CRYST1 145.891 145.891 158.756 90.00 90.00 90.00 1 ATOM 1 N MET 1 115.158 79.868 83.194 1.00 0.00 N ATOM 2 H1 MET 1 114.731 80.745 82.932 1.00 0.00 H ATOM 3 H2 MET 1 115.738 79.661 82.394 1.00 0.00 H ATOM 4 H3 MET 1 115.624 79.962 84.085 1.00 0.00 H ATOM 5 CA MET 1 114.161 78.848 83.220 1.00 0.00 C ATOM 6 HA MET 1 114.542 77.827 83.238 1.00 0.00 H ATOM 7 CB MET 1 113.386 78.921 84.594 1.00 0.00 C ATOM 8 HB2 MET 1 112.668 78.111 84.464 1.00 0.00 H ATOM 9 HB3 MET 1 114.077 78.612 85.378 1.00 0.00 H ATOM 10 CG MET 1 112.825 80.279 84.963 1.00 0.00 C ATOM 11 HG2 MET 1 112.552 80.224 86.017 1.00 0.00 H ATOM 12 HG3 MET 1 113.656 80.983 84.993 1.00 0.00 H ATOM 13 SD MET 1 111.506 80.943 83.894 1.00 0.00 S ATOM 14 CE MET 1 110.089 80.049 84.531 1.00 0.00 C ATOM 15 HE1 MET 1 109.987 80.415 85.552 1.00 0.00 H ATOM 16 HE2 MET 1 109.162 80.187 83.973 1.00 0.00 H ATOM 17 HE3 MET 1 110.200 78.975 84.678 1.00 0.00 H ATOM 18 C MET 1 113.176 79.031 81.987 1.00 0.00 C ATOM 19 O MET 1 113.380 80.012 81.195 1.00 0.00 O ATOM 20 N THR 2 112.054 78.262 81.834 1.00 0.00 N ATOM 21 H THR 2 111.987 77.356 82.277 1.00 0.00 H ATOM 22 CA THR 2 111.182 78.355 80.689 1.00 0.00 C ATOM 23 HA THR 2 111.190 79.375 80.305 1.00 0.00 H ATOM 24 CB THR 2 111.399 77.236 79.640 1.00 0.00 C ATOM 25 HB THR 2 111.448 76.251 80.104 1.00 0.00 H ATOM 26 CG2 THR 2 110.372 77.252 78.442 1.00 0.00 C ATOM 27 HG21 THR 2 109.390 76.951 78.807 1.00 0.00 H ATOM 28 HG22 THR 2 110.314 78.291 78.116 1.00 0.00 H ATOM 29 HG23 THR 2 110.762 76.611 77.651 1.00 0.00 H ATOM 30 OG1 THR 2 112.618 77.432 79.023 1.00 0.00 O ATOM 31 HG1 THR 2 113.249 76.910 79.524 1.00 0.00 H ATOM 32 C THR 2 109.715 78.292 81.213 1.00 0.00 C ATOM 33 O THR 2 109.341 77.291 81.810 1.00 0.00 O ATOM 34 N GLU 3 108.907 79.334 80.880 1.00 0.00 N ATOM 35 H GLU 3 109.426 80.128 80.531 1.00 0.00 H ATOM 36 CA GLU 3 107.486 79.397 81.253 1.00 0.00 C ATOM 37 HA GLU 3 107.299 79.265 82.319 1.00 0.00 H ATOM 38 CB GLU 3 106.992 80.836 81.032 1.00 0.00 C ATOM 39 HB2 GLU 3 107.735 81.568 81.349 1.00 0.00 H ATOM 40 HB3 GLU 3 106.961 80.843 79.943 1.00 0.00 H ATOM 41 CG GLU 3 105.626 81.125 81.535 1.00 0.00 C ATOM 42 HG2 GLU 3 105.380 82.078 81.066 1.00 0.00 H ATOM 43 HG3 GLU 3 104.940 80.346 81.203 1.00 0.00 H ATOM 44 CD GLU 3 105.508 81.237 83.038 1.00 0.00 C ATOM 45 OE1 GLU 3 104.999 80.255 83.586 1.00 0.00 O ATOM 46 OE2 GLU 3 105.662 82.314 83.633 1.00 0.00 O ATOM 47 C GLU 3 106.604 78.403 80.498 1.00 0.00 C ATOM 48 O GLU 3 106.588 78.289 79.256 1.00 0.00 O ATOM 49 N HID 4 105.736 77.713 81.241 1.00 0.00 N ATOM 50 H HID 4 105.668 77.940 82.223 1.00 0.00 H ATOM 51 CA HID 4 104.868 76.603 80.749 1.00 0.00 C ATOM 52 HA HID 4 105.401 76.206 79.884 1.00 0.00 H ATOM 53 CB HID 4 104.747 75.435 81.803 1.00 0.00 C ATOM 54 HB2 HID 4 104.437 75.902 82.737 1.00 0.00 H ATOM 55 HB3 HID 4 103.905 74.775 81.595 1.00 0.00 H ATOM 56 CG HID 4 106.027 74.693 82.022 1.00 0.00 C ATOM 57 ND1 HID 4 106.138 73.617 82.815 1.00 0.00 N ATOM 58 HD1 HID 4 105.388 73.175 83.327 1.00 0.00 H ATOM 59 CE1 HID 4 107.485 73.356 83.003 1.00 0.00 C ATOM 60 HE1 HID 4 107.887 72.615 83.679 1.00 0.00 H ATOM 61 NE2 HID 4 108.206 74.111 82.121 1.00 0.00 N ATOM 62 CD2 HID 4 107.296 74.965 81.501 1.00 0.00 C ATOM 63 HD2 HID 4 107.501 75.668 80.708 1.00 0.00 H ATOM 64 C HID 4 103.467 77.125 80.346 1.00 0.00 C ATOM 65 O HID 4 102.732 76.421 79.737 1.00 0.00 O ATOM 66 N ASN 5 103.140 78.396 80.665 1.00 0.00 N ATOM 67 H ASN 5 103.743 78.857 81.330 1.00 0.00 H ATOM 68 CA ASN 5 101.955 79.133 80.235 1.00 0.00 C ATOM 69 HA ASN 5 101.968 80.102 80.733 1.00 0.00 H ATOM 70 CB ASN 5 102.074 79.383 78.701 1.00 0.00 C ATOM 71 HB2 ASN 5 101.648 78.557 78.132 1.00 0.00 H ATOM 72 HB3 ASN 5 101.424 80.206 78.406 1.00 0.00 H ATOM 73 CG ASN 5 103.419 79.805 78.171 1.00 0.00 C ATOM 74 OD1 ASN 5 104.022 79.079 77.420 1.00 0.00 O ATOM 75 ND2 ASN 5 103.930 81.033 78.475 1.00 0.00 N ATOM 76 HD21 ASN 5 104.672 81.349 77.867 1.00 0.00 H ATOM 77 HD22 ASN 5 103.346 81.664 79.004 1.00 0.00 H ATOM 78 C ASN 5 100.530 78.652 80.673 1.00 0.00 C ATOM 79 O ASN 5 99.530 78.780 79.926 1.00 0.00 O ATOM 80 N GLU 6 100.512 78.224 81.953 1.00 0.00 N ATOM 81 H GLU 6 101.388 78.343 82.442 1.00 0.00 H ATOM 82 CA GLU 6 99.256 77.906 82.796 1.00 0.00 C ATOM 83 HA GLU 6 98.574 77.361 82.144 1.00 0.00 H ATOM 84 CB GLU 6 99.713 77.167 84.028 1.00 0.00 C ATOM 85 HB2 GLU 6 100.456 77.813 84.495 1.00 0.00 H ATOM 86 HB3 GLU 6 98.890 77.135 84.742 1.00 0.00 H ATOM 87 CG GLU 6 100.209 75.749 83.986 1.00 0.00 C ATOM 88 HG2 GLU 6 101.265 75.940 83.798 1.00 0.00 H ATOM 89 HG3 GLU 6 100.057 75.275 84.955 1.00 0.00 H ATOM 90 CD GLU 6 99.580 74.866 82.963 1.00 0.00 C ATOM 91 OE1 GLU 6 100.320 74.262 82.200 1.00 0.00 O ATOM 92 OE2 GLU 6 98.348 74.679 82.865 1.00 0.00 O ATOM 93 C GLU 6 98.511 79.177 83.195 1.00 0.00 C ATOM 94 O GLU 6 99.151 80.136 83.569 1.00 0.00 O ATOM 95 N ASP 7 97.195 79.275 83.116 1.00 0.00 N ATOM 96 H ASP 7 96.731 78.414 82.865 1.00 0.00 H ATOM 97 CA ASP 7 96.371 80.439 83.491 1.00 0.00 C ATOM 98 HA ASP 7 96.643 81.226 82.788 1.00 0.00 H ATOM 99 CB ASP 7 94.914 80.213 83.176 1.00 0.00 C ATOM 100 HB2 ASP 7 94.800 80.021 82.109 1.00 0.00 H ATOM 101 HB3 ASP 7 94.598 79.330 83.732 1.00 0.00 H ATOM 102 CG ASP 7 94.020 81.343 83.673 1.00 0.00 C ATOM 103 OD1 ASP 7 94.327 82.576 83.560 1.00 0.00 O ATOM 104 OD2 ASP 7 92.818 81.053 83.942 1.00 0.00 O ATOM 105 C ASP 7 96.583 80.877 84.915 1.00 0.00 C ATOM 106 O ASP 7 96.335 80.217 85.921 1.00 0.00 O ATOM 107 N PRO 8 97.225 82.076 85.094 1.00 0.00 N ATOM 108 CD PRO 8 97.559 83.016 84.041 1.00 0.00 C ATOM 109 HD2 PRO 8 96.675 83.380 83.516 1.00 0.00 H ATOM 110 HD3 PRO 8 98.175 82.434 83.356 1.00 0.00 H ATOM 111 CG PRO 8 98.146 84.233 84.817 1.00 0.00 C ATOM 112 HG2 PRO 8 97.302 84.849 85.128 1.00 0.00 H ATOM 113 HG3 PRO 8 98.917 84.797 84.292 1.00 0.00 H ATOM 114 CB PRO 8 98.808 83.494 85.944 1.00 0.00 C ATOM 115 HB2 PRO 8 99.114 84.113 86.788 1.00 0.00 H ATOM 116 HB3 PRO 8 99.642 82.854 85.656 1.00 0.00 H ATOM 117 CA PRO 8 97.745 82.507 86.341 1.00 0.00 C ATOM 118 HA PRO 8 98.289 81.765 86.926 1.00 0.00 H ATOM 119 C PRO 8 96.604 83.077 87.214 1.00 0.00 C ATOM 120 O PRO 8 95.611 83.679 86.738 1.00 0.00 O ATOM 121 N GLN 9 96.853 83.033 88.520 1.00 0.00 N ATOM 122 H GLN 9 97.640 82.534 88.909 1.00 0.00 H ATOM 123 CA GLN 9 95.954 83.766 89.440 1.00 0.00 C ATOM 124 HA GLN 9 94.951 83.907 89.036 1.00 0.00 H ATOM 125 CB GLN 9 95.824 83.100 90.906 1.00 0.00 C ATOM 126 HB2 GLN 9 95.531 82.068 90.714 1.00 0.00 H ATOM 127 HB3 GLN 9 96.802 83.133 91.386 1.00 0.00 H ATOM 128 CG GLN 9 94.814 83.749 91.882 1.00 0.00 C ATOM 129 HG2 GLN 9 94.914 83.493 92.937 1.00 0.00 H ATOM 130 HG3 GLN 9 95.000 84.815 91.753 1.00 0.00 H ATOM 131 CD GLN 9 93.410 83.463 91.550 1.00 0.00 C ATOM 132 OE1 GLN 9 93.169 82.654 90.657 1.00 0.00 O ATOM 133 NE2 GLN 9 92.520 84.015 92.268 1.00 0.00 N ATOM 134 HE21 GLN 9 91.552 83.828 92.047 1.00 0.00 H ATOM 135 HE22 GLN 9 92.759 84.540 93.097 1.00 0.00 H ATOM 136 C GLN 9 96.592 85.179 89.570 1.00 0.00 C ATOM 137 O GLN 9 97.789 85.311 89.734 1.00 0.00 O ATOM 138 N ILE 10 95.871 86.303 89.385 1.00 0.00 N ATOM 139 H ILE 10 94.864 86.240 89.334 1.00 0.00 H ATOM 140 CA ILE 10 96.388 87.706 89.216 1.00 0.00 C ATOM 141 HA ILE 10 97.101 87.735 88.392 1.00 0.00 H ATOM 142 CB ILE 10 95.299 88.776 88.842 1.00 0.00 C ATOM 143 HB ILE 10 94.621 88.791 89.695 1.00 0.00 H ATOM 144 CG2 ILE 10 95.864 90.205 88.649 1.00 0.00 C ATOM 145 HG21 ILE 10 96.839 90.044 88.190 1.00 0.00 H ATOM 146 HG22 ILE 10 95.213 90.693 87.923 1.00 0.00 H ATOM 147 HG23 ILE 10 95.861 90.784 89.572 1.00 0.00 H ATOM 148 CG1 ILE 10 94.620 88.267 87.552 1.00 0.00 C ATOM 149 HG12 ILE 10 94.159 87.329 87.860 1.00 0.00 H ATOM 150 HG13 ILE 10 93.811 88.895 87.180 1.00 0.00 H ATOM 151 CD1 ILE 10 95.555 88.015 86.405 1.00 0.00 C ATOM 152 HD11 ILE 10 96.514 88.459 86.672 1.00 0.00 H ATOM 153 HD12 ILE 10 95.655 86.953 86.181 1.00 0.00 H ATOM 154 HD13 ILE 10 95.102 88.418 85.499 1.00 0.00 H ATOM 155 C ILE 10 97.079 88.178 90.509 1.00 0.00 C ATOM 156 O ILE 10 98.271 88.542 90.512 1.00 0.00 O ATOM 157 N GLU 11 96.382 88.077 91.680 1.00 0.00 N ATOM 158 H GLU 11 95.571 87.477 91.633 1.00 0.00 H ATOM 159 CA GLU 11 96.889 88.710 92.882 1.00 0.00 C ATOM 160 HA GLU 11 97.976 88.702 92.963 1.00 0.00 H ATOM 161 CB GLU 11 96.386 90.172 92.900 1.00 0.00 C ATOM 162 HB2 GLU 11 96.730 90.621 91.969 1.00 0.00 H ATOM 163 HB3 GLU 11 95.296 90.169 92.885 1.00 0.00 H ATOM 164 CG GLU 11 96.921 90.942 94.131 1.00 0.00 C ATOM 165 HG2 GLU 11 96.628 91.992 94.155 1.00 0.00 H ATOM 166 HG3 GLU 11 96.436 90.623 95.054 1.00 0.00 H ATOM 167 CD GLU 11 98.454 90.860 94.257 1.00 0.00 C ATOM 168 OE1 GLU 11 98.986 89.945 94.988 1.00 0.00 O ATOM 169 OE2 GLU 11 99.125 91.671 93.626 1.00 0.00 O ATOM 170 C GLU 11 96.426 87.903 94.124 1.00 0.00 C ATOM 171 O GLU 11 95.247 87.412 94.082 1.00 0.00 O ATOM 172 N ARG 12 97.296 87.723 95.085 1.00 0.00 N ATOM 173 H ARG 12 98.150 88.261 95.104 1.00 0.00 H ATOM 174 CA ARG 12 97.149 86.906 96.323 1.00 0.00 C ATOM 175 HA ARG 12 96.410 86.121 96.159 1.00 0.00 H ATOM 176 CB ARG 12 98.543 86.258 96.638 1.00 0.00 C ATOM 177 HB2 ARG 12 99.304 87.023 96.789 1.00 0.00 H ATOM 178 HB3 ARG 12 98.545 85.689 97.568 1.00 0.00 H ATOM 179 CG ARG 12 99.074 85.282 95.514 1.00 0.00 C ATOM 180 HG2 ARG 12 98.365 84.494 95.259 1.00 0.00 H ATOM 181 HG3 ARG 12 99.176 85.799 94.560 1.00 0.00 H ATOM 182 CD ARG 12 100.397 84.562 95.864 1.00 0.00 C ATOM 183 HD2 ARG 12 100.287 84.430 96.941 1.00 0.00 H ATOM 184 HD3 ARG 12 100.350 83.556 95.446 1.00 0.00 H ATOM 185 NE ARG 12 101.521 85.319 95.530 1.00 0.00 N ATOM 186 HE ARG 12 101.271 86.185 95.076 1.00 0.00 H ATOM 187 CZ ARG 12 102.835 85.003 95.546 1.00 0.00 C ATOM 188 NH1 ARG 12 103.233 83.976 96.228 1.00 0.00 N ATOM 189 HH11 ARG 12 102.505 83.378 96.591 1.00 0.00 H ATOM 190 HH12 ARG 12 104.197 83.709 96.367 1.00 0.00 H ATOM 191 NH2 ARG 12 103.667 85.807 94.905 1.00 0.00 N ATOM 192 HH21 ARG 12 103.427 86.598 94.324 1.00 0.00 H ATOM 193 HH22 ARG 12 104.649 85.575 94.946 1.00 0.00 H ATOM 194 C ARG 12 96.577 87.597 97.562 1.00 0.00 C ATOM 195 O ARG 12 96.623 88.833 97.637 1.00 0.00 O ATOM 196 N VAL 13 96.005 86.852 98.460 1.00 0.00 N ATOM 197 H VAL 13 96.020 85.890 98.156 1.00 0.00 H ATOM 198 CA VAL 13 94.982 87.270 99.494 1.00 0.00 C ATOM 199 HA VAL 13 95.118 88.320 99.751 1.00 0.00 H ATOM 200 CB VAL 13 93.506 87.062 98.911 1.00 0.00 C ATOM 201 HB VAL 13 92.798 87.120 99.738 1.00 0.00 H ATOM 202 CG1 VAL 13 93.292 88.203 97.871 1.00 0.00 C ATOM 203 HG11 VAL 13 93.984 88.042 97.044 1.00 0.00 H ATOM 204 HG12 VAL 13 92.267 88.164 97.503 1.00 0.00 H ATOM 205 HG13 VAL 13 93.307 89.143 98.422 1.00 0.00 H ATOM 206 CG2 VAL 13 93.245 85.661 98.313 1.00 0.00 C ATOM 207 HG21 VAL 13 93.450 84.863 99.028 1.00 0.00 H ATOM 208 HG22 VAL 13 92.169 85.659 98.143 1.00 0.00 H ATOM 209 HG23 VAL 13 93.873 85.782 97.431 1.00 0.00 H ATOM 210 C VAL 13 95.175 86.461 100.818 1.00 0.00 C ATOM 211 O VAL 13 95.531 85.272 100.821 1.00 0.00 O ATOM 212 N ALA 14 95.174 87.096 101.982 1.00 0.00 N ATOM 213 H ALA 14 94.855 88.051 102.064 1.00 0.00 H ATOM 214 CA ALA 14 94.943 86.366 103.327 1.00 0.00 C ATOM 215 HA ALA 14 95.651 85.564 103.534 1.00 0.00 H ATOM 216 CB ALA 14 95.233 87.366 104.411 1.00 0.00 C ATOM 217 HB1 ALA 14 94.562 88.224 104.358 1.00 0.00 H ATOM 218 HB2 ALA 14 95.191 86.858 105.374 1.00 0.00 H ATOM 219 HB3 ALA 14 96.196 87.844 104.231 1.00 0.00 H ATOM 220 C ALA 14 93.524 85.751 103.469 1.00 0.00 C ATOM 221 O ALA 14 92.554 86.244 102.874 1.00 0.00 O ATOM 222 N ASP 15 93.444 84.637 104.082 1.00 0.00 N ATOM 223 H ASP 15 94.294 84.252 104.470 1.00 0.00 H ATOM 224 CA ASP 15 92.260 83.795 104.338 1.00 0.00 C ATOM 225 HA ASP 15 91.427 84.495 104.269 1.00 0.00 H ATOM 226 CB ASP 15 92.013 82.688 103.301 1.00 0.00 C ATOM 227 HB2 ASP 15 92.023 83.236 102.359 1.00 0.00 H ATOM 228 HB3 ASP 15 92.815 81.952 103.259 1.00 0.00 H ATOM 229 CG ASP 15 90.671 81.972 103.530 1.00 0.00 C ATOM 230 OD1 ASP 15 89.678 82.639 103.782 1.00 0.00 O ATOM 231 OD2 ASP 15 90.478 80.842 103.052 1.00 0.00 O ATOM 232 C ASP 15 92.261 83.246 105.832 1.00 0.00 C ATOM 233 O ASP 15 91.862 82.089 106.094 1.00 0.00 O ATOM 234 N ASP 16 92.715 84.153 106.751 1.00 0.00 N ATOM 235 H ASP 16 92.897 85.074 106.377 1.00 0.00 H ATOM 236 CA ASP 16 92.750 83.865 108.154 1.00 0.00 C ATOM 237 HA ASP 16 93.411 83.002 108.244 1.00 0.00 H ATOM 238 CB ASP 16 93.519 84.995 108.808 1.00 0.00 C ATOM 239 HB2 ASP 16 93.218 85.920 108.316 1.00 0.00 H ATOM 240 HB3 ASP 16 93.359 84.998 109.886 1.00 0.00 H ATOM 241 CG ASP 16 95.059 84.995 108.685 1.00 0.00 C ATOM 242 OD1 ASP 16 95.669 84.126 107.988 1.00 0.00 O ATOM 243 OD2 ASP 16 95.729 85.924 109.158 1.00 0.00 O ATOM 244 C ASP 16 91.331 83.772 108.758 1.00 0.00 C ATOM 245 O ASP 16 90.487 84.668 108.532 1.00 0.00 O ATOM 246 N ALA 17 90.894 82.771 109.515 1.00 0.00 N ATOM 247 H ALA 17 91.615 82.087 109.693 1.00 0.00 H ATOM 248 CA ALA 17 89.556 82.556 110.026 1.00 0.00 C ATOM 249 HA ALA 17 88.783 82.720 109.276 1.00 0.00 H ATOM 250 CB ALA 17 89.505 81.134 110.487 1.00 0.00 C ATOM 251 HB1 ALA 17 89.618 80.395 109.693 1.00 0.00 H ATOM 252 HB2 ALA 17 90.252 80.949 111.259 1.00 0.00 H ATOM 253 HB3 ALA 17 88.499 80.915 110.844 1.00 0.00 H ATOM 254 C ALA 17 89.372 83.592 111.241 1.00 0.00 C ATOM 255 O ALA 17 90.193 83.661 112.198 1.00 0.00 O ATOM 256 N ALA 18 88.350 84.445 111.179 1.00 0.00 N ATOM 257 H ALA 18 87.849 84.481 110.303 1.00 0.00 H ATOM 258 CA ALA 18 87.823 85.329 112.250 1.00 0.00 C ATOM 259 HA ALA 18 88.713 85.706 112.754 1.00 0.00 H ATOM 260 CB ALA 18 87.242 86.600 111.611 1.00 0.00 C ATOM 261 HB1 ALA 18 86.347 86.273 111.081 1.00 0.00 H ATOM 262 HB2 ALA 18 87.100 87.377 112.361 1.00 0.00 H ATOM 263 HB3 ALA 18 87.824 87.012 110.787 1.00 0.00 H ATOM 264 C ALA 18 86.919 84.712 113.278 1.00 0.00 C ATOM 265 O ALA 18 86.090 83.842 112.959 1.00 0.00 O ATOM 266 N ASP 19 87.135 85.097 114.549 1.00 0.00 N ATOM 267 H ASP 19 87.978 85.618 114.746 1.00 0.00 H ATOM 268 CA ASP 19 86.260 84.732 115.664 1.00 0.00 C ATOM 269 HA ASP 19 86.071 83.665 115.785 1.00 0.00 H ATOM 270 CB ASP 19 86.813 85.121 117.063 1.00 0.00 C ATOM 271 HB2 ASP 19 87.797 84.665 117.172 1.00 0.00 H ATOM 272 HB3 ASP 19 86.870 86.209 117.022 1.00 0.00 H ATOM 273 CG ASP 19 85.986 84.706 118.340 1.00 0.00 C ATOM 274 OD1 ASP 19 86.312 85.328 119.341 1.00 0.00 O ATOM 275 OD2 ASP 19 85.257 83.686 118.406 1.00 0.00 O ATOM 276 C ASP 19 84.801 85.313 115.511 1.00 0.00 C ATOM 277 O ASP 19 83.852 84.917 116.212 1.00 0.00 O ATOM 278 N GLU 20 84.607 86.200 114.521 1.00 0.00 N ATOM 279 H GLU 20 85.404 86.431 113.946 1.00 0.00 H ATOM 280 CA GLU 20 83.325 86.849 114.207 1.00 0.00 C ATOM 281 HA GLU 20 83.065 87.659 114.889 1.00 0.00 H ATOM 282 CB GLU 20 83.446 87.485 112.755 1.00 0.00 C ATOM 283 HB2 GLU 20 83.967 86.912 111.988 1.00 0.00 H ATOM 284 HB3 GLU 20 82.448 87.749 112.406 1.00 0.00 H ATOM 285 CG GLU 20 84.145 88.859 112.706 1.00 0.00 C ATOM 286 HG2 GLU 20 85.211 88.729 112.897 1.00 0.00 H ATOM 287 HG3 GLU 20 84.102 89.308 111.714 1.00 0.00 H ATOM 288 CD GLU 20 83.518 89.830 113.705 1.00 0.00 C ATOM 289 OE1 GLU 20 84.241 90.203 114.673 1.00 0.00 O ATOM 290 OE2 GLU 20 82.410 90.351 113.442 1.00 0.00 O ATOM 291 C GLU 20 82.150 85.827 114.202 1.00 0.00 C ATOM 292 O GLU 20 82.269 84.744 113.610 1.00 0.00 O ATOM 293 N GLU 21 80.948 86.222 114.603 1.00 0.00 N ATOM 294 H GLU 21 80.841 87.171 114.930 1.00 0.00 H ATOM 295 CA GLU 21 79.667 85.560 114.562 1.00 0.00 C ATOM 296 HA GLU 21 79.952 84.510 114.626 1.00 0.00 H ATOM 297 CB GLU 21 78.831 85.901 115.716 1.00 0.00 C ATOM 298 HB2 GLU 21 78.639 86.973 115.754 1.00 0.00 H ATOM 299 HB3 GLU 21 77.850 85.460 115.540 1.00 0.00 H ATOM 300 CG GLU 21 79.315 85.565 117.185 1.00 0.00 C ATOM 301 HG2 GLU 21 80.106 86.286 117.394 1.00 0.00 H ATOM 302 HG3 GLU 21 78.591 86.035 117.850 1.00 0.00 H ATOM 303 CD GLU 21 79.740 84.146 117.578 1.00 0.00 C ATOM 304 OE1 GLU 21 80.565 83.911 118.428 1.00 0.00 O ATOM 305 OE2 GLU 21 79.292 83.206 116.950 1.00 0.00 O ATOM 306 C GLU 21 79.004 85.768 113.200 1.00 0.00 C ATOM 307 O GLU 21 78.826 86.865 112.664 1.00 0.00 O ATOM 308 N ALA 22 78.451 84.636 112.668 1.00 0.00 N ATOM 309 H ALA 22 78.764 83.772 113.085 1.00 0.00 H ATOM 310 CA ALA 22 77.506 84.617 111.575 1.00 0.00 C ATOM 311 HA ALA 22 77.817 85.489 110.999 1.00 0.00 H ATOM 312 CB ALA 22 77.691 83.433 110.633 1.00 0.00 C ATOM 313 HB1 ALA 22 78.714 83.578 110.287 1.00 0.00 H ATOM 314 HB2 ALA 22 77.646 82.614 111.351 1.00 0.00 H ATOM 315 HB3 ALA 22 77.126 83.417 109.702 1.00 0.00 H ATOM 316 C ALA 22 76.107 84.721 112.054 1.00 0.00 C ATOM 317 O ALA 22 75.721 84.196 113.100 1.00 0.00 O ATOM 318 N VAL 23 75.193 85.362 111.334 1.00 0.00 N ATOM 319 H VAL 23 75.522 85.754 110.463 1.00 0.00 H ATOM 320 CA VAL 23 73.746 85.331 111.598 1.00 0.00 C ATOM 321 HA VAL 23 73.520 85.103 112.639 1.00 0.00 H ATOM 322 CB VAL 23 73.150 86.768 111.405 1.00 0.00 C ATOM 323 HB VAL 23 73.275 86.973 110.341 1.00 0.00 H ATOM 324 CG1 VAL 23 71.625 86.800 111.781 1.00 0.00 C ATOM 325 HG11 VAL 23 71.202 87.777 111.547 1.00 0.00 H ATOM 326 HG12 VAL 23 71.040 86.043 111.258 1.00 0.00 H ATOM 327 HG13 VAL 23 71.450 86.533 112.823 1.00 0.00 H ATOM 328 CG2 VAL 23 73.813 87.818 112.306 1.00 0.00 C ATOM 329 HG21 VAL 23 73.400 88.779 111.999 1.00 0.00 H ATOM 330 HG22 VAL 23 73.434 87.592 113.303 1.00 0.00 H ATOM 331 HG23 VAL 23 74.890 87.800 112.468 1.00 0.00 H ATOM 332 C VAL 23 73.074 84.335 110.651 1.00 0.00 C ATOM 333 O VAL 23 73.580 84.010 109.610 1.00 0.00 O ATOM 334 N THR 24 72.016 83.712 111.102 1.00 0.00 N ATOM 335 H THR 24 71.705 83.976 112.026 1.00 0.00 H ATOM 336 CA THR 24 71.118 82.871 110.209 1.00 0.00 C ATOM 337 HA THR 24 71.735 82.206 109.604 1.00 0.00 H ATOM 338 CB THR 24 70.157 81.992 111.060 1.00 0.00 C ATOM 339 HB THR 24 69.296 82.558 111.417 1.00 0.00 H ATOM 340 CG2 THR 24 69.555 80.868 110.175 1.00 0.00 C ATOM 341 HG21 THR 24 68.860 81.291 109.449 1.00 0.00 H ATOM 342 HG22 THR 24 70.401 80.364 109.707 1.00 0.00 H ATOM 343 HG23 THR 24 69.123 80.184 110.906 1.00 0.00 H ATOM 344 OG1 THR 24 70.806 81.340 112.116 1.00 0.00 O ATOM 345 HG1 THR 24 71.107 82.034 112.708 1.00 0.00 H ATOM 346 C THR 24 70.358 83.680 109.121 1.00 0.00 C ATOM 347 O THR 24 69.976 84.860 109.356 1.00 0.00 O ATOM 348 N GLU 25 70.097 83.141 107.989 1.00 0.00 N ATOM 349 H GLU 25 70.278 82.158 107.842 1.00 0.00 H ATOM 350 CA GLU 25 69.552 83.866 106.781 1.00 0.00 C ATOM 351 HA GLU 25 70.083 84.774 106.497 1.00 0.00 H ATOM 352 CB GLU 25 69.569 83.010 105.495 1.00 0.00 C ATOM 353 HB2 GLU 25 69.056 82.055 105.604 1.00 0.00 H ATOM 354 HB3 GLU 25 69.092 83.548 104.676 1.00 0.00 H ATOM 355 CG GLU 25 70.980 82.711 105.015 1.00 0.00 C ATOM 356 HG2 GLU 25 71.477 83.641 104.742 1.00 0.00 H ATOM 357 HG3 GLU 25 71.494 82.106 105.762 1.00 0.00 H ATOM 358 CD GLU 25 70.948 81.819 103.743 1.00 0.00 C ATOM 359 OE1 GLU 25 71.874 81.899 102.919 1.00 0.00 O ATOM 360 OE2 GLU 25 70.149 80.859 103.642 1.00 0.00 O ATOM 361 C GLU 25 68.054 84.365 107.106 1.00 0.00 C ATOM 362 O GLU 25 67.340 83.662 107.801 1.00 0.00 O ATOM 363 N PRO 26 67.597 85.503 106.530 1.00 0.00 N ATOM 364 CD PRO 26 68.424 86.483 105.867 1.00 0.00 C ATOM 365 HD2 PRO 26 69.184 86.134 105.168 1.00 0.00 H ATOM 366 HD3 PRO 26 68.786 87.106 106.684 1.00 0.00 H ATOM 367 CG PRO 26 67.481 87.371 105.063 1.00 0.00 C ATOM 368 HG2 PRO 26 67.334 87.050 104.032 1.00 0.00 H ATOM 369 HG3 PRO 26 67.980 88.340 105.059 1.00 0.00 H ATOM 370 CB PRO 26 66.238 87.403 105.899 1.00 0.00 C ATOM 371 HB2 PRO 26 65.358 87.708 105.331 1.00 0.00 H ATOM 372 HB3 PRO 26 66.412 88.059 106.752 1.00 0.00 H ATOM 373 CA PRO 26 66.175 85.868 106.473 1.00 0.00 C ATOM 374 HA PRO 26 65.875 85.944 107.518 1.00 0.00 H ATOM 375 C PRO 26 65.272 84.931 105.609 1.00 0.00 C ATOM 376 O PRO 26 65.719 84.006 104.909 1.00 0.00 O ATOM 377 N LEU 27 63.926 85.182 105.614 1.00 0.00 N ATOM 378 H LEU 27 63.587 85.913 106.223 1.00 0.00 H ATOM 379 CA LEU 27 62.936 84.434 104.672 1.00 0.00 C ATOM 380 HA LEU 27 63.268 83.413 104.485 1.00 0.00 H ATOM 381 CB LEU 27 61.568 84.490 105.343 1.00 0.00 C ATOM 382 HB2 LEU 27 61.274 85.532 105.472 1.00 0.00 H ATOM 383 HB3 LEU 27 60.910 83.931 104.678 1.00 0.00 H ATOM 384 CG LEU 27 61.567 83.647 106.673 1.00 0.00 C ATOM 385 HG LEU 27 62.375 83.794 107.389 1.00 0.00 H ATOM 386 CD1 LEU 27 60.323 83.887 107.500 1.00 0.00 C ATOM 387 HD11 LEU 27 60.177 84.926 107.796 1.00 0.00 H ATOM 388 HD12 LEU 27 59.524 83.441 106.908 1.00 0.00 H ATOM 389 HD13 LEU 27 60.329 83.328 108.436 1.00 0.00 H ATOM 390 CD2 LEU 27 61.619 82.148 106.315 1.00 0.00 C ATOM 391 HD21 LEU 27 62.539 82.028 105.742 1.00 0.00 H ATOM 392 HD22 LEU 27 61.602 81.588 107.250 1.00 0.00 H ATOM 393 HD23 LEU 27 60.726 81.919 105.735 1.00 0.00 H ATOM 394 C LEU 27 62.901 84.909 103.233 1.00 0.00 C ATOM 395 O LEU 27 62.336 84.223 102.359 1.00 0.00 O ATOM 396 N ALA 28 63.460 86.095 102.952 1.00 0.00 N ATOM 397 H ALA 28 63.801 86.669 103.710 1.00 0.00 H ATOM 398 CA ALA 28 63.415 86.713 101.672 1.00 0.00 C ATOM 399 HA ALA 28 62.435 87.082 101.373 1.00 0.00 H ATOM 400 CB ALA 28 64.290 87.975 101.814 1.00 0.00 C ATOM 401 HB1 ALA 28 63.955 88.589 102.650 1.00 0.00 H ATOM 402 HB2 ALA 28 65.351 87.793 101.989 1.00 0.00 H ATOM 403 HB3 ALA 28 64.182 88.624 100.945 1.00 0.00 H ATOM 404 C ALA 28 63.945 85.719 100.568 1.00 0.00 C ATOM 405 O ALA 28 63.266 85.485 99.556 1.00 0.00 O ATOM 406 N THR 29 65.103 85.109 100.762 1.00 0.00 N ATOM 407 H THR 29 65.605 85.195 101.634 1.00 0.00 H ATOM 408 CA THR 29 65.728 84.271 99.763 1.00 0.00 C ATOM 409 HA THR 29 66.777 84.051 99.961 1.00 0.00 H ATOM 410 CB THR 29 64.997 82.926 99.573 1.00 0.00 C ATOM 411 HB THR 29 63.947 83.104 99.343 1.00 0.00 H ATOM 412 CG2 THR 29 65.655 81.812 98.708 1.00 0.00 C ATOM 413 HG21 THR 29 65.628 82.109 97.659 1.00 0.00 H ATOM 414 HG22 THR 29 66.623 81.583 99.153 1.00 0.00 H ATOM 415 HG23 THR 29 65.086 80.884 98.775 1.00 0.00 H ATOM 416 OG1 THR 29 65.060 82.457 100.898 1.00 0.00 O ATOM 417 HG1 THR 29 64.649 83.144 101.428 1.00 0.00 H ATOM 418 C THR 29 65.870 85.028 98.425 1.00 0.00 C ATOM 419 O THR 29 65.569 84.595 97.319 1.00 0.00 O ATOM 420 N GLU 30 66.281 86.263 98.604 1.00 0.00 N ATOM 421 H GLU 30 66.670 86.407 99.525 1.00 0.00 H ATOM 422 CA GLU 30 66.575 87.311 97.561 1.00 0.00 C ATOM 423 HA GLU 30 66.326 86.908 96.580 1.00 0.00 H ATOM 424 CB GLU 30 65.787 88.625 97.903 1.00 0.00 C ATOM 425 HB2 GLU 30 66.156 88.929 98.882 1.00 0.00 H ATOM 426 HB3 GLU 30 66.048 89.403 97.186 1.00 0.00 H ATOM 427 CG GLU 30 64.270 88.582 98.004 1.00 0.00 C ATOM 428 HG2 GLU 30 63.932 87.791 98.673 1.00 0.00 H ATOM 429 HG3 GLU 30 63.881 89.545 98.333 1.00 0.00 H ATOM 430 CD GLU 30 63.609 88.197 96.635 1.00 0.00 C ATOM 431 OE1 GLU 30 64.202 88.006 95.506 1.00 0.00 O ATOM 432 OE2 GLU 30 62.358 88.029 96.652 1.00 0.00 O ATOM 433 C GLU 30 68.025 87.741 97.339 1.00 0.00 C ATOM 434 O GLU 30 68.369 88.276 96.314 1.00 0.00 O ATOM 435 N SER 31 68.940 87.488 98.305 1.00 0.00 N ATOM 436 H SER 31 68.605 87.050 99.151 1.00 0.00 H ATOM 437 CA SER 31 70.448 87.670 98.229 1.00 0.00 C ATOM 438 HA SER 31 70.548 88.703 97.896 1.00 0.00 H ATOM 439 CB SER 31 70.956 87.521 99.685 1.00 0.00 C ATOM 440 HB2 SER 31 70.367 88.239 100.255 1.00 0.00 H ATOM 441 HB3 SER 31 70.716 86.499 99.979 1.00 0.00 H ATOM 442 OG SER 31 72.331 87.786 99.884 1.00 0.00 O ATOM 443 HG SER 31 72.316 88.675 100.246 1.00 0.00 H ATOM 444 C SER 31 71.165 86.728 97.267 1.00 0.00 C ATOM 445 O SER 31 70.949 85.481 97.177 1.00 0.00 O ATOM 446 N LYS 32 72.055 87.394 96.566 1.00 0.00 N ATOM 447 H LYS 32 72.015 88.402 96.527 1.00 0.00 H ATOM 448 CA LYS 32 73.109 86.854 95.753 1.00 0.00 C ATOM 449 HA LYS 32 73.552 86.111 96.415 1.00 0.00 H ATOM 450 CB LYS 32 72.560 86.158 94.481 1.00 0.00 C ATOM 451 HB2 LYS 32 73.330 85.777 93.810 1.00 0.00 H ATOM 452 HB3 LYS 32 71.940 85.312 94.776 1.00 0.00 H ATOM 453 CG LYS 32 71.656 87.076 93.587 1.00 0.00 C ATOM 454 HG2 LYS 32 70.810 87.431 94.176 1.00 0.00 H ATOM 455 HG3 LYS 32 72.201 87.871 93.079 1.00 0.00 H ATOM 456 CD LYS 32 71.036 86.290 92.451 1.00 0.00 C ATOM 457 HD2 LYS 32 70.562 85.394 92.853 1.00 0.00 H ATOM 458 HD3 LYS 32 70.256 86.869 91.958 1.00 0.00 H ATOM 459 CE LYS 32 72.034 85.795 91.354 1.00 0.00 C ATOM 460 HE2 LYS 32 72.780 85.251 91.933 1.00 0.00 H ATOM 461 HE3 LYS 32 71.558 85.163 90.603 1.00 0.00 H ATOM 462 NZ LYS 32 72.774 86.941 90.743 1.00 0.00 N ATOM 463 HZ1 LYS 32 73.464 86.630 90.074 1.00 0.00 H ATOM 464 HZ2 LYS 32 72.136 87.643 90.397 1.00 0.00 H ATOM 465 HZ3 LYS 32 73.337 87.431 91.423 1.00 0.00 H ATOM 466 C LYS 32 74.042 88.018 95.338 1.00 0.00 C ATOM 467 O LYS 32 73.631 89.154 95.205 1.00 0.00 O ATOM 468 N ASP 33 75.216 87.658 94.985 1.00 0.00 N ATOM 469 H ASP 33 75.528 86.786 95.388 1.00 0.00 H ATOM 470 CA ASP 33 76.134 88.417 94.108 1.00 0.00 C ATOM 471 HA ASP 33 76.211 89.449 94.449 1.00 0.00 H ATOM 472 CB ASP 33 77.586 87.773 94.085 1.00 0.00 C ATOM 473 HB2 ASP 33 77.660 86.877 93.469 1.00 0.00 H ATOM 474 HB3 ASP 33 78.274 88.463 93.596 1.00 0.00 H ATOM 475 CG ASP 33 78.258 87.561 95.433 1.00 0.00 C ATOM 476 OD1 ASP 33 79.364 86.927 95.424 1.00 0.00 O ATOM 477 OD2 ASP 33 77.771 88.100 96.456 1.00 0.00 O ATOM 478 C ASP 33 75.739 88.480 92.662 1.00 0.00 C ATOM 479 O ASP 33 74.873 87.672 92.246 1.00 0.00 O ATOM 480 N GLU 34 76.317 89.334 91.812 1.00 0.00 N ATOM 481 H GLU 34 76.916 90.096 92.098 1.00 0.00 H ATOM 482 CA GLU 34 76.270 89.047 90.323 1.00 0.00 C ATOM 483 HA GLU 34 76.164 87.964 90.247 1.00 0.00 H ATOM 484 CB GLU 34 75.086 89.682 89.603 1.00 0.00 C ATOM 485 HB2 GLU 34 74.189 89.332 90.113 1.00 0.00 H ATOM 486 HB3 GLU 34 75.120 90.767 89.709 1.00 0.00 H ATOM 487 CG GLU 34 74.996 89.365 88.075 1.00 0.00 C ATOM 488 HG2 GLU 34 74.274 90.047 87.626 1.00 0.00 H ATOM 489 HG3 GLU 34 75.998 89.488 87.663 1.00 0.00 H ATOM 490 CD GLU 34 74.542 87.936 87.755 1.00 0.00 C ATOM 491 OE1 GLU 34 73.971 87.665 86.656 1.00 0.00 O ATOM 492 OE2 GLU 34 74.615 87.029 88.606 1.00 0.00 O ATOM 493 C GLU 34 77.729 89.389 89.814 1.00 0.00 C ATOM 494 O GLU 34 78.352 90.304 90.410 1.00 0.00 O ATOM 495 N PRO 35 78.382 88.843 88.774 1.00 0.00 N ATOM 496 CD PRO 35 78.033 87.549 88.170 1.00 0.00 C ATOM 497 HD2 PRO 35 77.177 87.633 87.500 1.00 0.00 H ATOM 498 HD3 PRO 35 77.778 86.777 88.895 1.00 0.00 H ATOM 499 CG PRO 35 79.403 87.205 87.529 1.00 0.00 C ATOM 500 HG2 PRO 35 79.312 86.543 86.668 1.00 0.00 H ATOM 501 HG3 PRO 35 80.012 86.664 88.254 1.00 0.00 H ATOM 502 CB PRO 35 80.122 88.499 87.215 1.00 0.00 C ATOM 503 HB2 PRO 35 79.749 88.890 86.268 1.00 0.00 H ATOM 504 HB3 PRO 35 81.209 88.510 87.137 1.00 0.00 H ATOM 505 CA PRO 35 79.707 89.411 88.313 1.00 0.00 C ATOM 506 HA PRO 35 80.419 89.345 89.136 1.00 0.00 H ATOM 507 C PRO 35 79.790 90.867 87.776 1.00 0.00 C ATOM 508 O PRO 35 78.819 91.356 87.222 1.00 0.00 O ATOM 509 N ALA 36 81.002 91.510 87.896 1.00 0.00 N ATOM 510 H ALA 36 81.775 91.078 88.380 1.00 0.00 H ATOM 511 CA ALA 36 81.173 92.758 87.090 1.00 0.00 C ATOM 512 HA ALA 36 80.253 93.337 87.165 1.00 0.00 H ATOM 513 CB ALA 36 82.349 93.599 87.743 1.00 0.00 C ATOM 514 HB1 ALA 36 81.975 93.912 88.718 1.00 0.00 H ATOM 515 HB2 ALA 36 83.376 93.238 87.796 1.00 0.00 H ATOM 516 HB3 ALA 36 82.362 94.585 87.281 1.00 0.00 H ATOM 517 C ALA 36 81.281 92.600 85.549 1.00 0.00 C ATOM 518 O ALA 36 81.766 91.556 85.029 1.00 0.00 O ATOM 519 N GLU 37 80.826 93.508 84.859 1.00 0.00 N ATOM 520 H GLU 37 80.434 94.333 85.290 1.00 0.00 H ATOM 521 CA GLU 37 80.637 93.534 83.385 1.00 0.00 C ATOM 522 HA GLU 37 79.705 94.081 83.241 1.00 0.00 H ATOM 523 CB GLU 37 81.847 94.237 82.721 1.00 0.00 C ATOM 524 HB2 GLU 37 82.750 93.648 82.884 1.00 0.00 H ATOM 525 HB3 GLU 37 81.686 94.187 81.644 1.00 0.00 H ATOM 526 CG GLU 37 82.163 95.717 83.193 1.00 0.00 C ATOM 527 HG2 GLU 37 82.584 95.603 84.192 1.00 0.00 H ATOM 528 HG3 GLU 37 82.997 96.031 82.566 1.00 0.00 H ATOM 529 CD GLU 37 80.905 96.606 83.095 1.00 0.00 C ATOM 530 OE1 GLU 37 79.928 96.282 82.360 1.00 0.00 O ATOM 531 OE2 GLU 37 80.924 97.641 83.802 1.00 0.00 O ATOM 532 C GLU 37 80.361 92.197 82.771 1.00 0.00 C ATOM 533 O GLU 37 81.071 91.713 81.881 1.00 0.00 O ATOM 534 N HID 38 79.332 91.533 83.321 1.00 0.00 N ATOM 535 H HID 38 78.756 91.940 84.045 1.00 0.00 H ATOM 536 CA HID 38 78.990 90.230 82.819 1.00 0.00 C ATOM 537 HA HID 38 79.869 89.588 82.775 1.00 0.00 H ATOM 538 CB HID 38 77.902 89.664 83.745 1.00 0.00 C ATOM 539 HB2 HID 38 78.116 89.962 84.772 1.00 0.00 H ATOM 540 HB3 HID 38 77.001 90.270 83.654 1.00 0.00 H ATOM 541 CG HID 38 77.682 88.233 83.745 1.00 0.00 C ATOM 542 ND1 HID 38 78.587 87.149 83.953 1.00 0.00 N ATOM 543 HD1 HID 38 79.528 87.239 84.309 1.00 0.00 H ATOM 544 CE1 HID 38 77.992 86.007 83.756 1.00 0.00 C ATOM 545 HE1 HID 38 78.477 85.044 83.823 1.00 0.00 H ATOM 546 NE2 HID 38 76.724 86.153 83.532 1.00 0.00 N ATOM 547 CD2 HID 38 76.462 87.551 83.486 1.00 0.00 C ATOM 548 HD2 HID 38 75.510 88.041 83.349 1.00 0.00 H ATOM 549 C HID 38 78.593 90.264 81.339 1.00 0.00 C ATOM 550 O HID 38 78.626 89.162 80.747 1.00 0.00 O ATOM 551 N PRO 39 78.195 91.358 80.669 1.00 0.00 N ATOM 552 CD PRO 39 77.251 92.305 81.257 1.00 0.00 C ATOM 553 HD2 PRO 39 77.705 93.085 81.869 1.00 0.00 H ATOM 554 HD3 PRO 39 76.578 91.807 81.955 1.00 0.00 H ATOM 555 CG PRO 39 76.434 92.918 80.052 1.00 0.00 C ATOM 556 HG2 PRO 39 76.188 93.974 80.161 1.00 0.00 H ATOM 557 HG3 PRO 39 75.528 92.327 79.921 1.00 0.00 H ATOM 558 CB PRO 39 77.307 92.585 78.875 1.00 0.00 C ATOM 559 HB2 PRO 39 78.111 93.307 78.734 1.00 0.00 H ATOM 560 HB3 PRO 39 76.796 92.484 77.918 1.00 0.00 H ATOM 561 CA PRO 39 78.117 91.360 79.230 1.00 0.00 C ATOM 562 HA PRO 39 77.615 90.470 78.849 1.00 0.00 H ATOM 563 C PRO 39 79.498 91.372 78.467 1.00 0.00 C ATOM 564 O PRO 39 79.510 91.031 77.325 1.00 0.00 O ATOM 565 N GLU 40 80.635 91.600 79.126 1.00 0.00 N ATOM 566 H GLU 40 80.691 91.840 80.106 1.00 0.00 H ATOM 567 CA GLU 40 81.978 91.502 78.507 1.00 0.00 C ATOM 568 HA GLU 40 81.731 91.568 77.448 1.00 0.00 H ATOM 569 CB GLU 40 82.940 92.594 79.016 1.00 0.00 C ATOM 570 HB2 GLU 40 83.204 92.399 80.056 1.00 0.00 H ATOM 571 HB3 GLU 40 83.918 92.518 78.542 1.00 0.00 H ATOM 572 CG GLU 40 82.309 93.961 78.976 1.00 0.00 C ATOM 573 HG2 GLU 40 81.506 94.074 79.704 1.00 0.00 H ATOM 574 HG3 GLU 40 83.066 94.676 79.300 1.00 0.00 H ATOM 575 CD GLU 40 81.743 94.374 77.585 1.00 0.00 C ATOM 576 OE1 GLU 40 82.415 94.235 76.569 1.00 0.00 O ATOM 577 OE2 GLU 40 80.653 94.933 77.551 1.00 0.00 O ATOM 578 C GLU 40 82.552 90.000 78.673 1.00 0.00 C ATOM 579 O GLU 40 83.711 89.832 78.346 1.00 0.00 O ATOM 580 N PHE 41 81.706 89.089 79.173 1.00 0.00 N ATOM 581 H PHE 41 80.783 89.467 79.338 1.00 0.00 H ATOM 582 CA PHE 41 81.975 87.667 79.268 1.00 0.00 C ATOM 583 HA PHE 41 82.940 87.437 79.720 1.00 0.00 H ATOM 584 CB PHE 41 80.971 86.955 80.275 1.00 0.00 C ATOM 585 HB2 PHE 41 81.131 87.318 81.290 1.00 0.00 H ATOM 586 HB3 PHE 41 79.947 87.270 80.075 1.00 0.00 H ATOM 587 CG PHE 41 81.155 85.416 80.377 1.00 0.00 C ATOM 588 CD1 PHE 41 80.098 84.565 80.055 1.00 0.00 C ATOM 589 HD1 PHE 41 79.090 84.915 79.885 1.00 0.00 H ATOM 590 CE1 PHE 41 80.218 83.178 80.017 1.00 0.00 C ATOM 591 HE1 PHE 41 79.482 82.435 79.749 1.00 0.00 H ATOM 592 CZ PHE 41 81.481 82.638 80.305 1.00 0.00 C ATOM 593 HZ PHE 41 81.590 81.565 80.245 1.00 0.00 H ATOM 594 CE2 PHE 41 82.548 83.447 80.769 1.00 0.00 C ATOM 595 HE2 PHE 41 83.489 82.994 81.044 1.00 0.00 H ATOM 596 CD2 PHE 41 82.407 84.877 80.752 1.00 0.00 C ATOM 597 HD2 PHE 41 83.178 85.468 81.224 1.00 0.00 H ATOM 598 C PHE 41 81.895 87.012 77.872 1.00 0.00 C ATOM 599 O PHE 41 81.016 87.316 77.084 1.00 0.00 O ATOM 600 N GLU 42 82.806 86.094 77.466 1.00 0.00 N ATOM 601 H GLU 42 83.564 85.903 78.105 1.00 0.00 H ATOM 602 CA GLU 42 82.952 85.532 76.080 1.00 0.00 C ATOM 603 HA GLU 42 82.915 86.391 75.411 1.00 0.00 H ATOM 604 CB GLU 42 84.311 84.995 75.978 1.00 0.00 C ATOM 605 HB2 GLU 42 84.425 84.621 74.961 1.00 0.00 H ATOM 606 HB3 GLU 42 85.076 85.730 76.232 1.00 0.00 H ATOM 607 CG GLU 42 84.582 83.678 76.858 1.00 0.00 C ATOM 608 HG2 GLU 42 84.260 83.984 77.853 1.00 0.00 H ATOM 609 HG3 GLU 42 83.983 82.871 76.437 1.00 0.00 H ATOM 610 CD GLU 42 86.049 83.244 76.788 1.00 0.00 C ATOM 611 OE1 GLU 42 86.391 82.283 77.532 1.00 0.00 O ATOM 612 OE2 GLU 42 86.841 83.916 76.062 1.00 0.00 O ATOM 613 C GLU 42 81.887 84.476 75.578 1.00 0.00 C ATOM 614 O GLU 42 81.757 84.317 74.388 1.00 0.00 O ATOM 615 N GLY 43 81.215 83.699 76.543 1.00 0.00 N ATOM 616 H GLY 43 81.356 84.009 77.493 1.00 0.00 H ATOM 617 CA GLY 43 80.304 82.637 76.173 1.00 0.00 C ATOM 618 HA2 GLY 43 79.584 82.566 76.989 1.00 0.00 H ATOM 619 HA3 GLY 43 79.725 82.933 75.298 1.00 0.00 H ATOM 620 C GLY 43 80.884 81.214 76.041 1.00 0.00 C ATOM 621 O GLY 43 82.131 80.990 76.118 1.00 0.00 O ATOM 622 N PRO 44 80.038 80.191 75.765 1.00 0.00 N ATOM 623 CD PRO 44 78.579 80.304 75.707 1.00 0.00 C ATOM 624 HD2 PRO 44 78.282 81.220 75.196 1.00 0.00 H ATOM 625 HD3 PRO 44 78.113 80.299 76.693 1.00 0.00 H ATOM 626 CG PRO 44 78.063 79.122 74.851 1.00 0.00 C ATOM 627 HG2 PRO 44 78.050 79.371 73.790 1.00 0.00 H ATOM 628 HG3 PRO 44 77.134 78.817 75.332 1.00 0.00 H ATOM 629 CB PRO 44 79.253 78.071 75.016 1.00 0.00 C ATOM 630 HB2 PRO 44 79.355 77.522 74.080 1.00 0.00 H ATOM 631 HB3 PRO 44 78.977 77.413 75.840 1.00 0.00 H ATOM 632 CA PRO 44 80.464 78.785 75.419 1.00 0.00 C ATOM 633 HA PRO 44 80.981 78.307 76.251 1.00 0.00 H ATOM 634 C PRO 44 81.500 78.831 74.253 1.00 0.00 C ATOM 635 O PRO 44 81.274 79.322 73.125 1.00 0.00 O ATOM 636 N ARG 45 82.585 78.118 74.569 1.00 0.00 N ATOM 637 H ARG 45 82.446 77.561 75.399 1.00 0.00 H ATOM 638 CA ARG 45 83.795 77.779 73.696 1.00 0.00 C ATOM 639 HA ARG 45 84.034 78.699 73.163 1.00 0.00 H ATOM 640 CB ARG 45 85.046 77.324 74.541 1.00 0.00 C ATOM 641 HB2 ARG 45 84.894 76.497 75.235 1.00 0.00 H ATOM 642 HB3 ARG 45 85.812 77.021 73.827 1.00 0.00 H ATOM 643 CG ARG 45 85.594 78.564 75.242 1.00 0.00 C ATOM 644 HG2 ARG 45 85.889 79.123 74.354 1.00 0.00 H ATOM 645 HG3 ARG 45 84.776 78.977 75.832 1.00 0.00 H ATOM 646 CD ARG 45 86.837 78.276 76.166 1.00 0.00 C ATOM 647 HD2 ARG 45 86.528 77.659 77.010 1.00 0.00 H ATOM 648 HD3 ARG 45 87.613 77.886 75.507 1.00 0.00 H ATOM 649 NE ARG 45 87.274 79.530 76.855 1.00 0.00 N ATOM 650 HE ARG 45 86.736 80.373 76.716 1.00 0.00 H ATOM 651 CZ ARG 45 88.370 79.687 77.545 1.00 0.00 C ATOM 652 NH1 ARG 45 89.310 78.783 77.603 1.00 0.00 N ATOM 653 HH11 ARG 45 89.267 77.866 77.181 1.00 0.00 H ATOM 654 HH12 ARG 45 90.137 78.964 78.154 1.00 0.00 H ATOM 655 NH2 ARG 45 88.585 80.849 78.146 1.00 0.00 N ATOM 656 HH21 ARG 45 87.831 81.520 78.148 1.00 0.00 H ATOM 657 HH22 ARG 45 89.480 80.979 78.596 1.00 0.00 H ATOM 658 C ARG 45 83.535 76.709 72.559 1.00 0.00 C ATOM 659 O ARG 45 82.745 75.745 72.623 1.00 0.00 O ATOM 660 N ARG 46 84.220 76.910 71.430 1.00 0.00 N ATOM 661 H ARG 46 84.902 77.654 71.439 1.00 0.00 H ATOM 662 CA ARG 46 84.097 76.120 70.155 1.00 0.00 C ATOM 663 HA ARG 46 83.048 76.149 69.860 1.00 0.00 H ATOM 664 CB ARG 46 84.993 76.773 69.095 1.00 0.00 C ATOM 665 HB2 ARG 46 85.953 77.075 69.514 1.00 0.00 H ATOM 666 HB3 ARG 46 85.075 76.019 68.313 1.00 0.00 H ATOM 667 CG ARG 46 84.368 77.963 68.340 1.00 0.00 C ATOM 668 HG2 ARG 46 83.569 77.578 67.706 1.00 0.00 H ATOM 669 HG3 ARG 46 83.968 78.699 69.037 1.00 0.00 H ATOM 670 CD ARG 46 85.319 78.709 67.415 1.00 0.00 C ATOM 671 HD2 ARG 46 85.763 77.949 66.773 1.00 0.00 H ATOM 672 HD3 ARG 46 84.635 79.319 66.825 1.00 0.00 H ATOM 673 NE ARG 46 86.324 79.426 68.216 1.00 0.00 N ATOM 674 HE ARG 46 86.212 79.373 69.219 1.00 0.00 H ATOM 675 CZ ARG 46 87.087 80.373 67.717 1.00 0.00 C ATOM 676 NH1 ARG 46 87.213 80.615 66.498 1.00 0.00 N ATOM 677 HH11 ARG 46 86.606 80.112 65.867 1.00 0.00 H ATOM 678 HH12 ARG 46 87.636 81.508 66.286 1.00 0.00 H ATOM 679 NH2 ARG 46 87.841 81.057 68.496 1.00 0.00 N ATOM 680 HH21 ARG 46 87.999 80.657 69.409 1.00 0.00 H ATOM 681 HH22 ARG 46 88.497 81.719 68.106 1.00 0.00 H ATOM 682 C ARG 46 84.471 74.646 70.313 1.00 0.00 C ATOM 683 O ARG 46 85.544 74.367 70.845 1.00 0.00 O ATOM 684 N ARG 47 83.563 73.796 69.875 1.00 0.00 N ATOM 685 H ARG 47 82.701 74.173 69.505 1.00 0.00 H ATOM 686 CA ARG 47 83.737 72.329 69.694 1.00 0.00 C ATOM 687 HA ARG 47 84.117 71.858 70.601 1.00 0.00 H ATOM 688 CB ARG 47 82.404 71.691 69.331 1.00 0.00 C ATOM 689 HB2 ARG 47 82.041 72.306 68.507 1.00 0.00 H ATOM 690 HB3 ARG 47 82.561 70.751 68.802 1.00 0.00 H ATOM 691 CG ARG 47 81.221 71.637 70.353 1.00 0.00 C ATOM 692 HG2 ARG 47 81.422 70.778 70.994 1.00 0.00 H ATOM 693 HG3 ARG 47 81.313 72.604 70.847 1.00 0.00 H ATOM 694 CD ARG 47 79.842 71.489 69.756 1.00 0.00 C ATOM 695 HD2 ARG 47 79.769 72.224 68.954 1.00 0.00 H ATOM 696 HD3 ARG 47 79.639 70.498 69.350 1.00 0.00 H ATOM 697 NE ARG 47 78.846 71.750 70.813 1.00 0.00 N ATOM 698 HE ARG 47 79.101 71.394 71.723 1.00 0.00 H ATOM 699 CZ ARG 47 77.706 72.460 70.755 1.00 0.00 C ATOM 700 NH1 ARG 47 77.208 72.967 69.674 1.00 0.00 N ATOM 701 HH11 ARG 47 77.671 73.029 68.778 1.00 0.00 H ATOM 702 HH12 ARG 47 76.255 73.292 69.740 1.00 0.00 H ATOM 703 NH2 ARG 47 76.933 72.473 71.815 1.00 0.00 N ATOM 704 HH21 ARG 47 77.060 71.862 72.609 1.00 0.00 H ATOM 705 HH22 ARG 47 76.065 72.990 71.819 1.00 0.00 H ATOM 706 C ARG 47 84.822 71.962 68.640 1.00 0.00 C ATOM 707 O ARG 47 84.936 72.721 67.711 1.00 0.00 O ATOM 708 N ALA 48 85.597 70.914 68.906 1.00 0.00 N ATOM 709 H ALA 48 85.390 70.398 69.749 1.00 0.00 H ATOM 710 CA ALA 48 86.693 70.564 67.989 1.00 0.00 C ATOM 711 HA ALA 48 87.185 71.479 67.656 1.00 0.00 H ATOM 712 CB ALA 48 87.600 69.680 68.777 1.00 0.00 C ATOM 713 HB1 ALA 48 88.348 69.278 68.093 1.00 0.00 H ATOM 714 HB2 ALA 48 88.115 70.147 69.616 1.00 0.00 H ATOM 715 HB3 ALA 48 86.947 68.927 69.220 1.00 0.00 H ATOM 716 C ALA 48 86.000 69.936 66.773 1.00 0.00 C ATOM 717 O ALA 48 84.858 69.525 66.777 1.00 0.00 O ATOM 718 N ARG 49 86.774 69.884 65.695 1.00 0.00 N ATOM 719 H ARG 49 87.708 70.241 65.838 1.00 0.00 H ATOM 720 CA ARG 49 86.280 69.565 64.345 1.00 0.00 C ATOM 721 HA ARG 49 85.465 70.253 64.118 1.00 0.00 H ATOM 722 CB ARG 49 87.281 69.887 63.239 1.00 0.00 C ATOM 723 HB2 ARG 49 87.324 70.973 63.150 1.00 0.00 H ATOM 724 HB3 ARG 49 88.256 69.422 63.385 1.00 0.00 H ATOM 725 CG ARG 49 86.751 69.532 61.854 1.00 0.00 C ATOM 726 HG2 ARG 49 86.873 68.458 61.719 1.00 0.00 H ATOM 727 HG3 ARG 49 85.711 69.849 61.778 1.00 0.00 H ATOM 728 CD ARG 49 87.507 70.197 60.688 1.00 0.00 C ATOM 729 HD2 ARG 49 86.918 70.009 59.791 1.00 0.00 H ATOM 730 HD3 ARG 49 87.562 71.277 60.824 1.00 0.00 H ATOM 731 NE ARG 49 88.851 69.608 60.483 1.00 0.00 N ATOM 732 HE ARG 49 89.622 70.026 60.984 1.00 0.00 H ATOM 733 CZ ARG 49 89.028 68.707 59.535 1.00 0.00 C ATOM 734 NH1 ARG 49 88.137 68.166 58.762 1.00 0.00 N ATOM 735 HH11 ARG 49 87.193 68.523 58.729 1.00 0.00 H ATOM 736 HH12 ARG 49 88.365 67.351 58.210 1.00 0.00 H ATOM 737 NH2 ARG 49 90.215 68.274 59.217 1.00 0.00 N ATOM 738 HH21 ARG 49 91.020 68.490 59.787 1.00 0.00 H ATOM 739 HH22 ARG 49 90.312 67.930 58.272 1.00 0.00 H ATOM 740 C ARG 49 85.635 68.194 64.367 1.00 0.00 C ATOM 741 O ARG 49 84.488 68.125 63.877 1.00 0.00 O ATOM 742 N ARG 50 86.210 67.129 64.893 1.00 0.00 N ATOM 743 H ARG 50 87.080 67.265 65.388 1.00 0.00 H ATOM 744 CA ARG 50 85.613 65.820 64.866 1.00 0.00 C ATOM 745 HA ARG 50 85.197 65.662 63.871 1.00 0.00 H ATOM 746 CB ARG 50 86.518 64.684 65.149 1.00 0.00 C ATOM 747 HB2 ARG 50 86.857 64.817 66.177 1.00 0.00 H ATOM 748 HB3 ARG 50 86.027 63.711 65.109 1.00 0.00 H ATOM 749 CG ARG 50 87.698 64.710 64.097 1.00 0.00 C ATOM 750 HG2 ARG 50 87.377 64.320 63.132 1.00 0.00 H ATOM 751 HG3 ARG 50 88.110 65.690 63.855 1.00 0.00 H ATOM 752 CD ARG 50 88.778 63.718 64.544 1.00 0.00 C ATOM 753 HD2 ARG 50 88.319 62.762 64.797 1.00 0.00 H ATOM 754 HD3 ARG 50 89.404 63.441 63.696 1.00 0.00 H ATOM 755 NE ARG 50 89.613 64.182 65.676 1.00 0.00 N ATOM 756 HE ARG 50 89.165 64.871 66.264 1.00 0.00 H ATOM 757 CZ ARG 50 90.644 63.543 66.167 1.00 0.00 C ATOM 758 NH1 ARG 50 91.084 62.457 65.689 1.00 0.00 N ATOM 759 HH11 ARG 50 90.685 62.076 64.843 1.00 0.00 H ATOM 760 HH12 ARG 50 91.802 61.962 66.197 1.00 0.00 H ATOM 761 NH2 ARG 50 91.389 64.017 67.178 1.00 0.00 N ATOM 762 HH21 ARG 50 91.137 64.878 67.642 1.00 0.00 H ATOM 763 HH22 ARG 50 92.267 63.592 67.437 1.00 0.00 H ATOM 764 C ARG 50 84.374 65.767 65.752 1.00 0.00 C ATOM 765 O ARG 50 83.355 65.151 65.458 1.00 0.00 O ATOM 766 N GLU 51 84.331 66.551 66.842 1.00 0.00 N ATOM 767 H GLU 51 85.027 67.254 67.048 1.00 0.00 H ATOM 768 CA GLU 51 83.123 66.660 67.680 1.00 0.00 C ATOM 769 HA GLU 51 82.775 65.654 67.916 1.00 0.00 H ATOM 770 CB GLU 51 83.526 67.423 69.055 1.00 0.00 C ATOM 771 HB2 GLU 51 84.239 66.842 69.640 1.00 0.00 H ATOM 772 HB3 GLU 51 84.040 68.352 68.808 1.00 0.00 H ATOM 773 CG GLU 51 82.403 67.913 70.054 1.00 0.00 C ATOM 774 HG2 GLU 51 82.972 68.484 70.788 1.00 0.00 H ATOM 775 HG3 GLU 51 81.767 68.612 69.512 1.00 0.00 H ATOM 776 CD GLU 51 81.676 66.783 70.853 1.00 0.00 C ATOM 777 OE1 GLU 51 82.229 65.675 71.033 1.00 0.00 O ATOM 778 OE2 GLU 51 80.499 67.011 71.214 1.00 0.00 O ATOM 779 C GLU 51 81.934 67.414 66.988 1.00 0.00 C ATOM 780 O GLU 51 80.771 66.958 67.098 1.00 0.00 O ATOM 781 N ARG 52 82.252 68.544 66.297 1.00 0.00 N ATOM 782 H ARG 52 83.225 68.814 66.283 1.00 0.00 H ATOM 783 CA ARG 52 81.281 69.170 65.312 1.00 0.00 C ATOM 784 HA ARG 52 80.427 69.453 65.928 1.00 0.00 H ATOM 785 CB ARG 52 81.988 70.424 64.703 1.00 0.00 C ATOM 786 HB2 ARG 52 82.500 70.969 65.495 1.00 0.00 H ATOM 787 HB3 ARG 52 82.772 70.190 63.982 1.00 0.00 H ATOM 788 CG ARG 52 81.090 71.417 63.933 1.00 0.00 C ATOM 789 HG2 ARG 52 80.326 70.983 63.289 1.00 0.00 H ATOM 790 HG3 ARG 52 80.467 72.047 64.568 1.00 0.00 H ATOM 791 CD ARG 52 81.879 72.351 63.084 1.00 0.00 C ATOM 792 HD2 ARG 52 82.500 72.862 63.819 1.00 0.00 H ATOM 793 HD3 ARG 52 82.436 71.793 62.331 1.00 0.00 H ATOM 794 NE ARG 52 81.063 73.329 62.433 1.00 0.00 N ATOM 795 HE ARG 52 80.165 73.525 62.851 1.00 0.00 H ATOM 796 CZ ARG 52 81.486 74.171 61.588 1.00 0.00 C ATOM 797 NH1 ARG 52 82.689 74.160 61.032 1.00 0.00 N ATOM 798 HH11 ARG 52 83.386 73.510 61.367 1.00 0.00 H ATOM 799 HH12 ARG 52 82.920 74.847 60.329 1.00 0.00 H ATOM 800 NH2 ARG 52 80.606 75.075 61.166 1.00 0.00 N ATOM 801 HH21 ARG 52 79.808 75.327 61.731 1.00 0.00 H ATOM 802 HH22 ARG 52 80.843 75.739 60.443 1.00 0.00 H ATOM 803 C ARG 52 80.805 68.300 64.176 1.00 0.00 C ATOM 804 O ARG 52 79.719 68.472 63.647 1.00 0.00 O ATOM 805 N ALA 53 81.644 67.285 63.684 1.00 0.00 N ATOM 806 H ALA 53 82.542 67.172 64.132 1.00 0.00 H ATOM 807 CA ALA 53 81.316 66.368 62.620 1.00 0.00 C ATOM 808 HA ALA 53 80.833 66.867 61.780 1.00 0.00 H ATOM 809 CB ALA 53 82.637 65.750 62.124 1.00 0.00 C ATOM 810 HB1 ALA 53 83.257 66.510 61.649 1.00 0.00 H ATOM 811 HB2 ALA 53 83.297 65.195 62.791 1.00 0.00 H ATOM 812 HB3 ALA 53 82.445 65.049 61.312 1.00 0.00 H ATOM 813 C ALA 53 80.252 65.312 63.118 1.00 0.00 C ATOM 814 O ALA 53 79.304 64.973 62.387 1.00 0.00 O ATOM 815 N GLU 54 80.258 64.942 64.382 1.00 0.00 N ATOM 816 H GLU 54 81.169 64.956 64.817 1.00 0.00 H ATOM 817 CA GLU 54 79.164 63.998 64.918 1.00 0.00 C ATOM 818 HA GLU 54 78.919 63.213 64.203 1.00 0.00 H ATOM 819 CB GLU 54 79.661 63.350 66.262 1.00 0.00 C ATOM 820 HB2 GLU 54 79.807 64.125 67.015 1.00 0.00 H ATOM 821 HB3 GLU 54 78.826 62.760 66.639 1.00 0.00 H ATOM 822 CG GLU 54 80.894 62.430 66.241 1.00 0.00 C ATOM 823 HG2 GLU 54 81.819 63.002 66.171 1.00 0.00 H ATOM 824 HG3 GLU 54 80.962 61.839 67.154 1.00 0.00 H ATOM 825 CD GLU 54 80.885 61.476 65.103 1.00 0.00 C ATOM 826 OE1 GLU 54 81.967 60.880 64.826 1.00 0.00 O ATOM 827 OE2 GLU 54 79.829 61.160 64.505 1.00 0.00 O ATOM 828 C GLU 54 77.923 64.782 65.272 1.00 0.00 C ATOM 829 O GLU 54 76.830 64.249 65.056 1.00 0.00 O ATOM 830 N ARG 55 78.046 66.050 65.679 1.00 0.00 N ATOM 831 H ARG 55 79.006 66.319 65.845 1.00 0.00 H ATOM 832 CA ARG 55 76.941 66.954 65.710 1.00 0.00 C ATOM 833 HA ARG 55 76.146 66.499 66.301 1.00 0.00 H ATOM 834 CB ARG 55 77.294 68.313 66.402 1.00 0.00 C ATOM 835 HB2 ARG 55 77.939 68.116 67.258 1.00 0.00 H ATOM 836 HB3 ARG 55 77.733 68.936 65.623 1.00 0.00 H ATOM 837 CG ARG 55 76.007 69.011 66.922 1.00 0.00 C ATOM 838 HG2 ARG 55 75.448 69.583 66.182 1.00 0.00 H ATOM 839 HG3 ARG 55 75.384 68.249 67.391 1.00 0.00 H ATOM 840 CD ARG 55 76.392 70.154 67.938 1.00 0.00 C ATOM 841 HD2 ARG 55 77.036 69.848 68.763 1.00 0.00 H ATOM 842 HD3 ARG 55 76.994 70.875 67.386 1.00 0.00 H ATOM 843 NE ARG 55 75.180 70.825 68.408 1.00 0.00 N ATOM 844 HE ARG 55 74.685 71.467 67.805 1.00 0.00 H ATOM 845 CZ ARG 55 74.603 70.625 69.566 1.00 0.00 C ATOM 846 NH1 ARG 55 74.989 69.735 70.426 1.00 0.00 N ATOM 847 HH11 ARG 55 75.633 69.002 70.166 1.00 0.00 H ATOM 848 HH12 ARG 55 74.536 69.576 71.314 1.00 0.00 H ATOM 849 NH2 ARG 55 73.608 71.276 69.999 1.00 0.00 N ATOM 850 HH21 ARG 55 73.342 72.076 69.443 1.00 0.00 H ATOM 851 HH22 ARG 55 73.390 71.135 70.975 1.00 0.00 H ATOM 852 C ARG 55 76.278 67.149 64.341 1.00 0.00 C ATOM 853 O ARG 55 74.991 67.258 64.312 1.00 0.00 O ATOM 854 N ARG 56 77.009 67.204 63.242 1.00 0.00 N ATOM 855 H ARG 56 77.991 67.385 63.398 1.00 0.00 H ATOM 856 CA ARG 56 76.386 67.382 61.896 1.00 0.00 C ATOM 857 HA ARG 56 75.637 68.168 61.985 1.00 0.00 H ATOM 858 CB ARG 56 77.417 67.758 60.807 1.00 0.00 C ATOM 859 HB2 ARG 56 78.348 67.232 61.020 1.00 0.00 H ATOM 860 HB3 ARG 56 77.116 67.438 59.810 1.00 0.00 H ATOM 861 CG ARG 56 77.593 69.375 60.854 1.00 0.00 C ATOM 862 HG2 ARG 56 76.744 69.914 60.432 1.00 0.00 H ATOM 863 HG3 ARG 56 77.839 69.625 61.886 1.00 0.00 H ATOM 864 CD ARG 56 78.830 69.693 60.080 1.00 0.00 C ATOM 865 HD2 ARG 56 79.670 69.266 60.628 1.00 0.00 H ATOM 866 HD3 ARG 56 78.733 69.315 59.063 1.00 0.00 H ATOM 867 NE ARG 56 79.070 71.142 60.019 1.00 0.00 N ATOM 868 HE ARG 56 78.241 71.720 60.000 1.00 0.00 H ATOM 869 CZ ARG 56 80.165 71.666 59.486 1.00 0.00 C ATOM 870 NH1 ARG 56 81.290 71.033 59.299 1.00 0.00 N ATOM 871 HH11 ARG 56 81.457 70.129 59.717 1.00 0.00 H ATOM 872 HH12 ARG 56 82.098 71.414 58.828 1.00 0.00 H ATOM 873 NH2 ARG 56 80.140 72.935 59.083 1.00 0.00 N ATOM 874 HH21 ARG 56 79.283 73.458 59.194 1.00 0.00 H ATOM 875 HH22 ARG 56 80.881 73.314 58.511 1.00 0.00 H ATOM 876 C ARG 56 75.756 66.071 61.382 1.00 0.00 C ATOM 877 O ARG 56 74.690 66.175 60.761 1.00 0.00 O ATOM 878 N ALA 57 76.213 64.925 61.775 1.00 0.00 N ATOM 879 H ALA 57 77.184 64.871 62.045 1.00 0.00 H ATOM 880 CA ALA 57 75.576 63.618 61.626 1.00 0.00 C ATOM 881 HA ALA 57 75.342 63.492 60.569 1.00 0.00 H ATOM 882 CB ALA 57 76.612 62.568 62.019 1.00 0.00 C ATOM 883 HB1 ALA 57 76.639 62.478 63.105 1.00 0.00 H ATOM 884 HB2 ALA 57 76.352 61.565 61.680 1.00 0.00 H ATOM 885 HB3 ALA 57 77.624 62.892 61.774 1.00 0.00 H ATOM 886 C ALA 57 74.182 63.494 62.348 1.00 0.00 C ATOM 887 O ALA 57 73.228 63.055 61.651 1.00 0.00 O ATOM 888 N ALA 58 74.068 64.060 63.565 1.00 0.00 N ATOM 889 H ALA 58 74.847 64.497 64.037 1.00 0.00 H ATOM 890 CA ALA 58 72.786 64.146 64.320 1.00 0.00 C ATOM 891 HA ALA 58 72.477 63.107 64.430 1.00 0.00 H ATOM 892 CB ALA 58 73.158 64.587 65.716 1.00 0.00 C ATOM 893 HB1 ALA 58 74.014 63.996 66.043 1.00 0.00 H ATOM 894 HB2 ALA 58 73.371 65.649 65.601 1.00 0.00 H ATOM 895 HB3 ALA 58 72.351 64.452 66.436 1.00 0.00 H ATOM 896 C ALA 58 71.831 65.104 63.560 1.00 0.00 C ATOM 897 O ALA 58 70.717 64.746 63.221 1.00 0.00 O ATOM 898 N GLN 59 72.257 66.291 63.249 1.00 0.00 N ATOM 899 H GLN 59 73.172 66.472 63.636 1.00 0.00 H ATOM 900 CA GLN 59 71.433 67.288 62.575 1.00 0.00 C ATOM 901 HA GLN 59 70.552 67.346 63.214 1.00 0.00 H ATOM 902 CB GLN 59 72.179 68.613 62.580 1.00 0.00 C ATOM 903 HB2 GLN 59 73.158 68.514 62.112 1.00 0.00 H ATOM 904 HB3 GLN 59 71.575 69.308 61.995 1.00 0.00 H ATOM 905 CG GLN 59 72.312 69.258 64.056 1.00 0.00 C ATOM 906 HG2 GLN 59 72.409 68.479 64.812 1.00 0.00 H ATOM 907 HG3 GLN 59 73.220 69.860 63.998 1.00 0.00 H ATOM 908 CD GLN 59 71.151 70.044 64.474 1.00 0.00 C ATOM 909 OE1 GLN 59 70.017 69.717 64.182 1.00 0.00 O ATOM 910 NE2 GLN 59 71.299 71.057 65.320 1.00 0.00 N ATOM 911 HE21 GLN 59 70.416 71.380 65.687 1.00 0.00 H ATOM 912 HE22 GLN 59 72.210 71.402 65.587 1.00 0.00 H ATOM 913 C GLN 59 70.989 66.891 61.103 1.00 0.00 C ATOM 914 O GLN 59 69.809 67.077 60.792 1.00 0.00 O ATOM 915 N ALA 60 71.849 66.165 60.442 1.00 0.00 N ATOM 916 H ALA 60 72.816 66.044 60.709 1.00 0.00 H ATOM 917 CA ALA 60 71.570 65.585 59.213 1.00 0.00 C ATOM 918 HA ALA 60 71.172 66.425 58.645 1.00 0.00 H ATOM 919 CB ALA 60 72.806 65.054 58.554 1.00 0.00 C ATOM 920 HB1 ALA 60 73.630 65.764 58.627 1.00 0.00 H ATOM 921 HB2 ALA 60 73.055 64.119 59.056 1.00 0.00 H ATOM 922 HB3 ALA 60 72.575 64.756 57.531 1.00 0.00 H ATOM 923 C ALA 60 70.399 64.583 59.252 1.00 0.00 C ATOM 924 O ALA 60 69.500 64.693 58.434 1.00 0.00 O ATOM 925 N ARG 61 70.429 63.638 60.168 1.00 0.00 N ATOM 926 H ARG 61 71.305 63.456 60.637 1.00 0.00 H ATOM 927 CA ARG 61 69.368 62.603 60.356 1.00 0.00 C ATOM 928 HA ARG 61 69.130 62.097 59.421 1.00 0.00 H ATOM 929 CB ARG 61 69.715 61.487 61.377 1.00 0.00 C ATOM 930 HB2 ARG 61 70.292 61.838 62.232 1.00 0.00 H ATOM 931 HB3 ARG 61 68.841 60.907 61.675 1.00 0.00 H ATOM 932 CG ARG 61 70.586 60.440 60.653 1.00 0.00 C ATOM 933 HG2 ARG 61 69.989 59.938 59.891 1.00 0.00 H ATOM 934 HG3 ARG 61 71.536 60.847 60.305 1.00 0.00 H ATOM 935 CD ARG 61 70.995 59.345 61.614 1.00 0.00 C ATOM 936 HD2 ARG 61 70.158 58.779 62.022 1.00 0.00 H ATOM 937 HD3 ARG 61 71.615 58.751 60.942 1.00 0.00 H ATOM 938 NE ARG 61 71.874 59.876 62.721 1.00 0.00 N ATOM 939 HE ARG 61 71.412 60.493 63.374 1.00 0.00 H ATOM 940 CZ ARG 61 73.033 59.388 63.180 1.00 0.00 C ATOM 941 NH1 ARG 61 73.652 58.390 62.694 1.00 0.00 N ATOM 942 HH11 ARG 61 73.180 57.845 61.987 1.00 0.00 H ATOM 943 HH12 ARG 61 74.460 57.944 63.106 1.00 0.00 H ATOM 944 NH2 ARG 61 73.451 59.911 64.341 1.00 0.00 N ATOM 945 HH21 ARG 61 72.968 60.675 64.792 1.00 0.00 H ATOM 946 HH22 ARG 61 74.302 59.635 64.811 1.00 0.00 H ATOM 947 C ARG 61 68.066 63.215 60.740 1.00 0.00 C ATOM 948 O ARG 61 67.053 62.924 60.169 1.00 0.00 O ATOM 949 N ALA 62 68.099 64.177 61.648 1.00 0.00 N ATOM 950 H ALA 62 68.953 64.410 62.134 1.00 0.00 H ATOM 951 CA ALA 62 66.971 64.975 62.068 1.00 0.00 C ATOM 952 HA ALA 62 66.169 64.329 62.427 1.00 0.00 H ATOM 953 CB ALA 62 67.220 65.897 63.178 1.00 0.00 C ATOM 954 HB1 ALA 62 67.900 66.706 62.911 1.00 0.00 H ATOM 955 HB2 ALA 62 66.297 66.434 63.396 1.00 0.00 H ATOM 956 HB3 ALA 62 67.654 65.365 64.025 1.00 0.00 H ATOM 957 C ALA 62 66.286 65.696 60.866 1.00 0.00 C ATOM 958 O ALA 62 65.082 65.581 60.641 1.00 0.00 O ATOM 959 N THR 63 67.050 66.428 60.085 1.00 0.00 N ATOM 960 H THR 63 68.001 66.552 60.401 1.00 0.00 H ATOM 961 CA THR 63 66.654 67.092 58.813 1.00 0.00 C ATOM 962 HA THR 63 66.032 67.936 59.111 1.00 0.00 H ATOM 963 CB THR 63 67.843 67.703 58.050 1.00 0.00 C ATOM 964 HB THR 63 68.618 66.936 58.050 1.00 0.00 H ATOM 965 CG2 THR 63 67.738 67.965 56.614 1.00 0.00 C ATOM 966 HG21 THR 63 68.584 68.502 56.185 1.00 0.00 H ATOM 967 HG22 THR 63 67.535 67.105 55.976 1.00 0.00 H ATOM 968 HG23 THR 63 66.834 68.563 56.506 1.00 0.00 H ATOM 969 OG1 THR 63 68.358 68.813 58.670 1.00 0.00 O ATOM 970 HG1 THR 63 68.874 68.405 59.369 1.00 0.00 H ATOM 971 C THR 63 65.829 66.135 57.930 1.00 0.00 C ATOM 972 O THR 63 64.709 66.505 57.528 1.00 0.00 O ATOM 973 N ALA 64 66.353 65.019 57.633 1.00 0.00 N ATOM 974 H ALA 64 67.268 64.813 58.008 1.00 0.00 H ATOM 975 CA ALA 64 65.736 63.979 56.796 1.00 0.00 C ATOM 976 HA ALA 64 65.689 64.340 55.769 1.00 0.00 H ATOM 977 CB ALA 64 66.617 62.735 56.686 1.00 0.00 C ATOM 978 HB1 ALA 64 66.981 62.456 57.674 1.00 0.00 H ATOM 979 HB2 ALA 64 66.095 61.910 56.200 1.00 0.00 H ATOM 980 HB3 ALA 64 67.455 62.873 56.002 1.00 0.00 H ATOM 981 C ALA 64 64.353 63.580 57.341 1.00 0.00 C ATOM 982 O ALA 64 63.414 63.471 56.579 1.00 0.00 O ATOM 983 N ILE 65 64.328 63.324 58.662 1.00 0.00 N ATOM 984 H ILE 65 65.195 63.543 59.132 1.00 0.00 H ATOM 985 CA ILE 65 63.106 62.938 59.524 1.00 0.00 C ATOM 986 HA ILE 65 62.661 62.020 59.141 1.00 0.00 H ATOM 987 CB ILE 65 63.638 62.529 60.865 1.00 0.00 C ATOM 988 HB ILE 65 64.440 63.222 61.117 1.00 0.00 H ATOM 989 CG2 ILE 65 62.672 62.547 62.058 1.00 0.00 C ATOM 990 HG21 ILE 65 61.797 61.932 61.846 1.00 0.00 H ATOM 991 HG22 ILE 65 63.248 62.309 62.952 1.00 0.00 H ATOM 992 HG23 ILE 65 62.374 63.593 62.126 1.00 0.00 H ATOM 993 CG1 ILE 65 64.333 61.169 60.632 1.00 0.00 C ATOM 994 HG12 ILE 65 63.599 60.365 60.587 1.00 0.00 H ATOM 995 HG13 ILE 65 64.979 61.244 59.757 1.00 0.00 H ATOM 996 CD1 ILE 65 65.239 60.826 61.874 1.00 0.00 C ATOM 997 HD11 ILE 65 65.848 59.947 61.662 1.00 0.00 H ATOM 998 HD12 ILE 65 65.891 61.689 62.016 1.00 0.00 H ATOM 999 HD13 ILE 65 64.692 60.618 62.794 1.00 0.00 H ATOM 1000 C ILE 65 61.985 64.007 59.455 1.00 0.00 C ATOM 1001 O ILE 65 60.809 63.676 59.325 1.00 0.00 O ATOM 1002 N GLU 66 62.398 65.282 59.433 1.00 0.00 N ATOM 1003 H GLU 66 63.382 65.445 59.593 1.00 0.00 H ATOM 1004 CA GLU 66 61.482 66.378 59.303 1.00 0.00 C ATOM 1005 HA GLU 66 60.673 66.318 60.031 1.00 0.00 H ATOM 1006 CB GLU 66 62.200 67.736 59.674 1.00 0.00 C ATOM 1007 HB2 GLU 66 62.481 67.853 60.720 1.00 0.00 H ATOM 1008 HB3 GLU 66 63.060 67.819 59.010 1.00 0.00 H ATOM 1009 CG GLU 66 61.405 69.062 59.382 1.00 0.00 C ATOM 1010 HG2 GLU 66 62.120 69.817 59.710 1.00 0.00 H ATOM 1011 HG3 GLU 66 61.279 69.173 58.305 1.00 0.00 H ATOM 1012 CD GLU 66 60.125 69.184 60.191 1.00 0.00 C ATOM 1013 OE1 GLU 66 59.945 68.603 61.290 1.00 0.00 O ATOM 1014 OE2 GLU 66 59.237 69.942 59.809 1.00 0.00 O ATOM 1015 C GLU 66 60.811 66.427 57.892 1.00 0.00 C ATOM 1016 O GLU 66 59.618 66.615 57.858 1.00 0.00 O ATOM 1017 N GLN 67 61.477 66.269 56.723 1.00 0.00 N ATOM 1018 H GLN 67 62.440 65.978 56.810 1.00 0.00 H ATOM 1019 CA GLN 67 60.874 66.057 55.366 1.00 0.00 C ATOM 1020 HA GLN 67 60.187 66.888 55.207 1.00 0.00 H ATOM 1021 CB GLN 67 61.835 65.866 54.184 1.00 0.00 C ATOM 1022 HB2 GLN 67 62.222 64.848 54.158 1.00 0.00 H ATOM 1023 HB3 GLN 67 61.233 65.998 53.285 1.00 0.00 H ATOM 1024 CG GLN 67 63.050 66.776 54.323 1.00 0.00 C ATOM 1025 HG2 GLN 67 63.725 66.238 54.988 1.00 0.00 H ATOM 1026 HG3 GLN 67 63.553 66.735 53.356 1.00 0.00 H ATOM 1027 CD GLN 67 62.850 68.247 54.797 1.00 0.00 C ATOM 1028 OE1 GLN 67 62.062 69.045 54.261 1.00 0.00 O ATOM 1029 NE2 GLN 67 63.495 68.659 55.825 1.00 0.00 N ATOM 1030 HE21 GLN 67 63.526 69.633 56.091 1.00 0.00 H ATOM 1031 HE22 GLN 67 63.883 67.969 56.452 1.00 0.00 H ATOM 1032 C GLN 67 59.824 64.995 55.353 1.00 0.00 C ATOM 1033 O GLN 67 58.725 65.185 54.887 1.00 0.00 O ATOM 1034 N ALA 68 60.167 63.859 55.950 1.00 0.00 N ATOM 1035 H ALA 68 61.102 63.704 56.299 1.00 0.00 H ATOM 1036 CA ALA 68 59.231 62.711 56.180 1.00 0.00 C ATOM 1037 HA ALA 68 58.761 62.452 55.232 1.00 0.00 H ATOM 1038 CB ALA 68 60.011 61.499 56.685 1.00 0.00 C ATOM 1039 HB1 ALA 68 59.407 60.592 56.654 1.00 0.00 H ATOM 1040 HB2 ALA 68 60.887 61.319 56.062 1.00 0.00 H ATOM 1041 HB3 ALA 68 60.301 61.789 57.694 1.00 0.00 H ATOM 1042 C ALA 68 57.996 63.165 57.090 1.00 0.00 C ATOM 1043 O ALA 68 56.964 62.493 56.839 1.00 0.00 O ATOM 1044 N ARG 69 58.191 64.038 58.098 1.00 0.00 N ATOM 1045 H ARG 69 59.129 64.401 58.189 1.00 0.00 H ATOM 1046 CA ARG 69 57.066 64.517 58.991 1.00 0.00 C ATOM 1047 HA ARG 69 56.347 63.711 59.133 1.00 0.00 H ATOM 1048 CB ARG 69 57.571 65.148 60.289 1.00 0.00 C ATOM 1049 HB2 ARG 69 58.516 65.640 60.058 1.00 0.00 H ATOM 1050 HB3 ARG 69 56.805 65.787 60.729 1.00 0.00 H ATOM 1051 CG ARG 69 57.806 64.070 61.359 1.00 0.00 C ATOM 1052 HG2 ARG 69 56.929 64.106 62.005 1.00 0.00 H ATOM 1053 HG3 ARG 69 57.693 63.063 60.959 1.00 0.00 H ATOM 1054 CD ARG 69 58.972 64.362 62.266 1.00 0.00 C ATOM 1055 HD2 ARG 69 59.837 64.580 61.639 1.00 0.00 H ATOM 1056 HD3 ARG 69 58.596 65.109 62.965 1.00 0.00 H ATOM 1057 NE ARG 69 59.293 63.191 63.082 1.00 0.00 N ATOM 1058 HE ARG 69 59.070 62.276 62.716 1.00 0.00 H ATOM 1059 CZ ARG 69 60.148 63.114 64.093 1.00 0.00 C ATOM 1060 NH1 ARG 69 60.608 64.147 64.705 1.00 0.00 N ATOM 1061 HH11 ARG 69 60.295 65.074 64.455 1.00 0.00 H ATOM 1062 HH12 ARG 69 61.100 64.030 65.579 1.00 0.00 H ATOM 1063 NH2 ARG 69 60.464 61.956 64.611 1.00 0.00 N ATOM 1064 HH21 ARG 69 60.206 61.130 64.091 1.00 0.00 H ATOM 1065 HH22 ARG 69 61.012 61.966 65.459 1.00 0.00 H ATOM 1066 C ARG 69 56.208 65.570 58.272 1.00 0.00 C ATOM 1067 O ARG 69 54.963 65.521 58.438 1.00 0.00 O ATOM 1068 N ARG 70 56.828 66.534 57.496 1.00 0.00 N ATOM 1069 H ARG 70 57.834 66.602 57.560 1.00 0.00 H ATOM 1070 CA ARG 70 56.094 67.467 56.679 1.00 0.00 C ATOM 1071 HA ARG 70 55.454 68.055 57.337 1.00 0.00 H ATOM 1072 CB ARG 70 57.128 68.307 55.920 1.00 0.00 C ATOM 1073 HB2 ARG 70 57.856 67.610 55.505 1.00 0.00 H ATOM 1074 HB3 ARG 70 56.679 68.807 55.062 1.00 0.00 H ATOM 1075 CG ARG 70 57.814 69.235 56.873 1.00 0.00 C ATOM 1076 HG2 ARG 70 57.164 70.077 57.112 1.00 0.00 H ATOM 1077 HG3 ARG 70 58.132 68.773 57.807 1.00 0.00 H ATOM 1078 CD ARG 70 59.092 69.776 56.153 1.00 0.00 C ATOM 1079 HD2 ARG 70 59.685 68.901 55.887 1.00 0.00 H ATOM 1080 HD3 ARG 70 58.822 70.165 55.171 1.00 0.00 H ATOM 1081 NE ARG 70 59.710 70.840 57.055 1.00 0.00 N ATOM 1082 HE ARG 70 59.264 71.062 57.933 1.00 0.00 H ATOM 1083 CZ ARG 70 60.822 71.537 56.849 1.00 0.00 C ATOM 1084 NH1 ARG 70 61.603 71.478 55.818 1.00 0.00 N ATOM 1085 HH11 ARG 70 61.440 70.777 55.109 1.00 0.00 H ATOM 1086 HH12 ARG 70 62.501 71.921 55.946 1.00 0.00 H ATOM 1087 NH2 ARG 70 61.198 72.344 57.779 1.00 0.00 N ATOM 1088 HH21 ARG 70 60.481 72.605 58.440 1.00 0.00 H ATOM 1089 HH22 ARG 70 62.060 72.869 57.741 1.00 0.00 H ATOM 1090 C ARG 70 55.209 66.759 55.630 1.00 0.00 C ATOM 1091 O ARG 70 54.147 67.238 55.164 1.00 0.00 O ATOM 1092 N ALA 71 55.673 65.542 55.162 1.00 0.00 N ATOM 1093 H ALA 71 56.658 65.337 55.257 1.00 0.00 H ATOM 1094 CA ALA 71 54.946 64.693 54.208 1.00 0.00 C ATOM 1095 HA ALA 71 54.541 65.381 53.465 1.00 0.00 H ATOM 1096 CB ALA 71 55.878 63.643 53.451 1.00 0.00 C ATOM 1097 HB1 ALA 71 55.334 63.122 52.663 1.00 0.00 H ATOM 1098 HB2 ALA 71 56.708 64.220 53.043 1.00 0.00 H ATOM 1099 HB3 ALA 71 56.291 62.918 54.152 1.00 0.00 H ATOM 1100 C ALA 71 53.832 63.822 54.864 1.00 0.00 C ATOM 1101 O ALA 71 53.331 62.978 54.108 1.00 0.00 O ATOM 1102 N ALA 72 53.522 63.940 56.136 1.00 0.00 N ATOM 1103 H ALA 72 54.036 64.551 56.754 1.00 0.00 H ATOM 1104 CA ALA 72 52.439 63.099 56.732 1.00 0.00 C ATOM 1105 HA ALA 72 51.602 63.093 56.034 1.00 0.00 H ATOM 1106 CB ALA 72 52.880 61.650 56.873 1.00 0.00 C ATOM 1107 HB1 ALA 72 53.169 61.316 55.876 1.00 0.00 H ATOM 1108 HB2 ALA 72 53.693 61.559 57.593 1.00 0.00 H ATOM 1109 HB3 ALA 72 52.159 60.921 57.243 1.00 0.00 H ATOM 1110 C ALA 72 51.855 63.634 58.097 1.00 0.00 C ATOM 1111 O ALA 72 52.204 63.060 59.161 1.00 0.00 O ATOM 1112 N LYS 73 51.023 64.636 58.098 1.00 0.00 N ATOM 1113 H LYS 73 50.809 64.978 57.172 1.00 0.00 H ATOM 1114 CA LYS 73 50.355 65.224 59.313 1.00 0.00 C ATOM 1115 HA LYS 73 51.199 65.458 59.961 1.00 0.00 H ATOM 1116 CB LYS 73 49.563 66.443 59.004 1.00 0.00 C ATOM 1117 HB2 LYS 73 50.227 67.129 58.477 1.00 0.00 H ATOM 1118 HB3 LYS 73 48.802 66.147 58.281 1.00 0.00 H ATOM 1119 CG LYS 73 48.887 67.163 60.139 1.00 0.00 C ATOM 1120 HG2 LYS 73 48.282 66.487 60.742 1.00 0.00 H ATOM 1121 HG3 LYS 73 49.661 67.581 60.783 1.00 0.00 H ATOM 1122 CD LYS 73 47.825 68.166 59.598 1.00 0.00 C ATOM 1123 HD2 LYS 73 48.318 69.000 59.098 1.00 0.00 H ATOM 1124 HD3 LYS 73 47.176 67.753 58.826 1.00 0.00 H ATOM 1125 CE LYS 73 47.003 68.841 60.676 1.00 0.00 C ATOM 1126 HE2 LYS 73 46.498 69.642 60.137 1.00 0.00 H ATOM 1127 HE3 LYS 73 46.246 68.225 61.162 1.00 0.00 H ATOM 1128 NZ LYS 73 47.907 69.442 61.722 1.00 0.00 N ATOM 1129 HZ1 LYS 73 48.908 69.477 61.591 1.00 0.00 H ATOM 1130 HZ2 LYS 73 47.663 70.373 62.028 1.00 0.00 H ATOM 1131 HZ3 LYS 73 47.729 69.024 62.625 1.00 0.00 H ATOM 1132 C LYS 73 49.519 64.172 60.091 1.00 0.00 C ATOM 1133 O LYS 73 48.473 63.598 59.645 1.00 0.00 O ATOM 1134 N ARG 74 50.039 63.838 61.245 1.00 0.00 N ATOM 1135 H ARG 74 50.861 64.323 61.574 1.00 0.00 H ATOM 1136 CA ARG 74 49.583 62.619 61.939 1.00 0.00 C ATOM 1137 HA ARG 74 49.347 61.794 61.267 1.00 0.00 H ATOM 1138 CB ARG 74 50.567 62.145 63.013 1.00 0.00 C ATOM 1139 HB2 ARG 74 50.852 62.919 63.725 1.00 0.00 H ATOM 1140 HB3 ARG 74 49.924 61.412 63.501 1.00 0.00 H ATOM 1141 CG ARG 74 51.930 61.647 62.507 1.00 0.00 C ATOM 1142 HG2 ARG 74 51.821 60.823 61.802 1.00 0.00 H ATOM 1143 HG3 ARG 74 52.583 62.486 62.267 1.00 0.00 H ATOM 1144 CD ARG 74 52.719 60.879 63.632 1.00 0.00 C ATOM 1145 HD2 ARG 74 52.132 60.161 64.205 1.00 0.00 H ATOM 1146 HD3 ARG 74 53.523 60.186 63.383 1.00 0.00 H ATOM 1147 NE ARG 74 53.163 61.786 64.690 1.00 0.00 N ATOM 1148 HE ARG 74 52.518 61.892 65.460 1.00 0.00 H ATOM 1149 CZ ARG 74 54.200 62.545 64.734 1.00 0.00 C ATOM 1150 NH1 ARG 74 55.128 62.644 63.841 1.00 0.00 N ATOM 1151 HH11 ARG 74 54.989 62.129 62.983 1.00 0.00 H ATOM 1152 HH12 ARG 74 55.972 63.169 64.020 1.00 0.00 H ATOM 1153 NH2 ARG 74 54.450 63.229 65.855 1.00 0.00 N ATOM 1154 HH21 ARG 74 53.907 63.001 66.675 1.00 0.00 H ATOM 1155 HH22 ARG 74 55.319 63.739 65.928 1.00 0.00 H ATOM 1156 C ARG 74 48.188 62.956 62.552 1.00 0.00 C ATOM 1157 O ARG 74 47.839 64.098 62.810 1.00 0.00 O ATOM 1158 N ARG 75 47.344 61.918 62.785 1.00 0.00 N ATOM 1159 H ARG 75 47.694 61.013 62.505 1.00 0.00 H ATOM 1160 CA ARG 75 46.160 61.916 63.595 1.00 0.00 C ATOM 1161 HA ARG 75 45.446 62.727 63.450 1.00 0.00 H ATOM 1162 CB ARG 75 45.382 60.648 63.280 1.00 0.00 C ATOM 1163 HB2 ARG 75 46.036 59.776 63.269 1.00 0.00 H ATOM 1164 HB3 ARG 75 44.566 60.506 63.987 1.00 0.00 H ATOM 1165 CG ARG 75 44.753 60.950 61.917 1.00 0.00 C ATOM 1166 HG2 ARG 75 44.020 61.756 61.872 1.00 0.00 H ATOM 1167 HG3 ARG 75 45.504 61.252 61.187 1.00 0.00 H ATOM 1168 CD ARG 75 44.133 59.603 61.473 1.00 0.00 C ATOM 1169 HD2 ARG 75 43.954 59.642 60.398 1.00 0.00 H ATOM 1170 HD3 ARG 75 44.692 58.705 61.734 1.00 0.00 H ATOM 1171 NE ARG 75 42.834 59.420 62.160 1.00 0.00 N ATOM 1172 HE ARG 75 42.431 60.220 62.627 1.00 0.00 H ATOM 1173 CZ ARG 75 42.048 58.399 61.959 1.00 0.00 C ATOM 1174 NH1 ARG 75 42.439 57.387 61.325 1.00 0.00 N ATOM 1175 HH11 ARG 75 43.302 57.379 60.800 1.00 0.00 H ATOM 1176 HH12 ARG 75 41.684 56.791 61.016 1.00 0.00 H ATOM 1177 NH2 ARG 75 40.834 58.484 62.383 1.00 0.00 N ATOM 1178 HH21 ARG 75 40.554 59.124 63.112 1.00 0.00 H ATOM 1179 HH22 ARG 75 40.174 57.756 62.147 1.00 0.00 H ATOM 1180 C ARG 75 46.616 61.977 65.102 1.00 0.00 C ATOM 1181 O ARG 75 47.828 62.025 65.352 1.00 0.00 O ATOM 1182 N ALA 76 45.679 62.084 66.055 1.00 0.00 N ATOM 1183 H ALA 76 44.699 62.255 65.883 1.00 0.00 H ATOM 1184 CA ALA 76 46.072 62.241 67.400 1.00 0.00 C ATOM 1185 HA ALA 76 46.779 63.059 67.540 1.00 0.00 H ATOM 1186 CB ALA 76 44.848 62.490 68.281 1.00 0.00 C ATOM 1187 HB1 ALA 76 45.087 62.548 69.343 1.00 0.00 H ATOM 1188 HB2 ALA 76 44.384 63.404 67.910 1.00 0.00 H ATOM 1189 HB3 ALA 76 44.161 61.648 68.196 1.00 0.00 H ATOM 1190 C ALA 76 46.684 60.865 67.906 1.00 0.00 C ATOM 1191 O ALA 76 47.727 60.785 68.560 1.00 0.00 O ATOM 1192 N ARG 77 46.116 59.721 67.441 1.00 0.00 N ATOM 1193 H ARG 77 45.302 59.858 66.860 1.00 0.00 H ATOM 1194 CA ARG 77 46.353 58.380 67.946 1.00 0.00 C ATOM 1195 HA ARG 77 46.070 58.260 68.992 1.00 0.00 H ATOM 1196 CB ARG 77 45.428 57.373 67.216 1.00 0.00 C ATOM 1197 HB2 ARG 77 45.447 56.369 67.642 1.00 0.00 H ATOM 1198 HB3 ARG 77 44.406 57.668 67.457 1.00 0.00 H ATOM 1199 CG ARG 77 45.532 57.331 65.663 1.00 0.00 C ATOM 1200 HG2 ARG 77 45.169 58.295 65.308 1.00 0.00 H ATOM 1201 HG3 ARG 77 46.535 57.085 65.314 1.00 0.00 H ATOM 1202 CD ARG 77 44.506 56.335 65.015 1.00 0.00 C ATOM 1203 HD2 ARG 77 44.310 55.479 65.661 1.00 0.00 H ATOM 1204 HD3 ARG 77 43.553 56.866 64.995 1.00 0.00 H ATOM 1205 NE ARG 77 44.895 56.006 63.629 1.00 0.00 N ATOM 1206 HE ARG 77 45.712 56.420 63.205 1.00 0.00 H ATOM 1207 CZ ARG 77 44.229 55.048 63.008 1.00 0.00 C ATOM 1208 NH1 ARG 77 43.209 54.358 63.451 1.00 0.00 N ATOM 1209 HH11 ARG 77 42.973 54.443 64.429 1.00 0.00 H ATOM 1210 HH12 ARG 77 42.795 53.670 62.839 1.00 0.00 H ATOM 1211 NH2 ARG 77 44.508 54.880 61.816 1.00 0.00 N ATOM 1212 HH21 ARG 77 45.226 55.458 61.404 1.00 0.00 H ATOM 1213 HH22 ARG 77 43.861 54.339 61.259 1.00 0.00 H ATOM 1214 C ARG 77 47.814 57.990 67.955 1.00 0.00 C ATOM 1215 O ARG 77 48.570 58.224 67.026 1.00 0.00 O ATOM 1216 N GLY 78 48.269 57.348 69.034 1.00 0.00 N ATOM 1217 H GLY 78 47.537 57.129 69.695 1.00 0.00 H ATOM 1218 CA GLY 78 49.485 56.652 68.964 1.00 0.00 C ATOM 1219 HA2 GLY 78 50.261 57.306 68.568 1.00 0.00 H ATOM 1220 HA3 GLY 78 49.636 56.441 70.023 1.00 0.00 H ATOM 1221 C GLY 78 49.310 55.395 68.125 1.00 0.00 C ATOM 1222 O GLY 78 48.265 54.727 68.186 1.00 0.00 O ATOM 1223 N GLN 79 50.452 55.023 67.494 1.00 0.00 N ATOM 1224 H GLN 79 51.153 55.747 67.437 1.00 0.00 H ATOM 1225 CA GLN 79 50.611 53.789 66.813 1.00 0.00 C ATOM 1226 HA GLN 79 49.814 53.702 66.074 1.00 0.00 H ATOM 1227 CB GLN 79 52.013 53.846 66.194 1.00 0.00 C ATOM 1228 HB2 GLN 79 52.707 54.038 67.012 1.00 0.00 H ATOM 1229 HB3 GLN 79 52.219 52.820 65.888 1.00 0.00 H ATOM 1230 CG GLN 79 52.206 54.859 64.953 1.00 0.00 C ATOM 1231 HG2 GLN 79 51.336 54.763 64.302 1.00 0.00 H ATOM 1232 HG3 GLN 79 52.295 55.905 65.248 1.00 0.00 H ATOM 1233 CD GLN 79 53.417 54.511 64.182 1.00 0.00 C ATOM 1234 OE1 GLN 79 54.146 53.517 64.419 1.00 0.00 O ATOM 1235 NE2 GLN 79 53.683 55.315 63.215 1.00 0.00 N ATOM 1236 HE21 GLN 79 54.367 55.053 62.520 1.00 0.00 H ATOM 1237 HE22 GLN 79 53.075 56.054 62.894 1.00 0.00 H ATOM 1238 C GLN 79 50.456 52.559 67.706 1.00 0.00 C ATOM 1239 O GLN 79 50.988 52.545 68.807 1.00 0.00 O ATOM 1240 N ILE 80 49.672 51.623 67.175 1.00 0.00 N ATOM 1241 H ILE 80 49.446 51.629 66.191 1.00 0.00 H ATOM 1242 CA ILE 80 48.983 50.672 68.003 1.00 0.00 C ATOM 1243 HA ILE 80 48.447 51.254 68.753 1.00 0.00 H ATOM 1244 CB ILE 80 47.835 50.114 67.121 1.00 0.00 C ATOM 1245 HB ILE 80 47.217 50.893 66.674 1.00 0.00 H ATOM 1246 CG2 ILE 80 48.303 49.153 65.983 1.00 0.00 C ATOM 1247 HG21 ILE 80 48.802 48.275 66.393 1.00 0.00 H ATOM 1248 HG22 ILE 80 47.595 48.953 65.179 1.00 0.00 H ATOM 1249 HG23 ILE 80 49.093 49.742 65.516 1.00 0.00 H ATOM 1250 CG1 ILE 80 46.939 49.136 67.937 1.00 0.00 C ATOM 1251 HG12 ILE 80 46.246 48.617 67.275 1.00 0.00 H ATOM 1252 HG13 ILE 80 47.547 48.398 68.460 1.00 0.00 H ATOM 1253 CD1 ILE 80 46.146 49.847 69.059 1.00 0.00 C ATOM 1254 HD11 ILE 80 46.785 50.269 69.835 1.00 0.00 H ATOM 1255 HD12 ILE 80 45.526 50.701 68.786 1.00 0.00 H ATOM 1256 HD13 ILE 80 45.438 49.124 69.465 1.00 0.00 H ATOM 1257 C ILE 80 49.860 49.711 68.800 1.00 0.00 C ATOM 1258 O ILE 80 49.437 49.225 69.858 1.00 0.00 O ATOM 1259 N VAL 81 51.005 49.333 68.238 1.00 0.00 N ATOM 1260 H VAL 81 51.222 49.651 67.305 1.00 0.00 H ATOM 1261 CA VAL 81 51.958 48.377 68.920 1.00 0.00 C ATOM 1262 HA VAL 81 51.285 47.559 69.181 1.00 0.00 H ATOM 1263 CB VAL 81 52.917 47.594 67.943 1.00 0.00 C ATOM 1264 HB VAL 81 53.622 48.251 67.435 1.00 0.00 H ATOM 1265 CG1 VAL 81 53.824 46.577 68.586 1.00 0.00 C ATOM 1266 HG11 VAL 81 54.476 47.030 69.333 1.00 0.00 H ATOM 1267 HG12 VAL 81 53.257 45.892 69.217 1.00 0.00 H ATOM 1268 HG13 VAL 81 54.475 46.017 67.915 1.00 0.00 H ATOM 1269 CG2 VAL 81 52.099 46.793 66.855 1.00 0.00 C ATOM 1270 HG21 VAL 81 51.618 47.478 66.156 1.00 0.00 H ATOM 1271 HG22 VAL 81 52.808 46.265 66.218 1.00 0.00 H ATOM 1272 HG23 VAL 81 51.491 46.048 67.368 1.00 0.00 H ATOM 1273 C VAL 81 52.672 49.075 70.076 1.00 0.00 C ATOM 1274 O VAL 81 52.887 48.509 71.131 1.00 0.00 O ATOM 1275 N SER 82 52.976 50.348 69.922 1.00 0.00 N ATOM 1276 H SER 82 53.027 50.765 69.003 1.00 0.00 H ATOM 1277 CA SER 82 53.502 51.216 71.042 1.00 0.00 C ATOM 1278 HA SER 82 54.364 50.735 71.505 1.00 0.00 H ATOM 1279 CB SER 82 54.182 52.431 70.423 1.00 0.00 C ATOM 1280 HB2 SER 82 54.830 52.753 71.237 1.00 0.00 H ATOM 1281 HB3 SER 82 54.696 52.025 69.551 1.00 0.00 H ATOM 1282 OG SER 82 53.227 53.468 70.065 1.00 0.00 O ATOM 1283 HG SER 82 52.425 53.105 69.681 1.00 0.00 H ATOM 1284 C SER 82 52.438 51.603 72.099 1.00 0.00 C ATOM 1285 O SER 82 52.726 51.814 73.284 1.00 0.00 O ATOM 1286 N GLU 83 51.129 51.588 71.730 1.00 0.00 N ATOM 1287 H GLU 83 50.939 51.426 70.752 1.00 0.00 H ATOM 1288 CA GLU 83 49.952 51.582 72.714 1.00 0.00 C ATOM 1289 HA GLU 83 50.062 52.310 73.517 1.00 0.00 H ATOM 1290 CB GLU 83 48.712 51.906 71.974 1.00 0.00 C ATOM 1291 HB2 GLU 83 48.787 51.305 71.068 1.00 0.00 H ATOM 1292 HB3 GLU 83 47.815 51.510 72.450 1.00 0.00 H ATOM 1293 CG GLU 83 48.615 53.375 71.440 1.00 0.00 C ATOM 1294 HG2 GLU 83 49.542 53.696 70.966 1.00 0.00 H ATOM 1295 HG3 GLU 83 47.815 53.364 70.699 1.00 0.00 H ATOM 1296 CD GLU 83 48.251 54.346 72.567 1.00 0.00 C ATOM 1297 OE1 GLU 83 48.914 55.437 72.681 1.00 0.00 O ATOM 1298 OE2 GLU 83 47.219 54.214 73.234 1.00 0.00 O ATOM 1299 C GLU 83 49.774 50.230 73.348 1.00 0.00 C ATOM 1300 O GLU 83 49.387 50.294 74.507 1.00 0.00 O ATOM 1301 N GLN 84 49.949 49.069 72.699 1.00 0.00 N ATOM 1302 H GLN 84 49.981 49.096 71.690 1.00 0.00 H ATOM 1303 CA GLN 84 49.755 47.743 73.242 1.00 0.00 C ATOM 1304 HA GLN 84 48.794 47.664 73.750 1.00 0.00 H ATOM 1305 CB GLN 84 49.712 46.675 72.141 1.00 0.00 C ATOM 1306 HB2 GLN 84 50.482 46.819 71.384 1.00 0.00 H ATOM 1307 HB3 GLN 84 49.993 45.741 72.629 1.00 0.00 H ATOM 1308 CG GLN 84 48.350 46.585 71.396 1.00 0.00 C ATOM 1309 HG2 GLN 84 47.526 46.272 72.038 1.00 0.00 H ATOM 1310 HG3 GLN 84 48.096 47.619 71.163 1.00 0.00 H ATOM 1311 CD GLN 84 48.496 45.868 70.002 1.00 0.00 C ATOM 1312 OE1 GLN 84 49.534 45.394 69.554 1.00 0.00 O ATOM 1313 NE2 GLN 84 47.388 45.649 69.357 1.00 0.00 N ATOM 1314 HE21 GLN 84 47.294 44.964 68.620 1.00 0.00 H ATOM 1315 HE22 GLN 84 46.507 45.863 69.802 1.00 0.00 H ATOM 1316 C GLN 84 50.756 47.368 74.325 1.00 0.00 C ATOM 1317 O GLN 84 50.508 46.588 75.206 1.00 0.00 O ATOM 1318 N ASN 85 51.981 47.931 74.263 1.00 0.00 N ATOM 1319 H ASN 85 52.073 48.708 73.623 1.00 0.00 H ATOM 1320 CA ASN 85 53.099 47.703 75.183 1.00 0.00 C ATOM 1321 HA ASN 85 53.202 46.639 75.398 1.00 0.00 H ATOM 1322 CB ASN 85 54.374 48.001 74.212 1.00 0.00 C ATOM 1323 HB2 ASN 85 54.211 47.311 73.384 1.00 0.00 H ATOM 1324 HB3 ASN 85 54.326 49.013 73.809 1.00 0.00 H ATOM 1325 CG ASN 85 55.718 47.803 74.821 1.00 0.00 C ATOM 1326 OD1 ASN 85 56.281 48.607 75.476 1.00 0.00 O ATOM 1327 ND2 ASN 85 56.276 46.623 74.708 1.00 0.00 N ATOM 1328 HD21 ASN 85 57.253 46.610 74.963 1.00 0.00 H ATOM 1329 HD22 ASN 85 55.830 45.823 74.283 1.00 0.00 H ATOM 1330 C ASN 85 53.161 48.593 76.413 1.00 0.00 C ATOM 1331 O ASN 85 52.493 49.655 76.412 1.00 0.00 O ATOM 1332 N PRO 86 53.748 48.139 77.530 1.00 0.00 N ATOM 1333 CD PRO 86 54.380 46.880 77.777 1.00 0.00 C ATOM 1334 HD2 PRO 86 55.390 46.742 77.392 1.00 0.00 H ATOM 1335 HD3 PRO 86 53.723 46.084 77.427 1.00 0.00 H ATOM 1336 CG PRO 86 54.428 46.645 79.229 1.00 0.00 C ATOM 1337 HG2 PRO 86 55.382 46.176 79.471 1.00 0.00 H ATOM 1338 HG3 PRO 86 53.578 46.119 79.665 1.00 0.00 H ATOM 1339 CB PRO 86 54.366 48.117 79.779 1.00 0.00 C ATOM 1340 HB2 PRO 86 55.326 48.633 79.738 1.00 0.00 H ATOM 1341 HB3 PRO 86 53.948 48.144 80.786 1.00 0.00 H ATOM 1342 CA PRO 86 53.403 48.715 78.848 1.00 0.00 C ATOM 1343 HA PRO 86 52.417 48.470 79.241 1.00 0.00 H ATOM 1344 C PRO 86 53.714 50.265 78.918 1.00 0.00 C ATOM 1345 O PRO 86 54.831 50.632 78.499 1.00 0.00 O ATOM 1346 N ALA 87 52.717 51.045 79.401 1.00 0.00 N ATOM 1347 H ALA 87 51.927 50.576 79.821 1.00 0.00 H ATOM 1348 CA ALA 87 52.709 52.450 79.422 1.00 0.00 C ATOM 1349 HA ALA 87 52.658 52.869 78.417 1.00 0.00 H ATOM 1350 CB ALA 87 51.385 52.898 79.948 1.00 0.00 C ATOM 1351 HB1 ALA 87 50.506 52.365 79.588 1.00 0.00 H ATOM 1352 HB2 ALA 87 51.364 52.821 81.035 1.00 0.00 H ATOM 1353 HB3 ALA 87 51.251 53.949 79.692 1.00 0.00 H ATOM 1354 C ALA 87 53.976 53.138 80.092 1.00 0.00 C ATOM 1355 O ALA 87 54.433 52.734 81.118 1.00 0.00 O ATOM 1356 N LYS 88 54.277 54.433 79.731 1.00 0.00 N ATOM 1357 H LYS 88 53.707 54.890 79.033 1.00 0.00 H ATOM 1358 CA LYS 88 55.330 55.216 80.405 1.00 0.00 C ATOM 1359 HA LYS 88 56.225 54.605 80.514 1.00 0.00 H ATOM 1360 CB LYS 88 55.679 56.383 79.537 1.00 0.00 C ATOM 1361 HB2 LYS 88 54.761 56.800 79.122 1.00 0.00 H ATOM 1362 HB3 LYS 88 56.112 57.174 80.149 1.00 0.00 H ATOM 1363 CG LYS 88 56.839 55.925 78.574 1.00 0.00 C ATOM 1364 HG2 LYS 88 57.696 55.590 79.157 1.00 0.00 H ATOM 1365 HG3 LYS 88 56.482 55.147 77.900 1.00 0.00 H ATOM 1366 CD LYS 88 57.228 57.068 77.700 1.00 0.00 C ATOM 1367 HD2 LYS 88 56.355 57.337 77.104 1.00 0.00 H ATOM 1368 HD3 LYS 88 57.490 57.914 78.335 1.00 0.00 H ATOM 1369 CE LYS 88 58.400 56.628 76.743 1.00 0.00 C ATOM 1370 HE2 LYS 88 59.191 56.156 77.325 1.00 0.00 H ATOM 1371 HE3 LYS 88 58.091 55.825 76.073 1.00 0.00 H ATOM 1372 NZ LYS 88 58.854 57.648 75.793 1.00 0.00 N ATOM 1373 HZ1 LYS 88 59.701 57.366 75.321 1.00 0.00 H ATOM 1374 HZ2 LYS 88 58.110 57.758 75.118 1.00 0.00 H ATOM 1375 HZ3 LYS 88 58.981 58.496 76.326 1.00 0.00 H ATOM 1376 C LYS 88 54.757 55.728 81.768 1.00 0.00 C ATOM 1377 O LYS 88 53.681 56.353 81.712 1.00 0.00 O ATOM 1378 N PRO 89 55.382 55.510 82.944 1.00 0.00 N ATOM 1379 CD PRO 89 56.613 54.762 83.202 1.00 0.00 C ATOM 1380 HD2 PRO 89 57.458 54.882 82.525 1.00 0.00 H ATOM 1381 HD3 PRO 89 56.375 53.698 83.170 1.00 0.00 H ATOM 1382 CG PRO 89 57.137 55.310 84.547 1.00 0.00 C ATOM 1383 HG2 PRO 89 57.557 56.302 84.379 1.00 0.00 H ATOM 1384 HG3 PRO 89 57.848 54.679 85.080 1.00 0.00 H ATOM 1385 CB PRO 89 55.818 55.475 85.316 1.00 0.00 C ATOM 1386 HB2 PRO 89 55.906 56.071 86.225 1.00 0.00 H ATOM 1387 HB3 PRO 89 55.501 54.494 85.668 1.00 0.00 H ATOM 1388 CA PRO 89 54.916 56.086 84.192 1.00 0.00 C ATOM 1389 HA PRO 89 53.855 55.838 84.240 1.00 0.00 H ATOM 1390 C PRO 89 55.045 57.630 84.179 1.00 0.00 C ATOM 1391 O PRO 89 55.556 58.246 83.253 1.00 0.00 O ATOM 1392 N ALA 90 54.515 58.250 85.193 1.00 0.00 N ATOM 1393 H ALA 90 54.100 57.735 85.957 1.00 0.00 H ATOM 1394 CA ALA 90 54.714 59.668 85.337 1.00 0.00 C ATOM 1395 HA ALA 90 54.594 60.111 84.349 1.00 0.00 H ATOM 1396 CB ALA 90 53.618 60.159 86.314 1.00 0.00 C ATOM 1397 HB1 ALA 90 53.764 59.746 87.312 1.00 0.00 H ATOM 1398 HB2 ALA 90 53.573 61.245 86.403 1.00 0.00 H ATOM 1399 HB3 ALA 90 52.701 59.833 85.822 1.00 0.00 H ATOM 1400 C ALA 90 56.204 60.002 85.796 1.00 0.00 C ATOM 1401 O ALA 90 56.528 59.516 86.820 1.00 0.00 O ATOM 1402 N ALA 91 56.892 60.727 84.877 1.00 0.00 N ATOM 1403 H ALA 91 56.426 60.872 83.993 1.00 0.00 H ATOM 1404 CA ALA 91 58.338 61.086 84.963 1.00 0.00 C ATOM 1405 HA ALA 91 58.866 60.137 85.057 1.00 0.00 H ATOM 1406 CB ALA 91 58.697 61.660 83.598 1.00 0.00 C ATOM 1407 HB1 ALA 91 58.424 61.064 82.727 1.00 0.00 H ATOM 1408 HB2 ALA 91 58.322 62.680 83.523 1.00 0.00 H ATOM 1409 HB3 ALA 91 59.776 61.766 83.483 1.00 0.00 H ATOM 1410 C ALA 91 58.576 61.954 86.140 1.00 0.00 C ATOM 1411 O ALA 91 57.735 62.813 86.509 1.00 0.00 O ATOM 1412 N ARG 92 59.719 61.739 86.755 1.00 0.00 N ATOM 1413 H ARG 92 60.444 61.294 86.209 1.00 0.00 H ATOM 1414 CA ARG 92 60.150 62.407 88.039 1.00 0.00 C ATOM 1415 HA ARG 92 59.277 62.932 88.427 1.00 0.00 H ATOM 1416 CB ARG 92 60.564 61.348 89.119 1.00 0.00 C ATOM 1417 HB2 ARG 92 61.416 60.760 88.776 1.00 0.00 H ATOM 1418 HB3 ARG 92 60.974 61.929 89.945 1.00 0.00 H ATOM 1419 CG ARG 92 59.448 60.322 89.485 1.00 0.00 C ATOM 1420 HG2 ARG 92 58.597 60.856 89.906 1.00 0.00 H ATOM 1421 HG3 ARG 92 59.104 59.894 88.544 1.00 0.00 H ATOM 1422 CD ARG 92 59.941 59.222 90.358 1.00 0.00 C ATOM 1423 HD2 ARG 92 60.556 59.592 91.178 1.00 0.00 H ATOM 1424 HD3 ARG 92 59.044 58.772 90.782 1.00 0.00 H ATOM 1425 NE ARG 92 60.642 58.130 89.630 1.00 0.00 N ATOM 1426 HE ARG 92 60.818 58.243 88.641 1.00 0.00 H ATOM 1427 CZ ARG 92 60.756 56.885 90.074 1.00 0.00 C ATOM 1428 NH1 ARG 92 60.201 56.392 91.122 1.00 0.00 N ATOM 1429 HH11 ARG 92 59.683 57.052 91.683 1.00 0.00 H ATOM 1430 HH12 ARG 92 60.304 55.420 91.377 1.00 0.00 H ATOM 1431 NH2 ARG 92 61.401 56.031 89.314 1.00 0.00 N ATOM 1432 HH21 ARG 92 61.876 56.282 88.459 1.00 0.00 H ATOM 1433 HH22 ARG 92 61.478 55.093 89.682 1.00 0.00 H ATOM 1434 C ARG 92 61.212 63.515 87.967 1.00 0.00 C ATOM 1435 O ARG 92 62.089 63.434 87.136 1.00 0.00 O ATOM 1436 N GLY 93 61.198 64.467 88.849 1.00 0.00 N ATOM 1437 H GLY 93 60.413 64.359 89.476 1.00 0.00 H ATOM 1438 CA GLY 93 62.096 65.668 88.988 1.00 0.00 C ATOM 1439 HA2 GLY 93 61.709 66.301 89.787 1.00 0.00 H ATOM 1440 HA3 GLY 93 63.127 65.421 89.243 1.00 0.00 H ATOM 1441 C GLY 93 62.159 66.432 87.697 1.00 0.00 C ATOM 1442 O GLY 93 63.249 66.609 87.194 1.00 0.00 O ATOM 1443 N VAL 94 60.964 66.753 87.141 1.00 0.00 N ATOM 1444 H VAL 94 60.145 66.410 87.622 1.00 0.00 H ATOM 1445 CA VAL 94 60.715 67.250 85.751 1.00 0.00 C ATOM 1446 HA VAL 94 61.733 67.117 85.385 1.00 0.00 H ATOM 1447 CB VAL 94 59.776 66.252 85.084 1.00 0.00 C ATOM 1448 HB VAL 94 60.324 65.320 85.221 1.00 0.00 H ATOM 1449 CG1 VAL 94 58.383 66.134 85.684 1.00 0.00 C ATOM 1450 HG11 VAL 94 58.042 67.124 85.987 1.00 0.00 H ATOM 1451 HG12 VAL 94 57.710 65.584 85.026 1.00 0.00 H ATOM 1452 HG13 VAL 94 58.430 65.479 86.554 1.00 0.00 H ATOM 1453 CG2 VAL 94 59.696 66.543 83.558 1.00 0.00 C ATOM 1454 HG21 VAL 94 59.189 67.489 83.370 1.00 0.00 H ATOM 1455 HG22 VAL 94 60.723 66.518 83.195 1.00 0.00 H ATOM 1456 HG23 VAL 94 59.152 65.722 83.092 1.00 0.00 H ATOM 1457 C VAL 94 60.271 68.726 85.731 1.00 0.00 C ATOM 1458 O VAL 94 60.435 69.339 84.680 1.00 0.00 O ATOM 1459 N VAL 95 60.043 69.389 86.899 1.00 0.00 N ATOM 1460 H VAL 95 59.994 68.790 87.711 1.00 0.00 H ATOM 1461 CA VAL 95 60.016 70.809 87.063 1.00 0.00 C ATOM 1462 HA VAL 95 60.097 71.231 86.061 1.00 0.00 H ATOM 1463 CB VAL 95 58.671 71.351 87.652 1.00 0.00 C ATOM 1464 HB VAL 95 58.465 72.390 87.392 1.00 0.00 H ATOM 1465 CG1 VAL 95 57.454 70.563 87.035 1.00 0.00 C ATOM 1466 HG11 VAL 95 57.399 69.569 87.480 1.00 0.00 H ATOM 1467 HG12 VAL 95 56.540 71.145 87.154 1.00 0.00 H ATOM 1468 HG13 VAL 95 57.488 70.460 85.951 1.00 0.00 H ATOM 1469 CG2 VAL 95 58.487 71.222 89.162 1.00 0.00 C ATOM 1470 HG21 VAL 95 59.165 71.855 89.736 1.00 0.00 H ATOM 1471 HG22 VAL 95 57.428 71.405 89.344 1.00 0.00 H ATOM 1472 HG23 VAL 95 58.704 70.177 89.382 1.00 0.00 H ATOM 1473 C VAL 95 61.134 71.440 87.848 1.00 0.00 C ATOM 1474 O VAL 95 61.784 70.780 88.625 1.00 0.00 O ATOM 1475 N ARG 96 61.396 72.723 87.613 1.00 0.00 N ATOM 1476 H ARG 96 61.059 73.086 86.733 1.00 0.00 H ATOM 1477 CA ARG 96 61.917 73.698 88.607 1.00 0.00 C ATOM 1478 HA ARG 96 62.502 73.148 89.344 1.00 0.00 H ATOM 1479 CB ARG 96 62.871 74.620 87.891 1.00 0.00 C ATOM 1480 HB2 ARG 96 62.344 75.087 87.059 1.00 0.00 H ATOM 1481 HB3 ARG 96 63.105 75.476 88.523 1.00 0.00 H ATOM 1482 CG ARG 96 64.111 73.879 87.420 1.00 0.00 C ATOM 1483 HG2 ARG 96 64.590 73.434 88.293 1.00 0.00 H ATOM 1484 HG3 ARG 96 63.850 73.014 86.810 1.00 0.00 H ATOM 1485 CD ARG 96 65.192 74.789 86.760 1.00 0.00 C ATOM 1486 HD2 ARG 96 64.887 75.005 85.736 1.00 0.00 H ATOM 1487 HD3 ARG 96 65.155 75.675 87.393 1.00 0.00 H ATOM 1488 NE ARG 96 66.541 74.154 86.740 1.00 0.00 N ATOM 1489 HE ARG 96 66.563 73.173 86.979 1.00 0.00 H ATOM 1490 CZ ARG 96 67.650 74.591 86.231 1.00 0.00 C ATOM 1491 NH1 ARG 96 67.861 75.838 85.910 1.00 0.00 N ATOM 1492 HH11 ARG 96 67.112 76.486 86.108 1.00 0.00 H ATOM 1493 HH12 ARG 96 68.527 76.180 85.232 1.00 0.00 H ATOM 1494 NH2 ARG 96 68.623 73.818 85.995 1.00 0.00 N ATOM 1495 HH21 ARG 96 68.462 72.846 86.216 1.00 0.00 H ATOM 1496 HH22 ARG 96 69.457 74.237 85.607 1.00 0.00 H ATOM 1497 C ARG 96 60.761 74.398 89.326 1.00 0.00 C ATOM 1498 O ARG 96 59.709 74.534 88.717 1.00 0.00 O ATOM 1499 N GLY 97 61.029 75.015 90.501 1.00 0.00 N ATOM 1500 H GLY 97 61.858 74.641 90.940 1.00 0.00 H ATOM 1501 CA GLY 97 60.200 75.972 91.240 1.00 0.00 C ATOM 1502 HA2 GLY 97 59.273 75.526 91.600 1.00 0.00 H ATOM 1503 HA3 GLY 97 60.773 76.520 91.988 1.00 0.00 H ATOM 1504 C GLY 97 59.738 77.169 90.446 1.00 0.00 C ATOM 1505 O GLY 97 60.236 77.501 89.345 1.00 0.00 O ATOM 1506 N LEU 98 58.881 77.980 91.051 1.00 0.00 N ATOM 1507 H LEU 98 58.637 77.715 91.994 1.00 0.00 H ATOM 1508 CA LEU 98 58.351 79.195 90.474 1.00 0.00 C ATOM 1509 HA LEU 98 58.181 78.948 89.426 1.00 0.00 H ATOM 1510 CB LEU 98 57.114 79.539 91.214 1.00 0.00 C ATOM 1511 HB2 LEU 98 56.440 78.683 91.219 1.00 0.00 H ATOM 1512 HB3 LEU 98 57.464 79.806 92.211 1.00 0.00 H ATOM 1513 CG LEU 98 56.232 80.695 90.711 1.00 0.00 C ATOM 1514 HG LEU 98 56.846 81.583 90.560 1.00 0.00 H ATOM 1515 CD1 LEU 98 55.616 80.474 89.307 1.00 0.00 C ATOM 1516 HD11 LEU 98 55.009 81.369 89.171 1.00 0.00 H ATOM 1517 HD12 LEU 98 56.396 80.378 88.552 1.00 0.00 H ATOM 1518 HD13 LEU 98 55.025 79.559 89.320 1.00 0.00 H ATOM 1519 CD2 LEU 98 55.195 80.934 91.808 1.00 0.00 C ATOM 1520 HD21 LEU 98 54.676 81.886 91.700 1.00 0.00 H ATOM 1521 HD22 LEU 98 54.497 80.111 91.656 1.00 0.00 H ATOM 1522 HD23 LEU 98 55.691 80.878 92.777 1.00 0.00 H ATOM 1523 C LEU 98 59.400 80.360 90.504 1.00 0.00 C ATOM 1524 O LEU 98 59.386 81.170 89.598 1.00 0.00 O ATOM 1525 N LYS 99 60.342 80.328 91.444 1.00 0.00 N ATOM 1526 H LYS 99 60.349 79.583 92.126 1.00 0.00 H ATOM 1527 CA LYS 99 61.432 81.327 91.520 1.00 0.00 C ATOM 1528 HA LYS 99 61.543 81.834 90.562 1.00 0.00 H ATOM 1529 CB LYS 99 60.883 82.386 92.483 1.00 0.00 C ATOM 1530 HB2 LYS 99 59.912 82.710 92.107 1.00 0.00 H ATOM 1531 HB3 LYS 99 60.811 81.923 93.467 1.00 0.00 H ATOM 1532 CG LYS 99 61.748 83.623 92.734 1.00 0.00 C ATOM 1533 HG2 LYS 99 62.703 83.243 93.096 1.00 0.00 H ATOM 1534 HG3 LYS 99 61.936 84.131 91.788 1.00 0.00 H ATOM 1535 CD LYS 99 61.052 84.539 93.740 1.00 0.00 C ATOM 1536 HD2 LYS 99 60.005 84.619 93.448 1.00 0.00 H ATOM 1537 HD3 LYS 99 60.963 84.009 94.688 1.00 0.00 H ATOM 1538 CE LYS 99 61.776 85.871 93.851 1.00 0.00 C ATOM 1539 HE2 LYS 99 61.598 86.580 93.042 1.00 0.00 H ATOM 1540 HE3 LYS 99 61.233 86.433 94.611 1.00 0.00 H ATOM 1541 NZ LYS 99 63.219 85.823 94.182 1.00 0.00 N ATOM 1542 HZ1 LYS 99 63.344 85.063 94.835 1.00 0.00 H ATOM 1543 HZ2 LYS 99 63.726 85.444 93.395 1.00 0.00 H ATOM 1544 HZ3 LYS 99 63.493 86.724 94.547 1.00 0.00 H ATOM 1545 C LYS 99 62.816 80.783 91.879 1.00 0.00 C ATOM 1546 O LYS 99 63.780 80.932 91.063 1.00 0.00 O ATOM 1547 OXT LYS 99 62.865 79.926 92.774 1.00 0.00 O TER 1548 LYS 99 ATOM 1548 C116 PA 100 112.147 77.779 47.895 1.00 0.00 C ATOM 1549 H16R PA 100 112.851 77.915 48.718 1.00 0.00 H ATOM 1550 H16S PA 100 112.663 77.765 46.932 1.00 0.00 H ATOM 1551 H16T PA 100 111.808 76.741 47.933 1.00 0.00 H ATOM 1552 C115 PA 100 111.055 78.761 47.978 1.00 0.00 C ATOM 1553 H15R PA 100 110.248 78.359 47.361 1.00 0.00 H ATOM 1554 H15S PA 100 111.386 79.697 47.524 1.00 0.00 H ATOM 1555 C114 PA 100 110.504 78.931 49.417 1.00 0.00 C ATOM 1556 H14R PA 100 111.128 79.478 50.126 1.00 0.00 H ATOM 1557 H14S PA 100 110.345 77.905 49.756 1.00 0.00 H ATOM 1558 C113 PA 100 109.252 79.781 49.598 1.00 0.00 C ATOM 1559 H13R PA 100 108.443 79.261 49.081 1.00 0.00 H ATOM 1560 H13S PA 100 109.376 80.739 49.089 1.00 0.00 H ATOM 1561 C112 PA 100 108.717 79.890 51.037 1.00 0.00 C ATOM 1562 H12R PA 100 107.851 80.541 51.172 1.00 0.00 H ATOM 1563 H12S PA 100 109.529 80.297 51.644 1.00 0.00 H ATOM 1564 C111 PA 100 108.300 78.563 51.633 1.00 0.00 C ATOM 1565 H11R PA 100 109.243 78.013 51.656 1.00 0.00 H ATOM 1566 H11S PA 100 107.690 77.898 51.018 1.00 0.00 H ATOM 1567 C110 PA 100 107.622 78.725 53.030 1.00 0.00 C ATOM 1568 H10R PA 100 106.692 79.296 52.988 1.00 0.00 H ATOM 1569 H10S PA 100 108.313 79.231 53.707 1.00 0.00 H ATOM 1570 C19 PA 100 107.154 77.361 53.540 1.00 0.00 C ATOM 1571 H9R PA 100 107.987 76.661 53.634 1.00 0.00 H ATOM 1572 H9S PA 100 106.485 76.938 52.788 1.00 0.00 H ATOM 1573 C18 PA 100 106.402 77.236 54.904 1.00 0.00 C ATOM 1574 H8R PA 100 105.587 77.962 54.944 1.00 0.00 H ATOM 1575 H8S PA 100 107.075 77.617 55.675 1.00 0.00 H ATOM 1576 C17 PA 100 105.974 75.821 55.260 1.00 0.00 C ATOM 1577 H7R PA 100 105.096 75.577 54.658 1.00 0.00 H ATOM 1578 H7S PA 100 105.565 75.931 56.267 1.00 0.00 H ATOM 1579 C16 PA 100 107.129 74.757 55.297 1.00 0.00 C ATOM 1580 H6R PA 100 107.887 75.194 55.951 1.00 0.00 H ATOM 1581 H6S PA 100 107.586 74.501 54.339 1.00 0.00 H ATOM 1582 C15 PA 100 106.741 73.525 56.056 1.00 0.00 C ATOM 1583 H5R PA 100 106.277 72.860 55.325 1.00 0.00 H ATOM 1584 H5S PA 100 105.927 73.663 56.771 1.00 0.00 H ATOM 1585 C14 PA 100 107.867 72.875 56.816 1.00 0.00 C ATOM 1586 H4R PA 100 108.384 73.498 57.549 1.00 0.00 H ATOM 1587 H4S PA 100 108.663 72.468 56.189 1.00 0.00 H ATOM 1588 C13 PA 100 107.404 71.740 57.786 1.00 0.00 C ATOM 1589 H3R PA 100 108.261 71.123 58.067 1.00 0.00 H ATOM 1590 H3S PA 100 106.853 71.007 57.193 1.00 0.00 H ATOM 1591 C12 PA 100 106.692 72.359 58.988 1.00 0.00 C ATOM 1592 H2R PA 100 105.700 72.728 58.719 1.00 0.00 H ATOM 1593 H2S PA 100 107.241 73.267 59.249 1.00 0.00 H ATOM 1594 C11 PGR 101 106.705 71.460 60.180 1.00 0.00 C ATOM 1595 O12 PGR 101 107.584 71.539 60.973 1.00 0.00 O ATOM 1596 O11 PGR 101 105.653 70.614 60.228 1.00 0.00 O ATOM 1597 C1 PGR 101 105.255 69.909 61.430 1.00 0.00 C ATOM 1598 HR PGR 101 106.079 69.237 61.681 1.00 0.00 H ATOM 1599 HS PGR 101 104.424 69.253 61.160 1.00 0.00 H ATOM 1600 C2 PGR 101 105.009 70.833 62.589 1.00 0.00 C ATOM 1601 HX PGR 101 105.881 71.471 62.754 1.00 0.00 H ATOM 1602 C3 PGR 101 104.761 70.042 63.861 1.00 0.00 C ATOM 1603 HA PGR 101 105.170 69.034 63.753 1.00 0.00 H ATOM 1604 HB PGR 101 103.697 70.082 64.107 1.00 0.00 H ATOM 1605 O31 PGR 101 105.528 70.654 64.828 1.00 0.00 O ATOM 1606 P31 PGR 101 105.422 70.194 66.389 1.00 0.00 P ATOM 1607 O32 PGR 101 104.180 71.120 66.797 1.00 0.00 O ATOM 1608 C31 PGR 101 104.384 72.472 67.163 1.00 0.00 C ATOM 1609 H1A PGR 101 104.836 72.904 66.266 1.00 0.00 H ATOM 1610 H1B PGR 101 105.138 72.562 67.949 1.00 0.00 H ATOM 1611 C32 PGR 101 103.109 73.185 67.517 1.00 0.00 C ATOM 1612 H2A PGR 101 103.354 74.036 68.157 1.00 0.00 H ATOM 1613 O35 PGR 101 102.319 72.311 68.321 1.00 0.00 O ATOM 1614 HO5A PGR 101 101.547 72.833 68.603 1.00 0.00 H ATOM 1615 C33 PGR 101 102.309 73.679 66.246 1.00 0.00 C ATOM 1616 H3A PGR 101 102.971 74.261 65.600 1.00 0.00 H ATOM 1617 H3B PGR 101 101.966 72.791 65.709 1.00 0.00 H ATOM 1618 O33 PGR 101 104.899 68.851 66.522 1.00 0.00 O ATOM 1619 O34 PGR 101 106.652 70.553 67.111 1.00 0.00 O ATOM 1620 O21 PGR 101 103.863 71.635 62.349 1.00 0.00 O ATOM 1621 C21 PGR 101 103.941 72.859 61.737 1.00 0.00 C ATOM 1622 O22 PGR 101 104.936 73.436 61.382 1.00 0.00 O ATOM 1623 O36 PGR 101 101.178 74.517 66.661 1.00 0.00 O ATOM 1624 HO6A PGR 101 101.587 75.212 67.207 1.00 0.00 H ATOM 1625 C12 OL 102 102.556 73.529 61.569 1.00 0.00 C ATOM 1626 H2R OL 102 101.821 72.739 61.405 1.00 0.00 H ATOM 1627 H2S OL 102 102.455 73.816 62.618 1.00 0.00 H ATOM 1628 C13 OL 102 102.604 74.620 60.464 1.00 0.00 C ATOM 1629 H3R OL 102 101.690 75.191 60.644 1.00 0.00 H ATOM 1630 H3S OL 102 103.446 75.312 60.538 1.00 0.00 H ATOM 1631 C14 OL 102 102.699 74.118 58.996 1.00 0.00 C ATOM 1632 H4R OL 102 103.682 73.649 58.910 1.00 0.00 H ATOM 1633 H4S OL 102 101.994 73.301 58.825 1.00 0.00 H ATOM 1634 C15 OL 102 102.532 75.337 57.997 1.00 0.00 C ATOM 1635 H5R OL 102 101.562 75.726 58.312 1.00 0.00 H ATOM 1636 H5S OL 102 103.372 76.034 58.020 1.00 0.00 H ATOM 1637 C16 OL 102 102.332 74.872 56.533 1.00 0.00 C ATOM 1638 H6R OL 102 103.241 74.434 56.115 1.00 0.00 H ATOM 1639 H6S OL 102 101.546 74.116 56.479 1.00 0.00 H ATOM 1640 C17 OL 102 102.127 76.052 55.586 1.00 0.00 C ATOM 1641 H7R OL 102 101.329 76.664 56.010 1.00 0.00 H ATOM 1642 H7S OL 102 102.897 76.826 55.546 1.00 0.00 H ATOM 1643 C18 OL 102 101.877 75.485 54.178 1.00 0.00 C ATOM 1644 H8R OL 102 102.780 75.021 53.777 1.00 0.00 H ATOM 1645 H8S OL 102 101.061 74.764 54.266 1.00 0.00 H ATOM 1646 C19 OL 102 101.349 76.523 53.331 1.00 0.00 C ATOM 1647 H9R OL 102 100.324 76.763 53.599 1.00 0.00 H ATOM 1648 C110 OL 102 102.130 77.221 52.514 1.00 0.00 C ATOM 1649 H10R OL 102 101.625 78.066 52.052 1.00 0.00 H ATOM 1650 C111 OL 102 103.535 77.094 52.093 1.00 0.00 C ATOM 1651 H11R OL 102 104.101 77.930 52.511 1.00 0.00 H ATOM 1652 H11S OL 102 103.977 76.202 52.543 1.00 0.00 H ATOM 1653 C112 OL 102 103.627 76.939 50.683 1.00 0.00 C ATOM 1654 H12R OL 102 103.220 76.006 50.287 1.00 0.00 H ATOM 1655 H12S OL 102 103.186 77.827 50.226 1.00 0.00 H ATOM 1656 C113 OL 102 105.076 77.055 50.239 1.00 0.00 C ATOM 1657 H13R OL 102 105.526 78.022 50.470 1.00 0.00 H ATOM 1658 H13S OL 102 105.689 76.305 50.743 1.00 0.00 H ATOM 1659 C114 OL 102 105.238 76.791 48.670 1.00 0.00 C ATOM 1660 H14R OL 102 104.955 75.772 48.395 1.00 0.00 H ATOM 1661 H14S OL 102 104.383 77.366 48.308 1.00 0.00 H ATOM 1662 C115 OL 102 106.539 77.360 47.920 1.00 0.00 C ATOM 1663 H15R OL 102 106.728 78.400 48.192 1.00 0.00 H ATOM 1664 H15S OL 102 107.351 76.730 48.289 1.00 0.00 H ATOM 1665 C116 OL 102 106.585 77.353 46.347 1.00 0.00 C ATOM 1666 H16R OL 102 107.417 78.019 46.107 1.00 0.00 H ATOM 1667 H16S OL 102 106.737 76.312 46.058 1.00 0.00 H ATOM 1668 C117 OL 102 105.281 77.705 45.580 1.00 0.00 C ATOM 1669 H17R OL 102 105.468 77.535 44.518 1.00 0.00 H ATOM 1670 H17S OL 102 104.473 77.032 45.877 1.00 0.00 H ATOM 1671 C118 OL 102 104.702 79.071 45.905 1.00 0.00 C ATOM 1672 H18R OL 102 104.533 79.193 46.976 1.00 0.00 H ATOM 1673 H18S OL 102 103.716 79.336 45.517 1.00 0.00 H ATOM 1674 H18T OL 102 105.433 79.802 45.554 1.00 0.00 H TER 1675 OL 102 ATOM 1675 C116 PA 103 82.944 75.231 44.266 1.00 0.00 C ATOM 1676 H16R PA 103 81.960 75.704 44.310 1.00 0.00 H ATOM 1677 H16S PA 103 83.579 75.772 43.561 1.00 0.00 H ATOM 1678 H16T PA 103 83.449 75.211 45.234 1.00 0.00 H ATOM 1679 C115 PA 103 82.837 73.822 43.805 1.00 0.00 C ATOM 1680 H15R PA 103 83.743 73.530 43.270 1.00 0.00 H ATOM 1681 H15S PA 103 81.959 73.671 43.175 1.00 0.00 H ATOM 1682 C114 PA 103 82.848 72.732 44.940 1.00 0.00 C ATOM 1683 H14R PA 103 82.079 72.977 45.676 1.00 0.00 H ATOM 1684 H14S PA 103 83.793 72.697 45.485 1.00 0.00 H ATOM 1685 C113 PA 103 82.643 71.295 44.414 1.00 0.00 C ATOM 1686 H13R PA 103 83.588 71.261 43.869 1.00 0.00 H ATOM 1687 H13S PA 103 81.839 71.342 43.677 1.00 0.00 H ATOM 1688 C112 PA 103 82.453 70.304 45.523 1.00 0.00 C ATOM 1689 H12R PA 103 81.443 70.265 45.935 1.00 0.00 H ATOM 1690 H12S PA 103 83.151 70.647 46.291 1.00 0.00 H ATOM 1691 C111 PA 103 82.752 68.910 45.069 1.00 0.00 C ATOM 1692 H11R PA 103 83.674 68.835 44.489 1.00 0.00 H ATOM 1693 H11S PA 103 81.959 68.569 44.400 1.00 0.00 H ATOM 1694 C110 PA 103 82.842 67.996 46.267 1.00 0.00 C ATOM 1695 H10R PA 103 81.997 68.174 46.936 1.00 0.00 H ATOM 1696 H10S PA 103 83.752 68.131 46.855 1.00 0.00 H ATOM 1697 C19 PA 103 82.758 66.573 45.841 1.00 0.00 C ATOM 1698 H9R PA 103 83.736 66.293 45.444 1.00 0.00 H ATOM 1699 H9S PA 103 82.049 66.433 45.022 1.00 0.00 H ATOM 1700 C18 PA 103 82.375 65.504 46.917 1.00 0.00 C ATOM 1701 H8R PA 103 82.370 64.492 46.507 1.00 0.00 H ATOM 1702 H8S PA 103 81.340 65.606 47.249 1.00 0.00 H ATOM 1703 C17 PA 103 83.384 65.540 48.117 1.00 0.00 C ATOM 1704 H7R PA 103 83.629 66.566 48.400 1.00 0.00 H ATOM 1705 H7S PA 103 84.350 65.094 47.872 1.00 0.00 H ATOM 1706 C16 PA 103 82.876 64.743 49.329 1.00 0.00 C ATOM 1707 H6R PA 103 83.709 64.448 49.970 1.00 0.00 H ATOM 1708 H6S PA 103 82.526 63.754 49.024 1.00 0.00 H ATOM 1709 C15 PA 103 81.813 65.468 50.231 1.00 0.00 C ATOM 1710 H5R PA 103 81.016 65.852 49.592 1.00 0.00 H ATOM 1711 H5S PA 103 82.328 66.377 50.550 1.00 0.00 H ATOM 1712 C14 PA 103 81.337 64.720 51.434 1.00 0.00 C ATOM 1713 H4R PA 103 82.078 63.987 51.759 1.00 0.00 H ATOM 1714 H4S PA 103 80.495 64.103 51.116 1.00 0.00 H ATOM 1715 C13 PA 103 81.191 65.489 52.784 1.00 0.00 C ATOM 1716 H3R PA 103 80.790 66.478 52.553 1.00 0.00 H ATOM 1717 H3S PA 103 82.200 65.670 53.159 1.00 0.00 H ATOM 1718 C12 PA 103 80.357 64.844 53.911 1.00 0.00 C ATOM 1719 H2R PA 103 80.644 63.795 54.016 1.00 0.00 H ATOM 1720 H2S PA 103 79.270 64.934 53.873 1.00 0.00 H ATOM 1721 C11 PGR 104 80.666 65.601 55.186 1.00 0.00 C ATOM 1722 O12 PGR 104 79.872 66.423 55.670 1.00 0.00 O ATOM 1723 O11 PGR 104 81.912 65.376 55.635 1.00 0.00 O ATOM 1724 C1 PGR 104 82.419 65.851 56.882 1.00 0.00 C ATOM 1725 HR PGR 104 82.024 66.862 57.013 1.00 0.00 H ATOM 1726 HS PGR 104 83.494 65.985 56.732 1.00 0.00 H ATOM 1727 C2 PGR 104 82.324 64.868 58.122 1.00 0.00 C ATOM 1728 HX PGR 104 82.578 65.387 59.050 1.00 0.00 H ATOM 1729 C3 PGR 104 83.279 63.632 57.920 1.00 0.00 C ATOM 1730 HA PGR 104 84.285 64.041 57.796 1.00 0.00 H ATOM 1731 HB PGR 104 82.990 62.966 57.103 1.00 0.00 H ATOM 1732 O31 PGR 104 83.251 62.996 59.096 1.00 0.00 O ATOM 1733 P31 PGR 104 83.955 61.634 59.383 1.00 0.00 P ATOM 1734 O32 PGR 104 82.978 60.504 58.709 1.00 0.00 O ATOM 1735 C31 PGR 104 81.651 60.366 59.319 1.00 0.00 C ATOM 1736 H1A PGR 104 81.098 59.883 58.509 1.00 0.00 H ATOM 1737 H1B PGR 104 81.144 61.329 59.428 1.00 0.00 H ATOM 1738 C32 PGR 104 81.466 59.485 60.562 1.00 0.00 C ATOM 1739 H2A PGR 104 82.160 58.641 60.542 1.00 0.00 H ATOM 1740 O35 PGR 104 81.992 60.309 61.682 1.00 0.00 O ATOM 1741 HO5A PGR 104 82.859 60.592 61.339 1.00 0.00 H ATOM 1742 C33 PGR 104 80.039 59.101 60.802 1.00 0.00 C ATOM 1743 H3A PGR 104 79.473 60.026 60.933 1.00 0.00 H ATOM 1744 H3B PGR 104 79.682 58.471 59.984 1.00 0.00 H ATOM 1745 O33 PGR 104 85.206 61.736 58.610 1.00 0.00 O ATOM 1746 O34 PGR 104 84.069 61.410 60.769 1.00 0.00 O ATOM 1747 O21 PGR 104 80.974 64.406 58.224 1.00 0.00 O ATOM 1748 C21 PGR 104 80.043 65.273 58.679 1.00 0.00 C ATOM 1749 O22 PGR 104 80.302 66.339 59.146 1.00 0.00 O ATOM 1750 O36 PGR 104 80.008 58.334 62.040 1.00 0.00 O ATOM 1751 HO6A PGR 104 79.082 58.068 62.185 1.00 0.00 H ATOM 1752 C12 OL 105 78.607 64.787 58.969 1.00 0.00 C ATOM 1753 H2R OL 105 78.375 64.917 60.028 1.00 0.00 H ATOM 1754 H2S OL 105 77.846 65.480 58.604 1.00 0.00 H ATOM 1755 C13 OL 105 78.382 63.300 58.616 1.00 0.00 C ATOM 1756 H3R OL 105 78.949 62.597 59.229 1.00 0.00 H ATOM 1757 H3S OL 105 77.376 63.066 58.972 1.00 0.00 H ATOM 1758 C14 OL 105 78.578 63.021 57.156 1.00 0.00 C ATOM 1759 H4R OL 105 78.962 63.904 56.641 1.00 0.00 H ATOM 1760 H4S OL 105 79.493 62.428 57.096 1.00 0.00 H ATOM 1761 C15 OL 105 77.356 62.496 56.505 1.00 0.00 C ATOM 1762 H5R OL 105 76.933 61.695 57.114 1.00 0.00 H ATOM 1763 H5S OL 105 76.535 63.193 56.688 1.00 0.00 H ATOM 1764 C16 OL 105 77.323 62.366 54.998 1.00 0.00 C ATOM 1765 H6R OL 105 77.405 63.355 54.542 1.00 0.00 H ATOM 1766 H6S OL 105 78.177 61.851 54.554 1.00 0.00 H ATOM 1767 C17 OL 105 76.147 61.472 54.366 1.00 0.00 C ATOM 1768 H7R OL 105 76.281 60.436 54.684 1.00 0.00 H ATOM 1769 H7S OL 105 75.174 61.829 54.708 1.00 0.00 H ATOM 1770 C18 OL 105 76.128 61.511 52.806 1.00 0.00 C ATOM 1771 H8R OL 105 75.803 62.496 52.466 1.00 0.00 H ATOM 1772 H8S OL 105 77.177 61.465 52.506 1.00 0.00 H ATOM 1773 C19 OL 105 75.285 60.407 52.100 1.00 0.00 C ATOM 1774 H9R OL 105 75.005 59.620 52.796 1.00 0.00 H ATOM 1775 C110 OL 105 74.902 60.311 50.845 1.00 0.00 C ATOM 1776 H10R OL 105 74.216 59.543 50.496 1.00 0.00 H ATOM 1777 C111 OL 105 75.037 61.321 49.760 1.00 0.00 C ATOM 1778 H11R OL 105 75.063 62.286 50.269 1.00 0.00 H ATOM 1779 H11S OL 105 76.092 61.189 49.514 1.00 0.00 H ATOM 1780 C112 OL 105 74.268 61.087 48.444 1.00 0.00 C ATOM 1781 H12R OL 105 74.426 60.049 48.147 1.00 0.00 H ATOM 1782 H12S OL 105 73.203 61.155 48.675 1.00 0.00 H ATOM 1783 C113 OL 105 74.668 62.108 47.362 1.00 0.00 C ATOM 1784 H13R OL 105 75.747 62.114 47.193 1.00 0.00 H ATOM 1785 H13S OL 105 74.258 61.889 46.374 1.00 0.00 H ATOM 1786 C114 OL 105 74.189 63.495 47.786 1.00 0.00 C ATOM 1787 H14R OL 105 73.212 63.593 48.263 1.00 0.00 H ATOM 1788 H14S OL 105 74.788 63.969 48.567 1.00 0.00 H ATOM 1789 C115 OL 105 74.473 64.592 46.701 1.00 0.00 C ATOM 1790 H15R OL 105 75.556 64.632 46.571 1.00 0.00 H ATOM 1791 H15S OL 105 73.940 64.225 45.821 1.00 0.00 H ATOM 1792 C116 OL 105 73.925 65.957 47.081 1.00 0.00 C ATOM 1793 H16R OL 105 72.848 66.094 46.965 1.00 0.00 H ATOM 1794 H16S OL 105 74.147 66.347 48.077 1.00 0.00 H ATOM 1795 C117 OL 105 74.415 66.958 46.069 1.00 0.00 C ATOM 1796 H17R OL 105 75.492 66.932 45.891 1.00 0.00 H ATOM 1797 H17S OL 105 73.942 66.792 45.099 1.00 0.00 H ATOM 1798 C118 OL 105 74.051 68.362 46.551 1.00 0.00 C ATOM 1799 H18R OL 105 74.508 68.517 47.531 1.00 0.00 H ATOM 1800 H18S OL 105 72.968 68.460 46.653 1.00 0.00 H ATOM 1801 H18T OL 105 74.402 69.165 45.899 1.00 0.00 H TER 1802 OL 105 ATOM 1802 C116 PA 106 44.533 84.080 53.415 1.00 0.00 C ATOM 1803 H16R PA 106 45.203 84.799 53.892 1.00 0.00 H ATOM 1804 H16S PA 106 44.134 83.452 54.214 1.00 0.00 H ATOM 1805 H16T PA 106 43.752 84.775 53.099 1.00 0.00 H ATOM 1806 C115 PA 106 45.335 83.293 52.304 1.00 0.00 C ATOM 1807 H15R PA 106 46.386 83.276 52.602 1.00 0.00 H ATOM 1808 H15S PA 106 45.352 83.985 51.460 1.00 0.00 H ATOM 1809 C114 PA 106 44.789 81.896 51.987 1.00 0.00 C ATOM 1810 H14R PA 106 45.181 81.634 51.002 1.00 0.00 H ATOM 1811 H14S PA 106 43.720 81.922 51.767 1.00 0.00 H ATOM 1812 C113 PA 106 44.937 80.821 53.034 1.00 0.00 C ATOM 1813 H13R PA 106 44.348 81.025 53.931 1.00 0.00 H ATOM 1814 H13S PA 106 45.957 80.961 53.398 1.00 0.00 H ATOM 1815 C112 PA 106 44.751 79.497 52.439 1.00 0.00 C ATOM 1816 H12R PA 106 43.841 79.458 51.837 1.00 0.00 H ATOM 1817 H12S PA 106 44.582 78.707 53.175 1.00 0.00 H ATOM 1818 C111 PA 106 45.986 79.039 51.783 1.00 0.00 C ATOM 1819 H11R PA 106 46.914 79.206 52.333 1.00 0.00 H ATOM 1820 H11S PA 106 46.200 79.605 50.874 1.00 0.00 H ATOM 1821 C110 PA 106 45.946 77.542 51.393 1.00 0.00 C ATOM 1822 H10R PA 106 44.958 77.334 50.978 1.00 0.00 H ATOM 1823 H10S PA 106 46.085 76.963 52.308 1.00 0.00 H ATOM 1824 C19 PA 106 46.966 77.215 50.314 1.00 0.00 C ATOM 1825 H9R PA 106 47.945 77.675 50.463 1.00 0.00 H ATOM 1826 H9S PA 106 46.566 77.598 49.373 1.00 0.00 H ATOM 1827 C18 PA 106 47.193 75.768 50.199 1.00 0.00 C ATOM 1828 H8R PA 106 47.678 75.358 51.088 1.00 0.00 H ATOM 1829 H8S PA 106 47.858 75.792 49.334 1.00 0.00 H ATOM 1830 C17 PA 106 46.088 74.814 49.890 1.00 0.00 C ATOM 1831 H7R PA 106 45.550 75.114 48.989 1.00 0.00 H ATOM 1832 H7S PA 106 45.525 74.816 50.826 1.00 0.00 H ATOM 1833 C16 PA 106 46.733 73.377 49.638 1.00 0.00 C ATOM 1834 H6R PA 106 47.405 73.354 48.777 1.00 0.00 H ATOM 1835 H6S PA 106 45.915 72.706 49.367 1.00 0.00 H ATOM 1836 C15 PA 106 47.626 72.776 50.748 1.00 0.00 C ATOM 1837 H5R PA 106 48.529 73.389 50.799 1.00 0.00 H ATOM 1838 H5S PA 106 48.115 71.869 50.387 1.00 0.00 H ATOM 1839 C14 PA 106 46.964 72.769 52.117 1.00 0.00 C ATOM 1840 H4R PA 106 45.976 72.327 51.973 1.00 0.00 H ATOM 1841 H4S PA 106 46.767 73.793 52.439 1.00 0.00 H ATOM 1842 C13 PA 106 47.801 72.072 53.150 1.00 0.00 C ATOM 1843 H3R PA 106 48.761 72.587 53.233 1.00 0.00 H ATOM 1844 H3S PA 106 48.169 71.177 52.644 1.00 0.00 H ATOM 1845 C12 PA 106 47.146 71.810 54.491 1.00 0.00 C ATOM 1846 H2R PA 106 46.385 71.055 54.283 1.00 0.00 H ATOM 1847 H2S PA 106 46.790 72.737 54.947 1.00 0.00 H ATOM 1848 C11 PGR 107 48.056 71.189 55.600 1.00 0.00 C ATOM 1849 O12 PGR 107 47.610 70.304 56.322 1.00 0.00 O ATOM 1850 O11 PGR 107 49.280 71.722 55.719 1.00 0.00 O ATOM 1851 C1 PGR 107 50.086 71.384 56.857 1.00 0.00 C ATOM 1852 HR PGR 107 49.456 71.570 57.730 1.00 0.00 H ATOM 1853 HS PGR 107 50.986 72.002 56.813 1.00 0.00 H ATOM 1854 C2 PGR 107 50.560 69.928 56.900 1.00 0.00 C ATOM 1855 HX PGR 107 49.755 69.199 57.027 1.00 0.00 H ATOM 1856 C3 PGR 107 51.496 69.706 58.074 1.00 0.00 C ATOM 1857 HA PGR 107 52.372 70.335 57.894 1.00 0.00 H ATOM 1858 HB PGR 107 51.966 68.720 58.058 1.00 0.00 H ATOM 1859 O31 PGR 107 50.760 69.903 59.280 1.00 0.00 O ATOM 1860 P31 PGR 107 51.491 70.005 60.756 1.00 0.00 P ATOM 1861 O32 PGR 107 52.065 68.631 61.160 1.00 0.00 O ATOM 1862 C31 PGR 107 53.175 68.058 60.439 1.00 0.00 C ATOM 1863 H1A PGR 107 53.985 68.749 60.188 1.00 0.00 H ATOM 1864 H1B PGR 107 52.826 67.567 59.527 1.00 0.00 H ATOM 1865 C32 PGR 107 53.762 66.922 61.319 1.00 0.00 C ATOM 1866 H2A PGR 107 54.628 66.507 60.796 1.00 0.00 H ATOM 1867 O35 PGR 107 52.769 65.868 61.474 1.00 0.00 O ATOM 1868 HO5A PGR 107 51.951 66.288 61.794 1.00 0.00 H ATOM 1869 C33 PGR 107 54.171 67.478 62.740 1.00 0.00 C ATOM 1870 H3A PGR 107 54.670 68.440 62.603 1.00 0.00 H ATOM 1871 H3B PGR 107 53.236 67.691 63.265 1.00 0.00 H ATOM 1872 O33 PGR 107 52.614 70.971 60.688 1.00 0.00 O ATOM 1873 O34 PGR 107 50.400 70.281 61.648 1.00 0.00 O ATOM 1874 O21 PGR 107 51.330 69.843 55.659 1.00 0.00 O ATOM 1875 C21 PGR 107 51.410 68.615 55.024 1.00 0.00 C ATOM 1876 O22 PGR 107 50.957 67.608 55.496 1.00 0.00 O ATOM 1877 O36 PGR 107 54.943 66.529 63.475 1.00 0.00 O ATOM 1878 HO6A PGR 107 55.860 66.821 63.327 1.00 0.00 H ATOM 1879 C12 OL 108 52.036 68.737 53.610 1.00 0.00 C ATOM 1880 H2R OL 108 53.064 69.068 53.769 1.00 0.00 H ATOM 1881 H2S OL 108 52.057 67.745 53.154 1.00 0.00 H ATOM 1882 C13 OL 108 51.383 69.874 52.867 1.00 0.00 C ATOM 1883 H3R OL 108 50.291 69.838 52.879 1.00 0.00 H ATOM 1884 H3S OL 108 51.753 70.769 53.371 1.00 0.00 H ATOM 1885 C14 OL 108 51.933 70.029 51.481 1.00 0.00 C ATOM 1886 H4R OL 108 53.014 70.057 51.329 1.00 0.00 H ATOM 1887 H4S OL 108 51.617 69.214 50.826 1.00 0.00 H ATOM 1888 C15 OL 108 51.434 71.361 50.865 1.00 0.00 C ATOM 1889 H5R OL 108 50.372 71.396 51.115 1.00 0.00 H ATOM 1890 H5S OL 108 51.834 72.238 51.378 1.00 0.00 H ATOM 1891 C16 OL 108 51.555 71.323 49.404 1.00 0.00 C ATOM 1892 H6R OL 108 52.613 71.445 49.163 1.00 0.00 H ATOM 1893 H6S OL 108 51.148 70.409 48.966 1.00 0.00 H ATOM 1894 C17 OL 108 50.892 72.525 48.761 1.00 0.00 C ATOM 1895 H7R OL 108 49.811 72.391 48.833 1.00 0.00 H ATOM 1896 H7S OL 108 51.166 73.409 49.341 1.00 0.00 H ATOM 1897 C18 OL 108 51.438 72.864 47.328 1.00 0.00 C ATOM 1898 H8R OL 108 52.478 73.156 47.489 1.00 0.00 H ATOM 1899 H8S OL 108 51.426 71.959 46.716 1.00 0.00 H ATOM 1900 C19 OL 108 50.640 73.902 46.607 1.00 0.00 C ATOM 1901 H9R OL 108 49.556 73.828 46.642 1.00 0.00 H ATOM 1902 C110 OL 108 51.078 74.902 45.982 1.00 0.00 C ATOM 1903 H10R OL 108 50.387 75.654 45.608 1.00 0.00 H ATOM 1904 C111 OL 108 52.521 75.228 45.799 1.00 0.00 C ATOM 1905 H11R OL 108 52.657 76.279 45.535 1.00 0.00 H ATOM 1906 H11S OL 108 53.117 74.958 46.673 1.00 0.00 H ATOM 1907 C112 OL 108 53.076 74.373 44.671 1.00 0.00 C ATOM 1908 H12R OL 108 52.742 73.342 44.807 1.00 0.00 H ATOM 1909 H12S OL 108 52.608 74.808 43.785 1.00 0.00 H ATOM 1910 C113 OL 108 54.602 74.384 44.592 1.00 0.00 C ATOM 1911 H13R OL 108 55.051 75.354 44.818 1.00 0.00 H ATOM 1912 H13S OL 108 55.050 73.801 45.400 1.00 0.00 H ATOM 1913 C114 OL 108 55.141 73.765 43.321 1.00 0.00 C ATOM 1914 H14R OL 108 54.401 73.058 42.942 1.00 0.00 H ATOM 1915 H14S OL 108 55.138 74.639 42.666 1.00 0.00 H ATOM 1916 C115 OL 108 56.606 73.306 43.430 1.00 0.00 C ATOM 1917 H15R OL 108 57.025 73.430 42.429 1.00 0.00 H ATOM 1918 H15S OL 108 57.105 73.984 44.125 1.00 0.00 H ATOM 1919 C116 OL 108 56.777 71.859 43.813 1.00 0.00 C ATOM 1920 H16R OL 108 56.190 71.730 44.725 1.00 0.00 H ATOM 1921 H16S OL 108 56.187 71.258 43.118 1.00 0.00 H ATOM 1922 C117 OL 108 58.266 71.350 43.903 1.00 0.00 C ATOM 1923 H17R OL 108 58.726 71.952 44.690 1.00 0.00 H ATOM 1924 H17S OL 108 58.063 70.343 44.273 1.00 0.00 H ATOM 1925 C118 OL 108 59.139 71.364 42.588 1.00 0.00 C ATOM 1926 H18R OL 108 58.760 70.825 41.717 1.00 0.00 H ATOM 1927 H18S OL 108 60.130 71.004 42.871 1.00 0.00 H ATOM 1928 H18T OL 108 59.204 72.392 42.226 1.00 0.00 H TER 1929 OL 108 ATOM 1929 C116 PA 109 64.071 64.779 45.350 1.00 0.00 C ATOM 1930 H16R PA 109 63.424 65.639 45.162 1.00 0.00 H ATOM 1931 H16S PA 109 63.531 64.165 46.073 1.00 0.00 H ATOM 1932 H16T PA 109 64.251 64.166 44.465 1.00 0.00 H ATOM 1933 C115 PA 109 65.448 65.214 45.724 1.00 0.00 C ATOM 1934 H15R PA 109 65.876 65.869 44.962 1.00 0.00 H ATOM 1935 H15S PA 109 66.098 64.338 45.671 1.00 0.00 H ATOM 1936 C114 PA 109 65.533 66.073 47.057 1.00 0.00 C ATOM 1937 H14R PA 109 65.343 65.533 47.987 1.00 0.00 H ATOM 1938 H14S PA 109 64.749 66.832 47.023 1.00 0.00 H ATOM 1939 C113 PA 109 66.886 66.840 47.320 1.00 0.00 C ATOM 1940 H13R PA 109 67.626 66.062 47.514 1.00 0.00 H ATOM 1941 H13S PA 109 66.837 67.345 48.287 1.00 0.00 H ATOM 1942 C112 PA 109 67.490 67.844 46.242 1.00 0.00 C ATOM 1943 H12R PA 109 67.964 67.294 45.427 1.00 0.00 H ATOM 1944 H12S PA 109 68.393 68.334 46.612 1.00 0.00 H ATOM 1945 C111 PA 109 66.524 68.951 45.699 1.00 0.00 C ATOM 1946 H11R PA 109 65.611 68.442 45.382 1.00 0.00 H ATOM 1947 H11S PA 109 67.003 69.443 44.851 1.00 0.00 H ATOM 1948 C110 PA 109 65.900 70.004 46.616 1.00 0.00 C ATOM 1949 H10R PA 109 65.228 69.372 47.201 1.00 0.00 H ATOM 1950 H10S PA 109 65.129 70.590 46.112 1.00 0.00 H ATOM 1951 C19 PA 109 66.897 70.926 47.324 1.00 0.00 C ATOM 1952 H9R PA 109 67.352 71.317 46.412 1.00 0.00 H ATOM 1953 H9S PA 109 67.607 70.238 47.787 1.00 0.00 H ATOM 1954 C18 PA 109 66.460 71.825 48.458 1.00 0.00 C ATOM 1955 H8R PA 109 65.755 71.333 49.131 1.00 0.00 H ATOM 1956 H8S PA 109 65.808 72.588 48.028 1.00 0.00 H ATOM 1957 C17 PA 109 67.567 72.478 49.197 1.00 0.00 C ATOM 1958 H7R PA 109 68.019 71.750 49.875 1.00 0.00 H ATOM 1959 H7S PA 109 67.105 73.191 49.883 1.00 0.00 H ATOM 1960 C16 PA 109 68.506 73.148 48.260 1.00 0.00 C ATOM 1961 H6R PA 109 67.827 73.847 47.767 1.00 0.00 H ATOM 1962 H6S PA 109 68.815 72.468 47.464 1.00 0.00 H ATOM 1963 C15 PA 109 69.729 73.715 48.985 1.00 0.00 C ATOM 1964 H5R PA 109 70.378 74.337 48.365 1.00 0.00 H ATOM 1965 H5S PA 109 70.389 72.879 49.226 1.00 0.00 H ATOM 1966 C14 PA 109 69.539 74.524 50.222 1.00 0.00 C ATOM 1967 H4R PA 109 69.128 73.888 51.008 1.00 0.00 H ATOM 1968 H4S PA 109 68.895 75.388 50.043 1.00 0.00 H ATOM 1969 C13 PA 109 70.870 75.170 50.704 1.00 0.00 C ATOM 1970 H3R PA 109 70.540 76.048 51.262 1.00 0.00 H ATOM 1971 H3S PA 109 71.491 75.488 49.863 1.00 0.00 H ATOM 1972 C12 PA 109 71.650 74.238 51.684 1.00 0.00 C ATOM 1973 H2R PA 109 71.772 73.305 51.131 1.00 0.00 H ATOM 1974 H2S PA 109 71.025 73.973 52.539 1.00 0.00 H ATOM 1975 C11 PGR 110 73.012 74.764 52.078 1.00 0.00 C ATOM 1976 O12 PGR 110 73.442 75.865 51.852 1.00 0.00 O ATOM 1977 O11 PGR 110 73.836 73.825 52.730 1.00 0.00 O ATOM 1978 C1 PGR 110 75.290 74.131 53.015 1.00 0.00 C ATOM 1979 HR PGR 110 75.800 74.466 52.109 1.00 0.00 H ATOM 1980 HS PGR 110 75.811 73.227 53.341 1.00 0.00 H ATOM 1981 C2 PGR 110 75.443 75.246 54.119 1.00 0.00 C ATOM 1982 HX PGR 110 76.354 74.916 54.624 1.00 0.00 H ATOM 1983 C3 PGR 110 74.316 75.137 55.146 1.00 0.00 C ATOM 1984 HA PGR 110 74.208 74.116 55.521 1.00 0.00 H ATOM 1985 HB PGR 110 73.450 75.466 54.566 1.00 0.00 H ATOM 1986 O31 PGR 110 74.678 76.058 56.149 1.00 0.00 O ATOM 1987 P31 PGR 110 75.412 75.684 57.426 1.00 0.00 P ATOM 1988 O32 PGR 110 74.294 74.816 58.199 1.00 0.00 O ATOM 1989 C31 PGR 110 73.327 75.429 59.076 1.00 0.00 C ATOM 1990 H1A PGR 110 72.458 74.805 59.299 1.00 0.00 H ATOM 1991 H1B PGR 110 73.003 76.410 58.718 1.00 0.00 H ATOM 1992 C32 PGR 110 73.844 75.681 60.481 1.00 0.00 C ATOM 1993 H2A PGR 110 74.720 76.318 60.333 1.00 0.00 H ATOM 1994 O35 PGR 110 74.313 74.455 61.043 1.00 0.00 O ATOM 1995 HO5A PGR 110 74.624 74.630 61.949 1.00 0.00 H ATOM 1996 C33 PGR 110 72.668 76.342 61.276 1.00 0.00 C ATOM 1997 H3A PGR 110 73.088 76.415 62.282 1.00 0.00 H ATOM 1998 H3B PGR 110 72.497 77.347 60.883 1.00 0.00 H ATOM 1999 O33 PGR 110 76.523 74.820 57.064 1.00 0.00 O ATOM 2000 O34 PGR 110 75.643 76.887 58.199 1.00 0.00 O ATOM 2001 O21 PGR 110 75.569 76.570 53.652 1.00 0.00 O ATOM 2002 C21 PGR 110 76.655 76.824 52.826 1.00 0.00 C ATOM 2003 O22 PGR 110 77.471 75.954 52.508 1.00 0.00 O ATOM 2004 O36 PGR 110 71.442 75.637 61.151 1.00 0.00 O ATOM 2005 HO6A PGR 110 70.747 76.105 61.647 1.00 0.00 H ATOM 2006 C12 OL 111 76.566 78.255 52.323 1.00 0.00 C ATOM 2007 H2R OL 111 75.910 78.212 51.451 1.00 0.00 H ATOM 2008 H2S OL 111 76.071 78.904 53.048 1.00 0.00 H ATOM 2009 C13 OL 111 77.922 78.868 52.109 1.00 0.00 C ATOM 2010 H3R OL 111 78.483 78.704 53.031 1.00 0.00 H ATOM 2011 H3S OL 111 78.438 78.378 51.281 1.00 0.00 H ATOM 2012 C14 OL 111 77.962 80.357 51.808 1.00 0.00 C ATOM 2013 H4R OL 111 77.669 80.550 50.774 1.00 0.00 H ATOM 2014 H4S OL 111 77.358 80.907 52.533 1.00 0.00 H ATOM 2015 C15 OL 111 79.320 80.914 52.142 1.00 0.00 C ATOM 2016 H5R OL 111 79.277 81.988 52.339 1.00 0.00 H ATOM 2017 H5S OL 111 79.676 80.470 53.074 1.00 0.00 H ATOM 2018 C16 OL 111 80.375 80.687 51.083 1.00 0.00 C ATOM 2019 H6R OL 111 80.414 79.625 50.831 1.00 0.00 H ATOM 2020 H6S OL 111 80.062 81.251 50.202 1.00 0.00 H ATOM 2021 C17 OL 111 81.868 80.852 51.444 1.00 0.00 C ATOM 2022 H7R OL 111 81.974 81.911 51.689 1.00 0.00 H ATOM 2023 H7S OL 111 82.085 80.354 52.391 1.00 0.00 H ATOM 2024 C18 OL 111 82.845 80.430 50.372 1.00 0.00 C ATOM 2025 H8R OL 111 83.904 80.464 50.637 1.00 0.00 H ATOM 2026 H8S OL 111 82.581 79.433 50.013 1.00 0.00 H ATOM 2027 C19 OL 111 82.660 81.231 49.157 1.00 0.00 C ATOM 2028 H9R OL 111 82.544 82.297 49.333 1.00 0.00 H ATOM 2029 C110 OL 111 82.980 80.877 47.927 1.00 0.00 C ATOM 2030 H10R OL 111 82.891 81.565 47.090 1.00 0.00 H ATOM 2031 C111 OL 111 83.393 79.469 47.458 1.00 0.00 C ATOM 2032 H11R OL 111 83.240 78.599 48.100 1.00 0.00 H ATOM 2033 H11S OL 111 82.851 79.107 46.582 1.00 0.00 H ATOM 2034 C112 OL 111 84.887 79.519 46.996 1.00 0.00 C ATOM 2035 H12R OL 111 85.009 80.430 46.407 1.00 0.00 H ATOM 2036 H12S OL 111 85.578 79.573 47.839 1.00 0.00 H ATOM 2037 C113 OL 111 85.292 78.462 45.990 1.00 0.00 C ATOM 2038 H13R OL 111 85.461 77.516 46.510 1.00 0.00 H ATOM 2039 H13S OL 111 84.482 78.239 45.292 1.00 0.00 H ATOM 2040 C114 OL 111 86.602 78.799 45.426 1.00 0.00 C ATOM 2041 H14R OL 111 86.446 79.563 44.661 1.00 0.00 H ATOM 2042 H14S OL 111 87.211 79.109 46.278 1.00 0.00 H ATOM 2043 C115 OL 111 87.490 77.836 44.721 1.00 0.00 C ATOM 2044 H15R OL 111 87.018 77.502 43.794 1.00 0.00 H ATOM 2045 H15S OL 111 88.375 78.321 44.304 1.00 0.00 H ATOM 2046 C116 OL 111 87.743 76.596 45.526 1.00 0.00 C ATOM 2047 H16R OL 111 88.388 76.911 46.350 1.00 0.00 H ATOM 2048 H16S OL 111 86.864 76.075 45.908 1.00 0.00 H ATOM 2049 C117 OL 111 88.535 75.518 44.819 1.00 0.00 C ATOM 2050 H17R OL 111 88.249 74.483 45.021 1.00 0.00 H ATOM 2051 H17S OL 111 88.235 75.637 43.776 1.00 0.00 H ATOM 2052 C118 OL 111 90.006 75.681 44.766 1.00 0.00 C ATOM 2053 H18R OL 111 90.270 76.726 44.941 1.00 0.00 H ATOM 2054 H18S OL 111 90.462 75.324 43.840 1.00 0.00 H ATOM 2055 H18T OL 111 90.609 75.195 45.536 1.00 0.00 H TER 2056 OL 111 ATOM 2056 C116 PA 112 95.710 78.678 41.721 1.00 0.00 C ATOM 2057 H16R PA 112 96.554 78.239 42.257 1.00 0.00 H ATOM 2058 H16S PA 112 95.319 79.627 42.095 1.00 0.00 H ATOM 2059 H16T PA 112 96.082 78.867 40.712 1.00 0.00 H ATOM 2060 C115 PA 112 94.516 77.733 41.829 1.00 0.00 C ATOM 2061 H15R PA 112 94.700 76.805 41.283 1.00 0.00 H ATOM 2062 H15S PA 112 93.673 78.281 41.404 1.00 0.00 H ATOM 2063 C114 PA 112 94.213 77.283 43.234 1.00 0.00 C ATOM 2064 H14R PA 112 95.039 76.741 43.699 1.00 0.00 H ATOM 2065 H14S PA 112 93.372 76.594 43.127 1.00 0.00 H ATOM 2066 C113 PA 112 93.753 78.378 44.200 1.00 0.00 C ATOM 2067 H13R PA 112 92.806 78.774 43.828 1.00 0.00 H ATOM 2068 H13S PA 112 94.492 79.179 44.264 1.00 0.00 H ATOM 2069 C112 PA 112 93.283 77.852 45.593 1.00 0.00 C ATOM 2070 H12R PA 112 92.443 77.177 45.415 1.00 0.00 H ATOM 2071 H12S PA 112 92.974 78.719 46.181 1.00 0.00 H ATOM 2072 C111 PA 112 94.479 77.243 46.287 1.00 0.00 C ATOM 2073 H11R PA 112 95.229 78.012 46.480 1.00 0.00 H ATOM 2074 H11S PA 112 94.834 76.429 45.652 1.00 0.00 H ATOM 2075 C110 PA 112 94.342 76.551 47.582 1.00 0.00 C ATOM 2076 H10R PA 112 93.687 75.678 47.533 1.00 0.00 H ATOM 2077 H10S PA 112 93.839 77.095 48.384 1.00 0.00 H ATOM 2078 C19 PA 112 95.740 76.179 48.261 1.00 0.00 C ATOM 2079 H9R PA 112 96.514 76.921 48.054 1.00 0.00 H ATOM 2080 H9S PA 112 96.214 75.308 47.803 1.00 0.00 H ATOM 2081 C18 PA 112 95.556 75.943 49.805 1.00 0.00 C ATOM 2082 H8R PA 112 94.970 76.718 50.304 1.00 0.00 H ATOM 2083 H8S PA 112 96.537 75.989 50.283 1.00 0.00 H ATOM 2084 C17 PA 112 94.985 74.600 50.119 1.00 0.00 C ATOM 2085 H7R PA 112 95.760 73.887 49.830 1.00 0.00 H ATOM 2086 H7S PA 112 94.068 74.408 49.558 1.00 0.00 H ATOM 2087 C16 PA 112 94.562 74.396 51.589 1.00 0.00 C ATOM 2088 H6R PA 112 94.267 73.395 51.911 1.00 0.00 H ATOM 2089 H6S PA 112 93.705 75.042 51.790 1.00 0.00 H ATOM 2090 C15 PA 112 95.651 74.884 52.597 1.00 0.00 C ATOM 2091 H5R PA 112 95.791 75.966 52.556 1.00 0.00 H ATOM 2092 H5S PA 112 96.545 74.336 52.291 1.00 0.00 H ATOM 2093 C14 PA 112 95.267 74.487 54.074 1.00 0.00 C ATOM 2094 H4R PA 112 95.279 73.403 54.211 1.00 0.00 H ATOM 2095 H4S PA 112 94.300 74.857 54.422 1.00 0.00 H ATOM 2096 C13 PA 112 96.155 75.039 55.182 1.00 0.00 C ATOM 2097 H3R PA 112 95.579 75.581 55.935 1.00 0.00 H ATOM 2098 H3S PA 112 96.611 75.941 54.769 1.00 0.00 H ATOM 2099 C12 PA 112 97.226 74.087 55.728 1.00 0.00 C ATOM 2100 H2R PA 112 97.891 74.777 56.251 1.00 0.00 H ATOM 2101 H2S PA 112 97.764 73.645 54.887 1.00 0.00 H ATOM 2102 C11 PC 113 96.764 73.069 56.617 1.00 0.00 C ATOM 2103 O12 PC 113 97.250 71.939 56.551 1.00 0.00 O ATOM 2104 O11 PC 113 95.755 73.457 57.426 1.00 0.00 O ATOM 2105 C1 PC 113 95.224 72.646 58.511 1.00 0.00 C ATOM 2106 HR PC 113 95.918 72.646 59.355 1.00 0.00 H ATOM 2107 HS PC 113 95.065 71.626 58.153 1.00 0.00 H ATOM 2108 C2 PC 113 93.919 73.433 58.920 1.00 0.00 C ATOM 2109 HX PC 113 94.118 74.489 59.122 1.00 0.00 H ATOM 2110 C3 PC 113 93.362 72.825 60.271 1.00 0.00 C ATOM 2111 HA PC 113 92.504 73.387 60.647 1.00 0.00 H ATOM 2112 HB PC 113 94.058 73.029 61.088 1.00 0.00 H ATOM 2113 O31 PC 113 93.100 71.391 60.147 1.00 0.00 O ATOM 2114 P31 PC 113 92.185 70.669 61.206 1.00 0.00 P ATOM 2115 O32 PC 113 93.025 70.717 62.586 1.00 0.00 O ATOM 2116 C31 PC 113 94.072 69.837 62.811 1.00 0.00 C ATOM 2117 H1A PC 113 94.903 70.036 62.130 1.00 0.00 H ATOM 2118 H1B PC 113 93.724 68.808 62.691 1.00 0.00 H ATOM 2119 C32 PC 113 94.530 70.023 64.298 1.00 0.00 C ATOM 2120 H2A PC 113 93.866 70.778 64.721 1.00 0.00 H ATOM 2121 H2B PC 113 95.499 70.524 64.304 1.00 0.00 H ATOM 2122 N31 PC 113 94.605 68.888 65.167 1.00 0.00 N ATOM 2123 C33 PC 113 93.258 68.257 65.329 1.00 0.00 C ATOM 2124 H3A PC 113 92.650 69.034 65.795 1.00 0.00 H ATOM 2125 H3B PC 113 93.342 67.368 65.956 1.00 0.00 H ATOM 2126 H3C PC 113 92.779 68.026 64.377 1.00 0.00 H ATOM 2127 C34 PC 113 95.652 67.897 64.754 1.00 0.00 C ATOM 2128 H4A PC 113 95.285 67.512 63.802 1.00 0.00 H ATOM 2129 H4B PC 113 95.765 67.028 65.405 1.00 0.00 H ATOM 2130 H4C PC 113 96.617 68.391 64.629 1.00 0.00 H ATOM 2131 C35 PC 113 95.009 69.334 66.540 1.00 0.00 C ATOM 2132 H5A PC 113 95.008 68.388 67.083 1.00 0.00 H ATOM 2133 H5B PC 113 94.234 70.030 66.864 1.00 0.00 H ATOM 2134 H5C PC 113 96.028 69.723 66.558 1.00 0.00 H ATOM 2135 O33 PC 113 91.006 71.490 61.357 1.00 0.00 O ATOM 2136 O34 PC 113 92.114 69.246 60.799 1.00 0.00 O ATOM 2137 O21 PC 113 92.966 73.257 57.873 1.00 0.00 O ATOM 2138 C21 PC 113 91.848 74.012 57.866 1.00 0.00 C ATOM 2139 O22 PC 113 91.793 75.183 58.294 1.00 0.00 O ATOM 2140 C12 OL 114 90.644 73.268 57.307 1.00 0.00 C ATOM 2141 H2R OL 114 89.881 73.359 58.083 1.00 0.00 H ATOM 2142 H2S OL 114 90.183 73.786 56.463 1.00 0.00 H ATOM 2143 C13 OL 114 90.837 71.744 57.087 1.00 0.00 C ATOM 2144 H3R OL 114 91.427 71.360 57.922 1.00 0.00 H ATOM 2145 H3S OL 114 89.831 71.331 57.190 1.00 0.00 H ATOM 2146 C14 OL 114 91.478 71.292 55.721 1.00 0.00 C ATOM 2147 H4R OL 114 90.868 71.620 54.877 1.00 0.00 H ATOM 2148 H4S OL 114 92.426 71.821 55.596 1.00 0.00 H ATOM 2149 C15 OL 114 91.616 69.785 55.631 1.00 0.00 C ATOM 2150 H5R OL 114 90.760 69.190 55.956 1.00 0.00 H ATOM 2151 H5S OL 114 91.497 69.547 54.572 1.00 0.00 H ATOM 2152 C16 OL 114 92.843 69.104 56.277 1.00 0.00 C ATOM 2153 H6R OL 114 92.827 69.446 57.314 1.00 0.00 H ATOM 2154 H6S OL 114 92.692 68.024 56.342 1.00 0.00 H ATOM 2155 C17 OL 114 94.175 69.535 55.850 1.00 0.00 C ATOM 2156 H7R OL 114 94.319 70.616 55.796 1.00 0.00 H ATOM 2157 H7S OL 114 94.951 69.232 56.557 1.00 0.00 H ATOM 2158 C18 OL 114 94.584 69.082 54.459 1.00 0.00 C ATOM 2159 H8R OL 114 94.410 68.011 54.341 1.00 0.00 H ATOM 2160 H8S OL 114 94.059 69.572 53.636 1.00 0.00 H ATOM 2161 C19 OL 114 96.086 69.330 54.283 1.00 0.00 C ATOM 2162 H9R OL 114 96.773 68.952 55.036 1.00 0.00 H ATOM 2163 C110 OL 114 96.669 69.833 53.242 1.00 0.00 C ATOM 2164 H10R OL 114 97.752 69.882 53.161 1.00 0.00 H ATOM 2165 C111 OL 114 95.912 70.265 52.030 1.00 0.00 C ATOM 2166 H11R OL 114 94.874 69.927 52.027 1.00 0.00 H ATOM 2167 H11S OL 114 95.874 71.357 52.023 1.00 0.00 H ATOM 2168 C112 OL 114 96.457 69.965 50.647 1.00 0.00 C ATOM 2169 H12R OL 114 97.509 70.237 50.540 1.00 0.00 H ATOM 2170 H12S OL 114 96.387 68.883 50.517 1.00 0.00 H ATOM 2171 C113 OL 114 95.468 70.360 49.575 1.00 0.00 C ATOM 2172 H13R OL 114 94.480 70.008 49.879 1.00 0.00 H ATOM 2173 H13S OL 114 95.416 71.447 49.482 1.00 0.00 H ATOM 2174 C114 OL 114 95.813 69.878 48.146 1.00 0.00 C ATOM 2175 H14R OL 114 96.901 69.962 48.134 1.00 0.00 H ATOM 2176 H14S OL 114 95.532 68.839 47.961 1.00 0.00 H ATOM 2177 C115 OL 114 95.361 70.775 47.030 1.00 0.00 C ATOM 2178 H15R OL 114 95.863 71.742 47.106 1.00 0.00 H ATOM 2179 H15S OL 114 95.758 70.276 46.144 1.00 0.00 H ATOM 2180 C116 OL 114 93.836 70.837 46.923 1.00 0.00 C ATOM 2181 H16R OL 114 93.338 69.997 47.412 1.00 0.00 H ATOM 2182 H16S OL 114 93.564 71.756 47.447 1.00 0.00 H ATOM 2183 C117 OL 114 93.366 70.951 45.443 1.00 0.00 C ATOM 2184 H17R OL 114 93.999 71.667 44.915 1.00 0.00 H ATOM 2185 H17S OL 114 93.409 69.971 44.963 1.00 0.00 H ATOM 2186 C118 OL 114 91.891 71.445 45.305 1.00 0.00 C ATOM 2187 H18R OL 114 91.860 72.384 45.862 1.00 0.00 H ATOM 2188 H18S OL 114 91.145 70.793 45.765 1.00 0.00 H ATOM 2189 H18T OL 114 91.563 71.526 44.267 1.00 0.00 H TER 2190 OL 114 ATOM 2190 C116 PA 115 78.637 90.096 38.770 1.00 0.00 C ATOM 2191 H16R PA 115 79.013 90.244 37.756 1.00 0.00 H ATOM 2192 H16S PA 115 79.506 90.256 39.412 1.00 0.00 H ATOM 2193 H16T PA 115 77.928 90.908 38.946 1.00 0.00 H ATOM 2194 C115 PA 115 77.928 88.780 38.777 1.00 0.00 C ATOM 2195 H15R PA 115 78.686 88.066 38.446 1.00 0.00 H ATOM 2196 H15S PA 115 77.094 88.882 38.080 1.00 0.00 H ATOM 2197 C114 PA 115 77.232 88.249 40.054 1.00 0.00 C ATOM 2198 H14R PA 115 76.322 88.852 40.068 1.00 0.00 H ATOM 2199 H14S PA 115 77.925 88.460 40.871 1.00 0.00 H ATOM 2200 C113 PA 115 76.804 86.763 40.057 1.00 0.00 C ATOM 2201 H13R PA 115 77.633 86.117 39.759 1.00 0.00 H ATOM 2202 H13S PA 115 76.041 86.598 39.294 1.00 0.00 H ATOM 2203 C112 PA 115 76.296 86.431 41.483 1.00 0.00 C ATOM 2204 H12R PA 115 75.222 86.605 41.576 1.00 0.00 H ATOM 2205 H12S PA 115 76.847 87.029 42.212 1.00 0.00 H ATOM 2206 C111 PA 115 76.508 84.953 41.836 1.00 0.00 C ATOM 2207 H11R PA 115 77.561 84.742 42.036 1.00 0.00 H ATOM 2208 H11S PA 115 76.169 84.320 41.014 1.00 0.00 H ATOM 2209 C110 PA 115 75.634 84.548 42.995 1.00 0.00 C ATOM 2210 H10R PA 115 75.493 83.469 42.903 1.00 0.00 H ATOM 2211 H10S PA 115 74.641 84.988 42.881 1.00 0.00 H ATOM 2212 C19 PA 115 76.101 85.043 44.304 1.00 0.00 C ATOM 2213 H9R PA 115 75.838 86.103 44.302 1.00 0.00 H ATOM 2214 H9S PA 115 77.184 84.914 44.351 1.00 0.00 H ATOM 2215 C18 PA 115 75.330 84.342 45.430 1.00 0.00 C ATOM 2216 H8R PA 115 75.585 83.281 45.465 1.00 0.00 H ATOM 2217 H8S PA 115 74.245 84.385 45.319 1.00 0.00 H ATOM 2218 C17 PA 115 75.626 84.896 46.818 1.00 0.00 C ATOM 2219 H7R PA 115 75.046 85.815 46.926 1.00 0.00 H ATOM 2220 H7S PA 115 76.687 85.156 46.834 1.00 0.00 H ATOM 2221 C16 PA 115 75.347 83.943 47.880 1.00 0.00 C ATOM 2222 H6R PA 115 75.842 82.990 47.686 1.00 0.00 H ATOM 2223 H6S PA 115 74.288 83.697 47.783 1.00 0.00 H ATOM 2224 C15 PA 115 75.712 84.542 49.268 1.00 0.00 C ATOM 2225 H5R PA 115 74.789 84.864 49.752 1.00 0.00 H ATOM 2226 H5S PA 115 76.274 85.467 49.125 1.00 0.00 H ATOM 2227 C14 PA 115 76.343 83.540 50.225 1.00 0.00 C ATOM 2228 H4R PA 115 77.354 83.288 49.899 1.00 0.00 H ATOM 2229 H4S PA 115 75.793 82.601 50.137 1.00 0.00 H ATOM 2230 C13 PA 115 76.513 83.938 51.667 1.00 0.00 C ATOM 2231 H3R PA 115 77.218 84.766 51.573 1.00 0.00 H ATOM 2232 H3S PA 115 77.026 83.062 52.070 1.00 0.00 H ATOM 2233 C12 PA 115 75.269 84.262 52.426 1.00 0.00 C ATOM 2234 H2R PA 115 74.563 84.941 51.943 1.00 0.00 H ATOM 2235 H2S PA 115 74.776 83.289 52.480 1.00 0.00 H ATOM 2236 C11 PGR 116 75.568 84.762 53.820 1.00 0.00 C ATOM 2237 O12 PGR 116 76.452 84.231 54.481 1.00 0.00 O ATOM 2238 O11 PGR 116 74.759 85.844 54.045 1.00 0.00 O ATOM 2239 C1 PGR 116 75.026 86.571 55.308 1.00 0.00 C ATOM 2240 HR PGR 116 74.996 85.824 56.106 1.00 0.00 H ATOM 2241 HS PGR 116 74.301 87.343 55.578 1.00 0.00 H ATOM 2242 C2 PGR 116 76.414 87.309 55.238 1.00 0.00 C ATOM 2243 HX PGR 116 77.180 86.576 54.972 1.00 0.00 H ATOM 2244 C3 PGR 116 76.839 87.919 56.549 1.00 0.00 C ATOM 2245 HA PGR 116 76.230 87.346 57.252 1.00 0.00 H ATOM 2246 HB PGR 116 76.447 88.925 56.718 1.00 0.00 H ATOM 2247 O31 PGR 116 78.171 87.737 57.033 1.00 0.00 O ATOM 2248 P31 PGR 116 78.723 86.447 57.778 1.00 0.00 P ATOM 2249 O32 PGR 116 78.818 85.322 56.672 1.00 0.00 O ATOM 2250 C31 PGR 116 79.978 85.084 55.935 1.00 0.00 C ATOM 2251 H1A PGR 116 80.854 84.922 56.569 1.00 0.00 H ATOM 2252 H1B PGR 116 80.147 85.871 55.195 1.00 0.00 H ATOM 2253 C32 PGR 116 79.840 83.693 55.244 1.00 0.00 C ATOM 2254 H2A PGR 116 79.130 83.725 54.414 1.00 0.00 H ATOM 2255 O35 PGR 116 79.385 82.710 56.193 1.00 0.00 O ATOM 2256 HO5A PGR 116 79.943 82.813 56.985 1.00 0.00 H ATOM 2257 C33 PGR 116 81.156 83.178 54.634 1.00 0.00 C ATOM 2258 H3A PGR 116 80.908 82.208 54.195 1.00 0.00 H ATOM 2259 H3B PGR 116 81.616 83.947 54.009 1.00 0.00 H ATOM 2260 O33 PGR 116 80.065 86.746 58.242 1.00 0.00 O ATOM 2261 O34 PGR 116 77.701 86.003 58.799 1.00 0.00 O ATOM 2262 O21 PGR 116 76.359 88.276 54.151 1.00 0.00 O ATOM 2263 C21 PGR 116 76.487 87.855 52.930 1.00 0.00 C ATOM 2264 O22 PGR 116 77.164 86.942 52.583 1.00 0.00 O ATOM 2265 O36 PGR 116 82.170 82.931 55.693 1.00 0.00 O ATOM 2266 HO6A PGR 116 81.850 82.203 56.256 1.00 0.00 H ATOM 2267 C12 OL 117 75.937 88.826 51.968 1.00 0.00 C ATOM 2268 H2R OL 117 76.613 89.631 51.673 1.00 0.00 H ATOM 2269 H2S OL 117 75.784 88.288 51.030 1.00 0.00 H ATOM 2270 C13 OL 117 74.477 89.184 52.366 1.00 0.00 C ATOM 2271 H3R OL 117 73.911 88.286 52.625 1.00 0.00 H ATOM 2272 H3S OL 117 74.451 89.868 53.216 1.00 0.00 H ATOM 2273 C14 OL 117 73.672 89.722 51.198 1.00 0.00 C ATOM 2274 H4R OL 117 73.846 89.102 50.315 1.00 0.00 H ATOM 2275 H4S OL 117 72.643 89.730 51.561 1.00 0.00 H ATOM 2276 C15 OL 117 74.058 91.186 50.830 1.00 0.00 C ATOM 2277 H5R OL 117 73.739 91.708 51.735 1.00 0.00 H ATOM 2278 H5S OL 117 75.143 91.235 50.726 1.00 0.00 H ATOM 2279 C16 OL 117 73.414 91.706 49.566 1.00 0.00 C ATOM 2280 H6R OL 117 73.324 90.854 48.889 1.00 0.00 H ATOM 2281 H6S OL 117 72.381 92.013 49.737 1.00 0.00 H ATOM 2282 C17 OL 117 74.138 92.901 48.964 1.00 0.00 C ATOM 2283 H7R OL 117 75.051 92.723 48.392 1.00 0.00 H ATOM 2284 H7S OL 117 73.553 93.208 48.095 1.00 0.00 H ATOM 2285 C18 OL 117 74.175 94.185 49.811 1.00 0.00 C ATOM 2286 H8R OL 117 73.766 94.958 49.156 1.00 0.00 H ATOM 2287 H8S OL 117 73.503 94.214 50.672 1.00 0.00 H ATOM 2288 C19 OL 117 75.690 94.341 50.151 1.00 0.00 C ATOM 2289 H9R OL 117 76.060 93.504 50.737 1.00 0.00 H ATOM 2290 C110 OL 117 76.544 95.313 49.789 1.00 0.00 C ATOM 2291 H10R OL 117 77.555 95.224 50.177 1.00 0.00 H ATOM 2292 C111 OL 117 76.242 96.566 49.022 1.00 0.00 C ATOM 2293 H11R OL 117 75.157 96.677 48.964 1.00 0.00 H ATOM 2294 H11S OL 117 76.637 97.361 49.658 1.00 0.00 H ATOM 2295 C112 OL 117 76.891 96.550 47.631 1.00 0.00 C ATOM 2296 H12R OL 117 76.938 97.583 47.280 1.00 0.00 H ATOM 2297 H12S OL 117 77.934 96.232 47.571 1.00 0.00 H ATOM 2298 C113 OL 117 76.212 95.762 46.461 1.00 0.00 C ATOM 2299 H13R OL 117 76.892 95.869 45.613 1.00 0.00 H ATOM 2300 H13S OL 117 76.363 94.761 46.872 1.00 0.00 H ATOM 2301 C114 OL 117 74.794 96.179 46.093 1.00 0.00 C ATOM 2302 H14R OL 117 74.067 95.904 46.860 1.00 0.00 H ATOM 2303 H14S OL 117 74.749 97.269 46.028 1.00 0.00 H ATOM 2304 C115 OL 117 74.213 95.478 44.855 1.00 0.00 C ATOM 2305 H15R OL 117 74.834 95.780 44.009 1.00 0.00 H ATOM 2306 H15S OL 117 74.264 94.397 44.994 1.00 0.00 H ATOM 2307 C116 OL 117 72.702 95.832 44.451 1.00 0.00 C ATOM 2308 H16R OL 117 72.033 95.826 45.314 1.00 0.00 H ATOM 2309 H16S OL 117 72.670 96.827 44.002 1.00 0.00 H ATOM 2310 C117 OL 117 72.204 95.070 43.254 1.00 0.00 C ATOM 2311 H17R OL 117 73.015 94.988 42.527 1.00 0.00 H ATOM 2312 H17S OL 117 71.982 94.038 43.534 1.00 0.00 H ATOM 2313 C118 OL 117 70.971 95.607 42.589 1.00 0.00 C ATOM 2314 H18R OL 117 71.076 96.548 42.045 1.00 0.00 H ATOM 2315 H18S OL 117 70.228 95.815 43.362 1.00 0.00 H ATOM 2316 H18T OL 117 70.532 94.843 41.944 1.00 0.00 H TER 2317 OL 117 ATOM 2317 C116 PA 118 58.999 44.032 42.380 1.00 0.00 C ATOM 2318 H16R PA 118 59.171 44.537 41.427 1.00 0.00 H ATOM 2319 H16S PA 118 58.710 43.022 42.081 1.00 0.00 H ATOM 2320 H16T PA 118 59.929 43.973 42.949 1.00 0.00 H ATOM 2321 C115 PA 118 57.837 44.939 42.930 1.00 0.00 C ATOM 2322 H15R PA 118 58.276 45.889 43.239 1.00 0.00 H ATOM 2323 H15S PA 118 57.477 44.380 43.796 1.00 0.00 H ATOM 2324 C114 PA 118 56.653 45.053 42.049 1.00 0.00 C ATOM 2325 H14R PA 118 56.105 44.113 42.148 1.00 0.00 H ATOM 2326 H14S PA 118 56.920 45.376 41.041 1.00 0.00 H ATOM 2327 C113 PA 118 55.587 46.022 42.544 1.00 0.00 C ATOM 2328 H13R PA 118 54.711 45.889 41.904 1.00 0.00 H ATOM 2329 H13S PA 118 55.904 47.045 42.335 1.00 0.00 H ATOM 2330 C112 PA 118 55.092 45.833 44.007 1.00 0.00 C ATOM 2331 H12R PA 118 55.969 45.709 44.646 1.00 0.00 H ATOM 2332 H12S PA 118 54.675 44.834 44.150 1.00 0.00 H ATOM 2333 C111 PA 118 54.240 46.954 44.575 1.00 0.00 C ATOM 2334 H11R PA 118 53.383 47.150 43.927 1.00 0.00 H ATOM 2335 H11S PA 118 54.870 47.813 44.816 1.00 0.00 H ATOM 2336 C110 PA 118 53.603 46.755 45.975 1.00 0.00 C ATOM 2337 H10R PA 118 54.310 46.938 46.787 1.00 0.00 H ATOM 2338 H10S PA 118 53.166 45.757 46.055 1.00 0.00 H ATOM 2339 C19 PA 118 52.469 47.832 46.177 1.00 0.00 C ATOM 2340 H9R PA 118 51.659 47.681 45.461 1.00 0.00 H ATOM 2341 H9S PA 118 52.747 48.864 45.951 1.00 0.00 H ATOM 2342 C18 PA 118 52.014 47.897 47.614 1.00 0.00 C ATOM 2343 H8R PA 118 52.805 48.463 48.110 1.00 0.00 H ATOM 2344 H8S PA 118 52.022 46.847 47.915 1.00 0.00 H ATOM 2345 C17 PA 118 50.663 48.559 47.704 1.00 0.00 C ATOM 2346 H7R PA 118 49.906 47.966 47.186 1.00 0.00 H ATOM 2347 H7S PA 118 50.711 49.500 47.152 1.00 0.00 H ATOM 2348 C16 PA 118 50.188 48.752 49.111 1.00 0.00 C ATOM 2349 H6R PA 118 50.869 49.403 49.664 1.00 0.00 H ATOM 2350 H6S PA 118 50.223 47.827 49.691 1.00 0.00 H ATOM 2351 C15 PA 118 48.784 49.300 49.120 1.00 0.00 C ATOM 2352 H5R PA 118 48.086 48.596 48.663 1.00 0.00 H ATOM 2353 H5S PA 118 48.645 50.186 48.497 1.00 0.00 H ATOM 2354 C14 PA 118 48.174 49.505 50.468 1.00 0.00 C ATOM 2355 H4R PA 118 47.851 48.586 50.962 1.00 0.00 H ATOM 2356 H4S PA 118 47.233 50.028 50.288 1.00 0.00 H ATOM 2357 C13 PA 118 48.865 50.318 51.506 1.00 0.00 C ATOM 2358 H3R PA 118 49.816 49.867 51.798 1.00 0.00 H ATOM 2359 H3S PA 118 48.298 50.263 52.438 1.00 0.00 H ATOM 2360 C12 PA 118 49.174 51.796 51.186 1.00 0.00 C ATOM 2361 H2R PA 118 48.406 52.267 50.570 1.00 0.00 H ATOM 2362 H2S PA 118 50.013 51.821 50.487 1.00 0.00 H ATOM 2363 C11 PC 119 49.605 52.668 52.388 1.00 0.00 C ATOM 2364 O12 PC 119 49.214 53.812 52.616 1.00 0.00 O ATOM 2365 O11 PC 119 50.336 51.857 53.211 1.00 0.00 O ATOM 2366 C1 PC 119 50.573 52.301 54.558 1.00 0.00 C ATOM 2367 HR PC 119 49.667 52.547 55.118 1.00 0.00 H ATOM 2368 HS PC 119 51.225 53.178 54.524 1.00 0.00 H ATOM 2369 C2 PC 119 51.163 51.068 55.270 1.00 0.00 C ATOM 2370 HX PC 119 50.324 50.368 55.324 1.00 0.00 H ATOM 2371 C3 PC 119 51.695 51.390 56.663 1.00 0.00 C ATOM 2372 HA PC 119 51.050 52.251 56.858 1.00 0.00 H ATOM 2373 HB PC 119 52.771 51.565 56.731 1.00 0.00 H ATOM 2374 O31 PC 119 51.214 50.291 57.454 1.00 0.00 O ATOM 2375 P31 PC 119 51.213 50.358 59.097 1.00 0.00 P ATOM 2376 O32 PC 119 52.635 50.783 59.519 1.00 0.00 O ATOM 2377 C31 PC 119 53.672 49.899 59.213 1.00 0.00 C ATOM 2378 H1A PC 119 53.616 49.528 58.187 1.00 0.00 H ATOM 2379 H1B PC 119 53.506 49.024 59.846 1.00 0.00 H ATOM 2380 C32 PC 119 55.021 50.481 59.521 1.00 0.00 C ATOM 2381 H2A PC 119 54.838 51.503 59.188 1.00 0.00 H ATOM 2382 H2B PC 119 55.906 50.033 59.068 1.00 0.00 H ATOM 2383 N31 PC 119 55.480 50.493 60.978 1.00 0.00 N ATOM 2384 C33 PC 119 56.642 51.250 61.171 1.00 0.00 C ATOM 2385 H3A PC 119 57.160 51.065 62.112 1.00 0.00 H ATOM 2386 H3B PC 119 56.297 52.284 61.124 1.00 0.00 H ATOM 2387 H3C PC 119 57.427 51.029 60.446 1.00 0.00 H ATOM 2388 C34 PC 119 54.428 50.882 61.924 1.00 0.00 C ATOM 2389 H4A PC 119 53.465 50.404 61.735 1.00 0.00 H ATOM 2390 H4B PC 119 54.238 51.955 61.878 1.00 0.00 H ATOM 2391 H4C PC 119 54.813 50.616 62.909 1.00 0.00 H ATOM 2392 C35 PC 119 55.814 49.188 61.472 1.00 0.00 C ATOM 2393 H5A PC 119 54.888 48.612 61.439 1.00 0.00 H ATOM 2394 H5B PC 119 56.304 49.140 62.446 1.00 0.00 H ATOM 2395 H5C PC 119 56.571 48.806 60.786 1.00 0.00 H ATOM 2396 O33 PC 119 50.225 51.420 59.522 1.00 0.00 O ATOM 2397 O34 PC 119 50.978 49.090 59.564 1.00 0.00 O ATOM 2398 O21 PC 119 52.236 50.474 54.520 1.00 0.00 O ATOM 2399 C21 PC 119 53.297 51.285 54.082 1.00 0.00 C ATOM 2400 O22 PC 119 53.685 52.315 54.555 1.00 0.00 O ATOM 2401 C12 OL 120 54.005 50.602 52.875 1.00 0.00 C ATOM 2402 H2R OL 120 54.382 49.618 53.162 1.00 0.00 H ATOM 2403 H2S OL 120 53.210 50.216 52.233 1.00 0.00 H ATOM 2404 C13 OL 120 54.970 51.553 52.230 1.00 0.00 C ATOM 2405 H3R OL 120 55.665 51.938 52.979 1.00 0.00 H ATOM 2406 H3S OL 120 55.601 50.881 51.645 1.00 0.00 H ATOM 2407 C14 OL 120 54.313 52.585 51.279 1.00 0.00 C ATOM 2408 H4R OL 120 53.842 53.244 52.011 1.00 0.00 H ATOM 2409 H4S OL 120 55.141 53.178 50.885 1.00 0.00 H ATOM 2410 C15 OL 120 53.316 52.138 50.177 1.00 0.00 C ATOM 2411 H5R OL 120 52.347 52.006 50.662 1.00 0.00 H ATOM 2412 H5S OL 120 53.201 53.036 49.567 1.00 0.00 H ATOM 2413 C16 OL 120 53.740 51.018 49.262 1.00 0.00 C ATOM 2414 H6R OL 120 53.878 50.146 49.905 1.00 0.00 H ATOM 2415 H6S OL 120 52.988 50.610 48.583 1.00 0.00 H ATOM 2416 C17 OL 120 55.028 51.105 48.531 1.00 0.00 C ATOM 2417 H7R OL 120 54.944 51.908 47.796 1.00 0.00 H ATOM 2418 H7S OL 120 55.823 51.255 49.265 1.00 0.00 H ATOM 2419 C18 OL 120 55.440 49.833 47.783 1.00 0.00 C ATOM 2420 H8R OL 120 54.627 49.526 47.122 1.00 0.00 H ATOM 2421 H8S OL 120 56.321 50.023 47.166 1.00 0.00 H ATOM 2422 C19 OL 120 55.697 48.617 48.654 1.00 0.00 C ATOM 2423 H9R OL 120 54.773 48.097 48.894 1.00 0.00 H ATOM 2424 C110 OL 120 56.810 48.247 49.249 1.00 0.00 C ATOM 2425 H10R OL 120 56.728 47.288 49.754 1.00 0.00 H ATOM 2426 C111 OL 120 58.229 48.879 49.134 1.00 0.00 C ATOM 2427 H11R OL 120 59.012 48.134 48.977 1.00 0.00 H ATOM 2428 H11S OL 120 58.359 49.525 48.263 1.00 0.00 H ATOM 2429 C112 OL 120 58.538 49.546 50.519 1.00 0.00 C ATOM 2430 H12R OL 120 57.661 50.189 50.621 1.00 0.00 H ATOM 2431 H12S OL 120 58.497 48.736 51.250 1.00 0.00 H ATOM 2432 C113 OL 120 59.718 50.614 50.556 1.00 0.00 C ATOM 2433 H13R OL 120 60.691 50.190 50.302 1.00 0.00 H ATOM 2434 H13S OL 120 59.597 51.292 49.709 1.00 0.00 H ATOM 2435 C114 OL 120 59.877 51.374 51.926 1.00 0.00 C ATOM 2436 H14R OL 120 60.119 50.668 52.723 1.00 0.00 H ATOM 2437 H14S OL 120 60.575 52.214 51.922 1.00 0.00 H ATOM 2438 C115 OL 120 58.595 52.112 52.483 1.00 0.00 C ATOM 2439 H15R OL 120 57.842 51.356 52.716 1.00 0.00 H ATOM 2440 H15S OL 120 58.709 52.618 53.444 1.00 0.00 H ATOM 2441 C116 OL 120 57.904 53.121 51.518 1.00 0.00 C ATOM 2442 H16R OL 120 57.365 52.573 50.743 1.00 0.00 H ATOM 2443 H16S OL 120 57.089 53.571 52.089 1.00 0.00 H ATOM 2444 C117 OL 120 58.940 54.118 50.822 1.00 0.00 C ATOM 2445 H17R OL 120 59.512 54.607 51.612 1.00 0.00 H ATOM 2446 H17S OL 120 59.625 53.398 50.370 1.00 0.00 H ATOM 2447 C118 OL 120 58.421 55.217 49.821 1.00 0.00 C ATOM 2448 H18R OL 120 57.811 56.037 50.207 1.00 0.00 H ATOM 2449 H18S OL 120 57.741 54.865 49.043 1.00 0.00 H ATOM 2450 H18T OL 120 59.253 55.708 49.313 1.00 0.00 H TER 2451 OL 120 ATOM 2451 C116 PA 121 67.553 65.604 53.346 1.00 0.00 C ATOM 2452 H16R PA 121 67.396 65.013 54.251 1.00 0.00 H ATOM 2453 H16S PA 121 67.501 66.618 53.748 1.00 0.00 H ATOM 2454 H16T PA 121 68.608 65.607 53.063 1.00 0.00 H ATOM 2455 C115 PA 121 66.650 65.400 52.124 1.00 0.00 C ATOM 2456 H15R PA 121 67.059 66.004 51.312 1.00 0.00 H ATOM 2457 H15S PA 121 65.604 65.691 52.237 1.00 0.00 H ATOM 2458 C114 PA 121 66.628 64.009 51.527 1.00 0.00 C ATOM 2459 H14R PA 121 66.036 63.279 52.083 1.00 0.00 H ATOM 2460 H14S PA 121 67.661 63.656 51.489 1.00 0.00 H ATOM 2461 C113 PA 121 66.163 63.970 50.029 1.00 0.00 C ATOM 2462 H13R PA 121 67.033 64.409 49.537 1.00 0.00 H ATOM 2463 H13S PA 121 65.191 64.461 49.944 1.00 0.00 H ATOM 2464 C112 PA 121 66.135 62.572 49.462 1.00 0.00 C ATOM 2465 H12R PA 121 65.410 62.034 50.076 1.00 0.00 H ATOM 2466 H12S PA 121 67.131 62.164 49.643 1.00 0.00 H ATOM 2467 C111 PA 121 65.857 62.418 47.983 1.00 0.00 C ATOM 2468 H11R PA 121 66.745 62.677 47.402 1.00 0.00 H ATOM 2469 H11S PA 121 64.968 63.026 47.800 1.00 0.00 H ATOM 2470 C110 PA 121 65.559 60.885 47.679 1.00 0.00 C ATOM 2471 H10R PA 121 66.456 60.273 47.793 1.00 0.00 H ATOM 2472 H10S PA 121 65.263 60.707 46.643 1.00 0.00 H ATOM 2473 C19 PA 121 64.439 60.272 48.548 1.00 0.00 C ATOM 2474 H9R PA 121 63.672 61.050 48.568 1.00 0.00 H ATOM 2475 H9S PA 121 64.757 60.075 49.574 1.00 0.00 H ATOM 2476 C18 PA 121 64.043 58.973 47.997 1.00 0.00 C ATOM 2477 H8R PA 121 64.761 58.160 48.124 1.00 0.00 H ATOM 2478 H8S PA 121 64.065 59.074 46.910 1.00 0.00 H ATOM 2479 C17 PA 121 62.671 58.454 48.436 1.00 0.00 C ATOM 2480 H7R PA 121 62.075 58.223 47.550 1.00 0.00 H ATOM 2481 H7S PA 121 62.176 59.293 48.929 1.00 0.00 H ATOM 2482 C16 PA 121 62.908 57.257 49.342 1.00 0.00 C ATOM 2483 H6R PA 121 63.731 56.585 49.093 1.00 0.00 H ATOM 2484 H6S PA 121 61.946 56.741 49.306 1.00 0.00 H ATOM 2485 C15 PA 121 62.854 57.598 50.816 1.00 0.00 C ATOM 2486 H5R PA 121 62.044 58.303 51.013 1.00 0.00 H ATOM 2487 H5S PA 121 63.783 57.964 51.257 1.00 0.00 H ATOM 2488 C14 PA 121 62.316 56.306 51.557 1.00 0.00 C ATOM 2489 H4R PA 121 62.848 55.418 51.209 1.00 0.00 H ATOM 2490 H4S PA 121 61.360 56.063 51.088 1.00 0.00 H ATOM 2491 C13 PA 121 62.231 56.334 53.042 1.00 0.00 C ATOM 2492 H3R PA 121 63.092 56.756 53.564 1.00 0.00 H ATOM 2493 H3S PA 121 62.340 55.322 53.438 1.00 0.00 H ATOM 2494 C12 PA 121 60.875 56.783 53.697 1.00 0.00 C ATOM 2495 H2R PA 121 60.514 57.773 53.411 1.00 0.00 H ATOM 2496 H2S PA 121 60.047 56.174 53.328 1.00 0.00 H ATOM 2497 C11 PGR 122 60.869 56.628 55.189 1.00 0.00 C ATOM 2498 O12 PGR 122 61.598 55.807 55.805 1.00 0.00 O ATOM 2499 O11 PGR 122 59.943 57.391 55.775 1.00 0.00 O ATOM 2500 C1 PGR 122 59.673 57.349 57.197 1.00 0.00 C ATOM 2501 HR PGR 122 59.378 56.346 57.515 1.00 0.00 H ATOM 2502 HS PGR 122 58.909 58.091 57.441 1.00 0.00 H ATOM 2503 C2 PGR 122 60.962 57.575 58.039 1.00 0.00 C ATOM 2504 HX PGR 122 61.594 56.684 58.066 1.00 0.00 H ATOM 2505 C3 PGR 122 60.682 57.757 59.505 1.00 0.00 C ATOM 2506 HA PGR 122 59.868 58.486 59.534 1.00 0.00 H ATOM 2507 HB PGR 122 61.513 58.201 60.060 1.00 0.00 H ATOM 2508 O31 PGR 122 60.250 56.529 59.995 1.00 0.00 O ATOM 2509 P31 PGR 122 59.352 56.509 61.327 1.00 0.00 P ATOM 2510 O32 PGR 122 60.328 57.224 62.325 1.00 0.00 O ATOM 2511 C31 PGR 122 61.215 56.431 63.034 1.00 0.00 C ATOM 2512 H1A PGR 122 61.642 55.632 62.422 1.00 0.00 H ATOM 2513 H1B PGR 122 60.567 55.921 63.751 1.00 0.00 H ATOM 2514 C32 PGR 122 62.462 57.055 63.671 1.00 0.00 C ATOM 2515 H2A PGR 122 62.881 56.452 64.480 1.00 0.00 H ATOM 2516 O35 PGR 122 62.261 58.478 64.176 1.00 0.00 O ATOM 2517 HO5A PGR 122 61.743 58.910 63.473 1.00 0.00 H ATOM 2518 C33 PGR 122 63.509 57.164 62.489 1.00 0.00 C ATOM 2519 H3A PGR 122 63.544 56.176 62.021 1.00 0.00 H ATOM 2520 H3B PGR 122 63.239 57.897 61.726 1.00 0.00 H ATOM 2521 O33 PGR 122 58.206 57.475 61.246 1.00 0.00 O ATOM 2522 O34 PGR 122 59.162 55.161 61.765 1.00 0.00 O ATOM 2523 O21 PGR 122 61.695 58.697 57.424 1.00 0.00 O ATOM 2524 C21 PGR 122 62.986 58.867 57.656 1.00 0.00 C ATOM 2525 O22 PGR 122 63.644 58.360 58.549 1.00 0.00 O ATOM 2526 O36 PGR 122 64.751 57.447 63.047 1.00 0.00 O ATOM 2527 HO6A PGR 122 64.663 58.315 63.480 1.00 0.00 H ATOM 2528 C12 OL 123 63.631 59.937 56.753 1.00 0.00 C ATOM 2529 H2R OL 123 63.211 60.937 56.882 1.00 0.00 H ATOM 2530 H2S OL 123 64.708 60.008 56.921 1.00 0.00 H ATOM 2531 C13 OL 123 63.334 59.559 55.322 1.00 0.00 C ATOM 2532 H3R OL 123 63.916 58.641 55.224 1.00 0.00 H ATOM 2533 H3S OL 123 62.280 59.348 55.126 1.00 0.00 H ATOM 2534 C14 OL 123 63.761 60.650 54.289 1.00 0.00 C ATOM 2535 H4R OL 123 63.444 61.631 54.649 1.00 0.00 H ATOM 2536 H4S OL 123 64.849 60.666 54.198 1.00 0.00 H ATOM 2537 C15 OL 123 63.316 60.246 52.914 1.00 0.00 C ATOM 2538 H5R OL 123 64.009 60.613 52.154 1.00 0.00 H ATOM 2539 H5S OL 123 63.414 59.166 52.790 1.00 0.00 H ATOM 2540 C16 OL 123 61.909 60.776 52.529 1.00 0.00 C ATOM 2541 H6R OL 123 61.338 60.188 51.808 1.00 0.00 H ATOM 2542 H6S OL 123 61.329 60.621 53.442 1.00 0.00 H ATOM 2543 C17 OL 123 61.831 62.228 52.045 1.00 0.00 C ATOM 2544 H7R OL 123 60.787 62.547 52.024 1.00 0.00 H ATOM 2545 H7S OL 123 62.453 62.907 52.632 1.00 0.00 H ATOM 2546 C18 OL 123 62.381 62.417 50.665 1.00 0.00 C ATOM 2547 H8R OL 123 63.404 62.039 50.599 1.00 0.00 H ATOM 2548 H8S OL 123 61.920 61.731 49.951 1.00 0.00 H ATOM 2549 C19 OL 123 62.255 63.838 50.290 1.00 0.00 C ATOM 2550 H9R OL 123 63.026 64.503 50.670 1.00 0.00 H ATOM 2551 C110 OL 123 61.367 64.396 49.453 1.00 0.00 C ATOM 2552 H10R OL 123 61.468 65.469 49.313 1.00 0.00 H ATOM 2553 C111 OL 123 60.267 63.720 48.642 1.00 0.00 C ATOM 2554 H11R OL 123 60.278 62.640 48.801 1.00 0.00 H ATOM 2555 H11S OL 123 59.289 63.976 49.057 1.00 0.00 H ATOM 2556 C112 OL 123 60.248 64.036 47.203 1.00 0.00 C ATOM 2557 H12R OL 123 61.310 63.948 46.963 1.00 0.00 H ATOM 2558 H12S OL 123 59.798 63.285 46.550 1.00 0.00 H ATOM 2559 C113 OL 123 59.607 65.500 46.929 1.00 0.00 C ATOM 2560 H13R OL 123 58.537 65.473 47.145 1.00 0.00 H ATOM 2561 H13S OL 123 60.076 66.049 47.747 1.00 0.00 H ATOM 2562 C114 OL 123 59.944 66.089 45.578 1.00 0.00 C ATOM 2563 H14R OL 123 61.027 66.179 45.687 1.00 0.00 H ATOM 2564 H14S OL 123 59.956 65.455 44.689 1.00 0.00 H ATOM 2565 C115 OL 123 59.309 67.399 45.330 1.00 0.00 C ATOM 2566 H15R OL 123 59.366 67.687 44.278 1.00 0.00 H ATOM 2567 H15S OL 123 58.241 67.198 45.439 1.00 0.00 H ATOM 2568 C116 OL 123 59.888 68.547 46.133 1.00 0.00 C ATOM 2569 H16R OL 123 59.440 69.461 45.737 1.00 0.00 H ATOM 2570 H16S OL 123 59.460 68.492 47.136 1.00 0.00 H ATOM 2571 C117 OL 123 61.391 68.622 46.273 1.00 0.00 C ATOM 2572 H17R OL 123 61.453 69.520 46.891 1.00 0.00 H ATOM 2573 H17S OL 123 61.745 67.713 46.763 1.00 0.00 H ATOM 2574 C118 OL 123 62.196 68.783 44.995 1.00 0.00 C ATOM 2575 H18R OL 123 63.190 69.149 45.259 1.00 0.00 H ATOM 2576 H18S OL 123 61.681 69.508 44.361 1.00 0.00 H ATOM 2577 H18T OL 123 62.082 67.939 44.311 1.00 0.00 H TER 2578 OL 123 ATOM 2578 C116 PA 124 132.373 32.031 37.760 1.00 0.00 C ATOM 2579 H16R PA 124 132.818 32.837 37.174 1.00 0.00 H ATOM 2580 H16S PA 124 131.336 32.308 37.958 1.00 0.00 H ATOM 2581 H16T PA 124 132.244 31.188 37.077 1.00 0.00 H ATOM 2582 C115 PA 124 133.317 31.670 38.905 1.00 0.00 C ATOM 2583 H15R PA 124 133.575 32.576 39.458 1.00 0.00 H ATOM 2584 H15S PA 124 134.203 31.180 38.497 1.00 0.00 H ATOM 2585 C114 PA 124 132.666 30.778 39.975 1.00 0.00 C ATOM 2586 H14R PA 124 132.232 29.815 39.699 1.00 0.00 H ATOM 2587 H14S PA 124 131.802 31.343 40.333 1.00 0.00 H ATOM 2588 C113 PA 124 133.496 30.656 41.260 1.00 0.00 C ATOM 2589 H13R PA 124 134.063 31.570 41.447 1.00 0.00 H ATOM 2590 H13S PA 124 134.285 29.909 41.151 1.00 0.00 H ATOM 2591 C112 PA 124 132.572 30.351 42.524 1.00 0.00 C ATOM 2592 H12R PA 124 132.026 29.414 42.401 1.00 0.00 H ATOM 2593 H12S PA 124 131.732 31.048 42.575 1.00 0.00 H ATOM 2594 C111 PA 124 133.297 30.434 43.871 1.00 0.00 C ATOM 2595 H11R PA 124 133.355 31.456 44.253 1.00 0.00 H ATOM 2596 H11S PA 124 134.315 30.041 43.829 1.00 0.00 H ATOM 2597 C110 PA 124 132.528 29.655 44.962 1.00 0.00 C ATOM 2598 H10R PA 124 132.362 28.642 44.588 1.00 0.00 H ATOM 2599 H10S PA 124 131.563 30.113 45.186 1.00 0.00 H ATOM 2600 C19 PA 124 133.446 29.687 46.144 1.00 0.00 C ATOM 2601 H9R PA 124 133.757 30.708 46.374 1.00 0.00 H ATOM 2602 H9S PA 124 134.393 29.209 45.885 1.00 0.00 H ATOM 2603 C18 PA 124 132.846 28.891 47.315 1.00 0.00 C ATOM 2604 H8R PA 124 133.708 28.843 47.984 1.00 0.00 H ATOM 2605 H8S PA 124 132.585 27.887 46.973 1.00 0.00 H ATOM 2606 C17 PA 124 131.690 29.686 48.004 1.00 0.00 C ATOM 2607 H7R PA 124 130.703 29.492 47.578 1.00 0.00 H ATOM 2608 H7S PA 124 131.870 30.762 47.956 1.00 0.00 H ATOM 2609 C16 PA 124 131.595 29.567 49.468 1.00 0.00 C ATOM 2610 H6R PA 124 132.412 30.055 50.004 1.00 0.00 H ATOM 2611 H6S PA 124 131.616 28.544 49.849 1.00 0.00 H ATOM 2612 C15 PA 124 130.298 30.207 49.923 1.00 0.00 C ATOM 2613 H5R PA 124 129.634 29.504 49.416 1.00 0.00 H ATOM 2614 H5S PA 124 130.157 31.073 49.272 1.00 0.00 H ATOM 2615 C14 PA 124 130.055 30.495 51.339 1.00 0.00 C ATOM 2616 H4R PA 124 129.373 31.346 51.402 1.00 0.00 H ATOM 2617 H4S PA 124 130.899 31.029 51.780 1.00 0.00 H ATOM 2618 C13 PA 124 129.699 29.269 52.131 1.00 0.00 C ATOM 2619 H3R PA 124 130.167 28.405 51.657 1.00 0.00 H ATOM 2620 H3S PA 124 128.623 29.127 52.005 1.00 0.00 H ATOM 2621 C12 PA 124 130.086 29.387 53.653 1.00 0.00 C ATOM 2622 H2R PA 124 129.761 30.375 53.984 1.00 0.00 H ATOM 2623 H2S PA 124 131.175 29.377 53.736 1.00 0.00 H ATOM 2624 C11 PC 125 129.551 28.376 54.604 1.00 0.00 C ATOM 2625 O12 PC 125 129.412 28.609 55.793 1.00 0.00 O ATOM 2626 O11 PC 125 129.141 27.282 53.980 1.00 0.00 O ATOM 2627 C1 PC 125 128.482 26.242 54.695 1.00 0.00 C ATOM 2628 HR PC 125 128.967 25.803 55.571 1.00 0.00 H ATOM 2629 HS PC 125 128.354 25.430 53.974 1.00 0.00 H ATOM 2630 C2 PC 125 127.090 26.740 55.165 1.00 0.00 C ATOM 2631 HX PC 125 127.160 27.749 55.580 1.00 0.00 H ATOM 2632 C3 PC 125 126.374 25.809 56.216 1.00 0.00 C ATOM 2633 HA PC 125 126.032 24.877 55.757 1.00 0.00 H ATOM 2634 HB PC 125 125.552 26.312 56.732 1.00 0.00 H ATOM 2635 O31 PC 125 127.383 25.603 57.155 1.00 0.00 O ATOM 2636 P31 PC 125 127.149 24.512 58.295 1.00 0.00 P ATOM 2637 O32 PC 125 126.077 25.220 59.156 1.00 0.00 O ATOM 2638 C31 PC 125 126.371 26.392 59.837 1.00 0.00 C ATOM 2639 H1A PC 125 126.967 27.014 59.165 1.00 0.00 H ATOM 2640 H1B PC 125 127.000 26.067 60.670 1.00 0.00 H ATOM 2641 C32 PC 125 125.045 27.054 60.366 1.00 0.00 C ATOM 2642 H2A PC 125 124.381 26.388 60.919 1.00 0.00 H ATOM 2643 H2B PC 125 124.455 27.469 59.548 1.00 0.00 H ATOM 2644 N31 PC 125 125.270 28.234 61.290 1.00 0.00 N ATOM 2645 C33 PC 125 123.920 28.869 61.495 1.00 0.00 C ATOM 2646 H3A PC 125 123.548 29.029 60.482 1.00 0.00 H ATOM 2647 H3B PC 125 124.121 29.764 62.085 1.00 0.00 H ATOM 2648 H3C PC 125 123.272 28.123 61.958 1.00 0.00 H ATOM 2649 C34 PC 125 125.566 27.661 62.610 1.00 0.00 C ATOM 2650 H4A PC 125 125.307 28.442 63.327 1.00 0.00 H ATOM 2651 H4B PC 125 126.640 27.465 62.602 1.00 0.00 H ATOM 2652 H4C PC 125 124.941 26.781 62.769 1.00 0.00 H ATOM 2653 C35 PC 125 126.310 29.159 60.814 1.00 0.00 C ATOM 2654 H5A PC 125 126.318 29.989 61.521 1.00 0.00 H ATOM 2655 H5B PC 125 126.183 29.457 59.772 1.00 0.00 H ATOM 2656 H5C PC 125 127.318 28.748 60.878 1.00 0.00 H ATOM 2657 O33 PC 125 126.690 23.246 57.671 1.00 0.00 O ATOM 2658 O34 PC 125 128.387 24.459 59.127 1.00 0.00 O ATOM 2659 O21 PC 125 126.302 26.729 54.009 1.00 0.00 O ATOM 2660 C21 PC 125 125.165 27.458 54.015 1.00 0.00 C ATOM 2661 O22 PC 125 124.675 28.068 55.040 1.00 0.00 O ATOM 2662 C12 OL 126 124.543 27.673 52.635 1.00 0.00 C ATOM 2663 H2R OL 126 125.392 28.143 52.134 1.00 0.00 H ATOM 2664 H2S OL 126 124.413 26.679 52.202 1.00 0.00 H ATOM 2665 C13 OL 126 123.344 28.635 52.558 1.00 0.00 C ATOM 2666 H3R OL 126 122.528 28.254 53.176 1.00 0.00 H ATOM 2667 H3S OL 126 123.579 29.624 52.956 1.00 0.00 H ATOM 2668 C14 OL 126 122.876 28.808 51.162 1.00 0.00 C ATOM 2669 H4R OL 126 123.752 29.150 50.608 1.00 0.00 H ATOM 2670 H4S OL 126 122.644 27.820 50.757 1.00 0.00 H ATOM 2671 C15 OL 126 121.688 29.737 50.994 1.00 0.00 C ATOM 2672 H5R OL 126 120.900 29.407 51.674 1.00 0.00 H ATOM 2673 H5S OL 126 122.122 30.711 51.231 1.00 0.00 H ATOM 2674 C16 OL 126 121.193 29.854 49.575 1.00 0.00 C ATOM 2675 H6R OL 126 121.918 30.155 48.816 1.00 0.00 H ATOM 2676 H6S OL 126 120.833 28.869 49.269 1.00 0.00 H ATOM 2677 C17 OL 126 120.095 30.911 49.451 1.00 0.00 C ATOM 2678 H7R OL 126 119.288 30.752 50.170 1.00 0.00 H ATOM 2679 H7S OL 126 120.441 31.904 49.746 1.00 0.00 H ATOM 2680 C18 OL 126 119.538 31.019 48.051 1.00 0.00 C ATOM 2681 H8R OL 126 120.204 30.850 47.203 1.00 0.00 H ATOM 2682 H8S OL 126 118.810 30.209 47.977 1.00 0.00 H ATOM 2683 C19 OL 126 118.846 32.348 47.798 1.00 0.00 C ATOM 2684 H9R OL 126 119.552 33.138 48.042 1.00 0.00 H ATOM 2685 C110 OL 126 117.600 32.624 47.277 1.00 0.00 C ATOM 2686 H10R OL 126 117.381 33.678 47.126 1.00 0.00 H ATOM 2687 C111 OL 126 116.618 31.613 46.768 1.00 0.00 C ATOM 2688 H11R OL 126 117.163 30.735 46.413 1.00 0.00 H ATOM 2689 H11S OL 126 115.823 31.323 47.458 1.00 0.00 H ATOM 2690 C112 OL 126 115.832 32.211 45.593 1.00 0.00 C ATOM 2691 H12R OL 126 115.374 33.161 45.874 1.00 0.00 H ATOM 2692 H12S OL 126 116.557 32.505 44.832 1.00 0.00 H ATOM 2693 C113 OL 126 114.799 31.283 44.937 1.00 0.00 C ATOM 2694 H13R OL 126 115.241 30.338 44.613 1.00 0.00 H ATOM 2695 H13S OL 126 114.266 30.921 45.819 1.00 0.00 H ATOM 2696 C114 OL 126 113.897 31.790 43.860 1.00 0.00 C ATOM 2697 H14R OL 126 113.131 31.067 43.571 1.00 0.00 H ATOM 2698 H14S OL 126 113.410 32.746 44.062 1.00 0.00 H ATOM 2699 C115 OL 126 114.753 31.982 42.610 1.00 0.00 C ATOM 2700 H15R OL 126 115.654 32.556 42.839 1.00 0.00 H ATOM 2701 H15S OL 126 115.066 30.967 42.358 1.00 0.00 H ATOM 2702 C116 OL 126 113.921 32.525 41.415 1.00 0.00 C ATOM 2703 H16R OL 126 113.274 31.774 40.955 1.00 0.00 H ATOM 2704 H16S OL 126 113.201 33.291 41.711 1.00 0.00 H ATOM 2705 C117 OL 126 114.898 32.912 40.355 1.00 0.00 C ATOM 2706 H17R OL 126 115.629 33.616 40.756 1.00 0.00 H ATOM 2707 H17S OL 126 115.387 32.024 39.949 1.00 0.00 H ATOM 2708 C118 OL 126 114.202 33.484 39.198 1.00 0.00 C ATOM 2709 H18R OL 126 114.939 33.810 38.461 1.00 0.00 H ATOM 2710 H18S OL 126 113.719 34.426 39.465 1.00 0.00 H ATOM 2711 H18T OL 126 113.498 32.765 38.775 1.00 0.00 H TER 2712 OL 126 ATOM 2712 C116 PA 127 73.374 59.221 43.607 1.00 0.00 C ATOM 2713 H16R PA 127 73.641 58.535 44.414 1.00 0.00 H ATOM 2714 H16S PA 127 73.973 60.125 43.737 1.00 0.00 H ATOM 2715 H16T PA 127 73.578 58.779 42.630 1.00 0.00 H ATOM 2716 C115 PA 127 71.912 59.652 43.762 1.00 0.00 C ATOM 2717 H15R PA 127 71.666 60.268 42.894 1.00 0.00 H ATOM 2718 H15S PA 127 71.923 60.336 44.613 1.00 0.00 H ATOM 2719 C114 PA 127 70.890 58.493 43.913 1.00 0.00 C ATOM 2720 H14R PA 127 71.242 57.891 44.753 1.00 0.00 H ATOM 2721 H14S PA 127 70.829 57.876 43.014 1.00 0.00 H ATOM 2722 C113 PA 127 69.563 58.982 44.413 1.00 0.00 C ATOM 2723 H13R PA 127 69.154 59.553 43.578 1.00 0.00 H ATOM 2724 H13S PA 127 69.580 59.536 45.354 1.00 0.00 H ATOM 2725 C112 PA 127 68.519 57.867 44.576 1.00 0.00 C ATOM 2726 H12R PA 127 68.932 57.117 45.255 1.00 0.00 H ATOM 2727 H12S PA 127 68.290 57.317 43.662 1.00 0.00 H ATOM 2728 C111 PA 127 67.218 58.336 45.284 1.00 0.00 C ATOM 2729 H11R PA 127 66.917 59.318 44.911 1.00 0.00 H ATOM 2730 H11S PA 127 67.475 58.573 46.319 1.00 0.00 H ATOM 2731 C110 PA 127 66.160 57.188 45.376 1.00 0.00 C ATOM 2732 H10R PA 127 66.123 56.765 44.371 1.00 0.00 H ATOM 2733 H10S PA 127 65.184 57.640 45.561 1.00 0.00 H ATOM 2734 C19 PA 127 66.439 56.016 46.353 1.00 0.00 C ATOM 2735 H9R PA 127 67.034 56.361 47.201 1.00 0.00 H ATOM 2736 H9S PA 127 67.181 55.439 45.796 1.00 0.00 H ATOM 2737 C18 PA 127 65.247 55.087 46.656 1.00 0.00 C ATOM 2738 H8R PA 127 65.030 54.471 45.781 1.00 0.00 H ATOM 2739 H8S PA 127 64.411 55.762 46.845 1.00 0.00 H ATOM 2740 C17 PA 127 65.613 54.256 47.905 1.00 0.00 C ATOM 2741 H7R PA 127 65.850 54.943 48.720 1.00 0.00 H ATOM 2742 H7S PA 127 66.506 53.686 47.641 1.00 0.00 H ATOM 2743 C16 PA 127 64.582 53.270 48.432 1.00 0.00 C ATOM 2744 H6R PA 127 64.184 52.704 47.588 1.00 0.00 H ATOM 2745 H6S PA 127 63.706 53.848 48.733 1.00 0.00 H ATOM 2746 C15 PA 127 65.168 52.519 49.648 1.00 0.00 C ATOM 2747 H5R PA 127 65.560 53.197 50.409 1.00 0.00 H ATOM 2748 H5S PA 127 65.922 51.875 49.192 1.00 0.00 H ATOM 2749 C14 PA 127 64.097 51.647 50.215 1.00 0.00 C ATOM 2750 H4R PA 127 63.690 50.977 49.456 1.00 0.00 H ATOM 2751 H4S PA 127 63.204 52.231 50.447 1.00 0.00 H ATOM 2752 C13 PA 127 64.485 50.839 51.421 1.00 0.00 C ATOM 2753 H3R PA 127 64.529 51.586 52.216 1.00 0.00 H ATOM 2754 H3S PA 127 65.550 50.615 51.331 1.00 0.00 H ATOM 2755 C12 PA 127 63.664 49.611 51.906 1.00 0.00 C ATOM 2756 H2R PA 127 62.578 49.614 51.789 1.00 0.00 H ATOM 2757 H2S PA 127 64.048 48.832 51.244 1.00 0.00 H ATOM 2758 C11 PC 128 64.008 49.318 53.301 1.00 0.00 C ATOM 2759 O12 PC 128 63.501 49.846 54.246 1.00 0.00 O ATOM 2760 O11 PC 128 65.051 48.428 53.325 1.00 0.00 O ATOM 2761 C1 PC 128 65.659 48.029 54.647 1.00 0.00 C ATOM 2762 HR PC 128 65.503 48.840 55.363 1.00 0.00 H ATOM 2763 HS PC 128 66.747 47.995 54.553 1.00 0.00 H ATOM 2764 C2 PC 128 64.884 46.797 55.138 1.00 0.00 C ATOM 2765 HX PC 128 63.833 46.987 54.904 1.00 0.00 H ATOM 2766 C3 PC 128 65.162 46.409 56.561 1.00 0.00 C ATOM 2767 HA PC 128 64.440 45.629 56.817 1.00 0.00 H ATOM 2768 HB PC 128 65.051 47.275 57.220 1.00 0.00 H ATOM 2769 O31 PC 128 66.436 45.939 56.676 1.00 0.00 O ATOM 2770 P31 PC 128 67.118 45.555 58.048 1.00 0.00 P ATOM 2771 O32 PC 128 68.710 45.409 57.783 1.00 0.00 O ATOM 2772 C31 PC 128 69.593 45.116 58.806 1.00 0.00 C ATOM 2773 H1A PC 128 69.369 44.056 58.948 1.00 0.00 H ATOM 2774 H1B PC 128 69.380 45.700 59.705 1.00 0.00 H ATOM 2775 C32 PC 128 71.028 45.212 58.267 1.00 0.00 C ATOM 2776 H2A PC 128 70.978 46.139 57.695 1.00 0.00 H ATOM 2777 H2B PC 128 71.265 44.347 57.646 1.00 0.00 H ATOM 2778 N31 PC 128 72.184 45.362 59.254 1.00 0.00 N ATOM 2779 C33 PC 128 72.071 44.242 60.168 1.00 0.00 C ATOM 2780 H3A PC 128 72.167 43.289 59.644 1.00 0.00 H ATOM 2781 H3B PC 128 71.085 44.342 60.625 1.00 0.00 H ATOM 2782 H3C PC 128 72.842 44.307 60.937 1.00 0.00 H ATOM 2783 C34 PC 128 73.511 45.432 58.606 1.00 0.00 C ATOM 2784 H4A PC 128 74.273 45.359 59.384 1.00 0.00 H ATOM 2785 H4B PC 128 73.530 46.402 58.108 1.00 0.00 H ATOM 2786 H4C PC 128 73.711 44.518 58.044 1.00 0.00 H ATOM 2787 C35 PC 128 72.106 46.568 60.055 1.00 0.00 C ATOM 2788 H5A PC 128 72.850 46.493 60.849 1.00 0.00 H ATOM 2789 H5B PC 128 71.070 46.698 60.372 1.00 0.00 H ATOM 2790 H5C PC 128 72.393 47.412 59.425 1.00 0.00 H ATOM 2791 O33 PC 128 66.896 46.649 59.019 1.00 0.00 O ATOM 2792 O34 PC 128 66.601 44.184 58.496 1.00 0.00 O ATOM 2793 O21 PC 128 65.271 45.672 54.230 1.00 0.00 O ATOM 2794 C21 PC 128 64.594 44.470 54.317 1.00 0.00 C ATOM 2795 O22 PC 128 63.461 44.314 54.858 1.00 0.00 O ATOM 2796 C12 OL 129 65.497 43.458 53.732 1.00 0.00 C ATOM 2797 H2R OL 129 65.885 43.984 52.857 1.00 0.00 H ATOM 2798 H2S OL 129 66.312 43.349 54.450 1.00 0.00 H ATOM 2799 C13 OL 129 64.891 42.026 53.415 1.00 0.00 C ATOM 2800 H3R OL 129 65.547 41.507 52.713 1.00 0.00 H ATOM 2801 H3S OL 129 64.856 41.425 54.326 1.00 0.00 H ATOM 2802 C14 OL 129 63.452 41.931 52.835 1.00 0.00 C ATOM 2803 H4R OL 129 63.272 40.871 52.646 1.00 0.00 H ATOM 2804 H4S OL 129 62.680 42.113 53.585 1.00 0.00 H ATOM 2805 C15 OL 129 63.250 42.648 51.541 1.00 0.00 C ATOM 2806 H5R OL 129 63.731 43.614 51.710 1.00 0.00 H ATOM 2807 H5S OL 129 63.804 42.145 50.746 1.00 0.00 H ATOM 2808 C16 OL 129 61.841 42.873 51.053 1.00 0.00 C ATOM 2809 H6R OL 129 61.819 43.076 49.981 1.00 0.00 H ATOM 2810 H6S OL 129 61.190 42.004 51.177 1.00 0.00 H ATOM 2811 C17 OL 129 61.075 44.026 51.694 1.00 0.00 C ATOM 2812 H7R OL 129 60.047 43.837 51.376 1.00 0.00 H ATOM 2813 H7S OL 129 61.014 43.964 52.783 1.00 0.00 H ATOM 2814 C18 OL 129 61.475 45.464 51.296 1.00 0.00 C ATOM 2815 H8R OL 129 61.180 45.568 50.250 1.00 0.00 H ATOM 2816 H8S OL 129 60.749 46.118 51.785 1.00 0.00 H ATOM 2817 C19 OL 129 62.870 45.952 51.508 1.00 0.00 C ATOM 2818 H9R OL 129 63.269 46.003 52.518 1.00 0.00 H ATOM 2819 C110 OL 129 63.806 46.154 50.548 1.00 0.00 C ATOM 2820 H10R OL 129 64.790 46.430 50.919 1.00 0.00 H ATOM 2821 C111 OL 129 63.632 46.444 49.111 1.00 0.00 C ATOM 2822 H11R OL 129 62.598 46.740 48.926 1.00 0.00 H ATOM 2823 H11S OL 129 64.264 47.315 48.923 1.00 0.00 H ATOM 2824 C112 OL 129 64.195 45.430 48.134 1.00 0.00 C ATOM 2825 H12R OL 129 64.131 45.897 47.149 1.00 0.00 H ATOM 2826 H12S OL 129 65.252 45.242 48.332 1.00 0.00 H ATOM 2827 C113 OL 129 63.379 44.169 48.145 1.00 0.00 C ATOM 2828 H13R OL 129 63.824 43.523 48.905 1.00 0.00 H ATOM 2829 H13S OL 129 62.331 44.353 48.390 1.00 0.00 H ATOM 2830 C114 OL 129 63.352 43.401 46.858 1.00 0.00 C ATOM 2831 H14R OL 129 63.227 44.023 45.969 1.00 0.00 H ATOM 2832 H14S OL 129 64.296 42.852 46.856 1.00 0.00 H ATOM 2833 C115 OL 129 62.227 42.357 46.693 1.00 0.00 C ATOM 2834 H15R OL 129 62.174 41.557 47.434 1.00 0.00 H ATOM 2835 H15S OL 129 61.196 42.717 46.698 1.00 0.00 H ATOM 2836 C116 OL 129 62.380 41.636 45.393 1.00 0.00 C ATOM 2837 H16R OL 129 62.425 42.262 44.500 1.00 0.00 H ATOM 2838 H16S OL 129 63.340 41.116 45.420 1.00 0.00 H ATOM 2839 C117 OL 129 61.261 40.653 45.129 1.00 0.00 C ATOM 2840 H17R OL 129 61.635 39.765 44.615 1.00 0.00 H ATOM 2841 H17S OL 129 60.843 40.396 46.104 1.00 0.00 H ATOM 2842 C118 OL 129 60.241 41.385 44.277 1.00 0.00 C ATOM 2843 H18R OL 129 59.332 40.779 44.257 1.00 0.00 H ATOM 2844 H18S OL 129 60.545 41.538 43.239 1.00 0.00 H ATOM 2845 H18T OL 129 59.864 42.380 44.520 1.00 0.00 H TER 2846 OL 129 ATOM 2846 C116 PA 130 90.349 60.316 47.412 1.00 0.00 C ATOM 2847 H16R PA 130 89.360 60.135 47.837 1.00 0.00 H ATOM 2848 H16S PA 130 90.169 60.646 46.386 1.00 0.00 H ATOM 2849 H16T PA 130 90.715 61.240 47.864 1.00 0.00 H ATOM 2850 C115 PA 130 91.511 59.352 47.734 1.00 0.00 C ATOM 2851 H15R PA 130 92.537 59.653 47.512 1.00 0.00 H ATOM 2852 H15S PA 130 91.453 58.477 47.084 1.00 0.00 H ATOM 2853 C114 PA 130 91.512 58.752 49.139 1.00 0.00 C ATOM 2854 H14R PA 130 92.511 58.315 49.205 1.00 0.00 H ATOM 2855 H14S PA 130 90.910 57.846 49.224 1.00 0.00 H ATOM 2856 C113 PA 130 91.195 59.755 50.299 1.00 0.00 C ATOM 2857 H13R PA 130 91.265 59.115 51.181 1.00 0.00 H ATOM 2858 H13S PA 130 90.165 60.118 50.291 1.00 0.00 H ATOM 2859 C112 PA 130 92.116 60.945 50.600 1.00 0.00 C ATOM 2860 H12R PA 130 91.553 61.612 51.257 1.00 0.00 H ATOM 2861 H12S PA 130 92.218 61.569 49.710 1.00 0.00 H ATOM 2862 C111 PA 130 93.520 60.610 51.078 1.00 0.00 C ATOM 2863 H11R PA 130 94.056 60.137 50.253 1.00 0.00 H ATOM 2864 H11S PA 130 93.516 59.879 51.889 1.00 0.00 H ATOM 2865 C110 PA 130 94.251 61.940 51.473 1.00 0.00 C ATOM 2866 H10R PA 130 93.722 62.358 52.332 1.00 0.00 H ATOM 2867 H10S PA 130 94.107 62.632 50.640 1.00 0.00 H ATOM 2868 C19 PA 130 95.725 61.882 51.892 1.00 0.00 C ATOM 2869 H9R PA 130 96.187 62.863 51.766 1.00 0.00 H ATOM 2870 H9S PA 130 96.209 61.198 51.193 1.00 0.00 H ATOM 2871 C18 PA 130 96.017 61.381 53.361 1.00 0.00 C ATOM 2872 H8R PA 130 95.860 60.309 53.497 1.00 0.00 H ATOM 2873 H8S PA 130 95.347 61.822 54.102 1.00 0.00 H ATOM 2874 C17 PA 130 97.456 61.703 53.813 1.00 0.00 C ATOM 2875 H7R PA 130 97.674 62.722 53.488 1.00 0.00 H ATOM 2876 H7S PA 130 98.137 61.114 53.195 1.00 0.00 H ATOM 2877 C16 PA 130 97.760 61.476 55.312 1.00 0.00 C ATOM 2878 H6R PA 130 97.651 60.389 55.345 1.00 0.00 H ATOM 2879 H6S PA 130 97.039 61.896 56.016 1.00 0.00 H ATOM 2880 C15 PA 130 99.277 61.751 55.767 1.00 0.00 C ATOM 2881 H5R PA 130 99.496 62.778 56.067 1.00 0.00 H ATOM 2882 H5S PA 130 99.700 61.549 54.780 1.00 0.00 H ATOM 2883 C14 PA 130 99.903 60.709 56.709 1.00 0.00 C ATOM 2884 H4R PA 130 99.690 59.684 56.397 1.00 0.00 H ATOM 2885 H4S PA 130 99.468 60.671 57.709 1.00 0.00 H ATOM 2886 C13 PA 130 101.408 60.814 56.777 1.00 0.00 C ATOM 2887 H3R PA 130 101.886 61.144 55.852 1.00 0.00 H ATOM 2888 H3S PA 130 101.788 59.800 56.914 1.00 0.00 H ATOM 2889 C12 PA 130 102.029 61.737 57.885 1.00 0.00 C ATOM 2890 H2R PA 130 101.320 61.667 58.713 1.00 0.00 H ATOM 2891 H2S PA 130 102.159 62.750 57.498 1.00 0.00 H ATOM 2892 C11 PGR 131 103.379 61.421 58.446 1.00 0.00 C ATOM 2893 O12 PGR 131 104.019 60.329 58.200 1.00 0.00 O ATOM 2894 O11 PGR 131 103.737 62.382 59.287 1.00 0.00 O ATOM 2895 C1 PGR 131 105.038 62.450 59.937 1.00 0.00 C ATOM 2896 HR PGR 131 105.074 61.621 60.648 1.00 0.00 H ATOM 2897 HS PGR 131 104.934 63.381 60.501 1.00 0.00 H ATOM 2898 C2 PGR 131 106.311 62.424 59.030 1.00 0.00 C ATOM 2899 HX PGR 131 106.156 61.586 58.346 1.00 0.00 H ATOM 2900 C3 PGR 131 107.575 62.333 59.854 1.00 0.00 C ATOM 2901 HA PGR 131 108.482 62.227 59.254 1.00 0.00 H ATOM 2902 HB PGR 131 107.509 61.421 60.454 1.00 0.00 H ATOM 2903 O31 PGR 131 107.675 63.462 60.709 1.00 0.00 O ATOM 2904 P31 PGR 131 108.990 63.833 61.468 1.00 0.00 P ATOM 2905 O32 PGR 131 109.989 64.497 60.449 1.00 0.00 O ATOM 2906 C31 PGR 131 109.992 65.897 60.111 1.00 0.00 C ATOM 2907 H1A PGR 131 110.020 66.390 61.086 1.00 0.00 H ATOM 2908 H1B PGR 131 109.060 66.244 59.656 1.00 0.00 H ATOM 2909 C32 PGR 131 111.179 66.336 59.189 1.00 0.00 C ATOM 2910 H2A PGR 131 111.380 65.474 58.546 1.00 0.00 H ATOM 2911 O35 PGR 131 112.396 66.729 59.955 1.00 0.00 O ATOM 2912 HO5A PGR 131 112.605 65.882 60.389 1.00 0.00 H ATOM 2913 C33 PGR 131 110.704 67.502 58.335 1.00 0.00 C ATOM 2914 H3A PGR 131 111.441 67.936 57.655 1.00 0.00 H ATOM 2915 H3B PGR 131 109.795 67.140 57.847 1.00 0.00 H ATOM 2916 O33 PGR 131 108.549 64.924 62.376 1.00 0.00 O ATOM 2917 O34 PGR 131 109.539 62.608 62.027 1.00 0.00 O ATOM 2918 O21 PGR 131 106.300 63.642 58.203 1.00 0.00 O ATOM 2919 C21 PGR 131 106.960 63.667 57.104 1.00 0.00 C ATOM 2920 O22 PGR 131 107.737 62.830 56.688 1.00 0.00 O ATOM 2921 O36 PGR 131 110.234 68.623 59.126 1.00 0.00 O ATOM 2922 HO6A PGR 131 109.280 68.578 59.313 1.00 0.00 H ATOM 2923 C12 OL 132 106.575 64.908 56.379 1.00 0.00 C ATOM 2924 H2R OL 132 105.993 65.568 57.026 1.00 0.00 H ATOM 2925 H2S OL 132 107.514 65.462 56.320 1.00 0.00 H ATOM 2926 C13 OL 132 105.941 64.592 55.044 1.00 0.00 C ATOM 2927 H3R OL 132 106.735 64.089 54.488 1.00 0.00 H ATOM 2928 H3S OL 132 105.059 63.947 55.034 1.00 0.00 H ATOM 2929 C14 OL 132 105.795 65.897 54.298 1.00 0.00 C ATOM 2930 H4R OL 132 105.097 66.572 54.799 1.00 0.00 H ATOM 2931 H4S OL 132 106.735 66.421 54.109 1.00 0.00 H ATOM 2932 C15 OL 132 105.048 65.615 53.027 1.00 0.00 C ATOM 2933 H5R OL 132 105.625 64.901 52.435 1.00 0.00 H ATOM 2934 H5S OL 132 104.062 65.238 53.305 1.00 0.00 H ATOM 2935 C16 OL 132 104.847 66.831 52.173 1.00 0.00 C ATOM 2936 H6R OL 132 104.291 67.587 52.732 1.00 0.00 H ATOM 2937 H6S OL 132 105.802 67.323 51.979 1.00 0.00 H ATOM 2938 C17 OL 132 104.180 66.615 50.783 1.00 0.00 C ATOM 2939 H7R OL 132 104.899 65.982 50.258 1.00 0.00 H ATOM 2940 H7S OL 132 103.356 65.937 51.013 1.00 0.00 H ATOM 2941 C18 OL 132 103.710 67.869 50.059 1.00 0.00 C ATOM 2942 H8R OL 132 103.001 68.513 50.584 1.00 0.00 H ATOM 2943 H8S OL 132 104.592 68.507 49.966 1.00 0.00 H ATOM 2944 C19 OL 132 103.217 67.392 48.744 1.00 0.00 C ATOM 2945 H9R OL 132 102.142 67.238 48.683 1.00 0.00 H ATOM 2946 C110 OL 132 103.915 67.191 47.715 1.00 0.00 C ATOM 2947 H10R OL 132 103.412 66.902 46.796 1.00 0.00 H ATOM 2948 C111 OL 132 105.401 67.341 47.515 1.00 0.00 C ATOM 2949 H11R OL 132 105.989 67.386 48.434 1.00 0.00 H ATOM 2950 H11S OL 132 105.679 66.506 46.869 1.00 0.00 H ATOM 2951 C112 OL 132 105.709 68.711 46.956 1.00 0.00 C ATOM 2952 H12R OL 132 105.124 69.452 47.504 1.00 0.00 H ATOM 2953 H12S OL 132 106.670 69.082 47.318 1.00 0.00 H ATOM 2954 C113 OL 132 105.476 68.838 45.477 1.00 0.00 C ATOM 2955 H13R OL 132 105.847 67.926 45.005 1.00 0.00 H ATOM 2956 H13S OL 132 104.397 68.709 45.369 1.00 0.00 H ATOM 2957 C114 OL 132 105.982 70.085 44.804 1.00 0.00 C ATOM 2958 H14R OL 132 105.589 70.985 45.282 1.00 0.00 H ATOM 2959 H14S OL 132 107.071 70.143 44.876 1.00 0.00 H ATOM 2960 C115 OL 132 105.451 70.243 43.376 1.00 0.00 C ATOM 2961 H15R OL 132 104.376 70.067 43.309 1.00 0.00 H ATOM 2962 H15S OL 132 105.558 71.313 43.182 1.00 0.00 H ATOM 2963 C116 OL 132 106.074 69.541 42.177 1.00 0.00 C ATOM 2964 H16R OL 132 105.619 69.982 41.288 1.00 0.00 H ATOM 2965 H16S OL 132 107.132 69.798 42.098 1.00 0.00 H ATOM 2966 C117 OL 132 105.935 68.000 42.043 1.00 0.00 C ATOM 2967 H17R OL 132 106.682 67.439 42.609 1.00 0.00 H ATOM 2968 H17S OL 132 104.913 67.837 42.390 1.00 0.00 H ATOM 2969 C118 OL 132 105.851 67.527 40.597 1.00 0.00 C ATOM 2970 H18R OL 132 105.519 66.489 40.676 1.00 0.00 H ATOM 2971 H18S OL 132 106.852 67.679 40.189 1.00 0.00 H ATOM 2972 H18T OL 132 105.063 68.075 40.077 1.00 0.00 H TER 2973 OL 132 ATOM 2973 C116 PA 133 37.456 41.286 52.348 1.00 0.00 C ATOM 2974 H16R PA 133 37.554 40.281 51.932 1.00 0.00 H ATOM 2975 H16S PA 133 37.235 41.207 53.415 1.00 0.00 H ATOM 2976 H16T PA 133 38.424 41.789 52.305 1.00 0.00 H ATOM 2977 C115 PA 133 36.444 42.174 51.663 1.00 0.00 C ATOM 2978 H15R PA 133 36.312 43.148 52.138 1.00 0.00 H ATOM 2979 H15S PA 133 35.480 41.660 51.657 1.00 0.00 H ATOM 2980 C114 PA 133 36.905 42.361 50.174 1.00 0.00 C ATOM 2981 H14R PA 133 36.134 42.988 49.721 1.00 0.00 H ATOM 2982 H14S PA 133 36.860 41.338 49.793 1.00 0.00 H ATOM 2983 C113 PA 133 38.305 42.893 49.871 1.00 0.00 C ATOM 2984 H13R PA 133 39.025 42.114 50.127 1.00 0.00 H ATOM 2985 H13S PA 133 38.533 43.763 50.491 1.00 0.00 H ATOM 2986 C112 PA 133 38.640 43.160 48.418 1.00 0.00 C ATOM 2987 H12R PA 133 38.378 42.200 47.967 1.00 0.00 H ATOM 2988 H12S PA 133 39.707 43.084 48.200 1.00 0.00 H ATOM 2989 C111 PA 133 37.940 44.365 47.872 1.00 0.00 C ATOM 2990 H11R PA 133 38.442 45.108 48.495 1.00 0.00 H ATOM 2991 H11S PA 133 36.857 44.310 48.003 1.00 0.00 H ATOM 2992 C110 PA 133 38.245 44.607 46.351 1.00 0.00 C ATOM 2993 H10R PA 133 37.487 44.080 45.768 1.00 0.00 H ATOM 2994 H10S PA 133 39.197 44.240 45.960 1.00 0.00 H ATOM 2995 C19 PA 133 38.099 46.021 45.986 1.00 0.00 C ATOM 2996 H9R PA 133 37.113 46.315 46.352 1.00 0.00 H ATOM 2997 H9S PA 133 38.090 46.133 44.900 1.00 0.00 H ATOM 2998 C18 PA 133 39.233 46.953 46.502 1.00 0.00 C ATOM 2999 H8R PA 133 39.194 47.061 47.588 1.00 0.00 H ATOM 3000 H8S PA 133 39.059 47.971 46.147 1.00 0.00 H ATOM 3001 C17 PA 133 40.628 46.538 46.229 1.00 0.00 C ATOM 3002 H7R PA 133 40.709 46.258 45.176 1.00 0.00 H ATOM 3003 H7S PA 133 40.822 45.683 46.879 1.00 0.00 H ATOM 3004 C16 PA 133 41.635 47.711 46.641 1.00 0.00 C ATOM 3005 H6R PA 133 41.493 48.664 46.127 1.00 0.00 H ATOM 3006 H6S PA 133 42.655 47.405 46.400 1.00 0.00 H ATOM 3007 C15 PA 133 41.570 48.055 48.141 1.00 0.00 C ATOM 3008 H5R PA 133 40.582 48.312 48.529 1.00 0.00 H ATOM 3009 H5S PA 133 42.202 48.930 48.312 1.00 0.00 H ATOM 3010 C14 PA 133 41.968 46.764 48.931 1.00 0.00 C ATOM 3011 H4R PA 133 42.841 46.390 48.392 1.00 0.00 H ATOM 3012 H4S PA 133 41.195 45.995 48.973 1.00 0.00 H ATOM 3013 C13 PA 133 42.422 47.077 50.341 1.00 0.00 C ATOM 3014 H3R PA 133 42.135 48.041 50.766 1.00 0.00 H ATOM 3015 H3S PA 133 43.501 47.033 50.178 1.00 0.00 H ATOM 3016 C12 PA 133 42.047 46.025 51.359 1.00 0.00 C ATOM 3017 H2R PA 133 42.658 45.138 51.180 1.00 0.00 H ATOM 3018 H2S PA 133 40.988 45.759 51.331 1.00 0.00 H ATOM 3019 C11 PGR 134 42.478 46.421 52.793 1.00 0.00 C ATOM 3020 O12 PGR 134 43.131 45.716 53.575 1.00 0.00 O ATOM 3021 O11 PGR 134 42.029 47.689 53.116 1.00 0.00 O ATOM 3022 C1 PGR 134 41.958 48.143 54.514 1.00 0.00 C ATOM 3023 HR PGR 134 41.555 47.272 55.038 1.00 0.00 H ATOM 3024 HS PGR 134 41.294 49.003 54.633 1.00 0.00 H ATOM 3025 C2 PGR 134 43.382 48.488 55.086 1.00 0.00 C ATOM 3026 HX PGR 134 44.112 47.689 54.932 1.00 0.00 H ATOM 3027 C3 PGR 134 43.175 48.791 56.558 1.00 0.00 C ATOM 3028 HA PGR 134 42.329 48.179 56.881 1.00 0.00 H ATOM 3029 HB PGR 134 42.821 49.821 56.654 1.00 0.00 H ATOM 3030 O31 PGR 134 44.320 48.390 57.349 1.00 0.00 O ATOM 3031 P31 PGR 134 44.564 48.882 58.884 1.00 0.00 P ATOM 3032 O32 PGR 134 45.305 50.270 58.762 1.00 0.00 O ATOM 3033 C31 PGR 134 45.590 51.081 59.832 1.00 0.00 C ATOM 3034 H1A PGR 134 45.716 52.088 59.425 1.00 0.00 H ATOM 3035 H1B PGR 134 44.836 51.081 60.623 1.00 0.00 H ATOM 3036 C32 PGR 134 46.934 50.694 60.560 1.00 0.00 C ATOM 3037 H2A PGR 134 47.704 50.491 59.812 1.00 0.00 H ATOM 3038 O35 PGR 134 46.697 49.470 61.280 1.00 0.00 O ATOM 3039 HO5A PGR 134 46.123 48.934 60.704 1.00 0.00 H ATOM 3040 C33 PGR 134 47.372 51.786 61.385 1.00 0.00 C ATOM 3041 H3A PGR 134 47.299 52.669 60.746 1.00 0.00 H ATOM 3042 H3B PGR 134 46.681 51.923 62.221 1.00 0.00 H ATOM 3043 O33 PGR 134 43.222 48.988 59.544 1.00 0.00 O ATOM 3044 O34 PGR 134 45.458 47.928 59.436 1.00 0.00 O ATOM 3045 O21 PGR 134 43.844 49.707 54.406 1.00 0.00 O ATOM 3046 C21 PGR 134 44.348 49.577 53.193 1.00 0.00 C ATOM 3047 O22 PGR 134 44.730 48.601 52.603 1.00 0.00 O ATOM 3048 O36 PGR 134 48.708 51.576 61.872 1.00 0.00 O ATOM 3049 HO6A PGR 134 49.197 51.401 61.049 1.00 0.00 H ATOM 3050 C12 OL 135 44.597 50.934 52.524 1.00 0.00 C ATOM 3051 H2R OL 135 43.975 51.720 52.958 1.00 0.00 H ATOM 3052 H2S OL 135 45.572 51.261 52.894 1.00 0.00 H ATOM 3053 C13 OL 135 44.363 50.863 51.035 1.00 0.00 C ATOM 3054 H3R OL 135 45.113 50.215 50.576 1.00 0.00 H ATOM 3055 H3S OL 135 43.435 50.328 50.823 1.00 0.00 H ATOM 3056 C14 OL 135 44.411 52.191 50.327 1.00 0.00 C ATOM 3057 H4R OL 135 44.008 52.090 49.317 1.00 0.00 H ATOM 3058 H4S OL 135 43.731 52.788 50.940 1.00 0.00 H ATOM 3059 C15 OL 135 45.696 52.912 50.362 1.00 0.00 C ATOM 3060 H5R OL 135 46.165 52.809 51.343 1.00 0.00 H ATOM 3061 H5S OL 135 46.389 52.420 49.675 1.00 0.00 H ATOM 3062 C16 OL 135 45.442 54.404 49.994 1.00 0.00 C ATOM 3063 H6R OL 135 44.625 54.396 49.270 1.00 0.00 H ATOM 3064 H6S OL 135 45.039 55.019 50.801 1.00 0.00 H ATOM 3065 C17 OL 135 46.543 55.171 49.246 1.00 0.00 C ATOM 3066 H7R OL 135 46.961 54.511 48.484 1.00 0.00 H ATOM 3067 H7S OL 135 46.128 56.109 48.871 1.00 0.00 H ATOM 3068 C18 OL 135 47.713 55.627 50.092 1.00 0.00 C ATOM 3069 H8R OL 135 47.269 56.176 50.925 1.00 0.00 H ATOM 3070 H8S OL 135 48.139 54.731 50.548 1.00 0.00 H ATOM 3071 C19 OL 135 48.795 56.486 49.532 1.00 0.00 C ATOM 3072 H9R OL 135 48.487 57.523 49.428 1.00 0.00 H ATOM 3073 C110 OL 135 49.974 56.087 49.117 1.00 0.00 C ATOM 3074 H10R OL 135 50.749 56.748 48.735 1.00 0.00 H ATOM 3075 C111 OL 135 50.499 54.680 49.275 1.00 0.00 C ATOM 3076 H11R OL 135 51.583 54.787 49.196 1.00 0.00 H ATOM 3077 H11S OL 135 50.340 54.320 50.294 1.00 0.00 H ATOM 3078 C112 OL 135 50.166 53.653 48.155 1.00 0.00 C ATOM 3079 H12R OL 135 50.823 52.800 48.337 1.00 0.00 H ATOM 3080 H12S OL 135 49.112 53.380 48.248 1.00 0.00 H ATOM 3081 C113 OL 135 50.506 54.084 46.749 1.00 0.00 C ATOM 3082 H13R OL 135 49.738 54.681 46.253 1.00 0.00 H ATOM 3083 H13S OL 135 51.385 54.729 46.821 1.00 0.00 H ATOM 3084 C114 OL 135 50.853 52.841 45.930 1.00 0.00 C ATOM 3085 H14R OL 135 51.699 52.348 46.412 1.00 0.00 H ATOM 3086 H14S OL 135 50.000 52.164 45.849 1.00 0.00 H ATOM 3087 C115 OL 135 51.196 53.136 44.444 1.00 0.00 C ATOM 3088 H15R OL 135 50.337 52.840 43.838 1.00 0.00 H ATOM 3089 H15S OL 135 51.335 54.212 44.322 1.00 0.00 H ATOM 3090 C116 OL 135 52.544 52.531 43.943 1.00 0.00 C ATOM 3091 H16R OL 135 52.730 52.960 42.956 1.00 0.00 H ATOM 3092 H16S OL 135 53.344 53.010 44.511 1.00 0.00 H ATOM 3093 C117 OL 135 52.634 51.035 43.800 1.00 0.00 C ATOM 3094 H17R OL 135 53.480 50.735 43.178 1.00 0.00 H ATOM 3095 H17S OL 135 52.789 50.770 44.848 1.00 0.00 H ATOM 3096 C118 OL 135 51.356 50.450 43.076 1.00 0.00 C ATOM 3097 H18R OL 135 51.074 51.054 42.212 1.00 0.00 H ATOM 3098 H18S OL 135 50.471 50.409 43.716 1.00 0.00 H ATOM 3099 H18T OL 135 51.499 49.422 42.737 1.00 0.00 H TER 3100 OL 135 ATOM 3100 C116 PA 136 78.508 40.107 39.458 1.00 0.00 C ATOM 3101 H16R PA 136 77.778 40.566 38.787 1.00 0.00 H ATOM 3102 H16S PA 136 78.240 39.055 39.579 1.00 0.00 H ATOM 3103 H16T PA 136 79.450 39.975 38.923 1.00 0.00 H ATOM 3104 C115 PA 136 78.607 40.762 40.757 1.00 0.00 C ATOM 3105 H15R PA 136 79.454 40.317 41.283 1.00 0.00 H ATOM 3106 H15S PA 136 77.827 40.458 41.458 1.00 0.00 H ATOM 3107 C114 PA 136 78.728 42.232 40.695 1.00 0.00 C ATOM 3108 H14R PA 136 77.843 42.785 40.372 1.00 0.00 H ATOM 3109 H14S PA 136 79.415 42.626 39.943 1.00 0.00 H ATOM 3110 C113 PA 136 79.161 42.973 42.035 1.00 0.00 C ATOM 3111 H13R PA 136 79.275 44.033 41.801 1.00 0.00 H ATOM 3112 H13S PA 136 80.194 42.687 42.245 1.00 0.00 H ATOM 3113 C112 PA 136 78.315 42.695 43.273 1.00 0.00 C ATOM 3114 H12R PA 136 78.779 43.163 44.144 1.00 0.00 H ATOM 3115 H12S PA 136 78.247 41.609 43.367 1.00 0.00 H ATOM 3116 C111 PA 136 76.881 43.304 43.087 1.00 0.00 C ATOM 3117 H11R PA 136 76.576 42.878 42.129 1.00 0.00 H ATOM 3118 H11S PA 136 76.831 44.379 42.900 1.00 0.00 H ATOM 3119 C110 PA 136 75.857 42.909 44.176 1.00 0.00 C ATOM 3120 H10R PA 136 76.092 41.913 44.557 1.00 0.00 H ATOM 3121 H10S PA 136 74.858 42.810 43.747 1.00 0.00 H ATOM 3122 C19 PA 136 75.738 44.050 45.108 1.00 0.00 C ATOM 3123 H9R PA 136 75.156 44.825 44.604 1.00 0.00 H ATOM 3124 H9S PA 136 76.706 44.527 45.274 1.00 0.00 H ATOM 3125 C18 PA 136 74.997 43.787 46.322 1.00 0.00 C ATOM 3126 H8R PA 136 75.209 42.775 46.673 1.00 0.00 H ATOM 3127 H8S PA 136 73.929 43.673 46.124 1.00 0.00 H ATOM 3128 C17 PA 136 75.154 44.759 47.504 1.00 0.00 C ATOM 3129 H7R PA 136 74.331 44.498 48.173 1.00 0.00 H ATOM 3130 H7S PA 136 74.811 45.775 47.301 1.00 0.00 H ATOM 3131 C16 PA 136 76.498 44.773 48.184 1.00 0.00 C ATOM 3132 H6R PA 136 77.256 44.975 47.424 1.00 0.00 H ATOM 3133 H6S PA 136 76.746 43.764 48.521 1.00 0.00 H ATOM 3134 C15 PA 136 76.381 45.696 49.470 1.00 0.00 C ATOM 3135 H5R PA 136 75.778 45.195 50.231 1.00 0.00 H ATOM 3136 H5S PA 136 75.865 46.659 49.458 1.00 0.00 H ATOM 3137 C14 PA 136 77.662 45.899 50.208 1.00 0.00 C ATOM 3138 H4R PA 136 78.407 46.449 49.630 1.00 0.00 H ATOM 3139 H4S PA 136 78.077 44.911 50.418 1.00 0.00 H ATOM 3140 C13 PA 136 77.478 46.678 51.468 1.00 0.00 C ATOM 3141 H3R PA 136 76.473 46.472 51.843 1.00 0.00 H ATOM 3142 H3S PA 136 77.382 47.747 51.262 1.00 0.00 H ATOM 3143 C12 PA 136 78.522 46.503 52.492 1.00 0.00 C ATOM 3144 H2R PA 136 79.440 46.967 52.124 1.00 0.00 H ATOM 3145 H2S PA 136 78.659 45.438 52.688 1.00 0.00 H ATOM 3146 C11 PGR 137 78.084 47.231 53.732 1.00 0.00 C ATOM 3147 O12 PGR 137 78.284 48.396 53.932 1.00 0.00 O ATOM 3148 O11 PGR 137 77.480 46.473 54.664 1.00 0.00 O ATOM 3149 C1 PGR 137 76.969 47.220 55.820 1.00 0.00 C ATOM 3150 HR PGR 137 76.273 47.953 55.404 1.00 0.00 H ATOM 3151 HS PGR 137 77.818 47.693 56.320 1.00 0.00 H ATOM 3152 C2 PGR 137 76.277 46.238 56.773 1.00 0.00 C ATOM 3153 HX PGR 137 75.773 46.804 57.560 1.00 0.00 H ATOM 3154 C3 PGR 137 77.280 45.353 57.448 1.00 0.00 C ATOM 3155 HA PGR 137 78.079 45.991 57.833 1.00 0.00 H ATOM 3156 HB PGR 137 77.724 44.734 56.664 1.00 0.00 H ATOM 3157 O31 PGR 137 76.791 44.594 58.616 1.00 0.00 O ATOM 3158 P31 PGR 137 77.331 44.978 60.108 1.00 0.00 P ATOM 3159 O32 PGR 137 78.766 44.355 60.360 1.00 0.00 O ATOM 3160 C31 PGR 137 78.986 42.939 60.561 1.00 0.00 C ATOM 3161 H1A PGR 137 79.850 42.831 59.899 1.00 0.00 H ATOM 3162 H1B PGR 137 78.110 42.394 60.200 1.00 0.00 H ATOM 3163 C32 PGR 137 79.345 42.602 61.980 1.00 0.00 C ATOM 3164 H2A PGR 137 79.574 41.534 62.004 1.00 0.00 H ATOM 3165 O35 PGR 137 78.189 42.843 62.776 1.00 0.00 O ATOM 3166 HO5A PGR 137 77.898 43.767 62.675 1.00 0.00 H ATOM 3167 C33 PGR 137 80.530 43.451 62.538 1.00 0.00 C ATOM 3168 H3A PGR 137 81.369 43.109 61.926 1.00 0.00 H ATOM 3169 H3B PGR 137 80.362 44.494 62.258 1.00 0.00 H ATOM 3170 O33 PGR 137 77.626 46.421 60.221 1.00 0.00 O ATOM 3171 O34 PGR 137 76.473 44.366 61.184 1.00 0.00 O ATOM 3172 O21 PGR 137 75.315 45.432 56.009 1.00 0.00 O ATOM 3173 C21 PGR 137 74.218 45.940 55.609 1.00 0.00 C ATOM 3174 O22 PGR 137 73.882 47.100 55.735 1.00 0.00 O ATOM 3175 O36 PGR 137 80.848 43.267 63.904 1.00 0.00 O ATOM 3176 HO6A PGR 137 80.015 43.517 64.343 1.00 0.00 H ATOM 3177 C12 OL 138 73.402 44.961 54.777 1.00 0.00 C ATOM 3178 H2R OL 138 73.086 44.084 55.347 1.00 0.00 H ATOM 3179 H2S OL 138 72.477 45.463 54.486 1.00 0.00 H ATOM 3180 C13 OL 138 74.173 44.491 53.522 1.00 0.00 C ATOM 3181 H3R OL 138 73.422 44.384 52.737 1.00 0.00 H ATOM 3182 H3S OL 138 74.726 45.332 53.097 1.00 0.00 H ATOM 3183 C14 OL 138 74.942 43.178 53.582 1.00 0.00 C ATOM 3184 H4R OL 138 75.694 43.176 54.374 1.00 0.00 H ATOM 3185 H4S OL 138 74.146 42.452 53.758 1.00 0.00 H ATOM 3186 C15 OL 138 75.508 42.864 52.162 1.00 0.00 C ATOM 3187 H5R OL 138 74.670 42.925 51.464 1.00 0.00 H ATOM 3188 H5S OL 138 76.322 43.526 51.859 1.00 0.00 H ATOM 3189 C16 OL 138 76.036 41.464 51.963 1.00 0.00 C ATOM 3190 H6R OL 138 76.847 41.500 52.693 1.00 0.00 H ATOM 3191 H6S OL 138 75.374 40.722 52.415 1.00 0.00 H ATOM 3192 C17 OL 138 76.602 41.226 50.661 1.00 0.00 C ATOM 3193 H7R OL 138 76.589 40.166 50.400 1.00 0.00 H ATOM 3194 H7S OL 138 75.974 41.736 49.928 1.00 0.00 H ATOM 3195 C18 OL 138 78.138 41.656 50.647 1.00 0.00 C ATOM 3196 H8R OL 138 78.549 41.478 49.651 1.00 0.00 H ATOM 3197 H8S OL 138 78.153 42.734 50.821 1.00 0.00 H ATOM 3198 C19 OL 138 79.080 41.011 51.564 1.00 0.00 C ATOM 3199 H9R OL 138 79.013 39.926 51.571 1.00 0.00 H ATOM 3200 C110 OL 138 80.106 41.611 52.260 1.00 0.00 C ATOM 3201 H10R OL 138 80.824 41.033 52.836 1.00 0.00 H ATOM 3202 C111 OL 138 80.443 43.041 52.238 1.00 0.00 C ATOM 3203 H11R OL 138 80.101 43.586 51.356 1.00 0.00 H ATOM 3204 H11S OL 138 79.937 43.501 53.089 1.00 0.00 H ATOM 3205 C112 OL 138 81.908 43.249 52.338 1.00 0.00 C ATOM 3206 H12R OL 138 82.291 42.812 53.263 1.00 0.00 H ATOM 3207 H12S OL 138 82.499 42.630 51.659 1.00 0.00 H ATOM 3208 C113 OL 138 82.371 44.732 52.255 1.00 0.00 C ATOM 3209 H13R OL 138 82.031 45.093 51.282 1.00 0.00 H ATOM 3210 H13S OL 138 81.996 45.471 52.966 1.00 0.00 H ATOM 3211 C114 OL 138 83.920 44.862 52.138 1.00 0.00 C ATOM 3212 H14R OL 138 84.388 44.302 52.952 1.00 0.00 H ATOM 3213 H14S OL 138 84.347 44.211 51.372 1.00 0.00 H ATOM 3214 C115 OL 138 84.305 46.326 52.304 1.00 0.00 C ATOM 3215 H15R OL 138 84.008 46.858 51.398 1.00 0.00 H ATOM 3216 H15S OL 138 83.838 46.725 53.207 1.00 0.00 H ATOM 3217 C116 OL 138 85.817 46.487 52.548 1.00 0.00 C ATOM 3218 H16R OL 138 86.032 45.986 53.495 1.00 0.00 H ATOM 3219 H16S OL 138 86.338 45.816 51.862 1.00 0.00 H ATOM 3220 C117 OL 138 86.381 47.879 52.494 1.00 0.00 C ATOM 3221 H17R OL 138 86.319 48.355 51.513 1.00 0.00 H ATOM 3222 H17S OL 138 85.863 48.562 53.171 1.00 0.00 H ATOM 3223 C118 OL 138 87.850 47.903 52.888 1.00 0.00 C ATOM 3224 H18R OL 138 88.462 47.786 51.992 1.00 0.00 H ATOM 3225 H18S OL 138 88.058 47.214 53.710 1.00 0.00 H ATOM 3226 H18T OL 138 88.107 48.906 53.234 1.00 0.00 H TER 3227 OL 138 ATOM 3227 C116 PA 139 78.813 65.283 44.755 1.00 0.00 C ATOM 3228 H16R PA 139 79.327 65.702 43.887 1.00 0.00 H ATOM 3229 H16S PA 139 78.316 64.376 44.405 1.00 0.00 H ATOM 3230 H16T PA 139 79.553 64.986 45.501 1.00 0.00 H ATOM 3231 C115 PA 139 77.970 66.356 45.461 1.00 0.00 C ATOM 3232 H15R PA 139 77.449 65.834 46.266 1.00 0.00 H ATOM 3233 H15S PA 139 77.242 66.707 44.726 1.00 0.00 H ATOM 3234 C114 PA 139 78.736 67.432 46.243 1.00 0.00 C ATOM 3235 H14R PA 139 79.485 67.811 45.543 1.00 0.00 H ATOM 3236 H14S PA 139 79.296 67.048 47.098 1.00 0.00 H ATOM 3237 C113 PA 139 77.898 68.560 46.716 1.00 0.00 C ATOM 3238 H13R PA 139 77.052 68.096 47.226 1.00 0.00 H ATOM 3239 H13S PA 139 77.350 69.055 45.912 1.00 0.00 H ATOM 3240 C112 PA 139 78.628 69.437 47.709 1.00 0.00 C ATOM 3241 H12R PA 139 79.695 69.324 47.507 1.00 0.00 H ATOM 3242 H12S PA 139 78.492 69.061 48.725 1.00 0.00 H ATOM 3243 C111 PA 139 78.040 70.868 47.811 1.00 0.00 C ATOM 3244 H11R PA 139 76.953 70.974 47.797 1.00 0.00 H ATOM 3245 H11S PA 139 78.218 71.453 46.905 1.00 0.00 H ATOM 3246 C110 PA 139 78.624 71.721 48.962 1.00 0.00 C ATOM 3247 H10R PA 139 78.586 71.026 49.804 1.00 0.00 H ATOM 3248 H10S PA 139 77.980 72.550 49.264 1.00 0.00 H ATOM 3249 C19 PA 139 80.037 72.208 48.800 1.00 0.00 C ATOM 3250 H9R PA 139 80.041 73.060 48.118 1.00 0.00 H ATOM 3251 H9S PA 139 80.704 71.519 48.278 1.00 0.00 H ATOM 3252 C18 PA 139 80.873 72.371 50.135 1.00 0.00 C ATOM 3253 H8R PA 139 80.501 73.241 50.681 1.00 0.00 H ATOM 3254 H8S PA 139 81.914 72.616 49.913 1.00 0.00 H ATOM 3255 C17 PA 139 80.896 71.149 51.113 1.00 0.00 C ATOM 3256 H7R PA 139 79.877 70.961 51.458 1.00 0.00 H ATOM 3257 H7S PA 139 81.383 71.385 52.061 1.00 0.00 H ATOM 3258 C16 PA 139 81.389 69.844 50.390 1.00 0.00 C ATOM 3259 H6R PA 139 80.654 69.584 49.625 1.00 0.00 H ATOM 3260 H6S PA 139 81.324 68.943 51.004 1.00 0.00 H ATOM 3261 C15 PA 139 82.767 69.816 49.603 1.00 0.00 C ATOM 3262 H5R PA 139 82.905 70.805 49.160 1.00 0.00 H ATOM 3263 H5S PA 139 82.727 69.128 48.756 1.00 0.00 H ATOM 3264 C14 PA 139 83.889 69.474 50.556 1.00 0.00 C ATOM 3265 H4R PA 139 83.763 68.435 50.870 1.00 0.00 H ATOM 3266 H4S PA 139 83.727 70.083 51.447 1.00 0.00 H ATOM 3267 C13 PA 139 85.274 69.714 49.865 1.00 0.00 C ATOM 3268 H3R PA 139 85.334 70.750 49.524 1.00 0.00 H ATOM 3269 H3S PA 139 85.354 69.108 48.961 1.00 0.00 H ATOM 3270 C12 PA 139 86.585 69.451 50.630 1.00 0.00 C ATOM 3271 H2R PA 139 87.419 69.621 49.946 1.00 0.00 H ATOM 3272 H2S PA 139 86.570 68.380 50.841 1.00 0.00 H ATOM 3273 C11 PGR 140 86.717 70.268 51.903 1.00 0.00 C ATOM 3274 O12 PGR 140 86.203 71.321 52.103 1.00 0.00 O ATOM 3275 O11 PGR 140 87.659 69.697 52.660 1.00 0.00 O ATOM 3276 C1 PGR 140 88.007 70.240 53.969 1.00 0.00 C ATOM 3277 HR PGR 140 88.191 71.303 53.793 1.00 0.00 H ATOM 3278 HS PGR 140 88.965 69.829 54.296 1.00 0.00 H ATOM 3279 C2 PGR 140 86.844 70.131 54.968 1.00 0.00 C ATOM 3280 HX PGR 140 85.846 70.465 54.674 1.00 0.00 H ATOM 3281 C3 PGR 140 87.143 70.885 56.239 1.00 0.00 C ATOM 3282 HA PGR 140 87.705 71.813 56.103 1.00 0.00 H ATOM 3283 HB PGR 140 87.764 70.321 56.939 1.00 0.00 H ATOM 3284 O31 PGR 140 85.898 71.364 56.794 1.00 0.00 O ATOM 3285 P31 PGR 140 84.801 70.369 57.487 1.00 0.00 P ATOM 3286 O32 PGR 140 83.970 69.652 56.278 1.00 0.00 O ATOM 3287 C31 PGR 140 82.591 69.913 56.011 1.00 0.00 C ATOM 3288 H1A PGR 140 82.340 70.969 56.138 1.00 0.00 H ATOM 3289 H1B PGR 140 82.158 69.358 56.847 1.00 0.00 H ATOM 3290 C32 PGR 140 82.144 69.367 54.629 1.00 0.00 C ATOM 3291 H2A PGR 140 82.486 68.340 54.480 1.00 0.00 H ATOM 3292 O35 PGR 140 82.777 70.193 53.652 1.00 0.00 O ATOM 3293 HO5A PGR 140 83.555 69.638 53.467 1.00 0.00 H ATOM 3294 C33 PGR 140 80.615 69.396 54.411 1.00 0.00 C ATOM 3295 H3A PGR 140 80.450 68.911 53.445 1.00 0.00 H ATOM 3296 H3B PGR 140 80.183 68.892 55.279 1.00 0.00 H ATOM 3297 O33 PGR 140 85.630 69.417 58.247 1.00 0.00 O ATOM 3298 O34 PGR 140 83.854 71.286 58.236 1.00 0.00 O ATOM 3299 O21 PGR 140 86.752 68.733 55.336 1.00 0.00 O ATOM 3300 C21 PGR 140 85.844 68.023 54.641 1.00 0.00 C ATOM 3301 O22 PGR 140 85.111 68.487 53.785 1.00 0.00 O ATOM 3302 O36 PGR 140 80.087 70.738 54.547 1.00 0.00 O ATOM 3303 HO6A PGR 140 80.791 71.175 54.036 1.00 0.00 H ATOM 3304 C12 OL 141 85.965 66.509 55.013 1.00 0.00 C ATOM 3305 H2R OL 141 87.020 66.238 54.938 1.00 0.00 H ATOM 3306 H2S OL 141 85.679 66.517 56.067 1.00 0.00 H ATOM 3307 C13 OL 141 85.071 65.531 54.255 1.00 0.00 C ATOM 3308 H3R OL 141 84.037 65.855 54.392 1.00 0.00 H ATOM 3309 H3S OL 141 85.338 65.551 53.196 1.00 0.00 H ATOM 3310 C14 OL 141 85.462 64.117 54.626 1.00 0.00 C ATOM 3311 H4R OL 141 86.525 64.003 54.402 1.00 0.00 H ATOM 3312 H4S OL 141 85.328 64.108 55.709 1.00 0.00 H ATOM 3313 C15 OL 141 84.600 62.899 54.177 1.00 0.00 C ATOM 3314 H5R OL 141 84.579 62.061 54.877 1.00 0.00 H ATOM 3315 H5S OL 141 83.561 63.220 54.277 1.00 0.00 H ATOM 3316 C16 OL 141 84.925 62.399 52.800 1.00 0.00 C ATOM 3317 H6R OL 141 84.216 61.678 52.387 1.00 0.00 H ATOM 3318 H6S OL 141 84.996 63.151 52.012 1.00 0.00 H ATOM 3319 C17 OL 141 86.165 61.634 52.848 1.00 0.00 C ATOM 3320 H7R OL 141 86.934 62.069 53.490 1.00 0.00 H ATOM 3321 H7S OL 141 85.916 60.687 53.333 1.00 0.00 H ATOM 3322 C18 OL 141 86.929 61.384 51.485 1.00 0.00 C ATOM 3323 H8R OL 141 87.092 62.348 50.998 1.00 0.00 H ATOM 3324 H8S OL 141 87.928 61.033 51.754 1.00 0.00 H ATOM 3325 C19 OL 141 86.195 60.420 50.659 1.00 0.00 C ATOM 3326 H9R OL 141 85.902 59.519 51.193 1.00 0.00 H ATOM 3327 C110 OL 141 85.755 60.520 49.416 1.00 0.00 C ATOM 3328 H10R OL 141 85.262 59.710 48.885 1.00 0.00 H ATOM 3329 C111 OL 141 86.085 61.580 48.436 1.00 0.00 C ATOM 3330 H11R OL 141 86.543 62.435 48.937 1.00 0.00 H ATOM 3331 H11S OL 141 86.711 61.138 47.658 1.00 0.00 H ATOM 3332 C112 OL 141 84.836 62.063 47.667 1.00 0.00 C ATOM 3333 H12R OL 141 83.927 62.092 48.272 1.00 0.00 H ATOM 3334 H12S OL 141 84.915 63.115 47.387 1.00 0.00 H ATOM 3335 C113 OL 141 84.571 61.178 46.447 1.00 0.00 C ATOM 3336 H13R OL 141 85.295 61.341 45.645 1.00 0.00 H ATOM 3337 H13S OL 141 84.590 60.118 46.711 1.00 0.00 H ATOM 3338 C114 OL 141 83.275 61.502 45.743 1.00 0.00 C ATOM 3339 H14R OL 141 82.360 61.129 46.208 1.00 0.00 H ATOM 3340 H14S OL 141 83.027 62.563 45.681 1.00 0.00 H ATOM 3341 C115 OL 141 83.268 60.966 44.326 1.00 0.00 C ATOM 3342 H15R OL 141 84.175 61.406 43.907 1.00 0.00 H ATOM 3343 H15S OL 141 83.573 59.917 44.306 1.00 0.00 H ATOM 3344 C116 OL 141 82.131 61.351 43.433 1.00 0.00 C ATOM 3345 H16R OL 141 81.307 60.735 43.797 1.00 0.00 H ATOM 3346 H16S OL 141 81.811 62.384 43.584 1.00 0.00 H ATOM 3347 C117 OL 141 82.306 61.122 41.932 1.00 0.00 C ATOM 3348 H17R OL 141 83.104 61.762 41.550 1.00 0.00 H ATOM 3349 H17S OL 141 82.564 60.107 41.621 1.00 0.00 H ATOM 3350 C118 OL 141 81.236 61.475 41.027 1.00 0.00 C ATOM 3351 H18R OL 141 81.636 61.485 40.011 1.00 0.00 H ATOM 3352 H18S OL 141 80.943 62.495 41.287 1.00 0.00 H ATOM 3353 H18T OL 141 80.328 60.882 41.158 1.00 0.00 H TER 3354 OL 141 ATOM 3354 C116 PA 142 61.369 104.562 41.687 1.00 0.00 C ATOM 3355 H16R PA 142 60.878 103.913 42.415 1.00 0.00 H ATOM 3356 H16S PA 142 61.865 103.836 41.039 1.00 0.00 H ATOM 3357 H16T PA 142 60.518 105.017 41.176 1.00 0.00 H ATOM 3358 C115 PA 142 62.309 105.572 42.400 1.00 0.00 C ATOM 3359 H15R PA 142 61.741 106.223 43.069 1.00 0.00 H ATOM 3360 H15S PA 142 62.863 106.209 41.707 1.00 0.00 H ATOM 3361 C114 PA 142 63.403 104.862 43.108 1.00 0.00 C ATOM 3362 H14R PA 142 63.914 104.297 42.325 1.00 0.00 H ATOM 3363 H14S PA 142 63.022 104.152 43.844 1.00 0.00 H ATOM 3364 C113 PA 142 64.449 105.788 43.843 1.00 0.00 C ATOM 3365 H13R PA 142 63.993 106.658 44.319 1.00 0.00 H ATOM 3366 H13S PA 142 65.127 106.106 43.048 1.00 0.00 H ATOM 3367 C112 PA 142 65.358 105.045 44.808 1.00 0.00 C ATOM 3368 H12R PA 142 65.565 103.981 44.676 1.00 0.00 H ATOM 3369 H12S PA 142 64.942 105.171 45.810 1.00 0.00 H ATOM 3370 C111 PA 142 66.747 105.716 44.932 1.00 0.00 C ATOM 3371 H11R PA 142 66.604 106.746 45.267 1.00 0.00 H ATOM 3372 H11S PA 142 67.169 105.873 43.938 1.00 0.00 H ATOM 3373 C110 PA 142 67.692 104.979 45.804 1.00 0.00 C ATOM 3374 H10R PA 142 67.692 103.924 45.521 1.00 0.00 H ATOM 3375 H10S PA 142 67.193 104.905 46.773 1.00 0.00 H ATOM 3376 C19 PA 142 68.977 105.763 45.922 1.00 0.00 C ATOM 3377 H9R PA 142 68.828 106.663 46.522 1.00 0.00 H ATOM 3378 H9S PA 142 69.274 106.105 44.928 1.00 0.00 H ATOM 3379 C18 PA 142 70.056 104.745 46.431 1.00 0.00 C ATOM 3380 H8R PA 142 70.963 105.342 46.549 1.00 0.00 H ATOM 3381 H8S PA 142 70.319 103.975 45.704 1.00 0.00 H ATOM 3382 C17 PA 142 69.763 103.830 47.756 1.00 0.00 C ATOM 3383 H7R PA 142 69.188 102.917 47.585 1.00 0.00 H ATOM 3384 H7S PA 142 69.209 104.443 48.469 1.00 0.00 H ATOM 3385 C16 PA 142 71.038 103.462 48.418 1.00 0.00 C ATOM 3386 H6R PA 142 71.627 104.380 48.468 1.00 0.00 H ATOM 3387 H6S PA 142 71.756 102.842 47.877 1.00 0.00 H ATOM 3388 C15 PA 142 70.947 102.882 49.883 1.00 0.00 C ATOM 3389 H5R PA 142 70.558 103.532 50.669 1.00 0.00 H ATOM 3390 H5S PA 142 72.018 102.781 50.066 1.00 0.00 H ATOM 3391 C14 PA 142 70.336 101.516 50.114 1.00 0.00 C ATOM 3392 H4R PA 142 70.890 100.834 49.465 1.00 0.00 H ATOM 3393 H4S PA 142 69.412 101.268 49.586 1.00 0.00 H ATOM 3394 C13 PA 142 70.448 101.163 51.558 1.00 0.00 C ATOM 3395 H3R PA 142 69.642 101.614 52.139 1.00 0.00 H ATOM 3396 H3S PA 142 71.304 101.678 51.999 1.00 0.00 H ATOM 3397 C12 PA 142 70.417 99.705 51.979 1.00 0.00 C ATOM 3398 H2R PA 142 71.118 99.043 51.467 1.00 0.00 H ATOM 3399 H2S PA 142 69.437 99.371 51.631 1.00 0.00 H ATOM 3400 C11 PC 143 70.570 99.415 53.517 1.00 0.00 C ATOM 3401 O12 PC 143 70.889 100.275 54.333 1.00 0.00 O ATOM 3402 O11 PC 143 70.207 98.186 53.853 1.00 0.00 O ATOM 3403 C1 PC 143 70.043 97.868 55.270 1.00 0.00 C ATOM 3404 HR PC 143 69.386 98.620 55.715 1.00 0.00 H ATOM 3405 HS PC 143 70.952 97.895 55.877 1.00 0.00 H ATOM 3406 C2 PC 143 69.346 96.495 55.406 1.00 0.00 C ATOM 3407 HX PC 143 68.409 96.547 54.847 1.00 0.00 H ATOM 3408 C3 PC 143 69.243 96.113 56.858 1.00 0.00 C ATOM 3409 HA PC 143 68.891 95.081 56.930 1.00 0.00 H ATOM 3410 HB PC 143 68.600 96.824 57.383 1.00 0.00 H ATOM 3411 O31 PC 143 70.580 96.116 57.370 1.00 0.00 O ATOM 3412 P31 PC 143 70.810 96.566 58.860 1.00 0.00 P ATOM 3413 O32 PC 143 70.364 98.008 59.019 1.00 0.00 O ATOM 3414 C31 PC 143 70.910 99.039 59.739 1.00 0.00 C ATOM 3415 H1A PC 143 71.902 99.319 59.374 1.00 0.00 H ATOM 3416 H1B PC 143 71.051 98.816 60.800 1.00 0.00 H ATOM 3417 C32 PC 143 69.911 100.181 59.553 1.00 0.00 C ATOM 3418 H2A PC 143 69.742 100.399 58.497 1.00 0.00 H ATOM 3419 H2B PC 143 70.410 101.062 59.959 1.00 0.00 H ATOM 3420 N31 PC 143 68.547 100.137 60.157 1.00 0.00 N ATOM 3421 C33 PC 143 68.532 100.162 61.624 1.00 0.00 C ATOM 3422 H3A PC 143 68.155 101.168 61.814 1.00 0.00 H ATOM 3423 H3B PC 143 69.526 100.056 62.060 1.00 0.00 H ATOM 3424 H3C PC 143 67.717 99.576 62.052 1.00 0.00 H ATOM 3425 C34 PC 143 67.800 101.292 59.676 1.00 0.00 C ATOM 3426 H4A PC 143 67.592 101.245 58.606 1.00 0.00 H ATOM 3427 H4B PC 143 68.316 102.216 59.939 1.00 0.00 H ATOM 3428 H4C PC 143 66.850 101.196 60.204 1.00 0.00 H ATOM 3429 C35 PC 143 67.779 98.919 59.808 1.00 0.00 C ATOM 3430 H5A PC 143 67.917 98.825 58.730 1.00 0.00 H ATOM 3431 H5B PC 143 66.739 99.083 60.094 1.00 0.00 H ATOM 3432 H5C PC 143 68.008 97.988 60.328 1.00 0.00 H ATOM 3433 O33 PC 143 69.923 95.811 59.807 1.00 0.00 O ATOM 3434 O34 PC 143 72.239 96.638 59.128 1.00 0.00 O ATOM 3435 O21 PC 143 70.132 95.529 54.736 1.00 0.00 O ATOM 3436 C21 PC 143 69.565 94.357 54.404 1.00 0.00 C ATOM 3437 O22 PC 143 68.390 94.179 54.580 1.00 0.00 O ATOM 3438 C12 OL 144 70.637 93.440 53.822 1.00 0.00 C ATOM 3439 H2R OL 144 70.821 93.744 52.790 1.00 0.00 H ATOM 3440 H2S OL 144 71.582 93.775 54.255 1.00 0.00 H ATOM 3441 C13 OL 144 70.383 91.957 53.932 1.00 0.00 C ATOM 3442 H3R OL 144 71.319 91.398 53.994 1.00 0.00 H ATOM 3443 H3S OL 144 69.845 91.805 54.870 1.00 0.00 H ATOM 3444 C14 OL 144 69.366 91.400 52.907 1.00 0.00 C ATOM 3445 H4R OL 144 69.201 90.340 53.113 1.00 0.00 H ATOM 3446 H4S OL 144 68.399 91.905 52.951 1.00 0.00 H ATOM 3447 C15 OL 144 69.928 91.394 51.380 1.00 0.00 C ATOM 3448 H5R OL 144 70.136 92.410 51.036 1.00 0.00 H ATOM 3449 H5S OL 144 70.895 90.910 51.533 1.00 0.00 H ATOM 3450 C16 OL 144 69.080 90.705 50.299 1.00 0.00 C ATOM 3451 H6R OL 144 68.864 89.764 50.809 1.00 0.00 H ATOM 3452 H6S OL 144 68.241 91.386 50.144 1.00 0.00 H ATOM 3453 C17 OL 144 69.907 90.623 49.042 1.00 0.00 C ATOM 3454 H7R OL 144 70.832 90.060 49.182 1.00 0.00 H ATOM 3455 H7S OL 144 69.285 89.952 48.447 1.00 0.00 H ATOM 3456 C18 OL 144 70.087 91.862 48.179 1.00 0.00 C ATOM 3457 H8R OL 144 69.052 92.166 48.006 1.00 0.00 H ATOM 3458 H8S OL 144 70.620 92.562 48.826 1.00 0.00 H ATOM 3459 C19 OL 144 70.900 91.729 46.904 1.00 0.00 C ATOM 3460 H9R OL 144 71.737 91.036 46.862 1.00 0.00 H ATOM 3461 C110 OL 144 70.665 92.529 45.856 1.00 0.00 C ATOM 3462 H10R OL 144 71.300 92.412 44.982 1.00 0.00 H ATOM 3463 C111 OL 144 69.575 93.573 45.719 1.00 0.00 C ATOM 3464 H11R OL 144 69.040 93.965 46.586 1.00 0.00 H ATOM 3465 H11S OL 144 69.964 94.489 45.268 1.00 0.00 H ATOM 3466 C112 OL 144 68.499 92.969 44.796 1.00 0.00 C ATOM 3467 H12R OL 144 69.095 92.974 43.881 1.00 0.00 H ATOM 3468 H12S OL 144 68.168 91.951 45.011 1.00 0.00 H ATOM 3469 C113 OL 144 67.326 93.882 44.549 1.00 0.00 C ATOM 3470 H13R OL 144 67.642 94.718 43.923 1.00 0.00 H ATOM 3471 H13S OL 144 66.707 93.330 43.838 1.00 0.00 H ATOM 3472 C114 OL 144 66.480 94.271 45.779 1.00 0.00 C ATOM 3473 H14R OL 144 66.385 93.400 46.431 1.00 0.00 H ATOM 3474 H14S OL 144 66.945 95.057 46.377 1.00 0.00 H ATOM 3475 C115 OL 144 65.031 94.638 45.327 1.00 0.00 C ATOM 3476 H15R OL 144 64.843 95.129 44.369 1.00 0.00 H ATOM 3477 H15S OL 144 64.630 93.690 44.963 1.00 0.00 H ATOM 3478 C116 OL 144 64.191 95.361 46.455 1.00 0.00 C ATOM 3479 H16R OL 144 64.175 94.751 47.361 1.00 0.00 H ATOM 3480 H16S OL 144 64.705 96.278 46.750 1.00 0.00 H ATOM 3481 C117 OL 144 62.757 95.745 46.012 1.00 0.00 C ATOM 3482 H17R OL 144 62.672 96.468 45.198 1.00 0.00 H ATOM 3483 H17S OL 144 62.281 94.853 45.599 1.00 0.00 H ATOM 3484 C118 OL 144 61.826 96.054 47.182 1.00 0.00 C ATOM 3485 H18R OL 144 60.842 96.377 46.834 1.00 0.00 H ATOM 3486 H18S OL 144 62.229 96.902 47.740 1.00 0.00 H ATOM 3487 H18T OL 144 61.810 95.250 47.921 1.00 0.00 H TER 3488 OL 144 ATOM 3488 C116 PA 145 79.733 76.433 48.346 1.00 0.00 C ATOM 3489 H16R PA 145 79.540 75.692 49.125 1.00 0.00 H ATOM 3490 H16S PA 145 79.999 77.371 48.838 1.00 0.00 H ATOM 3491 H16T PA 145 80.525 76.188 47.636 1.00 0.00 H ATOM 3492 C115 PA 145 78.567 76.804 47.479 1.00 0.00 C ATOM 3493 H15R PA 145 77.649 76.472 47.968 1.00 0.00 H ATOM 3494 H15S PA 145 78.790 76.210 46.590 1.00 0.00 H ATOM 3495 C114 PA 145 78.563 78.282 47.008 1.00 0.00 C ATOM 3496 H14R PA 145 77.914 78.405 46.139 1.00 0.00 H ATOM 3497 H14S PA 145 79.530 78.610 46.621 1.00 0.00 H ATOM 3498 C113 PA 145 78.005 79.188 48.083 1.00 0.00 C ATOM 3499 H13R PA 145 78.589 79.195 49.005 1.00 0.00 H ATOM 3500 H13S PA 145 77.025 78.824 48.400 1.00 0.00 H ATOM 3501 C112 PA 145 77.770 80.724 47.639 1.00 0.00 C ATOM 3502 H12R PA 145 77.345 81.237 48.504 1.00 0.00 H ATOM 3503 H12S PA 145 76.995 80.740 46.869 1.00 0.00 H ATOM 3504 C111 PA 145 79.068 81.397 47.189 1.00 0.00 C ATOM 3505 H11R PA 145 79.413 81.229 46.167 1.00 0.00 H ATOM 3506 H11S PA 145 79.833 80.991 47.855 1.00 0.00 H ATOM 3507 C110 PA 145 79.097 82.941 47.333 1.00 0.00 C ATOM 3508 H10R PA 145 78.546 83.270 48.216 1.00 0.00 H ATOM 3509 H10S PA 145 78.389 83.302 46.584 1.00 0.00 H ATOM 3510 C19 PA 145 80.383 83.743 47.130 1.00 0.00 C ATOM 3511 H9R PA 145 80.853 83.373 46.216 1.00 0.00 H ATOM 3512 H9S PA 145 80.990 83.409 47.975 1.00 0.00 H ATOM 3513 C18 PA 145 80.270 85.253 47.149 1.00 0.00 C ATOM 3514 H8R PA 145 79.705 85.509 46.251 1.00 0.00 H ATOM 3515 H8S PA 145 81.309 85.581 47.065 1.00 0.00 H ATOM 3516 C17 PA 145 79.648 85.776 48.439 1.00 0.00 C ATOM 3517 H7R PA 145 78.563 85.689 48.358 1.00 0.00 H ATOM 3518 H7S PA 145 79.585 86.865 48.380 1.00 0.00 H ATOM 3519 C16 PA 145 79.974 85.267 49.835 1.00 0.00 C ATOM 3520 H6R PA 145 80.952 84.785 49.773 1.00 0.00 H ATOM 3521 H6S PA 145 79.289 84.479 50.154 1.00 0.00 H ATOM 3522 C15 PA 145 80.150 86.476 50.783 1.00 0.00 C ATOM 3523 H5R PA 145 79.281 87.128 50.666 1.00 0.00 H ATOM 3524 H5S PA 145 80.966 87.092 50.398 1.00 0.00 H ATOM 3525 C14 PA 145 80.537 86.090 52.174 1.00 0.00 C ATOM 3526 H4R PA 145 81.342 85.352 52.167 1.00 0.00 H ATOM 3527 H4S PA 145 79.755 85.650 52.798 1.00 0.00 H ATOM 3528 C13 PA 145 81.051 87.278 53.031 1.00 0.00 C ATOM 3529 H3R PA 145 81.977 87.534 52.512 1.00 0.00 H ATOM 3530 H3S PA 145 81.311 87.066 54.070 1.00 0.00 H ATOM 3531 C12 PA 145 80.263 88.590 53.035 1.00 0.00 C ATOM 3532 H2R PA 145 79.217 88.354 53.241 1.00 0.00 H ATOM 3533 H2S PA 145 80.313 89.136 52.090 1.00 0.00 H ATOM 3534 C11 PGR 146 80.687 89.510 54.161 1.00 0.00 C ATOM 3535 O12 PGR 146 81.722 90.232 54.114 1.00 0.00 O ATOM 3536 O11 PGR 146 79.941 89.305 55.256 1.00 0.00 O ATOM 3537 C1 PGR 146 80.163 90.108 56.457 1.00 0.00 C ATOM 3538 HR PGR 146 81.221 89.938 56.672 1.00 0.00 H ATOM 3539 HS PGR 146 79.619 89.641 57.282 1.00 0.00 H ATOM 3540 C2 PGR 146 79.532 91.617 56.290 1.00 0.00 C ATOM 3541 HX PGR 146 80.344 92.342 56.201 1.00 0.00 H ATOM 3542 C3 PGR 146 78.818 91.991 57.696 1.00 0.00 C ATOM 3543 HA PGR 146 78.307 92.953 57.618 1.00 0.00 H ATOM 3544 HB PGR 146 79.622 92.001 58.436 1.00 0.00 H ATOM 3545 O31 PGR 146 77.913 91.034 58.119 1.00 0.00 O ATOM 3546 P31 PGR 146 77.098 91.267 59.441 1.00 0.00 P ATOM 3547 O32 PGR 146 76.242 92.545 59.057 1.00 0.00 O ATOM 3548 C31 PGR 146 74.930 92.324 58.523 1.00 0.00 C ATOM 3549 H1A PGR 146 74.401 91.687 59.236 1.00 0.00 H ATOM 3550 H1B PGR 146 75.012 91.821 57.557 1.00 0.00 H ATOM 3551 C32 PGR 146 74.243 93.670 58.216 1.00 0.00 C ATOM 3552 H2A PGR 146 74.819 94.288 57.523 1.00 0.00 H ATOM 3553 O35 PGR 146 73.914 94.367 59.411 1.00 0.00 O ATOM 3554 HO5A PGR 146 73.471 95.177 59.101 1.00 0.00 H ATOM 3555 C33 PGR 146 72.962 93.334 57.392 1.00 0.00 C ATOM 3556 H3A PGR 146 72.404 94.233 57.116 1.00 0.00 H ATOM 3557 H3B PGR 146 73.348 92.911 56.461 1.00 0.00 H ATOM 3558 O33 PGR 146 76.144 90.128 59.659 1.00 0.00 O ATOM 3559 O34 PGR 146 78.009 91.608 60.577 1.00 0.00 O ATOM 3560 O21 PGR 146 78.674 91.597 55.156 1.00 0.00 O ATOM 3561 C21 PGR 146 77.982 92.714 54.958 1.00 0.00 C ATOM 3562 O22 PGR 146 78.265 93.825 55.460 1.00 0.00 O ATOM 3563 O36 PGR 146 72.055 92.498 58.029 1.00 0.00 O ATOM 3564 HO6A PGR 146 71.507 92.137 57.309 1.00 0.00 H ATOM 3565 C12 OL 147 76.900 92.570 53.942 1.00 0.00 C ATOM 3566 H2R OL 147 77.282 93.024 53.025 1.00 0.00 H ATOM 3567 H2S OL 147 76.755 91.516 53.695 1.00 0.00 H ATOM 3568 C13 OL 147 75.583 93.181 54.466 1.00 0.00 C ATOM 3569 H3R OL 147 74.712 92.741 53.974 1.00 0.00 H ATOM 3570 H3S OL 147 75.438 92.734 55.452 1.00 0.00 H ATOM 3571 C14 OL 147 75.622 94.716 54.383 1.00 0.00 C ATOM 3572 H4R OL 147 76.216 95.089 55.220 1.00 0.00 H ATOM 3573 H4S OL 147 76.001 94.961 53.389 1.00 0.00 H ATOM 3574 C15 OL 147 74.147 95.211 54.462 1.00 0.00 C ATOM 3575 H5R OL 147 73.564 94.718 53.681 1.00 0.00 H ATOM 3576 H5S OL 147 73.584 94.986 55.371 1.00 0.00 H ATOM 3577 C16 OL 147 73.922 96.668 54.037 1.00 0.00 C ATOM 3578 H6R OL 147 73.057 97.129 54.519 1.00 0.00 H ATOM 3579 H6S OL 147 74.686 97.252 54.554 1.00 0.00 H ATOM 3580 C17 OL 147 74.064 96.968 52.599 1.00 0.00 C ATOM 3581 H7R OL 147 75.092 96.634 52.443 1.00 0.00 H ATOM 3582 H7S OL 147 73.277 96.440 52.058 1.00 0.00 H ATOM 3583 C18 OL 147 73.890 98.437 52.184 1.00 0.00 C ATOM 3584 H8R OL 147 72.931 98.748 52.603 1.00 0.00 H ATOM 3585 H8S OL 147 74.625 99.154 52.555 1.00 0.00 H ATOM 3586 C19 OL 147 73.757 98.436 50.742 1.00 0.00 C ATOM 3587 H9R OL 147 73.370 97.523 50.297 1.00 0.00 H ATOM 3588 C110 OL 147 74.010 99.449 49.900 1.00 0.00 C ATOM 3589 H10R OL 147 73.748 99.303 48.855 1.00 0.00 H ATOM 3590 C111 OL 147 74.568 100.816 50.189 1.00 0.00 C ATOM 3591 H11R OL 147 74.359 101.537 49.395 1.00 0.00 H ATOM 3592 H11S OL 147 74.235 101.113 51.185 1.00 0.00 H ATOM 3593 C112 OL 147 76.137 100.659 50.373 1.00 0.00 C ATOM 3594 H12R OL 147 76.550 101.512 50.916 1.00 0.00 H ATOM 3595 H12S OL 147 76.301 99.798 51.024 1.00 0.00 H ATOM 3596 C113 OL 147 76.944 100.454 49.096 1.00 0.00 C ATOM 3597 H13R OL 147 77.989 100.423 49.411 1.00 0.00 H ATOM 3598 H13S OL 147 76.707 99.564 48.509 1.00 0.00 H ATOM 3599 C114 OL 147 76.900 101.664 48.228 1.00 0.00 C ATOM 3600 H14R OL 147 75.896 101.764 47.811 1.00 0.00 H ATOM 3601 H14S OL 147 77.072 102.533 48.868 1.00 0.00 H ATOM 3602 C115 OL 147 77.846 101.497 47.100 1.00 0.00 C ATOM 3603 H15R OL 147 78.891 101.437 47.411 1.00 0.00 H ATOM 3604 H15S OL 147 77.664 100.525 46.637 1.00 0.00 H ATOM 3605 C116 OL 147 77.622 102.555 46.122 1.00 0.00 C ATOM 3606 H16R OL 147 76.605 102.356 45.778 1.00 0.00 H ATOM 3607 H16S OL 147 77.549 103.489 46.681 1.00 0.00 H ATOM 3608 C117 OL 147 78.790 102.766 45.101 1.00 0.00 C ATOM 3609 H17R OL 147 79.741 103.075 45.538 1.00 0.00 H ATOM 3610 H17S OL 147 79.025 101.809 44.631 1.00 0.00 H ATOM 3611 C118 OL 147 78.437 103.797 44.045 1.00 0.00 C ATOM 3612 H18R OL 147 77.518 103.522 43.525 1.00 0.00 H ATOM 3613 H18S OL 147 79.305 103.880 43.387 1.00 0.00 H ATOM 3614 H18T OL 147 78.342 104.722 44.618 1.00 0.00 H TER 3615 OL 147 ATOM 3615 C116 PA 148 6.143 58.166 36.570 1.00 0.00 C ATOM 3616 H16R PA 148 6.213 57.630 35.621 1.00 0.00 H ATOM 3617 H16S PA 148 7.164 58.386 36.891 1.00 0.00 H ATOM 3618 H16T PA 148 5.826 59.202 36.431 1.00 0.00 H ATOM 3619 C115 PA 148 5.397 57.402 37.740 1.00 0.00 C ATOM 3620 H15R PA 148 5.713 56.358 37.791 1.00 0.00 H ATOM 3621 H15S PA 148 4.360 57.415 37.399 1.00 0.00 H ATOM 3622 C114 PA 148 5.416 58.132 39.089 1.00 0.00 C ATOM 3623 H14R PA 148 4.823 59.047 39.156 1.00 0.00 H ATOM 3624 H14S PA 148 6.397 58.394 39.492 1.00 0.00 H ATOM 3625 C113 PA 148 4.727 57.218 40.082 1.00 0.00 C ATOM 3626 H13R PA 148 5.213 56.253 40.245 1.00 0.00 H ATOM 3627 H13S PA 148 3.733 57.019 39.676 1.00 0.00 H ATOM 3628 C112 PA 148 4.602 57.753 41.492 1.00 0.00 C ATOM 3629 H12R PA 148 4.044 58.681 41.355 1.00 0.00 H ATOM 3630 H12S PA 148 5.567 57.932 41.970 1.00 0.00 H ATOM 3631 C111 PA 148 3.814 56.798 42.504 1.00 0.00 C ATOM 3632 H11R PA 148 3.484 55.891 41.993 1.00 0.00 H ATOM 3633 H11S PA 148 2.951 57.395 42.806 1.00 0.00 H ATOM 3634 C110 PA 148 4.664 56.413 43.864 1.00 0.00 C ATOM 3635 H10R PA 148 4.085 55.867 44.611 1.00 0.00 H ATOM 3636 H10S PA 148 5.121 57.304 44.300 1.00 0.00 H ATOM 3637 C19 PA 148 5.905 55.590 43.535 1.00 0.00 C ATOM 3638 H9R PA 148 6.498 55.970 42.700 1.00 0.00 H ATOM 3639 H9S PA 148 5.604 54.601 43.184 1.00 0.00 H ATOM 3640 C18 PA 148 6.715 55.231 44.792 1.00 0.00 C ATOM 3641 H8R PA 148 6.201 54.404 45.287 1.00 0.00 H ATOM 3642 H8S PA 148 6.793 56.085 45.468 1.00 0.00 H ATOM 3643 C17 PA 148 8.179 54.871 44.470 1.00 0.00 C ATOM 3644 H7R PA 148 8.442 55.684 43.789 1.00 0.00 H ATOM 3645 H7S PA 148 8.301 53.841 44.130 1.00 0.00 H ATOM 3646 C16 PA 148 9.224 55.027 45.605 1.00 0.00 C ATOM 3647 H6R PA 148 9.077 54.230 46.336 1.00 0.00 H ATOM 3648 H6S PA 148 9.108 55.909 46.239 1.00 0.00 H ATOM 3649 C15 PA 148 10.673 55.083 45.055 1.00 0.00 C ATOM 3650 H5R PA 148 10.835 55.999 44.484 1.00 0.00 H ATOM 3651 H5S PA 148 10.827 54.177 44.465 1.00 0.00 H ATOM 3652 C14 PA 148 11.788 55.110 46.158 1.00 0.00 C ATOM 3653 H4R PA 148 11.484 54.479 46.996 1.00 0.00 H ATOM 3654 H4S PA 148 11.839 56.099 46.617 1.00 0.00 H ATOM 3655 C13 PA 148 13.070 54.617 45.551 1.00 0.00 C ATOM 3656 H3R PA 148 13.651 55.344 44.979 1.00 0.00 H ATOM 3657 H3S PA 148 12.842 53.833 44.826 1.00 0.00 H ATOM 3658 C12 PA 148 13.969 53.865 46.554 1.00 0.00 C ATOM 3659 H2R PA 148 14.942 53.505 46.213 1.00 0.00 H ATOM 3660 H2S PA 148 13.656 52.916 46.993 1.00 0.00 H ATOM 3661 C11 PGR 149 14.389 54.728 47.789 1.00 0.00 C ATOM 3662 O12 PGR 149 14.744 55.868 47.745 1.00 0.00 O ATOM 3663 O11 PGR 149 14.387 53.966 48.926 1.00 0.00 O ATOM 3664 C1 PGR 149 14.895 54.508 50.175 1.00 0.00 C ATOM 3665 HR PGR 149 15.967 54.700 50.083 1.00 0.00 H ATOM 3666 HS PGR 149 14.812 53.864 51.054 1.00 0.00 H ATOM 3667 C2 PGR 149 14.178 55.789 50.661 1.00 0.00 C ATOM 3668 HX PGR 149 14.147 56.520 49.849 1.00 0.00 H ATOM 3669 C3 PGR 149 14.787 56.392 51.976 1.00 0.00 C ATOM 3670 HA PGR 149 15.805 56.781 51.906 1.00 0.00 H ATOM 3671 HB PGR 149 14.834 55.699 52.821 1.00 0.00 H ATOM 3672 O31 PGR 149 14.088 57.510 52.364 1.00 0.00 O ATOM 3673 P31 PGR 149 14.669 58.533 53.442 1.00 0.00 P ATOM 3674 O32 PGR 149 15.577 59.554 52.575 1.00 0.00 O ATOM 3675 C31 PGR 149 14.989 60.272 51.449 1.00 0.00 C ATOM 3676 H1A PGR 149 14.521 61.237 51.659 1.00 0.00 H ATOM 3677 H1B PGR 149 14.171 59.723 50.974 1.00 0.00 H ATOM 3678 C32 PGR 149 16.134 60.659 50.434 1.00 0.00 C ATOM 3679 H2A PGR 149 15.622 61.161 49.610 1.00 0.00 H ATOM 3680 O35 PGR 149 16.777 59.553 49.974 1.00 0.00 O ATOM 3681 HO5A PGR 149 16.198 59.249 49.252 1.00 0.00 H ATOM 3682 C33 PGR 149 17.080 61.707 51.085 1.00 0.00 C ATOM 3683 H3A PGR 149 17.841 62.137 50.430 1.00 0.00 H ATOM 3684 H3B PGR 149 16.518 62.547 51.501 1.00 0.00 H ATOM 3685 O33 PGR 149 13.549 59.221 54.028 1.00 0.00 O ATOM 3686 O34 PGR 149 15.509 57.763 54.411 1.00 0.00 O ATOM 3687 O21 PGR 149 12.800 55.330 50.990 1.00 0.00 O ATOM 3688 C21 PGR 149 11.777 56.178 50.727 1.00 0.00 C ATOM 3689 O22 PGR 149 11.917 57.233 50.097 1.00 0.00 O ATOM 3690 O36 PGR 149 17.806 61.100 52.139 1.00 0.00 O ATOM 3691 HO6A PGR 149 17.175 60.542 52.629 1.00 0.00 H ATOM 3692 C12 OL 150 10.464 55.605 51.211 1.00 0.00 C ATOM 3693 H2R OL 150 10.612 54.988 52.100 1.00 0.00 H ATOM 3694 H2S OL 150 9.710 56.391 51.290 1.00 0.00 H ATOM 3695 C13 OL 150 9.979 54.676 50.131 1.00 0.00 C ATOM 3696 H3R OL 150 9.912 55.099 49.126 1.00 0.00 H ATOM 3697 H3S OL 150 10.667 53.844 49.968 1.00 0.00 H ATOM 3698 C14 OL 150 8.519 54.159 50.274 1.00 0.00 C ATOM 3699 H4R OL 150 8.268 53.771 51.263 1.00 0.00 H ATOM 3700 H4S OL 150 7.896 54.999 49.960 1.00 0.00 H ATOM 3701 C15 OL 150 8.242 53.038 49.347 1.00 0.00 C ATOM 3702 H5R OL 150 8.812 53.279 48.447 1.00 0.00 H ATOM 3703 H5S OL 150 8.790 52.146 49.656 1.00 0.00 H ATOM 3704 C16 OL 150 6.800 52.672 49.119 1.00 0.00 C ATOM 3705 H6R OL 150 6.324 52.685 50.102 1.00 0.00 H ATOM 3706 H6S OL 150 6.200 53.452 48.647 1.00 0.00 H ATOM 3707 C17 OL 150 6.591 51.380 48.350 1.00 0.00 C ATOM 3708 H7R OL 150 6.995 50.582 48.976 1.00 0.00 H ATOM 3709 H7S OL 150 5.536 51.112 48.260 1.00 0.00 H ATOM 3710 C18 OL 150 7.147 51.432 46.893 1.00 0.00 C ATOM 3711 H8R OL 150 6.765 52.289 46.334 1.00 0.00 H ATOM 3712 H8S OL 150 8.228 51.585 46.867 1.00 0.00 H ATOM 3713 C19 OL 150 6.973 50.073 46.289 1.00 0.00 C ATOM 3714 H9R OL 150 7.347 49.222 46.853 1.00 0.00 H ATOM 3715 C110 OL 150 6.602 49.897 45.053 1.00 0.00 C ATOM 3716 H10R OL 150 6.623 48.872 44.691 1.00 0.00 H ATOM 3717 C111 OL 150 6.065 50.764 44.041 1.00 0.00 C ATOM 3718 H11R OL 150 5.171 50.361 43.561 1.00 0.00 H ATOM 3719 H11S OL 150 5.613 51.695 44.390 1.00 0.00 H ATOM 3720 C112 OL 150 7.054 51.060 42.979 1.00 0.00 C ATOM 3721 H12R OL 150 7.974 51.447 43.421 1.00 0.00 H ATOM 3722 H12S OL 150 7.451 50.252 42.361 1.00 0.00 H ATOM 3723 C113 OL 150 6.647 52.189 42.030 1.00 0.00 C ATOM 3724 H13R OL 150 6.714 53.171 42.503 1.00 0.00 H ATOM 3725 H13S OL 150 7.354 52.018 41.216 1.00 0.00 H ATOM 3726 C114 OL 150 5.238 51.966 41.386 1.00 0.00 C ATOM 3727 H14R OL 150 5.206 50.919 41.075 1.00 0.00 H ATOM 3728 H14S OL 150 4.370 52.099 42.034 1.00 0.00 H ATOM 3729 C115 OL 150 5.107 52.870 40.130 1.00 0.00 C ATOM 3730 H15R OL 150 5.376 53.900 40.374 1.00 0.00 H ATOM 3731 H15S OL 150 5.855 52.466 39.446 1.00 0.00 H ATOM 3732 C116 OL 150 3.668 52.881 39.521 1.00 0.00 C ATOM 3733 H16R OL 150 3.231 51.882 39.587 1.00 0.00 H ATOM 3734 H16S OL 150 3.005 53.303 40.279 1.00 0.00 H ATOM 3735 C117 OL 150 3.600 53.482 38.137 1.00 0.00 C ATOM 3736 H17R OL 150 2.577 53.351 37.780 1.00 0.00 H ATOM 3737 H17S OL 150 3.781 54.549 38.277 1.00 0.00 H ATOM 3738 C118 OL 150 4.589 53.065 37.018 1.00 0.00 C ATOM 3739 H18R OL 150 5.033 53.898 36.469 1.00 0.00 H ATOM 3740 H18S OL 150 3.939 52.554 36.304 1.00 0.00 H ATOM 3741 H18T OL 150 5.330 52.331 37.342 1.00 0.00 H TER 3742 OL 150 ATOM 3742 C116 PA 151 33.629 88.387 46.803 1.00 0.00 C ATOM 3743 H16R PA 151 33.788 89.461 46.922 1.00 0.00 H ATOM 3744 H16S PA 151 33.691 88.012 45.780 1.00 0.00 H ATOM 3745 H16T PA 151 34.531 87.919 47.204 1.00 0.00 H ATOM 3746 C115 PA 151 32.373 87.914 47.548 1.00 0.00 C ATOM 3747 H15R PA 151 31.554 88.429 47.041 1.00 0.00 H ATOM 3748 H15S PA 151 32.441 88.364 48.540 1.00 0.00 H ATOM 3749 C114 PA 151 32.037 86.464 47.618 1.00 0.00 C ATOM 3750 H14R PA 151 32.212 86.058 46.619 1.00 0.00 H ATOM 3751 H14S PA 151 30.997 86.205 47.826 1.00 0.00 H ATOM 3752 C113 PA 151 32.935 85.676 48.541 1.00 0.00 C ATOM 3753 H13R PA 151 32.916 86.228 49.483 1.00 0.00 H ATOM 3754 H13S PA 151 33.982 85.842 48.276 1.00 0.00 H ATOM 3755 C112 PA 151 32.646 84.178 48.768 1.00 0.00 C ATOM 3756 H12R PA 151 32.636 83.672 47.801 1.00 0.00 H ATOM 3757 H12S PA 151 31.604 84.033 49.059 1.00 0.00 H ATOM 3758 C111 PA 151 33.479 83.506 49.727 1.00 0.00 C ATOM 3759 H11R PA 151 33.212 83.848 50.729 1.00 0.00 H ATOM 3760 H11S PA 151 34.504 83.851 49.579 1.00 0.00 H ATOM 3761 C110 PA 151 33.403 81.975 49.567 1.00 0.00 C ATOM 3762 H10R PA 151 33.570 81.823 48.498 1.00 0.00 H ATOM 3763 H10S PA 151 32.368 81.695 49.772 1.00 0.00 H ATOM 3764 C19 PA 151 34.472 81.210 50.382 1.00 0.00 C ATOM 3765 H9R PA 151 35.410 81.475 49.891 1.00 0.00 H ATOM 3766 H9S PA 151 34.327 80.129 50.333 1.00 0.00 H ATOM 3767 C18 PA 151 34.463 81.532 51.892 1.00 0.00 C ATOM 3768 H8R PA 151 33.438 81.505 52.267 1.00 0.00 H ATOM 3769 H8S PA 151 34.937 82.515 51.921 1.00 0.00 H ATOM 3770 C17 PA 151 35.304 80.584 52.803 1.00 0.00 C ATOM 3771 H7R PA 151 36.377 80.757 52.704 1.00 0.00 H ATOM 3772 H7S PA 151 35.250 79.515 52.589 1.00 0.00 H ATOM 3773 C16 PA 151 34.971 80.730 54.237 1.00 0.00 C ATOM 3774 H6R PA 151 33.915 80.454 54.257 1.00 0.00 H ATOM 3775 H6S PA 151 34.959 81.794 54.486 1.00 0.00 H ATOM 3776 C15 PA 151 35.853 79.919 55.283 1.00 0.00 C ATOM 3777 H5R PA 151 36.941 79.981 55.219 1.00 0.00 H ATOM 3778 H5S PA 151 35.692 78.844 55.178 1.00 0.00 H ATOM 3779 C14 PA 151 35.505 80.285 56.706 1.00 0.00 C ATOM 3780 H4R PA 151 35.684 81.347 56.883 1.00 0.00 H ATOM 3781 H4S PA 151 36.261 79.736 57.272 1.00 0.00 H ATOM 3782 C13 PA 151 34.161 79.769 57.191 1.00 0.00 C ATOM 3783 H3R PA 151 34.145 78.677 57.205 1.00 0.00 H ATOM 3784 H3S PA 151 33.342 80.143 56.573 1.00 0.00 H ATOM 3785 C12 PA 151 33.896 80.325 58.623 1.00 0.00 C ATOM 3786 H2R PA 151 34.025 81.409 58.631 1.00 0.00 H ATOM 3787 H2S PA 151 34.590 79.900 59.351 1.00 0.00 H ATOM 3788 C11 PGR 152 32.488 80.076 59.122 1.00 0.00 C ATOM 3789 O12 PGR 152 32.160 79.063 59.764 1.00 0.00 O ATOM 3790 O11 PGR 152 31.639 80.938 58.584 1.00 0.00 O ATOM 3791 C1 PGR 152 30.199 80.787 58.828 1.00 0.00 C ATOM 3792 HR PGR 152 30.052 80.157 59.709 1.00 0.00 H ATOM 3793 HS PGR 152 29.769 80.295 57.952 1.00 0.00 H ATOM 3794 C2 PGR 152 29.598 82.161 59.038 1.00 0.00 C ATOM 3795 HX PGR 152 30.395 82.880 59.243 1.00 0.00 H ATOM 3796 C3 PGR 152 28.591 82.318 60.255 1.00 0.00 C ATOM 3797 HA PGR 152 28.701 81.479 60.947 1.00 0.00 H ATOM 3798 HB PGR 152 27.556 82.259 59.907 1.00 0.00 H ATOM 3799 O31 PGR 152 28.960 83.531 60.859 1.00 0.00 O ATOM 3800 P31 PGR 152 28.018 84.120 62.034 1.00 0.00 P ATOM 3801 O32 PGR 152 28.082 82.877 63.022 1.00 0.00 O ATOM 3802 C31 PGR 152 29.228 82.496 63.693 1.00 0.00 C ATOM 3803 H1A PGR 152 29.430 83.284 64.422 1.00 0.00 H ATOM 3804 H1B PGR 152 30.016 82.301 62.961 1.00 0.00 H ATOM 3805 C32 PGR 152 28.870 81.147 64.321 1.00 0.00 C ATOM 3806 H2A PGR 152 28.601 80.511 63.473 1.00 0.00 H ATOM 3807 O35 PGR 152 27.727 81.104 65.180 1.00 0.00 O ATOM 3808 HO5A PGR 152 27.818 81.908 65.723 1.00 0.00 H ATOM 3809 C33 PGR 152 30.157 80.608 65.114 1.00 0.00 C ATOM 3810 H3A PGR 152 30.995 81.202 64.743 1.00 0.00 H ATOM 3811 H3B PGR 152 29.983 80.702 66.189 1.00 0.00 H ATOM 3812 O33 PGR 152 28.672 85.246 62.632 1.00 0.00 O ATOM 3813 O34 PGR 152 26.665 84.354 61.458 1.00 0.00 O ATOM 3814 O21 PGR 152 28.939 82.578 57.787 1.00 0.00 O ATOM 3815 C21 PGR 152 28.937 83.903 57.412 1.00 0.00 C ATOM 3816 O22 PGR 152 29.419 84.850 57.998 1.00 0.00 O ATOM 3817 O36 PGR 152 30.218 79.152 64.828 1.00 0.00 O ATOM 3818 HO6A PGR 152 30.254 78.895 63.889 1.00 0.00 H ATOM 3819 C12 OL 153 28.226 83.989 56.087 1.00 0.00 C ATOM 3820 H2R OL 153 28.880 83.600 55.303 1.00 0.00 H ATOM 3821 H2S OL 153 27.362 83.324 56.154 1.00 0.00 H ATOM 3822 C13 OL 153 27.869 85.416 55.714 1.00 0.00 C ATOM 3823 H3R OL 153 27.315 85.914 56.512 1.00 0.00 H ATOM 3824 H3S OL 153 28.777 85.981 55.493 1.00 0.00 H ATOM 3825 C14 OL 153 26.983 85.493 54.488 1.00 0.00 C ATOM 3826 H4R OL 153 27.313 84.821 53.693 1.00 0.00 H ATOM 3827 H4S OL 153 26.037 85.094 54.860 1.00 0.00 H ATOM 3828 C15 OL 153 26.803 86.894 53.876 1.00 0.00 C ATOM 3829 H5R OL 153 26.364 87.547 54.633 1.00 0.00 H ATOM 3830 H5S OL 153 27.769 87.298 53.566 1.00 0.00 H ATOM 3831 C16 OL 153 25.861 86.746 52.657 1.00 0.00 C ATOM 3832 H6R OL 153 26.313 85.929 52.092 1.00 0.00 H ATOM 3833 H6S OL 153 24.851 86.482 52.978 1.00 0.00 H ATOM 3834 C17 OL 153 25.810 88.049 51.837 1.00 0.00 C ATOM 3835 H7R OL 153 25.156 88.740 52.372 1.00 0.00 H ATOM 3836 H7S OL 153 26.820 88.445 51.714 1.00 0.00 H ATOM 3837 C18 OL 153 25.300 87.928 50.458 1.00 0.00 C ATOM 3838 H8R OL 153 26.063 87.404 49.878 1.00 0.00 H ATOM 3839 H8S OL 153 24.541 87.146 50.402 1.00 0.00 H ATOM 3840 C19 OL 153 24.779 89.216 49.809 1.00 0.00 C ATOM 3841 H9R OL 153 23.998 89.707 50.384 1.00 0.00 H ATOM 3842 C110 OL 153 25.215 89.762 48.708 1.00 0.00 C ATOM 3843 H10R OL 153 24.838 90.749 48.455 1.00 0.00 H ATOM 3844 C111 OL 153 26.389 89.340 47.910 1.00 0.00 C ATOM 3845 H11R OL 153 27.308 89.794 48.285 1.00 0.00 H ATOM 3846 H11S OL 153 26.570 88.264 47.882 1.00 0.00 H ATOM 3847 C112 OL 153 26.481 89.746 46.432 1.00 0.00 C ATOM 3848 H12R OL 153 25.579 89.340 45.969 1.00 0.00 H ATOM 3849 H12S OL 153 26.326 90.819 46.295 1.00 0.00 H ATOM 3850 C113 OL 153 27.745 89.443 45.637 1.00 0.00 C ATOM 3851 H13R OL 153 27.387 89.783 44.663 1.00 0.00 H ATOM 3852 H13S OL 153 28.543 90.102 45.985 1.00 0.00 H ATOM 3853 C114 OL 153 28.284 87.996 45.573 1.00 0.00 C ATOM 3854 H14R OL 153 29.245 87.847 45.076 1.00 0.00 H ATOM 3855 H14S OL 153 28.633 87.671 46.556 1.00 0.00 H ATOM 3856 C115 OL 153 27.305 87.046 44.918 1.00 0.00 C ATOM 3857 H15R OL 153 26.362 87.134 45.462 1.00 0.00 H ATOM 3858 H15S OL 153 26.991 87.163 43.879 1.00 0.00 H ATOM 3859 C116 OL 153 27.532 85.562 45.290 1.00 0.00 C ATOM 3860 H16R OL 153 27.645 85.611 46.375 1.00 0.00 H ATOM 3861 H16S OL 153 26.593 85.086 45.002 1.00 0.00 H ATOM 3862 C117 OL 153 28.738 84.944 44.587 1.00 0.00 C ATOM 3863 H17R OL 153 28.622 84.964 43.501 1.00 0.00 H ATOM 3864 H17S OL 153 29.648 85.502 44.816 1.00 0.00 H ATOM 3865 C118 OL 153 28.895 83.430 45.078 1.00 0.00 C ATOM 3866 H18R OL 153 28.249 83.100 45.894 1.00 0.00 H ATOM 3867 H18S OL 153 29.934 83.217 45.335 1.00 0.00 H ATOM 3868 H18T OL 153 28.669 82.722 44.278 1.00 0.00 H TER 3869 OL 153 ATOM 3869 C116 PA 154 27.165 72.676 39.124 1.00 0.00 C ATOM 3870 H16R PA 154 26.141 72.971 38.889 1.00 0.00 H ATOM 3871 H16S PA 154 27.115 71.793 39.765 1.00 0.00 H ATOM 3872 H16T PA 154 27.583 72.578 38.120 1.00 0.00 H ATOM 3873 C115 PA 154 27.885 73.778 39.922 1.00 0.00 C ATOM 3874 H15R PA 154 27.735 74.727 39.403 1.00 0.00 H ATOM 3875 H15S PA 154 28.954 73.557 39.920 1.00 0.00 H ATOM 3876 C114 PA 154 27.442 73.858 41.419 1.00 0.00 C ATOM 3877 H14R PA 154 27.486 72.951 42.027 1.00 0.00 H ATOM 3878 H14S PA 154 26.389 74.129 41.512 1.00 0.00 H ATOM 3879 C113 PA 154 28.051 74.999 42.093 1.00 0.00 C ATOM 3880 H13R PA 154 27.930 75.939 41.550 1.00 0.00 H ATOM 3881 H13S PA 154 29.114 74.824 42.268 1.00 0.00 H ATOM 3882 C112 PA 154 27.346 75.316 43.438 1.00 0.00 C ATOM 3883 H12R PA 154 27.463 74.399 44.019 1.00 0.00 H ATOM 3884 H12S PA 154 26.264 75.258 43.307 1.00 0.00 H ATOM 3885 C111 PA 154 27.835 76.568 44.099 1.00 0.00 C ATOM 3886 H11R PA 154 27.663 77.374 43.383 1.00 0.00 H ATOM 3887 H11S PA 154 28.897 76.437 44.320 1.00 0.00 H ATOM 3888 C110 PA 154 27.150 76.795 45.407 1.00 0.00 C ATOM 3889 H10R PA 154 27.459 76.046 46.140 1.00 0.00 H ATOM 3890 H10S PA 154 26.064 76.715 45.318 1.00 0.00 H ATOM 3891 C19 PA 154 27.475 78.170 45.881 1.00 0.00 C ATOM 3892 H9R PA 154 27.481 78.890 45.060 1.00 0.00 H ATOM 3893 H9S PA 154 28.519 78.188 46.201 1.00 0.00 H ATOM 3894 C18 PA 154 26.520 78.666 47.053 1.00 0.00 C ATOM 3895 H8R PA 154 25.573 78.838 46.537 1.00 0.00 H ATOM 3896 H8S PA 154 26.781 79.688 47.339 1.00 0.00 H ATOM 3897 C17 PA 154 26.446 77.698 48.182 1.00 0.00 C ATOM 3898 H7R PA 154 27.439 77.285 48.373 1.00 0.00 H ATOM 3899 H7S PA 154 25.771 76.854 48.027 1.00 0.00 H ATOM 3900 C16 PA 154 25.954 78.331 49.506 1.00 0.00 C ATOM 3901 H6R PA 154 24.888 78.564 49.475 1.00 0.00 H ATOM 3902 H6S PA 154 26.407 79.305 49.701 1.00 0.00 H ATOM 3903 C15 PA 154 26.136 77.534 50.773 1.00 0.00 C ATOM 3904 H5R PA 154 27.173 77.209 50.877 1.00 0.00 H ATOM 3905 H5S PA 154 25.602 76.584 50.694 1.00 0.00 H ATOM 3906 C14 PA 154 25.524 78.202 52.046 1.00 0.00 C ATOM 3907 H4R PA 154 24.504 78.583 51.956 1.00 0.00 H ATOM 3908 H4S PA 154 26.091 79.043 52.450 1.00 0.00 H ATOM 3909 C13 PA 154 25.441 77.189 53.242 1.00 0.00 C ATOM 3910 H3R PA 154 26.398 76.683 53.383 1.00 0.00 H ATOM 3911 H3S PA 154 24.779 76.333 53.092 1.00 0.00 H ATOM 3912 C12 PA 154 24.964 77.768 54.525 1.00 0.00 C ATOM 3913 H2R PA 154 23.881 77.913 54.546 1.00 0.00 H ATOM 3914 H2S PA 154 25.567 78.655 54.729 1.00 0.00 H ATOM 3915 C11 PGR 155 25.189 76.982 55.835 1.00 0.00 C ATOM 3916 O12 PGR 155 24.337 76.704 56.641 1.00 0.00 O ATOM 3917 O11 PGR 155 26.420 76.492 55.862 1.00 0.00 O ATOM 3918 C1 PGR 155 26.858 76.026 57.156 1.00 0.00 C ATOM 3919 HR PGR 155 26.738 76.779 57.940 1.00 0.00 H ATOM 3920 HS PGR 155 27.950 76.073 57.130 1.00 0.00 H ATOM 3921 C2 PGR 155 26.332 74.599 57.530 1.00 0.00 C ATOM 3922 HX PGR 155 25.248 74.718 57.456 1.00 0.00 H ATOM 3923 C3 PGR 155 26.557 74.246 59.019 1.00 0.00 C ATOM 3924 HA PGR 155 25.932 73.390 59.283 1.00 0.00 H ATOM 3925 HB PGR 155 26.391 75.079 59.707 1.00 0.00 H ATOM 3926 O31 PGR 155 27.968 73.854 59.133 1.00 0.00 O ATOM 3927 P31 PGR 155 28.754 73.729 60.525 1.00 0.00 P ATOM 3928 O32 PGR 155 29.053 75.213 60.960 1.00 0.00 O ATOM 3929 C31 PGR 155 30.199 75.852 60.480 1.00 0.00 C ATOM 3930 H1A PGR 155 29.991 76.921 60.390 1.00 0.00 H ATOM 3931 H1B PGR 155 30.386 75.459 59.477 1.00 0.00 H ATOM 3932 C32 PGR 155 31.385 75.688 61.398 1.00 0.00 C ATOM 3933 H2A PGR 155 31.959 76.616 61.339 1.00 0.00 H ATOM 3934 O35 PGR 155 32.205 74.632 60.905 1.00 0.00 O ATOM 3935 HO5A PGR 155 31.681 73.828 60.738 1.00 0.00 H ATOM 3936 C33 PGR 155 31.050 75.512 62.933 1.00 0.00 C ATOM 3937 H3A PGR 155 30.600 76.466 63.219 1.00 0.00 H ATOM 3938 H3B PGR 155 30.291 74.758 63.162 1.00 0.00 H ATOM 3939 O33 PGR 155 27.792 73.197 61.519 1.00 0.00 O ATOM 3940 O34 PGR 155 30.043 73.073 60.357 1.00 0.00 O ATOM 3941 O21 PGR 155 26.843 73.690 56.551 1.00 0.00 O ATOM 3942 C21 PGR 155 26.178 73.543 55.414 1.00 0.00 C ATOM 3943 O22 PGR 155 25.048 73.971 55.226 1.00 0.00 O ATOM 3944 O36 PGR 155 32.230 75.312 63.703 1.00 0.00 O ATOM 3945 HO6A PGR 155 31.992 75.184 64.639 1.00 0.00 H ATOM 3946 C12 OL 156 27.014 72.823 54.367 1.00 0.00 C ATOM 3947 H2R OL 156 28.065 72.685 54.629 1.00 0.00 H ATOM 3948 H2S OL 156 26.624 71.826 54.149 1.00 0.00 H ATOM 3949 C13 OL 156 26.959 73.698 53.136 1.00 0.00 C ATOM 3950 H3R OL 156 25.928 73.982 52.914 1.00 0.00 H ATOM 3951 H3S OL 156 27.387 74.618 53.542 1.00 0.00 H ATOM 3952 C14 OL 156 27.566 73.172 51.860 1.00 0.00 C ATOM 3953 H4R OL 156 28.549 72.846 52.206 1.00 0.00 H ATOM 3954 H4S OL 156 26.910 72.326 51.642 1.00 0.00 H ATOM 3955 C15 OL 156 27.516 74.130 50.647 1.00 0.00 C ATOM 3956 H5R OL 156 26.454 74.366 50.552 1.00 0.00 H ATOM 3957 H5S OL 156 27.967 75.103 50.853 1.00 0.00 H ATOM 3958 C16 OL 156 28.011 73.427 49.309 1.00 0.00 C ATOM 3959 H6R OL 156 27.694 72.382 49.342 1.00 0.00 H ATOM 3960 H6S OL 156 27.381 73.809 48.503 1.00 0.00 H ATOM 3961 C17 OL 156 29.519 73.674 49.137 1.00 0.00 C ATOM 3962 H7R OL 156 29.598 74.763 49.119 1.00 0.00 H ATOM 3963 H7S OL 156 29.996 73.333 50.059 1.00 0.00 H ATOM 3964 C18 OL 156 30.115 72.994 47.856 1.00 0.00 C ATOM 3965 H8R OL 156 31.190 72.813 47.932 1.00 0.00 H ATOM 3966 H8S OL 156 29.746 71.974 47.979 1.00 0.00 H ATOM 3967 C19 OL 156 29.775 73.567 46.552 1.00 0.00 C ATOM 3968 H9R OL 156 28.778 74.000 46.535 1.00 0.00 H ATOM 3969 C110 OL 156 30.627 73.769 45.510 1.00 0.00 C ATOM 3970 H10R OL 156 30.350 74.311 44.609 1.00 0.00 H ATOM 3971 C111 OL 156 32.060 73.432 45.415 1.00 0.00 C ATOM 3972 H11R OL 156 32.450 74.420 45.161 1.00 0.00 H ATOM 3973 H11S OL 156 32.431 73.147 46.401 1.00 0.00 H ATOM 3974 C112 OL 156 32.507 72.579 44.237 1.00 0.00 C ATOM 3975 H12R OL 156 33.593 72.532 44.347 1.00 0.00 H ATOM 3976 H12S OL 156 32.066 71.581 44.184 1.00 0.00 H ATOM 3977 C113 OL 156 32.272 73.016 42.801 1.00 0.00 C ATOM 3978 H13R OL 156 31.253 72.794 42.477 1.00 0.00 H ATOM 3979 H13S OL 156 32.212 74.093 42.628 1.00 0.00 H ATOM 3980 C114 OL 156 33.299 72.377 41.718 1.00 0.00 C ATOM 3981 H14R OL 156 34.303 72.734 41.958 1.00 0.00 H ATOM 3982 H14S OL 156 33.224 71.299 41.877 1.00 0.00 H ATOM 3983 C115 OL 156 32.908 72.590 40.247 1.00 0.00 C ATOM 3984 H15R OL 156 33.618 72.141 39.550 1.00 0.00 H ATOM 3985 H15S OL 156 31.904 72.220 40.031 1.00 0.00 H ATOM 3986 C116 OL 156 33.066 74.074 39.951 1.00 0.00 C ATOM 3987 H16R OL 156 32.477 74.639 40.677 1.00 0.00 H ATOM 3988 H16S OL 156 34.094 74.401 40.120 1.00 0.00 H ATOM 3989 C117 OL 156 32.753 74.615 38.571 1.00 0.00 C ATOM 3990 H17R OL 156 31.680 74.594 38.372 1.00 0.00 H ATOM 3991 H17S OL 156 33.029 75.668 38.475 1.00 0.00 H ATOM 3992 C118 OL 156 33.521 73.905 37.482 1.00 0.00 C ATOM 3993 H18R OL 156 33.286 72.839 37.470 1.00 0.00 H ATOM 3994 H18S OL 156 34.552 74.233 37.331 1.00 0.00 H ATOM 3995 H18T OL 156 33.052 74.326 36.590 1.00 0.00 H TER 3996 OL 156 ATOM 3996 C116 PA 157 51.091 47.092 38.821 1.00 0.00 C ATOM 3997 H16R PA 157 50.341 47.834 38.539 1.00 0.00 H ATOM 3998 H16S PA 157 51.387 46.647 37.869 1.00 0.00 H ATOM 3999 H16T PA 157 51.902 47.721 39.193 1.00 0.00 H ATOM 4000 C115 PA 157 50.517 46.145 39.893 1.00 0.00 C ATOM 4001 H15R PA 157 51.243 45.331 39.951 1.00 0.00 H ATOM 4002 H15S PA 157 49.559 45.831 39.474 1.00 0.00 H ATOM 4003 C114 PA 157 50.336 46.885 41.190 1.00 0.00 C ATOM 4004 H14R PA 157 49.570 47.654 41.074 1.00 0.00 H ATOM 4005 H14S PA 157 51.166 47.453 41.617 1.00 0.00 H ATOM 4006 C113 PA 157 49.798 46.046 42.367 1.00 0.00 C ATOM 4007 H13R PA 157 50.675 45.458 42.647 1.00 0.00 H ATOM 4008 H13S PA 157 48.980 45.482 41.912 1.00 0.00 H ATOM 4009 C112 PA 157 49.341 46.946 43.517 1.00 0.00 C ATOM 4010 H12R PA 157 48.752 47.778 43.123 1.00 0.00 H ATOM 4011 H12S PA 157 50.324 47.311 43.822 1.00 0.00 H ATOM 4012 C111 PA 157 48.674 46.255 44.802 1.00 0.00 C ATOM 4013 H11R PA 157 47.716 45.856 44.460 1.00 0.00 H ATOM 4014 H11S PA 157 48.377 47.050 45.489 1.00 0.00 H ATOM 4015 C110 PA 157 49.405 45.026 45.511 1.00 0.00 C ATOM 4016 H10R PA 157 50.439 45.307 45.723 1.00 0.00 H ATOM 4017 H10S PA 157 49.609 44.182 44.849 1.00 0.00 H ATOM 4018 C19 PA 157 48.861 44.484 46.816 1.00 0.00 C ATOM 4019 H9R PA 157 49.756 44.105 47.314 1.00 0.00 H ATOM 4020 H9S PA 157 48.251 43.611 46.574 1.00 0.00 H ATOM 4021 C18 PA 157 48.069 45.364 47.736 1.00 0.00 C ATOM 4022 H8R PA 157 47.204 45.656 47.138 1.00 0.00 H ATOM 4023 H8S PA 157 48.732 46.202 47.961 1.00 0.00 H ATOM 4024 C17 PA 157 47.517 44.702 49.064 1.00 0.00 C ATOM 4025 H7R PA 157 48.380 44.332 49.621 1.00 0.00 H ATOM 4026 H7S PA 157 47.005 43.753 48.887 1.00 0.00 H ATOM 4027 C16 PA 157 46.559 45.474 49.895 1.00 0.00 C ATOM 4028 H6R PA 157 45.709 45.882 49.345 1.00 0.00 H ATOM 4029 H6S PA 157 46.973 46.445 50.173 1.00 0.00 H ATOM 4030 C15 PA 157 46.047 44.712 51.139 1.00 0.00 C ATOM 4031 H5R PA 157 45.409 43.911 50.760 1.00 0.00 H ATOM 4032 H5S PA 157 45.342 45.379 51.641 1.00 0.00 H ATOM 4033 C14 PA 157 47.118 44.290 52.156 1.00 0.00 C ATOM 4034 H4R PA 157 47.635 45.236 52.329 1.00 0.00 H ATOM 4035 H4S PA 157 47.862 43.655 51.671 1.00 0.00 H ATOM 4036 C13 PA 157 46.520 43.696 53.395 1.00 0.00 C ATOM 4037 H3R PA 157 45.746 43.022 53.022 1.00 0.00 H ATOM 4038 H3S PA 157 46.056 44.441 54.044 1.00 0.00 H ATOM 4039 C12 PA 157 47.582 43.013 54.248 1.00 0.00 C ATOM 4040 H2R PA 157 48.428 43.690 54.378 1.00 0.00 H ATOM 4041 H2S PA 157 47.799 42.045 53.791 1.00 0.00 H ATOM 4042 C11 PGR 158 47.041 42.747 55.681 1.00 0.00 C ATOM 4043 O12 PGR 158 46.546 43.558 56.458 1.00 0.00 O ATOM 4044 O11 PGR 158 47.076 41.400 55.950 1.00 0.00 O ATOM 4045 C1 PGR 158 46.512 40.916 57.234 1.00 0.00 C ATOM 4046 HR PGR 158 45.459 41.180 57.104 1.00 0.00 H ATOM 4047 HS PGR 158 47.062 41.519 57.960 1.00 0.00 H ATOM 4048 C2 PGR 158 46.732 39.402 57.393 1.00 0.00 C ATOM 4049 HX PGR 158 46.437 39.152 58.415 1.00 0.00 H ATOM 4050 C3 PGR 158 48.240 39.055 57.080 1.00 0.00 C ATOM 4051 HA PGR 158 48.876 39.887 57.393 1.00 0.00 H ATOM 4052 HB PGR 158 48.340 38.801 56.022 1.00 0.00 H ATOM 4053 O31 PGR 158 48.501 37.921 57.885 1.00 0.00 O ATOM 4054 P31 PGR 158 49.219 38.027 59.319 1.00 0.00 P ATOM 4055 O32 PGR 158 50.532 38.943 59.064 1.00 0.00 O ATOM 4056 C31 PGR 158 51.632 38.383 58.365 1.00 0.00 C ATOM 4057 H1A PGR 158 52.121 39.135 57.742 1.00 0.00 H ATOM 4058 H1B PGR 158 51.369 37.562 57.693 1.00 0.00 H ATOM 4059 C32 PGR 158 52.804 37.929 59.266 1.00 0.00 C ATOM 4060 H2A PGR 158 53.660 37.608 58.666 1.00 0.00 H ATOM 4061 O35 PGR 158 52.436 36.758 59.947 1.00 0.00 O ATOM 4062 HO5A PGR 158 51.507 36.861 60.220 1.00 0.00 H ATOM 4063 C33 PGR 158 53.222 39.146 60.178 1.00 0.00 C ATOM 4064 H3A PGR 158 53.324 40.071 59.604 1.00 0.00 H ATOM 4065 H3B PGR 158 52.486 39.308 60.969 1.00 0.00 H ATOM 4066 O33 PGR 158 48.386 38.832 60.236 1.00 0.00 O ATOM 4067 O34 PGR 158 49.668 36.730 59.788 1.00 0.00 O ATOM 4068 O21 PGR 158 45.788 38.776 56.565 1.00 0.00 O ATOM 4069 C21 PGR 158 45.313 37.528 56.895 1.00 0.00 C ATOM 4070 O22 PGR 158 45.754 36.804 57.821 1.00 0.00 O ATOM 4071 O36 PGR 158 54.510 39.048 60.766 1.00 0.00 O ATOM 4072 HO6A PGR 158 54.554 39.872 61.284 1.00 0.00 H ATOM 4073 C12 OL 159 44.289 36.998 55.888 1.00 0.00 C ATOM 4074 H2R OL 159 44.797 36.561 55.026 1.00 0.00 H ATOM 4075 H2S OL 159 43.703 36.231 56.398 1.00 0.00 H ATOM 4076 C13 OL 159 43.336 38.138 55.466 1.00 0.00 C ATOM 4077 H3R OL 159 42.898 38.562 56.372 1.00 0.00 H ATOM 4078 H3S OL 159 43.912 38.957 55.032 1.00 0.00 H ATOM 4079 C14 OL 159 42.239 37.664 54.546 1.00 0.00 C ATOM 4080 H4R OL 159 41.728 36.812 54.999 1.00 0.00 H ATOM 4081 H4S OL 159 41.494 38.428 54.312 1.00 0.00 H ATOM 4082 C15 OL 159 42.887 37.058 53.232 1.00 0.00 C ATOM 4083 H5R OL 159 43.621 37.726 52.776 1.00 0.00 H ATOM 4084 H5S OL 159 43.584 36.243 53.442 1.00 0.00 H ATOM 4085 C16 OL 159 41.851 36.530 52.271 1.00 0.00 C ATOM 4086 H6R OL 159 41.274 35.749 52.771 1.00 0.00 H ATOM 4087 H6S OL 159 41.183 37.368 52.064 1.00 0.00 H ATOM 4088 C17 OL 159 42.455 35.963 50.984 1.00 0.00 C ATOM 4089 H7R OL 159 43.258 36.602 50.612 1.00 0.00 H ATOM 4090 H7S OL 159 42.864 34.965 51.155 1.00 0.00 H ATOM 4091 C18 OL 159 41.513 35.918 49.744 1.00 0.00 C ATOM 4092 H8R OL 159 41.990 35.330 48.957 1.00 0.00 H ATOM 4093 H8S OL 159 40.656 35.266 49.928 1.00 0.00 H ATOM 4094 C19 OL 159 41.166 37.341 49.291 1.00 0.00 C ATOM 4095 H9R OL 159 40.872 38.072 50.040 1.00 0.00 H ATOM 4096 C110 OL 159 41.113 37.848 47.988 1.00 0.00 C ATOM 4097 H10R OL 159 40.870 38.898 47.843 1.00 0.00 H ATOM 4098 C111 OL 159 41.319 37.006 46.772 1.00 0.00 C ATOM 4099 H11R OL 159 41.849 36.098 47.067 1.00 0.00 H ATOM 4100 H11S OL 159 40.435 36.509 46.367 1.00 0.00 H ATOM 4101 C112 OL 159 41.994 37.828 45.703 1.00 0.00 C ATOM 4102 H12R OL 159 42.709 38.496 46.187 1.00 0.00 H ATOM 4103 H12S OL 159 42.599 37.207 45.038 1.00 0.00 H ATOM 4104 C113 OL 159 41.030 38.543 44.676 1.00 0.00 C ATOM 4105 H13R OL 159 41.723 38.872 43.899 1.00 0.00 H ATOM 4106 H13S OL 159 40.440 37.800 44.136 1.00 0.00 H ATOM 4107 C114 OL 159 40.196 39.699 45.299 1.00 0.00 C ATOM 4108 H14R OL 159 39.414 39.230 45.898 1.00 0.00 H ATOM 4109 H14S OL 159 40.919 40.174 45.966 1.00 0.00 H ATOM 4110 C115 OL 159 39.686 40.729 44.275 1.00 0.00 C ATOM 4111 H15R OL 159 39.357 41.669 44.723 1.00 0.00 H ATOM 4112 H15S OL 159 40.538 41.194 43.775 1.00 0.00 H ATOM 4113 C116 OL 159 38.708 40.264 43.174 1.00 0.00 C ATOM 4114 H16R OL 159 39.160 39.415 42.657 1.00 0.00 H ATOM 4115 H16S OL 159 37.758 39.976 43.629 1.00 0.00 H ATOM 4116 C117 OL 159 38.530 41.377 42.090 1.00 0.00 C ATOM 4117 H17R OL 159 38.317 42.367 42.501 1.00 0.00 H ATOM 4118 H17S OL 159 39.497 41.608 41.639 1.00 0.00 H ATOM 4119 C118 OL 159 37.439 41.116 41.075 1.00 0.00 C ATOM 4120 H18R OL 159 37.900 40.398 40.393 1.00 0.00 H ATOM 4121 H18S OL 159 37.243 42.029 40.509 1.00 0.00 H ATOM 4122 H18T OL 159 36.555 40.599 41.454 1.00 0.00 H TER 4123 OL 159 ATOM 4123 C116 PA 160 100.316 63.176 50.795 1.00 0.00 C ATOM 4124 H16R PA 160 101.131 62.463 50.932 1.00 0.00 H ATOM 4125 H16S PA 160 99.712 63.118 51.704 1.00 0.00 H ATOM 4126 H16T PA 160 100.821 64.143 50.747 1.00 0.00 H ATOM 4127 C115 PA 160 99.468 62.935 49.588 1.00 0.00 C ATOM 4128 H15R PA 160 100.127 63.046 48.725 1.00 0.00 H ATOM 4129 H15S PA 160 98.700 63.708 49.524 1.00 0.00 H ATOM 4130 C114 PA 160 98.699 61.540 49.453 1.00 0.00 C ATOM 4131 H14R PA 160 98.095 61.604 48.546 1.00 0.00 H ATOM 4132 H14S PA 160 97.992 61.321 50.256 1.00 0.00 H ATOM 4133 C113 PA 160 99.563 60.253 49.430 1.00 0.00 C ATOM 4134 H13R PA 160 98.936 59.366 49.543 1.00 0.00 H ATOM 4135 H13S PA 160 100.336 60.351 50.195 1.00 0.00 H ATOM 4136 C112 PA 160 100.446 60.108 48.146 1.00 0.00 C ATOM 4137 H12R PA 160 101.319 60.735 48.339 1.00 0.00 H ATOM 4138 H12S PA 160 99.900 60.391 47.244 1.00 0.00 H ATOM 4139 C111 PA 160 100.955 58.721 47.930 1.00 0.00 C ATOM 4140 H11R PA 160 101.304 58.594 46.903 1.00 0.00 H ATOM 4141 H11S PA 160 100.071 58.080 47.951 1.00 0.00 H ATOM 4142 C110 PA 160 102.100 58.244 48.943 1.00 0.00 C ATOM 4143 H10R PA 160 101.891 58.489 49.986 1.00 0.00 H ATOM 4144 H10S PA 160 102.937 58.875 48.638 1.00 0.00 H ATOM 4145 C19 PA 160 102.610 56.804 48.666 1.00 0.00 C ATOM 4146 H9R PA 160 103.454 56.817 47.973 1.00 0.00 H ATOM 4147 H9S PA 160 101.788 56.239 48.222 1.00 0.00 H ATOM 4148 C18 PA 160 103.001 56.188 50.005 1.00 0.00 C ATOM 4149 H8R PA 160 102.236 56.211 50.784 1.00 0.00 H ATOM 4150 H8S PA 160 103.735 56.899 50.389 1.00 0.00 H ATOM 4151 C17 PA 160 103.723 54.840 49.830 1.00 0.00 C ATOM 4152 H7R PA 160 104.377 54.995 48.970 1.00 0.00 H ATOM 4153 H7S PA 160 103.022 54.015 49.687 1.00 0.00 H ATOM 4154 C16 PA 160 104.607 54.388 51.048 1.00 0.00 C ATOM 4155 H6R PA 160 105.252 55.236 51.288 1.00 0.00 H ATOM 4156 H6S PA 160 105.178 53.561 50.621 1.00 0.00 H ATOM 4157 C15 PA 160 103.818 53.877 52.192 1.00 0.00 C ATOM 4158 H5R PA 160 103.119 53.101 51.873 1.00 0.00 H ATOM 4159 H5S PA 160 103.191 54.718 52.493 1.00 0.00 H ATOM 4160 C14 PA 160 104.551 53.425 53.438 1.00 0.00 C ATOM 4161 H4R PA 160 105.246 54.203 53.761 1.00 0.00 H ATOM 4162 H4S PA 160 105.040 52.475 53.211 1.00 0.00 H ATOM 4163 C13 PA 160 103.650 53.143 54.581 1.00 0.00 C ATOM 4164 H3R PA 160 103.034 52.275 54.336 1.00 0.00 H ATOM 4165 H3S PA 160 103.039 53.971 54.946 1.00 0.00 H ATOM 4166 C12 PA 160 104.472 52.612 55.831 1.00 0.00 C ATOM 4167 H2R PA 160 105.352 52.031 55.546 1.00 0.00 H ATOM 4168 H2S PA 160 103.963 51.965 56.548 1.00 0.00 H ATOM 4169 C11 PC 161 105.077 53.782 56.544 1.00 0.00 C ATOM 4170 O12 PC 161 106.118 54.265 56.271 1.00 0.00 O ATOM 4171 O11 PC 161 104.121 54.289 57.453 1.00 0.00 O ATOM 4172 C1 PC 161 104.228 55.628 57.945 1.00 0.00 C ATOM 4173 HR PC 161 104.535 56.353 57.187 1.00 0.00 H ATOM 4174 HS PC 161 105.085 55.635 58.623 1.00 0.00 H ATOM 4175 C2 PC 161 102.984 56.174 58.656 1.00 0.00 C ATOM 4176 HX PC 161 103.185 57.168 59.065 1.00 0.00 H ATOM 4177 C3 PC 161 102.467 55.123 59.615 1.00 0.00 C ATOM 4178 HA PC 161 103.245 54.847 60.332 1.00 0.00 H ATOM 4179 HB PC 161 102.242 54.222 59.039 1.00 0.00 H ATOM 4180 O31 PC 161 101.303 55.434 60.411 1.00 0.00 O ATOM 4181 P31 PC 161 100.877 54.540 61.728 1.00 0.00 P ATOM 4182 O32 PC 161 101.455 55.377 62.936 1.00 0.00 O ATOM 4183 C31 PC 161 102.767 55.192 63.428 1.00 0.00 C ATOM 4184 H1A PC 161 103.372 55.946 62.918 1.00 0.00 H ATOM 4185 H1B PC 161 103.157 54.192 63.222 1.00 0.00 H ATOM 4186 C32 PC 161 102.622 55.453 64.987 1.00 0.00 C ATOM 4187 H2A PC 161 102.140 54.550 65.365 1.00 0.00 H ATOM 4188 H2B PC 161 101.878 56.199 65.268 1.00 0.00 H ATOM 4189 N31 PC 161 103.870 55.781 65.852 1.00 0.00 N ATOM 4190 C33 PC 161 105.070 54.909 65.553 1.00 0.00 C ATOM 4191 H3A PC 161 104.823 53.885 65.270 1.00 0.00 H ATOM 4192 H3B PC 161 105.790 54.988 66.369 1.00 0.00 H ATOM 4193 H3C PC 161 105.510 55.287 64.629 1.00 0.00 H ATOM 4194 C34 PC 161 104.200 57.184 65.543 1.00 0.00 C ATOM 4195 H4A PC 161 104.424 57.261 64.478 1.00 0.00 H ATOM 4196 H4B PC 161 105.107 57.469 66.078 1.00 0.00 H ATOM 4197 H4C PC 161 103.372 57.783 65.925 1.00 0.00 H ATOM 4198 C35 PC 161 103.598 55.734 67.317 1.00 0.00 C ATOM 4199 H5A PC 161 103.218 54.736 67.544 1.00 0.00 H ATOM 4200 H5B PC 161 102.945 56.519 67.700 1.00 0.00 H ATOM 4201 H5C PC 161 104.570 55.891 67.786 1.00 0.00 H ATOM 4202 O33 PC 161 99.430 54.586 61.821 1.00 0.00 O ATOM 4203 O34 PC 161 101.644 53.245 61.774 1.00 0.00 O ATOM 4204 O21 PC 161 101.948 56.271 57.615 1.00 0.00 O ATOM 4205 C21 PC 161 100.919 57.108 57.730 1.00 0.00 C ATOM 4206 O22 PC 161 100.832 57.885 58.659 1.00 0.00 O ATOM 4207 C12 OL 162 99.728 56.705 56.946 1.00 0.00 C ATOM 4208 H2R OL 162 99.095 56.099 57.598 1.00 0.00 H ATOM 4209 H2S OL 162 99.065 57.560 56.794 1.00 0.00 H ATOM 4210 C13 OL 162 99.952 56.152 55.525 1.00 0.00 C ATOM 4211 H3R OL 162 100.787 55.450 55.567 1.00 0.00 H ATOM 4212 H3S OL 162 99.126 55.472 55.304 1.00 0.00 H ATOM 4213 C14 OL 162 100.320 57.157 54.513 1.00 0.00 C ATOM 4214 H4R OL 162 100.130 56.822 53.491 1.00 0.00 H ATOM 4215 H4S OL 162 99.633 58.001 54.607 1.00 0.00 H ATOM 4216 C15 OL 162 101.804 57.690 54.512 1.00 0.00 C ATOM 4217 H5R OL 162 102.082 58.154 55.460 1.00 0.00 H ATOM 4218 H5S OL 162 102.561 56.917 54.366 1.00 0.00 H ATOM 4219 C16 OL 162 102.037 58.707 53.337 1.00 0.00 C ATOM 4220 H6R OL 162 102.355 58.186 52.432 1.00 0.00 H ATOM 4221 H6S OL 162 101.133 59.295 53.168 1.00 0.00 H ATOM 4222 C17 OL 162 103.081 59.728 53.531 1.00 0.00 C ATOM 4223 H7R OL 162 103.338 59.892 54.579 1.00 0.00 H ATOM 4224 H7S OL 162 104.025 59.400 53.090 1.00 0.00 H ATOM 4225 C18 OL 162 102.731 61.084 52.848 1.00 0.00 C ATOM 4226 H8R OL 162 102.491 60.857 51.808 1.00 0.00 H ATOM 4227 H8S OL 162 101.948 61.702 53.293 1.00 0.00 H ATOM 4228 C19 OL 162 103.971 61.923 52.933 1.00 0.00 C ATOM 4229 H9R OL 162 104.095 62.362 53.920 1.00 0.00 H ATOM 4230 C110 OL 162 104.862 62.282 51.973 1.00 0.00 C ATOM 4231 H10R OL 162 105.762 62.830 52.242 1.00 0.00 H ATOM 4232 C111 OL 162 104.898 61.820 50.534 1.00 0.00 C ATOM 4233 H11R OL 162 105.914 61.772 50.136 1.00 0.00 H ATOM 4234 H11S OL 162 104.593 60.776 50.438 1.00 0.00 H ATOM 4235 C112 OL 162 104.163 62.717 49.549 1.00 0.00 C ATOM 4236 H12R OL 162 103.146 62.934 49.885 1.00 0.00 H ATOM 4237 H12S OL 162 104.651 63.691 49.476 1.00 0.00 H ATOM 4238 C113 OL 162 104.091 62.174 48.146 1.00 0.00 C ATOM 4239 H13R OL 162 105.013 61.647 47.891 1.00 0.00 H ATOM 4240 H13S OL 162 103.321 61.412 48.012 1.00 0.00 H ATOM 4241 C114 OL 162 103.751 63.325 47.210 1.00 0.00 C ATOM 4242 H14R OL 162 102.717 63.569 47.460 1.00 0.00 H ATOM 4243 H14S OL 162 104.249 64.279 47.396 1.00 0.00 H ATOM 4244 C115 OL 162 103.444 62.781 45.821 1.00 0.00 C ATOM 4245 H15R OL 162 102.997 61.787 45.878 1.00 0.00 H ATOM 4246 H15S OL 162 102.773 63.490 45.332 1.00 0.00 H ATOM 4247 C116 OL 162 104.704 62.667 44.931 1.00 0.00 C ATOM 4248 H16R OL 162 105.472 62.015 45.353 1.00 0.00 H ATOM 4249 H16S OL 162 104.402 62.189 43.997 1.00 0.00 H ATOM 4250 C117 OL 162 105.232 64.081 44.503 1.00 0.00 C ATOM 4251 H17R OL 162 104.350 64.656 44.213 1.00 0.00 H ATOM 4252 H17S OL 162 105.720 64.554 45.358 1.00 0.00 H ATOM 4253 C118 OL 162 106.147 64.107 43.186 1.00 0.00 C ATOM 4254 H18R OL 162 107.177 63.790 43.361 1.00 0.00 H ATOM 4255 H18S OL 162 106.272 65.106 42.764 1.00 0.00 H ATOM 4256 H18T OL 162 105.610 63.753 42.304 1.00 0.00 H TER 4257 OL 162 ATOM 4257 C116 PA 163 66.072 33.651 40.741 1.00 0.00 C ATOM 4258 H16R PA 163 65.625 32.947 41.446 1.00 0.00 H ATOM 4259 H16S PA 163 65.250 34.062 40.152 1.00 0.00 H ATOM 4260 H16T PA 163 66.536 34.482 41.277 1.00 0.00 H ATOM 4261 C115 PA 163 67.044 32.917 39.939 1.00 0.00 C ATOM 4262 H15R PA 163 66.612 32.089 39.372 1.00 0.00 H ATOM 4263 H15S PA 163 67.843 32.551 40.587 1.00 0.00 H ATOM 4264 C114 PA 163 67.767 33.794 38.890 1.00 0.00 C ATOM 4265 H14R PA 163 66.960 34.228 38.296 1.00 0.00 H ATOM 4266 H14S PA 163 68.429 33.214 38.243 1.00 0.00 H ATOM 4267 C113 PA 163 68.801 34.796 39.430 1.00 0.00 C ATOM 4268 H13R PA 163 68.306 35.660 39.879 1.00 0.00 H ATOM 4269 H13S PA 163 69.372 35.231 38.607 1.00 0.00 H ATOM 4270 C112 PA 163 69.781 34.381 40.465 1.00 0.00 C ATOM 4271 H12R PA 163 70.278 33.464 40.140 1.00 0.00 H ATOM 4272 H12S PA 163 69.272 34.130 41.398 1.00 0.00 H ATOM 4273 C111 PA 163 70.715 35.457 40.918 1.00 0.00 C ATOM 4274 H11R PA 163 71.115 35.916 40.012 1.00 0.00 H ATOM 4275 H11S PA 163 71.602 34.986 41.347 1.00 0.00 H ATOM 4276 C110 PA 163 70.167 36.494 41.833 1.00 0.00 C ATOM 4277 H10R PA 163 69.454 37.090 41.260 1.00 0.00 H ATOM 4278 H10S PA 163 70.948 37.214 42.083 1.00 0.00 H ATOM 4279 C19 PA 163 69.591 36.062 43.207 1.00 0.00 C ATOM 4280 H9R PA 163 70.426 35.673 43.794 1.00 0.00 H ATOM 4281 H9S PA 163 68.915 35.209 43.117 1.00 0.00 H ATOM 4282 C18 PA 163 68.846 37.162 43.968 1.00 0.00 C ATOM 4283 H8R PA 163 68.006 37.556 43.392 1.00 0.00 H ATOM 4284 H8S PA 163 69.479 38.039 44.121 1.00 0.00 H ATOM 4285 C17 PA 163 68.375 36.630 45.363 1.00 0.00 C ATOM 4286 H7R PA 163 69.213 36.153 45.875 1.00 0.00 H ATOM 4287 H7S PA 163 67.739 35.763 45.175 1.00 0.00 H ATOM 4288 C16 PA 163 67.634 37.657 46.254 1.00 0.00 C ATOM 4289 H6R PA 163 66.615 37.795 45.887 1.00 0.00 H ATOM 4290 H6S PA 163 68.184 38.594 46.150 1.00 0.00 H ATOM 4291 C15 PA 163 67.557 37.265 47.755 1.00 0.00 C ATOM 4292 H5R PA 163 68.562 37.190 48.174 1.00 0.00 H ATOM 4293 H5S PA 163 67.120 36.266 47.803 1.00 0.00 H ATOM 4294 C14 PA 163 66.786 38.332 48.541 1.00 0.00 C ATOM 4295 H4R PA 163 65.822 38.440 48.040 1.00 0.00 H ATOM 4296 H4S PA 163 67.348 39.263 48.441 1.00 0.00 H ATOM 4297 C13 PA 163 66.599 38.069 50.042 1.00 0.00 C ATOM 4298 H3R PA 163 65.825 37.308 50.157 1.00 0.00 H ATOM 4299 H3S PA 163 66.147 38.987 50.422 1.00 0.00 H ATOM 4300 C12 PA 163 67.917 37.677 50.767 1.00 0.00 C ATOM 4301 H2R PA 163 68.624 38.507 50.703 1.00 0.00 H ATOM 4302 H2S PA 163 68.449 36.845 50.301 1.00 0.00 H ATOM 4303 C11 PC 164 67.682 37.505 52.264 1.00 0.00 C ATOM 4304 O12 PC 164 68.627 37.158 53.002 1.00 0.00 O ATOM 4305 O11 PC 164 66.452 37.876 52.715 1.00 0.00 O ATOM 4306 C1 PC 164 66.220 37.919 54.138 1.00 0.00 C ATOM 4307 HR PC 164 66.975 38.557 54.604 1.00 0.00 H ATOM 4308 HS PC 164 66.401 36.887 54.451 1.00 0.00 H ATOM 4309 C2 PC 164 64.758 38.318 54.356 1.00 0.00 C ATOM 4310 HX PC 164 64.624 39.367 54.080 1.00 0.00 H ATOM 4311 C3 PC 164 64.325 38.173 55.835 1.00 0.00 C ATOM 4312 HA PC 164 63.248 37.986 55.861 1.00 0.00 H ATOM 4313 HB PC 164 64.613 39.050 56.420 1.00 0.00 H ATOM 4314 O31 PC 164 64.930 37.029 56.372 1.00 0.00 O ATOM 4315 P31 PC 164 64.658 36.560 57.898 1.00 0.00 P ATOM 4316 O32 PC 164 65.445 37.650 58.798 1.00 0.00 O ATOM 4317 C31 PC 164 64.715 38.601 59.415 1.00 0.00 C ATOM 4318 H1A PC 164 64.032 38.077 60.089 1.00 0.00 H ATOM 4319 H1B PC 164 64.133 39.206 58.715 1.00 0.00 H ATOM 4320 C32 PC 164 65.713 39.441 60.299 1.00 0.00 C ATOM 4321 H2A PC 164 66.506 39.902 59.708 1.00 0.00 H ATOM 4322 H2B PC 164 66.368 38.752 60.836 1.00 0.00 H ATOM 4323 N31 PC 164 65.206 40.367 61.388 1.00 0.00 N ATOM 4324 C33 PC 164 64.115 39.658 62.142 1.00 0.00 C ATOM 4325 H3A PC 164 64.598 38.710 62.382 1.00 0.00 H ATOM 4326 H3B PC 164 63.220 39.411 61.569 1.00 0.00 H ATOM 4327 H3C PC 164 63.959 40.155 63.101 1.00 0.00 H ATOM 4328 C34 PC 164 66.252 40.707 62.380 1.00 0.00 C ATOM 4329 H4A PC 164 67.009 41.311 61.878 1.00 0.00 H ATOM 4330 H4B PC 164 66.624 39.732 62.697 1.00 0.00 H ATOM 4331 H4C PC 164 65.836 41.279 63.210 1.00 0.00 H ATOM 4332 C35 PC 164 64.703 41.640 60.796 1.00 0.00 C ATOM 4333 H5A PC 164 64.058 42.116 61.536 1.00 0.00 H ATOM 4334 H5B PC 164 64.189 41.353 59.877 1.00 0.00 H ATOM 4335 H5C PC 164 65.503 42.283 60.425 1.00 0.00 H ATOM 4336 O33 PC 164 63.195 36.666 58.219 1.00 0.00 O ATOM 4337 O34 PC 164 65.265 35.279 58.098 1.00 0.00 O ATOM 4338 O21 PC 164 63.972 37.487 53.442 1.00 0.00 O ATOM 4339 C21 PC 164 62.698 37.738 53.155 1.00 0.00 C ATOM 4340 O22 PC 164 62.164 38.661 53.708 1.00 0.00 O ATOM 4341 C12 OL 165 62.179 36.923 51.916 1.00 0.00 C ATOM 4342 H2R OL 165 62.361 35.872 52.149 1.00 0.00 H ATOM 4343 H2S OL 165 61.149 37.199 51.681 1.00 0.00 H ATOM 4344 C13 OL 165 62.951 37.178 50.702 1.00 0.00 C ATOM 4345 H3R OL 165 62.997 38.229 50.408 1.00 0.00 H ATOM 4346 H3S OL 165 63.995 36.913 50.880 1.00 0.00 H ATOM 4347 C14 OL 165 62.466 36.466 49.388 1.00 0.00 C ATOM 4348 H4R OL 165 62.596 35.390 49.516 1.00 0.00 H ATOM 4349 H4S OL 165 61.408 36.670 49.210 1.00 0.00 H ATOM 4350 C15 OL 165 63.208 36.928 48.114 1.00 0.00 C ATOM 4351 H5R OL 165 63.128 38.015 48.057 1.00 0.00 H ATOM 4352 H5S OL 165 64.279 36.719 48.166 1.00 0.00 H ATOM 4353 C16 OL 165 62.820 36.253 46.775 1.00 0.00 C ATOM 4354 H6R OL 165 62.823 35.165 46.876 1.00 0.00 H ATOM 4355 H6S OL 165 61.790 36.491 46.501 1.00 0.00 H ATOM 4356 C17 OL 165 63.789 36.616 45.628 1.00 0.00 C ATOM 4357 H7R OL 165 64.177 37.631 45.525 1.00 0.00 H ATOM 4358 H7S OL 165 64.722 36.099 45.860 1.00 0.00 H ATOM 4359 C18 OL 165 63.295 35.988 44.300 1.00 0.00 C ATOM 4360 H8R OL 165 62.826 35.028 44.522 1.00 0.00 H ATOM 4361 H8S OL 165 62.456 36.586 43.936 1.00 0.00 H ATOM 4362 C19 OL 165 64.502 36.075 43.307 1.00 0.00 C ATOM 4363 H9R OL 165 65.232 35.280 43.437 1.00 0.00 H ATOM 4364 C110 OL 165 64.712 37.096 42.446 1.00 0.00 C ATOM 4365 H10R OL 165 65.645 37.042 41.889 1.00 0.00 H ATOM 4366 C111 OL 165 63.777 38.226 42.116 1.00 0.00 C ATOM 4367 H11R OL 165 63.432 38.564 43.096 1.00 0.00 H ATOM 4368 H11S OL 165 64.195 39.155 41.722 1.00 0.00 H ATOM 4369 C112 OL 165 62.706 37.664 41.242 1.00 0.00 C ATOM 4370 H12R OL 165 63.117 37.463 40.251 1.00 0.00 H ATOM 4371 H12S OL 165 62.389 36.683 41.600 1.00 0.00 H ATOM 4372 C113 OL 165 61.545 38.637 41.076 1.00 0.00 C ATOM 4373 H13R OL 165 61.058 38.998 41.984 1.00 0.00 H ATOM 4374 H13S OL 165 62.082 39.517 40.717 1.00 0.00 H ATOM 4375 C114 OL 165 60.497 38.230 40.118 1.00 0.00 C ATOM 4376 H14R OL 165 60.852 38.350 39.092 1.00 0.00 H ATOM 4377 H14S OL 165 60.285 37.175 40.307 1.00 0.00 H ATOM 4378 C115 OL 165 59.154 38.908 40.281 1.00 0.00 C ATOM 4379 H15R OL 165 58.779 38.793 41.300 1.00 0.00 H ATOM 4380 H15S OL 165 59.378 39.976 40.264 1.00 0.00 H ATOM 4381 C116 OL 165 58.157 38.436 39.228 1.00 0.00 C ATOM 4382 H16R OL 165 58.577 38.700 38.255 1.00 0.00 H ATOM 4383 H16S OL 165 58.063 37.349 39.194 1.00 0.00 H ATOM 4384 C117 OL 165 56.800 39.026 39.421 1.00 0.00 C ATOM 4385 H17R OL 165 56.009 38.400 39.004 1.00 0.00 H ATOM 4386 H17S OL 165 56.540 38.980 40.481 1.00 0.00 H ATOM 4387 C118 OL 165 56.733 40.562 39.203 1.00 0.00 C ATOM 4388 H18R OL 165 57.379 41.053 39.933 1.00 0.00 H ATOM 4389 H18S OL 165 55.712 40.926 39.341 1.00 0.00 H ATOM 4390 H18T OL 165 56.956 41.121 38.292 1.00 0.00 H TER 4391 OL 165 ATOM 4391 C116 PA 166 34.599 61.302 35.507 1.00 0.00 C ATOM 4392 H16R PA 166 35.178 62.134 35.914 1.00 0.00 H ATOM 4393 H16S PA 166 33.785 61.267 36.234 1.00 0.00 H ATOM 4394 H16T PA 166 34.287 61.729 34.551 1.00 0.00 H ATOM 4395 C115 PA 166 35.317 59.962 35.364 1.00 0.00 C ATOM 4396 H15R PA 166 36.135 60.118 34.657 1.00 0.00 H ATOM 4397 H15S PA 166 34.689 59.159 34.972 1.00 0.00 H ATOM 4398 C114 PA 166 36.105 59.507 36.603 1.00 0.00 C ATOM 4399 H14R PA 166 35.504 59.720 37.489 1.00 0.00 H ATOM 4400 H14S PA 166 37.005 60.111 36.741 1.00 0.00 H ATOM 4401 C113 PA 166 36.544 57.980 36.449 1.00 0.00 C ATOM 4402 H13R PA 166 37.337 57.873 35.707 1.00 0.00 H ATOM 4403 H13S PA 166 35.806 57.279 36.054 1.00 0.00 H ATOM 4404 C112 PA 166 36.846 57.353 37.852 1.00 0.00 C ATOM 4405 H12R PA 166 37.193 56.321 37.770 1.00 0.00 H ATOM 4406 H12S PA 166 36.011 57.333 38.556 1.00 0.00 H ATOM 4407 C111 PA 166 37.962 58.175 38.456 1.00 0.00 C ATOM 4408 H11R PA 166 37.423 59.064 38.791 1.00 0.00 H ATOM 4409 H11S PA 166 38.759 58.326 37.725 1.00 0.00 H ATOM 4410 C110 PA 166 38.669 57.579 39.662 1.00 0.00 C ATOM 4411 H10R PA 166 39.552 58.205 39.804 1.00 0.00 H ATOM 4412 H10S PA 166 39.035 56.606 39.328 1.00 0.00 H ATOM 4413 C19 PA 166 37.873 57.442 40.904 1.00 0.00 C ATOM 4414 H9R PA 166 37.026 56.818 40.614 1.00 0.00 H ATOM 4415 H9S PA 166 37.418 58.398 41.173 1.00 0.00 H ATOM 4416 C18 PA 166 38.538 56.864 42.148 1.00 0.00 C ATOM 4417 H8R PA 166 38.994 56.010 41.642 1.00 0.00 H ATOM 4418 H8S PA 166 37.740 56.587 42.840 1.00 0.00 H ATOM 4419 C17 PA 166 39.484 57.935 42.771 1.00 0.00 C ATOM 4420 H7R PA 166 38.822 58.793 42.910 1.00 0.00 H ATOM 4421 H7S PA 166 40.162 58.261 41.979 1.00 0.00 H ATOM 4422 C16 PA 166 40.206 57.526 43.953 1.00 0.00 C ATOM 4423 H6R PA 166 40.694 56.585 43.691 1.00 0.00 H ATOM 4424 H6S PA 166 39.554 57.387 44.818 1.00 0.00 H ATOM 4425 C15 PA 166 41.161 58.512 44.425 1.00 0.00 C ATOM 4426 H5R PA 166 40.665 59.338 44.940 1.00 0.00 H ATOM 4427 H5S PA 166 41.580 59.088 43.597 1.00 0.00 H ATOM 4428 C14 PA 166 42.253 57.968 45.305 1.00 0.00 C ATOM 4429 H4R PA 166 43.012 58.745 45.413 1.00 0.00 H ATOM 4430 H4S PA 166 42.740 57.150 44.769 1.00 0.00 H ATOM 4431 C13 PA 166 41.858 57.384 46.698 1.00 0.00 C ATOM 4432 H3R PA 166 42.760 57.178 47.279 1.00 0.00 H ATOM 4433 H3S PA 166 41.443 56.376 46.649 1.00 0.00 H ATOM 4434 C12 PA 166 40.936 58.343 47.540 1.00 0.00 C ATOM 4435 H2R PA 166 39.920 58.379 47.141 1.00 0.00 H ATOM 4436 H2S PA 166 41.246 59.379 47.382 1.00 0.00 H ATOM 4437 C11 PGR 167 40.796 57.996 49.013 1.00 0.00 C ATOM 4438 O12 PGR 167 41.105 56.948 49.477 1.00 0.00 O ATOM 4439 O11 PGR 167 40.280 59.077 49.713 1.00 0.00 O ATOM 4440 C1 PGR 167 40.355 59.245 51.044 1.00 0.00 C ATOM 4441 HR PGR 167 39.673 58.508 51.476 1.00 0.00 H ATOM 4442 HS PGR 167 40.031 60.230 51.391 1.00 0.00 H ATOM 4443 C2 PGR 167 41.761 59.010 51.574 1.00 0.00 C ATOM 4444 HX PGR 167 42.213 58.095 51.185 1.00 0.00 H ATOM 4445 C3 PGR 167 41.792 58.986 53.101 1.00 0.00 C ATOM 4446 HA PGR 167 41.124 58.244 53.545 1.00 0.00 H ATOM 4447 HB PGR 167 41.530 59.932 53.582 1.00 0.00 H ATOM 4448 O31 PGR 167 43.065 58.737 53.701 1.00 0.00 O ATOM 4449 P31 PGR 167 43.312 58.872 55.245 1.00 0.00 P ATOM 4450 O32 PGR 167 43.742 60.344 55.460 1.00 0.00 O ATOM 4451 C31 PGR 167 44.873 60.851 54.686 1.00 0.00 C ATOM 4452 H1A PGR 167 44.542 60.960 53.650 1.00 0.00 H ATOM 4453 H1B PGR 167 45.636 60.070 54.636 1.00 0.00 H ATOM 4454 C32 PGR 167 45.313 62.188 55.210 1.00 0.00 C ATOM 4455 H2A PGR 167 45.984 62.726 54.536 1.00 0.00 H ATOM 4456 O35 PGR 167 45.935 61.935 56.457 1.00 0.00 O ATOM 4457 HO5A PGR 167 46.793 61.531 56.235 1.00 0.00 H ATOM 4458 C33 PGR 167 44.123 63.159 55.453 1.00 0.00 C ATOM 4459 H3A PGR 167 44.516 64.027 55.987 1.00 0.00 H ATOM 4460 H3B PGR 167 43.769 63.443 54.458 1.00 0.00 H ATOM 4461 O33 PGR 167 42.015 58.656 55.929 1.00 0.00 O ATOM 4462 O34 PGR 167 44.449 58.078 55.743 1.00 0.00 O ATOM 4463 O21 PGR 167 42.464 60.160 51.003 1.00 0.00 O ATOM 4464 C21 PGR 167 43.766 60.200 50.965 1.00 0.00 C ATOM 4465 O22 PGR 167 44.530 59.249 51.156 1.00 0.00 O ATOM 4466 O36 PGR 167 43.078 62.664 56.341 1.00 0.00 O ATOM 4467 HO6A PGR 167 42.437 63.389 56.449 1.00 0.00 H ATOM 4468 C12 OL 168 44.384 61.499 50.602 1.00 0.00 C ATOM 4469 H2R OL 168 43.984 62.263 51.271 1.00 0.00 H ATOM 4470 H2S OL 168 45.459 61.508 50.791 1.00 0.00 H ATOM 4471 C13 OL 168 44.122 61.680 49.086 1.00 0.00 C ATOM 4472 H3R OL 168 44.533 60.831 48.535 1.00 0.00 H ATOM 4473 H3S OL 168 43.062 61.715 48.829 1.00 0.00 H ATOM 4474 C14 OL 168 44.863 62.927 48.593 1.00 0.00 C ATOM 4475 H4R OL 168 45.900 62.894 48.934 1.00 0.00 H ATOM 4476 H4S OL 168 44.886 62.745 47.517 1.00 0.00 H ATOM 4477 C15 OL 168 44.200 64.277 48.915 1.00 0.00 C ATOM 4478 H5R OL 168 43.205 64.366 48.475 1.00 0.00 H ATOM 4479 H5S OL 168 43.969 64.286 49.983 1.00 0.00 H ATOM 4480 C16 OL 168 44.996 65.506 48.545 1.00 0.00 C ATOM 4481 H6R OL 168 44.390 66.381 48.786 1.00 0.00 H ATOM 4482 H6S OL 168 45.944 65.525 49.087 1.00 0.00 H ATOM 4483 C17 OL 168 45.306 65.628 47.028 1.00 0.00 C ATOM 4484 H7R OL 168 46.392 65.618 46.906 1.00 0.00 H ATOM 4485 H7S OL 168 44.903 64.792 46.452 1.00 0.00 H ATOM 4486 C18 OL 168 44.731 66.922 46.447 1.00 0.00 C ATOM 4487 H8R OL 168 43.676 67.064 46.689 1.00 0.00 H ATOM 4488 H8S OL 168 45.396 67.665 46.892 1.00 0.00 H ATOM 4489 C19 OL 168 44.976 67.134 44.985 1.00 0.00 C ATOM 4490 H9R OL 168 46.020 67.009 44.710 1.00 0.00 H ATOM 4491 C110 OL 168 44.158 67.331 43.952 1.00 0.00 C ATOM 4492 H10R OL 168 44.522 67.451 42.935 1.00 0.00 H ATOM 4493 C111 OL 168 42.610 67.332 44.096 1.00 0.00 C ATOM 4494 H11R OL 168 42.059 66.910 43.253 1.00 0.00 H ATOM 4495 H11S OL 168 42.282 66.650 44.883 1.00 0.00 H ATOM 4496 C112 OL 168 42.047 68.751 44.518 1.00 0.00 C ATOM 4497 H12R OL 168 42.627 69.160 45.348 1.00 0.00 H ATOM 4498 H12S OL 168 42.337 69.386 43.678 1.00 0.00 H ATOM 4499 C113 OL 168 40.541 68.761 44.784 1.00 0.00 C ATOM 4500 H13R OL 168 39.940 68.639 43.881 1.00 0.00 H ATOM 4501 H13S OL 168 40.292 67.909 45.420 1.00 0.00 H ATOM 4502 C114 OL 168 40.218 70.055 45.425 1.00 0.00 C ATOM 4503 H14R OL 168 40.607 70.144 46.441 1.00 0.00 H ATOM 4504 H14S OL 168 40.677 70.888 44.888 1.00 0.00 H ATOM 4505 C115 OL 168 38.662 70.173 45.469 1.00 0.00 C ATOM 4506 H15R OL 168 38.172 69.641 44.651 1.00 0.00 H ATOM 4507 H15S OL 168 38.274 69.550 46.277 1.00 0.00 H ATOM 4508 C116 OL 168 38.133 71.609 45.673 1.00 0.00 C ATOM 4509 H16R OL 168 38.356 71.994 46.670 1.00 0.00 H ATOM 4510 H16S OL 168 38.584 72.269 44.929 1.00 0.00 H ATOM 4511 C117 OL 168 36.625 71.648 45.364 1.00 0.00 C ATOM 4512 H17R OL 168 36.162 70.915 46.029 1.00 0.00 H ATOM 4513 H17S OL 168 36.416 72.689 45.619 1.00 0.00 H ATOM 4514 C118 OL 168 36.318 71.252 43.915 1.00 0.00 C ATOM 4515 H18R OL 168 35.226 71.276 43.929 1.00 0.00 H ATOM 4516 H18S OL 168 36.700 70.315 43.506 1.00 0.00 H ATOM 4517 H18T OL 168 36.421 72.087 43.219 1.00 0.00 H TER 4518 OL 168 ATOM 4518 C116 PA 169 123.307 13.822 35.129 1.00 0.00 C ATOM 4519 H16R PA 169 124.283 14.050 34.697 1.00 0.00 H ATOM 4520 H16S PA 169 122.431 14.301 34.686 1.00 0.00 H ATOM 4521 H16T PA 169 123.129 12.744 35.125 1.00 0.00 H ATOM 4522 C115 PA 169 123.291 14.346 36.573 1.00 0.00 C ATOM 4523 H15R PA 169 122.389 13.967 37.058 1.00 0.00 H ATOM 4524 H15S PA 169 123.067 15.406 36.435 1.00 0.00 H ATOM 4525 C114 PA 169 124.579 14.179 37.309 1.00 0.00 C ATOM 4526 H14R PA 169 125.422 14.445 36.668 1.00 0.00 H ATOM 4527 H14S PA 169 124.674 13.130 37.597 1.00 0.00 H ATOM 4528 C113 PA 169 124.598 14.824 38.615 1.00 0.00 C ATOM 4529 H13R PA 169 123.670 14.543 39.118 1.00 0.00 H ATOM 4530 H13S PA 169 124.509 15.910 38.553 1.00 0.00 H ATOM 4531 C112 PA 169 125.954 14.449 39.310 1.00 0.00 C ATOM 4532 H12R PA 169 126.814 14.900 38.809 1.00 0.00 H ATOM 4533 H12S PA 169 126.071 13.368 39.214 1.00 0.00 H ATOM 4534 C111 PA 169 126.023 14.862 40.789 1.00 0.00 C ATOM 4535 H11R PA 169 127.051 14.715 41.126 1.00 0.00 H ATOM 4536 H11S PA 169 125.391 14.154 41.329 1.00 0.00 H ATOM 4537 C110 PA 169 125.704 16.278 41.007 1.00 0.00 C ATOM 4538 H10R PA 169 124.907 16.611 40.339 1.00 0.00 H ATOM 4539 H10S PA 169 126.627 16.761 40.680 1.00 0.00 H ATOM 4540 C19 PA 169 125.371 16.700 42.397 1.00 0.00 C ATOM 4541 H9R PA 169 124.447 16.204 42.700 1.00 0.00 H ATOM 4542 H9S PA 169 125.130 17.759 42.279 1.00 0.00 H ATOM 4543 C18 PA 169 126.485 16.450 43.402 1.00 0.00 C ATOM 4544 H8R PA 169 127.317 17.115 43.164 1.00 0.00 H ATOM 4545 H8S PA 169 126.948 15.467 43.286 1.00 0.00 H ATOM 4546 C17 PA 169 126.046 16.688 44.873 1.00 0.00 C ATOM 4547 H7R PA 169 125.196 16.037 45.088 1.00 0.00 H ATOM 4548 H7S PA 169 125.699 17.687 45.144 1.00 0.00 H ATOM 4549 C16 PA 169 127.111 16.240 45.860 1.00 0.00 C ATOM 4550 H6R PA 169 128.106 16.514 45.503 1.00 0.00 H ATOM 4551 H6S PA 169 127.197 15.155 45.940 1.00 0.00 H ATOM 4552 C15 PA 169 126.999 16.807 47.286 1.00 0.00 C ATOM 4553 H5R PA 169 125.939 16.708 47.529 1.00 0.00 H ATOM 4554 H5S PA 169 126.993 17.897 47.342 1.00 0.00 H ATOM 4555 C14 PA 169 127.930 16.156 48.283 1.00 0.00 C ATOM 4556 H4R PA 169 128.934 16.167 47.853 1.00 0.00 H ATOM 4557 H4S PA 169 127.601 15.124 48.424 1.00 0.00 H ATOM 4558 C13 PA 169 127.930 16.930 49.574 1.00 0.00 C ATOM 4559 H3R PA 169 126.908 16.871 49.954 1.00 0.00 H ATOM 4560 H3S PA 169 128.054 17.966 49.250 1.00 0.00 H ATOM 4561 C12 PA 169 128.942 16.548 50.644 1.00 0.00 C ATOM 4562 H2R PA 169 129.970 16.540 50.274 1.00 0.00 H ATOM 4563 H2S PA 169 128.957 15.481 50.878 1.00 0.00 H ATOM 4564 C11 PGR 170 128.826 17.371 51.899 1.00 0.00 C ATOM 4565 O12 PGR 170 127.806 17.537 52.560 1.00 0.00 O ATOM 4566 O11 PGR 170 130.009 17.815 52.238 1.00 0.00 O ATOM 4567 C1 PGR 170 130.164 18.565 53.502 1.00 0.00 C ATOM 4568 HR PGR 170 129.591 18.158 54.339 1.00 0.00 H ATOM 4569 HS PGR 170 129.904 19.609 53.312 1.00 0.00 H ATOM 4570 C2 PGR 170 131.649 18.530 53.755 1.00 0.00 C ATOM 4571 HX PGR 170 132.190 17.661 53.371 1.00 0.00 H ATOM 4572 C3 PGR 170 131.958 18.620 55.214 1.00 0.00 C ATOM 4573 HA PGR 170 133.035 18.561 55.396 1.00 0.00 H ATOM 4574 HB PGR 170 131.584 17.763 55.779 1.00 0.00 H ATOM 4575 O31 PGR 170 131.516 19.872 55.774 1.00 0.00 O ATOM 4576 P31 PGR 170 131.312 20.068 57.312 1.00 0.00 P ATOM 4577 O32 PGR 170 132.757 20.549 57.676 1.00 0.00 O ATOM 4578 C31 PGR 170 133.296 21.667 56.985 1.00 0.00 C ATOM 4579 H1A PGR 170 132.676 22.542 57.195 1.00 0.00 H ATOM 4580 H1B PGR 170 133.297 21.452 55.914 1.00 0.00 H ATOM 4581 C32 PGR 170 134.739 21.978 57.385 1.00 0.00 C ATOM 4582 H2A PGR 170 135.211 21.015 57.592 1.00 0.00 H ATOM 4583 O35 PGR 170 134.940 22.675 58.599 1.00 0.00 O ATOM 4584 HO5A PGR 170 135.782 23.122 58.397 1.00 0.00 H ATOM 4585 C33 PGR 170 135.482 22.761 56.283 1.00 0.00 C ATOM 4586 H3A PGR 170 135.744 22.046 55.499 1.00 0.00 H ATOM 4587 H3B PGR 170 134.809 23.537 55.912 1.00 0.00 H ATOM 4588 O33 PGR 170 130.341 21.172 57.446 1.00 0.00 O ATOM 4589 O34 PGR 170 131.062 18.792 58.041 1.00 0.00 O ATOM 4590 O21 PGR 170 132.091 19.706 53.164 1.00 0.00 O ATOM 4591 C21 PGR 170 133.395 19.857 52.780 1.00 0.00 C ATOM 4592 O22 PGR 170 134.230 19.002 52.932 1.00 0.00 O ATOM 4593 O36 PGR 170 136.670 23.373 56.879 1.00 0.00 O ATOM 4594 HO6A PGR 170 137.345 22.678 56.982 1.00 0.00 H ATOM 4595 C12 OL 171 133.694 21.018 51.925 1.00 0.00 C ATOM 4596 H2R OL 171 133.935 20.606 50.943 1.00 0.00 H ATOM 4597 H2S OL 171 132.858 21.604 51.537 1.00 0.00 H ATOM 4598 C13 OL 171 134.877 21.822 52.449 1.00 0.00 C ATOM 4599 H3R OL 171 134.605 22.281 53.402 1.00 0.00 H ATOM 4600 H3S OL 171 135.642 21.116 52.777 1.00 0.00 H ATOM 4601 C14 OL 171 135.397 22.881 51.491 1.00 0.00 C ATOM 4602 H4R OL 171 135.476 22.345 50.543 1.00 0.00 H ATOM 4603 H4S OL 171 134.713 23.714 51.314 1.00 0.00 H ATOM 4604 C15 OL 171 136.779 23.344 51.953 1.00 0.00 C ATOM 4605 H5R OL 171 136.710 24.019 52.809 1.00 0.00 H ATOM 4606 H5S OL 171 137.372 22.467 52.219 1.00 0.00 H ATOM 4607 C16 OL 171 137.613 23.998 50.892 1.00 0.00 C ATOM 4608 H6R OL 171 138.673 23.843 51.102 1.00 0.00 H ATOM 4609 H6S OL 171 137.537 23.575 49.888 1.00 0.00 H ATOM 4610 C17 OL 171 137.366 25.417 50.716 1.00 0.00 C ATOM 4611 H7R OL 171 136.331 25.596 50.419 1.00 0.00 H ATOM 4612 H7S OL 171 137.439 25.935 51.674 1.00 0.00 H ATOM 4613 C18 OL 171 138.282 26.210 49.767 1.00 0.00 C ATOM 4614 H8R OL 171 138.284 25.571 48.882 1.00 0.00 H ATOM 4615 H8S OL 171 137.810 27.176 49.575 1.00 0.00 H ATOM 4616 C19 OL 171 139.668 26.365 50.352 1.00 0.00 C ATOM 4617 H9R OL 171 139.748 26.450 51.433 1.00 0.00 H ATOM 4618 C110 OL 171 140.838 26.323 49.688 1.00 0.00 C ATOM 4619 H10R OL 171 141.742 26.511 50.262 1.00 0.00 H ATOM 4620 C111 OL 171 141.000 25.975 48.217 1.00 0.00 C ATOM 4621 H11R OL 171 140.199 26.449 47.646 1.00 0.00 H ATOM 4622 H11S OL 171 141.945 26.467 47.979 1.00 0.00 H ATOM 4623 C112 OL 171 141.094 24.516 47.920 1.00 0.00 C ATOM 4624 H12R OL 171 141.876 24.069 48.538 1.00 0.00 H ATOM 4625 H12S OL 171 140.100 24.150 48.187 1.00 0.00 H ATOM 4626 C113 OL 171 141.358 24.278 46.405 1.00 0.00 C ATOM 4627 H13R OL 171 141.286 23.189 46.378 1.00 0.00 H ATOM 4628 H13S OL 171 140.506 24.652 45.834 1.00 0.00 H ATOM 4629 C114 OL 171 142.577 24.828 45.738 1.00 0.00 C ATOM 4630 H14R OL 171 142.289 25.545 44.966 1.00 0.00 H ATOM 4631 H14S OL 171 143.332 25.367 46.315 1.00 0.00 H ATOM 4632 C115 OL 171 143.416 23.692 45.134 1.00 0.00 C ATOM 4633 H15R OL 171 143.851 23.121 45.957 1.00 0.00 H ATOM 4634 H15S OL 171 142.751 23.013 44.596 1.00 0.00 H ATOM 4635 C116 OL 171 144.406 24.209 44.122 1.00 0.00 C ATOM 4636 H16R OL 171 143.719 24.575 43.356 1.00 0.00 H ATOM 4637 H16S OL 171 145.001 25.077 44.412 1.00 0.00 H ATOM 4638 C117 OL 171 145.465 23.150 43.629 1.00 0.00 C ATOM 4639 H17R OL 171 145.040 22.241 43.198 1.00 0.00 H ATOM 4640 H17S OL 171 145.916 23.675 42.784 1.00 0.00 H ATOM 4641 C118 OL 171 146.549 22.782 44.639 1.00 0.00 C ATOM 4642 H18R OL 171 147.303 23.487 44.998 1.00 0.00 H ATOM 4643 H18S OL 171 147.115 21.866 44.459 1.00 0.00 H ATOM 4644 H18T OL 171 146.095 22.349 45.532 1.00 0.00 H TER 4645 OL 171 ATOM 4645 C116 PA 172 94.610 82.344 45.970 1.00 0.00 C ATOM 4646 H16R PA 172 93.991 81.655 46.548 1.00 0.00 H ATOM 4647 H16S PA 172 94.040 82.835 45.179 1.00 0.00 H ATOM 4648 H16T PA 172 94.950 82.995 46.777 1.00 0.00 H ATOM 4649 C115 PA 172 95.789 81.833 45.263 1.00 0.00 C ATOM 4650 H15R PA 172 96.071 82.520 44.462 1.00 0.00 H ATOM 4651 H15S PA 172 95.508 80.954 44.679 1.00 0.00 H ATOM 4652 C114 PA 172 96.878 81.359 46.007 1.00 0.00 C ATOM 4653 H14R PA 172 96.523 80.757 46.847 1.00 0.00 H ATOM 4654 H14S PA 172 97.367 82.226 46.455 1.00 0.00 H ATOM 4655 C113 PA 172 97.973 80.685 45.178 1.00 0.00 C ATOM 4656 H13R PA 172 98.535 81.405 44.580 1.00 0.00 H ATOM 4657 H13S PA 172 97.489 80.026 44.453 1.00 0.00 H ATOM 4658 C112 PA 172 98.929 79.934 46.079 1.00 0.00 C ATOM 4659 H12R PA 172 99.501 79.211 45.493 1.00 0.00 H ATOM 4660 H12S PA 172 98.389 79.310 46.794 1.00 0.00 H ATOM 4661 C111 PA 172 99.919 80.773 46.868 1.00 0.00 C ATOM 4662 H11R PA 172 99.389 81.711 47.048 1.00 0.00 H ATOM 4663 H11S PA 172 100.728 81.020 46.177 1.00 0.00 H ATOM 4664 C110 PA 172 100.512 80.106 48.085 1.00 0.00 C ATOM 4665 H10R PA 172 101.333 80.738 48.429 1.00 0.00 H ATOM 4666 H10S PA 172 101.051 79.180 47.874 1.00 0.00 H ATOM 4667 C19 PA 172 99.465 79.938 49.265 1.00 0.00 C ATOM 4668 H9R PA 172 98.404 80.023 49.022 1.00 0.00 H ATOM 4669 H9S PA 172 99.595 80.783 49.944 1.00 0.00 H ATOM 4670 C18 PA 172 99.450 78.496 49.867 1.00 0.00 C ATOM 4671 H8R PA 172 100.434 78.249 50.270 1.00 0.00 H ATOM 4672 H8S PA 172 99.140 77.778 49.105 1.00 0.00 H ATOM 4673 C17 PA 172 98.455 78.421 51.080 1.00 0.00 C ATOM 4674 H7R PA 172 98.423 77.390 51.437 1.00 0.00 H ATOM 4675 H7S PA 172 97.437 78.635 50.747 1.00 0.00 H ATOM 4676 C16 PA 172 98.943 79.274 52.236 1.00 0.00 C ATOM 4677 H6R PA 172 99.084 80.313 51.929 1.00 0.00 H ATOM 4678 H6S PA 172 99.849 78.892 52.710 1.00 0.00 H ATOM 4679 C15 PA 172 97.921 79.360 53.478 1.00 0.00 C ATOM 4680 H5R PA 172 97.748 78.347 53.849 1.00 0.00 H ATOM 4681 H5S PA 172 96.964 79.760 53.137 1.00 0.00 H ATOM 4682 C14 PA 172 98.421 80.168 54.680 1.00 0.00 C ATOM 4683 H4R PA 172 97.624 80.511 55.344 1.00 0.00 H ATOM 4684 H4S PA 172 98.722 81.158 54.330 1.00 0.00 H ATOM 4685 C13 PA 172 99.497 79.470 55.622 1.00 0.00 C ATOM 4686 H3R PA 172 100.151 80.109 56.218 1.00 0.00 H ATOM 4687 H3S PA 172 100.144 79.009 54.873 1.00 0.00 H ATOM 4688 C12 PA 172 99.037 78.268 56.430 1.00 0.00 C ATOM 4689 H2R PA 172 99.735 77.816 57.137 1.00 0.00 H ATOM 4690 H2S PA 172 98.887 77.431 55.745 1.00 0.00 H ATOM 4691 C11 PGR 173 97.778 78.609 57.205 1.00 0.00 C ATOM 4692 O12 PGR 173 97.550 79.533 57.919 1.00 0.00 O ATOM 4693 O11 PGR 173 96.981 77.485 57.096 1.00 0.00 O ATOM 4694 C1 PGR 173 95.703 77.485 57.825 1.00 0.00 C ATOM 4695 HR PGR 173 95.872 77.793 58.860 1.00 0.00 H ATOM 4696 HS PGR 173 95.318 76.465 57.906 1.00 0.00 H ATOM 4697 C2 PGR 173 94.670 78.488 57.188 1.00 0.00 C ATOM 4698 HX PGR 173 95.038 79.517 57.211 1.00 0.00 H ATOM 4699 C3 PGR 173 93.408 78.315 57.988 1.00 0.00 C ATOM 4700 HA PGR 173 93.524 78.633 59.027 1.00 0.00 H ATOM 4701 HB PGR 173 92.979 77.313 57.913 1.00 0.00 H ATOM 4702 O31 PGR 173 92.485 79.345 57.614 1.00 0.00 O ATOM 4703 P31 PGR 173 91.022 79.398 58.228 1.00 0.00 P ATOM 4704 O32 PGR 173 90.383 78.013 57.685 1.00 0.00 O ATOM 4705 C31 PGR 173 90.407 77.653 56.270 1.00 0.00 C ATOM 4706 H1A PGR 173 91.049 76.769 56.247 1.00 0.00 H ATOM 4707 H1B PGR 173 90.879 78.400 55.625 1.00 0.00 H ATOM 4708 C32 PGR 173 88.982 77.310 55.607 1.00 0.00 C ATOM 4709 H2A PGR 173 88.318 78.170 55.722 1.00 0.00 H ATOM 4710 O35 PGR 173 88.416 76.108 56.223 1.00 0.00 O ATOM 4711 HO5A PGR 173 88.560 76.249 57.176 1.00 0.00 H ATOM 4712 C33 PGR 173 89.121 77.110 54.095 1.00 0.00 C ATOM 4713 H3A PGR 173 88.119 76.901 53.712 1.00 0.00 H ATOM 4714 H3B PGR 173 89.431 77.982 53.514 1.00 0.00 H ATOM 4715 O33 PGR 173 91.193 79.416 59.690 1.00 0.00 O ATOM 4716 O34 PGR 173 90.278 80.554 57.607 1.00 0.00 O ATOM 4717 O21 PGR 173 94.432 78.121 55.874 1.00 0.00 O ATOM 4718 C21 PGR 173 93.576 78.856 55.127 1.00 0.00 C ATOM 4719 O22 PGR 173 93.305 80.017 55.309 1.00 0.00 O ATOM 4720 O36 PGR 173 90.022 76.025 53.810 1.00 0.00 O ATOM 4721 HO6A PGR 173 89.674 75.192 54.176 1.00 0.00 H ATOM 4722 C12 OL 174 93.054 78.135 53.882 1.00 0.00 C ATOM 4723 H2R OL 174 93.924 77.771 53.330 1.00 0.00 H ATOM 4724 H2S OL 174 92.606 77.195 54.211 1.00 0.00 H ATOM 4725 C13 OL 174 92.129 78.951 52.926 1.00 0.00 C ATOM 4726 H3R OL 174 91.539 78.285 52.293 1.00 0.00 H ATOM 4727 H3S OL 174 91.353 79.461 53.501 1.00 0.00 H ATOM 4728 C14 OL 174 92.898 79.985 51.997 1.00 0.00 C ATOM 4729 H4R OL 174 92.120 80.382 51.341 1.00 0.00 H ATOM 4730 H4S OL 174 93.298 80.788 52.618 1.00 0.00 H ATOM 4731 C15 OL 174 93.972 79.476 50.900 1.00 0.00 C ATOM 4732 H5R OL 174 94.765 78.931 51.417 1.00 0.00 H ATOM 4733 H5S OL 174 93.512 78.707 50.277 1.00 0.00 H ATOM 4734 C16 OL 174 94.611 80.474 49.907 1.00 0.00 C ATOM 4735 H6R OL 174 95.423 79.935 49.416 1.00 0.00 H ATOM 4736 H6S OL 174 93.826 80.752 49.201 1.00 0.00 H ATOM 4737 C17 OL 174 95.015 81.795 50.661 1.00 0.00 C ATOM 4738 H7R OL 174 94.130 82.434 50.703 1.00 0.00 H ATOM 4739 H7S OL 174 95.308 81.531 51.680 1.00 0.00 H ATOM 4740 C18 OL 174 96.074 82.653 49.992 1.00 0.00 C ATOM 4741 H8R OL 174 96.963 82.034 50.128 1.00 0.00 H ATOM 4742 H8S OL 174 95.820 82.630 48.930 1.00 0.00 H ATOM 4743 C19 OL 174 96.223 84.046 50.542 1.00 0.00 C ATOM 4744 H9R OL 174 96.338 84.073 51.622 1.00 0.00 H ATOM 4745 C110 OL 174 96.061 85.176 49.863 1.00 0.00 C ATOM 4746 H10R OL 174 96.070 86.142 50.361 1.00 0.00 H ATOM 4747 C111 OL 174 95.687 85.277 48.413 1.00 0.00 C ATOM 4748 H11R OL 174 95.140 84.364 48.167 1.00 0.00 H ATOM 4749 H11S OL 174 95.111 86.161 48.133 1.00 0.00 H ATOM 4750 C112 OL 174 97.055 85.185 47.635 1.00 0.00 C ATOM 4751 H12R OL 174 97.904 85.568 48.206 1.00 0.00 H ATOM 4752 H12S OL 174 97.396 84.148 47.619 1.00 0.00 H ATOM 4753 C113 OL 174 97.179 85.637 46.172 1.00 0.00 C ATOM 4754 H13R OL 174 98.139 85.381 45.719 1.00 0.00 H ATOM 4755 H13S OL 174 96.366 85.132 45.646 1.00 0.00 H ATOM 4756 C114 OL 174 96.985 87.118 45.863 1.00 0.00 C ATOM 4757 H14R OL 174 96.870 87.307 44.793 1.00 0.00 H ATOM 4758 H14S OL 174 96.038 87.466 46.281 1.00 0.00 H ATOM 4759 C115 OL 174 98.161 88.034 46.269 1.00 0.00 C ATOM 4760 H15R OL 174 97.755 89.030 46.080 1.00 0.00 H ATOM 4761 H15S OL 174 98.367 88.002 47.341 1.00 0.00 H ATOM 4762 C116 OL 174 99.513 87.853 45.544 1.00 0.00 C ATOM 4763 H16R OL 174 99.838 86.813 45.467 1.00 0.00 H ATOM 4764 H16S OL 174 99.367 88.200 44.519 1.00 0.00 H ATOM 4765 C117 OL 174 100.570 88.646 46.365 1.00 0.00 C ATOM 4766 H17R OL 174 100.134 89.539 46.819 1.00 0.00 H ATOM 4767 H17S OL 174 100.793 87.965 47.189 1.00 0.00 H ATOM 4768 C118 OL 174 101.973 89.051 45.793 1.00 0.00 C ATOM 4769 H18R OL 174 102.444 88.183 45.328 1.00 0.00 H ATOM 4770 H18S OL 174 102.570 89.403 46.637 1.00 0.00 H ATOM 4771 H18T OL 174 101.877 89.885 45.094 1.00 0.00 H TER 4772 OL 174 ATOM 4772 C116 PA 175 68.181 62.603 44.064 1.00 0.00 C ATOM 4773 H16R PA 175 67.892 61.654 44.520 1.00 0.00 H ATOM 4774 H16S PA 175 68.167 62.218 43.042 1.00 0.00 H ATOM 4775 H16T PA 175 67.429 63.359 44.300 1.00 0.00 H ATOM 4776 C115 PA 175 69.630 63.013 44.254 1.00 0.00 C ATOM 4777 H15R PA 175 69.854 63.785 43.515 1.00 0.00 H ATOM 4778 H15S PA 175 70.293 62.169 44.054 1.00 0.00 H ATOM 4779 C114 PA 175 70.026 63.592 45.615 1.00 0.00 C ATOM 4780 H14R PA 175 69.486 64.541 45.588 1.00 0.00 H ATOM 4781 H14S PA 175 71.079 63.879 45.565 1.00 0.00 H ATOM 4782 C113 PA 175 69.738 62.719 46.837 1.00 0.00 C ATOM 4783 H13R PA 175 70.290 61.791 46.672 1.00 0.00 H ATOM 4784 H13S PA 175 68.671 62.493 46.882 1.00 0.00 H ATOM 4785 C112 PA 175 70.163 63.400 48.112 1.00 0.00 C ATOM 4786 H12R PA 175 69.522 64.248 48.364 1.00 0.00 H ATOM 4787 H12S PA 175 71.180 63.786 48.010 1.00 0.00 H ATOM 4788 C111 PA 175 70.137 62.475 49.334 1.00 0.00 C ATOM 4789 H11R PA 175 70.875 61.675 49.250 1.00 0.00 H ATOM 4790 H11S PA 175 69.233 61.869 49.424 1.00 0.00 H ATOM 4791 C110 PA 175 70.466 63.271 50.615 1.00 0.00 C ATOM 4792 H10R PA 175 70.048 62.579 51.348 1.00 0.00 H ATOM 4793 H10S PA 175 69.776 64.117 50.634 1.00 0.00 H ATOM 4794 C19 PA 175 71.890 63.727 50.861 1.00 0.00 C ATOM 4795 H9R PA 175 71.891 64.610 50.218 1.00 0.00 H ATOM 4796 H9S PA 175 72.736 63.120 50.532 1.00 0.00 H ATOM 4797 C18 PA 175 72.116 64.148 52.281 1.00 0.00 C ATOM 4798 H8R PA 175 72.030 63.166 52.751 1.00 0.00 H ATOM 4799 H8S PA 175 71.293 64.769 52.641 1.00 0.00 H ATOM 4800 C17 PA 175 73.426 64.883 52.563 1.00 0.00 C ATOM 4801 H7R PA 175 73.435 65.699 51.838 1.00 0.00 H ATOM 4802 H7S PA 175 74.297 64.327 52.210 1.00 0.00 H ATOM 4803 C16 PA 175 73.811 65.407 53.933 1.00 0.00 C ATOM 4804 H6R PA 175 74.750 65.950 53.810 1.00 0.00 H ATOM 4805 H6S PA 175 73.964 64.639 54.694 1.00 0.00 H ATOM 4806 C15 PA 175 72.791 66.298 54.611 1.00 0.00 C ATOM 4807 H5R PA 175 71.927 65.633 54.662 1.00 0.00 H ATOM 4808 H5S PA 175 72.364 67.102 54.007 1.00 0.00 H ATOM 4809 C14 PA 175 73.226 66.912 55.912 1.00 0.00 C ATOM 4810 H4R PA 175 73.899 66.227 56.431 1.00 0.00 H ATOM 4811 H4S PA 175 72.451 66.966 56.679 1.00 0.00 H ATOM 4812 C13 PA 175 74.116 68.204 55.838 1.00 0.00 C ATOM 4813 H3R PA 175 73.524 69.107 55.673 1.00 0.00 H ATOM 4814 H3S PA 175 74.985 68.160 55.179 1.00 0.00 H ATOM 4815 C12 PA 175 74.762 68.592 57.252 1.00 0.00 C ATOM 4816 H2R PA 175 75.465 69.413 57.095 1.00 0.00 H ATOM 4817 H2S PA 175 75.260 67.688 57.607 1.00 0.00 H ATOM 4818 C11 PGR 176 73.759 69.071 58.303 1.00 0.00 C ATOM 4819 O12 PGR 176 74.156 69.126 59.449 1.00 0.00 O ATOM 4820 O11 PGR 176 72.518 69.310 57.953 1.00 0.00 O ATOM 4821 C1 PGR 176 71.591 70.062 58.881 1.00 0.00 C ATOM 4822 HR PGR 176 71.541 69.480 59.805 1.00 0.00 H ATOM 4823 HS PGR 176 70.650 70.165 58.335 1.00 0.00 H ATOM 4824 C2 PGR 176 72.095 71.518 59.113 1.00 0.00 C ATOM 4825 HX PGR 176 73.177 71.472 59.260 1.00 0.00 H ATOM 4826 C3 PGR 176 71.409 72.240 60.337 1.00 0.00 C ATOM 4827 HA PGR 176 71.404 73.328 60.241 1.00 0.00 H ATOM 4828 HB PGR 176 71.950 71.999 61.255 1.00 0.00 H ATOM 4829 O31 PGR 176 70.104 71.778 60.457 1.00 0.00 O ATOM 4830 P31 PGR 176 69.005 72.672 61.331 1.00 0.00 P ATOM 4831 O32 PGR 176 69.133 74.059 60.517 1.00 0.00 O ATOM 4832 C31 PGR 176 68.814 74.114 59.183 1.00 0.00 C ATOM 4833 H1A PGR 176 67.811 73.694 59.066 1.00 0.00 H ATOM 4834 H1B PGR 176 69.506 73.460 58.646 1.00 0.00 H ATOM 4835 C32 PGR 176 68.939 75.605 58.617 1.00 0.00 C ATOM 4836 H2A PGR 176 68.796 75.565 57.534 1.00 0.00 H ATOM 4837 O35 PGR 176 70.261 76.203 58.872 1.00 0.00 O ATOM 4838 HO5A PGR 176 70.507 75.544 59.545 1.00 0.00 H ATOM 4839 C33 PGR 176 67.728 76.442 59.194 1.00 0.00 C ATOM 4840 H3A PGR 176 66.819 75.930 58.868 1.00 0.00 H ATOM 4841 H3B PGR 176 67.733 76.465 60.287 1.00 0.00 H ATOM 4842 O33 PGR 176 67.653 72.139 61.025 1.00 0.00 O ATOM 4843 O34 PGR 176 69.466 72.800 62.710 1.00 0.00 O ATOM 4844 O21 PGR 176 71.855 72.284 57.901 1.00 0.00 O ATOM 4845 C21 PGR 176 72.606 72.179 56.766 1.00 0.00 C ATOM 4846 O22 PGR 176 73.791 71.785 56.774 1.00 0.00 O ATOM 4847 O36 PGR 176 67.772 77.770 58.661 1.00 0.00 O ATOM 4848 HO6A PGR 176 66.902 78.205 58.608 1.00 0.00 H ATOM 4849 C12 OL 177 71.766 72.556 55.483 1.00 0.00 C ATOM 4850 H2R OL 177 71.449 73.601 55.496 1.00 0.00 H ATOM 4851 H2S OL 177 72.334 72.357 54.571 1.00 0.00 H ATOM 4852 C13 OL 177 70.524 71.648 55.416 1.00 0.00 C ATOM 4853 H3R OL 177 70.781 70.589 55.356 1.00 0.00 H ATOM 4854 H3S OL 177 69.940 71.885 56.308 1.00 0.00 H ATOM 4855 C14 OL 177 69.689 72.098 54.241 1.00 0.00 C ATOM 4856 H4R OL 177 69.345 73.117 54.431 1.00 0.00 H ATOM 4857 H4S OL 177 70.367 72.006 53.390 1.00 0.00 H ATOM 4858 C15 OL 177 68.509 71.201 54.155 1.00 0.00 C ATOM 4859 H5R OL 177 68.860 70.253 53.740 1.00 0.00 H ATOM 4860 H5S OL 177 68.052 71.064 55.137 1.00 0.00 H ATOM 4861 C16 OL 177 67.437 71.741 53.182 1.00 0.00 C ATOM 4862 H6R OL 177 67.415 72.833 53.176 1.00 0.00 H ATOM 4863 H6S OL 177 67.885 71.608 52.195 1.00 0.00 H ATOM 4864 C17 OL 177 66.101 70.982 53.166 1.00 0.00 C ATOM 4865 H7R OL 177 65.679 71.202 54.149 1.00 0.00 H ATOM 4866 H7S OL 177 65.464 71.375 52.371 1.00 0.00 H ATOM 4867 C18 OL 177 66.269 69.485 53.110 1.00 0.00 C ATOM 4868 H8R OL 177 67.044 69.109 53.782 1.00 0.00 H ATOM 4869 H8S OL 177 65.355 69.000 53.457 1.00 0.00 H ATOM 4870 C19 OL 177 66.539 69.211 51.665 1.00 0.00 C ATOM 4871 H9R OL 177 67.549 68.975 51.340 1.00 0.00 H ATOM 4872 C110 OL 177 65.661 69.053 50.695 1.00 0.00 C ATOM 4873 H10R OL 177 66.071 68.629 49.782 1.00 0.00 H ATOM 4874 C111 OL 177 64.209 69.405 50.687 1.00 0.00 C ATOM 4875 H11R OL 177 63.799 69.461 51.698 1.00 0.00 H ATOM 4876 H11S OL 177 63.963 70.380 50.260 1.00 0.00 H ATOM 4877 C112 OL 177 63.560 68.238 49.946 1.00 0.00 C ATOM 4878 H12R OL 177 63.970 68.124 48.941 1.00 0.00 H ATOM 4879 H12S OL 177 63.820 67.351 50.529 1.00 0.00 H ATOM 4880 C113 OL 177 62.110 68.439 49.824 1.00 0.00 C ATOM 4881 H13R OL 177 61.887 69.496 49.664 1.00 0.00 H ATOM 4882 H13S OL 177 61.877 68.093 48.815 1.00 0.00 H ATOM 4883 C114 OL 177 61.302 67.873 51.055 1.00 0.00 C ATOM 4884 H14R OL 177 61.337 66.784 51.129 1.00 0.00 H ATOM 4885 H14S OL 177 61.721 68.170 52.019 1.00 0.00 H ATOM 4886 C115 OL 177 59.803 68.156 51.006 1.00 0.00 C ATOM 4887 H15R OL 177 59.436 68.431 51.997 1.00 0.00 H ATOM 4888 H15S OL 177 59.610 69.010 50.354 1.00 0.00 H ATOM 4889 C116 OL 177 58.974 67.049 50.543 1.00 0.00 C ATOM 4890 H16R OL 177 59.039 67.026 49.453 1.00 0.00 H ATOM 4891 H16S OL 177 59.266 66.114 51.024 1.00 0.00 H ATOM 4892 C117 OL 177 57.457 67.229 50.861 1.00 0.00 C ATOM 4893 H17R OL 177 57.144 68.070 50.239 1.00 0.00 H ATOM 4894 H17S OL 177 56.863 66.458 50.366 1.00 0.00 H ATOM 4895 C118 OL 177 57.059 67.430 52.261 1.00 0.00 C ATOM 4896 H18R OL 177 55.967 67.414 52.273 1.00 0.00 H ATOM 4897 H18S OL 177 57.345 68.422 52.617 1.00 0.00 H ATOM 4898 H18T OL 177 57.259 66.655 53.003 1.00 0.00 H TER 4899 OL 177 ATOM 4899 C116 PA 178 22.386 90.195 43.763 1.00 0.00 C ATOM 4900 H16R PA 178 22.111 90.366 42.720 1.00 0.00 H ATOM 4901 H16S PA 178 23.464 90.024 43.727 1.00 0.00 H ATOM 4902 H16T PA 178 22.283 91.126 44.325 1.00 0.00 H ATOM 4903 C115 PA 178 21.541 89.105 44.375 1.00 0.00 C ATOM 4904 H15R PA 178 21.481 88.356 43.582 1.00 0.00 H ATOM 4905 H15S PA 178 20.503 89.440 44.436 1.00 0.00 H ATOM 4906 C114 PA 178 22.112 88.604 45.753 1.00 0.00 C ATOM 4907 H14R PA 178 22.349 89.450 46.402 1.00 0.00 H ATOM 4908 H14S PA 178 22.963 87.928 45.650 1.00 0.00 H ATOM 4909 C113 PA 178 21.083 87.851 46.542 1.00 0.00 C ATOM 4910 H13R PA 178 20.163 88.437 46.604 1.00 0.00 H ATOM 4911 H13S PA 178 21.434 87.554 47.532 1.00 0.00 H ATOM 4912 C112 PA 178 20.610 86.499 45.915 1.00 0.00 C ATOM 4913 H12R PA 178 21.513 85.898 46.043 1.00 0.00 H ATOM 4914 H12S PA 178 20.292 86.777 44.908 1.00 0.00 H ATOM 4915 C111 PA 178 19.338 85.881 46.654 1.00 0.00 C ATOM 4916 H11R PA 178 18.993 85.166 45.904 1.00 0.00 H ATOM 4917 H11S PA 178 18.593 86.677 46.708 1.00 0.00 H ATOM 4918 C110 PA 178 19.615 85.215 47.995 1.00 0.00 C ATOM 4919 H10R PA 178 20.303 85.829 48.580 1.00 0.00 H ATOM 4920 H10S PA 178 20.119 84.283 47.732 1.00 0.00 H ATOM 4921 C19 PA 178 18.406 84.776 48.775 1.00 0.00 C ATOM 4922 H9R PA 178 17.899 83.941 48.286 1.00 0.00 H ATOM 4923 H9S PA 178 17.627 85.540 48.818 1.00 0.00 H ATOM 4924 C18 PA 178 18.569 84.394 50.246 1.00 0.00 C ATOM 4925 H8R PA 178 17.523 84.151 50.444 1.00 0.00 H ATOM 4926 H8S PA 178 18.997 85.248 50.776 1.00 0.00 H ATOM 4927 C17 PA 178 19.567 83.270 50.514 1.00 0.00 C ATOM 4928 H7R PA 178 20.475 83.675 50.063 1.00 0.00 H ATOM 4929 H7S PA 178 19.355 82.343 49.978 1.00 0.00 H ATOM 4930 C16 PA 178 19.829 82.984 51.994 1.00 0.00 C ATOM 4931 H6R PA 178 20.353 83.841 52.422 1.00 0.00 H ATOM 4932 H6S PA 178 20.666 82.298 52.141 1.00 0.00 H ATOM 4933 C15 PA 178 18.582 82.581 52.741 1.00 0.00 C ATOM 4934 H5R PA 178 17.983 81.980 52.054 1.00 0.00 H ATOM 4935 H5S PA 178 17.955 83.449 52.953 1.00 0.00 H ATOM 4936 C14 PA 178 18.865 81.619 53.892 1.00 0.00 C ATOM 4937 H4R PA 178 19.598 82.008 54.602 1.00 0.00 H ATOM 4938 H4S PA 178 19.350 80.696 53.567 1.00 0.00 H ATOM 4939 C13 PA 178 17.606 81.296 54.730 1.00 0.00 C ATOM 4940 H3R PA 178 17.942 80.586 55.488 1.00 0.00 H ATOM 4941 H3S PA 178 16.958 80.575 54.229 1.00 0.00 H ATOM 4942 C12 PA 178 16.844 82.479 55.345 1.00 0.00 C ATOM 4943 H2R PA 178 16.264 83.091 54.651 1.00 0.00 H ATOM 4944 H2S PA 178 17.536 83.116 55.899 1.00 0.00 H ATOM 4945 C11 PGR 179 15.855 82.028 56.480 1.00 0.00 C ATOM 4946 O12 PGR 179 15.114 81.143 56.357 1.00 0.00 O ATOM 4947 O11 PGR 179 15.912 82.864 57.523 1.00 0.00 O ATOM 4948 C1 PGR 179 14.891 82.844 58.536 1.00 0.00 C ATOM 4949 HR PGR 179 15.067 82.044 59.261 1.00 0.00 H ATOM 4950 HS PGR 179 13.943 82.635 58.035 1.00 0.00 H ATOM 4951 C2 PGR 179 14.837 84.176 59.357 1.00 0.00 C ATOM 4952 HX PGR 179 15.807 84.570 59.672 1.00 0.00 H ATOM 4953 C3 PGR 179 13.944 83.949 60.601 1.00 0.00 C ATOM 4954 HA PGR 179 14.328 83.069 61.123 1.00 0.00 H ATOM 4955 HB PGR 179 12.887 83.859 60.337 1.00 0.00 H ATOM 4956 O31 PGR 179 14.002 85.041 61.549 1.00 0.00 O ATOM 4957 P31 PGR 179 13.718 84.876 63.036 1.00 0.00 P ATOM 4958 O32 PGR 179 12.233 84.404 63.156 1.00 0.00 O ATOM 4959 C31 PGR 179 11.157 85.344 62.988 1.00 0.00 C ATOM 4960 H1A PGR 179 11.259 85.780 61.991 1.00 0.00 H ATOM 4961 H1B PGR 179 11.173 86.050 63.822 1.00 0.00 H ATOM 4962 C32 PGR 179 9.808 84.596 63.053 1.00 0.00 C ATOM 4963 H2A PGR 179 9.744 83.733 63.720 1.00 0.00 H ATOM 4964 O35 PGR 179 9.622 84.066 61.697 1.00 0.00 O ATOM 4965 HO5A PGR 179 10.312 83.383 61.626 1.00 0.00 H ATOM 4966 C33 PGR 179 8.525 85.491 63.339 1.00 0.00 C ATOM 4967 H3A PGR 179 7.662 84.855 63.127 1.00 0.00 H ATOM 4968 H3B PGR 179 8.676 85.747 64.391 1.00 0.00 H ATOM 4969 O33 PGR 179 14.569 83.711 63.501 1.00 0.00 O ATOM 4970 O34 PGR 179 13.855 86.206 63.769 1.00 0.00 O ATOM 4971 O21 PGR 179 14.079 85.069 58.558 1.00 0.00 O ATOM 4972 C21 PGR 179 14.691 86.226 58.225 1.00 0.00 C ATOM 4973 O22 PGR 179 15.795 86.622 58.583 1.00 0.00 O ATOM 4974 O36 PGR 179 8.447 86.645 62.520 1.00 0.00 O ATOM 4975 HO6A PGR 179 8.013 86.316 61.713 1.00 0.00 H ATOM 4976 C12 OL 180 13.712 87.086 57.422 1.00 0.00 C ATOM 4977 H2R OL 180 12.838 86.474 57.190 1.00 0.00 H ATOM 4978 H2S OL 180 13.406 87.977 57.973 1.00 0.00 H ATOM 4979 C13 OL 180 14.396 87.639 56.195 1.00 0.00 C ATOM 4980 H3R OL 180 13.652 87.928 55.450 1.00 0.00 H ATOM 4981 H3S OL 180 15.006 88.516 56.421 1.00 0.00 H ATOM 4982 C14 OL 180 15.269 86.639 55.442 1.00 0.00 C ATOM 4983 H4R OL 180 16.200 86.522 56.001 1.00 0.00 H ATOM 4984 H4S OL 180 14.699 85.707 55.433 1.00 0.00 H ATOM 4985 C15 OL 180 15.702 87.049 54.042 1.00 0.00 C ATOM 4986 H5R OL 180 15.951 88.111 54.017 1.00 0.00 H ATOM 4987 H5S OL 180 16.628 86.519 53.811 1.00 0.00 H ATOM 4988 C16 OL 180 14.681 86.575 53.069 1.00 0.00 C ATOM 4989 H6R OL 180 14.444 85.530 53.280 1.00 0.00 H ATOM 4990 H6S OL 180 13.803 87.200 53.244 1.00 0.00 H ATOM 4991 C17 OL 180 15.108 86.647 51.633 1.00 0.00 C ATOM 4992 H7R OL 180 15.509 87.641 51.421 1.00 0.00 H ATOM 4993 H7S OL 180 15.954 85.990 51.422 1.00 0.00 H ATOM 4994 C18 OL 180 13.956 86.125 50.692 1.00 0.00 C ATOM 4995 H8R OL 180 13.757 85.095 50.993 1.00 0.00 H ATOM 4996 H8S OL 180 13.083 86.782 50.710 1.00 0.00 H ATOM 4997 C19 OL 180 14.466 86.109 49.227 1.00 0.00 C ATOM 4998 H9R OL 180 14.970 87.018 48.906 1.00 0.00 H ATOM 4999 C110 OL 180 14.745 85.041 48.476 1.00 0.00 C ATOM 5000 H10R OL 180 15.261 85.284 47.550 1.00 0.00 H ATOM 5001 C111 OL 180 14.383 83.604 48.560 1.00 0.00 C ATOM 5002 H11R OL 180 15.305 83.026 48.464 1.00 0.00 H ATOM 5003 H11S OL 180 13.975 83.431 49.558 1.00 0.00 H ATOM 5004 C112 OL 180 13.168 83.308 47.654 1.00 0.00 C ATOM 5005 H12R OL 180 12.440 84.090 47.878 1.00 0.00 H ATOM 5006 H12S OL 180 13.395 83.307 46.586 1.00 0.00 H ATOM 5007 C113 OL 180 12.583 81.902 48.024 1.00 0.00 C ATOM 5008 H13R OL 180 13.286 81.140 47.680 1.00 0.00 H ATOM 5009 H13S OL 180 12.501 81.837 49.111 1.00 0.00 H ATOM 5010 C114 OL 180 11.225 81.654 47.299 1.00 0.00 C ATOM 5011 H14R OL 180 10.525 82.456 47.544 1.00 0.00 H ATOM 5012 H14S OL 180 11.422 81.680 46.225 1.00 0.00 H ATOM 5013 C115 OL 180 10.447 80.458 47.824 1.00 0.00 C ATOM 5014 H15R OL 180 11.121 79.615 47.661 1.00 0.00 H ATOM 5015 H15S OL 180 10.424 80.529 48.913 1.00 0.00 H ATOM 5016 C116 OL 180 9.005 80.409 47.369 1.00 0.00 C ATOM 5017 H16R OL 180 8.496 81.370 47.471 1.00 0.00 H ATOM 5018 H16S OL 180 9.146 80.227 46.301 1.00 0.00 H ATOM 5019 C117 OL 180 8.390 79.141 47.842 1.00 0.00 C ATOM 5020 H17R OL 180 9.100 78.316 47.933 1.00 0.00 H ATOM 5021 H17S OL 180 7.922 79.237 48.825 1.00 0.00 H ATOM 5022 C118 OL 180 7.400 78.566 46.929 1.00 0.00 C ATOM 5023 H18R OL 180 6.880 77.658 47.242 1.00 0.00 H ATOM 5024 H18S OL 180 8.077 78.223 46.144 1.00 0.00 H ATOM 5025 H18T OL 180 6.611 79.215 46.544 1.00 0.00 H TER 5026 OL 180 ATOM 5026 C116 PA 181 133.053 84.393 48.805 1.00 0.00 C ATOM 5027 H16R PA 181 133.892 83.810 48.420 1.00 0.00 H ATOM 5028 H16S PA 181 133.450 85.063 49.571 1.00 0.00 H ATOM 5029 H16T PA 181 132.631 85.017 48.015 1.00 0.00 H ATOM 5030 C115 PA 181 132.003 83.463 49.516 1.00 0.00 C ATOM 5031 H15R PA 181 131.089 83.998 49.783 1.00 0.00 H ATOM 5032 H15S PA 181 132.395 83.133 50.480 1.00 0.00 H ATOM 5033 C114 PA 181 131.569 82.239 48.797 1.00 0.00 C ATOM 5034 H14R PA 181 132.553 81.766 48.818 1.00 0.00 H ATOM 5035 H14S PA 181 131.235 82.409 47.771 1.00 0.00 H ATOM 5036 C113 PA 181 130.681 81.136 49.502 1.00 0.00 C ATOM 5037 H13R PA 181 129.648 81.474 49.602 1.00 0.00 H ATOM 5038 H13S PA 181 130.992 81.026 50.543 1.00 0.00 H ATOM 5039 C112 PA 181 130.656 79.793 48.722 1.00 0.00 C ATOM 5040 H12R PA 181 131.648 79.353 48.598 1.00 0.00 H ATOM 5041 H12S PA 181 130.274 79.963 47.714 1.00 0.00 H ATOM 5042 C111 PA 181 129.934 78.703 49.470 1.00 0.00 C ATOM 5043 H11R PA 181 130.297 78.580 50.493 1.00 0.00 H ATOM 5044 H11S PA 181 130.177 77.752 48.990 1.00 0.00 H ATOM 5045 C110 PA 181 128.424 78.829 49.469 1.00 0.00 C ATOM 5046 H10R PA 181 128.110 79.142 48.471 1.00 0.00 H ATOM 5047 H10S PA 181 128.250 79.647 50.171 1.00 0.00 H ATOM 5048 C19 PA 181 127.823 77.577 50.057 1.00 0.00 C ATOM 5049 H9R PA 181 128.178 77.361 51.067 1.00 0.00 H ATOM 5050 H9S PA 181 128.011 76.778 49.337 1.00 0.00 H ATOM 5051 C18 PA 181 126.252 77.670 50.087 1.00 0.00 C ATOM 5052 H8R PA 181 126.080 77.608 49.011 1.00 0.00 H ATOM 5053 H8S PA 181 126.044 78.642 50.539 1.00 0.00 H ATOM 5054 C17 PA 181 125.367 76.593 50.730 1.00 0.00 C ATOM 5055 H7R PA 181 125.443 75.671 50.151 1.00 0.00 H ATOM 5056 H7S PA 181 124.321 76.899 50.662 1.00 0.00 H ATOM 5057 C16 PA 181 125.640 76.333 52.246 1.00 0.00 C ATOM 5058 H6R PA 181 126.644 75.908 52.301 1.00 0.00 H ATOM 5059 H6S PA 181 124.982 75.521 52.561 1.00 0.00 H ATOM 5060 C15 PA 181 125.455 77.516 53.171 1.00 0.00 C ATOM 5061 H5R PA 181 124.818 78.240 52.660 1.00 0.00 H ATOM 5062 H5S PA 181 126.458 77.942 53.249 1.00 0.00 H ATOM 5063 C14 PA 181 124.955 77.091 54.567 1.00 0.00 C ATOM 5064 H4R PA 181 125.495 77.674 55.316 1.00 0.00 H ATOM 5065 H4S PA 181 125.333 76.083 54.745 1.00 0.00 H ATOM 5066 C13 PA 181 123.437 77.197 54.630 1.00 0.00 C ATOM 5067 H3R PA 181 122.983 76.690 53.776 1.00 0.00 H ATOM 5068 H3S PA 181 123.162 78.221 54.368 1.00 0.00 H ATOM 5069 C12 PA 181 122.814 76.612 55.944 1.00 0.00 C ATOM 5070 H2R PA 181 123.077 75.555 55.870 1.00 0.00 H ATOM 5071 H2S PA 181 121.722 76.610 55.937 1.00 0.00 H ATOM 5072 C11 PGR 182 123.410 77.224 57.140 1.00 0.00 C ATOM 5073 O12 PGR 182 122.958 78.238 57.644 1.00 0.00 O ATOM 5074 O11 PGR 182 124.579 76.584 57.498 1.00 0.00 O ATOM 5075 C1 PGR 182 125.272 76.894 58.803 1.00 0.00 C ATOM 5076 HR PGR 182 125.811 76.119 59.354 1.00 0.00 H ATOM 5077 HS PGR 182 124.557 77.308 59.519 1.00 0.00 H ATOM 5078 C2 PGR 182 126.365 78.027 58.549 1.00 0.00 C ATOM 5079 HX PGR 182 126.981 77.679 57.715 1.00 0.00 H ATOM 5080 C3 PGR 182 127.244 78.281 59.774 1.00 0.00 C ATOM 5081 HA PGR 182 127.948 79.106 59.641 1.00 0.00 H ATOM 5082 HB PGR 182 127.844 77.407 60.039 1.00 0.00 H ATOM 5083 O31 PGR 182 126.478 78.659 60.874 1.00 0.00 O ATOM 5084 P31 PGR 182 127.094 78.604 62.366 1.00 0.00 P ATOM 5085 O32 PGR 182 127.084 77.020 62.607 1.00 0.00 O ATOM 5086 C31 PGR 182 125.852 76.496 62.697 1.00 0.00 C ATOM 5087 H1A PGR 182 125.349 76.705 61.750 1.00 0.00 H ATOM 5088 H1B PGR 182 125.269 76.876 63.541 1.00 0.00 H ATOM 5089 C32 PGR 182 125.952 74.981 62.784 1.00 0.00 C ATOM 5090 H2A PGR 182 126.598 74.846 63.655 1.00 0.00 H ATOM 5091 O35 PGR 182 126.646 74.402 61.675 1.00 0.00 O ATOM 5092 HO5A PGR 182 127.429 74.894 61.371 1.00 0.00 H ATOM 5093 C33 PGR 182 124.641 74.224 62.930 1.00 0.00 C ATOM 5094 H3A PGR 182 124.854 73.153 62.976 1.00 0.00 H ATOM 5095 H3B PGR 182 124.186 74.547 63.870 1.00 0.00 H ATOM 5096 O33 PGR 182 128.527 78.990 62.339 1.00 0.00 O ATOM 5097 O34 PGR 182 126.145 79.302 63.274 1.00 0.00 O ATOM 5098 O21 PGR 182 125.641 79.261 58.259 1.00 0.00 O ATOM 5099 C21 PGR 182 126.210 80.288 57.655 1.00 0.00 C ATOM 5100 O22 PGR 182 127.393 80.361 57.296 1.00 0.00 O ATOM 5101 O36 PGR 182 123.741 74.713 61.820 1.00 0.00 O ATOM 5102 HO6A PGR 182 123.662 75.675 61.949 1.00 0.00 H ATOM 5103 C12 OL 183 125.201 81.332 57.341 1.00 0.00 C ATOM 5104 H2R OL 183 124.219 80.899 57.546 1.00 0.00 H ATOM 5105 H2S OL 183 125.368 82.112 58.087 1.00 0.00 H ATOM 5106 C13 OL 183 125.445 81.900 55.948 1.00 0.00 C ATOM 5107 H3R OL 183 124.803 82.771 55.802 1.00 0.00 H ATOM 5108 H3S OL 183 126.461 82.301 55.960 1.00 0.00 H ATOM 5109 C14 OL 183 124.985 80.930 54.864 1.00 0.00 C ATOM 5110 H4R OL 183 125.555 80.002 54.942 1.00 0.00 H ATOM 5111 H4S OL 183 123.974 80.684 55.194 1.00 0.00 H ATOM 5112 C15 OL 183 124.965 81.585 53.480 1.00 0.00 C ATOM 5113 H5R OL 183 124.083 81.340 52.884 1.00 0.00 H ATOM 5114 H5S OL 183 124.842 82.662 53.611 1.00 0.00 H ATOM 5115 C16 OL 183 126.158 81.128 52.671 1.00 0.00 C ATOM 5116 H6R OL 183 126.996 81.204 53.367 1.00 0.00 H ATOM 5117 H6S OL 183 126.025 80.087 52.368 1.00 0.00 H ATOM 5118 C17 OL 183 126.425 81.956 51.422 1.00 0.00 C ATOM 5119 H7R OL 183 127.296 81.583 50.879 1.00 0.00 H ATOM 5120 H7S OL 183 125.509 81.819 50.845 1.00 0.00 H ATOM 5121 C18 OL 183 126.678 83.538 51.591 1.00 0.00 C ATOM 5122 H8R OL 183 125.889 83.939 52.230 1.00 0.00 H ATOM 5123 H8S OL 183 127.592 83.707 52.164 1.00 0.00 H ATOM 5124 C19 OL 183 126.583 84.382 50.297 1.00 0.00 C ATOM 5125 H9R OL 183 125.907 83.956 49.560 1.00 0.00 H ATOM 5126 C110 OL 183 127.305 85.424 49.981 1.00 0.00 C ATOM 5127 H10R OL 183 127.144 85.836 48.988 1.00 0.00 H ATOM 5128 C111 OL 183 128.173 86.208 50.901 1.00 0.00 C ATOM 5129 H11R OL 183 128.179 85.823 51.923 1.00 0.00 H ATOM 5130 H11S OL 183 129.155 85.944 50.502 1.00 0.00 H ATOM 5131 C112 OL 183 128.112 87.749 50.839 1.00 0.00 C ATOM 5132 H12R OL 183 128.178 87.968 49.771 1.00 0.00 H ATOM 5133 H12S OL 183 127.086 88.074 51.027 1.00 0.00 H ATOM 5134 C113 OL 183 129.277 88.536 51.483 1.00 0.00 C ATOM 5135 H13R OL 183 130.119 87.841 51.506 1.00 0.00 H ATOM 5136 H13S OL 183 129.642 89.282 50.775 1.00 0.00 H ATOM 5137 C114 OL 183 128.900 89.143 52.892 1.00 0.00 C ATOM 5138 H14R OL 183 128.219 89.954 52.624 1.00 0.00 H ATOM 5139 H14S OL 183 128.322 88.369 53.402 1.00 0.00 H ATOM 5140 C115 OL 183 130.080 89.654 53.773 1.00 0.00 C ATOM 5141 H15R OL 183 129.639 89.887 54.745 1.00 0.00 H ATOM 5142 H15S OL 183 130.728 88.804 53.995 1.00 0.00 H ATOM 5143 C116 OL 183 130.822 90.819 53.143 1.00 0.00 C ATOM 5144 H16R OL 183 131.182 90.422 52.191 1.00 0.00 H ATOM 5145 H16S OL 183 130.112 91.583 52.820 1.00 0.00 H ATOM 5146 C117 OL 183 131.824 91.475 54.075 1.00 0.00 C ATOM 5147 H17R OL 183 131.290 91.715 54.997 1.00 0.00 H ATOM 5148 H17S OL 183 132.684 90.869 54.369 1.00 0.00 H ATOM 5149 C118 OL 183 132.323 92.742 53.511 1.00 0.00 C ATOM 5150 H18R OL 183 131.459 93.260 53.090 1.00 0.00 H ATOM 5151 H18S OL 183 133.255 92.653 52.949 1.00 0.00 H ATOM 5152 H18T OL 183 132.638 93.503 54.229 1.00 0.00 H TER 5153 OL 183 ATOM 5153 C116 PA 184 86.144 69.567 41.849 1.00 0.00 C ATOM 5154 H16R PA 184 85.134 69.186 41.682 1.00 0.00 H ATOM 5155 H16S PA 184 86.437 70.114 40.951 1.00 0.00 H ATOM 5156 H16T PA 184 85.871 70.260 42.647 1.00 0.00 H ATOM 5157 C115 PA 184 87.078 68.443 42.123 1.00 0.00 C ATOM 5158 H15R PA 184 87.317 67.974 41.166 1.00 0.00 H ATOM 5159 H15S PA 184 86.690 67.703 42.827 1.00 0.00 H ATOM 5160 C114 PA 184 88.444 68.840 42.645 1.00 0.00 C ATOM 5161 H14R PA 184 88.952 69.288 41.788 1.00 0.00 H ATOM 5162 H14S PA 184 89.012 67.917 42.777 1.00 0.00 H ATOM 5163 C113 PA 184 88.467 69.849 43.776 1.00 0.00 C ATOM 5164 H13R PA 184 87.911 70.767 43.579 1.00 0.00 H ATOM 5165 H13S PA 184 89.445 70.303 43.950 1.00 0.00 H ATOM 5166 C112 PA 184 88.039 69.129 45.092 1.00 0.00 C ATOM 5167 H12R PA 184 88.727 68.321 45.351 1.00 0.00 H ATOM 5168 H12S PA 184 87.029 68.714 45.068 1.00 0.00 H ATOM 5169 C111 PA 184 88.057 70.059 46.341 1.00 0.00 C ATOM 5170 H11R PA 184 89.095 70.287 46.589 1.00 0.00 H ATOM 5171 H11S PA 184 87.640 69.576 47.227 1.00 0.00 H ATOM 5172 C110 PA 184 87.195 71.355 46.219 1.00 0.00 C ATOM 5173 H10R PA 184 86.139 71.078 46.189 1.00 0.00 H ATOM 5174 H10S PA 184 87.413 71.956 45.334 1.00 0.00 H ATOM 5175 C19 PA 184 87.339 72.331 47.434 1.00 0.00 C ATOM 5176 H9R PA 184 88.035 73.144 47.217 1.00 0.00 H ATOM 5177 H9S PA 184 87.515 71.886 48.415 1.00 0.00 H ATOM 5178 C18 PA 184 86.009 73.041 47.498 1.00 0.00 C ATOM 5179 H8R PA 184 85.198 72.311 47.517 1.00 0.00 H ATOM 5180 H8S PA 184 85.909 73.573 46.550 1.00 0.00 H ATOM 5181 C17 PA 184 85.927 74.048 48.612 1.00 0.00 C ATOM 5182 H7R PA 184 86.357 74.938 48.147 1.00 0.00 H ATOM 5183 H7S PA 184 86.652 73.816 49.394 1.00 0.00 H ATOM 5184 C16 PA 184 84.513 74.291 49.234 1.00 0.00 C ATOM 5185 H6R PA 184 84.252 73.377 49.770 1.00 0.00 H ATOM 5186 H6S PA 184 83.774 74.422 48.441 1.00 0.00 H ATOM 5187 C15 PA 184 84.258 75.571 50.023 1.00 0.00 C ATOM 5188 H5R PA 184 84.533 76.530 49.577 1.00 0.00 H ATOM 5189 H5S PA 184 84.980 75.407 50.825 1.00 0.00 H ATOM 5190 C14 PA 184 82.848 75.576 50.627 1.00 0.00 C ATOM 5191 H4R PA 184 82.497 74.660 51.106 1.00 0.00 H ATOM 5192 H4S PA 184 82.147 75.796 49.819 1.00 0.00 H ATOM 5193 C13 PA 184 82.648 76.592 51.730 1.00 0.00 C ATOM 5194 H3R PA 184 82.931 77.598 51.415 1.00 0.00 H ATOM 5195 H3S PA 184 83.376 76.360 52.511 1.00 0.00 H ATOM 5196 C12 PA 184 81.270 76.556 52.483 1.00 0.00 C ATOM 5197 H2R PA 184 80.629 75.674 52.430 1.00 0.00 H ATOM 5198 H2S PA 184 80.716 77.282 51.885 1.00 0.00 H ATOM 5199 C11 PGR 185 81.329 76.942 53.946 1.00 0.00 C ATOM 5200 O12 PGR 185 81.824 76.229 54.858 1.00 0.00 O ATOM 5201 O11 PGR 185 80.940 78.204 54.152 1.00 0.00 O ATOM 5202 C1 PGR 185 80.907 78.866 55.476 1.00 0.00 C ATOM 5203 HR PGR 185 80.268 78.256 56.120 1.00 0.00 H ATOM 5204 HS PGR 185 80.384 79.822 55.405 1.00 0.00 H ATOM 5205 C2 PGR 185 82.314 78.937 56.137 1.00 0.00 C ATOM 5206 HX PGR 185 82.771 77.944 56.169 1.00 0.00 H ATOM 5207 C3 PGR 185 82.236 79.450 57.612 1.00 0.00 C ATOM 5208 HA PGR 185 83.209 79.750 58.010 1.00 0.00 H ATOM 5209 HB PGR 185 81.790 78.688 58.256 1.00 0.00 H ATOM 5210 O31 PGR 185 81.469 80.658 57.566 1.00 0.00 O ATOM 5211 P31 PGR 185 81.038 81.391 58.868 1.00 0.00 P ATOM 5212 O32 PGR 185 79.853 80.500 59.442 1.00 0.00 O ATOM 5213 C31 PGR 185 78.686 80.310 58.645 1.00 0.00 C ATOM 5214 H1A PGR 185 78.190 79.343 58.757 1.00 0.00 H ATOM 5215 H1B PGR 185 78.954 80.448 57.595 1.00 0.00 H ATOM 5216 C32 PGR 185 77.663 81.450 59.016 1.00 0.00 C ATOM 5217 H2A PGR 185 76.700 81.112 58.625 1.00 0.00 H ATOM 5218 O35 PGR 185 77.949 82.655 58.309 1.00 0.00 O ATOM 5219 HO5A PGR 185 78.753 82.992 58.743 1.00 0.00 H ATOM 5220 C33 PGR 185 77.268 81.724 60.516 1.00 0.00 C ATOM 5221 H3A PGR 185 76.746 82.684 60.503 1.00 0.00 H ATOM 5222 H3B PGR 185 76.656 80.893 60.877 1.00 0.00 H ATOM 5223 O33 PGR 185 82.062 81.426 59.911 1.00 0.00 O ATOM 5224 O34 PGR 185 80.512 82.751 58.574 1.00 0.00 O ATOM 5225 O21 PGR 185 83.128 79.945 55.491 1.00 0.00 O ATOM 5226 C21 PGR 185 84.345 79.580 55.120 1.00 0.00 C ATOM 5227 O22 PGR 185 84.881 78.496 55.247 1.00 0.00 O ATOM 5228 O36 PGR 185 78.435 81.828 61.326 1.00 0.00 O ATOM 5229 HO6A PGR 185 78.791 82.734 61.346 1.00 0.00 H ATOM 5230 C12 OL 186 84.998 80.700 54.397 1.00 0.00 C ATOM 5231 H2R OL 186 84.337 81.204 53.689 1.00 0.00 H ATOM 5232 H2S OL 186 85.263 81.503 55.087 1.00 0.00 H ATOM 5233 C13 OL 186 86.263 80.234 53.585 1.00 0.00 C ATOM 5234 H3R OL 186 87.005 79.883 54.306 1.00 0.00 H ATOM 5235 H3S OL 186 86.043 79.436 52.873 1.00 0.00 H ATOM 5236 C14 OL 186 86.911 81.403 52.775 1.00 0.00 C ATOM 5237 H4R OL 186 86.209 81.854 52.070 1.00 0.00 H ATOM 5238 H4S OL 186 87.080 82.160 53.543 1.00 0.00 H ATOM 5239 C15 OL 186 88.297 80.982 52.158 1.00 0.00 C ATOM 5240 H5R OL 186 88.948 81.840 51.978 1.00 0.00 H ATOM 5241 H5S OL 186 88.818 80.321 52.854 1.00 0.00 H ATOM 5242 C16 OL 186 88.089 80.262 50.770 1.00 0.00 C ATOM 5243 H6R OL 186 87.588 79.305 50.932 1.00 0.00 H ATOM 5244 H6S OL 186 87.369 80.857 50.204 1.00 0.00 H ATOM 5245 C17 OL 186 89.409 80.113 49.996 1.00 0.00 C ATOM 5246 H7R OL 186 89.711 81.141 49.788 1.00 0.00 H ATOM 5247 H7S OL 186 90.166 79.615 50.604 1.00 0.00 H ATOM 5248 C18 OL 186 89.264 79.254 48.769 1.00 0.00 C ATOM 5249 H8R OL 186 88.577 78.427 48.957 1.00 0.00 H ATOM 5250 H8S OL 186 88.742 79.757 47.952 1.00 0.00 H ATOM 5251 C19 OL 186 90.557 78.804 48.153 1.00 0.00 C ATOM 5252 H9R OL 186 91.057 79.650 47.689 1.00 0.00 H ATOM 5253 C110 OL 186 90.931 77.503 48.127 1.00 0.00 C ATOM 5254 H10R OL 186 91.830 77.227 47.582 1.00 0.00 H ATOM 5255 C111 OL 186 90.206 76.236 48.557 1.00 0.00 C ATOM 5256 H11R OL 186 89.201 76.198 48.131 1.00 0.00 H ATOM 5257 H11S OL 186 90.672 75.364 48.094 1.00 0.00 H ATOM 5258 C112 OL 186 90.264 75.891 50.062 1.00 0.00 C ATOM 5259 H12R OL 186 91.317 75.917 50.353 1.00 0.00 H ATOM 5260 H12S OL 186 89.843 76.585 50.792 1.00 0.00 H ATOM 5261 C113 OL 186 89.841 74.481 50.393 1.00 0.00 C ATOM 5262 H13R OL 186 90.040 74.439 51.466 1.00 0.00 H ATOM 5263 H13S OL 186 88.760 74.345 50.330 1.00 0.00 H ATOM 5264 C114 OL 186 90.504 73.320 49.683 1.00 0.00 C ATOM 5265 H14R OL 186 90.241 73.237 48.626 1.00 0.00 H ATOM 5266 H14S OL 186 91.575 73.528 49.730 1.00 0.00 H ATOM 5267 C115 OL 186 90.211 72.029 50.414 1.00 0.00 C ATOM 5268 H15R OL 186 90.410 72.265 51.461 1.00 0.00 H ATOM 5269 H15S OL 186 89.170 71.702 50.373 1.00 0.00 H ATOM 5270 C116 OL 186 91.103 70.836 50.006 1.00 0.00 C ATOM 5271 H16R OL 186 90.834 70.700 48.956 1.00 0.00 H ATOM 5272 H16S OL 186 92.184 70.975 50.064 1.00 0.00 H ATOM 5273 C117 OL 186 90.923 69.533 50.835 1.00 0.00 C ATOM 5274 H17R OL 186 91.623 69.606 51.669 1.00 0.00 H ATOM 5275 H17S OL 186 89.897 69.461 51.202 1.00 0.00 H ATOM 5276 C118 OL 186 91.022 68.232 50.095 1.00 0.00 C ATOM 5277 H18R OL 186 90.761 67.405 50.759 1.00 0.00 H ATOM 5278 H18S OL 186 92.073 68.039 49.869 1.00 0.00 H ATOM 5279 H18T OL 186 90.399 68.168 49.201 1.00 0.00 H TER 5280 OL 186 ATOM 5280 C116 PA 187 29.639 41.105 39.032 1.00 0.00 C ATOM 5281 H16R PA 187 30.654 40.711 38.950 1.00 0.00 H ATOM 5282 H16S PA 187 29.611 42.137 38.676 1.00 0.00 H ATOM 5283 H16T PA 187 28.942 40.501 38.446 1.00 0.00 H ATOM 5284 C115 PA 187 29.330 41.030 40.553 1.00 0.00 C ATOM 5285 H15R PA 187 30.089 41.640 41.047 1.00 0.00 H ATOM 5286 H15S PA 187 29.519 39.968 40.723 1.00 0.00 H ATOM 5287 C114 PA 187 27.985 41.604 40.914 1.00 0.00 C ATOM 5288 H14R PA 187 27.361 41.113 40.164 1.00 0.00 H ATOM 5289 H14S PA 187 27.930 42.657 40.632 1.00 0.00 H ATOM 5290 C113 PA 187 27.450 41.611 42.326 1.00 0.00 C ATOM 5291 H13R PA 187 27.269 40.565 42.578 1.00 0.00 H ATOM 5292 H13S PA 187 26.458 42.066 42.359 1.00 0.00 H ATOM 5293 C112 PA 187 28.344 42.215 43.339 1.00 0.00 C ATOM 5294 H12R PA 187 27.754 42.676 44.135 1.00 0.00 H ATOM 5295 H12S PA 187 28.821 43.081 42.874 1.00 0.00 H ATOM 5296 C111 PA 187 29.397 41.257 43.919 1.00 0.00 C ATOM 5297 H11R PA 187 30.007 40.711 43.196 1.00 0.00 H ATOM 5298 H11S PA 187 28.921 40.401 44.400 1.00 0.00 H ATOM 5299 C110 PA 187 30.244 41.885 44.988 1.00 0.00 C ATOM 5300 H10R PA 187 30.810 42.661 44.468 1.00 0.00 H ATOM 5301 H10S PA 187 31.076 41.215 45.218 1.00 0.00 H ATOM 5302 C19 PA 187 29.709 42.356 46.333 1.00 0.00 C ATOM 5303 H9R PA 187 29.052 43.215 46.178 1.00 0.00 H ATOM 5304 H9S PA 187 30.516 42.848 46.880 1.00 0.00 H ATOM 5305 C18 PA 187 29.070 41.323 47.159 1.00 0.00 C ATOM 5306 H8R PA 187 29.771 40.501 47.314 1.00 0.00 H ATOM 5307 H8S PA 187 28.274 40.802 46.624 1.00 0.00 H ATOM 5308 C17 PA 187 28.587 41.859 48.502 1.00 0.00 C ATOM 5309 H7R PA 187 27.891 42.674 48.294 1.00 0.00 H ATOM 5310 H7S PA 187 29.393 42.374 49.029 1.00 0.00 H ATOM 5311 C16 PA 187 27.931 40.932 49.536 1.00 0.00 C ATOM 5312 H6R PA 187 26.875 40.719 49.359 1.00 0.00 H ATOM 5313 H6S PA 187 27.896 41.506 50.465 1.00 0.00 H ATOM 5314 C15 PA 187 28.637 39.576 49.655 1.00 0.00 C ATOM 5315 H5R PA 187 29.697 39.755 49.848 1.00 0.00 H ATOM 5316 H5S PA 187 28.569 38.993 48.734 1.00 0.00 H ATOM 5317 C14 PA 187 27.979 38.574 50.721 1.00 0.00 C ATOM 5318 H4R PA 187 28.345 37.560 50.547 1.00 0.00 H ATOM 5319 H4S PA 187 26.927 38.583 50.428 1.00 0.00 H ATOM 5320 C13 PA 187 28.269 38.970 52.170 1.00 0.00 C ATOM 5321 H3R PA 187 27.365 38.576 52.639 1.00 0.00 H ATOM 5322 H3S PA 187 28.384 40.054 52.225 1.00 0.00 H ATOM 5323 C12 PA 187 29.500 38.166 52.665 1.00 0.00 C ATOM 5324 H2R PA 187 29.281 37.100 52.574 1.00 0.00 H ATOM 5325 H2S PA 187 30.370 38.378 52.042 1.00 0.00 H ATOM 5326 C11 PGR 188 29.866 38.547 54.070 1.00 0.00 C ATOM 5327 O12 PGR 188 29.118 38.201 54.986 1.00 0.00 O ATOM 5328 O11 PGR 188 30.949 39.320 54.194 1.00 0.00 O ATOM 5329 C1 PGR 188 31.199 39.995 55.466 1.00 0.00 C ATOM 5330 HR PGR 188 30.266 40.439 55.822 1.00 0.00 H ATOM 5331 HS PGR 188 31.901 40.787 55.194 1.00 0.00 H ATOM 5332 C2 PGR 188 31.826 38.982 56.481 1.00 0.00 C ATOM 5333 HX PGR 188 31.063 38.371 56.970 1.00 0.00 H ATOM 5334 C3 PGR 188 32.343 39.845 57.646 1.00 0.00 C ATOM 5335 HA PGR 188 31.558 40.524 57.985 1.00 0.00 H ATOM 5336 HB PGR 188 33.161 40.506 57.348 1.00 0.00 H ATOM 5337 O31 PGR 188 32.654 39.128 58.826 1.00 0.00 O ATOM 5338 P31 PGR 188 33.269 39.892 60.097 1.00 0.00 P ATOM 5339 O32 PGR 188 32.006 40.548 60.786 1.00 0.00 O ATOM 5340 C31 PGR 188 31.664 41.915 60.699 1.00 0.00 C ATOM 5341 H1A PGR 188 31.083 42.038 59.781 1.00 0.00 H ATOM 5342 H1B PGR 188 32.508 42.606 60.769 1.00 0.00 H ATOM 5343 C32 PGR 188 30.730 42.250 61.933 1.00 0.00 C ATOM 5344 H2A PGR 188 30.397 43.277 61.760 1.00 0.00 H ATOM 5345 O35 PGR 188 31.490 42.277 63.130 1.00 0.00 O ATOM 5346 HO5A PGR 188 31.544 41.383 63.515 1.00 0.00 H ATOM 5347 C33 PGR 188 29.445 41.344 62.038 1.00 0.00 C ATOM 5348 H3A PGR 188 28.692 41.710 62.741 1.00 0.00 H ATOM 5349 H3B PGR 188 28.997 41.430 61.045 1.00 0.00 H ATOM 5350 O33 PGR 188 33.785 38.795 60.947 1.00 0.00 O ATOM 5351 O34 PGR 188 34.224 40.853 59.551 1.00 0.00 O ATOM 5352 O21 PGR 188 32.797 38.063 55.875 1.00 0.00 O ATOM 5353 C21 PGR 188 33.863 38.483 55.116 1.00 0.00 C ATOM 5354 O22 PGR 188 34.048 39.643 54.837 1.00 0.00 O ATOM 5355 O36 PGR 188 29.843 39.965 62.281 1.00 0.00 O ATOM 5356 HO6A PGR 188 30.569 39.756 61.667 1.00 0.00 H ATOM 5357 C12 OL 189 34.678 37.286 54.728 1.00 0.00 C ATOM 5358 H2R OL 189 35.017 36.837 55.664 1.00 0.00 H ATOM 5359 H2S OL 189 34.003 36.509 54.365 1.00 0.00 H ATOM 5360 C13 OL 189 35.830 37.650 53.768 1.00 0.00 C ATOM 5361 H3R OL 189 35.332 37.928 52.837 1.00 0.00 H ATOM 5362 H3S OL 189 36.404 38.435 54.264 1.00 0.00 H ATOM 5363 C14 OL 189 36.792 36.533 53.458 1.00 0.00 C ATOM 5364 H4R OL 189 37.277 36.236 54.390 1.00 0.00 H ATOM 5365 H4S OL 189 36.183 35.656 53.228 1.00 0.00 H ATOM 5366 C15 OL 189 37.717 36.864 52.329 1.00 0.00 C ATOM 5367 H5R OL 189 38.257 37.812 52.367 1.00 0.00 H ATOM 5368 H5S OL 189 38.591 36.209 52.302 1.00 0.00 H ATOM 5369 C16 OL 189 36.941 36.997 51.016 1.00 0.00 C ATOM 5370 H6R OL 189 36.128 36.268 50.980 1.00 0.00 H ATOM 5371 H6S OL 189 36.688 38.046 50.849 1.00 0.00 H ATOM 5372 C17 OL 189 37.830 36.554 49.836 1.00 0.00 C ATOM 5373 H7R OL 189 38.772 37.039 50.104 1.00 0.00 H ATOM 5374 H7S OL 189 37.980 35.473 49.866 1.00 0.00 H ATOM 5375 C18 OL 189 37.167 36.975 48.475 1.00 0.00 C ATOM 5376 H8R OL 189 37.021 38.057 48.474 1.00 0.00 H ATOM 5377 H8S OL 189 37.832 36.831 47.621 1.00 0.00 H ATOM 5378 C19 OL 189 35.888 36.174 48.310 1.00 0.00 C ATOM 5379 H9R OL 189 35.891 35.376 49.049 1.00 0.00 H ATOM 5380 C110 OL 189 34.923 36.358 47.446 1.00 0.00 C ATOM 5381 H10R OL 189 34.053 35.718 47.564 1.00 0.00 H ATOM 5382 C111 OL 189 34.870 37.354 46.313 1.00 0.00 C ATOM 5383 H11R OL 189 33.979 37.946 46.533 1.00 0.00 H ATOM 5384 H11S OL 189 35.754 37.994 46.285 1.00 0.00 H ATOM 5385 C112 OL 189 34.816 36.547 45.030 1.00 0.00 C ATOM 5386 H12R OL 189 35.197 35.571 45.340 1.00 0.00 H ATOM 5387 H12S OL 189 33.806 36.394 44.645 1.00 0.00 H ATOM 5388 C113 OL 189 35.779 36.969 44.009 1.00 0.00 C ATOM 5389 H13R OL 189 35.718 38.043 43.822 1.00 0.00 H ATOM 5390 H13S OL 189 36.706 36.872 44.578 1.00 0.00 H ATOM 5391 C114 OL 189 35.813 36.179 42.729 1.00 0.00 C ATOM 5392 H14R OL 189 36.052 35.145 42.987 1.00 0.00 H ATOM 5393 H14S OL 189 34.855 36.191 42.204 1.00 0.00 H ATOM 5394 C115 OL 189 36.981 36.656 41.833 1.00 0.00 C ATOM 5395 H15R OL 189 37.211 37.724 41.824 1.00 0.00 H ATOM 5396 H15S OL 189 37.880 36.214 42.268 1.00 0.00 H ATOM 5397 C116 OL 189 36.986 36.255 40.322 1.00 0.00 C ATOM 5398 H16R OL 189 36.409 35.381 40.011 1.00 0.00 H ATOM 5399 H16S OL 189 36.393 37.013 39.806 1.00 0.00 H ATOM 5400 C117 OL 189 38.282 36.008 39.734 1.00 0.00 C ATOM 5401 H17R OL 189 38.776 35.179 40.245 1.00 0.00 H ATOM 5402 H17S OL 189 38.199 35.723 38.683 1.00 0.00 H ATOM 5403 C118 OL 189 39.322 37.130 39.782 1.00 0.00 C ATOM 5404 H18R OL 189 40.315 37.010 39.344 1.00 0.00 H ATOM 5405 H18S OL 189 39.555 37.394 40.816 1.00 0.00 H ATOM 5406 H18T OL 189 39.005 37.948 39.131 1.00 0.00 H TER 5407 OL 189 ATOM 5407 C116 PA 190 106.512 49.316 44.593 1.00 0.00 C ATOM 5408 H16R PA 190 106.196 49.823 43.679 1.00 0.00 H ATOM 5409 H16S PA 190 107.096 50.143 45.004 1.00 0.00 H ATOM 5410 H16T PA 190 105.746 48.949 45.279 1.00 0.00 H ATOM 5411 C115 PA 190 107.275 48.060 44.182 1.00 0.00 C ATOM 5412 H15R PA 190 107.133 47.341 44.992 1.00 0.00 H ATOM 5413 H15S PA 190 108.322 48.361 44.102 1.00 0.00 H ATOM 5414 C114 PA 190 106.923 47.298 42.843 1.00 0.00 C ATOM 5415 H14R PA 190 107.066 47.991 42.012 1.00 0.00 H ATOM 5416 H14S PA 190 105.913 46.882 42.811 1.00 0.00 H ATOM 5417 C113 PA 190 108.008 46.277 42.457 1.00 0.00 C ATOM 5418 H13R PA 190 109.044 46.543 42.676 1.00 0.00 H ATOM 5419 H13S PA 190 108.127 45.986 41.412 1.00 0.00 H ATOM 5420 C112 PA 190 107.896 44.939 43.367 1.00 0.00 C ATOM 5421 H12R PA 190 106.831 44.709 43.290 1.00 0.00 H ATOM 5422 H12S PA 190 108.053 45.173 44.422 1.00 0.00 H ATOM 5423 C111 PA 190 108.827 43.784 42.814 1.00 0.00 C ATOM 5424 H11R PA 190 109.843 44.133 42.619 1.00 0.00 H ATOM 5425 H11S PA 190 108.466 43.357 41.877 1.00 0.00 H ATOM 5426 C110 PA 190 108.956 42.632 43.785 1.00 0.00 C ATOM 5427 H10R PA 190 109.121 41.707 43.229 1.00 0.00 H ATOM 5428 H10S PA 190 107.945 42.544 44.188 1.00 0.00 H ATOM 5429 C19 PA 190 109.898 42.899 44.881 1.00 0.00 C ATOM 5430 H9R PA 190 109.595 43.832 45.362 1.00 0.00 H ATOM 5431 H9S PA 190 110.908 43.124 44.532 1.00 0.00 H ATOM 5432 C18 PA 190 110.010 41.670 45.762 1.00 0.00 C ATOM 5433 H8R PA 190 110.390 40.877 45.115 1.00 0.00 H ATOM 5434 H8S PA 190 109.038 41.257 46.038 1.00 0.00 H ATOM 5435 C17 PA 190 110.897 41.933 46.958 1.00 0.00 C ATOM 5436 H7R PA 190 110.205 42.562 47.522 1.00 0.00 H ATOM 5437 H7S PA 190 111.793 42.482 46.661 1.00 0.00 H ATOM 5438 C16 PA 190 111.256 40.617 47.681 1.00 0.00 C ATOM 5439 H6R PA 190 111.870 40.016 47.007 1.00 0.00 H ATOM 5440 H6S PA 190 110.335 40.052 47.843 1.00 0.00 H ATOM 5441 C15 PA 190 112.035 40.691 49.005 1.00 0.00 C ATOM 5442 H5R PA 190 111.564 41.446 49.638 1.00 0.00 H ATOM 5443 H5S PA 190 113.006 41.119 48.745 1.00 0.00 H ATOM 5444 C14 PA 190 112.222 39.419 49.822 1.00 0.00 C ATOM 5445 H4R PA 190 111.280 38.961 50.131 1.00 0.00 H ATOM 5446 H4S PA 190 112.652 39.768 50.763 1.00 0.00 H ATOM 5447 C13 PA 190 113.126 38.348 49.149 1.00 0.00 C ATOM 5448 H3R PA 190 113.598 38.959 48.376 1.00 0.00 H ATOM 5449 H3S PA 190 112.503 37.626 48.617 1.00 0.00 H ATOM 5450 C12 PA 190 114.121 37.734 50.075 1.00 0.00 C ATOM 5451 H2R PA 190 114.785 38.540 50.394 1.00 0.00 H ATOM 5452 H2S PA 190 114.845 37.047 49.631 1.00 0.00 H ATOM 5453 C11 PGR 191 113.547 37.177 51.335 1.00 0.00 C ATOM 5454 O12 PGR 191 114.150 37.266 52.415 1.00 0.00 O ATOM 5455 O11 PGR 191 112.297 36.643 51.145 1.00 0.00 O ATOM 5456 C1 PGR 191 111.497 36.153 52.261 1.00 0.00 C ATOM 5457 HR PGR 191 112.096 35.402 52.782 1.00 0.00 H ATOM 5458 HS PGR 191 110.631 35.647 51.828 1.00 0.00 H ATOM 5459 C2 PGR 191 111.006 37.391 53.095 1.00 0.00 C ATOM 5460 HX PGR 191 111.933 37.919 53.329 1.00 0.00 H ATOM 5461 C3 PGR 191 110.125 37.141 54.347 1.00 0.00 C ATOM 5462 HA PGR 191 110.613 36.411 54.998 1.00 0.00 H ATOM 5463 HB PGR 191 109.180 36.789 53.927 1.00 0.00 H ATOM 5464 O31 PGR 191 109.892 38.319 55.097 1.00 0.00 O ATOM 5465 P31 PGR 191 111.093 39.003 55.838 1.00 0.00 P ATOM 5466 O32 PGR 191 111.559 40.060 54.715 1.00 0.00 O ATOM 5467 C31 PGR 191 110.847 41.309 54.583 1.00 0.00 C ATOM 5468 H1A PGR 191 109.775 41.171 54.744 1.00 0.00 H ATOM 5469 H1B PGR 191 111.010 41.554 53.530 1.00 0.00 H ATOM 5470 C32 PGR 191 111.369 42.331 55.609 1.00 0.00 C ATOM 5471 H2A PGR 191 112.447 42.212 55.743 1.00 0.00 H ATOM 5472 O35 PGR 191 110.573 42.334 56.862 1.00 0.00 O ATOM 5473 HO5A PGR 191 110.302 41.406 56.979 1.00 0.00 H ATOM 5474 C33 PGR 191 111.201 43.758 54.964 1.00 0.00 C ATOM 5475 H3A PGR 191 111.771 44.467 55.570 1.00 0.00 H ATOM 5476 H3B PGR 191 111.529 43.893 53.930 1.00 0.00 H ATOM 5477 O33 PGR 191 110.578 39.728 57.008 1.00 0.00 O ATOM 5478 O34 PGR 191 112.164 38.060 56.093 1.00 0.00 O ATOM 5479 O21 PGR 191 110.220 38.246 52.250 1.00 0.00 O ATOM 5480 C21 PGR 191 109.019 37.907 51.643 1.00 0.00 C ATOM 5481 O22 PGR 191 108.544 36.762 51.620 1.00 0.00 O ATOM 5482 O36 PGR 191 109.828 44.114 55.046 1.00 0.00 O ATOM 5483 HO6A PGR 191 109.277 43.420 54.643 1.00 0.00 H ATOM 5484 C12 OL 192 108.511 39.068 50.804 1.00 0.00 C ATOM 5485 H2R OL 192 109.254 39.070 50.003 1.00 0.00 H ATOM 5486 H2S OL 192 107.524 38.809 50.414 1.00 0.00 H ATOM 5487 C13 OL 192 108.432 40.444 51.496 1.00 0.00 C ATOM 5488 H3R OL 192 107.592 40.410 52.194 1.00 0.00 H ATOM 5489 H3S OL 192 109.281 40.621 52.160 1.00 0.00 H ATOM 5490 C14 OL 192 108.328 41.568 50.527 1.00 0.00 C ATOM 5491 H4R OL 192 108.437 42.550 50.992 1.00 0.00 H ATOM 5492 H4S OL 192 109.147 41.433 49.818 1.00 0.00 H ATOM 5493 C15 OL 192 106.960 41.538 49.788 1.00 0.00 C ATOM 5494 H5R OL 192 106.764 40.574 49.312 1.00 0.00 H ATOM 5495 H5S OL 192 106.216 41.745 50.560 1.00 0.00 H ATOM 5496 C16 OL 192 106.905 42.617 48.652 1.00 0.00 C ATOM 5497 H6R OL 192 107.911 42.612 48.227 1.00 0.00 H ATOM 5498 H6S OL 192 106.168 42.313 47.906 1.00 0.00 H ATOM 5499 C17 OL 192 106.617 44.000 49.166 1.00 0.00 C ATOM 5500 H7R OL 192 106.135 43.973 50.145 1.00 0.00 H ATOM 5501 H7S OL 192 107.582 44.503 49.254 1.00 0.00 H ATOM 5502 C18 OL 192 105.872 44.831 48.047 1.00 0.00 C ATOM 5503 H8R OL 192 106.509 45.130 47.213 1.00 0.00 H ATOM 5504 H8S OL 192 105.084 44.169 47.682 1.00 0.00 H ATOM 5505 C19 OL 192 105.306 46.030 48.588 1.00 0.00 C ATOM 5506 H9R OL 192 105.877 46.463 49.406 1.00 0.00 H ATOM 5507 C110 OL 192 104.186 46.679 48.216 1.00 0.00 C ATOM 5508 H10R OL 192 103.916 47.627 48.674 1.00 0.00 H ATOM 5509 C111 OL 192 103.376 46.377 46.932 1.00 0.00 C ATOM 5510 H11R OL 192 103.050 47.341 46.537 1.00 0.00 H ATOM 5511 H11S OL 192 103.937 45.815 46.182 1.00 0.00 H ATOM 5512 C112 OL 192 102.066 45.724 47.292 1.00 0.00 C ATOM 5513 H12R OL 192 102.240 44.803 47.853 1.00 0.00 H ATOM 5514 H12S OL 192 101.459 46.403 47.896 1.00 0.00 H ATOM 5515 C113 OL 192 101.242 45.486 46.049 1.00 0.00 C ATOM 5516 H13R OL 192 101.415 46.075 45.146 1.00 0.00 H ATOM 5517 H13S OL 192 101.423 44.488 45.646 1.00 0.00 H ATOM 5518 C114 OL 192 99.676 45.696 46.283 1.00 0.00 C ATOM 5519 H14R OL 192 99.421 46.607 46.828 1.00 0.00 H ATOM 5520 H14S OL 192 99.176 45.865 45.327 1.00 0.00 H ATOM 5521 C115 OL 192 99.012 44.551 47.104 1.00 0.00 C ATOM 5522 H15R OL 192 99.274 43.569 46.703 1.00 0.00 H ATOM 5523 H15S OL 192 99.549 44.587 48.054 1.00 0.00 H ATOM 5524 C116 OL 192 97.584 44.671 47.357 1.00 0.00 C ATOM 5525 H16R OL 192 97.339 44.021 48.199 1.00 0.00 H ATOM 5526 H16S OL 192 97.436 45.713 47.648 1.00 0.00 H ATOM 5527 C117 OL 192 96.544 44.427 46.183 1.00 0.00 C ATOM 5528 H17R OL 192 95.553 44.481 46.638 1.00 0.00 H ATOM 5529 H17S OL 192 96.581 45.232 45.446 1.00 0.00 H ATOM 5530 C118 OL 192 96.700 43.156 45.391 1.00 0.00 C ATOM 5531 H18R OL 192 97.752 42.959 45.176 1.00 0.00 H ATOM 5532 H18S OL 192 96.178 43.320 44.446 1.00 0.00 H ATOM 5533 H18T OL 192 96.315 42.280 45.916 1.00 0.00 H TER 5534 OL 192 ATOM 5534 C116 PA 193 35.692 66.856 44.526 1.00 0.00 C ATOM 5535 H16R PA 193 36.180 67.758 44.900 1.00 0.00 H ATOM 5536 H16S PA 193 36.383 66.506 43.756 1.00 0.00 H ATOM 5537 H16T PA 193 35.793 66.144 45.347 1.00 0.00 H ATOM 5538 C115 PA 193 34.257 67.153 44.005 1.00 0.00 C ATOM 5539 H15R PA 193 33.626 66.263 44.032 1.00 0.00 H ATOM 5540 H15S PA 193 34.378 67.339 42.936 1.00 0.00 H ATOM 5541 C114 PA 193 33.690 68.338 44.691 1.00 0.00 C ATOM 5542 H14R PA 193 32.751 68.654 44.231 1.00 0.00 H ATOM 5543 H14S PA 193 34.421 69.130 44.522 1.00 0.00 H ATOM 5544 C113 PA 193 33.524 68.084 46.172 1.00 0.00 C ATOM 5545 H13R PA 193 34.375 67.620 46.675 1.00 0.00 H ATOM 5546 H13S PA 193 32.801 67.290 46.369 1.00 0.00 H ATOM 5547 C112 PA 193 32.999 69.351 46.885 1.00 0.00 C ATOM 5548 H12R PA 193 32.160 69.787 46.339 1.00 0.00 H ATOM 5549 H12S PA 193 33.766 70.121 46.778 1.00 0.00 H ATOM 5550 C111 PA 193 32.739 69.051 48.393 1.00 0.00 C ATOM 5551 H11R PA 193 33.627 68.753 48.955 1.00 0.00 H ATOM 5552 H11S PA 193 32.114 68.157 48.332 1.00 0.00 H ATOM 5553 C110 PA 193 32.011 70.157 49.111 1.00 0.00 C ATOM 5554 H10R PA 193 30.975 70.155 48.767 1.00 0.00 H ATOM 5555 H10S PA 193 32.482 71.136 49.007 1.00 0.00 H ATOM 5556 C19 PA 193 31.773 69.947 50.645 1.00 0.00 C ATOM 5557 H9R PA 193 32.716 69.840 51.186 1.00 0.00 H ATOM 5558 H9S PA 193 31.440 68.956 50.961 1.00 0.00 H ATOM 5559 C18 PA 193 31.033 71.012 51.463 1.00 0.00 C ATOM 5560 H8R PA 193 29.987 70.958 51.156 1.00 0.00 H ATOM 5561 H8S PA 193 31.486 71.993 51.305 1.00 0.00 H ATOM 5562 C17 PA 193 30.983 70.773 52.970 1.00 0.00 C ATOM 5563 H7R PA 193 30.536 71.661 53.421 1.00 0.00 H ATOM 5564 H7S PA 193 32.029 70.742 53.281 1.00 0.00 H ATOM 5565 C16 PA 193 30.323 69.436 53.438 1.00 0.00 C ATOM 5566 H6R PA 193 30.954 68.600 53.132 1.00 0.00 H ATOM 5567 H6S PA 193 29.450 69.265 52.805 1.00 0.00 H ATOM 5568 C15 PA 193 30.085 69.244 54.942 1.00 0.00 C ATOM 5569 H5R PA 193 29.300 69.900 55.325 1.00 0.00 H ATOM 5570 H5S PA 193 31.010 69.484 55.470 1.00 0.00 H ATOM 5571 C14 PA 193 29.619 67.842 55.314 1.00 0.00 C ATOM 5572 H4R PA 193 30.008 67.095 54.618 1.00 0.00 H ATOM 5573 H4S PA 193 28.539 67.688 55.364 1.00 0.00 H ATOM 5574 C13 PA 193 30.179 67.338 56.599 1.00 0.00 C ATOM 5575 H3R PA 193 29.712 66.400 56.907 1.00 0.00 H ATOM 5576 H3S PA 193 29.860 68.130 57.280 1.00 0.00 H ATOM 5577 C12 PA 193 31.729 67.258 56.805 1.00 0.00 C ATOM 5578 H2R PA 193 32.241 68.179 56.516 1.00 0.00 H ATOM 5579 H2S PA 193 32.217 66.521 56.164 1.00 0.00 H ATOM 5580 C11 PC 194 32.090 66.934 58.266 1.00 0.00 C ATOM 5581 O12 PC 194 31.495 66.101 58.943 1.00 0.00 O ATOM 5582 O11 PC 194 33.094 67.742 58.754 1.00 0.00 O ATOM 5583 C1 PC 194 33.290 67.707 60.186 1.00 0.00 C ATOM 5584 HR PC 194 33.624 66.785 60.669 1.00 0.00 H ATOM 5585 HS PC 194 32.333 67.891 60.681 1.00 0.00 H ATOM 5586 C2 PC 194 34.387 68.763 60.429 1.00 0.00 C ATOM 5587 HX PC 194 35.273 68.317 59.970 1.00 0.00 H ATOM 5588 C3 PC 194 34.658 68.918 61.943 1.00 0.00 C ATOM 5589 HA PC 194 34.040 69.789 62.176 1.00 0.00 H ATOM 5590 HB PC 194 35.706 69.154 62.144 1.00 0.00 H ATOM 5591 O31 PC 194 34.156 67.936 62.783 1.00 0.00 O ATOM 5592 P31 PC 194 34.139 68.194 64.344 1.00 0.00 P ATOM 5593 O32 PC 194 35.642 68.507 64.561 1.00 0.00 O ATOM 5594 C31 PC 194 36.510 67.467 64.744 1.00 0.00 C ATOM 5595 H1A PC 194 36.524 66.748 63.921 1.00 0.00 H ATOM 5596 H1B PC 194 36.325 66.907 65.665 1.00 0.00 H ATOM 5597 C32 PC 194 37.940 68.015 64.750 1.00 0.00 C ATOM 5598 H2A PC 194 38.064 68.372 63.727 1.00 0.00 H ATOM 5599 H2B PC 194 38.702 67.247 64.893 1.00 0.00 H ATOM 5600 N31 PC 194 38.302 69.229 65.635 1.00 0.00 N ATOM 5601 C33 PC 194 37.435 70.414 65.512 1.00 0.00 C ATOM 5602 H3A PC 194 36.508 70.226 66.056 1.00 0.00 H ATOM 5603 H3B PC 194 37.146 70.596 64.477 1.00 0.00 H ATOM 5604 H3C PC 194 37.836 71.292 66.022 1.00 0.00 H ATOM 5605 C34 PC 194 38.178 68.809 67.081 1.00 0.00 C ATOM 5606 H4A PC 194 38.220 69.755 67.624 1.00 0.00 H ATOM 5607 H4B PC 194 38.951 68.121 67.427 1.00 0.00 H ATOM 5608 H4C PC 194 37.179 68.556 67.440 1.00 0.00 H ATOM 5609 C35 PC 194 39.687 69.611 65.335 1.00 0.00 C ATOM 5610 H5A PC 194 39.624 70.203 64.421 1.00 0.00 H ATOM 5611 H5B PC 194 40.297 68.751 65.056 1.00 0.00 H ATOM 5612 H5C PC 194 40.068 70.234 66.146 1.00 0.00 H ATOM 5613 O33 PC 194 33.466 69.473 64.661 1.00 0.00 O ATOM 5614 O34 PC 194 33.802 67.003 65.088 1.00 0.00 O ATOM 5615 O21 PC 194 33.888 70.012 59.879 1.00 0.00 O ATOM 5616 C21 PC 194 34.687 71.069 59.800 1.00 0.00 C ATOM 5617 O22 PC 194 35.882 71.113 60.057 1.00 0.00 O ATOM 5618 C12 OL 195 33.819 72.324 59.401 1.00 0.00 C ATOM 5619 H2R OL 195 33.031 72.133 58.670 1.00 0.00 H ATOM 5620 H2S OL 195 33.235 72.767 60.210 1.00 0.00 H ATOM 5621 C13 OL 195 34.721 73.354 58.688 1.00 0.00 C ATOM 5622 H3R OL 195 35.570 73.576 59.339 1.00 0.00 H ATOM 5623 H3S OL 195 35.113 72.809 57.827 1.00 0.00 H ATOM 5624 C14 OL 195 34.121 74.668 58.316 1.00 0.00 C ATOM 5625 H4R OL 195 33.679 75.082 59.225 1.00 0.00 H ATOM 5626 H4S OL 195 34.844 75.359 57.879 1.00 0.00 H ATOM 5627 C15 OL 195 33.186 74.523 57.152 1.00 0.00 C ATOM 5628 H5R OL 195 33.733 74.201 56.263 1.00 0.00 H ATOM 5629 H5S OL 195 32.442 73.739 57.308 1.00 0.00 H ATOM 5630 C16 OL 195 32.519 75.807 56.751 1.00 0.00 C ATOM 5631 H6R OL 195 32.311 76.413 57.635 1.00 0.00 H ATOM 5632 H6S OL 195 33.263 76.429 56.248 1.00 0.00 H ATOM 5633 C17 OL 195 31.428 75.796 55.723 1.00 0.00 C ATOM 5634 H7R OL 195 31.848 75.346 54.821 1.00 0.00 H ATOM 5635 H7S OL 195 30.639 75.264 56.258 1.00 0.00 H ATOM 5636 C18 OL 195 30.856 77.171 55.404 1.00 0.00 C ATOM 5637 H8R OL 195 30.518 77.623 56.339 1.00 0.00 H ATOM 5638 H8S OL 195 31.634 77.802 54.971 1.00 0.00 H ATOM 5639 C19 OL 195 29.834 77.185 54.336 1.00 0.00 C ATOM 5640 H9R OL 195 29.913 76.411 53.576 1.00 0.00 H ATOM 5641 C110 OL 195 28.831 78.066 54.311 1.00 0.00 C ATOM 5642 H10R OL 195 28.199 78.071 53.427 1.00 0.00 H ATOM 5643 C111 OL 195 28.450 79.238 55.239 1.00 0.00 C ATOM 5644 H11R OL 195 27.372 79.410 55.280 1.00 0.00 H ATOM 5645 H11S OL 195 28.673 78.836 56.229 1.00 0.00 H ATOM 5646 C112 OL 195 29.325 80.473 54.903 1.00 0.00 C ATOM 5647 H12R OL 195 29.443 81.221 55.690 1.00 0.00 H ATOM 5648 H12S OL 195 30.367 80.149 54.865 1.00 0.00 H ATOM 5649 C113 OL 195 28.999 80.977 53.464 1.00 0.00 C ATOM 5650 H13R OL 195 28.982 80.130 52.776 1.00 0.00 H ATOM 5651 H13S OL 195 28.018 81.457 53.487 1.00 0.00 H ATOM 5652 C114 OL 195 29.993 82.048 52.885 1.00 0.00 C ATOM 5653 H14R OL 195 30.087 82.864 53.605 1.00 0.00 H ATOM 5654 H14S OL 195 30.942 81.507 52.881 1.00 0.00 H ATOM 5655 C115 OL 195 29.613 82.531 51.458 1.00 0.00 C ATOM 5656 H15R OL 195 30.506 83.023 51.067 1.00 0.00 H ATOM 5657 H15S OL 195 29.440 81.630 50.864 1.00 0.00 H ATOM 5658 C116 OL 195 28.472 83.571 51.427 1.00 0.00 C ATOM 5659 H16R OL 195 27.721 83.343 52.186 1.00 0.00 H ATOM 5660 H16S OL 195 28.921 84.512 51.754 1.00 0.00 H ATOM 5661 C117 OL 195 27.853 83.750 50.056 1.00 0.00 C ATOM 5662 H17R OL 195 27.173 84.603 50.108 1.00 0.00 H ATOM 5663 H17S OL 195 28.625 84.084 49.360 1.00 0.00 H ATOM 5664 C118 OL 195 27.193 82.569 49.358 1.00 0.00 C ATOM 5665 H18R OL 195 26.486 81.840 49.760 1.00 0.00 H ATOM 5666 H18S OL 195 27.975 81.863 49.072 1.00 0.00 H ATOM 5667 H18T OL 195 26.717 82.971 48.461 1.00 0.00 H TER 5668 OL 195 ATOM 5668 C116 PA 196 33.375 65.737 39.740 1.00 0.00 C ATOM 5669 H16R PA 196 34.255 66.385 39.729 1.00 0.00 H ATOM 5670 H16S PA 196 33.449 65.002 38.936 1.00 0.00 H ATOM 5671 H16T PA 196 33.388 65.207 40.695 1.00 0.00 H ATOM 5672 C115 PA 196 32.084 66.560 39.682 1.00 0.00 C ATOM 5673 H15R PA 196 31.233 65.877 39.714 1.00 0.00 H ATOM 5674 H15S PA 196 32.081 67.137 38.754 1.00 0.00 H ATOM 5675 C114 PA 196 31.899 67.606 40.924 1.00 0.00 C ATOM 5676 H14R PA 196 32.816 68.099 41.254 1.00 0.00 H ATOM 5677 H14S PA 196 31.626 66.983 41.779 1.00 0.00 H ATOM 5678 C113 PA 196 30.684 68.475 40.647 1.00 0.00 C ATOM 5679 H13R PA 196 29.835 67.865 40.332 1.00 0.00 H ATOM 5680 H13S PA 196 30.886 69.143 39.808 1.00 0.00 H ATOM 5681 C112 PA 196 30.311 69.397 41.860 1.00 0.00 C ATOM 5682 H12R PA 196 29.587 70.089 41.426 1.00 0.00 H ATOM 5683 H12S PA 196 31.161 70.032 42.117 1.00 0.00 H ATOM 5684 C111 PA 196 29.854 68.517 43.085 1.00 0.00 C ATOM 5685 H11R PA 196 30.535 67.734 43.425 1.00 0.00 H ATOM 5686 H11S PA 196 28.938 68.003 42.785 1.00 0.00 H ATOM 5687 C110 PA 196 29.490 69.314 44.313 1.00 0.00 C ATOM 5688 H10R PA 196 28.762 70.095 44.082 1.00 0.00 H ATOM 5689 H10S PA 196 30.359 69.853 44.696 1.00 0.00 H ATOM 5690 C19 PA 196 28.767 68.485 45.376 1.00 0.00 C ATOM 5691 H9R PA 196 29.422 67.655 45.648 1.00 0.00 H ATOM 5692 H9S PA 196 27.895 67.941 45.008 1.00 0.00 H ATOM 5693 C18 PA 196 28.446 69.368 46.590 1.00 0.00 C ATOM 5694 H8R PA 196 27.711 70.095 46.238 1.00 0.00 H ATOM 5695 H8S PA 196 29.349 69.923 46.852 1.00 0.00 H ATOM 5696 C17 PA 196 28.051 68.712 47.844 1.00 0.00 C ATOM 5697 H7R PA 196 27.020 68.384 47.698 1.00 0.00 H ATOM 5698 H7S PA 196 27.945 69.526 48.565 1.00 0.00 H ATOM 5699 C16 PA 196 29.098 67.723 48.436 1.00 0.00 C ATOM 5700 H6R PA 196 30.079 68.187 48.560 1.00 0.00 H ATOM 5701 H6S PA 196 29.178 66.915 47.706 1.00 0.00 H ATOM 5702 C15 PA 196 28.692 67.154 49.848 1.00 0.00 C ATOM 5703 H5R PA 196 27.826 66.517 49.653 1.00 0.00 H ATOM 5704 H5S PA 196 28.329 67.925 50.530 1.00 0.00 H ATOM 5705 C14 PA 196 29.824 66.360 50.466 1.00 0.00 C ATOM 5706 H4R PA 196 30.676 66.988 50.735 1.00 0.00 H ATOM 5707 H4S PA 196 30.280 65.736 49.695 1.00 0.00 H ATOM 5708 C13 PA 196 29.416 65.513 51.694 1.00 0.00 C ATOM 5709 H3R PA 196 28.595 64.834 51.457 1.00 0.00 H ATOM 5710 H3S PA 196 29.065 66.190 52.475 1.00 0.00 H ATOM 5711 C12 PA 196 30.652 64.747 52.238 1.00 0.00 C ATOM 5712 H2R PA 196 31.462 65.398 52.574 1.00 0.00 H ATOM 5713 H2S PA 196 30.952 64.075 51.431 1.00 0.00 H ATOM 5714 C11 PGR 197 30.095 64.010 53.465 1.00 0.00 C ATOM 5715 O12 PGR 197 29.227 63.180 53.416 1.00 0.00 O ATOM 5716 O11 PGR 197 30.766 64.380 54.567 1.00 0.00 O ATOM 5717 C1 PGR 197 30.435 63.850 55.863 1.00 0.00 C ATOM 5718 HR PGR 197 29.355 63.883 56.031 1.00 0.00 H ATOM 5719 HS PGR 197 30.876 64.559 56.568 1.00 0.00 H ATOM 5720 C2 PGR 197 31.007 62.463 56.117 1.00 0.00 C ATOM 5721 HX PGR 197 30.721 61.763 55.328 1.00 0.00 H ATOM 5722 C3 PGR 197 30.474 61.861 57.459 1.00 0.00 C ATOM 5723 HA PGR 197 31.163 61.014 57.513 1.00 0.00 H ATOM 5724 HB PGR 197 29.436 61.543 57.328 1.00 0.00 H ATOM 5725 O31 PGR 197 30.503 62.827 58.494 1.00 0.00 O ATOM 5726 P31 PGR 197 30.563 62.258 60.025 1.00 0.00 P ATOM 5727 O32 PGR 197 32.060 62.002 60.150 1.00 0.00 O ATOM 5728 C31 PGR 197 32.935 63.194 60.241 1.00 0.00 C ATOM 5729 H1A PGR 197 32.971 63.568 61.267 1.00 0.00 H ATOM 5730 H1B PGR 197 32.631 63.899 59.463 1.00 0.00 H ATOM 5731 C32 PGR 197 34.360 62.828 59.887 1.00 0.00 C ATOM 5732 H2A PGR 197 34.974 63.731 59.917 1.00 0.00 H ATOM 5733 O35 PGR 197 34.346 62.322 58.501 1.00 0.00 O ATOM 5734 HO5A PGR 197 33.711 61.587 58.577 1.00 0.00 H ATOM 5735 C33 PGR 197 34.917 61.769 60.803 1.00 0.00 C ATOM 5736 H3A PGR 197 34.824 62.030 61.860 1.00 0.00 H ATOM 5737 H3B PGR 197 34.404 60.812 60.680 1.00 0.00 H ATOM 5738 O33 PGR 197 30.036 63.244 61.003 1.00 0.00 O ATOM 5739 O34 PGR 197 29.905 60.963 59.982 1.00 0.00 O ATOM 5740 O21 PGR 197 32.438 62.654 56.230 1.00 0.00 O ATOM 5741 C21 PGR 197 33.183 62.601 55.112 1.00 0.00 C ATOM 5742 O22 PGR 197 32.775 62.166 53.991 1.00 0.00 O ATOM 5743 O36 PGR 197 36.297 61.696 60.442 1.00 0.00 O ATOM 5744 HO6A PGR 197 36.292 61.716 59.469 1.00 0.00 H ATOM 5745 C12 OL 198 34.604 63.131 55.213 1.00 0.00 C ATOM 5746 H2R OL 198 34.865 63.179 56.272 1.00 0.00 H ATOM 5747 H2S OL 198 35.318 62.370 54.892 1.00 0.00 H ATOM 5748 C13 OL 198 34.895 64.517 54.766 1.00 0.00 C ATOM 5749 H3R OL 198 34.285 65.311 55.202 1.00 0.00 H ATOM 5750 H3S OL 198 35.907 64.742 55.107 1.00 0.00 H ATOM 5751 C14 OL 198 34.821 64.636 53.249 1.00 0.00 C ATOM 5752 H4R OL 198 35.478 63.879 52.816 1.00 0.00 H ATOM 5753 H4S OL 198 33.796 64.449 52.920 1.00 0.00 H ATOM 5754 C15 OL 198 35.210 65.956 52.592 1.00 0.00 C ATOM 5755 H5R OL 198 34.874 66.819 53.169 1.00 0.00 H ATOM 5756 H5S OL 198 36.301 66.009 52.621 1.00 0.00 H ATOM 5757 C16 OL 198 34.807 66.164 51.111 1.00 0.00 C ATOM 5758 H6R OL 198 33.740 66.374 51.204 1.00 0.00 H ATOM 5759 H6S OL 198 35.273 67.109 50.823 1.00 0.00 H ATOM 5760 C17 OL 198 35.044 65.019 50.149 1.00 0.00 C ATOM 5761 H7R OL 198 36.134 65.021 50.215 1.00 0.00 H ATOM 5762 H7S OL 198 34.679 64.096 50.604 1.00 0.00 H ATOM 5763 C18 OL 198 34.482 65.268 48.825 1.00 0.00 C ATOM 5764 H8R OL 198 33.403 65.408 48.919 1.00 0.00 H ATOM 5765 H8S OL 198 34.960 66.162 48.419 1.00 0.00 H ATOM 5766 C19 OL 198 34.747 64.195 47.810 1.00 0.00 C ATOM 5767 H9R OL 198 35.650 64.454 47.263 1.00 0.00 H ATOM 5768 C110 OL 198 34.007 63.182 47.385 1.00 0.00 C ATOM 5769 H10R OL 198 34.299 62.654 46.481 1.00 0.00 H ATOM 5770 C111 OL 198 32.736 62.699 48.039 1.00 0.00 C ATOM 5771 H11R OL 198 32.809 62.744 49.127 1.00 0.00 H ATOM 5772 H11S OL 198 31.973 63.415 47.725 1.00 0.00 H ATOM 5773 C112 OL 198 32.414 61.205 47.720 1.00 0.00 C ATOM 5774 H12R OL 198 33.302 60.571 47.668 1.00 0.00 H ATOM 5775 H12S OL 198 31.990 60.703 48.592 1.00 0.00 H ATOM 5776 C113 OL 198 31.595 61.042 46.448 1.00 0.00 C ATOM 5777 H13R OL 198 30.929 61.900 46.331 1.00 0.00 H ATOM 5778 H13S OL 198 32.249 60.991 45.576 1.00 0.00 H ATOM 5779 C114 OL 198 30.705 59.864 46.553 1.00 0.00 C ATOM 5780 H14R OL 198 31.311 58.973 46.731 1.00 0.00 H ATOM 5781 H14S OL 198 30.062 59.852 47.436 1.00 0.00 H ATOM 5782 C115 OL 198 29.816 59.809 45.370 1.00 0.00 C ATOM 5783 H15R OL 198 29.230 60.727 45.452 1.00 0.00 H ATOM 5784 H15S OL 198 30.295 59.861 44.390 1.00 0.00 H ATOM 5785 C116 OL 198 28.787 58.636 45.383 1.00 0.00 C ATOM 5786 H16R OL 198 29.263 57.663 45.516 1.00 0.00 H ATOM 5787 H16S OL 198 28.240 58.658 46.328 1.00 0.00 H ATOM 5788 C117 OL 198 27.817 58.596 44.261 1.00 0.00 C ATOM 5789 H17R OL 198 26.849 58.339 44.697 1.00 0.00 H ATOM 5790 H17S OL 198 27.705 59.637 43.951 1.00 0.00 H ATOM 5791 C118 OL 198 28.427 57.653 43.166 1.00 0.00 C ATOM 5792 H18R OL 198 28.582 56.662 43.596 1.00 0.00 H ATOM 5793 H18S OL 198 29.408 58.058 42.907 1.00 0.00 H ATOM 5794 H18T OL 198 27.804 57.757 42.275 1.00 0.00 H TER 5795 OL 198 ATOM 5795 C116 PA 199 105.411 96.994 43.111 1.00 0.00 C ATOM 5796 H16R PA 199 104.464 96.748 43.596 1.00 0.00 H ATOM 5797 H16S PA 199 105.930 96.049 42.941 1.00 0.00 H ATOM 5798 H16T PA 199 105.018 97.360 42.160 1.00 0.00 H ATOM 5799 C115 PA 199 106.401 97.925 43.777 1.00 0.00 C ATOM 5800 H15R PA 199 107.347 97.891 43.232 1.00 0.00 H ATOM 5801 H15S PA 199 106.665 97.685 44.809 1.00 0.00 H ATOM 5802 C114 PA 199 106.135 99.358 43.755 1.00 0.00 C ATOM 5803 H14R PA 199 106.512 99.828 42.844 1.00 0.00 H ATOM 5804 H14S PA 199 106.799 99.886 44.442 1.00 0.00 H ATOM 5805 C113 PA 199 104.616 99.845 43.766 1.00 0.00 C ATOM 5806 H13R PA 199 104.165 99.387 42.883 1.00 0.00 H ATOM 5807 H13S PA 199 104.576 100.930 43.648 1.00 0.00 H ATOM 5808 C112 PA 199 103.819 99.540 45.060 1.00 0.00 C ATOM 5809 H12R PA 199 103.967 100.209 45.910 1.00 0.00 H ATOM 5810 H12S PA 199 104.249 98.599 45.410 1.00 0.00 H ATOM 5811 C111 PA 199 102.395 99.394 44.771 1.00 0.00 C ATOM 5812 H11R PA 199 102.213 99.401 43.694 1.00 0.00 H ATOM 5813 H11S PA 199 101.983 100.366 45.052 1.00 0.00 H ATOM 5814 C110 PA 199 101.759 98.171 45.337 1.00 0.00 C ATOM 5815 H10R PA 199 102.321 97.284 45.037 1.00 0.00 H ATOM 5816 H10S PA 199 100.835 98.042 44.769 1.00 0.00 H ATOM 5817 C19 PA 199 101.671 98.295 46.871 1.00 0.00 C ATOM 5818 H9R PA 199 101.075 99.162 47.162 1.00 0.00 H ATOM 5819 H9S PA 199 102.675 98.551 47.216 1.00 0.00 H ATOM 5820 C18 PA 199 101.229 97.028 47.563 1.00 0.00 C ATOM 5821 H8R PA 199 101.387 96.153 46.928 1.00 0.00 H ATOM 5822 H8S PA 199 100.144 96.917 47.521 1.00 0.00 H ATOM 5823 C17 PA 199 101.825 96.752 48.980 1.00 0.00 C ATOM 5824 H7R PA 199 101.668 95.742 49.365 1.00 0.00 H ATOM 5825 H7S PA 199 101.223 97.224 49.760 1.00 0.00 H ATOM 5826 C16 PA 199 103.362 96.973 49.210 1.00 0.00 C ATOM 5827 H6R PA 199 103.654 98.020 49.112 1.00 0.00 H ATOM 5828 H6S PA 199 103.877 96.525 48.358 1.00 0.00 H ATOM 5829 C15 PA 199 103.941 96.227 50.337 1.00 0.00 C ATOM 5830 H5R PA 199 103.533 95.217 50.417 1.00 0.00 H ATOM 5831 H5S PA 199 103.542 96.716 51.228 1.00 0.00 H ATOM 5832 C14 PA 199 105.428 96.360 50.564 1.00 0.00 C ATOM 5833 H4R PA 199 105.733 97.408 50.609 1.00 0.00 H ATOM 5834 H4S PA 199 105.841 95.806 49.718 1.00 0.00 H ATOM 5835 C13 PA 199 105.921 95.631 51.795 1.00 0.00 C ATOM 5836 H3R PA 199 105.806 96.229 52.701 1.00 0.00 H ATOM 5837 H3S PA 199 107.006 95.503 51.789 1.00 0.00 H ATOM 5838 C12 PA 199 105.337 94.233 51.949 1.00 0.00 C ATOM 5839 H2R PA 199 105.659 93.542 51.166 1.00 0.00 H ATOM 5840 H2S PA 199 104.258 94.072 51.970 1.00 0.00 H ATOM 5841 C11 PGR 200 105.787 93.573 53.248 1.00 0.00 C ATOM 5842 O12 PGR 200 106.692 94.011 53.903 1.00 0.00 O ATOM 5843 O11 PGR 200 105.023 92.537 53.568 1.00 0.00 O ATOM 5844 C1 PGR 200 105.300 91.884 54.859 1.00 0.00 C ATOM 5845 HR PGR 200 105.211 92.756 55.512 1.00 0.00 H ATOM 5846 HS PGR 200 106.293 91.428 54.876 1.00 0.00 H ATOM 5847 C2 PGR 200 104.144 90.825 55.081 1.00 0.00 C ATOM 5848 HX PGR 200 103.195 91.347 55.228 1.00 0.00 H ATOM 5849 C3 PGR 200 104.430 90.183 56.438 1.00 0.00 C ATOM 5850 HA PGR 200 103.784 89.375 56.792 1.00 0.00 H ATOM 5851 HB PGR 200 104.183 90.972 57.152 1.00 0.00 H ATOM 5852 O31 PGR 200 105.752 89.894 56.723 1.00 0.00 O ATOM 5853 P31 PGR 200 106.184 89.707 58.233 1.00 0.00 P ATOM 5854 O32 PGR 200 105.395 88.470 58.715 1.00 0.00 O ATOM 5855 C31 PGR 200 105.691 87.156 58.195 1.00 0.00 C ATOM 5856 H1A PGR 200 106.687 86.888 58.555 1.00 0.00 H ATOM 5857 H1B PGR 200 105.825 87.192 57.111 1.00 0.00 H ATOM 5858 C32 PGR 200 104.606 86.150 58.760 1.00 0.00 C ATOM 5859 H2A PGR 200 104.767 85.205 58.234 1.00 0.00 H ATOM 5860 O35 PGR 200 103.406 86.535 58.233 1.00 0.00 O ATOM 5861 HO5A PGR 200 102.931 87.238 58.712 1.00 0.00 H ATOM 5862 C33 PGR 200 104.767 86.191 60.303 1.00 0.00 C ATOM 5863 H3A PGR 200 105.814 86.058 60.589 1.00 0.00 H ATOM 5864 H3B PGR 200 104.376 87.127 60.709 1.00 0.00 H ATOM 5865 O33 PGR 200 107.659 89.536 58.258 1.00 0.00 O ATOM 5866 O34 PGR 200 105.707 90.865 59.046 1.00 0.00 O ATOM 5867 O21 PGR 200 104.034 89.821 54.079 1.00 0.00 O ATOM 5868 C21 PGR 200 105.158 89.208 53.589 1.00 0.00 C ATOM 5869 O22 PGR 200 106.256 89.389 54.065 1.00 0.00 O ATOM 5870 O36 PGR 200 104.150 84.973 60.804 1.00 0.00 O ATOM 5871 HO6A PGR 200 103.258 85.254 61.075 1.00 0.00 H ATOM 5872 C12 OL 201 104.807 88.229 52.510 1.00 0.00 C ATOM 5873 H2R OL 201 103.969 87.600 52.819 1.00 0.00 H ATOM 5874 H2S OL 201 104.440 88.705 51.599 1.00 0.00 H ATOM 5875 C13 OL 201 105.998 87.259 52.160 1.00 0.00 C ATOM 5876 H3R OL 201 106.888 87.891 52.129 1.00 0.00 H ATOM 5877 H3S OL 201 106.196 86.493 52.914 1.00 0.00 H ATOM 5878 C14 OL 201 105.932 86.660 50.740 1.00 0.00 C ATOM 5879 H4R OL 201 106.810 86.102 50.407 1.00 0.00 H ATOM 5880 H4S OL 201 105.200 85.856 50.641 1.00 0.00 H ATOM 5881 C15 OL 201 106.030 87.774 49.672 1.00 0.00 C ATOM 5882 H5R OL 201 105.200 88.459 49.856 1.00 0.00 H ATOM 5883 H5S OL 201 106.889 88.443 49.755 1.00 0.00 H ATOM 5884 C16 OL 201 106.078 87.272 48.257 1.00 0.00 C ATOM 5885 H6R OL 201 106.820 86.472 48.196 1.00 0.00 H ATOM 5886 H6S OL 201 105.131 86.741 48.146 1.00 0.00 H ATOM 5887 C17 OL 201 106.256 88.261 47.098 1.00 0.00 C ATOM 5888 H7R OL 201 105.575 89.112 47.025 1.00 0.00 H ATOM 5889 H7S OL 201 107.232 88.747 47.162 1.00 0.00 H ATOM 5890 C18 OL 201 106.308 87.480 45.781 1.00 0.00 C ATOM 5891 H8R OL 201 107.142 86.777 45.829 1.00 0.00 H ATOM 5892 H8S OL 201 105.418 86.852 45.707 1.00 0.00 H ATOM 5893 C19 OL 201 106.593 88.361 44.554 1.00 0.00 C ATOM 5894 H9R OL 201 107.431 89.045 44.657 1.00 0.00 H ATOM 5895 C110 OL 201 106.022 88.334 43.290 1.00 0.00 C ATOM 5896 H10R OL 201 106.374 89.038 42.540 1.00 0.00 H ATOM 5897 C111 OL 201 104.824 87.511 42.953 1.00 0.00 C ATOM 5898 H11R OL 201 105.147 86.708 42.288 1.00 0.00 H ATOM 5899 H11S OL 201 104.384 87.047 43.838 1.00 0.00 H ATOM 5900 C112 OL 201 103.848 88.438 42.306 1.00 0.00 C ATOM 5901 H12R OL 201 103.534 89.222 42.999 1.00 0.00 H ATOM 5902 H12S OL 201 104.335 88.880 41.435 1.00 0.00 H ATOM 5903 C113 OL 201 102.552 87.624 41.882 1.00 0.00 C ATOM 5904 H13R OL 201 102.850 86.827 41.197 1.00 0.00 H ATOM 5905 H13S OL 201 102.199 87.094 42.769 1.00 0.00 H ATOM 5906 C114 OL 201 101.476 88.502 41.385 1.00 0.00 C ATOM 5907 H14R OL 201 101.108 89.099 42.222 1.00 0.00 H ATOM 5908 H14S OL 201 101.752 89.115 40.525 1.00 0.00 H ATOM 5909 C115 OL 201 100.325 87.713 40.857 1.00 0.00 C ATOM 5910 H15R OL 201 100.001 87.039 41.653 1.00 0.00 H ATOM 5911 H15S OL 201 99.524 88.415 40.613 1.00 0.00 H ATOM 5912 C116 OL 201 100.615 86.795 39.575 1.00 0.00 C ATOM 5913 H16R OL 201 101.555 87.050 39.082 1.00 0.00 H ATOM 5914 H16S OL 201 100.747 85.766 39.916 1.00 0.00 H ATOM 5915 C117 OL 201 99.499 86.785 38.544 1.00 0.00 C ATOM 5916 H17R OL 201 98.506 86.637 38.976 1.00 0.00 H ATOM 5917 H17S OL 201 99.508 87.701 37.950 1.00 0.00 H ATOM 5918 C118 OL 201 99.678 85.710 37.455 1.00 0.00 C ATOM 5919 H18R OL 201 100.734 85.591 37.202 1.00 0.00 H ATOM 5920 H18S OL 201 99.132 86.025 36.564 1.00 0.00 H ATOM 5921 H18T OL 201 99.359 84.687 37.661 1.00 0.00 H TER 5922 OL 201 ATOM 5922 C116 PA 202 97.336 65.944 41.470 1.00 0.00 C ATOM 5923 H16R PA 202 98.008 66.311 42.248 1.00 0.00 H ATOM 5924 H16S PA 202 97.383 66.807 40.802 1.00 0.00 H ATOM 5925 H16T PA 202 97.796 65.125 40.912 1.00 0.00 H ATOM 5926 C115 PA 202 95.915 65.594 41.963 1.00 0.00 C ATOM 5927 H15R PA 202 95.152 65.673 41.186 1.00 0.00 H ATOM 5928 H15S PA 202 95.697 66.451 42.604 1.00 0.00 H ATOM 5929 C114 PA 202 95.854 64.325 42.721 1.00 0.00 C ATOM 5930 H14R PA 202 96.313 64.403 43.709 1.00 0.00 H ATOM 5931 H14S PA 202 96.376 63.517 42.204 1.00 0.00 H ATOM 5932 C113 PA 202 94.374 63.856 42.966 1.00 0.00 C ATOM 5933 H13R PA 202 93.984 63.536 41.998 1.00 0.00 H ATOM 5934 H13S PA 202 93.782 64.743 43.201 1.00 0.00 H ATOM 5935 C112 PA 202 94.049 62.947 44.141 1.00 0.00 C ATOM 5936 H12R PA 202 94.555 61.993 43.974 1.00 0.00 H ATOM 5937 H12S PA 202 92.996 62.657 44.146 1.00 0.00 H ATOM 5938 C111 PA 202 94.346 63.509 45.523 1.00 0.00 C ATOM 5939 H11R PA 202 93.490 64.125 45.807 1.00 0.00 H ATOM 5940 H11S PA 202 95.191 64.199 45.483 1.00 0.00 H ATOM 5941 C110 PA 202 94.396 62.450 46.653 1.00 0.00 C ATOM 5942 H10R PA 202 94.962 61.623 46.218 1.00 0.00 H ATOM 5943 H10S PA 202 93.399 62.112 46.942 1.00 0.00 H ATOM 5944 C19 PA 202 95.094 63.077 47.851 1.00 0.00 C ATOM 5945 H9R PA 202 96.128 63.364 47.649 1.00 0.00 H ATOM 5946 H9S PA 202 95.281 62.237 48.524 1.00 0.00 H ATOM 5947 C18 PA 202 94.380 64.295 48.575 1.00 0.00 C ATOM 5948 H8R PA 202 93.524 63.959 49.164 1.00 0.00 H ATOM 5949 H8S PA 202 93.973 64.998 47.845 1.00 0.00 H ATOM 5950 C17 PA 202 95.173 65.070 49.480 1.00 0.00 C ATOM 5951 H7R PA 202 95.935 65.554 48.865 1.00 0.00 H ATOM 5952 H7S PA 202 95.762 64.490 50.193 1.00 0.00 H ATOM 5953 C16 PA 202 94.367 66.165 50.245 1.00 0.00 C ATOM 5954 H6R PA 202 93.460 66.386 49.679 1.00 0.00 H ATOM 5955 H6S PA 202 94.984 67.066 50.254 1.00 0.00 H ATOM 5956 C15 PA 202 93.918 65.759 51.655 1.00 0.00 C ATOM 5957 H5R PA 202 93.260 64.908 51.467 1.00 0.00 H ATOM 5958 H5S PA 202 93.186 66.510 51.959 1.00 0.00 H ATOM 5959 C14 PA 202 95.037 65.630 52.661 1.00 0.00 C ATOM 5960 H4R PA 202 95.578 66.578 52.624 1.00 0.00 H ATOM 5961 H4S PA 202 95.780 64.873 52.403 1.00 0.00 H ATOM 5962 C13 PA 202 94.308 65.288 54.038 1.00 0.00 C ATOM 5963 H3R PA 202 93.881 64.289 53.920 1.00 0.00 H ATOM 5964 H3S PA 202 93.465 65.963 54.197 1.00 0.00 H ATOM 5965 C12 PA 202 95.247 65.060 55.229 1.00 0.00 C ATOM 5966 H2R PA 202 95.738 65.973 55.573 1.00 0.00 H ATOM 5967 H2S PA 202 96.136 64.464 55.012 1.00 0.00 H ATOM 5968 C11 PGR 203 94.545 64.360 56.283 1.00 0.00 C ATOM 5969 O12 PGR 203 93.960 63.308 56.191 1.00 0.00 O ATOM 5970 O11 PGR 203 94.432 65.225 57.334 1.00 0.00 O ATOM 5971 C1 PGR 203 93.631 64.843 58.422 1.00 0.00 C ATOM 5972 HR PGR 203 94.165 65.192 59.309 1.00 0.00 H ATOM 5973 HS PGR 203 93.720 63.757 58.510 1.00 0.00 H ATOM 5974 C2 PGR 203 92.158 65.270 58.285 1.00 0.00 C ATOM 5975 HX PGR 203 92.121 66.356 58.167 1.00 0.00 H ATOM 5976 C3 PGR 203 91.440 64.764 59.506 1.00 0.00 C ATOM 5977 HA PGR 203 90.384 65.048 59.524 1.00 0.00 H ATOM 5978 HB PGR 203 91.829 65.445 60.267 1.00 0.00 H ATOM 5979 O31 PGR 203 91.539 63.377 59.911 1.00 0.00 O ATOM 5980 P31 PGR 203 90.778 62.904 61.193 1.00 0.00 P ATOM 5981 O32 PGR 203 91.400 63.634 62.392 1.00 0.00 O ATOM 5982 C31 PGR 203 92.667 63.371 62.840 1.00 0.00 C ATOM 5983 H1A PGR 203 93.391 63.376 62.022 1.00 0.00 H ATOM 5984 H1B PGR 203 92.679 62.384 63.311 1.00 0.00 H ATOM 5985 C32 PGR 203 93.228 64.460 63.784 1.00 0.00 C ATOM 5986 H2A PGR 203 92.571 64.629 64.641 1.00 0.00 H ATOM 5987 O35 PGR 203 93.454 65.676 63.030 1.00 0.00 O ATOM 5988 HO5A PGR 203 92.562 66.051 62.921 1.00 0.00 H ATOM 5989 C33 PGR 203 94.635 64.048 64.250 1.00 0.00 C ATOM 5990 H3A PGR 203 95.121 64.851 64.811 1.00 0.00 H ATOM 5991 H3B PGR 203 94.564 63.080 64.752 1.00 0.00 H ATOM 5992 O33 PGR 203 89.399 63.495 61.040 1.00 0.00 O ATOM 5993 O34 PGR 203 90.929 61.454 61.427 1.00 0.00 O ATOM 5994 O21 PGR 203 91.567 64.734 57.066 1.00 0.00 O ATOM 5995 C21 PGR 203 90.485 65.392 56.628 1.00 0.00 C ATOM 5996 O22 PGR 203 90.119 66.535 56.893 1.00 0.00 O ATOM 5997 O36 PGR 203 95.496 63.862 63.124 1.00 0.00 O ATOM 5998 HO6A PGR 203 95.242 63.113 62.556 1.00 0.00 H ATOM 5999 C12 OL 204 89.739 64.614 55.600 1.00 0.00 C ATOM 6000 H2R OL 204 89.849 63.581 55.937 1.00 0.00 H ATOM 6001 H2S OL 204 88.697 64.931 55.519 1.00 0.00 H ATOM 6002 C13 OL 204 90.311 64.569 54.160 1.00 0.00 C ATOM 6003 H3R OL 204 91.235 63.992 54.243 1.00 0.00 H ATOM 6004 H3S OL 204 89.727 64.059 53.391 1.00 0.00 H ATOM 6005 C14 OL 204 90.620 65.932 53.619 1.00 0.00 C ATOM 6006 H4R OL 204 91.273 66.472 54.309 1.00 0.00 H ATOM 6007 H4S OL 204 91.059 65.664 52.656 1.00 0.00 H ATOM 6008 C15 OL 204 89.444 66.849 53.324 1.00 0.00 C ATOM 6009 H5R OL 204 88.950 67.273 54.201 1.00 0.00 H ATOM 6010 H5S OL 204 89.743 67.697 52.705 1.00 0.00 H ATOM 6011 C16 OL 204 88.357 66.131 52.507 1.00 0.00 C ATOM 6012 H6R OL 204 87.941 65.274 53.040 1.00 0.00 H ATOM 6013 H6S OL 204 87.544 66.845 52.359 1.00 0.00 H ATOM 6014 C17 OL 204 88.681 65.539 51.101 1.00 0.00 C ATOM 6015 H7R OL 204 89.116 66.296 50.445 1.00 0.00 H ATOM 6016 H7S OL 204 89.355 64.694 51.260 1.00 0.00 H ATOM 6017 C18 OL 204 87.528 64.903 50.369 1.00 0.00 C ATOM 6018 H8R OL 204 87.753 64.068 49.702 1.00 0.00 H ATOM 6019 H8S OL 204 86.906 64.432 51.132 1.00 0.00 H ATOM 6020 C19 OL 204 86.763 65.952 49.560 1.00 0.00 C ATOM 6021 H9R OL 204 85.913 66.421 50.049 1.00 0.00 H ATOM 6022 C110 OL 204 86.927 66.234 48.260 1.00 0.00 C ATOM 6023 H10R OL 204 86.274 66.952 47.769 1.00 0.00 H ATOM 6024 C111 OL 204 88.116 65.816 47.471 1.00 0.00 C ATOM 6025 H11R OL 204 88.463 66.761 47.046 1.00 0.00 H ATOM 6026 H11S OL 204 88.839 65.354 48.145 1.00 0.00 H ATOM 6027 C112 OL 204 87.799 64.936 46.261 1.00 0.00 C ATOM 6028 H12R OL 204 87.256 64.082 46.672 1.00 0.00 H ATOM 6029 H12S OL 204 87.078 65.534 45.701 1.00 0.00 H ATOM 6030 C113 OL 204 88.947 64.372 45.445 1.00 0.00 C ATOM 6031 H13R OL 204 89.624 65.097 44.989 1.00 0.00 H ATOM 6032 H13S OL 204 89.653 63.952 46.164 1.00 0.00 H ATOM 6033 C114 OL 204 88.425 63.236 44.520 1.00 0.00 C ATOM 6034 H14R OL 204 87.831 62.455 45.000 1.00 0.00 H ATOM 6035 H14S OL 204 87.680 63.496 43.765 1.00 0.00 H ATOM 6036 C115 OL 204 89.474 62.514 43.667 1.00 0.00 C ATOM 6037 H15R OL 204 90.154 62.018 44.363 1.00 0.00 H ATOM 6038 H15S OL 204 88.832 61.861 43.073 1.00 0.00 H ATOM 6039 C116 OL 204 90.245 63.364 42.693 1.00 0.00 C ATOM 6040 H16R OL 204 89.589 64.102 42.228 1.00 0.00 H ATOM 6041 H16S OL 204 90.858 63.984 43.350 1.00 0.00 H ATOM 6042 C117 OL 204 90.820 62.674 41.501 1.00 0.00 C ATOM 6043 H17R OL 204 91.606 61.985 41.817 1.00 0.00 H ATOM 6044 H17S OL 204 90.066 62.216 40.857 1.00 0.00 H ATOM 6045 C118 OL 204 91.601 63.714 40.658 1.00 0.00 C ATOM 6046 H18R OL 204 92.315 63.253 39.972 1.00 0.00 H ATOM 6047 H18S OL 204 92.152 64.353 41.351 1.00 0.00 H ATOM 6048 H18T OL 204 90.993 64.410 40.076 1.00 0.00 H TER 6049 OL 204 ATOM 6049 C116 PA 205 66.037 83.845 36.146 1.00 0.00 C ATOM 6050 H16R PA 205 65.775 83.189 35.314 1.00 0.00 H ATOM 6051 H16S PA 205 67.027 84.306 36.120 1.00 0.00 H ATOM 6052 H16T PA 205 65.322 84.670 36.134 1.00 0.00 H ATOM 6053 C115 PA 205 65.922 82.997 37.413 1.00 0.00 C ATOM 6054 H15R PA 205 64.979 82.445 37.392 1.00 0.00 H ATOM 6055 H15S PA 205 65.806 83.702 38.238 1.00 0.00 H ATOM 6056 C114 PA 205 67.103 82.130 37.779 1.00 0.00 C ATOM 6057 H14R PA 205 68.032 82.686 37.640 1.00 0.00 H ATOM 6058 H14S PA 205 67.222 81.217 37.191 1.00 0.00 H ATOM 6059 C113 PA 205 67.005 81.741 39.201 1.00 0.00 C ATOM 6060 H13R PA 205 66.114 81.156 39.436 1.00 0.00 H ATOM 6061 H13S PA 205 66.985 82.701 39.720 1.00 0.00 H ATOM 6062 C112 PA 205 68.201 81.032 39.852 1.00 0.00 C ATOM 6063 H12R PA 205 69.126 81.587 39.683 1.00 0.00 H ATOM 6064 H12S PA 205 68.279 80.045 39.391 1.00 0.00 H ATOM 6065 C111 PA 205 68.024 80.788 41.317 1.00 0.00 C ATOM 6066 H11R PA 205 66.963 80.834 41.570 1.00 0.00 H ATOM 6067 H11S PA 205 68.426 81.632 41.883 1.00 0.00 H ATOM 6068 C110 PA 205 68.547 79.387 41.752 1.00 0.00 C ATOM 6069 H10R PA 205 69.618 79.354 41.542 1.00 0.00 H ATOM 6070 H10S PA 205 68.099 78.525 41.253 1.00 0.00 H ATOM 6071 C19 PA 205 68.470 79.175 43.234 1.00 0.00 C ATOM 6072 H9R PA 205 67.430 78.925 43.454 1.00 0.00 H ATOM 6073 H9S PA 205 68.702 80.062 43.828 1.00 0.00 H ATOM 6074 C18 PA 205 69.220 77.993 43.753 1.00 0.00 C ATOM 6075 H8R PA 205 70.280 77.928 43.501 1.00 0.00 H ATOM 6076 H8S PA 205 68.842 77.069 43.309 1.00 0.00 H ATOM 6077 C17 PA 205 69.169 77.858 45.283 1.00 0.00 C ATOM 6078 H7R PA 205 69.659 78.717 45.746 1.00 0.00 H ATOM 6079 H7S PA 205 69.760 76.966 45.499 1.00 0.00 H ATOM 6080 C16 PA 205 67.833 77.704 45.844 1.00 0.00 C ATOM 6081 H6R PA 205 67.252 77.029 45.212 1.00 0.00 H ATOM 6082 H6S PA 205 67.328 78.672 45.831 1.00 0.00 H ATOM 6083 C15 PA 205 67.849 77.228 47.293 1.00 0.00 C ATOM 6084 H5R PA 205 68.376 77.961 47.908 1.00 0.00 H ATOM 6085 H5S PA 205 68.366 76.274 47.413 1.00 0.00 H ATOM 6086 C14 PA 205 66.497 77.066 47.942 1.00 0.00 C ATOM 6087 H4R PA 205 65.982 76.300 47.359 1.00 0.00 H ATOM 6088 H4S PA 205 66.088 78.078 47.949 1.00 0.00 H ATOM 6089 C13 PA 205 66.437 76.529 49.393 1.00 0.00 C ATOM 6090 H3R PA 205 66.881 75.532 49.419 1.00 0.00 H ATOM 6091 H3S PA 205 65.357 76.375 49.440 1.00 0.00 H ATOM 6092 C12 PA 205 66.987 77.475 50.514 1.00 0.00 C ATOM 6093 H2R PA 205 66.529 78.465 50.569 1.00 0.00 H ATOM 6094 H2S PA 205 68.027 77.627 50.216 1.00 0.00 H ATOM 6095 C11 PGR 206 66.851 76.834 51.880 1.00 0.00 C ATOM 6096 O12 PGR 206 67.828 76.755 52.581 1.00 0.00 O ATOM 6097 O11 PGR 206 65.507 76.576 52.218 1.00 0.00 O ATOM 6098 C1 PGR 206 65.153 76.036 53.541 1.00 0.00 C ATOM 6099 HR PGR 206 65.654 75.077 53.695 1.00 0.00 H ATOM 6100 HS PGR 206 64.105 75.728 53.565 1.00 0.00 H ATOM 6101 C2 PGR 206 65.427 77.098 54.622 1.00 0.00 C ATOM 6102 HX PGR 206 66.302 77.660 54.285 1.00 0.00 H ATOM 6103 C3 PGR 206 65.619 76.538 56.083 1.00 0.00 C ATOM 6104 HA PGR 206 65.569 77.327 56.837 1.00 0.00 H ATOM 6105 HB PGR 206 66.613 76.092 56.167 1.00 0.00 H ATOM 6106 O31 PGR 206 64.568 75.615 56.289 1.00 0.00 O ATOM 6107 P31 PGR 206 64.479 74.614 57.483 1.00 0.00 P ATOM 6108 O32 PGR 206 65.903 73.799 57.487 1.00 0.00 O ATOM 6109 C31 PGR 206 66.257 72.816 56.494 1.00 0.00 C ATOM 6110 H1A PGR 206 67.349 72.762 56.503 1.00 0.00 H ATOM 6111 H1B PGR 206 65.957 73.071 55.474 1.00 0.00 H ATOM 6112 C32 PGR 206 65.681 71.409 56.892 1.00 0.00 C ATOM 6113 H2A PGR 206 66.262 70.713 56.282 1.00 0.00 H ATOM 6114 O35 PGR 206 64.254 71.269 56.733 1.00 0.00 O ATOM 6115 HO5A PGR 206 63.980 72.088 57.184 1.00 0.00 H ATOM 6116 C33 PGR 206 66.151 71.044 58.296 1.00 0.00 C ATOM 6117 H3A PGR 206 65.767 70.048 58.528 1.00 0.00 H ATOM 6118 H3B PGR 206 67.221 70.825 58.337 1.00 0.00 H ATOM 6119 O33 PGR 206 64.451 75.420 58.704 1.00 0.00 O ATOM 6120 O34 PGR 206 63.383 73.634 57.271 1.00 0.00 O ATOM 6121 O21 PGR 206 64.331 78.050 54.530 1.00 0.00 O ATOM 6122 C21 PGR 206 64.421 79.292 55.105 1.00 0.00 C ATOM 6123 O22 PGR 206 65.298 79.653 55.849 1.00 0.00 O ATOM 6124 O36 PGR 206 65.692 71.883 59.353 1.00 0.00 O ATOM 6125 HO6A PGR 206 66.277 71.920 60.131 1.00 0.00 H ATOM 6126 C12 OL 207 63.369 80.230 54.642 1.00 0.00 C ATOM 6127 H2R OL 207 62.393 79.744 54.702 1.00 0.00 H ATOM 6128 H2S OL 207 63.316 80.987 55.427 1.00 0.00 H ATOM 6129 C13 OL 207 63.788 80.732 53.263 1.00 0.00 C ATOM 6130 H3R OL 207 63.380 81.718 53.029 1.00 0.00 H ATOM 6131 H3S OL 207 64.850 80.961 53.150 1.00 0.00 H ATOM 6132 C14 OL 207 63.454 79.768 52.122 1.00 0.00 C ATOM 6133 H4R OL 207 63.928 78.799 52.295 1.00 0.00 H ATOM 6134 H4S OL 207 62.394 79.511 52.179 1.00 0.00 H ATOM 6135 C15 OL 207 63.909 80.267 50.744 1.00 0.00 C ATOM 6136 H5R OL 207 63.813 81.341 50.573 1.00 0.00 H ATOM 6137 H5S OL 207 64.981 80.060 50.761 1.00 0.00 H ATOM 6138 C16 OL 207 63.286 79.569 49.553 1.00 0.00 C ATOM 6139 H6R OL 207 63.374 80.221 48.682 1.00 0.00 H ATOM 6140 H6S OL 207 63.720 78.579 49.394 1.00 0.00 H ATOM 6141 C17 OL 207 61.738 79.236 49.784 1.00 0.00 C ATOM 6142 H7R OL 207 61.622 78.357 50.423 1.00 0.00 H ATOM 6143 H7S OL 207 61.224 80.049 50.301 1.00 0.00 H ATOM 6144 C18 OL 207 61.001 78.880 48.482 1.00 0.00 C ATOM 6145 H8R OL 207 59.978 78.553 48.683 1.00 0.00 H ATOM 6146 H8S OL 207 60.907 79.742 47.817 1.00 0.00 H ATOM 6147 C19 OL 207 61.716 77.825 47.644 1.00 0.00 C ATOM 6148 H9R OL 207 62.631 78.149 47.155 1.00 0.00 H ATOM 6149 C110 OL 207 61.244 76.641 47.301 1.00 0.00 C ATOM 6150 H10R OL 207 61.819 75.990 46.647 1.00 0.00 H ATOM 6151 C111 OL 207 59.981 76.009 47.871 1.00 0.00 C ATOM 6152 H11R OL 207 60.260 75.107 48.421 1.00 0.00 H ATOM 6153 H11S OL 207 59.452 76.499 48.691 1.00 0.00 H ATOM 6154 C112 OL 207 58.883 75.806 46.783 1.00 0.00 C ATOM 6155 H12R OL 207 59.353 75.096 46.100 1.00 0.00 H ATOM 6156 H12S OL 207 58.020 75.198 47.063 1.00 0.00 H ATOM 6157 C113 OL 207 58.402 77.109 46.113 1.00 0.00 C ATOM 6158 H13R OL 207 57.932 77.686 46.911 1.00 0.00 H ATOM 6159 H13S OL 207 59.279 77.658 45.764 1.00 0.00 H ATOM 6160 C114 OL 207 57.321 77.067 45.048 1.00 0.00 C ATOM 6161 H14R OL 207 57.452 76.220 44.371 1.00 0.00 H ATOM 6162 H14S OL 207 56.420 76.869 45.632 1.00 0.00 H ATOM 6163 C115 OL 207 57.260 78.307 44.159 1.00 0.00 C ATOM 6164 H15R OL 207 57.353 79.145 44.854 1.00 0.00 H ATOM 6165 H15S OL 207 58.174 78.348 43.563 1.00 0.00 H ATOM 6166 C116 OL 207 55.945 78.560 43.466 1.00 0.00 C ATOM 6167 H16R OL 207 55.584 77.583 43.137 1.00 0.00 H ATOM 6168 H16S OL 207 55.220 78.906 44.206 1.00 0.00 H ATOM 6169 C117 OL 207 55.988 79.533 42.298 1.00 0.00 C ATOM 6170 H17R OL 207 56.522 80.439 42.592 1.00 0.00 H ATOM 6171 H17S OL 207 56.530 79.091 41.459 1.00 0.00 H ATOM 6172 C118 OL 207 54.593 79.928 41.827 1.00 0.00 C ATOM 6173 H18R OL 207 54.541 80.376 40.833 1.00 0.00 H ATOM 6174 H18S OL 207 54.086 80.546 42.571 1.00 0.00 H ATOM 6175 H18T OL 207 53.919 79.068 41.827 1.00 0.00 H TER 6176 OL 207 ATOM 6176 C116 PA 208 60.424 47.761 42.217 1.00 0.00 C ATOM 6177 H16R PA 208 60.270 46.890 41.577 1.00 0.00 H ATOM 6178 H16S PA 208 59.469 48.131 42.597 1.00 0.00 H ATOM 6179 H16T PA 208 61.022 47.526 43.101 1.00 0.00 H ATOM 6180 C115 PA 208 60.975 48.919 41.413 1.00 0.00 C ATOM 6181 H15R PA 208 61.007 49.787 42.074 1.00 0.00 H ATOM 6182 H15S PA 208 60.303 49.095 40.570 1.00 0.00 H ATOM 6183 C114 PA 208 62.376 48.668 40.818 1.00 0.00 C ATOM 6184 H14R PA 208 62.774 49.376 40.088 1.00 0.00 H ATOM 6185 H14S PA 208 62.377 47.695 40.321 1.00 0.00 H ATOM 6186 C113 PA 208 63.367 48.702 41.917 1.00 0.00 C ATOM 6187 H13R PA 208 63.345 47.727 42.410 1.00 0.00 H ATOM 6188 H13S PA 208 63.051 49.440 42.658 1.00 0.00 H ATOM 6189 C112 PA 208 64.799 48.920 41.502 1.00 0.00 C ATOM 6190 H12R PA 208 65.010 49.837 40.948 1.00 0.00 H ATOM 6191 H12S PA 208 65.022 48.107 40.808 1.00 0.00 H ATOM 6192 C111 PA 208 65.746 49.019 42.623 1.00 0.00 C ATOM 6193 H11R PA 208 66.756 49.207 42.254 1.00 0.00 H ATOM 6194 H11S PA 208 65.676 48.003 43.016 1.00 0.00 H ATOM 6195 C110 PA 208 65.495 49.962 43.803 1.00 0.00 C ATOM 6196 H10R PA 208 64.459 49.797 44.108 1.00 0.00 H ATOM 6197 H10S PA 208 65.460 51.010 43.495 1.00 0.00 H ATOM 6198 C19 PA 208 66.443 49.778 44.928 1.00 0.00 C ATOM 6199 H9R PA 208 67.484 49.806 44.599 1.00 0.00 H ATOM 6200 H9S PA 208 66.237 48.766 45.282 1.00 0.00 H ATOM 6201 C18 PA 208 66.440 50.883 45.962 1.00 0.00 C ATOM 6202 H8R PA 208 65.414 50.986 46.322 1.00 0.00 H ATOM 6203 H8S PA 208 66.635 51.871 45.539 1.00 0.00 H ATOM 6204 C17 PA 208 67.332 50.479 47.094 1.00 0.00 C ATOM 6205 H7R PA 208 67.706 51.425 47.491 1.00 0.00 H ATOM 6206 H7S PA 208 68.261 50.051 46.713 1.00 0.00 H ATOM 6207 C16 PA 208 66.749 49.440 48.120 1.00 0.00 C ATOM 6208 H6R PA 208 66.674 48.490 47.588 1.00 0.00 H ATOM 6209 H6S PA 208 65.737 49.719 48.422 1.00 0.00 H ATOM 6210 C15 PA 208 67.637 49.247 49.355 1.00 0.00 C ATOM 6211 H5R PA 208 67.516 50.182 49.906 1.00 0.00 H ATOM 6212 H5S PA 208 68.682 49.066 49.094 1.00 0.00 H ATOM 6213 C14 PA 208 67.183 47.991 50.063 1.00 0.00 C ATOM 6214 H4R PA 208 67.254 47.105 49.429 1.00 0.00 H ATOM 6215 H4S PA 208 66.121 47.892 50.296 1.00 0.00 H ATOM 6216 C13 PA 208 68.014 47.680 51.345 1.00 0.00 C ATOM 6217 H3R PA 208 67.792 48.376 52.157 1.00 0.00 H ATOM 6218 H3S PA 208 69.053 47.907 51.095 1.00 0.00 H ATOM 6219 C12 PA 208 67.857 46.257 51.916 1.00 0.00 C ATOM 6220 H2R PA 208 68.006 45.556 51.092 1.00 0.00 H ATOM 6221 H2S PA 208 66.873 45.991 52.307 1.00 0.00 H ATOM 6222 C11 PGR 209 68.816 45.975 53.065 1.00 0.00 C ATOM 6223 O12 PGR 209 69.423 46.790 53.709 1.00 0.00 O ATOM 6224 O11 PGR 209 68.792 44.660 53.291 1.00 0.00 O ATOM 6225 C1 PGR 209 69.135 44.057 54.587 1.00 0.00 C ATOM 6226 HR PGR 209 68.313 44.366 55.237 1.00 0.00 H ATOM 6227 HS PGR 209 70.041 44.550 54.950 1.00 0.00 H ATOM 6228 C2 PGR 209 69.176 42.478 54.457 1.00 0.00 C ATOM 6229 HX PGR 209 68.178 42.174 54.130 1.00 0.00 H ATOM 6230 C3 PGR 209 69.451 41.863 55.894 1.00 0.00 C ATOM 6231 HA PGR 209 69.325 40.785 55.762 1.00 0.00 H ATOM 6232 HB PGR 209 68.682 42.294 56.541 1.00 0.00 H ATOM 6233 O31 PGR 209 70.720 42.253 56.419 1.00 0.00 O ATOM 6234 P31 PGR 209 71.397 41.446 57.624 1.00 0.00 P ATOM 6235 O32 PGR 209 71.837 40.159 56.925 1.00 0.00 O ATOM 6236 C31 PGR 209 73.162 39.698 56.882 1.00 0.00 C ATOM 6237 H1A PGR 209 73.532 39.636 57.908 1.00 0.00 H ATOM 6238 H1B PGR 209 73.748 40.431 56.322 1.00 0.00 H ATOM 6239 C32 PGR 209 73.127 38.302 56.211 1.00 0.00 C ATOM 6240 H2A PGR 209 72.540 38.488 55.308 1.00 0.00 H ATOM 6241 O35 PGR 209 72.631 37.258 57.103 1.00 0.00 O ATOM 6242 HO5A PGR 209 73.343 36.897 57.661 1.00 0.00 H ATOM 6243 C33 PGR 209 74.541 37.970 55.801 1.00 0.00 C ATOM 6244 H3A PGR 209 74.911 38.748 55.128 1.00 0.00 H ATOM 6245 H3B PGR 209 75.247 37.948 56.635 1.00 0.00 H ATOM 6246 O33 PGR 209 72.621 42.215 58.011 1.00 0.00 O ATOM 6247 O34 PGR 209 70.351 41.023 58.679 1.00 0.00 O ATOM 6248 O21 PGR 209 70.273 42.043 53.482 1.00 0.00 O ATOM 6249 C21 PGR 209 70.302 40.722 53.143 1.00 0.00 C ATOM 6250 O22 PGR 209 69.348 40.006 53.218 1.00 0.00 O ATOM 6251 O36 PGR 209 74.475 36.695 55.073 1.00 0.00 O ATOM 6252 HO6A PGR 209 74.639 35.952 55.681 1.00 0.00 H ATOM 6253 C12 OL 210 71.624 40.220 52.778 1.00 0.00 C ATOM 6254 H2R OL 210 72.000 40.872 51.988 1.00 0.00 H ATOM 6255 H2S OL 210 72.381 40.361 53.552 1.00 0.00 H ATOM 6256 C13 OL 210 71.602 38.823 52.356 1.00 0.00 C ATOM 6257 H3R OL 210 71.438 38.111 53.167 1.00 0.00 H ATOM 6258 H3S OL 210 70.838 38.769 51.577 1.00 0.00 H ATOM 6259 C14 OL 210 72.895 38.356 51.678 1.00 0.00 C ATOM 6260 H4R OL 210 73.725 38.263 52.381 1.00 0.00 H ATOM 6261 H4S OL 210 72.833 37.295 51.428 1.00 0.00 H ATOM 6262 C15 OL 210 73.387 39.142 50.411 1.00 0.00 C ATOM 6263 H5R OL 210 73.306 40.230 50.459 1.00 0.00 H ATOM 6264 H5S OL 210 74.435 38.855 50.299 1.00 0.00 H ATOM 6265 C16 OL 210 72.593 38.648 49.148 1.00 0.00 C ATOM 6266 H6R OL 210 72.634 37.557 49.168 1.00 0.00 H ATOM 6267 H6S OL 210 71.523 38.831 49.263 1.00 0.00 H ATOM 6268 C17 OL 210 73.058 39.108 47.813 1.00 0.00 C ATOM 6269 H7R OL 210 74.147 39.185 47.837 1.00 0.00 H ATOM 6270 H7S OL 210 72.775 38.421 47.014 1.00 0.00 H ATOM 6271 C18 OL 210 72.571 40.496 47.471 1.00 0.00 C ATOM 6272 H8R OL 210 72.397 41.203 48.286 1.00 0.00 H ATOM 6273 H8S OL 210 73.243 41.068 46.828 1.00 0.00 H ATOM 6274 C19 OL 210 71.236 40.298 46.851 1.00 0.00 C ATOM 6275 H9R OL 210 70.450 39.988 47.535 1.00 0.00 H ATOM 6276 C110 OL 210 71.075 40.559 45.509 1.00 0.00 C ATOM 6277 H10R OL 210 70.120 40.378 45.021 1.00 0.00 H ATOM 6278 C111 OL 210 72.132 40.947 44.558 1.00 0.00 C ATOM 6279 H11R OL 210 71.912 41.964 44.228 1.00 0.00 H ATOM 6280 H11S OL 210 73.184 40.865 44.840 1.00 0.00 H ATOM 6281 C112 OL 210 71.944 40.299 43.164 1.00 0.00 C ATOM 6282 H12R OL 210 71.741 39.226 43.161 1.00 0.00 H ATOM 6283 H12S OL 210 70.985 40.534 42.697 1.00 0.00 H ATOM 6284 C113 OL 210 73.061 40.633 42.181 1.00 0.00 C ATOM 6285 H13R OL 210 73.226 41.711 42.127 1.00 0.00 H ATOM 6286 H13S OL 210 74.001 40.230 42.564 1.00 0.00 H ATOM 6287 C114 OL 210 72.821 40.170 40.766 1.00 0.00 C ATOM 6288 H14R OL 210 72.879 39.080 40.805 1.00 0.00 H ATOM 6289 H14S OL 210 71.805 40.431 40.463 1.00 0.00 H ATOM 6290 C115 OL 210 73.807 40.719 39.788 1.00 0.00 C ATOM 6291 H15R OL 210 73.962 41.792 39.920 1.00 0.00 H ATOM 6292 H15S OL 210 74.829 40.388 39.982 1.00 0.00 H ATOM 6293 C116 OL 210 73.482 40.639 38.256 1.00 0.00 C ATOM 6294 H16R OL 210 72.423 40.877 38.138 1.00 0.00 H ATOM 6295 H16S OL 210 74.089 41.457 37.864 1.00 0.00 H ATOM 6296 C117 OL 210 73.845 39.311 37.672 1.00 0.00 C ATOM 6297 H17R OL 210 74.846 38.937 37.893 1.00 0.00 H ATOM 6298 H17S OL 210 73.186 38.491 37.966 1.00 0.00 H ATOM 6299 C118 OL 210 73.727 39.394 36.190 1.00 0.00 C ATOM 6300 H18R OL 210 73.777 38.355 35.858 1.00 0.00 H ATOM 6301 H18S OL 210 74.491 40.043 35.758 1.00 0.00 H ATOM 6302 H18T OL 210 72.824 39.847 35.775 1.00 0.00 H TER 6303 OL 210 ATOM 6303 C116 PA 211 84.303 57.680 40.954 1.00 0.00 C ATOM 6304 H16R PA 211 83.274 57.321 40.886 1.00 0.00 H ATOM 6305 H16S PA 211 84.890 57.046 40.287 1.00 0.00 H ATOM 6306 H16T PA 211 84.222 58.651 40.462 1.00 0.00 H ATOM 6307 C115 PA 211 84.875 57.919 42.360 1.00 0.00 C ATOM 6308 H15R PA 211 84.871 56.926 42.813 1.00 0.00 H ATOM 6309 H15S PA 211 84.210 58.575 42.927 1.00 0.00 H ATOM 6310 C114 PA 211 86.360 58.358 42.264 1.00 0.00 C ATOM 6311 H14R PA 211 86.552 59.023 41.419 1.00 0.00 H ATOM 6312 H14S PA 211 87.060 57.605 41.895 1.00 0.00 H ATOM 6313 C113 PA 211 86.918 58.757 43.559 1.00 0.00 C ATOM 6314 H13R PA 211 86.143 59.350 44.048 1.00 0.00 H ATOM 6315 H13S PA 211 87.839 59.335 43.457 1.00 0.00 H ATOM 6316 C112 PA 211 87.316 57.553 44.484 1.00 0.00 C ATOM 6317 H12R PA 211 88.268 57.254 44.039 1.00 0.00 H ATOM 6318 H12S PA 211 86.557 56.768 44.493 1.00 0.00 H ATOM 6319 C111 PA 211 87.487 57.886 45.866 1.00 0.00 C ATOM 6320 H11R PA 211 86.483 58.108 46.232 1.00 0.00 H ATOM 6321 H11S PA 211 88.052 58.804 46.043 1.00 0.00 H ATOM 6322 C110 PA 211 87.891 56.702 46.762 1.00 0.00 C ATOM 6323 H10R PA 211 88.922 56.365 46.636 1.00 0.00 H ATOM 6324 H10S PA 211 87.372 55.833 46.354 1.00 0.00 H ATOM 6325 C19 PA 211 87.594 56.908 48.178 1.00 0.00 C ATOM 6326 H9R PA 211 86.560 57.239 48.292 1.00 0.00 H ATOM 6327 H9S PA 211 88.161 57.727 48.626 1.00 0.00 H ATOM 6328 C18 PA 211 87.851 55.672 49.050 1.00 0.00 C ATOM 6329 H8R PA 211 88.937 55.574 49.113 1.00 0.00 H ATOM 6330 H8S PA 211 87.505 54.751 48.576 1.00 0.00 H ATOM 6331 C17 PA 211 87.274 55.910 50.466 1.00 0.00 C ATOM 6332 H7R PA 211 87.332 54.930 50.944 1.00 0.00 H ATOM 6333 H7S PA 211 86.216 56.149 50.594 1.00 0.00 H ATOM 6334 C16 PA 211 88.023 56.969 51.271 1.00 0.00 C ATOM 6335 H6R PA 211 87.908 57.979 50.873 1.00 0.00 H ATOM 6336 H6S PA 211 89.093 56.815 51.114 1.00 0.00 H ATOM 6337 C15 PA 211 87.692 56.899 52.758 1.00 0.00 C ATOM 6338 H5R PA 211 87.523 55.871 53.085 1.00 0.00 H ATOM 6339 H5S PA 211 86.776 57.464 52.940 1.00 0.00 H ATOM 6340 C14 PA 211 88.881 57.413 53.584 1.00 0.00 C ATOM 6341 H4R PA 211 89.853 57.301 53.100 1.00 0.00 H ATOM 6342 H4S PA 211 88.799 56.927 54.559 1.00 0.00 H ATOM 6343 C13 PA 211 88.491 58.888 53.881 1.00 0.00 C ATOM 6344 H3R PA 211 87.910 58.795 54.800 1.00 0.00 H ATOM 6345 H3S PA 211 87.875 59.340 53.101 1.00 0.00 H ATOM 6346 C12 PA 211 89.694 59.904 54.064 1.00 0.00 C ATOM 6347 H2R PA 211 89.288 60.901 54.248 1.00 0.00 H ATOM 6348 H2S PA 211 90.230 59.998 53.117 1.00 0.00 H ATOM 6349 C11 PC 212 90.602 59.448 55.101 1.00 0.00 C ATOM 6350 O12 PC 212 90.300 59.006 56.206 1.00 0.00 O ATOM 6351 O11 PC 212 91.854 59.570 54.601 1.00 0.00 O ATOM 6352 C1 PC 212 92.948 58.806 55.211 1.00 0.00 C ATOM 6353 HR PC 212 93.049 59.195 56.227 1.00 0.00 H ATOM 6354 HS PC 212 93.897 59.027 54.714 1.00 0.00 H ATOM 6355 C2 PC 212 92.627 57.318 55.184 1.00 0.00 C ATOM 6356 HX PC 212 91.653 57.066 55.610 1.00 0.00 H ATOM 6357 C3 PC 212 93.715 56.608 56.098 1.00 0.00 C ATOM 6358 HA PC 212 93.625 57.063 57.088 1.00 0.00 H ATOM 6359 HB PC 212 94.698 56.783 55.653 1.00 0.00 H ATOM 6360 O31 PC 212 93.436 55.268 56.160 1.00 0.00 O ATOM 6361 P31 PC 212 92.999 54.473 57.494 1.00 0.00 P ATOM 6362 O32 PC 212 94.303 53.762 57.931 1.00 0.00 O ATOM 6363 C31 PC 212 95.235 54.579 58.610 1.00 0.00 C ATOM 6364 H1A PC 212 94.945 54.642 59.662 1.00 0.00 H ATOM 6365 H1B PC 212 95.239 55.634 58.324 1.00 0.00 H ATOM 6366 C32 PC 212 96.624 53.932 58.418 1.00 0.00 C ATOM 6367 H2A PC 212 97.398 54.622 58.757 1.00 0.00 H ATOM 6368 H2B PC 212 96.705 53.772 57.342 1.00 0.00 H ATOM 6369 N31 PC 212 96.971 52.722 59.168 1.00 0.00 N ATOM 6370 C33 PC 212 96.818 52.885 60.672 1.00 0.00 C ATOM 6371 H3A PC 212 95.735 52.823 60.788 1.00 0.00 H ATOM 6372 H3B PC 212 97.241 53.840 60.987 1.00 0.00 H ATOM 6373 H3C PC 212 97.211 52.030 61.224 1.00 0.00 H ATOM 6374 C34 PC 212 96.262 51.536 58.767 1.00 0.00 C ATOM 6375 H4A PC 212 95.230 51.742 59.056 1.00 0.00 H ATOM 6376 H4B PC 212 96.613 50.626 59.255 1.00 0.00 H ATOM 6377 H4C PC 212 96.193 51.450 57.682 1.00 0.00 H ATOM 6378 C35 PC 212 98.418 52.641 58.778 1.00 0.00 C ATOM 6379 H5A PC 212 98.817 51.696 59.149 1.00 0.00 H ATOM 6380 H5B PC 212 98.861 53.584 59.103 1.00 0.00 H ATOM 6381 H5C PC 212 98.549 52.583 57.696 1.00 0.00 H ATOM 6382 O33 PC 212 92.537 55.277 58.615 1.00 0.00 O ATOM 6383 O34 PC 212 92.155 53.309 57.079 1.00 0.00 O ATOM 6384 O21 PC 212 92.661 56.917 53.808 1.00 0.00 O ATOM 6385 C21 PC 212 92.024 55.835 53.377 1.00 0.00 C ATOM 6386 O22 PC 212 91.350 55.046 54.046 1.00 0.00 O ATOM 6387 C12 OL 213 92.161 55.761 51.852 1.00 0.00 C ATOM 6388 H2R OL 213 91.258 56.170 51.393 1.00 0.00 H ATOM 6389 H2S OL 213 93.028 56.319 51.492 1.00 0.00 H ATOM 6390 C13 OL 213 92.363 54.335 51.443 1.00 0.00 C ATOM 6391 H3R OL 213 93.367 54.039 51.752 1.00 0.00 H ATOM 6392 H3S OL 213 91.657 53.765 52.052 1.00 0.00 H ATOM 6393 C14 OL 213 92.004 53.975 50.049 1.00 0.00 C ATOM 6394 H4R OL 213 92.146 52.926 49.781 1.00 0.00 H ATOM 6395 H4S OL 213 90.954 54.089 49.773 1.00 0.00 H ATOM 6396 C15 OL 213 92.732 54.872 49.054 1.00 0.00 C ATOM 6397 H5R OL 213 92.269 55.860 49.000 1.00 0.00 H ATOM 6398 H5S OL 213 93.773 54.944 49.375 1.00 0.00 H ATOM 6399 C16 OL 213 92.715 54.302 47.644 1.00 0.00 C ATOM 6400 H6R OL 213 93.333 54.854 46.933 1.00 0.00 H ATOM 6401 H6S OL 213 92.926 53.238 47.771 1.00 0.00 H ATOM 6402 C17 OL 213 91.279 54.231 47.035 1.00 0.00 C ATOM 6403 H7R OL 213 90.504 53.677 47.569 1.00 0.00 H ATOM 6404 H7S OL 213 90.860 55.235 46.942 1.00 0.00 H ATOM 6405 C18 OL 213 91.341 53.529 45.640 1.00 0.00 C ATOM 6406 H8R OL 213 92.168 53.991 45.096 1.00 0.00 H ATOM 6407 H8S OL 213 91.454 52.446 45.727 1.00 0.00 H ATOM 6408 C19 OL 213 90.119 53.849 44.892 1.00 0.00 C ATOM 6409 H9R OL 213 89.908 54.908 44.764 1.00 0.00 H ATOM 6410 C110 OL 213 89.231 53.003 44.400 1.00 0.00 C ATOM 6411 H10R OL 213 88.405 53.307 43.762 1.00 0.00 H ATOM 6412 C111 OL 213 89.283 51.580 44.754 1.00 0.00 C ATOM 6413 H11R OL 213 89.897 51.002 44.060 1.00 0.00 H ATOM 6414 H11S OL 213 89.632 51.459 45.782 1.00 0.00 H ATOM 6415 C112 OL 213 87.936 50.986 44.690 1.00 0.00 C ATOM 6416 H12R OL 213 87.388 51.128 43.756 1.00 0.00 H ATOM 6417 H12S OL 213 88.070 49.908 44.806 1.00 0.00 H ATOM 6418 C113 OL 213 87.039 51.608 45.725 1.00 0.00 C ATOM 6419 H13R OL 213 87.513 51.571 46.708 1.00 0.00 H ATOM 6420 H13S OL 213 86.891 52.648 45.426 1.00 0.00 H ATOM 6421 C114 OL 213 85.670 50.936 45.917 1.00 0.00 C ATOM 6422 H14R OL 213 85.125 50.929 44.970 1.00 0.00 H ATOM 6423 H14S OL 213 85.810 49.939 46.338 1.00 0.00 H ATOM 6424 C115 OL 213 84.673 51.619 46.829 1.00 0.00 C ATOM 6425 H15R OL 213 85.265 52.046 47.642 1.00 0.00 H ATOM 6426 H15S OL 213 84.193 52.507 46.411 1.00 0.00 H ATOM 6427 C116 OL 213 83.398 50.811 47.259 1.00 0.00 C ATOM 6428 H16R OL 213 82.669 51.385 47.836 1.00 0.00 H ATOM 6429 H16S OL 213 82.789 50.566 46.386 1.00 0.00 H ATOM 6430 C117 OL 213 83.587 49.509 47.995 1.00 0.00 C ATOM 6431 H17R OL 213 82.628 48.997 48.097 1.00 0.00 H ATOM 6432 H17S OL 213 84.139 48.835 47.337 1.00 0.00 H ATOM 6433 C118 OL 213 84.247 49.494 49.364 1.00 0.00 C ATOM 6434 H18R OL 213 85.328 49.646 49.320 1.00 0.00 H ATOM 6435 H18S OL 213 84.137 48.520 49.846 1.00 0.00 H ATOM 6436 H18T OL 213 83.760 50.315 49.895 1.00 0.00 H TER 6437 OL 213 ATOM 6437 C116 PA 214 116.003 67.667 44.222 1.00 0.00 C ATOM 6438 H16R PA 214 115.159 68.172 44.695 1.00 0.00 H ATOM 6439 H16S PA 214 116.024 66.577 44.280 1.00 0.00 H ATOM 6440 H16T PA 214 115.951 67.865 43.149 1.00 0.00 H ATOM 6441 C115 PA 214 117.260 68.264 44.765 1.00 0.00 C ATOM 6442 H15R PA 214 118.101 67.774 44.270 1.00 0.00 H ATOM 6443 H15S PA 214 117.391 68.039 45.825 1.00 0.00 H ATOM 6444 C114 PA 214 117.204 69.805 44.553 1.00 0.00 C ATOM 6445 H14R PA 214 117.242 69.985 43.477 1.00 0.00 H ATOM 6446 H14S PA 214 118.169 70.183 44.895 1.00 0.00 H ATOM 6447 C113 PA 214 116.035 70.573 45.126 1.00 0.00 C ATOM 6448 H13R PA 214 115.157 70.257 44.558 1.00 0.00 H ATOM 6449 H13S PA 214 116.124 71.648 44.954 1.00 0.00 H ATOM 6450 C112 PA 214 115.760 70.354 46.653 1.00 0.00 C ATOM 6451 H12R PA 214 115.751 69.265 46.735 1.00 0.00 H ATOM 6452 H12S PA 214 114.790 70.798 46.887 1.00 0.00 H ATOM 6453 C111 PA 214 116.949 70.937 47.465 1.00 0.00 C ATOM 6454 H11R PA 214 116.859 72.026 47.481 1.00 0.00 H ATOM 6455 H11S PA 214 117.868 70.704 46.924 1.00 0.00 H ATOM 6456 C110 PA 214 117.236 70.337 48.860 1.00 0.00 C ATOM 6457 H10R PA 214 118.316 70.458 48.967 1.00 0.00 H ATOM 6458 H10S PA 214 117.049 69.262 48.891 1.00 0.00 H ATOM 6459 C19 PA 214 116.754 71.103 50.113 1.00 0.00 C ATOM 6460 H9R PA 214 115.694 70.894 50.273 1.00 0.00 H ATOM 6461 H9S PA 214 116.772 72.140 49.772 1.00 0.00 H ATOM 6462 C18 PA 214 117.568 70.864 51.357 1.00 0.00 C ATOM 6463 H8R PA 214 118.622 71.094 51.185 1.00 0.00 H ATOM 6464 H8S PA 214 117.652 69.798 51.578 1.00 0.00 H ATOM 6465 C17 PA 214 117.074 71.440 52.716 1.00 0.00 C ATOM 6466 H7R PA 214 117.910 71.367 53.415 1.00 0.00 H ATOM 6467 H7S PA 214 116.212 70.863 53.056 1.00 0.00 H ATOM 6468 C16 PA 214 116.456 72.758 52.678 1.00 0.00 C ATOM 6469 H6R PA 214 115.554 72.769 52.062 1.00 0.00 H ATOM 6470 H6S PA 214 117.160 73.483 52.263 1.00 0.00 H ATOM 6471 C15 PA 214 116.151 73.486 53.965 1.00 0.00 C ATOM 6472 H5R PA 214 115.307 74.163 53.815 1.00 0.00 H ATOM 6473 H5S PA 214 116.972 74.132 54.283 1.00 0.00 H ATOM 6474 C14 PA 214 115.679 72.482 55.068 1.00 0.00 C ATOM 6475 H4R PA 214 116.557 71.931 55.413 1.00 0.00 H ATOM 6476 H4S PA 214 114.894 71.821 54.696 1.00 0.00 H ATOM 6477 C13 PA 214 115.211 73.158 56.343 1.00 0.00 C ATOM 6478 H3R PA 214 114.399 73.882 56.245 1.00 0.00 H ATOM 6479 H3S PA 214 116.050 73.668 56.820 1.00 0.00 H ATOM 6480 C12 PA 214 114.871 72.149 57.458 1.00 0.00 C ATOM 6481 H2R PA 214 115.773 71.608 57.750 1.00 0.00 H ATOM 6482 H2S PA 214 114.297 71.315 57.049 1.00 0.00 H ATOM 6483 C11 PC 215 114.098 72.831 58.620 1.00 0.00 C ATOM 6484 O12 PC 215 112.933 72.658 58.822 1.00 0.00 O ATOM 6485 O11 PC 215 114.971 73.588 59.364 1.00 0.00 O ATOM 6486 C1 PC 215 114.543 74.153 60.645 1.00 0.00 C ATOM 6487 HR PC 215 115.525 74.219 61.120 1.00 0.00 H ATOM 6488 HS PC 215 113.985 73.416 61.228 1.00 0.00 H ATOM 6489 C2 PC 215 113.802 75.487 60.469 1.00 0.00 C ATOM 6490 HX PC 215 114.521 76.201 60.061 1.00 0.00 H ATOM 6491 C3 PC 215 113.177 75.856 61.810 1.00 0.00 C ATOM 6492 HA PC 215 113.010 76.931 61.917 1.00 0.00 H ATOM 6493 HB PC 215 113.884 75.746 62.636 1.00 0.00 H ATOM 6494 O31 PC 215 111.988 75.038 62.081 1.00 0.00 O ATOM 6495 P31 PC 215 111.280 75.223 63.496 1.00 0.00 P ATOM 6496 O32 PC 215 110.241 74.051 63.560 1.00 0.00 O ATOM 6497 C31 PC 215 110.635 72.713 63.782 1.00 0.00 C ATOM 6498 H1A PC 215 110.944 72.540 64.816 1.00 0.00 H ATOM 6499 H1B PC 215 111.398 72.382 63.073 1.00 0.00 H ATOM 6500 C32 PC 215 109.468 71.835 63.476 1.00 0.00 C ATOM 6501 H2A PC 215 108.934 72.224 62.609 1.00 0.00 H ATOM 6502 H2B PC 215 108.798 71.751 64.333 1.00 0.00 H ATOM 6503 N31 PC 215 109.842 70.364 63.244 1.00 0.00 N ATOM 6504 C33 PC 215 108.580 69.535 63.041 1.00 0.00 C ATOM 6505 H3A PC 215 108.112 69.885 62.119 1.00 0.00 H ATOM 6506 H3B PC 215 107.974 69.625 63.944 1.00 0.00 H ATOM 6507 H3C PC 215 108.914 68.508 62.887 1.00 0.00 H ATOM 6508 C34 PC 215 110.763 70.207 62.072 1.00 0.00 C ATOM 6509 H4A PC 215 111.159 69.191 62.082 1.00 0.00 H ATOM 6510 H4B PC 215 111.528 70.976 61.956 1.00 0.00 H ATOM 6511 H4C PC 215 109.996 70.168 61.297 1.00 0.00 H ATOM 6512 C35 PC 215 110.440 69.770 64.502 1.00 0.00 C ATOM 6513 H5A PC 215 111.394 70.248 64.728 1.00 0.00 H ATOM 6514 H5B PC 215 110.471 68.699 64.293 1.00 0.00 H ATOM 6515 H5C PC 215 109.702 70.006 65.269 1.00 0.00 H ATOM 6516 O33 PC 215 112.326 75.002 64.529 1.00 0.00 O ATOM 6517 O34 PC 215 110.543 76.516 63.458 1.00 0.00 O ATOM 6518 O21 PC 215 112.710 75.400 59.449 1.00 0.00 O ATOM 6519 C21 PC 215 111.900 76.441 59.092 1.00 0.00 C ATOM 6520 O22 PC 215 112.012 77.534 59.580 1.00 0.00 O ATOM 6521 C12 OL 216 111.069 76.040 57.916 1.00 0.00 C ATOM 6522 H2R OL 216 110.592 75.073 58.087 1.00 0.00 H ATOM 6523 H2S OL 216 110.225 76.726 57.824 1.00 0.00 H ATOM 6524 C13 OL 216 111.811 76.032 56.572 1.00 0.00 C ATOM 6525 H3R OL 216 112.275 77.006 56.403 1.00 0.00 H ATOM 6526 H3S OL 216 112.640 75.323 56.621 1.00 0.00 H ATOM 6527 C14 OL 216 110.860 75.476 55.479 1.00 0.00 C ATOM 6528 H4R OL 216 110.336 74.671 56.000 1.00 0.00 H ATOM 6529 H4S OL 216 110.130 76.262 55.274 1.00 0.00 H ATOM 6530 C15 OL 216 111.426 74.990 54.175 1.00 0.00 C ATOM 6531 H5R OL 216 111.840 75.800 53.572 1.00 0.00 H ATOM 6532 H5S OL 216 112.123 74.171 54.365 1.00 0.00 H ATOM 6533 C16 OL 216 110.236 74.397 53.293 1.00 0.00 C ATOM 6534 H6R OL 216 109.642 73.682 53.866 1.00 0.00 H ATOM 6535 H6S OL 216 109.497 75.154 53.023 1.00 0.00 H ATOM 6536 C17 OL 216 110.856 73.583 52.084 1.00 0.00 C ATOM 6537 H7R OL 216 111.754 73.075 52.443 1.00 0.00 H ATOM 6538 H7S OL 216 110.166 72.741 52.003 1.00 0.00 H ATOM 6539 C18 OL 216 111.035 74.316 50.811 1.00 0.00 C ATOM 6540 H8R OL 216 110.090 74.710 50.431 1.00 0.00 H ATOM 6541 H8S OL 216 111.495 75.270 51.077 1.00 0.00 H ATOM 6542 C19 OL 216 111.825 73.526 49.809 1.00 0.00 C ATOM 6543 H9R OL 216 112.714 73.044 50.209 1.00 0.00 H ATOM 6544 C110 OL 216 111.731 73.400 48.490 1.00 0.00 C ATOM 6545 H10R OL 216 112.407 72.758 47.931 1.00 0.00 H ATOM 6546 C111 OL 216 110.565 73.989 47.743 1.00 0.00 C ATOM 6547 H11R OL 216 110.293 74.936 48.215 1.00 0.00 H ATOM 6548 H11S OL 216 110.732 74.205 46.686 1.00 0.00 H ATOM 6549 C112 OL 216 109.286 73.083 47.821 1.00 0.00 C ATOM 6550 H12R OL 216 109.392 72.091 47.377 1.00 0.00 H ATOM 6551 H12S OL 216 109.236 72.826 48.881 1.00 0.00 H ATOM 6552 C113 OL 216 108.003 73.705 47.328 1.00 0.00 C ATOM 6553 H13R OL 216 107.925 74.788 47.443 1.00 0.00 H ATOM 6554 H13S OL 216 107.998 73.625 46.238 1.00 0.00 H ATOM 6555 C114 OL 216 106.730 73.133 47.943 1.00 0.00 C ATOM 6556 H14R OL 216 105.827 73.594 47.538 1.00 0.00 H ATOM 6557 H14S OL 216 106.686 72.085 47.641 1.00 0.00 H ATOM 6558 C115 OL 216 106.642 73.302 49.543 1.00 0.00 C ATOM 6559 H15R OL 216 107.400 72.613 49.919 1.00 0.00 H ATOM 6560 H15S OL 216 107.025 74.301 49.764 1.00 0.00 H ATOM 6561 C116 OL 216 105.314 73.009 50.257 1.00 0.00 C ATOM 6562 H16R OL 216 104.455 73.532 49.833 1.00 0.00 H ATOM 6563 H16S OL 216 105.035 71.959 50.143 1.00 0.00 H ATOM 6564 C117 OL 216 105.492 73.400 51.677 1.00 0.00 C ATOM 6565 H17R OL 216 106.362 72.867 52.066 1.00 0.00 H ATOM 6566 H17S OL 216 105.675 74.477 51.682 1.00 0.00 H ATOM 6567 C118 OL 216 104.256 72.847 52.423 1.00 0.00 C ATOM 6568 H18R OL 216 104.048 71.776 52.376 1.00 0.00 H ATOM 6569 H18S OL 216 103.322 73.331 52.129 1.00 0.00 H ATOM 6570 H18T OL 216 104.216 73.067 53.492 1.00 0.00 H TER 6571 OL 216 ATOM 6571 C116 PA 217 54.442 35.276 48.229 1.00 0.00 C ATOM 6572 H16R PA 217 53.934 36.115 47.748 1.00 0.00 H ATOM 6573 H16S PA 217 55.276 35.716 48.780 1.00 0.00 H ATOM 6574 H16T PA 217 53.772 34.866 48.988 1.00 0.00 H ATOM 6575 C115 PA 217 55.039 34.268 47.310 1.00 0.00 C ATOM 6576 H15R PA 217 55.918 34.605 46.756 1.00 0.00 H ATOM 6577 H15S PA 217 54.320 34.023 46.526 1.00 0.00 H ATOM 6578 C114 PA 217 55.507 33.057 48.018 1.00 0.00 C ATOM 6579 H14R PA 217 54.656 32.717 48.613 1.00 0.00 H ATOM 6580 H14S PA 217 56.298 33.268 48.740 1.00 0.00 H ATOM 6581 C113 PA 217 55.967 32.017 47.092 1.00 0.00 C ATOM 6582 H13R PA 217 56.807 32.369 46.489 1.00 0.00 H ATOM 6583 H13S PA 217 55.147 32.036 46.371 1.00 0.00 H ATOM 6584 C112 PA 217 56.096 30.563 47.665 1.00 0.00 C ATOM 6585 H12R PA 217 55.952 29.808 46.889 1.00 0.00 H ATOM 6586 H12S PA 217 55.503 30.293 48.541 1.00 0.00 H ATOM 6587 C111 PA 217 57.525 30.332 48.062 1.00 0.00 C ATOM 6588 H11R PA 217 57.870 31.105 48.751 1.00 0.00 H ATOM 6589 H11S PA 217 58.078 30.473 47.131 1.00 0.00 H ATOM 6590 C110 PA 217 57.980 28.979 48.679 1.00 0.00 C ATOM 6591 H10R PA 217 59.051 28.912 48.884 1.00 0.00 H ATOM 6592 H10S PA 217 57.807 28.206 47.928 1.00 0.00 H ATOM 6593 C19 PA 217 57.329 28.494 49.968 1.00 0.00 C ATOM 6594 H9R PA 217 56.255 28.307 49.904 1.00 0.00 H ATOM 6595 H9S PA 217 57.436 29.306 50.690 1.00 0.00 H ATOM 6596 C18 PA 217 57.934 27.303 50.689 1.00 0.00 C ATOM 6597 H8R PA 217 57.944 26.444 50.015 1.00 0.00 H ATOM 6598 H8S PA 217 57.412 26.995 51.598 1.00 0.00 H ATOM 6599 C17 PA 217 59.338 27.628 51.173 1.00 0.00 C ATOM 6600 H7R PA 217 59.450 28.627 51.600 1.00 0.00 H ATOM 6601 H7S PA 217 59.991 27.623 50.298 1.00 0.00 H ATOM 6602 C16 PA 217 59.858 26.757 52.328 1.00 0.00 C ATOM 6603 H6R PA 217 59.118 26.617 53.119 1.00 0.00 H ATOM 6604 H6S PA 217 60.638 27.320 52.845 1.00 0.00 H ATOM 6605 C15 PA 217 60.340 25.453 51.933 1.00 0.00 C ATOM 6606 H5R PA 217 61.137 25.427 51.187 1.00 0.00 H ATOM 6607 H5S PA 217 59.449 25.010 51.483 1.00 0.00 H ATOM 6608 C14 PA 217 60.849 24.570 53.082 1.00 0.00 C ATOM 6609 H4R PA 217 61.544 25.065 53.763 1.00 0.00 H ATOM 6610 H4S PA 217 61.406 23.718 52.687 1.00 0.00 H ATOM 6611 C13 PA 217 59.752 24.039 53.967 1.00 0.00 C ATOM 6612 H3R PA 217 59.901 22.959 54.024 1.00 0.00 H ATOM 6613 H3S PA 217 58.780 24.216 53.502 1.00 0.00 H ATOM 6614 C12 PA 217 59.909 24.665 55.354 1.00 0.00 C ATOM 6615 H2R PA 217 59.709 25.738 55.380 1.00 0.00 H ATOM 6616 H2S PA 217 60.930 24.546 55.722 1.00 0.00 H ATOM 6617 C11 PGR 218 59.119 23.925 56.351 1.00 0.00 C ATOM 6618 O12 PGR 218 57.902 23.972 56.326 1.00 0.00 O ATOM 6619 O11 PGR 218 59.851 23.148 57.143 1.00 0.00 O ATOM 6620 C1 PGR 218 59.139 22.306 58.147 1.00 0.00 C ATOM 6621 HR PGR 218 58.546 21.497 57.712 1.00 0.00 H ATOM 6622 HS PGR 218 58.411 22.983 58.599 1.00 0.00 H ATOM 6623 C2 PGR 218 60.153 21.762 59.205 1.00 0.00 C ATOM 6624 HX PGR 218 60.940 21.206 58.689 1.00 0.00 H ATOM 6625 C3 PGR 218 59.451 20.856 60.206 1.00 0.00 C ATOM 6626 HA PGR 218 58.627 20.289 59.766 1.00 0.00 H ATOM 6627 HB PGR 218 59.133 21.531 61.005 1.00 0.00 H ATOM 6628 O31 PGR 218 60.392 19.911 60.678 1.00 0.00 O ATOM 6629 P31 PGR 218 60.063 19.050 61.946 1.00 0.00 P ATOM 6630 O32 PGR 218 59.018 17.887 61.348 1.00 0.00 O ATOM 6631 C31 PGR 218 58.333 16.932 62.153 1.00 0.00 C ATOM 6632 H1A PGR 218 57.433 16.605 61.626 1.00 0.00 H ATOM 6633 H1B PGR 218 58.027 17.491 63.042 1.00 0.00 H ATOM 6634 C32 PGR 218 59.232 15.706 62.529 1.00 0.00 C ATOM 6635 H2A PGR 218 60.035 16.200 63.082 1.00 0.00 H ATOM 6636 O35 PGR 218 59.576 14.908 61.383 1.00 0.00 O ATOM 6637 HO5A PGR 218 59.868 15.632 60.801 1.00 0.00 H ATOM 6638 C33 PGR 218 58.397 14.816 63.466 1.00 0.00 C ATOM 6639 H3A PGR 218 58.228 15.360 64.399 1.00 0.00 H ATOM 6640 H3B PGR 218 57.440 14.578 62.995 1.00 0.00 H ATOM 6641 O33 PGR 218 61.308 18.437 62.339 1.00 0.00 O ATOM 6642 O34 PGR 218 59.336 19.911 62.878 1.00 0.00 O ATOM 6643 O21 PGR 218 60.540 22.883 60.011 1.00 0.00 O ATOM 6644 C21 PGR 218 61.646 22.871 60.601 1.00 0.00 C ATOM 6645 O22 PGR 218 62.622 22.161 60.351 1.00 0.00 O ATOM 6646 O36 PGR 218 59.097 13.616 63.783 1.00 0.00 O ATOM 6647 HO6A PGR 218 59.072 13.093 62.962 1.00 0.00 H TER 6648 PGR 218 ATOM 6648 C12 OL 219 97.170 78.531 32.362 1.00 0.00 C ATOM 6649 H2R OL 219 98.073 77.928 32.468 1.00 0.00 H ATOM 6650 H2S OL 219 97.288 79.603 32.190 1.00 0.00 H ATOM 6651 C13 OL 219 96.160 78.310 33.447 1.00 0.00 C ATOM 6652 H3R OL 219 95.477 79.147 33.287 1.00 0.00 H ATOM 6653 H3S OL 219 95.593 77.387 33.313 1.00 0.00 H ATOM 6654 C14 OL 219 96.690 78.373 34.855 1.00 0.00 C ATOM 6655 H4R OL 219 97.366 77.535 35.037 1.00 0.00 H ATOM 6656 H4S OL 219 97.268 79.283 35.024 1.00 0.00 H ATOM 6657 C15 OL 219 95.597 78.605 35.945 1.00 0.00 C ATOM 6658 H5R OL 219 96.056 79.210 36.730 1.00 0.00 H ATOM 6659 H5S OL 219 94.863 79.294 35.522 1.00 0.00 H ATOM 6660 C16 OL 219 94.940 77.240 36.364 1.00 0.00 C ATOM 6661 H6R OL 219 93.963 77.200 35.879 1.00 0.00 H ATOM 6662 H6S OL 219 95.512 76.426 35.914 1.00 0.00 H ATOM 6663 C17 OL 219 94.809 77.130 37.904 1.00 0.00 C ATOM 6664 H7R OL 219 95.746 76.821 38.371 1.00 0.00 H ATOM 6665 H7S OL 219 94.671 78.154 38.258 1.00 0.00 H ATOM 6666 C18 OL 219 93.589 76.382 38.376 1.00 0.00 C ATOM 6667 H8R OL 219 93.527 76.604 39.443 1.00 0.00 H ATOM 6668 H8S OL 219 92.717 76.808 37.875 1.00 0.00 H ATOM 6669 C19 OL 219 93.711 74.879 38.118 1.00 0.00 C ATOM 6670 H9R OL 219 93.658 74.585 37.073 1.00 0.00 H ATOM 6671 C110 OL 219 93.820 73.956 39.114 1.00 0.00 C ATOM 6672 H10R OL 219 93.835 72.896 38.871 1.00 0.00 H ATOM 6673 C111 OL 219 93.892 74.133 40.557 1.00 0.00 C ATOM 6674 H11R OL 219 94.960 74.107 40.786 1.00 0.00 H ATOM 6675 H11S OL 219 93.544 75.120 40.867 1.00 0.00 H ATOM 6676 C112 OL 219 93.261 73.038 41.311 1.00 0.00 C ATOM 6677 H12R OL 219 93.387 72.170 40.661 1.00 0.00 H ATOM 6678 H12S OL 219 94.028 72.894 42.076 1.00 0.00 H ATOM 6679 C113 OL 219 91.888 73.339 41.852 1.00 0.00 C ATOM 6680 H13R OL 219 91.526 72.878 42.774 1.00 0.00 H ATOM 6681 H13S OL 219 91.802 74.393 42.123 1.00 0.00 H ATOM 6682 C114 OL 219 90.694 72.962 40.982 1.00 0.00 C ATOM 6683 H14R OL 219 90.977 73.374 40.010 1.00 0.00 H ATOM 6684 H14S OL 219 90.703 71.872 41.051 1.00 0.00 H ATOM 6685 C115 OL 219 89.401 73.578 41.544 1.00 0.00 C ATOM 6686 H15R OL 219 89.364 73.303 42.600 1.00 0.00 H ATOM 6687 H15S OL 219 89.238 74.657 41.493 1.00 0.00 H ATOM 6688 C116 OL 219 88.220 72.859 41.042 1.00 0.00 C ATOM 6689 H16R OL 219 88.254 71.774 41.162 1.00 0.00 H ATOM 6690 H16S OL 219 87.395 73.110 41.711 1.00 0.00 H ATOM 6691 C117 OL 219 88.009 73.287 39.596 1.00 0.00 C ATOM 6692 H17R OL 219 88.289 74.337 39.485 1.00 0.00 H ATOM 6693 H17S OL 219 88.717 72.722 38.986 1.00 0.00 H ATOM 6694 C118 OL 219 86.623 72.944 39.125 1.00 0.00 C ATOM 6695 H18R OL 219 86.760 71.874 38.955 1.00 0.00 H ATOM 6696 H18S OL 219 86.210 73.437 38.242 1.00 0.00 H ATOM 6697 H18T OL 219 85.972 73.172 39.972 1.00 0.00 H TER 6698 OL 219 ATOM 6698 C116 PA 220 31.887 47.384 39.099 1.00 0.00 C ATOM 6699 H16R PA 220 31.924 46.304 38.942 1.00 0.00 H ATOM 6700 H16S PA 220 32.448 47.644 39.998 1.00 0.00 H ATOM 6701 H16T PA 220 32.382 47.823 38.230 1.00 0.00 H ATOM 6702 C115 PA 220 30.407 47.733 39.165 1.00 0.00 C ATOM 6703 H15R PA 220 29.958 47.325 38.258 1.00 0.00 H ATOM 6704 H15S PA 220 30.345 48.821 39.103 1.00 0.00 H ATOM 6705 C114 PA 220 29.692 47.297 40.398 1.00 0.00 C ATOM 6706 H14R PA 220 28.807 47.929 40.495 1.00 0.00 H ATOM 6707 H14S PA 220 30.184 47.698 41.287 1.00 0.00 H ATOM 6708 C113 PA 220 29.434 45.883 40.475 1.00 0.00 C ATOM 6709 H13R PA 220 30.371 45.619 40.968 1.00 0.00 H ATOM 6710 H13S PA 220 29.505 45.366 39.515 1.00 0.00 H ATOM 6711 C112 PA 220 28.246 45.541 41.339 1.00 0.00 C ATOM 6712 H12R PA 220 28.370 46.253 42.158 1.00 0.00 H ATOM 6713 H12S PA 220 28.329 44.497 41.648 1.00 0.00 H ATOM 6714 C111 PA 220 26.887 45.578 40.603 1.00 0.00 C ATOM 6715 H11R PA 220 27.017 44.990 39.692 1.00 0.00 H ATOM 6716 H11S PA 220 26.691 46.595 40.258 1.00 0.00 H ATOM 6717 C110 PA 220 25.763 45.049 41.485 1.00 0.00 C ATOM 6718 H10R PA 220 25.911 43.974 41.608 1.00 0.00 H ATOM 6719 H10S PA 220 24.798 45.360 41.080 1.00 0.00 H ATOM 6720 C19 PA 220 25.792 45.723 42.831 1.00 0.00 C ATOM 6721 H9R PA 220 26.729 45.686 43.391 1.00 0.00 H ATOM 6722 H9S PA 220 25.059 45.181 43.433 1.00 0.00 H ATOM 6723 C18 PA 220 25.362 47.200 42.723 1.00 0.00 C ATOM 6724 H8R PA 220 24.393 47.183 42.219 1.00 0.00 H ATOM 6725 H8S PA 220 25.980 47.790 42.043 1.00 0.00 H ATOM 6726 C17 PA 220 25.458 47.883 44.080 1.00 0.00 C ATOM 6727 H7R PA 220 26.456 47.783 44.513 1.00 0.00 H ATOM 6728 H7S PA 220 24.968 47.179 44.755 1.00 0.00 H ATOM 6729 C16 PA 220 24.632 49.168 44.268 1.00 0.00 C ATOM 6730 H6R PA 220 23.590 48.888 44.104 1.00 0.00 H ATOM 6731 H6S PA 220 24.824 49.887 43.469 1.00 0.00 H ATOM 6732 C15 PA 220 24.646 49.845 45.629 1.00 0.00 C ATOM 6733 H5R PA 220 24.583 49.133 46.454 1.00 0.00 H ATOM 6734 H5S PA 220 23.777 50.491 45.767 1.00 0.00 H ATOM 6735 C14 PA 220 25.940 50.486 46.027 1.00 0.00 C ATOM 6736 H4R PA 220 26.177 51.257 45.291 1.00 0.00 H ATOM 6737 H4S PA 220 26.701 49.703 46.031 1.00 0.00 H ATOM 6738 C13 PA 220 25.932 51.094 47.385 1.00 0.00 C ATOM 6739 H3R PA 220 25.466 50.417 48.105 1.00 0.00 H ATOM 6740 H3S PA 220 25.404 52.048 47.448 1.00 0.00 H ATOM 6741 C12 PA 220 27.365 51.253 47.923 1.00 0.00 C ATOM 6742 H2R PA 220 27.874 51.848 47.162 1.00 0.00 H ATOM 6743 H2S PA 220 27.971 50.348 47.995 1.00 0.00 H ATOM 6744 C11 PGR 221 27.364 51.826 49.364 1.00 0.00 C ATOM 6745 O12 PGR 221 26.380 51.871 50.077 1.00 0.00 O ATOM 6746 O11 PGR 221 28.559 52.323 49.716 1.00 0.00 O ATOM 6747 C1 PGR 221 28.753 52.836 51.098 1.00 0.00 C ATOM 6748 HR PGR 221 27.916 53.501 51.325 1.00 0.00 H ATOM 6749 HS PGR 221 29.635 53.481 51.073 1.00 0.00 H ATOM 6750 C2 PGR 221 29.018 51.652 52.087 1.00 0.00 C ATOM 6751 HX PGR 221 28.205 50.944 51.906 1.00 0.00 H ATOM 6752 C3 PGR 221 28.928 51.896 53.614 1.00 0.00 C ATOM 6753 HA PGR 221 27.953 52.269 53.938 1.00 0.00 H ATOM 6754 HB PGR 221 29.651 52.694 53.799 1.00 0.00 H ATOM 6755 O31 PGR 221 29.258 50.621 54.253 1.00 0.00 O ATOM 6756 P31 PGR 221 29.146 50.403 55.867 1.00 0.00 P ATOM 6757 O32 PGR 221 27.673 50.127 56.169 1.00 0.00 O ATOM 6758 C31 PGR 221 27.171 48.852 56.140 1.00 0.00 C ATOM 6759 H1A PGR 221 27.556 48.179 56.910 1.00 0.00 H ATOM 6760 H1B PGR 221 27.284 48.399 55.152 1.00 0.00 H ATOM 6761 C32 PGR 221 25.625 48.824 56.488 1.00 0.00 C ATOM 6762 H2A PGR 221 25.246 47.818 56.294 1.00 0.00 H ATOM 6763 O35 PGR 221 24.931 49.800 55.713 1.00 0.00 O ATOM 6764 HO5A PGR 221 24.043 49.504 55.981 1.00 0.00 H ATOM 6765 C33 PGR 221 25.474 49.078 58.022 1.00 0.00 C ATOM 6766 H3A PGR 221 26.037 48.338 58.597 1.00 0.00 H ATOM 6767 H3B PGR 221 25.981 50.014 58.271 1.00 0.00 H ATOM 6768 O33 PGR 221 29.906 49.256 56.285 1.00 0.00 O ATOM 6769 O34 PGR 221 29.477 51.652 56.551 1.00 0.00 O ATOM 6770 O21 PGR 221 30.247 50.917 51.612 1.00 0.00 O ATOM 6771 C21 PGR 221 31.445 51.546 51.762 1.00 0.00 C ATOM 6772 O22 PGR 221 31.715 52.641 52.128 1.00 0.00 O ATOM 6773 O36 PGR 221 24.034 49.056 58.474 1.00 0.00 O ATOM 6774 HO6A PGR 221 23.599 49.912 58.309 1.00 0.00 H ATOM 6775 C12 OL 222 32.516 50.640 51.391 1.00 0.00 C ATOM 6776 H2R OL 222 33.396 50.878 51.992 1.00 0.00 H ATOM 6777 H2S OL 222 32.196 49.626 51.638 1.00 0.00 H ATOM 6778 C13 OL 222 32.855 50.676 49.939 1.00 0.00 C ATOM 6779 H3R OL 222 32.795 51.738 49.690 1.00 0.00 H ATOM 6780 H3S OL 222 33.876 50.329 49.767 1.00 0.00 H ATOM 6781 C14 OL 222 31.851 50.056 49.006 1.00 0.00 C ATOM 6782 H4R OL 222 31.871 48.980 49.193 1.00 0.00 H ATOM 6783 H4S OL 222 30.836 50.410 49.196 1.00 0.00 H ATOM 6784 C15 OL 222 32.155 50.466 47.561 1.00 0.00 C ATOM 6785 H5R OL 222 31.892 51.524 47.502 1.00 0.00 H ATOM 6786 H5S OL 222 33.198 50.266 47.309 1.00 0.00 H ATOM 6787 C16 OL 222 31.273 49.675 46.552 1.00 0.00 C ATOM 6788 H6R OL 222 31.684 48.675 46.705 1.00 0.00 H ATOM 6789 H6S OL 222 30.241 49.682 46.907 1.00 0.00 H ATOM 6790 C17 OL 222 31.458 49.962 45.072 1.00 0.00 C ATOM 6791 H7R OL 222 31.314 51.030 44.901 1.00 0.00 H ATOM 6792 H7S OL 222 32.531 49.860 44.894 1.00 0.00 H ATOM 6793 C18 OL 222 30.737 49.078 44.156 1.00 0.00 C ATOM 6794 H8R OL 222 31.039 48.033 44.247 1.00 0.00 H ATOM 6795 H8S OL 222 29.654 49.040 44.291 1.00 0.00 H ATOM 6796 C19 OL 222 31.024 49.582 42.770 1.00 0.00 C ATOM 6797 H9R OL 222 32.031 49.411 42.396 1.00 0.00 H ATOM 6798 C110 OL 222 30.148 50.100 41.887 1.00 0.00 C ATOM 6799 H10R OL 222 30.544 50.407 40.922 1.00 0.00 H ATOM 6800 C111 OL 222 28.710 50.544 42.200 1.00 0.00 C ATOM 6801 H11R OL 222 28.079 49.665 42.055 1.00 0.00 H ATOM 6802 H11S OL 222 28.654 50.811 43.258 1.00 0.00 H ATOM 6803 C112 OL 222 28.252 51.699 41.335 1.00 0.00 C ATOM 6804 H12R OL 222 28.865 52.571 41.575 1.00 0.00 H ATOM 6805 H12S OL 222 28.363 51.491 40.269 1.00 0.00 H ATOM 6806 C113 OL 222 26.808 52.025 41.590 1.00 0.00 C ATOM 6807 H13R OL 222 26.312 51.075 41.380 1.00 0.00 H ATOM 6808 H13S OL 222 26.690 52.267 42.648 1.00 0.00 H ATOM 6809 C114 OL 222 26.294 53.183 40.716 1.00 0.00 C ATOM 6810 H14R OL 222 27.079 53.940 40.672 1.00 0.00 H ATOM 6811 H14S OL 222 26.276 52.876 39.668 1.00 0.00 H ATOM 6812 C115 OL 222 25.069 53.872 41.170 1.00 0.00 C ATOM 6813 H15R OL 222 24.821 54.626 40.420 1.00 0.00 H ATOM 6814 H15S OL 222 24.213 53.211 41.321 1.00 0.00 H ATOM 6815 C116 OL 222 25.221 54.610 42.449 1.00 0.00 C ATOM 6816 H16R OL 222 25.154 53.807 43.186 1.00 0.00 H ATOM 6817 H16S OL 222 26.201 55.091 42.418 1.00 0.00 H ATOM 6818 C117 OL 222 24.254 55.748 42.748 1.00 0.00 C ATOM 6819 H17R OL 222 24.429 56.523 41.999 1.00 0.00 H ATOM 6820 H17S OL 222 23.229 55.420 42.561 1.00 0.00 H ATOM 6821 C118 OL 222 24.474 56.424 44.120 1.00 0.00 C ATOM 6822 H18R OL 222 23.816 57.279 44.287 1.00 0.00 H ATOM 6823 H18S OL 222 25.435 56.931 44.225 1.00 0.00 H ATOM 6824 H18T OL 222 24.327 55.640 44.866 1.00 0.00 H TER 6825 OL 222 ATOM 6825 C116 PA 223 99.142 37.012 41.504 1.00 0.00 C ATOM 6826 H16R PA 223 100.219 37.068 41.333 1.00 0.00 H ATOM 6827 H16S PA 223 98.921 37.709 42.314 1.00 0.00 H ATOM 6828 H16T PA 223 98.666 37.242 40.548 1.00 0.00 H ATOM 6829 C115 PA 223 98.779 35.513 41.844 1.00 0.00 C ATOM 6830 H15R PA 223 99.612 35.158 42.454 1.00 0.00 H ATOM 6831 H15S PA 223 98.844 34.891 40.948 1.00 0.00 H ATOM 6832 C114 PA 223 97.356 35.384 42.392 1.00 0.00 C ATOM 6833 H14R PA 223 96.544 35.896 41.872 1.00 0.00 H ATOM 6834 H14S PA 223 97.348 35.879 43.365 1.00 0.00 H ATOM 6835 C113 PA 223 96.993 33.921 42.671 1.00 0.00 C ATOM 6836 H13R PA 223 97.725 33.428 43.314 1.00 0.00 H ATOM 6837 H13S PA 223 96.865 33.404 41.718 1.00 0.00 H ATOM 6838 C112 PA 223 95.558 33.914 43.342 1.00 0.00 C ATOM 6839 H12R PA 223 94.822 34.289 42.628 1.00 0.00 H ATOM 6840 H12S PA 223 95.408 34.584 44.191 1.00 0.00 H ATOM 6841 C111 PA 223 95.246 32.444 43.696 1.00 0.00 C ATOM 6842 H11R PA 223 96.160 31.987 44.081 1.00 0.00 H ATOM 6843 H11S PA 223 95.036 31.940 42.750 1.00 0.00 H ATOM 6844 C110 PA 223 94.079 32.165 44.689 1.00 0.00 C ATOM 6845 H10R PA 223 93.160 32.614 44.304 1.00 0.00 H ATOM 6846 H10S PA 223 94.379 32.521 45.676 1.00 0.00 H ATOM 6847 C19 PA 223 93.661 30.691 44.728 1.00 0.00 C ATOM 6848 H9R PA 223 94.546 30.052 44.737 1.00 0.00 H ATOM 6849 H9S PA 223 93.095 30.379 43.848 1.00 0.00 H ATOM 6850 C18 PA 223 92.745 30.414 45.836 1.00 0.00 C ATOM 6851 H8R PA 223 91.906 31.102 45.711 1.00 0.00 H ATOM 6852 H8S PA 223 93.283 30.678 46.750 1.00 0.00 H ATOM 6853 C17 PA 223 92.232 28.969 45.859 1.00 0.00 C ATOM 6854 H7R PA 223 93.098 28.405 45.508 1.00 0.00 H ATOM 6855 H7S PA 223 91.413 28.767 45.166 1.00 0.00 H ATOM 6856 C16 PA 223 91.876 28.515 47.294 1.00 0.00 C ATOM 6857 H6R PA 223 92.721 28.514 47.986 1.00 0.00 H ATOM 6858 H6S PA 223 91.651 27.452 47.180 1.00 0.00 H ATOM 6859 C15 PA 223 90.682 29.249 47.825 1.00 0.00 C ATOM 6860 H5R PA 223 89.878 29.400 47.102 1.00 0.00 H ATOM 6861 H5S PA 223 90.928 30.262 48.150 1.00 0.00 H ATOM 6862 C14 PA 223 90.096 28.668 49.086 1.00 0.00 C ATOM 6863 H4R PA 223 90.072 27.583 48.967 1.00 0.00 H ATOM 6864 H4S PA 223 89.033 28.883 49.221 1.00 0.00 H ATOM 6865 C13 PA 223 90.823 29.177 50.456 1.00 0.00 C ATOM 6866 H3R PA 223 90.812 30.258 50.302 1.00 0.00 H ATOM 6867 H3S PA 223 91.885 28.921 50.422 1.00 0.00 H ATOM 6868 C12 PA 223 90.192 28.502 51.666 1.00 0.00 C ATOM 6869 H2R PA 223 90.475 27.453 51.774 1.00 0.00 H ATOM 6870 H2S PA 223 89.102 28.433 51.656 1.00 0.00 H ATOM 6871 C11 PC 224 90.674 29.164 52.916 1.00 0.00 C ATOM 6872 O12 PC 224 90.054 30.078 53.436 1.00 0.00 O ATOM 6873 O11 PC 224 91.876 28.685 53.299 1.00 0.00 O ATOM 6874 C1 PC 224 92.489 29.282 54.532 1.00 0.00 C ATOM 6875 HR PC 224 91.899 29.156 55.443 1.00 0.00 H ATOM 6876 HS PC 224 92.629 30.320 54.220 1.00 0.00 H ATOM 6877 C2 PC 224 93.769 28.510 54.776 1.00 0.00 C ATOM 6878 HX PC 224 93.505 27.482 54.517 1.00 0.00 H ATOM 6879 C3 PC 224 94.105 28.514 56.307 1.00 0.00 C ATOM 6880 HA PC 224 95.180 28.338 56.386 1.00 0.00 H ATOM 6881 HB PC 224 93.564 27.715 56.821 1.00 0.00 H ATOM 6882 O31 PC 224 93.873 29.731 57.025 1.00 0.00 O ATOM 6883 P31 PC 224 94.025 29.806 58.638 1.00 0.00 P ATOM 6884 O32 PC 224 92.530 29.683 59.195 1.00 0.00 O ATOM 6885 C31 PC 224 91.735 30.859 58.854 1.00 0.00 C ATOM 6886 H1A PC 224 91.634 30.940 57.769 1.00 0.00 H ATOM 6887 H1B PC 224 92.297 31.753 59.139 1.00 0.00 H ATOM 6888 C32 PC 224 90.343 30.755 59.471 1.00 0.00 C ATOM 6889 H2A PC 224 89.786 29.987 58.933 1.00 0.00 H ATOM 6890 H2B PC 224 89.824 31.710 59.378 1.00 0.00 H ATOM 6891 N31 PC 224 90.335 30.466 60.994 1.00 0.00 N ATOM 6892 C33 PC 224 90.501 29.108 61.376 1.00 0.00 C ATOM 6893 H3A PC 224 89.981 28.399 60.729 1.00 0.00 H ATOM 6894 H3B PC 224 90.149 29.129 62.408 1.00 0.00 H ATOM 6895 H3C PC 224 91.524 28.728 61.390 1.00 0.00 H ATOM 6896 C34 PC 224 91.236 31.441 61.761 1.00 0.00 C ATOM 6897 H4A PC 224 90.930 32.463 61.532 1.00 0.00 H ATOM 6898 H4B PC 224 92.298 31.346 61.530 1.00 0.00 H ATOM 6899 H4C PC 224 91.114 31.189 62.816 1.00 0.00 H ATOM 6900 C35 PC 224 88.957 30.714 61.455 1.00 0.00 C ATOM 6901 H5A PC 224 88.907 30.595 62.539 1.00 0.00 H ATOM 6902 H5B PC 224 88.266 29.972 61.050 1.00 0.00 H ATOM 6903 H5C PC 224 88.518 31.679 61.197 1.00 0.00 H ATOM 6904 O33 PC 224 94.776 28.609 59.043 1.00 0.00 O ATOM 6905 O34 PC 224 94.594 31.149 58.818 1.00 0.00 O ATOM 6906 O21 PC 224 94.693 29.071 53.888 1.00 0.00 O ATOM 6907 C21 PC 224 95.852 28.411 53.655 1.00 0.00 C ATOM 6908 O22 PC 224 96.251 27.413 54.264 1.00 0.00 O ATOM 6909 C12 OL 225 96.769 29.250 52.729 1.00 0.00 C ATOM 6910 H2R OL 225 97.094 30.140 53.272 1.00 0.00 H ATOM 6911 H2S OL 225 97.611 28.636 52.400 1.00 0.00 H ATOM 6912 C13 OL 225 95.934 29.666 51.519 1.00 0.00 C ATOM 6913 H3R OL 225 95.053 30.292 51.677 1.00 0.00 H ATOM 6914 H3S OL 225 96.584 30.339 50.956 1.00 0.00 H ATOM 6915 C14 OL 225 95.710 28.442 50.549 1.00 0.00 C ATOM 6916 H4R OL 225 95.082 27.669 50.998 1.00 0.00 H ATOM 6917 H4S OL 225 94.959 28.607 49.774 1.00 0.00 H ATOM 6918 C15 OL 225 96.973 27.833 49.916 1.00 0.00 C ATOM 6919 H5R OL 225 97.598 28.674 49.610 1.00 0.00 H ATOM 6920 H5S OL 225 97.560 27.329 50.686 1.00 0.00 H ATOM 6921 C16 OL 225 96.648 26.827 48.802 1.00 0.00 C ATOM 6922 H6R OL 225 96.386 25.899 49.315 1.00 0.00 H ATOM 6923 H6S OL 225 95.765 27.137 48.239 1.00 0.00 H ATOM 6924 C17 OL 225 97.747 26.639 47.717 1.00 0.00 C ATOM 6925 H7R OL 225 98.657 26.631 48.321 1.00 0.00 H ATOM 6926 H7S OL 225 97.693 25.681 47.195 1.00 0.00 H ATOM 6927 C18 OL 225 97.833 27.815 46.704 1.00 0.00 C ATOM 6928 H8R OL 225 98.372 27.385 45.858 1.00 0.00 H ATOM 6929 H8S OL 225 96.832 28.184 46.469 1.00 0.00 H ATOM 6930 C19 OL 225 98.715 28.900 47.250 1.00 0.00 C ATOM 6931 H9R OL 225 99.787 28.734 47.183 1.00 0.00 H ATOM 6932 C110 OL 225 98.343 30.010 47.647 1.00 0.00 C ATOM 6933 H10R OL 225 99.074 30.715 48.035 1.00 0.00 H ATOM 6934 C111 OL 225 96.946 30.670 47.680 1.00 0.00 C ATOM 6935 H11R OL 225 96.194 30.288 46.986 1.00 0.00 H ATOM 6936 H11S OL 225 96.570 30.748 48.703 1.00 0.00 H ATOM 6937 C112 OL 225 97.068 32.134 47.243 1.00 0.00 C ATOM 6938 H12R OL 225 97.546 32.218 46.265 1.00 0.00 H ATOM 6939 H12S OL 225 96.056 32.518 47.102 1.00 0.00 H ATOM 6940 C113 OL 225 97.806 32.958 48.331 1.00 0.00 C ATOM 6941 H13R OL 225 97.044 33.222 49.066 1.00 0.00 H ATOM 6942 H13S OL 225 98.522 32.375 48.914 1.00 0.00 H ATOM 6943 C114 OL 225 98.241 34.361 47.868 1.00 0.00 C ATOM 6944 H14R OL 225 97.360 34.955 47.618 1.00 0.00 H ATOM 6945 H14S OL 225 98.540 34.950 48.737 1.00 0.00 H ATOM 6946 C115 OL 225 99.087 34.457 46.675 1.00 0.00 C ATOM 6947 H15R OL 225 99.790 33.632 46.542 1.00 0.00 H ATOM 6948 H15S OL 225 98.409 34.314 45.832 1.00 0.00 H ATOM 6949 C116 OL 225 99.624 35.846 46.427 1.00 0.00 C ATOM 6950 H16R OL 225 99.824 36.092 45.382 1.00 0.00 H ATOM 6951 H16S OL 225 98.850 36.552 46.735 1.00 0.00 H ATOM 6952 C117 OL 225 100.930 36.296 47.132 1.00 0.00 C ATOM 6953 H17R OL 225 101.810 35.838 46.676 1.00 0.00 H ATOM 6954 H17S OL 225 101.011 37.375 46.987 1.00 0.00 H ATOM 6955 C118 OL 225 100.860 36.232 48.595 1.00 0.00 C ATOM 6956 H18R OL 225 100.824 35.175 48.869 1.00 0.00 H ATOM 6957 H18S OL 225 99.991 36.762 48.990 1.00 0.00 H ATOM 6958 H18T OL 225 101.725 36.699 49.071 1.00 0.00 H TER 6959 OL 225 ATOM 6959 C116 PA 226 15.919 65.201 44.520 1.00 0.00 C ATOM 6960 H16R PA 226 16.196 66.105 43.974 1.00 0.00 H ATOM 6961 H16S PA 226 16.838 64.611 44.505 1.00 0.00 H ATOM 6962 H16T PA 226 15.714 65.541 45.537 1.00 0.00 H ATOM 6963 C115 PA 226 14.709 64.535 44.007 1.00 0.00 C ATOM 6964 H15R PA 226 14.421 63.743 44.702 1.00 0.00 H ATOM 6965 H15S PA 226 14.960 63.888 43.164 1.00 0.00 H ATOM 6966 C114 PA 226 13.588 65.415 43.599 1.00 0.00 C ATOM 6967 H14R PA 226 12.813 64.702 43.308 1.00 0.00 H ATOM 6968 H14S PA 226 13.683 66.084 42.741 1.00 0.00 H ATOM 6969 C113 PA 226 13.120 66.406 44.584 1.00 0.00 C ATOM 6970 H13R PA 226 12.422 67.149 44.191 1.00 0.00 H ATOM 6971 H13S PA 226 13.967 67.060 44.801 1.00 0.00 H ATOM 6972 C112 PA 226 12.571 65.752 45.831 1.00 0.00 C ATOM 6973 H12R PA 226 13.313 65.094 46.288 1.00 0.00 H ATOM 6974 H12S PA 226 11.841 64.961 45.647 1.00 0.00 H ATOM 6975 C111 PA 226 12.074 66.741 46.898 1.00 0.00 C ATOM 6976 H11R PA 226 12.826 67.458 47.233 1.00 0.00 H ATOM 6977 H11S PA 226 11.942 66.058 47.739 1.00 0.00 H ATOM 6978 C110 PA 226 10.695 67.350 46.634 1.00 0.00 C ATOM 6979 H10R PA 226 10.067 66.504 46.346 1.00 0.00 H ATOM 6980 H10S PA 226 10.584 68.028 45.786 1.00 0.00 H ATOM 6981 C19 PA 226 10.114 67.908 47.902 1.00 0.00 C ATOM 6982 H9R PA 226 10.737 68.792 48.056 1.00 0.00 H ATOM 6983 H9S PA 226 10.221 67.195 48.721 1.00 0.00 H ATOM 6984 C18 PA 226 8.622 68.266 47.769 1.00 0.00 C ATOM 6985 H8R PA 226 7.953 67.404 47.719 1.00 0.00 H ATOM 6986 H8S PA 226 8.447 68.969 46.952 1.00 0.00 H ATOM 6987 C17 PA 226 8.238 68.890 49.104 1.00 0.00 C ATOM 6988 H7R PA 226 8.453 68.129 49.857 1.00 0.00 H ATOM 6989 H7S PA 226 7.154 68.969 49.211 1.00 0.00 H ATOM 6990 C16 PA 226 8.924 70.206 49.532 1.00 0.00 C ATOM 6991 H6R PA 226 8.947 70.866 48.662 1.00 0.00 H ATOM 6992 H6S PA 226 9.985 69.947 49.521 1.00 0.00 H ATOM 6993 C15 PA 226 8.745 70.845 50.938 1.00 0.00 C ATOM 6994 H5R PA 226 9.191 70.273 51.755 1.00 0.00 H ATOM 6995 H5S PA 226 7.664 70.959 51.038 1.00 0.00 H ATOM 6996 C14 PA 226 9.388 72.144 51.025 1.00 0.00 C ATOM 6997 H4R PA 226 8.648 72.830 50.606 1.00 0.00 H ATOM 6998 H4S PA 226 10.332 72.330 50.510 1.00 0.00 H ATOM 6999 C13 PA 226 9.769 72.594 52.437 1.00 0.00 C ATOM 7000 H3R PA 226 10.519 71.899 52.819 1.00 0.00 H ATOM 7001 H3S PA 226 8.909 72.500 53.103 1.00 0.00 H ATOM 7002 C12 PA 226 10.466 73.936 52.479 1.00 0.00 C ATOM 7003 H2R PA 226 10.194 74.491 51.578 1.00 0.00 H ATOM 7004 H2S PA 226 11.557 73.894 52.494 1.00 0.00 H ATOM 7005 C11 PGR 227 10.055 74.552 53.815 1.00 0.00 C ATOM 7006 O12 PGR 227 9.044 75.250 53.942 1.00 0.00 O ATOM 7007 O11 PGR 227 10.891 74.328 54.830 1.00 0.00 O ATOM 7008 C1 PGR 227 10.754 74.893 56.156 1.00 0.00 C ATOM 7009 HR PGR 227 11.335 74.282 56.852 1.00 0.00 H ATOM 7010 HS PGR 227 9.741 74.880 56.564 1.00 0.00 H ATOM 7011 C2 PGR 227 11.301 76.360 56.107 1.00 0.00 C ATOM 7012 HX PGR 227 12.339 76.341 55.763 1.00 0.00 H ATOM 7013 C3 PGR 227 11.084 77.102 57.447 1.00 0.00 C ATOM 7014 HA PGR 227 11.621 78.052 57.506 1.00 0.00 H ATOM 7015 HB PGR 227 11.549 76.494 58.228 1.00 0.00 H ATOM 7016 O31 PGR 227 9.794 77.306 57.706 1.00 0.00 O ATOM 7017 P31 PGR 227 9.316 77.900 59.060 1.00 0.00 P ATOM 7018 O32 PGR 227 10.117 79.317 59.053 1.00 0.00 O ATOM 7019 C31 PGR 227 9.662 80.389 58.165 1.00 0.00 C ATOM 7020 H1A PGR 227 9.772 80.048 57.132 1.00 0.00 H ATOM 7021 H1B PGR 227 8.641 80.724 58.364 1.00 0.00 H ATOM 7022 C32 PGR 227 10.510 81.688 58.362 1.00 0.00 C ATOM 7023 H2A PGR 227 11.564 81.420 58.255 1.00 0.00 H ATOM 7024 O35 PGR 227 10.226 82.252 59.687 1.00 0.00 O ATOM 7025 HO5A PGR 227 10.561 81.496 60.202 1.00 0.00 H ATOM 7026 C33 PGR 227 10.264 82.759 57.313 1.00 0.00 C ATOM 7027 H3A PGR 227 11.141 83.410 57.351 1.00 0.00 H ATOM 7028 H3B PGR 227 10.218 82.298 56.322 1.00 0.00 H ATOM 7029 O33 PGR 227 7.860 78.159 58.933 1.00 0.00 O ATOM 7030 O34 PGR 227 9.780 76.969 60.153 1.00 0.00 O ATOM 7031 O21 PGR 227 10.555 77.134 55.136 1.00 0.00 O ATOM 7032 C21 PGR 227 11.226 78.088 54.443 1.00 0.00 C ATOM 7033 O22 PGR 227 12.421 78.335 54.578 1.00 0.00 O ATOM 7034 O36 PGR 227 9.148 83.596 57.517 1.00 0.00 O ATOM 7035 HO6A PGR 227 8.314 83.178 57.237 1.00 0.00 H ATOM 7036 C12 OL 228 10.367 78.605 53.369 1.00 0.00 C ATOM 7037 H2R OL 228 9.380 78.844 53.771 1.00 0.00 H ATOM 7038 H2S OL 228 10.676 79.627 53.141 1.00 0.00 H ATOM 7039 C13 OL 228 10.392 77.780 52.119 1.00 0.00 C ATOM 7040 H3R OL 228 9.847 76.846 52.270 1.00 0.00 H ATOM 7041 H3S OL 228 9.792 78.266 51.347 1.00 0.00 H ATOM 7042 C14 OL 228 11.734 77.524 51.425 1.00 0.00 C ATOM 7043 H4R OL 228 12.478 77.910 52.125 1.00 0.00 H ATOM 7044 H4S OL 228 11.925 76.453 51.322 1.00 0.00 H ATOM 7045 C15 OL 228 11.825 78.049 49.988 1.00 0.00 C ATOM 7046 H5R OL 228 10.947 77.810 49.386 1.00 0.00 H ATOM 7047 H5S OL 228 11.752 79.126 50.153 1.00 0.00 H ATOM 7048 C16 OL 228 13.056 77.650 49.193 1.00 0.00 C ATOM 7049 H6R OL 228 13.140 78.386 48.390 1.00 0.00 H ATOM 7050 H6S OL 228 13.885 77.866 49.870 1.00 0.00 H ATOM 7051 C17 OL 228 13.138 76.168 48.791 1.00 0.00 C ATOM 7052 H7R OL 228 14.103 76.016 48.303 1.00 0.00 H ATOM 7053 H7S OL 228 13.194 75.541 49.683 1.00 0.00 H ATOM 7054 C18 OL 228 12.100 75.510 47.933 1.00 0.00 C ATOM 7055 H8R OL 228 11.222 75.453 48.579 1.00 0.00 H ATOM 7056 H8S OL 228 11.882 76.086 47.031 1.00 0.00 H ATOM 7057 C19 OL 228 12.496 74.097 47.543 1.00 0.00 C ATOM 7058 H9R OL 228 12.764 73.525 48.427 1.00 0.00 H ATOM 7059 C110 OL 228 12.546 73.562 46.357 1.00 0.00 C ATOM 7060 H10R OL 228 12.796 72.529 46.126 1.00 0.00 H ATOM 7061 C111 OL 228 12.300 74.281 45.027 1.00 0.00 C ATOM 7062 H11R OL 228 11.923 73.623 44.241 1.00 0.00 H ATOM 7063 H11S OL 228 11.518 75.032 45.158 1.00 0.00 H ATOM 7064 C112 OL 228 13.386 75.080 44.336 1.00 0.00 C ATOM 7065 H12R OL 228 13.002 75.366 43.355 1.00 0.00 H ATOM 7066 H12S OL 228 13.667 76.002 44.849 1.00 0.00 H ATOM 7067 C113 OL 228 14.639 74.265 44.165 1.00 0.00 C ATOM 7068 H13R OL 228 14.964 74.092 45.193 1.00 0.00 H ATOM 7069 H13S OL 228 14.292 73.290 43.820 1.00 0.00 H ATOM 7070 C114 OL 228 15.645 75.054 43.382 1.00 0.00 C ATOM 7071 H14R OL 228 15.167 75.552 42.536 1.00 0.00 H ATOM 7072 H14S OL 228 16.034 75.947 43.875 1.00 0.00 H ATOM 7073 C115 OL 228 16.891 74.159 42.910 1.00 0.00 C ATOM 7074 H15R OL 228 16.688 73.434 42.119 1.00 0.00 H ATOM 7075 H15S OL 228 17.519 74.886 42.391 1.00 0.00 H ATOM 7076 C116 OL 228 17.646 73.441 44.028 1.00 0.00 C ATOM 7077 H16R OL 228 17.891 74.116 44.850 1.00 0.00 H ATOM 7078 H16S OL 228 16.939 72.724 44.450 1.00 0.00 H ATOM 7079 C117 OL 228 18.949 72.856 43.436 1.00 0.00 C ATOM 7080 H17R OL 228 18.730 71.970 42.837 1.00 0.00 H ATOM 7081 H17S OL 228 19.345 73.553 42.694 1.00 0.00 H ATOM 7082 C118 OL 228 20.017 72.479 44.443 1.00 0.00 C ATOM 7083 H18R OL 228 19.977 73.171 45.287 1.00 0.00 H ATOM 7084 H18S OL 228 21.040 72.573 44.072 1.00 0.00 H ATOM 7085 H18T OL 228 19.918 71.459 44.821 1.00 0.00 H TER 7086 OL 228 ATOM 7086 C116 PA 229 16.199 53.682 40.812 1.00 0.00 C ATOM 7087 H16R PA 229 16.399 52.838 40.148 1.00 0.00 H ATOM 7088 H16S PA 229 16.053 54.592 40.226 1.00 0.00 H ATOM 7089 H16T PA 229 15.259 53.399 41.291 1.00 0.00 H ATOM 7090 C115 PA 229 17.302 53.714 41.885 1.00 0.00 C ATOM 7091 H15R PA 229 18.230 53.974 41.372 1.00 0.00 H ATOM 7092 H15S PA 229 17.622 52.695 42.111 1.00 0.00 H ATOM 7093 C114 PA 229 17.093 54.720 42.983 1.00 0.00 C ATOM 7094 H14R PA 229 18.063 55.003 43.398 1.00 0.00 H ATOM 7095 H14S PA 229 16.509 54.256 43.780 1.00 0.00 H ATOM 7096 C113 PA 229 16.223 55.944 42.571 1.00 0.00 C ATOM 7097 H13R PA 229 15.208 55.617 42.337 1.00 0.00 H ATOM 7098 H13S PA 229 16.716 56.282 41.657 1.00 0.00 H ATOM 7099 C112 PA 229 16.233 57.003 43.697 1.00 0.00 C ATOM 7100 H12R PA 229 17.232 57.226 44.076 1.00 0.00 H ATOM 7101 H12S PA 229 15.699 56.602 44.561 1.00 0.00 H ATOM 7102 C111 PA 229 15.753 58.450 43.206 1.00 0.00 C ATOM 7103 H11R PA 229 14.923 58.228 42.531 1.00 0.00 H ATOM 7104 H11S PA 229 16.559 58.894 42.618 1.00 0.00 H ATOM 7105 C110 PA 229 15.387 59.469 44.241 1.00 0.00 C ATOM 7106 H10R PA 229 14.651 59.121 44.969 1.00 0.00 H ATOM 7107 H10S PA 229 14.745 60.224 43.782 1.00 0.00 H ATOM 7108 C19 PA 229 16.622 60.144 44.880 1.00 0.00 C ATOM 7109 H9R PA 229 17.314 60.308 44.052 1.00 0.00 H ATOM 7110 H9S PA 229 17.079 59.398 45.534 1.00 0.00 H ATOM 7111 C18 PA 229 16.388 61.370 45.656 1.00 0.00 C ATOM 7112 H8R PA 229 16.327 62.168 44.913 1.00 0.00 H ATOM 7113 H8S PA 229 17.311 61.512 46.222 1.00 0.00 H ATOM 7114 C17 PA 229 15.179 61.399 46.685 1.00 0.00 C ATOM 7115 H7R PA 229 15.393 60.598 47.395 1.00 0.00 H ATOM 7116 H7S PA 229 14.286 61.101 46.131 1.00 0.00 H ATOM 7117 C16 PA 229 15.227 62.649 47.453 1.00 0.00 C ATOM 7118 H6R PA 229 15.212 63.314 46.586 1.00 0.00 H ATOM 7119 H6S PA 229 16.138 62.743 48.048 1.00 0.00 H ATOM 7120 C15 PA 229 14.004 62.956 48.248 1.00 0.00 C ATOM 7121 H5R PA 229 13.805 62.253 49.059 1.00 0.00 H ATOM 7122 H5S PA 229 13.125 62.931 47.601 1.00 0.00 H ATOM 7123 C14 PA 229 14.059 64.326 48.954 1.00 0.00 C ATOM 7124 H4R PA 229 14.043 64.991 48.088 1.00 0.00 H ATOM 7125 H4S PA 229 14.989 64.420 49.520 1.00 0.00 H ATOM 7126 C13 PA 229 12.842 64.706 49.812 1.00 0.00 C ATOM 7127 H3R PA 229 11.888 64.312 49.455 1.00 0.00 H ATOM 7128 H3S PA 229 12.635 65.777 49.770 1.00 0.00 H ATOM 7129 C12 PA 229 13.173 64.433 51.265 1.00 0.00 C ATOM 7130 H2R PA 229 14.048 65.008 51.577 1.00 0.00 H ATOM 7131 H2S PA 229 13.294 63.368 51.472 1.00 0.00 H ATOM 7132 C11 PGR 230 12.089 64.892 52.278 1.00 0.00 C ATOM 7133 O12 PGR 230 11.768 64.247 53.286 1.00 0.00 O ATOM 7134 O11 PGR 230 11.634 66.150 51.983 1.00 0.00 O ATOM 7135 C1 PGR 230 10.703 66.846 52.948 1.00 0.00 C ATOM 7136 HR PGR 230 9.882 66.199 53.268 1.00 0.00 H ATOM 7137 HS PGR 230 10.263 67.772 52.570 1.00 0.00 H ATOM 7138 C2 PGR 230 11.440 67.246 54.224 1.00 0.00 C ATOM 7139 HX PGR 230 11.992 66.386 54.612 1.00 0.00 H ATOM 7140 C3 PGR 230 10.269 67.661 55.166 1.00 0.00 C ATOM 7141 HA PGR 230 9.548 66.856 55.328 1.00 0.00 H ATOM 7142 HB PGR 230 9.725 68.561 54.868 1.00 0.00 H ATOM 7143 O31 PGR 230 10.782 67.951 56.427 1.00 0.00 O ATOM 7144 P31 PGR 230 10.516 66.932 57.619 1.00 0.00 P ATOM 7145 O32 PGR 230 9.002 67.203 57.919 1.00 0.00 O ATOM 7146 C31 PGR 230 8.654 68.369 58.698 1.00 0.00 C ATOM 7147 H1A PGR 230 9.085 69.296 58.310 1.00 0.00 H ATOM 7148 H1B PGR 230 8.925 68.330 59.757 1.00 0.00 H ATOM 7149 C32 PGR 230 7.122 68.576 58.510 1.00 0.00 C ATOM 7150 H2A PGR 230 6.582 67.635 58.642 1.00 0.00 H ATOM 7151 O35 PGR 230 6.743 69.000 57.215 1.00 0.00 O ATOM 7152 HO5A PGR 230 7.011 68.239 56.670 1.00 0.00 H ATOM 7153 C33 PGR 230 6.508 69.608 59.493 1.00 0.00 C ATOM 7154 H3A PGR 230 7.000 69.400 60.446 1.00 0.00 H ATOM 7155 H3B PGR 230 6.911 70.580 59.196 1.00 0.00 H ATOM 7156 O33 PGR 230 10.653 65.519 57.280 1.00 0.00 O ATOM 7157 O34 PGR 230 11.273 67.502 58.783 1.00 0.00 O ATOM 7158 O21 PGR 230 12.209 68.416 53.919 1.00 0.00 O ATOM 7159 C21 PGR 230 13.448 68.220 53.315 1.00 0.00 C ATOM 7160 O22 PGR 230 13.995 67.173 53.160 1.00 0.00 O ATOM 7161 O36 PGR 230 5.098 69.606 59.482 1.00 0.00 O ATOM 7162 HO6A PGR 230 4.837 69.717 58.550 1.00 0.00 H ATOM 7163 C12 OL 231 13.985 69.453 52.813 1.00 0.00 C ATOM 7164 H2R OL 231 14.315 70.135 53.599 1.00 0.00 H ATOM 7165 H2S OL 231 14.897 69.160 52.289 1.00 0.00 H ATOM 7166 C13 OL 231 13.107 70.248 51.830 1.00 0.00 C ATOM 7167 H3R OL 231 12.224 70.592 52.373 1.00 0.00 H ATOM 7168 H3S OL 231 13.583 71.185 51.533 1.00 0.00 H ATOM 7169 C14 OL 231 12.694 69.589 50.466 1.00 0.00 C ATOM 7170 H4R OL 231 12.092 68.699 50.662 1.00 0.00 H ATOM 7171 H4S OL 231 12.095 70.308 49.903 1.00 0.00 H ATOM 7172 C15 OL 231 13.850 69.030 49.552 1.00 0.00 C ATOM 7173 H5R OL 231 14.580 68.456 50.127 1.00 0.00 H ATOM 7174 H5S OL 231 13.376 68.206 49.015 1.00 0.00 H ATOM 7175 C16 OL 231 14.687 69.959 48.693 1.00 0.00 C ATOM 7176 H6R OL 231 15.047 70.711 49.397 1.00 0.00 H ATOM 7177 H6S OL 231 15.593 69.536 48.254 1.00 0.00 H ATOM 7178 C17 OL 231 13.873 70.629 47.576 1.00 0.00 C ATOM 7179 H7R OL 231 12.820 70.446 47.800 1.00 0.00 H ATOM 7180 H7S OL 231 13.914 71.718 47.519 1.00 0.00 H ATOM 7181 C18 OL 231 14.184 70.041 46.165 1.00 0.00 C ATOM 7182 H8R OL 231 15.191 70.258 45.803 1.00 0.00 H ATOM 7183 H8S OL 231 14.114 68.953 46.102 1.00 0.00 H ATOM 7184 C19 OL 231 13.210 70.458 45.120 1.00 0.00 C ATOM 7185 H9R OL 231 12.153 70.583 45.343 1.00 0.00 H ATOM 7186 C110 OL 231 13.560 70.804 43.813 1.00 0.00 C ATOM 7187 H10R OL 231 12.736 71.020 43.138 1.00 0.00 H ATOM 7188 C111 OL 231 14.886 70.498 43.188 1.00 0.00 C ATOM 7189 H11R OL 231 15.604 71.274 43.461 1.00 0.00 H ATOM 7190 H11S OL 231 15.366 69.635 43.656 1.00 0.00 H ATOM 7191 C112 OL 231 14.822 70.300 41.695 1.00 0.00 C ATOM 7192 H12R OL 231 14.202 71.050 41.198 1.00 0.00 H ATOM 7193 H12S OL 231 15.842 70.558 41.405 1.00 0.00 H ATOM 7194 C113 OL 231 14.402 68.841 41.303 1.00 0.00 C ATOM 7195 H13R OL 231 15.214 68.185 41.624 1.00 0.00 H ATOM 7196 H13S OL 231 13.582 68.471 41.921 1.00 0.00 H ATOM 7197 C114 OL 231 14.165 68.637 39.796 1.00 0.00 C ATOM 7198 H14R OL 231 13.409 69.330 39.420 1.00 0.00 H ATOM 7199 H14S OL 231 15.036 68.881 39.186 1.00 0.00 H ATOM 7200 C115 OL 231 13.668 67.204 39.571 1.00 0.00 C ATOM 7201 H15R OL 231 14.492 66.557 39.880 1.00 0.00 H ATOM 7202 H15S OL 231 12.792 66.852 40.119 1.00 0.00 H ATOM 7203 C116 OL 231 13.350 66.960 38.076 1.00 0.00 C ATOM 7204 H16R OL 231 14.131 67.449 37.491 1.00 0.00 H ATOM 7205 H16S OL 231 13.384 65.937 37.696 1.00 0.00 H ATOM 7206 C117 OL 231 11.948 67.460 37.789 1.00 0.00 C ATOM 7207 H17R OL 231 11.189 67.042 38.454 1.00 0.00 H ATOM 7208 H17S OL 231 12.017 68.529 38.001 1.00 0.00 H ATOM 7209 C118 OL 231 11.418 67.103 36.372 1.00 0.00 C ATOM 7210 H18R OL 231 11.512 66.037 36.154 1.00 0.00 H ATOM 7211 H18S OL 231 11.936 67.573 35.533 1.00 0.00 H ATOM 7212 H18T OL 231 10.381 67.438 36.301 1.00 0.00 H TER 7213 OL 231 ATOM 7213 C116 PA 232 76.367 59.871 41.663 1.00 0.00 C ATOM 7214 H16R PA 232 76.644 60.021 40.617 1.00 0.00 H ATOM 7215 H16S PA 232 75.336 60.155 41.883 1.00 0.00 H ATOM 7216 H16T PA 232 76.367 58.806 41.907 1.00 0.00 H ATOM 7217 C115 PA 232 77.422 60.487 42.580 1.00 0.00 C ATOM 7218 H15R PA 232 77.430 61.578 42.628 1.00 0.00 H ATOM 7219 H15S PA 232 78.423 60.243 42.220 1.00 0.00 H ATOM 7220 C114 PA 232 77.247 59.825 43.971 1.00 0.00 C ATOM 7221 H14R PA 232 77.064 58.752 43.889 1.00 0.00 H ATOM 7222 H14S PA 232 76.348 60.211 44.455 1.00 0.00 H ATOM 7223 C113 PA 232 78.486 59.965 44.847 1.00 0.00 C ATOM 7224 H13R PA 232 78.836 60.985 44.680 1.00 0.00 H ATOM 7225 H13S PA 232 79.266 59.327 44.427 1.00 0.00 H ATOM 7226 C112 PA 232 78.379 59.688 46.304 1.00 0.00 C ATOM 7227 H12R PA 232 77.654 60.440 46.624 1.00 0.00 H ATOM 7228 H12S PA 232 79.286 60.015 46.815 1.00 0.00 H ATOM 7229 C111 PA 232 78.071 58.190 46.722 1.00 0.00 C ATOM 7230 H11R PA 232 78.943 57.552 46.563 1.00 0.00 H ATOM 7231 H11S PA 232 77.223 57.796 46.157 1.00 0.00 H ATOM 7232 C110 PA 232 77.525 58.246 48.100 1.00 0.00 C ATOM 7233 H10R PA 232 76.759 59.024 48.129 1.00 0.00 H ATOM 7234 H10S PA 232 78.257 58.496 48.871 1.00 0.00 H ATOM 7235 C19 PA 232 76.953 56.893 48.549 1.00 0.00 C ATOM 7236 H9R PA 232 77.783 56.201 48.706 1.00 0.00 H ATOM 7237 H9S PA 232 76.403 56.504 47.689 1.00 0.00 H ATOM 7238 C18 PA 232 76.121 57.061 49.777 1.00 0.00 C ATOM 7239 H8R PA 232 75.287 57.752 49.633 1.00 0.00 H ATOM 7240 H8S PA 232 76.857 57.413 50.502 1.00 0.00 H ATOM 7241 C17 PA 232 75.502 55.771 50.312 1.00 0.00 C ATOM 7242 H7R PA 232 74.890 55.312 49.532 1.00 0.00 H ATOM 7243 H7S PA 232 74.826 55.881 51.162 1.00 0.00 H ATOM 7244 C16 PA 232 76.598 54.744 50.796 1.00 0.00 C ATOM 7245 H6R PA 232 77.317 54.451 50.029 1.00 0.00 H ATOM 7246 H6S PA 232 76.010 53.869 51.084 1.00 0.00 H ATOM 7247 C15 PA 232 77.380 55.152 52.056 1.00 0.00 C ATOM 7248 H5R PA 232 76.767 55.211 52.957 1.00 0.00 H ATOM 7249 H5S PA 232 77.909 56.105 51.990 1.00 0.00 H ATOM 7250 C14 PA 232 78.363 54.101 52.502 1.00 0.00 C ATOM 7251 H4R PA 232 79.085 53.781 51.748 1.00 0.00 H ATOM 7252 H4S PA 232 77.654 53.277 52.599 1.00 0.00 H ATOM 7253 C13 PA 232 79.228 54.472 53.760 1.00 0.00 C ATOM 7254 H3R PA 232 78.672 54.941 54.574 1.00 0.00 H ATOM 7255 H3S PA 232 79.877 55.318 53.524 1.00 0.00 H ATOM 7256 C12 PA 232 80.177 53.312 54.277 1.00 0.00 C ATOM 7257 H2R PA 232 80.670 52.903 53.392 1.00 0.00 H ATOM 7258 H2S PA 232 79.559 52.591 54.815 1.00 0.00 H ATOM 7259 C11 PGR 233 81.121 53.842 55.271 1.00 0.00 C ATOM 7260 O12 PGR 233 82.313 53.865 55.078 1.00 0.00 O ATOM 7261 O11 PGR 233 80.598 54.395 56.336 1.00 0.00 O ATOM 7262 C1 PGR 233 81.534 54.868 57.381 1.00 0.00 C ATOM 7263 HR PGR 233 82.322 54.162 57.655 1.00 0.00 H ATOM 7264 HS PGR 233 81.063 54.946 58.364 1.00 0.00 H ATOM 7265 C2 PGR 233 82.088 56.297 57.036 1.00 0.00 C ATOM 7266 HX PGR 233 82.480 56.194 56.021 1.00 0.00 H ATOM 7267 C3 PGR 233 83.185 56.643 58.037 1.00 0.00 C ATOM 7268 HA PGR 233 83.452 57.703 58.059 1.00 0.00 H ATOM 7269 HB PGR 233 84.043 56.038 57.734 1.00 0.00 H ATOM 7270 O31 PGR 233 82.757 56.332 59.321 1.00 0.00 O ATOM 7271 P31 PGR 233 83.853 56.091 60.406 1.00 0.00 P ATOM 7272 O32 PGR 233 84.411 54.597 59.881 1.00 0.00 O ATOM 7273 C31 PGR 233 83.657 53.408 60.096 1.00 0.00 C ATOM 7274 H1A PGR 233 82.608 53.604 59.861 1.00 0.00 H ATOM 7275 H1B PGR 233 83.658 53.045 61.127 1.00 0.00 H ATOM 7276 C32 PGR 233 84.216 52.311 59.128 1.00 0.00 C ATOM 7277 H2A PGR 233 85.281 52.265 59.369 1.00 0.00 H ATOM 7278 O35 PGR 233 84.069 52.711 57.723 1.00 0.00 O ATOM 7279 HO5A PGR 233 84.024 51.901 57.184 1.00 0.00 H ATOM 7280 C33 PGR 233 83.413 50.997 59.408 1.00 0.00 C ATOM 7281 H3A PGR 233 83.582 50.717 60.451 1.00 0.00 H ATOM 7282 H3B PGR 233 82.341 51.185 59.303 1.00 0.00 H ATOM 7283 O33 PGR 233 84.942 57.090 60.113 1.00 0.00 O ATOM 7284 O34 PGR 233 83.162 56.092 61.746 1.00 0.00 O ATOM 7285 O21 PGR 233 80.950 57.127 57.058 1.00 0.00 O ATOM 7286 C21 PGR 233 81.060 58.400 56.604 1.00 0.00 C ATOM 7287 O22 PGR 233 82.040 58.944 56.168 1.00 0.00 O ATOM 7288 O36 PGR 233 83.867 49.894 58.527 1.00 0.00 O ATOM 7289 HO6A PGR 233 84.838 49.837 58.588 1.00 0.00 H ATOM 7290 C12 OL 234 79.737 59.032 56.408 1.00 0.00 C ATOM 7291 H2R OL 234 79.180 58.877 57.334 1.00 0.00 H ATOM 7292 H2S OL 234 79.984 60.090 56.300 1.00 0.00 H ATOM 7293 C13 OL 234 78.825 58.391 55.355 1.00 0.00 C ATOM 7294 H3R OL 234 78.403 57.477 55.778 1.00 0.00 H ATOM 7295 H3S OL 234 78.011 59.110 55.240 1.00 0.00 H ATOM 7296 C14 OL 234 79.376 58.159 53.997 1.00 0.00 C ATOM 7297 H4R OL 234 80.109 57.350 54.017 1.00 0.00 H ATOM 7298 H4S OL 234 78.613 57.753 53.330 1.00 0.00 H ATOM 7299 C15 OL 234 79.961 59.419 53.373 1.00 0.00 C ATOM 7300 H5R OL 234 79.388 60.330 53.556 1.00 0.00 H ATOM 7301 H5S OL 234 80.957 59.538 53.803 1.00 0.00 H ATOM 7302 C16 OL 234 80.115 59.265 51.831 1.00 0.00 C ATOM 7303 H6R OL 234 80.898 58.519 51.675 1.00 0.00 H ATOM 7304 H6S OL 234 79.195 58.884 51.383 1.00 0.00 H ATOM 7305 C17 OL 234 80.519 60.585 51.084 1.00 0.00 C ATOM 7306 H7R OL 234 79.775 61.353 51.304 1.00 0.00 H ATOM 7307 H7S OL 234 81.390 61.044 51.555 1.00 0.00 H ATOM 7308 C18 OL 234 80.717 60.350 49.625 1.00 0.00 C ATOM 7309 H8R OL 234 81.500 59.634 49.368 1.00 0.00 H ATOM 7310 H8S OL 234 79.757 60.013 49.229 1.00 0.00 H ATOM 7311 C19 OL 234 80.987 61.666 48.967 1.00 0.00 C ATOM 7312 H9R OL 234 82.065 61.764 48.869 1.00 0.00 H ATOM 7313 C110 OL 234 80.093 62.623 48.569 1.00 0.00 C ATOM 7314 H10R OL 234 80.455 63.461 47.978 1.00 0.00 H ATOM 7315 C111 OL 234 78.586 62.507 48.659 1.00 0.00 C ATOM 7316 H11R OL 234 78.123 62.539 47.671 1.00 0.00 H ATOM 7317 H11S OL 234 78.435 61.464 48.947 1.00 0.00 H ATOM 7318 C112 OL 234 77.963 63.571 49.624 1.00 0.00 C ATOM 7319 H12R OL 234 76.931 63.218 49.670 1.00 0.00 H ATOM 7320 H12S OL 234 78.296 63.705 50.655 1.00 0.00 H ATOM 7321 C113 OL 234 77.931 64.904 48.975 1.00 0.00 C ATOM 7322 H13R OL 234 78.787 64.826 48.300 1.00 0.00 H ATOM 7323 H13S OL 234 77.079 65.016 48.301 1.00 0.00 H ATOM 7324 C114 OL 234 77.986 66.233 49.749 1.00 0.00 C ATOM 7325 H14R OL 234 78.783 65.987 50.453 1.00 0.00 H ATOM 7326 H14S OL 234 78.445 66.947 49.062 1.00 0.00 H ATOM 7327 C115 OL 234 76.697 66.708 50.420 1.00 0.00 C ATOM 7328 H15R OL 234 75.832 66.845 49.766 1.00 0.00 H ATOM 7329 H15S OL 234 76.414 65.938 51.140 1.00 0.00 H ATOM 7330 C116 OL 234 76.884 67.991 51.221 1.00 0.00 C ATOM 7331 H16R OL 234 77.791 67.906 51.824 1.00 0.00 H ATOM 7332 H16S OL 234 77.073 68.819 50.535 1.00 0.00 H ATOM 7333 C117 OL 234 75.718 68.345 52.008 1.00 0.00 C ATOM 7334 H17R OL 234 74.881 68.479 51.320 1.00 0.00 H ATOM 7335 H17S OL 234 75.358 67.481 52.571 1.00 0.00 H ATOM 7336 C118 OL 234 75.845 69.646 52.736 1.00 0.00 C ATOM 7337 H18R OL 234 76.125 70.478 52.087 1.00 0.00 H ATOM 7338 H18S OL 234 76.509 69.587 53.600 1.00 0.00 H ATOM 7339 H18T OL 234 74.844 69.889 53.099 1.00 0.00 H TER 7340 OL 234 ATOM 7340 C116 PA 235 5.573 87.827 40.702 1.00 0.00 C ATOM 7341 H16R PA 235 6.539 87.883 40.195 1.00 0.00 H ATOM 7342 H16S PA 235 4.913 88.093 39.874 1.00 0.00 H ATOM 7343 H16T PA 235 5.202 86.867 41.068 1.00 0.00 H ATOM 7344 C115 PA 235 5.601 88.972 41.756 1.00 0.00 C ATOM 7345 H15R PA 235 4.641 89.126 42.253 1.00 0.00 H ATOM 7346 H15S PA 235 5.740 89.827 41.092 1.00 0.00 H ATOM 7347 C114 PA 235 6.726 88.909 42.740 1.00 0.00 C ATOM 7348 H14R PA 235 7.709 88.911 42.264 1.00 0.00 H ATOM 7349 H14S PA 235 6.643 87.997 43.335 1.00 0.00 H ATOM 7350 C113 PA 235 6.633 90.062 43.806 1.00 0.00 C ATOM 7351 H13R PA 235 5.609 90.309 44.096 1.00 0.00 H ATOM 7352 H13S PA 235 6.990 90.965 43.306 1.00 0.00 H ATOM 7353 C112 PA 235 7.435 89.776 45.080 1.00 0.00 C ATOM 7354 H12R PA 235 8.487 89.871 44.803 1.00 0.00 H ATOM 7355 H12S PA 235 7.347 88.736 45.401 1.00 0.00 H ATOM 7356 C111 PA 235 7.050 90.640 46.282 1.00 0.00 C ATOM 7357 H11R PA 235 7.814 90.425 47.033 1.00 0.00 H ATOM 7358 H11S PA 235 6.076 90.330 46.667 1.00 0.00 H ATOM 7359 C110 PA 235 6.909 92.183 46.139 1.00 0.00 C ATOM 7360 H10R PA 235 5.957 92.277 45.612 1.00 0.00 H ATOM 7361 H10S PA 235 7.673 92.643 45.509 1.00 0.00 H ATOM 7362 C19 PA 235 6.750 92.799 47.462 1.00 0.00 C ATOM 7363 H9R PA 235 6.041 92.281 48.110 1.00 0.00 H ATOM 7364 H9S PA 235 6.247 93.760 47.333 1.00 0.00 H ATOM 7365 C18 PA 235 8.037 93.024 48.222 1.00 0.00 C ATOM 7366 H8R PA 235 8.682 93.655 47.607 1.00 0.00 H ATOM 7367 H8S PA 235 8.382 91.991 48.303 1.00 0.00 H ATOM 7368 C17 PA 235 7.762 93.636 49.598 1.00 0.00 C ATOM 7369 H7R PA 235 6.980 93.072 50.111 1.00 0.00 H ATOM 7370 H7S PA 235 7.277 94.592 49.388 1.00 0.00 H ATOM 7371 C16 PA 235 9.022 93.828 50.511 1.00 0.00 C ATOM 7372 H6R PA 235 9.791 94.305 49.901 1.00 0.00 H ATOM 7373 H6S PA 235 9.450 92.906 50.909 1.00 0.00 H ATOM 7374 C15 PA 235 8.707 94.838 51.582 1.00 0.00 C ATOM 7375 H5R PA 235 7.695 94.648 51.945 1.00 0.00 H ATOM 7376 H5S PA 235 8.724 95.777 51.026 1.00 0.00 H ATOM 7377 C14 PA 235 9.667 94.850 52.662 1.00 0.00 C ATOM 7378 H4R PA 235 10.620 94.452 52.310 1.00 0.00 H ATOM 7379 H4S PA 235 9.260 94.101 53.345 1.00 0.00 H ATOM 7380 C13 PA 235 9.913 96.211 53.273 1.00 0.00 C ATOM 7381 H3R PA 235 8.956 96.701 53.463 1.00 0.00 H ATOM 7382 H3S PA 235 10.377 96.881 52.546 1.00 0.00 H ATOM 7383 C12 PA 235 10.731 96.093 54.574 1.00 0.00 C ATOM 7384 H2R PA 235 11.005 97.109 54.866 1.00 0.00 H ATOM 7385 H2S PA 235 11.703 95.608 54.460 1.00 0.00 H ATOM 7386 C11 PGR 236 9.908 95.354 55.604 1.00 0.00 C ATOM 7387 O12 PGR 236 8.702 95.433 55.734 1.00 0.00 O ATOM 7388 O11 PGR 236 10.604 94.479 56.393 1.00 0.00 O ATOM 7389 C1 PGR 236 9.921 93.757 57.432 1.00 0.00 C ATOM 7390 HR PGR 236 9.488 94.539 58.061 1.00 0.00 H ATOM 7391 HS PGR 236 10.632 93.204 58.052 1.00 0.00 H ATOM 7392 C2 PGR 236 8.864 92.721 56.950 1.00 0.00 C ATOM 7393 HX PGR 236 8.001 93.229 56.512 1.00 0.00 H ATOM 7394 C3 PGR 236 8.119 92.004 58.088 1.00 0.00 C ATOM 7395 HA PGR 236 7.363 91.307 57.718 1.00 0.00 H ATOM 7396 HB PGR 236 7.556 92.776 58.617 1.00 0.00 H ATOM 7397 O31 PGR 236 9.032 91.444 59.038 1.00 0.00 O ATOM 7398 P31 PGR 236 8.462 90.407 60.150 1.00 0.00 P ATOM 7399 O32 PGR 236 7.391 91.330 60.950 1.00 0.00 O ATOM 7400 C31 PGR 236 7.717 92.620 61.495 1.00 0.00 C ATOM 7401 H1A PGR 236 8.285 93.076 60.680 1.00 0.00 H ATOM 7402 H1B PGR 236 8.356 92.574 62.381 1.00 0.00 H ATOM 7403 C32 PGR 236 6.547 93.563 61.731 1.00 0.00 C ATOM 7404 H2A PGR 236 6.735 94.588 61.401 1.00 0.00 H ATOM 7405 O35 PGR 236 6.120 93.389 63.023 1.00 0.00 O ATOM 7406 HO5A PGR 236 5.728 92.499 63.083 1.00 0.00 H ATOM 7407 C33 PGR 236 5.373 93.163 60.748 1.00 0.00 C ATOM 7408 H3A PGR 236 4.576 93.907 60.824 1.00 0.00 H ATOM 7409 H3B PGR 236 5.794 93.238 59.742 1.00 0.00 H ATOM 7410 O33 PGR 236 7.758 89.258 59.451 1.00 0.00 O ATOM 7411 O34 PGR 236 9.608 90.082 61.034 1.00 0.00 O ATOM 7412 O21 PGR 236 9.438 91.832 55.973 1.00 0.00 O ATOM 7413 C21 PGR 236 8.674 91.075 55.188 1.00 0.00 C ATOM 7414 O22 PGR 236 7.440 91.201 55.171 1.00 0.00 O ATOM 7415 O36 PGR 236 4.916 91.825 61.087 1.00 0.00 O ATOM 7416 HO6A PGR 236 5.691 91.236 61.136 1.00 0.00 H ATOM 7417 C12 OL 237 9.617 90.121 54.480 1.00 0.00 C ATOM 7418 H2R OL 237 10.631 90.513 54.583 1.00 0.00 H ATOM 7419 H2S OL 237 9.496 89.135 54.935 1.00 0.00 H ATOM 7420 C13 OL 237 9.276 90.147 53.003 1.00 0.00 C ATOM 7421 H3R OL 237 8.191 90.201 52.897 1.00 0.00 H ATOM 7422 H3S OL 237 9.519 91.179 52.740 1.00 0.00 H ATOM 7423 C14 OL 237 10.148 89.329 52.000 1.00 0.00 C ATOM 7424 H4R OL 237 11.215 89.557 52.050 1.00 0.00 H ATOM 7425 H4S OL 237 10.174 88.295 52.348 1.00 0.00 H ATOM 7426 C15 OL 237 9.860 89.522 50.451 1.00 0.00 C ATOM 7427 H5R OL 237 8.789 89.362 50.311 1.00 0.00 H ATOM 7428 H5S OL 237 10.123 90.555 50.216 1.00 0.00 H ATOM 7429 C16 OL 237 10.472 88.428 49.640 1.00 0.00 C ATOM 7430 H6R OL 237 11.510 88.494 49.974 1.00 0.00 H ATOM 7431 H6S OL 237 9.968 87.509 49.946 1.00 0.00 H ATOM 7432 C17 OL 237 10.341 88.581 48.133 1.00 0.00 C ATOM 7433 H7R OL 237 9.259 88.690 48.031 1.00 0.00 H ATOM 7434 H7S OL 237 10.856 89.540 48.051 1.00 0.00 H ATOM 7435 C18 OL 237 10.962 87.676 47.199 1.00 0.00 C ATOM 7436 H8R OL 237 12.035 87.635 47.400 1.00 0.00 H ATOM 7437 H8S OL 237 10.680 86.669 47.511 1.00 0.00 H ATOM 7438 C19 OL 237 10.687 87.936 45.816 1.00 0.00 C ATOM 7439 H9R OL 237 9.701 87.580 45.532 1.00 0.00 H ATOM 7440 C110 OL 237 11.471 88.568 44.991 1.00 0.00 C ATOM 7441 H10R OL 237 11.170 88.575 43.946 1.00 0.00 H ATOM 7442 C111 OL 237 12.886 89.044 45.235 1.00 0.00 C ATOM 7443 H11R OL 237 12.807 90.133 45.277 1.00 0.00 H ATOM 7444 H11S OL 237 13.315 88.782 46.204 1.00 0.00 H ATOM 7445 C112 OL 237 13.981 88.482 44.312 1.00 0.00 C ATOM 7446 H12R OL 237 13.654 88.743 43.304 1.00 0.00 H ATOM 7447 H12S OL 237 14.924 88.991 44.523 1.00 0.00 H ATOM 7448 C113 OL 237 14.171 86.946 44.349 1.00 0.00 C ATOM 7449 H13R OL 237 14.596 86.580 45.286 1.00 0.00 H ATOM 7450 H13S OL 237 13.140 86.593 44.281 1.00 0.00 H ATOM 7451 C114 OL 237 15.010 86.313 43.297 1.00 0.00 C ATOM 7452 H14R OL 237 14.593 85.325 43.092 1.00 0.00 H ATOM 7453 H14S OL 237 14.883 86.877 42.371 1.00 0.00 H ATOM 7454 C115 OL 237 16.510 86.147 43.534 1.00 0.00 C ATOM 7455 H15R OL 237 16.685 85.526 44.416 1.00 0.00 H ATOM 7456 H15S OL 237 16.925 85.573 42.703 1.00 0.00 H ATOM 7457 C116 OL 237 17.225 87.409 43.808 1.00 0.00 C ATOM 7458 H16R OL 237 16.925 87.890 44.741 1.00 0.00 H ATOM 7459 H16S OL 237 18.255 87.205 44.110 1.00 0.00 H ATOM 7460 C117 OL 237 17.180 88.450 42.646 1.00 0.00 C ATOM 7461 H17R OL 237 17.970 88.250 41.919 1.00 0.00 H ATOM 7462 H17S OL 237 16.222 88.390 42.126 1.00 0.00 H ATOM 7463 C118 OL 237 17.456 89.901 43.070 1.00 0.00 C ATOM 7464 H18R OL 237 18.441 90.059 43.513 1.00 0.00 H ATOM 7465 H18S OL 237 16.667 90.144 43.785 1.00 0.00 H ATOM 7466 H18T OL 237 17.357 90.581 42.221 1.00 0.00 H TER 7467 OL 237 ATOM 7467 C116 PA 238 117.051 34.993 36.075 1.00 0.00 C ATOM 7468 H16R PA 238 116.326 34.325 36.544 1.00 0.00 H ATOM 7469 H16S PA 238 117.933 34.361 35.949 1.00 0.00 H ATOM 7470 H16T PA 238 116.683 35.221 35.073 1.00 0.00 H ATOM 7471 C115 PA 238 117.193 36.188 36.910 1.00 0.00 C ATOM 7472 H15R PA 238 116.258 36.745 36.815 1.00 0.00 H ATOM 7473 H15S PA 238 118.016 36.861 36.661 1.00 0.00 H ATOM 7474 C114 PA 238 117.427 35.862 38.405 1.00 0.00 C ATOM 7475 H14R PA 238 118.179 35.107 38.640 1.00 0.00 H ATOM 7476 H14S PA 238 116.485 35.476 38.803 1.00 0.00 H ATOM 7477 C113 PA 238 117.828 36.981 39.344 1.00 0.00 C ATOM 7478 H13R PA 238 116.971 37.649 39.238 1.00 0.00 H ATOM 7479 H13S PA 238 118.654 37.557 38.921 1.00 0.00 H ATOM 7480 C112 PA 238 118.033 36.496 40.767 1.00 0.00 C ATOM 7481 H12R PA 238 118.676 35.621 40.653 1.00 0.00 H ATOM 7482 H12S PA 238 117.089 36.189 41.222 1.00 0.00 H ATOM 7483 C111 PA 238 118.614 37.534 41.710 1.00 0.00 C ATOM 7484 H11R PA 238 119.602 37.792 41.323 1.00 0.00 H ATOM 7485 H11S PA 238 118.910 37.093 42.664 1.00 0.00 H ATOM 7486 C110 PA 238 117.772 38.832 41.852 1.00 0.00 C ATOM 7487 H10R PA 238 116.996 38.943 42.612 1.00 0.00 H ATOM 7488 H10S PA 238 117.063 38.855 41.022 1.00 0.00 H ATOM 7489 C19 PA 238 118.608 40.075 41.858 1.00 0.00 C ATOM 7490 H9R PA 238 118.039 41.005 41.792 1.00 0.00 H ATOM 7491 H9S PA 238 119.157 40.110 40.915 1.00 0.00 H ATOM 7492 C18 PA 238 119.581 40.211 43.029 1.00 0.00 C ATOM 7493 H8R PA 238 120.253 41.018 42.730 1.00 0.00 H ATOM 7494 H8S PA 238 120.101 39.268 43.212 1.00 0.00 H ATOM 7495 C17 PA 238 118.790 40.692 44.270 1.00 0.00 C ATOM 7496 H7R PA 238 118.012 39.970 44.528 1.00 0.00 H ATOM 7497 H7S PA 238 118.388 41.663 43.976 1.00 0.00 H ATOM 7498 C16 PA 238 119.751 40.890 45.447 1.00 0.00 C ATOM 7499 H6R PA 238 120.465 41.678 45.200 1.00 0.00 H ATOM 7500 H6S PA 238 120.290 39.999 45.779 1.00 0.00 H ATOM 7501 C15 PA 238 119.015 41.265 46.672 1.00 0.00 C ATOM 7502 H5R PA 238 118.596 40.311 46.999 1.00 0.00 H ATOM 7503 H5S PA 238 118.232 42.020 46.575 1.00 0.00 H ATOM 7504 C14 PA 238 119.838 41.951 47.712 1.00 0.00 C ATOM 7505 H4R PA 238 120.237 42.845 47.229 1.00 0.00 H ATOM 7506 H4S PA 238 120.792 41.458 47.911 1.00 0.00 H ATOM 7507 C13 PA 238 119.208 42.469 48.973 1.00 0.00 C ATOM 7508 H3R PA 238 118.437 43.189 48.689 1.00 0.00 H ATOM 7509 H3S PA 238 119.984 42.877 49.624 1.00 0.00 H ATOM 7510 C12 PA 238 118.429 41.346 49.702 1.00 0.00 C ATOM 7511 H2R PA 238 119.124 40.552 49.982 1.00 0.00 H ATOM 7512 H2S PA 238 117.669 40.894 49.061 1.00 0.00 H ATOM 7513 C11 PC 239 117.808 41.835 50.997 1.00 0.00 C ATOM 7514 O12 PC 239 117.840 42.965 51.356 1.00 0.00 O ATOM 7515 O11 PC 239 116.868 40.946 51.570 1.00 0.00 O ATOM 7516 C1 PC 239 116.440 41.213 52.934 1.00 0.00 C ATOM 7517 HR PC 239 115.858 42.138 52.923 1.00 0.00 H ATOM 7518 HS PC 239 117.277 41.420 53.606 1.00 0.00 H ATOM 7519 C2 PC 239 115.575 40.056 53.437 1.00 0.00 C ATOM 7520 HX PC 239 114.779 39.884 52.709 1.00 0.00 H ATOM 7521 C3 PC 239 114.992 40.302 54.869 1.00 0.00 C ATOM 7522 HA PC 239 114.445 39.424 55.222 1.00 0.00 H ATOM 7523 HB PC 239 114.175 41.020 54.755 1.00 0.00 H ATOM 7524 O31 PC 239 116.036 40.693 55.690 1.00 0.00 O ATOM 7525 P31 PC 239 115.946 41.961 56.636 1.00 0.00 P ATOM 7526 O32 PC 239 115.214 41.431 57.926 1.00 0.00 O ATOM 7527 C31 PC 239 113.850 41.180 57.946 1.00 0.00 C ATOM 7528 H1A PC 239 113.571 40.364 57.275 1.00 0.00 H ATOM 7529 H1B PC 239 113.369 42.100 57.605 1.00 0.00 H ATOM 7530 C32 PC 239 113.256 41.008 59.331 1.00 0.00 C ATOM 7531 H2A PC 239 112.186 41.220 59.368 1.00 0.00 H ATOM 7532 H2B PC 239 113.773 41.729 59.966 1.00 0.00 H ATOM 7533 N31 PC 239 113.418 39.676 60.052 1.00 0.00 N ATOM 7534 C33 PC 239 112.696 39.816 61.310 1.00 0.00 C ATOM 7535 H3A PC 239 113.065 40.692 61.846 1.00 0.00 H ATOM 7536 H3B PC 239 112.765 38.904 61.904 1.00 0.00 H ATOM 7537 H3C PC 239 111.628 39.922 61.111 1.00 0.00 H ATOM 7538 C34 PC 239 112.836 38.568 59.213 1.00 0.00 C ATOM 7539 H4A PC 239 111.762 38.670 59.049 1.00 0.00 H ATOM 7540 H4B PC 239 112.949 37.668 59.820 1.00 0.00 H ATOM 7541 H4C PC 239 113.320 38.415 58.248 1.00 0.00 H ATOM 7542 C35 PC 239 114.930 39.431 60.224 1.00 0.00 C ATOM 7543 H5A PC 239 115.406 39.407 59.242 1.00 0.00 H ATOM 7544 H5B PC 239 115.016 38.435 60.662 1.00 0.00 H ATOM 7545 H5C PC 239 115.288 40.288 60.795 1.00 0.00 H ATOM 7546 O33 PC 239 117.291 42.355 57.065 1.00 0.00 O ATOM 7547 O34 PC 239 115.060 42.971 55.939 1.00 0.00 O ATOM 7548 O21 PC 239 116.261 38.750 53.261 1.00 0.00 O ATOM 7549 C21 PC 239 117.414 38.545 53.920 1.00 0.00 C ATOM 7550 O22 PC 239 118.160 39.343 54.491 1.00 0.00 O ATOM 7551 C12 OL 240 117.883 37.164 53.713 1.00 0.00 C ATOM 7552 H2R OL 240 118.553 36.854 54.518 1.00 0.00 H ATOM 7553 H2S OL 240 117.012 36.507 53.749 1.00 0.00 H ATOM 7554 C13 OL 240 118.470 36.990 52.218 1.00 0.00 C ATOM 7555 H3R OL 240 118.977 36.035 52.066 1.00 0.00 H ATOM 7556 H3S OL 240 117.775 36.966 51.376 1.00 0.00 H ATOM 7557 C14 OL 240 119.492 38.089 51.922 1.00 0.00 C ATOM 7558 H4R OL 240 118.998 39.055 51.793 1.00 0.00 H ATOM 7559 H4S OL 240 120.265 38.175 52.688 1.00 0.00 H ATOM 7560 C15 OL 240 120.212 37.929 50.637 1.00 0.00 C ATOM 7561 H5R OL 240 121.009 38.675 50.611 1.00 0.00 H ATOM 7562 H5S OL 240 120.778 36.995 50.623 1.00 0.00 H ATOM 7563 C16 OL 240 119.390 37.927 49.328 1.00 0.00 C ATOM 7564 H6R OL 240 118.999 36.919 49.176 1.00 0.00 H ATOM 7565 H6S OL 240 118.556 38.629 49.390 1.00 0.00 H ATOM 7566 C17 OL 240 120.203 38.152 47.962 1.00 0.00 C ATOM 7567 H7R OL 240 119.559 37.902 47.116 1.00 0.00 H ATOM 7568 H7S OL 240 120.464 39.185 47.721 1.00 0.00 H ATOM 7569 C18 OL 240 121.485 37.319 47.707 1.00 0.00 C ATOM 7570 H8R OL 240 122.225 37.717 48.404 1.00 0.00 H ATOM 7571 H8S OL 240 121.389 36.274 48.009 1.00 0.00 H ATOM 7572 C19 OL 240 122.111 37.467 46.419 1.00 0.00 C ATOM 7573 H9R OL 240 122.727 38.351 46.281 1.00 0.00 H ATOM 7574 C110 OL 240 121.901 36.634 45.393 1.00 0.00 C ATOM 7575 H10R OL 240 122.462 36.857 44.489 1.00 0.00 H ATOM 7576 C111 OL 240 121.052 35.296 45.410 1.00 0.00 C ATOM 7577 H11R OL 240 121.722 34.433 45.417 1.00 0.00 H ATOM 7578 H11S OL 240 120.584 35.082 46.373 1.00 0.00 H ATOM 7579 C112 OL 240 120.075 35.140 44.269 1.00 0.00 C ATOM 7580 H12R OL 240 119.383 35.972 44.408 1.00 0.00 H ATOM 7581 H12S OL 240 120.664 35.344 43.372 1.00 0.00 H ATOM 7582 C113 OL 240 119.388 33.726 44.117 1.00 0.00 C ATOM 7583 H13R OL 240 120.136 32.962 44.337 1.00 0.00 H ATOM 7584 H13S OL 240 118.612 33.716 44.884 1.00 0.00 H ATOM 7585 C114 OL 240 118.911 33.559 42.631 1.00 0.00 C ATOM 7586 H14R OL 240 117.984 34.128 42.538 1.00 0.00 H ATOM 7587 H14S OL 240 119.716 34.105 42.134 1.00 0.00 H ATOM 7588 C115 OL 240 118.694 32.108 42.158 1.00 0.00 C ATOM 7589 H15R OL 240 119.651 31.600 42.296 1.00 0.00 H ATOM 7590 H15S OL 240 117.864 31.654 42.701 1.00 0.00 H ATOM 7591 C116 OL 240 118.287 32.015 40.657 1.00 0.00 C ATOM 7592 H16R OL 240 117.515 31.307 40.352 1.00 0.00 H ATOM 7593 H16S OL 240 117.893 32.932 40.215 1.00 0.00 H ATOM 7594 C117 OL 240 119.500 31.497 39.767 1.00 0.00 C ATOM 7595 H17R OL 240 120.325 32.213 39.770 1.00 0.00 H ATOM 7596 H17S OL 240 119.792 30.557 40.238 1.00 0.00 H ATOM 7597 C118 OL 240 119.165 31.213 38.311 1.00 0.00 C ATOM 7598 H18R OL 240 118.289 30.567 38.219 1.00 0.00 H ATOM 7599 H18S OL 240 119.918 30.674 37.732 1.00 0.00 H ATOM 7600 H18T OL 240 119.002 32.171 37.812 1.00 0.00 H TER 7601 OL 240 ATOM 7601 C116 PA 241 55.146 94.922 41.767 1.00 0.00 C ATOM 7602 H16R PA 241 54.467 95.579 41.220 1.00 0.00 H ATOM 7603 H16S PA 241 54.620 94.111 42.276 1.00 0.00 H ATOM 7604 H16T PA 241 55.759 94.322 41.091 1.00 0.00 H ATOM 7605 C115 PA 241 56.040 95.776 42.631 1.00 0.00 C ATOM 7606 H15R PA 241 55.430 96.316 43.358 1.00 0.00 H ATOM 7607 H15S PA 241 56.618 96.577 42.166 1.00 0.00 H ATOM 7608 C114 PA 241 56.948 94.939 43.456 1.00 0.00 C ATOM 7609 H14R PA 241 57.677 94.459 42.800 1.00 0.00 H ATOM 7610 H14S PA 241 56.348 94.120 43.861 1.00 0.00 H ATOM 7611 C113 PA 241 57.711 95.701 44.526 1.00 0.00 C ATOM 7612 H13R PA 241 58.400 96.429 44.093 1.00 0.00 H ATOM 7613 H13S PA 241 58.296 94.950 45.060 1.00 0.00 H ATOM 7614 C112 PA 241 56.840 96.351 45.606 1.00 0.00 C ATOM 7615 H12R PA 241 56.129 95.640 46.032 1.00 0.00 H ATOM 7616 H12S PA 241 56.153 97.040 45.109 1.00 0.00 H ATOM 7617 C111 PA 241 57.640 97.136 46.645 1.00 0.00 C ATOM 7618 H11R PA 241 58.272 97.873 46.145 1.00 0.00 H ATOM 7619 H11S PA 241 58.360 96.573 47.243 1.00 0.00 H ATOM 7620 C110 PA 241 56.787 97.887 47.665 1.00 0.00 C ATOM 7621 H10R PA 241 56.198 97.109 48.155 1.00 0.00 H ATOM 7622 H10S PA 241 55.999 98.444 47.155 1.00 0.00 H ATOM 7623 C19 PA 241 57.521 98.804 48.526 1.00 0.00 C ATOM 7624 H9R PA 241 57.937 99.641 47.962 1.00 0.00 H ATOM 7625 H9S PA 241 58.394 98.249 48.877 1.00 0.00 H ATOM 7626 C18 PA 241 56.729 99.360 49.627 1.00 0.00 C ATOM 7627 H8R PA 241 56.449 98.546 50.300 1.00 0.00 H ATOM 7628 H8S PA 241 55.870 99.964 49.327 1.00 0.00 H ATOM 7629 C17 PA 241 57.419 100.307 50.597 1.00 0.00 C ATOM 7630 H7R PA 241 57.931 101.089 50.032 1.00 0.00 H ATOM 7631 H7S PA 241 58.183 99.739 51.132 1.00 0.00 H ATOM 7632 C16 PA 241 56.544 100.799 51.744 1.00 0.00 C ATOM 7633 H6R PA 241 56.022 99.955 52.198 1.00 0.00 H ATOM 7634 H6S PA 241 55.681 101.346 51.359 1.00 0.00 H ATOM 7635 C15 PA 241 57.376 101.546 52.789 1.00 0.00 C ATOM 7636 H5R PA 241 57.803 102.424 52.301 1.00 0.00 H ATOM 7637 H5S PA 241 58.265 101.004 53.119 1.00 0.00 H ATOM 7638 C14 PA 241 56.581 102.020 54.006 1.00 0.00 C ATOM 7639 H4R PA 241 55.872 102.737 53.585 1.00 0.00 H ATOM 7640 H4S PA 241 57.205 102.655 54.639 1.00 0.00 H ATOM 7641 C13 PA 241 55.885 100.911 54.814 1.00 0.00 C ATOM 7642 H3R PA 241 55.089 100.643 54.116 1.00 0.00 H ATOM 7643 H3S PA 241 55.336 101.317 55.666 1.00 0.00 H ATOM 7644 C12 PA 241 56.772 99.692 55.142 1.00 0.00 C ATOM 7645 H2R PA 241 57.226 99.228 54.263 1.00 0.00 H ATOM 7646 H2S PA 241 56.052 98.987 55.563 1.00 0.00 H ATOM 7647 C11 PGR 242 57.738 99.909 56.264 1.00 0.00 C ATOM 7648 O12 PGR 242 57.563 100.679 57.198 1.00 0.00 O ATOM 7649 O11 PGR 242 58.869 99.168 56.162 1.00 0.00 O ATOM 7650 C1 PGR 242 59.866 99.398 57.147 1.00 0.00 C ATOM 7651 HR PGR 242 59.560 99.029 58.129 1.00 0.00 H ATOM 7652 HS PGR 242 60.065 100.454 57.346 1.00 0.00 H ATOM 7653 C2 PGR 242 61.095 98.662 56.554 1.00 0.00 C ATOM 7654 HX PGR 242 60.850 97.612 56.374 1.00 0.00 H ATOM 7655 C3 PGR 242 62.424 98.748 57.476 1.00 0.00 C ATOM 7656 HA PGR 242 63.171 98.038 57.111 1.00 0.00 H ATOM 7657 HB PGR 242 62.033 98.426 58.445 1.00 0.00 H ATOM 7658 O31 PGR 242 62.902 100.107 57.615 1.00 0.00 O ATOM 7659 P31 PGR 242 64.036 100.532 58.589 1.00 0.00 P ATOM 7660 O32 PGR 242 65.400 100.073 57.876 1.00 0.00 O ATOM 7661 C31 PGR 242 65.654 100.458 56.516 1.00 0.00 C ATOM 7662 H1A PGR 242 64.852 100.086 55.872 1.00 0.00 H ATOM 7663 H1B PGR 242 65.825 101.533 56.420 1.00 0.00 H ATOM 7664 C32 PGR 242 66.930 99.704 55.981 1.00 0.00 C ATOM 7665 H2A PGR 242 66.848 98.698 56.400 1.00 0.00 H ATOM 7666 O35 PGR 242 68.072 100.350 56.376 1.00 0.00 O ATOM 7667 HO5A PGR 242 68.131 101.177 55.866 1.00 0.00 H ATOM 7668 C33 PGR 242 66.823 99.604 54.466 1.00 0.00 C ATOM 7669 H3A PGR 242 67.742 99.047 54.265 1.00 0.00 H ATOM 7670 H3B PGR 242 65.945 99.004 54.215 1.00 0.00 H ATOM 7671 O33 PGR 242 63.981 101.999 58.605 1.00 0.00 O ATOM 7672 O34 PGR 242 63.853 99.785 59.880 1.00 0.00 O ATOM 7673 O21 PGR 242 61.285 99.229 55.189 1.00 0.00 O ATOM 7674 C21 PGR 242 62.177 98.647 54.359 1.00 0.00 C ATOM 7675 O22 PGR 242 62.821 97.700 54.623 1.00 0.00 O ATOM 7676 O36 PGR 242 66.920 100.863 53.766 1.00 0.00 O ATOM 7677 HO6A PGR 242 66.130 101.426 53.851 1.00 0.00 H ATOM 7678 C12 OL 243 62.162 99.231 52.986 1.00 0.00 C ATOM 7679 H2R OL 243 61.180 99.151 52.517 1.00 0.00 H ATOM 7680 H2S OL 243 62.426 100.286 53.087 1.00 0.00 H ATOM 7681 C13 OL 243 63.220 98.630 52.017 1.00 0.00 C ATOM 7682 H3R OL 243 63.226 99.302 51.156 1.00 0.00 H ATOM 7683 H3S OL 243 64.266 98.675 52.328 1.00 0.00 H ATOM 7684 C14 OL 243 62.763 97.301 51.431 1.00 0.00 C ATOM 7685 H4R OL 243 62.521 96.678 52.294 1.00 0.00 H ATOM 7686 H4S OL 243 61.771 97.395 50.985 1.00 0.00 H ATOM 7687 C15 OL 243 63.731 96.557 50.504 1.00 0.00 C ATOM 7688 H5R OL 243 63.200 95.690 50.106 1.00 0.00 H ATOM 7689 H5S OL 243 63.875 97.329 49.746 1.00 0.00 H ATOM 7690 C16 OL 243 65.092 96.197 51.059 1.00 0.00 C ATOM 7691 H6R OL 243 65.516 97.088 51.527 1.00 0.00 H ATOM 7692 H6S OL 243 65.019 95.485 51.884 1.00 0.00 H ATOM 7693 C17 OL 243 66.147 95.792 49.981 1.00 0.00 C ATOM 7694 H7R OL 243 65.627 95.023 49.406 1.00 0.00 H ATOM 7695 H7S OL 243 66.404 96.590 49.281 1.00 0.00 H ATOM 7696 C18 OL 243 67.353 95.153 50.559 1.00 0.00 C ATOM 7697 H8R OL 243 67.915 95.851 51.184 1.00 0.00 H ATOM 7698 H8S OL 243 67.086 94.255 51.119 1.00 0.00 H ATOM 7699 C19 OL 243 68.314 94.521 49.591 1.00 0.00 C ATOM 7700 H9R OL 243 67.872 93.757 48.957 1.00 0.00 H ATOM 7701 C110 OL 243 69.574 94.917 49.353 1.00 0.00 C ATOM 7702 H10R OL 243 70.189 94.465 48.580 1.00 0.00 H ATOM 7703 C111 OL 243 70.198 95.991 50.126 1.00 0.00 C ATOM 7704 H11R OL 243 69.523 96.760 50.507 1.00 0.00 H ATOM 7705 H11S OL 243 70.811 95.610 50.946 1.00 0.00 H ATOM 7706 C112 OL 243 71.068 96.727 49.118 1.00 0.00 C ATOM 7707 H12R OL 243 71.719 97.113 49.905 1.00 0.00 H ATOM 7708 H12S OL 243 71.809 96.145 48.566 1.00 0.00 H ATOM 7709 C113 OL 243 70.395 97.825 48.397 1.00 0.00 C ATOM 7710 H13R OL 243 69.581 97.345 47.850 1.00 0.00 H ATOM 7711 H13S OL 243 70.090 98.662 49.028 1.00 0.00 H ATOM 7712 C114 OL 243 71.394 98.285 47.312 1.00 0.00 C ATOM 7713 H14R OL 243 72.415 98.368 47.692 1.00 0.00 H ATOM 7714 H14S OL 243 71.536 97.487 46.580 1.00 0.00 H ATOM 7715 C115 OL 243 70.917 99.609 46.548 1.00 0.00 C ATOM 7716 H15R OL 243 69.896 99.460 46.190 1.00 0.00 H ATOM 7717 H15S OL 243 71.001 100.498 47.176 1.00 0.00 H ATOM 7718 C116 OL 243 71.813 99.784 45.284 1.00 0.00 C ATOM 7719 H16R OL 243 72.889 99.636 45.395 1.00 0.00 H ATOM 7720 H16S OL 243 71.674 98.982 44.556 1.00 0.00 H ATOM 7721 C117 OL 243 71.733 101.174 44.554 1.00 0.00 C ATOM 7722 H17R OL 243 70.749 101.439 44.160 1.00 0.00 H ATOM 7723 H17S OL 243 72.183 101.939 45.190 1.00 0.00 H ATOM 7724 C118 OL 243 72.553 101.143 43.223 1.00 0.00 C ATOM 7725 H18R OL 243 72.702 102.121 42.761 1.00 0.00 H ATOM 7726 H18S OL 243 72.193 100.381 42.529 1.00 0.00 H ATOM 7727 H18T OL 243 73.582 100.795 43.330 1.00 0.00 H TER 7728 OL 243 ATOM 7728 C116 PA 244 12.630 79.420 44.210 1.00 0.00 C ATOM 7729 H16R PA 244 12.343 80.473 44.164 1.00 0.00 H ATOM 7730 H16S PA 244 12.557 79.220 45.281 1.00 0.00 H ATOM 7731 H16T PA 244 11.897 78.780 43.714 1.00 0.00 H ATOM 7732 C115 PA 244 13.956 79.317 43.504 1.00 0.00 C ATOM 7733 H15R PA 244 13.768 79.607 42.469 1.00 0.00 H ATOM 7734 H15S PA 244 14.238 78.262 43.495 1.00 0.00 H ATOM 7735 C114 PA 244 15.004 80.230 44.038 1.00 0.00 C ATOM 7736 H14R PA 244 14.770 81.293 43.957 1.00 0.00 H ATOM 7737 H14S PA 244 15.848 80.044 43.370 1.00 0.00 H ATOM 7738 C113 PA 244 15.328 79.961 45.533 1.00 0.00 C ATOM 7739 H13R PA 244 14.479 80.253 46.154 1.00 0.00 H ATOM 7740 H13S PA 244 16.176 80.587 45.819 1.00 0.00 H ATOM 7741 C112 PA 244 15.803 78.602 45.821 1.00 0.00 C ATOM 7742 H12R PA 244 16.621 78.423 45.120 1.00 0.00 H ATOM 7743 H12S PA 244 15.059 77.864 45.517 1.00 0.00 H ATOM 7744 C111 PA 244 16.224 78.346 47.247 1.00 0.00 C ATOM 7745 H11R PA 244 15.318 78.600 47.802 1.00 0.00 H ATOM 7746 H11S PA 244 17.017 79.018 47.582 1.00 0.00 H ATOM 7747 C110 PA 244 16.626 76.951 47.455 1.00 0.00 C ATOM 7748 H10R PA 244 17.586 76.854 46.944 1.00 0.00 H ATOM 7749 H10S PA 244 15.972 76.237 46.950 1.00 0.00 H ATOM 7750 C19 PA 244 16.910 76.688 48.954 1.00 0.00 C ATOM 7751 H9R PA 244 16.004 76.696 49.564 1.00 0.00 H ATOM 7752 H9S PA 244 17.506 77.501 49.375 1.00 0.00 H ATOM 7753 C18 PA 244 17.626 75.354 49.132 1.00 0.00 C ATOM 7754 H8R PA 244 17.854 75.166 50.183 1.00 0.00 H ATOM 7755 H8S PA 244 18.600 75.439 48.645 1.00 0.00 H ATOM 7756 C17 PA 244 17.008 74.146 48.391 1.00 0.00 C ATOM 7757 H7R PA 244 16.685 74.367 47.372 1.00 0.00 H ATOM 7758 H7S PA 244 16.071 73.813 48.841 1.00 0.00 H ATOM 7759 C16 PA 244 17.803 72.901 48.360 1.00 0.00 C ATOM 7760 H6R PA 244 18.696 73.095 47.763 1.00 0.00 H ATOM 7761 H6S PA 244 17.300 72.044 47.908 1.00 0.00 H ATOM 7762 C15 PA 244 18.284 72.446 49.713 1.00 0.00 C ATOM 7763 H5R PA 244 17.455 72.349 50.417 1.00 0.00 H ATOM 7764 H5S PA 244 18.891 73.242 50.148 1.00 0.00 H ATOM 7765 C14 PA 244 18.975 71.053 49.675 1.00 0.00 C ATOM 7766 H4R PA 244 19.599 71.126 48.782 1.00 0.00 H ATOM 7767 H4S PA 244 18.409 70.277 49.155 1.00 0.00 H ATOM 7768 C13 PA 244 19.711 70.562 50.850 1.00 0.00 C ATOM 7769 H3R PA 244 18.985 70.040 51.477 1.00 0.00 H ATOM 7770 H3S PA 244 20.062 71.376 51.489 1.00 0.00 H ATOM 7771 C12 PA 244 20.806 69.562 50.450 1.00 0.00 C ATOM 7772 H2R PA 244 21.438 69.904 49.628 1.00 0.00 H ATOM 7773 H2S PA 244 20.420 68.711 49.887 1.00 0.00 H ATOM 7774 C11 PC 245 21.637 69.168 51.730 1.00 0.00 C ATOM 7775 O12 PC 245 22.386 68.204 51.632 1.00 0.00 O ATOM 7776 O11 PC 245 21.535 69.944 52.791 1.00 0.00 O ATOM 7777 C1 PC 245 22.343 69.705 54.010 1.00 0.00 C ATOM 7778 HR PC 245 22.469 68.622 54.080 1.00 0.00 H ATOM 7779 HS PC 245 21.867 70.165 54.880 1.00 0.00 H ATOM 7780 C2 PC 245 23.739 70.256 53.861 1.00 0.00 C ATOM 7781 HX PC 245 24.213 69.715 53.039 1.00 0.00 H ATOM 7782 C3 PC 245 24.516 70.027 55.166 1.00 0.00 C ATOM 7783 HA PC 245 25.559 70.322 55.024 1.00 0.00 H ATOM 7784 HB PC 245 24.437 68.965 55.410 1.00 0.00 H ATOM 7785 O31 PC 245 23.875 70.739 56.219 1.00 0.00 O ATOM 7786 P31 PC 245 24.423 70.517 57.685 1.00 0.00 P ATOM 7787 O32 PC 245 26.014 70.975 57.583 1.00 0.00 O ATOM 7788 C31 PC 245 26.998 70.213 58.221 1.00 0.00 C ATOM 7789 H1A PC 245 28.006 70.586 58.028 1.00 0.00 H ATOM 7790 H1B PC 245 26.938 69.172 57.891 1.00 0.00 H ATOM 7791 C32 PC 245 26.812 70.325 59.755 1.00 0.00 C ATOM 7792 H2A PC 245 25.859 69.844 59.979 1.00 0.00 H ATOM 7793 H2B PC 245 26.779 71.365 60.084 1.00 0.00 H ATOM 7794 N31 PC 245 27.718 69.621 60.678 1.00 0.00 N ATOM 7795 C33 PC 245 27.425 70.102 62.055 1.00 0.00 C ATOM 7796 H3A PC 245 28.113 69.572 62.715 1.00 0.00 H ATOM 7797 H3B PC 245 26.404 69.797 62.288 1.00 0.00 H ATOM 7798 H3C PC 245 27.624 71.175 62.084 1.00 0.00 H ATOM 7799 C34 PC 245 27.502 68.211 60.618 1.00 0.00 C ATOM 7800 H4A PC 245 26.435 68.004 60.712 1.00 0.00 H ATOM 7801 H4B PC 245 28.092 67.711 61.387 1.00 0.00 H ATOM 7802 H4C PC 245 27.841 67.828 59.654 1.00 0.00 H ATOM 7803 C35 PC 245 29.147 69.815 60.283 1.00 0.00 C ATOM 7804 H5A PC 245 29.232 69.655 59.207 1.00 0.00 H ATOM 7805 H5B PC 245 29.833 69.136 60.791 1.00 0.00 H ATOM 7806 H5C PC 245 29.478 70.843 60.441 1.00 0.00 H ATOM 7807 O33 PC 245 23.674 71.520 58.511 1.00 0.00 O ATOM 7808 O34 PC 245 24.308 69.037 57.974 1.00 0.00 O ATOM 7809 O21 PC 245 23.663 71.632 53.608 1.00 0.00 O ATOM 7810 C21 PC 245 23.572 72.045 52.335 1.00 0.00 C ATOM 7811 O22 PC 245 24.071 71.406 51.446 1.00 0.00 O ATOM 7812 C12 OL 246 22.998 73.436 52.176 1.00 0.00 C ATOM 7813 H2R OL 246 21.970 73.431 52.544 1.00 0.00 H ATOM 7814 H2S OL 246 23.544 74.105 52.845 1.00 0.00 H ATOM 7815 C13 OL 246 23.122 73.990 50.764 1.00 0.00 C ATOM 7816 H3R OL 246 22.853 75.048 50.746 1.00 0.00 H ATOM 7817 H3S OL 246 24.108 73.858 50.314 1.00 0.00 H ATOM 7818 C14 OL 246 22.176 73.324 49.826 1.00 0.00 C ATOM 7819 H4R OL 246 22.510 72.330 49.522 1.00 0.00 H ATOM 7820 H4S OL 246 21.247 73.109 50.358 1.00 0.00 H ATOM 7821 C15 OL 246 21.844 74.067 48.495 1.00 0.00 C ATOM 7822 H5R OL 246 21.144 73.497 47.881 1.00 0.00 H ATOM 7823 H5S OL 246 21.255 74.956 48.730 1.00 0.00 H ATOM 7824 C16 OL 246 23.181 74.344 47.756 1.00 0.00 C ATOM 7825 H6R OL 246 22.817 74.749 46.809 1.00 0.00 H ATOM 7826 H6S OL 246 23.676 75.192 48.234 1.00 0.00 H ATOM 7827 C17 OL 246 24.109 73.155 47.441 1.00 0.00 C ATOM 7828 H7R OL 246 24.703 72.783 48.279 1.00 0.00 H ATOM 7829 H7S OL 246 23.457 72.303 47.239 1.00 0.00 H ATOM 7830 C18 OL 246 25.017 73.277 46.272 1.00 0.00 C ATOM 7831 H8R OL 246 25.817 74.007 46.411 1.00 0.00 H ATOM 7832 H8S OL 246 25.547 72.333 46.129 1.00 0.00 H ATOM 7833 C19 OL 246 24.226 73.705 45.061 1.00 0.00 C ATOM 7834 H9R OL 246 23.753 74.684 45.072 1.00 0.00 H ATOM 7835 C110 OL 246 24.105 72.947 43.964 1.00 0.00 C ATOM 7836 H10R OL 246 23.428 73.402 43.246 1.00 0.00 H ATOM 7837 C111 OL 246 24.679 71.631 43.653 1.00 0.00 C ATOM 7838 H11R OL 246 25.670 71.853 43.252 1.00 0.00 H ATOM 7839 H11S OL 246 24.778 71.103 44.604 1.00 0.00 H ATOM 7840 C112 OL 246 23.809 70.972 42.538 1.00 0.00 C ATOM 7841 H12R OL 246 24.038 69.905 42.507 1.00 0.00 H ATOM 7842 H12S OL 246 22.732 70.971 42.721 1.00 0.00 H ATOM 7843 C113 OL 246 24.060 71.591 41.163 1.00 0.00 C ATOM 7844 H13R OL 246 23.830 72.658 41.156 1.00 0.00 H ATOM 7845 H13S OL 246 25.124 71.503 40.933 1.00 0.00 H ATOM 7846 C114 OL 246 23.348 70.960 40.024 1.00 0.00 C ATOM 7847 H14R OL 246 23.747 71.364 39.091 1.00 0.00 H ATOM 7848 H14S OL 246 23.666 69.917 39.967 1.00 0.00 H ATOM 7849 C115 OL 246 21.816 71.022 40.135 1.00 0.00 C ATOM 7850 H15R OL 246 21.672 70.335 40.971 1.00 0.00 H ATOM 7851 H15S OL 246 21.502 72.040 40.375 1.00 0.00 H ATOM 7852 C116 OL 246 21.011 70.507 38.981 1.00 0.00 C ATOM 7853 H16R OL 246 21.449 70.815 38.030 1.00 0.00 H ATOM 7854 H16S OL 246 21.030 69.416 38.933 1.00 0.00 H ATOM 7855 C117 OL 246 19.572 71.086 39.059 1.00 0.00 C ATOM 7856 H17R OL 246 19.668 72.094 39.470 1.00 0.00 H ATOM 7857 H17S OL 246 19.193 71.091 38.035 1.00 0.00 H ATOM 7858 C118 OL 246 18.583 70.241 39.862 1.00 0.00 C ATOM 7859 H18R OL 246 18.954 70.248 40.889 1.00 0.00 H ATOM 7860 H18S OL 246 18.418 69.188 39.629 1.00 0.00 H ATOM 7861 H18T OL 246 17.633 70.775 39.786 1.00 0.00 H TER 7862 OL 246 ATOM 7862 C116 PA 247 35.862 41.541 45.499 1.00 0.00 C ATOM 7863 H16R PA 247 36.740 41.184 46.042 1.00 0.00 H ATOM 7864 H16S PA 247 35.951 42.629 45.524 1.00 0.00 H ATOM 7865 H16T PA 247 36.051 41.287 44.453 1.00 0.00 H ATOM 7866 C115 PA 247 34.519 40.920 45.975 1.00 0.00 C ATOM 7867 H15R PA 247 34.420 39.873 45.678 1.00 0.00 H ATOM 7868 H15S PA 247 33.728 41.528 45.532 1.00 0.00 H ATOM 7869 C114 PA 247 34.335 40.931 47.477 1.00 0.00 C ATOM 7870 H14R PA 247 34.817 41.856 47.801 1.00 0.00 H ATOM 7871 H14S PA 247 34.871 40.095 47.932 1.00 0.00 H ATOM 7872 C113 PA 247 32.845 41.015 47.999 1.00 0.00 C ATOM 7873 H13R PA 247 32.167 40.297 47.533 1.00 0.00 H ATOM 7874 H13S PA 247 32.438 42.003 47.774 1.00 0.00 H ATOM 7875 C112 PA 247 32.848 41.062 49.537 1.00 0.00 C ATOM 7876 H12R PA 247 31.821 41.192 49.885 1.00 0.00 H ATOM 7877 H12S PA 247 33.551 41.875 49.729 1.00 0.00 H ATOM 7878 C111 PA 247 33.413 39.881 50.186 1.00 0.00 C ATOM 7879 H11R PA 247 33.423 40.102 51.255 1.00 0.00 H ATOM 7880 H11S PA 247 34.473 39.850 49.923 1.00 0.00 H ATOM 7881 C110 PA 247 32.486 38.636 49.959 1.00 0.00 C ATOM 7882 H10R PA 247 32.321 38.475 48.892 1.00 0.00 H ATOM 7883 H10S PA 247 31.518 38.841 50.421 1.00 0.00 H ATOM 7884 C19 PA 247 32.886 37.293 50.572 1.00 0.00 C ATOM 7885 H9R PA 247 33.166 37.445 51.616 1.00 0.00 H ATOM 7886 H9S PA 247 33.769 36.967 50.019 1.00 0.00 H ATOM 7887 C18 PA 247 31.726 36.210 50.595 1.00 0.00 C ATOM 7888 H8R PA 247 31.486 35.973 49.557 1.00 0.00 H ATOM 7889 H8S PA 247 30.838 36.638 51.065 1.00 0.00 H ATOM 7890 C17 PA 247 32.221 34.897 51.255 1.00 0.00 C ATOM 7891 H7R PA 247 33.278 34.830 50.990 1.00 0.00 H ATOM 7892 H7S PA 247 31.710 34.047 50.798 1.00 0.00 H ATOM 7893 C16 PA 247 32.095 34.946 52.761 1.00 0.00 C ATOM 7894 H6R PA 247 32.158 35.961 53.159 1.00 0.00 H ATOM 7895 H6S PA 247 33.023 34.512 53.138 1.00 0.00 H ATOM 7896 C15 PA 247 30.890 34.139 53.356 1.00 0.00 C ATOM 7897 H5R PA 247 31.042 33.058 53.325 1.00 0.00 H ATOM 7898 H5S PA 247 29.997 34.366 52.769 1.00 0.00 H ATOM 7899 C14 PA 247 30.548 34.470 54.828 1.00 0.00 C ATOM 7900 H4R PA 247 29.721 33.786 55.030 1.00 0.00 H ATOM 7901 H4S PA 247 30.015 35.421 54.879 1.00 0.00 H ATOM 7902 C13 PA 247 31.687 34.322 55.884 1.00 0.00 C ATOM 7903 H3R PA 247 32.576 34.849 55.531 1.00 0.00 H ATOM 7904 H3S PA 247 31.846 33.242 55.892 1.00 0.00 H ATOM 7905 C12 PA 247 31.313 34.719 57.366 1.00 0.00 C ATOM 7906 H2R PA 247 30.813 33.976 57.990 1.00 0.00 H ATOM 7907 H2S PA 247 30.676 35.607 57.357 1.00 0.00 H ATOM 7908 C11 PGR 248 32.438 35.132 58.263 1.00 0.00 C ATOM 7909 O12 PGR 248 32.279 35.373 59.450 1.00 0.00 O ATOM 7910 O11 PGR 248 33.708 35.266 57.791 1.00 0.00 O ATOM 7911 C1 PGR 248 34.652 36.003 58.586 1.00 0.00 C ATOM 7912 HR PGR 248 34.184 36.904 58.990 1.00 0.00 H ATOM 7913 HS PGR 248 35.458 36.175 57.868 1.00 0.00 H ATOM 7914 C2 PGR 248 35.148 35.258 59.774 1.00 0.00 C ATOM 7915 HX PGR 248 34.360 34.859 60.417 1.00 0.00 H ATOM 7916 C3 PGR 248 35.933 36.291 60.638 1.00 0.00 C ATOM 7917 HA PGR 248 35.209 37.052 60.943 1.00 0.00 H ATOM 7918 HB PGR 248 36.691 36.703 59.967 1.00 0.00 H ATOM 7919 O31 PGR 248 36.345 35.703 61.813 1.00 0.00 O ATOM 7920 P31 PGR 248 37.567 36.141 62.693 1.00 0.00 P ATOM 7921 O32 PGR 248 38.701 35.062 62.330 1.00 0.00 O ATOM 7922 C31 PGR 248 39.836 35.526 61.728 1.00 0.00 C ATOM 7923 H1A PGR 248 40.393 36.179 62.405 1.00 0.00 H ATOM 7924 H1B PGR 248 39.543 35.930 60.756 1.00 0.00 H ATOM 7925 C32 PGR 248 40.811 34.355 61.243 1.00 0.00 C ATOM 7926 H2A PGR 248 41.818 34.510 60.846 1.00 0.00 H ATOM 7927 O35 PGR 248 40.029 33.516 60.335 1.00 0.00 O ATOM 7928 HO5A PGR 248 40.399 32.621 60.227 1.00 0.00 H ATOM 7929 C33 PGR 248 41.170 33.545 62.498 1.00 0.00 C ATOM 7930 H3A PGR 248 41.478 34.257 63.268 1.00 0.00 H ATOM 7931 H3B PGR 248 40.319 32.951 62.841 1.00 0.00 H ATOM 7932 O33 PGR 248 37.986 37.550 62.326 1.00 0.00 O ATOM 7933 O34 PGR 248 37.199 35.925 64.097 1.00 0.00 O ATOM 7934 O21 PGR 248 36.007 34.238 59.291 1.00 0.00 O ATOM 7935 C21 PGR 248 35.433 33.068 59.135 1.00 0.00 C ATOM 7936 O22 PGR 248 34.263 32.713 59.250 1.00 0.00 O ATOM 7937 O36 PGR 248 42.262 32.667 62.121 1.00 0.00 O ATOM 7938 HO6A PGR 248 41.977 32.179 61.328 1.00 0.00 H ATOM 7939 C12 OL 249 36.537 32.140 58.653 1.00 0.00 C ATOM 7940 H2R OL 249 37.515 32.509 58.970 1.00 0.00 H ATOM 7941 H2S OL 249 36.395 31.079 58.870 1.00 0.00 H ATOM 7942 C13 OL 249 36.584 32.263 57.135 1.00 0.00 C ATOM 7943 H3R OL 249 37.010 33.219 56.822 1.00 0.00 H ATOM 7944 H3S OL 249 37.363 31.581 56.787 1.00 0.00 H ATOM 7945 C14 OL 249 35.216 32.069 56.415 1.00 0.00 C ATOM 7946 H4R OL 249 34.786 31.167 56.854 1.00 0.00 H ATOM 7947 H4S OL 249 34.647 32.991 56.558 1.00 0.00 H ATOM 7948 C15 OL 249 35.169 31.801 54.857 1.00 0.00 C ATOM 7949 H5R OL 249 35.429 32.722 54.332 1.00 0.00 H ATOM 7950 H5S OL 249 35.843 31.008 54.527 1.00 0.00 H ATOM 7951 C16 OL 249 33.792 31.350 54.472 1.00 0.00 C ATOM 7952 H6R OL 249 33.737 30.319 54.829 1.00 0.00 H ATOM 7953 H6S OL 249 32.917 31.884 54.849 1.00 0.00 H ATOM 7954 C17 OL 249 33.621 31.225 52.998 1.00 0.00 C ATOM 7955 H7R OL 249 33.277 32.202 52.653 1.00 0.00 H ATOM 7956 H7S OL 249 34.510 30.935 52.434 1.00 0.00 H ATOM 7957 C18 OL 249 32.411 30.355 52.673 1.00 0.00 C ATOM 7958 H8R OL 249 31.552 30.763 53.210 1.00 0.00 H ATOM 7959 H8S OL 249 32.214 30.493 51.608 1.00 0.00 H ATOM 7960 C19 OL 249 32.599 28.958 53.000 1.00 0.00 C ATOM 7961 H9R OL 249 32.177 28.574 53.925 1.00 0.00 H ATOM 7962 C110 OL 249 33.195 28.022 52.209 1.00 0.00 C ATOM 7963 H10R OL 249 33.153 26.999 52.575 1.00 0.00 H ATOM 7964 C111 OL 249 33.934 28.195 50.907 1.00 0.00 C ATOM 7965 H11R OL 249 34.075 29.264 50.736 1.00 0.00 H ATOM 7966 H11S OL 249 34.983 27.897 50.966 1.00 0.00 H ATOM 7967 C112 OL 249 33.227 27.745 49.588 1.00 0.00 C ATOM 7968 H12R OL 249 32.223 28.173 49.547 1.00 0.00 H ATOM 7969 H12S OL 249 33.788 28.162 48.749 1.00 0.00 H ATOM 7970 C113 OL 249 33.204 26.194 49.444 1.00 0.00 C ATOM 7971 H13R OL 249 34.110 25.758 49.871 1.00 0.00 H ATOM 7972 H13S OL 249 32.571 25.725 50.200 1.00 0.00 H ATOM 7973 C114 OL 249 32.881 25.768 48.064 1.00 0.00 C ATOM 7974 H14R OL 249 32.034 26.191 47.519 1.00 0.00 H ATOM 7975 H14S OL 249 33.735 26.060 47.450 1.00 0.00 H ATOM 7976 C115 OL 249 32.873 24.126 48.094 1.00 0.00 C ATOM 7977 H15R OL 249 33.779 23.628 48.445 1.00 0.00 H ATOM 7978 H15S OL 249 32.155 23.757 48.830 1.00 0.00 H ATOM 7979 C116 OL 249 32.686 23.458 46.731 1.00 0.00 C ATOM 7980 H16R OL 249 31.708 23.794 46.378 1.00 0.00 H ATOM 7981 H16S OL 249 33.454 23.826 46.047 1.00 0.00 H ATOM 7982 C117 OL 249 32.581 21.985 46.752 1.00 0.00 C ATOM 7983 H17R OL 249 33.395 21.373 47.147 1.00 0.00 H ATOM 7984 H17S OL 249 31.794 21.721 47.462 1.00 0.00 H ATOM 7985 C118 OL 249 32.438 21.330 45.429 1.00 0.00 C ATOM 7986 H18R OL 249 31.652 21.869 44.896 1.00 0.00 H ATOM 7987 H18S OL 249 32.229 20.273 45.604 1.00 0.00 H ATOM 7988 H18T OL 249 33.367 21.378 44.857 1.00 0.00 H TER 7989 OL 249 ATOM 7989 C116 PA 250 37.775 63.187 43.499 1.00 0.00 C ATOM 7990 H16R PA 250 38.772 62.993 43.899 1.00 0.00 H ATOM 7991 H16S PA 250 37.287 63.976 44.075 1.00 0.00 H ATOM 7992 H16T PA 250 38.166 63.589 42.563 1.00 0.00 H ATOM 7993 C115 PA 250 37.144 61.869 43.305 1.00 0.00 C ATOM 7994 H15R PA 250 37.899 61.213 42.868 1.00 0.00 H ATOM 7995 H15S PA 250 36.416 61.966 42.497 1.00 0.00 H ATOM 7996 C114 PA 250 36.724 61.259 44.714 1.00 0.00 C ATOM 7997 H14R PA 250 35.892 61.789 45.184 1.00 0.00 H ATOM 7998 H14S PA 250 37.622 61.292 45.335 1.00 0.00 H ATOM 7999 C113 PA 250 36.325 59.771 44.645 1.00 0.00 C ATOM 8000 H13R PA 250 35.998 59.533 45.659 1.00 0.00 H ATOM 8001 H13S PA 250 37.138 59.076 44.426 1.00 0.00 H ATOM 8002 C112 PA 250 35.043 59.463 43.852 1.00 0.00 C ATOM 8003 H12R PA 250 35.384 59.568 42.820 1.00 0.00 H ATOM 8004 H12S PA 250 34.239 60.163 44.092 1.00 0.00 H ATOM 8005 C111 PA 250 34.556 58.019 43.874 1.00 0.00 C ATOM 8006 H11R PA 250 34.858 57.535 44.806 1.00 0.00 H ATOM 8007 H11S PA 250 34.961 57.455 43.031 1.00 0.00 H ATOM 8008 C110 PA 250 33.014 58.095 43.708 1.00 0.00 C ATOM 8009 H10R PA 250 32.615 58.850 43.027 1.00 0.00 H ATOM 8010 H10S PA 250 32.634 58.508 44.645 1.00 0.00 H ATOM 8011 C19 PA 250 32.255 56.746 43.489 1.00 0.00 C ATOM 8012 H9R PA 250 32.488 56.421 42.473 1.00 0.00 H ATOM 8013 H9S PA 250 31.168 56.853 43.470 1.00 0.00 H ATOM 8014 C18 PA 250 32.563 55.617 44.453 1.00 0.00 C ATOM 8015 H8R PA 250 33.636 55.586 44.653 1.00 0.00 H ATOM 8016 H8S PA 250 32.386 54.642 43.996 1.00 0.00 H ATOM 8017 C17 PA 250 32.008 55.822 45.867 1.00 0.00 C ATOM 8018 H7R PA 250 30.917 55.873 45.882 1.00 0.00 H ATOM 8019 H7S PA 250 32.253 56.801 46.285 1.00 0.00 H ATOM 8020 C16 PA 250 32.364 54.687 46.857 1.00 0.00 C ATOM 8021 H6R PA 250 33.442 54.704 47.028 1.00 0.00 H ATOM 8022 H6S PA 250 32.100 53.717 46.432 1.00 0.00 H ATOM 8023 C15 PA 250 31.618 54.707 48.175 1.00 0.00 C ATOM 8024 H5R PA 250 31.714 53.747 48.686 1.00 0.00 H ATOM 8025 H5S PA 250 30.566 54.754 47.884 1.00 0.00 H ATOM 8026 C14 PA 250 32.039 55.785 49.165 1.00 0.00 C ATOM 8027 H4R PA 250 31.753 56.719 48.676 1.00 0.00 H ATOM 8028 H4S PA 250 33.121 55.808 49.308 1.00 0.00 H ATOM 8029 C13 PA 250 31.270 55.613 50.456 1.00 0.00 C ATOM 8030 H3R PA 250 31.687 54.725 50.937 1.00 0.00 H ATOM 8031 H3S PA 250 30.239 55.278 50.326 1.00 0.00 H ATOM 8032 C12 PA 250 31.219 56.778 51.498 1.00 0.00 C ATOM 8033 H2R PA 250 30.573 57.606 51.198 1.00 0.00 H ATOM 8034 H2S PA 250 30.779 56.466 52.447 1.00 0.00 H ATOM 8035 C11 PGR 251 32.598 57.343 51.718 1.00 0.00 C ATOM 8036 O12 PGR 251 32.981 58.302 51.041 1.00 0.00 O ATOM 8037 O11 PGR 251 33.271 56.714 52.680 1.00 0.00 O ATOM 8038 C1 PGR 251 34.682 57.190 52.935 1.00 0.00 C ATOM 8039 HR PGR 251 35.354 57.189 52.073 1.00 0.00 H ATOM 8040 HS PGR 251 35.100 56.502 53.674 1.00 0.00 H ATOM 8041 C2 PGR 251 34.725 58.578 53.676 1.00 0.00 C ATOM 8042 HX PGR 251 35.672 58.584 54.221 1.00 0.00 H ATOM 8043 C3 PGR 251 33.665 58.801 54.789 1.00 0.00 C ATOM 8044 HA PGR 251 33.801 59.711 55.380 1.00 0.00 H ATOM 8045 HB PGR 251 33.695 58.062 55.593 1.00 0.00 H ATOM 8046 O31 PGR 251 32.279 58.971 54.298 1.00 0.00 O ATOM 8047 P31 PGR 251 31.108 58.486 55.225 1.00 0.00 P ATOM 8048 O32 PGR 251 30.937 56.986 54.922 1.00 0.00 O ATOM 8049 C31 PGR 251 31.709 55.941 55.564 1.00 0.00 C ATOM 8050 H1A PGR 251 31.644 56.027 56.652 1.00 0.00 H ATOM 8051 H1B PGR 251 32.725 56.177 55.240 1.00 0.00 H ATOM 8052 C32 PGR 251 31.186 54.573 55.168 1.00 0.00 C ATOM 8053 H2A PGR 251 31.073 54.525 54.082 1.00 0.00 H ATOM 8054 O35 PGR 251 30.023 54.237 55.809 1.00 0.00 O ATOM 8055 HO5A PGR 251 29.960 53.277 55.964 1.00 0.00 H ATOM 8056 C33 PGR 251 32.314 53.491 55.473 1.00 0.00 C ATOM 8057 H3A PGR 251 33.208 53.966 55.062 1.00 0.00 H ATOM 8058 H3B PGR 251 32.396 53.308 56.548 1.00 0.00 H ATOM 8059 O33 PGR 251 31.454 58.719 56.665 1.00 0.00 O ATOM 8060 O34 PGR 251 29.829 58.984 54.685 1.00 0.00 O ATOM 8061 O21 PGR 251 34.744 59.658 52.806 1.00 0.00 O ATOM 8062 C21 PGR 251 35.795 59.841 51.947 1.00 0.00 C ATOM 8063 O22 PGR 251 36.827 59.259 52.091 1.00 0.00 O ATOM 8064 O36 PGR 251 32.071 52.300 54.803 1.00 0.00 O ATOM 8065 HO6A PGR 251 31.774 52.536 53.906 1.00 0.00 H ATOM 8066 C12 OL 252 35.429 60.757 50.845 1.00 0.00 C ATOM 8067 H2R OL 252 34.658 60.224 50.285 1.00 0.00 H ATOM 8068 H2S OL 252 34.954 61.688 51.164 1.00 0.00 H ATOM 8069 C13 OL 252 36.595 61.143 49.964 1.00 0.00 C ATOM 8070 H3R OL 252 36.911 60.132 49.700 1.00 0.00 H ATOM 8071 H3S OL 252 36.287 61.659 49.053 1.00 0.00 H ATOM 8072 C14 OL 252 37.665 61.945 50.579 1.00 0.00 C ATOM 8073 H4R OL 252 37.245 62.835 51.053 1.00 0.00 H ATOM 8074 H4S OL 252 38.142 61.327 51.342 1.00 0.00 H ATOM 8075 C15 OL 252 38.645 62.646 49.582 1.00 0.00 C ATOM 8076 H5R OL 252 38.018 63.398 49.099 1.00 0.00 H ATOM 8077 H5S OL 252 39.260 63.308 50.195 1.00 0.00 H ATOM 8078 C16 OL 252 39.341 61.724 48.563 1.00 0.00 C ATOM 8079 H6R OL 252 40.303 61.260 48.789 1.00 0.00 H ATOM 8080 H6S OL 252 38.704 60.918 48.192 1.00 0.00 H ATOM 8081 C17 OL 252 39.721 62.532 47.230 1.00 0.00 C ATOM 8082 H7R OL 252 39.825 61.818 46.410 1.00 0.00 H ATOM 8083 H7S OL 252 38.927 63.247 47.008 1.00 0.00 H ATOM 8084 C18 OL 252 41.039 63.392 47.420 1.00 0.00 C ATOM 8085 H8R OL 252 40.788 64.189 48.123 1.00 0.00 H ATOM 8086 H8S OL 252 41.809 62.695 47.757 1.00 0.00 H ATOM 8087 C19 OL 252 41.465 64.161 46.197 1.00 0.00 C ATOM 8088 H9R OL 252 41.038 65.161 46.182 1.00 0.00 H ATOM 8089 C110 OL 252 42.264 63.794 45.160 1.00 0.00 C ATOM 8090 H10R OL 252 42.372 64.449 44.299 1.00 0.00 H ATOM 8091 C111 OL 252 42.943 62.440 45.154 1.00 0.00 C ATOM 8092 H11R OL 252 43.238 62.222 46.182 1.00 0.00 H ATOM 8093 H11S OL 252 42.173 61.723 44.860 1.00 0.00 H ATOM 8094 C112 OL 252 44.218 62.345 44.377 1.00 0.00 C ATOM 8095 H12R OL 252 44.167 62.830 43.400 1.00 0.00 H ATOM 8096 H12S OL 252 44.917 62.965 44.944 1.00 0.00 H ATOM 8097 C113 OL 252 44.857 60.994 44.344 1.00 0.00 C ATOM 8098 H13R OL 252 44.047 60.336 44.023 1.00 0.00 H ATOM 8099 H13S OL 252 45.611 60.981 43.554 1.00 0.00 H ATOM 8100 C114 OL 252 45.403 60.389 45.626 1.00 0.00 C ATOM 8101 H14R OL 252 46.130 61.044 46.113 1.00 0.00 H ATOM 8102 H14S OL 252 44.656 60.216 46.403 1.00 0.00 H ATOM 8103 C115 OL 252 45.973 59.044 45.321 1.00 0.00 C ATOM 8104 H15R OL 252 45.251 58.357 44.876 1.00 0.00 H ATOM 8105 H15S OL 252 46.785 59.289 44.634 1.00 0.00 H ATOM 8106 C116 OL 252 46.531 58.453 46.606 1.00 0.00 C ATOM 8107 H16R OL 252 46.033 58.903 47.468 1.00 0.00 H ATOM 8108 H16S OL 252 46.315 57.384 46.650 1.00 0.00 H ATOM 8109 C117 OL 252 47.969 58.760 46.835 1.00 0.00 C ATOM 8110 H17R OL 252 48.221 59.749 46.448 1.00 0.00 H ATOM 8111 H17S OL 252 48.252 58.758 47.890 1.00 0.00 H ATOM 8112 C118 OL 252 49.031 57.754 46.259 1.00 0.00 C ATOM 8113 H18R OL 252 48.920 56.686 46.458 1.00 0.00 H ATOM 8114 H18S OL 252 50.007 57.994 46.685 1.00 0.00 H ATOM 8115 H18T OL 252 49.058 57.887 45.175 1.00 0.00 H TER 8116 OL 252 ATOM 8116 C116 PA 253 32.505 80.161 45.154 1.00 0.00 C ATOM 8117 H16R PA 253 32.579 79.847 44.111 1.00 0.00 H ATOM 8118 H16S PA 253 33.238 79.538 45.670 1.00 0.00 H ATOM 8119 H16T PA 253 32.846 81.179 45.354 1.00 0.00 H ATOM 8120 C115 PA 253 31.211 79.679 45.718 1.00 0.00 C ATOM 8121 H15R PA 253 30.906 78.690 45.368 1.00 0.00 H ATOM 8122 H15S PA 253 30.396 80.333 45.402 1.00 0.00 H ATOM 8123 C114 PA 253 31.145 79.689 47.275 1.00 0.00 C ATOM 8124 H14R PA 253 30.120 79.873 47.603 1.00 0.00 H ATOM 8125 H14S PA 253 31.746 80.552 47.567 1.00 0.00 H ATOM 8126 C113 PA 253 31.611 78.350 47.914 1.00 0.00 C ATOM 8127 H13R PA 253 32.660 78.136 47.698 1.00 0.00 H ATOM 8128 H13S PA 253 31.001 77.507 47.583 1.00 0.00 H ATOM 8129 C112 PA 253 31.498 78.348 49.456 1.00 0.00 C ATOM 8130 H12R PA 253 30.452 78.132 49.683 1.00 0.00 H ATOM 8131 H12S PA 253 31.649 79.362 49.834 1.00 0.00 H ATOM 8132 C111 PA 253 32.417 77.341 50.141 1.00 0.00 C ATOM 8133 H11R PA 253 33.437 77.696 49.981 1.00 0.00 H ATOM 8134 H11S PA 253 32.291 76.359 49.681 1.00 0.00 H ATOM 8135 C110 PA 253 32.160 77.308 51.611 1.00 0.00 C ATOM 8136 H10R PA 253 31.109 77.302 51.906 1.00 0.00 H ATOM 8137 H10S PA 253 32.345 78.347 51.890 1.00 0.00 H ATOM 8138 C19 PA 253 33.102 76.572 52.540 1.00 0.00 C ATOM 8139 H9R PA 253 33.076 76.962 53.560 1.00 0.00 H ATOM 8140 H9S PA 253 34.036 76.930 52.102 1.00 0.00 H ATOM 8141 C18 PA 253 33.052 75.058 52.503 1.00 0.00 C ATOM 8142 H8R PA 253 33.030 74.754 51.454 1.00 0.00 H ATOM 8143 H8S PA 253 32.082 74.867 52.967 1.00 0.00 H ATOM 8144 C17 PA 253 34.137 74.331 53.288 1.00 0.00 C ATOM 8145 H7R PA 253 34.162 74.759 54.293 1.00 0.00 H ATOM 8146 H7S PA 253 35.136 74.584 52.928 1.00 0.00 H ATOM 8147 C16 PA 253 34.030 72.821 53.432 1.00 0.00 C ATOM 8148 H6R PA 253 34.023 72.413 52.419 1.00 0.00 H ATOM 8149 H6S PA 253 33.025 72.674 53.833 1.00 0.00 H ATOM 8150 C15 PA 253 35.125 72.216 54.359 1.00 0.00 C ATOM 8151 H5R PA 253 35.229 72.789 55.282 1.00 0.00 H ATOM 8152 H5S PA 253 36.112 72.300 53.898 1.00 0.00 H ATOM 8153 C14 PA 253 34.723 70.787 54.818 1.00 0.00 C ATOM 8154 H4R PA 253 34.464 70.211 53.927 1.00 0.00 H ATOM 8155 H4S PA 253 33.842 70.982 55.431 1.00 0.00 H ATOM 8156 C13 PA 253 35.794 70.060 55.604 1.00 0.00 C ATOM 8157 H3R PA 253 36.098 70.648 56.472 1.00 0.00 H ATOM 8158 H3S PA 253 36.725 70.015 55.035 1.00 0.00 H ATOM 8159 C12 PA 253 35.431 68.690 56.191 1.00 0.00 C ATOM 8160 H2R PA 253 35.220 68.045 55.335 1.00 0.00 H ATOM 8161 H2S PA 253 34.554 68.757 56.838 1.00 0.00 H ATOM 8162 C11 PGR 254 36.527 68.071 56.996 1.00 0.00 C ATOM 8163 O12 PGR 254 37.490 68.743 57.371 1.00 0.00 O ATOM 8164 O11 PGR 254 36.267 66.798 57.348 1.00 0.00 O ATOM 8165 C1 PGR 254 37.401 66.104 57.899 1.00 0.00 C ATOM 8166 HR PGR 254 37.449 66.454 58.933 1.00 0.00 H ATOM 8167 HS PGR 254 38.314 66.472 57.424 1.00 0.00 H ATOM 8168 C2 PGR 254 37.220 64.489 57.791 1.00 0.00 C ATOM 8169 HX PGR 254 36.151 64.307 57.927 1.00 0.00 H ATOM 8170 C3 PGR 254 37.952 63.824 58.963 1.00 0.00 C ATOM 8171 HA PGR 254 38.147 62.768 58.762 1.00 0.00 H ATOM 8172 HB PGR 254 37.297 63.888 59.836 1.00 0.00 H ATOM 8173 O31 PGR 254 39.177 64.427 59.118 1.00 0.00 O ATOM 8174 P31 PGR 254 40.410 63.801 59.936 1.00 0.00 P ATOM 8175 O32 PGR 254 40.737 62.466 59.151 1.00 0.00 O ATOM 8176 C31 PGR 254 40.645 61.178 59.762 1.00 0.00 C ATOM 8177 H1A PGR 254 39.714 61.030 60.316 1.00 0.00 H ATOM 8178 H1B PGR 254 41.409 61.177 60.543 1.00 0.00 H ATOM 8179 C32 PGR 254 40.881 60.077 58.761 1.00 0.00 C ATOM 8180 H2A PGR 254 41.019 59.085 59.197 1.00 0.00 H ATOM 8181 O35 PGR 254 42.134 60.164 58.012 1.00 0.00 O ATOM 8182 HO5A PGR 254 42.051 59.496 57.308 1.00 0.00 H ATOM 8183 C33 PGR 254 39.599 60.119 57.851 1.00 0.00 C ATOM 8184 H3A PGR 254 38.697 60.144 58.468 1.00 0.00 H ATOM 8185 H3B PGR 254 39.609 60.968 57.163 1.00 0.00 H ATOM 8186 O33 PGR 254 41.641 64.602 59.706 1.00 0.00 O ATOM 8187 O34 PGR 254 39.913 63.406 61.276 1.00 0.00 O ATOM 8188 O21 PGR 254 37.782 64.019 56.551 1.00 0.00 O ATOM 8189 C21 PGR 254 37.665 62.716 56.167 1.00 0.00 C ATOM 8190 O22 PGR 254 37.046 61.917 56.883 1.00 0.00 O ATOM 8191 O36 PGR 254 39.562 58.957 57.136 1.00 0.00 O ATOM 8192 HO6A PGR 254 40.250 59.045 56.452 1.00 0.00 H ATOM 8193 C12 OL 255 38.120 62.488 54.773 1.00 0.00 C ATOM 8194 H2R OL 255 38.101 61.427 54.513 1.00 0.00 H ATOM 8195 H2S OL 255 37.421 63.065 54.165 1.00 0.00 H ATOM 8196 C13 OL 255 39.466 63.091 54.574 1.00 0.00 C ATOM 8197 H3R OL 255 39.384 64.154 54.812 1.00 0.00 H ATOM 8198 H3S OL 255 40.161 62.718 55.328 1.00 0.00 H ATOM 8199 C14 OL 255 39.939 62.838 53.164 1.00 0.00 C ATOM 8200 H4R OL 255 39.941 61.773 52.922 1.00 0.00 H ATOM 8201 H4S OL 255 39.253 63.297 52.449 1.00 0.00 H ATOM 8202 C15 OL 255 41.325 63.334 52.784 1.00 0.00 C ATOM 8203 H5R OL 255 42.083 62.669 53.204 1.00 0.00 H ATOM 8204 H5S OL 255 41.469 63.142 51.719 1.00 0.00 H ATOM 8205 C16 OL 255 41.702 64.767 53.270 1.00 0.00 C ATOM 8206 H6R OL 255 41.689 64.877 54.357 1.00 0.00 H ATOM 8207 H6S OL 255 42.718 64.899 52.891 1.00 0.00 H ATOM 8208 C17 OL 255 40.872 65.898 52.575 1.00 0.00 C ATOM 8209 H7R OL 255 39.817 65.894 52.858 1.00 0.00 H ATOM 8210 H7S OL 255 41.205 66.883 52.910 1.00 0.00 H ATOM 8211 C18 OL 255 40.905 65.810 51.102 1.00 0.00 C ATOM 8212 H8R OL 255 41.732 65.237 50.677 1.00 0.00 H ATOM 8213 H8S OL 255 39.955 65.479 50.678 1.00 0.00 H ATOM 8214 C19 OL 255 41.194 67.189 50.583 1.00 0.00 C ATOM 8215 H9R OL 255 41.993 67.763 51.044 1.00 0.00 H ATOM 8216 C110 OL 255 40.365 67.953 49.788 1.00 0.00 C ATOM 8217 H10R OL 255 40.654 69.000 49.766 1.00 0.00 H ATOM 8218 C111 OL 255 39.053 67.572 49.141 1.00 0.00 C ATOM 8219 H11R OL 255 39.082 67.768 48.067 1.00 0.00 H ATOM 8220 H11S OL 255 39.003 66.485 49.239 1.00 0.00 H ATOM 8221 C112 OL 255 37.842 68.149 49.809 1.00 0.00 C ATOM 8222 H12R OL 255 36.912 67.693 49.462 1.00 0.00 H ATOM 8223 H12S OL 255 37.866 67.851 50.860 1.00 0.00 H ATOM 8224 C113 OL 255 37.705 69.658 49.652 1.00 0.00 C ATOM 8225 H13R OL 255 38.611 70.123 50.046 1.00 0.00 H ATOM 8226 H13S OL 255 37.737 69.966 48.605 1.00 0.00 H ATOM 8227 C114 OL 255 36.449 70.165 50.353 1.00 0.00 C ATOM 8228 H14R OL 255 35.589 69.673 49.894 1.00 0.00 H ATOM 8229 H14S OL 255 36.526 69.640 51.308 1.00 0.00 H ATOM 8230 C115 OL 255 36.242 71.729 50.588 1.00 0.00 C ATOM 8231 H15R OL 255 36.108 71.968 51.645 1.00 0.00 H ATOM 8232 H15S OL 255 37.261 72.063 50.383 1.00 0.00 H ATOM 8233 C116 OL 255 35.159 72.323 49.660 1.00 0.00 C ATOM 8234 H16R OL 255 35.249 71.729 48.748 1.00 0.00 H ATOM 8235 H16S OL 255 34.184 72.065 50.080 1.00 0.00 H ATOM 8236 C117 OL 255 35.343 73.835 49.301 1.00 0.00 C ATOM 8237 H17R OL 255 35.192 74.379 50.236 1.00 0.00 H ATOM 8238 H17S OL 255 36.351 74.153 49.026 1.00 0.00 H ATOM 8239 C118 OL 255 34.369 74.363 48.271 1.00 0.00 C ATOM 8240 H18R OL 255 34.376 75.433 48.055 1.00 0.00 H ATOM 8241 H18S OL 255 33.360 74.117 48.607 1.00 0.00 H ATOM 8242 H18T OL 255 34.583 73.894 47.308 1.00 0.00 H TER 8243 OL 255 ATOM 8243 C116 PA 256 57.610 57.645 42.229 1.00 0.00 C ATOM 8244 H16R PA 256 57.114 58.462 41.701 1.00 0.00 H ATOM 8245 H16S PA 256 56.842 56.913 42.488 1.00 0.00 H ATOM 8246 H16T PA 256 58.251 57.289 41.420 1.00 0.00 H ATOM 8247 C115 PA 256 58.498 57.978 43.425 1.00 0.00 C ATOM 8248 H15R PA 256 59.264 58.688 43.106 1.00 0.00 H ATOM 8249 H15S PA 256 58.990 57.072 43.786 1.00 0.00 H ATOM 8250 C114 PA 256 57.763 58.725 44.553 1.00 0.00 C ATOM 8251 H14R PA 256 56.882 58.225 44.961 1.00 0.00 H ATOM 8252 H14S PA 256 57.453 59.737 44.287 1.00 0.00 H ATOM 8253 C113 PA 256 58.601 58.878 45.864 1.00 0.00 C ATOM 8254 H13R PA 256 59.615 59.271 45.768 1.00 0.00 H ATOM 8255 H13S PA 256 58.713 57.851 46.218 1.00 0.00 H ATOM 8256 C112 PA 256 57.833 59.666 46.942 1.00 0.00 C ATOM 8257 H12R PA 256 56.898 59.120 47.087 1.00 0.00 H ATOM 8258 H12S PA 256 57.578 60.649 46.542 1.00 0.00 H ATOM 8259 C111 PA 256 58.569 59.775 48.287 1.00 0.00 C ATOM 8260 H11R PA 256 59.590 60.148 48.182 1.00 0.00 H ATOM 8261 H11S PA 256 58.859 58.826 48.743 1.00 0.00 H ATOM 8262 C110 PA 256 57.743 60.544 49.377 1.00 0.00 C ATOM 8263 H10R PA 256 56.882 59.901 49.571 1.00 0.00 H ATOM 8264 H10S PA 256 57.441 61.497 48.937 1.00 0.00 H ATOM 8265 C19 PA 256 58.481 60.698 50.702 1.00 0.00 C ATOM 8266 H9R PA 256 59.246 61.475 50.640 1.00 0.00 H ATOM 8267 H9S PA 256 59.046 59.783 50.889 1.00 0.00 H ATOM 8268 C18 PA 256 57.668 61.060 51.980 1.00 0.00 C ATOM 8269 H8R PA 256 56.621 61.161 51.686 1.00 0.00 H ATOM 8270 H8S PA 256 57.940 62.110 52.110 1.00 0.00 H ATOM 8271 C17 PA 256 58.083 60.243 53.245 1.00 0.00 C ATOM 8272 H7R PA 256 57.988 60.827 54.163 1.00 0.00 H ATOM 8273 H7S PA 256 59.144 59.991 53.303 1.00 0.00 H ATOM 8274 C16 PA 256 57.312 59.007 53.543 1.00 0.00 C ATOM 8275 H6R PA 256 56.235 59.178 53.492 1.00 0.00 H ATOM 8276 H6S PA 256 57.696 58.753 54.533 1.00 0.00 H ATOM 8277 C15 PA 256 57.597 57.826 52.504 1.00 0.00 C ATOM 8278 H5R PA 256 58.564 57.879 52.000 1.00 0.00 H ATOM 8279 H5S PA 256 56.926 57.968 51.655 1.00 0.00 H ATOM 8280 C14 PA 256 57.206 56.501 53.096 1.00 0.00 C ATOM 8281 H4R PA 256 57.953 56.106 53.788 1.00 0.00 H ATOM 8282 H4S PA 256 57.023 55.803 52.277 1.00 0.00 H ATOM 8283 C13 PA 256 55.889 56.557 53.839 1.00 0.00 C ATOM 8284 H3R PA 256 55.285 57.317 53.339 1.00 0.00 H ATOM 8285 H3S PA 256 55.992 57.088 54.788 1.00 0.00 H ATOM 8286 C12 PA 256 55.139 55.250 54.089 1.00 0.00 C ATOM 8287 H2R PA 256 55.792 54.768 54.820 1.00 0.00 H ATOM 8288 H2S PA 256 55.206 54.525 53.276 1.00 0.00 H ATOM 8289 C11 PGR 257 53.823 55.467 54.804 1.00 0.00 C ATOM 8290 O12 PGR 257 52.760 55.539 54.254 1.00 0.00 O ATOM 8291 O11 PGR 257 54.038 55.480 56.159 1.00 0.00 O ATOM 8292 C1 PGR 257 52.997 55.765 57.043 1.00 0.00 C ATOM 8293 HR PGR 257 53.193 55.339 58.030 1.00 0.00 H ATOM 8294 HS PGR 257 52.021 55.429 56.682 1.00 0.00 H ATOM 8295 C2 PGR 257 52.852 57.258 57.306 1.00 0.00 C ATOM 8296 HX PGR 257 53.811 57.711 57.572 1.00 0.00 H ATOM 8297 C3 PGR 257 51.948 57.591 58.512 1.00 0.00 C ATOM 8298 HA PGR 257 52.101 58.654 58.714 1.00 0.00 H ATOM 8299 HB PGR 257 52.312 56.982 59.344 1.00 0.00 H ATOM 8300 O31 PGR 257 50.595 57.211 58.208 1.00 0.00 O ATOM 8301 P31 PGR 257 49.467 57.692 59.177 1.00 0.00 P ATOM 8302 O32 PGR 257 49.319 59.229 58.801 1.00 0.00 O ATOM 8303 C31 PGR 257 49.158 59.550 57.452 1.00 0.00 C ATOM 8304 H1A PGR 257 48.283 59.039 57.042 1.00 0.00 H ATOM 8305 H1B PGR 257 50.012 59.190 56.873 1.00 0.00 H ATOM 8306 C32 PGR 257 49.050 61.069 57.246 1.00 0.00 C ATOM 8307 H2A PGR 257 49.950 61.477 57.713 1.00 0.00 H ATOM 8308 O35 PGR 257 47.931 61.457 58.062 1.00 0.00 O ATOM 8309 HO5A PGR 257 48.243 61.279 58.967 1.00 0.00 H ATOM 8310 C33 PGR 257 48.929 61.454 55.797 1.00 0.00 C ATOM 8311 H3A PGR 257 48.629 62.494 55.645 1.00 0.00 H ATOM 8312 H3B PGR 257 49.880 61.260 55.296 1.00 0.00 H ATOM 8313 O33 PGR 257 48.246 57.063 58.789 1.00 0.00 O ATOM 8314 O34 PGR 257 49.970 57.450 60.557 1.00 0.00 O ATOM 8315 O21 PGR 257 52.158 57.872 56.180 1.00 0.00 O ATOM 8316 C21 PGR 257 52.920 58.432 55.247 1.00 0.00 C ATOM 8317 O22 PGR 257 54.119 58.662 55.321 1.00 0.00 O ATOM 8318 O36 PGR 257 47.957 60.573 55.106 1.00 0.00 O ATOM 8319 HO6A PGR 257 47.801 60.838 54.182 1.00 0.00 H ATOM 8320 C12 OL 258 52.075 58.886 54.090 1.00 0.00 C ATOM 8321 H2R OL 258 51.203 58.236 54.187 1.00 0.00 H ATOM 8322 H2S OL 258 51.668 59.884 54.265 1.00 0.00 H ATOM 8323 C13 OL 258 52.675 58.761 52.733 1.00 0.00 C ATOM 8324 H3R OL 258 53.493 59.480 52.807 1.00 0.00 H ATOM 8325 H3S OL 258 52.971 57.718 52.602 1.00 0.00 H ATOM 8326 C14 OL 258 51.713 59.306 51.571 1.00 0.00 C ATOM 8327 H4R OL 258 51.652 58.496 50.841 1.00 0.00 H ATOM 8328 H4S OL 258 50.712 59.212 51.996 1.00 0.00 H ATOM 8329 C15 OL 258 52.214 60.531 50.930 1.00 0.00 C ATOM 8330 H5R OL 258 52.570 61.124 51.774 1.00 0.00 H ATOM 8331 H5S OL 258 53.065 60.317 50.279 1.00 0.00 H ATOM 8332 C16 OL 258 51.246 61.404 50.196 1.00 0.00 C ATOM 8333 H6R OL 258 50.658 61.739 51.054 1.00 0.00 H ATOM 8334 H6S OL 258 51.775 62.332 49.967 1.00 0.00 H ATOM 8335 C17 OL 258 50.194 60.837 49.176 1.00 0.00 C ATOM 8336 H7R OL 258 50.895 60.422 48.449 1.00 0.00 H ATOM 8337 H7S OL 258 49.527 60.057 49.549 1.00 0.00 H ATOM 8338 C18 OL 258 49.390 61.911 48.549 1.00 0.00 C ATOM 8339 H8R OL 258 50.071 62.721 48.277 1.00 0.00 H ATOM 8340 H8S OL 258 48.926 61.558 47.626 1.00 0.00 H ATOM 8341 C19 OL 258 48.405 62.509 49.440 1.00 0.00 C ATOM 8342 H9R OL 258 47.789 61.811 50.001 1.00 0.00 H ATOM 8343 C110 OL 258 48.222 63.783 49.696 1.00 0.00 C ATOM 8344 H10R OL 258 47.531 63.917 50.525 1.00 0.00 H ATOM 8345 C111 OL 258 48.818 65.005 49.120 1.00 0.00 C ATOM 8346 H11R OL 258 49.537 64.782 48.329 1.00 0.00 H ATOM 8347 H11S OL 258 48.044 65.515 48.542 1.00 0.00 H ATOM 8348 C112 OL 258 49.384 65.874 50.233 1.00 0.00 C ATOM 8349 H12R OL 258 50.298 65.435 50.638 1.00 0.00 H ATOM 8350 H12S OL 258 49.722 66.838 49.847 1.00 0.00 H ATOM 8351 C113 OL 258 48.332 66.237 51.417 1.00 0.00 C ATOM 8352 H13R OL 258 47.448 66.464 50.818 1.00 0.00 H ATOM 8353 H13S OL 258 47.980 65.383 51.999 1.00 0.00 H ATOM 8354 C114 OL 258 48.753 67.499 52.150 1.00 0.00 C ATOM 8355 H14R OL 258 49.605 67.111 52.713 1.00 0.00 H ATOM 8356 H14S OL 258 49.041 68.223 51.384 1.00 0.00 H ATOM 8357 C115 OL 258 47.833 68.226 53.194 1.00 0.00 C ATOM 8358 H15R OL 258 47.819 67.685 54.142 1.00 0.00 H ATOM 8359 H15S OL 258 48.176 69.220 53.488 1.00 0.00 H ATOM 8360 C116 OL 258 46.406 68.499 52.782 1.00 0.00 C ATOM 8361 H16R OL 258 46.058 67.463 52.793 1.00 0.00 H ATOM 8362 H16S OL 258 45.930 68.995 53.630 1.00 0.00 H ATOM 8363 C117 OL 258 46.131 69.263 51.459 1.00 0.00 C ATOM 8364 H17R OL 258 46.814 70.114 51.427 1.00 0.00 H ATOM 8365 H17S OL 258 46.330 68.675 50.560 1.00 0.00 H ATOM 8366 C118 OL 258 44.666 69.758 51.432 1.00 0.00 C ATOM 8367 H18R OL 258 44.499 70.039 50.391 1.00 0.00 H ATOM 8368 H18S OL 258 44.524 70.619 52.089 1.00 0.00 H ATOM 8369 H18T OL 258 43.911 68.996 51.638 1.00 0.00 H TER 8370 OL 258 ATOM 8370 C116 PA 259 112.340 120.341 41.403 1.00 0.00 C ATOM 8371 H16R PA 259 112.486 121.083 40.615 1.00 0.00 H ATOM 8372 H16S PA 259 111.293 120.046 41.502 1.00 0.00 H ATOM 8373 H16T PA 259 112.869 119.422 41.146 1.00 0.00 H ATOM 8374 C115 PA 259 112.799 120.835 42.719 1.00 0.00 C ATOM 8375 H15R PA 259 113.799 121.273 42.697 1.00 0.00 H ATOM 8376 H15S PA 259 112.638 120.037 43.446 1.00 0.00 H ATOM 8377 C114 PA 259 111.904 121.948 43.153 1.00 0.00 C ATOM 8378 H14R PA 259 111.896 122.826 42.503 1.00 0.00 H ATOM 8379 H14S PA 259 112.484 122.310 44.004 1.00 0.00 H ATOM 8380 C113 PA 259 110.455 121.509 43.481 1.00 0.00 C ATOM 8381 H13R PA 259 110.444 120.713 44.229 1.00 0.00 H ATOM 8382 H13S PA 259 109.950 121.158 42.579 1.00 0.00 H ATOM 8383 C112 PA 259 109.612 122.616 44.074 1.00 0.00 C ATOM 8384 H12R PA 259 108.656 122.146 44.311 1.00 0.00 H ATOM 8385 H12S PA 259 109.298 123.303 43.285 1.00 0.00 H ATOM 8386 C111 PA 259 110.164 123.229 45.355 1.00 0.00 C ATOM 8387 H11R PA 259 111.029 123.849 45.108 1.00 0.00 H ATOM 8388 H11S PA 259 110.508 122.488 46.079 1.00 0.00 H ATOM 8389 C110 PA 259 109.149 124.143 46.026 1.00 0.00 C ATOM 8390 H10R PA 259 108.485 124.625 45.306 1.00 0.00 H ATOM 8391 H10S PA 259 109.627 125.050 46.403 1.00 0.00 H ATOM 8392 C19 PA 259 108.447 123.410 47.180 1.00 0.00 C ATOM 8393 H9R PA 259 109.107 122.867 47.860 1.00 0.00 H ATOM 8394 H9S PA 259 108.034 122.554 46.643 1.00 0.00 H ATOM 8395 C18 PA 259 107.515 124.124 48.179 1.00 0.00 C ATOM 8396 H8R PA 259 106.634 124.498 47.653 1.00 0.00 H ATOM 8397 H8S PA 259 107.983 124.971 48.685 1.00 0.00 H ATOM 8398 C17 PA 259 106.908 123.180 49.274 1.00 0.00 C ATOM 8399 H7R PA 259 107.582 122.469 49.755 1.00 0.00 H ATOM 8400 H7S PA 259 106.266 122.465 48.756 1.00 0.00 H ATOM 8401 C16 PA 259 106.072 123.825 50.394 1.00 0.00 C ATOM 8402 H6R PA 259 105.352 124.557 50.020 1.00 0.00 H ATOM 8403 H6S PA 259 106.809 124.331 51.021 1.00 0.00 H ATOM 8404 C15 PA 259 105.447 122.802 51.301 1.00 0.00 C ATOM 8405 H5R PA 259 106.262 122.158 51.637 1.00 0.00 H ATOM 8406 H5S PA 259 104.837 122.172 50.651 1.00 0.00 H ATOM 8407 C14 PA 259 104.544 123.502 52.333 1.00 0.00 C ATOM 8408 H4R PA 259 103.816 124.188 51.896 1.00 0.00 H ATOM 8409 H4S PA 259 105.241 124.195 52.810 1.00 0.00 H ATOM 8410 C13 PA 259 103.965 122.596 53.415 1.00 0.00 C ATOM 8411 H3R PA 259 104.447 121.631 53.586 1.00 0.00 H ATOM 8412 H3S PA 259 103.063 122.206 52.939 1.00 0.00 H ATOM 8413 C12 PA 259 103.847 123.209 54.838 1.00 0.00 C ATOM 8414 H2R PA 259 104.825 123.664 55.008 1.00 0.00 H ATOM 8415 H2S PA 259 103.152 124.051 54.852 1.00 0.00 H ATOM 8416 C11 PC 260 103.509 122.160 55.856 1.00 0.00 C ATOM 8417 O12 PC 260 102.309 121.857 56.070 1.00 0.00 O ATOM 8418 O11 PC 260 104.609 121.720 56.471 1.00 0.00 O ATOM 8419 C1 PC 260 104.569 120.696 57.520 1.00 0.00 C ATOM 8420 HR PC 260 104.076 121.088 58.413 1.00 0.00 H ATOM 8421 HS PC 260 105.613 120.490 57.772 1.00 0.00 H ATOM 8422 C2 PC 260 103.822 119.423 57.003 1.00 0.00 C ATOM 8423 HX PC 260 103.025 119.788 56.350 1.00 0.00 H ATOM 8424 C3 PC 260 103.237 118.629 58.190 1.00 0.00 C ATOM 8425 HA PC 260 102.914 117.618 57.929 1.00 0.00 H ATOM 8426 HB PC 260 102.334 119.159 58.504 1.00 0.00 H ATOM 8427 O31 PC 260 104.059 118.567 59.333 1.00 0.00 O ATOM 8428 P31 PC 260 103.688 117.728 60.592 1.00 0.00 P ATOM 8429 O32 PC 260 104.732 118.329 61.650 1.00 0.00 O ATOM 8430 C31 PC 260 106.147 118.210 61.425 1.00 0.00 C ATOM 8431 H1A PC 260 106.444 118.688 60.487 1.00 0.00 H ATOM 8432 H1B PC 260 106.388 117.147 61.349 1.00 0.00 H ATOM 8433 C32 PC 260 106.824 118.859 62.617 1.00 0.00 C ATOM 8434 H2A PC 260 107.897 118.684 62.718 1.00 0.00 H ATOM 8435 H2B PC 260 106.328 118.508 63.523 1.00 0.00 H ATOM 8436 N31 PC 260 106.740 120.322 62.700 1.00 0.00 N ATOM 8437 C33 PC 260 105.439 120.757 63.191 1.00 0.00 C ATOM 8438 H3A PC 260 105.451 121.838 63.043 1.00 0.00 H ATOM 8439 H3B PC 260 105.298 120.513 64.245 1.00 0.00 H ATOM 8440 H3C PC 260 104.648 120.345 62.563 1.00 0.00 H ATOM 8441 C34 PC 260 107.844 120.817 63.592 1.00 0.00 C ATOM 8442 H4A PC 260 107.761 121.898 63.469 1.00 0.00 H ATOM 8443 H4B PC 260 108.823 120.587 63.170 1.00 0.00 H ATOM 8444 H4C PC 260 107.701 120.384 64.584 1.00 0.00 H ATOM 8445 C35 PC 260 106.967 120.943 61.415 1.00 0.00 C ATOM 8446 H5A PC 260 106.118 120.770 60.752 1.00 0.00 H ATOM 8447 H5B PC 260 107.950 120.511 61.220 1.00 0.00 H ATOM 8448 H5C PC 260 107.233 121.990 61.567 1.00 0.00 H ATOM 8449 O33 PC 260 102.327 118.144 60.993 1.00 0.00 O ATOM 8450 O34 PC 260 104.026 116.322 60.345 1.00 0.00 O ATOM 8451 O21 PC 260 104.676 118.568 56.259 1.00 0.00 O ATOM 8452 C21 PC 260 104.255 117.807 55.278 1.00 0.00 C ATOM 8453 O22 PC 260 103.106 117.809 54.901 1.00 0.00 O ATOM 8454 C12 OL 261 105.431 117.099 54.650 1.00 0.00 C ATOM 8455 H2R OL 261 105.876 116.437 55.396 1.00 0.00 H ATOM 8456 H2S OL 261 104.987 116.438 53.903 1.00 0.00 H ATOM 8457 C13 OL 261 106.444 118.050 53.999 1.00 0.00 C ATOM 8458 H3R OL 261 106.842 118.779 54.708 1.00 0.00 H ATOM 8459 H3S OL 261 107.344 117.530 53.664 1.00 0.00 H ATOM 8460 C14 OL 261 105.920 118.893 52.900 1.00 0.00 C ATOM 8461 H4R OL 261 105.029 119.423 53.245 1.00 0.00 H ATOM 8462 H4S OL 261 106.787 119.472 52.578 1.00 0.00 H ATOM 8463 C15 OL 261 105.449 118.215 51.587 1.00 0.00 C ATOM 8464 H5R OL 261 106.261 117.643 51.134 1.00 0.00 H ATOM 8465 H5S OL 261 104.714 117.446 51.836 1.00 0.00 H ATOM 8466 C16 OL 261 104.902 119.101 50.478 1.00 0.00 C ATOM 8467 H6R OL 261 104.020 119.645 50.821 1.00 0.00 H ATOM 8468 H6S OL 261 105.681 119.817 50.208 1.00 0.00 H ATOM 8469 C17 OL 261 104.413 118.300 49.299 1.00 0.00 C ATOM 8470 H7R OL 261 105.222 117.966 48.646 1.00 0.00 H ATOM 8471 H7S OL 261 104.048 117.331 49.646 1.00 0.00 H ATOM 8472 C18 OL 261 103.422 119.012 48.328 1.00 0.00 C ATOM 8473 H8R OL 261 103.120 118.319 47.540 1.00 0.00 H ATOM 8474 H8S OL 261 102.493 119.196 48.872 1.00 0.00 H ATOM 8475 C19 OL 261 104.172 120.169 47.807 1.00 0.00 C ATOM 8476 H9R OL 261 104.485 120.887 48.560 1.00 0.00 H ATOM 8477 C110 OL 261 104.319 120.391 46.465 1.00 0.00 C ATOM 8478 H10R OL 261 104.725 121.338 46.120 1.00 0.00 H ATOM 8479 C111 OL 261 103.967 119.547 45.340 1.00 0.00 C ATOM 8480 H11R OL 261 104.897 119.341 44.806 1.00 0.00 H ATOM 8481 H11S OL 261 103.622 118.553 45.633 1.00 0.00 H ATOM 8482 C112 OL 261 102.889 120.071 44.430 1.00 0.00 C ATOM 8483 H12R OL 261 102.024 120.233 45.076 1.00 0.00 H ATOM 8484 H12S OL 261 103.274 121.006 44.018 1.00 0.00 H ATOM 8485 C113 OL 261 102.457 119.048 43.314 1.00 0.00 C ATOM 8486 H13R OL 261 103.357 118.823 42.737 1.00 0.00 H ATOM 8487 H13S OL 261 102.045 118.100 43.668 1.00 0.00 H ATOM 8488 C114 OL 261 101.320 119.552 42.349 1.00 0.00 C ATOM 8489 H14R OL 261 101.259 118.739 41.622 1.00 0.00 H ATOM 8490 H14S OL 261 100.363 119.442 42.864 1.00 0.00 H ATOM 8491 C115 OL 261 101.554 120.942 41.713 1.00 0.00 C ATOM 8492 H15R OL 261 101.194 121.786 42.306 1.00 0.00 H ATOM 8493 H15S OL 261 102.608 121.028 41.440 1.00 0.00 H ATOM 8494 C116 OL 261 100.805 121.070 40.406 1.00 0.00 C ATOM 8495 H16R OL 261 101.000 122.139 40.300 1.00 0.00 H ATOM 8496 H16S OL 261 101.322 120.559 39.591 1.00 0.00 H ATOM 8497 C117 OL 261 99.375 120.703 40.346 1.00 0.00 C ATOM 8498 H17R OL 261 99.053 120.863 39.315 1.00 0.00 H ATOM 8499 H17S OL 261 99.214 119.645 40.564 1.00 0.00 H ATOM 8500 C118 OL 261 98.509 121.543 41.230 1.00 0.00 C ATOM 8501 H18R OL 261 97.581 120.973 41.301 1.00 0.00 H ATOM 8502 H18S OL 261 98.411 122.495 40.703 1.00 0.00 H ATOM 8503 H18T OL 261 98.870 121.839 42.217 1.00 0.00 H TER 8504 OL 261 ATOM 8504 C116 PA 262 127.086 46.338 43.176 1.00 0.00 C ATOM 8505 H16R PA 262 126.692 45.838 42.288 1.00 0.00 H ATOM 8506 H16S PA 262 128.030 45.878 43.474 1.00 0.00 H ATOM 8507 H16T PA 262 127.212 47.388 42.906 1.00 0.00 H ATOM 8508 C115 PA 262 126.055 46.084 44.353 1.00 0.00 C ATOM 8509 H15R PA 262 126.204 46.810 45.156 1.00 0.00 H ATOM 8510 H15S PA 262 126.262 45.063 44.680 1.00 0.00 H ATOM 8511 C114 PA 262 124.629 46.301 43.910 1.00 0.00 C ATOM 8512 H14R PA 262 124.364 45.592 43.124 1.00 0.00 H ATOM 8513 H14S PA 262 124.454 47.321 43.560 1.00 0.00 H ATOM 8514 C113 PA 262 123.615 46.162 45.022 1.00 0.00 C ATOM 8515 H13R PA 262 122.595 46.341 44.674 1.00 0.00 H ATOM 8516 H13S PA 262 123.867 46.948 45.737 1.00 0.00 H ATOM 8517 C112 PA 262 123.440 44.783 45.659 1.00 0.00 C ATOM 8518 H12R PA 262 124.322 44.502 46.239 1.00 0.00 H ATOM 8519 H12S PA 262 123.369 43.959 44.945 1.00 0.00 H ATOM 8520 C111 PA 262 122.214 44.656 46.486 1.00 0.00 C ATOM 8521 H11R PA 262 122.135 43.680 46.968 1.00 0.00 H ATOM 8522 H11S PA 262 121.328 44.855 45.881 1.00 0.00 H ATOM 8523 C110 PA 262 122.209 45.666 47.601 1.00 0.00 C ATOM 8524 H10R PA 262 121.706 46.619 47.424 1.00 0.00 H ATOM 8525 H10S PA 262 123.236 46.025 47.703 1.00 0.00 H ATOM 8526 C19 PA 262 121.620 45.092 48.828 1.00 0.00 C ATOM 8527 H9R PA 262 122.116 44.171 49.141 1.00 0.00 H ATOM 8528 H9S PA 262 120.613 44.739 48.594 1.00 0.00 H ATOM 8529 C18 PA 262 121.580 46.139 49.965 1.00 0.00 C ATOM 8530 H8R PA 262 121.233 47.110 49.606 1.00 0.00 H ATOM 8531 H8S PA 262 122.600 46.288 50.324 1.00 0.00 H ATOM 8532 C17 PA 262 120.825 45.686 51.187 1.00 0.00 C ATOM 8533 H7R PA 262 121.627 45.164 51.715 1.00 0.00 H ATOM 8534 H7S PA 262 120.116 44.931 50.840 1.00 0.00 H ATOM 8535 C16 PA 262 120.093 46.804 52.003 1.00 0.00 C ATOM 8536 H6R PA 262 119.910 46.426 53.011 1.00 0.00 H ATOM 8537 H6S PA 262 119.102 47.025 51.602 1.00 0.00 H ATOM 8538 C15 PA 262 120.926 48.077 52.222 1.00 0.00 C ATOM 8539 H5R PA 262 121.146 48.518 51.247 1.00 0.00 H ATOM 8540 H5S PA 262 121.895 47.728 52.585 1.00 0.00 H ATOM 8541 C14 PA 262 120.235 49.122 53.027 1.00 0.00 C ATOM 8542 H4R PA 262 120.021 48.731 54.024 1.00 0.00 H ATOM 8543 H4S PA 262 119.283 49.447 52.603 1.00 0.00 H ATOM 8544 C13 PA 262 121.131 50.328 53.362 1.00 0.00 C ATOM 8545 H3R PA 262 120.408 50.963 53.878 1.00 0.00 H ATOM 8546 H3S PA 262 121.340 50.838 52.419 1.00 0.00 H ATOM 8547 C12 PA 262 122.362 50.011 54.245 1.00 0.00 C ATOM 8548 H2R PA 262 123.084 49.438 53.658 1.00 0.00 H ATOM 8549 H2S PA 262 122.078 49.498 55.167 1.00 0.00 H ATOM 8550 C11 PC 263 123.111 51.234 54.768 1.00 0.00 C ATOM 8551 O12 PC 263 123.296 52.150 54.013 1.00 0.00 O ATOM 8552 O11 PC 263 123.606 51.115 56.030 1.00 0.00 O ATOM 8553 C1 PC 263 124.336 52.222 56.615 1.00 0.00 C ATOM 8554 HR PC 263 124.978 52.788 55.935 1.00 0.00 H ATOM 8555 HS PC 263 125.124 51.746 57.204 1.00 0.00 H ATOM 8556 C2 PC 263 123.377 53.086 57.522 1.00 0.00 C ATOM 8557 HX PC 263 123.955 53.975 57.786 1.00 0.00 H ATOM 8558 C3 PC 263 122.929 52.242 58.737 1.00 0.00 C ATOM 8559 HA PC 263 123.812 51.629 58.935 1.00 0.00 H ATOM 8560 HB PC 263 122.111 51.601 58.398 1.00 0.00 H ATOM 8561 O31 PC 263 122.545 52.922 59.962 1.00 0.00 O ATOM 8562 P31 PC 263 123.564 53.614 61.018 1.00 0.00 P ATOM 8563 O32 PC 263 123.727 52.536 62.125 1.00 0.00 O ATOM 8564 C31 PC 263 122.716 52.332 63.106 1.00 0.00 C ATOM 8565 H1A PC 263 121.722 52.039 62.758 1.00 0.00 H ATOM 8566 H1B PC 263 122.508 53.269 63.627 1.00 0.00 H ATOM 8567 C32 PC 263 123.279 51.132 63.982 1.00 0.00 C ATOM 8568 H2A PC 263 122.556 50.317 63.939 1.00 0.00 H ATOM 8569 H2B PC 263 123.297 51.457 65.023 1.00 0.00 H ATOM 8570 N31 PC 263 124.650 50.575 63.787 1.00 0.00 N ATOM 8571 C33 PC 263 124.818 49.946 62.487 1.00 0.00 C ATOM 8572 H3A PC 263 124.206 49.045 62.559 1.00 0.00 H ATOM 8573 H3B PC 263 125.876 49.706 62.375 1.00 0.00 H ATOM 8574 H3C PC 263 124.516 50.581 61.652 1.00 0.00 H ATOM 8575 C34 PC 263 125.541 51.740 64.032 1.00 0.00 C ATOM 8576 H4A PC 263 125.315 52.321 64.928 1.00 0.00 H ATOM 8577 H4B PC 263 125.464 52.425 63.187 1.00 0.00 H ATOM 8578 H4C PC 263 126.569 51.378 64.075 1.00 0.00 H ATOM 8579 C35 PC 263 124.915 49.510 64.790 1.00 0.00 C ATOM 8580 H5A PC 263 124.168 48.738 64.601 1.00 0.00 H ATOM 8581 H5B PC 263 124.854 49.966 65.779 1.00 0.00 H ATOM 8582 H5C PC 263 125.891 49.040 64.666 1.00 0.00 H ATOM 8583 O33 PC 263 124.926 53.793 60.446 1.00 0.00 O ATOM 8584 O34 PC 263 122.874 54.810 61.512 1.00 0.00 O ATOM 8585 O21 PC 263 122.240 53.437 56.709 1.00 0.00 O ATOM 8586 C21 PC 263 122.394 54.552 55.974 1.00 0.00 C ATOM 8587 O22 PC 263 123.319 55.346 56.099 1.00 0.00 O ATOM 8588 C12 OL 264 121.295 54.741 55.034 1.00 0.00 C ATOM 8589 H2R OL 264 120.815 53.811 54.721 1.00 0.00 H ATOM 8590 H2S OL 264 120.468 55.135 55.628 1.00 0.00 H ATOM 8591 C13 OL 264 121.654 55.590 53.811 1.00 0.00 C ATOM 8592 H3R OL 264 120.717 55.822 53.301 1.00 0.00 H ATOM 8593 H3S OL 264 122.083 56.529 54.166 1.00 0.00 H ATOM 8594 C14 OL 264 122.745 55.076 52.803 1.00 0.00 C ATOM 8595 H4R OL 264 123.594 54.698 53.376 1.00 0.00 H ATOM 8596 H4S OL 264 122.324 54.161 52.380 1.00 0.00 H ATOM 8597 C15 OL 264 123.040 56.006 51.728 1.00 0.00 C ATOM 8598 H5R OL 264 122.163 56.420 51.227 1.00 0.00 H ATOM 8599 H5S OL 264 123.570 56.898 52.070 1.00 0.00 H ATOM 8600 C16 OL 264 123.918 55.398 50.662 1.00 0.00 C ATOM 8601 H6R OL 264 124.196 56.228 50.010 1.00 0.00 H ATOM 8602 H6S OL 264 124.867 55.197 51.165 1.00 0.00 H ATOM 8603 C17 OL 264 123.219 54.295 49.800 1.00 0.00 C ATOM 8604 H7R OL 264 122.865 53.484 50.439 1.00 0.00 H ATOM 8605 H7S OL 264 122.393 54.803 49.298 1.00 0.00 H ATOM 8606 C18 OL 264 124.226 53.828 48.698 1.00 0.00 C ATOM 8607 H8R OL 264 123.616 53.506 47.851 1.00 0.00 H ATOM 8608 H8S OL 264 124.772 54.619 48.180 1.00 0.00 H ATOM 8609 C19 OL 264 125.286 52.815 49.063 1.00 0.00 C ATOM 8610 H9R OL 264 124.997 51.773 49.174 1.00 0.00 H ATOM 8611 C110 OL 264 126.564 53.086 49.315 1.00 0.00 C ATOM 8612 H10R OL 264 127.206 52.270 49.638 1.00 0.00 H ATOM 8613 C111 OL 264 127.162 54.445 49.179 1.00 0.00 C ATOM 8614 H11R OL 264 126.427 55.158 48.801 1.00 0.00 H ATOM 8615 H11S OL 264 127.362 54.763 50.205 1.00 0.00 H ATOM 8616 C112 OL 264 128.555 54.642 48.523 1.00 0.00 C ATOM 8617 H12R OL 264 128.700 55.723 48.560 1.00 0.00 H ATOM 8618 H12S OL 264 129.337 54.153 49.108 1.00 0.00 H ATOM 8619 C113 OL 264 128.477 54.097 47.037 1.00 0.00 C ATOM 8620 H13R OL 264 128.619 53.032 46.839 1.00 0.00 H ATOM 8621 H13S OL 264 127.503 54.160 46.548 1.00 0.00 H ATOM 8622 C114 OL 264 129.516 54.728 46.081 1.00 0.00 C ATOM 8623 H14R OL 264 129.343 54.256 45.112 1.00 0.00 H ATOM 8624 H14S OL 264 129.428 55.805 45.921 1.00 0.00 H ATOM 8625 C115 OL 264 130.958 54.471 46.505 1.00 0.00 C ATOM 8626 H15R OL 264 131.119 55.025 47.433 1.00 0.00 H ATOM 8627 H15S OL 264 131.003 53.418 46.792 1.00 0.00 H ATOM 8628 C116 OL 264 132.066 54.621 45.496 1.00 0.00 C ATOM 8629 H16R OL 264 131.997 55.627 45.075 1.00 0.00 H ATOM 8630 H16S OL 264 133.076 54.560 45.905 1.00 0.00 H ATOM 8631 C117 OL 264 132.082 53.560 44.325 1.00 0.00 C ATOM 8632 H17R OL 264 132.415 52.612 44.754 1.00 0.00 H ATOM 8633 H17S OL 264 131.095 53.304 43.933 1.00 0.00 H ATOM 8634 C118 OL 264 133.070 53.812 43.225 1.00 0.00 C ATOM 8635 H18R OL 264 133.907 54.346 43.679 1.00 0.00 H ATOM 8636 H18S OL 264 132.564 54.525 42.570 1.00 0.00 H ATOM 8637 H18T OL 264 133.440 52.918 42.720 1.00 0.00 H TER 8638 OL 264 ATOM 8638 C116 PA 265 118.379 65.250 46.859 1.00 0.00 C ATOM 8639 H16R PA 265 118.167 66.282 47.146 1.00 0.00 H ATOM 8640 H16S PA 265 118.073 65.192 45.812 1.00 0.00 H ATOM 8641 H16T PA 265 119.461 65.133 46.942 1.00 0.00 H ATOM 8642 C115 PA 265 117.572 64.352 47.773 1.00 0.00 C ATOM 8643 H15R PA 265 116.518 64.593 47.620 1.00 0.00 H ATOM 8644 H15S PA 265 117.827 64.733 48.764 1.00 0.00 H ATOM 8645 C114 PA 265 117.885 62.826 47.591 1.00 0.00 C ATOM 8646 H14R PA 265 118.888 62.426 47.748 1.00 0.00 H ATOM 8647 H14S PA 265 117.736 62.733 46.513 1.00 0.00 H ATOM 8648 C113 PA 265 116.764 62.040 48.312 1.00 0.00 C ATOM 8649 H13R PA 265 115.765 62.243 47.919 1.00 0.00 H ATOM 8650 H13S PA 265 116.773 62.378 49.350 1.00 0.00 H ATOM 8651 C112 PA 265 116.918 60.532 48.350 1.00 0.00 C ATOM 8652 H12R PA 265 117.777 60.324 48.991 1.00 0.00 H ATOM 8653 H12S PA 265 117.136 60.107 47.368 1.00 0.00 H ATOM 8654 C111 PA 265 115.666 59.880 48.887 1.00 0.00 C ATOM 8655 H11R PA 265 114.927 60.284 48.192 1.00 0.00 H ATOM 8656 H11S PA 265 115.344 60.295 49.844 1.00 0.00 H ATOM 8657 C110 PA 265 115.543 58.352 49.027 1.00 0.00 C ATOM 8658 H10R PA 265 115.884 58.048 48.036 1.00 0.00 H ATOM 8659 H10S PA 265 114.490 58.184 49.261 1.00 0.00 H ATOM 8660 C19 PA 265 116.476 57.798 50.211 1.00 0.00 C ATOM 8661 H9R PA 265 117.227 58.580 50.337 1.00 0.00 H ATOM 8662 H9S PA 265 117.123 56.952 49.964 1.00 0.00 H ATOM 8663 C18 PA 265 115.706 57.747 51.593 1.00 0.00 C ATOM 8664 H8R PA 265 114.982 56.936 51.486 1.00 0.00 H ATOM 8665 H8S PA 265 115.259 58.716 51.824 1.00 0.00 H ATOM 8666 C17 PA 265 116.610 57.499 52.773 1.00 0.00 C ATOM 8667 H7R PA 265 116.913 56.466 52.953 1.00 0.00 H ATOM 8668 H7S PA 265 116.059 57.743 53.684 1.00 0.00 H ATOM 8669 C16 PA 265 117.926 58.337 52.802 1.00 0.00 C ATOM 8670 H6R PA 265 117.624 59.371 52.627 1.00 0.00 H ATOM 8671 H6S PA 265 118.622 58.042 52.014 1.00 0.00 H ATOM 8672 C15 PA 265 118.644 58.262 54.170 1.00 0.00 C ATOM 8673 H5R PA 265 118.957 57.262 54.475 1.00 0.00 H ATOM 8674 H5S PA 265 118.093 58.661 55.025 1.00 0.00 H ATOM 8675 C14 PA 265 119.922 59.110 54.143 1.00 0.00 C ATOM 8676 H4R PA 265 119.790 60.176 53.950 1.00 0.00 H ATOM 8677 H4S PA 265 120.494 58.782 53.272 1.00 0.00 H ATOM 8678 C13 PA 265 120.868 58.916 55.439 1.00 0.00 C ATOM 8679 H3R PA 265 120.898 57.858 55.706 1.00 0.00 H ATOM 8680 H3S PA 265 120.385 59.362 56.311 1.00 0.00 H ATOM 8681 C12 PA 265 122.315 59.455 55.367 1.00 0.00 C ATOM 8682 H2R PA 265 122.282 60.461 54.943 1.00 0.00 H ATOM 8683 H2S PA 265 122.841 58.867 54.612 1.00 0.00 H ATOM 8684 C11 PGR 266 123.024 59.364 56.697 1.00 0.00 C ATOM 8685 O12 PGR 266 123.645 58.402 57.080 1.00 0.00 O ATOM 8686 O11 PGR 266 122.665 60.297 57.538 1.00 0.00 O ATOM 8687 C1 PGR 266 123.383 60.487 58.807 1.00 0.00 C ATOM 8688 HR PGR 266 123.087 59.624 59.408 1.00 0.00 H ATOM 8689 HS PGR 266 122.968 61.369 59.302 1.00 0.00 H ATOM 8690 C2 PGR 266 124.902 60.789 58.589 1.00 0.00 C ATOM 8691 HX PGR 266 125.410 60.083 57.928 1.00 0.00 H ATOM 8692 C3 PGR 266 125.765 60.770 59.887 1.00 0.00 C ATOM 8693 HA PGR 266 126.816 61.028 59.730 1.00 0.00 H ATOM 8694 HB PGR 266 125.754 59.767 60.320 1.00 0.00 H ATOM 8695 O31 PGR 266 125.135 61.637 60.846 1.00 0.00 O ATOM 8696 P31 PGR 266 125.590 61.926 62.324 1.00 0.00 P ATOM 8697 O32 PGR 266 125.352 60.499 63.034 1.00 0.00 O ATOM 8698 C31 PGR 266 124.106 59.858 62.927 1.00 0.00 C ATOM 8699 H1A PGR 266 123.873 59.649 61.880 1.00 0.00 H ATOM 8700 H1B PGR 266 123.354 60.567 63.282 1.00 0.00 H ATOM 8701 C32 PGR 266 124.025 58.596 63.874 1.00 0.00 C ATOM 8702 H2A PGR 266 123.005 58.204 63.869 1.00 0.00 H ATOM 8703 O35 PGR 266 124.787 57.506 63.336 1.00 0.00 O ATOM 8704 HO5A PGR 266 124.601 57.527 62.380 1.00 0.00 H ATOM 8705 C33 PGR 266 124.521 58.964 65.297 1.00 0.00 C ATOM 8706 H3A PGR 266 125.555 59.313 65.233 1.00 0.00 H ATOM 8707 H3B PGR 266 123.887 59.719 65.769 1.00 0.00 H ATOM 8708 O33 PGR 266 127.041 62.139 62.305 1.00 0.00 O ATOM 8709 O34 PGR 266 124.733 62.983 62.884 1.00 0.00 O ATOM 8710 O21 PGR 266 125.034 62.117 58.048 1.00 0.00 O ATOM 8711 C21 PGR 266 124.971 62.289 56.689 1.00 0.00 C ATOM 8712 O22 PGR 266 124.916 61.274 55.989 1.00 0.00 O ATOM 8713 O36 PGR 266 124.519 57.763 66.162 1.00 0.00 O ATOM 8714 HO6A PGR 266 123.606 57.625 66.474 1.00 0.00 H ATOM 8715 C12 OL 267 124.862 63.634 56.145 1.00 0.00 C ATOM 8716 H2R OL 267 123.946 64.078 56.540 1.00 0.00 H ATOM 8717 H2S OL 267 125.790 64.068 56.523 1.00 0.00 H ATOM 8718 C13 OL 267 124.993 63.723 54.672 1.00 0.00 C ATOM 8719 H3R OL 267 125.186 64.715 54.258 1.00 0.00 H ATOM 8720 H3S OL 267 125.931 63.268 54.348 1.00 0.00 H ATOM 8721 C14 OL 267 123.813 62.991 53.938 1.00 0.00 C ATOM 8722 H4R OL 267 124.230 62.909 52.933 1.00 0.00 H ATOM 8723 H4S OL 267 123.629 61.976 54.296 1.00 0.00 H ATOM 8724 C15 OL 267 122.424 63.710 53.889 1.00 0.00 C ATOM 8725 H5R OL 267 122.028 63.639 54.904 1.00 0.00 H ATOM 8726 H5S OL 267 122.613 64.757 53.644 1.00 0.00 H ATOM 8727 C16 OL 267 121.303 62.991 53.016 1.00 0.00 C ATOM 8728 H6R OL 267 120.868 62.108 53.489 1.00 0.00 H ATOM 8729 H6S OL 267 120.558 63.784 52.930 1.00 0.00 H ATOM 8730 C17 OL 267 121.833 62.468 51.593 1.00 0.00 C ATOM 8731 H7R OL 267 122.379 63.327 51.198 1.00 0.00 H ATOM 8732 H7S OL 267 122.730 61.855 51.700 1.00 0.00 H ATOM 8733 C18 OL 267 120.776 62.058 50.507 1.00 0.00 C ATOM 8734 H8R OL 267 119.968 61.392 50.818 1.00 0.00 H ATOM 8735 H8S OL 267 120.219 62.984 50.348 1.00 0.00 H ATOM 8736 C19 OL 267 121.541 61.586 49.390 1.00 0.00 C ATOM 8737 H9R OL 267 122.081 62.377 48.876 1.00 0.00 H ATOM 8738 C110 OL 267 121.636 60.376 48.846 1.00 0.00 C ATOM 8739 H10R OL 267 122.285 60.179 47.997 1.00 0.00 H ATOM 8740 C111 OL 267 121.096 59.080 49.469 1.00 0.00 C ATOM 8741 H11R OL 267 121.878 58.481 49.941 1.00 0.00 H ATOM 8742 H11S OL 267 120.343 59.346 50.214 1.00 0.00 H ATOM 8743 C112 OL 267 120.416 58.158 48.404 1.00 0.00 C ATOM 8744 H12R OL 267 120.286 57.253 49.000 1.00 0.00 H ATOM 8745 H12S OL 267 119.473 58.518 47.987 1.00 0.00 H ATOM 8746 C113 OL 267 121.224 57.820 47.116 1.00 0.00 C ATOM 8747 H13R OL 267 120.692 57.081 46.514 1.00 0.00 H ATOM 8748 H13S OL 267 121.269 58.694 46.462 1.00 0.00 H ATOM 8749 C114 OL 267 122.662 57.381 47.262 1.00 0.00 C ATOM 8750 H14R OL 267 123.193 57.938 48.037 1.00 0.00 H ATOM 8751 H14S OL 267 122.694 56.307 47.460 1.00 0.00 H ATOM 8752 C115 OL 267 123.587 57.536 46.006 1.00 0.00 C ATOM 8753 H15R OL 267 123.270 57.219 45.011 1.00 0.00 H ATOM 8754 H15S OL 267 123.556 58.603 45.778 1.00 0.00 H ATOM 8755 C116 OL 267 125.036 57.098 46.087 1.00 0.00 C ATOM 8756 H16R OL 267 125.363 57.473 47.059 1.00 0.00 H ATOM 8757 H16S OL 267 125.058 56.032 46.326 1.00 0.00 H ATOM 8758 C117 OL 267 125.816 57.531 44.888 1.00 0.00 C ATOM 8759 H17R OL 267 125.352 57.285 43.930 1.00 0.00 H ATOM 8760 H17S OL 267 125.741 58.619 44.947 1.00 0.00 H ATOM 8761 C118 OL 267 127.192 57.049 45.006 1.00 0.00 C ATOM 8762 H18R OL 267 127.972 57.480 44.374 1.00 0.00 H ATOM 8763 H18S OL 267 127.170 55.960 44.929 1.00 0.00 H ATOM 8764 H18T OL 267 127.444 57.265 46.046 1.00 0.00 H TER 8765 OL 267 ATOM 8765 C116 PA 268 77.805 52.910 41.386 1.00 0.00 C ATOM 8766 H16R PA 268 78.749 53.003 41.927 1.00 0.00 H ATOM 8767 H16S PA 268 77.755 53.802 40.758 1.00 0.00 H ATOM 8768 H16T PA 268 77.780 52.156 40.597 1.00 0.00 H ATOM 8769 C115 PA 268 76.650 52.741 42.456 1.00 0.00 C ATOM 8770 H15R PA 268 76.969 52.000 43.192 1.00 0.00 H ATOM 8771 H15S PA 268 75.721 52.367 42.019 1.00 0.00 H ATOM 8772 C114 PA 268 76.323 54.111 43.125 1.00 0.00 C ATOM 8773 H14R PA 268 76.398 54.951 42.432 1.00 0.00 H ATOM 8774 H14S PA 268 77.091 54.301 43.878 1.00 0.00 H ATOM 8775 C113 PA 268 74.882 54.126 43.808 1.00 0.00 C ATOM 8776 H13R PA 268 74.930 53.244 44.450 1.00 0.00 H ATOM 8777 H13S PA 268 74.213 53.785 43.015 1.00 0.00 H ATOM 8778 C112 PA 268 74.619 55.405 44.509 1.00 0.00 C ATOM 8779 H12R PA 268 74.692 56.218 43.784 1.00 0.00 H ATOM 8780 H12S PA 268 75.483 55.495 45.171 1.00 0.00 H ATOM 8781 C111 PA 268 73.341 55.502 45.336 1.00 0.00 C ATOM 8782 H11R PA 268 73.078 54.542 45.787 1.00 0.00 H ATOM 8783 H11S PA 268 72.548 55.834 44.662 1.00 0.00 H ATOM 8784 C110 PA 268 73.396 56.465 46.504 1.00 0.00 C ATOM 8785 H10R PA 268 73.719 57.451 46.163 1.00 0.00 H ATOM 8786 H10S PA 268 74.104 56.144 47.270 1.00 0.00 H ATOM 8787 C19 PA 268 72.119 56.594 47.290 1.00 0.00 C ATOM 8788 H9R PA 268 71.712 55.642 47.638 1.00 0.00 H ATOM 8789 H9S PA 268 71.282 56.842 46.634 1.00 0.00 H ATOM 8790 C18 PA 268 72.300 57.605 48.418 1.00 0.00 C ATOM 8791 H8R PA 268 71.430 58.262 48.361 1.00 0.00 H ATOM 8792 H8S PA 268 73.251 58.135 48.335 1.00 0.00 H ATOM 8793 C17 PA 268 72.116 56.999 49.773 1.00 0.00 C ATOM 8794 H7R PA 268 72.659 56.056 49.864 1.00 0.00 H ATOM 8795 H7S PA 268 71.107 56.591 49.862 1.00 0.00 H ATOM 8796 C16 PA 268 72.306 57.913 51.007 1.00 0.00 C ATOM 8797 H6R PA 268 71.902 58.894 50.746 1.00 0.00 H ATOM 8798 H6S PA 268 73.365 58.084 51.210 1.00 0.00 H ATOM 8799 C15 PA 268 71.612 57.372 52.254 1.00 0.00 C ATOM 8800 H5R PA 268 71.963 56.338 52.275 1.00 0.00 H ATOM 8801 H5S PA 268 70.545 57.307 52.034 1.00 0.00 H ATOM 8802 C14 PA 268 72.001 57.973 53.568 1.00 0.00 C ATOM 8803 H4R PA 268 72.069 59.055 53.439 1.00 0.00 H ATOM 8804 H4S PA 268 72.990 57.659 53.908 1.00 0.00 H ATOM 8805 C13 PA 268 71.067 57.578 54.688 1.00 0.00 C ATOM 8806 H3R PA 268 70.216 58.223 54.921 1.00 0.00 H ATOM 8807 H3S PA 268 71.587 57.738 55.635 1.00 0.00 H ATOM 8808 C12 PA 268 70.542 56.142 54.672 1.00 0.00 C ATOM 8809 H2R PA 268 71.326 55.385 54.606 1.00 0.00 H ATOM 8810 H2S PA 268 69.910 56.032 53.789 1.00 0.00 H ATOM 8811 C11 PGR 269 69.719 55.840 55.864 1.00 0.00 C ATOM 8812 O12 PGR 269 68.877 56.590 56.382 1.00 0.00 O ATOM 8813 O11 PGR 269 69.925 54.555 56.243 1.00 0.00 O ATOM 8814 C1 PGR 269 69.290 54.132 57.483 1.00 0.00 C ATOM 8815 HR PGR 269 68.260 54.488 57.566 1.00 0.00 H ATOM 8816 HS PGR 269 69.887 54.506 58.318 1.00 0.00 H ATOM 8817 C2 PGR 269 69.377 52.524 57.522 1.00 0.00 C ATOM 8818 HX PGR 269 68.615 52.059 58.153 1.00 0.00 H ATOM 8819 C3 PGR 269 70.733 51.944 57.857 1.00 0.00 C ATOM 8820 HA PGR 269 71.386 51.997 56.982 1.00 0.00 H ATOM 8821 HB PGR 269 70.750 50.950 58.310 1.00 0.00 H ATOM 8822 O31 PGR 269 71.375 52.730 58.821 1.00 0.00 O ATOM 8823 P31 PGR 269 71.426 52.284 60.327 1.00 0.00 P ATOM 8824 O32 PGR 269 71.579 53.687 61.212 1.00 0.00 O ATOM 8825 C31 PGR 269 70.498 54.567 61.347 1.00 0.00 C ATOM 8826 H1A PGR 269 69.643 54.188 61.912 1.00 0.00 H ATOM 8827 H1B PGR 269 70.130 54.827 60.352 1.00 0.00 H ATOM 8828 C32 PGR 269 71.049 55.835 61.899 1.00 0.00 C ATOM 8829 H2A PGR 269 70.242 56.572 61.879 1.00 0.00 H ATOM 8830 O35 PGR 269 72.032 56.420 61.054 1.00 0.00 O ATOM 8831 HO5A PGR 269 71.574 56.641 60.224 1.00 0.00 H ATOM 8832 C33 PGR 269 71.519 55.704 63.322 1.00 0.00 C ATOM 8833 H3A PGR 269 70.961 54.843 63.698 1.00 0.00 H ATOM 8834 H3B PGR 269 72.576 55.445 63.428 1.00 0.00 H ATOM 8835 O33 PGR 269 70.110 51.652 60.537 1.00 0.00 O ATOM 8836 O34 PGR 269 72.589 51.387 60.544 1.00 0.00 O ATOM 8837 O21 PGR 269 69.119 51.982 56.127 1.00 0.00 O ATOM 8838 C21 PGR 269 67.949 51.720 55.500 1.00 0.00 C ATOM 8839 O22 PGR 269 66.886 51.756 56.122 1.00 0.00 O ATOM 8840 O36 PGR 269 71.212 56.815 64.187 1.00 0.00 O ATOM 8841 HO6A PGR 269 70.291 57.012 63.938 1.00 0.00 H ATOM 8842 C12 OL 270 68.135 51.196 54.031 1.00 0.00 C ATOM 8843 H2R OL 270 68.232 50.109 54.017 1.00 0.00 H ATOM 8844 H2S OL 270 67.165 51.283 53.536 1.00 0.00 H ATOM 8845 C13 OL 270 69.265 51.969 53.383 1.00 0.00 C ATOM 8846 H3R OL 270 69.166 53.026 53.637 1.00 0.00 H ATOM 8847 H3S OL 270 70.293 51.680 53.610 1.00 0.00 H ATOM 8848 C14 OL 270 69.240 51.934 51.840 1.00 0.00 C ATOM 8849 H4R OL 270 69.070 50.950 51.399 1.00 0.00 H ATOM 8850 H4S OL 270 68.400 52.616 51.690 1.00 0.00 H ATOM 8851 C15 OL 270 70.495 52.672 51.368 1.00 0.00 C ATOM 8852 H5R OL 270 70.632 53.589 51.945 1.00 0.00 H ATOM 8853 H5S OL 270 71.439 52.137 51.493 1.00 0.00 H ATOM 8854 C16 OL 270 70.491 53.237 49.962 1.00 0.00 C ATOM 8855 H6R OL 270 69.666 53.952 49.950 1.00 0.00 H ATOM 8856 H6S OL 270 71.368 53.887 49.911 1.00 0.00 H ATOM 8857 C17 OL 270 70.401 52.240 48.779 1.00 0.00 C ATOM 8858 H7R OL 270 71.032 51.407 49.097 1.00 0.00 H ATOM 8859 H7S OL 270 69.377 51.862 48.764 1.00 0.00 H ATOM 8860 C18 OL 270 70.800 52.827 47.426 1.00 0.00 C ATOM 8861 H8R OL 270 70.235 53.700 47.093 1.00 0.00 H ATOM 8862 H8S OL 270 71.879 52.990 47.386 1.00 0.00 H ATOM 8863 C19 OL 270 70.479 51.820 46.374 1.00 0.00 C ATOM 8864 H9R OL 270 70.248 50.832 46.766 1.00 0.00 H ATOM 8865 C110 OL 270 70.252 52.043 45.086 1.00 0.00 C ATOM 8866 H10R OL 270 69.826 51.259 44.464 1.00 0.00 H ATOM 8867 C111 OL 270 70.612 53.215 44.407 1.00 0.00 C ATOM 8868 H11R OL 270 71.249 53.828 45.047 1.00 0.00 H ATOM 8869 H11S OL 270 71.183 52.953 43.514 1.00 0.00 H ATOM 8870 C112 OL 270 69.429 54.153 44.101 1.00 0.00 C ATOM 8871 H12R OL 270 68.958 54.544 45.006 1.00 0.00 H ATOM 8872 H12S OL 270 69.902 54.996 43.592 1.00 0.00 H ATOM 8873 C113 OL 270 68.338 53.715 43.073 1.00 0.00 C ATOM 8874 H13R OL 270 67.639 53.038 43.567 1.00 0.00 H ATOM 8875 H13S OL 270 67.692 54.546 42.779 1.00 0.00 H ATOM 8876 C114 OL 270 68.765 52.917 41.862 1.00 0.00 C ATOM 8877 H14R OL 270 69.514 53.503 41.326 1.00 0.00 H ATOM 8878 H14S OL 270 69.322 52.038 42.195 1.00 0.00 H ATOM 8879 C115 OL 270 67.622 52.517 40.921 1.00 0.00 C ATOM 8880 H15R OL 270 66.961 51.880 41.512 1.00 0.00 H ATOM 8881 H15S OL 270 67.114 53.469 40.751 1.00 0.00 H ATOM 8882 C116 OL 270 68.075 51.884 39.592 1.00 0.00 C ATOM 8883 H16R OL 270 68.572 50.947 39.850 1.00 0.00 H ATOM 8884 H16S OL 270 67.176 51.562 39.063 1.00 0.00 H ATOM 8885 C117 OL 270 68.912 52.844 38.750 1.00 0.00 C ATOM 8886 H17R OL 270 68.280 53.479 38.126 1.00 0.00 H ATOM 8887 H17S OL 270 69.410 53.572 39.394 1.00 0.00 H ATOM 8888 C118 OL 270 70.025 52.135 38.035 1.00 0.00 C ATOM 8889 H18R OL 270 70.693 51.712 38.787 1.00 0.00 H ATOM 8890 H18S OL 270 70.718 52.660 37.375 1.00 0.00 H ATOM 8891 H18T OL 270 69.526 51.271 37.590 1.00 0.00 H TER 8892 OL 270 ATOM 8892 C116 PA 271 147.482 97.809 51.167 1.00 0.00 C ATOM 8893 H16R PA 271 147.958 96.841 50.997 1.00 0.00 H ATOM 8894 H16S PA 271 147.449 98.043 52.233 1.00 0.00 H ATOM 8895 H16T PA 271 148.073 98.605 50.709 1.00 0.00 H ATOM 8896 C115 PA 271 146.173 97.757 50.593 1.00 0.00 C ATOM 8897 H15R PA 271 146.381 97.333 49.608 1.00 0.00 H ATOM 8898 H15S PA 271 145.819 98.786 50.509 1.00 0.00 H ATOM 8899 C114 PA 271 145.167 96.966 51.436 1.00 0.00 C ATOM 8900 H14R PA 271 144.896 97.595 52.286 1.00 0.00 H ATOM 8901 H14S PA 271 145.675 96.090 51.846 1.00 0.00 H ATOM 8902 C113 PA 271 144.038 96.436 50.590 1.00 0.00 C ATOM 8903 H13R PA 271 143.352 95.867 51.221 1.00 0.00 H ATOM 8904 H13S PA 271 144.544 95.719 49.940 1.00 0.00 H ATOM 8905 C112 PA 271 143.270 97.451 49.734 1.00 0.00 C ATOM 8906 H12R PA 271 143.909 98.275 49.411 1.00 0.00 H ATOM 8907 H12S PA 271 142.411 97.876 50.257 1.00 0.00 H ATOM 8908 C111 PA 271 142.840 96.687 48.460 1.00 0.00 C ATOM 8909 H11R PA 271 143.673 96.223 47.927 1.00 0.00 H ATOM 8910 H11S PA 271 142.443 97.323 47.666 1.00 0.00 H ATOM 8911 C110 PA 271 141.829 95.527 48.657 1.00 0.00 C ATOM 8912 H10R PA 271 142.263 94.816 49.363 1.00 0.00 H ATOM 8913 H10S PA 271 141.680 95.035 47.694 1.00 0.00 H ATOM 8914 C19 PA 271 140.361 95.890 49.150 1.00 0.00 C ATOM 8915 H9R PA 271 139.692 95.398 48.441 1.00 0.00 H ATOM 8916 H9S PA 271 140.340 96.964 48.952 1.00 0.00 H ATOM 8917 C18 PA 271 140.086 95.548 50.601 1.00 0.00 C ATOM 8918 H8R PA 271 140.558 96.196 51.343 1.00 0.00 H ATOM 8919 H8S PA 271 140.411 94.545 50.884 1.00 0.00 H ATOM 8920 C17 PA 271 138.484 95.582 50.767 1.00 0.00 C ATOM 8921 H7R PA 271 137.993 94.858 50.114 1.00 0.00 H ATOM 8922 H7S PA 271 138.044 96.573 50.634 1.00 0.00 H ATOM 8923 C16 PA 271 138.189 95.128 52.103 1.00 0.00 C ATOM 8924 H6R PA 271 138.457 95.775 52.941 1.00 0.00 H ATOM 8925 H6S PA 271 138.718 94.254 52.488 1.00 0.00 H ATOM 8926 C15 PA 271 136.739 94.608 52.335 1.00 0.00 C ATOM 8927 H5R PA 271 136.545 93.728 51.718 1.00 0.00 H ATOM 8928 H5S PA 271 135.928 95.257 52.000 1.00 0.00 H ATOM 8929 C14 PA 271 136.354 94.532 53.812 1.00 0.00 C ATOM 8930 H4R PA 271 135.297 94.356 54.024 1.00 0.00 H ATOM 8931 H4S PA 271 136.567 95.503 54.263 1.00 0.00 H ATOM 8932 C13 PA 271 136.912 93.404 54.633 1.00 0.00 C ATOM 8933 H3R PA 271 136.665 93.554 55.686 1.00 0.00 H ATOM 8934 H3S PA 271 138.001 93.326 54.616 1.00 0.00 H ATOM 8935 C12 PA 271 136.227 92.007 54.317 1.00 0.00 C ATOM 8936 H2R PA 271 136.222 91.706 53.267 1.00 0.00 H ATOM 8937 H2S PA 271 135.155 92.058 54.520 1.00 0.00 H ATOM 8938 C11 PGR 272 136.840 90.972 55.219 1.00 0.00 C ATOM 8939 O12 PGR 272 137.779 91.194 55.982 1.00 0.00 O ATOM 8940 O11 PGR 272 136.180 89.799 55.172 1.00 0.00 O ATOM 8941 C1 PGR 272 136.632 88.708 56.007 1.00 0.00 C ATOM 8942 HR PGR 272 137.713 88.545 56.007 1.00 0.00 H ATOM 8943 HS PGR 272 136.023 87.872 55.654 1.00 0.00 H ATOM 8944 C2 PGR 272 136.115 89.035 57.451 1.00 0.00 C ATOM 8945 HX PGR 272 136.230 90.102 57.658 1.00 0.00 H ATOM 8946 C3 PGR 272 136.691 88.083 58.526 1.00 0.00 C ATOM 8947 HA PGR 272 137.783 88.090 58.479 1.00 0.00 H ATOM 8948 HB PGR 272 136.403 87.073 58.224 1.00 0.00 H ATOM 8949 O31 PGR 272 136.204 88.295 59.839 1.00 0.00 O ATOM 8950 P31 PGR 272 136.828 89.477 60.727 1.00 0.00 P ATOM 8951 O32 PGR 272 135.789 89.574 61.822 1.00 0.00 O ATOM 8952 C31 PGR 272 134.529 90.255 61.732 1.00 0.00 C ATOM 8953 H1A PGR 272 133.945 89.622 61.059 1.00 0.00 H ATOM 8954 H1B PGR 272 134.632 91.240 61.270 1.00 0.00 H ATOM 8955 C32 PGR 272 133.854 90.306 63.092 1.00 0.00 C ATOM 8956 H2A PGR 272 132.894 90.828 63.065 1.00 0.00 H ATOM 8957 O35 PGR 272 134.627 91.099 64.068 1.00 0.00 O ATOM 8958 HO5A PGR 272 134.644 92.014 63.736 1.00 0.00 H ATOM 8959 C33 PGR 272 133.865 88.918 63.665 1.00 0.00 C ATOM 8960 H3A PGR 272 133.620 88.157 62.919 1.00 0.00 H ATOM 8961 H3B PGR 272 134.905 88.731 63.945 1.00 0.00 H ATOM 8962 O33 PGR 272 138.066 88.968 61.332 1.00 0.00 O ATOM 8963 O34 PGR 272 136.851 90.739 60.016 1.00 0.00 O ATOM 8964 O21 PGR 272 134.727 88.680 57.477 1.00 0.00 O ATOM 8965 C21 PGR 272 133.840 89.517 56.909 1.00 0.00 C ATOM 8966 O22 PGR 272 134.046 90.721 56.672 1.00 0.00 O ATOM 8967 O36 PGR 272 133.134 88.773 64.888 1.00 0.00 O ATOM 8968 HO6A PGR 272 133.226 89.530 65.493 1.00 0.00 H ATOM 8969 C12 OL 273 132.503 88.854 56.720 1.00 0.00 C ATOM 8970 H2R OL 273 132.041 88.676 57.694 1.00 0.00 H ATOM 8971 H2S OL 273 131.857 89.624 56.294 1.00 0.00 H ATOM 8972 C13 OL 273 132.533 87.665 55.872 1.00 0.00 C ATOM 8973 H3R OL 273 133.039 86.861 56.411 1.00 0.00 H ATOM 8974 H3S OL 273 131.531 87.279 55.676 1.00 0.00 H ATOM 8975 C14 OL 273 133.236 87.764 54.540 1.00 0.00 C ATOM 8976 H4R OL 273 132.959 88.635 53.942 1.00 0.00 H ATOM 8977 H4S OL 273 134.293 87.956 54.734 1.00 0.00 H ATOM 8978 C15 OL 273 132.961 86.572 53.650 1.00 0.00 C ATOM 8979 H5R OL 273 133.410 85.698 54.126 1.00 0.00 H ATOM 8980 H5S OL 273 131.899 86.498 53.407 1.00 0.00 H ATOM 8981 C16 OL 273 133.666 86.547 52.326 1.00 0.00 C ATOM 8982 H6R OL 273 133.692 85.509 51.987 1.00 0.00 H ATOM 8983 H6S OL 273 133.235 87.103 51.490 1.00 0.00 H ATOM 8984 C17 OL 273 135.141 86.938 52.339 1.00 0.00 C ATOM 8985 H7R OL 273 135.243 88.024 52.291 1.00 0.00 H ATOM 8986 H7S OL 273 135.686 86.451 53.151 1.00 0.00 H ATOM 8987 C18 OL 273 136.003 86.537 51.169 1.00 0.00 C ATOM 8988 H8R OL 273 136.281 85.481 51.165 1.00 0.00 H ATOM 8989 H8S OL 273 135.449 86.705 50.243 1.00 0.00 H ATOM 8990 C19 OL 273 137.324 87.317 51.038 1.00 0.00 C ATOM 8991 H9R OL 273 138.049 87.274 51.847 1.00 0.00 H ATOM 8992 C110 OL 273 137.684 87.989 49.895 1.00 0.00 C ATOM 8993 H10R OL 273 138.667 88.448 49.824 1.00 0.00 H ATOM 8994 C111 OL 273 136.815 88.156 48.677 1.00 0.00 C ATOM 8995 H11R OL 273 137.452 88.473 47.849 1.00 0.00 H ATOM 8996 H11S OL 273 136.364 87.185 48.460 1.00 0.00 H ATOM 8997 C112 OL 273 135.595 89.147 48.578 1.00 0.00 C ATOM 8998 H12R OL 273 135.296 89.319 47.541 1.00 0.00 H ATOM 8999 H12S OL 273 134.744 88.683 49.081 1.00 0.00 H ATOM 9000 C113 OL 273 135.959 90.410 49.384 1.00 0.00 C ATOM 9001 H13R OL 273 135.828 90.245 50.456 1.00 0.00 H ATOM 9002 H13S OL 273 136.965 90.676 49.053 1.00 0.00 H ATOM 9003 C114 OL 273 134.984 91.576 49.212 1.00 0.00 C ATOM 9004 H14R OL 273 135.439 92.495 49.587 1.00 0.00 H ATOM 9005 H14S OL 273 134.777 91.705 48.147 1.00 0.00 H ATOM 9006 C115 OL 273 133.670 91.262 49.899 1.00 0.00 C ATOM 9007 H15R OL 273 133.328 90.233 49.769 1.00 0.00 H ATOM 9008 H15S OL 273 133.999 91.347 50.937 1.00 0.00 H ATOM 9009 C116 OL 273 132.434 92.279 49.784 1.00 0.00 C ATOM 9010 H16R OL 273 131.770 92.042 50.618 1.00 0.00 H ATOM 9011 H16S OL 273 132.719 93.322 49.934 1.00 0.00 H ATOM 9012 C117 OL 273 131.764 92.190 48.391 1.00 0.00 C ATOM 9013 H17R OL 273 131.367 93.174 48.134 1.00 0.00 H ATOM 9014 H17S OL 273 132.590 92.028 47.695 1.00 0.00 H ATOM 9015 C118 OL 273 130.758 91.046 48.392 1.00 0.00 C ATOM 9016 H18R OL 273 131.174 90.171 48.896 1.00 0.00 H ATOM 9017 H18S OL 273 130.504 90.758 47.370 1.00 0.00 H ATOM 9018 H18T OL 273 129.851 91.336 48.927 1.00 0.00 H TER 9019 OL 273 ATOM 9019 C116 PA 274 69.766 82.896 47.977 1.00 0.00 C ATOM 9020 H16R PA 274 70.178 83.907 47.997 1.00 0.00 H ATOM 9021 H16S PA 274 70.413 82.056 47.717 1.00 0.00 H ATOM 9022 H16T PA 274 69.583 82.670 49.030 1.00 0.00 H ATOM 9023 C115 PA 274 68.343 82.753 47.365 1.00 0.00 C ATOM 9024 H15R PA 274 67.555 83.096 48.039 1.00 0.00 H ATOM 9025 H15S PA 274 68.126 81.689 47.252 1.00 0.00 H ATOM 9026 C114 PA 274 68.295 83.428 45.978 1.00 0.00 C ATOM 9027 H14R PA 274 69.188 83.000 45.519 1.00 0.00 H ATOM 9028 H14S PA 274 68.553 84.488 46.033 1.00 0.00 H ATOM 9029 C113 PA 274 67.122 83.025 45.153 1.00 0.00 C ATOM 9030 H13R PA 274 66.229 83.015 45.781 1.00 0.00 H ATOM 9031 H13S PA 274 67.289 82.036 44.722 1.00 0.00 H ATOM 9032 C112 PA 274 66.909 83.898 43.808 1.00 0.00 C ATOM 9033 H12R PA 274 67.843 84.107 43.282 1.00 0.00 H ATOM 9034 H12S PA 274 66.655 84.903 44.152 1.00 0.00 H ATOM 9035 C111 PA 274 65.712 83.448 42.856 1.00 0.00 C ATOM 9036 H11R PA 274 64.994 83.033 43.567 1.00 0.00 H ATOM 9037 H11S PA 274 65.920 82.581 42.225 1.00 0.00 H ATOM 9038 C110 PA 274 65.024 84.548 42.079 1.00 0.00 C ATOM 9039 H10R PA 274 64.839 84.029 41.136 1.00 0.00 H ATOM 9040 H10S PA 274 65.652 85.439 42.014 1.00 0.00 H ATOM 9041 C19 PA 274 63.704 84.982 42.796 1.00 0.00 C ATOM 9042 H9R PA 274 63.065 84.109 42.647 1.00 0.00 H ATOM 9043 H9S PA 274 63.332 85.819 42.203 1.00 0.00 H ATOM 9044 C18 PA 274 63.816 85.352 44.281 1.00 0.00 C ATOM 9045 H8R PA 274 64.552 86.101 44.579 1.00 0.00 H ATOM 9046 H8S PA 274 64.004 84.406 44.792 1.00 0.00 H ATOM 9047 C17 PA 274 62.473 85.733 44.736 1.00 0.00 C ATOM 9048 H7R PA 274 61.773 84.908 44.590 1.00 0.00 H ATOM 9049 H7S PA 274 62.070 86.545 44.126 1.00 0.00 H ATOM 9050 C16 PA 274 62.519 86.063 46.165 1.00 0.00 C ATOM 9051 H6R PA 274 61.486 86.279 46.447 1.00 0.00 H ATOM 9052 H6S PA 274 63.046 87.017 46.236 1.00 0.00 H ATOM 9053 C15 PA 274 63.215 84.996 47.153 1.00 0.00 C ATOM 9054 H5R PA 274 64.210 84.615 46.914 1.00 0.00 H ATOM 9055 H5S PA 274 62.817 83.983 47.242 1.00 0.00 H ATOM 9056 C14 PA 274 63.292 85.591 48.625 1.00 0.00 C ATOM 9057 H4R PA 274 62.294 85.726 49.046 1.00 0.00 H ATOM 9058 H4S PA 274 63.723 86.594 48.638 1.00 0.00 H ATOM 9059 C13 PA 274 64.188 84.849 49.669 1.00 0.00 C ATOM 9060 H3R PA 274 65.220 84.798 49.316 1.00 0.00 H ATOM 9061 H3S PA 274 63.931 83.788 49.639 1.00 0.00 H ATOM 9062 C12 PA 274 64.217 85.415 51.130 1.00 0.00 C ATOM 9063 H2R PA 274 63.185 85.571 51.451 1.00 0.00 H ATOM 9064 H2S PA 274 64.657 86.414 51.110 1.00 0.00 H ATOM 9065 C11 PGR 275 64.902 84.492 52.133 1.00 0.00 C ATOM 9066 O12 PGR 275 65.669 83.551 51.765 1.00 0.00 O ATOM 9067 O11 PGR 275 64.710 84.837 53.386 1.00 0.00 O ATOM 9068 C1 PGR 275 65.585 84.239 54.450 1.00 0.00 C ATOM 9069 HR PGR 275 65.805 83.178 54.305 1.00 0.00 H ATOM 9070 HS PGR 275 65.172 84.375 55.453 1.00 0.00 H ATOM 9071 C2 PGR 275 66.861 85.122 54.319 1.00 0.00 C ATOM 9072 HX PGR 275 67.268 85.043 53.308 1.00 0.00 H ATOM 9073 C3 PGR 275 67.823 84.702 55.428 1.00 0.00 C ATOM 9074 HA PGR 275 68.730 85.311 55.398 1.00 0.00 H ATOM 9075 HB PGR 275 68.195 83.675 55.379 1.00 0.00 H ATOM 9076 O31 PGR 275 67.128 84.762 56.618 1.00 0.00 O ATOM 9077 P31 PGR 275 67.817 84.424 58.010 1.00 0.00 P ATOM 9078 O32 PGR 275 68.345 82.983 57.690 1.00 0.00 O ATOM 9079 C31 PGR 275 67.340 81.884 57.463 1.00 0.00 C ATOM 9080 H1A PGR 275 66.523 82.191 56.806 1.00 0.00 H ATOM 9081 H1B PGR 275 66.917 81.614 58.434 1.00 0.00 H ATOM 9082 C32 PGR 275 68.081 80.680 56.845 1.00 0.00 C ATOM 9083 H2A PGR 275 67.486 79.765 56.893 1.00 0.00 H ATOM 9084 O35 PGR 275 69.191 80.446 57.707 1.00 0.00 O ATOM 9085 HO5A PGR 275 69.555 81.260 58.099 1.00 0.00 H ATOM 9086 C33 PGR 275 68.542 80.881 55.353 1.00 0.00 C ATOM 9087 H3A PGR 275 67.751 81.309 54.732 1.00 0.00 H ATOM 9088 H3B PGR 275 69.351 81.616 55.360 1.00 0.00 H ATOM 9089 O33 PGR 275 68.955 85.363 58.250 1.00 0.00 O ATOM 9090 O34 PGR 275 66.779 84.286 59.032 1.00 0.00 O ATOM 9091 O21 PGR 275 66.525 86.531 54.531 1.00 0.00 O ATOM 9092 C21 PGR 275 67.304 87.647 54.567 1.00 0.00 C ATOM 9093 O22 PGR 275 68.505 87.581 54.337 1.00 0.00 O ATOM 9094 O36 PGR 275 68.874 79.588 54.711 1.00 0.00 O ATOM 9095 HO6A PGR 275 68.673 79.645 53.760 1.00 0.00 H ATOM 9096 C12 OL 276 66.594 88.952 54.726 1.00 0.00 C ATOM 9097 H2R OL 276 65.900 89.003 55.568 1.00 0.00 H ATOM 9098 H2S OL 276 67.333 89.703 55.014 1.00 0.00 H ATOM 9099 C13 OL 276 65.733 89.284 53.523 1.00 0.00 C ATOM 9100 H3R OL 276 64.895 88.584 53.541 1.00 0.00 H ATOM 9101 H3S OL 276 65.169 90.194 53.739 1.00 0.00 H ATOM 9102 C14 OL 276 66.510 89.404 52.258 1.00 0.00 C ATOM 9103 H4R OL 276 67.094 90.318 52.383 1.00 0.00 H ATOM 9104 H4S OL 276 67.183 88.582 52.006 1.00 0.00 H ATOM 9105 C15 OL 276 65.687 89.645 51.027 1.00 0.00 C ATOM 9106 H5R OL 276 66.266 89.352 50.149 1.00 0.00 H ATOM 9107 H5S OL 276 64.735 89.112 50.975 1.00 0.00 H ATOM 9108 C16 OL 276 65.338 91.162 50.888 1.00 0.00 C ATOM 9109 H6R OL 276 65.016 91.587 51.841 1.00 0.00 H ATOM 9110 H6S OL 276 66.184 91.714 50.473 1.00 0.00 H ATOM 9111 C17 OL 276 64.225 91.314 49.882 1.00 0.00 C ATOM 9112 H7R OL 276 64.446 90.645 49.047 1.00 0.00 H ATOM 9113 H7S OL 276 63.258 91.117 50.348 1.00 0.00 H ATOM 9114 C18 OL 276 63.923 92.729 49.231 1.00 0.00 C ATOM 9115 H8R OL 276 63.540 93.466 49.939 1.00 0.00 H ATOM 9116 H8S OL 276 64.858 93.091 48.799 1.00 0.00 H ATOM 9117 C19 OL 276 62.849 92.644 48.229 1.00 0.00 C ATOM 9118 H9R OL 276 63.192 92.734 47.202 1.00 0.00 H ATOM 9119 C110 OL 276 61.581 92.649 48.615 1.00 0.00 C ATOM 9120 H10R OL 276 60.839 92.634 47.821 1.00 0.00 H ATOM 9121 C111 OL 276 61.083 92.582 50.020 1.00 0.00 C ATOM 9122 H11R OL 276 60.566 91.667 50.318 1.00 0.00 H ATOM 9123 H11S OL 276 61.834 92.756 50.794 1.00 0.00 H ATOM 9124 C112 OL 276 60.090 93.806 50.189 1.00 0.00 C ATOM 9125 H12R OL 276 60.644 94.730 50.013 1.00 0.00 H ATOM 9126 H12S OL 276 59.217 93.788 49.532 1.00 0.00 H ATOM 9127 C113 OL 276 59.529 93.990 51.622 1.00 0.00 C ATOM 9128 H13R OL 276 59.283 93.036 52.092 1.00 0.00 H ATOM 9129 H13S OL 276 60.357 94.423 52.187 1.00 0.00 H ATOM 9130 C114 OL 276 58.385 95.027 51.650 1.00 0.00 C ATOM 9131 H14R OL 276 58.623 95.857 50.981 1.00 0.00 H ATOM 9132 H14S OL 276 57.468 94.529 51.329 1.00 0.00 H ATOM 9133 C115 OL 276 58.001 95.523 53.067 1.00 0.00 C ATOM 9134 H15R OL 276 57.682 94.713 53.726 1.00 0.00 H ATOM 9135 H15S OL 276 58.948 95.889 53.468 1.00 0.00 H ATOM 9136 C116 OL 276 57.005 96.750 53.056 1.00 0.00 C ATOM 9137 H16R OL 276 57.056 97.196 54.051 1.00 0.00 H ATOM 9138 H16S OL 276 57.316 97.418 52.250 1.00 0.00 H ATOM 9139 C117 OL 276 55.568 96.324 52.624 1.00 0.00 C ATOM 9140 H17R OL 276 55.642 95.872 51.632 1.00 0.00 H ATOM 9141 H17S OL 276 55.294 95.503 53.289 1.00 0.00 H ATOM 9142 C118 OL 276 54.485 97.335 52.577 1.00 0.00 C ATOM 9143 H18R OL 276 54.373 97.925 51.666 1.00 0.00 H ATOM 9144 H18S OL 276 54.648 97.866 53.517 1.00 0.00 H ATOM 9145 H18T OL 276 53.512 96.858 52.718 1.00 0.00 H TER 9146 OL 276 ATOM 9146 C116 PA 277 30.222 12.870 40.250 1.00 0.00 C ATOM 9147 H16R PA 277 30.466 11.824 40.053 1.00 0.00 H ATOM 9148 H16S PA 277 31.128 13.480 40.226 1.00 0.00 H ATOM 9149 H16T PA 277 29.668 13.315 39.420 1.00 0.00 H ATOM 9150 C115 PA 277 29.485 12.910 41.549 1.00 0.00 C ATOM 9151 H15R PA 277 28.441 12.634 41.392 1.00 0.00 H ATOM 9152 H15S PA 277 29.461 13.942 41.906 1.00 0.00 H ATOM 9153 C114 PA 277 30.109 12.140 42.653 1.00 0.00 C ATOM 9154 H14R PA 277 31.167 12.410 42.612 1.00 0.00 H ATOM 9155 H14S PA 277 30.069 11.052 42.570 1.00 0.00 H ATOM 9156 C113 PA 277 29.628 12.424 44.081 1.00 0.00 C ATOM 9157 H13R PA 277 28.791 11.760 44.309 1.00 0.00 H ATOM 9158 H13S PA 277 29.209 13.432 44.119 1.00 0.00 H ATOM 9159 C112 PA 277 30.766 12.261 45.026 1.00 0.00 C ATOM 9160 H12R PA 277 31.417 13.127 44.889 1.00 0.00 H ATOM 9161 H12S PA 277 31.361 11.368 44.820 1.00 0.00 H ATOM 9162 C111 PA 277 30.239 12.338 46.444 1.00 0.00 C ATOM 9163 H11R PA 277 29.537 11.519 46.613 1.00 0.00 H ATOM 9164 H11S PA 277 29.621 13.228 46.577 1.00 0.00 H ATOM 9165 C110 PA 277 31.242 12.379 47.588 1.00 0.00 C ATOM 9166 H10R PA 277 31.952 13.195 47.433 1.00 0.00 H ATOM 9167 H10S PA 277 31.890 11.504 47.506 1.00 0.00 H ATOM 9168 C19 PA 277 30.661 12.456 48.992 1.00 0.00 C ATOM 9169 H9R PA 277 30.355 11.522 49.469 1.00 0.00 H ATOM 9170 H9S PA 277 29.772 13.069 48.828 1.00 0.00 H ATOM 9171 C18 PA 277 31.708 13.132 49.959 1.00 0.00 C ATOM 9172 H8R PA 277 32.191 13.914 49.368 1.00 0.00 H ATOM 9173 H8S PA 277 32.587 12.501 50.109 1.00 0.00 H ATOM 9174 C17 PA 277 31.353 13.570 51.363 1.00 0.00 C ATOM 9175 H7R PA 277 32.349 13.876 51.689 1.00 0.00 H ATOM 9176 H7S PA 277 31.056 12.730 51.996 1.00 0.00 H ATOM 9177 C16 PA 277 30.322 14.727 51.359 1.00 0.00 C ATOM 9178 H6R PA 277 29.426 14.450 50.799 1.00 0.00 H ATOM 9179 H6S PA 277 30.750 15.532 50.757 1.00 0.00 H ATOM 9180 C15 PA 277 29.837 15.338 52.566 1.00 0.00 C ATOM 9181 H5R PA 277 29.322 14.670 53.259 1.00 0.00 H ATOM 9182 H5S PA 277 29.252 16.237 52.360 1.00 0.00 H ATOM 9183 C14 PA 277 30.927 15.931 53.547 1.00 0.00 C ATOM 9184 H4R PA 277 31.561 16.597 52.958 1.00 0.00 H ATOM 9185 H4S PA 277 31.547 15.177 54.035 1.00 0.00 H ATOM 9186 C13 PA 277 30.519 16.762 54.736 1.00 0.00 C ATOM 9187 H3R PA 277 29.697 16.312 55.297 1.00 0.00 H ATOM 9188 H3S PA 277 30.165 17.723 54.356 1.00 0.00 H ATOM 9189 C12 PA 277 31.592 16.920 55.870 1.00 0.00 C ATOM 9190 H2R PA 277 31.094 17.682 56.474 1.00 0.00 H ATOM 9191 H2S PA 277 32.561 17.214 55.463 1.00 0.00 H ATOM 9192 C11 PGR 278 31.721 15.760 56.797 1.00 0.00 C ATOM 9193 O12 PGR 278 31.008 15.568 57.694 1.00 0.00 O ATOM 9194 O11 PGR 278 32.813 15.037 56.554 1.00 0.00 O ATOM 9195 C1 PGR 278 33.230 14.057 57.517 1.00 0.00 C ATOM 9196 HR PGR 278 33.170 14.481 58.523 1.00 0.00 H ATOM 9197 HS PGR 278 34.292 13.874 57.338 1.00 0.00 H ATOM 9198 C2 PGR 278 32.415 12.775 57.410 1.00 0.00 C ATOM 9199 HX PGR 278 31.348 12.987 57.304 1.00 0.00 H ATOM 9200 C3 PGR 278 32.596 11.851 58.670 1.00 0.00 C ATOM 9201 HA PGR 278 31.866 11.038 58.662 1.00 0.00 H ATOM 9202 HB PGR 278 32.261 12.484 59.495 1.00 0.00 H ATOM 9203 O31 PGR 278 34.009 11.555 58.772 1.00 0.00 O ATOM 9204 P31 PGR 278 34.598 10.721 59.956 1.00 0.00 P ATOM 9205 O32 PGR 278 34.009 11.340 61.331 1.00 0.00 O ATOM 9206 C31 PGR 278 34.499 10.908 62.573 1.00 0.00 C ATOM 9207 H1A PGR 278 34.806 9.866 62.456 1.00 0.00 H ATOM 9208 H1B PGR 278 33.765 10.978 63.379 1.00 0.00 H ATOM 9209 C32 PGR 278 35.735 11.755 62.974 1.00 0.00 C ATOM 9210 H2A PGR 278 35.740 12.785 62.609 1.00 0.00 H ATOM 9211 O35 PGR 278 36.807 10.958 62.498 1.00 0.00 O ATOM 9212 HO5A PGR 278 36.657 10.765 61.555 1.00 0.00 H ATOM 9213 C33 PGR 278 35.880 11.965 64.523 1.00 0.00 C ATOM 9214 H3A PGR 278 34.985 12.548 64.751 1.00 0.00 H ATOM 9215 H3B PGR 278 35.821 10.943 64.906 1.00 0.00 H ATOM 9216 O33 PGR 278 34.210 9.285 59.886 1.00 0.00 O ATOM 9217 O34 PGR 278 36.000 10.904 59.912 1.00 0.00 O ATOM 9218 O21 PGR 278 32.867 11.976 56.253 1.00 0.00 O ATOM 9219 C21 PGR 278 32.254 10.836 55.854 1.00 0.00 C ATOM 9220 O22 PGR 278 31.446 10.311 56.577 1.00 0.00 O ATOM 9221 O36 PGR 278 37.152 12.539 64.921 1.00 0.00 O ATOM 9222 HO6A PGR 278 37.040 12.805 65.851 1.00 0.00 H ATOM 9223 C12 OL 279 32.621 10.488 54.505 1.00 0.00 C ATOM 9224 H2R OL 279 31.931 9.726 54.137 1.00 0.00 H ATOM 9225 H2S OL 279 32.625 11.394 53.895 1.00 0.00 H ATOM 9226 C13 OL 279 33.995 9.866 54.478 1.00 0.00 C ATOM 9227 H3R OL 279 34.720 10.502 54.989 1.00 0.00 H ATOM 9228 H3S OL 279 33.888 8.956 55.073 1.00 0.00 H ATOM 9229 C14 OL 279 34.553 9.290 53.146 1.00 0.00 C ATOM 9230 H4R OL 279 35.092 10.067 52.600 1.00 0.00 H ATOM 9231 H4S OL 279 35.325 8.533 53.297 1.00 0.00 H ATOM 9232 C15 OL 279 33.559 8.708 52.135 1.00 0.00 C ATOM 9233 H5R OL 279 34.015 7.828 51.678 1.00 0.00 H ATOM 9234 H5S OL 279 32.782 8.365 52.821 1.00 0.00 H ATOM 9235 C16 OL 279 32.927 9.626 51.080 1.00 0.00 C ATOM 9236 H6R OL 279 32.461 10.492 51.554 1.00 0.00 H ATOM 9237 H6S OL 279 33.676 9.971 50.365 1.00 0.00 H ATOM 9238 C17 OL 279 31.812 8.937 50.320 1.00 0.00 C ATOM 9239 H7R OL 279 31.030 8.592 51.000 1.00 0.00 H ATOM 9240 H7S OL 279 31.270 9.580 49.624 1.00 0.00 H ATOM 9241 C18 OL 279 32.356 7.935 49.306 1.00 0.00 C ATOM 9242 H8R OL 279 32.955 8.535 48.618 1.00 0.00 H ATOM 9243 H8S OL 279 32.974 7.169 49.780 1.00 0.00 H ATOM 9244 C19 OL 279 31.162 7.238 48.632 1.00 0.00 C ATOM 9245 H9R OL 279 30.548 6.708 49.356 1.00 0.00 H ATOM 9246 C110 OL 279 30.651 7.378 47.388 1.00 0.00 C ATOM 9247 H10R OL 279 29.682 6.985 47.090 1.00 0.00 H ATOM 9248 C111 OL 279 31.532 8.016 46.372 1.00 0.00 C ATOM 9249 H11R OL 279 31.553 9.091 46.564 1.00 0.00 H ATOM 9250 H11S OL 279 32.569 7.707 46.517 1.00 0.00 H ATOM 9251 C112 OL 279 30.996 7.766 44.933 1.00 0.00 C ATOM 9252 H12R OL 279 30.970 6.697 44.711 1.00 0.00 H ATOM 9253 H12S OL 279 29.956 8.087 44.845 1.00 0.00 H ATOM 9254 C113 OL 279 31.856 8.279 43.774 1.00 0.00 C ATOM 9255 H13R OL 279 32.153 9.288 44.068 1.00 0.00 H ATOM 9256 H13S OL 279 32.807 7.746 43.718 1.00 0.00 H ATOM 9257 C114 OL 279 31.130 8.353 42.486 1.00 0.00 C ATOM 9258 H14R OL 279 30.712 7.346 42.428 1.00 0.00 H ATOM 9259 H14S OL 279 30.233 8.975 42.478 1.00 0.00 H ATOM 9260 C115 OL 279 31.959 8.683 41.155 1.00 0.00 C ATOM 9261 H15R OL 279 32.313 9.715 41.099 1.00 0.00 H ATOM 9262 H15S OL 279 32.963 8.268 41.265 1.00 0.00 H ATOM 9263 C116 OL 279 31.339 8.180 39.875 1.00 0.00 C ATOM 9264 H16R OL 279 30.361 8.646 39.732 1.00 0.00 H ATOM 9265 H16S OL 279 31.937 8.526 39.029 1.00 0.00 H ATOM 9266 C117 OL 279 31.207 6.635 39.708 1.00 0.00 C ATOM 9267 H17R OL 279 32.053 6.223 40.262 1.00 0.00 H ATOM 9268 H17S OL 279 30.271 6.373 40.204 1.00 0.00 H ATOM 9269 C118 OL 279 31.142 6.004 38.307 1.00 0.00 C ATOM 9270 H18R OL 279 30.217 6.338 37.831 1.00 0.00 H ATOM 9271 H18S OL 279 31.180 4.913 38.335 1.00 0.00 H ATOM 9272 H18T OL 279 32.023 6.288 37.729 1.00 0.00 H TER 9273 OL 279 ATOM 9273 C116 PA 280 123.029 51.389 39.630 1.00 0.00 C ATOM 9274 H16R PA 280 122.554 52.371 39.677 1.00 0.00 H ATOM 9275 H16S PA 280 123.488 51.434 38.640 1.00 0.00 H ATOM 9276 H16T PA 280 123.918 51.248 40.248 1.00 0.00 H ATOM 9277 C115 PA 280 122.010 50.238 39.782 1.00 0.00 C ATOM 9278 H15R PA 280 122.387 49.280 39.420 1.00 0.00 H ATOM 9279 H15S PA 280 121.166 50.380 39.104 1.00 0.00 H ATOM 9280 C114 PA 280 121.432 50.152 41.185 1.00 0.00 C ATOM 9281 H14R PA 280 120.671 49.370 41.226 1.00 0.00 H ATOM 9282 H14S PA 280 121.038 51.139 41.434 1.00 0.00 H ATOM 9283 C113 PA 280 122.310 49.914 42.422 1.00 0.00 C ATOM 9284 H13R PA 280 122.913 50.816 42.545 1.00 0.00 H ATOM 9285 H13S PA 280 122.814 48.948 42.353 1.00 0.00 H ATOM 9286 C112 PA 280 121.454 49.755 43.674 1.00 0.00 C ATOM 9287 H12R PA 280 120.659 49.019 43.541 1.00 0.00 H ATOM 9288 H12S PA 280 120.988 50.726 43.853 1.00 0.00 H ATOM 9289 C111 PA 280 122.209 49.456 44.974 1.00 0.00 C ATOM 9290 H11R PA 280 123.026 50.173 45.079 1.00 0.00 H ATOM 9291 H11S PA 280 122.762 48.538 44.764 1.00 0.00 H ATOM 9292 C110 PA 280 121.385 49.215 46.298 1.00 0.00 C ATOM 9293 H10R PA 280 121.948 48.461 46.852 1.00 0.00 H ATOM 9294 H10S PA 280 120.449 48.677 46.133 1.00 0.00 H ATOM 9295 C19 PA 280 121.363 50.369 47.271 1.00 0.00 C ATOM 9296 H9R PA 280 120.700 51.162 46.918 1.00 0.00 H ATOM 9297 H9S PA 280 122.330 50.837 47.470 1.00 0.00 H ATOM 9298 C18 PA 280 120.966 50.061 48.689 1.00 0.00 C ATOM 9299 H8R PA 280 121.525 49.277 49.204 1.00 0.00 H ATOM 9300 H8S PA 280 120.033 49.501 48.598 1.00 0.00 H ATOM 9301 C17 PA 280 120.619 51.200 49.623 1.00 0.00 C ATOM 9302 H7R PA 280 121.471 51.588 50.184 1.00 0.00 H ATOM 9303 H7S PA 280 119.961 50.760 50.375 1.00 0.00 H ATOM 9304 C16 PA 280 120.054 52.484 48.961 1.00 0.00 C ATOM 9305 H6R PA 280 119.189 52.123 48.400 1.00 0.00 H ATOM 9306 H6S PA 280 120.654 52.991 48.203 1.00 0.00 H ATOM 9307 C15 PA 280 119.831 53.673 49.912 1.00 0.00 C ATOM 9308 H5R PA 280 119.890 54.645 49.419 1.00 0.00 H ATOM 9309 H5S PA 280 120.591 53.888 50.665 1.00 0.00 H ATOM 9310 C14 PA 280 118.457 53.584 50.546 1.00 0.00 C ATOM 9311 H4R PA 280 117.695 53.324 49.808 1.00 0.00 H ATOM 9312 H4S PA 280 118.307 54.620 50.853 1.00 0.00 H ATOM 9313 C13 PA 280 118.418 52.757 51.844 1.00 0.00 C ATOM 9314 H3R PA 280 119.342 52.737 52.425 1.00 0.00 H ATOM 9315 H3S PA 280 118.218 51.765 51.434 1.00 0.00 H ATOM 9316 C12 PA 280 117.184 53.159 52.721 1.00 0.00 C ATOM 9317 H2R PA 280 117.097 54.217 52.980 1.00 0.00 H ATOM 9318 H2S PA 280 116.164 52.870 52.457 1.00 0.00 H ATOM 9319 C11 PGR 281 117.502 52.536 54.111 1.00 0.00 C ATOM 9320 O12 PGR 281 118.480 52.758 54.809 1.00 0.00 O ATOM 9321 O11 PGR 281 116.515 51.617 54.425 1.00 0.00 O ATOM 9322 C1 PGR 281 116.652 50.568 55.398 1.00 0.00 C ATOM 9323 HR PGR 281 117.682 50.205 55.408 1.00 0.00 H ATOM 9324 HS PGR 281 115.941 49.753 55.240 1.00 0.00 H ATOM 9325 C2 PGR 281 116.392 50.952 56.884 1.00 0.00 C ATOM 9326 HX PGR 281 116.963 51.836 57.180 1.00 0.00 H ATOM 9327 C3 PGR 281 116.655 49.801 57.837 1.00 0.00 C ATOM 9328 HA PGR 281 117.657 49.411 57.639 1.00 0.00 H ATOM 9329 HB PGR 281 116.061 48.930 57.548 1.00 0.00 H ATOM 9330 O31 PGR 281 116.499 50.065 59.192 1.00 0.00 O ATOM 9331 P31 PGR 281 117.645 50.740 60.022 1.00 0.00 P ATOM 9332 O32 PGR 281 117.479 52.246 59.811 1.00 0.00 O ATOM 9333 C31 PGR 281 116.305 52.952 60.123 1.00 0.00 C ATOM 9334 H1A PGR 281 116.118 52.700 61.171 1.00 0.00 H ATOM 9335 H1B PGR 281 115.544 52.507 59.478 1.00 0.00 H ATOM 9336 C32 PGR 281 116.466 54.441 59.799 1.00 0.00 C ATOM 9337 H2A PGR 281 116.852 54.596 58.789 1.00 0.00 H ATOM 9338 O35 PGR 281 117.494 54.943 60.578 1.00 0.00 O ATOM 9339 HO5A PGR 281 118.209 54.347 60.291 1.00 0.00 H ATOM 9340 C33 PGR 281 115.143 55.187 60.063 1.00 0.00 C ATOM 9341 H3A PGR 281 114.465 54.904 59.254 1.00 0.00 H ATOM 9342 H3B PGR 281 114.626 54.856 60.968 1.00 0.00 H ATOM 9343 O33 PGR 281 117.421 50.445 61.461 1.00 0.00 O ATOM 9344 O34 PGR 281 118.905 50.267 59.457 1.00 0.00 O ATOM 9345 O21 PGR 281 114.955 51.262 56.976 1.00 0.00 O ATOM 9346 C21 PGR 281 114.642 52.557 56.874 1.00 0.00 C ATOM 9347 O22 PGR 281 115.448 53.436 56.946 1.00 0.00 O ATOM 9348 O36 PGR 281 115.401 56.579 60.053 1.00 0.00 O ATOM 9349 HO6A PGR 281 115.804 56.765 59.186 1.00 0.00 H ATOM 9350 C12 OL 282 113.211 52.792 56.754 1.00 0.00 C ATOM 9351 H2R OL 282 112.726 52.165 57.505 1.00 0.00 H ATOM 9352 H2S OL 282 112.909 53.789 57.084 1.00 0.00 H ATOM 9353 C13 OL 282 112.761 52.409 55.231 1.00 0.00 C ATOM 9354 H3R OL 282 112.995 51.362 55.028 1.00 0.00 H ATOM 9355 H3S OL 282 111.687 52.563 55.348 1.00 0.00 H ATOM 9356 C14 OL 282 113.179 53.400 54.117 1.00 0.00 C ATOM 9357 H4R OL 282 112.326 54.077 54.034 1.00 0.00 H ATOM 9358 H4S OL 282 114.045 53.976 54.450 1.00 0.00 H ATOM 9359 C15 OL 282 113.368 52.797 52.819 1.00 0.00 C ATOM 9360 H5R OL 282 114.244 52.153 52.920 1.00 0.00 H ATOM 9361 H5S OL 282 112.554 52.086 52.664 1.00 0.00 H ATOM 9362 C16 OL 282 113.475 53.801 51.707 1.00 0.00 C ATOM 9363 H6R OL 282 112.505 54.273 51.534 1.00 0.00 H ATOM 9364 H6S OL 282 114.152 54.635 51.902 1.00 0.00 H ATOM 9365 C17 OL 282 113.751 53.266 50.311 1.00 0.00 C ATOM 9366 H7R OL 282 114.792 52.991 50.130 1.00 0.00 H ATOM 9367 H7S OL 282 113.266 52.318 50.071 1.00 0.00 H ATOM 9368 C18 OL 282 113.553 54.262 49.178 1.00 0.00 C ATOM 9369 H8R OL 282 112.597 54.772 49.317 1.00 0.00 H ATOM 9370 H8S OL 282 114.326 55.031 49.237 1.00 0.00 H ATOM 9371 C19 OL 282 113.738 53.804 47.826 1.00 0.00 C ATOM 9372 H9R OL 282 112.855 53.353 47.381 1.00 0.00 H ATOM 9373 C110 OL 282 114.858 53.835 47.106 1.00 0.00 C ATOM 9374 H10R OL 282 114.707 53.490 46.086 1.00 0.00 H ATOM 9375 C111 OL 282 116.227 54.188 47.504 1.00 0.00 C ATOM 9376 H11R OL 282 116.210 54.687 48.475 1.00 0.00 H ATOM 9377 H11S OL 282 116.834 53.283 47.569 1.00 0.00 H ATOM 9378 C112 OL 282 116.676 55.220 46.605 1.00 0.00 C ATOM 9379 H12R OL 282 116.195 55.140 45.628 1.00 0.00 H ATOM 9380 H12S OL 282 116.293 56.188 46.933 1.00 0.00 H ATOM 9381 C113 OL 282 118.162 55.388 46.481 1.00 0.00 C ATOM 9382 H13R OL 282 118.457 56.327 46.009 1.00 0.00 H ATOM 9383 H13S OL 282 118.519 55.465 47.510 1.00 0.00 H ATOM 9384 C114 OL 282 118.784 54.247 45.832 1.00 0.00 C ATOM 9385 H14R OL 282 119.014 53.462 46.556 1.00 0.00 H ATOM 9386 H14S OL 282 118.082 53.821 45.112 1.00 0.00 H ATOM 9387 C115 OL 282 120.102 54.669 45.069 1.00 0.00 C ATOM 9388 H15R OL 282 119.741 55.266 44.229 1.00 0.00 H ATOM 9389 H15S OL 282 120.815 55.219 45.687 1.00 0.00 H ATOM 9390 C116 OL 282 120.894 53.576 44.454 1.00 0.00 C ATOM 9391 H16R OL 282 121.104 52.844 45.237 1.00 0.00 H ATOM 9392 H16S OL 282 120.340 53.095 43.646 1.00 0.00 H ATOM 9393 C117 OL 282 122.218 54.070 43.875 1.00 0.00 C ATOM 9394 H17R OL 282 122.362 53.543 42.930 1.00 0.00 H ATOM 9395 H17S OL 282 122.193 55.128 43.604 1.00 0.00 H ATOM 9396 C118 OL 282 123.499 53.807 44.826 1.00 0.00 C ATOM 9397 H18R OL 282 123.436 52.819 45.286 1.00 0.00 H ATOM 9398 H18S OL 282 123.495 54.502 45.669 1.00 0.00 H ATOM 9399 H18T OL 282 124.481 53.844 44.349 1.00 0.00 H TER 9400 OL 282 ATOM 9400 C116 PA 283 47.358 55.428 41.486 1.00 0.00 C ATOM 9401 H16R PA 283 47.219 56.054 40.602 1.00 0.00 H ATOM 9402 H16S PA 283 46.528 54.723 41.566 1.00 0.00 H ATOM 9403 H16T PA 283 48.287 54.882 41.305 1.00 0.00 H ATOM 9404 C115 PA 283 47.591 56.230 42.785 1.00 0.00 C ATOM 9405 H15R PA 283 46.973 57.114 42.613 1.00 0.00 H ATOM 9406 H15S PA 283 48.634 56.526 42.653 1.00 0.00 H ATOM 9407 C114 PA 283 47.278 55.498 44.020 1.00 0.00 C ATOM 9408 H14R PA 283 47.437 56.139 44.889 1.00 0.00 H ATOM 9409 H14S PA 283 47.885 54.592 44.072 1.00 0.00 H ATOM 9410 C113 PA 283 45.784 54.924 44.179 1.00 0.00 C ATOM 9411 H13R PA 283 45.685 54.011 43.588 1.00 0.00 H ATOM 9412 H13S PA 283 44.984 55.568 43.808 1.00 0.00 H ATOM 9413 C112 PA 283 45.579 54.554 45.645 1.00 0.00 C ATOM 9414 H12R PA 283 45.546 55.460 46.253 1.00 0.00 H ATOM 9415 H12S PA 283 46.426 53.978 46.024 1.00 0.00 H ATOM 9416 C111 PA 283 44.430 53.689 45.938 1.00 0.00 C ATOM 9417 H11R PA 283 44.356 53.642 47.026 1.00 0.00 H ATOM 9418 H11S PA 283 44.698 52.711 45.532 1.00 0.00 H ATOM 9419 C110 PA 283 43.130 54.267 45.366 1.00 0.00 C ATOM 9420 H10R PA 283 43.408 54.455 44.327 1.00 0.00 H ATOM 9421 H10S PA 283 42.897 55.201 45.881 1.00 0.00 H ATOM 9422 C19 PA 283 41.931 53.279 45.443 1.00 0.00 C ATOM 9423 H9R PA 283 42.089 52.290 45.008 1.00 0.00 H ATOM 9424 H9S PA 283 41.193 53.724 44.772 1.00 0.00 H ATOM 9425 C18 PA 283 41.358 53.140 46.833 1.00 0.00 C ATOM 9426 H8R PA 283 40.640 53.950 46.979 1.00 0.00 H ATOM 9427 H8S PA 283 42.090 53.353 47.616 1.00 0.00 H ATOM 9428 C17 PA 283 40.672 51.856 47.062 1.00 0.00 C ATOM 9429 H7R PA 283 41.405 51.047 47.042 1.00 0.00 H ATOM 9430 H7S PA 283 40.040 51.706 46.184 1.00 0.00 H ATOM 9431 C16 PA 283 39.778 51.744 48.349 1.00 0.00 C ATOM 9432 H6R PA 283 39.150 50.877 48.132 1.00 0.00 H ATOM 9433 H6S PA 283 39.218 52.677 48.430 1.00 0.00 H ATOM 9434 C15 PA 283 40.615 51.474 49.600 1.00 0.00 C ATOM 9435 H5R PA 283 40.900 52.455 49.988 1.00 0.00 H ATOM 9436 H5S PA 283 41.581 51.079 49.278 1.00 0.00 H ATOM 9437 C14 PA 283 39.957 50.558 50.639 1.00 0.00 C ATOM 9438 H4R PA 283 40.044 49.532 50.276 1.00 0.00 H ATOM 9439 H4S PA 283 38.896 50.816 50.656 1.00 0.00 H ATOM 9440 C13 PA 283 40.398 50.534 52.089 1.00 0.00 C ATOM 9441 H3R PA 283 41.179 49.771 52.090 1.00 0.00 H ATOM 9442 H3S PA 283 39.596 50.137 52.715 1.00 0.00 H ATOM 9443 C12 PA 283 40.920 51.834 52.710 1.00 0.00 C ATOM 9444 H2R PA 283 40.277 52.675 52.444 1.00 0.00 H ATOM 9445 H2S PA 283 41.805 52.137 52.147 1.00 0.00 H ATOM 9446 C11 PGR 284 41.128 51.950 54.162 1.00 0.00 C ATOM 9447 O12 PGR 284 42.132 52.572 54.568 1.00 0.00 O ATOM 9448 O11 PGR 284 40.149 51.366 54.848 1.00 0.00 O ATOM 9449 C1 PGR 284 40.208 51.654 56.257 1.00 0.00 C ATOM 9450 HR PGR 284 41.250 51.688 56.586 1.00 0.00 H ATOM 9451 HS PGR 284 39.565 50.946 56.786 1.00 0.00 H ATOM 9452 C2 PGR 284 39.686 53.095 56.494 1.00 0.00 C ATOM 9453 HX PGR 284 40.016 53.842 55.767 1.00 0.00 H ATOM 9454 C3 PGR 284 39.957 53.564 57.946 1.00 0.00 C ATOM 9455 HA PGR 284 39.638 54.599 58.092 1.00 0.00 H ATOM 9456 HB PGR 284 41.049 53.555 57.992 1.00 0.00 H ATOM 9457 O31 PGR 284 39.345 52.572 58.901 1.00 0.00 O ATOM 9458 P31 PGR 284 38.886 52.885 60.378 1.00 0.00 P ATOM 9459 O32 PGR 284 37.605 53.803 60.213 1.00 0.00 O ATOM 9460 C31 PGR 284 36.595 53.474 59.292 1.00 0.00 C ATOM 9461 H1A PGR 284 36.871 53.897 58.322 1.00 0.00 H ATOM 9462 H1B PGR 284 35.824 54.225 59.481 1.00 0.00 H ATOM 9463 C32 PGR 284 35.767 52.167 59.395 1.00 0.00 C ATOM 9464 H2A PGR 284 35.073 52.272 60.233 1.00 0.00 H ATOM 9465 O35 PGR 284 36.598 50.941 59.412 1.00 0.00 O ATOM 9466 HO5A PGR 284 37.412 51.237 59.859 1.00 0.00 H ATOM 9467 C33 PGR 284 34.887 51.921 58.176 1.00 0.00 C ATOM 9468 H3A PGR 284 34.240 52.760 57.907 1.00 0.00 H ATOM 9469 H3B PGR 284 35.553 51.712 57.335 1.00 0.00 H ATOM 9470 O33 PGR 284 38.543 51.618 61.048 1.00 0.00 O ATOM 9471 O34 PGR 284 39.905 53.707 61.073 1.00 0.00 O ATOM 9472 O21 PGR 284 38.238 53.093 56.293 1.00 0.00 O ATOM 9473 C21 PGR 284 37.869 53.172 55.009 1.00 0.00 C ATOM 9474 O22 PGR 284 38.598 53.486 54.031 1.00 0.00 O ATOM 9475 O36 PGR 284 34.009 50.804 58.436 1.00 0.00 O ATOM 9476 HO6A PGR 284 33.541 50.546 57.622 1.00 0.00 H ATOM 9477 C12 OL 285 36.426 52.981 54.767 1.00 0.00 C ATOM 9478 H2R OL 285 35.991 52.763 55.745 1.00 0.00 H ATOM 9479 H2S OL 285 35.826 53.812 54.390 1.00 0.00 H ATOM 9480 C13 OL 285 36.105 51.695 53.939 1.00 0.00 C ATOM 9481 H3R OL 285 36.444 50.831 54.514 1.00 0.00 H ATOM 9482 H3S OL 285 35.019 51.580 53.960 1.00 0.00 H ATOM 9483 C14 OL 285 36.553 51.632 52.469 1.00 0.00 C ATOM 9484 H4R OL 285 37.644 51.601 52.483 1.00 0.00 H ATOM 9485 H4S OL 285 36.412 50.625 52.070 1.00 0.00 H ATOM 9486 C15 OL 285 35.973 52.681 51.571 1.00 0.00 C ATOM 9487 H5R OL 285 34.893 52.754 51.710 1.00 0.00 H ATOM 9488 H5S OL 285 36.290 53.685 51.860 1.00 0.00 H ATOM 9489 C16 OL 285 36.395 52.557 50.119 1.00 0.00 C ATOM 9490 H6R OL 285 37.485 52.572 50.063 1.00 0.00 H ATOM 9491 H6S OL 285 36.129 51.581 49.708 1.00 0.00 H ATOM 9492 C17 OL 285 35.832 53.688 49.213 1.00 0.00 C ATOM 9493 H7R OL 285 36.277 53.716 48.217 1.00 0.00 H ATOM 9494 H7S OL 285 34.754 53.520 49.168 1.00 0.00 H ATOM 9495 C18 OL 285 35.958 55.097 49.746 1.00 0.00 C ATOM 9496 H8R OL 285 35.352 55.229 50.645 1.00 0.00 H ATOM 9497 H8S OL 285 37.007 55.066 50.047 1.00 0.00 H ATOM 9498 C19 OL 285 35.633 56.187 48.794 1.00 0.00 C ATOM 9499 H9R OL 285 34.766 56.825 48.943 1.00 0.00 H ATOM 9500 C110 OL 285 36.327 56.477 47.714 1.00 0.00 C ATOM 9501 H10R OL 285 35.889 57.190 47.020 1.00 0.00 H ATOM 9502 C111 OL 285 37.602 55.778 47.214 1.00 0.00 C ATOM 9503 H11R OL 285 38.498 56.383 47.368 1.00 0.00 H ATOM 9504 H11S OL 285 37.713 54.872 47.813 1.00 0.00 H ATOM 9505 C112 OL 285 37.399 55.413 45.774 1.00 0.00 C ATOM 9506 H12R OL 285 37.249 56.337 45.211 1.00 0.00 H ATOM 9507 H12S OL 285 38.367 55.110 45.370 1.00 0.00 H ATOM 9508 C113 OL 285 36.281 54.416 45.304 1.00 0.00 C ATOM 9509 H13R OL 285 36.184 53.491 45.876 1.00 0.00 H ATOM 9510 H13S OL 285 35.329 54.919 45.485 1.00 0.00 H ATOM 9511 C114 OL 285 36.443 54.138 43.819 1.00 0.00 C ATOM 9512 H14R OL 285 36.659 55.034 43.233 1.00 0.00 H ATOM 9513 H14S OL 285 37.339 53.517 43.744 1.00 0.00 H ATOM 9514 C115 OL 285 35.374 53.252 43.298 1.00 0.00 C ATOM 9515 H15R OL 285 35.146 52.460 44.014 1.00 0.00 H ATOM 9516 H15S OL 285 34.411 53.764 43.247 1.00 0.00 H ATOM 9517 C116 OL 285 35.491 52.840 41.875 1.00 0.00 C ATOM 9518 H16R OL 285 35.484 53.732 41.245 1.00 0.00 H ATOM 9519 H16S OL 285 36.367 52.251 41.597 1.00 0.00 H ATOM 9520 C117 OL 285 34.362 51.882 41.416 1.00 0.00 C ATOM 9521 H17R OL 285 34.780 51.574 40.455 1.00 0.00 H ATOM 9522 H17S OL 285 34.472 51.048 42.113 1.00 0.00 H ATOM 9523 C118 OL 285 32.920 52.318 41.394 1.00 0.00 C ATOM 9524 H18R OL 285 32.853 53.139 40.677 1.00 0.00 H ATOM 9525 H18S OL 285 32.597 52.559 42.409 1.00 0.00 H ATOM 9526 H18T OL 285 32.194 51.594 41.019 1.00 0.00 H TER 9527 OL 285 ATOM 9527 C116 PA 286 32.808 43.240 39.843 1.00 0.00 C ATOM 9528 H16R PA 286 31.840 43.723 39.694 1.00 0.00 H ATOM 9529 H16S PA 286 32.977 42.493 39.064 1.00 0.00 H ATOM 9530 H16T PA 286 33.536 44.014 39.589 1.00 0.00 H ATOM 9531 C115 PA 286 33.032 42.776 41.206 1.00 0.00 C ATOM 9532 H15R PA 286 34.047 42.457 41.452 1.00 0.00 H ATOM 9533 H15S PA 286 32.440 41.880 41.405 1.00 0.00 H ATOM 9534 C114 PA 286 32.577 43.769 42.242 1.00 0.00 C ATOM 9535 H14R PA 286 32.618 43.302 43.229 1.00 0.00 H ATOM 9536 H14S PA 286 31.499 43.899 42.135 1.00 0.00 H ATOM 9537 C113 PA 286 33.445 45.019 42.262 1.00 0.00 C ATOM 9538 H13R PA 286 33.638 45.362 41.244 1.00 0.00 H ATOM 9539 H13S PA 286 34.451 44.748 42.588 1.00 0.00 H ATOM 9540 C112 PA 286 32.825 46.089 43.108 1.00 0.00 C ATOM 9541 H12R PA 286 31.737 46.004 43.148 1.00 0.00 H ATOM 9542 H12S PA 286 32.973 47.019 42.554 1.00 0.00 H ATOM 9543 C111 PA 286 33.465 46.321 44.474 1.00 0.00 C ATOM 9544 H11R PA 286 33.142 47.295 44.847 1.00 0.00 H ATOM 9545 H11S PA 286 34.557 46.332 44.457 1.00 0.00 H ATOM 9546 C110 PA 286 33.038 45.281 45.586 1.00 0.00 C ATOM 9547 H10R PA 286 33.158 44.266 45.199 1.00 0.00 H ATOM 9548 H10S PA 286 31.954 45.367 45.687 1.00 0.00 H ATOM 9549 C19 PA 286 33.799 45.243 46.853 1.00 0.00 C ATOM 9550 H9R PA 286 34.832 44.979 46.615 1.00 0.00 H ATOM 9551 H9S PA 286 33.351 44.479 47.491 1.00 0.00 H ATOM 9552 C18 PA 286 33.905 46.519 47.698 1.00 0.00 C ATOM 9553 H8R PA 286 32.890 46.754 48.025 1.00 0.00 H ATOM 9554 H8S PA 286 34.392 47.278 47.082 1.00 0.00 H ATOM 9555 C17 PA 286 34.764 46.336 48.928 1.00 0.00 C ATOM 9556 H7R PA 286 35.786 46.027 48.699 1.00 0.00 H ATOM 9557 H7S PA 286 34.500 45.398 49.421 1.00 0.00 H ATOM 9558 C16 PA 286 34.771 47.524 49.921 1.00 0.00 C ATOM 9559 H6R PA 286 33.739 47.692 50.238 1.00 0.00 H ATOM 9560 H6S PA 286 35.094 48.511 49.585 1.00 0.00 H ATOM 9561 C15 PA 286 35.762 47.339 51.073 1.00 0.00 C ATOM 9562 H5R PA 286 35.445 46.374 51.475 1.00 0.00 H ATOM 9563 H5S PA 286 35.572 48.025 51.901 1.00 0.00 H ATOM 9564 C14 PA 286 37.294 47.564 50.683 1.00 0.00 C ATOM 9565 H4R PA 286 37.380 48.558 50.239 1.00 0.00 H ATOM 9566 H4S PA 286 37.733 46.881 49.953 1.00 0.00 H ATOM 9567 C13 PA 286 38.184 47.380 51.994 1.00 0.00 C ATOM 9568 H3R PA 286 38.020 48.138 52.763 1.00 0.00 H ATOM 9569 H3S PA 286 39.186 47.589 51.612 1.00 0.00 H ATOM 9570 C12 PA 286 38.079 46.096 52.643 1.00 0.00 C ATOM 9571 H2R PA 286 38.352 45.300 51.947 1.00 0.00 H ATOM 9572 H2S PA 286 37.101 45.857 53.067 1.00 0.00 H ATOM 9573 C11 PGR 287 38.933 45.974 53.799 1.00 0.00 C ATOM 9574 O12 PGR 287 38.988 46.862 54.610 1.00 0.00 O ATOM 9575 O11 PGR 287 39.668 44.841 53.928 1.00 0.00 O ATOM 9576 C1 PGR 287 40.258 44.504 55.234 1.00 0.00 C ATOM 9577 HR PGR 287 39.664 44.888 56.067 1.00 0.00 H ATOM 9578 HS PGR 287 41.237 44.986 55.282 1.00 0.00 H ATOM 9579 C2 PGR 287 40.444 43.014 55.364 1.00 0.00 C ATOM 9580 HX PGR 287 39.541 42.506 55.014 1.00 0.00 H ATOM 9581 C3 PGR 287 40.850 42.714 56.837 1.00 0.00 C ATOM 9582 HA PGR 287 40.402 43.334 57.618 1.00 0.00 H ATOM 9583 HB PGR 287 41.867 43.026 57.089 1.00 0.00 H ATOM 9584 O31 PGR 287 40.594 41.319 57.181 1.00 0.00 O ATOM 9585 P31 PGR 287 41.089 40.748 58.582 1.00 0.00 P ATOM 9586 O32 PGR 287 42.652 40.463 58.341 1.00 0.00 O ATOM 9587 C31 PGR 287 43.464 40.100 59.369 1.00 0.00 C ATOM 9588 H1A PGR 287 44.363 39.651 58.939 1.00 0.00 H ATOM 9589 H1B PGR 287 42.888 39.434 60.017 1.00 0.00 H ATOM 9590 C32 PGR 287 44.002 41.249 60.279 1.00 0.00 C ATOM 9591 H2A PGR 287 43.192 41.504 60.967 1.00 0.00 H ATOM 9592 O35 PGR 287 44.351 42.363 59.543 1.00 0.00 O ATOM 9593 HO5A PGR 287 43.506 42.629 59.137 1.00 0.00 H ATOM 9594 C33 PGR 287 45.171 40.780 61.106 1.00 0.00 C ATOM 9595 H3A PGR 287 44.811 39.888 61.624 1.00 0.00 H ATOM 9596 H3B PGR 287 46.059 40.536 60.516 1.00 0.00 H ATOM 9597 O33 PGR 287 40.908 41.756 59.626 1.00 0.00 O ATOM 9598 O34 PGR 287 40.496 39.383 58.738 1.00 0.00 O ATOM 9599 O21 PGR 287 41.557 42.752 54.609 1.00 0.00 O ATOM 9600 C21 PGR 287 41.616 41.528 54.046 1.00 0.00 C ATOM 9601 O22 PGR 287 40.860 40.606 54.262 1.00 0.00 O ATOM 9602 O36 PGR 287 45.344 41.820 62.074 1.00 0.00 O ATOM 9603 HO6A PGR 287 46.053 41.604 62.705 1.00 0.00 H ATOM 9604 C12 OL 288 42.732 41.461 52.988 1.00 0.00 C ATOM 9605 H2R OL 288 43.609 42.031 53.302 1.00 0.00 H ATOM 9606 H2S OL 288 43.068 40.424 52.925 1.00 0.00 H ATOM 9607 C13 OL 288 42.202 41.913 51.628 1.00 0.00 C ATOM 9608 H3R OL 288 41.231 41.450 51.443 1.00 0.00 H ATOM 9609 H3S OL 288 41.834 42.930 51.780 1.00 0.00 H ATOM 9610 C14 OL 288 43.236 41.736 50.562 1.00 0.00 C ATOM 9611 H4R OL 288 44.051 42.378 50.905 1.00 0.00 H ATOM 9612 H4S OL 288 43.616 40.714 50.615 1.00 0.00 H ATOM 9613 C15 OL 288 42.758 42.262 49.251 1.00 0.00 C ATOM 9614 H5R OL 288 41.714 42.032 49.029 1.00 0.00 H ATOM 9615 H5S OL 288 42.610 43.344 49.255 1.00 0.00 H ATOM 9616 C16 OL 288 43.603 41.912 48.075 1.00 0.00 C ATOM 9617 H6R OL 288 44.578 42.403 48.074 1.00 0.00 H ATOM 9618 H6S OL 288 43.814 40.844 48.158 1.00 0.00 H ATOM 9619 C17 OL 288 42.944 42.321 46.764 1.00 0.00 C ATOM 9620 H7R OL 288 43.336 41.781 45.900 1.00 0.00 H ATOM 9621 H7S OL 288 41.928 41.939 46.640 1.00 0.00 H ATOM 9622 C18 OL 288 42.946 43.813 46.385 1.00 0.00 C ATOM 9623 H8R OL 288 42.498 43.803 45.389 1.00 0.00 H ATOM 9624 H8S OL 288 42.235 44.436 46.932 1.00 0.00 H ATOM 9625 C19 OL 288 44.334 44.416 46.371 1.00 0.00 C ATOM 9626 H9R OL 288 44.667 44.884 47.294 1.00 0.00 H ATOM 9627 C110 OL 288 45.177 44.508 45.331 1.00 0.00 C ATOM 9628 H10R OL 288 46.137 45.014 45.387 1.00 0.00 H ATOM 9629 C111 OL 288 44.916 44.151 43.908 1.00 0.00 C ATOM 9630 H11R OL 288 45.733 43.497 43.595 1.00 0.00 H ATOM 9631 H11S OL 288 43.930 43.725 43.713 1.00 0.00 H ATOM 9632 C112 OL 288 45.091 45.380 43.044 1.00 0.00 C ATOM 9633 H12R OL 288 44.138 45.905 43.135 1.00 0.00 H ATOM 9634 H12S OL 288 45.750 46.060 43.588 1.00 0.00 H ATOM 9635 C113 OL 288 45.574 45.183 41.603 1.00 0.00 C ATOM 9636 H13R OL 288 46.367 44.435 41.677 1.00 0.00 H ATOM 9637 H13S OL 288 44.647 44.867 41.121 1.00 0.00 H ATOM 9638 C114 OL 288 46.108 46.494 41.075 1.00 0.00 C ATOM 9639 H14R OL 288 45.310 47.240 41.076 1.00 0.00 H ATOM 9640 H14S OL 288 46.887 46.925 41.708 1.00 0.00 H ATOM 9641 C115 OL 288 46.751 46.355 39.692 1.00 0.00 C ATOM 9642 H15R OL 288 47.534 45.596 39.728 1.00 0.00 H ATOM 9643 H15S OL 288 45.972 45.871 39.099 1.00 0.00 H ATOM 9644 C116 OL 288 47.193 47.658 39.131 1.00 0.00 C ATOM 9645 H16R OL 288 47.604 48.279 39.930 1.00 0.00 H ATOM 9646 H16S OL 288 47.910 47.486 38.326 1.00 0.00 H ATOM 9647 C117 OL 288 46.032 48.365 38.412 1.00 0.00 C ATOM 9648 H17R OL 288 45.528 47.624 37.789 1.00 0.00 H ATOM 9649 H17S OL 288 45.267 48.741 39.094 1.00 0.00 H ATOM 9650 C118 OL 288 46.568 49.415 37.471 1.00 0.00 C ATOM 9651 H18R OL 288 45.831 50.016 36.934 1.00 0.00 H ATOM 9652 H18S OL 288 47.088 49.145 36.550 1.00 0.00 H ATOM 9653 H18T OL 288 47.291 50.128 37.875 1.00 0.00 H TER 9654 OL 288 ATOM 9654 C116 PA 289 16.263 62.758 35.347 1.00 0.00 C ATOM 9655 H16R PA 289 16.649 61.741 35.255 1.00 0.00 H ATOM 9656 H16S PA 289 16.672 63.311 34.499 1.00 0.00 H ATOM 9657 H16T PA 289 15.211 62.557 35.133 1.00 0.00 H ATOM 9658 C115 PA 289 16.284 63.507 36.627 1.00 0.00 C ATOM 9659 H15R PA 289 15.710 64.416 36.438 1.00 0.00 H ATOM 9660 H15S PA 289 17.322 63.788 36.818 1.00 0.00 H ATOM 9661 C114 PA 289 15.776 62.692 37.772 1.00 0.00 C ATOM 9662 H14R PA 289 16.273 61.732 37.924 1.00 0.00 H ATOM 9663 H14S PA 289 14.751 62.352 37.611 1.00 0.00 H ATOM 9664 C113 PA 289 15.747 63.362 39.139 1.00 0.00 C ATOM 9665 H13R PA 289 15.276 64.341 39.032 1.00 0.00 H ATOM 9666 H13S PA 289 16.765 63.522 39.500 1.00 0.00 H ATOM 9667 C112 PA 289 15.080 62.620 40.280 1.00 0.00 C ATOM 9668 H12R PA 289 14.056 62.377 39.988 1.00 0.00 H ATOM 9669 H12S PA 289 15.120 63.268 41.158 1.00 0.00 H ATOM 9670 C111 PA 289 15.683 61.278 40.654 1.00 0.00 C ATOM 9671 H11R PA 289 15.428 60.469 39.966 1.00 0.00 H ATOM 9672 H11S PA 289 15.239 61.028 41.620 1.00 0.00 H ATOM 9673 C110 PA 289 17.176 61.323 40.871 1.00 0.00 C ATOM 9674 H10R PA 289 17.699 61.411 39.916 1.00 0.00 H ATOM 9675 H10S PA 289 17.410 60.320 41.232 1.00 0.00 H ATOM 9676 C19 PA 289 17.677 62.345 41.966 1.00 0.00 C ATOM 9677 H9R PA 289 17.096 62.298 42.889 1.00 0.00 H ATOM 9678 H9S PA 289 17.617 63.389 41.652 1.00 0.00 H ATOM 9679 C18 PA 289 19.122 62.047 42.350 1.00 0.00 C ATOM 9680 H8R PA 289 19.886 62.012 41.570 1.00 0.00 H ATOM 9681 H8S PA 289 19.225 61.018 42.700 1.00 0.00 H ATOM 9682 C17 PA 289 19.637 62.923 43.541 1.00 0.00 C ATOM 9683 H7R PA 289 19.043 62.909 44.457 1.00 0.00 H ATOM 9684 H7S PA 289 19.753 63.968 43.248 1.00 0.00 H ATOM 9685 C16 PA 289 21.113 62.691 43.998 1.00 0.00 C ATOM 9686 H6R PA 289 21.733 62.918 43.128 1.00 0.00 H ATOM 9687 H6S PA 289 21.439 61.664 44.174 1.00 0.00 H ATOM 9688 C15 PA 289 21.603 63.582 45.124 1.00 0.00 C ATOM 9689 H5R PA 289 21.031 63.336 46.020 1.00 0.00 H ATOM 9690 H5S PA 289 21.370 64.590 44.774 1.00 0.00 H ATOM 9691 C14 PA 289 23.119 63.502 45.473 1.00 0.00 C ATOM 9692 H4R PA 289 23.644 63.874 44.591 1.00 0.00 H ATOM 9693 H4S PA 289 23.366 62.440 45.538 1.00 0.00 H ATOM 9694 C13 PA 289 23.580 64.049 46.853 1.00 0.00 C ATOM 9695 H3R PA 289 24.660 63.893 46.889 1.00 0.00 H ATOM 9696 H3S PA 289 23.068 63.430 47.594 1.00 0.00 H ATOM 9697 C12 PA 289 23.235 65.526 47.111 1.00 0.00 C ATOM 9698 H2R PA 289 22.248 65.783 46.722 1.00 0.00 H ATOM 9699 H2S PA 289 23.945 66.207 46.636 1.00 0.00 H ATOM 9700 C11 PGR 290 23.182 65.854 48.612 1.00 0.00 C ATOM 9701 O12 PGR 290 22.543 66.675 49.150 1.00 0.00 O ATOM 9702 O11 PGR 290 23.850 64.933 49.398 1.00 0.00 O ATOM 9703 C1 PGR 290 23.972 65.189 50.853 1.00 0.00 C ATOM 9704 HR PGR 290 24.353 66.213 50.850 1.00 0.00 H ATOM 9705 HS PGR 290 24.775 64.549 51.226 1.00 0.00 H ATOM 9706 C2 PGR 290 22.637 64.922 51.571 1.00 0.00 C ATOM 9707 HX PGR 290 21.815 65.631 51.444 1.00 0.00 H ATOM 9708 C3 PGR 290 22.884 64.836 53.082 1.00 0.00 C ATOM 9709 HA PGR 290 23.614 65.583 53.403 1.00 0.00 H ATOM 9710 HB PGR 290 23.260 63.832 53.294 1.00 0.00 H ATOM 9711 O31 PGR 290 21.677 65.054 53.837 1.00 0.00 O ATOM 9712 P31 PGR 290 21.679 64.911 55.353 1.00 0.00 P ATOM 9713 O32 PGR 290 20.171 64.595 55.765 1.00 0.00 O ATOM 9714 C31 PGR 290 19.597 63.472 55.227 1.00 0.00 C ATOM 9715 H1A PGR 290 20.113 62.580 55.593 1.00 0.00 H ATOM 9716 H1B PGR 290 19.562 63.523 54.136 1.00 0.00 H ATOM 9717 C32 PGR 290 18.178 63.291 55.690 1.00 0.00 C ATOM 9718 H2A PGR 290 17.673 64.256 55.781 1.00 0.00 H ATOM 9719 O35 PGR 290 18.174 62.618 56.973 1.00 0.00 O ATOM 9720 HO5A PGR 290 18.196 63.327 57.640 1.00 0.00 H ATOM 9721 C33 PGR 290 17.325 62.411 54.698 1.00 0.00 C ATOM 9722 H3A PGR 290 17.013 62.909 53.776 1.00 0.00 H ATOM 9723 H3B PGR 290 17.979 61.577 54.431 1.00 0.00 H ATOM 9724 O33 PGR 290 22.516 63.738 55.690 1.00 0.00 O ATOM 9725 O34 PGR 290 21.886 66.204 55.984 1.00 0.00 O ATOM 9726 O21 PGR 290 22.005 63.665 51.162 1.00 0.00 O ATOM 9727 C21 PGR 290 22.709 62.473 51.137 1.00 0.00 C ATOM 9728 O22 PGR 290 23.866 62.273 51.582 1.00 0.00 O ATOM 9729 O36 PGR 290 16.218 61.994 55.523 1.00 0.00 O ATOM 9730 HO6A PGR 290 16.577 62.012 56.428 1.00 0.00 H ATOM 9731 C12 OL 291 21.962 61.338 50.616 1.00 0.00 C ATOM 9732 H2R OL 291 22.551 60.557 50.130 1.00 0.00 H ATOM 9733 H2S OL 291 21.624 60.763 51.481 1.00 0.00 H ATOM 9734 C13 OL 291 20.898 61.880 49.603 1.00 0.00 C ATOM 9735 H3R OL 291 20.128 62.429 50.150 1.00 0.00 H ATOM 9736 H3S OL 291 21.291 62.651 48.937 1.00 0.00 H ATOM 9737 C14 OL 291 20.306 60.800 48.673 1.00 0.00 C ATOM 9738 H4R OL 291 19.602 60.161 49.210 1.00 0.00 H ATOM 9739 H4S OL 291 19.624 61.341 48.013 1.00 0.00 H ATOM 9740 C15 OL 291 21.330 59.982 47.802 1.00 0.00 C ATOM 9741 H5R OL 291 21.962 60.590 47.151 1.00 0.00 H ATOM 9742 H5S OL 291 22.030 59.344 48.345 1.00 0.00 H ATOM 9743 C16 OL 291 20.611 59.206 46.732 1.00 0.00 C ATOM 9744 H6R OL 291 20.212 58.322 47.232 1.00 0.00 H ATOM 9745 H6S OL 291 19.706 59.631 46.294 1.00 0.00 H ATOM 9746 C17 OL 291 21.507 58.514 45.609 1.00 0.00 C ATOM 9747 H7R OL 291 21.977 59.329 45.054 1.00 0.00 H ATOM 9748 H7S OL 291 22.336 58.015 46.114 1.00 0.00 H ATOM 9749 C18 OL 291 20.824 57.481 44.646 1.00 0.00 C ATOM 9750 H8R OL 291 21.532 56.819 44.144 1.00 0.00 H ATOM 9751 H8S OL 291 20.102 56.954 45.272 1.00 0.00 H ATOM 9752 C19 OL 291 20.060 58.136 43.564 1.00 0.00 C ATOM 9753 H9R OL 291 19.636 59.106 43.809 1.00 0.00 H ATOM 9754 C110 OL 291 19.954 57.808 42.331 1.00 0.00 C ATOM 9755 H10R OL 291 19.336 58.407 41.667 1.00 0.00 H ATOM 9756 C111 OL 291 20.577 56.587 41.768 1.00 0.00 C ATOM 9757 H11R OL 291 20.938 55.930 42.562 1.00 0.00 H ATOM 9758 H11S OL 291 19.715 56.045 41.375 1.00 0.00 H ATOM 9759 C112 OL 291 21.526 56.876 40.635 1.00 0.00 C ATOM 9760 H12R OL 291 21.110 57.743 40.118 1.00 0.00 H ATOM 9761 H12S OL 291 22.476 57.206 41.063 1.00 0.00 H ATOM 9762 C113 OL 291 21.842 55.652 39.919 1.00 0.00 C ATOM 9763 H13R OL 291 21.951 54.775 40.562 1.00 0.00 H ATOM 9764 H13S OL 291 20.992 55.364 39.297 1.00 0.00 H ATOM 9765 C114 OL 291 22.934 55.872 38.916 1.00 0.00 C ATOM 9766 H14R OL 291 23.837 56.181 39.447 1.00 0.00 H ATOM 9767 H14S OL 291 23.248 54.912 38.501 1.00 0.00 H ATOM 9768 C115 OL 291 22.501 56.821 37.804 1.00 0.00 C ATOM 9769 H15R OL 291 21.721 56.345 37.206 1.00 0.00 H ATOM 9770 H15S OL 291 22.118 57.755 38.221 1.00 0.00 H ATOM 9771 C116 OL 291 23.602 56.918 36.822 1.00 0.00 C ATOM 9772 H16R OL 291 24.512 57.261 37.317 1.00 0.00 H ATOM 9773 H16S OL 291 23.912 55.978 36.361 1.00 0.00 H ATOM 9774 C117 OL 291 23.145 57.938 35.779 1.00 0.00 C ATOM 9775 H17R OL 291 22.125 57.722 35.453 1.00 0.00 H ATOM 9776 H17S OL 291 23.091 58.919 36.255 1.00 0.00 H ATOM 9777 C118 OL 291 24.122 58.151 34.684 1.00 0.00 C ATOM 9778 H18R OL 291 23.847 58.876 33.916 1.00 0.00 H ATOM 9779 H18S OL 291 24.280 57.267 34.063 1.00 0.00 H ATOM 9780 H18T OL 291 25.013 58.621 35.105 1.00 0.00 H TER 9781 OL 291 ATOM 9781 C116 PA 292 102.842 52.222 45.702 1.00 0.00 C ATOM 9782 H16R PA 292 102.183 52.688 46.437 1.00 0.00 H ATOM 9783 H16S PA 292 103.014 53.005 44.961 1.00 0.00 H ATOM 9784 H16T PA 292 103.874 52.180 46.057 1.00 0.00 H ATOM 9785 C115 PA 292 102.170 51.024 45.150 1.00 0.00 C ATOM 9786 H15R PA 292 102.678 50.563 44.301 1.00 0.00 H ATOM 9787 H15S PA 292 101.175 51.345 44.837 1.00 0.00 H ATOM 9788 C114 PA 292 101.806 49.966 46.171 1.00 0.00 C ATOM 9789 H14R PA 292 102.722 49.552 46.598 1.00 0.00 H ATOM 9790 H14S PA 292 101.399 49.050 45.739 1.00 0.00 H ATOM 9791 C113 PA 292 100.918 50.341 47.376 1.00 0.00 C ATOM 9792 H13R PA 292 100.094 50.965 47.025 1.00 0.00 H ATOM 9793 H13S PA 292 101.459 51.034 48.023 1.00 0.00 H ATOM 9794 C112 PA 292 100.423 49.194 48.301 1.00 0.00 C ATOM 9795 H12R PA 292 101.346 48.654 48.524 1.00 0.00 H ATOM 9796 H12S PA 292 99.787 48.451 47.815 1.00 0.00 H ATOM 9797 C111 PA 292 99.695 49.759 49.526 1.00 0.00 C ATOM 9798 H11R PA 292 98.783 50.154 49.073 1.00 0.00 H ATOM 9799 H11S PA 292 100.292 50.578 49.932 1.00 0.00 H ATOM 9800 C110 PA 292 99.403 48.772 50.653 1.00 0.00 C ATOM 9801 H10R PA 292 98.848 49.269 51.452 1.00 0.00 H ATOM 9802 H10S PA 292 100.313 48.583 51.227 1.00 0.00 H ATOM 9803 C19 PA 292 98.753 47.479 50.192 1.00 0.00 C ATOM 9804 H9R PA 292 99.540 46.954 49.647 1.00 0.00 H ATOM 9805 H9S PA 292 97.985 47.639 49.433 1.00 0.00 H ATOM 9806 C18 PA 292 98.347 46.636 51.356 1.00 0.00 C ATOM 9807 H8R PA 292 97.451 47.110 51.762 1.00 0.00 H ATOM 9808 H8S PA 292 99.087 46.698 52.155 1.00 0.00 H ATOM 9809 C17 PA 292 98.139 45.136 51.057 1.00 0.00 C ATOM 9810 H7R PA 292 98.627 44.508 51.806 1.00 0.00 H ATOM 9811 H7S PA 292 98.651 44.893 50.124 1.00 0.00 H ATOM 9812 C16 PA 292 96.656 44.701 50.972 1.00 0.00 C ATOM 9813 H6R PA 292 96.749 43.675 50.611 1.00 0.00 H ATOM 9814 H6S PA 292 96.107 45.179 50.157 1.00 0.00 H ATOM 9815 C15 PA 292 95.937 44.749 52.370 1.00 0.00 C ATOM 9816 H5R PA 292 95.852 45.713 52.875 1.00 0.00 H ATOM 9817 H5S PA 292 96.432 44.012 53.007 1.00 0.00 H ATOM 9818 C14 PA 292 94.385 44.388 52.318 1.00 0.00 C ATOM 9819 H4R PA 292 94.304 43.364 51.947 1.00 0.00 H ATOM 9820 H4S PA 292 93.955 44.957 51.491 1.00 0.00 H ATOM 9821 C13 PA 292 93.705 44.508 53.714 1.00 0.00 C ATOM 9822 H3R PA 292 93.693 45.577 53.934 1.00 0.00 H ATOM 9823 H3S PA 292 94.170 43.842 54.444 1.00 0.00 H ATOM 9824 C12 PA 292 92.346 43.832 53.741 1.00 0.00 C ATOM 9825 H2R PA 292 91.726 44.158 52.903 1.00 0.00 H ATOM 9826 H2S PA 292 92.550 42.770 53.591 1.00 0.00 H ATOM 9827 C11 PGR 293 91.601 43.996 55.082 1.00 0.00 C ATOM 9828 O12 PGR 293 91.288 45.069 55.574 1.00 0.00 O ATOM 9829 O11 PGR 293 91.106 42.821 55.509 1.00 0.00 O ATOM 9830 C1 PGR 293 90.098 42.870 56.571 1.00 0.00 C ATOM 9831 HR PGR 293 89.178 43.237 56.108 1.00 0.00 H ATOM 9832 HS PGR 293 90.294 43.459 57.470 1.00 0.00 H ATOM 9833 C2 PGR 293 89.763 41.405 57.048 1.00 0.00 C ATOM 9834 HX PGR 293 88.780 41.351 57.523 1.00 0.00 H ATOM 9835 C3 PGR 293 90.772 40.770 58.039 1.00 0.00 C ATOM 9836 HA PGR 293 90.791 39.688 58.190 1.00 0.00 H ATOM 9837 HB PGR 293 90.598 41.290 58.985 1.00 0.00 H ATOM 9838 O31 PGR 293 92.102 40.945 57.575 1.00 0.00 O ATOM 9839 P31 PGR 293 93.424 40.657 58.451 1.00 0.00 P ATOM 9840 O32 PGR 293 93.873 42.100 58.887 1.00 0.00 O ATOM 9841 C31 PGR 293 94.509 42.988 57.996 1.00 0.00 C ATOM 9842 H1A PGR 293 94.093 42.848 56.995 1.00 0.00 H ATOM 9843 H1B PGR 293 95.562 42.713 57.891 1.00 0.00 H ATOM 9844 C32 PGR 293 94.289 44.477 58.443 1.00 0.00 C ATOM 9845 H2A PGR 293 94.483 45.005 57.506 1.00 0.00 H ATOM 9846 O35 PGR 293 95.328 44.781 59.357 1.00 0.00 O ATOM 9847 HO5A PGR 293 95.667 45.681 59.205 1.00 0.00 H ATOM 9848 C33 PGR 293 92.863 44.869 58.870 1.00 0.00 C ATOM 9849 H3A PGR 293 92.811 45.960 58.854 1.00 0.00 H ATOM 9850 H3B PGR 293 92.091 44.463 58.211 1.00 0.00 H ATOM 9851 O33 PGR 293 93.079 39.864 59.664 1.00 0.00 O ATOM 9852 O34 PGR 293 94.378 40.174 57.435 1.00 0.00 O ATOM 9853 O21 PGR 293 89.727 40.672 55.807 1.00 0.00 O ATOM 9854 C21 PGR 293 88.715 40.941 54.926 1.00 0.00 C ATOM 9855 O22 PGR 293 87.754 41.610 55.189 1.00 0.00 O ATOM 9856 O36 PGR 293 92.572 44.479 60.235 1.00 0.00 O ATOM 9857 HO6A PGR 293 92.284 43.548 60.220 1.00 0.00 H ATOM 9858 C12 OL 294 88.980 40.387 53.525 1.00 0.00 C ATOM 9859 H2R OL 294 89.560 39.484 53.727 1.00 0.00 H ATOM 9860 H2S OL 294 88.060 39.966 53.114 1.00 0.00 H ATOM 9861 C13 OL 294 89.690 41.398 52.578 1.00 0.00 C ATOM 9862 H3R OL 294 90.387 41.977 53.187 1.00 0.00 H ATOM 9863 H3S OL 294 90.346 40.877 51.878 1.00 0.00 H ATOM 9864 C14 OL 294 88.820 42.560 52.052 1.00 0.00 C ATOM 9865 H4R OL 294 88.484 43.198 52.873 1.00 0.00 H ATOM 9866 H4S OL 294 89.451 43.113 51.354 1.00 0.00 H ATOM 9867 C15 OL 294 87.490 42.057 51.303 1.00 0.00 C ATOM 9868 H5R OL 294 87.710 41.069 50.892 1.00 0.00 H ATOM 9869 H5S OL 294 86.695 41.944 52.043 1.00 0.00 H ATOM 9870 C16 OL 294 87.012 42.953 50.122 1.00 0.00 C ATOM 9871 H6R OL 294 86.308 42.360 49.534 1.00 0.00 H ATOM 9872 H6S OL 294 86.412 43.769 50.532 1.00 0.00 H ATOM 9873 C17 OL 294 88.072 43.522 49.194 1.00 0.00 C ATOM 9874 H7R OL 294 88.619 44.267 49.775 1.00 0.00 H ATOM 9875 H7S OL 294 88.654 42.706 48.761 1.00 0.00 H ATOM 9876 C18 OL 294 87.541 44.191 48.019 1.00 0.00 C ATOM 9877 H8R OL 294 88.354 44.631 47.438 1.00 0.00 H ATOM 9878 H8S OL 294 86.901 43.549 47.409 1.00 0.00 H ATOM 9879 C19 OL 294 86.741 45.384 48.415 1.00 0.00 C ATOM 9880 H9R OL 294 87.471 46.111 48.761 1.00 0.00 H ATOM 9881 C110 OL 294 85.472 45.736 48.308 1.00 0.00 C ATOM 9882 H10R OL 294 85.249 46.774 48.540 1.00 0.00 H ATOM 9883 C111 OL 294 84.392 44.812 47.767 1.00 0.00 C ATOM 9884 H11R OL 294 84.810 44.471 46.817 1.00 0.00 H ATOM 9885 H11S OL 294 84.207 43.916 48.364 1.00 0.00 H ATOM 9886 C112 OL 294 83.086 45.549 47.578 1.00 0.00 C ATOM 9887 H12R OL 294 82.800 45.964 48.547 1.00 0.00 H ATOM 9888 H12S OL 294 83.256 46.429 46.955 1.00 0.00 H ATOM 9889 C113 OL 294 82.065 44.711 46.803 1.00 0.00 C ATOM 9890 H13R OL 294 82.412 44.520 45.785 1.00 0.00 H ATOM 9891 H13S OL 294 81.824 43.836 47.410 1.00 0.00 H ATOM 9892 C114 OL 294 80.681 45.431 46.690 1.00 0.00 C ATOM 9893 H14R OL 294 79.998 44.735 46.200 1.00 0.00 H ATOM 9894 H14S OL 294 80.345 45.439 47.729 1.00 0.00 H ATOM 9895 C115 OL 294 80.522 46.813 45.959 1.00 0.00 C ATOM 9896 H15R OL 294 81.073 47.543 46.556 1.00 0.00 H ATOM 9897 H15S OL 294 80.944 46.686 44.960 1.00 0.00 H ATOM 9898 C116 OL 294 79.103 47.415 45.860 1.00 0.00 C ATOM 9899 H16R OL 294 78.514 46.836 45.146 1.00 0.00 H ATOM 9900 H16S OL 294 78.706 47.489 46.875 1.00 0.00 H ATOM 9901 C117 OL 294 79.207 48.927 45.559 1.00 0.00 C ATOM 9902 H17R OL 294 78.248 49.436 45.678 1.00 0.00 H ATOM 9903 H17S OL 294 79.930 49.452 46.187 1.00 0.00 H ATOM 9904 C118 OL 294 79.457 49.144 44.039 1.00 0.00 C ATOM 9905 H18R OL 294 79.844 50.157 43.912 1.00 0.00 H ATOM 9906 H18S OL 294 78.494 49.252 43.535 1.00 0.00 H ATOM 9907 H18T OL 294 80.106 48.432 43.525 1.00 0.00 H TER 9908 OL 294 ATOM 9908 C116 PA 295 93.329 86.081 44.823 1.00 0.00 C ATOM 9909 H16R PA 295 94.307 85.729 44.490 1.00 0.00 H ATOM 9910 H16S PA 295 92.798 85.148 45.022 1.00 0.00 H ATOM 9911 H16T PA 295 93.591 86.529 45.784 1.00 0.00 H ATOM 9912 C115 PA 295 92.676 87.010 43.862 1.00 0.00 C ATOM 9913 H15R PA 295 91.596 87.062 44.016 1.00 0.00 H ATOM 9914 H15S PA 295 92.778 86.554 42.874 1.00 0.00 H ATOM 9915 C114 PA 295 93.215 88.478 43.825 1.00 0.00 C ATOM 9916 H14R PA 295 92.679 88.844 42.946 1.00 0.00 H ATOM 9917 H14S PA 295 94.264 88.454 43.521 1.00 0.00 H ATOM 9918 C113 PA 295 93.035 89.355 45.002 1.00 0.00 C ATOM 9919 H13R PA 295 93.781 90.149 44.926 1.00 0.00 H ATOM 9920 H13S PA 295 93.414 88.901 45.920 1.00 0.00 H ATOM 9921 C112 PA 295 91.572 89.915 45.315 1.00 0.00 C ATOM 9922 H12R PA 295 90.938 89.033 45.207 1.00 0.00 H ATOM 9923 H12S PA 295 91.214 90.577 44.524 1.00 0.00 H ATOM 9924 C111 PA 295 91.619 90.507 46.630 1.00 0.00 C ATOM 9925 H11R PA 295 92.441 91.224 46.577 1.00 0.00 H ATOM 9926 H11S PA 295 92.061 89.785 47.319 1.00 0.00 H ATOM 9927 C110 PA 295 90.400 91.143 47.176 1.00 0.00 C ATOM 9928 H10R PA 295 89.646 90.374 46.992 1.00 0.00 H ATOM 9929 H10S PA 295 90.138 92.039 46.609 1.00 0.00 H ATOM 9930 C19 PA 295 90.526 91.498 48.758 1.00 0.00 C ATOM 9931 H9R PA 295 90.739 90.621 49.373 1.00 0.00 H ATOM 9932 H9S PA 295 89.627 91.949 49.182 1.00 0.00 H ATOM 9933 C18 PA 295 91.601 92.503 49.116 1.00 0.00 C ATOM 9934 H8R PA 295 92.483 92.104 48.610 1.00 0.00 H ATOM 9935 H8S PA 295 91.727 92.406 50.197 1.00 0.00 H ATOM 9936 C17 PA 295 91.361 93.953 48.542 1.00 0.00 C ATOM 9937 H7R PA 295 90.324 94.291 48.599 1.00 0.00 H ATOM 9938 H7S PA 295 91.549 93.934 47.467 1.00 0.00 H ATOM 9939 C16 PA 295 92.306 95.018 48.981 1.00 0.00 C ATOM 9940 H6R PA 295 91.941 96.023 48.756 1.00 0.00 H ATOM 9941 H6S PA 295 93.209 94.901 48.379 1.00 0.00 H ATOM 9942 C15 PA 295 92.819 95.012 50.444 1.00 0.00 C ATOM 9943 H5R PA 295 93.692 95.648 50.607 1.00 0.00 H ATOM 9944 H5S PA 295 93.248 94.058 50.759 1.00 0.00 H ATOM 9945 C14 PA 295 91.670 95.115 51.455 1.00 0.00 C ATOM 9946 H4R PA 295 91.025 94.251 51.282 1.00 0.00 H ATOM 9947 H4S PA 295 91.037 95.974 51.224 1.00 0.00 H ATOM 9948 C13 PA 295 92.049 95.115 52.894 1.00 0.00 C ATOM 9949 H3R PA 295 92.913 95.757 53.078 1.00 0.00 H ATOM 9950 H3S PA 295 92.450 94.183 53.298 1.00 0.00 H ATOM 9951 C12 PA 295 90.994 95.452 53.883 1.00 0.00 C ATOM 9952 H2R PA 295 90.188 94.737 53.706 1.00 0.00 H ATOM 9953 H2S PA 295 90.504 96.414 53.720 1.00 0.00 H ATOM 9954 C11 PGR 296 91.600 95.389 55.266 1.00 0.00 C ATOM 9955 O12 PGR 296 91.683 94.342 55.891 1.00 0.00 O ATOM 9956 O11 PGR 296 92.305 96.463 55.568 1.00 0.00 O ATOM 9957 C1 PGR 296 92.776 96.572 56.892 1.00 0.00 C ATOM 9958 HR PGR 296 93.546 95.825 57.098 1.00 0.00 H ATOM 9959 HS PGR 296 91.896 96.473 57.533 1.00 0.00 H ATOM 9960 C2 PGR 296 93.350 98.029 57.009 1.00 0.00 C ATOM 9961 HX PGR 296 94.353 98.031 56.574 1.00 0.00 H ATOM 9962 C3 PGR 296 93.518 98.407 58.467 1.00 0.00 C ATOM 9963 HA PGR 296 93.772 99.469 58.499 1.00 0.00 H ATOM 9964 HB PGR 296 94.397 97.930 58.908 1.00 0.00 H ATOM 9965 O31 PGR 296 92.306 98.218 59.215 1.00 0.00 O ATOM 9966 P31 PGR 296 92.031 98.838 60.624 1.00 0.00 P ATOM 9967 O32 PGR 296 91.520 100.274 60.307 1.00 0.00 O ATOM 9968 C31 PGR 296 90.195 100.513 59.844 1.00 0.00 C ATOM 9969 H1A PGR 296 89.484 100.445 60.671 1.00 0.00 H ATOM 9970 H1B PGR 296 89.986 99.714 59.127 1.00 0.00 H ATOM 9971 C32 PGR 296 90.178 101.824 59.142 1.00 0.00 C ATOM 9972 H2A PGR 296 90.895 101.959 58.328 1.00 0.00 H ATOM 9973 O35 PGR 296 90.370 102.849 60.149 1.00 0.00 O ATOM 9974 HO5A PGR 296 91.256 102.707 60.528 1.00 0.00 H ATOM 9975 C33 PGR 296 88.794 102.061 58.460 1.00 0.00 C ATOM 9976 H3A PGR 296 88.652 101.317 57.672 1.00 0.00 H ATOM 9977 H3B PGR 296 87.996 102.003 59.204 1.00 0.00 H ATOM 9978 O33 PGR 296 90.887 98.194 61.246 1.00 0.00 O ATOM 9979 O34 PGR 296 93.270 98.897 61.366 1.00 0.00 O ATOM 9980 O21 PGR 296 92.410 98.956 56.445 1.00 0.00 O ATOM 9981 C21 PGR 296 92.713 100.179 55.951 1.00 0.00 C ATOM 9982 O22 PGR 296 93.805 100.732 55.988 1.00 0.00 O ATOM 9983 O36 PGR 296 88.743 103.448 57.899 1.00 0.00 O ATOM 9984 HO6A PGR 296 89.603 103.659 57.495 1.00 0.00 H ATOM 9985 C12 OL 297 91.515 100.708 55.182 1.00 0.00 C ATOM 9986 H2R OL 297 90.693 100.002 55.316 1.00 0.00 H ATOM 9987 H2S OL 297 91.193 101.592 55.736 1.00 0.00 H ATOM 9988 C13 OL 297 91.878 101.039 53.643 1.00 0.00 C ATOM 9989 H3R OL 297 91.044 101.369 53.019 1.00 0.00 H ATOM 9990 H3S OL 297 92.554 101.893 53.723 1.00 0.00 H ATOM 9991 C14 OL 297 92.491 99.837 52.827 1.00 0.00 C ATOM 9992 H4R OL 297 93.408 99.421 53.250 1.00 0.00 H ATOM 9993 H4S OL 297 91.797 99.035 53.089 1.00 0.00 H ATOM 9994 C15 OL 297 92.656 100.092 51.329 1.00 0.00 C ATOM 9995 H5R OL 297 91.661 100.367 50.974 1.00 0.00 H ATOM 9996 H5S OL 297 93.253 100.994 51.173 1.00 0.00 H ATOM 9997 C16 OL 297 93.283 99.007 50.512 1.00 0.00 C ATOM 9998 H6R OL 297 94.371 98.999 50.607 1.00 0.00 H ATOM 9999 H6S OL 297 92.870 98.077 50.907 1.00 0.00 H ATOM 10000 C17 OL 297 92.977 99.046 48.944 1.00 0.00 C ATOM 10001 H7R OL 297 93.215 98.007 48.706 1.00 0.00 H ATOM 10002 H7S OL 297 91.909 99.246 48.841 1.00 0.00 H ATOM 10003 C18 OL 297 93.845 100.097 48.155 1.00 0.00 C ATOM 10004 H8R OL 297 93.376 100.139 47.169 1.00 0.00 H ATOM 10005 H8S OL 297 93.831 101.133 48.501 1.00 0.00 H ATOM 10006 C19 OL 297 95.401 99.823 48.231 1.00 0.00 C ATOM 10007 H9R OL 297 95.867 100.162 49.152 1.00 0.00 H ATOM 10008 C110 OL 297 96.133 99.280 47.252 1.00 0.00 C ATOM 10009 H10R OL 297 97.202 99.142 47.391 1.00 0.00 H ATOM 10010 C111 OL 297 95.660 98.612 46.020 1.00 0.00 C ATOM 10011 H11R OL 297 94.607 98.325 46.051 1.00 0.00 H ATOM 10012 H11S OL 297 95.648 99.418 45.284 1.00 0.00 H ATOM 10013 C112 OL 297 96.559 97.539 45.419 1.00 0.00 C ATOM 10014 H12R OL 297 96.440 97.607 44.336 1.00 0.00 H ATOM 10015 H12S OL 297 97.594 97.741 45.704 1.00 0.00 H ATOM 10016 C113 OL 297 96.199 96.200 45.875 1.00 0.00 C ATOM 10017 H13R OL 297 96.432 96.099 46.937 1.00 0.00 H ATOM 10018 H13S OL 297 95.156 95.904 45.739 1.00 0.00 H ATOM 10019 C114 OL 297 96.968 95.140 45.174 1.00 0.00 C ATOM 10020 H14R OL 297 96.990 95.170 44.083 1.00 0.00 H ATOM 10021 H14S OL 297 97.983 95.417 45.469 1.00 0.00 H ATOM 10022 C115 OL 297 96.487 93.710 45.517 1.00 0.00 C ATOM 10023 H15R OL 297 96.481 93.689 46.608 1.00 0.00 H ATOM 10024 H15S OL 297 95.467 93.582 45.146 1.00 0.00 H ATOM 10025 C116 OL 297 97.298 92.473 44.983 1.00 0.00 C ATOM 10026 H16R OL 297 98.279 92.222 45.393 1.00 0.00 H ATOM 10027 H16S OL 297 96.627 91.635 45.185 1.00 0.00 H ATOM 10028 C117 OL 297 97.257 92.367 43.429 1.00 0.00 C ATOM 10029 H17R OL 297 96.236 92.257 43.059 1.00 0.00 H ATOM 10030 H17S OL 297 97.579 93.339 43.052 1.00 0.00 H ATOM 10031 C118 OL 297 98.099 91.212 42.913 1.00 0.00 C ATOM 10032 H18R OL 297 99.163 91.332 43.129 1.00 0.00 H ATOM 10033 H18S OL 297 97.988 90.971 41.854 1.00 0.00 H ATOM 10034 H18T OL 297 97.748 90.311 43.420 1.00 0.00 H TER 10035 OL 297 ATOM 10035 C116 PA 298 23.296 80.462 40.651 1.00 0.00 C ATOM 10036 H16R PA 298 23.462 80.113 39.629 1.00 0.00 H ATOM 10037 H16S PA 298 23.881 81.382 40.596 1.00 0.00 H ATOM 10038 H16T PA 298 22.254 80.789 40.633 1.00 0.00 H ATOM 10039 C115 PA 298 23.553 79.559 41.866 1.00 0.00 C ATOM 10040 H15R PA 298 24.454 78.968 41.691 1.00 0.00 H ATOM 10041 H15S PA 298 22.689 78.896 41.945 1.00 0.00 H ATOM 10042 C114 PA 298 23.817 80.393 43.189 1.00 0.00 C ATOM 10043 H14R PA 298 23.566 79.714 44.007 1.00 0.00 H ATOM 10044 H14S PA 298 23.112 81.219 43.301 1.00 0.00 H ATOM 10045 C113 PA 298 25.214 80.846 43.423 1.00 0.00 C ATOM 10046 H13R PA 298 25.591 81.429 42.580 1.00 0.00 H ATOM 10047 H13S PA 298 25.921 80.013 43.440 1.00 0.00 H ATOM 10048 C112 PA 298 25.407 81.571 44.720 1.00 0.00 C ATOM 10049 H12R PA 298 26.489 81.701 44.654 1.00 0.00 H ATOM 10050 H12S PA 298 25.295 80.840 45.523 1.00 0.00 H ATOM 10051 C111 PA 298 24.635 82.877 44.927 1.00 0.00 C ATOM 10052 H11R PA 298 23.593 82.712 44.644 1.00 0.00 H ATOM 10053 H11S PA 298 24.924 83.606 44.166 1.00 0.00 H ATOM 10054 C110 PA 298 24.795 83.341 46.374 1.00 0.00 C ATOM 10055 H10R PA 298 25.848 83.597 46.512 1.00 0.00 H ATOM 10056 H10S PA 298 24.836 82.479 47.043 1.00 0.00 H ATOM 10057 C19 PA 298 23.655 84.391 46.743 1.00 0.00 C ATOM 10058 H9R PA 298 22.691 83.938 46.500 1.00 0.00 H ATOM 10059 H9S PA 298 23.662 85.235 46.050 1.00 0.00 H ATOM 10060 C18 PA 298 23.613 84.882 48.249 1.00 0.00 C ATOM 10061 H8R PA 298 22.759 85.550 48.379 1.00 0.00 H ATOM 10062 H8S PA 298 24.457 85.535 48.481 1.00 0.00 H ATOM 10063 C17 PA 298 23.381 83.752 49.265 1.00 0.00 C ATOM 10064 H7R PA 298 24.157 83.017 49.044 1.00 0.00 H ATOM 10065 H7S PA 298 22.513 83.132 49.031 1.00 0.00 H ATOM 10066 C16 PA 298 23.581 84.027 50.710 1.00 0.00 C ATOM 10067 H6R PA 298 22.683 84.547 51.051 1.00 0.00 H ATOM 10068 H6S PA 298 24.426 84.719 50.732 1.00 0.00 H ATOM 10069 C15 PA 298 23.939 82.863 51.630 1.00 0.00 C ATOM 10070 H5R PA 298 24.846 82.391 51.246 1.00 0.00 H ATOM 10071 H5S PA 298 23.260 82.012 51.710 1.00 0.00 H ATOM 10072 C14 PA 298 24.491 83.319 53.053 1.00 0.00 C ATOM 10073 H4R PA 298 23.990 84.200 53.457 1.00 0.00 H ATOM 10074 H4S PA 298 25.519 83.660 52.910 1.00 0.00 H ATOM 10075 C13 PA 298 24.433 82.054 54.015 1.00 0.00 C ATOM 10076 H3R PA 298 25.253 82.148 54.730 1.00 0.00 H ATOM 10077 H3S PA 298 24.728 81.117 53.539 1.00 0.00 H ATOM 10078 C12 PA 298 23.154 81.764 54.760 1.00 0.00 C ATOM 10079 H2R PA 298 22.406 81.362 54.074 1.00 0.00 H ATOM 10080 H2S PA 298 22.705 82.557 55.362 1.00 0.00 H ATOM 10081 C11 PGR 299 23.317 80.734 55.814 1.00 0.00 C ATOM 10082 O12 PGR 299 24.359 80.536 56.359 1.00 0.00 O ATOM 10083 O11 PGR 299 22.209 80.097 55.992 1.00 0.00 O ATOM 10084 C1 PGR 299 22.064 79.260 57.119 1.00 0.00 C ATOM 10085 HR PGR 299 22.174 79.898 58.000 1.00 0.00 H ATOM 10086 HS PGR 299 22.869 78.521 57.148 1.00 0.00 H ATOM 10087 C2 PGR 299 20.723 78.476 57.033 1.00 0.00 C ATOM 10088 HX PGR 299 20.002 79.118 56.522 1.00 0.00 H ATOM 10089 C3 PGR 299 20.215 78.114 58.456 1.00 0.00 C ATOM 10090 HA PGR 299 19.279 77.564 58.332 1.00 0.00 H ATOM 10091 HB PGR 299 19.947 79.002 59.034 1.00 0.00 H ATOM 10092 O31 PGR 299 21.174 77.325 59.156 1.00 0.00 O ATOM 10093 P31 PGR 299 20.647 76.686 60.522 1.00 0.00 P ATOM 10094 O32 PGR 299 20.531 77.945 61.506 1.00 0.00 O ATOM 10095 C31 PGR 299 21.715 78.688 61.829 1.00 0.00 C ATOM 10096 H1A PGR 299 22.383 78.156 62.512 1.00 0.00 H ATOM 10097 H1B PGR 299 22.371 79.001 61.013 1.00 0.00 H ATOM 10098 C32 PGR 299 21.220 79.887 62.662 1.00 0.00 C ATOM 10099 H2A PGR 299 22.087 80.387 63.100 1.00 0.00 H ATOM 10100 O35 PGR 299 20.521 79.428 63.783 1.00 0.00 O ATOM 10101 HO5A PGR 299 19.812 78.799 63.560 1.00 0.00 H ATOM 10102 C33 PGR 299 20.294 80.783 61.817 1.00 0.00 C ATOM 10103 H3A PGR 299 20.938 81.188 61.032 1.00 0.00 H ATOM 10104 H3B PGR 299 19.456 80.210 61.411 1.00 0.00 H ATOM 10105 O33 PGR 299 19.246 76.103 60.446 1.00 0.00 O ATOM 10106 O34 PGR 299 21.703 75.805 61.090 1.00 0.00 O ATOM 10107 O21 PGR 299 20.881 77.268 56.192 1.00 0.00 O ATOM 10108 C21 PGR 299 19.868 76.839 55.474 1.00 0.00 C ATOM 10109 O22 PGR 299 18.783 77.403 55.284 1.00 0.00 O ATOM 10110 O36 PGR 299 19.781 81.836 62.587 1.00 0.00 O ATOM 10111 HO6A PGR 299 19.575 81.332 63.395 1.00 0.00 H ATOM 10112 C12 OL 300 20.091 75.456 54.915 1.00 0.00 C ATOM 10113 H2R OL 300 21.034 75.027 55.260 1.00 0.00 H ATOM 10114 H2S OL 300 19.242 74.878 55.286 1.00 0.00 H ATOM 10115 C13 OL 300 19.915 75.519 53.357 1.00 0.00 C ATOM 10116 H3R OL 300 20.148 74.463 53.199 1.00 0.00 H ATOM 10117 H3S OL 300 18.903 75.695 52.986 1.00 0.00 H ATOM 10118 C14 OL 300 20.860 76.333 52.446 1.00 0.00 C ATOM 10119 H4R OL 300 21.848 76.328 52.910 1.00 0.00 H ATOM 10120 H4S OL 300 20.844 75.875 51.455 1.00 0.00 H ATOM 10121 C15 OL 300 20.522 77.759 52.383 1.00 0.00 C ATOM 10122 H5R OL 300 19.481 77.934 52.102 1.00 0.00 H ATOM 10123 H5S OL 300 20.557 78.147 53.403 1.00 0.00 H ATOM 10124 C16 OL 300 21.498 78.640 51.625 1.00 0.00 C ATOM 10125 H6R OL 300 21.084 79.642 51.754 1.00 0.00 H ATOM 10126 H6S OL 300 22.456 78.536 52.140 1.00 0.00 H ATOM 10127 C17 OL 300 21.589 78.351 50.145 1.00 0.00 C ATOM 10128 H7R OL 300 22.197 77.444 50.165 1.00 0.00 H ATOM 10129 H7S OL 300 20.613 78.224 49.673 1.00 0.00 H ATOM 10130 C18 OL 300 22.222 79.359 49.205 1.00 0.00 C ATOM 10131 H8R OL 300 21.571 80.229 49.317 1.00 0.00 H ATOM 10132 H8S OL 300 23.155 79.675 49.677 1.00 0.00 H ATOM 10133 C19 OL 300 22.387 78.832 47.816 1.00 0.00 C ATOM 10134 H9R OL 300 23.385 78.411 47.724 1.00 0.00 H ATOM 10135 C110 OL 300 21.564 78.924 46.796 1.00 0.00 C ATOM 10136 H10R OL 300 21.879 78.606 45.805 1.00 0.00 H ATOM 10137 C111 OL 300 20.150 79.308 46.916 1.00 0.00 C ATOM 10138 H11R OL 300 19.614 78.360 46.841 1.00 0.00 H ATOM 10139 H11S OL 300 19.833 79.746 47.865 1.00 0.00 H ATOM 10140 C112 OL 300 19.592 80.261 45.806 1.00 0.00 C ATOM 10141 H12R OL 300 19.723 79.792 44.828 1.00 0.00 H ATOM 10142 H12S OL 300 18.534 80.471 45.976 1.00 0.00 H ATOM 10143 C113 OL 300 20.351 81.628 45.666 1.00 0.00 C ATOM 10144 H13R OL 300 20.434 81.986 46.695 1.00 0.00 H ATOM 10145 H13S OL 300 21.411 81.416 45.508 1.00 0.00 H ATOM 10146 C114 OL 300 19.810 82.757 44.836 1.00 0.00 C ATOM 10147 H14R OL 300 18.773 83.031 45.045 1.00 0.00 H ATOM 10148 H14S OL 300 20.390 83.639 45.116 1.00 0.00 H ATOM 10149 C115 OL 300 19.862 82.450 43.283 1.00 0.00 C ATOM 10150 H15R OL 300 20.853 82.095 42.992 1.00 0.00 H ATOM 10151 H15S OL 300 19.133 81.694 42.983 1.00 0.00 H ATOM 10152 C116 OL 300 19.530 83.721 42.506 1.00 0.00 C ATOM 10153 H16R OL 300 18.558 84.192 42.664 1.00 0.00 H ATOM 10154 H16S OL 300 20.231 84.499 42.815 1.00 0.00 H ATOM 10155 C117 OL 300 19.454 83.628 40.960 1.00 0.00 C ATOM 10156 H17R OL 300 19.221 84.623 40.575 1.00 0.00 H ATOM 10157 H17S OL 300 20.470 83.355 40.668 1.00 0.00 H ATOM 10158 C118 OL 300 18.618 82.493 40.440 1.00 0.00 C ATOM 10159 H18R OL 300 18.821 82.307 39.383 1.00 0.00 H ATOM 10160 H18S OL 300 17.546 82.684 40.365 1.00 0.00 H ATOM 10161 H18T OL 300 18.774 81.557 40.981 1.00 0.00 H TER 10162 OL 300 ATOM 10162 C116 PA 301 111.339 81.895 43.745 1.00 0.00 C ATOM 10163 H16R PA 301 110.441 81.363 44.066 1.00 0.00 H ATOM 10164 H16S PA 301 112.005 81.398 43.037 1.00 0.00 H ATOM 10165 H16T PA 301 111.050 82.844 43.289 1.00 0.00 H ATOM 10166 C115 PA 301 112.107 82.236 45.021 1.00 0.00 C ATOM 10167 H15R PA 301 113.067 82.626 44.675 1.00 0.00 H ATOM 10168 H15S PA 301 112.349 81.277 45.485 1.00 0.00 H ATOM 10169 C114 PA 301 111.340 83.146 45.954 1.00 0.00 C ATOM 10170 H14R PA 301 110.288 82.920 46.139 1.00 0.00 H ATOM 10171 H14S PA 301 111.367 84.177 45.594 1.00 0.00 H ATOM 10172 C113 PA 301 111.914 83.020 47.345 1.00 0.00 C ATOM 10173 H13R PA 301 112.999 83.060 47.461 1.00 0.00 H ATOM 10174 H13S PA 301 111.726 82.031 47.767 1.00 0.00 H ATOM 10175 C112 PA 301 111.112 84.029 48.200 1.00 0.00 C ATOM 10176 H12R PA 301 110.072 83.701 48.246 1.00 0.00 H ATOM 10177 H12S PA 301 111.127 85.024 47.751 1.00 0.00 H ATOM 10178 C111 PA 301 111.534 84.159 49.692 1.00 0.00 C ATOM 10179 H11R PA 301 111.001 85.036 50.067 1.00 0.00 H ATOM 10180 H11S PA 301 112.582 84.443 49.805 1.00 0.00 H ATOM 10181 C110 PA 301 111.422 82.954 50.587 1.00 0.00 C ATOM 10182 H10R PA 301 111.890 82.077 50.134 1.00 0.00 H ATOM 10183 H10S PA 301 110.359 82.727 50.689 1.00 0.00 H ATOM 10184 C19 PA 301 112.018 83.135 52.045 1.00 0.00 C ATOM 10185 H9R PA 301 113.084 83.210 51.820 1.00 0.00 H ATOM 10186 H9S PA 301 111.942 82.148 52.505 1.00 0.00 H ATOM 10187 C18 PA 301 111.482 84.235 52.878 1.00 0.00 C ATOM 10188 H8R PA 301 111.886 85.230 52.679 1.00 0.00 H ATOM 10189 H8S PA 301 111.921 84.102 53.868 1.00 0.00 H ATOM 10190 C17 PA 301 109.970 84.282 52.921 1.00 0.00 C ATOM 10191 H7R PA 301 109.509 84.557 51.970 1.00 0.00 H ATOM 10192 H7S PA 301 109.770 85.150 53.553 1.00 0.00 H ATOM 10193 C16 PA 301 109.276 83.154 53.549 1.00 0.00 C ATOM 10194 H6R PA 301 109.710 83.075 54.548 1.00 0.00 H ATOM 10195 H6S PA 301 109.328 82.223 52.981 1.00 0.00 H ATOM 10196 C15 PA 301 107.794 83.417 53.716 1.00 0.00 C ATOM 10197 H5R PA 301 107.322 83.420 52.732 1.00 0.00 H ATOM 10198 H5S PA 301 107.469 84.397 54.073 1.00 0.00 H ATOM 10199 C14 PA 301 107.126 82.361 54.587 1.00 0.00 C ATOM 10200 H4R PA 301 107.338 81.405 54.103 1.00 0.00 H ATOM 10201 H4S PA 301 106.039 82.444 54.528 1.00 0.00 H ATOM 10202 C13 PA 301 107.523 82.241 56.092 1.00 0.00 C ATOM 10203 H3R PA 301 108.467 81.694 56.132 1.00 0.00 H ATOM 10204 H3S PA 301 106.708 81.697 56.575 1.00 0.00 H ATOM 10205 C12 PA 301 107.591 83.653 56.804 1.00 0.00 C ATOM 10206 H2R PA 301 106.830 84.303 56.368 1.00 0.00 H ATOM 10207 H2S PA 301 108.550 84.129 56.588 1.00 0.00 H ATOM 10208 C11 PGR 302 107.465 83.654 58.314 1.00 0.00 C ATOM 10209 O12 PGR 302 106.931 82.723 58.900 1.00 0.00 O ATOM 10210 O11 PGR 302 108.070 84.685 58.910 1.00 0.00 O ATOM 10211 C1 PGR 302 108.213 84.575 60.367 1.00 0.00 C ATOM 10212 HR PGR 302 107.276 84.397 60.901 1.00 0.00 H ATOM 10213 HS PGR 302 108.408 85.591 60.721 1.00 0.00 H ATOM 10214 C2 PGR 302 109.336 83.597 60.819 1.00 0.00 C ATOM 10215 HX PGR 302 108.974 82.649 60.411 1.00 0.00 H ATOM 10216 C3 PGR 302 109.625 83.574 62.338 1.00 0.00 C ATOM 10217 HA PGR 302 110.260 82.707 62.541 1.00 0.00 H ATOM 10218 HB PGR 302 108.755 83.456 62.989 1.00 0.00 H ATOM 10219 O31 PGR 302 110.333 84.775 62.714 1.00 0.00 O ATOM 10220 P31 PGR 302 110.596 85.103 64.159 1.00 0.00 P ATOM 10221 O32 PGR 302 109.188 85.782 64.646 1.00 0.00 O ATOM 10222 C31 PGR 302 108.900 87.159 64.477 1.00 0.00 C ATOM 10223 H1A PGR 302 107.850 87.385 64.275 1.00 0.00 H ATOM 10224 H1B PGR 302 109.310 87.463 63.510 1.00 0.00 H ATOM 10225 C32 PGR 302 109.467 87.917 65.754 1.00 0.00 C ATOM 10226 H2A PGR 302 108.784 87.740 66.590 1.00 0.00 H ATOM 10227 O35 PGR 302 110.833 87.578 66.083 1.00 0.00 O ATOM 10228 HO5A PGR 302 111.050 87.143 65.239 1.00 0.00 H ATOM 10229 C33 PGR 302 109.563 89.440 65.637 1.00 0.00 C ATOM 10230 H3A PGR 302 108.587 89.896 65.820 1.00 0.00 H ATOM 10231 H3B PGR 302 110.304 89.775 66.368 1.00 0.00 H ATOM 10232 O33 PGR 302 110.737 83.848 64.914 1.00 0.00 O ATOM 10233 O34 PGR 302 111.699 86.089 64.176 1.00 0.00 O ATOM 10234 O21 PGR 302 110.470 83.948 60.094 1.00 0.00 O ATOM 10235 C21 PGR 302 111.531 83.175 60.022 1.00 0.00 C ATOM 10236 O22 PGR 302 111.618 82.064 60.637 1.00 0.00 O ATOM 10237 O36 PGR 302 110.171 89.798 64.359 1.00 0.00 O ATOM 10238 HO6A PGR 302 111.082 89.470 64.253 1.00 0.00 H ATOM 10239 C12 OL 303 112.577 83.775 59.136 1.00 0.00 C ATOM 10240 H2R OL 303 112.012 84.631 58.762 1.00 0.00 H ATOM 10241 H2S OL 303 113.461 84.130 59.671 1.00 0.00 H ATOM 10242 C13 OL 303 112.923 82.931 57.884 1.00 0.00 C ATOM 10243 H3R OL 303 113.590 83.522 57.254 1.00 0.00 H ATOM 10244 H3S OL 303 113.536 82.056 58.109 1.00 0.00 H ATOM 10245 C14 OL 303 111.740 82.526 57.004 1.00 0.00 C ATOM 10246 H4R OL 303 111.017 81.971 57.604 1.00 0.00 H ATOM 10247 H4S OL 303 111.297 83.446 56.615 1.00 0.00 H ATOM 10248 C15 OL 303 112.102 81.681 55.794 1.00 0.00 C ATOM 10249 H5R OL 303 111.779 82.240 54.914 1.00 0.00 H ATOM 10250 H5S OL 303 113.169 81.469 55.697 1.00 0.00 H ATOM 10251 C16 OL 303 111.313 80.304 55.759 1.00 0.00 C ATOM 10252 H6R OL 303 111.648 79.641 56.558 1.00 0.00 H ATOM 10253 H6S OL 303 110.281 80.532 56.036 1.00 0.00 H ATOM 10254 C17 OL 303 111.399 79.612 54.373 1.00 0.00 C ATOM 10255 H7R OL 303 110.996 78.604 54.493 1.00 0.00 H ATOM 10256 H7S OL 303 110.695 80.121 53.711 1.00 0.00 H ATOM 10257 C18 OL 303 112.798 79.600 53.723 1.00 0.00 C ATOM 10258 H8R OL 303 112.599 79.036 52.809 1.00 0.00 H ATOM 10259 H8S OL 303 113.031 80.588 53.322 1.00 0.00 H ATOM 10260 C19 OL 303 113.921 79.084 54.645 1.00 0.00 C ATOM 10261 H9R OL 303 114.080 79.583 55.597 1.00 0.00 H ATOM 10262 C110 OL 303 114.766 78.167 54.266 1.00 0.00 C ATOM 10263 H10R OL 303 115.510 77.794 54.966 1.00 0.00 H ATOM 10264 C111 OL 303 114.786 77.471 52.917 1.00 0.00 C ATOM 10265 H11R OL 303 115.038 76.420 53.075 1.00 0.00 H ATOM 10266 H11S OL 303 113.801 77.542 52.450 1.00 0.00 H ATOM 10267 C112 OL 303 115.788 78.105 51.951 1.00 0.00 C ATOM 10268 H12R OL 303 115.455 79.142 51.865 1.00 0.00 H ATOM 10269 H12S OL 303 116.690 78.219 52.555 1.00 0.00 H ATOM 10270 C113 OL 303 115.890 77.385 50.605 1.00 0.00 C ATOM 10271 H13R OL 303 114.892 77.454 50.167 1.00 0.00 H ATOM 10272 H13S OL 303 116.463 78.064 49.970 1.00 0.00 H ATOM 10273 C114 OL 303 116.355 75.921 50.656 1.00 0.00 C ATOM 10274 H14R OL 303 117.377 75.733 50.991 1.00 0.00 H ATOM 10275 H14S OL 303 115.678 75.371 51.313 1.00 0.00 H ATOM 10276 C115 OL 303 116.279 75.191 49.337 1.00 0.00 C ATOM 10277 H15R OL 303 117.080 75.431 48.635 1.00 0.00 H ATOM 10278 H15S OL 303 116.513 74.135 49.489 1.00 0.00 H ATOM 10279 C116 OL 303 114.846 75.252 48.648 1.00 0.00 C ATOM 10280 H16R OL 303 114.023 74.941 49.295 1.00 0.00 H ATOM 10281 H16S OL 303 114.625 76.282 48.361 1.00 0.00 H ATOM 10282 C117 OL 303 114.842 74.386 47.402 1.00 0.00 C ATOM 10283 H17R OL 303 115.248 73.398 47.631 1.00 0.00 H ATOM 10284 H17S OL 303 113.842 74.327 46.966 1.00 0.00 H ATOM 10285 C118 OL 303 115.633 75.084 46.299 1.00 0.00 C ATOM 10286 H18R OL 303 115.198 76.065 46.092 1.00 0.00 H ATOM 10287 H18S OL 303 115.706 74.535 45.358 1.00 0.00 H ATOM 10288 H18T OL 303 116.671 75.286 46.570 1.00 0.00 H TER 10289 OL 303 ATOM 10289 C116 PA 304 3.067 121.417 39.813 1.00 0.00 C ATOM 10290 H16R PA 304 2.407 120.547 39.827 1.00 0.00 H ATOM 10291 H16S PA 304 3.554 121.345 38.839 1.00 0.00 H ATOM 10292 H16T PA 304 2.485 122.340 39.816 1.00 0.00 H ATOM 10293 C115 PA 304 3.954 121.428 41.040 1.00 0.00 C ATOM 10294 H15R PA 304 4.506 122.344 41.260 1.00 0.00 H ATOM 10295 H15S PA 304 4.790 120.731 40.946 1.00 0.00 H ATOM 10296 C114 PA 304 3.180 121.057 42.293 1.00 0.00 C ATOM 10297 H14R PA 304 2.953 119.991 42.228 1.00 0.00 H ATOM 10298 H14S PA 304 2.236 121.601 42.220 1.00 0.00 H ATOM 10299 C113 PA 304 3.936 121.387 43.599 1.00 0.00 C ATOM 10300 H13R PA 304 3.265 121.187 44.437 1.00 0.00 H ATOM 10301 H13S PA 304 3.944 122.457 43.814 1.00 0.00 H ATOM 10302 C112 PA 304 5.192 120.669 43.694 1.00 0.00 C ATOM 10303 H12R PA 304 5.790 120.994 42.839 1.00 0.00 H ATOM 10304 H12S PA 304 4.893 119.632 43.527 1.00 0.00 H ATOM 10305 C111 PA 304 5.906 121.095 45.021 1.00 0.00 C ATOM 10306 H11R PA 304 5.491 120.417 45.769 1.00 0.00 H ATOM 10307 H11S PA 304 5.906 122.133 45.358 1.00 0.00 H ATOM 10308 C110 PA 304 7.368 120.695 45.038 1.00 0.00 C ATOM 10309 H10R PA 304 7.764 121.168 44.136 1.00 0.00 H ATOM 10310 H10S PA 304 7.388 119.630 44.798 1.00 0.00 H ATOM 10311 C19 PA 304 8.052 121.060 46.358 1.00 0.00 C ATOM 10312 H9R PA 304 7.510 120.694 47.232 1.00 0.00 H ATOM 10313 H9S PA 304 7.942 122.141 46.470 1.00 0.00 H ATOM 10314 C18 PA 304 9.466 120.628 46.417 1.00 0.00 C ATOM 10315 H8R PA 304 10.012 121.150 45.629 1.00 0.00 H ATOM 10316 H8S PA 304 9.731 119.633 46.051 1.00 0.00 H ATOM 10317 C17 PA 304 10.067 120.984 47.713 1.00 0.00 C ATOM 10318 H7R PA 304 9.562 120.415 48.496 1.00 0.00 H ATOM 10319 H7S PA 304 10.013 122.027 48.033 1.00 0.00 H ATOM 10320 C16 PA 304 11.515 120.523 47.816 1.00 0.00 C ATOM 10321 H6R PA 304 12.152 121.295 47.377 1.00 0.00 H ATOM 10322 H6S PA 304 11.664 119.579 47.287 1.00 0.00 H ATOM 10323 C15 PA 304 11.971 120.215 49.250 1.00 0.00 C ATOM 10324 H5R PA 304 12.913 119.664 49.258 1.00 0.00 H ATOM 10325 H5S PA 304 11.253 119.536 49.715 1.00 0.00 H ATOM 10326 C14 PA 304 12.129 121.457 50.134 1.00 0.00 C ATOM 10327 H4R PA 304 11.172 121.872 50.455 1.00 0.00 H ATOM 10328 H4S PA 304 12.574 122.242 49.519 1.00 0.00 H ATOM 10329 C13 PA 304 13.016 121.308 51.351 1.00 0.00 C ATOM 10330 H3R PA 304 13.305 122.275 51.767 1.00 0.00 H ATOM 10331 H3S PA 304 13.973 120.937 50.977 1.00 0.00 H ATOM 10332 C12 PA 304 12.464 120.342 52.409 1.00 0.00 C ATOM 10333 H2R PA 304 12.293 119.354 51.978 1.00 0.00 H ATOM 10334 H2S PA 304 11.461 120.594 52.758 1.00 0.00 H ATOM 10335 C11 PGR 305 13.349 120.178 53.568 1.00 0.00 C ATOM 10336 O12 PGR 305 12.836 120.089 54.625 1.00 0.00 O ATOM 10337 O11 PGR 305 14.653 120.046 53.360 1.00 0.00 O ATOM 10338 C1 PGR 305 15.551 119.798 54.544 1.00 0.00 C ATOM 10339 HR PGR 305 15.292 120.405 55.415 1.00 0.00 H ATOM 10340 HS PGR 305 16.613 119.876 54.296 1.00 0.00 H ATOM 10341 C2 PGR 305 15.328 118.348 55.013 1.00 0.00 C ATOM 10342 HX PGR 305 14.252 118.164 54.953 1.00 0.00 H ATOM 10343 C3 PGR 305 15.919 118.262 56.404 1.00 0.00 C ATOM 10344 HA PGR 305 15.565 119.119 56.983 1.00 0.00 H ATOM 10345 HB PGR 305 17.001 118.269 56.253 1.00 0.00 H ATOM 10346 O31 PGR 305 15.635 117.013 56.973 1.00 0.00 O ATOM 10347 P31 PGR 305 16.098 116.587 58.398 1.00 0.00 P ATOM 10348 O32 PGR 305 17.535 115.832 58.183 1.00 0.00 O ATOM 10349 C31 PGR 305 18.476 116.200 57.188 1.00 0.00 C ATOM 10350 H1A PGR 305 18.794 117.213 57.447 1.00 0.00 H ATOM 10351 H1B PGR 305 18.007 116.275 56.204 1.00 0.00 H ATOM 10352 C32 PGR 305 19.612 115.184 57.163 1.00 0.00 C ATOM 10353 H2A PGR 305 19.218 114.196 57.415 1.00 0.00 H ATOM 10354 O35 PGR 305 20.587 115.517 58.153 1.00 0.00 O ATOM 10355 HO5A PGR 305 20.034 115.415 58.949 1.00 0.00 H ATOM 10356 C33 PGR 305 20.353 115.195 55.825 1.00 0.00 C ATOM 10357 H3A PGR 305 19.669 114.797 55.072 1.00 0.00 H ATOM 10358 H3B PGR 305 20.593 116.252 55.678 1.00 0.00 H ATOM 10359 O33 PGR 305 16.211 117.825 59.196 1.00 0.00 O ATOM 10360 O34 PGR 305 15.171 115.535 58.889 1.00 0.00 O ATOM 10361 O21 PGR 305 16.034 117.421 54.130 1.00 0.00 O ATOM 10362 C21 PGR 305 15.212 116.851 53.187 1.00 0.00 C ATOM 10363 O22 PGR 305 13.988 116.959 53.097 1.00 0.00 O ATOM 10364 O36 PGR 305 21.493 114.380 55.871 1.00 0.00 O ATOM 10365 HO6A PGR 305 21.913 114.784 56.652 1.00 0.00 H ATOM 10366 C12 OL 306 15.972 115.992 52.286 1.00 0.00 C ATOM 10367 H2R OL 306 16.734 115.570 52.945 1.00 0.00 H ATOM 10368 H2S OL 306 15.485 115.095 51.900 1.00 0.00 H ATOM 10369 C13 OL 306 16.619 116.698 51.169 1.00 0.00 C ATOM 10370 H3R OL 306 17.269 117.510 51.500 1.00 0.00 H ATOM 10371 H3S OL 306 17.236 115.930 50.697 1.00 0.00 H ATOM 10372 C14 OL 306 15.643 117.182 50.144 1.00 0.00 C ATOM 10373 H4R OL 306 14.881 116.400 50.124 1.00 0.00 H ATOM 10374 H4S OL 306 15.037 118.041 50.438 1.00 0.00 H ATOM 10375 C15 OL 306 16.238 117.348 48.767 1.00 0.00 C ATOM 10376 H5R OL 306 17.093 118.017 48.882 1.00 0.00 H ATOM 10377 H5S OL 306 16.589 116.336 48.556 1.00 0.00 H ATOM 10378 C16 OL 306 15.247 117.742 47.725 1.00 0.00 C ATOM 10379 H6R OL 306 14.893 118.773 47.663 1.00 0.00 H ATOM 10380 H6S OL 306 15.742 117.763 46.752 1.00 0.00 H ATOM 10381 C17 OL 306 14.015 116.828 47.649 1.00 0.00 C ATOM 10382 H7R OL 306 14.378 115.798 47.674 1.00 0.00 H ATOM 10383 H7S OL 306 13.368 116.939 48.522 1.00 0.00 H ATOM 10384 C18 OL 306 13.051 117.195 46.554 1.00 0.00 C ATOM 10385 H8R OL 306 12.778 118.252 46.560 1.00 0.00 H ATOM 10386 H8S OL 306 13.735 117.123 45.706 1.00 0.00 H ATOM 10387 C19 OL 306 11.909 116.270 46.528 1.00 0.00 C ATOM 10388 H9R OL 306 11.246 116.260 47.389 1.00 0.00 H ATOM 10389 C110 OL 306 11.671 115.455 45.510 1.00 0.00 C ATOM 10390 H10R OL 306 10.912 114.678 45.553 1.00 0.00 H ATOM 10391 C111 OL 306 12.496 115.299 44.222 1.00 0.00 C ATOM 10392 H11R OL 306 13.582 115.389 44.298 1.00 0.00 H ATOM 10393 H11S OL 306 12.340 114.253 43.952 1.00 0.00 H ATOM 10394 C112 OL 306 11.883 116.200 43.070 1.00 0.00 C ATOM 10395 H12R OL 306 12.432 115.796 42.217 1.00 0.00 H ATOM 10396 H12S OL 306 10.832 115.915 42.987 1.00 0.00 H ATOM 10397 C113 OL 306 12.124 117.663 43.326 1.00 0.00 C ATOM 10398 H13R OL 306 11.535 117.881 44.220 1.00 0.00 H ATOM 10399 H13S OL 306 13.193 117.882 43.369 1.00 0.00 H ATOM 10400 C114 OL 306 11.544 118.507 42.237 1.00 0.00 C ATOM 10401 H14R OL 306 12.166 118.215 41.388 1.00 0.00 H ATOM 10402 H14S OL 306 10.539 118.168 41.975 1.00 0.00 H ATOM 10403 C115 OL 306 11.574 119.996 42.504 1.00 0.00 C ATOM 10404 H15R OL 306 10.950 120.264 43.359 1.00 0.00 H ATOM 10405 H15S OL 306 12.539 120.099 43.005 1.00 0.00 H ATOM 10406 C116 OL 306 11.414 120.957 41.332 1.00 0.00 C ATOM 10407 H16R OL 306 10.349 120.899 41.096 1.00 0.00 H ATOM 10408 H16S OL 306 11.716 121.938 41.705 1.00 0.00 H ATOM 10409 C117 OL 306 12.288 120.618 40.076 1.00 0.00 C ATOM 10410 H17R OL 306 13.350 120.449 40.265 1.00 0.00 H ATOM 10411 H17S OL 306 12.029 119.774 39.433 1.00 0.00 H ATOM 10412 C118 OL 306 12.073 121.746 39.052 1.00 0.00 C ATOM 10413 H18R OL 306 11.975 122.710 39.555 1.00 0.00 H ATOM 10414 H18S OL 306 11.270 121.584 38.330 1.00 0.00 H ATOM 10415 H18T OL 306 12.941 121.931 38.416 1.00 0.00 H TER 10416 OL 306 ATOM 10416 C116 PA 307 98.920 59.107 44.716 1.00 0.00 C ATOM 10417 H16R PA 307 98.878 58.908 45.789 1.00 0.00 H ATOM 10418 H16S PA 307 99.987 59.040 44.489 1.00 0.00 H ATOM 10419 H16T PA 307 98.399 58.263 44.259 1.00 0.00 H ATOM 10420 C115 PA 307 98.250 60.435 44.290 1.00 0.00 C ATOM 10421 H15R PA 307 97.309 60.656 44.798 1.00 0.00 H ATOM 10422 H15S PA 307 98.005 60.372 43.227 1.00 0.00 H ATOM 10423 C114 PA 307 99.223 61.622 44.517 1.00 0.00 C ATOM 10424 H14R PA 307 100.095 61.457 43.881 1.00 0.00 H ATOM 10425 H14S PA 307 99.544 61.556 45.558 1.00 0.00 H ATOM 10426 C113 PA 307 98.684 62.983 44.327 1.00 0.00 C ATOM 10427 H13R PA 307 97.782 63.034 44.942 1.00 0.00 H ATOM 10428 H13S PA 307 98.303 62.987 43.304 1.00 0.00 H ATOM 10429 C112 PA 307 99.489 64.189 44.575 1.00 0.00 C ATOM 10430 H12R PA 307 99.114 64.976 43.917 1.00 0.00 H ATOM 10431 H12S PA 307 100.521 63.891 44.382 1.00 0.00 H ATOM 10432 C111 PA 307 99.259 64.757 46.046 1.00 0.00 C ATOM 10433 H11R PA 307 99.434 64.038 46.850 1.00 0.00 H ATOM 10434 H11S PA 307 98.213 65.040 46.176 1.00 0.00 H ATOM 10435 C110 PA 307 100.211 65.935 46.274 1.00 0.00 C ATOM 10436 H10R PA 307 100.210 66.635 45.437 1.00 0.00 H ATOM 10437 H10S PA 307 101.198 65.471 46.341 1.00 0.00 H ATOM 10438 C19 PA 307 99.856 66.862 47.447 1.00 0.00 C ATOM 10439 H9R PA 307 98.996 67.410 47.059 1.00 0.00 H ATOM 10440 H9S PA 307 100.704 67.548 47.500 1.00 0.00 H ATOM 10441 C18 PA 307 99.420 66.296 48.737 1.00 0.00 C ATOM 10442 H8R PA 307 100.276 65.732 49.115 1.00 0.00 H ATOM 10443 H8S PA 307 98.548 65.659 48.577 1.00 0.00 H ATOM 10444 C17 PA 307 98.982 67.450 49.627 1.00 0.00 C ATOM 10445 H7R PA 307 98.252 68.074 49.107 1.00 0.00 H ATOM 10446 H7S PA 307 99.813 68.114 49.876 1.00 0.00 H ATOM 10447 C16 PA 307 98.463 67.025 50.905 1.00 0.00 C ATOM 10448 H6R PA 307 97.847 66.143 50.721 1.00 0.00 H ATOM 10449 H6S PA 307 97.845 67.819 51.331 1.00 0.00 H ATOM 10450 C15 PA 307 99.612 66.753 51.933 1.00 0.00 C ATOM 10451 H5R PA 307 100.296 67.603 51.971 1.00 0.00 H ATOM 10452 H5S PA 307 100.240 65.879 51.749 1.00 0.00 H ATOM 10453 C14 PA 307 99.200 66.455 53.392 1.00 0.00 C ATOM 10454 H4R PA 307 98.373 65.751 53.503 1.00 0.00 H ATOM 10455 H4S PA 307 98.714 67.286 53.907 1.00 0.00 H ATOM 10456 C13 PA 307 100.396 66.206 54.295 1.00 0.00 C ATOM 10457 H3R PA 307 101.018 67.101 54.228 1.00 0.00 H ATOM 10458 H3S PA 307 100.950 65.371 53.861 1.00 0.00 H ATOM 10459 C12 PA 307 100.083 65.944 55.808 1.00 0.00 C ATOM 10460 H2R PA 307 99.542 64.997 55.752 1.00 0.00 H ATOM 10461 H2S PA 307 99.472 66.755 56.209 1.00 0.00 H ATOM 10462 C11 PGR 308 101.238 65.713 56.671 1.00 0.00 C ATOM 10463 O12 PGR 308 102.266 65.273 56.203 1.00 0.00 O ATOM 10464 O11 PGR 308 101.081 66.089 57.948 1.00 0.00 O ATOM 10465 C1 PGR 308 102.157 65.755 58.937 1.00 0.00 C ATOM 10466 HR PGR 308 102.492 64.715 58.947 1.00 0.00 H ATOM 10467 HS PGR 308 101.765 65.877 59.949 1.00 0.00 H ATOM 10468 C2 PGR 308 103.523 66.470 58.719 1.00 0.00 C ATOM 10469 HX PGR 308 103.995 65.907 57.910 1.00 0.00 H ATOM 10470 C3 PGR 308 104.293 66.469 60.119 1.00 0.00 C ATOM 10471 HA PGR 308 104.997 67.305 60.119 1.00 0.00 H ATOM 10472 HB PGR 308 104.800 65.523 60.326 1.00 0.00 H ATOM 10473 O31 PGR 308 103.426 66.760 61.235 1.00 0.00 O ATOM 10474 P31 PGR 308 103.642 66.324 62.772 1.00 0.00 P ATOM 10475 O32 PGR 308 103.440 64.790 62.733 1.00 0.00 O ATOM 10476 C31 PGR 308 102.091 64.344 62.546 1.00 0.00 C ATOM 10477 H1A PGR 308 101.670 64.814 61.653 1.00 0.00 H ATOM 10478 H1B PGR 308 101.544 64.655 63.440 1.00 0.00 H ATOM 10479 C32 PGR 308 102.046 62.884 62.290 1.00 0.00 C ATOM 10480 H2A PGR 308 103.038 62.525 62.002 1.00 0.00 H ATOM 10481 O35 PGR 308 101.125 62.533 61.306 1.00 0.00 O ATOM 10482 HO5A PGR 308 101.397 61.616 61.118 1.00 0.00 H ATOM 10483 C33 PGR 308 101.674 62.192 63.585 1.00 0.00 C ATOM 10484 H3A PGR 308 101.659 61.127 63.339 1.00 0.00 H ATOM 10485 H3B PGR 308 102.535 62.349 64.240 1.00 0.00 H ATOM 10486 O33 PGR 308 105.100 66.531 62.987 1.00 0.00 O ATOM 10487 O34 PGR 308 102.734 67.091 63.610 1.00 0.00 O ATOM 10488 O21 PGR 308 103.256 67.790 58.281 1.00 0.00 O ATOM 10489 C21 PGR 308 104.173 68.396 57.490 1.00 0.00 C ATOM 10490 O22 PGR 308 105.277 67.955 57.141 1.00 0.00 O ATOM 10491 O36 PGR 308 100.427 62.700 64.110 1.00 0.00 O ATOM 10492 HO6A PGR 308 100.197 62.173 64.897 1.00 0.00 H ATOM 10493 C12 OL 309 103.583 69.679 56.990 1.00 0.00 C ATOM 10494 H2R OL 309 103.446 70.377 57.819 1.00 0.00 H ATOM 10495 H2S OL 309 104.414 70.103 56.422 1.00 0.00 H ATOM 10496 C13 OL 309 102.407 69.563 56.018 1.00 0.00 C ATOM 10497 H3R OL 309 102.535 68.989 55.097 1.00 0.00 H ATOM 10498 H3S OL 309 101.535 69.057 56.438 1.00 0.00 H ATOM 10499 C14 OL 309 102.030 70.955 55.457 1.00 0.00 C ATOM 10500 H4R OL 309 101.733 71.547 56.326 1.00 0.00 H ATOM 10501 H4S OL 309 102.928 71.387 55.010 1.00 0.00 H ATOM 10502 C15 OL 309 100.972 70.958 54.423 1.00 0.00 C ATOM 10503 H5R OL 309 101.243 70.216 53.669 1.00 0.00 H ATOM 10504 H5S OL 309 100.039 70.597 54.860 1.00 0.00 H ATOM 10505 C16 OL 309 100.778 72.270 53.770 1.00 0.00 C ATOM 10506 H6R OL 309 100.235 72.777 54.571 1.00 0.00 H ATOM 10507 H6S OL 309 101.775 72.675 53.586 1.00 0.00 H ATOM 10508 C17 OL 309 100.040 72.202 52.457 1.00 0.00 C ATOM 10509 H7R OL 309 100.744 71.730 51.768 1.00 0.00 H ATOM 10510 H7S OL 309 99.280 71.420 52.386 1.00 0.00 H ATOM 10511 C18 OL 309 99.624 73.552 51.857 1.00 0.00 C ATOM 10512 H8R OL 309 99.042 74.089 52.608 1.00 0.00 H ATOM 10513 H8S OL 309 100.494 74.187 51.677 1.00 0.00 H ATOM 10514 C19 OL 309 98.687 73.513 50.714 1.00 0.00 C ATOM 10515 H9R OL 309 97.714 73.036 50.794 1.00 0.00 H ATOM 10516 C110 OL 309 98.810 74.280 49.599 1.00 0.00 C ATOM 10517 H10R OL 309 98.027 74.234 48.846 1.00 0.00 H ATOM 10518 C111 OL 309 99.996 75.057 49.185 1.00 0.00 C ATOM 10519 H11R OL 309 99.760 75.767 48.389 1.00 0.00 H ATOM 10520 H11S OL 309 100.324 75.656 50.037 1.00 0.00 H ATOM 10521 C112 OL 309 101.144 74.186 48.598 1.00 0.00 C ATOM 10522 H12R OL 309 101.764 74.831 47.973 1.00 0.00 H ATOM 10523 H12S OL 309 101.789 73.864 49.418 1.00 0.00 H ATOM 10524 C113 OL 309 100.702 72.925 47.788 1.00 0.00 C ATOM 10525 H13R OL 309 100.045 72.381 48.471 1.00 0.00 H ATOM 10526 H13S OL 309 99.998 73.176 46.992 1.00 0.00 H ATOM 10527 C114 OL 309 101.812 71.974 47.434 1.00 0.00 C ATOM 10528 H14R OL 309 102.482 71.757 48.269 1.00 0.00 H ATOM 10529 H14S OL 309 101.255 71.059 47.220 1.00 0.00 H ATOM 10530 C115 OL 309 102.652 72.341 46.183 1.00 0.00 C ATOM 10531 H15R OL 309 103.470 73.010 46.462 1.00 0.00 H ATOM 10532 H15S OL 309 103.188 71.403 46.023 1.00 0.00 H ATOM 10533 C116 OL 309 101.951 72.859 44.877 1.00 0.00 C ATOM 10534 H16R OL 309 101.120 72.159 44.764 1.00 0.00 H ATOM 10535 H16S OL 309 101.479 73.785 45.213 1.00 0.00 H ATOM 10536 C117 OL 309 102.846 72.912 43.589 1.00 0.00 C ATOM 10537 H17R OL 309 103.201 73.939 43.696 1.00 0.00 H ATOM 10538 H17S OL 309 103.749 72.304 43.678 1.00 0.00 H ATOM 10539 C118 OL 309 102.200 72.711 42.197 1.00 0.00 C ATOM 10540 H18R OL 309 101.352 73.389 42.076 1.00 0.00 H ATOM 10541 H18S OL 309 101.911 71.665 42.076 1.00 0.00 H ATOM 10542 H18T OL 309 102.941 72.938 41.429 1.00 0.00 H TER 10543 OL 309 ATOM 10543 C116 PA 310 127.849 140.679 46.985 1.00 0.00 C ATOM 10544 H16R PA 310 127.315 141.069 47.854 1.00 0.00 H ATOM 10545 H16S PA 310 127.456 141.291 46.170 1.00 0.00 H ATOM 10546 H16T PA 310 128.910 140.880 47.143 1.00 0.00 H ATOM 10547 C115 PA 310 127.467 139.214 46.913 1.00 0.00 C ATOM 10548 H15R PA 310 127.872 138.691 46.045 1.00 0.00 H ATOM 10549 H15S PA 310 126.386 139.128 46.784 1.00 0.00 H ATOM 10550 C114 PA 310 127.894 138.462 48.166 1.00 0.00 C ATOM 10551 H14R PA 310 127.365 138.764 49.073 1.00 0.00 H ATOM 10552 H14S PA 310 128.927 138.744 48.379 1.00 0.00 H ATOM 10553 C113 PA 310 127.574 136.916 47.997 1.00 0.00 C ATOM 10554 H13R PA 310 128.108 136.624 47.091 1.00 0.00 H ATOM 10555 H13S PA 310 126.527 136.738 47.742 1.00 0.00 H ATOM 10556 C112 PA 310 128.039 136.059 49.190 1.00 0.00 C ATOM 10557 H12R PA 310 127.291 136.154 49.980 1.00 0.00 H ATOM 10558 H12S PA 310 128.977 136.478 49.561 1.00 0.00 H ATOM 10559 C111 PA 310 128.046 134.565 48.980 1.00 0.00 C ATOM 10560 H11R PA 310 128.251 134.067 49.930 1.00 0.00 H ATOM 10561 H11S PA 310 128.809 134.270 48.258 1.00 0.00 H ATOM 10562 C110 PA 310 126.771 133.997 48.527 1.00 0.00 C ATOM 10563 H10R PA 310 126.571 134.249 47.483 1.00 0.00 H ATOM 10564 H10S PA 310 125.934 134.370 49.119 1.00 0.00 H ATOM 10565 C19 PA 310 126.699 132.461 48.504 1.00 0.00 C ATOM 10566 H9R PA 310 126.754 131.967 49.476 1.00 0.00 H ATOM 10567 H9S PA 310 127.592 132.067 48.013 1.00 0.00 H ATOM 10568 C18 PA 310 125.528 131.890 47.758 1.00 0.00 C ATOM 10569 H8R PA 310 125.766 130.847 47.538 1.00 0.00 H ATOM 10570 H8S PA 310 125.455 132.274 46.738 1.00 0.00 H ATOM 10571 C17 PA 310 124.140 132.003 48.557 1.00 0.00 C ATOM 10572 H7R PA 310 123.384 131.440 48.007 1.00 0.00 H ATOM 10573 H7S PA 310 123.812 133.045 48.540 1.00 0.00 H ATOM 10574 C16 PA 310 124.166 131.560 50.069 1.00 0.00 C ATOM 10575 H6R PA 310 124.850 130.738 50.286 1.00 0.00 H ATOM 10576 H6S PA 310 123.134 131.305 50.321 1.00 0.00 H ATOM 10577 C15 PA 310 124.489 132.752 51.015 1.00 0.00 C ATOM 10578 H5R PA 310 124.221 133.655 50.463 1.00 0.00 H ATOM 10579 H5S PA 310 125.567 132.914 51.066 1.00 0.00 H ATOM 10580 C14 PA 310 124.058 132.619 52.513 1.00 0.00 C ATOM 10581 H4R PA 310 124.580 133.393 53.079 1.00 0.00 H ATOM 10582 H4S PA 310 124.406 131.685 52.961 1.00 0.00 H ATOM 10583 C13 PA 310 122.563 132.930 52.670 1.00 0.00 C ATOM 10584 H3R PA 310 121.955 132.025 52.721 1.00 0.00 H ATOM 10585 H3S PA 310 122.130 133.336 51.753 1.00 0.00 H ATOM 10586 C12 PA 310 122.287 133.875 53.812 1.00 0.00 C ATOM 10587 H2R PA 310 121.229 134.136 53.889 1.00 0.00 H ATOM 10588 H2S PA 310 122.861 134.804 53.803 1.00 0.00 H ATOM 10589 C11 PC 311 122.726 133.291 55.098 1.00 0.00 C ATOM 10590 O12 PC 311 122.979 133.971 56.036 1.00 0.00 O ATOM 10591 O11 PC 311 122.826 131.900 55.124 1.00 0.00 O ATOM 10592 C1 PC 311 123.125 131.292 56.416 1.00 0.00 C ATOM 10593 HR PC 311 122.390 131.818 57.030 1.00 0.00 H ATOM 10594 HS PC 311 124.141 131.431 56.796 1.00 0.00 H ATOM 10595 C2 PC 311 122.922 129.702 56.359 1.00 0.00 C ATOM 10596 HX PC 311 121.957 129.371 55.966 1.00 0.00 H ATOM 10597 C3 PC 311 122.977 129.069 57.733 1.00 0.00 C ATOM 10598 HA PC 311 122.924 127.978 57.688 1.00 0.00 H ATOM 10599 HB PC 311 122.049 129.378 58.221 1.00 0.00 H ATOM 10600 O31 PC 311 123.927 129.631 58.623 1.00 0.00 O ATOM 10601 P31 PC 311 124.090 129.219 60.116 1.00 0.00 P ATOM 10602 O32 PC 311 122.940 130.008 60.774 1.00 0.00 O ATOM 10603 C31 PC 311 123.033 131.390 60.854 1.00 0.00 C ATOM 10604 H1A PC 311 122.769 131.877 59.912 1.00 0.00 H ATOM 10605 H1B PC 311 124.039 131.729 61.113 1.00 0.00 H ATOM 10606 C32 PC 311 122.044 132.007 61.757 1.00 0.00 C ATOM 10607 H2A PC 311 120.989 131.828 61.547 1.00 0.00 H ATOM 10608 H2B PC 311 122.135 133.087 61.625 1.00 0.00 H ATOM 10609 N31 PC 311 122.148 131.772 63.251 1.00 0.00 N ATOM 10610 C33 PC 311 121.583 130.452 63.596 1.00 0.00 C ATOM 10611 H3A PC 311 121.456 130.267 64.664 1.00 0.00 H ATOM 10612 H3B PC 311 122.182 129.702 63.078 1.00 0.00 H ATOM 10613 H3C PC 311 120.611 130.367 63.109 1.00 0.00 H ATOM 10614 C34 PC 311 123.544 131.675 63.689 1.00 0.00 C ATOM 10615 H4A PC 311 124.106 132.602 63.566 1.00 0.00 H ATOM 10616 H4B PC 311 124.093 130.960 63.074 1.00 0.00 H ATOM 10617 H4C PC 311 123.691 131.273 64.693 1.00 0.00 H ATOM 10618 C35 PC 311 121.399 132.825 63.982 1.00 0.00 C ATOM 10619 H5A PC 311 121.556 133.790 63.497 1.00 0.00 H ATOM 10620 H5B PC 311 121.774 132.787 65.005 1.00 0.00 H ATOM 10621 H5C PC 311 120.329 132.628 63.894 1.00 0.00 H ATOM 10622 O33 PC 311 123.830 127.760 60.339 1.00 0.00 O ATOM 10623 O34 PC 311 125.381 129.725 60.668 1.00 0.00 O ATOM 10624 O21 PC 311 123.966 129.327 55.381 1.00 0.00 O ATOM 10625 C21 PC 311 123.884 128.076 54.848 1.00 0.00 C ATOM 10626 O22 PC 311 123.215 127.213 55.333 1.00 0.00 O ATOM 10627 C12 OL 312 124.572 127.977 53.535 1.00 0.00 C ATOM 10628 H2R OL 312 125.543 128.471 53.607 1.00 0.00 H ATOM 10629 H2S OL 312 124.900 126.943 53.409 1.00 0.00 H ATOM 10630 C13 OL 312 123.698 128.554 52.464 1.00 0.00 C ATOM 10631 H3R OL 312 123.198 129.405 52.932 1.00 0.00 H ATOM 10632 H3S OL 312 124.251 128.988 51.628 1.00 0.00 H ATOM 10633 C14 OL 312 122.651 127.635 51.777 1.00 0.00 C ATOM 10634 H4R OL 312 123.217 126.708 51.666 1.00 0.00 H ATOM 10635 H4S OL 312 121.882 127.486 52.538 1.00 0.00 H ATOM 10636 C15 OL 312 122.161 128.060 50.311 1.00 0.00 C ATOM 10637 H5R OL 312 121.415 127.314 50.028 1.00 0.00 H ATOM 10638 H5S OL 312 121.602 128.995 50.386 1.00 0.00 H ATOM 10639 C16 OL 312 123.311 128.023 49.204 1.00 0.00 C ATOM 10640 H6R OL 312 123.968 128.888 49.316 1.00 0.00 H ATOM 10641 H6S OL 312 123.900 127.111 49.322 1.00 0.00 H ATOM 10642 C17 OL 312 122.683 128.111 47.849 1.00 0.00 C ATOM 10643 H7R OL 312 122.129 127.189 47.660 1.00 0.00 H ATOM 10644 H7S OL 312 121.950 128.915 47.753 1.00 0.00 H ATOM 10645 C18 OL 312 123.621 128.291 46.655 1.00 0.00 C ATOM 10646 H8R OL 312 124.139 129.252 46.645 1.00 0.00 H ATOM 10647 H8S OL 312 124.382 127.509 46.695 1.00 0.00 H ATOM 10648 C19 OL 312 122.841 128.183 45.443 1.00 0.00 C ATOM 10649 H9R OL 312 122.351 127.228 45.273 1.00 0.00 H ATOM 10650 C110 OL 312 122.742 129.076 44.473 1.00 0.00 C ATOM 10651 H10R OL 312 122.084 128.897 43.626 1.00 0.00 H ATOM 10652 C111 OL 312 123.442 130.301 44.296 1.00 0.00 C ATOM 10653 H11R OL 312 124.312 130.406 44.949 1.00 0.00 H ATOM 10654 H11S OL 312 123.823 130.304 43.273 1.00 0.00 H ATOM 10655 C112 OL 312 122.418 131.418 44.409 1.00 0.00 C ATOM 10656 H12R OL 312 121.717 131.525 43.578 1.00 0.00 H ATOM 10657 H12S OL 312 121.892 131.087 45.307 1.00 0.00 H ATOM 10658 C113 OL 312 122.988 132.859 44.824 1.00 0.00 C ATOM 10659 H13R OL 312 123.407 132.916 45.831 1.00 0.00 H ATOM 10660 H13S OL 312 123.836 133.125 44.190 1.00 0.00 H ATOM 10661 C114 OL 312 121.983 134.005 44.546 1.00 0.00 C ATOM 10662 H14R OL 312 121.663 133.979 43.502 1.00 0.00 H ATOM 10663 H14S OL 312 121.110 133.710 45.131 1.00 0.00 H ATOM 10664 C115 OL 312 122.395 135.292 45.092 1.00 0.00 C ATOM 10665 H15R OL 312 123.456 135.380 44.847 1.00 0.00 H ATOM 10666 H15S OL 312 121.868 136.077 44.546 1.00 0.00 H ATOM 10667 C116 OL 312 122.298 135.414 46.581 1.00 0.00 C ATOM 10668 H16R OL 312 121.287 135.684 46.890 1.00 0.00 H ATOM 10669 H16S OL 312 122.511 134.419 46.978 1.00 0.00 H ATOM 10670 C117 OL 312 123.343 136.416 47.251 1.00 0.00 C ATOM 10671 H17R OL 312 123.084 136.385 48.312 1.00 0.00 H ATOM 10672 H17S OL 312 124.396 136.151 47.132 1.00 0.00 H ATOM 10673 C118 OL 312 123.373 137.846 46.629 1.00 0.00 C ATOM 10674 H18R OL 312 123.558 137.800 45.554 1.00 0.00 H ATOM 10675 H18S OL 312 124.135 138.408 47.173 1.00 0.00 H ATOM 10676 H18T OL 312 122.452 138.412 46.783 1.00 0.00 H TER 10677 OL 312 ATOM 10677 C116 PA 313 125.240 66.266 42.833 1.00 0.00 C ATOM 10678 H16R PA 313 124.805 65.291 42.604 1.00 0.00 H ATOM 10679 H16S PA 313 125.006 66.944 42.009 1.00 0.00 H ATOM 10680 H16T PA 313 124.903 66.655 43.797 1.00 0.00 H ATOM 10681 C115 PA 313 126.746 66.201 42.695 1.00 0.00 C ATOM 10682 H15R PA 313 127.042 67.221 42.948 1.00 0.00 H ATOM 10683 H15S PA 313 127.161 65.930 41.722 1.00 0.00 H ATOM 10684 C114 PA 313 127.398 65.407 43.828 1.00 0.00 C ATOM 10685 H14R PA 313 127.083 64.364 43.741 1.00 0.00 H ATOM 10686 H14S PA 313 126.936 65.783 44.743 1.00 0.00 H ATOM 10687 C113 PA 313 128.887 65.502 43.820 1.00 0.00 C ATOM 10688 H13R PA 313 129.086 66.575 43.849 1.00 0.00 H ATOM 10689 H13S PA 313 129.460 65.253 42.924 1.00 0.00 H ATOM 10690 C112 PA 313 129.683 64.793 44.950 1.00 0.00 C ATOM 10691 H12R PA 313 130.627 64.435 44.535 1.00 0.00 H ATOM 10692 H12S PA 313 128.988 64.062 45.369 1.00 0.00 H ATOM 10693 C111 PA 313 130.012 65.722 46.116 1.00 0.00 C ATOM 10694 H11R PA 313 129.059 66.070 46.521 1.00 0.00 H ATOM 10695 H11S PA 313 130.722 66.518 45.883 1.00 0.00 H ATOM 10696 C110 PA 313 130.653 64.920 47.332 1.00 0.00 C ATOM 10697 H10R PA 313 129.864 64.366 47.845 1.00 0.00 H ATOM 10698 H10S PA 313 130.860 65.719 48.047 1.00 0.00 H ATOM 10699 C19 PA 313 131.936 64.152 46.870 1.00 0.00 C ATOM 10700 H9R PA 313 132.598 64.752 46.244 1.00 0.00 H ATOM 10701 H9S PA 313 131.622 63.349 46.200 1.00 0.00 H ATOM 10702 C18 PA 313 132.705 63.578 48.039 1.00 0.00 C ATOM 10703 H8R PA 313 133.481 62.866 47.749 1.00 0.00 H ATOM 10704 H8S PA 313 132.088 63.014 48.742 1.00 0.00 H ATOM 10705 C17 PA 313 133.495 64.641 48.768 1.00 0.00 C ATOM 10706 H7R PA 313 132.751 65.342 49.154 1.00 0.00 H ATOM 10707 H7S PA 313 134.096 65.266 48.104 1.00 0.00 H ATOM 10708 C16 PA 313 134.351 64.132 49.910 1.00 0.00 C ATOM 10709 H6R PA 313 135.210 63.652 49.436 1.00 0.00 H ATOM 10710 H6S PA 313 133.816 63.215 50.166 1.00 0.00 H ATOM 10711 C15 PA 313 134.508 65.139 51.041 1.00 0.00 C ATOM 10712 H5R PA 313 135.135 64.584 51.741 1.00 0.00 H ATOM 10713 H5S PA 313 133.602 65.231 51.644 1.00 0.00 H ATOM 10714 C14 PA 313 135.207 66.471 50.778 1.00 0.00 C ATOM 10715 H4R PA 313 134.757 66.844 49.856 1.00 0.00 H ATOM 10716 H4S PA 313 136.251 66.212 50.592 1.00 0.00 H ATOM 10717 C13 PA 313 135.047 67.500 51.867 1.00 0.00 C ATOM 10718 H3R PA 313 135.763 68.311 51.716 1.00 0.00 H ATOM 10719 H3S PA 313 135.436 67.069 52.792 1.00 0.00 H ATOM 10720 C12 PA 313 133.640 68.031 52.022 1.00 0.00 C ATOM 10721 H2R PA 313 132.922 67.212 52.097 1.00 0.00 H ATOM 10722 H2S PA 313 133.311 68.559 51.125 1.00 0.00 H ATOM 10723 C11 PC 314 133.501 68.947 53.236 1.00 0.00 C ATOM 10724 O12 PC 314 132.456 69.281 53.635 1.00 0.00 O ATOM 10725 O11 PC 314 134.627 69.561 53.722 1.00 0.00 O ATOM 10726 C1 PC 314 134.542 70.454 54.874 1.00 0.00 C ATOM 10727 HR PC 314 133.803 71.254 54.777 1.00 0.00 H ATOM 10728 HS PC 314 135.464 71.015 55.047 1.00 0.00 H ATOM 10729 C2 PC 314 134.200 69.551 56.110 1.00 0.00 C ATOM 10730 HX PC 314 133.251 69.038 55.934 1.00 0.00 H ATOM 10731 C3 PC 314 134.088 70.391 57.423 1.00 0.00 C ATOM 10732 HA PC 314 133.261 71.106 57.432 1.00 0.00 H ATOM 10733 HB PC 314 135.036 70.881 57.664 1.00 0.00 H ATOM 10734 O31 PC 314 133.822 69.480 58.488 1.00 0.00 O ATOM 10735 P31 PC 314 133.861 69.896 60.005 1.00 0.00 P ATOM 10736 O32 PC 314 132.682 70.944 60.096 1.00 0.00 O ATOM 10737 C31 PC 314 132.909 72.344 60.395 1.00 0.00 C ATOM 10738 H1A PC 314 133.257 72.744 59.439 1.00 0.00 H ATOM 10739 H1B PC 314 133.725 72.464 61.112 1.00 0.00 H ATOM 10740 C32 PC 314 131.602 72.969 60.835 1.00 0.00 C ATOM 10741 H2A PC 314 130.788 72.548 60.242 1.00 0.00 H ATOM 10742 H2B PC 314 131.608 74.051 60.693 1.00 0.00 H ATOM 10743 N31 PC 314 131.132 72.768 62.219 1.00 0.00 N ATOM 10744 C33 PC 314 131.004 71.365 62.593 1.00 0.00 C ATOM 10745 H3A PC 314 130.443 71.182 63.512 1.00 0.00 H ATOM 10746 H3B PC 314 132.009 70.941 62.612 1.00 0.00 H ATOM 10747 H3C PC 314 130.556 70.877 61.726 1.00 0.00 H ATOM 10748 C34 PC 314 131.958 73.495 63.171 1.00 0.00 C ATOM 10749 H4A PC 314 131.808 74.545 62.916 1.00 0.00 H ATOM 10750 H4B PC 314 132.967 73.154 62.932 1.00 0.00 H ATOM 10751 H4C PC 314 131.641 73.118 64.145 1.00 0.00 H ATOM 10752 C35 PC 314 129.785 73.391 62.249 1.00 0.00 C ATOM 10753 H5A PC 314 129.370 73.192 63.238 1.00 0.00 H ATOM 10754 H5B PC 314 129.130 73.068 61.439 1.00 0.00 H ATOM 10755 H5C PC 314 129.807 74.477 62.147 1.00 0.00 H ATOM 10756 O33 PC 314 133.441 68.716 60.731 1.00 0.00 O ATOM 10757 O34 PC 314 135.092 70.539 60.482 1.00 0.00 O ATOM 10758 O21 PC 314 135.296 68.616 56.322 1.00 0.00 O ATOM 10759 C21 PC 314 135.119 67.476 57.020 1.00 0.00 C ATOM 10760 O22 PC 314 134.028 66.907 57.045 1.00 0.00 O TER 10761 PC 314 ATOM 10761 C12 OL 315 118.126 6.246 35.304 1.00 0.00 C ATOM 10762 H2R OL 315 117.250 6.436 34.680 1.00 0.00 H ATOM 10763 H2S OL 315 117.694 5.739 36.170 1.00 0.00 H ATOM 10764 C13 OL 315 118.634 7.635 35.722 1.00 0.00 C ATOM 10765 H3R OL 315 119.712 7.569 35.558 1.00 0.00 H ATOM 10766 H3S OL 315 118.404 8.340 34.921 1.00 0.00 H ATOM 10767 C14 OL 315 118.255 8.221 37.102 1.00 0.00 C ATOM 10768 H4R OL 315 118.453 9.293 37.033 1.00 0.00 H ATOM 10769 H4S OL 315 117.245 7.840 37.262 1.00 0.00 H ATOM 10770 C15 OL 315 119.119 7.576 38.258 1.00 0.00 C ATOM 10771 H5R OL 315 118.668 7.860 39.211 1.00 0.00 H ATOM 10772 H5S OL 315 119.024 6.495 38.135 1.00 0.00 H ATOM 10773 C16 OL 315 120.528 8.025 38.296 1.00 0.00 C ATOM 10774 H6R OL 315 121.115 7.787 37.406 1.00 0.00 H ATOM 10775 H6S OL 315 120.454 9.111 38.386 1.00 0.00 H ATOM 10776 C17 OL 315 121.277 7.611 39.537 1.00 0.00 C ATOM 10777 H7R OL 315 122.157 8.244 39.665 1.00 0.00 H ATOM 10778 H7S OL 315 120.662 7.588 40.439 1.00 0.00 H ATOM 10779 C18 OL 315 121.853 6.159 39.633 1.00 0.00 C ATOM 10780 H8R OL 315 121.036 5.472 39.864 1.00 0.00 H ATOM 10781 H8S OL 315 122.392 5.925 38.713 1.00 0.00 H ATOM 10782 C19 OL 315 122.770 5.885 40.775 1.00 0.00 C ATOM 10783 H9R OL 315 122.746 6.698 41.496 1.00 0.00 H ATOM 10784 C110 OL 315 123.693 4.877 40.910 1.00 0.00 C ATOM 10785 H10R OL 315 124.325 4.882 41.794 1.00 0.00 H ATOM 10786 C111 OL 315 123.787 3.673 40.055 1.00 0.00 C ATOM 10787 H11R OL 315 124.290 2.826 40.525 1.00 0.00 H ATOM 10788 H11S OL 315 122.742 3.399 39.893 1.00 0.00 H ATOM 10789 C112 OL 315 124.549 4.016 38.791 1.00 0.00 C ATOM 10790 H12R OL 315 124.013 4.700 38.130 1.00 0.00 H ATOM 10791 H12S OL 315 125.498 4.510 39.011 1.00 0.00 H ATOM 10792 C113 OL 315 124.857 2.784 37.997 1.00 0.00 C ATOM 10793 H13R OL 315 123.944 2.420 37.520 1.00 0.00 H ATOM 10794 H13S OL 315 125.544 3.073 37.200 1.00 0.00 H ATOM 10795 C114 OL 315 125.514 1.612 38.646 1.00 0.00 C ATOM 10796 H14R OL 315 124.783 1.196 39.343 1.00 0.00 H ATOM 10797 H14S OL 315 125.742 0.870 37.878 1.00 0.00 H ATOM 10798 C115 OL 315 126.858 1.961 39.316 1.00 0.00 C ATOM 10799 H15R OL 315 127.469 2.540 38.620 1.00 0.00 H ATOM 10800 H15S OL 315 126.677 2.609 40.176 1.00 0.00 H ATOM 10801 C116 OL 315 127.625 0.676 39.780 1.00 0.00 C ATOM 10802 H16R OL 315 127.631 -0.111 39.022 1.00 0.00 H ATOM 10803 H16S OL 315 128.605 1.042 40.091 1.00 0.00 H ATOM 10804 C117 OL 315 126.958 -0.201 40.899 1.00 0.00 C ATOM 10805 H17R OL 315 126.693 0.420 41.757 1.00 0.00 H ATOM 10806 H17S OL 315 126.037 -0.696 40.582 1.00 0.00 H ATOM 10807 C118 OL 315 127.812 -1.280 41.446 1.00 0.00 C ATOM 10808 H18R OL 315 128.376 -1.745 40.635 1.00 0.00 H ATOM 10809 H18S OL 315 127.155 -2.028 41.895 1.00 0.00 H ATOM 10810 H18T OL 315 128.563 -0.922 42.153 1.00 0.00 H TER 10811 OL 315 ATOM 10811 C116 PA 316 85.811 80.340 38.285 1.00 0.00 C ATOM 10812 H16R PA 316 85.740 81.125 37.529 1.00 0.00 H ATOM 10813 H16S PA 316 84.820 79.908 38.434 1.00 0.00 H ATOM 10814 H16T PA 316 86.543 79.605 37.944 1.00 0.00 H ATOM 10815 C115 PA 316 86.246 80.840 39.603 1.00 0.00 C ATOM 10816 H15R PA 316 87.309 81.086 39.553 1.00 0.00 H ATOM 10817 H15S PA 316 86.201 80.018 40.321 1.00 0.00 H ATOM 10818 C114 PA 316 85.380 81.920 40.198 1.00 0.00 C ATOM 10819 H14R PA 316 84.318 81.711 40.053 1.00 0.00 H ATOM 10820 H14S PA 316 85.429 82.720 39.457 1.00 0.00 H ATOM 10821 C113 PA 316 85.774 82.576 41.482 1.00 0.00 C ATOM 10822 H13R PA 316 86.850 82.760 41.512 1.00 0.00 H ATOM 10823 H13S PA 316 85.689 81.810 42.254 1.00 0.00 H ATOM 10824 C112 PA 316 84.945 83.754 41.939 1.00 0.00 C ATOM 10825 H12R PA 316 83.902 83.432 41.976 1.00 0.00 H ATOM 10826 H12S PA 316 84.880 84.419 41.076 1.00 0.00 H ATOM 10827 C111 PA 316 85.536 84.560 43.076 1.00 0.00 C ATOM 10828 H11R PA 316 86.543 84.877 42.795 1.00 0.00 H ATOM 10829 H11S PA 316 85.470 83.893 43.938 1.00 0.00 H ATOM 10830 C110 PA 316 84.790 85.858 43.510 1.00 0.00 C ATOM 10831 H10R PA 316 83.787 85.600 43.857 1.00 0.00 H ATOM 10832 H10S PA 316 84.474 86.490 42.677 1.00 0.00 H ATOM 10833 C19 PA 316 85.452 86.554 44.656 1.00 0.00 C ATOM 10834 H9R PA 316 84.949 87.518 44.760 1.00 0.00 H ATOM 10835 H9S PA 316 86.477 86.825 44.396 1.00 0.00 H ATOM 10836 C18 PA 316 85.373 85.798 46.006 1.00 0.00 C ATOM 10837 H8R PA 316 86.074 84.965 45.919 1.00 0.00 H ATOM 10838 H8S PA 316 84.412 85.280 46.016 1.00 0.00 H ATOM 10839 C17 PA 316 85.622 86.668 47.138 1.00 0.00 C ATOM 10840 H7R PA 316 84.778 87.355 47.223 1.00 0.00 H ATOM 10841 H7S PA 316 86.461 87.357 47.025 1.00 0.00 H ATOM 10842 C16 PA 316 85.640 85.955 48.537 1.00 0.00 C ATOM 10843 H6R PA 316 85.721 86.742 49.289 1.00 0.00 H ATOM 10844 H6S PA 316 86.530 85.345 48.369 1.00 0.00 H ATOM 10845 C15 PA 316 84.505 84.985 48.895 1.00 0.00 C ATOM 10846 H5R PA 316 84.224 84.260 48.129 1.00 0.00 H ATOM 10847 H5S PA 316 83.634 85.644 48.883 1.00 0.00 H ATOM 10848 C14 PA 316 84.593 84.274 50.248 1.00 0.00 C ATOM 10849 H4R PA 316 85.609 83.882 50.323 1.00 0.00 H ATOM 10850 H4S PA 316 83.894 83.441 50.347 1.00 0.00 H ATOM 10851 C13 PA 316 84.458 85.176 51.455 1.00 0.00 C ATOM 10852 H3R PA 316 83.491 85.682 51.506 1.00 0.00 H ATOM 10853 H3S PA 316 85.285 85.888 51.487 1.00 0.00 H ATOM 10854 C12 PA 316 84.669 84.426 52.768 1.00 0.00 C ATOM 10855 H2R PA 316 85.687 84.033 52.783 1.00 0.00 H ATOM 10856 H2S PA 316 84.005 83.561 52.816 1.00 0.00 H ATOM 10857 C11 PGR 317 84.553 85.319 54.023 1.00 0.00 C ATOM 10858 O12 PGR 317 83.503 85.505 54.628 1.00 0.00 O ATOM 10859 O11 PGR 317 85.689 85.985 54.317 1.00 0.00 O ATOM 10860 C1 PGR 317 85.587 87.000 55.236 1.00 0.00 C ATOM 10861 HR PGR 317 85.422 86.672 56.266 1.00 0.00 H ATOM 10862 HS PGR 317 84.866 87.640 54.720 1.00 0.00 H ATOM 10863 C2 PGR 317 86.945 87.729 55.110 1.00 0.00 C ATOM 10864 HX PGR 317 87.733 86.991 54.937 1.00 0.00 H ATOM 10865 C3 PGR 317 87.194 88.587 56.400 1.00 0.00 C ATOM 10866 HA PGR 317 86.956 88.021 57.304 1.00 0.00 H ATOM 10867 HB PGR 317 86.589 89.475 56.194 1.00 0.00 H ATOM 10868 O31 PGR 317 88.521 89.108 56.462 1.00 0.00 O ATOM 10869 P31 PGR 317 88.992 90.423 57.222 1.00 0.00 P ATOM 10870 O32 PGR 317 88.769 91.534 56.078 1.00 0.00 O ATOM 10871 C31 PGR 317 87.494 91.768 55.477 1.00 0.00 C ATOM 10872 H1A PGR 317 86.655 91.921 56.161 1.00 0.00 H ATOM 10873 H1B PGR 317 87.165 90.903 54.896 1.00 0.00 H ATOM 10874 C32 PGR 317 87.664 93.057 54.619 1.00 0.00 C ATOM 10875 H2A PGR 317 88.690 93.192 54.266 1.00 0.00 H ATOM 10876 O35 PGR 317 87.433 94.325 55.320 1.00 0.00 O ATOM 10877 HO5A PGR 317 88.098 94.313 56.031 1.00 0.00 H ATOM 10878 C33 PGR 317 86.734 93.000 53.336 1.00 0.00 C ATOM 10879 H3A PGR 317 86.745 93.863 52.666 1.00 0.00 H ATOM 10880 H3B PGR 317 87.084 92.080 52.863 1.00 0.00 H ATOM 10881 O33 PGR 317 88.137 90.647 58.391 1.00 0.00 O ATOM 10882 O34 PGR 317 90.443 90.327 57.342 1.00 0.00 O ATOM 10883 O21 PGR 317 86.970 88.617 54.000 1.00 0.00 O ATOM 10884 C21 PGR 317 88.155 88.947 53.473 1.00 0.00 C ATOM 10885 O22 PGR 317 89.264 88.630 53.868 1.00 0.00 O ATOM 10886 O36 PGR 317 85.347 92.704 53.708 1.00 0.00 O ATOM 10887 HO6A PGR 317 84.990 93.397 54.292 1.00 0.00 H ATOM 10888 C12 OL 318 87.903 89.630 52.170 1.00 0.00 C ATOM 10889 H2R OL 318 86.973 90.189 52.291 1.00 0.00 H ATOM 10890 H2S OL 318 88.710 90.364 52.123 1.00 0.00 H ATOM 10891 C13 OL 318 87.890 88.613 51.038 1.00 0.00 C ATOM 10892 H3R OL 318 88.765 87.999 51.262 1.00 0.00 H ATOM 10893 H3S OL 318 87.094 87.884 51.199 1.00 0.00 H ATOM 10894 C14 OL 318 87.844 89.285 49.617 1.00 0.00 C ATOM 10895 H4R OL 318 88.794 89.802 49.467 1.00 0.00 H ATOM 10896 H4S OL 318 87.866 88.560 48.801 1.00 0.00 H ATOM 10897 C15 OL 318 86.718 90.326 49.479 1.00 0.00 C ATOM 10898 H5R OL 318 86.855 91.108 50.229 1.00 0.00 H ATOM 10899 H5S OL 318 86.722 90.725 48.463 1.00 0.00 H ATOM 10900 C16 OL 318 85.350 89.746 49.665 1.00 0.00 C ATOM 10901 H6R OL 318 85.310 88.818 49.091 1.00 0.00 H ATOM 10902 H6S OL 318 85.379 89.397 50.700 1.00 0.00 H ATOM 10903 C17 OL 318 84.255 90.764 49.432 1.00 0.00 C ATOM 10904 H7R OL 318 84.372 91.552 50.178 1.00 0.00 H ATOM 10905 H7S OL 318 84.497 91.276 48.498 1.00 0.00 H ATOM 10906 C18 OL 318 82.789 90.345 49.371 1.00 0.00 C ATOM 10907 H8R OL 318 82.572 90.118 50.416 1.00 0.00 H ATOM 10908 H8S OL 318 82.171 91.183 49.042 1.00 0.00 H ATOM 10909 C19 OL 318 82.573 89.078 48.547 1.00 0.00 C ATOM 10910 H9R OL 318 82.491 88.208 49.194 1.00 0.00 H ATOM 10911 C110 OL 318 82.316 88.910 47.238 1.00 0.00 C ATOM 10912 H10R OL 318 82.133 87.898 46.887 1.00 0.00 H ATOM 10913 C111 OL 318 82.218 90.037 46.286 1.00 0.00 C ATOM 10914 H11R OL 318 81.283 89.952 45.728 1.00 0.00 H ATOM 10915 H11S OL 318 82.165 90.980 46.833 1.00 0.00 H ATOM 10916 C112 OL 318 83.189 90.080 45.133 1.00 0.00 C ATOM 10917 H12R OL 318 83.109 89.096 44.667 1.00 0.00 H ATOM 10918 H12S OL 318 82.920 90.883 44.443 1.00 0.00 H ATOM 10919 C113 OL 318 84.583 90.273 45.605 1.00 0.00 C ATOM 10920 H13R OL 318 84.737 91.297 45.951 1.00 0.00 H ATOM 10921 H13S OL 318 84.859 89.463 46.283 1.00 0.00 H ATOM 10922 C114 OL 318 85.507 90.193 44.329 1.00 0.00 C ATOM 10923 H14R OL 318 85.041 89.559 43.571 1.00 0.00 H ATOM 10924 H14S OL 318 85.423 91.211 43.944 1.00 0.00 H ATOM 10925 C115 OL 318 87.014 89.947 44.571 1.00 0.00 C ATOM 10926 H15R OL 318 87.095 89.115 45.274 1.00 0.00 H ATOM 10927 H15S OL 318 87.456 89.446 43.707 1.00 0.00 H ATOM 10928 C116 OL 318 87.889 91.094 45.125 1.00 0.00 C ATOM 10929 H16R OL 318 87.573 91.425 46.116 1.00 0.00 H ATOM 10930 H16S OL 318 88.910 90.716 45.218 1.00 0.00 H ATOM 10931 C117 OL 318 87.840 92.354 44.371 1.00 0.00 C ATOM 10932 H17R OL 318 87.906 92.058 43.322 1.00 0.00 H ATOM 10933 H17S OL 318 86.826 92.754 44.313 1.00 0.00 H ATOM 10934 C118 OL 318 88.787 93.408 44.901 1.00 0.00 C ATOM 10935 H18R OL 318 88.789 94.210 44.160 1.00 0.00 H ATOM 10936 H18S OL 318 89.848 93.157 44.968 1.00 0.00 H ATOM 10937 H18T OL 318 88.536 93.842 45.871 1.00 0.00 H TER 10938 OL 318 ATOM 10938 C116 PA 319 127.417 81.994 45.301 1.00 0.00 C ATOM 10939 H16R PA 319 126.681 82.268 44.542 1.00 0.00 H ATOM 10940 H16S PA 319 127.770 80.983 45.089 1.00 0.00 H ATOM 10941 H16T PA 319 128.332 82.591 45.290 1.00 0.00 H ATOM 10942 C115 PA 319 126.879 81.991 46.666 1.00 0.00 C ATOM 10943 H15R PA 319 126.739 83.024 46.993 1.00 0.00 H ATOM 10944 H15S PA 319 127.665 81.549 47.282 1.00 0.00 H ATOM 10945 C114 PA 319 125.710 81.071 46.743 1.00 0.00 C ATOM 10946 H14R PA 319 125.921 80.032 46.482 1.00 0.00 H ATOM 10947 H14S PA 319 124.887 81.346 46.080 1.00 0.00 H ATOM 10948 C113 PA 319 125.257 80.993 48.206 1.00 0.00 C ATOM 10949 H13R PA 319 125.211 82.008 48.605 1.00 0.00 H ATOM 10950 H13S PA 319 126.020 80.457 48.774 1.00 0.00 H ATOM 10951 C112 PA 319 123.909 80.331 48.362 1.00 0.00 C ATOM 10952 H12R PA 319 124.058 79.256 48.240 1.00 0.00 H ATOM 10953 H12S PA 319 123.145 80.667 47.658 1.00 0.00 H ATOM 10954 C111 PA 319 123.425 80.576 49.789 1.00 0.00 C ATOM 10955 H11R PA 319 123.555 81.653 49.915 1.00 0.00 H ATOM 10956 H11S PA 319 123.943 80.024 50.577 1.00 0.00 H ATOM 10957 C110 PA 319 122.053 80.061 49.949 1.00 0.00 C ATOM 10958 H10R PA 319 122.143 78.994 49.738 1.00 0.00 H ATOM 10959 H10S PA 319 121.411 80.523 49.196 1.00 0.00 H ATOM 10960 C19 PA 319 121.547 80.363 51.409 1.00 0.00 C ATOM 10961 H9R PA 319 121.709 81.400 51.709 1.00 0.00 H ATOM 10962 H9S PA 319 122.198 79.779 52.063 1.00 0.00 H ATOM 10963 C18 PA 319 120.100 80.006 51.670 1.00 0.00 C ATOM 10964 H8R PA 319 119.786 79.222 50.977 1.00 0.00 H ATOM 10965 H8S PA 319 119.576 80.934 51.436 1.00 0.00 H ATOM 10966 C17 PA 319 119.918 79.550 53.134 1.00 0.00 C ATOM 10967 H7R PA 319 120.744 78.863 53.330 1.00 0.00 H ATOM 10968 H7S PA 319 118.934 79.078 53.179 1.00 0.00 H ATOM 10969 C16 PA 319 119.985 80.650 54.125 1.00 0.00 C ATOM 10970 H6R PA 319 119.430 81.513 53.750 1.00 0.00 H ATOM 10971 H6S PA 319 121.032 80.929 54.262 1.00 0.00 H ATOM 10972 C15 PA 319 119.505 80.433 55.621 1.00 0.00 C ATOM 10973 H5R PA 319 118.529 79.951 55.708 1.00 0.00 H ATOM 10974 H5S PA 319 119.407 81.410 56.099 1.00 0.00 H ATOM 10975 C14 PA 319 120.434 79.535 56.400 1.00 0.00 C ATOM 10976 H4R PA 319 121.270 80.221 56.550 1.00 0.00 H ATOM 10977 H4S PA 319 120.748 78.660 55.826 1.00 0.00 H ATOM 10978 C13 PA 319 119.808 79.100 57.773 1.00 0.00 C ATOM 10979 H3R PA 319 119.202 79.893 58.214 1.00 0.00 H ATOM 10980 H3S PA 319 120.558 78.884 58.537 1.00 0.00 H ATOM 10981 C12 PA 319 118.886 77.832 57.469 1.00 0.00 C ATOM 10982 H2R PA 319 119.189 77.303 56.563 1.00 0.00 H ATOM 10983 H2S PA 319 117.820 78.050 57.373 1.00 0.00 H ATOM 10984 C11 PGR 320 118.833 76.877 58.656 1.00 0.00 C ATOM 10985 O12 PGR 320 118.477 77.287 59.776 1.00 0.00 O ATOM 10986 O11 PGR 320 119.048 75.549 58.342 1.00 0.00 O ATOM 10987 C1 PGR 320 118.947 74.675 59.459 1.00 0.00 C ATOM 10988 HR PGR 320 118.086 74.991 60.054 1.00 0.00 H ATOM 10989 HS PGR 320 119.901 74.747 59.987 1.00 0.00 H ATOM 10990 C2 PGR 320 118.692 73.218 58.951 1.00 0.00 C ATOM 10991 HX PGR 320 117.693 73.137 58.515 1.00 0.00 H ATOM 10992 C3 PGR 320 118.675 72.155 60.081 1.00 0.00 C ATOM 10993 HA PGR 320 118.236 71.219 59.727 1.00 0.00 H ATOM 10994 HB PGR 320 117.929 72.415 60.837 1.00 0.00 H ATOM 10995 O31 PGR 320 119.955 71.956 60.657 1.00 0.00 O ATOM 10996 P31 PGR 320 120.160 71.052 61.946 1.00 0.00 P ATOM 10997 O32 PGR 320 119.625 72.004 63.157 1.00 0.00 O ATOM 10998 C31 PGR 320 120.004 73.381 63.260 1.00 0.00 C ATOM 10999 H1A PGR 320 119.427 74.091 62.662 1.00 0.00 H ATOM 11000 H1B PGR 320 121.064 73.413 62.997 1.00 0.00 H ATOM 11001 C32 PGR 320 119.878 73.944 64.728 1.00 0.00 C ATOM 11002 H2A PGR 320 120.048 73.131 65.439 1.00 0.00 H ATOM 11003 O35 PGR 320 118.603 74.560 64.840 1.00 0.00 O ATOM 11004 HO5A PGR 320 117.867 73.922 64.862 1.00 0.00 H ATOM 11005 C33 PGR 320 121.077 74.914 64.958 1.00 0.00 C ATOM 11006 H3A PGR 320 122.032 74.382 64.968 1.00 0.00 H ATOM 11007 H3B PGR 320 121.191 75.598 64.113 1.00 0.00 H ATOM 11008 O33 PGR 320 119.216 69.907 61.859 1.00 0.00 O ATOM 11009 O34 PGR 320 121.586 70.847 62.100 1.00 0.00 O ATOM 11010 O21 PGR 320 119.717 72.859 57.993 1.00 0.00 O ATOM 11011 C21 PGR 320 119.294 71.941 57.102 1.00 0.00 C ATOM 11012 O22 PGR 320 118.244 71.278 57.198 1.00 0.00 O ATOM 11013 O36 PGR 320 120.857 75.638 66.220 1.00 0.00 O ATOM 11014 HO6A PGR 320 119.945 75.977 66.179 1.00 0.00 H ATOM 11015 C12 OL 321 120.333 71.484 56.028 1.00 0.00 C ATOM 11016 H2R OL 321 121.033 70.935 56.663 1.00 0.00 H ATOM 11017 H2S OL 321 119.745 70.866 55.346 1.00 0.00 H ATOM 11018 C13 OL 321 121.022 72.576 55.206 1.00 0.00 C ATOM 11019 H3R OL 321 121.629 73.224 55.842 1.00 0.00 H ATOM 11020 H3S OL 321 121.647 72.063 54.473 1.00 0.00 H ATOM 11021 C14 OL 321 119.995 73.422 54.385 1.00 0.00 C ATOM 11022 H4R OL 321 119.514 72.672 53.752 1.00 0.00 H ATOM 11023 H4S OL 321 119.307 73.880 55.099 1.00 0.00 H ATOM 11024 C15 OL 321 120.533 74.566 53.531 1.00 0.00 C ATOM 11025 H5R OL 321 120.419 75.438 54.179 1.00 0.00 H ATOM 11026 H5S OL 321 121.593 74.424 53.311 1.00 0.00 H ATOM 11027 C16 OL 321 119.562 74.885 52.384 1.00 0.00 C ATOM 11028 H6R OL 321 119.524 73.986 51.765 1.00 0.00 H ATOM 11029 H6S OL 321 118.594 74.911 52.888 1.00 0.00 H ATOM 11030 C17 OL 321 119.928 76.157 51.416 1.00 0.00 C ATOM 11031 H7R OL 321 119.257 76.229 50.558 1.00 0.00 H ATOM 11032 H7S OL 321 119.774 77.003 52.089 1.00 0.00 H ATOM 11033 C18 OL 321 121.417 76.209 51.023 1.00 0.00 C ATOM 11034 H8R OL 321 121.737 77.109 50.493 1.00 0.00 H ATOM 11035 H8S OL 321 122.147 76.182 51.835 1.00 0.00 H ATOM 11036 C19 OL 321 121.605 75.074 50.022 1.00 0.00 C ATOM 11037 H9R OL 321 121.837 74.100 50.444 1.00 0.00 H ATOM 11038 C110 OL 321 121.552 75.112 48.715 1.00 0.00 C ATOM 11039 H10R OL 321 121.812 74.246 48.112 1.00 0.00 H ATOM 11040 C111 OL 321 121.140 76.336 47.863 1.00 0.00 C ATOM 11041 H11R OL 321 120.330 75.995 47.214 1.00 0.00 H ATOM 11042 H11S OL 321 120.835 77.170 48.498 1.00 0.00 H ATOM 11043 C112 OL 321 122.222 76.676 46.825 1.00 0.00 C ATOM 11044 H12R OL 321 123.061 77.101 47.382 1.00 0.00 H ATOM 11045 H12S OL 321 122.491 75.725 46.362 1.00 0.00 H ATOM 11046 C113 OL 321 121.763 77.679 45.759 1.00 0.00 C ATOM 11047 H13R OL 321 120.922 77.202 45.253 1.00 0.00 H ATOM 11048 H13S OL 321 121.292 78.596 46.118 1.00 0.00 H ATOM 11049 C114 OL 321 122.951 78.075 44.891 1.00 0.00 C ATOM 11050 H14R OL 321 123.837 78.351 45.467 1.00 0.00 H ATOM 11051 H14S OL 321 123.046 77.221 44.218 1.00 0.00 H ATOM 11052 C115 OL 321 122.636 79.261 44.025 1.00 0.00 C ATOM 11053 H15R OL 321 121.755 79.041 43.420 1.00 0.00 H ATOM 11054 H15S OL 321 122.275 80.120 44.595 1.00 0.00 H ATOM 11055 C116 OL 321 123.793 79.755 43.161 1.00 0.00 C ATOM 11056 H16R OL 321 123.309 80.548 42.586 1.00 0.00 H ATOM 11057 H16S OL 321 124.558 80.222 43.784 1.00 0.00 H ATOM 11058 C117 OL 321 124.364 78.671 42.291 1.00 0.00 C ATOM 11059 H17R OL 321 125.051 78.081 42.901 1.00 0.00 H ATOM 11060 H17S OL 321 123.525 78.044 41.983 1.00 0.00 H ATOM 11061 C118 OL 321 125.164 79.139 41.132 1.00 0.00 C ATOM 11062 H18R OL 321 124.738 79.684 40.287 1.00 0.00 H ATOM 11063 H18S OL 321 125.551 78.245 40.639 1.00 0.00 H ATOM 11064 H18T OL 321 125.992 79.771 41.461 1.00 0.00 H TER 11065 OL 321 ATOM 11065 C116 PA 322 67.685 42.256 49.201 1.00 0.00 C ATOM 11066 H16R PA 322 67.959 43.075 48.533 1.00 0.00 H ATOM 11067 H16S PA 322 66.627 42.367 49.448 1.00 0.00 H ATOM 11068 H16T PA 322 67.927 41.324 48.686 1.00 0.00 H ATOM 11069 C115 PA 322 68.534 42.433 50.438 1.00 0.00 C ATOM 11070 H15R PA 322 68.332 41.543 51.037 1.00 0.00 H ATOM 11071 H15S PA 322 68.039 43.235 50.989 1.00 0.00 H ATOM 11072 C114 PA 322 69.991 42.585 50.232 1.00 0.00 C ATOM 11073 H14R PA 322 70.372 41.688 49.740 1.00 0.00 H ATOM 11074 H14S PA 322 70.543 42.519 51.172 1.00 0.00 H ATOM 11075 C113 PA 322 70.511 43.741 49.437 1.00 0.00 C ATOM 11076 H13R PA 322 69.578 44.284 49.269 1.00 0.00 H ATOM 11077 H13S PA 322 70.845 43.520 48.421 1.00 0.00 H ATOM 11078 C112 PA 322 71.403 44.606 50.269 1.00 0.00 C ATOM 11079 H12R PA 322 72.289 43.974 50.363 1.00 0.00 H ATOM 11080 H12S PA 322 70.969 44.704 51.267 1.00 0.00 H ATOM 11081 C111 PA 322 71.646 46.042 49.714 1.00 0.00 C ATOM 11082 H11R PA 322 70.669 46.412 49.396 1.00 0.00 H ATOM 11083 H11S PA 322 72.472 45.998 49.001 1.00 0.00 H ATOM 11084 C110 PA 322 72.139 47.105 50.738 1.00 0.00 C ATOM 11085 H10R PA 322 73.015 46.698 51.247 1.00 0.00 H ATOM 11086 H10S PA 322 71.305 47.167 51.440 1.00 0.00 H ATOM 11087 C19 PA 322 72.485 48.410 50.101 1.00 0.00 C ATOM 11088 H9R PA 322 71.574 48.774 49.623 1.00 0.00 H ATOM 11089 H9S PA 322 73.188 48.130 49.313 1.00 0.00 H ATOM 11090 C18 PA 322 72.979 49.560 51.069 1.00 0.00 C ATOM 11091 H8R PA 322 72.196 49.726 51.812 1.00 0.00 H ATOM 11092 H8S PA 322 73.182 50.412 50.416 1.00 0.00 H ATOM 11093 C17 PA 322 74.188 49.255 51.831 1.00 0.00 C ATOM 11094 H7R PA 322 74.918 48.854 51.125 1.00 0.00 H ATOM 11095 H7S PA 322 74.017 48.533 52.631 1.00 0.00 H ATOM 11096 C16 PA 322 74.847 50.418 52.499 1.00 0.00 C ATOM 11097 H6R PA 322 75.223 51.090 51.725 1.00 0.00 H ATOM 11098 H6S PA 322 75.757 50.155 53.042 1.00 0.00 H ATOM 11099 C15 PA 322 73.963 51.182 53.427 1.00 0.00 C ATOM 11100 H5R PA 322 73.846 50.509 54.279 1.00 0.00 H ATOM 11101 H5S PA 322 72.974 51.514 53.107 1.00 0.00 H ATOM 11102 C14 PA 322 74.508 52.543 53.822 1.00 0.00 C ATOM 11103 H4R PA 322 74.395 53.163 52.930 1.00 0.00 H ATOM 11104 H4S PA 322 75.595 52.464 53.881 1.00 0.00 H ATOM 11105 C13 PA 322 73.866 53.131 55.175 1.00 0.00 C ATOM 11106 H3R PA 322 74.140 52.528 56.044 1.00 0.00 H ATOM 11107 H3S PA 322 72.800 52.962 55.011 1.00 0.00 H ATOM 11108 C12 PA 322 74.275 54.543 55.636 1.00 0.00 C ATOM 11109 H2R PA 322 73.922 55.375 55.023 1.00 0.00 H ATOM 11110 H2S PA 322 75.365 54.551 55.569 1.00 0.00 H ATOM 11111 C11 PGR 323 73.753 54.854 57.013 1.00 0.00 C ATOM 11112 O12 PGR 323 73.037 55.760 57.265 1.00 0.00 O ATOM 11113 O11 PGR 323 74.198 54.026 57.957 1.00 0.00 O ATOM 11114 C1 PGR 323 74.059 54.376 59.392 1.00 0.00 C ATOM 11115 HR PGR 323 74.080 53.469 60.002 1.00 0.00 H ATOM 11116 HS PGR 323 73.124 54.934 59.487 1.00 0.00 H ATOM 11117 C2 PGR 323 75.344 55.245 59.729 1.00 0.00 C ATOM 11118 HX PGR 323 76.273 54.732 59.469 1.00 0.00 H ATOM 11119 C3 PGR 323 75.363 55.575 61.170 1.00 0.00 C ATOM 11120 HA PGR 323 75.695 54.682 61.705 1.00 0.00 H ATOM 11121 HB PGR 323 74.319 55.784 61.416 1.00 0.00 H ATOM 11122 O31 PGR 323 76.268 56.632 61.497 1.00 0.00 O ATOM 11123 P31 PGR 323 76.801 56.804 62.958 1.00 0.00 P ATOM 11124 O32 PGR 323 77.671 55.388 62.974 1.00 0.00 O ATOM 11125 C31 PGR 323 77.790 54.618 64.098 1.00 0.00 C ATOM 11126 H1A PGR 323 76.763 54.422 64.416 1.00 0.00 H ATOM 11127 H1B PGR 323 78.329 55.205 64.847 1.00 0.00 H ATOM 11128 C32 PGR 323 78.554 53.283 63.913 1.00 0.00 C ATOM 11129 H2A PGR 323 78.827 52.796 64.853 1.00 0.00 H ATOM 11130 O35 PGR 323 79.767 53.553 63.170 1.00 0.00 O ATOM 11131 HO5A PGR 323 79.704 54.430 62.752 1.00 0.00 H ATOM 11132 C33 PGR 323 77.733 52.390 62.958 1.00 0.00 C ATOM 11133 H3A PGR 323 76.823 52.145 63.513 1.00 0.00 H ATOM 11134 H3B PGR 323 77.430 52.886 62.033 1.00 0.00 H ATOM 11135 O33 PGR 323 77.737 57.966 63.122 1.00 0.00 O ATOM 11136 O34 PGR 323 75.659 56.756 63.901 1.00 0.00 O ATOM 11137 O21 PGR 323 75.215 56.575 58.954 1.00 0.00 O ATOM 11138 C21 PGR 323 76.386 57.152 58.549 1.00 0.00 C ATOM 11139 O22 PGR 323 77.492 56.789 58.832 1.00 0.00 O ATOM 11140 O36 PGR 323 78.498 51.210 62.494 1.00 0.00 O ATOM 11141 HO6A PGR 323 78.177 51.100 61.582 1.00 0.00 H ATOM 11142 C12 OL 324 76.119 58.424 57.833 1.00 0.00 C ATOM 11143 H2R OL 324 77.067 58.603 57.322 1.00 0.00 H ATOM 11144 H2S OL 324 75.429 58.173 57.024 1.00 0.00 H ATOM 11145 C13 OL 324 75.780 59.607 58.737 1.00 0.00 C ATOM 11146 H3R OL 324 75.479 59.156 59.685 1.00 0.00 H ATOM 11147 H3S OL 324 76.613 60.288 58.924 1.00 0.00 H ATOM 11148 C14 OL 324 74.536 60.459 58.266 1.00 0.00 C ATOM 11149 H4R OL 324 74.441 61.295 58.962 1.00 0.00 H ATOM 11150 H4S OL 324 74.724 60.786 57.242 1.00 0.00 H ATOM 11151 C15 OL 324 73.217 59.694 58.249 1.00 0.00 C ATOM 11152 H5R OL 324 73.285 58.804 57.620 1.00 0.00 H ATOM 11153 H5S OL 324 72.860 59.268 59.189 1.00 0.00 H ATOM 11154 C16 OL 324 72.012 60.468 57.643 1.00 0.00 C ATOM 11155 H6R OL 324 71.056 59.951 57.748 1.00 0.00 H ATOM 11156 H6S OL 324 71.921 61.360 58.265 1.00 0.00 H ATOM 11157 C17 OL 324 72.106 61.087 56.206 1.00 0.00 C ATOM 11158 H7R OL 324 73.055 61.626 56.155 1.00 0.00 H ATOM 11159 H7S OL 324 72.309 60.187 55.622 1.00 0.00 H ATOM 11160 C18 OL 324 70.896 61.952 55.875 1.00 0.00 C ATOM 11161 H8R OL 324 70.855 62.759 56.609 1.00 0.00 H ATOM 11162 H8S OL 324 71.046 62.399 54.890 1.00 0.00 H ATOM 11163 C19 OL 324 69.660 61.066 55.876 1.00 0.00 C ATOM 11164 H9R OL 324 69.330 60.640 56.820 1.00 0.00 H ATOM 11165 C110 OL 324 68.840 60.767 54.853 1.00 0.00 C ATOM 11166 H10R OL 324 68.038 60.053 55.022 1.00 0.00 H ATOM 11167 C111 OL 324 68.951 61.202 53.424 1.00 0.00 C ATOM 11168 H11R OL 324 68.858 62.288 53.357 1.00 0.00 H ATOM 11169 H11S OL 324 69.959 60.926 53.106 1.00 0.00 H ATOM 11170 C112 OL 324 67.950 60.658 52.533 1.00 0.00 C ATOM 11171 H12R OL 324 66.938 60.663 52.943 1.00 0.00 H ATOM 11172 H12S OL 324 67.715 61.427 51.794 1.00 0.00 H ATOM 11173 C113 OL 324 68.451 59.428 51.816 1.00 0.00 C ATOM 11174 H13R OL 324 69.436 59.555 51.362 1.00 0.00 H ATOM 11175 H13S OL 324 68.655 58.715 52.618 1.00 0.00 H ATOM 11176 C114 OL 324 67.450 58.783 50.820 1.00 0.00 C ATOM 11177 H14R OL 324 66.444 58.902 51.228 1.00 0.00 H ATOM 11178 H14S OL 324 67.474 59.329 49.874 1.00 0.00 H ATOM 11179 C115 OL 324 67.734 57.340 50.375 1.00 0.00 C ATOM 11180 H15R OL 324 66.946 56.914 49.751 1.00 0.00 H ATOM 11181 H15S OL 324 68.723 57.198 49.932 1.00 0.00 H ATOM 11182 C116 OL 324 67.741 56.372 51.477 1.00 0.00 C ATOM 11183 H16R OL 324 68.084 55.415 51.077 1.00 0.00 H ATOM 11184 H16S OL 324 68.548 56.577 52.183 1.00 0.00 H ATOM 11185 C117 OL 324 66.410 56.104 52.210 1.00 0.00 C ATOM 11186 H17R OL 324 66.060 57.031 52.668 1.00 0.00 H ATOM 11187 H17S OL 324 65.616 55.768 51.540 1.00 0.00 H ATOM 11188 C118 OL 324 66.537 55.141 53.377 1.00 0.00 C ATOM 11189 H18R OL 324 67.370 55.530 53.965 1.00 0.00 H ATOM 11190 H18S OL 324 66.873 54.135 53.116 1.00 0.00 H ATOM 11191 H18T OL 324 65.677 54.931 54.017 1.00 0.00 H TER 11192 OL 324 ATOM 11192 C116 PA 325 41.676 77.148 42.542 1.00 0.00 C ATOM 11193 H16R PA 325 40.786 77.358 41.945 1.00 0.00 H ATOM 11194 H16S PA 325 41.688 76.063 42.422 1.00 0.00 H ATOM 11195 H16T PA 325 42.594 77.434 42.023 1.00 0.00 H ATOM 11196 C115 PA 325 41.498 77.499 43.996 1.00 0.00 C ATOM 11197 H15R PA 325 40.691 76.827 44.296 1.00 0.00 H ATOM 11198 H15S PA 325 41.185 78.546 44.008 1.00 0.00 H ATOM 11199 C114 PA 325 42.584 77.237 45.060 1.00 0.00 C ATOM 11200 H14R PA 325 43.547 77.725 44.897 1.00 0.00 H ATOM 11201 H14S PA 325 42.896 76.193 45.135 1.00 0.00 H ATOM 11202 C113 PA 325 42.246 77.586 46.529 1.00 0.00 C ATOM 11203 H13R PA 325 41.484 76.911 46.922 1.00 0.00 H ATOM 11204 H13S PA 325 41.768 78.568 46.494 1.00 0.00 H ATOM 11205 C112 PA 325 43.380 77.711 47.471 1.00 0.00 C ATOM 11206 H12R PA 325 44.138 78.359 47.027 1.00 0.00 H ATOM 11207 H12S PA 325 43.965 76.789 47.501 1.00 0.00 H ATOM 11208 C111 PA 325 43.020 78.225 48.856 1.00 0.00 C ATOM 11209 H11R PA 325 44.029 78.323 49.261 1.00 0.00 H ATOM 11210 H11S PA 325 42.518 77.364 49.301 1.00 0.00 H ATOM 11211 C110 PA 325 42.252 79.525 48.908 1.00 0.00 C ATOM 11212 H10R PA 325 41.963 79.739 49.939 1.00 0.00 H ATOM 11213 H10S PA 325 41.366 79.485 48.271 1.00 0.00 H ATOM 11214 C19 PA 325 43.189 80.705 48.582 1.00 0.00 C ATOM 11215 H9R PA 325 43.573 80.585 47.567 1.00 0.00 H ATOM 11216 H9S PA 325 43.989 80.655 49.324 1.00 0.00 H ATOM 11217 C18 PA 325 42.395 81.990 48.749 1.00 0.00 C ATOM 11218 H8R PA 325 41.921 81.955 49.733 1.00 0.00 H ATOM 11219 H8S PA 325 41.572 82.079 48.036 1.00 0.00 H ATOM 11220 C17 PA 325 43.244 83.209 48.523 1.00 0.00 C ATOM 11221 H7R PA 325 43.587 83.198 47.487 1.00 0.00 H ATOM 11222 H7S PA 325 44.149 83.133 49.129 1.00 0.00 H ATOM 11223 C16 PA 325 42.512 84.482 48.831 1.00 0.00 C ATOM 11224 H6R PA 325 41.434 84.402 48.675 1.00 0.00 H ATOM 11225 H6S PA 325 42.732 85.284 48.124 1.00 0.00 H ATOM 11226 C15 PA 325 42.711 85.018 50.220 1.00 0.00 C ATOM 11227 H5R PA 325 43.743 85.311 50.426 1.00 0.00 H ATOM 11228 H5S PA 325 42.595 84.199 50.933 1.00 0.00 H ATOM 11229 C14 PA 325 41.669 85.997 50.653 1.00 0.00 C ATOM 11230 H4R PA 325 40.795 85.407 50.937 1.00 0.00 H ATOM 11231 H4S PA 325 41.446 86.608 49.776 1.00 0.00 H ATOM 11232 C13 PA 325 41.986 86.853 51.873 1.00 0.00 C ATOM 11233 H3R PA 325 42.863 87.460 51.640 1.00 0.00 H ATOM 11234 H3S PA 325 42.184 86.255 52.765 1.00 0.00 H ATOM 11235 C12 PA 325 40.833 87.760 52.242 1.00 0.00 C ATOM 11236 H2R PA 325 39.904 87.214 52.415 1.00 0.00 H ATOM 11237 H2S PA 325 40.451 88.359 51.412 1.00 0.00 H ATOM 11238 C11 PC 326 41.206 88.672 53.419 1.00 0.00 C ATOM 11239 O12 PC 326 40.610 88.639 54.503 1.00 0.00 O ATOM 11240 O11 PC 326 41.974 89.696 53.014 1.00 0.00 O ATOM 11241 C1 PC 326 42.434 90.686 53.917 1.00 0.00 C ATOM 11242 HR PC 326 41.521 91.076 54.375 1.00 0.00 H ATOM 11243 HS PC 326 43.069 91.420 53.413 1.00 0.00 H ATOM 11244 C2 PC 326 43.270 90.122 55.090 1.00 0.00 C ATOM 11245 HX PC 326 42.843 89.191 55.469 1.00 0.00 H ATOM 11246 C3 PC 326 43.490 91.139 56.274 1.00 0.00 C ATOM 11247 HA PC 326 42.519 91.461 56.660 1.00 0.00 H ATOM 11248 HB PC 326 43.982 92.017 55.848 1.00 0.00 H ATOM 11249 O31 PC 326 44.386 90.618 57.220 1.00 0.00 O ATOM 11250 P31 PC 326 43.745 89.671 58.334 1.00 0.00 P ATOM 11251 O32 PC 326 42.832 90.618 59.130 1.00 0.00 O ATOM 11252 C31 PC 326 43.256 91.836 59.799 1.00 0.00 C ATOM 11253 H1A PC 326 43.608 92.560 59.059 1.00 0.00 H ATOM 11254 H1B PC 326 44.051 91.690 60.534 1.00 0.00 H ATOM 11255 C32 PC 326 42.220 92.389 60.644 1.00 0.00 C ATOM 11256 H2A PC 326 41.283 92.511 60.099 1.00 0.00 H ATOM 11257 H2B PC 326 42.529 93.362 61.030 1.00 0.00 H ATOM 11258 N31 PC 326 41.915 91.761 61.984 1.00 0.00 N ATOM 11259 C33 PC 326 41.059 92.612 62.790 1.00 0.00 C ATOM 11260 H3A PC 326 41.627 93.480 63.128 1.00 0.00 H ATOM 11261 H3B PC 326 40.660 91.950 63.560 1.00 0.00 H ATOM 11262 H3C PC 326 40.279 92.920 62.092 1.00 0.00 H ATOM 11263 C34 PC 326 41.373 90.338 61.797 1.00 0.00 C ATOM 11264 H4A PC 326 41.316 89.782 62.734 1.00 0.00 H ATOM 11265 H4B PC 326 42.080 89.821 61.146 1.00 0.00 H ATOM 11266 H4C PC 326 40.370 90.310 61.370 1.00 0.00 H ATOM 11267 C35 PC 326 43.120 91.716 62.834 1.00 0.00 C ATOM 11268 H5A PC 326 43.880 91.042 62.436 1.00 0.00 H ATOM 11269 H5B PC 326 42.753 91.423 63.819 1.00 0.00 H ATOM 11270 H5C PC 326 43.498 92.732 62.960 1.00 0.00 H ATOM 11271 O33 PC 326 42.967 88.622 57.668 1.00 0.00 O ATOM 11272 O34 PC 326 44.849 89.180 59.222 1.00 0.00 O ATOM 11273 O21 PC 326 44.534 89.857 54.493 1.00 0.00 O ATOM 11274 C21 PC 326 44.839 88.594 54.084 1.00 0.00 C ATOM 11275 O22 PC 326 44.076 87.632 54.200 1.00 0.00 O ATOM 11276 C12 OL 327 46.246 88.415 53.444 1.00 0.00 C ATOM 11277 H2R OL 327 46.702 89.398 53.312 1.00 0.00 H ATOM 11278 H2S OL 327 46.894 87.886 54.146 1.00 0.00 H ATOM 11279 C13 OL 327 46.060 87.719 52.057 1.00 0.00 C ATOM 11280 H3R OL 327 45.334 86.925 52.245 1.00 0.00 H ATOM 11281 H3S OL 327 45.701 88.458 51.338 1.00 0.00 H ATOM 11282 C14 OL 327 47.282 87.053 51.514 1.00 0.00 C ATOM 11283 H4R OL 327 48.123 87.745 51.589 1.00 0.00 H ATOM 11284 H4S OL 327 47.604 86.304 52.240 1.00 0.00 H ATOM 11285 C15 OL 327 47.175 86.322 50.167 1.00 0.00 C ATOM 11286 H5R OL 327 48.075 85.747 49.940 1.00 0.00 H ATOM 11287 H5S OL 327 46.505 85.460 50.191 1.00 0.00 H ATOM 11288 C16 OL 327 46.930 87.315 48.998 1.00 0.00 C ATOM 11289 H6R OL 327 45.942 87.780 48.957 1.00 0.00 H ATOM 11290 H6S OL 327 47.679 88.103 49.097 1.00 0.00 H ATOM 11291 C17 OL 327 47.088 86.689 47.597 1.00 0.00 C ATOM 11292 H7R OL 327 48.028 86.156 47.441 1.00 0.00 H ATOM 11293 H7S OL 327 46.335 85.903 47.510 1.00 0.00 H ATOM 11294 C18 OL 327 46.843 87.796 46.513 1.00 0.00 C ATOM 11295 H8R OL 327 45.855 88.226 46.690 1.00 0.00 H ATOM 11296 H8S OL 327 47.585 88.595 46.580 1.00 0.00 H ATOM 11297 C19 OL 327 46.839 87.274 45.106 1.00 0.00 C ATOM 11298 H9R OL 327 46.050 86.546 44.931 1.00 0.00 H ATOM 11299 C110 OL 327 47.567 87.636 44.019 1.00 0.00 C ATOM 11300 H10R OL 327 47.366 87.205 43.041 1.00 0.00 H ATOM 11301 C111 OL 327 48.716 88.562 44.141 1.00 0.00 C ATOM 11302 H11R OL 327 48.893 88.911 45.161 1.00 0.00 H ATOM 11303 H11S OL 327 49.637 88.008 43.952 1.00 0.00 H ATOM 11304 C112 OL 327 48.618 89.826 43.185 1.00 0.00 C ATOM 11305 H12R OL 327 49.434 90.522 43.389 1.00 0.00 H ATOM 11306 H12S OL 327 48.772 89.383 42.198 1.00 0.00 H ATOM 11307 C113 OL 327 47.343 90.697 43.323 1.00 0.00 C ATOM 11308 H13R OL 327 47.398 91.558 42.654 1.00 0.00 H ATOM 11309 H13S OL 327 46.448 90.146 43.026 1.00 0.00 H ATOM 11310 C114 OL 327 47.047 91.165 44.751 1.00 0.00 C ATOM 11311 H14R OL 327 47.336 90.380 45.452 1.00 0.00 H ATOM 11312 H14S OL 327 47.857 91.878 44.920 1.00 0.00 H ATOM 11313 C115 OL 327 45.536 91.553 44.886 1.00 0.00 C ATOM 11314 H15R OL 327 45.365 92.405 44.226 1.00 0.00 H ATOM 11315 H15S OL 327 44.902 90.738 44.531 1.00 0.00 H ATOM 11316 C116 OL 327 45.158 91.873 46.350 1.00 0.00 C ATOM 11317 H16R OL 327 45.313 91.024 47.019 1.00 0.00 H ATOM 11318 H16S OL 327 45.868 92.589 46.769 1.00 0.00 H ATOM 11319 C117 OL 327 43.769 92.480 46.608 1.00 0.00 C ATOM 11320 H17R OL 327 42.958 91.826 46.278 1.00 0.00 H ATOM 11321 H17S OL 327 43.605 92.540 47.686 1.00 0.00 H ATOM 11322 C118 OL 327 43.408 93.790 45.883 1.00 0.00 C ATOM 11323 H18R OL 327 42.381 93.977 46.205 1.00 0.00 H ATOM 11324 H18S OL 327 43.357 93.672 44.799 1.00 0.00 H ATOM 11325 H18T OL 327 43.894 94.694 46.256 1.00 0.00 H TER 11326 OL 327 ATOM 11326 C116 PA 328 53.477 42.636 41.313 1.00 0.00 C ATOM 11327 H16R PA 328 53.860 43.610 41.625 1.00 0.00 H ATOM 11328 H16S PA 328 52.522 42.935 40.877 1.00 0.00 H ATOM 11329 H16T PA 328 54.076 42.175 40.525 1.00 0.00 H ATOM 11330 C115 PA 328 53.299 41.680 42.529 1.00 0.00 C ATOM 11331 H15R PA 328 54.294 41.328 42.810 1.00 0.00 H ATOM 11332 H15S PA 328 52.691 40.847 42.171 1.00 0.00 H ATOM 11333 C114 PA 328 52.767 42.307 43.799 1.00 0.00 C ATOM 11334 H14R PA 328 51.757 42.675 43.604 1.00 0.00 H ATOM 11335 H14S PA 328 53.494 43.087 44.030 1.00 0.00 H ATOM 11336 C113 PA 328 52.725 41.365 44.988 1.00 0.00 C ATOM 11337 H13R PA 328 52.082 40.502 44.805 1.00 0.00 H ATOM 11338 H13S PA 328 52.257 41.832 45.857 1.00 0.00 H ATOM 11339 C112 PA 328 54.137 40.806 45.304 1.00 0.00 C ATOM 11340 H12R PA 328 54.862 41.611 45.170 1.00 0.00 H ATOM 11341 H12S PA 328 54.388 40.063 44.545 1.00 0.00 H ATOM 11342 C111 PA 328 54.383 40.228 46.692 1.00 0.00 C ATOM 11343 H11R PA 328 55.448 39.994 46.745 1.00 0.00 H ATOM 11344 H11S PA 328 54.046 39.208 46.889 1.00 0.00 H ATOM 11345 C110 PA 328 53.972 41.102 47.908 1.00 0.00 C ATOM 11346 H10R PA 328 52.941 41.388 47.692 1.00 0.00 H ATOM 11347 H10S PA 328 54.552 42.016 47.762 1.00 0.00 H ATOM 11348 C19 PA 328 54.119 40.451 49.285 1.00 0.00 C ATOM 11349 H9R PA 328 55.153 40.111 49.373 1.00 0.00 H ATOM 11350 H9S PA 328 53.355 39.686 49.132 1.00 0.00 H ATOM 11351 C18 PA 328 53.567 41.258 50.444 1.00 0.00 C ATOM 11352 H8R PA 328 54.262 42.093 50.553 1.00 0.00 H ATOM 11353 H8S PA 328 53.672 40.468 51.191 1.00 0.00 H ATOM 11354 C17 PA 328 52.111 41.775 50.378 1.00 0.00 C ATOM 11355 H7R PA 328 51.356 40.987 50.357 1.00 0.00 H ATOM 11356 H7S PA 328 51.957 42.343 49.458 1.00 0.00 H ATOM 11357 C16 PA 328 51.773 42.542 51.645 1.00 0.00 C ATOM 11358 H6R PA 328 52.522 42.382 52.423 1.00 0.00 H ATOM 11359 H6S PA 328 50.818 42.228 52.074 1.00 0.00 H ATOM 11360 C15 PA 328 51.601 44.047 51.388 1.00 0.00 C ATOM 11361 H5R PA 328 50.883 44.122 50.569 1.00 0.00 H ATOM 11362 H5S PA 328 52.505 44.546 51.034 1.00 0.00 H ATOM 11363 C14 PA 328 51.119 44.690 52.600 1.00 0.00 C ATOM 11364 H4R PA 328 51.854 44.482 53.380 1.00 0.00 H ATOM 11365 H4S PA 328 50.137 44.217 52.669 1.00 0.00 H ATOM 11366 C13 PA 328 51.084 46.265 52.485 1.00 0.00 C ATOM 11367 H3R PA 328 50.672 46.586 51.526 1.00 0.00 H ATOM 11368 H3S PA 328 52.138 46.526 52.365 1.00 0.00 H ATOM 11369 C12 PA 328 50.302 46.941 53.653 1.00 0.00 C ATOM 11370 H2R PA 328 49.330 46.485 53.853 1.00 0.00 H ATOM 11371 H2S PA 328 50.365 47.976 53.312 1.00 0.00 H ATOM 11372 C11 PC 329 51.099 46.870 54.910 1.00 0.00 C ATOM 11373 O12 PC 329 50.627 46.317 55.909 1.00 0.00 O ATOM 11374 O11 PC 329 52.326 47.419 54.823 1.00 0.00 O ATOM 11375 C1 PC 329 53.055 47.684 56.160 1.00 0.00 C ATOM 11376 HR PC 329 52.264 48.085 56.799 1.00 0.00 H ATOM 11377 HS PC 329 53.937 48.323 56.080 1.00 0.00 H ATOM 11378 C2 PC 329 53.528 46.284 56.706 1.00 0.00 C ATOM 11379 HX PC 329 52.690 45.608 56.898 1.00 0.00 H ATOM 11380 C3 PC 329 54.470 46.555 57.933 1.00 0.00 C ATOM 11381 HA PC 329 53.962 47.194 58.659 1.00 0.00 H ATOM 11382 HB PC 329 55.420 46.976 57.593 1.00 0.00 H ATOM 11383 O31 PC 329 54.640 45.310 58.570 1.00 0.00 O ATOM 11384 P31 PC 329 54.768 45.219 60.180 1.00 0.00 P ATOM 11385 O32 PC 329 56.211 45.833 60.483 1.00 0.00 O ATOM 11386 C31 PC 329 57.035 45.311 61.413 1.00 0.00 C ATOM 11387 H1A PC 329 57.304 44.306 61.077 1.00 0.00 H ATOM 11388 H1B PC 329 56.498 45.183 62.356 1.00 0.00 H ATOM 11389 C32 PC 329 58.257 46.201 61.574 1.00 0.00 C ATOM 11390 H2A PC 329 57.877 47.120 62.023 1.00 0.00 H ATOM 11391 H2B PC 329 58.631 46.558 60.613 1.00 0.00 H ATOM 11392 N31 PC 329 59.461 45.746 62.444 1.00 0.00 N ATOM 11393 C33 PC 329 59.159 45.103 63.774 1.00 0.00 C ATOM 11394 H3A PC 329 60.116 44.735 64.146 1.00 0.00 H ATOM 11395 H3B PC 329 58.375 44.365 63.594 1.00 0.00 H ATOM 11396 H3C PC 329 58.771 45.900 64.409 1.00 0.00 H ATOM 11397 C34 PC 329 60.190 44.668 61.764 1.00 0.00 C ATOM 11398 H4A PC 329 61.148 44.624 62.285 1.00 0.00 H ATOM 11399 H4B PC 329 60.300 44.888 60.701 1.00 0.00 H ATOM 11400 H4C PC 329 59.495 43.866 62.016 1.00 0.00 H ATOM 11401 C35 PC 329 60.364 46.914 62.640 1.00 0.00 C ATOM 11402 H5A PC 329 59.706 47.701 63.013 1.00 0.00 H ATOM 11403 H5B PC 329 60.792 47.274 61.703 1.00 0.00 H ATOM 11404 H5C PC 329 61.157 46.636 63.336 1.00 0.00 H ATOM 11405 O33 PC 329 53.666 46.095 60.612 1.00 0.00 O ATOM 11406 O34 PC 329 54.714 43.800 60.555 1.00 0.00 O ATOM 11407 O21 PC 329 54.366 45.794 55.640 1.00 0.00 O ATOM 11408 C21 PC 329 54.486 44.454 55.338 1.00 0.00 C ATOM 11409 O22 PC 329 53.996 43.543 55.991 1.00 0.00 O ATOM 11410 C12 OL 330 55.112 44.141 54.001 1.00 0.00 C ATOM 11411 H2R OL 330 56.154 43.883 54.202 1.00 0.00 H ATOM 11412 H2S OL 330 54.586 43.264 53.618 1.00 0.00 H ATOM 11413 C13 OL 330 55.236 45.388 53.048 1.00 0.00 C ATOM 11414 H3R OL 330 54.307 45.962 53.075 1.00 0.00 H ATOM 11415 H3S OL 330 55.975 46.116 53.387 1.00 0.00 H ATOM 11416 C14 OL 330 55.594 45.057 51.573 1.00 0.00 C ATOM 11417 H4R OL 330 54.776 44.426 51.221 1.00 0.00 H ATOM 11418 H4S OL 330 55.704 45.902 50.889 1.00 0.00 H ATOM 11419 C15 OL 330 56.924 44.267 51.532 1.00 0.00 C ATOM 11420 H5R OL 330 57.622 44.719 52.240 1.00 0.00 H ATOM 11421 H5S OL 330 56.779 43.241 51.875 1.00 0.00 H ATOM 11422 C16 OL 330 57.531 44.232 50.129 1.00 0.00 C ATOM 11423 H6R OL 330 57.700 45.263 49.810 1.00 0.00 H ATOM 11424 H6S OL 330 58.492 43.719 50.202 1.00 0.00 H ATOM 11425 C17 OL 330 56.650 43.508 49.016 1.00 0.00 C ATOM 11426 H7R OL 330 56.383 42.500 49.341 1.00 0.00 H ATOM 11427 H7S OL 330 55.653 43.934 48.889 1.00 0.00 H ATOM 11428 C18 OL 330 57.102 43.388 47.560 1.00 0.00 C ATOM 11429 H8R OL 330 58.166 43.151 47.498 1.00 0.00 H ATOM 11430 H8S OL 330 56.520 42.710 46.932 1.00 0.00 H ATOM 11431 C19 OL 330 56.972 44.778 46.908 1.00 0.00 C ATOM 11432 H9R OL 330 55.952 45.150 46.873 1.00 0.00 H ATOM 11433 C110 OL 330 57.929 45.558 46.360 1.00 0.00 C ATOM 11434 H10R OL 330 57.510 46.490 45.988 1.00 0.00 H ATOM 11435 C111 OL 330 59.409 45.378 46.317 1.00 0.00 C ATOM 11436 H11R OL 330 59.717 44.532 46.935 1.00 0.00 H ATOM 11437 H11S OL 330 59.739 45.113 45.310 1.00 0.00 H ATOM 11438 C112 OL 330 60.258 46.536 46.717 1.00 0.00 C ATOM 11439 H12R OL 330 60.091 46.807 47.762 1.00 0.00 H ATOM 11440 H12S OL 330 61.315 46.321 46.549 1.00 0.00 H ATOM 11441 C113 OL 330 59.913 47.818 45.930 1.00 0.00 C ATOM 11442 H13R OL 330 60.099 47.573 44.882 1.00 0.00 H ATOM 11443 H13S OL 330 58.892 48.177 46.075 1.00 0.00 H ATOM 11444 C114 OL 330 60.713 48.996 46.343 1.00 0.00 C ATOM 11445 H14R OL 330 60.432 49.143 47.388 1.00 0.00 H ATOM 11446 H14S OL 330 61.792 48.831 46.297 1.00 0.00 H ATOM 11447 C115 OL 330 60.503 50.254 45.520 1.00 0.00 C ATOM 11448 H15R OL 330 60.821 50.089 44.488 1.00 0.00 H ATOM 11449 H15S OL 330 59.431 50.461 45.517 1.00 0.00 H ATOM 11450 C116 OL 330 61.258 51.464 46.011 1.00 0.00 C ATOM 11451 H16R OL 330 61.179 51.350 47.094 1.00 0.00 H ATOM 11452 H16S OL 330 62.298 51.230 45.772 1.00 0.00 H ATOM 11453 C117 OL 330 60.867 52.897 45.535 1.00 0.00 C ATOM 11454 H17R OL 330 60.618 52.941 44.473 1.00 0.00 H ATOM 11455 H17S OL 330 59.929 53.091 46.059 1.00 0.00 H ATOM 11456 C118 OL 330 61.821 54.033 45.840 1.00 0.00 C ATOM 11457 H18R OL 330 61.307 54.902 45.425 1.00 0.00 H ATOM 11458 H18S OL 330 62.807 53.853 45.407 1.00 0.00 H ATOM 11459 H18T OL 330 61.893 54.111 46.927 1.00 0.00 H TER 11460 OL 330 ATOM 11460 C116 PA 331 127.841 61.747 42.965 1.00 0.00 C ATOM 11461 H16R PA 331 128.383 62.579 43.419 1.00 0.00 H ATOM 11462 H16S PA 331 126.800 61.877 43.269 1.00 0.00 H ATOM 11463 H16T PA 331 127.842 62.066 41.921 1.00 0.00 H ATOM 11464 C115 PA 331 128.505 60.418 43.254 1.00 0.00 C ATOM 11465 H15R PA 331 129.352 60.572 42.582 1.00 0.00 H ATOM 11466 H15S PA 331 127.855 59.572 43.021 1.00 0.00 H ATOM 11467 C114 PA 331 129.008 60.403 44.699 1.00 0.00 C ATOM 11468 H14R PA 331 128.127 60.347 45.341 1.00 0.00 H ATOM 11469 H14S PA 331 129.400 61.414 44.826 1.00 0.00 H ATOM 11470 C113 PA 331 130.051 59.321 45.213 1.00 0.00 C ATOM 11471 H13R PA 331 130.777 59.173 44.410 1.00 0.00 H ATOM 11472 H13S PA 331 129.547 58.353 45.207 1.00 0.00 H ATOM 11473 C112 PA 331 130.887 59.642 46.511 1.00 0.00 C ATOM 11474 H12R PA 331 130.237 59.812 47.372 1.00 0.00 H ATOM 11475 H12S PA 331 131.362 60.623 46.436 1.00 0.00 H ATOM 11476 C111 PA 331 132.031 58.669 46.697 1.00 0.00 C ATOM 11477 H11R PA 331 132.613 58.792 45.781 1.00 0.00 H ATOM 11478 H11S PA 331 131.627 57.656 46.743 1.00 0.00 H ATOM 11479 C110 PA 331 132.865 58.948 47.939 1.00 0.00 C ATOM 11480 H10R PA 331 132.184 58.940 48.792 1.00 0.00 H ATOM 11481 H10S PA 331 133.390 59.900 47.843 1.00 0.00 H ATOM 11482 C19 PA 331 134.013 57.923 48.253 1.00 0.00 C ATOM 11483 H9R PA 331 134.597 58.158 49.144 1.00 0.00 H ATOM 11484 H9S PA 331 134.720 57.909 47.421 1.00 0.00 H ATOM 11485 C18 PA 331 133.533 56.474 48.423 1.00 0.00 C ATOM 11486 H8R PA 331 132.965 56.120 47.560 1.00 0.00 H ATOM 11487 H8S PA 331 132.920 56.522 49.325 1.00 0.00 H ATOM 11488 C17 PA 331 134.549 55.384 48.720 1.00 0.00 C ATOM 11489 H7R PA 331 135.184 55.746 49.531 1.00 0.00 H ATOM 11490 H7S PA 331 135.226 55.229 47.878 1.00 0.00 H ATOM 11491 C16 PA 331 133.914 54.065 49.187 1.00 0.00 C ATOM 11492 H6R PA 331 133.341 53.578 48.395 1.00 0.00 H ATOM 11493 H6S PA 331 133.204 54.389 49.951 1.00 0.00 H ATOM 11494 C15 PA 331 134.994 53.179 49.791 1.00 0.00 C ATOM 11495 H5R PA 331 135.522 53.607 50.645 1.00 0.00 H ATOM 11496 H5S PA 331 135.817 53.068 49.082 1.00 0.00 H ATOM 11497 C14 PA 331 134.568 51.859 50.243 1.00 0.00 C ATOM 11498 H4R PA 331 134.010 51.426 49.410 1.00 0.00 H ATOM 11499 H4S PA 331 133.883 51.888 51.093 1.00 0.00 H ATOM 11500 C13 PA 331 135.595 50.774 50.778 1.00 0.00 C ATOM 11501 H3R PA 331 136.251 50.716 49.907 1.00 0.00 H ATOM 11502 H3S PA 331 135.100 49.822 50.978 1.00 0.00 H ATOM 11503 C12 PA 331 136.380 51.272 52.019 1.00 0.00 C ATOM 11504 H2R PA 331 136.980 50.446 52.406 1.00 0.00 H ATOM 11505 H2S PA 331 137.178 51.936 51.682 1.00 0.00 H ATOM 11506 C11 PGR 332 135.535 51.830 53.132 1.00 0.00 C ATOM 11507 O12 PGR 332 135.792 52.882 53.781 1.00 0.00 O ATOM 11508 O11 PGR 332 134.493 51.091 53.389 1.00 0.00 O ATOM 11509 C1 PGR 332 133.636 51.604 54.463 1.00 0.00 C ATOM 11510 HR PGR 332 134.228 51.864 55.345 1.00 0.00 H ATOM 11511 HS PGR 332 133.013 50.769 54.793 1.00 0.00 H ATOM 11512 C2 PGR 332 132.663 52.779 53.936 1.00 0.00 C ATOM 11513 HX PGR 332 133.246 53.473 53.326 1.00 0.00 H ATOM 11514 C3 PGR 332 132.116 53.524 55.188 1.00 0.00 C ATOM 11515 HA PGR 332 131.276 54.115 54.813 1.00 0.00 H ATOM 11516 HB PGR 332 132.990 54.064 55.560 1.00 0.00 H ATOM 11517 O31 PGR 332 131.544 52.617 56.132 1.00 0.00 O ATOM 11518 P31 PGR 332 130.716 53.260 57.385 1.00 0.00 P ATOM 11519 O32 PGR 332 129.286 53.468 56.773 1.00 0.00 O ATOM 11520 C31 PGR 332 128.356 52.411 56.412 1.00 0.00 C ATOM 11521 H1A PGR 332 127.329 52.777 56.496 1.00 0.00 H ATOM 11522 H1B PGR 332 128.475 51.680 57.216 1.00 0.00 H ATOM 11523 C32 PGR 332 128.633 51.682 55.070 1.00 0.00 C ATOM 11524 H2A PGR 332 129.716 51.569 54.982 1.00 0.00 H ATOM 11525 O35 PGR 332 128.287 52.474 53.926 1.00 0.00 O ATOM 11526 HO5A PGR 332 127.380 52.353 53.594 1.00 0.00 H ATOM 11527 C33 PGR 332 128.021 50.269 55.043 1.00 0.00 C ATOM 11528 H3A PGR 332 127.999 49.835 54.041 1.00 0.00 H ATOM 11529 H3B PGR 332 128.757 49.712 55.628 1.00 0.00 H ATOM 11530 O33 PGR 332 130.668 52.303 58.491 1.00 0.00 O ATOM 11531 O34 PGR 332 131.252 54.654 57.567 1.00 0.00 O ATOM 11532 O21 PGR 332 131.680 52.194 53.090 1.00 0.00 O ATOM 11533 C21 PGR 332 131.215 52.964 52.054 1.00 0.00 C ATOM 11534 O22 PGR 332 131.615 54.063 51.851 1.00 0.00 O ATOM 11535 O36 PGR 332 126.760 50.113 55.642 1.00 0.00 O ATOM 11536 HO6A PGR 332 126.588 49.157 55.706 1.00 0.00 H ATOM 11537 C12 OL 333 130.207 52.249 51.132 1.00 0.00 C ATOM 11538 H2R OL 333 129.561 51.546 51.662 1.00 0.00 H ATOM 11539 H2S OL 333 129.708 53.070 50.613 1.00 0.00 H ATOM 11540 C13 OL 333 130.938 51.429 50.037 1.00 0.00 C ATOM 11541 H3R OL 333 131.665 51.978 49.436 1.00 0.00 H ATOM 11542 H3S OL 333 131.378 50.581 50.567 1.00 0.00 H ATOM 11543 C14 OL 333 129.892 50.745 49.144 1.00 0.00 C ATOM 11544 H4R OL 333 129.085 50.318 49.744 1.00 0.00 H ATOM 11545 H4S OL 333 129.463 51.625 48.660 1.00 0.00 H ATOM 11546 C15 OL 333 130.412 49.695 48.062 1.00 0.00 C ATOM 11547 H5R OL 333 131.160 49.154 48.645 1.00 0.00 H ATOM 11548 H5S OL 333 129.581 49.078 47.713 1.00 0.00 H ATOM 11549 C16 OL 333 130.971 50.193 46.727 1.00 0.00 C ATOM 11550 H6R OL 333 130.336 50.994 46.342 1.00 0.00 H ATOM 11551 H6S OL 333 131.940 50.662 46.909 1.00 0.00 H ATOM 11552 C17 OL 333 131.285 49.158 45.595 1.00 0.00 C ATOM 11553 H7R OL 333 131.970 48.456 46.076 1.00 0.00 H ATOM 11554 H7S OL 333 130.373 48.619 45.332 1.00 0.00 H ATOM 11555 C18 OL 333 131.803 49.806 44.283 1.00 0.00 C ATOM 11556 H8R OL 333 131.133 50.523 43.805 1.00 0.00 H ATOM 11557 H8S OL 333 132.660 50.456 44.474 1.00 0.00 H ATOM 11558 C19 OL 333 132.194 48.835 43.211 1.00 0.00 C ATOM 11559 H9R OL 333 131.543 47.982 43.037 1.00 0.00 H ATOM 11560 C110 OL 333 133.287 48.945 42.411 1.00 0.00 C ATOM 11561 H10R OL 333 133.436 48.195 41.638 1.00 0.00 H ATOM 11562 C111 OL 333 134.291 50.059 42.320 1.00 0.00 C ATOM 11563 H11R OL 333 134.179 50.706 41.447 1.00 0.00 H ATOM 11564 H11S OL 333 134.116 50.648 43.222 1.00 0.00 H ATOM 11565 C112 OL 333 135.728 49.678 42.327 1.00 0.00 C ATOM 11566 H12R OL 333 136.251 50.635 42.377 1.00 0.00 H ATOM 11567 H12S OL 333 135.857 49.115 43.254 1.00 0.00 H ATOM 11568 C113 OL 333 136.188 48.850 41.212 1.00 0.00 C ATOM 11569 H13R OL 333 135.580 47.947 41.300 1.00 0.00 H ATOM 11570 H13S OL 333 135.945 49.387 40.292 1.00 0.00 H ATOM 11571 C114 OL 333 137.628 48.363 41.225 1.00 0.00 C ATOM 11572 H14R OL 333 138.009 48.706 42.189 1.00 0.00 H ATOM 11573 H14S OL 333 137.670 47.296 41.450 1.00 0.00 H ATOM 11574 C115 OL 333 138.575 48.704 40.144 1.00 0.00 C ATOM 11575 H15R OL 333 139.363 47.952 40.208 1.00 0.00 H ATOM 11576 H15S OL 333 138.115 48.582 39.161 1.00 0.00 H ATOM 11577 C116 OL 333 138.999 50.242 40.167 1.00 0.00 C ATOM 11578 H16R OL 333 138.158 50.905 39.952 1.00 0.00 H ATOM 11579 H16S OL 333 139.464 50.590 41.092 1.00 0.00 H ATOM 11580 C117 OL 333 140.024 50.551 39.114 1.00 0.00 C ATOM 11581 H17R OL 333 140.516 51.488 39.383 1.00 0.00 H ATOM 11582 H17S OL 333 140.770 49.755 39.168 1.00 0.00 H ATOM 11583 C118 OL 333 139.457 50.698 37.708 1.00 0.00 C ATOM 11584 H18R OL 333 138.573 51.321 37.554 1.00 0.00 H ATOM 11585 H18S OL 333 139.215 49.745 37.235 1.00 0.00 H ATOM 11586 H18T OL 333 140.274 51.248 37.235 1.00 0.00 H TER 11587 OL 333 ATOM 11587 C116 PA 334 138.192 99.397 47.652 1.00 0.00 C ATOM 11588 H16R PA 334 138.710 98.708 48.322 1.00 0.00 H ATOM 11589 H16S PA 334 137.694 100.178 48.230 1.00 0.00 H ATOM 11590 H16T PA 334 138.965 99.864 47.039 1.00 0.00 H ATOM 11591 C115 PA 334 137.218 98.493 46.877 1.00 0.00 C ATOM 11592 H15R PA 334 137.809 98.154 46.024 1.00 0.00 H ATOM 11593 H15S PA 334 136.482 99.178 46.450 1.00 0.00 H ATOM 11594 C114 PA 334 136.512 97.414 47.709 1.00 0.00 C ATOM 11595 H14R PA 334 137.284 96.755 48.111 1.00 0.00 H ATOM 11596 H14S PA 334 135.961 96.756 47.034 1.00 0.00 H ATOM 11597 C113 PA 334 135.546 97.881 48.812 1.00 0.00 C ATOM 11598 H13R PA 334 134.863 98.536 48.268 1.00 0.00 H ATOM 11599 H13S PA 334 136.057 98.608 49.446 1.00 0.00 H ATOM 11600 C112 PA 334 134.713 96.816 49.453 1.00 0.00 C ATOM 11601 H12R PA 334 135.425 96.189 49.995 1.00 0.00 H ATOM 11602 H12S PA 334 134.253 96.147 48.723 1.00 0.00 H ATOM 11603 C111 PA 334 133.675 97.299 50.598 1.00 0.00 C ATOM 11604 H11R PA 334 132.914 97.850 50.042 1.00 0.00 H ATOM 11605 H11S PA 334 134.168 98.058 51.210 1.00 0.00 H ATOM 11606 C110 PA 334 133.127 96.127 51.431 1.00 0.00 C ATOM 11607 H10R PA 334 133.923 95.529 51.877 1.00 0.00 H ATOM 11608 H10S PA 334 132.684 95.350 50.804 1.00 0.00 H ATOM 11609 C19 PA 334 132.465 96.750 52.584 1.00 0.00 C ATOM 11610 H9R PA 334 131.721 96.115 53.072 1.00 0.00 H ATOM 11611 H9S PA 334 131.728 97.458 52.200 1.00 0.00 H ATOM 11612 C18 PA 334 133.348 97.307 53.742 1.00 0.00 C ATOM 11613 H8R PA 334 134.209 97.926 53.479 1.00 0.00 H ATOM 11614 H8S PA 334 133.728 96.384 54.184 1.00 0.00 H ATOM 11615 C17 PA 334 132.619 97.948 54.940 1.00 0.00 C ATOM 11616 H7R PA 334 132.003 98.752 54.532 1.00 0.00 H ATOM 11617 H7S PA 334 133.244 98.512 55.634 1.00 0.00 H ATOM 11618 C16 PA 334 131.673 97.013 55.715 1.00 0.00 C ATOM 11619 H6R PA 334 130.851 96.643 55.098 1.00 0.00 H ATOM 11620 H6S PA 334 131.122 97.657 56.404 1.00 0.00 H ATOM 11621 C15 PA 334 132.410 95.821 56.449 1.00 0.00 C ATOM 11622 H5R PA 334 132.841 96.194 57.380 1.00 0.00 H ATOM 11623 H5S PA 334 133.329 95.570 55.916 1.00 0.00 H ATOM 11624 C14 PA 334 131.541 94.607 56.718 1.00 0.00 C ATOM 11625 H4R PA 334 131.353 94.093 55.772 1.00 0.00 H ATOM 11626 H4S PA 334 130.526 94.943 56.940 1.00 0.00 H ATOM 11627 C13 PA 334 132.007 93.756 57.882 1.00 0.00 C ATOM 11628 H3R PA 334 132.124 94.414 58.746 1.00 0.00 H ATOM 11629 H3S PA 334 132.986 93.363 57.600 1.00 0.00 H ATOM 11630 C12 PA 334 131.207 92.457 58.089 1.00 0.00 C ATOM 11631 H2R PA 334 131.117 91.761 57.252 1.00 0.00 H ATOM 11632 H2S PA 334 130.166 92.732 58.266 1.00 0.00 H ATOM 11633 C11 PGR 335 131.613 91.663 59.304 1.00 0.00 C ATOM 11634 O12 PGR 335 132.670 91.809 59.859 1.00 0.00 O ATOM 11635 O11 PGR 335 130.735 90.672 59.536 1.00 0.00 O ATOM 11636 C1 PGR 335 131.177 89.623 60.463 1.00 0.00 C ATOM 11637 HR PGR 335 131.364 90.042 61.455 1.00 0.00 H ATOM 11638 HS PGR 335 132.074 89.204 60.000 1.00 0.00 H ATOM 11639 C2 PGR 335 130.015 88.546 60.583 1.00 0.00 C ATOM 11640 HX PGR 335 129.123 89.154 60.751 1.00 0.00 H ATOM 11641 C3 PGR 335 130.332 87.597 61.828 1.00 0.00 C ATOM 11642 HA PGR 335 129.613 86.782 61.946 1.00 0.00 H ATOM 11643 HB PGR 335 130.392 88.149 62.770 1.00 0.00 H ATOM 11644 O31 PGR 335 131.584 86.950 61.668 1.00 0.00 O ATOM 11645 P31 PGR 335 131.857 85.499 62.330 1.00 0.00 P ATOM 11646 O32 PGR 335 131.378 84.585 61.131 1.00 0.00 O ATOM 11647 C31 PGR 335 132.210 84.502 59.966 1.00 0.00 C ATOM 11648 H1A PGR 335 133.296 84.425 60.065 1.00 0.00 H ATOM 11649 H1B PGR 335 131.969 85.297 59.256 1.00 0.00 H ATOM 11650 C32 PGR 335 131.851 83.191 59.238 1.00 0.00 C ATOM 11651 H2A PGR 335 130.779 83.267 59.036 1.00 0.00 H ATOM 11652 O35 PGR 335 132.166 82.142 60.132 1.00 0.00 O ATOM 11653 HO5A PGR 335 131.837 82.452 60.994 1.00 0.00 H ATOM 11654 C33 PGR 335 132.514 82.976 57.902 1.00 0.00 C ATOM 11655 H3A PGR 335 132.131 82.048 57.470 1.00 0.00 H ATOM 11656 H3B PGR 335 132.246 83.849 57.302 1.00 0.00 H ATOM 11657 O33 PGR 335 133.290 85.308 62.523 1.00 0.00 O ATOM 11658 O34 PGR 335 130.856 85.285 63.413 1.00 0.00 O ATOM 11659 O21 PGR 335 129.997 87.706 59.449 1.00 0.00 O ATOM 11660 C21 PGR 335 128.920 86.897 59.355 1.00 0.00 C ATOM 11661 O22 PGR 335 127.935 86.984 60.034 1.00 0.00 O ATOM 11662 O36 PGR 335 133.931 82.990 58.016 1.00 0.00 O ATOM 11663 HO6A PGR 335 134.242 82.185 58.468 1.00 0.00 H ATOM 11664 C12 OL 336 129.124 86.002 58.140 1.00 0.00 C ATOM 11665 H2R OL 336 130.211 85.980 58.030 1.00 0.00 H ATOM 11666 H2S OL 336 128.913 84.933 58.216 1.00 0.00 H ATOM 11667 C13 OL 336 128.384 86.630 56.923 1.00 0.00 C ATOM 11668 H3R OL 336 127.304 86.484 56.996 1.00 0.00 H ATOM 11669 H3S OL 336 128.505 87.712 56.839 1.00 0.00 H ATOM 11670 C14 OL 336 128.946 85.905 55.681 1.00 0.00 C ATOM 11671 H4R OL 336 128.698 86.557 54.841 1.00 0.00 H ATOM 11672 H4S OL 336 130.036 85.831 55.686 1.00 0.00 H ATOM 11673 C15 OL 336 128.477 84.440 55.468 1.00 0.00 C ATOM 11674 H5R OL 336 128.589 83.808 56.352 1.00 0.00 H ATOM 11675 H5S OL 336 127.392 84.475 55.348 1.00 0.00 H ATOM 11676 C16 OL 336 129.312 83.850 54.327 1.00 0.00 C ATOM 11677 H6R OL 336 128.852 82.994 53.828 1.00 0.00 H ATOM 11678 H6S OL 336 129.398 84.560 53.502 1.00 0.00 H ATOM 11679 C17 OL 336 130.712 83.372 54.624 1.00 0.00 C ATOM 11680 H7R OL 336 131.335 84.246 54.827 1.00 0.00 H ATOM 11681 H7S OL 336 130.698 82.810 55.560 1.00 0.00 H ATOM 11682 C18 OL 336 131.413 82.496 53.436 1.00 0.00 C ATOM 11683 H8R OL 336 131.454 82.987 52.461 1.00 0.00 H ATOM 11684 H8S OL 336 132.470 82.351 53.667 1.00 0.00 H ATOM 11685 C19 OL 336 130.758 81.068 53.299 1.00 0.00 C ATOM 11686 H9R OL 336 129.680 81.110 53.163 1.00 0.00 H ATOM 11687 C110 OL 336 131.475 79.947 53.204 1.00 0.00 C ATOM 11688 H10R OL 336 130.883 79.051 53.034 1.00 0.00 H ATOM 11689 C111 OL 336 132.791 79.580 53.669 1.00 0.00 C ATOM 11690 H11R OL 336 133.491 80.381 53.423 1.00 0.00 H ATOM 11691 H11S OL 336 132.828 79.414 54.748 1.00 0.00 H ATOM 11692 C112 OL 336 133.301 78.404 52.828 1.00 0.00 C ATOM 11693 H12R OL 336 134.149 77.940 53.336 1.00 0.00 H ATOM 11694 H12S OL 336 132.534 77.627 52.843 1.00 0.00 H ATOM 11695 C113 OL 336 133.497 78.697 51.356 1.00 0.00 C ATOM 11696 H13R OL 336 132.551 79.022 50.917 1.00 0.00 H ATOM 11697 H13S OL 336 134.170 79.542 51.198 1.00 0.00 H ATOM 11698 C114 OL 336 134.168 77.491 50.612 1.00 0.00 C ATOM 11699 H14R OL 336 135.132 77.313 51.092 1.00 0.00 H ATOM 11700 H14S OL 336 133.533 76.615 50.764 1.00 0.00 H ATOM 11701 C115 OL 336 134.364 77.714 49.060 1.00 0.00 C ATOM 11702 H15R OL 336 133.548 78.274 48.598 1.00 0.00 H ATOM 11703 H15S OL 336 135.206 78.369 48.827 1.00 0.00 H ATOM 11704 C116 OL 336 134.644 76.492 48.219 1.00 0.00 C ATOM 11705 H16R OL 336 133.714 76.060 47.844 1.00 0.00 H ATOM 11706 H16S OL 336 135.039 76.863 47.271 1.00 0.00 H ATOM 11707 C117 OL 336 135.563 75.424 48.918 1.00 0.00 C ATOM 11708 H17R OL 336 136.601 75.758 48.979 1.00 0.00 H ATOM 11709 H17S OL 336 135.098 75.333 49.902 1.00 0.00 H ATOM 11710 C118 OL 336 135.527 74.043 48.197 1.00 0.00 C ATOM 11711 H18R OL 336 136.135 74.259 47.315 1.00 0.00 H ATOM 11712 H18S OL 336 134.535 73.744 47.853 1.00 0.00 H ATOM 11713 H18T OL 336 136.010 73.330 48.868 1.00 0.00 H TER 11714 OL 336 ATOM 11714 C116 PA 337 135.402 51.707 46.351 1.00 0.00 C ATOM 11715 H16R PA 337 135.852 52.563 46.858 1.00 0.00 H ATOM 11716 H16S PA 337 134.339 51.955 46.304 1.00 0.00 H ATOM 11717 H16T PA 337 135.913 51.731 45.387 1.00 0.00 H ATOM 11718 C115 PA 337 135.710 50.388 47.043 1.00 0.00 C ATOM 11719 H15R PA 337 135.087 50.366 47.939 1.00 0.00 H ATOM 11720 H15S PA 337 136.653 50.485 47.584 1.00 0.00 H ATOM 11721 C114 PA 337 135.572 49.184 46.190 1.00 0.00 C ATOM 11722 H14R PA 337 136.310 49.229 45.388 1.00 0.00 H ATOM 11723 H14S PA 337 134.569 49.021 45.791 1.00 0.00 H ATOM 11724 C113 PA 337 135.951 48.014 47.113 1.00 0.00 C ATOM 11725 H13R PA 337 135.268 47.836 47.947 1.00 0.00 H ATOM 11726 H13S PA 337 136.883 48.331 47.586 1.00 0.00 H ATOM 11727 C112 PA 337 136.141 46.650 46.448 1.00 0.00 C ATOM 11728 H12R PA 337 136.377 45.942 47.244 1.00 0.00 H ATOM 11729 H12S PA 337 136.949 46.789 45.726 1.00 0.00 H ATOM 11730 C111 PA 337 134.890 46.084 45.801 1.00 0.00 C ATOM 11731 H11R PA 337 135.069 45.100 45.364 1.00 0.00 H ATOM 11732 H11S PA 337 134.727 46.735 44.940 1.00 0.00 H ATOM 11733 C110 PA 337 133.599 45.801 46.631 1.00 0.00 C ATOM 11734 H10R PA 337 132.686 45.867 46.035 1.00 0.00 H ATOM 11735 H10S PA 337 133.551 46.673 47.286 1.00 0.00 H ATOM 11736 C19 PA 337 133.496 44.483 47.456 1.00 0.00 C ATOM 11737 H9R PA 337 134.460 44.168 47.861 1.00 0.00 H ATOM 11738 H9S PA 337 133.331 43.633 46.791 1.00 0.00 H ATOM 11739 C18 PA 337 132.665 44.572 48.685 1.00 0.00 C ATOM 11740 H8R PA 337 132.528 43.520 48.943 1.00 0.00 H ATOM 11741 H8S PA 337 131.693 44.879 48.291 1.00 0.00 H ATOM 11742 C17 PA 337 133.201 45.407 49.830 1.00 0.00 C ATOM 11743 H7R PA 337 133.286 46.448 49.510 1.00 0.00 H ATOM 11744 H7S PA 337 134.238 45.187 50.091 1.00 0.00 H ATOM 11745 C16 PA 337 132.371 45.305 51.053 1.00 0.00 C ATOM 11746 H6R PA 337 132.538 44.313 51.479 1.00 0.00 H ATOM 11747 H6S PA 337 131.312 45.311 50.789 1.00 0.00 H ATOM 11748 C15 PA 337 132.737 46.338 52.038 1.00 0.00 C ATOM 11749 H5R PA 337 133.819 46.407 52.167 1.00 0.00 H ATOM 11750 H5S PA 337 132.476 45.948 53.024 1.00 0.00 H ATOM 11751 C14 PA 337 132.074 47.718 51.807 1.00 0.00 C ATOM 11752 H4R PA 337 132.382 48.122 50.840 1.00 0.00 H ATOM 11753 H4S PA 337 132.621 48.300 52.552 1.00 0.00 H ATOM 11754 C13 PA 337 130.562 47.824 51.743 1.00 0.00 C ATOM 11755 H3R PA 337 130.153 46.820 51.612 1.00 0.00 H ATOM 11756 H3S PA 337 130.129 48.314 50.868 1.00 0.00 H ATOM 11757 C12 PA 337 129.833 48.349 52.970 1.00 0.00 C ATOM 11758 H2R PA 337 128.772 48.129 52.835 1.00 0.00 H ATOM 11759 H2S PA 337 130.173 49.375 53.126 1.00 0.00 H ATOM 11760 C11 PGR 338 130.311 47.560 54.175 1.00 0.00 C ATOM 11761 O12 PGR 338 131.203 48.028 54.866 1.00 0.00 O ATOM 11762 O11 PGR 338 129.733 46.327 54.315 1.00 0.00 O ATOM 11763 C1 PGR 338 130.088 45.568 55.494 1.00 0.00 C ATOM 11764 HR PGR 338 131.179 45.553 55.562 1.00 0.00 H ATOM 11765 HS PGR 338 129.724 44.554 55.312 1.00 0.00 H ATOM 11766 C2 PGR 338 129.612 46.101 56.831 1.00 0.00 C ATOM 11767 HX PGR 338 129.795 47.170 56.966 1.00 0.00 H ATOM 11768 C3 PGR 338 130.281 45.282 57.993 1.00 0.00 C ATOM 11769 HA PGR 338 131.366 45.373 57.900 1.00 0.00 H ATOM 11770 HB PGR 338 130.026 44.227 57.864 1.00 0.00 H ATOM 11771 O31 PGR 338 129.838 45.604 59.281 1.00 0.00 O ATOM 11772 P31 PGR 338 130.832 45.083 60.426 1.00 0.00 P ATOM 11773 O32 PGR 338 132.073 46.041 60.352 1.00 0.00 O ATOM 11774 C31 PGR 338 132.054 47.432 60.636 1.00 0.00 C ATOM 11775 H1A PGR 338 131.238 47.916 60.094 1.00 0.00 H ATOM 11776 H1B PGR 338 132.975 47.876 60.248 1.00 0.00 H ATOM 11777 C32 PGR 338 131.869 47.888 62.067 1.00 0.00 C ATOM 11778 H2A PGR 338 132.596 47.364 62.692 1.00 0.00 H ATOM 11779 O35 PGR 338 130.528 47.735 62.497 1.00 0.00 O ATOM 11780 HO5A PGR 338 130.332 46.781 62.482 1.00 0.00 H ATOM 11781 C33 PGR 338 131.967 49.463 62.055 1.00 0.00 C ATOM 11782 H3A PGR 338 132.920 49.699 61.576 1.00 0.00 H ATOM 11783 H3B PGR 338 131.161 49.839 61.420 1.00 0.00 H ATOM 11784 O33 PGR 338 130.161 45.202 61.753 1.00 0.00 O ATOM 11785 O34 PGR 338 131.407 43.796 60.080 1.00 0.00 O ATOM 11786 O21 PGR 338 128.154 45.832 56.952 1.00 0.00 O ATOM 11787 C21 PGR 338 127.204 46.563 56.279 1.00 0.00 C ATOM 11788 O22 PGR 338 127.405 47.598 55.638 1.00 0.00 O ATOM 11789 O36 PGR 338 131.757 49.991 63.352 1.00 0.00 O ATOM 11790 HO6A PGR 338 132.585 49.823 63.837 1.00 0.00 H ATOM 11791 C12 OL 339 125.855 45.842 56.382 1.00 0.00 C ATOM 11792 H2R OL 339 125.780 44.944 55.766 1.00 0.00 H ATOM 11793 H2S OL 339 125.701 45.420 57.377 1.00 0.00 H ATOM 11794 C13 OL 339 124.654 46.744 55.927 1.00 0.00 C ATOM 11795 H3R OL 339 123.696 46.522 56.401 1.00 0.00 H ATOM 11796 H3S OL 339 124.906 47.723 56.340 1.00 0.00 H ATOM 11797 C14 OL 339 124.327 46.741 54.373 1.00 0.00 C ATOM 11798 H4R OL 339 124.092 45.701 54.133 1.00 0.00 H ATOM 11799 H4S OL 339 123.494 47.375 54.062 1.00 0.00 H ATOM 11800 C15 OL 339 125.512 47.106 53.438 1.00 0.00 C ATOM 11801 H5R OL 339 126.049 48.026 53.679 1.00 0.00 H ATOM 11802 H5S OL 339 126.268 46.322 53.508 1.00 0.00 H ATOM 11803 C16 OL 339 125.047 46.999 51.973 1.00 0.00 C ATOM 11804 H6R OL 339 124.570 46.019 51.897 1.00 0.00 H ATOM 11805 H6S OL 339 124.234 47.720 51.868 1.00 0.00 H ATOM 11806 C17 OL 339 126.182 47.281 50.939 1.00 0.00 C ATOM 11807 H7R OL 339 126.599 48.275 51.114 1.00 0.00 H ATOM 11808 H7S OL 339 127.080 46.706 51.177 1.00 0.00 H ATOM 11809 C18 OL 339 125.743 47.073 49.467 1.00 0.00 C ATOM 11810 H8R OL 339 125.276 46.086 49.459 1.00 0.00 H ATOM 11811 H8S OL 339 124.988 47.845 49.309 1.00 0.00 H ATOM 11812 C19 OL 339 126.852 47.096 48.463 1.00 0.00 C ATOM 11813 H9R OL 339 127.587 46.310 48.616 1.00 0.00 H ATOM 11814 C110 OL 339 127.116 48.128 47.563 1.00 0.00 C ATOM 11815 H10R OL 339 128.024 48.083 46.967 1.00 0.00 H ATOM 11816 C111 OL 339 126.441 49.388 47.441 1.00 0.00 C ATOM 11817 H11R OL 339 125.647 49.533 48.176 1.00 0.00 H ATOM 11818 H11S OL 339 127.034 50.274 47.682 1.00 0.00 H ATOM 11819 C112 OL 339 125.769 49.625 46.076 1.00 0.00 C ATOM 11820 H12R OL 339 125.016 48.852 45.912 1.00 0.00 H ATOM 11821 H12S OL 339 125.136 50.514 46.106 1.00 0.00 H ATOM 11822 C113 OL 339 126.806 49.788 44.935 1.00 0.00 C ATOM 11823 H13R OL 339 127.525 50.560 45.218 1.00 0.00 H ATOM 11824 H13S OL 339 127.437 48.908 44.792 1.00 0.00 H ATOM 11825 C114 OL 339 126.193 50.314 43.647 1.00 0.00 C ATOM 11826 H14R OL 339 125.746 49.447 43.156 1.00 0.00 H ATOM 11827 H14S OL 339 125.422 51.010 43.986 1.00 0.00 H ATOM 11828 C115 OL 339 127.158 50.838 42.635 1.00 0.00 C ATOM 11829 H15R OL 339 127.879 50.042 42.437 1.00 0.00 H ATOM 11830 H15S OL 339 126.570 51.125 41.761 1.00 0.00 H ATOM 11831 C116 OL 339 127.966 52.123 43.108 1.00 0.00 C ATOM 11832 H16R OL 339 127.314 52.675 43.788 1.00 0.00 H ATOM 11833 H16S OL 339 128.801 51.688 43.661 1.00 0.00 H ATOM 11834 C117 OL 339 128.476 53.061 42.000 1.00 0.00 C ATOM 11835 H17R OL 339 129.461 53.482 42.212 1.00 0.00 H ATOM 11836 H17S OL 339 128.692 52.333 41.214 1.00 0.00 H ATOM 11837 C118 OL 339 127.426 54.139 41.573 1.00 0.00 C ATOM 11838 H18R OL 339 127.894 54.741 40.791 1.00 0.00 H ATOM 11839 H18S OL 339 127.109 54.661 42.478 1.00 0.00 H ATOM 11840 H18T OL 339 126.568 53.707 41.054 1.00 0.00 H TER 11841 OL 339 ATOM 11841 C116 PA 340 55.553 72.092 48.249 1.00 0.00 C ATOM 11842 H16R PA 340 54.660 71.873 48.838 1.00 0.00 H ATOM 11843 H16S PA 340 56.447 71.739 48.769 1.00 0.00 H ATOM 11844 H16T PA 340 55.546 71.562 47.295 1.00 0.00 H ATOM 11845 C115 PA 340 55.480 73.566 47.959 1.00 0.00 C ATOM 11846 H15R PA 340 54.475 73.734 47.568 1.00 0.00 H ATOM 11847 H15S PA 340 56.170 73.794 47.144 1.00 0.00 H ATOM 11848 C114 PA 340 55.618 74.496 49.255 1.00 0.00 C ATOM 11849 H14R PA 340 56.621 74.397 49.674 1.00 0.00 H ATOM 11850 H14S PA 340 54.951 74.076 50.012 1.00 0.00 H ATOM 11851 C113 PA 340 55.367 75.926 48.984 1.00 0.00 C ATOM 11852 H13R PA 340 54.352 76.016 48.592 1.00 0.00 H ATOM 11853 H13S PA 340 55.996 76.168 48.124 1.00 0.00 H ATOM 11854 C112 PA 340 55.620 76.675 50.282 1.00 0.00 C ATOM 11855 H12R PA 340 56.527 76.264 50.729 1.00 0.00 H ATOM 11856 H12S PA 340 54.935 76.484 51.112 1.00 0.00 H ATOM 11857 C111 PA 340 55.865 78.196 50.154 1.00 0.00 C ATOM 11858 H11R PA 340 55.399 78.692 51.008 1.00 0.00 H ATOM 11859 H11S PA 340 55.210 78.665 49.418 1.00 0.00 H ATOM 11860 C110 PA 340 57.271 78.665 49.996 1.00 0.00 C ATOM 11861 H10R PA 340 57.374 79.713 49.708 1.00 0.00 H ATOM 11862 H10S PA 340 57.722 78.069 49.200 1.00 0.00 H ATOM 11863 C19 PA 340 58.122 78.615 51.268 1.00 0.00 C ATOM 11864 H9R PA 340 59.060 79.104 50.998 1.00 0.00 H ATOM 11865 H9S PA 340 58.417 77.658 51.703 1.00 0.00 H ATOM 11866 C18 PA 340 57.388 79.417 52.409 1.00 0.00 C ATOM 11867 H8R PA 340 56.701 78.766 52.953 1.00 0.00 H ATOM 11868 H8S PA 340 56.836 80.202 51.887 1.00 0.00 H ATOM 11869 C17 PA 340 58.357 80.224 53.349 1.00 0.00 C ATOM 11870 H7R PA 340 58.812 80.848 52.577 1.00 0.00 H ATOM 11871 H7S PA 340 59.142 79.666 53.864 1.00 0.00 H ATOM 11872 C16 PA 340 57.746 81.215 54.366 1.00 0.00 C ATOM 11873 H6R PA 340 56.842 81.755 54.079 1.00 0.00 H ATOM 11874 H6S PA 340 58.453 82.028 54.548 1.00 0.00 H ATOM 11875 C15 PA 340 57.407 80.534 55.696 1.00 0.00 C ATOM 11876 H5R PA 340 57.693 81.125 56.569 1.00 0.00 H ATOM 11877 H5S PA 340 57.974 79.603 55.755 1.00 0.00 H ATOM 11878 C14 PA 340 55.913 80.338 55.671 1.00 0.00 C ATOM 11879 H4R PA 340 55.562 80.067 54.673 1.00 0.00 H ATOM 11880 H4S PA 340 55.420 81.205 56.115 1.00 0.00 H ATOM 11881 C13 PA 340 55.346 79.324 56.701 1.00 0.00 C ATOM 11882 H3R PA 340 55.596 79.721 57.686 1.00 0.00 H ATOM 11883 H3S PA 340 55.845 78.354 56.639 1.00 0.00 H ATOM 11884 C12 PA 340 53.840 79.121 56.573 1.00 0.00 C ATOM 11885 H2R PA 340 53.486 78.896 55.565 1.00 0.00 H ATOM 11886 H2S PA 340 53.287 79.954 57.012 1.00 0.00 H ATOM 11887 C11 PGR 341 53.407 78.002 57.454 1.00 0.00 C ATOM 11888 O12 PGR 341 54.108 76.973 57.725 1.00 0.00 O ATOM 11889 O11 PGR 341 52.164 78.125 57.800 1.00 0.00 O ATOM 11890 C1 PGR 341 51.390 77.254 58.682 1.00 0.00 C ATOM 11891 HR PGR 341 51.989 77.101 59.583 1.00 0.00 H ATOM 11892 HS PGR 341 51.328 76.216 58.344 1.00 0.00 H ATOM 11893 C2 PGR 341 50.064 77.940 59.052 1.00 0.00 C ATOM 11894 HX PGR 341 50.265 78.868 59.594 1.00 0.00 H ATOM 11895 C3 PGR 341 49.284 77.019 60.062 1.00 0.00 C ATOM 11896 HA PGR 341 49.870 76.890 60.976 1.00 0.00 H ATOM 11897 HB PGR 341 49.098 76.030 59.636 1.00 0.00 H ATOM 11898 O31 PGR 341 48.010 77.527 60.452 1.00 0.00 O ATOM 11899 P31 PGR 341 47.907 78.603 61.631 1.00 0.00 P ATOM 11900 O32 PGR 341 48.805 79.865 61.227 1.00 0.00 O ATOM 11901 C31 PGR 341 48.480 80.839 60.226 1.00 0.00 C ATOM 11902 H1A PGR 341 47.848 80.406 59.447 1.00 0.00 H ATOM 11903 H1B PGR 341 49.390 81.128 59.694 1.00 0.00 H ATOM 11904 C32 PGR 341 47.735 82.093 60.666 1.00 0.00 C ATOM 11905 H2A PGR 341 47.640 82.797 59.835 1.00 0.00 H ATOM 11906 O35 PGR 341 46.448 81.671 61.094 1.00 0.00 O ATOM 11907 HO5A PGR 341 46.531 80.818 61.557 1.00 0.00 H ATOM 11908 C33 PGR 341 48.275 82.818 61.902 1.00 0.00 C ATOM 11909 H3A PGR 341 49.273 83.190 61.657 1.00 0.00 H ATOM 11910 H3B PGR 341 47.588 83.623 62.172 1.00 0.00 H ATOM 11911 O33 PGR 341 46.493 79.095 61.716 1.00 0.00 O ATOM 11912 O34 PGR 341 48.562 78.045 62.874 1.00 0.00 O ATOM 11913 O21 PGR 341 49.216 78.215 57.873 1.00 0.00 O ATOM 11914 C21 PGR 341 49.542 79.357 57.244 1.00 0.00 C ATOM 11915 O22 PGR 341 50.164 80.248 57.743 1.00 0.00 O ATOM 11916 O36 PGR 341 48.333 81.958 63.024 1.00 0.00 O ATOM 11917 HO6A PGR 341 47.492 81.998 63.515 1.00 0.00 H ATOM 11918 C12 OL 342 48.868 79.455 55.931 1.00 0.00 C ATOM 11919 H2R OL 342 47.966 78.843 55.857 1.00 0.00 H ATOM 11920 H2S OL 342 48.581 80.506 55.860 1.00 0.00 H ATOM 11921 C13 OL 342 49.661 79.213 54.701 1.00 0.00 C ATOM 11922 H3R OL 342 49.965 78.166 54.643 1.00 0.00 H ATOM 11923 H3S OL 342 48.957 79.375 53.882 1.00 0.00 H ATOM 11924 C14 OL 342 50.770 80.276 54.560 1.00 0.00 C ATOM 11925 H4R OL 342 50.225 81.219 54.484 1.00 0.00 H ATOM 11926 H4S OL 342 51.384 80.353 55.460 1.00 0.00 H ATOM 11927 C15 OL 342 51.656 79.940 53.326 1.00 0.00 C ATOM 11928 H5R OL 342 52.198 79.012 53.524 1.00 0.00 H ATOM 11929 H5S OL 342 50.982 79.731 52.493 1.00 0.00 H ATOM 11930 C16 OL 342 52.676 81.085 52.996 1.00 0.00 C ATOM 11931 H6R OL 342 52.186 81.986 53.372 1.00 0.00 H ATOM 11932 H6S OL 342 53.564 81.257 53.608 1.00 0.00 H ATOM 11933 C17 OL 342 53.242 81.069 51.569 1.00 0.00 C ATOM 11934 H7R OL 342 54.030 80.320 51.675 1.00 0.00 H ATOM 11935 H7S OL 342 52.516 80.644 50.872 1.00 0.00 H ATOM 11936 C18 OL 342 53.521 82.505 51.075 1.00 0.00 C ATOM 11937 H8R OL 342 52.581 82.883 50.669 1.00 0.00 H ATOM 11938 H8S OL 342 53.742 83.112 51.956 1.00 0.00 H ATOM 11939 C19 OL 342 54.723 82.412 50.161 1.00 0.00 C ATOM 11940 H9R OL 342 55.117 81.404 50.059 1.00 0.00 H ATOM 11941 C110 OL 342 55.368 83.447 49.598 1.00 0.00 C ATOM 11942 H10R OL 342 56.322 83.246 49.117 1.00 0.00 H ATOM 11943 C111 OL 342 54.847 84.860 49.504 1.00 0.00 C ATOM 11944 H11R OL 342 53.883 85.011 49.993 1.00 0.00 H ATOM 11945 H11S OL 342 55.574 85.444 50.071 1.00 0.00 H ATOM 11946 C112 OL 342 54.906 85.292 48.063 1.00 0.00 C ATOM 11947 H12R OL 342 55.905 85.025 47.712 1.00 0.00 H ATOM 11948 H12S OL 342 54.103 84.718 47.595 1.00 0.00 H ATOM 11949 C113 OL 342 54.589 86.777 47.895 1.00 0.00 C ATOM 11950 H13R OL 342 53.777 86.944 48.605 1.00 0.00 H ATOM 11951 H13S OL 342 55.395 87.435 48.226 1.00 0.00 H ATOM 11952 C114 OL 342 54.356 87.047 46.391 1.00 0.00 C ATOM 11953 H14R OL 342 55.170 86.551 45.857 1.00 0.00 H ATOM 11954 H14S OL 342 53.455 86.588 45.978 1.00 0.00 H ATOM 11955 C115 OL 342 54.363 88.570 46.106 1.00 0.00 C ATOM 11956 H15R OL 342 53.683 89.221 46.659 1.00 0.00 H ATOM 11957 H15S OL 342 55.342 88.896 46.463 1.00 0.00 H ATOM 11958 C116 OL 342 54.265 88.861 44.664 1.00 0.00 C ATOM 11959 H16R OL 342 55.054 88.280 44.183 1.00 0.00 H ATOM 11960 H16S OL 342 53.367 88.349 44.311 1.00 0.00 H ATOM 11961 C117 OL 342 54.387 90.308 44.207 1.00 0.00 C ATOM 11962 H17R OL 342 54.415 90.457 43.125 1.00 0.00 H ATOM 11963 H17S OL 342 53.473 90.800 44.547 1.00 0.00 H ATOM 11964 C118 OL 342 55.444 91.203 44.835 1.00 0.00 C ATOM 11965 H18R OL 342 55.212 92.255 44.657 1.00 0.00 H ATOM 11966 H18S OL 342 56.450 91.021 44.452 1.00 0.00 H ATOM 11967 H18T OL 342 55.611 91.035 45.901 1.00 0.00 H TER 11968 OL 342 ATOM 11968 C116 PA 343 23.529 25.196 42.421 1.00 0.00 C ATOM 11969 H16R PA 343 22.565 25.160 41.909 1.00 0.00 H ATOM 11970 H16S PA 343 23.423 25.275 43.505 1.00 0.00 H ATOM 11971 H16T PA 343 23.984 24.296 42.004 1.00 0.00 H ATOM 11972 C115 PA 343 24.481 26.320 41.973 1.00 0.00 C ATOM 11973 H15R PA 343 24.034 27.311 42.076 1.00 0.00 H ATOM 11974 H15S PA 343 24.606 26.161 40.899 1.00 0.00 H ATOM 11975 C114 PA 343 25.879 26.322 42.643 1.00 0.00 C ATOM 11976 H14R PA 343 26.506 27.021 42.086 1.00 0.00 H ATOM 11977 H14S PA 343 26.271 25.314 42.490 1.00 0.00 H ATOM 11978 C113 PA 343 25.834 26.507 44.188 1.00 0.00 C ATOM 11979 H13R PA 343 25.369 25.618 44.619 1.00 0.00 H ATOM 11980 H13S PA 343 25.255 27.376 44.509 1.00 0.00 H ATOM 11981 C112 PA 343 27.188 26.666 44.754 1.00 0.00 C ATOM 11982 H12R PA 343 27.491 27.650 44.391 1.00 0.00 H ATOM 11983 H12S PA 343 28.005 26.024 44.420 1.00 0.00 H ATOM 11984 C111 PA 343 27.380 26.707 46.233 1.00 0.00 C ATOM 11985 H11R PA 343 26.824 25.850 46.617 1.00 0.00 H ATOM 11986 H11S PA 343 26.970 27.643 46.618 1.00 0.00 H ATOM 11987 C110 PA 343 28.839 26.663 46.704 1.00 0.00 C ATOM 11988 H10R PA 343 29.499 27.351 46.173 1.00 0.00 H ATOM 11989 H10S PA 343 29.270 25.666 46.593 1.00 0.00 H ATOM 11990 C19 PA 343 28.983 26.998 48.217 1.00 0.00 C ATOM 11991 H9R PA 343 28.545 27.952 48.518 1.00 0.00 H ATOM 11992 H9S PA 343 30.047 27.021 48.465 1.00 0.00 H ATOM 11993 C18 PA 343 28.546 25.834 49.086 1.00 0.00 C ATOM 11994 H8R PA 343 29.334 25.119 48.841 1.00 0.00 H ATOM 11995 H8S PA 343 27.627 25.357 48.741 1.00 0.00 H ATOM 11996 C17 PA 343 28.362 26.091 50.624 1.00 0.00 C ATOM 11997 H7R PA 343 28.129 25.067 50.926 1.00 0.00 H ATOM 11998 H7S PA 343 27.392 26.589 50.686 1.00 0.00 H ATOM 11999 C16 PA 343 29.500 26.727 51.347 1.00 0.00 C ATOM 12000 H6R PA 343 29.612 27.737 50.945 1.00 0.00 H ATOM 12001 H6S PA 343 30.467 26.290 51.089 1.00 0.00 H ATOM 12002 C15 PA 343 29.481 26.577 52.936 1.00 0.00 C ATOM 12003 H5R PA 343 30.238 27.224 53.384 1.00 0.00 H ATOM 12004 H5S PA 343 29.882 25.567 53.040 1.00 0.00 H ATOM 12005 C14 PA 343 28.182 26.684 53.684 1.00 0.00 C ATOM 12006 H4R PA 343 28.424 26.643 54.748 1.00 0.00 H ATOM 12007 H4S PA 343 27.456 25.907 53.437 1.00 0.00 H ATOM 12008 C13 PA 343 27.457 28.066 53.614 1.00 0.00 C ATOM 12009 H3R PA 343 26.599 28.094 54.289 1.00 0.00 H ATOM 12010 H3S PA 343 27.090 28.206 52.595 1.00 0.00 H ATOM 12011 C12 PA 343 28.424 29.244 53.955 1.00 0.00 C ATOM 12012 H2R PA 343 27.957 30.231 53.965 1.00 0.00 H ATOM 12013 H2S PA 343 29.221 29.262 53.208 1.00 0.00 H ATOM 12014 C11 PGR 344 29.032 29.105 55.257 1.00 0.00 C ATOM 12015 O12 PGR 344 28.268 28.942 56.211 1.00 0.00 O ATOM 12016 O11 PGR 344 30.379 29.046 55.254 1.00 0.00 O ATOM 12017 C1 PGR 344 31.115 28.880 56.529 1.00 0.00 C ATOM 12018 HR PGR 344 30.561 29.472 57.262 1.00 0.00 H ATOM 12019 HS PGR 344 32.160 29.190 56.446 1.00 0.00 H ATOM 12020 C2 PGR 344 31.009 27.437 57.058 1.00 0.00 C ATOM 12021 HX PGR 344 29.965 27.116 57.005 1.00 0.00 H ATOM 12022 C3 PGR 344 31.513 27.336 58.490 1.00 0.00 C ATOM 12023 HA PGR 344 31.107 28.221 58.987 1.00 0.00 H ATOM 12024 HB PGR 344 32.601 27.388 58.571 1.00 0.00 H ATOM 12025 O31 PGR 344 31.020 26.217 59.233 1.00 0.00 O ATOM 12026 P31 PGR 344 31.166 26.058 60.809 1.00 0.00 P ATOM 12027 O32 PGR 344 32.613 25.492 60.963 1.00 0.00 O ATOM 12028 C31 PGR 344 32.879 24.149 61.174 1.00 0.00 C ATOM 12029 H1A PGR 344 32.241 23.799 61.990 1.00 0.00 H ATOM 12030 H1B PGR 344 33.944 24.128 61.417 1.00 0.00 H ATOM 12031 C32 PGR 344 32.664 23.283 59.957 1.00 0.00 C ATOM 12032 H2A PGR 344 31.608 23.464 59.742 1.00 0.00 H ATOM 12033 O35 PGR 344 33.682 23.609 58.979 1.00 0.00 O ATOM 12034 HO5A PGR 344 33.670 24.578 58.877 1.00 0.00 H ATOM 12035 C33 PGR 344 32.751 21.815 60.340 1.00 0.00 C ATOM 12036 H3A PGR 344 31.993 21.528 61.072 1.00 0.00 H ATOM 12037 H3B PGR 344 32.640 21.218 59.431 1.00 0.00 H ATOM 12038 O33 PGR 344 31.140 27.372 61.513 1.00 0.00 O ATOM 12039 O34 PGR 344 30.256 25.005 61.253 1.00 0.00 O ATOM 12040 O21 PGR 344 31.818 26.611 56.195 1.00 0.00 O ATOM 12041 C21 PGR 344 31.584 25.226 56.207 1.00 0.00 C ATOM 12042 O22 PGR 344 30.562 24.797 56.628 1.00 0.00 O ATOM 12043 O36 PGR 344 34.013 21.565 60.922 1.00 0.00 O ATOM 12044 HO6A PGR 344 34.466 21.935 60.142 1.00 0.00 H ATOM 12045 C12 OL 345 32.669 24.341 55.612 1.00 0.00 C ATOM 12046 H2R OL 345 33.300 23.727 56.258 1.00 0.00 H ATOM 12047 H2S OL 345 32.091 23.491 55.243 1.00 0.00 H ATOM 12048 C13 OL 345 33.690 25.105 54.650 1.00 0.00 C ATOM 12049 H3R OL 345 33.070 25.606 53.903 1.00 0.00 H ATOM 12050 H3S OL 345 34.199 25.919 55.171 1.00 0.00 H ATOM 12051 C14 OL 345 34.536 24.059 53.907 1.00 0.00 C ATOM 12052 H4R OL 345 35.031 23.529 54.724 1.00 0.00 H ATOM 12053 H4S OL 345 33.935 23.311 53.385 1.00 0.00 H ATOM 12054 C15 OL 345 35.403 24.743 52.860 1.00 0.00 C ATOM 12055 H5R OL 345 34.732 25.357 52.255 1.00 0.00 H ATOM 12056 H5S OL 345 36.081 25.446 53.349 1.00 0.00 H ATOM 12057 C16 OL 345 36.280 23.808 52.075 1.00 0.00 C ATOM 12058 H6R OL 345 37.098 24.376 51.628 1.00 0.00 H ATOM 12059 H6S OL 345 36.757 23.041 52.688 1.00 0.00 H ATOM 12060 C17 OL 345 35.473 23.178 50.897 1.00 0.00 C ATOM 12061 H7R OL 345 34.477 22.829 51.178 1.00 0.00 H ATOM 12062 H7S OL 345 35.237 23.834 50.057 1.00 0.00 H ATOM 12063 C18 OL 345 36.051 21.842 50.428 1.00 0.00 C ATOM 12064 H8R OL 345 37.116 21.678 50.602 1.00 0.00 H ATOM 12065 H8S OL 345 35.686 20.985 50.998 1.00 0.00 H ATOM 12066 C19 OL 345 35.910 21.519 48.961 1.00 0.00 C ATOM 12067 H9R OL 345 35.208 20.703 48.809 1.00 0.00 H ATOM 12068 C110 OL 345 36.604 21.953 47.940 1.00 0.00 C ATOM 12069 H10R OL 345 36.363 21.596 46.942 1.00 0.00 H ATOM 12070 C111 OL 345 37.610 23.018 48.051 1.00 0.00 C ATOM 12071 H11R OL 345 37.232 23.867 47.478 1.00 0.00 H ATOM 12072 H11S OL 345 37.907 23.335 49.053 1.00 0.00 H ATOM 12073 C112 OL 345 38.974 22.709 47.413 1.00 0.00 C ATOM 12074 H12R OL 345 39.449 23.652 47.688 1.00 0.00 H ATOM 12075 H12S OL 345 39.492 21.952 48.006 1.00 0.00 H ATOM 12076 C113 OL 345 38.888 22.483 45.862 1.00 0.00 C ATOM 12077 H13R OL 345 38.547 21.505 45.514 1.00 0.00 H ATOM 12078 H13S OL 345 38.157 23.151 45.401 1.00 0.00 H ATOM 12079 C114 OL 345 40.294 22.631 45.194 1.00 0.00 C ATOM 12080 H14R OL 345 40.628 23.670 45.228 1.00 0.00 H ATOM 12081 H14S OL 345 41.109 22.149 45.739 1.00 0.00 H ATOM 12082 C115 OL 345 40.374 22.255 43.669 1.00 0.00 C ATOM 12083 H15R OL 345 39.588 21.511 43.528 1.00 0.00 H ATOM 12084 H15S OL 345 40.169 23.150 43.078 1.00 0.00 H ATOM 12085 C116 OL 345 41.667 21.519 43.351 1.00 0.00 C ATOM 12086 H16R OL 345 42.464 22.229 43.581 1.00 0.00 H ATOM 12087 H16S OL 345 41.809 20.744 44.106 1.00 0.00 H ATOM 12088 C117 OL 345 41.886 21.042 41.935 1.00 0.00 C ATOM 12089 H17R OL 345 41.238 20.183 41.748 1.00 0.00 H ATOM 12090 H17S OL 345 41.544 21.683 41.120 1.00 0.00 H ATOM 12091 C118 OL 345 43.318 20.588 41.753 1.00 0.00 C ATOM 12092 H18R OL 345 43.446 19.759 42.452 1.00 0.00 H ATOM 12093 H18S OL 345 44.042 21.317 42.122 1.00 0.00 H ATOM 12094 H18T OL 345 43.655 20.322 40.748 1.00 0.00 H TER 12095 OL 345 ATOM 12095 C116 PA 346 105.863 31.404 39.151 1.00 0.00 C ATOM 12096 H16R PA 346 106.489 32.297 39.203 1.00 0.00 H ATOM 12097 H16S PA 346 106.404 30.679 38.539 1.00 0.00 H ATOM 12098 H16T PA 346 105.834 30.923 40.131 1.00 0.00 H ATOM 12099 C115 PA 346 104.476 31.717 38.556 1.00 0.00 C ATOM 12100 H15R PA 346 103.852 30.840 38.742 1.00 0.00 H ATOM 12101 H15S PA 346 104.314 31.751 37.476 1.00 0.00 H ATOM 12102 C114 PA 346 103.735 32.985 39.114 1.00 0.00 C ATOM 12103 H14R PA 346 102.837 33.077 38.500 1.00 0.00 H ATOM 12104 H14S PA 346 104.260 33.940 39.041 1.00 0.00 H ATOM 12105 C113 PA 346 103.459 32.896 40.589 1.00 0.00 C ATOM 12106 H13R PA 346 104.452 32.840 41.040 1.00 0.00 H ATOM 12107 H13S PA 346 102.864 32.018 40.849 1.00 0.00 H ATOM 12108 C112 PA 346 102.611 34.085 41.093 1.00 0.00 C ATOM 12109 H12R PA 346 101.714 34.188 40.478 1.00 0.00 H ATOM 12110 H12S PA 346 103.194 34.997 40.948 1.00 0.00 H ATOM 12111 C111 PA 346 102.331 33.948 42.613 1.00 0.00 C ATOM 12112 H11R PA 346 101.755 33.034 42.770 1.00 0.00 H ATOM 12113 H11S PA 346 101.591 34.671 42.963 1.00 0.00 H ATOM 12114 C110 PA 346 103.547 33.980 43.554 1.00 0.00 C ATOM 12115 H10R PA 346 103.986 34.977 43.475 1.00 0.00 H ATOM 12116 H10S PA 346 104.310 33.231 43.330 1.00 0.00 H ATOM 12117 C19 PA 346 103.255 33.628 45.009 1.00 0.00 C ATOM 12118 H9R PA 346 102.637 34.432 45.413 1.00 0.00 H ATOM 12119 H9S PA 346 104.199 33.772 45.539 1.00 0.00 H ATOM 12120 C18 PA 346 102.661 32.254 45.155 1.00 0.00 C ATOM 12121 H8R PA 346 103.206 31.606 44.466 1.00 0.00 H ATOM 12122 H8S PA 346 101.604 32.090 44.935 1.00 0.00 H ATOM 12123 C17 PA 346 102.963 31.616 46.512 1.00 0.00 C ATOM 12124 H7R PA 346 104.033 31.632 46.728 1.00 0.00 H ATOM 12125 H7S PA 346 102.710 30.555 46.460 1.00 0.00 H ATOM 12126 C16 PA 346 102.482 32.452 47.672 1.00 0.00 C ATOM 12127 H6R PA 346 101.435 32.711 47.501 1.00 0.00 H ATOM 12128 H6S PA 346 103.014 33.405 47.632 1.00 0.00 H ATOM 12129 C15 PA 346 102.679 31.948 49.109 1.00 0.00 C ATOM 12130 H5R PA 346 102.633 32.817 49.768 1.00 0.00 H ATOM 12131 H5S PA 346 103.659 31.497 49.277 1.00 0.00 H ATOM 12132 C14 PA 346 101.597 31.004 49.590 1.00 0.00 C ATOM 12133 H4R PA 346 101.417 30.123 48.971 1.00 0.00 H ATOM 12134 H4S PA 346 100.619 31.417 49.845 1.00 0.00 H ATOM 12135 C13 PA 346 101.967 30.239 50.891 1.00 0.00 C ATOM 12136 H3R PA 346 102.100 30.935 51.722 1.00 0.00 H ATOM 12137 H3S PA 346 102.931 29.728 50.924 1.00 0.00 H ATOM 12138 C12 PA 346 100.836 29.251 51.313 1.00 0.00 C ATOM 12139 H2R PA 346 100.655 28.470 50.571 1.00 0.00 H ATOM 12140 H2S PA 346 99.912 29.815 51.456 1.00 0.00 H ATOM 12141 C11 PC 347 101.317 28.731 52.635 1.00 0.00 C ATOM 12142 O12 PC 347 102.387 28.198 52.714 1.00 0.00 O ATOM 12143 O11 PC 347 100.439 28.907 53.630 1.00 0.00 O ATOM 12144 C1 PC 347 100.766 28.233 54.866 1.00 0.00 C ATOM 12145 HR PC 347 100.122 28.675 55.630 1.00 0.00 H ATOM 12146 HS PC 347 101.799 28.482 55.121 1.00 0.00 H ATOM 12147 C2 PC 347 100.437 26.745 54.766 1.00 0.00 C ATOM 12148 HX PC 347 99.501 26.643 54.210 1.00 0.00 H ATOM 12149 C3 PC 347 100.300 26.128 56.152 1.00 0.00 C ATOM 12150 HA PC 347 100.186 25.054 55.984 1.00 0.00 H ATOM 12151 HB PC 347 99.502 26.508 56.796 1.00 0.00 H ATOM 12152 O31 PC 347 101.456 26.354 56.886 1.00 0.00 O ATOM 12153 P31 PC 347 101.468 25.880 58.436 1.00 0.00 P ATOM 12154 O32 PC 347 100.610 26.906 59.248 1.00 0.00 O ATOM 12155 C31 PC 347 99.963 26.544 60.477 1.00 0.00 C ATOM 12156 H1A PC 347 100.674 26.212 61.239 1.00 0.00 H ATOM 12157 H1B PC 347 99.268 25.714 60.328 1.00 0.00 H ATOM 12158 C32 PC 347 99.186 27.767 61.081 1.00 0.00 C ATOM 12159 H2A PC 347 98.718 28.430 60.352 1.00 0.00 H ATOM 12160 H2B PC 347 99.956 28.402 61.522 1.00 0.00 H ATOM 12161 N31 PC 347 98.201 27.480 62.198 1.00 0.00 N ATOM 12162 C33 PC 347 97.634 28.704 62.840 1.00 0.00 C ATOM 12163 H3A PC 347 97.081 29.242 62.069 1.00 0.00 H ATOM 12164 H3B PC 347 98.388 29.420 63.171 1.00 0.00 H ATOM 12165 H3C PC 347 97.008 28.448 63.696 1.00 0.00 H ATOM 12166 C34 PC 347 97.014 26.793 61.744 1.00 0.00 C ATOM 12167 H4A PC 347 97.255 25.733 61.650 1.00 0.00 H ATOM 12168 H4B PC 347 96.679 27.176 60.779 1.00 0.00 H ATOM 12169 H4C PC 347 96.247 26.945 62.505 1.00 0.00 H ATOM 12170 C35 PC 347 98.878 26.721 63.292 1.00 0.00 C ATOM 12171 H5A PC 347 99.632 27.280 63.849 1.00 0.00 H ATOM 12172 H5B PC 347 99.420 25.871 62.873 1.00 0.00 H ATOM 12173 H5C PC 347 98.142 26.249 63.944 1.00 0.00 H ATOM 12174 O33 PC 347 100.772 24.524 58.520 1.00 0.00 O ATOM 12175 O34 PC 347 102.805 26.064 58.953 1.00 0.00 O ATOM 12176 O21 PC 347 101.406 25.914 54.034 1.00 0.00 O ATOM 12177 C21 PC 347 101.155 25.615 52.704 1.00 0.00 C ATOM 12178 O22 PC 347 100.195 25.989 52.085 1.00 0.00 O ATOM 12179 C12 OL 348 102.372 25.025 52.104 1.00 0.00 C ATOM 12180 H2R OL 348 103.081 25.836 51.925 1.00 0.00 H ATOM 12181 H2S OL 348 102.636 24.205 52.775 1.00 0.00 H ATOM 12182 C13 OL 348 102.159 24.352 50.729 1.00 0.00 C ATOM 12183 H3R OL 348 101.350 23.619 50.750 1.00 0.00 H ATOM 12184 H3S OL 348 101.792 25.195 50.140 1.00 0.00 H ATOM 12185 C14 OL 348 103.474 23.742 50.141 1.00 0.00 C ATOM 12186 H4R OL 348 104.215 24.526 49.973 1.00 0.00 H ATOM 12187 H4S OL 348 103.999 23.044 50.798 1.00 0.00 H ATOM 12188 C15 OL 348 103.243 23.203 48.733 1.00 0.00 C ATOM 12189 H5R OL 348 102.490 22.413 48.687 1.00 0.00 H ATOM 12190 H5S OL 348 102.776 24.057 48.239 1.00 0.00 H ATOM 12191 C16 OL 348 104.375 22.597 47.955 1.00 0.00 C ATOM 12192 H6R OL 348 105.114 23.380 47.769 1.00 0.00 H ATOM 12193 H6S OL 348 104.955 21.756 48.342 1.00 0.00 H ATOM 12194 C17 OL 348 103.940 22.200 46.534 1.00 0.00 C ATOM 12195 H7R OL 348 104.763 21.796 45.941 1.00 0.00 H ATOM 12196 H7S OL 348 103.273 21.355 46.722 1.00 0.00 H ATOM 12197 C18 OL 348 103.249 23.283 45.697 1.00 0.00 C ATOM 12198 H8R OL 348 102.410 23.811 46.155 1.00 0.00 H ATOM 12199 H8S OL 348 104.045 24.028 45.637 1.00 0.00 H ATOM 12200 C19 OL 348 102.819 22.627 44.407 1.00 0.00 C ATOM 12201 H9R OL 348 103.593 22.612 43.645 1.00 0.00 H ATOM 12202 C110 OL 348 101.684 21.979 44.260 1.00 0.00 C ATOM 12203 H10R OL 348 101.466 21.588 43.270 1.00 0.00 H ATOM 12204 C111 OL 348 100.464 21.877 45.145 1.00 0.00 C ATOM 12205 H11R OL 348 100.417 22.648 45.916 1.00 0.00 H ATOM 12206 H11S OL 348 99.577 22.088 44.545 1.00 0.00 H ATOM 12207 C112 OL 348 100.439 20.608 45.999 1.00 0.00 C ATOM 12208 H12R OL 348 100.625 19.742 45.360 1.00 0.00 H ATOM 12209 H12S OL 348 101.260 20.566 46.718 1.00 0.00 H ATOM 12210 C113 OL 348 99.185 20.589 46.897 1.00 0.00 C ATOM 12211 H13R OL 348 98.277 20.949 46.410 1.00 0.00 H ATOM 12212 H13S OL 348 98.991 19.530 47.080 1.00 0.00 H ATOM 12213 C114 OL 348 99.349 21.203 48.298 1.00 0.00 C ATOM 12214 H14R OL 348 100.119 20.621 48.808 1.00 0.00 H ATOM 12215 H14S OL 348 99.680 22.225 48.102 1.00 0.00 H ATOM 12216 C115 OL 348 98.044 21.255 49.124 1.00 0.00 C ATOM 12217 H15R OL 348 98.325 21.415 50.167 1.00 0.00 H ATOM 12218 H15S OL 348 97.444 22.150 48.951 1.00 0.00 H ATOM 12219 C116 OL 348 97.123 20.051 49.093 1.00 0.00 C ATOM 12220 H16R OL 348 96.209 20.399 49.578 1.00 0.00 H ATOM 12221 H16S OL 348 96.706 19.788 48.119 1.00 0.00 H ATOM 12222 C117 OL 348 97.637 18.772 49.731 1.00 0.00 C ATOM 12223 H17R OL 348 98.317 18.292 49.024 1.00 0.00 H ATOM 12224 H17S OL 348 98.253 18.936 50.618 1.00 0.00 H ATOM 12225 C118 OL 348 96.567 17.758 50.013 1.00 0.00 C ATOM 12226 H18R OL 348 97.086 16.822 50.232 1.00 0.00 H ATOM 12227 H18S OL 348 95.831 17.570 49.228 1.00 0.00 H ATOM 12228 H18T OL 348 96.019 18.108 50.891 1.00 0.00 H TER 12229 OL 348 ATOM 12229 C116 PA 349 39.791 16.866 42.924 1.00 0.00 C ATOM 12230 H16R PA 349 39.759 15.850 42.523 1.00 0.00 H ATOM 12231 H16S PA 349 39.056 17.493 42.415 1.00 0.00 H ATOM 12232 H16T PA 349 39.477 16.869 43.970 1.00 0.00 H ATOM 12233 C115 PA 349 41.199 17.423 42.842 1.00 0.00 C ATOM 12234 H15R PA 349 41.944 16.839 43.387 1.00 0.00 H ATOM 12235 H15S PA 349 41.206 18.407 43.315 1.00 0.00 H ATOM 12236 C114 PA 349 41.693 17.501 41.386 1.00 0.00 C ATOM 12237 H14R PA 349 42.613 18.086 41.324 1.00 0.00 H ATOM 12238 H14S PA 349 40.973 18.050 40.775 1.00 0.00 H ATOM 12239 C113 PA 349 41.972 16.137 40.876 1.00 0.00 C ATOM 12240 H13R PA 349 42.224 16.245 39.819 1.00 0.00 H ATOM 12241 H13S PA 349 41.124 15.459 40.990 1.00 0.00 H ATOM 12242 C112 PA 349 43.087 15.316 41.483 1.00 0.00 C ATOM 12243 H12R PA 349 43.108 14.349 40.975 1.00 0.00 H ATOM 12244 H12S PA 349 42.872 15.109 42.533 1.00 0.00 H ATOM 12245 C111 PA 349 44.525 15.772 41.346 1.00 0.00 C ATOM 12246 H11R PA 349 44.674 16.777 41.747 1.00 0.00 H ATOM 12247 H11S PA 349 44.851 15.956 40.320 1.00 0.00 H ATOM 12248 C110 PA 349 45.588 14.747 41.918 1.00 0.00 C ATOM 12249 H10R PA 349 46.567 15.224 41.847 1.00 0.00 H ATOM 12250 H10S PA 349 45.636 13.998 41.125 1.00 0.00 H ATOM 12251 C19 PA 349 45.562 14.046 43.315 1.00 0.00 C ATOM 12252 H9R PA 349 46.542 13.586 43.455 1.00 0.00 H ATOM 12253 H9S PA 349 44.781 13.292 43.437 1.00 0.00 H ATOM 12254 C18 PA 349 45.248 15.067 44.369 1.00 0.00 C ATOM 12255 H8R PA 349 44.258 15.473 44.152 1.00 0.00 H ATOM 12256 H8S PA 349 46.062 15.792 44.313 1.00 0.00 H ATOM 12257 C17 PA 349 45.121 14.474 45.788 1.00 0.00 C ATOM 12258 H7R PA 349 46.126 14.217 46.128 1.00 0.00 H ATOM 12259 H7S PA 349 44.520 13.562 45.768 1.00 0.00 H ATOM 12260 C16 PA 349 44.505 15.400 46.855 1.00 0.00 C ATOM 12261 H6R PA 349 43.436 15.424 46.632 1.00 0.00 H ATOM 12262 H6S PA 349 44.882 16.420 46.758 1.00 0.00 H ATOM 12263 C15 PA 349 44.752 14.952 48.313 1.00 0.00 C ATOM 12264 H5R PA 349 44.668 13.863 48.327 1.00 0.00 H ATOM 12265 H5S PA 349 43.788 15.127 48.796 1.00 0.00 H ATOM 12266 C14 PA 349 45.804 15.637 49.133 1.00 0.00 C ATOM 12267 H4R PA 349 45.609 16.645 49.503 1.00 0.00 H ATOM 12268 H4S PA 349 46.735 15.746 48.572 1.00 0.00 H ATOM 12269 C13 PA 349 46.248 14.925 50.435 1.00 0.00 C ATOM 12270 H3R PA 349 46.515 13.869 50.357 1.00 0.00 H ATOM 12271 H3S PA 349 45.309 14.778 50.974 1.00 0.00 H ATOM 12272 C12 PA 349 47.185 15.789 51.261 1.00 0.00 C ATOM 12273 H2R PA 349 46.702 16.739 51.500 1.00 0.00 H ATOM 12274 H2S PA 349 48.017 15.991 50.583 1.00 0.00 H ATOM 12275 C11 PGR 350 47.675 15.240 52.562 1.00 0.00 C ATOM 12276 O12 PGR 350 48.906 14.957 52.732 1.00 0.00 O ATOM 12277 O11 PGR 350 46.726 15.173 53.528 1.00 0.00 O ATOM 12278 C1 PGR 350 47.092 14.770 54.917 1.00 0.00 C ATOM 12279 HR PGR 350 47.484 15.689 55.361 1.00 0.00 H ATOM 12280 HS PGR 350 47.842 13.976 54.938 1.00 0.00 H ATOM 12281 C2 PGR 350 45.826 14.322 55.614 1.00 0.00 C ATOM 12282 HX PGR 350 45.097 15.136 55.589 1.00 0.00 H ATOM 12283 C3 PGR 350 46.099 13.997 57.081 1.00 0.00 C ATOM 12284 HA PGR 350 46.653 14.813 57.552 1.00 0.00 H ATOM 12285 HB PGR 350 46.619 13.036 57.043 1.00 0.00 H ATOM 12286 O31 PGR 350 44.882 13.895 57.856 1.00 0.00 O ATOM 12287 P31 PGR 350 43.951 15.143 58.239 1.00 0.00 P ATOM 12288 O32 PGR 350 42.957 15.234 57.061 1.00 0.00 O ATOM 12289 C31 PGR 350 41.859 14.344 56.830 1.00 0.00 C ATOM 12290 H1A PGR 350 41.181 14.339 57.687 1.00 0.00 H ATOM 12291 H1B PGR 350 42.295 13.351 56.699 1.00 0.00 H ATOM 12292 C32 PGR 350 41.092 14.878 55.594 1.00 0.00 C ATOM 12293 H2A PGR 350 41.824 15.088 54.810 1.00 0.00 H ATOM 12294 O35 PGR 350 40.569 16.189 55.910 1.00 0.00 O ATOM 12295 HO5A PGR 350 40.928 16.705 55.166 1.00 0.00 H ATOM 12296 C33 PGR 350 39.814 14.039 55.114 1.00 0.00 C ATOM 12297 H3A PGR 350 39.246 14.580 54.353 1.00 0.00 H ATOM 12298 H3B PGR 350 40.101 13.064 54.711 1.00 0.00 H ATOM 12299 O33 PGR 350 43.203 14.836 59.497 1.00 0.00 O ATOM 12300 O34 PGR 350 44.720 16.373 58.349 1.00 0.00 O ATOM 12301 O21 PGR 350 45.196 13.124 55.007 1.00 0.00 O ATOM 12302 C21 PGR 350 44.343 13.300 53.961 1.00 0.00 C ATOM 12303 O22 PGR 350 44.045 14.391 53.538 1.00 0.00 O ATOM 12304 O36 PGR 350 38.917 13.923 56.308 1.00 0.00 O ATOM 12305 HO6A PGR 350 38.049 13.645 55.964 1.00 0.00 H ATOM 12306 C12 OL 351 43.637 12.053 53.519 1.00 0.00 C ATOM 12307 H2R OL 351 43.975 11.132 53.998 1.00 0.00 H ATOM 12308 H2S OL 351 42.581 12.181 53.768 1.00 0.00 H ATOM 12309 C13 OL 351 43.899 11.744 52.074 1.00 0.00 C ATOM 12310 H3R OL 351 44.064 12.695 51.564 1.00 0.00 H ATOM 12311 H3S OL 351 44.805 11.136 52.032 1.00 0.00 H ATOM 12312 C14 OL 351 42.727 10.877 51.459 1.00 0.00 C ATOM 12313 H4R OL 351 42.894 9.842 51.763 1.00 0.00 H ATOM 12314 H4S OL 351 41.832 11.289 51.931 1.00 0.00 H ATOM 12315 C15 OL 351 42.666 10.827 49.964 1.00 0.00 C ATOM 12316 H5R OL 351 43.662 10.533 49.627 1.00 0.00 H ATOM 12317 H5S OL 351 41.948 10.069 49.646 1.00 0.00 H ATOM 12318 C16 OL 351 42.289 12.141 49.287 1.00 0.00 C ATOM 12319 H6R OL 351 41.389 12.464 49.813 1.00 0.00 H ATOM 12320 H6S OL 351 43.108 12.842 49.459 1.00 0.00 H ATOM 12321 C17 OL 351 42.031 12.012 47.718 1.00 0.00 C ATOM 12322 H7R OL 351 43.008 12.121 47.242 1.00 0.00 H ATOM 12323 H7S OL 351 41.530 11.064 47.508 1.00 0.00 H ATOM 12324 C18 OL 351 41.129 13.195 47.357 1.00 0.00 C ATOM 12325 H8R OL 351 40.216 12.987 47.918 1.00 0.00 H ATOM 12326 H8S OL 351 41.566 14.124 47.728 1.00 0.00 H ATOM 12327 C19 OL 351 41.045 13.221 45.893 1.00 0.00 C ATOM 12328 H9R OL 351 41.929 13.308 45.266 1.00 0.00 H ATOM 12329 C110 OL 351 39.872 13.428 45.313 1.00 0.00 C ATOM 12330 H10R OL 351 39.785 13.638 44.250 1.00 0.00 H ATOM 12331 C111 OL 351 38.517 13.482 46.030 1.00 0.00 C ATOM 12332 H11R OL 351 38.138 12.458 46.054 1.00 0.00 H ATOM 12333 H11S OL 351 38.605 13.805 47.070 1.00 0.00 H ATOM 12334 C112 OL 351 37.549 14.439 45.406 1.00 0.00 C ATOM 12335 H12R OL 351 37.437 14.367 44.322 1.00 0.00 H ATOM 12336 H12S OL 351 36.564 14.161 45.785 1.00 0.00 H ATOM 12337 C113 OL 351 37.656 15.929 45.838 1.00 0.00 C ATOM 12338 H13R OL 351 37.599 15.962 46.928 1.00 0.00 H ATOM 12339 H13S OL 351 38.684 16.225 45.619 1.00 0.00 H ATOM 12340 C114 OL 351 36.642 16.836 45.201 1.00 0.00 C ATOM 12341 H14R OL 351 36.721 16.840 44.111 1.00 0.00 H ATOM 12342 H14S OL 351 35.640 16.502 45.475 1.00 0.00 H ATOM 12343 C115 OL 351 36.834 18.277 45.455 1.00 0.00 C ATOM 12344 H15R OL 351 36.794 18.470 46.530 1.00 0.00 H ATOM 12345 H15S OL 351 37.842 18.616 45.209 1.00 0.00 H ATOM 12346 C116 OL 351 35.742 19.135 44.802 1.00 0.00 C ATOM 12347 H16R OL 351 34.885 19.209 45.475 1.00 0.00 H ATOM 12348 H16S OL 351 36.082 20.171 44.743 1.00 0.00 H ATOM 12349 C117 OL 351 35.203 18.708 43.411 1.00 0.00 C ATOM 12350 H17R OL 351 35.014 17.635 43.485 1.00 0.00 H ATOM 12351 H17S OL 351 34.307 19.324 43.308 1.00 0.00 H ATOM 12352 C118 OL 351 36.223 18.976 42.308 1.00 0.00 C ATOM 12353 H18R OL 351 37.024 18.236 42.354 1.00 0.00 H ATOM 12354 H18S OL 351 36.739 19.893 42.598 1.00 0.00 H ATOM 12355 H18T OL 351 35.935 19.010 41.255 1.00 0.00 H TER 12356 OL 351 ATOM 12356 C116 PA 352 82.671 94.262 43.628 1.00 0.00 C ATOM 12357 H16R PA 352 81.829 93.927 43.018 1.00 0.00 H ATOM 12358 H16S PA 352 83.389 93.453 43.779 1.00 0.00 H ATOM 12359 H16T PA 352 83.163 94.934 42.922 1.00 0.00 H ATOM 12360 C115 PA 352 82.145 94.998 44.899 1.00 0.00 C ATOM 12361 H15R PA 352 81.387 95.714 44.574 1.00 0.00 H ATOM 12362 H15S PA 352 82.902 95.500 45.505 1.00 0.00 H ATOM 12363 C114 PA 352 81.520 93.932 45.780 1.00 0.00 C ATOM 12364 H14R PA 352 82.281 93.150 45.823 1.00 0.00 H ATOM 12365 H14S PA 352 80.630 93.505 45.314 1.00 0.00 H ATOM 12366 C113 PA 352 81.168 94.278 47.227 1.00 0.00 C ATOM 12367 H13R PA 352 81.014 93.385 47.837 1.00 0.00 H ATOM 12368 H13S PA 352 80.249 94.866 47.282 1.00 0.00 H ATOM 12369 C112 PA 352 82.225 95.069 47.984 1.00 0.00 C ATOM 12370 H12R PA 352 81.823 95.381 48.950 1.00 0.00 H ATOM 12371 H12S PA 352 82.496 95.997 47.476 1.00 0.00 H ATOM 12372 C111 PA 352 83.587 94.282 48.020 1.00 0.00 C ATOM 12373 H11R PA 352 83.950 94.091 47.008 1.00 0.00 H ATOM 12374 H11S PA 352 83.382 93.314 48.482 1.00 0.00 H ATOM 12375 C110 PA 352 84.702 95.109 48.655 1.00 0.00 C ATOM 12376 H10R PA 352 84.400 95.407 49.661 1.00 0.00 H ATOM 12377 H10S PA 352 84.877 96.031 48.097 1.00 0.00 H ATOM 12378 C19 PA 352 86.026 94.372 48.679 1.00 0.00 C ATOM 12379 H9R PA 352 85.947 93.869 47.713 1.00 0.00 H ATOM 12380 H9S PA 352 86.013 93.529 49.373 1.00 0.00 H ATOM 12381 C18 PA 352 87.294 95.268 48.987 1.00 0.00 C ATOM 12382 H8R PA 352 88.217 94.717 48.794 1.00 0.00 H ATOM 12383 H8S PA 352 87.220 95.587 50.029 1.00 0.00 H ATOM 12384 C17 PA 352 87.485 96.580 48.303 1.00 0.00 C ATOM 12385 H7R PA 352 86.740 97.329 48.580 1.00 0.00 H ATOM 12386 H7S PA 352 87.248 96.376 47.257 1.00 0.00 H ATOM 12387 C16 PA 352 88.880 97.260 48.530 1.00 0.00 C ATOM 12388 H6R PA 352 88.921 98.091 47.823 1.00 0.00 H ATOM 12389 H6S PA 352 89.689 96.659 48.112 1.00 0.00 H ATOM 12390 C15 PA 352 89.044 97.740 49.918 1.00 0.00 C ATOM 12391 H5R PA 352 89.939 98.365 49.961 1.00 0.00 H ATOM 12392 H5S PA 352 89.237 96.888 50.572 1.00 0.00 H ATOM 12393 C14 PA 352 87.952 98.694 50.330 1.00 0.00 C ATOM 12394 H4R PA 352 87.001 98.157 50.316 1.00 0.00 H ATOM 12395 H4S PA 352 87.814 99.469 49.574 1.00 0.00 H ATOM 12396 C13 PA 352 88.175 99.379 51.627 1.00 0.00 C ATOM 12397 H3R PA 352 89.161 99.849 51.622 1.00 0.00 H ATOM 12398 H3S PA 352 88.285 98.565 52.347 1.00 0.00 H ATOM 12399 C12 PA 352 87.115 100.382 52.001 1.00 0.00 C ATOM 12400 H2R PA 352 86.982 101.270 51.379 1.00 0.00 H ATOM 12401 H2S PA 352 86.175 99.829 51.952 1.00 0.00 H ATOM 12402 C11 PC 353 87.265 100.802 53.451 1.00 0.00 C ATOM 12403 O12 PC 353 87.338 99.982 54.341 1.00 0.00 O ATOM 12404 O11 PC 353 87.067 102.094 53.744 1.00 0.00 O ATOM 12405 C1 PC 353 87.227 102.543 55.098 1.00 0.00 C ATOM 12406 HR PC 353 88.245 102.407 55.472 1.00 0.00 H ATOM 12407 HS PC 353 86.611 102.022 55.835 1.00 0.00 H ATOM 12408 C2 PC 353 86.907 104.027 55.269 1.00 0.00 C ATOM 12409 HX PC 353 87.620 104.505 55.946 1.00 0.00 H ATOM 12410 C3 PC 353 85.457 104.250 55.587 1.00 0.00 C ATOM 12411 HA PC 353 85.329 103.738 56.544 1.00 0.00 H ATOM 12412 HB PC 353 84.927 103.735 54.782 1.00 0.00 H ATOM 12413 O31 PC 353 85.097 105.587 55.532 1.00 0.00 O ATOM 12414 P31 PC 353 84.188 106.197 56.564 1.00 0.00 P ATOM 12415 O32 PC 353 85.039 106.343 57.868 1.00 0.00 O ATOM 12416 C31 PC 353 84.916 105.324 58.881 1.00 0.00 C ATOM 12417 H1A PC 353 84.597 104.348 58.505 1.00 0.00 H ATOM 12418 H1B PC 353 84.152 105.643 59.595 1.00 0.00 H ATOM 12419 C32 PC 353 86.205 105.109 59.659 1.00 0.00 C ATOM 12420 H2A PC 353 86.865 104.704 58.890 1.00 0.00 H ATOM 12421 H2B PC 353 86.111 104.403 60.486 1.00 0.00 H ATOM 12422 N31 PC 353 86.732 106.359 60.256 1.00 0.00 N ATOM 12423 C33 PC 353 87.663 106.873 59.245 1.00 0.00 C ATOM 12424 H3A PC 353 88.338 106.092 58.892 1.00 0.00 H ATOM 12425 H3B PC 353 88.243 107.715 59.629 1.00 0.00 H ATOM 12426 H3C PC 353 87.014 107.176 58.423 1.00 0.00 H ATOM 12427 C34 PC 353 85.754 107.409 60.584 1.00 0.00 C ATOM 12428 H4A PC 353 85.300 107.836 59.689 1.00 0.00 H ATOM 12429 H4B PC 353 86.251 108.160 61.200 1.00 0.00 H ATOM 12430 H4C PC 353 84.979 106.878 61.138 1.00 0.00 H ATOM 12431 C35 PC 353 87.580 106.112 61.348 1.00 0.00 C ATOM 12432 H5A PC 353 87.839 107.078 61.785 1.00 0.00 H ATOM 12433 H5B PC 353 88.391 105.468 61.006 1.00 0.00 H ATOM 12434 H5C PC 353 87.082 105.483 62.087 1.00 0.00 H ATOM 12435 O33 PC 353 83.845 107.566 56.202 1.00 0.00 O ATOM 12436 O34 PC 353 83.054 105.304 56.819 1.00 0.00 O ATOM 12437 O21 PC 353 87.351 104.756 54.035 1.00 0.00 O ATOM 12438 C21 PC 353 88.701 104.866 53.770 1.00 0.00 C ATOM 12439 O22 PC 353 89.571 104.582 54.574 1.00 0.00 O ATOM 12440 C12 OL 354 88.946 105.434 52.356 1.00 0.00 C ATOM 12441 H2R OL 354 88.006 105.434 51.801 1.00 0.00 H ATOM 12442 H2S OL 354 89.339 106.452 52.311 1.00 0.00 H ATOM 12443 C13 OL 354 89.978 104.566 51.632 1.00 0.00 C ATOM 12444 H3R OL 354 89.534 103.570 51.579 1.00 0.00 H ATOM 12445 H3S OL 354 90.004 105.020 50.639 1.00 0.00 H ATOM 12446 C14 OL 354 91.442 104.448 52.234 1.00 0.00 C ATOM 12447 H4R OL 354 91.699 105.418 52.667 1.00 0.00 H ATOM 12448 H4S OL 354 91.521 103.656 52.981 1.00 0.00 H ATOM 12449 C15 OL 354 92.498 104.116 51.215 1.00 0.00 C ATOM 12450 H5R OL 354 93.450 103.938 51.721 1.00 0.00 H ATOM 12451 H5S OL 354 92.224 103.170 50.742 1.00 0.00 H ATOM 12452 C16 OL 354 92.754 105.229 50.194 1.00 0.00 C ATOM 12453 H6R OL 354 91.851 105.287 49.583 1.00 0.00 H ATOM 12454 H6S OL 354 92.939 106.196 50.665 1.00 0.00 H ATOM 12455 C17 OL 354 93.977 104.907 49.300 1.00 0.00 C ATOM 12456 H7R OL 354 94.933 104.626 49.746 1.00 0.00 H ATOM 12457 H7S OL 354 93.743 103.935 48.861 1.00 0.00 H ATOM 12458 C18 OL 354 94.252 105.968 48.270 1.00 0.00 C ATOM 12459 H8R OL 354 93.323 106.002 47.696 1.00 0.00 H ATOM 12460 H8S OL 354 94.483 106.894 48.799 1.00 0.00 H ATOM 12461 C19 OL 354 95.474 105.649 47.441 1.00 0.00 C ATOM 12462 H9R OL 354 96.399 105.996 47.894 1.00 0.00 H ATOM 12463 C110 OL 354 95.516 105.327 46.116 1.00 0.00 C ATOM 12464 H10R OL 354 96.500 105.102 45.714 1.00 0.00 H ATOM 12465 C111 OL 354 94.388 104.866 45.341 1.00 0.00 C ATOM 12466 H11R OL 354 93.431 105.054 45.831 1.00 0.00 H ATOM 12467 H11S OL 354 94.383 105.393 44.384 1.00 0.00 H ATOM 12468 C112 OL 354 94.462 103.359 45.266 1.00 0.00 C ATOM 12469 H12R OL 354 95.484 103.174 44.929 1.00 0.00 H ATOM 12470 H12S OL 354 94.424 102.992 46.294 1.00 0.00 H ATOM 12471 C113 OL 354 93.508 102.764 44.338 1.00 0.00 C ATOM 12472 H13R OL 354 93.761 103.010 43.305 1.00 0.00 H ATOM 12473 H13S OL 354 93.567 101.680 44.217 1.00 0.00 H ATOM 12474 C114 OL 354 92.084 103.230 44.395 1.00 0.00 C ATOM 12475 H14R OL 354 91.674 102.983 45.377 1.00 0.00 H ATOM 12476 H14S OL 354 91.921 104.303 44.276 1.00 0.00 H ATOM 12477 C115 OL 354 91.157 102.400 43.526 1.00 0.00 C ATOM 12478 H15R OL 354 91.575 102.489 42.521 1.00 0.00 H ATOM 12479 H15S OL 354 91.170 101.350 43.826 1.00 0.00 H ATOM 12480 C116 OL 354 89.598 102.755 43.475 1.00 0.00 C ATOM 12481 H16R OL 354 89.074 102.331 44.333 1.00 0.00 H ATOM 12482 H16S OL 354 89.506 103.840 43.565 1.00 0.00 H ATOM 12483 C117 OL 354 88.930 102.353 42.132 1.00 0.00 C ATOM 12484 H17R OL 354 89.719 102.474 41.388 1.00 0.00 H ATOM 12485 H17S OL 354 88.722 101.283 42.202 1.00 0.00 H ATOM 12486 C118 OL 354 87.746 103.218 41.754 1.00 0.00 C ATOM 12487 H18R OL 354 87.023 102.779 41.063 1.00 0.00 H ATOM 12488 H18S OL 354 88.061 104.215 41.437 1.00 0.00 H ATOM 12489 H18T OL 354 87.131 103.505 42.610 1.00 0.00 H TER 12490 OL 354 ATOM 12490 C116 PA 355 17.234 50.265 50.304 1.00 0.00 C ATOM 12491 H16R PA 355 17.381 50.581 51.339 1.00 0.00 H ATOM 12492 H16S PA 355 18.255 50.291 49.917 1.00 0.00 H ATOM 12493 H16T PA 355 16.790 49.291 50.521 1.00 0.00 H ATOM 12494 C115 PA 355 16.249 51.235 49.680 1.00 0.00 C ATOM 12495 H15R PA 355 16.557 52.253 49.927 1.00 0.00 H ATOM 12496 H15S PA 355 15.259 51.070 50.110 1.00 0.00 H ATOM 12497 C114 PA 355 16.228 51.001 48.160 1.00 0.00 C ATOM 12498 H14R PA 355 17.203 51.188 47.705 1.00 0.00 H ATOM 12499 H14S PA 355 15.623 51.725 47.610 1.00 0.00 H ATOM 12500 C113 PA 355 15.588 49.594 47.875 1.00 0.00 C ATOM 12501 H13R PA 355 14.750 49.276 48.499 1.00 0.00 H ATOM 12502 H13S PA 355 16.214 48.707 47.994 1.00 0.00 H ATOM 12503 C112 PA 355 15.163 49.392 46.415 1.00 0.00 C ATOM 12504 H12R PA 355 14.487 50.225 46.213 1.00 0.00 H ATOM 12505 H12S PA 355 14.664 48.436 46.246 1.00 0.00 H ATOM 12506 C111 PA 355 16.309 49.551 45.394 1.00 0.00 C ATOM 12507 H11R PA 355 16.905 50.409 45.712 1.00 0.00 H ATOM 12508 H11S PA 355 15.932 49.845 44.413 1.00 0.00 H ATOM 12509 C110 PA 355 17.107 48.381 45.379 1.00 0.00 C ATOM 12510 H10R PA 355 16.444 47.514 45.368 1.00 0.00 H ATOM 12511 H10S PA 355 17.652 48.174 46.302 1.00 0.00 H ATOM 12512 C19 PA 355 18.009 48.385 44.185 1.00 0.00 C ATOM 12513 H9R PA 355 18.575 49.315 44.269 1.00 0.00 H ATOM 12514 H9S PA 355 17.496 48.491 43.227 1.00 0.00 H ATOM 12515 C18 PA 355 19.033 47.138 44.199 1.00 0.00 C ATOM 12516 H8R PA 355 19.247 46.732 43.208 1.00 0.00 H ATOM 12517 H8S PA 355 18.518 46.278 44.632 1.00 0.00 H ATOM 12518 C17 PA 355 20.387 47.281 44.903 1.00 0.00 C ATOM 12519 H7R PA 355 21.015 47.804 44.179 1.00 0.00 H ATOM 12520 H7S PA 355 20.743 46.251 44.973 1.00 0.00 H ATOM 12521 C16 PA 355 20.436 48.057 46.241 1.00 0.00 C ATOM 12522 H6R PA 355 19.555 47.941 46.876 1.00 0.00 H ATOM 12523 H6S PA 355 20.574 49.110 45.986 1.00 0.00 H ATOM 12524 C15 PA 355 21.667 47.710 47.070 1.00 0.00 C ATOM 12525 H5R PA 355 22.515 47.795 46.387 1.00 0.00 H ATOM 12526 H5S PA 355 21.559 46.637 47.243 1.00 0.00 H ATOM 12527 C14 PA 355 21.725 48.409 48.380 1.00 0.00 C ATOM 12528 H4R PA 355 20.959 48.037 49.064 1.00 0.00 H ATOM 12529 H4S PA 355 21.662 49.499 48.394 1.00 0.00 H ATOM 12530 C13 PA 355 23.034 48.165 49.095 1.00 0.00 C ATOM 12531 H3R PA 355 23.824 48.771 48.648 1.00 0.00 H ATOM 12532 H3S PA 355 23.385 47.155 48.871 1.00 0.00 H ATOM 12533 C12 PA 355 23.038 48.454 50.622 1.00 0.00 C ATOM 12534 H2R PA 355 22.190 47.874 50.992 1.00 0.00 H ATOM 12535 H2S PA 355 22.934 49.538 50.709 1.00 0.00 H ATOM 12536 C11 PC 356 24.310 48.118 51.279 1.00 0.00 C ATOM 12537 O12 PC 356 25.166 48.942 51.666 1.00 0.00 O ATOM 12538 O11 PC 356 24.497 46.798 51.428 1.00 0.00 O ATOM 12539 C1 PC 356 25.646 46.211 52.116 1.00 0.00 C ATOM 12540 HR PC 356 26.662 46.566 51.921 1.00 0.00 H ATOM 12541 HS PC 356 25.581 45.174 51.779 1.00 0.00 H ATOM 12542 C2 PC 356 25.436 46.123 53.642 1.00 0.00 C ATOM 12543 HX PC 356 25.746 47.128 53.942 1.00 0.00 H ATOM 12544 C3 PC 356 26.362 45.307 54.391 1.00 0.00 C ATOM 12545 HA PC 356 27.328 45.742 54.122 1.00 0.00 H ATOM 12546 HB PC 356 26.302 44.285 54.008 1.00 0.00 H ATOM 12547 O31 PC 356 26.085 45.474 55.834 1.00 0.00 O ATOM 12548 P31 PC 356 27.110 44.840 56.856 1.00 0.00 P ATOM 12549 O32 PC 356 26.826 43.319 56.665 1.00 0.00 O ATOM 12550 C31 PC 356 25.552 42.821 57.055 1.00 0.00 C ATOM 12551 H1A PC 356 24.792 43.141 56.337 1.00 0.00 H ATOM 12552 H1B PC 356 25.312 43.207 58.048 1.00 0.00 H ATOM 12553 C32 PC 356 25.860 41.280 57.066 1.00 0.00 C ATOM 12554 H2A PC 356 26.582 41.154 57.875 1.00 0.00 H ATOM 12555 H2B PC 356 26.370 41.180 56.106 1.00 0.00 H ATOM 12556 N31 PC 356 24.716 40.353 57.291 1.00 0.00 N ATOM 12557 C33 PC 356 23.625 40.613 56.316 1.00 0.00 C ATOM 12558 H3A PC 356 23.993 40.498 55.296 1.00 0.00 H ATOM 12559 H3B PC 356 23.211 41.599 56.533 1.00 0.00 H ATOM 12560 H3C PC 356 22.875 39.862 56.568 1.00 0.00 H ATOM 12561 C34 PC 356 25.161 38.903 57.135 1.00 0.00 C ATOM 12562 H4A PC 356 25.805 38.689 57.989 1.00 0.00 H ATOM 12563 H4B PC 356 25.768 38.822 56.231 1.00 0.00 H ATOM 12564 H4C PC 356 24.301 38.238 57.041 1.00 0.00 H ATOM 12565 C35 PC 356 24.228 40.546 58.621 1.00 0.00 C ATOM 12566 H5A PC 356 23.240 40.086 58.586 1.00 0.00 H ATOM 12567 H5B PC 356 24.137 41.595 58.906 1.00 0.00 H ATOM 12568 H5C PC 356 24.887 40.104 59.371 1.00 0.00 H ATOM 12569 O33 PC 356 28.480 45.105 56.300 1.00 0.00 O ATOM 12570 O34 PC 356 26.778 45.281 58.204 1.00 0.00 O ATOM 12571 O21 PC 356 24.117 45.687 53.973 1.00 0.00 O ATOM 12572 C21 PC 356 23.526 44.471 53.789 1.00 0.00 C ATOM 12573 O22 PC 356 24.061 43.482 53.317 1.00 0.00 O ATOM 12574 C12 OL 357 22.023 44.472 53.987 1.00 0.00 C ATOM 12575 H2R OL 357 21.784 44.912 54.958 1.00 0.00 H ATOM 12576 H2S OL 357 21.600 45.104 53.203 1.00 0.00 H ATOM 12577 C13 OL 357 21.364 43.061 53.997 1.00 0.00 C ATOM 12578 H3R OL 357 21.921 42.358 54.619 1.00 0.00 H ATOM 12579 H3S OL 357 20.409 43.232 54.498 1.00 0.00 H ATOM 12580 C14 OL 357 21.183 42.557 52.521 1.00 0.00 C ATOM 12581 H4R OL 357 20.785 43.381 51.925 1.00 0.00 H ATOM 12582 H4S OL 357 22.187 42.315 52.166 1.00 0.00 H ATOM 12583 C15 OL 357 20.282 41.351 52.159 1.00 0.00 C ATOM 12584 H5R OL 357 20.671 40.787 51.309 1.00 0.00 H ATOM 12585 H5S OL 357 20.452 40.718 53.032 1.00 0.00 H ATOM 12586 C16 OL 357 18.794 41.698 51.955 1.00 0.00 C ATOM 12587 H6R OL 357 18.395 42.205 52.835 1.00 0.00 H ATOM 12588 H6S OL 357 18.611 42.532 51.274 1.00 0.00 H ATOM 12589 C17 OL 357 17.943 40.564 51.443 1.00 0.00 C ATOM 12590 H7R OL 357 18.349 40.305 50.463 1.00 0.00 H ATOM 12591 H7S OL 357 18.097 39.661 52.038 1.00 0.00 H ATOM 12592 C18 OL 357 16.482 40.820 51.073 1.00 0.00 C ATOM 12593 H8R OL 357 15.936 41.177 51.948 1.00 0.00 H ATOM 12594 H8S OL 357 16.636 41.654 50.385 1.00 0.00 H ATOM 12595 C19 OL 357 15.568 39.763 50.531 1.00 0.00 C ATOM 12596 H9R OL 357 15.092 39.236 51.354 1.00 0.00 H ATOM 12597 C110 OL 357 15.419 39.424 49.269 1.00 0.00 C ATOM 12598 H10R OL 357 14.732 38.605 49.071 1.00 0.00 H ATOM 12599 C111 OL 357 16.044 40.058 48.022 1.00 0.00 C ATOM 12600 H11R OL 357 16.629 40.952 48.245 1.00 0.00 H ATOM 12601 H11S OL 357 16.780 39.345 47.643 1.00 0.00 H ATOM 12602 C112 OL 357 15.102 40.433 46.857 1.00 0.00 C ATOM 12603 H12R OL 357 14.536 39.602 46.432 1.00 0.00 H ATOM 12604 H12S OL 357 14.387 41.144 47.277 1.00 0.00 H ATOM 12605 C113 OL 357 15.734 41.230 45.718 1.00 0.00 C ATOM 12606 H13R OL 357 16.126 42.192 46.052 1.00 0.00 H ATOM 12607 H13S OL 357 16.428 40.561 45.204 1.00 0.00 H ATOM 12608 C114 OL 357 14.765 41.469 44.554 1.00 0.00 C ATOM 12609 H14R OL 357 14.194 40.596 44.233 1.00 0.00 H ATOM 12610 H14S OL 357 13.905 42.074 44.849 1.00 0.00 H ATOM 12611 C115 OL 357 15.391 42.153 43.309 1.00 0.00 C ATOM 12612 H15R OL 357 14.561 42.364 42.631 1.00 0.00 H ATOM 12613 H15S OL 357 15.863 43.087 43.623 1.00 0.00 H ATOM 12614 C116 OL 357 16.428 41.370 42.601 1.00 0.00 C ATOM 12615 H16R OL 357 16.728 41.936 41.717 1.00 0.00 H ATOM 12616 H16S OL 357 17.306 41.308 43.246 1.00 0.00 H ATOM 12617 C117 OL 357 16.048 40.003 42.084 1.00 0.00 C ATOM 12618 H17R OL 357 15.923 39.307 42.915 1.00 0.00 H ATOM 12619 H17S OL 357 15.039 40.223 41.728 1.00 0.00 H ATOM 12620 C118 OL 357 16.982 39.552 40.996 1.00 0.00 C ATOM 12621 H18R OL 357 17.838 39.089 41.491 1.00 0.00 H ATOM 12622 H18S OL 357 17.225 40.393 40.342 1.00 0.00 H ATOM 12623 H18T OL 357 16.616 38.724 40.386 1.00 0.00 H TER 12624 OL 357 ATOM 12624 C116 PA 358 115.673 95.990 47.087 1.00 0.00 C ATOM 12625 H16R PA 358 114.732 95.558 46.741 1.00 0.00 H ATOM 12626 H16S PA 358 116.085 95.406 47.913 1.00 0.00 H ATOM 12627 H16T PA 358 116.414 95.844 46.299 1.00 0.00 H ATOM 12628 C115 PA 358 115.394 97.438 47.535 1.00 0.00 C ATOM 12629 H15R PA 358 114.574 97.464 48.255 1.00 0.00 H ATOM 12630 H15S PA 358 115.115 98.046 46.672 1.00 0.00 H ATOM 12631 C114 PA 358 116.646 98.124 48.120 1.00 0.00 C ATOM 12632 H14R PA 358 117.075 97.494 48.902 1.00 0.00 H ATOM 12633 H14S PA 358 116.380 99.113 48.497 1.00 0.00 H ATOM 12634 C113 PA 358 117.784 98.412 47.100 1.00 0.00 C ATOM 12635 H13R PA 358 117.384 99.238 46.508 1.00 0.00 H ATOM 12636 H13S PA 358 117.832 97.446 46.592 1.00 0.00 H ATOM 12637 C112 PA 358 119.013 98.829 47.730 1.00 0.00 C ATOM 12638 H12R PA 358 119.772 98.732 46.951 1.00 0.00 H ATOM 12639 H12S PA 358 119.274 98.249 48.618 1.00 0.00 H ATOM 12640 C111 PA 358 119.100 100.294 48.246 1.00 0.00 C ATOM 12641 H11R PA 358 118.514 100.466 49.151 1.00 0.00 H ATOM 12642 H11S PA 358 118.742 100.992 47.486 1.00 0.00 H ATOM 12643 C110 PA 358 120.520 100.643 48.729 1.00 0.00 C ATOM 12644 H10R PA 358 121.287 100.257 48.054 1.00 0.00 H ATOM 12645 H10S PA 358 120.466 100.131 49.692 1.00 0.00 H ATOM 12646 C19 PA 358 120.888 102.072 48.976 1.00 0.00 C ATOM 12647 H9R PA 358 120.202 102.387 49.765 1.00 0.00 H ATOM 12648 H9S PA 358 120.809 102.629 48.040 1.00 0.00 H ATOM 12649 C18 PA 358 122.362 102.076 49.420 1.00 0.00 C ATOM 12650 H8R PA 358 122.905 101.850 48.500 1.00 0.00 H ATOM 12651 H8S PA 358 122.595 101.234 50.075 1.00 0.00 H ATOM 12652 C17 PA 358 123.012 103.317 49.948 1.00 0.00 C ATOM 12653 H7R PA 358 122.774 104.143 49.274 1.00 0.00 H ATOM 12654 H7S PA 358 124.082 103.112 49.887 1.00 0.00 H ATOM 12655 C16 PA 358 122.500 103.771 51.391 1.00 0.00 C ATOM 12656 H6R PA 358 121.415 103.893 51.400 1.00 0.00 H ATOM 12657 H6S PA 358 122.991 104.740 51.506 1.00 0.00 H ATOM 12658 C15 PA 358 122.886 102.766 52.469 1.00 0.00 C ATOM 12659 H5R PA 358 122.409 101.790 52.358 1.00 0.00 H ATOM 12660 H5S PA 358 122.395 103.142 53.369 1.00 0.00 H ATOM 12661 C14 PA 358 124.373 102.643 52.692 1.00 0.00 C ATOM 12662 H4R PA 358 124.788 103.653 52.735 1.00 0.00 H ATOM 12663 H4S PA 358 124.928 102.063 51.952 1.00 0.00 H ATOM 12664 C13 PA 358 124.829 102.140 54.117 1.00 0.00 C ATOM 12665 H3R PA 358 124.491 101.107 54.225 1.00 0.00 H ATOM 12666 H3S PA 358 124.311 102.722 54.881 1.00 0.00 H ATOM 12667 C12 PA 358 126.345 102.178 54.370 1.00 0.00 C ATOM 12668 H2R PA 358 126.664 103.168 54.036 1.00 0.00 H ATOM 12669 H2S PA 358 126.841 101.446 53.729 1.00 0.00 H ATOM 12670 C11 PC 359 126.826 101.943 55.786 1.00 0.00 C ATOM 12671 O12 PC 359 128.052 101.648 55.994 1.00 0.00 O ATOM 12672 O11 PC 359 125.900 102.128 56.755 1.00 0.00 O ATOM 12673 C1 PC 359 126.101 101.548 58.144 1.00 0.00 C ATOM 12674 HR PC 359 125.396 102.027 58.829 1.00 0.00 H ATOM 12675 HS PC 359 127.149 101.618 58.446 1.00 0.00 H ATOM 12676 C2 PC 359 125.763 100.040 58.062 1.00 0.00 C ATOM 12677 HX PC 359 124.696 100.109 57.835 1.00 0.00 H ATOM 12678 C3 PC 359 125.798 99.228 59.362 1.00 0.00 C ATOM 12679 HA PC 359 125.386 98.231 59.186 1.00 0.00 H ATOM 12680 HB PC 359 125.078 99.700 60.036 1.00 0.00 H ATOM 12681 O31 PC 359 127.155 99.179 59.936 1.00 0.00 O ATOM 12682 P31 PC 359 127.464 98.399 61.252 1.00 0.00 P ATOM 12683 O32 PC 359 126.917 99.284 62.343 1.00 0.00 O ATOM 12684 C31 PC 359 127.714 100.347 62.796 1.00 0.00 C ATOM 12685 H1A PC 359 127.705 101.062 61.969 1.00 0.00 H ATOM 12686 H1B PC 359 128.728 100.026 63.047 1.00 0.00 H ATOM 12687 C32 PC 359 127.026 100.946 63.988 1.00 0.00 C ATOM 12688 H2A PC 359 125.959 100.757 63.863 1.00 0.00 H ATOM 12689 H2B PC 359 127.192 102.020 63.898 1.00 0.00 H ATOM 12690 N31 PC 359 127.463 100.478 65.409 1.00 0.00 N ATOM 12691 C33 PC 359 127.153 98.999 65.529 1.00 0.00 C ATOM 12692 H3A PC 359 127.725 98.529 64.727 1.00 0.00 H ATOM 12693 H3B PC 359 126.083 98.826 65.412 1.00 0.00 H ATOM 12694 H3C PC 359 127.493 98.647 66.504 1.00 0.00 H ATOM 12695 C34 PC 359 128.960 100.650 65.619 1.00 0.00 C ATOM 12696 H4A PC 359 129.194 101.643 65.234 1.00 0.00 H ATOM 12697 H4B PC 359 129.525 99.870 65.106 1.00 0.00 H ATOM 12698 H4C PC 359 129.170 100.648 66.690 1.00 0.00 H ATOM 12699 C35 PC 359 126.711 101.219 66.472 1.00 0.00 C ATOM 12700 H5A PC 359 125.638 101.022 66.465 1.00 0.00 H ATOM 12701 H5B PC 359 126.855 102.264 66.193 1.00 0.00 H ATOM 12702 H5C PC 359 127.033 100.959 67.481 1.00 0.00 H ATOM 12703 O33 PC 359 126.573 97.276 61.252 1.00 0.00 O ATOM 12704 O34 PC 359 128.909 98.210 61.423 1.00 0.00 O ATOM 12705 O21 PC 359 126.456 99.320 56.983 1.00 0.00 O ATOM 12706 C21 PC 359 125.835 98.320 56.339 1.00 0.00 C ATOM 12707 O22 PC 359 124.663 97.984 56.556 1.00 0.00 O ATOM 12708 C12 OL 360 126.614 97.676 55.174 1.00 0.00 C ATOM 12709 H2R OL 360 127.663 97.839 55.428 1.00 0.00 H ATOM 12710 H2S OL 360 126.381 96.613 55.265 1.00 0.00 H ATOM 12711 C13 OL 360 126.160 98.272 53.799 1.00 0.00 C ATOM 12712 H3R OL 360 126.305 99.354 53.836 1.00 0.00 H ATOM 12713 H3S OL 360 126.932 97.983 53.083 1.00 0.00 H ATOM 12714 C14 OL 360 124.813 97.787 53.218 1.00 0.00 C ATOM 12715 H4R OL 360 124.825 96.705 53.066 1.00 0.00 H ATOM 12716 H4S OL 360 124.096 98.083 53.986 1.00 0.00 H ATOM 12717 C15 OL 360 124.448 98.518 51.941 1.00 0.00 C ATOM 12718 H5R OL 360 123.414 98.365 51.625 1.00 0.00 H ATOM 12719 H5S OL 360 124.536 99.580 52.179 1.00 0.00 H ATOM 12720 C16 OL 360 125.259 98.111 50.783 1.00 0.00 C ATOM 12721 H6R OL 360 126.309 98.242 51.051 1.00 0.00 H ATOM 12722 H6S OL 360 125.366 97.072 50.464 1.00 0.00 H ATOM 12723 C17 OL 360 124.852 99.012 49.546 1.00 0.00 C ATOM 12724 H7R OL 360 123.767 98.885 49.561 1.00 0.00 H ATOM 12725 H7S OL 360 124.853 100.037 49.923 1.00 0.00 H ATOM 12726 C18 OL 360 125.606 98.624 48.218 1.00 0.00 C ATOM 12727 H8R OL 360 125.547 99.356 47.410 1.00 0.00 H ATOM 12728 H8S OL 360 126.695 98.643 48.299 1.00 0.00 H ATOM 12729 C19 OL 360 125.147 97.324 47.673 1.00 0.00 C ATOM 12730 H9R OL 360 125.902 96.546 47.752 1.00 0.00 H ATOM 12731 C110 OL 360 124.009 96.970 47.071 1.00 0.00 C ATOM 12732 H10R OL 360 123.865 95.913 46.862 1.00 0.00 H ATOM 12733 C111 OL 360 122.816 97.884 46.903 1.00 0.00 C ATOM 12734 H11R OL 360 121.947 97.367 47.314 1.00 0.00 H ATOM 12735 H11S OL 360 122.916 98.795 47.497 1.00 0.00 H ATOM 12736 C112 OL 360 122.491 98.224 45.467 1.00 0.00 C ATOM 12737 H12R OL 360 121.685 98.960 45.420 1.00 0.00 H ATOM 12738 H12S OL 360 123.333 98.750 45.014 1.00 0.00 H ATOM 12739 C113 OL 360 122.015 97.165 44.619 1.00 0.00 C ATOM 12740 H13R OL 360 122.833 96.469 44.421 1.00 0.00 H ATOM 12741 H13S OL 360 121.278 96.626 45.218 1.00 0.00 H ATOM 12742 C114 OL 360 121.221 97.521 43.281 1.00 0.00 C ATOM 12743 H14R OL 360 120.519 98.331 43.491 1.00 0.00 H ATOM 12744 H14S OL 360 121.880 98.048 42.588 1.00 0.00 H ATOM 12745 C115 OL 360 120.579 96.340 42.615 1.00 0.00 C ATOM 12746 H15R OL 360 120.063 96.841 41.794 1.00 0.00 H ATOM 12747 H15S OL 360 121.370 95.692 42.232 1.00 0.00 H ATOM 12748 C116 OL 360 119.522 95.667 43.381 1.00 0.00 C ATOM 12749 H16R OL 360 119.945 95.015 44.148 1.00 0.00 H ATOM 12750 H16S OL 360 118.909 96.338 43.986 1.00 0.00 H ATOM 12751 C117 OL 360 118.659 94.767 42.475 1.00 0.00 C ATOM 12752 H17R OL 360 118.026 95.425 41.876 1.00 0.00 H ATOM 12753 H17S OL 360 119.249 94.374 41.644 1.00 0.00 H ATOM 12754 C118 OL 360 118.005 93.557 43.125 1.00 0.00 C ATOM 12755 H18R OL 360 117.201 94.047 43.679 1.00 0.00 H ATOM 12756 H18S OL 360 118.615 92.936 43.785 1.00 0.00 H ATOM 12757 H18T OL 360 117.420 93.027 42.371 1.00 0.00 H TER 12758 OL 360 ATOM 12758 C116 PA 361 118.432 43.764 39.601 1.00 0.00 C ATOM 12759 H16R PA 361 118.608 43.426 38.577 1.00 0.00 H ATOM 12760 H16S PA 361 117.754 44.613 39.493 1.00 0.00 H ATOM 12761 H16T PA 361 117.884 42.982 40.129 1.00 0.00 H ATOM 12762 C115 PA 361 119.566 44.378 40.383 1.00 0.00 C ATOM 12763 H15R PA 361 120.076 45.104 39.746 1.00 0.00 H ATOM 12764 H15S PA 361 120.310 43.601 40.567 1.00 0.00 H ATOM 12765 C114 PA 361 119.030 45.088 41.625 1.00 0.00 C ATOM 12766 H14R PA 361 118.070 44.600 41.806 1.00 0.00 H ATOM 12767 H14S PA 361 118.894 46.163 41.487 1.00 0.00 H ATOM 12768 C113 PA 361 119.935 45.131 42.781 1.00 0.00 C ATOM 12769 H13R PA 361 120.859 45.700 42.663 1.00 0.00 H ATOM 12770 H13S PA 361 120.282 44.105 42.920 1.00 0.00 H ATOM 12771 C112 PA 361 119.212 45.605 44.059 1.00 0.00 C ATOM 12772 H12R PA 361 118.987 46.651 43.840 1.00 0.00 H ATOM 12773 H12S PA 361 119.865 45.578 44.934 1.00 0.00 H ATOM 12774 C111 PA 361 117.963 44.807 44.559 1.00 0.00 C ATOM 12775 H11R PA 361 118.468 43.985 45.070 1.00 0.00 H ATOM 12776 H11S PA 361 117.340 44.539 43.704 1.00 0.00 H ATOM 12777 C110 PA 361 117.045 45.473 45.515 1.00 0.00 C ATOM 12778 H10R PA 361 116.173 44.861 45.753 1.00 0.00 H ATOM 12779 H10S PA 361 116.508 46.268 44.993 1.00 0.00 H ATOM 12780 C19 PA 361 117.769 46.185 46.707 1.00 0.00 C ATOM 12781 H9R PA 361 118.627 46.793 46.414 1.00 0.00 H ATOM 12782 H9S PA 361 118.213 45.400 47.323 1.00 0.00 H ATOM 12783 C18 PA 361 116.824 47.091 47.547 1.00 0.00 C ATOM 12784 H8R PA 361 115.986 46.457 47.844 1.00 0.00 H ATOM 12785 H8S PA 361 116.427 47.835 46.853 1.00 0.00 H ATOM 12786 C17 PA 361 117.607 47.815 48.646 1.00 0.00 C ATOM 12787 H7R PA 361 118.465 48.341 48.221 1.00 0.00 H ATOM 12788 H7S PA 361 118.011 47.147 49.409 1.00 0.00 H ATOM 12789 C16 PA 361 117.048 48.778 49.575 1.00 0.00 C ATOM 12790 H6R PA 361 116.636 49.650 49.062 1.00 0.00 H ATOM 12791 H6S PA 361 117.903 49.200 50.106 1.00 0.00 H ATOM 12792 C15 PA 361 115.899 48.245 50.406 1.00 0.00 C ATOM 12793 H5R PA 361 116.294 47.474 51.071 1.00 0.00 H ATOM 12794 H5S PA 361 115.132 47.751 49.806 1.00 0.00 H ATOM 12795 C14 PA 361 115.190 49.341 51.187 1.00 0.00 C ATOM 12796 H4R PA 361 114.527 49.998 50.621 1.00 0.00 H ATOM 12797 H4S PA 361 116.038 49.931 51.540 1.00 0.00 H ATOM 12798 C13 PA 361 114.442 48.854 52.394 1.00 0.00 C ATOM 12799 H3R PA 361 113.889 49.734 52.729 1.00 0.00 H ATOM 12800 H3S PA 361 114.982 48.613 53.312 1.00 0.00 H ATOM 12801 C12 PA 361 113.496 47.664 52.130 1.00 0.00 C ATOM 12802 H2R PA 361 113.941 46.849 51.555 1.00 0.00 H ATOM 12803 H2S PA 361 112.709 48.121 51.528 1.00 0.00 H ATOM 12804 C11 PGR 362 112.819 47.142 53.424 1.00 0.00 C ATOM 12805 O12 PGR 362 112.786 45.992 53.761 1.00 0.00 O ATOM 12806 O11 PGR 362 112.406 48.147 54.257 1.00 0.00 O ATOM 12807 C1 PGR 362 112.022 47.796 55.605 1.00 0.00 C ATOM 12808 HR PGR 362 112.886 47.249 55.990 1.00 0.00 H ATOM 12809 HS PGR 362 111.129 47.170 55.526 1.00 0.00 H ATOM 12810 C2 PGR 362 111.869 49.010 56.425 1.00 0.00 C ATOM 12811 HX PGR 362 112.785 49.590 56.290 1.00 0.00 H ATOM 12812 C3 PGR 362 111.813 48.697 57.966 1.00 0.00 C ATOM 12813 HA PGR 362 110.962 48.044 58.174 1.00 0.00 H ATOM 12814 HB PGR 362 111.561 49.572 58.572 1.00 0.00 H ATOM 12815 O31 PGR 362 113.056 48.181 58.361 1.00 0.00 O ATOM 12816 P31 PGR 362 113.292 47.724 59.886 1.00 0.00 P ATOM 12817 O32 PGR 362 112.810 48.992 60.754 1.00 0.00 O ATOM 12818 C31 PGR 362 113.597 50.158 60.839 1.00 0.00 C ATOM 12819 H1A PGR 362 113.482 50.527 59.816 1.00 0.00 H ATOM 12820 H1B PGR 362 114.645 49.864 60.946 1.00 0.00 H ATOM 12821 C32 PGR 362 113.290 51.224 61.897 1.00 0.00 C ATOM 12822 H2A PGR 362 113.715 52.159 61.521 1.00 0.00 H ATOM 12823 O35 PGR 362 114.003 50.965 63.142 1.00 0.00 O ATOM 12824 HO5A PGR 362 113.799 50.049 63.402 1.00 0.00 H ATOM 12825 C33 PGR 362 111.806 51.386 62.139 1.00 0.00 C ATOM 12826 H3A PGR 362 111.666 52.308 62.710 1.00 0.00 H ATOM 12827 H3B PGR 362 111.216 51.510 61.228 1.00 0.00 H ATOM 12828 O33 PGR 362 112.265 46.727 60.283 1.00 0.00 O ATOM 12829 O34 PGR 362 114.727 47.480 60.102 1.00 0.00 O ATOM 12830 O21 PGR 362 110.753 49.874 56.050 1.00 0.00 O ATOM 12831 C21 PGR 362 109.475 49.420 56.112 1.00 0.00 C ATOM 12832 O22 PGR 362 109.154 48.337 56.484 1.00 0.00 O ATOM 12833 O36 PGR 362 111.188 50.290 62.799 1.00 0.00 O ATOM 12834 HO6A PGR 362 110.986 49.530 62.224 1.00 0.00 H ATOM 12835 C12 OL 363 108.502 50.497 55.637 1.00 0.00 C ATOM 12836 H2R OL 363 107.481 50.112 55.661 1.00 0.00 H ATOM 12837 H2S OL 363 108.598 51.297 56.374 1.00 0.00 H ATOM 12838 C13 OL 363 109.042 51.077 54.275 1.00 0.00 C ATOM 12839 H3R OL 363 110.055 51.428 54.479 1.00 0.00 H ATOM 12840 H3S OL 363 109.038 50.420 53.403 1.00 0.00 H ATOM 12841 C14 OL 363 108.293 52.352 53.988 1.00 0.00 C ATOM 12842 H4R OL 363 107.281 51.942 54.012 1.00 0.00 H ATOM 12843 H4S OL 363 108.499 53.123 54.732 1.00 0.00 H ATOM 12844 C15 OL 363 108.346 52.859 52.593 1.00 0.00 C ATOM 12845 H5R OL 363 108.133 52.188 51.758 1.00 0.00 H ATOM 12846 H5S OL 363 107.608 53.660 52.663 1.00 0.00 H ATOM 12847 C16 OL 363 109.637 53.452 52.261 1.00 0.00 C ATOM 12848 H6R OL 363 110.017 54.118 53.038 1.00 0.00 H ATOM 12849 H6S OL 363 110.322 52.606 52.349 1.00 0.00 H ATOM 12850 C17 OL 363 109.627 54.157 50.978 1.00 0.00 C ATOM 12851 H7R OL 363 108.885 54.957 51.027 1.00 0.00 H ATOM 12852 H7S OL 363 110.598 54.656 51.007 1.00 0.00 H ATOM 12853 C18 OL 363 109.627 53.308 49.739 1.00 0.00 C ATOM 12854 H8R OL 363 110.581 52.792 49.870 1.00 0.00 H ATOM 12855 H8S OL 363 108.775 52.625 49.734 1.00 0.00 H ATOM 12856 C19 OL 363 109.646 54.266 48.531 1.00 0.00 C ATOM 12857 H9R OL 363 110.311 55.102 48.732 1.00 0.00 H ATOM 12858 C110 OL 363 108.983 54.244 47.372 1.00 0.00 C ATOM 12859 H10R OL 363 109.119 54.982 46.585 1.00 0.00 H ATOM 12860 C111 OL 363 108.045 53.206 46.897 1.00 0.00 C ATOM 12861 H11R OL 363 108.359 52.873 45.906 1.00 0.00 H ATOM 12862 H11S OL 363 108.079 52.385 47.616 1.00 0.00 H ATOM 12863 C112 OL 363 106.657 53.618 46.854 1.00 0.00 C ATOM 12864 H12R OL 363 105.935 52.863 47.171 1.00 0.00 H ATOM 12865 H12S OL 363 106.653 54.398 47.618 1.00 0.00 H ATOM 12866 C113 OL 363 106.324 54.292 45.526 1.00 0.00 C ATOM 12867 H13R OL 363 105.600 55.105 45.614 1.00 0.00 H ATOM 12868 H13S OL 363 107.200 54.886 45.256 1.00 0.00 H ATOM 12869 C114 OL 363 106.129 53.399 44.246 1.00 0.00 C ATOM 12870 H14R OL 363 106.527 52.441 44.584 1.00 0.00 H ATOM 12871 H14S OL 363 105.067 53.235 44.050 1.00 0.00 H ATOM 12872 C115 OL 363 106.874 53.752 42.927 1.00 0.00 C ATOM 12873 H15R OL 363 107.931 53.714 43.197 1.00 0.00 H ATOM 12874 H15S OL 363 106.739 53.046 42.105 1.00 0.00 H ATOM 12875 C116 OL 363 106.666 55.113 42.341 1.00 0.00 C ATOM 12876 H16R OL 363 105.620 55.246 42.059 1.00 0.00 H ATOM 12877 H16S OL 363 106.928 55.817 43.134 1.00 0.00 H ATOM 12878 C117 OL 363 107.499 55.382 41.108 1.00 0.00 C ATOM 12879 H17R OL 363 108.553 55.248 41.361 1.00 0.00 H ATOM 12880 H17S OL 363 107.189 54.586 40.428 1.00 0.00 H ATOM 12881 C118 OL 363 107.215 56.696 40.383 1.00 0.00 C ATOM 12882 H18R OL 363 107.527 57.570 40.958 1.00 0.00 H ATOM 12883 H18S OL 363 106.150 56.714 40.140 1.00 0.00 H ATOM 12884 H18T OL 363 107.799 56.758 39.462 1.00 0.00 H TER 12885 OL 363 ATOM 12885 C116 PA 364 83.375 7.934 38.065 1.00 0.00 C ATOM 12886 H16R PA 364 84.448 7.750 37.979 1.00 0.00 H ATOM 12887 H16S PA 364 82.760 7.111 37.697 1.00 0.00 H ATOM 12888 H16T PA 364 83.160 8.277 39.080 1.00 0.00 H ATOM 12889 C115 PA 364 82.857 9.130 37.176 1.00 0.00 C ATOM 12890 H15R PA 364 83.158 9.081 36.127 1.00 0.00 H ATOM 12891 H15S PA 364 83.262 10.066 37.564 1.00 0.00 H ATOM 12892 C114 PA 364 81.203 9.200 37.289 1.00 0.00 C ATOM 12893 H14R PA 364 80.856 8.177 37.128 1.00 0.00 H ATOM 12894 H14S PA 364 80.801 9.838 36.499 1.00 0.00 H ATOM 12895 C113 PA 364 80.530 9.479 38.658 1.00 0.00 C ATOM 12896 H13R PA 364 81.104 8.965 39.431 1.00 0.00 H ATOM 12897 H13S PA 364 79.488 9.168 38.558 1.00 0.00 H ATOM 12898 C112 PA 364 80.636 10.999 38.953 1.00 0.00 C ATOM 12899 H12R PA 364 80.043 11.481 38.173 1.00 0.00 H ATOM 12900 H12S PA 364 81.639 11.410 38.819 1.00 0.00 H ATOM 12901 C111 PA 364 80.161 11.535 40.365 1.00 0.00 C ATOM 12902 H11R PA 364 80.737 11.163 41.215 1.00 0.00 H ATOM 12903 H11S PA 364 79.216 11.012 40.531 1.00 0.00 H ATOM 12904 C110 PA 364 80.027 13.051 40.376 1.00 0.00 C ATOM 12905 H10R PA 364 79.260 13.366 39.665 1.00 0.00 H ATOM 12906 H10S PA 364 80.786 13.678 39.903 1.00 0.00 H ATOM 12907 C19 PA 364 79.714 13.578 41.790 1.00 0.00 C ATOM 12908 H9R PA 364 78.992 12.954 42.321 1.00 0.00 H ATOM 12909 H9S PA 364 79.234 14.558 41.834 1.00 0.00 H ATOM 12910 C18 PA 364 80.962 13.622 42.705 1.00 0.00 C ATOM 12911 H8R PA 364 81.796 14.045 42.142 1.00 0.00 H ATOM 12912 H8S PA 364 81.288 12.613 42.968 1.00 0.00 H ATOM 12913 C17 PA 364 80.669 14.367 44.055 1.00 0.00 C ATOM 12914 H7R PA 364 79.960 13.705 44.557 1.00 0.00 H ATOM 12915 H7S PA 364 80.172 15.304 43.797 1.00 0.00 H ATOM 12916 C16 PA 364 81.933 14.484 44.898 1.00 0.00 C ATOM 12917 H6R PA 364 82.723 14.827 44.227 1.00 0.00 H ATOM 12918 H6S PA 364 82.319 13.579 45.371 1.00 0.00 H ATOM 12919 C15 PA 364 81.818 15.545 45.837 1.00 0.00 C ATOM 12920 H5R PA 364 81.410 16.372 45.252 1.00 0.00 H ATOM 12921 H5S PA 364 82.835 15.832 46.113 1.00 0.00 H ATOM 12922 C14 PA 364 81.016 15.213 47.174 1.00 0.00 C ATOM 12923 H4R PA 364 80.891 14.154 47.407 1.00 0.00 H ATOM 12924 H4S PA 364 80.069 15.753 47.103 1.00 0.00 H ATOM 12925 C13 PA 364 81.660 15.647 48.478 1.00 0.00 C ATOM 12926 H3R PA 364 82.289 16.538 48.417 1.00 0.00 H ATOM 12927 H3S PA 364 82.316 14.853 48.840 1.00 0.00 H ATOM 12928 C12 PA 364 80.697 15.867 49.674 1.00 0.00 C ATOM 12929 H2R PA 364 79.895 16.516 49.317 1.00 0.00 H ATOM 12930 H2S PA 364 80.303 14.878 49.914 1.00 0.00 H ATOM 12931 C11 PGR 365 81.392 16.383 50.865 1.00 0.00 C ATOM 12932 O12 PGR 365 81.769 17.546 50.989 1.00 0.00 O ATOM 12933 O11 PGR 365 81.505 15.471 51.845 1.00 0.00 O ATOM 12934 C1 PGR 365 82.287 15.771 52.986 1.00 0.00 C ATOM 12935 HR PGR 365 82.084 16.796 53.307 1.00 0.00 H ATOM 12936 HS PGR 365 83.311 15.774 52.604 1.00 0.00 H ATOM 12937 C2 PGR 365 82.081 14.783 54.168 1.00 0.00 C ATOM 12938 HX PGR 365 81.029 14.550 54.352 1.00 0.00 H ATOM 12939 C3 PGR 365 82.509 15.290 55.560 1.00 0.00 C ATOM 12940 HA PGR 365 82.442 14.482 56.293 1.00 0.00 H ATOM 12941 HB PGR 365 81.844 16.052 55.976 1.00 0.00 H ATOM 12942 O31 PGR 365 83.930 15.650 55.543 1.00 0.00 O ATOM 12943 P31 PGR 365 84.763 15.813 56.913 1.00 0.00 P ATOM 12944 O32 PGR 365 85.110 14.280 57.479 1.00 0.00 O ATOM 12945 C31 PGR 365 84.212 13.628 58.401 1.00 0.00 C ATOM 12946 H1A PGR 365 83.327 13.315 57.841 1.00 0.00 H ATOM 12947 H1B PGR 365 83.861 14.318 59.173 1.00 0.00 H ATOM 12948 C32 PGR 365 84.566 12.290 59.091 1.00 0.00 C ATOM 12949 H2A PGR 365 83.670 11.713 59.334 1.00 0.00 H ATOM 12950 O35 PGR 365 84.960 12.565 60.387 1.00 0.00 O ATOM 12951 HO5A PGR 365 85.483 13.383 60.307 1.00 0.00 H ATOM 12952 C33 PGR 365 85.603 11.417 58.287 1.00 0.00 C ATOM 12953 H3A PGR 365 85.744 10.521 58.897 1.00 0.00 H ATOM 12954 H3B PGR 365 85.288 11.245 57.255 1.00 0.00 H ATOM 12955 O33 PGR 365 86.071 16.257 56.487 1.00 0.00 O ATOM 12956 O34 PGR 365 83.980 16.612 57.856 1.00 0.00 O ATOM 12957 O21 PGR 365 82.834 13.597 53.806 1.00 0.00 O ATOM 12958 C21 PGR 365 82.695 12.398 54.432 1.00 0.00 C ATOM 12959 O22 PGR 365 82.058 12.243 55.432 1.00 0.00 O ATOM 12960 O36 PGR 365 86.859 12.078 58.166 1.00 0.00 O ATOM 12961 HO6A PGR 365 86.810 12.979 57.799 1.00 0.00 H ATOM 12962 C12 OL 366 83.698 11.362 54.004 1.00 0.00 C ATOM 12963 H2R OL 366 84.577 11.446 54.647 1.00 0.00 H ATOM 12964 H2S OL 366 83.338 10.344 54.167 1.00 0.00 H ATOM 12965 C13 OL 366 84.067 11.458 52.432 1.00 0.00 C ATOM 12966 H3R OL 366 84.490 12.459 52.324 1.00 0.00 H ATOM 12967 H3S OL 366 84.794 10.712 52.105 1.00 0.00 H ATOM 12968 C14 OL 366 82.799 11.394 51.628 1.00 0.00 C ATOM 12969 H4R OL 366 82.392 10.386 51.729 1.00 0.00 H ATOM 12970 H4S OL 366 82.022 11.981 52.124 1.00 0.00 H ATOM 12971 C15 OL 366 82.959 11.728 50.204 1.00 0.00 C ATOM 12972 H5R OL 366 83.288 12.733 49.930 1.00 0.00 H ATOM 12973 H5S OL 366 83.730 11.065 49.806 1.00 0.00 H ATOM 12974 C16 OL 366 81.796 11.498 49.369 1.00 0.00 C ATOM 12975 H6R OL 366 81.306 10.529 49.484 1.00 0.00 H ATOM 12976 H6S OL 366 80.972 12.191 49.552 1.00 0.00 H ATOM 12977 C17 OL 366 82.128 11.576 47.885 1.00 0.00 C ATOM 12978 H7R OL 366 81.163 11.829 47.442 1.00 0.00 H ATOM 12979 H7S OL 366 82.781 12.426 47.678 1.00 0.00 H ATOM 12980 C18 OL 366 82.571 10.200 47.222 1.00 0.00 C ATOM 12981 H8R OL 366 83.247 9.602 47.837 1.00 0.00 H ATOM 12982 H8S OL 366 81.674 9.580 47.158 1.00 0.00 H ATOM 12983 C19 OL 366 83.225 10.378 45.847 1.00 0.00 C ATOM 12984 H9R OL 366 84.293 10.554 45.747 1.00 0.00 H ATOM 12985 C110 OL 366 82.630 10.335 44.651 1.00 0.00 C ATOM 12986 H10R OL 366 83.192 10.458 43.729 1.00 0.00 H ATOM 12987 C111 OL 366 81.222 10.076 44.323 1.00 0.00 C ATOM 12988 H11R OL 366 80.556 10.693 44.929 1.00 0.00 H ATOM 12989 H11S OL 366 81.002 10.378 43.297 1.00 0.00 H ATOM 12990 C112 OL 366 80.769 8.630 44.557 1.00 0.00 C ATOM 12991 H12R OL 366 80.988 8.358 45.592 1.00 0.00 H ATOM 12992 H12S OL 366 79.693 8.473 44.458 1.00 0.00 H ATOM 12993 C113 OL 366 81.642 7.706 43.746 1.00 0.00 C ATOM 12994 H13R OL 366 81.239 7.861 42.743 1.00 0.00 H ATOM 12995 H13S OL 366 82.722 7.822 43.860 1.00 0.00 H ATOM 12996 C114 OL 366 81.516 6.211 44.095 1.00 0.00 C ATOM 12997 H14R OL 366 81.954 5.680 43.247 1.00 0.00 H ATOM 12998 H14S OL 366 82.009 5.948 45.033 1.00 0.00 H ATOM 12999 C115 OL 366 80.106 5.692 44.075 1.00 0.00 C ATOM 13000 H15R OL 366 79.561 5.980 44.976 1.00 0.00 H ATOM 13001 H15S OL 366 79.514 5.978 43.203 1.00 0.00 H ATOM 13002 C116 OL 366 80.011 4.091 44.161 1.00 0.00 C ATOM 13003 H16R OL 366 78.972 3.755 44.187 1.00 0.00 H ATOM 13004 H16S OL 366 80.440 3.683 43.243 1.00 0.00 H ATOM 13005 C117 OL 366 80.719 3.482 45.464 1.00 0.00 C ATOM 13006 H17R OL 366 81.808 3.422 45.416 1.00 0.00 H ATOM 13007 H17S OL 366 80.529 4.118 46.331 1.00 0.00 H ATOM 13008 C118 OL 366 80.293 1.989 45.747 1.00 0.00 C ATOM 13009 H18R OL 366 81.008 1.623 46.487 1.00 0.00 H ATOM 13010 H18S OL 366 80.173 1.480 44.788 1.00 0.00 H ATOM 13011 H18T OL 366 79.338 1.910 46.270 1.00 0.00 H TER 13012 OL 366 ATOM 13012 C116 PA 367 140.982 67.718 37.511 1.00 0.00 C ATOM 13013 H16R PA 367 140.917 66.635 37.392 1.00 0.00 H ATOM 13014 H16S PA 367 140.364 68.190 36.744 1.00 0.00 H ATOM 13015 H16T PA 367 140.565 68.102 38.445 1.00 0.00 H ATOM 13016 C115 PA 367 142.460 68.201 37.416 1.00 0.00 C ATOM 13017 H15R PA 367 142.488 69.269 37.643 1.00 0.00 H ATOM 13018 H15S PA 367 142.936 68.010 36.452 1.00 0.00 H ATOM 13019 C114 PA 367 143.444 67.608 38.466 1.00 0.00 C ATOM 13020 H14R PA 367 144.431 68.031 38.266 1.00 0.00 H ATOM 13021 H14S PA 367 143.566 66.534 38.312 1.00 0.00 H ATOM 13022 C113 PA 367 143.055 67.953 39.883 1.00 0.00 C ATOM 13023 H13R PA 367 142.346 67.170 40.160 1.00 0.00 H ATOM 13024 H13S PA 367 142.603 68.946 39.929 1.00 0.00 H ATOM 13025 C112 PA 367 144.130 67.918 41.018 1.00 0.00 C ATOM 13026 H12R PA 367 144.927 68.478 40.525 1.00 0.00 H ATOM 13027 H12S PA 367 144.466 66.895 41.197 1.00 0.00 H ATOM 13028 C111 PA 367 143.672 68.440 42.366 1.00 0.00 C ATOM 13029 H11R PA 367 142.696 68.073 42.692 1.00 0.00 H ATOM 13030 H11S PA 367 143.255 69.449 42.390 1.00 0.00 H ATOM 13031 C110 PA 367 144.689 68.392 43.482 1.00 0.00 C ATOM 13032 H10R PA 367 145.615 68.965 43.395 1.00 0.00 H ATOM 13033 H10S PA 367 145.080 67.372 43.459 1.00 0.00 H ATOM 13034 C19 PA 367 144.131 68.559 44.890 1.00 0.00 C ATOM 13035 H9R PA 367 143.056 68.434 45.040 1.00 0.00 H ATOM 13036 H9S PA 367 144.258 69.596 45.205 1.00 0.00 H ATOM 13037 C18 PA 367 144.782 67.750 45.984 1.00 0.00 C ATOM 13038 H8R PA 367 145.850 67.969 46.039 1.00 0.00 H ATOM 13039 H8S PA 367 144.568 66.719 45.696 1.00 0.00 H ATOM 13040 C17 PA 367 144.238 68.065 47.379 1.00 0.00 C ATOM 13041 H7R PA 367 143.214 67.685 47.363 1.00 0.00 H ATOM 13042 H7S PA 367 144.118 69.121 47.631 1.00 0.00 H ATOM 13043 C16 PA 367 145.041 67.417 48.560 1.00 0.00 C ATOM 13044 H6R PA 367 145.933 68.035 48.439 1.00 0.00 H ATOM 13045 H6S PA 367 145.290 66.355 48.508 1.00 0.00 H ATOM 13046 C15 PA 367 144.498 67.473 49.980 1.00 0.00 C ATOM 13047 H5R PA 367 144.150 68.491 50.165 1.00 0.00 H ATOM 13048 H5S PA 367 145.361 67.371 50.642 1.00 0.00 H ATOM 13049 C14 PA 367 143.375 66.498 50.441 1.00 0.00 C ATOM 13050 H4R PA 367 142.524 66.906 49.891 1.00 0.00 H ATOM 13051 H4S PA 367 143.261 66.750 51.497 1.00 0.00 H ATOM 13052 C13 PA 367 143.520 65.061 50.099 1.00 0.00 C ATOM 13053 H3R PA 367 143.491 64.916 49.017 1.00 0.00 H ATOM 13054 H3S PA 367 142.660 64.494 50.460 1.00 0.00 H ATOM 13055 C12 PA 367 144.801 64.451 50.646 1.00 0.00 C ATOM 13056 H2R PA 367 145.697 65.005 50.359 1.00 0.00 H ATOM 13057 H2S PA 367 144.906 63.508 50.104 1.00 0.00 H ATOM 13058 C11 PGR 368 144.745 64.284 52.120 1.00 0.00 C ATOM 13059 O12 PGR 368 145.180 65.143 52.817 1.00 0.00 O ATOM 13060 O11 PGR 368 143.990 63.265 52.533 1.00 0.00 O ATOM 13061 C1 PGR 368 143.580 63.057 53.904 1.00 0.00 C ATOM 13062 HR PGR 368 144.482 63.254 54.490 1.00 0.00 H ATOM 13063 HS PGR 368 143.382 61.983 53.946 1.00 0.00 H ATOM 13064 C2 PGR 368 142.385 64.004 54.178 1.00 0.00 C ATOM 13065 HX PGR 368 142.623 65.007 53.815 1.00 0.00 H ATOM 13066 C3 PGR 368 142.158 64.014 55.687 1.00 0.00 C ATOM 13067 HA PGR 368 141.567 64.916 55.864 1.00 0.00 H ATOM 13068 HB PGR 368 143.111 64.188 56.193 1.00 0.00 H ATOM 13069 O31 PGR 368 141.624 62.801 56.200 1.00 0.00 O ATOM 13070 P31 PGR 368 140.959 62.783 57.693 1.00 0.00 P ATOM 13071 O32 PGR 368 142.242 62.846 58.600 1.00 0.00 O ATOM 13072 C31 PGR 368 142.707 64.108 59.162 1.00 0.00 C ATOM 13073 H1A PGR 368 141.952 64.617 59.768 1.00 0.00 H ATOM 13074 H1B PGR 368 143.020 64.820 58.395 1.00 0.00 H ATOM 13075 C32 PGR 368 143.979 63.835 60.051 1.00 0.00 C ATOM 13076 H2A PGR 368 144.338 64.739 60.549 1.00 0.00 H ATOM 13077 O35 PGR 368 144.938 63.175 59.280 1.00 0.00 O ATOM 13078 HO5A PGR 368 144.410 62.538 58.767 1.00 0.00 H ATOM 13079 C33 PGR 368 143.621 62.895 61.301 1.00 0.00 C ATOM 13080 H3A PGR 368 144.556 62.970 61.861 1.00 0.00 H ATOM 13081 H3B PGR 368 142.720 63.203 61.838 1.00 0.00 H ATOM 13082 O33 PGR 368 140.156 64.001 57.826 1.00 0.00 O ATOM 13083 O34 PGR 368 140.322 61.543 58.092 1.00 0.00 O ATOM 13084 O21 PGR 368 141.180 63.482 53.581 1.00 0.00 O ATOM 13085 C21 PGR 368 140.177 64.337 53.436 1.00 0.00 C ATOM 13086 O22 PGR 368 140.213 65.541 53.650 1.00 0.00 O ATOM 13087 O36 PGR 368 143.532 61.573 60.837 1.00 0.00 O ATOM 13088 HO6A PGR 368 142.629 61.253 60.661 1.00 0.00 H ATOM 13089 C12 OL 369 138.900 63.726 52.915 1.00 0.00 C ATOM 13090 H2R OL 369 138.724 62.759 53.391 1.00 0.00 H ATOM 13091 H2S OL 369 138.012 64.307 53.172 1.00 0.00 H ATOM 13092 C13 OL 369 139.108 63.456 51.407 1.00 0.00 C ATOM 13093 H3R OL 369 139.363 64.361 50.851 1.00 0.00 H ATOM 13094 H3S OL 369 140.094 62.986 51.436 1.00 0.00 H ATOM 13095 C14 OL 369 138.095 62.596 50.666 1.00 0.00 C ATOM 13096 H4R OL 369 138.067 61.592 51.096 1.00 0.00 H ATOM 13097 H4S OL 369 137.035 62.831 50.776 1.00 0.00 H ATOM 13098 C15 OL 369 138.364 62.489 49.170 1.00 0.00 C ATOM 13099 H5R OL 369 137.511 61.972 48.726 1.00 0.00 H ATOM 13100 H5S OL 369 138.503 63.509 48.805 1.00 0.00 H ATOM 13101 C16 OL 369 139.590 61.659 48.650 1.00 0.00 C ATOM 13102 H6R OL 369 139.544 61.502 47.571 1.00 0.00 H ATOM 13103 H6S OL 369 140.410 62.364 48.803 1.00 0.00 H ATOM 13104 C17 OL 369 139.950 60.340 49.377 1.00 0.00 C ATOM 13105 H7R OL 369 140.858 59.950 48.913 1.00 0.00 H ATOM 13106 H7S OL 369 140.243 60.641 50.385 1.00 0.00 H ATOM 13107 C18 OL 369 138.754 59.302 49.339 1.00 0.00 C ATOM 13108 H8R OL 369 137.749 59.702 49.491 1.00 0.00 H ATOM 13109 H8S OL 369 138.639 58.855 48.349 1.00 0.00 H ATOM 13110 C19 OL 369 138.975 58.258 50.377 1.00 0.00 C ATOM 13111 H9R OL 369 139.195 58.447 51.424 1.00 0.00 H ATOM 13112 C110 OL 369 138.857 56.926 50.178 1.00 0.00 C ATOM 13113 H10R OL 369 139.108 56.240 50.984 1.00 0.00 H ATOM 13114 C111 OL 369 138.309 56.234 48.932 1.00 0.00 C ATOM 13115 H11R OL 369 137.421 55.652 49.186 1.00 0.00 H ATOM 13116 H11S OL 369 137.880 56.969 48.249 1.00 0.00 H ATOM 13117 C112 OL 369 139.351 55.272 48.342 1.00 0.00 C ATOM 13118 H12R OL 369 140.222 55.878 48.082 1.00 0.00 H ATOM 13119 H12S OL 369 139.642 54.623 49.171 1.00 0.00 H ATOM 13120 C113 OL 369 138.966 54.287 47.323 1.00 0.00 C ATOM 13121 H13R OL 369 138.204 53.609 47.711 1.00 0.00 H ATOM 13122 H13S OL 369 138.425 54.910 46.607 1.00 0.00 H ATOM 13123 C114 OL 369 140.147 53.512 46.697 1.00 0.00 C ATOM 13124 H14R OL 369 140.960 54.136 46.318 1.00 0.00 H ATOM 13125 H14S OL 369 140.630 52.895 47.458 1.00 0.00 H ATOM 13126 C115 OL 369 139.786 52.567 45.570 1.00 0.00 C ATOM 13127 H15R OL 369 140.568 51.941 45.135 1.00 0.00 H ATOM 13128 H15S OL 369 139.050 51.868 45.971 1.00 0.00 H ATOM 13129 C116 OL 369 139.062 53.213 44.486 1.00 0.00 C ATOM 13130 H16R OL 369 138.136 53.625 44.891 1.00 0.00 H ATOM 13131 H16S OL 369 139.539 54.173 44.276 1.00 0.00 H ATOM 13132 C117 OL 369 138.919 52.518 43.126 1.00 0.00 C ATOM 13133 H17R OL 369 139.875 52.136 42.763 1.00 0.00 H ATOM 13134 H17S OL 369 138.270 51.646 43.230 1.00 0.00 H ATOM 13135 C118 OL 369 138.378 53.340 41.911 1.00 0.00 C ATOM 13136 H18R OL 369 137.296 53.404 42.040 1.00 0.00 H ATOM 13137 H18S OL 369 138.807 52.879 41.019 1.00 0.00 H ATOM 13138 H18T OL 369 138.681 54.378 41.760 1.00 0.00 H TER 13139 OL 369 ATOM 13139 C116 PA 370 90.152 81.264 45.376 1.00 0.00 C ATOM 13140 H16R PA 370 90.017 81.118 44.302 1.00 0.00 H ATOM 13141 H16S PA 370 89.750 80.387 45.888 1.00 0.00 H ATOM 13142 H16T PA 370 91.241 81.331 45.392 1.00 0.00 H ATOM 13143 C115 PA 370 89.559 82.512 45.885 1.00 0.00 C ATOM 13144 H15R PA 370 89.630 82.547 46.974 1.00 0.00 H ATOM 13145 H15S PA 370 88.470 82.583 45.900 1.00 0.00 H ATOM 13146 C114 PA 370 90.122 83.851 45.339 1.00 0.00 C ATOM 13147 H14R PA 370 89.729 83.948 44.325 1.00 0.00 H ATOM 13148 H14S PA 370 91.213 83.808 45.300 1.00 0.00 H ATOM 13149 C113 PA 370 89.628 85.116 45.987 1.00 0.00 C ATOM 13150 H13R PA 370 88.540 85.066 46.075 1.00 0.00 H ATOM 13151 H13S PA 370 89.883 86.021 45.433 1.00 0.00 H ATOM 13152 C112 PA 370 90.233 85.202 47.440 1.00 0.00 C ATOM 13153 H12R PA 370 91.312 85.055 47.348 1.00 0.00 H ATOM 13154 H12S PA 370 90.041 84.324 48.059 1.00 0.00 H ATOM 13155 C111 PA 370 89.866 86.453 48.290 1.00 0.00 C ATOM 13156 H11R PA 370 88.974 86.187 48.861 1.00 0.00 H ATOM 13157 H11S PA 370 89.692 87.317 47.644 1.00 0.00 H ATOM 13158 C110 PA 370 90.975 86.896 49.265 1.00 0.00 C ATOM 13159 H10R PA 370 90.541 87.667 49.905 1.00 0.00 H ATOM 13160 H10S PA 370 91.667 87.422 48.605 1.00 0.00 H ATOM 13161 C19 PA 370 91.671 85.696 50.035 1.00 0.00 C ATOM 13162 H9R PA 370 92.218 85.099 49.302 1.00 0.00 H ATOM 13163 H9S PA 370 90.943 84.966 50.393 1.00 0.00 H ATOM 13164 C18 PA 370 92.591 86.225 51.067 1.00 0.00 C ATOM 13165 H8R PA 370 92.885 87.193 50.658 1.00 0.00 H ATOM 13166 H8S PA 370 93.473 85.584 51.001 1.00 0.00 H ATOM 13167 C17 PA 370 91.999 86.353 52.512 1.00 0.00 C ATOM 13168 H7R PA 370 90.911 86.261 52.478 1.00 0.00 H ATOM 13169 H7S PA 370 92.180 87.326 52.972 1.00 0.00 H ATOM 13170 C16 PA 370 92.680 85.300 53.362 1.00 0.00 C ATOM 13171 H6R PA 370 92.128 84.387 53.130 1.00 0.00 H ATOM 13172 H6S PA 370 92.353 85.489 54.387 1.00 0.00 H ATOM 13173 C15 PA 370 94.263 85.293 53.469 1.00 0.00 C ATOM 13174 H5R PA 370 94.488 86.307 53.807 1.00 0.00 H ATOM 13175 H5S PA 370 94.771 84.934 52.571 1.00 0.00 H ATOM 13176 C14 PA 370 94.722 84.357 54.627 1.00 0.00 C ATOM 13177 H4R PA 370 94.591 83.280 54.497 1.00 0.00 H ATOM 13178 H4S PA 370 94.223 84.561 55.577 1.00 0.00 H ATOM 13179 C13 PA 370 96.157 84.503 54.962 1.00 0.00 C ATOM 13180 H3R PA 370 96.464 85.539 55.120 1.00 0.00 H ATOM 13181 H3S PA 370 96.690 84.147 54.077 1.00 0.00 H ATOM 13182 C12 PA 370 96.547 83.647 56.163 1.00 0.00 C ATOM 13183 H2R PA 370 96.409 82.611 55.847 1.00 0.00 H ATOM 13184 H2S PA 370 95.823 83.694 56.979 1.00 0.00 H ATOM 13185 C11 PGR 371 97.980 83.870 56.620 1.00 0.00 C ATOM 13186 O12 PGR 371 98.721 84.766 56.277 1.00 0.00 O ATOM 13187 O11 PGR 371 98.232 82.868 57.480 1.00 0.00 O ATOM 13188 C1 PGR 371 99.203 83.167 58.536 1.00 0.00 C ATOM 13189 HR PGR 371 98.783 83.875 59.255 1.00 0.00 H ATOM 13190 HS PGR 371 100.056 83.657 58.059 1.00 0.00 H ATOM 13191 C2 PGR 371 99.747 81.828 59.195 1.00 0.00 C ATOM 13192 HX PGR 371 99.040 81.071 58.846 1.00 0.00 H ATOM 13193 C3 PGR 371 99.693 81.771 60.699 1.00 0.00 C ATOM 13194 HA PGR 371 98.718 82.096 61.071 1.00 0.00 H ATOM 13195 HB PGR 371 100.380 82.560 61.017 1.00 0.00 H ATOM 13196 O31 PGR 371 100.164 80.534 61.214 1.00 0.00 O ATOM 13197 P31 PGR 371 100.026 80.112 62.728 1.00 0.00 P ATOM 13198 O32 PGR 371 98.582 80.348 63.109 1.00 0.00 O ATOM 13199 C31 PGR 371 98.114 79.789 64.286 1.00 0.00 C ATOM 13200 H1A PGR 371 98.733 80.115 65.126 1.00 0.00 H ATOM 13201 H1B PGR 371 98.138 78.706 64.137 1.00 0.00 H ATOM 13202 C32 PGR 371 96.637 80.167 64.656 1.00 0.00 C ATOM 13203 H2A PGR 371 96.407 79.687 65.611 1.00 0.00 H ATOM 13204 O35 PGR 371 95.927 79.523 63.614 1.00 0.00 O ATOM 13205 HO5A PGR 371 96.460 79.533 62.799 1.00 0.00 H ATOM 13206 C33 PGR 371 96.406 81.751 64.622 1.00 0.00 C ATOM 13207 H3A PGR 371 97.094 82.135 65.380 1.00 0.00 H ATOM 13208 H3B PGR 371 96.786 82.060 63.645 1.00 0.00 H ATOM 13209 O33 PGR 371 100.262 78.658 62.740 1.00 0.00 O ATOM 13210 O34 PGR 371 100.937 80.950 63.575 1.00 0.00 O ATOM 13211 O21 PGR 371 101.166 81.636 58.693 1.00 0.00 O ATOM 13212 C21 PGR 371 101.685 80.458 58.402 1.00 0.00 C ATOM 13213 O22 PGR 371 101.095 79.403 58.553 1.00 0.00 O ATOM 13214 O36 PGR 371 95.057 82.222 64.905 1.00 0.00 O ATOM 13215 HO6A PGR 371 95.181 83.167 65.109 1.00 0.00 H ATOM 13216 C12 OL 372 103.190 80.553 58.163 1.00 0.00 C ATOM 13217 H2R OL 372 103.462 81.605 58.052 1.00 0.00 H ATOM 13218 H2S OL 372 103.739 80.063 58.970 1.00 0.00 H ATOM 13219 C13 OL 372 103.564 80.069 56.795 1.00 0.00 C ATOM 13220 H3R OL 372 104.632 79.859 56.707 1.00 0.00 H ATOM 13221 H3S OL 372 103.105 79.092 56.632 1.00 0.00 H ATOM 13222 C14 OL 372 103.143 80.935 55.606 1.00 0.00 C ATOM 13223 H4R OL 372 102.114 81.240 55.808 1.00 0.00 H ATOM 13224 H4S OL 372 103.680 81.883 55.675 1.00 0.00 H ATOM 13225 C15 OL 372 103.300 80.299 54.193 1.00 0.00 C ATOM 13226 H5R OL 372 104.367 80.066 54.202 1.00 0.00 H ATOM 13227 H5S OL 372 102.722 79.373 54.177 1.00 0.00 H ATOM 13228 C16 OL 372 103.155 81.288 53.059 1.00 0.00 C ATOM 13229 H6R OL 372 102.211 81.835 53.022 1.00 0.00 H ATOM 13230 H6S OL 372 103.823 82.148 53.138 1.00 0.00 H ATOM 13231 C17 OL 372 103.627 80.746 51.709 1.00 0.00 C ATOM 13232 H7R OL 372 104.600 80.293 51.912 1.00 0.00 H ATOM 13233 H7S OL 372 102.994 79.875 51.531 1.00 0.00 H ATOM 13234 C18 OL 372 103.626 81.867 50.636 1.00 0.00 C ATOM 13235 H8R OL 372 102.641 82.327 50.529 1.00 0.00 H ATOM 13236 H8S OL 372 104.374 82.545 51.052 1.00 0.00 H ATOM 13237 C19 OL 372 103.902 81.264 49.292 1.00 0.00 C ATOM 13238 H9R OL 372 103.077 80.692 48.876 1.00 0.00 H ATOM 13239 C110 OL 372 105.067 81.264 48.635 1.00 0.00 C ATOM 13240 H10R OL 372 105.249 80.692 47.729 1.00 0.00 H ATOM 13241 C111 OL 372 106.266 82.017 49.005 1.00 0.00 C ATOM 13242 H11R OL 372 106.475 82.088 50.075 1.00 0.00 H ATOM 13243 H11S OL 372 107.174 81.584 48.579 1.00 0.00 H ATOM 13244 C112 OL 372 106.131 83.416 48.447 1.00 0.00 C ATOM 13245 H12R OL 372 105.294 83.992 48.846 1.00 0.00 H ATOM 13246 H12S OL 372 107.050 83.857 48.837 1.00 0.00 H ATOM 13247 C113 OL 372 106.056 83.574 46.934 1.00 0.00 C ATOM 13248 H13R OL 372 105.482 82.790 46.437 1.00 0.00 H ATOM 13249 H13S OL 372 105.590 84.501 46.593 1.00 0.00 H ATOM 13250 C114 OL 372 107.452 83.393 46.265 1.00 0.00 C ATOM 13251 H14R OL 372 108.138 84.204 46.520 1.00 0.00 H ATOM 13252 H14S OL 372 107.844 82.472 46.702 1.00 0.00 H ATOM 13253 C115 OL 372 107.511 83.186 44.719 1.00 0.00 C ATOM 13254 H15R OL 372 106.943 83.993 44.251 1.00 0.00 H ATOM 13255 H15S OL 372 108.584 83.351 44.608 1.00 0.00 H ATOM 13256 C116 OL 372 107.043 81.788 44.315 1.00 0.00 C ATOM 13257 H16R OL 372 107.384 81.043 45.036 1.00 0.00 H ATOM 13258 H16S OL 372 105.962 81.737 44.460 1.00 0.00 H ATOM 13259 C117 OL 372 107.311 81.492 42.828 1.00 0.00 C ATOM 13260 H17R OL 372 106.834 82.193 42.139 1.00 0.00 H ATOM 13261 H17S OL 372 108.338 81.538 42.460 1.00 0.00 H ATOM 13262 C118 OL 372 106.662 80.134 42.448 1.00 0.00 C ATOM 13263 H18R OL 372 106.968 79.371 43.166 1.00 0.00 H ATOM 13264 H18S OL 372 106.749 79.913 41.382 1.00 0.00 H ATOM 13265 H18T OL 372 105.584 80.217 42.603 1.00 0.00 H TER 13266 OL 372 ATOM 13266 C116 PA 373 91.766 128.048 39.613 1.00 0.00 C ATOM 13267 H16R PA 373 92.368 128.260 40.499 1.00 0.00 H ATOM 13268 H16S PA 373 92.499 128.237 38.826 1.00 0.00 H ATOM 13269 H16T PA 373 91.423 127.014 39.537 1.00 0.00 H ATOM 13270 C115 PA 373 90.548 128.974 39.412 1.00 0.00 C ATOM 13271 H15R PA 373 90.223 129.272 38.413 1.00 0.00 H ATOM 13272 H15S PA 373 90.796 130.022 39.590 1.00 0.00 H ATOM 13273 C114 PA 373 89.403 128.569 40.387 1.00 0.00 C ATOM 13274 H14R PA 373 88.753 127.770 40.026 1.00 0.00 H ATOM 13275 H14S PA 373 88.695 129.380 40.572 1.00 0.00 H ATOM 13276 C113 PA 373 89.868 128.158 41.835 1.00 0.00 C ATOM 13277 H13R PA 373 90.411 129.013 42.243 1.00 0.00 H ATOM 13278 H13S PA 373 90.556 127.312 41.903 1.00 0.00 H ATOM 13279 C112 PA 373 88.668 127.743 42.696 1.00 0.00 C ATOM 13280 H12R PA 373 88.178 126.965 42.107 1.00 0.00 H ATOM 13281 H12S PA 373 88.025 128.621 42.795 1.00 0.00 H ATOM 13282 C111 PA 373 89.064 127.105 44.006 1.00 0.00 C ATOM 13283 H11R PA 373 89.828 127.671 44.544 1.00 0.00 H ATOM 13284 H11S PA 373 89.467 126.109 43.811 1.00 0.00 H ATOM 13285 C110 PA 373 87.896 127.070 44.990 1.00 0.00 C ATOM 13286 H10R PA 373 87.187 126.328 44.616 1.00 0.00 H ATOM 13287 H10S PA 373 87.399 128.033 44.861 1.00 0.00 H ATOM 13288 C19 PA 373 88.396 126.810 46.376 1.00 0.00 C ATOM 13289 H9R PA 373 88.976 127.687 46.672 1.00 0.00 H ATOM 13290 H9S PA 373 89.082 125.961 46.339 1.00 0.00 H ATOM 13291 C18 PA 373 87.266 126.492 47.318 1.00 0.00 C ATOM 13292 H8R PA 373 86.434 125.870 46.980 1.00 0.00 H ATOM 13293 H8S PA 373 86.710 127.428 47.411 1.00 0.00 H ATOM 13294 C17 PA 373 87.886 125.942 48.714 1.00 0.00 C ATOM 13295 H7R PA 373 88.766 126.515 49.012 1.00 0.00 H ATOM 13296 H7S PA 373 88.368 124.995 48.463 1.00 0.00 H ATOM 13297 C16 PA 373 86.808 125.748 49.842 1.00 0.00 C ATOM 13298 H6R PA 373 86.266 124.870 49.485 1.00 0.00 H ATOM 13299 H6S PA 373 86.029 126.510 49.766 1.00 0.00 H ATOM 13300 C15 PA 373 87.386 125.558 51.227 1.00 0.00 C ATOM 13301 H5R PA 373 88.030 126.432 51.345 1.00 0.00 H ATOM 13302 H5S PA 373 87.962 124.633 51.298 1.00 0.00 H ATOM 13303 C14 PA 373 86.409 125.470 52.452 1.00 0.00 C ATOM 13304 H4R PA 373 85.647 124.693 52.374 1.00 0.00 H ATOM 13305 H4S PA 373 86.022 126.492 52.464 1.00 0.00 H ATOM 13306 C13 PA 373 87.155 125.295 53.751 1.00 0.00 C ATOM 13307 H3R PA 373 86.399 125.214 54.534 1.00 0.00 H ATOM 13308 H3S PA 373 87.782 126.132 54.067 1.00 0.00 H ATOM 13309 C12 PA 373 88.017 124.039 53.844 1.00 0.00 C ATOM 13310 H2R PA 373 88.909 124.257 53.253 1.00 0.00 H ATOM 13311 H2S PA 373 87.533 123.119 53.509 1.00 0.00 H ATOM 13312 C11 PC 374 88.642 123.837 55.200 1.00 0.00 C ATOM 13313 O12 PC 374 88.429 124.463 56.192 1.00 0.00 O ATOM 13314 O11 PC 374 89.590 122.836 55.200 1.00 0.00 O ATOM 13315 C1 PC 374 90.297 122.534 56.405 1.00 0.00 C ATOM 13316 HR PC 374 89.701 122.184 57.252 1.00 0.00 H ATOM 13317 HS PC 374 90.822 123.449 56.691 1.00 0.00 H ATOM 13318 C2 PC 374 91.456 121.516 56.120 1.00 0.00 C ATOM 13319 HX PC 374 90.960 120.675 55.627 1.00 0.00 H ATOM 13320 C3 PC 374 92.129 120.920 57.336 1.00 0.00 C ATOM 13321 HA PC 374 92.889 120.254 56.920 1.00 0.00 H ATOM 13322 HB PC 374 91.413 120.405 57.981 1.00 0.00 H ATOM 13323 O31 PC 374 92.827 121.903 57.990 1.00 0.00 O ATOM 13324 P31 PC 374 93.961 121.642 59.026 1.00 0.00 P ATOM 13325 O32 PC 374 93.201 121.270 60.359 1.00 0.00 O ATOM 13326 C31 PC 374 92.644 122.325 61.115 1.00 0.00 C ATOM 13327 H1A PC 374 92.044 123.042 60.549 1.00 0.00 H ATOM 13328 H1B PC 374 93.532 122.864 61.456 1.00 0.00 H ATOM 13329 C32 PC 374 91.833 121.821 62.361 1.00 0.00 C ATOM 13330 H2A PC 374 92.430 121.186 63.018 1.00 0.00 H ATOM 13331 H2B PC 374 90.904 121.296 62.135 1.00 0.00 H ATOM 13332 N31 PC 374 91.298 122.886 63.309 1.00 0.00 N ATOM 13333 C33 PC 374 90.468 122.163 64.260 1.00 0.00 C ATOM 13334 H3A PC 374 91.060 121.471 64.860 1.00 0.00 H ATOM 13335 H3B PC 374 89.673 121.646 63.720 1.00 0.00 H ATOM 13336 H3C PC 374 90.190 122.974 64.935 1.00 0.00 H ATOM 13337 C34 PC 374 92.364 123.671 64.060 1.00 0.00 C ATOM 13338 H4A PC 374 93.318 123.661 63.530 1.00 0.00 H ATOM 13339 H4B PC 374 92.471 123.265 65.067 1.00 0.00 H ATOM 13340 H4C PC 374 92.018 124.705 64.057 1.00 0.00 H ATOM 13341 C35 PC 374 90.378 123.846 62.731 1.00 0.00 C ATOM 13342 H5A PC 374 89.517 123.326 62.308 1.00 0.00 H ATOM 13343 H5B PC 374 90.848 124.346 61.883 1.00 0.00 H ATOM 13344 H5C PC 374 89.976 124.559 63.453 1.00 0.00 H ATOM 13345 O33 PC 374 94.747 120.381 58.648 1.00 0.00 O ATOM 13346 O34 PC 374 94.696 122.903 59.185 1.00 0.00 O ATOM 13347 O21 PC 374 92.371 122.125 55.226 1.00 0.00 O ATOM 13348 C21 PC 374 93.178 121.319 54.497 1.00 0.00 C ATOM 13349 O22 PC 374 93.282 120.134 54.467 1.00 0.00 O ATOM 13350 C12 OL 375 94.055 122.253 53.667 1.00 0.00 C ATOM 13351 H2R OL 375 93.521 123.189 53.491 1.00 0.00 H ATOM 13352 H2S OL 375 94.839 122.538 54.372 1.00 0.00 H ATOM 13353 C13 OL 375 94.661 121.531 52.477 1.00 0.00 C ATOM 13354 H3R OL 375 95.292 120.749 52.905 1.00 0.00 H ATOM 13355 H3S OL 375 93.813 121.140 51.911 1.00 0.00 H ATOM 13356 C14 OL 375 95.442 122.401 51.463 1.00 0.00 C ATOM 13357 H4R OL 375 94.782 123.196 51.109 1.00 0.00 H ATOM 13358 H4S OL 375 96.405 122.776 51.815 1.00 0.00 H ATOM 13359 C15 OL 375 95.696 121.574 50.244 1.00 0.00 C ATOM 13360 H5R OL 375 96.298 120.693 50.477 1.00 0.00 H ATOM 13361 H5S OL 375 94.752 121.158 49.887 1.00 0.00 H ATOM 13362 C16 OL 375 96.407 122.363 49.124 1.00 0.00 C ATOM 13363 H6R OL 375 95.777 123.150 48.706 1.00 0.00 H ATOM 13364 H6S OL 375 97.235 123.009 49.427 1.00 0.00 H ATOM 13365 C17 OL 375 96.893 121.545 47.937 1.00 0.00 C ATOM 13366 H7R OL 375 97.741 120.970 48.317 1.00 0.00 H ATOM 13367 H7S OL 375 96.192 120.803 47.551 1.00 0.00 H ATOM 13368 C18 OL 375 97.341 122.354 46.683 1.00 0.00 C ATOM 13369 H8R OL 375 98.097 123.078 46.993 1.00 0.00 H ATOM 13370 H8S OL 375 97.864 121.661 46.020 1.00 0.00 H ATOM 13371 C19 OL 375 96.219 123.046 46.044 1.00 0.00 C ATOM 13372 H9R OL 375 95.209 122.781 46.346 1.00 0.00 H ATOM 13373 C110 OL 375 96.355 124.065 45.244 1.00 0.00 C ATOM 13374 H10R OL 375 95.453 124.397 44.737 1.00 0.00 H ATOM 13375 C111 OL 375 97.587 124.575 44.752 1.00 0.00 C ATOM 13376 H11R OL 375 97.741 125.606 45.077 1.00 0.00 H ATOM 13377 H11S OL 375 98.374 123.985 45.227 1.00 0.00 H ATOM 13378 C112 OL 375 97.810 124.544 43.282 1.00 0.00 C ATOM 13379 H12R OL 375 98.731 125.074 43.029 1.00 0.00 H ATOM 13380 H12S OL 375 97.868 123.513 42.927 1.00 0.00 H ATOM 13381 C113 OL 375 96.708 125.248 42.480 1.00 0.00 C ATOM 13382 H13R OL 375 95.747 124.736 42.562 1.00 0.00 H ATOM 13383 H13S OL 375 96.708 126.275 42.850 1.00 0.00 H ATOM 13384 C114 OL 375 97.028 125.234 40.984 1.00 0.00 C ATOM 13385 H14R OL 375 98.071 125.262 40.661 1.00 0.00 H ATOM 13386 H14S OL 375 96.654 124.295 40.571 1.00 0.00 H ATOM 13387 C115 OL 375 96.370 126.395 40.277 1.00 0.00 C ATOM 13388 H15R OL 375 95.448 126.081 39.784 1.00 0.00 H ATOM 13389 H15S OL 375 96.057 127.193 40.953 1.00 0.00 H ATOM 13390 C116 OL 375 97.318 126.967 39.207 1.00 0.00 C ATOM 13391 H16R OL 375 98.185 127.396 39.713 1.00 0.00 H ATOM 13392 H16S OL 375 97.765 126.294 38.473 1.00 0.00 H ATOM 13393 C117 OL 375 96.743 128.156 38.500 1.00 0.00 C ATOM 13394 H17R OL 375 96.401 128.848 39.273 1.00 0.00 H ATOM 13395 H17S OL 375 97.572 128.715 38.062 1.00 0.00 H ATOM 13396 C118 OL 375 95.645 127.892 37.564 1.00 0.00 C ATOM 13397 H18R OL 375 94.650 127.795 38.003 1.00 0.00 H ATOM 13398 H18S OL 375 95.938 126.891 37.239 1.00 0.00 H ATOM 13399 H18T OL 375 95.592 128.588 36.724 1.00 0.00 H TER 13400 OL 375 ATOM 13400 C116 PA 376 16.562 27.403 40.103 1.00 0.00 C ATOM 13401 H16R PA 376 16.839 26.531 40.699 1.00 0.00 H ATOM 13402 H16S PA 376 16.799 27.124 39.075 1.00 0.00 H ATOM 13403 H16T PA 376 15.475 27.304 40.096 1.00 0.00 H ATOM 13404 C115 PA 376 17.162 28.764 40.580 1.00 0.00 C ATOM 13405 H15R PA 376 16.550 29.577 40.184 1.00 0.00 H ATOM 13406 H15S PA 376 18.134 28.895 40.099 1.00 0.00 H ATOM 13407 C114 PA 376 17.223 28.877 42.105 1.00 0.00 C ATOM 13408 H14R PA 376 17.755 28.030 42.544 1.00 0.00 H ATOM 13409 H14S PA 376 16.221 28.695 42.500 1.00 0.00 H ATOM 13410 C113 PA 376 17.831 30.161 42.658 1.00 0.00 C ATOM 13411 H13R PA 376 17.539 30.999 42.023 1.00 0.00 H ATOM 13412 H13S PA 376 18.921 30.142 42.714 1.00 0.00 H ATOM 13413 C112 PA 376 17.422 30.524 44.126 1.00 0.00 C ATOM 13414 H12R PA 376 17.305 29.668 44.793 1.00 0.00 H ATOM 13415 H12S PA 376 16.363 30.743 43.971 1.00 0.00 H ATOM 13416 C111 PA 376 18.164 31.676 44.839 1.00 0.00 C ATOM 13417 H11R PA 376 18.229 32.537 44.171 1.00 0.00 H ATOM 13418 H11S PA 376 19.188 31.506 45.179 1.00 0.00 H ATOM 13419 C110 PA 376 17.375 32.238 46.087 1.00 0.00 C ATOM 13420 H10R PA 376 16.334 32.368 45.784 1.00 0.00 H ATOM 13421 H10S PA 376 17.696 33.262 46.290 1.00 0.00 H ATOM 13422 C19 PA 376 17.502 31.359 47.332 1.00 0.00 C ATOM 13423 H9R PA 376 18.539 31.096 47.551 1.00 0.00 H ATOM 13424 H9S PA 376 16.878 30.490 47.115 1.00 0.00 H ATOM 13425 C18 PA 376 17.022 32.106 48.578 1.00 0.00 C ATOM 13426 H8R PA 376 15.996 32.343 48.289 1.00 0.00 H ATOM 13427 H8S PA 376 17.474 33.100 48.603 1.00 0.00 H ATOM 13428 C17 PA 376 17.296 31.442 49.880 1.00 0.00 C ATOM 13429 H7R PA 376 18.293 31.043 50.080 1.00 0.00 H ATOM 13430 H7S PA 376 16.684 30.545 49.999 1.00 0.00 H ATOM 13431 C16 PA 376 16.831 32.422 50.975 1.00 0.00 C ATOM 13432 H6R PA 376 15.832 32.857 50.897 1.00 0.00 H ATOM 13433 H6S PA 376 17.456 33.312 50.879 1.00 0.00 H ATOM 13434 C15 PA 376 16.933 31.893 52.393 1.00 0.00 C ATOM 13435 H5R PA 376 17.852 31.311 52.476 1.00 0.00 H ATOM 13436 H5S PA 376 16.061 31.262 52.574 1.00 0.00 H ATOM 13437 C14 PA 376 16.863 32.991 53.415 1.00 0.00 C ATOM 13438 H4R PA 376 15.853 33.406 53.401 1.00 0.00 H ATOM 13439 H4S PA 376 17.482 33.860 53.182 1.00 0.00 H ATOM 13440 C13 PA 376 17.337 32.644 54.829 1.00 0.00 C ATOM 13441 H3R PA 376 16.719 31.764 55.019 1.00 0.00 H ATOM 13442 H3S PA 376 16.956 33.378 55.542 1.00 0.00 H ATOM 13443 C12 PA 376 18.741 32.065 55.003 1.00 0.00 C ATOM 13444 H2R PA 376 19.375 32.950 54.917 1.00 0.00 H ATOM 13445 H2S PA 376 19.130 31.393 54.235 1.00 0.00 H ATOM 13446 C11 PC 377 18.896 31.397 56.281 1.00 0.00 C ATOM 13447 O12 PC 377 18.026 30.845 56.907 1.00 0.00 O ATOM 13448 O11 PC 377 20.118 31.399 56.691 1.00 0.00 O ATOM 13449 C1 PC 377 20.577 30.906 58.013 1.00 0.00 C ATOM 13450 HR PC 377 19.904 31.351 58.751 1.00 0.00 H ATOM 13451 HS PC 377 21.553 31.381 58.139 1.00 0.00 H ATOM 13452 C2 PC 377 20.702 29.335 57.972 1.00 0.00 C ATOM 13453 HX PC 377 19.789 28.814 57.673 1.00 0.00 H ATOM 13454 C3 PC 377 20.968 28.737 59.384 1.00 0.00 C ATOM 13455 HA PC 377 21.451 27.757 59.366 1.00 0.00 H ATOM 13456 HB PC 377 20.003 28.735 59.896 1.00 0.00 H ATOM 13457 O31 PC 377 21.910 29.558 60.132 1.00 0.00 O ATOM 13458 P31 PC 377 22.253 29.199 61.632 1.00 0.00 P ATOM 13459 O32 PC 377 22.996 27.820 61.635 1.00 0.00 O ATOM 13460 C31 PC 377 24.353 27.739 61.804 1.00 0.00 C ATOM 13461 H1A PC 377 24.709 28.052 62.788 1.00 0.00 H ATOM 13462 H1B PC 377 24.846 28.383 61.071 1.00 0.00 H ATOM 13463 C32 PC 377 24.746 26.320 61.690 1.00 0.00 C ATOM 13464 H2A PC 377 24.433 25.892 60.737 1.00 0.00 H ATOM 13465 H2B PC 377 24.280 25.797 62.526 1.00 0.00 H ATOM 13466 N31 PC 377 26.213 26.060 61.798 1.00 0.00 N ATOM 13467 C33 PC 377 26.478 24.647 61.720 1.00 0.00 C ATOM 13468 H3A PC 377 25.762 24.192 61.034 1.00 0.00 H ATOM 13469 H3B PC 377 26.392 24.222 62.721 1.00 0.00 H ATOM 13470 H3C PC 377 27.488 24.465 61.349 1.00 0.00 H ATOM 13471 C34 PC 377 26.764 26.714 60.610 1.00 0.00 C ATOM 13472 H4A PC 377 26.530 27.776 60.521 1.00 0.00 H ATOM 13473 H4B PC 377 26.377 26.143 59.764 1.00 0.00 H ATOM 13474 H4C PC 377 27.835 26.510 60.578 1.00 0.00 H ATOM 13475 C35 PC 377 26.812 26.666 62.940 1.00 0.00 C ATOM 13476 H5A PC 377 26.631 27.736 63.051 1.00 0.00 H ATOM 13477 H5B PC 377 27.888 26.544 62.808 1.00 0.00 H ATOM 13478 H5C PC 377 26.424 26.105 63.791 1.00 0.00 H ATOM 13479 O33 PC 377 23.171 30.256 62.138 1.00 0.00 O ATOM 13480 O34 PC 377 20.914 29.005 62.423 1.00 0.00 O ATOM 13481 O21 PC 377 21.885 28.974 56.983 1.00 0.00 O ATOM 13482 C21 PC 377 21.658 28.032 56.003 1.00 0.00 C ATOM 13483 O22 PC 377 20.577 27.552 56.011 1.00 0.00 O ATOM 13484 C12 OL 378 22.720 27.674 54.940 1.00 0.00 C ATOM 13485 H2R OL 378 23.019 26.634 55.083 1.00 0.00 H ATOM 13486 H2S OL 378 22.229 27.622 53.966 1.00 0.00 H ATOM 13487 C13 OL 378 23.964 28.683 54.941 1.00 0.00 C ATOM 13488 H3R OL 378 24.470 28.704 55.908 1.00 0.00 H ATOM 13489 H3S OL 378 24.607 28.255 54.169 1.00 0.00 H ATOM 13490 C14 OL 378 23.665 30.208 54.735 1.00 0.00 C ATOM 13491 H4R OL 378 23.146 30.673 55.575 1.00 0.00 H ATOM 13492 H4S OL 378 24.596 30.766 54.607 1.00 0.00 H ATOM 13493 C15 OL 378 22.928 30.454 53.448 1.00 0.00 C ATOM 13494 H5R OL 378 23.537 29.971 52.680 1.00 0.00 H ATOM 13495 H5S OL 378 21.906 30.073 53.398 1.00 0.00 H ATOM 13496 C16 OL 378 22.664 31.994 53.131 1.00 0.00 C ATOM 13497 H6R OL 378 22.255 32.499 54.009 1.00 0.00 H ATOM 13498 H6S OL 378 23.565 32.512 52.798 1.00 0.00 H ATOM 13499 C17 OL 378 21.643 32.220 51.981 1.00 0.00 C ATOM 13500 H7R OL 378 22.204 31.972 51.078 1.00 0.00 H ATOM 13501 H7S OL 378 20.864 31.464 52.102 1.00 0.00 H ATOM 13502 C18 OL 378 21.021 33.640 51.926 1.00 0.00 C ATOM 13503 H8R OL 378 20.495 33.895 52.849 1.00 0.00 H ATOM 13504 H8S OL 378 21.724 34.474 51.878 1.00 0.00 H ATOM 13505 C19 OL 378 20.220 33.719 50.701 1.00 0.00 C ATOM 13506 H9R OL 378 19.556 32.887 50.480 1.00 0.00 H ATOM 13507 C110 OL 378 20.317 34.647 49.721 1.00 0.00 C ATOM 13508 H10R OL 378 19.713 34.508 48.828 1.00 0.00 H ATOM 13509 C111 OL 378 21.288 35.775 49.582 1.00 0.00 C ATOM 13510 H11R OL 378 20.705 36.691 49.464 1.00 0.00 H ATOM 13511 H11S OL 378 21.912 35.997 50.451 1.00 0.00 H ATOM 13512 C112 OL 378 22.275 35.466 48.493 1.00 0.00 C ATOM 13513 H12R OL 378 21.618 35.353 47.629 1.00 0.00 H ATOM 13514 H12S OL 378 22.783 36.425 48.372 1.00 0.00 H ATOM 13515 C113 OL 378 23.256 34.323 48.872 1.00 0.00 C ATOM 13516 H13R OL 378 23.451 34.372 49.946 1.00 0.00 H ATOM 13517 H13S OL 378 22.666 33.403 48.862 1.00 0.00 H ATOM 13518 C114 OL 378 24.484 34.198 48.010 1.00 0.00 C ATOM 13519 H14R OL 378 24.873 33.196 48.203 1.00 0.00 H ATOM 13520 H14S OL 378 24.320 34.224 46.931 1.00 0.00 H ATOM 13521 C115 OL 378 25.638 35.103 48.374 1.00 0.00 C ATOM 13522 H15R OL 378 25.238 36.108 48.223 1.00 0.00 H ATOM 13523 H15S OL 378 25.879 35.049 49.437 1.00 0.00 H ATOM 13524 C116 OL 378 26.932 34.966 47.607 1.00 0.00 C ATOM 13525 H16R OL 378 27.391 33.993 47.796 1.00 0.00 H ATOM 13526 H16S OL 378 26.632 35.187 46.581 1.00 0.00 H ATOM 13527 C117 OL 378 27.910 36.117 47.933 1.00 0.00 C ATOM 13528 H17R OL 378 27.228 36.968 47.890 1.00 0.00 H ATOM 13529 H17S OL 378 28.315 35.925 48.929 1.00 0.00 H ATOM 13530 C118 OL 378 29.098 36.295 46.989 1.00 0.00 C ATOM 13531 H18R OL 378 29.549 35.320 46.791 1.00 0.00 H ATOM 13532 H18S OL 378 29.838 37.055 47.250 1.00 0.00 H ATOM 13533 H18T OL 378 28.665 36.617 46.040 1.00 0.00 H TER 13534 OL 378 ATOM 13534 C116 PA 379 102.356 55.123 42.790 1.00 0.00 C ATOM 13535 H16R PA 379 101.586 54.554 43.314 1.00 0.00 H ATOM 13536 H16S PA 379 103.000 54.473 42.193 1.00 0.00 H ATOM 13537 H16T PA 379 101.705 55.574 42.038 1.00 0.00 H ATOM 13538 C115 PA 379 103.054 56.303 43.481 1.00 0.00 C ATOM 13539 H15R PA 379 103.972 55.963 43.966 1.00 0.00 H ATOM 13540 H15S PA 379 102.408 56.625 44.301 1.00 0.00 H ATOM 13541 C114 PA 379 103.449 57.345 42.527 1.00 0.00 C ATOM 13542 H14R PA 379 102.613 57.692 41.915 1.00 0.00 H ATOM 13543 H14S PA 379 104.184 56.894 41.857 1.00 0.00 H ATOM 13544 C113 PA 379 104.114 58.551 43.186 1.00 0.00 C ATOM 13545 H13R PA 379 103.748 58.942 44.138 1.00 0.00 H ATOM 13546 H13S PA 379 103.780 59.281 42.446 1.00 0.00 H ATOM 13547 C112 PA 379 105.647 58.570 43.272 1.00 0.00 C ATOM 13548 H12R PA 379 105.997 59.603 43.222 1.00 0.00 H ATOM 13549 H12S PA 379 105.937 57.916 42.447 1.00 0.00 H ATOM 13550 C111 PA 379 106.229 58.073 44.547 1.00 0.00 C ATOM 13551 H11R PA 379 107.168 57.567 44.312 1.00 0.00 H ATOM 13552 H11S PA 379 105.603 57.287 44.973 1.00 0.00 H ATOM 13553 C110 PA 379 106.687 59.127 45.566 1.00 0.00 C ATOM 13554 H10R PA 379 105.792 59.614 45.959 1.00 0.00 H ATOM 13555 H10S PA 379 107.165 59.916 44.981 1.00 0.00 H ATOM 13556 C19 PA 379 107.421 58.689 46.848 1.00 0.00 C ATOM 13557 H9R PA 379 107.671 59.509 47.525 1.00 0.00 H ATOM 13558 H9S PA 379 108.343 58.167 46.582 1.00 0.00 H ATOM 13559 C18 PA 379 106.557 57.588 47.597 1.00 0.00 C ATOM 13560 H8R PA 379 106.654 56.660 47.029 1.00 0.00 H ATOM 13561 H8S PA 379 105.500 57.852 47.530 1.00 0.00 H ATOM 13562 C17 PA 379 107.076 57.432 48.992 1.00 0.00 C ATOM 13563 H7R PA 379 108.097 57.045 48.945 1.00 0.00 H ATOM 13564 H7S PA 379 106.444 56.688 49.481 1.00 0.00 H ATOM 13565 C16 PA 379 106.996 58.513 49.990 1.00 0.00 C ATOM 13566 H6R PA 379 105.981 58.915 49.999 1.00 0.00 H ATOM 13567 H6S PA 379 107.603 59.362 49.667 1.00 0.00 H ATOM 13568 C15 PA 379 107.475 57.980 51.362 1.00 0.00 C ATOM 13569 H5R PA 379 108.510 57.630 51.384 1.00 0.00 H ATOM 13570 H5S PA 379 106.830 57.148 51.653 1.00 0.00 H ATOM 13571 C14 PA 379 107.355 59.079 52.378 1.00 0.00 C ATOM 13572 H4R PA 379 106.317 59.419 52.382 1.00 0.00 H ATOM 13573 H4S PA 379 107.902 60.004 52.184 1.00 0.00 H ATOM 13574 C13 PA 379 107.868 58.755 53.753 1.00 0.00 C ATOM 13575 H3R PA 379 108.944 58.577 53.713 1.00 0.00 H ATOM 13576 H3S PA 379 107.498 57.799 54.129 1.00 0.00 H ATOM 13577 C12 PA 379 107.637 59.831 54.763 1.00 0.00 C ATOM 13578 H2R PA 379 106.659 60.309 54.854 1.00 0.00 H ATOM 13579 H2S PA 379 108.358 60.615 54.521 1.00 0.00 H ATOM 13580 C11 PC 380 108.020 59.379 56.127 1.00 0.00 C ATOM 13581 O12 PC 380 107.234 58.836 56.928 1.00 0.00 O ATOM 13582 O11 PC 380 109.289 59.574 56.421 1.00 0.00 O ATOM 13583 C1 PC 380 109.700 58.935 57.721 1.00 0.00 C ATOM 13584 HR PC 380 108.954 59.239 58.460 1.00 0.00 H ATOM 13585 HS PC 380 110.756 59.179 57.861 1.00 0.00 H ATOM 13586 C2 PC 380 109.583 57.343 57.735 1.00 0.00 C ATOM 13587 HX PC 380 108.541 57.027 57.633 1.00 0.00 H ATOM 13588 C3 PC 380 109.948 56.742 59.142 1.00 0.00 C ATOM 13589 HA PC 380 110.960 57.025 59.442 1.00 0.00 H ATOM 13590 HB PC 380 109.730 55.690 58.941 1.00 0.00 H ATOM 13591 O31 PC 380 109.016 57.265 60.069 1.00 0.00 O ATOM 13592 P31 PC 380 109.054 56.724 61.546 1.00 0.00 P ATOM 13593 O32 PC 380 110.224 57.573 62.047 1.00 0.00 O ATOM 13594 C31 PC 380 110.169 58.971 62.178 1.00 0.00 C ATOM 13595 H1A PC 380 109.507 59.003 63.047 1.00 0.00 H ATOM 13596 H1B PC 380 109.785 59.397 61.248 1.00 0.00 H ATOM 13597 C32 PC 380 111.542 59.569 62.491 1.00 0.00 C ATOM 13598 H2A PC 380 111.243 60.581 62.766 1.00 0.00 H ATOM 13599 H2B PC 380 112.191 59.615 61.615 1.00 0.00 H ATOM 13600 N31 PC 380 112.451 59.170 63.588 1.00 0.00 N ATOM 13601 C33 PC 380 111.771 59.126 64.967 1.00 0.00 C ATOM 13602 H3A PC 380 111.530 60.109 65.376 1.00 0.00 H ATOM 13603 H3B PC 380 112.548 58.650 65.567 1.00 0.00 H ATOM 13604 H3C PC 380 110.872 58.517 64.859 1.00 0.00 H ATOM 13605 C34 PC 380 113.178 57.970 63.212 1.00 0.00 C ATOM 13606 H4A PC 380 113.689 57.533 64.071 1.00 0.00 H ATOM 13607 H4B PC 380 113.852 58.298 62.419 1.00 0.00 H ATOM 13608 H4C PC 380 112.466 57.201 62.908 1.00 0.00 H ATOM 13609 C35 PC 380 113.379 60.299 63.761 1.00 0.00 C ATOM 13610 H5A PC 380 113.950 60.081 64.664 1.00 0.00 H ATOM 13611 H5B PC 380 112.831 61.233 63.628 1.00 0.00 H ATOM 13612 H5C PC 380 114.092 60.158 62.947 1.00 0.00 H ATOM 13613 O33 PC 380 107.977 57.121 62.458 1.00 0.00 O ATOM 13614 O34 PC 380 109.532 55.374 61.560 1.00 0.00 O ATOM 13615 O21 PC 380 110.334 56.671 56.665 1.00 0.00 O ATOM 13616 C21 PC 380 111.614 56.938 56.508 1.00 0.00 C ATOM 13617 O22 PC 380 112.363 57.332 57.423 1.00 0.00 O ATOM 13618 C12 OL 381 112.009 56.695 55.105 1.00 0.00 C ATOM 13619 H2R OL 381 112.992 56.239 54.971 1.00 0.00 H ATOM 13620 H2S OL 381 111.310 56.016 54.612 1.00 0.00 H ATOM 13621 C13 OL 381 112.032 58.013 54.257 1.00 0.00 C ATOM 13622 H3R OL 381 111.268 58.778 54.406 1.00 0.00 H ATOM 13623 H3S OL 381 112.962 58.549 54.462 1.00 0.00 H ATOM 13624 C14 OL 381 111.868 57.753 52.720 1.00 0.00 C ATOM 13625 H4R OL 381 112.712 57.091 52.515 1.00 0.00 H ATOM 13626 H4S OL 381 110.910 57.268 52.519 1.00 0.00 H ATOM 13627 C15 OL 381 112.050 59.061 51.936 1.00 0.00 C ATOM 13628 H5R OL 381 111.240 59.754 52.177 1.00 0.00 H ATOM 13629 H5S OL 381 113.013 59.468 52.251 1.00 0.00 H ATOM 13630 C16 OL 381 112.002 58.847 50.409 1.00 0.00 C ATOM 13631 H6R OL 381 112.926 59.142 49.907 1.00 0.00 H ATOM 13632 H6S OL 381 111.638 57.820 50.339 1.00 0.00 H ATOM 13633 C17 OL 381 110.986 59.709 49.615 1.00 0.00 C ATOM 13634 H7R OL 381 109.985 59.773 50.048 1.00 0.00 H ATOM 13635 H7S OL 381 111.331 60.742 49.699 1.00 0.00 H ATOM 13636 C18 OL 381 110.810 59.380 48.164 1.00 0.00 C ATOM 13637 H8R OL 381 110.282 58.424 48.191 1.00 0.00 H ATOM 13638 H8S OL 381 110.141 60.074 47.652 1.00 0.00 H ATOM 13639 C19 OL 381 112.066 59.410 47.352 1.00 0.00 C ATOM 13640 H9R OL 381 112.660 60.320 47.324 1.00 0.00 H ATOM 13641 C110 OL 381 112.629 58.342 46.847 1.00 0.00 C ATOM 13642 H10R OL 381 113.651 58.459 46.495 1.00 0.00 H ATOM 13643 C111 OL 381 111.953 57.035 46.706 1.00 0.00 C ATOM 13644 H11R OL 381 111.980 56.396 47.591 1.00 0.00 H ATOM 13645 H11S OL 381 110.888 57.204 46.529 1.00 0.00 H ATOM 13646 C112 OL 381 112.618 56.236 45.568 1.00 0.00 C ATOM 13647 H12R OL 381 112.901 57.056 44.904 1.00 0.00 H ATOM 13648 H12S OL 381 113.557 55.831 45.951 1.00 0.00 H ATOM 13649 C113 OL 381 111.695 55.265 44.808 1.00 0.00 C ATOM 13650 H13R OL 381 111.268 54.545 45.509 1.00 0.00 H ATOM 13651 H13S OL 381 110.851 55.893 44.515 1.00 0.00 H ATOM 13652 C114 OL 381 112.347 54.473 43.619 1.00 0.00 C ATOM 13653 H14R OL 381 113.028 53.687 43.955 1.00 0.00 H ATOM 13654 H14S OL 381 111.612 53.854 43.100 1.00 0.00 H ATOM 13655 C115 OL 381 113.015 55.357 42.534 1.00 0.00 C ATOM 13656 H15R OL 381 112.359 56.229 42.508 1.00 0.00 H ATOM 13657 H15S OL 381 113.997 55.705 42.860 1.00 0.00 H ATOM 13658 C116 OL 381 113.249 54.628 41.149 1.00 0.00 C ATOM 13659 H16R OL 381 114.075 53.923 41.266 1.00 0.00 H ATOM 13660 H16S OL 381 112.346 54.078 40.877 1.00 0.00 H ATOM 13661 C117 OL 381 113.545 55.589 40.013 1.00 0.00 C ATOM 13662 H17R OL 381 114.354 56.286 40.240 1.00 0.00 H ATOM 13663 H17S OL 381 113.822 55.010 39.130 1.00 0.00 H ATOM 13664 C118 OL 381 112.391 56.628 39.795 1.00 0.00 C ATOM 13665 H18R OL 381 111.377 56.235 39.691 1.00 0.00 H ATOM 13666 H18S OL 381 112.640 57.294 38.966 1.00 0.00 H ATOM 13667 H18T OL 381 112.444 57.279 40.670 1.00 0.00 H TER 13668 OL 381 ATOM 13668 C116 PA 382 0.293 42.784 38.976 1.00 0.00 C ATOM 13669 H16R PA 382 0.144 41.743 39.270 1.00 0.00 H ATOM 13670 H16S PA 382 0.760 42.735 37.990 1.00 0.00 H ATOM 13671 H16T PA 382 -0.676 43.236 38.754 1.00 0.00 H ATOM 13672 C115 PA 382 1.081 43.481 40.113 1.00 0.00 C ATOM 13673 H15R PA 382 0.472 44.301 40.499 1.00 0.00 H ATOM 13674 H15S PA 382 1.989 43.947 39.724 1.00 0.00 H ATOM 13675 C114 PA 382 1.414 42.569 41.301 1.00 0.00 C ATOM 13676 H14R PA 382 1.995 41.676 41.063 1.00 0.00 H ATOM 13677 H14S PA 382 0.466 42.084 41.544 1.00 0.00 H ATOM 13678 C113 PA 382 1.952 43.149 42.549 1.00 0.00 C ATOM 13679 H13R PA 382 1.325 44.008 42.799 1.00 0.00 H ATOM 13680 H13S PA 382 2.863 43.667 42.244 1.00 0.00 H ATOM 13681 C112 PA 382 2.120 42.124 43.689 1.00 0.00 C ATOM 13682 H12R PA 382 2.707 41.279 43.324 1.00 0.00 H ATOM 13683 H12S PA 382 1.230 41.495 43.746 1.00 0.00 H ATOM 13684 C111 PA 382 2.560 42.630 45.010 1.00 0.00 C ATOM 13685 H11R PA 382 1.966 43.433 45.452 1.00 0.00 H ATOM 13686 H11S PA 382 3.561 43.062 44.940 1.00 0.00 H ATOM 13687 C110 PA 382 2.621 41.481 46.033 1.00 0.00 C ATOM 13688 H10R PA 382 3.621 41.049 45.953 1.00 0.00 H ATOM 13689 H10S PA 382 1.868 40.703 45.892 1.00 0.00 H ATOM 13690 C19 PA 382 2.424 41.813 47.503 1.00 0.00 C ATOM 13691 H9R PA 382 1.389 41.894 47.842 1.00 0.00 H ATOM 13692 H9S PA 382 2.828 42.807 47.704 1.00 0.00 H ATOM 13693 C18 PA 382 2.900 40.790 48.447 1.00 0.00 C ATOM 13694 H8R PA 382 3.884 40.440 48.129 1.00 0.00 H ATOM 13695 H8S PA 382 2.206 39.949 48.508 1.00 0.00 H ATOM 13696 C17 PA 382 2.989 41.414 49.797 1.00 0.00 C ATOM 13697 H7R PA 382 2.003 41.805 50.058 1.00 0.00 H ATOM 13698 H7S PA 382 3.712 42.233 49.811 1.00 0.00 H ATOM 13699 C16 PA 382 3.547 40.545 50.973 1.00 0.00 C ATOM 13700 H6R PA 382 4.540 40.317 50.579 1.00 0.00 H ATOM 13701 H6S PA 382 2.966 39.622 50.925 1.00 0.00 H ATOM 13702 C15 PA 382 3.447 41.098 52.428 1.00 0.00 C ATOM 13703 H5R PA 382 2.412 41.447 52.431 1.00 0.00 H ATOM 13704 H5S PA 382 3.966 42.055 52.508 1.00 0.00 H ATOM 13705 C14 PA 382 3.743 40.179 53.665 1.00 0.00 C ATOM 13706 H4R PA 382 4.828 40.174 53.784 1.00 0.00 H ATOM 13707 H4S PA 382 3.330 39.195 53.433 1.00 0.00 H ATOM 13708 C13 PA 382 3.251 40.717 54.969 1.00 0.00 C ATOM 13709 H3R PA 382 3.681 40.086 55.750 1.00 0.00 H ATOM 13710 H3S PA 382 2.166 40.641 55.074 1.00 0.00 H ATOM 13711 C12 PA 382 3.491 42.226 55.135 1.00 0.00 C ATOM 13712 H2R PA 382 2.786 42.820 54.551 1.00 0.00 H ATOM 13713 H2S PA 382 4.499 42.582 54.909 1.00 0.00 H ATOM 13714 C11 PGR 383 3.188 42.592 56.555 1.00 0.00 C ATOM 13715 O12 PGR 383 2.838 41.870 57.440 1.00 0.00 O ATOM 13716 O11 PGR 383 3.484 43.947 56.701 1.00 0.00 O ATOM 13717 C1 PGR 383 3.599 44.503 58.031 1.00 0.00 C ATOM 13718 HR PGR 383 2.954 44.000 58.757 1.00 0.00 H ATOM 13719 HS PGR 383 3.356 45.568 58.044 1.00 0.00 H ATOM 13720 C2 PGR 383 5.032 44.260 58.568 1.00 0.00 C ATOM 13721 HX PGR 383 5.250 43.192 58.493 1.00 0.00 H ATOM 13722 C3 PGR 383 5.226 44.626 60.134 1.00 0.00 C ATOM 13723 HA PGR 383 4.208 44.684 60.528 1.00 0.00 H ATOM 13724 HB PGR 383 5.698 45.605 60.017 1.00 0.00 H ATOM 13725 O31 PGR 383 6.051 43.667 60.817 1.00 0.00 O ATOM 13726 P31 PGR 383 6.092 43.864 62.387 1.00 0.00 P ATOM 13727 O32 PGR 383 6.873 45.224 62.648 1.00 0.00 O ATOM 13728 C31 PGR 383 8.272 45.335 62.379 1.00 0.00 C ATOM 13729 H1A PGR 383 8.566 45.272 61.329 1.00 0.00 H ATOM 13730 H1B PGR 383 8.754 44.579 63.004 1.00 0.00 H ATOM 13731 C32 PGR 383 8.790 46.713 62.892 1.00 0.00 C ATOM 13732 H2A PGR 383 9.880 46.752 62.956 1.00 0.00 H ATOM 13733 O35 PGR 383 8.381 47.000 64.179 1.00 0.00 O ATOM 13734 HO5A PGR 383 8.683 46.205 64.654 1.00 0.00 H ATOM 13735 C33 PGR 383 8.314 47.848 61.889 1.00 0.00 C ATOM 13736 H3A PGR 383 8.675 48.837 62.182 1.00 0.00 H ATOM 13737 H3B PGR 383 8.650 47.510 60.905 1.00 0.00 H ATOM 13738 O33 PGR 383 4.704 44.183 62.830 1.00 0.00 O ATOM 13739 O34 PGR 383 6.757 42.742 63.069 1.00 0.00 O ATOM 13740 O21 PGR 383 5.852 45.103 57.829 1.00 0.00 O ATOM 13741 C21 PGR 383 7.178 44.858 57.721 1.00 0.00 C ATOM 13742 O22 PGR 383 7.839 43.991 58.292 1.00 0.00 O ATOM 13743 O36 PGR 383 6.877 47.964 61.855 1.00 0.00 O ATOM 13744 HO6A PGR 383 6.682 48.679 61.223 1.00 0.00 H ATOM 13745 C12 OL 384 7.808 45.738 56.678 1.00 0.00 C ATOM 13746 H2R OL 384 8.884 45.646 56.839 1.00 0.00 H ATOM 13747 H2S OL 384 7.508 45.327 55.712 1.00 0.00 H ATOM 13748 C13 OL 384 7.451 47.217 56.826 1.00 0.00 C ATOM 13749 H3R OL 384 7.405 47.468 57.887 1.00 0.00 H ATOM 13750 H3S OL 384 8.279 47.774 56.383 1.00 0.00 H ATOM 13751 C14 OL 384 6.061 47.602 56.242 1.00 0.00 C ATOM 13752 H4R OL 384 5.188 47.023 56.551 1.00 0.00 H ATOM 13753 H4S OL 384 5.841 48.649 56.464 1.00 0.00 H ATOM 13754 C15 OL 384 5.992 47.330 54.775 1.00 0.00 C ATOM 13755 H5R OL 384 6.986 47.622 54.429 1.00 0.00 H ATOM 13756 H5S OL 384 6.078 46.295 54.436 1.00 0.00 H ATOM 13757 C16 OL 384 4.886 48.214 54.066 1.00 0.00 C ATOM 13758 H6R OL 384 3.903 47.877 54.400 1.00 0.00 H ATOM 13759 H6S OL 384 5.021 49.224 54.458 1.00 0.00 H ATOM 13760 C17 OL 384 4.931 48.229 52.545 1.00 0.00 C ATOM 13761 H7R OL 384 4.295 49.066 52.248 1.00 0.00 H ATOM 13762 H7S OL 384 5.925 48.579 52.258 1.00 0.00 H ATOM 13763 C18 OL 384 4.499 46.865 51.912 1.00 0.00 C ATOM 13764 H8R OL 384 5.175 46.030 52.106 1.00 0.00 H ATOM 13765 H8S OL 384 3.529 46.635 52.357 1.00 0.00 H ATOM 13766 C19 OL 384 4.272 47.167 50.494 1.00 0.00 C ATOM 13767 H9R OL 384 3.825 48.137 50.290 1.00 0.00 H ATOM 13768 C110 OL 384 4.603 46.441 49.438 1.00 0.00 C ATOM 13769 H10R OL 384 4.589 46.863 48.437 1.00 0.00 H ATOM 13770 C111 OL 384 5.152 45.060 49.572 1.00 0.00 C ATOM 13771 H11R OL 384 5.933 44.972 50.329 1.00 0.00 H ATOM 13772 H11S OL 384 4.288 44.487 49.916 1.00 0.00 H ATOM 13773 C112 OL 384 5.550 44.658 48.174 1.00 0.00 C ATOM 13774 H12R OL 384 4.685 44.819 47.527 1.00 0.00 H ATOM 13775 H12S OL 384 6.304 45.325 47.750 1.00 0.00 H ATOM 13776 C113 OL 384 6.011 43.233 48.034 1.00 0.00 C ATOM 13777 H13R OL 384 5.110 42.643 48.213 1.00 0.00 H ATOM 13778 H13S OL 384 6.246 43.132 46.972 1.00 0.00 H ATOM 13779 C114 OL 384 7.085 42.727 48.918 1.00 0.00 C ATOM 13780 H14R OL 384 8.027 43.277 48.859 1.00 0.00 H ATOM 13781 H14S OL 384 6.648 42.788 49.917 1.00 0.00 H ATOM 13782 C115 OL 384 7.480 41.279 48.518 1.00 0.00 C ATOM 13783 H15R OL 384 6.562 40.691 48.460 1.00 0.00 H ATOM 13784 H15S OL 384 7.814 41.255 47.478 1.00 0.00 H ATOM 13785 C116 OL 384 8.376 40.561 49.520 1.00 0.00 C ATOM 13786 H16R OL 384 7.892 40.307 50.465 1.00 0.00 H ATOM 13787 H16S OL 384 8.645 39.606 49.064 1.00 0.00 H ATOM 13788 C117 OL 384 9.682 41.273 49.775 1.00 0.00 C ATOM 13789 H17R OL 384 9.427 42.186 50.316 1.00 0.00 H ATOM 13790 H17S OL 384 10.212 40.741 50.569 1.00 0.00 H ATOM 13791 C118 OL 384 10.752 41.351 48.679 1.00 0.00 C ATOM 13792 H18R OL 384 10.327 41.743 47.753 1.00 0.00 H ATOM 13793 H18S OL 384 11.250 40.420 48.399 1.00 0.00 H ATOM 13794 H18T OL 384 11.484 42.077 49.040 1.00 0.00 H TER 13795 OL 384 ATOM 13795 C116 PA 385 70.403 66.889 49.071 1.00 0.00 C ATOM 13796 H16R PA 385 69.705 66.334 49.702 1.00 0.00 H ATOM 13797 H16S PA 385 71.410 66.849 49.490 1.00 0.00 H ATOM 13798 H16T PA 385 70.334 66.383 48.105 1.00 0.00 H ATOM 13799 C115 PA 385 69.948 68.274 48.956 1.00 0.00 C ATOM 13800 H15R PA 385 68.897 68.406 48.691 1.00 0.00 H ATOM 13801 H15S PA 385 70.462 68.704 48.094 1.00 0.00 H ATOM 13802 C114 PA 385 70.312 69.201 50.175 1.00 0.00 C ATOM 13803 H14R PA 385 70.184 68.654 51.111 1.00 0.00 H ATOM 13804 H14S PA 385 69.628 70.050 50.116 1.00 0.00 H ATOM 13805 C113 PA 385 71.851 69.657 50.041 1.00 0.00 C ATOM 13806 H13R PA 385 72.515 68.790 50.043 1.00 0.00 H ATOM 13807 H13S PA 385 72.068 70.272 50.917 1.00 0.00 H ATOM 13808 C112 PA 385 72.192 70.567 48.868 1.00 0.00 C ATOM 13809 H12R PA 385 71.372 71.235 48.597 1.00 0.00 H ATOM 13810 H12S PA 385 72.284 70.021 47.927 1.00 0.00 H ATOM 13811 C111 PA 385 73.404 71.387 49.092 1.00 0.00 C ATOM 13812 H11R PA 385 74.240 70.701 49.242 1.00 0.00 H ATOM 13813 H11S PA 385 73.207 71.860 50.057 1.00 0.00 H ATOM 13814 C110 PA 385 73.619 72.398 47.967 1.00 0.00 C ATOM 13815 H10R PA 385 72.800 73.114 47.878 1.00 0.00 H ATOM 13816 H10S PA 385 73.478 71.977 46.969 1.00 0.00 H ATOM 13817 C19 PA 385 74.850 73.266 48.260 1.00 0.00 C ATOM 13818 H9R PA 385 75.385 73.438 47.323 1.00 0.00 H ATOM 13819 H9S PA 385 75.552 72.813 48.964 1.00 0.00 H ATOM 13820 C18 PA 385 74.611 74.672 48.969 1.00 0.00 C ATOM 13821 H8R PA 385 75.522 75.146 49.342 1.00 0.00 H ATOM 13822 H8S PA 385 74.028 74.578 49.888 1.00 0.00 H ATOM 13823 C17 PA 385 73.917 75.748 48.043 1.00 0.00 C ATOM 13824 H7R PA 385 72.911 75.352 47.894 1.00 0.00 H ATOM 13825 H7S PA 385 74.333 75.867 47.040 1.00 0.00 H ATOM 13826 C16 PA 385 73.684 77.207 48.681 1.00 0.00 C ATOM 13827 H6R PA 385 74.597 77.744 48.943 1.00 0.00 H ATOM 13828 H6S PA 385 73.161 76.995 49.616 1.00 0.00 H ATOM 13829 C15 PA 385 72.742 78.201 47.880 1.00 0.00 C ATOM 13830 H5R PA 385 71.868 77.627 47.563 1.00 0.00 H ATOM 13831 H5S PA 385 73.281 78.488 46.974 1.00 0.00 H ATOM 13832 C14 PA 385 72.302 79.412 48.734 1.00 0.00 C ATOM 13833 H4R PA 385 71.620 79.097 49.527 1.00 0.00 H ATOM 13834 H4S PA 385 71.739 80.066 48.065 1.00 0.00 H ATOM 13835 C13 PA 385 73.426 80.298 49.250 1.00 0.00 C ATOM 13836 H3R PA 385 73.862 80.588 48.291 1.00 0.00 H ATOM 13837 H3S PA 385 74.151 79.698 49.804 1.00 0.00 H ATOM 13838 C12 PA 385 72.987 81.546 50.089 1.00 0.00 C ATOM 13839 H2R PA 385 72.005 81.777 49.671 1.00 0.00 H ATOM 13840 H2S PA 385 73.616 82.393 49.807 1.00 0.00 H ATOM 13841 C11 PGR 386 73.033 81.235 51.568 1.00 0.00 C ATOM 13842 O12 PGR 386 73.977 80.696 52.172 1.00 0.00 O ATOM 13843 O11 PGR 386 71.990 81.707 52.189 1.00 0.00 O ATOM 13844 C1 PGR 386 71.771 81.633 53.578 1.00 0.00 C ATOM 13845 HR PGR 386 72.184 80.673 53.898 1.00 0.00 H ATOM 13846 HS PGR 386 70.693 81.702 53.745 1.00 0.00 H ATOM 13847 C2 PGR 386 72.638 82.660 54.159 1.00 0.00 C ATOM 13848 HX PGR 386 73.695 82.397 54.073 1.00 0.00 H ATOM 13849 C3 PGR 386 72.337 82.996 55.647 1.00 0.00 C ATOM 13850 HA PGR 386 71.283 83.243 55.803 1.00 0.00 H ATOM 13851 HB PGR 386 72.875 83.936 55.798 1.00 0.00 H ATOM 13852 O31 PGR 386 72.591 82.019 56.634 1.00 0.00 O ATOM 13853 P31 PGR 386 74.083 81.450 56.927 1.00 0.00 P ATOM 13854 O32 PGR 386 74.117 80.314 55.769 1.00 0.00 O ATOM 13855 C31 PGR 386 73.588 78.972 55.952 1.00 0.00 C ATOM 13856 H1A PGR 386 74.285 78.645 56.728 1.00 0.00 H ATOM 13857 H1B PGR 386 73.783 78.478 54.997 1.00 0.00 H ATOM 13858 C32 PGR 386 72.141 78.939 56.415 1.00 0.00 C ATOM 13859 H2A PGR 386 71.566 79.812 56.096 1.00 0.00 H ATOM 13860 O35 PGR 386 72.155 78.908 57.882 1.00 0.00 O ATOM 13861 HO5A PGR 386 72.839 79.541 58.166 1.00 0.00 H ATOM 13862 C33 PGR 386 71.373 77.689 55.964 1.00 0.00 C ATOM 13863 H3A PGR 386 71.478 77.509 54.891 1.00 0.00 H ATOM 13864 H3B PGR 386 71.859 76.816 56.408 1.00 0.00 H ATOM 13865 O33 PGR 386 75.133 82.444 56.625 1.00 0.00 O ATOM 13866 O34 PGR 386 74.125 80.692 58.205 1.00 0.00 O ATOM 13867 O21 PGR 386 72.494 83.900 53.418 1.00 0.00 O ATOM 13868 C21 PGR 386 71.263 84.483 53.334 1.00 0.00 C ATOM 13869 O22 PGR 386 70.214 84.099 53.780 1.00 0.00 O ATOM 13870 O36 PGR 386 69.955 77.831 56.178 1.00 0.00 O ATOM 13871 HO6A PGR 386 69.565 78.649 55.822 1.00 0.00 H ATOM 13872 C12 OL 387 71.373 85.784 52.581 1.00 0.00 C ATOM 13873 H2R OL 387 70.719 86.569 52.966 1.00 0.00 H ATOM 13874 H2S OL 387 72.410 86.088 52.742 1.00 0.00 H ATOM 13875 C13 OL 387 71.259 85.482 51.069 1.00 0.00 C ATOM 13876 H3R OL 387 71.685 84.501 50.848 1.00 0.00 H ATOM 13877 H3S OL 387 70.216 85.229 50.867 1.00 0.00 H ATOM 13878 C14 OL 387 71.801 86.566 50.235 1.00 0.00 C ATOM 13879 H4R OL 387 71.279 87.504 50.432 1.00 0.00 H ATOM 13880 H4S OL 387 72.851 86.787 50.439 1.00 0.00 H ATOM 13881 C15 OL 387 71.632 86.414 48.738 1.00 0.00 C ATOM 13882 H5R OL 387 71.988 85.424 48.447 1.00 0.00 H ATOM 13883 H5S OL 387 70.579 86.547 48.481 1.00 0.00 H ATOM 13884 C16 OL 387 72.396 87.472 47.895 1.00 0.00 C ATOM 13885 H6R OL 387 72.536 88.418 48.424 1.00 0.00 H ATOM 13886 H6S OL 387 73.414 87.078 47.866 1.00 0.00 H ATOM 13887 C17 OL 387 71.909 87.591 46.451 1.00 0.00 C ATOM 13888 H7R OL 387 71.009 88.209 46.481 1.00 0.00 H ATOM 13889 H7S OL 387 72.674 88.178 45.940 1.00 0.00 H ATOM 13890 C18 OL 387 71.748 86.242 45.727 1.00 0.00 C ATOM 13891 H8R OL 387 72.348 85.416 46.115 1.00 0.00 H ATOM 13892 H8S OL 387 70.677 86.032 45.763 1.00 0.00 H ATOM 13893 C19 OL 387 72.124 86.377 44.269 1.00 0.00 C ATOM 13894 H9R OL 387 73.173 86.474 44.000 1.00 0.00 H ATOM 13895 C110 OL 387 71.241 86.479 43.198 1.00 0.00 C ATOM 13896 H10R OL 387 71.657 86.666 42.211 1.00 0.00 H ATOM 13897 C111 OL 387 69.796 86.258 43.134 1.00 0.00 C ATOM 13898 H11R OL 387 69.393 85.517 42.441 1.00 0.00 H ATOM 13899 H11S OL 387 69.388 85.961 44.102 1.00 0.00 H ATOM 13900 C112 OL 387 69.090 87.589 42.504 1.00 0.00 C ATOM 13901 H12R OL 387 69.697 87.896 41.650 1.00 0.00 H ATOM 13902 H12S OL 387 68.100 87.205 42.253 1.00 0.00 H ATOM 13903 C113 OL 387 69.033 88.942 43.323 1.00 0.00 C ATOM 13904 H13R OL 387 70.068 89.285 43.380 1.00 0.00 H ATOM 13905 H13S OL 387 68.557 89.693 42.689 1.00 0.00 H ATOM 13906 C114 OL 387 68.349 88.800 44.697 1.00 0.00 C ATOM 13907 H14R OL 387 68.718 87.901 45.196 1.00 0.00 H ATOM 13908 H14S OL 387 68.605 89.685 45.284 1.00 0.00 H ATOM 13909 C115 OL 387 66.847 88.822 44.647 1.00 0.00 C ATOM 13910 H15R OL 387 66.368 89.802 44.601 1.00 0.00 H ATOM 13911 H15S OL 387 66.455 88.253 43.802 1.00 0.00 H ATOM 13912 C116 OL 387 66.221 88.247 45.964 1.00 0.00 C ATOM 13913 H16R OL 387 65.132 88.179 45.911 1.00 0.00 H ATOM 13914 H16S OL 387 66.525 87.210 46.118 1.00 0.00 H ATOM 13915 C117 OL 387 66.572 88.912 47.296 1.00 0.00 C ATOM 13916 H17R OL 387 65.867 88.583 48.062 1.00 0.00 H ATOM 13917 H17S OL 387 67.515 88.536 47.698 1.00 0.00 H ATOM 13918 C118 OL 387 66.657 90.448 47.302 1.00 0.00 C ATOM 13919 H18R OL 387 66.630 90.596 48.383 1.00 0.00 H ATOM 13920 H18S OL 387 65.749 90.725 46.762 1.00 0.00 H ATOM 13921 H18T OL 387 67.574 90.857 46.872 1.00 0.00 H TER 13922 OL 387 ATOM 13922 C116 PA 388 106.319 110.517 44.118 1.00 0.00 C ATOM 13923 H16R PA 388 106.259 110.628 43.033 1.00 0.00 H ATOM 13924 H16S PA 388 107.172 111.009 44.588 1.00 0.00 H ATOM 13925 H16T PA 388 105.327 110.936 44.301 1.00 0.00 H ATOM 13926 C115 PA 388 106.208 109.106 44.630 1.00 0.00 C ATOM 13927 H15R PA 388 107.085 108.546 44.298 1.00 0.00 H ATOM 13928 H15S PA 388 105.285 108.692 44.219 1.00 0.00 H ATOM 13929 C114 PA 388 106.320 108.875 46.137 1.00 0.00 C ATOM 13930 H14R PA 388 105.629 109.596 46.579 1.00 0.00 H ATOM 13931 H14S PA 388 107.325 108.963 46.556 1.00 0.00 H ATOM 13932 C113 PA 388 105.959 107.371 46.476 1.00 0.00 C ATOM 13933 H13R PA 388 106.570 106.730 45.837 1.00 0.00 H ATOM 13934 H13S PA 388 104.974 107.204 46.037 1.00 0.00 H ATOM 13935 C112 PA 388 106.148 106.900 47.960 1.00 0.00 C ATOM 13936 H12R PA 388 105.838 105.856 48.038 1.00 0.00 H ATOM 13937 H12S PA 388 105.424 107.428 48.584 1.00 0.00 H ATOM 13938 C111 PA 388 107.573 107.103 48.494 1.00 0.00 C ATOM 13939 H11R PA 388 107.644 108.183 48.641 1.00 0.00 H ATOM 13940 H11S PA 388 108.378 106.842 47.805 1.00 0.00 H ATOM 13941 C110 PA 388 107.827 106.496 49.864 1.00 0.00 C ATOM 13942 H10R PA 388 107.038 106.766 50.569 1.00 0.00 H ATOM 13943 H10S PA 388 108.781 106.674 50.364 1.00 0.00 H ATOM 13944 C19 PA 388 107.885 104.993 49.688 1.00 0.00 C ATOM 13945 H9R PA 388 108.651 104.751 48.949 1.00 0.00 H ATOM 13946 H9S PA 388 107.010 104.717 49.096 1.00 0.00 H ATOM 13947 C18 PA 388 108.024 104.064 50.875 1.00 0.00 C ATOM 13948 H8R PA 388 108.775 104.482 51.548 1.00 0.00 H ATOM 13949 H8S PA 388 108.347 103.033 50.717 1.00 0.00 H ATOM 13950 C17 PA 388 106.741 104.046 51.748 1.00 0.00 C ATOM 13951 H7R PA 388 105.926 103.680 51.121 1.00 0.00 H ATOM 13952 H7S PA 388 106.464 105.096 51.862 1.00 0.00 H ATOM 13953 C16 PA 388 106.776 103.261 53.028 1.00 0.00 C ATOM 13954 H6R PA 388 107.735 103.253 53.550 1.00 0.00 H ATOM 13955 H6S PA 388 106.646 102.189 52.861 1.00 0.00 H ATOM 13956 C15 PA 388 105.685 103.651 54.009 1.00 0.00 C ATOM 13957 H5R PA 388 104.683 103.694 53.575 1.00 0.00 H ATOM 13958 H5S PA 388 105.824 104.704 54.263 1.00 0.00 H ATOM 13959 C14 PA 388 105.624 102.767 55.229 1.00 0.00 C ATOM 13960 H4R PA 388 106.470 102.792 55.919 1.00 0.00 H ATOM 13961 H4S PA 388 105.443 101.722 54.969 1.00 0.00 H ATOM 13962 C13 PA 388 104.553 103.106 56.251 1.00 0.00 C ATOM 13963 H3R PA 388 104.654 102.517 57.165 1.00 0.00 H ATOM 13964 H3S PA 388 103.539 102.851 55.937 1.00 0.00 H ATOM 13965 C12 PA 388 104.587 104.582 56.695 1.00 0.00 C ATOM 13966 H2R PA 388 104.437 105.259 55.851 1.00 0.00 H ATOM 13967 H2S PA 388 105.587 104.945 56.940 1.00 0.00 H ATOM 13968 C11 PGR 389 103.552 104.855 57.787 1.00 0.00 C ATOM 13969 O12 PGR 389 103.074 103.972 58.421 1.00 0.00 O ATOM 13970 O11 PGR 389 103.339 106.157 57.991 1.00 0.00 O ATOM 13971 C1 PGR 389 102.337 106.577 58.871 1.00 0.00 C ATOM 13972 HR PGR 389 102.792 106.845 59.828 1.00 0.00 H ATOM 13973 HS PGR 389 101.531 105.860 59.049 1.00 0.00 H ATOM 13974 C2 PGR 389 101.756 107.918 58.430 1.00 0.00 C ATOM 13975 HX PGR 389 102.553 108.567 58.057 1.00 0.00 H ATOM 13976 C3 PGR 389 100.937 108.717 59.490 1.00 0.00 C ATOM 13977 HA PGR 389 101.384 108.531 60.471 1.00 0.00 H ATOM 13978 HB PGR 389 99.916 108.328 59.461 1.00 0.00 H ATOM 13979 O31 PGR 389 100.989 110.098 59.324 1.00 0.00 O ATOM 13980 P31 PGR 389 100.424 111.104 60.360 1.00 0.00 P ATOM 13981 O32 PGR 389 98.882 111.083 59.972 1.00 0.00 O ATOM 13982 C31 PGR 389 97.973 110.231 60.712 1.00 0.00 C ATOM 13983 H1A PGR 389 98.494 109.541 61.380 1.00 0.00 H ATOM 13984 H1B PGR 389 97.213 109.735 60.104 1.00 0.00 H ATOM 13985 C32 PGR 389 97.024 110.993 61.657 1.00 0.00 C ATOM 13986 H2A PGR 389 96.324 111.576 61.052 1.00 0.00 H ATOM 13987 O35 PGR 389 97.878 111.817 62.556 1.00 0.00 O ATOM 13988 HO5A PGR 389 98.044 111.418 63.429 1.00 0.00 H ATOM 13989 C33 PGR 389 96.224 110.055 62.543 1.00 0.00 C ATOM 13990 H3A PGR 389 95.763 109.490 61.729 1.00 0.00 H ATOM 13991 H3B PGR 389 96.843 109.399 63.160 1.00 0.00 H ATOM 13992 O33 PGR 389 100.601 110.514 61.699 1.00 0.00 O ATOM 13993 O34 PGR 389 101.057 112.398 60.166 1.00 0.00 O ATOM 13994 O21 PGR 389 101.004 107.730 57.205 1.00 0.00 O ATOM 13995 C21 PGR 389 99.811 107.087 57.086 1.00 0.00 C ATOM 13996 O22 PGR 389 99.230 106.508 57.991 1.00 0.00 O ATOM 13997 O36 PGR 389 95.310 110.811 63.346 1.00 0.00 O ATOM 13998 HO6A PGR 389 94.602 111.122 62.754 1.00 0.00 H ATOM 13999 C12 OL 390 99.391 107.111 55.647 1.00 0.00 C ATOM 14000 H2R OL 390 98.449 107.664 55.644 1.00 0.00 H ATOM 14001 H2S OL 390 100.149 107.615 55.044 1.00 0.00 H ATOM 14002 C13 OL 390 99.342 105.699 54.983 1.00 0.00 C ATOM 14003 H3R OL 390 98.526 105.152 55.458 1.00 0.00 H ATOM 14004 H3S OL 390 98.884 105.894 54.011 1.00 0.00 H ATOM 14005 C14 OL 390 100.519 104.724 54.984 1.00 0.00 C ATOM 14006 H4R OL 390 100.727 104.414 56.010 1.00 0.00 H ATOM 14007 H4S OL 390 100.171 103.822 54.475 1.00 0.00 H ATOM 14008 C15 OL 390 101.734 105.241 54.312 1.00 0.00 C ATOM 14009 H5R OL 390 102.055 106.069 54.948 1.00 0.00 H ATOM 14010 H5S OL 390 102.632 104.622 54.261 1.00 0.00 H ATOM 14011 C16 OL 390 101.559 105.830 52.886 1.00 0.00 C ATOM 14012 H6R OL 390 101.173 106.843 53.017 1.00 0.00 H ATOM 14013 H6S OL 390 102.562 105.936 52.465 1.00 0.00 H ATOM 14014 C17 OL 390 100.821 105.068 51.821 1.00 0.00 C ATOM 14015 H7R OL 390 101.338 104.121 51.652 1.00 0.00 H ATOM 14016 H7S OL 390 99.802 104.847 52.145 1.00 0.00 H ATOM 14017 C18 OL 390 100.750 105.870 50.524 1.00 0.00 C ATOM 14018 H8R OL 390 100.140 105.264 49.850 1.00 0.00 H ATOM 14019 H8S OL 390 100.122 106.753 50.660 1.00 0.00 H ATOM 14020 C19 OL 390 102.093 106.031 49.902 1.00 0.00 C ATOM 14021 H9R OL 390 102.617 106.914 50.260 1.00 0.00 H ATOM 14022 C110 OL 390 102.638 105.234 48.965 1.00 0.00 C ATOM 14023 H10R OL 390 103.667 105.366 48.640 1.00 0.00 H ATOM 14024 C111 OL 390 102.128 103.922 48.396 1.00 0.00 C ATOM 14025 H11R OL 390 101.109 103.741 48.745 1.00 0.00 H ATOM 14026 H11S OL 390 101.972 104.137 47.337 1.00 0.00 H ATOM 14027 C112 OL 390 103.082 102.795 48.737 1.00 0.00 C ATOM 14028 H12R OL 390 102.721 101.937 48.166 1.00 0.00 H ATOM 14029 H12S OL 390 104.068 102.883 48.275 1.00 0.00 H ATOM 14030 C113 OL 390 103.117 102.444 50.180 1.00 0.00 C ATOM 14031 H13R OL 390 103.272 103.330 50.799 1.00 0.00 H ATOM 14032 H13S OL 390 102.084 102.184 50.420 1.00 0.00 H ATOM 14033 C114 OL 390 104.095 101.368 50.611 1.00 0.00 C ATOM 14034 H14R OL 390 104.274 100.606 49.850 1.00 0.00 H ATOM 14035 H14S OL 390 105.138 101.685 50.673 1.00 0.00 H ATOM 14036 C115 OL 390 103.668 100.664 51.934 1.00 0.00 C ATOM 14037 H15R OL 390 104.427 99.928 52.206 1.00 0.00 H ATOM 14038 H15S OL 390 103.516 101.486 52.638 1.00 0.00 H ATOM 14039 C116 OL 390 102.440 99.799 51.963 1.00 0.00 C ATOM 14040 H16R OL 390 101.523 100.270 51.602 1.00 0.00 H ATOM 14041 H16S OL 390 102.595 99.066 51.169 1.00 0.00 H ATOM 14042 C117 OL 390 102.144 98.829 53.139 1.00 0.00 C ATOM 14043 H17R OL 390 101.403 98.117 52.769 1.00 0.00 H ATOM 14044 H17S OL 390 103.020 98.259 53.457 1.00 0.00 H ATOM 14045 C118 OL 390 101.399 99.449 54.247 1.00 0.00 C ATOM 14046 H18R OL 390 100.941 98.698 54.893 1.00 0.00 H ATOM 14047 H18S OL 390 100.583 100.070 53.873 1.00 0.00 H ATOM 14048 H18T OL 390 101.915 100.209 54.838 1.00 0.00 H TER 14049 OL 390 ATOM 14049 C116 PA 391 23.251 45.656 37.386 1.00 0.00 C ATOM 14050 H16R PA 391 23.245 44.806 38.071 1.00 0.00 H ATOM 14051 H16S PA 391 23.876 46.376 37.919 1.00 0.00 H ATOM 14052 H16T PA 391 23.714 45.313 36.459 1.00 0.00 H ATOM 14053 C115 PA 391 21.835 46.233 37.087 1.00 0.00 C ATOM 14054 H15R PA 391 21.424 45.497 36.393 1.00 0.00 H ATOM 14055 H15S PA 391 22.001 47.213 36.635 1.00 0.00 H ATOM 14056 C114 PA 391 20.900 46.316 38.345 1.00 0.00 C ATOM 14057 H14R PA 391 21.031 45.330 38.797 1.00 0.00 H ATOM 14058 H14S PA 391 19.853 46.441 38.061 1.00 0.00 H ATOM 14059 C113 PA 391 21.258 47.413 39.324 1.00 0.00 C ATOM 14060 H13R PA 391 21.377 48.318 38.724 1.00 0.00 H ATOM 14061 H13S PA 391 22.235 47.229 39.775 1.00 0.00 H ATOM 14062 C112 PA 391 20.234 47.737 40.454 1.00 0.00 C ATOM 14063 H12R PA 391 20.295 47.046 41.297 1.00 0.00 H ATOM 14064 H12S PA 391 19.221 47.644 40.057 1.00 0.00 H ATOM 14065 C111 PA 391 20.408 49.163 41.032 1.00 0.00 C ATOM 14066 H11R PA 391 19.527 49.356 41.647 1.00 0.00 H ATOM 14067 H11S PA 391 20.462 49.917 40.244 1.00 0.00 H ATOM 14068 C110 PA 391 21.814 49.540 41.633 1.00 0.00 C ATOM 14069 H10R PA 391 22.630 49.287 40.954 1.00 0.00 H ATOM 14070 H10S PA 391 22.077 48.864 42.449 1.00 0.00 H ATOM 14071 C19 PA 391 21.911 50.919 42.260 1.00 0.00 C ATOM 14072 H9R PA 391 21.861 51.526 41.353 1.00 0.00 H ATOM 14073 H9S PA 391 22.926 50.970 42.659 1.00 0.00 H ATOM 14074 C18 PA 391 20.765 51.215 43.339 1.00 0.00 C ATOM 14075 H8R PA 391 20.617 50.347 43.984 1.00 0.00 H ATOM 14076 H8S PA 391 19.855 51.383 42.760 1.00 0.00 H ATOM 14077 C17 PA 391 21.071 52.432 44.176 1.00 0.00 C ATOM 14078 H7R PA 391 21.262 53.388 43.685 1.00 0.00 H ATOM 14079 H7S PA 391 22.092 52.257 44.524 1.00 0.00 H ATOM 14080 C16 PA 391 20.196 52.589 45.474 1.00 0.00 C ATOM 14081 H6R PA 391 19.742 51.660 45.825 1.00 0.00 H ATOM 14082 H6S PA 391 19.319 53.185 45.216 1.00 0.00 H ATOM 14083 C15 PA 391 20.872 53.236 46.676 1.00 0.00 C ATOM 14084 H5R PA 391 21.347 54.174 46.379 1.00 0.00 H ATOM 14085 H5S PA 391 21.679 52.655 47.129 1.00 0.00 H ATOM 14086 C14 PA 391 19.843 53.533 47.798 1.00 0.00 C ATOM 14087 H4R PA 391 19.080 52.754 47.860 1.00 0.00 H ATOM 14088 H4S PA 391 19.257 54.435 47.608 1.00 0.00 H ATOM 14089 C13 PA 391 20.499 53.817 49.187 1.00 0.00 C ATOM 14090 H3R PA 391 21.147 54.692 49.112 1.00 0.00 H ATOM 14091 H3S PA 391 20.974 52.905 49.553 1.00 0.00 H ATOM 14092 C12 PA 391 19.538 54.321 50.235 1.00 0.00 C ATOM 14093 H2R PA 391 18.871 55.091 49.839 1.00 0.00 H ATOM 14094 H2S PA 391 18.887 53.489 50.512 1.00 0.00 H ATOM 14095 C11 PC 392 20.321 54.829 51.377 1.00 0.00 C ATOM 14096 O12 PC 392 20.396 54.253 52.436 1.00 0.00 O ATOM 14097 O11 PC 392 20.966 56.013 51.194 1.00 0.00 O ATOM 14098 C1 PC 392 21.627 56.650 52.374 1.00 0.00 C ATOM 14099 HR PC 392 20.905 56.492 53.180 1.00 0.00 H ATOM 14100 HS PC 392 21.688 57.733 52.243 1.00 0.00 H ATOM 14101 C2 PC 392 22.987 55.977 52.746 1.00 0.00 C ATOM 14102 HX PC 392 22.821 54.897 52.751 1.00 0.00 H ATOM 14103 C3 PC 392 23.495 56.584 54.155 1.00 0.00 C ATOM 14104 HA PC 392 24.488 56.127 54.165 1.00 0.00 H ATOM 14105 HB PC 392 22.893 56.243 55.001 1.00 0.00 H ATOM 14106 O31 PC 392 23.477 57.962 54.013 1.00 0.00 O ATOM 14107 P31 PC 392 24.155 58.775 55.202 1.00 0.00 P ATOM 14108 O32 PC 392 23.091 58.529 56.387 1.00 0.00 O ATOM 14109 C31 PC 392 21.840 59.068 56.205 1.00 0.00 C ATOM 14110 H1A PC 392 21.378 58.913 55.226 1.00 0.00 H ATOM 14111 H1B PC 392 21.935 60.155 56.269 1.00 0.00 H ATOM 14112 C32 PC 392 20.941 58.648 57.418 1.00 0.00 C ATOM 14113 H2A PC 392 21.569 58.644 58.310 1.00 0.00 H ATOM 14114 H2B PC 392 20.598 57.613 57.432 1.00 0.00 H ATOM 14115 N31 PC 392 19.854 59.585 57.727 1.00 0.00 N ATOM 14116 C33 PC 392 19.005 59.689 56.555 1.00 0.00 C ATOM 14117 H3A PC 392 19.554 60.106 55.709 1.00 0.00 H ATOM 14118 H3B PC 392 18.184 60.304 56.927 1.00 0.00 H ATOM 14119 H3C PC 392 18.549 58.725 56.327 1.00 0.00 H ATOM 14120 C34 PC 392 19.089 58.952 58.822 1.00 0.00 C ATOM 14121 H4A PC 392 18.094 59.395 58.893 1.00 0.00 H ATOM 14122 H4B PC 392 19.664 59.133 59.731 1.00 0.00 H ATOM 14123 H4C PC 392 19.128 57.885 58.597 1.00 0.00 H ATOM 14124 C35 PC 392 20.387 60.938 58.095 1.00 0.00 C ATOM 14125 H5A PC 392 19.509 61.465 58.473 1.00 0.00 H ATOM 14126 H5B PC 392 20.922 61.467 57.305 1.00 0.00 H ATOM 14127 H5C PC 392 21.124 60.919 58.899 1.00 0.00 H ATOM 14128 O33 PC 392 25.416 58.157 55.622 1.00 0.00 O ATOM 14129 O34 PC 392 24.296 60.206 54.853 1.00 0.00 O ATOM 14130 O21 PC 392 23.964 56.344 51.688 1.00 0.00 O ATOM 14131 C21 PC 392 23.988 55.482 50.694 1.00 0.00 C ATOM 14132 O22 PC 392 23.491 54.369 50.681 1.00 0.00 O ATOM 14133 C12 OL 393 24.937 55.941 49.584 1.00 0.00 C ATOM 14134 H2R OL 393 25.956 55.894 49.974 1.00 0.00 H ATOM 14135 H2S OL 393 24.916 55.308 48.694 1.00 0.00 H ATOM 14136 C13 OL 393 24.689 57.374 49.141 1.00 0.00 C ATOM 14137 H3R OL 393 23.660 57.420 48.780 1.00 0.00 H ATOM 14138 H3S OL 393 24.883 57.876 50.091 1.00 0.00 H ATOM 14139 C14 OL 393 25.753 57.851 48.202 1.00 0.00 C ATOM 14140 H4R OL 393 26.686 57.572 48.696 1.00 0.00 H ATOM 14141 H4S OL 393 25.580 57.230 47.321 1.00 0.00 H ATOM 14142 C15 OL 393 25.894 59.327 47.898 1.00 0.00 C ATOM 14143 H5R OL 393 26.768 59.399 47.248 1.00 0.00 H ATOM 14144 H5S OL 393 25.025 59.703 47.354 1.00 0.00 H ATOM 14145 C16 OL 393 26.039 60.144 49.192 1.00 0.00 C ATOM 14146 H6R OL 393 25.223 60.058 49.913 1.00 0.00 H ATOM 14147 H6S OL 393 26.998 59.959 49.679 1.00 0.00 H ATOM 14148 C17 OL 393 26.119 61.723 48.936 1.00 0.00 C ATOM 14149 H7R OL 393 25.272 62.274 48.521 1.00 0.00 H ATOM 14150 H7S OL 393 26.113 62.114 49.956 1.00 0.00 H ATOM 14151 C18 OL 393 27.404 62.113 48.240 1.00 0.00 C ATOM 14152 H8R OL 393 28.315 61.841 48.776 1.00 0.00 H ATOM 14153 H8S OL 393 27.553 61.590 47.293 1.00 0.00 H ATOM 14154 C19 OL 393 27.436 63.590 48.155 1.00 0.00 C ATOM 14155 H9R OL 393 27.015 64.022 49.059 1.00 0.00 H ATOM 14156 C110 OL 393 27.861 64.360 47.195 1.00 0.00 C ATOM 14157 H10R OL 393 27.833 65.442 47.291 1.00 0.00 H ATOM 14158 C111 OL 393 28.546 63.987 45.906 1.00 0.00 C ATOM 14159 H11R OL 393 29.552 64.410 45.867 1.00 0.00 H ATOM 14160 H11S OL 393 28.717 62.917 45.772 1.00 0.00 H ATOM 14161 C112 OL 393 27.666 64.761 44.837 1.00 0.00 C ATOM 14162 H12R OL 393 26.667 64.321 44.853 1.00 0.00 H ATOM 14163 H12S OL 393 27.509 65.793 45.156 1.00 0.00 H ATOM 14164 C113 OL 393 28.131 65.063 43.429 1.00 0.00 C ATOM 14165 H13R OL 393 27.780 65.974 42.941 1.00 0.00 H ATOM 14166 H13S OL 393 29.202 65.275 43.419 1.00 0.00 H ATOM 14167 C114 OL 393 27.840 64.040 42.374 1.00 0.00 C ATOM 14168 H14R OL 393 26.764 64.099 42.201 1.00 0.00 H ATOM 14169 H14S OL 393 28.284 64.385 41.437 1.00 0.00 H ATOM 14170 C115 OL 393 28.387 62.661 42.526 1.00 0.00 C ATOM 14171 H15R OL 393 29.342 62.821 43.031 1.00 0.00 H ATOM 14172 H15S OL 393 27.749 62.135 43.239 1.00 0.00 H ATOM 14173 C116 OL 393 28.436 61.856 41.230 1.00 0.00 C ATOM 14174 H16R OL 393 27.416 61.548 40.988 1.00 0.00 H ATOM 14175 H16S OL 393 28.892 62.457 40.441 1.00 0.00 H ATOM 14176 C117 OL 393 29.320 60.662 41.370 1.00 0.00 C ATOM 14177 H17R OL 393 30.379 60.887 41.510 1.00 0.00 H ATOM 14178 H17S OL 393 29.068 60.221 42.336 1.00 0.00 H ATOM 14179 C118 OL 393 29.016 59.580 40.290 1.00 0.00 C ATOM 14180 H18R OL 393 29.235 59.957 39.289 1.00 0.00 H ATOM 14181 H18S OL 393 27.966 59.286 40.244 1.00 0.00 H ATOM 14182 H18T OL 393 29.556 58.639 40.414 1.00 0.00 H TER 14183 OL 393 ATOM 14183 C116 PA 394 109.117 114.001 42.884 1.00 0.00 C ATOM 14184 H16R PA 394 108.435 114.303 43.681 1.00 0.00 H ATOM 14185 H16S PA 394 109.761 113.246 43.339 1.00 0.00 H ATOM 14186 H16T PA 394 108.402 113.719 42.108 1.00 0.00 H ATOM 14187 C115 PA 394 110.000 115.123 42.368 1.00 0.00 C ATOM 14188 H15R PA 394 109.501 115.927 41.823 1.00 0.00 H ATOM 14189 H15S PA 394 110.581 114.741 41.526 1.00 0.00 H ATOM 14190 C114 PA 394 111.022 115.524 43.493 1.00 0.00 C ATOM 14191 H14R PA 394 111.624 114.644 43.731 1.00 0.00 H ATOM 14192 H14S PA 394 110.405 115.684 44.379 1.00 0.00 H ATOM 14193 C113 PA 394 111.871 116.784 43.172 1.00 0.00 C ATOM 14194 H13R PA 394 111.197 117.528 42.742 1.00 0.00 H ATOM 14195 H13S PA 394 112.486 116.462 42.329 1.00 0.00 H ATOM 14196 C112 PA 394 112.653 117.376 44.265 1.00 0.00 C ATOM 14197 H12R PA 394 113.515 117.903 43.850 1.00 0.00 H ATOM 14198 H12S PA 394 113.121 116.548 44.802 1.00 0.00 H ATOM 14199 C111 PA 394 111.844 118.236 45.320 1.00 0.00 C ATOM 14200 H11R PA 394 111.151 117.468 45.670 1.00 0.00 H ATOM 14201 H11S PA 394 111.243 119.048 44.907 1.00 0.00 H ATOM 14202 C110 PA 394 112.839 118.865 46.386 1.00 0.00 C ATOM 14203 H10R PA 394 113.327 119.754 45.980 1.00 0.00 H ATOM 14204 H10S PA 394 113.527 118.109 46.770 1.00 0.00 H ATOM 14205 C19 PA 394 112.006 119.369 47.616 1.00 0.00 C ATOM 14206 H9R PA 394 111.585 118.507 48.138 1.00 0.00 H ATOM 14207 H9S PA 394 111.067 119.871 47.373 1.00 0.00 H ATOM 14208 C18 PA 394 112.628 120.359 48.601 1.00 0.00 C ATOM 14209 H8R PA 394 111.994 120.488 49.480 1.00 0.00 H ATOM 14210 H8S PA 394 112.554 121.346 48.139 1.00 0.00 H ATOM 14211 C17 PA 394 114.082 120.013 49.121 1.00 0.00 C ATOM 14212 H7R PA 394 114.779 119.933 48.284 1.00 0.00 H ATOM 14213 H7S PA 394 114.142 118.961 49.410 1.00 0.00 H ATOM 14214 C16 PA 394 114.678 120.990 50.030 1.00 0.00 C ATOM 14215 H6R PA 394 114.958 121.945 49.579 1.00 0.00 H ATOM 14216 H6S PA 394 115.684 120.619 50.237 1.00 0.00 H ATOM 14217 C15 PA 394 113.824 121.320 51.283 1.00 0.00 C ATOM 14218 H5R PA 394 113.913 120.489 51.986 1.00 0.00 H ATOM 14219 H5S PA 394 112.776 121.487 51.027 1.00 0.00 H ATOM 14220 C14 PA 394 114.452 122.600 52.025 1.00 0.00 C ATOM 14221 H4R PA 394 114.452 123.406 51.289 1.00 0.00 H ATOM 14222 H4S PA 394 115.492 122.289 52.141 1.00 0.00 H ATOM 14223 C13 PA 394 113.665 122.936 53.296 1.00 0.00 C ATOM 14224 H3R PA 394 113.631 122.033 53.910 1.00 0.00 H ATOM 14225 H3S PA 394 112.613 123.098 53.052 1.00 0.00 H ATOM 14226 C12 PA 394 114.173 124.261 53.863 1.00 0.00 C ATOM 14227 H2R PA 394 113.866 125.140 53.292 1.00 0.00 H ATOM 14228 H2S PA 394 115.262 124.302 53.790 1.00 0.00 H ATOM 14229 C11 PGR 395 113.606 124.593 55.225 1.00 0.00 C ATOM 14230 O12 PGR 395 112.761 123.880 55.742 1.00 0.00 O ATOM 14231 O11 PGR 395 114.187 125.654 55.771 1.00 0.00 O ATOM 14232 C1 PGR 395 113.570 126.153 56.943 1.00 0.00 C ATOM 14233 HR PGR 395 113.571 125.375 57.710 1.00 0.00 H ATOM 14234 HS PGR 395 112.521 126.404 56.770 1.00 0.00 H ATOM 14235 C2 PGR 395 114.458 127.342 57.357 1.00 0.00 C ATOM 14236 HX PGR 395 115.491 126.986 57.373 1.00 0.00 H ATOM 14237 C3 PGR 395 114.098 127.909 58.792 1.00 0.00 C ATOM 14238 HA PGR 395 114.630 128.855 58.918 1.00 0.00 H ATOM 14239 HB PGR 395 114.389 127.104 59.472 1.00 0.00 H ATOM 14240 O31 PGR 395 112.713 128.010 58.934 1.00 0.00 O ATOM 14241 P31 PGR 395 111.981 128.437 60.282 1.00 0.00 P ATOM 14242 O32 PGR 395 112.184 130.089 60.330 1.00 0.00 O ATOM 14243 C31 PGR 395 111.484 131.012 59.600 1.00 0.00 C ATOM 14244 H1A PGR 395 110.567 131.186 60.169 1.00 0.00 H ATOM 14245 H1B PGR 395 111.318 130.637 58.587 1.00 0.00 H ATOM 14246 C32 PGR 395 112.215 132.363 59.408 1.00 0.00 C ATOM 14247 H2A PGR 395 113.002 132.246 58.659 1.00 0.00 H ATOM 14248 O35 PGR 395 112.863 132.560 60.704 1.00 0.00 O ATOM 14249 HO5A PGR 395 113.050 131.649 60.992 1.00 0.00 H ATOM 14250 C33 PGR 395 111.244 133.511 59.036 1.00 0.00 C ATOM 14251 H3A PGR 395 111.007 133.401 57.974 1.00 0.00 H ATOM 14252 H3B PGR 395 110.288 133.415 59.556 1.00 0.00 H ATOM 14253 O33 PGR 395 110.541 128.224 60.109 1.00 0.00 O ATOM 14254 O34 PGR 395 112.571 127.802 61.482 1.00 0.00 O ATOM 14255 O21 PGR 395 114.185 128.331 56.365 1.00 0.00 O ATOM 14256 C21 PGR 395 114.872 129.489 56.226 1.00 0.00 C ATOM 14257 O22 PGR 395 115.777 129.738 56.956 1.00 0.00 O ATOM 14258 O36 PGR 395 111.863 134.792 59.195 1.00 0.00 O ATOM 14259 HO6A PGR 395 112.385 134.647 60.005 1.00 0.00 H ATOM 14260 C12 OL 396 114.525 130.222 54.923 1.00 0.00 C ATOM 14261 H2R OL 396 114.376 131.277 55.161 1.00 0.00 H ATOM 14262 H2S OL 396 115.361 129.983 54.262 1.00 0.00 H ATOM 14263 C13 OL 396 113.250 129.768 54.234 1.00 0.00 C ATOM 14264 H3R OL 396 112.559 129.738 55.079 1.00 0.00 H ATOM 14265 H3S OL 396 113.032 130.541 53.494 1.00 0.00 H ATOM 14266 C14 OL 396 113.293 128.433 53.515 1.00 0.00 C ATOM 14267 H4R OL 396 114.234 128.563 52.976 1.00 0.00 H ATOM 14268 H4S OL 396 113.252 127.583 54.199 1.00 0.00 H ATOM 14269 C15 OL 396 111.997 128.382 52.740 1.00 0.00 C ATOM 14270 H5R OL 396 111.139 128.268 53.405 1.00 0.00 H ATOM 14271 H5S OL 396 111.864 129.351 52.253 1.00 0.00 H ATOM 14272 C16 OL 396 111.964 127.296 51.705 1.00 0.00 C ATOM 14273 H6R OL 396 112.868 127.142 51.113 1.00 0.00 H ATOM 14274 H6S OL 396 111.802 126.344 52.215 1.00 0.00 H ATOM 14275 C17 OL 396 110.753 127.484 50.833 1.00 0.00 C ATOM 14276 H7R OL 396 109.807 127.506 51.379 1.00 0.00 H ATOM 14277 H7S OL 396 110.779 128.441 50.309 1.00 0.00 H ATOM 14278 C18 OL 396 110.559 126.466 49.699 1.00 0.00 C ATOM 14279 H8R OL 396 109.562 126.675 49.306 1.00 0.00 H ATOM 14280 H8S OL 396 111.197 126.699 48.844 1.00 0.00 H ATOM 14281 C19 OL 396 110.830 125.001 49.861 1.00 0.00 C ATOM 14282 H9R OL 396 110.554 124.786 50.890 1.00 0.00 H ATOM 14283 C110 OL 396 111.598 124.129 49.203 1.00 0.00 C ATOM 14284 H10R OL 396 111.738 123.161 49.677 1.00 0.00 H ATOM 14285 C111 OL 396 112.189 124.215 47.852 1.00 0.00 C ATOM 14286 H11R OL 396 111.771 123.373 47.297 1.00 0.00 H ATOM 14287 H11S OL 396 111.947 125.155 47.350 1.00 0.00 H ATOM 14288 C112 OL 396 113.624 124.105 47.916 1.00 0.00 C ATOM 14289 H12R OL 396 114.061 124.924 48.491 1.00 0.00 H ATOM 14290 H12S OL 396 113.758 123.224 48.546 1.00 0.00 H ATOM 14291 C113 OL 396 114.334 123.712 46.633 1.00 0.00 C ATOM 14292 H13R OL 396 115.314 123.268 46.821 1.00 0.00 H ATOM 14293 H13S OL 396 113.797 122.972 46.036 1.00 0.00 H ATOM 14294 C114 OL 396 114.259 124.871 45.673 1.00 0.00 C ATOM 14295 H14R OL 396 113.221 125.210 45.650 1.00 0.00 H ATOM 14296 H14S OL 396 114.681 125.760 46.146 1.00 0.00 H ATOM 14297 C115 OL 396 114.817 124.663 44.295 1.00 0.00 C ATOM 14298 H15R OL 396 115.899 124.513 44.277 1.00 0.00 H ATOM 14299 H15S OL 396 114.411 123.710 43.951 1.00 0.00 H ATOM 14300 C116 OL 396 114.390 125.837 43.461 1.00 0.00 C ATOM 14301 H16R OL 396 113.368 125.576 43.178 1.00 0.00 H ATOM 14302 H16S OL 396 114.092 126.689 44.076 1.00 0.00 H ATOM 14303 C117 OL 396 115.296 126.290 42.272 1.00 0.00 C ATOM 14304 H17R OL 396 115.265 125.477 41.543 1.00 0.00 H ATOM 14305 H17S OL 396 114.736 127.071 41.754 1.00 0.00 H ATOM 14306 C118 OL 396 116.669 126.668 42.598 1.00 0.00 C ATOM 14307 H18R OL 396 117.087 126.944 41.627 1.00 0.00 H ATOM 14308 H18S OL 396 117.306 125.858 42.960 1.00 0.00 H ATOM 14309 H18T OL 396 116.824 127.524 43.257 1.00 0.00 H TER 14310 OL 396 ATOM 14310 C116 PA 397 -4.439 47.667 42.834 1.00 0.00 C ATOM 14311 H16R PA 397 -5.468 47.988 42.660 1.00 0.00 H ATOM 14312 H16S PA 397 -4.420 47.177 43.810 1.00 0.00 H ATOM 14313 H16T PA 397 -4.337 46.819 42.154 1.00 0.00 H ATOM 14314 C115 PA 397 -3.357 48.623 42.578 1.00 0.00 C ATOM 14315 H15R PA 397 -3.585 49.121 41.633 1.00 0.00 H ATOM 14316 H15S PA 397 -2.446 48.049 42.397 1.00 0.00 H ATOM 14317 C114 PA 397 -3.112 49.650 43.641 1.00 0.00 C ATOM 14318 H14R PA 397 -3.881 50.424 43.684 1.00 0.00 H ATOM 14319 H14S PA 397 -2.146 50.126 43.463 1.00 0.00 H ATOM 14320 C113 PA 397 -3.133 49.010 45.044 1.00 0.00 C ATOM 14321 H13R PA 397 -2.630 48.043 44.971 1.00 0.00 H ATOM 14322 H13S PA 397 -4.111 48.843 45.500 1.00 0.00 H ATOM 14323 C112 PA 397 -2.483 49.998 46.006 1.00 0.00 C ATOM 14324 H12R PA 397 -3.032 50.938 45.927 1.00 0.00 H ATOM 14325 H12S PA 397 -1.468 50.229 45.677 1.00 0.00 H ATOM 14326 C111 PA 397 -2.302 49.442 47.403 1.00 0.00 C ATOM 14327 H11R PA 397 -1.927 48.433 47.224 1.00 0.00 H ATOM 14328 H11S PA 397 -3.257 49.319 47.919 1.00 0.00 H ATOM 14329 C110 PA 397 -1.239 50.057 48.289 1.00 0.00 C ATOM 14330 H10R PA 397 -0.998 51.063 47.940 1.00 0.00 H ATOM 14331 H10S PA 397 -0.305 49.494 48.231 1.00 0.00 H ATOM 14332 C19 PA 397 -1.776 50.206 49.709 1.00 0.00 C ATOM 14333 H9R PA 397 -2.486 49.399 49.900 1.00 0.00 H ATOM 14334 H9S PA 397 -2.270 51.172 49.838 1.00 0.00 H ATOM 14335 C18 PA 397 -0.819 49.990 50.870 1.00 0.00 C ATOM 14336 H8R PA 397 0.052 50.566 50.549 1.00 0.00 H ATOM 14337 H8S PA 397 -0.475 48.973 51.067 1.00 0.00 H ATOM 14338 C17 PA 397 -1.476 50.569 52.180 1.00 0.00 C ATOM 14339 H7R PA 397 -2.509 50.214 52.159 1.00 0.00 H ATOM 14340 H7S PA 397 -1.602 51.652 52.114 1.00 0.00 H ATOM 14341 C16 PA 397 -0.813 49.958 53.420 1.00 0.00 C ATOM 14342 H6R PA 397 -0.984 48.880 53.408 1.00 0.00 H ATOM 14343 H6S PA 397 -1.417 50.270 54.274 1.00 0.00 H ATOM 14344 C15 PA 397 0.694 50.246 53.622 1.00 0.00 C ATOM 14345 H5R PA 397 0.929 51.214 53.176 1.00 0.00 H ATOM 14346 H5S PA 397 1.160 49.434 53.060 1.00 0.00 H ATOM 14347 C14 PA 397 1.089 50.259 55.083 1.00 0.00 C ATOM 14348 H4R PA 397 1.215 49.275 55.539 1.00 0.00 H ATOM 14349 H4S PA 397 0.340 50.866 55.596 1.00 0.00 H ATOM 14350 C13 PA 397 2.421 50.942 55.406 1.00 0.00 C ATOM 14351 H3R PA 397 2.373 51.975 55.055 1.00 0.00 H ATOM 14352 H3S PA 397 3.280 50.436 54.960 1.00 0.00 H ATOM 14353 C12 PA 397 2.747 50.789 56.863 1.00 0.00 C ATOM 14354 H2R PA 397 2.981 49.753 57.116 1.00 0.00 H ATOM 14355 H2S PA 397 1.928 50.913 57.575 1.00 0.00 H ATOM 14356 C11 PGR 398 3.881 51.644 57.354 1.00 0.00 C ATOM 14357 O12 PGR 398 4.500 51.298 58.298 1.00 0.00 O ATOM 14358 O11 PGR 398 4.152 52.691 56.547 1.00 0.00 O ATOM 14359 C1 PGR 398 5.009 53.850 57.071 1.00 0.00 C ATOM 14360 HR PGR 398 4.568 54.110 58.037 1.00 0.00 H ATOM 14361 HS PGR 398 4.841 54.651 56.346 1.00 0.00 H ATOM 14362 C2 PGR 398 6.597 53.518 57.231 1.00 0.00 C ATOM 14363 HX PGR 398 6.758 52.630 57.848 1.00 0.00 H ATOM 14364 C3 PGR 398 7.367 54.627 57.920 1.00 0.00 C ATOM 14365 HA PGR 398 7.065 54.827 58.952 1.00 0.00 H ATOM 14366 HB PGR 398 7.243 55.531 57.320 1.00 0.00 H ATOM 14367 O31 PGR 398 8.718 54.240 57.992 1.00 0.00 O ATOM 14368 P31 PGR 398 9.850 55.292 58.059 1.00 0.00 P ATOM 14369 O32 PGR 398 9.590 56.116 56.826 1.00 0.00 O ATOM 14370 C31 PGR 398 9.944 55.640 55.499 1.00 0.00 C ATOM 14371 H1A PGR 398 9.492 54.667 55.286 1.00 0.00 H ATOM 14372 H1B PGR 398 11.023 55.556 55.348 1.00 0.00 H ATOM 14373 C32 PGR 398 9.387 56.674 54.519 1.00 0.00 C ATOM 14374 H2A PGR 398 9.655 56.380 53.501 1.00 0.00 H ATOM 14375 O35 PGR 398 9.985 58.003 54.777 1.00 0.00 O ATOM 14376 HO5A PGR 398 9.533 58.636 54.191 1.00 0.00 H ATOM 14377 C33 PGR 398 7.866 56.724 54.695 1.00 0.00 C ATOM 14378 H3A PGR 398 7.428 55.743 54.498 1.00 0.00 H ATOM 14379 H3B PGR 398 7.505 57.024 55.682 1.00 0.00 H ATOM 14380 O33 PGR 398 9.602 56.316 59.148 1.00 0.00 O ATOM 14381 O34 PGR 398 11.167 54.673 57.928 1.00 0.00 O ATOM 14382 O21 PGR 398 7.132 53.400 55.891 1.00 0.00 O ATOM 14383 C21 PGR 398 7.509 52.126 55.440 1.00 0.00 C ATOM 14384 O22 PGR 398 7.522 51.049 56.020 1.00 0.00 O ATOM 14385 O36 PGR 398 7.344 57.631 53.722 1.00 0.00 O ATOM 14386 HO6A PGR 398 6.474 57.947 54.024 1.00 0.00 H ATOM 14387 C12 OL 399 7.805 52.185 53.916 1.00 0.00 C ATOM 14388 H2R OL 399 8.030 53.236 53.722 1.00 0.00 H ATOM 14389 H2S OL 399 8.711 51.621 53.684 1.00 0.00 H ATOM 14390 C13 OL 399 6.664 51.647 53.067 1.00 0.00 C ATOM 14391 H3R OL 399 7.057 51.540 52.054 1.00 0.00 H ATOM 14392 H3S OL 399 6.216 50.697 53.366 1.00 0.00 H ATOM 14393 C14 OL 399 5.509 52.649 53.005 1.00 0.00 C ATOM 14394 H4R OL 399 5.402 53.084 54.001 1.00 0.00 H ATOM 14395 H4S OL 399 5.742 53.503 52.366 1.00 0.00 H ATOM 14396 C15 OL 399 4.145 52.018 52.551 1.00 0.00 C ATOM 14397 H5R OL 399 3.910 51.074 53.047 1.00 0.00 H ATOM 14398 H5S OL 399 3.397 52.650 53.033 1.00 0.00 H ATOM 14399 C16 OL 399 3.963 51.813 51.010 1.00 0.00 C ATOM 14400 H6R OL 399 4.306 52.755 50.578 1.00 0.00 H ATOM 14401 H6S OL 399 4.563 50.954 50.702 1.00 0.00 H ATOM 14402 C17 OL 399 2.572 51.644 50.649 1.00 0.00 C ATOM 14403 H7R OL 399 2.098 50.787 51.133 1.00 0.00 H ATOM 14404 H7S OL 399 2.028 52.536 50.966 1.00 0.00 H ATOM 14405 C18 OL 399 2.398 51.604 49.143 1.00 0.00 C ATOM 14406 H8R OL 399 3.208 51.040 48.676 1.00 0.00 H ATOM 14407 H8S OL 399 1.506 51.016 48.915 1.00 0.00 H ATOM 14408 C19 OL 399 2.312 52.916 48.418 1.00 0.00 C ATOM 14409 H9R OL 399 2.775 53.693 49.020 1.00 0.00 H ATOM 14410 C110 OL 399 1.785 53.249 47.247 1.00 0.00 C ATOM 14411 H10R OL 399 1.669 54.296 46.978 1.00 0.00 H ATOM 14412 C111 OL 399 1.098 52.402 46.213 1.00 0.00 C ATOM 14413 H11R OL 399 1.150 51.340 46.460 1.00 0.00 H ATOM 14414 H11S OL 399 0.054 52.719 46.155 1.00 0.00 H ATOM 14415 C112 OL 399 1.646 52.595 44.805 1.00 0.00 C ATOM 14416 H12R OL 399 1.627 53.656 44.547 1.00 0.00 H ATOM 14417 H12S OL 399 2.674 52.228 44.780 1.00 0.00 H ATOM 14418 C113 OL 399 0.924 51.735 43.723 1.00 0.00 C ATOM 14419 H13R OL 399 -0.086 52.100 43.524 1.00 0.00 H ATOM 14420 H13S OL 399 1.417 51.866 42.758 1.00 0.00 H ATOM 14421 C114 OL 399 0.977 50.233 43.985 1.00 0.00 C ATOM 14422 H14R OL 399 0.487 49.898 44.902 1.00 0.00 H ATOM 14423 H14S OL 399 0.557 49.803 43.073 1.00 0.00 H ATOM 14424 C115 OL 399 2.439 49.613 43.968 1.00 0.00 C ATOM 14425 H15R OL 399 2.936 50.022 43.085 1.00 0.00 H ATOM 14426 H15S OL 399 3.024 49.899 44.844 1.00 0.00 H ATOM 14427 C116 OL 399 2.494 48.037 43.915 1.00 0.00 C ATOM 14428 H16R OL 399 1.982 47.673 43.022 1.00 0.00 H ATOM 14429 H16S OL 399 3.559 47.830 43.793 1.00 0.00 H ATOM 14430 C117 OL 399 1.940 47.294 45.027 1.00 0.00 C ATOM 14431 H17R OL 399 0.891 47.599 45.021 1.00 0.00 H ATOM 14432 H17S OL 399 2.001 46.259 44.685 1.00 0.00 H ATOM 14433 C118 OL 399 2.573 47.617 46.425 1.00 0.00 C ATOM 14434 H18R OL 399 2.540 48.703 46.535 1.00 0.00 H ATOM 14435 H18S OL 399 3.630 47.340 46.440 1.00 0.00 H ATOM 14436 H18T OL 399 2.180 47.178 47.344 1.00 0.00 H TER 14437 OL 399 ATOM 14437 C116 PA 400 43.475 96.555 35.857 1.00 0.00 C ATOM 14438 H16R PA 400 43.518 95.518 35.520 1.00 0.00 H ATOM 14439 H16S PA 400 44.456 96.956 36.120 1.00 0.00 H ATOM 14440 H16T PA 400 43.210 97.145 34.978 1.00 0.00 H ATOM 14441 C115 PA 400 42.535 96.766 37.064 1.00 0.00 C ATOM 14442 H15R PA 400 41.591 97.125 36.650 1.00 0.00 H ATOM 14443 H15S PA 400 42.748 97.767 37.444 1.00 0.00 H ATOM 14444 C114 PA 400 42.499 95.573 38.057 1.00 0.00 C ATOM 14445 H14R PA 400 43.523 95.639 38.430 1.00 0.00 H ATOM 14446 H14S PA 400 42.344 94.586 37.618 1.00 0.00 H ATOM 14447 C113 PA 400 41.679 95.786 39.316 1.00 0.00 C ATOM 14448 H13R PA 400 40.587 95.798 39.312 1.00 0.00 H ATOM 14449 H13S PA 400 42.043 96.735 39.715 1.00 0.00 H ATOM 14450 C112 PA 400 41.997 94.671 40.349 1.00 0.00 C ATOM 14451 H12R PA 400 43.049 94.799 40.614 1.00 0.00 H ATOM 14452 H12S PA 400 41.827 93.689 39.901 1.00 0.00 H ATOM 14453 C111 PA 400 41.245 94.674 41.568 1.00 0.00 C ATOM 14454 H11R PA 400 41.755 93.916 42.167 1.00 0.00 H ATOM 14455 H11S PA 400 40.187 94.502 41.361 1.00 0.00 H ATOM 14456 C110 PA 400 41.289 96.077 42.261 1.00 0.00 C ATOM 14457 H10R PA 400 40.559 96.765 41.828 1.00 0.00 H ATOM 14458 H10S PA 400 42.270 96.506 42.050 1.00 0.00 H ATOM 14459 C19 PA 400 40.956 96.124 43.761 1.00 0.00 C ATOM 14460 H9R PA 400 41.700 95.451 44.195 1.00 0.00 H ATOM 14461 H9S PA 400 39.978 95.645 43.844 1.00 0.00 H ATOM 14462 C18 PA 400 41.006 97.441 44.523 1.00 0.00 C ATOM 14463 H8R PA 400 40.273 98.106 44.061 1.00 0.00 H ATOM 14464 H8S PA 400 42.015 97.849 44.607 1.00 0.00 H ATOM 14465 C17 PA 400 40.580 97.310 45.996 1.00 0.00 C ATOM 14466 H7R PA 400 40.587 96.273 46.340 1.00 0.00 H ATOM 14467 H7S PA 400 39.499 97.460 46.032 1.00 0.00 H ATOM 14468 C16 PA 400 41.490 98.031 47.099 1.00 0.00 C ATOM 14469 H6R PA 400 41.976 98.922 46.697 1.00 0.00 H ATOM 14470 H6S PA 400 42.313 97.315 47.059 1.00 0.00 H ATOM 14471 C15 PA 400 40.886 98.155 48.469 1.00 0.00 C ATOM 14472 H5R PA 400 40.889 97.093 48.723 1.00 0.00 H ATOM 14473 H5S PA 400 39.853 98.499 48.378 1.00 0.00 H ATOM 14474 C14 PA 400 41.805 98.922 49.360 1.00 0.00 C ATOM 14475 H4R PA 400 41.856 99.913 48.904 1.00 0.00 H ATOM 14476 H4S PA 400 42.770 98.420 49.460 1.00 0.00 H ATOM 14477 C13 PA 400 41.438 98.981 50.799 1.00 0.00 C ATOM 14478 H3R PA 400 41.277 98.009 51.270 1.00 0.00 H ATOM 14479 H3S PA 400 40.403 99.322 50.863 1.00 0.00 H ATOM 14480 C12 PA 400 42.386 99.799 51.707 1.00 0.00 C ATOM 14481 H2R PA 400 43.309 99.266 51.945 1.00 0.00 H ATOM 14482 H2S PA 400 42.828 100.606 51.120 1.00 0.00 H ATOM 14483 C11 PC 401 41.913 100.309 53.016 1.00 0.00 C ATOM 14484 O12 PC 401 41.043 99.727 53.675 1.00 0.00 O ATOM 14485 O11 PC 401 42.611 101.396 53.406 1.00 0.00 O ATOM 14486 C1 PC 401 42.142 102.066 54.579 1.00 0.00 C ATOM 14487 HR PC 401 42.832 101.613 55.295 1.00 0.00 H ATOM 14488 HS PC 401 41.122 101.805 54.872 1.00 0.00 H ATOM 14489 C2 PC 401 42.394 103.559 54.552 1.00 0.00 C ATOM 14490 HX PC 401 43.478 103.627 54.429 1.00 0.00 H ATOM 14491 C3 PC 401 41.874 104.295 55.833 1.00 0.00 C ATOM 14492 HA PC 401 42.204 105.335 55.758 1.00 0.00 H ATOM 14493 HB PC 401 42.357 103.786 56.671 1.00 0.00 H ATOM 14494 O31 PC 401 40.508 104.109 55.925 1.00 0.00 O ATOM 14495 P31 PC 401 39.691 104.978 56.919 1.00 0.00 P ATOM 14496 O32 PC 401 40.198 106.369 56.612 1.00 0.00 O ATOM 14497 C31 PC 401 39.756 107.078 55.532 1.00 0.00 C ATOM 14498 H1A PC 401 38.780 107.516 55.754 1.00 0.00 H ATOM 14499 H1B PC 401 39.708 106.441 54.645 1.00 0.00 H ATOM 14500 C32 PC 401 40.946 108.089 55.339 1.00 0.00 C ATOM 14501 H2A PC 401 41.024 108.409 54.299 1.00 0.00 H ATOM 14502 H2B PC 401 41.817 107.536 55.696 1.00 0.00 H ATOM 14503 N31 PC 401 40.932 109.259 56.190 1.00 0.00 N ATOM 14504 C33 PC 401 41.078 109.037 57.675 1.00 0.00 C ATOM 14505 H3A PC 401 40.854 109.875 58.336 1.00 0.00 H ATOM 14506 H3B PC 401 42.101 108.811 57.980 1.00 0.00 H ATOM 14507 H3C PC 401 40.361 108.243 57.886 1.00 0.00 H ATOM 14508 C34 PC 401 42.128 110.086 55.680 1.00 0.00 C ATOM 14509 H4A PC 401 43.093 109.577 55.642 1.00 0.00 H ATOM 14510 H4B PC 401 42.276 110.824 56.469 1.00 0.00 H ATOM 14511 H4C PC 401 41.769 110.561 54.766 1.00 0.00 H ATOM 14512 C35 PC 401 39.669 110.015 56.010 1.00 0.00 C ATOM 14513 H5A PC 401 39.506 110.199 54.947 1.00 0.00 H ATOM 14514 H5B PC 401 39.716 110.966 56.542 1.00 0.00 H ATOM 14515 H5C PC 401 38.835 109.414 56.376 1.00 0.00 H ATOM 14516 O33 PC 401 38.252 104.916 56.580 1.00 0.00 O ATOM 14517 O34 PC 401 40.053 104.676 58.324 1.00 0.00 O ATOM 14518 O21 PC 401 41.548 104.167 53.530 1.00 0.00 O ATOM 14519 C21 PC 401 41.874 105.419 53.079 1.00 0.00 C ATOM 14520 O22 PC 401 42.793 106.051 53.567 1.00 0.00 O ATOM 14521 C12 OL 402 41.045 105.960 51.914 1.00 0.00 C ATOM 14522 H2R OL 402 39.997 105.659 51.978 1.00 0.00 H ATOM 14523 H2S OL 402 41.053 107.049 52.003 1.00 0.00 H ATOM 14524 C13 OL 402 41.716 105.608 50.598 1.00 0.00 C ATOM 14525 H3R OL 402 41.180 106.269 49.914 1.00 0.00 H ATOM 14526 H3S OL 402 42.722 106.034 50.600 1.00 0.00 H ATOM 14527 C14 OL 402 41.649 104.170 50.071 1.00 0.00 C ATOM 14528 H4R OL 402 42.237 103.460 50.656 1.00 0.00 H ATOM 14529 H4S OL 402 40.659 103.745 50.249 1.00 0.00 H ATOM 14530 C15 OL 402 42.071 104.042 48.570 1.00 0.00 C ATOM 14531 H5R OL 402 41.449 104.646 47.907 1.00 0.00 H ATOM 14532 H5S OL 402 43.054 104.434 48.300 1.00 0.00 H ATOM 14533 C16 OL 402 42.050 102.638 48.176 1.00 0.00 C ATOM 14534 H6R OL 402 42.694 102.248 48.968 1.00 0.00 H ATOM 14535 H6S OL 402 41.033 102.246 48.244 1.00 0.00 H ATOM 14536 C17 OL 402 42.529 102.289 46.735 1.00 0.00 C ATOM 14537 H7R OL 402 43.119 103.146 46.403 1.00 0.00 H ATOM 14538 H7S OL 402 43.220 101.450 46.842 1.00 0.00 H ATOM 14539 C18 OL 402 41.505 102.008 45.683 1.00 0.00 C ATOM 14540 H8R OL 402 40.892 101.107 45.744 1.00 0.00 H ATOM 14541 H8S OL 402 40.796 102.826 45.828 1.00 0.00 H ATOM 14542 C19 OL 402 41.949 102.236 44.289 1.00 0.00 C ATOM 14543 H9R OL 402 41.321 102.990 43.820 1.00 0.00 H ATOM 14544 C110 OL 402 42.900 101.632 43.581 1.00 0.00 C ATOM 14545 H10R OL 402 43.030 101.986 42.562 1.00 0.00 H ATOM 14546 C111 OL 402 43.882 100.582 43.970 1.00 0.00 C ATOM 14547 H11R OL 402 44.888 100.880 44.272 1.00 0.00 H ATOM 14548 H11S OL 402 43.570 100.143 44.920 1.00 0.00 H ATOM 14549 C112 OL 402 43.797 99.518 42.883 1.00 0.00 C ATOM 14550 H12R OL 402 42.780 99.123 42.853 1.00 0.00 H ATOM 14551 H12S OL 402 43.947 100.085 41.961 1.00 0.00 H ATOM 14552 C113 OL 402 44.764 98.344 42.954 1.00 0.00 C ATOM 14553 H13R OL 402 44.448 97.734 43.803 1.00 0.00 H ATOM 14554 H13S OL 402 44.662 97.714 42.068 1.00 0.00 H ATOM 14555 C114 OL 402 46.250 98.667 43.173 1.00 0.00 C ATOM 14556 H14R OL 402 46.654 99.242 42.337 1.00 0.00 H ATOM 14557 H14S OL 402 46.417 99.336 44.019 1.00 0.00 H ATOM 14558 C115 OL 402 47.241 97.519 43.292 1.00 0.00 C ATOM 14559 H15R OL 402 47.616 97.229 42.308 1.00 0.00 H ATOM 14560 H15S OL 402 48.181 97.809 43.767 1.00 0.00 H ATOM 14561 C116 OL 402 46.688 96.302 43.881 1.00 0.00 C ATOM 14562 H16R OL 402 46.446 96.593 44.906 1.00 0.00 H ATOM 14563 H16S OL 402 45.855 95.955 43.266 1.00 0.00 H ATOM 14564 C117 OL 402 47.548 95.098 44.096 1.00 0.00 C ATOM 14565 H17R OL 402 48.172 95.345 44.958 1.00 0.00 H ATOM 14566 H17S OL 402 46.875 94.247 44.213 1.00 0.00 H ATOM 14567 C118 OL 402 48.546 94.752 43.001 1.00 0.00 C ATOM 14568 H18R OL 402 49.358 95.470 42.864 1.00 0.00 H ATOM 14569 H18S OL 402 47.985 94.691 42.066 1.00 0.00 H ATOM 14570 H18T OL 402 48.968 93.748 43.081 1.00 0.00 H TER 14571 OL 402 ATOM 14571 C116 PA 403 42.450 114.100 37.185 1.00 0.00 C ATOM 14572 H16R PA 403 43.070 113.201 37.208 1.00 0.00 H ATOM 14573 H16S PA 403 43.185 114.903 37.093 1.00 0.00 H ATOM 14574 H16T PA 403 41.843 114.147 36.279 1.00 0.00 H ATOM 14575 C115 PA 403 41.654 114.523 38.362 1.00 0.00 C ATOM 14576 H15R PA 403 42.254 114.429 39.270 1.00 0.00 H ATOM 14577 H15S PA 403 40.800 113.859 38.513 1.00 0.00 H ATOM 14578 C114 PA 403 41.189 115.930 38.255 1.00 0.00 C ATOM 14579 H14R PA 403 40.350 115.945 37.555 1.00 0.00 H ATOM 14580 H14S PA 403 41.951 116.593 37.842 1.00 0.00 H ATOM 14581 C113 PA 403 40.636 116.543 39.461 1.00 0.00 C ATOM 14582 H13R PA 403 41.401 116.415 40.230 1.00 0.00 H ATOM 14583 H13S PA 403 39.836 115.914 39.857 1.00 0.00 H ATOM 14584 C112 PA 403 40.328 118.055 39.338 1.00 0.00 C ATOM 14585 H12R PA 403 39.637 118.335 38.540 1.00 0.00 H ATOM 14586 H12S PA 403 41.235 118.615 39.102 1.00 0.00 H ATOM 14587 C111 PA 403 39.710 118.491 40.656 1.00 0.00 C ATOM 14588 H11R PA 403 38.658 118.196 40.642 1.00 0.00 H ATOM 14589 H11S PA 403 39.706 119.580 40.578 1.00 0.00 H ATOM 14590 C110 PA 403 40.231 117.909 41.990 1.00 0.00 C ATOM 14591 H10R PA 403 41.294 118.102 42.148 1.00 0.00 H ATOM 14592 H10S PA 403 40.203 116.819 41.930 1.00 0.00 H ATOM 14593 C19 PA 403 39.495 118.317 43.262 1.00 0.00 C ATOM 14594 H9R PA 403 38.434 118.087 43.144 1.00 0.00 H ATOM 14595 H9S PA 403 39.513 119.400 43.405 1.00 0.00 H ATOM 14596 C18 PA 403 39.970 117.469 44.486 1.00 0.00 C ATOM 14597 H8R PA 403 40.251 116.467 44.155 1.00 0.00 H ATOM 14598 H8S PA 403 39.212 117.401 45.270 1.00 0.00 H ATOM 14599 C17 PA 403 41.177 118.080 45.102 1.00 0.00 C ATOM 14600 H7R PA 403 41.052 119.163 45.034 1.00 0.00 H ATOM 14601 H7S PA 403 42.045 117.718 44.546 1.00 0.00 H ATOM 14602 C16 PA 403 41.308 117.981 46.614 1.00 0.00 C ATOM 14603 H6R PA 403 41.037 116.976 46.943 1.00 0.00 H ATOM 14604 H6S PA 403 40.626 118.650 47.144 1.00 0.00 H ATOM 14605 C15 PA 403 42.665 118.282 47.141 1.00 0.00 C ATOM 14606 H5R PA 403 43.025 119.290 46.923 1.00 0.00 H ATOM 14607 H5S PA 403 43.367 117.561 46.717 1.00 0.00 H ATOM 14608 C14 PA 403 42.708 118.221 48.600 1.00 0.00 C ATOM 14609 H4R PA 403 42.290 117.289 48.986 1.00 0.00 H ATOM 14610 H4S PA 403 42.121 119.084 48.923 1.00 0.00 H ATOM 14611 C13 PA 403 44.149 118.215 49.078 1.00 0.00 C ATOM 14612 H3R PA 403 44.524 119.170 48.702 1.00 0.00 H ATOM 14613 H3S PA 403 44.704 117.417 48.581 1.00 0.00 H ATOM 14614 C12 PA 403 44.327 118.046 50.512 1.00 0.00 C ATOM 14615 H2R PA 403 45.378 117.752 50.545 1.00 0.00 H ATOM 14616 H2S PA 403 43.756 117.244 50.983 1.00 0.00 H ATOM 14617 C11 PGR 404 44.080 119.284 51.259 1.00 0.00 C ATOM 14618 O12 PGR 404 44.778 120.308 51.190 1.00 0.00 O ATOM 14619 O11 PGR 404 43.011 119.167 52.040 1.00 0.00 O ATOM 14620 C1 PGR 404 42.484 120.375 52.661 1.00 0.00 C ATOM 14621 HR PGR 404 42.553 121.281 52.053 1.00 0.00 H ATOM 14622 HS PGR 404 43.058 120.440 53.588 1.00 0.00 H ATOM 14623 C2 PGR 404 41.049 120.122 53.107 1.00 0.00 C ATOM 14624 HX PGR 404 40.726 120.837 53.868 1.00 0.00 H ATOM 14625 C3 PGR 404 40.970 118.701 53.761 1.00 0.00 C ATOM 14626 HA PGR 404 41.880 118.469 54.319 1.00 0.00 H ATOM 14627 HB PGR 404 40.894 117.975 52.947 1.00 0.00 H ATOM 14628 O31 PGR 404 39.824 118.547 54.562 1.00 0.00 O ATOM 14629 P31 PGR 404 39.580 117.221 55.478 1.00 0.00 P ATOM 14630 O32 PGR 404 38.329 116.454 54.734 1.00 0.00 O ATOM 14631 C31 PGR 404 38.408 116.004 53.370 1.00 0.00 C ATOM 14632 H1A PGR 404 39.095 115.175 53.185 1.00 0.00 H ATOM 14633 H1B PGR 404 38.742 116.916 52.868 1.00 0.00 H ATOM 14634 C32 PGR 404 37.054 115.605 52.892 1.00 0.00 C ATOM 14635 H2A PGR 404 36.285 116.382 52.913 1.00 0.00 H ATOM 14636 O35 PGR 404 36.665 114.468 53.668 1.00 0.00 O ATOM 14637 HO5A PGR 404 36.414 114.843 54.531 1.00 0.00 H ATOM 14638 C33 PGR 404 37.098 114.998 51.407 1.00 0.00 C ATOM 14639 H3A PGR 404 36.207 114.384 51.253 1.00 0.00 H ATOM 14640 H3B PGR 404 37.199 115.867 50.752 1.00 0.00 H ATOM 14641 O33 PGR 404 40.776 116.313 55.403 1.00 0.00 O ATOM 14642 O34 PGR 404 39.193 117.710 56.836 1.00 0.00 O ATOM 14643 O21 PGR 404 40.138 120.094 52.044 1.00 0.00 O ATOM 14644 C21 PGR 404 39.762 121.284 51.490 1.00 0.00 C ATOM 14645 O22 PGR 404 40.087 122.407 51.865 1.00 0.00 O ATOM 14646 O36 PGR 404 38.309 114.220 51.292 1.00 0.00 O ATOM 14647 HO6A PGR 404 38.092 113.271 51.311 1.00 0.00 H ATOM 14648 C12 OL 405 38.743 121.151 50.360 1.00 0.00 C ATOM 14649 H2R OL 405 37.858 121.010 50.985 1.00 0.00 H ATOM 14650 H2S OL 405 38.662 122.139 49.902 1.00 0.00 H ATOM 14651 C13 OL 405 39.028 119.909 49.523 1.00 0.00 C ATOM 14652 H3R OL 405 40.025 120.041 49.099 1.00 0.00 H ATOM 14653 H3S OL 405 39.063 119.066 50.216 1.00 0.00 H ATOM 14654 C14 OL 405 38.189 119.580 48.343 1.00 0.00 C ATOM 14655 H4R OL 405 38.620 118.666 47.928 1.00 0.00 H ATOM 14656 H4S OL 405 37.293 119.221 48.853 1.00 0.00 H ATOM 14657 C15 OL 405 38.088 120.729 47.366 1.00 0.00 C ATOM 14658 H5R OL 405 37.689 121.672 47.747 1.00 0.00 H ATOM 14659 H5S OL 405 38.978 121.067 46.831 1.00 0.00 H ATOM 14660 C16 OL 405 37.136 120.320 46.177 1.00 0.00 C ATOM 14661 H6R OL 405 37.499 119.389 45.736 1.00 0.00 H ATOM 14662 H6S OL 405 36.103 120.088 46.446 1.00 0.00 H ATOM 14663 C17 OL 405 37.025 121.320 45.062 1.00 0.00 C ATOM 14664 H7R OL 405 36.619 122.294 45.341 1.00 0.00 H ATOM 14665 H7S OL 405 38.018 121.584 44.692 1.00 0.00 H ATOM 14666 C18 OL 405 36.152 120.874 43.949 1.00 0.00 C ATOM 14667 H8R OL 405 36.065 121.703 43.243 1.00 0.00 H ATOM 14668 H8S OL 405 36.759 120.151 43.401 1.00 0.00 H ATOM 14669 C19 OL 405 34.882 120.270 44.321 1.00 0.00 C ATOM 14670 H9R OL 405 34.602 120.451 45.355 1.00 0.00 H ATOM 14671 C110 OL 405 34.049 119.566 43.543 1.00 0.00 C ATOM 14672 H10R OL 405 33.124 119.282 44.038 1.00 0.00 H ATOM 14673 C111 OL 405 34.188 119.320 42.045 1.00 0.00 C ATOM 14674 H11R OL 405 35.213 119.336 41.670 1.00 0.00 H ATOM 14675 H11S OL 405 33.753 118.352 41.788 1.00 0.00 H ATOM 14676 C112 OL 405 33.315 120.419 41.284 1.00 0.00 C ATOM 14677 H12R OL 405 32.308 120.000 41.331 1.00 0.00 H ATOM 14678 H12S OL 405 33.273 121.352 41.850 1.00 0.00 H ATOM 14679 C113 OL 405 33.578 120.865 39.796 1.00 0.00 C ATOM 14680 H13R OL 405 32.834 121.602 39.487 1.00 0.00 H ATOM 14681 H13S OL 405 34.446 121.524 39.733 1.00 0.00 H ATOM 14682 C114 OL 405 33.743 119.844 38.738 1.00 0.00 C ATOM 14683 H14R OL 405 34.744 119.415 38.654 1.00 0.00 H ATOM 14684 H14S OL 405 33.026 119.025 38.647 1.00 0.00 H ATOM 14685 C115 OL 405 33.658 120.456 37.369 1.00 0.00 C ATOM 14686 H15R OL 405 34.238 121.381 37.406 1.00 0.00 H ATOM 14687 H15S OL 405 34.266 119.876 36.672 1.00 0.00 H ATOM 14688 C116 OL 405 32.245 120.839 36.821 1.00 0.00 C ATOM 14689 H16R OL 405 31.642 119.932 36.756 1.00 0.00 H ATOM 14690 H16S OL 405 31.705 121.462 37.537 1.00 0.00 H ATOM 14691 C117 OL 405 32.265 121.520 35.526 1.00 0.00 C ATOM 14692 H17R OL 405 33.281 121.495 35.126 1.00 0.00 H ATOM 14693 H17S OL 405 31.701 120.900 34.826 1.00 0.00 H ATOM 14694 C118 OL 405 31.776 122.950 35.533 1.00 0.00 C ATOM 14695 H18R OL 405 32.340 123.611 36.195 1.00 0.00 H ATOM 14696 H18S OL 405 30.727 123.118 35.783 1.00 0.00 H ATOM 14697 H18T OL 405 31.850 123.546 34.621 1.00 0.00 H TER 14698 OL 405 ATOM 14698 C116 PA 406 78.035 8.355 42.095 1.00 0.00 C ATOM 14699 H16R PA 406 79.068 8.018 42.200 1.00 0.00 H ATOM 14700 H16S PA 406 77.833 8.373 41.022 1.00 0.00 H ATOM 14701 H16T PA 406 77.402 7.519 42.400 1.00 0.00 H ATOM 14702 C115 PA 406 77.758 9.707 42.932 1.00 0.00 C ATOM 14703 H15R PA 406 78.515 10.453 42.680 1.00 0.00 H ATOM 14704 H15S PA 406 77.771 9.453 43.994 1.00 0.00 H ATOM 14705 C114 PA 406 76.358 10.309 42.565 1.00 0.00 C ATOM 14706 H14R PA 406 75.533 9.718 42.966 1.00 0.00 H ATOM 14707 H14S PA 406 76.253 10.306 41.478 1.00 0.00 H ATOM 14708 C113 PA 406 76.231 11.757 42.918 1.00 0.00 C ATOM 14709 H13R PA 406 75.239 11.994 42.529 1.00 0.00 H ATOM 14710 H13S PA 406 76.935 12.329 42.310 1.00 0.00 H ATOM 14711 C112 PA 406 76.456 12.038 44.390 1.00 0.00 C ATOM 14712 H12R PA 406 77.301 11.474 44.792 1.00 0.00 H ATOM 14713 H12S PA 406 75.486 11.777 44.817 1.00 0.00 H ATOM 14714 C111 PA 406 76.539 13.536 44.599 1.00 0.00 C ATOM 14715 H11R PA 406 75.898 14.106 43.924 1.00 0.00 H ATOM 14716 H11S PA 406 77.579 13.804 44.400 1.00 0.00 H ATOM 14717 C110 PA 406 76.113 14.024 45.963 1.00 0.00 C ATOM 14718 H10R PA 406 75.118 13.598 46.108 1.00 0.00 H ATOM 14719 H10S PA 406 76.068 15.115 45.970 1.00 0.00 H ATOM 14720 C19 PA 406 77.089 13.715 47.154 1.00 0.00 C ATOM 14721 H9R PA 406 78.019 14.274 47.035 1.00 0.00 H ATOM 14722 H9S PA 406 77.324 12.653 47.244 1.00 0.00 H ATOM 14723 C18 PA 406 76.463 14.144 48.612 1.00 0.00 C ATOM 14724 H8R PA 406 75.546 13.626 48.902 1.00 0.00 H ATOM 14725 H8S PA 406 76.108 15.177 48.587 1.00 0.00 H ATOM 14726 C17 PA 406 77.501 14.118 49.679 1.00 0.00 C ATOM 14727 H7R PA 406 78.058 15.055 49.609 1.00 0.00 H ATOM 14728 H7S PA 406 78.256 13.330 49.635 1.00 0.00 H ATOM 14729 C16 PA 406 76.741 14.221 51.009 1.00 0.00 C ATOM 14730 H6R PA 406 75.832 13.622 51.087 1.00 0.00 H ATOM 14731 H6S PA 406 76.330 15.227 51.114 1.00 0.00 H ATOM 14732 C15 PA 406 77.606 14.021 52.188 1.00 0.00 C ATOM 14733 H5R PA 406 78.274 14.883 52.142 1.00 0.00 H ATOM 14734 H5S PA 406 78.109 13.060 52.061 1.00 0.00 H ATOM 14735 C14 PA 406 76.768 14.047 53.485 1.00 0.00 C ATOM 14736 H4R PA 406 75.941 13.334 53.454 1.00 0.00 H ATOM 14737 H4S PA 406 76.226 14.989 53.383 1.00 0.00 H ATOM 14738 C13 PA 406 77.578 14.003 54.766 1.00 0.00 C ATOM 14739 H3R PA 406 76.835 14.285 55.514 1.00 0.00 H ATOM 14740 H3S PA 406 78.296 14.823 54.845 1.00 0.00 H ATOM 14741 C12 PA 406 78.239 12.678 55.275 1.00 0.00 C ATOM 14742 H2R PA 406 78.985 12.286 54.579 1.00 0.00 H ATOM 14743 H2S PA 406 77.493 11.923 55.530 1.00 0.00 H ATOM 14744 C11 PGR 407 79.081 13.086 56.490 1.00 0.00 C ATOM 14745 O12 PGR 407 79.624 14.158 56.633 1.00 0.00 O ATOM 14746 O11 PGR 407 78.956 12.221 57.453 1.00 0.00 O ATOM 14747 C1 PGR 407 79.592 12.304 58.795 1.00 0.00 C ATOM 14748 HR PGR 407 80.632 12.638 58.745 1.00 0.00 H ATOM 14749 HS PGR 407 79.311 11.352 59.251 1.00 0.00 H ATOM 14750 C2 PGR 407 78.761 13.400 59.649 1.00 0.00 C ATOM 14751 HX PGR 407 78.629 14.300 59.043 1.00 0.00 H ATOM 14752 C3 PGR 407 79.533 13.717 60.983 1.00 0.00 C ATOM 14753 HA PGR 407 80.563 14.012 60.767 1.00 0.00 H ATOM 14754 HB PGR 407 79.784 12.812 61.542 1.00 0.00 H ATOM 14755 O31 PGR 407 78.855 14.577 61.844 1.00 0.00 O ATOM 14756 P31 PGR 407 79.268 14.930 63.360 1.00 0.00 P ATOM 14757 O32 PGR 407 78.989 13.695 64.229 1.00 0.00 O ATOM 14758 C31 PGR 407 77.707 13.203 64.506 1.00 0.00 C ATOM 14759 H1A PGR 407 77.307 12.932 63.525 1.00 0.00 H ATOM 14760 H1B PGR 407 77.088 13.979 64.964 1.00 0.00 H ATOM 14761 C32 PGR 407 77.738 12.010 65.556 1.00 0.00 C ATOM 14762 H2A PGR 407 76.795 11.463 65.466 1.00 0.00 H ATOM 14763 O35 PGR 407 77.895 12.433 66.937 1.00 0.00 O ATOM 14764 HO5A PGR 407 78.686 12.999 66.888 1.00 0.00 H ATOM 14765 C33 PGR 407 78.849 10.958 65.183 1.00 0.00 C ATOM 14766 H3A PGR 407 78.686 10.070 65.799 1.00 0.00 H ATOM 14767 H3B PGR 407 78.813 10.693 64.124 1.00 0.00 H ATOM 14768 O33 PGR 407 80.721 15.106 63.516 1.00 0.00 O ATOM 14769 O34 PGR 407 78.413 16.028 63.790 1.00 0.00 O ATOM 14770 O21 PGR 407 77.561 12.705 60.071 1.00 0.00 O ATOM 14771 C21 PGR 407 76.688 13.529 60.724 1.00 0.00 C ATOM 14772 O22 PGR 407 75.559 13.128 61.053 1.00 0.00 O ATOM 14773 O36 PGR 407 80.217 11.351 65.530 1.00 0.00 O ATOM 14774 HO6A PGR 407 80.451 12.103 64.957 1.00 0.00 H TER 14775 PGR 407 ATOM 14775 C12 OL 408 149.655 86.737 43.855 1.00 0.00 C ATOM 14776 H2R OL 408 149.934 86.034 44.643 1.00 0.00 H ATOM 14777 H2S OL 408 150.091 86.301 42.954 1.00 0.00 H ATOM 14778 C13 OL 408 148.117 86.852 43.708 1.00 0.00 C ATOM 14779 H3R OL 408 147.957 87.706 44.369 1.00 0.00 H ATOM 14780 H3S OL 408 147.826 87.220 42.722 1.00 0.00 H ATOM 14781 C14 OL 408 147.416 85.554 44.017 1.00 0.00 C ATOM 14782 H4R OL 408 147.263 84.922 43.140 1.00 0.00 H ATOM 14783 H4S OL 408 148.045 84.881 44.603 1.00 0.00 H ATOM 14784 C15 OL 408 145.988 85.754 44.675 1.00 0.00 C ATOM 14785 H5R OL 408 145.482 84.787 44.649 1.00 0.00 H ATOM 14786 H5S OL 408 146.118 85.826 45.757 1.00 0.00 H ATOM 14787 C16 OL 408 145.116 86.837 44.065 1.00 0.00 C ATOM 14788 H6R OL 408 145.588 87.783 44.339 1.00 0.00 H ATOM 14789 H6S OL 408 144.923 86.824 42.990 1.00 0.00 H ATOM 14790 C17 OL 408 143.619 86.820 44.594 1.00 0.00 C ATOM 14791 H7R OL 408 143.061 86.036 44.078 1.00 0.00 H ATOM 14792 H7S OL 408 143.618 86.475 45.630 1.00 0.00 H ATOM 14793 C18 OL 408 142.934 88.112 44.302 1.00 0.00 C ATOM 14794 H8R OL 408 143.539 88.793 44.904 1.00 0.00 H ATOM 14795 H8S OL 408 143.054 88.289 43.231 1.00 0.00 H ATOM 14796 C19 OL 408 141.567 88.202 44.840 1.00 0.00 C ATOM 14797 H9R OL 408 141.467 88.063 45.914 1.00 0.00 H ATOM 14798 C110 OL 408 140.458 88.583 44.118 1.00 0.00 C ATOM 14799 H10R OL 408 139.549 88.725 44.697 1.00 0.00 H ATOM 14800 C111 OL 408 140.387 89.123 42.750 1.00 0.00 C ATOM 14801 H11R OL 408 139.757 90.013 42.812 1.00 0.00 H ATOM 14802 H11S OL 408 141.316 89.535 42.351 1.00 0.00 H ATOM 14803 C112 OL 408 139.646 88.129 41.900 1.00 0.00 C ATOM 14804 H12R OL 408 139.885 88.457 40.887 1.00 0.00 H ATOM 14805 H12S OL 408 140.073 87.140 42.081 1.00 0.00 H ATOM 14806 C113 OL 408 138.148 88.050 42.178 1.00 0.00 C ATOM 14807 H13R OL 408 138.080 87.571 43.158 1.00 0.00 H ATOM 14808 H13S OL 408 137.620 88.963 42.460 1.00 0.00 H ATOM 14809 C114 OL 408 137.321 87.337 41.112 1.00 0.00 C ATOM 14810 H14R OL 408 137.881 86.402 41.043 1.00 0.00 H ATOM 14811 H14S OL 408 136.421 86.935 41.583 1.00 0.00 H ATOM 14812 C115 OL 408 136.921 87.995 39.798 1.00 0.00 C ATOM 14813 H15R OL 408 136.055 88.599 40.078 1.00 0.00 H ATOM 14814 H15S OL 408 137.714 88.607 39.363 1.00 0.00 H ATOM 14815 C116 OL 408 136.436 86.982 38.724 1.00 0.00 C ATOM 14816 H16R OL 408 137.327 86.358 38.627 1.00 0.00 H ATOM 14817 H16S OL 408 135.721 86.268 39.138 1.00 0.00 H ATOM 14818 C117 OL 408 135.832 87.735 37.475 1.00 0.00 C ATOM 14819 H17R OL 408 135.293 88.595 37.877 1.00 0.00 H ATOM 14820 H17S OL 408 136.685 88.083 36.889 1.00 0.00 H ATOM 14821 C118 OL 408 134.950 86.805 36.603 1.00 0.00 C ATOM 14822 H18R OL 408 134.515 87.311 35.739 1.00 0.00 H ATOM 14823 H18S OL 408 134.042 86.365 37.021 1.00 0.00 H ATOM 14824 H18T OL 408 135.566 85.954 36.304 1.00 0.00 H TER 14825 OL 408 ATOM 14825 C116 PA 409 98.665 26.101 37.125 1.00 0.00 C ATOM 14826 H16R PA 409 98.809 25.019 37.121 1.00 0.00 H ATOM 14827 H16S PA 409 99.635 26.578 37.281 1.00 0.00 H ATOM 14828 H16T PA 409 98.286 26.428 36.154 1.00 0.00 H ATOM 14829 C115 PA 409 97.809 26.475 38.367 1.00 0.00 C ATOM 14830 H15R PA 409 96.862 25.934 38.294 1.00 0.00 H ATOM 14831 H15S PA 409 97.564 27.536 38.295 1.00 0.00 H ATOM 14832 C114 PA 409 98.568 26.033 39.645 1.00 0.00 C ATOM 14833 H14R PA 409 99.635 26.215 39.498 1.00 0.00 H ATOM 14834 H14S PA 409 98.671 24.947 39.620 1.00 0.00 H ATOM 14835 C113 PA 409 98.199 26.682 40.946 1.00 0.00 C ATOM 14836 H13R PA 409 98.649 27.676 40.977 1.00 0.00 H ATOM 14837 H13S PA 409 98.841 26.154 41.654 1.00 0.00 H ATOM 14838 C112 PA 409 96.801 26.743 41.482 1.00 0.00 C ATOM 14839 H12R PA 409 96.418 25.730 41.620 1.00 0.00 H ATOM 14840 H12S PA 409 96.243 27.305 40.730 1.00 0.00 H ATOM 14841 C111 PA 409 96.782 27.485 42.881 1.00 0.00 C ATOM 14842 H11R PA 409 97.432 28.363 42.896 1.00 0.00 H ATOM 14843 H11S PA 409 97.173 26.823 43.657 1.00 0.00 H ATOM 14844 C110 PA 409 95.364 27.675 43.398 1.00 0.00 C ATOM 14845 H10R PA 409 94.827 28.371 42.750 1.00 0.00 H ATOM 14846 H10S PA 409 95.470 28.083 44.405 1.00 0.00 H ATOM 14847 C19 PA 409 94.404 26.428 43.366 1.00 0.00 C ATOM 14848 H9R PA 409 94.381 26.102 42.324 1.00 0.00 H ATOM 14849 H9S PA 409 93.412 26.819 43.599 1.00 0.00 H ATOM 14850 C18 PA 409 94.949 25.411 44.375 1.00 0.00 C ATOM 14851 H8R PA 409 95.159 25.952 45.300 1.00 0.00 H ATOM 14852 H8S PA 409 95.892 25.063 43.948 1.00 0.00 H ATOM 14853 C17 PA 409 94.020 24.199 44.656 1.00 0.00 C ATOM 14854 H7R PA 409 93.934 23.641 43.721 1.00 0.00 H ATOM 14855 H7S PA 409 93.050 24.652 44.873 1.00 0.00 H ATOM 14856 C16 PA 409 94.516 23.254 45.768 1.00 0.00 C ATOM 14857 H6R PA 409 95.535 22.914 45.570 1.00 0.00 H ATOM 14858 H6S PA 409 93.880 22.366 45.771 1.00 0.00 H ATOM 14859 C15 PA 409 94.587 23.881 47.128 1.00 0.00 C ATOM 14860 H5R PA 409 95.377 24.620 47.275 1.00 0.00 H ATOM 14861 H5S PA 409 94.966 23.049 47.726 1.00 0.00 H ATOM 14862 C14 PA 409 93.274 24.434 47.778 1.00 0.00 C ATOM 14863 H4R PA 409 92.394 23.817 47.582 1.00 0.00 H ATOM 14864 H4S PA 409 93.026 25.366 47.266 1.00 0.00 H ATOM 14865 C13 PA 409 93.429 24.625 49.353 1.00 0.00 C ATOM 14866 H3R PA 409 94.396 25.106 49.517 1.00 0.00 H ATOM 14867 H3S PA 409 93.382 23.621 49.781 1.00 0.00 H ATOM 14868 C12 PA 409 92.345 25.416 49.902 1.00 0.00 C ATOM 14869 H2R PA 409 91.476 25.054 49.349 1.00 0.00 H ATOM 14870 H2S PA 409 92.410 26.470 49.622 1.00 0.00 H ATOM 14871 C11 PC 410 92.146 25.260 51.441 1.00 0.00 C ATOM 14872 O12 PC 410 92.969 25.528 52.301 1.00 0.00 O ATOM 14873 O11 PC 410 90.932 24.754 51.634 1.00 0.00 O ATOM 14874 C1 PC 410 90.397 24.639 52.920 1.00 0.00 C ATOM 14875 HR PC 410 90.290 25.595 53.439 1.00 0.00 H ATOM 14876 HS PC 410 91.053 23.950 53.459 1.00 0.00 H ATOM 14877 C2 PC 410 89.034 24.006 52.752 1.00 0.00 C ATOM 14878 HX PC 410 88.404 24.721 52.217 1.00 0.00 H ATOM 14879 C3 PC 410 88.361 23.746 54.129 1.00 0.00 C ATOM 14880 HA PC 410 87.294 23.514 54.074 1.00 0.00 H ATOM 14881 HB PC 410 88.428 24.700 54.657 1.00 0.00 H ATOM 14882 O31 PC 410 89.052 22.756 54.873 1.00 0.00 O ATOM 14883 P31 PC 410 88.508 22.491 56.371 1.00 0.00 P ATOM 14884 O32 PC 410 86.986 22.054 56.090 1.00 0.00 O ATOM 14885 C31 PC 410 86.735 20.792 55.451 1.00 0.00 C ATOM 14886 H1A PC 410 87.029 20.033 56.181 1.00 0.00 H ATOM 14887 H1B PC 410 87.352 20.744 54.551 1.00 0.00 H ATOM 14888 C32 PC 410 85.239 20.756 54.996 1.00 0.00 C ATOM 14889 H2A PC 410 85.089 19.900 54.336 1.00 0.00 H ATOM 14890 H2B PC 410 85.047 21.719 54.522 1.00 0.00 H ATOM 14891 N31 PC 410 84.188 20.512 55.972 1.00 0.00 N ATOM 14892 C33 PC 410 82.905 21.125 55.453 1.00 0.00 C ATOM 14893 H3A PC 410 82.882 20.797 54.413 1.00 0.00 H ATOM 14894 H3B PC 410 82.991 22.210 55.537 1.00 0.00 H ATOM 14895 H3C PC 410 82.130 20.790 56.144 1.00 0.00 H ATOM 14896 C34 PC 410 83.955 19.011 56.085 1.00 0.00 C ATOM 14897 H4A PC 410 83.366 18.768 56.971 1.00 0.00 H ATOM 14898 H4B PC 410 84.930 18.542 56.221 1.00 0.00 H ATOM 14899 H4C PC 410 83.548 18.694 55.124 1.00 0.00 H ATOM 14900 C35 PC 410 84.410 20.972 57.277 1.00 0.00 C ATOM 14901 H5A PC 410 83.576 20.656 57.905 1.00 0.00 H ATOM 14902 H5B PC 410 84.538 22.052 57.185 1.00 0.00 H ATOM 14903 H5C PC 410 85.298 20.519 57.719 1.00 0.00 H ATOM 14904 O33 PC 410 89.162 21.395 57.011 1.00 0.00 O ATOM 14905 O34 PC 410 88.455 23.863 56.999 1.00 0.00 O ATOM 14906 O21 PC 410 89.144 22.668 52.104 1.00 0.00 O ATOM 14907 C21 PC 410 88.013 22.118 51.687 1.00 0.00 C ATOM 14908 O22 PC 410 86.904 22.580 51.765 1.00 0.00 O ATOM 14909 C12 OL 411 88.250 20.767 51.116 1.00 0.00 C ATOM 14910 H2R OL 411 88.583 20.966 50.095 1.00 0.00 H ATOM 14911 H2S OL 411 89.007 20.270 51.726 1.00 0.00 H ATOM 14912 C13 OL 411 86.985 19.882 51.170 1.00 0.00 C ATOM 14913 H3R OL 411 86.714 19.822 52.226 1.00 0.00 H ATOM 14914 H3S OL 411 86.132 20.302 50.633 1.00 0.00 H ATOM 14915 C14 OL 411 87.146 18.542 50.594 1.00 0.00 C ATOM 14916 H4R OL 411 88.106 18.113 50.889 1.00 0.00 H ATOM 14917 H4S OL 411 86.454 17.780 50.958 1.00 0.00 H ATOM 14918 C15 OL 411 86.952 18.583 49.039 1.00 0.00 C ATOM 14919 H5R OL 411 87.519 19.379 48.553 1.00 0.00 H ATOM 14920 H5S OL 411 87.345 17.672 48.583 1.00 0.00 H ATOM 14921 C16 OL 411 85.526 18.693 48.495 1.00 0.00 C ATOM 14922 H6R OL 411 85.001 17.802 48.844 1.00 0.00 H ATOM 14923 H6S OL 411 84.889 19.459 48.942 1.00 0.00 H ATOM 14924 C17 OL 411 85.555 18.904 46.948 1.00 0.00 C ATOM 14925 H7R OL 411 85.372 19.958 46.730 1.00 0.00 H ATOM 14926 H7S OL 411 86.547 18.823 46.500 1.00 0.00 H ATOM 14927 C18 OL 411 84.559 18.093 46.090 1.00 0.00 C ATOM 14928 H8R OL 411 84.823 17.033 46.102 1.00 0.00 H ATOM 14929 H8S OL 411 83.533 18.048 46.460 1.00 0.00 H ATOM 14930 C19 OL 411 84.525 18.664 44.677 1.00 0.00 C ATOM 14931 H9R OL 411 83.762 19.438 44.646 1.00 0.00 H ATOM 14932 C110 OL 411 85.235 18.365 43.596 1.00 0.00 C ATOM 14933 H10R OL 411 85.055 18.911 42.674 1.00 0.00 H ATOM 14934 C111 OL 411 86.318 17.356 43.335 1.00 0.00 C ATOM 14935 H11R OL 411 87.300 17.831 43.393 1.00 0.00 H ATOM 14936 H11S OL 411 86.302 16.711 44.216 1.00 0.00 H ATOM 14937 C112 OL 411 86.162 16.615 41.970 1.00 0.00 C ATOM 14938 H12R OL 411 86.837 15.758 42.034 1.00 0.00 H ATOM 14939 H12S OL 411 85.145 16.272 41.770 1.00 0.00 H ATOM 14940 C113 OL 411 86.707 17.313 40.680 1.00 0.00 C ATOM 14941 H13R OL 411 86.061 18.112 40.310 1.00 0.00 H ATOM 14942 H13S OL 411 87.532 17.898 41.089 1.00 0.00 H ATOM 14943 C114 OL 411 87.163 16.399 39.593 1.00 0.00 C ATOM 14944 H14R OL 411 87.878 15.671 39.983 1.00 0.00 H ATOM 14945 H14S OL 411 86.407 15.654 39.339 1.00 0.00 H ATOM 14946 C115 OL 411 87.746 17.143 38.372 1.00 0.00 C ATOM 14947 H15R OL 411 86.919 17.616 37.837 1.00 0.00 H ATOM 14948 H15S OL 411 88.433 17.925 38.704 1.00 0.00 H ATOM 14949 C116 OL 411 88.370 16.128 37.417 1.00 0.00 C ATOM 14950 H16R OL 411 89.296 15.822 37.910 1.00 0.00 H ATOM 14951 H16S OL 411 87.721 15.255 37.325 1.00 0.00 H ATOM 14952 C117 OL 411 88.712 16.584 36.070 1.00 0.00 C ATOM 14953 H17R OL 411 87.820 16.896 35.523 1.00 0.00 H ATOM 14954 H17S OL 411 89.382 17.438 36.198 1.00 0.00 H ATOM 14955 C118 OL 411 89.450 15.682 35.102 1.00 0.00 C ATOM 14956 H18R OL 411 88.716 15.065 34.580 1.00 0.00 H ATOM 14957 H18S OL 411 89.922 14.897 35.696 1.00 0.00 H ATOM 14958 H18T OL 411 90.137 16.255 34.476 1.00 0.00 H TER 14959 OL 411 ATOM 14959 C116 PA 412 110.744 60.688 42.266 1.00 0.00 C ATOM 14960 H16R PA 412 111.565 61.274 41.846 1.00 0.00 H ATOM 14961 H16S PA 412 109.853 61.167 41.855 1.00 0.00 H ATOM 14962 H16T PA 412 110.940 59.733 41.775 1.00 0.00 H ATOM 14963 C115 PA 412 110.768 60.510 43.753 1.00 0.00 C ATOM 14964 H15R PA 412 111.728 60.115 44.094 1.00 0.00 H ATOM 14965 H15S PA 412 110.020 59.764 44.029 1.00 0.00 H ATOM 14966 C114 PA 412 110.423 61.863 44.270 1.00 0.00 C ATOM 14967 H14R PA 412 109.683 62.336 43.621 1.00 0.00 H ATOM 14968 H14S PA 412 111.212 62.618 44.261 1.00 0.00 H ATOM 14969 C113 PA 412 109.770 61.855 45.674 1.00 0.00 C ATOM 14970 H13R PA 412 110.572 61.736 46.405 1.00 0.00 H ATOM 14971 H13S PA 412 109.172 60.960 45.858 1.00 0.00 H ATOM 14972 C112 PA 412 108.802 62.929 46.036 1.00 0.00 C ATOM 14973 H12R PA 412 107.838 62.760 45.550 1.00 0.00 H ATOM 14974 H12S PA 412 109.063 63.805 45.439 1.00 0.00 H ATOM 14975 C111 PA 412 108.687 63.155 47.559 1.00 0.00 C ATOM 14976 H11R PA 412 109.569 62.720 48.032 1.00 0.00 H ATOM 14977 H11S PA 412 107.860 62.570 47.968 1.00 0.00 H ATOM 14978 C110 PA 412 108.435 64.652 47.978 1.00 0.00 C ATOM 14979 H10R PA 412 107.519 65.019 47.510 1.00 0.00 H ATOM 14980 H10S PA 412 109.232 65.375 47.796 1.00 0.00 H ATOM 14981 C19 PA 412 108.216 64.875 49.491 1.00 0.00 C ATOM 14982 H9R PA 412 107.473 64.176 49.879 1.00 0.00 H ATOM 14983 H9S PA 412 107.795 65.877 49.606 1.00 0.00 H ATOM 14984 C18 PA 412 109.394 64.653 50.413 1.00 0.00 C ATOM 14985 H8R PA 412 110.393 64.613 49.973 1.00 0.00 H ATOM 14986 H8S PA 412 109.259 63.635 50.785 1.00 0.00 H ATOM 14987 C17 PA 412 109.283 65.555 51.681 1.00 0.00 C ATOM 14988 H7R PA 412 108.318 65.400 52.168 1.00 0.00 H ATOM 14989 H7S PA 412 109.540 66.584 51.418 1.00 0.00 H ATOM 14990 C16 PA 412 110.335 65.161 52.761 1.00 0.00 C ATOM 14991 H6R PA 412 110.256 65.754 53.674 1.00 0.00 H ATOM 14992 H6S PA 412 111.331 65.390 52.377 1.00 0.00 H ATOM 14993 C15 PA 412 110.424 63.742 53.277 1.00 0.00 C ATOM 14994 H5R PA 412 110.840 63.124 52.478 1.00 0.00 H ATOM 14995 H5S PA 412 109.366 63.499 53.393 1.00 0.00 H ATOM 14996 C14 PA 412 111.408 63.498 54.437 1.00 0.00 C ATOM 14997 H4R PA 412 111.274 64.257 55.211 1.00 0.00 H ATOM 14998 H4S PA 412 112.450 63.458 54.113 1.00 0.00 H ATOM 14999 C13 PA 412 111.129 62.181 55.081 1.00 0.00 C ATOM 15000 H3R PA 412 111.143 61.482 54.243 1.00 0.00 H ATOM 15001 H3S PA 412 110.163 62.252 55.585 1.00 0.00 H ATOM 15002 C12 PA 412 112.195 61.656 56.084 1.00 0.00 C ATOM 15003 H2R PA 412 113.108 61.530 55.498 1.00 0.00 H ATOM 15004 H2S PA 412 111.968 60.668 56.489 1.00 0.00 H ATOM 15005 C11 PGR 413 112.445 62.568 57.255 1.00 0.00 C ATOM 15006 O12 PGR 413 111.743 62.565 58.243 1.00 0.00 O ATOM 15007 O11 PGR 413 113.471 63.409 57.004 1.00 0.00 O ATOM 15008 C1 PGR 413 113.864 64.268 58.045 1.00 0.00 C ATOM 15009 HR PGR 413 113.738 63.674 58.953 1.00 0.00 H ATOM 15010 HS PGR 413 113.225 65.153 58.107 1.00 0.00 H ATOM 15011 C2 PGR 413 115.382 64.623 57.907 1.00 0.00 C ATOM 15012 HX PGR 413 115.923 63.730 57.585 1.00 0.00 H ATOM 15013 C3 PGR 413 116.126 64.958 59.278 1.00 0.00 C ATOM 15014 HA PGR 413 117.177 65.163 59.059 1.00 0.00 H ATOM 15015 HB PGR 413 116.102 63.998 59.801 1.00 0.00 H ATOM 15016 O31 PGR 413 115.504 65.966 60.121 1.00 0.00 O ATOM 15017 P31 PGR 413 116.125 66.374 61.509 1.00 0.00 P ATOM 15018 O32 PGR 413 115.710 65.189 62.552 1.00 0.00 O ATOM 15019 C31 PGR 413 116.367 65.005 63.767 1.00 0.00 C ATOM 15020 H1A PGR 413 117.395 64.669 63.610 1.00 0.00 H ATOM 15021 H1B PGR 413 116.322 65.964 64.290 1.00 0.00 H ATOM 15022 C32 PGR 413 115.756 63.980 64.697 1.00 0.00 C ATOM 15023 H2A PGR 413 116.339 64.014 65.620 1.00 0.00 H ATOM 15024 O35 PGR 413 116.022 62.739 64.158 1.00 0.00 O ATOM 15025 HO5A PGR 413 115.452 62.845 63.376 1.00 0.00 H ATOM 15026 C33 PGR 413 114.266 64.197 65.053 1.00 0.00 C ATOM 15027 H3A PGR 413 114.188 65.286 65.105 1.00 0.00 H ATOM 15028 H3B PGR 413 113.649 63.898 64.202 1.00 0.00 H ATOM 15029 O33 PGR 413 117.575 66.474 61.395 1.00 0.00 O ATOM 15030 O34 PGR 413 115.426 67.555 61.958 1.00 0.00 O ATOM 15031 O21 PGR 413 115.570 65.663 56.892 1.00 0.00 O ATOM 15032 C21 PGR 413 115.160 66.948 57.118 1.00 0.00 C ATOM 15033 O22 PGR 413 114.497 67.328 58.078 1.00 0.00 O ATOM 15034 O36 PGR 413 113.841 63.590 66.231 1.00 0.00 O ATOM 15035 HO6A PGR 413 112.942 63.894 66.452 1.00 0.00 H ATOM 15036 C12 OL 414 115.674 67.904 56.078 1.00 0.00 C ATOM 15037 H2R OL 414 116.470 68.447 56.591 1.00 0.00 H ATOM 15038 H2S OL 414 116.142 67.315 55.286 1.00 0.00 H ATOM 15039 C13 OL 414 114.579 68.684 55.505 1.00 0.00 C ATOM 15040 H3R OL 414 114.301 69.400 56.281 1.00 0.00 H ATOM 15041 H3S OL 414 115.059 69.250 54.704 1.00 0.00 H ATOM 15042 C14 OL 414 113.448 67.814 54.956 1.00 0.00 C ATOM 15043 H4R OL 414 113.782 67.012 54.295 1.00 0.00 H ATOM 15044 H4S OL 414 112.855 67.294 55.711 1.00 0.00 H ATOM 15045 C15 OL 414 112.507 68.594 54.106 1.00 0.00 C ATOM 15046 H5R OL 414 113.107 68.645 53.195 1.00 0.00 H ATOM 15047 H5S OL 414 111.677 67.966 53.777 1.00 0.00 H ATOM 15048 C16 OL 414 112.023 69.936 54.576 1.00 0.00 C ATOM 15049 H6R OL 414 111.901 69.764 55.647 1.00 0.00 H ATOM 15050 H6S OL 414 112.695 70.757 54.316 1.00 0.00 H ATOM 15051 C17 OL 414 110.647 70.314 54.145 1.00 0.00 C ATOM 15052 H7R OL 414 110.658 71.351 54.484 1.00 0.00 H ATOM 15053 H7S OL 414 110.605 70.397 53.057 1.00 0.00 H ATOM 15054 C18 OL 414 109.467 69.595 54.794 1.00 0.00 C ATOM 15055 H8R OL 414 109.337 68.613 54.335 1.00 0.00 H ATOM 15056 H8S OL 414 109.443 69.497 55.882 1.00 0.00 H ATOM 15057 C19 OL 414 108.169 70.242 54.492 1.00 0.00 C ATOM 15058 H9R OL 414 107.753 70.870 55.275 1.00 0.00 H ATOM 15059 C110 OL 414 107.567 70.078 53.298 1.00 0.00 C ATOM 15060 H10R OL 414 106.634 70.593 53.081 1.00 0.00 H ATOM 15061 C111 OL 414 108.051 69.225 52.190 1.00 0.00 C ATOM 15062 H11R OL 414 109.084 68.940 52.396 1.00 0.00 H ATOM 15063 H11S OL 414 107.531 68.266 52.245 1.00 0.00 H ATOM 15064 C112 OL 414 108.064 69.937 50.898 1.00 0.00 C ATOM 15065 H12R OL 414 107.000 70.097 50.708 1.00 0.00 H ATOM 15066 H12S OL 414 108.361 70.986 50.970 1.00 0.00 H ATOM 15067 C113 OL 414 108.657 69.151 49.752 1.00 0.00 C ATOM 15068 H13R OL 414 108.166 68.176 49.705 1.00 0.00 H ATOM 15069 H13S OL 414 108.296 69.735 48.904 1.00 0.00 H ATOM 15070 C114 OL 414 110.173 68.890 49.936 1.00 0.00 C ATOM 15071 H14R OL 414 110.435 68.338 50.841 1.00 0.00 H ATOM 15072 H14S OL 414 110.482 68.195 49.153 1.00 0.00 H ATOM 15073 C115 OL 414 111.080 70.096 50.000 1.00 0.00 C ATOM 15074 H15R OL 414 110.707 70.674 49.152 1.00 0.00 H ATOM 15075 H15S OL 414 111.040 70.744 50.878 1.00 0.00 H ATOM 15076 C116 OL 414 112.547 69.778 49.641 1.00 0.00 C ATOM 15077 H16R OL 414 112.734 69.683 48.570 1.00 0.00 H ATOM 15078 H16S OL 414 113.187 70.607 49.951 1.00 0.00 H ATOM 15079 C117 OL 414 113.117 68.507 50.245 1.00 0.00 C ATOM 15080 H17R OL 414 112.745 68.512 51.271 1.00 0.00 H ATOM 15081 H17S OL 414 112.579 67.638 49.860 1.00 0.00 H ATOM 15082 C118 OL 414 114.498 68.132 50.006 1.00 0.00 C ATOM 15083 H18R OL 414 115.293 68.768 50.401 1.00 0.00 H ATOM 15084 H18S OL 414 114.737 67.966 48.953 1.00 0.00 H ATOM 15085 H18T OL 414 114.794 67.170 50.430 1.00 0.00 H TER 15086 OL 414 ATOM 15086 C116 PA 415 52.066 6.572 39.031 1.00 0.00 C ATOM 15087 H16R PA 415 52.377 5.917 38.215 1.00 0.00 H ATOM 15088 H16S PA 415 52.412 6.033 39.915 1.00 0.00 H ATOM 15089 H16T PA 415 52.492 7.577 39.060 1.00 0.00 H ATOM 15090 C115 PA 415 50.506 6.806 39.157 1.00 0.00 C ATOM 15091 H15R PA 415 50.308 7.034 40.207 1.00 0.00 H ATOM 15092 H15S PA 415 50.055 5.831 38.960 1.00 0.00 H ATOM 15093 C114 PA 415 50.038 7.934 38.254 1.00 0.00 C ATOM 15094 H14R PA 415 50.432 7.903 37.236 1.00 0.00 H ATOM 15095 H14S PA 415 50.390 8.882 38.666 1.00 0.00 H ATOM 15096 C113 PA 415 48.554 7.925 38.082 1.00 0.00 C ATOM 15097 H13R PA 415 48.236 6.915 37.814 1.00 0.00 H ATOM 15098 H13S PA 415 48.063 8.482 37.282 1.00 0.00 H ATOM 15099 C112 PA 415 47.751 8.311 39.281 1.00 0.00 C ATOM 15100 H12R PA 415 48.088 7.823 40.198 1.00 0.00 H ATOM 15101 H12S PA 415 46.749 7.902 39.133 1.00 0.00 H ATOM 15102 C111 PA 415 47.751 9.829 39.482 1.00 0.00 C ATOM 15103 H11R PA 415 47.379 10.261 38.550 1.00 0.00 H ATOM 15104 H11S PA 415 48.791 10.147 39.578 1.00 0.00 H ATOM 15105 C110 PA 415 46.873 10.390 40.677 1.00 0.00 C ATOM 15106 H10R PA 415 45.877 10.009 40.441 1.00 0.00 H ATOM 15107 H10S PA 415 46.845 11.481 40.675 1.00 0.00 H ATOM 15108 C19 PA 415 47.461 9.970 41.984 1.00 0.00 C ATOM 15109 H9R PA 415 48.404 10.517 42.041 1.00 0.00 H ATOM 15110 H9S PA 415 47.683 8.902 41.934 1.00 0.00 H ATOM 15111 C18 PA 415 46.751 10.350 43.273 1.00 0.00 C ATOM 15112 H8R PA 415 46.938 11.394 43.535 1.00 0.00 H ATOM 15113 H8S PA 415 47.230 9.712 44.018 1.00 0.00 H ATOM 15114 C17 PA 415 45.250 10.210 43.432 1.00 0.00 C ATOM 15115 H7R PA 415 44.890 9.256 43.041 1.00 0.00 H ATOM 15116 H7S PA 415 44.680 10.971 42.895 1.00 0.00 H ATOM 15117 C16 PA 415 44.660 10.324 44.860 1.00 0.00 C ATOM 15118 H6R PA 415 43.570 10.281 44.804 1.00 0.00 H ATOM 15119 H6S PA 415 44.780 11.331 45.264 1.00 0.00 H ATOM 15120 C15 PA 415 45.195 9.260 45.814 1.00 0.00 C ATOM 15121 H5R PA 415 46.196 9.590 46.101 1.00 0.00 H ATOM 15122 H5S PA 415 45.288 8.406 45.140 1.00 0.00 H ATOM 15123 C14 PA 415 44.249 8.938 47.007 1.00 0.00 C ATOM 15124 H4R PA 415 43.357 8.448 46.611 1.00 0.00 H ATOM 15125 H4S PA 415 43.777 9.854 47.369 1.00 0.00 H ATOM 15126 C13 PA 415 44.967 8.022 48.024 1.00 0.00 C ATOM 15127 H3R PA 415 45.688 8.713 48.466 1.00 0.00 H ATOM 15128 H3S PA 415 45.412 7.275 47.363 1.00 0.00 H ATOM 15129 C12 PA 415 43.863 7.324 48.862 1.00 0.00 C ATOM 15130 H2R PA 415 43.360 6.456 48.430 1.00 0.00 H ATOM 15131 H2S PA 415 43.152 8.134 49.042 1.00 0.00 H ATOM 15132 C11 PC 416 44.552 6.916 50.126 1.00 0.00 C ATOM 15133 O12 PC 416 45.086 5.858 50.430 1.00 0.00 O ATOM 15134 O11 PC 416 44.472 8.000 50.947 1.00 0.00 O ATOM 15135 C1 PC 416 45.171 8.051 52.291 1.00 0.00 C ATOM 15136 HR PC 416 45.144 7.031 52.684 1.00 0.00 H ATOM 15137 HS PC 416 44.690 8.679 53.045 1.00 0.00 H ATOM 15138 C2 PC 416 46.691 8.373 52.135 1.00 0.00 C ATOM 15139 HX PC 416 47.156 7.630 51.482 1.00 0.00 H ATOM 15140 C3 PC 416 47.336 8.617 53.522 1.00 0.00 C ATOM 15141 HA PC 416 48.252 9.189 53.357 1.00 0.00 H ATOM 15142 HB PC 416 47.602 7.643 53.940 1.00 0.00 H ATOM 15143 O31 PC 416 46.581 9.392 54.423 1.00 0.00 O ATOM 15144 P31 PC 416 46.910 9.389 55.992 1.00 0.00 P ATOM 15145 O32 PC 416 45.777 10.242 56.719 1.00 0.00 O ATOM 15146 C31 PC 416 44.454 9.919 56.704 1.00 0.00 C ATOM 15147 H1A PC 416 44.290 8.919 57.114 1.00 0.00 H ATOM 15148 H1B PC 416 44.109 9.953 55.668 1.00 0.00 H ATOM 15149 C32 PC 416 43.681 10.952 57.541 1.00 0.00 C ATOM 15150 H2A PC 416 42.621 10.936 57.281 1.00 0.00 H ATOM 15151 H2B PC 416 44.030 11.965 57.336 1.00 0.00 H ATOM 15152 N31 PC 416 43.742 10.777 59.010 1.00 0.00 N ATOM 15153 C33 PC 416 45.165 10.703 59.492 1.00 0.00 C ATOM 15154 H3A PC 416 45.142 10.682 60.582 1.00 0.00 H ATOM 15155 H3B PC 416 45.718 11.541 59.066 1.00 0.00 H ATOM 15156 H3C PC 416 45.677 9.875 59.000 1.00 0.00 H ATOM 15157 C34 PC 416 43.091 11.829 59.704 1.00 0.00 C ATOM 15158 H4A PC 416 43.123 11.553 60.759 1.00 0.00 H ATOM 15159 H4B PC 416 42.097 11.884 59.258 1.00 0.00 H ATOM 15160 H4C PC 416 43.659 12.748 59.549 1.00 0.00 H ATOM 15161 C35 PC 416 43.065 9.532 59.517 1.00 0.00 C ATOM 15162 H5A PC 416 42.028 9.560 59.178 1.00 0.00 H ATOM 15163 H5B PC 416 43.097 9.606 60.604 1.00 0.00 H ATOM 15164 H5C PC 416 43.600 8.684 59.085 1.00 0.00 H ATOM 15165 O33 PC 416 46.788 7.955 56.432 1.00 0.00 O ATOM 15166 O34 PC 416 48.185 10.099 56.175 1.00 0.00 O ATOM 15167 O21 PC 416 46.700 9.544 51.387 1.00 0.00 O ATOM 15168 C21 PC 416 47.808 9.902 50.646 1.00 0.00 C ATOM 15169 O22 PC 416 48.766 9.167 50.496 1.00 0.00 O ATOM 15170 C12 OL 417 47.738 11.347 50.244 1.00 0.00 C ATOM 15171 H2R OL 417 46.762 11.494 49.775 1.00 0.00 H ATOM 15172 H2S OL 417 47.751 11.989 51.127 1.00 0.00 H ATOM 15173 C13 OL 417 48.812 11.695 49.146 1.00 0.00 C ATOM 15174 H3R OL 417 48.913 12.777 49.045 1.00 0.00 H ATOM 15175 H3S OL 417 49.790 11.272 49.386 1.00 0.00 H ATOM 15176 C14 OL 417 48.398 11.126 47.792 1.00 0.00 C ATOM 15177 H4R OL 417 48.278 10.049 47.925 1.00 0.00 H ATOM 15178 H4S OL 417 47.364 11.344 47.519 1.00 0.00 H ATOM 15179 C15 OL 417 49.274 11.396 46.598 1.00 0.00 C ATOM 15180 H5R OL 417 50.254 11.589 47.039 1.00 0.00 H ATOM 15181 H5S OL 417 49.393 10.465 46.039 1.00 0.00 H ATOM 15182 C16 OL 417 48.874 12.660 45.779 1.00 0.00 C ATOM 15183 H6R OL 417 49.108 12.485 44.727 1.00 0.00 H ATOM 15184 H6S OL 417 47.786 12.736 45.730 1.00 0.00 H ATOM 15185 C17 OL 417 49.492 13.998 46.269 1.00 0.00 C ATOM 15186 H7R OL 417 49.167 14.158 47.299 1.00 0.00 H ATOM 15187 H7S OL 417 50.582 13.938 46.277 1.00 0.00 H ATOM 15188 C18 OL 417 49.104 15.184 45.446 1.00 0.00 C ATOM 15189 H8R OL 417 48.858 14.824 44.444 1.00 0.00 H ATOM 15190 H8S OL 417 48.291 15.695 45.965 1.00 0.00 H ATOM 15191 C19 OL 417 50.216 16.096 45.316 1.00 0.00 C ATOM 15192 H9R OL 417 50.435 16.608 46.249 1.00 0.00 H ATOM 15193 C110 OL 417 51.030 16.359 44.226 1.00 0.00 C ATOM 15194 H10R OL 417 51.862 17.048 44.347 1.00 0.00 H ATOM 15195 C111 OL 417 50.902 15.895 42.858 1.00 0.00 C ATOM 15196 H11R OL 417 49.849 15.640 42.722 1.00 0.00 H ATOM 15197 H11S OL 417 51.172 16.596 42.065 1.00 0.00 H ATOM 15198 C112 OL 417 51.774 14.627 42.665 1.00 0.00 C ATOM 15199 H12R OL 417 52.834 14.890 42.661 1.00 0.00 H ATOM 15200 H12S OL 417 51.618 13.877 43.444 1.00 0.00 H ATOM 15201 C113 OL 417 51.535 13.892 41.344 1.00 0.00 C ATOM 15202 H13R OL 417 50.498 13.577 41.206 1.00 0.00 H ATOM 15203 H13S OL 417 51.600 14.754 40.677 1.00 0.00 H ATOM 15204 C114 OL 417 52.522 12.723 40.984 1.00 0.00 C ATOM 15205 H14R OL 417 53.591 12.946 40.967 1.00 0.00 H ATOM 15206 H14S OL 417 52.355 12.001 41.785 1.00 0.00 H ATOM 15207 C115 OL 417 52.341 12.044 39.614 1.00 0.00 C ATOM 15208 H15R OL 417 53.150 11.315 39.534 1.00 0.00 H ATOM 15209 H15S OL 417 51.437 11.434 39.563 1.00 0.00 H ATOM 15210 C116 OL 417 52.526 12.967 38.357 1.00 0.00 C ATOM 15211 H16R OL 417 53.323 13.700 38.496 1.00 0.00 H ATOM 15212 H16S OL 417 52.889 12.395 37.500 1.00 0.00 H ATOM 15213 C117 OL 417 51.232 13.818 37.960 1.00 0.00 C ATOM 15214 H17R OL 417 51.244 14.743 38.540 1.00 0.00 H ATOM 15215 H17S OL 417 51.276 14.074 36.900 1.00 0.00 H ATOM 15216 C118 OL 417 49.875 13.165 38.151 1.00 0.00 C ATOM 15217 H18R OL 417 49.403 13.327 39.123 1.00 0.00 H ATOM 15218 H18S OL 417 49.876 12.091 37.953 1.00 0.00 H ATOM 15219 H18T OL 417 49.202 13.652 37.443 1.00 0.00 H TER 15220 OL 417 ATOM 15220 C116 PA 418 55.098 84.015 43.531 1.00 0.00 C ATOM 15221 H16R PA 418 54.312 84.764 43.647 1.00 0.00 H ATOM 15222 H16S PA 418 55.052 83.700 42.486 1.00 0.00 H ATOM 15223 H16T PA 418 56.078 84.415 43.798 1.00 0.00 H ATOM 15224 C115 PA 418 55.018 82.741 44.344 1.00 0.00 C ATOM 15225 H15R PA 418 55.354 83.061 45.333 1.00 0.00 H ATOM 15226 H15S PA 418 55.645 81.925 43.980 1.00 0.00 H ATOM 15227 C114 PA 418 53.620 82.333 44.681 1.00 0.00 C ATOM 15228 H14R PA 418 53.022 82.318 43.767 1.00 0.00 H ATOM 15229 H14S PA 418 53.264 83.219 45.210 1.00 0.00 H ATOM 15230 C113 PA 418 53.524 81.096 45.569 1.00 0.00 C ATOM 15231 H13R PA 418 54.519 81.060 46.017 1.00 0.00 H ATOM 15232 H13S PA 418 53.529 80.226 44.909 1.00 0.00 H ATOM 15233 C112 PA 418 52.171 80.963 46.281 1.00 0.00 C ATOM 15234 H12R PA 418 51.434 81.069 45.482 1.00 0.00 H ATOM 15235 H12S PA 418 51.899 81.763 46.973 1.00 0.00 H ATOM 15236 C111 PA 418 52.159 79.559 46.973 1.00 0.00 C ATOM 15237 H11R PA 418 53.042 79.491 47.612 1.00 0.00 H ATOM 15238 H11S PA 418 52.269 78.747 46.251 1.00 0.00 H ATOM 15239 C110 PA 418 50.888 79.233 47.726 1.00 0.00 C ATOM 15240 H10R PA 418 50.183 79.391 46.908 1.00 0.00 H ATOM 15241 H10S PA 418 50.645 79.937 48.525 1.00 0.00 H ATOM 15242 C19 PA 418 50.881 77.823 48.276 1.00 0.00 C ATOM 15243 H9R PA 418 51.550 77.244 47.637 1.00 0.00 H ATOM 15244 H9S PA 418 49.855 77.470 48.147 1.00 0.00 H ATOM 15245 C18 PA 418 51.344 77.674 49.711 1.00 0.00 C ATOM 15246 H8R PA 418 50.980 78.461 50.374 1.00 0.00 H ATOM 15247 H8S PA 418 52.422 77.847 49.740 1.00 0.00 H ATOM 15248 C17 PA 418 50.952 76.341 50.210 1.00 0.00 C ATOM 15249 H7R PA 418 51.631 75.620 49.749 1.00 0.00 H ATOM 15250 H7S PA 418 49.928 75.987 50.075 1.00 0.00 H ATOM 15251 C16 PA 418 51.169 76.247 51.718 1.00 0.00 C ATOM 15252 H6R PA 418 50.539 77.053 52.102 1.00 0.00 H ATOM 15253 H6S PA 418 52.203 76.540 51.911 1.00 0.00 H ATOM 15254 C15 PA 418 50.946 74.903 52.399 1.00 0.00 C ATOM 15255 H5R PA 418 51.807 74.306 52.094 1.00 0.00 H ATOM 15256 H5S PA 418 50.020 74.518 51.966 1.00 0.00 H ATOM 15257 C14 PA 418 50.772 75.023 53.817 1.00 0.00 C ATOM 15258 H4R PA 418 51.557 75.619 54.286 1.00 0.00 H ATOM 15259 H4S PA 418 50.926 74.004 54.178 1.00 0.00 H ATOM 15260 C13 PA 418 49.367 75.498 54.275 1.00 0.00 C ATOM 15261 H3R PA 418 48.765 74.668 53.899 1.00 0.00 H ATOM 15262 H3S PA 418 49.146 76.478 53.848 1.00 0.00 H ATOM 15263 C12 PA 418 49.204 75.557 55.838 1.00 0.00 C ATOM 15264 H2R PA 418 49.878 76.297 56.274 1.00 0.00 H ATOM 15265 H2S PA 418 49.531 74.589 56.224 1.00 0.00 H ATOM 15266 C11 PC 419 47.758 75.870 56.231 1.00 0.00 C ATOM 15267 O12 PC 419 46.960 76.451 55.489 1.00 0.00 O ATOM 15268 O11 PC 419 47.596 75.430 57.502 1.00 0.00 O ATOM 15269 C1 PC 419 46.348 75.452 58.172 1.00 0.00 C ATOM 15270 HR PC 419 45.840 76.400 57.981 1.00 0.00 H ATOM 15271 HS PC 419 46.602 75.471 59.235 1.00 0.00 H ATOM 15272 C2 PC 419 45.601 74.126 57.871 1.00 0.00 C ATOM 15273 HX PC 419 44.794 74.010 58.600 1.00 0.00 H ATOM 15274 C3 PC 419 46.537 72.872 58.112 1.00 0.00 C ATOM 15275 HA PC 419 47.416 72.879 57.463 1.00 0.00 H ATOM 15276 HB PC 419 46.055 71.937 57.815 1.00 0.00 H ATOM 15277 O31 PC 419 47.116 72.811 59.444 1.00 0.00 O ATOM 15278 P31 PC 419 46.203 72.374 60.645 1.00 0.00 P ATOM 15279 O32 PC 419 45.580 73.695 61.109 1.00 0.00 O ATOM 15280 C31 PC 419 46.306 74.511 61.833 1.00 0.00 C ATOM 15281 H1A PC 419 47.228 74.825 61.338 1.00 0.00 H ATOM 15282 H1B PC 419 46.497 74.009 62.785 1.00 0.00 H ATOM 15283 C32 PC 419 45.433 75.779 62.124 1.00 0.00 C ATOM 15284 H2A PC 419 44.962 76.148 61.212 1.00 0.00 H ATOM 15285 H2B PC 419 46.025 76.593 62.544 1.00 0.00 H ATOM 15286 N31 PC 419 44.263 75.710 63.026 1.00 0.00 N ATOM 15287 C33 PC 419 43.257 74.681 62.531 1.00 0.00 C ATOM 15288 H3A PC 419 42.288 74.695 63.032 1.00 0.00 H ATOM 15289 H3B PC 419 43.672 73.672 62.501 1.00 0.00 H ATOM 15290 H3C PC 419 43.143 74.961 61.483 1.00 0.00 H ATOM 15291 C34 PC 419 44.705 75.229 64.391 1.00 0.00 C ATOM 15292 H4A PC 419 45.368 74.362 64.385 1.00 0.00 H ATOM 15293 H4B PC 419 43.793 74.940 64.917 1.00 0.00 H ATOM 15294 H4C PC 419 45.207 76.072 64.868 1.00 0.00 H ATOM 15295 C35 PC 419 43.609 77.024 63.121 1.00 0.00 C ATOM 15296 H5A PC 419 43.220 77.211 62.119 1.00 0.00 H ATOM 15297 H5B PC 419 44.369 77.773 63.351 1.00 0.00 H ATOM 15298 H5C PC 419 42.846 77.027 63.901 1.00 0.00 H ATOM 15299 O33 PC 419 45.057 71.554 60.260 1.00 0.00 O ATOM 15300 O34 PC 419 47.070 71.920 61.782 1.00 0.00 O ATOM 15301 O21 PC 419 44.999 74.118 56.493 1.00 0.00 O ATOM 15302 C21 PC 419 44.046 75.014 56.066 1.00 0.00 C ATOM 15303 O22 PC 419 43.722 75.978 56.771 1.00 0.00 O ATOM 15304 C12 OL 420 43.251 74.483 54.860 1.00 0.00 C ATOM 15305 H2R OL 420 43.884 73.713 54.415 1.00 0.00 H ATOM 15306 H2S OL 420 42.336 73.978 55.177 1.00 0.00 H ATOM 15307 C13 OL 420 42.827 75.701 53.944 1.00 0.00 C ATOM 15308 H3R OL 420 43.681 76.376 53.855 1.00 0.00 H ATOM 15309 H3S OL 420 42.610 75.257 52.969 1.00 0.00 H ATOM 15310 C14 OL 420 41.541 76.550 54.319 1.00 0.00 C ATOM 15311 H4R OL 420 40.832 75.870 54.796 1.00 0.00 H ATOM 15312 H4S OL 420 41.807 77.209 55.148 1.00 0.00 H ATOM 15313 C15 OL 420 40.894 77.354 53.212 1.00 0.00 C ATOM 15314 H5R OL 420 40.047 77.968 53.524 1.00 0.00 H ATOM 15315 H5S OL 420 41.727 77.952 52.837 1.00 0.00 H ATOM 15316 C16 OL 420 40.349 76.495 52.116 1.00 0.00 C ATOM 15317 H6R OL 420 39.961 77.166 51.347 1.00 0.00 H ATOM 15318 H6S OL 420 41.057 75.828 51.619 1.00 0.00 H ATOM 15319 C17 OL 420 39.233 75.644 52.572 1.00 0.00 C ATOM 15320 H7R OL 420 39.645 74.727 52.998 1.00 0.00 H ATOM 15321 H7S OL 420 38.666 76.123 53.373 1.00 0.00 H ATOM 15322 C18 OL 420 38.275 75.304 51.341 1.00 0.00 C ATOM 15323 H8R OL 420 38.843 75.061 50.441 1.00 0.00 H ATOM 15324 H8S OL 420 37.704 74.396 51.545 1.00 0.00 H ATOM 15325 C19 OL 420 37.262 76.426 51.091 1.00 0.00 C ATOM 15326 H9R OL 420 36.690 76.679 51.981 1.00 0.00 H ATOM 15327 C110 OL 420 37.014 77.181 50.008 1.00 0.00 C ATOM 15328 H10R OL 420 36.270 77.972 50.050 1.00 0.00 H ATOM 15329 C111 OL 420 37.701 77.047 48.723 1.00 0.00 C ATOM 15330 H11R OL 420 38.502 77.778 48.595 1.00 0.00 H ATOM 15331 H11S OL 420 38.207 76.079 48.733 1.00 0.00 H ATOM 15332 C112 OL 420 36.779 77.083 47.468 1.00 0.00 C ATOM 15333 H12R OL 420 36.197 76.184 47.679 1.00 0.00 H ATOM 15334 H12S OL 420 36.173 77.990 47.520 1.00 0.00 H ATOM 15335 C113 OL 420 37.494 77.000 46.155 1.00 0.00 C ATOM 15336 H13R OL 420 38.101 77.905 46.091 1.00 0.00 H ATOM 15337 H13S OL 420 38.237 76.226 46.356 1.00 0.00 H ATOM 15338 C114 OL 420 36.637 76.748 44.925 1.00 0.00 C ATOM 15339 H14R OL 420 37.306 76.715 44.063 1.00 0.00 H ATOM 15340 H14S OL 420 36.017 75.865 45.091 1.00 0.00 H ATOM 15341 C115 OL 420 35.653 77.894 44.682 1.00 0.00 C ATOM 15342 H15R OL 420 35.132 78.108 45.618 1.00 0.00 H ATOM 15343 H15S OL 420 36.251 78.773 44.432 1.00 0.00 H ATOM 15344 C116 OL 420 34.667 77.739 43.550 1.00 0.00 C ATOM 15345 H16R OL 420 34.365 78.762 43.317 1.00 0.00 H ATOM 15346 H16S OL 420 35.204 77.253 42.732 1.00 0.00 H ATOM 15347 C117 OL 420 33.408 76.944 44.043 1.00 0.00 C ATOM 15348 H17R OL 420 33.841 75.979 44.314 1.00 0.00 H ATOM 15349 H17S OL 420 33.221 77.450 44.993 1.00 0.00 H ATOM 15350 C118 OL 420 32.339 77.048 42.998 1.00 0.00 C ATOM 15351 H18R OL 420 31.450 76.578 43.422 1.00 0.00 H ATOM 15352 H18S OL 420 32.568 76.569 42.044 1.00 0.00 H ATOM 15353 H18T OL 420 32.011 78.071 42.802 1.00 0.00 H TER 15354 OL 420 ATOM 15354 C116 PA 421 26.577 32.762 52.213 1.00 0.00 C ATOM 15355 H16R PA 421 25.772 33.411 51.861 1.00 0.00 H ATOM 15356 H16S PA 421 27.529 33.270 52.378 1.00 0.00 H ATOM 15357 H16T PA 421 26.182 32.298 53.119 1.00 0.00 H ATOM 15358 C115 PA 421 26.800 31.682 51.162 1.00 0.00 C ATOM 15359 H15R PA 421 27.622 31.016 51.432 1.00 0.00 H ATOM 15360 H15S PA 421 27.139 32.144 50.232 1.00 0.00 H ATOM 15361 C114 PA 421 25.684 30.811 50.922 1.00 0.00 C ATOM 15362 H14R PA 421 24.838 31.415 50.590 1.00 0.00 H ATOM 15363 H14S PA 421 25.323 30.342 51.840 1.00 0.00 H ATOM 15364 C113 PA 421 26.071 29.635 49.907 1.00 0.00 C ATOM 15365 H13R PA 421 26.830 29.047 50.426 1.00 0.00 H ATOM 15366 H13S PA 421 26.435 30.116 48.997 1.00 0.00 H ATOM 15367 C112 PA 421 24.963 28.670 49.542 1.00 0.00 C ATOM 15368 H12R PA 421 24.659 27.978 50.330 1.00 0.00 H ATOM 15369 H12S PA 421 25.330 28.118 48.674 1.00 0.00 H ATOM 15370 C111 PA 421 23.656 29.284 49.019 1.00 0.00 C ATOM 15371 H11R PA 421 23.505 28.897 48.009 1.00 0.00 H ATOM 15372 H11S PA 421 23.839 30.356 48.920 1.00 0.00 H ATOM 15373 C110 PA 421 22.423 28.983 49.951 1.00 0.00 C ATOM 15374 H10R PA 421 22.378 29.689 50.783 1.00 0.00 H ATOM 15375 H10S PA 421 22.437 28.043 50.507 1.00 0.00 H ATOM 15376 C19 PA 421 21.065 29.050 49.206 1.00 0.00 C ATOM 15377 H9R PA 421 21.159 28.468 48.286 1.00 0.00 H ATOM 15378 H9S PA 421 20.901 30.103 48.969 1.00 0.00 H ATOM 15379 C18 PA 421 19.908 28.477 49.939 1.00 0.00 C ATOM 15380 H8R PA 421 19.921 27.417 49.679 1.00 0.00 H ATOM 15381 H8S PA 421 18.994 28.870 49.487 1.00 0.00 H ATOM 15382 C17 PA 421 19.940 28.551 51.496 1.00 0.00 C ATOM 15383 H7R PA 421 20.187 29.614 51.524 1.00 0.00 H ATOM 15384 H7S PA 421 20.770 27.940 51.858 1.00 0.00 H ATOM 15385 C16 PA 421 18.558 28.252 52.163 1.00 0.00 C ATOM 15386 H6R PA 421 17.897 29.088 51.926 1.00 0.00 H ATOM 15387 H6S PA 421 18.587 28.310 53.253 1.00 0.00 H ATOM 15388 C15 PA 421 17.833 26.968 51.797 1.00 0.00 C ATOM 15389 H5R PA 421 17.582 27.116 50.745 1.00 0.00 H ATOM 15390 H5S PA 421 16.915 26.952 52.390 1.00 0.00 H ATOM 15391 C14 PA 421 18.608 25.750 52.041 1.00 0.00 C ATOM 15392 H4R PA 421 19.624 25.718 51.641 1.00 0.00 H ATOM 15393 H4S PA 421 17.985 24.932 51.674 1.00 0.00 H ATOM 15394 C13 PA 421 18.802 25.569 53.486 1.00 0.00 C ATOM 15395 H3R PA 421 17.880 25.545 54.071 1.00 0.00 H ATOM 15396 H3S PA 421 19.221 26.531 53.791 1.00 0.00 H ATOM 15397 C12 PA 421 19.725 24.455 53.950 1.00 0.00 C ATOM 15398 H2R PA 421 19.283 23.516 53.608 1.00 0.00 H ATOM 15399 H2S PA 421 20.622 24.670 53.366 1.00 0.00 H ATOM 15400 C11 PGR 422 19.954 24.474 55.485 1.00 0.00 C ATOM 15401 O12 PGR 422 21.029 24.687 55.998 1.00 0.00 O ATOM 15402 O11 PGR 422 18.769 24.091 56.101 1.00 0.00 O ATOM 15403 C1 PGR 422 18.665 24.254 57.489 1.00 0.00 C ATOM 15404 HR PGR 422 19.607 23.911 57.923 1.00 0.00 H ATOM 15405 HS PGR 422 17.941 23.584 57.960 1.00 0.00 H ATOM 15406 C2 PGR 422 18.429 25.712 57.765 1.00 0.00 C ATOM 15407 HX PGR 422 19.283 26.279 57.385 1.00 0.00 H ATOM 15408 C3 PGR 422 18.293 25.982 59.316 1.00 0.00 C ATOM 15409 HA PGR 422 17.653 26.825 59.588 1.00 0.00 H ATOM 15410 HB PGR 422 19.228 26.222 59.831 1.00 0.00 H ATOM 15411 O31 PGR 422 17.809 24.816 59.978 1.00 0.00 O ATOM 15412 P31 PGR 422 17.218 24.938 61.485 1.00 0.00 P ATOM 15413 O32 PGR 422 15.872 25.865 61.261 1.00 0.00 O ATOM 15414 C31 PGR 422 14.949 26.033 62.361 1.00 0.00 C ATOM 15415 H1A PGR 422 15.403 26.647 63.143 1.00 0.00 H ATOM 15416 H1B PGR 422 14.627 25.065 62.755 1.00 0.00 H ATOM 15417 C32 PGR 422 13.730 26.836 61.791 1.00 0.00 C ATOM 15418 H2A PGR 422 13.241 27.384 62.600 1.00 0.00 H ATOM 15419 O35 PGR 422 12.693 25.999 61.141 1.00 0.00 O ATOM 15420 HO5A PGR 422 12.506 25.277 61.768 1.00 0.00 H ATOM 15421 C33 PGR 422 14.041 27.895 60.707 1.00 0.00 C ATOM 15422 H3A PGR 422 14.707 28.628 61.169 1.00 0.00 H ATOM 15423 H3B PGR 422 14.549 27.420 59.864 1.00 0.00 H ATOM 15424 O33 PGR 422 16.840 23.591 61.916 1.00 0.00 O ATOM 15425 O34 PGR 422 18.149 25.735 62.303 1.00 0.00 O ATOM 15426 O21 PGR 422 17.160 25.989 57.093 1.00 0.00 O ATOM 15427 C21 PGR 422 16.877 27.299 57.037 1.00 0.00 C ATOM 15428 O22 PGR 422 17.564 28.141 57.568 1.00 0.00 O ATOM 15429 O36 PGR 422 12.815 28.585 60.398 1.00 0.00 O ATOM 15430 HO6A PGR 422 13.015 29.227 59.692 1.00 0.00 H ATOM 15431 C12 OL 423 15.632 27.436 56.240 1.00 0.00 C ATOM 15432 H2R OL 423 15.466 26.577 55.586 1.00 0.00 H ATOM 15433 H2S OL 423 14.760 27.448 56.897 1.00 0.00 H ATOM 15434 C13 OL 423 15.454 28.775 55.329 1.00 0.00 C ATOM 15435 H3R OL 423 15.689 29.637 55.957 1.00 0.00 H ATOM 15436 H3S OL 423 16.146 28.906 54.495 1.00 0.00 H ATOM 15437 C14 OL 423 14.097 28.839 54.708 1.00 0.00 C ATOM 15438 H4R OL 423 13.988 28.237 53.803 1.00 0.00 H ATOM 15439 H4S OL 423 13.439 28.293 55.387 1.00 0.00 H ATOM 15440 C15 OL 423 13.717 30.269 54.437 1.00 0.00 C ATOM 15441 H5R OL 423 13.064 30.558 55.263 1.00 0.00 H ATOM 15442 H5S OL 423 14.662 30.797 54.577 1.00 0.00 H ATOM 15443 C16 OL 423 13.043 30.555 53.026 1.00 0.00 C ATOM 15444 H6R OL 423 13.094 31.629 52.835 1.00 0.00 H ATOM 15445 H6S OL 423 13.582 30.102 52.191 1.00 0.00 H ATOM 15446 C17 OL 423 11.509 30.197 53.143 1.00 0.00 C ATOM 15447 H7R OL 423 11.490 29.119 52.967 1.00 0.00 H ATOM 15448 H7S OL 423 11.034 30.333 54.117 1.00 0.00 H ATOM 15449 C18 OL 423 10.584 30.716 52.058 1.00 0.00 C ATOM 15450 H8R OL 423 9.593 30.306 52.264 1.00 0.00 H ATOM 15451 H8S OL 423 10.700 31.799 51.982 1.00 0.00 H ATOM 15452 C19 OL 423 11.071 30.080 50.813 1.00 0.00 C ATOM 15453 H9R OL 423 10.984 28.996 50.844 1.00 0.00 H ATOM 15454 C110 OL 423 11.505 30.703 49.754 1.00 0.00 C ATOM 15455 H10R OL 423 11.817 30.085 48.917 1.00 0.00 H ATOM 15456 C111 OL 423 11.791 32.129 49.727 1.00 0.00 C ATOM 15457 H11R OL 423 10.831 32.558 49.430 1.00 0.00 H ATOM 15458 H11S OL 423 12.103 32.586 50.668 1.00 0.00 H ATOM 15459 C112 OL 423 12.931 32.493 48.775 1.00 0.00 C ATOM 15460 H12R OL 423 13.261 33.492 49.067 1.00 0.00 H ATOM 15461 H12S OL 423 13.787 31.846 48.978 1.00 0.00 H ATOM 15462 C113 OL 423 12.556 32.463 47.258 1.00 0.00 C ATOM 15463 H13R OL 423 13.390 32.889 46.696 1.00 0.00 H ATOM 15464 H13S OL 423 12.482 31.419 46.948 1.00 0.00 H ATOM 15465 C114 OL 423 11.319 33.330 47.042 1.00 0.00 C ATOM 15466 H14R OL 423 10.425 32.807 47.389 1.00 0.00 H ATOM 15467 H14S OL 423 11.363 34.286 47.570 1.00 0.00 H ATOM 15468 C115 OL 423 11.088 33.747 45.517 1.00 0.00 C ATOM 15469 H15R OL 423 10.559 34.699 45.439 1.00 0.00 H ATOM 15470 H15S OL 423 12.052 33.812 45.010 1.00 0.00 H ATOM 15471 C116 OL 423 10.379 32.637 44.773 1.00 0.00 C ATOM 15472 H16R OL 423 10.954 31.714 44.669 1.00 0.00 H ATOM 15473 H16S OL 423 9.387 32.419 45.176 1.00 0.00 H ATOM 15474 C117 OL 423 9.931 33.004 43.398 1.00 0.00 C ATOM 15475 H17R OL 423 9.449 32.122 42.971 1.00 0.00 H ATOM 15476 H17S OL 423 9.187 33.799 43.473 1.00 0.00 H ATOM 15477 C118 OL 423 11.010 33.497 42.387 1.00 0.00 C ATOM 15478 H18R OL 423 10.636 33.581 41.365 1.00 0.00 H ATOM 15479 H18S OL 423 11.803 32.751 42.457 1.00 0.00 H ATOM 15480 H18T OL 423 11.465 34.441 42.696 1.00 0.00 H TER 15481 OL 423 ATOM 15481 C116 PA 424 114.039 83.541 37.933 1.00 0.00 C ATOM 15482 H16R PA 424 114.441 83.931 36.996 1.00 0.00 H ATOM 15483 H16S PA 424 114.127 84.429 38.562 1.00 0.00 H ATOM 15484 H16T PA 424 112.971 83.367 37.783 1.00 0.00 H ATOM 15485 C115 PA 424 114.746 82.205 38.494 1.00 0.00 C ATOM 15486 H15R PA 424 115.829 82.318 38.408 1.00 0.00 H ATOM 15487 H15S PA 424 114.423 81.428 37.799 1.00 0.00 H ATOM 15488 C114 PA 424 114.403 81.783 39.934 1.00 0.00 C ATOM 15489 H14R PA 424 114.950 80.912 40.300 1.00 0.00 H ATOM 15490 H14S PA 424 113.368 81.438 39.889 1.00 0.00 H ATOM 15491 C113 PA 424 114.516 82.841 41.027 1.00 0.00 C ATOM 15492 H13R PA 424 114.092 82.376 41.920 1.00 0.00 H ATOM 15493 H13S PA 424 113.826 83.610 40.672 1.00 0.00 H ATOM 15494 C112 PA 424 115.887 83.500 41.118 1.00 0.00 C ATOM 15495 H12R PA 424 116.174 83.911 40.148 1.00 0.00 H ATOM 15496 H12S PA 424 116.545 82.663 41.362 1.00 0.00 H ATOM 15497 C111 PA 424 115.968 84.597 42.152 1.00 0.00 C ATOM 15498 H11R PA 424 115.331 85.453 41.921 1.00 0.00 H ATOM 15499 H11S PA 424 117.003 84.890 42.342 1.00 0.00 H ATOM 15500 C110 PA 424 115.334 84.249 43.557 1.00 0.00 C ATOM 15501 H10R PA 424 115.901 83.489 44.098 1.00 0.00 H ATOM 15502 H10S PA 424 114.328 83.834 43.473 1.00 0.00 H ATOM 15503 C19 PA 424 115.378 85.496 44.516 1.00 0.00 C ATOM 15504 H9R PA 424 114.713 86.306 44.208 1.00 0.00 H ATOM 15505 H9S PA 424 116.359 85.976 44.543 1.00 0.00 H ATOM 15506 C18 PA 424 115.129 85.216 45.927 1.00 0.00 C ATOM 15507 H8R PA 424 115.898 84.514 46.256 1.00 0.00 H ATOM 15508 H8S PA 424 114.198 84.659 46.044 1.00 0.00 H ATOM 15509 C17 PA 424 115.083 86.383 46.889 1.00 0.00 C ATOM 15510 H7R PA 424 114.213 87.036 46.793 1.00 0.00 H ATOM 15511 H7S PA 424 115.968 86.960 46.611 1.00 0.00 H ATOM 15512 C16 PA 424 115.129 86.022 48.395 1.00 0.00 C ATOM 15513 H6R PA 424 116.167 85.684 48.416 1.00 0.00 H ATOM 15514 H6S PA 424 114.529 85.175 48.732 1.00 0.00 H ATOM 15515 C15 PA 424 114.971 87.106 49.513 1.00 0.00 C ATOM 15516 H5R PA 424 113.900 87.319 49.533 1.00 0.00 H ATOM 15517 H5S PA 424 115.509 88.015 49.236 1.00 0.00 H ATOM 15518 C14 PA 424 115.375 86.620 50.975 1.00 0.00 C ATOM 15519 H4R PA 424 116.461 86.567 51.068 1.00 0.00 H ATOM 15520 H4S PA 424 115.105 85.571 51.115 1.00 0.00 H ATOM 15521 C13 PA 424 114.741 87.480 52.108 1.00 0.00 C ATOM 15522 H3R PA 424 115.199 87.154 53.045 1.00 0.00 H ATOM 15523 H3S PA 424 113.727 87.092 52.226 1.00 0.00 H ATOM 15524 C12 PA 424 114.905 89.006 51.979 1.00 0.00 C ATOM 15525 H2R PA 424 114.298 89.428 51.175 1.00 0.00 H ATOM 15526 H2S PA 424 115.963 88.970 51.711 1.00 0.00 H ATOM 15527 C11 PGR 425 114.812 89.815 53.285 1.00 0.00 C ATOM 15528 O12 PGR 425 113.701 90.302 53.591 1.00 0.00 O ATOM 15529 O11 PGR 425 115.987 90.059 53.921 1.00 0.00 O ATOM 15530 C1 PGR 425 115.970 90.789 55.243 1.00 0.00 C ATOM 15531 HR PGR 425 115.311 91.658 55.163 1.00 0.00 H ATOM 15532 HS PGR 425 116.988 91.155 55.394 1.00 0.00 H ATOM 15533 C2 PGR 425 115.511 89.892 56.403 1.00 0.00 C ATOM 15534 HX PGR 425 114.595 89.400 56.067 1.00 0.00 H ATOM 15535 C3 PGR 425 115.328 90.639 57.777 1.00 0.00 C ATOM 15536 HA PGR 425 115.041 89.953 58.579 1.00 0.00 H ATOM 15537 HB PGR 425 114.417 91.240 57.705 1.00 0.00 H ATOM 15538 O31 PGR 425 116.377 91.477 58.115 1.00 0.00 O ATOM 15539 P31 PGR 425 116.192 92.475 59.309 1.00 0.00 P ATOM 15540 O32 PGR 425 115.924 91.545 60.529 1.00 0.00 O ATOM 15541 C31 PGR 425 116.965 90.630 60.912 1.00 0.00 C ATOM 15542 H1A PGR 425 117.602 90.322 60.078 1.00 0.00 H ATOM 15543 H1B PGR 425 117.701 91.038 61.609 1.00 0.00 H ATOM 15544 C32 PGR 425 116.120 89.451 61.521 1.00 0.00 C ATOM 15545 H2A PGR 425 115.250 89.214 60.904 1.00 0.00 H ATOM 15546 O35 PGR 425 115.615 89.721 62.843 1.00 0.00 O ATOM 15547 HO5A PGR 425 116.392 89.468 63.373 1.00 0.00 H ATOM 15548 C33 PGR 425 116.834 88.091 61.428 1.00 0.00 C ATOM 15549 H3A PGR 425 116.355 87.282 61.984 1.00 0.00 H ATOM 15550 H3B PGR 425 116.937 87.826 60.373 1.00 0.00 H ATOM 15551 O33 PGR 425 117.562 92.982 59.524 1.00 0.00 O ATOM 15552 O34 PGR 425 115.080 93.345 59.093 1.00 0.00 O ATOM 15553 O21 PGR 425 116.490 88.921 56.688 1.00 0.00 O ATOM 15554 C21 PGR 425 116.759 87.959 55.810 1.00 0.00 C ATOM 15555 O22 PGR 425 115.860 87.584 55.054 1.00 0.00 O ATOM 15556 O36 PGR 425 118.116 88.179 62.022 1.00 0.00 O ATOM 15557 HO6A PGR 425 118.110 88.232 62.995 1.00 0.00 H ATOM 15558 C12 OL 426 118.202 87.370 55.866 1.00 0.00 C ATOM 15559 H2R OL 426 118.838 88.241 56.035 1.00 0.00 H ATOM 15560 H2S OL 426 118.338 86.664 56.688 1.00 0.00 H ATOM 15561 C13 OL 426 118.744 86.648 54.631 1.00 0.00 C ATOM 15562 H3R OL 426 118.023 85.960 54.185 1.00 0.00 H ATOM 15563 H3S OL 426 119.052 87.431 53.934 1.00 0.00 H ATOM 15564 C14 OL 426 119.895 85.775 55.075 1.00 0.00 C ATOM 15565 H4R OL 426 120.624 86.369 55.630 1.00 0.00 H ATOM 15566 H4S OL 426 119.567 85.007 55.778 1.00 0.00 H ATOM 15567 C15 OL 426 120.576 85.182 53.855 1.00 0.00 C ATOM 15568 H5R OL 426 121.459 84.626 54.176 1.00 0.00 H ATOM 15569 H5S OL 426 120.035 84.264 53.614 1.00 0.00 H ATOM 15570 C16 OL 426 120.704 85.988 52.529 1.00 0.00 C ATOM 15571 H6R OL 426 119.681 86.227 52.228 1.00 0.00 H ATOM 15572 H6S OL 426 121.171 86.951 52.745 1.00 0.00 H ATOM 15573 C17 OL 426 121.530 85.482 51.359 1.00 0.00 C ATOM 15574 H7R OL 426 121.683 86.193 50.545 1.00 0.00 H ATOM 15575 H7S OL 426 122.554 85.314 51.701 1.00 0.00 H ATOM 15576 C18 OL 426 120.929 84.204 50.661 1.00 0.00 C ATOM 15577 H8R OL 426 120.949 83.379 51.375 1.00 0.00 H ATOM 15578 H8S OL 426 119.902 84.318 50.309 1.00 0.00 H ATOM 15579 C19 OL 426 121.732 83.746 49.447 1.00 0.00 C ATOM 15580 H9R OL 426 122.800 83.890 49.588 1.00 0.00 H ATOM 15581 C110 OL 426 121.228 83.293 48.206 1.00 0.00 C ATOM 15582 H10R OL 426 121.941 83.154 47.397 1.00 0.00 H ATOM 15583 C111 OL 426 119.741 82.995 47.936 1.00 0.00 C ATOM 15584 H11R OL 426 119.723 81.951 47.618 1.00 0.00 H ATOM 15585 H11S OL 426 119.161 83.011 48.861 1.00 0.00 H ATOM 15586 C112 OL 426 119.222 84.037 46.955 1.00 0.00 C ATOM 15587 H12R OL 426 118.144 84.077 47.125 1.00 0.00 H ATOM 15588 H12S OL 426 119.645 85.031 47.119 1.00 0.00 H ATOM 15589 C113 OL 426 119.381 83.460 45.568 1.00 0.00 C ATOM 15590 H13R OL 426 120.283 82.844 45.597 1.00 0.00 H ATOM 15591 H13S OL 426 118.666 82.688 45.276 1.00 0.00 H ATOM 15592 C114 OL 426 119.583 84.565 44.491 1.00 0.00 C ATOM 15593 H14R OL 426 118.653 85.133 44.427 1.00 0.00 H ATOM 15594 H14S OL 426 120.243 85.299 44.957 1.00 0.00 H ATOM 15595 C115 OL 426 119.840 84.014 43.065 1.00 0.00 C ATOM 15596 H15R OL 426 120.645 83.276 43.081 1.00 0.00 H ATOM 15597 H15S OL 426 118.953 83.439 42.790 1.00 0.00 H ATOM 15598 C116 OL 426 120.070 85.129 42.038 1.00 0.00 C ATOM 15599 H16R OL 426 119.090 85.608 41.993 1.00 0.00 H ATOM 15600 H16S OL 426 120.671 85.995 42.324 1.00 0.00 H ATOM 15601 C117 OL 426 120.186 84.611 40.615 1.00 0.00 C ATOM 15602 H17R OL 426 119.426 83.882 40.326 1.00 0.00 H ATOM 15603 H17S OL 426 120.038 85.485 39.977 1.00 0.00 H ATOM 15604 C118 OL 426 121.465 83.851 40.385 1.00 0.00 C ATOM 15605 H18R OL 426 121.660 83.666 39.326 1.00 0.00 H ATOM 15606 H18S OL 426 121.368 82.860 40.833 1.00 0.00 H ATOM 15607 H18T OL 426 122.276 84.359 40.911 1.00 0.00 H TER 15608 OL 426 ATOM 15608 C116 PA 427 78.855 58.171 38.965 1.00 0.00 C ATOM 15609 H16R PA 427 79.557 59.006 39.003 1.00 0.00 H ATOM 15610 H16S PA 427 77.992 58.492 39.551 1.00 0.00 H ATOM 15611 H16T PA 427 78.651 57.901 37.926 1.00 0.00 H ATOM 15612 C115 PA 427 79.515 56.913 39.566 1.00 0.00 C ATOM 15613 H15R PA 427 80.391 56.676 38.959 1.00 0.00 H ATOM 15614 H15S PA 427 78.837 56.058 39.515 1.00 0.00 H ATOM 15615 C114 PA 427 79.810 57.164 41.057 1.00 0.00 C ATOM 15616 H14R PA 427 78.960 57.381 41.707 1.00 0.00 H ATOM 15617 H14S PA 427 80.408 58.077 41.072 1.00 0.00 H ATOM 15618 C113 PA 427 80.613 56.080 41.692 1.00 0.00 C ATOM 15619 H13R PA 427 81.442 55.785 41.045 1.00 0.00 H ATOM 15620 H13S PA 427 79.943 55.223 41.787 1.00 0.00 H ATOM 15621 C112 PA 427 81.174 56.605 43.084 1.00 0.00 C ATOM 15622 H12R PA 427 80.275 57.017 43.547 1.00 0.00 H ATOM 15623 H12S PA 427 81.914 57.400 42.972 1.00 0.00 H ATOM 15624 C111 PA 427 81.505 55.384 44.061 1.00 0.00 C ATOM 15625 H11R PA 427 81.921 55.742 45.005 1.00 0.00 H ATOM 15626 H11S PA 427 82.245 54.713 43.617 1.00 0.00 H ATOM 15627 C110 PA 427 80.264 54.607 44.509 1.00 0.00 C ATOM 15628 H10R PA 427 79.739 54.130 43.679 1.00 0.00 H ATOM 15629 H10S PA 427 79.476 55.293 44.825 1.00 0.00 H ATOM 15630 C19 PA 427 80.596 53.466 45.497 1.00 0.00 C ATOM 15631 H9R PA 427 81.357 52.876 44.981 1.00 0.00 H ATOM 15632 H9S PA 427 79.734 52.804 45.593 1.00 0.00 H ATOM 15633 C18 PA 427 81.065 53.844 46.862 1.00 0.00 C ATOM 15634 H8R PA 427 82.148 53.977 46.823 1.00 0.00 H ATOM 15635 H8S PA 427 80.849 52.995 47.514 1.00 0.00 H ATOM 15636 C17 PA 427 80.429 55.086 47.571 1.00 0.00 C ATOM 15637 H7R PA 427 79.341 55.111 47.484 1.00 0.00 H ATOM 15638 H7S PA 427 80.834 56.003 47.139 1.00 0.00 H ATOM 15639 C16 PA 427 80.640 55.092 49.095 1.00 0.00 C ATOM 15640 H6R PA 427 80.260 54.147 49.489 1.00 0.00 H ATOM 15641 H6S PA 427 79.936 55.792 49.550 1.00 0.00 H ATOM 15642 C15 PA 427 82.109 55.342 49.399 1.00 0.00 C ATOM 15643 H5R PA 427 82.630 55.940 48.648 1.00 0.00 H ATOM 15644 H5S PA 427 82.792 54.490 49.407 1.00 0.00 H ATOM 15645 C14 PA 427 82.339 55.971 50.805 1.00 0.00 C ATOM 15646 H4R PA 427 81.447 56.432 51.235 1.00 0.00 H ATOM 15647 H4S PA 427 83.029 56.811 50.710 1.00 0.00 H ATOM 15648 C13 PA 427 83.108 55.036 51.736 1.00 0.00 C ATOM 15649 H3R PA 427 83.892 54.369 51.373 1.00 0.00 H ATOM 15650 H3S PA 427 82.374 54.302 52.073 1.00 0.00 H ATOM 15651 C12 PA 427 83.707 55.672 52.906 1.00 0.00 C ATOM 15652 H2R PA 427 82.952 55.889 53.665 1.00 0.00 H ATOM 15653 H2S PA 427 84.065 56.671 52.650 1.00 0.00 H ATOM 15654 C11 PGR 428 84.737 54.834 53.595 1.00 0.00 C ATOM 15655 O12 PGR 428 85.220 55.257 54.703 1.00 0.00 O ATOM 15656 O11 PGR 428 85.364 53.910 52.853 1.00 0.00 O ATOM 15657 C1 PGR 428 86.362 53.085 53.562 1.00 0.00 C ATOM 15658 HR PGR 428 87.102 53.719 54.058 1.00 0.00 H ATOM 15659 HS PGR 428 86.913 52.545 52.788 1.00 0.00 H ATOM 15660 C2 PGR 428 85.778 52.094 54.522 1.00 0.00 C ATOM 15661 HX PGR 428 85.217 52.566 55.333 1.00 0.00 H ATOM 15662 C3 PGR 428 86.802 51.142 55.106 1.00 0.00 C ATOM 15663 HA PGR 428 87.795 51.598 55.129 1.00 0.00 H ATOM 15664 HB PGR 428 86.887 50.303 54.410 1.00 0.00 H ATOM 15665 O31 PGR 428 86.307 50.838 56.392 1.00 0.00 O ATOM 15666 P31 PGR 428 87.383 50.621 57.564 1.00 0.00 P ATOM 15667 O32 PGR 428 88.321 49.410 57.125 1.00 0.00 O ATOM 15668 C31 PGR 428 87.795 48.092 57.243 1.00 0.00 C ATOM 15669 H1A PGR 428 87.484 47.924 58.277 1.00 0.00 H ATOM 15670 H1B PGR 428 88.626 47.405 57.062 1.00 0.00 H ATOM 15671 C32 PGR 428 86.609 47.736 56.280 1.00 0.00 C ATOM 15672 H2A PGR 428 87.090 48.080 55.361 1.00 0.00 H ATOM 15673 O35 PGR 428 85.308 48.336 56.530 1.00 0.00 O ATOM 15674 HO5A PGR 428 85.308 49.280 56.292 1.00 0.00 H ATOM 15675 C33 PGR 428 86.324 46.198 56.144 1.00 0.00 C ATOM 15676 H3A PGR 428 85.492 46.093 55.442 1.00 0.00 H ATOM 15677 H3B PGR 428 87.197 45.691 55.724 1.00 0.00 H ATOM 15678 O33 PGR 428 88.232 51.783 57.685 1.00 0.00 O ATOM 15679 O34 PGR 428 86.520 50.249 58.766 1.00 0.00 O ATOM 15680 O21 PGR 428 84.862 51.235 53.782 1.00 0.00 O ATOM 15681 C21 PGR 428 83.934 50.445 54.396 1.00 0.00 C ATOM 15682 O22 PGR 428 83.702 50.336 55.602 1.00 0.00 O ATOM 15683 O36 PGR 428 86.001 45.737 57.490 1.00 0.00 O ATOM 15684 HO6A PGR 428 85.856 44.806 57.243 1.00 0.00 H ATOM 15685 C12 OL 429 83.206 49.593 53.347 1.00 0.00 C ATOM 15686 H2R OL 429 83.902 49.265 52.572 1.00 0.00 H ATOM 15687 H2S OL 429 82.843 48.612 53.660 1.00 0.00 H ATOM 15688 C13 OL 429 82.159 50.521 52.648 1.00 0.00 C ATOM 15689 H3R OL 429 81.647 51.052 53.453 1.00 0.00 H ATOM 15690 H3S OL 429 82.614 51.346 52.096 1.00 0.00 H ATOM 15691 C14 OL 429 81.093 49.821 51.920 1.00 0.00 C ATOM 15692 H4R OL 429 81.735 49.061 51.470 1.00 0.00 H ATOM 15693 H4S OL 429 80.393 49.292 52.570 1.00 0.00 H ATOM 15694 C15 OL 429 80.338 50.738 50.940 1.00 0.00 C ATOM 15695 H5R OL 429 79.782 51.427 51.579 1.00 0.00 H ATOM 15696 H5S OL 429 81.084 51.217 50.302 1.00 0.00 H ATOM 15697 C16 OL 429 79.463 49.967 49.978 1.00 0.00 C ATOM 15698 H6R OL 429 80.064 49.138 49.598 1.00 0.00 H ATOM 15699 H6S OL 429 78.653 49.481 50.525 1.00 0.00 H ATOM 15700 C17 OL 429 78.863 50.864 48.803 1.00 0.00 C ATOM 15701 H7R OL 429 79.656 51.350 48.230 1.00 0.00 H ATOM 15702 H7S OL 429 78.496 50.100 48.114 1.00 0.00 H ATOM 15703 C18 OL 429 77.736 51.777 49.181 1.00 0.00 C ATOM 15704 H8R OL 429 76.879 51.155 49.448 1.00 0.00 H ATOM 15705 H8S OL 429 77.926 52.416 50.046 1.00 0.00 H ATOM 15706 C19 OL 429 77.407 52.614 47.993 1.00 0.00 C ATOM 15707 H9R OL 429 78.174 53.352 47.771 1.00 0.00 H ATOM 15708 C110 OL 429 76.303 52.774 47.287 1.00 0.00 C ATOM 15709 H10R OL 429 76.384 53.537 46.517 1.00 0.00 H ATOM 15710 C111 OL 429 75.072 52.054 47.590 1.00 0.00 C ATOM 15711 H11R OL 429 74.810 52.308 48.619 1.00 0.00 H ATOM 15712 H11S OL 429 74.283 52.616 47.086 1.00 0.00 H ATOM 15713 C112 OL 429 74.973 50.526 47.326 1.00 0.00 C ATOM 15714 H12R OL 429 75.847 50.015 47.737 1.00 0.00 H ATOM 15715 H12S OL 429 74.133 50.050 47.835 1.00 0.00 H ATOM 15716 C113 OL 429 75.029 50.146 45.908 1.00 0.00 C ATOM 15717 H13R OL 429 75.940 50.602 45.514 1.00 0.00 H ATOM 15718 H13S OL 429 75.130 49.069 45.757 1.00 0.00 H ATOM 15719 C114 OL 429 73.795 50.635 45.070 1.00 0.00 C ATOM 15720 H14R OL 429 72.866 50.389 45.587 1.00 0.00 H ATOM 15721 H14S OL 429 73.852 51.724 45.133 1.00 0.00 H ATOM 15722 C115 OL 429 73.721 50.038 43.677 1.00 0.00 C ATOM 15723 H15R OL 429 74.487 50.415 42.996 1.00 0.00 H ATOM 15724 H15S OL 429 73.871 48.959 43.759 1.00 0.00 H ATOM 15725 C116 OL 429 72.358 50.327 43.020 1.00 0.00 C ATOM 15726 H16R OL 429 71.539 50.343 43.742 1.00 0.00 H ATOM 15727 H16S OL 429 72.391 51.380 42.733 1.00 0.00 H ATOM 15728 C117 OL 429 72.062 49.382 41.907 1.00 0.00 C ATOM 15729 H17R OL 429 72.738 49.528 41.062 1.00 0.00 H ATOM 15730 H17S OL 429 72.189 48.403 42.374 1.00 0.00 H ATOM 15731 C118 OL 429 70.714 49.574 41.167 1.00 0.00 C ATOM 15732 H18R OL 429 69.848 49.140 41.671 1.00 0.00 H ATOM 15733 H18S OL 429 70.818 49.087 40.194 1.00 0.00 H ATOM 15734 H18T OL 429 70.548 50.612 40.871 1.00 0.00 H TER 15735 OL 429 ATOM 15735 C116 PA 430 93.780 109.275 40.485 1.00 0.00 C ATOM 15736 H16R PA 430 94.764 108.850 40.276 1.00 0.00 H ATOM 15737 H16S PA 430 93.198 109.165 39.568 1.00 0.00 H ATOM 15738 H16T PA 430 93.274 108.685 41.251 1.00 0.00 H ATOM 15739 C115 PA 430 93.915 110.727 40.990 1.00 0.00 C ATOM 15740 H15R PA 430 94.070 111.344 40.102 1.00 0.00 H ATOM 15741 H15S PA 430 94.781 110.819 41.650 1.00 0.00 H ATOM 15742 C114 PA 430 92.657 111.284 41.668 1.00 0.00 C ATOM 15743 H14R PA 430 92.617 110.820 42.655 1.00 0.00 H ATOM 15744 H14S PA 430 91.797 111.019 41.049 1.00 0.00 H ATOM 15745 C113 PA 430 92.800 112.768 41.899 1.00 0.00 C ATOM 15746 H13R PA 430 92.344 113.223 41.017 1.00 0.00 H ATOM 15747 H13S PA 430 93.846 113.067 41.805 1.00 0.00 H ATOM 15748 C112 PA 430 92.254 113.301 43.322 1.00 0.00 C ATOM 15749 H12R PA 430 92.545 114.351 43.393 1.00 0.00 H ATOM 15750 H12S PA 430 92.845 112.776 44.076 1.00 0.00 H ATOM 15751 C111 PA 430 90.804 113.093 43.757 1.00 0.00 C ATOM 15752 H11R PA 430 90.648 112.062 44.081 1.00 0.00 H ATOM 15753 H11S PA 430 90.178 113.276 42.882 1.00 0.00 H ATOM 15754 C110 PA 430 90.199 113.975 44.826 1.00 0.00 C ATOM 15755 H10R PA 430 89.126 113.797 44.724 1.00 0.00 H ATOM 15756 H10S PA 430 90.350 114.989 44.452 1.00 0.00 H ATOM 15757 C19 PA 430 90.833 113.921 46.224 1.00 0.00 C ATOM 15758 H9R PA 430 91.812 114.381 46.072 1.00 0.00 H ATOM 15759 H9S PA 430 91.031 112.907 46.578 1.00 0.00 H ATOM 15760 C18 PA 430 90.031 114.613 47.364 1.00 0.00 C ATOM 15761 H8R PA 430 89.201 114.008 47.733 1.00 0.00 H ATOM 15762 H8S PA 430 89.733 115.569 46.929 1.00 0.00 H ATOM 15763 C17 PA 430 91.055 114.821 48.540 1.00 0.00 C ATOM 15764 H7R PA 430 91.987 115.244 48.159 1.00 0.00 H ATOM 15765 H7S PA 430 91.400 113.871 48.955 1.00 0.00 H ATOM 15766 C16 PA 430 90.426 115.675 49.744 1.00 0.00 C ATOM 15767 H6R PA 430 89.936 116.574 49.362 1.00 0.00 H ATOM 15768 H6S PA 430 91.134 116.057 50.483 1.00 0.00 H ATOM 15769 C15 PA 430 89.430 114.862 50.626 1.00 0.00 C ATOM 15770 H5R PA 430 88.455 114.794 50.140 1.00 0.00 H ATOM 15771 H5S PA 430 89.239 115.437 51.535 1.00 0.00 H ATOM 15772 C14 PA 430 89.943 113.500 51.050 1.00 0.00 C ATOM 15773 H4R PA 430 91.034 113.528 51.000 1.00 0.00 H ATOM 15774 H4S PA 430 89.557 112.824 50.285 1.00 0.00 H ATOM 15775 C13 PA 430 89.588 113.021 52.384 1.00 0.00 C ATOM 15776 H3R PA 430 89.765 113.722 53.202 1.00 0.00 H ATOM 15777 H3S PA 430 90.286 112.234 52.676 1.00 0.00 H ATOM 15778 C12 PA 430 88.264 112.436 52.345 1.00 0.00 C ATOM 15779 H2R PA 430 87.559 113.165 51.939 1.00 0.00 H ATOM 15780 H2S PA 430 88.313 111.537 51.727 1.00 0.00 H ATOM 15781 C11 PGR 431 87.784 112.150 53.766 1.00 0.00 C ATOM 15782 O12 PGR 431 88.595 111.924 54.646 1.00 0.00 O ATOM 15783 O11 PGR 431 86.472 112.340 53.966 1.00 0.00 O ATOM 15784 C1 PGR 431 85.908 112.447 55.293 1.00 0.00 C ATOM 15785 HR PGR 431 86.341 111.630 55.875 1.00 0.00 H ATOM 15786 HS PGR 431 84.844 112.215 55.197 1.00 0.00 H ATOM 15787 C2 PGR 431 86.201 113.891 55.653 1.00 0.00 C ATOM 15788 HX PGR 431 87.274 114.070 55.549 1.00 0.00 H ATOM 15789 C3 PGR 431 85.872 114.314 57.038 1.00 0.00 C ATOM 15790 HA PGR 431 84.792 114.178 57.134 1.00 0.00 H ATOM 15791 HB PGR 431 86.094 115.381 57.120 1.00 0.00 H ATOM 15792 O31 PGR 431 86.594 113.494 57.996 1.00 0.00 O ATOM 15793 P31 PGR 431 86.858 114.047 59.497 1.00 0.00 P ATOM 15794 O32 PGR 431 88.366 114.463 59.590 1.00 0.00 O ATOM 15795 C31 PGR 431 88.834 115.824 59.348 1.00 0.00 C ATOM 15796 H1A PGR 431 88.399 116.474 60.112 1.00 0.00 H ATOM 15797 H1B PGR 431 88.568 116.147 58.339 1.00 0.00 H ATOM 15798 C32 PGR 431 90.376 115.989 59.567 1.00 0.00 C ATOM 15799 H2A PGR 431 90.400 117.080 59.509 1.00 0.00 H ATOM 15800 O35 PGR 431 91.085 115.353 58.515 1.00 0.00 O ATOM 15801 HO5A PGR 431 90.569 114.531 58.428 1.00 0.00 H ATOM 15802 C33 PGR 431 90.869 115.611 60.989 1.00 0.00 C ATOM 15803 H3A PGR 431 90.260 116.253 61.630 1.00 0.00 H ATOM 15804 H3B PGR 431 90.532 114.606 61.256 1.00 0.00 H ATOM 15805 O33 PGR 431 86.012 115.295 59.565 1.00 0.00 O ATOM 15806 O34 PGR 431 86.708 112.926 60.452 1.00 0.00 O ATOM 15807 O21 PGR 431 85.517 114.771 54.783 1.00 0.00 O ATOM 15808 C21 PGR 431 86.112 115.263 53.694 1.00 0.00 C ATOM 15809 O22 PGR 431 87.335 115.170 53.479 1.00 0.00 O ATOM 15810 O36 PGR 431 92.286 115.891 61.184 1.00 0.00 O ATOM 15811 HO6A PGR 431 92.619 116.633 60.648 1.00 0.00 H ATOM 15812 C12 OL 432 85.251 116.079 52.873 1.00 0.00 C ATOM 15813 H2R OL 432 84.292 115.568 52.977 1.00 0.00 H ATOM 15814 H2S OL 432 85.135 117.137 53.117 1.00 0.00 H ATOM 15815 C13 OL 432 85.697 115.941 51.411 1.00 0.00 C ATOM 15816 H3R OL 432 86.586 116.502 51.119 1.00 0.00 H ATOM 15817 H3S OL 432 85.877 114.894 51.156 1.00 0.00 H ATOM 15818 C14 OL 432 84.595 116.366 50.446 1.00 0.00 C ATOM 15819 H4R OL 432 84.804 115.898 49.482 1.00 0.00 H ATOM 15820 H4S OL 432 83.642 115.920 50.738 1.00 0.00 H ATOM 15821 C15 OL 432 84.487 117.845 50.173 1.00 0.00 C ATOM 15822 H5R OL 432 84.501 118.352 51.140 1.00 0.00 H ATOM 15823 H5S OL 432 85.423 118.183 49.722 1.00 0.00 H ATOM 15824 C16 OL 432 83.340 118.266 49.322 1.00 0.00 C ATOM 15825 H6R OL 432 82.429 117.820 49.727 1.00 0.00 H ATOM 15826 H6S OL 432 83.206 119.336 49.496 1.00 0.00 H ATOM 15827 C17 OL 432 83.611 118.221 47.842 1.00 0.00 C ATOM 15828 H7R OL 432 84.538 118.714 47.545 1.00 0.00 H ATOM 15829 H7S OL 432 83.838 117.186 47.577 1.00 0.00 H ATOM 15830 C18 OL 432 82.396 118.823 47.121 1.00 0.00 C ATOM 15831 H8R OL 432 81.686 117.996 47.189 1.00 0.00 H ATOM 15832 H8S OL 432 81.835 119.663 47.535 1.00 0.00 H ATOM 15833 C19 OL 432 82.609 119.043 45.685 1.00 0.00 C ATOM 15834 H9R OL 432 83.214 118.239 45.275 1.00 0.00 H ATOM 15835 C110 OL 432 82.343 120.130 44.966 1.00 0.00 C ATOM 15836 H10R OL 432 82.585 120.220 43.911 1.00 0.00 H ATOM 15837 C111 OL 432 81.563 121.297 45.518 1.00 0.00 C ATOM 15838 H11R OL 432 81.653 121.355 46.604 1.00 0.00 H ATOM 15839 H11S OL 432 82.090 122.172 45.133 1.00 0.00 H ATOM 15840 C112 OL 432 80.072 121.318 45.324 1.00 0.00 C ATOM 15841 H12R OL 432 79.766 121.296 44.275 1.00 0.00 H ATOM 15842 H12S OL 432 79.682 120.489 45.919 1.00 0.00 H ATOM 15843 C113 OL 432 79.408 122.578 45.760 1.00 0.00 C ATOM 15844 H13R OL 432 79.885 122.943 46.672 1.00 0.00 H ATOM 15845 H13S OL 432 79.733 123.309 45.017 1.00 0.00 H ATOM 15846 C114 OL 432 77.882 122.763 45.708 1.00 0.00 C ATOM 15847 H14R OL 432 77.329 121.952 46.187 1.00 0.00 H ATOM 15848 H14S OL 432 77.639 123.641 46.310 1.00 0.00 H ATOM 15849 C115 OL 432 77.395 123.140 44.319 1.00 0.00 C ATOM 15850 H15R OL 432 77.885 124.092 44.108 1.00 0.00 H ATOM 15851 H15S OL 432 77.599 122.434 43.511 1.00 0.00 H ATOM 15852 C116 OL 432 75.927 123.513 44.370 1.00 0.00 C ATOM 15853 H16R OL 432 75.320 122.605 44.386 1.00 0.00 H ATOM 15854 H16S OL 432 75.654 123.998 45.310 1.00 0.00 H ATOM 15855 C117 OL 432 75.550 124.382 43.110 1.00 0.00 C ATOM 15856 H17R OL 432 76.132 125.306 43.108 1.00 0.00 H ATOM 15857 H17S OL 432 75.834 123.738 42.275 1.00 0.00 H ATOM 15858 C118 OL 432 74.049 124.771 42.903 1.00 0.00 C ATOM 15859 H18R OL 432 73.495 123.855 42.688 1.00 0.00 H ATOM 15860 H18S OL 432 73.801 125.447 42.081 1.00 0.00 H ATOM 15861 H18T OL 432 73.778 125.338 43.796 1.00 0.00 H TER 15862 OL 432 ATOM 15862 C116 PA 433 76.502 138.051 42.789 1.00 0.00 C ATOM 15863 H16R PA 433 76.123 137.641 41.850 1.00 0.00 H ATOM 15864 H16S PA 433 76.651 137.205 43.462 1.00 0.00 H ATOM 15865 H16T PA 433 77.462 138.463 42.473 1.00 0.00 H ATOM 15866 C115 PA 433 75.601 139.236 43.231 1.00 0.00 C ATOM 15867 H15R PA 433 74.622 138.811 43.459 1.00 0.00 H ATOM 15868 H15S PA 433 75.471 139.879 42.358 1.00 0.00 H ATOM 15869 C114 PA 433 76.163 139.973 44.450 1.00 0.00 C ATOM 15870 H14R PA 433 77.127 140.442 44.245 1.00 0.00 H ATOM 15871 H14S PA 433 76.448 139.249 45.217 1.00 0.00 H ATOM 15872 C113 PA 433 75.195 140.967 45.113 1.00 0.00 C ATOM 15873 H13R PA 433 74.206 140.554 44.905 1.00 0.00 H ATOM 15874 H13S PA 433 75.358 141.921 44.607 1.00 0.00 H ATOM 15875 C112 PA 433 75.277 141.014 46.651 1.00 0.00 C ATOM 15876 H12R PA 433 75.052 140.045 47.104 1.00 0.00 H ATOM 15877 H12S PA 433 74.510 141.648 47.101 1.00 0.00 H ATOM 15878 C111 PA 433 76.622 141.443 47.266 1.00 0.00 C ATOM 15879 H11R PA 433 77.384 140.759 46.889 1.00 0.00 H ATOM 15880 H11S PA 433 76.538 141.267 48.340 1.00 0.00 H ATOM 15881 C110 PA 433 77.111 142.900 46.918 1.00 0.00 C ATOM 15882 H10R PA 433 76.398 143.715 47.061 1.00 0.00 H ATOM 15883 H10S PA 433 77.292 143.057 45.853 1.00 0.00 H ATOM 15884 C19 PA 433 78.407 143.269 47.575 1.00 0.00 C ATOM 15885 H9R PA 433 79.187 142.608 47.192 1.00 0.00 H ATOM 15886 H9S PA 433 78.289 142.968 48.618 1.00 0.00 H ATOM 15887 C18 PA 433 78.876 144.729 47.567 1.00 0.00 C ATOM 15888 H8R PA 433 77.966 145.294 47.777 1.00 0.00 H ATOM 15889 H8S PA 433 79.285 144.909 46.571 1.00 0.00 H ATOM 15890 C17 PA 433 79.965 144.919 48.612 1.00 0.00 C ATOM 15891 H7R PA 433 80.878 144.605 48.103 1.00 0.00 H ATOM 15892 H7S PA 433 79.962 144.172 49.409 1.00 0.00 H ATOM 15893 C16 PA 433 80.057 146.299 49.223 1.00 0.00 C ATOM 15894 H6R PA 433 79.099 146.663 49.600 1.00 0.00 H ATOM 15895 H6S PA 433 80.394 147.024 48.479 1.00 0.00 H ATOM 15896 C15 PA 433 80.944 146.428 50.441 1.00 0.00 C ATOM 15897 H5R PA 433 81.953 146.102 50.181 1.00 0.00 H ATOM 15898 H5S PA 433 80.551 145.758 51.209 1.00 0.00 H ATOM 15899 C14 PA 433 81.014 147.875 51.049 1.00 0.00 C ATOM 15900 H4R PA 433 79.994 148.259 51.122 1.00 0.00 H ATOM 15901 H4S PA 433 81.498 148.531 50.323 1.00 0.00 H ATOM 15902 C13 PA 433 81.714 147.918 52.434 1.00 0.00 C ATOM 15903 H3R PA 433 82.559 147.228 52.378 1.00 0.00 H ATOM 15904 H3S PA 433 81.083 147.538 53.239 1.00 0.00 H ATOM 15905 C12 PA 433 82.269 149.267 52.818 1.00 0.00 C ATOM 15906 H2R PA 433 81.564 150.095 52.924 1.00 0.00 H ATOM 15907 H2S PA 433 83.026 149.594 52.102 1.00 0.00 H ATOM 15908 C11 PGR 434 82.955 149.096 54.198 1.00 0.00 C ATOM 15909 O12 PGR 434 82.454 149.625 55.187 1.00 0.00 O ATOM 15910 O11 PGR 434 84.159 148.465 54.164 1.00 0.00 O ATOM 15911 C1 PGR 434 84.911 148.104 55.345 1.00 0.00 C ATOM 15912 HR PGR 434 85.345 148.992 55.811 1.00 0.00 H ATOM 15913 HS PGR 434 85.772 147.533 54.988 1.00 0.00 H ATOM 15914 C2 PGR 434 84.150 147.187 56.379 1.00 0.00 C ATOM 15915 HX PGR 434 83.088 147.438 56.315 1.00 0.00 H ATOM 15916 C3 PGR 434 84.622 147.351 57.866 1.00 0.00 C ATOM 15917 HA PGR 434 84.113 146.653 58.535 1.00 0.00 H ATOM 15918 HB PGR 434 84.420 148.332 58.304 1.00 0.00 H ATOM 15919 O31 PGR 434 86.042 147.054 57.843 1.00 0.00 O ATOM 15920 P31 PGR 434 86.880 146.978 59.132 1.00 0.00 P ATOM 15921 O32 PGR 434 86.459 145.623 59.815 1.00 0.00 O ATOM 15922 C31 PGR 434 86.975 144.422 59.302 1.00 0.00 C ATOM 15923 H1A PGR 434 88.059 144.528 59.216 1.00 0.00 H ATOM 15924 H1B PGR 434 86.475 144.215 58.352 1.00 0.00 H ATOM 15925 C32 PGR 434 86.607 143.255 60.229 1.00 0.00 C ATOM 15926 H2A PGR 434 87.052 142.301 59.936 1.00 0.00 H ATOM 15927 O35 PGR 434 85.200 142.992 60.186 1.00 0.00 O ATOM 15928 HO5A PGR 434 84.839 143.779 60.632 1.00 0.00 H ATOM 15929 C33 PGR 434 87.103 143.560 61.700 1.00 0.00 C ATOM 15930 H3A PGR 434 88.163 143.825 61.728 1.00 0.00 H ATOM 15931 H3B PGR 434 86.610 144.487 62.003 1.00 0.00 H ATOM 15932 O33 PGR 434 88.296 146.940 58.649 1.00 0.00 O ATOM 15933 O34 PGR 434 86.523 148.011 60.057 1.00 0.00 O ATOM 15934 O21 PGR 434 84.364 145.825 55.934 1.00 0.00 O ATOM 15935 C21 PGR 434 83.694 144.784 56.497 1.00 0.00 C ATOM 15936 O22 PGR 434 82.902 144.851 57.375 1.00 0.00 O ATOM 15937 O36 PGR 434 86.864 142.386 62.538 1.00 0.00 O ATOM 15938 HO6A PGR 434 85.929 142.120 62.602 1.00 0.00 H ATOM 15939 C12 OL 435 84.071 143.522 55.819 1.00 0.00 C ATOM 15940 H2R OL 435 85.129 143.331 56.010 1.00 0.00 H ATOM 15941 H2S OL 435 83.543 142.658 56.229 1.00 0.00 H ATOM 15942 C13 OL 435 83.805 143.594 54.315 1.00 0.00 C ATOM 15943 H3R OL 435 84.554 144.241 53.854 1.00 0.00 H ATOM 15944 H3S OL 435 84.292 142.710 53.898 1.00 0.00 H ATOM 15945 C14 OL 435 82.378 143.757 54.038 1.00 0.00 C ATOM 15946 H4R OL 435 81.767 143.087 54.646 1.00 0.00 H ATOM 15947 H4S OL 435 82.143 144.723 54.490 1.00 0.00 H ATOM 15948 C15 OL 435 81.856 143.651 52.625 1.00 0.00 C ATOM 15949 H5R OL 435 80.773 143.642 52.762 1.00 0.00 H ATOM 15950 H5S OL 435 82.223 144.559 52.142 1.00 0.00 H ATOM 15951 C16 OL 435 82.181 142.334 51.864 1.00 0.00 C ATOM 15952 H6R OL 435 83.217 142.092 51.618 1.00 0.00 H ATOM 15953 H6S OL 435 81.966 141.552 52.595 1.00 0.00 H ATOM 15954 C17 OL 435 81.356 142.083 50.601 1.00 0.00 C ATOM 15955 H7R OL 435 80.306 142.306 50.800 1.00 0.00 H ATOM 15956 H7S OL 435 81.690 142.837 49.886 1.00 0.00 H ATOM 15957 C18 OL 435 81.420 140.699 50.084 1.00 0.00 C ATOM 15958 H8R OL 435 82.432 140.545 49.703 1.00 0.00 H ATOM 15959 H8S OL 435 81.234 139.845 50.740 1.00 0.00 H ATOM 15960 C19 OL 435 80.413 140.518 48.927 1.00 0.00 C ATOM 15961 H9R OL 435 79.396 140.684 49.270 1.00 0.00 H ATOM 15962 C110 OL 435 80.723 140.050 47.666 1.00 0.00 C ATOM 15963 H10R OL 435 79.951 140.120 46.904 1.00 0.00 H ATOM 15964 C111 OL 435 81.939 139.469 47.087 1.00 0.00 C ATOM 15965 H11R OL 435 82.517 138.923 47.835 1.00 0.00 H ATOM 15966 H11S OL 435 81.681 138.734 46.322 1.00 0.00 H ATOM 15967 C112 OL 435 82.947 140.518 46.536 1.00 0.00 C ATOM 15968 H12R OL 435 83.225 141.029 47.460 1.00 0.00 H ATOM 15969 H12S OL 435 83.802 139.918 46.216 1.00 0.00 H ATOM 15970 C113 OL 435 82.476 141.465 45.462 1.00 0.00 C ATOM 15971 H13R OL 435 81.686 142.084 45.893 1.00 0.00 H ATOM 15972 H13S OL 435 83.248 142.215 45.277 1.00 0.00 H ATOM 15973 C114 OL 435 82.114 140.832 44.154 1.00 0.00 C ATOM 15974 H14R OL 435 82.878 140.076 43.960 1.00 0.00 H ATOM 15975 H14S OL 435 81.202 140.237 44.227 1.00 0.00 H ATOM 15976 C115 OL 435 81.935 141.859 43.051 1.00 0.00 C ATOM 15977 H15R OL 435 82.895 142.367 42.939 1.00 0.00 H ATOM 15978 H15S OL 435 81.800 141.361 42.089 1.00 0.00 H ATOM 15979 C116 OL 435 80.929 143.002 43.235 1.00 0.00 C ATOM 15980 H16R OL 435 81.269 143.554 44.113 1.00 0.00 H ATOM 15981 H16S OL 435 80.995 143.659 42.365 1.00 0.00 H ATOM 15982 C117 OL 435 79.452 142.604 43.507 1.00 0.00 C ATOM 15983 H17R OL 435 79.539 141.931 44.362 1.00 0.00 H ATOM 15984 H17S OL 435 78.886 143.486 43.814 1.00 0.00 H ATOM 15985 C118 OL 435 78.688 142.054 42.409 1.00 0.00 C ATOM 15986 H18R OL 435 78.776 142.642 41.493 1.00 0.00 H ATOM 15987 H18S OL 435 77.640 141.872 42.656 1.00 0.00 H ATOM 15988 H18T OL 435 79.152 141.075 42.271 1.00 0.00 H TER 15989 OL 435 ATOM 15989 C116 PA 436 14.188 49.525 40.317 1.00 0.00 C ATOM 15990 H16R PA 436 15.217 49.702 40.637 1.00 0.00 H ATOM 15991 H16S PA 436 14.066 49.930 39.310 1.00 0.00 H ATOM 15992 H16T PA 436 14.137 48.435 40.277 1.00 0.00 H ATOM 15993 C115 PA 436 13.256 50.210 41.253 1.00 0.00 C ATOM 15994 H15R PA 436 13.502 51.270 41.333 1.00 0.00 H ATOM 15995 H15S PA 436 13.279 49.806 42.268 1.00 0.00 H ATOM 15996 C114 PA 436 11.841 49.947 40.895 1.00 0.00 C ATOM 15997 H14R PA 436 11.650 48.873 40.932 1.00 0.00 H ATOM 15998 H14S PA 436 11.661 50.280 39.871 1.00 0.00 H ATOM 15999 C113 PA 436 10.894 50.704 41.886 1.00 0.00 C ATOM 16000 H13R PA 436 9.912 50.857 41.434 1.00 0.00 H ATOM 16001 H13S PA 436 11.292 51.699 42.097 1.00 0.00 H ATOM 16002 C112 PA 436 10.658 50.018 43.229 1.00 0.00 C ATOM 16003 H12R PA 436 10.595 48.940 43.070 1.00 0.00 H ATOM 16004 H12S PA 436 9.671 50.415 43.479 1.00 0.00 H ATOM 16005 C111 PA 436 11.476 50.387 44.475 1.00 0.00 C ATOM 16006 H11R PA 436 11.399 51.473 44.554 1.00 0.00 H ATOM 16007 H11S PA 436 12.487 50.005 44.319 1.00 0.00 H ATOM 16008 C110 PA 436 10.932 49.975 45.862 1.00 0.00 C ATOM 16009 H10R PA 436 11.031 48.889 45.922 1.00 0.00 H ATOM 16010 H10S PA 436 9.855 49.967 46.044 1.00 0.00 H ATOM 16011 C19 PA 436 11.534 50.746 47.073 1.00 0.00 C ATOM 16012 H9R PA 436 11.124 51.729 47.315 1.00 0.00 H ATOM 16013 H9S PA 436 12.607 50.926 46.977 1.00 0.00 H ATOM 16014 C18 PA 436 11.423 50.053 48.461 1.00 0.00 C ATOM 16015 H8R PA 436 11.987 49.126 48.340 1.00 0.00 H ATOM 16016 H8S PA 436 10.367 49.904 48.697 1.00 0.00 H ATOM 16017 C17 PA 436 11.879 50.860 49.652 1.00 0.00 C ATOM 16018 H7R PA 436 11.573 51.908 49.623 1.00 0.00 H ATOM 16019 H7S PA 436 12.961 50.932 49.518 1.00 0.00 H ATOM 16020 C16 PA 436 11.315 50.138 50.873 1.00 0.00 C ATOM 16021 H6R PA 436 11.690 49.113 50.831 1.00 0.00 H ATOM 16022 H6S PA 436 10.227 50.211 50.940 1.00 0.00 H ATOM 16023 C15 PA 436 11.851 50.964 52.063 1.00 0.00 C ATOM 16024 H5R PA 436 11.400 51.958 52.107 1.00 0.00 H ATOM 16025 H5S PA 436 12.928 51.076 51.923 1.00 0.00 H ATOM 16026 C14 PA 436 11.636 50.514 53.522 1.00 0.00 C ATOM 16027 H4R PA 436 10.547 50.594 53.552 1.00 0.00 H ATOM 16028 H4S PA 436 11.856 51.327 54.217 1.00 0.00 H ATOM 16029 C13 PA 436 12.231 49.111 53.896 1.00 0.00 C ATOM 16030 H3R PA 436 13.322 49.103 53.861 1.00 0.00 H ATOM 16031 H3S PA 436 11.867 48.371 53.180 1.00 0.00 H ATOM 16032 C12 PA 436 11.734 48.607 55.309 1.00 0.00 C ATOM 16033 H2R PA 436 10.716 48.214 55.309 1.00 0.00 H ATOM 16034 H2S PA 436 11.826 49.324 56.128 1.00 0.00 H ATOM 16035 C11 PGR 437 12.426 47.321 55.705 1.00 0.00 C ATOM 16036 O12 PGR 437 11.990 46.174 55.424 1.00 0.00 O ATOM 16037 O11 PGR 437 13.689 47.584 56.184 1.00 0.00 O ATOM 16038 C1 PGR 437 14.357 46.443 56.921 1.00 0.00 C ATOM 16039 HR PGR 437 14.532 45.590 56.261 1.00 0.00 H ATOM 16040 HS PGR 437 13.715 46.070 57.723 1.00 0.00 H ATOM 16041 C2 PGR 437 15.663 46.834 57.527 1.00 0.00 C ATOM 16042 HX PGR 437 15.954 46.159 58.336 1.00 0.00 H ATOM 16043 C3 PGR 437 15.735 48.282 58.121 1.00 0.00 C ATOM 16044 HA PGR 437 15.003 48.474 58.910 1.00 0.00 H ATOM 16045 HB PGR 437 15.378 48.966 57.347 1.00 0.00 H ATOM 16046 O31 PGR 437 17.011 48.576 58.643 1.00 0.00 O ATOM 16047 P31 PGR 437 17.466 50.059 58.917 1.00 0.00 P ATOM 16048 O32 PGR 437 17.616 50.637 57.515 1.00 0.00 O ATOM 16049 C31 PGR 437 18.764 50.370 56.750 1.00 0.00 C ATOM 16050 H1A PGR 437 18.993 49.313 56.907 1.00 0.00 H ATOM 16051 H1B PGR 437 19.582 51.038 57.032 1.00 0.00 H ATOM 16052 C32 PGR 437 18.533 50.483 55.193 1.00 0.00 C ATOM 16053 H2A PGR 437 19.367 49.903 54.789 1.00 0.00 H ATOM 16054 O35 PGR 437 18.728 51.859 54.796 1.00 0.00 O ATOM 16055 HO5A PGR 437 18.173 52.353 55.425 1.00 0.00 H ATOM 16056 C33 PGR 437 17.161 49.963 54.756 1.00 0.00 C ATOM 16057 H3A PGR 437 17.018 50.020 53.673 1.00 0.00 H ATOM 16058 H3B PGR 437 17.018 48.901 54.971 1.00 0.00 H ATOM 16059 O33 PGR 437 16.329 50.790 59.612 1.00 0.00 O ATOM 16060 O34 PGR 437 18.766 49.920 59.600 1.00 0.00 O ATOM 16061 O21 PGR 437 16.610 46.810 56.496 1.00 0.00 O ATOM 16062 C21 PGR 437 17.183 45.585 56.041 1.00 0.00 C ATOM 16063 O22 PGR 437 16.766 44.553 56.512 1.00 0.00 O ATOM 16064 O36 PGR 437 16.000 50.679 55.287 1.00 0.00 O ATOM 16065 HO6A PGR 437 16.333 50.837 56.189 1.00 0.00 H ATOM 16066 C12 OL 438 18.225 45.615 54.907 1.00 0.00 C ATOM 16067 H2R OL 438 18.929 46.429 55.091 1.00 0.00 H ATOM 16068 H2S OL 438 18.822 44.710 54.781 1.00 0.00 H ATOM 16069 C13 OL 438 17.404 45.932 53.727 1.00 0.00 C ATOM 16070 H3R OL 438 16.605 45.247 53.434 1.00 0.00 H ATOM 16071 H3S OL 438 16.865 46.878 53.819 1.00 0.00 H ATOM 16072 C14 OL 438 18.346 45.983 52.536 1.00 0.00 C ATOM 16073 H4R OL 438 18.942 46.896 52.598 1.00 0.00 H ATOM 16074 H4S OL 438 18.889 45.037 52.581 1.00 0.00 H ATOM 16075 C15 OL 438 17.533 45.932 51.246 1.00 0.00 C ATOM 16076 H5R OL 438 16.770 45.150 51.249 1.00 0.00 H ATOM 16077 H5S OL 438 16.974 46.867 51.325 1.00 0.00 H ATOM 16078 C16 OL 438 18.370 45.864 49.971 1.00 0.00 C ATOM 16079 H6R OL 438 18.791 46.871 49.945 1.00 0.00 H ATOM 16080 H6S OL 438 19.203 45.171 50.110 1.00 0.00 H ATOM 16081 C17 OL 438 17.640 45.592 48.626 1.00 0.00 C ATOM 16082 H7R OL 438 16.917 44.816 48.886 1.00 0.00 H ATOM 16083 H7S OL 438 17.041 46.465 48.356 1.00 0.00 H ATOM 16084 C18 OL 438 18.339 45.014 47.441 1.00 0.00 C ATOM 16085 H8R OL 438 17.821 45.131 46.486 1.00 0.00 H ATOM 16086 H8S OL 438 19.207 45.660 47.298 1.00 0.00 H ATOM 16087 C19 OL 438 18.577 43.544 47.579 1.00 0.00 C ATOM 16088 H9R OL 438 17.704 42.978 47.262 1.00 0.00 H ATOM 16089 C110 OL 438 19.783 42.985 47.911 1.00 0.00 C ATOM 16090 H10R OL 438 19.922 41.909 47.979 1.00 0.00 H ATOM 16091 C111 OL 438 21.002 43.645 48.424 1.00 0.00 C ATOM 16092 H11R OL 438 20.729 44.656 48.736 1.00 0.00 H ATOM 16093 H11S OL 438 21.220 43.130 49.362 1.00 0.00 H ATOM 16094 C112 OL 438 22.247 43.638 47.547 1.00 0.00 C ATOM 16095 H12R OL 438 22.397 42.706 46.997 1.00 0.00 H ATOM 16096 H12S OL 438 22.073 44.427 46.812 1.00 0.00 H ATOM 16097 C113 OL 438 23.542 43.992 48.319 1.00 0.00 C ATOM 16098 H13R OL 438 23.359 44.759 49.074 1.00 0.00 H ATOM 16099 H13S OL 438 23.989 43.051 48.647 1.00 0.00 H ATOM 16100 C114 OL 438 24.573 44.648 47.405 1.00 0.00 C ATOM 16101 H14R OL 438 24.956 43.909 46.699 1.00 0.00 H ATOM 16102 H14S OL 438 24.085 45.462 46.865 1.00 0.00 H ATOM 16103 C115 OL 438 25.832 45.269 48.019 1.00 0.00 C ATOM 16104 H15R OL 438 25.632 46.093 48.707 1.00 0.00 H ATOM 16105 H15S OL 438 26.355 44.531 48.631 1.00 0.00 H ATOM 16106 C116 OL 438 26.855 45.752 46.967 1.00 0.00 C ATOM 16107 H16R OL 438 27.072 45.027 46.181 1.00 0.00 H ATOM 16108 H16S OL 438 26.467 46.623 46.434 1.00 0.00 H ATOM 16109 C117 OL 438 28.232 46.050 47.629 1.00 0.00 C ATOM 16110 H17R OL 438 28.046 46.830 48.370 1.00 0.00 H ATOM 16111 H17S OL 438 28.656 45.230 48.212 1.00 0.00 H ATOM 16112 C118 OL 438 29.346 46.489 46.687 1.00 0.00 C ATOM 16113 H18R OL 438 30.263 46.578 47.274 1.00 0.00 H ATOM 16114 H18S OL 438 29.156 47.458 46.221 1.00 0.00 H ATOM 16115 H18T OL 438 29.693 45.668 46.055 1.00 0.00 H TER 16116 OL 438 ATOM 16116 C116 PA 439 47.097 113.088 42.641 1.00 0.00 C ATOM 16117 H16R PA 439 46.542 112.180 42.885 1.00 0.00 H ATOM 16118 H16S PA 439 47.435 113.053 41.604 1.00 0.00 H ATOM 16119 H16T PA 439 46.487 113.982 42.785 1.00 0.00 H ATOM 16120 C115 PA 439 48.380 113.350 43.504 1.00 0.00 C ATOM 16121 H15R PA 439 48.179 113.586 44.551 1.00 0.00 H ATOM 16122 H15S PA 439 49.016 114.130 43.081 1.00 0.00 H ATOM 16123 C114 PA 439 49.382 112.164 43.491 1.00 0.00 C ATOM 16124 H14R PA 439 49.765 112.020 42.479 1.00 0.00 H ATOM 16125 H14S PA 439 48.837 111.261 43.775 1.00 0.00 H ATOM 16126 C113 PA 439 50.583 112.328 44.383 1.00 0.00 C ATOM 16127 H13R PA 439 50.842 113.388 44.440 1.00 0.00 H ATOM 16128 H13S PA 439 51.450 111.863 43.910 1.00 0.00 H ATOM 16129 C112 PA 439 50.514 111.718 45.791 1.00 0.00 C ATOM 16130 H12R PA 439 50.119 110.700 45.791 1.00 0.00 H ATOM 16131 H12S PA 439 49.787 112.313 46.349 1.00 0.00 H ATOM 16132 C111 PA 439 51.880 111.669 46.381 1.00 0.00 C ATOM 16133 H11R PA 439 52.291 112.677 46.470 1.00 0.00 H ATOM 16134 H11S PA 439 52.456 111.170 45.599 1.00 0.00 H ATOM 16135 C110 PA 439 51.880 110.914 47.746 1.00 0.00 C ATOM 16136 H10R PA 439 51.322 109.975 47.737 1.00 0.00 H ATOM 16137 H10S PA 439 51.389 111.515 48.514 1.00 0.00 H ATOM 16138 C19 PA 439 53.275 110.677 48.376 1.00 0.00 C ATOM 16139 H9R PA 439 53.606 111.685 48.634 1.00 0.00 H ATOM 16140 H9S PA 439 53.872 110.238 47.574 1.00 0.00 H ATOM 16141 C18 PA 439 53.313 109.800 49.645 1.00 0.00 C ATOM 16142 H8R PA 439 52.691 108.927 49.434 1.00 0.00 H ATOM 16143 H8S PA 439 52.797 110.353 50.432 1.00 0.00 H ATOM 16144 C17 PA 439 54.722 109.578 50.146 1.00 0.00 C ATOM 16145 H7R PA 439 54.895 109.948 51.159 1.00 0.00 H ATOM 16146 H7S PA 439 55.319 110.290 49.572 1.00 0.00 H ATOM 16147 C16 PA 439 55.255 108.155 50.018 1.00 0.00 C ATOM 16148 H6R PA 439 56.345 108.200 50.048 1.00 0.00 H ATOM 16149 H6S PA 439 54.842 107.637 49.149 1.00 0.00 H ATOM 16150 C15 PA 439 54.597 107.222 51.045 1.00 0.00 C ATOM 16151 H5R PA 439 54.816 106.199 50.731 1.00 0.00 H ATOM 16152 H5S PA 439 53.509 107.287 50.980 1.00 0.00 H ATOM 16153 C14 PA 439 55.161 107.502 52.393 1.00 0.00 C ATOM 16154 H4R PA 439 54.814 108.431 52.851 1.00 0.00 H ATOM 16155 H4S PA 439 56.242 107.602 52.272 1.00 0.00 H ATOM 16156 C13 PA 439 54.932 106.387 53.399 1.00 0.00 C ATOM 16157 H3R PA 439 55.289 105.452 52.963 1.00 0.00 H ATOM 16158 H3S PA 439 53.851 106.322 53.540 1.00 0.00 H ATOM 16159 C12 PA 439 55.556 106.515 54.841 1.00 0.00 C ATOM 16160 H2R PA 439 56.625 106.307 54.761 1.00 0.00 H ATOM 16161 H2S PA 439 55.209 105.717 55.501 1.00 0.00 H ATOM 16162 C11 PGR 440 55.245 107.816 55.571 1.00 0.00 C ATOM 16163 O12 PGR 440 56.046 108.759 55.515 1.00 0.00 O ATOM 16164 O11 PGR 440 54.130 107.752 56.325 1.00 0.00 O ATOM 16165 C1 PGR 440 54.095 108.735 57.435 1.00 0.00 C ATOM 16166 HR PGR 440 54.228 109.698 56.935 1.00 0.00 H ATOM 16167 HS PGR 440 54.867 108.530 58.181 1.00 0.00 H ATOM 16168 C2 PGR 440 52.833 108.724 58.283 1.00 0.00 C ATOM 16169 HX PGR 440 52.809 109.509 59.043 1.00 0.00 H ATOM 16170 C3 PGR 440 52.675 107.461 59.098 1.00 0.00 C ATOM 16171 HA PGR 440 53.442 107.424 59.876 1.00 0.00 H ATOM 16172 HB PGR 440 52.962 106.679 58.391 1.00 0.00 H ATOM 16173 O31 PGR 440 51.388 107.355 59.749 1.00 0.00 O ATOM 16174 P31 PGR 440 50.851 105.948 60.440 1.00 0.00 P ATOM 16175 O32 PGR 440 49.335 105.710 59.942 1.00 0.00 O ATOM 16176 C31 PGR 440 49.034 104.478 59.355 1.00 0.00 C ATOM 16177 H1A PGR 440 49.364 103.659 59.999 1.00 0.00 H ATOM 16178 H1B PGR 440 49.645 104.395 58.452 1.00 0.00 H ATOM 16179 C32 PGR 440 47.609 104.241 58.992 1.00 0.00 C ATOM 16180 H2A PGR 440 47.369 103.257 58.581 1.00 0.00 H ATOM 16181 O35 PGR 440 47.213 105.199 57.996 1.00 0.00 O ATOM 16182 HO5A PGR 440 47.823 105.931 58.201 1.00 0.00 H ATOM 16183 C33 PGR 440 46.842 104.609 60.270 1.00 0.00 C ATOM 16184 H3A PGR 440 45.770 104.558 60.064 1.00 0.00 H ATOM 16185 H3B PGR 440 47.109 103.945 61.096 1.00 0.00 H ATOM 16186 O33 PGR 440 51.677 104.826 60.002 1.00 0.00 O ATOM 16187 O34 PGR 440 50.711 106.132 61.908 1.00 0.00 O ATOM 16188 O21 PGR 440 51.603 108.921 57.466 1.00 0.00 O ATOM 16189 C21 PGR 440 51.333 110.066 56.896 1.00 0.00 C ATOM 16190 O22 PGR 440 52.039 111.050 57.173 1.00 0.00 O ATOM 16191 O36 PGR 440 47.004 105.998 60.761 1.00 0.00 O ATOM 16192 HO6A PGR 440 47.960 106.138 60.885 1.00 0.00 H ATOM 16193 C12 OL 441 50.175 110.193 55.933 1.00 0.00 C ATOM 16194 H2R OL 441 49.740 109.204 55.776 1.00 0.00 H ATOM 16195 H2S OL 441 49.414 110.855 56.351 1.00 0.00 H ATOM 16196 C13 OL 441 50.635 110.803 54.601 1.00 0.00 C ATOM 16197 H3R OL 441 49.750 110.797 53.961 1.00 0.00 H ATOM 16198 H3S OL 441 50.936 111.838 54.780 1.00 0.00 H ATOM 16199 C14 OL 441 51.709 110.038 53.934 1.00 0.00 C ATOM 16200 H4R OL 441 52.013 110.457 52.972 1.00 0.00 H ATOM 16201 H4S OL 441 52.650 110.009 54.486 1.00 0.00 H ATOM 16202 C15 OL 441 51.433 108.510 53.796 1.00 0.00 C ATOM 16203 H5R OL 441 52.244 108.010 53.264 1.00 0.00 H ATOM 16204 H5S OL 441 51.260 108.249 54.843 1.00 0.00 H ATOM 16205 C16 OL 441 50.183 108.058 52.981 1.00 0.00 C ATOM 16206 H6R OL 441 50.026 106.983 53.087 1.00 0.00 H ATOM 16207 H6S OL 441 49.342 108.669 53.316 1.00 0.00 H ATOM 16208 C17 OL 441 50.345 108.491 51.510 1.00 0.00 C ATOM 16209 H7R OL 441 50.194 109.571 51.456 1.00 0.00 H ATOM 16210 H7S OL 441 51.293 108.293 51.005 1.00 0.00 H ATOM 16211 C18 OL 441 49.213 107.902 50.626 1.00 0.00 C ATOM 16212 H8R OL 441 49.288 106.823 50.473 1.00 0.00 H ATOM 16213 H8S OL 441 48.233 108.017 51.095 1.00 0.00 H ATOM 16214 C19 OL 441 49.379 108.507 49.313 1.00 0.00 C ATOM 16215 H9R OL 441 50.194 108.142 48.693 1.00 0.00 H ATOM 16216 C110 OL 441 48.583 109.405 48.765 1.00 0.00 C ATOM 16217 H10R OL 441 48.768 109.666 47.726 1.00 0.00 H ATOM 16218 C111 OL 441 47.299 109.963 49.288 1.00 0.00 C ATOM 16219 H11R OL 441 46.523 109.295 48.910 1.00 0.00 H ATOM 16220 H11S OL 441 47.266 109.881 50.377 1.00 0.00 H ATOM 16221 C112 OL 441 46.975 111.428 48.939 1.00 0.00 C ATOM 16222 H12R OL 441 46.162 111.753 49.592 1.00 0.00 H ATOM 16223 H12S OL 441 47.840 112.057 49.158 1.00 0.00 H ATOM 16224 C113 OL 441 46.536 111.669 47.488 1.00 0.00 C ATOM 16225 H13R OL 441 47.243 111.301 46.741 1.00 0.00 H ATOM 16226 H13S OL 441 45.636 111.080 47.299 1.00 0.00 H ATOM 16227 C114 OL 441 46.414 113.033 47.120 1.00 0.00 C ATOM 16228 H14R OL 441 47.407 113.485 47.176 1.00 0.00 H ATOM 16229 H14S OL 441 46.270 113.124 46.042 1.00 0.00 H ATOM 16230 C115 OL 441 45.343 113.813 47.837 1.00 0.00 C ATOM 16231 H15R OL 441 45.550 113.686 48.902 1.00 0.00 H ATOM 16232 H15S OL 441 45.503 114.879 47.664 1.00 0.00 H ATOM 16233 C116 OL 441 43.929 113.404 47.434 1.00 0.00 C ATOM 16234 H16R OL 441 43.786 113.452 46.353 1.00 0.00 H ATOM 16235 H16S OL 441 43.698 112.365 47.677 1.00 0.00 H ATOM 16236 C117 OL 441 42.935 114.161 48.230 1.00 0.00 C ATOM 16237 H17R OL 441 42.989 113.884 49.285 1.00 0.00 H ATOM 16238 H17S OL 441 43.161 115.229 48.205 1.00 0.00 H ATOM 16239 C118 OL 441 41.503 113.961 47.777 1.00 0.00 C ATOM 16240 H18R OL 441 41.197 112.914 47.834 1.00 0.00 H ATOM 16241 H18S OL 441 41.463 114.277 46.733 1.00 0.00 H ATOM 16242 H18T OL 441 40.783 114.501 48.395 1.00 0.00 H TER 16243 OL 441 ATOM 16243 C116 PA 442 118.113 78.573 45.293 1.00 0.00 C ATOM 16244 H16R PA 442 118.343 78.383 44.243 1.00 0.00 H ATOM 16245 H16S PA 442 118.359 77.673 45.861 1.00 0.00 H ATOM 16246 H16T PA 442 118.782 79.359 45.650 1.00 0.00 H ATOM 16247 C115 PA 442 116.644 79.031 45.480 1.00 0.00 C ATOM 16248 H15R PA 442 116.119 78.129 45.161 1.00 0.00 H ATOM 16249 H15S PA 442 116.348 79.924 44.927 1.00 0.00 H ATOM 16250 C114 PA 442 116.272 79.315 46.910 1.00 0.00 C ATOM 16251 H14R PA 442 116.697 78.576 47.592 1.00 0.00 H ATOM 16252 H14S PA 442 115.234 78.984 46.831 1.00 0.00 H ATOM 16253 C113 PA 442 116.475 80.738 47.370 1.00 0.00 C ATOM 16254 H13R PA 442 115.799 81.463 46.910 1.00 0.00 H ATOM 16255 H13S PA 442 117.508 81.049 47.200 1.00 0.00 H ATOM 16256 C112 PA 442 116.222 80.846 48.884 1.00 0.00 C ATOM 16257 H12R PA 442 116.990 80.296 49.433 1.00 0.00 H ATOM 16258 H12S PA 442 115.249 80.391 49.083 1.00 0.00 H ATOM 16259 C111 PA 442 116.137 82.213 49.445 1.00 0.00 C ATOM 16260 H11R PA 442 115.560 82.785 48.715 1.00 0.00 H ATOM 16261 H11S PA 442 117.085 82.734 49.595 1.00 0.00 H ATOM 16262 C110 PA 442 115.446 82.353 50.818 1.00 0.00 C ATOM 16263 H10R PA 442 114.588 81.685 50.919 1.00 0.00 H ATOM 16264 H10S PA 442 115.090 83.385 50.838 1.00 0.00 H ATOM 16265 C19 PA 442 116.365 82.252 51.978 1.00 0.00 C ATOM 16266 H9R PA 442 117.243 82.890 51.857 1.00 0.00 H ATOM 16267 H9S PA 442 116.752 81.232 51.932 1.00 0.00 H ATOM 16268 C18 PA 442 115.654 82.566 53.273 1.00 0.00 C ATOM 16269 H8R PA 442 114.771 81.925 53.332 1.00 0.00 H ATOM 16270 H8S PA 442 115.275 83.589 53.238 1.00 0.00 H ATOM 16271 C17 PA 442 116.529 82.709 54.485 1.00 0.00 C ATOM 16272 H7R PA 442 117.297 83.447 54.243 1.00 0.00 H ATOM 16273 H7S PA 442 117.079 81.782 54.662 1.00 0.00 H ATOM 16274 C16 PA 442 115.806 83.022 55.750 1.00 0.00 C ATOM 16275 H6R PA 442 115.020 82.300 55.985 1.00 0.00 H ATOM 16276 H6S PA 442 115.338 83.997 55.600 1.00 0.00 H ATOM 16277 C15 PA 442 116.773 83.167 56.820 1.00 0.00 C ATOM 16278 H5R PA 442 117.556 83.806 56.406 1.00 0.00 H ATOM 16279 H5S PA 442 117.163 82.156 56.952 1.00 0.00 H ATOM 16280 C14 PA 442 116.323 83.583 58.180 1.00 0.00 C ATOM 16281 H4R PA 442 115.825 82.760 58.695 1.00 0.00 H ATOM 16282 H4S PA 442 115.583 84.377 58.296 1.00 0.00 H ATOM 16283 C13 PA 442 117.546 83.816 59.060 1.00 0.00 C ATOM 16284 H3R PA 442 118.029 84.700 58.638 1.00 0.00 H ATOM 16285 H3S PA 442 118.258 82.992 58.987 1.00 0.00 H ATOM 16286 C12 PA 442 117.051 83.914 60.486 1.00 0.00 C ATOM 16287 H2R PA 442 116.563 82.997 60.822 1.00 0.00 H ATOM 16288 H2S PA 442 116.248 84.648 60.581 1.00 0.00 H ATOM 16289 C11 PGR 443 118.133 84.214 61.526 1.00 0.00 C ATOM 16290 O12 PGR 443 118.236 83.520 62.527 1.00 0.00 O ATOM 16291 O11 PGR 443 118.825 85.342 61.385 1.00 0.00 O ATOM 16292 C1 PGR 443 119.905 85.669 62.416 1.00 0.00 C ATOM 16293 HR PGR 443 119.361 85.761 63.360 1.00 0.00 H ATOM 16294 HS PGR 443 120.313 86.637 62.116 1.00 0.00 H ATOM 16295 C2 PGR 443 121.094 84.653 62.425 1.00 0.00 C ATOM 16296 HX PGR 443 120.701 83.633 62.432 1.00 0.00 H ATOM 16297 C3 PGR 443 122.008 84.767 63.734 1.00 0.00 C ATOM 16298 HA PGR 443 123.044 84.519 63.491 1.00 0.00 H ATOM 16299 HB PGR 443 121.592 84.066 64.462 1.00 0.00 H ATOM 16300 O31 PGR 443 122.146 86.128 64.157 1.00 0.00 O ATOM 16301 P31 PGR 443 122.913 86.508 65.521 1.00 0.00 P ATOM 16302 O32 PGR 443 121.962 85.785 66.624 1.00 0.00 O ATOM 16303 C31 PGR 443 120.898 86.423 67.288 1.00 0.00 C ATOM 16304 H1A PGR 443 120.291 86.980 66.571 1.00 0.00 H ATOM 16305 H1B PGR 443 121.313 87.151 67.990 1.00 0.00 H ATOM 16306 C32 PGR 443 120.108 85.303 67.973 1.00 0.00 C ATOM 16307 H2A PGR 443 120.682 84.725 68.702 1.00 0.00 H ATOM 16308 O35 PGR 443 119.723 84.526 66.824 1.00 0.00 O ATOM 16309 HO5A PGR 443 120.504 83.949 66.753 1.00 0.00 H ATOM 16310 C33 PGR 443 118.786 85.847 68.579 1.00 0.00 C ATOM 16311 H3A PGR 443 118.030 85.070 68.722 1.00 0.00 H ATOM 16312 H3B PGR 443 118.935 86.288 69.568 1.00 0.00 H ATOM 16313 O33 PGR 443 124.292 85.841 65.380 1.00 0.00 O ATOM 16314 O34 PGR 443 122.875 87.990 65.758 1.00 0.00 O ATOM 16315 O21 PGR 443 121.871 84.854 61.194 1.00 0.00 O ATOM 16316 C21 PGR 443 121.445 84.134 60.141 1.00 0.00 C ATOM 16317 O22 PGR 443 120.559 83.291 60.154 1.00 0.00 O ATOM 16318 O36 PGR 443 118.127 86.846 67.783 1.00 0.00 O ATOM 16319 HO6A PGR 443 118.250 86.544 66.865 1.00 0.00 H ATOM 16320 C12 OL 444 122.181 84.378 58.825 1.00 0.00 C ATOM 16321 H2R OL 444 122.439 83.393 58.431 1.00 0.00 H ATOM 16322 H2S OL 444 121.445 84.769 58.118 1.00 0.00 H ATOM 16323 C13 OL 444 123.446 85.218 58.908 1.00 0.00 C ATOM 16324 H3R OL 444 123.287 86.147 59.461 1.00 0.00 H ATOM 16325 H3S OL 444 124.194 84.727 59.534 1.00 0.00 H ATOM 16326 C14 OL 444 124.281 85.501 57.647 1.00 0.00 C ATOM 16327 H4R OL 444 125.082 86.163 57.982 1.00 0.00 H ATOM 16328 H4S OL 444 124.708 84.573 57.261 1.00 0.00 H ATOM 16329 C15 OL 444 123.573 86.240 56.498 1.00 0.00 C ATOM 16330 H5R OL 444 122.796 85.585 56.097 1.00 0.00 H ATOM 16331 H5S OL 444 123.136 87.206 56.760 1.00 0.00 H ATOM 16332 C16 OL 444 124.597 86.465 55.341 1.00 0.00 C ATOM 16333 H6R OL 444 125.323 87.102 55.851 1.00 0.00 H ATOM 16334 H6S OL 444 125.075 85.506 55.131 1.00 0.00 H ATOM 16335 C17 OL 444 124.028 87.065 54.063 1.00 0.00 C ATOM 16336 H7R OL 444 123.378 86.406 53.483 1.00 0.00 H ATOM 16337 H7S OL 444 123.287 87.817 54.340 1.00 0.00 H ATOM 16338 C18 OL 444 125.008 87.655 53.032 1.00 0.00 C ATOM 16339 H8R OL 444 125.446 88.552 53.474 1.00 0.00 H ATOM 16340 H8S OL 444 125.888 87.022 52.898 1.00 0.00 H ATOM 16341 C19 OL 444 124.297 87.843 51.728 1.00 0.00 C ATOM 16342 H9R OL 444 123.917 86.919 51.299 1.00 0.00 H ATOM 16343 C110 OL 444 124.009 88.957 51.072 1.00 0.00 C ATOM 16344 H10R OL 444 123.423 88.864 50.161 1.00 0.00 H ATOM 16345 C111 OL 444 124.408 90.308 51.540 1.00 0.00 C ATOM 16346 H11R OL 444 123.597 90.685 52.167 1.00 0.00 H ATOM 16347 H11S OL 444 125.354 90.312 52.087 1.00 0.00 H ATOM 16348 C112 OL 444 124.695 91.228 50.374 1.00 0.00 C ATOM 16349 H12R OL 444 125.329 90.767 49.615 1.00 0.00 H ATOM 16350 H12S OL 444 123.727 91.434 49.912 1.00 0.00 H ATOM 16351 C113 OL 444 125.440 92.582 50.686 1.00 0.00 C ATOM 16352 H13R OL 444 125.120 92.984 51.650 1.00 0.00 H ATOM 16353 H13S OL 444 126.468 92.305 50.931 1.00 0.00 H ATOM 16354 C114 OL 444 125.466 93.649 49.532 1.00 0.00 C ATOM 16355 H14R OL 444 124.509 93.773 49.021 1.00 0.00 H ATOM 16356 H14S OL 444 125.665 94.689 49.799 1.00 0.00 H ATOM 16357 C115 OL 444 126.495 93.280 48.470 1.00 0.00 C ATOM 16358 H15R OL 444 127.502 93.429 48.866 1.00 0.00 H ATOM 16359 H15S OL 444 126.437 92.229 48.178 1.00 0.00 H ATOM 16360 C116 OL 444 126.402 94.123 47.232 1.00 0.00 C ATOM 16361 H16R OL 444 125.418 94.489 46.932 1.00 0.00 H ATOM 16362 H16S OL 444 126.924 95.049 47.486 1.00 0.00 H ATOM 16363 C117 OL 444 127.167 93.543 46.107 1.00 0.00 C ATOM 16364 H17R OL 444 128.022 92.978 46.483 1.00 0.00 H ATOM 16365 H17S OL 444 126.561 92.696 45.778 1.00 0.00 H ATOM 16366 C118 OL 444 127.688 94.535 44.977 1.00 0.00 C ATOM 16367 H18R OL 444 128.309 94.070 44.209 1.00 0.00 H ATOM 16368 H18S OL 444 128.106 95.472 45.352 1.00 0.00 H ATOM 16369 H18T OL 444 126.817 94.752 44.356 1.00 0.00 H TER 16370 OL 444 ATOM 16370 C116 PA 445 100.174 102.786 40.540 1.00 0.00 C ATOM 16371 H16R PA 445 99.797 101.761 40.544 1.00 0.00 H ATOM 16372 H16S PA 445 101.245 102.806 40.749 1.00 0.00 H ATOM 16373 H16T PA 445 100.118 103.123 39.503 1.00 0.00 H ATOM 16374 C115 PA 445 99.404 103.509 41.616 1.00 0.00 C ATOM 16375 H15R PA 445 98.339 103.436 41.388 1.00 0.00 H ATOM 16376 H15S PA 445 99.741 104.543 41.719 1.00 0.00 H ATOM 16377 C114 PA 445 99.604 102.841 43.010 1.00 0.00 C ATOM 16378 H14R PA 445 100.506 103.284 43.436 1.00 0.00 H ATOM 16379 H14S PA 445 99.664 101.756 42.903 1.00 0.00 H ATOM 16380 C113 PA 445 98.485 103.277 43.993 1.00 0.00 C ATOM 16381 H13R PA 445 97.594 103.366 43.367 1.00 0.00 H ATOM 16382 H13S PA 445 98.652 104.332 44.220 1.00 0.00 H ATOM 16383 C112 PA 445 98.387 102.479 45.290 1.00 0.00 C ATOM 16384 H12R PA 445 98.122 101.469 44.972 1.00 0.00 H ATOM 16385 H12S PA 445 97.580 102.893 45.898 1.00 0.00 H ATOM 16386 C111 PA 445 99.544 102.539 46.259 1.00 0.00 C ATOM 16387 H11R PA 445 99.674 103.616 46.386 1.00 0.00 H ATOM 16388 H11S PA 445 100.511 102.169 45.912 1.00 0.00 H ATOM 16389 C110 PA 445 99.269 101.831 47.671 1.00 0.00 C ATOM 16390 H10R PA 445 100.140 101.885 48.328 1.00 0.00 H ATOM 16391 H10S PA 445 99.134 100.759 47.510 1.00 0.00 H ATOM 16392 C19 PA 445 98.168 102.453 48.578 1.00 0.00 C ATOM 16393 H9R PA 445 97.190 102.401 48.095 1.00 0.00 H ATOM 16394 H9S PA 445 98.318 103.509 48.814 1.00 0.00 H ATOM 16395 C18 PA 445 98.063 101.709 49.881 1.00 0.00 C ATOM 16396 H8R PA 445 99.008 101.681 50.428 1.00 0.00 H ATOM 16397 H8S PA 445 97.894 100.633 49.808 1.00 0.00 H ATOM 16398 C17 PA 445 96.865 102.171 50.734 1.00 0.00 C ATOM 16399 H7R PA 445 95.901 102.021 50.242 1.00 0.00 H ATOM 16400 H7S PA 445 97.082 103.206 51.006 1.00 0.00 H ATOM 16401 C16 PA 445 96.680 101.465 52.065 1.00 0.00 C ATOM 16402 H6R PA 445 96.329 100.436 51.969 1.00 0.00 H ATOM 16403 H6S PA 445 95.768 101.861 52.517 1.00 0.00 H ATOM 16404 C15 PA 445 97.894 101.467 52.950 1.00 0.00 C ATOM 16405 H5R PA 445 98.520 102.351 52.813 1.00 0.00 H ATOM 16406 H5S PA 445 98.446 100.583 52.626 1.00 0.00 H ATOM 16407 C14 PA 445 97.488 101.417 54.458 1.00 0.00 C ATOM 16408 H4R PA 445 96.789 100.598 54.637 1.00 0.00 H ATOM 16409 H4S PA 445 97.035 102.341 54.824 1.00 0.00 H ATOM 16410 C13 PA 445 98.626 101.142 55.423 1.00 0.00 C ATOM 16411 H3R PA 445 99.550 101.697 55.251 1.00 0.00 H ATOM 16412 H3S PA 445 98.969 100.112 55.305 1.00 0.00 H ATOM 16413 C12 PA 445 98.350 101.503 56.899 1.00 0.00 C ATOM 16414 H2R PA 445 97.450 101.065 57.333 1.00 0.00 H ATOM 16415 H2S PA 445 98.120 102.570 56.932 1.00 0.00 H ATOM 16416 C11 PC 446 99.517 101.294 57.819 1.00 0.00 C ATOM 16417 O12 PC 446 99.463 101.445 59.031 1.00 0.00 O ATOM 16418 O11 PC 446 100.683 100.938 57.248 1.00 0.00 O ATOM 16419 C1 PC 446 101.879 100.803 58.020 1.00 0.00 C ATOM 16420 HR PC 446 101.904 101.685 58.665 1.00 0.00 H ATOM 16421 HS PC 446 102.793 100.817 57.421 1.00 0.00 H ATOM 16422 C2 PC 446 101.854 99.444 58.766 1.00 0.00 C ATOM 16423 HX PC 446 100.851 99.258 59.159 1.00 0.00 H ATOM 16424 C3 PC 446 102.851 99.418 59.962 1.00 0.00 C ATOM 16425 HA PC 446 102.487 100.149 60.689 1.00 0.00 H ATOM 16426 HB PC 446 103.823 99.763 59.600 1.00 0.00 H ATOM 16427 O31 PC 446 102.911 98.161 60.636 1.00 0.00 O ATOM 16428 P31 PC 446 103.386 98.068 62.141 1.00 0.00 P ATOM 16429 O32 PC 446 102.203 98.675 62.980 1.00 0.00 O ATOM 16430 C31 PC 446 101.242 97.930 63.684 1.00 0.00 C ATOM 16431 H1A PC 446 101.591 97.491 64.622 1.00 0.00 H ATOM 16432 H1B PC 446 100.956 97.022 63.147 1.00 0.00 H ATOM 16433 C32 PC 446 100.059 98.823 63.961 1.00 0.00 C ATOM 16434 H2A PC 446 99.634 99.189 63.025 1.00 0.00 H ATOM 16435 H2B PC 446 100.365 99.591 64.673 1.00 0.00 H ATOM 16436 N31 PC 446 98.876 98.185 64.715 1.00 0.00 N ATOM 16437 C33 PC 446 98.171 97.035 64.096 1.00 0.00 C ATOM 16438 H3A PC 446 98.793 96.150 63.960 1.00 0.00 H ATOM 16439 H3B PC 446 97.868 97.456 63.136 1.00 0.00 H ATOM 16440 H3C PC 446 97.290 96.690 64.640 1.00 0.00 H ATOM 16441 C34 PC 446 99.272 97.563 65.973 1.00 0.00 C ATOM 16442 H4A PC 446 98.456 97.224 66.613 1.00 0.00 H ATOM 16443 H4B PC 446 99.872 98.337 66.455 1.00 0.00 H ATOM 16444 H4C PC 446 99.829 96.665 65.702 1.00 0.00 H ATOM 16445 C35 PC 446 97.852 99.251 64.955 1.00 0.00 C ATOM 16446 H5A PC 446 98.357 100.156 65.297 1.00 0.00 H ATOM 16447 H5B PC 446 97.140 98.853 65.680 1.00 0.00 H ATOM 16448 H5C PC 446 97.250 99.390 64.055 1.00 0.00 H ATOM 16449 O33 PC 446 103.475 96.654 62.520 1.00 0.00 O ATOM 16450 O34 PC 446 104.545 98.874 62.337 1.00 0.00 O ATOM 16451 O21 PC 446 102.187 98.341 57.843 1.00 0.00 O ATOM 16452 C21 PC 446 101.726 97.115 58.029 1.00 0.00 C ATOM 16453 O22 PC 446 100.794 96.814 58.728 1.00 0.00 O ATOM 16454 C12 OL 447 102.501 96.107 57.280 1.00 0.00 C ATOM 16455 H2R OL 447 103.430 96.598 56.981 1.00 0.00 H ATOM 16456 H2S OL 447 102.793 95.352 58.013 1.00 0.00 H ATOM 16457 C13 OL 447 101.806 95.746 55.955 1.00 0.00 C ATOM 16458 H3R OL 447 100.743 95.619 56.172 1.00 0.00 H ATOM 16459 H3S OL 447 101.853 96.675 55.384 1.00 0.00 H ATOM 16460 C14 OL 447 102.383 94.503 55.295 1.00 0.00 C ATOM 16461 H4R OL 447 103.457 94.690 55.241 1.00 0.00 H ATOM 16462 H4S OL 447 102.324 93.554 55.833 1.00 0.00 H ATOM 16463 C15 OL 447 101.941 94.244 53.886 1.00 0.00 C ATOM 16464 H5R OL 447 101.766 95.214 53.415 1.00 0.00 H ATOM 16465 H5S OL 447 102.809 93.911 53.314 1.00 0.00 H ATOM 16466 C16 OL 447 100.773 93.248 53.912 1.00 0.00 C ATOM 16467 H6R OL 447 101.076 92.474 54.620 1.00 0.00 H ATOM 16468 H6S OL 447 99.865 93.684 54.334 1.00 0.00 H ATOM 16469 C17 OL 447 100.446 92.675 52.515 1.00 0.00 C ATOM 16470 H7R OL 447 99.523 92.102 52.624 1.00 0.00 H ATOM 16471 H7S OL 447 100.202 93.460 51.797 1.00 0.00 H ATOM 16472 C18 OL 447 101.389 91.669 51.970 1.00 0.00 C ATOM 16473 H8R OL 447 102.437 91.962 52.065 1.00 0.00 H ATOM 16474 H8S OL 447 101.458 90.802 52.631 1.00 0.00 H ATOM 16475 C19 OL 447 101.034 91.005 50.666 1.00 0.00 C ATOM 16476 H9R OL 447 100.103 90.451 50.754 1.00 0.00 H ATOM 16477 C110 OL 447 101.840 90.829 49.636 1.00 0.00 C ATOM 16478 H10R OL 447 101.504 90.124 48.880 1.00 0.00 H ATOM 16479 C111 OL 447 103.205 91.402 49.536 1.00 0.00 C ATOM 16480 H11R OL 447 103.177 92.243 50.232 1.00 0.00 H ATOM 16481 H11S OL 447 103.954 90.756 49.998 1.00 0.00 H ATOM 16482 C112 OL 447 103.847 91.942 48.190 1.00 0.00 C ATOM 16483 H12R OL 447 104.225 91.070 47.651 1.00 0.00 H ATOM 16484 H12S OL 447 103.059 92.397 47.586 1.00 0.00 H ATOM 16485 C113 OL 447 105.014 92.952 48.428 1.00 0.00 C ATOM 16486 H13R OL 447 104.750 93.789 49.079 1.00 0.00 H ATOM 16487 H13S OL 447 105.746 92.355 48.976 1.00 0.00 H ATOM 16488 C114 OL 447 105.707 93.604 47.194 1.00 0.00 C ATOM 16489 H14R OL 447 105.052 94.367 46.769 1.00 0.00 H ATOM 16490 H14S OL 447 106.445 94.313 47.574 1.00 0.00 H ATOM 16491 C115 OL 447 106.205 92.531 46.153 1.00 0.00 C ATOM 16492 H15R OL 447 106.711 91.788 46.773 1.00 0.00 H ATOM 16493 H15S OL 447 105.320 92.036 45.748 1.00 0.00 H ATOM 16494 C116 OL 447 107.072 93.161 45.081 1.00 0.00 C ATOM 16495 H16R OL 447 106.455 93.836 44.485 1.00 0.00 H ATOM 16496 H16S OL 447 107.874 93.754 45.525 1.00 0.00 H ATOM 16497 C117 OL 447 107.738 92.162 44.079 1.00 0.00 C ATOM 16498 H17R OL 447 107.794 91.245 44.669 1.00 0.00 H ATOM 16499 H17S OL 447 107.032 92.023 43.257 1.00 0.00 H ATOM 16500 C118 OL 447 109.050 92.699 43.484 1.00 0.00 C ATOM 16501 H18R OL 447 109.780 92.808 44.289 1.00 0.00 H ATOM 16502 H18S OL 447 108.800 93.713 43.167 1.00 0.00 H ATOM 16503 H18T OL 447 109.492 92.010 42.760 1.00 0.00 H TER 16504 OL 447 ATOM 16504 C116 PA 448 100.707 134.300 39.806 1.00 0.00 C ATOM 16505 H16R PA 448 101.258 135.124 40.264 1.00 0.00 H ATOM 16506 H16S PA 448 99.970 134.738 39.130 1.00 0.00 H ATOM 16507 H16T PA 448 101.372 133.776 39.116 1.00 0.00 H ATOM 16508 C115 PA 448 100.118 133.240 40.702 1.00 0.00 C ATOM 16509 H15R PA 448 99.308 133.619 41.327 1.00 0.00 H ATOM 16510 H15S PA 448 100.912 132.918 41.379 1.00 0.00 H ATOM 16511 C114 PA 448 99.719 132.063 39.812 1.00 0.00 C ATOM 16512 H14R PA 448 100.625 131.517 39.541 1.00 0.00 H ATOM 16513 H14S PA 448 99.308 132.306 38.830 1.00 0.00 H ATOM 16514 C113 PA 448 98.667 131.090 40.436 1.00 0.00 C ATOM 16515 H13R PA 448 98.376 130.303 39.736 1.00 0.00 H ATOM 16516 H13S PA 448 97.771 131.657 40.695 1.00 0.00 H ATOM 16517 C112 PA 448 99.217 130.363 41.678 1.00 0.00 C ATOM 16518 H12R PA 448 99.574 131.111 42.388 1.00 0.00 H ATOM 16519 H12S PA 448 100.044 129.808 41.229 1.00 0.00 H ATOM 16520 C111 PA 448 98.228 129.373 42.434 1.00 0.00 C ATOM 16521 H11R PA 448 97.869 128.516 41.860 1.00 0.00 H ATOM 16522 H11S PA 448 97.303 129.929 42.604 1.00 0.00 H ATOM 16523 C110 PA 448 98.926 129.015 43.812 1.00 0.00 C ATOM 16524 H10R PA 448 98.339 128.307 44.401 1.00 0.00 H ATOM 16525 H10S PA 448 98.772 129.912 44.415 1.00 0.00 H ATOM 16526 C19 PA 448 100.375 128.610 43.740 1.00 0.00 C ATOM 16527 H9R PA 448 100.967 129.515 43.892 1.00 0.00 H ATOM 16528 H9S PA 448 100.608 128.224 42.746 1.00 0.00 H ATOM 16529 C18 PA 448 100.862 127.723 44.925 1.00 0.00 C ATOM 16530 H8R PA 448 101.869 127.368 44.700 1.00 0.00 H ATOM 16531 H8S PA 448 100.275 126.804 44.858 1.00 0.00 H ATOM 16532 C17 PA 448 100.895 128.314 46.250 1.00 0.00 C ATOM 16533 H7R PA 448 99.909 128.741 46.439 1.00 0.00 H ATOM 16534 H7S PA 448 101.511 129.209 46.142 1.00 0.00 H ATOM 16535 C16 PA 448 101.391 127.417 47.389 1.00 0.00 C ATOM 16536 H6R PA 448 102.223 126.843 46.975 1.00 0.00 H ATOM 16537 H6S PA 448 100.667 126.645 47.658 1.00 0.00 H ATOM 16538 C15 PA 448 101.643 128.176 48.661 1.00 0.00 C ATOM 16539 H5R PA 448 100.713 128.654 48.973 1.00 0.00 H ATOM 16540 H5S PA 448 102.219 129.097 48.551 1.00 0.00 H ATOM 16541 C14 PA 448 102.141 127.316 49.819 1.00 0.00 C ATOM 16542 H4R PA 448 103.110 126.936 49.489 1.00 0.00 H ATOM 16543 H4S PA 448 101.441 126.481 49.896 1.00 0.00 H ATOM 16544 C13 PA 448 102.241 128.010 51.257 1.00 0.00 C ATOM 16545 H3R PA 448 101.197 128.127 51.554 1.00 0.00 H ATOM 16546 H3S PA 448 102.722 128.988 51.187 1.00 0.00 H ATOM 16547 C12 PA 448 103.036 127.130 52.256 1.00 0.00 C ATOM 16548 H2R PA 448 104.101 127.021 52.041 1.00 0.00 H ATOM 16549 H2S PA 448 102.637 126.169 52.587 1.00 0.00 H ATOM 16550 C11 PGR 449 103.180 127.859 53.553 1.00 0.00 C ATOM 16551 O12 PGR 449 103.193 129.094 53.623 1.00 0.00 O ATOM 16552 O11 PGR 449 103.052 127.058 54.615 1.00 0.00 O ATOM 16553 C1 PGR 449 103.021 127.563 55.966 1.00 0.00 C ATOM 16554 HR PGR 449 103.979 128.050 56.167 1.00 0.00 H ATOM 16555 HS PGR 449 102.938 126.662 56.578 1.00 0.00 H ATOM 16556 C2 PGR 449 101.845 128.453 56.362 1.00 0.00 C ATOM 16557 HX PGR 449 102.124 129.393 55.879 1.00 0.00 H ATOM 16558 C3 PGR 449 101.803 128.514 57.881 1.00 0.00 C ATOM 16559 HA PGR 449 100.899 129.119 57.996 1.00 0.00 H ATOM 16560 HB PGR 449 102.717 128.997 58.235 1.00 0.00 H ATOM 16561 O31 PGR 449 101.686 127.293 58.558 1.00 0.00 O ATOM 16562 P31 PGR 449 101.917 127.067 60.128 1.00 0.00 P ATOM 16563 O32 PGR 449 103.408 127.313 60.514 1.00 0.00 O ATOM 16564 C31 PGR 449 103.981 128.577 60.798 1.00 0.00 C ATOM 16565 H1A PGR 449 103.507 128.880 61.736 1.00 0.00 H ATOM 16566 H1B PGR 449 103.680 129.356 60.093 1.00 0.00 H ATOM 16567 C32 PGR 449 105.564 128.498 60.728 1.00 0.00 C ATOM 16568 H2A PGR 449 105.939 127.689 61.361 1.00 0.00 H ATOM 16569 O35 PGR 449 105.897 128.210 59.376 1.00 0.00 O ATOM 16570 HO5A PGR 449 105.338 127.449 59.135 1.00 0.00 H ATOM 16571 C33 PGR 449 106.201 129.865 61.036 1.00 0.00 C ATOM 16572 H3A PGR 449 105.845 130.705 60.435 1.00 0.00 H ATOM 16573 H3B PGR 449 105.928 130.072 62.074 1.00 0.00 H ATOM 16574 O33 PGR 449 101.061 128.008 60.953 1.00 0.00 O ATOM 16575 O34 PGR 449 101.631 125.624 60.400 1.00 0.00 O ATOM 16576 O21 PGR 449 100.560 127.975 55.762 1.00 0.00 O ATOM 16577 C21 PGR 449 100.038 126.722 55.904 1.00 0.00 C ATOM 16578 O22 PGR 449 100.550 125.746 56.449 1.00 0.00 O ATOM 16579 O36 PGR 449 107.618 129.785 61.003 1.00 0.00 O ATOM 16580 HO6A PGR 449 107.961 130.587 61.437 1.00 0.00 H ATOM 16581 C12 OL 450 98.752 126.515 55.148 1.00 0.00 C ATOM 16582 H2R OL 450 98.157 125.636 55.402 1.00 0.00 H ATOM 16583 H2S OL 450 98.035 127.291 55.423 1.00 0.00 H ATOM 16584 C13 OL 450 99.114 126.486 53.629 1.00 0.00 C ATOM 16585 H3R OL 450 99.701 127.372 53.377 1.00 0.00 H ATOM 16586 H3S OL 450 99.833 125.696 53.404 1.00 0.00 H ATOM 16587 C14 OL 450 97.814 126.404 52.656 1.00 0.00 C ATOM 16588 H4R OL 450 97.262 125.543 53.038 1.00 0.00 H ATOM 16589 H4S OL 450 97.136 127.256 52.745 1.00 0.00 H ATOM 16590 C15 OL 450 98.180 126.151 51.201 1.00 0.00 C ATOM 16591 H5R OL 450 98.798 126.976 50.840 1.00 0.00 H ATOM 16592 H5S OL 450 98.778 125.238 51.172 1.00 0.00 H ATOM 16593 C16 OL 450 96.989 125.950 50.287 1.00 0.00 C ATOM 16594 H6R OL 450 96.391 125.071 50.535 1.00 0.00 H ATOM 16595 H6S OL 450 96.270 126.748 50.484 1.00 0.00 H ATOM 16596 C17 OL 450 97.242 126.061 48.786 1.00 0.00 C ATOM 16597 H7R OL 450 98.154 125.541 48.484 1.00 0.00 H ATOM 16598 H7S OL 450 96.407 125.533 48.321 1.00 0.00 H ATOM 16599 C18 OL 450 97.372 127.503 48.311 1.00 0.00 C ATOM 16600 H8R OL 450 96.619 128.112 48.816 1.00 0.00 H ATOM 16601 H8S OL 450 98.306 127.892 48.722 1.00 0.00 H ATOM 16602 C19 OL 450 97.282 127.701 46.805 1.00 0.00 C ATOM 16603 H9R OL 450 98.201 127.474 46.269 1.00 0.00 H ATOM 16604 C110 OL 450 96.265 128.029 46.109 1.00 0.00 C ATOM 16605 H10R OL 450 96.473 128.076 45.043 1.00 0.00 H ATOM 16606 C111 OL 450 94.820 128.344 46.489 1.00 0.00 C ATOM 16607 H11R OL 450 94.855 128.586 47.553 1.00 0.00 H ATOM 16608 H11S OL 450 94.501 129.313 46.098 1.00 0.00 H ATOM 16609 C112 OL 450 93.899 127.185 46.089 1.00 0.00 C ATOM 16610 H12R OL 450 94.326 126.222 46.378 1.00 0.00 H ATOM 16611 H12S OL 450 92.895 127.231 46.516 1.00 0.00 H ATOM 16612 C113 OL 450 93.517 127.238 44.666 1.00 0.00 C ATOM 16613 H13R OL 450 92.961 128.088 44.264 1.00 0.00 H ATOM 16614 H13S OL 450 94.454 127.238 44.105 1.00 0.00 H ATOM 16615 C114 OL 450 92.800 125.937 44.259 1.00 0.00 C ATOM 16616 H14R OL 450 93.361 125.115 44.710 1.00 0.00 H ATOM 16617 H14S OL 450 91.815 125.923 44.730 1.00 0.00 H ATOM 16618 C115 OL 450 92.671 125.647 42.774 1.00 0.00 C ATOM 16619 H15R OL 450 92.508 126.540 42.168 1.00 0.00 H ATOM 16620 H15S OL 450 93.610 125.320 42.320 1.00 0.00 H ATOM 16621 C116 OL 450 91.523 124.654 42.465 1.00 0.00 C ATOM 16622 H16R OL 450 91.697 123.748 43.050 1.00 0.00 H ATOM 16623 H16S OL 450 90.591 125.031 42.892 1.00 0.00 H ATOM 16624 C117 OL 450 91.304 124.360 41.023 1.00 0.00 C ATOM 16625 H17R OL 450 90.910 125.251 40.529 1.00 0.00 H ATOM 16626 H17S OL 450 92.275 124.084 40.608 1.00 0.00 H ATOM 16627 C118 OL 450 90.414 123.167 40.793 1.00 0.00 C ATOM 16628 H18R OL 450 90.330 122.885 39.741 1.00 0.00 H ATOM 16629 H18S OL 450 89.423 123.281 41.237 1.00 0.00 H ATOM 16630 H18T OL 450 90.857 122.322 41.323 1.00 0.00 H TER 16631 OL 450 ATOM 16631 C116 PA 451 31.208 85.709 42.090 1.00 0.00 C ATOM 16632 H16R PA 451 31.006 86.706 42.488 1.00 0.00 H ATOM 16633 H16S PA 451 30.213 85.287 41.932 1.00 0.00 H ATOM 16634 H16T PA 451 31.705 85.786 41.121 1.00 0.00 H ATOM 16635 C115 PA 451 32.095 84.913 43.089 1.00 0.00 C ATOM 16636 H15R PA 451 32.266 83.914 42.682 1.00 0.00 H ATOM 16637 H15S PA 451 31.520 84.710 43.995 1.00 0.00 H ATOM 16638 C114 PA 451 33.385 85.616 43.581 1.00 0.00 C ATOM 16639 H14R PA 451 33.106 86.646 43.814 1.00 0.00 H ATOM 16640 H14S PA 451 34.013 85.742 42.696 1.00 0.00 H ATOM 16641 C113 PA 451 34.090 84.933 44.741 1.00 0.00 C ATOM 16642 H13R PA 451 33.314 84.720 45.480 1.00 0.00 H ATOM 16643 H13S PA 451 34.885 85.520 45.205 1.00 0.00 H ATOM 16644 C112 PA 451 34.820 83.671 44.344 1.00 0.00 C ATOM 16645 H12R PA 451 35.613 83.730 43.595 1.00 0.00 H ATOM 16646 H12S PA 451 34.120 82.942 43.932 1.00 0.00 H ATOM 16647 C111 PA 451 35.514 83.068 45.645 1.00 0.00 C ATOM 16648 H11R PA 451 34.760 82.649 46.315 1.00 0.00 H ATOM 16649 H11S PA 451 36.000 83.939 46.091 1.00 0.00 H ATOM 16650 C110 PA 451 36.663 82.079 45.305 1.00 0.00 C ATOM 16651 H10R PA 451 37.498 82.566 44.798 1.00 0.00 H ATOM 16652 H10S PA 451 36.199 81.388 44.598 1.00 0.00 H ATOM 16653 C19 PA 451 37.214 81.261 46.444 1.00 0.00 C ATOM 16654 H9R PA 451 37.833 80.437 46.083 1.00 0.00 H ATOM 16655 H9S PA 451 36.414 80.705 46.937 1.00 0.00 H ATOM 16656 C18 PA 451 37.795 82.011 47.608 1.00 0.00 C ATOM 16657 H8R PA 451 37.087 82.723 48.037 1.00 0.00 H ATOM 16658 H8S PA 451 38.637 82.606 47.251 1.00 0.00 H ATOM 16659 C17 PA 451 38.370 81.143 48.639 1.00 0.00 C ATOM 16660 H7R PA 451 39.209 80.590 48.213 1.00 0.00 H ATOM 16661 H7S PA 451 37.640 80.357 48.843 1.00 0.00 H ATOM 16662 C16 PA 451 38.897 81.919 49.931 1.00 0.00 C ATOM 16663 H6R PA 451 38.144 82.526 50.436 1.00 0.00 H ATOM 16664 H6S PA 451 39.692 82.582 49.584 1.00 0.00 H ATOM 16665 C15 PA 451 39.292 80.839 51.032 1.00 0.00 C ATOM 16666 H5R PA 451 39.732 80.023 50.454 1.00 0.00 H ATOM 16667 H5S PA 451 38.407 80.329 51.419 1.00 0.00 H ATOM 16668 C14 PA 451 40.134 81.422 52.136 1.00 0.00 C ATOM 16669 H4R PA 451 40.638 82.342 51.834 1.00 0.00 H ATOM 16670 H4S PA 451 40.892 80.756 52.553 1.00 0.00 H ATOM 16671 C13 PA 451 39.323 81.888 53.339 1.00 0.00 C ATOM 16672 H3R PA 451 38.931 81.023 53.877 1.00 0.00 H ATOM 16673 H3S PA 451 38.456 82.487 53.050 1.00 0.00 H ATOM 16674 C12 PA 451 40.025 82.873 54.260 1.00 0.00 C ATOM 16675 H2R PA 451 39.204 83.203 54.900 1.00 0.00 H ATOM 16676 H2S PA 451 40.405 83.735 53.709 1.00 0.00 H ATOM 16677 C11 PGR 452 41.145 82.311 55.100 1.00 0.00 C ATOM 16678 O12 PGR 452 41.773 83.002 55.880 1.00 0.00 O ATOM 16679 O11 PGR 452 41.227 80.967 54.966 1.00 0.00 O ATOM 16680 C1 PGR 452 42.105 80.284 55.855 1.00 0.00 C ATOM 16681 HR PGR 452 42.920 80.925 56.201 1.00 0.00 H ATOM 16682 HS PGR 452 42.513 79.413 55.336 1.00 0.00 H ATOM 16683 C2 PGR 452 41.150 79.931 57.029 1.00 0.00 C ATOM 16684 HX PGR 452 40.432 80.745 57.160 1.00 0.00 H ATOM 16685 C3 PGR 452 41.860 79.634 58.366 1.00 0.00 C ATOM 16686 HA PGR 452 42.673 80.348 58.519 1.00 0.00 H ATOM 16687 HB PGR 452 42.144 78.582 58.449 1.00 0.00 H ATOM 16688 O31 PGR 452 40.960 79.920 59.389 1.00 0.00 O ATOM 16689 P31 PGR 452 41.186 79.411 60.983 1.00 0.00 P ATOM 16690 O32 PGR 452 41.184 77.834 60.906 1.00 0.00 O ATOM 16691 C31 PGR 452 39.939 77.141 60.968 1.00 0.00 C ATOM 16692 H1A PGR 452 39.377 77.379 60.061 1.00 0.00 H ATOM 16693 H1B PGR 452 39.456 77.494 61.882 1.00 0.00 H ATOM 16694 C32 PGR 452 40.377 75.677 61.144 1.00 0.00 C ATOM 16695 H2A PGR 452 41.194 75.719 61.869 1.00 0.00 H ATOM 16696 O35 PGR 452 40.822 75.171 59.848 1.00 0.00 O ATOM 16697 HO5A PGR 452 41.595 75.716 59.617 1.00 0.00 H ATOM 16698 C33 PGR 452 39.129 74.962 61.516 1.00 0.00 C ATOM 16699 H3A PGR 452 38.583 75.591 62.224 1.00 0.00 H ATOM 16700 H3B PGR 452 38.472 74.769 60.665 1.00 0.00 H ATOM 16701 O33 PGR 452 42.595 79.730 61.416 1.00 0.00 O ATOM 16702 O34 PGR 452 40.170 79.850 61.934 1.00 0.00 O ATOM 16703 O21 PGR 452 40.455 78.752 56.667 1.00 0.00 O ATOM 16704 C21 PGR 452 39.134 78.635 56.964 1.00 0.00 C ATOM 16705 O22 PGR 452 38.519 79.327 57.733 1.00 0.00 O ATOM 16706 O36 PGR 452 39.457 73.657 62.022 1.00 0.00 O ATOM 16707 HO6A PGR 452 38.612 73.314 62.365 1.00 0.00 H ATOM 16708 C12 OL 453 38.418 77.563 56.228 1.00 0.00 C ATOM 16709 H2R OL 453 37.349 77.788 56.204 1.00 0.00 H ATOM 16710 H2S OL 453 38.745 77.446 55.193 1.00 0.00 H ATOM 16711 C13 OL 453 38.763 76.259 56.946 1.00 0.00 C ATOM 16712 H3R OL 453 39.837 76.131 57.096 1.00 0.00 H ATOM 16713 H3S OL 453 38.444 76.363 57.986 1.00 0.00 H ATOM 16714 C14 OL 453 38.286 74.965 56.252 1.00 0.00 C ATOM 16715 H4R OL 453 37.233 75.096 55.992 1.00 0.00 H ATOM 16716 H4S OL 453 38.876 74.791 55.350 1.00 0.00 H ATOM 16717 C15 OL 453 38.424 73.775 57.219 1.00 0.00 C ATOM 16718 H5R OL 453 39.306 73.651 57.851 1.00 0.00 H ATOM 16719 H5S OL 453 37.610 73.799 57.946 1.00 0.00 H ATOM 16720 C16 OL 453 38.409 72.434 56.473 1.00 0.00 C ATOM 16721 H6R OL 453 37.950 71.631 57.053 1.00 0.00 H ATOM 16722 H6S OL 453 37.681 72.603 55.677 1.00 0.00 H ATOM 16723 C17 OL 453 39.770 71.842 56.013 1.00 0.00 C ATOM 16724 H7R OL 453 40.182 72.691 55.465 1.00 0.00 H ATOM 16725 H7S OL 453 40.432 71.653 56.860 1.00 0.00 H ATOM 16726 C18 OL 453 39.654 70.736 55.030 1.00 0.00 C ATOM 16727 H8R OL 453 40.631 70.263 54.914 1.00 0.00 H ATOM 16728 H8S OL 453 39.111 69.951 55.560 1.00 0.00 H ATOM 16729 C19 OL 453 39.082 71.039 53.722 1.00 0.00 C ATOM 16730 H9R OL 453 38.000 70.941 53.723 1.00 0.00 H ATOM 16731 C110 OL 453 39.671 71.320 52.539 1.00 0.00 C ATOM 16732 H10R OL 453 39.040 71.538 51.681 1.00 0.00 H ATOM 16733 C111 OL 453 41.145 71.422 52.237 1.00 0.00 C ATOM 16734 H11R OL 453 41.651 71.353 53.202 1.00 0.00 H ATOM 16735 H11S OL 453 41.509 70.506 51.768 1.00 0.00 H ATOM 16736 C112 OL 453 41.585 72.706 51.446 1.00 0.00 C ATOM 16737 H12R OL 453 41.341 73.576 52.058 1.00 0.00 H ATOM 16738 H12S OL 453 42.637 72.498 51.239 1.00 0.00 H ATOM 16739 C113 OL 453 40.821 72.786 50.067 1.00 0.00 C ATOM 16740 H13R OL 453 40.841 71.746 49.735 1.00 0.00 H ATOM 16741 H13S OL 453 39.738 72.887 50.166 1.00 0.00 H ATOM 16742 C114 OL 453 41.457 73.525 48.937 1.00 0.00 C ATOM 16743 H14R OL 453 40.978 73.246 47.996 1.00 0.00 H ATOM 16744 H14S OL 453 41.305 74.607 48.951 1.00 0.00 H ATOM 16745 C115 OL 453 42.951 73.368 48.812 1.00 0.00 C ATOM 16746 H15R OL 453 43.603 73.956 49.462 1.00 0.00 H ATOM 16747 H15S OL 453 43.320 72.358 49.001 1.00 0.00 H ATOM 16748 C116 OL 453 43.433 73.804 47.416 1.00 0.00 C ATOM 16749 H16R OL 453 42.962 74.690 46.986 1.00 0.00 H ATOM 16750 H16S OL 453 44.432 74.185 47.637 1.00 0.00 H ATOM 16751 C117 OL 453 43.611 72.552 46.469 1.00 0.00 C ATOM 16752 H17R OL 453 44.354 71.848 46.847 1.00 0.00 H ATOM 16753 H17S OL 453 42.682 72.006 46.289 1.00 0.00 H ATOM 16754 C118 OL 453 44.155 73.047 45.107 1.00 0.00 C ATOM 16755 H18R OL 453 43.475 73.752 44.625 1.00 0.00 H ATOM 16756 H18S OL 453 44.254 72.229 44.390 1.00 0.00 H ATOM 16757 H18T OL 453 45.156 73.485 45.126 1.00 0.00 H TER 16758 OL 453 ATOM 16758 C116 PA 454 94.287 39.891 43.996 1.00 0.00 C ATOM 16759 H16R PA 454 94.520 40.865 43.560 1.00 0.00 H ATOM 16760 H16S PA 454 94.959 39.220 43.456 1.00 0.00 H ATOM 16761 H16T PA 454 94.754 39.968 44.980 1.00 0.00 H ATOM 16762 C115 PA 454 92.820 39.528 43.881 1.00 0.00 C ATOM 16763 H15R PA 454 92.668 38.505 44.233 1.00 0.00 H ATOM 16764 H15S PA 454 92.689 39.502 42.797 1.00 0.00 H ATOM 16765 C114 PA 454 91.912 40.548 44.541 1.00 0.00 C ATOM 16766 H14R PA 454 92.332 41.555 44.520 1.00 0.00 H ATOM 16767 H14S PA 454 91.914 40.275 45.599 1.00 0.00 H ATOM 16768 C113 PA 454 90.497 40.675 44.043 1.00 0.00 C ATOM 16769 H13R PA 454 89.989 39.712 44.135 1.00 0.00 H ATOM 16770 H13S PA 454 90.505 41.042 43.014 1.00 0.00 H ATOM 16771 C112 PA 454 89.592 41.649 44.859 1.00 0.00 C ATOM 16772 H12R PA 454 88.627 41.537 44.360 1.00 0.00 H ATOM 16773 H12S PA 454 90.033 42.648 44.866 1.00 0.00 H ATOM 16774 C111 PA 454 89.510 41.355 46.408 1.00 0.00 C ATOM 16775 H11R PA 454 88.799 42.088 46.797 1.00 0.00 H ATOM 16776 H11S PA 454 90.505 41.528 46.823 1.00 0.00 H ATOM 16777 C110 PA 454 89.113 39.911 46.615 1.00 0.00 C ATOM 16778 H10R PA 454 89.593 39.186 45.954 1.00 0.00 H ATOM 16779 H10S PA 454 88.036 39.856 46.444 1.00 0.00 H ATOM 16780 C19 PA 454 89.448 39.379 48.043 1.00 0.00 C ATOM 16781 H9R PA 454 89.365 40.195 48.764 1.00 0.00 H ATOM 16782 H9S PA 454 90.430 38.924 48.185 1.00 0.00 H ATOM 16783 C18 PA 454 88.491 38.309 48.467 1.00 0.00 C ATOM 16784 H8R PA 454 88.644 37.381 47.912 1.00 0.00 H ATOM 16785 H8S PA 454 87.541 38.689 48.085 1.00 0.00 H ATOM 16786 C17 PA 454 88.524 38.107 49.924 1.00 0.00 C ATOM 16787 H7R PA 454 88.737 39.051 50.431 1.00 0.00 H ATOM 16788 H7S PA 454 89.354 37.424 50.114 1.00 0.00 H ATOM 16789 C16 PA 454 87.199 37.731 50.633 1.00 0.00 C ATOM 16790 H6R PA 454 86.706 36.906 50.114 1.00 0.00 H ATOM 16791 H6S PA 454 86.530 38.594 50.607 1.00 0.00 H ATOM 16792 C15 PA 454 87.357 37.256 52.096 1.00 0.00 C ATOM 16793 H5R PA 454 87.698 37.947 52.870 1.00 0.00 H ATOM 16794 H5S PA 454 88.175 36.532 52.113 1.00 0.00 H ATOM 16795 C14 PA 454 86.239 36.368 52.635 1.00 0.00 C ATOM 16796 H4R PA 454 86.087 35.672 51.807 1.00 0.00 H ATOM 16797 H4S PA 454 85.307 36.936 52.661 1.00 0.00 H ATOM 16798 C13 PA 454 86.444 35.668 53.949 1.00 0.00 C ATOM 16799 H3R PA 454 86.829 36.398 54.664 1.00 0.00 H ATOM 16800 H3S PA 454 87.207 34.893 53.859 1.00 0.00 H ATOM 16801 C12 PA 454 85.231 34.916 54.452 1.00 0.00 C ATOM 16802 H2R PA 454 85.543 34.200 55.215 1.00 0.00 H ATOM 16803 H2S PA 454 84.706 34.375 53.661 1.00 0.00 H ATOM 16804 C11 PGR 455 84.270 35.765 55.276 1.00 0.00 C ATOM 16805 O12 PGR 455 84.189 35.881 56.472 1.00 0.00 O ATOM 16806 O11 PGR 455 83.289 36.299 54.477 1.00 0.00 O ATOM 16807 C1 PGR 455 82.259 37.041 55.232 1.00 0.00 C ATOM 16808 HR PGR 455 81.887 36.428 56.057 1.00 0.00 H ATOM 16809 HS PGR 455 81.486 37.274 54.496 1.00 0.00 H ATOM 16810 C2 PGR 455 82.843 38.413 55.760 1.00 0.00 C ATOM 16811 HX PGR 455 83.759 38.214 56.322 1.00 0.00 H ATOM 16812 C3 PGR 455 81.797 39.095 56.652 1.00 0.00 C ATOM 16813 HA PGR 455 81.732 38.476 57.551 1.00 0.00 H ATOM 16814 HB PGR 455 80.792 39.122 56.223 1.00 0.00 H ATOM 16815 O31 PGR 455 82.208 40.411 56.978 1.00 0.00 O ATOM 16816 P31 PGR 455 81.387 41.303 58.015 1.00 0.00 P ATOM 16817 O32 PGR 455 79.901 41.239 57.401 1.00 0.00 O ATOM 16818 C31 PGR 455 79.563 41.855 56.127 1.00 0.00 C ATOM 16819 H1A PGR 455 80.276 41.532 55.364 1.00 0.00 H ATOM 16820 H1B PGR 455 79.693 42.933 56.253 1.00 0.00 H ATOM 16821 C32 PGR 455 78.094 41.574 55.727 1.00 0.00 C ATOM 16822 H2A PGR 455 77.998 41.898 54.687 1.00 0.00 H ATOM 16823 O35 PGR 455 77.277 42.373 56.560 1.00 0.00 O ATOM 16824 HO5A PGR 455 77.501 42.053 57.452 1.00 0.00 H ATOM 16825 C33 PGR 455 77.626 40.101 55.768 1.00 0.00 C ATOM 16826 H3A PGR 455 76.542 40.063 55.629 1.00 0.00 H ATOM 16827 H3B PGR 455 78.256 39.540 55.074 1.00 0.00 H ATOM 16828 O33 PGR 455 81.378 40.549 59.284 1.00 0.00 O ATOM 16829 O34 PGR 455 81.888 42.681 58.007 1.00 0.00 O ATOM 16830 O21 PGR 455 83.225 39.237 54.615 1.00 0.00 O ATOM 16831 C21 PGR 455 84.410 39.187 54.182 1.00 0.00 C ATOM 16832 O22 PGR 455 85.315 38.466 54.555 1.00 0.00 O ATOM 16833 O36 PGR 455 77.899 39.677 57.097 1.00 0.00 O ATOM 16834 HO6A PGR 455 78.834 39.922 57.214 1.00 0.00 H ATOM 16835 C12 OL 456 84.757 40.147 53.063 1.00 0.00 C ATOM 16836 H2R OL 456 84.518 41.134 53.466 1.00 0.00 H ATOM 16837 H2S OL 456 85.815 39.941 52.889 1.00 0.00 H ATOM 16838 C13 OL 456 83.841 39.771 51.818 1.00 0.00 C ATOM 16839 H3R OL 456 83.910 38.694 51.655 1.00 0.00 H ATOM 16840 H3S OL 456 82.836 40.014 52.168 1.00 0.00 H ATOM 16841 C14 OL 456 84.347 40.407 50.578 1.00 0.00 C ATOM 16842 H4R OL 456 84.108 41.473 50.579 1.00 0.00 H ATOM 16843 H4S OL 456 85.437 40.345 50.596 1.00 0.00 H ATOM 16844 C15 OL 456 83.763 39.858 49.283 1.00 0.00 C ATOM 16845 H5R OL 456 84.401 40.207 48.468 1.00 0.00 H ATOM 16846 H5S OL 456 83.829 38.778 49.137 1.00 0.00 H ATOM 16847 C16 OL 456 82.412 40.458 49.034 1.00 0.00 C ATOM 16848 H6R OL 456 81.862 40.358 49.971 1.00 0.00 H ATOM 16849 H6S OL 456 82.597 41.521 48.866 1.00 0.00 H ATOM 16850 C17 OL 456 81.486 39.660 48.052 1.00 0.00 C ATOM 16851 H7R OL 456 81.499 38.598 48.306 1.00 0.00 H ATOM 16852 H7S OL 456 80.440 39.970 48.093 1.00 0.00 H ATOM 16853 C18 OL 456 81.830 39.847 46.623 1.00 0.00 C ATOM 16854 H8R OL 456 82.909 39.732 46.499 1.00 0.00 H ATOM 16855 H8S OL 456 81.297 39.060 46.084 1.00 0.00 H ATOM 16856 C19 OL 456 81.402 41.145 46.058 1.00 0.00 C ATOM 16857 H9R OL 456 80.411 41.383 46.433 1.00 0.00 H ATOM 16858 C110 OL 456 82.039 41.851 45.121 1.00 0.00 C ATOM 16859 H10R OL 456 81.406 42.639 44.723 1.00 0.00 H ATOM 16860 C111 OL 456 83.462 41.594 44.596 1.00 0.00 C ATOM 16861 H11R OL 456 83.882 42.584 44.785 1.00 0.00 H ATOM 16862 H11S OL 456 84.085 40.961 45.232 1.00 0.00 H ATOM 16863 C112 OL 456 83.567 41.337 43.056 1.00 0.00 C ATOM 16864 H12R OL 456 83.065 40.381 42.894 1.00 0.00 H ATOM 16865 H12S OL 456 82.968 42.086 42.533 1.00 0.00 H ATOM 16866 C113 OL 456 84.997 41.370 42.459 1.00 0.00 C ATOM 16867 H13R OL 456 85.054 42.364 42.009 1.00 0.00 H ATOM 16868 H13S OL 456 85.718 41.147 43.247 1.00 0.00 H ATOM 16869 C114 OL 456 85.154 40.316 41.391 1.00 0.00 C ATOM 16870 H14R OL 456 86.156 40.409 40.966 1.00 0.00 H ATOM 16871 H14S OL 456 85.205 39.395 41.977 1.00 0.00 H ATOM 16872 C115 OL 456 84.139 40.121 40.290 1.00 0.00 C ATOM 16873 H15R OL 456 84.403 39.192 39.781 1.00 0.00 H ATOM 16874 H15S OL 456 83.214 39.843 40.800 1.00 0.00 H ATOM 16875 C116 OL 456 84.060 41.346 39.315 1.00 0.00 C ATOM 16876 H16R OL 456 84.021 42.331 39.785 1.00 0.00 H ATOM 16877 H16S OL 456 84.986 41.250 38.744 1.00 0.00 H ATOM 16878 C117 OL 456 82.957 41.126 38.226 1.00 0.00 C ATOM 16879 H17R OL 456 83.358 41.630 37.344 1.00 0.00 H ATOM 16880 H17S OL 456 82.953 40.086 37.892 1.00 0.00 H ATOM 16881 C118 OL 456 81.510 41.606 38.602 1.00 0.00 C ATOM 16882 H18R OL 456 81.568 42.588 39.075 1.00 0.00 H ATOM 16883 H18S OL 456 81.093 40.968 39.384 1.00 0.00 H ATOM 16884 H18T OL 456 80.846 41.751 37.748 1.00 0.00 H TER 16885 OL 456 ATOM 16885 C116 PA 457 58.051 29.585 40.145 1.00 0.00 C ATOM 16886 H16R PA 457 57.943 29.259 41.182 1.00 0.00 H ATOM 16887 H16S PA 457 59.124 29.667 39.958 1.00 0.00 H ATOM 16888 H16T PA 457 57.628 28.804 39.510 1.00 0.00 H ATOM 16889 C115 PA 457 57.407 30.918 39.788 1.00 0.00 C ATOM 16890 H15R PA 457 56.364 30.613 39.893 1.00 0.00 H ATOM 16891 H15S PA 457 57.600 31.138 38.735 1.00 0.00 H ATOM 16892 C114 PA 457 57.964 31.878 40.744 1.00 0.00 C ATOM 16893 H14R PA 457 59.031 31.688 40.610 1.00 0.00 H ATOM 16894 H14S PA 457 57.728 31.681 41.792 1.00 0.00 H ATOM 16895 C113 PA 457 57.490 33.281 40.414 1.00 0.00 C ATOM 16896 H13R PA 457 56.469 33.378 40.790 1.00 0.00 H ATOM 16897 H13S PA 457 57.541 33.364 39.326 1.00 0.00 H ATOM 16898 C112 PA 457 58.270 34.452 41.022 1.00 0.00 C ATOM 16899 H12R PA 457 58.156 35.352 40.414 1.00 0.00 H ATOM 16900 H12S PA 457 59.336 34.222 41.075 1.00 0.00 H ATOM 16901 C111 PA 457 57.656 34.835 42.382 1.00 0.00 C ATOM 16902 H11R PA 457 57.561 34.032 43.116 1.00 0.00 H ATOM 16903 H11S PA 457 56.679 35.279 42.182 1.00 0.00 H ATOM 16904 C110 PA 457 58.575 35.814 43.041 1.00 0.00 C ATOM 16905 H10R PA 457 58.779 36.644 42.361 1.00 0.00 H ATOM 16906 H10S PA 457 59.592 35.422 42.971 1.00 0.00 H ATOM 16907 C19 PA 457 58.284 36.266 44.543 1.00 0.00 C ATOM 16908 H9R PA 457 58.546 35.354 45.084 1.00 0.00 H ATOM 16909 H9S PA 457 57.196 36.234 44.638 1.00 0.00 H ATOM 16910 C18 PA 457 58.723 37.520 45.217 1.00 0.00 C ATOM 16911 H8R PA 457 58.350 38.435 44.752 1.00 0.00 H ATOM 16912 H8S PA 457 59.796 37.609 45.035 1.00 0.00 H ATOM 16913 C17 PA 457 58.496 37.548 46.714 1.00 0.00 C ATOM 16914 H7R PA 457 58.744 36.574 47.142 1.00 0.00 H ATOM 16915 H7S PA 457 57.451 37.597 47.026 1.00 0.00 H ATOM 16916 C16 PA 457 59.228 38.579 47.528 1.00 0.00 C ATOM 16917 H6R PA 457 59.224 39.450 46.869 1.00 0.00 H ATOM 16918 H6S PA 457 60.287 38.349 47.389 1.00 0.00 H ATOM 16919 C15 PA 457 58.509 38.933 48.831 1.00 0.00 C ATOM 16920 H5R PA 457 58.171 38.018 49.321 1.00 0.00 H ATOM 16921 H5S PA 457 57.612 39.523 48.631 1.00 0.00 H ATOM 16922 C14 PA 457 59.452 39.755 49.675 1.00 0.00 C ATOM 16923 H4R PA 457 59.884 40.608 49.147 1.00 0.00 H ATOM 16924 H4S PA 457 60.296 39.126 49.964 1.00 0.00 H ATOM 16925 C13 PA 457 58.815 40.392 50.881 1.00 0.00 C ATOM 16926 H3R PA 457 57.956 41.021 50.637 1.00 0.00 H ATOM 16927 H3S PA 457 59.568 41.074 51.281 1.00 0.00 H ATOM 16928 C12 PA 457 58.427 39.384 51.956 1.00 0.00 C ATOM 16929 H2R PA 457 59.295 38.805 52.278 1.00 0.00 H ATOM 16930 H2S PA 457 57.694 38.672 51.569 1.00 0.00 H ATOM 16931 C11 PGR 458 57.796 40.139 53.128 1.00 0.00 C ATOM 16932 O12 PGR 458 57.895 41.345 53.264 1.00 0.00 O ATOM 16933 O11 PGR 458 57.053 39.287 53.952 1.00 0.00 O ATOM 16934 C1 PGR 458 56.224 39.899 55.023 1.00 0.00 C ATOM 16935 HR PGR 458 55.657 40.722 54.579 1.00 0.00 H ATOM 16936 HS PGR 458 56.862 40.518 55.659 1.00 0.00 H ATOM 16937 C2 PGR 458 55.324 38.899 55.877 1.00 0.00 C ATOM 16938 HX PGR 458 54.903 39.445 56.725 1.00 0.00 H ATOM 16939 C3 PGR 458 56.353 37.860 56.367 1.00 0.00 C ATOM 16940 HA PGR 458 57.251 38.269 56.838 1.00 0.00 H ATOM 16941 HB PGR 458 56.653 37.214 55.538 1.00 0.00 H ATOM 16942 O31 PGR 458 55.705 37.034 57.282 1.00 0.00 O ATOM 16943 P31 PGR 458 56.553 35.700 57.800 1.00 0.00 P ATOM 16944 O32 PGR 458 56.566 34.820 56.403 1.00 0.00 O ATOM 16945 C31 PGR 458 55.411 34.311 55.850 1.00 0.00 C ATOM 16946 H1A PGR 458 54.687 35.109 55.668 1.00 0.00 H ATOM 16947 H1B PGR 458 54.885 33.570 56.458 1.00 0.00 H ATOM 16948 C32 PGR 458 55.652 33.567 54.483 1.00 0.00 C ATOM 16949 H2A PGR 458 54.684 33.242 54.093 1.00 0.00 H ATOM 16950 O35 PGR 458 56.500 32.388 54.836 1.00 0.00 O ATOM 16951 HO5A PGR 458 56.102 31.835 55.532 1.00 0.00 H ATOM 16952 C33 PGR 458 56.354 34.420 53.411 1.00 0.00 C ATOM 16953 H3A PGR 458 55.767 35.325 53.234 1.00 0.00 H ATOM 16954 H3B PGR 458 57.205 34.776 53.997 1.00 0.00 H ATOM 16955 O33 PGR 458 58.017 36.036 58.129 1.00 0.00 O ATOM 16956 O34 PGR 458 55.768 34.948 58.751 1.00 0.00 O ATOM 16957 O21 PGR 458 54.274 38.207 55.123 1.00 0.00 O ATOM 16958 C21 PGR 458 53.146 38.907 54.752 1.00 0.00 C ATOM 16959 O22 PGR 458 52.839 40.098 54.941 1.00 0.00 O ATOM 16960 O36 PGR 458 56.679 33.878 52.114 1.00 0.00 O ATOM 16961 HO6A PGR 458 55.878 33.466 51.742 1.00 0.00 H ATOM 16962 C12 OL 459 52.175 38.038 53.997 1.00 0.00 C ATOM 16963 H2R OL 459 52.608 37.038 53.919 1.00 0.00 H ATOM 16964 H2S OL 459 51.188 38.018 54.465 1.00 0.00 H ATOM 16965 C13 OL 459 52.009 38.593 52.577 1.00 0.00 C ATOM 16966 H3R OL 459 51.355 39.467 52.580 1.00 0.00 H ATOM 16967 H3S OL 459 53.005 38.829 52.197 1.00 0.00 H ATOM 16968 C14 OL 459 51.467 37.436 51.724 1.00 0.00 C ATOM 16969 H4R OL 459 52.061 36.520 51.693 1.00 0.00 H ATOM 16970 H4S OL 459 50.530 37.095 52.169 1.00 0.00 H ATOM 16971 C15 OL 459 51.108 37.944 50.390 1.00 0.00 C ATOM 16972 H5R OL 459 50.384 38.757 50.475 1.00 0.00 H ATOM 16973 H5S OL 459 51.889 38.496 49.862 1.00 0.00 H ATOM 16974 C16 OL 459 50.353 36.953 49.550 1.00 0.00 C ATOM 16975 H6R OL 459 51.095 36.175 49.361 1.00 0.00 H ATOM 16976 H6S OL 459 49.510 36.666 50.182 1.00 0.00 H ATOM 16977 C17 OL 459 49.756 37.428 48.230 1.00 0.00 C ATOM 16978 H7R OL 459 48.865 38.046 48.358 1.00 0.00 H ATOM 16979 H7S OL 459 50.512 38.097 47.815 1.00 0.00 H ATOM 16980 C18 OL 459 49.442 36.367 47.253 1.00 0.00 C ATOM 16981 H8R OL 459 50.354 35.782 47.118 1.00 0.00 H ATOM 16982 H8S OL 459 48.688 35.780 47.782 1.00 0.00 H ATOM 16983 C19 OL 459 49.058 36.907 45.933 1.00 0.00 C ATOM 16984 H9R OL 459 47.982 37.053 45.892 1.00 0.00 H ATOM 16985 C110 OL 459 49.792 36.952 44.804 1.00 0.00 C ATOM 16986 H10R OL 459 49.339 37.304 43.881 1.00 0.00 H ATOM 16987 C111 OL 459 51.316 36.811 44.631 1.00 0.00 C ATOM 16988 H11R OL 459 51.808 37.394 45.412 1.00 0.00 H ATOM 16989 H11S OL 459 51.718 35.799 44.714 1.00 0.00 H ATOM 16990 C112 OL 459 51.727 37.186 43.142 1.00 0.00 C ATOM 16991 H12R OL 459 51.087 36.576 42.502 1.00 0.00 H ATOM 16992 H12S OL 459 51.496 38.251 43.063 1.00 0.00 H ATOM 16993 C113 OL 459 53.148 36.884 42.690 1.00 0.00 C ATOM 16994 H13R OL 459 53.795 37.522 43.297 1.00 0.00 H ATOM 16995 H13S OL 459 53.384 35.857 42.977 1.00 0.00 H ATOM 16996 C114 OL 459 53.507 37.360 41.258 1.00 0.00 C ATOM 16997 H14R OL 459 52.956 38.213 40.857 1.00 0.00 H ATOM 16998 H14S OL 459 54.479 37.826 41.432 1.00 0.00 H ATOM 16999 C115 OL 459 53.766 36.241 40.273 1.00 0.00 C ATOM 17000 H15R OL 459 54.073 36.744 39.354 1.00 0.00 H ATOM 17001 H15S OL 459 54.648 35.639 40.499 1.00 0.00 H ATOM 17002 C116 OL 459 52.548 35.319 40.085 1.00 0.00 C ATOM 17003 H16R OL 459 52.195 35.114 41.098 1.00 0.00 H ATOM 17004 H16S OL 459 51.674 35.763 39.604 1.00 0.00 H ATOM 17005 C117 OL 459 52.910 34.026 39.244 1.00 0.00 C ATOM 17006 H17R OL 459 53.290 34.234 38.242 1.00 0.00 H ATOM 17007 H17S OL 459 53.608 33.291 39.649 1.00 0.00 H ATOM 17008 C118 OL 459 51.628 33.269 38.917 1.00 0.00 C ATOM 17009 H18R OL 459 51.299 32.867 39.878 1.00 0.00 H ATOM 17010 H18S OL 459 51.903 32.414 38.295 1.00 0.00 H ATOM 17011 H18T OL 459 50.800 33.789 38.430 1.00 0.00 H TER 17012 OL 459 ATOM 17012 C116 PA 460 73.077 90.874 42.434 1.00 0.00 C ATOM 17013 H16R PA 460 72.132 90.445 42.094 1.00 0.00 H ATOM 17014 H16S PA 460 72.873 91.941 42.548 1.00 0.00 H ATOM 17015 H16T PA 460 73.349 90.429 43.394 1.00 0.00 H ATOM 17016 C115 PA 460 74.235 90.654 41.483 1.00 0.00 C ATOM 17017 H15R PA 460 73.803 91.047 40.560 1.00 0.00 H ATOM 17018 H15S PA 460 74.308 89.565 41.519 1.00 0.00 H ATOM 17019 C114 PA 460 75.523 91.277 41.934 1.00 0.00 C ATOM 17020 H14R PA 460 75.486 92.362 41.815 1.00 0.00 H ATOM 17021 H14S PA 460 76.128 91.020 41.063 1.00 0.00 H ATOM 17022 C113 PA 460 76.263 90.910 43.273 1.00 0.00 C ATOM 17023 H13R PA 460 75.591 91.290 44.045 1.00 0.00 H ATOM 17024 H13S PA 460 77.075 91.624 43.428 1.00 0.00 H ATOM 17025 C112 PA 460 76.668 89.470 43.556 1.00 0.00 C ATOM 17026 H12R PA 460 77.362 89.076 42.810 1.00 0.00 H ATOM 17027 H12S PA 460 75.774 88.855 43.445 1.00 0.00 H ATOM 17028 C111 PA 460 77.204 89.235 44.950 1.00 0.00 C ATOM 17029 H11R PA 460 78.168 89.745 44.990 1.00 0.00 H ATOM 17030 H11S PA 460 77.461 88.174 44.924 1.00 0.00 H ATOM 17031 C110 PA 460 76.290 89.726 46.027 1.00 0.00 C ATOM 17032 H10R PA 460 75.287 89.447 45.696 1.00 0.00 H ATOM 17033 H10S PA 460 76.305 90.806 46.187 1.00 0.00 H ATOM 17034 C19 PA 460 76.506 88.921 47.321 1.00 0.00 C ATOM 17035 H9R PA 460 76.424 87.858 47.086 1.00 0.00 H ATOM 17036 H9S PA 460 75.646 88.908 47.994 1.00 0.00 H ATOM 17037 C18 PA 460 77.774 89.243 48.160 1.00 0.00 C ATOM 17038 H8R PA 460 78.579 89.208 47.423 1.00 0.00 H ATOM 17039 H8S PA 460 77.829 88.370 48.814 1.00 0.00 H ATOM 17040 C17 PA 460 77.626 90.529 48.974 1.00 0.00 C ATOM 17041 H7R PA 460 76.731 90.346 49.573 1.00 0.00 H ATOM 17042 H7S PA 460 77.469 91.456 48.418 1.00 0.00 H ATOM 17043 C16 PA 460 78.781 90.826 49.904 1.00 0.00 C ATOM 17044 H6R PA 460 79.727 90.787 49.360 1.00 0.00 H ATOM 17045 H6S PA 460 79.008 90.034 50.620 1.00 0.00 H ATOM 17046 C15 PA 460 78.858 92.131 50.552 1.00 0.00 C ATOM 17047 H5R PA 460 78.077 92.094 51.314 1.00 0.00 H ATOM 17048 H5S PA 460 78.559 92.920 49.858 1.00 0.00 H ATOM 17049 C14 PA 460 80.197 92.499 51.095 1.00 0.00 C ATOM 17050 H4R PA 460 80.826 92.761 50.242 1.00 0.00 H ATOM 17051 H4S PA 460 80.709 91.637 51.529 1.00 0.00 H ATOM 17052 C13 PA 460 80.248 93.590 52.200 1.00 0.00 C ATOM 17053 H3R PA 460 79.478 93.350 52.935 1.00 0.00 H ATOM 17054 H3S PA 460 80.070 94.610 51.852 1.00 0.00 H ATOM 17055 C12 PA 460 81.629 93.772 52.842 1.00 0.00 C ATOM 17056 H2R PA 460 82.416 94.183 52.206 1.00 0.00 H ATOM 17057 H2S PA 460 82.053 92.806 53.126 1.00 0.00 H ATOM 17058 C11 PC 461 81.388 94.619 54.082 1.00 0.00 C ATOM 17059 O12 PC 461 81.532 94.228 55.199 1.00 0.00 O ATOM 17060 O11 PC 461 81.017 95.865 53.795 1.00 0.00 O ATOM 17061 C1 PC 461 80.851 96.738 54.956 1.00 0.00 C ATOM 17062 HR PC 461 80.090 96.268 55.584 1.00 0.00 H ATOM 17063 HS PC 461 80.640 97.704 54.490 1.00 0.00 H ATOM 17064 C2 PC 461 82.170 97.086 55.688 1.00 0.00 C ATOM 17065 HX PC 461 82.901 96.297 55.495 1.00 0.00 H ATOM 17066 C3 PC 461 81.838 97.072 57.223 1.00 0.00 C ATOM 17067 HA PC 461 81.305 96.151 57.473 1.00 0.00 H ATOM 17068 HB PC 461 81.282 97.914 57.643 1.00 0.00 H ATOM 17069 O31 PC 461 83.146 96.996 57.831 1.00 0.00 O ATOM 17070 P31 PC 461 83.199 96.911 59.376 1.00 0.00 P ATOM 17071 O32 PC 461 83.460 98.378 59.819 1.00 0.00 O ATOM 17072 C31 PC 461 82.460 99.338 59.784 1.00 0.00 C ATOM 17073 H1A PC 461 81.508 98.824 59.939 1.00 0.00 H ATOM 17074 H1B PC 461 82.524 99.816 58.803 1.00 0.00 H ATOM 17075 C32 PC 461 82.534 100.378 60.936 1.00 0.00 C ATOM 17076 H2A PC 461 81.978 101.291 60.718 1.00 0.00 H ATOM 17077 H2B PC 461 83.558 100.748 61.004 1.00 0.00 H ATOM 17078 N31 PC 461 82.343 99.902 62.386 1.00 0.00 N ATOM 17079 C33 PC 461 83.102 98.666 62.676 1.00 0.00 C ATOM 17080 H3A PC 461 82.636 97.704 62.457 1.00 0.00 H ATOM 17081 H3B PC 461 83.434 98.698 63.714 1.00 0.00 H ATOM 17082 H3C PC 461 83.976 98.692 62.023 1.00 0.00 H ATOM 17083 C34 PC 461 82.969 100.927 63.307 1.00 0.00 C ATOM 17084 H4A PC 461 82.481 101.892 63.163 1.00 0.00 H ATOM 17085 H4B PC 461 84.050 100.994 63.174 1.00 0.00 H ATOM 17086 H4C PC 461 82.796 100.418 64.256 1.00 0.00 H ATOM 17087 C35 PC 461 80.897 99.680 62.622 1.00 0.00 C ATOM 17088 H5A PC 461 80.487 100.690 62.571 1.00 0.00 H ATOM 17089 H5B PC 461 80.687 99.272 63.612 1.00 0.00 H ATOM 17090 H5C PC 461 80.591 99.083 61.761 1.00 0.00 H ATOM 17091 O33 PC 461 81.907 96.539 59.898 1.00 0.00 O ATOM 17092 O34 PC 461 84.343 96.114 59.825 1.00 0.00 O ATOM 17093 O21 PC 461 82.654 98.378 55.305 1.00 0.00 O ATOM 17094 C21 PC 461 83.296 98.632 54.159 1.00 0.00 C ATOM 17095 O22 PC 461 83.572 97.757 53.339 1.00 0.00 O ATOM 17096 C12 OL 462 83.665 100.097 54.052 1.00 0.00 C ATOM 17097 H2R OL 462 83.049 100.663 54.754 1.00 0.00 H ATOM 17098 H2S OL 462 84.710 100.116 54.366 1.00 0.00 H ATOM 17099 C13 OL 462 83.437 100.559 52.622 1.00 0.00 C ATOM 17100 H3R OL 462 83.964 100.031 51.824 1.00 0.00 H ATOM 17101 H3S OL 462 82.390 100.406 52.353 1.00 0.00 H ATOM 17102 C14 OL 462 83.615 102.016 52.388 1.00 0.00 C ATOM 17103 H4R OL 462 82.794 102.610 52.796 1.00 0.00 H ATOM 17104 H4S OL 462 84.539 102.313 52.888 1.00 0.00 H ATOM 17105 C15 OL 462 83.839 102.300 50.877 1.00 0.00 C ATOM 17106 H5R OL 462 84.853 102.049 50.559 1.00 0.00 H ATOM 17107 H5S OL 462 83.351 101.614 50.182 1.00 0.00 H ATOM 17108 C16 OL 462 83.578 103.754 50.445 1.00 0.00 C ATOM 17109 H6R OL 462 83.924 103.943 49.427 1.00 0.00 H ATOM 17110 H6S OL 462 82.538 104.008 50.232 1.00 0.00 H ATOM 17111 C17 OL 462 84.134 104.773 51.492 1.00 0.00 C ATOM 17112 H7R OL 462 83.349 105.121 52.168 1.00 0.00 H ATOM 17113 H7S OL 462 84.953 104.341 52.070 1.00 0.00 H ATOM 17114 C18 OL 462 84.679 105.981 50.821 1.00 0.00 C ATOM 17115 H8R OL 462 84.958 106.591 51.683 1.00 0.00 H ATOM 17116 H8S OL 462 85.539 105.994 50.149 1.00 0.00 H ATOM 17117 C19 OL 462 83.528 106.726 50.136 1.00 0.00 C ATOM 17118 H9R OL 462 82.693 106.815 50.827 1.00 0.00 H ATOM 17119 C110 OL 462 83.588 107.278 48.922 1.00 0.00 C ATOM 17120 H10R OL 462 82.710 107.766 48.507 1.00 0.00 H ATOM 17121 C111 OL 462 84.720 107.157 47.910 1.00 0.00 C ATOM 17122 H11R OL 462 85.004 108.205 47.799 1.00 0.00 H ATOM 17123 H11S OL 462 85.574 106.598 48.299 1.00 0.00 H ATOM 17124 C112 OL 462 84.353 106.530 46.539 1.00 0.00 C ATOM 17125 H12R OL 462 83.795 105.609 46.718 1.00 0.00 H ATOM 17126 H12S OL 462 83.613 107.147 46.025 1.00 0.00 H ATOM 17127 C113 OL 462 85.655 106.462 45.663 1.00 0.00 C ATOM 17128 H13R OL 462 85.966 107.473 45.392 1.00 0.00 H ATOM 17129 H13S OL 462 86.478 106.074 46.268 1.00 0.00 H ATOM 17130 C114 OL 462 85.563 105.489 44.440 1.00 0.00 C ATOM 17131 H14R OL 462 86.460 105.681 43.848 1.00 0.00 H ATOM 17132 H14S OL 462 85.765 104.434 44.634 1.00 0.00 H ATOM 17133 C115 OL 462 84.315 105.617 43.577 1.00 0.00 C ATOM 17134 H15R OL 462 83.370 105.603 44.123 1.00 0.00 H ATOM 17135 H15S OL 462 84.261 106.511 42.953 1.00 0.00 H ATOM 17136 C116 OL 462 84.272 104.494 42.535 1.00 0.00 C ATOM 17137 H16R OL 462 85.137 104.564 41.872 1.00 0.00 H ATOM 17138 H16S OL 462 84.458 103.524 42.999 1.00 0.00 H ATOM 17139 C117 OL 462 82.964 104.509 41.736 1.00 0.00 C ATOM 17140 H17R OL 462 82.123 104.850 42.342 1.00 0.00 H ATOM 17141 H17S OL 462 83.150 105.160 40.879 1.00 0.00 H ATOM 17142 C118 OL 462 82.536 103.199 41.165 1.00 0.00 C ATOM 17143 H18R OL 462 82.247 102.473 41.927 1.00 0.00 H ATOM 17144 H18S OL 462 83.366 102.710 40.650 1.00 0.00 H ATOM 17145 H18T OL 462 81.743 103.218 40.414 1.00 0.00 H TER 17146 OL 462 ATOM 17146 C116 PA 463 106.940 35.575 41.708 1.00 0.00 C ATOM 17147 H16R PA 463 107.180 35.741 40.656 1.00 0.00 H ATOM 17148 H16S PA 463 106.000 35.035 41.837 1.00 0.00 H ATOM 17149 H16T PA 463 107.675 34.810 41.968 1.00 0.00 H ATOM 17150 C115 PA 463 107.105 36.822 42.619 1.00 0.00 C ATOM 17151 H15R PA 463 108.064 37.342 42.567 1.00 0.00 H ATOM 17152 H15S PA 463 107.026 36.564 43.677 1.00 0.00 H ATOM 17153 C114 PA 463 106.096 37.952 42.230 1.00 0.00 C ATOM 17154 H14R PA 463 105.118 37.470 42.166 1.00 0.00 H ATOM 17155 H14S PA 463 106.327 38.463 41.293 1.00 0.00 H ATOM 17156 C113 PA 463 105.986 39.068 43.247 1.00 0.00 C ATOM 17157 H13R PA 463 105.603 39.931 42.698 1.00 0.00 H ATOM 17158 H13S PA 463 107.007 39.228 43.600 1.00 0.00 H ATOM 17159 C112 PA 463 105.077 38.875 44.480 1.00 0.00 C ATOM 17160 H12R PA 463 105.390 37.995 45.045 1.00 0.00 H ATOM 17161 H12S PA 463 104.103 38.516 44.139 1.00 0.00 H ATOM 17162 C111 PA 463 104.898 40.039 45.458 1.00 0.00 C ATOM 17163 H11R PA 463 105.004 40.984 44.922 1.00 0.00 H ATOM 17164 H11S PA 463 105.774 39.945 46.102 1.00 0.00 H ATOM 17165 C110 PA 463 103.585 40.033 46.270 1.00 0.00 C ATOM 17166 H10R PA 463 103.313 39.078 46.724 1.00 0.00 H ATOM 17167 H10S PA 463 102.839 40.143 45.480 1.00 0.00 H ATOM 17168 C19 PA 463 103.415 41.082 47.321 1.00 0.00 C ATOM 17169 H9R PA 463 103.394 42.043 46.803 1.00 0.00 H ATOM 17170 H9S PA 463 104.278 41.067 47.991 1.00 0.00 H ATOM 17171 C18 PA 463 102.166 40.875 48.149 1.00 0.00 C ATOM 17172 H8R PA 463 102.302 39.948 48.709 1.00 0.00 H ATOM 17173 H8S PA 463 101.353 40.595 47.476 1.00 0.00 H ATOM 17174 C17 PA 463 101.769 42.037 49.029 1.00 0.00 C ATOM 17175 H7R PA 463 100.997 41.576 49.648 1.00 0.00 H ATOM 17176 H7S PA 463 101.321 42.828 48.424 1.00 0.00 H ATOM 17177 C16 PA 463 102.848 42.433 50.029 1.00 0.00 C ATOM 17178 H6R PA 463 103.519 43.110 49.495 1.00 0.00 H ATOM 17179 H6S PA 463 103.431 41.534 50.242 1.00 0.00 H ATOM 17180 C15 PA 463 102.435 43.243 51.157 1.00 0.00 C ATOM 17181 H5R PA 463 101.823 42.659 51.848 1.00 0.00 H ATOM 17182 H5S PA 463 101.847 44.092 50.801 1.00 0.00 H ATOM 17183 C14 PA 463 103.582 43.763 52.006 1.00 0.00 C ATOM 17184 H4R PA 463 103.192 44.528 52.681 1.00 0.00 H ATOM 17185 H4S PA 463 104.377 44.226 51.418 1.00 0.00 H ATOM 17186 C13 PA 463 104.263 42.679 52.854 1.00 0.00 C ATOM 17187 H3R PA 463 104.747 41.988 52.161 1.00 0.00 H ATOM 17188 H3S PA 463 103.609 42.243 53.612 1.00 0.00 H ATOM 17189 C12 PA 463 105.580 43.181 53.478 1.00 0.00 C ATOM 17190 H2R PA 463 105.365 44.002 54.165 1.00 0.00 H ATOM 17191 H2S PA 463 106.140 43.636 52.658 1.00 0.00 H ATOM 17192 C11 PGR 464 106.549 42.213 54.195 1.00 0.00 C ATOM 17193 O12 PGR 464 107.706 42.475 54.455 1.00 0.00 O ATOM 17194 O11 PGR 464 105.970 41.010 54.319 1.00 0.00 O ATOM 17195 C1 PGR 464 106.800 40.041 54.927 1.00 0.00 C ATOM 17196 HR PGR 464 107.086 40.489 55.883 1.00 0.00 H ATOM 17197 HS PGR 464 107.673 39.700 54.365 1.00 0.00 H ATOM 17198 C2 PGR 464 105.971 38.699 55.231 1.00 0.00 C ATOM 17199 HX PGR 464 105.045 38.976 55.742 1.00 0.00 H ATOM 17200 C3 PGR 464 106.759 37.608 56.041 1.00 0.00 C ATOM 17201 HA PGR 464 106.865 37.968 57.068 1.00 0.00 H ATOM 17202 HB PGR 464 107.738 37.560 55.558 1.00 0.00 H ATOM 17203 O31 PGR 464 106.205 36.349 56.053 1.00 0.00 O ATOM 17204 P31 PGR 464 104.925 36.068 56.922 1.00 0.00 P ATOM 17205 O32 PGR 464 103.735 35.960 55.921 1.00 0.00 O ATOM 17206 C31 PGR 464 103.693 35.020 54.880 1.00 0.00 C ATOM 17207 H1A PGR 464 104.036 34.053 55.256 1.00 0.00 H ATOM 17208 H1B PGR 464 104.328 35.316 54.041 1.00 0.00 H ATOM 17209 C32 PGR 464 102.296 34.787 54.459 1.00 0.00 C ATOM 17210 H2A PGR 464 101.800 35.707 54.139 1.00 0.00 H ATOM 17211 O35 PGR 464 101.591 34.035 55.375 1.00 0.00 O ATOM 17212 HO5A PGR 464 100.648 34.106 55.141 1.00 0.00 H ATOM 17213 C33 PGR 464 102.379 33.824 53.230 1.00 0.00 C ATOM 17214 H3A PGR 464 101.481 33.793 52.608 1.00 0.00 H ATOM 17215 H3B PGR 464 103.188 34.191 52.592 1.00 0.00 H ATOM 17216 O33 PGR 464 105.084 34.745 57.545 1.00 0.00 O ATOM 17217 O34 PGR 464 104.832 37.217 57.894 1.00 0.00 O ATOM 17218 O21 PGR 464 105.700 38.056 53.993 1.00 0.00 O ATOM 17219 C21 PGR 464 104.689 38.546 53.217 1.00 0.00 C ATOM 17220 O22 PGR 464 103.638 39.123 53.547 1.00 0.00 O ATOM 17221 O36 PGR 464 102.834 32.538 53.715 1.00 0.00 O ATOM 17222 HO6A PGR 464 102.286 32.453 54.516 1.00 0.00 H ATOM 17223 C12 OL 465 104.811 38.172 51.755 1.00 0.00 C ATOM 17224 H2R OL 465 104.262 38.921 51.182 1.00 0.00 H ATOM 17225 H2S OL 465 105.828 38.394 51.424 1.00 0.00 H ATOM 17226 C13 OL 465 104.405 36.723 51.388 1.00 0.00 C ATOM 17227 H3R OL 465 104.825 36.015 52.105 1.00 0.00 H ATOM 17228 H3S OL 465 103.395 36.539 51.763 1.00 0.00 H ATOM 17229 C14 OL 465 104.606 36.189 49.931 1.00 0.00 C ATOM 17230 H4R OL 465 104.093 35.239 49.774 1.00 0.00 H ATOM 17231 H4S OL 465 103.991 36.768 49.240 1.00 0.00 H ATOM 17232 C15 OL 465 106.046 36.163 49.459 1.00 0.00 C ATOM 17233 H5R OL 465 106.425 37.187 49.420 1.00 0.00 H ATOM 17234 H5S OL 465 106.634 35.734 50.272 1.00 0.00 H ATOM 17235 C16 OL 465 106.285 35.583 48.094 1.00 0.00 C ATOM 17236 H6R OL 465 105.963 34.541 48.038 1.00 0.00 H ATOM 17237 H6S OL 465 105.831 36.105 47.250 1.00 0.00 H ATOM 17238 C17 OL 465 107.867 35.617 47.834 1.00 0.00 C ATOM 17239 H7R OL 465 108.385 35.500 48.789 1.00 0.00 H ATOM 17240 H7S OL 465 108.072 34.659 47.350 1.00 0.00 H ATOM 17241 C18 OL 465 108.319 36.793 47.068 1.00 0.00 C ATOM 17242 H8R OL 465 107.867 36.739 46.076 1.00 0.00 H ATOM 17243 H8S OL 465 107.894 37.630 47.627 1.00 0.00 H ATOM 17244 C19 OL 465 109.787 36.838 47.210 1.00 0.00 C ATOM 17245 H9R OL 465 110.074 36.930 48.254 1.00 0.00 H ATOM 17246 C110 OL 465 110.574 36.801 46.181 1.00 0.00 C ATOM 17247 H10R OL 465 111.644 36.855 46.364 1.00 0.00 H ATOM 17248 C111 OL 465 110.166 36.821 44.717 1.00 0.00 C ATOM 17249 H11R OL 465 109.376 36.095 44.513 1.00 0.00 H ATOM 17250 H11S OL 465 109.691 37.737 44.359 1.00 0.00 H ATOM 17251 C112 OL 465 111.443 36.608 43.893 1.00 0.00 C ATOM 17252 H12R OL 465 111.896 35.702 44.301 1.00 0.00 H ATOM 17253 H12S OL 465 111.076 36.347 42.898 1.00 0.00 H ATOM 17254 C113 OL 465 112.417 37.739 43.774 1.00 0.00 C ATOM 17255 H13R OL 465 111.991 38.677 43.412 1.00 0.00 H ATOM 17256 H13S OL 465 112.712 38.035 44.783 1.00 0.00 H ATOM 17257 C114 OL 465 113.764 37.373 43.082 1.00 0.00 C ATOM 17258 H14R OL 465 113.517 37.000 42.086 1.00 0.00 H ATOM 17259 H14S OL 465 114.165 38.388 43.105 1.00 0.00 H ATOM 17260 C115 OL 465 114.618 36.229 43.708 1.00 0.00 C ATOM 17261 H15R OL 465 113.908 35.400 43.739 1.00 0.00 H ATOM 17262 H15S OL 465 115.345 35.936 42.948 1.00 0.00 H ATOM 17263 C116 OL 465 115.223 36.326 45.031 1.00 0.00 C ATOM 17264 H16R OL 465 114.459 36.538 45.781 1.00 0.00 H ATOM 17265 H16S OL 465 115.647 35.366 45.335 1.00 0.00 H ATOM 17266 C117 OL 465 116.185 37.452 45.225 1.00 0.00 C ATOM 17267 H17R OL 465 117.044 37.132 44.631 1.00 0.00 H ATOM 17268 H17S OL 465 115.708 38.316 44.756 1.00 0.00 H ATOM 17269 C118 OL 465 116.497 37.714 46.720 1.00 0.00 C ATOM 17270 H18R OL 465 117.142 38.588 46.615 1.00 0.00 H ATOM 17271 H18S OL 465 117.036 36.877 47.170 1.00 0.00 H ATOM 17272 H18T OL 465 115.599 37.959 47.290 1.00 0.00 H TER 17273 OL 465 ATOM 17273 C116 PA 466 48.256 41.007 48.958 1.00 0.00 C ATOM 17274 H16R PA 466 48.856 40.096 48.908 1.00 0.00 H ATOM 17275 H16S PA 466 48.847 41.901 49.166 1.00 0.00 H ATOM 17276 H16T PA 466 47.944 41.198 47.929 1.00 0.00 H ATOM 17277 C115 PA 466 47.138 40.976 49.895 1.00 0.00 C ATOM 17278 H15R PA 466 46.303 40.545 49.339 1.00 0.00 H ATOM 17279 H15S PA 466 46.975 41.981 50.287 1.00 0.00 H ATOM 17280 C114 PA 466 47.294 39.910 50.982 1.00 0.00 C ATOM 17281 H14R PA 466 48.264 40.160 51.416 1.00 0.00 H ATOM 17282 H14S PA 466 47.458 39.021 50.370 1.00 0.00 H ATOM 17283 C113 PA 466 46.143 39.633 51.903 1.00 0.00 C ATOM 17284 H13R PA 466 45.332 39.106 51.396 1.00 0.00 H ATOM 17285 H13S PA 466 45.829 40.564 52.381 1.00 0.00 H ATOM 17286 C112 PA 466 46.524 38.799 53.110 1.00 0.00 C ATOM 17287 H12R PA 466 45.597 38.656 53.669 1.00 0.00 H ATOM 17288 H12S PA 466 47.237 39.383 53.695 1.00 0.00 H ATOM 17289 C111 PA 466 47.228 37.495 52.712 1.00 0.00 C ATOM 17290 H11R PA 466 47.904 37.144 53.495 1.00 0.00 H ATOM 17291 H11S PA 466 47.964 37.605 51.914 1.00 0.00 H ATOM 17292 C110 PA 466 46.358 36.372 52.268 1.00 0.00 C ATOM 17293 H10R PA 466 45.514 36.770 51.701 1.00 0.00 H ATOM 17294 H10S PA 466 45.818 36.092 53.175 1.00 0.00 H ATOM 17295 C19 PA 466 47.160 35.223 51.690 1.00 0.00 C ATOM 17296 H9R PA 466 47.982 34.913 52.340 1.00 0.00 H ATOM 17297 H9S PA 466 47.586 35.649 50.779 1.00 0.00 H ATOM 17298 C18 PA 466 46.374 33.929 51.339 1.00 0.00 C ATOM 17299 H8R PA 466 45.565 34.261 50.685 1.00 0.00 H ATOM 17300 H8S PA 466 45.907 33.440 52.197 1.00 0.00 H ATOM 17301 C17 PA 466 47.093 32.896 50.683 1.00 0.00 C ATOM 17302 H7R PA 466 47.852 32.571 51.397 1.00 0.00 H ATOM 17303 H7S PA 466 47.650 33.271 49.822 1.00 0.00 H ATOM 17304 C16 PA 466 46.230 31.756 50.158 1.00 0.00 C ATOM 17305 H6R PA 466 45.564 32.201 49.416 1.00 0.00 H ATOM 17306 H6S PA 466 45.551 31.364 50.918 1.00 0.00 H ATOM 17307 C15 PA 466 47.137 30.591 49.537 1.00 0.00 C ATOM 17308 H5R PA 466 47.632 30.860 48.602 1.00 0.00 H ATOM 17309 H5S PA 466 46.522 29.715 49.321 1.00 0.00 H ATOM 17310 C14 PA 466 48.159 30.065 50.513 1.00 0.00 C ATOM 17311 H4R PA 466 47.675 30.006 51.490 1.00 0.00 H ATOM 17312 H4S PA 466 48.918 30.847 50.585 1.00 0.00 H ATOM 17313 C13 PA 466 48.851 28.784 50.120 1.00 0.00 C ATOM 17314 H3R PA 466 49.240 28.893 49.105 1.00 0.00 H ATOM 17315 H3S PA 466 48.163 27.943 50.230 1.00 0.00 H ATOM 17316 C12 PA 466 50.060 28.431 51.033 1.00 0.00 C ATOM 17317 H2R PA 466 50.244 27.356 51.093 1.00 0.00 H ATOM 17318 H2S PA 466 50.027 28.790 52.064 1.00 0.00 H ATOM 17319 C11 PGR 467 51.332 29.082 50.549 1.00 0.00 C ATOM 17320 O12 PGR 467 51.336 30.010 49.829 1.00 0.00 O ATOM 17321 O11 PGR 467 52.441 28.580 51.131 1.00 0.00 O ATOM 17322 C1 PGR 467 53.700 29.294 51.016 1.00 0.00 C ATOM 17323 HR PGR 467 53.935 29.871 50.119 1.00 0.00 H ATOM 17324 HS PGR 467 54.472 28.520 51.028 1.00 0.00 H ATOM 17325 C2 PGR 467 53.868 30.126 52.257 1.00 0.00 C ATOM 17326 HX PGR 467 54.848 30.605 52.180 1.00 0.00 H ATOM 17327 C3 PGR 467 53.720 29.294 53.613 1.00 0.00 C ATOM 17328 HA PGR 467 54.164 28.315 53.416 1.00 0.00 H ATOM 17329 HB PGR 467 52.646 29.125 53.725 1.00 0.00 H ATOM 17330 O31 PGR 467 54.381 30.093 54.582 1.00 0.00 O ATOM 17331 P31 PGR 467 54.200 29.767 56.159 1.00 0.00 P ATOM 17332 O32 PGR 467 52.732 30.312 56.470 1.00 0.00 O ATOM 17333 C31 PGR 467 52.324 31.619 56.223 1.00 0.00 C ATOM 17334 H1A PGR 467 52.606 31.850 55.192 1.00 0.00 H ATOM 17335 H1B PGR 467 52.731 32.356 56.920 1.00 0.00 H ATOM 17336 C32 PGR 467 50.791 31.751 56.170 1.00 0.00 C ATOM 17337 H2A PGR 467 50.463 32.766 55.932 1.00 0.00 H ATOM 17338 O35 PGR 467 50.276 31.625 57.485 1.00 0.00 O ATOM 17339 HO5A PGR 467 50.700 30.855 57.903 1.00 0.00 H ATOM 17340 C33 PGR 467 50.065 30.813 55.242 1.00 0.00 C ATOM 17341 H3A PGR 467 50.399 31.005 54.220 1.00 0.00 H ATOM 17342 H3B PGR 467 50.404 29.787 55.404 1.00 0.00 H ATOM 17343 O33 PGR 467 54.119 28.278 56.312 1.00 0.00 O ATOM 17344 O34 PGR 467 55.197 30.624 56.899 1.00 0.00 O ATOM 17345 O21 PGR 467 52.906 31.152 52.444 1.00 0.00 O ATOM 17346 C21 PGR 467 53.210 32.342 51.878 1.00 0.00 C ATOM 17347 O22 PGR 467 54.277 32.657 51.377 1.00 0.00 O ATOM 17348 O36 PGR 467 48.651 30.970 55.328 1.00 0.00 O ATOM 17349 HO6A PGR 467 48.398 31.856 55.010 1.00 0.00 H ATOM 17350 C12 OL 468 52.030 33.294 52.009 1.00 0.00 C ATOM 17351 H2R OL 468 51.711 33.021 53.018 1.00 0.00 H ATOM 17352 H2S OL 468 52.355 34.326 51.862 1.00 0.00 H ATOM 17353 C13 OL 468 50.944 33.006 50.939 1.00 0.00 C ATOM 17354 H3R OL 468 50.500 32.009 50.993 1.00 0.00 H ATOM 17355 H3S OL 468 50.140 33.702 51.187 1.00 0.00 H ATOM 17356 C14 OL 468 51.536 33.248 49.508 1.00 0.00 C ATOM 17357 H4R OL 468 52.030 34.217 49.407 1.00 0.00 H ATOM 17358 H4S OL 468 52.236 32.410 49.500 1.00 0.00 H ATOM 17359 C15 OL 468 50.497 33.073 48.368 1.00 0.00 C ATOM 17360 H5R OL 468 49.910 32.181 48.598 1.00 0.00 H ATOM 17361 H5S OL 468 49.826 33.934 48.402 1.00 0.00 H ATOM 17362 C16 OL 468 51.110 32.949 46.931 1.00 0.00 C ATOM 17363 H6R OL 468 50.198 33.073 46.343 1.00 0.00 H ATOM 17364 H6S OL 468 51.752 33.799 46.690 1.00 0.00 H ATOM 17365 C17 OL 468 51.872 31.607 46.692 1.00 0.00 C ATOM 17366 H7R OL 468 52.761 31.560 47.324 1.00 0.00 H ATOM 17367 H7S OL 468 51.333 30.780 47.161 1.00 0.00 H ATOM 17368 C18 OL 468 52.094 31.292 45.197 1.00 0.00 C ATOM 17369 H8R OL 468 52.415 30.264 45.014 1.00 0.00 H ATOM 17370 H8S OL 468 51.087 31.361 44.781 1.00 0.00 H ATOM 17371 C19 OL 468 52.937 32.278 44.477 1.00 0.00 C ATOM 17372 H9R OL 468 52.574 33.302 44.493 1.00 0.00 H ATOM 17373 C110 OL 468 54.063 31.993 43.774 1.00 0.00 C ATOM 17374 H10R OL 468 54.617 32.781 43.270 1.00 0.00 H ATOM 17375 C111 OL 468 54.587 30.638 43.525 1.00 0.00 C ATOM 17376 H11R OL 468 55.679 30.642 43.532 1.00 0.00 H ATOM 17377 H11S OL 468 54.154 29.902 44.206 1.00 0.00 H ATOM 17378 C112 OL 468 54.329 30.110 42.080 1.00 0.00 C ATOM 17379 H12R OL 468 54.991 30.641 41.392 1.00 0.00 H ATOM 17380 H12S OL 468 54.730 29.097 42.003 1.00 0.00 H ATOM 17381 C113 OL 468 52.933 30.163 41.636 1.00 0.00 C ATOM 17382 H13R OL 468 52.297 29.603 42.325 1.00 0.00 H ATOM 17383 H13S OL 468 52.613 31.206 41.597 1.00 0.00 H ATOM 17384 C114 OL 468 52.718 29.491 40.287 1.00 0.00 C ATOM 17385 H14R OL 468 53.202 30.147 39.560 1.00 0.00 H ATOM 17386 H14S OL 468 53.286 28.559 40.257 1.00 0.00 H ATOM 17387 C115 OL 468 51.253 29.132 39.957 1.00 0.00 C ATOM 17388 H15R OL 468 50.925 28.332 40.625 1.00 0.00 H ATOM 17389 H15S OL 468 50.705 30.043 40.206 1.00 0.00 H ATOM 17390 C116 OL 468 51.040 28.724 38.470 1.00 0.00 C ATOM 17391 H16R OL 468 51.385 29.603 37.920 1.00 0.00 H ATOM 17392 H16S OL 468 51.716 27.908 38.204 1.00 0.00 H ATOM 17393 C117 OL 468 49.655 28.226 38.050 1.00 0.00 C ATOM 17394 H17R OL 468 49.246 27.463 38.715 1.00 0.00 H ATOM 17395 H17S OL 468 48.925 29.038 38.051 1.00 0.00 H ATOM 17396 C118 OL 468 49.533 27.676 36.592 1.00 0.00 C ATOM 17397 H18R OL 468 49.640 26.591 36.537 1.00 0.00 H ATOM 17398 H18S OL 468 50.340 28.114 36.001 1.00 0.00 H ATOM 17399 H18T OL 468 48.553 27.856 36.145 1.00 0.00 H TER 17400 OL 468 ATOM 17400 C116 PA 469 155.095 98.082 47.567 1.00 0.00 C ATOM 17401 H16R PA 469 155.734 98.755 46.992 1.00 0.00 H ATOM 17402 H16S PA 469 155.593 97.734 48.474 1.00 0.00 H ATOM 17403 H16T PA 469 154.316 98.770 47.903 1.00 0.00 H ATOM 17404 C115 PA 469 154.575 96.866 46.889 1.00 0.00 C ATOM 17405 H15R PA 469 154.266 96.077 47.578 1.00 0.00 H ATOM 17406 H15S PA 469 155.306 96.481 46.174 1.00 0.00 H ATOM 17407 C114 PA 469 153.299 97.261 46.073 1.00 0.00 C ATOM 17408 H14R PA 469 153.631 98.100 45.459 1.00 0.00 H ATOM 17409 H14S PA 469 152.618 97.867 46.674 1.00 0.00 H ATOM 17410 C113 PA 469 152.622 96.098 45.300 1.00 0.00 C ATOM 17411 H13R PA 469 152.307 95.428 46.102 1.00 0.00 H ATOM 17412 H13S PA 469 153.441 95.587 44.789 1.00 0.00 H ATOM 17413 C112 PA 469 151.453 96.483 44.360 1.00 0.00 C ATOM 17414 H12R PA 469 150.991 95.607 43.901 1.00 0.00 H ATOM 17415 H12S PA 469 151.777 97.191 43.595 1.00 0.00 H ATOM 17416 C111 PA 469 150.177 96.982 45.154 1.00 0.00 C ATOM 17417 H11R PA 469 150.425 97.781 45.856 1.00 0.00 H ATOM 17418 H11S PA 469 149.903 96.120 45.767 1.00 0.00 H ATOM 17419 C110 PA 469 149.015 97.424 44.392 1.00 0.00 C ATOM 17420 H10R PA 469 148.793 96.624 43.683 1.00 0.00 H ATOM 17421 H10S PA 469 149.354 98.144 43.645 1.00 0.00 H ATOM 17422 C19 PA 469 147.817 97.895 45.095 1.00 0.00 C ATOM 17423 H9R PA 469 147.428 96.978 45.543 1.00 0.00 H ATOM 17424 H9S PA 469 147.037 98.178 44.386 1.00 0.00 H ATOM 17425 C18 PA 469 148.002 99.191 46.013 1.00 0.00 C ATOM 17426 H8R PA 469 148.254 100.024 45.354 1.00 0.00 H ATOM 17427 H8S PA 469 148.919 99.149 46.604 1.00 0.00 H ATOM 17428 C17 PA 469 146.740 99.475 46.803 1.00 0.00 C ATOM 17429 H7R PA 469 146.201 98.678 47.319 1.00 0.00 H ATOM 17430 H7S PA 469 145.935 99.982 46.265 1.00 0.00 H ATOM 17431 C16 PA 469 147.143 100.524 47.924 1.00 0.00 C ATOM 17432 H6R PA 469 147.630 101.299 47.328 1.00 0.00 H ATOM 17433 H6S PA 469 147.822 100.126 48.681 1.00 0.00 H ATOM 17434 C15 PA 469 146.008 101.224 48.602 1.00 0.00 C ATOM 17435 H5R PA 469 145.303 100.520 49.050 1.00 0.00 H ATOM 17436 H5S PA 469 145.395 101.876 47.977 1.00 0.00 H ATOM 17437 C14 PA 469 146.554 102.223 49.723 1.00 0.00 C ATOM 17438 H4R PA 469 147.043 103.097 49.288 1.00 0.00 H ATOM 17439 H4S PA 469 147.254 101.761 50.423 1.00 0.00 H ATOM 17440 C13 PA 469 145.438 102.908 50.485 1.00 0.00 C ATOM 17441 H3R PA 469 144.785 102.220 51.026 1.00 0.00 H ATOM 17442 H3S PA 469 144.859 103.537 49.805 1.00 0.00 H ATOM 17443 C12 PA 469 145.930 103.940 51.507 1.00 0.00 C ATOM 17444 H2R PA 469 146.582 104.679 51.035 1.00 0.00 H ATOM 17445 H2S PA 469 146.496 103.405 52.272 1.00 0.00 H ATOM 17446 C11 PC 470 144.823 104.677 52.165 1.00 0.00 C ATOM 17447 O12 PC 470 143.660 104.437 51.932 1.00 0.00 O ATOM 17448 O11 PC 470 145.264 105.486 53.041 1.00 0.00 O ATOM 17449 C1 PC 470 144.324 106.237 53.904 1.00 0.00 C ATOM 17450 HR PC 470 143.655 105.554 54.434 1.00 0.00 H ATOM 17451 HS PC 470 143.752 106.912 53.262 1.00 0.00 H ATOM 17452 C2 PC 470 145.106 107.166 54.876 1.00 0.00 C ATOM 17453 HX PC 470 146.104 106.779 55.099 1.00 0.00 H ATOM 17454 C3 PC 470 144.325 107.417 56.186 1.00 0.00 C ATOM 17455 HA PC 470 143.997 106.472 56.627 1.00 0.00 H ATOM 17456 HB PC 470 143.432 108.025 56.022 1.00 0.00 H ATOM 17457 O31 PC 470 145.168 108.120 57.054 1.00 0.00 O ATOM 17458 P31 PC 470 146.371 107.406 57.899 1.00 0.00 P ATOM 17459 O32 PC 470 147.671 107.357 56.946 1.00 0.00 O ATOM 17460 C31 PC 470 148.458 108.404 56.612 1.00 0.00 C ATOM 17461 H1A PC 470 148.717 108.797 57.599 1.00 0.00 H ATOM 17462 H1B PC 470 147.872 109.050 55.953 1.00 0.00 H ATOM 17463 C32 PC 470 149.641 107.956 55.780 1.00 0.00 C ATOM 17464 H2A PC 470 150.346 108.786 55.720 1.00 0.00 H ATOM 17465 H2B PC 470 149.294 107.523 54.841 1.00 0.00 H ATOM 17466 N31 PC 470 150.420 106.820 56.417 1.00 0.00 N ATOM 17467 C33 PC 470 150.581 107.040 57.875 1.00 0.00 C ATOM 17468 H3A PC 470 149.571 107.030 58.286 1.00 0.00 H ATOM 17469 H3B PC 470 151.010 108.023 58.078 1.00 0.00 H ATOM 17470 H3C PC 470 151.188 106.273 58.358 1.00 0.00 H ATOM 17471 C34 PC 470 149.737 105.477 56.143 1.00 0.00 C ATOM 17472 H4A PC 470 150.065 104.603 56.706 1.00 0.00 H ATOM 17473 H4B PC 470 149.760 105.325 55.063 1.00 0.00 H ATOM 17474 H4C PC 470 148.704 105.678 56.431 1.00 0.00 H ATOM 17475 C35 PC 470 151.752 106.642 55.747 1.00 0.00 C ATOM 17476 H5A PC 470 151.601 106.205 54.758 1.00 0.00 H ATOM 17477 H5B PC 470 152.184 105.881 56.399 1.00 0.00 H ATOM 17478 H5C PC 470 152.353 107.552 55.746 1.00 0.00 H ATOM 17479 O33 PC 470 146.712 108.310 59.046 1.00 0.00 O ATOM 17480 O34 PC 470 146.005 105.982 58.146 1.00 0.00 O ATOM 17481 O21 PC 470 145.096 108.452 54.229 1.00 0.00 O ATOM 17482 C21 PC 470 146.129 108.802 53.390 1.00 0.00 C ATOM 17483 O22 PC 470 147.185 108.173 53.218 1.00 0.00 O ATOM 17484 C12 OL 471 145.991 110.169 52.762 1.00 0.00 C ATOM 17485 H2R OL 471 144.927 110.409 52.806 1.00 0.00 H ATOM 17486 H2S OL 471 146.548 110.837 53.423 1.00 0.00 H ATOM 17487 C13 OL 471 146.416 110.275 51.324 1.00 0.00 C ATOM 17488 H3R OL 471 147.458 109.949 51.303 1.00 0.00 H ATOM 17489 H3S OL 471 145.834 109.580 50.715 1.00 0.00 H ATOM 17490 C14 OL 471 146.381 111.702 50.716 1.00 0.00 C ATOM 17491 H4R OL 471 145.582 112.228 51.242 1.00 0.00 H ATOM 17492 H4S OL 471 147.392 112.081 50.879 1.00 0.00 H ATOM 17493 C15 OL 471 146.158 111.762 49.182 1.00 0.00 C ATOM 17494 H5R OL 471 146.404 112.791 48.910 1.00 0.00 H ATOM 17495 H5S OL 471 146.983 111.127 48.853 1.00 0.00 H ATOM 17496 C16 OL 471 144.785 111.367 48.746 1.00 0.00 C ATOM 17497 H6R OL 471 144.568 110.327 48.997 1.00 0.00 H ATOM 17498 H6S OL 471 144.157 112.129 49.211 1.00 0.00 H ATOM 17499 C17 OL 471 144.714 111.522 47.201 1.00 0.00 C ATOM 17500 H7R OL 471 144.873 112.530 46.810 1.00 0.00 H ATOM 17501 H7S OL 471 145.470 110.875 46.751 1.00 0.00 H ATOM 17502 C18 OL 471 143.339 111.159 46.587 1.00 0.00 C ATOM 17503 H8R OL 471 143.090 110.099 46.668 1.00 0.00 H ATOM 17504 H8S OL 471 142.567 111.530 47.264 1.00 0.00 H ATOM 17505 C19 OL 471 143.197 111.617 45.150 1.00 0.00 C ATOM 17506 H9R OL 471 144.051 112.230 44.874 1.00 0.00 H ATOM 17507 C110 OL 471 142.267 111.400 44.204 1.00 0.00 C ATOM 17508 H10R OL 471 142.275 111.950 43.267 1.00 0.00 H ATOM 17509 C111 OL 471 140.913 110.714 44.373 1.00 0.00 C ATOM 17510 H11R OL 471 140.932 109.709 43.948 1.00 0.00 H ATOM 17511 H11S OL 471 140.718 110.644 45.445 1.00 0.00 H ATOM 17512 C112 OL 471 139.720 111.495 43.900 1.00 0.00 C ATOM 17513 H12R OL 471 139.785 111.543 42.811 1.00 0.00 H ATOM 17514 H12S OL 471 138.892 110.786 43.960 1.00 0.00 H ATOM 17515 C113 OL 471 139.409 112.765 44.700 1.00 0.00 C ATOM 17516 H13R OL 471 139.306 112.500 45.754 1.00 0.00 H ATOM 17517 H13S OL 471 140.206 113.489 44.521 1.00 0.00 H ATOM 17518 C114 OL 471 137.923 113.342 44.374 1.00 0.00 C ATOM 17519 H14R OL 471 137.927 114.320 44.860 1.00 0.00 H ATOM 17520 H14S OL 471 137.864 113.544 43.303 1.00 0.00 H ATOM 17521 C115 OL 471 136.780 112.619 45.080 1.00 0.00 C ATOM 17522 H15R OL 471 137.098 111.576 45.147 1.00 0.00 H ATOM 17523 H15S OL 471 136.650 112.923 46.121 1.00 0.00 H ATOM 17524 C116 OL 471 135.402 112.705 44.363 1.00 0.00 C ATOM 17525 H16R OL 471 135.184 113.737 44.080 1.00 0.00 H ATOM 17526 H16S OL 471 135.432 112.100 43.454 1.00 0.00 H ATOM 17527 C117 OL 471 134.248 112.179 45.326 1.00 0.00 C ATOM 17528 H17R OL 471 134.224 112.878 46.165 1.00 0.00 H ATOM 17529 H17S OL 471 133.320 112.142 44.751 1.00 0.00 H ATOM 17530 C118 OL 471 134.639 110.797 45.936 1.00 0.00 C ATOM 17531 H18R OL 471 133.781 110.157 46.157 1.00 0.00 H ATOM 17532 H18S OL 471 135.057 110.904 46.939 1.00 0.00 H ATOM 17533 H18T OL 471 135.335 110.208 45.336 1.00 0.00 H TER 17534 OL 471 ATOM 17534 C116 PA 472 67.823 143.507 36.227 1.00 0.00 C ATOM 17535 H16R PA 472 68.849 143.294 36.534 1.00 0.00 H ATOM 17536 H16S PA 472 67.883 144.570 35.986 1.00 0.00 H ATOM 17537 H16T PA 472 67.616 142.917 35.331 1.00 0.00 H ATOM 17538 C115 PA 472 66.633 143.362 37.233 1.00 0.00 C ATOM 17539 H15R PA 472 65.745 143.532 36.621 1.00 0.00 H ATOM 17540 H15S PA 472 66.602 144.176 37.959 1.00 0.00 H ATOM 17541 C114 PA 472 66.434 142.006 38.012 1.00 0.00 C ATOM 17542 H14R PA 472 67.407 141.612 38.312 1.00 0.00 H ATOM 17543 H14S PA 472 66.116 141.222 37.322 1.00 0.00 H ATOM 17544 C113 PA 472 65.661 142.151 39.315 1.00 0.00 C ATOM 17545 H13R PA 472 66.229 142.843 39.941 1.00 0.00 H ATOM 17546 H13S PA 472 65.781 141.234 39.895 1.00 0.00 H ATOM 17547 C112 PA 472 64.194 142.494 39.237 1.00 0.00 C ATOM 17548 H12R PA 472 63.754 141.659 38.688 1.00 0.00 H ATOM 17549 H12S PA 472 63.989 143.428 38.709 1.00 0.00 H ATOM 17550 C111 PA 472 63.474 142.766 40.516 1.00 0.00 C ATOM 17551 H11R PA 472 64.281 143.294 41.029 1.00 0.00 H ATOM 17552 H11S PA 472 63.215 141.807 40.970 1.00 0.00 H ATOM 17553 C110 PA 472 62.154 143.463 40.436 1.00 0.00 C ATOM 17554 H10R PA 472 61.412 142.786 40.006 1.00 0.00 H ATOM 17555 H10S PA 472 62.122 144.366 39.823 1.00 0.00 H ATOM 17556 C19 PA 472 61.713 143.867 41.821 1.00 0.00 C ATOM 17557 H9R PA 472 62.630 144.321 42.200 1.00 0.00 H ATOM 17558 H9S PA 472 61.626 142.993 42.470 1.00 0.00 H ATOM 17559 C18 PA 472 60.460 144.722 41.951 1.00 0.00 C ATOM 17560 H8R PA 472 59.718 144.466 41.193 1.00 0.00 H ATOM 17561 H8S PA 472 60.720 145.770 41.789 1.00 0.00 H ATOM 17562 C17 PA 472 59.864 144.619 43.334 1.00 0.00 C ATOM 17563 H7R PA 472 59.953 143.651 43.830 1.00 0.00 H ATOM 17564 H7S PA 472 58.802 144.852 43.228 1.00 0.00 H ATOM 17565 C16 PA 472 60.308 145.770 44.260 1.00 0.00 C ATOM 17566 H6R PA 472 59.789 145.802 45.221 1.00 0.00 H ATOM 17567 H6S PA 472 60.041 146.710 43.772 1.00 0.00 H ATOM 17568 C15 PA 472 61.787 145.610 44.691 1.00 0.00 C ATOM 17569 H5R PA 472 62.037 146.569 45.149 1.00 0.00 H ATOM 17570 H5S PA 472 62.494 145.457 43.873 1.00 0.00 H ATOM 17571 C14 PA 472 62.154 144.475 45.625 1.00 0.00 C ATOM 17572 H4R PA 472 63.160 144.187 45.313 1.00 0.00 H ATOM 17573 H4S PA 472 61.511 143.642 45.333 1.00 0.00 H ATOM 17574 C13 PA 472 61.957 144.759 47.097 1.00 0.00 C ATOM 17575 H3R PA 472 60.884 144.890 47.254 1.00 0.00 H ATOM 17576 H3S PA 472 62.417 145.708 47.379 1.00 0.00 H ATOM 17577 C12 PA 472 62.322 143.569 47.932 1.00 0.00 C ATOM 17578 H2R PA 472 63.399 143.520 47.760 1.00 0.00 H ATOM 17579 H2S PA 472 61.953 142.584 47.637 1.00 0.00 H ATOM 17580 C11 PGR 473 62.086 144.005 49.321 1.00 0.00 C ATOM 17581 O12 PGR 473 62.842 144.763 49.902 1.00 0.00 O ATOM 17582 O11 PGR 473 60.887 143.752 49.811 1.00 0.00 O ATOM 17583 C1 PGR 473 60.389 144.383 51.037 1.00 0.00 C ATOM 17584 HR PGR 473 61.101 144.179 51.841 1.00 0.00 H ATOM 17585 HS PGR 473 59.453 143.851 51.228 1.00 0.00 H ATOM 17586 C2 PGR 473 60.141 145.940 50.865 1.00 0.00 C ATOM 17587 HX PGR 473 61.139 146.383 50.921 1.00 0.00 H ATOM 17588 C3 PGR 473 59.319 146.466 52.043 1.00 0.00 C ATOM 17589 HA PGR 473 59.607 146.109 53.035 1.00 0.00 H ATOM 17590 HB PGR 473 58.279 146.178 51.873 1.00 0.00 H ATOM 17591 O31 PGR 473 59.303 147.929 51.936 1.00 0.00 O ATOM 17592 P31 PGR 473 58.593 148.735 53.041 1.00 0.00 P ATOM 17593 O32 PGR 473 58.648 150.225 52.390 1.00 0.00 O ATOM 17594 C31 PGR 473 57.843 150.560 51.286 1.00 0.00 C ATOM 17595 H1A PGR 473 56.872 150.140 51.562 1.00 0.00 H ATOM 17596 H1B PGR 473 58.050 149.949 50.404 1.00 0.00 H ATOM 17597 C32 PGR 473 57.738 151.995 50.872 1.00 0.00 C ATOM 17598 H2A PGR 473 58.789 152.244 50.701 1.00 0.00 H ATOM 17599 O35 PGR 473 57.275 152.764 51.966 1.00 0.00 O ATOM 17600 HO5A PGR 473 56.446 152.322 52.223 1.00 0.00 H ATOM 17601 C33 PGR 473 56.830 152.292 49.697 1.00 0.00 C ATOM 17602 H3A PGR 473 57.046 153.326 49.417 1.00 0.00 H ATOM 17603 H3B PGR 473 57.171 151.748 48.812 1.00 0.00 H ATOM 17604 O33 PGR 473 57.171 148.289 53.028 1.00 0.00 O ATOM 17605 O34 PGR 473 59.418 148.694 54.259 1.00 0.00 O ATOM 17606 O21 PGR 473 59.536 146.266 49.587 1.00 0.00 O ATOM 17607 C21 PGR 473 59.845 147.385 48.992 1.00 0.00 C ATOM 17608 O22 PGR 473 60.692 148.121 49.476 1.00 0.00 O ATOM 17609 O36 PGR 473 55.448 151.971 49.997 1.00 0.00 O ATOM 17610 HO6A PGR 473 55.027 152.584 50.626 1.00 0.00 H ATOM 17611 C12 OL 474 59.158 147.640 47.719 1.00 0.00 C ATOM 17612 H2R OL 474 59.525 148.523 47.192 1.00 0.00 H ATOM 17613 H2S OL 474 59.346 146.794 47.054 1.00 0.00 H ATOM 17614 C13 OL 474 57.709 147.782 47.976 1.00 0.00 C ATOM 17615 H3R OL 474 57.468 146.902 48.575 1.00 0.00 H ATOM 17616 H3S OL 474 57.554 148.676 48.585 1.00 0.00 H ATOM 17617 C14 OL 474 56.803 147.836 46.760 1.00 0.00 C ATOM 17618 H4R OL 474 57.228 148.558 46.060 1.00 0.00 H ATOM 17619 H4S OL 474 56.566 146.858 46.336 1.00 0.00 H ATOM 17620 C15 OL 474 55.487 148.472 47.252 1.00 0.00 C ATOM 17621 H5R OL 474 54.977 147.825 47.968 1.00 0.00 H ATOM 17622 H5S OL 474 55.562 149.456 47.721 1.00 0.00 H ATOM 17623 C16 OL 474 54.420 148.584 46.178 1.00 0.00 C ATOM 17624 H6R OL 474 54.671 149.208 45.318 1.00 0.00 H ATOM 17625 H6S OL 474 54.388 147.551 45.823 1.00 0.00 H ATOM 17626 C17 OL 474 53.048 148.901 46.674 1.00 0.00 C ATOM 17627 H7R OL 474 52.869 148.102 47.396 1.00 0.00 H ATOM 17628 H7S OL 474 53.132 149.851 47.207 1.00 0.00 H ATOM 17629 C18 OL 474 51.853 148.890 45.661 1.00 0.00 C ATOM 17630 H8R OL 474 50.875 148.997 46.133 1.00 0.00 H ATOM 17631 H8S OL 474 51.821 149.793 45.048 1.00 0.00 H ATOM 17632 C19 OL 474 51.787 147.623 44.917 1.00 0.00 C ATOM 17633 H9R OL 474 52.222 147.639 43.921 1.00 0.00 H ATOM 17634 C110 OL 474 51.066 146.501 45.309 1.00 0.00 C ATOM 17635 H10R OL 474 51.087 145.617 44.676 1.00 0.00 H ATOM 17636 C111 OL 474 50.379 146.277 46.613 1.00 0.00 C ATOM 17637 H11R OL 474 50.353 147.221 47.162 1.00 0.00 H ATOM 17638 H11S OL 474 49.317 146.135 46.402 1.00 0.00 H ATOM 17639 C112 OL 474 51.066 145.099 47.485 1.00 0.00 C ATOM 17640 H12R OL 474 52.096 145.441 47.602 1.00 0.00 H ATOM 17641 H12S OL 474 50.624 144.982 48.477 1.00 0.00 H ATOM 17642 C113 OL 474 51.197 143.741 46.775 1.00 0.00 C ATOM 17643 H13R OL 474 50.278 143.462 46.255 1.00 0.00 H ATOM 17644 H13S OL 474 51.987 143.757 46.022 1.00 0.00 H ATOM 17645 C114 OL 474 51.677 142.656 47.742 1.00 0.00 C ATOM 17646 H14R OL 474 52.600 143.033 48.186 1.00 0.00 H ATOM 17647 H14S OL 474 50.908 142.635 48.518 1.00 0.00 H ATOM 17648 C115 OL 474 51.860 141.210 47.108 1.00 0.00 C ATOM 17649 H15R OL 474 52.287 140.479 47.798 1.00 0.00 H ATOM 17650 H15S OL 474 50.827 140.936 46.883 1.00 0.00 H ATOM 17651 C116 OL 474 52.671 141.157 45.852 1.00 0.00 C ATOM 17652 H16R OL 474 52.219 141.806 45.100 1.00 0.00 H ATOM 17653 H16S OL 474 53.655 141.621 45.949 1.00 0.00 H ATOM 17654 C117 OL 474 52.999 139.710 45.301 1.00 0.00 C ATOM 17655 H17R OL 474 53.467 139.812 44.319 1.00 0.00 H ATOM 17656 H17S OL 474 53.735 139.387 46.040 1.00 0.00 H ATOM 17657 C118 OL 474 51.789 138.752 45.093 1.00 0.00 C ATOM 17658 H18R OL 474 51.483 138.382 46.074 1.00 0.00 H ATOM 17659 H18S OL 474 52.017 137.795 44.619 1.00 0.00 H ATOM 17660 H18T OL 474 50.955 139.209 44.556 1.00 0.00 H TER 17661 OL 474 ATOM 17661 C116 PA 475 7.037 100.353 42.923 1.00 0.00 C ATOM 17662 H16R PA 475 7.223 99.378 43.377 1.00 0.00 H ATOM 17663 H16S PA 475 8.042 100.551 42.546 1.00 0.00 H ATOM 17664 H16T PA 475 6.307 100.225 42.121 1.00 0.00 H ATOM 17665 C115 PA 475 6.576 101.403 43.922 1.00 0.00 C ATOM 17666 H15R PA 475 6.470 102.315 43.331 1.00 0.00 H ATOM 17667 H15S PA 475 7.326 101.775 44.623 1.00 0.00 H ATOM 17668 C114 PA 475 5.231 101.106 44.580 1.00 0.00 C ATOM 17669 H14R PA 475 5.185 100.026 44.734 1.00 0.00 H ATOM 17670 H14S PA 475 4.443 101.256 43.839 1.00 0.00 H ATOM 17671 C113 PA 475 5.051 101.749 45.993 1.00 0.00 C ATOM 17672 H13R PA 475 4.035 101.599 46.365 1.00 0.00 H ATOM 17673 H13S PA 475 5.188 102.828 45.897 1.00 0.00 H ATOM 17674 C112 PA 475 5.900 101.325 47.092 1.00 0.00 C ATOM 17675 H12R PA 475 6.919 101.548 46.771 1.00 0.00 H ATOM 17676 H12S PA 475 5.745 100.255 47.246 1.00 0.00 H ATOM 17677 C111 PA 475 5.657 102.031 48.486 1.00 0.00 C ATOM 17678 H11R PA 475 6.462 101.722 49.156 1.00 0.00 H ATOM 17679 H11S PA 475 4.712 101.610 48.836 1.00 0.00 H ATOM 17680 C110 PA 475 5.640 103.593 48.506 1.00 0.00 C ATOM 17681 H10R PA 475 5.340 103.933 49.500 1.00 0.00 H ATOM 17682 H10S PA 475 4.769 103.873 47.911 1.00 0.00 H ATOM 17683 C19 PA 475 6.942 104.261 47.995 1.00 0.00 C ATOM 17684 H9R PA 475 7.294 103.777 47.082 1.00 0.00 H ATOM 17685 H9S PA 475 7.622 104.119 48.838 1.00 0.00 H ATOM 17686 C18 PA 475 6.890 105.679 47.527 1.00 0.00 C ATOM 17687 H8R PA 475 6.187 106.320 48.062 1.00 0.00 H ATOM 17688 H8S PA 475 6.359 105.639 46.573 1.00 0.00 H ATOM 17689 C17 PA 475 8.279 106.303 47.246 1.00 0.00 C ATOM 17690 H7R PA 475 8.291 106.870 46.312 1.00 0.00 H ATOM 17691 H7S PA 475 8.931 105.454 47.031 1.00 0.00 H ATOM 17692 C16 PA 475 9.000 107.038 48.350 1.00 0.00 C ATOM 17693 H6R PA 475 9.007 106.481 49.289 1.00 0.00 H ATOM 17694 H6S PA 475 8.568 108.016 48.570 1.00 0.00 H ATOM 17695 C15 PA 475 10.475 107.202 48.009 1.00 0.00 C ATOM 17696 H5R PA 475 10.637 108.071 47.369 1.00 0.00 H ATOM 17697 H5S PA 475 10.835 106.326 47.465 1.00 0.00 H ATOM 17698 C14 PA 475 11.409 107.348 49.221 1.00 0.00 C ATOM 17699 H4R PA 475 12.387 107.471 48.751 1.00 0.00 H ATOM 17700 H4S PA 475 11.480 106.436 49.818 1.00 0.00 H ATOM 17701 C13 PA 475 11.160 108.629 50.184 1.00 0.00 C ATOM 17702 H3R PA 475 10.198 108.512 50.687 1.00 0.00 H ATOM 17703 H3S PA 475 11.194 109.471 49.490 1.00 0.00 H ATOM 17704 C12 PA 475 12.235 108.835 51.279 1.00 0.00 C ATOM 17705 H2R PA 475 13.153 109.323 50.946 1.00 0.00 H ATOM 17706 H2S PA 475 12.409 107.885 51.788 1.00 0.00 H ATOM 17707 C11 PC 476 11.694 109.770 52.330 1.00 0.00 C ATOM 17708 O12 PC 476 12.322 110.739 52.733 1.00 0.00 O ATOM 17709 O11 PC 476 10.468 109.586 52.750 1.00 0.00 O ATOM 17710 C1 PC 476 9.822 110.608 53.678 1.00 0.00 C ATOM 17711 HR PC 476 9.538 111.495 53.106 1.00 0.00 H ATOM 17712 HS PC 476 10.575 110.823 54.440 1.00 0.00 H ATOM 17713 C2 PC 476 8.483 109.973 54.323 1.00 0.00 C ATOM 17714 HX PC 476 7.817 110.824 54.488 1.00 0.00 H ATOM 17715 C3 PC 476 8.695 109.404 55.682 1.00 0.00 C ATOM 17716 HA PC 476 9.407 110.107 56.123 1.00 0.00 H ATOM 17717 HB PC 476 9.092 108.410 55.463 1.00 0.00 H ATOM 17718 O31 PC 476 7.524 109.325 56.431 1.00 0.00 O ATOM 17719 P31 PC 476 7.748 109.014 57.977 1.00 0.00 P ATOM 17720 O32 PC 476 6.519 109.641 58.679 1.00 0.00 O ATOM 17721 C31 PC 476 6.493 110.993 58.946 1.00 0.00 C ATOM 17722 H1A PC 476 6.833 111.422 58.000 1.00 0.00 H ATOM 17723 H1B PC 476 7.199 111.265 59.735 1.00 0.00 H ATOM 17724 C32 PC 476 5.091 111.342 59.179 1.00 0.00 C ATOM 17725 H2A PC 476 4.629 110.750 59.971 1.00 0.00 H ATOM 17726 H2B PC 476 4.595 111.126 58.232 1.00 0.00 H ATOM 17727 N31 PC 476 4.781 112.815 59.433 1.00 0.00 N ATOM 17728 C33 PC 476 5.078 113.628 58.234 1.00 0.00 C ATOM 17729 H3A PC 476 4.590 113.146 57.385 1.00 0.00 H ATOM 17730 H3B PC 476 6.138 113.812 58.054 1.00 0.00 H ATOM 17731 H3C PC 476 4.674 114.606 58.496 1.00 0.00 H ATOM 17732 C34 PC 476 3.294 112.920 59.562 1.00 0.00 C ATOM 17733 H4A PC 476 3.050 112.022 60.133 1.00 0.00 H ATOM 17734 H4B PC 476 2.848 112.896 58.567 1.00 0.00 H ATOM 17735 H4C PC 476 2.972 113.819 60.091 1.00 0.00 H ATOM 17736 C35 PC 476 5.384 113.308 60.693 1.00 0.00 C ATOM 17737 H5A PC 476 4.959 112.742 61.523 1.00 0.00 H ATOM 17738 H5B PC 476 5.159 114.375 60.693 1.00 0.00 H ATOM 17739 H5C PC 476 6.446 113.063 60.642 1.00 0.00 H ATOM 17740 O33 PC 476 7.642 107.557 58.195 1.00 0.00 O ATOM 17741 O34 PC 476 8.935 109.672 58.503 1.00 0.00 O ATOM 17742 O21 PC 476 8.035 108.875 53.467 1.00 0.00 O ATOM 17743 C21 PC 476 6.731 108.803 53.185 1.00 0.00 C ATOM 17744 O22 PC 476 5.884 109.490 53.655 1.00 0.00 O ATOM 17745 C12 OL 477 6.430 107.684 52.230 1.00 0.00 C ATOM 17746 H2R OL 477 7.121 106.864 52.439 1.00 0.00 H ATOM 17747 H2S OL 477 5.434 107.291 52.443 1.00 0.00 H ATOM 17748 C13 OL 477 6.549 108.192 50.758 1.00 0.00 C ATOM 17749 H3R OL 477 7.318 108.935 50.534 1.00 0.00 H ATOM 17750 H3S OL 477 6.927 107.332 50.202 1.00 0.00 H ATOM 17751 C14 OL 477 5.276 108.697 50.128 1.00 0.00 C ATOM 17752 H4R OL 477 5.116 109.687 50.559 1.00 0.00 H ATOM 17753 H4S OL 477 5.492 108.964 49.092 1.00 0.00 H ATOM 17754 C15 OL 477 4.164 107.705 50.152 1.00 0.00 C ATOM 17755 H5R OL 477 4.646 106.764 49.879 1.00 0.00 H ATOM 17756 H5S OL 477 3.728 107.637 51.150 1.00 0.00 H ATOM 17757 C16 OL 477 2.970 108.053 49.132 1.00 0.00 C ATOM 17758 H6R OL 477 2.666 109.090 49.292 1.00 0.00 H ATOM 17759 H6S OL 477 3.361 107.889 48.125 1.00 0.00 H ATOM 17760 C17 OL 477 1.786 107.113 49.252 1.00 0.00 C ATOM 17761 H7R OL 477 2.068 106.058 49.288 1.00 0.00 H ATOM 17762 H7S OL 477 1.330 107.292 50.228 1.00 0.00 H ATOM 17763 C18 OL 477 0.860 107.281 48.030 1.00 0.00 C ATOM 17764 H8R OL 477 0.301 108.205 48.193 1.00 0.00 H ATOM 17765 H8S OL 477 1.346 107.157 47.060 1.00 0.00 H ATOM 17766 C19 OL 477 -0.242 106.174 48.183 1.00 0.00 C ATOM 17767 H9R OL 477 -0.758 106.181 49.139 1.00 0.00 H ATOM 17768 C110 OL 477 -0.787 105.473 47.187 1.00 0.00 C ATOM 17769 H10R OL 477 -1.633 104.840 47.442 1.00 0.00 H ATOM 17770 C111 OL 477 -0.264 105.262 45.806 1.00 0.00 C ATOM 17771 H11R OL 477 -1.026 104.951 45.089 1.00 0.00 H ATOM 17772 H11S OL 477 0.180 106.181 45.419 1.00 0.00 H ATOM 17773 C112 OL 477 0.775 104.201 45.998 1.00 0.00 C ATOM 17774 H12R OL 477 1.662 104.687 46.409 1.00 0.00 H ATOM 17775 H12S OL 477 0.342 103.453 46.665 1.00 0.00 H ATOM 17776 C113 OL 477 1.160 103.496 44.721 1.00 0.00 C ATOM 17777 H13R OL 477 1.988 102.818 44.937 1.00 0.00 H ATOM 17778 H13S OL 477 0.297 102.895 44.426 1.00 0.00 H ATOM 17779 C114 OL 477 1.746 104.505 43.619 1.00 0.00 C ATOM 17780 H14R OL 477 2.197 103.835 42.884 1.00 0.00 H ATOM 17781 H14S OL 477 0.971 104.962 43.000 1.00 0.00 H ATOM 17782 C115 OL 477 2.691 105.503 44.188 1.00 0.00 C ATOM 17783 H15R OL 477 2.109 106.255 44.723 1.00 0.00 H ATOM 17784 H15S OL 477 3.315 105.014 44.939 1.00 0.00 H ATOM 17785 C116 OL 477 3.772 106.082 43.239 1.00 0.00 C ATOM 17786 H16R OL 477 3.204 106.499 42.404 1.00 0.00 H ATOM 17787 H16S OL 477 4.143 106.896 43.865 1.00 0.00 H ATOM 17788 C117 OL 477 4.924 105.285 42.673 1.00 0.00 C ATOM 17789 H17R OL 477 4.505 104.429 42.140 1.00 0.00 H ATOM 17790 H17S OL 477 5.357 105.755 41.787 1.00 0.00 H ATOM 17791 C118 OL 477 6.141 105.036 43.540 1.00 0.00 C ATOM 17792 H18R OL 477 5.804 104.519 44.441 1.00 0.00 H ATOM 17793 H18S OL 477 6.676 105.875 43.991 1.00 0.00 H ATOM 17794 H18T OL 477 6.859 104.376 43.049 1.00 0.00 H TER 17795 OL 477 ATOM 17795 C116 PA 478 96.883 21.903 37.487 1.00 0.00 C ATOM 17796 H16R PA 478 97.045 21.106 36.758 1.00 0.00 H ATOM 17797 H16S PA 478 97.661 21.735 38.235 1.00 0.00 H ATOM 17798 H16T PA 478 97.116 22.895 37.095 1.00 0.00 H ATOM 17799 C115 PA 478 95.512 21.981 38.166 1.00 0.00 C ATOM 17800 H15R PA 478 95.291 20.920 38.305 1.00 0.00 H ATOM 17801 H15S PA 478 94.628 22.297 37.607 1.00 0.00 H ATOM 17802 C114 PA 478 95.503 22.821 39.363 1.00 0.00 C ATOM 17803 H14R PA 478 94.503 22.718 39.790 1.00 0.00 H ATOM 17804 H14S PA 478 95.551 23.841 38.976 1.00 0.00 H ATOM 17805 C113 PA 478 96.517 22.625 40.432 1.00 0.00 C ATOM 17806 H13R PA 478 96.460 23.391 41.208 1.00 0.00 H ATOM 17807 H13S PA 478 97.546 22.863 40.154 1.00 0.00 H ATOM 17808 C112 PA 478 96.613 21.193 41.061 1.00 0.00 C ATOM 17809 H12R PA 478 97.570 21.236 41.586 1.00 0.00 H ATOM 17810 H12S PA 478 96.831 20.411 40.331 1.00 0.00 H ATOM 17811 C111 PA 478 95.456 20.778 42.007 1.00 0.00 C ATOM 17812 H11R PA 478 94.574 20.252 41.637 1.00 0.00 H ATOM 17813 H11S PA 478 94.969 21.681 42.383 1.00 0.00 H ATOM 17814 C110 PA 478 95.917 19.988 43.172 1.00 0.00 C ATOM 17815 H10R PA 478 96.703 20.450 43.773 1.00 0.00 H ATOM 17816 H10S PA 478 96.371 19.109 42.709 1.00 0.00 H ATOM 17817 C19 PA 478 94.783 19.377 44.019 1.00 0.00 C ATOM 17818 H9R PA 478 94.113 18.801 43.377 1.00 0.00 H ATOM 17819 H9S PA 478 94.141 20.222 44.277 1.00 0.00 H ATOM 17820 C18 PA 478 95.100 18.567 45.212 1.00 0.00 C ATOM 17821 H8R PA 478 95.915 19.045 45.759 1.00 0.00 H ATOM 17822 H8S PA 478 95.572 17.650 44.853 1.00 0.00 H ATOM 17823 C17 PA 478 94.017 18.225 46.181 1.00 0.00 C ATOM 17824 H7R PA 478 94.424 17.480 46.868 1.00 0.00 H ATOM 17825 H7S PA 478 93.110 17.883 45.679 1.00 0.00 H ATOM 17826 C16 PA 478 93.629 19.416 47.046 1.00 0.00 C ATOM 17827 H6R PA 478 93.067 20.195 46.526 1.00 0.00 H ATOM 17828 H6S PA 478 94.580 19.892 47.295 1.00 0.00 H ATOM 17829 C15 PA 478 92.968 19.200 48.436 1.00 0.00 C ATOM 17830 H5R PA 478 93.383 18.428 49.088 1.00 0.00 H ATOM 17831 H5S PA 478 91.974 18.777 48.273 1.00 0.00 H ATOM 17832 C14 PA 478 92.903 20.520 49.234 1.00 0.00 C ATOM 17833 H4R PA 478 92.339 21.274 48.681 1.00 0.00 H ATOM 17834 H4S PA 478 93.900 20.960 49.298 1.00 0.00 H ATOM 17835 C13 PA 478 92.120 20.335 50.615 1.00 0.00 C ATOM 17836 H3R PA 478 92.416 19.336 50.944 1.00 0.00 H ATOM 17837 H3S PA 478 91.038 20.263 50.480 1.00 0.00 H ATOM 17838 C12 PA 478 92.555 21.357 51.647 1.00 0.00 C ATOM 17839 H2R PA 478 92.271 22.349 51.288 1.00 0.00 H ATOM 17840 H2S PA 478 93.643 21.283 51.704 1.00 0.00 H ATOM 17841 C11 PGR 479 91.942 21.006 52.972 1.00 0.00 C ATOM 17842 O12 PGR 479 92.285 21.474 54.067 1.00 0.00 O ATOM 17843 O11 PGR 479 91.019 20.056 52.891 1.00 0.00 O ATOM 17844 C1 PGR 479 90.593 19.228 54.024 1.00 0.00 C ATOM 17845 HR PGR 479 89.536 18.975 53.916 1.00 0.00 H ATOM 17846 HS PGR 479 90.738 19.807 54.940 1.00 0.00 H ATOM 17847 C2 PGR 479 91.401 17.914 54.196 1.00 0.00 C ATOM 17848 HX PGR 479 90.932 17.399 55.038 1.00 0.00 H ATOM 17849 C3 PGR 479 92.848 18.330 54.569 1.00 0.00 C ATOM 17850 HA PGR 479 92.942 19.378 54.863 1.00 0.00 H ATOM 17851 HB PGR 479 93.519 18.201 53.716 1.00 0.00 H ATOM 17852 O31 PGR 479 93.335 17.454 55.566 1.00 0.00 O ATOM 17853 P31 PGR 479 94.848 17.407 55.990 1.00 0.00 P ATOM 17854 O32 PGR 479 95.222 18.937 56.017 1.00 0.00 O ATOM 17855 C31 PGR 479 94.864 19.776 57.081 1.00 0.00 C ATOM 17856 H1A PGR 479 95.225 19.452 58.061 1.00 0.00 H ATOM 17857 H1B PGR 479 93.786 19.951 57.043 1.00 0.00 H ATOM 17858 C32 PGR 479 95.610 21.016 56.715 1.00 0.00 C ATOM 17859 H2A PGR 479 95.269 21.419 55.758 1.00 0.00 H ATOM 17860 O35 PGR 479 97.051 20.784 56.800 1.00 0.00 O ATOM 17861 HO5A PGR 479 97.191 19.947 56.323 1.00 0.00 H ATOM 17862 C33 PGR 479 95.363 22.136 57.765 1.00 0.00 C ATOM 17863 H3A PGR 479 96.167 22.876 57.738 1.00 0.00 H ATOM 17864 H3B PGR 479 94.478 22.649 57.382 1.00 0.00 H ATOM 17865 O33 PGR 479 95.008 16.861 57.334 1.00 0.00 O ATOM 17866 O34 PGR 479 95.664 16.889 54.823 1.00 0.00 O ATOM 17867 O21 PGR 479 91.234 17.212 52.910 1.00 0.00 O ATOM 17868 C21 PGR 479 91.204 15.857 52.986 1.00 0.00 C ATOM 17869 O22 PGR 479 91.352 15.304 54.058 1.00 0.00 O ATOM 17870 O36 PGR 479 95.155 21.759 59.164 1.00 0.00 O ATOM 17871 HO6A PGR 479 95.838 21.100 59.383 1.00 0.00 H ATOM 17872 C12 OL 480 91.054 15.132 51.654 1.00 0.00 C ATOM 17873 H2R OL 480 91.923 14.477 51.564 1.00 0.00 H ATOM 17874 H2S OL 480 90.232 14.414 51.676 1.00 0.00 H ATOM 17875 C13 OL 480 90.930 16.030 50.370 1.00 0.00 C ATOM 17876 H3R OL 480 90.079 16.695 50.526 1.00 0.00 H ATOM 17877 H3S OL 480 91.920 16.477 50.250 1.00 0.00 H ATOM 17878 C14 OL 480 90.595 15.314 49.058 1.00 0.00 C ATOM 17879 H4R OL 480 91.386 14.570 48.941 1.00 0.00 H ATOM 17880 H4S OL 480 89.649 14.793 49.214 1.00 0.00 H ATOM 17881 C15 OL 480 90.520 16.237 47.907 1.00 0.00 C ATOM 17882 H5R OL 480 89.666 16.902 48.052 1.00 0.00 H ATOM 17883 H5S OL 480 91.401 16.859 47.736 1.00 0.00 H ATOM 17884 C16 OL 480 90.263 15.345 46.642 1.00 0.00 C ATOM 17885 H6R OL 480 91.152 14.727 46.781 1.00 0.00 H ATOM 17886 H6S OL 480 89.465 14.600 46.638 1.00 0.00 H ATOM 17887 C17 OL 480 90.239 16.170 45.312 1.00 0.00 C ATOM 17888 H7R OL 480 89.490 16.958 45.420 1.00 0.00 H ATOM 17889 H7S OL 480 91.053 16.895 45.243 1.00 0.00 H ATOM 17890 C18 OL 480 89.978 15.396 43.999 1.00 0.00 C ATOM 17891 H8R OL 480 89.220 14.694 44.351 1.00 0.00 H ATOM 17892 H8S OL 480 89.418 15.896 43.206 1.00 0.00 H ATOM 17893 C19 OL 480 91.175 14.647 43.550 1.00 0.00 C ATOM 17894 H9R OL 480 91.996 14.559 44.257 1.00 0.00 H ATOM 17895 C110 OL 480 91.398 13.993 42.438 1.00 0.00 C ATOM 17896 H10R OL 480 92.378 13.538 42.320 1.00 0.00 H ATOM 17897 C111 OL 480 90.418 13.776 41.345 1.00 0.00 C ATOM 17898 H11R OL 480 89.697 13.042 41.709 1.00 0.00 H ATOM 17899 H11S OL 480 89.761 14.619 41.124 1.00 0.00 H ATOM 17900 C112 OL 480 90.866 13.037 40.088 1.00 0.00 C ATOM 17901 H12R OL 480 91.638 13.641 39.607 1.00 0.00 H ATOM 17902 H12S OL 480 91.359 12.113 40.396 1.00 0.00 H ATOM 17903 C113 OL 480 89.845 12.680 39.090 1.00 0.00 C ATOM 17904 H13R OL 480 89.034 12.270 39.695 1.00 0.00 H ATOM 17905 H13S OL 480 89.465 13.635 38.723 1.00 0.00 H ATOM 17906 C114 OL 480 90.262 11.728 37.970 1.00 0.00 C ATOM 17907 H14R OL 480 90.302 10.673 38.250 1.00 0.00 H ATOM 17908 H14S OL 480 89.417 11.835 37.286 1.00 0.00 H ATOM 17909 C115 OL 480 91.473 12.265 37.266 1.00 0.00 C ATOM 17910 H15R OL 480 91.414 13.351 37.165 1.00 0.00 H ATOM 17911 H15S OL 480 92.319 11.992 37.901 1.00 0.00 H ATOM 17912 C116 OL 480 91.699 11.696 35.901 1.00 0.00 C ATOM 17913 H16R OL 480 92.720 11.927 35.587 1.00 0.00 H ATOM 17914 H16S OL 480 91.770 10.631 36.133 1.00 0.00 H ATOM 17915 C117 OL 480 90.644 11.876 34.906 1.00 0.00 C ATOM 17916 H17R OL 480 89.663 11.475 35.170 1.00 0.00 H ATOM 17917 H17S OL 480 90.602 12.963 34.808 1.00 0.00 H ATOM 17918 C118 OL 480 90.882 11.371 33.495 1.00 0.00 C ATOM 17919 H18R OL 480 90.643 10.314 33.362 1.00 0.00 H ATOM 17920 H18S OL 480 91.935 11.454 33.220 1.00 0.00 H ATOM 17921 H18T OL 480 90.228 11.864 32.772 1.00 0.00 H TER 17922 OL 480 ATOM 17922 C116 PA 481 112.776 47.509 43.348 1.00 0.00 C ATOM 17923 H16R PA 481 112.280 48.244 42.711 1.00 0.00 H ATOM 17924 H16S PA 481 113.416 46.975 42.642 1.00 0.00 H ATOM 17925 H16T PA 481 113.369 48.273 43.854 1.00 0.00 H ATOM 17926 C115 PA 481 111.783 46.668 44.077 1.00 0.00 C ATOM 17927 H15R PA 481 111.142 46.231 43.309 1.00 0.00 H ATOM 17928 H15S PA 481 111.165 47.256 44.759 1.00 0.00 H ATOM 17929 C114 PA 481 112.411 45.527 44.803 1.00 0.00 C ATOM 17930 H14R PA 481 112.969 44.980 44.041 1.00 0.00 H ATOM 17931 H14S PA 481 111.603 44.924 45.224 1.00 0.00 H ATOM 17932 C113 PA 481 113.412 46.022 45.894 1.00 0.00 C ATOM 17933 H13R PA 481 114.168 46.719 45.526 1.00 0.00 H ATOM 17934 H13S PA 481 114.024 45.130 46.043 1.00 0.00 H ATOM 17935 C112 PA 481 112.830 46.468 47.241 1.00 0.00 C ATOM 17936 H12R PA 481 112.461 47.494 47.193 1.00 0.00 H ATOM 17937 H12S PA 481 113.698 46.542 47.900 1.00 0.00 H ATOM 17938 C111 PA 481 111.850 45.484 47.900 1.00 0.00 C ATOM 17939 H11R PA 481 112.231 44.488 47.665 1.00 0.00 H ATOM 17940 H11S PA 481 110.889 45.443 47.383 1.00 0.00 H ATOM 17941 C110 PA 481 111.668 45.659 49.325 1.00 0.00 C ATOM 17942 H10R PA 481 111.040 46.549 49.398 1.00 0.00 H ATOM 17943 H10S PA 481 112.625 46.022 49.706 1.00 0.00 H ATOM 17944 C19 PA 481 111.059 44.409 50.039 1.00 0.00 C ATOM 17945 H9R PA 481 111.893 43.713 50.148 1.00 0.00 H ATOM 17946 H9S PA 481 110.354 43.864 49.408 1.00 0.00 H ATOM 17947 C18 PA 481 110.445 44.788 51.416 1.00 0.00 C ATOM 17948 H8R PA 481 111.065 45.545 51.900 1.00 0.00 H ATOM 17949 H8S PA 481 110.335 43.924 52.075 1.00 0.00 H ATOM 17950 C17 PA 481 109.098 45.526 51.331 1.00 0.00 C ATOM 17951 H7R PA 481 108.323 44.818 51.029 1.00 0.00 H ATOM 17952 H7S PA 481 109.161 46.268 50.532 1.00 0.00 H ATOM 17953 C16 PA 481 108.719 46.234 52.611 1.00 0.00 C ATOM 17954 H6R PA 481 109.356 47.057 52.942 1.00 0.00 H ATOM 17955 H6S PA 481 108.756 45.606 53.503 1.00 0.00 H ATOM 17956 C15 PA 481 107.340 46.943 52.560 1.00 0.00 C ATOM 17957 H5R PA 481 106.605 46.249 52.144 1.00 0.00 H ATOM 17958 H5S PA 481 107.477 47.780 51.872 1.00 0.00 H ATOM 17959 C14 PA 481 106.773 47.495 53.856 1.00 0.00 C ATOM 17960 H4R PA 481 106.065 48.303 53.657 1.00 0.00 H ATOM 17961 H4S PA 481 107.610 47.870 54.449 1.00 0.00 H ATOM 17962 C13 PA 481 105.983 46.515 54.763 1.00 0.00 C ATOM 17963 H3R PA 481 106.640 45.644 54.811 1.00 0.00 H ATOM 17964 H3S PA 481 105.088 46.211 54.216 1.00 0.00 H ATOM 17965 C12 PA 481 105.489 47.150 56.108 1.00 0.00 C ATOM 17966 H2R PA 481 106.266 47.748 56.589 1.00 0.00 H ATOM 17967 H2S PA 481 104.694 47.867 55.892 1.00 0.00 H ATOM 17968 C11 PC 482 105.040 46.089 57.084 1.00 0.00 C ATOM 17969 O12 PC 482 104.967 46.404 58.255 1.00 0.00 O ATOM 17970 O11 PC 482 104.806 44.882 56.519 1.00 0.00 O ATOM 17971 C1 PC 482 104.447 43.750 57.283 1.00 0.00 C ATOM 17972 HR PC 482 105.281 43.560 57.963 1.00 0.00 H ATOM 17973 HS PC 482 104.291 42.952 56.553 1.00 0.00 H ATOM 17974 C2 PC 482 103.141 44.048 58.225 1.00 0.00 C ATOM 17975 HX PC 482 103.452 44.605 59.113 1.00 0.00 H ATOM 17976 C3 PC 482 102.517 42.685 58.742 1.00 0.00 C ATOM 17977 HA PC 482 103.045 42.358 59.641 1.00 0.00 H ATOM 17978 HB PC 482 102.520 41.908 57.973 1.00 0.00 H ATOM 17979 O31 PC 482 101.216 43.125 59.153 1.00 0.00 O ATOM 17980 P31 PC 482 100.344 42.219 60.098 1.00 0.00 P ATOM 17981 O32 PC 482 100.072 40.950 59.274 1.00 0.00 O ATOM 17982 C31 PC 482 99.240 41.036 58.238 1.00 0.00 C ATOM 17983 H1A PC 482 99.531 41.724 57.441 1.00 0.00 H ATOM 17984 H1B PC 482 98.217 41.197 58.587 1.00 0.00 H ATOM 17985 C32 PC 482 99.177 39.658 57.634 1.00 0.00 C ATOM 17986 H2A PC 482 100.166 39.398 57.255 1.00 0.00 H ATOM 17987 H2B PC 482 98.483 39.704 56.793 1.00 0.00 H ATOM 17988 N31 PC 482 98.730 38.564 58.597 1.00 0.00 N ATOM 17989 C33 PC 482 97.579 38.941 59.450 1.00 0.00 C ATOM 17990 H3A PC 482 96.727 39.181 58.812 1.00 0.00 H ATOM 17991 H3B PC 482 97.853 39.801 60.063 1.00 0.00 H ATOM 17992 H3C PC 482 97.399 38.068 60.078 1.00 0.00 H ATOM 17993 C34 PC 482 98.325 37.432 57.763 1.00 0.00 C ATOM 17994 H4A PC 482 97.482 37.699 57.124 1.00 0.00 H ATOM 17995 H4B PC 482 98.121 36.577 58.408 1.00 0.00 H ATOM 17996 H4C PC 482 99.204 37.239 57.146 1.00 0.00 H ATOM 17997 C35 PC 482 99.845 38.108 59.504 1.00 0.00 C ATOM 17998 H5A PC 482 100.679 37.736 58.906 1.00 0.00 H ATOM 17999 H5B PC 482 99.487 37.398 60.251 1.00 0.00 H ATOM 18000 H5C PC 482 100.046 39.004 60.092 1.00 0.00 H ATOM 18001 O33 PC 482 101.142 41.875 61.285 1.00 0.00 O ATOM 18002 O34 PC 482 99.030 42.885 60.321 1.00 0.00 O ATOM 18003 O21 PC 482 102.155 44.777 57.386 1.00 0.00 O ATOM 18004 C21 PC 482 101.528 44.276 56.273 1.00 0.00 C ATOM 18005 O22 PC 482 101.755 43.243 55.707 1.00 0.00 O ATOM 18006 C12 OL 483 100.542 45.258 55.723 1.00 0.00 C ATOM 18007 H2R OL 483 99.569 44.765 55.777 1.00 0.00 H ATOM 18008 H2S OL 483 100.459 46.044 56.477 1.00 0.00 H ATOM 18009 C13 OL 483 100.941 45.797 54.392 1.00 0.00 C ATOM 18010 H3R OL 483 101.087 45.010 53.650 1.00 0.00 H ATOM 18011 H3S OL 483 100.090 46.311 53.942 1.00 0.00 H ATOM 18012 C14 OL 483 102.111 46.731 54.501 1.00 0.00 C ATOM 18013 H4R OL 483 101.797 47.343 55.349 1.00 0.00 H ATOM 18014 H4S OL 483 103.003 46.210 54.855 1.00 0.00 H ATOM 18015 C15 OL 483 102.368 47.674 53.305 1.00 0.00 C ATOM 18016 H5R OL 483 102.872 47.092 52.530 1.00 0.00 H ATOM 18017 H5S OL 483 101.435 47.974 52.823 1.00 0.00 H ATOM 18018 C16 OL 483 103.092 48.908 53.640 1.00 0.00 C ATOM 18019 H6R OL 483 102.611 49.443 54.461 1.00 0.00 H ATOM 18020 H6S OL 483 104.013 48.690 54.183 1.00 0.00 H ATOM 18021 C17 OL 483 103.427 49.838 52.403 1.00 0.00 C ATOM 18022 H7R OL 483 102.580 50.526 52.372 1.00 0.00 H ATOM 18023 H7S OL 483 104.262 50.514 52.601 1.00 0.00 H ATOM 18024 C18 OL 483 103.722 49.268 50.983 1.00 0.00 C ATOM 18025 H8R OL 483 104.615 48.654 51.121 1.00 0.00 H ATOM 18026 H8S OL 483 102.976 48.513 50.727 1.00 0.00 H ATOM 18027 C19 OL 483 103.854 50.207 49.863 1.00 0.00 C ATOM 18028 H9R OL 483 102.926 50.560 49.420 1.00 0.00 H ATOM 18029 C110 OL 483 104.975 50.615 49.263 1.00 0.00 C ATOM 18030 H10R OL 483 105.083 51.385 48.504 1.00 0.00 H ATOM 18031 C111 OL 483 106.324 50.503 49.813 1.00 0.00 C ATOM 18032 H11R OL 483 106.563 51.518 50.138 1.00 0.00 H ATOM 18033 H11S OL 483 106.206 49.999 50.774 1.00 0.00 H ATOM 18034 C112 OL 483 107.333 49.875 48.789 1.00 0.00 C ATOM 18035 H12R OL 483 106.869 48.962 48.413 1.00 0.00 H ATOM 18036 H12S OL 483 107.428 50.505 47.902 1.00 0.00 H ATOM 18037 C113 OL 483 108.762 49.527 49.265 1.00 0.00 C ATOM 18038 H13R OL 483 109.262 50.430 49.620 1.00 0.00 H ATOM 18039 H13S OL 483 108.877 48.847 50.112 1.00 0.00 H ATOM 18040 C114 OL 483 109.569 48.929 48.135 1.00 0.00 C ATOM 18041 H14R OL 483 110.550 48.760 48.583 1.00 0.00 H ATOM 18042 H14S OL 483 109.217 47.909 47.967 1.00 0.00 H ATOM 18043 C115 OL 483 109.880 49.730 46.893 1.00 0.00 C ATOM 18044 H15R OL 483 110.138 49.025 46.100 1.00 0.00 H ATOM 18045 H15S OL 483 108.984 50.253 46.553 1.00 0.00 H ATOM 18046 C116 OL 483 111.081 50.736 47.087 1.00 0.00 C ATOM 18047 H16R OL 483 111.056 51.482 47.884 1.00 0.00 H ATOM 18048 H16S OL 483 111.981 50.121 47.164 1.00 0.00 H ATOM 18049 C117 OL 483 111.324 51.477 45.757 1.00 0.00 C ATOM 18050 H17R OL 483 110.427 52.054 45.520 1.00 0.00 H ATOM 18051 H17S OL 483 112.273 51.982 45.947 1.00 0.00 H ATOM 18052 C118 OL 483 111.653 50.546 44.550 1.00 0.00 C ATOM 18053 H18R OL 483 112.290 49.724 44.879 1.00 0.00 H ATOM 18054 H18S OL 483 112.074 51.060 43.683 1.00 0.00 H ATOM 18055 H18T OL 483 110.701 50.202 44.139 1.00 0.00 H TER 18056 OL 483 ATOM 18056 C116 PA 484 116.732 104.130 46.112 1.00 0.00 C ATOM 18057 H16R PA 484 116.461 103.578 45.210 1.00 0.00 H ATOM 18058 H16S PA 484 116.089 105.012 46.140 1.00 0.00 H ATOM 18059 H16T PA 484 116.649 103.462 46.972 1.00 0.00 H ATOM 18060 C115 PA 484 118.142 104.607 46.303 1.00 0.00 C ATOM 18061 H15R PA 484 118.352 105.314 45.498 1.00 0.00 H ATOM 18062 H15S PA 484 118.857 103.785 46.218 1.00 0.00 H ATOM 18063 C114 PA 484 118.351 105.239 47.712 1.00 0.00 C ATOM 18064 H14R PA 484 118.365 104.478 48.495 1.00 0.00 H ATOM 18065 H14S PA 484 117.527 105.891 48.009 1.00 0.00 H ATOM 18066 C113 PA 484 119.638 105.925 47.776 1.00 0.00 C ATOM 18067 H13R PA 484 119.576 106.730 47.040 1.00 0.00 H ATOM 18068 H13S PA 484 120.489 105.324 47.450 1.00 0.00 H ATOM 18069 C112 PA 484 119.960 106.286 49.219 1.00 0.00 C ATOM 18070 H12R PA 484 120.043 105.360 49.791 1.00 0.00 H ATOM 18071 H12S PA 484 119.090 106.851 49.561 1.00 0.00 H ATOM 18072 C111 PA 484 121.216 107.116 49.342 1.00 0.00 C ATOM 18073 H11R PA 484 121.249 107.952 48.640 1.00 0.00 H ATOM 18074 H11S PA 484 121.976 106.409 49.000 1.00 0.00 H ATOM 18075 C110 PA 484 121.370 107.773 50.662 1.00 0.00 C ATOM 18076 H10R PA 484 122.390 108.115 50.851 1.00 0.00 H ATOM 18077 H10S PA 484 121.301 107.066 51.491 1.00 0.00 H ATOM 18078 C19 PA 484 120.376 108.930 50.888 1.00 0.00 C ATOM 18079 H9R PA 484 119.410 108.460 51.084 1.00 0.00 H ATOM 18080 H9S PA 484 120.309 109.599 50.027 1.00 0.00 H ATOM 18081 C18 PA 484 120.650 109.798 52.094 1.00 0.00 C ATOM 18082 H8R PA 484 121.585 110.349 51.974 1.00 0.00 H ATOM 18083 H8S PA 484 120.785 109.171 52.978 1.00 0.00 H ATOM 18084 C17 PA 484 119.504 110.780 52.259 1.00 0.00 C ATOM 18085 H7R PA 484 118.612 110.159 52.157 1.00 0.00 H ATOM 18086 H7S PA 484 119.528 111.432 51.382 1.00 0.00 H ATOM 18087 C16 PA 484 119.611 111.849 53.481 1.00 0.00 C ATOM 18088 H6R PA 484 120.402 112.579 53.294 1.00 0.00 H ATOM 18089 H6S PA 484 119.981 111.331 54.368 1.00 0.00 H ATOM 18090 C15 PA 484 118.373 112.643 53.846 1.00 0.00 C ATOM 18091 H5R PA 484 117.536 112.043 54.211 1.00 0.00 H ATOM 18092 H5S PA 484 117.975 113.070 52.923 1.00 0.00 H ATOM 18093 C14 PA 484 118.684 113.704 54.880 1.00 0.00 C ATOM 18094 H4R PA 484 119.221 114.537 54.422 1.00 0.00 H ATOM 18095 H4S PA 484 119.135 113.223 55.751 1.00 0.00 H ATOM 18096 C13 PA 484 117.377 114.360 55.282 1.00 0.00 C ATOM 18097 H3R PA 484 116.647 113.612 55.596 1.00 0.00 H ATOM 18098 H3S PA 484 116.976 114.869 54.402 1.00 0.00 H ATOM 18099 C12 PA 484 117.646 115.439 56.252 1.00 0.00 C ATOM 18100 H2R PA 484 118.068 116.303 55.734 1.00 0.00 H ATOM 18101 H2S PA 484 118.296 115.056 57.042 1.00 0.00 H ATOM 18102 C11 PGR 485 116.362 115.963 56.909 1.00 0.00 C ATOM 18103 O12 PGR 485 115.543 116.640 56.435 1.00 0.00 O ATOM 18104 O11 PGR 485 116.378 115.703 58.211 1.00 0.00 O ATOM 18105 C1 PGR 485 115.275 116.153 59.014 1.00 0.00 C ATOM 18106 HR PGR 485 115.069 117.217 58.872 1.00 0.00 H ATOM 18107 HS PGR 485 115.541 115.920 60.049 1.00 0.00 H ATOM 18108 C2 PGR 485 114.103 115.181 58.648 1.00 0.00 C ATOM 18109 HX PGR 485 113.963 115.045 57.572 1.00 0.00 H ATOM 18110 C3 PGR 485 112.722 115.558 59.208 1.00 0.00 C ATOM 18111 HA PGR 485 112.087 114.692 59.414 1.00 0.00 H ATOM 18112 HB PGR 485 112.213 116.177 58.465 1.00 0.00 H ATOM 18113 O31 PGR 485 112.857 116.301 60.423 1.00 0.00 O ATOM 18114 P31 PGR 485 111.933 117.574 60.713 1.00 0.00 P ATOM 18115 O32 PGR 485 110.453 117.127 60.358 1.00 0.00 O ATOM 18116 C31 PGR 485 109.647 116.338 61.167 1.00 0.00 C ATOM 18117 H1A PGR 485 108.644 116.433 60.743 1.00 0.00 H ATOM 18118 H1B PGR 485 109.659 116.755 62.178 1.00 0.00 H ATOM 18119 C32 PGR 485 110.046 114.813 61.229 1.00 0.00 C ATOM 18120 H2A PGR 485 111.080 114.818 61.583 1.00 0.00 H ATOM 18121 O35 PGR 485 109.956 114.005 60.081 1.00 0.00 O ATOM 18122 HO5A PGR 485 109.264 114.318 59.471 1.00 0.00 H ATOM 18123 C33 PGR 485 109.154 114.123 62.209 1.00 0.00 C ATOM 18124 H3A PGR 485 109.265 113.042 62.326 1.00 0.00 H ATOM 18125 H3B PGR 485 109.537 114.628 63.100 1.00 0.00 H ATOM 18126 O33 PGR 485 112.019 117.917 62.149 1.00 0.00 O ATOM 18127 O34 PGR 485 112.251 118.615 59.730 1.00 0.00 O ATOM 18128 O21 PGR 485 114.397 113.834 59.136 1.00 0.00 O ATOM 18129 C21 PGR 485 114.534 113.650 60.485 1.00 0.00 C ATOM 18130 O22 PGR 485 114.766 114.447 61.407 1.00 0.00 O ATOM 18131 O36 PGR 485 107.804 114.439 61.957 1.00 0.00 O ATOM 18132 HO6A PGR 485 107.656 114.061 61.071 1.00 0.00 H ATOM 18133 C12 OL 486 114.338 112.236 60.802 1.00 0.00 C ATOM 18134 H2R OL 486 113.981 112.072 61.821 1.00 0.00 H ATOM 18135 H2S OL 486 113.720 111.746 60.046 1.00 0.00 H ATOM 18136 C13 OL 486 115.678 111.479 60.592 1.00 0.00 C ATOM 18137 H3R OL 486 116.431 111.959 61.221 1.00 0.00 H ATOM 18138 H3S OL 486 115.672 110.473 61.017 1.00 0.00 H ATOM 18139 C14 OL 486 116.268 111.395 59.199 1.00 0.00 C ATOM 18140 H4R OL 486 115.621 110.721 58.634 1.00 0.00 H ATOM 18141 H4S OL 486 116.232 112.366 58.700 1.00 0.00 H ATOM 18142 C15 OL 486 117.585 110.672 59.194 1.00 0.00 C ATOM 18143 H5R OL 486 118.413 111.346 59.424 1.00 0.00 H ATOM 18144 H5S OL 486 117.575 109.912 59.977 1.00 0.00 H ATOM 18145 C16 OL 486 117.910 109.925 57.851 1.00 0.00 C ATOM 18146 H6R OL 486 117.072 109.238 57.719 1.00 0.00 H ATOM 18147 H6S OL 486 118.007 110.554 56.963 1.00 0.00 H ATOM 18148 C17 OL 486 119.219 109.256 57.763 1.00 0.00 C ATOM 18149 H7R OL 486 119.676 109.230 56.771 1.00 0.00 H ATOM 18150 H7S OL 486 119.878 109.884 58.366 1.00 0.00 H ATOM 18151 C18 OL 486 119.270 107.941 58.469 1.00 0.00 C ATOM 18152 H8R OL 486 119.074 108.295 59.484 1.00 0.00 H ATOM 18153 H8S OL 486 118.435 107.279 58.228 1.00 0.00 H ATOM 18154 C19 OL 486 120.537 107.166 58.436 1.00 0.00 C ATOM 18155 H9R OL 486 121.109 107.397 59.331 1.00 0.00 H ATOM 18156 C110 OL 486 120.818 106.288 57.518 1.00 0.00 C ATOM 18157 H10R OL 486 121.737 105.731 57.680 1.00 0.00 H ATOM 18158 C111 OL 486 119.991 105.874 56.413 1.00 0.00 C ATOM 18159 H11R OL 486 119.556 104.936 56.764 1.00 0.00 H ATOM 18160 H11S OL 486 119.144 106.546 56.262 1.00 0.00 H ATOM 18161 C112 OL 486 120.732 105.492 55.112 1.00 0.00 C ATOM 18162 H12R OL 486 121.258 106.435 54.950 1.00 0.00 H ATOM 18163 H12S OL 486 121.467 104.709 55.308 1.00 0.00 H ATOM 18164 C113 OL 486 119.819 105.433 53.895 1.00 0.00 C ATOM 18165 H13R OL 486 118.877 105.891 54.202 1.00 0.00 H ATOM 18166 H13S OL 486 120.210 105.962 53.024 1.00 0.00 H ATOM 18167 C114 OL 486 119.327 104.095 53.555 1.00 0.00 C ATOM 18168 H14R OL 486 120.173 103.626 53.049 1.00 0.00 H ATOM 18169 H14S OL 486 119.068 103.487 54.424 1.00 0.00 H ATOM 18170 C115 OL 486 118.263 104.231 52.504 1.00 0.00 C ATOM 18171 H15R OL 486 117.413 104.853 52.794 1.00 0.00 H ATOM 18172 H15S OL 486 118.679 104.843 51.701 1.00 0.00 H ATOM 18173 C116 OL 486 117.581 102.927 52.124 1.00 0.00 C ATOM 18174 H16R OL 486 118.340 102.268 51.698 1.00 0.00 H ATOM 18175 H16S OL 486 117.135 102.432 52.990 1.00 0.00 H ATOM 18176 C117 OL 486 116.422 103.113 51.092 1.00 0.00 C ATOM 18177 H17R OL 486 115.646 103.650 51.641 1.00 0.00 H ATOM 18178 H17S OL 486 116.745 103.747 50.265 1.00 0.00 H ATOM 18179 C118 OL 486 115.821 101.859 50.519 1.00 0.00 C ATOM 18180 H18R OL 486 115.352 101.282 51.319 1.00 0.00 H ATOM 18181 H18S OL 486 116.537 101.290 49.922 1.00 0.00 H ATOM 18182 H18T OL 486 115.008 102.089 49.827 1.00 0.00 H TER 18183 OL 486 ATOM 18183 C116 PA 487 73.816 30.552 47.082 1.00 0.00 C ATOM 18184 H16R PA 487 74.557 29.779 46.868 1.00 0.00 H ATOM 18185 H16S PA 487 74.072 31.095 47.994 1.00 0.00 H ATOM 18186 H16T PA 487 73.848 31.277 46.266 1.00 0.00 H ATOM 18187 C115 PA 487 72.480 29.843 47.328 1.00 0.00 C ATOM 18188 H15R PA 487 71.708 30.409 47.853 1.00 0.00 H ATOM 18189 H15S PA 487 72.789 29.208 48.160 1.00 0.00 H ATOM 18190 C114 PA 487 71.948 29.027 46.122 1.00 0.00 C ATOM 18191 H14R PA 487 72.781 28.486 45.668 1.00 0.00 H ATOM 18192 H14S PA 487 71.633 29.736 45.354 1.00 0.00 H ATOM 18193 C113 PA 487 70.906 27.958 46.469 1.00 0.00 C ATOM 18194 H13R PA 487 71.187 27.607 47.464 1.00 0.00 H ATOM 18195 H13S PA 487 71.209 27.146 45.805 1.00 0.00 H ATOM 18196 C112 PA 487 69.469 28.437 46.243 1.00 0.00 C ATOM 18197 H12R PA 487 69.377 29.079 45.364 1.00 0.00 H ATOM 18198 H12S PA 487 69.231 29.153 47.033 1.00 0.00 H ATOM 18199 C111 PA 487 68.551 27.210 46.177 1.00 0.00 C ATOM 18200 H11R PA 487 68.843 26.568 47.010 1.00 0.00 H ATOM 18201 H11S PA 487 68.832 26.682 45.264 1.00 0.00 H ATOM 18202 C110 PA 487 67.034 27.702 46.184 1.00 0.00 C ATOM 18203 H10R PA 487 66.829 28.162 45.215 1.00 0.00 H ATOM 18204 H10S PA 487 66.806 28.541 46.845 1.00 0.00 H ATOM 18205 C19 PA 487 65.938 26.686 46.565 1.00 0.00 C ATOM 18206 H9R PA 487 65.018 27.250 46.731 1.00 0.00 H ATOM 18207 H9S PA 487 66.219 26.219 47.512 1.00 0.00 H ATOM 18208 C18 PA 487 65.791 25.535 45.600 1.00 0.00 C ATOM 18209 H8R PA 487 66.763 25.038 45.625 1.00 0.00 H ATOM 18210 H8S PA 487 65.486 25.880 44.610 1.00 0.00 H ATOM 18211 C17 PA 487 64.765 24.497 45.982 1.00 0.00 C ATOM 18212 H7R PA 487 63.769 24.884 45.757 1.00 0.00 H ATOM 18213 H7S PA 487 64.659 24.336 47.057 1.00 0.00 H ATOM 18214 C16 PA 487 64.861 23.181 45.279 1.00 0.00 C ATOM 18215 H6R PA 487 65.853 22.801 45.532 1.00 0.00 H ATOM 18216 H6S PA 487 64.745 23.220 44.194 1.00 0.00 H ATOM 18217 C15 PA 487 63.904 22.124 45.864 1.00 0.00 C ATOM 18218 H5R PA 487 62.868 22.347 45.601 1.00 0.00 H ATOM 18219 H5S PA 487 63.987 22.101 46.953 1.00 0.00 H ATOM 18220 C14 PA 487 64.140 20.691 45.325 1.00 0.00 C ATOM 18221 H4R PA 487 65.169 20.345 45.207 1.00 0.00 H ATOM 18222 H4S PA 487 63.732 20.560 44.321 1.00 0.00 H ATOM 18223 C13 PA 487 63.430 19.673 46.162 1.00 0.00 C ATOM 18224 H3R PA 487 62.408 19.849 45.818 1.00 0.00 H ATOM 18225 H3S PA 487 63.439 19.955 47.217 1.00 0.00 H ATOM 18226 C12 PA 487 63.951 18.247 45.860 1.00 0.00 C ATOM 18227 H2R PA 487 65.005 18.064 46.077 1.00 0.00 H ATOM 18228 H2S PA 487 63.907 17.917 44.820 1.00 0.00 H ATOM 18229 C11 PGR 488 63.168 17.382 46.825 1.00 0.00 C ATOM 18230 O12 PGR 488 63.618 17.046 47.907 1.00 0.00 O ATOM 18231 O11 PGR 488 61.901 17.264 46.407 1.00 0.00 O ATOM 18232 C1 PGR 488 60.977 16.608 47.398 1.00 0.00 C ATOM 18233 HR PGR 488 61.379 15.731 47.912 1.00 0.00 H ATOM 18234 HS PGR 488 60.126 16.264 46.805 1.00 0.00 H ATOM 18235 C2 PGR 488 60.422 17.604 48.409 1.00 0.00 C ATOM 18236 HX PGR 488 61.125 18.437 48.489 1.00 0.00 H ATOM 18237 C3 PGR 488 60.256 16.887 49.751 1.00 0.00 C ATOM 18238 HA PGR 488 61.109 16.292 50.086 1.00 0.00 H ATOM 18239 HB PGR 488 59.376 16.253 49.619 1.00 0.00 H ATOM 18240 O31 PGR 488 59.958 17.850 50.787 1.00 0.00 O ATOM 18241 P31 PGR 488 59.771 17.377 52.281 1.00 0.00 P ATOM 18242 O32 PGR 488 58.437 16.474 52.355 1.00 0.00 O ATOM 18243 C31 PGR 488 57.170 16.952 51.946 1.00 0.00 C ATOM 18244 H1A PGR 488 56.478 16.239 51.490 1.00 0.00 H ATOM 18245 H1B PGR 488 57.265 17.790 51.251 1.00 0.00 H ATOM 18246 C32 PGR 488 56.447 17.594 53.131 1.00 0.00 C ATOM 18247 H2A PGR 488 57.188 18.301 53.513 1.00 0.00 H ATOM 18248 O35 PGR 488 56.018 16.735 54.273 1.00 0.00 O ATOM 18249 HO5A PGR 488 55.450 17.344 54.779 1.00 0.00 H ATOM 18250 C33 PGR 488 55.193 18.432 52.610 1.00 0.00 C ATOM 18251 H3A PGR 488 55.569 19.225 51.959 1.00 0.00 H ATOM 18252 H3B PGR 488 54.497 17.791 52.061 1.00 0.00 H ATOM 18253 O33 PGR 488 60.907 16.535 52.701 1.00 0.00 O ATOM 18254 O34 PGR 488 59.612 18.696 52.964 1.00 0.00 O ATOM 18255 O21 PGR 488 59.152 18.107 47.823 1.00 0.00 O ATOM 18256 C21 PGR 488 58.692 19.258 48.305 1.00 0.00 C ATOM 18257 O22 PGR 488 59.326 20.001 49.054 1.00 0.00 O ATOM 18258 O36 PGR 488 54.495 19.015 53.698 1.00 0.00 O ATOM 18259 HO6A PGR 488 55.130 19.595 54.156 1.00 0.00 H ATOM 18260 C12 OL 489 57.168 19.397 47.914 1.00 0.00 C ATOM 18261 H2R OL 489 57.265 20.212 47.194 1.00 0.00 H ATOM 18262 H2S OL 489 56.840 18.488 47.406 1.00 0.00 H ATOM 18263 C13 OL 489 56.223 19.826 49.115 1.00 0.00 C ATOM 18264 H3R OL 489 56.562 19.392 50.058 1.00 0.00 H ATOM 18265 H3S OL 489 56.374 20.868 49.405 1.00 0.00 H ATOM 18266 C14 OL 489 54.737 19.580 48.969 1.00 0.00 C ATOM 18267 H4R OL 489 54.598 18.497 48.922 1.00 0.00 H ATOM 18268 H4S OL 489 54.250 19.947 49.875 1.00 0.00 H ATOM 18269 C15 OL 489 54.109 20.091 47.592 1.00 0.00 C ATOM 18270 H5R OL 489 54.147 21.182 47.564 1.00 0.00 H ATOM 18271 H5S OL 489 54.740 19.817 46.745 1.00 0.00 H ATOM 18272 C16 OL 489 52.744 19.580 47.216 1.00 0.00 C ATOM 18273 H6R OL 489 52.667 18.500 47.352 1.00 0.00 H ATOM 18274 H6S OL 489 52.033 19.941 47.962 1.00 0.00 H ATOM 18275 C17 OL 489 52.111 19.918 45.861 1.00 0.00 C ATOM 18276 H7R OL 489 52.361 20.954 45.623 1.00 0.00 H ATOM 18277 H7S OL 489 52.660 19.241 45.203 1.00 0.00 H ATOM 18278 C18 OL 489 50.558 19.730 45.829 1.00 0.00 C ATOM 18279 H8R OL 489 50.190 19.683 44.802 1.00 0.00 H ATOM 18280 H8S OL 489 50.322 18.787 46.327 1.00 0.00 H ATOM 18281 C19 OL 489 50.053 20.954 46.640 1.00 0.00 C ATOM 18282 H9R OL 489 49.970 20.852 47.719 1.00 0.00 H ATOM 18283 C110 OL 489 49.622 22.067 46.089 1.00 0.00 C ATOM 18284 H10R OL 489 49.119 22.799 46.717 1.00 0.00 H ATOM 18285 C111 OL 489 49.606 22.380 44.686 1.00 0.00 C ATOM 18286 H11R OL 489 49.707 21.457 44.112 1.00 0.00 H ATOM 18287 H11S OL 489 48.604 22.641 44.338 1.00 0.00 H ATOM 18288 C112 OL 489 50.754 23.353 44.260 1.00 0.00 C ATOM 18289 H12R OL 489 50.686 24.249 44.881 1.00 0.00 H ATOM 18290 H12S OL 489 51.707 22.955 44.615 1.00 0.00 H ATOM 18291 C113 OL 489 50.845 23.607 42.801 1.00 0.00 C ATOM 18292 H13R OL 489 50.765 22.736 42.147 1.00 0.00 H ATOM 18293 H13S OL 489 49.955 24.211 42.611 1.00 0.00 H ATOM 18294 C114 OL 489 52.110 24.315 42.338 1.00 0.00 C ATOM 18295 H14R OL 489 52.360 25.111 43.043 1.00 0.00 H ATOM 18296 H14S OL 489 52.877 23.556 42.504 1.00 0.00 H ATOM 18297 C115 OL 489 52.149 24.640 40.814 1.00 0.00 C ATOM 18298 H15R OL 489 52.041 23.728 40.223 1.00 0.00 H ATOM 18299 H15S OL 489 51.427 25.417 40.558 1.00 0.00 H ATOM 18300 C116 OL 489 53.477 25.181 40.422 1.00 0.00 C ATOM 18301 H16R OL 489 53.509 26.120 40.978 1.00 0.00 H ATOM 18302 H16S OL 489 54.164 24.675 41.103 1.00 0.00 H ATOM 18303 C117 OL 489 53.759 25.312 38.958 1.00 0.00 C ATOM 18304 H17R OL 489 53.526 24.374 38.450 1.00 0.00 H ATOM 18305 H17S OL 489 53.102 26.041 38.480 1.00 0.00 H ATOM 18306 C118 OL 489 55.210 25.693 38.797 1.00 0.00 C ATOM 18307 H18R OL 489 55.402 25.666 37.723 1.00 0.00 H ATOM 18308 H18S OL 489 55.841 24.893 39.189 1.00 0.00 H ATOM 18309 H18T OL 489 55.352 26.698 39.202 1.00 0.00 H TER 18310 OL 489 ATOM 18310 C116 PA 490 58.468 23.357 49.259 1.00 0.00 C ATOM 18311 H16R PA 490 59.053 22.774 49.974 1.00 0.00 H ATOM 18312 H16S PA 490 57.651 22.756 48.855 1.00 0.00 H ATOM 18313 H16T PA 490 58.045 24.271 49.682 1.00 0.00 H ATOM 18314 C115 PA 490 59.445 23.915 48.241 1.00 0.00 C ATOM 18315 H15R PA 490 60.131 24.598 48.747 1.00 0.00 H ATOM 18316 H15S PA 490 58.837 24.511 47.557 1.00 0.00 H ATOM 18317 C114 PA 490 60.109 22.743 47.478 1.00 0.00 C ATOM 18318 H14R PA 490 60.459 22.020 48.218 1.00 0.00 H ATOM 18319 H14S PA 490 61.050 22.989 46.981 1.00 0.00 H ATOM 18320 C113 PA 490 59.255 22.150 46.397 1.00 0.00 C ATOM 18321 H13R PA 490 59.006 22.935 45.680 1.00 0.00 H ATOM 18322 H13S PA 490 58.348 21.927 46.963 1.00 0.00 H ATOM 18323 C112 PA 490 59.857 20.938 45.778 1.00 0.00 C ATOM 18324 H12R PA 490 60.312 20.284 46.525 1.00 0.00 H ATOM 18325 H12S PA 490 60.772 21.273 45.284 1.00 0.00 H ATOM 18326 C111 PA 490 59.008 20.147 44.666 1.00 0.00 C ATOM 18327 H11R PA 490 59.065 20.649 43.698 1.00 0.00 H ATOM 18328 H11S PA 490 58.027 20.123 45.145 1.00 0.00 H ATOM 18329 C110 PA 490 59.540 18.780 44.488 1.00 0.00 C ATOM 18330 H10R PA 490 60.078 18.333 45.327 1.00 0.00 H ATOM 18331 H10S PA 490 60.202 18.763 43.620 1.00 0.00 H ATOM 18332 C19 PA 490 58.435 17.855 43.929 1.00 0.00 C ATOM 18333 H9R PA 490 58.905 16.965 43.506 1.00 0.00 H ATOM 18334 H9S PA 490 57.924 18.381 43.119 1.00 0.00 H ATOM 18335 C18 PA 490 57.315 17.360 44.885 1.00 0.00 C ATOM 18336 H8R PA 490 56.815 18.230 45.315 1.00 0.00 H ATOM 18337 H8S PA 490 57.716 16.712 45.666 1.00 0.00 H ATOM 18338 C17 PA 490 56.264 16.437 44.250 1.00 0.00 C ATOM 18339 H7R PA 490 56.715 15.455 44.093 1.00 0.00 H ATOM 18340 H7S PA 490 56.024 16.710 43.220 1.00 0.00 H ATOM 18341 C16 PA 490 54.969 16.178 44.976 1.00 0.00 C ATOM 18342 H6R PA 490 54.426 15.479 44.337 1.00 0.00 H ATOM 18343 H6S PA 490 54.382 17.096 45.049 1.00 0.00 H ATOM 18344 C15 PA 490 55.119 15.403 46.281 1.00 0.00 C ATOM 18345 H5R PA 490 55.575 16.031 47.049 1.00 0.00 H ATOM 18346 H5S PA 490 55.866 14.629 46.092 1.00 0.00 H ATOM 18347 C14 PA 490 53.900 14.725 46.828 1.00 0.00 C ATOM 18348 H4R PA 490 53.393 14.136 46.061 1.00 0.00 H ATOM 18349 H4S PA 490 53.271 15.526 47.222 1.00 0.00 H ATOM 18350 C13 PA 490 54.310 13.851 48.008 1.00 0.00 C ATOM 18351 H3R PA 490 55.005 14.464 48.586 1.00 0.00 H ATOM 18352 H3S PA 490 54.997 13.083 47.648 1.00 0.00 H ATOM 18353 C12 PA 490 53.077 13.393 48.835 1.00 0.00 C ATOM 18354 H2R PA 490 52.317 12.884 48.239 1.00 0.00 H ATOM 18355 H2S PA 490 52.507 14.227 49.249 1.00 0.00 H ATOM 18356 C11 PGR 491 53.424 12.494 49.945 1.00 0.00 C ATOM 18357 O12 PGR 491 54.026 12.868 50.959 1.00 0.00 O ATOM 18358 O11 PGR 491 53.095 11.235 49.668 1.00 0.00 O ATOM 18359 C1 PGR 491 53.299 10.098 50.646 1.00 0.00 C ATOM 18360 HR PGR 491 52.826 10.494 51.549 1.00 0.00 H ATOM 18361 HS PGR 491 54.354 9.849 50.786 1.00 0.00 H ATOM 18362 C2 PGR 491 52.438 8.855 50.126 1.00 0.00 C ATOM 18363 HX PGR 491 51.431 9.143 49.814 1.00 0.00 H ATOM 18364 C3 PGR 491 52.335 7.830 51.281 1.00 0.00 C ATOM 18365 HA PGR 491 51.721 6.961 51.035 1.00 0.00 H ATOM 18366 HB PGR 491 52.002 8.337 52.191 1.00 0.00 H ATOM 18367 O31 PGR 491 53.696 7.502 51.641 1.00 0.00 O ATOM 18368 P31 PGR 491 54.003 6.980 53.134 1.00 0.00 P ATOM 18369 O32 PGR 491 54.645 8.296 53.792 1.00 0.00 O ATOM 18370 C31 PGR 491 53.816 9.323 54.306 1.00 0.00 C ATOM 18371 H1A PGR 491 53.131 8.973 55.082 1.00 0.00 H ATOM 18372 H1B PGR 491 53.196 9.658 53.471 1.00 0.00 H ATOM 18373 C32 PGR 491 54.720 10.435 54.831 1.00 0.00 C ATOM 18374 H2A PGR 491 55.117 10.044 55.771 1.00 0.00 H ATOM 18375 O35 PGR 491 55.829 10.668 53.893 1.00 0.00 O ATOM 18376 HO5A PGR 491 56.098 9.793 53.559 1.00 0.00 H ATOM 18377 C33 PGR 491 54.003 11.714 55.117 1.00 0.00 C ATOM 18378 H3A PGR 491 53.498 12.097 54.226 1.00 0.00 H ATOM 18379 H3B PGR 491 53.203 11.496 55.829 1.00 0.00 H ATOM 18380 O33 PGR 491 52.740 6.660 53.809 1.00 0.00 O ATOM 18381 O34 PGR 491 55.043 5.934 53.098 1.00 0.00 O ATOM 18382 O21 PGR 491 53.157 8.283 49.011 1.00 0.00 O ATOM 18383 C21 PGR 491 52.396 7.544 48.185 1.00 0.00 C ATOM 18384 O22 PGR 491 51.258 7.135 48.378 1.00 0.00 O ATOM 18385 O36 PGR 491 54.923 12.650 55.625 1.00 0.00 O ATOM 18386 HO6A PGR 491 54.452 13.482 55.439 1.00 0.00 H ATOM 18387 C12 OL 492 53.158 7.114 46.940 1.00 0.00 C ATOM 18388 H2R OL 492 53.187 6.026 46.848 1.00 0.00 H ATOM 18389 H2S OL 492 52.478 7.439 46.150 1.00 0.00 H ATOM 18390 C13 OL 492 54.565 7.869 46.811 1.00 0.00 C ATOM 18391 H3R OL 492 54.443 8.656 46.064 1.00 0.00 H ATOM 18392 H3S OL 492 54.914 8.403 47.698 1.00 0.00 H ATOM 18393 C14 OL 492 55.624 6.879 46.420 1.00 0.00 C ATOM 18394 H4R OL 492 56.522 7.455 46.654 1.00 0.00 H ATOM 18395 H4S OL 492 55.510 6.036 47.105 1.00 0.00 H ATOM 18396 C15 OL 492 55.510 6.733 44.895 1.00 0.00 C ATOM 18397 H5R OL 492 54.471 6.501 44.650 1.00 0.00 H ATOM 18398 H5S OL 492 55.706 7.646 44.328 1.00 0.00 H ATOM 18399 C16 OL 492 56.334 5.611 44.244 1.00 0.00 C ATOM 18400 H6R OL 492 56.063 4.624 44.626 1.00 0.00 H ATOM 18401 H6S OL 492 56.182 5.779 43.175 1.00 0.00 H ATOM 18402 C17 OL 492 57.880 5.818 44.413 1.00 0.00 C ATOM 18403 H7R OL 492 58.170 6.827 44.109 1.00 0.00 H ATOM 18404 H7S OL 492 58.062 5.925 45.484 1.00 0.00 H ATOM 18405 C18 OL 492 58.845 4.813 43.792 1.00 0.00 C ATOM 18406 H8R OL 492 59.848 4.967 44.198 1.00 0.00 H ATOM 18407 H8S OL 492 58.514 3.801 44.036 1.00 0.00 H ATOM 18408 C19 OL 492 58.834 4.909 42.275 1.00 0.00 C ATOM 18409 H9R OL 492 57.862 5.147 41.850 1.00 0.00 H ATOM 18410 C110 OL 492 59.885 4.669 41.472 1.00 0.00 C ATOM 18411 H10R OL 492 59.833 4.772 40.391 1.00 0.00 H ATOM 18412 C111 OL 492 61.301 4.415 41.970 1.00 0.00 C ATOM 18413 H11R OL 492 62.002 4.851 41.255 1.00 0.00 H ATOM 18414 H11S OL 492 61.488 4.910 42.925 1.00 0.00 H ATOM 18415 C112 OL 492 61.539 2.944 42.093 1.00 0.00 C ATOM 18416 H12R OL 492 61.021 2.573 42.980 1.00 0.00 H ATOM 18417 H12S OL 492 61.064 2.520 41.206 1.00 0.00 H ATOM 18418 C113 OL 492 62.977 2.399 42.343 1.00 0.00 C ATOM 18419 H13R OL 492 63.385 2.574 43.341 1.00 0.00 H ATOM 18420 H13S OL 492 63.016 1.330 42.122 1.00 0.00 H ATOM 18421 C114 OL 492 63.943 2.997 41.389 1.00 0.00 C ATOM 18422 H14R OL 492 63.602 2.995 40.351 1.00 0.00 H ATOM 18423 H14S OL 492 64.069 4.038 41.694 1.00 0.00 H ATOM 18424 C115 OL 492 65.188 2.169 41.350 1.00 0.00 C ATOM 18425 H15R OL 492 65.140 1.196 40.855 1.00 0.00 H ATOM 18426 H15S OL 492 65.887 2.838 40.844 1.00 0.00 H ATOM 18427 C116 OL 492 65.885 2.004 42.695 1.00 0.00 C ATOM 18428 H16R OL 492 65.649 2.798 43.407 1.00 0.00 H ATOM 18429 H16S OL 492 65.468 1.108 43.159 1.00 0.00 H ATOM 18430 C117 OL 492 67.372 1.805 42.551 1.00 0.00 C ATOM 18431 H17R OL 492 67.578 0.798 42.182 1.00 0.00 H ATOM 18432 H17S OL 492 67.882 2.462 41.844 1.00 0.00 H ATOM 18433 C118 OL 492 68.038 2.010 43.911 1.00 0.00 C ATOM 18434 H18R OL 492 67.374 1.490 44.604 1.00 0.00 H ATOM 18435 H18S OL 492 68.117 3.050 44.233 1.00 0.00 H ATOM 18436 H18T OL 492 69.008 1.515 43.991 1.00 0.00 H TER 18437 OL 492 ATOM 18437 C116 PA 493 -1.935 59.304 41.613 1.00 0.00 C ATOM 18438 H16R PA 493 -2.501 60.215 41.409 1.00 0.00 H ATOM 18439 H16S PA 493 -2.688 58.557 41.873 1.00 0.00 H ATOM 18440 H16T PA 493 -1.454 58.991 40.684 1.00 0.00 H ATOM 18441 C115 PA 493 -0.757 59.610 42.602 1.00 0.00 C ATOM 18442 H15R PA 493 -0.260 58.650 42.759 1.00 0.00 H ATOM 18443 H15S PA 493 -1.247 59.837 43.550 1.00 0.00 H ATOM 18444 C114 PA 493 0.329 60.543 42.196 1.00 0.00 C ATOM 18445 H14R PA 493 -0.111 61.529 42.030 1.00 0.00 H ATOM 18446 H14S PA 493 0.855 60.360 41.257 1.00 0.00 H ATOM 18447 C113 PA 493 1.458 60.722 43.230 1.00 0.00 C ATOM 18448 H13R PA 493 1.920 59.733 43.232 1.00 0.00 H ATOM 18449 H13S PA 493 1.035 60.855 44.228 1.00 0.00 H ATOM 18450 C112 PA 493 2.460 61.739 42.979 1.00 0.00 C ATOM 18451 H12R PA 493 1.991 62.724 42.959 1.00 0.00 H ATOM 18452 H12S PA 493 2.883 61.591 41.983 1.00 0.00 H ATOM 18453 C111 PA 493 3.683 61.817 43.850 1.00 0.00 C ATOM 18454 H11R PA 493 3.355 62.091 44.855 1.00 0.00 H ATOM 18455 H11S PA 493 4.303 62.629 43.463 1.00 0.00 H ATOM 18456 C110 PA 493 4.559 60.559 43.915 1.00 0.00 C ATOM 18457 H10R PA 493 4.560 60.064 42.942 1.00 0.00 H ATOM 18458 H10S PA 493 4.104 59.760 44.503 1.00 0.00 H ATOM 18459 C19 PA 493 5.919 60.844 44.477 1.00 0.00 C ATOM 18460 H9R PA 493 5.930 60.902 45.567 1.00 0.00 H ATOM 18461 H9S PA 493 6.313 61.801 44.129 1.00 0.00 H ATOM 18462 C18 PA 493 6.952 59.728 44.154 1.00 0.00 C ATOM 18463 H8R PA 493 7.117 59.622 43.079 1.00 0.00 H ATOM 18464 H8S PA 493 6.682 58.741 44.536 1.00 0.00 H ATOM 18465 C17 PA 493 8.371 60.040 44.646 1.00 0.00 C ATOM 18466 H7R PA 493 8.479 61.116 44.799 1.00 0.00 H ATOM 18467 H7S PA 493 8.983 59.770 43.784 1.00 0.00 H ATOM 18468 C16 PA 493 8.831 59.317 45.858 1.00 0.00 C ATOM 18469 H6R PA 493 9.905 59.510 45.815 1.00 0.00 H ATOM 18470 H6S PA 493 8.708 58.234 45.788 1.00 0.00 H ATOM 18471 C15 PA 493 8.131 59.896 47.090 1.00 0.00 C ATOM 18472 H5R PA 493 7.050 60.039 47.033 1.00 0.00 H ATOM 18473 H5S PA 493 8.590 60.875 47.248 1.00 0.00 H ATOM 18474 C14 PA 493 8.530 59.127 48.355 1.00 0.00 C ATOM 18475 H4R PA 493 9.621 59.074 48.344 1.00 0.00 H ATOM 18476 H4S PA 493 7.966 58.193 48.389 1.00 0.00 H ATOM 18477 C13 PA 493 7.977 59.875 49.693 1.00 0.00 C ATOM 18478 H3R PA 493 6.977 60.315 49.699 1.00 0.00 H ATOM 18479 H3S PA 493 8.649 60.726 49.825 1.00 0.00 H ATOM 18480 C12 PA 493 8.217 59.094 50.985 1.00 0.00 C ATOM 18481 H2R PA 493 9.233 58.694 51.006 1.00 0.00 H ATOM 18482 H2S PA 493 7.566 58.220 51.064 1.00 0.00 H ATOM 18483 C11 PGR 494 7.994 59.935 52.260 1.00 0.00 C ATOM 18484 O12 PGR 494 8.813 59.942 53.181 1.00 0.00 O ATOM 18485 O11 PGR 494 6.813 60.577 52.221 1.00 0.00 O ATOM 18486 C1 PGR 494 6.397 61.512 53.282 1.00 0.00 C ATOM 18487 HR PGR 494 6.634 61.122 54.275 1.00 0.00 H ATOM 18488 HS PGR 494 5.313 61.591 53.173 1.00 0.00 H ATOM 18489 C2 PGR 494 6.970 62.934 53.101 1.00 0.00 C ATOM 18490 HX PGR 494 8.012 62.887 53.427 1.00 0.00 H ATOM 18491 C3 PGR 494 6.303 63.773 54.164 1.00 0.00 C ATOM 18492 HA PGR 494 6.376 63.262 55.127 1.00 0.00 H ATOM 18493 HB PGR 494 5.267 63.912 53.845 1.00 0.00 H ATOM 18494 O31 PGR 494 6.996 65.011 54.235 1.00 0.00 O ATOM 18495 P31 PGR 494 6.395 66.189 55.201 1.00 0.00 P ATOM 18496 O32 PGR 494 6.922 65.802 56.680 1.00 0.00 O ATOM 18497 C31 PGR 494 6.244 64.879 57.443 1.00 0.00 C ATOM 18498 H1A PGR 494 6.055 63.911 56.972 1.00 0.00 H ATOM 18499 H1B PGR 494 5.269 65.277 57.735 1.00 0.00 H ATOM 18500 C32 PGR 494 6.776 64.881 58.892 1.00 0.00 C ATOM 18501 H2A PGR 494 6.419 65.683 59.543 1.00 0.00 H ATOM 18502 O35 PGR 494 8.173 64.955 58.870 1.00 0.00 O ATOM 18503 HO5A PGR 494 8.407 65.488 58.089 1.00 0.00 H ATOM 18504 C33 PGR 494 6.342 63.527 59.508 1.00 0.00 C ATOM 18505 H3A PGR 494 6.695 63.235 60.501 1.00 0.00 H ATOM 18506 H3B PGR 494 5.254 63.560 59.599 1.00 0.00 H ATOM 18507 O33 PGR 494 7.041 67.479 54.927 1.00 0.00 O ATOM 18508 O34 PGR 494 4.891 66.125 55.238 1.00 0.00 O ATOM 18509 O21 PGR 494 6.797 63.407 51.753 1.00 0.00 O ATOM 18510 C21 PGR 494 7.970 63.444 50.978 1.00 0.00 C ATOM 18511 O22 PGR 494 9.104 63.131 51.381 1.00 0.00 O ATOM 18512 O36 PGR 494 6.748 62.468 58.623 1.00 0.00 O ATOM 18513 HO6A PGR 494 6.172 61.688 58.721 1.00 0.00 H ATOM 18514 C12 OL 495 7.569 63.935 49.575 1.00 0.00 C ATOM 18515 H2R OL 495 6.828 63.166 49.347 1.00 0.00 H ATOM 18516 H2S OL 495 7.108 64.921 49.480 1.00 0.00 H ATOM 18517 C13 OL 495 8.677 63.852 48.545 1.00 0.00 C ATOM 18518 H3R OL 495 9.341 64.716 48.607 1.00 0.00 H ATOM 18519 H3S OL 495 9.307 62.975 48.713 1.00 0.00 H ATOM 18520 C14 OL 495 8.116 63.915 47.063 1.00 0.00 C ATOM 18521 H4R OL 495 7.244 63.270 46.933 1.00 0.00 H ATOM 18522 H4S OL 495 7.767 64.944 46.960 1.00 0.00 H ATOM 18523 C15 OL 495 9.163 63.706 46.046 1.00 0.00 C ATOM 18524 H5R OL 495 10.056 64.245 46.368 1.00 0.00 H ATOM 18525 H5S OL 495 9.465 62.659 46.114 1.00 0.00 H ATOM 18526 C16 OL 495 8.590 64.098 44.699 1.00 0.00 C ATOM 18527 H6R OL 495 7.700 63.487 44.536 1.00 0.00 H ATOM 18528 H6S OL 495 8.097 65.072 44.687 1.00 0.00 H ATOM 18529 C17 OL 495 9.608 63.883 43.545 1.00 0.00 C ATOM 18530 H7R OL 495 10.477 64.541 43.610 1.00 0.00 H ATOM 18531 H7S OL 495 9.977 62.860 43.647 1.00 0.00 H ATOM 18532 C18 OL 495 8.975 64.112 42.190 1.00 0.00 C ATOM 18533 H8R OL 495 8.089 63.511 41.973 1.00 0.00 H ATOM 18534 H8S OL 495 8.659 65.157 42.210 1.00 0.00 H ATOM 18535 C19 OL 495 10.013 63.962 41.137 1.00 0.00 C ATOM 18536 H9R OL 495 10.625 64.856 41.050 1.00 0.00 H ATOM 18537 C110 OL 495 10.228 62.843 40.402 1.00 0.00 C ATOM 18538 H10R OL 495 11.081 62.835 39.728 1.00 0.00 H ATOM 18539 C111 OL 495 9.545 61.539 40.590 1.00 0.00 C ATOM 18540 H11R OL 495 8.642 61.652 41.194 1.00 0.00 H ATOM 18541 H11S OL 495 9.364 61.143 39.588 1.00 0.00 H ATOM 18542 C112 OL 495 10.560 60.591 41.234 1.00 0.00 C ATOM 18543 H12R OL 495 11.458 60.685 40.620 1.00 0.00 H ATOM 18544 H12S OL 495 10.844 60.841 42.259 1.00 0.00 H ATOM 18545 C113 OL 495 10.224 59.153 41.000 1.00 0.00 C ATOM 18546 H13R OL 495 9.207 58.902 41.309 1.00 0.00 H ATOM 18547 H13S OL 495 10.214 58.883 39.942 1.00 0.00 H ATOM 18548 C114 OL 495 11.178 58.231 41.782 1.00 0.00 C ATOM 18549 H14R OL 495 12.176 58.674 41.813 1.00 0.00 H ATOM 18550 H14S OL 495 10.780 58.259 42.798 1.00 0.00 H ATOM 18551 C115 OL 495 11.296 56.812 41.220 1.00 0.00 C ATOM 18552 H15R OL 495 10.403 56.250 41.500 1.00 0.00 H ATOM 18553 H15S OL 495 11.332 56.795 40.129 1.00 0.00 H ATOM 18554 C116 OL 495 12.547 56.048 41.679 1.00 0.00 C ATOM 18555 H16R OL 495 13.451 56.467 41.231 1.00 0.00 H ATOM 18556 H16S OL 495 12.623 56.158 42.762 1.00 0.00 H ATOM 18557 C117 OL 495 12.486 54.532 41.427 1.00 0.00 C ATOM 18558 H17R OL 495 13.333 53.996 41.861 1.00 0.00 H ATOM 18559 H17S OL 495 11.634 54.138 41.985 1.00 0.00 H ATOM 18560 C118 OL 495 12.495 54.102 39.950 1.00 0.00 C ATOM 18561 H18R OL 495 12.184 53.079 39.729 1.00 0.00 H ATOM 18562 H18S OL 495 13.516 54.245 39.589 1.00 0.00 H ATOM 18563 H18T OL 495 11.831 54.722 39.345 1.00 0.00 H TER 18564 OL 495 ATOM 18564 C116 PA 496 131.723 38.538 44.395 1.00 0.00 C ATOM 18565 H16R PA 496 130.915 38.832 43.721 1.00 0.00 H ATOM 18566 H16S PA 496 131.473 37.536 44.751 1.00 0.00 H ATOM 18567 H16T PA 496 132.651 38.383 43.841 1.00 0.00 H ATOM 18568 C115 PA 496 132.027 39.623 45.491 1.00 0.00 C ATOM 18569 H15R PA 496 131.120 39.949 46.005 1.00 0.00 H ATOM 18570 H15S PA 496 132.260 40.564 44.987 1.00 0.00 H ATOM 18571 C114 PA 496 133.176 39.165 46.467 1.00 0.00 C ATOM 18572 H14R PA 496 134.046 38.846 45.889 1.00 0.00 H ATOM 18573 H14S PA 496 132.782 38.401 47.142 1.00 0.00 H ATOM 18574 C113 PA 496 133.571 40.321 47.306 1.00 0.00 C ATOM 18575 H13R PA 496 132.686 40.952 47.414 1.00 0.00 H ATOM 18576 H13S PA 496 134.276 41.005 46.830 1.00 0.00 H ATOM 18577 C112 PA 496 134.077 39.884 48.661 1.00 0.00 C ATOM 18578 H12R PA 496 134.844 39.107 48.629 1.00 0.00 H ATOM 18579 H12S PA 496 133.278 39.335 49.163 1.00 0.00 H ATOM 18580 C111 PA 496 134.385 40.961 49.672 1.00 0.00 C ATOM 18581 H11R PA 496 134.398 40.616 50.708 1.00 0.00 H ATOM 18582 H11S PA 496 133.573 41.691 49.700 1.00 0.00 H ATOM 18583 C110 PA 496 135.752 41.556 49.482 1.00 0.00 C ATOM 18584 H10R PA 496 135.853 41.876 48.443 1.00 0.00 H ATOM 18585 H10S PA 496 136.374 40.665 49.589 1.00 0.00 H ATOM 18586 C19 PA 496 136.162 42.660 50.362 1.00 0.00 C ATOM 18587 H9R PA 496 136.137 42.266 51.380 1.00 0.00 H ATOM 18588 H9S PA 496 135.440 43.478 50.392 1.00 0.00 H ATOM 18589 C18 PA 496 137.544 43.185 50.097 1.00 0.00 C ATOM 18590 H8R PA 496 137.556 43.595 49.085 1.00 0.00 H ATOM 18591 H8S PA 496 138.232 42.340 50.021 1.00 0.00 H ATOM 18592 C17 PA 496 138.031 44.305 51.017 1.00 0.00 C ATOM 18593 H7R PA 496 139.108 44.395 50.861 1.00 0.00 H ATOM 18594 H7S PA 496 137.906 43.964 52.047 1.00 0.00 H ATOM 18595 C16 PA 496 137.312 45.624 50.739 1.00 0.00 C ATOM 18596 H6R PA 496 136.225 45.552 50.658 1.00 0.00 H ATOM 18597 H6S PA 496 137.657 46.051 49.795 1.00 0.00 H ATOM 18598 C15 PA 496 137.646 46.742 51.749 1.00 0.00 C ATOM 18599 H5R PA 496 137.274 47.664 51.297 1.00 0.00 H ATOM 18600 H5S PA 496 138.726 46.769 51.910 1.00 0.00 H ATOM 18601 C14 PA 496 136.826 46.555 52.939 1.00 0.00 C ATOM 18602 H4R PA 496 137.324 45.827 53.582 1.00 0.00 H ATOM 18603 H4S PA 496 135.913 46.005 52.702 1.00 0.00 H ATOM 18604 C13 PA 496 136.535 47.832 53.719 1.00 0.00 C ATOM 18605 H3R PA 496 135.934 48.561 53.171 1.00 0.00 H ATOM 18606 H3S PA 496 137.476 48.328 53.966 1.00 0.00 H ATOM 18607 C12 PA 496 135.799 47.706 55.035 1.00 0.00 C ATOM 18608 H2R PA 496 134.836 47.194 55.096 1.00 0.00 H ATOM 18609 H2S PA 496 135.595 48.763 55.214 1.00 0.00 H ATOM 18610 C11 PGR 497 136.844 47.161 56.147 1.00 0.00 C ATOM 18611 O12 PGR 497 137.727 47.888 56.509 1.00 0.00 O ATOM 18612 O11 PGR 497 136.676 45.845 56.492 1.00 0.00 O ATOM 18613 C1 PGR 497 137.657 45.130 57.287 1.00 0.00 C ATOM 18614 HR PGR 497 137.674 45.724 58.205 1.00 0.00 H ATOM 18615 HS PGR 497 138.656 45.025 56.856 1.00 0.00 H ATOM 18616 C2 PGR 497 137.112 43.781 57.716 1.00 0.00 C ATOM 18617 HX PGR 497 136.048 43.760 57.966 1.00 0.00 H ATOM 18618 C3 PGR 497 137.845 43.227 58.936 1.00 0.00 C ATOM 18619 HA PGR 497 137.874 43.946 59.759 1.00 0.00 H ATOM 18620 HB PGR 497 138.862 42.957 58.639 1.00 0.00 H ATOM 18621 O31 PGR 497 137.115 42.102 59.375 1.00 0.00 O ATOM 18622 P31 PGR 497 137.614 41.208 60.653 1.00 0.00 P ATOM 18623 O32 PGR 497 137.780 42.205 61.857 1.00 0.00 O ATOM 18624 C31 PGR 497 136.744 42.352 62.830 1.00 0.00 C ATOM 18625 H1A PGR 497 136.516 41.346 63.190 1.00 0.00 H ATOM 18626 H1B PGR 497 135.851 42.867 62.468 1.00 0.00 H ATOM 18627 C32 PGR 497 137.415 43.206 63.956 1.00 0.00 C ATOM 18628 H2A PGR 497 136.596 43.611 64.558 1.00 0.00 H ATOM 18629 O35 PGR 497 137.930 44.316 63.251 1.00 0.00 O ATOM 18630 HO5A PGR 497 138.743 43.918 62.892 1.00 0.00 H ATOM 18631 C33 PGR 497 138.491 42.436 64.708 1.00 0.00 C ATOM 18632 H3A PGR 497 138.480 42.753 65.754 1.00 0.00 H ATOM 18633 H3B PGR 497 138.097 41.420 64.626 1.00 0.00 H ATOM 18634 O33 PGR 497 136.534 40.286 60.952 1.00 0.00 O ATOM 18635 O34 PGR 497 138.907 40.676 60.207 1.00 0.00 O ATOM 18636 O21 PGR 497 137.482 42.830 56.695 1.00 0.00 O ATOM 18637 C21 PGR 497 136.571 42.480 55.763 1.00 0.00 C ATOM 18638 O22 PGR 497 135.513 43.075 55.620 1.00 0.00 O ATOM 18639 O36 PGR 497 139.692 42.599 63.904 1.00 0.00 O ATOM 18640 HO6A PGR 497 139.732 41.772 63.391 1.00 0.00 H ATOM 18641 C12 OL 498 137.101 41.548 54.690 1.00 0.00 C ATOM 18642 H2R OL 498 137.376 42.183 53.846 1.00 0.00 H ATOM 18643 H2S OL 498 138.064 41.142 55.009 1.00 0.00 H ATOM 18644 C13 OL 498 136.153 40.517 54.179 1.00 0.00 C ATOM 18645 H3R OL 498 135.389 40.215 54.898 1.00 0.00 H ATOM 18646 H3S OL 498 135.625 41.055 53.389 1.00 0.00 H ATOM 18647 C14 OL 498 136.787 39.342 53.446 1.00 0.00 C ATOM 18648 H4R OL 498 137.747 39.632 53.015 1.00 0.00 H ATOM 18649 H4S OL 498 136.964 38.594 54.222 1.00 0.00 H ATOM 18650 C15 OL 498 135.917 38.583 52.443 1.00 0.00 C ATOM 18651 H5R OL 498 134.893 38.350 52.742 1.00 0.00 H ATOM 18652 H5S OL 498 135.760 39.112 51.501 1.00 0.00 H ATOM 18653 C16 OL 498 136.509 37.223 52.124 1.00 0.00 C ATOM 18654 H6R OL 498 137.600 37.258 52.155 1.00 0.00 H ATOM 18655 H6S OL 498 136.253 36.405 52.800 1.00 0.00 H ATOM 18656 C17 OL 498 136.342 36.637 50.705 1.00 0.00 C ATOM 18657 H7R OL 498 135.379 36.850 50.237 1.00 0.00 H ATOM 18658 H7S OL 498 137.113 37.017 50.031 1.00 0.00 H ATOM 18659 C18 OL 498 136.372 35.145 50.831 1.00 0.00 C ATOM 18660 H8R OL 498 137.139 34.812 51.533 1.00 0.00 H ATOM 18661 H8S OL 498 135.455 34.877 51.359 1.00 0.00 H ATOM 18662 C19 OL 498 136.523 34.451 49.508 1.00 0.00 C ATOM 18663 H9R OL 498 137.148 35.074 48.874 1.00 0.00 H ATOM 18664 C110 OL 498 135.909 33.329 49.204 1.00 0.00 C ATOM 18665 H10R OL 498 136.026 32.918 48.205 1.00 0.00 H ATOM 18666 C111 OL 498 135.052 32.535 50.090 1.00 0.00 C ATOM 18667 H11R OL 498 134.719 33.177 50.908 1.00 0.00 H ATOM 18668 H11S OL 498 134.164 32.346 49.485 1.00 0.00 H ATOM 18669 C112 OL 498 135.767 31.253 50.491 1.00 0.00 C ATOM 18670 H12R OL 498 136.596 31.727 51.019 1.00 0.00 H ATOM 18671 H12S OL 498 135.258 30.753 51.317 1.00 0.00 H ATOM 18672 C113 OL 498 136.048 30.295 49.351 1.00 0.00 C ATOM 18673 H13R OL 498 135.742 29.259 49.514 1.00 0.00 H ATOM 18674 H13S OL 498 135.275 30.504 48.608 1.00 0.00 H ATOM 18675 C114 OL 498 137.565 30.351 48.780 1.00 0.00 C ATOM 18676 H14R OL 498 137.804 31.370 48.468 1.00 0.00 H ATOM 18677 H14S OL 498 138.316 30.023 49.502 1.00 0.00 H ATOM 18678 C115 OL 498 137.852 29.480 47.587 1.00 0.00 C ATOM 18679 H15R OL 498 137.731 28.425 47.843 1.00 0.00 H ATOM 18680 H15S OL 498 137.048 29.612 46.861 1.00 0.00 H ATOM 18681 C116 OL 498 139.147 29.849 46.950 1.00 0.00 C ATOM 18682 H16R OL 498 139.119 30.927 46.777 1.00 0.00 H ATOM 18683 H16S OL 498 139.900 29.634 47.711 1.00 0.00 H ATOM 18684 C117 OL 498 139.560 29.095 45.725 1.00 0.00 C ATOM 18685 H17R OL 498 139.140 28.087 45.722 1.00 0.00 H ATOM 18686 H17S OL 498 139.053 29.480 44.837 1.00 0.00 H ATOM 18687 C118 OL 498 141.037 29.023 45.443 1.00 0.00 C ATOM 18688 H18R OL 498 141.301 28.701 44.434 1.00 0.00 H ATOM 18689 H18S OL 498 141.619 28.459 46.175 1.00 0.00 H ATOM 18690 H18T OL 498 141.225 30.093 45.551 1.00 0.00 H TER 18691 OL 498 ATOM 18691 C116 PA 499 74.393 115.399 43.476 1.00 0.00 C ATOM 18692 H16R PA 499 74.301 116.047 44.350 1.00 0.00 H ATOM 18693 H16S PA 499 73.493 115.715 42.944 1.00 0.00 H ATOM 18694 H16T PA 499 75.330 115.559 42.939 1.00 0.00 H ATOM 18695 C115 PA 499 74.268 113.883 43.934 1.00 0.00 C ATOM 18696 H15R PA 499 73.481 113.743 44.678 1.00 0.00 H ATOM 18697 H15S PA 499 75.131 113.645 44.560 1.00 0.00 H ATOM 18698 C114 PA 499 74.213 112.936 42.711 1.00 0.00 C ATOM 18699 H14R PA 499 75.216 112.930 42.280 1.00 0.00 H ATOM 18700 H14S PA 499 73.583 113.438 41.974 1.00 0.00 H ATOM 18701 C113 PA 499 73.868 111.447 43.043 1.00 0.00 C ATOM 18702 H13R PA 499 74.656 110.951 43.615 1.00 0.00 H ATOM 18703 H13S PA 499 73.693 111.016 42.056 1.00 0.00 H ATOM 18704 C112 PA 499 72.447 111.218 43.656 1.00 0.00 C ATOM 18705 H12R PA 499 71.671 111.791 43.146 1.00 0.00 H ATOM 18706 H12S PA 499 72.528 111.650 44.656 1.00 0.00 H ATOM 18707 C111 PA 499 72.072 109.768 43.876 1.00 0.00 C ATOM 18708 H11R PA 499 71.107 109.693 44.381 1.00 0.00 H ATOM 18709 H11S PA 499 72.888 109.471 44.539 1.00 0.00 H ATOM 18710 C110 PA 499 72.052 108.890 42.684 1.00 0.00 C ATOM 18711 H10R PA 499 73.008 108.754 42.173 1.00 0.00 H ATOM 18712 H10S PA 499 71.487 109.389 41.894 1.00 0.00 H ATOM 18713 C19 PA 499 71.656 107.467 42.859 1.00 0.00 C ATOM 18714 H9R PA 499 71.801 106.939 41.914 1.00 0.00 H ATOM 18715 H9S PA 499 70.594 107.482 43.114 1.00 0.00 H ATOM 18716 C18 PA 499 72.301 106.643 43.974 1.00 0.00 C ATOM 18717 H8R PA 499 71.665 105.759 44.058 1.00 0.00 H ATOM 18718 H8S PA 499 72.161 107.176 44.917 1.00 0.00 H ATOM 18719 C17 PA 499 73.784 106.265 43.830 1.00 0.00 C ATOM 18720 H7R PA 499 74.230 107.248 43.995 1.00 0.00 H ATOM 18721 H7S PA 499 73.882 105.972 42.783 1.00 0.00 H ATOM 18722 C16 PA 499 74.273 105.251 44.789 1.00 0.00 C ATOM 18723 H6R PA 499 75.300 104.967 44.549 1.00 0.00 H ATOM 18724 H6S PA 499 73.751 104.295 44.871 1.00 0.00 H ATOM 18725 C15 PA 499 74.387 105.732 46.265 1.00 0.00 C ATOM 18726 H5R PA 499 73.416 106.130 46.568 1.00 0.00 H ATOM 18727 H5S PA 499 75.227 106.424 46.350 1.00 0.00 H ATOM 18728 C14 PA 499 74.606 104.539 47.330 1.00 0.00 C ATOM 18729 H4R PA 499 75.633 104.249 47.098 1.00 0.00 H ATOM 18730 H4S PA 499 73.984 103.643 47.264 1.00 0.00 H ATOM 18731 C13 PA 499 74.677 104.967 48.802 1.00 0.00 C ATOM 18732 H3R PA 499 74.610 104.082 49.439 1.00 0.00 H ATOM 18733 H3S PA 499 73.772 105.528 49.042 1.00 0.00 H ATOM 18734 C12 PA 499 75.855 105.866 49.115 1.00 0.00 C ATOM 18735 H2R PA 499 75.987 106.689 48.410 1.00 0.00 H ATOM 18736 H2S PA 499 76.749 105.257 48.969 1.00 0.00 H ATOM 18737 C11 PGR 500 75.757 106.342 50.542 1.00 0.00 C ATOM 18738 O12 PGR 500 75.744 105.642 51.475 1.00 0.00 O ATOM 18739 O11 PGR 500 75.759 107.704 50.591 1.00 0.00 O ATOM 18740 C1 PGR 500 76.008 108.448 51.806 1.00 0.00 C ATOM 18741 HR PGR 500 75.356 108.020 52.571 1.00 0.00 H ATOM 18742 HS PGR 500 75.757 109.507 51.709 1.00 0.00 H ATOM 18743 C2 PGR 500 77.360 108.064 52.417 1.00 0.00 C ATOM 18744 HX PGR 500 77.392 106.982 52.573 1.00 0.00 H ATOM 18745 C3 PGR 500 77.563 108.875 53.783 1.00 0.00 C ATOM 18746 HA PGR 500 76.931 108.466 54.576 1.00 0.00 H ATOM 18747 HB PGR 500 77.422 109.959 53.791 1.00 0.00 H ATOM 18748 O31 PGR 500 78.868 108.586 54.301 1.00 0.00 O ATOM 18749 P31 PGR 500 79.239 109.294 55.657 1.00 0.00 P ATOM 18750 O32 PGR 500 80.181 110.466 55.179 1.00 0.00 O ATOM 18751 C31 PGR 500 81.480 110.282 54.634 1.00 0.00 C ATOM 18752 H1A PGR 500 81.971 109.586 55.318 1.00 0.00 H ATOM 18753 H1B PGR 500 81.352 109.715 53.708 1.00 0.00 H ATOM 18754 C32 PGR 500 82.224 111.601 54.308 1.00 0.00 C ATOM 18755 H2A PGR 500 83.234 111.408 53.937 1.00 0.00 H ATOM 18756 O35 PGR 500 82.358 112.330 55.558 1.00 0.00 O ATOM 18757 HO5A PGR 500 82.679 113.210 55.290 1.00 0.00 H ATOM 18758 C33 PGR 500 81.291 112.425 53.337 1.00 0.00 C ATOM 18759 H3A PGR 500 81.307 112.081 52.299 1.00 0.00 H ATOM 18760 H3B PGR 500 80.247 112.382 53.657 1.00 0.00 H ATOM 18761 O33 PGR 500 78.006 109.830 56.306 1.00 0.00 O ATOM 18762 O34 PGR 500 80.037 108.315 56.430 1.00 0.00 O ATOM 18763 O21 PGR 500 78.472 108.310 51.478 1.00 0.00 O ATOM 18764 C21 PGR 500 78.632 109.585 51.046 1.00 0.00 C ATOM 18765 O22 PGR 500 77.818 110.462 51.219 1.00 0.00 O ATOM 18766 O36 PGR 500 81.629 113.777 53.295 1.00 0.00 O ATOM 18767 HO6A PGR 500 81.116 114.220 52.595 1.00 0.00 H ATOM 18768 C12 OL 501 79.912 109.747 50.373 1.00 0.00 C ATOM 18769 H2R OL 501 80.781 109.751 51.034 1.00 0.00 H ATOM 18770 H2S OL 501 80.211 108.851 49.826 1.00 0.00 H ATOM 18771 C13 OL 501 79.880 110.917 49.262 1.00 0.00 C ATOM 18772 H3R OL 501 79.223 110.637 48.436 1.00 0.00 H ATOM 18773 H3S OL 501 79.272 111.748 49.628 1.00 0.00 H ATOM 18774 C14 OL 501 81.319 111.334 48.900 1.00 0.00 C ATOM 18775 H4R OL 501 81.793 111.459 49.876 1.00 0.00 H ATOM 18776 H4S OL 501 81.819 110.414 48.589 1.00 0.00 H ATOM 18777 C15 OL 501 81.517 112.489 47.978 1.00 0.00 C ATOM 18778 H5R OL 501 80.916 112.357 47.075 1.00 0.00 H ATOM 18779 H5S OL 501 81.071 113.378 48.429 1.00 0.00 H ATOM 18780 C16 OL 501 83.017 112.807 47.748 1.00 0.00 C ATOM 18781 H6R OL 501 83.560 112.783 48.696 1.00 0.00 H ATOM 18782 H6S OL 501 83.299 111.958 47.121 1.00 0.00 H ATOM 18783 C17 OL 501 83.373 114.146 47.080 1.00 0.00 C ATOM 18784 H7R OL 501 82.763 114.219 46.177 1.00 0.00 H ATOM 18785 H7S OL 501 83.035 114.947 47.741 1.00 0.00 H ATOM 18786 C18 OL 501 84.724 114.479 46.555 1.00 0.00 C ATOM 18787 H8R OL 501 84.986 113.764 45.772 1.00 0.00 H ATOM 18788 H8S OL 501 84.743 115.440 46.037 1.00 0.00 H ATOM 18789 C19 OL 501 85.802 114.320 47.646 1.00 0.00 C ATOM 18790 H9R OL 501 85.901 115.282 48.142 1.00 0.00 H ATOM 18791 C110 OL 501 86.478 113.186 47.974 1.00 0.00 C ATOM 18792 H10R OL 501 87.261 113.228 48.727 1.00 0.00 H ATOM 18793 C111 OL 501 86.251 111.862 47.226 1.00 0.00 C ATOM 18794 H11R OL 501 86.301 110.994 47.886 1.00 0.00 H ATOM 18795 H11S OL 501 85.274 111.842 46.737 1.00 0.00 H ATOM 18796 C112 OL 501 87.458 111.689 46.311 1.00 0.00 C ATOM 18797 H12R OL 501 87.396 112.366 45.456 1.00 0.00 H ATOM 18798 H12S OL 501 88.275 111.799 47.027 1.00 0.00 H ATOM 18799 C113 OL 501 87.523 110.197 45.787 1.00 0.00 C ATOM 18800 H13R OL 501 87.495 109.564 46.677 1.00 0.00 H ATOM 18801 H13S OL 501 86.527 110.070 45.359 1.00 0.00 H ATOM 18802 C114 OL 501 88.794 109.934 44.947 1.00 0.00 C ATOM 18803 H14R OL 501 88.684 110.590 44.081 1.00 0.00 H ATOM 18804 H14S OL 501 89.568 110.299 45.625 1.00 0.00 H ATOM 18805 C115 OL 501 89.059 108.513 44.712 1.00 0.00 C ATOM 18806 H15R OL 501 89.408 107.938 45.572 1.00 0.00 H ATOM 18807 H15S OL 501 88.003 108.255 44.601 1.00 0.00 H ATOM 18808 C116 OL 501 89.733 108.308 43.415 1.00 0.00 C ATOM 18809 H16R OL 501 89.148 108.797 42.634 1.00 0.00 H ATOM 18810 H16S OL 501 90.645 108.899 43.520 1.00 0.00 H ATOM 18811 C117 OL 501 89.856 106.871 43.090 1.00 0.00 C ATOM 18812 H17R OL 501 90.389 106.223 43.788 1.00 0.00 H ATOM 18813 H17S OL 501 88.816 106.540 43.074 1.00 0.00 H ATOM 18814 C118 OL 501 90.445 106.620 41.719 1.00 0.00 C ATOM 18815 H18R OL 501 90.118 105.593 41.544 1.00 0.00 H ATOM 18816 H18S OL 501 91.499 106.874 41.591 1.00 0.00 H ATOM 18817 H18T OL 501 89.877 107.156 40.956 1.00 0.00 H TER 18818 OL 501 ATOM 18818 C116 PA 502 72.039 17.222 39.937 1.00 0.00 C ATOM 18819 H16R PA 502 72.593 18.088 40.306 1.00 0.00 H ATOM 18820 H16S PA 502 71.392 17.628 39.156 1.00 0.00 H ATOM 18821 H16T PA 502 72.832 16.665 39.434 1.00 0.00 H ATOM 18822 C115 PA 502 71.231 16.580 40.988 1.00 0.00 C ATOM 18823 H15R PA 502 70.495 15.784 40.855 1.00 0.00 H ATOM 18824 H15S PA 502 70.576 17.268 41.526 1.00 0.00 H ATOM 18825 C114 PA 502 72.159 16.244 42.153 1.00 0.00 C ATOM 18826 H14R PA 502 72.832 17.065 42.405 1.00 0.00 H ATOM 18827 H14S PA 502 72.924 15.553 41.793 1.00 0.00 H ATOM 18828 C113 PA 502 71.526 15.681 43.380 1.00 0.00 C ATOM 18829 H13R PA 502 70.645 15.105 43.090 1.00 0.00 H ATOM 18830 H13S PA 502 71.226 16.547 43.974 1.00 0.00 H ATOM 18831 C112 PA 502 72.456 14.963 44.354 1.00 0.00 C ATOM 18832 H12R PA 502 71.987 14.609 45.275 1.00 0.00 H ATOM 18833 H12S PA 502 73.272 15.620 44.664 1.00 0.00 H ATOM 18834 C111 PA 502 72.912 13.576 43.939 1.00 0.00 C ATOM 18835 H11R PA 502 73.494 13.099 44.730 1.00 0.00 H ATOM 18836 H11S PA 502 73.707 13.595 43.190 1.00 0.00 H ATOM 18837 C110 PA 502 71.794 12.660 43.558 1.00 0.00 C ATOM 18838 H10R PA 502 71.491 12.852 42.527 1.00 0.00 H ATOM 18839 H10S PA 502 70.897 12.797 44.165 1.00 0.00 H ATOM 18840 C19 PA 502 72.068 11.232 43.615 1.00 0.00 C ATOM 18841 H9R PA 502 72.553 10.989 44.563 1.00 0.00 H ATOM 18842 H9S PA 502 72.684 10.991 42.746 1.00 0.00 H ATOM 18843 C18 PA 502 70.784 10.285 43.421 1.00 0.00 C ATOM 18844 H8R PA 502 70.324 10.657 42.503 1.00 0.00 H ATOM 18845 H8S PA 502 70.015 10.530 44.157 1.00 0.00 H ATOM 18846 C17 PA 502 71.146 8.831 43.426 1.00 0.00 C ATOM 18847 H7R PA 502 71.971 8.706 42.721 1.00 0.00 H ATOM 18848 H7S PA 502 70.352 8.286 42.912 1.00 0.00 H ATOM 18849 C16 PA 502 71.637 8.250 44.799 1.00 0.00 C ATOM 18850 H6R PA 502 70.753 8.177 45.435 1.00 0.00 H ATOM 18851 H6S PA 502 72.177 9.096 45.231 1.00 0.00 H ATOM 18852 C15 PA 502 72.532 6.986 44.771 1.00 0.00 C ATOM 18853 H5R PA 502 73.136 6.945 43.862 1.00 0.00 H ATOM 18854 H5S PA 502 71.908 6.089 44.779 1.00 0.00 H ATOM 18855 C14 PA 502 73.507 7.041 45.972 1.00 0.00 C ATOM 18856 H4R PA 502 73.975 8.022 46.076 1.00 0.00 H ATOM 18857 H4S PA 502 74.295 6.305 45.795 1.00 0.00 H ATOM 18858 C13 PA 502 72.746 6.721 47.343 1.00 0.00 C ATOM 18859 H3R PA 502 71.924 6.011 47.227 1.00 0.00 H ATOM 18860 H3S PA 502 72.226 7.624 47.670 1.00 0.00 H ATOM 18861 C12 PA 502 73.727 6.116 48.446 1.00 0.00 C ATOM 18862 H2R PA 502 74.687 6.630 48.530 1.00 0.00 H ATOM 18863 H2S PA 502 74.025 5.152 48.029 1.00 0.00 H ATOM 18864 C11 PGR 503 72.998 5.986 49.788 1.00 0.00 C ATOM 18865 O12 PGR 503 71.856 6.259 50.030 1.00 0.00 O ATOM 18866 O11 PGR 503 73.809 5.582 50.748 1.00 0.00 O ATOM 18867 C1 PGR 503 73.128 5.348 52.045 1.00 0.00 C ATOM 18868 HR PGR 503 72.212 4.756 51.965 1.00 0.00 H ATOM 18869 HS PGR 503 72.752 6.288 52.456 1.00 0.00 H ATOM 18870 C2 PGR 503 74.070 4.656 53.025 1.00 0.00 C ATOM 18871 HX PGR 503 73.555 4.548 53.983 1.00 0.00 H ATOM 18872 C3 PGR 503 75.368 5.427 53.035 1.00 0.00 C ATOM 18873 HA PGR 503 75.026 6.460 53.133 1.00 0.00 H ATOM 18874 HB PGR 503 75.880 5.477 52.070 1.00 0.00 H ATOM 18875 O31 PGR 503 76.308 5.160 54.060 1.00 0.00 O ATOM 18876 P31 PGR 503 75.885 5.172 55.591 1.00 0.00 P ATOM 18877 O32 PGR 503 75.047 3.721 55.797 1.00 0.00 O ATOM 18878 C31 PGR 503 75.639 2.458 55.572 1.00 0.00 C ATOM 18879 H1A PGR 503 76.655 2.354 55.961 1.00 0.00 H ATOM 18880 H1B PGR 503 75.586 2.225 54.505 1.00 0.00 H ATOM 18881 C32 PGR 503 74.728 1.366 56.231 1.00 0.00 C ATOM 18882 H2A PGR 503 74.635 1.608 57.293 1.00 0.00 H ATOM 18883 O35 PGR 503 73.447 1.304 55.608 1.00 0.00 O ATOM 18884 HO5A PGR 503 73.076 0.592 56.159 1.00 0.00 H ATOM 18885 C33 PGR 503 75.444 0.018 56.188 1.00 0.00 C ATOM 18886 H3A PGR 503 76.449 0.144 56.598 1.00 0.00 H ATOM 18887 H3B PGR 503 74.842 -0.743 56.691 1.00 0.00 H ATOM 18888 O33 PGR 503 77.074 5.081 56.507 1.00 0.00 O ATOM 18889 O34 PGR 503 74.982 6.334 55.778 1.00 0.00 O ATOM 18890 O21 PGR 503 74.384 3.328 52.539 1.00 0.00 O ATOM 18891 C21 PGR 503 73.463 2.325 52.488 1.00 0.00 C ATOM 18892 O22 PGR 503 72.346 2.464 52.996 1.00 0.00 O ATOM 18893 O36 PGR 503 75.642 -0.432 54.822 1.00 0.00 O ATOM 18894 HO6A PGR 503 76.307 0.097 54.345 1.00 0.00 H ATOM 18895 C12 OL 504 74.008 1.085 51.758 1.00 0.00 C ATOM 18896 H2R OL 504 74.345 0.311 52.451 1.00 0.00 H ATOM 18897 H2S OL 504 73.311 0.621 51.058 1.00 0.00 H ATOM 18898 C13 OL 504 75.296 1.305 50.942 1.00 0.00 C ATOM 18899 H3R OL 504 76.161 1.833 51.348 1.00 0.00 H ATOM 18900 H3S OL 504 75.686 0.306 50.738 1.00 0.00 H ATOM 18901 C14 OL 504 75.150 1.970 49.593 1.00 0.00 C ATOM 18902 H4R OL 504 74.448 1.418 48.966 1.00 0.00 H ATOM 18903 H4S OL 504 74.653 2.923 49.784 1.00 0.00 H ATOM 18904 C15 OL 504 76.432 2.257 48.720 1.00 0.00 C ATOM 18905 H5R OL 504 77.284 1.628 48.988 1.00 0.00 H ATOM 18906 H5S OL 504 76.239 1.904 47.705 1.00 0.00 H ATOM 18907 C16 OL 504 76.871 3.792 48.948 1.00 0.00 C ATOM 18908 H6R OL 504 76.112 4.407 48.460 1.00 0.00 H ATOM 18909 H6S OL 504 76.789 4.119 49.987 1.00 0.00 H ATOM 18910 C17 OL 504 78.275 4.061 48.575 1.00 0.00 C ATOM 18911 H7R OL 504 78.974 3.802 49.372 1.00 0.00 H ATOM 18912 H7S OL 504 78.544 3.582 47.631 1.00 0.00 H ATOM 18913 C18 OL 504 78.496 5.599 48.361 1.00 0.00 C ATOM 18914 H8R OL 504 78.624 6.147 49.297 1.00 0.00 H ATOM 18915 H8S OL 504 79.433 5.572 47.801 1.00 0.00 H ATOM 18916 C19 OL 504 77.630 6.299 47.379 1.00 0.00 C ATOM 18917 H9R OL 504 77.273 5.644 46.589 1.00 0.00 H ATOM 18918 C110 OL 504 77.308 7.622 47.433 1.00 0.00 C ATOM 18919 H10R OL 504 76.715 8.021 46.615 1.00 0.00 H ATOM 18920 C111 OL 504 77.765 8.652 48.341 1.00 0.00 C ATOM 18921 H11R OL 504 78.490 8.319 49.087 1.00 0.00 H ATOM 18922 H11S OL 504 78.520 9.331 47.942 1.00 0.00 H ATOM 18923 C112 OL 504 76.631 9.602 48.920 1.00 0.00 C ATOM 18924 H12R OL 504 76.219 9.091 49.793 1.00 0.00 H ATOM 18925 H12S OL 504 77.215 10.425 49.337 1.00 0.00 H ATOM 18926 C113 OL 504 75.581 10.085 47.911 1.00 0.00 C ATOM 18927 H13R OL 504 75.989 10.833 47.228 1.00 0.00 H ATOM 18928 H13S OL 504 75.299 9.216 47.312 1.00 0.00 H ATOM 18929 C114 OL 504 74.420 10.804 48.624 1.00 0.00 C ATOM 18930 H14R OL 504 74.141 10.135 49.442 1.00 0.00 H ATOM 18931 H14S OL 504 74.625 11.730 49.165 1.00 0.00 H ATOM 18932 C115 OL 504 73.183 10.955 47.749 1.00 0.00 C ATOM 18933 H15R OL 504 73.417 11.811 47.113 1.00 0.00 H ATOM 18934 H15S OL 504 73.045 10.121 47.058 1.00 0.00 H ATOM 18935 C116 OL 504 71.862 11.239 48.377 1.00 0.00 C ATOM 18936 H16R OL 504 71.596 10.480 49.116 1.00 0.00 H ATOM 18937 H16S OL 504 71.893 12.129 49.010 1.00 0.00 H ATOM 18938 C117 OL 504 70.881 11.499 47.274 1.00 0.00 C ATOM 18939 H17R OL 504 71.025 12.436 46.731 1.00 0.00 H ATOM 18940 H17S OL 504 70.997 10.703 46.535 1.00 0.00 H ATOM 18941 C118 OL 504 69.409 11.427 47.754 1.00 0.00 C ATOM 18942 H18R OL 504 68.724 11.474 46.905 1.00 0.00 H ATOM 18943 H18S OL 504 69.134 12.241 48.428 1.00 0.00 H ATOM 18944 H18T OL 504 69.223 10.474 48.256 1.00 0.00 H TER 18945 OL 504 ATOM 18945 C116 PA 505 83.435 132.405 39.621 1.00 0.00 C ATOM 18946 H16R PA 505 84.111 131.622 39.970 1.00 0.00 H ATOM 18947 H16S PA 505 84.034 132.926 38.871 1.00 0.00 H ATOM 18948 H16T PA 505 82.549 131.983 39.141 1.00 0.00 H ATOM 18949 C115 PA 505 82.989 133.494 40.623 1.00 0.00 C ATOM 18950 H15R PA 505 82.293 133.061 41.345 1.00 0.00 H ATOM 18951 H15S PA 505 82.473 134.332 40.150 1.00 0.00 H ATOM 18952 C114 PA 505 84.231 133.951 41.380 1.00 0.00 C ATOM 18953 H14R PA 505 84.967 134.236 40.625 1.00 0.00 H ATOM 18954 H14S PA 505 84.756 133.121 41.857 1.00 0.00 H ATOM 18955 C113 PA 505 84.018 135.031 42.515 1.00 0.00 C ATOM 18956 H13R PA 505 83.665 136.028 42.244 1.00 0.00 H ATOM 18957 H13S PA 505 85.001 135.180 42.967 1.00 0.00 H ATOM 18958 C112 PA 505 83.258 134.432 43.659 1.00 0.00 C ATOM 18959 H12R PA 505 83.490 133.372 43.787 1.00 0.00 H ATOM 18960 H12S PA 505 82.201 134.457 43.387 1.00 0.00 H ATOM 18961 C111 PA 505 83.484 135.205 44.951 1.00 0.00 C ATOM 18962 H11R PA 505 83.179 136.252 44.888 1.00 0.00 H ATOM 18963 H11S PA 505 84.556 135.397 45.034 1.00 0.00 H ATOM 18964 C110 PA 505 82.879 134.627 46.288 1.00 0.00 C ATOM 18965 H10R PA 505 83.236 133.601 46.395 1.00 0.00 H ATOM 18966 H10S PA 505 81.819 134.476 46.074 1.00 0.00 H ATOM 18967 C19 PA 505 83.293 135.377 47.525 1.00 0.00 C ATOM 18968 H9R PA 505 83.176 136.447 47.343 1.00 0.00 H ATOM 18969 H9S PA 505 84.363 135.180 47.614 1.00 0.00 H ATOM 18970 C18 PA 505 82.504 135.066 48.725 1.00 0.00 C ATOM 18971 H8R PA 505 82.798 134.036 48.938 1.00 0.00 H ATOM 18972 H8S PA 505 81.429 134.996 48.542 1.00 0.00 H ATOM 18973 C17 PA 505 82.859 135.942 49.957 1.00 0.00 C ATOM 18974 H7R PA 505 82.498 136.929 49.661 1.00 0.00 H ATOM 18975 H7S PA 505 83.950 135.931 49.894 1.00 0.00 H ATOM 18976 C16 PA 505 82.247 135.447 51.268 1.00 0.00 C ATOM 18977 H6R PA 505 81.168 135.295 51.194 1.00 0.00 H ATOM 18978 H6S PA 505 82.340 136.203 52.050 1.00 0.00 H ATOM 18979 C15 PA 505 82.986 134.215 51.810 1.00 0.00 C ATOM 18980 H5R PA 505 84.046 134.319 52.052 1.00 0.00 H ATOM 18981 H5S PA 505 82.935 133.350 51.145 1.00 0.00 H ATOM 18982 C14 PA 505 82.282 133.549 53.000 1.00 0.00 C ATOM 18983 H4R PA 505 82.856 132.678 53.323 1.00 0.00 H ATOM 18984 H4S PA 505 81.268 133.159 52.894 1.00 0.00 H ATOM 18985 C13 PA 505 82.152 134.405 54.291 1.00 0.00 C ATOM 18986 H3R PA 505 81.671 135.368 54.110 1.00 0.00 H ATOM 18987 H3S PA 505 83.129 134.676 54.698 1.00 0.00 H ATOM 18988 C12 PA 505 81.462 133.705 55.467 1.00 0.00 C ATOM 18989 H2R PA 505 81.907 132.755 55.769 1.00 0.00 H ATOM 18990 H2S PA 505 80.442 133.450 55.172 1.00 0.00 H ATOM 18991 C11 PGR 506 81.335 134.614 56.685 1.00 0.00 C ATOM 18992 O12 PGR 506 81.413 134.135 57.791 1.00 0.00 O ATOM 18993 O11 PGR 506 81.023 135.902 56.369 1.00 0.00 O ATOM 18994 C1 PGR 506 80.759 136.885 57.469 1.00 0.00 C ATOM 18995 HR PGR 506 80.000 136.497 58.153 1.00 0.00 H ATOM 18996 HS PGR 506 80.388 137.865 57.159 1.00 0.00 H ATOM 18997 C2 PGR 506 81.963 137.209 58.407 1.00 0.00 C ATOM 18998 HX PGR 506 82.378 136.258 58.750 1.00 0.00 H ATOM 18999 C3 PGR 506 81.466 137.948 59.639 1.00 0.00 C ATOM 19000 HA PGR 506 80.596 137.383 59.983 1.00 0.00 H ATOM 19001 HB PGR 506 81.184 138.966 59.358 1.00 0.00 H ATOM 19002 O31 PGR 506 82.493 137.960 60.596 1.00 0.00 O ATOM 19003 P31 PGR 506 82.223 138.366 62.128 1.00 0.00 P ATOM 19004 O32 PGR 506 82.169 139.923 62.091 1.00 0.00 O ATOM 19005 C31 PGR 506 80.967 140.570 61.856 1.00 0.00 C ATOM 19006 H1A PGR 506 80.290 140.234 62.645 1.00 0.00 H ATOM 19007 H1B PGR 506 80.472 140.509 60.883 1.00 0.00 H ATOM 19008 C32 PGR 506 81.321 142.031 62.211 1.00 0.00 C ATOM 19009 H2A PGR 506 82.127 142.352 61.546 1.00 0.00 H ATOM 19010 O35 PGR 506 81.749 142.203 63.538 1.00 0.00 O ATOM 19011 HO5A PGR 506 82.229 141.381 63.745 1.00 0.00 H ATOM 19012 C33 PGR 506 80.150 142.984 62.076 1.00 0.00 C ATOM 19013 H3A PGR 506 80.357 143.901 62.633 1.00 0.00 H ATOM 19014 H3B PGR 506 80.219 143.306 61.034 1.00 0.00 H ATOM 19015 O33 PGR 506 80.948 137.749 62.657 1.00 0.00 O ATOM 19016 O34 PGR 506 83.495 138.064 62.792 1.00 0.00 O ATOM 19017 O21 PGR 506 82.867 138.069 57.704 1.00 0.00 O ATOM 19018 C21 PGR 506 83.763 137.523 56.823 1.00 0.00 C ATOM 19019 O22 PGR 506 84.127 136.313 56.708 1.00 0.00 O ATOM 19020 O36 PGR 506 78.914 142.354 62.424 1.00 0.00 O ATOM 19021 HO6A PGR 506 78.181 142.981 62.295 1.00 0.00 H ATOM 19022 C12 OL 507 84.382 138.585 55.900 1.00 0.00 C ATOM 19023 H2R OL 507 83.867 139.515 56.149 1.00 0.00 H ATOM 19024 H2S OL 507 85.445 138.741 56.094 1.00 0.00 H ATOM 19025 C13 OL 507 84.076 138.355 54.464 1.00 0.00 C ATOM 19026 H3R OL 507 84.151 137.271 54.347 1.00 0.00 H ATOM 19027 H3S OL 507 83.000 138.513 54.377 1.00 0.00 H ATOM 19028 C14 OL 507 84.993 139.239 53.501 1.00 0.00 C ATOM 19029 H4R OL 507 84.673 140.256 53.738 1.00 0.00 H ATOM 19030 H4S OL 507 86.069 139.125 53.649 1.00 0.00 H ATOM 19031 C15 OL 507 84.738 139.151 52.017 1.00 0.00 C ATOM 19032 H5R OL 507 84.951 138.125 51.711 1.00 0.00 H ATOM 19033 H5S OL 507 83.735 139.355 51.635 1.00 0.00 H ATOM 19034 C16 OL 507 85.694 140.117 51.277 1.00 0.00 C ATOM 19035 H6R OL 507 85.259 141.116 51.353 1.00 0.00 H ATOM 19036 H6S OL 507 86.640 140.117 51.822 1.00 0.00 H ATOM 19037 C17 OL 507 85.911 139.711 49.805 1.00 0.00 C ATOM 19038 H7R OL 507 86.225 138.665 49.791 1.00 0.00 H ATOM 19039 H7S OL 507 84.965 139.723 49.261 1.00 0.00 H ATOM 19040 C18 OL 507 86.876 140.616 49.131 1.00 0.00 C ATOM 19041 H8R OL 507 86.508 141.645 49.144 1.00 0.00 H ATOM 19042 H8S OL 507 87.867 140.641 49.588 1.00 0.00 H ATOM 19043 C19 OL 507 86.994 140.214 47.697 1.00 0.00 C ATOM 19044 H9R OL 507 86.791 139.178 47.439 1.00 0.00 H ATOM 19045 C110 OL 507 87.413 140.901 46.626 1.00 0.00 C ATOM 19046 H10R OL 507 87.303 140.439 45.648 1.00 0.00 H ATOM 19047 C111 OL 507 87.596 142.346 46.630 1.00 0.00 C ATOM 19048 H11R OL 507 87.743 142.664 47.664 1.00 0.00 H ATOM 19049 H11S OL 507 88.580 142.555 46.206 1.00 0.00 H ATOM 19050 C112 OL 507 86.460 143.232 45.981 1.00 0.00 C ATOM 19051 H12R OL 507 85.465 142.997 46.367 1.00 0.00 H ATOM 19052 H12S OL 507 86.484 144.282 46.279 1.00 0.00 H ATOM 19053 C113 OL 507 86.377 143.076 44.480 1.00 0.00 C ATOM 19054 H13R OL 507 87.383 143.046 44.056 1.00 0.00 H ATOM 19055 H13S OL 507 85.965 142.079 44.310 1.00 0.00 H ATOM 19056 C114 OL 507 85.591 144.214 43.710 1.00 0.00 C ATOM 19057 H14R OL 507 84.577 144.271 44.112 1.00 0.00 H ATOM 19058 H14S OL 507 86.004 145.203 43.914 1.00 0.00 H ATOM 19059 C115 OL 507 85.241 143.838 42.233 1.00 0.00 C ATOM 19060 H15R OL 507 86.175 143.816 41.668 1.00 0.00 H ATOM 19061 H15S OL 507 84.892 142.804 42.276 1.00 0.00 H ATOM 19062 C116 OL 507 84.179 144.694 41.561 1.00 0.00 C ATOM 19063 H16R OL 507 83.276 144.739 42.173 1.00 0.00 H ATOM 19064 H16S OL 507 84.588 145.699 41.438 1.00 0.00 H ATOM 19065 C117 OL 507 83.722 144.166 40.218 1.00 0.00 C ATOM 19066 H17R OL 507 84.563 144.321 39.538 1.00 0.00 H ATOM 19067 H17S OL 507 83.492 143.105 40.336 1.00 0.00 H ATOM 19068 C118 OL 507 82.531 144.926 39.575 1.00 0.00 C ATOM 19069 H18R OL 507 82.880 145.951 39.433 1.00 0.00 H ATOM 19070 H18S OL 507 81.690 145.076 40.254 1.00 0.00 H ATOM 19071 H18T OL 507 82.241 144.487 38.618 1.00 0.00 H TER 19072 OL 507 ATOM 19072 C116 PA 508 -1.241 75.294 39.437 1.00 0.00 C ATOM 19073 H16R PA 508 -0.824 75.083 38.450 1.00 0.00 H ATOM 19074 H16S PA 508 -1.346 76.379 39.373 1.00 0.00 H ATOM 19075 H16T PA 508 -2.272 74.954 39.554 1.00 0.00 H ATOM 19076 C115 PA 508 -0.442 75.116 40.772 1.00 0.00 C ATOM 19077 H15R PA 508 -0.482 74.060 41.045 1.00 0.00 H ATOM 19078 H15S PA 508 -0.866 75.603 41.653 1.00 0.00 H ATOM 19079 C114 PA 508 0.959 75.795 40.803 1.00 0.00 C ATOM 19080 H14R PA 508 1.008 76.232 41.802 1.00 0.00 H ATOM 19081 H14S PA 508 0.909 76.721 40.226 1.00 0.00 H ATOM 19082 C113 PA 508 2.130 74.806 40.462 1.00 0.00 C ATOM 19083 H13R PA 508 3.089 75.289 40.261 1.00 0.00 H ATOM 19084 H13S PA 508 1.800 74.273 39.569 1.00 0.00 H ATOM 19085 C112 PA 508 2.249 73.695 41.534 1.00 0.00 C ATOM 19086 H12R PA 508 1.272 73.231 41.689 1.00 0.00 H ATOM 19087 H12S PA 508 2.501 74.170 42.484 1.00 0.00 H ATOM 19088 C111 PA 508 3.310 72.729 41.108 1.00 0.00 C ATOM 19089 H11R PA 508 4.298 73.186 41.194 1.00 0.00 H ATOM 19090 H11S PA 508 3.209 72.261 40.127 1.00 0.00 H ATOM 19091 C110 PA 508 3.434 71.686 42.232 1.00 0.00 C ATOM 19092 H10R PA 508 2.471 71.359 42.630 1.00 0.00 H ATOM 19093 H10S PA 508 4.025 72.178 43.007 1.00 0.00 H ATOM 19094 C19 PA 508 4.257 70.480 41.814 1.00 0.00 C ATOM 19095 H9R PA 508 5.197 70.858 41.407 1.00 0.00 H ATOM 19096 H9S PA 508 3.776 69.977 40.973 1.00 0.00 H ATOM 19097 C18 PA 508 4.563 69.507 42.953 1.00 0.00 C ATOM 19098 H8R PA 508 5.258 68.759 42.564 1.00 0.00 H ATOM 19099 H8S PA 508 3.706 68.847 43.100 1.00 0.00 H ATOM 19100 C17 PA 508 5.125 70.071 44.240 1.00 0.00 C ATOM 19101 H7R PA 508 4.384 70.785 44.606 1.00 0.00 H ATOM 19102 H7S PA 508 5.990 70.715 44.068 1.00 0.00 H ATOM 19103 C16 PA 508 5.254 68.974 45.305 1.00 0.00 C ATOM 19104 H6R PA 508 5.943 68.199 44.962 1.00 0.00 H ATOM 19105 H6S PA 508 4.286 68.471 45.366 1.00 0.00 H ATOM 19106 C15 PA 508 5.612 69.476 46.726 1.00 0.00 C ATOM 19107 H5R PA 508 6.606 69.927 46.696 1.00 0.00 H ATOM 19108 H5S PA 508 5.816 68.627 47.382 1.00 0.00 H ATOM 19109 C14 PA 508 4.373 70.270 47.335 1.00 0.00 C ATOM 19110 H4R PA 508 3.463 69.699 47.532 1.00 0.00 H ATOM 19111 H4S PA 508 4.055 71.125 46.736 1.00 0.00 H ATOM 19112 C13 PA 508 4.755 70.833 48.689 1.00 0.00 C ATOM 19113 H3R PA 508 5.334 71.741 48.508 1.00 0.00 H ATOM 19114 H3S PA 508 5.540 70.306 49.235 1.00 0.00 H ATOM 19115 C12 PA 508 3.498 71.207 49.454 1.00 0.00 C ATOM 19116 H2R PA 508 2.875 70.319 49.573 1.00 0.00 H ATOM 19117 H2S PA 508 3.022 72.012 48.889 1.00 0.00 H ATOM 19118 C11 PGR 509 3.817 71.685 50.808 1.00 0.00 C ATOM 19119 O12 PGR 509 4.550 71.119 51.620 1.00 0.00 O ATOM 19120 O11 PGR 509 3.166 72.767 51.098 1.00 0.00 O ATOM 19121 C1 PGR 509 3.158 73.356 52.450 1.00 0.00 C ATOM 19122 HR PGR 509 4.159 73.163 52.843 1.00 0.00 H ATOM 19123 HS PGR 509 2.366 72.819 52.979 1.00 0.00 H ATOM 19124 C2 PGR 509 2.918 74.907 52.327 1.00 0.00 C ATOM 19125 HX PGR 509 3.407 75.244 51.409 1.00 0.00 H ATOM 19126 C3 PGR 509 3.701 75.577 53.494 1.00 0.00 C ATOM 19127 HA PGR 509 3.289 76.577 53.648 1.00 0.00 H ATOM 19128 HB PGR 509 4.763 75.783 53.341 1.00 0.00 H ATOM 19129 O31 PGR 509 3.524 74.855 54.699 1.00 0.00 O ATOM 19130 P31 PGR 509 4.100 75.320 56.073 1.00 0.00 P ATOM 19131 O32 PGR 509 3.230 76.603 56.344 1.00 0.00 O ATOM 19132 C31 PGR 509 1.845 76.437 56.658 1.00 0.00 C ATOM 19133 H1A PGR 509 1.611 75.923 57.594 1.00 0.00 H ATOM 19134 H1B PGR 509 1.249 75.855 55.949 1.00 0.00 H ATOM 19135 C32 PGR 509 1.299 77.844 56.761 1.00 0.00 C ATOM 19136 H2A PGR 509 1.555 78.251 55.780 1.00 0.00 H ATOM 19137 O35 PGR 509 1.879 78.573 57.850 1.00 0.00 O ATOM 19138 HO5A PGR 509 2.824 78.340 57.864 1.00 0.00 H ATOM 19139 C33 PGR 509 -0.297 77.937 56.779 1.00 0.00 C ATOM 19140 H3A PGR 509 -0.530 78.989 56.600 1.00 0.00 H ATOM 19141 H3B PGR 509 -0.750 77.243 56.066 1.00 0.00 H ATOM 19142 O33 PGR 509 3.870 74.325 57.125 1.00 0.00 O ATOM 19143 O34 PGR 509 5.552 75.592 55.822 1.00 0.00 O ATOM 19144 O21 PGR 509 1.494 75.320 52.355 1.00 0.00 O ATOM 19145 C21 PGR 509 1.136 76.561 52.059 1.00 0.00 C ATOM 19146 O22 PGR 509 1.920 77.456 51.638 1.00 0.00 O ATOM 19147 O36 PGR 509 -0.771 77.552 58.114 1.00 0.00 O ATOM 19148 HO6A PGR 509 -1.644 77.121 58.080 1.00 0.00 H ATOM 19149 C12 OL 510 -0.373 76.760 52.061 1.00 0.00 C ATOM 19150 H2R OL 510 -0.767 76.273 52.956 1.00 0.00 H ATOM 19151 H2S OL 510 -0.510 77.809 52.330 1.00 0.00 H ATOM 19152 C13 OL 510 -1.119 76.410 50.753 1.00 0.00 C ATOM 19153 H3R OL 510 -0.727 75.435 50.456 1.00 0.00 H ATOM 19154 H3S OL 510 -2.142 76.205 51.074 1.00 0.00 H ATOM 19155 C14 OL 510 -0.983 77.474 49.671 1.00 0.00 C ATOM 19156 H4R OL 510 0.027 77.569 49.267 1.00 0.00 H ATOM 19157 H4S OL 510 -1.555 77.092 48.823 1.00 0.00 H ATOM 19158 C15 OL 510 -1.486 78.880 50.063 1.00 0.00 C ATOM 19159 H5R OL 510 -2.436 78.899 50.603 1.00 0.00 H ATOM 19160 H5S OL 510 -0.725 79.324 50.708 1.00 0.00 H ATOM 19161 C16 OL 510 -1.618 79.932 48.944 1.00 0.00 C ATOM 19162 H6R OL 510 -1.927 79.416 48.032 1.00 0.00 H ATOM 19163 H6S OL 510 -2.484 80.544 49.207 1.00 0.00 H ATOM 19164 C17 OL 510 -0.357 80.660 48.437 1.00 0.00 C ATOM 19165 H7R OL 510 -0.116 81.293 49.293 1.00 0.00 H ATOM 19166 H7S OL 510 0.492 80.026 48.172 1.00 0.00 H ATOM 19167 C18 OL 510 -0.568 81.683 47.333 1.00 0.00 C ATOM 19168 H8R OL 510 -1.334 82.325 47.775 1.00 0.00 H ATOM 19169 H8S OL 510 0.370 82.240 47.305 1.00 0.00 H ATOM 19170 C19 OL 510 -1.049 81.144 46.012 1.00 0.00 C ATOM 19171 H9R OL 510 -0.606 80.199 45.709 1.00 0.00 H ATOM 19172 C110 OL 510 -2.091 81.584 45.298 1.00 0.00 C ATOM 19173 H10R OL 510 -2.272 81.093 44.345 1.00 0.00 H ATOM 19174 C111 OL 510 -2.846 82.865 45.515 1.00 0.00 C ATOM 19175 H11R OL 510 -3.706 82.707 46.170 1.00 0.00 H ATOM 19176 H11S OL 510 -2.239 83.673 45.928 1.00 0.00 H ATOM 19177 C112 OL 510 -3.492 83.366 44.181 1.00 0.00 C ATOM 19178 H12R OL 510 -3.988 84.303 44.443 1.00 0.00 H ATOM 19179 H12S OL 510 -2.711 83.544 43.439 1.00 0.00 H ATOM 19180 C113 OL 510 -4.468 82.355 43.547 1.00 0.00 C ATOM 19181 H13R OL 510 -3.948 81.547 43.027 1.00 0.00 H ATOM 19182 H13S OL 510 -5.112 81.839 44.263 1.00 0.00 H ATOM 19183 C114 OL 510 -5.433 83.033 42.617 1.00 0.00 C ATOM 19184 H14R OL 510 -5.879 83.894 43.119 1.00 0.00 H ATOM 19185 H14S OL 510 -4.869 83.333 41.731 1.00 0.00 H ATOM 19186 C115 OL 510 -6.601 82.210 42.120 1.00 0.00 C ATOM 19187 H15R OL 510 -6.232 81.444 41.435 1.00 0.00 H ATOM 19188 H15S OL 510 -7.045 81.798 43.029 1.00 0.00 H ATOM 19189 C116 OL 510 -7.495 82.976 41.254 1.00 0.00 C ATOM 19190 H16R OL 510 -7.931 83.793 41.833 1.00 0.00 H ATOM 19191 H16S OL 510 -6.962 83.368 40.385 1.00 0.00 H ATOM 19192 C117 OL 510 -8.728 82.203 40.638 1.00 0.00 C ATOM 19193 H17R OL 510 -8.443 81.187 40.357 1.00 0.00 H ATOM 19194 H17S OL 510 -9.476 81.977 41.401 1.00 0.00 H ATOM 19195 C118 OL 510 -9.381 82.940 39.499 1.00 0.00 C ATOM 19196 H18R OL 510 -8.817 82.867 38.567 1.00 0.00 H ATOM 19197 H18S OL 510 -9.732 83.928 39.804 1.00 0.00 H ATOM 19198 H18T OL 510 -10.290 82.367 39.307 1.00 0.00 H TER 19199 OL 510 ATOM 19199 C116 PA 511 150.289 55.753 52.362 1.00 0.00 C ATOM 19200 H16R PA 511 150.909 55.776 53.261 1.00 0.00 H ATOM 19201 H16S PA 511 150.087 54.718 52.078 1.00 0.00 H ATOM 19202 H16T PA 511 149.329 56.209 52.614 1.00 0.00 H ATOM 19203 C115 PA 511 150.945 56.531 51.245 1.00 0.00 C ATOM 19204 H15R PA 511 151.942 56.094 51.164 1.00 0.00 H ATOM 19205 H15S PA 511 151.108 57.545 51.616 1.00 0.00 H ATOM 19206 C114 PA 511 150.264 56.535 49.805 1.00 0.00 C ATOM 19207 H14R PA 511 149.333 57.101 49.883 1.00 0.00 H ATOM 19208 H14S PA 511 150.101 55.538 49.392 1.00 0.00 H ATOM 19209 C113 PA 511 151.153 57.274 48.893 1.00 0.00 C ATOM 19210 H13R PA 511 152.205 56.986 48.947 1.00 0.00 H ATOM 19211 H13S PA 511 151.358 58.292 49.231 1.00 0.00 H ATOM 19212 C112 PA 511 150.738 57.358 47.459 1.00 0.00 C ATOM 19213 H12R PA 511 150.714 56.312 47.147 1.00 0.00 H ATOM 19214 H12S PA 511 151.556 57.765 46.861 1.00 0.00 H ATOM 19215 C111 PA 511 149.525 58.180 47.134 1.00 0.00 C ATOM 19216 H11R PA 511 148.731 57.592 47.598 1.00 0.00 H ATOM 19217 H11S PA 511 149.382 58.218 46.052 1.00 0.00 H ATOM 19218 C110 PA 511 149.382 59.539 47.668 1.00 0.00 C ATOM 19219 H10R PA 511 150.341 60.043 47.531 1.00 0.00 H ATOM 19220 H10S PA 511 149.310 59.584 48.756 1.00 0.00 H ATOM 19221 C19 PA 511 148.107 60.214 47.170 1.00 0.00 C ATOM 19222 H9R PA 511 148.167 60.335 46.087 1.00 0.00 H ATOM 19223 H9S PA 511 148.091 61.251 47.511 1.00 0.00 H ATOM 19224 C18 PA 511 146.714 59.699 47.528 1.00 0.00 C ATOM 19225 H8R PA 511 146.707 58.608 47.493 1.00 0.00 H ATOM 19226 H8S PA 511 145.962 59.946 46.775 1.00 0.00 H ATOM 19227 C17 PA 511 146.319 60.199 48.893 1.00 0.00 C ATOM 19228 H7R PA 511 146.348 61.291 48.926 1.00 0.00 H ATOM 19229 H7S PA 511 147.033 59.892 49.660 1.00 0.00 H ATOM 19230 C16 PA 511 144.892 59.725 49.350 1.00 0.00 C ATOM 19231 H6R PA 511 144.881 58.680 49.033 1.00 0.00 H ATOM 19232 H6S PA 511 144.136 60.277 48.788 1.00 0.00 H ATOM 19233 C15 PA 511 144.592 59.932 50.836 1.00 0.00 C ATOM 19234 H5R PA 511 144.979 60.902 51.154 1.00 0.00 H ATOM 19235 H5S PA 511 145.160 59.217 51.434 1.00 0.00 H ATOM 19236 C14 PA 511 143.117 59.634 51.235 1.00 0.00 C ATOM 19237 H4R PA 511 142.727 58.921 50.506 1.00 0.00 H ATOM 19238 H4S PA 511 142.472 60.515 51.230 1.00 0.00 H ATOM 19239 C13 PA 511 142.954 58.806 52.506 1.00 0.00 C ATOM 19240 H3R PA 511 143.209 59.390 53.393 1.00 0.00 H ATOM 19241 H3S PA 511 143.827 58.151 52.536 1.00 0.00 H ATOM 19242 C12 PA 511 141.628 58.119 52.653 1.00 0.00 C ATOM 19243 H2R PA 511 141.525 57.290 51.950 1.00 0.00 H ATOM 19244 H2S PA 511 140.804 58.818 52.497 1.00 0.00 H ATOM 19245 C11 PGR 512 141.504 57.539 54.012 1.00 0.00 C ATOM 19246 O12 PGR 512 140.551 57.598 54.740 1.00 0.00 O ATOM 19247 O11 PGR 512 142.546 56.714 54.289 1.00 0.00 O ATOM 19248 C1 PGR 512 142.483 55.871 55.548 1.00 0.00 C ATOM 19249 HR PGR 512 142.553 56.577 56.380 1.00 0.00 H ATOM 19250 HS PGR 512 143.387 55.285 55.732 1.00 0.00 H ATOM 19251 C2 PGR 512 141.360 54.795 55.605 1.00 0.00 C ATOM 19252 HX PGR 512 140.406 55.324 55.677 1.00 0.00 H ATOM 19253 C3 PGR 512 141.463 53.955 56.888 1.00 0.00 C ATOM 19254 HA PGR 512 141.466 54.699 57.689 1.00 0.00 H ATOM 19255 HB PGR 512 142.396 53.386 56.895 1.00 0.00 H ATOM 19256 O31 PGR 512 140.316 53.103 56.991 1.00 0.00 O ATOM 19257 P31 PGR 512 140.051 52.164 58.180 1.00 0.00 P ATOM 19258 O32 PGR 512 139.640 53.147 59.354 1.00 0.00 O ATOM 19259 C31 PGR 512 138.435 53.858 59.293 1.00 0.00 C ATOM 19260 H1A PGR 512 137.676 53.087 59.143 1.00 0.00 H ATOM 19261 H1B PGR 512 138.420 54.565 58.459 1.00 0.00 H ATOM 19262 C32 PGR 512 138.302 54.743 60.507 1.00 0.00 C ATOM 19263 H2A PGR 512 139.223 55.324 60.599 1.00 0.00 H ATOM 19264 O35 PGR 512 137.882 54.015 61.691 1.00 0.00 O ATOM 19265 HO5A PGR 512 137.836 54.716 62.365 1.00 0.00 H ATOM 19266 C33 PGR 512 137.140 55.728 60.282 1.00 0.00 C ATOM 19267 H3A PGR 512 137.158 56.283 59.341 1.00 0.00 H ATOM 19268 H3B PGR 512 136.179 55.208 60.237 1.00 0.00 H ATOM 19269 O33 PGR 512 138.911 51.321 57.749 1.00 0.00 O ATOM 19270 O34 PGR 512 141.343 51.565 58.622 1.00 0.00 O ATOM 19271 O21 PGR 512 141.635 53.852 54.569 1.00 0.00 O ATOM 19272 C21 PGR 512 141.061 54.051 53.369 1.00 0.00 C ATOM 19273 O22 PGR 512 140.492 55.051 52.982 1.00 0.00 O ATOM 19274 O36 PGR 512 136.958 56.655 61.377 1.00 0.00 O ATOM 19275 HO6A PGR 512 137.531 57.403 61.129 1.00 0.00 H ATOM 19276 C12 OL 513 141.303 52.858 52.507 1.00 0.00 C ATOM 19277 H2R OL 513 141.985 53.219 51.734 1.00 0.00 H ATOM 19278 H2S OL 513 141.789 52.075 53.093 1.00 0.00 H ATOM 19279 C13 OL 513 140.096 52.347 51.782 1.00 0.00 C ATOM 19280 H3R OL 513 139.454 51.874 52.528 1.00 0.00 H ATOM 19281 H3S OL 513 139.587 53.179 51.290 1.00 0.00 H ATOM 19282 C14 OL 513 140.481 51.408 50.655 1.00 0.00 C ATOM 19283 H4R OL 513 141.317 51.822 50.087 1.00 0.00 H ATOM 19284 H4S OL 513 140.937 50.502 51.060 1.00 0.00 H ATOM 19285 C15 OL 513 139.309 50.952 49.693 1.00 0.00 C ATOM 19286 H5R OL 513 138.534 50.460 50.285 1.00 0.00 H ATOM 19287 H5S OL 513 138.766 51.848 49.387 1.00 0.00 H ATOM 19288 C16 OL 513 139.575 49.931 48.620 1.00 0.00 C ATOM 19289 H6R OL 513 138.701 49.694 48.011 1.00 0.00 H ATOM 19290 H6S OL 513 140.231 50.252 47.809 1.00 0.00 H ATOM 19291 C17 OL 513 140.138 48.628 49.163 1.00 0.00 C ATOM 19292 H7R OL 513 141.113 48.725 49.645 1.00 0.00 H ATOM 19293 H7S OL 513 139.424 48.266 49.906 1.00 0.00 H ATOM 19294 C18 OL 513 140.239 47.571 48.071 1.00 0.00 C ATOM 19295 H8R OL 513 139.256 47.351 47.651 1.00 0.00 H ATOM 19296 H8S OL 513 140.930 47.935 47.309 1.00 0.00 H ATOM 19297 C19 OL 513 140.803 46.314 48.573 1.00 0.00 C ATOM 19298 H9R OL 513 141.477 46.519 49.401 1.00 0.00 H ATOM 19299 C110 OL 513 140.734 45.061 48.131 1.00 0.00 C ATOM 19300 H10R OL 513 141.506 44.399 48.513 1.00 0.00 H ATOM 19301 C111 OL 513 139.943 44.580 46.972 1.00 0.00 C ATOM 19302 H11R OL 513 139.098 45.252 46.809 1.00 0.00 H ATOM 19303 H11S OL 513 140.535 44.666 46.058 1.00 0.00 H ATOM 19304 C112 OL 513 139.495 43.172 47.188 1.00 0.00 C ATOM 19305 H12R OL 513 140.309 42.522 46.860 1.00 0.00 H ATOM 19306 H12S OL 513 139.387 42.865 48.230 1.00 0.00 H ATOM 19307 C113 OL 513 138.132 42.799 46.461 1.00 0.00 C ATOM 19308 H13R OL 513 137.747 41.893 46.933 1.00 0.00 H ATOM 19309 H13S OL 513 137.482 43.587 46.847 1.00 0.00 H ATOM 19310 C114 OL 513 138.099 42.684 44.901 1.00 0.00 C ATOM 19311 H14R OL 513 138.009 43.715 44.553 1.00 0.00 H ATOM 19312 H14S OL 513 139.063 42.316 44.543 1.00 0.00 H ATOM 19313 C115 OL 513 136.922 42.040 44.259 1.00 0.00 C ATOM 19314 H15R OL 513 136.825 40.989 44.536 1.00 0.00 H ATOM 19315 H15S OL 513 135.993 42.413 44.697 1.00 0.00 H ATOM 19316 C116 OL 513 137.034 42.038 42.705 1.00 0.00 C ATOM 19317 H16R OL 513 137.936 41.521 42.371 1.00 0.00 H ATOM 19318 H16S OL 513 136.177 41.534 42.253 1.00 0.00 H ATOM 19319 C117 OL 513 136.886 43.481 42.108 1.00 0.00 C ATOM 19320 H17R OL 513 136.071 44.015 42.602 1.00 0.00 H ATOM 19321 H17S OL 513 137.727 44.108 42.412 1.00 0.00 H ATOM 19322 C118 OL 513 136.898 43.604 40.620 1.00 0.00 C ATOM 19323 H18R OL 513 136.129 42.973 40.168 1.00 0.00 H ATOM 19324 H18S OL 513 137.924 43.376 40.326 1.00 0.00 H ATOM 19325 H18T OL 513 136.649 44.634 40.357 1.00 0.00 H TER 19326 OL 513 ATOM 19326 C116 PA 514 4.177 92.176 40.996 1.00 0.00 C ATOM 19327 H16R PA 514 5.124 92.122 41.536 1.00 0.00 H ATOM 19328 H16S PA 514 4.294 92.854 40.148 1.00 0.00 H ATOM 19329 H16T PA 514 3.822 91.189 40.692 1.00 0.00 H ATOM 19330 C115 PA 514 3.292 92.800 42.033 1.00 0.00 C ATOM 19331 H15R PA 514 2.294 92.899 41.601 1.00 0.00 H ATOM 19332 H15S PA 514 3.720 93.741 42.385 1.00 0.00 H ATOM 19333 C114 PA 514 3.141 91.917 43.333 1.00 0.00 C ATOM 19334 H14R PA 514 4.139 91.710 43.724 1.00 0.00 H ATOM 19335 H14S PA 514 2.657 90.954 43.155 1.00 0.00 H ATOM 19336 C113 PA 514 2.195 92.592 44.267 1.00 0.00 C ATOM 19337 H13R PA 514 1.144 92.368 44.073 1.00 0.00 H ATOM 19338 H13S PA 514 2.190 93.676 44.135 1.00 0.00 H ATOM 19339 C112 PA 514 2.624 92.243 45.707 1.00 0.00 C ATOM 19340 H12R PA 514 2.171 93.036 46.305 1.00 0.00 H ATOM 19341 H12S PA 514 3.672 92.325 46.004 1.00 0.00 H ATOM 19342 C111 PA 514 2.014 90.935 46.122 1.00 0.00 C ATOM 19343 H11R PA 514 2.623 90.272 45.506 1.00 0.00 H ATOM 19344 H11S PA 514 0.981 90.868 45.774 1.00 0.00 H ATOM 19345 C110 PA 514 2.212 90.626 47.614 1.00 0.00 C ATOM 19346 H10R PA 514 2.090 91.568 48.153 1.00 0.00 H ATOM 19347 H10S PA 514 3.284 90.426 47.670 1.00 0.00 H ATOM 19348 C19 PA 514 1.465 89.514 48.354 1.00 0.00 C ATOM 19349 H9R PA 514 1.438 89.813 49.404 1.00 0.00 H ATOM 19350 H9S PA 514 2.166 88.682 48.260 1.00 0.00 H ATOM 19351 C18 PA 514 0.050 89.066 47.948 1.00 0.00 C ATOM 19352 H8R PA 514 -0.018 88.466 47.038 1.00 0.00 H ATOM 19353 H8S PA 514 -0.566 89.923 47.666 1.00 0.00 H ATOM 19354 C17 PA 514 -0.705 88.283 49.026 1.00 0.00 C ATOM 19355 H7R PA 514 -1.716 88.626 48.800 1.00 0.00 H ATOM 19356 H7S PA 514 -0.487 88.595 50.050 1.00 0.00 H ATOM 19357 C16 PA 514 -0.456 86.790 48.926 1.00 0.00 C ATOM 19358 H6R PA 514 0.617 86.592 48.898 1.00 0.00 H ATOM 19359 H6S PA 514 -0.857 86.354 48.009 1.00 0.00 H ATOM 19360 C15 PA 514 -1.051 86.076 50.178 1.00 0.00 C ATOM 19361 H5R PA 514 -2.131 86.093 50.016 1.00 0.00 H ATOM 19362 H5S PA 514 -1.032 86.554 51.159 1.00 0.00 H ATOM 19363 C14 PA 514 -0.658 84.640 50.343 1.00 0.00 C ATOM 19364 H4R PA 514 0.404 84.468 50.159 1.00 0.00 H ATOM 19365 H4S PA 514 -1.201 84.047 49.603 1.00 0.00 H ATOM 19366 C13 PA 514 -0.958 84.178 51.803 1.00 0.00 C ATOM 19367 H3R PA 514 -2.023 84.018 51.987 1.00 0.00 H ATOM 19368 H3S PA 514 -0.699 84.996 52.478 1.00 0.00 H ATOM 19369 C12 PA 514 -0.226 82.898 52.244 1.00 0.00 C ATOM 19370 H2R PA 514 0.822 82.926 51.937 1.00 0.00 H ATOM 19371 H2S PA 514 -0.717 82.065 51.737 1.00 0.00 H ATOM 19372 C11 PC 515 -0.364 82.818 53.751 1.00 0.00 C ATOM 19373 O12 PC 515 -1.312 82.529 54.394 1.00 0.00 O ATOM 19374 O11 PC 515 0.810 83.106 54.308 1.00 0.00 O ATOM 19375 C1 PC 515 1.194 83.153 55.714 1.00 0.00 C ATOM 19376 HR PC 515 0.418 83.727 56.227 1.00 0.00 H ATOM 19377 HS PC 515 2.159 83.664 55.769 1.00 0.00 H ATOM 19378 C2 PC 515 1.369 81.745 56.367 1.00 0.00 C ATOM 19379 HX PC 515 0.467 81.141 56.245 1.00 0.00 H ATOM 19380 C3 PC 515 1.625 81.988 57.887 1.00 0.00 C ATOM 19381 HA PC 515 1.470 81.115 58.526 1.00 0.00 H ATOM 19382 HB PC 515 1.005 82.805 58.265 1.00 0.00 H ATOM 19383 O31 PC 515 2.997 82.440 57.894 1.00 0.00 O ATOM 19384 P31 PC 515 4.031 82.202 59.166 1.00 0.00 P ATOM 19385 O32 PC 515 3.311 82.985 60.322 1.00 0.00 O ATOM 19386 C31 PC 515 3.279 84.389 60.237 1.00 0.00 C ATOM 19387 H1A PC 515 2.624 84.625 59.394 1.00 0.00 H ATOM 19388 H1B PC 515 4.211 84.893 59.972 1.00 0.00 H ATOM 19389 C32 PC 515 2.589 84.848 61.488 1.00 0.00 C ATOM 19390 H2A PC 515 1.656 84.294 61.597 1.00 0.00 H ATOM 19391 H2B PC 515 2.384 85.908 61.332 1.00 0.00 H ATOM 19392 N31 PC 515 3.390 84.713 62.767 1.00 0.00 N ATOM 19393 C33 PC 515 3.346 83.286 63.271 1.00 0.00 C ATOM 19394 H3A PC 515 2.282 83.085 63.142 1.00 0.00 H ATOM 19395 H3B PC 515 3.666 83.253 64.314 1.00 0.00 H ATOM 19396 H3C PC 515 3.823 82.601 62.569 1.00 0.00 H ATOM 19397 C34 PC 515 4.758 85.116 62.521 1.00 0.00 C ATOM 19398 H4A PC 515 5.152 84.410 61.789 1.00 0.00 H ATOM 19399 H4B PC 515 5.256 84.929 63.474 1.00 0.00 H ATOM 19400 H4C PC 515 4.675 86.164 62.228 1.00 0.00 H ATOM 19401 C35 PC 515 2.818 85.515 63.839 1.00 0.00 C ATOM 19402 H5A PC 515 3.486 85.497 64.701 1.00 0.00 H ATOM 19403 H5B PC 515 1.846 85.126 64.147 1.00 0.00 H ATOM 19404 H5C PC 515 2.827 86.521 63.417 1.00 0.00 H ATOM 19405 O33 PC 515 4.082 80.762 59.444 1.00 0.00 O ATOM 19406 O34 PC 515 5.274 82.984 58.902 1.00 0.00 O ATOM 19407 O21 PC 515 2.630 81.226 55.762 1.00 0.00 O ATOM 19408 C21 PC 515 2.497 80.564 54.618 1.00 0.00 C ATOM 19409 O22 PC 515 1.393 80.316 54.219 1.00 0.00 O ATOM 19410 C12 OL 516 3.727 79.962 53.996 1.00 0.00 C ATOM 19411 H2R OL 516 4.644 80.328 54.463 1.00 0.00 H ATOM 19412 H2S OL 516 3.708 78.877 54.117 1.00 0.00 H ATOM 19413 C13 OL 516 3.926 80.436 52.548 1.00 0.00 C ATOM 19414 H3R OL 516 3.175 79.877 51.985 1.00 0.00 H ATOM 19415 H3S OL 516 3.682 81.493 52.669 1.00 0.00 H ATOM 19416 C14 OL 516 5.329 80.384 51.954 1.00 0.00 C ATOM 19417 H4R OL 516 5.331 81.033 51.075 1.00 0.00 H ATOM 19418 H4S OL 516 5.942 80.936 52.670 1.00 0.00 H ATOM 19419 C15 OL 516 5.805 78.949 51.739 1.00 0.00 C ATOM 19420 H5R OL 516 6.874 79.114 51.592 1.00 0.00 H ATOM 19421 H5S OL 516 5.918 78.340 52.638 1.00 0.00 H ATOM 19422 C16 OL 516 5.130 78.112 50.543 1.00 0.00 C ATOM 19423 H6R OL 516 4.038 78.146 50.552 1.00 0.00 H ATOM 19424 H6S OL 516 5.458 78.573 49.609 1.00 0.00 H ATOM 19425 C17 OL 516 5.613 76.656 50.512 1.00 0.00 C ATOM 19426 H7R OL 516 6.690 76.540 50.379 1.00 0.00 H ATOM 19427 H7S OL 516 5.452 76.242 51.510 1.00 0.00 H ATOM 19428 C18 OL 516 5.020 75.778 49.360 1.00 0.00 C ATOM 19429 H8R OL 516 3.934 75.705 49.271 1.00 0.00 H ATOM 19430 H8S OL 516 5.289 76.222 48.400 1.00 0.00 H ATOM 19431 C19 OL 516 5.651 74.423 49.566 1.00 0.00 C ATOM 19432 H9R OL 516 4.993 73.799 50.167 1.00 0.00 H ATOM 19433 C110 OL 516 6.827 73.993 49.126 1.00 0.00 C ATOM 19434 H10R OL 516 7.171 73.019 49.465 1.00 0.00 H ATOM 19435 C111 OL 516 7.780 74.677 48.227 1.00 0.00 C ATOM 19436 H11R OL 516 7.472 75.724 48.248 1.00 0.00 H ATOM 19437 H11S OL 516 8.702 74.574 48.804 1.00 0.00 H ATOM 19438 C112 OL 516 7.967 74.261 46.756 1.00 0.00 C ATOM 19439 H12R OL 516 7.050 74.551 46.238 1.00 0.00 H ATOM 19440 H12S OL 516 8.753 74.915 46.376 1.00 0.00 H ATOM 19441 C113 OL 516 8.424 72.776 46.562 1.00 0.00 C ATOM 19442 H13R OL 516 9.298 72.748 47.216 1.00 0.00 H ATOM 19443 H13S OL 516 7.683 72.111 47.010 1.00 0.00 H ATOM 19444 C114 OL 516 8.599 72.477 45.116 1.00 0.00 C ATOM 19445 H14R OL 516 7.662 72.489 44.555 1.00 0.00 H ATOM 19446 H14S OL 516 9.213 73.266 44.677 1.00 0.00 H ATOM 19447 C115 OL 516 9.226 71.120 44.725 1.00 0.00 C ATOM 19448 H15R OL 516 10.114 71.018 45.353 1.00 0.00 H ATOM 19449 H15S OL 516 8.537 70.378 45.134 1.00 0.00 H ATOM 19450 C116 OL 516 9.686 70.893 43.261 1.00 0.00 C ATOM 19451 H16R OL 516 8.903 71.101 42.530 1.00 0.00 H ATOM 19452 H16S OL 516 10.471 71.594 42.968 1.00 0.00 H ATOM 19453 C117 OL 516 10.136 69.488 42.935 1.00 0.00 C ATOM 19454 H17R OL 516 10.966 69.134 43.551 1.00 0.00 H ATOM 19455 H17S OL 516 9.272 68.825 43.019 1.00 0.00 H ATOM 19456 C118 OL 516 10.813 69.358 41.580 1.00 0.00 C ATOM 19457 H18R OL 516 11.698 69.971 41.393 1.00 0.00 H ATOM 19458 H18S OL 516 10.142 69.606 40.754 1.00 0.00 H ATOM 19459 H18T OL 516 11.046 68.299 41.451 1.00 0.00 H TER 19460 OL 516 ATOM 19460 C116 PA 517 53.430 108.175 45.347 1.00 0.00 C ATOM 19461 H16R PA 517 53.645 108.195 44.277 1.00 0.00 H ATOM 19462 H16S PA 517 54.304 108.421 45.953 1.00 0.00 H ATOM 19463 H16T PA 517 52.577 108.854 45.405 1.00 0.00 H ATOM 19464 C115 PA 517 53.041 106.756 45.759 1.00 0.00 C ATOM 19465 H15R PA 517 53.980 106.232 45.567 1.00 0.00 H ATOM 19466 H15S PA 517 52.252 106.379 45.104 1.00 0.00 H ATOM 19467 C114 PA 517 52.582 106.605 47.184 1.00 0.00 C ATOM 19468 H14R PA 517 51.726 107.235 47.436 1.00 0.00 H ATOM 19469 H14S PA 517 53.423 106.898 47.817 1.00 0.00 H ATOM 19470 C113 PA 517 52.193 105.153 47.673 1.00 0.00 C ATOM 19471 H13R PA 517 53.084 104.530 47.579 1.00 0.00 H ATOM 19472 H13S PA 517 51.453 104.738 46.984 1.00 0.00 H ATOM 19473 C112 PA 517 51.755 105.174 49.151 1.00 0.00 C ATOM 19474 H12R PA 517 51.004 105.937 49.366 1.00 0.00 H ATOM 19475 H12S PA 517 52.629 105.262 49.800 1.00 0.00 H ATOM 19476 C111 PA 517 50.873 103.856 49.468 1.00 0.00 C ATOM 19477 H11R PA 517 51.256 102.931 49.033 1.00 0.00 H ATOM 19478 H11S PA 517 49.986 103.939 48.837 1.00 0.00 H ATOM 19479 C110 PA 517 50.328 103.699 50.897 1.00 0.00 C ATOM 19480 H10R PA 517 50.042 102.671 51.127 1.00 0.00 H ATOM 19481 H10S PA 517 49.519 104.430 50.956 1.00 0.00 H ATOM 19482 C19 PA 517 51.285 104.090 51.984 1.00 0.00 C ATOM 19483 H9R PA 517 50.694 103.936 52.889 1.00 0.00 H ATOM 19484 H9S PA 517 51.328 105.180 51.947 1.00 0.00 H ATOM 19485 C18 PA 517 52.632 103.302 51.997 1.00 0.00 C ATOM 19486 H8R PA 517 53.170 103.678 52.870 1.00 0.00 H ATOM 19487 H8S PA 517 53.239 103.620 51.147 1.00 0.00 H ATOM 19488 C17 PA 517 52.569 101.679 51.985 1.00 0.00 C ATOM 19489 H7R PA 517 53.569 101.278 51.805 1.00 0.00 H ATOM 19490 H7S PA 517 52.169 101.431 51.000 1.00 0.00 H ATOM 19491 C16 PA 517 51.766 101.001 53.080 1.00 0.00 C ATOM 19492 H6R PA 517 50.699 101.159 52.909 1.00 0.00 H ATOM 19493 H6S PA 517 51.976 101.439 54.058 1.00 0.00 H ATOM 19494 C15 PA 517 51.987 99.564 53.275 1.00 0.00 C ATOM 19495 H5R PA 517 53.031 99.468 53.580 1.00 0.00 H ATOM 19496 H5S PA 517 51.946 99.059 52.308 1.00 0.00 H ATOM 19497 C14 PA 517 51.034 98.807 54.100 1.00 0.00 C ATOM 19498 H4R PA 517 50.053 98.979 53.652 1.00 0.00 H ATOM 19499 H4S PA 517 50.946 99.302 55.069 1.00 0.00 H ATOM 19500 C13 PA 517 51.200 97.320 54.104 1.00 0.00 C ATOM 19501 H3R PA 517 52.188 96.981 54.420 1.00 0.00 H ATOM 19502 H3S PA 517 51.290 96.985 53.068 1.00 0.00 H ATOM 19503 C12 PA 517 50.030 96.567 54.744 1.00 0.00 C ATOM 19504 H2R PA 517 50.126 95.556 54.344 1.00 0.00 H ATOM 19505 H2S PA 517 49.014 96.833 54.447 1.00 0.00 H ATOM 19506 C11 PGR 518 50.140 96.465 56.202 1.00 0.00 C ATOM 19507 O12 PGR 518 50.797 95.573 56.719 1.00 0.00 O ATOM 19508 O11 PGR 518 49.513 97.494 56.820 1.00 0.00 O ATOM 19509 C1 PGR 518 49.624 97.572 58.254 1.00 0.00 C ATOM 19510 HR PGR 518 49.568 96.575 58.699 1.00 0.00 H ATOM 19511 HS PGR 518 48.840 98.283 58.528 1.00 0.00 H ATOM 19512 C2 PGR 518 50.993 98.245 58.781 1.00 0.00 C ATOM 19513 HX PGR 518 51.902 97.684 58.550 1.00 0.00 H ATOM 19514 C3 PGR 518 51.035 98.414 60.319 1.00 0.00 C ATOM 19515 HA PGR 518 51.747 99.201 60.583 1.00 0.00 H ATOM 19516 HB PGR 518 51.400 97.472 60.736 1.00 0.00 H ATOM 19517 O31 PGR 518 49.781 98.747 60.905 1.00 0.00 O ATOM 19518 P31 PGR 518 49.545 98.766 62.453 1.00 0.00 P ATOM 19519 O32 PGR 518 49.824 97.275 62.809 1.00 0.00 O ATOM 19520 C31 PGR 518 48.846 96.387 63.296 1.00 0.00 C ATOM 19521 H1A PGR 518 49.192 95.358 63.172 1.00 0.00 H ATOM 19522 H1B PGR 518 47.934 96.421 62.695 1.00 0.00 H ATOM 19523 C32 PGR 518 48.480 96.719 64.762 1.00 0.00 C ATOM 19524 H2A PGR 518 48.245 97.784 64.830 1.00 0.00 H ATOM 19525 O35 PGR 518 49.624 96.386 65.553 1.00 0.00 O ATOM 19526 HO5A PGR 518 50.133 97.200 65.715 1.00 0.00 H ATOM 19527 C33 PGR 518 47.321 95.864 65.319 1.00 0.00 C ATOM 19528 H3A PGR 518 46.555 95.740 64.549 1.00 0.00 H ATOM 19529 H3B PGR 518 47.719 94.856 65.460 1.00 0.00 H ATOM 19530 O33 PGR 518 50.570 99.617 63.060 1.00 0.00 O ATOM 19531 O34 PGR 518 48.151 99.088 62.708 1.00 0.00 O ATOM 19532 O21 PGR 518 51.057 99.563 58.110 1.00 0.00 O ATOM 19533 C21 PGR 518 50.115 100.516 58.264 1.00 0.00 C ATOM 19534 O22 PGR 518 49.074 100.467 58.880 1.00 0.00 O ATOM 19535 O36 PGR 518 46.754 96.372 66.584 1.00 0.00 O ATOM 19536 HO6A PGR 518 45.799 96.313 66.398 1.00 0.00 H ATOM 19537 C12 OL 519 50.518 101.721 57.449 1.00 0.00 C ATOM 19538 H2R OL 519 50.608 102.464 58.243 1.00 0.00 H ATOM 19539 H2S OL 519 51.532 101.680 57.047 1.00 0.00 H ATOM 19540 C13 OL 519 49.333 101.978 56.453 1.00 0.00 C ATOM 19541 H3R OL 519 49.529 101.313 55.609 1.00 0.00 H ATOM 19542 H3S OL 519 48.338 101.819 56.872 1.00 0.00 H ATOM 19543 C14 OL 519 49.322 103.339 55.746 1.00 0.00 C ATOM 19544 H4R OL 519 49.106 104.200 56.383 1.00 0.00 H ATOM 19545 H4S OL 519 50.289 103.551 55.285 1.00 0.00 H ATOM 19546 C15 OL 519 48.221 103.340 54.662 1.00 0.00 C ATOM 19547 H5R OL 519 48.582 102.735 53.828 1.00 0.00 H ATOM 19548 H5S OL 519 47.280 102.926 55.032 1.00 0.00 H ATOM 19549 C16 OL 519 47.907 104.652 54.079 1.00 0.00 C ATOM 19550 H6R OL 519 47.339 105.216 54.821 1.00 0.00 H ATOM 19551 H6S OL 519 48.882 105.098 53.874 1.00 0.00 H ATOM 19552 C17 OL 519 46.850 104.428 52.955 1.00 0.00 C ATOM 19553 H7R OL 519 47.201 103.727 52.195 1.00 0.00 H ATOM 19554 H7S OL 519 46.014 103.988 53.503 1.00 0.00 H ATOM 19555 C18 OL 519 46.531 105.643 52.164 1.00 0.00 C ATOM 19556 H8R OL 519 46.156 106.440 52.810 1.00 0.00 H ATOM 19557 H8S OL 519 47.405 106.131 51.729 1.00 0.00 H ATOM 19558 C19 OL 519 45.342 105.475 51.187 1.00 0.00 C ATOM 19559 H9R OL 519 44.370 105.536 51.668 1.00 0.00 H ATOM 19560 C110 OL 519 45.400 105.248 49.872 1.00 0.00 C ATOM 19561 H10R OL 519 44.540 105.279 49.207 1.00 0.00 H ATOM 19562 C111 OL 519 46.713 104.998 49.123 1.00 0.00 C ATOM 19563 H11R OL 519 47.584 104.960 49.780 1.00 0.00 H ATOM 19564 H11S OL 519 46.763 103.969 48.763 1.00 0.00 H ATOM 19565 C112 OL 519 47.055 105.859 47.883 1.00 0.00 C ATOM 19566 H12R OL 519 47.089 106.915 48.159 1.00 0.00 H ATOM 19567 H12S OL 519 48.003 105.479 47.499 1.00 0.00 H ATOM 19568 C113 OL 519 46.015 105.785 46.847 1.00 0.00 C ATOM 19569 H13R OL 519 45.049 106.116 47.231 1.00 0.00 H ATOM 19570 H13S OL 519 46.236 106.571 46.122 1.00 0.00 H ATOM 19571 C114 OL 519 46.026 104.496 46.056 1.00 0.00 C ATOM 19572 H14R OL 519 46.930 103.957 46.346 1.00 0.00 H ATOM 19573 H14S OL 519 45.294 103.756 46.388 1.00 0.00 H ATOM 19574 C115 OL 519 45.914 104.681 44.547 1.00 0.00 C ATOM 19575 H15R OL 519 46.671 105.399 44.223 1.00 0.00 H ATOM 19576 H15S OL 519 46.158 103.750 44.030 1.00 0.00 H ATOM 19577 C116 OL 519 44.525 105.071 43.999 1.00 0.00 C ATOM 19578 H16R OL 519 43.966 104.134 44.033 1.00 0.00 H ATOM 19579 H16S OL 519 44.041 105.731 44.723 1.00 0.00 H ATOM 19580 C117 OL 519 44.532 105.411 42.512 1.00 0.00 C ATOM 19581 H17R OL 519 43.593 105.909 42.261 1.00 0.00 H ATOM 19582 H17S OL 519 45.412 105.981 42.206 1.00 0.00 H ATOM 19583 C118 OL 519 44.478 104.181 41.501 1.00 0.00 C ATOM 19584 H18R OL 519 43.532 103.654 41.638 1.00 0.00 H ATOM 19585 H18S OL 519 45.337 103.507 41.520 1.00 0.00 H ATOM 19586 H18T OL 519 44.515 104.582 40.486 1.00 0.00 H TER 19587 OL 519 ATOM 19587 C116 PA 520 75.504 31.270 42.967 1.00 0.00 C ATOM 19588 H16R PA 520 74.846 30.840 43.724 1.00 0.00 H ATOM 19589 H16S PA 520 76.428 31.510 43.497 1.00 0.00 H ATOM 19590 H16T PA 520 75.706 30.396 42.344 1.00 0.00 H ATOM 19591 C115 PA 520 74.770 32.403 42.378 1.00 0.00 C ATOM 19592 H15R PA 520 75.531 33.042 41.925 1.00 0.00 H ATOM 19593 H15S PA 520 74.219 32.958 43.140 1.00 0.00 H ATOM 19594 C114 PA 520 73.759 32.087 41.335 1.00 0.00 C ATOM 19595 H14R PA 520 74.349 31.362 40.772 1.00 0.00 H ATOM 19596 H14S PA 520 73.547 32.931 40.676 1.00 0.00 H ATOM 19597 C113 PA 520 72.502 31.315 41.633 1.00 0.00 C ATOM 19598 H13R PA 520 72.674 30.263 41.867 1.00 0.00 H ATOM 19599 H13S PA 520 71.863 31.130 40.767 1.00 0.00 H ATOM 19600 C112 PA 520 71.703 31.798 42.755 1.00 0.00 C ATOM 19601 H12R PA 520 71.779 32.878 42.607 1.00 0.00 H ATOM 19602 H12S PA 520 72.256 31.493 43.646 1.00 0.00 H ATOM 19603 C111 PA 520 70.336 31.277 42.839 1.00 0.00 C ATOM 19604 H11R PA 520 70.250 30.213 43.072 1.00 0.00 H ATOM 19605 H11S PA 520 69.960 31.441 41.827 1.00 0.00 H ATOM 19606 C110 PA 520 69.448 32.009 43.881 1.00 0.00 C ATOM 19607 H10R PA 520 69.408 32.976 43.374 1.00 0.00 H ATOM 19608 H10S PA 520 69.975 32.047 44.837 1.00 0.00 H ATOM 19609 C19 PA 520 67.980 31.592 44.031 1.00 0.00 C ATOM 19610 H9R PA 520 67.928 30.625 44.536 1.00 0.00 H ATOM 19611 H9S PA 520 67.580 31.349 43.045 1.00 0.00 H ATOM 19612 C18 PA 520 66.997 32.529 44.833 1.00 0.00 C ATOM 19613 H8R PA 520 66.009 32.252 44.459 1.00 0.00 H ATOM 19614 H8S PA 520 67.178 33.568 44.547 1.00 0.00 H ATOM 19615 C17 PA 520 67.160 32.457 46.392 1.00 0.00 C ATOM 19616 H7R PA 520 68.168 32.506 46.810 1.00 0.00 H ATOM 19617 H7S PA 520 66.945 31.434 46.709 1.00 0.00 H ATOM 19618 C16 PA 520 66.315 33.350 47.143 1.00 0.00 C ATOM 19619 H6R PA 520 65.275 33.247 46.827 1.00 0.00 H ATOM 19620 H6S PA 520 66.587 34.350 46.797 1.00 0.00 H ATOM 19621 C15 PA 520 66.276 33.134 48.655 1.00 0.00 C ATOM 19622 H5R PA 520 67.250 33.069 49.146 1.00 0.00 H ATOM 19623 H5S PA 520 65.749 32.181 48.729 1.00 0.00 H ATOM 19624 C14 PA 520 65.341 34.157 49.334 1.00 0.00 C ATOM 19625 H4R PA 520 64.423 34.117 48.744 1.00 0.00 H ATOM 19626 H4S PA 520 65.781 35.155 49.396 1.00 0.00 H ATOM 19627 C13 PA 520 64.856 33.818 50.748 1.00 0.00 C ATOM 19628 H3R PA 520 64.806 32.740 50.916 1.00 0.00 H ATOM 19629 H3S PA 520 63.825 34.166 50.833 1.00 0.00 H ATOM 19630 C12 PA 520 65.620 34.470 51.905 1.00 0.00 C ATOM 19631 H2R PA 520 65.782 35.536 51.731 1.00 0.00 H ATOM 19632 H2S PA 520 66.565 33.931 51.808 1.00 0.00 H ATOM 19633 C11 PGR 521 65.038 34.275 53.273 1.00 0.00 C ATOM 19634 O12 PGR 521 65.713 33.852 54.227 1.00 0.00 O ATOM 19635 O11 PGR 521 63.689 34.458 53.311 1.00 0.00 O ATOM 19636 C1 PGR 521 62.786 34.232 54.404 1.00 0.00 C ATOM 19637 HR PGR 521 61.863 34.764 54.158 1.00 0.00 H ATOM 19638 HS PGR 521 63.175 34.712 55.306 1.00 0.00 H ATOM 19639 C2 PGR 521 62.551 32.792 54.598 1.00 0.00 C ATOM 19640 HX PGR 521 61.678 32.619 55.233 1.00 0.00 H ATOM 19641 C3 PGR 521 63.771 32.045 55.287 1.00 0.00 C ATOM 19642 HA PGR 521 64.241 32.678 56.044 1.00 0.00 H ATOM 19643 HB PGR 521 64.501 31.875 54.491 1.00 0.00 H ATOM 19644 O31 PGR 521 63.386 30.703 55.680 1.00 0.00 O ATOM 19645 P31 PGR 521 62.475 30.486 57.050 1.00 0.00 P ATOM 19646 O32 PGR 521 60.954 30.436 56.494 1.00 0.00 O ATOM 19647 C31 PGR 521 60.264 29.257 56.455 1.00 0.00 C ATOM 19648 H1A PGR 521 60.176 28.749 57.419 1.00 0.00 H ATOM 19649 H1B PGR 521 60.821 28.610 55.771 1.00 0.00 H ATOM 19650 C32 PGR 521 58.863 29.590 55.939 1.00 0.00 C ATOM 19651 H2A PGR 521 58.879 30.069 54.956 1.00 0.00 H ATOM 19652 O35 PGR 521 58.344 30.637 56.779 1.00 0.00 O ATOM 19653 HO5A PGR 521 58.896 31.421 56.606 1.00 0.00 H ATOM 19654 C33 PGR 521 57.896 28.289 55.933 1.00 0.00 C ATOM 19655 H3A PGR 521 57.013 28.393 55.297 1.00 0.00 H ATOM 19656 H3B PGR 521 58.482 27.410 55.654 1.00 0.00 H ATOM 19657 O33 PGR 521 62.889 29.144 57.588 1.00 0.00 O ATOM 19658 O34 PGR 521 62.683 31.674 57.886 1.00 0.00 O ATOM 19659 O21 PGR 521 62.266 32.139 53.345 1.00 0.00 O ATOM 19660 C21 PGR 521 61.145 32.418 52.612 1.00 0.00 C ATOM 19661 O22 PGR 521 60.284 33.244 53.070 1.00 0.00 O ATOM 19662 O36 PGR 521 57.446 28.113 57.291 1.00 0.00 O ATOM 19663 HO6A PGR 521 56.622 27.603 57.188 1.00 0.00 H ATOM 19664 C12 OL 522 61.098 31.685 51.302 1.00 0.00 C ATOM 19665 H2R OL 522 62.062 31.217 51.096 1.00 0.00 H ATOM 19666 H2S OL 522 60.309 30.936 51.395 1.00 0.00 H ATOM 19667 C13 OL 522 60.768 32.589 50.188 1.00 0.00 C ATOM 19668 H3R OL 522 59.723 32.899 50.245 1.00 0.00 H ATOM 19669 H3S OL 522 61.409 33.466 50.305 1.00 0.00 H ATOM 19670 C14 OL 522 60.969 31.916 48.851 1.00 0.00 C ATOM 19671 H4R OL 522 62.042 31.718 48.802 1.00 0.00 H ATOM 19672 H4S OL 522 60.391 30.990 48.800 1.00 0.00 H ATOM 19673 C15 OL 522 60.573 32.794 47.672 1.00 0.00 C ATOM 19674 H5R OL 522 59.508 33.027 47.737 1.00 0.00 H ATOM 19675 H5S OL 522 61.026 33.787 47.708 1.00 0.00 H ATOM 19676 C16 OL 522 60.830 32.255 46.256 1.00 0.00 C ATOM 19677 H6R OL 522 61.899 32.072 46.127 1.00 0.00 H ATOM 19678 H6S OL 522 60.293 31.319 46.087 1.00 0.00 H ATOM 19679 C17 OL 522 60.537 33.323 45.100 1.00 0.00 C ATOM 19680 H7R OL 522 59.483 33.354 44.813 1.00 0.00 H ATOM 19681 H7S OL 522 60.895 34.278 45.490 1.00 0.00 H ATOM 19682 C18 OL 522 61.145 33.100 43.813 1.00 0.00 C ATOM 19683 H8R OL 522 61.139 33.947 43.124 1.00 0.00 H ATOM 19684 H8S OL 522 62.235 33.052 43.793 1.00 0.00 H ATOM 19685 C19 OL 522 60.557 31.916 43.117 1.00 0.00 C ATOM 19686 H9R OL 522 59.577 31.584 43.451 1.00 0.00 H ATOM 19687 C110 OL 522 61.196 31.187 42.237 1.00 0.00 C ATOM 19688 H10R OL 522 60.635 30.328 41.879 1.00 0.00 H ATOM 19689 C111 OL 522 62.578 31.257 41.762 1.00 0.00 C ATOM 19690 H11R OL 522 62.520 31.590 40.723 1.00 0.00 H ATOM 19691 H11S OL 522 63.159 31.899 42.426 1.00 0.00 H ATOM 19692 C112 OL 522 63.030 29.806 41.964 1.00 0.00 C ATOM 19693 H12R OL 522 62.750 29.384 42.931 1.00 0.00 H ATOM 19694 H12S OL 522 62.466 29.083 41.370 1.00 0.00 H ATOM 19695 C113 OL 522 64.479 29.785 41.858 1.00 0.00 C ATOM 19696 H13R OL 522 64.868 30.122 40.895 1.00 0.00 H ATOM 19697 H13S OL 522 64.877 30.390 42.675 1.00 0.00 H ATOM 19698 C114 OL 522 65.056 28.353 41.991 1.00 0.00 C ATOM 19699 H14R OL 522 64.720 27.891 42.922 1.00 0.00 H ATOM 19700 H14S OL 522 64.749 27.633 41.229 1.00 0.00 H ATOM 19701 C115 OL 522 66.617 28.450 41.984 1.00 0.00 C ATOM 19702 H15R OL 522 66.847 28.978 41.057 1.00 0.00 H ATOM 19703 H15S OL 522 67.070 29.107 42.730 1.00 0.00 H ATOM 19704 C116 OL 522 67.268 27.115 42.113 1.00 0.00 C ATOM 19705 H16R OL 522 67.010 26.642 43.063 1.00 0.00 H ATOM 19706 H16S OL 522 66.902 26.397 41.375 1.00 0.00 H ATOM 19707 C117 OL 522 68.766 27.163 42.040 1.00 0.00 C ATOM 19708 H17R OL 522 69.075 27.535 41.060 1.00 0.00 H ATOM 19709 H17S OL 522 69.205 27.893 42.723 1.00 0.00 H ATOM 19710 C118 OL 522 69.461 25.777 42.177 1.00 0.00 C ATOM 19711 H18R OL 522 69.464 25.380 43.195 1.00 0.00 H ATOM 19712 H18S OL 522 70.482 25.796 41.789 1.00 0.00 H ATOM 19713 H18T OL 522 68.901 25.087 41.543 1.00 0.00 H TER 19714 OL 522 ATOM 19714 C116 PA 523 101.312 12.256 35.613 1.00 0.00 C ATOM 19715 H16R PA 523 100.893 12.913 36.378 1.00 0.00 H ATOM 19716 H16S PA 523 100.510 11.610 35.250 1.00 0.00 H ATOM 19717 H16T PA 523 101.663 12.902 34.805 1.00 0.00 H ATOM 19718 C115 PA 523 102.532 11.556 36.094 1.00 0.00 C ATOM 19719 H15R PA 523 103.261 12.334 36.329 1.00 0.00 H ATOM 19720 H15S PA 523 103.021 10.826 35.446 1.00 0.00 H ATOM 19721 C114 PA 523 102.222 10.917 37.368 1.00 0.00 C ATOM 19722 H14R PA 523 101.440 10.155 37.400 1.00 0.00 H ATOM 19723 H14S PA 523 101.867 11.718 38.020 1.00 0.00 H ATOM 19724 C113 PA 523 103.410 10.386 38.095 1.00 0.00 C ATOM 19725 H13R PA 523 103.812 11.173 38.736 1.00 0.00 H ATOM 19726 H13S PA 523 104.144 9.951 37.413 1.00 0.00 H ATOM 19727 C112 PA 523 103.053 9.179 38.955 1.00 0.00 C ATOM 19728 H12R PA 523 102.557 8.428 38.336 1.00 0.00 H ATOM 19729 H12S PA 523 102.197 9.372 39.606 1.00 0.00 H ATOM 19730 C111 PA 523 104.242 8.537 39.770 1.00 0.00 C ATOM 19731 H11R PA 523 104.833 9.358 40.183 1.00 0.00 H ATOM 19732 H11S PA 523 104.921 8.138 39.013 1.00 0.00 H ATOM 19733 C110 PA 523 103.992 7.501 40.829 1.00 0.00 C ATOM 19734 H10R PA 523 103.322 6.716 40.472 1.00 0.00 H ATOM 19735 H10S PA 523 103.453 7.971 41.653 1.00 0.00 H ATOM 19736 C19 PA 523 105.281 6.828 41.394 1.00 0.00 C ATOM 19737 H9R PA 523 106.038 7.554 41.699 1.00 0.00 H ATOM 19738 H9S PA 523 105.704 6.096 40.704 1.00 0.00 H ATOM 19739 C18 PA 523 105.077 5.888 42.627 1.00 0.00 C ATOM 19740 H8R PA 523 105.127 6.393 43.594 1.00 0.00 H ATOM 19741 H8S PA 523 105.949 5.233 42.689 1.00 0.00 H ATOM 19742 C17 PA 523 103.849 4.986 42.579 1.00 0.00 C ATOM 19743 H7R PA 523 103.857 4.399 41.659 1.00 0.00 H ATOM 19744 H7S PA 523 102.903 5.496 42.770 1.00 0.00 H ATOM 19745 C16 PA 523 103.929 3.941 43.661 1.00 0.00 C ATOM 19746 H6R PA 523 103.069 3.310 43.430 1.00 0.00 H ATOM 19747 H6S PA 523 103.763 4.466 44.603 1.00 0.00 H ATOM 19748 C15 PA 523 105.156 2.974 43.782 1.00 0.00 C ATOM 19749 H5R PA 523 106.077 3.478 44.083 1.00 0.00 H ATOM 19750 H5S PA 523 105.360 2.513 42.813 1.00 0.00 H ATOM 19751 C14 PA 523 104.982 1.891 44.767 1.00 0.00 C ATOM 19752 H4R PA 523 105.760 1.140 44.618 1.00 0.00 H ATOM 19753 H4S PA 523 104.085 1.282 44.633 1.00 0.00 H ATOM 19754 C13 PA 523 104.857 2.363 46.170 1.00 0.00 C ATOM 19755 H3R PA 523 103.901 2.842 46.387 1.00 0.00 H ATOM 19756 H3S PA 523 105.693 3.038 46.366 1.00 0.00 H ATOM 19757 C12 PA 523 104.994 1.203 47.197 1.00 0.00 C ATOM 19758 H2R PA 523 105.893 0.597 47.061 1.00 0.00 H ATOM 19759 H2S PA 523 104.196 0.464 47.100 1.00 0.00 H ATOM 19760 C11 PGR 524 104.927 1.661 48.658 1.00 0.00 C ATOM 19761 O12 PGR 524 105.774 2.337 49.240 1.00 0.00 O ATOM 19762 O11 PGR 524 103.696 1.159 49.202 1.00 0.00 O ATOM 19763 C1 PGR 524 103.430 1.280 50.623 1.00 0.00 C ATOM 19764 HR PGR 524 104.381 1.242 51.159 1.00 0.00 H ATOM 19765 HS PGR 524 102.858 0.422 50.986 1.00 0.00 H ATOM 19766 C2 PGR 524 102.823 2.701 50.796 1.00 0.00 C ATOM 19767 HX PGR 524 103.522 3.361 50.277 1.00 0.00 H ATOM 19768 C3 PGR 524 102.592 3.236 52.221 1.00 0.00 C ATOM 19769 HA PGR 524 103.468 3.023 52.840 1.00 0.00 H ATOM 19770 HB PGR 524 101.767 2.740 52.739 1.00 0.00 H ATOM 19771 O31 PGR 524 102.290 4.608 52.163 1.00 0.00 O ATOM 19772 P31 PGR 524 101.825 5.502 53.369 1.00 0.00 P ATOM 19773 O32 PGR 524 100.356 4.965 53.626 1.00 0.00 O ATOM 19774 C31 PGR 524 99.298 5.085 52.709 1.00 0.00 C ATOM 19775 H1A PGR 524 99.467 4.224 52.057 1.00 0.00 H ATOM 19776 H1B PGR 524 99.379 5.934 52.025 1.00 0.00 H ATOM 19777 C32 PGR 524 97.885 5.025 53.307 1.00 0.00 C ATOM 19778 H2A PGR 524 97.226 5.017 52.435 1.00 0.00 H ATOM 19779 O35 PGR 524 97.646 6.231 54.110 1.00 0.00 O ATOM 19780 HO5A PGR 524 97.697 6.989 53.500 1.00 0.00 H ATOM 19781 C33 PGR 524 97.607 3.802 54.219 1.00 0.00 C ATOM 19782 H3A PGR 524 97.980 2.939 53.662 1.00 0.00 H ATOM 19783 H3B PGR 524 98.198 3.848 55.137 1.00 0.00 H ATOM 19784 O33 PGR 524 102.578 5.085 54.624 1.00 0.00 O ATOM 19785 O34 PGR 524 101.727 6.950 52.990 1.00 0.00 O ATOM 19786 O21 PGR 524 101.560 2.734 50.145 1.00 0.00 O ATOM 19787 C21 PGR 524 101.484 3.154 48.864 1.00 0.00 C ATOM 19788 O22 PGR 524 102.342 3.804 48.312 1.00 0.00 O ATOM 19789 O36 PGR 524 96.226 3.564 54.476 1.00 0.00 O ATOM 19790 HO6A PGR 524 95.884 4.403 54.832 1.00 0.00 H ATOM 19791 C12 OL 525 100.177 2.865 48.251 1.00 0.00 C ATOM 19792 H2R OL 525 100.245 2.463 47.238 1.00 0.00 H ATOM 19793 H2S OL 525 99.684 2.026 48.745 1.00 0.00 H ATOM 19794 C13 OL 525 99.252 4.041 48.347 1.00 0.00 C ATOM 19795 H3R OL 525 99.022 4.386 49.357 1.00 0.00 H ATOM 19796 H3S OL 525 99.737 4.922 47.922 1.00 0.00 H ATOM 19797 C14 OL 525 97.911 3.802 47.631 1.00 0.00 C ATOM 19798 H4R OL 525 97.389 2.984 48.131 1.00 0.00 H ATOM 19799 H4S OL 525 97.210 4.618 47.821 1.00 0.00 H ATOM 19800 C15 OL 525 98.015 3.452 46.127 1.00 0.00 C ATOM 19801 H5R OL 525 98.549 2.510 45.987 1.00 0.00 H ATOM 19802 H5S OL 525 97.034 3.354 45.658 1.00 0.00 H ATOM 19803 C16 OL 525 98.759 4.511 45.353 1.00 0.00 C ATOM 19804 H6R OL 525 98.185 5.440 45.368 1.00 0.00 H ATOM 19805 H6S OL 525 99.711 4.850 45.768 1.00 0.00 H ATOM 19806 C17 OL 525 98.943 4.005 43.969 1.00 0.00 C ATOM 19807 H7R OL 525 99.553 3.099 43.972 1.00 0.00 H ATOM 19808 H7S OL 525 97.963 3.661 43.631 1.00 0.00 H ATOM 19809 C18 OL 525 99.550 5.054 43.010 1.00 0.00 C ATOM 19810 H8R OL 525 98.937 5.958 43.038 1.00 0.00 H ATOM 19811 H8S OL 525 100.474 5.384 43.489 1.00 0.00 H ATOM 19812 C19 OL 525 99.904 4.564 41.652 1.00 0.00 C ATOM 19813 H9R OL 525 100.096 3.510 41.468 1.00 0.00 H ATOM 19814 C110 OL 525 100.052 5.372 40.583 1.00 0.00 C ATOM 19815 H10R OL 525 100.493 4.901 39.709 1.00 0.00 H ATOM 19816 C111 OL 525 99.943 6.899 40.527 1.00 0.00 C ATOM 19817 H11R OL 525 99.752 7.339 41.508 1.00 0.00 H ATOM 19818 H11S OL 525 100.901 7.387 40.336 1.00 0.00 H ATOM 19819 C112 OL 525 98.978 7.512 39.537 1.00 0.00 C ATOM 19820 H12R OL 525 99.045 7.107 38.525 1.00 0.00 H ATOM 19821 H12S OL 525 97.926 7.365 39.790 1.00 0.00 H ATOM 19822 C113 OL 525 99.272 8.985 39.303 1.00 0.00 C ATOM 19823 H13R OL 525 99.161 9.476 40.272 1.00 0.00 H ATOM 19824 H13S OL 525 100.320 9.213 39.097 1.00 0.00 H ATOM 19825 C114 OL 525 98.388 9.820 38.397 1.00 0.00 C ATOM 19826 H14R OL 525 98.719 10.858 38.479 1.00 0.00 H ATOM 19827 H14S OL 525 98.633 9.546 37.369 1.00 0.00 H ATOM 19828 C115 OL 525 96.944 9.714 38.666 1.00 0.00 C ATOM 19829 H15R OL 525 96.606 8.676 38.680 1.00 0.00 H ATOM 19830 H15S OL 525 96.889 10.123 39.677 1.00 0.00 H ATOM 19831 C116 OL 525 96.268 10.688 37.702 1.00 0.00 C ATOM 19832 H16R OL 525 96.763 11.659 37.638 1.00 0.00 H ATOM 19833 H16S OL 525 96.309 10.280 36.690 1.00 0.00 H ATOM 19834 C117 OL 525 94.805 10.925 38.039 1.00 0.00 C ATOM 19835 H17R OL 525 94.588 11.437 38.979 1.00 0.00 H ATOM 19836 H17S OL 525 94.397 11.457 37.177 1.00 0.00 H ATOM 19837 C118 OL 525 93.902 9.710 37.978 1.00 0.00 C ATOM 19838 H18R OL 525 94.224 9.024 38.764 1.00 0.00 H ATOM 19839 H18S OL 525 93.994 9.310 36.966 1.00 0.00 H ATOM 19840 H18T OL 525 92.842 9.804 38.223 1.00 0.00 H TER 19841 OL 525 ATOM 19841 C116 PA 526 67.039 19.468 40.810 1.00 0.00 C ATOM 19842 H16R PA 526 66.212 19.899 41.378 1.00 0.00 H ATOM 19843 H16S PA 526 66.755 18.526 40.337 1.00 0.00 H ATOM 19844 H16T PA 526 67.309 20.221 40.066 1.00 0.00 H ATOM 19845 C115 PA 526 68.300 19.243 41.622 1.00 0.00 C ATOM 19846 H15R PA 526 68.490 20.289 41.871 1.00 0.00 H ATOM 19847 H15S PA 526 69.011 18.926 40.856 1.00 0.00 H ATOM 19848 C114 PA 526 68.240 18.385 42.882 1.00 0.00 C ATOM 19849 H14R PA 526 69.257 18.289 43.267 1.00 0.00 H ATOM 19850 H14S PA 526 68.023 17.333 42.689 1.00 0.00 H ATOM 19851 C113 PA 526 67.293 18.813 43.976 1.00 0.00 C ATOM 19852 H13R PA 526 66.861 17.928 44.447 1.00 0.00 H ATOM 19853 H13S PA 526 66.460 19.307 43.470 1.00 0.00 H ATOM 19854 C112 PA 526 67.940 19.638 45.056 1.00 0.00 C ATOM 19855 H12R PA 526 68.634 19.024 45.634 1.00 0.00 H ATOM 19856 H12S PA 526 67.043 19.833 45.647 1.00 0.00 H ATOM 19857 C111 PA 526 68.555 20.955 44.636 1.00 0.00 C ATOM 19858 H11R PA 526 68.042 21.525 43.859 1.00 0.00 H ATOM 19859 H11S PA 526 69.561 20.708 44.291 1.00 0.00 H ATOM 19860 C110 PA 526 68.661 21.919 45.822 1.00 0.00 C ATOM 19861 H10R PA 526 67.670 22.286 46.096 1.00 0.00 H ATOM 19862 H10S PA 526 69.162 22.818 45.459 1.00 0.00 H ATOM 19863 C19 PA 526 69.388 21.507 47.121 1.00 0.00 C ATOM 19864 H9R PA 526 69.004 20.599 47.592 1.00 0.00 H ATOM 19865 H9S PA 526 69.239 22.264 47.893 1.00 0.00 H ATOM 19866 C18 PA 526 70.972 21.191 46.896 1.00 0.00 C ATOM 19867 H8R PA 526 71.404 21.823 47.675 1.00 0.00 H ATOM 19868 H8S PA 526 71.153 21.711 45.952 1.00 0.00 H ATOM 19869 C17 PA 526 71.298 19.752 46.987 1.00 0.00 C ATOM 19870 H7R PA 526 70.700 19.212 46.249 1.00 0.00 H ATOM 19871 H7S PA 526 70.954 19.424 47.971 1.00 0.00 H ATOM 19872 C16 PA 526 72.787 19.502 46.863 1.00 0.00 C ATOM 19873 H6R PA 526 73.416 19.868 47.677 1.00 0.00 H ATOM 19874 H6S PA 526 73.232 20.079 46.050 1.00 0.00 H ATOM 19875 C15 PA 526 73.016 18.030 46.647 1.00 0.00 C ATOM 19876 H5R PA 526 74.090 17.830 46.641 1.00 0.00 H ATOM 19877 H5S PA 526 72.786 17.815 45.601 1.00 0.00 H ATOM 19878 C14 PA 526 72.526 17.050 47.734 1.00 0.00 C ATOM 19879 H4R PA 526 71.440 16.964 47.663 1.00 0.00 H ATOM 19880 H4S PA 526 72.709 17.496 48.714 1.00 0.00 H ATOM 19881 C13 PA 526 73.185 15.675 47.725 1.00 0.00 C ATOM 19882 H3R PA 526 74.250 15.880 47.851 1.00 0.00 H ATOM 19883 H3S PA 526 73.152 15.131 46.779 1.00 0.00 H ATOM 19884 C12 PA 526 72.776 14.710 48.861 1.00 0.00 C ATOM 19885 H2R PA 526 73.466 13.915 48.571 1.00 0.00 H ATOM 19886 H2S PA 526 71.758 14.333 48.748 1.00 0.00 H ATOM 19887 C11 PC 527 72.999 14.974 50.276 1.00 0.00 C ATOM 19888 O12 PC 527 73.320 16.005 50.775 1.00 0.00 O ATOM 19889 O11 PC 527 72.731 13.870 50.952 1.00 0.00 O ATOM 19890 C1 PC 527 72.979 13.804 52.436 1.00 0.00 C ATOM 19891 HR PC 527 72.131 14.319 52.896 1.00 0.00 H ATOM 19892 HS PC 527 73.968 14.249 52.569 1.00 0.00 H ATOM 19893 C2 PC 527 73.214 12.265 52.786 1.00 0.00 C ATOM 19894 HX PC 527 72.485 11.591 52.330 1.00 0.00 H ATOM 19895 C3 PC 527 72.872 12.131 54.272 1.00 0.00 C ATOM 19896 HA PC 527 72.990 11.095 54.599 1.00 0.00 H ATOM 19897 HB PC 527 71.828 12.430 54.394 1.00 0.00 H ATOM 19898 O31 PC 527 73.622 13.078 55.076 1.00 0.00 O ATOM 19899 P31 PC 527 73.361 13.290 56.589 1.00 0.00 P ATOM 19900 O32 PC 527 73.907 12.087 57.351 1.00 0.00 O ATOM 19901 C31 PC 527 75.296 11.929 57.606 1.00 0.00 C ATOM 19902 H1A PC 527 75.735 12.751 58.179 1.00 0.00 H ATOM 19903 H1B PC 527 75.806 11.960 56.640 1.00 0.00 H ATOM 19904 C32 PC 527 75.602 10.613 58.478 1.00 0.00 C ATOM 19905 H2A PC 527 74.790 10.544 59.203 1.00 0.00 H ATOM 19906 H2B PC 527 76.493 10.769 59.087 1.00 0.00 H ATOM 19907 N31 PC 527 75.653 9.209 57.824 1.00 0.00 N ATOM 19908 C33 PC 527 76.523 9.110 56.647 1.00 0.00 C ATOM 19909 H3A PC 527 76.326 9.885 55.904 1.00 0.00 H ATOM 19910 H3B PC 527 76.348 8.137 56.186 1.00 0.00 H ATOM 19911 H3C PC 527 77.575 9.171 56.932 1.00 0.00 H ATOM 19912 C34 PC 527 76.071 8.116 58.692 1.00 0.00 C ATOM 19913 H4A PC 527 77.119 8.228 58.975 1.00 0.00 H ATOM 19914 H4B PC 527 75.949 7.164 58.172 1.00 0.00 H ATOM 19915 H4C PC 527 75.432 8.128 59.576 1.00 0.00 H ATOM 19916 C35 PC 527 74.211 8.874 57.546 1.00 0.00 C ATOM 19917 H5A PC 527 73.584 8.990 58.431 1.00 0.00 H ATOM 19918 H5B PC 527 74.159 7.869 57.126 1.00 0.00 H ATOM 19919 H5C PC 527 73.839 9.582 56.804 1.00 0.00 H ATOM 19920 O33 PC 527 74.106 14.489 57.010 1.00 0.00 O ATOM 19921 O34 PC 527 71.905 13.199 56.823 1.00 0.00 O ATOM 19922 O21 PC 527 74.567 11.851 52.514 1.00 0.00 O ATOM 19923 C21 PC 527 74.961 10.615 52.849 1.00 0.00 C ATOM 19924 O22 PC 527 74.243 9.731 53.213 1.00 0.00 O ATOM 19925 C12 OL 528 76.506 10.478 52.776 1.00 0.00 C ATOM 19926 H2R OL 528 76.886 11.118 51.977 1.00 0.00 H ATOM 19927 H2S OL 528 77.015 10.893 53.648 1.00 0.00 H ATOM 19928 C13 OL 528 76.874 8.987 52.720 1.00 0.00 C ATOM 19929 H3R OL 528 76.688 8.406 53.626 1.00 0.00 H ATOM 19930 H3S OL 528 76.324 8.624 51.849 1.00 0.00 H ATOM 19931 C14 OL 528 78.432 8.682 52.471 1.00 0.00 C ATOM 19932 H4R OL 528 78.742 9.242 51.586 1.00 0.00 H ATOM 19933 H4S OL 528 78.952 9.157 53.305 1.00 0.00 H ATOM 19934 C15 OL 528 78.707 7.170 52.210 1.00 0.00 C ATOM 19935 H5R OL 528 78.225 6.671 53.054 1.00 0.00 H ATOM 19936 H5S OL 528 78.171 6.895 51.299 1.00 0.00 H ATOM 19937 C16 OL 528 80.161 6.755 52.251 1.00 0.00 C ATOM 19938 H6R OL 528 80.640 7.394 52.996 1.00 0.00 H ATOM 19939 H6S OL 528 80.204 5.699 52.525 1.00 0.00 H ATOM 19940 C17 OL 528 80.969 6.899 50.870 1.00 0.00 C ATOM 19941 H7R OL 528 80.717 6.005 50.296 1.00 0.00 H ATOM 19942 H7S OL 528 80.728 7.795 50.296 1.00 0.00 H ATOM 19943 C18 OL 528 82.539 6.995 51.097 1.00 0.00 C ATOM 19944 H8R OL 528 82.747 7.729 51.877 1.00 0.00 H ATOM 19945 H8S OL 528 82.913 6.078 51.557 1.00 0.00 H ATOM 19946 C19 OL 528 83.314 7.392 49.859 1.00 0.00 C ATOM 19947 H9R OL 528 83.282 8.462 49.666 1.00 0.00 H ATOM 19948 C110 OL 528 84.000 6.669 48.984 1.00 0.00 C ATOM 19949 H10R OL 528 84.104 7.140 48.010 1.00 0.00 H ATOM 19950 C111 OL 528 84.245 5.137 49.104 1.00 0.00 C ATOM 19951 H11R OL 528 85.310 4.940 49.244 1.00 0.00 H ATOM 19952 H11S OL 528 83.732 4.750 49.986 1.00 0.00 H ATOM 19953 C112 OL 528 83.891 4.139 47.956 1.00 0.00 C ATOM 19954 H12R OL 528 82.817 3.958 47.878 1.00 0.00 H ATOM 19955 H12S OL 528 84.271 4.445 46.979 1.00 0.00 H ATOM 19956 C113 OL 528 84.450 2.756 48.265 1.00 0.00 C ATOM 19957 H13R OL 528 85.540 2.821 48.299 1.00 0.00 H ATOM 19958 H13S OL 528 84.076 2.514 49.262 1.00 0.00 H ATOM 19959 C114 OL 528 84.161 1.627 47.216 1.00 0.00 C ATOM 19960 H14R OL 528 83.182 1.221 47.480 1.00 0.00 H ATOM 19961 H14S OL 528 83.956 2.023 46.219 1.00 0.00 H ATOM 19962 C115 OL 528 85.294 0.609 47.167 1.00 0.00 C ATOM 19963 H15R OL 528 84.958 -0.094 46.402 1.00 0.00 H ATOM 19964 H15S OL 528 86.209 1.126 46.869 1.00 0.00 H ATOM 19965 C116 OL 528 85.605 -0.121 48.475 1.00 0.00 C ATOM 19966 H16R OL 528 86.390 -0.857 48.291 1.00 0.00 H ATOM 19967 H16S OL 528 86.035 0.642 49.127 1.00 0.00 H ATOM 19968 C117 OL 528 84.471 -0.932 49.087 1.00 0.00 C ATOM 19969 H17R OL 528 83.694 -0.165 49.127 1.00 0.00 H ATOM 19970 H17S OL 528 84.084 -1.592 48.308 1.00 0.00 H ATOM 19971 C118 OL 528 84.969 -1.667 50.397 1.00 0.00 C ATOM 19972 H18R OL 528 85.758 -2.406 50.247 1.00 0.00 H ATOM 19973 H18S OL 528 84.147 -2.237 50.836 1.00 0.00 H ATOM 19974 H18T OL 528 85.268 -0.894 51.108 1.00 0.00 H TER 19975 OL 528 ATOM 19975 C116 PA 529 103.210 124.508 46.023 1.00 0.00 C ATOM 19976 H16R PA 529 103.850 123.771 45.534 1.00 0.00 H ATOM 19977 H16S PA 529 103.760 125.400 46.330 1.00 0.00 H ATOM 19978 H16T PA 529 102.504 124.767 45.232 1.00 0.00 H ATOM 19979 C115 PA 529 102.651 123.858 47.224 1.00 0.00 C ATOM 19980 H15R PA 529 102.325 124.696 47.844 1.00 0.00 H ATOM 19981 H15S PA 529 103.445 123.388 47.808 1.00 0.00 H ATOM 19982 C114 PA 529 101.338 123.026 47.051 1.00 0.00 C ATOM 19983 H14R PA 529 101.494 122.362 46.198 1.00 0.00 H ATOM 19984 H14S PA 529 100.506 123.662 46.741 1.00 0.00 H ATOM 19985 C113 PA 529 101.047 122.212 48.340 1.00 0.00 C ATOM 19986 H13R PA 529 101.903 121.619 48.667 1.00 0.00 H ATOM 19987 H13S PA 529 100.347 121.402 48.123 1.00 0.00 H ATOM 19988 C112 PA 529 100.554 123.016 49.487 1.00 0.00 C ATOM 19989 H12R PA 529 99.787 123.769 49.290 1.00 0.00 H ATOM 19990 H12S PA 529 101.414 123.608 49.807 1.00 0.00 H ATOM 19991 C111 PA 529 100.106 122.233 50.740 1.00 0.00 C ATOM 19992 H11R PA 529 99.039 122.004 50.752 1.00 0.00 H ATOM 19993 H11S PA 529 100.241 122.902 51.593 1.00 0.00 H ATOM 19994 C110 PA 529 100.832 120.938 50.992 1.00 0.00 C ATOM 19995 H10R PA 529 101.886 121.077 50.744 1.00 0.00 H ATOM 19996 H10S PA 529 100.480 120.151 50.322 1.00 0.00 H ATOM 19997 C19 PA 529 100.721 120.429 52.380 1.00 0.00 C ATOM 19998 H9R PA 529 99.686 120.103 52.502 1.00 0.00 H ATOM 19999 H9S PA 529 100.980 121.205 53.103 1.00 0.00 H ATOM 20000 C18 PA 529 101.463 119.149 52.801 1.00 0.00 C ATOM 20001 H8R PA 529 101.268 118.969 53.860 1.00 0.00 H ATOM 20002 H8S PA 529 102.458 119.591 52.710 1.00 0.00 H ATOM 20003 C17 PA 529 101.152 117.853 51.914 1.00 0.00 C ATOM 20004 H7R PA 529 101.247 117.946 50.830 1.00 0.00 H ATOM 20005 H7S PA 529 100.087 117.712 52.110 1.00 0.00 H ATOM 20006 C16 PA 529 101.846 116.480 52.239 1.00 0.00 C ATOM 20007 H6R PA 529 101.416 116.316 53.230 1.00 0.00 H ATOM 20008 H6S PA 529 102.933 116.578 52.206 1.00 0.00 H ATOM 20009 C15 PA 529 101.440 115.385 51.304 1.00 0.00 C ATOM 20010 H5R PA 529 101.820 115.577 50.298 1.00 0.00 H ATOM 20011 H5S PA 529 100.356 115.469 51.199 1.00 0.00 H ATOM 20012 C14 PA 529 101.781 114.034 51.763 1.00 0.00 C ATOM 20013 H4R PA 529 102.872 113.983 51.735 1.00 0.00 H ATOM 20014 H4S PA 529 101.444 113.328 51.002 1.00 0.00 H ATOM 20015 C13 PA 529 101.203 113.705 53.119 1.00 0.00 C ATOM 20016 H3R PA 529 100.127 113.599 52.969 1.00 0.00 H ATOM 20017 H3S PA 529 101.249 114.553 53.805 1.00 0.00 H ATOM 20018 C12 PA 529 101.900 112.503 53.845 1.00 0.00 C ATOM 20019 H2R PA 529 102.217 111.674 53.208 1.00 0.00 H ATOM 20020 H2S PA 529 102.820 112.859 54.314 1.00 0.00 H ATOM 20021 C11 PGR 530 101.049 111.933 54.942 1.00 0.00 C ATOM 20022 O12 PGR 530 100.989 110.768 55.254 1.00 0.00 O ATOM 20023 O11 PGR 530 100.403 112.890 55.677 1.00 0.00 O ATOM 20024 C1 PGR 530 99.502 112.576 56.685 1.00 0.00 C ATOM 20025 HR PGR 530 99.994 112.140 57.559 1.00 0.00 H ATOM 20026 HS PGR 530 98.687 111.911 56.391 1.00 0.00 H ATOM 20027 C2 PGR 530 98.693 113.834 57.095 1.00 0.00 C ATOM 20028 HX PGR 530 99.402 114.654 57.241 1.00 0.00 H ATOM 20029 C3 PGR 530 97.947 113.490 58.418 1.00 0.00 C ATOM 20030 HA PGR 530 98.588 113.480 59.304 1.00 0.00 H ATOM 20031 HB PGR 530 97.530 112.492 58.259 1.00 0.00 H ATOM 20032 O31 PGR 530 96.932 114.469 58.679 1.00 0.00 O ATOM 20033 P31 PGR 530 97.254 115.826 59.432 1.00 0.00 P ATOM 20034 O32 PGR 530 96.903 115.739 60.972 1.00 0.00 O ATOM 20035 C31 PGR 530 95.574 116.028 61.454 1.00 0.00 C ATOM 20036 H1A PGR 530 94.895 115.306 60.993 1.00 0.00 H ATOM 20037 H1B PGR 530 95.300 117.078 61.322 1.00 0.00 H ATOM 20038 C32 PGR 530 95.380 115.878 62.957 1.00 0.00 C ATOM 20039 H2A PGR 530 94.351 116.144 63.212 1.00 0.00 H ATOM 20040 O35 PGR 530 96.230 116.808 63.757 1.00 0.00 O ATOM 20041 HO5A PGR 530 97.088 116.677 63.316 1.00 0.00 H ATOM 20042 C33 PGR 530 95.597 114.485 63.518 1.00 0.00 C ATOM 20043 H3A PGR 530 95.034 113.871 62.811 1.00 0.00 H ATOM 20044 H3B PGR 530 96.641 114.178 63.415 1.00 0.00 H ATOM 20045 O33 PGR 530 98.704 116.162 59.344 1.00 0.00 O ATOM 20046 O34 PGR 530 96.304 116.879 58.966 1.00 0.00 O ATOM 20047 O21 PGR 530 97.627 114.188 56.050 1.00 0.00 O ATOM 20048 C21 PGR 530 97.964 114.968 55.033 1.00 0.00 C ATOM 20049 O22 PGR 530 99.106 115.375 54.887 1.00 0.00 O ATOM 20050 O36 PGR 530 95.111 114.355 64.819 1.00 0.00 O ATOM 20051 HO6A PGR 530 95.784 114.651 65.457 1.00 0.00 H ATOM 20052 C12 OL 531 96.874 115.187 53.980 1.00 0.00 C ATOM 20053 H2R OL 531 96.722 114.297 53.367 1.00 0.00 H ATOM 20054 H2S OL 531 95.913 115.397 54.455 1.00 0.00 H ATOM 20055 C13 OL 531 97.153 116.269 52.919 1.00 0.00 C ATOM 20056 H3R OL 531 97.452 117.219 53.367 1.00 0.00 H ATOM 20057 H3S OL 531 98.034 116.052 52.310 1.00 0.00 H ATOM 20058 C14 OL 531 96.076 116.565 51.946 1.00 0.00 C ATOM 20059 H4R OL 531 95.663 115.616 51.598 1.00 0.00 H ATOM 20060 H4S OL 531 95.277 117.146 52.412 1.00 0.00 H ATOM 20061 C15 OL 531 96.489 117.470 50.796 1.00 0.00 C ATOM 20062 H5R OL 531 96.894 118.433 51.113 1.00 0.00 H ATOM 20063 H5S OL 531 97.301 116.944 50.289 1.00 0.00 H ATOM 20064 C16 OL 531 95.379 117.744 49.810 1.00 0.00 C ATOM 20065 H6R OL 531 94.698 118.347 50.414 1.00 0.00 H ATOM 20066 H6S OL 531 95.790 118.429 49.066 1.00 0.00 H ATOM 20067 C17 OL 531 94.673 116.574 49.157 1.00 0.00 C ATOM 20068 H7R OL 531 94.251 115.896 49.902 1.00 0.00 H ATOM 20069 H7S OL 531 93.841 116.974 48.574 1.00 0.00 H ATOM 20070 C18 OL 531 95.639 115.743 48.290 1.00 0.00 C ATOM 20071 H8R OL 531 95.976 116.386 47.475 1.00 0.00 H ATOM 20072 H8S OL 531 96.423 115.492 49.007 1.00 0.00 H ATOM 20073 C19 OL 531 95.070 114.468 47.738 1.00 0.00 C ATOM 20074 H9R OL 531 94.526 113.925 48.507 1.00 0.00 H ATOM 20075 C110 OL 531 95.205 113.879 46.473 1.00 0.00 C ATOM 20076 H10R OL 531 94.567 113.010 46.328 1.00 0.00 H ATOM 20077 C111 OL 531 95.964 114.436 45.327 1.00 0.00 C ATOM 20078 H11R OL 531 96.519 115.338 45.594 1.00 0.00 H ATOM 20079 H11S OL 531 96.850 113.825 45.143 1.00 0.00 H ATOM 20080 C112 OL 531 95.092 114.600 44.077 1.00 0.00 C ATOM 20081 H12R OL 531 94.726 113.685 43.607 1.00 0.00 H ATOM 20082 H12S OL 531 94.262 115.256 44.350 1.00 0.00 H ATOM 20083 C113 OL 531 95.690 115.494 43.032 1.00 0.00 C ATOM 20084 H13R OL 531 96.343 116.197 43.554 1.00 0.00 H ATOM 20085 H13S OL 531 96.309 114.885 42.369 1.00 0.00 H ATOM 20086 C114 OL 531 94.812 116.326 42.118 1.00 0.00 C ATOM 20087 H14R OL 531 94.224 115.741 41.408 1.00 0.00 H ATOM 20088 H14S OL 531 94.152 116.955 42.720 1.00 0.00 H ATOM 20089 C115 OL 531 95.618 117.309 41.220 1.00 0.00 C ATOM 20090 H15R OL 531 94.847 117.799 40.623 1.00 0.00 H ATOM 20091 H15S OL 531 96.144 118.058 41.815 1.00 0.00 H ATOM 20092 C116 OL 531 96.536 116.627 40.250 1.00 0.00 C ATOM 20093 H16R OL 531 97.370 116.146 40.766 1.00 0.00 H ATOM 20094 H16S OL 531 96.003 115.839 39.713 1.00 0.00 H ATOM 20095 C117 OL 531 97.232 117.550 39.269 1.00 0.00 C ATOM 20096 H17R OL 531 97.777 118.372 39.737 1.00 0.00 H ATOM 20097 H17S OL 531 97.863 116.884 38.676 1.00 0.00 H ATOM 20098 C118 OL 531 96.368 118.334 38.273 1.00 0.00 C ATOM 20099 H18R OL 531 95.862 117.706 37.537 1.00 0.00 H ATOM 20100 H18S OL 531 96.906 119.184 37.850 1.00 0.00 H ATOM 20101 H18T OL 531 95.525 118.894 38.682 1.00 0.00 H TER 20102 OL 531 ATOM 20102 C116 PA 532 30.754 24.018 42.583 1.00 0.00 C ATOM 20103 H16R PA 532 30.556 24.652 43.450 1.00 0.00 H ATOM 20104 H16S PA 532 30.906 22.956 42.784 1.00 0.00 H ATOM 20105 H16T PA 532 29.868 24.108 41.952 1.00 0.00 H ATOM 20106 C115 PA 532 32.020 24.381 41.818 1.00 0.00 C ATOM 20107 H15R PA 532 31.976 25.470 41.878 1.00 0.00 H ATOM 20108 H15S PA 532 31.979 24.057 40.776 1.00 0.00 H ATOM 20109 C114 PA 532 33.373 23.906 42.378 1.00 0.00 C ATOM 20110 H14R PA 532 33.363 22.815 42.409 1.00 0.00 H ATOM 20111 H14S PA 532 33.441 24.299 43.394 1.00 0.00 H ATOM 20112 C113 PA 532 34.569 24.483 41.625 1.00 0.00 C ATOM 20113 H13R PA 532 34.607 25.566 41.754 1.00 0.00 H ATOM 20114 H13S PA 532 34.573 24.101 40.602 1.00 0.00 H ATOM 20115 C112 PA 532 35.929 23.955 42.055 1.00 0.00 C ATOM 20116 H12R PA 532 36.573 24.571 41.424 1.00 0.00 H ATOM 20117 H12S PA 532 35.995 22.931 41.680 1.00 0.00 H ATOM 20118 C111 PA 532 36.445 24.170 43.492 1.00 0.00 C ATOM 20119 H11R PA 532 37.515 23.978 43.384 1.00 0.00 H ATOM 20120 H11S PA 532 36.096 23.408 44.192 1.00 0.00 H ATOM 20121 C110 PA 532 36.140 25.603 44.087 1.00 0.00 C ATOM 20122 H10R PA 532 35.083 25.873 44.143 1.00 0.00 H ATOM 20123 H10S PA 532 36.499 26.305 43.332 1.00 0.00 H ATOM 20124 C19 PA 532 36.901 25.823 45.419 1.00 0.00 C ATOM 20125 H9R PA 532 37.901 25.463 45.168 1.00 0.00 H ATOM 20126 H9S PA 532 36.373 25.098 46.041 1.00 0.00 H ATOM 20127 C18 PA 532 36.700 27.191 46.123 1.00 0.00 C ATOM 20128 H8R PA 532 35.660 27.385 46.392 1.00 0.00 H ATOM 20129 H8S PA 532 37.085 27.958 45.448 1.00 0.00 H ATOM 20130 C17 PA 532 37.308 27.349 47.518 1.00 0.00 C ATOM 20131 H7R PA 532 36.598 27.074 48.301 1.00 0.00 H ATOM 20132 H7S PA 532 37.422 28.420 47.698 1.00 0.00 H ATOM 20133 C16 PA 532 38.669 26.626 47.647 1.00 0.00 C ATOM 20134 H6R PA 532 39.246 26.898 46.760 1.00 0.00 H ATOM 20135 H6S PA 532 38.515 25.546 47.681 1.00 0.00 H ATOM 20136 C15 PA 532 39.442 27.093 48.949 1.00 0.00 C ATOM 20137 H5R PA 532 39.477 28.173 48.794 1.00 0.00 H ATOM 20138 H5S PA 532 40.474 26.735 48.956 1.00 0.00 H ATOM 20139 C14 PA 532 38.833 26.639 50.259 1.00 0.00 C ATOM 20140 H4R PA 532 38.694 25.559 50.343 1.00 0.00 H ATOM 20141 H4S PA 532 37.798 26.989 50.235 1.00 0.00 H ATOM 20142 C13 PA 532 39.430 27.254 51.502 1.00 0.00 C ATOM 20143 H3R PA 532 39.348 28.343 51.505 1.00 0.00 H ATOM 20144 H3S PA 532 40.466 26.919 51.418 1.00 0.00 H ATOM 20145 C12 PA 532 38.900 26.689 52.823 1.00 0.00 C ATOM 20146 H2R PA 532 37.877 27.069 52.829 1.00 0.00 H ATOM 20147 H2S PA 532 38.892 25.601 52.923 1.00 0.00 H ATOM 20148 C11 PGR 533 39.603 27.352 54.025 1.00 0.00 C ATOM 20149 O12 PGR 533 40.810 27.468 54.072 1.00 0.00 O ATOM 20150 O11 PGR 533 38.777 27.872 54.966 1.00 0.00 O ATOM 20151 C1 PGR 533 39.451 28.182 56.274 1.00 0.00 C ATOM 20152 HR PGR 533 40.066 27.320 56.543 1.00 0.00 H ATOM 20153 HS PGR 533 38.753 28.265 57.111 1.00 0.00 H ATOM 20154 C2 PGR 533 40.383 29.381 56.254 1.00 0.00 C ATOM 20155 HX PGR 533 41.162 29.197 55.510 1.00 0.00 H ATOM 20156 C3 PGR 533 41.041 29.691 57.644 1.00 0.00 C ATOM 20157 HA PGR 533 41.501 30.674 57.513 1.00 0.00 H ATOM 20158 HB PGR 533 41.833 28.979 57.889 1.00 0.00 H ATOM 20159 O31 PGR 533 40.055 29.663 58.651 1.00 0.00 O ATOM 20160 P31 PGR 533 40.484 29.982 60.140 1.00 0.00 P ATOM 20161 O32 PGR 533 41.245 28.660 60.465 1.00 0.00 O ATOM 20162 C31 PGR 533 40.725 27.501 60.911 1.00 0.00 C ATOM 20163 H1A PGR 533 39.791 27.275 60.390 1.00 0.00 H ATOM 20164 H1B PGR 533 40.511 27.583 61.980 1.00 0.00 H ATOM 20165 C32 PGR 533 41.818 26.412 60.643 1.00 0.00 C ATOM 20166 H2A PGR 533 42.807 26.576 61.078 1.00 0.00 H ATOM 20167 O35 PGR 533 42.081 26.235 59.216 1.00 0.00 O ATOM 20168 HO5A PGR 533 41.258 25.900 58.818 1.00 0.00 H ATOM 20169 C33 PGR 533 41.439 25.049 61.236 1.00 0.00 C ATOM 20170 H3A PGR 533 41.847 24.356 60.495 1.00 0.00 H ATOM 20171 H3B PGR 533 41.899 24.962 62.223 1.00 0.00 H ATOM 20172 O33 PGR 533 41.403 31.178 60.250 1.00 0.00 O ATOM 20173 O34 PGR 533 39.248 29.999 60.910 1.00 0.00 O ATOM 20174 O21 PGR 533 39.627 30.533 55.744 1.00 0.00 O ATOM 20175 C21 PGR 533 40.224 31.726 55.491 1.00 0.00 C ATOM 20176 O22 PGR 533 41.474 31.876 55.616 1.00 0.00 O ATOM 20177 O36 PGR 533 40.027 24.822 61.243 1.00 0.00 O ATOM 20178 HO6A PGR 533 39.774 24.900 60.306 1.00 0.00 H ATOM 20179 C12 OL 534 39.257 32.736 55.095 1.00 0.00 C ATOM 20180 H2R OL 534 38.314 32.230 54.879 1.00 0.00 H ATOM 20181 H2S OL 534 39.139 33.464 55.901 1.00 0.00 H ATOM 20182 C13 OL 534 39.664 33.613 53.863 1.00 0.00 C ATOM 20183 H3R OL 534 38.866 34.341 53.702 1.00 0.00 H ATOM 20184 H3S OL 534 40.557 34.155 54.181 1.00 0.00 H ATOM 20185 C14 OL 534 39.977 32.895 52.487 1.00 0.00 C ATOM 20186 H4R OL 534 39.873 33.666 51.721 1.00 0.00 H ATOM 20187 H4S OL 534 41.016 32.576 52.377 1.00 0.00 H ATOM 20188 C15 OL 534 39.238 31.637 52.146 1.00 0.00 C ATOM 20189 H5R OL 534 39.719 31.147 51.296 1.00 0.00 H ATOM 20190 H5S OL 534 39.411 30.998 53.014 1.00 0.00 H ATOM 20191 C16 OL 534 37.777 31.767 52.082 1.00 0.00 C ATOM 20192 H6R OL 534 37.167 30.862 52.040 1.00 0.00 H ATOM 20193 H6S OL 534 37.390 32.348 52.921 1.00 0.00 H ATOM 20194 C17 OL 534 37.251 32.580 50.850 1.00 0.00 C ATOM 20195 H7R OL 534 36.180 32.682 51.039 1.00 0.00 H ATOM 20196 H7S OL 534 37.589 33.617 50.910 1.00 0.00 H ATOM 20197 C18 OL 534 37.495 31.877 49.474 1.00 0.00 C ATOM 20198 H8R OL 534 38.576 31.799 49.338 1.00 0.00 H ATOM 20199 H8S OL 534 36.995 30.918 49.320 1.00 0.00 H ATOM 20200 C19 OL 534 36.936 32.798 48.521 1.00 0.00 C ATOM 20201 H9R OL 534 37.559 33.598 48.128 1.00 0.00 H ATOM 20202 C110 OL 534 35.764 32.634 47.910 1.00 0.00 C ATOM 20203 H10R OL 534 35.514 33.489 47.287 1.00 0.00 H ATOM 20204 C111 OL 534 34.721 31.545 47.870 1.00 0.00 C ATOM 20205 H11R OL 534 34.952 30.662 48.469 1.00 0.00 H ATOM 20206 H11S OL 534 33.774 31.882 48.299 1.00 0.00 H ATOM 20207 C112 OL 534 34.516 31.099 46.422 1.00 0.00 C ATOM 20208 H12R OL 534 33.965 31.950 46.015 1.00 0.00 H ATOM 20209 H12S OL 534 35.443 31.049 45.847 1.00 0.00 H ATOM 20210 C113 OL 534 33.709 29.817 46.266 1.00 0.00 C ATOM 20211 H13R OL 534 34.121 28.907 46.708 1.00 0.00 H ATOM 20212 H13S OL 534 32.787 29.937 46.839 1.00 0.00 H ATOM 20213 C114 OL 534 33.244 29.523 44.877 1.00 0.00 C ATOM 20214 H14R OL 534 32.555 30.299 44.538 1.00 0.00 H ATOM 20215 H14S OL 534 34.079 29.503 44.173 1.00 0.00 H ATOM 20216 C115 OL 534 32.469 28.197 44.883 1.00 0.00 C ATOM 20217 H15R OL 534 33.020 27.422 45.419 1.00 0.00 H ATOM 20218 H15S OL 534 31.601 28.291 45.539 1.00 0.00 H ATOM 20219 C116 OL 534 31.942 27.718 43.556 1.00 0.00 C ATOM 20220 H16R OL 534 32.785 27.386 42.945 1.00 0.00 H ATOM 20221 H16S OL 534 31.451 26.768 43.778 1.00 0.00 H ATOM 20222 C117 OL 534 31.006 28.580 42.827 1.00 0.00 C ATOM 20223 H17R OL 534 30.253 29.001 43.496 1.00 0.00 H ATOM 20224 H17S OL 534 31.412 29.519 42.446 1.00 0.00 H ATOM 20225 C118 OL 534 30.382 27.777 41.700 1.00 0.00 C ATOM 20226 H18R OL 534 31.072 27.478 40.908 1.00 0.00 H ATOM 20227 H18S OL 534 29.565 28.357 41.266 1.00 0.00 H ATOM 20228 H18T OL 534 29.965 26.848 42.094 1.00 0.00 H TER 20229 OL 534 ATOM 20229 C116 PA 535 106.774 25.149 38.568 1.00 0.00 C ATOM 20230 H16R PA 535 106.513 24.236 39.108 1.00 0.00 H ATOM 20231 H16S PA 535 107.462 24.923 37.751 1.00 0.00 H ATOM 20232 H16T PA 535 105.794 25.509 38.249 1.00 0.00 H ATOM 20233 C115 PA 535 107.411 26.105 39.654 1.00 0.00 C ATOM 20234 H15R PA 535 107.952 26.912 39.156 1.00 0.00 H ATOM 20235 H15S PA 535 108.146 25.497 40.185 1.00 0.00 H ATOM 20236 C114 PA 535 106.455 26.893 40.567 1.00 0.00 C ATOM 20237 H14R PA 535 105.793 27.482 39.929 1.00 0.00 H ATOM 20238 H14S PA 535 107.050 27.597 41.153 1.00 0.00 H ATOM 20239 C113 PA 535 105.573 25.941 41.494 1.00 0.00 C ATOM 20240 H13R PA 535 104.971 25.210 40.949 1.00 0.00 H ATOM 20241 H13S PA 535 104.774 26.605 41.831 1.00 0.00 H ATOM 20242 C112 PA 535 106.186 25.229 42.647 1.00 0.00 C ATOM 20243 H12R PA 535 105.416 24.804 43.295 1.00 0.00 H ATOM 20244 H12S PA 535 106.698 25.898 43.341 1.00 0.00 H ATOM 20245 C111 PA 535 107.112 24.103 42.256 1.00 0.00 C ATOM 20246 H11R PA 535 108.072 24.420 41.843 1.00 0.00 H ATOM 20247 H11S PA 535 106.714 23.489 41.445 1.00 0.00 H ATOM 20248 C110 PA 535 107.491 23.094 43.304 1.00 0.00 C ATOM 20249 H10R PA 535 107.952 22.230 42.820 1.00 0.00 H ATOM 20250 H10S PA 535 106.629 22.696 43.841 1.00 0.00 H ATOM 20251 C19 PA 535 108.563 23.541 44.342 1.00 0.00 C ATOM 20252 H9R PA 535 109.184 24.309 43.876 1.00 0.00 H ATOM 20253 H9S PA 535 109.197 22.668 44.509 1.00 0.00 H ATOM 20254 C18 PA 535 107.837 24.092 45.630 1.00 0.00 C ATOM 20255 H8R PA 535 107.038 23.370 45.810 1.00 0.00 H ATOM 20256 H8S PA 535 107.347 25.054 45.460 1.00 0.00 H ATOM 20257 C17 PA 535 108.719 24.124 46.875 1.00 0.00 C ATOM 20258 H7R PA 535 109.636 24.707 46.763 1.00 0.00 H ATOM 20259 H7S PA 535 108.956 23.102 47.178 1.00 0.00 H ATOM 20260 C16 PA 535 108.063 24.851 48.070 1.00 0.00 C ATOM 20261 H6R PA 535 107.095 24.406 48.309 1.00 0.00 H ATOM 20262 H6S PA 535 107.868 25.883 47.770 1.00 0.00 H ATOM 20263 C15 PA 535 108.857 24.798 49.360 1.00 0.00 C ATOM 20264 H5R PA 535 109.871 25.050 49.043 1.00 0.00 H ATOM 20265 H5S PA 535 108.843 23.738 49.622 1.00 0.00 H ATOM 20266 C14 PA 535 108.399 25.690 50.509 1.00 0.00 C ATOM 20267 H4R PA 535 107.345 25.483 50.707 1.00 0.00 H ATOM 20268 H4S PA 535 108.456 26.759 50.295 1.00 0.00 H ATOM 20269 C13 PA 535 109.223 25.437 51.740 1.00 0.00 C ATOM 20270 H3R PA 535 110.224 25.108 51.455 1.00 0.00 H ATOM 20271 H3S PA 535 108.909 24.460 52.113 1.00 0.00 H ATOM 20272 C12 PA 535 109.078 26.520 52.844 1.00 0.00 C ATOM 20273 H2R PA 535 108.110 26.765 53.287 1.00 0.00 H ATOM 20274 H2S PA 535 109.301 27.499 52.416 1.00 0.00 H ATOM 20275 C11 PGR 536 110.063 26.451 54.005 1.00 0.00 C ATOM 20276 O12 PGR 536 109.768 26.841 55.082 1.00 0.00 O ATOM 20277 O11 PGR 536 111.293 25.900 53.719 1.00 0.00 O ATOM 20278 C1 PGR 536 112.225 25.430 54.700 1.00 0.00 C ATOM 20279 HR PGR 536 112.337 26.273 55.388 1.00 0.00 H ATOM 20280 HS PGR 536 113.159 25.170 54.196 1.00 0.00 H ATOM 20281 C2 PGR 536 111.667 24.181 55.409 1.00 0.00 C ATOM 20282 HX PGR 536 110.644 24.386 55.736 1.00 0.00 H ATOM 20283 C3 PGR 536 112.386 24.003 56.696 1.00 0.00 C ATOM 20284 HA PGR 536 112.419 24.945 57.249 1.00 0.00 H ATOM 20285 HB PGR 536 113.397 23.594 56.621 1.00 0.00 H ATOM 20286 O31 PGR 536 111.636 23.072 57.532 1.00 0.00 O ATOM 20287 P31 PGR 536 111.900 23.082 59.149 1.00 0.00 P ATOM 20288 O32 PGR 536 111.339 24.495 59.664 1.00 0.00 O ATOM 20289 C31 PGR 536 109.941 24.918 59.551 1.00 0.00 C ATOM 20290 H1A PGR 536 109.812 25.334 58.549 1.00 0.00 H ATOM 20291 H1B PGR 536 109.311 24.043 59.732 1.00 0.00 H ATOM 20292 C32 PGR 536 109.727 26.060 60.504 1.00 0.00 C ATOM 20293 H2A PGR 536 108.656 26.084 60.718 1.00 0.00 H ATOM 20294 O35 PGR 536 110.028 27.233 59.749 1.00 0.00 O ATOM 20295 HO5A PGR 536 110.997 27.328 59.740 1.00 0.00 H ATOM 20296 C33 PGR 536 110.334 25.812 61.917 1.00 0.00 C ATOM 20297 H3A PGR 536 110.267 24.741 62.128 1.00 0.00 H ATOM 20298 H3B PGR 536 111.364 26.163 62.022 1.00 0.00 H ATOM 20299 O33 PGR 536 110.958 22.084 59.747 1.00 0.00 O ATOM 20300 O34 PGR 536 113.324 23.007 59.476 1.00 0.00 O ATOM 20301 O21 PGR 536 111.780 22.991 54.659 1.00 0.00 O ATOM 20302 C21 PGR 536 110.697 22.567 53.983 1.00 0.00 C ATOM 20303 O22 PGR 536 109.635 23.106 53.945 1.00 0.00 O ATOM 20304 O36 PGR 536 109.671 26.706 62.851 1.00 0.00 O ATOM 20305 HO6A PGR 536 110.009 26.506 63.742 1.00 0.00 H ATOM 20306 C12 OL 537 111.048 21.424 52.990 1.00 0.00 C ATOM 20307 H2R OL 537 111.942 20.837 53.211 1.00 0.00 H ATOM 20308 H2S OL 537 110.179 20.765 52.935 1.00 0.00 H ATOM 20309 C13 OL 537 111.319 22.076 51.630 1.00 0.00 C ATOM 20310 H3R OL 537 110.488 22.717 51.327 1.00 0.00 H ATOM 20311 H3S OL 537 112.228 22.675 51.713 1.00 0.00 H ATOM 20312 C14 OL 537 111.618 21.058 50.570 1.00 0.00 C ATOM 20313 H4R OL 537 112.571 20.578 50.802 1.00 0.00 H ATOM 20314 H4S OL 537 110.796 20.342 50.510 1.00 0.00 H ATOM 20315 C15 OL 537 111.650 21.839 49.208 1.00 0.00 C ATOM 20316 H5R OL 537 111.671 21.071 48.431 1.00 0.00 H ATOM 20317 H5S OL 537 110.692 22.306 48.973 1.00 0.00 H ATOM 20318 C16 OL 537 112.756 22.837 48.863 1.00 0.00 C ATOM 20319 H6R OL 537 112.797 22.977 47.780 1.00 0.00 H ATOM 20320 H6S OL 537 112.619 23.826 49.306 1.00 0.00 H ATOM 20321 C17 OL 537 114.116 22.312 49.179 1.00 0.00 C ATOM 20322 H7R OL 537 114.174 22.267 50.268 1.00 0.00 H ATOM 20323 H7S OL 537 114.130 21.284 48.813 1.00 0.00 H ATOM 20324 C18 OL 537 115.239 23.109 48.511 1.00 0.00 C ATOM 20325 H8R OL 537 115.130 23.066 47.425 1.00 0.00 H ATOM 20326 H8S OL 537 115.091 24.142 48.834 1.00 0.00 H ATOM 20327 C19 OL 537 116.668 22.652 48.935 1.00 0.00 C ATOM 20328 H9R OL 537 116.876 22.607 50.001 1.00 0.00 H ATOM 20329 C110 OL 537 117.653 22.399 48.120 1.00 0.00 C ATOM 20330 H10R OL 537 118.511 21.933 48.597 1.00 0.00 H ATOM 20331 C111 OL 537 117.701 22.472 46.573 1.00 0.00 C ATOM 20332 H11R OL 537 118.349 21.732 46.099 1.00 0.00 H ATOM 20333 H11S OL 537 116.721 22.324 46.116 1.00 0.00 H ATOM 20334 C112 OL 537 118.035 23.877 46.243 1.00 0.00 C ATOM 20335 H12R OL 537 117.365 24.693 46.521 1.00 0.00 H ATOM 20336 H12S OL 537 118.860 24.162 46.900 1.00 0.00 H ATOM 20337 C113 OL 537 118.519 24.133 44.872 1.00 0.00 C ATOM 20338 H13R OL 537 118.743 25.202 44.858 1.00 0.00 H ATOM 20339 H13S OL 537 119.471 23.632 44.682 1.00 0.00 H ATOM 20340 C114 OL 537 117.587 23.607 43.766 1.00 0.00 C ATOM 20341 H14R OL 537 117.603 22.515 43.796 1.00 0.00 H ATOM 20342 H14S OL 537 116.601 24.059 43.895 1.00 0.00 H ATOM 20343 C115 OL 537 118.082 24.018 42.374 1.00 0.00 C ATOM 20344 H15R OL 537 117.318 23.629 41.697 1.00 0.00 H ATOM 20345 H15S OL 537 118.120 25.108 42.419 1.00 0.00 H ATOM 20346 C116 OL 537 119.359 23.459 41.939 1.00 0.00 C ATOM 20347 H16R OL 537 120.104 23.702 42.699 1.00 0.00 H ATOM 20348 H16S OL 537 119.376 22.376 41.793 1.00 0.00 H ATOM 20349 C117 OL 537 119.824 23.898 40.563 1.00 0.00 C ATOM 20350 H17R OL 537 119.610 24.962 40.444 1.00 0.00 H ATOM 20351 H17S OL 537 120.912 23.815 40.506 1.00 0.00 H ATOM 20352 C118 OL 537 119.251 23.188 39.307 1.00 0.00 C ATOM 20353 H18R OL 537 119.675 23.383 38.320 1.00 0.00 H ATOM 20354 H18S OL 537 118.242 23.604 39.303 1.00 0.00 H ATOM 20355 H18T OL 537 119.053 22.114 39.300 1.00 0.00 H TER 20356 OL 537 ATOM 20356 C116 PA 538 125.996 67.815 49.066 1.00 0.00 C ATOM 20357 H16R PA 538 126.295 66.776 49.220 1.00 0.00 H ATOM 20358 H16S PA 538 124.924 67.653 49.195 1.00 0.00 H ATOM 20359 H16T PA 538 126.304 68.436 49.910 1.00 0.00 H ATOM 20360 C115 PA 538 126.240 68.402 47.626 1.00 0.00 C ATOM 20361 H15R PA 538 125.702 67.856 46.848 1.00 0.00 H ATOM 20362 H15S PA 538 127.277 68.351 47.289 1.00 0.00 H ATOM 20363 C114 PA 538 125.648 69.796 47.559 1.00 0.00 C ATOM 20364 H14R PA 538 124.671 69.776 48.049 1.00 0.00 H ATOM 20365 H14S PA 538 125.455 69.948 46.495 1.00 0.00 H ATOM 20366 C113 PA 538 126.511 70.890 48.285 1.00 0.00 C ATOM 20367 H13R PA 538 126.792 70.529 49.276 1.00 0.00 H ATOM 20368 H13S PA 538 125.848 71.731 48.501 1.00 0.00 H ATOM 20369 C112 PA 538 127.543 71.518 47.502 1.00 0.00 C ATOM 20370 H12R PA 538 126.929 71.866 46.669 1.00 0.00 H ATOM 20371 H12S PA 538 128.339 70.817 47.242 1.00 0.00 H ATOM 20372 C111 PA 538 128.112 72.760 48.171 1.00 0.00 C ATOM 20373 H11R PA 538 128.527 72.500 49.147 1.00 0.00 H ATOM 20374 H11S PA 538 127.384 73.566 48.287 1.00 0.00 H ATOM 20375 C110 PA 538 129.178 73.438 47.266 1.00 0.00 C ATOM 20376 H10R PA 538 128.790 73.598 46.258 1.00 0.00 H ATOM 20377 H10S PA 538 130.051 72.798 47.118 1.00 0.00 H ATOM 20378 C19 PA 538 129.575 74.823 47.789 1.00 0.00 C ATOM 20379 H9R PA 538 128.696 75.457 47.660 1.00 0.00 H ATOM 20380 H9S PA 538 130.420 75.219 47.221 1.00 0.00 H ATOM 20381 C18 PA 538 129.942 74.751 49.297 1.00 0.00 C ATOM 20382 H8R PA 538 129.028 74.588 49.871 1.00 0.00 H ATOM 20383 H8S PA 538 130.276 75.706 49.709 1.00 0.00 H ATOM 20384 C17 PA 538 130.963 73.696 49.635 1.00 0.00 C ATOM 20385 H7R PA 538 131.730 73.650 48.859 1.00 0.00 H ATOM 20386 H7S PA 538 130.531 72.695 49.567 1.00 0.00 H ATOM 20387 C16 PA 538 131.538 73.927 50.985 1.00 0.00 C ATOM 20388 H6R PA 538 130.750 74.055 51.730 1.00 0.00 H ATOM 20389 H6S PA 538 132.054 74.885 51.086 1.00 0.00 H ATOM 20390 C15 PA 538 132.527 72.845 51.343 1.00 0.00 C ATOM 20391 H5R PA 538 133.326 72.735 50.607 1.00 0.00 H ATOM 20392 H5S PA 538 131.991 71.894 51.313 1.00 0.00 H ATOM 20393 C14 PA 538 133.050 72.792 52.779 1.00 0.00 C ATOM 20394 H4R PA 538 133.677 71.899 52.825 1.00 0.00 H ATOM 20395 H4S PA 538 132.238 72.547 53.467 1.00 0.00 H ATOM 20396 C13 PA 538 133.777 73.996 53.169 1.00 0.00 C ATOM 20397 H3R PA 538 133.236 74.944 53.219 1.00 0.00 H ATOM 20398 H3S PA 538 134.550 74.215 52.430 1.00 0.00 H ATOM 20399 C12 PA 538 134.448 73.836 54.501 1.00 0.00 C ATOM 20400 H2R PA 538 135.095 74.682 54.741 1.00 0.00 H ATOM 20401 H2S PA 538 135.033 72.958 54.784 1.00 0.00 H ATOM 20402 C11 PGR 539 133.453 74.021 55.633 1.00 0.00 C ATOM 20403 O12 PGR 539 132.673 73.193 55.946 1.00 0.00 O ATOM 20404 O11 PGR 539 133.624 75.126 56.401 1.00 0.00 O ATOM 20405 C1 PGR 539 132.683 75.345 57.518 1.00 0.00 C ATOM 20406 HR PGR 539 133.080 75.949 58.338 1.00 0.00 H ATOM 20407 HS PGR 539 132.455 74.369 57.953 1.00 0.00 H ATOM 20408 C2 PGR 539 131.430 76.027 56.890 1.00 0.00 C ATOM 20409 HX PGR 539 131.810 77.030 56.679 1.00 0.00 H ATOM 20410 C3 PGR 539 130.327 76.088 57.948 1.00 0.00 C ATOM 20411 HA PGR 539 129.462 76.569 57.486 1.00 0.00 H ATOM 20412 HB PGR 539 130.741 76.653 58.788 1.00 0.00 H ATOM 20413 O31 PGR 539 129.979 74.824 58.257 1.00 0.00 O ATOM 20414 P31 PGR 539 128.757 74.481 59.122 1.00 0.00 P ATOM 20415 O32 PGR 539 127.470 74.960 58.223 1.00 0.00 O ATOM 20416 C31 PGR 539 126.809 74.064 57.332 1.00 0.00 C ATOM 20417 H1A PGR 539 127.613 73.446 56.924 1.00 0.00 H ATOM 20418 H1B PGR 539 126.391 74.634 56.498 1.00 0.00 H ATOM 20419 C32 PGR 539 125.656 73.229 58.021 1.00 0.00 C ATOM 20420 H2A PGR 539 125.181 73.947 58.694 1.00 0.00 H ATOM 20421 O35 PGR 539 126.213 72.172 58.817 1.00 0.00 O ATOM 20422 HO5A PGR 539 126.963 72.650 59.215 1.00 0.00 H ATOM 20423 C33 PGR 539 124.739 72.664 56.928 1.00 0.00 C ATOM 20424 H3A PGR 539 123.962 72.144 57.494 1.00 0.00 H ATOM 20425 H3B PGR 539 124.302 73.452 56.309 1.00 0.00 H ATOM 20426 O33 PGR 539 128.646 72.997 59.255 1.00 0.00 O ATOM 20427 O34 PGR 539 128.746 75.294 60.378 1.00 0.00 O ATOM 20428 O21 PGR 539 130.838 75.310 55.815 1.00 0.00 O ATOM 20429 C21 PGR 539 129.852 75.813 55.109 1.00 0.00 C ATOM 20430 O22 PGR 539 129.433 76.967 55.095 1.00 0.00 O ATOM 20431 O36 PGR 539 125.439 71.649 56.202 1.00 0.00 O ATOM 20432 HO6A PGR 539 124.782 70.959 55.999 1.00 0.00 H ATOM 20433 C12 OL 540 129.392 74.827 54.074 1.00 0.00 C ATOM 20434 H2R OL 540 128.345 75.081 53.894 1.00 0.00 H ATOM 20435 H2S OL 540 129.833 75.057 53.102 1.00 0.00 H ATOM 20436 C13 OL 540 129.386 73.366 54.474 1.00 0.00 C ATOM 20437 H3R OL 540 130.378 72.979 54.228 1.00 0.00 H ATOM 20438 H3S OL 540 129.274 73.205 55.548 1.00 0.00 H ATOM 20439 C14 OL 540 128.297 72.489 53.882 1.00 0.00 C ATOM 20440 H4R OL 540 128.460 71.579 54.463 1.00 0.00 H ATOM 20441 H4S OL 540 127.257 72.755 54.084 1.00 0.00 H ATOM 20442 C15 OL 540 128.286 72.285 52.370 1.00 0.00 C ATOM 20443 H5R OL 540 127.614 72.996 51.884 1.00 0.00 H ATOM 20444 H5S OL 540 129.275 72.483 51.950 1.00 0.00 H ATOM 20445 C16 OL 540 127.881 70.843 51.990 1.00 0.00 C ATOM 20446 H6R OL 540 128.048 70.752 50.915 1.00 0.00 H ATOM 20447 H6S OL 540 128.496 70.114 52.523 1.00 0.00 H ATOM 20448 C17 OL 540 126.387 70.493 52.357 1.00 0.00 C ATOM 20449 H7R OL 540 126.111 69.518 51.950 1.00 0.00 H ATOM 20450 H7S OL 540 126.352 70.339 53.438 1.00 0.00 H ATOM 20451 C18 OL 540 125.251 71.504 51.979 1.00 0.00 C ATOM 20452 H8R OL 540 125.418 72.543 52.269 1.00 0.00 H ATOM 20453 H8S OL 540 125.320 71.588 50.892 1.00 0.00 H ATOM 20454 C19 OL 540 123.840 71.145 52.528 1.00 0.00 C ATOM 20455 H9R OL 540 123.574 71.275 53.573 1.00 0.00 H ATOM 20456 C110 OL 540 122.849 70.811 51.698 1.00 0.00 C ATOM 20457 H10R OL 540 121.911 70.663 52.227 1.00 0.00 H ATOM 20458 C111 OL 540 122.825 70.700 50.214 1.00 0.00 C ATOM 20459 H11R OL 540 123.767 71.054 49.791 1.00 0.00 H ATOM 20460 H11S OL 540 122.916 69.627 50.034 1.00 0.00 H ATOM 20461 C112 OL 540 121.596 71.177 49.457 1.00 0.00 C ATOM 20462 H12R OL 540 120.666 70.710 49.787 1.00 0.00 H ATOM 20463 H12S OL 540 121.413 72.228 49.687 1.00 0.00 H ATOM 20464 C113 OL 540 121.821 70.965 47.930 1.00 0.00 C ATOM 20465 H13R OL 540 122.830 71.236 47.613 1.00 0.00 H ATOM 20466 H13S OL 540 121.870 69.916 47.627 1.00 0.00 H ATOM 20467 C114 OL 540 120.770 71.679 47.053 1.00 0.00 C ATOM 20468 H14R OL 540 119.773 71.333 47.336 1.00 0.00 H ATOM 20469 H14S OL 540 120.794 72.766 47.156 1.00 0.00 H ATOM 20470 C115 OL 540 120.800 71.214 45.621 1.00 0.00 C ATOM 20471 H15R OL 540 120.767 70.128 45.735 1.00 0.00 H ATOM 20472 H15S OL 540 119.923 71.665 45.154 1.00 0.00 H ATOM 20473 C116 OL 540 122.074 71.719 44.845 1.00 0.00 C ATOM 20474 H16R OL 540 122.213 72.796 44.960 1.00 0.00 H ATOM 20475 H16S OL 540 122.913 71.094 45.158 1.00 0.00 H ATOM 20476 C117 OL 540 121.944 71.408 43.310 1.00 0.00 C ATOM 20477 H17R OL 540 121.012 71.865 42.972 1.00 0.00 H ATOM 20478 H17S OL 540 122.812 71.881 42.846 1.00 0.00 H ATOM 20479 C118 OL 540 121.864 70.000 42.895 1.00 0.00 C ATOM 20480 H18R OL 540 121.656 69.888 41.829 1.00 0.00 H ATOM 20481 H18S OL 540 120.935 69.628 43.331 1.00 0.00 H ATOM 20482 H18T OL 540 122.826 69.490 42.977 1.00 0.00 H TER 20483 OL 540 ATOM 20483 C116 PA 541 88.438 40.771 35.541 1.00 0.00 C ATOM 20484 H16R PA 541 89.037 39.955 35.132 1.00 0.00 H ATOM 20485 H16S PA 541 88.905 41.700 35.208 1.00 0.00 H ATOM 20486 H16T PA 541 87.527 40.770 34.940 1.00 0.00 H ATOM 20487 C115 PA 541 88.264 40.717 37.098 1.00 0.00 C ATOM 20488 H15R PA 541 87.707 41.559 37.516 1.00 0.00 H ATOM 20489 H15S PA 541 89.251 40.917 37.521 1.00 0.00 H ATOM 20490 C114 PA 541 87.718 39.351 37.486 1.00 0.00 C ATOM 20491 H14R PA 541 87.892 38.544 36.771 1.00 0.00 H ATOM 20492 H14S PA 541 86.654 39.390 37.243 1.00 0.00 H ATOM 20493 C113 PA 541 88.110 38.957 38.875 1.00 0.00 C ATOM 20494 H13R PA 541 88.119 39.779 39.594 1.00 0.00 H ATOM 20495 H13S PA 541 89.163 38.667 38.859 1.00 0.00 H ATOM 20496 C112 PA 541 87.420 37.746 39.431 1.00 0.00 C ATOM 20497 H12R PA 541 87.757 36.867 38.878 1.00 0.00 H ATOM 20498 H12S PA 541 86.338 37.777 39.292 1.00 0.00 H ATOM 20499 C111 PA 541 87.731 37.534 40.949 1.00 0.00 C ATOM 20500 H11R PA 541 87.119 36.797 41.472 1.00 0.00 H ATOM 20501 H11S PA 541 87.364 38.369 41.549 1.00 0.00 H ATOM 20502 C110 PA 541 89.210 37.205 41.147 1.00 0.00 C ATOM 20503 H10R PA 541 89.753 38.137 40.974 1.00 0.00 H ATOM 20504 H10S PA 541 89.676 36.503 40.452 1.00 0.00 H ATOM 20505 C19 PA 541 89.489 36.756 42.578 1.00 0.00 C ATOM 20506 H9R PA 541 88.814 35.928 42.807 1.00 0.00 H ATOM 20507 H9S PA 541 89.199 37.453 43.367 1.00 0.00 H ATOM 20508 C18 PA 541 90.936 36.381 42.730 1.00 0.00 C ATOM 20509 H8R PA 541 91.617 37.218 42.565 1.00 0.00 H ATOM 20510 H8S PA 541 91.231 35.685 41.942 1.00 0.00 H ATOM 20511 C17 PA 541 91.120 35.683 44.125 1.00 0.00 C ATOM 20512 H7R PA 541 92.176 35.424 44.228 1.00 0.00 H ATOM 20513 H7S PA 541 90.538 34.759 44.114 1.00 0.00 H ATOM 20514 C16 PA 541 90.919 36.637 45.327 1.00 0.00 C ATOM 20515 H6R PA 541 89.849 36.617 45.544 1.00 0.00 H ATOM 20516 H6S PA 541 91.171 37.663 45.050 1.00 0.00 H ATOM 20517 C15 PA 541 91.629 36.240 46.648 1.00 0.00 C ATOM 20518 H5R PA 541 91.100 36.754 47.453 1.00 0.00 H ATOM 20519 H5S PA 541 92.660 36.601 46.665 1.00 0.00 H ATOM 20520 C14 PA 541 91.651 34.736 46.990 1.00 0.00 C ATOM 20521 H4R PA 541 92.330 34.265 46.278 1.00 0.00 H ATOM 20522 H4S PA 541 90.650 34.357 46.771 1.00 0.00 H ATOM 20523 C13 PA 541 91.987 34.438 48.490 1.00 0.00 C ATOM 20524 H3R PA 541 91.193 34.901 49.078 1.00 0.00 H ATOM 20525 H3S PA 541 92.910 34.964 48.743 1.00 0.00 H ATOM 20526 C12 PA 541 92.281 32.925 48.905 1.00 0.00 C ATOM 20527 H2R PA 541 93.206 32.607 48.419 1.00 0.00 H ATOM 20528 H2S PA 541 91.435 32.345 48.531 1.00 0.00 H ATOM 20529 C11 PGR 542 92.362 32.821 50.452 1.00 0.00 C ATOM 20530 O12 PGR 542 93.305 32.296 51.061 1.00 0.00 O ATOM 20531 O11 PGR 542 91.329 33.365 51.041 1.00 0.00 O ATOM 20532 C1 PGR 542 91.186 33.329 52.544 1.00 0.00 C ATOM 20533 HR PGR 542 91.167 32.298 52.908 1.00 0.00 H ATOM 20534 HS PGR 542 90.167 33.679 52.727 1.00 0.00 H ATOM 20535 C2 PGR 542 92.227 34.242 53.276 1.00 0.00 C ATOM 20536 HX PGR 542 93.238 34.005 52.936 1.00 0.00 H ATOM 20537 C3 PGR 542 92.150 33.993 54.770 1.00 0.00 C ATOM 20538 HA PGR 542 92.846 34.662 55.283 1.00 0.00 H ATOM 20539 HB PGR 542 92.456 32.954 54.915 1.00 0.00 H ATOM 20540 O31 PGR 542 90.842 34.171 55.333 1.00 0.00 O ATOM 20541 P31 PGR 542 90.496 33.961 56.866 1.00 0.00 P ATOM 20542 O32 PGR 542 89.854 32.541 56.890 1.00 0.00 O ATOM 20543 C31 PGR 542 88.635 32.353 56.251 1.00 0.00 C ATOM 20544 H1A PGR 542 88.670 32.551 55.176 1.00 0.00 H ATOM 20545 H1B PGR 542 87.912 32.937 56.826 1.00 0.00 H ATOM 20546 C32 PGR 542 88.222 30.906 56.459 1.00 0.00 C ATOM 20547 H2A PGR 542 87.892 30.837 57.498 1.00 0.00 H ATOM 20548 O35 PGR 542 89.359 30.145 56.078 1.00 0.00 O ATOM 20549 HO5A PGR 542 89.647 30.375 55.177 1.00 0.00 H ATOM 20550 C33 PGR 542 87.046 30.664 55.427 1.00 0.00 C ATOM 20551 H3A PGR 542 86.302 31.456 55.312 1.00 0.00 H ATOM 20552 H3B PGR 542 87.587 30.557 54.483 1.00 0.00 H ATOM 20553 O33 PGR 542 91.778 33.899 57.633 1.00 0.00 O ATOM 20554 O34 PGR 542 89.427 34.945 57.297 1.00 0.00 O ATOM 20555 O21 PGR 542 91.946 35.561 53.040 1.00 0.00 O ATOM 20556 C21 PGR 542 92.534 36.152 51.972 1.00 0.00 C ATOM 20557 O22 PGR 542 93.338 35.573 51.266 1.00 0.00 O ATOM 20558 O36 PGR 542 86.388 29.390 55.614 1.00 0.00 O ATOM 20559 HO6A PGR 542 85.901 29.410 56.458 1.00 0.00 H ATOM 20560 C12 OL 543 92.398 37.656 51.873 1.00 0.00 C ATOM 20561 H2R OL 543 91.328 37.872 51.877 1.00 0.00 H ATOM 20562 H2S OL 543 92.893 38.155 52.708 1.00 0.00 H ATOM 20563 C13 OL 543 93.021 38.298 50.534 1.00 0.00 C ATOM 20564 H3R OL 543 94.109 38.345 50.609 1.00 0.00 H ATOM 20565 H3S OL 543 92.851 37.641 49.679 1.00 0.00 H ATOM 20566 C14 OL 543 92.582 39.736 50.238 1.00 0.00 C ATOM 20567 H4R OL 543 91.496 39.620 50.251 1.00 0.00 H ATOM 20568 H4S OL 543 92.684 40.376 51.116 1.00 0.00 H ATOM 20569 C15 OL 543 93.266 40.378 49.083 1.00 0.00 C ATOM 20570 H5R OL 543 94.355 40.299 49.102 1.00 0.00 H ATOM 20571 H5S OL 543 93.100 39.795 48.174 1.00 0.00 H ATOM 20572 C16 OL 543 92.832 41.815 48.909 1.00 0.00 C ATOM 20573 H6R OL 543 91.747 41.867 48.795 1.00 0.00 H ATOM 20574 H6S OL 543 93.022 42.343 49.846 1.00 0.00 H ATOM 20575 C17 OL 543 93.517 42.511 47.836 1.00 0.00 C ATOM 20576 H7R OL 543 94.583 42.564 48.063 1.00 0.00 H ATOM 20577 H7S OL 543 93.217 41.935 46.957 1.00 0.00 H ATOM 20578 C18 OL 543 92.927 43.970 47.609 1.00 0.00 C ATOM 20579 H8R OL 543 93.245 44.396 46.655 1.00 0.00 H ATOM 20580 H8S OL 543 91.838 43.895 47.575 1.00 0.00 H ATOM 20581 C19 OL 543 93.297 44.916 48.716 1.00 0.00 C ATOM 20582 H9R OL 543 94.282 44.842 49.169 1.00 0.00 H ATOM 20583 C110 OL 543 92.543 45.769 49.365 1.00 0.00 C ATOM 20584 H10R OL 543 92.992 46.346 50.170 1.00 0.00 H ATOM 20585 C111 OL 543 91.103 46.040 49.055 1.00 0.00 C ATOM 20586 H11R OL 543 90.820 45.502 48.148 1.00 0.00 H ATOM 20587 H11S OL 543 90.333 45.568 49.669 1.00 0.00 H ATOM 20588 C112 OL 543 90.785 47.535 48.763 1.00 0.00 C ATOM 20589 H12R OL 543 90.903 48.115 49.681 1.00 0.00 H ATOM 20590 H12S OL 543 91.534 47.924 48.070 1.00 0.00 H ATOM 20591 C113 OL 543 89.334 47.832 48.264 1.00 0.00 C ATOM 20592 H13R OL 543 88.960 47.210 47.448 1.00 0.00 H ATOM 20593 H13S OL 543 88.635 47.738 49.098 1.00 0.00 H ATOM 20594 C114 OL 543 89.318 49.196 47.633 1.00 0.00 C ATOM 20595 H14R OL 543 90.218 49.282 47.020 1.00 0.00 H ATOM 20596 H14S OL 543 88.415 49.429 47.064 1.00 0.00 H ATOM 20597 C115 OL 543 89.443 50.223 48.711 1.00 0.00 C ATOM 20598 H15R OL 543 90.332 49.978 49.296 1.00 0.00 H ATOM 20599 H15S OL 543 89.771 51.128 48.195 1.00 0.00 H ATOM 20600 C116 OL 543 88.195 50.583 49.499 1.00 0.00 C ATOM 20601 H16R OL 543 87.437 50.834 48.754 1.00 0.00 H ATOM 20602 H16S OL 543 87.792 49.646 49.890 1.00 0.00 H ATOM 20603 C117 OL 543 88.382 51.616 50.571 1.00 0.00 C ATOM 20604 H17R OL 543 88.637 52.614 50.208 1.00 0.00 H ATOM 20605 H17S OL 543 87.477 51.466 51.163 1.00 0.00 H ATOM 20606 C118 OL 543 89.375 51.220 51.588 1.00 0.00 C ATOM 20607 H18R OL 543 89.611 50.169 51.764 1.00 0.00 H ATOM 20608 H18S OL 543 89.220 51.704 52.555 1.00 0.00 H ATOM 20609 H18T OL 543 90.309 51.654 51.226 1.00 0.00 H TER 20610 OL 543 ATOM 20610 C116 PA 544 105.874 28.807 43.677 1.00 0.00 C ATOM 20611 H16R PA 544 106.472 28.303 44.439 1.00 0.00 H ATOM 20612 H16S PA 544 106.373 28.961 42.718 1.00 0.00 H ATOM 20613 H16T PA 544 105.081 28.083 43.476 1.00 0.00 H ATOM 20614 C115 PA 544 105.265 30.102 44.137 1.00 0.00 C ATOM 20615 H15R PA 544 104.535 29.915 44.928 1.00 0.00 H ATOM 20616 H15S PA 544 104.751 30.523 43.270 1.00 0.00 H ATOM 20617 C114 PA 544 106.341 31.038 44.742 1.00 0.00 C ATOM 20618 H14R PA 544 107.108 30.523 45.323 1.00 0.00 H ATOM 20619 H14S PA 544 105.773 31.590 45.494 1.00 0.00 H ATOM 20620 C113 PA 544 107.062 31.916 43.747 1.00 0.00 C ATOM 20621 H13R PA 544 106.272 32.459 43.224 1.00 0.00 H ATOM 20622 H13S PA 544 107.675 31.418 42.992 1.00 0.00 H ATOM 20623 C112 PA 544 107.900 32.948 44.452 1.00 0.00 C ATOM 20624 H12R PA 544 107.280 33.521 45.145 1.00 0.00 H ATOM 20625 H12S PA 544 108.372 33.644 43.755 1.00 0.00 H ATOM 20626 C111 PA 544 109.019 32.334 45.264 1.00 0.00 C ATOM 20627 H11R PA 544 109.523 31.558 44.684 1.00 0.00 H ATOM 20628 H11S PA 544 108.600 31.900 46.174 1.00 0.00 H ATOM 20629 C110 PA 544 110.190 33.270 45.525 1.00 0.00 C ATOM 20630 H10R PA 544 109.781 34.272 45.670 1.00 0.00 H ATOM 20631 H10S PA 544 110.866 33.243 44.668 1.00 0.00 H ATOM 20632 C19 PA 544 110.896 32.960 46.817 1.00 0.00 C ATOM 20633 H9R PA 544 111.182 31.911 46.717 1.00 0.00 H ATOM 20634 H9S PA 544 110.135 32.914 47.599 1.00 0.00 H ATOM 20635 C18 PA 544 112.130 33.820 47.213 1.00 0.00 C ATOM 20636 H8R PA 544 111.787 34.849 47.340 1.00 0.00 H ATOM 20637 H8S PA 544 112.835 33.760 46.381 1.00 0.00 H ATOM 20638 C17 PA 544 112.809 33.259 48.510 1.00 0.00 C ATOM 20639 H7R PA 544 113.126 32.267 48.184 1.00 0.00 H ATOM 20640 H7S PA 544 112.113 33.295 49.351 1.00 0.00 H ATOM 20641 C16 PA 544 114.154 33.999 48.854 1.00 0.00 C ATOM 20642 H6R PA 544 114.072 35.086 48.904 1.00 0.00 H ATOM 20643 H6S PA 544 114.835 33.776 48.030 1.00 0.00 H ATOM 20644 C15 PA 544 114.843 33.472 50.136 1.00 0.00 C ATOM 20645 H5R PA 544 114.852 32.386 50.023 1.00 0.00 H ATOM 20646 H5S PA 544 114.088 33.753 50.873 1.00 0.00 H ATOM 20647 C14 PA 544 116.148 34.254 50.459 1.00 0.00 C ATOM 20648 H4R PA 544 115.909 35.248 50.842 1.00 0.00 H ATOM 20649 H4S PA 544 116.802 34.394 49.595 1.00 0.00 H ATOM 20650 C13 PA 544 117.035 33.626 51.537 1.00 0.00 C ATOM 20651 H3R PA 544 117.919 34.258 51.649 1.00 0.00 H ATOM 20652 H3S PA 544 117.432 32.740 51.036 1.00 0.00 H ATOM 20653 C12 PA 544 116.398 33.289 52.917 1.00 0.00 C ATOM 20654 H2R PA 544 115.740 32.421 52.833 1.00 0.00 H ATOM 20655 H2S PA 544 115.723 34.106 53.180 1.00 0.00 H ATOM 20656 C11 PGR 545 117.429 32.913 53.922 1.00 0.00 C ATOM 20657 O12 PGR 545 117.907 31.835 54.024 1.00 0.00 O ATOM 20658 O11 PGR 545 117.852 34.005 54.590 1.00 0.00 O ATOM 20659 C1 PGR 545 118.879 33.902 55.540 1.00 0.00 C ATOM 20660 HR PGR 545 118.454 33.196 56.258 1.00 0.00 H ATOM 20661 HS PGR 545 119.008 34.853 56.063 1.00 0.00 H ATOM 20662 C2 PGR 545 120.284 33.389 55.070 1.00 0.00 C ATOM 20663 HX PGR 545 120.048 32.414 54.635 1.00 0.00 H ATOM 20664 C3 PGR 545 121.343 33.325 56.288 1.00 0.00 C ATOM 20665 HA PGR 545 122.141 32.614 56.059 1.00 0.00 H ATOM 20666 HB PGR 545 120.903 33.023 57.242 1.00 0.00 H ATOM 20667 O31 PGR 545 121.832 34.631 56.584 1.00 0.00 O ATOM 20668 P31 PGR 545 123.145 34.827 57.454 1.00 0.00 P ATOM 20669 O32 PGR 545 124.434 34.508 56.539 1.00 0.00 O ATOM 20670 C31 PGR 545 124.817 35.400 55.411 1.00 0.00 C ATOM 20671 H1A PGR 545 125.097 36.387 55.786 1.00 0.00 H ATOM 20672 H1B PGR 545 124.045 35.486 54.642 1.00 0.00 H ATOM 20673 C32 PGR 545 125.944 34.734 54.683 1.00 0.00 C ATOM 20674 H2A PGR 545 125.691 33.726 54.344 1.00 0.00 H ATOM 20675 O35 PGR 545 126.910 34.514 55.728 1.00 0.00 O ATOM 20676 HO5A PGR 545 126.303 34.252 56.444 1.00 0.00 H ATOM 20677 C33 PGR 545 126.535 35.569 53.623 1.00 0.00 C ATOM 20678 H3A PGR 545 127.352 35.033 53.133 1.00 0.00 H ATOM 20679 H3B PGR 545 125.703 35.682 52.923 1.00 0.00 H ATOM 20680 O33 PGR 545 123.275 36.246 57.883 1.00 0.00 O ATOM 20681 O34 PGR 545 123.120 33.773 58.495 1.00 0.00 O ATOM 20682 O21 PGR 545 120.749 34.390 54.104 1.00 0.00 O ATOM 20683 C21 PGR 545 121.834 34.060 53.349 1.00 0.00 C ATOM 20684 O22 PGR 545 122.544 33.109 53.565 1.00 0.00 O ATOM 20685 O36 PGR 545 127.009 36.833 54.252 1.00 0.00 O ATOM 20686 HO6A PGR 545 127.634 36.635 54.973 1.00 0.00 H ATOM 20687 C12 OL 546 122.035 35.232 52.409 1.00 0.00 C ATOM 20688 H2R OL 546 121.079 35.717 52.204 1.00 0.00 H ATOM 20689 H2S OL 546 122.499 36.028 52.995 1.00 0.00 H ATOM 20690 C13 OL 546 122.950 34.977 51.187 1.00 0.00 C ATOM 20691 H3R OL 546 123.159 35.972 50.788 1.00 0.00 H ATOM 20692 H3S OL 546 123.891 34.508 51.481 1.00 0.00 H ATOM 20693 C14 OL 546 122.118 34.066 50.172 1.00 0.00 C ATOM 20694 H4R OL 546 122.018 33.091 50.654 1.00 0.00 H ATOM 20695 H4S OL 546 121.071 34.348 50.041 1.00 0.00 H ATOM 20696 C15 OL 546 122.729 33.765 48.813 1.00 0.00 C ATOM 20697 H5R OL 546 122.085 33.190 48.144 1.00 0.00 H ATOM 20698 H5S OL 546 122.808 34.711 48.273 1.00 0.00 H ATOM 20699 C16 OL 546 124.238 33.420 48.883 1.00 0.00 C ATOM 20700 H6R OL 546 124.509 33.369 47.826 1.00 0.00 H ATOM 20701 H6S OL 546 124.813 34.262 49.273 1.00 0.00 H ATOM 20702 C17 OL 546 124.547 32.134 49.713 1.00 0.00 C ATOM 20703 H7R OL 546 124.477 32.166 50.802 1.00 0.00 H ATOM 20704 H7S OL 546 123.852 31.327 49.472 1.00 0.00 H ATOM 20705 C18 OL 546 125.836 31.549 49.268 1.00 0.00 C ATOM 20706 H8R OL 546 125.849 31.469 48.180 1.00 0.00 H ATOM 20707 H8S OL 546 126.670 32.184 49.575 1.00 0.00 H ATOM 20708 C19 OL 546 126.108 30.237 49.741 1.00 0.00 C ATOM 20709 H9R OL 546 126.684 30.424 50.644 1.00 0.00 H ATOM 20710 C110 OL 546 125.967 29.036 49.211 1.00 0.00 C ATOM 20711 H10R OL 546 126.463 28.171 49.644 1.00 0.00 H ATOM 20712 C111 OL 546 125.403 28.861 47.818 1.00 0.00 C ATOM 20713 H11R OL 546 124.691 28.033 47.810 1.00 0.00 H ATOM 20714 H11S OL 546 124.748 29.713 47.623 1.00 0.00 H ATOM 20715 C112 OL 546 126.462 28.841 46.745 1.00 0.00 C ATOM 20716 H12R OL 546 126.963 29.803 46.612 1.00 0.00 H ATOM 20717 H12S OL 546 127.292 28.208 47.067 1.00 0.00 H ATOM 20718 C113 OL 546 126.169 28.233 45.328 1.00 0.00 C ATOM 20719 H13R OL 546 125.410 28.751 44.737 1.00 0.00 H ATOM 20720 H13S OL 546 127.117 28.288 44.789 1.00 0.00 H ATOM 20721 C114 OL 546 125.575 26.742 45.278 1.00 0.00 C ATOM 20722 H14R OL 546 126.164 26.005 45.830 1.00 0.00 H ATOM 20723 H14S OL 546 124.600 26.847 45.757 1.00 0.00 H ATOM 20724 C115 OL 546 125.644 26.080 43.865 1.00 0.00 C ATOM 20725 H15R OL 546 125.033 25.176 43.908 1.00 0.00 H ATOM 20726 H15S OL 546 125.087 26.842 43.315 1.00 0.00 H ATOM 20727 C116 OL 546 127.022 25.607 43.470 1.00 0.00 C ATOM 20728 H16R OL 546 127.816 26.336 43.649 1.00 0.00 H ATOM 20729 H16S OL 546 127.242 24.682 44.007 1.00 0.00 H ATOM 20730 C117 OL 546 127.068 25.101 42.048 1.00 0.00 C ATOM 20731 H17R OL 546 126.329 24.331 41.816 1.00 0.00 H ATOM 20732 H17S OL 546 126.726 25.907 41.395 1.00 0.00 H ATOM 20733 C118 OL 546 128.446 24.690 41.609 1.00 0.00 C ATOM 20734 H18R OL 546 128.492 24.736 40.519 1.00 0.00 H ATOM 20735 H18S OL 546 128.627 23.623 41.752 1.00 0.00 H ATOM 20736 H18T OL 546 129.345 25.204 41.956 1.00 0.00 H TER 20737 OL 546 ATOM 20737 C116 PA 547 49.518 144.659 38.182 1.00 0.00 C ATOM 20738 H16R PA 547 48.996 143.705 38.284 1.00 0.00 H ATOM 20739 H16S PA 547 48.877 145.372 37.660 1.00 0.00 H ATOM 20740 H16T PA 547 49.641 144.992 39.215 1.00 0.00 H ATOM 20741 C115 PA 547 50.808 144.223 37.411 1.00 0.00 C ATOM 20742 H15R PA 547 51.503 143.664 38.040 1.00 0.00 H ATOM 20743 H15S PA 547 51.412 145.109 37.202 1.00 0.00 H ATOM 20744 C114 PA 547 50.740 143.464 36.123 1.00 0.00 C ATOM 20745 H14R PA 547 49.871 143.836 35.576 1.00 0.00 H ATOM 20746 H14S PA 547 50.476 142.428 36.346 1.00 0.00 H ATOM 20747 C113 PA 547 52.041 143.493 35.314 1.00 0.00 C ATOM 20748 H13R PA 547 52.231 144.503 34.946 1.00 0.00 H ATOM 20749 H13S PA 547 51.755 142.867 34.467 1.00 0.00 H ATOM 20750 C112 PA 547 53.296 142.847 35.866 1.00 0.00 C ATOM 20751 H12R PA 547 53.640 143.452 36.708 1.00 0.00 H ATOM 20752 H12S PA 547 54.078 142.808 35.105 1.00 0.00 H ATOM 20753 C111 PA 547 53.021 141.415 36.400 1.00 0.00 C ATOM 20754 H11R PA 547 52.555 140.848 35.591 1.00 0.00 H ATOM 20755 H11S PA 547 52.326 141.543 37.232 1.00 0.00 H ATOM 20756 C110 PA 547 54.245 140.599 36.837 1.00 0.00 C ATOM 20757 H10R PA 547 54.989 141.170 37.397 1.00 0.00 H ATOM 20758 H10S PA 547 54.663 140.280 35.880 1.00 0.00 H ATOM 20759 C19 PA 547 53.831 139.334 37.475 1.00 0.00 C ATOM 20760 H9R PA 547 53.466 138.586 36.769 1.00 0.00 H ATOM 20761 H9S PA 547 52.889 139.453 38.016 1.00 0.00 H ATOM 20762 C18 PA 547 54.974 138.681 38.398 1.00 0.00 C ATOM 20763 H8R PA 547 55.903 138.911 37.872 1.00 0.00 H ATOM 20764 H8S PA 547 54.917 137.591 38.392 1.00 0.00 H ATOM 20765 C17 PA 547 54.792 139.025 39.889 1.00 0.00 C ATOM 20766 H7R PA 547 53.864 138.669 40.340 1.00 0.00 H ATOM 20767 H7S PA 547 54.601 140.100 39.888 1.00 0.00 H ATOM 20768 C16 PA 547 55.958 138.695 40.815 1.00 0.00 C ATOM 20769 H6R PA 547 56.919 138.978 40.379 1.00 0.00 H ATOM 20770 H6S PA 547 55.950 137.610 40.945 1.00 0.00 H ATOM 20771 C15 PA 547 55.881 139.384 42.153 1.00 0.00 C ATOM 20772 H5R PA 547 55.131 138.806 42.697 1.00 0.00 H ATOM 20773 H5S PA 547 55.501 140.385 41.938 1.00 0.00 H ATOM 20774 C14 PA 547 57.238 139.401 42.878 1.00 0.00 C ATOM 20775 H4R PA 547 57.917 139.906 42.188 1.00 0.00 H ATOM 20776 H4S PA 547 57.629 138.415 43.139 1.00 0.00 H ATOM 20777 C13 PA 547 57.307 140.146 44.157 1.00 0.00 C ATOM 20778 H3R PA 547 56.572 139.687 44.821 1.00 0.00 H ATOM 20779 H3S PA 547 56.853 141.125 43.994 1.00 0.00 H ATOM 20780 C12 PA 547 58.701 140.375 44.803 1.00 0.00 C ATOM 20781 H2R PA 547 59.145 140.974 44.004 1.00 0.00 H ATOM 20782 H2S PA 547 59.168 139.402 44.970 1.00 0.00 H ATOM 20783 C11 PGR 548 58.743 141.252 46.079 1.00 0.00 C ATOM 20784 O12 PGR 548 59.837 141.597 46.512 1.00 0.00 O ATOM 20785 O11 PGR 548 57.482 141.501 46.649 1.00 0.00 O ATOM 20786 C1 PGR 548 57.158 142.055 47.956 1.00 0.00 C ATOM 20787 HR PGR 548 57.826 141.561 48.666 1.00 0.00 H ATOM 20788 HS PGR 548 56.115 141.777 48.128 1.00 0.00 H ATOM 20789 C2 PGR 548 57.190 143.574 48.038 1.00 0.00 C ATOM 20790 HX PGR 548 58.158 143.952 47.698 1.00 0.00 H ATOM 20791 C3 PGR 548 56.958 144.143 49.434 1.00 0.00 C ATOM 20792 HA PGR 548 56.660 145.194 49.404 1.00 0.00 H ATOM 20793 HB PGR 548 57.902 144.146 49.986 1.00 0.00 H ATOM 20794 O31 PGR 548 55.993 143.404 50.094 1.00 0.00 O ATOM 20795 P31 PGR 548 55.347 143.754 51.494 1.00 0.00 P ATOM 20796 O32 PGR 548 53.931 143.178 51.375 1.00 0.00 O ATOM 20797 C31 PGR 548 52.930 143.906 50.765 1.00 0.00 C ATOM 20798 H1A PGR 548 52.103 143.242 50.502 1.00 0.00 H ATOM 20799 H1B PGR 548 53.436 144.321 49.890 1.00 0.00 H ATOM 20800 C32 PGR 548 52.269 144.994 51.657 1.00 0.00 C ATOM 20801 H2A PGR 548 51.233 145.083 51.320 1.00 0.00 H ATOM 20802 O35 PGR 548 52.976 146.262 51.448 1.00 0.00 O ATOM 20803 HO5A PGR 548 53.894 145.945 51.522 1.00 0.00 H ATOM 20804 C33 PGR 548 52.367 144.609 53.175 1.00 0.00 C ATOM 20805 H3A PGR 548 52.434 143.518 53.151 1.00 0.00 H ATOM 20806 H3B PGR 548 53.265 145.001 53.658 1.00 0.00 H ATOM 20807 O33 PGR 548 56.104 143.002 52.615 1.00 0.00 O ATOM 20808 O34 PGR 548 55.308 145.235 51.546 1.00 0.00 O ATOM 20809 O21 PGR 548 56.162 144.071 47.168 1.00 0.00 O ATOM 20810 C21 PGR 548 56.375 144.114 45.836 1.00 0.00 C ATOM 20811 O22 PGR 548 57.499 144.057 45.355 1.00 0.00 O ATOM 20812 O36 PGR 548 51.152 144.906 53.851 1.00 0.00 O ATOM 20813 HO6A PGR 548 51.058 145.871 53.762 1.00 0.00 H ATOM 20814 C12 OL 549 55.073 144.325 45.068 1.00 0.00 C ATOM 20815 H2R OL 549 54.556 143.367 44.981 1.00 0.00 H ATOM 20816 H2S OL 549 54.465 144.814 45.833 1.00 0.00 H ATOM 20817 C13 OL 549 55.225 144.949 43.662 1.00 0.00 C ATOM 20818 H3R OL 549 54.191 145.159 43.379 1.00 0.00 H ATOM 20819 H3S OL 549 55.762 145.896 43.747 1.00 0.00 H ATOM 20820 C14 OL 549 55.881 144.069 42.562 1.00 0.00 C ATOM 20821 H4R OL 549 56.827 143.663 42.928 1.00 0.00 H ATOM 20822 H4S OL 549 55.251 143.203 42.348 1.00 0.00 H ATOM 20823 C15 OL 549 56.106 144.772 41.260 1.00 0.00 C ATOM 20824 H5R OL 549 55.176 145.092 40.786 1.00 0.00 H ATOM 20825 H5S OL 549 56.741 145.645 41.430 1.00 0.00 H ATOM 20826 C16 OL 549 56.820 143.829 40.275 1.00 0.00 C ATOM 20827 H6R OL 549 57.762 143.498 40.717 1.00 0.00 H ATOM 20828 H6S OL 549 56.178 142.951 40.178 1.00 0.00 H ATOM 20829 C17 OL 549 56.963 144.464 38.851 1.00 0.00 C ATOM 20830 H7R OL 549 57.446 143.738 38.194 1.00 0.00 H ATOM 20831 H7S OL 549 56.008 144.744 38.400 1.00 0.00 H ATOM 20832 C18 OL 549 57.741 145.756 38.806 1.00 0.00 C ATOM 20833 H8R OL 549 57.167 146.434 39.442 1.00 0.00 H ATOM 20834 H8S OL 549 58.710 145.686 39.305 1.00 0.00 H ATOM 20835 C19 OL 549 57.681 146.316 37.414 1.00 0.00 C ATOM 20836 H9R OL 549 56.732 146.256 36.888 1.00 0.00 H ATOM 20837 C110 OL 549 58.682 146.936 36.746 1.00 0.00 C ATOM 20838 H10R OL 549 58.510 147.321 35.744 1.00 0.00 H ATOM 20839 C111 OL 549 60.075 147.162 37.231 1.00 0.00 C ATOM 20840 H11R OL 549 60.173 146.576 38.148 1.00 0.00 H ATOM 20841 H11S OL 549 60.766 146.780 36.476 1.00 0.00 H ATOM 20842 C112 OL 549 60.414 148.646 37.469 1.00 0.00 C ATOM 20843 H12R OL 549 60.257 149.307 36.613 1.00 0.00 H ATOM 20844 H12S OL 549 59.728 148.901 38.279 1.00 0.00 H ATOM 20845 C113 OL 549 61.893 148.830 37.927 1.00 0.00 C ATOM 20846 H13R OL 549 62.129 149.840 38.268 1.00 0.00 H ATOM 20847 H13S OL 549 62.094 148.221 38.811 1.00 0.00 H ATOM 20848 C114 OL 549 62.929 148.365 36.893 1.00 0.00 C ATOM 20849 H14R OL 549 62.776 147.405 36.397 1.00 0.00 H ATOM 20850 H14S OL 549 62.980 149.122 36.107 1.00 0.00 H ATOM 20851 C115 OL 549 64.320 148.256 37.496 1.00 0.00 C ATOM 20852 H15R OL 549 64.573 149.226 37.930 1.00 0.00 H ATOM 20853 H15S OL 549 64.149 147.644 38.384 1.00 0.00 H ATOM 20854 C116 OL 549 65.415 147.807 36.619 1.00 0.00 C ATOM 20855 H16R OL 549 65.233 146.909 36.025 1.00 0.00 H ATOM 20856 H16S OL 549 65.388 148.614 35.884 1.00 0.00 H ATOM 20857 C117 OL 549 66.713 147.563 37.385 1.00 0.00 C ATOM 20858 H17R OL 549 66.540 146.873 38.213 1.00 0.00 H ATOM 20859 H17S OL 549 67.437 147.121 36.698 1.00 0.00 H ATOM 20860 C118 OL 549 67.392 148.793 37.894 1.00 0.00 C ATOM 20861 H18R OL 549 67.374 149.568 37.125 1.00 0.00 H ATOM 20862 H18S OL 549 68.406 148.495 38.167 1.00 0.00 H ATOM 20863 H18T OL 549 67.053 149.221 38.840 1.00 0.00 H TER 20864 OL 549 ATOM 20864 C116 PA 550 52.532 95.008 45.631 1.00 0.00 C ATOM 20865 H16R PA 550 52.280 95.190 44.584 1.00 0.00 H ATOM 20866 H16S PA 550 53.526 95.382 45.885 1.00 0.00 H ATOM 20867 H16T PA 550 51.740 95.535 46.169 1.00 0.00 H ATOM 20868 C115 PA 550 52.372 93.524 46.087 1.00 0.00 C ATOM 20869 H15R PA 550 52.393 93.507 47.178 1.00 0.00 H ATOM 20870 H15S PA 550 53.109 92.815 45.703 1.00 0.00 H ATOM 20871 C114 PA 550 51.065 92.893 45.560 1.00 0.00 C ATOM 20872 H14R PA 550 51.028 92.903 44.468 1.00 0.00 H ATOM 20873 H14S PA 550 50.225 93.509 45.887 1.00 0.00 H ATOM 20874 C113 PA 550 50.823 91.408 46.021 1.00 0.00 C ATOM 20875 H13R PA 550 51.510 90.792 45.438 1.00 0.00 H ATOM 20876 H13S PA 550 49.797 91.196 45.714 1.00 0.00 H ATOM 20877 C112 PA 550 51.164 91.204 47.508 1.00 0.00 C ATOM 20878 H12R PA 550 51.011 92.135 48.058 1.00 0.00 H ATOM 20879 H12S PA 550 52.247 91.061 47.509 1.00 0.00 H ATOM 20880 C111 PA 550 50.404 90.070 48.232 1.00 0.00 C ATOM 20881 H11R PA 550 50.848 89.182 47.778 1.00 0.00 H ATOM 20882 H11S PA 550 49.338 90.167 48.012 1.00 0.00 H ATOM 20883 C110 PA 550 50.710 89.720 49.678 1.00 0.00 C ATOM 20884 H10R PA 550 51.776 89.511 49.789 1.00 0.00 H ATOM 20885 H10S PA 550 50.295 88.747 49.952 1.00 0.00 H ATOM 20886 C19 PA 550 50.285 90.696 50.646 1.00 0.00 C ATOM 20887 H9R PA 550 49.230 90.975 50.611 1.00 0.00 H ATOM 20888 H9S PA 550 50.806 91.601 50.326 1.00 0.00 H ATOM 20889 C18 PA 550 50.620 90.344 52.097 1.00 0.00 C ATOM 20890 H8R PA 550 51.604 89.921 52.310 1.00 0.00 H ATOM 20891 H8S PA 550 49.974 89.593 52.556 1.00 0.00 H ATOM 20892 C17 PA 550 50.476 91.494 53.162 1.00 0.00 C ATOM 20893 H7R PA 550 50.761 91.214 54.178 1.00 0.00 H ATOM 20894 H7S PA 550 49.406 91.714 53.166 1.00 0.00 H ATOM 20895 C16 PA 550 51.133 92.835 52.726 1.00 0.00 C ATOM 20896 H6R PA 550 50.766 93.534 53.481 1.00 0.00 H ATOM 20897 H6S PA 550 50.826 93.205 51.746 1.00 0.00 H ATOM 20898 C15 PA 550 52.630 92.810 52.854 1.00 0.00 C ATOM 20899 H5R PA 550 52.877 93.679 52.241 1.00 0.00 H ATOM 20900 H5S PA 550 53.019 91.907 52.380 1.00 0.00 H ATOM 20901 C14 PA 550 53.158 92.898 54.267 1.00 0.00 C ATOM 20902 H4R PA 550 52.744 92.165 54.962 1.00 0.00 H ATOM 20903 H4S PA 550 53.007 93.877 54.727 1.00 0.00 H ATOM 20904 C13 PA 550 54.646 92.557 54.275 1.00 0.00 C ATOM 20905 H3R PA 550 55.292 93.095 53.577 1.00 0.00 H ATOM 20906 H3S PA 550 54.744 91.489 54.073 1.00 0.00 H ATOM 20907 C12 PA 550 55.370 92.589 55.605 1.00 0.00 C ATOM 20908 H2R PA 550 55.220 93.640 55.861 1.00 0.00 H ATOM 20909 H2S PA 550 56.401 92.231 55.568 1.00 0.00 H ATOM 20910 C11 PGR 551 54.664 91.923 56.742 1.00 0.00 C ATOM 20911 O12 PGR 551 54.086 92.484 57.649 1.00 0.00 O ATOM 20912 O11 PGR 551 54.705 90.674 56.403 1.00 0.00 O ATOM 20913 C1 PGR 551 54.489 89.763 57.534 1.00 0.00 C ATOM 20914 HR PGR 551 55.032 90.230 58.360 1.00 0.00 H ATOM 20915 HS PGR 551 54.841 88.752 57.313 1.00 0.00 H ATOM 20916 C2 PGR 551 52.904 89.730 57.851 1.00 0.00 C ATOM 20917 HX PGR 551 52.571 90.742 57.610 1.00 0.00 H ATOM 20918 C3 PGR 551 52.507 89.272 59.348 1.00 0.00 C ATOM 20919 HA PGR 551 51.420 89.268 59.466 1.00 0.00 H ATOM 20920 HB PGR 551 52.996 89.873 60.119 1.00 0.00 H ATOM 20921 O31 PGR 551 53.057 87.978 59.548 1.00 0.00 O ATOM 20922 P31 PGR 551 53.300 87.332 60.995 1.00 0.00 P ATOM 20923 O32 PGR 551 54.578 88.051 61.517 1.00 0.00 O ATOM 20924 C31 PGR 551 55.838 87.730 61.116 1.00 0.00 C ATOM 20925 H1A PGR 551 55.930 87.816 60.030 1.00 0.00 H ATOM 20926 H1B PGR 551 56.115 86.677 61.213 1.00 0.00 H ATOM 20927 C32 PGR 551 56.860 88.483 61.835 1.00 0.00 C ATOM 20928 H2A PGR 551 57.876 88.323 61.466 1.00 0.00 H ATOM 20929 O35 PGR 551 56.816 87.959 63.174 1.00 0.00 O ATOM 20930 HO5A PGR 551 57.197 87.079 63.001 1.00 0.00 H ATOM 20931 C33 PGR 551 56.458 89.976 61.795 1.00 0.00 C ATOM 20932 H3A PGR 551 56.356 90.258 60.744 1.00 0.00 H ATOM 20933 H3B PGR 551 55.448 90.080 62.200 1.00 0.00 H ATOM 20934 O33 PGR 551 52.210 87.797 61.848 1.00 0.00 O ATOM 20935 O34 PGR 551 53.493 85.866 61.003 1.00 0.00 O ATOM 20936 O21 PGR 551 52.300 88.928 56.826 1.00 0.00 O ATOM 20937 C21 PGR 551 51.053 89.132 56.516 1.00 0.00 C ATOM 20938 O22 PGR 551 50.297 89.906 57.065 1.00 0.00 O ATOM 20939 O36 PGR 551 57.484 90.671 62.534 1.00 0.00 O ATOM 20940 HO6A PGR 551 57.596 90.318 63.435 1.00 0.00 H ATOM 20941 C12 OL 552 50.539 88.337 55.384 1.00 0.00 C ATOM 20942 H2R OL 552 49.608 88.780 55.025 1.00 0.00 H ATOM 20943 H2S OL 552 51.285 88.136 54.612 1.00 0.00 H ATOM 20944 C13 OL 552 49.977 87.057 56.057 1.00 0.00 C ATOM 20945 H3R OL 552 50.856 86.570 56.482 1.00 0.00 H ATOM 20946 H3S OL 552 49.315 87.230 56.908 1.00 0.00 H ATOM 20947 C14 OL 552 49.207 86.050 55.181 1.00 0.00 C ATOM 20948 H4R OL 552 49.101 85.134 55.766 1.00 0.00 H ATOM 20949 H4S OL 552 48.177 86.368 55.008 1.00 0.00 H ATOM 20950 C15 OL 552 49.857 85.649 53.845 1.00 0.00 C ATOM 20951 H5R OL 552 49.723 86.380 53.045 1.00 0.00 H ATOM 20952 H5S OL 552 50.922 85.447 53.973 1.00 0.00 H ATOM 20953 C16 OL 552 49.213 84.348 53.279 1.00 0.00 C ATOM 20954 H6R OL 552 49.391 83.611 54.065 1.00 0.00 H ATOM 20955 H6S OL 552 48.152 84.599 53.213 1.00 0.00 H ATOM 20956 C17 OL 552 49.712 83.876 51.912 1.00 0.00 C ATOM 20957 H7R OL 552 49.373 84.447 51.045 1.00 0.00 H ATOM 20958 H7S OL 552 50.800 83.971 51.923 1.00 0.00 H ATOM 20959 C18 OL 552 49.354 82.455 51.578 1.00 0.00 C ATOM 20960 H8R OL 552 49.800 81.663 52.181 1.00 0.00 H ATOM 20961 H8S OL 552 48.263 82.433 51.634 1.00 0.00 H ATOM 20962 C19 OL 552 49.762 82.284 50.168 1.00 0.00 C ATOM 20963 H9R OL 552 50.795 82.001 49.982 1.00 0.00 H ATOM 20964 C110 OL 552 48.864 82.309 49.156 1.00 0.00 C ATOM 20965 H10R OL 552 49.276 82.138 48.165 1.00 0.00 H ATOM 20966 C111 OL 552 47.382 82.620 49.095 1.00 0.00 C ATOM 20967 H11R OL 552 46.824 82.522 50.029 1.00 0.00 H ATOM 20968 H11S OL 552 47.308 83.631 48.688 1.00 0.00 H ATOM 20969 C112 OL 552 46.731 81.701 47.983 1.00 0.00 C ATOM 20970 H12R OL 552 46.773 80.657 48.300 1.00 0.00 H ATOM 20971 H12S OL 552 45.660 81.839 47.824 1.00 0.00 H ATOM 20972 C113 OL 552 47.138 81.891 46.511 1.00 0.00 C ATOM 20973 H13R OL 552 46.775 82.833 46.095 1.00 0.00 H ATOM 20974 H13S OL 552 48.171 82.231 46.406 1.00 0.00 H ATOM 20975 C114 OL 552 46.763 80.660 45.670 1.00 0.00 C ATOM 20976 H14R OL 552 45.699 80.466 45.826 1.00 0.00 H ATOM 20977 H14S OL 552 47.042 80.970 44.661 1.00 0.00 H ATOM 20978 C115 OL 552 47.628 79.566 45.874 1.00 0.00 C ATOM 20979 H15R OL 552 48.654 79.909 45.726 1.00 0.00 H ATOM 20980 H15S OL 552 47.583 79.339 46.941 1.00 0.00 H ATOM 20981 C116 OL 552 47.303 78.310 45.123 1.00 0.00 C ATOM 20982 H16R OL 552 46.252 78.017 45.166 1.00 0.00 H ATOM 20983 H16S OL 552 47.543 78.510 44.077 1.00 0.00 H ATOM 20984 C117 OL 552 48.060 77.133 45.724 1.00 0.00 C ATOM 20985 H17R OL 552 49.144 77.250 45.672 1.00 0.00 H ATOM 20986 H17S OL 552 47.801 77.021 46.779 1.00 0.00 H ATOM 20987 C118 OL 552 47.743 75.777 45.031 1.00 0.00 C ATOM 20988 H18R OL 552 48.182 75.086 45.754 1.00 0.00 H ATOM 20989 H18S OL 552 48.385 75.662 44.155 1.00 0.00 H ATOM 20990 H18T OL 552 46.766 75.352 44.792 1.00 0.00 H TER 20991 OL 552 ATOM 20991 C116 PA 553 10.694 41.447 44.352 1.00 0.00 C ATOM 20992 H16R PA 553 11.144 40.981 43.473 1.00 0.00 H ATOM 20993 H16S PA 553 10.675 40.741 45.185 1.00 0.00 H ATOM 20994 H16T PA 553 11.320 42.280 44.679 1.00 0.00 H ATOM 20995 C115 PA 553 9.230 41.810 44.110 1.00 0.00 C ATOM 20996 H15R PA 553 9.120 42.291 43.136 1.00 0.00 H ATOM 20997 H15S PA 553 9.106 42.641 44.808 1.00 0.00 H ATOM 20998 C114 PA 553 8.231 40.715 44.286 1.00 0.00 C ATOM 20999 H14R PA 553 8.430 40.057 45.134 1.00 0.00 H ATOM 21000 H14S PA 553 8.397 40.068 43.422 1.00 0.00 H ATOM 21001 C113 PA 553 6.798 41.159 44.273 1.00 0.00 C ATOM 21002 H13R PA 553 6.555 41.764 43.397 1.00 0.00 H ATOM 21003 H13S PA 553 6.838 41.745 45.193 1.00 0.00 H ATOM 21004 C112 PA 553 5.752 40.016 44.432 1.00 0.00 C ATOM 21005 H12R PA 553 5.893 39.244 43.672 1.00 0.00 H ATOM 21006 H12S PA 553 4.754 40.318 44.110 1.00 0.00 H ATOM 21007 C111 PA 553 5.866 39.258 45.776 1.00 0.00 C ATOM 21008 H11R PA 553 5.603 39.852 46.654 1.00 0.00 H ATOM 21009 H11S PA 553 6.937 39.108 45.928 1.00 0.00 H ATOM 21010 C110 PA 553 5.097 37.926 45.659 1.00 0.00 C ATOM 21011 H10R PA 553 5.195 37.425 44.694 1.00 0.00 H ATOM 21012 H10S PA 553 4.016 38.062 45.724 1.00 0.00 H ATOM 21013 C19 PA 553 5.590 37.036 46.715 1.00 0.00 C ATOM 21014 H9R PA 553 6.657 36.956 46.496 1.00 0.00 H ATOM 21015 H9S PA 553 5.035 36.100 46.616 1.00 0.00 H ATOM 21016 C18 PA 553 5.318 37.548 48.164 1.00 0.00 C ATOM 21017 H8R PA 553 4.240 37.520 48.337 1.00 0.00 H ATOM 21018 H8S PA 553 5.573 38.608 48.229 1.00 0.00 H ATOM 21019 C17 PA 553 5.993 36.748 49.300 1.00 0.00 C ATOM 21020 H7R PA 553 5.612 37.089 50.265 1.00 0.00 H ATOM 21021 H7S PA 553 7.076 36.882 49.336 1.00 0.00 H ATOM 21022 C16 PA 553 5.671 35.185 49.413 1.00 0.00 C ATOM 21023 H6R PA 553 6.175 34.665 48.596 1.00 0.00 H ATOM 21024 H6S PA 553 4.605 35.076 49.202 1.00 0.00 H ATOM 21025 C15 PA 553 6.066 34.599 50.794 1.00 0.00 C ATOM 21026 H5R PA 553 5.782 33.560 50.974 1.00 0.00 H ATOM 21027 H5S PA 553 5.470 35.142 51.530 1.00 0.00 H ATOM 21028 C14 PA 553 7.492 34.696 51.167 1.00 0.00 C ATOM 21029 H4R PA 553 7.935 35.647 50.863 1.00 0.00 H ATOM 21030 H4S PA 553 7.978 33.939 50.548 1.00 0.00 H ATOM 21031 C13 PA 553 7.795 34.449 52.610 1.00 0.00 C ATOM 21032 H3R PA 553 6.996 34.833 53.248 1.00 0.00 H ATOM 21033 H3S PA 553 8.670 34.982 52.989 1.00 0.00 H ATOM 21034 C12 PA 553 7.662 32.964 52.815 1.00 0.00 C ATOM 21035 H2R PA 553 8.513 32.456 52.357 1.00 0.00 H ATOM 21036 H2S PA 553 6.822 32.552 52.252 1.00 0.00 H ATOM 21037 C11 PC 554 7.688 32.719 54.326 1.00 0.00 C ATOM 21038 O12 PC 554 8.669 32.535 54.988 1.00 0.00 O ATOM 21039 O11 PC 554 6.427 32.713 54.794 1.00 0.00 O ATOM 21040 C1 PC 554 6.205 32.041 56.145 1.00 0.00 C ATOM 21041 HR PC 554 5.451 32.550 56.751 1.00 0.00 H ATOM 21042 HS PC 554 7.143 31.922 56.693 1.00 0.00 H ATOM 21043 C2 PC 554 5.757 30.663 55.851 1.00 0.00 C ATOM 21044 HX PC 554 4.944 30.687 55.121 1.00 0.00 H ATOM 21045 C3 PC 554 5.237 29.826 57.064 1.00 0.00 C ATOM 21046 HA PC 554 5.080 28.787 56.764 1.00 0.00 H ATOM 21047 HB PC 554 4.304 30.326 57.337 1.00 0.00 H ATOM 21048 O31 PC 554 6.197 30.038 58.077 1.00 0.00 O ATOM 21049 P31 PC 554 5.856 29.575 59.518 1.00 0.00 P ATOM 21050 O32 PC 554 4.831 30.711 60.074 1.00 0.00 O ATOM 21051 C31 PC 554 5.175 32.028 60.031 1.00 0.00 C ATOM 21052 H1A PC 554 5.533 32.327 59.043 1.00 0.00 H ATOM 21053 H1B PC 554 6.048 32.137 60.680 1.00 0.00 H ATOM 21054 C32 PC 554 4.060 32.982 60.488 1.00 0.00 C ATOM 21055 H2A PC 554 3.262 32.995 59.744 1.00 0.00 H ATOM 21056 H2B PC 554 4.424 34.003 60.611 1.00 0.00 H ATOM 21057 N31 PC 554 3.396 32.866 61.836 1.00 0.00 N ATOM 21058 C33 PC 554 2.610 34.116 62.086 1.00 0.00 C ATOM 21059 H3A PC 554 1.956 33.938 62.942 1.00 0.00 H ATOM 21060 H3B PC 554 1.997 34.314 61.206 1.00 0.00 H ATOM 21061 H3C PC 554 3.325 34.911 62.302 1.00 0.00 H ATOM 21062 C34 PC 554 2.446 31.717 61.837 1.00 0.00 C ATOM 21063 H4A PC 554 2.091 31.558 62.856 1.00 0.00 H ATOM 21064 H4B PC 554 2.936 30.828 61.437 1.00 0.00 H ATOM 21065 H4C PC 554 1.582 31.925 61.204 1.00 0.00 H ATOM 21066 C35 PC 554 4.364 32.776 62.878 1.00 0.00 C ATOM 21067 H5A PC 554 3.811 32.927 63.806 1.00 0.00 H ATOM 21068 H5B PC 554 5.127 33.536 62.708 1.00 0.00 H ATOM 21069 H5C PC 554 4.870 31.809 62.885 1.00 0.00 H ATOM 21070 O33 PC 554 5.145 28.268 59.395 1.00 0.00 O ATOM 21071 O34 PC 554 7.095 29.663 60.270 1.00 0.00 O ATOM 21072 O21 PC 554 6.840 29.984 55.260 1.00 0.00 O ATOM 21073 C21 PC 554 6.512 28.944 54.476 1.00 0.00 C ATOM 21074 O22 PC 554 5.370 28.453 54.429 1.00 0.00 O ATOM 21075 C12 OL 555 7.677 28.345 53.659 1.00 0.00 C ATOM 21076 H2R OL 555 8.585 28.952 53.684 1.00 0.00 H ATOM 21077 H2S OL 555 7.888 27.409 54.181 1.00 0.00 H ATOM 21078 C13 OL 555 7.278 28.062 52.187 1.00 0.00 C ATOM 21079 H3R OL 555 6.273 27.641 52.256 1.00 0.00 H ATOM 21080 H3S OL 555 7.070 28.978 51.629 1.00 0.00 H ATOM 21081 C14 OL 555 8.211 27.160 51.350 1.00 0.00 C ATOM 21082 H4R OL 555 9.262 27.324 51.597 1.00 0.00 H ATOM 21083 H4S OL 555 8.150 26.169 51.805 1.00 0.00 H ATOM 21084 C15 OL 555 8.094 27.056 49.887 1.00 0.00 C ATOM 21085 H5R OL 555 8.874 26.364 49.563 1.00 0.00 H ATOM 21086 H5S OL 555 7.194 26.461 49.721 1.00 0.00 H ATOM 21087 C16 OL 555 8.231 28.409 49.126 1.00 0.00 C ATOM 21088 H6R OL 555 7.463 29.125 49.428 1.00 0.00 H ATOM 21089 H6S OL 555 9.218 28.831 49.325 1.00 0.00 H ATOM 21090 C17 OL 555 8.245 28.189 47.578 1.00 0.00 C ATOM 21091 H7R OL 555 9.251 27.865 47.301 1.00 0.00 H ATOM 21092 H7S OL 555 7.570 27.380 47.289 1.00 0.00 H ATOM 21093 C18 OL 555 7.905 29.456 46.826 1.00 0.00 C ATOM 21094 H8R OL 555 6.926 29.565 46.355 1.00 0.00 H ATOM 21095 H8S OL 555 7.935 30.336 47.473 1.00 0.00 H ATOM 21096 C19 OL 555 8.840 29.736 45.724 1.00 0.00 C ATOM 21097 H9R OL 555 9.676 30.333 46.078 1.00 0.00 H ATOM 21098 C110 OL 555 8.756 29.234 44.491 1.00 0.00 C ATOM 21099 H10R OL 555 9.557 29.394 43.774 1.00 0.00 H ATOM 21100 C111 OL 555 7.665 28.304 43.939 1.00 0.00 C ATOM 21101 H11R OL 555 8.257 27.480 43.537 1.00 0.00 H ATOM 21102 H11S OL 555 6.986 27.968 44.725 1.00 0.00 H ATOM 21103 C112 OL 555 6.834 28.978 42.818 1.00 0.00 C ATOM 21104 H12R OL 555 6.980 30.059 42.861 1.00 0.00 H ATOM 21105 H12S OL 555 7.310 28.689 41.878 1.00 0.00 H ATOM 21106 C113 OL 555 5.296 28.654 42.765 1.00 0.00 C ATOM 21107 H13R OL 555 5.191 27.595 42.520 1.00 0.00 H ATOM 21108 H13S OL 555 4.780 28.869 43.704 1.00 0.00 H ATOM 21109 C114 OL 555 4.636 29.491 41.691 1.00 0.00 C ATOM 21110 H14R OL 555 3.562 29.316 41.592 1.00 0.00 H ATOM 21111 H14S OL 555 4.741 30.522 42.034 1.00 0.00 H ATOM 21112 C115 OL 555 5.184 29.230 40.262 1.00 0.00 C ATOM 21113 H15R OL 555 6.260 29.306 40.093 1.00 0.00 H ATOM 21114 H15S OL 555 5.112 28.154 40.093 1.00 0.00 H ATOM 21115 C116 OL 555 4.502 30.010 39.256 1.00 0.00 C ATOM 21116 H16R OL 555 5.046 29.853 38.323 1.00 0.00 H ATOM 21117 H16S OL 555 3.467 29.718 39.066 1.00 0.00 H ATOM 21118 C117 OL 555 4.233 31.487 39.562 1.00 0.00 C ATOM 21119 H17R OL 555 3.744 31.607 40.531 1.00 0.00 H ATOM 21120 H17S OL 555 5.150 32.081 39.565 1.00 0.00 H ATOM 21121 C118 OL 555 3.239 32.053 38.505 1.00 0.00 C ATOM 21122 H18R OL 555 3.574 31.671 37.539 1.00 0.00 H ATOM 21123 H18S OL 555 3.199 33.142 38.439 1.00 0.00 H ATOM 21124 H18T OL 555 2.291 31.519 38.607 1.00 0.00 H TER 21125 OL 555 ATOM 21125 C116 PA 556 101.719 82.543 41.736 1.00 0.00 C ATOM 21126 H16R PA 556 100.726 82.463 41.291 1.00 0.00 H ATOM 21127 H16S PA 556 101.809 81.526 42.123 1.00 0.00 H ATOM 21128 H16T PA 556 102.385 82.641 40.876 1.00 0.00 H ATOM 21129 C115 PA 556 101.720 83.483 42.905 1.00 0.00 C ATOM 21130 H15R PA 556 100.947 83.206 43.625 1.00 0.00 H ATOM 21131 H15S PA 556 101.354 84.390 42.418 1.00 0.00 H ATOM 21132 C114 PA 556 103.051 83.599 43.562 1.00 0.00 C ATOM 21133 H14R PA 556 103.714 84.094 42.849 1.00 0.00 H ATOM 21134 H14S PA 556 103.585 82.665 43.746 1.00 0.00 H ATOM 21135 C113 PA 556 102.996 84.573 44.792 1.00 0.00 C ATOM 21136 H13R PA 556 102.851 85.588 44.414 1.00 0.00 H ATOM 21137 H13S PA 556 104.023 84.626 45.158 1.00 0.00 H ATOM 21138 C112 PA 556 102.109 84.122 45.974 1.00 0.00 C ATOM 21139 H12R PA 556 102.305 83.069 46.187 1.00 0.00 H ATOM 21140 H12S PA 556 101.063 84.212 45.674 1.00 0.00 H ATOM 21141 C111 PA 556 102.374 84.948 47.286 1.00 0.00 C ATOM 21142 H11R PA 556 102.353 85.925 46.798 1.00 0.00 H ATOM 21143 H11S PA 556 103.324 84.702 47.764 1.00 0.00 H ATOM 21144 C110 PA 556 101.280 84.818 48.356 1.00 0.00 C ATOM 21145 H10R PA 556 101.508 83.782 48.613 1.00 0.00 H ATOM 21146 H10S PA 556 100.301 84.815 47.872 1.00 0.00 H ATOM 21147 C19 PA 556 101.431 85.696 49.626 1.00 0.00 C ATOM 21148 H9R PA 556 101.477 86.749 49.340 1.00 0.00 H ATOM 21149 H9S PA 556 102.393 85.615 50.137 1.00 0.00 H ATOM 21150 C18 PA 556 100.334 85.678 50.706 1.00 0.00 C ATOM 21151 H8R PA 556 100.364 84.644 51.057 1.00 0.00 H ATOM 21152 H8S PA 556 99.351 85.710 50.232 1.00 0.00 H ATOM 21153 C17 PA 556 100.629 86.775 51.781 1.00 0.00 C ATOM 21154 H7R PA 556 100.417 87.761 51.362 1.00 0.00 H ATOM 21155 H7S PA 556 101.678 86.765 52.083 1.00 0.00 H ATOM 21156 C16 PA 556 99.842 86.610 53.069 1.00 0.00 C ATOM 21157 H6R PA 556 99.956 85.545 53.282 1.00 0.00 H ATOM 21158 H6S PA 556 98.782 86.798 52.890 1.00 0.00 H ATOM 21159 C15 PA 556 100.470 87.464 54.106 1.00 0.00 C ATOM 21160 H5R PA 556 101.349 88.024 53.779 1.00 0.00 H ATOM 21161 H5S PA 556 100.788 86.873 54.967 1.00 0.00 H ATOM 21162 C14 PA 556 99.488 88.480 54.607 1.00 0.00 C ATOM 21163 H4R PA 556 98.788 87.869 55.181 1.00 0.00 H ATOM 21164 H4S PA 556 98.867 88.783 53.762 1.00 0.00 H ATOM 21165 C13 PA 556 99.901 89.681 55.556 1.00 0.00 C ATOM 21166 H3R PA 556 100.867 90.075 55.233 1.00 0.00 H ATOM 21167 H3S PA 556 100.100 89.285 56.553 1.00 0.00 H ATOM 21168 C12 PA 556 98.820 90.761 55.650 1.00 0.00 C ATOM 21169 H2R PA 556 97.894 90.433 56.127 1.00 0.00 H ATOM 21170 H2S PA 556 98.408 91.045 54.680 1.00 0.00 H ATOM 21171 C11 PC 557 99.136 92.035 56.498 1.00 0.00 C ATOM 21172 O12 PC 557 100.237 92.389 56.847 1.00 0.00 O ATOM 21173 O11 PC 557 98.003 92.718 56.753 1.00 0.00 O ATOM 21174 C1 PC 557 98.130 93.804 57.554 1.00 0.00 C ATOM 21175 HR PC 557 98.790 94.485 57.011 1.00 0.00 H ATOM 21176 HS PC 557 98.518 93.714 58.571 1.00 0.00 H ATOM 21177 C2 PC 557 96.723 94.392 57.781 1.00 0.00 C ATOM 21178 HX PC 557 96.982 95.284 58.356 1.00 0.00 H ATOM 21179 C3 PC 557 95.804 93.494 58.623 1.00 0.00 C ATOM 21180 HA PC 557 96.296 92.628 59.073 1.00 0.00 H ATOM 21181 HB PC 557 94.917 93.225 58.044 1.00 0.00 H ATOM 21182 O31 PC 557 95.348 94.354 59.674 1.00 0.00 O ATOM 21183 P31 PC 557 94.484 93.802 60.865 1.00 0.00 P ATOM 21184 O32 PC 557 93.088 93.678 60.200 1.00 0.00 O ATOM 21185 C31 PC 557 92.354 94.823 60.018 1.00 0.00 C ATOM 21186 H1A PC 557 92.961 95.396 59.313 1.00 0.00 H ATOM 21187 H1B PC 557 92.191 95.346 60.964 1.00 0.00 H ATOM 21188 C32 PC 557 91.083 94.433 59.340 1.00 0.00 C ATOM 21189 H2A PC 557 91.333 93.826 58.469 1.00 0.00 H ATOM 21190 H2B PC 557 90.560 95.362 59.108 1.00 0.00 H ATOM 21191 N31 PC 557 90.148 93.537 60.024 1.00 0.00 N ATOM 21192 C33 PC 557 88.918 93.568 59.240 1.00 0.00 C ATOM 21193 H3A PC 557 88.425 94.460 59.628 1.00 0.00 H ATOM 21194 H3B PC 557 88.300 92.684 59.404 1.00 0.00 H ATOM 21195 H3C PC 557 89.063 93.793 58.182 1.00 0.00 H ATOM 21196 C34 PC 557 90.651 92.051 60.160 1.00 0.00 C ATOM 21197 H4A PC 557 91.585 92.093 60.723 1.00 0.00 H ATOM 21198 H4B PC 557 90.849 91.689 59.151 1.00 0.00 H ATOM 21199 H4C PC 557 89.858 91.479 60.644 1.00 0.00 H ATOM 21200 C35 PC 557 89.978 93.995 61.468 1.00 0.00 C ATOM 21201 H5A PC 557 90.997 94.040 61.855 1.00 0.00 H ATOM 21202 H5B PC 557 89.283 93.354 62.012 1.00 0.00 H ATOM 21203 H5C PC 557 89.589 95.014 61.474 1.00 0.00 H ATOM 21204 O33 PC 557 94.832 92.373 61.213 1.00 0.00 O ATOM 21205 O34 PC 557 94.458 94.783 61.971 1.00 0.00 O ATOM 21206 O21 PC 557 96.169 94.732 56.488 1.00 0.00 O ATOM 21207 C21 PC 557 96.653 95.760 55.733 1.00 0.00 C ATOM 21208 O22 PC 557 97.625 96.336 56.139 1.00 0.00 O ATOM 21209 C12 OL 558 95.945 95.821 54.468 1.00 0.00 C ATOM 21210 H2R OL 558 96.091 94.913 53.879 1.00 0.00 H ATOM 21211 H2S OL 558 94.888 95.706 54.717 1.00 0.00 H ATOM 21212 C13 OL 558 96.284 97.154 53.731 1.00 0.00 C ATOM 21213 H3R OL 558 95.503 97.364 52.996 1.00 0.00 H ATOM 21214 H3S OL 558 96.124 97.946 54.466 1.00 0.00 H ATOM 21215 C14 OL 558 97.664 97.191 53.062 1.00 0.00 C ATOM 21216 H4R OL 558 97.713 97.972 52.300 1.00 0.00 H ATOM 21217 H4S OL 558 98.343 97.506 53.857 1.00 0.00 H ATOM 21218 C15 OL 558 98.054 95.950 52.250 1.00 0.00 C ATOM 21219 H5R OL 558 99.025 96.174 51.803 1.00 0.00 H ATOM 21220 H5S OL 558 98.144 95.216 53.053 1.00 0.00 H ATOM 21221 C16 OL 558 97.087 95.407 51.194 1.00 0.00 C ATOM 21222 H6R OL 558 96.094 95.264 51.626 1.00 0.00 H ATOM 21223 H6S OL 558 96.888 96.117 50.388 1.00 0.00 H ATOM 21224 C17 OL 558 97.501 94.041 50.615 1.00 0.00 C ATOM 21225 H7R OL 558 98.557 94.004 50.340 1.00 0.00 H ATOM 21226 H7S OL 558 97.373 93.223 51.328 1.00 0.00 H ATOM 21227 C18 OL 558 96.597 93.672 49.469 1.00 0.00 C ATOM 21228 H8R OL 558 95.563 93.572 49.808 1.00 0.00 H ATOM 21229 H8S OL 558 96.669 94.476 48.734 1.00 0.00 H ATOM 21230 C19 OL 558 97.173 92.448 48.781 1.00 0.00 C ATOM 21231 H9R OL 558 98.188 92.544 48.406 1.00 0.00 H ATOM 21232 C110 OL 558 96.479 91.353 48.438 1.00 0.00 C ATOM 21233 H10R OL 558 97.056 90.625 47.875 1.00 0.00 H ATOM 21234 C111 OL 558 95.052 91.029 48.686 1.00 0.00 C ATOM 21235 H11R OL 558 94.589 91.762 49.350 1.00 0.00 H ATOM 21236 H11S OL 558 94.627 90.939 47.685 1.00 0.00 H ATOM 21237 C112 OL 558 94.953 89.665 49.309 1.00 0.00 C ATOM 21238 H12R OL 558 95.192 88.959 48.511 1.00 0.00 H ATOM 21239 H12S OL 558 93.903 89.419 49.477 1.00 0.00 H ATOM 21240 C113 OL 558 95.646 89.282 50.626 1.00 0.00 C ATOM 21241 H13R OL 558 95.333 88.283 50.936 1.00 0.00 H ATOM 21242 H13S OL 558 96.685 89.061 50.374 1.00 0.00 H ATOM 21243 C114 OL 558 95.536 90.381 51.652 1.00 0.00 C ATOM 21244 H14R OL 558 96.282 90.218 52.431 1.00 0.00 H ATOM 21245 H14S OL 558 95.973 91.348 51.397 1.00 0.00 H ATOM 21246 C115 OL 558 94.050 90.481 52.199 1.00 0.00 C ATOM 21247 H15R OL 558 93.195 90.534 51.520 1.00 0.00 H ATOM 21248 H15S OL 558 93.823 89.544 52.712 1.00 0.00 H ATOM 21249 C116 OL 558 93.734 91.674 52.973 1.00 0.00 C ATOM 21250 H16R OL 558 94.656 92.000 53.458 1.00 0.00 H ATOM 21251 H16S OL 558 93.437 92.538 52.374 1.00 0.00 H ATOM 21252 C117 OL 558 92.625 91.382 53.941 1.00 0.00 C ATOM 21253 H17R OL 558 92.936 90.649 54.688 1.00 0.00 H ATOM 21254 H17S OL 558 92.487 92.275 54.554 1.00 0.00 H ATOM 21255 C118 OL 558 91.360 90.897 53.344 1.00 0.00 C ATOM 21256 H18R OL 558 91.453 90.048 52.663 1.00 0.00 H ATOM 21257 H18S OL 558 90.952 91.742 52.786 1.00 0.00 H ATOM 21258 H18T OL 558 90.626 90.687 54.124 1.00 0.00 H TER 21259 OL 558 ATOM 21259 C116 PA 559 114.838 19.686 31.549 1.00 0.00 C ATOM 21260 H16R PA 559 114.984 18.759 30.991 1.00 0.00 H ATOM 21261 H16S PA 559 115.789 20.222 31.556 1.00 0.00 H ATOM 21262 H16T PA 559 114.100 20.248 30.973 1.00 0.00 H ATOM 21263 C115 PA 559 114.431 19.395 32.997 1.00 0.00 C ATOM 21264 H15R PA 559 113.383 19.088 33.021 1.00 0.00 H ATOM 21265 H15S PA 559 114.426 20.308 33.595 1.00 0.00 H ATOM 21266 C114 PA 559 115.302 18.391 33.790 1.00 0.00 C ATOM 21267 H14R PA 559 116.309 18.778 33.622 1.00 0.00 H ATOM 21268 H14S PA 559 115.313 17.387 33.361 1.00 0.00 H ATOM 21269 C113 PA 559 115.026 18.198 35.275 1.00 0.00 C ATOM 21270 H13R PA 559 114.014 17.837 35.471 1.00 0.00 H ATOM 21271 H13S PA 559 115.073 19.207 35.691 1.00 0.00 H ATOM 21272 C112 PA 559 116.047 17.378 36.121 1.00 0.00 C ATOM 21273 H12R PA 559 117.016 17.881 36.135 1.00 0.00 H ATOM 21274 H12S PA 559 116.291 16.442 35.615 1.00 0.00 H ATOM 21275 C111 PA 559 115.497 17.067 37.508 1.00 0.00 C ATOM 21276 H11R PA 559 116.106 16.395 38.116 1.00 0.00 H ATOM 21277 H11S PA 559 114.524 16.583 37.406 1.00 0.00 H ATOM 21278 C110 PA 559 115.307 18.390 38.334 1.00 0.00 C ATOM 21279 H10R PA 559 114.462 18.889 37.855 1.00 0.00 H ATOM 21280 H10S PA 559 116.253 18.934 38.359 1.00 0.00 H ATOM 21281 C19 PA 559 115.043 18.145 39.847 1.00 0.00 C ATOM 21282 H9R PA 559 114.152 17.540 40.032 1.00 0.00 H ATOM 21283 H9S PA 559 114.814 19.149 40.211 1.00 0.00 H ATOM 21284 C18 PA 559 116.131 17.698 40.767 1.00 0.00 C ATOM 21285 H8R PA 559 117.077 18.231 40.643 1.00 0.00 H ATOM 21286 H8S PA 559 116.484 16.680 40.591 1.00 0.00 H ATOM 21287 C17 PA 559 115.826 17.858 42.256 1.00 0.00 C ATOM 21288 H7R PA 559 116.667 17.440 42.814 1.00 0.00 H ATOM 21289 H7S PA 559 115.097 17.065 42.434 1.00 0.00 H ATOM 21290 C16 PA 559 115.281 19.214 42.819 1.00 0.00 C ATOM 21291 H6R PA 559 114.251 19.388 42.501 1.00 0.00 H ATOM 21292 H6S PA 559 115.913 19.997 42.395 1.00 0.00 H ATOM 21293 C15 PA 559 115.273 19.375 44.354 1.00 0.00 C ATOM 21294 H5R PA 559 114.467 18.712 44.675 1.00 0.00 H ATOM 21295 H5S PA 559 115.016 20.414 44.567 1.00 0.00 H ATOM 21296 C14 PA 559 116.542 18.945 45.061 1.00 0.00 C ATOM 21297 H4R PA 559 117.416 19.501 44.717 1.00 0.00 H ATOM 21298 H4S PA 559 116.986 17.951 44.964 1.00 0.00 H ATOM 21299 C13 PA 559 116.282 19.011 46.583 1.00 0.00 C ATOM 21300 H3R PA 559 115.593 18.208 46.854 1.00 0.00 H ATOM 21301 H3S PA 559 115.737 19.926 46.823 1.00 0.00 H ATOM 21302 C12 PA 559 117.585 18.907 47.365 1.00 0.00 C ATOM 21303 H2R PA 559 118.230 19.743 47.085 1.00 0.00 H ATOM 21304 H2S PA 559 118.103 18.023 46.988 1.00 0.00 H ATOM 21305 C11 PC 560 117.485 18.775 48.803 1.00 0.00 C ATOM 21306 O12 PC 560 116.549 18.275 49.398 1.00 0.00 O ATOM 21307 O11 PC 560 118.709 18.973 49.381 1.00 0.00 O ATOM 21308 C1 PC 560 118.872 18.580 50.787 1.00 0.00 C ATOM 21309 HR PC 560 118.032 19.014 51.334 1.00 0.00 H ATOM 21310 HS PC 560 119.773 19.028 51.215 1.00 0.00 H ATOM 21311 C2 PC 560 118.730 17.025 50.921 1.00 0.00 C ATOM 21312 HX PC 560 118.100 16.591 50.140 1.00 0.00 H ATOM 21313 C3 PC 560 118.134 16.696 52.269 1.00 0.00 C ATOM 21314 HA PC 560 118.082 15.615 52.417 1.00 0.00 H ATOM 21315 HB PC 560 117.114 17.089 52.271 1.00 0.00 H ATOM 21316 O31 PC 560 118.841 17.329 53.400 1.00 0.00 O ATOM 21317 P31 PC 560 118.450 16.902 54.927 1.00 0.00 P ATOM 21318 O32 PC 560 119.139 15.508 55.091 1.00 0.00 O ATOM 21319 C31 PC 560 120.473 15.531 55.244 1.00 0.00 C ATOM 21320 H1A PC 560 120.648 16.060 56.184 1.00 0.00 H ATOM 21321 H1B PC 560 120.997 16.001 54.409 1.00 0.00 H ATOM 21322 C32 PC 560 120.924 14.076 55.356 1.00 0.00 C ATOM 21323 H2A PC 560 121.997 14.041 55.164 1.00 0.00 H ATOM 21324 H2B PC 560 120.337 13.707 54.514 1.00 0.00 H ATOM 21325 N31 PC 560 120.447 13.229 56.466 1.00 0.00 N ATOM 21326 C33 PC 560 120.857 11.853 56.174 1.00 0.00 C ATOM 21327 H3A PC 560 120.181 11.146 56.656 1.00 0.00 H ATOM 21328 H3B PC 560 121.877 11.727 56.540 1.00 0.00 H ATOM 21329 H3C PC 560 120.681 11.624 55.122 1.00 0.00 H ATOM 21330 C34 PC 560 120.959 13.743 57.769 1.00 0.00 C ATOM 21331 H4A PC 560 120.689 14.796 57.859 1.00 0.00 H ATOM 21332 H4B PC 560 122.043 13.628 57.711 1.00 0.00 H ATOM 21333 H4C PC 560 120.475 13.105 58.510 1.00 0.00 H ATOM 21334 C35 PC 560 118.971 13.070 56.327 1.00 0.00 C ATOM 21335 H5A PC 560 118.883 12.782 55.278 1.00 0.00 H ATOM 21336 H5B PC 560 118.398 13.963 56.583 1.00 0.00 H ATOM 21337 H5C PC 560 118.545 12.255 56.913 1.00 0.00 H ATOM 21338 O33 PC 560 119.048 17.848 55.835 1.00 0.00 O ATOM 21339 O34 PC 560 116.999 16.708 54.937 1.00 0.00 O ATOM 21340 O21 PC 560 120.110 16.506 50.686 1.00 0.00 O ATOM 21341 C21 PC 560 120.375 15.190 50.809 1.00 0.00 C ATOM 21342 O22 PC 560 119.528 14.411 50.987 1.00 0.00 O ATOM 21343 C12 OL 561 121.847 14.747 50.666 1.00 0.00 C ATOM 21344 H2R OL 561 122.312 15.711 50.885 1.00 0.00 H ATOM 21345 H2S OL 561 122.059 14.068 51.494 1.00 0.00 H ATOM 21346 C13 OL 561 122.277 14.167 49.339 1.00 0.00 C ATOM 21347 H3R OL 561 121.707 13.245 49.200 1.00 0.00 H ATOM 21348 H3S OL 561 122.076 14.882 48.538 1.00 0.00 H ATOM 21349 C14 OL 561 123.754 13.850 49.246 1.00 0.00 C ATOM 21350 H4R OL 561 124.337 14.768 49.341 1.00 0.00 H ATOM 21351 H4S OL 561 124.154 13.296 50.098 1.00 0.00 H ATOM 21352 C15 OL 561 124.121 13.061 48.002 1.00 0.00 C ATOM 21353 H5R OL 561 125.157 12.763 48.176 1.00 0.00 H ATOM 21354 H5S OL 561 123.501 12.162 47.999 1.00 0.00 H ATOM 21355 C16 OL 561 124.071 13.880 46.674 1.00 0.00 C ATOM 21356 H6R OL 561 123.084 14.326 46.531 1.00 0.00 H ATOM 21357 H6S OL 561 124.694 14.776 46.634 1.00 0.00 H ATOM 21358 C17 OL 561 124.456 13.108 45.433 1.00 0.00 C ATOM 21359 H7R OL 561 124.607 13.824 44.623 1.00 0.00 H ATOM 21360 H7S OL 561 125.443 12.684 45.630 1.00 0.00 H ATOM 21361 C18 OL 561 123.512 12.026 44.981 1.00 0.00 C ATOM 21362 H8R OL 561 123.055 11.511 45.828 1.00 0.00 H ATOM 21363 H8S OL 561 122.727 12.510 44.397 1.00 0.00 H ATOM 21364 C19 OL 561 124.045 10.900 44.202 1.00 0.00 C ATOM 21365 H9R OL 561 124.944 10.479 44.643 1.00 0.00 H ATOM 21366 C110 OL 561 123.575 10.321 43.108 1.00 0.00 C ATOM 21367 H10R OL 561 124.088 9.436 42.741 1.00 0.00 H ATOM 21368 C111 OL 561 122.369 10.763 42.251 1.00 0.00 C ATOM 21369 H11R OL 561 122.349 11.854 42.294 1.00 0.00 H ATOM 21370 H11S OL 561 122.624 10.470 41.230 1.00 0.00 H ATOM 21371 C112 OL 561 121.016 10.139 42.662 1.00 0.00 C ATOM 21372 H12R OL 561 121.150 9.094 42.949 1.00 0.00 H ATOM 21373 H12S OL 561 120.813 10.739 43.552 1.00 0.00 H ATOM 21374 C113 OL 561 119.872 10.169 41.573 1.00 0.00 C ATOM 21375 H13R OL 561 120.318 9.759 40.664 1.00 0.00 H ATOM 21376 H13S OL 561 119.128 9.544 42.072 1.00 0.00 H ATOM 21377 C114 OL 561 119.425 11.562 41.150 1.00 0.00 C ATOM 21378 H14R OL 561 120.398 11.974 40.872 1.00 0.00 H ATOM 21379 H14S OL 561 118.720 11.576 40.316 1.00 0.00 H ATOM 21380 C115 OL 561 118.910 12.420 42.335 1.00 0.00 C ATOM 21381 H15R OL 561 118.924 11.833 43.257 1.00 0.00 H ATOM 21382 H15S OL 561 119.598 13.254 42.485 1.00 0.00 H ATOM 21383 C116 OL 561 117.570 13.087 42.061 1.00 0.00 C ATOM 21384 H16R OL 561 117.617 13.730 41.179 1.00 0.00 H ATOM 21385 H16S OL 561 116.795 12.370 41.783 1.00 0.00 H ATOM 21386 C117 OL 561 116.975 13.899 43.175 1.00 0.00 C ATOM 21387 H17R OL 561 115.996 14.266 42.861 1.00 0.00 H ATOM 21388 H17S OL 561 116.789 13.100 43.897 1.00 0.00 H ATOM 21389 C118 OL 561 117.871 15.012 43.664 1.00 0.00 C ATOM 21390 H18R OL 561 118.046 15.786 42.914 1.00 0.00 H ATOM 21391 H18S OL 561 118.867 14.696 43.980 1.00 0.00 H ATOM 21392 H18T OL 561 117.355 15.593 44.431 1.00 0.00 H TER 21393 OL 561 ATOM 21393 C116 PA 562 81.494 119.795 41.504 1.00 0.00 C ATOM 21394 H16R PA 562 81.690 120.255 40.533 1.00 0.00 H ATOM 21395 H16S PA 562 81.568 120.607 42.230 1.00 0.00 H ATOM 21396 H16T PA 562 80.449 119.483 41.551 1.00 0.00 H ATOM 21397 C115 PA 562 82.554 118.679 41.795 1.00 0.00 C ATOM 21398 H15R PA 562 83.420 119.154 42.261 1.00 0.00 H ATOM 21399 H15S PA 562 82.966 118.191 40.909 1.00 0.00 H ATOM 21400 C114 PA 562 81.921 117.628 42.634 1.00 0.00 C ATOM 21401 H14R PA 562 81.057 117.306 42.048 1.00 0.00 H ATOM 21402 H14S PA 562 81.396 117.994 43.518 1.00 0.00 H ATOM 21403 C113 PA 562 82.821 116.448 43.078 1.00 0.00 C ATOM 21404 H13R PA 562 83.800 116.712 43.482 1.00 0.00 H ATOM 21405 H13S PA 562 82.968 115.784 42.224 1.00 0.00 H ATOM 21406 C112 PA 562 81.995 115.507 43.931 1.00 0.00 C ATOM 21407 H12R PA 562 81.788 115.834 44.952 1.00 0.00 H ATOM 21408 H12S PA 562 82.549 114.573 44.042 1.00 0.00 H ATOM 21409 C111 PA 562 80.618 114.972 43.451 1.00 0.00 C ATOM 21410 H11R PA 562 80.672 114.781 42.377 1.00 0.00 H ATOM 21411 H11S PA 562 79.957 115.839 43.518 1.00 0.00 H ATOM 21412 C110 PA 562 80.246 113.692 44.092 1.00 0.00 C ATOM 21413 H10R PA 562 80.047 113.746 45.164 1.00 0.00 H ATOM 21414 H10S PA 562 81.094 113.014 43.976 1.00 0.00 H ATOM 21415 C19 PA 562 78.995 113.109 43.505 1.00 0.00 C ATOM 21416 H9R PA 562 79.109 113.034 42.421 1.00 0.00 H ATOM 21417 H9S PA 562 78.105 113.707 43.711 1.00 0.00 H ATOM 21418 C18 PA 562 78.621 111.731 44.100 1.00 0.00 C ATOM 21419 H8R PA 562 79.404 110.969 44.100 1.00 0.00 H ATOM 21420 H8S PA 562 77.842 111.382 43.419 1.00 0.00 H ATOM 21421 C17 PA 562 78.031 111.777 45.505 1.00 0.00 C ATOM 21422 H7R PA 562 77.464 112.709 45.549 1.00 0.00 H ATOM 21423 H7S PA 562 78.825 111.772 46.255 1.00 0.00 H ATOM 21424 C16 PA 562 76.919 110.782 45.730 1.00 0.00 C ATOM 21425 H6R PA 562 77.289 109.759 45.628 1.00 0.00 H ATOM 21426 H6S PA 562 76.184 110.890 44.930 1.00 0.00 H ATOM 21427 C15 PA 562 76.342 111.053 47.097 1.00 0.00 C ATOM 21428 H5R PA 562 76.134 112.110 47.278 1.00 0.00 H ATOM 21429 H5S PA 562 77.159 110.879 47.800 1.00 0.00 H ATOM 21430 C14 PA 562 75.245 110.154 47.428 1.00 0.00 C ATOM 21431 H4R PA 562 75.696 109.175 47.252 1.00 0.00 H ATOM 21432 H4S PA 562 74.400 110.150 46.735 1.00 0.00 H ATOM 21433 C13 PA 562 74.812 110.293 48.853 1.00 0.00 C ATOM 21434 H3R PA 562 75.716 110.321 49.464 1.00 0.00 H ATOM 21435 H3S PA 562 74.285 109.416 49.235 1.00 0.00 H ATOM 21436 C12 PA 562 73.973 111.559 49.060 1.00 0.00 C ATOM 21437 H2R PA 562 73.106 111.581 48.397 1.00 0.00 H ATOM 21438 H2S PA 562 74.456 112.535 48.976 1.00 0.00 H ATOM 21439 C11 PC 563 73.377 111.678 50.422 1.00 0.00 C ATOM 21440 O12 PC 563 73.819 111.366 51.468 1.00 0.00 O ATOM 21441 O11 PC 563 72.242 112.350 50.314 1.00 0.00 O ATOM 21442 C1 PC 563 71.540 112.739 51.525 1.00 0.00 C ATOM 21443 HR PC 563 72.038 113.247 52.355 1.00 0.00 H ATOM 21444 HS PC 563 71.063 111.813 51.856 1.00 0.00 H ATOM 21445 C2 PC 563 70.297 113.630 51.198 1.00 0.00 C ATOM 21446 HX PC 563 70.571 114.469 50.554 1.00 0.00 H ATOM 21447 C3 PC 563 69.578 114.222 52.515 1.00 0.00 C ATOM 21448 HA PC 563 68.556 114.449 52.202 1.00 0.00 H ATOM 21449 HB PC 563 70.079 115.161 52.767 1.00 0.00 H ATOM 21450 O31 PC 563 69.587 113.380 53.662 1.00 0.00 O ATOM 21451 P31 PC 563 68.962 113.850 55.005 1.00 0.00 P ATOM 21452 O32 PC 563 67.890 112.865 55.407 1.00 0.00 O ATOM 21453 C31 PC 563 66.720 112.810 54.651 1.00 0.00 C ATOM 21454 H1A PC 563 67.037 112.240 53.774 1.00 0.00 H ATOM 21455 H1B PC 563 66.354 113.811 54.409 1.00 0.00 H ATOM 21456 C32 PC 563 65.642 111.982 55.466 1.00 0.00 C ATOM 21457 H2A PC 563 66.132 111.100 55.881 1.00 0.00 H ATOM 21458 H2B PC 563 64.868 111.732 54.740 1.00 0.00 H ATOM 21459 N31 PC 563 64.957 112.685 56.509 1.00 0.00 N ATOM 21460 C33 PC 563 64.104 113.744 55.973 1.00 0.00 C ATOM 21461 H3A PC 563 63.962 113.566 54.906 1.00 0.00 H ATOM 21462 H3B PC 563 64.549 114.730 56.119 1.00 0.00 H ATOM 21463 H3C PC 563 63.168 113.656 56.526 1.00 0.00 H ATOM 21464 C34 PC 563 64.051 111.714 57.169 1.00 0.00 C ATOM 21465 H4A PC 563 63.420 111.137 56.491 1.00 0.00 H ATOM 21466 H4B PC 563 63.377 112.368 57.724 1.00 0.00 H ATOM 21467 H4C PC 563 64.650 111.098 57.841 1.00 0.00 H ATOM 21468 C35 PC 563 65.937 113.248 57.469 1.00 0.00 C ATOM 21469 H5A PC 563 65.406 113.616 58.349 1.00 0.00 H ATOM 21470 H5B PC 563 66.453 114.068 56.968 1.00 0.00 H ATOM 21471 H5C PC 563 66.646 112.479 57.779 1.00 0.00 H ATOM 21472 O33 PC 563 70.119 113.605 55.933 1.00 0.00 O ATOM 21473 O34 PC 563 68.476 115.250 54.902 1.00 0.00 O ATOM 21474 O21 PC 563 69.358 112.745 50.511 1.00 0.00 O ATOM 21475 C21 PC 563 68.317 113.261 49.879 1.00 0.00 C ATOM 21476 O22 PC 563 68.218 114.438 49.549 1.00 0.00 O ATOM 21477 C12 OL 564 67.368 112.163 49.541 1.00 0.00 C ATOM 21478 H2R OL 564 67.988 111.351 49.156 1.00 0.00 H ATOM 21479 H2S OL 564 67.048 111.941 50.561 1.00 0.00 H ATOM 21480 C13 OL 564 66.162 112.581 48.584 1.00 0.00 C ATOM 21481 H3R OL 564 65.855 113.599 48.830 1.00 0.00 H ATOM 21482 H3S OL 564 66.563 112.634 47.569 1.00 0.00 H ATOM 21483 C14 OL 564 64.812 111.823 48.578 1.00 0.00 C ATOM 21484 H4R OL 564 64.374 111.858 49.578 1.00 0.00 H ATOM 21485 H4S OL 564 64.060 112.359 47.995 1.00 0.00 H ATOM 21486 C15 OL 564 64.879 110.368 48.237 1.00 0.00 C ATOM 21487 H5R OL 564 65.091 110.240 47.173 1.00 0.00 H ATOM 21488 H5S OL 564 65.659 109.896 48.839 1.00 0.00 H ATOM 21489 C16 OL 564 63.610 109.571 48.732 1.00 0.00 C ATOM 21490 H6R OL 564 63.702 109.674 49.815 1.00 0.00 H ATOM 21491 H6S OL 564 62.642 109.895 48.341 1.00 0.00 H ATOM 21492 C17 OL 564 63.710 108.180 48.335 1.00 0.00 C ATOM 21493 H7R OL 564 63.909 108.224 47.262 1.00 0.00 H ATOM 21494 H7S OL 564 64.581 107.726 48.813 1.00 0.00 H ATOM 21495 C18 OL 564 62.463 107.342 48.568 1.00 0.00 C ATOM 21496 H8R OL 564 62.316 107.168 49.636 1.00 0.00 H ATOM 21497 H8S OL 564 61.593 107.761 48.059 1.00 0.00 H ATOM 21498 C19 OL 564 62.763 105.945 48.090 1.00 0.00 C ATOM 21499 H9R OL 564 63.792 105.627 48.238 1.00 0.00 H ATOM 21500 C110 OL 564 61.901 105.117 47.504 1.00 0.00 C ATOM 21501 H10R OL 564 62.193 104.112 47.208 1.00 0.00 H ATOM 21502 C111 OL 564 60.471 105.380 47.177 1.00 0.00 C ATOM 21503 H11R OL 564 59.946 104.425 47.105 1.00 0.00 H ATOM 21504 H11S OL 564 60.065 105.894 48.051 1.00 0.00 H ATOM 21505 C112 OL 564 60.407 106.207 45.779 1.00 0.00 C ATOM 21506 H12R OL 564 61.259 106.889 45.796 1.00 0.00 H ATOM 21507 H12S OL 564 60.518 105.521 44.937 1.00 0.00 H ATOM 21508 C113 OL 564 59.053 107.009 45.627 1.00 0.00 C ATOM 21509 H13R OL 564 58.577 107.238 46.583 1.00 0.00 H ATOM 21510 H13S OL 564 59.235 107.881 44.996 1.00 0.00 H ATOM 21511 C114 OL 564 57.941 106.244 44.925 1.00 0.00 C ATOM 21512 H14R OL 564 58.371 105.587 44.167 1.00 0.00 H ATOM 21513 H14S OL 564 57.245 105.730 45.591 1.00 0.00 H ATOM 21514 C115 OL 564 57.026 107.119 44.082 1.00 0.00 C ATOM 21515 H15R OL 564 56.443 107.675 44.819 1.00 0.00 H ATOM 21516 H15S OL 564 57.679 107.836 43.581 1.00 0.00 H ATOM 21517 C116 OL 564 56.022 106.392 43.124 1.00 0.00 C ATOM 21518 H16R OL 564 55.322 105.719 43.624 1.00 0.00 H ATOM 21519 H16S OL 564 55.362 107.116 42.643 1.00 0.00 H ATOM 21520 C117 OL 564 56.579 105.753 41.842 1.00 0.00 C ATOM 21521 H17R OL 564 57.102 106.417 41.151 1.00 0.00 H ATOM 21522 H17S OL 564 57.397 105.050 42.014 1.00 0.00 H ATOM 21523 C118 OL 564 55.559 104.988 41.086 1.00 0.00 C ATOM 21524 H18R OL 564 55.022 104.273 41.713 1.00 0.00 H ATOM 21525 H18S OL 564 56.144 104.586 40.256 1.00 0.00 H ATOM 21526 H18T OL 564 54.778 105.619 40.657 1.00 0.00 H TER 21527 OL 564 ATOM 21527 C116 PA 565 21.357 17.904 41.164 1.00 0.00 C ATOM 21528 H16R PA 565 20.590 18.268 40.478 1.00 0.00 H ATOM 21529 H16S PA 565 21.177 16.827 41.187 1.00 0.00 H ATOM 21530 H16T PA 565 22.239 18.104 40.553 1.00 0.00 H ATOM 21531 C115 PA 565 21.359 18.511 42.605 1.00 0.00 C ATOM 21532 H15R PA 565 20.316 18.470 42.926 1.00 0.00 H ATOM 21533 H15S PA 565 21.439 19.600 42.575 1.00 0.00 H ATOM 21534 C114 PA 565 22.323 17.794 43.569 1.00 0.00 C ATOM 21535 H14R PA 565 23.319 17.623 43.153 1.00 0.00 H ATOM 21536 H14S PA 565 21.910 16.798 43.745 1.00 0.00 H ATOM 21537 C113 PA 565 22.631 18.622 44.822 1.00 0.00 C ATOM 21538 H13R PA 565 21.696 19.046 45.195 1.00 0.00 H ATOM 21539 H13S PA 565 23.109 19.564 44.546 1.00 0.00 H ATOM 21540 C112 PA 565 23.204 17.959 46.030 1.00 0.00 C ATOM 21541 H12R PA 565 24.135 17.477 45.724 1.00 0.00 H ATOM 21542 H12S PA 565 22.542 17.186 46.424 1.00 0.00 H ATOM 21543 C111 PA 565 23.579 18.941 47.138 1.00 0.00 C ATOM 21544 H11R PA 565 24.060 19.817 46.698 1.00 0.00 H ATOM 21545 H11S PA 565 24.346 18.533 47.799 1.00 0.00 H ATOM 21546 C110 PA 565 22.498 19.500 48.005 1.00 0.00 C ATOM 21547 H10R PA 565 22.352 18.712 48.748 1.00 0.00 H ATOM 21548 H10S PA 565 21.562 19.598 47.451 1.00 0.00 H ATOM 21549 C19 PA 565 22.824 20.786 48.659 1.00 0.00 C ATOM 21550 H9R PA 565 22.947 21.606 47.949 1.00 0.00 H ATOM 21551 H9S PA 565 23.850 20.627 48.997 1.00 0.00 H ATOM 21552 C18 PA 565 21.971 21.234 49.863 1.00 0.00 C ATOM 21553 H8R PA 565 20.920 21.406 49.620 1.00 0.00 H ATOM 21554 H8S PA 565 22.352 22.242 50.038 1.00 0.00 H ATOM 21555 C17 PA 565 22.180 20.359 51.113 1.00 0.00 C ATOM 21556 H7R PA 565 23.240 20.203 51.322 1.00 0.00 H ATOM 21557 H7S PA 565 21.689 19.397 50.948 1.00 0.00 H ATOM 21558 C16 PA 565 21.554 21.016 52.400 1.00 0.00 C ATOM 21559 H6R PA 565 20.527 21.367 52.277 1.00 0.00 H ATOM 21560 H6S PA 565 21.891 22.049 52.510 1.00 0.00 H ATOM 21561 C15 PA 565 21.752 20.171 53.633 1.00 0.00 C ATOM 21562 H5R PA 565 22.593 19.476 53.599 1.00 0.00 H ATOM 21563 H5S PA 565 20.959 19.427 53.724 1.00 0.00 H ATOM 21564 C14 PA 565 21.627 21.060 54.872 1.00 0.00 C ATOM 21565 H4R PA 565 20.579 21.365 54.837 1.00 0.00 H ATOM 21566 H4S PA 565 22.183 22.000 54.853 1.00 0.00 H ATOM 21567 C13 PA 565 21.880 20.232 56.094 1.00 0.00 C ATOM 21568 H3R PA 565 22.891 19.828 56.175 1.00 0.00 H ATOM 21569 H3S PA 565 21.215 19.367 56.060 1.00 0.00 H ATOM 21570 C12 PA 565 21.739 21.046 57.419 1.00 0.00 C ATOM 21571 H2R PA 565 22.270 22.000 57.436 1.00 0.00 H ATOM 21572 H2S PA 565 20.718 21.343 57.666 1.00 0.00 H ATOM 21573 C11 PGR 566 22.137 20.256 58.606 1.00 0.00 C ATOM 21574 O12 PGR 566 21.753 19.110 58.768 1.00 0.00 O ATOM 21575 O11 PGR 566 23.048 20.878 59.385 1.00 0.00 O ATOM 21576 C1 PGR 566 23.686 20.213 60.399 1.00 0.00 C ATOM 21577 HR PGR 566 24.162 19.392 59.857 1.00 0.00 H ATOM 21578 HS PGR 566 22.914 19.871 61.092 1.00 0.00 H ATOM 21579 C2 PGR 566 24.714 21.202 61.051 1.00 0.00 C ATOM 21580 HX PGR 566 25.480 20.535 61.456 1.00 0.00 H ATOM 21581 C3 PGR 566 24.037 21.915 62.235 1.00 0.00 C ATOM 21582 HA PGR 566 23.273 21.265 62.670 1.00 0.00 H ATOM 21583 HB PGR 566 23.495 22.787 61.860 1.00 0.00 H ATOM 21584 O31 PGR 566 24.984 22.273 63.183 1.00 0.00 O ATOM 21585 P31 PGR 566 24.578 22.746 64.724 1.00 0.00 P ATOM 21586 O32 PGR 566 24.381 24.346 64.730 1.00 0.00 O ATOM 21587 C31 PGR 566 23.782 25.054 65.834 1.00 0.00 C ATOM 21588 H1A PGR 566 22.791 24.635 66.025 1.00 0.00 H ATOM 21589 H1B PGR 566 23.653 26.112 65.589 1.00 0.00 H ATOM 21590 C32 PGR 566 24.731 25.050 67.059 1.00 0.00 C ATOM 21591 H2A PGR 566 25.734 25.222 66.661 1.00 0.00 H ATOM 21592 O35 PGR 566 24.842 23.845 67.830 1.00 0.00 O ATOM 21593 HO5A PGR 566 25.229 23.279 67.138 1.00 0.00 H ATOM 21594 C33 PGR 566 24.581 26.240 68.031 1.00 0.00 C ATOM 21595 H3A PGR 566 25.349 26.201 68.808 1.00 0.00 H ATOM 21596 H3B PGR 566 24.612 27.208 67.524 1.00 0.00 H ATOM 21597 O33 PGR 566 23.296 22.161 65.043 1.00 0.00 O ATOM 21598 O34 PGR 566 25.754 22.586 65.617 1.00 0.00 O ATOM 21599 O21 PGR 566 25.261 22.206 60.103 1.00 0.00 O ATOM 21600 C21 PGR 566 25.887 21.782 58.985 1.00 0.00 C ATOM 21601 O22 PGR 566 26.248 20.657 58.807 1.00 0.00 O ATOM 21602 O36 PGR 566 23.345 25.961 68.747 1.00 0.00 O ATOM 21603 HO6A PGR 566 23.365 25.010 68.953 1.00 0.00 H ATOM 21604 C12 OL 567 26.013 22.906 57.908 1.00 0.00 C ATOM 21605 H2R OL 567 25.608 23.881 58.185 1.00 0.00 H ATOM 21606 H2S OL 567 27.064 23.124 57.703 1.00 0.00 H ATOM 21607 C13 OL 567 25.518 22.442 56.565 1.00 0.00 C ATOM 21608 H3R OL 567 26.003 21.530 56.211 1.00 0.00 H ATOM 21609 H3S OL 567 24.461 22.209 56.712 1.00 0.00 H ATOM 21610 C14 OL 567 25.500 23.607 55.594 1.00 0.00 C ATOM 21611 H4R OL 567 24.907 24.447 55.960 1.00 0.00 H ATOM 21612 H4S OL 567 26.516 23.977 55.440 1.00 0.00 H ATOM 21613 C15 OL 567 24.941 23.159 54.150 1.00 0.00 C ATOM 21614 H5R OL 567 25.778 22.774 53.564 1.00 0.00 H ATOM 21615 H5S OL 567 24.222 22.338 54.153 1.00 0.00 H ATOM 21616 C16 OL 567 24.513 24.312 53.253 1.00 0.00 C ATOM 21617 H6R OL 567 23.574 24.680 53.670 1.00 0.00 H ATOM 21618 H6S OL 567 25.183 25.146 53.475 1.00 0.00 H ATOM 21619 C17 OL 567 24.505 23.973 51.798 1.00 0.00 C ATOM 21620 H7R OL 567 25.527 23.678 51.548 1.00 0.00 H ATOM 21621 H7S OL 567 23.856 23.158 51.471 1.00 0.00 H ATOM 21622 C18 OL 567 23.937 25.171 50.990 1.00 0.00 C ATOM 21623 H8R OL 567 22.880 25.302 51.229 1.00 0.00 H ATOM 21624 H8S OL 567 24.243 26.164 51.325 1.00 0.00 H ATOM 21625 C19 OL 567 24.153 25.130 49.448 1.00 0.00 C ATOM 21626 H9R OL 567 25.194 25.003 49.163 1.00 0.00 H ATOM 21627 C110 OL 567 23.215 25.124 48.498 1.00 0.00 C ATOM 21628 H10R OL 567 23.434 25.242 47.440 1.00 0.00 H ATOM 21629 C111 OL 567 21.791 25.383 48.716 1.00 0.00 C ATOM 21630 H11R OL 567 21.437 25.585 49.729 1.00 0.00 H ATOM 21631 H11S OL 567 21.521 26.193 48.035 1.00 0.00 H ATOM 21632 C112 OL 567 20.811 24.241 48.274 1.00 0.00 C ATOM 21633 H12R OL 567 20.951 23.511 49.074 1.00 0.00 H ATOM 21634 H12S OL 567 19.813 24.681 48.223 1.00 0.00 H ATOM 21635 C113 OL 567 21.180 23.619 46.949 1.00 0.00 C ATOM 21636 H13R OL 567 21.226 24.402 46.190 1.00 0.00 H ATOM 21637 H13S OL 567 22.204 23.261 47.073 1.00 0.00 H ATOM 21638 C114 OL 567 20.242 22.431 46.722 1.00 0.00 C ATOM 21639 H14R OL 567 20.490 21.720 47.513 1.00 0.00 H ATOM 21640 H14S OL 567 19.190 22.641 46.921 1.00 0.00 H ATOM 21641 C115 OL 567 20.155 21.795 45.306 1.00 0.00 C ATOM 21642 H15R OL 567 21.176 21.564 44.996 1.00 0.00 H ATOM 21643 H15S OL 567 19.633 20.839 45.378 1.00 0.00 H ATOM 21644 C116 OL 567 19.652 22.669 44.060 1.00 0.00 C ATOM 21645 H16R OL 567 20.200 23.606 44.177 1.00 0.00 H ATOM 21646 H16S OL 567 20.042 22.210 43.149 1.00 0.00 H ATOM 21647 C117 OL 567 18.116 22.768 43.961 1.00 0.00 C ATOM 21648 H17R OL 567 17.699 21.768 44.095 1.00 0.00 H ATOM 21649 H17S OL 567 17.918 23.332 44.875 1.00 0.00 H ATOM 21650 C118 OL 567 17.597 23.504 42.747 1.00 0.00 C ATOM 21651 H18R OL 567 18.231 24.346 42.461 1.00 0.00 H ATOM 21652 H18S OL 567 16.597 23.930 42.858 1.00 0.00 H ATOM 21653 H18T OL 567 17.545 22.872 41.858 1.00 0.00 H TER 21654 OL 567 ATOM 21654 C116 PA 568 131.141 81.417 44.844 1.00 0.00 C ATOM 21655 H16R PA 568 131.369 80.412 44.484 1.00 0.00 H ATOM 21656 H16S PA 568 130.539 81.949 44.104 1.00 0.00 H ATOM 21657 H16T PA 568 130.671 81.356 45.828 1.00 0.00 H ATOM 21658 C115 PA 568 132.516 81.980 45.015 1.00 0.00 C ATOM 21659 H15R PA 568 133.151 81.626 45.830 1.00 0.00 H ATOM 21660 H15S PA 568 132.229 82.915 45.500 1.00 0.00 H ATOM 21661 C114 PA 568 133.287 82.242 43.802 1.00 0.00 C ATOM 21662 H14R PA 568 132.960 83.197 43.388 1.00 0.00 H ATOM 21663 H14S PA 568 133.107 81.359 43.184 1.00 0.00 H ATOM 21664 C113 PA 568 134.715 82.453 44.031 1.00 0.00 C ATOM 21665 H13R PA 568 135.043 82.740 43.030 1.00 0.00 H ATOM 21666 H13S PA 568 135.171 81.476 44.208 1.00 0.00 H ATOM 21667 C112 PA 568 135.117 83.551 45.058 1.00 0.00 C ATOM 21668 H12R PA 568 134.870 83.369 46.106 1.00 0.00 H ATOM 21669 H12S PA 568 134.508 84.391 44.718 1.00 0.00 H ATOM 21670 C111 PA 568 136.577 83.847 44.948 1.00 0.00 C ATOM 21671 H11R PA 568 136.740 84.092 43.897 1.00 0.00 H ATOM 21672 H11S PA 568 137.195 83.015 45.291 1.00 0.00 H ATOM 21673 C110 PA 568 137.066 85.032 45.822 1.00 0.00 C ATOM 21674 H10R PA 568 136.923 84.859 46.891 1.00 0.00 H ATOM 21675 H10S PA 568 136.336 85.804 45.571 1.00 0.00 H ATOM 21676 C19 PA 568 138.447 85.557 45.567 1.00 0.00 C ATOM 21677 H9R PA 568 138.436 86.608 45.864 1.00 0.00 H ATOM 21678 H9S PA 568 138.784 85.682 44.535 1.00 0.00 H ATOM 21679 C18 PA 568 139.490 84.716 46.337 1.00 0.00 C ATOM 21680 H8R PA 568 139.652 84.025 45.507 1.00 0.00 H ATOM 21681 H8S PA 568 138.932 84.182 47.109 1.00 0.00 H ATOM 21682 C17 PA 568 140.748 85.427 46.831 1.00 0.00 C ATOM 21683 H7R PA 568 141.118 86.121 46.073 1.00 0.00 H ATOM 21684 H7S PA 568 141.506 84.661 47.008 1.00 0.00 H ATOM 21685 C16 PA 568 140.591 86.239 48.089 1.00 0.00 C ATOM 21686 H6R PA 568 139.743 86.899 47.897 1.00 0.00 H ATOM 21687 H6S PA 568 141.368 87.003 48.165 1.00 0.00 H ATOM 21688 C15 PA 568 140.384 85.569 49.418 1.00 0.00 C ATOM 21689 H5R PA 568 139.358 85.195 49.385 1.00 0.00 H ATOM 21690 H5S PA 568 140.437 86.264 50.258 1.00 0.00 H ATOM 21691 C14 PA 568 141.280 84.275 49.570 1.00 0.00 C ATOM 21692 H4R PA 568 142.343 84.486 49.431 1.00 0.00 H ATOM 21693 H4S PA 568 140.936 83.582 48.800 1.00 0.00 H ATOM 21694 C13 PA 568 141.079 83.612 50.890 1.00 0.00 C ATOM 21695 H3R PA 568 140.046 83.546 51.238 1.00 0.00 H ATOM 21696 H3S PA 568 141.521 84.299 51.614 1.00 0.00 H ATOM 21697 C12 PA 568 141.544 82.205 51.034 1.00 0.00 C ATOM 21698 H2R PA 568 142.582 82.040 50.738 1.00 0.00 H ATOM 21699 H2S PA 568 140.939 81.670 50.299 1.00 0.00 H ATOM 21700 C11 PGR 569 141.383 81.553 52.405 1.00 0.00 C ATOM 21701 O12 PGR 569 140.830 80.454 52.502 1.00 0.00 O ATOM 21702 O11 PGR 569 141.653 82.377 53.427 1.00 0.00 O ATOM 21703 C1 PGR 569 141.255 82.078 54.804 1.00 0.00 C ATOM 21704 HR PGR 569 141.937 82.725 55.361 1.00 0.00 H ATOM 21705 HS PGR 569 141.475 81.042 55.073 1.00 0.00 H ATOM 21706 C2 PGR 569 139.778 82.540 55.013 1.00 0.00 C ATOM 21707 HX PGR 569 139.692 83.600 54.764 1.00 0.00 H ATOM 21708 C3 PGR 569 139.436 82.404 56.539 1.00 0.00 C ATOM 21709 HA PGR 569 138.360 82.480 56.714 1.00 0.00 H ATOM 21710 HB PGR 569 139.924 83.182 57.132 1.00 0.00 H ATOM 21711 O31 PGR 569 139.797 81.120 56.988 1.00 0.00 O ATOM 21712 P31 PGR 569 139.123 80.424 58.176 1.00 0.00 P ATOM 21713 O32 PGR 569 137.569 80.220 57.895 1.00 0.00 O ATOM 21714 C31 PGR 569 137.158 79.415 56.833 1.00 0.00 C ATOM 21715 H1A PGR 569 137.661 78.446 56.802 1.00 0.00 H ATOM 21716 H1B PGR 569 137.512 79.820 55.881 1.00 0.00 H ATOM 21717 C32 PGR 569 135.575 79.236 56.802 1.00 0.00 C ATOM 21718 H2A PGR 569 135.149 80.241 56.742 1.00 0.00 H ATOM 21719 O35 PGR 569 135.245 78.553 58.080 1.00 0.00 O ATOM 21720 HO5A PGR 569 135.875 77.817 58.181 1.00 0.00 H ATOM 21721 C33 PGR 569 135.031 78.345 55.737 1.00 0.00 C ATOM 21722 H3A PGR 569 133.964 78.163 55.888 1.00 0.00 H ATOM 21723 H3B PGR 569 135.116 78.871 54.783 1.00 0.00 H ATOM 21724 O33 PGR 569 139.835 79.116 58.342 1.00 0.00 O ATOM 21725 O34 PGR 569 139.295 81.395 59.257 1.00 0.00 O ATOM 21726 O21 PGR 569 138.777 81.793 54.186 1.00 0.00 O ATOM 21727 C21 PGR 569 137.540 82.282 54.057 1.00 0.00 C ATOM 21728 O22 PGR 569 137.216 83.383 54.497 1.00 0.00 O ATOM 21729 O36 PGR 569 135.680 77.060 55.812 1.00 0.00 O ATOM 21730 HO6A PGR 569 135.344 76.580 56.591 1.00 0.00 H ATOM 21731 C12 OL 570 136.497 81.387 53.356 1.00 0.00 C ATOM 21732 H2R OL 570 137.003 80.420 53.404 1.00 0.00 H ATOM 21733 H2S OL 570 135.664 81.255 54.050 1.00 0.00 H ATOM 21734 C13 OL 570 136.110 82.015 52.022 1.00 0.00 C ATOM 21735 H3R OL 570 135.062 81.851 51.762 1.00 0.00 H ATOM 21736 H3S OL 570 136.296 83.086 52.119 1.00 0.00 H ATOM 21737 C14 OL 570 137.024 81.563 50.888 1.00 0.00 C ATOM 21738 H4R OL 570 138.061 81.823 51.110 1.00 0.00 H ATOM 21739 H4S OL 570 137.009 80.471 50.892 1.00 0.00 H ATOM 21740 C15 OL 570 136.612 82.157 49.570 1.00 0.00 C ATOM 21741 H5R OL 570 135.549 82.364 49.426 1.00 0.00 H ATOM 21742 H5S OL 570 137.115 83.125 49.570 1.00 0.00 H ATOM 21743 C16 OL 570 137.032 81.418 48.332 1.00 0.00 C ATOM 21744 H6R OL 570 136.518 80.463 48.206 1.00 0.00 H ATOM 21745 H6S OL 570 136.804 81.993 47.432 1.00 0.00 H ATOM 21746 C17 OL 570 138.606 81.104 48.295 1.00 0.00 C ATOM 21747 H7R OL 570 139.107 81.989 48.691 1.00 0.00 H ATOM 21748 H7S OL 570 138.687 80.314 49.043 1.00 0.00 H ATOM 21749 C18 OL 570 139.074 80.703 46.890 1.00 0.00 C ATOM 21750 H8R OL 570 138.433 79.866 46.605 1.00 0.00 H ATOM 21751 H8S OL 570 138.778 81.429 46.130 1.00 0.00 H ATOM 21752 C19 OL 570 140.542 80.260 46.845 1.00 0.00 C ATOM 21753 H9R OL 570 141.256 80.867 46.295 1.00 0.00 H ATOM 21754 C110 OL 570 141.037 79.058 47.358 1.00 0.00 C ATOM 21755 H10R OL 570 142.114 78.948 47.263 1.00 0.00 H ATOM 21756 C111 OL 570 140.307 78.063 48.230 1.00 0.00 C ATOM 21757 H11R OL 570 139.266 78.389 48.266 1.00 0.00 H ATOM 21758 H11S OL 570 140.524 77.185 47.618 1.00 0.00 H ATOM 21759 C112 OL 570 140.764 77.875 49.607 1.00 0.00 C ATOM 21760 H12R OL 570 141.835 77.666 49.558 1.00 0.00 H ATOM 21761 H12S OL 570 140.574 78.855 50.051 1.00 0.00 H ATOM 21762 C113 OL 570 139.929 76.830 50.432 1.00 0.00 C ATOM 21763 H13R OL 570 140.544 76.763 51.332 1.00 0.00 H ATOM 21764 H13S OL 570 139.028 77.305 50.826 1.00 0.00 H ATOM 21765 C114 OL 570 139.738 75.383 49.891 1.00 0.00 C ATOM 21766 H14R OL 570 139.301 74.635 50.556 1.00 0.00 H ATOM 21767 H14S OL 570 138.940 75.381 49.146 1.00 0.00 H ATOM 21768 C115 OL 570 141.000 74.719 49.359 1.00 0.00 C ATOM 21769 H15R OL 570 141.147 75.410 48.525 1.00 0.00 H ATOM 21770 H15S OL 570 141.852 74.830 50.032 1.00 0.00 H ATOM 21771 C116 OL 570 140.841 73.348 48.719 1.00 0.00 C ATOM 21772 H16R OL 570 140.937 72.625 49.532 1.00 0.00 H ATOM 21773 H16S OL 570 139.830 73.159 48.352 1.00 0.00 H ATOM 21774 C117 OL 570 141.775 73.033 47.546 1.00 0.00 C ATOM 21775 H17R OL 570 141.410 73.352 46.567 1.00 0.00 H ATOM 21776 H17S OL 570 142.739 73.502 47.753 1.00 0.00 H ATOM 21777 C118 OL 570 142.001 71.474 47.324 1.00 0.00 C ATOM 21778 H18R OL 570 142.681 71.469 46.470 1.00 0.00 H ATOM 21779 H18S OL 570 141.124 70.935 46.960 1.00 0.00 H ATOM 21780 H18T OL 570 142.605 70.999 48.101 1.00 0.00 H TER 21781 OL 570 ATOM 21781 C116 PA 571 110.052 32.911 40.496 1.00 0.00 C ATOM 21782 H16R PA 571 110.584 33.072 41.436 1.00 0.00 H ATOM 21783 H16S PA 571 108.979 32.966 40.695 1.00 0.00 H ATOM 21784 H16T PA 571 110.256 33.741 39.817 1.00 0.00 H ATOM 21785 C115 PA 571 110.365 31.610 39.802 1.00 0.00 C ATOM 21786 H15R PA 571 111.451 31.515 39.739 1.00 0.00 H ATOM 21787 H15S PA 571 109.913 31.635 38.809 1.00 0.00 H ATOM 21788 C114 PA 571 109.820 30.457 40.528 1.00 0.00 C ATOM 21789 H14R PA 571 110.378 29.674 40.011 1.00 0.00 H ATOM 21790 H14S PA 571 108.753 30.259 40.404 1.00 0.00 H ATOM 21791 C113 PA 571 110.171 30.324 41.991 1.00 0.00 C ATOM 21792 H13R PA 571 109.812 31.188 42.555 1.00 0.00 H ATOM 21793 H13S PA 571 111.245 30.449 42.148 1.00 0.00 H ATOM 21794 C112 PA 571 109.927 29.024 42.670 1.00 0.00 C ATOM 21795 H12R PA 571 110.435 28.270 42.066 1.00 0.00 H ATOM 21796 H12S PA 571 108.869 28.755 42.632 1.00 0.00 H ATOM 21797 C111 PA 571 110.430 28.867 44.133 1.00 0.00 C ATOM 21798 H11R PA 571 110.675 29.840 44.565 1.00 0.00 H ATOM 21799 H11S PA 571 111.350 28.285 44.052 1.00 0.00 H ATOM 21800 C110 PA 571 109.590 27.873 44.975 1.00 0.00 C ATOM 21801 H10R PA 571 109.734 26.816 44.739 1.00 0.00 H ATOM 21802 H10S PA 571 108.517 27.989 44.808 1.00 0.00 H ATOM 21803 C19 PA 571 109.832 28.068 46.520 1.00 0.00 C ATOM 21804 H9R PA 571 109.046 27.403 46.884 1.00 0.00 H ATOM 21805 H9S PA 571 109.651 29.090 46.859 1.00 0.00 H ATOM 21806 C18 PA 571 111.157 27.480 46.998 1.00 0.00 C ATOM 21807 H8R PA 571 111.949 28.020 46.475 1.00 0.00 H ATOM 21808 H8S PA 571 111.239 26.426 46.724 1.00 0.00 H ATOM 21809 C17 PA 571 111.458 27.796 48.506 1.00 0.00 C ATOM 21810 H7R PA 571 110.691 27.366 49.154 1.00 0.00 H ATOM 21811 H7S PA 571 111.442 28.876 48.668 1.00 0.00 H ATOM 21812 C16 PA 571 112.829 27.275 48.933 1.00 0.00 C ATOM 21813 H6R PA 571 113.522 27.957 48.435 1.00 0.00 H ATOM 21814 H6S PA 571 113.056 26.286 48.530 1.00 0.00 H ATOM 21815 C15 PA 571 113.052 27.177 50.446 1.00 0.00 C ATOM 21816 H5R PA 571 114.052 26.813 50.692 1.00 0.00 H ATOM 21817 H5S PA 571 112.480 26.386 50.935 1.00 0.00 H ATOM 21818 C14 PA 571 112.738 28.412 51.175 1.00 0.00 C ATOM 21819 H4R PA 571 112.650 28.039 52.197 1.00 0.00 H ATOM 21820 H4S PA 571 111.751 28.836 50.981 1.00 0.00 H ATOM 21821 C13 PA 571 113.845 29.546 51.177 1.00 0.00 C ATOM 21822 H3R PA 571 113.313 30.488 51.024 1.00 0.00 H ATOM 21823 H3S PA 571 114.406 29.401 50.252 1.00 0.00 H ATOM 21824 C12 PA 571 114.669 29.494 52.492 1.00 0.00 C ATOM 21825 H2R PA 571 115.548 30.092 52.243 1.00 0.00 H ATOM 21826 H2S PA 571 114.992 28.489 52.772 1.00 0.00 H ATOM 21827 C11 PC 572 113.907 30.085 53.640 1.00 0.00 C ATOM 21828 O12 PC 572 114.273 31.057 54.243 1.00 0.00 O ATOM 21829 O11 PC 572 112.872 29.293 54.019 1.00 0.00 O ATOM 21830 C1 PC 572 111.902 29.885 54.990 1.00 0.00 C ATOM 21831 HR PC 572 112.525 30.145 55.850 1.00 0.00 H ATOM 21832 HS PC 572 111.138 29.155 55.270 1.00 0.00 H ATOM 21833 C2 PC 572 111.156 31.114 54.360 1.00 0.00 C ATOM 21834 HX PC 572 111.825 31.953 54.153 1.00 0.00 H ATOM 21835 C3 PC 572 110.063 31.636 55.352 1.00 0.00 C ATOM 21836 HA PC 572 109.114 31.196 55.033 1.00 0.00 H ATOM 21837 HB PC 572 110.169 32.724 55.364 1.00 0.00 H ATOM 21838 O31 PC 572 110.185 31.130 56.678 1.00 0.00 O ATOM 21839 P31 PC 572 108.994 31.468 57.628 1.00 0.00 P ATOM 21840 O32 PC 572 107.904 30.489 57.241 1.00 0.00 O ATOM 21841 C31 PC 572 108.216 29.129 57.133 1.00 0.00 C ATOM 21842 H1A PC 572 108.399 28.652 58.099 1.00 0.00 H ATOM 21843 H1B PC 572 109.092 29.051 56.484 1.00 0.00 H ATOM 21844 C32 PC 572 107.161 28.344 56.414 1.00 0.00 C ATOM 21845 H2A PC 572 107.598 27.944 55.498 1.00 0.00 H ATOM 21846 H2B PC 572 106.356 29.050 56.206 1.00 0.00 H ATOM 21847 N31 PC 572 106.464 27.242 57.142 1.00 0.00 N ATOM 21848 C33 PC 572 105.843 27.635 58.444 1.00 0.00 C ATOM 21849 H3A PC 572 104.977 28.261 58.223 1.00 0.00 H ATOM 21850 H3B PC 572 106.612 28.101 59.061 1.00 0.00 H ATOM 21851 H3C PC 572 105.474 26.758 58.978 1.00 0.00 H ATOM 21852 C34 PC 572 105.363 26.784 56.253 1.00 0.00 C ATOM 21853 H4A PC 572 104.773 26.088 56.851 1.00 0.00 H ATOM 21854 H4B PC 572 105.897 26.328 55.418 1.00 0.00 H ATOM 21855 H4C PC 572 104.861 27.728 56.036 1.00 0.00 H ATOM 21856 C35 PC 572 107.420 26.168 57.504 1.00 0.00 C ATOM 21857 H5A PC 572 107.725 25.650 56.594 1.00 0.00 H ATOM 21858 H5B PC 572 106.808 25.529 58.142 1.00 0.00 H ATOM 21859 H5C PC 572 108.298 26.627 57.962 1.00 0.00 H ATOM 21860 O33 PC 572 109.357 31.158 59.042 1.00 0.00 O ATOM 21861 O34 PC 572 108.460 32.791 57.317 1.00 0.00 O ATOM 21862 O21 PC 572 110.531 30.742 53.150 1.00 0.00 O ATOM 21863 C21 PC 572 110.211 31.595 52.260 1.00 0.00 C ATOM 21864 O22 PC 572 110.280 32.779 52.440 1.00 0.00 O ATOM 21865 C12 OL 573 109.600 30.955 50.983 1.00 0.00 C ATOM 21866 H2R OL 573 110.419 30.626 50.341 1.00 0.00 H ATOM 21867 H2S OL 573 109.101 30.010 51.204 1.00 0.00 H ATOM 21868 C13 OL 573 108.649 31.935 50.228 1.00 0.00 C ATOM 21869 H3R OL 573 107.962 32.521 50.841 1.00 0.00 H ATOM 21870 H3S OL 573 109.252 32.769 49.864 1.00 0.00 H ATOM 21871 C14 OL 573 107.991 31.322 49.034 1.00 0.00 C ATOM 21872 H4R OL 573 107.734 32.098 48.310 1.00 0.00 H ATOM 21873 H4S OL 573 108.692 30.698 48.476 1.00 0.00 H ATOM 21874 C15 OL 573 106.770 30.540 49.471 1.00 0.00 C ATOM 21875 H5R OL 573 106.999 30.030 50.409 1.00 0.00 H ATOM 21876 H5S OL 573 105.978 31.232 49.766 1.00 0.00 H ATOM 21877 C16 OL 573 106.192 29.705 48.361 1.00 0.00 C ATOM 21878 H6R OL 573 105.860 30.288 47.500 1.00 0.00 H ATOM 21879 H6S OL 573 107.015 29.093 47.987 1.00 0.00 H ATOM 21880 C17 OL 573 105.101 28.749 48.728 1.00 0.00 C ATOM 21881 H7R OL 573 105.338 28.195 49.639 1.00 0.00 H ATOM 21882 H7S OL 573 104.181 29.257 49.024 1.00 0.00 H ATOM 21883 C18 OL 573 104.775 27.648 47.732 1.00 0.00 C ATOM 21884 H8R OL 573 104.804 28.053 46.718 1.00 0.00 H ATOM 21885 H8S OL 573 105.574 26.904 47.782 1.00 0.00 H ATOM 21886 C19 OL 573 103.421 26.915 47.942 1.00 0.00 C ATOM 21887 H9R OL 573 103.143 26.597 48.944 1.00 0.00 H ATOM 21888 C110 OL 573 102.553 26.654 46.908 1.00 0.00 C ATOM 21889 H10R OL 573 101.656 26.096 47.162 1.00 0.00 H ATOM 21890 C111 OL 573 102.615 26.963 45.392 1.00 0.00 C ATOM 21891 H11R OL 573 103.656 27.223 45.186 1.00 0.00 H ATOM 21892 H11S OL 573 102.419 26.114 44.734 1.00 0.00 H ATOM 21893 C112 OL 573 101.626 28.074 44.969 1.00 0.00 C ATOM 21894 H12R OL 573 100.579 27.764 44.960 1.00 0.00 H ATOM 21895 H12S OL 573 101.631 28.821 45.765 1.00 0.00 H ATOM 21896 C113 OL 573 101.854 28.759 43.670 1.00 0.00 C ATOM 21897 H13R OL 573 101.005 29.441 43.599 1.00 0.00 H ATOM 21898 H13S OL 573 102.809 29.288 43.707 1.00 0.00 H ATOM 21899 C114 OL 573 102.078 27.821 42.431 1.00 0.00 C ATOM 21900 H14R OL 573 102.832 27.033 42.495 1.00 0.00 H ATOM 21901 H14S OL 573 101.129 27.283 42.398 1.00 0.00 H ATOM 21902 C115 OL 573 102.350 28.366 41.035 1.00 0.00 C ATOM 21903 H15R OL 573 101.693 29.183 40.731 1.00 0.00 H ATOM 21904 H15S OL 573 103.315 28.877 41.052 1.00 0.00 H ATOM 21905 C116 OL 573 102.361 27.352 39.902 1.00 0.00 C ATOM 21906 H16R OL 573 102.937 26.482 40.223 1.00 0.00 H ATOM 21907 H16S OL 573 101.349 26.981 39.724 1.00 0.00 H ATOM 21908 C117 OL 573 102.865 27.866 38.504 1.00 0.00 C ATOM 21909 H17R OL 573 102.209 28.696 38.231 1.00 0.00 H ATOM 21910 H17S OL 573 103.854 28.325 38.571 1.00 0.00 H ATOM 21911 C118 OL 573 102.811 26.824 37.413 1.00 0.00 C ATOM 21912 H18R OL 573 101.759 26.648 37.179 1.00 0.00 H ATOM 21913 H18S OL 573 103.230 25.837 37.619 1.00 0.00 H ATOM 21914 H18T OL 573 103.372 27.220 36.563 1.00 0.00 H TER 21915 OL 573 ATOM 21915 C116 PA 574 38.402 124.345 41.815 1.00 0.00 C ATOM 21916 H16R PA 574 37.613 123.898 41.208 1.00 0.00 H ATOM 21917 H16S PA 574 38.519 125.371 41.459 1.00 0.00 H ATOM 21918 H16T PA 574 38.124 124.405 42.869 1.00 0.00 H ATOM 21919 C115 PA 574 39.796 123.666 41.781 1.00 0.00 C ATOM 21920 H15R PA 574 40.351 123.757 40.845 1.00 0.00 H ATOM 21921 H15S PA 574 39.707 122.578 41.804 1.00 0.00 H ATOM 21922 C114 PA 574 40.739 124.105 42.852 1.00 0.00 C ATOM 21923 H14R PA 574 41.704 123.620 42.692 1.00 0.00 H ATOM 21924 H14S PA 574 40.380 123.726 43.811 1.00 0.00 H ATOM 21925 C113 PA 574 41.079 125.608 42.958 1.00 0.00 C ATOM 21926 H13R PA 574 40.249 126.151 43.415 1.00 0.00 H ATOM 21927 H13S PA 574 41.259 125.976 41.946 1.00 0.00 H ATOM 21928 C112 PA 574 42.319 125.910 43.895 1.00 0.00 C ATOM 21929 H12R PA 574 43.083 126.469 43.351 1.00 0.00 H ATOM 21930 H12S PA 574 42.909 125.012 44.092 1.00 0.00 H ATOM 21931 C111 PA 574 41.981 126.627 45.262 1.00 0.00 C ATOM 21932 H11R PA 574 41.538 125.951 45.996 1.00 0.00 H ATOM 21933 H11S PA 574 41.298 127.454 45.054 1.00 0.00 H ATOM 21934 C110 PA 574 43.237 127.154 46.057 1.00 0.00 C ATOM 21935 H10R PA 574 43.827 127.771 45.377 1.00 0.00 H ATOM 21936 H10S PA 574 43.825 126.271 46.318 1.00 0.00 H ATOM 21937 C19 PA 574 42.913 127.838 47.420 1.00 0.00 C ATOM 21938 H9R PA 574 43.862 128.150 47.860 1.00 0.00 H ATOM 21939 H9S PA 574 42.416 127.073 48.020 1.00 0.00 H ATOM 21940 C18 PA 574 41.973 129.068 47.301 1.00 0.00 C ATOM 21941 H8R PA 574 40.979 128.629 47.190 1.00 0.00 H ATOM 21942 H8S PA 574 42.330 129.690 46.477 1.00 0.00 H ATOM 21943 C17 PA 574 41.963 129.859 48.603 1.00 0.00 C ATOM 21944 H7R PA 574 42.959 130.075 48.995 1.00 0.00 H ATOM 21945 H7S PA 574 41.361 129.327 49.343 1.00 0.00 H ATOM 21946 C16 PA 574 41.330 131.250 48.311 1.00 0.00 C ATOM 21947 H6R PA 574 40.438 131.060 47.711 1.00 0.00 H ATOM 21948 H6S PA 574 42.009 131.836 47.688 1.00 0.00 H ATOM 21949 C15 PA 574 40.829 131.953 49.613 1.00 0.00 C ATOM 21950 H5R PA 574 41.510 131.746 50.441 1.00 0.00 H ATOM 21951 H5S PA 574 39.916 131.446 49.934 1.00 0.00 H ATOM 21952 C14 PA 574 40.742 133.430 49.626 1.00 0.00 C ATOM 21953 H4R PA 574 40.315 133.810 50.556 1.00 0.00 H ATOM 21954 H4S PA 574 39.996 133.724 48.884 1.00 0.00 H ATOM 21955 C13 PA 574 42.079 134.201 49.465 1.00 0.00 C ATOM 21956 H3R PA 574 41.893 135.271 49.574 1.00 0.00 H ATOM 21957 H3S PA 574 42.308 134.226 48.397 1.00 0.00 H ATOM 21958 C12 PA 574 43.402 133.638 50.102 1.00 0.00 C ATOM 21959 H2R PA 574 44.229 134.263 49.757 1.00 0.00 H ATOM 21960 H2S PA 574 43.592 132.611 49.785 1.00 0.00 H ATOM 21961 C11 PC 575 43.460 133.649 51.592 1.00 0.00 C ATOM 21962 O12 PC 575 42.476 133.547 52.295 1.00 0.00 O ATOM 21963 O11 PC 575 44.687 133.614 52.091 1.00 0.00 O ATOM 21964 C1 PC 575 44.873 133.651 53.545 1.00 0.00 C ATOM 21965 HR PC 575 44.105 133.005 53.976 1.00 0.00 H ATOM 21966 HS PC 575 44.740 134.629 54.016 1.00 0.00 H ATOM 21967 C2 PC 575 46.315 133.128 53.861 1.00 0.00 C ATOM 21968 HX PC 575 46.352 132.044 53.721 1.00 0.00 H ATOM 21969 C3 PC 575 46.700 133.372 55.339 1.00 0.00 C ATOM 21970 HA PC 575 47.751 133.075 55.397 1.00 0.00 H ATOM 21971 HB PC 575 46.224 132.674 56.032 1.00 0.00 H ATOM 21972 O31 PC 575 46.517 134.712 55.728 1.00 0.00 O ATOM 21973 P31 PC 575 46.956 135.286 57.158 1.00 0.00 P ATOM 21974 O32 PC 575 48.380 135.979 56.891 1.00 0.00 O ATOM 21975 C31 PC 575 49.178 136.366 57.943 1.00 0.00 C ATOM 21976 H1A PC 575 49.522 135.499 58.513 1.00 0.00 H ATOM 21977 H1B PC 575 48.562 136.928 58.650 1.00 0.00 H ATOM 21978 C32 PC 575 50.252 137.210 57.246 1.00 0.00 C ATOM 21979 H2A PC 575 50.621 136.465 56.539 1.00 0.00 H ATOM 21980 H2B PC 575 51.013 137.377 58.009 1.00 0.00 H ATOM 21981 N31 PC 575 49.892 138.514 56.642 1.00 0.00 N ATOM 21982 C33 PC 575 49.200 139.423 57.593 1.00 0.00 C ATOM 21983 H3A PC 575 48.738 138.881 58.420 1.00 0.00 H ATOM 21984 H3B PC 575 48.456 139.903 56.956 1.00 0.00 H ATOM 21985 H3C PC 575 49.790 140.287 57.903 1.00 0.00 H ATOM 21986 C34 PC 575 51.182 139.176 56.286 1.00 0.00 C ATOM 21987 H4A PC 575 50.953 140.219 56.062 1.00 0.00 H ATOM 21988 H4B PC 575 51.572 138.584 55.457 1.00 0.00 H ATOM 21989 H4C PC 575 51.892 139.308 57.104 1.00 0.00 H ATOM 21990 C35 PC 575 49.150 138.292 55.337 1.00 0.00 C ATOM 21991 H5A PC 575 49.811 137.631 54.774 1.00 0.00 H ATOM 21992 H5B PC 575 48.954 139.174 54.725 1.00 0.00 H ATOM 21993 H5C PC 575 48.204 137.829 55.621 1.00 0.00 H ATOM 21994 O33 PC 575 46.015 136.364 57.480 1.00 0.00 O ATOM 21995 O34 PC 575 47.093 134.102 58.033 1.00 0.00 O ATOM 21996 O21 PC 575 47.274 133.849 53.023 1.00 0.00 O ATOM 21997 C21 PC 575 47.338 135.233 52.884 1.00 0.00 C ATOM 21998 O22 PC 575 46.632 136.082 53.238 1.00 0.00 O ATOM 21999 C12 OL 576 48.531 135.656 52.153 1.00 0.00 C ATOM 22000 H2R OL 576 48.732 136.712 52.348 1.00 0.00 H ATOM 22001 H2S OL 576 49.455 135.144 52.430 1.00 0.00 H ATOM 22002 C13 OL 576 48.541 135.563 50.664 1.00 0.00 C ATOM 22003 H3R OL 576 48.980 134.577 50.495 1.00 0.00 H ATOM 22004 H3S OL 576 47.553 135.561 50.199 1.00 0.00 H ATOM 22005 C14 OL 576 49.289 136.629 49.937 1.00 0.00 C ATOM 22006 H4R OL 576 48.756 137.582 49.899 1.00 0.00 H ATOM 22007 H4S OL 576 50.108 137.007 50.552 1.00 0.00 H ATOM 22008 C15 OL 576 49.794 136.294 48.518 1.00 0.00 C ATOM 22009 H5R OL 576 50.125 137.254 48.116 1.00 0.00 H ATOM 22010 H5S OL 576 50.779 135.822 48.514 1.00 0.00 H ATOM 22011 C16 OL 576 48.824 135.394 47.610 1.00 0.00 C ATOM 22012 H6R OL 576 48.377 134.590 48.199 1.00 0.00 H ATOM 22013 H6S OL 576 47.950 136.020 47.418 1.00 0.00 H ATOM 22014 C17 OL 576 49.527 134.907 46.292 1.00 0.00 C ATOM 22015 H7R OL 576 50.213 135.663 45.904 1.00 0.00 H ATOM 22016 H7S OL 576 50.223 134.129 46.614 1.00 0.00 H ATOM 22017 C18 OL 576 48.538 134.564 45.163 1.00 0.00 C ATOM 22018 H8R OL 576 48.990 133.827 44.496 1.00 0.00 H ATOM 22019 H8S OL 576 47.595 134.224 45.596 1.00 0.00 H ATOM 22020 C19 OL 576 48.160 135.824 44.456 1.00 0.00 C ATOM 22021 H9R OL 576 47.318 136.317 44.933 1.00 0.00 H ATOM 22022 C110 OL 576 48.453 136.105 43.229 1.00 0.00 C ATOM 22023 H10R OL 576 47.900 136.935 42.795 1.00 0.00 H ATOM 22024 C111 OL 576 49.469 135.511 42.347 1.00 0.00 C ATOM 22025 H11R OL 576 50.255 135.151 43.014 1.00 0.00 H ATOM 22026 H11S OL 576 49.084 134.657 41.785 1.00 0.00 H ATOM 22027 C112 OL 576 49.851 136.539 41.240 1.00 0.00 C ATOM 22028 H12R OL 576 49.030 137.116 40.811 1.00 0.00 H ATOM 22029 H12S OL 576 50.430 137.335 41.711 1.00 0.00 H ATOM 22030 C113 OL 576 50.695 135.839 40.136 1.00 0.00 C ATOM 22031 H13R OL 576 50.323 134.839 39.900 1.00 0.00 H ATOM 22032 H13S OL 576 50.615 136.397 39.201 1.00 0.00 H ATOM 22033 C114 OL 576 52.181 135.687 40.526 1.00 0.00 C ATOM 22034 H14R OL 576 52.514 136.726 40.558 1.00 0.00 H ATOM 22035 H14S OL 576 52.416 135.217 41.483 1.00 0.00 H ATOM 22036 C115 OL 576 53.003 135.051 39.399 1.00 0.00 C ATOM 22037 H15R OL 576 52.489 134.205 38.937 1.00 0.00 H ATOM 22038 H15S OL 576 53.051 135.873 38.682 1.00 0.00 H ATOM 22039 C116 OL 576 54.464 134.699 39.773 1.00 0.00 C ATOM 22040 H16R OL 576 54.889 135.641 40.127 1.00 0.00 H ATOM 22041 H16S OL 576 54.405 133.919 40.534 1.00 0.00 H ATOM 22042 C117 OL 576 55.200 134.008 38.645 1.00 0.00 C ATOM 22043 H17R OL 576 56.081 133.486 39.025 1.00 0.00 H ATOM 22044 H17S OL 576 54.571 133.175 38.324 1.00 0.00 H ATOM 22045 C118 OL 576 55.417 134.869 37.450 1.00 0.00 C ATOM 22046 H18R OL 576 54.522 135.393 37.109 1.00 0.00 H ATOM 22047 H18S OL 576 55.918 134.365 36.621 1.00 0.00 H ATOM 22048 H18T OL 576 56.043 135.695 37.793 1.00 0.00 H TER 22049 OL 576 ATOM 22049 C116 PA 577 90.804 22.174 42.193 1.00 0.00 C ATOM 22050 H16R PA 577 91.711 22.505 41.683 1.00 0.00 H ATOM 22051 H16S PA 577 90.307 23.070 42.573 1.00 0.00 H ATOM 22052 H16T PA 577 90.085 21.686 41.532 1.00 0.00 H ATOM 22053 C115 PA 577 91.270 21.293 43.365 1.00 0.00 C ATOM 22054 H15R PA 577 91.702 21.976 44.099 1.00 0.00 H ATOM 22055 H15S PA 577 92.150 20.695 43.118 1.00 0.00 H ATOM 22056 C114 PA 577 90.128 20.338 43.972 1.00 0.00 C ATOM 22057 H14R PA 577 90.579 19.696 44.732 1.00 0.00 H ATOM 22058 H14S PA 577 89.788 19.627 43.216 1.00 0.00 H ATOM 22059 C113 PA 577 88.986 21.076 44.513 1.00 0.00 C ATOM 22060 H13R PA 577 88.396 20.469 45.203 1.00 0.00 H ATOM 22061 H13S PA 577 88.288 21.437 43.755 1.00 0.00 H ATOM 22062 C112 PA 577 89.363 22.216 45.411 1.00 0.00 C ATOM 22063 H12R PA 577 89.735 23.052 44.815 1.00 0.00 H ATOM 22064 H12S PA 577 90.190 21.838 46.015 1.00 0.00 H ATOM 22065 C111 PA 577 88.206 22.665 46.357 1.00 0.00 C ATOM 22066 H11R PA 577 87.690 21.809 46.797 1.00 0.00 H ATOM 22067 H11S PA 577 87.434 23.094 45.715 1.00 0.00 H ATOM 22068 C110 PA 577 88.517 23.658 47.497 1.00 0.00 C ATOM 22069 H10R PA 577 89.176 24.452 47.139 1.00 0.00 H ATOM 22070 H10S PA 577 89.136 23.175 48.256 1.00 0.00 H ATOM 22071 C19 PA 577 87.311 24.392 48.186 1.00 0.00 C ATOM 22072 H9R PA 577 86.581 23.722 48.645 1.00 0.00 H ATOM 22073 H9S PA 577 86.845 25.071 47.469 1.00 0.00 H ATOM 22074 C18 PA 577 87.856 25.206 49.338 1.00 0.00 C ATOM 22075 H8R PA 577 88.710 25.749 48.929 1.00 0.00 H ATOM 22076 H8S PA 577 88.259 24.560 50.121 1.00 0.00 H ATOM 22077 C17 PA 577 86.870 26.344 49.711 1.00 0.00 C ATOM 22078 H7R PA 577 87.125 27.077 48.943 1.00 0.00 H ATOM 22079 H7S PA 577 87.273 26.920 50.547 1.00 0.00 H ATOM 22080 C16 PA 577 85.336 26.064 49.808 1.00 0.00 C ATOM 22081 H6R PA 577 85.145 25.357 50.618 1.00 0.00 H ATOM 22082 H6S PA 577 85.072 25.385 48.995 1.00 0.00 H ATOM 22083 C15 PA 577 84.386 27.210 49.905 1.00 0.00 C ATOM 22084 H5R PA 577 84.528 27.888 49.060 1.00 0.00 H ATOM 22085 H5S PA 577 84.630 27.810 50.783 1.00 0.00 H ATOM 22086 C14 PA 577 82.964 26.865 49.810 1.00 0.00 C ATOM 22087 H4R PA 577 82.605 26.453 50.756 1.00 0.00 H ATOM 22088 H4S PA 577 82.789 26.019 49.143 1.00 0.00 H ATOM 22089 C13 PA 577 82.058 27.939 49.262 1.00 0.00 C ATOM 22090 H3R PA 577 82.355 28.168 48.236 1.00 0.00 H ATOM 22091 H3S PA 577 82.285 28.824 49.861 1.00 0.00 H ATOM 22092 C12 PA 577 80.470 27.640 49.372 1.00 0.00 C ATOM 22093 H2R PA 577 80.248 26.705 48.853 1.00 0.00 H ATOM 22094 H2S PA 577 79.838 28.431 48.962 1.00 0.00 H ATOM 22095 C11 PGR 578 79.937 27.556 50.762 1.00 0.00 C ATOM 22096 O12 PGR 578 79.904 26.600 51.446 1.00 0.00 O ATOM 22097 O11 PGR 578 79.671 28.820 51.162 1.00 0.00 O ATOM 22098 C1 PGR 578 79.131 28.973 52.496 1.00 0.00 C ATOM 22099 HR PGR 578 78.447 28.151 52.723 1.00 0.00 H ATOM 22100 HS PGR 578 78.543 29.892 52.553 1.00 0.00 H ATOM 22101 C2 PGR 578 80.310 28.984 53.542 1.00 0.00 C ATOM 22102 HX PGR 578 80.604 27.932 53.561 1.00 0.00 H ATOM 22103 C3 PGR 578 79.891 29.386 55.004 1.00 0.00 C ATOM 22104 HA PGR 578 79.304 28.538 55.365 1.00 0.00 H ATOM 22105 HB PGR 578 79.419 30.370 55.049 1.00 0.00 H ATOM 22106 O31 PGR 578 81.028 29.565 55.787 1.00 0.00 O ATOM 22107 P31 PGR 578 80.752 29.949 57.309 1.00 0.00 P ATOM 22108 O32 PGR 578 80.541 28.483 57.988 1.00 0.00 O ATOM 22109 C31 PGR 578 81.497 27.840 58.844 1.00 0.00 C ATOM 22110 H1A PGR 578 81.854 28.551 59.594 1.00 0.00 H ATOM 22111 H1B PGR 578 82.254 27.411 58.182 1.00 0.00 H ATOM 22112 C32 PGR 578 80.706 26.712 59.665 1.00 0.00 C ATOM 22113 H2A PGR 578 81.371 25.954 60.087 1.00 0.00 H ATOM 22114 O35 PGR 578 79.880 26.060 58.712 1.00 0.00 O ATOM 22115 HO5A PGR 578 79.686 26.764 58.067 1.00 0.00 H ATOM 22116 C33 PGR 578 79.787 27.204 60.781 1.00 0.00 C ATOM 22117 H3A PGR 578 80.443 27.640 61.538 1.00 0.00 H ATOM 22118 H3B PGR 578 78.994 27.893 60.478 1.00 0.00 H ATOM 22119 O33 PGR 578 81.955 30.556 57.819 1.00 0.00 O ATOM 22120 O34 PGR 578 79.480 30.728 57.470 1.00 0.00 O ATOM 22121 O21 PGR 578 81.269 30.047 53.123 1.00 0.00 O ATOM 22122 C21 PGR 578 82.591 29.762 53.039 1.00 0.00 C ATOM 22123 O22 PGR 578 82.952 28.618 53.192 1.00 0.00 O ATOM 22124 O36 PGR 578 79.255 26.070 61.387 1.00 0.00 O ATOM 22125 HO6A PGR 578 78.649 26.416 62.068 1.00 0.00 H ATOM 22126 C12 OL 579 83.549 30.923 52.814 1.00 0.00 C ATOM 22127 H2R OL 579 83.155 31.677 52.130 1.00 0.00 H ATOM 22128 H2S OL 579 83.828 31.382 53.764 1.00 0.00 H ATOM 22129 C13 OL 579 84.881 30.581 52.226 1.00 0.00 C ATOM 22130 H3R OL 579 85.287 29.667 52.662 1.00 0.00 H ATOM 22131 H3S OL 579 84.611 30.094 51.287 1.00 0.00 H ATOM 22132 C14 OL 579 85.691 31.836 51.997 1.00 0.00 C ATOM 22133 H4R OL 579 85.065 32.547 51.455 1.00 0.00 H ATOM 22134 H4S OL 579 85.831 32.342 52.955 1.00 0.00 H ATOM 22135 C15 OL 579 87.066 31.496 51.374 1.00 0.00 C ATOM 22136 H5R OL 579 87.729 31.029 52.106 1.00 0.00 H ATOM 22137 H5S OL 579 86.868 30.843 50.521 1.00 0.00 H ATOM 22138 C16 OL 579 87.792 32.658 50.625 1.00 0.00 C ATOM 22139 H6R OL 579 88.070 33.393 51.383 1.00 0.00 H ATOM 22140 H6S OL 579 88.735 32.287 50.218 1.00 0.00 H ATOM 22141 C17 OL 579 86.863 33.347 49.600 1.00 0.00 C ATOM 22142 H7R OL 579 86.338 32.592 49.011 1.00 0.00 H ATOM 22143 H7S OL 579 86.052 33.902 50.076 1.00 0.00 H ATOM 22144 C18 OL 579 87.587 34.277 48.659 1.00 0.00 C ATOM 22145 H8R OL 579 87.918 35.185 49.167 1.00 0.00 H ATOM 22146 H8S OL 579 88.522 33.866 48.270 1.00 0.00 H ATOM 22147 C19 OL 579 86.777 34.633 47.476 1.00 0.00 C ATOM 22148 H9R OL 579 86.209 35.536 47.683 1.00 0.00 H ATOM 22149 C110 OL 579 86.633 34.110 46.237 1.00 0.00 C ATOM 22150 H10R OL 579 85.954 34.643 45.575 1.00 0.00 H ATOM 22151 C111 OL 579 87.349 32.898 45.764 1.00 0.00 C ATOM 22152 H11R OL 579 87.936 32.440 46.563 1.00 0.00 H ATOM 22153 H11S OL 579 86.552 32.188 45.534 1.00 0.00 H ATOM 22154 C112 OL 579 88.157 33.107 44.481 1.00 0.00 C ATOM 22155 H12R OL 579 87.537 33.606 43.733 1.00 0.00 H ATOM 22156 H12S OL 579 88.993 33.784 44.675 1.00 0.00 H ATOM 22157 C113 OL 579 88.732 31.825 43.947 1.00 0.00 C ATOM 22158 H13R OL 579 89.286 31.416 44.794 1.00 0.00 H ATOM 22159 H13S OL 579 87.955 31.086 43.740 1.00 0.00 H ATOM 22160 C114 OL 579 89.753 32.031 42.769 1.00 0.00 C ATOM 22161 H14R OL 579 89.198 32.286 41.864 1.00 0.00 H ATOM 22162 H14S OL 579 90.468 32.811 43.040 1.00 0.00 H ATOM 22163 C115 OL 579 90.588 30.836 42.432 1.00 0.00 C ATOM 22164 H15R OL 579 91.010 30.464 43.368 1.00 0.00 H ATOM 22165 H15S OL 579 89.889 30.011 42.277 1.00 0.00 H ATOM 22166 C116 OL 579 91.523 30.934 41.239 1.00 0.00 C ATOM 22167 H16R OL 579 91.065 31.485 40.415 1.00 0.00 H ATOM 22168 H16S OL 579 92.336 31.533 41.655 1.00 0.00 H ATOM 22169 C117 OL 579 91.970 29.539 40.719 1.00 0.00 C ATOM 22170 H17R OL 579 91.986 28.800 41.523 1.00 0.00 H ATOM 22171 H17S OL 579 91.224 29.063 40.079 1.00 0.00 H ATOM 22172 C118 OL 579 93.384 29.498 40.025 1.00 0.00 C ATOM 22173 H18R OL 579 93.679 28.496 39.709 1.00 0.00 H ATOM 22174 H18S OL 579 94.154 29.848 40.715 1.00 0.00 H ATOM 22175 H18T OL 579 93.449 30.170 39.167 1.00 0.00 H TER 22176 OL 579 ATOM 22176 C116 PA 580 124.915 126.993 42.314 1.00 0.00 C ATOM 22177 H16R PA 580 124.091 127.423 42.887 1.00 0.00 H ATOM 22178 H16S PA 580 124.492 126.748 41.338 1.00 0.00 H ATOM 22179 H16T PA 580 125.587 127.844 42.181 1.00 0.00 H ATOM 22180 C115 PA 580 125.610 125.746 42.966 1.00 0.00 C ATOM 22181 H15R PA 580 126.269 125.275 42.233 1.00 0.00 H ATOM 22182 H15S PA 580 124.807 125.043 43.198 1.00 0.00 H ATOM 22183 C114 PA 580 126.575 126.049 44.127 1.00 0.00 C ATOM 22184 H14R PA 580 126.073 126.492 44.990 1.00 0.00 H ATOM 22185 H14S PA 580 127.249 126.831 43.770 1.00 0.00 H ATOM 22186 C113 PA 580 127.501 124.893 44.666 1.00 0.00 C ATOM 22187 H13R PA 580 128.265 124.568 43.956 1.00 0.00 H ATOM 22188 H13S PA 580 126.969 123.980 44.943 1.00 0.00 H ATOM 22189 C112 PA 580 128.311 125.246 45.942 1.00 0.00 C ATOM 22190 H12R PA 580 128.672 124.393 46.521 1.00 0.00 H ATOM 22191 H12S PA 580 127.585 125.653 46.649 1.00 0.00 H ATOM 22192 C111 PA 580 129.357 126.328 45.701 1.00 0.00 C ATOM 22193 H11R PA 580 128.798 127.199 45.354 1.00 0.00 H ATOM 22194 H11S PA 580 130.006 125.987 44.892 1.00 0.00 H ATOM 22195 C110 PA 580 130.215 126.656 46.912 1.00 0.00 C ATOM 22196 H10R PA 580 129.555 127.051 47.687 1.00 0.00 H ATOM 22197 H10S PA 580 130.927 127.426 46.605 1.00 0.00 H ATOM 22198 C19 PA 580 131.048 125.449 47.306 1.00 0.00 C ATOM 22199 H9R PA 580 131.590 125.039 46.451 1.00 0.00 H ATOM 22200 H9S PA 580 130.331 124.710 47.670 1.00 0.00 H ATOM 22201 C18 PA 580 131.931 125.632 48.566 1.00 0.00 C ATOM 22202 H8R PA 580 132.769 126.235 48.211 1.00 0.00 H ATOM 22203 H8S PA 580 132.338 124.649 48.813 1.00 0.00 H ATOM 22204 C17 PA 580 131.234 126.297 49.792 1.00 0.00 C ATOM 22205 H7R PA 580 130.146 126.261 49.707 1.00 0.00 H ATOM 22206 H7S PA 580 131.336 127.379 49.686 1.00 0.00 H ATOM 22207 C16 PA 580 131.719 125.914 51.131 1.00 0.00 C ATOM 22208 H6R PA 580 132.809 125.874 51.182 1.00 0.00 H ATOM 22209 H6S PA 580 131.436 124.901 51.424 1.00 0.00 H ATOM 22210 C15 PA 580 131.191 126.837 52.206 1.00 0.00 C ATOM 22211 H5R PA 580 130.141 126.550 52.116 1.00 0.00 H ATOM 22212 H5S PA 580 131.309 127.894 51.959 1.00 0.00 H ATOM 22213 C14 PA 580 131.570 126.620 53.724 1.00 0.00 C ATOM 22214 H4R PA 580 132.636 126.796 53.875 1.00 0.00 H ATOM 22215 H4S PA 580 131.505 125.564 53.993 1.00 0.00 H ATOM 22216 C13 PA 580 130.836 127.479 54.733 1.00 0.00 C ATOM 22217 H3R PA 580 129.895 126.964 54.941 1.00 0.00 H ATOM 22218 H3S PA 580 130.694 128.404 54.171 1.00 0.00 H ATOM 22219 C12 PA 580 131.587 127.753 56.043 1.00 0.00 C ATOM 22220 H2R PA 580 132.510 128.337 56.026 1.00 0.00 H ATOM 22221 H2S PA 580 131.832 126.752 56.401 1.00 0.00 H ATOM 22222 C11 PC 581 130.737 128.288 57.166 1.00 0.00 C ATOM 22223 O12 PC 581 130.497 127.705 58.243 1.00 0.00 O ATOM 22224 O11 PC 581 130.183 129.475 56.869 1.00 0.00 O ATOM 22225 C1 PC 581 129.481 130.255 57.896 1.00 0.00 C ATOM 22226 HR PC 581 128.624 129.689 58.271 1.00 0.00 H ATOM 22227 HS PC 581 129.104 131.201 57.501 1.00 0.00 H ATOM 22228 C2 PC 581 130.439 130.502 59.098 1.00 0.00 C ATOM 22229 HX PC 581 131.081 129.628 59.232 1.00 0.00 H ATOM 22230 C3 PC 581 129.529 130.827 60.307 1.00 0.00 C ATOM 22231 HA PC 581 128.733 130.088 60.424 1.00 0.00 H ATOM 22232 HB PC 581 129.055 131.808 60.229 1.00 0.00 H ATOM 22233 O31 PC 581 130.363 130.812 61.432 1.00 0.00 O ATOM 22234 P31 PC 581 129.781 130.942 62.865 1.00 0.00 P ATOM 22235 O32 PC 581 128.946 129.608 63.048 1.00 0.00 O ATOM 22236 C31 PC 581 129.400 128.484 63.750 1.00 0.00 C ATOM 22237 H1A PC 581 129.222 128.543 64.827 1.00 0.00 H ATOM 22238 H1B PC 581 130.447 128.230 63.562 1.00 0.00 H ATOM 22239 C32 PC 581 128.580 127.358 63.108 1.00 0.00 C ATOM 22240 H2A PC 581 128.873 127.193 62.071 1.00 0.00 H ATOM 22241 H2B PC 581 127.543 127.678 63.223 1.00 0.00 H ATOM 22242 N31 PC 581 128.679 126.025 63.736 1.00 0.00 N ATOM 22243 C33 PC 581 130.110 125.573 63.941 1.00 0.00 C ATOM 22244 H3A PC 581 130.665 125.460 63.009 1.00 0.00 H ATOM 22245 H3B PC 581 130.181 124.548 64.308 1.00 0.00 H ATOM 22246 H3C PC 581 130.725 126.241 64.546 1.00 0.00 H ATOM 22247 C34 PC 581 127.943 126.121 65.032 1.00 0.00 C ATOM 22248 H4A PC 581 127.880 125.144 65.514 1.00 0.00 H ATOM 22249 H4B PC 581 126.983 126.603 64.842 1.00 0.00 H ATOM 22250 H4C PC 581 128.446 126.893 65.615 1.00 0.00 H ATOM 22251 C35 PC 581 127.854 125.100 62.923 1.00 0.00 C ATOM 22252 H5A PC 581 126.814 125.326 63.162 1.00 0.00 H ATOM 22253 H5B PC 581 128.178 124.095 63.197 1.00 0.00 H ATOM 22254 H5C PC 581 127.985 125.280 61.855 1.00 0.00 H ATOM 22255 O33 PC 581 130.992 130.880 63.771 1.00 0.00 O ATOM 22256 O34 PC 581 128.958 132.162 62.963 1.00 0.00 O ATOM 22257 O21 PC 581 131.299 131.595 58.702 1.00 0.00 O ATOM 22258 C21 PC 581 132.579 131.584 59.185 1.00 0.00 C ATOM 22259 O22 PC 581 133.123 130.713 59.850 1.00 0.00 O ATOM 22260 C12 OL 582 133.282 132.856 58.751 1.00 0.00 C ATOM 22261 H2R OL 582 132.544 133.643 58.578 1.00 0.00 H ATOM 22262 H2S OL 582 133.868 133.305 59.556 1.00 0.00 H ATOM 22263 C13 OL 582 134.132 132.546 57.452 1.00 0.00 C ATOM 22264 H3R OL 582 134.408 133.537 57.087 1.00 0.00 H ATOM 22265 H3S OL 582 135.088 132.033 57.580 1.00 0.00 H ATOM 22266 C14 OL 582 133.466 131.826 56.301 1.00 0.00 C ATOM 22267 H4R OL 582 133.270 130.805 56.633 1.00 0.00 H ATOM 22268 H4S OL 582 132.429 132.160 56.227 1.00 0.00 H ATOM 22269 C15 OL 582 134.201 131.919 54.935 1.00 0.00 C ATOM 22270 H5R OL 582 134.197 132.966 54.627 1.00 0.00 H ATOM 22271 H5S OL 582 135.287 131.839 55.014 1.00 0.00 H ATOM 22272 C16 OL 582 133.619 130.992 53.860 1.00 0.00 C ATOM 22273 H6R OL 582 133.290 130.083 54.367 1.00 0.00 H ATOM 22274 H6S OL 582 132.657 131.372 53.509 1.00 0.00 H ATOM 22275 C17 OL 582 134.495 130.697 52.624 1.00 0.00 C ATOM 22276 H7R OL 582 134.643 131.684 52.180 1.00 0.00 H ATOM 22277 H7S OL 582 135.408 130.201 52.958 1.00 0.00 H ATOM 22278 C18 OL 582 133.859 129.746 51.671 1.00 0.00 C ATOM 22279 H8R OL 582 133.707 128.798 52.192 1.00 0.00 H ATOM 22280 H8S OL 582 132.899 130.197 51.412 1.00 0.00 H ATOM 22281 C19 OL 582 134.835 129.646 50.510 1.00 0.00 C ATOM 22282 H9R OL 582 135.823 129.445 50.917 1.00 0.00 H ATOM 22283 C110 OL 582 134.537 129.553 49.202 1.00 0.00 C ATOM 22284 H10R OL 582 135.429 129.371 48.608 1.00 0.00 H ATOM 22285 C111 OL 582 133.184 129.545 48.516 1.00 0.00 C ATOM 22286 H11R OL 582 132.860 128.577 48.128 1.00 0.00 H ATOM 22287 H11S OL 582 132.485 129.797 49.316 1.00 0.00 H ATOM 22288 C112 OL 582 132.978 130.476 47.357 1.00 0.00 C ATOM 22289 H12R OL 582 133.617 131.358 47.435 1.00 0.00 H ATOM 22290 H12S OL 582 133.444 130.051 46.465 1.00 0.00 H ATOM 22291 C113 OL 582 131.435 130.845 47.242 1.00 0.00 C ATOM 22292 H13R OL 582 130.786 129.993 47.026 1.00 0.00 H ATOM 22293 H13S OL 582 131.122 131.405 48.125 1.00 0.00 H ATOM 22294 C114 OL 582 131.380 131.803 46.178 1.00 0.00 C ATOM 22295 H14R OL 582 131.794 132.753 46.523 1.00 0.00 H ATOM 22296 H14S OL 582 131.986 131.452 45.340 1.00 0.00 H ATOM 22297 C115 OL 582 129.921 131.994 45.843 1.00 0.00 C ATOM 22298 H15R OL 582 129.395 131.050 45.691 1.00 0.00 H ATOM 22299 H15S OL 582 129.291 132.481 46.591 1.00 0.00 H ATOM 22300 C116 OL 582 129.716 132.813 44.670 1.00 0.00 C ATOM 22301 H16R OL 582 130.346 133.680 44.460 1.00 0.00 H ATOM 22302 H16S OL 582 129.901 132.272 43.740 1.00 0.00 H ATOM 22303 C117 OL 582 128.287 133.472 44.517 1.00 0.00 C ATOM 22304 H17R OL 582 128.112 134.130 45.370 1.00 0.00 H ATOM 22305 H17S OL 582 128.291 134.078 43.609 1.00 0.00 H ATOM 22306 C118 OL 582 127.160 132.482 44.359 1.00 0.00 C ATOM 22307 H18R OL 582 126.233 132.969 44.668 1.00 0.00 H ATOM 22308 H18S OL 582 127.318 131.689 45.092 1.00 0.00 H ATOM 22309 H18T OL 582 127.201 132.168 43.314 1.00 0.00 H TER 22310 OL 582 ATOM 22310 C116 PA 583 71.710 120.789 37.461 1.00 0.00 C ATOM 22311 H16R PA 583 72.327 119.989 37.047 1.00 0.00 H ATOM 22312 H16S PA 583 71.138 121.110 36.588 1.00 0.00 H ATOM 22313 H16T PA 583 70.968 120.321 38.111 1.00 0.00 H ATOM 22314 C115 PA 583 72.280 121.897 38.307 1.00 0.00 C ATOM 22315 H15R PA 583 73.021 122.477 37.755 1.00 0.00 H ATOM 22316 H15S PA 583 72.806 121.437 39.145 1.00 0.00 H ATOM 22317 C114 PA 583 71.194 122.823 38.942 1.00 0.00 C ATOM 22318 H14R PA 583 70.355 122.180 39.219 1.00 0.00 H ATOM 22319 H14S PA 583 70.882 123.433 38.092 1.00 0.00 H ATOM 22320 C113 PA 583 71.715 123.864 40.047 1.00 0.00 C ATOM 22321 H13R PA 583 72.635 124.295 39.647 1.00 0.00 H ATOM 22322 H13S PA 583 72.143 123.361 40.917 1.00 0.00 H ATOM 22323 C112 PA 583 70.742 125.032 40.351 1.00 0.00 C ATOM 22324 H12R PA 583 69.762 124.554 40.414 1.00 0.00 H ATOM 22325 H12S PA 583 70.694 125.656 39.457 1.00 0.00 H ATOM 22326 C111 PA 583 71.082 125.996 41.440 1.00 0.00 C ATOM 22327 H11R PA 583 71.877 126.722 41.260 1.00 0.00 H ATOM 22328 H11S PA 583 71.347 125.302 42.241 1.00 0.00 H ATOM 22329 C110 PA 583 70.015 126.990 41.926 1.00 0.00 C ATOM 22330 H10R PA 583 69.060 126.579 41.592 1.00 0.00 H ATOM 22331 H10S PA 583 70.062 127.969 41.445 1.00 0.00 H ATOM 22332 C19 PA 583 70.044 127.241 43.453 1.00 0.00 C ATOM 22333 H9R PA 583 69.645 126.321 43.884 1.00 0.00 H ATOM 22334 H9S PA 583 69.406 128.074 43.756 1.00 0.00 H ATOM 22335 C18 PA 583 71.481 127.512 43.949 1.00 0.00 C ATOM 22336 H8R PA 583 71.851 128.371 43.386 1.00 0.00 H ATOM 22337 H8S PA 583 72.175 126.681 43.803 1.00 0.00 H ATOM 22338 C17 PA 583 71.496 127.692 45.442 1.00 0.00 C ATOM 22339 H7R PA 583 72.499 127.446 45.796 1.00 0.00 H ATOM 22340 H7S PA 583 70.733 127.052 45.889 1.00 0.00 H ATOM 22341 C16 PA 583 71.149 129.093 45.912 1.00 0.00 C ATOM 22342 H6R PA 583 70.092 129.193 45.659 1.00 0.00 H ATOM 22343 H6S PA 583 71.634 129.866 45.311 1.00 0.00 H ATOM 22344 C15 PA 583 71.294 129.505 47.422 1.00 0.00 C ATOM 22345 H5R PA 583 72.345 129.277 47.608 1.00 0.00 H ATOM 22346 H5S PA 583 70.668 128.780 47.947 1.00 0.00 H ATOM 22347 C14 PA 583 70.868 130.912 47.850 1.00 0.00 C ATOM 22348 H4R PA 583 69.792 131.082 47.776 1.00 0.00 H ATOM 22349 H4S PA 583 71.400 131.463 47.071 1.00 0.00 H ATOM 22350 C13 PA 583 71.397 131.288 49.208 1.00 0.00 C ATOM 22351 H3R PA 583 72.426 130.947 49.339 1.00 0.00 H ATOM 22352 H3S PA 583 70.710 131.021 50.014 1.00 0.00 H ATOM 22353 C12 PA 583 71.324 132.783 49.332 1.00 0.00 C ATOM 22354 H2R PA 583 70.306 133.150 49.189 1.00 0.00 H ATOM 22355 H2S PA 583 71.925 133.366 48.631 1.00 0.00 H ATOM 22356 C11 PGR 584 71.593 133.160 50.730 1.00 0.00 C ATOM 22357 O12 PGR 584 71.773 132.304 51.628 1.00 0.00 O ATOM 22358 O11 PGR 584 71.569 134.494 50.891 1.00 0.00 O ATOM 22359 C1 PGR 584 71.124 134.899 52.224 1.00 0.00 C ATOM 22360 HR PGR 584 71.827 134.467 52.940 1.00 0.00 H ATOM 22361 HS PGR 584 70.100 134.548 52.376 1.00 0.00 H ATOM 22362 C2 PGR 584 71.055 136.404 52.404 1.00 0.00 C ATOM 22363 HX PGR 584 72.097 136.732 52.374 1.00 0.00 H ATOM 22364 C3 PGR 584 70.526 136.816 53.801 1.00 0.00 C ATOM 22365 HA PGR 584 70.972 136.228 54.608 1.00 0.00 H ATOM 22366 HB PGR 584 69.452 136.623 53.856 1.00 0.00 H ATOM 22367 O31 PGR 584 70.843 138.170 54.083 1.00 0.00 O ATOM 22368 P31 PGR 584 70.362 138.867 55.450 1.00 0.00 P ATOM 22369 O32 PGR 584 68.804 138.563 55.435 1.00 0.00 O ATOM 22370 C31 PGR 584 67.895 139.052 54.491 1.00 0.00 C ATOM 22371 H1A PGR 584 68.271 138.922 53.474 1.00 0.00 H ATOM 22372 H1B PGR 584 66.959 138.503 54.618 1.00 0.00 H ATOM 22373 C32 PGR 584 67.416 140.454 54.684 1.00 0.00 C ATOM 22374 H2A PGR 584 66.430 140.620 54.241 1.00 0.00 H ATOM 22375 O35 PGR 584 68.413 141.269 54.070 1.00 0.00 O ATOM 22376 HO5A PGR 584 69.230 141.015 54.535 1.00 0.00 H ATOM 22377 C33 PGR 584 67.310 140.957 56.161 1.00 0.00 C ATOM 22378 H3A PGR 584 66.617 140.364 56.763 1.00 0.00 H ATOM 22379 H3B PGR 584 68.290 140.938 56.645 1.00 0.00 H ATOM 22380 O33 PGR 584 70.986 138.210 56.611 1.00 0.00 O ATOM 22381 O34 PGR 584 70.448 140.367 55.313 1.00 0.00 O ATOM 22382 O21 PGR 584 70.170 137.026 51.391 1.00 0.00 O ATOM 22383 C21 PGR 584 70.373 138.290 51.153 1.00 0.00 C ATOM 22384 O22 PGR 584 71.410 138.835 51.448 1.00 0.00 O ATOM 22385 O36 PGR 584 66.801 142.270 56.172 1.00 0.00 O ATOM 22386 HO6A PGR 584 67.369 142.913 55.712 1.00 0.00 H ATOM 22387 C12 OL 585 69.268 138.934 50.366 1.00 0.00 C ATOM 22388 H2R OL 585 68.269 138.728 50.756 1.00 0.00 H ATOM 22389 H2S OL 585 69.364 140.019 50.438 1.00 0.00 H ATOM 22390 C13 OL 585 69.426 138.528 48.854 1.00 0.00 C ATOM 22391 H3R OL 585 70.436 138.906 48.684 1.00 0.00 H ATOM 22392 H3S OL 585 69.435 137.443 48.733 1.00 0.00 H ATOM 22393 C14 OL 585 68.342 139.149 47.917 1.00 0.00 C ATOM 22394 H4R OL 585 67.408 138.585 47.956 1.00 0.00 H ATOM 22395 H4S OL 585 68.090 140.153 48.265 1.00 0.00 H ATOM 22396 C15 OL 585 68.697 139.303 46.495 1.00 0.00 C ATOM 22397 H5R OL 585 69.599 139.894 46.319 1.00 0.00 H ATOM 22398 H5S OL 585 68.879 138.278 46.165 1.00 0.00 H ATOM 22399 C16 OL 585 67.570 139.885 45.485 1.00 0.00 C ATOM 22400 H6R OL 585 67.995 139.873 44.479 1.00 0.00 H ATOM 22401 H6S OL 585 66.812 139.100 45.485 1.00 0.00 H ATOM 22402 C17 OL 585 66.944 141.205 45.917 1.00 0.00 C ATOM 22403 H7R OL 585 66.608 141.102 46.951 1.00 0.00 H ATOM 22404 H7S OL 585 67.803 141.878 45.947 1.00 0.00 H ATOM 22405 C18 OL 585 65.815 141.695 45.055 1.00 0.00 C ATOM 22406 H8R OL 585 64.996 140.973 45.042 1.00 0.00 H ATOM 22407 H8S OL 585 65.282 142.589 45.382 1.00 0.00 H ATOM 22408 C19 OL 585 66.181 141.807 43.591 1.00 0.00 C ATOM 22409 H9R OL 585 65.936 140.893 43.056 1.00 0.00 H ATOM 22410 C110 OL 585 66.757 142.801 42.908 1.00 0.00 C ATOM 22411 H10R OL 585 66.913 142.622 41.847 1.00 0.00 H ATOM 22412 C111 OL 585 67.402 144.008 43.387 1.00 0.00 C ATOM 22413 H11R OL 585 66.788 144.823 42.998 1.00 0.00 H ATOM 22414 H11S OL 585 67.254 144.099 44.465 1.00 0.00 H ATOM 22415 C112 OL 585 68.864 144.156 43.093 1.00 0.00 C ATOM 22416 H12R OL 585 69.071 144.102 42.023 1.00 0.00 H ATOM 22417 H12S OL 585 68.998 145.212 43.336 1.00 0.00 H ATOM 22418 C113 OL 585 69.784 143.184 43.865 1.00 0.00 C ATOM 22419 H13R OL 585 69.355 143.117 44.867 1.00 0.00 H ATOM 22420 H13S OL 585 69.680 142.168 43.478 1.00 0.00 H ATOM 22421 C114 OL 585 71.190 143.641 43.881 1.00 0.00 C ATOM 22422 H14R OL 585 71.494 143.930 42.873 1.00 0.00 H ATOM 22423 H14S OL 585 71.300 144.517 44.524 1.00 0.00 H ATOM 22424 C115 OL 585 72.054 142.636 44.501 1.00 0.00 C ATOM 22425 H15R OL 585 71.853 141.616 44.167 1.00 0.00 H ATOM 22426 H15S OL 585 73.027 142.712 44.011 1.00 0.00 H ATOM 22427 C116 OL 585 71.929 142.432 46.059 1.00 0.00 C ATOM 22428 H16R OL 585 70.901 142.159 46.307 1.00 0.00 H ATOM 22429 H16S OL 585 72.463 141.649 46.600 1.00 0.00 H ATOM 22430 C117 OL 585 72.190 143.745 46.892 1.00 0.00 C ATOM 22431 H17R OL 585 73.056 144.305 46.533 1.00 0.00 H ATOM 22432 H17S OL 585 71.392 144.450 46.649 1.00 0.00 H ATOM 22433 C118 OL 585 72.282 143.518 48.414 1.00 0.00 C ATOM 22434 H18R OL 585 73.205 142.991 48.663 1.00 0.00 H ATOM 22435 H18S OL 585 71.430 142.948 48.789 1.00 0.00 H ATOM 22436 H18T OL 585 72.224 144.463 48.958 1.00 0.00 H TER 22437 OL 585 ATOM 22437 C116 PA 586 84.271 110.988 51.402 1.00 0.00 C ATOM 22438 H16R PA 586 83.589 111.744 51.008 1.00 0.00 H ATOM 22439 H16S PA 586 84.781 111.370 52.289 1.00 0.00 H ATOM 22440 H16T PA 586 83.757 110.039 51.568 1.00 0.00 H ATOM 22441 C115 PA 586 85.335 110.879 50.382 1.00 0.00 C ATOM 22442 H15R PA 586 85.895 111.805 50.236 1.00 0.00 H ATOM 22443 H15S PA 586 84.765 110.708 49.467 1.00 0.00 H ATOM 22444 C114 PA 586 86.288 109.719 50.692 1.00 0.00 C ATOM 22445 H14R PA 586 85.600 108.919 50.972 1.00 0.00 H ATOM 22446 H14S PA 586 86.972 109.970 51.505 1.00 0.00 H ATOM 22447 C113 PA 586 87.358 109.315 49.654 1.00 0.00 C ATOM 22448 H13R PA 586 88.208 109.999 49.662 1.00 0.00 H ATOM 22449 H13S PA 586 86.814 109.321 48.707 1.00 0.00 H ATOM 22450 C112 PA 586 88.039 108.002 50.035 1.00 0.00 C ATOM 22451 H12R PA 586 87.311 107.190 50.097 1.00 0.00 H ATOM 22452 H12S PA 586 88.477 108.121 51.028 1.00 0.00 H ATOM 22453 C111 PA 586 89.106 107.486 49.073 1.00 0.00 C ATOM 22454 H11R PA 586 88.616 107.336 48.109 1.00 0.00 H ATOM 22455 H11S PA 586 89.279 106.479 49.458 1.00 0.00 H ATOM 22456 C110 PA 586 90.377 108.271 48.878 1.00 0.00 C ATOM 22457 H10R PA 586 90.022 109.187 48.401 1.00 0.00 H ATOM 22458 H10S PA 586 90.954 107.756 48.107 1.00 0.00 H ATOM 22459 C19 PA 586 91.176 108.522 50.188 1.00 0.00 C ATOM 22460 H9R PA 586 91.527 107.611 50.676 1.00 0.00 H ATOM 22461 H9S PA 586 90.548 109.123 50.850 1.00 0.00 H ATOM 22462 C18 PA 586 92.544 109.144 50.054 1.00 0.00 C ATOM 22463 H8R PA 586 92.514 109.946 49.314 1.00 0.00 H ATOM 22464 H8S PA 586 93.163 108.470 49.459 1.00 0.00 H ATOM 22465 C17 PA 586 93.266 109.635 51.320 1.00 0.00 C ATOM 22466 H7R PA 586 94.226 110.050 51.004 1.00 0.00 H ATOM 22467 H7S PA 586 93.320 108.784 52.002 1.00 0.00 H ATOM 22468 C16 PA 586 92.522 110.582 52.136 1.00 0.00 C ATOM 22469 H6R PA 586 91.736 109.995 52.616 1.00 0.00 H ATOM 22470 H6S PA 586 91.932 111.211 51.467 1.00 0.00 H ATOM 22471 C15 PA 586 93.181 111.497 53.134 1.00 0.00 C ATOM 22472 H5R PA 586 92.479 112.176 53.621 1.00 0.00 H ATOM 22473 H5S PA 586 93.902 112.072 52.548 1.00 0.00 H ATOM 22474 C14 PA 586 93.977 110.704 54.259 1.00 0.00 C ATOM 22475 H4R PA 586 94.551 109.869 53.852 1.00 0.00 H ATOM 22476 H4S PA 586 93.290 110.283 54.996 1.00 0.00 H ATOM 22477 C13 PA 586 95.001 111.568 55.004 1.00 0.00 C ATOM 22478 H3R PA 586 95.597 112.157 54.304 1.00 0.00 H ATOM 22479 H3S PA 586 95.714 110.857 55.428 1.00 0.00 H ATOM 22480 C12 PA 586 94.417 112.502 56.000 1.00 0.00 C ATOM 22481 H2R PA 586 95.202 113.165 56.371 1.00 0.00 H ATOM 22482 H2S PA 586 93.613 113.094 55.558 1.00 0.00 H ATOM 22483 C11 PGR 587 93.919 111.790 57.212 1.00 0.00 C ATOM 22484 O12 PGR 587 92.789 111.886 57.632 1.00 0.00 O ATOM 22485 O11 PGR 587 94.863 111.051 57.902 1.00 0.00 O ATOM 22486 C1 PGR 587 94.464 110.084 58.927 1.00 0.00 C ATOM 22487 HR PGR 587 93.949 110.702 59.666 1.00 0.00 H ATOM 22488 HS PGR 587 95.355 109.639 59.377 1.00 0.00 H ATOM 22489 C2 PGR 587 93.590 108.958 58.410 1.00 0.00 C ATOM 22490 HX PGR 587 92.670 109.388 58.005 1.00 0.00 H ATOM 22491 C3 PGR 587 93.097 107.996 59.568 1.00 0.00 C ATOM 22492 HA PGR 587 92.812 107.039 59.123 1.00 0.00 H ATOM 22493 HB PGR 587 92.331 108.433 60.213 1.00 0.00 H ATOM 22494 O31 PGR 587 94.125 107.695 60.454 1.00 0.00 O ATOM 22495 P31 PGR 587 93.965 106.524 61.438 1.00 0.00 P ATOM 22496 O32 PGR 587 92.866 107.113 62.437 1.00 0.00 O ATOM 22497 C31 PGR 587 93.269 108.078 63.391 1.00 0.00 C ATOM 22498 H1A PGR 587 93.664 108.968 62.894 1.00 0.00 H ATOM 22499 H1B PGR 587 94.079 107.652 63.988 1.00 0.00 H ATOM 22500 C32 PGR 587 92.095 108.469 64.222 1.00 0.00 C ATOM 22501 H2A PGR 587 92.442 109.282 64.865 1.00 0.00 H ATOM 22502 O35 PGR 587 91.573 107.342 64.934 1.00 0.00 O ATOM 22503 HO5A PGR 587 90.603 107.419 64.977 1.00 0.00 H ATOM 22504 C33 PGR 587 90.932 109.084 63.342 1.00 0.00 C ATOM 22505 H3A PGR 587 91.273 109.879 62.673 1.00 0.00 H ATOM 22506 H3B PGR 587 90.464 108.262 62.794 1.00 0.00 H ATOM 22507 O33 PGR 587 93.370 105.348 60.747 1.00 0.00 O ATOM 22508 O34 PGR 587 95.213 106.353 62.245 1.00 0.00 O ATOM 22509 O21 PGR 587 94.316 108.299 57.396 1.00 0.00 O ATOM 22510 C21 PGR 587 93.725 107.517 56.454 1.00 0.00 C ATOM 22511 O22 PGR 587 92.515 107.397 56.303 1.00 0.00 O ATOM 22512 O36 PGR 587 89.997 109.758 64.215 1.00 0.00 O ATOM 22513 HO6A PGR 587 89.190 109.865 63.680 1.00 0.00 H ATOM 22514 C12 OL 588 94.853 106.919 55.627 1.00 0.00 C ATOM 22515 H2R OL 588 95.221 107.772 55.054 1.00 0.00 H ATOM 22516 H2S OL 588 95.737 106.701 56.230 1.00 0.00 H ATOM 22517 C13 OL 588 94.467 105.728 54.827 1.00 0.00 C ATOM 22518 H3R OL 588 94.079 104.915 55.445 1.00 0.00 H ATOM 22519 H3S OL 588 93.601 106.016 54.227 1.00 0.00 H ATOM 22520 C14 OL 588 95.564 105.193 53.902 1.00 0.00 C ATOM 22521 H4R OL 588 96.543 105.108 54.378 1.00 0.00 H ATOM 22522 H4S OL 588 95.290 104.161 53.674 1.00 0.00 H ATOM 22523 C15 OL 588 95.742 105.908 52.537 1.00 0.00 C ATOM 22524 H5R OL 588 96.427 105.275 51.971 1.00 0.00 H ATOM 22525 H5S OL 588 94.848 105.899 51.909 1.00 0.00 H ATOM 22526 C16 OL 588 96.333 107.320 52.455 1.00 0.00 C ATOM 22527 H6R OL 588 95.697 108.045 52.968 1.00 0.00 H ATOM 22528 H6S OL 588 97.247 107.209 53.042 1.00 0.00 H ATOM 22529 C17 OL 588 96.650 107.893 51.157 1.00 0.00 C ATOM 22530 H7R OL 588 96.891 107.064 50.489 1.00 0.00 H ATOM 22531 H7S OL 588 95.735 108.160 50.625 1.00 0.00 H ATOM 22532 C18 OL 588 97.700 109.025 51.138 1.00 0.00 C ATOM 22533 H8R OL 588 98.549 108.789 51.783 1.00 0.00 H ATOM 22534 H8S OL 588 98.103 109.144 50.131 1.00 0.00 H ATOM 22535 C19 OL 588 97.106 110.251 51.693 1.00 0.00 C ATOM 22536 H9R OL 588 96.581 110.206 52.644 1.00 0.00 H ATOM 22537 C110 OL 588 97.053 111.382 51.000 1.00 0.00 C ATOM 22538 H10R OL 588 96.528 112.253 51.385 1.00 0.00 H ATOM 22539 C111 OL 588 97.656 111.681 49.649 1.00 0.00 C ATOM 22540 H11R OL 588 98.429 110.958 49.383 1.00 0.00 H ATOM 22541 H11S OL 588 96.920 111.582 48.847 1.00 0.00 H ATOM 22542 C112 OL 588 98.239 113.111 49.621 1.00 0.00 C ATOM 22543 H12R OL 588 97.406 113.797 49.790 1.00 0.00 H ATOM 22544 H12S OL 588 98.860 113.210 50.513 1.00 0.00 H ATOM 22545 C113 OL 588 98.900 113.580 48.296 1.00 0.00 C ATOM 22546 H13R OL 588 99.781 113.019 47.978 1.00 0.00 H ATOM 22547 H13S OL 588 98.346 113.300 47.398 1.00 0.00 H ATOM 22548 C114 OL 588 99.208 115.089 48.285 1.00 0.00 C ATOM 22549 H14R OL 588 98.296 115.673 48.145 1.00 0.00 H ATOM 22550 H14S OL 588 99.740 115.455 49.166 1.00 0.00 H ATOM 22551 C115 OL 588 99.959 115.472 47.072 1.00 0.00 C ATOM 22552 H15R OL 588 100.853 114.852 46.980 1.00 0.00 H ATOM 22553 H15S OL 588 99.419 115.219 46.157 1.00 0.00 H ATOM 22554 C116 OL 588 100.569 116.865 47.156 1.00 0.00 C ATOM 22555 H16R OL 588 101.189 117.029 48.040 1.00 0.00 H ATOM 22556 H16S OL 588 101.254 116.867 46.306 1.00 0.00 H ATOM 22557 C117 OL 588 99.627 118.093 46.993 1.00 0.00 C ATOM 22558 H17R OL 588 99.023 118.135 47.902 1.00 0.00 H ATOM 22559 H17S OL 588 100.200 119.023 47.017 1.00 0.00 H ATOM 22560 C118 OL 588 98.838 118.106 45.679 1.00 0.00 C ATOM 22561 H18R OL 588 98.215 118.994 45.551 1.00 0.00 H ATOM 22562 H18S OL 588 98.229 117.211 45.541 1.00 0.00 H ATOM 22563 H18T OL 588 99.484 117.841 44.840 1.00 0.00 H TER 22564 OL 588 ATOM 22564 C116 PA 589 131.902 109.186 40.162 1.00 0.00 C ATOM 22565 H16R PA 589 130.889 109.190 39.755 1.00 0.00 H ATOM 22566 H16S PA 589 132.355 108.250 39.830 1.00 0.00 H ATOM 22567 H16T PA 589 132.436 109.975 39.628 1.00 0.00 H ATOM 22568 C115 PA 589 131.850 109.500 41.736 1.00 0.00 C ATOM 22569 H15R PA 589 131.401 110.496 41.749 1.00 0.00 H ATOM 22570 H15S PA 589 132.871 109.698 42.069 1.00 0.00 H ATOM 22571 C114 PA 589 131.124 108.668 42.737 1.00 0.00 C ATOM 22572 H14R PA 589 131.323 108.991 43.762 1.00 0.00 H ATOM 22573 H14S PA 589 131.637 107.705 42.695 1.00 0.00 H ATOM 22574 C113 PA 589 129.606 108.673 42.579 1.00 0.00 C ATOM 22575 H13R PA 589 129.128 108.235 41.700 1.00 0.00 H ATOM 22576 H13S PA 589 129.155 109.661 42.692 1.00 0.00 H ATOM 22577 C112 PA 589 128.845 107.928 43.767 1.00 0.00 C ATOM 22578 H12R PA 589 127.760 107.853 43.666 1.00 0.00 H ATOM 22579 H12S PA 589 128.993 108.490 44.691 1.00 0.00 H ATOM 22580 C111 PA 589 129.374 106.518 44.067 1.00 0.00 C ATOM 22581 H11R PA 589 130.433 106.542 44.332 1.00 0.00 H ATOM 22582 H11S PA 589 129.216 105.972 43.135 1.00 0.00 H ATOM 22583 C110 PA 589 128.642 105.741 45.187 1.00 0.00 C ATOM 22584 H10R PA 589 129.106 104.754 45.232 1.00 0.00 H ATOM 22585 H10S PA 589 127.591 105.559 44.953 1.00 0.00 H ATOM 22586 C19 PA 589 128.551 106.298 46.559 1.00 0.00 C ATOM 22587 H9R PA 589 128.048 105.545 47.170 1.00 0.00 H ATOM 22588 H9S PA 589 127.787 107.077 46.577 1.00 0.00 H ATOM 22589 C18 PA 589 129.915 106.716 47.191 1.00 0.00 C ATOM 22590 H8R PA 589 130.385 107.467 46.553 1.00 0.00 H ATOM 22591 H8S PA 589 130.485 105.787 47.261 1.00 0.00 H ATOM 22592 C17 PA 589 129.749 107.362 48.576 1.00 0.00 C ATOM 22593 H7R PA 589 129.014 106.674 49.000 1.00 0.00 H ATOM 22594 H7S PA 589 129.237 108.308 48.390 1.00 0.00 H ATOM 22595 C16 PA 589 130.937 107.440 49.425 1.00 0.00 C ATOM 22596 H6R PA 589 131.636 108.215 49.101 1.00 0.00 H ATOM 22597 H6S PA 589 131.471 106.488 49.444 1.00 0.00 H ATOM 22598 C15 PA 589 130.572 107.805 50.876 1.00 0.00 C ATOM 22599 H5R PA 589 129.819 108.596 50.860 1.00 0.00 H ATOM 22600 H5S PA 589 131.503 108.199 51.290 1.00 0.00 H ATOM 22601 C14 PA 589 130.137 106.526 51.649 1.00 0.00 C ATOM 22602 H4R PA 589 130.994 105.850 51.669 1.00 0.00 H ATOM 22603 H4S PA 589 129.340 106.000 51.119 1.00 0.00 H ATOM 22604 C13 PA 589 129.944 106.852 53.155 1.00 0.00 C ATOM 22605 H3R PA 589 129.061 107.479 53.292 1.00 0.00 H ATOM 22606 H3S PA 589 130.822 107.306 53.620 1.00 0.00 H ATOM 22607 C12 PA 589 129.686 105.601 54.027 1.00 0.00 C ATOM 22608 H2R PA 589 130.288 104.711 53.831 1.00 0.00 H ATOM 22609 H2S PA 589 128.684 105.194 53.880 1.00 0.00 H ATOM 22610 C11 PGR 590 129.835 105.844 55.512 1.00 0.00 C ATOM 22611 O12 PGR 590 130.534 106.668 56.054 1.00 0.00 O ATOM 22612 O11 PGR 590 129.135 104.866 56.218 1.00 0.00 O ATOM 22613 C1 PGR 590 129.298 104.771 57.635 1.00 0.00 C ATOM 22614 HR PGR 590 130.383 104.716 57.753 1.00 0.00 H ATOM 22615 HS PGR 590 128.867 103.856 58.050 1.00 0.00 H ATOM 22616 C2 PGR 590 128.621 106.001 58.230 1.00 0.00 C ATOM 22617 HX PGR 590 128.924 106.977 57.842 1.00 0.00 H ATOM 22618 C3 PGR 590 128.732 106.075 59.745 1.00 0.00 C ATOM 22619 HA PGR 590 129.778 105.934 60.031 1.00 0.00 H ATOM 22620 HB PGR 590 128.094 105.320 60.212 1.00 0.00 H ATOM 22621 O31 PGR 590 128.313 107.359 60.184 1.00 0.00 O ATOM 22622 P31 PGR 590 128.187 107.834 61.657 1.00 0.00 P ATOM 22623 O32 PGR 590 126.615 107.832 61.841 1.00 0.00 O ATOM 22624 C31 PGR 590 125.846 108.971 61.327 1.00 0.00 C ATOM 22625 H1A PGR 590 126.275 109.922 61.652 1.00 0.00 H ATOM 22626 H1B PGR 590 126.045 108.881 60.256 1.00 0.00 H ATOM 22627 C32 PGR 590 124.406 108.656 61.695 1.00 0.00 C ATOM 22628 H2A PGR 590 123.726 109.303 61.136 1.00 0.00 H ATOM 22629 O35 PGR 590 124.288 108.801 63.172 1.00 0.00 O ATOM 22630 HO5A PGR 590 124.681 108.044 63.643 1.00 0.00 H ATOM 22631 C33 PGR 590 124.037 107.207 61.408 1.00 0.00 C ATOM 22632 H3A PGR 590 124.636 106.797 60.592 1.00 0.00 H ATOM 22633 H3B PGR 590 124.310 106.584 62.264 1.00 0.00 H ATOM 22634 O33 PGR 590 128.844 106.864 62.512 1.00 0.00 O ATOM 22635 O34 PGR 590 128.740 109.177 61.788 1.00 0.00 O ATOM 22636 O21 PGR 590 127.233 105.861 57.872 1.00 0.00 O ATOM 22637 C21 PGR 590 126.536 107.013 57.716 1.00 0.00 C ATOM 22638 O22 PGR 590 127.013 108.132 57.673 1.00 0.00 O ATOM 22639 O36 PGR 590 122.611 107.062 61.134 1.00 0.00 O ATOM 22640 HO6A PGR 590 122.430 106.142 60.869 1.00 0.00 H ATOM 22641 C12 OL 591 125.156 106.662 57.338 1.00 0.00 C ATOM 22642 H2R OL 591 124.657 106.014 58.062 1.00 0.00 H ATOM 22643 H2S OL 591 124.555 107.572 57.287 1.00 0.00 H ATOM 22644 C13 OL 591 125.132 106.029 55.915 1.00 0.00 C ATOM 22645 H3R OL 591 125.881 105.234 55.912 1.00 0.00 H ATOM 22646 H3S OL 591 124.141 105.622 55.706 1.00 0.00 H ATOM 22647 C14 OL 591 125.465 106.923 54.725 1.00 0.00 C ATOM 22648 H4R OL 591 124.623 107.614 54.637 1.00 0.00 H ATOM 22649 H4S OL 591 126.341 107.541 54.936 1.00 0.00 H ATOM 22650 C15 OL 591 125.578 106.164 53.382 1.00 0.00 C ATOM 22651 H5R OL 591 126.464 105.526 53.405 1.00 0.00 H ATOM 22652 H5S OL 591 124.731 105.517 53.141 1.00 0.00 H ATOM 22653 C16 OL 591 125.624 107.170 52.184 1.00 0.00 C ATOM 22654 H6R OL 591 124.639 107.637 52.118 1.00 0.00 H ATOM 22655 H6S OL 591 126.334 107.964 52.426 1.00 0.00 H ATOM 22656 C17 OL 591 126.037 106.527 50.847 1.00 0.00 C ATOM 22657 H7R OL 591 127.043 106.113 50.942 1.00 0.00 H ATOM 22658 H7S OL 591 125.281 105.749 50.726 1.00 0.00 H ATOM 22659 C18 OL 591 126.152 107.558 49.688 1.00 0.00 C ATOM 22660 H8R OL 591 126.835 108.368 49.952 1.00 0.00 H ATOM 22661 H8S OL 591 126.503 107.026 48.802 1.00 0.00 H ATOM 22662 C19 OL 591 124.869 108.240 49.334 1.00 0.00 C ATOM 22663 H9R OL 591 124.513 108.905 50.116 1.00 0.00 H ATOM 22664 C110 OL 591 124.199 108.172 48.206 1.00 0.00 C ATOM 22665 H10R OL 591 123.279 108.745 48.117 1.00 0.00 H ATOM 22666 C111 OL 591 124.655 107.525 46.927 1.00 0.00 C ATOM 22667 H11R OL 591 125.736 107.534 47.076 1.00 0.00 H ATOM 22668 H11S OL 591 124.390 106.466 46.940 1.00 0.00 H ATOM 22669 C112 OL 591 124.329 108.104 45.515 1.00 0.00 C ATOM 22670 H12R OL 591 124.772 109.094 45.389 1.00 0.00 H ATOM 22671 H12S OL 591 124.620 107.474 44.672 1.00 0.00 H ATOM 22672 C113 OL 591 122.780 108.394 45.550 1.00 0.00 C ATOM 22673 H13R OL 591 122.206 107.496 45.789 1.00 0.00 H ATOM 22674 H13S OL 591 122.528 109.027 46.403 1.00 0.00 H ATOM 22675 C114 OL 591 122.182 109.062 44.378 1.00 0.00 C ATOM 22676 H14R OL 591 122.753 109.967 44.158 1.00 0.00 H ATOM 22677 H14S OL 591 122.395 108.416 43.523 1.00 0.00 H ATOM 22678 C115 OL 591 120.735 109.372 44.617 1.00 0.00 C ATOM 22679 H15R OL 591 120.298 108.404 44.869 1.00 0.00 H ATOM 22680 H15S OL 591 120.543 110.025 45.472 1.00 0.00 H ATOM 22681 C116 OL 591 120.146 110.065 43.363 1.00 0.00 C ATOM 22682 H16R OL 591 120.837 110.883 43.153 1.00 0.00 H ATOM 22683 H16S OL 591 120.211 109.409 42.493 1.00 0.00 H ATOM 22684 C117 OL 591 118.721 110.457 43.477 1.00 0.00 C ATOM 22685 H17R OL 591 118.538 111.262 44.192 1.00 0.00 H ATOM 22686 H17S OL 591 118.397 111.020 42.599 1.00 0.00 H ATOM 22687 C118 OL 591 117.748 109.369 43.884 1.00 0.00 C ATOM 22688 H18R OL 591 117.715 109.205 44.963 1.00 0.00 H ATOM 22689 H18S OL 591 118.168 108.471 43.426 1.00 0.00 H ATOM 22690 H18T OL 591 116.745 109.544 43.489 1.00 0.00 H TER 22691 OL 591 ATOM 22691 C116 PA 592 106.067 125.791 43.791 1.00 0.00 C ATOM 22692 H16R PA 592 106.374 124.806 44.151 1.00 0.00 H ATOM 22693 H16S PA 592 105.227 125.592 43.123 1.00 0.00 H ATOM 22694 H16T PA 592 105.763 126.369 44.667 1.00 0.00 H ATOM 22695 C115 PA 592 107.125 126.569 42.955 1.00 0.00 C ATOM 22696 H15R PA 592 106.632 127.308 42.320 1.00 0.00 H ATOM 22697 H15S PA 592 107.576 125.931 42.193 1.00 0.00 H ATOM 22698 C114 PA 592 108.346 127.174 43.819 1.00 0.00 C ATOM 22699 H14R PA 592 108.810 126.395 44.428 1.00 0.00 H ATOM 22700 H14S PA 592 107.957 127.751 44.660 1.00 0.00 H ATOM 22701 C113 PA 592 109.487 127.836 43.057 1.00 0.00 C ATOM 22702 H13R PA 592 109.119 128.781 42.650 1.00 0.00 H ATOM 22703 H13S PA 592 109.626 127.196 42.183 1.00 0.00 H ATOM 22704 C112 PA 592 110.861 127.909 43.787 1.00 0.00 C ATOM 22705 H12R PA 592 111.621 128.460 43.229 1.00 0.00 H ATOM 22706 H12S PA 592 111.186 126.884 43.975 1.00 0.00 H ATOM 22707 C111 PA 592 110.778 128.833 44.970 1.00 0.00 C ATOM 22708 H11R PA 592 109.936 129.524 44.892 1.00 0.00 H ATOM 22709 H11S PA 592 111.708 129.403 45.005 1.00 0.00 H ATOM 22710 C110 PA 592 110.599 128.143 46.327 1.00 0.00 C ATOM 22711 H10R PA 592 111.538 127.652 46.591 1.00 0.00 H ATOM 22712 H10S PA 592 109.826 127.395 46.140 1.00 0.00 H ATOM 22713 C19 PA 592 110.263 129.037 47.440 1.00 0.00 C ATOM 22714 H9R PA 592 110.069 128.426 48.323 1.00 0.00 H ATOM 22715 H9S PA 592 109.366 129.573 47.121 1.00 0.00 H ATOM 22716 C18 PA 592 111.285 130.123 47.705 1.00 0.00 C ATOM 22717 H8R PA 592 110.971 130.701 48.576 1.00 0.00 H ATOM 22718 H8S PA 592 111.373 130.886 46.928 1.00 0.00 H ATOM 22719 C17 PA 592 112.680 129.653 47.875 1.00 0.00 C ATOM 22720 H7R PA 592 112.987 129.250 46.908 1.00 0.00 H ATOM 22721 H7S PA 592 112.682 128.838 48.601 1.00 0.00 H ATOM 22722 C16 PA 592 113.699 130.706 48.267 1.00 0.00 C ATOM 22723 H6R PA 592 113.482 131.597 47.674 1.00 0.00 H ATOM 22724 H6S PA 592 114.724 130.457 47.985 1.00 0.00 H ATOM 22725 C15 PA 592 113.562 131.131 49.666 1.00 0.00 C ATOM 22726 H5R PA 592 113.857 130.227 50.204 1.00 0.00 H ATOM 22727 H5S PA 592 112.563 131.445 49.977 1.00 0.00 H ATOM 22728 C14 PA 592 114.626 132.186 50.222 1.00 0.00 C ATOM 22729 H4R PA 592 114.611 133.010 49.506 1.00 0.00 H ATOM 22730 H4S PA 592 115.646 131.805 50.131 1.00 0.00 H ATOM 22731 C13 PA 592 114.373 132.657 51.723 1.00 0.00 C ATOM 22732 H3R PA 592 115.143 133.366 52.035 1.00 0.00 H ATOM 22733 H3S PA 592 114.552 131.791 52.362 1.00 0.00 H ATOM 22734 C12 PA 592 113.065 133.267 52.126 1.00 0.00 C ATOM 22735 H2R PA 592 112.237 132.576 51.955 1.00 0.00 H ATOM 22736 H2S PA 592 112.818 134.154 51.539 1.00 0.00 H ATOM 22737 C11 PGR 593 113.058 133.662 53.600 1.00 0.00 C ATOM 22738 O12 PGR 593 112.376 133.091 54.423 1.00 0.00 O ATOM 22739 O11 PGR 593 113.921 134.634 53.960 1.00 0.00 O ATOM 22740 C1 PGR 593 114.124 135.003 55.370 1.00 0.00 C ATOM 22741 HR PGR 593 113.183 135.339 55.813 1.00 0.00 H ATOM 22742 HS PGR 593 114.742 135.905 55.378 1.00 0.00 H ATOM 22743 C2 PGR 593 114.854 133.888 56.143 1.00 0.00 C ATOM 22744 HX PGR 593 114.142 133.068 56.271 1.00 0.00 H ATOM 22745 C3 PGR 593 115.097 134.320 57.595 1.00 0.00 C ATOM 22746 HA PGR 593 114.123 134.627 57.985 1.00 0.00 H ATOM 22747 HB PGR 593 115.813 135.147 57.586 1.00 0.00 H ATOM 22748 O31 PGR 593 115.702 133.255 58.321 1.00 0.00 O ATOM 22749 P31 PGR 593 116.745 133.491 59.492 1.00 0.00 P ATOM 22750 O32 PGR 593 118.110 133.718 58.805 1.00 0.00 O ATOM 22751 C31 PGR 593 119.136 132.686 58.681 1.00 0.00 C ATOM 22752 H1A PGR 593 119.018 131.921 59.451 1.00 0.00 H ATOM 22753 H1B PGR 593 119.073 132.190 57.709 1.00 0.00 H ATOM 22754 C32 PGR 593 120.444 133.431 58.909 1.00 0.00 C ATOM 22755 H2A PGR 593 121.218 132.663 58.971 1.00 0.00 H ATOM 22756 O35 PGR 593 120.703 134.242 57.707 1.00 0.00 O ATOM 22757 HO5A PGR 593 120.046 134.959 57.765 1.00 0.00 H ATOM 22758 C33 PGR 593 120.463 134.274 60.180 1.00 0.00 C ATOM 22759 H3A PGR 593 119.797 135.136 60.092 1.00 0.00 H ATOM 22760 H3B PGR 593 120.173 133.702 61.065 1.00 0.00 H ATOM 22761 O33 PGR 593 116.422 134.801 60.138 1.00 0.00 O ATOM 22762 O34 PGR 593 116.758 132.231 60.274 1.00 0.00 O ATOM 22763 O21 PGR 593 116.005 133.305 55.434 1.00 0.00 O ATOM 22764 C21 PGR 593 117.103 134.100 55.216 1.00 0.00 C ATOM 22765 O22 PGR 593 117.055 135.272 55.463 1.00 0.00 O ATOM 22766 O36 PGR 593 121.850 134.668 60.373 1.00 0.00 O ATOM 22767 HO6A PGR 593 121.849 135.233 61.167 1.00 0.00 H ATOM 22768 C12 OL 594 118.267 133.426 54.595 1.00 0.00 C ATOM 22769 H2R OL 594 118.700 133.928 53.727 1.00 0.00 H ATOM 22770 H2S OL 594 119.140 133.441 55.251 1.00 0.00 H ATOM 22771 C13 OL 594 117.973 131.990 54.231 1.00 0.00 C ATOM 22772 H3R OL 594 117.424 131.525 55.052 1.00 0.00 H ATOM 22773 H3S OL 594 117.168 132.080 53.499 1.00 0.00 H ATOM 22774 C14 OL 594 119.215 131.185 53.852 1.00 0.00 C ATOM 22775 H4R OL 594 119.784 131.671 53.057 1.00 0.00 H ATOM 22776 H4S OL 594 119.952 131.139 54.658 1.00 0.00 H ATOM 22777 C15 OL 594 118.904 129.774 53.333 1.00 0.00 C ATOM 22778 H5R OL 594 118.197 129.794 52.502 1.00 0.00 H ATOM 22779 H5S OL 594 119.830 129.393 52.896 1.00 0.00 H ATOM 22780 C16 OL 594 118.316 128.790 54.325 1.00 0.00 C ATOM 22781 H6R OL 594 118.963 128.783 55.204 1.00 0.00 H ATOM 22782 H6S OL 594 117.343 129.214 54.583 1.00 0.00 H ATOM 22783 C17 OL 594 118.167 127.327 53.873 1.00 0.00 C ATOM 22784 H7R OL 594 119.064 126.957 53.372 1.00 0.00 H ATOM 22785 H7S OL 594 117.992 126.740 54.777 1.00 0.00 H ATOM 22786 C18 OL 594 117.029 127.160 52.763 1.00 0.00 C ATOM 22787 H8R OL 594 116.636 126.153 52.919 1.00 0.00 H ATOM 22788 H8S OL 594 116.262 127.884 53.045 1.00 0.00 H ATOM 22789 C19 OL 594 117.404 127.429 51.353 1.00 0.00 C ATOM 22790 H9R OL 594 117.217 128.409 50.920 1.00 0.00 H ATOM 22791 C110 OL 594 118.204 126.647 50.671 1.00 0.00 C ATOM 22792 H10R OL 594 118.448 126.939 49.653 1.00 0.00 H ATOM 22793 C111 OL 594 118.623 125.319 51.048 1.00 0.00 C ATOM 22794 H11R OL 594 119.687 125.396 51.282 1.00 0.00 H ATOM 22795 H11S OL 594 118.096 125.061 51.968 1.00 0.00 H ATOM 22796 C112 OL 594 118.256 124.178 50.035 1.00 0.00 C ATOM 22797 H12R OL 594 117.183 124.212 49.832 1.00 0.00 H ATOM 22798 H12S OL 594 118.738 124.352 49.072 1.00 0.00 H ATOM 22799 C113 OL 594 118.810 122.784 50.424 1.00 0.00 C ATOM 22800 H13R OL 594 119.796 122.952 50.862 1.00 0.00 H ATOM 22801 H13S OL 594 118.114 122.354 51.147 1.00 0.00 H ATOM 22802 C114 OL 594 119.016 121.868 49.166 1.00 0.00 C ATOM 22803 H14R OL 594 120.007 122.037 48.739 1.00 0.00 H ATOM 22804 H14S OL 594 119.099 120.912 49.688 1.00 0.00 H ATOM 22805 C115 OL 594 117.874 121.949 48.099 1.00 0.00 C ATOM 22806 H15R OL 594 116.885 121.958 48.560 1.00 0.00 H ATOM 22807 H15S OL 594 118.011 122.832 47.471 1.00 0.00 H ATOM 22808 C116 OL 594 117.989 120.634 47.335 1.00 0.00 C ATOM 22809 H16R OL 594 118.975 120.594 46.867 1.00 0.00 H ATOM 22810 H16S OL 594 117.872 119.751 47.966 1.00 0.00 H ATOM 22811 C117 OL 594 116.827 120.625 46.401 1.00 0.00 C ATOM 22812 H17R OL 594 115.906 120.701 46.984 1.00 0.00 H ATOM 22813 H17S OL 594 116.905 121.459 45.701 1.00 0.00 H ATOM 22814 C118 OL 594 116.571 119.394 45.478 1.00 0.00 C ATOM 22815 H18R OL 594 115.824 119.603 44.709 1.00 0.00 H ATOM 22816 H18S OL 594 116.263 118.517 46.051 1.00 0.00 H ATOM 22817 H18T OL 594 117.447 119.247 44.842 1.00 0.00 H TER 22818 OL 594 ATOM 22818 C116 PA 595 142.109 40.427 37.814 1.00 0.00 C ATOM 22819 H16R PA 595 142.405 41.304 38.394 1.00 0.00 H ATOM 22820 H16S PA 595 141.098 40.548 37.420 1.00 0.00 H ATOM 22821 H16T PA 595 142.789 40.453 36.960 1.00 0.00 H ATOM 22822 C115 PA 595 142.415 39.243 38.736 1.00 0.00 C ATOM 22823 H15R PA 595 142.076 38.324 38.255 1.00 0.00 H ATOM 22824 H15S PA 595 141.779 39.358 39.616 1.00 0.00 H ATOM 22825 C114 PA 595 143.944 39.174 39.023 1.00 0.00 C ATOM 22826 H14R PA 595 144.223 40.183 39.335 1.00 0.00 H ATOM 22827 H14S PA 595 144.529 38.861 38.156 1.00 0.00 H ATOM 22828 C113 PA 595 144.241 38.245 40.192 1.00 0.00 C ATOM 22829 H13R PA 595 143.727 38.692 41.046 1.00 0.00 H ATOM 22830 H13S PA 595 145.320 38.316 40.342 1.00 0.00 H ATOM 22831 C112 PA 595 143.938 36.754 40.101 1.00 0.00 C ATOM 22832 H12R PA 595 144.570 36.520 39.242 1.00 0.00 H ATOM 22833 H12S PA 595 142.946 36.548 39.695 1.00 0.00 H ATOM 22834 C111 PA 595 144.334 35.951 41.379 1.00 0.00 C ATOM 22835 H11R PA 595 145.206 36.288 41.943 1.00 0.00 H ATOM 22836 H11S PA 595 144.605 34.957 41.018 1.00 0.00 H ATOM 22837 C110 PA 595 143.150 36.016 42.386 1.00 0.00 C ATOM 22838 H10R PA 595 142.204 35.816 41.880 1.00 0.00 H ATOM 22839 H10S PA 595 142.927 37.019 42.756 1.00 0.00 H ATOM 22840 C19 PA 595 143.290 35.035 43.525 1.00 0.00 C ATOM 22841 H9R PA 595 144.199 35.292 44.072 1.00 0.00 H ATOM 22842 H9S PA 595 143.180 34.058 43.049 1.00 0.00 H ATOM 22843 C18 PA 595 142.115 35.063 44.456 1.00 0.00 C ATOM 22844 H8R PA 595 141.270 34.875 43.791 1.00 0.00 H ATOM 22845 H8S PA 595 142.049 36.044 44.931 1.00 0.00 H ATOM 22846 C17 PA 595 142.251 33.936 45.505 1.00 0.00 C ATOM 22847 H7R PA 595 143.125 34.173 46.115 1.00 0.00 H ATOM 22848 H7S PA 595 142.359 32.988 44.974 1.00 0.00 H ATOM 22849 C16 PA 595 141.119 33.893 46.559 1.00 0.00 C ATOM 22850 H6R PA 595 140.222 33.424 46.150 1.00 0.00 H ATOM 22851 H6S PA 595 140.696 34.875 46.779 1.00 0.00 H ATOM 22852 C15 PA 595 141.510 33.141 47.830 1.00 0.00 C ATOM 22853 H5R PA 595 142.260 33.742 48.349 1.00 0.00 H ATOM 22854 H5S PA 595 141.971 32.198 47.528 1.00 0.00 H ATOM 22855 C14 PA 595 140.340 32.960 48.835 1.00 0.00 C ATOM 22856 H4R PA 595 139.436 32.692 48.284 1.00 0.00 H ATOM 22857 H4S PA 595 140.042 33.918 49.265 1.00 0.00 H ATOM 22858 C13 PA 595 140.583 31.994 49.948 1.00 0.00 C ATOM 22859 H3R PA 595 141.597 32.206 50.291 1.00 0.00 H ATOM 22860 H3S PA 595 140.546 30.970 49.569 1.00 0.00 H ATOM 22861 C12 PA 595 139.531 32.213 51.070 1.00 0.00 C ATOM 22862 H2R PA 595 138.491 32.190 50.737 1.00 0.00 H ATOM 22863 H2S PA 595 139.658 33.213 51.491 1.00 0.00 H ATOM 22864 C11 PC 596 139.695 31.065 52.140 1.00 0.00 C ATOM 22865 O12 PC 596 140.713 30.558 52.461 1.00 0.00 O ATOM 22866 O11 PC 596 138.540 30.970 52.772 1.00 0.00 O ATOM 22867 C1 PC 596 138.319 29.851 53.613 1.00 0.00 C ATOM 22868 HR PC 596 139.019 29.918 54.450 1.00 0.00 H ATOM 22869 HS PC 596 138.507 28.948 53.026 1.00 0.00 H ATOM 22870 C2 PC 596 136.826 29.820 53.959 1.00 0.00 C ATOM 22871 HX PC 596 136.307 30.684 53.536 1.00 0.00 H ATOM 22872 C3 PC 596 136.664 29.976 55.492 1.00 0.00 C ATOM 22873 HA PC 596 135.611 30.088 55.763 1.00 0.00 H ATOM 22874 HB PC 596 137.087 30.943 55.774 1.00 0.00 H ATOM 22875 O31 PC 596 137.187 28.868 56.228 1.00 0.00 O ATOM 22876 P31 PC 596 136.984 28.674 57.830 1.00 0.00 P ATOM 22877 O32 PC 596 137.881 29.880 58.420 1.00 0.00 O ATOM 22878 C31 PC 596 139.188 29.954 58.035 1.00 0.00 C ATOM 22879 H1A PC 596 139.164 30.227 56.977 1.00 0.00 H ATOM 22880 H1B PC 596 139.736 29.011 58.106 1.00 0.00 H ATOM 22881 C32 PC 596 139.923 31.190 58.638 1.00 0.00 C ATOM 22882 H2A PC 596 139.204 32.010 58.627 1.00 0.00 H ATOM 22883 H2B PC 596 140.830 31.370 58.059 1.00 0.00 H ATOM 22884 N31 PC 596 140.451 31.198 60.054 1.00 0.00 N ATOM 22885 C33 PC 596 141.249 29.934 60.371 1.00 0.00 C ATOM 22886 H3A PC 596 140.616 29.054 60.249 1.00 0.00 H ATOM 22887 H3B PC 596 141.689 29.969 61.369 1.00 0.00 H ATOM 22888 H3C PC 596 141.996 29.977 59.576 1.00 0.00 H ATOM 22889 C34 PC 596 141.518 32.240 60.238 1.00 0.00 C ATOM 22890 H4A PC 596 142.330 32.159 59.512 1.00 0.00 H ATOM 22891 H4B PC 596 141.916 32.235 61.254 1.00 0.00 H ATOM 22892 H4C PC 596 141.117 33.239 60.064 1.00 0.00 H ATOM 22893 C35 PC 596 139.426 31.566 61.003 1.00 0.00 C ATOM 22894 H5A PC 596 139.149 32.617 60.917 1.00 0.00 H ATOM 22895 H5B PC 596 139.731 31.350 62.029 1.00 0.00 H ATOM 22896 H5C PC 596 138.579 30.934 60.732 1.00 0.00 H ATOM 22897 O33 PC 596 135.599 28.975 58.223 1.00 0.00 O ATOM 22898 O34 PC 596 137.718 27.469 58.312 1.00 0.00 O ATOM 22899 O21 PC 596 136.249 28.615 53.363 1.00 0.00 O ATOM 22900 C21 PC 596 134.912 28.656 53.157 1.00 0.00 C ATOM 22901 O22 PC 596 134.147 29.578 53.492 1.00 0.00 O ATOM 22902 C12 OL 597 134.398 27.491 52.221 1.00 0.00 C ATOM 22903 H2R OL 597 134.496 27.789 51.175 1.00 0.00 H ATOM 22904 H2S OL 597 135.036 26.617 52.365 1.00 0.00 H ATOM 22905 C13 OL 597 132.901 27.114 52.598 1.00 0.00 C ATOM 22906 H3R OL 597 132.773 27.022 53.678 1.00 0.00 H ATOM 22907 H3S OL 597 132.237 27.869 52.173 1.00 0.00 H ATOM 22908 C14 OL 597 132.566 25.718 52.025 1.00 0.00 C ATOM 22909 H4R OL 597 132.741 25.739 50.948 1.00 0.00 H ATOM 22910 H4S OL 597 133.126 24.892 52.470 1.00 0.00 H ATOM 22911 C15 OL 597 131.062 25.424 52.128 1.00 0.00 C ATOM 22912 H5R OL 597 130.803 25.682 53.157 1.00 0.00 H ATOM 22913 H5S OL 597 130.449 26.099 51.528 1.00 0.00 H ATOM 22914 C16 OL 597 130.864 23.953 51.779 1.00 0.00 C ATOM 22915 H6R OL 597 131.270 23.820 50.774 1.00 0.00 H ATOM 22916 H6S OL 597 131.520 23.300 52.357 1.00 0.00 H ATOM 22917 C17 OL 597 129.383 23.499 51.918 1.00 0.00 C ATOM 22918 H7R OL 597 129.155 23.610 52.980 1.00 0.00 H ATOM 22919 H7S OL 597 128.652 24.125 51.401 1.00 0.00 H ATOM 22920 C18 OL 597 129.159 22.082 51.353 1.00 0.00 C ATOM 22921 H8R OL 597 129.742 21.347 51.912 1.00 0.00 H ATOM 22922 H8S OL 597 128.164 21.653 51.487 1.00 0.00 H ATOM 22923 C19 OL 597 129.309 22.057 49.835 1.00 0.00 C ATOM 22924 H9R OL 597 128.849 22.917 49.356 1.00 0.00 H ATOM 22925 C110 OL 597 129.968 21.214 49.036 1.00 0.00 C ATOM 22926 H10R OL 597 129.884 21.547 48.005 1.00 0.00 H ATOM 22927 C111 OL 597 130.712 19.935 49.342 1.00 0.00 C ATOM 22928 H11R OL 597 130.897 19.827 50.413 1.00 0.00 H ATOM 22929 H11S OL 597 130.104 19.048 49.153 1.00 0.00 H ATOM 22930 C112 OL 597 132.135 19.942 48.613 1.00 0.00 C ATOM 22931 H12R OL 597 132.703 20.821 48.927 1.00 0.00 H ATOM 22932 H12S OL 597 132.697 19.074 48.963 1.00 0.00 H ATOM 22933 C113 OL 597 131.971 19.976 47.023 1.00 0.00 C ATOM 22934 H13R OL 597 131.262 19.210 46.703 1.00 0.00 H ATOM 22935 H13S OL 597 131.354 20.809 46.681 1.00 0.00 H ATOM 22936 C114 OL 597 133.281 19.995 46.277 1.00 0.00 C ATOM 22937 H14R OL 597 133.198 20.415 45.272 1.00 0.00 H ATOM 22938 H14S OL 597 133.974 20.575 46.889 1.00 0.00 H ATOM 22939 C115 OL 597 133.853 18.626 45.971 1.00 0.00 C ATOM 22940 H15R OL 597 133.835 18.028 46.884 1.00 0.00 H ATOM 22941 H15S OL 597 133.156 18.128 45.293 1.00 0.00 H ATOM 22942 C116 OL 597 135.298 18.744 45.500 1.00 0.00 C ATOM 22943 H16R OL 597 135.822 19.328 46.260 1.00 0.00 H ATOM 22944 H16S OL 597 135.853 17.805 45.468 1.00 0.00 H ATOM 22945 C117 OL 597 135.339 19.356 44.077 1.00 0.00 C ATOM 22946 H17R OL 597 134.922 20.362 43.995 1.00 0.00 H ATOM 22947 H17S OL 597 136.423 19.300 43.961 1.00 0.00 H ATOM 22948 C118 OL 597 134.725 18.576 42.990 1.00 0.00 C ATOM 22949 H18R OL 597 135.385 18.657 42.123 1.00 0.00 H ATOM 22950 H18S OL 597 133.702 18.828 42.703 1.00 0.00 H ATOM 22951 H18T OL 597 134.643 17.554 43.366 1.00 0.00 H TER 22952 OL 597 ATOM 22952 C116 PA 598 132.706 21.375 41.078 1.00 0.00 C ATOM 22953 H16R PA 598 133.519 20.661 40.931 1.00 0.00 H ATOM 22954 H16S PA 598 133.211 22.338 41.178 1.00 0.00 H ATOM 22955 H16T PA 598 132.056 21.367 40.201 1.00 0.00 H ATOM 22956 C115 PA 598 131.879 21.173 42.433 1.00 0.00 C ATOM 22957 H15R PA 598 132.493 21.241 43.333 1.00 0.00 H ATOM 22958 H15S PA 598 131.600 20.123 42.550 1.00 0.00 H ATOM 22959 C114 PA 598 130.624 21.936 42.427 1.00 0.00 C ATOM 22960 H14R PA 598 130.073 21.784 41.496 1.00 0.00 H ATOM 22961 H14S PA 598 130.889 22.994 42.475 1.00 0.00 H ATOM 22962 C113 PA 598 129.762 21.762 43.616 1.00 0.00 C ATOM 22963 H13R PA 598 128.929 22.468 43.606 1.00 0.00 H ATOM 22964 H13S PA 598 130.362 21.969 44.505 1.00 0.00 H ATOM 22965 C112 PA 598 129.228 20.359 43.680 1.00 0.00 C ATOM 22966 H12R PA 598 130.041 19.632 43.618 1.00 0.00 H ATOM 22967 H12S PA 598 128.614 20.028 42.840 1.00 0.00 H ATOM 22968 C111 PA 598 128.412 19.998 44.946 1.00 0.00 C ATOM 22969 H11R PA 598 128.980 20.104 45.873 1.00 0.00 H ATOM 22970 H11S PA 598 128.129 18.944 44.911 1.00 0.00 H ATOM 22971 C110 PA 598 127.150 20.813 45.100 1.00 0.00 C ATOM 22972 H10R PA 598 126.268 20.181 45.225 1.00 0.00 H ATOM 22973 H10S PA 598 126.981 21.468 44.243 1.00 0.00 H ATOM 22974 C19 PA 598 127.049 21.634 46.407 1.00 0.00 C ATOM 22975 H9R PA 598 127.859 22.355 46.541 1.00 0.00 H ATOM 22976 H9S PA 598 127.205 21.028 47.302 1.00 0.00 H ATOM 22977 C18 PA 598 125.664 22.340 46.466 1.00 0.00 C ATOM 22978 H8R PA 598 124.967 21.511 46.610 1.00 0.00 H ATOM 22979 H8S PA 598 125.292 22.853 45.577 1.00 0.00 H ATOM 22980 C17 PA 598 125.444 23.330 47.629 1.00 0.00 C ATOM 22981 H7R PA 598 124.402 23.657 47.621 1.00 0.00 H ATOM 22982 H7S PA 598 126.002 24.266 47.574 1.00 0.00 H ATOM 22983 C16 PA 598 125.553 22.637 48.967 1.00 0.00 C ATOM 22984 H6R PA 598 126.541 22.215 49.162 1.00 0.00 H ATOM 22985 H6S PA 598 124.988 21.703 49.004 1.00 0.00 H ATOM 22986 C15 PA 598 125.314 23.613 50.075 1.00 0.00 C ATOM 22987 H5R PA 598 124.586 24.398 49.861 1.00 0.00 H ATOM 22988 H5S PA 598 126.242 24.186 50.141 1.00 0.00 H ATOM 22989 C14 PA 598 125.221 22.852 51.479 1.00 0.00 C ATOM 22990 H4R PA 598 126.165 22.524 51.918 1.00 0.00 H ATOM 22991 H4S PA 598 124.762 21.903 51.198 1.00 0.00 H ATOM 22992 C13 PA 598 124.389 23.491 52.554 1.00 0.00 C ATOM 22993 H3R PA 598 123.410 23.811 52.190 1.00 0.00 H ATOM 22994 H3S PA 598 124.911 24.389 52.891 1.00 0.00 H ATOM 22995 C12 PA 598 124.185 22.632 53.854 1.00 0.00 C ATOM 22996 H2R PA 598 125.152 22.351 54.278 1.00 0.00 H ATOM 22997 H2S PA 598 123.616 21.700 53.831 1.00 0.00 H ATOM 22998 C11 PGR 599 123.534 23.402 55.000 1.00 0.00 C ATOM 22999 O12 PGR 599 123.629 22.954 56.103 1.00 0.00 O ATOM 23000 O11 PGR 599 122.645 24.330 54.531 1.00 0.00 O ATOM 23001 C1 PGR 599 121.628 24.760 55.457 1.00 0.00 C ATOM 23002 HR PGR 599 122.128 24.888 56.421 1.00 0.00 H ATOM 23003 HS PGR 599 120.870 23.992 55.634 1.00 0.00 H ATOM 23004 C2 PGR 599 121.099 26.190 55.189 1.00 0.00 C ATOM 23005 HX PGR 599 121.972 26.808 54.965 1.00 0.00 H ATOM 23006 C3 PGR 599 120.369 26.631 56.493 1.00 0.00 C ATOM 23007 HA PGR 599 120.330 27.720 56.578 1.00 0.00 H ATOM 23008 HB PGR 599 120.898 26.280 57.383 1.00 0.00 H ATOM 23009 O31 PGR 599 119.123 26.058 56.339 1.00 0.00 O ATOM 23010 P31 PGR 599 118.033 26.218 57.449 1.00 0.00 P ATOM 23011 O32 PGR 599 117.905 27.804 57.728 1.00 0.00 O ATOM 23012 C31 PGR 599 116.976 28.300 58.660 1.00 0.00 C ATOM 23013 H1A PGR 599 117.259 27.991 59.670 1.00 0.00 H ATOM 23014 H1B PGR 599 116.043 27.750 58.510 1.00 0.00 H ATOM 23015 C32 PGR 599 116.702 29.793 58.531 1.00 0.00 C ATOM 23016 H2A PGR 599 116.011 30.098 59.321 1.00 0.00 H ATOM 23017 O35 PGR 599 116.023 30.061 57.353 1.00 0.00 O ATOM 23018 HO5A PGR 599 116.575 29.952 56.558 1.00 0.00 H ATOM 23019 C33 PGR 599 117.993 30.763 58.628 1.00 0.00 C ATOM 23020 H3A PGR 599 118.437 30.731 59.626 1.00 0.00 H ATOM 23021 H3B PGR 599 118.828 30.390 58.030 1.00 0.00 H ATOM 23022 O33 PGR 599 116.742 25.764 56.986 1.00 0.00 O ATOM 23023 O34 PGR 599 118.606 25.673 58.716 1.00 0.00 O ATOM 23024 O21 PGR 599 120.362 26.126 54.038 1.00 0.00 O ATOM 23025 C21 PGR 599 119.702 27.262 53.588 1.00 0.00 C ATOM 23026 O22 PGR 599 119.611 28.323 54.173 1.00 0.00 O ATOM 23027 O36 PGR 599 117.545 32.081 58.228 1.00 0.00 O ATOM 23028 HO6A PGR 599 117.024 31.979 57.411 1.00 0.00 H ATOM 23029 C12 OL 600 119.266 26.918 52.140 1.00 0.00 C ATOM 23030 H2R OL 600 120.125 26.943 51.467 1.00 0.00 H ATOM 23031 H2S OL 600 118.938 25.877 52.092 1.00 0.00 H ATOM 23032 C13 OL 600 118.099 27.803 51.651 1.00 0.00 C ATOM 23033 H3R OL 600 117.488 28.098 52.506 1.00 0.00 H ATOM 23034 H3S OL 600 118.495 28.713 51.195 1.00 0.00 H ATOM 23035 C14 OL 600 117.172 27.054 50.641 1.00 0.00 C ATOM 23036 H4R OL 600 117.554 26.057 50.410 1.00 0.00 H ATOM 23037 H4S OL 600 116.174 26.913 51.060 1.00 0.00 H ATOM 23038 C15 OL 600 117.090 27.758 49.281 1.00 0.00 C ATOM 23039 H5R OL 600 116.596 28.717 49.452 1.00 0.00 H ATOM 23040 H5S OL 600 118.087 28.018 48.921 1.00 0.00 H ATOM 23041 C16 OL 600 116.513 26.887 48.244 1.00 0.00 C ATOM 23042 H6R OL 600 117.246 26.171 47.868 1.00 0.00 H ATOM 23043 H6S OL 600 115.711 26.283 48.672 1.00 0.00 H ATOM 23044 C17 OL 600 115.998 27.644 47.059 1.00 0.00 C ATOM 23045 H7R OL 600 115.372 28.460 47.427 1.00 0.00 H ATOM 23046 H7S OL 600 116.867 27.992 46.497 1.00 0.00 H ATOM 23047 C18 OL 600 115.311 26.883 45.896 1.00 0.00 C ATOM 23048 H8R OL 600 115.996 26.168 45.435 1.00 0.00 H ATOM 23049 H8S OL 600 114.471 26.264 46.216 1.00 0.00 H ATOM 23050 C19 OL 600 114.600 27.813 44.891 1.00 0.00 C ATOM 23051 H9R OL 600 113.915 28.525 45.342 1.00 0.00 H ATOM 23052 C110 OL 600 114.500 27.660 43.567 1.00 0.00 C ATOM 23053 H10R OL 600 113.789 28.226 42.972 1.00 0.00 H ATOM 23054 C111 OL 600 115.434 26.836 42.743 1.00 0.00 C ATOM 23055 H11R OL 600 116.100 26.122 43.233 1.00 0.00 H ATOM 23056 H11S OL 600 114.808 26.138 42.184 1.00 0.00 H ATOM 23057 C112 OL 600 116.246 27.750 41.850 1.00 0.00 C ATOM 23058 H12R OL 600 116.693 27.200 41.019 1.00 0.00 H ATOM 23059 H12S OL 600 115.567 28.410 41.306 1.00 0.00 H ATOM 23060 C113 OL 600 117.347 28.639 42.490 1.00 0.00 C ATOM 23061 H13R OL 600 117.260 29.595 41.971 1.00 0.00 H ATOM 23062 H13S OL 600 117.045 28.874 43.513 1.00 0.00 H ATOM 23063 C114 OL 600 118.806 28.123 42.429 1.00 0.00 C ATOM 23064 H14R OL 600 119.505 28.785 42.945 1.00 0.00 H ATOM 23065 H14S OL 600 118.876 27.162 42.942 1.00 0.00 H ATOM 23066 C115 OL 600 119.293 27.786 41.043 1.00 0.00 C ATOM 23067 H15R OL 600 118.712 27.044 40.491 1.00 0.00 H ATOM 23068 H15S OL 600 119.137 28.640 40.380 1.00 0.00 H ATOM 23069 C116 OL 600 120.654 27.332 41.042 1.00 0.00 C ATOM 23070 H16R OL 600 121.279 27.971 41.670 1.00 0.00 H ATOM 23071 H16S OL 600 120.763 26.383 41.572 1.00 0.00 H ATOM 23072 C117 OL 600 121.277 27.111 39.684 1.00 0.00 C ATOM 23073 H17R OL 600 120.681 26.466 39.036 1.00 0.00 H ATOM 23074 H17S OL 600 121.236 28.087 39.195 1.00 0.00 H ATOM 23075 C118 OL 600 122.628 26.458 39.628 1.00 0.00 C ATOM 23076 H18R OL 600 122.665 25.482 40.117 1.00 0.00 H ATOM 23077 H18S OL 600 123.348 27.026 40.221 1.00 0.00 H ATOM 23078 H18T OL 600 123.000 26.308 38.613 1.00 0.00 H TER 23079 OL 600 ATOM 23079 C116 PA 601 140.515 106.181 40.205 1.00 0.00 C ATOM 23080 H16R PA 601 141.311 105.610 39.723 1.00 0.00 H ATOM 23081 H16S PA 601 140.824 107.217 40.362 1.00 0.00 H ATOM 23082 H16T PA 601 139.732 106.199 39.445 1.00 0.00 H ATOM 23083 C115 PA 601 140.132 105.390 41.499 1.00 0.00 C ATOM 23084 H15R PA 601 139.971 104.390 41.091 1.00 0.00 H ATOM 23085 H15S PA 601 139.125 105.667 41.817 1.00 0.00 H ATOM 23086 C114 PA 601 141.227 105.361 42.547 1.00 0.00 C ATOM 23087 H14R PA 601 142.011 104.844 41.989 1.00 0.00 H ATOM 23088 H14S PA 601 140.825 104.676 43.295 1.00 0.00 H ATOM 23089 C113 PA 601 141.685 106.797 43.048 1.00 0.00 C ATOM 23090 H13R PA 601 140.797 107.411 43.210 1.00 0.00 H ATOM 23091 H13S PA 601 142.039 107.266 42.127 1.00 0.00 H ATOM 23092 C112 PA 601 142.719 107.060 44.109 1.00 0.00 C ATOM 23093 H12R PA 601 143.029 108.104 44.186 1.00 0.00 H ATOM 23094 H12S PA 601 143.628 106.533 43.812 1.00 0.00 H ATOM 23095 C111 PA 601 142.436 106.533 45.464 1.00 0.00 C ATOM 23096 H11R PA 601 143.270 107.062 45.929 1.00 0.00 H ATOM 23097 H11S PA 601 142.601 105.458 45.369 1.00 0.00 H ATOM 23098 C110 PA 601 141.156 106.900 45.966 1.00 0.00 C ATOM 23099 H10R PA 601 140.400 106.141 45.752 1.00 0.00 H ATOM 23100 H10S PA 601 140.685 107.789 45.541 1.00 0.00 H ATOM 23101 C19 PA 601 141.129 107.159 47.488 1.00 0.00 C ATOM 23102 H9R PA 601 140.227 107.722 47.740 1.00 0.00 H ATOM 23103 H9S PA 601 141.912 107.744 47.974 1.00 0.00 H ATOM 23104 C18 PA 601 140.893 105.792 48.139 1.00 0.00 C ATOM 23105 H8R PA 601 141.590 105.058 47.730 1.00 0.00 H ATOM 23106 H8S PA 601 139.950 105.376 47.778 1.00 0.00 H ATOM 23107 C17 PA 601 141.035 106.013 49.670 1.00 0.00 C ATOM 23108 H7R PA 601 140.453 106.871 50.013 1.00 0.00 H ATOM 23109 H7S PA 601 142.031 106.342 49.974 1.00 0.00 H ATOM 23110 C16 PA 601 140.534 104.761 50.406 1.00 0.00 C ATOM 23111 H6R PA 601 141.241 103.934 50.319 1.00 0.00 H ATOM 23112 H6S PA 601 139.597 104.426 49.958 1.00 0.00 H ATOM 23113 C15 PA 601 140.293 105.052 51.895 1.00 0.00 C ATOM 23114 H5R PA 601 139.505 105.800 52.002 1.00 0.00 H ATOM 23115 H5S PA 601 141.184 105.590 52.226 1.00 0.00 H ATOM 23116 C14 PA 601 140.076 103.916 52.907 1.00 0.00 C ATOM 23117 H4R PA 601 140.984 103.311 52.885 1.00 0.00 H ATOM 23118 H4S PA 601 139.305 103.356 52.374 1.00 0.00 H ATOM 23119 C13 PA 601 139.687 104.297 54.272 1.00 0.00 C ATOM 23120 H3R PA 601 140.544 104.867 54.638 1.00 0.00 H ATOM 23121 H3S PA 601 139.815 103.370 54.833 1.00 0.00 H ATOM 23122 C12 PA 601 138.456 105.084 54.518 1.00 0.00 C ATOM 23123 H2R PA 601 137.560 104.509 54.277 1.00 0.00 H ATOM 23124 H2S PA 601 138.483 105.919 53.814 1.00 0.00 H ATOM 23125 C11 PGR 602 138.347 105.552 55.921 1.00 0.00 C ATOM 23126 O12 PGR 602 139.267 105.582 56.708 1.00 0.00 O ATOM 23127 O11 PGR 602 137.053 105.929 56.293 1.00 0.00 O ATOM 23128 C1 PGR 602 136.682 105.880 57.712 1.00 0.00 C ATOM 23129 HR PGR 602 135.809 106.473 57.995 1.00 0.00 H ATOM 23130 HS PGR 602 137.564 106.248 58.242 1.00 0.00 H ATOM 23131 C2 PGR 602 136.318 104.459 57.992 1.00 0.00 C ATOM 23132 HX PGR 602 135.681 104.440 58.879 1.00 0.00 H ATOM 23133 C3 PGR 602 137.525 103.563 58.388 1.00 0.00 C ATOM 23134 HA PGR 602 138.365 104.164 58.746 1.00 0.00 H ATOM 23135 HB PGR 602 137.798 102.957 57.520 1.00 0.00 H ATOM 23136 O31 PGR 602 137.136 102.637 59.409 1.00 0.00 O ATOM 23137 P31 PGR 602 137.006 103.038 60.956 1.00 0.00 P ATOM 23138 O32 PGR 602 138.517 103.163 61.355 1.00 0.00 O ATOM 23139 C31 PGR 602 139.359 101.995 61.395 1.00 0.00 C ATOM 23140 H1A PGR 602 139.171 101.464 60.458 1.00 0.00 H ATOM 23141 H1B PGR 602 139.123 101.385 62.270 1.00 0.00 H ATOM 23142 C32 PGR 602 140.867 102.559 61.421 1.00 0.00 C ATOM 23143 H2A PGR 602 141.154 103.225 62.239 1.00 0.00 H ATOM 23144 O35 PGR 602 141.015 103.305 60.242 1.00 0.00 O ATOM 23145 HO5A PGR 602 140.202 103.808 60.426 1.00 0.00 H ATOM 23146 C33 PGR 602 141.746 101.368 61.468 1.00 0.00 C ATOM 23147 H3A PGR 602 141.606 100.857 62.424 1.00 0.00 H ATOM 23148 H3B PGR 602 141.528 100.615 60.707 1.00 0.00 H ATOM 23149 O33 PGR 602 136.294 104.362 61.096 1.00 0.00 O ATOM 23150 O34 PGR 602 136.367 101.930 61.643 1.00 0.00 O ATOM 23151 O21 PGR 602 135.717 103.730 56.855 1.00 0.00 O ATOM 23152 C21 PGR 602 134.471 103.944 56.717 1.00 0.00 C ATOM 23153 O22 PGR 602 133.943 104.825 57.280 1.00 0.00 O ATOM 23154 O36 PGR 602 143.119 101.756 61.420 1.00 0.00 O ATOM 23155 HO6A PGR 602 143.545 101.087 60.855 1.00 0.00 H ATOM 23156 C12 OL 603 133.809 102.952 55.748 1.00 0.00 C ATOM 23157 H2R OL 603 134.149 103.245 54.752 1.00 0.00 H ATOM 23158 H2S OL 603 134.026 101.920 56.029 1.00 0.00 H ATOM 23159 C13 OL 603 132.278 103.022 55.838 1.00 0.00 C ATOM 23160 H3R OL 603 132.070 102.986 56.909 1.00 0.00 H ATOM 23161 H3S OL 603 131.856 104.009 55.634 1.00 0.00 H ATOM 23162 C14 OL 603 131.560 101.938 55.081 1.00 0.00 C ATOM 23163 H4R OL 603 131.978 100.972 55.374 1.00 0.00 H ATOM 23164 H4S OL 603 130.547 101.903 55.488 1.00 0.00 H ATOM 23165 C15 OL 603 131.722 102.099 53.603 1.00 0.00 C ATOM 23166 H5R OL 603 131.604 103.139 53.289 1.00 0.00 H ATOM 23167 H5S OL 603 132.740 101.894 53.263 1.00 0.00 H ATOM 23168 C16 OL 603 130.699 101.210 52.893 1.00 0.00 C ATOM 23169 H6R OL 603 131.017 100.174 53.030 1.00 0.00 H ATOM 23170 H6S OL 603 129.690 101.320 53.296 1.00 0.00 H ATOM 23171 C17 OL 603 130.466 101.329 51.417 1.00 0.00 C ATOM 23172 H7R OL 603 131.237 100.883 50.786 1.00 0.00 H ATOM 23173 H7S OL 603 129.597 100.705 51.197 1.00 0.00 H ATOM 23174 C18 OL 603 130.099 102.770 50.930 1.00 0.00 C ATOM 23175 H8R OL 603 130.742 103.513 51.407 1.00 0.00 H ATOM 23176 H8S OL 603 130.290 102.917 49.865 1.00 0.00 H ATOM 23177 C19 OL 603 128.649 103.083 51.368 1.00 0.00 C ATOM 23178 H9R OL 603 128.474 103.556 52.331 1.00 0.00 H ATOM 23179 C110 OL 603 127.566 102.740 50.657 1.00 0.00 C ATOM 23180 H10R OL 603 126.576 102.989 51.029 1.00 0.00 H ATOM 23181 C111 OL 603 127.605 102.034 49.316 1.00 0.00 C ATOM 23182 H11R OL 603 128.614 102.192 48.932 1.00 0.00 H ATOM 23183 H11S OL 603 127.621 100.948 49.430 1.00 0.00 H ATOM 23184 C112 OL 603 126.540 102.467 48.297 1.00 0.00 C ATOM 23185 H12R OL 603 125.580 102.088 48.653 1.00 0.00 H ATOM 23186 H12S OL 603 126.420 103.550 48.364 1.00 0.00 H ATOM 23187 C113 OL 603 126.821 102.181 46.840 1.00 0.00 C ATOM 23188 H13R OL 603 127.839 102.448 46.549 1.00 0.00 H ATOM 23189 H13S OL 603 126.898 101.103 46.683 1.00 0.00 H ATOM 23190 C114 OL 603 125.759 102.740 45.903 1.00 0.00 C ATOM 23191 H14R OL 603 124.846 102.145 45.839 1.00 0.00 H ATOM 23192 H14S OL 603 125.423 103.711 46.274 1.00 0.00 H ATOM 23193 C115 OL 603 126.282 103.035 44.516 1.00 0.00 C ATOM 23194 H15R OL 603 127.178 103.651 44.621 1.00 0.00 H ATOM 23195 H15S OL 603 126.574 102.077 44.081 1.00 0.00 H ATOM 23196 C116 OL 603 125.181 103.711 43.643 1.00 0.00 C ATOM 23197 H16R OL 603 124.216 103.201 43.607 1.00 0.00 H ATOM 23198 H16S OL 603 125.056 104.651 44.184 1.00 0.00 H ATOM 23199 C117 OL 603 125.703 103.744 42.228 1.00 0.00 C ATOM 23200 H17R OL 603 125.065 104.408 41.640 1.00 0.00 H ATOM 23201 H17S OL 603 126.674 104.236 42.308 1.00 0.00 H ATOM 23202 C118 OL 603 125.922 102.430 41.563 1.00 0.00 C ATOM 23203 H18R OL 603 125.112 101.701 41.635 1.00 0.00 H ATOM 23204 H18S OL 603 126.903 101.970 41.696 1.00 0.00 H ATOM 23205 H18T OL 603 125.978 102.623 40.490 1.00 0.00 H TER 23206 OL 603 ATOM 23206 C116 PA 604 55.997 127.267 33.110 1.00 0.00 C ATOM 23207 H16R PA 604 56.115 128.260 32.671 1.00 0.00 H ATOM 23208 H16S PA 604 54.905 127.271 33.123 1.00 0.00 H ATOM 23209 H16T PA 604 56.445 126.497 32.478 1.00 0.00 H ATOM 23210 C115 PA 604 56.553 127.432 34.571 1.00 0.00 C ATOM 23211 H15R PA 604 55.974 128.270 34.965 1.00 0.00 H ATOM 23212 H15S PA 604 57.528 127.897 34.412 1.00 0.00 H ATOM 23213 C114 PA 604 56.397 126.153 35.357 1.00 0.00 C ATOM 23214 H14R PA 604 56.530 126.523 36.376 1.00 0.00 H ATOM 23215 H14S PA 604 57.152 125.494 34.924 1.00 0.00 H ATOM 23216 C113 PA 604 55.058 125.480 35.253 1.00 0.00 C ATOM 23217 H13R PA 604 55.144 124.536 35.795 1.00 0.00 H ATOM 23218 H13S PA 604 54.883 125.076 34.253 1.00 0.00 H ATOM 23219 C112 PA 604 53.873 126.149 35.974 1.00 0.00 C ATOM 23220 H12R PA 604 53.612 126.858 35.186 1.00 0.00 H ATOM 23221 H12S PA 604 54.223 126.707 36.844 1.00 0.00 H ATOM 23222 C111 PA 604 52.684 125.154 36.135 1.00 0.00 C ATOM 23223 H11R PA 604 52.931 124.293 36.760 1.00 0.00 H ATOM 23224 H11S PA 604 52.366 124.685 35.201 1.00 0.00 H ATOM 23225 C110 PA 604 51.445 125.757 36.828 1.00 0.00 C ATOM 23226 H10R PA 604 50.628 125.174 36.398 1.00 0.00 H ATOM 23227 H10S PA 604 51.376 126.786 36.469 1.00 0.00 H ATOM 23228 C19 PA 604 51.640 125.714 38.358 1.00 0.00 C ATOM 23229 H9R PA 604 52.717 125.647 38.524 1.00 0.00 H ATOM 23230 H9S PA 604 51.127 124.842 38.771 1.00 0.00 H ATOM 23231 C18 PA 604 50.930 126.860 39.045 1.00 0.00 C ATOM 23232 H8R PA 604 49.870 126.655 39.205 1.00 0.00 H ATOM 23233 H8S PA 604 50.993 127.697 38.347 1.00 0.00 H ATOM 23234 C17 PA 604 51.630 127.353 40.399 1.00 0.00 C ATOM 23235 H7R PA 604 51.081 128.272 40.611 1.00 0.00 H ATOM 23236 H7S PA 604 52.683 127.602 40.253 1.00 0.00 H ATOM 23237 C16 PA 604 51.583 126.395 41.541 1.00 0.00 C ATOM 23238 H6R PA 604 52.165 125.478 41.429 1.00 0.00 H ATOM 23239 H6S PA 604 50.552 126.043 41.614 1.00 0.00 H ATOM 23240 C15 PA 604 51.889 126.973 42.923 1.00 0.00 C ATOM 23241 H5R PA 604 51.141 127.682 43.284 1.00 0.00 H ATOM 23242 H5S PA 604 52.822 127.537 42.978 1.00 0.00 H ATOM 23243 C14 PA 604 52.003 125.891 44.036 1.00 0.00 C ATOM 23244 H4R PA 604 53.003 125.452 44.068 1.00 0.00 H ATOM 23245 H4S PA 604 51.312 125.065 43.853 1.00 0.00 H ATOM 23246 C13 PA 604 51.768 126.376 45.478 1.00 0.00 C ATOM 23247 H3R PA 604 50.770 126.820 45.462 1.00 0.00 H ATOM 23248 H3S PA 604 52.502 127.135 45.756 1.00 0.00 H ATOM 23249 C12 PA 604 51.810 125.308 46.548 1.00 0.00 C ATOM 23250 H2R PA 604 52.670 124.689 46.279 1.00 0.00 H ATOM 23251 H2S PA 604 50.985 124.648 46.271 1.00 0.00 H ATOM 23252 C11 PC 605 51.720 125.748 47.957 1.00 0.00 C ATOM 23253 O12 PC 605 51.804 126.935 48.352 1.00 0.00 O ATOM 23254 O11 PC 605 51.508 124.709 48.734 1.00 0.00 O ATOM 23255 C1 PC 605 51.250 124.892 50.172 1.00 0.00 C ATOM 23256 HR PC 605 52.016 125.434 50.732 1.00 0.00 H ATOM 23257 HS PC 605 51.088 123.912 50.629 1.00 0.00 H ATOM 23258 C2 PC 605 49.939 125.693 50.368 1.00 0.00 C ATOM 23259 HX PC 605 49.884 126.566 49.712 1.00 0.00 H ATOM 23260 C3 PC 605 49.599 126.147 51.813 1.00 0.00 C ATOM 23261 HA PC 605 48.522 126.264 51.960 1.00 0.00 H ATOM 23262 HB PC 605 49.973 127.155 52.010 1.00 0.00 H ATOM 23263 O31 PC 605 50.023 125.151 52.771 1.00 0.00 O ATOM 23264 P31 PC 605 49.730 125.373 54.313 1.00 0.00 P ATOM 23265 O32 PC 605 50.576 126.611 54.634 1.00 0.00 O ATOM 23266 C31 PC 605 51.962 126.552 54.713 1.00 0.00 C ATOM 23267 H1A PC 605 52.333 126.158 53.764 1.00 0.00 H ATOM 23268 H1B PC 605 52.375 125.858 55.450 1.00 0.00 H ATOM 23269 C32 PC 605 52.663 127.887 54.898 1.00 0.00 C ATOM 23270 H2A PC 605 52.572 128.481 53.987 1.00 0.00 H ATOM 23271 H2B PC 605 53.730 127.720 55.052 1.00 0.00 H ATOM 23272 N31 PC 605 52.187 128.798 56.035 1.00 0.00 N ATOM 23273 C33 PC 605 50.864 129.379 55.827 1.00 0.00 C ATOM 23274 H3A PC 605 50.814 129.697 54.785 1.00 0.00 H ATOM 23275 H3B PC 605 50.834 130.181 56.566 1.00 0.00 H ATOM 23276 H3C PC 605 50.173 128.576 56.089 1.00 0.00 H ATOM 23277 C34 PC 605 52.344 128.215 57.329 1.00 0.00 C ATOM 23278 H4A PC 605 53.193 127.531 57.283 1.00 0.00 H ATOM 23279 H4B PC 605 51.406 127.790 57.687 1.00 0.00 H ATOM 23280 H4C PC 605 52.574 128.999 58.053 1.00 0.00 H ATOM 23281 C35 PC 605 53.098 129.989 56.067 1.00 0.00 C ATOM 23282 H5A PC 605 52.975 130.624 55.189 1.00 0.00 H ATOM 23283 H5B PC 605 54.106 129.573 56.063 1.00 0.00 H ATOM 23284 H5C PC 605 52.993 130.495 57.028 1.00 0.00 H ATOM 23285 O33 PC 605 48.333 125.800 54.498 1.00 0.00 O ATOM 23286 O34 PC 605 50.221 124.140 55.072 1.00 0.00 O ATOM 23287 O21 PC 605 48.880 124.774 50.021 1.00 0.00 O ATOM 23288 C21 PC 605 48.422 124.694 48.797 1.00 0.00 C ATOM 23289 O22 PC 605 48.847 125.413 47.914 1.00 0.00 O ATOM 23290 C12 OL 606 47.313 123.604 48.654 1.00 0.00 C ATOM 23291 H2R OL 606 47.411 123.223 47.635 1.00 0.00 H ATOM 23292 H2S OL 606 47.398 122.735 49.309 1.00 0.00 H ATOM 23293 C13 OL 606 45.895 124.291 48.732 1.00 0.00 C ATOM 23294 H3R OL 606 45.781 124.865 49.653 1.00 0.00 H ATOM 23295 H3S OL 606 45.813 125.011 47.915 1.00 0.00 H ATOM 23296 C14 OL 606 44.781 123.303 48.625 1.00 0.00 C ATOM 23297 H4R OL 606 45.024 122.843 47.665 1.00 0.00 H ATOM 23298 H4S OL 606 45.096 122.523 49.322 1.00 0.00 H ATOM 23299 C15 OL 606 43.338 123.964 48.689 1.00 0.00 C ATOM 23300 H5R OL 606 43.255 124.712 49.481 1.00 0.00 H ATOM 23301 H5S OL 606 43.237 124.663 47.856 1.00 0.00 H ATOM 23302 C16 OL 606 42.108 123.053 48.679 1.00 0.00 C ATOM 23303 H6R OL 606 42.089 122.381 49.539 1.00 0.00 H ATOM 23304 H6S OL 606 41.217 123.658 48.854 1.00 0.00 H ATOM 23305 C17 OL 606 42.076 122.017 47.580 1.00 0.00 C ATOM 23306 H7R OL 606 42.914 121.318 47.619 1.00 0.00 H ATOM 23307 H7S OL 606 41.121 121.488 47.560 1.00 0.00 H ATOM 23308 C18 OL 606 42.074 122.644 46.288 1.00 0.00 C ATOM 23309 H8R OL 606 41.198 123.292 46.361 1.00 0.00 H ATOM 23310 H8S OL 606 42.903 123.326 46.087 1.00 0.00 H ATOM 23311 C19 OL 606 42.012 121.775 45.071 1.00 0.00 C ATOM 23312 H9R OL 606 41.001 121.520 44.761 1.00 0.00 H ATOM 23313 C110 OL 606 43.038 121.241 44.297 1.00 0.00 C ATOM 23314 H10R OL 606 42.660 120.699 43.433 1.00 0.00 H ATOM 23315 C111 OL 606 44.454 121.577 44.397 1.00 0.00 C ATOM 23316 H11R OL 606 44.655 122.262 45.223 1.00 0.00 H ATOM 23317 H11S OL 606 45.067 120.694 44.591 1.00 0.00 H ATOM 23318 C112 OL 606 44.923 122.124 43.088 1.00 0.00 C ATOM 23319 H12R OL 606 44.765 121.411 42.276 1.00 0.00 H ATOM 23320 H12S OL 606 44.336 123.000 42.806 1.00 0.00 H ATOM 23321 C113 OL 606 46.469 122.492 42.820 1.00 0.00 C ATOM 23322 H13R OL 606 47.115 121.629 42.644 1.00 0.00 H ATOM 23323 H13S OL 606 46.661 123.118 41.946 1.00 0.00 H ATOM 23324 C114 OL 606 46.994 123.170 44.090 1.00 0.00 C ATOM 23325 H14R OL 606 46.753 122.572 44.971 1.00 0.00 H ATOM 23326 H14S OL 606 48.081 123.074 44.038 1.00 0.00 H ATOM 23327 C115 OL 606 46.622 124.642 44.214 1.00 0.00 C ATOM 23328 H15R OL 606 45.566 124.815 43.993 1.00 0.00 H ATOM 23329 H15S OL 606 46.863 124.964 45.230 1.00 0.00 H ATOM 23330 C116 OL 606 47.360 125.515 43.178 1.00 0.00 C ATOM 23331 H16R OL 606 48.419 125.276 43.062 1.00 0.00 H ATOM 23332 H16S OL 606 46.986 125.415 42.156 1.00 0.00 H ATOM 23333 C117 OL 606 47.156 126.999 43.608 1.00 0.00 C ATOM 23334 H17R OL 606 46.102 127.281 43.571 1.00 0.00 H ATOM 23335 H17S OL 606 47.466 127.132 44.646 1.00 0.00 H ATOM 23336 C118 OL 606 47.950 127.988 42.736 1.00 0.00 C ATOM 23337 H18R OL 606 47.557 128.960 43.043 1.00 0.00 H ATOM 23338 H18S OL 606 47.728 127.810 41.682 1.00 0.00 H ATOM 23339 H18T OL 606 49.035 127.906 42.829 1.00 0.00 H TER 23340 OL 606 ATOM 23340 C116 PA 607 116.980 57.205 43.214 1.00 0.00 C ATOM 23341 H16R PA 607 117.729 56.411 43.233 1.00 0.00 H ATOM 23342 H16S PA 607 116.203 56.776 42.579 1.00 0.00 H ATOM 23343 H16T PA 607 116.589 57.415 44.212 1.00 0.00 H ATOM 23344 C115 PA 607 117.577 58.459 42.569 1.00 0.00 C ATOM 23345 H15R PA 607 116.767 59.190 42.529 1.00 0.00 H ATOM 23346 H15S PA 607 117.977 58.386 41.555 1.00 0.00 H ATOM 23347 C114 PA 607 118.627 59.128 43.441 1.00 0.00 C ATOM 23348 H14R PA 607 119.476 58.459 43.595 1.00 0.00 H ATOM 23349 H14S PA 607 118.286 59.306 44.463 1.00 0.00 H ATOM 23350 C113 PA 607 119.099 60.419 42.813 1.00 0.00 C ATOM 23351 H13R PA 607 118.216 61.061 42.838 1.00 0.00 H ATOM 23352 H13S PA 607 119.400 60.151 41.798 1.00 0.00 H ATOM 23353 C112 PA 607 120.218 61.068 43.546 1.00 0.00 C ATOM 23354 H12R PA 607 119.936 61.433 44.536 1.00 0.00 H ATOM 23355 H12S PA 607 120.529 61.957 42.994 1.00 0.00 H ATOM 23356 C111 PA 607 121.491 60.150 43.683 1.00 0.00 C ATOM 23357 H11R PA 607 121.637 59.651 42.723 1.00 0.00 H ATOM 23358 H11S PA 607 121.392 59.330 44.397 1.00 0.00 H ATOM 23359 C110 PA 607 122.782 60.903 43.889 1.00 0.00 C ATOM 23360 H10R PA 607 122.830 61.671 43.114 1.00 0.00 H ATOM 23361 H10S PA 607 123.635 60.220 43.895 1.00 0.00 H ATOM 23362 C19 PA 607 122.864 61.681 45.206 1.00 0.00 C ATOM 23363 H9R PA 607 122.297 61.157 45.979 1.00 0.00 H ATOM 23364 H9S PA 607 122.167 62.510 45.068 1.00 0.00 H ATOM 23365 C18 PA 607 124.269 62.058 45.669 1.00 0.00 C ATOM 23366 H8R PA 607 124.759 62.661 44.901 1.00 0.00 H ATOM 23367 H8S PA 607 124.826 61.123 45.580 1.00 0.00 H ATOM 23368 C17 PA 607 124.402 62.582 47.113 1.00 0.00 C ATOM 23369 H7R PA 607 124.106 61.836 47.853 1.00 0.00 H ATOM 23370 H7S PA 607 123.666 63.376 47.253 1.00 0.00 H ATOM 23371 C16 PA 607 125.807 62.990 47.603 1.00 0.00 C ATOM 23372 H6R PA 607 125.725 63.474 48.578 1.00 0.00 H ATOM 23373 H6S PA 607 126.162 63.892 47.100 1.00 0.00 H ATOM 23374 C15 PA 607 126.928 61.920 47.702 1.00 0.00 C ATOM 23375 H5R PA 607 127.684 62.555 48.168 1.00 0.00 H ATOM 23376 H5S PA 607 127.157 61.818 46.639 1.00 0.00 H ATOM 23377 C14 PA 607 126.642 60.534 48.387 1.00 0.00 C ATOM 23378 H4R PA 607 127.060 59.759 47.741 1.00 0.00 H ATOM 23379 H4S PA 607 125.576 60.302 48.339 1.00 0.00 H ATOM 23380 C13 PA 607 127.044 60.454 49.862 1.00 0.00 C ATOM 23381 H3R PA 607 126.387 61.093 50.456 1.00 0.00 H ATOM 23382 H3S PA 607 128.056 60.851 49.963 1.00 0.00 H ATOM 23383 C12 PA 607 126.991 59.094 50.441 1.00 0.00 C ATOM 23384 H2R PA 607 127.661 58.397 49.935 1.00 0.00 H ATOM 23385 H2S PA 607 126.022 58.605 50.317 1.00 0.00 H ATOM 23386 C11 PC 608 127.364 58.927 51.964 1.00 0.00 C ATOM 23387 O12 PC 608 126.586 58.439 52.763 1.00 0.00 O ATOM 23388 O11 PC 608 128.599 59.399 52.231 1.00 0.00 O ATOM 23389 C1 PC 608 129.213 59.209 53.516 1.00 0.00 C ATOM 23390 HR PC 608 129.271 58.119 53.573 1.00 0.00 H ATOM 23391 HS PC 608 128.597 59.570 54.344 1.00 0.00 H ATOM 23392 C2 PC 608 130.670 59.869 53.476 1.00 0.00 C ATOM 23393 HX PC 608 131.312 59.201 52.895 1.00 0.00 H ATOM 23394 C3 PC 608 131.289 59.882 54.886 1.00 0.00 C ATOM 23395 HA PC 608 131.286 58.867 55.290 1.00 0.00 H ATOM 23396 HB PC 608 130.630 60.421 55.572 1.00 0.00 H ATOM 23397 O31 PC 608 132.612 60.227 54.809 1.00 0.00 O ATOM 23398 P31 PC 608 133.402 60.390 56.182 1.00 0.00 P ATOM 23399 O32 PC 608 132.884 61.744 56.783 1.00 0.00 O ATOM 23400 C31 PC 608 133.077 62.922 56.112 1.00 0.00 C ATOM 23401 H1A PC 608 132.653 62.779 55.114 1.00 0.00 H ATOM 23402 H1B PC 608 134.118 63.241 56.019 1.00 0.00 H ATOM 23403 C32 PC 608 132.211 63.887 56.920 1.00 0.00 C ATOM 23404 H2A PC 608 131.168 63.569 56.896 1.00 0.00 H ATOM 23405 H2B PC 608 132.464 64.858 56.492 1.00 0.00 H ATOM 23406 N31 PC 608 132.478 64.014 58.418 1.00 0.00 N ATOM 23407 C33 PC 608 132.005 62.893 59.240 1.00 0.00 C ATOM 23408 H3A PC 608 132.420 61.946 58.891 1.00 0.00 H ATOM 23409 H3B PC 608 130.923 62.844 59.107 1.00 0.00 H ATOM 23410 H3C PC 608 132.265 63.092 60.280 1.00 0.00 H ATOM 23411 C34 PC 608 133.943 64.179 58.665 1.00 0.00 C ATOM 23412 H4A PC 608 134.062 64.399 59.727 1.00 0.00 H ATOM 23413 H4B PC 608 134.417 64.910 58.009 1.00 0.00 H ATOM 23414 H4C PC 608 134.474 63.248 58.459 1.00 0.00 H ATOM 23415 C35 PC 608 132.029 65.300 58.963 1.00 0.00 C ATOM 23416 H5A PC 608 132.393 66.027 58.236 1.00 0.00 H ATOM 23417 H5B PC 608 132.505 65.416 59.938 1.00 0.00 H ATOM 23418 H5C PC 608 130.941 65.251 59.017 1.00 0.00 H ATOM 23419 O33 PC 608 133.023 59.297 57.064 1.00 0.00 O ATOM 23420 O34 PC 608 134.857 60.523 55.887 1.00 0.00 O ATOM 23421 O21 PC 608 130.706 61.187 52.831 1.00 0.00 O ATOM 23422 C21 PC 608 130.277 62.288 53.450 1.00 0.00 C ATOM 23423 O22 PC 608 129.623 62.290 54.469 1.00 0.00 O ATOM 23424 C12 OL 609 130.844 63.508 52.861 1.00 0.00 C ATOM 23425 H2R OL 609 131.410 64.080 53.599 1.00 0.00 H ATOM 23426 H2S OL 609 131.512 63.170 52.066 1.00 0.00 H ATOM 23427 C13 OL 609 129.725 64.317 52.305 1.00 0.00 C ATOM 23428 H3R OL 609 129.394 63.792 51.407 1.00 0.00 H ATOM 23429 H3S OL 609 128.830 64.288 52.931 1.00 0.00 H ATOM 23430 C14 OL 609 130.121 65.760 51.964 1.00 0.00 C ATOM 23431 H4R OL 609 130.576 66.258 52.823 1.00 0.00 H ATOM 23432 H4S OL 609 130.787 65.708 51.100 1.00 0.00 H ATOM 23433 C15 OL 609 128.980 66.613 51.550 1.00 0.00 C ATOM 23434 H5R OL 609 128.440 66.114 50.742 1.00 0.00 H ATOM 23435 H5S OL 609 128.237 66.597 52.350 1.00 0.00 H ATOM 23436 C16 OL 609 129.389 67.989 51.009 1.00 0.00 C ATOM 23437 H6R OL 609 128.448 68.524 50.861 1.00 0.00 H ATOM 23438 H6S OL 609 129.814 68.527 51.859 1.00 0.00 H ATOM 23439 C17 OL 609 130.300 67.992 49.782 1.00 0.00 C ATOM 23440 H7R OL 609 131.216 67.418 49.936 1.00 0.00 H ATOM 23441 H7S OL 609 129.696 67.584 48.969 1.00 0.00 H ATOM 23442 C18 OL 609 130.652 69.443 49.390 1.00 0.00 C ATOM 23443 H8R OL 609 129.771 70.050 49.610 1.00 0.00 H ATOM 23444 H8S OL 609 131.412 69.796 50.090 1.00 0.00 H ATOM 23445 C19 OL 609 130.968 69.720 47.964 1.00 0.00 C ATOM 23446 H9R OL 609 130.109 69.408 47.374 1.00 0.00 H ATOM 23447 C110 OL 609 132.132 70.267 47.560 1.00 0.00 C ATOM 23448 H10R OL 609 132.288 70.422 46.496 1.00 0.00 H ATOM 23449 C111 OL 609 133.264 70.757 48.386 1.00 0.00 C ATOM 23450 H11R OL 609 133.117 71.836 48.467 1.00 0.00 H ATOM 23451 H11S OL 609 133.288 70.308 49.381 1.00 0.00 H ATOM 23452 C112 OL 609 134.681 70.428 47.848 1.00 0.00 C ATOM 23453 H12R OL 609 134.881 70.867 46.868 1.00 0.00 H ATOM 23454 H12S OL 609 135.395 70.861 48.552 1.00 0.00 H ATOM 23455 C113 OL 609 135.200 68.943 47.869 1.00 0.00 C ATOM 23456 H13R OL 609 136.264 68.827 47.655 1.00 0.00 H ATOM 23457 H13S OL 609 135.017 68.683 48.913 1.00 0.00 H ATOM 23458 C114 OL 609 134.584 67.799 46.968 1.00 0.00 C ATOM 23459 H14R OL 609 135.195 66.936 47.241 1.00 0.00 H ATOM 23460 H14S OL 609 133.604 67.584 47.401 1.00 0.00 H ATOM 23461 C115 OL 609 134.643 68.054 45.512 1.00 0.00 C ATOM 23462 H15R OL 609 134.029 68.893 45.180 1.00 0.00 H ATOM 23463 H15S OL 609 135.635 68.203 45.082 1.00 0.00 H ATOM 23464 C116 OL 609 134.033 66.859 44.725 1.00 0.00 C ATOM 23465 H16R OL 609 133.006 66.729 45.075 1.00 0.00 H ATOM 23466 H16S OL 609 134.014 67.271 43.714 1.00 0.00 H ATOM 23467 C117 OL 609 134.813 65.550 44.960 1.00 0.00 C ATOM 23468 H17R OL 609 135.886 65.746 45.014 1.00 0.00 H ATOM 23469 H17S OL 609 134.519 65.354 45.994 1.00 0.00 H ATOM 23470 C118 OL 609 134.582 64.460 43.938 1.00 0.00 C ATOM 23471 H18R OL 609 134.960 64.747 42.955 1.00 0.00 H ATOM 23472 H18S OL 609 133.534 64.154 43.949 1.00 0.00 H ATOM 23473 H18T OL 609 135.089 63.532 44.213 1.00 0.00 H TER 23474 OL 609 ATOM 23474 C116 PA 610 50.836 17.904 37.141 1.00 0.00 C ATOM 23475 H16R PA 610 51.750 17.794 37.727 1.00 0.00 H ATOM 23476 H16S PA 610 51.212 18.386 36.236 1.00 0.00 H ATOM 23477 H16T PA 610 50.344 17.008 36.758 1.00 0.00 H ATOM 23478 C115 PA 610 49.776 18.683 37.910 1.00 0.00 C ATOM 23479 H15R PA 610 48.885 18.929 37.329 1.00 0.00 H ATOM 23480 H15S PA 610 50.220 19.609 38.282 1.00 0.00 H ATOM 23481 C114 PA 610 49.380 18.053 39.252 1.00 0.00 C ATOM 23482 H14R PA 610 50.238 17.544 39.696 1.00 0.00 H ATOM 23483 H14S PA 610 48.644 17.251 39.164 1.00 0.00 H ATOM 23484 C113 PA 610 48.720 19.079 40.102 1.00 0.00 C ATOM 23485 H13R PA 610 48.031 19.653 39.479 1.00 0.00 H ATOM 23486 H13S PA 610 49.514 19.814 40.250 1.00 0.00 H ATOM 23487 C112 PA 610 48.120 18.590 41.418 1.00 0.00 C ATOM 23488 H12R PA 610 48.873 18.096 42.036 1.00 0.00 H ATOM 23489 H12S PA 610 47.393 17.790 41.267 1.00 0.00 H ATOM 23490 C111 PA 610 47.441 19.660 42.196 1.00 0.00 C ATOM 23491 H11R PA 610 46.702 20.130 41.543 1.00 0.00 H ATOM 23492 H11S PA 610 48.217 20.360 42.513 1.00 0.00 H ATOM 23493 C110 PA 610 46.704 19.135 43.485 1.00 0.00 C ATOM 23494 H10R PA 610 47.391 18.509 44.059 1.00 0.00 H ATOM 23495 H10S PA 610 45.846 18.460 43.462 1.00 0.00 H ATOM 23496 C19 PA 610 46.310 20.331 44.340 1.00 0.00 C ATOM 23497 H9R PA 610 45.615 20.997 43.825 1.00 0.00 H ATOM 23498 H9S PA 610 47.280 20.829 44.404 1.00 0.00 H ATOM 23499 C18 PA 610 45.763 20.041 45.727 1.00 0.00 C ATOM 23500 H8R PA 610 46.437 19.310 46.178 1.00 0.00 H ATOM 23501 H8S PA 610 44.823 19.532 45.504 1.00 0.00 H ATOM 23502 C17 PA 610 45.533 21.283 46.565 1.00 0.00 C ATOM 23503 H7R PA 610 44.594 21.754 46.268 1.00 0.00 H ATOM 23504 H7S PA 610 46.222 22.099 46.337 1.00 0.00 H ATOM 23505 C16 PA 610 45.364 20.973 48.048 1.00 0.00 C ATOM 23506 H6R PA 610 44.618 20.176 48.009 1.00 0.00 H ATOM 23507 H6S PA 610 44.937 21.841 48.556 1.00 0.00 H ATOM 23508 C15 PA 610 46.595 20.782 48.778 1.00 0.00 C ATOM 23509 H5R PA 610 47.216 21.668 48.630 1.00 0.00 H ATOM 23510 H5S PA 610 47.079 19.985 48.211 1.00 0.00 H ATOM 23511 C14 PA 610 46.434 20.179 50.197 1.00 0.00 C ATOM 23512 H4R PA 610 45.851 19.256 50.164 1.00 0.00 H ATOM 23513 H4S PA 610 45.825 20.816 50.842 1.00 0.00 H ATOM 23514 C13 PA 610 47.758 19.991 51.024 1.00 0.00 C ATOM 23515 H3R PA 610 47.446 19.795 52.052 1.00 0.00 H ATOM 23516 H3S PA 610 48.272 20.942 51.177 1.00 0.00 H ATOM 23517 C12 PA 610 48.735 18.996 50.353 1.00 0.00 C ATOM 23518 H2R PA 610 48.923 19.480 49.392 1.00 0.00 H ATOM 23519 H2S PA 610 48.393 18.013 50.023 1.00 0.00 H ATOM 23520 C11 PGR 611 50.051 18.791 51.061 1.00 0.00 C ATOM 23521 O12 PGR 611 50.738 17.815 50.834 1.00 0.00 O ATOM 23522 O11 PGR 611 50.411 19.687 51.988 1.00 0.00 O ATOM 23523 C1 PGR 611 51.532 19.493 52.833 1.00 0.00 C ATOM 23524 HR PGR 611 52.486 19.396 52.309 1.00 0.00 H ATOM 23525 HS PGR 611 51.375 18.641 53.498 1.00 0.00 H ATOM 23526 C2 PGR 611 51.647 20.703 53.685 1.00 0.00 C ATOM 23527 HX PGR 611 52.637 20.609 54.139 1.00 0.00 H ATOM 23528 C3 PGR 611 50.691 20.662 54.870 1.00 0.00 C ATOM 23529 HA PGR 611 50.001 19.816 54.813 1.00 0.00 H ATOM 23530 HB PGR 611 50.130 21.600 54.870 1.00 0.00 H ATOM 23531 O31 PGR 611 51.472 20.691 56.095 1.00 0.00 O ATOM 23532 P31 PGR 611 50.800 20.483 57.545 1.00 0.00 P ATOM 23533 O32 PGR 611 50.725 18.937 57.795 1.00 0.00 O ATOM 23534 C31 PGR 611 51.854 18.119 57.776 1.00 0.00 C ATOM 23535 H1A PGR 611 52.581 18.405 57.011 1.00 0.00 H ATOM 23536 H1B PGR 611 51.523 17.112 57.509 1.00 0.00 H ATOM 23537 C32 PGR 611 52.494 18.018 59.231 1.00 0.00 C ATOM 23538 H2A PGR 611 51.618 17.969 59.884 1.00 0.00 H ATOM 23539 O35 PGR 611 53.349 19.136 59.453 1.00 0.00 O ATOM 23540 HO5A PGR 611 52.794 19.927 59.339 1.00 0.00 H ATOM 23541 C33 PGR 611 53.282 16.708 59.469 1.00 0.00 C ATOM 23542 H3A PGR 611 53.709 16.723 60.475 1.00 0.00 H ATOM 23543 H3B PGR 611 52.618 15.854 59.309 1.00 0.00 H ATOM 23544 O33 PGR 611 51.750 20.953 58.611 1.00 0.00 O ATOM 23545 O34 PGR 611 49.412 20.983 57.510 1.00 0.00 O ATOM 23546 O21 PGR 611 51.523 21.928 52.926 1.00 0.00 O ATOM 23547 C21 PGR 611 52.611 22.306 52.147 1.00 0.00 C ATOM 23548 O22 PGR 611 53.641 21.668 51.999 1.00 0.00 O ATOM 23549 O36 PGR 611 54.362 16.710 58.520 1.00 0.00 O ATOM 23550 HO6A PGR 611 55.170 16.259 58.823 1.00 0.00 H ATOM 23551 C12 OL 612 52.328 23.619 51.385 1.00 0.00 C ATOM 23552 H2R OL 612 52.142 24.411 52.113 1.00 0.00 H ATOM 23553 H2S OL 612 53.212 23.976 50.853 1.00 0.00 H ATOM 23554 C13 OL 612 51.181 23.615 50.345 1.00 0.00 C ATOM 23555 H3R OL 612 51.185 24.456 49.649 1.00 0.00 H ATOM 23556 H3S OL 612 51.158 22.719 49.721 1.00 0.00 H ATOM 23557 C14 OL 612 49.747 23.673 50.968 1.00 0.00 C ATOM 23558 H4R OL 612 49.549 22.747 51.512 1.00 0.00 H ATOM 23559 H4S OL 612 49.719 24.465 51.720 1.00 0.00 H ATOM 23560 C15 OL 612 48.594 23.849 49.970 1.00 0.00 C ATOM 23561 H5R OL 612 48.502 22.872 49.491 1.00 0.00 H ATOM 23562 H5S OL 612 47.696 24.083 50.546 1.00 0.00 H ATOM 23563 C16 OL 612 48.853 24.857 48.869 1.00 0.00 C ATOM 23564 H6R OL 612 49.415 25.675 49.323 1.00 0.00 H ATOM 23565 H6S OL 612 49.529 24.443 48.118 1.00 0.00 H ATOM 23566 C17 OL 612 47.647 25.384 48.001 1.00 0.00 C ATOM 23567 H7R OL 612 47.070 24.577 47.545 1.00 0.00 H ATOM 23568 H7S OL 612 46.856 25.889 48.560 1.00 0.00 H ATOM 23569 C18 OL 612 48.064 26.122 46.694 1.00 0.00 C ATOM 23570 H8R OL 612 48.605 27.056 46.862 1.00 0.00 H ATOM 23571 H8S OL 612 48.850 25.521 46.233 1.00 0.00 H ATOM 23572 C19 OL 612 47.033 26.294 45.604 1.00 0.00 C ATOM 23573 H9R OL 612 46.595 25.358 45.267 1.00 0.00 H ATOM 23574 C110 OL 612 46.488 27.423 45.337 1.00 0.00 C ATOM 23575 H10R OL 612 45.601 27.383 44.711 1.00 0.00 H ATOM 23576 C111 OL 612 46.853 28.859 45.770 1.00 0.00 C ATOM 23577 H11R OL 612 45.887 29.306 46.016 1.00 0.00 H ATOM 23578 H11S OL 612 47.489 28.916 46.656 1.00 0.00 H ATOM 23579 C112 OL 612 47.520 29.731 44.679 1.00 0.00 C ATOM 23580 H12R OL 612 48.471 29.294 44.369 1.00 0.00 H ATOM 23581 H12S OL 612 46.955 29.888 43.758 1.00 0.00 H ATOM 23582 C113 OL 612 47.889 31.144 45.083 1.00 0.00 C ATOM 23583 H13R OL 612 48.826 31.205 45.640 1.00 0.00 H ATOM 23584 H13S OL 612 48.190 31.620 44.147 1.00 0.00 H ATOM 23585 C114 OL 612 46.647 31.913 45.605 1.00 0.00 C ATOM 23586 H14R OL 612 45.925 32.059 44.799 1.00 0.00 H ATOM 23587 H14S OL 612 46.183 31.307 46.386 1.00 0.00 H ATOM 23588 C115 OL 612 46.909 33.310 46.187 1.00 0.00 C ATOM 23589 H15R OL 612 47.407 33.269 47.158 1.00 0.00 H ATOM 23590 H15S OL 612 47.447 33.912 45.452 1.00 0.00 H ATOM 23591 C116 OL 612 45.670 34.009 46.566 1.00 0.00 C ATOM 23592 H16R OL 612 44.944 33.974 45.751 1.00 0.00 H ATOM 23593 H16S OL 612 45.161 33.458 47.358 1.00 0.00 H ATOM 23594 C117 OL 612 46.000 35.447 46.987 1.00 0.00 C ATOM 23595 H17R OL 612 46.606 35.459 47.895 1.00 0.00 H ATOM 23596 H17S OL 612 46.498 36.025 46.205 1.00 0.00 H ATOM 23597 C118 OL 612 44.771 36.171 47.363 1.00 0.00 C ATOM 23598 H18R OL 612 44.116 36.130 46.490 1.00 0.00 H ATOM 23599 H18S OL 612 44.969 37.211 47.630 1.00 0.00 H ATOM 23600 H18T OL 612 44.272 35.694 48.209 1.00 0.00 H TER 23601 OL 612 ATOM 23601 C116 PA 613 123.533 30.485 38.145 1.00 0.00 C ATOM 23602 H16R PA 613 122.624 29.879 38.147 1.00 0.00 H ATOM 23603 H16S PA 613 124.194 30.126 37.353 1.00 0.00 H ATOM 23604 H16T PA 613 123.198 31.508 37.963 1.00 0.00 H ATOM 23605 C115 PA 613 124.083 30.398 39.639 1.00 0.00 C ATOM 23606 H15R PA 613 124.910 31.095 39.788 1.00 0.00 H ATOM 23607 H15S PA 613 124.488 29.403 39.836 1.00 0.00 H ATOM 23608 C114 PA 613 123.014 30.615 40.736 1.00 0.00 C ATOM 23609 H14R PA 613 122.144 30.003 40.489 1.00 0.00 H ATOM 23610 H14S PA 613 122.712 31.657 40.610 1.00 0.00 H ATOM 23611 C113 PA 613 123.590 30.381 42.149 1.00 0.00 C ATOM 23612 H13R PA 613 124.609 30.773 42.147 1.00 0.00 H ATOM 23613 H13S PA 613 123.701 29.333 42.433 1.00 0.00 H ATOM 23614 C112 PA 613 122.708 31.073 43.210 1.00 0.00 C ATOM 23615 H12R PA 613 121.689 31.142 42.824 1.00 0.00 H ATOM 23616 H12S PA 613 122.915 32.109 43.486 1.00 0.00 H ATOM 23617 C111 PA 613 122.428 30.264 44.578 1.00 0.00 C ATOM 23618 H11R PA 613 121.607 30.825 45.030 1.00 0.00 H ATOM 23619 H11S PA 613 123.267 30.285 45.277 1.00 0.00 H ATOM 23620 C110 PA 613 122.005 28.753 44.545 1.00 0.00 C ATOM 23621 H10R PA 613 122.990 28.281 44.549 1.00 0.00 H ATOM 23622 H10S PA 613 121.595 28.504 43.565 1.00 0.00 H ATOM 23623 C19 PA 613 121.192 28.177 45.661 1.00 0.00 C ATOM 23624 H9R PA 613 120.115 28.359 45.636 1.00 0.00 H ATOM 23625 H9S PA 613 121.403 28.719 46.585 1.00 0.00 H ATOM 23626 C18 PA 613 121.348 26.638 45.675 1.00 0.00 C ATOM 23627 H8R PA 613 122.335 26.253 45.410 1.00 0.00 H ATOM 23628 H8S PA 613 120.757 26.201 44.867 1.00 0.00 H ATOM 23629 C17 PA 613 121.015 26.061 47.106 1.00 0.00 C ATOM 23630 H7R PA 613 119.957 25.894 47.317 1.00 0.00 H ATOM 23631 H7S PA 613 121.420 26.763 47.838 1.00 0.00 H ATOM 23632 C16 PA 613 121.539 24.633 47.356 1.00 0.00 C ATOM 23633 H6R PA 613 122.523 24.653 46.882 1.00 0.00 H ATOM 23634 H6S PA 613 121.059 23.918 46.684 1.00 0.00 H ATOM 23635 C15 PA 613 121.703 24.237 48.821 1.00 0.00 C ATOM 23636 H5R PA 613 122.215 25.035 49.363 1.00 0.00 H ATOM 23637 H5S PA 613 122.420 23.421 48.929 1.00 0.00 H ATOM 23638 C14 PA 613 120.435 23.893 49.505 1.00 0.00 C ATOM 23639 H4R PA 613 119.881 23.285 48.786 1.00 0.00 H ATOM 23640 H4S PA 613 119.866 24.817 49.630 1.00 0.00 H ATOM 23641 C13 PA 613 120.673 23.285 50.878 1.00 0.00 C ATOM 23642 H3R PA 613 120.817 24.095 51.596 1.00 0.00 H ATOM 23643 H3S PA 613 121.598 22.705 50.875 1.00 0.00 H ATOM 23644 C12 PA 613 119.640 22.307 51.381 1.00 0.00 C ATOM 23645 H2R PA 613 119.457 21.456 50.722 1.00 0.00 H ATOM 23646 H2S PA 613 118.713 22.878 51.300 1.00 0.00 H ATOM 23647 C11 PC 614 119.886 21.833 52.796 1.00 0.00 C ATOM 23648 O12 PC 614 119.551 22.494 53.764 1.00 0.00 O ATOM 23649 O11 PC 614 120.500 20.645 52.923 1.00 0.00 O ATOM 23650 C1 PC 614 120.881 20.150 54.287 1.00 0.00 C ATOM 23651 HR PC 614 120.011 19.747 54.812 1.00 0.00 H ATOM 23652 HS PC 614 121.321 20.876 54.976 1.00 0.00 H ATOM 23653 C2 PC 614 121.869 18.989 54.067 1.00 0.00 C ATOM 23654 HX PC 614 121.306 18.160 53.630 1.00 0.00 H ATOM 23655 C3 PC 614 122.442 18.461 55.384 1.00 0.00 C ATOM 23656 HA PC 614 123.269 17.748 55.333 1.00 0.00 H ATOM 23657 HB PC 614 121.681 17.944 55.974 1.00 0.00 H ATOM 23658 O31 PC 614 122.996 19.577 56.079 1.00 0.00 O ATOM 23659 P31 PC 614 123.421 19.599 57.613 1.00 0.00 P ATOM 23660 O32 PC 614 122.257 20.492 58.196 1.00 0.00 O ATOM 23661 C31 PC 614 120.946 20.036 58.107 1.00 0.00 C ATOM 23662 H1A PC 614 120.921 18.953 58.251 1.00 0.00 H ATOM 23663 H1B PC 614 120.456 20.211 57.145 1.00 0.00 H ATOM 23664 C32 PC 614 120.125 20.690 59.177 1.00 0.00 C ATOM 23665 H2A PC 614 119.049 20.672 58.994 1.00 0.00 H ATOM 23666 H2B PC 614 120.598 21.672 59.220 1.00 0.00 H ATOM 23667 N31 PC 614 120.239 20.281 60.595 1.00 0.00 N ATOM 23668 C33 PC 614 119.420 19.020 60.826 1.00 0.00 C ATOM 23669 H3A PC 614 119.887 18.156 60.351 1.00 0.00 H ATOM 23670 H3B PC 614 118.381 19.120 60.507 1.00 0.00 H ATOM 23671 H3C PC 614 119.512 18.800 61.891 1.00 0.00 H ATOM 23672 C34 PC 614 121.649 20.134 61.024 1.00 0.00 C ATOM 23673 H4A PC 614 122.297 19.841 60.196 1.00 0.00 H ATOM 23674 H4B PC 614 121.618 19.492 61.906 1.00 0.00 H ATOM 23675 H4C PC 614 122.149 21.062 61.305 1.00 0.00 H ATOM 23676 C35 PC 614 119.692 21.265 61.622 1.00 0.00 C ATOM 23677 H5A PC 614 118.656 21.363 61.294 1.00 0.00 H ATOM 23678 H5B PC 614 120.218 22.215 61.518 1.00 0.00 H ATOM 23679 H5C PC 614 119.777 20.802 62.606 1.00 0.00 H ATOM 23680 O33 PC 614 123.255 18.211 58.136 1.00 0.00 O ATOM 23681 O34 PC 614 124.657 20.316 57.903 1.00 0.00 O ATOM 23682 O21 PC 614 122.920 19.328 53.125 1.00 0.00 O ATOM 23683 C21 PC 614 123.528 18.271 52.520 1.00 0.00 C ATOM 23684 O22 PC 614 123.131 17.159 52.565 1.00 0.00 O ATOM 23685 C12 OL 615 124.574 18.722 51.517 1.00 0.00 C ATOM 23686 H2R OL 615 125.186 19.518 51.946 1.00 0.00 H ATOM 23687 H2S OL 615 125.255 17.908 51.262 1.00 0.00 H ATOM 23688 C13 OL 615 124.022 19.191 50.147 1.00 0.00 C ATOM 23689 H3R OL 615 123.540 20.171 50.149 1.00 0.00 H ATOM 23690 H3S OL 615 124.952 19.351 49.598 1.00 0.00 H ATOM 23691 C14 OL 615 123.056 18.191 49.553 1.00 0.00 C ATOM 23692 H4R OL 615 123.552 17.228 49.417 1.00 0.00 H ATOM 23693 H4S OL 615 122.235 18.028 50.255 1.00 0.00 H ATOM 23694 C15 OL 615 122.683 18.640 48.196 1.00 0.00 C ATOM 23695 H5R OL 615 122.289 19.652 48.318 1.00 0.00 H ATOM 23696 H5S OL 615 123.548 18.758 47.540 1.00 0.00 H ATOM 23697 C16 OL 615 121.656 17.724 47.475 1.00 0.00 C ATOM 23698 H6R OL 615 122.237 16.800 47.484 1.00 0.00 H ATOM 23699 H6S OL 615 120.804 17.616 48.150 1.00 0.00 H ATOM 23700 C17 OL 615 121.224 18.251 46.108 1.00 0.00 C ATOM 23701 H7R OL 615 120.496 19.043 46.293 1.00 0.00 H ATOM 23702 H7S OL 615 122.075 18.608 45.526 1.00 0.00 H ATOM 23703 C18 OL 615 120.406 17.211 45.334 1.00 0.00 C ATOM 23704 H8R OL 615 119.720 16.680 45.997 1.00 0.00 H ATOM 23705 H8S OL 615 119.756 17.825 44.707 1.00 0.00 H ATOM 23706 C19 OL 615 121.270 16.226 44.602 1.00 0.00 C ATOM 23707 H9R OL 615 121.827 15.620 45.311 1.00 0.00 H ATOM 23708 C110 OL 615 121.514 16.134 43.285 1.00 0.00 C ATOM 23709 H10R OL 615 122.224 15.398 42.916 1.00 0.00 H ATOM 23710 C111 OL 615 121.044 17.041 42.229 1.00 0.00 C ATOM 23711 H11R OL 615 120.500 17.901 42.626 1.00 0.00 H ATOM 23712 H11S OL 615 121.861 17.618 41.791 1.00 0.00 H ATOM 23713 C112 OL 615 120.292 16.358 41.116 1.00 0.00 C ATOM 23714 H12R OL 615 119.314 15.959 41.393 1.00 0.00 H ATOM 23715 H12S OL 615 119.910 17.161 40.482 1.00 0.00 H ATOM 23716 C113 OL 615 121.056 15.247 40.404 1.00 0.00 C ATOM 23717 H13R OL 615 122.028 15.597 40.052 1.00 0.00 H ATOM 23718 H13S OL 615 121.414 14.488 41.104 1.00 0.00 H ATOM 23719 C114 OL 615 120.265 14.675 39.222 1.00 0.00 C ATOM 23720 H14R OL 615 120.808 13.835 38.782 1.00 0.00 H ATOM 23721 H14S OL 615 119.368 14.241 39.667 1.00 0.00 H ATOM 23722 C115 OL 615 119.749 15.751 38.325 1.00 0.00 C ATOM 23723 H15R OL 615 119.104 16.532 38.733 1.00 0.00 H ATOM 23724 H15S OL 615 120.636 16.316 38.032 1.00 0.00 H ATOM 23725 C116 OL 615 119.238 15.249 37.021 1.00 0.00 C ATOM 23726 H16R OL 615 119.763 14.304 36.867 1.00 0.00 H ATOM 23727 H16S OL 615 118.203 14.903 37.058 1.00 0.00 H ATOM 23728 C117 OL 615 119.717 16.036 35.725 1.00 0.00 C ATOM 23729 H17R OL 615 119.214 17.004 35.670 1.00 0.00 H ATOM 23730 H17S OL 615 120.779 16.283 35.789 1.00 0.00 H ATOM 23731 C118 OL 615 119.364 15.353 34.383 1.00 0.00 C ATOM 23732 H18R OL 615 119.538 16.101 33.607 1.00 0.00 H ATOM 23733 H18S OL 615 118.366 14.919 34.288 1.00 0.00 H ATOM 23734 H18T OL 615 120.129 14.633 34.084 1.00 0.00 H TER 23735 OL 615 ATOM 23735 C116 PA 616 61.691 6.343 36.710 1.00 0.00 C ATOM 23736 H16R PA 616 61.226 5.545 37.293 1.00 0.00 H ATOM 23737 H16S PA 616 62.565 5.944 36.191 1.00 0.00 H ATOM 23738 H16T PA 616 60.896 6.648 36.026 1.00 0.00 H ATOM 23739 C115 PA 616 62.044 7.473 37.734 1.00 0.00 C ATOM 23740 H15R PA 616 61.167 7.521 38.383 1.00 0.00 H ATOM 23741 H15S PA 616 62.196 8.453 37.277 1.00 0.00 H ATOM 23742 C114 PA 616 63.166 7.106 38.690 1.00 0.00 C ATOM 23743 H14R PA 616 62.768 6.271 39.271 1.00 0.00 H ATOM 23744 H14S PA 616 63.202 7.883 39.456 1.00 0.00 H ATOM 23745 C113 PA 616 64.568 6.977 38.129 1.00 0.00 C ATOM 23746 H13R PA 616 64.913 7.986 37.890 1.00 0.00 H ATOM 23747 H13S PA 616 64.552 6.282 37.287 1.00 0.00 H ATOM 23748 C112 PA 616 65.484 6.232 39.113 1.00 0.00 C ATOM 23749 H12R PA 616 66.143 5.655 38.461 1.00 0.00 H ATOM 23750 H12S PA 616 64.957 5.415 39.611 1.00 0.00 H ATOM 23751 C111 PA 616 66.287 7.069 40.163 1.00 0.00 C ATOM 23752 H11R PA 616 65.515 7.782 40.459 1.00 0.00 H ATOM 23753 H11S PA 616 67.156 7.604 39.775 1.00 0.00 H ATOM 23754 C110 PA 616 66.712 6.219 41.379 1.00 0.00 C ATOM 23755 H10R PA 616 67.487 5.492 41.123 1.00 0.00 H ATOM 23756 H10S PA 616 65.833 5.633 41.655 1.00 0.00 H ATOM 23757 C19 PA 616 67.246 7.070 42.450 1.00 0.00 C ATOM 23758 H9R PA 616 66.391 7.537 42.943 1.00 0.00 H ATOM 23759 H9S PA 616 67.966 7.846 42.182 1.00 0.00 H ATOM 23760 C18 PA 616 68.073 6.257 43.475 1.00 0.00 C ATOM 23761 H8R PA 616 69.041 5.929 43.088 1.00 0.00 H ATOM 23762 H8S PA 616 67.598 5.275 43.538 1.00 0.00 H ATOM 23763 C17 PA 616 68.038 6.715 44.918 1.00 0.00 C ATOM 23764 H7R PA 616 66.988 6.635 45.209 1.00 0.00 H ATOM 23765 H7S PA 616 68.457 7.711 45.072 1.00 0.00 H ATOM 23766 C16 PA 616 68.887 5.807 45.825 1.00 0.00 C ATOM 23767 H6R PA 616 69.913 6.174 45.756 1.00 0.00 H ATOM 23768 H6S PA 616 68.982 4.748 45.575 1.00 0.00 H ATOM 23769 C15 PA 616 68.590 6.071 47.247 1.00 0.00 C ATOM 23770 H5R PA 616 68.164 7.055 47.452 1.00 0.00 H ATOM 23771 H5S PA 616 69.556 5.967 47.745 1.00 0.00 H ATOM 23772 C14 PA 616 67.622 5.081 47.888 1.00 0.00 C ATOM 23773 H4R PA 616 67.720 4.016 47.666 1.00 0.00 H ATOM 23774 H4S PA 616 66.601 5.249 47.539 1.00 0.00 H ATOM 23775 C13 PA 616 67.594 5.192 49.363 1.00 0.00 C ATOM 23776 H3R PA 616 67.674 6.250 49.619 1.00 0.00 H ATOM 23777 H3S PA 616 68.524 4.690 49.636 1.00 0.00 H ATOM 23778 C12 PA 616 66.490 4.399 50.052 1.00 0.00 C ATOM 23779 H2R PA 616 66.635 3.343 49.815 1.00 0.00 H ATOM 23780 H2S PA 616 65.503 4.695 49.689 1.00 0.00 H ATOM 23781 C11 PGR 617 66.496 4.472 51.540 1.00 0.00 C ATOM 23782 O12 PGR 617 65.509 4.358 52.236 1.00 0.00 O ATOM 23783 O11 PGR 617 67.724 4.440 52.036 1.00 0.00 O ATOM 23784 C1 PGR 617 67.931 3.806 53.355 1.00 0.00 C ATOM 23785 HR PGR 617 67.161 4.164 54.043 1.00 0.00 H ATOM 23786 HS PGR 617 68.935 3.992 53.743 1.00 0.00 H ATOM 23787 C2 PGR 617 67.720 2.311 53.212 1.00 0.00 C ATOM 23788 HX PGR 617 66.783 2.068 52.703 1.00 0.00 H ATOM 23789 C3 PGR 617 67.702 1.662 54.669 1.00 0.00 C ATOM 23790 HA PGR 617 67.722 0.618 54.345 1.00 0.00 H ATOM 23791 HB PGR 617 66.770 1.977 55.146 1.00 0.00 H ATOM 23792 O31 PGR 617 68.949 1.993 55.302 1.00 0.00 O ATOM 23793 P31 PGR 617 69.218 1.361 56.753 1.00 0.00 P ATOM 23794 O32 PGR 617 68.532 2.390 57.807 1.00 0.00 O ATOM 23795 C31 PGR 617 67.165 2.756 57.644 1.00 0.00 C ATOM 23796 H1A PGR 617 66.606 1.858 57.368 1.00 0.00 H ATOM 23797 H1B PGR 617 67.183 3.527 56.869 1.00 0.00 H ATOM 23798 C32 PGR 617 66.539 3.224 58.983 1.00 0.00 C ATOM 23799 H2A PGR 617 65.493 3.488 58.809 1.00 0.00 H ATOM 23800 O35 PGR 617 67.209 4.442 59.460 1.00 0.00 O ATOM 23801 HO5A PGR 617 68.175 4.313 59.446 1.00 0.00 H ATOM 23802 C33 PGR 617 66.763 2.097 60.093 1.00 0.00 C ATOM 23803 H3A PGR 617 66.249 1.163 59.851 1.00 0.00 H ATOM 23804 H3B PGR 617 67.818 1.811 60.108 1.00 0.00 H ATOM 23805 O33 PGR 617 68.463 0.106 56.879 1.00 0.00 O ATOM 23806 O34 PGR 617 70.681 1.368 56.873 1.00 0.00 O ATOM 23807 O21 PGR 617 68.843 1.839 52.450 1.00 0.00 O ATOM 23808 C21 PGR 617 68.918 0.640 51.846 1.00 0.00 C ATOM 23809 O22 PGR 617 68.286 -0.365 52.063 1.00 0.00 O ATOM 23810 O36 PGR 617 66.350 2.507 61.368 1.00 0.00 O ATOM 23811 HO6A PGR 617 67.004 2.167 62.005 1.00 0.00 H ATOM 23812 C12 OL 618 70.099 0.631 50.837 1.00 0.00 C ATOM 23813 H2R OL 618 70.988 0.908 51.407 1.00 0.00 H ATOM 23814 H2S OL 618 70.146 -0.402 50.484 1.00 0.00 H ATOM 23815 C13 OL 618 69.838 1.618 49.709 1.00 0.00 C ATOM 23816 H3R OL 618 68.782 1.471 49.471 1.00 0.00 H ATOM 23817 H3S OL 618 69.774 2.619 50.139 1.00 0.00 H ATOM 23818 C14 OL 618 70.761 1.525 48.566 1.00 0.00 C ATOM 23819 H4R OL 618 71.824 1.443 48.806 1.00 0.00 H ATOM 23820 H4S OL 618 70.766 0.599 47.987 1.00 0.00 H ATOM 23821 C15 OL 618 70.404 2.563 47.553 1.00 0.00 C ATOM 23822 H5R OL 618 69.324 2.678 47.442 1.00 0.00 H ATOM 23823 H5S OL 618 70.620 3.548 47.972 1.00 0.00 H ATOM 23824 C16 OL 618 71.199 2.422 46.195 1.00 0.00 C ATOM 23825 H6R OL 618 70.983 1.429 45.797 1.00 0.00 H ATOM 23826 H6S OL 618 71.100 3.161 45.397 1.00 0.00 H ATOM 23827 C17 OL 618 72.717 2.348 46.396 1.00 0.00 C ATOM 23828 H7R OL 618 72.875 3.320 46.867 1.00 0.00 H ATOM 23829 H7S OL 618 73.032 1.508 47.019 1.00 0.00 H ATOM 23830 C18 OL 618 73.462 2.373 45.039 1.00 0.00 C ATOM 23831 H8R OL 618 73.120 1.547 44.413 1.00 0.00 H ATOM 23832 H8S OL 618 73.293 3.168 44.310 1.00 0.00 H ATOM 23833 C19 OL 618 74.961 2.311 45.345 1.00 0.00 C ATOM 23834 H9R OL 618 75.301 3.203 45.865 1.00 0.00 H ATOM 23835 C110 OL 618 75.890 1.411 44.960 1.00 0.00 C ATOM 23836 H10R OL 618 76.904 1.524 45.336 1.00 0.00 H ATOM 23837 C111 OL 618 75.724 0.258 43.974 1.00 0.00 C ATOM 23838 H11R OL 618 75.804 -0.742 44.405 1.00 0.00 H ATOM 23839 H11S OL 618 74.704 0.283 43.584 1.00 0.00 H ATOM 23840 C112 OL 618 76.809 0.399 42.949 1.00 0.00 C ATOM 23841 H12R OL 618 76.911 1.431 42.607 1.00 0.00 H ATOM 23842 H12S OL 618 77.743 0.185 43.472 1.00 0.00 H ATOM 23843 C113 OL 618 76.697 -0.603 41.811 1.00 0.00 C ATOM 23844 H13R OL 618 77.121 -1.551 42.151 1.00 0.00 H ATOM 23845 H13S OL 618 75.764 -1.113 41.559 1.00 0.00 H ATOM 23846 C114 OL 618 77.432 -0.244 40.595 1.00 0.00 C ATOM 23847 H14R OL 618 77.363 0.824 40.376 1.00 0.00 H ATOM 23848 H14S OL 618 78.479 -0.538 40.698 1.00 0.00 H ATOM 23849 C115 OL 618 76.946 -0.938 39.292 1.00 0.00 C ATOM 23850 H15R OL 618 75.936 -0.597 39.056 1.00 0.00 H ATOM 23851 H15S OL 618 77.653 -0.648 38.512 1.00 0.00 H ATOM 23852 C116 OL 618 76.913 -2.486 39.146 1.00 0.00 C ATOM 23853 H16R OL 618 76.740 -2.910 38.154 1.00 0.00 H ATOM 23854 H16S OL 618 77.834 -2.903 39.559 1.00 0.00 H ATOM 23855 C117 OL 618 75.893 -3.314 39.979 1.00 0.00 C ATOM 23856 H17R OL 618 76.209 -4.333 39.745 1.00 0.00 H ATOM 23857 H17S OL 618 75.975 -3.218 41.063 1.00 0.00 H ATOM 23858 C118 OL 618 74.385 -3.139 39.593 1.00 0.00 C ATOM 23859 H18R OL 618 74.273 -3.495 38.567 1.00 0.00 H ATOM 23860 H18S OL 618 74.010 -2.140 39.825 1.00 0.00 H ATOM 23861 H18T OL 618 73.798 -3.799 40.235 1.00 0.00 H TER 23862 OL 618 ATOM 23862 C116 PA 619 142.969 100.063 39.993 1.00 0.00 C ATOM 23863 H16R PA 619 142.918 99.642 38.987 1.00 0.00 H ATOM 23864 H16S PA 619 142.067 100.670 40.095 1.00 0.00 H ATOM 23865 H16T PA 619 142.881 99.251 40.718 1.00 0.00 H ATOM 23866 C115 PA 619 144.279 100.825 40.172 1.00 0.00 C ATOM 23867 H15R PA 619 144.409 101.589 39.403 1.00 0.00 H ATOM 23868 H15S PA 619 145.076 100.117 39.936 1.00 0.00 H ATOM 23869 C114 PA 619 144.452 101.390 41.573 1.00 0.00 C ATOM 23870 H14R PA 619 145.341 102.008 41.710 1.00 0.00 H ATOM 23871 H14S PA 619 144.576 100.574 42.287 1.00 0.00 H ATOM 23872 C113 PA 619 143.236 102.310 41.991 1.00 0.00 C ATOM 23873 H13R PA 619 142.257 101.879 41.774 1.00 0.00 H ATOM 23874 H13S PA 619 143.376 103.274 41.498 1.00 0.00 H ATOM 23875 C112 PA 619 143.175 102.559 43.515 1.00 0.00 C ATOM 23876 H12R PA 619 142.473 103.395 43.473 1.00 0.00 H ATOM 23877 H12S PA 619 144.207 102.850 43.721 1.00 0.00 H ATOM 23878 C111 PA 619 142.679 101.451 44.405 1.00 0.00 C ATOM 23879 H11R PA 619 143.502 100.742 44.512 1.00 0.00 H ATOM 23880 H11S PA 619 141.866 100.953 43.874 1.00 0.00 H ATOM 23881 C110 PA 619 142.296 102.110 45.780 1.00 0.00 C ATOM 23882 H10R PA 619 141.373 102.603 45.469 1.00 0.00 H ATOM 23883 H10S PA 619 142.929 102.905 46.178 1.00 0.00 H ATOM 23884 C19 PA 619 142.102 100.977 46.820 1.00 0.00 C ATOM 23885 H9R PA 619 143.067 100.670 47.227 1.00 0.00 H ATOM 23886 H9S PA 619 141.591 100.066 46.499 1.00 0.00 H ATOM 23887 C18 PA 619 141.473 101.549 48.108 1.00 0.00 C ATOM 23888 H8R PA 619 140.699 102.297 47.921 1.00 0.00 H ATOM 23889 H8S PA 619 142.352 102.131 48.392 1.00 0.00 H ATOM 23890 C17 PA 619 141.394 100.499 49.171 1.00 0.00 C ATOM 23891 H7R PA 619 142.387 100.228 49.534 1.00 0.00 H ATOM 23892 H7S PA 619 141.032 99.528 48.825 1.00 0.00 H ATOM 23893 C16 PA 619 140.527 100.955 50.398 1.00 0.00 C ATOM 23894 H6R PA 619 139.513 101.094 50.017 1.00 0.00 H ATOM 23895 H6S PA 619 140.762 101.959 50.757 1.00 0.00 H ATOM 23896 C15 PA 619 140.587 100.017 51.622 1.00 0.00 C ATOM 23897 H5R PA 619 140.194 99.055 51.288 1.00 0.00 H ATOM 23898 H5S PA 619 139.833 100.444 52.287 1.00 0.00 H ATOM 23899 C14 PA 619 141.832 99.895 52.375 1.00 0.00 C ATOM 23900 H4R PA 619 142.264 100.873 52.596 1.00 0.00 H ATOM 23901 H4S PA 619 142.585 99.434 51.732 1.00 0.00 H ATOM 23902 C13 PA 619 141.582 99.051 53.651 1.00 0.00 C ATOM 23903 H3R PA 619 142.545 98.763 54.078 1.00 0.00 H ATOM 23904 H3S PA 619 141.073 98.095 53.510 1.00 0.00 H ATOM 23905 C12 PA 619 140.930 99.750 54.758 1.00 0.00 C ATOM 23906 H2R PA 619 141.322 100.764 54.652 1.00 0.00 H ATOM 23907 H2S PA 619 139.841 99.816 54.711 1.00 0.00 H ATOM 23908 C11 PGR 620 141.252 99.107 56.130 1.00 0.00 C ATOM 23909 O12 PGR 620 142.130 99.541 56.879 1.00 0.00 O ATOM 23910 O11 PGR 620 140.487 98.071 56.335 1.00 0.00 O ATOM 23911 C1 PGR 620 140.629 97.321 57.625 1.00 0.00 C ATOM 23912 HR PGR 620 141.680 97.082 57.808 1.00 0.00 H ATOM 23913 HS PGR 620 140.025 96.416 57.728 1.00 0.00 H ATOM 23914 C2 PGR 620 140.161 98.219 58.774 1.00 0.00 C ATOM 23915 HX PGR 620 140.700 99.169 58.799 1.00 0.00 H ATOM 23916 C3 PGR 620 140.421 97.608 60.133 1.00 0.00 C ATOM 23917 HA PGR 620 141.491 97.385 60.153 1.00 0.00 H ATOM 23918 HB PGR 620 139.783 96.730 60.263 1.00 0.00 H ATOM 23919 O31 PGR 620 140.006 98.485 61.181 1.00 0.00 O ATOM 23920 P31 PGR 620 140.109 97.965 62.735 1.00 0.00 P ATOM 23921 O32 PGR 620 139.274 98.999 63.527 1.00 0.00 O ATOM 23922 C31 PGR 620 137.880 99.049 63.418 1.00 0.00 C ATOM 23923 H1A PGR 620 137.657 98.542 62.476 1.00 0.00 H ATOM 23924 H1B PGR 620 137.536 100.063 63.197 1.00 0.00 H ATOM 23925 C32 PGR 620 137.101 98.431 64.598 1.00 0.00 C ATOM 23926 H2A PGR 620 137.339 98.999 65.501 1.00 0.00 H ATOM 23927 O35 PGR 620 137.462 97.100 64.922 1.00 0.00 O ATOM 23928 HO5A PGR 620 138.117 96.926 64.222 1.00 0.00 H ATOM 23929 C33 PGR 620 135.646 98.556 64.345 1.00 0.00 C ATOM 23930 H3A PGR 620 135.154 98.074 65.193 1.00 0.00 H ATOM 23931 H3B PGR 620 135.370 99.614 64.343 1.00 0.00 H ATOM 23932 O33 PGR 620 139.338 96.789 63.050 1.00 0.00 O ATOM 23933 O34 PGR 620 141.472 98.041 63.320 1.00 0.00 O ATOM 23934 O21 PGR 620 138.689 98.401 58.680 1.00 0.00 O ATOM 23935 C21 PGR 620 138.265 99.504 58.105 1.00 0.00 C ATOM 23936 O22 PGR 620 139.000 100.348 57.692 1.00 0.00 O ATOM 23937 O36 PGR 620 135.286 97.915 63.085 1.00 0.00 O ATOM 23938 HO6A PGR 620 135.413 96.950 63.119 1.00 0.00 H ATOM 23939 C12 OL 621 136.788 99.564 57.959 1.00 0.00 C ATOM 23940 H2R OL 621 136.319 99.498 58.944 1.00 0.00 H ATOM 23941 H2S OL 621 136.577 100.568 57.583 1.00 0.00 H ATOM 23942 C13 OL 621 136.184 98.513 57.076 1.00 0.00 C ATOM 23943 H3R OL 621 136.470 97.544 57.493 1.00 0.00 H ATOM 23944 H3S OL 621 135.104 98.556 57.226 1.00 0.00 H ATOM 23945 C14 OL 621 136.537 98.546 55.589 1.00 0.00 C ATOM 23946 H4R OL 621 137.612 98.499 55.402 1.00 0.00 H ATOM 23947 H4S OL 621 136.085 97.686 55.090 1.00 0.00 H ATOM 23948 C15 OL 621 136.092 99.773 54.827 1.00 0.00 C ATOM 23949 H5R OL 621 135.025 99.930 54.995 1.00 0.00 H ATOM 23950 H5S OL 621 136.694 100.597 55.214 1.00 0.00 H ATOM 23951 C16 OL 621 136.419 99.789 53.302 1.00 0.00 C ATOM 23952 H6R OL 621 137.378 99.278 53.195 1.00 0.00 H ATOM 23953 H6S OL 621 135.649 99.208 52.790 1.00 0.00 H ATOM 23954 C17 OL 621 136.560 101.153 52.645 1.00 0.00 C ATOM 23955 H7R OL 621 135.824 101.798 53.129 1.00 0.00 H ATOM 23956 H7S OL 621 137.486 101.615 52.993 1.00 0.00 H ATOM 23957 C18 OL 621 136.195 101.288 51.152 1.00 0.00 C ATOM 23958 H8R OL 621 136.600 102.241 50.805 1.00 0.00 H ATOM 23959 H8S OL 621 136.722 100.468 50.659 1.00 0.00 H ATOM 23960 C19 OL 621 134.732 101.222 50.891 1.00 0.00 C ATOM 23961 H9R OL 621 134.303 100.319 51.318 1.00 0.00 H ATOM 23962 C110 OL 621 133.937 102.170 50.370 1.00 0.00 C ATOM 23963 H10R OL 621 132.878 101.926 50.347 1.00 0.00 H ATOM 23964 C111 OL 621 134.307 103.440 49.725 1.00 0.00 C ATOM 23965 H11R OL 621 135.393 103.396 49.627 1.00 0.00 H ATOM 23966 H11S OL 621 133.869 103.517 48.728 1.00 0.00 H ATOM 23967 C112 OL 621 133.934 104.744 50.474 1.00 0.00 C ATOM 23968 H12R OL 621 134.126 105.619 49.850 1.00 0.00 H ATOM 23969 H12S OL 621 132.842 104.749 50.504 1.00 0.00 H ATOM 23970 C113 OL 621 134.369 105.015 51.936 1.00 0.00 C ATOM 23971 H13R OL 621 133.906 104.228 52.534 1.00 0.00 H ATOM 23972 H13S OL 621 135.452 104.892 52.009 1.00 0.00 H ATOM 23973 C114 OL 621 133.880 106.415 52.490 1.00 0.00 C ATOM 23974 H14R OL 621 134.122 107.203 51.774 1.00 0.00 H ATOM 23975 H14S OL 621 132.791 106.424 52.572 1.00 0.00 H ATOM 23976 C115 OL 621 134.471 106.773 53.854 1.00 0.00 C ATOM 23977 H15R OL 621 134.659 105.893 54.473 1.00 0.00 H ATOM 23978 H15S OL 621 135.459 107.207 53.689 1.00 0.00 H ATOM 23979 C116 OL 621 133.596 107.901 54.588 1.00 0.00 C ATOM 23980 H16R OL 621 133.482 108.686 53.838 1.00 0.00 H ATOM 23981 H16S OL 621 132.560 107.610 54.777 1.00 0.00 H ATOM 23982 C117 OL 621 134.208 108.410 55.948 1.00 0.00 C ATOM 23983 H17R OL 621 133.625 109.159 56.488 1.00 0.00 H ATOM 23984 H17S OL 621 134.236 107.573 56.650 1.00 0.00 H ATOM 23985 C118 OL 621 135.587 109.047 55.899 1.00 0.00 C ATOM 23986 H18R OL 621 136.403 108.350 55.695 1.00 0.00 H ATOM 23987 H18S OL 621 135.759 109.668 56.780 1.00 0.00 H ATOM 23988 H18T OL 621 135.674 109.764 55.080 1.00 0.00 H TER 23989 OL 621 ATOM 23989 C116 PA 622 91.235 9.061 41.649 1.00 0.00 C ATOM 23990 H16R PA 622 92.305 8.916 41.812 1.00 0.00 H ATOM 23991 H16S PA 622 91.090 9.660 40.748 1.00 0.00 H ATOM 23992 H16T PA 622 90.773 8.090 41.459 1.00 0.00 H ATOM 23993 C115 PA 622 90.473 9.713 42.854 1.00 0.00 C ATOM 23994 H15R PA 622 90.975 10.649 43.108 1.00 0.00 H ATOM 23995 H15S PA 622 90.673 9.109 43.741 1.00 0.00 H ATOM 23996 C114 PA 622 89.047 9.841 42.514 1.00 0.00 C ATOM 23997 H14R PA 622 88.641 8.907 42.119 1.00 0.00 H ATOM 23998 H14S PA 622 88.944 10.442 41.608 1.00 0.00 H ATOM 23999 C113 PA 622 88.143 10.387 43.592 1.00 0.00 C ATOM 24000 H13R PA 622 88.493 9.961 44.535 1.00 0.00 H ATOM 24001 H13S PA 622 87.182 9.892 43.439 1.00 0.00 H ATOM 24002 C112 PA 622 87.994 11.961 43.557 1.00 0.00 C ATOM 24003 H12R PA 622 88.097 12.369 42.550 1.00 0.00 H ATOM 24004 H12S PA 622 88.851 12.410 44.062 1.00 0.00 H ATOM 24005 C111 PA 622 86.727 12.572 44.237 1.00 0.00 C ATOM 24006 H11R PA 622 85.858 12.135 43.741 1.00 0.00 H ATOM 24007 H11S PA 622 86.602 13.618 43.948 1.00 0.00 H ATOM 24008 C110 PA 622 86.660 12.607 45.839 1.00 0.00 C ATOM 24009 H10R PA 622 87.555 13.182 46.087 1.00 0.00 H ATOM 24010 H10S PA 622 86.720 11.582 46.212 1.00 0.00 H ATOM 24011 C19 PA 622 85.510 13.440 46.381 1.00 0.00 C ATOM 24012 H9R PA 622 84.605 13.012 45.945 1.00 0.00 H ATOM 24013 H9S PA 622 85.500 14.365 45.802 1.00 0.00 H ATOM 24014 C18 PA 622 85.294 13.639 47.893 1.00 0.00 C ATOM 24015 H8R PA 622 85.463 12.616 48.238 1.00 0.00 H ATOM 24016 H8S PA 622 84.308 14.041 48.133 1.00 0.00 H ATOM 24017 C17 PA 622 86.362 14.580 48.548 1.00 0.00 C ATOM 24018 H7R PA 622 86.276 15.428 47.866 1.00 0.00 H ATOM 24019 H7S PA 622 87.350 14.134 48.419 1.00 0.00 H ATOM 24020 C16 PA 622 86.140 14.937 50.039 1.00 0.00 C ATOM 24021 H6R PA 622 85.107 15.217 50.255 1.00 0.00 H ATOM 24022 H6S PA 622 86.654 15.885 50.211 1.00 0.00 H ATOM 24023 C15 PA 622 86.861 13.898 51.020 1.00 0.00 C ATOM 24024 H5R PA 622 87.801 13.551 50.586 1.00 0.00 H ATOM 24025 H5S PA 622 86.291 12.969 51.089 1.00 0.00 H ATOM 24026 C14 PA 622 87.056 14.500 52.406 1.00 0.00 C ATOM 24027 H4R PA 622 86.053 14.652 52.811 1.00 0.00 H ATOM 24028 H4S PA 622 87.509 15.487 52.291 1.00 0.00 H ATOM 24029 C13 PA 622 87.861 13.610 53.362 1.00 0.00 C ATOM 24030 H3R PA 622 88.413 14.169 54.119 1.00 0.00 H ATOM 24031 H3S PA 622 88.637 13.048 52.838 1.00 0.00 H ATOM 24032 C12 PA 622 86.970 12.616 54.111 1.00 0.00 C ATOM 24033 H2R PA 622 86.445 12.060 53.332 1.00 0.00 H ATOM 24034 H2S PA 622 86.242 12.995 54.831 1.00 0.00 H ATOM 24035 C11 PC 623 87.800 11.767 54.989 1.00 0.00 C ATOM 24036 O12 PC 623 88.953 12.122 55.280 1.00 0.00 O ATOM 24037 O11 PC 623 87.242 10.644 55.401 1.00 0.00 O ATOM 24038 C1 PC 623 88.015 9.647 56.184 1.00 0.00 C ATOM 24039 HR PC 623 88.127 10.073 57.184 1.00 0.00 H ATOM 24040 HS PC 623 88.988 9.392 55.756 1.00 0.00 H ATOM 24041 C2 PC 623 87.072 8.372 56.208 1.00 0.00 C ATOM 24042 HX PC 623 86.048 8.734 56.330 1.00 0.00 H ATOM 24043 C3 PC 623 87.437 7.542 57.450 1.00 0.00 C ATOM 24044 HA PC 623 86.854 6.617 57.469 1.00 0.00 H ATOM 24045 HB PC 623 87.356 8.102 58.385 1.00 0.00 H ATOM 24046 O31 PC 623 88.793 6.924 57.360 1.00 0.00 O ATOM 24047 P31 PC 623 89.519 6.310 58.663 1.00 0.00 P ATOM 24048 O32 PC 623 90.645 7.291 59.002 1.00 0.00 O ATOM 24049 C31 PC 623 90.256 8.577 59.189 1.00 0.00 C ATOM 24050 H1A PC 623 89.355 8.538 59.806 1.00 0.00 H ATOM 24051 H1B PC 623 90.159 9.025 58.197 1.00 0.00 H ATOM 24052 C32 PC 623 91.339 9.413 59.937 1.00 0.00 C ATOM 24053 H2A PC 623 91.073 10.471 59.969 1.00 0.00 H ATOM 24054 H2B PC 623 92.227 9.438 59.304 1.00 0.00 H ATOM 24055 N31 PC 623 91.842 9.163 61.327 1.00 0.00 N ATOM 24056 C33 PC 623 90.741 9.340 62.391 1.00 0.00 C ATOM 24057 H3A PC 623 91.209 9.258 63.373 1.00 0.00 H ATOM 24058 H3B PC 623 90.100 8.457 62.401 1.00 0.00 H ATOM 24059 H3C PC 623 90.146 10.229 62.179 1.00 0.00 H ATOM 24060 C34 PC 623 92.260 7.769 61.403 1.00 0.00 C ATOM 24061 H4A PC 623 92.726 7.547 62.364 1.00 0.00 H ATOM 24062 H4B PC 623 93.026 7.646 60.635 1.00 0.00 H ATOM 24063 H4C PC 623 91.407 7.123 61.189 1.00 0.00 H ATOM 24064 C35 PC 623 93.014 10.014 61.613 1.00 0.00 C ATOM 24065 H5A PC 623 93.479 9.693 62.546 1.00 0.00 H ATOM 24066 H5B PC 623 92.722 11.059 61.500 1.00 0.00 H ATOM 24067 H5C PC 623 93.818 9.766 60.919 1.00 0.00 H ATOM 24068 O33 PC 623 88.532 6.124 59.748 1.00 0.00 O ATOM 24069 O34 PC 623 90.195 5.094 58.119 1.00 0.00 O ATOM 24070 O21 PC 623 87.086 7.627 54.954 1.00 0.00 O ATOM 24071 C21 PC 623 86.215 6.663 54.777 1.00 0.00 C ATOM 24072 O22 PC 623 85.649 6.140 55.647 1.00 0.00 O ATOM 24073 C12 OL 624 86.040 6.220 53.336 1.00 0.00 C ATOM 24074 H2R OL 624 86.890 5.780 52.809 1.00 0.00 H ATOM 24075 H2S OL 624 85.280 5.436 53.315 1.00 0.00 H ATOM 24076 C13 OL 624 85.843 7.362 52.307 1.00 0.00 C ATOM 24077 H3R OL 624 85.658 6.881 51.345 1.00 0.00 H ATOM 24078 H3S OL 624 84.900 7.875 52.506 1.00 0.00 H ATOM 24079 C14 OL 624 86.958 8.315 52.050 1.00 0.00 C ATOM 24080 H4R OL 624 87.040 9.074 52.830 1.00 0.00 H ATOM 24081 H4S OL 624 87.858 7.696 52.051 1.00 0.00 H ATOM 24082 C15 OL 624 86.872 8.927 50.651 1.00 0.00 C ATOM 24083 H5R OL 624 86.987 8.069 49.985 1.00 0.00 H ATOM 24084 H5S OL 624 85.903 9.272 50.286 1.00 0.00 H ATOM 24085 C16 OL 624 88.062 9.795 50.358 1.00 0.00 C ATOM 24086 H6R OL 624 87.849 10.760 50.823 1.00 0.00 H ATOM 24087 H6S OL 624 89.034 9.501 50.759 1.00 0.00 H ATOM 24088 C17 OL 624 88.280 10.199 48.879 1.00 0.00 C ATOM 24089 H7R OL 624 88.482 9.315 48.270 1.00 0.00 H ATOM 24090 H7S OL 624 87.323 10.548 48.485 1.00 0.00 H ATOM 24091 C18 OL 624 89.353 11.217 48.424 1.00 0.00 C ATOM 24092 H8R OL 624 89.326 11.424 47.352 1.00 0.00 H ATOM 24093 H8S OL 624 89.232 12.143 48.990 1.00 0.00 H ATOM 24094 C19 OL 624 90.794 10.870 48.678 1.00 0.00 C ATOM 24095 H9R OL 624 91.083 10.816 49.724 1.00 0.00 H ATOM 24096 C110 OL 624 91.704 10.495 47.756 1.00 0.00 C ATOM 24097 H10R OL 624 92.696 10.275 48.141 1.00 0.00 H ATOM 24098 C111 OL 624 91.575 10.721 46.290 1.00 0.00 C ATOM 24099 H11R OL 624 90.867 9.987 45.899 1.00 0.00 H ATOM 24100 H11S OL 624 91.171 11.733 46.209 1.00 0.00 H ATOM 24101 C112 OL 624 93.033 10.546 45.769 1.00 0.00 C ATOM 24102 H12R OL 624 93.257 11.158 44.893 1.00 0.00 H ATOM 24103 H12S OL 624 93.716 11.072 46.439 1.00 0.00 H ATOM 24104 C113 OL 624 93.390 9.047 45.525 1.00 0.00 C ATOM 24105 H13R OL 624 93.335 8.615 46.527 1.00 0.00 H ATOM 24106 H13S OL 624 92.622 8.567 44.914 1.00 0.00 H ATOM 24107 C114 OL 624 94.710 8.674 44.927 1.00 0.00 C ATOM 24108 H14R OL 624 94.605 7.623 44.652 1.00 0.00 H ATOM 24109 H14S OL 624 94.759 9.185 43.963 1.00 0.00 H ATOM 24110 C115 OL 624 95.986 8.868 45.760 1.00 0.00 C ATOM 24111 H15R OL 624 96.885 8.756 45.149 1.00 0.00 H ATOM 24112 H15S OL 624 95.976 9.931 46.009 1.00 0.00 H ATOM 24113 C116 OL 624 96.091 8.167 47.107 1.00 0.00 C ATOM 24114 H16R OL 624 95.217 8.108 47.759 1.00 0.00 H ATOM 24115 H16S OL 624 96.374 7.118 46.998 1.00 0.00 H ATOM 24116 C117 OL 624 97.106 8.929 48.006 1.00 0.00 C ATOM 24117 H17R OL 624 98.021 9.142 47.449 1.00 0.00 H ATOM 24118 H17S OL 624 96.611 9.854 48.308 1.00 0.00 H ATOM 24119 C118 OL 624 97.540 8.212 49.299 1.00 0.00 C ATOM 24120 H18R OL 624 98.414 7.573 49.159 1.00 0.00 H ATOM 24121 H18S OL 624 96.726 7.537 49.570 1.00 0.00 H ATOM 24122 H18T OL 624 97.862 8.940 50.047 1.00 0.00 H TER 24123 OL 624 ATOM 24123 C116 PA 625 120.679 119.857 41.412 1.00 0.00 C ATOM 24124 H16R PA 625 121.667 120.110 41.022 1.00 0.00 H ATOM 24125 H16S PA 625 120.115 120.671 40.954 1.00 0.00 H ATOM 24126 H16T PA 625 120.380 118.940 40.899 1.00 0.00 H ATOM 24127 C115 PA 625 120.331 120.061 42.896 1.00 0.00 C ATOM 24128 H15R PA 625 119.282 120.064 43.199 1.00 0.00 H ATOM 24129 H15S PA 625 120.693 120.956 43.407 1.00 0.00 H ATOM 24130 C114 PA 625 120.934 119.120 43.888 1.00 0.00 C ATOM 24131 H14R PA 625 121.990 119.395 43.922 1.00 0.00 H ATOM 24132 H14S PA 625 120.881 118.081 43.556 1.00 0.00 H ATOM 24133 C113 PA 625 120.581 119.433 45.332 1.00 0.00 C ATOM 24134 H13R PA 625 119.530 119.170 45.466 1.00 0.00 H ATOM 24135 H13S PA 625 120.792 120.500 45.435 1.00 0.00 H ATOM 24136 C112 PA 625 121.400 118.578 46.399 1.00 0.00 C ATOM 24137 H12R PA 625 122.420 118.943 46.263 1.00 0.00 H ATOM 24138 H12S PA 625 121.330 117.533 46.091 1.00 0.00 H ATOM 24139 C111 PA 625 121.121 118.856 47.864 1.00 0.00 C ATOM 24140 H11R PA 625 120.063 118.720 48.098 1.00 0.00 H ATOM 24141 H11S PA 625 121.437 119.884 48.053 1.00 0.00 H ATOM 24142 C110 PA 625 121.812 117.905 48.878 1.00 0.00 C ATOM 24143 H10R PA 625 122.893 118.044 48.812 1.00 0.00 H ATOM 24144 H10S PA 625 121.621 116.833 48.794 1.00 0.00 H ATOM 24145 C19 PA 625 121.522 118.223 50.296 1.00 0.00 C ATOM 24146 H9R PA 625 120.451 118.120 50.481 1.00 0.00 H ATOM 24147 H9S PA 625 121.636 119.274 50.571 1.00 0.00 H ATOM 24148 C18 PA 625 122.439 117.437 51.265 1.00 0.00 C ATOM 24149 H8R PA 625 123.502 117.683 51.219 1.00 0.00 H ATOM 24150 H8S PA 625 122.346 116.395 50.953 1.00 0.00 H ATOM 24151 C17 PA 625 122.029 117.456 52.655 1.00 0.00 C ATOM 24152 H7R PA 625 121.182 116.770 52.581 1.00 0.00 H ATOM 24153 H7S PA 625 121.733 118.416 53.083 1.00 0.00 H ATOM 24154 C16 PA 625 122.980 116.797 53.615 1.00 0.00 C ATOM 24155 H6R PA 625 123.799 117.514 53.699 1.00 0.00 H ATOM 24156 H6S PA 625 123.400 115.848 53.275 1.00 0.00 H ATOM 24157 C15 PA 625 122.205 116.543 54.934 1.00 0.00 C ATOM 24158 H5R PA 625 121.144 116.378 54.739 1.00 0.00 H ATOM 24159 H5S PA 625 122.325 117.517 55.414 1.00 0.00 H ATOM 24160 C14 PA 625 122.793 115.448 55.838 1.00 0.00 C ATOM 24161 H4R PA 625 122.509 114.483 55.412 1.00 0.00 H ATOM 24162 H4S PA 625 122.270 115.603 56.784 1.00 0.00 H ATOM 24163 C13 PA 625 124.332 115.561 56.100 1.00 0.00 C ATOM 24164 H3R PA 625 124.878 116.359 55.593 1.00 0.00 H ATOM 24165 H3S PA 625 124.651 114.643 55.601 1.00 0.00 H ATOM 24166 C12 PA 625 124.601 115.825 57.612 1.00 0.00 C ATOM 24167 H2R PA 625 124.270 116.832 57.875 1.00 0.00 H ATOM 24168 H2S PA 625 124.061 115.105 58.229 1.00 0.00 H ATOM 24169 C11 PGR 626 126.076 115.834 57.974 1.00 0.00 C ATOM 24170 O12 PGR 626 126.475 115.155 58.856 1.00 0.00 O ATOM 24171 O11 PGR 626 126.755 116.675 57.178 1.00 0.00 O ATOM 24172 C1 PGR 626 128.105 116.914 57.647 1.00 0.00 C ATOM 24173 HR PGR 626 128.022 117.327 58.656 1.00 0.00 H ATOM 24174 HS PGR 626 128.478 117.718 57.008 1.00 0.00 H ATOM 24175 C2 PGR 626 129.045 115.679 57.500 1.00 0.00 C ATOM 24176 HX PGR 626 128.524 114.743 57.718 1.00 0.00 H ATOM 24177 C3 PGR 626 130.324 115.908 58.337 1.00 0.00 C ATOM 24178 HA PGR 626 130.068 116.270 59.336 1.00 0.00 H ATOM 24179 HB PGR 626 130.731 116.669 57.666 1.00 0.00 H ATOM 24180 O31 PGR 626 131.142 114.789 58.437 1.00 0.00 O ATOM 24181 P31 PGR 626 131.094 113.653 59.527 1.00 0.00 P ATOM 24182 O32 PGR 626 129.940 112.673 59.074 1.00 0.00 O ATOM 24183 C31 PGR 626 129.964 112.072 57.794 1.00 0.00 C ATOM 24184 H1A PGR 626 130.872 111.485 57.634 1.00 0.00 H ATOM 24185 H1B PGR 626 129.907 112.869 57.048 1.00 0.00 H ATOM 24186 C32 PGR 626 128.729 111.159 57.533 1.00 0.00 C ATOM 24187 H2A PGR 626 128.622 110.982 56.460 1.00 0.00 H ATOM 24188 O35 PGR 626 129.002 109.857 58.142 1.00 0.00 O ATOM 24189 HO5A PGR 626 128.168 109.376 58.288 1.00 0.00 H ATOM 24190 C33 PGR 626 127.356 111.670 58.069 1.00 0.00 C ATOM 24191 H3A PGR 626 127.222 112.735 57.864 1.00 0.00 H ATOM 24192 H3B PGR 626 126.574 111.152 57.507 1.00 0.00 H ATOM 24193 O33 PGR 626 132.316 112.876 59.411 1.00 0.00 O ATOM 24194 O34 PGR 626 130.678 114.253 60.807 1.00 0.00 O ATOM 24195 O21 PGR 626 129.493 115.665 56.137 1.00 0.00 O ATOM 24196 C21 PGR 626 128.823 114.945 55.258 1.00 0.00 C ATOM 24197 O22 PGR 626 127.793 114.331 55.461 1.00 0.00 O ATOM 24198 O36 PGR 626 127.290 111.422 59.503 1.00 0.00 O ATOM 24199 HO6A PGR 626 126.506 111.891 59.839 1.00 0.00 H ATOM 24200 C12 OL 627 129.414 115.026 53.878 1.00 0.00 C ATOM 24201 H2R OL 627 130.353 115.582 53.840 1.00 0.00 H ATOM 24202 H2S OL 627 129.582 114.001 53.542 1.00 0.00 H ATOM 24203 C13 OL 627 128.383 115.802 52.950 1.00 0.00 C ATOM 24204 H3R OL 627 127.406 115.366 53.169 1.00 0.00 H ATOM 24205 H3S OL 627 128.319 116.877 53.133 1.00 0.00 H ATOM 24206 C14 OL 627 128.771 115.502 51.517 1.00 0.00 C ATOM 24207 H4R OL 627 129.841 115.719 51.521 1.00 0.00 H ATOM 24208 H4S OL 627 128.721 114.434 51.294 1.00 0.00 H ATOM 24209 C15 OL 627 128.132 116.404 50.415 1.00 0.00 C ATOM 24210 H5R OL 627 128.428 117.409 50.724 1.00 0.00 H ATOM 24211 H5S OL 627 128.566 116.270 49.422 1.00 0.00 H ATOM 24212 C16 OL 627 126.647 116.316 50.381 1.00 0.00 C ATOM 24213 H6R OL 627 126.318 115.279 50.291 1.00 0.00 H ATOM 24214 H6S OL 627 126.239 116.573 51.361 1.00 0.00 H ATOM 24215 C17 OL 627 126.027 117.199 49.237 1.00 0.00 C ATOM 24216 H7R OL 627 124.966 117.277 49.482 1.00 0.00 H ATOM 24217 H7S OL 627 126.378 118.229 49.333 1.00 0.00 H ATOM 24218 C18 OL 627 126.195 116.677 47.785 1.00 0.00 C ATOM 24219 H8R OL 627 127.255 116.805 47.559 1.00 0.00 H ATOM 24220 H8S OL 627 125.926 115.619 47.799 1.00 0.00 H ATOM 24221 C19 OL 627 125.347 117.547 46.876 1.00 0.00 C ATOM 24222 H9R OL 627 125.448 118.614 47.058 1.00 0.00 H ATOM 24223 C110 OL 627 124.532 117.229 45.829 1.00 0.00 C ATOM 24224 H10R OL 627 123.906 118.000 45.387 1.00 0.00 H ATOM 24225 C111 OL 627 124.259 115.915 45.236 1.00 0.00 C ATOM 24226 H11R OL 627 124.759 115.179 45.869 1.00 0.00 H ATOM 24227 H11S OL 627 123.176 115.776 45.216 1.00 0.00 H ATOM 24228 C112 OL 627 124.963 115.886 43.870 1.00 0.00 C ATOM 24229 H12R OL 627 125.991 116.234 43.986 1.00 0.00 H ATOM 24230 H12S OL 627 124.879 114.875 43.465 1.00 0.00 H ATOM 24231 C113 OL 627 124.408 116.768 42.799 1.00 0.00 C ATOM 24232 H13R OL 627 124.475 117.847 42.955 1.00 0.00 H ATOM 24233 H13S OL 627 124.953 116.539 41.881 1.00 0.00 H ATOM 24234 C114 OL 627 122.928 116.405 42.507 1.00 0.00 C ATOM 24235 H14R OL 627 122.458 116.697 43.448 1.00 0.00 H ATOM 24236 H14S OL 627 122.702 117.010 41.626 1.00 0.00 H ATOM 24237 C115 OL 627 122.632 114.987 42.065 1.00 0.00 C ATOM 24238 H15R OL 627 123.105 114.664 41.136 1.00 0.00 H ATOM 24239 H15S OL 627 122.913 114.256 42.826 1.00 0.00 H ATOM 24240 C116 OL 627 121.131 114.811 41.768 1.00 0.00 C ATOM 24241 H16R OL 627 120.492 115.003 42.632 1.00 0.00 H ATOM 24242 H16S OL 627 120.834 115.496 40.971 1.00 0.00 H ATOM 24243 C117 OL 627 120.680 113.386 41.303 1.00 0.00 C ATOM 24244 H17R OL 627 120.634 112.669 42.125 1.00 0.00 H ATOM 24245 H17S OL 627 119.633 113.404 40.993 1.00 0.00 H ATOM 24246 C118 OL 627 121.484 112.725 40.174 1.00 0.00 C ATOM 24247 H18R OL 627 121.089 111.723 39.996 1.00 0.00 H ATOM 24248 H18S OL 627 122.521 112.639 40.507 1.00 0.00 H ATOM 24249 H18T OL 627 121.519 113.334 39.269 1.00 0.00 H TER 24250 OL 627 ATOM 24250 C116 PA 628 37.657 13.256 39.380 1.00 0.00 C ATOM 24251 H16R PA 628 37.674 14.254 39.825 1.00 0.00 H ATOM 24252 H16S PA 628 36.601 13.113 39.144 1.00 0.00 H ATOM 24253 H16T PA 628 38.165 13.371 38.420 1.00 0.00 H ATOM 24254 C115 PA 628 37.913 12.184 40.362 1.00 0.00 C ATOM 24255 H15R PA 628 39.004 12.201 40.340 1.00 0.00 H ATOM 24256 H15S PA 628 37.520 11.244 39.970 1.00 0.00 H ATOM 24257 C114 PA 628 37.407 12.413 41.723 1.00 0.00 C ATOM 24258 H14R PA 628 37.062 13.445 41.815 1.00 0.00 H ATOM 24259 H14S PA 628 38.270 12.452 42.391 1.00 0.00 H ATOM 24260 C113 PA 628 36.405 11.375 42.154 1.00 0.00 C ATOM 24261 H13R PA 628 36.694 10.324 42.218 1.00 0.00 H ATOM 24262 H13S PA 628 35.645 11.363 41.369 1.00 0.00 H ATOM 24263 C112 PA 628 35.773 11.718 43.557 1.00 0.00 C ATOM 24264 H12R PA 628 35.445 12.759 43.544 1.00 0.00 H ATOM 24265 H12S PA 628 36.566 11.701 44.307 1.00 0.00 H ATOM 24266 C111 PA 628 34.808 10.682 44.000 1.00 0.00 C ATOM 24267 H11R PA 628 35.271 9.697 43.913 1.00 0.00 H ATOM 24268 H11S PA 628 33.933 10.749 43.350 1.00 0.00 H ATOM 24269 C110 PA 628 34.305 10.877 45.528 1.00 0.00 C ATOM 24270 H10R PA 628 33.431 10.263 45.755 1.00 0.00 H ATOM 24271 H10S PA 628 33.899 11.890 45.555 1.00 0.00 H ATOM 24272 C19 PA 628 35.353 10.559 46.502 1.00 0.00 C ATOM 24273 H9R PA 628 36.384 10.884 46.347 1.00 0.00 H ATOM 24274 H9S PA 628 35.416 9.470 46.569 1.00 0.00 H ATOM 24275 C18 PA 628 35.038 11.043 47.970 1.00 0.00 C ATOM 24276 H8R PA 628 34.011 10.756 48.203 1.00 0.00 H ATOM 24277 H8S PA 628 35.146 12.126 47.883 1.00 0.00 H ATOM 24278 C17 PA 628 35.968 10.583 49.160 1.00 0.00 C ATOM 24279 H7R PA 628 35.917 9.498 49.270 1.00 0.00 H ATOM 24280 H7S PA 628 35.686 10.971 50.141 1.00 0.00 H ATOM 24281 C16 PA 628 37.432 11.037 49.054 1.00 0.00 C ATOM 24282 H6R PA 628 37.346 12.126 49.057 1.00 0.00 H ATOM 24283 H6S PA 628 38.006 10.806 48.155 1.00 0.00 H ATOM 24284 C15 PA 628 38.257 10.493 50.208 1.00 0.00 C ATOM 24285 H5R PA 628 37.680 10.532 51.134 1.00 0.00 H ATOM 24286 H5S PA 628 39.228 10.974 50.343 1.00 0.00 H ATOM 24287 C14 PA 628 38.474 8.967 50.127 1.00 0.00 C ATOM 24288 H4R PA 628 39.133 8.785 49.276 1.00 0.00 H ATOM 24289 H4S PA 628 37.544 8.432 49.921 1.00 0.00 H ATOM 24290 C13 PA 628 39.288 8.367 51.258 1.00 0.00 C ATOM 24291 H3R PA 628 38.722 8.529 52.178 1.00 0.00 H ATOM 24292 H3S PA 628 40.179 8.941 51.521 1.00 0.00 H ATOM 24293 C12 PA 628 39.630 6.903 50.862 1.00 0.00 C ATOM 24294 H2R PA 628 40.394 6.785 50.091 1.00 0.00 H ATOM 24295 H2S PA 628 38.756 6.372 50.478 1.00 0.00 H ATOM 24296 C11 PC 629 40.123 6.175 52.120 1.00 0.00 C ATOM 24297 O12 PC 629 41.002 6.561 52.808 1.00 0.00 O ATOM 24298 O11 PC 629 39.591 4.944 52.179 1.00 0.00 O ATOM 24299 C1 PC 629 39.812 4.074 53.335 1.00 0.00 C ATOM 24300 HR PC 629 40.889 3.925 53.226 1.00 0.00 H ATOM 24301 HS PC 629 39.283 3.167 53.031 1.00 0.00 H ATOM 24302 C2 PC 629 39.319 4.574 54.689 1.00 0.00 C ATOM 24303 HX PC 629 39.839 5.472 55.033 1.00 0.00 H ATOM 24304 C3 PC 629 39.490 3.543 55.801 1.00 0.00 C ATOM 24305 HA PC 629 40.509 3.161 55.696 1.00 0.00 H ATOM 24306 HB PC 629 38.821 2.706 55.587 1.00 0.00 H ATOM 24307 O31 PC 629 39.098 4.114 57.056 1.00 0.00 O ATOM 24308 P31 PC 629 39.460 3.318 58.322 1.00 0.00 P ATOM 24309 O32 PC 629 38.523 1.976 58.233 1.00 0.00 O ATOM 24310 C31 PC 629 38.657 1.184 59.330 1.00 0.00 C ATOM 24311 H1A PC 629 38.349 1.575 60.303 1.00 0.00 H ATOM 24312 H1B PC 629 39.696 0.907 59.525 1.00 0.00 H ATOM 24313 C32 PC 629 37.820 -0.057 58.919 1.00 0.00 C ATOM 24314 H2A PC 629 38.544 -0.686 58.400 1.00 0.00 H ATOM 24315 H2B PC 629 36.971 0.356 58.372 1.00 0.00 H ATOM 24316 N31 PC 629 37.336 -1.038 59.885 1.00 0.00 N ATOM 24317 C33 PC 629 36.370 -0.482 60.887 1.00 0.00 C ATOM 24318 H3A PC 629 36.991 0.128 61.544 1.00 0.00 H ATOM 24319 H3B PC 629 35.867 -1.323 61.367 1.00 0.00 H ATOM 24320 H3C PC 629 35.647 0.123 60.338 1.00 0.00 H ATOM 24321 C34 PC 629 36.641 -2.053 59.202 1.00 0.00 C ATOM 24322 H4A PC 629 37.339 -2.477 58.478 1.00 0.00 H ATOM 24323 H4B PC 629 35.888 -1.536 58.606 1.00 0.00 H ATOM 24324 H4C PC 629 36.305 -2.770 59.953 1.00 0.00 H ATOM 24325 C35 PC 629 38.510 -1.648 60.577 1.00 0.00 C ATOM 24326 H5A PC 629 39.109 -2.378 60.030 1.00 0.00 H ATOM 24327 H5B PC 629 38.088 -2.200 61.417 1.00 0.00 H ATOM 24328 H5C PC 629 39.220 -0.948 61.021 1.00 0.00 H ATOM 24329 O33 PC 629 40.939 3.036 58.355 1.00 0.00 O ATOM 24330 O34 PC 629 38.864 4.083 59.425 1.00 0.00 O ATOM 24331 O21 PC 629 37.854 4.666 54.569 1.00 0.00 O ATOM 24332 C21 PC 629 37.345 5.711 53.949 1.00 0.00 C ATOM 24333 O22 PC 629 37.964 6.692 53.618 1.00 0.00 O ATOM 24334 C12 OL 630 35.879 5.584 53.923 1.00 0.00 C ATOM 24335 H2R OL 630 35.480 5.625 54.938 1.00 0.00 H ATOM 24336 H2S OL 630 35.486 6.372 53.277 1.00 0.00 H ATOM 24337 C13 OL 630 35.202 4.312 53.302 1.00 0.00 C ATOM 24338 H3R OL 630 35.534 3.467 53.908 1.00 0.00 H ATOM 24339 H3S OL 630 34.116 4.401 53.380 1.00 0.00 H ATOM 24340 C14 OL 630 35.612 4.053 51.850 1.00 0.00 C ATOM 24341 H4R OL 630 36.686 3.881 51.941 1.00 0.00 H ATOM 24342 H4S OL 630 35.132 3.112 51.574 1.00 0.00 H ATOM 24343 C15 OL 630 35.238 5.232 50.847 1.00 0.00 C ATOM 24344 H5R OL 630 34.228 5.463 51.192 1.00 0.00 H ATOM 24345 H5S OL 630 35.730 6.186 51.046 1.00 0.00 H ATOM 24346 C16 OL 630 35.351 4.956 49.373 1.00 0.00 C ATOM 24347 H6R OL 630 36.435 4.860 49.277 1.00 0.00 H ATOM 24348 H6S OL 630 35.022 3.981 49.011 1.00 0.00 H ATOM 24349 C17 OL 630 34.946 6.047 48.324 1.00 0.00 C ATOM 24350 H7R OL 630 33.857 6.088 48.258 1.00 0.00 H ATOM 24351 H7S OL 630 35.304 7.044 48.589 1.00 0.00 H ATOM 24352 C18 OL 630 35.473 5.684 46.941 1.00 0.00 C ATOM 24353 H8R OL 630 36.562 5.733 47.009 1.00 0.00 H ATOM 24354 H8S OL 630 35.333 4.619 46.744 1.00 0.00 H ATOM 24355 C19 OL 630 34.861 6.431 45.818 1.00 0.00 C ATOM 24356 H9R OL 630 33.775 6.483 45.814 1.00 0.00 H ATOM 24357 C110 OL 630 35.577 7.044 44.927 1.00 0.00 C ATOM 24358 H10R OL 630 35.046 7.553 44.127 1.00 0.00 H ATOM 24359 C111 OL 630 37.034 7.047 44.709 1.00 0.00 C ATOM 24360 H11R OL 630 37.325 6.051 45.047 1.00 0.00 H ATOM 24361 H11S OL 630 37.196 7.254 43.649 1.00 0.00 H ATOM 24362 C112 OL 630 37.794 8.205 45.354 1.00 0.00 C ATOM 24363 H12R OL 630 37.420 9.146 44.945 1.00 0.00 H ATOM 24364 H12S OL 630 37.518 8.276 46.408 1.00 0.00 H ATOM 24365 C113 OL 630 39.311 7.988 45.342 1.00 0.00 C ATOM 24366 H13R OL 630 39.929 8.777 45.775 1.00 0.00 H ATOM 24367 H13S OL 630 39.465 7.277 46.156 1.00 0.00 H ATOM 24368 C114 OL 630 39.878 7.498 43.980 1.00 0.00 C ATOM 24369 H14R OL 630 40.867 7.094 44.206 1.00 0.00 H ATOM 24370 H14S OL 630 39.315 6.665 43.554 1.00 0.00 H ATOM 24371 C115 OL 630 40.180 8.655 43.090 1.00 0.00 C ATOM 24372 H15R OL 630 39.317 9.243 42.770 1.00 0.00 H ATOM 24373 H15S OL 630 40.847 9.361 43.589 1.00 0.00 H ATOM 24374 C116 OL 630 40.883 8.141 41.840 1.00 0.00 C ATOM 24375 H16R OL 630 41.386 7.186 42.006 1.00 0.00 H ATOM 24376 H16S OL 630 40.137 8.050 41.048 1.00 0.00 H ATOM 24377 C117 OL 630 41.832 9.135 41.214 1.00 0.00 C ATOM 24378 H17R OL 630 41.305 10.090 41.251 1.00 0.00 H ATOM 24379 H17S OL 630 42.700 9.196 41.874 1.00 0.00 H ATOM 24380 C118 OL 630 42.335 8.729 39.869 1.00 0.00 C ATOM 24381 H18R OL 630 43.169 9.361 39.556 1.00 0.00 H ATOM 24382 H18S OL 630 41.490 8.786 39.179 1.00 0.00 H ATOM 24383 H18T OL 630 42.611 7.694 40.082 1.00 0.00 H TER 24384 OL 630 ATOM 24384 C116 PA 631 143.033 27.398 40.952 1.00 0.00 C ATOM 24385 H16R PA 631 143.103 26.683 41.774 1.00 0.00 H ATOM 24386 H16S PA 631 143.821 27.170 40.231 1.00 0.00 H ATOM 24387 H16T PA 631 142.047 27.336 40.487 1.00 0.00 H ATOM 24388 C115 PA 631 143.413 28.791 41.294 1.00 0.00 C ATOM 24389 H15R PA 631 142.899 29.035 42.226 1.00 0.00 H ATOM 24390 H15S PA 631 143.024 29.541 40.602 1.00 0.00 H ATOM 24391 C114 PA 631 144.954 29.047 41.594 1.00 0.00 C ATOM 24392 H14R PA 631 145.468 29.131 40.634 1.00 0.00 H ATOM 24393 H14S PA 631 145.343 28.196 42.156 1.00 0.00 H ATOM 24394 C113 PA 631 145.146 30.270 42.430 1.00 0.00 C ATOM 24395 H13R PA 631 144.535 30.375 43.329 1.00 0.00 H ATOM 24396 H13S PA 631 144.716 31.174 41.993 1.00 0.00 H ATOM 24397 C112 PA 631 146.632 30.664 42.711 1.00 0.00 C ATOM 24398 H12R PA 631 147.086 30.735 41.721 1.00 0.00 H ATOM 24399 H12S PA 631 147.044 29.854 43.318 1.00 0.00 H ATOM 24400 C111 PA 631 146.741 31.991 43.497 1.00 0.00 C ATOM 24401 H11R PA 631 145.980 32.746 43.288 1.00 0.00 H ATOM 24402 H11S PA 631 147.756 32.333 43.280 1.00 0.00 H ATOM 24403 C110 PA 631 146.788 31.848 44.989 1.00 0.00 C ATOM 24404 H10R PA 631 147.594 31.147 45.218 1.00 0.00 H ATOM 24405 H10S PA 631 145.892 31.285 45.260 1.00 0.00 H ATOM 24406 C19 PA 631 146.754 33.121 45.825 1.00 0.00 C ATOM 24407 H9R PA 631 146.907 32.905 46.885 1.00 0.00 H ATOM 24408 H9S PA 631 145.766 33.583 45.881 1.00 0.00 H ATOM 24409 C18 PA 631 147.651 34.144 45.281 1.00 0.00 C ATOM 24410 H8R PA 631 147.636 34.222 44.192 1.00 0.00 H ATOM 24411 H8S PA 631 148.624 33.742 45.568 1.00 0.00 H ATOM 24412 C17 PA 631 147.399 35.528 45.828 1.00 0.00 C ATOM 24413 H7R PA 631 146.395 35.785 45.486 1.00 0.00 H ATOM 24414 H7S PA 631 148.099 36.205 45.334 1.00 0.00 H ATOM 24415 C16 PA 631 147.597 35.680 47.261 1.00 0.00 C ATOM 24416 H6R PA 631 148.647 35.463 47.467 1.00 0.00 H ATOM 24417 H6S PA 631 147.063 34.893 47.797 1.00 0.00 H ATOM 24418 C15 PA 631 147.142 37.020 47.818 1.00 0.00 C ATOM 24419 H5R PA 631 146.185 37.410 47.467 1.00 0.00 H ATOM 24420 H5S PA 631 147.801 37.824 47.483 1.00 0.00 H ATOM 24421 C14 PA 631 146.911 36.944 49.377 1.00 0.00 C ATOM 24422 H4R PA 631 147.862 36.862 49.907 1.00 0.00 H ATOM 24423 H4S PA 631 146.345 36.027 49.551 1.00 0.00 H ATOM 24424 C13 PA 631 146.056 38.057 50.017 1.00 0.00 C ATOM 24425 H3R PA 631 145.021 38.044 49.667 1.00 0.00 H ATOM 24426 H3S PA 631 146.447 39.030 49.711 1.00 0.00 H ATOM 24427 C12 PA 631 146.070 37.956 51.541 1.00 0.00 C ATOM 24428 H2R PA 631 145.451 38.771 51.922 1.00 0.00 H ATOM 24429 H2S PA 631 147.079 38.115 51.928 1.00 0.00 H ATOM 24430 C11 PGR 632 145.499 36.637 51.950 1.00 0.00 C ATOM 24431 O12 PGR 632 146.146 35.898 52.672 1.00 0.00 O ATOM 24432 O11 PGR 632 144.290 36.358 51.370 1.00 0.00 O ATOM 24433 C1 PGR 632 143.635 35.154 51.954 1.00 0.00 C ATOM 24434 HR PGR 632 144.435 34.421 52.088 1.00 0.00 H ATOM 24435 HS PGR 632 142.926 34.807 51.198 1.00 0.00 H ATOM 24436 C2 PGR 632 142.981 35.442 53.300 1.00 0.00 C ATOM 24437 HX PGR 632 143.739 35.821 53.990 1.00 0.00 H ATOM 24438 C3 PGR 632 142.462 34.151 53.902 1.00 0.00 C ATOM 24439 HA PGR 632 143.260 33.434 53.691 1.00 0.00 H ATOM 24440 HB PGR 632 141.520 33.875 53.422 1.00 0.00 H ATOM 24441 O31 PGR 632 142.274 34.454 55.270 1.00 0.00 O ATOM 24442 P31 PGR 632 141.650 33.327 56.232 1.00 0.00 P ATOM 24443 O32 PGR 632 140.123 33.361 55.792 1.00 0.00 O ATOM 24444 C31 PGR 632 139.489 34.667 55.883 1.00 0.00 C ATOM 24445 H1A PGR 632 139.704 35.332 55.043 1.00 0.00 H ATOM 24446 H1B PGR 632 139.906 35.081 56.804 1.00 0.00 H ATOM 24447 C32 PGR 632 137.962 34.582 56.050 1.00 0.00 C ATOM 24448 H2A PGR 632 137.607 35.596 55.849 1.00 0.00 H ATOM 24449 O35 PGR 632 137.560 33.691 55.033 1.00 0.00 O ATOM 24450 HO5A PGR 632 138.300 33.065 55.132 1.00 0.00 H ATOM 24451 C33 PGR 632 137.515 34.020 57.421 1.00 0.00 C ATOM 24452 H3A PGR 632 137.873 32.997 57.566 1.00 0.00 H ATOM 24453 H3B PGR 632 137.843 34.529 58.331 1.00 0.00 H ATOM 24454 O33 PGR 632 142.122 31.964 55.938 1.00 0.00 O ATOM 24455 O34 PGR 632 141.752 33.778 57.634 1.00 0.00 O ATOM 24456 O21 PGR 632 141.808 36.292 53.158 1.00 0.00 O ATOM 24457 C21 PGR 632 141.840 37.584 53.023 1.00 0.00 C ATOM 24458 O22 PGR 632 142.773 38.278 53.259 1.00 0.00 O ATOM 24459 O36 PGR 632 136.141 33.980 57.445 1.00 0.00 O ATOM 24460 HO6A PGR 632 135.878 33.590 56.592 1.00 0.00 H ATOM 24461 C12 OL 633 140.643 38.255 52.418 1.00 0.00 C ATOM 24462 H2R OL 633 139.823 37.720 52.900 1.00 0.00 H ATOM 24463 H2S OL 633 140.516 39.253 52.843 1.00 0.00 H ATOM 24464 C13 OL 633 140.609 38.171 50.898 1.00 0.00 C ATOM 24465 H3R OL 633 141.651 38.124 50.575 1.00 0.00 H ATOM 24466 H3S OL 633 140.305 37.143 50.691 1.00 0.00 H ATOM 24467 C14 OL 633 139.621 39.049 50.197 1.00 0.00 C ATOM 24468 H4R OL 633 138.632 39.099 50.657 1.00 0.00 H ATOM 24469 H4S OL 633 139.924 40.074 49.975 1.00 0.00 H ATOM 24470 C15 OL 633 139.176 38.438 48.834 1.00 0.00 C ATOM 24471 H5R OL 633 140.114 38.325 48.287 1.00 0.00 H ATOM 24472 H5S OL 633 138.854 37.398 48.913 1.00 0.00 H ATOM 24473 C16 OL 633 138.155 39.161 47.980 1.00 0.00 C ATOM 24474 H6R OL 633 137.276 39.239 48.623 1.00 0.00 H ATOM 24475 H6S OL 633 138.481 40.160 47.682 1.00 0.00 H ATOM 24476 C17 OL 633 137.570 38.338 46.793 1.00 0.00 C ATOM 24477 H7R OL 633 137.173 37.397 47.179 1.00 0.00 H ATOM 24478 H7S OL 633 136.745 38.917 46.374 1.00 0.00 H ATOM 24479 C18 OL 633 138.563 37.884 45.785 1.00 0.00 C ATOM 24480 H8R OL 633 139.366 37.389 46.335 1.00 0.00 H ATOM 24481 H8S OL 633 138.097 37.153 45.121 1.00 0.00 H ATOM 24482 C19 OL 633 139.215 39.040 44.916 1.00 0.00 C ATOM 24483 H9R OL 633 139.692 39.820 45.505 1.00 0.00 H ATOM 24484 C110 OL 633 139.154 39.206 43.568 1.00 0.00 C ATOM 24485 H10R OL 633 139.674 40.072 43.167 1.00 0.00 H ATOM 24486 C111 OL 633 138.568 38.288 42.545 1.00 0.00 C ATOM 24487 H11R OL 633 138.822 38.689 41.561 1.00 0.00 H ATOM 24488 H11S OL 633 139.047 37.317 42.683 1.00 0.00 H ATOM 24489 C112 OL 633 137.025 38.164 42.595 1.00 0.00 C ATOM 24490 H12R OL 633 136.761 37.696 43.545 1.00 0.00 H ATOM 24491 H12S OL 633 136.566 39.155 42.587 1.00 0.00 H ATOM 24492 C113 OL 633 136.481 37.256 41.485 1.00 0.00 C ATOM 24493 H13R OL 633 136.802 37.599 40.499 1.00 0.00 H ATOM 24494 H13S OL 633 137.034 36.322 41.608 1.00 0.00 H ATOM 24495 C114 OL 633 134.969 37.036 41.506 1.00 0.00 C ATOM 24496 H14R OL 633 134.700 36.783 42.533 1.00 0.00 H ATOM 24497 H14S OL 633 134.390 37.927 41.255 1.00 0.00 H ATOM 24498 C115 OL 633 134.614 35.884 40.521 1.00 0.00 C ATOM 24499 H15R OL 633 134.958 36.237 39.546 1.00 0.00 H ATOM 24500 H15S OL 633 135.231 35.026 40.795 1.00 0.00 H ATOM 24501 C116 OL 633 133.173 35.465 40.483 1.00 0.00 C ATOM 24502 H16R OL 633 132.636 36.284 39.999 1.00 0.00 H ATOM 24503 H16S OL 633 133.057 34.584 39.849 1.00 0.00 H ATOM 24504 C117 OL 633 132.605 35.182 41.898 1.00 0.00 C ATOM 24505 H17R OL 633 133.162 34.394 42.409 1.00 0.00 H ATOM 24506 H17S OL 633 132.583 36.144 42.413 1.00 0.00 H ATOM 24507 C118 OL 633 131.128 34.712 41.847 1.00 0.00 C ATOM 24508 H18R OL 633 130.424 35.423 41.409 1.00 0.00 H ATOM 24509 H18S OL 633 130.746 34.539 42.855 1.00 0.00 H ATOM 24510 H18T OL 633 131.021 33.765 41.314 1.00 0.00 H TER 24511 OL 633 ATOM 24511 C116 PA 634 125.481 120.720 45.395 1.00 0.00 C ATOM 24512 H16R PA 634 125.380 121.417 44.561 1.00 0.00 H ATOM 24513 H16S PA 634 124.447 120.579 45.715 1.00 0.00 H ATOM 24514 H16T PA 634 125.950 119.880 44.878 1.00 0.00 H ATOM 24515 C115 PA 634 126.345 121.602 46.348 1.00 0.00 C ATOM 24516 H15R PA 634 125.776 122.458 46.717 1.00 0.00 H ATOM 24517 H15S PA 634 127.220 121.988 45.821 1.00 0.00 H ATOM 24518 C114 PA 634 126.871 120.813 47.503 1.00 0.00 C ATOM 24519 H14R PA 634 127.372 119.964 47.034 1.00 0.00 H ATOM 24520 H14S PA 634 126.079 120.426 48.148 1.00 0.00 H ATOM 24521 C113 PA 634 127.881 121.520 48.415 1.00 0.00 C ATOM 24522 H13R PA 634 128.690 121.812 47.742 1.00 0.00 H ATOM 24523 H13S PA 634 128.239 120.847 49.197 1.00 0.00 H ATOM 24524 C112 PA 634 127.411 122.834 48.992 1.00 0.00 C ATOM 24525 H12R PA 634 126.432 122.787 49.473 1.00 0.00 H ATOM 24526 H12S PA 634 127.378 123.584 48.200 1.00 0.00 H ATOM 24527 C111 PA 634 128.303 123.363 50.087 1.00 0.00 C ATOM 24528 H11R PA 634 129.124 123.765 49.490 1.00 0.00 H ATOM 24529 H11S PA 634 128.613 122.566 50.766 1.00 0.00 H ATOM 24530 C110 PA 634 127.713 124.483 50.844 1.00 0.00 C ATOM 24531 H10R PA 634 128.356 124.856 51.644 1.00 0.00 H ATOM 24532 H10S PA 634 126.849 124.058 51.360 1.00 0.00 H ATOM 24533 C19 PA 634 127.267 125.671 49.830 1.00 0.00 C ATOM 24534 H9R PA 634 126.469 125.411 49.131 1.00 0.00 H ATOM 24535 H9S PA 634 128.126 125.996 49.240 1.00 0.00 H ATOM 24536 C18 PA 634 126.784 126.869 50.671 1.00 0.00 C ATOM 24537 H8R PA 634 127.390 126.872 51.579 1.00 0.00 H ATOM 24538 H8S PA 634 125.814 126.636 51.116 1.00 0.00 H ATOM 24539 C17 PA 634 126.745 128.199 49.908 1.00 0.00 C ATOM 24540 H7R PA 634 125.850 128.729 50.240 1.00 0.00 H ATOM 24541 H7S PA 634 126.634 128.185 48.822 1.00 0.00 H ATOM 24542 C16 PA 634 127.995 129.053 50.196 1.00 0.00 C ATOM 24543 H6R PA 634 127.902 129.927 49.548 1.00 0.00 H ATOM 24544 H6S PA 634 128.821 128.433 49.841 1.00 0.00 H ATOM 24545 C15 PA 634 128.068 129.610 51.661 1.00 0.00 C ATOM 24546 H5R PA 634 128.468 128.871 52.358 1.00 0.00 H ATOM 24547 H5S PA 634 127.039 129.871 51.917 1.00 0.00 H ATOM 24548 C14 PA 634 129.154 130.768 51.751 1.00 0.00 C ATOM 24549 H4R PA 634 129.141 131.525 50.964 1.00 0.00 H ATOM 24550 H4S PA 634 130.114 130.262 51.626 1.00 0.00 H ATOM 24551 C13 PA 634 129.141 131.442 53.145 1.00 0.00 C ATOM 24552 H3R PA 634 129.965 132.159 53.149 1.00 0.00 H ATOM 24553 H3S PA 634 129.122 130.740 53.982 1.00 0.00 H ATOM 24554 C12 PA 634 127.818 132.148 53.400 1.00 0.00 C ATOM 24555 H2R PA 634 127.063 131.386 53.607 1.00 0.00 H ATOM 24556 H2S PA 634 127.409 132.713 52.560 1.00 0.00 H ATOM 24557 C11 PGR 635 127.845 133.014 54.653 1.00 0.00 C ATOM 24558 O12 PGR 635 128.848 133.222 55.343 1.00 0.00 O ATOM 24559 O11 PGR 635 126.571 133.515 54.859 1.00 0.00 O ATOM 24560 C1 PGR 635 126.402 134.255 56.121 1.00 0.00 C ATOM 24561 HR PGR 635 126.617 133.603 56.971 1.00 0.00 H ATOM 24562 HS PGR 635 125.341 134.512 56.065 1.00 0.00 H ATOM 24563 C2 PGR 635 127.162 135.601 56.150 1.00 0.00 C ATOM 24564 HX PGR 635 128.209 135.528 55.843 1.00 0.00 H ATOM 24565 C3 PGR 635 127.117 136.249 57.522 1.00 0.00 C ATOM 24566 HA PGR 635 127.622 137.217 57.481 1.00 0.00 H ATOM 24567 HB PGR 635 127.602 135.643 58.292 1.00 0.00 H ATOM 24568 O31 PGR 635 125.730 136.375 57.875 1.00 0.00 O ATOM 24569 P31 PGR 635 125.256 137.001 59.203 1.00 0.00 P ATOM 24570 O32 PGR 635 125.865 138.503 59.170 1.00 0.00 O ATOM 24571 C31 PGR 635 125.324 139.483 58.192 1.00 0.00 C ATOM 24572 H1A PGR 635 124.300 139.762 58.455 1.00 0.00 H ATOM 24573 H1B PGR 635 125.273 139.083 57.176 1.00 0.00 H ATOM 24574 C32 PGR 635 126.212 140.732 58.124 1.00 0.00 C ATOM 24575 H2A PGR 635 125.836 141.473 57.414 1.00 0.00 H ATOM 24576 O35 PGR 635 127.567 140.435 57.620 1.00 0.00 O ATOM 24577 HO5A PGR 635 128.007 139.785 58.197 1.00 0.00 H ATOM 24578 C33 PGR 635 126.430 141.396 59.512 1.00 0.00 C ATOM 24579 H3A PGR 635 126.996 142.326 59.420 1.00 0.00 H ATOM 24580 H3B PGR 635 125.464 141.786 59.843 1.00 0.00 H ATOM 24581 O33 PGR 635 123.791 136.982 59.120 1.00 0.00 O ATOM 24582 O34 PGR 635 125.968 136.409 60.377 1.00 0.00 O ATOM 24583 O21 PGR 635 126.522 136.474 55.163 1.00 0.00 O ATOM 24584 C21 PGR 635 127.063 136.664 53.972 1.00 0.00 C ATOM 24585 O22 PGR 635 128.025 136.076 53.516 1.00 0.00 O ATOM 24586 O36 PGR 635 127.141 140.511 60.476 1.00 0.00 O ATOM 24587 HO6A PGR 635 126.612 139.695 60.419 1.00 0.00 H ATOM 24588 C12 OL 636 126.364 137.693 53.147 1.00 0.00 C ATOM 24589 H2R OL 636 126.213 138.555 53.799 1.00 0.00 H ATOM 24590 H2S OL 636 126.919 137.937 52.238 1.00 0.00 H ATOM 24591 C13 OL 636 124.961 137.158 52.855 1.00 0.00 C ATOM 24592 H3R OL 636 124.980 136.207 52.318 1.00 0.00 H ATOM 24593 H3S OL 636 124.501 137.041 53.839 1.00 0.00 H ATOM 24594 C14 OL 636 124.255 138.186 51.961 1.00 0.00 C ATOM 24595 H4R OL 636 124.344 139.066 52.601 1.00 0.00 H ATOM 24596 H4S OL 636 124.778 138.442 51.037 1.00 0.00 H ATOM 24597 C15 OL 636 122.868 137.692 51.742 1.00 0.00 C ATOM 24598 H5R OL 636 122.758 136.749 51.201 1.00 0.00 H ATOM 24599 H5S OL 636 122.319 137.658 52.685 1.00 0.00 H ATOM 24600 C16 OL 636 122.220 138.723 50.830 1.00 0.00 C ATOM 24601 H6R OL 636 122.666 139.665 51.158 1.00 0.00 H ATOM 24602 H6S OL 636 122.648 138.500 49.850 1.00 0.00 H ATOM 24603 C17 OL 636 120.700 138.767 50.772 1.00 0.00 C ATOM 24604 H7R OL 636 120.278 137.943 50.192 1.00 0.00 H ATOM 24605 H7S OL 636 120.262 138.542 51.746 1.00 0.00 H ATOM 24606 C18 OL 636 120.108 140.006 50.026 1.00 0.00 C ATOM 24607 H8R OL 636 119.023 139.926 50.116 1.00 0.00 H ATOM 24608 H8S OL 636 120.490 140.892 50.537 1.00 0.00 H ATOM 24609 C19 OL 636 120.487 140.120 48.527 1.00 0.00 C ATOM 24610 H9R OL 636 121.540 140.357 48.401 1.00 0.00 H ATOM 24611 C110 OL 636 119.758 139.983 47.443 1.00 0.00 C ATOM 24612 H10R OL 636 120.137 140.191 46.446 1.00 0.00 H ATOM 24613 C111 OL 636 118.270 139.699 47.522 1.00 0.00 C ATOM 24614 H11R OL 636 117.964 139.014 48.316 1.00 0.00 H ATOM 24615 H11S OL 636 117.585 140.545 47.441 1.00 0.00 H ATOM 24616 C112 OL 636 118.005 138.794 46.376 1.00 0.00 C ATOM 24617 H12R OL 636 116.957 138.948 46.112 1.00 0.00 H ATOM 24618 H12S OL 636 118.626 139.184 45.567 1.00 0.00 H ATOM 24619 C113 OL 636 118.336 137.288 46.500 1.00 0.00 C ATOM 24620 H13R OL 636 119.397 137.208 46.744 1.00 0.00 H ATOM 24621 H13S OL 636 117.825 136.936 47.399 1.00 0.00 H ATOM 24622 C114 OL 636 117.924 136.525 45.255 1.00 0.00 C ATOM 24623 H14R OL 636 116.925 136.890 45.008 1.00 0.00 H ATOM 24624 H14S OL 636 118.526 136.890 44.419 1.00 0.00 H ATOM 24625 C115 OL 636 117.973 135.047 45.381 1.00 0.00 C ATOM 24626 H15R OL 636 118.818 134.714 45.988 1.00 0.00 H ATOM 24627 H15S OL 636 117.049 134.738 45.873 1.00 0.00 H ATOM 24628 C116 OL 636 118.069 134.351 43.969 1.00 0.00 C ATOM 24629 H16R OL 636 117.079 134.431 43.516 1.00 0.00 H ATOM 24630 H16S OL 636 118.785 134.864 43.323 1.00 0.00 H ATOM 24631 C117 OL 636 118.341 132.910 44.082 1.00 0.00 C ATOM 24632 H17R OL 636 119.265 132.864 44.662 1.00 0.00 H ATOM 24633 H17S OL 636 117.491 132.455 44.596 1.00 0.00 H ATOM 24634 C118 OL 636 118.627 132.268 42.705 1.00 0.00 C ATOM 24635 H18R OL 636 119.184 132.904 42.014 1.00 0.00 H ATOM 24636 H18S OL 636 117.688 131.961 42.240 1.00 0.00 H ATOM 24637 H18T OL 636 119.190 131.345 42.861 1.00 0.00 H TER 24638 OL 636 ATOM 24638 C116 PA 637 20.615 142.724 34.385 1.00 0.00 C ATOM 24639 H16R PA 637 19.704 142.938 34.948 1.00 0.00 H ATOM 24640 H16S PA 637 20.276 142.121 33.540 1.00 0.00 H ATOM 24641 H16T PA 637 21.110 143.631 34.032 1.00 0.00 H ATOM 24642 C115 PA 637 21.559 141.838 35.115 1.00 0.00 C ATOM 24643 H15R PA 637 22.328 141.554 34.395 1.00 0.00 H ATOM 24644 H15S PA 637 20.988 140.974 35.460 1.00 0.00 H ATOM 24645 C114 PA 637 22.367 142.540 36.261 1.00 0.00 C ATOM 24646 H14R PA 637 21.657 142.927 36.995 1.00 0.00 H ATOM 24647 H14S PA 637 22.911 143.396 35.856 1.00 0.00 H ATOM 24648 C113 PA 637 23.471 141.738 36.919 1.00 0.00 C ATOM 24649 H13R PA 637 24.388 141.690 36.328 1.00 0.00 H ATOM 24650 H13S PA 637 22.989 140.759 36.940 1.00 0.00 H ATOM 24651 C112 PA 637 23.883 142.346 38.297 1.00 0.00 C ATOM 24652 H12R PA 637 22.995 142.404 38.930 1.00 0.00 H ATOM 24653 H12S PA 637 24.294 143.351 38.176 1.00 0.00 H ATOM 24654 C111 PA 637 24.983 141.440 39.052 1.00 0.00 C ATOM 24655 H11R PA 637 25.725 141.021 38.369 1.00 0.00 H ATOM 24656 H11S PA 637 24.448 140.534 39.344 1.00 0.00 H ATOM 24657 C110 PA 637 25.633 142.088 40.295 1.00 0.00 C ATOM 24658 H10R PA 637 24.766 142.427 40.866 1.00 0.00 H ATOM 24659 H10S PA 637 26.187 142.993 40.038 1.00 0.00 H ATOM 24660 C19 PA 637 26.446 141.283 41.292 1.00 0.00 C ATOM 24661 H9R PA 637 27.415 140.980 40.889 1.00 0.00 H ATOM 24662 H9S PA 637 25.958 140.327 41.492 1.00 0.00 H ATOM 24663 C18 PA 637 26.546 141.945 42.724 1.00 0.00 C ATOM 24664 H8R PA 637 26.849 142.993 42.693 1.00 0.00 H ATOM 24665 H8S PA 637 27.289 141.402 43.312 1.00 0.00 H ATOM 24666 C17 PA 637 25.257 141.872 43.489 1.00 0.00 C ATOM 24667 H7R PA 637 25.114 140.811 43.704 1.00 0.00 H ATOM 24668 H7S PA 637 24.356 142.252 43.004 1.00 0.00 H ATOM 24669 C16 PA 637 25.373 142.645 44.832 1.00 0.00 C ATOM 24670 H6R PA 637 25.698 143.660 44.596 1.00 0.00 H ATOM 24671 H6S PA 637 26.239 142.284 45.392 1.00 0.00 H ATOM 24672 C15 PA 637 24.179 142.488 45.634 1.00 0.00 C ATOM 24673 H5R PA 637 24.057 141.438 45.907 1.00 0.00 H ATOM 24674 H5S PA 637 23.340 142.938 45.099 1.00 0.00 H ATOM 24675 C14 PA 637 24.223 143.317 46.919 1.00 0.00 C ATOM 24676 H4R PA 637 25.156 143.118 47.450 1.00 0.00 H ATOM 24677 H4S PA 637 23.463 142.949 47.611 1.00 0.00 H ATOM 24678 C13 PA 637 24.043 144.851 46.668 1.00 0.00 C ATOM 24679 H3R PA 637 23.209 145.095 46.007 1.00 0.00 H ATOM 24680 H3S PA 637 24.969 145.135 46.165 1.00 0.00 H ATOM 24681 C12 PA 637 23.747 145.563 47.959 1.00 0.00 C ATOM 24682 H2R PA 637 22.824 145.213 48.426 1.00 0.00 H ATOM 24683 H2S PA 637 23.525 146.625 47.842 1.00 0.00 H ATOM 24684 C11 PGR 638 24.975 145.599 48.908 1.00 0.00 C ATOM 24685 O12 PGR 638 24.963 145.112 50.003 1.00 0.00 O ATOM 24686 O11 PGR 638 26.110 146.157 48.421 1.00 0.00 O ATOM 24687 C1 PGR 638 27.183 146.218 49.327 1.00 0.00 C ATOM 24688 HR PGR 638 26.839 146.508 50.323 1.00 0.00 H ATOM 24689 HS PGR 638 27.875 146.982 48.963 1.00 0.00 H ATOM 24690 C2 PGR 638 27.905 144.859 49.455 1.00 0.00 C ATOM 24691 HX PGR 638 27.256 143.993 49.609 1.00 0.00 H ATOM 24692 C3 PGR 638 28.879 144.897 50.576 1.00 0.00 C ATOM 24693 HA PGR 638 28.462 145.294 51.505 1.00 0.00 H ATOM 24694 HB PGR 638 29.722 145.521 50.269 1.00 0.00 H ATOM 24695 O31 PGR 638 29.489 143.612 50.786 1.00 0.00 O ATOM 24696 P31 PGR 638 30.412 143.287 52.106 1.00 0.00 P ATOM 24697 O32 PGR 638 31.667 144.183 51.791 1.00 0.00 O ATOM 24698 C31 PGR 638 32.747 143.905 50.866 1.00 0.00 C ATOM 24699 H1A PGR 638 33.215 142.943 51.090 1.00 0.00 H ATOM 24700 H1B PGR 638 33.470 144.724 50.879 1.00 0.00 H ATOM 24701 C32 PGR 638 32.245 143.799 49.458 1.00 0.00 C ATOM 24702 H2A PGR 638 31.432 144.512 49.298 1.00 0.00 H ATOM 24703 O35 PGR 638 31.632 142.534 49.257 1.00 0.00 O ATOM 24704 HO5A PGR 638 30.844 142.564 49.829 1.00 0.00 H ATOM 24705 C33 PGR 638 33.269 144.069 48.378 1.00 0.00 C ATOM 24706 H3A PGR 638 32.806 143.969 47.393 1.00 0.00 H ATOM 24707 H3B PGR 638 33.622 145.087 48.560 1.00 0.00 H ATOM 24708 O33 PGR 638 29.699 143.778 53.260 1.00 0.00 O ATOM 24709 O34 PGR 638 30.793 141.849 52.051 1.00 0.00 O ATOM 24710 O21 PGR 638 28.665 144.713 48.230 1.00 0.00 O ATOM 24711 C21 PGR 638 28.929 143.477 47.795 1.00 0.00 C ATOM 24712 O22 PGR 638 28.567 142.441 48.267 1.00 0.00 O ATOM 24713 O36 PGR 638 34.338 143.176 48.579 1.00 0.00 O ATOM 24714 HO6A PGR 638 34.089 142.287 48.269 1.00 0.00 H ATOM 24715 C12 OL 639 29.755 143.518 46.550 1.00 0.00 C ATOM 24716 H2R OL 639 29.870 144.595 46.406 1.00 0.00 H ATOM 24717 H2S OL 639 30.791 143.195 46.672 1.00 0.00 H ATOM 24718 C13 OL 639 29.112 142.882 45.313 1.00 0.00 C ATOM 24719 H3R OL 639 28.282 142.214 45.550 1.00 0.00 H ATOM 24720 H3S OL 639 28.554 143.702 44.856 1.00 0.00 H ATOM 24721 C14 OL 639 30.132 142.319 44.341 1.00 0.00 C ATOM 24722 H4R OL 639 29.531 141.735 43.641 1.00 0.00 H ATOM 24723 H4S OL 639 30.587 143.192 43.868 1.00 0.00 H ATOM 24724 C15 OL 639 31.284 141.400 44.850 1.00 0.00 C ATOM 24725 H5R OL 639 31.962 141.868 45.566 1.00 0.00 H ATOM 24726 H5S OL 639 30.825 140.511 45.289 1.00 0.00 H ATOM 24727 C16 OL 639 31.961 140.873 43.621 1.00 0.00 C ATOM 24728 H6R OL 639 31.274 140.898 42.773 1.00 0.00 H ATOM 24729 H6S OL 639 32.835 141.523 43.540 1.00 0.00 H ATOM 24730 C17 OL 639 32.591 139.460 43.700 1.00 0.00 C ATOM 24731 H7R OL 639 33.270 139.412 44.554 1.00 0.00 H ATOM 24732 H7S OL 639 31.838 138.722 43.984 1.00 0.00 H ATOM 24733 C18 OL 639 33.422 139.134 42.466 1.00 0.00 C ATOM 24734 H8R OL 639 33.485 138.053 42.328 1.00 0.00 H ATOM 24735 H8S OL 639 32.869 139.591 41.643 1.00 0.00 H ATOM 24736 C19 OL 639 34.870 139.582 42.322 1.00 0.00 C ATOM 24737 H9R OL 639 35.450 139.444 43.232 1.00 0.00 H ATOM 24738 C110 OL 639 35.577 140.011 41.241 1.00 0.00 C ATOM 24739 H10R OL 639 36.624 140.270 41.378 1.00 0.00 H ATOM 24740 C111 OL 639 35.117 140.157 39.836 1.00 0.00 C ATOM 24741 H11R OL 639 34.297 139.443 39.731 1.00 0.00 H ATOM 24742 H11S OL 639 34.642 141.138 39.763 1.00 0.00 H ATOM 24743 C112 OL 639 36.263 139.882 38.794 1.00 0.00 C ATOM 24744 H12R OL 639 36.711 138.886 38.776 1.00 0.00 H ATOM 24745 H12S OL 639 35.743 139.929 37.835 1.00 0.00 H ATOM 24746 C113 OL 639 37.508 140.859 38.708 1.00 0.00 C ATOM 24747 H13R OL 639 37.206 141.861 38.394 1.00 0.00 H ATOM 24748 H13S OL 639 37.985 141.075 39.666 1.00 0.00 H ATOM 24749 C114 OL 639 38.619 140.406 37.803 1.00 0.00 C ATOM 24750 H14R OL 639 39.307 141.238 37.637 1.00 0.00 H ATOM 24751 H14S OL 639 39.236 139.703 38.366 1.00 0.00 H ATOM 24752 C115 OL 639 38.201 139.843 36.469 1.00 0.00 C ATOM 24753 H15R OL 639 39.133 139.392 36.125 1.00 0.00 H ATOM 24754 H15S OL 639 37.521 138.993 36.564 1.00 0.00 H ATOM 24755 C116 OL 639 37.589 140.778 35.523 1.00 0.00 C ATOM 24756 H16R OL 639 36.633 141.139 35.907 1.00 0.00 H ATOM 24757 H16S OL 639 38.143 141.700 35.338 1.00 0.00 H ATOM 24758 C117 OL 639 37.441 140.146 34.142 1.00 0.00 C ATOM 24759 H17R OL 639 37.472 140.944 33.397 1.00 0.00 H ATOM 24760 H17S OL 639 38.230 139.464 33.817 1.00 0.00 H ATOM 24761 C118 OL 639 36.201 139.321 34.160 1.00 0.00 C ATOM 24762 H18R OL 639 36.222 138.550 34.933 1.00 0.00 H ATOM 24763 H18S OL 639 35.938 139.010 33.147 1.00 0.00 H ATOM 24764 H18T OL 639 35.392 139.969 34.503 1.00 0.00 H TER 24765 OL 639 ATOM 24765 C116 PA 640 3.852 96.032 37.339 1.00 0.00 C ATOM 24766 H16R PA 640 4.472 96.215 36.459 1.00 0.00 H ATOM 24767 H16S PA 640 3.192 96.853 37.627 1.00 0.00 H ATOM 24768 H16T PA 640 3.197 95.182 37.136 1.00 0.00 H ATOM 24769 C115 PA 640 4.734 95.586 38.438 1.00 0.00 C ATOM 24770 H15R PA 640 5.213 94.660 38.113 1.00 0.00 H ATOM 24771 H15S PA 640 4.033 95.243 39.202 1.00 0.00 H ATOM 24772 C114 PA 640 5.734 96.583 38.957 1.00 0.00 C ATOM 24773 H14R PA 640 5.083 97.259 39.515 1.00 0.00 H ATOM 24774 H14S PA 640 6.112 97.189 38.131 1.00 0.00 H ATOM 24775 C113 PA 640 6.947 95.929 39.710 1.00 0.00 C ATOM 24776 H13R PA 640 7.712 95.745 38.953 1.00 0.00 H ATOM 24777 H13S PA 640 6.578 94.975 40.093 1.00 0.00 H ATOM 24778 C112 PA 640 7.645 96.807 40.765 1.00 0.00 C ATOM 24779 H12R PA 640 7.019 96.934 41.651 1.00 0.00 H ATOM 24780 H12S PA 640 7.711 97.800 40.316 1.00 0.00 H ATOM 24781 C111 PA 640 9.017 96.253 41.189 1.00 0.00 C ATOM 24782 H11R PA 640 9.590 96.431 40.277 1.00 0.00 H ATOM 24783 H11S PA 640 8.965 95.182 41.395 1.00 0.00 H ATOM 24784 C110 PA 640 9.654 97.100 42.320 1.00 0.00 C ATOM 24785 H10R PA 640 8.914 96.994 43.116 1.00 0.00 H ATOM 24786 H10S PA 640 9.727 98.164 42.088 1.00 0.00 H ATOM 24787 C19 PA 640 11.072 96.767 42.780 1.00 0.00 C ATOM 24788 H9R PA 640 11.706 96.774 41.891 1.00 0.00 H ATOM 24789 H9S PA 640 11.129 95.751 43.176 1.00 0.00 H ATOM 24790 C18 PA 640 11.639 97.804 43.790 1.00 0.00 C ATOM 24791 H8R PA 640 10.942 97.964 44.615 1.00 0.00 H ATOM 24792 H8S PA 640 11.606 98.777 43.297 1.00 0.00 H ATOM 24793 C17 PA 640 13.080 97.516 44.218 1.00 0.00 C ATOM 24794 H7R PA 640 13.708 97.291 43.353 1.00 0.00 H ATOM 24795 H7S PA 640 13.094 96.615 44.834 1.00 0.00 H ATOM 24796 C16 PA 640 13.692 98.624 45.061 1.00 0.00 C ATOM 24797 H6R PA 640 13.608 99.525 44.449 1.00 0.00 H ATOM 24798 H6S PA 640 14.772 98.485 45.140 1.00 0.00 H ATOM 24799 C15 PA 640 13.274 98.823 46.495 1.00 0.00 C ATOM 24800 H5R PA 640 12.267 99.240 46.565 1.00 0.00 H ATOM 24801 H5S PA 640 13.739 99.739 46.863 1.00 0.00 H ATOM 24802 C14 PA 640 13.422 97.633 47.440 1.00 0.00 C ATOM 24803 H4R PA 640 14.381 97.112 47.457 1.00 0.00 H ATOM 24804 H4S PA 640 12.651 96.929 47.119 1.00 0.00 H ATOM 24805 C13 PA 640 13.213 98.134 48.886 1.00 0.00 C ATOM 24806 H3R PA 640 12.229 98.574 49.058 1.00 0.00 H ATOM 24807 H3S PA 640 13.918 98.958 49.016 1.00 0.00 H ATOM 24808 C12 PA 640 13.513 97.117 49.981 1.00 0.00 C ATOM 24809 H2R PA 640 12.725 96.390 50.186 1.00 0.00 H ATOM 24810 H2S PA 640 14.383 96.464 49.892 1.00 0.00 H ATOM 24811 C11 PGR 641 13.712 97.840 51.277 1.00 0.00 C ATOM 24812 O12 PGR 641 13.440 99.021 51.490 1.00 0.00 O ATOM 24813 O11 PGR 641 14.256 97.002 52.213 1.00 0.00 O ATOM 24814 C1 PGR 641 14.498 97.490 53.573 1.00 0.00 C ATOM 24815 HR PGR 641 13.583 97.309 54.143 1.00 0.00 H ATOM 24816 HS PGR 641 14.822 98.534 53.555 1.00 0.00 H ATOM 24817 C2 PGR 641 15.708 96.697 54.216 1.00 0.00 C ATOM 24818 HX PGR 641 15.885 95.721 53.758 1.00 0.00 H ATOM 24819 C3 PGR 641 15.475 96.536 55.722 1.00 0.00 C ATOM 24820 HA PGR 641 16.417 96.242 56.193 1.00 0.00 H ATOM 24821 HB PGR 641 14.678 95.866 56.054 1.00 0.00 H ATOM 24822 O31 PGR 641 15.280 97.890 56.198 1.00 0.00 O ATOM 24823 P31 PGR 641 15.082 98.332 57.803 1.00 0.00 P ATOM 24824 O32 PGR 641 13.708 97.624 58.215 1.00 0.00 O ATOM 24825 C31 PGR 641 13.591 96.370 58.796 1.00 0.00 C ATOM 24826 H1A PGR 641 14.292 96.262 59.628 1.00 0.00 H ATOM 24827 H1B PGR 641 14.013 95.673 58.067 1.00 0.00 H ATOM 24828 C32 PGR 641 12.128 96.059 59.201 1.00 0.00 C ATOM 24829 H2A PGR 641 11.534 96.060 58.283 1.00 0.00 H ATOM 24830 O35 PGR 641 11.557 97.075 60.107 1.00 0.00 O ATOM 24831 HO5A PGR 641 10.676 97.262 59.734 1.00 0.00 H ATOM 24832 C33 PGR 641 12.051 94.723 59.878 1.00 0.00 C ATOM 24833 H3A PGR 641 12.470 93.960 59.217 1.00 0.00 H ATOM 24834 H3B PGR 641 12.615 94.753 60.814 1.00 0.00 H ATOM 24835 O33 PGR 641 16.154 97.774 58.660 1.00 0.00 O ATOM 24836 O34 PGR 641 14.876 99.778 57.713 1.00 0.00 O ATOM 24837 O21 PGR 641 16.968 97.440 54.075 1.00 0.00 O ATOM 24838 C21 PGR 641 18.136 96.794 54.465 1.00 0.00 C ATOM 24839 O22 PGR 641 18.181 95.729 55.012 1.00 0.00 O ATOM 24840 O36 PGR 641 10.710 94.392 60.231 1.00 0.00 O ATOM 24841 HO6A PGR 641 10.435 95.138 60.793 1.00 0.00 H ATOM 24842 C12 OL 642 19.372 97.573 54.162 1.00 0.00 C ATOM 24843 H2R OL 642 19.324 98.234 53.294 1.00 0.00 H ATOM 24844 H2S OL 642 19.495 98.194 55.051 1.00 0.00 H ATOM 24845 C13 OL 642 20.582 96.754 54.212 1.00 0.00 C ATOM 24846 H3R OL 642 21.428 97.432 54.078 1.00 0.00 H ATOM 24847 H3S OL 642 20.668 96.300 55.202 1.00 0.00 H ATOM 24848 C14 OL 642 20.709 95.508 53.318 1.00 0.00 C ATOM 24849 H4R OL 642 19.993 94.689 53.410 1.00 0.00 H ATOM 24850 H4S OL 642 20.514 95.924 52.327 1.00 0.00 H ATOM 24851 C15 OL 642 22.155 94.954 53.289 1.00 0.00 C ATOM 24852 H5R OL 642 22.876 95.755 53.114 1.00 0.00 H ATOM 24853 H5S OL 642 22.403 94.667 54.313 1.00 0.00 H ATOM 24854 C16 OL 642 22.406 93.757 52.452 1.00 0.00 C ATOM 24855 H6R OL 642 23.322 93.281 52.809 1.00 0.00 H ATOM 24856 H6S OL 642 21.622 93.035 52.689 1.00 0.00 H ATOM 24857 C17 OL 642 22.484 94.022 50.983 1.00 0.00 C ATOM 24858 H7R OL 642 21.522 94.372 50.603 1.00 0.00 H ATOM 24859 H7S OL 642 23.238 94.782 50.766 1.00 0.00 H ATOM 24860 C18 OL 642 22.656 92.730 50.189 1.00 0.00 C ATOM 24861 H8R OL 642 23.443 92.773 49.433 1.00 0.00 H ATOM 24862 H8S OL 642 22.997 91.974 50.899 1.00 0.00 H ATOM 24863 C19 OL 642 21.400 92.135 49.620 1.00 0.00 C ATOM 24864 H9R OL 642 20.967 91.321 50.195 1.00 0.00 H ATOM 24865 C110 OL 642 20.770 92.523 48.506 1.00 0.00 C ATOM 24866 H10R OL 642 19.860 92.037 48.164 1.00 0.00 H ATOM 24867 C111 OL 642 21.221 93.618 47.654 1.00 0.00 C ATOM 24868 H11R OL 642 20.385 94.240 47.329 1.00 0.00 H ATOM 24869 H11S OL 642 21.891 94.225 48.266 1.00 0.00 H ATOM 24870 C112 OL 642 21.935 93.107 46.423 1.00 0.00 C ATOM 24871 H12R OL 642 22.782 92.441 46.595 1.00 0.00 H ATOM 24872 H12S OL 642 21.303 92.421 45.855 1.00 0.00 H ATOM 24873 C113 OL 642 22.394 94.278 45.579 1.00 0.00 C ATOM 24874 H13R OL 642 21.486 94.850 45.376 1.00 0.00 H ATOM 24875 H13S OL 642 22.963 94.919 46.254 1.00 0.00 H ATOM 24876 C114 OL 642 23.151 93.978 44.270 1.00 0.00 C ATOM 24877 H14R OL 642 22.471 93.430 43.614 1.00 0.00 H ATOM 24878 H14S OL 642 23.280 94.987 43.872 1.00 0.00 H ATOM 24879 C115 OL 642 24.399 93.104 44.339 1.00 0.00 C ATOM 24880 H15R OL 642 25.091 93.534 45.066 1.00 0.00 H ATOM 24881 H15S OL 642 24.153 92.116 44.733 1.00 0.00 H ATOM 24882 C116 OL 642 25.100 92.929 42.947 1.00 0.00 C ATOM 24883 H16R OL 642 24.301 92.565 42.298 1.00 0.00 H ATOM 24884 H16S OL 642 25.390 93.869 42.473 1.00 0.00 H ATOM 24885 C117 OL 642 26.219 91.907 42.772 1.00 0.00 C ATOM 24886 H17R OL 642 25.771 90.920 42.899 1.00 0.00 H ATOM 24887 H17S OL 642 26.521 91.914 41.723 1.00 0.00 H ATOM 24888 C118 OL 642 27.480 92.119 43.537 1.00 0.00 C ATOM 24889 H18R OL 642 27.398 92.295 44.612 1.00 0.00 H ATOM 24890 H18S OL 642 28.047 92.914 43.048 1.00 0.00 H ATOM 24891 H18T OL 642 28.159 91.276 43.390 1.00 0.00 H TER 24892 OL 642 ATOM 24892 C116 PA 643 9.346 106.901 41.923 1.00 0.00 C ATOM 24893 H16R PA 643 9.430 106.918 40.834 1.00 0.00 H ATOM 24894 H16S PA 643 9.964 107.705 42.328 1.00 0.00 H ATOM 24895 H16T PA 643 8.336 107.249 42.150 1.00 0.00 H ATOM 24896 C115 PA 643 9.477 105.441 42.507 1.00 0.00 C ATOM 24897 H15R PA 643 8.830 104.879 41.831 1.00 0.00 H ATOM 24898 H15S PA 643 9.114 105.448 43.537 1.00 0.00 H ATOM 24899 C114 PA 643 10.943 104.958 42.442 1.00 0.00 C ATOM 24900 H14R PA 643 11.485 105.399 43.280 1.00 0.00 H ATOM 24901 H14S PA 643 11.419 105.390 41.559 1.00 0.00 H ATOM 24902 C113 PA 643 11.085 103.414 42.512 1.00 0.00 C ATOM 24903 H13R PA 643 12.120 103.067 42.543 1.00 0.00 H ATOM 24904 H13S PA 643 10.713 103.031 41.560 1.00 0.00 H ATOM 24905 C112 PA 643 10.497 102.700 43.692 1.00 0.00 C ATOM 24906 H12R PA 643 10.487 101.635 43.450 1.00 0.00 H ATOM 24907 H12S PA 643 9.437 102.963 43.708 1.00 0.00 H ATOM 24908 C111 PA 643 11.119 102.875 45.095 1.00 0.00 C ATOM 24909 H11R PA 643 10.993 103.919 45.387 1.00 0.00 H ATOM 24910 H11S PA 643 12.157 102.545 45.170 1.00 0.00 H ATOM 24911 C110 PA 643 10.394 101.941 46.120 1.00 0.00 C ATOM 24912 H10R PA 643 10.663 100.885 46.045 1.00 0.00 H ATOM 24913 H10S PA 643 9.333 101.876 45.870 1.00 0.00 H ATOM 24914 C19 PA 643 10.417 102.473 47.492 1.00 0.00 C ATOM 24915 H9R PA 643 10.163 103.535 47.519 1.00 0.00 H ATOM 24916 H9S PA 643 11.479 102.534 47.738 1.00 0.00 H ATOM 24917 C18 PA 643 9.588 101.703 48.535 1.00 0.00 C ATOM 24918 H8R PA 643 9.438 100.642 48.325 1.00 0.00 H ATOM 24919 H8S PA 643 8.522 101.938 48.558 1.00 0.00 H ATOM 24920 C17 PA 643 10.119 102.038 49.939 1.00 0.00 C ATOM 24921 H7R PA 643 11.141 102.422 49.969 1.00 0.00 H ATOM 24922 H7S PA 643 10.003 101.159 50.577 1.00 0.00 H ATOM 24923 C16 PA 643 9.295 103.159 50.610 1.00 0.00 C ATOM 24924 H6R PA 643 8.253 102.839 50.542 1.00 0.00 H ATOM 24925 H6S PA 643 9.435 104.040 49.980 1.00 0.00 H ATOM 24926 C15 PA 643 9.733 103.647 51.979 1.00 0.00 C ATOM 24927 H5R PA 643 10.796 103.885 51.900 1.00 0.00 H ATOM 24928 H5S PA 643 9.604 102.832 52.694 1.00 0.00 H ATOM 24929 C14 PA 643 8.990 104.883 52.484 1.00 0.00 C ATOM 24930 H4R PA 643 7.909 104.726 52.476 1.00 0.00 H ATOM 24931 H4S PA 643 9.135 105.663 51.733 1.00 0.00 H ATOM 24932 C13 PA 643 9.363 105.286 53.833 1.00 0.00 C ATOM 24933 H3R PA 643 9.496 104.389 54.442 1.00 0.00 H ATOM 24934 H3S PA 643 8.528 105.770 54.343 1.00 0.00 H ATOM 24935 C12 PA 643 10.680 105.989 53.893 1.00 0.00 C ATOM 24936 H2R PA 643 10.552 106.816 53.190 1.00 0.00 H ATOM 24937 H2S PA 643 11.541 105.392 53.587 1.00 0.00 H ATOM 24938 C11 PGR 644 10.886 106.416 55.367 1.00 0.00 C ATOM 24939 O12 PGR 644 10.633 105.706 56.328 1.00 0.00 O ATOM 24940 O11 PGR 644 11.502 107.633 55.433 1.00 0.00 O ATOM 24941 C1 PGR 644 11.898 108.195 56.770 1.00 0.00 C ATOM 24942 HR PGR 644 11.112 108.205 57.528 1.00 0.00 H ATOM 24943 HS PGR 644 12.064 109.258 56.578 1.00 0.00 H ATOM 24944 C2 PGR 644 13.226 107.564 57.266 1.00 0.00 C ATOM 24945 HX PGR 644 13.049 106.492 57.384 1.00 0.00 H ATOM 24946 C3 PGR 644 13.543 108.200 58.643 1.00 0.00 C ATOM 24947 HA PGR 644 14.563 108.061 59.009 1.00 0.00 H ATOM 24948 HB PGR 644 12.954 107.625 59.362 1.00 0.00 H ATOM 24949 O31 PGR 644 13.158 109.593 58.625 1.00 0.00 O ATOM 24950 P31 PGR 644 13.997 110.548 59.585 1.00 0.00 P ATOM 24951 O32 PGR 644 15.477 110.431 59.161 1.00 0.00 O ATOM 24952 C31 PGR 644 15.862 110.503 57.840 1.00 0.00 C ATOM 24953 H1A PGR 644 15.478 111.484 57.549 1.00 0.00 H ATOM 24954 H1B PGR 644 15.426 109.707 57.230 1.00 0.00 H ATOM 24955 C32 PGR 644 17.418 110.591 57.575 1.00 0.00 C ATOM 24956 H2A PGR 644 17.715 110.468 56.530 1.00 0.00 H ATOM 24957 O35 PGR 644 18.105 109.536 58.235 1.00 0.00 O ATOM 24958 HO5A PGR 644 19.053 109.527 58.009 1.00 0.00 H ATOM 24959 C33 PGR 644 18.090 111.861 58.110 1.00 0.00 C ATOM 24960 H3A PGR 644 19.113 111.974 57.744 1.00 0.00 H ATOM 24961 H3B PGR 644 17.482 112.646 57.654 1.00 0.00 H ATOM 24962 O33 PGR 644 13.552 111.920 59.258 1.00 0.00 O ATOM 24963 O34 PGR 644 13.881 110.127 60.990 1.00 0.00 O ATOM 24964 O21 PGR 644 14.388 107.874 56.447 1.00 0.00 O ATOM 24965 C21 PGR 644 14.584 107.046 55.364 1.00 0.00 C ATOM 24966 O22 PGR 644 14.081 105.937 55.143 1.00 0.00 O ATOM 24967 O36 PGR 644 17.986 112.015 59.505 1.00 0.00 O ATOM 24968 HO6A PGR 644 17.037 112.013 59.721 1.00 0.00 H ATOM 24969 C12 OL 645 15.601 107.604 54.392 1.00 0.00 C ATOM 24970 H2R OL 645 15.469 108.687 54.340 1.00 0.00 H ATOM 24971 H2S OL 645 16.605 107.514 54.811 1.00 0.00 H ATOM 24972 C13 OL 645 15.687 106.955 53.011 1.00 0.00 C ATOM 24973 H3R OL 645 15.769 105.884 53.208 1.00 0.00 H ATOM 24974 H3S OL 645 14.727 107.088 52.508 1.00 0.00 H ATOM 24975 C14 OL 645 16.846 107.583 52.198 1.00 0.00 C ATOM 24976 H4R OL 645 16.782 108.668 52.298 1.00 0.00 H ATOM 24977 H4S OL 645 17.825 107.237 52.536 1.00 0.00 H ATOM 24978 C15 OL 645 16.698 107.180 50.728 1.00 0.00 C ATOM 24979 H5R OL 645 16.514 106.121 50.536 1.00 0.00 H ATOM 24980 H5S OL 645 15.836 107.708 50.316 1.00 0.00 H ATOM 24981 C16 OL 645 17.875 107.875 49.957 1.00 0.00 C ATOM 24982 H6R OL 645 17.831 108.937 50.204 1.00 0.00 H ATOM 24983 H6S OL 645 18.780 107.568 50.486 1.00 0.00 H ATOM 24984 C17 OL 645 17.800 107.745 48.432 1.00 0.00 C ATOM 24985 H7R OL 645 17.628 106.731 48.064 1.00 0.00 H ATOM 24986 H7S OL 645 16.917 108.283 48.079 1.00 0.00 H ATOM 24987 C18 OL 645 18.962 108.299 47.738 1.00 0.00 C ATOM 24988 H8R OL 645 19.240 109.271 48.152 1.00 0.00 H ATOM 24989 H8S OL 645 19.875 107.709 47.843 1.00 0.00 H ATOM 24990 C19 OL 645 18.633 108.508 46.307 1.00 0.00 C ATOM 24991 H9R OL 645 18.487 107.546 45.823 1.00 0.00 H ATOM 24992 C110 OL 645 18.484 109.631 45.606 1.00 0.00 C ATOM 24993 H10R OL 645 18.184 109.570 44.563 1.00 0.00 H ATOM 24994 C111 OL 645 18.630 111.071 46.115 1.00 0.00 C ATOM 24995 H11R OL 645 17.619 111.485 46.094 1.00 0.00 H ATOM 24996 H11S OL 645 18.966 110.998 47.151 1.00 0.00 H ATOM 24997 C112 OL 645 19.658 111.707 45.192 1.00 0.00 C ATOM 24998 H12R OL 645 20.590 111.165 45.014 1.00 0.00 H ATOM 24999 H12S OL 645 19.156 111.814 44.228 1.00 0.00 H ATOM 25000 C113 OL 645 20.184 113.108 45.589 1.00 0.00 C ATOM 25001 H13R OL 645 20.481 113.147 46.639 1.00 0.00 H ATOM 25002 H13S OL 645 21.022 113.400 44.952 1.00 0.00 H ATOM 25003 C114 OL 645 19.049 114.143 45.465 1.00 0.00 C ATOM 25004 H14R OL 645 18.637 113.953 44.472 1.00 0.00 H ATOM 25005 H14S OL 645 18.235 113.926 46.160 1.00 0.00 H ATOM 25006 C115 OL 645 19.518 115.558 45.655 1.00 0.00 C ATOM 25007 H15R OL 645 19.553 115.738 46.732 1.00 0.00 H ATOM 25008 H15S OL 645 20.573 115.599 45.377 1.00 0.00 H ATOM 25009 C116 OL 645 18.727 116.638 44.995 1.00 0.00 C ATOM 25010 H16R OL 645 18.577 116.469 43.927 1.00 0.00 H ATOM 25011 H16S OL 645 17.746 116.550 45.467 1.00 0.00 H ATOM 25012 C117 OL 645 19.257 117.937 45.375 1.00 0.00 C ATOM 25013 H17R OL 645 19.073 118.110 46.438 1.00 0.00 H ATOM 25014 H17S OL 645 20.347 118.000 45.356 1.00 0.00 H ATOM 25015 C118 OL 645 18.642 119.099 44.577 1.00 0.00 C ATOM 25016 H18R OL 645 19.155 120.008 44.899 1.00 0.00 H ATOM 25017 H18S OL 645 17.555 119.058 44.674 1.00 0.00 H ATOM 25018 H18T OL 645 18.776 118.895 43.513 1.00 0.00 H TER 25019 OL 645 ATOM 25019 C116 PA 646 45.698 5.438 37.537 1.00 0.00 C ATOM 25020 H16R PA 646 46.641 5.680 38.030 1.00 0.00 H ATOM 25021 H16S PA 646 45.309 6.362 37.104 1.00 0.00 H ATOM 25022 H16T PA 646 45.869 4.835 36.642 1.00 0.00 H ATOM 25023 C115 PA 646 44.719 4.780 38.495 1.00 0.00 C ATOM 25024 H15R PA 646 45.006 3.730 38.589 1.00 0.00 H ATOM 25025 H15S PA 646 43.695 4.719 38.118 1.00 0.00 H ATOM 25026 C114 PA 646 44.817 5.392 39.912 1.00 0.00 C ATOM 25027 H14R PA 646 44.746 6.453 39.663 1.00 0.00 H ATOM 25028 H14S PA 646 45.763 5.035 40.325 1.00 0.00 H ATOM 25029 C113 PA 646 43.824 4.978 41.042 1.00 0.00 C ATOM 25030 H13R PA 646 43.401 3.972 40.999 1.00 0.00 H ATOM 25031 H13S PA 646 43.042 5.713 40.839 1.00 0.00 H ATOM 25032 C112 PA 646 44.374 5.304 42.466 1.00 0.00 C ATOM 25033 H12R PA 646 45.004 6.171 42.258 1.00 0.00 H ATOM 25034 H12S PA 646 45.064 4.526 42.799 1.00 0.00 H ATOM 25035 C111 PA 646 43.508 5.827 43.628 1.00 0.00 C ATOM 25036 H11R PA 646 42.986 6.752 43.374 1.00 0.00 H ATOM 25037 H11S PA 646 44.253 6.141 44.363 1.00 0.00 H ATOM 25038 C110 PA 646 42.711 4.721 44.193 1.00 0.00 C ATOM 25039 H10R PA 646 43.186 3.750 44.038 1.00 0.00 H ATOM 25040 H10S PA 646 41.719 4.730 43.736 1.00 0.00 H ATOM 25041 C19 PA 646 42.387 4.770 45.660 1.00 0.00 C ATOM 25042 H9R PA 646 42.170 5.818 45.879 1.00 0.00 H ATOM 25043 H9S PA 646 43.254 4.439 46.235 1.00 0.00 H ATOM 25044 C18 PA 646 41.182 3.960 46.152 1.00 0.00 C ATOM 25045 H8R PA 646 41.214 2.901 45.887 1.00 0.00 H ATOM 25046 H8S PA 646 40.396 4.504 45.625 1.00 0.00 H ATOM 25047 C17 PA 646 40.922 4.170 47.667 1.00 0.00 C ATOM 25048 H7R PA 646 39.934 3.814 47.967 1.00 0.00 H ATOM 25049 H7S PA 646 41.091 5.240 47.804 1.00 0.00 H ATOM 25050 C16 PA 646 41.916 3.364 48.486 1.00 0.00 C ATOM 25051 H6R PA 646 42.942 3.718 48.366 1.00 0.00 H ATOM 25052 H6S PA 646 42.009 2.360 48.067 1.00 0.00 H ATOM 25053 C15 PA 646 41.529 3.442 49.975 1.00 0.00 C ATOM 25054 H5R PA 646 40.465 3.352 50.201 1.00 0.00 H ATOM 25055 H5S PA 646 41.560 4.495 50.261 1.00 0.00 H ATOM 25056 C14 PA 646 42.253 2.360 50.847 1.00 0.00 C ATOM 25057 H4R PA 646 41.807 1.384 50.646 1.00 0.00 H ATOM 25058 H4S PA 646 42.061 2.509 51.912 1.00 0.00 H ATOM 25059 C13 PA 646 43.737 2.188 50.800 1.00 0.00 C ATOM 25060 H3R PA 646 44.355 2.859 51.400 1.00 0.00 H ATOM 25061 H3S PA 646 44.137 2.198 49.784 1.00 0.00 H ATOM 25062 C12 PA 646 44.357 0.853 51.290 1.00 0.00 C ATOM 25063 H2R PA 646 45.436 1.020 51.311 1.00 0.00 H ATOM 25064 H2S PA 646 44.150 0.126 50.502 1.00 0.00 H ATOM 25065 C11 PC 647 43.824 0.439 52.674 1.00 0.00 C ATOM 25066 O12 PC 647 44.114 1.107 53.659 1.00 0.00 O ATOM 25067 O11 PC 647 43.078 -0.688 52.544 1.00 0.00 O ATOM 25068 C1 PC 647 42.515 -1.310 53.733 1.00 0.00 C ATOM 25069 HR PC 647 43.267 -1.290 54.527 1.00 0.00 H ATOM 25070 HS PC 647 42.150 -2.299 53.445 1.00 0.00 H ATOM 25071 C2 PC 647 41.218 -0.538 54.017 1.00 0.00 C ATOM 25072 HX PC 647 41.442 0.523 54.153 1.00 0.00 H ATOM 25073 C3 PC 647 40.622 -1.097 55.325 1.00 0.00 C ATOM 25074 HA PC 647 39.784 -0.506 55.704 1.00 0.00 H ATOM 25075 HB PC 647 41.440 -1.170 56.046 1.00 0.00 H ATOM 25076 O31 PC 647 40.188 -2.396 54.969 1.00 0.00 O ATOM 25077 P31 PC 647 39.520 -3.371 56.039 1.00 0.00 P ATOM 25078 O32 PC 647 38.112 -2.734 56.178 1.00 0.00 O ATOM 25079 C31 PC 647 37.314 -2.635 55.087 1.00 0.00 C ATOM 25080 H1A PC 647 37.381 -3.561 54.509 1.00 0.00 H ATOM 25081 H1B PC 647 37.510 -1.783 54.431 1.00 0.00 H ATOM 25082 C32 PC 647 35.945 -2.426 55.764 1.00 0.00 C ATOM 25083 H2A PC 647 35.936 -1.335 55.796 1.00 0.00 H ATOM 25084 H2B PC 647 35.960 -2.958 56.717 1.00 0.00 H ATOM 25085 N31 PC 647 34.728 -2.737 54.971 1.00 0.00 N ATOM 25086 C33 PC 647 33.534 -2.232 55.673 1.00 0.00 C ATOM 25087 H3A PC 647 33.392 -2.770 56.611 1.00 0.00 H ATOM 25088 H3B PC 647 32.628 -2.179 55.067 1.00 0.00 H ATOM 25089 H3C PC 647 33.726 -1.177 55.872 1.00 0.00 H ATOM 25090 C34 PC 647 34.832 -2.078 53.618 1.00 0.00 C ATOM 25091 H4A PC 647 33.826 -2.176 53.206 1.00 0.00 H ATOM 25092 H4B PC 647 35.625 -2.505 53.003 1.00 0.00 H ATOM 25093 H4C PC 647 35.109 -1.024 53.676 1.00 0.00 H ATOM 25094 C35 PC 647 34.579 -4.186 54.855 1.00 0.00 C ATOM 25095 H5A PC 647 34.193 -4.602 55.787 1.00 0.00 H ATOM 25096 H5B PC 647 35.563 -4.610 54.652 1.00 0.00 H ATOM 25097 H5C PC 647 33.961 -4.360 53.973 1.00 0.00 H ATOM 25098 O33 PC 647 39.349 -4.723 55.427 1.00 0.00 O ATOM 25099 O34 PC 647 40.200 -3.293 57.371 1.00 0.00 O ATOM 25100 O21 PC 647 40.398 -0.673 52.878 1.00 0.00 O ATOM 25101 C21 PC 647 39.214 -0.042 52.696 1.00 0.00 C ATOM 25102 O22 PC 647 38.723 0.631 53.612 1.00 0.00 O ATOM 25103 C12 OL 648 38.686 -0.162 51.316 1.00 0.00 C ATOM 25104 H2R OL 648 39.490 0.048 50.607 1.00 0.00 H ATOM 25105 H2S OL 648 38.350 -1.181 51.118 1.00 0.00 H ATOM 25106 C13 OL 648 37.603 0.819 51.120 1.00 0.00 C ATOM 25107 H3R OL 648 36.872 0.780 51.930 1.00 0.00 H ATOM 25108 H3S OL 648 38.210 1.727 51.121 1.00 0.00 H ATOM 25109 C14 OL 648 36.913 0.946 49.787 1.00 0.00 C ATOM 25110 H4R OL 648 35.976 0.385 49.802 1.00 0.00 H ATOM 25111 H4S OL 648 36.467 1.938 49.883 1.00 0.00 H ATOM 25112 C15 OL 648 37.776 0.762 48.583 1.00 0.00 C ATOM 25113 H5R OL 648 38.652 1.414 48.611 1.00 0.00 H ATOM 25114 H5S OL 648 38.200 -0.244 48.571 1.00 0.00 H ATOM 25115 C16 OL 648 37.009 1.083 47.288 1.00 0.00 C ATOM 25116 H6R OL 648 35.973 0.742 47.329 1.00 0.00 H ATOM 25117 H6S OL 648 36.923 2.170 47.216 1.00 0.00 H ATOM 25118 C17 OL 648 37.680 0.444 46.017 1.00 0.00 C ATOM 25119 H7R OL 648 38.724 0.754 46.085 1.00 0.00 H ATOM 25120 H7S OL 648 37.699 -0.648 46.017 1.00 0.00 H ATOM 25121 C18 OL 648 37.240 0.996 44.731 1.00 0.00 C ATOM 25122 H8R OL 648 37.700 0.304 44.022 1.00 0.00 H ATOM 25123 H8S OL 648 36.151 1.073 44.695 1.00 0.00 H ATOM 25124 C19 OL 648 37.719 2.361 44.564 1.00 0.00 C ATOM 25125 H9R OL 648 37.207 3.071 45.209 1.00 0.00 H ATOM 25126 C110 OL 648 38.686 2.734 43.708 1.00 0.00 C ATOM 25127 H10R OL 648 38.947 3.789 43.679 1.00 0.00 H ATOM 25128 C111 OL 648 39.465 1.899 42.760 1.00 0.00 C ATOM 25129 H11R OL 648 40.472 2.193 43.066 1.00 0.00 H ATOM 25130 H11S OL 648 39.327 0.817 42.810 1.00 0.00 H ATOM 25131 C112 OL 648 39.049 2.272 41.310 1.00 0.00 C ATOM 25132 H12R OL 648 39.318 1.439 40.657 1.00 0.00 H ATOM 25133 H12S OL 648 38.007 2.531 41.114 1.00 0.00 H ATOM 25134 C113 OL 648 39.756 3.514 40.872 1.00 0.00 C ATOM 25135 H13R OL 648 39.498 4.432 41.404 1.00 0.00 H ATOM 25136 H13S OL 648 40.813 3.427 41.132 1.00 0.00 H ATOM 25137 C114 OL 648 39.561 3.758 39.397 1.00 0.00 C ATOM 25138 H14R OL 648 39.815 2.836 38.871 1.00 0.00 H ATOM 25139 H14S OL 648 38.529 4.059 39.207 1.00 0.00 H ATOM 25140 C115 OL 648 40.558 4.792 39.004 1.00 0.00 C ATOM 25141 H15R OL 648 40.295 5.761 39.433 1.00 0.00 H ATOM 25142 H15S OL 648 41.569 4.555 39.342 1.00 0.00 H ATOM 25143 C116 OL 648 40.446 5.133 37.487 1.00 0.00 C ATOM 25144 H16R OL 648 40.802 4.252 36.948 1.00 0.00 H ATOM 25145 H16S OL 648 39.409 5.302 37.190 1.00 0.00 H ATOM 25146 C117 OL 648 41.171 6.424 37.158 1.00 0.00 C ATOM 25147 H17R OL 648 40.789 7.237 37.779 1.00 0.00 H ATOM 25148 H17S OL 648 42.212 6.254 37.442 1.00 0.00 H ATOM 25149 C118 OL 648 41.095 6.860 35.728 1.00 0.00 C ATOM 25150 H18R OL 648 40.174 7.425 35.574 1.00 0.00 H ATOM 25151 H18S OL 648 41.186 6.031 35.023 1.00 0.00 H ATOM 25152 H18T OL 648 41.910 7.585 35.681 1.00 0.00 H TER 25153 OL 648 ATOM 25153 C116 PA 649 90.592 58.456 42.724 1.00 0.00 C ATOM 25154 H16R PA 649 90.251 58.427 43.761 1.00 0.00 H ATOM 25155 H16S PA 649 89.678 58.492 42.128 1.00 0.00 H ATOM 25156 H16T PA 649 91.232 59.326 42.560 1.00 0.00 H ATOM 25157 C115 PA 649 91.270 57.095 42.273 1.00 0.00 C ATOM 25158 H15R PA 649 91.237 57.085 41.181 1.00 0.00 H ATOM 25159 H15S PA 649 90.793 56.143 42.517 1.00 0.00 H ATOM 25160 C114 PA 649 92.708 56.920 42.810 1.00 0.00 C ATOM 25161 H14R PA 649 93.392 57.598 42.295 1.00 0.00 H ATOM 25162 H14S PA 649 92.965 55.869 42.663 1.00 0.00 H ATOM 25163 C113 PA 649 92.915 57.077 44.285 1.00 0.00 C ATOM 25164 H13R PA 649 92.139 56.489 44.778 1.00 0.00 H ATOM 25165 H13S PA 649 92.719 58.100 44.613 1.00 0.00 H ATOM 25166 C112 PA 649 94.313 56.825 44.796 1.00 0.00 C ATOM 25167 H12R PA 649 94.980 57.202 44.018 1.00 0.00 H ATOM 25168 H12S PA 649 94.450 55.742 44.821 1.00 0.00 H ATOM 25169 C111 PA 649 94.721 57.423 46.176 1.00 0.00 C ATOM 25170 H11R PA 649 93.823 57.205 46.757 1.00 0.00 H ATOM 25171 H11S PA 649 94.657 58.495 45.978 1.00 0.00 H ATOM 25172 C110 PA 649 95.977 56.727 46.779 1.00 0.00 C ATOM 25173 H10R PA 649 96.804 57.056 46.148 1.00 0.00 H ATOM 25174 H10S PA 649 95.975 55.649 46.604 1.00 0.00 H ATOM 25175 C19 PA 649 96.273 57.201 48.165 1.00 0.00 C ATOM 25176 H9R PA 649 95.426 56.852 48.760 1.00 0.00 H ATOM 25177 H9S PA 649 96.328 58.291 48.166 1.00 0.00 H ATOM 25178 C18 PA 649 97.608 56.719 48.698 1.00 0.00 C ATOM 25179 H8R PA 649 97.833 57.399 49.523 1.00 0.00 H ATOM 25180 H8S PA 649 98.334 56.799 47.886 1.00 0.00 H ATOM 25181 C17 PA 649 97.528 55.285 49.131 1.00 0.00 C ATOM 25182 H7R PA 649 97.420 54.644 48.253 1.00 0.00 H ATOM 25183 H7S PA 649 96.642 55.114 49.747 1.00 0.00 H ATOM 25184 C16 PA 649 98.715 54.812 49.932 1.00 0.00 C ATOM 25185 H6R PA 649 98.954 55.655 50.583 1.00 0.00 H ATOM 25186 H6S PA 649 99.534 54.524 49.268 1.00 0.00 H ATOM 25187 C15 PA 649 98.374 53.677 50.944 1.00 0.00 C ATOM 25188 H5R PA 649 98.101 52.688 50.569 1.00 0.00 H ATOM 25189 H5S PA 649 97.435 53.943 51.433 1.00 0.00 H ATOM 25190 C14 PA 649 99.482 53.460 51.902 1.00 0.00 C ATOM 25191 H4R PA 649 99.630 54.394 52.447 1.00 0.00 H ATOM 25192 H4S PA 649 100.410 53.317 51.345 1.00 0.00 H ATOM 25193 C13 PA 649 99.132 52.261 52.890 1.00 0.00 C ATOM 25194 H3R PA 649 98.652 51.424 52.379 1.00 0.00 H ATOM 25195 H3S PA 649 98.538 52.754 53.663 1.00 0.00 H ATOM 25196 C12 PA 649 100.432 51.817 53.470 1.00 0.00 C ATOM 25197 H2R PA 649 101.172 52.601 53.647 1.00 0.00 H ATOM 25198 H2S PA 649 100.811 51.054 52.788 1.00 0.00 H ATOM 25199 C11 PC 650 100.174 51.118 54.741 1.00 0.00 C ATOM 25200 O12 PC 650 100.445 51.572 55.796 1.00 0.00 O ATOM 25201 O11 PC 650 99.619 49.901 54.555 1.00 0.00 O ATOM 25202 C1 PC 650 99.564 48.927 55.657 1.00 0.00 C ATOM 25203 HR PC 650 100.364 49.005 56.397 1.00 0.00 H ATOM 25204 HS PC 650 99.554 47.893 55.301 1.00 0.00 H ATOM 25205 C2 PC 650 98.281 49.217 56.441 1.00 0.00 C ATOM 25206 HX PC 650 98.347 50.227 56.852 1.00 0.00 H ATOM 25207 C3 PC 650 97.990 48.060 57.490 1.00 0.00 C ATOM 25208 HA PC 650 98.889 47.514 57.789 1.00 0.00 H ATOM 25209 HB PC 650 97.178 47.412 57.152 1.00 0.00 H ATOM 25210 O31 PC 650 97.528 48.700 58.677 1.00 0.00 O ATOM 25211 P31 PC 650 96.754 47.808 59.779 1.00 0.00 P ATOM 25212 O32 PC 650 96.379 48.923 60.912 1.00 0.00 O ATOM 25213 C31 PC 650 97.252 49.270 61.970 1.00 0.00 C ATOM 25214 H1A PC 650 96.672 50.008 62.530 1.00 0.00 H ATOM 25215 H1B PC 650 98.249 49.632 61.707 1.00 0.00 H ATOM 25216 C32 PC 650 97.547 48.049 62.859 1.00 0.00 C ATOM 25217 H2A PC 650 98.607 47.793 62.819 1.00 0.00 H ATOM 25218 H2B PC 650 96.960 47.226 62.448 1.00 0.00 H ATOM 25219 N31 PC 650 97.202 48.268 64.302 1.00 0.00 N ATOM 25220 C33 PC 650 95.735 48.453 64.554 1.00 0.00 C ATOM 25221 H3A PC 650 95.190 47.820 63.852 1.00 0.00 H ATOM 25222 H3B PC 650 95.583 49.532 64.488 1.00 0.00 H ATOM 25223 H3C PC 650 95.459 48.055 65.531 1.00 0.00 H ATOM 25224 C34 PC 650 97.760 47.080 65.018 1.00 0.00 C ATOM 25225 H4A PC 650 98.838 47.249 65.001 1.00 0.00 H ATOM 25226 H4B PC 650 97.413 46.175 64.518 1.00 0.00 H ATOM 25227 H4C PC 650 97.420 47.259 66.039 1.00 0.00 H ATOM 25228 C35 PC 650 97.845 49.480 64.770 1.00 0.00 C ATOM 25229 H5A PC 650 97.152 50.311 64.626 1.00 0.00 H ATOM 25230 H5B PC 650 98.607 49.687 64.017 1.00 0.00 H ATOM 25231 H5C PC 650 98.098 49.324 65.819 1.00 0.00 H ATOM 25232 O33 PC 650 95.526 47.365 59.210 1.00 0.00 O ATOM 25233 O34 PC 650 97.702 46.742 60.286 1.00 0.00 O ATOM 25234 O21 PC 650 97.163 49.222 55.434 1.00 0.00 O ATOM 25235 C21 PC 650 96.731 48.201 54.691 1.00 0.00 C ATOM 25236 O22 PC 650 96.944 47.055 54.864 1.00 0.00 O ATOM 25237 C12 OL 651 95.724 48.519 53.750 1.00 0.00 C ATOM 25238 H2R OL 651 95.736 47.750 52.975 1.00 0.00 H ATOM 25239 H2S OL 651 94.743 48.295 54.174 1.00 0.00 H ATOM 25240 C13 OL 651 95.793 50.001 53.242 1.00 0.00 C ATOM 25241 H3R OL 651 95.616 50.785 53.981 1.00 0.00 H ATOM 25242 H3S OL 651 96.795 50.244 52.882 1.00 0.00 H ATOM 25243 C14 OL 651 94.780 50.347 52.137 1.00 0.00 C ATOM 25244 H4R OL 651 93.801 50.094 52.549 1.00 0.00 H ATOM 25245 H4S OL 651 94.831 51.421 51.944 1.00 0.00 H ATOM 25246 C15 OL 651 95.119 49.576 50.916 1.00 0.00 C ATOM 25247 H5R OL 651 96.175 49.761 50.707 1.00 0.00 H ATOM 25248 H5S OL 651 94.968 48.535 51.211 1.00 0.00 H ATOM 25249 C16 OL 651 94.230 50.049 49.747 1.00 0.00 C ATOM 25250 H6R OL 651 93.215 50.085 50.148 1.00 0.00 H ATOM 25251 H6S OL 651 94.590 51.069 49.595 1.00 0.00 H ATOM 25252 C17 OL 651 94.307 49.191 48.420 1.00 0.00 C ATOM 25253 H7R OL 651 93.808 48.256 48.683 1.00 0.00 H ATOM 25254 H7S OL 651 93.628 49.591 47.664 1.00 0.00 H ATOM 25255 C18 OL 651 95.674 49.075 47.738 1.00 0.00 C ATOM 25256 H8R OL 651 96.369 48.481 48.335 1.00 0.00 H ATOM 25257 H8S OL 651 95.628 48.418 46.867 1.00 0.00 H ATOM 25258 C19 OL 651 96.299 50.410 47.308 1.00 0.00 C ATOM 25259 H9R OL 651 96.522 51.138 48.083 1.00 0.00 H ATOM 25260 C110 OL 651 96.747 50.723 46.048 1.00 0.00 C ATOM 25261 H10R OL 651 97.309 51.637 45.869 1.00 0.00 H ATOM 25262 C111 OL 651 96.758 49.889 44.804 1.00 0.00 C ATOM 25263 H11R OL 651 95.901 49.213 44.774 1.00 0.00 H ATOM 25264 H11S OL 651 96.633 50.532 43.930 1.00 0.00 H ATOM 25265 C112 OL 651 97.893 48.911 44.564 1.00 0.00 C ATOM 25266 H12R OL 651 98.872 49.324 44.815 1.00 0.00 H ATOM 25267 H12S OL 651 97.838 48.105 45.298 1.00 0.00 H ATOM 25268 C113 OL 651 97.929 48.365 43.160 1.00 0.00 C ATOM 25269 H13R OL 651 97.120 47.704 42.842 1.00 0.00 H ATOM 25270 H13S OL 651 97.707 49.204 42.498 1.00 0.00 H ATOM 25271 C114 OL 651 99.202 47.708 42.825 1.00 0.00 C ATOM 25272 H14R OL 651 99.907 48.536 42.924 1.00 0.00 H ATOM 25273 H14S OL 651 99.618 46.985 43.530 1.00 0.00 H ATOM 25274 C115 OL 651 99.047 46.959 41.479 1.00 0.00 C ATOM 25275 H15R OL 651 98.376 46.097 41.456 1.00 0.00 H ATOM 25276 H15S OL 651 98.549 47.534 40.695 1.00 0.00 H ATOM 25277 C116 OL 651 100.390 46.577 40.954 1.00 0.00 C ATOM 25278 H16R OL 651 100.043 45.999 40.095 1.00 0.00 H ATOM 25279 H16S OL 651 100.711 47.491 40.449 1.00 0.00 H ATOM 25280 C117 OL 651 101.401 45.819 41.790 1.00 0.00 C ATOM 25281 H17R OL 651 101.722 46.529 42.555 1.00 0.00 H ATOM 25282 H17S OL 651 101.155 44.906 42.336 1.00 0.00 H ATOM 25283 C118 OL 651 102.568 45.194 41.068 1.00 0.00 C ATOM 25284 H18R OL 651 103.051 45.997 40.508 1.00 0.00 H ATOM 25285 H18S OL 651 102.082 44.439 40.447 1.00 0.00 H ATOM 25286 H18T OL 651 103.225 44.737 41.811 1.00 0.00 H TER 25287 OL 651 ATOM 25287 C116 PA 652 112.201 71.085 45.669 1.00 0.00 C ATOM 25288 H16R PA 652 111.997 72.139 45.472 1.00 0.00 H ATOM 25289 H16S PA 652 113.030 70.679 45.084 1.00 0.00 H ATOM 25290 H16T PA 652 112.459 70.927 46.719 1.00 0.00 H ATOM 25291 C115 PA 652 110.948 70.362 45.360 1.00 0.00 C ATOM 25292 H15R PA 652 110.922 70.317 44.270 1.00 0.00 H ATOM 25293 H15S PA 652 110.100 70.940 45.734 1.00 0.00 H ATOM 25294 C114 PA 652 110.769 68.978 45.965 1.00 0.00 C ATOM 25295 H14R PA 652 109.762 68.565 45.886 1.00 0.00 H ATOM 25296 H14S PA 652 110.826 69.036 47.054 1.00 0.00 H ATOM 25297 C113 PA 652 111.600 67.846 45.373 1.00 0.00 C ATOM 25298 H13R PA 652 112.594 68.088 44.993 1.00 0.00 H ATOM 25299 H13S PA 652 111.132 67.582 44.422 1.00 0.00 H ATOM 25300 C112 PA 652 111.658 66.642 46.215 1.00 0.00 C ATOM 25301 H12R PA 652 110.682 66.263 46.525 1.00 0.00 H ATOM 25302 H12S PA 652 112.113 66.866 47.182 1.00 0.00 H ATOM 25303 C111 PA 652 112.608 65.550 45.699 1.00 0.00 C ATOM 25304 H11R PA 652 113.583 66.041 45.693 1.00 0.00 H ATOM 25305 H11S PA 652 112.359 65.420 44.644 1.00 0.00 H ATOM 25306 C110 PA 652 112.655 64.265 46.566 1.00 0.00 C ATOM 25307 H10R PA 652 113.456 63.637 46.171 1.00 0.00 H ATOM 25308 H10S PA 652 111.704 63.733 46.494 1.00 0.00 H ATOM 25309 C19 PA 652 112.851 64.481 48.064 1.00 0.00 C ATOM 25310 H9R PA 652 112.062 65.164 48.385 1.00 0.00 H ATOM 25311 H9S PA 652 113.831 64.958 48.133 1.00 0.00 H ATOM 25312 C18 PA 652 112.748 63.239 48.869 1.00 0.00 C ATOM 25313 H8R PA 652 113.472 62.521 48.477 1.00 0.00 H ATOM 25314 H8S PA 652 111.797 62.704 48.830 1.00 0.00 H ATOM 25315 C17 PA 652 113.099 63.385 50.401 1.00 0.00 C ATOM 25316 H7R PA 652 113.058 62.373 50.807 1.00 0.00 H ATOM 25317 H7S PA 652 112.322 63.889 50.980 1.00 0.00 H ATOM 25318 C16 PA 652 114.480 63.981 50.740 1.00 0.00 C ATOM 25319 H6R PA 652 114.539 65.007 50.371 1.00 0.00 H ATOM 25320 H6S PA 652 115.386 63.450 50.440 1.00 0.00 H ATOM 25321 C15 PA 652 114.609 64.113 52.295 1.00 0.00 C ATOM 25322 H5R PA 652 114.404 63.158 52.783 1.00 0.00 H ATOM 25323 H5S PA 652 113.778 64.781 52.533 1.00 0.00 H ATOM 25324 C14 PA 652 116.019 64.514 52.715 1.00 0.00 C ATOM 25325 H4R PA 652 116.130 64.579 53.799 1.00 0.00 H ATOM 25326 H4S PA 652 116.277 65.558 52.525 1.00 0.00 H ATOM 25327 C13 PA 652 117.180 63.633 52.267 1.00 0.00 C ATOM 25328 H3R PA 652 118.098 63.901 52.792 1.00 0.00 H ATOM 25329 H3S PA 652 117.360 63.846 51.211 1.00 0.00 H ATOM 25330 C12 PA 652 116.996 62.122 52.602 1.00 0.00 C ATOM 25331 H2R PA 652 117.816 61.566 52.142 1.00 0.00 H ATOM 25332 H2S PA 652 116.118 61.707 52.103 1.00 0.00 H ATOM 25333 C11 PGR 653 116.838 61.722 54.007 1.00 0.00 C ATOM 25334 O12 PGR 653 115.805 61.252 54.515 1.00 0.00 O ATOM 25335 O11 PGR 653 118.006 61.993 54.697 1.00 0.00 O ATOM 25336 C1 PGR 653 118.129 61.687 56.056 1.00 0.00 C ATOM 25337 HR PGR 653 118.165 60.604 56.194 1.00 0.00 H ATOM 25338 HS PGR 653 117.198 61.936 56.570 1.00 0.00 H ATOM 25339 C2 PGR 653 119.270 62.493 56.696 1.00 0.00 C ATOM 25340 HX PGR 653 120.209 62.190 56.226 1.00 0.00 H ATOM 25341 C3 PGR 653 119.335 62.105 58.214 1.00 0.00 C ATOM 25342 HA PGR 653 119.862 62.973 58.618 1.00 0.00 H ATOM 25343 HB PGR 653 119.891 61.167 58.287 1.00 0.00 H ATOM 25344 O31 PGR 653 118.120 61.919 58.823 1.00 0.00 O ATOM 25345 P31 PGR 653 118.051 61.379 60.369 1.00 0.00 P ATOM 25346 O32 PGR 653 118.824 60.013 60.304 1.00 0.00 O ATOM 25347 C31 PGR 653 118.407 58.979 59.434 1.00 0.00 C ATOM 25348 H1A PGR 653 118.555 59.360 58.420 1.00 0.00 H ATOM 25349 H1B PGR 653 117.329 58.844 59.549 1.00 0.00 H ATOM 25350 C32 PGR 653 119.222 57.716 59.447 1.00 0.00 C ATOM 25351 H2A PGR 653 118.913 57.111 58.591 1.00 0.00 H ATOM 25352 O35 PGR 653 119.053 57.107 60.660 1.00 0.00 O ATOM 25353 HO5A PGR 653 119.286 56.180 60.473 1.00 0.00 H ATOM 25354 C33 PGR 653 120.765 58.027 59.419 1.00 0.00 C ATOM 25355 H3A PGR 653 121.312 57.096 59.249 1.00 0.00 H ATOM 25356 H3B PGR 653 121.117 58.729 58.659 1.00 0.00 H ATOM 25357 O33 PGR 653 118.795 62.279 61.224 1.00 0.00 O ATOM 25358 O34 PGR 653 116.613 61.132 60.708 1.00 0.00 O ATOM 25359 O21 PGR 653 119.116 63.856 56.440 1.00 0.00 O ATOM 25360 C21 PGR 653 120.077 64.819 56.622 1.00 0.00 C ATOM 25361 O22 PGR 653 121.220 64.567 56.943 1.00 0.00 O ATOM 25362 O36 PGR 653 121.185 58.564 60.657 1.00 0.00 O ATOM 25363 HO6A PGR 653 120.738 59.418 60.795 1.00 0.00 H ATOM 25364 C12 OL 654 119.396 66.120 56.240 1.00 0.00 C ATOM 25365 H2R OL 654 118.311 66.037 56.330 1.00 0.00 H ATOM 25366 H2S OL 654 119.702 66.925 56.911 1.00 0.00 H ATOM 25367 C13 OL 654 119.873 66.498 54.823 1.00 0.00 C ATOM 25368 H3R OL 654 120.905 66.813 54.989 1.00 0.00 H ATOM 25369 H3S OL 654 119.930 65.713 54.066 1.00 0.00 H ATOM 25370 C14 OL 654 119.254 67.714 54.195 1.00 0.00 C ATOM 25371 H4R OL 654 118.195 67.526 54.006 1.00 0.00 H ATOM 25372 H4S OL 654 119.195 68.579 54.859 1.00 0.00 H ATOM 25373 C15 OL 654 119.917 67.996 52.876 1.00 0.00 C ATOM 25374 H5R OL 654 119.656 69.036 52.672 1.00 0.00 H ATOM 25375 H5S OL 654 120.991 68.135 53.019 1.00 0.00 H ATOM 25376 C16 OL 654 119.734 67.139 51.667 1.00 0.00 C ATOM 25377 H6R OL 654 120.153 66.140 51.808 1.00 0.00 H ATOM 25378 H6S OL 654 118.674 66.940 51.495 1.00 0.00 H ATOM 25379 C17 OL 654 120.089 67.781 50.293 1.00 0.00 C ATOM 25380 H7R OL 654 119.405 68.605 50.078 1.00 0.00 H ATOM 25381 H7S OL 654 121.043 68.310 50.335 1.00 0.00 H ATOM 25382 C18 OL 654 120.034 66.850 49.063 1.00 0.00 C ATOM 25383 H8R OL 654 119.125 66.271 49.244 1.00 0.00 H ATOM 25384 H8S OL 654 119.756 67.340 48.128 1.00 0.00 H ATOM 25385 C19 OL 654 121.120 65.838 48.847 1.00 0.00 C ATOM 25386 H9R OL 654 121.091 64.994 49.532 1.00 0.00 H ATOM 25387 C110 OL 654 122.114 65.974 47.937 1.00 0.00 C ATOM 25388 H10R OL 654 122.800 65.138 47.825 1.00 0.00 H ATOM 25389 C111 OL 654 122.356 67.097 46.964 1.00 0.00 C ATOM 25390 H11R OL 654 121.481 67.739 46.844 1.00 0.00 H ATOM 25391 H11S OL 654 123.213 67.677 47.312 1.00 0.00 H ATOM 25392 C112 OL 654 122.693 66.473 45.573 1.00 0.00 C ATOM 25393 H12R OL 654 122.976 67.264 44.876 1.00 0.00 H ATOM 25394 H12S OL 654 123.557 65.816 45.691 1.00 0.00 H ATOM 25395 C113 OL 654 121.541 65.724 44.898 1.00 0.00 C ATOM 25396 H13R OL 654 121.225 64.961 45.613 1.00 0.00 H ATOM 25397 H13S OL 654 120.750 66.477 44.853 1.00 0.00 H ATOM 25398 C114 OL 654 121.847 65.198 43.490 1.00 0.00 C ATOM 25399 H14R OL 654 122.449 65.967 43.002 1.00 0.00 H ATOM 25400 H14S OL 654 122.450 64.288 43.494 1.00 0.00 H ATOM 25401 C115 OL 654 120.539 64.895 42.678 1.00 0.00 C ATOM 25402 H15R OL 654 119.892 64.307 43.332 1.00 0.00 H ATOM 25403 H15S OL 654 119.952 65.808 42.560 1.00 0.00 H ATOM 25404 C116 OL 654 120.801 64.318 41.334 1.00 0.00 C ATOM 25405 H16R OL 654 121.573 64.851 40.775 1.00 0.00 H ATOM 25406 H16S OL 654 121.227 63.350 41.608 1.00 0.00 H ATOM 25407 C117 OL 654 119.605 64.020 40.582 1.00 0.00 C ATOM 25408 H17R OL 654 119.022 63.255 41.100 1.00 0.00 H ATOM 25409 H17S OL 654 119.137 64.999 40.464 1.00 0.00 H ATOM 25410 C118 OL 654 119.792 63.333 39.229 1.00 0.00 C ATOM 25411 H18R OL 654 119.872 64.095 38.450 1.00 0.00 H ATOM 25412 H18S OL 654 118.909 62.707 39.082 1.00 0.00 H ATOM 25413 H18T OL 654 120.635 62.639 39.215 1.00 0.00 H TER 25414 OL 654 ATOM 25414 C116 PA 655 140.959 72.000 38.552 1.00 0.00 C ATOM 25415 H16R PA 655 141.932 72.212 38.103 1.00 0.00 H ATOM 25416 H16S PA 655 140.310 72.832 38.270 1.00 0.00 H ATOM 25417 H16T PA 655 140.575 71.028 38.235 1.00 0.00 H ATOM 25418 C115 PA 655 140.982 71.935 40.083 1.00 0.00 C ATOM 25419 H15R PA 655 141.803 71.286 40.397 1.00 0.00 H ATOM 25420 H15S PA 655 139.987 71.533 40.284 1.00 0.00 H ATOM 25421 C114 PA 655 141.084 73.339 40.758 1.00 0.00 C ATOM 25422 H14R PA 655 140.181 73.855 40.424 1.00 0.00 H ATOM 25423 H14S PA 655 141.913 73.817 40.231 1.00 0.00 H ATOM 25424 C113 PA 655 141.217 73.342 42.326 1.00 0.00 C ATOM 25425 H13R PA 655 140.734 72.521 42.861 1.00 0.00 H ATOM 25426 H13S PA 655 140.811 74.262 42.753 1.00 0.00 H ATOM 25427 C112 PA 655 142.658 73.400 42.747 1.00 0.00 C ATOM 25428 H12R PA 655 142.701 73.948 43.690 1.00 0.00 H ATOM 25429 H12S PA 655 143.190 74.087 42.086 1.00 0.00 H ATOM 25430 C111 PA 655 143.268 72.046 42.804 1.00 0.00 C ATOM 25431 H11R PA 655 143.230 71.522 41.847 1.00 0.00 H ATOM 25432 H11S PA 655 142.787 71.290 43.428 1.00 0.00 H ATOM 25433 C110 PA 655 144.721 71.986 43.284 1.00 0.00 C ATOM 25434 H10R PA 655 145.408 72.280 42.488 1.00 0.00 H ATOM 25435 H10S PA 655 144.974 70.974 43.608 1.00 0.00 H ATOM 25436 C19 PA 655 145.089 72.993 44.425 1.00 0.00 C ATOM 25437 H9R PA 655 144.204 73.061 45.061 1.00 0.00 H ATOM 25438 H9S PA 655 145.427 73.956 44.036 1.00 0.00 H ATOM 25439 C18 PA 655 146.194 72.300 45.320 1.00 0.00 C ATOM 25440 H8R PA 655 147.172 72.514 44.885 1.00 0.00 H ATOM 25441 H8S PA 655 146.099 71.215 45.407 1.00 0.00 H ATOM 25442 C17 PA 655 146.185 72.842 46.744 1.00 0.00 C ATOM 25443 H7R PA 655 145.605 73.764 46.825 1.00 0.00 H ATOM 25444 H7S PA 655 147.169 73.287 46.906 1.00 0.00 H ATOM 25445 C16 PA 655 145.802 71.935 47.869 1.00 0.00 C ATOM 25446 H6R PA 655 146.467 71.070 47.828 1.00 0.00 H ATOM 25447 H6S PA 655 144.754 71.692 47.680 1.00 0.00 H ATOM 25448 C15 PA 655 145.813 72.762 49.250 1.00 0.00 C ATOM 25449 H5R PA 655 144.969 73.451 49.171 1.00 0.00 H ATOM 25450 H5S PA 655 146.703 73.386 49.354 1.00 0.00 H ATOM 25451 C14 PA 655 145.602 71.744 50.425 1.00 0.00 C ATOM 25452 H4R PA 655 146.538 71.201 50.572 1.00 0.00 H ATOM 25453 H4S PA 655 144.873 71.042 50.017 1.00 0.00 H ATOM 25454 C13 PA 655 145.164 72.375 51.724 1.00 0.00 C ATOM 25455 H3R PA 655 145.741 73.276 51.942 1.00 0.00 H ATOM 25456 H3S PA 655 145.394 71.721 52.568 1.00 0.00 H ATOM 25457 C12 PA 655 143.663 72.744 51.633 1.00 0.00 C ATOM 25458 H2R PA 655 142.984 71.889 51.645 1.00 0.00 H ATOM 25459 H2S PA 655 143.504 73.233 50.670 1.00 0.00 H ATOM 25460 C11 PGR 656 143.278 73.786 52.607 1.00 0.00 C ATOM 25461 O12 PGR 656 143.989 74.235 53.506 1.00 0.00 O ATOM 25462 O11 PGR 656 142.041 74.162 52.392 1.00 0.00 O ATOM 25463 C1 PGR 656 141.422 75.160 53.282 1.00 0.00 C ATOM 25464 HR PGR 656 140.710 75.647 52.610 1.00 0.00 H ATOM 25465 HS PGR 656 142.106 75.901 53.703 1.00 0.00 H ATOM 25466 C2 PGR 656 140.634 74.410 54.341 1.00 0.00 C ATOM 25467 HX PGR 656 139.909 75.001 54.907 1.00 0.00 H ATOM 25468 C3 PGR 656 141.726 73.739 55.256 1.00 0.00 C ATOM 25469 HA PGR 656 142.463 74.482 55.571 1.00 0.00 H ATOM 25470 HB PGR 656 142.241 72.889 54.802 1.00 0.00 H ATOM 25471 O31 PGR 656 141.146 73.182 56.387 1.00 0.00 O ATOM 25472 P31 PGR 656 142.019 72.826 57.695 1.00 0.00 P ATOM 25473 O32 PGR 656 142.701 71.387 57.328 1.00 0.00 O ATOM 25474 C31 PGR 656 142.197 70.066 57.588 1.00 0.00 C ATOM 25475 H1A PGR 656 142.164 69.438 56.694 1.00 0.00 H ATOM 25476 H1B PGR 656 141.235 70.040 58.108 1.00 0.00 H ATOM 25477 C32 PGR 656 143.180 69.388 58.402 1.00 0.00 C ATOM 25478 H2A PGR 656 143.399 69.951 59.313 1.00 0.00 H ATOM 25479 O35 PGR 656 144.385 69.083 57.655 1.00 0.00 O ATOM 25480 HO5A PGR 656 144.097 68.500 56.929 1.00 0.00 H ATOM 25481 C33 PGR 656 142.535 68.009 58.831 1.00 0.00 C ATOM 25482 H3A PGR 656 143.123 67.419 59.539 1.00 0.00 H ATOM 25483 H3B PGR 656 141.604 68.304 59.322 1.00 0.00 H ATOM 25484 O33 PGR 656 143.167 73.790 57.719 1.00 0.00 O ATOM 25485 O34 PGR 656 141.187 72.637 58.888 1.00 0.00 O ATOM 25486 O21 PGR 656 139.789 73.295 53.830 1.00 0.00 O ATOM 25487 C21 PGR 656 138.709 73.588 53.060 1.00 0.00 C ATOM 25488 O22 PGR 656 138.276 74.757 52.952 1.00 0.00 O ATOM 25489 O36 PGR 656 142.177 67.205 57.685 1.00 0.00 O ATOM 25490 HO6A PGR 656 143.001 66.939 57.237 1.00 0.00 H ATOM 25491 C12 OL 657 138.006 72.320 52.547 1.00 0.00 C ATOM 25492 H2R OL 657 137.810 71.627 53.367 1.00 0.00 H ATOM 25493 H2S OL 657 137.094 72.627 52.031 1.00 0.00 H ATOM 25494 C13 OL 657 138.920 71.533 51.681 1.00 0.00 C ATOM 25495 H3R OL 657 138.971 71.989 50.690 1.00 0.00 H ATOM 25496 H3S OL 657 139.945 71.487 52.054 1.00 0.00 H ATOM 25497 C14 OL 657 138.303 70.181 51.420 1.00 0.00 C ATOM 25498 H4R OL 657 137.937 69.704 52.332 1.00 0.00 H ATOM 25499 H4S OL 657 137.360 70.390 50.911 1.00 0.00 H ATOM 25500 C15 OL 657 139.166 69.193 50.667 1.00 0.00 C ATOM 25501 H5R OL 657 139.620 69.560 49.744 1.00 0.00 H ATOM 25502 H5S OL 657 139.970 68.823 51.307 1.00 0.00 H ATOM 25503 C16 OL 657 138.378 67.920 50.306 1.00 0.00 C ATOM 25504 H6R OL 657 138.137 67.429 51.251 1.00 0.00 H ATOM 25505 H6S OL 657 137.464 68.109 49.739 1.00 0.00 H ATOM 25506 C17 OL 657 139.251 66.889 49.621 1.00 0.00 C ATOM 25507 H7R OL 657 140.049 66.612 50.313 1.00 0.00 H ATOM 25508 H7S OL 657 138.681 66.000 49.341 1.00 0.00 H ATOM 25509 C18 OL 657 139.748 67.354 48.223 1.00 0.00 C ATOM 25510 H8R OL 657 140.435 68.201 48.271 1.00 0.00 H ATOM 25511 H8S OL 657 140.255 66.512 47.746 1.00 0.00 H ATOM 25512 C19 OL 657 138.611 67.654 47.268 1.00 0.00 C ATOM 25513 H9R OL 657 138.085 68.514 47.674 1.00 0.00 H ATOM 25514 C110 OL 657 138.106 66.940 46.234 1.00 0.00 C ATOM 25515 H10R OL 657 137.257 67.379 45.717 1.00 0.00 H ATOM 25516 C111 OL 657 138.726 65.692 45.628 1.00 0.00 C ATOM 25517 H11R OL 657 139.105 64.992 46.376 1.00 0.00 H ATOM 25518 H11S OL 657 137.922 65.181 45.095 1.00 0.00 H ATOM 25519 C112 OL 657 139.794 66.062 44.550 1.00 0.00 C ATOM 25520 H12R OL 657 139.624 65.253 43.836 1.00 0.00 H ATOM 25521 H12S OL 657 139.744 67.067 44.124 1.00 0.00 H ATOM 25522 C113 OL 657 141.147 65.926 44.941 1.00 0.00 C ATOM 25523 H13R OL 657 141.663 66.093 43.994 1.00 0.00 H ATOM 25524 H13S OL 657 141.540 66.689 45.616 1.00 0.00 H ATOM 25525 C114 OL 657 141.589 64.516 45.399 1.00 0.00 C ATOM 25526 H14R OL 657 141.390 64.437 46.470 1.00 0.00 H ATOM 25527 H14S OL 657 140.839 63.793 45.073 1.00 0.00 H ATOM 25528 C115 OL 657 142.954 64.080 44.825 1.00 0.00 C ATOM 25529 H15R OL 657 142.927 64.041 43.734 1.00 0.00 H ATOM 25530 H15S OL 657 143.738 64.810 45.037 1.00 0.00 H ATOM 25531 C116 OL 657 143.291 62.699 45.327 1.00 0.00 C ATOM 25532 H16R OL 657 142.582 61.903 45.090 1.00 0.00 H ATOM 25533 H16S OL 657 144.180 62.461 44.739 1.00 0.00 H ATOM 25534 C117 OL 657 143.686 62.538 46.757 1.00 0.00 C ATOM 25535 H17R OL 657 142.981 62.751 47.563 1.00 0.00 H ATOM 25536 H17S OL 657 144.015 61.504 46.880 1.00 0.00 H ATOM 25537 C118 OL 657 144.895 63.421 47.088 1.00 0.00 C ATOM 25538 H18R OL 657 144.824 64.503 47.210 1.00 0.00 H ATOM 25539 H18S OL 657 145.620 63.462 46.273 1.00 0.00 H ATOM 25540 H18T OL 657 145.285 63.047 48.037 1.00 0.00 H TER 25541 OL 657 ATOM 25541 C116 PA 658 114.036 -8.229 42.167 1.00 0.00 C ATOM 25542 H16R PA 658 114.033 -9.309 42.328 1.00 0.00 H ATOM 25543 H16S PA 658 114.881 -8.050 41.498 1.00 0.00 H ATOM 25544 H16T PA 658 113.077 -8.053 41.676 1.00 0.00 H ATOM 25545 C115 PA 658 114.256 -7.555 43.477 1.00 0.00 C ATOM 25546 H15R PA 658 115.247 -7.638 43.930 1.00 0.00 H ATOM 25547 H15S PA 658 113.662 -8.060 44.242 1.00 0.00 H ATOM 25548 C114 PA 658 113.751 -6.106 43.498 1.00 0.00 C ATOM 25549 H14R PA 658 112.689 -6.186 43.258 1.00 0.00 H ATOM 25550 H14S PA 658 114.296 -5.485 42.784 1.00 0.00 H ATOM 25551 C113 PA 658 113.847 -5.453 44.849 1.00 0.00 C ATOM 25552 H13R PA 658 113.549 -4.410 44.726 1.00 0.00 H ATOM 25553 H13S PA 658 114.906 -5.350 45.096 1.00 0.00 H ATOM 25554 C112 PA 658 113.251 -6.181 46.024 1.00 0.00 C ATOM 25555 H12R PA 658 113.624 -7.185 46.235 1.00 0.00 H ATOM 25556 H12S PA 658 112.218 -6.322 45.697 1.00 0.00 H ATOM 25557 C111 PA 658 113.314 -5.466 47.398 1.00 0.00 C ATOM 25558 H11R PA 658 112.872 -6.181 48.096 1.00 0.00 H ATOM 25559 H11S PA 658 112.664 -4.589 47.393 1.00 0.00 H ATOM 25560 C110 PA 658 114.749 -5.184 47.914 1.00 0.00 C ATOM 25561 H10R PA 658 115.429 -4.718 47.198 1.00 0.00 H ATOM 25562 H10S PA 658 115.212 -6.129 48.205 1.00 0.00 H ATOM 25563 C19 PA 658 114.771 -4.223 49.126 1.00 0.00 C ATOM 25564 H9R PA 658 114.161 -4.526 49.980 1.00 0.00 H ATOM 25565 H9S PA 658 114.516 -3.224 48.768 1.00 0.00 H ATOM 25566 C18 PA 658 116.210 -4.041 49.654 1.00 0.00 C ATOM 25567 H8R PA 658 116.933 -3.608 48.959 1.00 0.00 H ATOM 25568 H8S PA 658 116.728 -4.951 49.965 1.00 0.00 H ATOM 25569 C17 PA 658 115.998 -3.250 50.981 1.00 0.00 C ATOM 25570 H7R PA 658 115.322 -3.781 51.655 1.00 0.00 H ATOM 25571 H7S PA 658 115.462 -2.348 50.679 1.00 0.00 H ATOM 25572 C16 PA 658 117.356 -2.842 51.631 1.00 0.00 C ATOM 25573 H6R PA 658 117.787 -2.164 50.890 1.00 0.00 H ATOM 25574 H6S PA 658 117.917 -3.778 51.659 1.00 0.00 H ATOM 25575 C15 PA 658 117.115 -2.237 53.000 1.00 0.00 C ATOM 25576 H5R PA 658 116.331 -2.841 53.461 1.00 0.00 H ATOM 25577 H5S PA 658 116.728 -1.226 52.854 1.00 0.00 H ATOM 25578 C14 PA 658 118.415 -2.251 53.810 1.00 0.00 C ATOM 25579 H4R PA 658 119.099 -1.748 53.124 1.00 0.00 H ATOM 25580 H4S PA 658 118.645 -3.307 53.968 1.00 0.00 H ATOM 25581 C13 PA 658 118.222 -1.539 55.150 1.00 0.00 C ATOM 25582 H3R PA 658 117.353 -1.962 55.657 1.00 0.00 H ATOM 25583 H3S PA 658 118.085 -0.495 54.861 1.00 0.00 H ATOM 25584 C12 PA 658 119.420 -1.696 56.082 1.00 0.00 C ATOM 25585 H2R PA 658 120.315 -1.829 55.471 1.00 0.00 H ATOM 25586 H2S PA 658 119.286 -2.633 56.626 1.00 0.00 H ATOM 25587 C11 PGR 659 119.504 -0.447 56.962 1.00 0.00 C ATOM 25588 O12 PGR 659 119.135 0.695 56.733 1.00 0.00 O ATOM 25589 O11 PGR 659 120.261 -0.853 58.093 1.00 0.00 O ATOM 25590 C1 PGR 659 120.987 0.087 58.851 1.00 0.00 C ATOM 25591 HR PGR 659 121.069 -0.192 59.904 1.00 0.00 H ATOM 25592 HS PGR 659 120.439 1.031 58.797 1.00 0.00 H ATOM 25593 C2 PGR 659 122.382 0.098 58.167 1.00 0.00 C ATOM 25594 HX PGR 659 122.667 -0.931 57.931 1.00 0.00 H ATOM 25595 C3 PGR 659 123.385 0.794 59.088 1.00 0.00 C ATOM 25596 HA PGR 659 124.276 0.938 58.472 1.00 0.00 H ATOM 25597 HB PGR 659 123.651 0.185 59.956 1.00 0.00 H ATOM 25598 O31 PGR 659 122.829 2.074 59.478 1.00 0.00 O ATOM 25599 P31 PGR 659 123.751 3.294 60.090 1.00 0.00 P ATOM 25600 O32 PGR 659 123.994 2.837 61.549 1.00 0.00 O ATOM 25601 C31 PGR 659 122.964 2.927 62.520 1.00 0.00 C ATOM 25602 H1A PGR 659 122.118 2.666 61.879 1.00 0.00 H ATOM 25603 H1B PGR 659 122.867 3.930 62.944 1.00 0.00 H ATOM 25604 C32 PGR 659 123.173 1.855 63.609 1.00 0.00 C ATOM 25605 H2A PGR 659 122.208 1.570 64.038 1.00 0.00 H ATOM 25606 O35 PGR 659 124.080 2.411 64.581 1.00 0.00 O ATOM 25607 HO5A PGR 659 123.889 1.998 65.442 1.00 0.00 H ATOM 25608 C33 PGR 659 123.731 0.527 63.076 1.00 0.00 C ATOM 25609 H3A PGR 659 123.067 0.335 62.229 1.00 0.00 H ATOM 25610 H3B PGR 659 124.744 0.690 62.699 1.00 0.00 H ATOM 25611 O33 PGR 659 125.086 3.196 59.456 1.00 0.00 O ATOM 25612 O34 PGR 659 122.883 4.465 59.904 1.00 0.00 O ATOM 25613 O21 PGR 659 122.299 0.775 56.826 1.00 0.00 O ATOM 25614 C21 PGR 659 123.251 0.396 55.893 1.00 0.00 C ATOM 25615 O22 PGR 659 124.143 -0.435 56.195 1.00 0.00 O ATOM 25616 O36 PGR 659 123.724 -0.598 64.050 1.00 0.00 O ATOM 25617 HO6A PGR 659 123.289 -1.340 63.593 1.00 0.00 H ATOM 25618 C12 OL 660 123.082 0.963 54.571 1.00 0.00 C ATOM 25619 H2R OL 660 123.419 2.000 54.626 1.00 0.00 H ATOM 25620 H2S OL 660 123.799 0.471 53.911 1.00 0.00 H ATOM 25621 C13 OL 660 121.626 0.928 54.060 1.00 0.00 C ATOM 25622 H3R OL 660 121.125 -0.041 54.111 1.00 0.00 H ATOM 25623 H3S OL 660 121.068 1.537 54.774 1.00 0.00 H ATOM 25624 C14 OL 660 121.441 1.644 52.689 1.00 0.00 C ATOM 25625 H4R OL 660 122.152 1.183 52.000 1.00 0.00 H ATOM 25626 H4S OL 660 120.500 1.331 52.233 1.00 0.00 H ATOM 25627 C15 OL 660 121.741 3.203 52.692 1.00 0.00 C ATOM 25628 H5R OL 660 120.864 3.718 53.088 1.00 0.00 H ATOM 25629 H5S OL 660 122.560 3.449 53.371 1.00 0.00 H ATOM 25630 C16 OL 660 122.321 3.843 51.375 1.00 0.00 C ATOM 25631 H6R OL 660 123.343 3.502 51.202 1.00 0.00 H ATOM 25632 H6S OL 660 121.632 3.451 50.624 1.00 0.00 H ATOM 25633 C17 OL 660 122.322 5.391 51.377 1.00 0.00 C ATOM 25634 H7R OL 660 122.981 5.667 52.203 1.00 0.00 H ATOM 25635 H7S OL 660 122.859 5.661 50.466 1.00 0.00 H ATOM 25636 C18 OL 660 121.020 6.169 51.339 1.00 0.00 C ATOM 25637 H8R OL 660 120.399 5.905 52.197 1.00 0.00 H ATOM 25638 H8S OL 660 121.343 7.204 51.471 1.00 0.00 H ATOM 25639 C19 OL 660 120.168 5.998 50.108 1.00 0.00 C ATOM 25640 H9R OL 660 119.594 5.075 50.099 1.00 0.00 H ATOM 25641 C110 OL 660 119.902 6.834 49.066 1.00 0.00 C ATOM 25642 H10R OL 660 119.385 6.571 48.147 1.00 0.00 H ATOM 25643 C111 OL 660 120.778 7.996 48.839 1.00 0.00 C ATOM 25644 H11R OL 660 121.588 8.122 49.561 1.00 0.00 H ATOM 25645 H11S OL 660 121.346 7.807 47.926 1.00 0.00 H ATOM 25646 C112 OL 660 120.013 9.232 48.614 1.00 0.00 C ATOM 25647 H12R OL 660 119.130 9.133 47.979 1.00 0.00 H ATOM 25648 H12S OL 660 119.482 9.386 49.556 1.00 0.00 H ATOM 25649 C113 OL 660 120.924 10.461 48.290 1.00 0.00 C ATOM 25650 H13R OL 660 121.246 10.897 49.238 1.00 0.00 H ATOM 25651 H13S OL 660 121.786 10.118 47.714 1.00 0.00 H ATOM 25652 C114 OL 660 120.304 11.611 47.451 1.00 0.00 C ATOM 25653 H14R OL 660 121.160 12.270 47.292 1.00 0.00 H ATOM 25654 H14S OL 660 119.940 11.134 46.539 1.00 0.00 H ATOM 25655 C115 OL 660 119.108 12.318 48.184 1.00 0.00 C ATOM 25656 H15R OL 660 118.346 11.564 48.395 1.00 0.00 H ATOM 25657 H15S OL 660 119.410 12.510 49.215 1.00 0.00 H ATOM 25658 C116 OL 660 118.554 13.535 47.511 1.00 0.00 C ATOM 25659 H16R OL 660 119.392 14.233 47.459 1.00 0.00 H ATOM 25660 H16S OL 660 118.428 13.207 46.477 1.00 0.00 H ATOM 25661 C117 OL 660 117.380 14.301 48.092 1.00 0.00 C ATOM 25662 H17R OL 660 116.672 13.626 48.577 1.00 0.00 H ATOM 25663 H17S OL 660 117.882 14.672 48.988 1.00 0.00 H ATOM 25664 C118 OL 660 116.870 15.443 47.121 1.00 0.00 C ATOM 25665 H18R OL 660 116.526 16.293 47.715 1.00 0.00 H ATOM 25666 H18S OL 660 115.993 15.128 46.552 1.00 0.00 H ATOM 25667 H18T OL 660 117.701 15.728 46.473 1.00 0.00 H TER 25668 OL 660 ATOM 25668 C116 PA 661 89.932 26.398 40.909 1.00 0.00 C ATOM 25669 H16R PA 661 89.635 27.277 40.333 1.00 0.00 H ATOM 25670 H16S PA 661 89.327 25.598 40.479 1.00 0.00 H ATOM 25671 H16T PA 661 90.902 26.054 40.545 1.00 0.00 H ATOM 25672 C115 PA 661 89.907 26.608 42.382 1.00 0.00 C ATOM 25673 H15R PA 661 90.768 27.195 42.708 1.00 0.00 H ATOM 25674 H15S PA 661 89.984 25.577 42.734 1.00 0.00 H ATOM 25675 C114 PA 661 88.576 27.078 42.956 1.00 0.00 C ATOM 25676 H14R PA 661 87.786 26.575 42.394 1.00 0.00 H ATOM 25677 H14S PA 661 88.541 28.121 42.637 1.00 0.00 H ATOM 25678 C113 PA 661 88.534 26.958 44.462 1.00 0.00 C ATOM 25679 H13R PA 661 89.324 27.510 44.977 1.00 0.00 H ATOM 25680 H13S PA 661 88.630 25.902 44.720 1.00 0.00 H ATOM 25681 C112 PA 661 87.226 27.516 44.899 1.00 0.00 C ATOM 25682 H12R PA 661 87.349 28.591 44.750 1.00 0.00 H ATOM 25683 H12S PA 661 87.305 27.290 45.964 1.00 0.00 H ATOM 25684 C111 PA 661 85.896 26.772 44.442 1.00 0.00 C ATOM 25685 H11R PA 661 85.945 25.681 44.455 1.00 0.00 H ATOM 25686 H11S PA 661 85.781 27.023 43.386 1.00 0.00 H ATOM 25687 C110 PA 661 84.683 27.479 45.064 1.00 0.00 C ATOM 25688 H10R PA 661 84.781 28.500 44.691 1.00 0.00 H ATOM 25689 H10S PA 661 84.711 27.490 46.156 1.00 0.00 H ATOM 25690 C19 PA 661 83.328 27.079 44.553 1.00 0.00 C ATOM 25691 H9R PA 661 83.304 27.324 43.489 1.00 0.00 H ATOM 25692 H9S PA 661 82.461 27.661 44.874 1.00 0.00 H ATOM 25693 C18 PA 661 82.955 25.667 44.884 1.00 0.00 C ATOM 25694 H8R PA 661 83.541 24.946 44.309 1.00 0.00 H ATOM 25695 H8S PA 661 81.947 25.491 44.505 1.00 0.00 H ATOM 25696 C17 PA 661 83.060 25.283 46.433 1.00 0.00 C ATOM 25697 H7R PA 661 82.670 26.022 47.136 1.00 0.00 H ATOM 25698 H7S PA 661 84.135 25.258 46.626 1.00 0.00 H ATOM 25699 C16 PA 661 82.498 23.895 46.658 1.00 0.00 C ATOM 25700 H6R PA 661 82.916 23.274 45.863 1.00 0.00 H ATOM 25701 H6S PA 661 81.410 23.832 46.590 1.00 0.00 H ATOM 25702 C15 PA 661 82.979 23.263 47.918 1.00 0.00 C ATOM 25703 H5R PA 661 82.922 23.893 48.808 1.00 0.00 H ATOM 25704 H5S PA 661 84.034 23.097 47.694 1.00 0.00 H ATOM 25705 C14 PA 661 82.282 21.910 48.323 1.00 0.00 C ATOM 25706 H4R PA 661 83.012 21.125 48.532 1.00 0.00 H ATOM 25707 H4S PA 661 81.671 21.591 47.476 1.00 0.00 H ATOM 25708 C13 PA 661 81.359 22.161 49.544 1.00 0.00 C ATOM 25709 H3R PA 661 80.662 22.864 49.084 1.00 0.00 H ATOM 25710 H3S PA 661 81.804 22.761 50.340 1.00 0.00 H ATOM 25711 C12 PA 661 80.546 21.022 50.144 1.00 0.00 C ATOM 25712 H2R PA 661 81.265 20.629 50.866 1.00 0.00 H ATOM 25713 H2S PA 661 80.461 20.245 49.382 1.00 0.00 H ATOM 25714 C11 PGR 662 79.310 21.319 50.947 1.00 0.00 C ATOM 25715 O12 PGR 662 78.938 22.514 51.136 1.00 0.00 O ATOM 25716 O11 PGR 662 78.645 20.191 51.325 1.00 0.00 O ATOM 25717 C1 PGR 662 77.449 20.472 52.111 1.00 0.00 C ATOM 25718 HR PGR 662 76.688 21.025 51.556 1.00 0.00 H ATOM 25719 HS PGR 662 77.727 21.049 52.997 1.00 0.00 H ATOM 25720 C2 PGR 662 77.025 19.074 52.678 1.00 0.00 C ATOM 25721 HX PGR 662 76.128 19.082 53.303 1.00 0.00 H ATOM 25722 C3 PGR 662 78.168 18.411 53.449 1.00 0.00 C ATOM 25723 HA PGR 662 78.966 19.114 53.700 1.00 0.00 H ATOM 25724 HB PGR 662 78.614 17.759 52.694 1.00 0.00 H ATOM 25725 O31 PGR 662 77.680 17.681 54.634 1.00 0.00 O ATOM 25726 P31 PGR 662 77.052 18.479 55.817 1.00 0.00 P ATOM 25727 O32 PGR 662 75.567 18.620 55.320 1.00 0.00 O ATOM 25728 C31 PGR 662 74.657 17.534 55.344 1.00 0.00 C ATOM 25729 H1A PGR 662 74.358 17.369 56.382 1.00 0.00 H ATOM 25730 H1B PGR 662 75.061 16.636 54.868 1.00 0.00 H ATOM 25731 C32 PGR 662 73.490 17.953 54.469 1.00 0.00 C ATOM 25732 H2A PGR 662 73.879 18.222 53.483 1.00 0.00 H ATOM 25733 O35 PGR 662 72.836 19.097 55.065 1.00 0.00 O ATOM 25734 HO5A PGR 662 73.526 19.777 54.962 1.00 0.00 H ATOM 25735 C33 PGR 662 72.518 16.828 54.187 1.00 0.00 C ATOM 25736 H3A PGR 662 72.932 16.107 53.478 1.00 0.00 H ATOM 25737 H3B PGR 662 72.285 16.257 55.089 1.00 0.00 H ATOM 25738 O33 PGR 662 77.063 17.603 57.017 1.00 0.00 O ATOM 25739 O34 PGR 662 77.673 19.853 55.891 1.00 0.00 O ATOM 25740 O21 PGR 662 76.743 18.376 51.404 1.00 0.00 O ATOM 25741 C21 PGR 662 75.597 18.770 50.767 1.00 0.00 C ATOM 25742 O22 PGR 662 74.746 19.628 51.119 1.00 0.00 O ATOM 25743 O36 PGR 662 71.238 17.281 53.680 1.00 0.00 O ATOM 25744 HO6A PGR 662 70.815 16.422 53.501 1.00 0.00 H ATOM 25745 C12 OL 663 75.579 18.151 49.404 1.00 0.00 C ATOM 25746 H2R OL 663 75.538 17.067 49.536 1.00 0.00 H ATOM 25747 H2S OL 663 74.758 18.582 48.827 1.00 0.00 H ATOM 25748 C13 OL 663 76.960 18.490 48.727 1.00 0.00 C ATOM 25749 H3R OL 663 77.379 19.482 48.908 1.00 0.00 H ATOM 25750 H3S OL 663 77.599 17.702 49.130 1.00 0.00 H ATOM 25751 C14 OL 663 76.984 18.215 47.281 1.00 0.00 C ATOM 25752 H4R OL 663 76.537 17.221 47.211 1.00 0.00 H ATOM 25753 H4S OL 663 76.242 18.976 47.031 1.00 0.00 H ATOM 25754 C15 OL 663 78.348 18.462 46.597 1.00 0.00 C ATOM 25755 H5R OL 663 78.505 19.542 46.604 1.00 0.00 H ATOM 25756 H5S OL 663 79.138 17.994 47.187 1.00 0.00 H ATOM 25757 C16 OL 663 78.446 17.834 45.232 1.00 0.00 C ATOM 25758 H6R OL 663 79.520 17.762 45.050 1.00 0.00 H ATOM 25759 H6S OL 663 78.237 16.765 45.310 1.00 0.00 H ATOM 25760 C17 OL 663 77.646 18.479 44.066 1.00 0.00 C ATOM 25761 H7R OL 663 77.579 19.568 44.110 1.00 0.00 H ATOM 25762 H7S OL 663 78.209 18.214 43.169 1.00 0.00 H ATOM 25763 C18 OL 663 76.260 17.859 43.951 1.00 0.00 C ATOM 25764 H8R OL 663 76.294 16.770 44.019 1.00 0.00 H ATOM 25765 H8S OL 663 75.611 18.165 44.774 1.00 0.00 H ATOM 25766 C19 OL 663 75.587 18.223 42.620 1.00 0.00 C ATOM 25767 H9R OL 663 75.543 17.497 41.812 1.00 0.00 H ATOM 25768 C110 OL 663 74.968 19.326 42.393 1.00 0.00 C ATOM 25769 H10R OL 663 74.580 19.583 41.411 1.00 0.00 H ATOM 25770 C111 OL 663 74.989 20.498 43.239 1.00 0.00 C ATOM 25771 H11R OL 663 75.126 20.191 44.277 1.00 0.00 H ATOM 25772 H11S OL 663 75.898 21.065 43.027 1.00 0.00 H ATOM 25773 C112 OL 663 73.795 21.364 42.965 1.00 0.00 C ATOM 25774 H12R OL 663 73.670 21.581 41.902 1.00 0.00 H ATOM 25775 H12S OL 663 72.879 20.849 43.258 1.00 0.00 H ATOM 25776 C113 OL 663 73.948 22.745 43.523 1.00 0.00 C ATOM 25777 H13R OL 663 74.450 22.757 44.493 1.00 0.00 H ATOM 25778 H13S OL 663 74.720 23.331 43.020 1.00 0.00 H ATOM 25779 C114 OL 663 72.640 23.583 43.242 1.00 0.00 C ATOM 25780 H14R OL 663 72.432 23.611 42.170 1.00 0.00 H ATOM 25781 H14S OL 663 71.767 23.030 43.594 1.00 0.00 H ATOM 25782 C115 OL 663 72.698 24.987 43.964 1.00 0.00 C ATOM 25783 H15R OL 663 71.729 25.486 44.028 1.00 0.00 H ATOM 25784 H15S OL 663 72.873 24.780 45.022 1.00 0.00 H ATOM 25785 C116 OL 663 73.869 25.960 43.491 1.00 0.00 C ATOM 25786 H16R OL 663 73.944 26.697 44.293 1.00 0.00 H ATOM 25787 H16S OL 663 74.883 25.583 43.343 1.00 0.00 H ATOM 25788 C117 OL 663 73.398 26.631 42.242 1.00 0.00 C ATOM 25789 H17R OL 663 73.193 25.856 41.501 1.00 0.00 H ATOM 25790 H17S OL 663 72.523 27.162 42.623 1.00 0.00 H ATOM 25791 C118 OL 663 74.465 27.718 41.859 1.00 0.00 C ATOM 25792 H18R OL 663 74.202 28.435 41.079 1.00 0.00 H ATOM 25793 H18S OL 663 75.371 27.205 41.529 1.00 0.00 H ATOM 25794 H18T OL 663 74.786 28.298 42.726 1.00 0.00 H TER 25795 OL 663 ATOM 25795 C116 PA 664 62.791 97.320 33.795 1.00 0.00 C ATOM 25796 H16R PA 664 62.288 96.363 33.647 1.00 0.00 H ATOM 25797 H16S PA 664 63.878 97.300 33.688 1.00 0.00 H ATOM 25798 H16T PA 664 62.565 98.023 32.990 1.00 0.00 H ATOM 25799 C115 PA 664 62.467 97.791 35.228 1.00 0.00 C ATOM 25800 H15R PA 664 62.469 96.891 35.848 1.00 0.00 H ATOM 25801 H15S PA 664 61.424 98.089 35.349 1.00 0.00 H ATOM 25802 C114 PA 664 63.393 98.878 35.752 1.00 0.00 C ATOM 25803 H14R PA 664 63.292 99.811 35.194 1.00 0.00 H ATOM 25804 H14S PA 664 64.450 98.609 35.688 1.00 0.00 H ATOM 25805 C113 PA 664 63.054 99.303 37.179 1.00 0.00 C ATOM 25806 H13R PA 664 61.982 99.502 37.233 1.00 0.00 H ATOM 25807 H13S PA 664 63.535 100.238 37.475 1.00 0.00 H ATOM 25808 C112 PA 664 63.345 98.247 38.228 1.00 0.00 C ATOM 25809 H12R PA 664 64.368 97.915 38.039 1.00 0.00 H ATOM 25810 H12S PA 664 62.790 97.316 38.096 1.00 0.00 H ATOM 25811 C111 PA 664 63.511 98.909 39.687 1.00 0.00 C ATOM 25812 H11R PA 664 64.389 99.559 39.675 1.00 0.00 H ATOM 25813 H11S PA 664 63.747 98.210 40.492 1.00 0.00 H ATOM 25814 C110 PA 664 62.466 99.710 40.253 1.00 0.00 C ATOM 25815 H10R PA 664 61.692 99.013 40.579 1.00 0.00 H ATOM 25816 H10S PA 664 62.208 100.374 39.425 1.00 0.00 H ATOM 25817 C19 PA 664 62.920 100.470 41.551 1.00 0.00 C ATOM 25818 H9R PA 664 62.320 101.382 41.561 1.00 0.00 H ATOM 25819 H9S PA 664 63.943 100.830 41.420 1.00 0.00 H ATOM 25820 C18 PA 664 62.619 99.741 42.847 1.00 0.00 C ATOM 25821 H8R PA 664 62.972 98.709 42.797 1.00 0.00 H ATOM 25822 H8S PA 664 61.531 99.702 42.928 1.00 0.00 H ATOM 25823 C17 PA 664 63.059 100.544 44.147 1.00 0.00 C ATOM 25824 H7R PA 664 62.838 101.608 44.037 1.00 0.00 H ATOM 25825 H7S PA 664 64.145 100.492 44.249 1.00 0.00 H ATOM 25826 C16 PA 664 62.459 99.817 45.399 1.00 0.00 C ATOM 25827 H6R PA 664 63.045 98.913 45.576 1.00 0.00 H ATOM 25828 H6S PA 664 61.492 99.423 45.081 1.00 0.00 H ATOM 25829 C15 PA 664 62.379 100.700 46.724 1.00 0.00 C ATOM 25830 H5R PA 664 62.058 101.726 46.529 1.00 0.00 H ATOM 25831 H5S PA 664 63.380 100.693 47.161 1.00 0.00 H ATOM 25832 C14 PA 664 61.549 100.070 47.915 1.00 0.00 C ATOM 25833 H4R PA 664 61.882 99.034 48.005 1.00 0.00 H ATOM 25834 H4S PA 664 60.515 99.884 47.618 1.00 0.00 H ATOM 25835 C13 PA 664 61.741 100.696 49.291 1.00 0.00 C ATOM 25836 H3R PA 664 62.795 100.602 49.559 1.00 0.00 H ATOM 25837 H3S PA 664 61.219 100.058 50.007 1.00 0.00 H ATOM 25838 C12 PA 664 61.211 102.125 49.426 1.00 0.00 C ATOM 25839 H2R PA 664 61.587 102.794 48.650 1.00 0.00 H ATOM 25840 H2S PA 664 60.130 102.043 49.302 1.00 0.00 H ATOM 25841 C11 PGR 665 61.392 102.779 50.733 1.00 0.00 C ATOM 25842 O12 PGR 665 60.507 102.920 51.522 1.00 0.00 O ATOM 25843 O11 PGR 665 62.651 103.075 50.971 1.00 0.00 O ATOM 25844 C1 PGR 665 62.878 103.733 52.312 1.00 0.00 C ATOM 25845 HR PGR 665 63.933 103.664 52.587 1.00 0.00 H ATOM 25846 HS PGR 665 62.358 103.298 53.170 1.00 0.00 H ATOM 25847 C2 PGR 665 62.613 105.277 52.174 1.00 0.00 C ATOM 25848 HX PGR 665 63.068 105.724 51.286 1.00 0.00 H ATOM 25849 C3 PGR 665 63.312 105.988 53.363 1.00 0.00 C ATOM 25850 HA PGR 665 63.446 107.056 53.170 1.00 0.00 H ATOM 25851 HB PGR 665 64.283 105.491 53.441 1.00 0.00 H ATOM 25852 O31 PGR 665 62.658 105.713 54.595 1.00 0.00 O ATOM 25853 P31 PGR 665 63.358 105.836 56.030 1.00 0.00 P ATOM 25854 O32 PGR 665 63.462 107.500 56.258 1.00 0.00 O ATOM 25855 C31 PGR 665 62.295 108.312 56.488 1.00 0.00 C ATOM 25856 H1A PGR 665 61.495 107.875 55.885 1.00 0.00 H ATOM 25857 H1B PGR 665 62.488 109.322 56.116 1.00 0.00 H ATOM 25858 C32 PGR 665 61.975 108.488 58.071 1.00 0.00 C ATOM 25859 H2A PGR 665 62.918 108.635 58.604 1.00 0.00 H ATOM 25860 O35 PGR 665 61.348 107.232 58.538 1.00 0.00 O ATOM 25861 HO5A PGR 665 61.914 106.564 58.111 1.00 0.00 H ATOM 25862 C33 PGR 665 60.999 109.666 58.355 1.00 0.00 C ATOM 25863 H3A PGR 665 60.481 109.403 59.281 1.00 0.00 H ATOM 25864 H3B PGR 665 61.577 110.573 58.551 1.00 0.00 H ATOM 25865 O33 PGR 665 62.437 105.258 57.022 1.00 0.00 O ATOM 25866 O34 PGR 665 64.664 105.207 55.942 1.00 0.00 O ATOM 25867 O21 PGR 665 61.165 105.534 52.230 1.00 0.00 O ATOM 25868 C21 PGR 665 60.757 106.848 52.228 1.00 0.00 C ATOM 25869 O22 PGR 665 61.522 107.764 51.923 1.00 0.00 O ATOM 25870 O36 PGR 665 60.032 109.954 57.300 1.00 0.00 O ATOM 25871 HO6A PGR 665 60.490 110.535 56.667 1.00 0.00 H ATOM 25872 C12 OL 666 59.335 107.089 52.619 1.00 0.00 C ATOM 25873 H2R OL 666 59.385 107.285 53.692 1.00 0.00 H ATOM 25874 H2S OL 666 58.994 108.058 52.249 1.00 0.00 H ATOM 25875 C13 OL 666 58.459 105.859 52.191 1.00 0.00 C ATOM 25876 H3R OL 666 58.864 104.945 52.629 1.00 0.00 H ATOM 25877 H3S OL 666 57.489 105.946 52.685 1.00 0.00 H ATOM 25878 C14 OL 666 58.460 105.640 50.740 1.00 0.00 C ATOM 25879 H4R OL 666 57.998 106.540 50.330 1.00 0.00 H ATOM 25880 H4S OL 666 59.444 105.518 50.283 1.00 0.00 H ATOM 25881 C15 OL 666 57.591 104.453 50.270 1.00 0.00 C ATOM 25882 H5R OL 666 58.319 103.645 50.369 1.00 0.00 H ATOM 25883 H5S OL 666 56.821 104.290 51.027 1.00 0.00 H ATOM 25884 C16 OL 666 57.022 104.493 48.884 1.00 0.00 C ATOM 25885 H6R OL 666 56.337 105.320 48.683 1.00 0.00 H ATOM 25886 H6S OL 666 57.740 104.778 48.112 1.00 0.00 H ATOM 25887 C17 OL 666 56.403 103.143 48.475 1.00 0.00 C ATOM 25888 H7R OL 666 57.156 102.353 48.434 1.00 0.00 H ATOM 25889 H7S OL 666 55.853 102.772 49.343 1.00 0.00 H ATOM 25890 C18 OL 666 55.659 103.266 47.112 1.00 0.00 C ATOM 25891 H8R OL 666 54.750 103.871 47.118 1.00 0.00 H ATOM 25892 H8S OL 666 56.286 103.705 46.333 1.00 0.00 H ATOM 25893 C19 OL 666 55.189 101.903 46.804 1.00 0.00 C ATOM 25894 H9R OL 666 54.392 101.509 47.429 1.00 0.00 H ATOM 25895 C110 OL 666 55.667 101.157 45.826 1.00 0.00 C ATOM 25896 H10R OL 666 55.207 100.173 45.875 1.00 0.00 H ATOM 25897 C111 OL 666 56.795 101.446 44.887 1.00 0.00 C ATOM 25898 H11R OL 666 57.220 102.450 44.949 1.00 0.00 H ATOM 25899 H11S OL 666 57.651 100.814 45.133 1.00 0.00 H ATOM 25900 C112 OL 666 56.405 101.258 43.410 1.00 0.00 C ATOM 25901 H12R OL 666 56.201 100.205 43.205 1.00 0.00 H ATOM 25902 H12S OL 666 55.427 101.707 43.224 1.00 0.00 H ATOM 25903 C113 OL 666 57.367 101.974 42.468 1.00 0.00 C ATOM 25904 H13R OL 666 57.352 103.033 42.734 1.00 0.00 H ATOM 25905 H13S OL 666 58.418 101.787 42.699 1.00 0.00 H ATOM 25906 C114 OL 666 56.984 101.811 40.986 1.00 0.00 C ATOM 25907 H14R OL 666 55.923 101.943 40.768 1.00 0.00 H ATOM 25908 H14S OL 666 57.393 102.705 40.511 1.00 0.00 H ATOM 25909 C115 OL 666 57.550 100.538 40.384 1.00 0.00 C ATOM 25910 H15R OL 666 58.605 100.711 40.605 1.00 0.00 H ATOM 25911 H15S OL 666 57.429 99.650 41.007 1.00 0.00 H ATOM 25912 C116 OL 666 57.385 100.163 38.982 1.00 0.00 C ATOM 25913 H16R OL 666 57.416 101.095 38.413 1.00 0.00 H ATOM 25914 H16S OL 666 58.107 99.407 38.667 1.00 0.00 H ATOM 25915 C117 OL 666 55.974 99.833 38.598 1.00 0.00 C ATOM 25916 H17R OL 666 55.766 98.809 38.916 1.00 0.00 H ATOM 25917 H17S OL 666 55.204 100.483 39.019 1.00 0.00 H ATOM 25918 C118 OL 666 55.772 99.960 37.128 1.00 0.00 C ATOM 25919 H18R OL 666 55.779 101.003 36.805 1.00 0.00 H ATOM 25920 H18S OL 666 54.861 99.545 36.692 1.00 0.00 H ATOM 25921 H18T OL 666 56.502 99.584 36.407 1.00 0.00 H TER 25922 OL 666 ATOM 25922 C116 PA 667 67.148 130.795 38.111 1.00 0.00 C ATOM 25923 H16R PA 667 66.733 131.510 38.824 1.00 0.00 H ATOM 25924 H16S PA 667 66.832 131.164 37.133 1.00 0.00 H ATOM 25925 H16T PA 667 68.230 130.923 38.028 1.00 0.00 H ATOM 25926 C115 PA 667 66.805 129.323 38.420 1.00 0.00 C ATOM 25927 H15R PA 667 67.345 128.875 39.257 1.00 0.00 H ATOM 25928 H15S PA 667 67.052 128.682 37.571 1.00 0.00 H ATOM 25929 C114 PA 667 65.393 129.187 38.938 1.00 0.00 C ATOM 25930 H14R PA 667 64.709 129.505 38.147 1.00 0.00 H ATOM 25931 H14S PA 667 65.228 129.838 39.799 1.00 0.00 H ATOM 25932 C113 PA 667 65.049 127.679 39.299 1.00 0.00 C ATOM 25933 H13R PA 667 65.155 127.123 38.365 1.00 0.00 H ATOM 25934 H13S PA 667 64.020 127.671 39.664 1.00 0.00 H ATOM 25935 C112 PA 667 65.855 127.005 40.385 1.00 0.00 C ATOM 25936 H12R PA 667 65.981 127.743 41.181 1.00 0.00 H ATOM 25937 H12S PA 667 66.813 126.825 39.893 1.00 0.00 H ATOM 25938 C111 PA 667 65.198 125.693 40.888 1.00 0.00 C ATOM 25939 H11R PA 667 65.158 125.051 40.006 1.00 0.00 H ATOM 25940 H11S PA 667 64.156 125.940 41.099 1.00 0.00 H ATOM 25941 C110 PA 667 65.883 125.043 42.138 1.00 0.00 C ATOM 25942 H10R PA 667 66.333 125.791 42.793 1.00 0.00 H ATOM 25943 H10S PA 667 66.693 124.403 41.784 1.00 0.00 H ATOM 25944 C19 PA 667 64.938 124.191 42.983 1.00 0.00 C ATOM 25945 H9R PA 667 64.235 124.891 43.438 1.00 0.00 H ATOM 25946 H9S PA 667 65.401 123.769 43.877 1.00 0.00 H ATOM 25947 C18 PA 667 64.173 123.118 42.124 1.00 0.00 C ATOM 25948 H8R PA 667 64.413 122.191 42.648 1.00 0.00 H ATOM 25949 H8S PA 667 64.582 123.031 41.115 1.00 0.00 H ATOM 25950 C17 PA 667 62.626 123.244 42.077 1.00 0.00 C ATOM 25951 H7R PA 667 62.517 123.018 41.014 1.00 0.00 H ATOM 25952 H7S PA 667 62.351 124.295 41.969 1.00 0.00 H ATOM 25953 C16 PA 667 61.769 122.461 43.041 1.00 0.00 C ATOM 25954 H6R PA 667 61.877 121.375 43.033 1.00 0.00 H ATOM 25955 H6S PA 667 60.759 122.643 42.669 1.00 0.00 H ATOM 25956 C15 PA 667 61.800 123.046 44.387 1.00 0.00 C ATOM 25957 H5R PA 667 61.580 124.116 44.383 1.00 0.00 H ATOM 25958 H5S PA 667 62.823 123.076 44.767 1.00 0.00 H ATOM 25959 C14 PA 667 61.007 122.261 45.424 1.00 0.00 C ATOM 25960 H4R PA 667 61.247 121.197 45.486 1.00 0.00 H ATOM 25961 H4S PA 667 60.010 122.148 44.992 1.00 0.00 H ATOM 25962 C13 PA 667 60.981 122.867 46.793 1.00 0.00 C ATOM 25963 H3R PA 667 60.408 122.154 47.391 1.00 0.00 H ATOM 25964 H3S PA 667 60.418 123.799 46.710 1.00 0.00 H ATOM 25965 C12 PA 667 62.289 123.060 47.613 1.00 0.00 C ATOM 25966 H2R PA 667 62.918 123.852 47.199 1.00 0.00 H ATOM 25967 H2S PA 667 62.890 122.149 47.597 1.00 0.00 H ATOM 25968 C11 PC 668 61.997 123.519 48.988 1.00 0.00 C ATOM 25969 O12 PC 668 61.119 122.993 49.674 1.00 0.00 O ATOM 25970 O11 PC 668 62.797 124.486 49.351 1.00 0.00 O ATOM 25971 C1 PC 668 62.856 124.916 50.759 1.00 0.00 C ATOM 25972 HR PC 668 63.783 125.490 50.832 1.00 0.00 H ATOM 25973 HS PC 668 62.867 124.038 51.410 1.00 0.00 H ATOM 25974 C2 PC 668 61.648 125.886 51.120 1.00 0.00 C ATOM 25975 HX PC 668 62.002 126.502 51.951 1.00 0.00 H ATOM 25976 C3 PC 668 60.385 125.154 51.391 1.00 0.00 C ATOM 25977 HA PC 668 60.643 124.201 51.860 1.00 0.00 H ATOM 25978 HB PC 668 59.746 124.982 50.522 1.00 0.00 H ATOM 25979 O31 PC 668 59.656 125.898 52.325 1.00 0.00 O ATOM 25980 P31 PC 668 59.877 125.979 53.866 1.00 0.00 P ATOM 25981 O32 PC 668 58.631 125.123 54.309 1.00 0.00 O ATOM 25982 C31 PC 668 58.719 123.758 53.998 1.00 0.00 C ATOM 25983 H1A PC 668 59.670 123.263 54.209 1.00 0.00 H ATOM 25984 H1B PC 668 58.390 123.664 52.960 1.00 0.00 H ATOM 25985 C32 PC 668 57.649 123.181 54.910 1.00 0.00 C ATOM 25986 H2A PC 668 56.720 123.744 54.809 1.00 0.00 H ATOM 25987 H2B PC 668 57.892 123.218 55.973 1.00 0.00 H ATOM 25988 N31 PC 668 57.241 121.729 54.600 1.00 0.00 N ATOM 25989 C33 PC 668 56.842 121.607 53.181 1.00 0.00 C ATOM 25990 H3A PC 668 57.681 121.807 52.513 1.00 0.00 H ATOM 25991 H3B PC 668 55.984 122.226 52.916 1.00 0.00 H ATOM 25992 H3C PC 668 56.537 120.567 53.058 1.00 0.00 H ATOM 25993 C34 PC 668 58.205 120.771 55.029 1.00 0.00 C ATOM 25994 H4A PC 668 57.789 119.790 54.797 1.00 0.00 H ATOM 25995 H4B PC 668 58.428 120.830 56.095 1.00 0.00 H ATOM 25996 H4C PC 668 59.113 120.844 54.428 1.00 0.00 H ATOM 25997 C35 PC 668 56.026 121.446 55.319 1.00 0.00 C ATOM 25998 H5A PC 668 55.143 121.964 54.941 1.00 0.00 H ATOM 25999 H5B PC 668 56.244 121.628 56.372 1.00 0.00 H ATOM 26000 H5C PC 668 55.845 120.385 55.137 1.00 0.00 H ATOM 26001 O33 PC 668 61.112 125.231 54.332 1.00 0.00 O ATOM 26002 O34 PC 668 59.715 127.417 54.194 1.00 0.00 O ATOM 26003 O21 PC 668 61.336 126.759 49.966 1.00 0.00 O ATOM 26004 C21 PC 668 62.251 127.736 49.610 1.00 0.00 C ATOM 26005 O22 PC 668 63.413 127.761 50.099 1.00 0.00 O ATOM 26006 C12 OL 669 61.780 128.681 48.476 1.00 0.00 C ATOM 26007 H2R OL 669 60.703 128.549 48.359 1.00 0.00 H ATOM 26008 H2S OL 669 61.869 129.709 48.834 1.00 0.00 H ATOM 26009 C13 OL 669 62.513 128.509 47.213 1.00 0.00 C ATOM 26010 H3R OL 669 62.086 129.252 46.537 1.00 0.00 H ATOM 26011 H3S OL 669 63.562 128.716 47.436 1.00 0.00 H ATOM 26012 C14 OL 669 62.315 127.191 46.528 1.00 0.00 C ATOM 26013 H4R OL 669 62.416 126.343 47.208 1.00 0.00 H ATOM 26014 H4S OL 669 61.268 127.179 46.216 1.00 0.00 H ATOM 26015 C15 OL 669 63.343 126.929 45.392 1.00 0.00 C ATOM 26016 H5R OL 669 64.394 127.003 45.679 1.00 0.00 H ATOM 26017 H5S OL 669 63.211 125.927 44.979 1.00 0.00 H ATOM 26018 C16 OL 669 63.216 127.849 44.246 1.00 0.00 C ATOM 26019 H6R OL 669 63.562 128.856 44.489 1.00 0.00 H ATOM 26020 H6S OL 669 63.876 127.593 43.415 1.00 0.00 H ATOM 26021 C17 OL 669 61.779 127.982 43.742 1.00 0.00 C ATOM 26022 H7R OL 669 61.160 127.085 43.665 1.00 0.00 H ATOM 26023 H7S OL 669 61.284 128.681 44.420 1.00 0.00 H ATOM 26024 C18 OL 669 61.674 128.411 42.320 1.00 0.00 C ATOM 26025 H8R OL 669 62.248 129.338 42.257 1.00 0.00 H ATOM 26026 H8S OL 669 62.061 127.515 41.831 1.00 0.00 H ATOM 26027 C19 OL 669 60.215 128.649 41.984 1.00 0.00 C ATOM 26028 H9R OL 669 59.499 128.484 42.785 1.00 0.00 H ATOM 26029 C110 OL 669 59.745 129.265 40.909 1.00 0.00 C ATOM 26030 H10R OL 669 58.671 129.430 40.890 1.00 0.00 H ATOM 26031 C111 OL 669 60.562 130.020 39.912 1.00 0.00 C ATOM 26032 H11R OL 669 60.465 131.076 40.174 1.00 0.00 H ATOM 26033 H11S OL 669 61.603 129.723 40.054 1.00 0.00 H ATOM 26034 C112 OL 669 60.117 129.770 38.484 1.00 0.00 C ATOM 26035 H12R OL 669 60.781 130.370 37.858 1.00 0.00 H ATOM 26036 H12S OL 669 60.208 128.751 38.100 1.00 0.00 H ATOM 26037 C113 OL 669 58.654 130.242 38.271 1.00 0.00 C ATOM 26038 H13R OL 669 57.943 129.650 38.850 1.00 0.00 H ATOM 26039 H13S OL 669 58.663 131.241 38.711 1.00 0.00 H ATOM 26040 C114 OL 669 58.189 130.045 36.753 1.00 0.00 C ATOM 26041 H14R OL 669 58.036 128.971 36.623 1.00 0.00 H ATOM 26042 H14S OL 669 57.190 130.470 36.636 1.00 0.00 H ATOM 26043 C115 OL 669 59.318 130.533 35.751 1.00 0.00 C ATOM 26044 H15R OL 669 59.791 131.440 36.134 1.00 0.00 H ATOM 26045 H15S OL 669 60.063 129.735 35.759 1.00 0.00 H ATOM 26046 C116 OL 669 58.729 130.757 34.412 1.00 0.00 C ATOM 26047 H16R OL 669 59.451 130.376 33.687 1.00 0.00 H ATOM 26048 H16S OL 669 57.803 130.183 34.346 1.00 0.00 H ATOM 26049 C117 OL 669 58.377 132.185 34.042 1.00 0.00 C ATOM 26050 H17R OL 669 59.197 132.901 33.949 1.00 0.00 H ATOM 26051 H17S OL 669 57.957 132.153 33.034 1.00 0.00 H ATOM 26052 C118 OL 669 57.264 132.934 34.752 1.00 0.00 C ATOM 26053 H18R OL 669 57.001 133.847 34.214 1.00 0.00 H ATOM 26054 H18S OL 669 57.463 133.257 35.776 1.00 0.00 H ATOM 26055 H18T OL 669 56.322 132.388 34.843 1.00 0.00 H TER 26056 OL 669 ATOM 26056 C116 PA 670 142.372 10.726 37.832 1.00 0.00 C ATOM 26057 H16R PA 670 142.079 11.645 37.322 1.00 0.00 H ATOM 26058 H16S PA 670 141.402 10.309 38.109 1.00 0.00 H ATOM 26059 H16T PA 670 142.913 10.063 37.153 1.00 0.00 H ATOM 26060 C115 PA 670 143.155 11.153 39.009 1.00 0.00 C ATOM 26061 H15R PA 670 143.945 11.827 38.671 1.00 0.00 H ATOM 26062 H15S PA 670 143.573 10.219 39.390 1.00 0.00 H ATOM 26063 C114 PA 670 142.489 11.770 40.238 1.00 0.00 C ATOM 26064 H14R PA 670 141.759 11.095 40.687 1.00 0.00 H ATOM 26065 H14S PA 670 142.017 12.644 39.784 1.00 0.00 H ATOM 26066 C113 PA 670 143.520 12.205 41.319 1.00 0.00 C ATOM 26067 H13R PA 670 144.351 12.629 40.752 1.00 0.00 H ATOM 26068 H13S PA 670 143.786 11.288 41.849 1.00 0.00 H ATOM 26069 C112 PA 670 143.025 13.189 42.454 1.00 0.00 C ATOM 26070 H12R PA 670 142.702 12.608 43.320 1.00 0.00 H ATOM 26071 H12S PA 670 142.199 13.792 42.071 1.00 0.00 H ATOM 26072 C111 PA 670 144.209 13.949 43.043 1.00 0.00 C ATOM 26073 H11R PA 670 144.729 14.462 42.231 1.00 0.00 H ATOM 26074 H11S PA 670 144.888 13.189 43.436 1.00 0.00 H ATOM 26075 C110 PA 670 143.820 14.908 44.152 1.00 0.00 C ATOM 26076 H10R PA 670 143.318 15.790 43.748 1.00 0.00 H ATOM 26077 H10S PA 670 144.734 15.378 44.524 1.00 0.00 H ATOM 26078 C19 PA 670 142.854 14.429 45.268 1.00 0.00 C ATOM 26079 H9R PA 670 142.002 13.925 44.806 1.00 0.00 H ATOM 26080 H9S PA 670 142.507 15.309 45.812 1.00 0.00 H ATOM 26081 C18 PA 670 143.556 13.508 46.361 1.00 0.00 C ATOM 26082 H8R PA 670 143.596 12.463 46.046 1.00 0.00 H ATOM 26083 H8S PA 670 142.810 13.445 47.155 1.00 0.00 H ATOM 26084 C17 PA 670 144.810 13.979 47.103 1.00 0.00 C ATOM 26085 H7R PA 670 145.696 14.089 46.474 1.00 0.00 H ATOM 26086 H7S PA 670 145.130 13.250 47.850 1.00 0.00 H ATOM 26087 C16 PA 670 144.681 15.294 47.781 1.00 0.00 C ATOM 26088 H6R PA 670 144.544 16.214 47.209 1.00 0.00 H ATOM 26089 H6S PA 670 145.660 15.511 48.214 1.00 0.00 H ATOM 26090 C15 PA 670 143.770 15.222 49.022 1.00 0.00 C ATOM 26091 H5R PA 670 143.903 14.266 49.534 1.00 0.00 H ATOM 26092 H5S PA 670 142.729 15.182 48.695 1.00 0.00 H ATOM 26093 C14 PA 670 143.871 16.315 50.081 1.00 0.00 C ATOM 26094 H4R PA 670 143.694 17.333 49.728 1.00 0.00 H ATOM 26095 H4S PA 670 144.933 16.415 50.316 1.00 0.00 H ATOM 26096 C13 PA 670 143.133 16.020 51.290 1.00 0.00 C ATOM 26097 H3R PA 670 143.308 14.972 51.541 1.00 0.00 H ATOM 26098 H3S PA 670 142.089 16.316 51.164 1.00 0.00 H ATOM 26099 C12 PA 670 143.735 16.878 52.462 1.00 0.00 C ATOM 26100 H2R PA 670 144.810 16.692 52.506 1.00 0.00 H ATOM 26101 H2S PA 670 143.571 17.858 52.008 1.00 0.00 H ATOM 26102 C11 PGR 671 143.036 16.635 53.739 1.00 0.00 C ATOM 26103 O12 PGR 671 143.639 16.794 54.780 1.00 0.00 O ATOM 26104 O11 PGR 671 141.677 16.565 53.597 1.00 0.00 O ATOM 26105 C1 PGR 671 140.956 16.694 54.862 1.00 0.00 C ATOM 26106 HR PGR 671 141.267 15.965 55.615 1.00 0.00 H ATOM 26107 HS PGR 671 139.948 16.283 54.769 1.00 0.00 H ATOM 26108 C2 PGR 671 140.791 18.126 55.275 1.00 0.00 C ATOM 26109 HX PGR 671 141.694 18.701 55.057 1.00 0.00 H ATOM 26110 C3 PGR 671 140.236 18.313 56.699 1.00 0.00 C ATOM 26111 HA PGR 671 139.996 19.349 56.950 1.00 0.00 H ATOM 26112 HB PGR 671 140.968 17.831 57.351 1.00 0.00 H ATOM 26113 O31 PGR 671 139.003 17.539 56.844 1.00 0.00 O ATOM 26114 P31 PGR 671 138.609 17.041 58.301 1.00 0.00 P ATOM 26115 O32 PGR 671 138.650 18.373 59.188 1.00 0.00 O ATOM 26116 C31 PGR 671 137.589 19.292 59.160 1.00 0.00 C ATOM 26117 H1A PGR 671 136.665 18.801 59.478 1.00 0.00 H ATOM 26118 H1B PGR 671 137.379 19.652 58.149 1.00 0.00 H ATOM 26119 C32 PGR 671 137.951 20.568 60.022 1.00 0.00 C ATOM 26120 H2A PGR 671 137.225 21.379 59.920 1.00 0.00 H ATOM 26121 O35 PGR 671 139.077 21.078 59.362 1.00 0.00 O ATOM 26122 HO5A PGR 671 138.739 21.158 58.452 1.00 0.00 H ATOM 26123 C33 PGR 671 138.365 20.337 61.466 1.00 0.00 C ATOM 26124 H3A PGR 671 137.494 20.081 62.075 1.00 0.00 H ATOM 26125 H3B PGR 671 139.146 19.578 61.558 1.00 0.00 H ATOM 26126 O33 PGR 671 137.212 16.643 58.239 1.00 0.00 O ATOM 26127 O34 PGR 671 139.635 16.194 58.871 1.00 0.00 O ATOM 26128 O21 PGR 671 139.791 18.807 54.504 1.00 0.00 O ATOM 26129 C21 PGR 671 139.999 19.145 53.178 1.00 0.00 C ATOM 26130 O22 PGR 671 141.100 19.034 52.682 1.00 0.00 O ATOM 26131 O36 PGR 671 138.883 21.545 61.883 1.00 0.00 O ATOM 26132 HO6A PGR 671 139.476 21.762 61.142 1.00 0.00 H ATOM 26133 C12 OL 672 138.737 19.689 52.570 1.00 0.00 C ATOM 26134 H2R OL 672 137.904 19.525 53.256 1.00 0.00 H ATOM 26135 H2S OL 672 138.759 20.766 52.388 1.00 0.00 H ATOM 26136 C13 OL 672 138.558 18.991 51.211 1.00 0.00 C ATOM 26137 H3R OL 672 139.363 19.352 50.568 1.00 0.00 H ATOM 26138 H3S OL 672 138.778 17.923 51.264 1.00 0.00 H ATOM 26139 C14 OL 672 137.292 19.456 50.436 1.00 0.00 C ATOM 26140 H4R OL 672 136.483 19.064 51.057 1.00 0.00 H ATOM 26141 H4S OL 672 137.196 20.543 50.461 1.00 0.00 H ATOM 26142 C15 OL 672 137.251 19.104 48.977 1.00 0.00 C ATOM 26143 H5R OL 672 137.094 18.031 48.849 1.00 0.00 H ATOM 26144 H5S OL 672 136.285 19.395 48.558 1.00 0.00 H ATOM 26145 C16 OL 672 138.386 19.551 48.039 1.00 0.00 C ATOM 26146 H6R OL 672 139.403 19.522 48.435 1.00 0.00 H ATOM 26147 H6S OL 672 138.314 18.855 47.201 1.00 0.00 H ATOM 26148 C17 OL 672 138.408 21.024 47.656 1.00 0.00 C ATOM 26149 H7R OL 672 138.280 21.773 48.439 1.00 0.00 H ATOM 26150 H7S OL 672 139.391 21.151 47.198 1.00 0.00 H ATOM 26151 C18 OL 672 137.391 21.337 46.543 1.00 0.00 C ATOM 26152 H8R OL 672 137.609 20.744 45.652 1.00 0.00 H ATOM 26153 H8S OL 672 136.380 21.146 46.909 1.00 0.00 H ATOM 26154 C19 OL 672 137.663 22.760 46.160 1.00 0.00 C ATOM 26155 H9R OL 672 138.710 23.035 46.265 1.00 0.00 H ATOM 26156 C110 OL 672 136.783 23.688 46.007 1.00 0.00 C ATOM 26157 H10R OL 672 137.065 24.737 45.971 1.00 0.00 H ATOM 26158 C111 OL 672 135.297 23.439 45.929 1.00 0.00 C ATOM 26159 H11R OL 672 134.933 23.922 45.020 1.00 0.00 H ATOM 26160 H11S OL 672 135.045 22.388 45.775 1.00 0.00 H ATOM 26161 C112 OL 672 134.793 23.993 47.315 1.00 0.00 C ATOM 26162 H12R OL 672 135.226 23.392 48.117 1.00 0.00 H ATOM 26163 H12S OL 672 135.184 25.012 47.341 1.00 0.00 H ATOM 26164 C113 OL 672 133.256 23.934 47.417 1.00 0.00 C ATOM 26165 H13R OL 672 132.851 22.922 47.350 1.00 0.00 H ATOM 26166 H13S OL 672 133.077 24.298 48.431 1.00 0.00 H ATOM 26167 C114 OL 672 132.512 24.724 46.275 1.00 0.00 C ATOM 26168 H14R OL 672 132.827 25.763 46.155 1.00 0.00 H ATOM 26169 H14S OL 672 132.581 24.187 45.326 1.00 0.00 H ATOM 26170 C115 OL 672 130.981 24.733 46.477 1.00 0.00 C ATOM 26171 H15R OL 672 130.392 24.879 45.569 1.00 0.00 H ATOM 26172 H15S OL 672 130.656 23.716 46.705 1.00 0.00 H ATOM 26173 C116 OL 672 130.534 25.638 47.611 1.00 0.00 C ATOM 26174 H16R OL 672 130.978 25.250 48.529 1.00 0.00 H ATOM 26175 H16S OL 672 130.827 26.680 47.461 1.00 0.00 H ATOM 26176 C117 OL 672 129.010 25.668 47.714 1.00 0.00 C ATOM 26177 H17R OL 672 128.495 26.234 46.935 1.00 0.00 H ATOM 26178 H17S OL 672 128.662 24.635 47.654 1.00 0.00 H ATOM 26179 C118 OL 672 128.591 26.308 48.999 1.00 0.00 C ATOM 26180 H18R OL 672 127.567 26.638 48.813 1.00 0.00 H ATOM 26181 H18S OL 672 129.161 27.179 49.327 1.00 0.00 H ATOM 26182 H18T OL 672 128.587 25.589 49.822 1.00 0.00 H TER 26183 OL 672 ATOM 26183 C116 PA 673 1.311 67.491 38.369 1.00 0.00 C ATOM 26184 H16R PA 673 0.922 67.601 37.355 1.00 0.00 H ATOM 26185 H16S PA 673 2.328 67.876 38.278 1.00 0.00 H ATOM 26186 H16T PA 673 0.759 68.238 38.944 1.00 0.00 H ATOM 26187 C115 PA 673 1.286 65.999 38.880 1.00 0.00 C ATOM 26188 H15R PA 673 1.655 65.337 38.094 1.00 0.00 H ATOM 26189 H15S PA 673 0.318 65.544 39.096 1.00 0.00 H ATOM 26190 C114 PA 673 2.240 65.847 40.067 1.00 0.00 C ATOM 26191 H14R PA 673 3.196 66.352 39.913 1.00 0.00 H ATOM 26192 H14S PA 673 2.558 64.803 40.024 1.00 0.00 H ATOM 26193 C113 PA 673 1.641 66.126 41.476 1.00 0.00 C ATOM 26194 H13R PA 673 0.675 65.635 41.614 1.00 0.00 H ATOM 26195 H13S PA 673 1.322 67.162 41.603 1.00 0.00 H ATOM 26196 C112 PA 673 2.646 65.750 42.520 1.00 0.00 C ATOM 26197 H12R PA 673 3.367 66.567 42.595 1.00 0.00 H ATOM 26198 H12S PA 673 3.194 64.836 42.284 1.00 0.00 H ATOM 26199 C111 PA 673 2.028 65.756 43.935 1.00 0.00 C ATOM 26200 H11R PA 673 1.396 64.882 44.103 1.00 0.00 H ATOM 26201 H11S PA 673 1.363 66.599 44.134 1.00 0.00 H ATOM 26202 C110 PA 673 3.028 65.678 45.161 1.00 0.00 C ATOM 26203 H10R PA 673 3.576 66.620 45.233 1.00 0.00 H ATOM 26204 H10S PA 673 3.747 64.875 44.984 1.00 0.00 H ATOM 26205 C19 PA 673 2.404 65.273 46.432 1.00 0.00 C ATOM 26206 H9R PA 673 1.807 64.361 46.361 1.00 0.00 H ATOM 26207 H9S PA 673 1.740 66.104 46.677 1.00 0.00 H ATOM 26208 C18 PA 673 3.443 65.213 47.533 1.00 0.00 C ATOM 26209 H8R PA 673 4.098 66.081 47.435 1.00 0.00 H ATOM 26210 H8S PA 673 4.115 64.357 47.435 1.00 0.00 H ATOM 26211 C17 PA 673 2.893 65.223 48.975 1.00 0.00 C ATOM 26212 H7R PA 673 2.025 65.831 49.239 1.00 0.00 H ATOM 26213 H7S PA 673 3.645 65.646 49.645 1.00 0.00 H ATOM 26214 C16 PA 673 2.825 63.745 49.429 1.00 0.00 C ATOM 26215 H6R PA 673 3.654 63.157 49.029 1.00 0.00 H ATOM 26216 H6S PA 673 1.979 63.238 48.961 1.00 0.00 H ATOM 26217 C15 PA 673 2.554 63.552 50.967 1.00 0.00 C ATOM 26218 H5R PA 673 1.541 63.911 51.162 1.00 0.00 H ATOM 26219 H5S PA 673 3.150 64.281 51.519 1.00 0.00 H ATOM 26220 C14 PA 673 2.774 62.096 51.453 1.00 0.00 C ATOM 26221 H4R PA 673 3.805 61.735 51.428 1.00 0.00 H ATOM 26222 H4S PA 673 2.207 61.414 50.817 1.00 0.00 H ATOM 26223 C13 PA 673 2.088 61.818 52.740 1.00 0.00 C ATOM 26224 H3R PA 673 1.024 62.051 52.654 1.00 0.00 H ATOM 26225 H3S PA 673 2.474 62.556 53.446 1.00 0.00 H ATOM 26226 C12 PA 673 2.345 60.376 53.241 1.00 0.00 C ATOM 26227 H2R PA 673 2.105 59.641 52.470 1.00 0.00 H ATOM 26228 H2S PA 673 3.403 60.203 53.450 1.00 0.00 H ATOM 26229 C11 PGR 674 1.615 60.092 54.515 1.00 0.00 C ATOM 26230 O12 PGR 674 1.216 60.982 55.304 1.00 0.00 O ATOM 26231 O11 PGR 674 1.582 58.781 54.763 1.00 0.00 O ATOM 26232 C1 PGR 674 0.863 58.226 55.913 1.00 0.00 C ATOM 26233 HR PGR 674 -0.178 58.555 55.961 1.00 0.00 H ATOM 26234 HS PGR 674 1.343 58.567 56.834 1.00 0.00 H ATOM 26235 C2 PGR 674 0.973 56.706 55.949 1.00 0.00 C ATOM 26236 HX PGR 674 0.382 56.303 56.775 1.00 0.00 H ATOM 26237 C3 PGR 674 2.481 56.196 55.896 1.00 0.00 C ATOM 26238 HA PGR 674 2.867 56.286 54.877 1.00 0.00 H ATOM 26239 HB PGR 674 2.566 55.189 56.312 1.00 0.00 H ATOM 26240 O31 PGR 674 3.429 57.027 56.699 1.00 0.00 O ATOM 26241 P31 PGR 674 3.303 57.248 58.273 1.00 0.00 P ATOM 26242 O32 PGR 674 4.762 56.908 58.824 1.00 0.00 O ATOM 26243 C31 PGR 674 5.850 57.832 58.567 1.00 0.00 C ATOM 26244 H1A PGR 674 5.870 58.177 57.530 1.00 0.00 H ATOM 26245 H1B PGR 674 6.751 57.251 58.778 1.00 0.00 H ATOM 26246 C32 PGR 674 6.069 59.143 59.422 1.00 0.00 C ATOM 26247 H2A PGR 674 7.116 59.398 59.241 1.00 0.00 H ATOM 26248 O35 PGR 674 5.192 60.162 58.937 1.00 0.00 O ATOM 26249 HO5A PGR 674 4.424 59.599 58.732 1.00 0.00 H ATOM 26250 C33 PGR 674 5.894 58.980 61.005 1.00 0.00 C ATOM 26251 H3A PGR 674 4.865 58.632 61.124 1.00 0.00 H ATOM 26252 H3B PGR 674 6.681 58.307 61.356 1.00 0.00 H ATOM 26253 O33 PGR 674 3.023 58.691 58.459 1.00 0.00 O ATOM 26254 O34 PGR 674 2.431 56.179 58.837 1.00 0.00 O ATOM 26255 O21 PGR 674 0.337 56.261 54.676 1.00 0.00 O ATOM 26256 C21 PGR 674 0.063 54.919 54.591 1.00 0.00 C ATOM 26257 O22 PGR 674 0.365 54.053 55.397 1.00 0.00 O ATOM 26258 O36 PGR 674 5.994 60.280 61.617 1.00 0.00 O ATOM 26259 HO6A PGR 674 6.944 60.471 61.516 1.00 0.00 H ATOM 26260 C12 OL 675 -0.618 54.581 53.295 1.00 0.00 C ATOM 26261 H2R OL 675 -0.843 53.524 53.136 1.00 0.00 H ATOM 26262 H2S OL 675 -1.613 55.014 53.173 1.00 0.00 H ATOM 26263 C13 OL 675 0.310 55.051 52.182 1.00 0.00 C ATOM 26264 H3R OL 675 0.543 56.108 52.328 1.00 0.00 H ATOM 26265 H3S OL 675 1.272 54.616 52.463 1.00 0.00 H ATOM 26266 C14 OL 675 -0.081 54.707 50.713 1.00 0.00 C ATOM 26267 H4R OL 675 0.687 55.245 50.153 1.00 0.00 H ATOM 26268 H4S OL 675 -0.021 53.651 50.444 1.00 0.00 H ATOM 26269 C15 OL 675 -1.493 55.244 50.335 1.00 0.00 C ATOM 26270 H5R OL 675 -2.250 54.840 51.010 1.00 0.00 H ATOM 26271 H5S OL 675 -1.647 56.298 50.575 1.00 0.00 H ATOM 26272 C16 OL 675 -1.995 54.878 48.871 1.00 0.00 C ATOM 26273 H6R OL 675 -1.954 53.817 48.614 1.00 0.00 H ATOM 26274 H6S OL 675 -3.037 55.200 48.820 1.00 0.00 H ATOM 26275 C17 OL 675 -1.378 55.550 47.593 1.00 0.00 C ATOM 26276 H7R OL 675 -1.365 56.629 47.757 1.00 0.00 H ATOM 26277 H7S OL 675 -0.345 55.201 47.528 1.00 0.00 H ATOM 26278 C18 OL 675 -2.134 55.154 46.278 1.00 0.00 C ATOM 26279 H8R OL 675 -2.021 54.080 46.117 1.00 0.00 H ATOM 26280 H8S OL 675 -3.217 55.204 46.408 1.00 0.00 H ATOM 26281 C19 OL 675 -1.772 55.938 45.086 1.00 0.00 C ATOM 26282 H9R OL 675 -1.023 55.533 44.410 1.00 0.00 H ATOM 26283 C110 OL 675 -2.358 57.102 44.748 1.00 0.00 C ATOM 26284 H10R OL 675 -2.195 57.591 43.791 1.00 0.00 H ATOM 26285 C111 OL 675 -3.001 58.063 45.707 1.00 0.00 C ATOM 26286 H11R OL 675 -2.574 58.085 46.712 1.00 0.00 H ATOM 26287 H11S OL 675 -2.656 59.032 45.338 1.00 0.00 H ATOM 26288 C112 OL 675 -4.581 57.874 45.708 1.00 0.00 C ATOM 26289 H12R OL 675 -4.998 56.894 45.950 1.00 0.00 H ATOM 26290 H12S OL 675 -4.823 58.528 46.548 1.00 0.00 H ATOM 26291 C113 OL 675 -5.172 58.468 44.449 1.00 0.00 C ATOM 26292 H13R OL 675 -4.575 59.228 43.942 1.00 0.00 H ATOM 26293 H13S OL 675 -5.016 57.700 43.689 1.00 0.00 H ATOM 26294 C114 OL 675 -6.554 58.996 44.565 1.00 0.00 C ATOM 26295 H14R OL 675 -6.585 59.811 45.291 1.00 0.00 H ATOM 26296 H14S OL 675 -6.726 59.474 43.599 1.00 0.00 H ATOM 26297 C115 OL 675 -7.721 58.052 44.889 1.00 0.00 C ATOM 26298 H15R OL 675 -7.685 57.729 45.932 1.00 0.00 H ATOM 26299 H15S OL 675 -8.755 58.400 44.864 1.00 0.00 H ATOM 26300 C116 OL 675 -7.764 56.794 43.973 1.00 0.00 C ATOM 26301 H16R OL 675 -7.490 57.019 42.940 1.00 0.00 H ATOM 26302 H16S OL 675 -6.884 56.194 44.213 1.00 0.00 H ATOM 26303 C117 OL 675 -9.082 56.037 43.959 1.00 0.00 C ATOM 26304 H17R OL 675 -9.703 56.591 43.252 1.00 0.00 H ATOM 26305 H17S OL 675 -9.054 55.025 43.549 1.00 0.00 H ATOM 26306 C118 OL 675 -9.864 55.978 45.307 1.00 0.00 C ATOM 26307 H18R OL 675 -10.181 57.004 45.506 1.00 0.00 H ATOM 26308 H18S OL 675 -9.369 55.643 46.221 1.00 0.00 H ATOM 26309 H18T OL 675 -10.762 55.365 45.215 1.00 0.00 H TER 26310 OL 675 ATOM 26310 C116 PA 676 81.536 16.595 41.496 1.00 0.00 C ATOM 26311 H16R PA 676 80.479 16.358 41.636 1.00 0.00 H ATOM 26312 H16S PA 676 81.955 16.460 42.495 1.00 0.00 H ATOM 26313 H16T PA 676 81.876 15.778 40.857 1.00 0.00 H ATOM 26314 C115 PA 676 81.821 18.095 41.073 1.00 0.00 C ATOM 26315 H15R PA 676 81.176 18.300 40.216 1.00 0.00 H ATOM 26316 H15S PA 676 82.859 18.111 40.735 1.00 0.00 H ATOM 26317 C114 PA 676 81.523 18.879 42.337 1.00 0.00 C ATOM 26318 H14R PA 676 82.223 18.531 43.100 1.00 0.00 H ATOM 26319 H14S PA 676 80.523 18.582 42.659 1.00 0.00 H ATOM 26320 C113 PA 676 81.783 20.401 42.216 1.00 0.00 C ATOM 26321 H13R PA 676 81.285 20.809 41.334 1.00 0.00 H ATOM 26322 H13S PA 676 82.843 20.618 42.065 1.00 0.00 H ATOM 26323 C112 PA 676 81.318 21.113 43.461 1.00 0.00 C ATOM 26324 H12R PA 676 82.099 21.871 43.553 1.00 0.00 H ATOM 26325 H12S PA 676 81.443 20.477 44.341 1.00 0.00 H ATOM 26326 C111 PA 676 79.916 21.713 43.464 1.00 0.00 C ATOM 26327 H11R PA 676 79.075 21.020 43.393 1.00 0.00 H ATOM 26328 H11S PA 676 79.835 22.335 42.570 1.00 0.00 H ATOM 26329 C110 PA 676 79.655 22.640 44.685 1.00 0.00 C ATOM 26330 H10R PA 676 79.889 23.655 44.357 1.00 0.00 H ATOM 26331 H10S PA 676 80.245 22.401 45.573 1.00 0.00 H ATOM 26332 C19 PA 676 78.142 22.643 45.144 1.00 0.00 C ATOM 26333 H9R PA 676 77.957 21.665 45.595 1.00 0.00 H ATOM 26334 H9S PA 676 77.403 22.845 44.366 1.00 0.00 H ATOM 26335 C18 PA 676 77.842 23.614 46.252 1.00 0.00 C ATOM 26336 H8R PA 676 78.270 24.595 46.035 1.00 0.00 H ATOM 26337 H8S PA 676 78.487 23.250 47.054 1.00 0.00 H ATOM 26338 C17 PA 676 76.335 23.845 46.652 1.00 0.00 C ATOM 26339 H7R PA 676 76.012 23.085 47.366 1.00 0.00 H ATOM 26340 H7S PA 676 75.747 23.684 45.746 1.00 0.00 H ATOM 26341 C16 PA 676 76.082 25.295 47.118 1.00 0.00 C ATOM 26342 H6R PA 676 75.035 25.393 47.411 1.00 0.00 H ATOM 26343 H6S PA 676 76.201 25.972 46.269 1.00 0.00 H ATOM 26344 C15 PA 676 76.930 25.806 48.356 1.00 0.00 C ATOM 26345 H5R PA 676 77.974 25.930 48.061 1.00 0.00 H ATOM 26346 H5S PA 676 76.964 25.114 49.200 1.00 0.00 H ATOM 26347 C14 PA 676 76.398 27.128 48.992 1.00 0.00 C ATOM 26348 H4R PA 676 76.347 27.809 48.140 1.00 0.00 H ATOM 26349 H4S PA 676 77.086 27.544 49.731 1.00 0.00 H ATOM 26350 C13 PA 676 74.979 26.962 49.601 1.00 0.00 C ATOM 26351 H3R PA 676 74.845 26.116 50.277 1.00 0.00 H ATOM 26352 H3S PA 676 74.222 26.583 48.911 1.00 0.00 H ATOM 26353 C12 PA 676 74.621 28.257 50.376 1.00 0.00 C ATOM 26354 H2R PA 676 75.466 28.497 51.024 1.00 0.00 H ATOM 26355 H2S PA 676 74.557 29.113 49.702 1.00 0.00 H ATOM 26356 C11 PC 677 73.430 28.195 51.313 1.00 0.00 C ATOM 26357 O12 PC 677 72.374 27.716 50.897 1.00 0.00 O ATOM 26358 O11 PC 677 73.545 28.862 52.488 1.00 0.00 O ATOM 26359 C1 PC 677 72.352 28.797 53.320 1.00 0.00 C ATOM 26360 HR PC 677 72.086 27.751 53.494 1.00 0.00 H ATOM 26361 HS PC 677 71.486 29.338 52.931 1.00 0.00 H ATOM 26362 C2 PC 677 72.729 29.589 54.576 1.00 0.00 C ATOM 26363 HX PC 677 73.682 29.348 55.053 1.00 0.00 H ATOM 26364 C3 PC 677 71.669 29.406 55.637 1.00 0.00 C ATOM 26365 HA PC 677 71.287 28.393 55.787 1.00 0.00 H ATOM 26366 HB PC 677 70.827 30.030 55.326 1.00 0.00 H ATOM 26367 O31 PC 677 72.248 29.847 56.850 1.00 0.00 O ATOM 26368 P31 PC 677 71.701 29.476 58.277 1.00 0.00 P ATOM 26369 O32 PC 677 70.355 30.245 58.476 1.00 0.00 O ATOM 26370 C31 PC 677 69.226 29.773 57.910 1.00 0.00 C ATOM 26371 H1A PC 677 68.993 28.719 58.083 1.00 0.00 H ATOM 26372 H1B PC 677 69.342 29.960 56.839 1.00 0.00 H ATOM 26373 C32 PC 677 67.979 30.544 58.445 1.00 0.00 C ATOM 26374 H2A PC 677 67.916 31.535 57.993 1.00 0.00 H ATOM 26375 H2B PC 677 67.986 30.788 59.508 1.00 0.00 H ATOM 26376 N31 PC 677 66.649 30.026 58.050 1.00 0.00 N ATOM 26377 C33 PC 677 66.489 29.968 56.585 1.00 0.00 C ATOM 26378 H3A PC 677 65.472 29.632 56.376 1.00 0.00 H ATOM 26379 H3B PC 677 67.231 29.368 56.056 1.00 0.00 H ATOM 26380 H3C PC 677 66.569 30.995 56.225 1.00 0.00 H ATOM 26381 C34 PC 677 66.578 28.650 58.574 1.00 0.00 C ATOM 26382 H4A PC 677 66.979 28.587 59.587 1.00 0.00 H ATOM 26383 H4B PC 677 67.201 27.968 57.993 1.00 0.00 H ATOM 26384 H4C PC 677 65.564 28.250 58.613 1.00 0.00 H ATOM 26385 C35 PC 677 65.594 30.947 58.615 1.00 0.00 C ATOM 26386 H5A PC 677 65.779 31.915 58.148 1.00 0.00 H ATOM 26387 H5B PC 677 65.796 31.171 59.664 1.00 0.00 H ATOM 26388 H5C PC 677 64.588 30.603 58.374 1.00 0.00 H ATOM 26389 O33 PC 677 71.486 28.030 58.451 1.00 0.00 O ATOM 26390 O34 PC 677 72.647 30.056 59.308 1.00 0.00 O ATOM 26391 O21 PC 677 72.813 31.042 54.247 1.00 0.00 O ATOM 26392 C21 PC 677 73.950 31.491 53.737 1.00 0.00 C ATOM 26393 O22 PC 677 75.060 30.987 53.886 1.00 0.00 O ATOM 26394 C12 OL 678 73.656 32.661 52.867 1.00 0.00 C ATOM 26395 H2R OL 678 72.643 32.964 53.139 1.00 0.00 H ATOM 26396 H2S OL 678 74.322 33.441 53.240 1.00 0.00 H ATOM 26397 C13 OL 678 73.975 32.352 51.343 1.00 0.00 C ATOM 26398 H3R OL 678 73.544 31.396 51.038 1.00 0.00 H ATOM 26399 H3S OL 678 73.710 33.155 50.651 1.00 0.00 H ATOM 26400 C14 OL 678 75.483 32.303 51.117 1.00 0.00 C ATOM 26401 H4R OL 678 76.030 32.757 51.946 1.00 0.00 H ATOM 26402 H4S OL 678 75.841 31.273 51.176 1.00 0.00 H ATOM 26403 C15 OL 678 75.973 32.979 49.847 1.00 0.00 C ATOM 26404 H5R OL 678 75.378 32.578 49.023 1.00 0.00 H ATOM 26405 H5S OL 678 75.734 34.023 50.059 1.00 0.00 H ATOM 26406 C16 OL 678 77.462 32.735 49.739 1.00 0.00 C ATOM 26407 H6R OL 678 77.943 33.300 50.540 1.00 0.00 H ATOM 26408 H6S OL 678 77.776 31.782 50.169 1.00 0.00 H ATOM 26409 C17 OL 678 78.040 33.101 48.390 1.00 0.00 C ATOM 26410 H7R OL 678 78.071 34.185 48.263 1.00 0.00 H ATOM 26411 H7S OL 678 79.072 32.748 48.438 1.00 0.00 H ATOM 26412 C18 OL 678 77.387 32.605 47.121 1.00 0.00 C ATOM 26413 H8R OL 678 76.526 33.175 46.765 1.00 0.00 H ATOM 26414 H8S OL 678 78.023 32.846 46.267 1.00 0.00 H ATOM 26415 C19 OL 678 77.081 31.165 47.025 1.00 0.00 C ATOM 26416 H9R OL 678 76.306 30.815 47.701 1.00 0.00 H ATOM 26417 C110 OL 678 77.616 30.218 46.225 1.00 0.00 C ATOM 26418 H10R OL 678 77.272 29.192 46.329 1.00 0.00 H ATOM 26419 C111 OL 678 78.702 30.336 45.143 1.00 0.00 C ATOM 26420 H11R OL 678 78.170 30.391 44.192 1.00 0.00 H ATOM 26421 H11S OL 678 79.186 31.308 45.259 1.00 0.00 H ATOM 26422 C112 OL 678 79.732 29.277 45.019 1.00 0.00 C ATOM 26423 H12R OL 678 80.339 29.548 44.152 1.00 0.00 H ATOM 26424 H12S OL 678 80.327 29.334 45.933 1.00 0.00 H ATOM 26425 C113 OL 678 79.054 27.930 44.934 1.00 0.00 C ATOM 26426 H13R OL 678 79.828 27.162 44.874 1.00 0.00 H ATOM 26427 H13S OL 678 78.522 27.745 45.870 1.00 0.00 H ATOM 26428 C114 OL 678 78.066 27.713 43.858 1.00 0.00 C ATOM 26429 H14R OL 678 77.550 26.751 43.831 1.00 0.00 H ATOM 26430 H14S OL 678 77.178 28.310 44.076 1.00 0.00 H ATOM 26431 C115 OL 678 78.607 27.911 42.405 1.00 0.00 C ATOM 26432 H15R OL 678 77.879 27.698 41.619 1.00 0.00 H ATOM 26433 H15S OL 678 78.711 28.980 42.208 1.00 0.00 H ATOM 26434 C116 OL 678 79.903 27.300 41.966 1.00 0.00 C ATOM 26435 H16R OL 678 79.918 27.507 40.894 1.00 0.00 H ATOM 26436 H16S OL 678 80.757 27.831 42.391 1.00 0.00 H ATOM 26437 C117 OL 678 80.048 25.799 41.963 1.00 0.00 C ATOM 26438 H17R OL 678 80.095 25.312 42.939 1.00 0.00 H ATOM 26439 H17S OL 678 79.165 25.346 41.508 1.00 0.00 H ATOM 26440 C118 OL 678 81.170 25.308 41.095 1.00 0.00 C ATOM 26441 H18R OL 678 80.980 24.257 40.866 1.00 0.00 H ATOM 26442 H18S OL 678 82.227 25.388 41.359 1.00 0.00 H ATOM 26443 H18T OL 678 80.993 25.759 40.117 1.00 0.00 H TER 26444 OL 678 ATOM 26444 C116 PA 679 20.317 27.033 43.492 1.00 0.00 C ATOM 26445 H16R PA 679 19.494 27.100 42.778 1.00 0.00 H ATOM 26446 H16S PA 679 20.775 26.045 43.403 1.00 0.00 H ATOM 26447 H16T PA 679 21.029 27.743 43.066 1.00 0.00 H ATOM 26448 C115 PA 679 19.813 27.309 44.845 1.00 0.00 C ATOM 26449 H15R PA 679 19.576 28.374 44.786 1.00 0.00 H ATOM 26450 H15S PA 679 20.578 27.417 45.617 1.00 0.00 H ATOM 26451 C114 PA 679 18.662 26.391 45.289 1.00 0.00 C ATOM 26452 H14R PA 679 19.096 25.414 45.509 1.00 0.00 H ATOM 26453 H14S PA 679 17.948 26.307 44.467 1.00 0.00 H ATOM 26454 C113 PA 679 17.731 26.848 46.418 1.00 0.00 C ATOM 26455 H13R PA 679 17.302 27.839 46.259 1.00 0.00 H ATOM 26456 H13S PA 679 18.334 26.994 47.317 1.00 0.00 H ATOM 26457 C112 PA 679 16.565 25.860 46.618 1.00 0.00 C ATOM 26458 H12R PA 679 16.793 24.994 45.992 1.00 0.00 H ATOM 26459 H12S PA 679 15.699 26.360 46.180 1.00 0.00 H ATOM 26460 C111 PA 679 16.254 25.452 48.042 1.00 0.00 C ATOM 26461 H11R PA 679 15.550 26.125 48.536 1.00 0.00 H ATOM 26462 H11S PA 679 17.165 25.421 48.643 1.00 0.00 H ATOM 26463 C110 PA 679 15.629 24.064 48.054 1.00 0.00 C ATOM 26464 H10R PA 679 16.237 23.389 47.447 1.00 0.00 H ATOM 26465 H10S PA 679 14.678 24.177 47.530 1.00 0.00 H ATOM 26466 C19 PA 679 15.466 23.543 49.417 1.00 0.00 C ATOM 26467 H9R PA 679 14.962 24.250 50.078 1.00 0.00 H ATOM 26468 H9S PA 679 16.454 23.615 49.876 1.00 0.00 H ATOM 26469 C18 PA 679 14.964 22.173 49.628 1.00 0.00 C ATOM 26470 H8R PA 679 15.560 21.440 49.080 1.00 0.00 H ATOM 26471 H8S PA 679 13.982 22.005 49.181 1.00 0.00 H ATOM 26472 C17 PA 679 14.924 21.611 51.108 1.00 0.00 C ATOM 26473 H7R PA 679 14.129 20.862 51.127 1.00 0.00 H ATOM 26474 H7S PA 679 14.518 22.391 51.755 1.00 0.00 H ATOM 26475 C16 PA 679 16.346 21.211 51.639 1.00 0.00 C ATOM 26476 H6R PA 679 17.000 22.079 51.535 1.00 0.00 H ATOM 26477 H6S PA 679 16.719 20.434 50.967 1.00 0.00 H ATOM 26478 C15 PA 679 16.381 20.802 53.117 1.00 0.00 C ATOM 26479 H5R PA 679 15.528 20.139 53.272 1.00 0.00 H ATOM 26480 H5S PA 679 16.265 21.644 53.802 1.00 0.00 H ATOM 26481 C14 PA 679 17.673 20.145 53.632 1.00 0.00 C ATOM 26482 H4R PA 679 18.543 20.774 53.431 1.00 0.00 H ATOM 26483 H4S PA 679 17.619 19.239 53.025 1.00 0.00 H ATOM 26484 C13 PA 679 17.514 19.683 55.092 1.00 0.00 C ATOM 26485 H3R PA 679 18.431 19.154 55.359 1.00 0.00 H ATOM 26486 H3S PA 679 16.768 18.890 55.174 1.00 0.00 H ATOM 26487 C12 PA 679 16.997 20.641 56.148 1.00 0.00 C ATOM 26488 H2R PA 679 15.961 20.910 55.931 1.00 0.00 H ATOM 26489 H2S PA 679 17.579 21.564 56.163 1.00 0.00 H ATOM 26490 C11 PGR 680 17.170 20.108 57.516 1.00 0.00 C ATOM 26491 O12 PGR 680 17.762 20.702 58.406 1.00 0.00 O ATOM 26492 O11 PGR 680 16.610 18.888 57.653 1.00 0.00 O ATOM 26493 C1 PGR 680 16.705 18.231 58.955 1.00 0.00 C ATOM 26494 HR PGR 680 16.196 18.853 59.696 1.00 0.00 H ATOM 26495 HS PGR 680 17.773 18.209 59.184 1.00 0.00 H ATOM 26496 C2 PGR 680 16.096 16.836 58.964 1.00 0.00 C ATOM 26497 HX PGR 680 15.010 16.939 58.903 1.00 0.00 H ATOM 26498 C3 PGR 680 16.458 15.974 60.234 1.00 0.00 C ATOM 26499 HA PGR 680 17.536 16.122 60.341 1.00 0.00 H ATOM 26500 HB PGR 680 16.222 14.953 59.923 1.00 0.00 H ATOM 26501 O31 PGR 680 15.774 16.423 61.381 1.00 0.00 O ATOM 26502 P31 PGR 680 16.228 15.861 62.852 1.00 0.00 P ATOM 26503 O32 PGR 680 16.343 14.306 62.641 1.00 0.00 O ATOM 26504 C31 PGR 680 15.275 13.524 62.916 1.00 0.00 C ATOM 26505 H1A PGR 680 15.523 12.563 62.460 1.00 0.00 H ATOM 26506 H1B PGR 680 14.365 13.889 62.432 1.00 0.00 H ATOM 26507 C32 PGR 680 15.123 13.303 64.416 1.00 0.00 C ATOM 26508 H2A PGR 680 15.266 14.217 64.999 1.00 0.00 H ATOM 26509 O35 PGR 680 16.192 12.370 64.798 1.00 0.00 O ATOM 26510 HO5A PGR 680 16.881 12.926 65.204 1.00 0.00 H ATOM 26511 C33 PGR 680 13.768 12.643 64.734 1.00 0.00 C ATOM 26512 H3A PGR 680 13.727 12.130 65.699 1.00 0.00 H ATOM 26513 H3B PGR 680 13.043 13.460 64.745 1.00 0.00 H ATOM 26514 O33 PGR 680 17.645 16.227 63.037 1.00 0.00 O ATOM 26515 O34 PGR 680 15.238 16.292 63.922 1.00 0.00 O ATOM 26516 O21 PGR 680 16.600 15.978 57.830 1.00 0.00 O ATOM 26517 C21 PGR 680 17.886 15.712 57.647 1.00 0.00 C ATOM 26518 O22 PGR 680 18.852 16.102 58.272 1.00 0.00 O ATOM 26519 O36 PGR 680 13.317 11.818 63.713 1.00 0.00 O ATOM 26520 HO6A PGR 680 13.881 11.037 63.573 1.00 0.00 H ATOM 26521 C12 OL 681 18.169 14.804 56.493 1.00 0.00 C ATOM 26522 H2R OL 681 19.248 14.645 56.554 1.00 0.00 H ATOM 26523 H2S OL 681 17.750 13.843 56.798 1.00 0.00 H ATOM 26524 C13 OL 681 17.568 15.333 55.159 1.00 0.00 C ATOM 26525 H3R OL 681 16.483 15.303 55.278 1.00 0.00 H ATOM 26526 H3S OL 681 17.918 16.339 54.921 1.00 0.00 H ATOM 26527 C14 OL 681 17.853 14.327 54.065 1.00 0.00 C ATOM 26528 H4R OL 681 18.932 14.263 53.912 1.00 0.00 H ATOM 26529 H4S OL 681 17.561 13.364 54.490 1.00 0.00 H ATOM 26530 C15 OL 681 17.091 14.520 52.792 1.00 0.00 C ATOM 26531 H5R OL 681 17.561 13.771 52.151 1.00 0.00 H ATOM 26532 H5S OL 681 16.076 14.164 52.981 1.00 0.00 H ATOM 26533 C16 OL 681 17.122 15.865 52.040 1.00 0.00 C ATOM 26534 H6R OL 681 16.979 16.639 52.797 1.00 0.00 H ATOM 26535 H6S OL 681 18.171 16.085 51.835 1.00 0.00 H ATOM 26536 C17 OL 681 16.156 16.120 50.895 1.00 0.00 C ATOM 26537 H7R OL 681 16.414 15.479 50.049 1.00 0.00 H ATOM 26538 H7S OL 681 15.199 15.601 50.985 1.00 0.00 H ATOM 26539 C18 OL 681 16.149 17.558 50.415 1.00 0.00 C ATOM 26540 H8R OL 681 15.428 17.706 49.608 1.00 0.00 H ATOM 26541 H8S OL 681 15.750 18.134 51.252 1.00 0.00 H ATOM 26542 C19 OL 681 17.489 18.210 50.064 1.00 0.00 C ATOM 26543 H9R OL 681 18.323 17.960 50.715 1.00 0.00 H ATOM 26544 C110 OL 681 17.787 18.732 48.850 1.00 0.00 C ATOM 26545 H10R OL 681 18.830 18.947 48.632 1.00 0.00 H ATOM 26546 C111 OL 681 16.871 19.064 47.818 1.00 0.00 C ATOM 26547 H11R OL 681 15.971 19.521 48.236 1.00 0.00 H ATOM 26548 H11S OL 681 17.382 19.861 47.275 1.00 0.00 H ATOM 26549 C112 OL 681 16.703 17.910 46.816 1.00 0.00 C ATOM 26550 H12R OL 681 16.189 17.102 47.341 1.00 0.00 H ATOM 26551 H12S OL 681 16.051 18.148 45.973 1.00 0.00 H ATOM 26552 C113 OL 681 18.104 17.409 46.295 1.00 0.00 C ATOM 26553 H13R OL 681 18.359 18.060 45.456 1.00 0.00 H ATOM 26554 H13S OL 681 18.933 17.510 46.998 1.00 0.00 H ATOM 26555 C114 OL 681 18.154 15.977 45.874 1.00 0.00 C ATOM 26556 H14R OL 681 19.192 15.716 45.659 1.00 0.00 H ATOM 26557 H14S OL 681 18.064 15.190 46.626 1.00 0.00 H ATOM 26558 C115 OL 681 17.091 15.543 44.936 1.00 0.00 C ATOM 26559 H15R OL 681 17.036 14.453 44.897 1.00 0.00 H ATOM 26560 H15S OL 681 16.129 15.809 45.379 1.00 0.00 H ATOM 26561 C116 OL 681 17.228 16.061 43.513 1.00 0.00 C ATOM 26562 H16R OL 681 16.189 16.160 43.193 1.00 0.00 H ATOM 26563 H16S OL 681 17.464 17.121 43.394 1.00 0.00 H ATOM 26564 C117 OL 681 17.993 15.201 42.578 1.00 0.00 C ATOM 26565 H17R OL 681 19.007 15.128 42.977 1.00 0.00 H ATOM 26566 H17S OL 681 17.628 14.173 42.516 1.00 0.00 H ATOM 26567 C118 OL 681 18.028 15.839 41.148 1.00 0.00 C ATOM 26568 H18R OL 681 17.023 16.062 40.783 1.00 0.00 H ATOM 26569 H18S OL 681 18.523 15.163 40.447 1.00 0.00 H ATOM 26570 H18T OL 681 18.452 16.843 41.084 1.00 0.00 H TER 26571 OL 681 ATOM 26571 C116 PA 682 97.393 141.489 41.319 1.00 0.00 C ATOM 26572 H16R PA 682 97.865 140.508 41.233 1.00 0.00 H ATOM 26573 H16S PA 682 96.407 141.252 41.725 1.00 0.00 H ATOM 26574 H16T PA 682 98.001 142.068 42.016 1.00 0.00 H ATOM 26575 C115 PA 682 97.293 142.196 39.971 1.00 0.00 C ATOM 26576 H15R PA 682 96.675 143.083 40.123 1.00 0.00 H ATOM 26577 H15S PA 682 96.839 141.478 39.285 1.00 0.00 H ATOM 26578 C114 PA 682 98.618 142.764 39.352 1.00 0.00 C ATOM 26579 H14R PA 682 98.370 143.107 38.345 1.00 0.00 H ATOM 26580 H14S PA 682 99.435 142.057 39.195 1.00 0.00 H ATOM 26581 C113 PA 682 99.175 143.952 40.122 1.00 0.00 C ATOM 26582 H13R PA 682 99.066 143.763 41.192 1.00 0.00 H ATOM 26583 H13S PA 682 98.571 144.838 39.918 1.00 0.00 H ATOM 26584 C112 PA 682 100.565 144.334 39.674 1.00 0.00 C ATOM 26585 H12R PA 682 100.583 144.955 38.775 1.00 0.00 H ATOM 26586 H12S PA 682 101.127 143.432 39.421 1.00 0.00 H ATOM 26587 C111 PA 682 101.225 145.225 40.730 1.00 0.00 C ATOM 26588 H11R PA 682 102.037 145.666 40.148 1.00 0.00 H ATOM 26589 H11S PA 682 101.732 144.706 41.547 1.00 0.00 H ATOM 26590 C110 PA 682 100.426 146.364 41.215 1.00 0.00 C ATOM 26591 H10R PA 682 99.608 146.746 40.601 1.00 0.00 H ATOM 26592 H10S PA 682 101.116 147.199 41.349 1.00 0.00 H ATOM 26593 C19 PA 682 99.682 146.191 42.532 1.00 0.00 C ATOM 26594 H9R PA 682 98.872 145.466 42.427 1.00 0.00 H ATOM 26595 H9S PA 682 99.275 147.199 42.636 1.00 0.00 H ATOM 26596 C18 PA 682 100.470 145.920 43.836 1.00 0.00 C ATOM 26597 H8R PA 682 100.195 146.817 44.394 1.00 0.00 H ATOM 26598 H8S PA 682 101.533 145.893 43.589 1.00 0.00 H ATOM 26599 C17 PA 682 100.212 144.733 44.708 1.00 0.00 C ATOM 26600 H7R PA 682 100.416 143.839 44.116 1.00 0.00 H ATOM 26601 H7S PA 682 99.163 144.778 45.009 1.00 0.00 H ATOM 26602 C16 PA 682 101.199 144.784 45.938 1.00 0.00 C ATOM 26603 H6R PA 682 101.217 145.786 46.373 1.00 0.00 H ATOM 26604 H6S PA 682 102.170 144.567 45.489 1.00 0.00 H ATOM 26605 C15 PA 682 100.908 143.749 46.963 1.00 0.00 C ATOM 26606 H5R PA 682 101.024 142.740 46.564 1.00 0.00 H ATOM 26607 H5S PA 682 99.825 143.695 47.094 1.00 0.00 H ATOM 26608 C14 PA 682 101.782 143.916 48.121 1.00 0.00 C ATOM 26609 H4R PA 682 101.540 144.873 48.588 1.00 0.00 H ATOM 26610 H4S PA 682 102.803 144.056 47.758 1.00 0.00 H ATOM 26611 C13 PA 682 101.478 143.085 49.318 1.00 0.00 C ATOM 26612 H3R PA 682 101.475 142.036 49.014 1.00 0.00 H ATOM 26613 H3S PA 682 100.501 143.310 49.750 1.00 0.00 H ATOM 26614 C12 PA 682 102.516 143.302 50.396 1.00 0.00 C ATOM 26615 H2R PA 682 102.594 144.330 50.756 1.00 0.00 H ATOM 26616 H2S PA 682 103.514 143.000 50.075 1.00 0.00 H ATOM 26617 C11 PC 683 102.115 142.401 51.525 1.00 0.00 C ATOM 26618 O12 PC 683 102.129 141.207 51.522 1.00 0.00 O ATOM 26619 O11 PC 683 101.726 143.177 52.633 1.00 0.00 O ATOM 26620 C1 PC 683 101.151 142.504 53.716 1.00 0.00 C ATOM 26621 HR PC 683 101.860 141.757 54.081 1.00 0.00 H ATOM 26622 HS PC 683 100.231 142.037 53.355 1.00 0.00 H ATOM 26623 C2 PC 683 100.921 143.391 54.954 1.00 0.00 C ATOM 26624 HX PC 683 101.845 143.873 55.285 1.00 0.00 H ATOM 26625 C3 PC 683 100.358 142.491 56.053 1.00 0.00 C ATOM 26626 HA PC 683 101.149 141.896 56.518 1.00 0.00 H ATOM 26627 HB PC 683 99.588 141.789 55.723 1.00 0.00 H ATOM 26628 O31 PC 683 99.780 143.393 56.978 1.00 0.00 O ATOM 26629 P31 PC 683 99.614 143.167 58.526 1.00 0.00 P ATOM 26630 O32 PC 683 101.039 143.093 59.138 1.00 0.00 O ATOM 26631 C31 PC 683 101.968 144.088 58.901 1.00 0.00 C ATOM 26632 H1A PC 683 101.888 144.596 57.937 1.00 0.00 H ATOM 26633 H1B PC 683 102.969 143.694 59.093 1.00 0.00 H ATOM 26634 C32 PC 683 101.756 145.193 59.986 1.00 0.00 C ATOM 26635 H2A PC 683 100.688 145.400 59.906 1.00 0.00 H ATOM 26636 H2B PC 683 102.260 146.102 59.656 1.00 0.00 H ATOM 26637 N31 PC 683 102.088 144.988 61.420 1.00 0.00 N ATOM 26638 C33 PC 683 101.554 143.725 62.001 1.00 0.00 C ATOM 26639 H3A PC 683 100.544 143.930 62.358 1.00 0.00 H ATOM 26640 H3B PC 683 102.137 143.552 62.907 1.00 0.00 H ATOM 26641 H3C PC 683 101.497 142.959 61.226 1.00 0.00 H ATOM 26642 C34 PC 683 103.536 145.096 61.721 1.00 0.00 C ATOM 26643 H4A PC 683 104.033 144.155 61.479 1.00 0.00 H ATOM 26644 H4B PC 683 103.632 145.259 62.796 1.00 0.00 H ATOM 26645 H4C PC 683 103.854 145.955 61.128 1.00 0.00 H ATOM 26646 C35 PC 683 101.531 146.103 62.232 1.00 0.00 C ATOM 26647 H5A PC 683 102.108 146.992 61.974 1.00 0.00 H ATOM 26648 H5B PC 683 101.405 145.652 63.218 1.00 0.00 H ATOM 26649 H5C PC 683 100.468 146.137 61.990 1.00 0.00 H ATOM 26650 O33 PC 683 98.913 144.306 59.102 1.00 0.00 O ATOM 26651 O34 PC 683 99.020 141.848 58.563 1.00 0.00 O ATOM 26652 O21 PC 683 99.965 144.266 54.596 1.00 0.00 O ATOM 26653 C21 PC 683 100.288 145.408 53.987 1.00 0.00 C ATOM 26654 O22 PC 683 101.429 145.892 53.805 1.00 0.00 O ATOM 26655 C12 OL 684 99.095 146.080 53.398 1.00 0.00 C ATOM 26656 H2R OL 684 98.286 145.349 53.335 1.00 0.00 H ATOM 26657 H2S OL 684 98.635 146.793 54.085 1.00 0.00 H ATOM 26658 C13 OL 684 99.369 146.672 52.080 1.00 0.00 C ATOM 26659 H3R OL 684 100.147 147.438 52.055 1.00 0.00 H ATOM 26660 H3S OL 684 99.817 145.878 51.481 1.00 0.00 H ATOM 26661 C14 OL 684 98.149 147.109 51.187 1.00 0.00 C ATOM 26662 H4R OL 684 97.444 147.674 51.800 1.00 0.00 H ATOM 26663 H4S OL 684 98.554 147.829 50.474 1.00 0.00 H ATOM 26664 C15 OL 684 97.462 145.904 50.467 1.00 0.00 C ATOM 26665 H5R OL 684 98.104 145.035 50.622 1.00 0.00 H ATOM 26666 H5S OL 684 96.539 145.616 50.973 1.00 0.00 H ATOM 26667 C16 OL 684 97.196 146.116 48.974 1.00 0.00 C ATOM 26668 H6R OL 684 96.691 147.074 48.834 1.00 0.00 H ATOM 26669 H6S OL 684 98.130 146.027 48.416 1.00 0.00 H ATOM 26670 C17 OL 684 96.285 145.051 48.469 1.00 0.00 C ATOM 26671 H7R OL 684 96.683 144.035 48.417 1.00 0.00 H ATOM 26672 H7S OL 684 95.412 145.055 49.124 1.00 0.00 H ATOM 26673 C18 OL 684 95.644 145.354 47.072 1.00 0.00 C ATOM 26674 H8R OL 684 94.769 144.713 46.948 1.00 0.00 H ATOM 26675 H8S OL 684 95.450 146.425 46.975 1.00 0.00 H ATOM 26676 C19 OL 684 96.600 144.876 45.999 1.00 0.00 C ATOM 26677 H9R OL 684 97.602 144.596 46.318 1.00 0.00 H ATOM 26678 C110 OL 684 96.276 144.772 44.698 1.00 0.00 C ATOM 26679 H10R OL 684 97.074 144.304 44.127 1.00 0.00 H ATOM 26680 C111 OL 684 95.026 145.201 44.009 1.00 0.00 C ATOM 26681 H11R OL 684 94.442 144.285 43.901 1.00 0.00 H ATOM 26682 H11S OL 684 94.475 145.842 44.701 1.00 0.00 H ATOM 26683 C112 OL 684 95.150 145.965 42.708 1.00 0.00 C ATOM 26684 H12R OL 684 95.558 146.965 42.870 1.00 0.00 H ATOM 26685 H12S OL 684 95.828 145.433 42.037 1.00 0.00 H ATOM 26686 C113 OL 684 93.823 146.079 41.965 1.00 0.00 C ATOM 26687 H13R OL 684 93.523 145.089 41.616 1.00 0.00 H ATOM 26688 H13S OL 684 93.074 146.489 42.645 1.00 0.00 H ATOM 26689 C114 OL 684 93.794 147.123 40.735 1.00 0.00 C ATOM 26690 H14R OL 684 92.919 147.026 40.089 1.00 0.00 H ATOM 26691 H14S OL 684 93.734 148.122 41.173 1.00 0.00 H ATOM 26692 C115 OL 684 95.034 146.883 39.866 1.00 0.00 C ATOM 26693 H15R OL 684 95.980 146.895 40.411 1.00 0.00 H ATOM 26694 H15S OL 684 95.013 145.830 39.577 1.00 0.00 H ATOM 26695 C116 OL 684 95.192 147.801 38.705 1.00 0.00 C ATOM 26696 H16R OL 684 94.241 147.654 38.187 1.00 0.00 H ATOM 26697 H16S OL 684 95.284 148.884 38.815 1.00 0.00 H ATOM 26698 C117 OL 684 96.144 147.265 37.594 1.00 0.00 C ATOM 26699 H17R OL 684 95.998 146.186 37.508 1.00 0.00 H ATOM 26700 H17S OL 684 95.832 147.644 36.619 1.00 0.00 H ATOM 26701 C118 OL 684 97.658 147.650 37.794 1.00 0.00 C ATOM 26702 H18R OL 684 98.021 147.303 38.764 1.00 0.00 H ATOM 26703 H18S OL 684 97.873 148.720 37.827 1.00 0.00 H ATOM 26704 H18T OL 684 98.247 147.209 36.987 1.00 0.00 H TER 26705 OL 684 ATOM 26705 C116 PA 685 34.424 144.269 44.846 1.00 0.00 C ATOM 26706 H16R PA 685 34.336 144.747 45.824 1.00 0.00 H ATOM 26707 H16S PA 685 33.406 144.146 44.471 1.00 0.00 H ATOM 26708 H16T PA 685 34.870 144.987 44.155 1.00 0.00 H ATOM 26709 C115 PA 685 35.025 142.799 44.850 1.00 0.00 C ATOM 26710 H15R PA 685 35.126 142.384 43.845 1.00 0.00 H ATOM 26711 H15S PA 685 34.406 142.090 45.404 1.00 0.00 H ATOM 26712 C114 PA 685 36.411 142.836 45.337 1.00 0.00 C ATOM 26713 H14R PA 685 36.446 143.085 46.400 1.00 0.00 H ATOM 26714 H14S PA 685 36.951 143.573 44.739 1.00 0.00 H ATOM 26715 C113 PA 685 37.190 141.544 45.190 1.00 0.00 C ATOM 26716 H13R PA 685 38.241 141.792 45.358 1.00 0.00 H ATOM 26717 H13S PA 685 37.189 141.324 44.120 1.00 0.00 H ATOM 26718 C112 PA 685 36.579 140.383 46.066 1.00 0.00 C ATOM 26719 H12R PA 685 35.650 139.975 45.663 1.00 0.00 H ATOM 26720 H12S PA 685 36.118 140.831 46.949 1.00 0.00 H ATOM 26721 C111 PA 685 37.559 139.318 46.522 1.00 0.00 C ATOM 26722 H11R PA 685 36.987 138.613 47.129 1.00 0.00 H ATOM 26723 H11S PA 685 38.357 139.734 47.141 1.00 0.00 H ATOM 26724 C110 PA 685 38.328 138.626 45.432 1.00 0.00 C ATOM 26725 H10R PA 685 39.138 139.234 45.025 1.00 0.00 H ATOM 26726 H10S PA 685 37.725 138.284 44.588 1.00 0.00 H ATOM 26727 C19 PA 685 38.999 137.357 45.997 1.00 0.00 C ATOM 26728 H9R PA 685 38.215 136.630 46.218 1.00 0.00 H ATOM 26729 H9S PA 685 39.489 137.473 46.966 1.00 0.00 H ATOM 26730 C18 PA 685 40.046 136.667 45.173 1.00 0.00 C ATOM 26731 H8R PA 685 40.972 137.226 45.025 1.00 0.00 H ATOM 26732 H8S PA 685 39.730 136.531 44.137 1.00 0.00 H ATOM 26733 C17 PA 685 40.549 135.292 45.699 1.00 0.00 C ATOM 26734 H7R PA 685 40.666 135.471 46.770 1.00 0.00 H ATOM 26735 H7S PA 685 41.481 134.990 45.217 1.00 0.00 H ATOM 26736 C16 PA 685 39.719 134.042 45.582 1.00 0.00 C ATOM 26737 H6R PA 685 40.384 133.282 45.997 1.00 0.00 H ATOM 26738 H6S PA 685 39.417 133.808 44.559 1.00 0.00 H ATOM 26739 C15 PA 685 38.346 133.939 46.298 1.00 0.00 C ATOM 26740 H5R PA 685 37.595 134.553 45.797 1.00 0.00 H ATOM 26741 H5S PA 685 38.451 134.395 47.285 1.00 0.00 H ATOM 26742 C14 PA 685 37.930 132.490 46.529 1.00 0.00 C ATOM 26743 H4R PA 685 38.227 132.417 47.577 1.00 0.00 H ATOM 26744 H4S PA 685 38.625 131.761 46.106 1.00 0.00 H ATOM 26745 C13 PA 685 36.460 132.090 46.152 1.00 0.00 C ATOM 26746 H3R PA 685 36.358 132.105 45.064 1.00 0.00 H ATOM 26747 H3S PA 685 35.835 132.936 46.444 1.00 0.00 H ATOM 26748 C12 PA 685 36.052 130.755 46.705 1.00 0.00 C ATOM 26749 H2R PA 685 36.870 130.161 46.292 1.00 0.00 H ATOM 26750 H2S PA 685 35.065 130.415 46.384 1.00 0.00 H ATOM 26751 C11 PGR 686 36.087 130.734 48.243 1.00 0.00 C ATOM 26752 O12 PGR 686 35.538 131.679 48.868 1.00 0.00 O ATOM 26753 O11 PGR 686 36.699 129.629 48.694 1.00 0.00 O ATOM 26754 C1 PGR 686 37.043 129.488 50.063 1.00 0.00 C ATOM 26755 HR PGR 686 37.588 130.406 50.296 1.00 0.00 H ATOM 26756 HS PGR 686 37.799 128.705 50.171 1.00 0.00 H ATOM 26757 C2 PGR 686 35.818 129.390 50.966 1.00 0.00 C ATOM 26758 HX PGR 686 35.515 130.427 51.133 1.00 0.00 H ATOM 26759 C3 PGR 686 36.084 128.722 52.311 1.00 0.00 C ATOM 26760 HA PGR 686 36.855 129.254 52.874 1.00 0.00 H ATOM 26761 HB PGR 686 36.321 127.655 52.286 1.00 0.00 H ATOM 26762 O31 PGR 686 34.887 128.808 53.049 1.00 0.00 O ATOM 26763 P31 PGR 686 34.912 128.619 54.629 1.00 0.00 P ATOM 26764 O32 PGR 686 35.221 127.071 54.671 1.00 0.00 O ATOM 26765 C31 PGR 686 34.228 126.171 54.165 1.00 0.00 C ATOM 26766 H1A PGR 686 34.048 126.397 53.110 1.00 0.00 H ATOM 26767 H1B PGR 686 33.267 126.340 54.657 1.00 0.00 H ATOM 26768 C32 PGR 686 34.684 124.753 54.221 1.00 0.00 C ATOM 26769 H2A PGR 686 34.755 124.455 55.270 1.00 0.00 H ATOM 26770 O35 PGR 686 35.924 124.674 53.551 1.00 0.00 O ATOM 26771 HO5A PGR 686 36.424 125.431 53.904 1.00 0.00 H ATOM 26772 C33 PGR 686 33.699 123.651 53.604 1.00 0.00 C ATOM 26773 H3A PGR 686 33.999 122.652 53.930 1.00 0.00 H ATOM 26774 H3B PGR 686 32.635 123.794 53.807 1.00 0.00 H ATOM 26775 O33 PGR 686 36.033 129.321 55.195 1.00 0.00 O ATOM 26776 O34 PGR 686 33.624 128.870 55.250 1.00 0.00 O ATOM 26777 O21 PGR 686 34.761 128.693 50.257 1.00 0.00 O ATOM 26778 C21 PGR 686 34.926 127.406 49.817 1.00 0.00 C ATOM 26779 O22 PGR 686 35.871 126.681 49.979 1.00 0.00 O ATOM 26780 O36 PGR 686 33.779 123.727 52.174 1.00 0.00 O ATOM 26781 HO6A PGR 686 34.697 123.586 51.878 1.00 0.00 H ATOM 26782 C12 OL 687 33.668 126.874 49.187 1.00 0.00 C ATOM 26783 H2R OL 687 33.983 125.898 48.812 1.00 0.00 H ATOM 26784 H2S OL 687 32.924 126.740 49.975 1.00 0.00 H ATOM 26785 C13 OL 687 33.218 127.637 47.993 1.00 0.00 C ATOM 26786 H3R OL 687 33.052 128.694 48.213 1.00 0.00 H ATOM 26787 H3S OL 687 34.022 127.619 47.254 1.00 0.00 H ATOM 26788 C14 OL 687 31.953 127.055 47.387 1.00 0.00 C ATOM 26789 H4R OL 687 32.296 126.063 47.086 1.00 0.00 H ATOM 26790 H4S OL 687 31.123 126.990 48.094 1.00 0.00 H ATOM 26791 C15 OL 687 31.500 127.757 46.136 1.00 0.00 C ATOM 26792 H5R OL 687 31.385 128.817 46.369 1.00 0.00 H ATOM 26793 H5S OL 687 32.190 127.720 45.291 1.00 0.00 H ATOM 26794 C16 OL 687 30.237 127.138 45.549 1.00 0.00 C ATOM 26795 H6R OL 687 30.306 126.061 45.384 1.00 0.00 H ATOM 26796 H6S OL 687 29.414 127.219 46.262 1.00 0.00 H ATOM 26797 C17 OL 687 30.075 127.539 44.033 1.00 0.00 C ATOM 26798 H7R OL 687 29.755 128.582 43.986 1.00 0.00 H ATOM 26799 H7S OL 687 30.952 127.469 43.387 1.00 0.00 H ATOM 26800 C18 OL 687 29.039 126.715 43.242 1.00 0.00 C ATOM 26801 H8R OL 687 28.973 127.124 42.231 1.00 0.00 H ATOM 26802 H8S OL 687 29.484 125.720 43.185 1.00 0.00 H ATOM 26803 C19 OL 687 27.640 126.517 43.778 1.00 0.00 C ATOM 26804 H9R OL 687 27.633 125.926 44.690 1.00 0.00 H ATOM 26805 C110 OL 687 26.515 127.021 43.225 1.00 0.00 C ATOM 26806 H10R OL 687 25.632 126.737 43.792 1.00 0.00 H ATOM 26807 C111 OL 687 26.386 127.799 42.027 1.00 0.00 C ATOM 26808 H11R OL 687 25.789 128.704 42.160 1.00 0.00 H ATOM 26809 H11S OL 687 27.362 128.156 41.692 1.00 0.00 H ATOM 26810 C112 OL 687 25.657 127.007 40.974 1.00 0.00 C ATOM 26811 H12R OL 687 26.026 125.979 41.013 1.00 0.00 H ATOM 26812 H12S OL 687 24.610 126.869 41.252 1.00 0.00 H ATOM 26813 C113 OL 687 25.648 127.746 39.683 1.00 0.00 C ATOM 26814 H13R OL 687 25.339 128.773 39.891 1.00 0.00 H ATOM 26815 H13S OL 687 26.706 127.856 39.437 1.00 0.00 H ATOM 26816 C114 OL 687 24.796 127.087 38.577 1.00 0.00 C ATOM 26817 H14R OL 687 24.856 125.999 38.647 1.00 0.00 H ATOM 26818 H14S OL 687 23.754 127.216 38.880 1.00 0.00 H ATOM 26819 C115 OL 687 24.719 127.707 37.085 1.00 0.00 C ATOM 26820 H15R OL 687 24.037 128.556 37.163 1.00 0.00 H ATOM 26821 H15S OL 687 25.748 127.997 36.863 1.00 0.00 H ATOM 26822 C116 OL 687 24.159 126.741 36.091 1.00 0.00 C ATOM 26823 H16R OL 687 23.885 127.421 35.282 1.00 0.00 H ATOM 26824 H16S OL 687 24.990 126.191 35.645 1.00 0.00 H ATOM 26825 C117 OL 687 22.947 125.906 36.533 1.00 0.00 C ATOM 26826 H17R OL 687 23.235 125.228 37.340 1.00 0.00 H ATOM 26827 H17S OL 687 22.215 126.607 36.940 1.00 0.00 H ATOM 26828 C118 OL 687 22.163 125.171 35.432 1.00 0.00 C ATOM 26829 H18R OL 687 21.826 125.915 34.708 1.00 0.00 H ATOM 26830 H18S OL 687 21.261 124.683 35.807 1.00 0.00 H ATOM 26831 H18T OL 687 22.803 124.430 34.950 1.00 0.00 H TER 26832 OL 687 ATOM 26832 C116 PA 688 138.016 29.173 42.335 1.00 0.00 C ATOM 26833 H16R PA 688 138.483 28.278 42.749 1.00 0.00 H ATOM 26834 H16S PA 688 137.213 28.800 41.695 1.00 0.00 H ATOM 26835 H16T PA 688 137.481 29.665 43.150 1.00 0.00 H ATOM 26836 C115 PA 688 138.964 30.119 41.544 1.00 0.00 C ATOM 26837 H15R PA 688 139.528 29.515 40.829 1.00 0.00 H ATOM 26838 H15S PA 688 139.735 30.445 42.245 1.00 0.00 H ATOM 26839 C114 PA 688 138.176 31.329 40.904 1.00 0.00 C ATOM 26840 H14R PA 688 137.439 30.856 40.250 1.00 0.00 H ATOM 26841 H14S PA 688 138.751 31.885 40.161 1.00 0.00 H ATOM 26842 C113 PA 688 137.522 32.343 41.925 1.00 0.00 C ATOM 26843 H13R PA 688 136.523 32.011 42.213 1.00 0.00 H ATOM 26844 H13S PA 688 137.265 33.212 41.314 1.00 0.00 H ATOM 26845 C112 PA 688 138.381 32.792 43.066 1.00 0.00 C ATOM 26846 H12R PA 688 139.304 33.265 42.725 1.00 0.00 H ATOM 26847 H12S PA 688 138.702 32.006 43.752 1.00 0.00 H ATOM 26848 C111 PA 688 137.761 33.761 43.975 1.00 0.00 C ATOM 26849 H11R PA 688 137.433 34.634 43.407 1.00 0.00 H ATOM 26850 H11S PA 688 138.385 34.115 44.798 1.00 0.00 H ATOM 26851 C110 PA 688 136.568 33.250 44.683 1.00 0.00 C ATOM 26852 H10R PA 688 136.987 32.421 45.256 1.00 0.00 H ATOM 26853 H10S PA 688 135.868 32.863 43.939 1.00 0.00 H ATOM 26854 C19 PA 688 135.906 34.275 45.560 1.00 0.00 C ATOM 26855 H9R PA 688 136.057 35.171 44.955 1.00 0.00 H ATOM 26856 H9S PA 688 136.634 34.386 46.366 1.00 0.00 H ATOM 26857 C18 PA 688 134.559 33.917 46.084 1.00 0.00 C ATOM 26858 H8R PA 688 134.398 34.385 47.057 1.00 0.00 H ATOM 26859 H8S PA 688 134.607 32.844 46.283 1.00 0.00 H ATOM 26860 C17 PA 688 133.435 34.649 45.288 1.00 0.00 C ATOM 26861 H7R PA 688 133.335 33.964 44.444 1.00 0.00 H ATOM 26862 H7S PA 688 133.904 35.598 45.019 1.00 0.00 H ATOM 26863 C16 PA 688 132.078 34.826 45.982 1.00 0.00 C ATOM 26864 H6R PA 688 131.406 35.439 45.377 1.00 0.00 H ATOM 26865 H6S PA 688 132.273 35.505 46.814 1.00 0.00 H ATOM 26866 C15 PA 688 131.408 33.545 46.477 1.00 0.00 C ATOM 26867 H5R PA 688 132.156 32.802 46.762 1.00 0.00 H ATOM 26868 H5S PA 688 130.744 32.964 45.834 1.00 0.00 H ATOM 26869 C14 PA 688 130.406 33.690 47.626 1.00 0.00 C ATOM 26870 H4R PA 688 129.891 32.727 47.663 1.00 0.00 H ATOM 26871 H4S PA 688 129.715 34.509 47.417 1.00 0.00 H ATOM 26872 C13 PA 688 131.107 33.963 49.044 1.00 0.00 C ATOM 26873 H3R PA 688 131.536 34.967 49.024 1.00 0.00 H ATOM 26874 H3S PA 688 131.962 33.318 49.260 1.00 0.00 H ATOM 26875 C12 PA 688 130.165 33.908 50.165 1.00 0.00 C ATOM 26876 H2R PA 688 129.375 33.166 50.027 1.00 0.00 H ATOM 26877 H2S PA 688 129.592 34.837 50.137 1.00 0.00 H ATOM 26878 C11 PGR 689 130.832 33.847 51.501 1.00 0.00 C ATOM 26879 O12 PGR 689 132.029 33.593 51.705 1.00 0.00 O ATOM 26880 O11 PGR 689 130.057 34.383 52.446 1.00 0.00 O ATOM 26881 C1 PGR 689 130.490 34.460 53.880 1.00 0.00 C ATOM 26882 HR PGR 689 130.856 33.514 54.286 1.00 0.00 H ATOM 26883 HS PGR 689 129.564 34.581 54.447 1.00 0.00 H ATOM 26884 C2 PGR 689 131.432 35.572 54.187 1.00 0.00 C ATOM 26885 HX PGR 689 132.235 35.466 53.452 1.00 0.00 H ATOM 26886 C3 PGR 689 132.032 35.330 55.614 1.00 0.00 C ATOM 26887 HA PGR 689 132.650 36.191 55.879 1.00 0.00 H ATOM 26888 HB PGR 689 132.676 34.448 55.570 1.00 0.00 H ATOM 26889 O31 PGR 689 131.031 35.144 56.543 1.00 0.00 O ATOM 26890 P31 PGR 689 131.318 34.807 58.089 1.00 0.00 P ATOM 26891 O32 PGR 689 131.749 33.276 58.092 1.00 0.00 O ATOM 26892 C31 PGR 689 130.809 32.280 57.724 1.00 0.00 C ATOM 26893 H1A PGR 689 130.198 32.580 56.869 1.00 0.00 H ATOM 26894 H1B PGR 689 130.170 32.096 58.591 1.00 0.00 H ATOM 26895 C32 PGR 689 131.567 30.956 57.447 1.00 0.00 C ATOM 26896 H2A PGR 689 130.853 30.215 57.077 1.00 0.00 H ATOM 26897 O35 PGR 689 132.145 30.449 58.640 1.00 0.00 O ATOM 26898 HO5A PGR 689 132.802 30.987 59.119 1.00 0.00 H ATOM 26899 C33 PGR 689 132.648 31.121 56.354 1.00 0.00 C ATOM 26900 H3A PGR 689 132.051 31.600 55.573 1.00 0.00 H ATOM 26901 H3B PGR 689 133.465 31.755 56.707 1.00 0.00 H ATOM 26902 O33 PGR 689 132.462 35.601 58.619 1.00 0.00 O ATOM 26903 O34 PGR 689 129.967 34.836 58.772 1.00 0.00 O ATOM 26904 O21 PGR 689 130.787 36.898 54.047 1.00 0.00 O ATOM 26905 C21 PGR 689 131.622 37.941 53.726 1.00 0.00 C ATOM 26906 O22 PGR 689 132.816 37.861 53.813 1.00 0.00 O ATOM 26907 O36 PGR 689 133.165 29.796 56.010 1.00 0.00 O ATOM 26908 HO6A PGR 689 133.492 29.755 55.094 1.00 0.00 H ATOM 26909 C12 OL 690 130.862 39.259 53.563 1.00 0.00 C ATOM 26910 H2R OL 690 129.858 39.163 53.983 1.00 0.00 H ATOM 26911 H2S OL 690 131.394 39.940 54.230 1.00 0.00 H ATOM 26912 C13 OL 690 130.881 39.719 52.077 1.00 0.00 C ATOM 26913 H3R OL 690 130.524 40.751 52.031 1.00 0.00 H ATOM 26914 H3S OL 690 131.899 39.737 51.683 1.00 0.00 H ATOM 26915 C14 OL 690 129.988 38.838 51.082 1.00 0.00 C ATOM 26916 H4R OL 690 129.776 39.398 50.169 1.00 0.00 H ATOM 26917 H4S OL 690 130.468 37.875 50.894 1.00 0.00 H ATOM 26918 C15 OL 690 128.623 38.417 51.700 1.00 0.00 C ATOM 26919 H5R OL 690 128.780 37.478 52.235 1.00 0.00 H ATOM 26920 H5S OL 690 128.316 39.198 52.400 1.00 0.00 H ATOM 26921 C16 OL 690 127.601 38.159 50.701 1.00 0.00 C ATOM 26922 H6R OL 690 126.597 38.065 51.121 1.00 0.00 H ATOM 26923 H6S OL 690 127.547 39.139 50.222 1.00 0.00 H ATOM 26924 C17 OL 690 127.862 37.015 49.732 1.00 0.00 C ATOM 26925 H7R OL 690 128.862 37.000 49.295 1.00 0.00 H ATOM 26926 H7S OL 690 127.733 36.089 50.297 1.00 0.00 H ATOM 26927 C18 OL 690 126.765 37.021 48.637 1.00 0.00 C ATOM 26928 H8R OL 690 127.054 36.042 48.251 1.00 0.00 H ATOM 26929 H8S OL 690 125.723 37.015 48.965 1.00 0.00 H ATOM 26930 C19 OL 690 127.070 38.169 47.760 1.00 0.00 C ATOM 26931 H9R OL 690 126.628 39.103 48.097 1.00 0.00 H ATOM 26932 C110 OL 690 127.727 38.135 46.540 1.00 0.00 C ATOM 26933 H10R OL 690 127.807 39.077 46.003 1.00 0.00 H ATOM 26934 C111 OL 690 128.270 36.873 45.921 1.00 0.00 C ATOM 26935 H11R OL 690 129.112 37.191 45.302 1.00 0.00 H ATOM 26936 H11S OL 690 128.834 36.230 46.599 1.00 0.00 H ATOM 26937 C112 OL 690 127.316 36.082 45.099 1.00 0.00 C ATOM 26938 H12R OL 690 127.861 35.261 44.629 1.00 0.00 H ATOM 26939 H12S OL 690 126.465 35.664 45.642 1.00 0.00 H ATOM 26940 C113 OL 690 126.796 36.935 43.945 1.00 0.00 C ATOM 26941 H13R OL 690 126.129 37.664 44.410 1.00 0.00 H ATOM 26942 H13S OL 690 127.575 37.483 43.411 1.00 0.00 H ATOM 26943 C114 OL 690 125.819 36.129 43.044 1.00 0.00 C ATOM 26944 H14R OL 690 126.368 35.339 42.527 1.00 0.00 H ATOM 26945 H14S OL 690 124.992 35.607 43.530 1.00 0.00 H ATOM 26946 C115 OL 690 125.023 37.043 42.155 1.00 0.00 C ATOM 26947 H15R OL 690 124.422 37.759 42.720 1.00 0.00 H ATOM 26948 H15S OL 690 125.706 37.687 41.598 1.00 0.00 H ATOM 26949 C116 OL 690 124.211 36.316 41.148 1.00 0.00 C ATOM 26950 H16R OL 690 124.847 35.511 40.774 1.00 0.00 H ATOM 26951 H16S OL 690 123.329 35.794 41.525 1.00 0.00 H ATOM 26952 C117 OL 690 123.719 37.171 40.005 1.00 0.00 C ATOM 26953 H17R OL 690 123.307 38.109 40.381 1.00 0.00 H ATOM 26954 H17S OL 690 124.601 37.471 39.435 1.00 0.00 H ATOM 26955 C118 OL 690 122.772 36.431 39.071 1.00 0.00 C ATOM 26956 H18R OL 690 121.786 36.361 39.533 1.00 0.00 H ATOM 26957 H18S OL 690 123.076 35.414 38.816 1.00 0.00 H ATOM 26958 H18T OL 690 122.694 36.910 38.093 1.00 0.00 H TER 26959 OL 690 ATOM 26959 C116 PA 691 58.469 82.818 42.503 1.00 0.00 C ATOM 26960 H16R PA 691 57.411 82.579 42.638 1.00 0.00 H ATOM 26961 H16S PA 691 58.875 81.873 42.135 1.00 0.00 H ATOM 26962 H16T PA 691 58.643 83.544 41.707 1.00 0.00 H ATOM 26963 C115 PA 691 59.201 83.269 43.781 1.00 0.00 C ATOM 26964 H15R PA 691 58.559 84.121 44.016 1.00 0.00 H ATOM 26965 H15S PA 691 60.144 83.737 43.494 1.00 0.00 H ATOM 26966 C114 PA 691 59.206 82.366 44.981 1.00 0.00 C ATOM 26967 H14R PA 691 59.533 81.343 44.786 1.00 0.00 H ATOM 26968 H14S PA 691 58.137 82.287 45.191 1.00 0.00 H ATOM 26969 C113 PA 691 59.911 82.838 46.254 1.00 0.00 C ATOM 26970 H13R PA 691 59.820 83.922 46.354 1.00 0.00 H ATOM 26971 H13S PA 691 60.972 82.647 46.083 1.00 0.00 H ATOM 26972 C112 PA 691 59.352 82.221 47.539 1.00 0.00 C ATOM 26973 H12R PA 691 58.938 81.218 47.412 1.00 0.00 H ATOM 26974 H12S PA 691 58.528 82.864 47.855 1.00 0.00 H ATOM 26975 C111 PA 691 60.284 82.475 48.783 1.00 0.00 C ATOM 26976 H11R PA 691 60.779 83.444 48.697 1.00 0.00 H ATOM 26977 H11S PA 691 61.138 81.795 48.765 1.00 0.00 H ATOM 26978 C110 PA 691 59.571 82.405 50.145 1.00 0.00 C ATOM 26979 H10R PA 691 59.298 81.358 50.291 1.00 0.00 H ATOM 26980 H10S PA 691 58.650 82.978 50.028 1.00 0.00 H ATOM 26981 C19 PA 691 60.439 82.785 51.374 1.00 0.00 C ATOM 26982 H9R PA 691 61.374 83.199 50.990 1.00 0.00 H ATOM 26983 H9S PA 691 60.849 81.921 51.900 1.00 0.00 H ATOM 26984 C18 PA 691 59.694 83.570 52.410 1.00 0.00 C ATOM 26985 H8R PA 691 58.679 83.274 52.684 1.00 0.00 H ATOM 26986 H8S PA 691 59.468 84.561 52.012 1.00 0.00 H ATOM 26987 C17 PA 691 60.573 83.757 53.687 1.00 0.00 C ATOM 26988 H7R PA 691 61.580 84.150 53.530 1.00 0.00 H ATOM 26989 H7S PA 691 60.808 82.732 53.980 1.00 0.00 H ATOM 26990 C16 PA 691 59.712 84.421 54.856 1.00 0.00 C ATOM 26991 H6R PA 691 58.986 83.704 55.247 1.00 0.00 H ATOM 26992 H6S PA 691 59.280 85.377 54.552 1.00 0.00 H ATOM 26993 C15 PA 691 60.602 84.836 56.017 1.00 0.00 C ATOM 26994 H5R PA 691 61.113 83.937 56.370 1.00 0.00 H ATOM 26995 H5S PA 691 59.931 85.116 56.831 1.00 0.00 H ATOM 26996 C14 PA 691 61.641 85.887 55.670 1.00 0.00 C ATOM 26997 H4R PA 691 61.100 86.805 55.430 1.00 0.00 H ATOM 26998 H4S PA 691 62.299 85.560 54.862 1.00 0.00 H ATOM 26999 C13 PA 691 62.578 86.116 56.803 1.00 0.00 C ATOM 27000 H3R PA 691 62.881 85.085 56.997 1.00 0.00 H ATOM 27001 H3S PA 691 61.931 86.454 57.615 1.00 0.00 H ATOM 27002 C12 PA 691 63.767 87.058 56.491 1.00 0.00 C ATOM 27003 H2R PA 691 63.349 88.011 56.161 1.00 0.00 H ATOM 27004 H2S PA 691 64.464 86.766 55.703 1.00 0.00 H ATOM 27005 C11 PGR 692 64.622 87.268 57.809 1.00 0.00 C ATOM 27006 O12 PGR 692 65.603 88.001 57.864 1.00 0.00 O ATOM 27007 O11 PGR 692 64.078 86.718 58.904 1.00 0.00 O ATOM 27008 C1 PGR 692 64.684 86.901 60.235 1.00 0.00 C ATOM 27009 HR PGR 692 65.732 86.609 60.124 1.00 0.00 H ATOM 27010 HS PGR 692 64.162 86.267 60.956 1.00 0.00 H ATOM 27011 C2 PGR 692 64.448 88.378 60.654 1.00 0.00 C ATOM 27012 HX PGR 692 64.829 89.053 59.883 1.00 0.00 H ATOM 27013 C3 PGR 692 65.101 88.725 62.014 1.00 0.00 C ATOM 27014 HA PGR 692 64.391 89.396 62.505 1.00 0.00 H ATOM 27015 HB PGR 692 66.101 89.141 61.870 1.00 0.00 H ATOM 27016 O31 PGR 692 65.269 87.563 62.814 1.00 0.00 O ATOM 27017 P31 PGR 692 66.079 87.649 64.184 1.00 0.00 P ATOM 27018 O32 PGR 692 67.658 87.915 63.850 1.00 0.00 O ATOM 27019 C31 PGR 692 68.495 86.928 63.235 1.00 0.00 C ATOM 27020 H1A PGR 692 67.953 86.182 62.648 1.00 0.00 H ATOM 27021 H1B PGR 692 69.014 86.377 64.024 1.00 0.00 H ATOM 27022 C32 PGR 692 69.398 87.814 62.371 1.00 0.00 C ATOM 27023 H2A PGR 692 70.398 87.375 62.366 1.00 0.00 H ATOM 27024 O35 PGR 692 69.570 89.086 62.885 1.00 0.00 O ATOM 27025 HO5A PGR 692 68.702 89.274 63.284 1.00 0.00 H ATOM 27026 C33 PGR 692 68.748 88.010 60.948 1.00 0.00 C ATOM 27027 H3A PGR 692 68.570 87.066 60.427 1.00 0.00 H ATOM 27028 H3B PGR 692 67.788 88.500 61.130 1.00 0.00 H ATOM 27029 O33 PGR 692 65.558 88.827 64.939 1.00 0.00 O ATOM 27030 O34 PGR 692 66.041 86.263 64.728 1.00 0.00 O ATOM 27031 O21 PGR 692 63.066 88.552 60.912 1.00 0.00 O ATOM 27032 C21 PGR 692 62.150 88.776 59.905 1.00 0.00 C ATOM 27033 O22 PGR 692 62.451 89.137 58.797 1.00 0.00 O ATOM 27034 O36 PGR 692 69.557 88.731 60.050 1.00 0.00 O ATOM 27035 HO6A PGR 692 68.983 88.753 59.264 1.00 0.00 H ATOM 27036 C12 OL 693 60.791 88.361 60.368 1.00 0.00 C ATOM 27037 H2R OL 693 60.991 87.372 60.786 1.00 0.00 H ATOM 27038 H2S OL 693 60.385 89.027 61.132 1.00 0.00 H ATOM 27039 C13 OL 693 59.870 87.981 59.213 1.00 0.00 C ATOM 27040 H3R OL 693 60.287 87.242 58.526 1.00 0.00 H ATOM 27041 H3S OL 693 59.043 87.457 59.697 1.00 0.00 H ATOM 27042 C14 OL 693 59.292 89.196 58.436 1.00 0.00 C ATOM 27043 H4R OL 693 58.825 89.966 59.054 1.00 0.00 H ATOM 27044 H4S OL 693 60.145 89.750 58.039 1.00 0.00 H ATOM 27045 C15 OL 693 58.409 88.593 57.272 1.00 0.00 C ATOM 27046 H5R OL 693 59.041 87.919 56.691 1.00 0.00 H ATOM 27047 H5S OL 693 57.525 88.062 57.632 1.00 0.00 H ATOM 27048 C16 OL 693 57.840 89.653 56.284 1.00 0.00 C ATOM 27049 H6R OL 693 57.019 89.243 55.692 1.00 0.00 H ATOM 27050 H6S OL 693 57.405 90.480 56.850 1.00 0.00 H ATOM 27051 C17 OL 693 58.839 90.147 55.231 1.00 0.00 C ATOM 27052 H7R OL 693 58.790 91.229 55.096 1.00 0.00 H ATOM 27053 H7S OL 693 59.858 89.894 55.531 1.00 0.00 H ATOM 27054 C18 OL 693 58.606 89.543 53.892 1.00 0.00 C ATOM 27055 H8R OL 693 57.559 89.620 53.593 1.00 0.00 H ATOM 27056 H8S OL 693 58.945 90.241 53.124 1.00 0.00 H ATOM 27057 C19 OL 693 59.159 88.191 53.658 1.00 0.00 C ATOM 27058 H9R OL 693 58.877 87.417 54.368 1.00 0.00 H ATOM 27059 C110 OL 693 60.020 87.810 52.688 1.00 0.00 C ATOM 27060 H10R OL 693 60.416 86.799 52.728 1.00 0.00 H ATOM 27061 C111 OL 693 60.590 88.582 51.568 1.00 0.00 C ATOM 27062 H11R OL 693 60.217 89.606 51.490 1.00 0.00 H ATOM 27063 H11S OL 693 61.679 88.518 51.598 1.00 0.00 H ATOM 27064 C112 OL 693 60.458 88.003 50.199 1.00 0.00 C ATOM 27065 H12R OL 693 61.000 88.494 49.388 1.00 0.00 H ATOM 27066 H12S OL 693 60.830 86.977 50.226 1.00 0.00 H ATOM 27067 C113 OL 693 58.966 87.907 49.780 1.00 0.00 C ATOM 27068 H13R OL 693 58.364 87.363 50.511 1.00 0.00 H ATOM 27069 H13S OL 693 58.506 88.897 49.809 1.00 0.00 H ATOM 27070 C114 OL 693 58.756 87.241 48.388 1.00 0.00 C ATOM 27071 H14R OL 693 59.070 86.196 48.358 1.00 0.00 H ATOM 27072 H14S OL 693 57.665 87.221 48.345 1.00 0.00 H ATOM 27073 C115 OL 693 59.308 88.021 47.189 1.00 0.00 C ATOM 27074 H15R OL 693 60.382 88.046 46.997 1.00 0.00 H ATOM 27075 H15S OL 693 58.857 87.445 46.378 1.00 0.00 H ATOM 27076 C116 OL 693 58.720 89.469 47.028 1.00 0.00 C ATOM 27077 H16R OL 693 57.630 89.463 47.091 1.00 0.00 H ATOM 27078 H16S OL 693 59.015 89.927 47.975 1.00 0.00 H ATOM 27079 C117 OL 693 59.100 90.305 45.867 1.00 0.00 C ATOM 27080 H17R OL 693 60.178 90.310 45.689 1.00 0.00 H ATOM 27081 H17S OL 693 58.871 89.880 44.888 1.00 0.00 H ATOM 27082 C118 OL 693 58.696 91.813 46.040 1.00 0.00 C ATOM 27083 H18R OL 693 58.895 92.392 45.135 1.00 0.00 H ATOM 27084 H18S OL 693 59.234 92.260 46.879 1.00 0.00 H ATOM 27085 H18T OL 693 57.648 91.943 46.320 1.00 0.00 H TER 27086 OL 693 ATOM 27086 C116 PA 694 16.639 136.356 39.186 1.00 0.00 C ATOM 27087 H16R PA 694 16.218 135.765 38.370 1.00 0.00 H ATOM 27088 H16S PA 694 17.042 135.705 39.964 1.00 0.00 H ATOM 27089 H16T PA 694 17.478 136.890 38.734 1.00 0.00 H ATOM 27090 C115 PA 694 15.568 137.257 39.663 1.00 0.00 C ATOM 27091 H15R PA 694 15.090 137.802 38.847 1.00 0.00 H ATOM 27092 H15S PA 694 15.964 138.011 40.346 1.00 0.00 H ATOM 27093 C114 PA 694 14.595 136.520 40.612 1.00 0.00 C ATOM 27094 H14R PA 694 14.062 135.773 40.019 1.00 0.00 H ATOM 27095 H14S PA 694 13.797 137.208 40.899 1.00 0.00 H ATOM 27096 C113 PA 694 15.164 135.804 41.864 1.00 0.00 C ATOM 27097 H13R PA 694 15.775 134.992 41.464 1.00 0.00 H ATOM 27098 H13S PA 694 14.304 135.489 42.458 1.00 0.00 H ATOM 27099 C112 PA 694 16.042 136.643 42.827 1.00 0.00 C ATOM 27100 H12R PA 694 15.421 137.537 42.912 1.00 0.00 H ATOM 27101 H12S PA 694 17.002 136.938 42.399 1.00 0.00 H ATOM 27102 C111 PA 694 16.353 135.868 44.018 1.00 0.00 C ATOM 27103 H11R PA 694 16.705 134.851 43.832 1.00 0.00 H ATOM 27104 H11S PA 694 15.434 135.817 44.604 1.00 0.00 H ATOM 27105 C110 PA 694 17.281 136.483 45.060 1.00 0.00 C ATOM 27106 H10R PA 694 16.973 137.481 45.378 1.00 0.00 H ATOM 27107 H10S PA 694 18.280 136.610 44.638 1.00 0.00 H ATOM 27108 C19 PA 694 17.538 135.702 46.331 1.00 0.00 C ATOM 27109 H9R PA 694 18.195 136.286 46.979 1.00 0.00 H ATOM 27110 H9S PA 694 18.260 134.947 46.014 1.00 0.00 H ATOM 27111 C18 PA 694 16.311 135.258 47.132 1.00 0.00 C ATOM 27112 H8R PA 694 16.677 134.685 47.987 1.00 0.00 H ATOM 27113 H8S PA 694 15.665 134.611 46.535 1.00 0.00 H ATOM 27114 C17 PA 694 15.415 136.439 47.650 1.00 0.00 C ATOM 27115 H7R PA 694 14.419 136.011 47.789 1.00 0.00 H ATOM 27116 H7S PA 694 15.165 137.127 46.840 1.00 0.00 H ATOM 27117 C16 PA 694 15.931 137.027 48.981 1.00 0.00 C ATOM 27118 H6R PA 694 16.932 137.438 48.835 1.00 0.00 H ATOM 27119 H6S PA 694 16.258 136.260 49.686 1.00 0.00 H ATOM 27120 C15 PA 694 14.965 138.149 49.439 1.00 0.00 C ATOM 27121 H5R PA 694 14.032 137.632 49.670 1.00 0.00 H ATOM 27122 H5S PA 694 14.640 138.765 48.597 1.00 0.00 H ATOM 27123 C14 PA 694 15.403 138.814 50.732 1.00 0.00 C ATOM 27124 H4R PA 694 15.457 138.136 51.587 1.00 0.00 H ATOM 27125 H4S PA 694 14.601 139.499 51.016 1.00 0.00 H ATOM 27126 C13 PA 694 16.683 139.682 50.639 1.00 0.00 C ATOM 27127 H3R PA 694 16.602 140.399 49.819 1.00 0.00 H ATOM 27128 H3S PA 694 17.531 139.069 50.327 1.00 0.00 H ATOM 27129 C12 PA 694 16.983 140.608 51.731 1.00 0.00 C ATOM 27130 H2R PA 694 16.179 141.324 51.914 1.00 0.00 H ATOM 27131 H2S PA 694 17.822 141.227 51.403 1.00 0.00 H ATOM 27132 C11 PGR 695 17.411 140.053 53.047 1.00 0.00 C ATOM 27133 O12 PGR 695 17.450 138.900 53.330 1.00 0.00 O ATOM 27134 O11 PGR 695 17.786 140.950 54.022 1.00 0.00 O ATOM 27135 C1 PGR 695 18.521 140.522 55.251 1.00 0.00 C ATOM 27136 HR PGR 695 18.174 139.544 55.594 1.00 0.00 H ATOM 27137 HS PGR 695 18.362 141.204 56.090 1.00 0.00 H ATOM 27138 C2 PGR 695 20.037 140.430 54.884 1.00 0.00 C ATOM 27139 HX PGR 695 20.261 139.695 54.106 1.00 0.00 H ATOM 27140 C3 PGR 695 20.833 139.850 56.020 1.00 0.00 C ATOM 27141 HA PGR 695 21.894 139.820 55.757 1.00 0.00 H ATOM 27142 HB PGR 695 20.545 138.819 56.239 1.00 0.00 H ATOM 27143 O31 PGR 695 20.579 140.631 57.194 1.00 0.00 O ATOM 27144 P31 PGR 695 21.408 140.447 58.580 1.00 0.00 P ATOM 27145 O32 PGR 695 20.618 139.265 59.343 1.00 0.00 O ATOM 27146 C31 PGR 695 19.320 139.482 59.808 1.00 0.00 C ATOM 27147 H1A PGR 695 18.790 139.800 58.907 1.00 0.00 H ATOM 27148 H1B PGR 695 19.365 140.247 60.588 1.00 0.00 H ATOM 27149 C32 PGR 695 18.703 138.234 60.454 1.00 0.00 C ATOM 27150 H2A PGR 695 17.620 138.356 60.537 1.00 0.00 H ATOM 27151 O35 PGR 695 19.153 138.192 61.785 1.00 0.00 O ATOM 27152 HO5A PGR 695 20.076 138.496 61.718 1.00 0.00 H ATOM 27153 C33 PGR 695 19.024 136.979 59.690 1.00 0.00 C ATOM 27154 H3A PGR 695 18.714 137.157 58.656 1.00 0.00 H ATOM 27155 H3B PGR 695 20.074 136.682 59.742 1.00 0.00 H ATOM 27156 O33 PGR 695 22.688 139.926 58.275 1.00 0.00 O ATOM 27157 O34 PGR 695 21.242 141.673 59.345 1.00 0.00 O ATOM 27158 O21 PGR 695 20.576 141.667 54.362 1.00 0.00 O ATOM 27159 C21 PGR 695 20.512 141.865 53.034 1.00 0.00 C ATOM 27160 O22 PGR 695 20.140 141.097 52.195 1.00 0.00 O ATOM 27161 O36 PGR 695 18.177 135.954 60.102 1.00 0.00 O ATOM 27162 HO6A PGR 695 18.408 135.184 59.552 1.00 0.00 H ATOM 27163 C12 OL 696 20.955 143.294 52.641 1.00 0.00 C ATOM 27164 H2R OL 696 21.616 143.647 53.435 1.00 0.00 H ATOM 27165 H2S OL 696 21.560 143.286 51.732 1.00 0.00 H ATOM 27166 C13 OL 696 19.683 144.055 52.500 1.00 0.00 C ATOM 27167 H3R OL 696 19.099 143.588 51.705 1.00 0.00 H ATOM 27168 H3S OL 696 19.070 143.851 53.380 1.00 0.00 H ATOM 27169 C14 OL 696 19.852 145.573 52.385 1.00 0.00 C ATOM 27170 H4R OL 696 20.444 145.860 53.257 1.00 0.00 H ATOM 27171 H4S OL 696 20.489 145.759 51.518 1.00 0.00 H ATOM 27172 C15 OL 696 18.633 146.370 52.238 1.00 0.00 C ATOM 27173 H5R OL 696 18.079 145.866 51.443 1.00 0.00 H ATOM 27174 H5S OL 696 18.043 146.155 53.132 1.00 0.00 H ATOM 27175 C16 OL 696 18.716 147.786 51.969 1.00 0.00 C ATOM 27176 H6R OL 696 19.436 148.384 52.532 1.00 0.00 H ATOM 27177 H6S OL 696 19.091 147.936 50.955 1.00 0.00 H ATOM 27178 C17 OL 696 17.356 148.471 52.191 1.00 0.00 C ATOM 27179 H7R OL 696 16.519 147.906 51.777 1.00 0.00 H ATOM 27180 H7S OL 696 17.090 148.490 53.250 1.00 0.00 H ATOM 27181 C18 OL 696 17.292 149.954 51.766 1.00 0.00 C ATOM 27182 H8R OL 696 18.182 150.456 52.153 1.00 0.00 H ATOM 27183 H8S OL 696 17.595 150.100 50.727 1.00 0.00 H ATOM 27184 C19 OL 696 16.129 150.718 52.334 1.00 0.00 C ATOM 27185 H9R OL 696 16.243 150.656 53.413 1.00 0.00 H ATOM 27186 C110 OL 696 15.088 151.185 51.676 1.00 0.00 C ATOM 27187 H10R OL 696 14.211 151.556 52.202 1.00 0.00 H ATOM 27188 C111 OL 696 14.897 151.257 50.149 1.00 0.00 C ATOM 27189 H11R OL 696 15.863 151.093 49.666 1.00 0.00 H ATOM 27190 H11S OL 696 14.337 150.343 49.942 1.00 0.00 H ATOM 27191 C112 OL 696 14.183 152.541 49.631 1.00 0.00 C ATOM 27192 H12R OL 696 13.108 152.648 49.793 1.00 0.00 H ATOM 27193 H12S OL 696 14.505 153.493 50.056 1.00 0.00 H ATOM 27194 C113 OL 696 14.434 152.773 48.130 1.00 0.00 C ATOM 27195 H13R OL 696 15.510 152.646 47.996 1.00 0.00 H ATOM 27196 H13S OL 696 13.976 151.993 47.519 1.00 0.00 H ATOM 27197 C114 OL 696 14.090 154.193 47.625 1.00 0.00 C ATOM 27198 H14R OL 696 13.188 154.658 48.027 1.00 0.00 H ATOM 27199 H14S OL 696 14.934 154.806 47.948 1.00 0.00 H ATOM 27200 C115 OL 696 13.846 154.296 46.159 1.00 0.00 C ATOM 27201 H15R OL 696 13.859 155.336 45.828 1.00 0.00 H ATOM 27202 H15S OL 696 14.704 153.806 45.695 1.00 0.00 H ATOM 27203 C116 OL 696 12.613 153.680 45.481 1.00 0.00 C ATOM 27204 H16R OL 696 12.653 152.621 45.748 1.00 0.00 H ATOM 27205 H16S OL 696 11.734 154.106 45.968 1.00 0.00 H ATOM 27206 C117 OL 696 12.452 153.938 44.037 1.00 0.00 C ATOM 27207 H17R OL 696 13.416 153.856 43.532 1.00 0.00 H ATOM 27208 H17S OL 696 11.777 153.184 43.627 1.00 0.00 H ATOM 27209 C118 OL 696 12.039 155.373 43.700 1.00 0.00 C ATOM 27210 H18R OL 696 12.067 155.617 42.636 1.00 0.00 H ATOM 27211 H18S OL 696 12.712 156.142 44.085 1.00 0.00 H ATOM 27212 H18T OL 696 11.037 155.578 44.083 1.00 0.00 H TER 27213 OL 696 ATOM 27213 C116 PA 697 117.205 -4.328 39.777 1.00 0.00 C ATOM 27214 H16R PA 697 116.902 -3.642 40.571 1.00 0.00 H ATOM 27215 H16S PA 697 116.455 -4.367 38.984 1.00 0.00 H ATOM 27216 H16T PA 697 118.160 -3.956 39.398 1.00 0.00 H ATOM 27217 C115 PA 697 117.390 -5.758 40.360 1.00 0.00 C ATOM 27218 H15R PA 697 117.674 -6.386 39.512 1.00 0.00 H ATOM 27219 H15S PA 697 116.478 -6.241 40.719 1.00 0.00 H ATOM 27220 C114 PA 697 118.425 -5.916 41.445 1.00 0.00 C ATOM 27221 H14R PA 697 119.338 -6.010 40.854 1.00 0.00 H ATOM 27222 H14S PA 697 118.446 -6.911 41.894 1.00 0.00 H ATOM 27223 C113 PA 697 118.337 -4.919 42.632 1.00 0.00 C ATOM 27224 H13R PA 697 118.471 -5.593 43.481 1.00 0.00 H ATOM 27225 H13S PA 697 117.336 -4.502 42.765 1.00 0.00 H ATOM 27226 C112 PA 697 119.386 -3.794 42.498 1.00 0.00 C ATOM 27227 H12R PA 697 119.055 -3.043 41.777 1.00 0.00 H ATOM 27228 H12S PA 697 120.305 -4.058 41.972 1.00 0.00 H ATOM 27229 C111 PA 697 119.624 -3.145 43.852 1.00 0.00 C ATOM 27230 H11R PA 697 120.321 -2.305 43.872 1.00 0.00 H ATOM 27231 H11S PA 697 120.329 -3.815 44.348 1.00 0.00 H ATOM 27232 C110 PA 697 118.416 -2.787 44.717 1.00 0.00 C ATOM 27233 H10R PA 697 117.796 -3.666 44.905 1.00 0.00 H ATOM 27234 H10S PA 697 117.804 -2.154 44.071 1.00 0.00 H ATOM 27235 C19 PA 697 118.688 -2.080 46.010 1.00 0.00 C ATOM 27236 H9R PA 697 119.163 -1.192 45.587 1.00 0.00 H ATOM 27237 H9S PA 697 119.267 -2.788 46.606 1.00 0.00 H ATOM 27238 C18 PA 697 117.451 -1.630 46.695 1.00 0.00 C ATOM 27239 H8R PA 697 116.997 -2.584 46.970 1.00 0.00 H ATOM 27240 H8S PA 697 116.860 -1.050 45.983 1.00 0.00 H ATOM 27241 C17 PA 697 117.773 -0.663 47.846 1.00 0.00 C ATOM 27242 H7R PA 697 118.387 0.168 47.491 1.00 0.00 H ATOM 27243 H7S PA 697 118.344 -1.330 48.496 1.00 0.00 H ATOM 27244 C16 PA 697 116.526 -0.056 48.418 1.00 0.00 C ATOM 27245 H6R PA 697 115.714 -0.771 48.570 1.00 0.00 H ATOM 27246 H6S PA 697 116.152 0.697 47.722 1.00 0.00 H ATOM 27247 C15 PA 697 116.889 0.603 49.761 1.00 0.00 C ATOM 27248 H5R PA 697 117.369 1.533 49.448 1.00 0.00 H ATOM 27249 H5S PA 697 117.626 0.107 50.395 1.00 0.00 H ATOM 27250 C14 PA 697 115.746 1.062 50.653 1.00 0.00 C ATOM 27251 H4R PA 697 115.529 0.124 51.168 1.00 0.00 H ATOM 27252 H4S PA 697 114.895 1.396 50.054 1.00 0.00 H ATOM 27253 C13 PA 697 116.175 1.993 51.768 1.00 0.00 C ATOM 27254 H3R PA 697 116.432 2.925 51.261 1.00 0.00 H ATOM 27255 H3S PA 697 117.091 1.763 52.317 1.00 0.00 H ATOM 27256 C12 PA 697 114.971 2.317 52.775 1.00 0.00 C ATOM 27257 H2R PA 697 114.691 1.442 53.365 1.00 0.00 H ATOM 27258 H2S PA 697 114.093 2.713 52.261 1.00 0.00 H ATOM 27259 C11 PGR 698 115.493 3.356 53.761 1.00 0.00 C ATOM 27260 O12 PGR 698 116.552 3.140 54.345 1.00 0.00 O ATOM 27261 O11 PGR 698 114.715 4.514 53.881 1.00 0.00 O ATOM 27262 C1 PGR 698 115.243 5.513 54.900 1.00 0.00 C ATOM 27263 HR PGR 698 115.402 5.035 55.870 1.00 0.00 H ATOM 27264 HS PGR 698 114.425 6.189 55.162 1.00 0.00 H ATOM 27265 C2 PGR 698 116.529 6.224 54.320 1.00 0.00 C ATOM 27266 HX PGR 698 117.350 5.520 54.480 1.00 0.00 H ATOM 27267 C3 PGR 698 116.886 7.518 55.114 1.00 0.00 C ATOM 27268 HA PGR 698 116.559 7.556 56.156 1.00 0.00 H ATOM 27269 HB PGR 698 116.412 8.356 54.595 1.00 0.00 H ATOM 27270 O31 PGR 698 118.293 7.711 55.147 1.00 0.00 O ATOM 27271 P31 PGR 698 118.839 8.952 55.780 1.00 0.00 P ATOM 27272 O32 PGR 698 118.584 10.179 54.765 1.00 0.00 O ATOM 27273 C31 PGR 698 118.859 9.910 53.431 1.00 0.00 C ATOM 27274 H1A PGR 698 118.002 9.370 53.021 1.00 0.00 H ATOM 27275 H1B PGR 698 119.725 9.244 53.399 1.00 0.00 H ATOM 27276 C32 PGR 698 119.010 11.256 52.597 1.00 0.00 C ATOM 27277 H2A PGR 698 119.225 11.013 51.554 1.00 0.00 H ATOM 27278 O35 PGR 698 119.992 12.118 53.177 1.00 0.00 O ATOM 27279 HO5A PGR 698 120.848 11.655 53.150 1.00 0.00 H ATOM 27280 C33 PGR 698 117.638 11.953 52.569 1.00 0.00 C ATOM 27281 H3A PGR 698 116.827 11.232 52.438 1.00 0.00 H ATOM 27282 H3B PGR 698 117.484 12.675 53.375 1.00 0.00 H ATOM 27283 O33 PGR 698 118.075 9.168 56.990 1.00 0.00 O ATOM 27284 O34 PGR 698 120.322 8.799 55.952 1.00 0.00 O ATOM 27285 O21 PGR 698 116.383 6.435 52.881 1.00 0.00 O ATOM 27286 C21 PGR 698 115.300 7.146 52.412 1.00 0.00 C ATOM 27287 O22 PGR 698 114.524 7.719 53.064 1.00 0.00 O ATOM 27288 O36 PGR 698 117.636 12.637 51.314 1.00 0.00 O ATOM 27289 HO6A PGR 698 118.541 12.989 51.235 1.00 0.00 H ATOM 27290 C12 OL 699 115.375 7.323 50.917 1.00 0.00 C ATOM 27291 H2R OL 699 114.498 7.877 50.575 1.00 0.00 H ATOM 27292 H2S OL 699 116.003 8.184 50.681 1.00 0.00 H ATOM 27293 C13 OL 699 115.705 6.113 50.118 1.00 0.00 C ATOM 27294 H3R OL 699 116.555 5.627 50.602 1.00 0.00 H ATOM 27295 H3S OL 699 114.990 5.294 50.012 1.00 0.00 H ATOM 27296 C14 OL 699 116.297 6.333 48.722 1.00 0.00 C ATOM 27297 H4R OL 699 115.586 6.875 48.096 1.00 0.00 H ATOM 27298 H4S OL 699 117.173 6.984 48.764 1.00 0.00 H ATOM 27299 C15 OL 699 116.599 4.995 48.022 1.00 0.00 C ATOM 27300 H5R OL 699 117.149 4.319 48.680 1.00 0.00 H ATOM 27301 H5S OL 699 115.667 4.474 47.791 1.00 0.00 H ATOM 27302 C16 OL 699 117.344 5.226 46.725 1.00 0.00 C ATOM 27303 H6R OL 699 116.961 6.158 46.305 1.00 0.00 H ATOM 27304 H6S OL 699 118.414 5.429 46.808 1.00 0.00 H ATOM 27305 C17 OL 699 117.244 4.112 45.728 1.00 0.00 C ATOM 27306 H7R OL 699 116.228 3.776 45.508 1.00 0.00 H ATOM 27307 H7S OL 699 117.749 4.304 44.779 1.00 0.00 H ATOM 27308 C18 OL 699 117.940 2.788 46.190 1.00 0.00 C ATOM 27309 H8R OL 699 119.004 3.003 46.305 1.00 0.00 H ATOM 27310 H8S OL 699 117.609 2.504 47.191 1.00 0.00 H ATOM 27311 C19 OL 699 117.674 1.676 45.196 1.00 0.00 C ATOM 27312 H9R OL 699 116.740 1.186 45.459 1.00 0.00 H ATOM 27313 C110 OL 699 118.449 1.134 44.215 1.00 0.00 C ATOM 27314 H10R OL 699 117.930 0.365 43.648 1.00 0.00 H ATOM 27315 C111 OL 699 119.731 1.687 43.665 1.00 0.00 C ATOM 27316 H11R OL 699 119.971 2.647 44.128 1.00 0.00 H ATOM 27317 H11S OL 699 120.513 1.048 44.080 1.00 0.00 H ATOM 27318 C112 OL 699 119.701 1.862 42.124 1.00 0.00 C ATOM 27319 H12R OL 699 118.798 2.369 41.779 1.00 0.00 H ATOM 27320 H12S OL 699 120.426 2.649 41.906 1.00 0.00 H ATOM 27321 C113 OL 699 119.865 0.642 41.214 1.00 0.00 C ATOM 27322 H13R OL 699 118.988 0.013 41.382 1.00 0.00 H ATOM 27323 H13S OL 699 119.877 1.005 40.184 1.00 0.00 H ATOM 27324 C114 OL 699 121.060 -0.262 41.419 1.00 0.00 C ATOM 27325 H14R OL 699 121.892 0.437 41.527 1.00 0.00 H ATOM 27326 H14S OL 699 121.108 -0.797 42.369 1.00 0.00 H ATOM 27327 C115 OL 699 121.192 -1.227 40.263 1.00 0.00 C ATOM 27328 H15R OL 699 120.249 -1.778 40.247 1.00 0.00 H ATOM 27329 H15S OL 699 121.367 -0.774 39.284 1.00 0.00 H ATOM 27330 C116 OL 699 122.377 -2.108 40.544 1.00 0.00 C ATOM 27331 H16R OL 699 123.258 -1.542 40.852 1.00 0.00 H ATOM 27332 H16S OL 699 122.151 -2.770 41.382 1.00 0.00 H ATOM 27333 C117 OL 699 122.641 -3.031 39.334 1.00 0.00 C ATOM 27334 H17R OL 699 122.871 -2.498 38.409 1.00 0.00 H ATOM 27335 H17S OL 699 123.369 -3.800 39.600 1.00 0.00 H ATOM 27336 C118 OL 699 121.485 -3.901 38.926 1.00 0.00 C ATOM 27337 H18R OL 699 121.269 -4.504 39.810 1.00 0.00 H ATOM 27338 H18S OL 699 121.642 -4.679 38.177 1.00 0.00 H ATOM 27339 H18T OL 699 120.618 -3.372 38.525 1.00 0.00 H TER 27340 OL 699 ATOM 27340 C116 PA 700 60.739 113.419 36.993 1.00 0.00 C ATOM 27341 H16R PA 700 60.010 112.607 36.959 1.00 0.00 H ATOM 27342 H16S PA 700 61.011 113.628 35.956 1.00 0.00 H ATOM 27343 H16T PA 700 60.215 114.317 37.329 1.00 0.00 H ATOM 27344 C115 PA 700 61.880 113.232 38.012 1.00 0.00 C ATOM 27345 H15R PA 700 62.606 114.043 37.922 1.00 0.00 H ATOM 27346 H15S PA 700 62.395 112.344 37.641 1.00 0.00 H ATOM 27347 C114 PA 700 61.434 112.947 39.462 1.00 0.00 C ATOM 27348 H14R PA 700 60.583 112.263 39.483 1.00 0.00 H ATOM 27349 H14S PA 700 60.916 113.804 39.898 1.00 0.00 H ATOM 27350 C113 PA 700 62.479 112.482 40.473 1.00 0.00 C ATOM 27351 H13R PA 700 62.791 111.480 40.170 1.00 0.00 H ATOM 27352 H13S PA 700 62.008 112.411 41.455 1.00 0.00 H ATOM 27353 C112 PA 700 63.618 113.531 40.769 1.00 0.00 C ATOM 27354 H12R PA 700 63.245 114.385 41.339 1.00 0.00 H ATOM 27355 H12S PA 700 64.123 113.986 39.914 1.00 0.00 H ATOM 27356 C111 PA 700 64.740 113.115 41.660 1.00 0.00 C ATOM 27357 H11R PA 700 65.097 112.117 41.395 1.00 0.00 H ATOM 27358 H11S PA 700 64.276 112.988 42.641 1.00 0.00 H ATOM 27359 C110 PA 700 65.977 114.121 41.709 1.00 0.00 C ATOM 27360 H10R PA 700 65.580 115.127 41.860 1.00 0.00 H ATOM 27361 H10S PA 700 66.524 114.076 40.765 1.00 0.00 H ATOM 27362 C19 PA 700 66.906 113.917 42.760 1.00 0.00 C ATOM 27363 H9R PA 700 67.408 112.995 42.461 1.00 0.00 H ATOM 27364 H9S PA 700 66.470 113.906 43.760 1.00 0.00 H ATOM 27365 C18 PA 700 68.011 114.968 42.919 1.00 0.00 C ATOM 27366 H8R PA 700 67.486 115.925 42.893 1.00 0.00 H ATOM 27367 H8S PA 700 68.657 114.821 42.051 1.00 0.00 H ATOM 27368 C17 PA 700 68.825 114.938 44.212 1.00 0.00 C ATOM 27369 H7R PA 700 69.380 113.998 44.258 1.00 0.00 H ATOM 27370 H7S PA 700 68.211 114.772 45.100 1.00 0.00 H ATOM 27371 C16 PA 700 69.810 116.020 44.349 1.00 0.00 C ATOM 27372 H6R PA 700 69.329 116.919 43.957 1.00 0.00 H ATOM 27373 H6S PA 700 70.684 115.942 43.698 1.00 0.00 H ATOM 27374 C15 PA 700 70.320 116.195 45.765 1.00 0.00 C ATOM 27375 H5R PA 700 69.585 116.313 46.564 1.00 0.00 H ATOM 27376 H5S PA 700 70.853 117.146 45.705 1.00 0.00 H ATOM 27377 C14 PA 700 71.258 115.010 46.064 1.00 0.00 C ATOM 27378 H4R PA 700 71.783 114.629 45.186 1.00 0.00 H ATOM 27379 H4S PA 700 70.649 114.121 46.243 1.00 0.00 H ATOM 27380 C13 PA 700 72.450 115.146 47.057 1.00 0.00 C ATOM 27381 H3R PA 700 73.081 115.984 46.755 1.00 0.00 H ATOM 27382 H3S PA 700 73.146 114.304 47.054 1.00 0.00 H ATOM 27383 C12 PA 700 72.002 115.308 48.468 1.00 0.00 C ATOM 27384 H2R PA 700 71.898 114.259 48.750 1.00 0.00 H ATOM 27385 H2S PA 700 71.043 115.800 48.639 1.00 0.00 H ATOM 27386 C11 PC 701 73.101 116.034 49.331 1.00 0.00 C ATOM 27387 O12 PC 701 73.388 115.624 50.420 1.00 0.00 O ATOM 27388 O11 PC 701 73.705 117.104 48.789 1.00 0.00 O ATOM 27389 C1 PC 701 74.578 117.941 49.590 1.00 0.00 C ATOM 27390 HR PC 701 74.022 118.147 50.508 1.00 0.00 H ATOM 27391 HS PC 701 74.753 118.869 49.039 1.00 0.00 H ATOM 27392 C2 PC 701 75.809 117.175 50.154 1.00 0.00 C ATOM 27393 HX PC 701 75.514 116.467 50.933 1.00 0.00 H ATOM 27394 C3 PC 701 76.624 118.297 50.728 1.00 0.00 C ATOM 27395 HA PC 701 76.002 118.803 51.471 1.00 0.00 H ATOM 27396 HB PC 701 76.903 119.025 49.962 1.00 0.00 H ATOM 27397 O31 PC 701 77.746 117.700 51.269 1.00 0.00 O ATOM 27398 P31 PC 701 78.235 118.013 52.677 1.00 0.00 P ATOM 27399 O32 PC 701 76.869 117.743 53.500 1.00 0.00 O ATOM 27400 C31 PC 701 76.540 116.435 53.807 1.00 0.00 C ATOM 27401 H1A PC 701 76.983 116.155 54.767 1.00 0.00 H ATOM 27402 H1B PC 701 76.835 115.768 52.993 1.00 0.00 H ATOM 27403 C32 PC 701 75.043 116.539 53.867 1.00 0.00 C ATOM 27404 H2A PC 701 74.621 116.872 52.918 1.00 0.00 H ATOM 27405 H2B PC 701 74.745 117.326 54.561 1.00 0.00 H ATOM 27406 N31 PC 701 74.369 115.185 54.224 1.00 0.00 N ATOM 27407 C33 PC 701 72.948 115.368 54.010 1.00 0.00 C ATOM 27408 H3A PC 701 72.517 114.463 54.440 1.00 0.00 H ATOM 27409 H3B PC 701 72.735 115.445 52.943 1.00 0.00 H ATOM 27410 H3C PC 701 72.652 116.243 54.591 1.00 0.00 H ATOM 27411 C34 PC 701 74.873 114.047 53.420 1.00 0.00 C ATOM 27412 H4A PC 701 74.393 113.128 53.759 1.00 0.00 H ATOM 27413 H4B PC 701 75.960 113.954 53.438 1.00 0.00 H ATOM 27414 H4C PC 701 74.665 114.223 52.364 1.00 0.00 H ATOM 27415 C35 PC 701 74.465 114.875 55.694 1.00 0.00 C ATOM 27416 H5A PC 701 74.015 113.905 55.914 1.00 0.00 H ATOM 27417 H5B PC 701 73.881 115.627 56.227 1.00 0.00 H ATOM 27418 H5C PC 701 75.512 114.924 55.997 1.00 0.00 H ATOM 27419 O33 PC 701 79.303 116.983 52.820 1.00 0.00 O ATOM 27420 O34 PC 701 78.549 119.442 52.626 1.00 0.00 O ATOM 27421 O21 PC 701 76.604 116.679 49.065 1.00 0.00 O ATOM 27422 C21 PC 701 76.899 115.382 49.036 1.00 0.00 C ATOM 27423 O22 PC 701 76.708 114.549 49.899 1.00 0.00 O ATOM 27424 C12 OL 702 77.555 114.960 47.740 1.00 0.00 C ATOM 27425 H2R OL 702 77.996 113.987 47.967 1.00 0.00 H ATOM 27426 H2S OL 702 76.794 114.756 46.984 1.00 0.00 H ATOM 27427 C13 OL 702 78.776 115.910 47.369 1.00 0.00 C ATOM 27428 H3R OL 702 79.310 116.266 48.253 1.00 0.00 H ATOM 27429 H3S OL 702 79.477 115.275 46.823 1.00 0.00 H ATOM 27430 C14 OL 702 78.346 117.140 46.548 1.00 0.00 C ATOM 27431 H4R OL 702 77.772 117.704 47.286 1.00 0.00 H ATOM 27432 H4S OL 702 79.091 117.879 46.244 1.00 0.00 H ATOM 27433 C15 OL 702 77.524 116.805 45.193 1.00 0.00 C ATOM 27434 H5R OL 702 78.034 116.187 44.450 1.00 0.00 H ATOM 27435 H5S OL 702 76.572 116.424 45.567 1.00 0.00 H ATOM 27436 C16 OL 702 77.107 118.152 44.441 1.00 0.00 C ATOM 27437 H6R OL 702 78.034 118.673 44.195 1.00 0.00 H ATOM 27438 H6S OL 702 76.550 117.907 43.534 1.00 0.00 H ATOM 27439 C17 OL 702 76.286 119.237 45.136 1.00 0.00 C ATOM 27440 H7R OL 702 76.708 119.628 46.064 1.00 0.00 H ATOM 27441 H7S OL 702 76.411 120.112 44.494 1.00 0.00 H ATOM 27442 C18 OL 702 74.809 119.017 45.292 1.00 0.00 C ATOM 27443 H8R OL 702 74.463 118.222 44.628 1.00 0.00 H ATOM 27444 H8S OL 702 74.615 118.719 46.325 1.00 0.00 H ATOM 27445 C19 OL 702 74.064 120.275 44.974 1.00 0.00 C ATOM 27446 H9R OL 702 74.130 121.021 45.762 1.00 0.00 H ATOM 27447 C110 OL 702 73.405 120.487 43.800 1.00 0.00 C ATOM 27448 H10R OL 702 72.904 121.437 43.629 1.00 0.00 H ATOM 27449 C111 OL 702 73.398 119.591 42.590 1.00 0.00 C ATOM 27450 H11R OL 702 73.588 118.567 42.920 1.00 0.00 H ATOM 27451 H11S OL 702 72.415 119.328 42.194 1.00 0.00 H ATOM 27452 C112 OL 702 74.274 120.021 41.396 1.00 0.00 C ATOM 27453 H12R OL 702 74.090 121.040 41.050 1.00 0.00 H ATOM 27454 H12S OL 702 75.293 120.119 41.775 1.00 0.00 H ATOM 27455 C113 OL 702 74.233 119.012 40.214 1.00 0.00 C ATOM 27456 H13R OL 702 74.394 118.005 40.605 1.00 0.00 H ATOM 27457 H13S OL 702 73.222 119.073 39.806 1.00 0.00 H ATOM 27458 C114 OL 702 75.125 119.378 39.102 1.00 0.00 C ATOM 27459 H14R OL 702 75.143 118.520 38.427 1.00 0.00 H ATOM 27460 H14S OL 702 74.833 120.292 38.581 1.00 0.00 H ATOM 27461 C115 OL 702 76.587 119.647 39.585 1.00 0.00 C ATOM 27462 H15R OL 702 76.553 120.605 40.108 1.00 0.00 H ATOM 27463 H15S OL 702 76.911 118.901 40.315 1.00 0.00 H ATOM 27464 C116 OL 702 77.609 119.867 38.466 1.00 0.00 C ATOM 27465 H16R OL 702 77.491 118.967 37.858 1.00 0.00 H ATOM 27466 H16S OL 702 77.408 120.670 37.755 1.00 0.00 H ATOM 27467 C117 OL 702 79.003 120.080 39.008 1.00 0.00 C ATOM 27468 H17R OL 702 79.028 120.797 39.831 1.00 0.00 H ATOM 27469 H17S OL 702 79.392 119.183 39.495 1.00 0.00 H ATOM 27470 C118 OL 702 79.976 120.452 37.881 1.00 0.00 C ATOM 27471 H18R OL 702 81.003 120.574 38.231 1.00 0.00 H ATOM 27472 H18S OL 702 79.616 121.413 37.510 1.00 0.00 H ATOM 27473 H18T OL 702 80.018 119.816 36.994 1.00 0.00 H TER 27474 OL 702 ATOM 27474 C116 PA 703 5.277 123.006 48.664 1.00 0.00 C ATOM 27475 H16R PA 703 4.226 123.287 48.754 1.00 0.00 H ATOM 27476 H16S PA 703 5.316 121.916 48.721 1.00 0.00 H ATOM 27477 H16T PA 703 5.640 123.388 47.708 1.00 0.00 H ATOM 27478 C115 PA 703 6.069 123.648 49.773 1.00 0.00 C ATOM 27479 H15R PA 703 5.904 123.110 50.709 1.00 0.00 H ATOM 27480 H15S PA 703 5.730 124.657 50.014 1.00 0.00 H ATOM 27481 C114 PA 703 7.582 123.708 49.515 1.00 0.00 C ATOM 27482 H14R PA 703 7.735 124.376 48.665 1.00 0.00 H ATOM 27483 H14S PA 703 7.937 122.700 49.288 1.00 0.00 H ATOM 27484 C113 PA 703 8.338 124.069 50.751 1.00 0.00 C ATOM 27485 H13R PA 703 9.389 123.924 50.491 1.00 0.00 H ATOM 27486 H13S PA 703 8.347 123.298 51.524 1.00 0.00 H ATOM 27487 C112 PA 703 8.225 125.514 51.327 1.00 0.00 C ATOM 27488 H12R PA 703 9.126 125.711 51.911 1.00 0.00 H ATOM 27489 H12S PA 703 7.477 125.445 52.119 1.00 0.00 H ATOM 27490 C111 PA 703 7.960 126.694 50.304 1.00 0.00 C ATOM 27491 H11R PA 703 7.097 126.459 49.677 1.00 0.00 H ATOM 27492 H11S PA 703 8.812 126.765 49.624 1.00 0.00 H ATOM 27493 C110 PA 703 7.591 127.998 50.965 1.00 0.00 C ATOM 27494 H10R PA 703 8.479 128.568 51.246 1.00 0.00 H ATOM 27495 H10S PA 703 6.889 127.804 51.778 1.00 0.00 H ATOM 27496 C19 PA 703 6.934 128.967 49.989 1.00 0.00 C ATOM 27497 H9R PA 703 6.045 128.498 49.563 1.00 0.00 H ATOM 27498 H9S PA 703 7.633 129.075 49.157 1.00 0.00 H ATOM 27499 C18 PA 703 6.465 130.372 50.621 1.00 0.00 C ATOM 27500 H8R PA 703 7.266 130.721 51.276 1.00 0.00 H ATOM 27501 H8S PA 703 5.641 130.183 51.312 1.00 0.00 H ATOM 27502 C17 PA 703 6.034 131.371 49.564 1.00 0.00 C ATOM 27503 H7R PA 703 5.230 130.997 48.927 1.00 0.00 H ATOM 27504 H7S PA 703 6.895 131.752 49.010 1.00 0.00 H ATOM 27505 C16 PA 703 5.538 132.715 50.221 1.00 0.00 C ATOM 27506 H6R PA 703 4.615 132.541 50.778 1.00 0.00 H ATOM 27507 H6S PA 703 5.344 133.450 49.437 1.00 0.00 H ATOM 27508 C15 PA 703 6.633 133.452 51.071 1.00 0.00 C ATOM 27509 H5R PA 703 7.482 133.661 50.417 1.00 0.00 H ATOM 27510 H5S PA 703 6.793 132.713 51.860 1.00 0.00 H ATOM 27511 C14 PA 703 6.242 134.723 51.796 1.00 0.00 C ATOM 27512 H4R PA 703 6.278 135.534 51.065 1.00 0.00 H ATOM 27513 H4S PA 703 7.023 134.983 52.513 1.00 0.00 H ATOM 27514 C13 PA 703 4.931 134.772 52.500 1.00 0.00 C ATOM 27515 H3R PA 703 4.198 134.210 51.916 1.00 0.00 H ATOM 27516 H3S PA 703 4.539 135.791 52.520 1.00 0.00 H ATOM 27517 C12 PA 703 4.844 134.262 53.889 1.00 0.00 C ATOM 27518 H2R PA 703 3.837 134.361 54.301 1.00 0.00 H ATOM 27519 H2S PA 703 5.421 134.733 54.687 1.00 0.00 H ATOM 27520 C11 PGR 704 5.269 132.853 53.953 1.00 0.00 C ATOM 27521 O12 PGR 704 4.607 131.908 53.476 1.00 0.00 O ATOM 27522 O11 PGR 704 6.467 132.710 54.627 1.00 0.00 O ATOM 27523 C1 PGR 704 6.896 131.348 54.684 1.00 0.00 C ATOM 27524 HR PGR 704 7.159 131.102 53.652 1.00 0.00 H ATOM 27525 HS PGR 704 6.073 130.675 54.942 1.00 0.00 H ATOM 27526 C2 PGR 704 8.199 130.935 55.522 1.00 0.00 C ATOM 27527 HX PGR 704 8.238 129.846 55.607 1.00 0.00 H ATOM 27528 C3 PGR 704 8.281 131.628 56.908 1.00 0.00 C ATOM 27529 HA PGR 704 7.337 131.445 57.427 1.00 0.00 H ATOM 27530 HB PGR 704 8.304 132.710 56.757 1.00 0.00 H ATOM 27531 O31 PGR 704 9.473 131.065 57.507 1.00 0.00 O ATOM 27532 P31 PGR 704 10.061 131.553 58.895 1.00 0.00 P ATOM 27533 O32 PGR 704 10.582 132.961 58.605 1.00 0.00 O ATOM 27534 C31 PGR 704 11.917 133.135 58.016 1.00 0.00 C ATOM 27535 H1A PGR 704 12.739 132.573 58.465 1.00 0.00 H ATOM 27536 H1B PGR 704 12.132 134.197 58.157 1.00 0.00 H ATOM 27537 C32 PGR 704 12.032 132.737 56.536 1.00 0.00 C ATOM 27538 H2A PGR 704 11.220 133.249 56.014 1.00 0.00 H ATOM 27539 O35 PGR 704 11.923 131.281 56.248 1.00 0.00 O ATOM 27540 HO5A PGR 704 10.982 131.037 56.184 1.00 0.00 H ATOM 27541 C33 PGR 704 13.358 133.266 55.919 1.00 0.00 C ATOM 27542 H3A PGR 704 13.334 133.252 54.827 1.00 0.00 H ATOM 27543 H3B PGR 704 13.393 134.338 56.127 1.00 0.00 H ATOM 27544 O33 PGR 704 8.946 131.568 59.850 1.00 0.00 O ATOM 27545 O34 PGR 704 11.193 130.657 59.259 1.00 0.00 O ATOM 27546 O21 PGR 704 9.343 131.486 54.829 1.00 0.00 O ATOM 27547 C21 PGR 704 9.804 130.868 53.694 1.00 0.00 C ATOM 27548 O22 PGR 704 9.409 129.791 53.399 1.00 0.00 O ATOM 27549 O36 PGR 704 14.512 132.643 56.492 1.00 0.00 O ATOM 27550 HO6A PGR 704 14.491 131.670 56.505 1.00 0.00 H ATOM 27551 C12 OL 705 10.840 131.587 53.001 1.00 0.00 C ATOM 27552 H2R OL 705 10.782 132.561 53.491 1.00 0.00 H ATOM 27553 H2S OL 705 11.893 131.311 53.089 1.00 0.00 H ATOM 27554 C13 OL 705 10.517 131.858 51.528 1.00 0.00 C ATOM 27555 H3R OL 705 9.466 132.130 51.403 1.00 0.00 H ATOM 27556 H3S OL 705 11.166 132.714 51.334 1.00 0.00 H ATOM 27557 C14 OL 705 10.727 130.741 50.622 1.00 0.00 C ATOM 27558 H4R OL 705 11.701 130.282 50.804 1.00 0.00 H ATOM 27559 H4S OL 705 10.005 129.956 50.857 1.00 0.00 H ATOM 27560 C15 OL 705 10.528 131.198 49.131 1.00 0.00 C ATOM 27561 H5R OL 705 9.616 131.795 49.064 1.00 0.00 H ATOM 27562 H5S OL 705 11.282 131.894 48.759 1.00 0.00 H ATOM 27563 C16 OL 705 10.466 130.017 48.131 1.00 0.00 C ATOM 27564 H6R OL 705 11.323 129.371 48.334 1.00 0.00 H ATOM 27565 H6S OL 705 9.591 129.510 48.541 1.00 0.00 H ATOM 27566 C17 OL 705 10.251 130.362 46.679 1.00 0.00 C ATOM 27567 H7R OL 705 11.061 131.050 46.427 1.00 0.00 H ATOM 27568 H7S OL 705 10.397 129.519 46.000 1.00 0.00 H ATOM 27569 C18 OL 705 8.882 131.017 46.306 1.00 0.00 C ATOM 27570 H8R OL 705 8.463 131.636 47.102 1.00 0.00 H ATOM 27571 H8S OL 705 8.998 131.666 45.436 1.00 0.00 H ATOM 27572 C19 OL 705 7.906 129.924 46.017 1.00 0.00 C ATOM 27573 H9R OL 705 7.251 129.655 46.842 1.00 0.00 H ATOM 27574 C110 OL 705 7.744 129.369 44.871 1.00 0.00 C ATOM 27575 H10R OL 705 6.982 128.623 44.655 1.00 0.00 H ATOM 27576 C111 OL 705 8.528 129.689 43.611 1.00 0.00 C ATOM 27577 H11R OL 705 9.346 130.401 43.737 1.00 0.00 H ATOM 27578 H11S OL 705 9.026 128.826 43.164 1.00 0.00 H ATOM 27579 C112 OL 705 7.496 130.286 42.626 1.00 0.00 C ATOM 27580 H12R OL 705 6.985 131.201 42.934 1.00 0.00 H ATOM 27581 H12S OL 705 8.000 130.608 41.713 1.00 0.00 H ATOM 27582 C113 OL 705 6.344 129.378 42.081 1.00 0.00 C ATOM 27583 H13R OL 705 5.626 129.284 42.899 1.00 0.00 H ATOM 27584 H13S OL 705 5.776 129.999 41.385 1.00 0.00 H ATOM 27585 C114 OL 705 6.629 128.013 41.517 1.00 0.00 C ATOM 27586 H14R OL 705 6.850 128.009 40.447 1.00 0.00 H ATOM 27587 H14S OL 705 7.492 127.661 42.087 1.00 0.00 H ATOM 27588 C115 OL 705 5.544 126.949 41.674 1.00 0.00 C ATOM 27589 H15R OL 705 4.526 127.137 41.327 1.00 0.00 H ATOM 27590 H15S OL 705 5.808 126.004 41.195 1.00 0.00 H ATOM 27591 C116 OL 705 5.391 126.675 43.194 1.00 0.00 C ATOM 27592 H16R OL 705 6.319 126.327 43.654 1.00 0.00 H ATOM 27593 H16S OL 705 5.160 127.536 43.824 1.00 0.00 H ATOM 27594 C117 OL 705 4.386 125.541 43.519 1.00 0.00 C ATOM 27595 H17R OL 705 3.382 125.872 43.244 1.00 0.00 H ATOM 27596 H17S OL 705 4.530 124.611 42.967 1.00 0.00 H ATOM 27597 C118 OL 705 4.397 125.053 44.953 1.00 0.00 C ATOM 27598 H18R OL 705 4.521 126.015 45.453 1.00 0.00 H ATOM 27599 H18S OL 705 5.253 124.383 45.052 1.00 0.00 H ATOM 27600 H18T OL 705 3.543 124.459 45.287 1.00 0.00 H TER 27601 OL 705 ATOM 27601 C116 PA 706 37.107 84.960 38.263 1.00 0.00 C ATOM 27602 H16R PA 706 37.345 85.892 37.747 1.00 0.00 H ATOM 27603 H16S PA 706 36.078 84.989 38.629 1.00 0.00 H ATOM 27604 H16T PA 706 37.197 84.133 37.556 1.00 0.00 H ATOM 27605 C115 PA 706 37.995 84.796 39.473 1.00 0.00 C ATOM 27606 H15R PA 706 39.046 84.811 39.174 1.00 0.00 H ATOM 27607 H15S PA 706 37.873 83.790 39.880 1.00 0.00 H ATOM 27608 C114 PA 706 37.706 85.941 40.533 1.00 0.00 C ATOM 27609 H14R PA 706 36.651 85.901 40.811 1.00 0.00 H ATOM 27610 H14S PA 706 38.003 86.929 40.176 1.00 0.00 H ATOM 27611 C113 PA 706 38.493 85.682 41.827 1.00 0.00 C ATOM 27612 H13R PA 706 39.576 85.792 41.746 1.00 0.00 H ATOM 27613 H13S PA 706 38.465 84.615 42.059 1.00 0.00 H ATOM 27614 C112 PA 706 38.122 86.373 43.086 1.00 0.00 C ATOM 27615 H12R PA 706 37.053 86.341 43.308 1.00 0.00 H ATOM 27616 H12S PA 706 38.245 87.447 42.934 1.00 0.00 H ATOM 27617 C111 PA 706 38.777 85.814 44.282 1.00 0.00 C ATOM 27618 H11R PA 706 39.860 85.896 44.171 1.00 0.00 H ATOM 27619 H11S PA 706 38.575 84.742 44.337 1.00 0.00 H ATOM 27620 C110 PA 706 38.247 86.425 45.605 1.00 0.00 C ATOM 27621 H10R PA 706 37.176 86.257 45.474 1.00 0.00 H ATOM 27622 H10S PA 706 38.264 87.516 45.635 1.00 0.00 H ATOM 27623 C19 PA 706 38.942 85.816 46.820 1.00 0.00 C ATOM 27624 H9R PA 706 40.022 85.696 46.705 1.00 0.00 H ATOM 27625 H9S PA 706 38.507 84.825 46.968 1.00 0.00 H ATOM 27626 C18 PA 706 38.762 86.479 48.116 1.00 0.00 C ATOM 27627 H8R PA 706 39.094 87.517 48.048 1.00 0.00 H ATOM 27628 H8S PA 706 39.448 85.958 48.788 1.00 0.00 H ATOM 27629 C17 PA 706 37.267 86.589 48.608 1.00 0.00 C ATOM 27630 H7R PA 706 36.591 86.437 47.764 1.00 0.00 H ATOM 27631 H7S PA 706 37.103 87.647 48.826 1.00 0.00 H ATOM 27632 C16 PA 706 36.954 85.658 49.724 1.00 0.00 C ATOM 27633 H6R PA 706 37.068 84.605 49.461 1.00 0.00 H ATOM 27634 H6S PA 706 35.903 85.591 50.011 1.00 0.00 H ATOM 27635 C15 PA 706 37.787 85.897 50.986 1.00 0.00 C ATOM 27636 H5R PA 706 38.096 86.937 51.104 1.00 0.00 H ATOM 27637 H5S PA 706 38.733 85.355 50.929 1.00 0.00 H ATOM 27638 C14 PA 706 36.874 85.540 52.208 1.00 0.00 C ATOM 27639 H4R PA 706 36.696 84.466 52.120 1.00 0.00 H ATOM 27640 H4S PA 706 35.934 86.095 52.248 1.00 0.00 H ATOM 27641 C13 PA 706 37.460 85.698 53.632 1.00 0.00 C ATOM 27642 H3R PA 706 37.827 86.706 53.835 1.00 0.00 H ATOM 27643 H3S PA 706 38.304 85.005 53.668 1.00 0.00 H ATOM 27644 C12 PA 706 36.404 85.438 54.746 1.00 0.00 C ATOM 27645 H2R PA 706 35.712 84.664 54.409 1.00 0.00 H ATOM 27646 H2S PA 706 35.809 86.328 54.960 1.00 0.00 H ATOM 27647 C11 PGR 707 36.918 84.996 56.066 1.00 0.00 C ATOM 27648 O12 PGR 707 38.060 85.239 56.460 1.00 0.00 O ATOM 27649 O11 PGR 707 35.962 84.432 56.808 1.00 0.00 O ATOM 27650 C1 PGR 707 36.322 84.197 58.233 1.00 0.00 C ATOM 27651 HR PGR 707 37.324 83.787 58.379 1.00 0.00 H ATOM 27652 HS PGR 707 35.588 83.471 58.590 1.00 0.00 H ATOM 27653 C2 PGR 707 36.264 85.479 59.193 1.00 0.00 C ATOM 27654 HX PGR 707 36.953 86.281 58.917 1.00 0.00 H ATOM 27655 C3 PGR 707 36.551 85.103 60.668 1.00 0.00 C ATOM 27656 HA PGR 707 36.493 86.066 61.183 1.00 0.00 H ATOM 27657 HB PGR 707 37.576 84.727 60.726 1.00 0.00 H ATOM 27658 O31 PGR 707 35.616 84.177 61.192 1.00 0.00 O ATOM 27659 P31 PGR 707 36.078 83.086 62.268 1.00 0.00 P ATOM 27660 O32 PGR 707 34.774 82.300 62.670 1.00 0.00 O ATOM 27661 C31 PGR 707 34.587 80.888 62.461 1.00 0.00 C ATOM 27662 H1A PGR 707 35.380 80.413 63.045 1.00 0.00 H ATOM 27663 H1B PGR 707 34.633 80.565 61.418 1.00 0.00 H ATOM 27664 C32 PGR 707 33.324 80.392 63.105 1.00 0.00 C ATOM 27665 H2A PGR 707 33.332 80.794 64.122 1.00 0.00 H ATOM 27666 O35 PGR 707 32.144 80.921 62.490 1.00 0.00 O ATOM 27667 HO5A PGR 707 32.308 81.879 62.548 1.00 0.00 H ATOM 27668 C33 PGR 707 33.291 78.871 63.321 1.00 0.00 C ATOM 27669 H3A PGR 707 34.182 78.563 63.874 1.00 0.00 H ATOM 27670 H3B PGR 707 32.428 78.483 63.867 1.00 0.00 H ATOM 27671 O33 PGR 707 37.018 82.073 61.671 1.00 0.00 O ATOM 27672 O34 PGR 707 36.562 83.771 63.508 1.00 0.00 O ATOM 27673 O21 PGR 707 34.907 86.097 59.187 1.00 0.00 O ATOM 27674 C21 PGR 707 34.702 86.767 58.089 1.00 0.00 C ATOM 27675 O22 PGR 707 35.578 87.305 57.429 1.00 0.00 O ATOM 27676 O36 PGR 707 33.421 78.227 61.988 1.00 0.00 O ATOM 27677 HO6A PGR 707 32.825 78.670 61.358 1.00 0.00 H TER 27678 PGR 707 ATOM 27678 C12 OL 708 126.671 31.987 44.450 1.00 0.00 C ATOM 27679 H2R OL 708 126.834 31.520 45.423 1.00 0.00 H ATOM 27680 H2S OL 708 126.065 32.844 44.750 1.00 0.00 H ATOM 27681 C13 OL 708 128.047 32.443 43.815 1.00 0.00 C ATOM 27682 H3R OL 708 127.905 33.256 43.100 1.00 0.00 H ATOM 27683 H3S OL 708 128.623 32.804 44.669 1.00 0.00 H ATOM 27684 C14 OL 708 128.688 31.195 43.147 1.00 0.00 C ATOM 27685 H4R OL 708 129.640 31.540 42.738 1.00 0.00 H ATOM 27686 H4S OL 708 128.856 30.376 43.849 1.00 0.00 H ATOM 27687 C15 OL 708 127.933 30.590 41.934 1.00 0.00 C ATOM 27688 H5R OL 708 126.948 30.234 42.242 1.00 0.00 H ATOM 27689 H5S OL 708 127.773 31.350 41.166 1.00 0.00 H ATOM 27690 C16 OL 708 128.693 29.351 41.421 1.00 0.00 C ATOM 27691 H6R OL 708 129.715 29.687 41.236 1.00 0.00 H ATOM 27692 H6S OL 708 128.870 28.731 42.302 1.00 0.00 H ATOM 27693 C17 OL 708 128.039 28.558 40.338 1.00 0.00 C ATOM 27694 H7R OL 708 128.591 27.621 40.233 1.00 0.00 H ATOM 27695 H7S OL 708 126.986 28.338 40.528 1.00 0.00 H ATOM 27696 C18 OL 708 128.082 29.165 38.977 1.00 0.00 C ATOM 27697 H8R OL 708 127.442 28.562 38.330 1.00 0.00 H ATOM 27698 H8S OL 708 127.752 30.205 39.025 1.00 0.00 H ATOM 27699 C19 OL 708 129.461 29.211 38.361 1.00 0.00 C ATOM 27700 H9R OL 708 130.163 29.136 39.187 1.00 0.00 H ATOM 27701 C110 OL 708 129.841 29.270 37.144 1.00 0.00 C ATOM 27702 H10R OL 708 130.895 29.135 36.916 1.00 0.00 H ATOM 27703 C111 OL 708 128.979 29.455 35.932 1.00 0.00 C ATOM 27704 H11R OL 708 127.955 29.631 36.270 1.00 0.00 H ATOM 27705 H11S OL 708 129.346 30.398 35.520 1.00 0.00 H ATOM 27706 C112 OL 708 129.228 28.294 34.928 1.00 0.00 C ATOM 27707 H12R OL 708 130.284 28.307 34.649 1.00 0.00 H ATOM 27708 H12S OL 708 128.928 27.407 35.489 1.00 0.00 H ATOM 27709 C113 OL 708 128.282 28.394 33.699 1.00 0.00 C ATOM 27710 H13R OL 708 127.249 28.127 33.933 1.00 0.00 H ATOM 27711 H13S OL 708 128.143 29.373 33.236 1.00 0.00 H ATOM 27712 C114 OL 708 128.840 27.402 32.741 1.00 0.00 C ATOM 27713 H14R OL 708 129.847 27.804 32.608 1.00 0.00 H ATOM 27714 H14S OL 708 128.849 26.404 33.184 1.00 0.00 H ATOM 27715 C115 OL 708 128.139 27.306 31.385 1.00 0.00 C ATOM 27716 H15R OL 708 128.745 26.681 30.727 1.00 0.00 H ATOM 27717 H15S OL 708 127.148 26.854 31.460 1.00 0.00 H ATOM 27718 C116 OL 708 127.762 28.573 30.542 1.00 0.00 C ATOM 27719 H16R OL 708 126.980 29.138 31.053 1.00 0.00 H ATOM 27720 H16S OL 708 128.525 29.354 30.558 1.00 0.00 H ATOM 27721 C117 OL 708 127.398 28.225 29.037 1.00 0.00 C ATOM 27722 H17R OL 708 128.228 27.839 28.441 1.00 0.00 H ATOM 27723 H17S OL 708 126.629 27.453 29.113 1.00 0.00 H ATOM 27724 C118 OL 708 126.907 29.454 28.325 1.00 0.00 C ATOM 27725 H18R OL 708 126.481 29.172 27.360 1.00 0.00 H ATOM 27726 H18S OL 708 127.661 30.205 28.080 1.00 0.00 H ATOM 27727 H18T OL 708 126.069 29.961 28.807 1.00 0.00 H TER 27728 OL 708 ATOM 27728 C116 PA 709 28.485 -0.228 39.824 1.00 0.00 C ATOM 27729 H16R PA 709 29.394 -0.579 39.330 1.00 0.00 H ATOM 27730 H16S PA 709 28.123 0.699 39.374 1.00 0.00 H ATOM 27731 H16T PA 709 27.707 -0.994 39.850 1.00 0.00 H ATOM 27732 C115 PA 709 28.922 0.112 41.290 1.00 0.00 C ATOM 27733 H15R PA 709 29.623 0.945 41.204 1.00 0.00 H ATOM 27734 H15S PA 709 29.459 -0.646 41.863 1.00 0.00 H ATOM 27735 C114 PA 709 27.646 0.528 41.962 1.00 0.00 C ATOM 27736 H14R PA 709 26.958 -0.283 42.213 1.00 0.00 H ATOM 27737 H14S PA 709 27.131 1.233 41.306 1.00 0.00 H ATOM 27738 C113 PA 709 27.878 1.265 43.263 1.00 0.00 C ATOM 27739 H13R PA 709 28.668 2.018 43.247 1.00 0.00 H ATOM 27740 H13S PA 709 28.339 0.600 43.997 1.00 0.00 H ATOM 27741 C112 PA 709 26.526 1.686 43.840 1.00 0.00 C ATOM 27742 H12R PA 709 25.823 0.868 44.013 1.00 0.00 H ATOM 27743 H12S PA 709 26.006 2.318 43.118 1.00 0.00 H ATOM 27744 C111 PA 709 26.789 2.390 45.193 1.00 0.00 C ATOM 27745 H11R PA 709 27.675 3.023 45.268 1.00 0.00 H ATOM 27746 H11S PA 709 26.961 1.646 45.974 1.00 0.00 H ATOM 27747 C110 PA 709 25.567 3.180 45.706 1.00 0.00 C ATOM 27748 H10R PA 709 24.585 2.768 45.464 1.00 0.00 H ATOM 27749 H10S PA 709 25.469 4.040 45.040 1.00 0.00 H ATOM 27750 C19 PA 709 25.645 3.579 47.198 1.00 0.00 C ATOM 27751 H9R PA 709 25.814 2.687 47.804 1.00 0.00 H ATOM 27752 H9S PA 709 24.711 4.124 47.350 1.00 0.00 H ATOM 27753 C18 PA 709 26.765 4.532 47.586 1.00 0.00 C ATOM 27754 H8R PA 709 26.777 5.322 46.831 1.00 0.00 H ATOM 27755 H8S PA 709 27.678 3.944 47.467 1.00 0.00 H ATOM 27756 C17 PA 709 26.601 5.146 48.900 1.00 0.00 C ATOM 27757 H7R PA 709 26.599 4.414 49.711 1.00 0.00 H ATOM 27758 H7S PA 709 25.621 5.626 48.932 1.00 0.00 H ATOM 27759 C16 PA 709 27.621 6.091 49.305 1.00 0.00 C ATOM 27760 H6R PA 709 27.719 6.850 48.526 1.00 0.00 H ATOM 27761 H6S PA 709 28.667 5.779 49.348 1.00 0.00 H ATOM 27762 C15 PA 709 27.255 6.745 50.649 1.00 0.00 C ATOM 27763 H5R PA 709 27.041 6.026 51.442 1.00 0.00 H ATOM 27764 H5S PA 709 26.361 7.367 50.571 1.00 0.00 H ATOM 27765 C14 PA 709 28.397 7.643 51.162 1.00 0.00 C ATOM 27766 H4R PA 709 28.673 8.294 50.330 1.00 0.00 H ATOM 27767 H4S PA 709 29.315 7.168 51.514 1.00 0.00 H ATOM 27768 C13 PA 709 27.971 8.661 52.209 1.00 0.00 C ATOM 27769 H3R PA 709 27.219 9.383 51.884 1.00 0.00 H ATOM 27770 H3S PA 709 28.776 9.393 52.309 1.00 0.00 H ATOM 27771 C12 PA 709 27.530 8.138 53.482 1.00 0.00 C ATOM 27772 H2R PA 709 26.501 7.800 53.345 1.00 0.00 H ATOM 27773 H2S PA 709 27.652 8.935 54.219 1.00 0.00 H ATOM 27774 C11 PGR 710 28.305 6.977 54.123 1.00 0.00 C ATOM 27775 O12 PGR 710 27.786 6.066 54.783 1.00 0.00 O ATOM 27776 O11 PGR 710 29.667 7.344 54.239 1.00 0.00 O ATOM 27777 C1 PGR 710 30.513 6.563 55.082 1.00 0.00 C ATOM 27778 HR PGR 710 30.098 6.559 56.094 1.00 0.00 H ATOM 27779 HS PGR 710 31.483 7.065 55.065 1.00 0.00 H ATOM 27780 C2 PGR 710 30.651 5.107 54.671 1.00 0.00 C ATOM 27781 HX PGR 710 29.659 4.685 54.490 1.00 0.00 H ATOM 27782 C3 PGR 710 31.359 4.249 55.672 1.00 0.00 C ATOM 27783 HA PGR 710 31.125 4.548 56.697 1.00 0.00 H ATOM 27784 HB PGR 710 32.440 4.412 55.643 1.00 0.00 H ATOM 27785 O31 PGR 710 31.003 2.935 55.480 1.00 0.00 O ATOM 27786 P31 PGR 710 31.433 1.842 56.538 1.00 0.00 P ATOM 27787 O32 PGR 710 30.861 2.382 57.904 1.00 0.00 O ATOM 27788 C31 PGR 710 29.485 2.327 58.287 1.00 0.00 C ATOM 27789 H1A PGR 710 29.216 1.303 58.015 1.00 0.00 H ATOM 27790 H1B PGR 710 29.100 3.184 57.728 1.00 0.00 H ATOM 27791 C32 PGR 710 29.230 2.576 59.786 1.00 0.00 C ATOM 27792 H2A PGR 710 28.145 2.669 59.884 1.00 0.00 H ATOM 27793 O35 PGR 710 29.778 3.840 60.101 1.00 0.00 O ATOM 27794 HO5A PGR 710 30.750 3.863 60.039 1.00 0.00 H ATOM 27795 C33 PGR 710 29.699 1.336 60.689 1.00 0.00 C ATOM 27796 H3A PGR 710 28.965 0.549 60.495 1.00 0.00 H ATOM 27797 H3B PGR 710 30.644 0.923 60.328 1.00 0.00 H ATOM 27798 O33 PGR 710 30.685 0.635 56.173 1.00 0.00 O ATOM 27799 O34 PGR 710 32.904 1.881 56.681 1.00 0.00 O ATOM 27800 O21 PGR 710 31.392 5.004 53.428 1.00 0.00 O ATOM 27801 C21 PGR 710 30.774 4.684 52.301 1.00 0.00 C ATOM 27802 O22 PGR 710 29.532 4.751 52.175 1.00 0.00 O ATOM 27803 O36 PGR 710 29.844 1.664 62.095 1.00 0.00 O ATOM 27804 HO6A PGR 710 30.356 2.487 62.186 1.00 0.00 H ATOM 27805 C12 OL 711 31.711 4.417 51.203 1.00 0.00 C ATOM 27806 H2R OL 711 32.154 5.386 50.963 1.00 0.00 H ATOM 27807 H2S OL 711 32.518 3.816 51.627 1.00 0.00 H ATOM 27808 C13 OL 711 31.089 3.616 49.949 1.00 0.00 C ATOM 27809 H3R OL 711 30.325 2.954 50.362 1.00 0.00 H ATOM 27810 H3S OL 711 30.684 4.392 49.296 1.00 0.00 H ATOM 27811 C14 OL 711 31.966 2.723 49.186 1.00 0.00 C ATOM 27812 H4R OL 711 32.581 3.297 48.489 1.00 0.00 H ATOM 27813 H4S OL 711 32.571 2.130 49.874 1.00 0.00 H ATOM 27814 C15 OL 711 31.255 1.729 48.319 1.00 0.00 C ATOM 27815 H5R OL 711 32.088 1.265 47.788 1.00 0.00 H ATOM 27816 H5S OL 711 30.801 0.937 48.919 1.00 0.00 H ATOM 27817 C16 OL 711 30.231 2.263 47.325 1.00 0.00 C ATOM 27818 H6R OL 711 29.908 1.432 46.694 1.00 0.00 H ATOM 27819 H6S OL 711 29.313 2.523 47.855 1.00 0.00 H ATOM 27820 C17 OL 711 30.722 3.455 46.477 1.00 0.00 C ATOM 27821 H7R OL 711 29.831 3.808 45.953 1.00 0.00 H ATOM 27822 H7S OL 711 31.095 4.340 46.997 1.00 0.00 H ATOM 27823 C18 OL 711 31.529 3.009 45.272 1.00 0.00 C ATOM 27824 H8R OL 711 31.534 1.919 45.208 1.00 0.00 H ATOM 27825 H8S OL 711 31.136 3.302 44.296 1.00 0.00 H ATOM 27826 C19 OL 711 33.000 3.339 45.363 1.00 0.00 C ATOM 27827 H9R OL 711 33.376 3.454 46.376 1.00 0.00 H ATOM 27828 C110 OL 711 33.837 3.557 44.361 1.00 0.00 C ATOM 27829 H10R OL 711 34.844 3.909 44.567 1.00 0.00 H ATOM 27830 C111 OL 711 33.613 3.379 42.918 1.00 0.00 C ATOM 27831 H11R OL 711 34.351 2.687 42.506 1.00 0.00 H ATOM 27832 H11S OL 711 32.630 2.996 42.633 1.00 0.00 H ATOM 27833 C112 OL 711 33.797 4.567 42.010 1.00 0.00 C ATOM 27834 H12R OL 711 33.296 4.324 41.070 1.00 0.00 H ATOM 27835 H12S OL 711 33.144 5.340 42.420 1.00 0.00 H ATOM 27836 C113 OL 711 35.247 5.033 41.889 1.00 0.00 C ATOM 27837 H13R OL 711 35.757 5.294 42.818 1.00 0.00 H ATOM 27838 H13S OL 711 35.885 4.211 41.556 1.00 0.00 H ATOM 27839 C114 OL 711 35.418 6.216 40.841 1.00 0.00 C ATOM 27840 H14R OL 711 34.749 5.965 40.015 1.00 0.00 H ATOM 27841 H14S OL 711 35.039 7.133 41.297 1.00 0.00 H ATOM 27842 C115 OL 711 36.835 6.377 40.259 1.00 0.00 C ATOM 27843 H15R OL 711 37.571 6.681 41.007 1.00 0.00 H ATOM 27844 H15S OL 711 37.199 5.421 39.879 1.00 0.00 H ATOM 27845 C116 OL 711 36.754 7.484 39.284 1.00 0.00 C ATOM 27846 H16R OL 711 36.108 7.278 38.427 1.00 0.00 H ATOM 27847 H16S OL 711 36.350 8.340 39.828 1.00 0.00 H ATOM 27848 C117 OL 711 38.069 7.965 38.742 1.00 0.00 C ATOM 27849 H17R OL 711 38.684 8.388 39.539 1.00 0.00 H ATOM 27850 H17S OL 711 38.743 7.134 38.523 1.00 0.00 H ATOM 27851 C118 OL 711 38.068 8.990 37.679 1.00 0.00 C ATOM 27852 H18R OL 711 39.062 9.350 37.407 1.00 0.00 H ATOM 27853 H18S OL 711 37.511 9.822 38.116 1.00 0.00 H ATOM 27854 H18T OL 711 37.666 8.761 36.690 1.00 0.00 H TER 27855 OL 711 ATOM 27855 C116 PA 712 111.321 109.798 44.464 1.00 0.00 C ATOM 27856 H16R PA 712 111.713 110.817 44.480 1.00 0.00 H ATOM 27857 H16S PA 712 110.270 109.983 44.229 1.00 0.00 H ATOM 27858 H16T PA 712 111.834 109.267 43.660 1.00 0.00 H ATOM 27859 C115 PA 712 111.403 109.120 45.807 1.00 0.00 C ATOM 27860 H15R PA 712 110.858 108.179 45.704 1.00 0.00 H ATOM 27861 H15S PA 712 110.810 109.649 46.556 1.00 0.00 H ATOM 27862 C114 PA 712 112.759 108.995 46.466 1.00 0.00 C ATOM 27863 H14R PA 712 113.219 109.984 46.429 1.00 0.00 H ATOM 27864 H14S PA 712 113.343 108.367 45.789 1.00 0.00 H ATOM 27865 C113 PA 712 112.883 108.334 47.770 1.00 0.00 C ATOM 27866 H13R PA 712 112.374 108.903 48.550 1.00 0.00 H ATOM 27867 H13S PA 712 113.953 108.237 47.969 1.00 0.00 H ATOM 27868 C112 PA 712 112.253 106.925 47.952 1.00 0.00 C ATOM 27869 H12R PA 712 112.660 106.357 47.112 1.00 0.00 H ATOM 27870 H12S PA 712 111.176 107.100 47.918 1.00 0.00 H ATOM 27871 C111 PA 712 112.687 106.217 49.261 1.00 0.00 C ATOM 27872 H11R PA 712 112.765 106.849 50.148 1.00 0.00 H ATOM 27873 H11S PA 712 113.718 105.871 49.160 1.00 0.00 H ATOM 27874 C110 PA 712 111.826 105.080 49.727 1.00 0.00 C ATOM 27875 H10R PA 712 111.664 104.397 48.890 1.00 0.00 H ATOM 27876 H10S PA 712 110.801 105.301 50.034 1.00 0.00 H ATOM 27877 C19 PA 712 112.418 104.201 50.772 1.00 0.00 C ATOM 27878 H9R PA 712 113.496 104.025 50.742 1.00 0.00 H ATOM 27879 H9S PA 712 111.861 103.262 50.807 1.00 0.00 H ATOM 27880 C18 PA 712 112.174 104.835 52.170 1.00 0.00 C ATOM 27881 H8R PA 712 111.152 104.593 52.470 1.00 0.00 H ATOM 27882 H8S PA 712 112.261 105.923 52.207 1.00 0.00 H ATOM 27883 C17 PA 712 113.092 104.488 53.329 1.00 0.00 C ATOM 27884 H7R PA 712 112.737 104.935 54.260 1.00 0.00 H ATOM 27885 H7S PA 712 114.063 104.952 53.145 1.00 0.00 H ATOM 27886 C16 PA 712 113.185 102.967 53.416 1.00 0.00 C ATOM 27887 H6R PA 712 113.947 102.549 52.755 1.00 0.00 H ATOM 27888 H6S PA 712 112.243 102.511 53.103 1.00 0.00 H ATOM 27889 C15 PA 712 113.606 102.368 54.776 1.00 0.00 C ATOM 27890 H5R PA 712 113.092 101.405 54.737 1.00 0.00 H ATOM 27891 H5S PA 712 113.107 102.945 55.557 1.00 0.00 H ATOM 27892 C14 PA 712 115.111 102.275 54.951 1.00 0.00 C ATOM 27893 H4R PA 712 115.550 103.274 54.974 1.00 0.00 H ATOM 27894 H4S PA 712 115.531 101.682 54.136 1.00 0.00 H ATOM 27895 C13 PA 712 115.412 101.610 56.281 1.00 0.00 C ATOM 27896 H3R PA 712 115.098 100.564 56.276 1.00 0.00 H ATOM 27897 H3S PA 712 114.890 102.099 57.106 1.00 0.00 H ATOM 27898 C12 PA 712 116.924 101.553 56.523 1.00 0.00 C ATOM 27899 H2R PA 712 117.232 102.600 56.474 1.00 0.00 H ATOM 27900 H2S PA 712 117.504 101.009 55.775 1.00 0.00 H ATOM 27901 C11 PGR 713 117.102 100.867 57.854 1.00 0.00 C ATOM 27902 O12 PGR 713 117.411 101.482 58.855 1.00 0.00 O ATOM 27903 O11 PGR 713 116.903 99.483 57.766 1.00 0.00 O ATOM 27904 C1 PGR 713 117.399 98.716 58.918 1.00 0.00 C ATOM 27905 HR PGR 713 116.968 97.735 59.136 1.00 0.00 H ATOM 27906 HS PGR 713 117.233 99.320 59.814 1.00 0.00 H ATOM 27907 C2 PGR 713 118.919 98.487 58.803 1.00 0.00 C ATOM 27908 HX PGR 713 119.097 97.513 58.341 1.00 0.00 H ATOM 27909 C3 PGR 713 119.513 98.411 60.179 1.00 0.00 C ATOM 27910 HA PGR 713 120.557 98.097 60.091 1.00 0.00 H ATOM 27911 HB PGR 713 118.872 97.869 60.879 1.00 0.00 H ATOM 27912 O31 PGR 713 119.615 99.759 60.727 1.00 0.00 O ATOM 27913 P31 PGR 713 120.208 100.081 62.176 1.00 0.00 P ATOM 27914 O32 PGR 713 119.083 99.569 63.264 1.00 0.00 O ATOM 27915 C31 PGR 713 119.205 98.337 63.931 1.00 0.00 C ATOM 27916 H1A PGR 713 120.086 98.338 64.579 1.00 0.00 H ATOM 27917 H1B PGR 713 119.260 97.505 63.225 1.00 0.00 H ATOM 27918 C32 PGR 713 117.986 98.169 64.879 1.00 0.00 C ATOM 27919 H2A PGR 713 118.128 97.358 65.598 1.00 0.00 H ATOM 27920 O35 PGR 713 116.768 98.015 64.067 1.00 0.00 O ATOM 27921 HO5A PGR 713 116.827 97.080 63.801 1.00 0.00 H ATOM 27922 C33 PGR 713 117.758 99.357 65.774 1.00 0.00 C ATOM 27923 H3A PGR 713 118.534 99.421 66.541 1.00 0.00 H ATOM 27924 H3B PGR 713 117.823 100.280 65.192 1.00 0.00 H ATOM 27925 O33 PGR 713 121.426 99.300 62.281 1.00 0.00 O ATOM 27926 O34 PGR 713 120.267 101.581 62.300 1.00 0.00 O ATOM 27927 O21 PGR 713 119.520 99.552 58.071 1.00 0.00 O ATOM 27928 C21 PGR 713 120.704 99.493 57.355 1.00 0.00 C ATOM 27929 O22 PGR 713 121.356 98.444 57.333 1.00 0.00 O ATOM 27930 O36 PGR 713 116.496 99.297 66.468 1.00 0.00 O ATOM 27931 HO6A PGR 713 115.985 98.823 65.787 1.00 0.00 H ATOM 27932 C12 OL 714 121.126 100.750 56.681 1.00 0.00 C ATOM 27933 H2R OL 714 120.280 101.438 56.725 1.00 0.00 H ATOM 27934 H2S OL 714 121.989 101.136 57.228 1.00 0.00 H ATOM 27935 C13 OL 714 121.470 100.432 55.180 1.00 0.00 C ATOM 27936 H3R OL 714 121.948 101.271 54.670 1.00 0.00 H ATOM 27937 H3S OL 714 122.211 99.636 55.282 1.00 0.00 H ATOM 27938 C14 OL 714 120.186 100.105 54.462 1.00 0.00 C ATOM 27939 H4R OL 714 119.591 99.441 55.092 1.00 0.00 H ATOM 27940 H4S OL 714 119.769 101.084 54.217 1.00 0.00 H ATOM 27941 C15 OL 714 120.603 99.317 53.232 1.00 0.00 C ATOM 27942 H5R OL 714 121.344 99.767 52.568 1.00 0.00 H ATOM 27943 H5S OL 714 121.075 98.409 53.615 1.00 0.00 H ATOM 27944 C16 OL 714 119.462 98.893 52.338 1.00 0.00 C ATOM 27945 H6R OL 714 119.240 99.749 51.696 1.00 0.00 H ATOM 27946 H6S OL 714 119.822 98.179 51.595 1.00 0.00 H ATOM 27947 C17 OL 714 118.230 98.270 53.012 1.00 0.00 C ATOM 27948 H7R OL 714 117.823 97.434 52.438 1.00 0.00 H ATOM 27949 H7S OL 714 118.481 97.725 53.925 1.00 0.00 H ATOM 27950 C18 OL 714 117.136 99.297 53.159 1.00 0.00 C ATOM 27951 H8R OL 714 117.417 100.239 53.634 1.00 0.00 H ATOM 27952 H8S OL 714 116.653 99.720 52.276 1.00 0.00 H ATOM 27953 C19 OL 714 116.190 98.558 54.077 1.00 0.00 C ATOM 27954 H9R OL 714 116.361 98.706 55.140 1.00 0.00 H ATOM 27955 C110 OL 714 115.115 97.807 53.743 1.00 0.00 C ATOM 27956 H10R OL 714 114.471 97.344 54.487 1.00 0.00 H ATOM 27957 C111 OL 714 114.625 97.523 52.386 1.00 0.00 C ATOM 27958 H11R OL 714 115.445 97.632 51.673 1.00 0.00 H ATOM 27959 H11S OL 714 114.367 96.462 52.360 1.00 0.00 H ATOM 27960 C112 OL 714 113.347 98.509 51.946 1.00 0.00 C ATOM 27961 H12R OL 714 112.439 98.251 52.496 1.00 0.00 H ATOM 27962 H12S OL 714 113.650 99.547 52.096 1.00 0.00 H ATOM 27963 C113 OL 714 113.049 98.468 50.487 1.00 0.00 C ATOM 27964 H13R OL 714 112.224 99.162 50.315 1.00 0.00 H ATOM 27965 H13S OL 714 113.967 98.626 49.917 1.00 0.00 H ATOM 27966 C114 OL 714 112.538 97.036 50.150 1.00 0.00 C ATOM 27967 H14R OL 714 113.313 96.281 50.298 1.00 0.00 H ATOM 27968 H14S OL 714 111.849 96.698 50.927 1.00 0.00 H ATOM 27969 C115 OL 714 111.856 96.825 48.812 1.00 0.00 C ATOM 27970 H15R OL 714 110.879 97.312 48.811 1.00 0.00 H ATOM 27971 H15S OL 714 112.393 97.355 48.022 1.00 0.00 H ATOM 27972 C116 OL 714 111.644 95.392 48.474 1.00 0.00 C ATOM 27973 H16R OL 714 112.546 94.867 48.796 1.00 0.00 H ATOM 27974 H16S OL 714 110.906 94.948 49.146 1.00 0.00 H ATOM 27975 C117 OL 714 111.343 94.937 47.019 1.00 0.00 C ATOM 27976 H17R OL 714 112.207 95.225 46.416 1.00 0.00 H ATOM 27977 H17S OL 714 111.048 93.892 46.901 1.00 0.00 H ATOM 27978 C118 OL 714 110.136 95.741 46.510 1.00 0.00 C ATOM 27979 H18R OL 714 109.941 95.670 45.438 1.00 0.00 H ATOM 27980 H18S OL 714 110.342 96.809 46.606 1.00 0.00 H ATOM 27981 H18T OL 714 109.224 95.555 47.082 1.00 0.00 H TER 27982 OL 714 ATOM 27982 C116 PA 715 100.345 138.432 41.066 1.00 0.00 C ATOM 27983 H16R PA 715 100.053 138.543 40.019 1.00 0.00 H ATOM 27984 H16S PA 715 99.529 138.336 41.785 1.00 0.00 H ATOM 27985 H16T PA 715 100.857 137.467 41.078 1.00 0.00 H ATOM 27986 C115 PA 715 101.414 139.420 41.510 1.00 0.00 C ATOM 27987 H15R PA 715 101.895 139.524 40.535 1.00 0.00 H ATOM 27988 H15S PA 715 102.056 138.983 42.278 1.00 0.00 H ATOM 27989 C114 PA 715 100.850 140.731 42.037 1.00 0.00 C ATOM 27990 H14R PA 715 100.421 140.616 43.034 1.00 0.00 H ATOM 27991 H14S PA 715 100.094 141.109 41.344 1.00 0.00 H ATOM 27992 C113 PA 715 101.875 141.842 42.138 1.00 0.00 C ATOM 27993 H13R PA 715 101.238 142.730 42.122 1.00 0.00 H ATOM 27994 H13S PA 715 102.540 141.807 41.273 1.00 0.00 H ATOM 27995 C112 PA 715 102.828 141.809 43.323 1.00 0.00 C ATOM 27996 H12R PA 715 103.312 140.831 43.286 1.00 0.00 H ATOM 27997 H12S PA 715 102.223 142.034 44.203 1.00 0.00 H ATOM 27998 C111 PA 715 103.914 142.844 43.326 1.00 0.00 C ATOM 27999 H11R PA 715 103.651 143.903 43.375 1.00 0.00 H ATOM 28000 H11S PA 715 104.330 142.801 42.318 1.00 0.00 H ATOM 28001 C110 PA 715 104.985 142.674 44.373 1.00 0.00 C ATOM 28002 H10R PA 715 105.878 143.042 43.864 1.00 0.00 H ATOM 28003 H10S PA 715 105.117 141.590 44.395 1.00 0.00 H ATOM 28004 C19 PA 715 104.811 143.297 45.770 1.00 0.00 C ATOM 28005 H9R PA 715 103.846 142.988 46.178 1.00 0.00 H ATOM 28006 H9S PA 715 104.587 144.357 45.631 1.00 0.00 H ATOM 28007 C18 PA 715 106.018 143.127 46.723 1.00 0.00 C ATOM 28008 H8R PA 715 106.974 143.408 46.276 1.00 0.00 H ATOM 28009 H8S PA 715 106.171 142.064 46.918 1.00 0.00 H ATOM 28010 C17 PA 715 105.940 143.679 48.059 1.00 0.00 C ATOM 28011 H7R PA 715 104.919 143.966 48.316 1.00 0.00 H ATOM 28012 H7S PA 715 106.341 144.695 48.066 1.00 0.00 H ATOM 28013 C16 PA 715 106.542 142.796 49.145 1.00 0.00 C ATOM 28014 H6R PA 715 107.604 142.630 48.957 1.00 0.00 H ATOM 28015 H6S PA 715 106.094 141.802 49.217 1.00 0.00 H ATOM 28016 C15 PA 715 106.411 143.405 50.483 1.00 0.00 C ATOM 28017 H5R PA 715 106.682 142.584 51.150 1.00 0.00 H ATOM 28018 H5S PA 715 105.396 143.781 50.623 1.00 0.00 H ATOM 28019 C14 PA 715 107.365 144.608 50.815 1.00 0.00 C ATOM 28020 H4R PA 715 107.191 145.432 50.121 1.00 0.00 H ATOM 28021 H4S PA 715 108.373 144.464 50.419 1.00 0.00 H ATOM 28022 C13 PA 715 107.196 145.222 52.234 1.00 0.00 C ATOM 28023 H3R PA 715 106.171 145.461 52.526 1.00 0.00 H ATOM 28024 H3S PA 715 107.754 146.160 52.255 1.00 0.00 H ATOM 28025 C12 PA 715 107.780 144.292 53.266 1.00 0.00 C ATOM 28026 H2R PA 715 108.780 144.032 52.914 1.00 0.00 H ATOM 28027 H2S PA 715 107.273 143.326 53.301 1.00 0.00 H ATOM 28028 C11 PGR 716 107.881 145.007 54.557 1.00 0.00 C ATOM 28029 O12 PGR 716 107.003 145.251 55.347 1.00 0.00 O ATOM 28030 O11 PGR 716 109.146 145.419 54.795 1.00 0.00 O ATOM 28031 C1 PGR 716 109.582 146.090 56.031 1.00 0.00 C ATOM 28032 HR PGR 716 108.950 146.961 56.223 1.00 0.00 H ATOM 28033 HS PGR 716 110.516 146.643 55.897 1.00 0.00 H ATOM 28034 C2 PGR 716 109.592 145.119 57.179 1.00 0.00 C ATOM 28035 HX PGR 716 108.567 144.740 57.206 1.00 0.00 H ATOM 28036 C3 PGR 716 109.776 145.719 58.607 1.00 0.00 C ATOM 28037 HA PGR 716 109.091 146.570 58.627 1.00 0.00 H ATOM 28038 HB PGR 716 110.798 146.098 58.691 1.00 0.00 H ATOM 28039 O31 PGR 716 109.443 144.801 59.616 1.00 0.00 O ATOM 28040 P31 PGR 716 109.194 145.399 61.042 1.00 0.00 P ATOM 28041 O32 PGR 716 110.506 146.215 61.479 1.00 0.00 O ATOM 28042 C31 PGR 716 111.749 145.528 61.798 1.00 0.00 C ATOM 28043 H1A PGR 716 112.541 146.253 61.591 1.00 0.00 H ATOM 28044 H1B PGR 716 112.004 144.732 61.093 1.00 0.00 H ATOM 28045 C32 PGR 716 111.707 145.122 63.348 1.00 0.00 C ATOM 28046 H2A PGR 716 112.718 144.983 63.740 1.00 0.00 H ATOM 28047 O35 PGR 716 111.085 143.807 63.379 1.00 0.00 O ATOM 28048 HO5A PGR 716 110.219 144.089 63.034 1.00 0.00 H ATOM 28049 C33 PGR 716 110.804 146.024 64.246 1.00 0.00 C ATOM 28050 H3A PGR 716 110.746 147.075 63.949 1.00 0.00 H ATOM 28051 H3B PGR 716 109.773 145.663 64.233 1.00 0.00 H ATOM 28052 O33 PGR 716 108.120 146.393 61.075 1.00 0.00 O ATOM 28053 O34 PGR 716 109.013 144.225 61.922 1.00 0.00 O ATOM 28054 O21 PGR 716 110.425 143.977 56.850 1.00 0.00 O ATOM 28055 C21 PGR 716 111.707 144.105 56.685 1.00 0.00 C ATOM 28056 O22 PGR 716 112.354 145.112 56.824 1.00 0.00 O ATOM 28057 O36 PGR 716 111.218 146.027 65.662 1.00 0.00 O ATOM 28058 HO6A PGR 716 111.663 145.206 65.941 1.00 0.00 H ATOM 28059 C12 OL 717 112.281 142.816 56.232 1.00 0.00 C ATOM 28060 H2R OL 717 113.169 142.603 56.831 1.00 0.00 H ATOM 28061 H2S OL 717 111.540 142.048 56.463 1.00 0.00 H ATOM 28062 C13 OL 717 112.817 142.844 54.804 1.00 0.00 C ATOM 28063 H3R OL 717 113.430 143.743 54.712 1.00 0.00 H ATOM 28064 H3S OL 717 113.513 142.015 54.655 1.00 0.00 H ATOM 28065 C14 OL 717 111.681 142.839 53.725 1.00 0.00 C ATOM 28066 H4R OL 717 111.037 141.959 53.777 1.00 0.00 H ATOM 28067 H4S OL 717 111.021 143.625 54.098 1.00 0.00 H ATOM 28068 C15 OL 717 112.321 143.021 52.348 1.00 0.00 C ATOM 28069 H5R OL 717 112.895 143.946 52.263 1.00 0.00 H ATOM 28070 H5S OL 717 112.986 142.213 52.036 1.00 0.00 H ATOM 28071 C16 OL 717 111.200 143.206 51.348 1.00 0.00 C ATOM 28072 H6R OL 717 110.613 142.288 51.267 1.00 0.00 H ATOM 28073 H6S OL 717 110.473 143.986 51.581 1.00 0.00 H ATOM 28074 C17 OL 717 111.789 143.332 49.936 1.00 0.00 C ATOM 28075 H7R OL 717 112.549 144.106 50.064 1.00 0.00 H ATOM 28076 H7S OL 717 112.467 142.487 49.801 1.00 0.00 H ATOM 28077 C18 OL 717 110.773 143.573 48.869 1.00 0.00 C ATOM 28078 H8R OL 717 110.192 142.679 48.633 1.00 0.00 H ATOM 28079 H8S OL 717 110.064 144.324 49.227 1.00 0.00 H ATOM 28080 C19 OL 717 111.342 144.279 47.669 1.00 0.00 C ATOM 28081 H9R OL 717 112.141 144.956 47.959 1.00 0.00 H ATOM 28082 C110 OL 717 110.986 144.144 46.388 1.00 0.00 C ATOM 28083 H10R OL 717 111.386 144.795 45.615 1.00 0.00 H ATOM 28084 C111 OL 717 109.915 143.266 45.865 1.00 0.00 C ATOM 28085 H11R OL 717 109.447 142.657 46.641 1.00 0.00 H ATOM 28086 H11S OL 717 109.076 143.898 45.565 1.00 0.00 H ATOM 28087 C112 OL 717 110.340 142.439 44.649 1.00 0.00 C ATOM 28088 H12R OL 717 110.518 143.051 43.762 1.00 0.00 H ATOM 28089 H12S OL 717 111.363 142.072 44.756 1.00 0.00 H ATOM 28090 C113 OL 717 109.387 141.383 44.321 1.00 0.00 C ATOM 28091 H13R OL 717 109.606 140.556 44.999 1.00 0.00 H ATOM 28092 H13S OL 717 108.352 141.664 44.523 1.00 0.00 H ATOM 28093 C114 OL 717 109.557 140.736 42.953 1.00 0.00 C ATOM 28094 H14R OL 717 109.261 141.360 42.107 1.00 0.00 H ATOM 28095 H14S OL 717 110.629 140.531 42.927 1.00 0.00 H ATOM 28096 C115 OL 717 108.842 139.439 42.758 1.00 0.00 C ATOM 28097 H15R OL 717 109.221 138.745 43.511 1.00 0.00 H ATOM 28098 H15S OL 717 107.761 139.484 42.912 1.00 0.00 H ATOM 28099 C116 OL 717 109.018 138.873 41.281 1.00 0.00 C ATOM 28100 H16R OL 717 108.544 139.543 40.560 1.00 0.00 H ATOM 28101 H16S OL 717 110.060 138.887 40.954 1.00 0.00 H ATOM 28102 C117 OL 717 108.374 137.496 41.106 1.00 0.00 C ATOM 28103 H17R OL 717 108.896 136.727 41.680 1.00 0.00 H ATOM 28104 H17S OL 717 107.341 137.549 41.454 1.00 0.00 H ATOM 28105 C118 OL 717 108.401 137.048 39.687 1.00 0.00 C ATOM 28106 H18R OL 717 107.768 137.686 39.065 1.00 0.00 H ATOM 28107 H18S OL 717 108.070 136.025 39.496 1.00 0.00 H ATOM 28108 H18T OL 717 109.386 137.039 39.215 1.00 0.00 H TER 28109 OL 717 ATOM 28109 C116 PA 718 49.448 120.830 44.662 1.00 0.00 C ATOM 28110 H16R PA 718 49.869 119.909 45.072 1.00 0.00 H ATOM 28111 H16S PA 718 48.894 120.741 43.725 1.00 0.00 H ATOM 28112 H16T PA 718 48.682 121.088 45.396 1.00 0.00 H ATOM 28113 C115 PA 718 50.580 121.866 44.680 1.00 0.00 C ATOM 28114 H15R PA 718 50.813 121.970 45.742 1.00 0.00 H ATOM 28115 H15S PA 718 50.199 122.840 44.368 1.00 0.00 H ATOM 28116 C114 PA 718 51.780 121.374 43.819 1.00 0.00 C ATOM 28117 H14R PA 718 51.446 121.026 42.839 1.00 0.00 H ATOM 28118 H14S PA 718 52.289 120.538 44.302 1.00 0.00 H ATOM 28119 C113 PA 718 52.807 122.564 43.842 1.00 0.00 C ATOM 28120 H13R PA 718 52.847 122.777 44.912 1.00 0.00 H ATOM 28121 H13S PA 718 52.361 123.405 43.307 1.00 0.00 H ATOM 28122 C112 PA 718 54.173 122.237 43.406 1.00 0.00 C ATOM 28123 H12R PA 718 54.554 121.574 44.186 1.00 0.00 H ATOM 28124 H12S PA 718 54.819 123.112 43.299 1.00 0.00 H ATOM 28125 C111 PA 718 54.191 121.451 42.060 1.00 0.00 C ATOM 28126 H11R PA 718 53.481 121.999 41.438 1.00 0.00 H ATOM 28127 H11S PA 718 53.634 120.522 42.197 1.00 0.00 H ATOM 28128 C110 PA 718 55.547 121.290 41.509 1.00 0.00 C ATOM 28129 H10R PA 718 55.822 122.247 41.060 1.00 0.00 H ATOM 28130 H10S PA 718 55.433 120.485 40.780 1.00 0.00 H ATOM 28131 C19 PA 718 56.718 120.790 42.364 1.00 0.00 C ATOM 28132 H9R PA 718 57.104 121.609 42.975 1.00 0.00 H ATOM 28133 H9S PA 718 57.511 120.641 41.628 1.00 0.00 H ATOM 28134 C18 PA 718 56.424 119.524 43.170 1.00 0.00 C ATOM 28135 H8R PA 718 56.289 118.606 42.595 1.00 0.00 H ATOM 28136 H8S PA 718 55.522 119.745 43.744 1.00 0.00 H ATOM 28137 C17 PA 718 57.600 119.319 44.204 1.00 0.00 C ATOM 28138 H7R PA 718 58.016 120.289 44.484 1.00 0.00 H ATOM 28139 H7S PA 718 58.458 118.965 43.629 1.00 0.00 H ATOM 28140 C16 PA 718 57.266 118.347 45.312 1.00 0.00 C ATOM 28141 H6R PA 718 56.883 117.475 44.778 1.00 0.00 H ATOM 28142 H6S PA 718 56.338 118.685 45.778 1.00 0.00 H ATOM 28143 C15 PA 718 58.326 117.942 46.267 1.00 0.00 C ATOM 28144 H5R PA 718 59.006 117.452 45.567 1.00 0.00 H ATOM 28145 H5S PA 718 57.979 117.117 46.893 1.00 0.00 H ATOM 28146 C14 PA 718 59.049 119.128 46.913 1.00 0.00 C ATOM 28147 H4R PA 718 58.326 119.530 47.626 1.00 0.00 H ATOM 28148 H4S PA 718 59.188 119.972 46.233 1.00 0.00 H ATOM 28149 C13 PA 718 60.428 118.887 47.563 1.00 0.00 C ATOM 28150 H3R PA 718 61.139 119.642 47.222 1.00 0.00 H ATOM 28151 H3S PA 718 60.862 117.897 47.408 1.00 0.00 H ATOM 28152 C12 PA 718 60.510 119.034 49.061 1.00 0.00 C ATOM 28153 H2R PA 718 59.711 118.361 49.379 1.00 0.00 H ATOM 28154 H2S PA 718 60.232 120.047 49.357 1.00 0.00 H ATOM 28155 C11 PGR 719 61.788 118.651 49.765 1.00 0.00 C ATOM 28156 O12 PGR 719 62.160 117.491 49.807 1.00 0.00 O ATOM 28157 O11 PGR 719 62.340 119.573 50.516 1.00 0.00 O ATOM 28158 C1 PGR 719 63.281 119.263 51.521 1.00 0.00 C ATOM 28159 HR PGR 719 64.242 118.892 51.154 1.00 0.00 H ATOM 28160 HS PGR 719 62.776 118.607 52.234 1.00 0.00 H ATOM 28161 C2 PGR 719 63.502 120.565 52.389 1.00 0.00 C ATOM 28162 HX PGR 719 64.066 120.332 53.296 1.00 0.00 H ATOM 28163 C3 PGR 719 62.078 121.070 52.730 1.00 0.00 C ATOM 28164 HA PGR 719 61.430 120.193 52.786 1.00 0.00 H ATOM 28165 HB PGR 719 61.707 121.686 51.907 1.00 0.00 H ATOM 28166 O31 PGR 719 62.010 121.764 53.978 1.00 0.00 O ATOM 28167 P31 PGR 719 62.185 120.966 55.347 1.00 0.00 P ATOM 28168 O32 PGR 719 63.764 120.859 55.639 1.00 0.00 O ATOM 28169 C31 PGR 719 64.461 122.017 55.678 1.00 0.00 C ATOM 28170 H1A PGR 719 64.027 122.664 56.444 1.00 0.00 H ATOM 28171 H1B PGR 719 64.289 122.483 54.705 1.00 0.00 H ATOM 28172 C32 PGR 719 66.003 121.752 55.948 1.00 0.00 C ATOM 28173 H2A PGR 719 66.286 120.817 55.457 1.00 0.00 H ATOM 28174 O35 PGR 719 66.254 121.704 57.374 1.00 0.00 O ATOM 28175 HO5A PGR 719 67.151 121.326 57.386 1.00 0.00 H ATOM 28176 C33 PGR 719 66.723 122.948 55.276 1.00 0.00 C ATOM 28177 H3A PGR 719 67.812 122.863 55.297 1.00 0.00 H ATOM 28178 H3B PGR 719 66.441 123.110 54.233 1.00 0.00 H ATOM 28179 O33 PGR 719 61.652 121.811 56.430 1.00 0.00 O ATOM 28180 O34 PGR 719 61.561 119.602 55.167 1.00 0.00 O ATOM 28181 O21 PGR 719 64.105 121.686 51.694 1.00 0.00 O ATOM 28182 C21 PGR 719 65.449 121.711 51.506 1.00 0.00 C ATOM 28183 O22 PGR 719 66.122 120.897 52.065 1.00 0.00 O ATOM 28184 O36 PGR 719 66.168 124.126 55.864 1.00 0.00 O ATOM 28185 HO6A PGR 719 65.227 124.228 55.633 1.00 0.00 H ATOM 28186 C12 OL 720 65.980 122.783 50.515 1.00 0.00 C ATOM 28187 H2R OL 720 65.233 123.570 50.390 1.00 0.00 H ATOM 28188 H2S OL 720 66.780 123.262 51.082 1.00 0.00 H ATOM 28189 C13 OL 720 66.265 122.268 49.102 1.00 0.00 C ATOM 28190 H3R OL 720 66.947 121.419 49.177 1.00 0.00 H ATOM 28191 H3S OL 720 65.341 121.939 48.621 1.00 0.00 H ATOM 28192 C14 OL 720 66.727 123.414 48.088 1.00 0.00 C ATOM 28193 H4R OL 720 66.997 122.938 47.143 1.00 0.00 H ATOM 28194 H4S OL 720 65.861 124.048 47.886 1.00 0.00 H ATOM 28195 C15 OL 720 67.895 124.295 48.503 1.00 0.00 C ATOM 28196 H5R OL 720 67.698 124.543 49.548 1.00 0.00 H ATOM 28197 H5S OL 720 68.829 123.737 48.407 1.00 0.00 H ATOM 28198 C16 OL 720 67.914 125.629 47.695 1.00 0.00 C ATOM 28199 H6R OL 720 68.926 126.022 47.806 1.00 0.00 H ATOM 28200 H6S OL 720 67.949 125.410 46.625 1.00 0.00 H ATOM 28201 C17 OL 720 66.852 126.736 47.952 1.00 0.00 C ATOM 28202 H7R OL 720 65.888 126.341 47.623 1.00 0.00 H ATOM 28203 H7S OL 720 66.740 126.888 49.027 1.00 0.00 H ATOM 28204 C18 OL 720 67.389 128.039 47.485 1.00 0.00 C ATOM 28205 H8R OL 720 66.691 128.781 47.879 1.00 0.00 H ATOM 28206 H8S OL 720 68.399 128.312 47.798 1.00 0.00 H ATOM 28207 C19 OL 720 67.253 128.146 45.966 1.00 0.00 C ATOM 28208 H9R OL 720 67.512 127.326 45.300 1.00 0.00 H ATOM 28209 C110 OL 720 66.924 129.244 45.304 1.00 0.00 C ATOM 28210 H10R OL 720 66.802 129.154 44.228 1.00 0.00 H ATOM 28211 C111 OL 720 66.590 130.586 45.877 1.00 0.00 C ATOM 28212 H11R OL 720 66.832 130.628 46.941 1.00 0.00 H ATOM 28213 H11S OL 720 67.124 131.459 45.497 1.00 0.00 H ATOM 28214 C112 OL 720 65.064 130.978 45.868 1.00 0.00 C ATOM 28215 H12R OL 720 64.450 130.100 46.080 1.00 0.00 H ATOM 28216 H12S OL 720 64.882 131.776 46.590 1.00 0.00 H ATOM 28217 C113 OL 720 64.670 131.653 44.575 1.00 0.00 C ATOM 28218 H13R OL 720 65.179 132.618 44.524 1.00 0.00 H ATOM 28219 H13S OL 720 65.109 131.115 43.732 1.00 0.00 H ATOM 28220 C114 OL 720 63.185 131.997 44.357 1.00 0.00 C ATOM 28221 H14R OL 720 62.599 131.076 44.329 1.00 0.00 H ATOM 28222 H14S OL 720 62.817 132.488 45.260 1.00 0.00 H ATOM 28223 C115 OL 720 62.846 132.993 43.288 1.00 0.00 C ATOM 28224 H15R OL 720 61.859 133.453 43.374 1.00 0.00 H ATOM 28225 H15S OL 720 63.458 133.877 43.479 1.00 0.00 H ATOM 28226 C116 OL 720 63.177 132.484 41.786 1.00 0.00 C ATOM 28227 H16R OL 720 64.183 132.063 41.724 1.00 0.00 H ATOM 28228 H16S OL 720 62.475 131.699 41.498 1.00 0.00 H ATOM 28229 C117 OL 720 63.054 133.443 40.689 1.00 0.00 C ATOM 28230 H17R OL 720 61.977 133.521 40.528 1.00 0.00 H ATOM 28231 H17S OL 720 63.388 134.458 40.913 1.00 0.00 H ATOM 28232 C118 OL 720 63.991 133.118 39.507 1.00 0.00 C ATOM 28233 H18R OL 720 63.829 132.091 39.170 1.00 0.00 H ATOM 28234 H18S OL 720 65.018 133.224 39.861 1.00 0.00 H ATOM 28235 H18T OL 720 63.925 133.836 38.687 1.00 0.00 H TER 28236 OL 720 ATOM 28236 C116 PA 721 132.475 126.487 41.355 1.00 0.00 C ATOM 28237 H16R PA 721 132.984 125.714 40.775 1.00 0.00 H ATOM 28238 H16S PA 721 133.118 127.353 41.523 1.00 0.00 H ATOM 28239 H16T PA 721 131.679 126.855 40.704 1.00 0.00 H ATOM 28240 C115 PA 721 131.890 126.097 42.747 1.00 0.00 C ATOM 28241 H15R PA 721 130.922 125.635 42.542 1.00 0.00 H ATOM 28242 H15S PA 721 131.597 127.010 43.269 1.00 0.00 H ATOM 28243 C114 PA 721 132.817 125.379 43.725 1.00 0.00 C ATOM 28244 H14R PA 721 133.380 124.605 43.198 1.00 0.00 H ATOM 28245 H14S PA 721 132.155 124.880 44.436 1.00 0.00 H ATOM 28246 C113 PA 721 133.809 126.365 44.369 1.00 0.00 C ATOM 28247 H13R PA 721 133.321 127.151 44.950 1.00 0.00 H ATOM 28248 H13S PA 721 134.281 126.980 43.600 1.00 0.00 H ATOM 28249 C112 PA 721 134.783 125.627 45.362 1.00 0.00 C ATOM 28250 H12R PA 721 135.115 124.690 44.910 1.00 0.00 H ATOM 28251 H12S PA 721 134.172 125.413 46.241 1.00 0.00 H ATOM 28252 C111 PA 721 136.057 126.394 45.810 1.00 0.00 C ATOM 28253 H11R PA 721 135.670 127.296 46.290 1.00 0.00 H ATOM 28254 H11S PA 721 136.646 126.755 44.964 1.00 0.00 H ATOM 28255 C110 PA 721 136.899 125.592 46.753 1.00 0.00 C ATOM 28256 H10R PA 721 137.951 125.867 46.651 1.00 0.00 H ATOM 28257 H10S PA 721 136.763 124.533 46.525 1.00 0.00 H ATOM 28258 C19 PA 721 136.338 125.737 48.116 1.00 0.00 C ATOM 28259 H9R PA 721 135.282 125.493 48.252 1.00 0.00 H ATOM 28260 H9S PA 721 136.202 126.779 48.414 1.00 0.00 H ATOM 28261 C18 PA 721 137.166 125.001 49.172 1.00 0.00 C ATOM 28262 H8R PA 721 138.120 125.510 49.327 1.00 0.00 H ATOM 28263 H8S PA 721 137.374 123.974 48.866 1.00 0.00 H ATOM 28264 C17 PA 721 136.571 124.773 50.514 1.00 0.00 C ATOM 28265 H7R PA 721 137.207 124.078 51.066 1.00 0.00 H ATOM 28266 H7S PA 721 135.590 124.302 50.423 1.00 0.00 H ATOM 28267 C16 PA 721 136.455 125.936 51.526 1.00 0.00 C ATOM 28268 H6R PA 721 136.123 126.882 51.093 1.00 0.00 H ATOM 28269 H6S PA 721 137.486 126.142 51.820 1.00 0.00 H ATOM 28270 C15 PA 721 135.689 125.681 52.861 1.00 0.00 C ATOM 28271 H5R PA 721 134.606 125.611 52.737 1.00 0.00 H ATOM 28272 H5S PA 721 135.737 126.615 53.425 1.00 0.00 H ATOM 28273 C14 PA 721 136.207 124.424 53.602 1.00 0.00 C ATOM 28274 H4R PA 721 137.181 124.615 54.058 1.00 0.00 H ATOM 28275 H4S PA 721 136.410 123.578 52.942 1.00 0.00 H ATOM 28276 C13 PA 721 135.219 124.058 54.757 1.00 0.00 C ATOM 28277 H3R PA 721 135.069 124.901 55.435 1.00 0.00 H ATOM 28278 H3S PA 721 135.824 123.330 55.302 1.00 0.00 H ATOM 28279 C12 PA 721 133.855 123.352 54.442 1.00 0.00 C ATOM 28280 H2R PA 721 134.048 122.339 54.084 1.00 0.00 H ATOM 28281 H2S PA 721 133.472 123.885 53.569 1.00 0.00 H ATOM 28282 C11 PC 722 132.934 123.205 55.615 1.00 0.00 C ATOM 28283 O12 PC 722 131.806 123.615 55.573 1.00 0.00 O ATOM 28284 O11 PC 722 133.396 122.461 56.659 1.00 0.00 O ATOM 28285 C1 PC 722 132.459 122.003 57.725 1.00 0.00 C ATOM 28286 HR PC 722 131.715 122.781 57.914 1.00 0.00 H ATOM 28287 HS PC 722 133.003 121.854 58.661 1.00 0.00 H ATOM 28288 C2 PC 722 131.918 120.693 57.151 1.00 0.00 C ATOM 28289 HX PC 722 131.450 120.973 56.204 1.00 0.00 H ATOM 28290 C3 PC 722 130.872 120.223 58.106 1.00 0.00 C ATOM 28291 HA PC 722 130.467 119.232 57.887 1.00 0.00 H ATOM 28292 HB PC 722 130.010 120.894 58.073 1.00 0.00 H ATOM 28293 O31 PC 722 131.356 120.279 59.449 1.00 0.00 O ATOM 28294 P31 PC 722 130.588 119.526 60.629 1.00 0.00 P ATOM 28295 O32 PC 722 130.969 118.064 60.324 1.00 0.00 O ATOM 28296 C31 PC 722 132.297 117.637 60.540 1.00 0.00 C ATOM 28297 H1A PC 722 133.014 118.436 60.333 1.00 0.00 H ATOM 28298 H1B PC 722 132.519 116.745 59.949 1.00 0.00 H ATOM 28299 C32 PC 722 132.156 117.326 62.037 1.00 0.00 C ATOM 28300 H2A PC 722 131.530 116.460 62.256 1.00 0.00 H ATOM 28301 H2B PC 722 131.753 118.210 62.534 1.00 0.00 H ATOM 28302 N31 PC 722 133.366 117.043 62.862 1.00 0.00 N ATOM 28303 C33 PC 722 134.283 116.090 62.240 1.00 0.00 C ATOM 28304 H3A PC 722 134.636 116.452 61.273 1.00 0.00 H ATOM 28305 H3B PC 722 133.738 115.156 62.100 1.00 0.00 H ATOM 28306 H3C PC 722 135.170 115.890 62.842 1.00 0.00 H ATOM 28307 C34 PC 722 134.121 118.306 63.064 1.00 0.00 C ATOM 28308 H4A PC 722 134.975 117.955 63.645 1.00 0.00 H ATOM 28309 H4B PC 722 133.470 119.047 63.531 1.00 0.00 H ATOM 28310 H4C PC 722 134.380 118.721 62.089 1.00 0.00 H ATOM 28311 C35 PC 722 133.000 116.564 64.203 1.00 0.00 C ATOM 28312 H5A PC 722 133.882 116.555 64.845 1.00 0.00 H ATOM 28313 H5B PC 722 132.611 115.546 64.152 1.00 0.00 H ATOM 28314 H5C PC 722 132.180 117.180 64.575 1.00 0.00 H ATOM 28315 O33 PC 722 131.077 119.939 61.969 1.00 0.00 O ATOM 28316 O34 PC 722 129.150 119.677 60.407 1.00 0.00 O ATOM 28317 O21 PC 722 132.971 119.739 57.119 1.00 0.00 O ATOM 28318 C21 PC 722 132.888 118.442 56.564 1.00 0.00 C ATOM 28319 O22 PC 722 131.901 118.019 56.036 1.00 0.00 O ATOM 28320 C12 OL 723 134.268 117.697 56.447 1.00 0.00 C ATOM 28321 H2R OL 723 134.688 118.054 55.505 1.00 0.00 H ATOM 28322 H2S OL 723 134.937 118.091 57.215 1.00 0.00 H ATOM 28323 C13 OL 723 133.986 116.139 56.520 1.00 0.00 C ATOM 28324 H3R OL 723 134.921 115.710 56.886 1.00 0.00 H ATOM 28325 H3S OL 723 133.184 115.904 57.224 1.00 0.00 H ATOM 28326 C14 OL 723 133.574 115.547 55.204 1.00 0.00 C ATOM 28327 H4R OL 723 132.604 116.036 55.092 1.00 0.00 H ATOM 28328 H4S OL 723 134.162 116.035 54.423 1.00 0.00 H ATOM 28329 C15 OL 723 133.514 114.021 55.285 1.00 0.00 C ATOM 28330 H5R OL 723 134.501 113.584 55.451 1.00 0.00 H ATOM 28331 H5S OL 723 132.883 113.760 56.138 1.00 0.00 H ATOM 28332 C16 OL 723 132.895 113.214 54.078 1.00 0.00 C ATOM 28333 H6R OL 723 132.023 113.826 53.838 1.00 0.00 H ATOM 28334 H6S OL 723 133.623 113.216 53.264 1.00 0.00 H ATOM 28335 C17 OL 723 132.378 111.839 54.620 1.00 0.00 C ATOM 28336 H7R OL 723 133.185 111.290 55.109 1.00 0.00 H ATOM 28337 H7S OL 723 131.506 112.008 55.256 1.00 0.00 H ATOM 28338 C18 OL 723 131.792 110.826 53.554 1.00 0.00 C ATOM 28339 H8R OL 723 132.582 110.474 52.887 1.00 0.00 H ATOM 28340 H8S OL 723 131.381 109.920 54.004 1.00 0.00 H ATOM 28341 C19 OL 723 130.822 111.512 52.724 1.00 0.00 C ATOM 28342 H9R OL 723 129.970 111.928 53.255 1.00 0.00 H ATOM 28343 C110 OL 723 130.808 111.570 51.388 1.00 0.00 C ATOM 28344 H10R OL 723 129.957 112.013 50.877 1.00 0.00 H ATOM 28345 C111 OL 723 131.761 111.091 50.341 1.00 0.00 C ATOM 28346 H11R OL 723 132.288 110.243 50.783 1.00 0.00 H ATOM 28347 H11S OL 723 131.203 110.733 49.473 1.00 0.00 H ATOM 28348 C112 OL 723 132.884 112.120 49.964 1.00 0.00 C ATOM 28349 H12R OL 723 133.198 112.589 50.899 1.00 0.00 H ATOM 28350 H12S OL 723 133.612 111.526 49.408 1.00 0.00 H ATOM 28351 C113 OL 723 132.431 113.147 48.934 1.00 0.00 C ATOM 28352 H13R OL 723 132.302 112.500 48.064 1.00 0.00 H ATOM 28353 H13S OL 723 131.450 113.532 49.220 1.00 0.00 H ATOM 28354 C114 OL 723 133.454 114.266 48.748 1.00 0.00 C ATOM 28355 H14R OL 723 134.411 113.743 48.679 1.00 0.00 H ATOM 28356 H14S OL 723 133.251 114.608 47.731 1.00 0.00 H ATOM 28357 C115 OL 723 133.359 115.504 49.726 1.00 0.00 C ATOM 28358 H15R OL 723 132.353 115.928 49.759 1.00 0.00 H ATOM 28359 H15S OL 723 133.665 115.222 50.735 1.00 0.00 H ATOM 28360 C116 OL 723 134.350 116.671 49.408 1.00 0.00 C ATOM 28361 H16R OL 723 134.147 117.303 48.540 1.00 0.00 H ATOM 28362 H16S OL 723 134.224 117.427 50.186 1.00 0.00 H ATOM 28363 C117 OL 723 135.831 116.223 49.243 1.00 0.00 C ATOM 28364 H17R OL 723 136.388 116.343 50.175 1.00 0.00 H ATOM 28365 H17S OL 723 136.044 115.168 49.056 1.00 0.00 H ATOM 28366 C118 OL 723 136.642 116.930 48.254 1.00 0.00 C ATOM 28367 H18R OL 723 136.629 117.955 48.632 1.00 0.00 H ATOM 28368 H18S OL 723 136.259 116.910 47.231 1.00 0.00 H ATOM 28369 H18T OL 723 137.698 116.654 48.290 1.00 0.00 H TER 28370 OL 723 ATOM 28370 C116 PA 724 109.691 131.273 39.951 1.00 0.00 C ATOM 28371 H16R PA 724 109.099 130.379 40.156 1.00 0.00 H ATOM 28372 H16S PA 724 110.668 130.968 40.332 1.00 0.00 H ATOM 28373 H16T PA 724 109.738 131.232 38.861 1.00 0.00 H ATOM 28374 C115 PA 724 109.063 132.453 40.629 1.00 0.00 C ATOM 28375 H15R PA 724 108.064 132.568 40.201 1.00 0.00 H ATOM 28376 H15S PA 724 109.634 133.355 40.400 1.00 0.00 H ATOM 28377 C114 PA 724 108.963 132.240 42.145 1.00 0.00 C ATOM 28378 H14R PA 724 109.941 132.256 42.631 1.00 0.00 H ATOM 28379 H14S PA 724 108.487 131.275 42.333 1.00 0.00 H ATOM 28380 C113 PA 724 108.193 133.261 42.968 1.00 0.00 C ATOM 28381 H13R PA 724 107.130 133.346 42.732 1.00 0.00 H ATOM 28382 H13S PA 724 108.617 134.249 42.781 1.00 0.00 H ATOM 28383 C112 PA 724 108.115 133.002 44.529 1.00 0.00 C ATOM 28384 H12R PA 724 109.159 132.752 44.729 1.00 0.00 H ATOM 28385 H12S PA 724 107.445 132.157 44.702 1.00 0.00 H ATOM 28386 C111 PA 724 107.524 134.225 45.239 1.00 0.00 C ATOM 28387 H11R PA 724 106.690 134.495 44.588 1.00 0.00 H ATOM 28388 H11S PA 724 108.248 135.043 45.224 1.00 0.00 H ATOM 28389 C110 PA 724 107.171 133.941 46.675 1.00 0.00 C ATOM 28390 H10R PA 724 106.290 133.302 46.758 1.00 0.00 H ATOM 28391 H10S PA 724 106.874 134.898 47.108 1.00 0.00 H ATOM 28392 C19 PA 724 108.355 133.620 47.609 1.00 0.00 C ATOM 28393 H9R PA 724 109.017 134.473 47.767 1.00 0.00 H ATOM 28394 H9S PA 724 108.883 132.788 47.137 1.00 0.00 H ATOM 28395 C18 PA 724 107.826 133.114 48.923 1.00 0.00 C ATOM 28396 H8R PA 724 107.120 132.296 48.763 1.00 0.00 H ATOM 28397 H8S PA 724 107.199 133.887 49.373 1.00 0.00 H ATOM 28398 C17 PA 724 108.920 132.608 49.805 1.00 0.00 C ATOM 28399 H7R PA 724 109.818 133.220 49.910 1.00 0.00 H ATOM 28400 H7S PA 724 109.408 131.692 49.467 1.00 0.00 H ATOM 28401 C16 PA 724 108.415 132.283 51.253 1.00 0.00 C ATOM 28402 H6R PA 724 107.531 131.655 51.125 1.00 0.00 H ATOM 28403 H6S PA 724 108.124 133.253 51.661 1.00 0.00 H ATOM 28404 C15 PA 724 109.444 131.673 52.197 1.00 0.00 C ATOM 28405 H5R PA 724 110.096 132.485 52.526 1.00 0.00 H ATOM 28406 H5S PA 724 110.051 131.005 51.582 1.00 0.00 H ATOM 28407 C14 PA 724 108.965 130.834 53.433 1.00 0.00 C ATOM 28408 H4R PA 724 109.002 129.759 53.245 1.00 0.00 H ATOM 28409 H4S PA 724 107.918 131.091 53.602 1.00 0.00 H ATOM 28410 C13 PA 724 109.842 130.875 54.676 1.00 0.00 C ATOM 28411 H3R PA 724 109.676 131.845 55.148 1.00 0.00 H ATOM 28412 H3S PA 724 110.904 130.898 54.419 1.00 0.00 H ATOM 28413 C12 PA 724 109.662 129.715 55.728 1.00 0.00 C ATOM 28414 H2R PA 724 110.598 129.657 56.287 1.00 0.00 H ATOM 28415 H2S PA 724 109.632 128.713 55.293 1.00 0.00 H ATOM 28416 C11 PGR 725 108.474 129.812 56.535 1.00 0.00 C ATOM 28417 O12 PGR 725 108.367 129.079 57.485 1.00 0.00 O ATOM 28418 O11 PGR 725 107.556 130.777 56.283 1.00 0.00 O ATOM 28419 C1 PGR 725 106.435 131.011 57.097 1.00 0.00 C ATOM 28420 HR PGR 725 106.716 131.539 58.012 1.00 0.00 H ATOM 28421 HS PGR 725 106.016 130.026 57.316 1.00 0.00 H ATOM 28422 C2 PGR 725 105.414 131.956 56.355 1.00 0.00 C ATOM 28423 HX PGR 725 105.977 132.617 55.692 1.00 0.00 H ATOM 28424 C3 PGR 725 104.888 132.848 57.500 1.00 0.00 C ATOM 28425 HA PGR 725 104.077 133.453 57.086 1.00 0.00 H ATOM 28426 HB PGR 725 105.681 133.514 57.851 1.00 0.00 H ATOM 28427 O31 PGR 725 104.250 132.114 58.559 1.00 0.00 O ATOM 28428 P31 PGR 725 103.845 132.765 59.968 1.00 0.00 P ATOM 28429 O32 PGR 725 102.849 133.962 59.618 1.00 0.00 O ATOM 28430 C31 PGR 725 101.574 134.014 60.215 1.00 0.00 C ATOM 28431 H1A PGR 725 101.739 133.694 61.247 1.00 0.00 H ATOM 28432 H1B PGR 725 100.975 133.253 59.708 1.00 0.00 H ATOM 28433 C32 PGR 725 101.036 135.452 60.084 1.00 0.00 C ATOM 28434 H2A PGR 725 100.920 135.603 59.007 1.00 0.00 H ATOM 28435 O35 PGR 725 101.963 136.416 60.716 1.00 0.00 O ATOM 28436 HO5A PGR 725 102.893 136.226 60.496 1.00 0.00 H ATOM 28437 C33 PGR 725 99.691 135.737 60.806 1.00 0.00 C ATOM 28438 H3A PGR 725 98.905 135.121 60.362 1.00 0.00 H ATOM 28439 H3B PGR 725 99.735 135.495 61.871 1.00 0.00 H ATOM 28440 O33 PGR 725 103.128 131.798 60.793 1.00 0.00 O ATOM 28441 O34 PGR 725 105.076 133.460 60.494 1.00 0.00 O ATOM 28442 O21 PGR 725 104.419 131.144 55.586 1.00 0.00 O ATOM 28443 C21 PGR 725 103.864 131.628 54.481 1.00 0.00 C ATOM 28444 O22 PGR 725 104.105 132.735 54.168 1.00 0.00 O ATOM 28445 O36 PGR 725 99.320 137.111 60.560 1.00 0.00 O ATOM 28446 HO6A PGR 725 99.098 137.193 59.615 1.00 0.00 H TER 28447 PGR 725 ATOM 28447 C12 OL 726 98.759 44.309 38.224 1.00 0.00 C ATOM 28448 H2R OL 726 99.098 43.873 39.166 1.00 0.00 H ATOM 28449 H2S OL 726 99.542 45.067 38.159 1.00 0.00 H ATOM 28450 C13 OL 726 97.351 44.898 38.469 1.00 0.00 C ATOM 28451 H3R OL 726 96.649 44.172 38.883 1.00 0.00 H ATOM 28452 H3S OL 726 97.490 45.643 39.256 1.00 0.00 H ATOM 28453 C14 OL 726 96.743 45.537 37.185 1.00 0.00 C ATOM 28454 H4R OL 726 97.476 46.172 36.683 1.00 0.00 H ATOM 28455 H4S OL 726 96.430 44.785 36.457 1.00 0.00 H ATOM 28456 C15 OL 726 95.593 46.527 37.428 1.00 0.00 C ATOM 28457 H5R OL 726 95.921 47.530 37.709 1.00 0.00 H ATOM 28458 H5S OL 726 95.190 46.630 36.418 1.00 0.00 H ATOM 28459 C16 OL 726 94.561 46.031 38.420 1.00 0.00 C ATOM 28460 H6R OL 726 93.811 45.384 37.961 1.00 0.00 H ATOM 28461 H6S OL 726 94.972 45.384 39.198 1.00 0.00 H ATOM 28462 C17 OL 726 93.806 47.173 39.169 1.00 0.00 C ATOM 28463 H7R OL 726 93.071 46.776 39.873 1.00 0.00 H ATOM 28464 H7S OL 726 94.579 47.694 39.738 1.00 0.00 H ATOM 28465 C18 OL 726 93.103 48.132 38.121 1.00 0.00 C ATOM 28466 H8R OL 726 93.867 48.437 37.403 1.00 0.00 H ATOM 28467 H8S OL 726 92.326 47.550 37.622 1.00 0.00 H ATOM 28468 C19 OL 726 92.569 49.370 38.773 1.00 0.00 C ATOM 28469 H9R OL 726 93.364 50.022 39.125 1.00 0.00 H ATOM 28470 C110 OL 726 91.314 49.669 39.020 1.00 0.00 C ATOM 28471 H10R OL 726 91.009 50.616 39.457 1.00 0.00 H ATOM 28472 C111 OL 726 90.063 48.926 38.670 1.00 0.00 C ATOM 28473 H11R OL 726 89.406 49.661 38.201 1.00 0.00 H ATOM 28474 H11S OL 726 90.407 48.224 37.907 1.00 0.00 H ATOM 28475 C112 OL 726 89.251 48.234 39.784 1.00 0.00 C ATOM 28476 H12R OL 726 88.461 47.545 39.477 1.00 0.00 H ATOM 28477 H12S OL 726 89.909 47.616 40.398 1.00 0.00 H ATOM 28478 C113 OL 726 88.685 49.180 40.856 1.00 0.00 C ATOM 28479 H13R OL 726 88.394 48.554 41.702 1.00 0.00 H ATOM 28480 H13S OL 726 89.372 49.957 41.198 1.00 0.00 H ATOM 28481 C114 OL 726 87.339 49.800 40.429 1.00 0.00 C ATOM 28482 H14R OL 726 87.101 50.724 40.961 1.00 0.00 H ATOM 28483 H14S OL 726 87.566 50.119 39.409 1.00 0.00 H ATOM 28484 C115 OL 726 86.116 48.796 40.556 1.00 0.00 C ATOM 28485 H15R OL 726 86.481 47.824 40.219 1.00 0.00 H ATOM 28486 H15S OL 726 85.775 48.747 41.593 1.00 0.00 H ATOM 28487 C116 OL 726 84.951 49.161 39.710 1.00 0.00 C ATOM 28488 H16R OL 726 84.039 48.606 39.936 1.00 0.00 H ATOM 28489 H16S OL 726 84.813 50.195 40.032 1.00 0.00 H ATOM 28490 C117 OL 726 85.222 49.369 38.200 1.00 0.00 C ATOM 28491 H17R OL 726 85.491 50.422 38.091 1.00 0.00 H ATOM 28492 H17S OL 726 85.993 48.667 37.876 1.00 0.00 H ATOM 28493 C118 OL 726 84.042 49.128 37.341 1.00 0.00 C ATOM 28494 H18R OL 726 83.943 48.055 37.514 1.00 0.00 H ATOM 28495 H18S OL 726 84.172 49.305 36.271 1.00 0.00 H ATOM 28496 H18T OL 726 83.129 49.648 37.637 1.00 0.00 H TER 28497 OL 726 ATOM 28497 C116 PA 727 145.292 38.742 44.517 1.00 0.00 C ATOM 28498 H16R PA 727 146.321 38.912 44.194 1.00 0.00 H ATOM 28499 H16S PA 727 144.970 37.714 44.334 1.00 0.00 H ATOM 28500 H16T PA 727 145.423 38.897 45.590 1.00 0.00 H ATOM 28501 C115 PA 727 144.257 39.743 44.069 1.00 0.00 C ATOM 28502 H15R PA 727 144.352 39.907 42.994 1.00 0.00 H ATOM 28503 H15S PA 727 144.683 40.727 44.279 1.00 0.00 H ATOM 28504 C114 PA 727 142.809 39.573 44.604 1.00 0.00 C ATOM 28505 H14R PA 727 142.265 38.775 44.095 1.00 0.00 H ATOM 28506 H14S PA 727 142.294 40.518 44.421 1.00 0.00 H ATOM 28507 C113 PA 727 142.778 39.431 46.101 1.00 0.00 C ATOM 28508 H13R PA 727 143.444 38.602 46.348 1.00 0.00 H ATOM 28509 H13S PA 727 141.773 39.206 46.465 1.00 0.00 H ATOM 28510 C112 PA 727 143.262 40.686 46.852 1.00 0.00 C ATOM 28511 H12R PA 727 142.483 41.412 46.612 1.00 0.00 H ATOM 28512 H12S PA 727 144.246 40.962 46.466 1.00 0.00 H ATOM 28513 C111 PA 727 143.398 40.618 48.399 1.00 0.00 C ATOM 28514 H11R PA 727 144.139 39.871 48.690 1.00 0.00 H ATOM 28515 H11S PA 727 142.446 40.246 48.785 1.00 0.00 H ATOM 28516 C110 PA 727 143.818 41.908 49.004 1.00 0.00 C ATOM 28517 H10R PA 727 143.218 42.711 48.573 1.00 0.00 H ATOM 28518 H10S PA 727 144.849 42.178 48.766 1.00 0.00 H ATOM 28519 C19 PA 727 143.746 41.736 50.535 1.00 0.00 C ATOM 28520 H9R PA 727 144.433 42.453 50.991 1.00 0.00 H ATOM 28521 H9S PA 727 144.222 40.847 50.953 1.00 0.00 H ATOM 28522 C18 PA 727 142.430 41.578 51.368 1.00 0.00 C ATOM 28523 H8R PA 727 142.727 41.292 52.379 1.00 0.00 H ATOM 28524 H8S PA 727 141.916 40.750 50.876 1.00 0.00 H ATOM 28525 C17 PA 727 141.416 42.768 51.380 1.00 0.00 C ATOM 28526 H7R PA 727 140.526 42.554 51.975 1.00 0.00 H ATOM 28527 H7S PA 727 141.172 42.794 50.316 1.00 0.00 H ATOM 28528 C16 PA 727 141.872 44.195 51.545 1.00 0.00 C ATOM 28529 H6R PA 727 141.000 44.821 51.343 1.00 0.00 H ATOM 28530 H6S PA 727 142.649 44.438 50.818 1.00 0.00 H ATOM 28531 C15 PA 727 142.583 44.531 52.878 1.00 0.00 C ATOM 28532 H5R PA 727 142.866 45.584 52.931 1.00 0.00 H ATOM 28533 H5S PA 727 143.543 44.012 52.852 1.00 0.00 H ATOM 28534 C14 PA 727 141.880 43.956 54.032 1.00 0.00 C ATOM 28535 H4R PA 727 142.559 44.172 54.859 1.00 0.00 H ATOM 28536 H4S PA 727 141.832 42.868 54.113 1.00 0.00 H ATOM 28537 C13 PA 727 140.395 44.448 54.240 1.00 0.00 C ATOM 28538 H3R PA 727 139.847 43.894 55.005 1.00 0.00 H ATOM 28539 H3S PA 727 139.788 44.143 53.385 1.00 0.00 H ATOM 28540 C12 PA 727 140.393 45.969 54.427 1.00 0.00 C ATOM 28541 H2R PA 727 139.405 46.386 54.633 1.00 0.00 H ATOM 28542 H2S PA 727 140.669 46.402 53.464 1.00 0.00 H ATOM 28543 C11 PC 728 141.250 46.483 55.559 1.00 0.00 C ATOM 28544 O12 PC 728 142.218 47.197 55.391 1.00 0.00 O ATOM 28545 O11 PC 728 140.798 46.002 56.731 1.00 0.00 O ATOM 28546 C1 PC 728 141.548 46.297 57.941 1.00 0.00 C ATOM 28547 HR PC 728 140.765 46.048 58.663 1.00 0.00 H ATOM 28548 HS PC 728 141.848 47.346 57.881 1.00 0.00 H ATOM 28549 C2 PC 728 142.773 45.393 57.981 1.00 0.00 C ATOM 28550 HX PC 728 142.595 44.377 57.619 1.00 0.00 H ATOM 28551 C3 PC 728 143.287 45.233 59.449 1.00 0.00 C ATOM 28552 HA PC 728 144.253 44.723 59.503 1.00 0.00 H ATOM 28553 HB PC 728 142.543 44.631 59.976 1.00 0.00 H ATOM 28554 O31 PC 728 143.267 46.552 60.086 1.00 0.00 O ATOM 28555 P31 PC 728 143.017 46.695 61.617 1.00 0.00 P ATOM 28556 O32 PC 728 142.520 48.235 61.775 1.00 0.00 O ATOM 28557 C31 PC 728 141.480 48.703 61.050 1.00 0.00 C ATOM 28558 H1A PC 728 140.566 48.118 61.182 1.00 0.00 H ATOM 28559 H1B PC 728 141.777 48.616 60.002 1.00 0.00 H ATOM 28560 C32 PC 728 141.328 50.230 61.277 1.00 0.00 C ATOM 28561 H2A PC 728 140.718 50.718 60.515 1.00 0.00 H ATOM 28562 H2B PC 728 142.344 50.608 61.158 1.00 0.00 H ATOM 28563 N31 PC 728 140.797 50.839 62.598 1.00 0.00 N ATOM 28564 C33 PC 728 139.460 50.135 62.836 1.00 0.00 C ATOM 28565 H3A PC 728 138.910 50.650 63.625 1.00 0.00 H ATOM 28566 H3B PC 728 139.691 49.124 63.175 1.00 0.00 H ATOM 28567 H3C PC 728 138.767 50.324 62.014 1.00 0.00 H ATOM 28568 C34 PC 728 141.725 50.534 63.643 1.00 0.00 C ATOM 28569 H4A PC 728 141.350 51.148 64.463 1.00 0.00 H ATOM 28570 H4B PC 728 142.762 50.822 63.469 1.00 0.00 H ATOM 28571 H4C PC 728 141.786 49.474 63.893 1.00 0.00 H ATOM 28572 C35 PC 728 140.493 52.296 62.507 1.00 0.00 C ATOM 28573 H5A PC 728 140.076 52.525 61.525 1.00 0.00 H ATOM 28574 H5B PC 728 141.469 52.782 62.477 1.00 0.00 H ATOM 28575 H5C PC 728 139.836 52.684 63.286 1.00 0.00 H ATOM 28576 O33 PC 728 141.809 45.908 62.018 1.00 0.00 O ATOM 28577 O34 PC 728 144.227 46.483 62.412 1.00 0.00 O ATOM 28578 O21 PC 728 143.875 46.043 57.347 1.00 0.00 O ATOM 28579 C21 PC 728 144.983 45.424 56.947 1.00 0.00 C ATOM 28580 O22 PC 728 145.264 44.254 57.256 1.00 0.00 O ATOM 28581 C12 OL 729 145.769 46.379 56.121 1.00 0.00 C ATOM 28582 H2R OL 729 145.225 47.321 56.034 1.00 0.00 H ATOM 28583 H2S OL 729 146.805 46.460 56.457 1.00 0.00 H ATOM 28584 C13 OL 729 145.782 45.860 54.767 1.00 0.00 C ATOM 28585 H3R OL 729 144.856 45.333 54.528 1.00 0.00 H ATOM 28586 H3S OL 729 145.634 46.705 54.091 1.00 0.00 H ATOM 28587 C14 OL 729 146.918 45.014 54.275 1.00 0.00 C ATOM 28588 H4R OL 729 147.784 45.638 54.506 1.00 0.00 H ATOM 28589 H4S OL 729 146.971 44.079 54.837 1.00 0.00 H ATOM 28590 C15 OL 729 146.887 44.671 52.791 1.00 0.00 C ATOM 28591 H5R OL 729 147.837 44.281 52.421 1.00 0.00 H ATOM 28592 H5S OL 729 146.114 43.921 52.611 1.00 0.00 H ATOM 28593 C16 OL 729 146.630 45.894 51.938 1.00 0.00 C ATOM 28594 H6R OL 729 145.590 46.203 52.064 1.00 0.00 H ATOM 28595 H6S OL 729 147.242 46.749 52.232 1.00 0.00 H ATOM 28596 C17 OL 729 146.765 45.540 50.472 1.00 0.00 C ATOM 28597 H7R OL 729 147.819 45.385 50.234 1.00 0.00 H ATOM 28598 H7S OL 729 146.364 44.527 50.398 1.00 0.00 H ATOM 28599 C18 OL 729 146.295 46.483 49.388 1.00 0.00 C ATOM 28600 H8R OL 729 146.618 47.499 49.627 1.00 0.00 H ATOM 28601 H8S OL 729 146.883 46.127 48.540 1.00 0.00 H ATOM 28602 C19 OL 729 144.795 46.387 49.285 1.00 0.00 C ATOM 28603 H9R OL 729 144.192 46.562 50.173 1.00 0.00 H ATOM 28604 C110 OL 729 144.111 46.067 48.173 1.00 0.00 C ATOM 28605 H10R OL 729 143.030 45.976 48.102 1.00 0.00 H ATOM 28606 C111 OL 729 144.740 45.682 46.842 1.00 0.00 C ATOM 28607 H11R OL 729 144.972 46.604 46.305 1.00 0.00 H ATOM 28608 H11S OL 729 145.523 44.926 46.929 1.00 0.00 H ATOM 28609 C112 OL 729 143.706 44.990 45.967 1.00 0.00 C ATOM 28610 H12R OL 729 143.425 44.026 46.395 1.00 0.00 H ATOM 28611 H12S OL 729 142.871 45.661 45.751 1.00 0.00 H ATOM 28612 C113 OL 729 144.241 44.671 44.593 1.00 0.00 C ATOM 28613 H13R OL 729 144.649 45.629 44.263 1.00 0.00 H ATOM 28614 H13S OL 729 145.098 43.994 44.599 1.00 0.00 H ATOM 28615 C114 OL 729 143.328 43.999 43.653 1.00 0.00 C ATOM 28616 H14R OL 729 142.965 43.160 44.250 1.00 0.00 H ATOM 28617 H14S OL 729 142.366 44.506 43.553 1.00 0.00 H ATOM 28618 C115 OL 729 144.007 43.461 42.427 1.00 0.00 C ATOM 28619 H15R OL 729 144.314 44.282 41.776 1.00 0.00 H ATOM 28620 H15S OL 729 144.826 42.877 42.851 1.00 0.00 H ATOM 28621 C116 OL 729 143.176 42.500 41.583 1.00 0.00 C ATOM 28622 H16R OL 729 143.670 42.052 40.719 1.00 0.00 H ATOM 28623 H16S OL 729 143.036 41.594 42.176 1.00 0.00 H ATOM 28624 C117 OL 729 141.879 43.142 41.052 1.00 0.00 C ATOM 28625 H17R OL 729 141.436 42.381 40.407 1.00 0.00 H ATOM 28626 H17S OL 729 141.173 43.301 41.871 1.00 0.00 H ATOM 28627 C118 OL 729 142.033 44.414 40.236 1.00 0.00 C ATOM 28628 H18R OL 729 142.763 44.371 39.426 1.00 0.00 H ATOM 28629 H18S OL 729 142.301 45.313 40.795 1.00 0.00 H ATOM 28630 H18T OL 729 141.008 44.583 39.898 1.00 0.00 H TER 28631 OL 729 ATOM 28631 C116 PA 730 92.757 131.586 37.470 1.00 0.00 C ATOM 28632 H16R PA 730 93.708 131.370 36.978 1.00 0.00 H ATOM 28633 H16S PA 730 92.342 132.455 36.955 1.00 0.00 H ATOM 28634 H16T PA 730 92.075 130.743 37.346 1.00 0.00 H ATOM 28635 C115 PA 730 93.105 131.873 38.885 1.00 0.00 C ATOM 28636 H15R PA 730 92.159 131.902 39.429 1.00 0.00 H ATOM 28637 H15S PA 730 93.437 132.914 38.897 1.00 0.00 H ATOM 28638 C114 PA 730 94.197 130.966 39.530 1.00 0.00 C ATOM 28639 H14R PA 730 95.190 131.194 39.138 1.00 0.00 H ATOM 28640 H14S PA 730 94.025 129.907 39.327 1.00 0.00 H ATOM 28641 C113 PA 730 94.359 131.302 41.045 1.00 0.00 C ATOM 28642 H13R PA 730 94.588 132.332 41.327 1.00 0.00 H ATOM 28643 H13S PA 730 95.164 130.650 41.391 1.00 0.00 H ATOM 28644 C112 PA 730 93.116 130.758 41.907 1.00 0.00 C ATOM 28645 H12R PA 730 93.206 129.674 41.810 1.00 0.00 H ATOM 28646 H12S PA 730 92.240 131.168 41.400 1.00 0.00 H ATOM 28647 C111 PA 730 93.124 131.057 43.346 1.00 0.00 C ATOM 28648 H11R PA 730 93.308 132.125 43.484 1.00 0.00 H ATOM 28649 H11S PA 730 93.983 130.497 43.720 1.00 0.00 H ATOM 28650 C110 PA 730 91.798 130.726 43.999 1.00 0.00 C ATOM 28651 H10R PA 730 91.608 129.689 43.716 1.00 0.00 H ATOM 28652 H10S PA 730 90.994 131.349 43.602 1.00 0.00 H ATOM 28653 C19 PA 730 91.940 130.903 45.547 1.00 0.00 C ATOM 28654 H9R PA 730 92.054 131.968 45.757 1.00 0.00 H ATOM 28655 H9S PA 730 92.829 130.444 45.985 1.00 0.00 H ATOM 28656 C18 PA 730 90.838 130.315 46.420 1.00 0.00 C ATOM 28657 H8R PA 730 90.953 129.233 46.333 1.00 0.00 H ATOM 28658 H8S PA 730 89.891 130.559 45.936 1.00 0.00 H ATOM 28659 C17 PA 730 91.015 130.657 47.916 1.00 0.00 C ATOM 28660 H7R PA 730 91.236 131.726 47.935 1.00 0.00 H ATOM 28661 H7S PA 730 91.887 130.137 48.318 1.00 0.00 H ATOM 28662 C16 PA 730 89.792 130.267 48.804 1.00 0.00 C ATOM 28663 H6R PA 730 89.633 129.199 48.641 1.00 0.00 H ATOM 28664 H6S PA 730 88.798 130.615 48.517 1.00 0.00 H ATOM 28665 C15 PA 730 89.879 130.546 50.337 1.00 0.00 C ATOM 28666 H5R PA 730 90.569 129.866 50.841 1.00 0.00 H ATOM 28667 H5S PA 730 88.887 130.341 50.746 1.00 0.00 H ATOM 28668 C14 PA 730 90.371 131.947 50.679 1.00 0.00 C ATOM 28669 H4R PA 730 89.708 132.718 50.280 1.00 0.00 H ATOM 28670 H4S PA 730 91.321 132.188 50.197 1.00 0.00 H ATOM 28671 C13 PA 730 90.465 132.190 52.183 1.00 0.00 C ATOM 28672 H3R PA 730 91.115 131.420 52.605 1.00 0.00 H ATOM 28673 H3S PA 730 89.475 132.118 52.638 1.00 0.00 H ATOM 28674 C12 PA 730 90.793 133.594 52.593 1.00 0.00 C ATOM 28675 H2R PA 730 89.963 134.294 52.477 1.00 0.00 H ATOM 28676 H2S PA 730 91.662 133.894 52.004 1.00 0.00 H ATOM 28677 C11 PGR 731 91.063 133.769 54.040 1.00 0.00 C ATOM 28678 O12 PGR 731 90.765 132.927 54.847 1.00 0.00 O ATOM 28679 O11 PGR 731 91.710 134.888 54.262 1.00 0.00 O ATOM 28680 C1 PGR 731 92.158 135.290 55.612 1.00 0.00 C ATOM 28681 HR PGR 731 91.517 135.066 56.468 1.00 0.00 H ATOM 28682 HS PGR 731 92.322 136.370 55.582 1.00 0.00 H ATOM 28683 C2 PGR 731 93.384 134.382 55.831 1.00 0.00 C ATOM 28684 HX PGR 731 93.250 133.494 55.207 1.00 0.00 H ATOM 28685 C3 PGR 731 93.634 134.163 57.308 1.00 0.00 C ATOM 28686 HA PGR 731 94.615 133.762 57.577 1.00 0.00 H ATOM 28687 HB PGR 731 92.849 133.472 57.627 1.00 0.00 H ATOM 28688 O31 PGR 731 93.465 135.339 58.065 1.00 0.00 O ATOM 28689 P31 PGR 731 93.257 135.394 59.606 1.00 0.00 P ATOM 28690 O32 PGR 731 91.827 134.657 59.827 1.00 0.00 O ATOM 28691 C31 PGR 731 90.684 135.314 60.230 1.00 0.00 C ATOM 28692 H1A PGR 731 90.595 136.221 59.628 1.00 0.00 H ATOM 28693 H1B PGR 731 90.671 135.636 61.274 1.00 0.00 H ATOM 28694 C32 PGR 731 89.394 134.458 59.958 1.00 0.00 C ATOM 28695 H2A PGR 731 88.706 135.051 60.566 1.00 0.00 H ATOM 28696 O35 PGR 731 89.549 133.125 60.487 1.00 0.00 O ATOM 28697 HO5A PGR 731 88.650 132.749 60.484 1.00 0.00 H ATOM 28698 C33 PGR 731 89.196 134.378 58.453 1.00 0.00 C ATOM 28699 H3A PGR 731 88.201 134.024 58.172 1.00 0.00 H ATOM 28700 H3B PGR 731 89.293 135.403 58.085 1.00 0.00 H ATOM 28701 O33 PGR 731 94.255 134.480 60.245 1.00 0.00 O ATOM 28702 O34 PGR 731 93.126 136.799 60.000 1.00 0.00 O ATOM 28703 O21 PGR 731 94.539 135.064 55.294 1.00 0.00 O ATOM 28704 C21 PGR 731 94.869 134.974 53.941 1.00 0.00 C ATOM 28705 O22 PGR 731 94.225 134.386 53.121 1.00 0.00 O ATOM 28706 O36 PGR 731 90.191 133.571 57.846 1.00 0.00 O ATOM 28707 HO6A PGR 731 89.868 133.342 56.956 1.00 0.00 H ATOM 28708 C12 OL 732 96.088 135.856 53.692 1.00 0.00 C ATOM 28709 H2R OL 732 95.801 136.909 53.737 1.00 0.00 H ATOM 28710 H2S OL 732 96.732 135.687 54.557 1.00 0.00 H ATOM 28711 C13 OL 732 96.766 135.382 52.398 1.00 0.00 C ATOM 28712 H3R OL 732 97.352 134.500 52.664 1.00 0.00 H ATOM 28713 H3S OL 732 96.053 135.047 51.642 1.00 0.00 H ATOM 28714 C14 OL 732 97.623 136.464 51.796 1.00 0.00 C ATOM 28715 H4R OL 732 97.088 137.398 51.618 1.00 0.00 H ATOM 28716 H4S OL 732 98.382 136.685 52.550 1.00 0.00 H ATOM 28717 C15 OL 732 98.170 136.152 50.365 1.00 0.00 C ATOM 28718 H5R OL 732 98.954 135.405 50.507 1.00 0.00 H ATOM 28719 H5S OL 732 97.414 135.559 49.846 1.00 0.00 H ATOM 28720 C16 OL 732 98.710 137.299 49.497 1.00 0.00 C ATOM 28721 H6R OL 732 99.543 137.751 50.039 1.00 0.00 H ATOM 28722 H6S OL 732 99.116 136.898 48.566 1.00 0.00 H ATOM 28723 C17 OL 732 97.720 138.471 49.145 1.00 0.00 C ATOM 28724 H7R OL 732 97.059 138.202 48.318 1.00 0.00 H ATOM 28725 H7S OL 732 97.007 138.749 49.925 1.00 0.00 H ATOM 28726 C18 OL 732 98.367 139.692 48.685 1.00 0.00 C ATOM 28727 H8R OL 732 98.975 140.092 49.499 1.00 0.00 H ATOM 28728 H8S OL 732 99.043 139.444 47.865 1.00 0.00 H ATOM 28729 C19 OL 732 97.445 140.783 48.357 1.00 0.00 C ATOM 28730 H9R OL 732 96.841 141.176 49.172 1.00 0.00 H ATOM 28731 C110 OL 732 97.087 141.329 47.159 1.00 0.00 C ATOM 28732 H10R OL 732 96.443 142.202 47.091 1.00 0.00 H ATOM 28733 C111 OL 732 97.928 141.139 45.938 1.00 0.00 C ATOM 28734 H11R OL 732 98.084 142.064 45.379 1.00 0.00 H ATOM 28735 H11S OL 732 98.968 140.916 46.188 1.00 0.00 H ATOM 28736 C112 OL 732 97.285 140.131 44.942 1.00 0.00 C ATOM 28737 H12R OL 732 96.210 140.076 45.128 1.00 0.00 H ATOM 28738 H12S OL 732 97.415 140.580 43.956 1.00 0.00 H ATOM 28739 C113 OL 732 97.858 138.655 44.973 1.00 0.00 C ATOM 28740 H13R OL 732 98.895 138.560 44.643 1.00 0.00 H ATOM 28741 H13S OL 732 97.925 138.353 46.021 1.00 0.00 H ATOM 28742 C114 OL 732 96.978 137.705 44.115 1.00 0.00 C ATOM 28743 H14R OL 732 95.962 137.692 44.514 1.00 0.00 H ATOM 28744 H14S OL 732 96.819 137.990 43.072 1.00 0.00 H ATOM 28745 C115 OL 732 97.539 136.316 44.001 1.00 0.00 C ATOM 28746 H15R OL 732 98.528 136.231 43.547 1.00 0.00 H ATOM 28747 H15S OL 732 97.770 135.944 45.001 1.00 0.00 H ATOM 28748 C116 OL 732 96.521 135.289 43.403 1.00 0.00 C ATOM 28749 H16R OL 732 97.136 134.411 43.195 1.00 0.00 H ATOM 28750 H16S OL 732 95.744 134.973 44.103 1.00 0.00 H ATOM 28751 C117 OL 732 95.990 135.564 41.992 1.00 0.00 C ATOM 28752 H17R OL 732 96.729 136.167 41.460 1.00 0.00 H ATOM 28753 H17S OL 732 95.793 134.645 41.438 1.00 0.00 H ATOM 28754 C118 OL 732 94.643 136.253 42.013 1.00 0.00 C ATOM 28755 H18R OL 732 93.971 135.789 42.738 1.00 0.00 H ATOM 28756 H18S OL 732 94.092 136.255 41.070 1.00 0.00 H ATOM 28757 H18T OL 732 94.693 137.331 42.180 1.00 0.00 H TER 28758 OL 732 ATOM 28758 C116 PA 733 36.087 32.144 41.593 1.00 0.00 C ATOM 28759 H16R PA 733 36.958 32.559 41.081 1.00 0.00 H ATOM 28760 H16S PA 733 36.126 32.357 42.663 1.00 0.00 H ATOM 28761 H16T PA 733 35.246 32.786 41.319 1.00 0.00 H ATOM 28762 C115 PA 733 35.756 30.636 41.468 1.00 0.00 C ATOM 28763 H15R PA 733 35.758 30.317 40.424 1.00 0.00 H ATOM 28764 H15S PA 733 34.760 30.443 41.874 1.00 0.00 H ATOM 28765 C114 PA 733 36.798 29.665 42.170 1.00 0.00 C ATOM 28766 H14R PA 733 36.566 28.633 41.899 1.00 0.00 H ATOM 28767 H14S PA 733 36.657 29.813 43.243 1.00 0.00 H ATOM 28768 C113 PA 733 38.247 30.060 42.052 1.00 0.00 C ATOM 28769 H13R PA 733 38.509 31.112 42.179 1.00 0.00 H ATOM 28770 H13S PA 733 38.407 29.759 41.014 1.00 0.00 H ATOM 28771 C112 PA 733 39.269 29.139 42.754 1.00 0.00 C ATOM 28772 H12R PA 733 39.014 29.237 43.812 1.00 0.00 H ATOM 28773 H12S PA 733 40.230 29.628 42.586 1.00 0.00 H ATOM 28774 C111 PA 733 39.326 27.659 42.370 1.00 0.00 C ATOM 28775 H11R PA 733 39.156 27.646 41.291 1.00 0.00 H ATOM 28776 H11S PA 733 38.455 27.232 42.873 1.00 0.00 H ATOM 28777 C110 PA 733 40.578 26.864 42.766 1.00 0.00 C ATOM 28778 H10R PA 733 41.415 27.477 42.425 1.00 0.00 H ATOM 28779 H10S PA 733 40.697 25.877 42.314 1.00 0.00 H ATOM 28780 C19 PA 733 40.675 26.667 44.273 1.00 0.00 C ATOM 28781 H9R PA 733 39.926 25.982 44.676 1.00 0.00 H ATOM 28782 H9S PA 733 40.480 27.493 44.960 1.00 0.00 H ATOM 28783 C18 PA 733 42.027 26.087 44.633 1.00 0.00 C ATOM 28784 H8R PA 733 42.884 26.750 44.506 1.00 0.00 H ATOM 28785 H8S PA 733 42.207 25.162 44.080 1.00 0.00 H ATOM 28786 C17 PA 733 42.185 25.890 46.091 1.00 0.00 C ATOM 28787 H7R PA 733 41.333 25.309 46.451 1.00 0.00 H ATOM 28788 H7S PA 733 42.152 26.861 46.591 1.00 0.00 H ATOM 28789 C16 PA 733 43.398 25.125 46.505 1.00 0.00 C ATOM 28790 H6R PA 733 44.323 25.423 46.008 1.00 0.00 H ATOM 28791 H6S PA 733 43.275 24.096 46.162 1.00 0.00 H ATOM 28792 C15 PA 733 43.588 24.946 48.021 1.00 0.00 C ATOM 28793 H5R PA 733 43.688 25.952 48.434 1.00 0.00 H ATOM 28794 H5S PA 733 44.582 24.503 48.105 1.00 0.00 H ATOM 28795 C14 PA 733 42.530 24.011 48.644 1.00 0.00 C ATOM 28796 H4R PA 733 42.508 23.090 48.058 1.00 0.00 H ATOM 28797 H4S PA 733 41.574 24.508 48.467 1.00 0.00 H ATOM 28798 C13 PA 733 42.790 23.528 50.051 1.00 0.00 C ATOM 28799 H3R PA 733 42.840 24.293 50.829 1.00 0.00 H ATOM 28800 H3S PA 733 43.747 23.008 50.133 1.00 0.00 H ATOM 28801 C12 PA 733 41.761 22.423 50.453 1.00 0.00 C ATOM 28802 H2R PA 733 41.900 21.465 49.948 1.00 0.00 H ATOM 28803 H2S PA 733 40.736 22.747 50.259 1.00 0.00 H ATOM 28804 C11 PC 734 41.757 22.093 51.935 1.00 0.00 C ATOM 28805 O12 PC 734 40.768 21.788 52.597 1.00 0.00 O ATOM 28806 O11 PC 734 43.033 22.110 52.361 1.00 0.00 O ATOM 28807 C1 PC 734 43.399 21.622 53.668 1.00 0.00 C ATOM 28808 HR PC 734 43.512 20.536 53.716 1.00 0.00 H ATOM 28809 HS PC 734 42.748 21.972 54.473 1.00 0.00 H ATOM 28810 C2 PC 734 44.851 22.089 53.850 1.00 0.00 C ATOM 28811 HX PC 734 45.410 21.563 53.073 1.00 0.00 H ATOM 28812 C3 PC 734 45.443 21.734 55.227 1.00 0.00 C ATOM 28813 HA PC 734 46.335 22.322 55.458 1.00 0.00 H ATOM 28814 HB PC 734 45.721 20.677 55.211 1.00 0.00 H ATOM 28815 O31 PC 734 44.518 22.008 56.233 1.00 0.00 O ATOM 28816 P31 PC 734 44.847 21.763 57.794 1.00 0.00 P ATOM 28817 O32 PC 734 43.565 22.148 58.658 1.00 0.00 O ATOM 28818 C31 PC 734 42.436 21.282 58.690 1.00 0.00 C ATOM 28819 H1A PC 734 42.791 20.300 59.013 1.00 0.00 H ATOM 28820 H1B PC 734 42.168 21.111 57.645 1.00 0.00 H ATOM 28821 C32 PC 734 41.336 21.828 59.640 1.00 0.00 C ATOM 28822 H2A PC 734 41.122 22.813 59.222 1.00 0.00 H ATOM 28823 H2B PC 734 41.668 21.942 60.673 1.00 0.00 H ATOM 28824 N31 PC 734 39.966 21.231 59.597 1.00 0.00 N ATOM 28825 C33 PC 734 39.518 21.300 58.220 1.00 0.00 C ATOM 28826 H3A PC 734 38.483 20.956 58.197 1.00 0.00 H ATOM 28827 H3B PC 734 40.188 20.737 57.569 1.00 0.00 H ATOM 28828 H3C PC 734 39.597 22.371 58.026 1.00 0.00 H ATOM 28829 C34 PC 734 39.933 19.819 60.137 1.00 0.00 C ATOM 28830 H4A PC 734 38.882 19.527 60.175 1.00 0.00 H ATOM 28831 H4B PC 734 40.310 19.909 61.156 1.00 0.00 H ATOM 28832 H4C PC 734 40.454 19.100 59.503 1.00 0.00 H ATOM 28833 C35 PC 734 39.104 22.109 60.428 1.00 0.00 C ATOM 28834 H5A PC 734 39.195 23.101 59.981 1.00 0.00 H ATOM 28835 H5B PC 734 39.585 22.250 61.398 1.00 0.00 H ATOM 28836 H5C PC 734 38.058 21.802 60.468 1.00 0.00 H ATOM 28837 O33 PC 734 45.143 20.306 58.118 1.00 0.00 O ATOM 28838 O34 PC 734 45.915 22.689 58.155 1.00 0.00 O ATOM 28839 O21 PC 734 44.814 23.530 53.692 1.00 0.00 O ATOM 28840 C21 PC 734 46.000 24.153 53.380 1.00 0.00 C ATOM 28841 O22 PC 734 47.077 23.553 53.315 1.00 0.00 O ATOM 28842 C12 OL 735 45.952 25.638 53.256 1.00 0.00 C ATOM 28843 H2R OL 735 46.348 25.950 52.287 1.00 0.00 H ATOM 28844 H2S OL 735 44.921 25.993 53.325 1.00 0.00 H ATOM 28845 C13 OL 735 46.774 26.281 54.288 1.00 0.00 C ATOM 28846 H3R OL 735 46.543 25.972 55.310 1.00 0.00 H ATOM 28847 H3S OL 735 47.808 26.012 54.065 1.00 0.00 H ATOM 28848 C14 OL 735 46.766 27.798 54.226 1.00 0.00 C ATOM 28849 H4R OL 735 47.500 28.163 54.948 1.00 0.00 H ATOM 28850 H4S OL 735 47.205 28.198 53.310 1.00 0.00 H ATOM 28851 C15 OL 735 45.393 28.462 54.174 1.00 0.00 C ATOM 28852 H5R OL 735 44.826 28.020 53.352 1.00 0.00 H ATOM 28853 H5S OL 735 44.893 28.250 55.121 1.00 0.00 H ATOM 28854 C16 OL 735 45.429 29.996 53.879 1.00 0.00 C ATOM 28855 H6R OL 735 46.142 30.493 54.540 1.00 0.00 H ATOM 28856 H6S OL 735 45.848 30.094 52.875 1.00 0.00 H ATOM 28857 C17 OL 735 44.101 30.675 54.035 1.00 0.00 C ATOM 28858 H7R OL 735 43.464 30.086 54.699 1.00 0.00 H ATOM 28859 H7S OL 735 44.280 31.638 54.518 1.00 0.00 H ATOM 28860 C18 OL 735 43.320 30.800 52.708 1.00 0.00 C ATOM 28861 H8R OL 735 42.367 31.253 52.991 1.00 0.00 H ATOM 28862 H8S OL 735 43.822 31.442 51.982 1.00 0.00 H ATOM 28863 C19 OL 735 42.831 29.466 52.197 1.00 0.00 C ATOM 28864 H9R OL 735 42.397 28.895 53.014 1.00 0.00 H ATOM 28865 C110 OL 735 42.903 28.920 50.969 1.00 0.00 C ATOM 28866 H10R OL 735 42.505 27.920 50.815 1.00 0.00 H ATOM 28867 C111 OL 735 43.262 29.591 49.718 1.00 0.00 C ATOM 28868 H11R OL 735 44.014 30.361 49.903 1.00 0.00 H ATOM 28869 H11S OL 735 43.806 28.858 49.120 1.00 0.00 H ATOM 28870 C112 OL 735 42.040 30.161 48.985 1.00 0.00 C ATOM 28871 H12R OL 735 41.242 29.427 49.109 1.00 0.00 H ATOM 28872 H12S OL 735 41.605 30.991 49.546 1.00 0.00 H ATOM 28873 C113 OL 735 42.193 30.340 47.512 1.00 0.00 C ATOM 28874 H13R OL 735 43.111 30.880 47.270 1.00 0.00 H ATOM 28875 H13S OL 735 42.197 29.449 46.880 1.00 0.00 H ATOM 28876 C114 OL 735 41.066 31.161 46.925 1.00 0.00 C ATOM 28877 H14R OL 735 40.126 30.707 47.245 1.00 0.00 H ATOM 28878 H14S OL 735 41.019 32.159 47.367 1.00 0.00 H ATOM 28879 C115 OL 735 41.192 31.332 45.407 1.00 0.00 C ATOM 28880 H15R OL 735 42.204 31.681 45.192 1.00 0.00 H ATOM 28881 H15S OL 735 41.052 30.337 44.980 1.00 0.00 H ATOM 28882 C116 OL 735 40.115 32.184 44.809 1.00 0.00 C ATOM 28883 H16R OL 735 40.191 32.269 43.723 1.00 0.00 H ATOM 28884 H16S OL 735 39.167 31.695 45.040 1.00 0.00 H ATOM 28885 C117 OL 735 40.125 33.683 45.245 1.00 0.00 C ATOM 28886 H17R OL 735 39.960 33.790 46.319 1.00 0.00 H ATOM 28887 H17S OL 735 41.113 34.092 45.022 1.00 0.00 H ATOM 28888 C118 OL 735 39.078 34.566 44.530 1.00 0.00 C ATOM 28889 H18R OL 735 38.102 34.085 44.432 1.00 0.00 H ATOM 28890 H18S OL 735 39.496 34.751 43.539 1.00 0.00 H ATOM 28891 H18T OL 735 39.003 35.572 44.949 1.00 0.00 H TER 28892 OL 735 ATOM 28892 C116 PA 736 104.882 115.955 45.106 1.00 0.00 C ATOM 28893 H16R PA 736 105.071 116.882 45.653 1.00 0.00 H ATOM 28894 H16S PA 736 103.838 116.065 44.803 1.00 0.00 H ATOM 28895 H16T PA 736 105.491 115.881 44.203 1.00 0.00 H ATOM 28896 C115 PA 736 105.093 114.726 45.886 1.00 0.00 C ATOM 28897 H15R PA 736 104.828 113.895 45.229 1.00 0.00 H ATOM 28898 H15S PA 736 104.257 114.759 46.588 1.00 0.00 H ATOM 28899 C114 PA 736 106.412 114.605 46.641 1.00 0.00 C ATOM 28900 H14R PA 736 106.528 115.416 47.363 1.00 0.00 H ATOM 28901 H14S PA 736 107.344 114.541 46.076 1.00 0.00 H ATOM 28902 C113 PA 736 106.445 113.369 47.523 1.00 0.00 C ATOM 28903 H13R PA 736 106.235 112.553 46.829 1.00 0.00 H ATOM 28904 H13S PA 736 105.690 113.450 48.308 1.00 0.00 H ATOM 28905 C112 PA 736 107.843 113.117 48.087 1.00 0.00 C ATOM 28906 H12R PA 736 108.208 113.928 48.720 1.00 0.00 H ATOM 28907 H12S PA 736 108.583 113.219 47.290 1.00 0.00 H ATOM 28908 C111 PA 736 107.870 111.757 48.818 1.00 0.00 C ATOM 28909 H11R PA 736 107.517 110.959 48.162 1.00 0.00 H ATOM 28910 H11S PA 736 107.025 111.745 49.510 1.00 0.00 H ATOM 28911 C110 PA 736 109.192 111.480 49.518 1.00 0.00 C ATOM 28912 H10R PA 736 109.355 112.327 50.187 1.00 0.00 H ATOM 28913 H10S PA 736 109.982 111.460 48.764 1.00 0.00 H ATOM 28914 C19 PA 736 109.202 110.164 50.428 1.00 0.00 C ATOM 28915 H9R PA 736 109.045 109.236 49.873 1.00 0.00 H ATOM 28916 H9S PA 736 108.416 110.195 51.184 1.00 0.00 H ATOM 28917 C18 PA 736 110.466 110.114 51.263 1.00 0.00 C ATOM 28918 H8R PA 736 110.333 110.910 51.999 1.00 0.00 H ATOM 28919 H8S PA 736 111.342 110.338 50.652 1.00 0.00 H ATOM 28920 C17 PA 736 110.765 108.846 51.970 1.00 0.00 C ATOM 28921 H7R PA 736 111.662 109.005 52.572 1.00 0.00 H ATOM 28922 H7S PA 736 110.824 108.076 51.198 1.00 0.00 H ATOM 28923 C16 PA 736 109.632 108.453 52.995 1.00 0.00 C ATOM 28924 H6R PA 736 108.612 108.505 52.608 1.00 0.00 H ATOM 28925 H6S PA 736 109.586 109.112 53.865 1.00 0.00 H ATOM 28926 C15 PA 736 109.892 107.117 53.580 1.00 0.00 C ATOM 28927 H5R PA 736 110.921 107.168 53.942 1.00 0.00 H ATOM 28928 H5S PA 736 109.853 106.374 52.781 1.00 0.00 H ATOM 28929 C14 PA 736 109.160 106.551 54.841 1.00 0.00 C ATOM 28930 H4R PA 736 108.088 106.527 54.634 1.00 0.00 H ATOM 28931 H4S PA 736 109.333 107.197 55.705 1.00 0.00 H ATOM 28932 C13 PA 736 109.799 105.175 55.254 1.00 0.00 C ATOM 28933 H3R PA 736 110.890 105.196 55.305 1.00 0.00 H ATOM 28934 H3S PA 736 109.615 104.401 54.506 1.00 0.00 H ATOM 28935 C12 PA 736 109.327 104.771 56.626 1.00 0.00 C ATOM 28936 H2R PA 736 108.239 104.706 56.699 1.00 0.00 H ATOM 28937 H2S PA 736 109.471 105.454 57.466 1.00 0.00 H ATOM 28938 C11 PGR 737 110.038 103.477 56.976 1.00 0.00 C ATOM 28939 O12 PGR 737 111.156 103.372 57.395 1.00 0.00 O ATOM 28940 O11 PGR 737 109.183 102.434 56.830 1.00 0.00 O ATOM 28941 C1 PGR 737 109.676 101.048 57.189 1.00 0.00 C ATOM 28942 HR PGR 737 109.997 101.199 58.223 1.00 0.00 H ATOM 28943 HS PGR 737 110.438 100.690 56.492 1.00 0.00 H ATOM 28944 C2 PGR 737 108.514 100.104 57.372 1.00 0.00 C ATOM 28945 HX PGR 737 107.840 100.643 58.042 1.00 0.00 H ATOM 28946 C3 PGR 737 109.048 98.809 58.058 1.00 0.00 C ATOM 28947 HA PGR 737 108.214 98.336 58.583 1.00 0.00 H ATOM 28948 HB PGR 737 109.757 98.950 58.877 1.00 0.00 H ATOM 28949 O31 PGR 737 109.760 97.920 57.130 1.00 0.00 O ATOM 28950 P31 PGR 737 110.312 96.506 57.567 1.00 0.00 P ATOM 28951 O32 PGR 737 111.809 96.845 57.843 1.00 0.00 O ATOM 28952 C31 PGR 737 112.647 97.193 56.772 1.00 0.00 C ATOM 28953 H1A PGR 737 112.213 97.878 56.040 1.00 0.00 H ATOM 28954 H1B PGR 737 112.937 96.295 56.220 1.00 0.00 H ATOM 28955 C32 PGR 737 113.878 97.928 57.241 1.00 0.00 C ATOM 28956 H2A PGR 737 114.493 98.127 56.360 1.00 0.00 H ATOM 28957 O35 PGR 737 114.549 97.034 58.116 1.00 0.00 O ATOM 28958 HO5A PGR 737 114.592 96.201 57.612 1.00 0.00 H ATOM 28959 C33 PGR 737 113.644 99.308 57.906 1.00 0.00 C ATOM 28960 H3A PGR 737 114.566 99.624 58.400 1.00 0.00 H ATOM 28961 H3B PGR 737 113.188 100.024 57.217 1.00 0.00 H ATOM 28962 O33 PGR 737 109.721 96.112 58.867 1.00 0.00 O ATOM 28963 O34 PGR 737 110.222 95.492 56.450 1.00 0.00 O ATOM 28964 O21 PGR 737 107.831 99.790 56.167 1.00 0.00 O ATOM 28965 C21 PGR 737 106.577 99.259 56.288 1.00 0.00 C ATOM 28966 O22 PGR 737 105.931 99.293 57.315 1.00 0.00 O ATOM 28967 O36 PGR 737 112.829 99.165 59.050 1.00 0.00 O ATOM 28968 HO6A PGR 737 112.573 100.074 59.288 1.00 0.00 H ATOM 28969 C12 OL 738 106.117 98.548 55.022 1.00 0.00 C ATOM 28970 H2R OL 738 106.130 97.458 55.082 1.00 0.00 H ATOM 28971 H2S OL 738 105.054 98.733 54.857 1.00 0.00 H ATOM 28972 C13 OL 738 106.829 99.156 53.819 1.00 0.00 C ATOM 28973 H3R OL 738 106.186 98.969 52.956 1.00 0.00 H ATOM 28974 H3S OL 738 106.823 100.235 53.986 1.00 0.00 H ATOM 28975 C14 OL 738 108.206 98.610 53.518 1.00 0.00 C ATOM 28976 H4R OL 738 108.867 98.833 54.359 1.00 0.00 H ATOM 28977 H4S OL 738 108.036 97.556 53.289 1.00 0.00 H ATOM 28978 C15 OL 738 108.861 99.238 52.296 1.00 0.00 C ATOM 28979 H5R OL 738 109.017 100.317 52.358 1.00 0.00 H ATOM 28980 H5S OL 738 109.830 98.765 52.125 1.00 0.00 H ATOM 28981 C16 OL 738 108.150 98.892 50.941 1.00 0.00 C ATOM 28982 H6R OL 738 108.071 97.804 50.885 1.00 0.00 H ATOM 28983 H6S OL 738 107.111 99.228 50.910 1.00 0.00 H ATOM 28984 C17 OL 738 108.767 99.348 49.663 1.00 0.00 C ATOM 28985 H7R OL 738 108.995 100.410 49.553 1.00 0.00 H ATOM 28986 H7S OL 738 109.751 98.873 49.649 1.00 0.00 H ATOM 28987 C18 OL 738 108.003 98.843 48.473 1.00 0.00 C ATOM 28988 H8R OL 738 108.615 98.991 47.581 1.00 0.00 H ATOM 28989 H8S OL 738 107.927 97.758 48.375 1.00 0.00 H ATOM 28990 C19 OL 738 106.699 99.512 48.346 1.00 0.00 C ATOM 28991 H9R OL 738 105.867 98.838 48.533 1.00 0.00 H ATOM 28992 C110 OL 738 106.329 100.771 48.195 1.00 0.00 C ATOM 28993 H10R OL 738 105.250 100.901 48.237 1.00 0.00 H ATOM 28994 C111 OL 738 107.078 101.998 47.946 1.00 0.00 C ATOM 28995 H11R OL 738 106.527 102.831 48.387 1.00 0.00 H ATOM 28996 H11S OL 738 108.077 101.940 48.385 1.00 0.00 H ATOM 28997 C112 OL 738 107.212 102.420 46.512 1.00 0.00 C ATOM 28998 H12R OL 738 107.888 103.276 46.569 1.00 0.00 H ATOM 28999 H12S OL 738 107.697 101.671 45.882 1.00 0.00 H ATOM 29000 C113 OL 738 105.931 102.856 45.862 1.00 0.00 C ATOM 29001 H13R OL 738 105.221 102.027 45.839 1.00 0.00 H ATOM 29002 H13S OL 738 105.514 103.623 46.517 1.00 0.00 H ATOM 29003 C114 OL 738 106.135 103.324 44.432 1.00 0.00 C ATOM 29004 H14R OL 738 107.040 103.935 44.432 1.00 0.00 H ATOM 29005 H14S OL 738 106.381 102.463 43.806 1.00 0.00 H ATOM 29006 C115 OL 738 104.904 104.054 43.749 1.00 0.00 C ATOM 29007 H15R OL 738 104.094 103.322 43.705 1.00 0.00 H ATOM 29008 H15S OL 738 104.569 104.973 44.234 1.00 0.00 H ATOM 29009 C116 OL 738 105.115 104.394 42.283 1.00 0.00 C ATOM 29010 H16R OL 738 105.990 105.045 42.333 1.00 0.00 H ATOM 29011 H16S OL 738 105.475 103.480 41.806 1.00 0.00 H ATOM 29012 C117 OL 738 103.850 104.878 41.567 1.00 0.00 C ATOM 29013 H17R OL 738 103.182 104.018 41.485 1.00 0.00 H ATOM 29014 H17S OL 738 103.406 105.681 42.160 1.00 0.00 H ATOM 29015 C118 OL 738 104.091 105.485 40.233 1.00 0.00 C ATOM 29016 H18R OL 738 104.821 106.292 40.138 1.00 0.00 H ATOM 29017 H18S OL 738 103.159 105.877 39.820 1.00 0.00 H ATOM 29018 H18T OL 738 104.386 104.648 39.597 1.00 0.00 H TER 29019 OL 738 ATOM 29019 C116 PA 739 123.061 111.887 46.459 1.00 0.00 C ATOM 29020 H16R PA 739 122.088 111.454 46.221 1.00 0.00 H ATOM 29021 H16S PA 739 123.726 111.051 46.687 1.00 0.00 H ATOM 29022 H16T PA 739 123.445 112.384 45.566 1.00 0.00 H ATOM 29023 C115 PA 739 122.947 112.897 47.579 1.00 0.00 C ATOM 29024 H15R PA 739 122.337 113.716 47.190 1.00 0.00 H ATOM 29025 H15S PA 739 123.923 113.336 47.794 1.00 0.00 H ATOM 29026 C114 PA 739 122.290 112.363 48.898 1.00 0.00 C ATOM 29027 H14R PA 739 122.777 111.427 49.180 1.00 0.00 H ATOM 29028 H14S PA 739 121.297 112.027 48.593 1.00 0.00 H ATOM 29029 C113 PA 739 122.299 113.335 50.036 1.00 0.00 C ATOM 29030 H13R PA 739 121.557 112.930 50.727 1.00 0.00 H ATOM 29031 H13S PA 739 121.871 114.280 49.694 1.00 0.00 H ATOM 29032 C112 PA 739 123.551 113.566 50.792 1.00 0.00 C ATOM 29033 H12R PA 739 123.379 114.521 51.294 1.00 0.00 H ATOM 29034 H12S PA 739 124.342 113.778 50.071 1.00 0.00 H ATOM 29035 C111 PA 739 124.019 112.515 51.787 1.00 0.00 C ATOM 29036 H11R PA 739 124.068 111.619 51.165 1.00 0.00 H ATOM 29037 H11S PA 739 123.326 112.472 52.629 1.00 0.00 H ATOM 29038 C110 PA 739 125.468 112.750 52.383 1.00 0.00 C ATOM 29039 H10R PA 739 125.405 113.630 53.027 1.00 0.00 H ATOM 29040 H10S PA 739 126.059 113.161 51.562 1.00 0.00 H ATOM 29041 C19 PA 739 126.166 111.550 53.056 1.00 0.00 C ATOM 29042 H9R PA 739 127.209 111.695 53.344 1.00 0.00 H ATOM 29043 H9S PA 739 126.061 110.837 52.235 1.00 0.00 H ATOM 29044 C18 PA 739 125.333 110.878 54.144 1.00 0.00 C ATOM 29045 H8R PA 739 125.893 110.004 54.482 1.00 0.00 H ATOM 29046 H8S PA 739 124.460 110.418 53.675 1.00 0.00 H ATOM 29047 C17 PA 739 124.891 111.664 55.323 1.00 0.00 C ATOM 29048 H7R PA 739 124.103 112.316 54.941 1.00 0.00 H ATOM 29049 H7S PA 739 125.677 112.201 55.857 1.00 0.00 H ATOM 29050 C16 PA 739 124.167 110.886 56.312 1.00 0.00 C ATOM 29051 H6R PA 739 124.869 110.343 56.948 1.00 0.00 H ATOM 29052 H6S PA 739 123.478 110.161 55.875 1.00 0.00 H ATOM 29053 C15 PA 739 123.364 111.782 57.270 1.00 0.00 C ATOM 29054 H5R PA 739 122.844 112.508 56.641 1.00 0.00 H ATOM 29055 H5S PA 739 124.016 112.417 57.875 1.00 0.00 H ATOM 29056 C14 PA 739 122.472 111.011 58.165 1.00 0.00 C ATOM 29057 H4R PA 739 123.104 110.267 58.655 1.00 0.00 H ATOM 29058 H4S PA 739 121.752 110.547 57.489 1.00 0.00 H ATOM 29059 C13 PA 739 121.717 111.889 59.207 1.00 0.00 C ATOM 29060 H3R PA 739 122.432 112.152 59.990 1.00 0.00 H ATOM 29061 H3S PA 739 121.077 111.212 59.777 1.00 0.00 H ATOM 29062 C12 PA 739 120.789 113.016 58.705 1.00 0.00 C ATOM 29063 H2R PA 739 120.177 112.648 57.878 1.00 0.00 H ATOM 29064 H2S PA 739 121.437 113.759 58.235 1.00 0.00 H ATOM 29065 C11 PC 740 120.134 113.721 59.898 1.00 0.00 C ATOM 29066 O12 PC 740 120.168 113.294 61.061 1.00 0.00 O ATOM 29067 O11 PC 740 119.485 114.857 59.568 1.00 0.00 O ATOM 29068 C1 PC 740 118.844 115.706 60.596 1.00 0.00 C ATOM 29069 HR PC 740 118.230 115.141 61.302 1.00 0.00 H ATOM 29070 HS PC 740 118.144 116.380 60.095 1.00 0.00 H ATOM 29071 C2 PC 740 119.887 116.638 61.254 1.00 0.00 C ATOM 29072 HX PC 740 120.799 116.121 61.564 1.00 0.00 H ATOM 29073 C3 PC 740 119.262 117.289 62.458 1.00 0.00 C ATOM 29074 HA PC 740 118.809 116.515 63.082 1.00 0.00 H ATOM 29075 HB PC 740 118.678 118.201 62.316 1.00 0.00 H ATOM 29076 O31 PC 740 120.366 117.825 63.075 1.00 0.00 O ATOM 29077 P31 PC 740 120.341 118.462 64.471 1.00 0.00 P ATOM 29078 O32 PC 740 119.410 119.732 64.273 1.00 0.00 O ATOM 29079 C31 PC 740 118.760 120.339 65.384 1.00 0.00 C ATOM 29080 H1A PC 740 119.570 120.913 65.840 1.00 0.00 H ATOM 29081 H1B PC 740 118.271 119.567 65.983 1.00 0.00 H ATOM 29082 C32 PC 740 117.550 121.226 64.914 1.00 0.00 C ATOM 29083 H2A PC 740 117.077 121.666 65.794 1.00 0.00 H ATOM 29084 H2B PC 740 116.804 120.618 64.401 1.00 0.00 H ATOM 29085 N31 PC 740 117.930 122.392 64.062 1.00 0.00 N ATOM 29086 C33 PC 740 116.843 123.382 63.962 1.00 0.00 C ATOM 29087 H3A PC 740 115.988 122.962 63.431 1.00 0.00 H ATOM 29088 H3B PC 740 117.219 124.285 63.479 1.00 0.00 H ATOM 29089 H3C PC 740 116.573 123.410 65.019 1.00 0.00 H ATOM 29090 C34 PC 740 119.010 123.091 64.745 1.00 0.00 C ATOM 29091 H4A PC 740 118.806 123.288 65.798 1.00 0.00 H ATOM 29092 H4B PC 740 119.326 123.992 64.217 1.00 0.00 H ATOM 29093 H4C PC 740 119.840 122.383 64.774 1.00 0.00 H ATOM 29094 C35 PC 740 118.569 121.959 62.833 1.00 0.00 C ATOM 29095 H5A PC 740 119.455 121.336 62.964 1.00 0.00 H ATOM 29096 H5B PC 740 118.888 122.766 62.171 1.00 0.00 H ATOM 29097 H5C PC 740 117.934 121.280 62.262 1.00 0.00 H ATOM 29098 O33 PC 740 119.711 117.499 65.414 1.00 0.00 O ATOM 29099 O34 PC 740 121.670 118.977 64.839 1.00 0.00 O ATOM 29100 O21 PC 740 120.219 117.780 60.369 1.00 0.00 O ATOM 29101 C21 PC 740 121.183 117.703 59.405 1.00 0.00 C ATOM 29102 O22 PC 740 122.017 116.850 59.364 1.00 0.00 O ATOM 29103 C12 OL 741 120.925 118.792 58.327 1.00 0.00 C ATOM 29104 H2R OL 741 120.550 119.700 58.804 1.00 0.00 H ATOM 29105 H2S OL 741 121.819 119.171 57.828 1.00 0.00 H ATOM 29106 C13 OL 741 119.867 118.312 57.371 1.00 0.00 C ATOM 29107 H3R OL 741 119.996 117.263 57.094 1.00 0.00 H ATOM 29108 H3S OL 741 118.880 118.326 57.838 1.00 0.00 H ATOM 29109 C14 OL 741 119.931 119.186 56.084 1.00 0.00 C ATOM 29110 H4R OL 741 119.941 120.244 56.357 1.00 0.00 H ATOM 29111 H4S OL 741 120.827 119.104 55.466 1.00 0.00 H ATOM 29112 C15 OL 741 118.670 119.030 55.227 1.00 0.00 C ATOM 29113 H5R OL 741 118.742 118.006 54.856 1.00 0.00 H ATOM 29114 H5S OL 741 117.871 118.876 55.955 1.00 0.00 H ATOM 29115 C16 OL 741 118.431 120.067 54.213 1.00 0.00 C ATOM 29116 H6R OL 741 118.104 120.953 54.761 1.00 0.00 H ATOM 29117 H6S OL 741 119.361 120.300 53.691 1.00 0.00 H ATOM 29118 C17 OL 741 117.417 119.658 53.146 1.00 0.00 C ATOM 29119 H7R OL 741 116.634 119.133 53.697 1.00 0.00 H ATOM 29120 H7S OL 741 116.971 120.558 52.717 1.00 0.00 H ATOM 29121 C18 OL 741 118.035 118.804 52.096 1.00 0.00 C ATOM 29122 H8R OL 741 118.700 119.394 51.462 1.00 0.00 H ATOM 29123 H8S OL 741 118.674 117.987 52.435 1.00 0.00 H ATOM 29124 C19 OL 741 116.988 118.335 51.171 1.00 0.00 C ATOM 29125 H9R OL 741 116.287 119.122 50.903 1.00 0.00 H ATOM 29126 C110 OL 741 116.775 117.097 50.731 1.00 0.00 C ATOM 29127 H10R OL 741 115.959 116.844 50.059 1.00 0.00 H ATOM 29128 C111 OL 741 117.680 115.914 50.930 1.00 0.00 C ATOM 29129 H11R OL 741 118.092 115.977 51.940 1.00 0.00 H ATOM 29130 H11S OL 741 117.024 115.044 51.011 1.00 0.00 H ATOM 29131 C112 OL 741 118.637 115.572 49.756 1.00 0.00 C ATOM 29132 H12R OL 741 119.385 116.342 49.554 1.00 0.00 H ATOM 29133 H12S OL 741 119.237 114.731 50.110 1.00 0.00 H ATOM 29134 C113 OL 741 117.858 115.213 48.481 1.00 0.00 C ATOM 29135 H13R OL 741 117.254 114.320 48.654 1.00 0.00 H ATOM 29136 H13S OL 741 117.084 115.944 48.235 1.00 0.00 H ATOM 29137 C114 OL 741 118.855 115.029 47.308 1.00 0.00 C ATOM 29138 H14R OL 741 119.355 115.987 47.156 1.00 0.00 H ATOM 29139 H14S OL 741 119.612 114.343 47.693 1.00 0.00 H ATOM 29140 C115 OL 741 118.141 114.534 46.016 1.00 0.00 C ATOM 29141 H15R OL 741 118.816 114.433 45.162 1.00 0.00 H ATOM 29142 H15S OL 741 117.782 113.519 46.197 1.00 0.00 H ATOM 29143 C116 OL 741 116.989 115.486 45.695 1.00 0.00 C ATOM 29144 H16R OL 741 116.366 115.350 46.582 1.00 0.00 H ATOM 29145 H16S OL 741 117.439 116.473 45.571 1.00 0.00 H ATOM 29146 C117 OL 741 116.253 115.366 44.326 1.00 0.00 C ATOM 29147 H17R OL 741 115.291 115.852 44.154 1.00 0.00 H ATOM 29148 H17S OL 741 116.945 115.734 43.565 1.00 0.00 H ATOM 29149 C118 OL 741 115.885 113.901 43.902 1.00 0.00 C ATOM 29150 H18R OL 741 115.151 113.844 43.095 1.00 0.00 H ATOM 29151 H18S OL 741 115.394 113.320 44.685 1.00 0.00 H ATOM 29152 H18T OL 741 116.801 113.440 43.526 1.00 0.00 H TER 29153 OL 741 ATOM 29153 C116 PA 742 92.549 135.897 38.181 1.00 0.00 C ATOM 29154 H16R PA 742 91.852 135.900 37.341 1.00 0.00 H ATOM 29155 H16S PA 742 93.333 135.206 37.863 1.00 0.00 H ATOM 29156 H16T PA 742 93.053 136.865 38.221 1.00 0.00 H ATOM 29157 C115 PA 742 91.776 135.502 39.422 1.00 0.00 C ATOM 29158 H15R PA 742 92.462 135.238 40.229 1.00 0.00 H ATOM 29159 H15S PA 742 91.455 134.478 39.218 1.00 0.00 H ATOM 29160 C114 PA 742 90.497 136.320 39.689 1.00 0.00 C ATOM 29161 H14R PA 742 89.736 135.808 39.097 1.00 0.00 H ATOM 29162 H14S PA 742 90.555 137.343 39.311 1.00 0.00 H ATOM 29163 C113 PA 742 90.037 136.328 41.160 1.00 0.00 C ATOM 29164 H13R PA 742 89.177 136.981 41.323 1.00 0.00 H ATOM 29165 H13S PA 742 90.877 136.648 41.780 1.00 0.00 H ATOM 29166 C112 PA 742 89.558 134.930 41.620 1.00 0.00 C ATOM 29167 H12R PA 742 90.446 134.305 41.502 1.00 0.00 H ATOM 29168 H12S PA 742 88.772 134.631 40.924 1.00 0.00 H ATOM 29169 C111 PA 742 89.082 134.860 43.009 1.00 0.00 C ATOM 29170 H11R PA 742 88.499 135.706 43.380 1.00 0.00 H ATOM 29171 H11S PA 742 89.964 134.889 43.652 1.00 0.00 H ATOM 29172 C110 PA 742 88.319 133.579 43.350 1.00 0.00 C ATOM 29173 H10R PA 742 88.949 132.731 43.074 1.00 0.00 H ATOM 29174 H10S PA 742 87.450 133.351 42.728 1.00 0.00 H ATOM 29175 C19 PA 742 87.928 133.501 44.780 1.00 0.00 C ATOM 29176 H9R PA 742 87.459 134.435 45.099 1.00 0.00 H ATOM 29177 H9S PA 742 88.730 133.263 45.481 1.00 0.00 H ATOM 29178 C18 PA 742 86.860 132.427 45.126 1.00 0.00 C ATOM 29179 H8R PA 742 87.101 131.470 44.659 1.00 0.00 H ATOM 29180 H8S PA 742 85.908 132.683 44.657 1.00 0.00 H ATOM 29181 C17 PA 742 86.872 132.064 46.577 1.00 0.00 C ATOM 29182 H7R PA 742 86.909 133.019 47.106 1.00 0.00 H ATOM 29183 H7S PA 742 87.747 131.413 46.632 1.00 0.00 H ATOM 29184 C16 PA 742 85.779 131.124 47.037 1.00 0.00 C ATOM 29185 H6R PA 742 85.791 130.305 46.314 1.00 0.00 H ATOM 29186 H6S PA 742 84.785 131.572 46.984 1.00 0.00 H ATOM 29187 C15 PA 742 85.853 130.734 48.600 1.00 0.00 C ATOM 29188 H5R PA 742 86.850 130.366 48.856 1.00 0.00 H ATOM 29189 H5S PA 742 85.142 129.922 48.764 1.00 0.00 H ATOM 29190 C14 PA 742 85.607 132.008 49.515 1.00 0.00 C ATOM 29191 H4R PA 742 84.596 132.403 49.392 1.00 0.00 H ATOM 29192 H4S PA 742 86.171 132.861 49.132 1.00 0.00 H ATOM 29193 C13 PA 742 86.145 131.828 50.925 1.00 0.00 C ATOM 29194 H3R PA 742 86.161 132.791 51.440 1.00 0.00 H ATOM 29195 H3S PA 742 87.193 131.520 50.938 1.00 0.00 H ATOM 29196 C12 PA 742 85.217 130.858 51.666 1.00 0.00 C ATOM 29197 H2R PA 742 85.276 129.917 51.115 1.00 0.00 H ATOM 29198 H2S PA 742 84.229 131.321 51.624 1.00 0.00 H ATOM 29199 C11 PC 743 85.649 130.656 53.061 1.00 0.00 C ATOM 29200 O12 PC 743 86.443 129.807 53.427 1.00 0.00 O ATOM 29201 O11 PC 743 85.017 131.551 53.834 1.00 0.00 O ATOM 29202 C1 PC 743 85.203 131.422 55.273 1.00 0.00 C ATOM 29203 HR PC 743 85.375 130.389 55.585 1.00 0.00 H ATOM 29204 HS PC 743 84.320 131.799 55.796 1.00 0.00 H ATOM 29205 C2 PC 743 86.384 132.330 55.831 1.00 0.00 C ATOM 29206 HX PC 743 87.344 132.057 55.385 1.00 0.00 H ATOM 29207 C3 PC 743 86.531 132.186 57.354 1.00 0.00 C ATOM 29208 HA PC 743 85.673 131.598 57.689 1.00 0.00 H ATOM 29209 HB PC 743 86.457 133.158 57.847 1.00 0.00 H ATOM 29210 O31 PC 743 87.702 131.363 57.533 1.00 0.00 O ATOM 29211 P31 PC 743 88.143 130.850 58.930 1.00 0.00 P ATOM 29212 O32 PC 743 87.450 129.438 59.060 1.00 0.00 O ATOM 29213 C31 PC 743 87.752 128.406 58.136 1.00 0.00 C ATOM 29214 H1A PC 743 88.803 128.105 58.110 1.00 0.00 H ATOM 29215 H1B PC 743 87.401 128.658 57.132 1.00 0.00 H ATOM 29216 C32 PC 743 87.022 127.191 58.667 1.00 0.00 C ATOM 29217 H2A PC 743 87.187 126.394 57.940 1.00 0.00 H ATOM 29218 H2B PC 743 85.970 127.435 58.826 1.00 0.00 H ATOM 29219 N31 PC 743 87.458 126.612 60.001 1.00 0.00 N ATOM 29220 C33 PC 743 88.885 126.116 59.983 1.00 0.00 C ATOM 29221 H3A PC 743 88.998 125.286 59.285 1.00 0.00 H ATOM 29222 H3B PC 743 89.146 125.813 60.998 1.00 0.00 H ATOM 29223 H3C PC 743 89.528 126.926 59.636 1.00 0.00 H ATOM 29224 C34 PC 743 87.217 127.476 61.198 1.00 0.00 C ATOM 29225 H4A PC 743 86.187 127.835 61.215 1.00 0.00 H ATOM 29226 H4B PC 743 87.914 128.313 61.127 1.00 0.00 H ATOM 29227 H4C PC 743 87.496 126.833 62.033 1.00 0.00 H ATOM 29228 C35 PC 743 86.530 125.396 60.090 1.00 0.00 C ATOM 29229 H5A PC 743 85.515 125.795 60.132 1.00 0.00 H ATOM 29230 H5B PC 743 86.829 124.800 60.953 1.00 0.00 H ATOM 29231 H5C PC 743 86.721 124.823 59.181 1.00 0.00 H ATOM 29232 O33 PC 743 89.607 130.738 58.967 1.00 0.00 O ATOM 29233 O34 PC 743 87.562 131.728 59.949 1.00 0.00 O ATOM 29234 O21 PC 743 86.028 133.677 55.458 1.00 0.00 O ATOM 29235 C21 PC 743 87.060 134.407 54.929 1.00 0.00 C ATOM 29236 O22 PC 743 88.226 134.181 55.100 1.00 0.00 O ATOM 29237 C12 OL 744 86.604 135.709 54.331 1.00 0.00 C ATOM 29238 H2R OL 744 85.616 135.536 53.900 1.00 0.00 H ATOM 29239 H2S OL 744 86.539 136.384 55.187 1.00 0.00 H ATOM 29240 C13 OL 744 87.453 136.211 53.269 1.00 0.00 C ATOM 29241 H3R OL 744 87.002 137.190 53.096 1.00 0.00 H ATOM 29242 H3S OL 744 88.475 136.413 53.596 1.00 0.00 H ATOM 29243 C14 OL 744 87.458 135.475 51.942 1.00 0.00 C ATOM 29244 H4R OL 744 88.028 134.551 52.058 1.00 0.00 H ATOM 29245 H4S OL 744 86.504 134.966 51.790 1.00 0.00 H ATOM 29246 C15 OL 744 88.021 136.252 50.646 1.00 0.00 C ATOM 29247 H5R OL 744 87.610 137.250 50.478 1.00 0.00 H ATOM 29248 H5S OL 744 89.041 136.585 50.847 1.00 0.00 H ATOM 29249 C16 OL 744 88.161 135.324 49.353 1.00 0.00 C ATOM 29250 H6R OL 744 88.812 134.474 49.567 1.00 0.00 H ATOM 29251 H6S OL 744 87.227 134.801 49.138 1.00 0.00 H ATOM 29252 C17 OL 744 88.437 136.086 48.076 1.00 0.00 C ATOM 29253 H7R OL 744 88.191 135.305 47.353 1.00 0.00 H ATOM 29254 H7S OL 744 87.656 136.845 47.992 1.00 0.00 H ATOM 29255 C18 OL 744 89.855 136.693 48.038 1.00 0.00 C ATOM 29256 H8R OL 744 90.044 137.254 48.955 1.00 0.00 H ATOM 29257 H8S OL 744 90.597 135.895 47.964 1.00 0.00 H ATOM 29258 C19 OL 744 90.022 137.702 46.937 1.00 0.00 C ATOM 29259 H9R OL 744 89.426 138.609 46.997 1.00 0.00 H ATOM 29260 C110 OL 744 90.774 137.595 45.836 1.00 0.00 C ATOM 29261 H10R OL 744 90.789 138.412 45.119 1.00 0.00 H ATOM 29262 C111 OL 744 91.580 136.483 45.464 1.00 0.00 C ATOM 29263 H11R OL 744 91.270 135.503 45.833 1.00 0.00 H ATOM 29264 H11S OL 744 91.414 136.426 44.387 1.00 0.00 H ATOM 29265 C112 OL 744 93.067 136.757 45.630 1.00 0.00 C ATOM 29266 H12R OL 744 93.724 135.974 45.246 1.00 0.00 H ATOM 29267 H12S OL 744 93.334 137.591 44.978 1.00 0.00 H ATOM 29268 C113 OL 744 93.584 136.739 47.039 1.00 0.00 C ATOM 29269 H13R OL 744 94.589 137.167 47.040 1.00 0.00 H ATOM 29270 H13S OL 744 93.166 137.549 47.641 1.00 0.00 H ATOM 29271 C114 OL 744 93.589 135.418 47.788 1.00 0.00 C ATOM 29272 H14R OL 744 94.128 135.693 48.697 1.00 0.00 H ATOM 29273 H14S OL 744 92.624 135.044 48.137 1.00 0.00 H ATOM 29274 C115 OL 744 94.358 134.223 47.140 1.00 0.00 C ATOM 29275 H15R OL 744 93.960 133.774 46.227 1.00 0.00 H ATOM 29276 H15S OL 744 95.369 134.598 46.970 1.00 0.00 H ATOM 29277 C116 OL 744 94.232 133.015 48.057 1.00 0.00 C ATOM 29278 H16R OL 744 93.232 132.587 48.158 1.00 0.00 H ATOM 29279 H16S OL 744 94.889 132.249 47.640 1.00 0.00 H ATOM 29280 C117 OL 744 94.609 133.303 49.506 1.00 0.00 C ATOM 29281 H17R OL 744 95.528 133.892 49.484 1.00 0.00 H ATOM 29282 H17S OL 744 93.805 133.898 49.945 1.00 0.00 H ATOM 29283 C118 OL 744 94.911 132.163 50.450 1.00 0.00 C ATOM 29284 H18R OL 744 95.804 131.635 50.110 1.00 0.00 H ATOM 29285 H18S OL 744 94.049 131.494 50.401 1.00 0.00 H ATOM 29286 H18T OL 744 95.199 132.553 51.429 1.00 0.00 H TER 29287 OL 744 ATOM 29287 C116 PA 745 131.949 96.037 44.976 1.00 0.00 C ATOM 29288 H16R PA 745 132.511 96.942 45.217 1.00 0.00 H ATOM 29289 H16S PA 745 131.056 96.127 45.598 1.00 0.00 H ATOM 29290 H16T PA 745 131.753 95.964 43.904 1.00 0.00 H ATOM 29291 C115 PA 745 132.673 94.721 45.499 1.00 0.00 C ATOM 29292 H15R PA 745 131.997 93.870 45.394 1.00 0.00 H ATOM 29293 H15S PA 745 132.847 94.796 46.574 1.00 0.00 H ATOM 29294 C114 PA 745 133.986 94.461 44.817 1.00 0.00 C ATOM 29295 H14R PA 745 134.709 95.278 44.810 1.00 0.00 H ATOM 29296 H14S PA 745 133.828 94.240 43.759 1.00 0.00 H ATOM 29297 C113 PA 745 134.700 93.249 45.345 1.00 0.00 C ATOM 29298 H13R PA 745 134.046 92.375 45.297 1.00 0.00 H ATOM 29299 H13S PA 745 134.906 93.417 46.404 1.00 0.00 H ATOM 29300 C112 PA 745 136.061 92.909 44.676 1.00 0.00 C ATOM 29301 H12R PA 745 136.643 93.821 44.527 1.00 0.00 H ATOM 29302 H12S PA 745 135.774 92.560 43.682 1.00 0.00 H ATOM 29303 C111 PA 745 137.034 91.977 45.356 1.00 0.00 C ATOM 29304 H11R PA 745 137.402 91.335 44.553 1.00 0.00 H ATOM 29305 H11S PA 745 136.410 91.289 45.931 1.00 0.00 H ATOM 29306 C110 PA 745 138.224 92.699 46.052 1.00 0.00 C ATOM 29307 H10R PA 745 137.784 93.480 46.676 1.00 0.00 H ATOM 29308 H10S PA 745 138.801 93.137 45.235 1.00 0.00 H ATOM 29309 C19 PA 745 139.074 91.775 46.841 1.00 0.00 C ATOM 29310 H9R PA 745 139.520 91.096 46.111 1.00 0.00 H ATOM 29311 H9S PA 745 138.483 91.128 47.493 1.00 0.00 H ATOM 29312 C18 PA 745 140.178 92.555 47.557 1.00 0.00 C ATOM 29313 H8R PA 745 139.683 93.134 48.340 1.00 0.00 H ATOM 29314 H8S PA 745 140.669 93.237 46.860 1.00 0.00 H ATOM 29315 C17 PA 745 141.156 91.559 48.240 1.00 0.00 C ATOM 29316 H7R PA 745 142.100 92.039 48.506 1.00 0.00 H ATOM 29317 H7S PA 745 141.522 90.859 47.485 1.00 0.00 H ATOM 29318 C16 PA 745 140.727 90.795 49.459 1.00 0.00 C ATOM 29319 H6R PA 745 141.505 90.339 50.076 1.00 0.00 H ATOM 29320 H6S PA 745 140.177 89.942 49.056 1.00 0.00 H ATOM 29321 C15 PA 745 139.987 91.605 50.532 1.00 0.00 C ATOM 29322 H5R PA 745 139.092 92.000 50.046 1.00 0.00 H ATOM 29323 H5S PA 745 140.560 92.482 50.840 1.00 0.00 H ATOM 29324 C14 PA 745 139.624 90.812 51.811 1.00 0.00 C ATOM 29325 H4R PA 745 139.217 89.870 51.436 1.00 0.00 H ATOM 29326 H4S PA 745 138.902 91.353 52.426 1.00 0.00 H ATOM 29327 C13 PA 745 140.801 90.593 52.784 1.00 0.00 C ATOM 29328 H3R PA 745 141.246 91.554 53.051 1.00 0.00 H ATOM 29329 H3S PA 745 141.559 89.885 52.441 1.00 0.00 H ATOM 29330 C12 PA 745 140.208 89.880 54.024 1.00 0.00 C ATOM 29331 H2R PA 745 139.820 88.944 53.618 1.00 0.00 H ATOM 29332 H2S PA 745 139.432 90.450 54.540 1.00 0.00 H ATOM 29333 C11 PGR 746 141.235 89.489 55.096 1.00 0.00 C ATOM 29334 O12 PGR 746 141.018 88.766 56.033 1.00 0.00 O ATOM 29335 O11 PGR 746 142.437 90.165 54.951 1.00 0.00 O ATOM 29336 C1 PGR 746 143.479 90.273 55.966 1.00 0.00 C ATOM 29337 HR PGR 746 143.056 90.513 56.945 1.00 0.00 H ATOM 29338 HS PGR 746 144.238 91.023 55.729 1.00 0.00 H ATOM 29339 C2 PGR 746 144.176 88.922 55.998 1.00 0.00 C ATOM 29340 HX PGR 746 143.475 88.133 55.713 1.00 0.00 H ATOM 29341 C3 PGR 746 144.819 88.679 57.355 1.00 0.00 C ATOM 29342 HA PGR 746 145.446 87.786 57.298 1.00 0.00 H ATOM 29343 HB PGR 746 143.997 88.383 58.011 1.00 0.00 H ATOM 29344 O31 PGR 746 145.532 89.859 57.787 1.00 0.00 O ATOM 29345 P31 PGR 746 146.264 89.901 59.212 1.00 0.00 P ATOM 29346 O32 PGR 746 145.082 89.848 60.301 1.00 0.00 O ATOM 29347 C31 PGR 746 144.006 90.776 60.401 1.00 0.00 C ATOM 29348 H1A PGR 746 143.088 90.304 60.760 1.00 0.00 H ATOM 29349 H1B PGR 746 143.776 91.288 59.463 1.00 0.00 H ATOM 29350 C32 PGR 746 144.307 91.883 61.403 1.00 0.00 C ATOM 29351 H2A PGR 746 143.526 92.564 61.751 1.00 0.00 H ATOM 29352 O35 PGR 746 145.374 92.688 60.840 1.00 0.00 O ATOM 29353 HO5A PGR 746 146.052 92.044 60.569 1.00 0.00 H ATOM 29354 C33 PGR 746 144.775 91.283 62.728 1.00 0.00 C ATOM 29355 H3A PGR 746 144.806 92.019 63.536 1.00 0.00 H ATOM 29356 H3B PGR 746 144.200 90.435 63.109 1.00 0.00 H ATOM 29357 O33 PGR 746 147.082 88.677 59.302 1.00 0.00 O ATOM 29358 O34 PGR 746 146.889 91.243 59.349 1.00 0.00 O ATOM 29359 O21 PGR 746 145.190 88.888 54.999 1.00 0.00 O ATOM 29360 C21 PGR 746 145.682 87.666 54.618 1.00 0.00 C ATOM 29361 O22 PGR 746 145.171 86.587 54.942 1.00 0.00 O ATOM 29362 O36 PGR 746 146.090 90.829 62.511 1.00 0.00 O ATOM 29363 HO6A PGR 746 146.214 90.066 63.103 1.00 0.00 H ATOM 29364 C12 OL 747 146.916 87.758 53.843 1.00 0.00 C ATOM 29365 H2R OL 747 146.528 87.891 52.831 1.00 0.00 H ATOM 29366 H2S OL 747 147.558 88.607 54.084 1.00 0.00 H ATOM 29367 C13 OL 747 147.570 86.361 53.578 1.00 0.00 C ATOM 29368 H3R OL 747 148.137 86.002 54.440 1.00 0.00 H ATOM 29369 H3S OL 747 146.769 85.669 53.311 1.00 0.00 H ATOM 29370 C14 OL 747 148.476 86.329 52.370 1.00 0.00 C ATOM 29371 H4R OL 747 147.990 86.871 51.557 1.00 0.00 H ATOM 29372 H4S OL 747 149.376 86.925 52.531 1.00 0.00 H ATOM 29373 C15 OL 747 148.942 84.926 51.929 1.00 0.00 C ATOM 29374 H5R OL 747 149.831 84.555 52.443 1.00 0.00 H ATOM 29375 H5S OL 747 148.267 84.135 52.263 1.00 0.00 H ATOM 29376 C16 OL 747 149.099 84.932 50.378 1.00 0.00 C ATOM 29377 H6R OL 747 148.201 85.391 49.959 1.00 0.00 H ATOM 29378 H6S OL 747 149.970 85.504 50.052 1.00 0.00 H ATOM 29379 C17 OL 747 149.252 83.479 49.868 1.00 0.00 C ATOM 29380 H7R OL 747 149.990 83.042 50.544 1.00 0.00 H ATOM 29381 H7S OL 747 148.303 82.946 49.953 1.00 0.00 H ATOM 29382 C18 OL 747 149.803 83.318 48.439 1.00 0.00 C ATOM 29383 H8R OL 747 150.637 83.999 48.255 1.00 0.00 H ATOM 29384 H8S OL 747 150.328 82.362 48.372 1.00 0.00 H ATOM 29385 C19 OL 747 148.810 83.466 47.371 1.00 0.00 C ATOM 29386 H9R OL 747 148.286 84.413 47.470 1.00 0.00 H ATOM 29387 C110 OL 747 148.713 82.598 46.319 1.00 0.00 C ATOM 29388 H10R OL 747 147.995 82.850 45.543 1.00 0.00 H ATOM 29389 C111 OL 747 149.423 81.353 46.080 1.00 0.00 C ATOM 29390 H11R OL 747 149.998 81.487 45.161 1.00 0.00 H ATOM 29391 H11S OL 747 150.141 81.098 46.862 1.00 0.00 H ATOM 29392 C112 OL 747 148.431 80.247 45.606 1.00 0.00 C ATOM 29393 H12R OL 747 147.652 80.074 46.351 1.00 0.00 H ATOM 29394 H12S OL 747 148.029 80.529 44.631 1.00 0.00 H ATOM 29395 C113 OL 747 149.008 78.874 45.297 1.00 0.00 C ATOM 29396 H13R OL 747 149.705 78.898 44.457 1.00 0.00 H ATOM 29397 H13S OL 747 149.673 78.611 46.122 1.00 0.00 H ATOM 29398 C114 OL 747 147.980 77.825 44.855 1.00 0.00 C ATOM 29399 H14R OL 747 147.446 77.639 45.789 1.00 0.00 H ATOM 29400 H14S OL 747 147.335 78.312 44.121 1.00 0.00 H ATOM 29401 C115 OL 747 148.416 76.474 44.413 1.00 0.00 C ATOM 29402 H15R OL 747 147.582 75.776 44.515 1.00 0.00 H ATOM 29403 H15S OL 747 148.721 76.480 43.365 1.00 0.00 H ATOM 29404 C116 OL 747 149.454 75.882 45.276 1.00 0.00 C ATOM 29405 H16R OL 747 150.351 76.493 45.399 1.00 0.00 H ATOM 29406 H16S OL 747 149.138 75.708 46.307 1.00 0.00 H ATOM 29407 C117 OL 747 150.131 74.678 44.774 1.00 0.00 C ATOM 29408 H17R OL 747 150.474 74.198 45.693 1.00 0.00 H ATOM 29409 H17S OL 747 149.363 73.956 44.490 1.00 0.00 H ATOM 29410 C118 OL 747 151.240 74.993 43.748 1.00 0.00 C ATOM 29411 H18R OL 747 150.911 75.628 42.923 1.00 0.00 H ATOM 29412 H18S OL 747 151.676 74.135 43.233 1.00 0.00 H ATOM 29413 H18T OL 747 152.101 75.465 44.226 1.00 0.00 H TER 29414 OL 747 ATOM 29414 C116 PA 748 41.888 1.936 35.373 1.00 0.00 C ATOM 29415 H16R PA 748 41.414 1.071 34.904 1.00 0.00 H ATOM 29416 H16S PA 748 42.882 2.102 34.954 1.00 0.00 H ATOM 29417 H16T PA 748 41.270 2.831 35.280 1.00 0.00 H ATOM 29418 C115 PA 748 42.108 1.613 36.820 1.00 0.00 C ATOM 29419 H15R PA 748 41.172 1.273 37.268 1.00 0.00 H ATOM 29420 H15S PA 748 42.391 2.535 37.332 1.00 0.00 H ATOM 29421 C114 PA 748 43.055 0.428 37.023 1.00 0.00 C ATOM 29422 H14R PA 748 43.990 0.894 36.707 1.00 0.00 H ATOM 29423 H14S PA 748 42.796 -0.403 36.363 1.00 0.00 H ATOM 29424 C113 PA 748 43.215 -0.051 38.482 1.00 0.00 C ATOM 29425 H13R PA 748 43.830 -0.950 38.565 1.00 0.00 H ATOM 29426 H13S PA 748 42.213 -0.350 38.797 1.00 0.00 H ATOM 29427 C112 PA 748 43.658 0.995 39.395 1.00 0.00 C ATOM 29428 H12R PA 748 42.872 1.746 39.493 1.00 0.00 H ATOM 29429 H12S PA 748 44.508 1.467 38.897 1.00 0.00 H ATOM 29430 C111 PA 748 44.178 0.553 40.758 1.00 0.00 C ATOM 29431 H11R PA 748 44.419 1.475 41.292 1.00 0.00 H ATOM 29432 H11S PA 748 45.095 -0.038 40.715 1.00 0.00 H ATOM 29433 C110 PA 748 43.246 -0.287 41.585 1.00 0.00 C ATOM 29434 H10R PA 748 43.382 -1.340 41.334 1.00 0.00 H ATOM 29435 H10S PA 748 42.248 -0.001 41.247 1.00 0.00 H ATOM 29436 C19 PA 748 43.492 -0.273 43.037 1.00 0.00 C ATOM 29437 H9R PA 748 44.440 -0.792 43.191 1.00 0.00 H ATOM 29438 H9S PA 748 42.641 -0.776 43.500 1.00 0.00 H ATOM 29439 C18 PA 748 43.615 1.080 43.733 1.00 0.00 C ATOM 29440 H8R PA 748 42.662 1.594 43.592 1.00 0.00 H ATOM 29441 H8S PA 748 44.497 1.617 43.380 1.00 0.00 H ATOM 29442 C17 PA 748 43.627 0.960 45.298 1.00 0.00 C ATOM 29443 H7R PA 748 42.735 0.431 45.639 1.00 0.00 H ATOM 29444 H7S PA 748 43.610 1.969 45.715 1.00 0.00 H ATOM 29445 C16 PA 748 44.862 0.117 45.707 1.00 0.00 C ATOM 29446 H6R PA 748 45.813 0.629 45.546 1.00 0.00 H ATOM 29447 H6S PA 748 44.892 -0.804 45.121 1.00 0.00 H ATOM 29448 C15 PA 748 44.764 -0.316 47.150 1.00 0.00 C ATOM 29449 H5R PA 748 43.912 0.212 47.584 1.00 0.00 H ATOM 29450 H5S PA 748 45.644 0.044 47.687 1.00 0.00 H ATOM 29451 C14 PA 748 44.749 -1.763 47.291 1.00 0.00 C ATOM 29452 H4R PA 748 45.675 -2.188 46.899 1.00 0.00 H ATOM 29453 H4S PA 748 43.867 -2.135 46.767 1.00 0.00 H ATOM 29454 C13 PA 748 44.617 -2.245 48.742 1.00 0.00 C ATOM 29455 H3R PA 748 44.403 -3.315 48.710 1.00 0.00 H ATOM 29456 H3S PA 748 43.852 -1.632 49.224 1.00 0.00 H ATOM 29457 C12 PA 748 45.898 -2.277 49.636 1.00 0.00 C ATOM 29458 H2R PA 748 46.271 -1.254 49.558 1.00 0.00 H ATOM 29459 H2S PA 748 46.717 -2.928 49.323 1.00 0.00 H ATOM 29460 C11 PC 749 45.534 -2.495 51.095 1.00 0.00 C ATOM 29461 O12 PC 749 44.666 -3.263 51.495 1.00 0.00 O ATOM 29462 O11 PC 749 46.383 -1.794 51.846 1.00 0.00 O ATOM 29463 C1 PC 749 46.226 -1.769 53.291 1.00 0.00 C ATOM 29464 HR PC 749 46.344 -2.711 53.833 1.00 0.00 H ATOM 29465 HS PC 749 45.238 -1.408 53.589 1.00 0.00 H ATOM 29466 C2 PC 749 47.411 -0.794 53.871 1.00 0.00 C ATOM 29467 HX PC 749 48.341 -1.361 53.778 1.00 0.00 H ATOM 29468 C3 PC 749 47.209 -0.523 55.372 1.00 0.00 C ATOM 29469 HA PC 749 48.003 0.144 55.717 1.00 0.00 H ATOM 29470 HB PC 749 47.197 -1.499 55.864 1.00 0.00 H ATOM 29471 O31 PC 749 45.953 0.161 55.505 1.00 0.00 O ATOM 29472 P31 PC 749 45.094 -0.020 56.787 1.00 0.00 P ATOM 29473 O32 PC 749 44.350 -1.394 56.561 1.00 0.00 O ATOM 29474 C31 PC 749 44.376 -2.370 57.532 1.00 0.00 C ATOM 29475 H1A PC 749 44.034 -1.929 58.472 1.00 0.00 H ATOM 29476 H1B PC 749 45.414 -2.672 57.697 1.00 0.00 H ATOM 29477 C32 PC 749 43.530 -3.551 56.923 1.00 0.00 C ATOM 29478 H2A PC 749 43.788 -3.812 55.895 1.00 0.00 H ATOM 29479 H2B PC 749 42.492 -3.224 57.004 1.00 0.00 H ATOM 29480 N31 PC 749 43.673 -4.843 57.620 1.00 0.00 N ATOM 29481 C33 PC 749 42.689 -5.777 56.883 1.00 0.00 C ATOM 29482 H3A PC 749 42.628 -6.685 57.484 1.00 0.00 H ATOM 29483 H3B PC 749 43.157 -6.092 55.949 1.00 0.00 H ATOM 29484 H3C PC 749 41.726 -5.301 56.695 1.00 0.00 H ATOM 29485 C34 PC 749 45.012 -5.454 57.503 1.00 0.00 C ATOM 29486 H4A PC 749 45.819 -4.737 57.667 1.00 0.00 H ATOM 29487 H4B PC 749 45.067 -5.875 56.499 1.00 0.00 H ATOM 29488 H4C PC 749 45.160 -6.293 58.185 1.00 0.00 H ATOM 29489 C35 PC 749 43.348 -4.818 59.021 1.00 0.00 C ATOM 29490 H5A PC 749 43.329 -5.795 59.506 1.00 0.00 H ATOM 29491 H5B PC 749 42.324 -4.456 59.116 1.00 0.00 H ATOM 29492 H5C PC 749 44.055 -4.150 59.515 1.00 0.00 H ATOM 29493 O33 PC 749 46.038 -0.106 57.911 1.00 0.00 O ATOM 29494 O34 PC 749 44.017 0.938 56.847 1.00 0.00 O ATOM 29495 O21 PC 749 47.503 0.396 52.997 1.00 0.00 O ATOM 29496 C21 PC 749 48.364 0.311 51.905 1.00 0.00 C ATOM 29497 O22 PC 749 48.640 -0.761 51.292 1.00 0.00 O ATOM 29498 C12 OL 750 48.784 1.677 51.393 1.00 0.00 C ATOM 29499 H2R OL 750 49.052 2.386 52.179 1.00 0.00 H ATOM 29500 H2S OL 750 49.726 1.584 50.848 1.00 0.00 H ATOM 29501 C13 OL 750 47.812 2.395 50.459 1.00 0.00 C ATOM 29502 H3R OL 750 46.928 2.667 51.040 1.00 0.00 H ATOM 29503 H3S OL 750 48.265 3.349 50.181 1.00 0.00 H ATOM 29504 C14 OL 750 47.263 1.838 49.134 1.00 0.00 C ATOM 29505 H4R OL 750 48.085 1.330 48.625 1.00 0.00 H ATOM 29506 H4S OL 750 46.448 1.120 49.246 1.00 0.00 H ATOM 29507 C15 OL 750 46.763 2.913 48.163 1.00 0.00 C ATOM 29508 H5R OL 750 46.159 2.575 47.318 1.00 0.00 H ATOM 29509 H5S OL 750 46.076 3.583 48.684 1.00 0.00 H ATOM 29510 C16 OL 750 47.787 3.675 47.483 1.00 0.00 C ATOM 29511 H6R OL 750 48.499 4.156 48.157 1.00 0.00 H ATOM 29512 H6S OL 750 48.430 2.977 46.943 1.00 0.00 H ATOM 29513 C17 OL 750 47.169 4.694 46.508 1.00 0.00 C ATOM 29514 H7R OL 750 46.683 4.147 45.697 1.00 0.00 H ATOM 29515 H7S OL 750 46.327 5.218 46.966 1.00 0.00 H ATOM 29516 C18 OL 750 48.129 5.651 45.887 1.00 0.00 C ATOM 29517 H8R OL 750 48.213 6.486 46.585 1.00 0.00 H ATOM 29518 H8S OL 750 49.109 5.182 45.994 1.00 0.00 H ATOM 29519 C19 OL 750 47.794 6.046 44.424 1.00 0.00 C ATOM 29520 H9R OL 750 46.781 6.379 44.215 1.00 0.00 H ATOM 29521 C110 OL 750 48.697 6.083 43.478 1.00 0.00 C ATOM 29522 H10R OL 750 48.410 6.404 42.480 1.00 0.00 H ATOM 29523 C111 OL 750 50.110 5.796 43.556 1.00 0.00 C ATOM 29524 H11R OL 750 50.208 4.966 44.260 1.00 0.00 H ATOM 29525 H11S OL 750 50.392 5.410 42.574 1.00 0.00 H ATOM 29526 C112 OL 750 50.972 7.005 44.000 1.00 0.00 C ATOM 29527 H12R OL 750 50.608 7.310 44.983 1.00 0.00 H ATOM 29528 H12S OL 750 52.043 6.791 44.023 1.00 0.00 H ATOM 29529 C113 OL 750 50.662 8.199 43.075 1.00 0.00 C ATOM 29530 H13R OL 750 50.814 7.901 42.036 1.00 0.00 H ATOM 29531 H13S OL 750 49.600 8.450 43.035 1.00 0.00 H ATOM 29532 C114 OL 750 51.566 9.416 43.250 1.00 0.00 C ATOM 29533 H14R OL 750 51.306 10.002 42.366 1.00 0.00 H ATOM 29534 H14S OL 750 51.306 9.900 44.194 1.00 0.00 H ATOM 29535 C115 OL 750 53.086 9.247 43.191 1.00 0.00 C ATOM 29536 H15R OL 750 53.570 10.183 43.480 1.00 0.00 H ATOM 29537 H15S OL 750 53.413 8.479 43.896 1.00 0.00 H ATOM 29538 C116 OL 750 53.634 9.082 41.804 1.00 0.00 C ATOM 29539 H16R OL 750 52.891 8.844 41.040 1.00 0.00 H ATOM 29540 H16S OL 750 54.122 10.038 41.606 1.00 0.00 H ATOM 29541 C117 OL 750 54.682 7.977 41.791 1.00 0.00 C ATOM 29542 H17R OL 750 55.597 8.097 42.375 1.00 0.00 H ATOM 29543 H17S OL 750 54.245 7.002 42.015 1.00 0.00 H ATOM 29544 C118 OL 750 55.339 7.910 40.457 1.00 0.00 C ATOM 29545 H18R OL 750 56.189 7.224 40.453 1.00 0.00 H ATOM 29546 H18S OL 750 55.791 8.859 40.160 1.00 0.00 H ATOM 29547 H18T OL 750 54.599 7.557 39.735 1.00 0.00 H TER 29548 OL 750 ATOM 29548 C116 PA 751 9.477 27.927 39.072 1.00 0.00 C ATOM 29549 H16R PA 751 9.052 28.932 39.041 1.00 0.00 H ATOM 29550 H16S PA 751 9.282 27.584 38.054 1.00 0.00 H ATOM 29551 H16T PA 751 10.540 28.007 39.309 1.00 0.00 H ATOM 29552 C115 PA 751 8.802 27.162 40.177 1.00 0.00 C ATOM 29553 H15R PA 751 7.731 27.256 39.990 1.00 0.00 H ATOM 29554 H15S PA 751 8.997 27.646 41.137 1.00 0.00 H ATOM 29555 C114 PA 751 9.129 25.645 40.225 1.00 0.00 C ATOM 29556 H14R PA 751 10.171 25.373 40.041 1.00 0.00 H ATOM 29557 H14S PA 751 8.547 25.109 39.473 1.00 0.00 H ATOM 29558 C113 PA 751 8.745 25.106 41.597 1.00 0.00 C ATOM 29559 H13R PA 751 9.319 25.805 42.210 1.00 0.00 H ATOM 29560 H13S PA 751 8.996 24.052 41.736 1.00 0.00 H ATOM 29561 C112 PA 751 7.221 25.043 42.002 1.00 0.00 C ATOM 29562 H12R PA 751 6.639 24.307 41.443 1.00 0.00 H ATOM 29563 H12S PA 751 6.723 25.974 41.722 1.00 0.00 H ATOM 29564 C111 PA 751 7.002 24.654 43.484 1.00 0.00 C ATOM 29565 H11R PA 751 5.945 24.474 43.693 1.00 0.00 H ATOM 29566 H11S PA 751 7.383 25.514 44.038 1.00 0.00 H ATOM 29567 C110 PA 751 7.709 23.461 44.126 1.00 0.00 C ATOM 29568 H10R PA 751 8.789 23.593 44.025 1.00 0.00 H ATOM 29569 H10S PA 751 7.497 22.566 43.537 1.00 0.00 H ATOM 29570 C19 PA 751 7.490 23.284 45.562 1.00 0.00 C ATOM 29571 H9R PA 751 6.573 23.828 45.794 1.00 0.00 H ATOM 29572 H9S PA 751 8.298 23.872 46.003 1.00 0.00 H ATOM 29573 C18 PA 751 7.458 21.860 46.032 1.00 0.00 C ATOM 29574 H8R PA 751 8.465 21.540 45.758 1.00 0.00 H ATOM 29575 H8S PA 751 6.683 21.187 45.660 1.00 0.00 H ATOM 29576 C17 PA 751 7.315 21.850 47.594 1.00 0.00 C ATOM 29577 H7R PA 751 6.292 22.220 47.690 1.00 0.00 H ATOM 29578 H7S PA 751 7.949 22.658 47.965 1.00 0.00 H ATOM 29579 C16 PA 751 7.486 20.449 48.116 1.00 0.00 C ATOM 29580 H6R PA 751 8.487 20.092 47.863 1.00 0.00 H ATOM 29581 H6S PA 751 6.752 19.754 47.703 1.00 0.00 H ATOM 29582 C15 PA 751 7.403 20.347 49.680 1.00 0.00 C ATOM 29583 H5R PA 751 6.386 20.662 49.922 1.00 0.00 H ATOM 29584 H5S PA 751 8.055 21.026 50.233 1.00 0.00 H ATOM 29585 C14 PA 751 7.804 18.939 50.187 1.00 0.00 C ATOM 29586 H4R PA 751 8.076 19.083 51.235 1.00 0.00 H ATOM 29587 H4S PA 751 8.819 18.698 49.866 1.00 0.00 H ATOM 29588 C13 PA 751 6.615 17.975 49.901 1.00 0.00 C ATOM 29589 H3R PA 751 6.576 17.611 48.872 1.00 0.00 H ATOM 29590 H3S PA 751 5.725 18.607 49.937 1.00 0.00 H ATOM 29591 C12 PA 751 6.430 16.924 50.954 1.00 0.00 C ATOM 29592 H2R PA 751 7.335 16.314 50.930 1.00 0.00 H ATOM 29593 H2S PA 751 5.610 16.232 50.748 1.00 0.00 H ATOM 29594 C11 PC 752 6.199 17.611 52.317 1.00 0.00 C ATOM 29595 O12 PC 752 7.064 17.623 53.188 1.00 0.00 O ATOM 29596 O11 PC 752 5.018 18.264 52.290 1.00 0.00 O ATOM 29597 C1 PC 752 4.599 19.098 53.435 1.00 0.00 C ATOM 29598 HR PC 752 4.683 18.510 54.353 1.00 0.00 H ATOM 29599 HS PC 752 3.572 19.462 53.358 1.00 0.00 H ATOM 29600 C2 PC 752 5.495 20.353 53.591 1.00 0.00 C ATOM 29601 HX PC 752 6.526 20.003 53.680 1.00 0.00 H ATOM 29602 C3 PC 752 5.101 21.224 54.821 1.00 0.00 C ATOM 29603 HA PC 752 5.920 21.926 54.994 1.00 0.00 H ATOM 29604 HB PC 752 4.961 20.550 55.670 1.00 0.00 H ATOM 29605 O31 PC 752 3.865 21.869 54.646 1.00 0.00 O ATOM 29606 P31 PC 752 3.286 22.912 55.659 1.00 0.00 P ATOM 29607 O32 PC 752 1.761 22.818 55.327 1.00 0.00 O ATOM 29608 C31 PC 752 1.069 21.633 55.531 1.00 0.00 C ATOM 29609 H1A PC 752 1.741 21.012 56.129 1.00 0.00 H ATOM 29610 H1B PC 752 0.841 21.218 54.546 1.00 0.00 H ATOM 29611 C32 PC 752 -0.310 21.966 56.175 1.00 0.00 C ATOM 29612 H2A PC 752 -0.906 22.555 55.476 1.00 0.00 H ATOM 29613 H2B PC 752 -0.066 22.608 57.022 1.00 0.00 H ATOM 29614 N31 PC 752 -1.045 20.806 56.741 1.00 0.00 N ATOM 29615 C33 PC 752 -1.085 19.639 55.848 1.00 0.00 C ATOM 29616 H3A PC 752 -0.075 19.297 55.615 1.00 0.00 H ATOM 29617 H3B PC 752 -1.634 20.017 54.984 1.00 0.00 H ATOM 29618 H3C PC 752 -1.649 18.810 56.277 1.00 0.00 H ATOM 29619 C34 PC 752 -0.377 20.410 58.011 1.00 0.00 C ATOM 29620 H4A PC 752 -0.822 19.453 58.290 1.00 0.00 H ATOM 29621 H4B PC 752 -0.537 21.165 58.782 1.00 0.00 H ATOM 29622 H4C PC 752 0.689 20.353 57.784 1.00 0.00 H ATOM 29623 C35 PC 752 -2.452 21.165 57.064 1.00 0.00 C ATOM 29624 H5A PC 752 -2.953 20.405 57.666 1.00 0.00 H ATOM 29625 H5B PC 752 -3.008 21.177 56.125 1.00 0.00 H ATOM 29626 H5C PC 752 -2.472 22.130 57.573 1.00 0.00 H ATOM 29627 O33 PC 752 3.563 22.434 57.056 1.00 0.00 O ATOM 29628 O34 PC 752 3.761 24.235 55.278 1.00 0.00 O ATOM 29629 O21 PC 752 5.486 21.179 52.408 1.00 0.00 O ATOM 29630 C21 PC 752 6.366 22.169 52.037 1.00 0.00 C ATOM 29631 O22 PC 752 7.413 22.383 52.612 1.00 0.00 O ATOM 29632 C12 OL 753 5.745 22.881 50.865 1.00 0.00 C ATOM 29633 H2R OL 753 6.423 22.809 50.012 1.00 0.00 H ATOM 29634 H2S OL 753 4.806 22.368 50.649 1.00 0.00 H ATOM 29635 C13 OL 753 5.519 24.395 51.111 1.00 0.00 C ATOM 29636 H3R OL 753 4.842 24.387 51.968 1.00 0.00 H ATOM 29637 H3S OL 753 6.567 24.645 51.289 1.00 0.00 H ATOM 29638 C14 OL 753 4.753 25.113 49.942 1.00 0.00 C ATOM 29639 H4R OL 753 3.700 24.872 50.106 1.00 0.00 H ATOM 29640 H4S OL 753 4.734 26.190 50.126 1.00 0.00 H ATOM 29641 C15 OL 753 5.278 24.888 48.469 1.00 0.00 C ATOM 29642 H5R OL 753 6.367 24.822 48.427 1.00 0.00 H ATOM 29643 H5S OL 753 4.836 24.023 47.970 1.00 0.00 H ATOM 29644 C16 OL 753 4.961 26.073 47.548 1.00 0.00 C ATOM 29645 H6R OL 753 5.441 26.948 47.991 1.00 0.00 H ATOM 29646 H6S OL 753 5.385 26.030 46.543 1.00 0.00 H ATOM 29647 C17 OL 753 3.455 26.323 47.404 1.00 0.00 C ATOM 29648 H7R OL 753 2.910 26.406 48.347 1.00 0.00 H ATOM 29649 H7S OL 753 3.335 27.333 47.007 1.00 0.00 H ATOM 29650 C18 OL 753 2.659 25.339 46.617 1.00 0.00 C ATOM 29651 H8R OL 753 3.133 25.130 45.655 1.00 0.00 H ATOM 29652 H8S OL 753 2.568 24.405 47.175 1.00 0.00 H ATOM 29653 C19 OL 753 1.362 26.010 46.375 1.00 0.00 C ATOM 29654 H9R OL 753 1.426 26.805 45.636 1.00 0.00 H ATOM 29655 C110 OL 753 0.199 25.942 47.051 1.00 0.00 C ATOM 29656 H10R OL 753 -0.580 26.685 46.902 1.00 0.00 H ATOM 29657 C111 OL 753 -0.238 25.045 48.193 1.00 0.00 C ATOM 29658 H11R OL 753 -1.118 24.439 47.965 1.00 0.00 H ATOM 29659 H11S OL 753 0.540 24.316 48.430 1.00 0.00 H ATOM 29660 C112 OL 753 -0.617 25.771 49.503 1.00 0.00 C ATOM 29661 H12R OL 753 -1.627 26.150 49.333 1.00 0.00 H ATOM 29662 H12S OL 753 -0.892 25.025 50.251 1.00 0.00 H ATOM 29663 C113 OL 753 0.339 26.867 50.083 1.00 0.00 C ATOM 29664 H13R OL 753 1.355 26.505 50.257 1.00 0.00 H ATOM 29665 H13S OL 753 0.456 27.647 49.329 1.00 0.00 H ATOM 29666 C114 OL 753 -0.134 27.630 51.392 1.00 0.00 C ATOM 29667 H14R OL 753 -0.199 26.787 52.084 1.00 0.00 H ATOM 29668 H14S OL 753 0.672 28.215 51.839 1.00 0.00 H ATOM 29669 C115 OL 753 -1.533 28.282 51.236 1.00 0.00 C ATOM 29670 H15R OL 753 -2.228 27.447 51.127 1.00 0.00 H ATOM 29671 H15S OL 753 -1.776 28.924 52.085 1.00 0.00 H ATOM 29672 C116 OL 753 -1.690 29.142 49.961 1.00 0.00 C ATOM 29673 H16R OL 753 -0.960 29.016 49.160 1.00 0.00 H ATOM 29674 H16S OL 753 -2.598 29.014 49.367 1.00 0.00 H ATOM 29675 C117 OL 753 -1.617 30.651 50.306 1.00 0.00 C ATOM 29676 H17R OL 753 -2.350 30.937 51.064 1.00 0.00 H ATOM 29677 H17S OL 753 -0.578 30.888 50.545 1.00 0.00 H ATOM 29678 C118 OL 753 -1.759 31.591 49.105 1.00 0.00 C ATOM 29679 H18R OL 753 -2.431 31.081 48.412 1.00 0.00 H ATOM 29680 H18S OL 753 -0.777 31.825 48.688 1.00 0.00 H ATOM 29681 H18T OL 753 -2.190 32.582 49.257 1.00 0.00 H TER 29682 OL 753 ATOM 29682 C116 PA 754 25.217 12.782 45.651 1.00 0.00 C ATOM 29683 H16R PA 754 25.245 11.763 46.041 1.00 0.00 H ATOM 29684 H16S PA 754 26.158 13.307 45.833 1.00 0.00 H ATOM 29685 H16T PA 754 25.179 12.804 44.560 1.00 0.00 H ATOM 29686 C115 PA 754 23.912 13.487 46.143 1.00 0.00 C ATOM 29687 H15R PA 754 23.910 14.445 45.618 1.00 0.00 H ATOM 29688 H15S PA 754 23.995 13.690 47.212 1.00 0.00 H ATOM 29689 C114 PA 754 22.596 12.708 45.931 1.00 0.00 C ATOM 29690 H14R PA 754 22.743 11.694 46.307 1.00 0.00 H ATOM 29691 H14S PA 754 22.423 12.602 44.858 1.00 0.00 H ATOM 29692 C113 PA 754 21.384 13.396 46.581 1.00 0.00 C ATOM 29693 H13R PA 754 20.437 12.985 46.228 1.00 0.00 H ATOM 29694 H13S PA 754 21.405 14.458 46.325 1.00 0.00 H ATOM 29695 C112 PA 754 21.410 13.300 48.085 1.00 0.00 C ATOM 29696 H12R PA 754 22.343 13.710 48.478 1.00 0.00 H ATOM 29697 H12S PA 754 21.466 12.299 48.518 1.00 0.00 H ATOM 29698 C111 PA 754 20.211 13.938 48.860 1.00 0.00 C ATOM 29699 H11R PA 754 19.341 13.781 48.219 1.00 0.00 H ATOM 29700 H11S PA 754 20.268 15.025 48.954 1.00 0.00 H ATOM 29701 C110 PA 754 20.061 13.326 50.322 1.00 0.00 C ATOM 29702 H10R PA 754 19.962 12.242 50.230 1.00 0.00 H ATOM 29703 H10S PA 754 19.069 13.423 50.769 1.00 0.00 H ATOM 29704 C19 PA 754 20.982 13.733 51.401 1.00 0.00 C ATOM 29705 H9R PA 754 21.973 13.281 51.325 1.00 0.00 H ATOM 29706 H9S PA 754 20.629 13.304 52.341 1.00 0.00 H ATOM 29707 C18 PA 754 21.194 15.217 51.547 1.00 0.00 C ATOM 29708 H8R PA 754 20.247 15.759 51.571 1.00 0.00 H ATOM 29709 H8S PA 754 21.617 15.696 50.662 1.00 0.00 H ATOM 29710 C17 PA 754 22.129 15.501 52.747 1.00 0.00 C ATOM 29711 H7R PA 754 22.301 16.574 52.643 1.00 0.00 H ATOM 29712 H7S PA 754 23.110 15.080 52.514 1.00 0.00 H ATOM 29713 C16 PA 754 21.647 14.975 54.142 1.00 0.00 C ATOM 29714 H6R PA 754 21.806 13.898 54.227 1.00 0.00 H ATOM 29715 H6S PA 754 20.579 15.151 54.290 1.00 0.00 H ATOM 29716 C15 PA 754 22.450 15.626 55.228 1.00 0.00 C ATOM 29717 H5R PA 754 22.536 16.714 55.239 1.00 0.00 H ATOM 29718 H5S PA 754 23.495 15.339 55.095 1.00 0.00 H ATOM 29719 C14 PA 754 21.852 15.336 56.603 1.00 0.00 C ATOM 29720 H4R PA 754 21.451 14.321 56.547 1.00 0.00 H ATOM 29721 H4S PA 754 21.031 15.969 56.945 1.00 0.00 H ATOM 29722 C13 PA 754 22.928 15.560 57.679 1.00 0.00 C ATOM 29723 H3R PA 754 22.862 16.629 57.890 1.00 0.00 H ATOM 29724 H3S PA 754 23.942 15.356 57.329 1.00 0.00 H ATOM 29725 C12 PA 754 22.681 15.022 59.100 1.00 0.00 C ATOM 29726 H2R PA 754 21.695 14.988 59.567 1.00 0.00 H ATOM 29727 H2S PA 754 23.323 15.571 59.792 1.00 0.00 H ATOM 29728 C11 PC 755 23.071 13.639 59.071 1.00 0.00 C ATOM 29729 O12 PC 755 24.216 13.217 58.993 1.00 0.00 O ATOM 29730 O11 PC 755 21.967 12.863 58.969 1.00 0.00 O ATOM 29731 C1 PC 755 22.056 11.442 58.971 1.00 0.00 C ATOM 29732 HR PC 755 22.348 11.167 59.988 1.00 0.00 H ATOM 29733 HS PC 755 22.770 11.156 58.194 1.00 0.00 H ATOM 29734 C2 PC 755 20.657 10.868 58.685 1.00 0.00 C ATOM 29735 HX PC 755 19.833 11.454 59.100 1.00 0.00 H ATOM 29736 C3 PC 755 20.502 9.462 59.309 1.00 0.00 C ATOM 29737 HA PC 755 20.802 9.393 60.357 1.00 0.00 H ATOM 29738 HB PC 755 21.122 8.694 58.839 1.00 0.00 H ATOM 29739 O31 PC 755 19.160 9.037 59.118 1.00 0.00 O ATOM 29740 P31 PC 755 18.759 7.582 59.428 1.00 0.00 P ATOM 29741 O32 PC 755 17.348 7.391 58.725 1.00 0.00 O ATOM 29742 C31 PC 755 17.047 7.867 57.367 1.00 0.00 C ATOM 29743 H1A PC 755 17.314 6.994 56.766 1.00 0.00 H ATOM 29744 H1B PC 755 17.658 8.711 57.038 1.00 0.00 H ATOM 29745 C32 PC 755 15.544 8.252 57.230 1.00 0.00 C ATOM 29746 H2A PC 755 15.376 8.541 56.191 1.00 0.00 H ATOM 29747 H2B PC 755 15.320 9.118 57.855 1.00 0.00 H ATOM 29748 N31 PC 755 14.433 7.232 57.550 1.00 0.00 N ATOM 29749 C33 PC 755 13.148 7.540 56.939 1.00 0.00 C ATOM 29750 H3A PC 755 13.300 7.693 55.870 1.00 0.00 H ATOM 29751 H3B PC 755 12.643 8.417 57.346 1.00 0.00 H ATOM 29752 H3C PC 755 12.573 6.618 57.036 1.00 0.00 H ATOM 29753 C34 PC 755 14.880 5.864 57.152 1.00 0.00 C ATOM 29754 H4A PC 755 15.188 5.827 56.106 1.00 0.00 H ATOM 29755 H4B PC 755 14.097 5.114 57.273 1.00 0.00 H ATOM 29756 H4C PC 755 15.628 5.521 57.869 1.00 0.00 H ATOM 29757 C35 PC 755 14.308 7.017 58.996 1.00 0.00 C ATOM 29758 H5A PC 755 14.454 8.000 59.446 1.00 0.00 H ATOM 29759 H5B PC 755 15.106 6.407 59.423 1.00 0.00 H ATOM 29760 H5C PC 755 13.346 6.672 59.378 1.00 0.00 H ATOM 29761 O33 PC 755 19.624 6.582 58.776 1.00 0.00 O ATOM 29762 O34 PC 755 18.513 7.435 60.907 1.00 0.00 O ATOM 29763 O21 PC 755 20.625 10.865 57.259 1.00 0.00 O ATOM 29764 C21 PC 755 19.468 10.733 56.627 1.00 0.00 C ATOM 29765 O22 PC 755 18.401 10.938 57.206 1.00 0.00 O ATOM 29766 C12 OL 756 19.698 10.547 55.141 1.00 0.00 C ATOM 29767 H2R OL 756 20.039 11.494 54.718 1.00 0.00 H ATOM 29768 H2S OL 756 20.396 9.719 54.996 1.00 0.00 H ATOM 29769 C13 OL 756 18.436 10.054 54.425 1.00 0.00 C ATOM 29770 H3R OL 756 18.008 9.244 55.019 1.00 0.00 H ATOM 29771 H3S OL 756 17.671 10.822 54.559 1.00 0.00 H ATOM 29772 C14 OL 756 18.745 9.594 52.973 1.00 0.00 C ATOM 29773 H4R OL 756 18.940 10.378 52.237 1.00 0.00 H ATOM 29774 H4S OL 756 19.712 9.115 52.813 1.00 0.00 H ATOM 29775 C15 OL 756 17.582 8.718 52.395 1.00 0.00 C ATOM 29776 H5R OL 756 17.476 7.891 53.100 1.00 0.00 H ATOM 29777 H5S OL 756 16.610 9.212 52.354 1.00 0.00 H ATOM 29778 C16 OL 756 17.838 8.091 51.065 1.00 0.00 C ATOM 29779 H6R OL 756 18.706 7.431 51.130 1.00 0.00 H ATOM 29780 H6S OL 756 17.091 7.335 50.818 1.00 0.00 H ATOM 29781 C17 OL 756 17.959 8.956 49.770 1.00 0.00 C ATOM 29782 H7R OL 756 17.104 9.619 49.622 1.00 0.00 H ATOM 29783 H7S OL 756 18.628 9.800 49.953 1.00 0.00 H ATOM 29784 C18 OL 756 18.408 8.049 48.531 1.00 0.00 C ATOM 29785 H8R OL 756 19.292 7.475 48.818 1.00 0.00 H ATOM 29786 H8S OL 756 17.555 7.380 48.401 1.00 0.00 H ATOM 29787 C19 OL 756 18.718 8.810 47.250 1.00 0.00 C ATOM 29788 H9R OL 756 18.970 9.867 47.283 1.00 0.00 H ATOM 29789 C110 OL 756 18.620 8.286 46.035 1.00 0.00 C ATOM 29790 H10R OL 756 18.882 8.926 45.196 1.00 0.00 H ATOM 29791 C111 OL 756 18.170 6.890 45.670 1.00 0.00 C ATOM 29792 H11R OL 756 19.010 6.202 45.785 1.00 0.00 H ATOM 29793 H11S OL 756 17.391 6.501 46.329 1.00 0.00 H ATOM 29794 C112 OL 756 17.571 6.990 44.224 1.00 0.00 C ATOM 29795 H12R OL 756 16.763 7.714 44.105 1.00 0.00 H ATOM 29796 H12S OL 756 18.375 7.312 43.558 1.00 0.00 H ATOM 29797 C113 OL 756 16.888 5.704 43.772 1.00 0.00 C ATOM 29798 H13R OL 756 16.637 5.745 42.710 1.00 0.00 H ATOM 29799 H13S OL 756 17.468 4.782 43.850 1.00 0.00 H ATOM 29800 C114 OL 756 15.631 5.312 44.500 1.00 0.00 C ATOM 29801 H14R OL 756 15.707 5.271 45.588 1.00 0.00 H ATOM 29802 H14S OL 756 14.823 6.029 44.338 1.00 0.00 H ATOM 29803 C115 OL 756 14.923 3.954 44.058 1.00 0.00 C ATOM 29804 H15R OL 756 14.032 3.797 44.669 1.00 0.00 H ATOM 29805 H15S OL 756 14.545 4.054 43.038 1.00 0.00 H ATOM 29806 C116 OL 756 15.792 2.735 44.015 1.00 0.00 C ATOM 29807 H16R OL 756 16.684 2.871 43.399 1.00 0.00 H ATOM 29808 H16S OL 756 16.175 2.479 45.005 1.00 0.00 H ATOM 29809 C117 OL 756 15.142 1.615 43.309 1.00 0.00 C ATOM 29810 H17R OL 756 14.216 1.604 43.888 1.00 0.00 H ATOM 29811 H17S OL 756 14.886 1.810 42.266 1.00 0.00 H ATOM 29812 C118 OL 756 15.711 0.247 43.490 1.00 0.00 C ATOM 29813 H18R OL 756 15.043 -0.512 43.077 1.00 0.00 H ATOM 29814 H18S OL 756 15.933 -0.014 44.527 1.00 0.00 H ATOM 29815 H18T OL 756 16.620 0.187 42.887 1.00 0.00 H TER 29816 OL 756 ATOM 29816 C116 PA 757 0.036 124.924 39.642 1.00 0.00 C ATOM 29817 H16R PA 757 -0.321 125.920 39.369 1.00 0.00 H ATOM 29818 H16S PA 757 -0.843 124.370 39.977 1.00 0.00 H ATOM 29819 H16T PA 757 0.401 124.433 38.737 1.00 0.00 H ATOM 29820 C115 PA 757 0.963 125.009 40.758 1.00 0.00 C ATOM 29821 H15R PA 757 1.719 125.666 40.322 1.00 0.00 H ATOM 29822 H15S PA 757 1.390 124.030 40.982 1.00 0.00 H ATOM 29823 C114 PA 757 0.348 125.642 42.062 1.00 0.00 C ATOM 29824 H14R PA 757 -0.430 126.385 41.881 1.00 0.00 H ATOM 29825 H14S PA 757 1.095 126.069 42.734 1.00 0.00 H ATOM 29826 C113 PA 757 -0.273 124.575 42.967 1.00 0.00 C ATOM 29827 H13R PA 757 0.415 123.755 43.186 1.00 0.00 H ATOM 29828 H13S PA 757 -1.156 124.131 42.502 1.00 0.00 H ATOM 29829 C112 PA 757 -0.648 125.182 44.363 1.00 0.00 C ATOM 29830 H12R PA 757 -1.100 124.411 44.990 1.00 0.00 H ATOM 29831 H12S PA 757 -1.357 125.998 44.210 1.00 0.00 H ATOM 29832 C111 PA 757 0.566 125.640 45.284 1.00 0.00 C ATOM 29833 H11R PA 757 0.742 126.712 45.173 1.00 0.00 H ATOM 29834 H11S PA 757 1.551 125.217 45.074 1.00 0.00 H ATOM 29835 C110 PA 757 0.179 125.369 46.808 1.00 0.00 C ATOM 29836 H10R PA 757 0.046 124.286 46.846 1.00 0.00 H ATOM 29837 H10S PA 757 -0.803 125.744 47.105 1.00 0.00 H ATOM 29838 C19 PA 757 1.243 125.719 47.838 1.00 0.00 C ATOM 29839 H9R PA 757 1.935 124.877 47.903 1.00 0.00 H ATOM 29840 H9S PA 757 0.780 125.655 48.825 1.00 0.00 H ATOM 29841 C18 PA 757 1.850 127.127 47.765 1.00 0.00 C ATOM 29842 H8R PA 757 1.176 127.968 47.942 1.00 0.00 H ATOM 29843 H8S PA 757 2.242 127.293 46.759 1.00 0.00 H ATOM 29844 C17 PA 757 3.228 127.371 48.589 1.00 0.00 C ATOM 29845 H7R PA 757 3.822 128.032 47.954 1.00 0.00 H ATOM 29846 H7S PA 757 4.002 126.603 48.645 1.00 0.00 H ATOM 29847 C16 PA 757 3.093 127.762 50.123 1.00 0.00 C ATOM 29848 H6R PA 757 2.082 128.156 50.245 1.00 0.00 H ATOM 29849 H6S PA 757 3.795 128.578 50.307 1.00 0.00 H ATOM 29850 C15 PA 757 3.243 126.567 51.096 1.00 0.00 C ATOM 29851 H5R PA 757 3.186 126.954 52.116 1.00 0.00 H ATOM 29852 H5S PA 757 4.250 126.172 50.951 1.00 0.00 H ATOM 29853 C14 PA 757 2.268 125.391 50.948 1.00 0.00 C ATOM 29854 H4R PA 757 2.518 124.811 50.057 1.00 0.00 H ATOM 29855 H4S PA 757 1.219 125.684 50.862 1.00 0.00 H ATOM 29856 C13 PA 757 2.270 124.482 52.216 1.00 0.00 C ATOM 29857 H3R PA 757 1.463 123.747 52.204 1.00 0.00 H ATOM 29858 H3S PA 757 1.982 125.142 53.037 1.00 0.00 H ATOM 29859 C12 PA 757 3.620 123.778 52.552 1.00 0.00 C ATOM 29860 H2R PA 757 4.406 124.502 52.777 1.00 0.00 H ATOM 29861 H2S PA 757 4.052 123.153 51.768 1.00 0.00 H ATOM 29862 C11 PGR 758 3.521 122.853 53.684 1.00 0.00 C ATOM 29863 O12 PGR 758 2.580 122.889 54.473 1.00 0.00 O ATOM 29864 O11 PGR 758 4.442 121.898 53.725 1.00 0.00 O ATOM 29865 C1 PGR 758 4.305 120.949 54.881 1.00 0.00 C ATOM 29866 HR PGR 758 4.073 121.505 55.793 1.00 0.00 H ATOM 29867 HS PGR 758 5.197 120.331 55.007 1.00 0.00 H ATOM 29868 C2 PGR 758 3.082 120.003 54.678 1.00 0.00 C ATOM 29869 HX PGR 758 2.204 120.562 54.344 1.00 0.00 H ATOM 29870 C3 PGR 758 2.758 119.470 56.079 1.00 0.00 C ATOM 29871 HA PGR 758 1.984 118.706 55.969 1.00 0.00 H ATOM 29872 HB PGR 758 2.334 120.307 56.638 1.00 0.00 H ATOM 29873 O31 PGR 758 3.934 119.036 56.753 1.00 0.00 O ATOM 29874 P31 PGR 758 4.328 117.458 56.978 1.00 0.00 P ATOM 29875 O32 PGR 758 4.997 117.047 55.585 1.00 0.00 O ATOM 29876 C31 PGR 758 6.333 117.330 55.166 1.00 0.00 C ATOM 29877 H1A PGR 758 6.695 118.322 55.449 1.00 0.00 H ATOM 29878 H1B PGR 758 6.423 117.165 54.090 1.00 0.00 H ATOM 29879 C32 PGR 758 7.299 116.322 55.782 1.00 0.00 C ATOM 29880 H2A PGR 758 6.834 115.362 56.022 1.00 0.00 H ATOM 29881 O35 PGR 758 7.737 116.873 56.998 1.00 0.00 O ATOM 29882 HO5A PGR 758 6.921 116.821 57.527 1.00 0.00 H ATOM 29883 C33 PGR 758 8.474 115.972 54.900 1.00 0.00 C ATOM 29884 H3A PGR 758 9.052 115.215 55.438 1.00 0.00 H ATOM 29885 H3B PGR 758 8.076 115.464 54.018 1.00 0.00 H ATOM 29886 O33 PGR 758 5.441 117.483 57.991 1.00 0.00 O ATOM 29887 O34 PGR 758 3.110 116.648 57.113 1.00 0.00 O ATOM 29888 O21 PGR 758 3.520 118.985 53.722 1.00 0.00 O ATOM 29889 C21 PGR 758 2.748 117.920 53.460 1.00 0.00 C ATOM 29890 O22 PGR 758 1.582 117.817 53.803 1.00 0.00 O ATOM 29891 O36 PGR 758 9.343 117.081 54.554 1.00 0.00 O ATOM 29892 HO6A PGR 758 10.140 116.613 54.247 1.00 0.00 H ATOM 29893 C12 OL 759 3.458 116.975 52.478 1.00 0.00 C ATOM 29894 H2R OL 759 2.796 116.675 51.663 1.00 0.00 H ATOM 29895 H2S OL 759 4.388 117.392 52.088 1.00 0.00 H ATOM 29896 C13 OL 759 3.665 115.583 53.080 1.00 0.00 C ATOM 29897 H3R OL 759 4.028 115.737 54.098 1.00 0.00 H ATOM 29898 H3S OL 759 2.743 115.038 53.291 1.00 0.00 H ATOM 29899 C14 OL 759 4.509 114.571 52.303 1.00 0.00 C ATOM 29900 H4R OL 759 5.472 115.068 52.165 1.00 0.00 H ATOM 29901 H4S OL 759 4.753 113.634 52.809 1.00 0.00 H ATOM 29902 C15 OL 759 3.920 114.261 50.961 1.00 0.00 C ATOM 29903 H5R OL 759 2.931 113.801 51.016 1.00 0.00 H ATOM 29904 H5S OL 759 3.610 115.154 50.414 1.00 0.00 H ATOM 29905 C16 OL 759 4.841 113.340 50.065 1.00 0.00 C ATOM 29906 H6R OL 759 5.629 113.884 49.539 1.00 0.00 H ATOM 29907 H6S OL 759 5.283 112.681 50.815 1.00 0.00 H ATOM 29908 C17 OL 759 4.187 112.603 48.965 1.00 0.00 C ATOM 29909 H7R OL 759 4.917 111.946 48.488 1.00 0.00 H ATOM 29910 H7S OL 759 3.471 111.967 49.489 1.00 0.00 H ATOM 29911 C18 OL 759 3.425 113.544 47.921 1.00 0.00 C ATOM 29912 H8R OL 759 2.672 114.252 48.272 1.00 0.00 H ATOM 29913 H8S OL 759 4.181 114.267 47.606 1.00 0.00 H ATOM 29914 C19 OL 759 2.851 112.702 46.859 1.00 0.00 C ATOM 29915 H9R OL 759 3.472 111.828 46.680 1.00 0.00 H ATOM 29916 C110 OL 759 1.846 112.981 45.964 1.00 0.00 C ATOM 29917 H10R OL 759 1.635 112.268 45.171 1.00 0.00 H ATOM 29918 C111 OL 759 1.127 114.294 45.900 1.00 0.00 C ATOM 29919 H11R OL 759 0.351 114.254 46.668 1.00 0.00 H ATOM 29920 H11S OL 759 1.750 115.107 46.279 1.00 0.00 H ATOM 29921 C112 OL 759 0.567 114.729 44.604 1.00 0.00 C ATOM 29922 H12R OL 759 0.177 115.736 44.771 1.00 0.00 H ATOM 29923 H12S OL 759 1.444 114.865 43.968 1.00 0.00 H ATOM 29924 C113 OL 759 -0.491 113.903 43.903 1.00 0.00 C ATOM 29925 H13R OL 759 -0.346 112.826 44.007 1.00 0.00 H ATOM 29926 H13S OL 759 -1.441 114.116 44.398 1.00 0.00 H ATOM 29927 C114 OL 759 -0.633 114.278 42.439 1.00 0.00 C ATOM 29928 H14R OL 759 -0.617 115.364 42.327 1.00 0.00 H ATOM 29929 H14S OL 759 0.217 113.930 41.848 1.00 0.00 H ATOM 29930 C115 OL 759 -1.923 113.533 41.918 1.00 0.00 C ATOM 29931 H15R OL 759 -1.793 112.464 42.099 1.00 0.00 H ATOM 29932 H15S OL 759 -2.765 113.849 42.538 1.00 0.00 H ATOM 29933 C116 OL 759 -2.207 113.735 40.420 1.00 0.00 C ATOM 29934 H16R OL 759 -2.119 114.784 40.128 1.00 0.00 H ATOM 29935 H16S OL 759 -1.428 113.172 39.902 1.00 0.00 H ATOM 29936 C117 OL 759 -3.437 113.114 39.885 1.00 0.00 C ATOM 29937 H17R OL 759 -3.395 113.162 38.795 1.00 0.00 H ATOM 29938 H17S OL 759 -3.504 112.041 40.076 1.00 0.00 H ATOM 29939 C118 OL 759 -4.738 113.874 40.182 1.00 0.00 C ATOM 29940 H18R OL 759 -4.680 114.917 39.862 1.00 0.00 H ATOM 29941 H18S OL 759 -5.034 113.944 41.231 1.00 0.00 H ATOM 29942 H18T OL 759 -5.476 113.396 39.535 1.00 0.00 H TER 29943 OL 759 ATOM 29943 C116 PA 760 8.847 111.577 49.943 1.00 0.00 C ATOM 29944 H16R PA 760 9.253 111.076 49.062 1.00 0.00 H ATOM 29945 H16S PA 760 7.950 111.108 50.355 1.00 0.00 H ATOM 29946 H16T PA 760 9.649 111.319 50.638 1.00 0.00 H ATOM 29947 C115 PA 760 8.906 113.088 49.644 1.00 0.00 C ATOM 29948 H15R PA 760 8.635 113.684 50.518 1.00 0.00 H ATOM 29949 H15S PA 760 8.303 113.295 48.758 1.00 0.00 H ATOM 29950 C114 PA 760 10.259 113.604 49.191 1.00 0.00 C ATOM 29951 H14R PA 760 10.212 114.693 49.126 1.00 0.00 H ATOM 29952 H14S PA 760 10.303 113.182 48.184 1.00 0.00 H ATOM 29953 C113 PA 760 11.497 113.190 50.042 1.00 0.00 C ATOM 29954 H13R PA 760 11.616 112.119 50.214 1.00 0.00 H ATOM 29955 H13S PA 760 11.501 113.556 51.071 1.00 0.00 H ATOM 29956 C112 PA 760 12.887 113.689 49.549 1.00 0.00 C ATOM 29957 H12R PA 760 12.872 114.770 49.701 1.00 0.00 H ATOM 29958 H12S PA 760 12.804 113.380 48.505 1.00 0.00 H ATOM 29959 C111 PA 760 14.090 112.915 50.170 1.00 0.00 C ATOM 29960 H11R PA 760 13.914 112.310 51.061 1.00 0.00 H ATOM 29961 H11S PA 760 14.864 113.601 50.521 1.00 0.00 H ATOM 29962 C110 PA 760 14.777 111.994 49.146 1.00 0.00 C ATOM 29963 H10R PA 760 15.059 112.679 48.344 1.00 0.00 H ATOM 29964 H10S PA 760 14.033 111.298 48.753 1.00 0.00 H ATOM 29965 C19 PA 760 16.096 111.256 49.608 1.00 0.00 C ATOM 29966 H9R PA 760 16.564 110.766 48.752 1.00 0.00 H ATOM 29967 H9S PA 760 15.740 110.440 50.240 1.00 0.00 H ATOM 29968 C18 PA 760 17.128 112.142 50.315 1.00 0.00 C ATOM 29969 H8R PA 760 16.861 112.364 51.350 1.00 0.00 H ATOM 29970 H8S PA 760 16.989 113.153 49.928 1.00 0.00 H ATOM 29971 C17 PA 760 18.615 111.630 50.450 1.00 0.00 C ATOM 29972 H7R PA 760 19.005 111.114 49.570 1.00 0.00 H ATOM 29973 H7S PA 760 18.598 110.856 51.221 1.00 0.00 H ATOM 29974 C16 PA 760 19.712 112.677 50.709 1.00 0.00 C ATOM 29975 H6R PA 760 20.072 113.140 49.788 1.00 0.00 H ATOM 29976 H6S PA 760 20.598 112.159 51.080 1.00 0.00 H ATOM 29977 C15 PA 760 19.359 113.896 51.535 1.00 0.00 C ATOM 29978 H5R PA 760 19.048 113.579 52.532 1.00 0.00 H ATOM 29979 H5S PA 760 18.489 114.418 51.131 1.00 0.00 H ATOM 29980 C14 PA 760 20.472 114.915 51.443 1.00 0.00 C ATOM 29981 H4R PA 760 20.590 115.311 50.432 1.00 0.00 H ATOM 29982 H4S PA 760 21.469 114.520 51.648 1.00 0.00 H ATOM 29983 C13 PA 760 20.246 116.095 52.344 1.00 0.00 C ATOM 29984 H3R PA 760 20.533 115.738 53.335 1.00 0.00 H ATOM 29985 H3S PA 760 19.202 116.411 52.397 1.00 0.00 H ATOM 29986 C12 PA 760 21.126 117.299 51.939 1.00 0.00 C ATOM 29987 H2R PA 760 20.728 117.810 51.061 1.00 0.00 H ATOM 29988 H2S PA 760 22.150 117.031 51.671 1.00 0.00 H ATOM 29989 C11 PC 761 21.057 118.214 53.097 1.00 0.00 C ATOM 29990 O12 PC 761 22.052 118.808 53.431 1.00 0.00 O ATOM 29991 O11 PC 761 19.810 118.380 53.579 1.00 0.00 O ATOM 29992 C1 PC 761 19.517 119.323 54.698 1.00 0.00 C ATOM 29993 HR PC 761 20.320 119.348 55.440 1.00 0.00 H ATOM 29994 HS PC 761 18.556 119.096 55.166 1.00 0.00 H ATOM 29995 C2 PC 761 19.399 120.744 54.085 1.00 0.00 C ATOM 29996 HX PC 761 20.344 121.018 53.608 1.00 0.00 H ATOM 29997 C3 PC 761 19.001 121.746 55.218 1.00 0.00 C ATOM 29998 HA PC 761 18.765 122.691 54.722 1.00 0.00 H ATOM 29999 HB PC 761 19.782 122.014 55.934 1.00 0.00 H ATOM 30000 O31 PC 761 17.822 121.365 55.912 1.00 0.00 O ATOM 30001 P31 PC 761 17.468 122.009 57.280 1.00 0.00 P ATOM 30002 O32 PC 761 18.605 121.530 58.267 1.00 0.00 O ATOM 30003 C31 PC 761 18.481 120.262 58.766 1.00 0.00 C ATOM 30004 H1A PC 761 18.524 119.642 57.868 1.00 0.00 H ATOM 30005 H1B PC 761 17.543 119.983 59.253 1.00 0.00 H ATOM 30006 C32 PC 761 19.646 119.830 59.719 1.00 0.00 C ATOM 30007 H2A PC 761 20.553 119.774 59.115 1.00 0.00 H ATOM 30008 H2B PC 761 19.515 118.775 59.965 1.00 0.00 H ATOM 30009 N31 PC 761 19.764 120.587 61.033 1.00 0.00 N ATOM 30010 C33 PC 761 20.775 119.938 61.975 1.00 0.00 C ATOM 30011 H3A PC 761 20.260 119.271 62.668 1.00 0.00 H ATOM 30012 H3B PC 761 21.267 120.740 62.527 1.00 0.00 H ATOM 30013 H3C PC 761 21.634 119.507 61.457 1.00 0.00 H ATOM 30014 C34 PC 761 20.267 121.938 60.627 1.00 0.00 C ATOM 30015 H4A PC 761 19.480 122.516 60.140 1.00 0.00 H ATOM 30016 H4B PC 761 21.026 121.847 59.849 1.00 0.00 H ATOM 30017 H4C PC 761 20.683 122.467 61.486 1.00 0.00 H ATOM 30018 C35 PC 761 18.515 120.931 61.770 1.00 0.00 C ATOM 30019 H5A PC 761 18.722 121.642 62.571 1.00 0.00 H ATOM 30020 H5B PC 761 18.077 119.998 62.126 1.00 0.00 H ATOM 30021 H5C PC 761 18.017 121.378 60.908 1.00 0.00 H ATOM 30022 O33 PC 761 17.667 123.485 57.131 1.00 0.00 O ATOM 30023 O34 PC 761 16.153 121.594 57.689 1.00 0.00 O ATOM 30024 O21 PC 761 18.304 120.602 53.060 1.00 0.00 O ATOM 30025 C21 PC 761 18.274 121.447 52.021 1.00 0.00 C ATOM 30026 O22 PC 761 19.179 122.262 51.801 1.00 0.00 O ATOM 30027 C12 OL 762 17.208 121.149 51.011 1.00 0.00 C ATOM 30028 H2R OL 762 17.326 120.167 50.549 1.00 0.00 H ATOM 30029 H2S OL 762 16.269 121.043 51.559 1.00 0.00 H ATOM 30030 C13 OL 762 17.111 122.164 49.914 1.00 0.00 C ATOM 30031 H3R OL 762 17.080 123.202 50.251 1.00 0.00 H ATOM 30032 H3S OL 762 17.977 121.979 49.274 1.00 0.00 H ATOM 30033 C14 OL 762 15.923 121.922 48.987 1.00 0.00 C ATOM 30034 H4R OL 762 15.714 120.860 48.847 1.00 0.00 H ATOM 30035 H4S OL 762 15.054 122.352 49.490 1.00 0.00 H ATOM 30036 C15 OL 762 16.006 122.629 47.652 1.00 0.00 C ATOM 30037 H5R OL 762 16.132 123.687 47.892 1.00 0.00 H ATOM 30038 H5S OL 762 16.791 122.169 47.048 1.00 0.00 H ATOM 30039 C16 OL 762 14.782 122.236 46.797 1.00 0.00 C ATOM 30040 H6R OL 762 14.663 121.151 46.768 1.00 0.00 H ATOM 30041 H6S OL 762 13.922 122.601 47.362 1.00 0.00 H ATOM 30042 C17 OL 762 14.768 122.781 45.417 1.00 0.00 C ATOM 30043 H7R OL 762 14.963 123.854 45.473 1.00 0.00 H ATOM 30044 H7S OL 762 15.655 122.494 44.848 1.00 0.00 H ATOM 30045 C18 OL 762 13.417 122.496 44.795 1.00 0.00 C ATOM 30046 H8R OL 762 13.342 121.482 44.397 1.00 0.00 H ATOM 30047 H8S OL 762 12.575 122.404 45.484 1.00 0.00 H ATOM 30048 C19 OL 762 13.109 123.561 43.770 1.00 0.00 C ATOM 30049 H9R OL 762 12.523 124.403 44.131 1.00 0.00 H ATOM 30050 C110 OL 762 13.564 123.571 42.483 1.00 0.00 C ATOM 30051 H10R OL 762 13.192 124.410 41.901 1.00 0.00 H ATOM 30052 C111 OL 762 14.609 122.680 41.850 1.00 0.00 C ATOM 30053 H11R OL 762 15.158 122.129 42.617 1.00 0.00 H ATOM 30054 H11S OL 762 14.015 121.902 41.363 1.00 0.00 H ATOM 30055 C112 OL 762 15.601 123.305 40.821 1.00 0.00 C ATOM 30056 H12R OL 762 15.217 123.549 39.828 1.00 0.00 H ATOM 30057 H12S OL 762 15.949 124.222 41.301 1.00 0.00 H ATOM 30058 C113 OL 762 16.713 122.218 40.784 1.00 0.00 C ATOM 30059 H13R OL 762 16.958 121.858 41.785 1.00 0.00 H ATOM 30060 H13S OL 762 16.338 121.314 40.299 1.00 0.00 H ATOM 30061 C114 OL 762 17.934 122.817 39.985 1.00 0.00 C ATOM 30062 H14R OL 762 17.599 123.029 38.968 1.00 0.00 H ATOM 30063 H14S OL 762 18.262 123.734 40.478 1.00 0.00 H ATOM 30064 C115 OL 762 19.058 121.818 39.762 1.00 0.00 C ATOM 30065 H15R OL 762 19.975 122.342 39.487 1.00 0.00 H ATOM 30066 H15S OL 762 19.385 121.355 40.696 1.00 0.00 H ATOM 30067 C116 OL 762 18.659 120.784 38.635 1.00 0.00 C ATOM 30068 H16R OL 762 19.123 119.818 38.846 1.00 0.00 H ATOM 30069 H16S OL 762 17.601 120.590 38.826 1.00 0.00 H ATOM 30070 C117 OL 762 18.992 121.319 37.165 1.00 0.00 C ATOM 30071 H17R OL 762 18.329 122.155 36.929 1.00 0.00 H ATOM 30072 H17S OL 762 20.005 121.726 37.155 1.00 0.00 H ATOM 30073 C118 OL 762 18.846 120.138 36.188 1.00 0.00 C ATOM 30074 H18R OL 762 17.808 119.799 36.202 1.00 0.00 H ATOM 30075 H18S OL 762 19.523 119.299 36.364 1.00 0.00 H ATOM 30076 H18T OL 762 19.038 120.513 35.181 1.00 0.00 H TER 30077 OL 762 ATOM 30077 C116 PA 763 8.327 134.193 42.300 1.00 0.00 C ATOM 30078 H16R PA 763 9.077 134.018 41.526 1.00 0.00 H ATOM 30079 H16S PA 763 7.395 133.902 41.811 1.00 0.00 H ATOM 30080 H16T PA 763 8.498 133.432 43.064 1.00 0.00 H ATOM 30081 C115 PA 763 8.291 135.599 42.967 1.00 0.00 C ATOM 30082 H15R PA 763 9.280 136.007 43.188 1.00 0.00 H ATOM 30083 H15S PA 763 7.783 135.527 43.931 1.00 0.00 H ATOM 30084 C114 PA 763 7.641 136.733 42.078 1.00 0.00 C ATOM 30085 H14R PA 763 6.643 136.401 41.786 1.00 0.00 H ATOM 30086 H14S PA 763 8.222 136.916 41.171 1.00 0.00 H ATOM 30087 C113 PA 763 7.518 138.041 42.918 1.00 0.00 C ATOM 30088 H13R PA 763 8.342 138.067 43.635 1.00 0.00 H ATOM 30089 H13S PA 763 6.638 137.993 43.563 1.00 0.00 H ATOM 30090 C112 PA 763 7.389 139.354 42.118 1.00 0.00 C ATOM 30091 H12R PA 763 6.566 139.248 41.408 1.00 0.00 H ATOM 30092 H12S PA 763 8.345 139.360 41.590 1.00 0.00 H ATOM 30093 C111 PA 763 7.159 140.672 42.951 1.00 0.00 C ATOM 30094 H11R PA 763 6.139 140.774 43.328 1.00 0.00 H ATOM 30095 H11S PA 763 7.188 141.517 42.260 1.00 0.00 H ATOM 30096 C110 PA 763 8.087 140.838 44.182 1.00 0.00 C ATOM 30097 H10R PA 763 9.083 140.586 43.812 1.00 0.00 H ATOM 30098 H10S PA 763 7.837 140.130 44.975 1.00 0.00 H ATOM 30099 C19 PA 763 7.988 142.274 44.775 1.00 0.00 C ATOM 30100 H9R PA 763 6.998 142.461 45.195 1.00 0.00 H ATOM 30101 H9S PA 763 8.288 142.909 43.938 1.00 0.00 H ATOM 30102 C18 PA 763 8.982 142.492 45.891 1.00 0.00 C ATOM 30103 H8R PA 763 10.005 142.178 45.670 1.00 0.00 H ATOM 30104 H8S PA 763 8.678 141.982 46.807 1.00 0.00 H ATOM 30105 C17 PA 763 9.109 143.987 46.223 1.00 0.00 C ATOM 30106 H7R PA 763 8.210 144.308 46.752 1.00 0.00 H ATOM 30107 H7S PA 763 9.203 144.638 45.352 1.00 0.00 H ATOM 30108 C16 PA 763 10.267 144.284 47.098 1.00 0.00 C ATOM 30109 H6R PA 763 10.325 145.368 47.210 1.00 0.00 H ATOM 30110 H6S PA 763 11.143 143.919 46.558 1.00 0.00 H ATOM 30111 C15 PA 763 10.194 143.739 48.540 1.00 0.00 C ATOM 30112 H5R PA 763 10.290 142.653 48.613 1.00 0.00 H ATOM 30113 H5S PA 763 9.174 143.911 48.891 1.00 0.00 H ATOM 30114 C14 PA 763 11.194 144.355 49.457 1.00 0.00 C ATOM 30115 H4R PA 763 11.066 145.438 49.405 1.00 0.00 H ATOM 30116 H4S PA 763 12.202 144.140 49.094 1.00 0.00 H ATOM 30117 C13 PA 763 11.004 143.983 50.874 1.00 0.00 C ATOM 30118 H3R PA 763 11.765 144.354 51.564 1.00 0.00 H ATOM 30119 H3S PA 763 11.259 142.922 50.929 1.00 0.00 H ATOM 30120 C12 PA 763 9.564 144.315 51.485 1.00 0.00 C ATOM 30121 H2R PA 763 8.752 143.732 51.046 1.00 0.00 H ATOM 30122 H2S PA 763 9.304 145.374 51.422 1.00 0.00 H ATOM 30123 C11 PGR 764 9.654 143.894 52.945 1.00 0.00 C ATOM 30124 O12 PGR 764 9.306 142.779 53.318 1.00 0.00 O ATOM 30125 O11 PGR 764 10.123 144.960 53.692 1.00 0.00 O ATOM 30126 C1 PGR 764 10.480 144.687 55.100 1.00 0.00 C ATOM 30127 HR PGR 764 11.445 144.180 55.173 1.00 0.00 H ATOM 30128 HS PGR 764 9.827 143.897 55.480 1.00 0.00 H ATOM 30129 C2 PGR 764 10.350 146.055 55.773 1.00 0.00 C ATOM 30130 HX PGR 764 11.136 146.679 55.339 1.00 0.00 H ATOM 30131 C3 PGR 764 10.440 145.964 57.303 1.00 0.00 C ATOM 30132 HA PGR 764 11.333 145.368 57.510 1.00 0.00 H ATOM 30133 HB PGR 764 9.637 145.334 57.694 1.00 0.00 H ATOM 30134 O31 PGR 764 10.514 147.200 57.991 1.00 0.00 O ATOM 30135 P31 PGR 764 11.236 147.197 59.400 1.00 0.00 P ATOM 30136 O32 PGR 764 10.685 148.559 60.097 1.00 0.00 O ATOM 30137 C31 PGR 764 9.527 148.505 60.957 1.00 0.00 C ATOM 30138 H1A PGR 764 9.772 147.772 61.729 1.00 0.00 H ATOM 30139 H1B PGR 764 8.641 148.178 60.407 1.00 0.00 H ATOM 30140 C32 PGR 764 9.349 149.946 61.541 1.00 0.00 C ATOM 30141 H2A PGR 764 9.618 150.709 60.806 1.00 0.00 H ATOM 30142 O35 PGR 764 10.282 150.158 62.536 1.00 0.00 O ATOM 30143 HO5A PGR 764 10.163 149.405 63.142 1.00 0.00 H ATOM 30144 C33 PGR 764 7.930 150.243 62.044 1.00 0.00 C ATOM 30145 H3A PGR 764 7.993 151.283 62.375 1.00 0.00 H ATOM 30146 H3B PGR 764 7.217 150.237 61.216 1.00 0.00 H ATOM 30147 O33 PGR 764 10.696 146.056 60.131 1.00 0.00 O ATOM 30148 O34 PGR 764 12.673 147.329 59.247 1.00 0.00 O ATOM 30149 O21 PGR 764 9.163 146.777 55.278 1.00 0.00 O ATOM 30150 C21 PGR 764 7.938 146.312 55.659 1.00 0.00 C ATOM 30151 O22 PGR 764 7.611 145.315 56.285 1.00 0.00 O ATOM 30152 O36 PGR 764 7.522 149.412 63.119 1.00 0.00 O ATOM 30153 HO6A PGR 764 7.381 148.575 62.641 1.00 0.00 H ATOM 30154 C12 OL 765 6.922 147.232 55.018 1.00 0.00 C ATOM 30155 H2R OL 765 6.030 147.255 55.649 1.00 0.00 H ATOM 30156 H2S OL 765 7.277 148.255 55.156 1.00 0.00 H ATOM 30157 C13 OL 765 6.555 146.950 53.607 1.00 0.00 C ATOM 30158 H3R OL 765 5.709 147.587 53.338 1.00 0.00 H ATOM 30159 H3S OL 765 7.353 147.311 52.955 1.00 0.00 H ATOM 30160 C14 OL 765 6.135 145.452 53.372 1.00 0.00 C ATOM 30161 H4R OL 765 6.931 144.710 53.470 1.00 0.00 H ATOM 30162 H4S OL 765 5.267 145.339 54.025 1.00 0.00 H ATOM 30163 C15 OL 765 5.658 145.161 51.904 1.00 0.00 C ATOM 30164 H5R OL 765 4.922 145.904 51.590 1.00 0.00 H ATOM 30165 H5S OL 765 6.578 145.390 51.363 1.00 0.00 H ATOM 30166 C16 OL 765 5.167 143.711 51.683 1.00 0.00 C ATOM 30167 H6R OL 765 6.002 143.009 51.645 1.00 0.00 H ATOM 30168 H6S OL 765 4.776 143.281 52.608 1.00 0.00 H ATOM 30169 C17 OL 765 4.469 143.740 50.393 1.00 0.00 C ATOM 30170 H7R OL 765 3.520 144.223 50.637 1.00 0.00 H ATOM 30171 H7S OL 765 5.103 144.250 49.665 1.00 0.00 H ATOM 30172 C18 OL 765 4.155 142.384 49.800 1.00 0.00 C ATOM 30173 H8R OL 765 3.748 141.807 50.633 1.00 0.00 H ATOM 30174 H8S OL 765 3.260 142.471 49.179 1.00 0.00 H ATOM 30175 C19 OL 765 5.220 141.629 49.011 1.00 0.00 C ATOM 30176 H9R OL 765 6.192 141.412 49.446 1.00 0.00 H ATOM 30177 C110 OL 765 5.166 141.313 47.698 1.00 0.00 C ATOM 30178 H10R OL 765 6.045 140.924 47.192 1.00 0.00 H ATOM 30179 C111 OL 765 3.906 141.232 46.850 1.00 0.00 C ATOM 30180 H11R OL 765 3.083 141.176 47.567 1.00 0.00 H ATOM 30181 H11S OL 765 3.937 142.207 46.358 1.00 0.00 H ATOM 30182 C112 OL 765 4.092 140.057 45.948 1.00 0.00 C ATOM 30183 H12R OL 765 5.029 140.128 45.393 1.00 0.00 H ATOM 30184 H12S OL 765 4.229 139.145 46.531 1.00 0.00 H ATOM 30185 C113 OL 765 3.044 139.829 44.841 1.00 0.00 C ATOM 30186 H13R OL 765 2.085 139.441 45.191 1.00 0.00 H ATOM 30187 H13S OL 765 2.830 140.763 44.318 1.00 0.00 H ATOM 30188 C114 OL 765 3.458 138.723 43.813 1.00 0.00 C ATOM 30189 H14R OL 765 3.974 139.211 42.983 1.00 0.00 H ATOM 30190 H14S OL 765 4.329 138.200 44.214 1.00 0.00 H ATOM 30191 C115 OL 765 2.279 137.975 43.361 1.00 0.00 C ATOM 30192 H15R OL 765 2.035 137.336 44.212 1.00 0.00 H ATOM 30193 H15S OL 765 1.432 138.613 43.102 1.00 0.00 H ATOM 30194 C116 OL 765 2.539 136.971 42.226 1.00 0.00 C ATOM 30195 H16R OL 765 1.682 136.466 41.776 1.00 0.00 H ATOM 30196 H16S OL 765 2.896 137.584 41.396 1.00 0.00 H ATOM 30197 C117 OL 765 3.657 135.940 42.459 1.00 0.00 C ATOM 30198 H17R OL 765 4.515 136.408 42.945 1.00 0.00 H ATOM 30199 H17S OL 765 3.426 135.284 43.301 1.00 0.00 H ATOM 30200 C118 OL 765 4.173 135.221 41.246 1.00 0.00 C ATOM 30201 H18R OL 765 4.665 135.803 40.464 1.00 0.00 H ATOM 30202 H18S OL 765 3.445 134.557 40.775 1.00 0.00 H ATOM 30203 H18T OL 765 4.877 134.459 41.587 1.00 0.00 H TER 30204 OL 765 ATOM 30204 C116 PA 766 107.295 13.307 38.546 1.00 0.00 C ATOM 30205 H16R PA 766 108.231 13.592 38.061 1.00 0.00 H ATOM 30206 H16S PA 766 106.548 14.051 38.265 1.00 0.00 H ATOM 30207 H16T PA 766 107.021 12.283 38.283 1.00 0.00 H ATOM 30208 C115 PA 766 107.566 13.382 40.052 1.00 0.00 C ATOM 30209 H15R PA 766 108.088 14.323 40.241 1.00 0.00 H ATOM 30210 H15S PA 766 108.078 12.454 40.315 1.00 0.00 H ATOM 30211 C114 PA 766 106.361 13.272 40.918 1.00 0.00 C ATOM 30212 H14R PA 766 106.711 13.382 41.946 1.00 0.00 H ATOM 30213 H14S PA 766 106.010 12.240 40.846 1.00 0.00 H ATOM 30214 C113 PA 766 105.181 14.272 40.537 1.00 0.00 C ATOM 30215 H13R PA 766 104.355 14.060 41.219 1.00 0.00 H ATOM 30216 H13S PA 766 104.807 13.939 39.566 1.00 0.00 H ATOM 30217 C112 PA 766 105.441 15.731 40.411 1.00 0.00 C ATOM 30218 H12R PA 766 104.622 16.287 39.950 1.00 0.00 H ATOM 30219 H12S PA 766 106.332 15.922 39.809 1.00 0.00 H ATOM 30220 C111 PA 766 105.503 16.425 41.775 1.00 0.00 C ATOM 30221 H11R PA 766 106.183 15.925 42.468 1.00 0.00 H ATOM 30222 H11S PA 766 104.578 16.393 42.355 1.00 0.00 H ATOM 30223 C110 PA 766 106.000 17.851 41.604 1.00 0.00 C ATOM 30224 H10R PA 766 105.727 18.143 40.588 1.00 0.00 H ATOM 30225 H10S PA 766 107.083 17.752 41.502 1.00 0.00 H ATOM 30226 C19 PA 766 105.756 18.880 42.700 1.00 0.00 C ATOM 30227 H9R PA 766 104.690 18.968 42.916 1.00 0.00 H ATOM 30228 H9S PA 766 106.188 19.864 42.506 1.00 0.00 H ATOM 30229 C18 PA 766 106.451 18.445 44.079 1.00 0.00 C ATOM 30230 H8R PA 766 107.517 18.227 43.984 1.00 0.00 H ATOM 30231 H8S PA 766 106.053 17.472 44.372 1.00 0.00 H ATOM 30232 C17 PA 766 106.348 19.474 45.200 1.00 0.00 C ATOM 30233 H7R PA 766 105.277 19.663 45.303 1.00 0.00 H ATOM 30234 H7S PA 766 106.742 20.474 45.009 1.00 0.00 H ATOM 30235 C16 PA 766 106.940 18.960 46.498 1.00 0.00 C ATOM 30236 H6R PA 766 107.111 17.882 46.460 1.00 0.00 H ATOM 30237 H6S PA 766 106.246 19.190 47.309 1.00 0.00 H ATOM 30238 C15 PA 766 108.290 19.640 46.768 1.00 0.00 C ATOM 30239 H5R PA 766 107.946 20.675 46.820 1.00 0.00 H ATOM 30240 H5S PA 766 108.930 19.554 45.888 1.00 0.00 H ATOM 30241 C14 PA 766 109.016 19.067 47.951 1.00 0.00 C ATOM 30242 H4R PA 766 109.912 19.592 48.291 1.00 0.00 H ATOM 30243 H4S PA 766 109.342 18.055 47.705 1.00 0.00 H ATOM 30244 C13 PA 766 108.225 18.925 49.250 1.00 0.00 C ATOM 30245 H3R PA 766 108.827 18.263 49.877 1.00 0.00 H ATOM 30246 H3S PA 766 107.292 18.372 49.119 1.00 0.00 H ATOM 30247 C12 PA 766 107.839 20.246 49.917 1.00 0.00 C ATOM 30248 H2R PA 766 106.908 20.628 49.494 1.00 0.00 H ATOM 30249 H2S PA 766 108.642 20.987 49.899 1.00 0.00 H ATOM 30250 C11 PGR 767 107.563 19.871 51.434 1.00 0.00 C ATOM 30251 O12 PGR 767 108.397 19.282 52.139 1.00 0.00 O ATOM 30252 O11 PGR 767 106.468 20.316 52.002 1.00 0.00 O ATOM 30253 C1 PGR 767 106.319 20.337 53.435 1.00 0.00 C ATOM 30254 HR PGR 767 107.134 20.944 53.838 1.00 0.00 H ATOM 30255 HS PGR 767 106.471 19.329 53.830 1.00 0.00 H ATOM 30256 C2 PGR 767 105.043 21.005 53.776 1.00 0.00 C ATOM 30257 HX PGR 767 104.997 21.885 53.129 1.00 0.00 H ATOM 30258 C3 PGR 767 104.717 21.329 55.305 1.00 0.00 C ATOM 30259 HA PGR 767 103.773 21.877 55.253 1.00 0.00 H ATOM 30260 HB PGR 767 105.548 21.873 55.761 1.00 0.00 H ATOM 30261 O31 PGR 767 104.512 20.187 56.109 1.00 0.00 O ATOM 30262 P31 PGR 767 104.379 20.404 57.735 1.00 0.00 P ATOM 30263 O32 PGR 767 105.851 20.936 57.911 1.00 0.00 O ATOM 30264 C31 PGR 767 106.949 19.996 57.989 1.00 0.00 C ATOM 30265 H1A PGR 767 106.939 19.483 57.023 1.00 0.00 H ATOM 30266 H1B PGR 767 106.660 19.247 58.731 1.00 0.00 H ATOM 30267 C32 PGR 767 108.246 20.772 58.311 1.00 0.00 C ATOM 30268 H2A PGR 767 109.014 20.008 58.160 1.00 0.00 H ATOM 30269 O35 PGR 767 108.337 21.261 59.652 1.00 0.00 O ATOM 30270 HO5A PGR 767 109.265 21.522 59.797 1.00 0.00 H ATOM 30271 C33 PGR 767 108.583 21.958 57.318 1.00 0.00 C ATOM 30272 H3A PGR 767 109.547 22.355 57.646 1.00 0.00 H ATOM 30273 H3B PGR 767 108.715 21.511 56.329 1.00 0.00 H ATOM 30274 O33 PGR 767 103.402 21.545 58.076 1.00 0.00 O ATOM 30275 O34 PGR 767 104.170 19.080 58.398 1.00 0.00 O ATOM 30276 O21 PGR 767 103.964 20.128 53.262 1.00 0.00 O ATOM 30277 C21 PGR 767 102.751 20.638 53.019 1.00 0.00 C ATOM 30278 O22 PGR 767 102.537 21.806 53.117 1.00 0.00 O ATOM 30279 O36 PGR 767 107.695 23.082 57.346 1.00 0.00 O ATOM 30280 HO6A PGR 767 107.425 23.268 58.263 1.00 0.00 H ATOM 30281 C12 OL 768 101.778 19.686 52.469 1.00 0.00 C ATOM 30282 H2R OL 768 102.038 18.683 52.812 1.00 0.00 H ATOM 30283 H2S OL 768 100.791 19.949 52.856 1.00 0.00 H ATOM 30284 C13 OL 768 101.817 19.693 50.933 1.00 0.00 C ATOM 30285 H3R OL 768 101.005 19.116 50.485 1.00 0.00 H ATOM 30286 H3S OL 768 101.758 20.735 50.610 1.00 0.00 H ATOM 30287 C14 OL 768 103.119 19.034 50.488 1.00 0.00 C ATOM 30288 H4R OL 768 103.201 19.360 49.449 1.00 0.00 H ATOM 30289 H4S OL 768 103.921 19.566 51.002 1.00 0.00 H ATOM 30290 C15 OL 768 103.203 17.500 50.636 1.00 0.00 C ATOM 30291 H5R OL 768 103.117 17.318 51.709 1.00 0.00 H ATOM 30292 H5S OL 768 102.216 17.219 50.264 1.00 0.00 H ATOM 30293 C16 OL 768 104.463 17.039 49.998 1.00 0.00 C ATOM 30294 H6R OL 768 105.355 17.500 50.427 1.00 0.00 H ATOM 30295 H6S OL 768 104.713 16.012 50.273 1.00 0.00 H ATOM 30296 C17 OL 768 104.424 17.100 48.495 1.00 0.00 C ATOM 30297 H7R OL 768 104.429 18.142 48.168 1.00 0.00 H ATOM 30298 H7S OL 768 105.375 16.791 48.057 1.00 0.00 H ATOM 30299 C18 OL 768 103.389 16.236 47.747 1.00 0.00 C ATOM 30300 H8R OL 768 103.511 15.218 48.123 1.00 0.00 H ATOM 30301 H8S OL 768 102.384 16.515 48.071 1.00 0.00 H ATOM 30302 C19 OL 768 103.529 16.546 46.287 1.00 0.00 C ATOM 30303 H9R OL 768 103.219 17.568 46.085 1.00 0.00 H ATOM 30304 C110 OL 768 103.862 15.642 45.313 1.00 0.00 C ATOM 30305 H10R OL 768 103.890 16.050 44.306 1.00 0.00 H ATOM 30306 C111 OL 768 104.173 14.189 45.427 1.00 0.00 C ATOM 30307 H11R OL 768 103.828 13.805 46.389 1.00 0.00 H ATOM 30308 H11S OL 768 103.584 13.579 44.739 1.00 0.00 H ATOM 30309 C112 OL 768 105.604 13.782 45.212 1.00 0.00 C ATOM 30310 H12R OL 768 105.770 12.702 45.213 1.00 0.00 H ATOM 30311 H12S OL 768 105.991 14.029 44.221 1.00 0.00 H ATOM 30312 C113 OL 768 106.638 14.343 46.218 1.00 0.00 C ATOM 30313 H13R OL 768 106.538 15.430 46.247 1.00 0.00 H ATOM 30314 H13S OL 768 106.310 14.020 47.208 1.00 0.00 H ATOM 30315 C114 OL 768 108.143 13.994 46.008 1.00 0.00 C ATOM 30316 H14R OL 768 108.211 12.912 46.139 1.00 0.00 H ATOM 30317 H14S OL 768 108.518 14.257 45.016 1.00 0.00 H ATOM 30318 C115 OL 768 108.931 14.593 47.178 1.00 0.00 C ATOM 30319 H15R OL 768 108.567 15.554 47.548 1.00 0.00 H ATOM 30320 H15S OL 768 108.718 13.931 48.019 1.00 0.00 H ATOM 30321 C116 OL 768 110.416 14.678 47.091 1.00 0.00 C ATOM 30322 H16R OL 768 110.749 14.909 48.106 1.00 0.00 H ATOM 30323 H16S OL 768 110.899 13.713 46.923 1.00 0.00 H ATOM 30324 C117 OL 768 110.870 15.778 46.103 1.00 0.00 C ATOM 30325 H17R OL 768 110.503 15.432 45.135 1.00 0.00 H ATOM 30326 H17S OL 768 110.270 16.668 46.306 1.00 0.00 H ATOM 30327 C118 OL 768 112.386 16.085 46.278 1.00 0.00 C ATOM 30328 H18R OL 768 112.764 16.945 45.721 1.00 0.00 H ATOM 30329 H18S OL 768 112.982 15.249 45.905 1.00 0.00 H ATOM 30330 H18T OL 768 112.755 16.314 47.280 1.00 0.00 H TER 30331 OL 768 ATOM 30331 C116 PA 769 68.553 97.658 40.474 1.00 0.00 C ATOM 30332 H16R PA 769 68.248 96.630 40.266 1.00 0.00 H ATOM 30333 H16S PA 769 69.619 97.672 40.239 1.00 0.00 H ATOM 30334 H16T PA 769 68.022 98.258 39.732 1.00 0.00 H ATOM 30335 C115 PA 769 68.139 98.135 41.846 1.00 0.00 C ATOM 30336 H15R PA 769 68.009 99.219 41.884 1.00 0.00 H ATOM 30337 H15S PA 769 68.973 97.943 42.525 1.00 0.00 H ATOM 30338 C114 PA 769 66.923 97.352 42.450 1.00 0.00 C ATOM 30339 H14R PA 769 67.388 96.457 42.871 1.00 0.00 H ATOM 30340 H14S PA 769 66.132 97.188 41.715 1.00 0.00 H ATOM 30341 C113 PA 769 66.232 98.100 43.642 1.00 0.00 C ATOM 30342 H13R PA 769 65.230 97.672 43.704 1.00 0.00 H ATOM 30343 H13S PA 769 65.980 99.137 43.410 1.00 0.00 H ATOM 30344 C112 PA 769 66.944 98.079 44.992 1.00 0.00 C ATOM 30345 H12R PA 769 68.007 98.285 44.855 1.00 0.00 H ATOM 30346 H12S PA 769 66.948 97.050 45.358 1.00 0.00 H ATOM 30347 C111 PA 769 66.133 98.884 46.004 1.00 0.00 C ATOM 30348 H11R PA 769 65.104 98.525 46.067 1.00 0.00 H ATOM 30349 H11S PA 769 66.031 99.937 45.732 1.00 0.00 H ATOM 30350 C110 PA 769 66.823 98.837 47.334 1.00 0.00 C ATOM 30351 H10R PA 769 67.809 99.304 47.382 1.00 0.00 H ATOM 30352 H10S PA 769 66.988 97.771 47.501 1.00 0.00 H ATOM 30353 C19 PA 769 66.023 99.637 48.367 1.00 0.00 C ATOM 30354 H9R PA 769 65.122 99.113 48.694 1.00 0.00 H ATOM 30355 H9S PA 769 65.764 100.583 47.887 1.00 0.00 H ATOM 30356 C18 PA 769 66.791 99.983 49.595 1.00 0.00 C ATOM 30357 H8R PA 769 67.828 99.970 49.256 1.00 0.00 H ATOM 30358 H8S PA 769 66.792 99.095 50.231 1.00 0.00 H ATOM 30359 C17 PA 769 66.386 101.300 50.273 1.00 0.00 C ATOM 30360 H7R PA 769 67.005 101.320 51.172 1.00 0.00 H ATOM 30361 H7S PA 769 65.410 101.302 50.764 1.00 0.00 H ATOM 30362 C16 PA 769 66.601 102.579 49.405 1.00 0.00 C ATOM 30363 H6R PA 769 66.217 102.516 48.385 1.00 0.00 H ATOM 30364 H6S PA 769 67.684 102.630 49.273 1.00 0.00 H ATOM 30365 C15 PA 769 66.112 103.792 50.248 1.00 0.00 C ATOM 30366 H5R PA 769 66.520 103.743 51.259 1.00 0.00 H ATOM 30367 H5S PA 769 65.036 103.720 50.418 1.00 0.00 H ATOM 30368 C14 PA 769 66.471 105.209 49.626 1.00 0.00 C ATOM 30369 H4R PA 769 65.782 105.377 48.797 1.00 0.00 H ATOM 30370 H4S PA 769 67.460 105.128 49.170 1.00 0.00 H ATOM 30371 C13 PA 769 66.352 106.284 50.680 1.00 0.00 C ATOM 30372 H3R PA 769 66.756 105.900 51.619 1.00 0.00 H ATOM 30373 H3S PA 769 65.295 106.431 50.912 1.00 0.00 H ATOM 30374 C12 PA 769 67.036 107.584 50.375 1.00 0.00 C ATOM 30375 H2R PA 769 68.022 107.514 49.910 1.00 0.00 H ATOM 30376 H2S PA 769 66.512 108.227 49.664 1.00 0.00 H ATOM 30377 C11 PGR 770 67.245 108.301 51.620 1.00 0.00 C ATOM 30378 O12 PGR 770 66.729 108.183 52.740 1.00 0.00 O ATOM 30379 O11 PGR 770 68.143 109.258 51.520 1.00 0.00 O ATOM 30380 C1 PGR 770 68.580 109.972 52.649 1.00 0.00 C ATOM 30381 HR PGR 770 67.729 110.385 53.195 1.00 0.00 H ATOM 30382 HS PGR 770 69.305 110.730 52.343 1.00 0.00 H ATOM 30383 C2 PGR 770 69.442 108.913 53.417 1.00 0.00 C ATOM 30384 HX PGR 770 68.829 108.076 53.761 1.00 0.00 H ATOM 30385 C3 PGR 770 70.000 109.556 54.702 1.00 0.00 C ATOM 30386 HA PGR 770 69.372 110.368 55.076 1.00 0.00 H ATOM 30387 HB PGR 770 70.981 109.911 54.376 1.00 0.00 H ATOM 30388 O31 PGR 770 70.326 108.573 55.770 1.00 0.00 O ATOM 30389 P31 PGR 770 70.767 109.100 57.257 1.00 0.00 P ATOM 30390 O32 PGR 770 69.562 109.865 57.983 1.00 0.00 O ATOM 30391 C31 PGR 770 68.462 109.190 58.530 1.00 0.00 C ATOM 30392 H1A PGR 770 68.681 108.678 59.470 1.00 0.00 H ATOM 30393 H1B PGR 770 68.130 108.365 57.894 1.00 0.00 H ATOM 30394 C32 PGR 770 67.256 110.073 58.806 1.00 0.00 C ATOM 30395 H2A PGR 770 66.961 110.511 57.849 1.00 0.00 H ATOM 30396 O35 PGR 770 67.607 111.124 59.692 1.00 0.00 O ATOM 30397 HO5A PGR 770 68.267 111.573 59.134 1.00 0.00 H ATOM 30398 C33 PGR 770 66.109 109.210 59.455 1.00 0.00 C ATOM 30399 H3A PGR 770 65.178 109.760 59.613 1.00 0.00 H ATOM 30400 H3B PGR 770 65.905 108.510 58.641 1.00 0.00 H ATOM 30401 O33 PGR 770 71.205 107.954 58.059 1.00 0.00 O ATOM 30402 O34 PGR 770 71.781 110.109 57.012 1.00 0.00 O ATOM 30403 O21 PGR 770 70.561 108.517 52.504 1.00 0.00 O ATOM 30404 C21 PGR 770 70.503 107.329 51.850 1.00 0.00 C ATOM 30405 O22 PGR 770 69.499 106.684 51.949 1.00 0.00 O ATOM 30406 O36 PGR 770 66.558 108.632 60.761 1.00 0.00 O ATOM 30407 HO6A PGR 770 66.850 109.438 61.222 1.00 0.00 H ATOM 30408 C12 OL 771 71.594 106.962 50.883 1.00 0.00 C ATOM 30409 H2R OL 771 72.428 106.690 51.534 1.00 0.00 H ATOM 30410 H2S OL 771 71.242 106.038 50.418 1.00 0.00 H ATOM 30411 C13 OL 771 71.911 108.039 49.893 1.00 0.00 C ATOM 30412 H3R OL 771 71.993 108.972 50.453 1.00 0.00 H ATOM 30413 H3S OL 771 72.917 107.941 49.478 1.00 0.00 H ATOM 30414 C14 OL 771 70.932 108.098 48.707 1.00 0.00 C ATOM 30415 H4R OL 771 71.101 107.369 47.911 1.00 0.00 H ATOM 30416 H4S OL 771 69.942 107.909 49.127 1.00 0.00 H ATOM 30417 C15 OL 771 70.979 109.526 48.038 1.00 0.00 C ATOM 30418 H5R OL 771 70.890 110.323 48.779 1.00 0.00 H ATOM 30419 H5S OL 771 71.976 109.464 47.596 1.00 0.00 H ATOM 30420 C16 OL 771 69.910 109.882 47.044 1.00 0.00 C ATOM 30421 H6R OL 771 70.046 109.287 46.139 1.00 0.00 H ATOM 30422 H6S OL 771 68.860 109.828 47.339 1.00 0.00 H ATOM 30423 C17 OL 771 69.949 111.304 46.654 1.00 0.00 C ATOM 30424 H7R OL 771 69.963 111.899 47.569 1.00 0.00 H ATOM 30425 H7S OL 771 70.895 111.514 46.150 1.00 0.00 H ATOM 30426 C18 OL 771 68.725 111.803 45.875 1.00 0.00 C ATOM 30427 H8R OL 771 67.862 111.643 46.525 1.00 0.00 H ATOM 30428 H8S OL 771 68.728 112.891 45.786 1.00 0.00 H ATOM 30429 C19 OL 771 68.730 111.091 44.553 1.00 0.00 C ATOM 30430 H9R OL 771 69.554 111.366 43.899 1.00 0.00 H ATOM 30431 C110 OL 771 67.689 110.331 44.093 1.00 0.00 C ATOM 30432 H10R OL 771 67.720 109.811 43.140 1.00 0.00 H ATOM 30433 C111 OL 771 66.406 110.052 44.816 1.00 0.00 C ATOM 30434 H11R OL 771 66.581 109.167 45.430 1.00 0.00 H ATOM 30435 H11S OL 771 66.040 110.861 45.452 1.00 0.00 H ATOM 30436 C112 OL 771 65.240 109.764 43.845 1.00 0.00 C ATOM 30437 H12R OL 771 65.303 110.476 43.020 1.00 0.00 H ATOM 30438 H12S OL 771 65.558 108.893 43.269 1.00 0.00 H ATOM 30439 C113 OL 771 63.832 109.863 44.386 1.00 0.00 C ATOM 30440 H13R OL 771 63.676 109.030 45.075 1.00 0.00 H ATOM 30441 H13S OL 771 63.750 110.706 45.076 1.00 0.00 H ATOM 30442 C114 OL 771 62.660 109.752 43.348 1.00 0.00 C ATOM 30443 H14R OL 771 62.580 110.594 42.657 1.00 0.00 H ATOM 30444 H14S OL 771 62.937 108.968 42.640 1.00 0.00 H ATOM 30445 C115 OL 771 61.262 109.424 43.921 1.00 0.00 C ATOM 30446 H15R OL 771 61.141 108.342 43.844 1.00 0.00 H ATOM 30447 H15S OL 771 61.184 109.702 44.974 1.00 0.00 H ATOM 30448 C116 OL 771 60.073 110.145 43.291 1.00 0.00 C ATOM 30449 H16R OL 771 59.183 109.822 43.835 1.00 0.00 H ATOM 30450 H16S OL 771 60.162 111.207 43.531 1.00 0.00 H ATOM 30451 C117 OL 771 59.613 110.021 41.845 1.00 0.00 C ATOM 30452 H17R OL 771 58.623 110.478 41.781 1.00 0.00 H ATOM 30453 H17S OL 771 60.402 110.544 41.300 1.00 0.00 H ATOM 30454 C118 OL 771 59.555 108.577 41.250 1.00 0.00 C ATOM 30455 H18R OL 771 58.817 107.987 41.798 1.00 0.00 H ATOM 30456 H18S OL 771 60.499 108.055 41.423 1.00 0.00 H ATOM 30457 H18T OL 771 59.342 108.529 40.180 1.00 0.00 H TER 30458 OL 771 ATOM 30458 C116 PA 772 28.289 106.197 39.803 1.00 0.00 C ATOM 30459 H16R PA 772 28.061 106.916 40.592 1.00 0.00 H ATOM 30460 H16S PA 772 28.713 106.733 38.951 1.00 0.00 H ATOM 30461 H16T PA 772 29.080 105.506 40.104 1.00 0.00 H ATOM 30462 C115 PA 772 26.982 105.528 39.314 1.00 0.00 C ATOM 30463 H15R PA 772 27.279 105.006 38.402 1.00 0.00 H ATOM 30464 H15S PA 772 26.207 106.244 39.033 1.00 0.00 H ATOM 30465 C114 PA 772 26.425 104.550 40.323 1.00 0.00 C ATOM 30466 H14R PA 772 27.193 103.842 40.641 1.00 0.00 H ATOM 30467 H14S PA 772 25.648 103.898 39.919 1.00 0.00 H ATOM 30468 C113 PA 772 25.659 105.147 41.442 1.00 0.00 C ATOM 30469 H13R PA 772 25.193 104.330 41.996 1.00 0.00 H ATOM 30470 H13S PA 772 24.821 105.748 41.084 1.00 0.00 H ATOM 30471 C112 PA 772 26.474 105.966 42.499 1.00 0.00 C ATOM 30472 H12R PA 772 26.907 106.822 41.978 1.00 0.00 H ATOM 30473 H12S PA 772 27.321 105.404 42.896 1.00 0.00 H ATOM 30474 C111 PA 772 25.665 106.555 43.659 1.00 0.00 C ATOM 30475 H11R PA 772 25.035 105.764 44.069 1.00 0.00 H ATOM 30476 H11S PA 772 25.025 107.313 43.202 1.00 0.00 H ATOM 30477 C110 PA 772 26.532 107.169 44.863 1.00 0.00 C ATOM 30478 H10R PA 772 27.215 106.453 45.324 1.00 0.00 H ATOM 30479 H10S PA 772 25.879 107.477 45.683 1.00 0.00 H ATOM 30480 C19 PA 772 27.542 108.176 44.294 1.00 0.00 C ATOM 30481 H9R PA 772 26.964 108.984 43.840 1.00 0.00 H ATOM 30482 H9S PA 772 28.085 107.618 43.529 1.00 0.00 H ATOM 30483 C18 PA 772 28.505 108.703 45.384 1.00 0.00 C ATOM 30484 H8R PA 772 29.190 109.186 44.684 1.00 0.00 H ATOM 30485 H8S PA 772 28.991 107.847 45.857 1.00 0.00 H ATOM 30486 C17 PA 772 27.969 109.606 46.468 1.00 0.00 C ATOM 30487 H7R PA 772 26.977 109.299 46.806 1.00 0.00 H ATOM 30488 H7S PA 772 27.952 110.620 46.063 1.00 0.00 H ATOM 30489 C16 PA 772 28.795 109.540 47.773 1.00 0.00 C ATOM 30490 H6R PA 772 29.860 109.715 47.608 1.00 0.00 H ATOM 30491 H6S PA 772 28.730 108.472 47.989 1.00 0.00 H ATOM 30492 C15 PA 772 28.235 110.423 48.878 1.00 0.00 C ATOM 30493 H5R PA 772 27.165 110.315 49.067 1.00 0.00 H ATOM 30494 H5S PA 772 28.423 111.499 48.853 1.00 0.00 H ATOM 30495 C14 PA 772 28.647 109.915 50.298 1.00 0.00 C ATOM 30496 H4R PA 772 29.732 110.034 50.275 1.00 0.00 H ATOM 30497 H4S PA 772 28.358 108.872 50.444 1.00 0.00 H ATOM 30498 C13 PA 772 28.007 110.607 51.506 1.00 0.00 C ATOM 30499 H3R PA 772 28.200 110.094 52.450 1.00 0.00 H ATOM 30500 H3S PA 772 26.926 110.602 51.354 1.00 0.00 H ATOM 30501 C12 PA 772 28.374 112.017 51.804 1.00 0.00 C ATOM 30502 H2R PA 772 28.181 112.743 51.012 1.00 0.00 H ATOM 30503 H2S PA 772 29.435 112.194 51.992 1.00 0.00 H ATOM 30504 C11 PC 773 27.562 112.495 52.976 1.00 0.00 C ATOM 30505 O12 PC 773 26.372 112.253 53.132 1.00 0.00 O ATOM 30506 O11 PC 773 28.235 113.280 53.919 1.00 0.00 O ATOM 30507 C1 PC 773 27.439 113.957 54.902 1.00 0.00 C ATOM 30508 HR PC 773 28.057 113.966 55.803 1.00 0.00 H ATOM 30509 HS PC 773 26.519 113.390 55.069 1.00 0.00 H ATOM 30510 C2 PC 773 27.219 115.414 54.470 1.00 0.00 C ATOM 30511 HX PC 773 28.172 115.799 54.100 1.00 0.00 H ATOM 30512 C3 PC 773 26.716 116.208 55.736 1.00 0.00 C ATOM 30513 HA PC 773 26.315 117.190 55.472 1.00 0.00 H ATOM 30514 HB PC 773 27.426 116.249 56.566 1.00 0.00 H ATOM 30515 O31 PC 773 25.577 115.615 56.206 1.00 0.00 O ATOM 30516 P31 PC 773 24.611 116.351 57.268 1.00 0.00 P ATOM 30517 O32 PC 773 23.591 115.168 57.682 1.00 0.00 O ATOM 30518 C31 PC 773 24.006 114.091 58.522 1.00 0.00 C ATOM 30519 H1A PC 773 24.674 114.398 59.331 1.00 0.00 H ATOM 30520 H1B PC 773 24.615 113.446 57.883 1.00 0.00 H ATOM 30521 C32 PC 773 22.695 113.455 58.991 1.00 0.00 C ATOM 30522 H2A PC 773 22.217 113.037 58.104 1.00 0.00 H ATOM 30523 H2B PC 773 22.067 114.245 59.406 1.00 0.00 H ATOM 30524 N31 PC 773 22.656 112.472 60.113 1.00 0.00 N ATOM 30525 C33 PC 773 21.396 111.624 59.934 1.00 0.00 C ATOM 30526 H3A PC 773 21.539 110.926 59.108 1.00 0.00 H ATOM 30527 H3B PC 773 20.510 112.242 59.781 1.00 0.00 H ATOM 30528 H3C PC 773 21.369 111.095 60.888 1.00 0.00 H ATOM 30529 C34 PC 773 23.743 111.517 60.208 1.00 0.00 C ATOM 30530 H4A PC 773 23.520 110.627 60.798 1.00 0.00 H ATOM 30531 H4B PC 773 24.545 111.995 60.773 1.00 0.00 H ATOM 30532 H4C PC 773 23.849 111.383 59.131 1.00 0.00 H ATOM 30533 C35 PC 773 22.635 113.240 61.332 1.00 0.00 C ATOM 30534 H5A PC 773 23.503 113.879 61.501 1.00 0.00 H ATOM 30535 H5B PC 773 22.398 112.627 62.203 1.00 0.00 H ATOM 30536 H5C PC 773 21.734 113.853 61.278 1.00 0.00 H ATOM 30537 O33 PC 773 25.386 116.691 58.452 1.00 0.00 O ATOM 30538 O34 PC 773 23.887 117.424 56.515 1.00 0.00 O ATOM 30539 O21 PC 773 26.222 115.482 53.365 1.00 0.00 O ATOM 30540 C21 PC 773 26.217 116.556 52.583 1.00 0.00 C ATOM 30541 O22 PC 773 26.742 117.621 52.894 1.00 0.00 O ATOM 30542 C12 OL 774 25.583 116.333 51.258 1.00 0.00 C ATOM 30543 H2R OL 774 24.493 116.310 51.327 1.00 0.00 H ATOM 30544 H2S OL 774 25.802 117.140 50.555 1.00 0.00 H ATOM 30545 C13 OL 774 26.152 115.002 50.732 1.00 0.00 C ATOM 30546 H3R OL 774 27.188 114.942 51.072 1.00 0.00 H ATOM 30547 H3S OL 774 25.747 114.101 51.199 1.00 0.00 H ATOM 30548 C14 OL 774 26.058 114.940 49.179 1.00 0.00 C ATOM 30549 H4R OL 774 25.018 115.178 48.947 1.00 0.00 H ATOM 30550 H4S OL 774 26.614 115.759 48.717 1.00 0.00 H ATOM 30551 C15 OL 774 26.599 113.682 48.455 1.00 0.00 C ATOM 30552 H5R OL 774 27.637 113.711 48.791 1.00 0.00 H ATOM 30553 H5S OL 774 26.172 112.752 48.837 1.00 0.00 H ATOM 30554 C16 OL 774 26.511 113.768 46.900 1.00 0.00 C ATOM 30555 H6R OL 774 27.068 114.580 46.428 1.00 0.00 H ATOM 30556 H6S OL 774 26.914 112.835 46.501 1.00 0.00 H ATOM 30557 C17 OL 774 25.104 113.873 46.307 1.00 0.00 C ATOM 30558 H7R OL 774 24.351 113.273 46.822 1.00 0.00 H ATOM 30559 H7S OL 774 24.641 114.814 46.611 1.00 0.00 H ATOM 30560 C18 OL 774 24.900 113.749 44.733 1.00 0.00 C ATOM 30561 H8R OL 774 23.842 113.800 44.465 1.00 0.00 H ATOM 30562 H8S OL 774 25.269 114.582 44.131 1.00 0.00 H ATOM 30563 C19 OL 774 25.484 112.485 44.179 1.00 0.00 C ATOM 30564 H9R OL 774 26.550 112.597 43.995 1.00 0.00 H ATOM 30565 C110 OL 774 24.851 111.316 44.056 1.00 0.00 C ATOM 30566 H10R OL 774 25.469 110.478 43.744 1.00 0.00 H ATOM 30567 C111 OL 774 23.369 111.061 44.096 1.00 0.00 C ATOM 30568 H11R OL 774 23.051 110.284 44.794 1.00 0.00 H ATOM 30569 H11S OL 774 22.869 111.948 44.490 1.00 0.00 H ATOM 30570 C112 OL 774 22.776 110.600 42.727 1.00 0.00 C ATOM 30571 H12R OL 774 23.230 109.677 42.359 1.00 0.00 H ATOM 30572 H12S OL 774 21.730 110.428 42.989 1.00 0.00 H ATOM 30573 C113 OL 774 22.683 111.680 41.593 1.00 0.00 C ATOM 30574 H13R OL 774 23.360 112.482 41.893 1.00 0.00 H ATOM 30575 H13S OL 774 23.180 111.450 40.648 1.00 0.00 H ATOM 30576 C114 OL 774 21.246 112.203 41.229 1.00 0.00 C ATOM 30577 H14R OL 774 20.559 111.432 40.875 1.00 0.00 H ATOM 30578 H14S OL 774 20.816 112.579 42.160 1.00 0.00 H ATOM 30579 C115 OL 774 21.158 113.440 40.320 1.00 0.00 C ATOM 30580 H15R OL 774 21.422 114.368 40.832 1.00 0.00 H ATOM 30581 H15S OL 774 21.900 113.342 39.526 1.00 0.00 H ATOM 30582 C116 OL 774 19.797 113.717 39.753 1.00 0.00 C ATOM 30583 H16R OL 774 19.560 112.901 39.067 1.00 0.00 H ATOM 30584 H16S OL 774 19.030 113.705 40.531 1.00 0.00 H ATOM 30585 C117 OL 774 19.813 114.993 38.918 1.00 0.00 C ATOM 30586 H17R OL 774 20.051 115.761 39.657 1.00 0.00 H ATOM 30587 H17S OL 774 20.684 114.935 38.262 1.00 0.00 H ATOM 30588 C118 OL 774 18.457 115.227 38.176 1.00 0.00 C ATOM 30589 H18R OL 774 17.638 115.262 38.898 1.00 0.00 H ATOM 30590 H18S OL 774 18.131 114.413 37.525 1.00 0.00 H ATOM 30591 H18T OL 774 18.498 116.174 37.634 1.00 0.00 H TER 30592 OL 774 ATOM 30592 C116 PA 775 21.087 64.997 37.950 1.00 0.00 C ATOM 30593 H16R PA 775 21.293 64.238 37.192 1.00 0.00 H ATOM 30594 H16S PA 775 21.252 66.017 37.598 1.00 0.00 H ATOM 30595 H16T PA 775 20.028 64.979 38.215 1.00 0.00 H ATOM 30596 C115 PA 775 22.043 64.960 39.185 1.00 0.00 C ATOM 30597 H15R PA 775 23.105 64.932 38.934 1.00 0.00 H ATOM 30598 H15S PA 775 21.930 63.974 39.639 1.00 0.00 H ATOM 30599 C114 PA 775 21.857 66.083 40.201 1.00 0.00 C ATOM 30600 H14R PA 775 20.803 66.209 40.453 1.00 0.00 H ATOM 30601 H14S PA 775 22.136 67.020 39.713 1.00 0.00 H ATOM 30602 C113 PA 775 22.738 65.959 41.496 1.00 0.00 C ATOM 30603 H13R PA 775 23.774 65.702 41.269 1.00 0.00 H ATOM 30604 H13S PA 775 22.291 65.095 41.992 1.00 0.00 H ATOM 30605 C112 PA 775 22.545 67.244 42.347 1.00 0.00 C ATOM 30606 H12R PA 775 21.475 67.441 42.438 1.00 0.00 H ATOM 30607 H12S PA 775 23.043 68.066 41.828 1.00 0.00 H ATOM 30608 C111 PA 775 23.251 67.134 43.698 1.00 0.00 C ATOM 30609 H11R PA 775 24.304 67.088 43.409 1.00 0.00 H ATOM 30610 H11S PA 775 23.035 66.203 44.225 1.00 0.00 H ATOM 30611 C110 PA 775 22.934 68.355 44.668 1.00 0.00 C ATOM 30612 H10R PA 775 23.499 69.248 44.397 1.00 0.00 H ATOM 30613 H10S PA 775 23.302 68.113 45.667 1.00 0.00 H ATOM 30614 C19 PA 775 21.470 68.760 44.822 1.00 0.00 C ATOM 30615 H9R PA 775 21.041 68.790 43.818 1.00 0.00 H ATOM 30616 H9S PA 775 21.550 69.736 45.307 1.00 0.00 H ATOM 30617 C18 PA 775 20.595 67.806 45.556 1.00 0.00 C ATOM 30618 H8R PA 775 20.980 67.704 46.573 1.00 0.00 H ATOM 30619 H8S PA 775 20.611 66.844 45.040 1.00 0.00 H ATOM 30620 C17 PA 775 19.123 68.301 45.775 1.00 0.00 C ATOM 30621 H7R PA 775 18.698 68.780 44.891 1.00 0.00 H ATOM 30622 H7S PA 775 19.186 69.193 46.403 1.00 0.00 H ATOM 30623 C16 PA 775 18.233 67.454 46.608 1.00 0.00 C ATOM 30624 H6R PA 775 18.488 66.435 46.310 1.00 0.00 H ATOM 30625 H6S PA 775 17.168 67.569 46.395 1.00 0.00 H ATOM 30626 C15 PA 775 18.475 67.493 48.204 1.00 0.00 C ATOM 30627 H5R PA 775 18.210 68.497 48.540 1.00 0.00 H ATOM 30628 H5S PA 775 19.559 67.387 48.280 1.00 0.00 H ATOM 30629 C14 PA 775 17.608 66.446 48.908 1.00 0.00 C ATOM 30630 H4R PA 775 17.851 65.470 48.482 1.00 0.00 H ATOM 30631 H4S PA 775 16.586 66.569 48.544 1.00 0.00 H ATOM 30632 C13 PA 775 17.504 66.432 50.368 1.00 0.00 C ATOM 30633 H3R PA 775 16.610 65.904 50.706 1.00 0.00 H ATOM 30634 H3S PA 775 17.360 67.432 50.781 1.00 0.00 H ATOM 30635 C12 PA 775 18.661 65.857 51.074 1.00 0.00 C ATOM 30636 H2R PA 775 19.557 66.423 50.814 1.00 0.00 H ATOM 30637 H2S PA 775 18.857 64.822 50.785 1.00 0.00 H ATOM 30638 C11 PC 776 18.406 65.848 52.567 1.00 0.00 C ATOM 30639 O12 PC 776 17.905 64.948 53.137 1.00 0.00 O ATOM 30640 O11 PC 776 18.672 67.024 53.166 1.00 0.00 O ATOM 30641 C1 PC 776 18.115 67.233 54.488 1.00 0.00 C ATOM 30642 HR PC 776 18.350 66.366 55.111 1.00 0.00 H ATOM 30643 HS PC 776 17.037 67.395 54.406 1.00 0.00 H ATOM 30644 C2 PC 776 18.651 68.548 55.222 1.00 0.00 C ATOM 30645 HX PC 776 19.726 68.605 55.033 1.00 0.00 H ATOM 30646 C3 PC 776 18.277 68.546 56.702 1.00 0.00 C ATOM 30647 HA PC 776 18.493 69.501 57.189 1.00 0.00 H ATOM 30648 HB PC 776 18.947 67.846 57.207 1.00 0.00 H ATOM 30649 O31 PC 776 16.962 68.193 56.873 1.00 0.00 O ATOM 30650 P31 PC 776 16.455 67.742 58.305 1.00 0.00 P ATOM 30651 O32 PC 776 16.445 68.929 59.307 1.00 0.00 O ATOM 30652 C31 PC 776 15.306 69.755 59.520 1.00 0.00 C ATOM 30653 H1A PC 776 14.555 69.159 60.045 1.00 0.00 H ATOM 30654 H1B PC 776 14.849 69.832 58.530 1.00 0.00 H ATOM 30655 C32 PC 776 15.707 71.087 60.119 1.00 0.00 C ATOM 30656 H2A PC 776 16.146 70.996 61.114 1.00 0.00 H ATOM 30657 H2B PC 776 14.820 71.718 60.182 1.00 0.00 H ATOM 30658 N31 PC 776 16.618 71.971 59.332 1.00 0.00 N ATOM 30659 C33 PC 776 17.993 71.475 59.411 1.00 0.00 C ATOM 30660 H3A PC 776 18.351 72.040 60.273 1.00 0.00 H ATOM 30661 H3B PC 776 18.568 71.794 58.541 1.00 0.00 H ATOM 30662 H3C PC 776 18.015 70.395 59.568 1.00 0.00 H ATOM 30663 C34 PC 776 16.249 71.910 57.898 1.00 0.00 C ATOM 30664 H4A PC 776 15.210 72.108 57.632 1.00 0.00 H ATOM 30665 H4B PC 776 16.559 70.915 57.573 1.00 0.00 H ATOM 30666 H4C PC 776 16.826 72.716 57.442 1.00 0.00 H ATOM 30667 C35 PC 776 16.631 73.432 59.821 1.00 0.00 C ATOM 30668 H5A PC 776 15.620 73.807 59.661 1.00 0.00 H ATOM 30669 H5B PC 776 17.409 73.941 59.250 1.00 0.00 H ATOM 30670 H5C PC 776 17.029 73.415 60.837 1.00 0.00 H ATOM 30671 O33 PC 776 15.086 67.238 58.085 1.00 0.00 O ATOM 30672 O34 PC 776 17.469 66.822 58.826 1.00 0.00 O ATOM 30673 O21 PC 776 18.060 69.668 54.507 1.00 0.00 O ATOM 30674 C21 PC 776 18.241 70.987 54.769 1.00 0.00 C ATOM 30675 O22 PC 776 18.795 71.400 55.713 1.00 0.00 O ATOM 30676 C12 OL 777 17.689 71.822 53.616 1.00 0.00 C ATOM 30677 H2R OL 777 18.322 72.693 53.433 1.00 0.00 H ATOM 30678 H2S OL 777 17.563 71.189 52.735 1.00 0.00 H ATOM 30679 C13 OL 777 16.405 72.526 53.968 1.00 0.00 C ATOM 30680 H3R OL 777 15.692 71.847 54.439 1.00 0.00 H ATOM 30681 H3S OL 777 16.608 73.425 54.554 1.00 0.00 H ATOM 30682 C14 OL 777 15.822 73.005 52.610 1.00 0.00 C ATOM 30683 H4R OL 777 16.535 73.641 52.081 1.00 0.00 H ATOM 30684 H4S OL 777 15.566 72.103 52.051 1.00 0.00 H ATOM 30685 C15 OL 777 14.481 73.728 52.757 1.00 0.00 C ATOM 30686 H5R OL 777 14.151 73.887 51.728 1.00 0.00 H ATOM 30687 H5S OL 777 13.759 73.152 53.339 1.00 0.00 H ATOM 30688 C16 OL 777 14.585 75.141 53.469 1.00 0.00 C ATOM 30689 H6R OL 777 13.624 75.622 53.667 1.00 0.00 H ATOM 30690 H6S OL 777 14.966 75.021 54.485 1.00 0.00 H ATOM 30691 C17 OL 777 15.462 76.165 52.704 1.00 0.00 C ATOM 30692 H7R OL 777 16.522 75.926 52.593 1.00 0.00 H ATOM 30693 H7S OL 777 15.143 76.151 51.660 1.00 0.00 H ATOM 30694 C18 OL 777 15.620 77.595 53.220 1.00 0.00 C ATOM 30695 H8R OL 777 14.635 78.020 53.420 1.00 0.00 H ATOM 30696 H8S OL 777 16.028 77.462 54.224 1.00 0.00 H ATOM 30697 C19 OL 777 16.345 78.525 52.350 1.00 0.00 C ATOM 30698 H9R OL 777 17.403 78.278 52.318 1.00 0.00 H ATOM 30699 C110 OL 777 15.939 79.590 51.721 1.00 0.00 C ATOM 30700 H10R OL 777 16.694 80.144 51.169 1.00 0.00 H ATOM 30701 C111 OL 777 14.521 80.195 51.718 1.00 0.00 C ATOM 30702 H11R OL 777 14.387 80.465 50.669 1.00 0.00 H ATOM 30703 H11S OL 777 13.804 79.456 52.082 1.00 0.00 H ATOM 30704 C112 OL 777 14.371 81.332 52.650 1.00 0.00 C ATOM 30705 H12R OL 777 14.671 81.083 53.670 1.00 0.00 H ATOM 30706 H12S OL 777 15.003 82.162 52.328 1.00 0.00 H ATOM 30707 C113 OL 777 12.971 81.952 52.641 1.00 0.00 C ATOM 30708 H13R OL 777 13.010 82.355 51.627 1.00 0.00 H ATOM 30709 H13S OL 777 12.226 81.161 52.534 1.00 0.00 H ATOM 30710 C114 OL 777 12.675 83.025 53.715 1.00 0.00 C ATOM 30711 H14R OL 777 12.667 82.554 54.700 1.00 0.00 H ATOM 30712 H14S OL 777 13.523 83.706 53.814 1.00 0.00 H ATOM 30713 C115 OL 777 11.404 83.837 53.618 1.00 0.00 C ATOM 30714 H15R OL 777 11.237 84.007 52.552 1.00 0.00 H ATOM 30715 H15S OL 777 10.585 83.186 53.930 1.00 0.00 H ATOM 30716 C116 OL 777 11.500 85.148 54.394 1.00 0.00 C ATOM 30717 H16R OL 777 11.800 84.867 55.405 1.00 0.00 H ATOM 30718 H16S OL 777 12.387 85.741 54.165 1.00 0.00 H ATOM 30719 C117 OL 777 10.242 86.035 54.563 1.00 0.00 C ATOM 30720 H17R OL 777 9.715 85.581 55.404 1.00 0.00 H ATOM 30721 H17S OL 777 10.530 87.066 54.777 1.00 0.00 H ATOM 30722 C118 OL 777 9.328 86.151 53.360 1.00 0.00 C ATOM 30723 H18R OL 777 8.538 86.904 53.401 1.00 0.00 H ATOM 30724 H18S OL 777 8.777 85.224 53.186 1.00 0.00 H ATOM 30725 H18T OL 777 9.970 86.090 52.479 1.00 0.00 H TER 30726 OL 777 ATOM 30726 C116 PA 778 12.198 14.557 40.379 1.00 0.00 C ATOM 30727 H16R PA 778 11.374 14.520 41.095 1.00 0.00 H ATOM 30728 H16S PA 778 11.826 14.217 39.411 1.00 0.00 H ATOM 30729 H16T PA 778 12.322 15.638 40.281 1.00 0.00 H ATOM 30730 C115 PA 778 13.469 13.790 40.901 1.00 0.00 C ATOM 30731 H15R PA 778 13.643 14.176 41.907 1.00 0.00 H ATOM 30732 H15S PA 778 14.409 13.984 40.381 1.00 0.00 H ATOM 30733 C114 PA 778 13.325 12.287 41.040 1.00 0.00 C ATOM 30734 H14R PA 778 12.848 11.959 40.114 1.00 0.00 H ATOM 30735 H14S PA 778 12.593 11.895 41.749 1.00 0.00 H ATOM 30736 C113 PA 778 14.620 11.536 41.411 1.00 0.00 C ATOM 30737 H13R PA 778 15.284 11.852 40.604 1.00 0.00 H ATOM 30738 H13S PA 778 14.487 10.456 41.324 1.00 0.00 H ATOM 30739 C112 PA 778 15.250 12.004 42.656 1.00 0.00 C ATOM 30740 H12R PA 778 14.583 11.960 43.519 1.00 0.00 H ATOM 30741 H12S PA 778 15.525 13.058 42.572 1.00 0.00 H ATOM 30742 C111 PA 778 16.401 11.051 43.022 1.00 0.00 C ATOM 30743 H11R PA 778 17.219 11.084 42.300 1.00 0.00 H ATOM 30744 H11S PA 778 16.087 10.027 43.232 1.00 0.00 H ATOM 30745 C110 PA 778 17.150 11.524 44.268 1.00 0.00 C ATOM 30746 H10R PA 778 17.451 12.567 44.155 1.00 0.00 H ATOM 30747 H10S PA 778 18.001 10.875 44.486 1.00 0.00 H ATOM 30748 C19 PA 778 16.391 11.523 45.594 1.00 0.00 C ATOM 30749 H9R PA 778 16.227 10.467 45.818 1.00 0.00 H ATOM 30750 H9S PA 778 15.398 11.976 45.579 1.00 0.00 H ATOM 30751 C18 PA 778 17.210 12.218 46.711 1.00 0.00 C ATOM 30752 H8R PA 778 17.502 13.257 46.545 1.00 0.00 H ATOM 30753 H8S PA 778 18.174 11.708 46.761 1.00 0.00 H ATOM 30754 C17 PA 778 16.566 12.164 48.154 1.00 0.00 C ATOM 30755 H7R PA 778 17.207 12.685 48.868 1.00 0.00 H ATOM 30756 H7S PA 778 16.556 11.087 48.334 1.00 0.00 H ATOM 30757 C16 PA 778 15.122 12.759 48.323 1.00 0.00 C ATOM 30758 H6R PA 778 14.426 12.274 47.637 1.00 0.00 H ATOM 30759 H6S PA 778 15.195 13.822 48.084 1.00 0.00 H ATOM 30760 C15 PA 778 14.646 12.548 49.751 1.00 0.00 C ATOM 30761 H5R PA 778 13.741 13.143 49.888 1.00 0.00 H ATOM 30762 H5S PA 778 15.382 13.079 50.356 1.00 0.00 H ATOM 30763 C14 PA 778 14.337 11.116 50.184 1.00 0.00 C ATOM 30764 H4R PA 778 15.152 10.453 49.888 1.00 0.00 H ATOM 30765 H4S PA 778 13.438 10.867 49.616 1.00 0.00 H ATOM 30766 C13 PA 778 13.926 10.802 51.657 1.00 0.00 C ATOM 30767 H3R PA 778 13.731 9.739 51.811 1.00 0.00 H ATOM 30768 H3S PA 778 12.954 11.227 51.915 1.00 0.00 H ATOM 30769 C12 PA 778 14.976 11.509 52.576 1.00 0.00 C ATOM 30770 H2R PA 778 14.881 12.590 52.456 1.00 0.00 H ATOM 30771 H2S PA 778 16.005 11.186 52.403 1.00 0.00 H ATOM 30772 C11 PC 779 14.738 11.158 54.024 1.00 0.00 C ATOM 30773 O12 PC 779 13.918 10.415 54.519 1.00 0.00 O ATOM 30774 O11 PC 779 15.663 11.818 54.761 1.00 0.00 O ATOM 30775 C1 PC 779 15.497 11.860 56.190 1.00 0.00 C ATOM 30776 HR PC 779 16.479 12.151 56.571 1.00 0.00 H ATOM 30777 HS PC 779 15.144 10.908 56.595 1.00 0.00 H ATOM 30778 C2 PC 779 14.426 12.889 56.709 1.00 0.00 C ATOM 30779 HX PC 779 14.777 13.857 56.344 1.00 0.00 H ATOM 30780 C3 PC 779 14.282 13.011 58.264 1.00 0.00 C ATOM 30781 HA PC 779 15.216 13.486 58.574 1.00 0.00 H ATOM 30782 HB PC 779 14.278 12.071 58.823 1.00 0.00 H ATOM 30783 O31 PC 779 13.262 14.022 58.518 1.00 0.00 O ATOM 30784 P31 PC 779 11.952 13.771 59.402 1.00 0.00 P ATOM 30785 O32 PC 779 12.245 14.624 60.689 1.00 0.00 O ATOM 30786 C31 PC 779 11.990 15.989 60.662 1.00 0.00 C ATOM 30787 H1A PC 779 10.935 16.178 60.448 1.00 0.00 H ATOM 30788 H1B PC 779 12.517 16.411 59.803 1.00 0.00 H ATOM 30789 C32 PC 779 12.458 16.686 61.959 1.00 0.00 C ATOM 30790 H2A PC 779 13.547 16.741 61.938 1.00 0.00 H ATOM 30791 H2B PC 779 12.109 16.114 62.820 1.00 0.00 H ATOM 30792 N31 PC 779 12.113 18.091 62.147 1.00 0.00 N ATOM 30793 C33 PC 779 12.746 18.545 63.496 1.00 0.00 C ATOM 30794 H3A PC 779 12.348 19.537 63.716 1.00 0.00 H ATOM 30795 H3B PC 779 13.816 18.716 63.371 1.00 0.00 H ATOM 30796 H3C PC 779 12.394 17.932 64.327 1.00 0.00 H ATOM 30797 C34 PC 779 12.506 18.928 61.023 1.00 0.00 C ATOM 30798 H4A PC 779 12.441 19.968 61.349 1.00 0.00 H ATOM 30799 H4B PC 779 11.754 18.650 60.283 1.00 0.00 H ATOM 30800 H4C PC 779 13.518 18.842 60.626 1.00 0.00 H ATOM 30801 C35 PC 779 10.670 18.082 62.331 1.00 0.00 C ATOM 30802 H5A PC 779 10.204 17.755 61.401 1.00 0.00 H ATOM 30803 H5B PC 779 10.359 19.126 62.399 1.00 0.00 H ATOM 30804 H5C PC 779 10.306 17.559 63.217 1.00 0.00 H ATOM 30805 O33 PC 779 10.804 14.381 58.732 1.00 0.00 O ATOM 30806 O34 PC 779 11.804 12.380 59.835 1.00 0.00 O ATOM 30807 O21 PC 779 13.112 12.513 56.227 1.00 0.00 O ATOM 30808 C21 PC 779 12.377 11.416 56.653 1.00 0.00 C ATOM 30809 O22 PC 779 12.749 10.733 57.584 1.00 0.00 O ATOM 30810 C12 OL 780 11.080 11.306 55.889 1.00 0.00 C ATOM 30811 H2R OL 780 11.382 11.166 54.849 1.00 0.00 H ATOM 30812 H2S OL 780 10.532 10.428 56.236 1.00 0.00 H ATOM 30813 C13 OL 780 10.176 12.554 55.872 1.00 0.00 C ATOM 30814 H3R OL 780 9.853 12.952 56.836 1.00 0.00 H ATOM 30815 H3S OL 780 10.837 13.356 55.536 1.00 0.00 H ATOM 30816 C14 OL 780 8.940 12.356 55.027 1.00 0.00 C ATOM 30817 H4R OL 780 9.086 11.638 54.218 1.00 0.00 H ATOM 30818 H4S OL 780 8.208 11.806 55.623 1.00 0.00 H ATOM 30819 C15 OL 780 8.327 13.677 54.475 1.00 0.00 C ATOM 30820 H5R OL 780 8.033 14.382 55.255 1.00 0.00 H ATOM 30821 H5S OL 780 9.106 14.281 54.005 1.00 0.00 H ATOM 30822 C16 OL 780 7.013 13.469 53.616 1.00 0.00 C ATOM 30823 H6R OL 780 6.288 12.847 54.146 1.00 0.00 H ATOM 30824 H6S OL 780 6.537 14.452 53.602 1.00 0.00 H ATOM 30825 C17 OL 780 7.207 12.876 52.123 1.00 0.00 C ATOM 30826 H7R OL 780 8.041 13.375 51.626 1.00 0.00 H ATOM 30827 H7S OL 780 7.338 11.797 52.229 1.00 0.00 H ATOM 30828 C18 OL 780 5.993 12.999 51.267 1.00 0.00 C ATOM 30829 H8R OL 780 5.124 12.741 51.876 1.00 0.00 H ATOM 30830 H8S OL 780 5.760 14.002 50.902 1.00 0.00 H ATOM 30831 C19 OL 780 6.129 12.243 49.975 1.00 0.00 C ATOM 30832 H9R OL 780 6.114 11.167 50.133 1.00 0.00 H ATOM 30833 C110 OL 780 6.302 12.783 48.778 1.00 0.00 C ATOM 30834 H10R OL 780 6.505 12.150 47.918 1.00 0.00 H ATOM 30835 C111 OL 780 6.306 14.209 48.382 1.00 0.00 C ATOM 30836 H11R OL 780 5.275 14.413 48.086 1.00 0.00 H ATOM 30837 H11S OL 780 6.578 14.852 49.221 1.00 0.00 H ATOM 30838 C112 OL 780 7.228 14.348 47.227 1.00 0.00 C ATOM 30839 H12R OL 780 8.100 13.746 47.490 1.00 0.00 H ATOM 30840 H12S OL 780 6.736 13.983 46.323 1.00 0.00 H ATOM 30841 C113 OL 780 7.746 15.797 47.007 1.00 0.00 C ATOM 30842 H13R OL 780 6.798 16.322 46.872 1.00 0.00 H ATOM 30843 H13S OL 780 8.273 16.382 47.764 1.00 0.00 H ATOM 30844 C114 OL 780 8.614 15.927 45.789 1.00 0.00 C ATOM 30845 H14R OL 780 9.619 15.520 45.923 1.00 0.00 H ATOM 30846 H14S OL 780 8.139 15.271 45.057 1.00 0.00 H ATOM 30847 C115 OL 780 8.592 17.350 45.213 1.00 0.00 C ATOM 30848 H15R OL 780 8.995 18.048 45.951 1.00 0.00 H ATOM 30849 H15S OL 780 9.231 17.324 44.328 1.00 0.00 H ATOM 30850 C116 OL 780 7.259 17.765 44.698 1.00 0.00 C ATOM 30851 H16R OL 780 6.705 16.873 44.400 1.00 0.00 H ATOM 30852 H16S OL 780 6.778 18.122 45.612 1.00 0.00 H ATOM 30853 C117 OL 780 7.309 18.701 43.534 1.00 0.00 C ATOM 30854 H17R OL 780 6.391 19.273 43.679 1.00 0.00 H ATOM 30855 H17S OL 780 8.079 19.468 43.636 1.00 0.00 H ATOM 30856 C118 OL 780 7.352 18.310 42.060 1.00 0.00 C ATOM 30857 H18R OL 780 6.530 17.607 41.907 1.00 0.00 H ATOM 30858 H18S OL 780 8.250 17.698 41.944 1.00 0.00 H ATOM 30859 H18T OL 780 7.236 18.994 41.217 1.00 0.00 H TER 30860 OL 780 ATOM 30860 C116 PA 781 -3.696 132.315 48.868 1.00 0.00 C ATOM 30861 H16R PA 781 -3.408 131.286 48.644 1.00 0.00 H ATOM 30862 H16S PA 781 -4.130 132.238 49.867 1.00 0.00 H ATOM 30863 H16T PA 781 -2.787 132.917 48.926 1.00 0.00 H ATOM 30864 C115 PA 781 -4.731 132.910 47.883 1.00 0.00 C ATOM 30865 H15R PA 781 -4.915 133.948 48.169 1.00 0.00 H ATOM 30866 H15S PA 781 -5.672 132.382 48.047 1.00 0.00 H ATOM 30867 C114 PA 781 -4.296 132.819 46.367 1.00 0.00 C ATOM 30868 H14R PA 781 -4.946 133.488 45.800 1.00 0.00 H ATOM 30869 H14S PA 781 -4.477 131.781 46.079 1.00 0.00 H ATOM 30870 C113 PA 781 -2.808 133.113 46.044 1.00 0.00 C ATOM 30871 H13R PA 781 -2.720 132.871 44.983 1.00 0.00 H ATOM 30872 H13S PA 781 -2.134 132.496 46.642 1.00 0.00 H ATOM 30873 C112 PA 781 -2.460 134.536 46.291 1.00 0.00 C ATOM 30874 H12R PA 781 -2.760 134.804 47.306 1.00 0.00 H ATOM 30875 H12S PA 781 -3.040 135.135 45.587 1.00 0.00 H ATOM 30876 C111 PA 781 -0.969 134.854 46.098 1.00 0.00 C ATOM 30877 H11R PA 781 -0.719 135.017 45.048 1.00 0.00 H ATOM 30878 H11S PA 781 -0.339 134.012 46.391 1.00 0.00 H ATOM 30879 C110 PA 781 -0.580 136.043 46.976 1.00 0.00 C ATOM 30880 H10R PA 781 -0.895 135.759 47.982 1.00 0.00 H ATOM 30881 H10S PA 781 -1.165 136.932 46.729 1.00 0.00 H ATOM 30882 C19 PA 781 0.941 136.293 47.020 1.00 0.00 C ATOM 30883 H9R PA 781 1.411 136.190 46.040 1.00 0.00 H ATOM 30884 H9S PA 781 1.510 135.597 47.640 1.00 0.00 H ATOM 30885 C18 PA 781 1.397 137.592 47.647 1.00 0.00 C ATOM 30886 H8R PA 781 0.987 138.390 47.025 1.00 0.00 H ATOM 30887 H8S PA 781 2.485 137.650 47.576 1.00 0.00 H ATOM 30888 C17 PA 781 0.944 137.707 49.132 1.00 0.00 C ATOM 30889 H7R PA 781 -0.114 137.973 49.181 1.00 0.00 H ATOM 30890 H7S PA 781 1.388 138.593 49.591 1.00 0.00 H ATOM 30891 C16 PA 781 1.268 136.592 50.096 1.00 0.00 C ATOM 30892 H6R PA 781 2.354 136.668 50.009 1.00 0.00 H ATOM 30893 H6S PA 781 0.913 135.638 49.699 1.00 0.00 H ATOM 30894 C15 PA 781 0.776 136.889 51.485 1.00 0.00 C ATOM 30895 H5R PA 781 -0.255 136.570 51.652 1.00 0.00 H ATOM 30896 H5S PA 781 0.719 137.937 51.784 1.00 0.00 H ATOM 30897 C14 PA 781 1.755 136.360 52.526 1.00 0.00 C ATOM 30898 H4R PA 781 2.782 136.731 52.541 1.00 0.00 H ATOM 30899 H4S PA 781 1.851 135.292 52.319 1.00 0.00 H ATOM 30900 C13 PA 781 1.089 136.337 53.901 1.00 0.00 C ATOM 30901 H3R PA 781 1.665 135.742 54.613 1.00 0.00 H ATOM 30902 H3S PA 781 0.101 135.890 53.774 1.00 0.00 H ATOM 30903 C12 PA 781 0.738 137.675 54.497 1.00 0.00 C ATOM 30904 H2R PA 781 0.020 137.559 55.312 1.00 0.00 H ATOM 30905 H2S PA 781 0.297 138.312 53.727 1.00 0.00 H ATOM 30906 C11 PGR 782 1.966 138.259 55.087 1.00 0.00 C ATOM 30907 O12 PGR 782 2.253 139.427 54.932 1.00 0.00 O ATOM 30908 O11 PGR 782 2.646 137.447 55.950 1.00 0.00 O ATOM 30909 C1 PGR 782 3.872 137.952 56.463 1.00 0.00 C ATOM 30910 HR PGR 782 4.082 137.507 57.440 1.00 0.00 H ATOM 30911 HS PGR 782 3.808 139.015 56.712 1.00 0.00 H ATOM 30912 C2 PGR 782 5.159 137.758 55.697 1.00 0.00 C ATOM 30913 HX PGR 782 5.116 136.806 55.162 1.00 0.00 H ATOM 30914 C3 PGR 782 6.530 137.861 56.435 1.00 0.00 C ATOM 30915 HA PGR 782 7.389 137.843 55.760 1.00 0.00 H ATOM 30916 HB PGR 782 6.653 136.961 57.043 1.00 0.00 H ATOM 30917 O31 PGR 782 6.742 139.028 57.221 1.00 0.00 O ATOM 30918 P31 PGR 782 7.789 138.946 58.321 1.00 0.00 P ATOM 30919 O32 PGR 782 7.254 137.806 59.292 1.00 0.00 O ATOM 30920 C31 PGR 782 6.133 138.052 60.096 1.00 0.00 C ATOM 30921 H1A PGR 782 5.426 138.611 59.479 1.00 0.00 H ATOM 30922 H1B PGR 782 6.378 138.755 60.896 1.00 0.00 H ATOM 30923 C32 PGR 782 5.467 136.736 60.583 1.00 0.00 C ATOM 30924 H2A PGR 782 6.090 136.116 61.232 1.00 0.00 H ATOM 30925 O35 PGR 782 5.120 135.810 59.511 1.00 0.00 O ATOM 30926 HO5A PGR 782 5.862 135.411 59.021 1.00 0.00 H ATOM 30927 C33 PGR 782 4.147 137.187 61.222 1.00 0.00 C ATOM 30928 H3A PGR 782 3.602 136.298 61.550 1.00 0.00 H ATOM 30929 H3B PGR 782 4.403 137.833 62.065 1.00 0.00 H ATOM 30930 O33 PGR 782 9.053 138.517 57.726 1.00 0.00 O ATOM 30931 O34 PGR 782 7.758 140.299 58.995 1.00 0.00 O ATOM 30932 O21 PGR 782 5.210 138.763 54.693 1.00 0.00 O ATOM 30933 C21 PGR 782 5.647 138.394 53.502 1.00 0.00 C ATOM 30934 O22 PGR 782 6.296 137.378 53.414 1.00 0.00 O ATOM 30935 O36 PGR 782 3.267 137.944 60.351 1.00 0.00 O ATOM 30936 HO6A PGR 782 2.911 137.387 59.636 1.00 0.00 H ATOM 30937 C12 OL 783 5.235 139.330 52.399 1.00 0.00 C ATOM 30938 H2R OL 783 4.220 139.673 52.607 1.00 0.00 H ATOM 30939 H2S OL 783 5.798 140.266 52.402 1.00 0.00 H ATOM 30940 C13 OL 783 5.240 138.820 50.920 1.00 0.00 C ATOM 30941 H3R OL 783 4.547 138.010 50.684 1.00 0.00 H ATOM 30942 H3S OL 783 4.775 139.581 50.289 1.00 0.00 H ATOM 30943 C14 OL 783 6.626 138.398 50.456 1.00 0.00 C ATOM 30944 H4R OL 783 7.315 139.201 50.726 1.00 0.00 H ATOM 30945 H4S OL 783 6.987 137.515 50.987 1.00 0.00 H ATOM 30946 C15 OL 783 6.812 138.076 48.934 1.00 0.00 C ATOM 30947 H5R OL 783 6.828 138.977 48.319 1.00 0.00 H ATOM 30948 H5S OL 783 7.825 137.688 48.808 1.00 0.00 H ATOM 30949 C16 OL 783 5.833 137.113 48.349 1.00 0.00 C ATOM 30950 H6R OL 783 5.768 136.262 49.030 1.00 0.00 H ATOM 30951 H6S OL 783 4.815 137.506 48.384 1.00 0.00 H ATOM 30952 C17 OL 783 6.124 136.663 46.921 1.00 0.00 C ATOM 30953 H7R OL 783 6.037 137.599 46.366 1.00 0.00 H ATOM 30954 H7S OL 783 7.124 136.249 46.774 1.00 0.00 H ATOM 30955 C18 OL 783 5.062 135.609 46.471 1.00 0.00 C ATOM 30956 H8R OL 783 5.030 134.867 47.271 1.00 0.00 H ATOM 30957 H8S OL 783 4.087 136.100 46.493 1.00 0.00 H ATOM 30958 C19 OL 783 5.470 134.990 45.196 1.00 0.00 C ATOM 30959 H9R OL 783 5.815 135.677 44.428 1.00 0.00 H ATOM 30960 C110 OL 783 5.272 133.706 44.889 1.00 0.00 C ATOM 30961 H10R OL 783 5.409 133.466 43.838 1.00 0.00 H ATOM 30962 C111 OL 783 5.031 132.608 45.939 1.00 0.00 C ATOM 30963 H11R OL 783 5.980 132.604 46.478 1.00 0.00 H ATOM 30964 H11S OL 783 4.312 132.789 46.741 1.00 0.00 H ATOM 30965 C112 OL 783 4.790 131.154 45.430 1.00 0.00 C ATOM 30966 H12R OL 783 5.587 130.653 44.877 1.00 0.00 H ATOM 30967 H12S OL 783 4.647 130.540 46.322 1.00 0.00 H ATOM 30968 C113 OL 783 3.467 131.163 44.581 1.00 0.00 C ATOM 30969 H13R OL 783 2.726 131.894 44.911 1.00 0.00 H ATOM 30970 H13S OL 783 3.749 131.597 43.620 1.00 0.00 H ATOM 30971 C114 OL 783 2.900 129.764 44.281 1.00 0.00 C ATOM 30972 H14R OL 783 3.812 129.264 43.946 1.00 0.00 H ATOM 30973 H14S OL 783 2.695 129.129 45.145 1.00 0.00 H ATOM 30974 C115 OL 783 1.757 129.612 43.258 1.00 0.00 C ATOM 30975 H15R OL 783 1.432 128.573 43.166 1.00 0.00 H ATOM 30976 H15S OL 783 0.911 130.200 43.617 1.00 0.00 H ATOM 30977 C116 OL 783 2.247 129.961 41.888 1.00 0.00 C ATOM 30978 H16R OL 783 3.323 129.786 41.830 1.00 0.00 H ATOM 30979 H16S OL 783 2.041 129.228 41.105 1.00 0.00 H ATOM 30980 C117 OL 783 1.635 131.267 41.353 1.00 0.00 C ATOM 30981 H17R OL 783 0.561 131.172 41.176 1.00 0.00 H ATOM 30982 H17S OL 783 1.613 131.994 42.168 1.00 0.00 H ATOM 30983 C118 OL 783 2.413 131.847 40.235 1.00 0.00 C ATOM 30984 H18R OL 783 1.683 132.199 39.503 1.00 0.00 H ATOM 30985 H18S OL 783 3.110 131.189 39.713 1.00 0.00 H ATOM 30986 H18T OL 783 3.152 132.553 40.622 1.00 0.00 H TER 30987 OL 783 ATOM 30987 C116 PA 784 85.969 125.146 40.456 1.00 0.00 C ATOM 30988 H16R PA 784 85.443 124.648 41.274 1.00 0.00 H ATOM 30989 H16S PA 784 87.036 125.121 40.687 1.00 0.00 H ATOM 30990 H16T PA 784 85.761 124.574 39.550 1.00 0.00 H ATOM 30991 C115 PA 784 85.576 126.613 40.221 1.00 0.00 C ATOM 30992 H15R PA 784 84.631 126.673 39.678 1.00 0.00 H ATOM 30993 H15S PA 784 86.302 127.139 39.598 1.00 0.00 H ATOM 30994 C114 PA 784 85.148 127.272 41.617 1.00 0.00 C ATOM 30995 H14R PA 784 86.063 127.344 42.209 1.00 0.00 H ATOM 30996 H14S PA 784 84.450 126.671 42.205 1.00 0.00 H ATOM 30997 C113 PA 784 84.588 128.678 41.473 1.00 0.00 C ATOM 30998 H13R PA 784 83.775 128.528 40.759 1.00 0.00 H ATOM 30999 H13S PA 784 85.241 129.384 40.956 1.00 0.00 H ATOM 31000 C112 PA 784 84.133 129.130 42.845 1.00 0.00 C ATOM 31001 H12R PA 784 84.950 129.173 43.568 1.00 0.00 H ATOM 31002 H12S PA 784 83.433 128.377 43.213 1.00 0.00 H ATOM 31003 C111 PA 784 83.345 130.457 42.712 1.00 0.00 C ATOM 31004 H11R PA 784 83.038 130.483 41.664 1.00 0.00 H ATOM 31005 H11S PA 784 84.013 131.308 42.864 1.00 0.00 H ATOM 31006 C110 PA 784 82.081 130.620 43.581 1.00 0.00 C ATOM 31007 H10R PA 784 81.235 130.002 43.272 1.00 0.00 H ATOM 31008 H10S PA 784 81.696 131.633 43.450 1.00 0.00 H ATOM 31009 C19 PA 784 82.199 130.258 45.020 1.00 0.00 C ATOM 31010 H9R PA 784 83.018 130.897 45.354 1.00 0.00 H ATOM 31011 H9S PA 784 82.485 129.205 45.065 1.00 0.00 H ATOM 31012 C18 PA 784 80.999 130.753 45.823 1.00 0.00 C ATOM 31013 H8R PA 784 80.066 130.255 45.551 1.00 0.00 H ATOM 31014 H8S PA 784 80.868 131.812 45.593 1.00 0.00 H ATOM 31015 C17 PA 784 81.174 130.716 47.366 1.00 0.00 C ATOM 31016 H7R PA 784 81.900 131.451 47.719 1.00 0.00 H ATOM 31017 H7S PA 784 81.561 129.789 47.795 1.00 0.00 H ATOM 31018 C16 PA 784 79.900 130.919 48.060 1.00 0.00 C ATOM 31019 H6R PA 784 79.122 130.354 47.541 1.00 0.00 H ATOM 31020 H6S PA 784 79.631 131.977 48.076 1.00 0.00 H ATOM 31021 C15 PA 784 79.681 130.421 49.469 1.00 0.00 C ATOM 31022 H5R PA 784 79.793 129.339 49.561 1.00 0.00 H ATOM 31023 H5S PA 784 78.661 130.590 49.820 1.00 0.00 H ATOM 31024 C14 PA 784 80.548 131.085 50.511 1.00 0.00 C ATOM 31025 H4R PA 784 80.266 132.134 50.622 1.00 0.00 H ATOM 31026 H4S PA 784 81.576 130.996 50.153 1.00 0.00 H ATOM 31027 C13 PA 784 80.505 130.489 51.947 1.00 0.00 C ATOM 31028 H3R PA 784 81.278 130.856 52.626 1.00 0.00 H ATOM 31029 H3S PA 784 80.642 129.405 51.944 1.00 0.00 H ATOM 31030 C12 PA 784 79.069 130.667 52.567 1.00 0.00 C ATOM 31031 H2R PA 784 78.875 131.739 52.637 1.00 0.00 H ATOM 31032 H2S PA 784 78.436 130.229 51.792 1.00 0.00 H ATOM 31033 C11 PGR 785 78.918 129.903 53.808 1.00 0.00 C ATOM 31034 O12 PGR 785 77.875 129.454 54.151 1.00 0.00 O ATOM 31035 O11 PGR 785 80.075 129.863 54.480 1.00 0.00 O ATOM 31036 C1 PGR 785 80.161 129.004 55.678 1.00 0.00 C ATOM 31037 HR PGR 785 79.497 129.473 56.409 1.00 0.00 H ATOM 31038 HS PGR 785 81.164 129.037 56.110 1.00 0.00 H ATOM 31039 C2 PGR 785 79.871 127.533 55.340 1.00 0.00 C ATOM 31040 HX PGR 785 78.927 127.456 54.794 1.00 0.00 H ATOM 31041 C3 PGR 785 79.752 126.649 56.578 1.00 0.00 C ATOM 31042 HA PGR 785 79.584 125.596 56.342 1.00 0.00 H ATOM 31043 HB PGR 785 78.883 127.054 57.104 1.00 0.00 H ATOM 31044 O31 PGR 785 80.832 126.724 57.486 1.00 0.00 O ATOM 31045 P31 PGR 785 80.775 126.191 59.004 1.00 0.00 P ATOM 31046 O32 PGR 785 79.970 127.303 59.856 1.00 0.00 O ATOM 31047 C31 PGR 785 78.637 127.035 60.233 1.00 0.00 C ATOM 31048 H1A PGR 785 78.632 126.362 61.095 1.00 0.00 H ATOM 31049 H1B PGR 785 78.155 126.510 59.405 1.00 0.00 H ATOM 31050 C32 PGR 785 77.852 128.293 60.625 1.00 0.00 C ATOM 31051 H2A PGR 785 76.778 128.107 60.699 1.00 0.00 H ATOM 31052 O35 PGR 785 78.066 129.261 59.540 1.00 0.00 O ATOM 31053 HO5A PGR 785 77.215 129.338 59.073 1.00 0.00 H ATOM 31054 C33 PGR 785 78.456 128.872 61.926 1.00 0.00 C ATOM 31055 H3A PGR 785 78.465 128.057 62.654 1.00 0.00 H ATOM 31056 H3B PGR 785 79.468 129.248 61.758 1.00 0.00 H ATOM 31057 O33 PGR 785 80.063 124.910 59.021 1.00 0.00 O ATOM 31058 O34 PGR 785 82.155 126.313 59.469 1.00 0.00 O ATOM 31059 O21 PGR 785 80.970 127.013 54.529 1.00 0.00 O ATOM 31060 C21 PGR 785 80.833 125.803 53.914 1.00 0.00 C ATOM 31061 O22 PGR 785 79.987 124.917 54.189 1.00 0.00 O ATOM 31062 O36 PGR 785 77.636 129.993 62.360 1.00 0.00 O ATOM 31063 HO6A PGR 785 77.452 130.466 61.528 1.00 0.00 H ATOM 31064 C12 OL 786 81.922 125.517 52.912 1.00 0.00 C ATOM 31065 H2R OL 786 82.889 125.668 53.396 1.00 0.00 H ATOM 31066 H2S OL 786 81.852 124.455 52.667 1.00 0.00 H ATOM 31067 C13 OL 786 81.735 126.358 51.607 1.00 0.00 C ATOM 31068 H3R OL 786 81.019 125.944 50.894 1.00 0.00 H ATOM 31069 H3S OL 786 81.418 127.368 51.874 1.00 0.00 H ATOM 31070 C14 OL 786 82.990 126.429 50.745 1.00 0.00 C ATOM 31071 H4R OL 786 83.821 126.912 51.263 1.00 0.00 H ATOM 31072 H4S OL 786 83.456 125.444 50.675 1.00 0.00 H ATOM 31073 C15 OL 786 82.753 127.043 49.377 1.00 0.00 C ATOM 31074 H5R OL 786 82.152 127.940 49.539 1.00 0.00 H ATOM 31075 H5S OL 786 83.673 127.497 49.003 1.00 0.00 H ATOM 31076 C16 OL 786 82.190 125.993 48.382 1.00 0.00 C ATOM 31077 H6R OL 786 82.925 125.206 48.202 1.00 0.00 H ATOM 31078 H6S OL 786 81.251 125.615 48.793 1.00 0.00 H ATOM 31079 C17 OL 786 81.800 126.720 47.142 1.00 0.00 C ATOM 31080 H7R OL 786 81.057 127.480 47.390 1.00 0.00 H ATOM 31081 H7S OL 786 82.628 127.330 46.774 1.00 0.00 H ATOM 31082 C18 OL 786 81.157 125.854 46.019 1.00 0.00 C ATOM 31083 H8R OL 786 80.344 125.344 46.540 1.00 0.00 H ATOM 31084 H8S OL 786 80.786 126.522 45.239 1.00 0.00 H ATOM 31085 C19 OL 786 82.101 124.790 45.462 1.00 0.00 C ATOM 31086 H9R OL 786 82.664 124.228 46.203 1.00 0.00 H ATOM 31087 C110 OL 786 82.279 124.543 44.152 1.00 0.00 C ATOM 31088 H10R OL 786 83.031 123.787 43.941 1.00 0.00 H ATOM 31089 C111 OL 786 81.493 125.093 43.008 1.00 0.00 C ATOM 31090 H11R OL 786 80.624 125.532 43.503 1.00 0.00 H ATOM 31091 H11S OL 786 82.074 125.917 42.589 1.00 0.00 H ATOM 31092 C112 OL 786 81.106 124.152 41.918 1.00 0.00 C ATOM 31093 H12R OL 786 80.578 123.246 42.220 1.00 0.00 H ATOM 31094 H12S OL 786 80.443 124.742 41.282 1.00 0.00 H ATOM 31095 C113 OL 786 82.260 123.871 40.943 1.00 0.00 C ATOM 31096 H13R OL 786 82.882 124.767 41.009 1.00 0.00 H ATOM 31097 H13S OL 786 82.881 123.023 41.241 1.00 0.00 H ATOM 31098 C114 OL 786 81.807 123.434 39.569 1.00 0.00 C ATOM 31099 H14R OL 786 81.546 122.374 39.585 1.00 0.00 H ATOM 31100 H14S OL 786 80.834 123.885 39.363 1.00 0.00 H ATOM 31101 C115 OL 786 82.939 123.613 38.518 1.00 0.00 C ATOM 31102 H15R OL 786 83.192 124.666 38.651 1.00 0.00 H ATOM 31103 H15S OL 786 83.753 122.961 38.843 1.00 0.00 H ATOM 31104 C116 OL 786 82.654 123.146 37.058 1.00 0.00 C ATOM 31105 H16R OL 786 82.599 122.056 37.057 1.00 0.00 H ATOM 31106 H16S OL 786 81.664 123.473 36.734 1.00 0.00 H ATOM 31107 C117 OL 786 83.756 123.664 36.093 1.00 0.00 C ATOM 31108 H17R OL 786 83.658 124.750 36.135 1.00 0.00 H ATOM 31109 H17S OL 786 84.746 123.278 36.346 1.00 0.00 H ATOM 31110 C118 OL 786 83.487 123.161 34.669 1.00 0.00 C ATOM 31111 H18R OL 786 82.425 123.156 34.413 1.00 0.00 H ATOM 31112 H18S OL 786 83.884 122.171 34.438 1.00 0.00 H ATOM 31113 H18T OL 786 83.838 123.915 33.961 1.00 0.00 H TER 31114 OL 786 ATOM 31114 C116 PA 787 116.761 130.822 38.661 1.00 0.00 C ATOM 31115 H16R PA 787 117.725 130.674 39.153 1.00 0.00 H ATOM 31116 H16S PA 787 117.028 131.322 37.727 1.00 0.00 H ATOM 31117 H16T PA 787 116.432 129.865 38.250 1.00 0.00 H ATOM 31118 C115 PA 787 115.719 131.485 39.494 1.00 0.00 C ATOM 31119 H15R PA 787 114.925 131.548 38.746 1.00 0.00 H ATOM 31120 H15S PA 787 116.017 132.492 39.794 1.00 0.00 H ATOM 31121 C114 PA 787 115.197 130.603 40.662 1.00 0.00 C ATOM 31122 H14R PA 787 115.953 130.439 41.432 1.00 0.00 H ATOM 31123 H14S PA 787 114.932 129.625 40.254 1.00 0.00 H ATOM 31124 C113 PA 787 113.960 131.098 41.436 1.00 0.00 C ATOM 31125 H13R PA 787 113.689 130.331 42.164 1.00 0.00 H ATOM 31126 H13S PA 787 113.242 131.365 40.658 1.00 0.00 H ATOM 31127 C112 PA 787 114.358 132.291 42.344 1.00 0.00 C ATOM 31128 H12R PA 787 114.887 133.077 41.801 1.00 0.00 H ATOM 31129 H12S PA 787 115.112 131.877 43.017 1.00 0.00 H ATOM 31130 C111 PA 787 113.294 132.858 43.289 1.00 0.00 C ATOM 31131 H11R PA 787 112.569 132.090 43.567 1.00 0.00 H ATOM 31132 H11S PA 787 112.793 133.629 42.701 1.00 0.00 H ATOM 31133 C110 PA 787 113.887 133.619 44.418 1.00 0.00 C ATOM 31134 H10R PA 787 114.480 134.441 44.011 1.00 0.00 H ATOM 31135 H10S PA 787 114.532 132.924 44.960 1.00 0.00 H ATOM 31136 C19 PA 787 112.804 134.264 45.286 1.00 0.00 C ATOM 31137 H9R PA 787 112.127 133.574 45.794 1.00 0.00 H ATOM 31138 H9S PA 787 112.069 134.898 44.785 1.00 0.00 H ATOM 31139 C18 PA 787 113.394 135.039 46.422 1.00 0.00 C ATOM 31140 H8R PA 787 113.939 135.726 45.770 1.00 0.00 H ATOM 31141 H8S PA 787 114.049 134.348 46.955 1.00 0.00 H ATOM 31142 C17 PA 787 112.437 135.652 47.380 1.00 0.00 C ATOM 31143 H7R PA 787 111.706 134.901 47.686 1.00 0.00 H ATOM 31144 H7S PA 787 111.885 136.376 46.777 1.00 0.00 H ATOM 31145 C16 PA 787 113.007 136.433 48.564 1.00 0.00 C ATOM 31146 H6R PA 787 113.614 137.214 48.100 1.00 0.00 H ATOM 31147 H6S PA 787 113.763 135.885 49.129 1.00 0.00 H ATOM 31148 C15 PA 787 112.055 136.961 49.653 1.00 0.00 C ATOM 31149 H5R PA 787 111.240 136.249 49.803 1.00 0.00 H ATOM 31150 H5S PA 787 111.609 137.911 49.352 1.00 0.00 H ATOM 31151 C14 PA 787 112.793 137.270 50.952 1.00 0.00 C ATOM 31152 H4R PA 787 113.484 138.103 50.813 1.00 0.00 H ATOM 31153 H4S PA 787 113.338 136.361 51.214 1.00 0.00 H ATOM 31154 C13 PA 787 111.705 137.591 51.979 1.00 0.00 C ATOM 31155 H3R PA 787 111.279 136.602 52.154 1.00 0.00 H ATOM 31156 H3S PA 787 110.941 138.219 51.516 1.00 0.00 H ATOM 31157 C12 PA 787 112.265 138.265 53.286 1.00 0.00 C ATOM 31158 H2R PA 787 112.959 139.080 53.072 1.00 0.00 H ATOM 31159 H2S PA 787 112.827 137.568 53.911 1.00 0.00 H ATOM 31160 C11 PC 788 111.175 138.875 54.171 1.00 0.00 C ATOM 31161 O12 PC 788 111.428 139.892 54.762 1.00 0.00 O ATOM 31162 O11 PC 788 110.058 138.115 54.340 1.00 0.00 O ATOM 31163 C1 PC 788 109.242 138.503 55.437 1.00 0.00 C ATOM 31164 HR PC 788 109.788 138.777 56.344 1.00 0.00 H ATOM 31165 HS PC 788 108.660 137.629 55.742 1.00 0.00 H ATOM 31166 C2 PC 788 108.251 139.561 54.950 1.00 0.00 C ATOM 31167 HX PC 788 108.747 140.474 54.611 1.00 0.00 H ATOM 31168 C3 PC 788 107.142 139.865 56.040 1.00 0.00 C ATOM 31169 HA PC 788 106.327 140.387 55.532 1.00 0.00 H ATOM 31170 HB PC 788 107.535 140.505 56.834 1.00 0.00 H ATOM 31171 O31 PC 788 106.778 138.658 56.607 1.00 0.00 O ATOM 31172 P31 PC 788 105.842 138.576 57.877 1.00 0.00 P ATOM 31173 O32 PC 788 106.800 138.768 59.140 1.00 0.00 O ATOM 31174 C31 PC 788 107.873 137.909 59.381 1.00 0.00 C ATOM 31175 H1A PC 788 108.522 137.796 58.509 1.00 0.00 H ATOM 31176 H1B PC 788 107.629 136.905 59.738 1.00 0.00 H ATOM 31177 C32 PC 788 108.663 138.640 60.451 1.00 0.00 C ATOM 31178 H2A PC 788 108.756 139.713 60.277 1.00 0.00 H ATOM 31179 H2B PC 788 109.689 138.268 60.439 1.00 0.00 H ATOM 31180 N31 PC 788 108.200 138.628 61.838 1.00 0.00 N ATOM 31181 C33 PC 788 109.342 139.111 62.703 1.00 0.00 C ATOM 31182 H3A PC 788 109.323 138.737 63.728 1.00 0.00 H ATOM 31183 H3B PC 788 109.239 140.196 62.743 1.00 0.00 H ATOM 31184 H3C PC 788 110.237 138.809 62.157 1.00 0.00 H ATOM 31185 C34 PC 788 107.106 139.489 62.106 1.00 0.00 C ATOM 31186 H4A PC 788 107.517 140.477 61.896 1.00 0.00 H ATOM 31187 H4B PC 788 106.893 139.454 63.175 1.00 0.00 H ATOM 31188 H4C PC 788 106.195 139.251 61.554 1.00 0.00 H ATOM 31189 C35 PC 788 107.971 137.269 62.409 1.00 0.00 C ATOM 31190 H5A PC 788 107.970 137.241 63.500 1.00 0.00 H ATOM 31191 H5B PC 788 108.816 136.620 62.176 1.00 0.00 H ATOM 31192 H5C PC 788 107.072 136.862 61.943 1.00 0.00 H ATOM 31193 O33 PC 788 104.943 139.722 57.944 1.00 0.00 O ATOM 31194 O34 PC 788 105.294 137.208 57.979 1.00 0.00 O ATOM 31195 O21 PC 788 107.589 138.886 53.771 1.00 0.00 O ATOM 31196 C21 PC 788 106.881 139.653 52.974 1.00 0.00 C ATOM 31197 O22 PC 788 106.545 140.818 53.204 1.00 0.00 O ATOM 31198 C12 OL 789 106.412 138.901 51.716 1.00 0.00 C ATOM 31199 H2R OL 789 105.880 138.007 52.046 1.00 0.00 H ATOM 31200 H2S OL 789 105.675 139.542 51.228 1.00 0.00 H ATOM 31201 C13 OL 789 107.697 138.420 50.901 1.00 0.00 C ATOM 31202 H3R OL 789 107.971 139.164 50.150 1.00 0.00 H ATOM 31203 H3S OL 789 108.518 137.977 51.467 1.00 0.00 H ATOM 31204 C14 OL 789 107.263 137.326 49.929 1.00 0.00 C ATOM 31205 H4R OL 789 106.940 136.469 50.524 1.00 0.00 H ATOM 31206 H4S OL 789 106.412 137.666 49.335 1.00 0.00 H ATOM 31207 C15 OL 789 108.278 136.957 48.889 1.00 0.00 C ATOM 31208 H5R OL 789 109.204 136.558 49.310 1.00 0.00 H ATOM 31209 H5S OL 789 107.732 136.249 48.262 1.00 0.00 H ATOM 31210 C16 OL 789 108.937 138.072 48.065 1.00 0.00 C ATOM 31211 H6R OL 789 109.472 138.843 48.622 1.00 0.00 H ATOM 31212 H6S OL 789 109.729 137.554 47.521 1.00 0.00 H ATOM 31213 C17 OL 789 107.873 138.762 47.247 1.00 0.00 C ATOM 31214 H7R OL 789 107.396 139.367 48.020 1.00 0.00 H ATOM 31215 H7S OL 789 108.250 139.599 46.656 1.00 0.00 H ATOM 31216 C18 OL 789 106.857 138.153 46.378 1.00 0.00 C ATOM 31217 H8R OL 789 107.337 137.497 45.649 1.00 0.00 H ATOM 31218 H8S OL 789 106.208 137.543 47.010 1.00 0.00 H ATOM 31219 C19 OL 789 105.896 139.053 45.651 1.00 0.00 C ATOM 31220 H9R OL 789 106.317 139.305 44.681 1.00 0.00 H ATOM 31221 C110 OL 789 104.893 139.647 46.296 1.00 0.00 C ATOM 31222 H10R OL 789 104.378 140.341 45.637 1.00 0.00 H ATOM 31223 C111 OL 789 104.298 139.425 47.620 1.00 0.00 C ATOM 31224 H11R OL 789 104.782 138.758 48.336 1.00 0.00 H ATOM 31225 H11S OL 789 104.289 140.389 48.132 1.00 0.00 H ATOM 31226 C112 OL 789 102.809 139.131 47.704 1.00 0.00 C ATOM 31227 H12R OL 789 102.433 139.611 48.610 1.00 0.00 H ATOM 31228 H12S OL 789 102.152 139.550 46.940 1.00 0.00 H ATOM 31229 C113 OL 789 102.495 137.641 47.680 1.00 0.00 C ATOM 31230 H13R OL 789 101.462 137.554 47.338 1.00 0.00 H ATOM 31231 H13S OL 789 102.984 137.228 46.795 1.00 0.00 H ATOM 31232 C114 OL 789 102.759 136.874 49.036 1.00 0.00 C ATOM 31233 H14R OL 789 103.698 137.161 49.514 1.00 0.00 H ATOM 31234 H14S OL 789 102.119 137.227 49.847 1.00 0.00 H ATOM 31235 C115 OL 789 102.857 135.333 48.937 1.00 0.00 C ATOM 31236 H15R OL 789 101.824 134.980 48.894 1.00 0.00 H ATOM 31237 H15S OL 789 103.208 134.936 47.983 1.00 0.00 H ATOM 31238 C116 OL 789 103.659 134.687 50.071 1.00 0.00 C ATOM 31239 H16R OL 789 104.677 134.886 49.731 1.00 0.00 H ATOM 31240 H16S OL 789 103.424 135.243 50.982 1.00 0.00 H ATOM 31241 C117 OL 789 103.339 133.240 50.387 1.00 0.00 C ATOM 31242 H17R OL 789 103.913 132.992 51.282 1.00 0.00 H ATOM 31243 H17S OL 789 102.327 133.237 50.797 1.00 0.00 H ATOM 31244 C118 OL 789 103.702 132.266 49.254 1.00 0.00 C ATOM 31245 H18R OL 789 103.613 131.242 49.622 1.00 0.00 H ATOM 31246 H18S OL 789 104.637 132.475 48.731 1.00 0.00 H ATOM 31247 H18T OL 789 102.966 132.236 48.447 1.00 0.00 H TER 31248 OL 789 ATOM 31248 C116 PA 790 114.180 11.734 46.224 1.00 0.00 C ATOM 31249 H16R PA 790 114.150 12.634 46.843 1.00 0.00 H ATOM 31250 H16S PA 790 113.245 11.187 46.361 1.00 0.00 H ATOM 31251 H16T PA 790 114.116 12.115 45.203 1.00 0.00 H ATOM 31252 C115 PA 790 115.481 10.938 46.437 1.00 0.00 C ATOM 31253 H15R PA 790 115.355 10.576 47.459 1.00 0.00 H ATOM 31254 H15S PA 790 116.324 11.617 46.587 1.00 0.00 H ATOM 31255 C114 PA 790 115.836 9.846 45.463 1.00 0.00 C ATOM 31256 H14R PA 790 115.752 10.310 44.478 1.00 0.00 H ATOM 31257 H14S PA 790 115.038 9.106 45.374 1.00 0.00 H ATOM 31258 C113 PA 790 117.237 9.295 45.724 1.00 0.00 C ATOM 31259 H13R PA 790 117.260 9.002 46.775 1.00 0.00 H ATOM 31260 H13S PA 790 117.890 10.170 45.711 1.00 0.00 H ATOM 31261 C112 PA 790 117.701 8.274 44.725 1.00 0.00 C ATOM 31262 H12R PA 790 117.490 8.716 43.749 1.00 0.00 H ATOM 31263 H12S PA 790 116.969 7.467 44.653 1.00 0.00 H ATOM 31264 C111 PA 790 119.117 7.680 44.988 1.00 0.00 C ATOM 31265 H11R PA 790 119.350 7.156 45.917 1.00 0.00 H ATOM 31266 H11S PA 790 119.765 8.556 45.066 1.00 0.00 H ATOM 31267 C110 PA 790 119.540 6.763 43.809 1.00 0.00 C ATOM 31268 H10R PA 790 119.621 7.348 42.891 1.00 0.00 H ATOM 31269 H10S PA 790 118.637 6.168 43.654 1.00 0.00 H ATOM 31270 C19 PA 790 120.766 5.910 44.018 1.00 0.00 C ATOM 31271 H9R PA 790 121.148 5.501 43.081 1.00 0.00 H ATOM 31272 H9S PA 790 120.394 5.107 44.659 1.00 0.00 H ATOM 31273 C18 PA 790 121.888 6.571 44.891 1.00 0.00 C ATOM 31274 H8R PA 790 121.493 6.905 45.853 1.00 0.00 H ATOM 31275 H8S PA 790 122.231 7.411 44.283 1.00 0.00 H ATOM 31276 C17 PA 790 123.175 5.621 45.052 1.00 0.00 C ATOM 31277 H7R PA 790 123.712 5.535 44.105 1.00 0.00 H ATOM 31278 H7S PA 790 122.904 4.585 45.266 1.00 0.00 H ATOM 31279 C16 PA 790 124.222 6.121 46.023 1.00 0.00 C ATOM 31280 H6R PA 790 125.101 5.486 46.152 1.00 0.00 H ATOM 31281 H6S PA 790 123.858 6.046 47.049 1.00 0.00 H ATOM 31282 C15 PA 790 124.850 7.526 45.769 1.00 0.00 C ATOM 31283 H5R PA 790 124.248 8.408 45.997 1.00 0.00 H ATOM 31284 H5S PA 790 125.000 7.630 44.692 1.00 0.00 H ATOM 31285 C14 PA 790 126.114 7.818 46.623 1.00 0.00 C ATOM 31286 H4R PA 790 126.520 8.784 46.316 1.00 0.00 H ATOM 31287 H4S PA 790 126.714 6.979 46.264 1.00 0.00 H ATOM 31288 C13 PA 790 125.804 7.898 48.098 1.00 0.00 C ATOM 31289 H3R PA 790 126.686 8.064 48.720 1.00 0.00 H ATOM 31290 H3S PA 790 125.483 6.900 48.406 1.00 0.00 H ATOM 31291 C12 PA 790 124.693 8.853 48.560 1.00 0.00 C ATOM 31292 H2R PA 790 123.774 8.285 48.399 1.00 0.00 H ATOM 31293 H2S PA 790 124.788 9.783 47.995 1.00 0.00 H ATOM 31294 C11 PC 791 124.643 9.178 50.042 1.00 0.00 C ATOM 31295 O12 PC 791 123.676 9.445 50.650 1.00 0.00 O ATOM 31296 O11 PC 791 126.019 9.159 50.505 1.00 0.00 O ATOM 31297 C1 PC 791 126.191 8.931 51.868 1.00 0.00 C ATOM 31298 HR PC 791 125.527 9.520 52.507 1.00 0.00 H ATOM 31299 HS PC 791 127.171 9.294 52.188 1.00 0.00 H ATOM 31300 C2 PC 791 126.123 7.400 52.175 1.00 0.00 C ATOM 31301 HX PC 791 125.084 7.081 52.054 1.00 0.00 H ATOM 31302 C3 PC 791 126.673 7.162 53.626 1.00 0.00 C ATOM 31303 HA PC 791 126.056 7.731 54.326 1.00 0.00 H ATOM 31304 HB PC 791 127.694 7.550 53.677 1.00 0.00 H ATOM 31305 O31 PC 791 126.678 5.821 53.966 1.00 0.00 O ATOM 31306 P31 PC 791 126.650 5.393 55.513 1.00 0.00 P ATOM 31307 O32 PC 791 125.242 5.846 56.060 1.00 0.00 O ATOM 31308 C31 PC 791 124.146 5.056 55.960 1.00 0.00 C ATOM 31309 H1A PC 791 124.326 4.174 56.581 1.00 0.00 H ATOM 31310 H1B PC 791 123.940 4.645 54.969 1.00 0.00 H ATOM 31311 C32 PC 791 122.958 5.773 56.646 1.00 0.00 C ATOM 31312 H2A PC 791 122.768 6.778 56.267 1.00 0.00 H ATOM 31313 H2B PC 791 123.189 5.983 57.691 1.00 0.00 H ATOM 31314 N31 PC 791 121.642 5.136 56.675 1.00 0.00 N ATOM 31315 C33 PC 791 121.026 5.443 55.375 1.00 0.00 C ATOM 31316 H3A PC 791 120.421 6.351 55.374 1.00 0.00 H ATOM 31317 H3B PC 791 120.415 4.594 55.065 1.00 0.00 H ATOM 31318 H3C PC 791 121.810 5.551 54.624 1.00 0.00 H ATOM 31319 C34 PC 791 121.660 3.633 56.956 1.00 0.00 C ATOM 31320 H4A PC 791 122.142 3.057 56.165 1.00 0.00 H ATOM 31321 H4B PC 791 120.619 3.348 57.115 1.00 0.00 H ATOM 31322 H4C PC 791 122.198 3.519 57.899 1.00 0.00 H ATOM 31323 C35 PC 791 120.930 5.856 57.691 1.00 0.00 C ATOM 31324 H5A PC 791 120.783 6.898 57.406 1.00 0.00 H ATOM 31325 H5B PC 791 121.564 5.851 58.579 1.00 0.00 H ATOM 31326 H5C PC 791 119.948 5.413 57.863 1.00 0.00 H ATOM 31327 O33 PC 791 126.753 3.938 55.469 1.00 0.00 O ATOM 31328 O34 PC 791 127.682 6.172 56.258 1.00 0.00 O ATOM 31329 O21 PC 791 127.134 6.828 51.360 1.00 0.00 O ATOM 31330 C21 PC 791 126.987 5.589 51.018 1.00 0.00 C ATOM 31331 O22 PC 791 126.043 4.929 51.223 1.00 0.00 O ATOM 31332 C12 OL 792 128.208 5.054 50.352 1.00 0.00 C ATOM 31333 H2R OL 792 129.145 5.417 50.780 1.00 0.00 H ATOM 31334 H2S OL 792 128.120 3.981 50.530 1.00 0.00 H ATOM 31335 C13 OL 792 128.167 4.985 48.825 1.00 0.00 C ATOM 31336 H3R OL 792 127.184 4.858 48.367 1.00 0.00 H ATOM 31337 H3S OL 792 128.540 5.971 48.539 1.00 0.00 H ATOM 31338 C14 OL 792 129.052 3.918 48.269 1.00 0.00 C ATOM 31339 H4R OL 792 129.906 3.818 48.942 1.00 0.00 H ATOM 31340 H4S OL 792 128.476 3.002 48.414 1.00 0.00 H ATOM 31341 C15 OL 792 129.392 4.059 46.768 1.00 0.00 C ATOM 31342 H5R OL 792 129.737 5.040 46.436 1.00 0.00 H ATOM 31343 H5S OL 792 130.097 3.253 46.555 1.00 0.00 H ATOM 31344 C16 OL 792 128.296 3.740 45.750 1.00 0.00 C ATOM 31345 H6R OL 792 127.762 2.832 46.037 1.00 0.00 H ATOM 31346 H6S OL 792 127.662 4.623 45.851 1.00 0.00 H ATOM 31347 C17 OL 792 128.751 3.491 44.306 1.00 0.00 C ATOM 31348 H7R OL 792 129.094 4.454 43.922 1.00 0.00 H ATOM 31349 H7S OL 792 129.688 2.930 44.308 1.00 0.00 H ATOM 31350 C18 OL 792 127.677 2.830 43.449 1.00 0.00 C ATOM 31351 H8R OL 792 128.106 2.819 42.445 1.00 0.00 H ATOM 31352 H8S OL 792 127.662 1.773 43.726 1.00 0.00 H ATOM 31353 C19 OL 792 126.302 3.358 43.448 1.00 0.00 C ATOM 31354 H9R OL 792 126.107 4.415 43.286 1.00 0.00 H ATOM 31355 C110 OL 792 125.191 2.662 43.754 1.00 0.00 C ATOM 31356 H10R OL 792 124.217 3.136 43.842 1.00 0.00 H ATOM 31357 C111 OL 792 125.184 1.176 44.001 1.00 0.00 C ATOM 31358 H11R OL 792 125.113 0.718 43.012 1.00 0.00 H ATOM 31359 H11S OL 792 126.083 0.757 44.456 1.00 0.00 H ATOM 31360 C112 OL 792 124.052 0.672 44.883 1.00 0.00 C ATOM 31361 H12R OL 792 124.027 1.303 45.774 1.00 0.00 H ATOM 31362 H12S OL 792 123.161 0.764 44.259 1.00 0.00 H ATOM 31363 C113 OL 792 124.265 -0.736 45.318 1.00 0.00 C ATOM 31364 H13R OL 792 124.753 -1.359 44.565 1.00 0.00 H ATOM 31365 H13S OL 792 124.968 -0.691 46.152 1.00 0.00 H ATOM 31366 C114 OL 792 122.954 -1.322 45.719 1.00 0.00 C ATOM 31367 H14R OL 792 122.544 -0.794 46.582 1.00 0.00 H ATOM 31368 H14S OL 792 122.301 -1.170 44.858 1.00 0.00 H ATOM 31369 C115 OL 792 123.105 -2.796 45.978 1.00 0.00 C ATOM 31370 H15R OL 792 122.157 -3.335 45.921 1.00 0.00 H ATOM 31371 H15S OL 792 123.606 -3.120 45.063 1.00 0.00 H ATOM 31372 C116 OL 792 123.709 -3.171 47.289 1.00 0.00 C ATOM 31373 H16R OL 792 123.785 -4.261 47.290 1.00 0.00 H ATOM 31374 H16S OL 792 124.743 -2.826 47.219 1.00 0.00 H ATOM 31375 C117 OL 792 123.043 -2.619 48.543 1.00 0.00 C ATOM 31376 H17R OL 792 123.084 -1.551 48.319 1.00 0.00 H ATOM 31377 H17S OL 792 121.970 -2.818 48.559 1.00 0.00 H ATOM 31378 C118 OL 792 123.667 -2.876 49.873 1.00 0.00 C ATOM 31379 H18R OL 792 123.017 -2.500 50.666 1.00 0.00 H ATOM 31380 H18S OL 792 124.617 -2.340 49.894 1.00 0.00 H ATOM 31381 H18T OL 792 123.703 -3.966 49.929 1.00 0.00 H TER 31382 OL 792 ATOM 31382 C116 PA 793 95.727 19.604 32.875 1.00 0.00 C ATOM 31383 H16R PA 793 94.934 19.536 33.623 1.00 0.00 H ATOM 31384 H16S PA 793 95.320 19.578 31.861 1.00 0.00 H ATOM 31385 H16T PA 793 96.132 20.617 32.930 1.00 0.00 H ATOM 31386 C115 PA 793 96.940 18.669 32.961 1.00 0.00 C ATOM 31387 H15R PA 793 97.291 18.739 31.929 1.00 0.00 H ATOM 31388 H15S PA 793 96.643 17.620 33.017 1.00 0.00 H ATOM 31389 C114 PA 793 97.992 18.859 34.018 1.00 0.00 C ATOM 31390 H14R PA 793 98.395 19.866 33.891 1.00 0.00 H ATOM 31391 H14S PA 793 98.886 18.254 33.853 1.00 0.00 H ATOM 31392 C113 PA 793 97.454 18.582 35.399 1.00 0.00 C ATOM 31393 H13R PA 793 96.929 17.625 35.384 1.00 0.00 H ATOM 31394 H13S PA 793 96.615 19.231 35.658 1.00 0.00 H ATOM 31395 C112 PA 793 98.464 18.616 36.568 1.00 0.00 C ATOM 31396 H12R PA 793 98.743 19.643 36.813 1.00 0.00 H ATOM 31397 H12S PA 793 99.354 18.033 36.326 1.00 0.00 H ATOM 31398 C111 PA 793 97.788 18.089 37.801 1.00 0.00 C ATOM 31399 H11R PA 793 97.589 17.022 37.680 1.00 0.00 H ATOM 31400 H11S PA 793 96.792 18.516 37.942 1.00 0.00 H ATOM 31401 C110 PA 793 98.628 18.285 39.000 1.00 0.00 C ATOM 31402 H10R PA 793 98.694 19.375 39.038 1.00 0.00 H ATOM 31403 H10S PA 793 99.611 17.817 38.909 1.00 0.00 H ATOM 31404 C19 PA 793 98.002 17.687 40.247 1.00 0.00 C ATOM 31405 H9R PA 793 97.938 16.600 40.162 1.00 0.00 H ATOM 31406 H9S PA 793 96.939 17.896 40.382 1.00 0.00 H ATOM 31407 C18 PA 793 98.732 18.030 41.568 1.00 0.00 C ATOM 31408 H8R PA 793 98.455 19.001 41.982 1.00 0.00 H ATOM 31409 H8S PA 793 99.750 18.220 41.221 1.00 0.00 H ATOM 31410 C17 PA 793 98.807 16.943 42.647 1.00 0.00 C ATOM 31411 H7R PA 793 98.837 15.948 42.200 1.00 0.00 H ATOM 31412 H7S PA 793 97.861 16.926 43.192 1.00 0.00 H ATOM 31413 C16 PA 793 100.046 17.260 43.520 1.00 0.00 C ATOM 31414 H6R PA 793 100.288 18.325 43.535 1.00 0.00 H ATOM 31415 H6S PA 793 100.933 16.768 43.117 1.00 0.00 H ATOM 31416 C15 PA 793 99.889 16.807 44.978 1.00 0.00 C ATOM 31417 H5R PA 793 99.114 17.466 45.374 1.00 0.00 H ATOM 31418 H5S PA 793 100.771 16.978 45.599 1.00 0.00 H ATOM 31419 C14 PA 793 99.672 15.308 45.218 1.00 0.00 C ATOM 31420 H4R PA 793 100.577 14.790 44.894 1.00 0.00 H ATOM 31421 H4S PA 793 98.923 14.902 44.534 1.00 0.00 H ATOM 31422 C13 PA 793 99.613 14.873 46.742 1.00 0.00 C ATOM 31423 H3R PA 793 98.599 15.063 47.099 1.00 0.00 H ATOM 31424 H3S PA 793 100.359 15.508 47.225 1.00 0.00 H ATOM 31425 C12 PA 793 100.153 13.454 46.946 1.00 0.00 C ATOM 31426 H2R PA 793 101.168 13.482 46.545 1.00 0.00 H ATOM 31427 H2S PA 793 99.576 12.774 46.316 1.00 0.00 H ATOM 31428 C11 PC 794 100.132 13.070 48.447 1.00 0.00 C ATOM 31429 O12 PC 794 100.928 13.553 49.250 1.00 0.00 O ATOM 31430 O11 PC 794 99.092 12.304 48.660 1.00 0.00 O ATOM 31431 C1 PC 794 98.782 11.769 50.020 1.00 0.00 C ATOM 31432 HR PC 794 99.638 11.204 50.399 1.00 0.00 H ATOM 31433 HS PC 794 98.057 10.967 49.862 1.00 0.00 H ATOM 31434 C2 PC 794 98.282 12.763 51.038 1.00 0.00 C ATOM 31435 HX PC 794 99.028 13.552 51.159 1.00 0.00 H ATOM 31436 C3 PC 794 97.971 12.167 52.408 1.00 0.00 C ATOM 31437 HA PC 794 97.255 11.351 52.278 1.00 0.00 H ATOM 31438 HB PC 794 97.540 12.952 53.034 1.00 0.00 H ATOM 31439 O31 PC 794 99.126 11.745 53.054 1.00 0.00 O ATOM 31440 P31 PC 794 99.054 11.009 54.512 1.00 0.00 P ATOM 31441 O32 PC 794 98.806 12.196 55.584 1.00 0.00 O ATOM 31442 C31 PC 794 99.780 13.092 55.923 1.00 0.00 C ATOM 31443 H1A PC 794 100.111 13.554 54.989 1.00 0.00 H ATOM 31444 H1B PC 794 100.627 12.582 56.390 1.00 0.00 H ATOM 31445 C32 PC 794 99.405 14.066 57.094 1.00 0.00 C ATOM 31446 H2A PC 794 100.192 14.711 57.488 1.00 0.00 H ATOM 31447 H2B PC 794 99.025 13.522 57.959 1.00 0.00 H ATOM 31448 N31 PC 794 98.321 15.071 56.854 1.00 0.00 N ATOM 31449 C33 PC 794 97.032 14.433 56.437 1.00 0.00 C ATOM 31450 H3A PC 794 97.178 13.770 55.583 1.00 0.00 H ATOM 31451 H3B PC 794 96.325 15.215 56.159 1.00 0.00 H ATOM 31452 H3C PC 794 96.613 13.810 57.228 1.00 0.00 H ATOM 31453 C34 PC 794 97.917 15.750 58.085 1.00 0.00 C ATOM 31454 H4A PC 794 98.762 16.343 58.437 1.00 0.00 H ATOM 31455 H4B PC 794 97.631 14.937 58.755 1.00 0.00 H ATOM 31456 H4C PC 794 97.097 16.416 57.812 1.00 0.00 H ATOM 31457 C35 PC 794 98.773 16.137 55.882 1.00 0.00 C ATOM 31458 H5A PC 794 97.952 16.843 55.750 1.00 0.00 H ATOM 31459 H5B PC 794 99.019 15.714 54.907 1.00 0.00 H ATOM 31460 H5C PC 794 99.672 16.529 56.359 1.00 0.00 H ATOM 31461 O33 PC 794 98.013 9.991 54.566 1.00 0.00 O ATOM 31462 O34 PC 794 100.417 10.547 54.655 1.00 0.00 O ATOM 31463 O21 PC 794 97.132 13.468 50.512 1.00 0.00 O ATOM 31464 C21 PC 794 95.873 13.011 50.429 1.00 0.00 C ATOM 31465 O22 PC 794 95.456 11.915 50.664 1.00 0.00 O ATOM 31466 C12 OL 795 94.919 14.066 50.058 1.00 0.00 C ATOM 31467 H2R OL 795 94.238 14.305 50.878 1.00 0.00 H ATOM 31468 H2S OL 795 95.478 14.997 49.953 1.00 0.00 H ATOM 31469 C13 OL 795 94.003 13.801 48.867 1.00 0.00 C ATOM 31470 H3R OL 795 93.357 13.007 49.246 1.00 0.00 H ATOM 31471 H3S OL 795 93.454 14.739 48.769 1.00 0.00 H ATOM 31472 C14 OL 795 94.704 13.455 47.575 1.00 0.00 C ATOM 31473 H4R OL 795 95.173 12.478 47.711 1.00 0.00 H ATOM 31474 H4S OL 795 93.890 13.319 46.859 1.00 0.00 H ATOM 31475 C15 OL 795 95.697 14.480 46.908 1.00 0.00 C ATOM 31476 H5R OL 795 95.245 15.471 46.980 1.00 0.00 H ATOM 31477 H5S OL 795 96.454 14.594 47.687 1.00 0.00 H ATOM 31478 C16 OL 795 96.306 14.134 45.628 1.00 0.00 C ATOM 31479 H6R OL 795 96.765 15.081 45.335 1.00 0.00 H ATOM 31480 H6S OL 795 97.170 13.519 45.888 1.00 0.00 H ATOM 31481 C17 OL 795 95.328 13.525 44.660 1.00 0.00 C ATOM 31482 H7R OL 795 94.940 12.616 45.126 1.00 0.00 H ATOM 31483 H7S OL 795 94.471 14.199 44.603 1.00 0.00 H ATOM 31484 C18 OL 795 95.921 13.267 43.330 1.00 0.00 C ATOM 31485 H8R OL 795 96.519 14.138 43.054 1.00 0.00 H ATOM 31486 H8S OL 795 96.657 12.470 43.453 1.00 0.00 H ATOM 31487 C19 OL 795 94.817 12.923 42.419 1.00 0.00 C ATOM 31488 H9R OL 795 94.216 12.101 42.798 1.00 0.00 H ATOM 31489 C110 OL 795 94.592 13.377 41.179 1.00 0.00 C ATOM 31490 H10R OL 795 93.884 12.916 40.496 1.00 0.00 H ATOM 31491 C111 OL 795 95.498 14.404 40.514 1.00 0.00 C ATOM 31492 H11R OL 795 96.055 15.052 41.194 1.00 0.00 H ATOM 31493 H11S OL 795 96.106 13.790 39.846 1.00 0.00 H ATOM 31494 C112 OL 795 94.608 15.316 39.605 1.00 0.00 C ATOM 31495 H12R OL 795 95.265 15.928 38.983 1.00 0.00 H ATOM 31496 H12S OL 795 93.975 14.679 38.985 1.00 0.00 H ATOM 31497 C113 OL 795 93.723 16.195 40.580 1.00 0.00 C ATOM 31498 H13R OL 795 93.161 15.462 41.163 1.00 0.00 H ATOM 31499 H13S OL 795 94.266 16.824 41.288 1.00 0.00 H ATOM 31500 C114 OL 795 92.654 16.993 39.792 1.00 0.00 C ATOM 31501 H14R OL 795 92.350 16.590 38.824 1.00 0.00 H ATOM 31502 H14S OL 795 91.751 17.044 40.404 1.00 0.00 H ATOM 31503 C115 OL 795 92.975 18.396 39.419 1.00 0.00 C ATOM 31504 H15R OL 795 93.223 19.003 40.292 1.00 0.00 H ATOM 31505 H15S OL 795 93.835 18.487 38.752 1.00 0.00 H ATOM 31506 C116 OL 795 91.849 19.289 38.956 1.00 0.00 C ATOM 31507 H16R OL 795 91.146 19.395 39.785 1.00 0.00 H ATOM 31508 H16S OL 795 92.178 20.327 38.880 1.00 0.00 H ATOM 31509 C117 OL 795 91.158 18.841 37.705 1.00 0.00 C ATOM 31510 H17R OL 795 91.093 17.751 37.732 1.00 0.00 H ATOM 31511 H17S OL 795 90.194 19.348 37.790 1.00 0.00 H ATOM 31512 C118 OL 795 91.861 19.180 36.385 1.00 0.00 C ATOM 31513 H18R OL 795 92.941 19.098 36.522 1.00 0.00 H ATOM 31514 H18S OL 795 91.762 20.224 36.081 1.00 0.00 H ATOM 31515 H18T OL 795 91.677 18.531 35.525 1.00 0.00 H TER 31516 OL 795 ATOM 31516 C116 PA 796 26.547 22.104 41.434 1.00 0.00 C ATOM 31517 H16R PA 796 27.089 22.996 41.755 1.00 0.00 H ATOM 31518 H16S PA 796 26.066 22.298 40.473 1.00 0.00 H ATOM 31519 H16T PA 796 27.339 21.397 41.178 1.00 0.00 H ATOM 31520 C115 PA 796 25.545 21.540 42.472 1.00 0.00 C ATOM 31521 H15R PA 796 25.160 20.529 42.326 1.00 0.00 H ATOM 31522 H15S PA 796 24.665 22.186 42.454 1.00 0.00 H ATOM 31523 C114 PA 796 26.083 21.570 43.879 1.00 0.00 C ATOM 31524 H14R PA 796 25.313 21.201 44.560 1.00 0.00 H ATOM 31525 H14S PA 796 26.107 22.644 44.079 1.00 0.00 H ATOM 31526 C113 PA 796 27.448 20.998 44.094 1.00 0.00 C ATOM 31527 H13R PA 796 28.115 21.228 43.261 1.00 0.00 H ATOM 31528 H13S PA 796 27.241 19.931 44.203 1.00 0.00 H ATOM 31529 C112 PA 796 28.151 21.583 45.342 1.00 0.00 C ATOM 31530 H12R PA 796 28.347 22.655 45.279 1.00 0.00 H ATOM 31531 H12S PA 796 29.159 21.166 45.375 1.00 0.00 H ATOM 31532 C111 PA 796 27.479 21.408 46.706 1.00 0.00 C ATOM 31533 H11R PA 796 27.179 20.360 46.754 1.00 0.00 H ATOM 31534 H11S PA 796 26.480 21.837 46.605 1.00 0.00 H ATOM 31535 C110 PA 796 28.319 22.044 47.829 1.00 0.00 C ATOM 31536 H10R PA 796 28.420 23.131 47.781 1.00 0.00 H ATOM 31537 H10S PA 796 29.337 21.741 47.576 1.00 0.00 H ATOM 31538 C19 PA 796 28.153 21.561 49.289 1.00 0.00 C ATOM 31539 H9R PA 796 28.189 20.471 49.339 1.00 0.00 H ATOM 31540 H9S PA 796 27.178 21.746 49.746 1.00 0.00 H ATOM 31541 C18 PA 796 29.238 22.085 50.299 1.00 0.00 C ATOM 31542 H8R PA 796 29.300 23.175 50.255 1.00 0.00 H ATOM 31543 H8S PA 796 30.259 21.755 50.100 1.00 0.00 H ATOM 31544 C17 PA 796 28.939 21.704 51.717 1.00 0.00 C ATOM 31545 H7R PA 796 28.882 20.614 51.679 1.00 0.00 H ATOM 31546 H7S PA 796 27.927 21.974 52.029 1.00 0.00 H ATOM 31547 C16 PA 796 29.974 22.250 52.738 1.00 0.00 C ATOM 31548 H6R PA 796 29.834 23.324 52.872 1.00 0.00 H ATOM 31549 H6S PA 796 30.933 22.193 52.219 1.00 0.00 H ATOM 31550 C15 PA 796 30.131 21.402 54.011 1.00 0.00 C ATOM 31551 H5R PA 796 30.999 21.880 54.471 1.00 0.00 H ATOM 31552 H5S PA 796 30.297 20.354 53.751 1.00 0.00 H ATOM 31553 C14 PA 796 28.820 21.502 54.854 1.00 0.00 C ATOM 31554 H4R PA 796 27.914 21.249 54.299 1.00 0.00 H ATOM 31555 H4S PA 796 28.728 22.590 54.834 1.00 0.00 H ATOM 31556 C13 PA 796 28.939 21.034 56.339 1.00 0.00 C ATOM 31557 H3R PA 796 28.579 20.015 56.493 1.00 0.00 H ATOM 31558 H3S PA 796 28.119 21.632 56.742 1.00 0.00 H ATOM 31559 C12 PA 796 30.303 21.156 57.008 1.00 0.00 C ATOM 31560 H2R PA 796 30.700 22.171 56.936 1.00 0.00 H ATOM 31561 H2S PA 796 31.137 20.548 56.651 1.00 0.00 H ATOM 31562 C11 PC 797 30.115 20.775 58.450 1.00 0.00 C ATOM 31563 O12 PC 797 29.832 21.487 59.388 1.00 0.00 O ATOM 31564 O11 PC 797 30.240 19.464 58.581 1.00 0.00 O ATOM 31565 C1 PC 797 30.070 18.995 59.937 1.00 0.00 C ATOM 31566 HR PC 797 30.616 19.623 60.646 1.00 0.00 H ATOM 31567 HS PC 797 30.596 18.044 60.051 1.00 0.00 H ATOM 31568 C2 PC 797 28.577 18.901 60.279 1.00 0.00 C ATOM 31569 HX PC 797 28.083 19.867 60.150 1.00 0.00 H ATOM 31570 C3 PC 797 28.485 18.480 61.752 1.00 0.00 C ATOM 31571 HA PC 797 27.430 18.449 62.035 1.00 0.00 H ATOM 31572 HB PC 797 28.944 19.262 62.362 1.00 0.00 H ATOM 31573 O31 PC 797 29.112 17.243 61.960 1.00 0.00 O ATOM 31574 P31 PC 797 28.746 16.416 63.292 1.00 0.00 P ATOM 31575 O32 PC 797 29.867 16.809 64.335 1.00 0.00 O ATOM 31576 C31 PC 797 30.055 18.160 64.831 1.00 0.00 C ATOM 31577 H1A PC 797 29.148 18.552 65.298 1.00 0.00 H ATOM 31578 H1B PC 797 30.308 18.817 63.996 1.00 0.00 H ATOM 31579 C32 PC 797 31.126 18.268 65.930 1.00 0.00 C ATOM 31580 H2A PC 797 31.241 19.350 66.006 1.00 0.00 H ATOM 31581 H2B PC 797 32.034 17.800 65.547 1.00 0.00 H ATOM 31582 N31 PC 797 30.850 17.637 67.286 1.00 0.00 N ATOM 31583 C33 PC 797 29.828 18.494 67.912 1.00 0.00 C ATOM 31584 H3A PC 797 30.196 19.484 68.185 1.00 0.00 H ATOM 31585 H3B PC 797 29.590 18.071 68.890 1.00 0.00 H ATOM 31586 H3C PC 797 28.909 18.508 67.324 1.00 0.00 H ATOM 31587 C34 PC 797 30.410 16.260 67.129 1.00 0.00 C ATOM 31588 H4A PC 797 29.420 16.263 66.669 1.00 0.00 H ATOM 31589 H4B PC 797 30.302 15.780 68.103 1.00 0.00 H ATOM 31590 H4C PC 797 31.211 15.815 66.538 1.00 0.00 H ATOM 31591 C35 PC 797 32.035 17.710 68.147 1.00 0.00 C ATOM 31592 H5A PC 797 32.735 16.964 67.766 1.00 0.00 H ATOM 31593 H5B PC 797 31.735 17.636 69.194 1.00 0.00 H ATOM 31594 H5C PC 797 32.504 18.693 68.087 1.00 0.00 H ATOM 31595 O33 PC 797 27.427 16.901 63.820 1.00 0.00 O ATOM 31596 O34 PC 797 29.023 14.981 63.097 1.00 0.00 O ATOM 31597 O21 PC 797 28.045 17.900 59.381 1.00 0.00 O ATOM 31598 C21 PC 797 26.759 17.530 59.493 1.00 0.00 C ATOM 31599 O22 PC 797 25.870 17.972 60.251 1.00 0.00 O ATOM 31600 C12 OL 798 26.350 16.477 58.614 1.00 0.00 C ATOM 31601 H2R OL 798 26.810 15.536 58.923 1.00 0.00 H ATOM 31602 H2S OL 798 25.259 16.468 58.668 1.00 0.00 H ATOM 31603 C13 OL 798 26.728 16.718 57.140 1.00 0.00 C ATOM 31604 H3R OL 798 27.801 16.921 57.154 1.00 0.00 H ATOM 31605 H3S OL 798 26.581 15.808 56.554 1.00 0.00 H ATOM 31606 C14 OL 798 26.080 17.797 56.343 1.00 0.00 C ATOM 31607 H4R OL 798 24.999 17.648 56.359 1.00 0.00 H ATOM 31608 H4S OL 798 26.191 18.699 56.950 1.00 0.00 H ATOM 31609 C15 OL 798 26.664 18.014 54.981 1.00 0.00 C ATOM 31610 H5R OL 798 27.731 18.214 54.867 1.00 0.00 H ATOM 31611 H5S OL 798 26.619 17.147 54.318 1.00 0.00 H ATOM 31612 C16 OL 798 25.905 19.084 54.239 1.00 0.00 C ATOM 31613 H6R OL 798 24.827 18.930 54.153 1.00 0.00 H ATOM 31614 H6S OL 798 25.903 20.097 54.647 1.00 0.00 H ATOM 31615 C17 OL 798 26.417 19.185 52.761 1.00 0.00 C ATOM 31616 H7R OL 798 26.337 20.240 52.491 1.00 0.00 H ATOM 31617 H7S OL 798 27.483 18.949 52.762 1.00 0.00 H ATOM 31618 C18 OL 798 25.680 18.260 51.823 1.00 0.00 C ATOM 31619 H8R OL 798 26.007 17.282 52.180 1.00 0.00 H ATOM 31620 H8S OL 798 24.593 18.300 51.924 1.00 0.00 H ATOM 31621 C19 OL 798 26.108 18.532 50.397 1.00 0.00 C ATOM 31622 H9R OL 798 25.884 19.559 50.122 1.00 0.00 H ATOM 31623 C110 OL 798 26.573 17.698 49.510 1.00 0.00 C ATOM 31624 H10R OL 798 26.790 17.949 48.475 1.00 0.00 H ATOM 31625 C111 OL 798 26.879 16.198 49.883 1.00 0.00 C ATOM 31626 H11R OL 798 27.478 15.780 49.071 1.00 0.00 H ATOM 31627 H11S OL 798 27.333 16.104 50.871 1.00 0.00 H ATOM 31628 C112 OL 798 25.511 15.468 49.905 1.00 0.00 C ATOM 31629 H12R OL 798 24.750 15.838 50.595 1.00 0.00 H ATOM 31630 H12S OL 798 25.114 15.587 48.894 1.00 0.00 H ATOM 31631 C113 OL 798 25.621 14.009 50.229 1.00 0.00 C ATOM 31632 H13R OL 798 25.729 13.998 51.316 1.00 0.00 H ATOM 31633 H13S OL 798 24.755 13.402 49.956 1.00 0.00 H ATOM 31634 C114 OL 798 26.669 13.257 49.463 1.00 0.00 C ATOM 31635 H14R OL 798 26.718 13.746 48.488 1.00 0.00 H ATOM 31636 H14S OL 798 27.627 13.423 49.960 1.00 0.00 H ATOM 31637 C115 OL 798 26.184 11.785 49.257 1.00 0.00 C ATOM 31638 H15R OL 798 26.087 11.370 50.262 1.00 0.00 H ATOM 31639 H15S OL 798 25.224 11.749 48.739 1.00 0.00 H ATOM 31640 C116 OL 798 27.207 11.052 48.334 1.00 0.00 C ATOM 31641 H16R OL 798 27.586 11.670 47.517 1.00 0.00 H ATOM 31642 H16S OL 798 28.115 10.865 48.911 1.00 0.00 H ATOM 31643 C117 OL 798 26.744 9.712 47.804 1.00 0.00 C ATOM 31644 H17R OL 798 26.788 8.992 48.625 1.00 0.00 H ATOM 31645 H17S OL 798 25.711 9.868 47.486 1.00 0.00 H ATOM 31646 C118 OL 798 27.704 9.161 46.724 1.00 0.00 C ATOM 31647 H18R OL 798 28.736 9.112 47.079 1.00 0.00 H ATOM 31648 H18S OL 798 27.753 9.750 45.806 1.00 0.00 H ATOM 31649 H18T OL 798 27.495 8.130 46.432 1.00 0.00 H TER 31650 OL 798 ATOM 31650 C116 PA 799 69.676 117.200 39.862 1.00 0.00 C ATOM 31651 H16R PA 799 69.128 117.649 39.031 1.00 0.00 H ATOM 31652 H16S PA 799 69.033 116.370 40.162 1.00 0.00 H ATOM 31653 H16T PA 799 70.675 116.931 39.513 1.00 0.00 H ATOM 31654 C115 PA 799 69.796 118.273 40.977 1.00 0.00 C ATOM 31655 H15R PA 799 70.486 119.083 40.731 1.00 0.00 H ATOM 31656 H15S PA 799 70.323 117.753 41.780 1.00 0.00 H ATOM 31657 C114 PA 799 68.406 118.676 41.524 1.00 0.00 C ATOM 31658 H14R PA 799 67.997 117.805 42.040 1.00 0.00 H ATOM 31659 H14S PA 799 67.679 118.833 40.725 1.00 0.00 H ATOM 31660 C113 PA 799 68.532 119.868 42.473 1.00 0.00 C ATOM 31661 H13R PA 799 69.330 119.577 43.160 1.00 0.00 H ATOM 31662 H13S PA 799 67.715 120.038 43.177 1.00 0.00 H ATOM 31663 C112 PA 799 68.808 121.229 41.827 1.00 0.00 C ATOM 31664 H12R PA 799 67.893 121.581 41.346 1.00 0.00 H ATOM 31665 H12S PA 799 69.655 121.299 41.142 1.00 0.00 H ATOM 31666 C111 PA 799 68.969 122.373 42.909 1.00 0.00 C ATOM 31667 H11R PA 799 68.196 122.443 43.678 1.00 0.00 H ATOM 31668 H11S PA 799 68.851 123.308 42.357 1.00 0.00 H ATOM 31669 C110 PA 799 70.322 122.515 43.526 1.00 0.00 C ATOM 31670 H10R PA 799 70.943 123.065 42.815 1.00 0.00 H ATOM 31671 H10S PA 799 70.802 121.559 43.742 1.00 0.00 H ATOM 31672 C19 PA 799 70.244 123.471 44.780 1.00 0.00 C ATOM 31673 H9R PA 799 69.306 123.191 45.263 1.00 0.00 H ATOM 31674 H9S PA 799 70.033 124.531 44.631 1.00 0.00 H ATOM 31675 C18 PA 799 71.493 123.580 45.648 1.00 0.00 C ATOM 31676 H8R PA 799 72.271 124.140 45.125 1.00 0.00 H ATOM 31677 H8S PA 799 71.870 122.577 45.858 1.00 0.00 H ATOM 31678 C17 PA 799 71.360 124.260 46.891 1.00 0.00 C ATOM 31679 H7R PA 799 70.788 123.718 47.647 1.00 0.00 H ATOM 31680 H7S PA 799 70.562 124.980 46.699 1.00 0.00 H ATOM 31681 C16 PA 799 72.568 124.922 47.525 1.00 0.00 C ATOM 31682 H6R PA 799 73.256 125.476 46.883 1.00 0.00 H ATOM 31683 H6S PA 799 73.107 124.065 47.935 1.00 0.00 H ATOM 31684 C15 PA 799 72.125 125.952 48.499 1.00 0.00 C ATOM 31685 H5R PA 799 71.377 125.515 49.165 1.00 0.00 H ATOM 31686 H5S PA 799 71.607 126.748 47.961 1.00 0.00 H ATOM 31687 C14 PA 799 73.197 126.515 49.328 1.00 0.00 C ATOM 31688 H4R PA 799 73.761 127.184 48.675 1.00 0.00 H ATOM 31689 H4S PA 799 73.898 125.799 49.761 1.00 0.00 H ATOM 31690 C13 PA 799 72.582 127.351 50.426 1.00 0.00 C ATOM 31691 H3R PA 799 71.965 126.673 51.020 1.00 0.00 H ATOM 31692 H3S PA 799 71.930 128.113 49.994 1.00 0.00 H ATOM 31693 C12 PA 799 73.658 127.895 51.417 1.00 0.00 C ATOM 31694 H2R PA 799 74.444 128.425 50.875 1.00 0.00 H ATOM 31695 H2S PA 799 74.092 127.003 51.874 1.00 0.00 H ATOM 31696 C11 PGR 800 73.130 128.704 52.573 1.00 0.00 C ATOM 31697 O12 PGR 800 72.039 128.568 53.134 1.00 0.00 O ATOM 31698 O11 PGR 800 73.994 129.712 52.924 1.00 0.00 O ATOM 31699 C1 PGR 800 73.535 130.615 53.895 1.00 0.00 C ATOM 31700 HR PGR 800 73.211 130.005 54.741 1.00 0.00 H ATOM 31701 HS PGR 800 72.650 131.202 53.638 1.00 0.00 H ATOM 31702 C2 PGR 800 74.746 131.461 54.413 1.00 0.00 C ATOM 31703 HX PGR 800 75.622 130.808 54.372 1.00 0.00 H ATOM 31704 C3 PGR 800 74.494 131.972 55.830 1.00 0.00 C ATOM 31705 HA PGR 800 75.320 132.604 56.168 1.00 0.00 H ATOM 31706 HB PGR 800 74.532 131.075 56.454 1.00 0.00 H ATOM 31707 O31 PGR 800 73.132 132.541 55.959 1.00 0.00 O ATOM 31708 P31 PGR 800 72.673 133.004 57.429 1.00 0.00 P ATOM 31709 O32 PGR 800 73.643 134.275 57.574 1.00 0.00 O ATOM 31710 C31 PGR 800 74.859 134.210 58.403 1.00 0.00 C ATOM 31711 H1A PGR 800 75.409 133.288 58.200 1.00 0.00 H ATOM 31712 H1B PGR 800 74.539 134.300 59.444 1.00 0.00 H ATOM 31713 C32 PGR 800 75.618 135.465 57.909 1.00 0.00 C ATOM 31714 H2A PGR 800 75.672 135.418 56.818 1.00 0.00 H ATOM 31715 O35 PGR 800 74.966 136.773 58.173 1.00 0.00 O ATOM 31716 HO5A PGR 800 74.329 136.859 57.442 1.00 0.00 H ATOM 31717 C33 PGR 800 77.045 135.381 58.415 1.00 0.00 C ATOM 31718 H3A PGR 800 77.075 135.547 59.495 1.00 0.00 H ATOM 31719 H3B PGR 800 77.531 134.433 58.171 1.00 0.00 H ATOM 31720 O33 PGR 800 71.264 133.430 57.398 1.00 0.00 O ATOM 31721 O34 PGR 800 73.141 131.883 58.342 1.00 0.00 O ATOM 31722 O21 PGR 800 74.876 132.512 53.491 1.00 0.00 O ATOM 31723 C21 PGR 800 76.015 133.191 53.414 1.00 0.00 C ATOM 31724 O22 PGR 800 77.051 132.952 54.077 1.00 0.00 O ATOM 31725 O36 PGR 800 77.782 136.390 57.777 1.00 0.00 O ATOM 31726 HO6A PGR 800 77.903 136.083 56.860 1.00 0.00 H ATOM 31727 C12 OL 801 75.910 134.267 52.379 1.00 0.00 C ATOM 31728 H2R OL 801 75.046 134.911 52.552 1.00 0.00 H ATOM 31729 H2S OL 801 76.842 134.829 52.462 1.00 0.00 H ATOM 31730 C13 OL 801 75.642 133.543 51.012 1.00 0.00 C ATOM 31731 H3R OL 801 74.621 133.164 51.087 1.00 0.00 H ATOM 31732 H3S OL 801 75.505 134.206 50.155 1.00 0.00 H ATOM 31733 C14 OL 801 76.598 132.478 50.484 1.00 0.00 C ATOM 31734 H4R OL 801 77.528 132.881 50.078 1.00 0.00 H ATOM 31735 H4S OL 801 77.122 131.984 51.304 1.00 0.00 H ATOM 31736 C15 OL 801 75.960 131.474 49.528 1.00 0.00 C ATOM 31737 H5R OL 801 76.638 130.630 49.384 1.00 0.00 H ATOM 31738 H5S OL 801 75.101 130.922 49.916 1.00 0.00 H ATOM 31739 C16 OL 801 75.352 132.177 48.251 1.00 0.00 C ATOM 31740 H6R OL 801 74.503 132.832 48.454 1.00 0.00 H ATOM 31741 H6S OL 801 76.075 132.908 47.883 1.00 0.00 H ATOM 31742 C17 OL 801 74.891 131.315 47.153 1.00 0.00 C ATOM 31743 H7R OL 801 75.589 130.605 46.704 1.00 0.00 H ATOM 31744 H7S OL 801 74.037 130.691 47.426 1.00 0.00 H ATOM 31745 C18 OL 801 74.404 131.992 45.926 1.00 0.00 C ATOM 31746 H8R OL 801 74.078 131.160 45.298 1.00 0.00 H ATOM 31747 H8S OL 801 73.473 132.521 46.143 1.00 0.00 H ATOM 31748 C19 OL 801 75.363 132.914 45.208 1.00 0.00 C ATOM 31749 H9R OL 801 76.095 133.345 45.886 1.00 0.00 H ATOM 31750 C110 OL 801 75.353 133.194 43.870 1.00 0.00 C ATOM 31751 H10R OL 801 76.041 133.895 43.405 1.00 0.00 H ATOM 31752 C111 OL 801 74.483 132.458 42.843 1.00 0.00 C ATOM 31753 H11R OL 801 75.029 131.783 42.180 1.00 0.00 H ATOM 31754 H11S OL 801 73.762 131.880 43.426 1.00 0.00 H ATOM 31755 C112 OL 801 73.734 133.477 41.990 1.00 0.00 C ATOM 31756 H12R OL 801 73.031 132.926 41.363 1.00 0.00 H ATOM 31757 H12S OL 801 73.317 134.268 42.617 1.00 0.00 H ATOM 31758 C113 OL 801 74.477 134.213 40.882 1.00 0.00 C ATOM 31759 H13R OL 801 75.238 134.790 41.410 1.00 0.00 H ATOM 31760 H13S OL 801 75.039 133.421 40.383 1.00 0.00 H ATOM 31761 C114 OL 801 73.718 135.187 40.046 1.00 0.00 C ATOM 31762 H14R OL 801 72.821 134.763 39.590 1.00 0.00 H ATOM 31763 H14S OL 801 73.432 135.976 40.745 1.00 0.00 H ATOM 31764 C115 OL 801 74.540 135.846 38.911 1.00 0.00 C ATOM 31765 H15R OL 801 75.595 135.960 39.169 1.00 0.00 H ATOM 31766 H15S OL 801 74.564 135.207 38.026 1.00 0.00 H ATOM 31767 C116 OL 801 73.961 137.284 38.490 1.00 0.00 C ATOM 31768 H16R OL 801 74.572 137.763 37.721 1.00 0.00 H ATOM 31769 H16S OL 801 72.997 137.093 38.015 1.00 0.00 H ATOM 31770 C117 OL 801 73.836 138.397 39.543 1.00 0.00 C ATOM 31771 H17R OL 801 73.456 138.112 40.526 1.00 0.00 H ATOM 31772 H17S OL 801 74.816 138.840 39.730 1.00 0.00 H ATOM 31773 C118 OL 801 72.983 139.510 38.954 1.00 0.00 C ATOM 31774 H18R OL 801 73.414 139.885 38.023 1.00 0.00 H ATOM 31775 H18S OL 801 72.956 140.353 39.647 1.00 0.00 H ATOM 31776 H18T OL 801 71.963 139.137 38.844 1.00 0.00 H TER 31777 OL 801 ATOM 31777 C116 PA 802 80.694 4.310 39.792 1.00 0.00 C ATOM 31778 H16R PA 802 80.509 3.501 40.502 1.00 0.00 H ATOM 31779 H16S PA 802 80.517 4.020 38.755 1.00 0.00 H ATOM 31780 H16T PA 802 79.759 4.842 39.979 1.00 0.00 H ATOM 31781 C115 PA 802 81.886 5.269 39.979 1.00 0.00 C ATOM 31782 H15R PA 802 82.027 5.420 41.051 1.00 0.00 H ATOM 31783 H15S PA 802 81.547 6.197 39.513 1.00 0.00 H ATOM 31784 C114 PA 802 83.173 4.648 39.390 1.00 0.00 C ATOM 31785 H14R PA 802 84.002 5.348 39.509 1.00 0.00 H ATOM 31786 H14S PA 802 82.982 4.710 38.317 1.00 0.00 H ATOM 31787 C113 PA 802 83.558 3.189 39.917 1.00 0.00 C ATOM 31788 H13R PA 802 84.483 2.955 39.386 1.00 0.00 H ATOM 31789 H13S PA 802 82.844 2.506 39.452 1.00 0.00 H ATOM 31790 C112 PA 802 83.662 2.930 41.473 1.00 0.00 C ATOM 31791 H12R PA 802 83.675 1.842 41.568 1.00 0.00 H ATOM 31792 H12S PA 802 82.792 3.318 42.007 1.00 0.00 H ATOM 31793 C111 PA 802 84.729 3.714 42.178 1.00 0.00 C ATOM 31794 H11R PA 802 84.454 4.744 41.943 1.00 0.00 H ATOM 31795 H11S PA 802 85.631 3.445 41.624 1.00 0.00 H ATOM 31796 C110 PA 802 84.884 3.307 43.695 1.00 0.00 C ATOM 31797 H10R PA 802 85.009 2.227 43.802 1.00 0.00 H ATOM 31798 H10S PA 802 83.993 3.641 44.231 1.00 0.00 H ATOM 31799 C19 PA 802 86.080 4.044 44.304 1.00 0.00 C ATOM 31800 H9R PA 802 87.011 3.850 43.768 1.00 0.00 H ATOM 31801 H9S PA 802 86.230 3.561 45.272 1.00 0.00 H ATOM 31802 C18 PA 802 86.019 5.552 44.495 1.00 0.00 C ATOM 31803 H8R PA 802 85.100 5.749 45.050 1.00 0.00 H ATOM 31804 H8S PA 802 85.904 6.175 43.605 1.00 0.00 H ATOM 31805 C17 PA 802 87.050 6.110 45.297 1.00 0.00 C ATOM 31806 H7R PA 802 86.818 5.680 46.274 1.00 0.00 H ATOM 31807 H7S PA 802 86.718 7.145 45.394 1.00 0.00 H ATOM 31808 C16 PA 802 88.562 5.997 44.965 1.00 0.00 C ATOM 31809 H6R PA 802 88.797 6.281 43.937 1.00 0.00 H ATOM 31810 H6S PA 802 88.914 4.964 44.975 1.00 0.00 H ATOM 31811 C15 PA 802 89.424 6.898 45.854 1.00 0.00 C ATOM 31812 H5R PA 802 89.205 7.922 45.544 1.00 0.00 H ATOM 31813 H5S PA 802 90.502 6.775 45.734 1.00 0.00 H ATOM 31814 C14 PA 802 89.125 6.601 47.334 1.00 0.00 C ATOM 31815 H4R PA 802 88.894 5.548 47.508 1.00 0.00 H ATOM 31816 H4S PA 802 88.268 7.177 47.689 1.00 0.00 H ATOM 31817 C13 PA 802 90.283 6.787 48.276 1.00 0.00 C ATOM 31818 H3R PA 802 90.556 7.840 48.179 1.00 0.00 H ATOM 31819 H3S PA 802 91.137 6.248 47.860 1.00 0.00 H ATOM 31820 C12 PA 802 89.917 6.291 49.729 1.00 0.00 C ATOM 31821 H2R PA 802 88.987 6.786 50.017 1.00 0.00 H ATOM 31822 H2S PA 802 89.804 5.206 49.762 1.00 0.00 H ATOM 31823 C11 PGR 803 91.056 6.692 50.673 1.00 0.00 C ATOM 31824 O12 PGR 803 90.778 7.259 51.699 1.00 0.00 O ATOM 31825 O11 PGR 803 92.277 6.490 50.176 1.00 0.00 O ATOM 31826 C1 PGR 803 93.346 6.867 51.097 1.00 0.00 C ATOM 31827 HR PGR 803 93.224 7.945 51.226 1.00 0.00 H ATOM 31828 HS PGR 803 94.334 6.760 50.641 1.00 0.00 H ATOM 31829 C2 PGR 803 93.395 6.125 52.416 1.00 0.00 C ATOM 31830 HX PGR 803 92.408 5.939 52.846 1.00 0.00 H ATOM 31831 C3 PGR 803 94.281 6.758 53.456 1.00 0.00 C ATOM 31832 HA PGR 803 93.953 7.744 53.792 1.00 0.00 H ATOM 31833 HB PGR 803 95.300 6.836 53.069 1.00 0.00 H ATOM 31834 O31 PGR 803 94.591 6.030 54.658 1.00 0.00 O ATOM 31835 P31 PGR 803 93.515 5.926 55.851 1.00 0.00 P ATOM 31836 O32 PGR 803 92.133 5.277 55.301 1.00 0.00 O ATOM 31837 C31 PGR 803 91.034 6.094 55.102 1.00 0.00 C ATOM 31838 H1A PGR 803 91.381 6.924 54.481 1.00 0.00 H ATOM 31839 H1B PGR 803 90.767 6.519 56.073 1.00 0.00 H ATOM 31840 C32 PGR 803 89.755 5.400 54.653 1.00 0.00 C ATOM 31841 H2A PGR 803 88.981 6.151 54.474 1.00 0.00 H ATOM 31842 O35 PGR 803 89.159 4.673 55.709 1.00 0.00 O ATOM 31843 HO5A PGR 803 89.261 5.154 56.550 1.00 0.00 H ATOM 31844 C33 PGR 803 89.844 4.508 53.463 1.00 0.00 C ATOM 31845 H3A PGR 803 90.008 5.060 52.534 1.00 0.00 H ATOM 31846 H3B PGR 803 90.786 3.954 53.451 1.00 0.00 H ATOM 31847 O33 PGR 803 94.057 4.965 56.855 1.00 0.00 O ATOM 31848 O34 PGR 803 93.197 7.263 56.322 1.00 0.00 O ATOM 31849 O21 PGR 803 93.996 4.866 52.036 1.00 0.00 O ATOM 31850 C21 PGR 803 93.241 3.972 51.415 1.00 0.00 C ATOM 31851 O22 PGR 803 91.997 3.925 51.392 1.00 0.00 O ATOM 31852 O36 PGR 803 88.675 3.577 53.471 1.00 0.00 O ATOM 31853 HO6A PGR 803 88.610 3.363 54.419 1.00 0.00 H ATOM 31854 C12 OL 804 94.131 2.946 50.599 1.00 0.00 C ATOM 31855 H2R OL 804 94.969 3.502 50.174 1.00 0.00 H ATOM 31856 H2S OL 804 94.556 2.175 51.246 1.00 0.00 H ATOM 31857 C13 OL 804 93.329 2.252 49.550 1.00 0.00 C ATOM 31858 H3R OL 804 93.978 1.444 49.206 1.00 0.00 H ATOM 31859 H3S OL 804 92.439 1.775 49.963 1.00 0.00 H ATOM 31860 C14 OL 804 92.910 3.126 48.314 1.00 0.00 C ATOM 31861 H4R OL 804 92.632 2.408 47.539 1.00 0.00 H ATOM 31862 H4S OL 804 92.013 3.720 48.502 1.00 0.00 H ATOM 31863 C15 OL 804 93.983 3.916 47.524 1.00 0.00 C ATOM 31864 H5R OL 804 94.256 4.789 48.121 1.00 0.00 H ATOM 31865 H5S OL 804 94.797 3.225 47.293 1.00 0.00 H ATOM 31866 C16 OL 804 93.516 4.529 46.195 1.00 0.00 C ATOM 31867 H6R OL 804 92.761 5.289 46.407 1.00 0.00 H ATOM 31868 H6S OL 804 94.406 5.084 45.890 1.00 0.00 H ATOM 31869 C17 OL 804 93.046 3.565 45.078 1.00 0.00 C ATOM 31870 H7R OL 804 93.458 2.577 45.294 1.00 0.00 H ATOM 31871 H7S OL 804 91.955 3.509 45.097 1.00 0.00 H ATOM 31872 C18 OL 804 93.651 3.969 43.771 1.00 0.00 C ATOM 31873 H8R OL 804 94.691 3.640 43.728 1.00 0.00 H ATOM 31874 H8S OL 804 93.170 3.301 43.054 1.00 0.00 H ATOM 31875 C19 OL 804 93.514 5.354 43.313 1.00 0.00 C ATOM 31876 H9R OL 804 92.778 5.897 43.899 1.00 0.00 H ATOM 31877 C110 OL 804 94.240 5.966 42.384 1.00 0.00 C ATOM 31878 H10R OL 804 94.173 7.023 42.139 1.00 0.00 H ATOM 31879 C111 OL 804 95.232 5.207 41.534 1.00 0.00 C ATOM 31880 H11R OL 804 96.231 5.609 41.714 1.00 0.00 H ATOM 31881 H11S OL 804 95.115 4.121 41.557 1.00 0.00 H ATOM 31882 C112 OL 804 94.960 5.526 40.070 1.00 0.00 C ATOM 31883 H12R OL 804 95.198 6.583 39.937 1.00 0.00 H ATOM 31884 H12S OL 804 95.749 4.997 39.532 1.00 0.00 H ATOM 31885 C113 OL 804 93.493 5.317 39.664 1.00 0.00 C ATOM 31886 H13R OL 804 93.407 4.229 39.700 1.00 0.00 H ATOM 31887 H13S OL 804 92.759 5.669 40.393 1.00 0.00 H ATOM 31888 C114 OL 804 93.164 5.677 38.178 1.00 0.00 C ATOM 31889 H14R OL 804 93.560 6.677 37.987 1.00 0.00 H ATOM 31890 H14S OL 804 93.690 5.063 37.445 1.00 0.00 H ATOM 31891 C115 OL 804 91.697 5.661 37.835 1.00 0.00 C ATOM 31892 H15R OL 804 91.369 4.654 37.572 1.00 0.00 H ATOM 31893 H15S OL 804 91.032 5.925 38.660 1.00 0.00 H ATOM 31894 C116 OL 804 91.404 6.589 36.602 1.00 0.00 C ATOM 31895 H16R OL 804 91.772 7.600 36.789 1.00 0.00 H ATOM 31896 H16S OL 804 92.002 6.285 35.740 1.00 0.00 H ATOM 31897 C117 OL 804 89.971 6.973 36.334 1.00 0.00 C ATOM 31898 H17R OL 804 89.391 6.052 36.238 1.00 0.00 H ATOM 31899 H17S OL 804 89.440 7.410 37.183 1.00 0.00 H ATOM 31900 C118 OL 804 89.788 7.946 35.174 1.00 0.00 C ATOM 31901 H18R OL 804 88.775 8.352 35.187 1.00 0.00 H ATOM 31902 H18S OL 804 89.894 7.320 34.285 1.00 0.00 H ATOM 31903 H18T OL 804 90.636 8.620 35.032 1.00 0.00 H TER 31904 OL 804 ATOM 31904 C116 PA 805 104.384 137.262 42.652 1.00 0.00 C ATOM 31905 H16R PA 805 103.622 136.980 41.923 1.00 0.00 H ATOM 31906 H16S PA 805 105.273 136.969 42.090 1.00 0.00 H ATOM 31907 H16T PA 805 104.477 138.348 42.719 1.00 0.00 H ATOM 31908 C115 PA 805 104.147 136.620 43.972 1.00 0.00 C ATOM 31909 H15R PA 805 103.418 137.144 44.592 1.00 0.00 H ATOM 31910 H15S PA 805 105.066 136.481 44.546 1.00 0.00 H ATOM 31911 C114 PA 805 103.690 135.105 43.969 1.00 0.00 C ATOM 31912 H14R PA 805 104.400 134.482 43.422 1.00 0.00 H ATOM 31913 H14S PA 805 102.737 134.976 43.452 1.00 0.00 H ATOM 31914 C113 PA 805 103.544 134.469 45.343 1.00 0.00 C ATOM 31915 H13R PA 805 102.833 135.054 45.929 1.00 0.00 H ATOM 31916 H13S PA 805 104.485 134.514 45.895 1.00 0.00 H ATOM 31917 C112 PA 805 103.171 132.981 45.249 1.00 0.00 C ATOM 31918 H12R PA 805 103.394 132.557 46.230 1.00 0.00 H ATOM 31919 H12S PA 805 103.789 132.494 44.492 1.00 0.00 H ATOM 31920 C111 PA 805 101.710 132.653 44.856 1.00 0.00 C ATOM 31921 H11R PA 805 101.739 131.564 44.777 1.00 0.00 H ATOM 31922 H11S PA 805 101.454 133.057 43.874 1.00 0.00 H ATOM 31923 C110 PA 805 100.734 133.218 45.891 1.00 0.00 C ATOM 31924 H10R PA 805 100.707 134.305 45.792 1.00 0.00 H ATOM 31925 H10S PA 805 101.131 132.938 46.869 1.00 0.00 H ATOM 31926 C19 PA 805 99.340 132.629 45.820 1.00 0.00 C ATOM 31927 H9R PA 805 99.455 131.553 45.972 1.00 0.00 H ATOM 31928 H9S PA 805 99.025 132.857 44.800 1.00 0.00 H ATOM 31929 C18 PA 805 98.286 133.121 46.871 1.00 0.00 C ATOM 31930 H8R PA 805 97.296 132.688 46.712 1.00 0.00 H ATOM 31931 H8S PA 805 98.133 134.197 46.771 1.00 0.00 H ATOM 31932 C17 PA 805 98.588 132.869 48.360 1.00 0.00 C ATOM 31933 H7R PA 805 97.678 133.072 48.928 1.00 0.00 H ATOM 31934 H7S PA 805 99.386 133.565 48.628 1.00 0.00 H ATOM 31935 C16 PA 805 98.883 131.416 48.619 1.00 0.00 C ATOM 31936 H6R PA 805 99.848 131.095 48.221 1.00 0.00 H ATOM 31937 H6S PA 805 98.245 130.760 48.022 1.00 0.00 H ATOM 31938 C15 PA 805 98.837 131.042 50.080 1.00 0.00 C ATOM 31939 H5R PA 805 98.941 129.956 50.050 1.00 0.00 H ATOM 31940 H5S PA 805 97.876 131.248 50.556 1.00 0.00 H ATOM 31941 C14 PA 805 100.017 131.636 50.874 1.00 0.00 C ATOM 31942 H4R PA 805 100.314 132.625 50.517 1.00 0.00 H ATOM 31943 H4S PA 805 100.831 130.958 50.610 1.00 0.00 H ATOM 31944 C13 PA 805 99.746 131.774 52.346 1.00 0.00 C ATOM 31945 H3R PA 805 98.992 132.525 52.592 1.00 0.00 H ATOM 31946 H3S PA 805 100.660 132.162 52.798 1.00 0.00 H ATOM 31947 C12 PA 805 99.534 130.418 53.076 1.00 0.00 C ATOM 31948 H2R PA 805 100.208 129.616 52.766 1.00 0.00 H ATOM 31949 H2S PA 805 98.578 130.019 52.729 1.00 0.00 H ATOM 31950 C11 PGR 806 99.430 130.526 54.578 1.00 0.00 C ATOM 31951 O12 PGR 806 100.293 131.094 55.280 1.00 0.00 O ATOM 31952 O11 PGR 806 98.361 129.884 55.047 1.00 0.00 O ATOM 31953 C1 PGR 806 98.062 129.857 56.474 1.00 0.00 C ATOM 31954 HR PGR 806 98.888 129.455 57.066 1.00 0.00 H ATOM 31955 HS PGR 806 97.253 129.136 56.617 1.00 0.00 H ATOM 31956 C2 PGR 806 97.649 131.285 56.895 1.00 0.00 C ATOM 31957 HX PGR 806 98.370 132.065 56.639 1.00 0.00 H ATOM 31958 C3 PGR 806 97.370 131.403 58.440 1.00 0.00 C ATOM 31959 HA PGR 806 96.710 132.231 58.708 1.00 0.00 H ATOM 31960 HB PGR 806 98.353 131.522 58.904 1.00 0.00 H ATOM 31961 O31 PGR 806 96.868 130.156 58.862 1.00 0.00 O ATOM 31962 P31 PGR 806 96.325 129.860 60.267 1.00 0.00 P ATOM 31963 O32 PGR 806 94.739 129.952 60.016 1.00 0.00 O ATOM 31964 C31 PGR 806 94.011 128.873 59.344 1.00 0.00 C ATOM 31965 H1A PGR 806 93.596 128.084 59.976 1.00 0.00 H ATOM 31966 H1B PGR 806 94.620 128.303 58.638 1.00 0.00 H ATOM 31967 C32 PGR 806 92.783 129.454 58.662 1.00 0.00 C ATOM 31968 H2A PGR 806 92.420 128.600 58.085 1.00 0.00 H ATOM 31969 O35 PGR 806 91.892 129.890 59.656 1.00 0.00 O ATOM 31970 HO5A PGR 806 90.965 129.955 59.362 1.00 0.00 H ATOM 31971 C33 PGR 806 93.093 130.659 57.711 1.00 0.00 C ATOM 31972 H3A PGR 806 93.753 131.346 58.246 1.00 0.00 H ATOM 31973 H3B PGR 806 93.750 130.419 56.871 1.00 0.00 H ATOM 31974 O33 PGR 806 96.695 128.397 60.468 1.00 0.00 O ATOM 31975 O34 PGR 806 96.751 130.969 61.174 1.00 0.00 O ATOM 31976 O21 PGR 806 96.372 131.554 56.241 1.00 0.00 O ATOM 31977 C21 PGR 806 96.481 131.961 54.982 1.00 0.00 C ATOM 31978 O22 PGR 806 97.333 132.683 54.425 1.00 0.00 O ATOM 31979 O36 PGR 806 91.937 131.447 57.283 1.00 0.00 O ATOM 31980 HO6A PGR 806 91.297 130.789 56.956 1.00 0.00 H ATOM 31981 C12 OL 807 95.252 131.502 54.159 1.00 0.00 C ATOM 31982 H2R OL 807 94.426 131.520 54.872 1.00 0.00 H ATOM 31983 H2S OL 807 95.198 132.301 53.416 1.00 0.00 H ATOM 31984 C13 OL 807 95.484 130.072 53.665 1.00 0.00 C ATOM 31985 H3R OL 807 96.394 130.136 53.065 1.00 0.00 H ATOM 31986 H3S OL 807 95.655 129.434 54.535 1.00 0.00 H ATOM 31987 C14 OL 807 94.344 129.470 52.832 1.00 0.00 C ATOM 31988 H4R OL 807 94.014 130.200 52.090 1.00 0.00 H ATOM 31989 H4S OL 807 94.619 128.642 52.176 1.00 0.00 H ATOM 31990 C15 OL 807 93.089 129.167 53.726 1.00 0.00 C ATOM 31991 H5R OL 807 93.335 128.591 54.621 1.00 0.00 H ATOM 31992 H5S OL 807 92.679 130.108 54.098 1.00 0.00 H ATOM 31993 C16 OL 807 92.046 128.370 52.912 1.00 0.00 C ATOM 31994 H6R OL 807 91.009 128.665 53.087 1.00 0.00 H ATOM 31995 H6S OL 807 92.182 128.688 51.876 1.00 0.00 H ATOM 31996 C17 OL 807 92.311 126.874 53.085 1.00 0.00 C ATOM 31997 H7R OL 807 93.182 126.517 52.532 1.00 0.00 H ATOM 31998 H7S OL 807 92.439 126.638 54.143 1.00 0.00 H ATOM 31999 C18 OL 807 91.112 126.034 52.578 1.00 0.00 C ATOM 32000 H8R OL 807 90.220 126.086 53.205 1.00 0.00 H ATOM 32001 H8S OL 807 90.874 126.488 51.614 1.00 0.00 H ATOM 32002 C19 OL 807 91.456 124.592 52.408 1.00 0.00 C ATOM 32003 H9R OL 807 91.449 124.045 53.348 1.00 0.00 H ATOM 32004 C110 OL 807 91.971 123.948 51.396 1.00 0.00 C ATOM 32005 H10R OL 807 92.266 122.919 51.586 1.00 0.00 H ATOM 32006 C111 OL 807 92.263 124.457 50.008 1.00 0.00 C ATOM 32007 H11R OL 807 91.636 125.337 49.845 1.00 0.00 H ATOM 32008 H11S OL 807 93.312 124.750 49.929 1.00 0.00 H ATOM 32009 C112 OL 807 91.997 123.530 48.954 1.00 0.00 C ATOM 32010 H12R OL 807 92.563 122.628 49.197 1.00 0.00 H ATOM 32011 H12S OL 807 90.940 123.257 48.976 1.00 0.00 H ATOM 32012 C113 OL 807 92.447 123.900 47.484 1.00 0.00 C ATOM 32013 H13R OL 807 91.829 124.717 47.108 1.00 0.00 H ATOM 32014 H13S OL 807 93.529 124.034 47.556 1.00 0.00 H ATOM 32015 C114 OL 807 92.238 122.816 46.398 1.00 0.00 C ATOM 32016 H14R OL 807 91.247 122.976 45.968 1.00 0.00 H ATOM 32017 H14S OL 807 92.983 122.960 45.613 1.00 0.00 H ATOM 32018 C115 OL 807 92.456 121.299 46.764 1.00 0.00 C ATOM 32019 H15R OL 807 93.490 121.233 47.106 1.00 0.00 H ATOM 32020 H15S OL 807 91.726 121.063 47.541 1.00 0.00 H ATOM 32021 C116 OL 807 92.213 120.384 45.666 1.00 0.00 C ATOM 32022 H16R OL 807 91.188 120.454 45.294 1.00 0.00 H ATOM 32023 H16S OL 807 92.933 120.550 44.862 1.00 0.00 H ATOM 32024 C117 OL 807 92.473 118.936 46.087 1.00 0.00 C ATOM 32025 H17R OL 807 93.531 118.853 46.345 1.00 0.00 H ATOM 32026 H17S OL 807 91.908 118.684 46.987 1.00 0.00 H ATOM 32027 C118 OL 807 92.115 117.887 44.880 1.00 0.00 C ATOM 32028 H18R OL 807 92.697 118.287 44.047 1.00 0.00 H ATOM 32029 H18S OL 807 91.051 117.931 44.638 1.00 0.00 H ATOM 32030 H18T OL 807 92.458 116.860 45.016 1.00 0.00 H TER 32031 OL 807 ATOM 32031 C116 PA 808 62.279 134.569 33.927 1.00 0.00 C ATOM 32032 H16R PA 808 63.220 134.844 34.409 1.00 0.00 H ATOM 32033 H16S PA 808 62.439 134.181 32.919 1.00 0.00 H ATOM 32034 H16T PA 808 61.973 133.712 34.531 1.00 0.00 H ATOM 32035 C115 PA 808 61.190 135.656 33.961 1.00 0.00 C ATOM 32036 H15R PA 808 60.244 135.363 33.502 1.00 0.00 H ATOM 32037 H15S PA 808 61.546 136.589 33.520 1.00 0.00 H ATOM 32038 C114 PA 808 60.793 136.161 35.381 1.00 0.00 C ATOM 32039 H14R PA 808 60.127 137.026 35.339 1.00 0.00 H ATOM 32040 H14S PA 808 61.731 136.523 35.805 1.00 0.00 H ATOM 32041 C113 PA 808 60.147 134.949 36.249 1.00 0.00 C ATOM 32042 H13R PA 808 60.802 134.120 36.523 1.00 0.00 H ATOM 32043 H13S PA 808 59.236 134.561 35.789 1.00 0.00 H ATOM 32044 C112 PA 808 59.607 135.651 37.552 1.00 0.00 C ATOM 32045 H12R PA 808 58.856 136.405 37.306 1.00 0.00 H ATOM 32046 H12S PA 808 60.373 136.172 38.130 1.00 0.00 H ATOM 32047 C111 PA 808 59.066 134.689 38.589 1.00 0.00 C ATOM 32048 H11R PA 808 59.798 133.887 38.707 1.00 0.00 H ATOM 32049 H11S PA 808 58.161 134.319 38.102 1.00 0.00 H ATOM 32050 C110 PA 808 58.782 135.196 39.981 1.00 0.00 C ATOM 32051 H10R PA 808 57.806 135.683 40.050 1.00 0.00 H ATOM 32052 H10S PA 808 59.498 135.941 40.334 1.00 0.00 H ATOM 32053 C19 PA 808 58.578 134.093 41.019 1.00 0.00 C ATOM 32054 H9R PA 808 59.337 133.349 41.271 1.00 0.00 H ATOM 32055 H9S PA 808 57.838 133.366 40.678 1.00 0.00 H ATOM 32056 C18 PA 808 58.293 134.557 42.446 1.00 0.00 C ATOM 32057 H8R PA 808 58.969 135.406 42.570 1.00 0.00 H ATOM 32058 H8S PA 808 58.574 133.796 43.177 1.00 0.00 H ATOM 32059 C17 PA 808 56.842 134.998 42.692 1.00 0.00 C ATOM 32060 H7R PA 808 56.086 134.225 42.537 1.00 0.00 H ATOM 32061 H7S PA 808 56.541 135.675 41.889 1.00 0.00 H ATOM 32062 C16 PA 808 56.573 135.562 44.089 1.00 0.00 C ATOM 32063 H6R PA 808 57.284 136.365 44.290 1.00 0.00 H ATOM 32064 H6S PA 808 56.864 134.698 44.691 1.00 0.00 H ATOM 32065 C15 PA 808 55.116 135.717 44.302 1.00 0.00 C ATOM 32066 H5R PA 808 54.528 134.997 43.729 1.00 0.00 H ATOM 32067 H5S PA 808 54.678 136.627 43.886 1.00 0.00 H ATOM 32068 C14 PA 808 54.663 135.563 45.779 1.00 0.00 C ATOM 32069 H4R PA 808 54.866 134.564 46.170 1.00 0.00 H ATOM 32070 H4S PA 808 53.582 135.711 45.830 1.00 0.00 H ATOM 32071 C13 PA 808 55.305 136.607 46.688 1.00 0.00 C ATOM 32072 H3R PA 808 55.385 137.490 46.050 1.00 0.00 H ATOM 32073 H3S PA 808 56.315 136.242 46.887 1.00 0.00 H ATOM 32074 C12 PA 808 54.466 136.988 47.849 1.00 0.00 C ATOM 32075 H2R PA 808 54.462 136.120 48.510 1.00 0.00 H ATOM 32076 H2S PA 808 53.471 137.127 47.421 1.00 0.00 H ATOM 32077 C11 PGR 809 55.136 138.090 48.545 1.00 0.00 C ATOM 32078 O12 PGR 809 56.013 138.767 48.139 1.00 0.00 O ATOM 32079 O11 PGR 809 54.676 138.320 49.793 1.00 0.00 O ATOM 32080 C1 PGR 809 54.924 139.631 50.256 1.00 0.00 C ATOM 32081 HR PGR 809 54.332 140.249 49.575 1.00 0.00 H ATOM 32082 HS PGR 809 55.965 139.960 50.196 1.00 0.00 H ATOM 32083 C2 PGR 809 54.282 139.706 51.621 1.00 0.00 C ATOM 32084 HX PGR 809 54.457 140.744 51.919 1.00 0.00 H ATOM 32085 C3 PGR 809 54.804 138.659 52.581 1.00 0.00 C ATOM 32086 HA PGR 809 55.864 138.482 52.379 1.00 0.00 H ATOM 32087 HB PGR 809 54.145 137.791 52.508 1.00 0.00 H ATOM 32088 O31 PGR 809 54.593 139.101 53.903 1.00 0.00 O ATOM 32089 P31 PGR 809 54.854 138.124 55.128 1.00 0.00 P ATOM 32090 O32 PGR 809 56.380 137.949 55.116 1.00 0.00 O ATOM 32091 C31 PGR 809 57.307 138.811 55.800 1.00 0.00 C ATOM 32092 H1A PGR 809 57.214 138.650 56.877 1.00 0.00 H ATOM 32093 H1B PGR 809 56.961 139.801 55.492 1.00 0.00 H ATOM 32094 C32 PGR 809 58.741 138.609 55.319 1.00 0.00 C ATOM 32095 H2A PGR 809 58.820 138.915 54.273 1.00 0.00 H ATOM 32096 O35 PGR 809 59.231 137.256 55.405 1.00 0.00 O ATOM 32097 HO5A PGR 809 58.451 136.674 55.429 1.00 0.00 H ATOM 32098 C33 PGR 809 59.647 139.540 56.109 1.00 0.00 C ATOM 32099 H3A PGR 809 60.725 139.461 55.946 1.00 0.00 H ATOM 32100 H3B PGR 809 59.429 140.592 55.908 1.00 0.00 H ATOM 32101 O33 PGR 809 54.509 138.778 56.425 1.00 0.00 O ATOM 32102 O34 PGR 809 54.224 136.820 54.792 1.00 0.00 O ATOM 32103 O21 PGR 809 52.788 139.491 51.493 1.00 0.00 O ATOM 32104 C21 PGR 809 51.923 139.969 52.455 1.00 0.00 C ATOM 32105 O22 PGR 809 52.277 140.595 53.456 1.00 0.00 O ATOM 32106 O36 PGR 809 59.508 139.383 57.505 1.00 0.00 O ATOM 32107 HO6A PGR 809 59.699 138.449 57.703 1.00 0.00 H ATOM 32108 C12 OL 810 50.498 139.888 52.062 1.00 0.00 C ATOM 32109 H2R OL 810 50.293 139.124 51.310 1.00 0.00 H ATOM 32110 H2S OL 810 49.931 139.572 52.940 1.00 0.00 H ATOM 32111 C13 OL 810 50.109 141.233 51.506 1.00 0.00 C ATOM 32112 H3R OL 810 50.553 142.085 52.024 1.00 0.00 H ATOM 32113 H3S OL 810 50.616 141.377 50.550 1.00 0.00 H ATOM 32114 C14 OL 810 48.590 141.393 51.463 1.00 0.00 C ATOM 32115 H4R OL 810 48.196 141.262 52.473 1.00 0.00 H ATOM 32116 H4S OL 810 48.384 142.402 51.099 1.00 0.00 H ATOM 32117 C15 OL 810 47.870 140.440 50.517 1.00 0.00 C ATOM 32118 H5R OL 810 47.991 139.520 51.092 1.00 0.00 H ATOM 32119 H5S OL 810 46.799 140.645 50.452 1.00 0.00 H ATOM 32120 C16 OL 810 48.440 140.364 49.068 1.00 0.00 C ATOM 32121 H6R OL 810 48.687 141.396 48.809 1.00 0.00 H ATOM 32122 H6S OL 810 49.349 139.760 49.036 1.00 0.00 H ATOM 32123 C17 OL 810 47.588 139.673 47.953 1.00 0.00 C ATOM 32124 H7R OL 810 47.257 138.716 48.362 1.00 0.00 H ATOM 32125 H7S OL 810 46.740 140.329 47.748 1.00 0.00 H ATOM 32126 C18 OL 810 48.339 139.630 46.670 1.00 0.00 C ATOM 32127 H8R OL 810 48.649 140.626 46.348 1.00 0.00 H ATOM 32128 H8S OL 810 49.296 139.111 46.752 1.00 0.00 H ATOM 32129 C19 OL 810 47.547 139.026 45.601 1.00 0.00 C ATOM 32130 H9R OL 810 47.572 137.939 45.632 1.00 0.00 H ATOM 32131 C110 OL 810 47.026 139.624 44.523 1.00 0.00 C ATOM 32132 H10R OL 810 46.514 139.081 43.732 1.00 0.00 H ATOM 32133 C111 OL 810 46.876 141.148 44.417 1.00 0.00 C ATOM 32134 H11R OL 810 45.962 141.438 43.894 1.00 0.00 H ATOM 32135 H11S OL 810 46.806 141.651 45.384 1.00 0.00 H ATOM 32136 C112 OL 810 48.066 141.499 43.645 1.00 0.00 C ATOM 32137 H12R OL 810 48.916 140.825 43.770 1.00 0.00 H ATOM 32138 H12S OL 810 47.783 141.281 42.613 1.00 0.00 H ATOM 32139 C113 OL 810 48.425 142.931 43.584 1.00 0.00 C ATOM 32140 H13R OL 810 47.522 143.475 43.301 1.00 0.00 H ATOM 32141 H13S OL 810 48.725 143.308 44.564 1.00 0.00 H ATOM 32142 C114 OL 810 49.566 143.247 42.559 1.00 0.00 C ATOM 32143 H14R OL 810 49.136 143.008 41.584 1.00 0.00 H ATOM 32144 H14S OL 810 49.596 144.338 42.511 1.00 0.00 H ATOM 32145 C115 OL 810 50.871 142.662 42.913 1.00 0.00 C ATOM 32146 H15R OL 810 51.318 143.225 43.735 1.00 0.00 H ATOM 32147 H15S OL 810 50.836 141.688 43.406 1.00 0.00 H ATOM 32148 C116 OL 810 51.943 142.598 41.759 1.00 0.00 C ATOM 32149 H16R OL 810 52.377 143.593 41.640 1.00 0.00 H ATOM 32150 H16S OL 810 52.788 141.981 42.071 1.00 0.00 H ATOM 32151 C117 OL 810 51.544 142.085 40.389 1.00 0.00 C ATOM 32152 H17R OL 810 50.959 142.925 40.007 1.00 0.00 H ATOM 32153 H17S OL 810 52.406 142.103 39.718 1.00 0.00 H ATOM 32154 C118 OL 810 50.929 140.681 40.261 1.00 0.00 C ATOM 32155 H18R OL 810 50.933 140.285 39.243 1.00 0.00 H ATOM 32156 H18S OL 810 49.905 140.686 40.640 1.00 0.00 H ATOM 32157 H18T OL 810 51.564 139.970 40.794 1.00 0.00 H TER 32158 OL 810 ATOM 32158 C116 PA 811 130.099 122.109 43.919 1.00 0.00 C ATOM 32159 H16R PA 811 129.217 121.775 44.469 1.00 0.00 H ATOM 32160 H16S PA 811 129.928 122.939 43.229 1.00 0.00 H ATOM 32161 H16T PA 811 130.762 122.584 44.645 1.00 0.00 H ATOM 32162 C115 PA 811 131.007 120.968 43.318 1.00 0.00 C ATOM 32163 H15R PA 811 132.022 121.279 43.061 1.00 0.00 H ATOM 32164 H15S PA 811 130.584 120.799 42.326 1.00 0.00 H ATOM 32165 C114 PA 811 131.085 119.639 44.157 1.00 0.00 C ATOM 32166 H14R PA 811 131.768 119.701 45.006 1.00 0.00 H ATOM 32167 H14S PA 811 131.473 119.022 43.345 1.00 0.00 H ATOM 32168 C113 PA 811 129.802 118.888 44.420 1.00 0.00 C ATOM 32169 H13R PA 811 129.195 118.695 43.533 1.00 0.00 H ATOM 32170 H13S PA 811 129.001 119.404 44.953 1.00 0.00 H ATOM 32171 C112 PA 811 129.949 117.551 45.149 1.00 0.00 C ATOM 32172 H12R PA 811 130.455 116.934 44.403 1.00 0.00 H ATOM 32173 H12S PA 811 129.005 117.044 45.358 1.00 0.00 H ATOM 32174 C111 PA 811 130.879 117.616 46.397 1.00 0.00 C ATOM 32175 H11R PA 811 131.896 117.854 46.077 1.00 0.00 H ATOM 32176 H11S PA 811 131.089 116.608 46.760 1.00 0.00 H ATOM 32177 C110 PA 811 130.404 118.528 47.569 1.00 0.00 C ATOM 32178 H10R PA 811 129.398 118.261 47.896 1.00 0.00 H ATOM 32179 H10S PA 811 130.161 119.504 47.142 1.00 0.00 H ATOM 32180 C19 PA 811 131.373 118.708 48.729 1.00 0.00 C ATOM 32181 H9R PA 811 132.304 118.974 48.224 1.00 0.00 H ATOM 32182 H9S PA 811 131.551 117.782 49.279 1.00 0.00 H ATOM 32183 C18 PA 811 130.943 119.759 49.752 1.00 0.00 C ATOM 32184 H8R PA 811 130.062 119.515 50.350 1.00 0.00 H ATOM 32185 H8S PA 811 130.457 120.644 49.337 1.00 0.00 H ATOM 32186 C17 PA 811 132.001 120.003 50.826 1.00 0.00 C ATOM 32187 H7R PA 811 132.956 120.119 50.309 1.00 0.00 H ATOM 32188 H7S PA 811 132.181 119.107 51.424 1.00 0.00 H ATOM 32189 C16 PA 811 131.687 121.224 51.782 1.00 0.00 C ATOM 32190 H6R PA 811 131.063 121.926 51.226 1.00 0.00 H ATOM 32191 H6S PA 811 132.563 121.793 52.102 1.00 0.00 H ATOM 32192 C15 PA 811 130.987 120.816 53.108 1.00 0.00 C ATOM 32193 H5R PA 811 131.070 121.749 53.669 1.00 0.00 H ATOM 32194 H5S PA 811 131.478 120.021 53.673 1.00 0.00 H ATOM 32195 C14 PA 811 129.510 120.488 52.986 1.00 0.00 C ATOM 32196 H4R PA 811 129.459 119.572 52.394 1.00 0.00 H ATOM 32197 H4S PA 811 128.890 121.248 52.507 1.00 0.00 H ATOM 32198 C13 PA 811 128.899 120.146 54.293 1.00 0.00 C ATOM 32199 H3R PA 811 129.053 121.055 54.877 1.00 0.00 H ATOM 32200 H3S PA 811 129.406 119.343 54.832 1.00 0.00 H ATOM 32201 C12 PA 811 127.448 119.793 54.165 1.00 0.00 C ATOM 32202 H2R PA 811 127.410 118.744 53.864 1.00 0.00 H ATOM 32203 H2S PA 811 126.853 120.369 53.453 1.00 0.00 H ATOM 32204 C11 PGR 812 126.714 119.738 55.430 1.00 0.00 C ATOM 32205 O12 PGR 812 127.234 120.132 56.464 1.00 0.00 O ATOM 32206 O11 PGR 812 125.479 119.234 55.278 1.00 0.00 O ATOM 32207 C1 PGR 812 124.595 119.336 56.441 1.00 0.00 C ATOM 32208 HR PGR 812 125.138 118.910 57.288 1.00 0.00 H ATOM 32209 HS PGR 812 123.637 118.821 56.332 1.00 0.00 H ATOM 32210 C2 PGR 812 124.385 120.764 56.752 1.00 0.00 C ATOM 32211 HX PGR 812 125.299 121.363 56.721 1.00 0.00 H ATOM 32212 C3 PGR 812 123.982 120.934 58.223 1.00 0.00 C ATOM 32213 HA PGR 812 124.446 120.249 58.937 1.00 0.00 H ATOM 32214 HB PGR 812 122.899 120.861 58.350 1.00 0.00 H ATOM 32215 O31 PGR 812 124.552 122.171 58.627 1.00 0.00 O ATOM 32216 P31 PGR 812 124.089 122.823 59.995 1.00 0.00 P ATOM 32217 O32 PGR 812 124.571 121.799 61.094 1.00 0.00 O ATOM 32218 C31 PGR 812 125.900 121.832 61.665 1.00 0.00 C ATOM 32219 H1A PGR 812 126.225 122.774 62.113 1.00 0.00 H ATOM 32220 H1B PGR 812 126.548 121.614 60.812 1.00 0.00 H ATOM 32221 C32 PGR 812 126.099 120.854 62.751 1.00 0.00 C ATOM 32222 H2A PGR 812 125.886 119.855 62.364 1.00 0.00 H ATOM 32223 O35 PGR 812 125.164 121.007 63.881 1.00 0.00 O ATOM 32224 HO5A PGR 812 125.512 120.462 64.609 1.00 0.00 H ATOM 32225 C33 PGR 812 127.513 120.692 63.498 1.00 0.00 C ATOM 32226 H3A PGR 812 127.452 119.935 64.284 1.00 0.00 H ATOM 32227 H3B PGR 812 128.263 120.384 62.765 1.00 0.00 H ATOM 32228 O33 PGR 812 124.804 124.080 60.093 1.00 0.00 O ATOM 32229 O34 PGR 812 122.605 122.878 60.043 1.00 0.00 O ATOM 32230 O21 PGR 812 123.344 121.162 55.865 1.00 0.00 O ATOM 32231 C21 PGR 812 123.376 122.405 55.264 1.00 0.00 C ATOM 32232 O22 PGR 812 124.380 123.020 55.114 1.00 0.00 O ATOM 32233 O36 PGR 812 127.976 121.954 64.087 1.00 0.00 O ATOM 32234 HO6A PGR 812 128.933 122.018 63.914 1.00 0.00 H ATOM 32235 C12 OL 813 122.022 122.669 54.632 1.00 0.00 C ATOM 32236 H2R OL 813 121.377 122.151 55.345 1.00 0.00 H ATOM 32237 H2S OL 813 121.763 123.730 54.608 1.00 0.00 H ATOM 32238 C13 OL 813 121.863 122.011 53.224 1.00 0.00 C ATOM 32239 H3R OL 813 122.090 120.943 53.270 1.00 0.00 H ATOM 32240 H3S OL 813 120.808 122.096 52.957 1.00 0.00 H ATOM 32241 C14 OL 813 122.578 122.739 52.018 1.00 0.00 C ATOM 32242 H4R OL 813 122.103 123.719 51.940 1.00 0.00 H ATOM 32243 H4S OL 813 123.651 122.820 52.208 1.00 0.00 H ATOM 32244 C15 OL 813 122.524 121.975 50.696 1.00 0.00 C ATOM 32245 H5R OL 813 123.254 121.170 50.589 1.00 0.00 H ATOM 32246 H5S OL 813 121.527 121.529 50.717 1.00 0.00 H ATOM 32247 C16 OL 813 122.844 122.942 49.555 1.00 0.00 C ATOM 32248 H6R OL 813 122.122 123.749 49.696 1.00 0.00 H ATOM 32249 H6S OL 813 123.851 123.347 49.682 1.00 0.00 H ATOM 32250 C17 OL 813 122.903 122.348 48.150 1.00 0.00 C ATOM 32251 H7R OL 813 123.583 121.495 48.205 1.00 0.00 H ATOM 32252 H7S OL 813 121.916 121.883 48.100 1.00 0.00 H ATOM 32253 C18 OL 813 123.112 123.368 47.001 1.00 0.00 C ATOM 32254 H8R OL 813 123.984 123.953 47.301 1.00 0.00 H ATOM 32255 H8S OL 813 123.397 122.878 46.068 1.00 0.00 H ATOM 32256 C19 OL 813 121.988 124.296 46.788 1.00 0.00 C ATOM 32257 H9R OL 813 121.820 125.030 47.573 1.00 0.00 H ATOM 32258 C110 OL 813 121.251 124.330 45.727 1.00 0.00 C ATOM 32259 H10R OL 813 120.562 125.165 45.623 1.00 0.00 H ATOM 32260 C111 OL 813 121.175 123.376 44.510 1.00 0.00 C ATOM 32261 H11R OL 813 121.717 122.434 44.618 1.00 0.00 H ATOM 32262 H11S OL 813 120.162 122.983 44.402 1.00 0.00 H ATOM 32263 C112 OL 813 121.628 124.141 43.279 1.00 0.00 C ATOM 32264 H12R OL 813 120.852 124.842 42.964 1.00 0.00 H ATOM 32265 H12S OL 813 122.462 124.833 43.412 1.00 0.00 H ATOM 32266 C113 OL 813 121.694 123.350 41.936 1.00 0.00 C ATOM 32267 H13R OL 813 122.411 122.569 42.197 1.00 0.00 H ATOM 32268 H13S OL 813 120.696 122.908 41.903 1.00 0.00 H ATOM 32269 C114 OL 813 121.909 124.133 40.575 1.00 0.00 C ATOM 32270 H14R OL 813 121.158 124.874 40.296 1.00 0.00 H ATOM 32271 H14S OL 813 122.798 124.707 40.846 1.00 0.00 H ATOM 32272 C115 OL 813 122.315 123.250 39.422 1.00 0.00 C ATOM 32273 H15R OL 813 123.364 122.953 39.496 1.00 0.00 H ATOM 32274 H15S OL 813 121.921 122.262 39.672 1.00 0.00 H ATOM 32275 C116 OL 813 122.002 123.620 38.059 1.00 0.00 C ATOM 32276 H16R OL 813 120.960 123.948 38.035 1.00 0.00 H ATOM 32277 H16S OL 813 122.392 124.610 37.815 1.00 0.00 H ATOM 32278 C117 OL 813 122.198 122.605 36.938 1.00 0.00 C ATOM 32279 H17R OL 813 121.987 123.111 35.993 1.00 0.00 H ATOM 32280 H17S OL 813 123.224 122.236 36.995 1.00 0.00 H ATOM 32281 C118 OL 813 121.188 121.415 37.030 1.00 0.00 C ATOM 32282 H18R OL 813 121.261 120.821 36.117 1.00 0.00 H ATOM 32283 H18S OL 813 120.172 121.809 37.092 1.00 0.00 H ATOM 32284 H18T OL 813 121.399 120.906 37.972 1.00 0.00 H TER 32285 OL 813 ATOM 32285 C116 PA 814 39.650 129.450 43.608 1.00 0.00 C ATOM 32286 H16R PA 814 40.523 129.819 43.067 1.00 0.00 H ATOM 32287 H16S PA 814 39.774 128.366 43.549 1.00 0.00 H ATOM 32288 H16T PA 814 39.615 129.776 44.650 1.00 0.00 H ATOM 32289 C115 PA 814 38.335 129.861 42.943 1.00 0.00 C ATOM 32290 H15R PA 814 37.446 129.568 43.505 1.00 0.00 H ATOM 32291 H15S PA 814 38.348 129.229 42.053 1.00 0.00 H ATOM 32292 C114 PA 814 38.150 131.247 42.521 1.00 0.00 C ATOM 32293 H14R PA 814 38.057 131.878 43.407 1.00 0.00 H ATOM 32294 H14S PA 814 37.208 131.371 41.983 1.00 0.00 H ATOM 32295 C113 PA 814 39.346 131.966 41.760 1.00 0.00 C ATOM 32296 H13R PA 814 39.415 131.355 40.858 1.00 0.00 H ATOM 32297 H13S PA 814 40.287 131.730 42.262 1.00 0.00 H ATOM 32298 C112 PA 814 39.273 133.531 41.638 1.00 0.00 C ATOM 32299 H12R PA 814 40.110 133.833 41.006 1.00 0.00 H ATOM 32300 H12S PA 814 39.615 133.941 42.591 1.00 0.00 H ATOM 32301 C111 PA 814 37.960 134.127 41.159 1.00 0.00 C ATOM 32302 H11R PA 814 37.057 133.694 41.593 1.00 0.00 H ATOM 32303 H11S PA 814 37.830 133.792 40.127 1.00 0.00 H ATOM 32304 C110 PA 814 37.947 135.574 41.257 1.00 0.00 C ATOM 32305 H10R PA 814 38.739 135.943 40.602 1.00 0.00 H ATOM 32306 H10S PA 814 38.309 135.828 42.256 1.00 0.00 H ATOM 32307 C19 PA 814 36.540 136.142 40.927 1.00 0.00 C ATOM 32308 H9R PA 814 36.309 135.866 39.896 1.00 0.00 H ATOM 32309 H9S PA 814 36.565 137.234 40.932 1.00 0.00 H ATOM 32310 C18 PA 814 35.376 135.672 41.874 1.00 0.00 C ATOM 32311 H8R PA 814 35.171 134.611 41.716 1.00 0.00 H ATOM 32312 H8S PA 814 34.481 136.161 41.484 1.00 0.00 H ATOM 32313 C17 PA 814 35.562 136.087 43.340 1.00 0.00 C ATOM 32314 H7R PA 814 35.828 137.145 43.368 1.00 0.00 H ATOM 32315 H7S PA 814 36.323 135.544 43.904 1.00 0.00 H ATOM 32316 C16 PA 814 34.393 135.779 44.344 1.00 0.00 C ATOM 32317 H6R PA 814 34.351 134.702 44.520 1.00 0.00 H ATOM 32318 H6S PA 814 33.549 136.223 43.812 1.00 0.00 H ATOM 32319 C15 PA 814 34.678 136.338 45.687 1.00 0.00 C ATOM 32320 H5R PA 814 34.871 137.412 45.710 1.00 0.00 H ATOM 32321 H5S PA 814 35.611 135.881 46.024 1.00 0.00 H ATOM 32322 C14 PA 814 33.665 135.967 46.776 1.00 0.00 C ATOM 32323 H4R PA 814 33.313 134.936 46.703 1.00 0.00 H ATOM 32324 H4S PA 814 32.798 136.594 46.559 1.00 0.00 H ATOM 32325 C13 PA 814 34.058 136.408 48.203 1.00 0.00 C ATOM 32326 H3R PA 814 33.106 136.353 48.736 1.00 0.00 H ATOM 32327 H3S PA 814 34.421 137.435 48.275 1.00 0.00 H ATOM 32328 C12 PA 814 35.097 135.438 48.815 1.00 0.00 C ATOM 32329 H2R PA 814 36.127 135.690 48.553 1.00 0.00 H ATOM 32330 H2S PA 814 35.013 134.411 48.453 1.00 0.00 H ATOM 32331 C11 PGR 815 34.986 135.491 50.320 1.00 0.00 C ATOM 32332 O12 PGR 815 34.433 134.602 50.918 1.00 0.00 O ATOM 32333 O11 PGR 815 35.420 136.662 50.778 1.00 0.00 O ATOM 32334 C1 PGR 815 35.600 136.590 52.305 1.00 0.00 C ATOM 32335 HR PGR 815 34.631 136.271 52.698 1.00 0.00 H ATOM 32336 HS PGR 815 35.889 137.629 52.481 1.00 0.00 H ATOM 32337 C2 PGR 815 36.805 135.747 52.721 1.00 0.00 C ATOM 32338 HX PGR 815 36.674 134.830 52.141 1.00 0.00 H ATOM 32339 C3 PGR 815 36.732 135.452 54.236 1.00 0.00 C ATOM 32340 HA PGR 815 37.662 135.000 54.590 1.00 0.00 H ATOM 32341 HB PGR 815 35.986 134.703 54.514 1.00 0.00 H ATOM 32342 O31 PGR 815 36.456 136.686 54.919 1.00 0.00 O ATOM 32343 P31 PGR 815 36.317 136.854 56.516 1.00 0.00 P ATOM 32344 O32 PGR 815 34.744 136.895 56.649 1.00 0.00 O ATOM 32345 C31 PGR 815 33.975 137.991 56.259 1.00 0.00 C ATOM 32346 H1A PGR 815 34.171 138.942 56.759 1.00 0.00 H ATOM 32347 H1B PGR 815 34.267 138.097 55.212 1.00 0.00 H ATOM 32348 C32 PGR 815 32.526 137.669 56.278 1.00 0.00 C ATOM 32349 H2A PGR 815 32.293 137.078 57.168 1.00 0.00 H ATOM 32350 O35 PGR 815 32.178 137.137 55.018 1.00 0.00 O ATOM 32351 HO5A PGR 815 32.192 136.163 55.010 1.00 0.00 H ATOM 32352 C33 PGR 815 31.711 138.985 56.402 1.00 0.00 C ATOM 32353 H3A PGR 815 30.648 138.791 56.235 1.00 0.00 H ATOM 32354 H3B PGR 815 31.927 139.415 57.383 1.00 0.00 H ATOM 32355 O33 PGR 815 36.747 135.593 57.194 1.00 0.00 O ATOM 32356 O34 PGR 815 36.931 138.113 56.873 1.00 0.00 O ATOM 32357 O21 PGR 815 38.085 136.393 52.393 1.00 0.00 O ATOM 32358 C21 PGR 815 38.492 136.320 51.101 1.00 0.00 C ATOM 32359 O22 PGR 815 38.071 135.563 50.210 1.00 0.00 O ATOM 32360 O36 PGR 815 32.098 139.852 55.281 1.00 0.00 O ATOM 32361 HO6A PGR 815 31.689 140.728 55.400 1.00 0.00 H ATOM 32362 C12 OL 816 39.601 137.344 50.898 1.00 0.00 C ATOM 32363 H2R OL 816 40.309 137.229 51.722 1.00 0.00 H ATOM 32364 H2S OL 816 40.061 137.254 49.912 1.00 0.00 H ATOM 32365 C13 OL 816 38.924 138.743 50.943 1.00 0.00 C ATOM 32366 H3R OL 816 37.967 138.776 50.417 1.00 0.00 H ATOM 32367 H3S OL 816 38.693 138.968 51.986 1.00 0.00 H ATOM 32368 C14 OL 816 39.894 139.802 50.504 1.00 0.00 C ATOM 32369 H4R OL 816 40.898 139.599 50.882 1.00 0.00 H ATOM 32370 H4S OL 816 40.039 139.699 49.426 1.00 0.00 H ATOM 32371 C15 OL 816 39.529 141.269 50.877 1.00 0.00 C ATOM 32372 H5R OL 816 38.608 141.697 50.475 1.00 0.00 H ATOM 32373 H5S OL 816 39.372 141.232 51.957 1.00 0.00 H ATOM 32374 C16 OL 816 40.557 142.331 50.585 1.00 0.00 C ATOM 32375 H6R OL 816 40.088 143.221 51.010 1.00 0.00 H ATOM 32376 H6S OL 816 41.365 142.149 51.296 1.00 0.00 H ATOM 32377 C17 OL 816 41.135 142.563 49.233 1.00 0.00 C ATOM 32378 H7R OL 816 41.856 143.363 49.414 1.00 0.00 H ATOM 32379 H7S OL 816 41.625 141.648 48.894 1.00 0.00 H ATOM 32380 C18 OL 816 40.150 142.941 48.074 1.00 0.00 C ATOM 32381 H8R OL 816 39.697 141.968 47.873 1.00 0.00 H ATOM 32382 H8S OL 816 39.408 143.644 48.458 1.00 0.00 H ATOM 32383 C19 OL 816 40.956 143.557 46.954 1.00 0.00 C ATOM 32384 H9R OL 816 41.278 144.531 47.312 1.00 0.00 H ATOM 32385 C110 OL 816 41.429 143.063 45.744 1.00 0.00 C ATOM 32386 H10R OL 816 42.052 143.675 45.097 1.00 0.00 H ATOM 32387 C111 OL 816 41.203 141.689 45.296 1.00 0.00 C ATOM 32388 H11R OL 816 40.551 141.124 45.965 1.00 0.00 H ATOM 32389 H11S OL 816 40.577 141.972 44.447 1.00 0.00 H ATOM 32390 C112 OL 816 42.346 140.812 44.785 1.00 0.00 C ATOM 32391 H12R OL 816 41.893 139.922 44.341 1.00 0.00 H ATOM 32392 H12S OL 816 42.890 141.242 43.942 1.00 0.00 H ATOM 32393 C113 OL 816 43.299 140.598 45.930 1.00 0.00 C ATOM 32394 H13R OL 816 44.260 140.458 45.431 1.00 0.00 H ATOM 32395 H13S OL 816 43.342 141.465 46.592 1.00 0.00 H ATOM 32396 C114 OL 816 42.936 139.379 46.806 1.00 0.00 C ATOM 32397 H14R OL 816 42.071 139.479 47.465 1.00 0.00 H ATOM 32398 H14S OL 816 42.632 138.538 46.180 1.00 0.00 H ATOM 32399 C115 OL 816 44.110 138.864 47.668 1.00 0.00 C ATOM 32400 H15R OL 816 44.984 138.499 47.123 1.00 0.00 H ATOM 32401 H15S OL 816 44.444 139.669 48.326 1.00 0.00 H ATOM 32402 C116 OL 816 43.760 137.632 48.484 1.00 0.00 C ATOM 32403 H16R OL 816 42.949 137.080 48.005 1.00 0.00 H ATOM 32404 H16S OL 816 44.643 136.991 48.437 1.00 0.00 H ATOM 32405 C117 OL 816 43.247 137.924 49.831 1.00 0.00 C ATOM 32406 H17R OL 816 42.354 138.552 49.835 1.00 0.00 H ATOM 32407 H17S OL 816 43.001 136.979 50.320 1.00 0.00 H ATOM 32408 C118 OL 816 44.321 138.636 50.720 1.00 0.00 C ATOM 32409 H18R OL 816 45.329 138.283 50.490 1.00 0.00 H ATOM 32410 H18S OL 816 44.156 138.351 51.761 1.00 0.00 H ATOM 32411 H18T OL 816 44.360 139.719 50.584 1.00 0.00 H TER 32412 OL 816 ATOM 32412 C116 PA 817 134.733 117.080 40.828 1.00 0.00 C ATOM 32413 H16R PA 817 133.657 117.152 40.998 1.00 0.00 H ATOM 32414 H16S PA 817 134.867 116.111 40.342 1.00 0.00 H ATOM 32415 H16T PA 817 135.085 117.867 40.159 1.00 0.00 H ATOM 32416 C115 PA 817 135.351 117.087 42.198 1.00 0.00 C ATOM 32417 H15R PA 817 136.427 116.909 42.165 1.00 0.00 H ATOM 32418 H15S PA 817 134.821 116.385 42.846 1.00 0.00 H ATOM 32419 C114 PA 817 135.199 118.532 42.804 1.00 0.00 C ATOM 32420 H14R PA 817 134.360 119.075 42.365 1.00 0.00 H ATOM 32421 H14S PA 817 136.036 119.189 42.561 1.00 0.00 H ATOM 32422 C113 PA 817 134.959 118.510 44.338 1.00 0.00 C ATOM 32423 H13R PA 817 135.681 117.851 44.825 1.00 0.00 H ATOM 32424 H13S PA 817 134.039 117.953 44.529 1.00 0.00 H ATOM 32425 C112 PA 817 134.833 119.874 45.062 1.00 0.00 C ATOM 32426 H12R PA 817 133.830 120.207 44.788 1.00 0.00 H ATOM 32427 H12S PA 817 135.519 120.500 44.488 1.00 0.00 H ATOM 32428 C111 PA 817 134.984 119.928 46.561 1.00 0.00 C ATOM 32429 H11R PA 817 135.991 119.588 46.811 1.00 0.00 H ATOM 32430 H11S PA 817 134.161 119.326 46.953 1.00 0.00 H ATOM 32431 C110 PA 817 134.834 121.341 47.019 1.00 0.00 C ATOM 32432 H10R PA 817 133.828 121.687 46.774 1.00 0.00 H ATOM 32433 H10S PA 817 135.556 122.051 46.610 1.00 0.00 H ATOM 32434 C19 PA 817 134.714 121.696 48.472 1.00 0.00 C ATOM 32435 H9R PA 817 133.885 121.108 48.871 1.00 0.00 H ATOM 32436 H9S PA 817 134.234 122.676 48.459 1.00 0.00 H ATOM 32437 C18 PA 817 136.004 121.375 49.256 1.00 0.00 C ATOM 32438 H8R PA 817 136.689 122.212 49.105 1.00 0.00 H ATOM 32439 H8S PA 817 136.484 120.497 48.818 1.00 0.00 H ATOM 32440 C17 PA 817 135.722 121.230 50.751 1.00 0.00 C ATOM 32441 H7R PA 817 134.914 120.531 50.975 1.00 0.00 H ATOM 32442 H7S PA 817 135.386 122.149 51.235 1.00 0.00 H ATOM 32443 C16 PA 817 136.954 120.809 51.573 1.00 0.00 C ATOM 32444 H6R PA 817 137.619 121.674 51.527 1.00 0.00 H ATOM 32445 H6S PA 817 137.373 120.012 50.956 1.00 0.00 H ATOM 32446 C15 PA 817 136.551 120.323 53.000 1.00 0.00 C ATOM 32447 H5R PA 817 136.157 119.305 52.976 1.00 0.00 H ATOM 32448 H5S PA 817 135.817 121.030 53.391 1.00 0.00 H ATOM 32449 C14 PA 817 137.796 120.156 53.916 1.00 0.00 C ATOM 32450 H4R PA 817 138.280 121.133 53.986 1.00 0.00 H ATOM 32451 H4S PA 817 138.565 119.522 53.468 1.00 0.00 H ATOM 32452 C13 PA 817 137.411 119.750 55.364 1.00 0.00 C ATOM 32453 H3R PA 817 138.331 119.353 55.798 1.00 0.00 H ATOM 32454 H3S PA 817 136.756 118.883 55.255 1.00 0.00 H ATOM 32455 C12 PA 817 136.612 120.712 56.186 1.00 0.00 C ATOM 32456 H2R PA 817 135.573 120.810 55.862 1.00 0.00 H ATOM 32457 H2S PA 817 137.015 121.722 56.089 1.00 0.00 H ATOM 32458 C11 PGR 818 136.576 120.471 57.610 1.00 0.00 C ATOM 32459 O12 PGR 818 136.930 119.397 58.129 1.00 0.00 O ATOM 32460 O11 PGR 818 135.953 121.457 58.255 1.00 0.00 O ATOM 32461 C1 PGR 818 135.888 121.379 59.735 1.00 0.00 C ATOM 32462 HR PGR 818 135.387 120.451 60.022 1.00 0.00 H ATOM 32463 HS PGR 818 135.259 122.194 60.102 1.00 0.00 H ATOM 32464 C2 PGR 818 137.279 121.494 60.327 1.00 0.00 C ATOM 32465 HX PGR 818 138.061 120.780 60.055 1.00 0.00 H ATOM 32466 C3 PGR 818 137.105 121.388 61.893 1.00 0.00 C ATOM 32467 HA PGR 818 138.067 121.622 62.357 1.00 0.00 H ATOM 32468 HB PGR 818 136.795 120.366 62.124 1.00 0.00 H ATOM 32469 O31 PGR 818 135.982 122.206 62.312 1.00 0.00 O ATOM 32470 P31 PGR 818 135.748 122.788 63.817 1.00 0.00 P ATOM 32471 O32 PGR 818 136.491 121.804 64.771 1.00 0.00 O ATOM 32472 C31 PGR 818 136.334 121.781 66.213 1.00 0.00 C ATOM 32473 H1A PGR 818 135.259 121.923 66.355 1.00 0.00 H ATOM 32474 H1B PGR 818 136.940 122.600 66.608 1.00 0.00 H ATOM 32475 C32 PGR 818 136.699 120.466 66.911 1.00 0.00 C ATOM 32476 H2A PGR 818 136.250 120.455 67.908 1.00 0.00 H ATOM 32477 O35 PGR 818 138.132 120.315 67.023 1.00 0.00 O ATOM 32478 HO5A PGR 818 138.582 120.253 66.162 1.00 0.00 H ATOM 32479 C33 PGR 818 136.157 119.274 66.117 1.00 0.00 C ATOM 32480 H3A PGR 818 135.115 119.546 65.934 1.00 0.00 H ATOM 32481 H3B PGR 818 136.698 119.176 65.172 1.00 0.00 H ATOM 32482 O33 PGR 818 136.444 124.042 63.957 1.00 0.00 O ATOM 32483 O34 PGR 818 134.298 122.725 63.942 1.00 0.00 O ATOM 32484 O21 PGR 818 137.733 122.802 60.045 1.00 0.00 O ATOM 32485 C21 PGR 818 138.508 123.048 58.974 1.00 0.00 C ATOM 32486 O22 PGR 818 138.887 122.258 58.160 1.00 0.00 O ATOM 32487 O36 PGR 818 136.160 117.952 66.791 1.00 0.00 O ATOM 32488 HO6A PGR 818 137.092 117.849 67.056 1.00 0.00 H ATOM 32489 C12 OL 819 138.644 124.490 58.657 1.00 0.00 C ATOM 32490 H2R OL 819 138.861 124.909 59.642 1.00 0.00 H ATOM 32491 H2S OL 819 139.571 124.646 58.101 1.00 0.00 H ATOM 32492 C13 OL 819 137.402 125.119 57.934 1.00 0.00 C ATOM 32493 H3R OL 819 137.034 124.368 57.232 1.00 0.00 H ATOM 32494 H3S OL 819 136.602 125.286 58.658 1.00 0.00 H ATOM 32495 C14 OL 819 137.777 126.462 57.216 1.00 0.00 C ATOM 32496 H4R OL 819 138.145 127.167 57.964 1.00 0.00 H ATOM 32497 H4S OL 819 138.564 126.190 56.511 1.00 0.00 H ATOM 32498 C15 OL 819 136.652 127.207 56.447 1.00 0.00 C ATOM 32499 H5R OL 819 136.230 126.605 55.639 1.00 0.00 H ATOM 32500 H5S OL 819 135.830 127.352 57.151 1.00 0.00 H ATOM 32501 C16 OL 819 136.993 128.584 55.821 1.00 0.00 C ATOM 32502 H6R OL 819 136.258 128.892 55.074 1.00 0.00 H ATOM 32503 H6S OL 819 136.958 129.302 56.643 1.00 0.00 H ATOM 32504 C17 OL 819 138.440 128.725 55.200 1.00 0.00 C ATOM 32505 H7R OL 819 138.469 129.753 54.833 1.00 0.00 H ATOM 32506 H7S OL 819 139.270 128.557 55.889 1.00 0.00 H ATOM 32507 C18 OL 819 138.671 127.999 53.842 1.00 0.00 C ATOM 32508 H8R OL 819 138.429 126.967 54.107 1.00 0.00 H ATOM 32509 H8S OL 819 137.967 128.231 53.040 1.00 0.00 H ATOM 32510 C19 OL 819 140.052 128.113 53.244 1.00 0.00 C ATOM 32511 H9R OL 819 140.772 127.360 53.555 1.00 0.00 H ATOM 32512 C110 OL 819 140.451 128.949 52.237 1.00 0.00 C ATOM 32513 H10R OL 819 141.493 128.812 51.959 1.00 0.00 H ATOM 32514 C111 OL 819 139.660 130.011 51.528 1.00 0.00 C ATOM 32515 H11R OL 819 138.614 130.174 51.793 1.00 0.00 H ATOM 32516 H11S OL 819 140.072 131.011 51.679 1.00 0.00 H ATOM 32517 C112 OL 819 139.594 129.825 50.017 1.00 0.00 C ATOM 32518 H12R OL 819 139.219 130.771 49.623 1.00 0.00 H ATOM 32519 H12S OL 819 140.569 129.759 49.531 1.00 0.00 H ATOM 32520 C113 OL 819 138.728 128.636 49.509 1.00 0.00 C ATOM 32521 H13R OL 819 139.021 127.746 50.070 1.00 0.00 H ATOM 32522 H13S OL 819 137.718 128.799 49.890 1.00 0.00 H ATOM 32523 C114 OL 819 138.762 128.508 48.061 1.00 0.00 C ATOM 32524 H14R OL 819 139.773 128.296 47.704 1.00 0.00 H ATOM 32525 H14S OL 819 138.131 127.667 47.765 1.00 0.00 H ATOM 32526 C115 OL 819 138.218 129.721 47.255 1.00 0.00 C ATOM 32527 H15R OL 819 137.203 129.895 47.616 1.00 0.00 H ATOM 32528 H15S OL 819 138.736 130.672 47.396 1.00 0.00 H ATOM 32529 C116 OL 819 138.078 129.547 45.777 1.00 0.00 C ATOM 32530 H16R OL 819 137.523 128.629 45.574 1.00 0.00 H ATOM 32531 H16S OL 819 137.590 130.372 45.254 1.00 0.00 H ATOM 32532 C117 OL 819 139.405 129.233 45.017 1.00 0.00 C ATOM 32533 H17R OL 819 139.953 130.175 45.072 1.00 0.00 H ATOM 32534 H17S OL 819 140.040 128.517 45.544 1.00 0.00 H ATOM 32535 C118 OL 819 139.083 128.741 43.627 1.00 0.00 C ATOM 32536 H18R OL 819 139.938 128.202 43.214 1.00 0.00 H ATOM 32537 H18S OL 819 139.049 129.684 43.077 1.00 0.00 H ATOM 32538 H18T OL 819 138.111 128.247 43.560 1.00 0.00 H TER 32539 OL 819 ATOM 32539 C116 PA 820 117.138 127.652 46.743 1.00 0.00 C ATOM 32540 H16R PA 820 116.447 127.964 47.529 1.00 0.00 H ATOM 32541 H16S PA 820 117.890 127.051 47.258 1.00 0.00 H ATOM 32542 H16T PA 820 116.715 127.016 45.962 1.00 0.00 H ATOM 32543 C115 PA 820 117.817 128.895 46.115 1.00 0.00 C ATOM 32544 H15R PA 820 117.195 129.385 45.363 1.00 0.00 H ATOM 32545 H15S PA 820 118.716 128.502 45.635 1.00 0.00 H ATOM 32546 C114 PA 820 118.339 129.896 47.197 1.00 0.00 C ATOM 32547 H14R PA 820 118.766 129.403 48.073 1.00 0.00 H ATOM 32548 H14S PA 820 117.524 130.514 47.578 1.00 0.00 H ATOM 32549 C113 PA 820 119.370 130.764 46.604 1.00 0.00 C ATOM 32550 H13R PA 820 119.265 130.977 45.538 1.00 0.00 H ATOM 32551 H13S PA 820 120.315 130.234 46.741 1.00 0.00 H ATOM 32552 C112 PA 820 119.412 132.134 47.239 1.00 0.00 C ATOM 32553 H12R PA 820 118.558 132.746 46.943 1.00 0.00 H ATOM 32554 H12S PA 820 120.247 132.689 46.807 1.00 0.00 H ATOM 32555 C111 PA 820 119.530 132.322 48.706 1.00 0.00 C ATOM 32556 H11R PA 820 120.535 132.311 49.134 1.00 0.00 H ATOM 32557 H11S PA 820 119.041 131.551 49.304 1.00 0.00 H ATOM 32558 C110 PA 820 119.001 133.659 49.178 1.00 0.00 C ATOM 32559 H10R PA 820 118.014 133.944 48.807 1.00 0.00 H ATOM 32560 H10S PA 820 119.767 134.337 48.797 1.00 0.00 H ATOM 32561 C19 PA 820 118.912 133.782 50.712 1.00 0.00 C ATOM 32562 H9R PA 820 119.761 133.460 51.319 1.00 0.00 H ATOM 32563 H9S PA 820 118.093 133.195 51.132 1.00 0.00 H ATOM 32564 C18 PA 820 118.572 135.265 51.079 1.00 0.00 C ATOM 32565 H8R PA 820 119.180 135.959 50.495 1.00 0.00 H ATOM 32566 H8S PA 820 118.924 135.381 52.106 1.00 0.00 H ATOM 32567 C17 PA 820 117.122 135.744 50.866 1.00 0.00 C ATOM 32568 H7R PA 820 116.513 135.217 51.604 1.00 0.00 H ATOM 32569 H7S PA 820 116.803 135.396 49.881 1.00 0.00 H ATOM 32570 C16 PA 820 116.821 137.285 50.913 1.00 0.00 C ATOM 32571 H6R PA 820 115.961 137.637 50.340 1.00 0.00 H ATOM 32572 H6S PA 820 117.629 137.631 50.266 1.00 0.00 H ATOM 32573 C15 PA 820 116.818 137.901 52.275 1.00 0.00 C ATOM 32574 H5R PA 820 117.812 137.743 52.698 1.00 0.00 H ATOM 32575 H5S PA 820 116.126 137.373 52.934 1.00 0.00 H ATOM 32576 C14 PA 820 116.784 139.464 52.329 1.00 0.00 C ATOM 32577 H4R PA 820 115.807 139.717 51.911 1.00 0.00 H ATOM 32578 H4S PA 820 117.571 139.832 51.668 1.00 0.00 H ATOM 32579 C13 PA 820 117.029 139.910 53.788 1.00 0.00 C ATOM 32580 H3R PA 820 117.046 141.001 53.742 1.00 0.00 H ATOM 32581 H3S PA 820 118.064 139.577 53.889 1.00 0.00 H ATOM 32582 C12 PA 820 116.042 139.458 54.898 1.00 0.00 C ATOM 32583 H2R PA 820 116.123 138.381 55.061 1.00 0.00 H ATOM 32584 H2S PA 820 115.063 139.760 54.521 1.00 0.00 H ATOM 32585 C11 PGR 821 116.346 140.262 56.099 1.00 0.00 C ATOM 32586 O12 PGR 821 115.553 141.129 56.456 1.00 0.00 O ATOM 32587 O11 PGR 821 117.448 139.971 56.619 1.00 0.00 O ATOM 32588 C1 PGR 821 117.792 140.644 57.869 1.00 0.00 C ATOM 32589 HR PGR 821 117.090 140.470 58.689 1.00 0.00 H ATOM 32590 HS PGR 821 117.854 141.703 57.605 1.00 0.00 H ATOM 32591 C2 PGR 821 119.201 140.243 58.266 1.00 0.00 C ATOM 32592 HX PGR 821 119.285 139.154 58.316 1.00 0.00 H ATOM 32593 C3 PGR 821 119.553 140.758 59.713 1.00 0.00 C ATOM 32594 HA PGR 821 120.611 140.714 59.983 1.00 0.00 H ATOM 32595 HB PGR 821 118.902 140.232 60.416 1.00 0.00 H ATOM 32596 O31 PGR 821 119.191 142.121 59.698 1.00 0.00 O ATOM 32597 P31 PGR 821 119.174 143.105 61.032 1.00 0.00 P ATOM 32598 O32 PGR 821 118.211 144.251 60.425 1.00 0.00 O ATOM 32599 C31 PGR 821 116.853 144.017 60.093 1.00 0.00 C ATOM 32600 H1A PGR 821 116.260 144.036 61.011 1.00 0.00 H ATOM 32601 H1B PGR 821 116.611 143.091 59.565 1.00 0.00 H ATOM 32602 C32 PGR 821 116.418 145.192 59.159 1.00 0.00 C ATOM 32603 H2A PGR 821 116.977 145.046 58.232 1.00 0.00 H ATOM 32604 O35 PGR 821 116.754 146.410 59.789 1.00 0.00 O ATOM 32605 HO5A PGR 821 116.334 146.327 60.664 1.00 0.00 H ATOM 32606 C33 PGR 821 114.885 145.158 58.735 1.00 0.00 C ATOM 32607 H3A PGR 821 114.592 145.979 58.075 1.00 0.00 H ATOM 32608 H3B PGR 821 114.632 144.290 58.120 1.00 0.00 H ATOM 32609 O33 PGR 821 118.520 142.373 62.037 1.00 0.00 O ATOM 32610 O34 PGR 821 120.536 143.590 61.322 1.00 0.00 O ATOM 32611 O21 PGR 821 120.019 140.833 57.228 1.00 0.00 O ATOM 32612 C21 PGR 821 121.282 140.466 57.158 1.00 0.00 C ATOM 32613 O22 PGR 821 121.696 139.480 57.751 1.00 0.00 O ATOM 32614 O36 PGR 821 114.156 145.116 59.893 1.00 0.00 O ATOM 32615 HO6A PGR 821 114.282 146.018 60.238 1.00 0.00 H ATOM 32616 C12 OL 822 122.085 141.367 56.286 1.00 0.00 C ATOM 32617 H2R OL 822 121.974 142.410 56.590 1.00 0.00 H ATOM 32618 H2S OL 822 123.157 141.178 56.378 1.00 0.00 H ATOM 32619 C13 OL 822 121.804 141.246 54.806 1.00 0.00 C ATOM 32620 H3R OL 822 121.785 140.204 54.481 1.00 0.00 H ATOM 32621 H3S OL 822 120.797 141.641 54.655 1.00 0.00 H ATOM 32622 C14 OL 822 122.773 141.911 53.829 1.00 0.00 C ATOM 32623 H4R OL 822 122.369 141.917 52.815 1.00 0.00 H ATOM 32624 H4S OL 822 122.743 142.982 54.039 1.00 0.00 H ATOM 32625 C15 OL 822 124.271 141.574 53.853 1.00 0.00 C ATOM 32626 H5R OL 822 124.773 142.103 54.665 1.00 0.00 H ATOM 32627 H5S OL 822 124.458 140.508 53.999 1.00 0.00 H ATOM 32628 C16 OL 822 124.997 141.981 52.564 1.00 0.00 C ATOM 32629 H6R OL 822 124.537 141.265 51.879 1.00 0.00 H ATOM 32630 H6S OL 822 124.659 142.977 52.268 1.00 0.00 H ATOM 32631 C17 OL 822 126.548 141.790 52.592 1.00 0.00 C ATOM 32632 H7R OL 822 126.997 142.713 52.965 1.00 0.00 H ATOM 32633 H7S OL 822 126.942 141.140 53.376 1.00 0.00 H ATOM 32634 C18 OL 822 127.291 141.370 51.280 1.00 0.00 C ATOM 32635 H8R OL 822 126.998 140.371 50.950 1.00 0.00 H ATOM 32636 H8S OL 822 126.911 142.026 50.495 1.00 0.00 H ATOM 32637 C19 OL 822 128.744 141.582 51.232 1.00 0.00 C ATOM 32638 H9R OL 822 129.027 142.631 51.183 1.00 0.00 H ATOM 32639 C110 OL 822 129.711 140.610 51.368 1.00 0.00 C ATOM 32640 H10R OL 822 130.747 140.937 51.356 1.00 0.00 H ATOM 32641 C111 OL 822 129.432 139.184 51.642 1.00 0.00 C ATOM 32642 H11R OL 822 128.667 139.025 52.404 1.00 0.00 H ATOM 32643 H11S OL 822 129.091 138.710 50.719 1.00 0.00 H ATOM 32644 C112 OL 822 130.613 138.405 52.263 1.00 0.00 C ATOM 32645 H12R OL 822 130.757 138.778 53.279 1.00 0.00 H ATOM 32646 H12S OL 822 130.285 137.364 52.276 1.00 0.00 H ATOM 32647 C113 OL 822 131.898 138.538 51.488 1.00 0.00 C ATOM 32648 H13R OL 822 131.806 138.163 50.466 1.00 0.00 H ATOM 32649 H13S OL 822 132.307 139.550 51.462 1.00 0.00 H ATOM 32650 C114 OL 822 132.957 137.700 52.137 1.00 0.00 C ATOM 32651 H14R OL 822 133.907 137.937 51.654 1.00 0.00 H ATOM 32652 H14S OL 822 133.071 138.180 53.111 1.00 0.00 H ATOM 32653 C115 OL 822 132.690 136.224 52.234 1.00 0.00 C ATOM 32654 H15R OL 822 133.616 135.766 52.588 1.00 0.00 H ATOM 32655 H15S OL 822 131.993 136.121 53.069 1.00 0.00 H ATOM 32656 C116 OL 822 132.302 135.413 51.016 1.00 0.00 C ATOM 32657 H16R OL 822 131.389 135.759 50.528 1.00 0.00 H ATOM 32658 H16S OL 822 133.000 135.584 50.193 1.00 0.00 H ATOM 32659 C117 OL 822 132.151 133.906 51.356 1.00 0.00 C ATOM 32660 H17R OL 822 132.956 133.702 52.065 1.00 0.00 H ATOM 32661 H17S OL 822 131.249 133.839 51.967 1.00 0.00 H ATOM 32662 C118 OL 822 132.220 133.041 50.072 1.00 0.00 C ATOM 32663 H18R OL 822 133.047 133.453 49.490 1.00 0.00 H ATOM 32664 H18S OL 822 131.210 133.088 49.660 1.00 0.00 H ATOM 32665 H18T OL 822 132.325 131.986 50.334 1.00 0.00 H TER 32666 OL 822 ATOM 32666 C116 PA 823 90.466 102.106 47.763 1.00 0.00 C ATOM 32667 H16R PA 823 89.991 101.977 46.788 1.00 0.00 H ATOM 32668 H16S PA 823 90.747 101.052 47.811 1.00 0.00 H ATOM 32669 H16T PA 823 91.365 102.707 47.616 1.00 0.00 H ATOM 32670 C115 PA 823 89.503 102.499 48.793 1.00 0.00 C ATOM 32671 H15R PA 823 90.058 102.827 49.675 1.00 0.00 H ATOM 32672 H15S PA 823 88.914 101.702 49.252 1.00 0.00 H ATOM 32673 C114 PA 823 88.376 103.502 48.397 1.00 0.00 C ATOM 32674 H14R PA 823 88.801 104.498 48.255 1.00 0.00 H ATOM 32675 H14S PA 823 87.754 103.581 49.291 1.00 0.00 H ATOM 32676 C113 PA 823 87.438 102.908 47.237 1.00 0.00 C ATOM 32677 H13R PA 823 88.092 102.644 46.404 1.00 0.00 H ATOM 32678 H13S PA 823 86.716 103.637 46.861 1.00 0.00 H ATOM 32679 C112 PA 823 86.664 101.694 47.631 1.00 0.00 C ATOM 32680 H12R PA 823 86.263 101.959 48.612 1.00 0.00 H ATOM 32681 H12S PA 823 87.275 100.806 47.810 1.00 0.00 H ATOM 32682 C111 PA 823 85.587 101.254 46.584 1.00 0.00 C ATOM 32683 H11R PA 823 85.301 100.221 46.790 1.00 0.00 H ATOM 32684 H11S PA 823 86.003 101.167 45.579 1.00 0.00 H ATOM 32685 C110 PA 823 84.375 102.090 46.628 1.00 0.00 C ATOM 32686 H10R PA 823 84.716 103.023 46.174 1.00 0.00 H ATOM 32687 H10S PA 823 83.989 102.252 47.637 1.00 0.00 H ATOM 32688 C19 PA 823 83.225 101.555 45.822 1.00 0.00 C ATOM 32689 H9R PA 823 83.473 101.311 44.787 1.00 0.00 H ATOM 32690 H9S PA 823 82.601 102.451 45.812 1.00 0.00 H ATOM 32691 C18 PA 823 82.452 100.323 46.422 1.00 0.00 C ATOM 32692 H8R PA 823 82.869 99.339 46.199 1.00 0.00 H ATOM 32693 H8S PA 823 81.483 100.361 45.921 1.00 0.00 H ATOM 32694 C17 PA 823 82.091 100.398 47.859 1.00 0.00 C ATOM 32695 H7R PA 823 81.514 101.295 48.093 1.00 0.00 H ATOM 32696 H7S PA 823 83.120 100.417 48.222 1.00 0.00 H ATOM 32697 C16 PA 823 81.150 99.240 48.376 1.00 0.00 C ATOM 32698 H6R PA 823 81.530 98.243 48.142 1.00 0.00 H ATOM 32699 H6S PA 823 80.177 99.301 47.883 1.00 0.00 H ATOM 32700 C15 PA 823 80.882 99.288 49.843 1.00 0.00 C ATOM 32701 H5R PA 823 80.610 100.309 50.118 1.00 0.00 H ATOM 32702 H5S PA 823 81.906 99.206 50.211 1.00 0.00 H ATOM 32703 C14 PA 823 79.981 98.196 50.409 1.00 0.00 C ATOM 32704 H4R PA 823 80.543 97.259 50.427 1.00 0.00 H ATOM 32705 H4S PA 823 79.073 97.938 49.859 1.00 0.00 H ATOM 32706 C13 PA 823 79.486 98.527 51.829 1.00 0.00 C ATOM 32707 H3R PA 823 78.957 99.468 51.667 1.00 0.00 H ATOM 32708 H3S PA 823 80.275 98.660 52.572 1.00 0.00 H ATOM 32709 C12 PA 823 78.377 97.671 52.410 1.00 0.00 C ATOM 32710 H2R PA 823 78.679 96.687 52.775 1.00 0.00 H ATOM 32711 H2S PA 823 77.653 97.533 51.605 1.00 0.00 H ATOM 32712 C11 PC 824 77.689 98.324 53.610 1.00 0.00 C ATOM 32713 O12 PC 824 77.315 97.619 54.522 1.00 0.00 O ATOM 32714 O11 PC 824 77.356 99.618 53.481 1.00 0.00 O ATOM 32715 C1 PC 824 76.549 100.187 54.583 1.00 0.00 C ATOM 32716 HR PC 824 75.841 99.421 54.911 1.00 0.00 H ATOM 32717 HS PC 824 75.998 101.064 54.234 1.00 0.00 H ATOM 32718 C2 PC 824 77.397 100.523 55.828 1.00 0.00 C ATOM 32719 HX PC 824 77.870 99.619 56.223 1.00 0.00 H ATOM 32720 C3 PC 824 76.506 101.163 56.920 1.00 0.00 C ATOM 32721 HA PC 824 75.595 100.563 56.988 1.00 0.00 H ATOM 32722 HB PC 824 76.278 102.160 56.534 1.00 0.00 H ATOM 32723 O31 PC 824 77.194 101.362 58.152 1.00 0.00 O ATOM 32724 P31 PC 824 76.390 101.677 59.510 1.00 0.00 P ATOM 32725 O32 PC 824 75.433 100.426 59.766 1.00 0.00 O ATOM 32726 C31 PC 824 75.883 99.128 60.037 1.00 0.00 C ATOM 32727 H1A PC 824 76.644 99.284 60.806 1.00 0.00 H ATOM 32728 H1B PC 824 76.371 98.743 59.138 1.00 0.00 H ATOM 32729 C32 PC 824 74.793 98.201 60.549 1.00 0.00 C ATOM 32730 H2A PC 824 75.164 97.175 60.560 1.00 0.00 H ATOM 32731 H2B PC 824 73.952 98.455 59.903 1.00 0.00 H ATOM 32732 N31 PC 824 74.334 98.339 61.966 1.00 0.00 N ATOM 32733 C33 PC 824 75.299 98.106 63.040 1.00 0.00 C ATOM 32734 H3A PC 824 75.865 97.191 62.858 1.00 0.00 H ATOM 32735 H3B PC 824 74.708 98.073 63.956 1.00 0.00 H ATOM 32736 H3C PC 824 76.013 98.931 63.040 1.00 0.00 H ATOM 32737 C34 PC 824 73.705 99.654 62.088 1.00 0.00 C ATOM 32738 H4A PC 824 72.894 99.806 61.374 1.00 0.00 H ATOM 32739 H4B PC 824 74.519 100.379 62.052 1.00 0.00 H ATOM 32740 H4C PC 824 73.326 99.745 63.107 1.00 0.00 H ATOM 32741 C35 PC 824 73.256 97.330 62.236 1.00 0.00 C ATOM 32742 H5A PC 824 72.699 97.597 63.135 1.00 0.00 H ATOM 32743 H5B PC 824 73.775 96.384 62.400 1.00 0.00 H ATOM 32744 H5C PC 824 72.693 97.177 61.315 1.00 0.00 H ATOM 32745 O33 PC 824 77.319 101.795 60.637 1.00 0.00 O ATOM 32746 O34 PC 824 75.516 102.852 59.211 1.00 0.00 O ATOM 32747 O21 PC 824 78.378 101.525 55.467 1.00 0.00 O ATOM 32748 C21 PC 824 79.554 101.130 54.853 1.00 0.00 C ATOM 32749 O22 PC 824 79.927 100.010 54.622 1.00 0.00 O ATOM 32750 C12 OL 825 80.195 102.253 54.171 1.00 0.00 C ATOM 32751 H2R OL 825 80.071 103.085 54.867 1.00 0.00 H ATOM 32752 H2S OL 825 81.274 102.093 54.116 1.00 0.00 H ATOM 32753 C13 OL 825 79.541 102.545 52.778 1.00 0.00 C ATOM 32754 H3R OL 825 79.761 101.704 52.116 1.00 0.00 H ATOM 32755 H3S OL 825 78.459 102.662 52.858 1.00 0.00 H ATOM 32756 C14 OL 825 80.030 103.879 52.152 1.00 0.00 C ATOM 32757 H4R OL 825 79.830 104.797 52.709 1.00 0.00 H ATOM 32758 H4S OL 825 81.121 103.916 52.188 1.00 0.00 H ATOM 32759 C15 OL 825 79.734 103.974 50.679 1.00 0.00 C ATOM 32760 H5R OL 825 80.437 103.291 50.196 1.00 0.00 H ATOM 32761 H5S OL 825 78.746 103.583 50.427 1.00 0.00 H ATOM 32762 C16 OL 825 79.850 105.329 50.107 1.00 0.00 C ATOM 32763 H6R OL 825 78.924 105.858 50.342 1.00 0.00 H ATOM 32764 H6S OL 825 80.672 105.876 50.573 1.00 0.00 H ATOM 32765 C17 OL 825 79.884 105.326 48.639 1.00 0.00 C ATOM 32766 H7R OL 825 80.902 105.035 48.373 1.00 0.00 H ATOM 32767 H7S OL 825 79.194 104.539 48.328 1.00 0.00 H ATOM 32768 C18 OL 825 79.647 106.673 47.978 1.00 0.00 C ATOM 32769 H8R OL 825 78.819 107.224 48.429 1.00 0.00 H ATOM 32770 H8S OL 825 80.443 107.417 48.046 1.00 0.00 H ATOM 32771 C19 OL 825 79.402 106.585 46.538 1.00 0.00 C ATOM 32772 H9R OL 825 78.570 105.944 46.261 1.00 0.00 H ATOM 32773 C110 OL 825 79.917 107.338 45.617 1.00 0.00 C ATOM 32774 H10R OL 825 79.486 107.247 44.624 1.00 0.00 H ATOM 32775 C111 OL 825 80.984 108.343 45.745 1.00 0.00 C ATOM 32776 H11R OL 825 80.607 109.187 46.326 1.00 0.00 H ATOM 32777 H11S OL 825 81.752 107.877 46.367 1.00 0.00 H ATOM 32778 C112 OL 825 81.646 108.745 44.418 1.00 0.00 C ATOM 32779 H12R OL 825 82.090 107.911 43.870 1.00 0.00 H ATOM 32780 H12S OL 825 80.832 109.101 43.783 1.00 0.00 H ATOM 32781 C113 OL 825 82.681 109.909 44.669 1.00 0.00 C ATOM 32782 H13R OL 825 82.336 110.659 45.384 1.00 0.00 H ATOM 32783 H13S OL 825 83.591 109.488 45.101 1.00 0.00 H ATOM 32784 C114 OL 825 83.193 110.706 43.369 1.00 0.00 C ATOM 32785 H14R OL 825 83.382 109.883 42.677 1.00 0.00 H ATOM 32786 H14S OL 825 82.261 111.142 43.002 1.00 0.00 H ATOM 32787 C115 OL 825 84.331 111.677 43.620 1.00 0.00 C ATOM 32788 H15R OL 825 84.010 112.357 44.412 1.00 0.00 H ATOM 32789 H15S OL 825 85.179 111.171 44.086 1.00 0.00 H ATOM 32790 C116 OL 825 84.555 112.600 42.418 1.00 0.00 C ATOM 32791 H16R OL 825 84.694 112.013 41.508 1.00 0.00 H ATOM 32792 H16S OL 825 83.617 113.098 42.165 1.00 0.00 H ATOM 32793 C117 OL 825 85.611 113.707 42.610 1.00 0.00 C ATOM 32794 H17R OL 825 85.737 114.331 41.722 1.00 0.00 H ATOM 32795 H17S OL 825 85.415 114.378 43.449 1.00 0.00 H ATOM 32796 C118 OL 825 86.994 113.169 42.779 1.00 0.00 C ATOM 32797 H18R OL 825 87.283 112.582 41.905 1.00 0.00 H ATOM 32798 H18S OL 825 87.054 112.430 43.581 1.00 0.00 H ATOM 32799 H18T OL 825 87.689 114.005 42.877 1.00 0.00 H TER 32800 OL 825 ATOM 32800 C116 PA 826 60.687 119.883 39.412 1.00 0.00 C ATOM 32801 H16R PA 826 61.290 120.791 39.343 1.00 0.00 H ATOM 32802 H16S PA 826 59.723 120.331 39.160 1.00 0.00 H ATOM 32803 H16T PA 826 60.792 119.240 38.535 1.00 0.00 H ATOM 32804 C115 PA 826 60.764 119.113 40.674 1.00 0.00 C ATOM 32805 H15R PA 826 60.600 119.762 41.536 1.00 0.00 H ATOM 32806 H15S PA 826 61.782 118.728 40.761 1.00 0.00 H ATOM 32807 C114 PA 826 59.821 117.977 40.674 1.00 0.00 C ATOM 32808 H14R PA 826 59.849 117.442 39.723 1.00 0.00 H ATOM 32809 H14S PA 826 58.821 118.410 40.745 1.00 0.00 H ATOM 32810 C113 PA 826 60.052 117.011 41.735 1.00 0.00 C ATOM 32811 H13R PA 826 60.582 117.315 42.639 1.00 0.00 H ATOM 32812 H13S PA 826 60.701 116.234 41.326 1.00 0.00 H ATOM 32813 C112 PA 826 58.736 116.343 42.239 1.00 0.00 C ATOM 32814 H12R PA 826 58.056 116.206 41.395 1.00 0.00 H ATOM 32815 H12S PA 826 58.208 117.055 42.876 1.00 0.00 H ATOM 32816 C111 PA 826 58.860 115.008 42.857 1.00 0.00 C ATOM 32817 H11R PA 826 59.735 115.033 43.511 1.00 0.00 H ATOM 32818 H11S PA 826 59.180 114.258 42.132 1.00 0.00 H ATOM 32819 C110 PA 826 57.577 114.524 43.549 1.00 0.00 C ATOM 32820 H10R PA 826 56.766 114.756 42.856 1.00 0.00 H ATOM 32821 H10S PA 826 57.429 115.093 44.469 1.00 0.00 H ATOM 32822 C19 PA 826 57.614 113.010 43.879 1.00 0.00 C ATOM 32823 H9R PA 826 58.332 112.740 44.657 1.00 0.00 H ATOM 32824 H9S PA 826 57.990 112.496 42.992 1.00 0.00 H ATOM 32825 C18 PA 826 56.326 112.385 44.299 1.00 0.00 C ATOM 32826 H8R PA 826 56.339 111.295 44.247 1.00 0.00 H ATOM 32827 H8S PA 826 55.438 112.710 43.752 1.00 0.00 H ATOM 32828 C17 PA 826 55.923 112.838 45.671 1.00 0.00 C ATOM 32829 H7R PA 826 54.916 112.419 45.721 1.00 0.00 H ATOM 32830 H7S PA 826 55.666 113.888 45.517 1.00 0.00 H ATOM 32831 C16 PA 826 56.933 112.421 46.745 1.00 0.00 C ATOM 32832 H6R PA 826 56.155 112.422 47.511 1.00 0.00 H ATOM 32833 H6S PA 826 57.718 113.083 47.116 1.00 0.00 H ATOM 32834 C15 PA 826 57.475 110.994 46.661 1.00 0.00 C ATOM 32835 H5R PA 826 58.171 110.923 45.822 1.00 0.00 H ATOM 32836 H5S PA 826 56.679 110.291 46.407 1.00 0.00 H ATOM 32837 C14 PA 826 58.295 110.457 47.810 1.00 0.00 C ATOM 32838 H4R PA 826 58.645 109.513 47.387 1.00 0.00 H ATOM 32839 H4S PA 826 57.546 110.167 48.550 1.00 0.00 H ATOM 32840 C13 PA 826 59.474 111.252 48.311 1.00 0.00 C ATOM 32841 H3R PA 826 59.126 112.254 48.574 1.00 0.00 H ATOM 32842 H3S PA 826 60.200 111.307 47.498 1.00 0.00 H ATOM 32843 C12 PA 826 59.992 110.521 49.535 1.00 0.00 C ATOM 32844 H2R PA 826 61.050 110.789 49.576 1.00 0.00 H ATOM 32845 H2S PA 826 59.880 109.466 49.276 1.00 0.00 H ATOM 32846 C11 PGR 827 59.358 110.889 50.854 1.00 0.00 C ATOM 32847 O12 PGR 827 59.866 110.660 51.935 1.00 0.00 O ATOM 32848 O11 PGR 827 58.072 111.359 50.711 1.00 0.00 O ATOM 32849 C1 PGR 827 57.349 111.756 51.899 1.00 0.00 C ATOM 32850 HR PGR 827 57.296 110.869 52.536 1.00 0.00 H ATOM 32851 HS PGR 827 56.335 112.063 51.633 1.00 0.00 H ATOM 32852 C2 PGR 827 58.084 112.948 52.689 1.00 0.00 C ATOM 32853 HX PGR 827 59.173 112.886 52.620 1.00 0.00 H ATOM 32854 C3 PGR 827 57.578 113.117 54.092 1.00 0.00 C ATOM 32855 HA PGR 827 57.156 112.182 54.468 1.00 0.00 H ATOM 32856 HB PGR 827 56.747 113.819 53.985 1.00 0.00 H ATOM 32857 O31 PGR 827 58.558 113.711 54.993 1.00 0.00 O ATOM 32858 P31 PGR 827 58.218 114.503 56.318 1.00 0.00 P ATOM 32859 O32 PGR 827 57.227 115.638 55.758 1.00 0.00 O ATOM 32860 C31 PGR 827 57.876 116.726 55.080 1.00 0.00 C ATOM 32861 H1A PGR 827 58.550 116.327 54.318 1.00 0.00 H ATOM 32862 H1B PGR 827 58.437 117.224 55.875 1.00 0.00 H ATOM 32863 C32 PGR 827 56.765 117.522 54.382 1.00 0.00 C ATOM 32864 H2A PGR 827 57.368 118.111 53.685 1.00 0.00 H ATOM 32865 O35 PGR 827 56.125 118.293 55.313 1.00 0.00 O ATOM 32866 HO5A PGR 827 56.043 117.834 56.168 1.00 0.00 H ATOM 32867 C33 PGR 827 55.717 116.728 53.565 1.00 0.00 C ATOM 32868 H3A PGR 827 56.232 115.929 53.025 1.00 0.00 H ATOM 32869 H3B PGR 827 54.984 116.365 54.290 1.00 0.00 H ATOM 32870 O33 PGR 827 57.322 113.590 57.121 1.00 0.00 O ATOM 32871 O34 PGR 827 59.452 115.081 56.869 1.00 0.00 O ATOM 32872 O21 PGR 827 57.746 114.151 51.996 1.00 0.00 O ATOM 32873 C21 PGR 827 58.446 114.467 50.820 1.00 0.00 C ATOM 32874 O22 PGR 827 59.493 113.927 50.471 1.00 0.00 O ATOM 32875 O36 PGR 827 55.124 117.505 52.560 1.00 0.00 O ATOM 32876 HO6A PGR 827 54.883 118.359 52.962 1.00 0.00 H ATOM 32877 C12 OL 828 57.937 115.506 49.953 1.00 0.00 C ATOM 32878 H2R OL 828 57.814 116.353 50.633 1.00 0.00 H ATOM 32879 H2S OL 828 58.774 115.675 49.273 1.00 0.00 H ATOM 32880 C13 OL 828 56.622 115.124 49.233 1.00 0.00 C ATOM 32881 H3R OL 828 56.877 114.521 48.360 1.00 0.00 H ATOM 32882 H3S OL 828 56.008 114.490 49.877 1.00 0.00 H ATOM 32883 C14 OL 828 55.767 116.263 48.703 1.00 0.00 C ATOM 32884 H4R OL 828 55.466 116.961 49.487 1.00 0.00 H ATOM 32885 H4S OL 828 56.283 116.916 47.996 1.00 0.00 H ATOM 32886 C15 OL 828 54.592 115.748 47.839 1.00 0.00 C ATOM 32887 H5R OL 828 55.014 115.187 47.004 1.00 0.00 H ATOM 32888 H5S OL 828 53.878 115.206 48.462 1.00 0.00 H ATOM 32889 C16 OL 828 53.787 116.921 47.370 1.00 0.00 C ATOM 32890 H6R OL 828 53.167 117.336 48.167 1.00 0.00 H ATOM 32891 H6S OL 828 54.487 117.745 47.212 1.00 0.00 H ATOM 32892 C17 OL 828 52.744 116.773 46.230 1.00 0.00 C ATOM 32893 H7R OL 828 52.437 115.727 46.159 1.00 0.00 H ATOM 32894 H7S OL 828 51.803 117.233 46.539 1.00 0.00 H ATOM 32895 C18 OL 828 53.011 117.219 44.764 1.00 0.00 C ATOM 32896 H8R OL 828 52.044 117.277 44.260 1.00 0.00 H ATOM 32897 H8S OL 828 53.420 118.218 44.601 1.00 0.00 H ATOM 32898 C19 OL 828 53.934 116.266 44.014 1.00 0.00 C ATOM 32899 H9R OL 828 54.990 116.336 44.263 1.00 0.00 H ATOM 32900 C110 OL 828 53.557 115.336 43.150 1.00 0.00 C ATOM 32901 H10R OL 828 54.265 114.593 42.791 1.00 0.00 H ATOM 32902 C111 OL 828 52.287 115.247 42.326 1.00 0.00 C ATOM 32903 H11R OL 828 51.904 114.224 42.329 1.00 0.00 H ATOM 32904 H11S OL 828 51.603 115.975 42.766 1.00 0.00 H ATOM 32905 C112 OL 828 52.676 115.641 40.944 1.00 0.00 C ATOM 32906 H12R OL 828 53.184 116.606 40.999 1.00 0.00 H ATOM 32907 H12S OL 828 53.317 114.851 40.545 1.00 0.00 H ATOM 32908 C113 OL 828 51.490 115.891 40.009 1.00 0.00 C ATOM 32909 H13R OL 828 51.925 116.104 39.030 1.00 0.00 H ATOM 32910 H13S OL 828 50.858 115.022 39.814 1.00 0.00 H ATOM 32911 C114 OL 828 50.379 116.896 40.448 1.00 0.00 C ATOM 32912 H14R OL 828 49.559 116.899 39.727 1.00 0.00 H ATOM 32913 H14S OL 828 50.005 116.638 41.440 1.00 0.00 H ATOM 32914 C115 OL 828 50.848 118.319 40.484 1.00 0.00 C ATOM 32915 H15R OL 828 51.477 118.447 41.367 1.00 0.00 H ATOM 32916 H15S OL 828 51.499 118.398 39.611 1.00 0.00 H ATOM 32917 C116 OL 828 49.710 119.435 40.374 1.00 0.00 C ATOM 32918 H16R OL 828 49.045 119.108 39.573 1.00 0.00 H ATOM 32919 H16S OL 828 49.136 119.367 41.301 1.00 0.00 H ATOM 32920 C117 OL 828 50.233 120.889 40.097 1.00 0.00 C ATOM 32921 H17R OL 828 51.253 121.020 40.463 1.00 0.00 H ATOM 32922 H17S OL 828 50.391 121.182 39.057 1.00 0.00 H ATOM 32923 C118 OL 828 49.419 121.933 40.876 1.00 0.00 C ATOM 32924 H18R OL 828 48.390 121.585 40.766 1.00 0.00 H ATOM 32925 H18S OL 828 49.555 122.934 40.461 1.00 0.00 H ATOM 32926 H18T OL 828 49.636 122.009 41.944 1.00 0.00 H TER 32927 OL 828 ATOM 32927 C116 PA 829 84.997 35.148 40.048 1.00 0.00 C ATOM 32928 H16R PA 829 84.669 34.395 39.328 1.00 0.00 H ATOM 32929 H16S PA 829 86.069 35.282 39.895 1.00 0.00 H ATOM 32930 H16T PA 829 84.575 36.140 39.873 1.00 0.00 H ATOM 32931 C115 PA 829 84.720 34.611 41.519 1.00 0.00 C ATOM 32932 H15R PA 829 83.727 34.910 41.862 1.00 0.00 H ATOM 32933 H15S PA 829 85.340 35.293 42.105 1.00 0.00 H ATOM 32934 C114 PA 829 85.162 33.184 41.643 1.00 0.00 C ATOM 32935 H14R PA 829 86.226 33.200 41.399 1.00 0.00 H ATOM 32936 H14S PA 829 84.700 32.655 40.807 1.00 0.00 H ATOM 32937 C113 PA 829 85.005 32.542 42.986 1.00 0.00 C ATOM 32938 H13R PA 829 84.813 33.286 43.763 1.00 0.00 H ATOM 32939 H13S PA 829 85.990 32.091 43.123 1.00 0.00 H ATOM 32940 C112 PA 829 83.817 31.533 43.009 1.00 0.00 C ATOM 32941 H12R PA 829 83.943 30.809 42.201 1.00 0.00 H ATOM 32942 H12S PA 829 82.893 32.059 42.763 1.00 0.00 H ATOM 32943 C111 PA 829 83.550 30.791 44.277 1.00 0.00 C ATOM 32944 H11R PA 829 84.561 30.452 44.515 1.00 0.00 H ATOM 32945 H11S PA 829 82.859 29.950 44.196 1.00 0.00 H ATOM 32946 C110 PA 829 82.975 31.655 45.402 1.00 0.00 C ATOM 32947 H10R PA 829 81.969 31.981 45.130 1.00 0.00 H ATOM 32948 H10S PA 829 83.468 32.629 45.438 1.00 0.00 H ATOM 32949 C19 PA 829 82.859 30.954 46.740 1.00 0.00 C ATOM 32950 H9R PA 829 83.861 30.736 47.115 1.00 0.00 H ATOM 32951 H9S PA 829 82.409 29.959 46.769 1.00 0.00 H ATOM 32952 C18 PA 829 82.278 31.788 47.941 1.00 0.00 C ATOM 32953 H8R PA 829 82.437 31.163 48.822 1.00 0.00 H ATOM 32954 H8S PA 829 81.221 32.048 47.855 1.00 0.00 H ATOM 32955 C17 PA 829 82.996 33.166 48.032 1.00 0.00 C ATOM 32956 H7R PA 829 82.769 33.656 47.083 1.00 0.00 H ATOM 32957 H7S PA 829 84.066 32.994 47.897 1.00 0.00 H ATOM 32958 C16 PA 829 82.768 34.008 49.287 1.00 0.00 C ATOM 32959 H6R PA 829 83.401 34.895 49.371 1.00 0.00 H ATOM 32960 H6S PA 829 83.062 33.259 50.024 1.00 0.00 H ATOM 32961 C15 PA 829 81.325 34.434 49.475 1.00 0.00 C ATOM 32962 H5R PA 829 80.685 33.594 49.752 1.00 0.00 H ATOM 32963 H5S PA 829 81.143 34.936 48.523 1.00 0.00 H ATOM 32964 C14 PA 829 81.163 35.464 50.562 1.00 0.00 C ATOM 32965 H4R PA 829 80.622 36.345 50.211 1.00 0.00 H ATOM 32966 H4S PA 829 82.121 35.975 50.673 1.00 0.00 H ATOM 32967 C13 PA 829 80.464 35.131 51.934 1.00 0.00 C ATOM 32968 H3R PA 829 79.553 34.594 51.660 1.00 0.00 H ATOM 32969 H3S PA 829 80.170 36.004 52.519 1.00 0.00 H ATOM 32970 C12 PA 829 81.183 34.101 52.843 1.00 0.00 C ATOM 32971 H2R PA 829 82.146 34.492 53.177 1.00 0.00 H ATOM 32972 H2S PA 829 81.306 33.232 52.193 1.00 0.00 H ATOM 32973 C11 PGR 830 80.263 33.733 54.001 1.00 0.00 C ATOM 32974 O12 PGR 830 80.600 33.830 55.185 1.00 0.00 O ATOM 32975 O11 PGR 830 79.193 33.064 53.563 1.00 0.00 O ATOM 32976 C1 PGR 830 78.082 32.734 54.488 1.00 0.00 C ATOM 32977 HR PGR 830 78.470 32.176 55.345 1.00 0.00 H ATOM 32978 HS PGR 830 77.399 32.119 53.896 1.00 0.00 H ATOM 32979 C2 PGR 830 77.434 34.028 54.986 1.00 0.00 C ATOM 32980 HX PGR 830 78.156 34.659 55.510 1.00 0.00 H ATOM 32981 C3 PGR 830 76.220 33.607 55.900 1.00 0.00 C ATOM 32982 HA PGR 830 76.521 32.903 56.680 1.00 0.00 H ATOM 32983 HB PGR 830 75.372 33.178 55.361 1.00 0.00 H ATOM 32984 O31 PGR 830 75.791 34.782 56.589 1.00 0.00 O ATOM 32985 P31 PGR 830 74.872 34.781 57.911 1.00 0.00 P ATOM 32986 O32 PGR 830 73.400 34.502 57.318 1.00 0.00 O ATOM 32987 C31 PGR 830 72.715 33.247 57.439 1.00 0.00 C ATOM 32988 H1A PGR 830 72.653 32.940 58.486 1.00 0.00 H ATOM 32989 H1B PGR 830 73.333 32.490 56.949 1.00 0.00 H ATOM 32990 C32 PGR 830 71.301 33.174 56.818 1.00 0.00 C ATOM 32991 H2A PGR 830 71.021 32.128 56.665 1.00 0.00 H ATOM 32992 O35 PGR 830 71.308 33.792 55.577 1.00 0.00 O ATOM 32993 HO5A PGR 830 70.416 33.829 55.187 1.00 0.00 H ATOM 32994 C33 PGR 830 70.259 33.787 57.816 1.00 0.00 C ATOM 32995 H3A PGR 830 69.388 33.909 57.168 1.00 0.00 H ATOM 32996 H3B PGR 830 70.019 33.000 58.536 1.00 0.00 H ATOM 32997 O33 PGR 830 75.304 33.647 58.807 1.00 0.00 O ATOM 32998 O34 PGR 830 74.852 36.158 58.406 1.00 0.00 O ATOM 32999 O21 PGR 830 76.914 34.716 53.839 1.00 0.00 O ATOM 33000 C21 PGR 830 76.965 36.083 53.740 1.00 0.00 C ATOM 33001 O22 PGR 830 77.535 36.839 54.464 1.00 0.00 O ATOM 33002 O36 PGR 830 70.607 35.056 58.371 1.00 0.00 O ATOM 33003 HO6A PGR 830 70.848 34.860 59.295 1.00 0.00 H ATOM 33004 C12 OL 831 76.264 36.485 52.503 1.00 0.00 C ATOM 33005 H2R OL 831 75.857 35.588 52.031 1.00 0.00 H ATOM 33006 H2S OL 831 75.391 37.120 52.667 1.00 0.00 H ATOM 33007 C13 OL 831 77.201 37.108 51.491 1.00 0.00 C ATOM 33008 H3R OL 831 77.120 38.195 51.569 1.00 0.00 H ATOM 33009 H3S OL 831 78.255 36.870 51.647 1.00 0.00 H ATOM 33010 C14 OL 831 76.908 36.620 50.040 1.00 0.00 C ATOM 33011 H4R OL 831 77.122 35.551 49.967 1.00 0.00 H ATOM 33012 H4S OL 831 75.832 36.787 49.964 1.00 0.00 H ATOM 33013 C15 OL 831 77.550 37.297 48.839 1.00 0.00 C ATOM 33014 H5R OL 831 77.489 38.373 49.013 1.00 0.00 H ATOM 33015 H5S OL 831 78.622 37.116 48.741 1.00 0.00 H ATOM 33016 C16 OL 831 76.894 36.951 47.534 1.00 0.00 C ATOM 33017 H6R OL 831 76.825 35.871 47.387 1.00 0.00 H ATOM 33018 H6S OL 831 75.888 37.373 47.591 1.00 0.00 H ATOM 33019 C17 OL 831 77.572 37.458 46.299 1.00 0.00 C ATOM 33020 H7R OL 831 76.912 37.164 45.480 1.00 0.00 H ATOM 33021 H7S OL 831 77.451 38.543 46.282 1.00 0.00 H ATOM 33022 C18 OL 831 78.996 37.102 46.026 1.00 0.00 C ATOM 33023 H8R OL 831 79.338 37.519 45.077 1.00 0.00 H ATOM 33024 H8S OL 831 79.547 37.468 46.895 1.00 0.00 H ATOM 33025 C19 OL 831 79.209 35.633 45.885 1.00 0.00 C ATOM 33026 H9R OL 831 79.511 35.101 46.783 1.00 0.00 H ATOM 33027 C110 OL 831 79.086 34.972 44.752 1.00 0.00 C ATOM 33028 H10R OL 831 79.258 33.906 44.878 1.00 0.00 H ATOM 33029 C111 OL 831 78.688 35.423 43.371 1.00 0.00 C ATOM 33030 H11R OL 831 77.991 34.684 42.970 1.00 0.00 H ATOM 33031 H11S OL 831 78.151 36.373 43.426 1.00 0.00 H ATOM 33032 C112 OL 831 79.902 35.484 42.539 1.00 0.00 C ATOM 33033 H12R OL 831 80.462 34.569 42.742 1.00 0.00 H ATOM 33034 H12S OL 831 79.543 35.265 41.531 1.00 0.00 H ATOM 33035 C113 OL 831 80.800 36.731 42.794 1.00 0.00 C ATOM 33036 H13R OL 831 81.214 36.993 41.818 1.00 0.00 H ATOM 33037 H13S OL 831 80.122 37.552 43.036 1.00 0.00 H ATOM 33038 C114 OL 831 81.969 36.472 43.748 1.00 0.00 C ATOM 33039 H14R OL 831 81.591 36.372 44.767 1.00 0.00 H ATOM 33040 H14S OL 831 82.543 35.587 43.466 1.00 0.00 H ATOM 33041 C115 OL 831 82.937 37.734 43.722 1.00 0.00 C ATOM 33042 H15R OL 831 83.050 38.056 42.684 1.00 0.00 H ATOM 33043 H15S OL 831 82.573 38.587 44.298 1.00 0.00 H ATOM 33044 C116 OL 831 84.354 37.542 44.147 1.00 0.00 C ATOM 33045 H16R OL 831 84.772 36.678 43.627 1.00 0.00 H ATOM 33046 H16S OL 831 84.852 38.468 43.852 1.00 0.00 H ATOM 33047 C117 OL 831 84.481 37.249 45.582 1.00 0.00 C ATOM 33048 H17R OL 831 83.562 37.457 46.134 1.00 0.00 H ATOM 33049 H17S OL 831 84.429 36.159 45.636 1.00 0.00 H ATOM 33050 C118 OL 831 85.659 37.983 46.166 1.00 0.00 C ATOM 33051 H18R OL 831 86.582 37.423 46.003 1.00 0.00 H ATOM 33052 H18S OL 831 85.584 38.076 47.251 1.00 0.00 H ATOM 33053 H18T OL 831 85.877 38.979 45.775 1.00 0.00 H TER 33054 OL 831 ATOM 33054 C116 PA 832 113.987 87.521 39.791 1.00 0.00 C ATOM 33055 H16R PA 832 113.291 88.006 39.103 1.00 0.00 H ATOM 33056 H16S PA 832 113.866 86.441 39.679 1.00 0.00 H ATOM 33057 H16T PA 832 114.971 87.780 39.394 1.00 0.00 H ATOM 33058 C115 PA 832 113.949 88.085 41.221 1.00 0.00 C ATOM 33059 H15R PA 832 114.632 87.535 41.872 1.00 0.00 H ATOM 33060 H15S PA 832 112.977 87.828 41.646 1.00 0.00 H ATOM 33061 C114 PA 832 114.114 89.580 41.027 1.00 0.00 C ATOM 33062 H14R PA 832 113.279 89.959 40.434 1.00 0.00 H ATOM 33063 H14S PA 832 115.003 89.910 40.486 1.00 0.00 H ATOM 33064 C113 PA 832 114.091 90.258 42.417 1.00 0.00 C ATOM 33065 H13R PA 832 114.827 89.708 43.008 1.00 0.00 H ATOM 33066 H13S PA 832 113.120 90.104 42.892 1.00 0.00 H ATOM 33067 C112 PA 832 114.467 91.772 42.447 1.00 0.00 C ATOM 33068 H12R PA 832 113.680 92.410 42.040 1.00 0.00 H ATOM 33069 H12S PA 832 115.278 92.069 41.779 1.00 0.00 H ATOM 33070 C111 PA 832 114.664 92.279 43.934 1.00 0.00 C ATOM 33071 H11R PA 832 114.871 93.346 43.827 1.00 0.00 H ATOM 33072 H11S PA 832 115.625 91.838 44.205 1.00 0.00 H ATOM 33073 C110 PA 832 113.596 91.997 44.941 1.00 0.00 C ATOM 33074 H10R PA 832 113.266 90.957 44.897 1.00 0.00 H ATOM 33075 H10S PA 832 112.650 92.524 44.800 1.00 0.00 H ATOM 33076 C19 PA 832 114.107 92.292 46.345 1.00 0.00 C ATOM 33077 H9R PA 832 113.285 92.205 47.058 1.00 0.00 H ATOM 33078 H9S PA 832 114.369 93.349 46.434 1.00 0.00 H ATOM 33079 C18 PA 832 115.365 91.557 46.796 1.00 0.00 C ATOM 33080 H8R PA 832 116.189 91.623 46.083 1.00 0.00 H ATOM 33081 H8S PA 832 115.249 90.473 46.869 1.00 0.00 H ATOM 33082 C17 PA 832 115.882 91.974 48.172 1.00 0.00 C ATOM 33083 H7R PA 832 116.199 93.002 47.986 1.00 0.00 H ATOM 33084 H7S PA 832 116.760 91.364 48.394 1.00 0.00 H ATOM 33085 C16 PA 832 114.911 91.881 49.315 1.00 0.00 C ATOM 33086 H6R PA 832 114.429 90.907 49.416 1.00 0.00 H ATOM 33087 H6S PA 832 114.101 92.543 49.001 1.00 0.00 H ATOM 33088 C15 PA 832 115.521 92.075 50.677 1.00 0.00 C ATOM 33089 H5R PA 832 116.377 91.406 50.793 1.00 0.00 H ATOM 33090 H5S PA 832 114.860 91.705 51.464 1.00 0.00 H ATOM 33091 C14 PA 832 116.042 93.532 51.018 1.00 0.00 C ATOM 33092 H4R PA 832 115.314 94.312 50.785 1.00 0.00 H ATOM 33093 H4S PA 832 116.887 93.666 50.339 1.00 0.00 H ATOM 33094 C13 PA 832 116.459 93.541 52.474 1.00 0.00 C ATOM 33095 H3R PA 832 117.098 92.675 52.659 1.00 0.00 H ATOM 33096 H3S PA 832 115.596 93.230 53.067 1.00 0.00 H ATOM 33097 C12 PA 832 117.061 94.783 53.095 1.00 0.00 C ATOM 33098 H2R PA 832 116.269 95.530 53.175 1.00 0.00 H ATOM 33099 H2S PA 832 117.959 95.188 52.623 1.00 0.00 H ATOM 33100 C11 PGR 833 117.428 94.540 54.512 1.00 0.00 C ATOM 33101 O12 PGR 833 116.841 93.754 55.277 1.00 0.00 O ATOM 33102 O11 PGR 833 118.423 95.291 54.924 1.00 0.00 O ATOM 33103 C1 PGR 833 119.016 95.202 56.244 1.00 0.00 C ATOM 33104 HR PGR 833 118.264 95.028 57.018 1.00 0.00 H ATOM 33105 HS PGR 833 119.594 96.104 56.459 1.00 0.00 H ATOM 33106 C2 PGR 833 119.866 94.000 56.373 1.00 0.00 C ATOM 33107 HX PGR 833 119.214 93.139 56.203 1.00 0.00 H ATOM 33108 C3 PGR 833 120.422 93.868 57.745 1.00 0.00 C ATOM 33109 HA PGR 833 120.938 92.906 57.815 1.00 0.00 H ATOM 33110 HB PGR 833 119.631 93.852 58.498 1.00 0.00 H ATOM 33111 O31 PGR 833 121.223 94.971 58.057 1.00 0.00 O ATOM 33112 P31 PGR 833 121.917 95.225 59.423 1.00 0.00 P ATOM 33113 O32 PGR 833 122.859 93.990 59.583 1.00 0.00 O ATOM 33114 C31 PGR 833 123.284 93.393 60.775 1.00 0.00 C ATOM 33115 H1A PGR 833 122.403 93.246 61.406 1.00 0.00 H ATOM 33116 H1B PGR 833 123.630 92.411 60.440 1.00 0.00 H ATOM 33117 C32 PGR 833 124.307 94.271 61.534 1.00 0.00 C ATOM 33118 H2A PGR 833 124.016 95.319 61.423 1.00 0.00 H ATOM 33119 O35 PGR 833 125.695 94.051 61.090 1.00 0.00 O ATOM 33120 HO5A PGR 833 125.766 94.420 60.191 1.00 0.00 H ATOM 33121 C33 PGR 833 124.242 94.001 63.016 1.00 0.00 C ATOM 33122 H3A PGR 833 123.189 94.050 63.303 1.00 0.00 H ATOM 33123 H3B PGR 833 124.520 92.944 63.059 1.00 0.00 H ATOM 33124 O33 PGR 833 122.611 96.526 59.298 1.00 0.00 O ATOM 33125 O34 PGR 833 120.863 95.109 60.459 1.00 0.00 O ATOM 33126 O21 PGR 833 120.984 93.951 55.447 1.00 0.00 O ATOM 33127 C21 PGR 833 121.793 94.988 55.107 1.00 0.00 C ATOM 33128 O22 PGR 833 121.772 96.146 55.528 1.00 0.00 O ATOM 33129 O36 PGR 833 125.122 94.896 63.661 1.00 0.00 O ATOM 33130 HO6A PGR 833 124.781 94.843 64.572 1.00 0.00 H ATOM 33131 C12 OL 834 122.675 94.625 53.923 1.00 0.00 C ATOM 33132 H2R OL 834 123.673 95.025 54.114 1.00 0.00 H ATOM 33133 H2S OL 834 122.918 93.576 54.107 1.00 0.00 H ATOM 33134 C13 OL 834 122.110 95.027 52.476 1.00 0.00 C ATOM 33135 H3R OL 834 122.054 96.118 52.454 1.00 0.00 H ATOM 33136 H3S OL 834 122.643 94.733 51.569 1.00 0.00 H ATOM 33137 C14 OL 834 120.644 94.581 52.327 1.00 0.00 C ATOM 33138 H4R OL 834 120.326 93.739 52.945 1.00 0.00 H ATOM 33139 H4S OL 834 119.979 95.355 52.715 1.00 0.00 H ATOM 33140 C15 OL 834 120.319 94.181 50.900 1.00 0.00 C ATOM 33141 H5R OL 834 120.816 93.224 50.729 1.00 0.00 H ATOM 33142 H5S OL 834 119.232 94.112 50.985 1.00 0.00 H ATOM 33143 C16 OL 834 120.741 95.094 49.746 1.00 0.00 C ATOM 33144 H6R OL 834 120.344 96.092 49.946 1.00 0.00 H ATOM 33145 H6S OL 834 121.830 95.163 49.784 1.00 0.00 H ATOM 33146 C17 OL 834 120.186 94.710 48.417 1.00 0.00 C ATOM 33147 H7R OL 834 119.099 94.755 48.508 1.00 0.00 H ATOM 33148 H7S OL 834 120.429 95.547 47.759 1.00 0.00 H ATOM 33149 C18 OL 834 120.807 93.358 47.979 1.00 0.00 C ATOM 33150 H8R OL 834 121.884 93.288 48.143 1.00 0.00 H ATOM 33151 H8S OL 834 120.338 92.602 48.612 1.00 0.00 H ATOM 33152 C19 OL 834 120.400 93.151 46.534 1.00 0.00 C ATOM 33153 H9R OL 834 119.326 93.108 46.370 1.00 0.00 H ATOM 33154 C110 OL 834 121.202 93.176 45.481 1.00 0.00 C ATOM 33155 H10R OL 834 120.792 93.053 44.483 1.00 0.00 H ATOM 33156 C111 OL 834 122.718 93.234 45.419 1.00 0.00 C ATOM 33157 H11R OL 834 123.078 93.843 44.587 1.00 0.00 H ATOM 33158 H11S OL 834 123.104 93.727 46.313 1.00 0.00 H ATOM 33159 C112 OL 834 123.499 91.912 45.257 1.00 0.00 C ATOM 33160 H12R OL 834 124.544 92.230 45.248 1.00 0.00 H ATOM 33161 H12S OL 834 123.289 91.283 46.125 1.00 0.00 H ATOM 33162 C113 OL 834 123.117 91.194 43.914 1.00 0.00 C ATOM 33163 H13R OL 834 122.035 91.305 43.814 1.00 0.00 H ATOM 33164 H13S OL 834 123.545 91.861 43.162 1.00 0.00 H ATOM 33165 C114 OL 834 123.543 89.803 43.612 1.00 0.00 C ATOM 33166 H14R OL 834 124.599 89.740 43.885 1.00 0.00 H ATOM 33167 H14S OL 834 123.055 89.131 44.321 1.00 0.00 H ATOM 33168 C115 OL 834 123.236 89.181 42.249 1.00 0.00 C ATOM 33169 H15R OL 834 123.635 88.166 42.297 1.00 0.00 H ATOM 33170 H15S OL 834 122.162 89.034 42.113 1.00 0.00 H ATOM 33171 C116 OL 834 123.784 89.900 41.070 1.00 0.00 C ATOM 33172 H16R OL 834 123.602 90.977 41.061 1.00 0.00 H ATOM 33173 H16S OL 834 124.864 89.738 41.088 1.00 0.00 H ATOM 33174 C117 OL 834 123.430 89.332 39.737 1.00 0.00 C ATOM 33175 H17R OL 834 123.774 88.296 39.739 1.00 0.00 H ATOM 33176 H17S OL 834 122.339 89.288 39.736 1.00 0.00 H ATOM 33177 C118 OL 834 123.898 90.188 38.636 1.00 0.00 C ATOM 33178 H18R OL 834 123.524 89.848 37.668 1.00 0.00 H ATOM 33179 H18S OL 834 124.974 90.373 38.670 1.00 0.00 H ATOM 33180 H18T OL 834 123.380 91.143 38.751 1.00 0.00 H TER 33181 OL 834 ATOM 33181 C116 PA 835 5.544 108.800 46.138 1.00 0.00 C ATOM 33182 H16R PA 835 4.851 108.202 45.542 1.00 0.00 H ATOM 33183 H16S PA 835 4.892 109.172 46.930 1.00 0.00 H ATOM 33184 H16T PA 835 6.326 108.206 46.616 1.00 0.00 H ATOM 33185 C115 PA 835 6.086 109.978 45.349 1.00 0.00 C ATOM 33186 H15R PA 835 5.297 110.420 44.736 1.00 0.00 H ATOM 33187 H15S PA 835 6.692 109.533 44.557 1.00 0.00 H ATOM 33188 C114 PA 835 7.084 110.940 46.094 1.00 0.00 C ATOM 33189 H14R PA 835 8.040 110.412 46.097 1.00 0.00 H ATOM 33190 H14S PA 835 6.955 111.015 47.176 1.00 0.00 H ATOM 33191 C113 PA 835 7.404 112.243 45.342 1.00 0.00 C ATOM 33192 H13R PA 835 7.595 112.046 44.285 1.00 0.00 H ATOM 33193 H13S PA 835 8.346 112.618 45.746 1.00 0.00 H ATOM 33194 C112 PA 835 6.167 113.169 45.429 1.00 0.00 C ATOM 33195 H12R PA 835 6.012 113.275 46.505 1.00 0.00 H ATOM 33196 H12S PA 835 5.307 112.629 45.028 1.00 0.00 H ATOM 33197 C111 PA 835 6.189 114.578 44.891 1.00 0.00 C ATOM 33198 H11R PA 835 5.178 114.969 45.029 1.00 0.00 H ATOM 33199 H11S PA 835 6.223 114.510 43.801 1.00 0.00 H ATOM 33200 C110 PA 835 7.327 115.539 45.296 1.00 0.00 C ATOM 33201 H10R PA 835 7.351 116.465 44.717 1.00 0.00 H ATOM 33202 H10S PA 835 8.286 115.101 45.011 1.00 0.00 H ATOM 33203 C19 PA 835 7.258 115.959 46.746 1.00 0.00 C ATOM 33204 H9R PA 835 7.358 115.068 47.371 1.00 0.00 H ATOM 33205 H9S PA 835 6.266 116.406 46.840 1.00 0.00 H ATOM 33206 C18 PA 835 8.184 117.118 47.102 1.00 0.00 C ATOM 33207 H8R PA 835 7.929 118.017 46.536 1.00 0.00 H ATOM 33208 H8S PA 835 9.221 116.837 46.910 1.00 0.00 H ATOM 33209 C17 PA 835 8.188 117.571 48.551 1.00 0.00 C ATOM 33210 H7R PA 835 8.893 118.369 48.791 1.00 0.00 H ATOM 33211 H7S PA 835 8.492 116.804 49.266 1.00 0.00 H ATOM 33212 C16 PA 835 6.837 118.089 49.079 1.00 0.00 C ATOM 33213 H6R PA 835 6.100 117.283 49.084 1.00 0.00 H ATOM 33214 H6S PA 835 6.488 118.898 48.434 1.00 0.00 H ATOM 33215 C15 PA 835 6.845 118.544 50.544 1.00 0.00 C ATOM 33216 H5R PA 835 6.803 117.698 51.233 1.00 0.00 H ATOM 33217 H5S PA 835 5.888 119.065 50.613 1.00 0.00 H ATOM 33218 C14 PA 835 7.904 119.548 50.993 1.00 0.00 C ATOM 33219 H4R PA 835 8.352 120.213 50.251 1.00 0.00 H ATOM 33220 H4S PA 835 8.662 118.817 51.284 1.00 0.00 H ATOM 33221 C13 PA 835 7.432 120.237 52.251 1.00 0.00 C ATOM 33222 H3R PA 835 6.958 119.479 52.879 1.00 0.00 H ATOM 33223 H3S PA 835 6.646 120.945 51.982 1.00 0.00 H ATOM 33224 C12 PA 835 8.541 120.857 53.129 1.00 0.00 C ATOM 33225 H2R PA 835 9.020 121.700 52.626 1.00 0.00 H ATOM 33226 H2S PA 835 9.296 120.098 53.345 1.00 0.00 H ATOM 33227 C11 PGR 836 7.995 121.422 54.429 1.00 0.00 C ATOM 33228 O12 PGR 836 7.729 120.686 55.342 1.00 0.00 O ATOM 33229 O11 PGR 836 7.980 122.763 54.506 1.00 0.00 O ATOM 33230 C1 PGR 836 7.572 123.416 55.758 1.00 0.00 C ATOM 33231 HR PGR 836 6.781 122.850 56.255 1.00 0.00 H ATOM 33232 HS PGR 836 7.101 124.351 55.445 1.00 0.00 H ATOM 33233 C2 PGR 836 8.646 123.642 56.722 1.00 0.00 C ATOM 33234 HX PGR 836 8.845 122.674 57.189 1.00 0.00 H ATOM 33235 C3 PGR 836 8.259 124.661 57.841 1.00 0.00 C ATOM 33236 HA PGR 836 7.754 125.531 57.415 1.00 0.00 H ATOM 33237 HB PGR 836 9.204 124.922 58.324 1.00 0.00 H ATOM 33238 O31 PGR 836 7.359 123.957 58.690 1.00 0.00 O ATOM 33239 P31 PGR 836 7.132 124.437 60.207 1.00 0.00 P ATOM 33240 O32 PGR 836 8.431 123.824 61.000 1.00 0.00 O ATOM 33241 C31 PGR 836 9.577 124.632 61.325 1.00 0.00 C ATOM 33242 H1A PGR 836 9.699 125.304 60.473 1.00 0.00 H ATOM 33243 H1B PGR 836 10.464 123.997 61.399 1.00 0.00 H ATOM 33244 C32 PGR 836 9.327 125.266 62.708 1.00 0.00 C ATOM 33245 H2A PGR 836 8.804 124.542 63.339 1.00 0.00 H ATOM 33246 O35 PGR 836 8.450 126.442 62.575 1.00 0.00 O ATOM 33247 HO5A PGR 836 7.922 126.301 61.769 1.00 0.00 H ATOM 33248 C33 PGR 836 10.564 125.668 63.541 1.00 0.00 C ATOM 33249 H3A PGR 836 10.261 126.219 64.435 1.00 0.00 H ATOM 33250 H3B PGR 836 11.077 124.764 63.879 1.00 0.00 H ATOM 33251 O33 PGR 836 7.078 125.908 60.162 1.00 0.00 O ATOM 33252 O34 PGR 836 5.894 123.664 60.619 1.00 0.00 O ATOM 33253 O21 PGR 836 9.860 124.226 56.104 1.00 0.00 O ATOM 33254 C21 PGR 836 10.713 123.465 55.327 1.00 0.00 C ATOM 33255 O22 PGR 836 10.710 122.260 55.316 1.00 0.00 O ATOM 33256 O36 PGR 836 11.493 126.508 62.842 1.00 0.00 O ATOM 33257 HO6A PGR 836 10.943 127.306 62.747 1.00 0.00 H ATOM 33258 C12 OL 837 11.800 124.273 54.656 1.00 0.00 C ATOM 33259 H2R OL 837 12.237 124.989 55.356 1.00 0.00 H ATOM 33260 H2S OL 837 12.595 123.588 54.351 1.00 0.00 H ATOM 33261 C13 OL 837 11.300 125.137 53.401 1.00 0.00 C ATOM 33262 H3R OL 837 10.750 124.464 52.740 1.00 0.00 H ATOM 33263 H3S OL 837 10.634 125.945 53.709 1.00 0.00 H ATOM 33264 C14 OL 837 12.421 125.821 52.656 1.00 0.00 C ATOM 33265 H4R OL 837 12.903 126.540 53.322 1.00 0.00 H ATOM 33266 H4S OL 837 13.237 125.124 52.455 1.00 0.00 H ATOM 33267 C15 OL 837 11.974 126.545 51.319 1.00 0.00 C ATOM 33268 H5R OL 837 10.891 126.665 51.255 1.00 0.00 H ATOM 33269 H5S OL 837 12.516 127.490 51.247 1.00 0.00 H ATOM 33270 C16 OL 837 12.213 125.619 50.075 1.00 0.00 C ATOM 33271 H6R OL 837 13.254 125.289 50.040 1.00 0.00 H ATOM 33272 H6S OL 837 11.672 124.671 50.051 1.00 0.00 H ATOM 33273 C17 OL 837 11.957 126.273 48.663 1.00 0.00 C ATOM 33274 H7R OL 837 10.970 126.739 48.641 1.00 0.00 H ATOM 33275 H7S OL 837 12.676 127.091 48.599 1.00 0.00 H ATOM 33276 C18 OL 837 11.999 125.331 47.552 1.00 0.00 C ATOM 33277 H8R OL 837 12.998 124.896 47.480 1.00 0.00 H ATOM 33278 H8S OL 837 11.289 124.503 47.619 1.00 0.00 H ATOM 33279 C19 OL 837 11.840 126.077 46.216 1.00 0.00 C ATOM 33280 H9R OL 837 12.759 126.469 45.787 1.00 0.00 H ATOM 33281 C110 OL 837 10.734 126.327 45.617 1.00 0.00 C ATOM 33282 H10R OL 837 10.739 126.863 44.672 1.00 0.00 H ATOM 33283 C111 OL 837 9.345 125.983 46.028 1.00 0.00 C ATOM 33284 H11R OL 837 9.185 125.927 47.107 1.00 0.00 H ATOM 33285 H11S OL 837 8.853 126.897 45.686 1.00 0.00 H ATOM 33286 C112 OL 837 8.871 124.673 45.305 1.00 0.00 C ATOM 33287 H12R OL 837 9.481 123.769 45.371 1.00 0.00 H ATOM 33288 H12S OL 837 7.842 124.466 45.608 1.00 0.00 H ATOM 33289 C113 OL 837 8.990 124.977 43.739 1.00 0.00 C ATOM 33290 H13R OL 837 8.514 125.898 43.397 1.00 0.00 H ATOM 33291 H13S OL 837 10.039 125.164 43.497 1.00 0.00 H ATOM 33292 C114 OL 837 8.530 123.856 42.810 1.00 0.00 C ATOM 33293 H14R OL 837 8.889 122.855 43.059 1.00 0.00 H ATOM 33294 H14S OL 837 7.451 123.701 42.874 1.00 0.00 H ATOM 33295 C115 OL 837 8.897 124.164 41.386 1.00 0.00 C ATOM 33296 H15R OL 837 8.586 125.178 41.125 1.00 0.00 H ATOM 33297 H15S OL 837 9.981 124.081 41.279 1.00 0.00 H ATOM 33298 C116 OL 837 8.243 123.269 40.228 1.00 0.00 C ATOM 33299 H16R OL 837 8.580 122.260 40.474 1.00 0.00 H ATOM 33300 H16S OL 837 7.164 123.295 40.398 1.00 0.00 H ATOM 33301 C117 OL 837 8.608 123.684 38.776 1.00 0.00 C ATOM 33302 H17R OL 837 9.692 123.812 38.744 1.00 0.00 H ATOM 33303 H17S OL 837 8.312 122.969 38.006 1.00 0.00 H ATOM 33304 C118 OL 837 7.949 124.942 38.398 1.00 0.00 C ATOM 33305 H18R OL 837 8.435 125.339 37.504 1.00 0.00 H ATOM 33306 H18S OL 837 8.188 125.706 39.141 1.00 0.00 H ATOM 33307 H18T OL 837 6.882 124.839 38.188 1.00 0.00 H TER 33308 OL 837 ATOM 33308 C116 PA 838 3.848 37.509 41.620 1.00 0.00 C ATOM 33309 H16R PA 838 4.475 37.281 40.756 1.00 0.00 H ATOM 33310 H16S PA 838 4.266 37.691 42.612 1.00 0.00 H ATOM 33311 H16T PA 838 3.305 38.424 41.376 1.00 0.00 H ATOM 33312 C115 PA 838 2.873 36.370 41.844 1.00 0.00 C ATOM 33313 H15R PA 838 2.316 36.389 40.905 1.00 0.00 H ATOM 33314 H15S PA 838 2.241 36.580 42.710 1.00 0.00 H ATOM 33315 C114 PA 838 3.534 35.022 41.936 1.00 0.00 C ATOM 33316 H14R PA 838 3.980 34.734 40.982 1.00 0.00 H ATOM 33317 H14S PA 838 2.748 34.281 42.096 1.00 0.00 H ATOM 33318 C113 PA 838 4.551 34.913 43.026 1.00 0.00 C ATOM 33319 H13R PA 838 4.174 35.215 44.005 1.00 0.00 H ATOM 33320 H13S PA 838 5.419 35.566 42.910 1.00 0.00 H ATOM 33321 C112 PA 838 5.231 33.508 42.909 1.00 0.00 C ATOM 33322 H12R PA 838 5.669 33.524 41.909 1.00 0.00 H ATOM 33323 H12S PA 838 4.547 32.669 42.762 1.00 0.00 H ATOM 33324 C111 PA 838 6.268 33.160 43.987 1.00 0.00 C ATOM 33325 H11R PA 838 7.046 33.904 43.803 1.00 0.00 H ATOM 33326 H11S PA 838 6.670 32.204 43.645 1.00 0.00 H ATOM 33327 C110 PA 838 5.917 33.038 45.492 1.00 0.00 C ATOM 33328 H10R PA 838 5.319 33.938 45.648 1.00 0.00 H ATOM 33329 H10S PA 838 6.837 33.007 46.081 1.00 0.00 H ATOM 33330 C19 PA 838 5.156 31.813 45.796 1.00 0.00 C ATOM 33331 H9R PA 838 5.594 30.955 45.283 1.00 0.00 H ATOM 33332 H9S PA 838 4.149 31.936 45.394 1.00 0.00 H ATOM 33333 C18 PA 838 4.986 31.490 47.220 1.00 0.00 C ATOM 33334 H8R PA 838 4.827 32.369 47.848 1.00 0.00 H ATOM 33335 H8S PA 838 6.012 31.312 47.551 1.00 0.00 H ATOM 33336 C17 PA 838 4.072 30.375 47.541 1.00 0.00 C ATOM 33337 H7R PA 838 4.055 29.532 46.847 1.00 0.00 H ATOM 33338 H7S PA 838 3.030 30.700 47.547 1.00 0.00 H ATOM 33339 C16 PA 838 4.164 29.845 48.973 1.00 0.00 C ATOM 33340 H6R PA 838 5.071 29.249 49.097 1.00 0.00 H ATOM 33341 H6S PA 838 3.321 29.168 49.127 1.00 0.00 H ATOM 33342 C15 PA 838 4.180 30.925 50.059 1.00 0.00 C ATOM 33343 H5R PA 838 5.045 31.568 49.883 1.00 0.00 H ATOM 33344 H5S PA 838 4.637 30.409 50.906 1.00 0.00 H ATOM 33345 C14 PA 838 2.806 31.574 50.385 1.00 0.00 C ATOM 33346 H4R PA 838 2.144 30.787 50.752 1.00 0.00 H ATOM 33347 H4S PA 838 2.361 32.096 49.535 1.00 0.00 H ATOM 33348 C13 PA 838 2.910 32.618 51.379 1.00 0.00 C ATOM 33349 H3R PA 838 1.871 32.875 51.595 1.00 0.00 H ATOM 33350 H3S PA 838 3.250 33.572 50.969 1.00 0.00 H ATOM 33351 C12 PA 838 3.698 32.211 52.702 1.00 0.00 C ATOM 33352 H2R PA 838 4.758 32.194 52.438 1.00 0.00 H ATOM 33353 H2S PA 838 3.547 31.220 53.135 1.00 0.00 H ATOM 33354 C11 PGR 839 3.593 33.337 53.804 1.00 0.00 C ATOM 33355 O12 PGR 839 3.217 32.992 54.893 1.00 0.00 O ATOM 33356 O11 PGR 839 3.920 34.564 53.358 1.00 0.00 O ATOM 33357 C1 PGR 839 3.652 35.681 54.269 1.00 0.00 C ATOM 33358 HR PGR 839 2.688 35.578 54.772 1.00 0.00 H ATOM 33359 HS PGR 839 3.554 36.560 53.626 1.00 0.00 H ATOM 33360 C2 PGR 839 4.846 35.816 55.250 1.00 0.00 C ATOM 33361 HX PGR 839 5.242 34.835 55.525 1.00 0.00 H ATOM 33362 C3 PGR 839 4.347 36.569 56.495 1.00 0.00 C ATOM 33363 HA PGR 839 3.424 36.113 56.860 1.00 0.00 H ATOM 33364 HB PGR 839 4.224 37.628 56.252 1.00 0.00 H ATOM 33365 O31 PGR 839 5.363 36.306 57.553 1.00 0.00 O ATOM 33366 P31 PGR 839 5.086 36.418 59.069 1.00 0.00 P ATOM 33367 O32 PGR 839 5.725 37.782 59.487 1.00 0.00 O ATOM 33368 C31 PGR 839 7.125 38.079 59.378 1.00 0.00 C ATOM 33369 H1A PGR 839 7.462 37.742 58.395 1.00 0.00 H ATOM 33370 H1B PGR 839 7.723 37.382 59.970 1.00 0.00 H ATOM 33371 C32 PGR 839 7.454 39.548 59.501 1.00 0.00 C ATOM 33372 H2A PGR 839 8.506 39.660 59.226 1.00 0.00 H ATOM 33373 O35 PGR 839 7.296 39.925 60.798 1.00 0.00 O ATOM 33374 HO5A PGR 839 7.531 40.866 60.886 1.00 0.00 H ATOM 33375 C33 PGR 839 6.621 40.485 58.588 1.00 0.00 C ATOM 33376 H3A PGR 839 7.005 41.492 58.767 1.00 0.00 H ATOM 33377 H3B PGR 839 6.764 40.280 57.524 1.00 0.00 H ATOM 33378 O33 PGR 839 3.591 36.383 59.282 1.00 0.00 O ATOM 33379 O34 PGR 839 5.838 35.396 59.862 1.00 0.00 O ATOM 33380 O21 PGR 839 5.876 36.618 54.516 1.00 0.00 O ATOM 33381 C21 PGR 839 7.137 36.560 54.981 1.00 0.00 C ATOM 33382 O22 PGR 839 7.562 35.658 55.695 1.00 0.00 O ATOM 33383 O36 PGR 839 5.185 40.439 58.784 1.00 0.00 O ATOM 33384 HO6A PGR 839 4.934 39.498 58.746 1.00 0.00 H ATOM 33385 C12 OL 840 8.096 37.573 54.356 1.00 0.00 C ATOM 33386 H2R OL 840 9.078 37.576 54.834 1.00 0.00 H ATOM 33387 H2S OL 840 8.317 37.215 53.348 1.00 0.00 H ATOM 33388 C13 OL 840 7.498 39.050 54.425 1.00 0.00 C ATOM 33389 H3R OL 840 6.489 38.839 54.065 1.00 0.00 H ATOM 33390 H3S OL 840 7.375 39.400 55.453 1.00 0.00 H ATOM 33391 C14 OL 840 8.250 40.101 53.718 1.00 0.00 C ATOM 33392 H4R OL 840 9.236 40.109 54.188 1.00 0.00 H ATOM 33393 H4S OL 840 8.358 39.786 52.678 1.00 0.00 H ATOM 33394 C15 OL 840 7.576 41.486 53.735 1.00 0.00 C ATOM 33395 H5R OL 840 6.620 41.509 53.207 1.00 0.00 H ATOM 33396 H5S OL 840 7.367 41.766 54.770 1.00 0.00 H ATOM 33397 C16 OL 840 8.594 42.472 53.166 1.00 0.00 C ATOM 33398 H6R OL 840 9.410 42.594 53.881 1.00 0.00 H ATOM 33399 H6S OL 840 8.935 42.008 52.238 1.00 0.00 H ATOM 33400 C17 OL 840 7.958 43.852 52.763 1.00 0.00 C ATOM 33401 H7R OL 840 7.221 43.625 51.989 1.00 0.00 H ATOM 33402 H7S OL 840 7.434 44.188 53.660 1.00 0.00 H ATOM 33403 C18 OL 840 8.911 44.958 52.204 1.00 0.00 C ATOM 33404 H8R OL 840 9.581 45.307 52.992 1.00 0.00 H ATOM 33405 H8S OL 840 9.721 44.542 51.601 1.00 0.00 H ATOM 33406 C19 OL 840 8.186 46.105 51.512 1.00 0.00 C ATOM 33407 H9R OL 840 7.295 46.432 52.043 1.00 0.00 H ATOM 33408 C110 OL 840 8.619 46.724 50.457 1.00 0.00 C ATOM 33409 H10R OL 840 8.000 47.487 49.991 1.00 0.00 H ATOM 33410 C111 OL 840 9.943 46.703 49.787 1.00 0.00 C ATOM 33411 H11R OL 840 10.327 47.719 49.669 1.00 0.00 H ATOM 33412 H11S OL 840 10.710 46.138 50.320 1.00 0.00 H ATOM 33413 C112 OL 840 9.774 46.115 48.441 1.00 0.00 C ATOM 33414 H12R OL 840 10.777 46.075 48.011 1.00 0.00 H ATOM 33415 H12S OL 840 9.390 45.093 48.452 1.00 0.00 H ATOM 33416 C113 OL 840 8.948 47.087 47.545 1.00 0.00 C ATOM 33417 H13R OL 840 7.906 46.990 47.856 1.00 0.00 H ATOM 33418 H13S OL 840 9.296 48.116 47.656 1.00 0.00 H ATOM 33419 C114 OL 840 8.846 46.801 46.052 1.00 0.00 C ATOM 33420 H14R OL 840 8.812 47.774 45.557 1.00 0.00 H ATOM 33421 H14S OL 840 9.769 46.329 45.707 1.00 0.00 H ATOM 33422 C115 OL 840 7.593 46.070 45.566 1.00 0.00 C ATOM 33423 H15R OL 840 7.627 45.089 46.044 1.00 0.00 H ATOM 33424 H15S OL 840 6.679 46.597 45.848 1.00 0.00 H ATOM 33425 C116 OL 840 7.678 45.913 44.052 1.00 0.00 C ATOM 33426 H16R OL 840 7.936 46.829 43.516 1.00 0.00 H ATOM 33427 H16S OL 840 8.458 45.198 43.780 1.00 0.00 H ATOM 33428 C117 OL 840 6.383 45.286 43.483 1.00 0.00 C ATOM 33429 H17R OL 840 5.906 44.493 44.063 1.00 0.00 H ATOM 33430 H17S OL 840 5.577 46.023 43.500 1.00 0.00 H ATOM 33431 C118 OL 840 6.657 44.717 42.129 1.00 0.00 C ATOM 33432 H18R OL 840 7.445 43.971 42.257 1.00 0.00 H ATOM 33433 H18S OL 840 7.125 45.544 41.591 1.00 0.00 H ATOM 33434 H18T OL 840 5.739 44.346 41.670 1.00 0.00 H TER 33435 OL 840 ATOM 33435 C116 PA 841 58.653 154.467 41.909 1.00 0.00 C ATOM 33436 H16R PA 841 57.967 155.287 42.128 1.00 0.00 H ATOM 33437 H16S PA 841 58.167 153.659 42.459 1.00 0.00 H ATOM 33438 H16T PA 841 58.599 154.071 40.892 1.00 0.00 H ATOM 33439 C115 PA 841 60.163 154.793 42.319 1.00 0.00 C ATOM 33440 H15R PA 841 60.154 154.930 43.403 1.00 0.00 H ATOM 33441 H15S PA 841 60.546 155.699 41.844 1.00 0.00 H ATOM 33442 C114 PA 841 61.177 153.727 41.870 1.00 0.00 C ATOM 33443 H14R PA 841 61.053 153.569 40.797 1.00 0.00 H ATOM 33444 H14S PA 841 60.955 152.765 42.336 1.00 0.00 H ATOM 33445 C113 PA 841 62.652 154.035 42.033 1.00 0.00 C ATOM 33446 H13R PA 841 63.028 154.985 41.648 1.00 0.00 H ATOM 33447 H13S PA 841 63.219 153.268 41.501 1.00 0.00 H ATOM 33448 C112 PA 841 63.100 154.050 43.538 1.00 0.00 C ATOM 33449 H12R PA 841 62.605 154.885 44.038 1.00 0.00 H ATOM 33450 H12S PA 841 64.136 154.379 43.434 1.00 0.00 H ATOM 33451 C111 PA 841 63.000 152.767 44.299 1.00 0.00 C ATOM 33452 H11R PA 841 63.486 152.009 43.682 1.00 0.00 H ATOM 33453 H11S PA 841 61.937 152.537 44.194 1.00 0.00 H ATOM 33454 C110 PA 841 63.632 152.856 45.702 1.00 0.00 C ATOM 33455 H10R PA 841 63.340 153.717 46.308 1.00 0.00 H ATOM 33456 H10S PA 841 64.692 153.070 45.545 1.00 0.00 H ATOM 33457 C19 PA 841 63.551 151.606 46.450 1.00 0.00 C ATOM 33458 H9R PA 841 62.483 151.381 46.498 1.00 0.00 H ATOM 33459 H9S PA 841 63.947 151.681 47.465 1.00 0.00 H ATOM 33460 C18 PA 841 64.225 150.394 45.844 1.00 0.00 C ATOM 33461 H8R PA 841 65.284 150.656 45.794 1.00 0.00 H ATOM 33462 H8S PA 841 64.005 150.098 44.816 1.00 0.00 H ATOM 33463 C17 PA 841 64.121 149.133 46.762 1.00 0.00 C ATOM 33464 H7R PA 841 63.137 148.658 46.764 1.00 0.00 H ATOM 33465 H7S PA 841 64.283 149.474 47.786 1.00 0.00 H ATOM 33466 C16 PA 841 65.166 148.087 46.445 1.00 0.00 C ATOM 33467 H6R PA 841 66.132 148.566 46.274 1.00 0.00 H ATOM 33468 H6S PA 841 64.919 147.524 45.542 1.00 0.00 H ATOM 33469 C15 PA 841 65.309 147.198 47.682 1.00 0.00 C ATOM 33470 H5R PA 841 64.328 146.736 47.813 1.00 0.00 H ATOM 33471 H5S PA 841 65.570 147.819 48.542 1.00 0.00 H ATOM 33472 C14 PA 841 66.318 146.008 47.488 1.00 0.00 C ATOM 33473 H4R PA 841 67.288 146.468 47.287 1.00 0.00 H ATOM 33474 H4S PA 841 66.042 145.370 46.647 1.00 0.00 H ATOM 33475 C13 PA 841 66.301 145.210 48.818 1.00 0.00 C ATOM 33476 H3R PA 841 65.321 144.733 48.877 1.00 0.00 H ATOM 33477 H3S PA 841 66.530 145.917 49.618 1.00 0.00 H ATOM 33478 C12 PA 841 67.386 144.121 48.726 1.00 0.00 C ATOM 33479 H2R PA 841 68.371 144.572 48.592 1.00 0.00 H ATOM 33480 H2S PA 841 67.254 143.602 47.774 1.00 0.00 H ATOM 33481 C11 PC 842 67.280 143.073 49.854 1.00 0.00 C ATOM 33482 O12 PC 842 68.128 142.864 50.687 1.00 0.00 O ATOM 33483 O11 PC 842 66.042 142.459 49.829 1.00 0.00 O ATOM 33484 C1 PC 842 65.581 141.576 50.874 1.00 0.00 C ATOM 33485 HR PC 842 65.946 141.842 51.870 1.00 0.00 H ATOM 33486 HS PC 842 65.800 140.515 50.733 1.00 0.00 H ATOM 33487 C2 PC 842 64.045 141.777 51.033 1.00 0.00 C ATOM 33488 HX PC 842 63.896 142.859 51.033 1.00 0.00 H ATOM 33489 C3 PC 842 63.443 141.067 52.253 1.00 0.00 C ATOM 33490 HA PC 842 63.941 141.282 53.201 1.00 0.00 H ATOM 33491 HB PC 842 63.627 140.015 52.020 1.00 0.00 H ATOM 33492 O31 PC 842 62.021 141.380 52.345 1.00 0.00 O ATOM 33493 P31 PC 842 61.285 140.973 53.712 1.00 0.00 P ATOM 33494 O32 PC 842 61.309 139.389 53.615 1.00 0.00 O ATOM 33495 C31 PC 842 60.833 138.782 52.461 1.00 0.00 C ATOM 33496 H1A PC 842 61.587 138.902 51.679 1.00 0.00 H ATOM 33497 H1B PC 842 59.850 139.175 52.192 1.00 0.00 H ATOM 33498 C32 PC 842 60.684 137.294 52.725 1.00 0.00 C ATOM 33499 H2A PC 842 60.166 137.213 53.682 1.00 0.00 H ATOM 33500 H2B PC 842 61.643 136.818 52.934 1.00 0.00 H ATOM 33501 N31 PC 842 59.828 136.451 51.810 1.00 0.00 N ATOM 33502 C33 PC 842 60.307 136.396 50.369 1.00 0.00 C ATOM 33503 H3A PC 842 60.158 137.364 49.890 1.00 0.00 H ATOM 33504 H3B PC 842 59.608 135.690 49.918 1.00 0.00 H ATOM 33505 H3C PC 842 61.329 136.051 50.208 1.00 0.00 H ATOM 33506 C34 PC 842 59.741 135.078 52.350 1.00 0.00 C ATOM 33507 H4A PC 842 59.623 135.088 53.435 1.00 0.00 H ATOM 33508 H4B PC 842 60.672 134.541 52.162 1.00 0.00 H ATOM 33509 H4C PC 842 58.888 134.550 51.920 1.00 0.00 H ATOM 33510 C35 PC 842 58.431 137.005 51.686 1.00 0.00 C ATOM 33511 H5A PC 842 57.866 136.220 51.183 1.00 0.00 H ATOM 33512 H5B PC 842 58.372 138.005 51.253 1.00 0.00 H ATOM 33513 H5C PC 842 58.088 137.196 52.704 1.00 0.00 H ATOM 33514 O33 PC 842 61.974 141.373 54.894 1.00 0.00 O ATOM 33515 O34 PC 842 59.878 141.363 53.554 1.00 0.00 O ATOM 33516 O21 PC 842 63.386 141.184 49.879 1.00 0.00 O ATOM 33517 C21 PC 842 63.466 139.899 49.509 1.00 0.00 C ATOM 33518 O22 PC 842 64.255 139.083 50.025 1.00 0.00 O ATOM 33519 C12 OL 843 62.495 139.628 48.327 1.00 0.00 C ATOM 33520 H2R OL 843 61.544 139.236 48.694 1.00 0.00 H ATOM 33521 H2S OL 843 62.185 140.612 47.969 1.00 0.00 H ATOM 33522 C13 OL 843 63.182 138.913 47.180 1.00 0.00 C ATOM 33523 H3R OL 843 64.072 139.406 46.783 1.00 0.00 H ATOM 33524 H3S OL 843 63.537 137.917 47.453 1.00 0.00 H ATOM 33525 C14 OL 843 62.136 138.805 46.087 1.00 0.00 C ATOM 33526 H4R OL 843 61.226 138.496 46.605 1.00 0.00 H ATOM 33527 H4S OL 843 61.905 139.809 45.724 1.00 0.00 H ATOM 33528 C15 OL 843 62.411 137.858 44.860 1.00 0.00 C ATOM 33529 H5R OL 843 62.472 136.843 45.259 1.00 0.00 H ATOM 33530 H5S OL 843 61.542 137.851 44.199 1.00 0.00 H ATOM 33531 C16 OL 843 63.707 138.191 44.082 1.00 0.00 C ATOM 33532 H6R OL 843 63.591 139.197 43.674 1.00 0.00 H ATOM 33533 H6S OL 843 64.514 138.252 44.815 1.00 0.00 H ATOM 33534 C17 OL 843 64.170 137.207 43.054 1.00 0.00 C ATOM 33535 H7R OL 843 64.429 136.246 43.504 1.00 0.00 H ATOM 33536 H7S OL 843 63.312 137.050 42.398 1.00 0.00 H ATOM 33537 C18 OL 843 65.223 137.667 42.138 1.00 0.00 C ATOM 33538 H8R OL 843 65.118 138.700 41.799 1.00 0.00 H ATOM 33539 H8S OL 843 66.012 137.925 42.847 1.00 0.00 H ATOM 33540 C19 OL 843 65.833 136.693 41.146 1.00 0.00 C ATOM 33541 H9R OL 843 66.493 135.911 41.512 1.00 0.00 H ATOM 33542 C110 OL 843 65.329 136.442 39.923 1.00 0.00 C ATOM 33543 H10R OL 843 65.658 135.631 39.278 1.00 0.00 H ATOM 33544 C111 OL 843 64.172 137.124 39.339 1.00 0.00 C ATOM 33545 H11R OL 843 63.398 136.412 39.045 1.00 0.00 H ATOM 33546 H11S OL 843 63.759 137.946 39.929 1.00 0.00 H ATOM 33547 C112 OL 843 64.634 137.917 38.077 1.00 0.00 C ATOM 33548 H12R OL 843 65.321 138.753 38.225 1.00 0.00 H ATOM 33549 H12S OL 843 65.154 137.124 37.535 1.00 0.00 H ATOM 33550 C113 OL 843 63.491 138.467 37.285 1.00 0.00 C ATOM 33551 H13R OL 843 62.744 137.677 37.175 1.00 0.00 H ATOM 33552 H13S OL 843 63.033 139.307 37.811 1.00 0.00 H ATOM 33553 C114 OL 843 63.864 138.824 35.832 1.00 0.00 C ATOM 33554 H14R OL 843 64.840 139.313 35.832 1.00 0.00 H ATOM 33555 H14S OL 843 64.026 137.892 35.287 1.00 0.00 H ATOM 33556 C115 OL 843 62.758 139.705 35.125 1.00 0.00 C ATOM 33557 H15R OL 843 61.814 139.264 35.454 1.00 0.00 H ATOM 33558 H15S OL 843 62.713 140.679 35.617 1.00 0.00 H ATOM 33559 C116 OL 843 62.941 139.820 33.629 1.00 0.00 C ATOM 33560 H16R OL 843 62.434 138.893 33.353 1.00 0.00 H ATOM 33561 H16S OL 843 62.348 140.582 33.119 1.00 0.00 H ATOM 33562 C117 OL 843 64.372 139.869 32.989 1.00 0.00 C ATOM 33563 H17R OL 843 65.062 140.546 33.496 1.00 0.00 H ATOM 33564 H17S OL 843 64.981 138.984 33.183 1.00 0.00 H ATOM 33565 C118 OL 843 64.323 139.966 31.423 1.00 0.00 C ATOM 33566 H18R OL 843 65.282 139.726 30.959 1.00 0.00 H ATOM 33567 H18S OL 843 63.986 140.939 31.061 1.00 0.00 H ATOM 33568 H18T OL 843 63.672 139.257 30.907 1.00 0.00 H TER 33569 OL 843 ATOM 33569 C116 PA 844 75.424 35.991 40.588 1.00 0.00 C ATOM 33570 H16R PA 844 75.407 36.422 39.585 1.00 0.00 H ATOM 33571 H16S PA 844 74.773 35.125 40.451 1.00 0.00 H ATOM 33572 H16T PA 844 76.455 35.682 40.773 1.00 0.00 H ATOM 33573 C115 PA 844 75.106 37.085 41.627 1.00 0.00 C ATOM 33574 H15R PA 844 74.117 37.419 41.306 1.00 0.00 H ATOM 33575 H15S PA 844 75.817 37.912 41.582 1.00 0.00 H ATOM 33576 C114 PA 844 75.121 36.656 43.100 1.00 0.00 C ATOM 33577 H14R PA 844 75.345 37.580 43.637 1.00 0.00 H ATOM 33578 H14S PA 844 75.935 35.993 43.400 1.00 0.00 H ATOM 33579 C113 PA 844 73.747 36.118 43.582 1.00 0.00 C ATOM 33580 H13R PA 844 73.670 35.204 42.990 1.00 0.00 H ATOM 33581 H13S PA 844 73.043 36.913 43.327 1.00 0.00 H ATOM 33582 C112 PA 844 73.778 35.797 45.076 1.00 0.00 C ATOM 33583 H12R PA 844 74.285 36.649 45.534 1.00 0.00 H ATOM 33584 H12S PA 844 74.416 34.942 45.312 1.00 0.00 H ATOM 33585 C111 PA 844 72.390 35.648 45.612 1.00 0.00 C ATOM 33586 H11R PA 844 71.982 34.777 45.096 1.00 0.00 H ATOM 33587 H11S PA 844 71.731 36.519 45.595 1.00 0.00 H ATOM 33588 C110 PA 844 72.426 35.197 47.012 1.00 0.00 C ATOM 33589 H10R PA 844 72.847 35.900 47.733 1.00 0.00 H ATOM 33590 H10S PA 844 73.159 34.389 47.050 1.00 0.00 H ATOM 33591 C19 PA 844 71.154 34.644 47.532 1.00 0.00 C ATOM 33592 H9R PA 844 70.535 34.205 46.746 1.00 0.00 H ATOM 33593 H9S PA 844 70.507 35.479 47.809 1.00 0.00 H ATOM 33594 C18 PA 844 71.493 33.679 48.740 1.00 0.00 C ATOM 33595 H8R PA 844 71.881 34.283 49.562 1.00 0.00 H ATOM 33596 H8S PA 844 72.255 32.941 48.481 1.00 0.00 H ATOM 33597 C17 PA 844 70.349 32.930 49.406 1.00 0.00 C ATOM 33598 H7R PA 844 69.882 32.183 48.761 1.00 0.00 H ATOM 33599 H7S PA 844 69.498 33.567 49.653 1.00 0.00 H ATOM 33600 C16 PA 844 70.773 32.234 50.723 1.00 0.00 C ATOM 33601 H6R PA 844 71.389 32.872 51.360 1.00 0.00 H ATOM 33602 H6S PA 844 71.367 31.381 50.386 1.00 0.00 H ATOM 33603 C15 PA 844 69.610 31.641 51.532 1.00 0.00 C ATOM 33604 H5R PA 844 68.911 32.442 51.777 1.00 0.00 H ATOM 33605 H5S PA 844 70.017 31.299 52.486 1.00 0.00 H ATOM 33606 C14 PA 844 68.942 30.549 50.764 1.00 0.00 C ATOM 33607 H4R PA 844 68.483 30.806 49.807 1.00 0.00 H ATOM 33608 H4S PA 844 68.156 30.216 51.445 1.00 0.00 H ATOM 33609 C13 PA 844 69.793 29.272 50.540 1.00 0.00 C ATOM 33610 H3R PA 844 70.040 28.923 51.545 1.00 0.00 H ATOM 33611 H3S PA 844 70.744 29.398 50.017 1.00 0.00 H ATOM 33612 C12 PA 844 68.971 28.183 49.832 1.00 0.00 C ATOM 33613 H2R PA 844 68.205 28.477 49.111 1.00 0.00 H ATOM 33614 H2S PA 844 69.643 27.544 49.256 1.00 0.00 H ATOM 33615 C11 PGR 845 68.243 27.348 50.842 1.00 0.00 C ATOM 33616 O12 PGR 845 68.290 27.576 52.041 1.00 0.00 O ATOM 33617 O11 PGR 845 67.554 26.372 50.305 1.00 0.00 O ATOM 33618 C1 PGR 845 66.933 25.450 51.310 1.00 0.00 C ATOM 33619 HR PGR 845 67.601 25.000 52.049 1.00 0.00 H ATOM 33620 HS PGR 845 66.533 24.649 50.682 1.00 0.00 H ATOM 33621 C2 PGR 845 65.790 26.060 52.145 1.00 0.00 C ATOM 33622 HX PGR 845 65.944 27.081 52.505 1.00 0.00 H ATOM 33623 C3 PGR 845 65.529 25.100 53.275 1.00 0.00 C ATOM 33624 HA PGR 845 64.608 25.321 53.821 1.00 0.00 H ATOM 33625 HB PGR 845 66.291 25.188 54.054 1.00 0.00 H ATOM 33626 O31 PGR 845 65.550 23.742 52.931 1.00 0.00 O ATOM 33627 P31 PGR 845 65.194 22.525 53.925 1.00 0.00 P ATOM 33628 O32 PGR 845 63.827 22.058 53.372 1.00 0.00 O ATOM 33629 C31 PGR 845 63.756 21.184 52.215 1.00 0.00 C ATOM 33630 H1A PGR 845 64.318 20.248 52.250 1.00 0.00 H ATOM 33631 H1B PGR 845 64.140 21.759 51.368 1.00 0.00 H ATOM 33632 C32 PGR 845 62.257 20.851 52.062 1.00 0.00 C ATOM 33633 H2A PGR 845 61.661 21.718 52.359 1.00 0.00 H ATOM 33634 O35 PGR 845 61.956 19.673 52.987 1.00 0.00 O ATOM 33635 HO5A PGR 845 61.131 19.188 52.805 1.00 0.00 H ATOM 33636 C33 PGR 845 61.870 20.611 50.627 1.00 0.00 C ATOM 33637 H3A PGR 845 60.824 20.305 50.708 1.00 0.00 H ATOM 33638 H3B PGR 845 62.106 21.535 50.092 1.00 0.00 H ATOM 33639 O33 PGR 845 66.245 21.494 53.712 1.00 0.00 O ATOM 33640 O34 PGR 845 65.083 23.070 55.292 1.00 0.00 O ATOM 33641 O21 PGR 845 64.681 26.175 51.243 1.00 0.00 O ATOM 33642 C21 PGR 845 64.644 27.235 50.412 1.00 0.00 C ATOM 33643 O22 PGR 845 65.441 28.173 50.467 1.00 0.00 O ATOM 33644 O36 PGR 845 62.755 19.594 50.189 1.00 0.00 O ATOM 33645 HO6A PGR 845 63.502 20.173 49.953 1.00 0.00 H ATOM 33646 C12 OL 846 63.398 27.310 49.564 1.00 0.00 C ATOM 33647 H2R OL 846 63.423 26.548 48.782 1.00 0.00 H ATOM 33648 H2S OL 846 62.505 27.110 50.158 1.00 0.00 H ATOM 33649 C13 OL 846 63.427 28.713 48.766 1.00 0.00 C ATOM 33650 H3R OL 846 63.487 29.459 49.561 1.00 0.00 H ATOM 33651 H3S OL 846 64.325 28.664 48.146 1.00 0.00 H ATOM 33652 C14 OL 846 62.242 28.991 47.818 1.00 0.00 C ATOM 33653 H4R OL 846 61.292 28.831 48.333 1.00 0.00 H ATOM 33654 H4S OL 846 62.107 29.994 47.407 1.00 0.00 H ATOM 33655 C15 OL 846 62.252 28.117 46.641 1.00 0.00 C ATOM 33656 H5R OL 846 63.149 28.403 46.088 1.00 0.00 H ATOM 33657 H5S OL 846 62.420 27.062 46.867 1.00 0.00 H ATOM 33658 C16 OL 846 61.116 28.402 45.743 1.00 0.00 C ATOM 33659 H6R OL 846 60.245 28.405 46.402 1.00 0.00 H ATOM 33660 H6S OL 846 61.248 29.436 45.415 1.00 0.00 H ATOM 33661 C17 OL 846 60.802 27.423 44.700 1.00 0.00 C ATOM 33662 H7R OL 846 61.617 27.323 43.980 1.00 0.00 H ATOM 33663 H7S OL 846 60.570 26.455 45.149 1.00 0.00 H ATOM 33664 C18 OL 846 59.658 28.003 43.713 1.00 0.00 C ATOM 33665 H8R OL 846 59.945 28.911 43.179 1.00 0.00 H ATOM 33666 H8S OL 846 59.437 27.301 42.906 1.00 0.00 H ATOM 33667 C19 OL 846 58.382 28.414 44.511 1.00 0.00 C ATOM 33668 H9R OL 846 58.430 29.241 45.215 1.00 0.00 H ATOM 33669 C110 OL 846 57.162 27.908 44.228 1.00 0.00 C ATOM 33670 H10R OL 846 56.338 28.292 44.823 1.00 0.00 H ATOM 33671 C111 OL 846 56.752 26.902 43.135 1.00 0.00 C ATOM 33672 H11R OL 846 56.216 27.471 42.373 1.00 0.00 H ATOM 33673 H11S OL 846 57.594 26.439 42.615 1.00 0.00 H ATOM 33674 C112 OL 846 55.770 25.904 43.556 1.00 0.00 C ATOM 33675 H12R OL 846 54.943 26.502 43.944 1.00 0.00 H ATOM 33676 H12S OL 846 55.377 25.474 42.632 1.00 0.00 H ATOM 33677 C113 OL 846 56.311 24.763 44.363 1.00 0.00 C ATOM 33678 H13R OL 846 57.040 24.257 43.727 1.00 0.00 H ATOM 33679 H13S OL 846 56.973 25.131 45.150 1.00 0.00 H ATOM 33680 C114 OL 846 55.291 23.771 44.924 1.00 0.00 C ATOM 33681 H14R OL 846 54.802 23.234 44.109 1.00 0.00 H ATOM 33682 H14S OL 846 56.010 22.991 45.184 1.00 0.00 H ATOM 33683 C115 OL 846 54.231 24.274 45.894 1.00 0.00 C ATOM 33684 H15R OL 846 53.449 24.888 45.441 1.00 0.00 H ATOM 33685 H15S OL 846 53.816 23.324 46.239 1.00 0.00 H ATOM 33686 C116 OL 846 54.748 25.043 47.108 1.00 0.00 C ATOM 33687 H16R OL 846 55.599 24.559 47.590 1.00 0.00 H ATOM 33688 H16S OL 846 55.080 26.019 46.747 1.00 0.00 H ATOM 33689 C117 OL 846 53.742 25.292 48.192 1.00 0.00 C ATOM 33690 H17R OL 846 52.929 25.881 47.762 1.00 0.00 H ATOM 33691 H17S OL 846 53.213 24.373 48.452 1.00 0.00 H ATOM 33692 C118 OL 846 54.324 25.940 49.466 1.00 0.00 C ATOM 33693 H18R OL 846 54.889 26.847 49.245 1.00 0.00 H ATOM 33694 H18S OL 846 54.914 25.193 50.001 1.00 0.00 H ATOM 33695 H18T OL 846 53.576 26.135 50.238 1.00 0.00 H TER 33696 OL 846 ATOM 33696 C116 PA 847 80.400 137.603 39.081 1.00 0.00 C ATOM 33697 H16R PA 847 80.216 136.562 39.356 1.00 0.00 H ATOM 33698 H16S PA 847 80.892 137.613 38.106 1.00 0.00 H ATOM 33699 H16T PA 847 79.442 138.122 39.006 1.00 0.00 H ATOM 33700 C115 PA 847 81.336 138.281 40.012 1.00 0.00 C ATOM 33701 H15R PA 847 81.663 139.211 39.542 1.00 0.00 H ATOM 33702 H15S PA 847 82.257 137.698 39.944 1.00 0.00 H ATOM 33703 C114 PA 847 80.911 138.388 41.525 1.00 0.00 C ATOM 33704 H14R PA 847 80.111 139.131 41.540 1.00 0.00 H ATOM 33705 H14S PA 847 81.723 138.735 42.169 1.00 0.00 H ATOM 33706 C113 PA 847 80.274 137.100 42.006 1.00 0.00 C ATOM 33707 H13R PA 847 80.922 136.253 41.771 1.00 0.00 H ATOM 33708 H13S PA 847 79.351 137.060 41.424 1.00 0.00 H ATOM 33709 C112 PA 847 80.070 137.010 43.455 1.00 0.00 C ATOM 33710 H12R PA 847 79.525 137.903 43.767 1.00 0.00 H ATOM 33711 H12S PA 847 80.989 137.018 44.044 1.00 0.00 H ATOM 33712 C111 PA 847 79.302 135.710 43.817 1.00 0.00 C ATOM 33713 H11R PA 847 79.965 134.881 43.560 1.00 0.00 H ATOM 33714 H11S PA 847 78.430 135.438 43.219 1.00 0.00 H ATOM 33715 C110 PA 847 78.958 135.517 45.305 1.00 0.00 C ATOM 33716 H10R PA 847 79.890 135.622 45.864 1.00 0.00 H ATOM 33717 H10S PA 847 78.684 134.462 45.384 1.00 0.00 H ATOM 33718 C19 PA 847 77.846 136.444 45.811 1.00 0.00 C ATOM 33719 H9R PA 847 76.920 136.025 45.410 1.00 0.00 H ATOM 33720 H9S PA 847 77.891 137.479 45.465 1.00 0.00 H ATOM 33721 C18 PA 847 77.587 136.196 47.307 1.00 0.00 C ATOM 33722 H8R PA 847 77.797 135.128 47.397 1.00 0.00 H ATOM 33723 H8S PA 847 76.506 136.294 47.426 1.00 0.00 H ATOM 33724 C17 PA 847 78.332 137.187 48.220 1.00 0.00 C ATOM 33725 H7R PA 847 78.060 138.244 48.237 1.00 0.00 H ATOM 33726 H7S PA 847 79.258 137.343 47.662 1.00 0.00 H ATOM 33727 C16 PA 847 78.566 136.660 49.651 1.00 0.00 C ATOM 33728 H6R PA 847 78.945 135.645 49.781 1.00 0.00 H ATOM 33729 H6S PA 847 77.554 136.620 50.060 1.00 0.00 H ATOM 33730 C15 PA 847 79.316 137.709 50.467 1.00 0.00 C ATOM 33731 H5R PA 847 78.940 138.703 50.219 1.00 0.00 H ATOM 33732 H5S PA 847 80.327 137.588 50.071 1.00 0.00 H ATOM 33733 C14 PA 847 79.259 137.414 51.983 1.00 0.00 C ATOM 33734 H4R PA 847 79.634 136.417 52.225 1.00 0.00 H ATOM 33735 H4S PA 847 78.201 137.433 52.249 1.00 0.00 H ATOM 33736 C13 PA 847 79.928 138.502 52.784 1.00 0.00 C ATOM 33737 H3R PA 847 79.551 139.414 52.316 1.00 0.00 H ATOM 33738 H3S PA 847 80.989 138.385 52.555 1.00 0.00 H ATOM 33739 C12 PA 847 79.617 138.501 54.237 1.00 0.00 C ATOM 33740 H2R PA 847 80.201 137.722 54.731 1.00 0.00 H ATOM 33741 H2S PA 847 78.538 138.519 54.408 1.00 0.00 H ATOM 33742 C11 PGR 848 80.041 139.805 54.728 1.00 0.00 C ATOM 33743 O12 PGR 848 81.168 140.068 54.990 1.00 0.00 O ATOM 33744 O11 PGR 848 78.999 140.615 54.720 1.00 0.00 O ATOM 33745 C1 PGR 848 79.025 142.021 54.801 1.00 0.00 C ATOM 33746 HR PGR 848 79.384 142.602 53.948 1.00 0.00 H ATOM 33747 HS PGR 848 79.601 142.266 55.697 1.00 0.00 H ATOM 33748 C2 PGR 848 77.544 142.566 55.150 1.00 0.00 C ATOM 33749 HX PGR 848 77.601 143.557 55.608 1.00 0.00 H ATOM 33750 C3 PGR 848 76.924 141.499 56.183 1.00 0.00 C ATOM 33751 HA PGR 848 77.581 141.362 57.046 1.00 0.00 H ATOM 33752 HB PGR 848 76.809 140.571 55.617 1.00 0.00 H ATOM 33753 O31 PGR 848 75.643 142.035 56.455 1.00 0.00 O ATOM 33754 P31 PGR 848 74.570 141.193 57.344 1.00 0.00 P ATOM 33755 O32 PGR 848 74.492 139.794 56.677 1.00 0.00 O ATOM 33756 C31 PGR 848 73.874 139.574 55.435 1.00 0.00 C ATOM 33757 H1A PGR 848 74.274 140.228 54.657 1.00 0.00 H ATOM 33758 H1B PGR 848 72.815 139.783 55.608 1.00 0.00 H ATOM 33759 C32 PGR 848 74.055 138.068 55.185 1.00 0.00 C ATOM 33760 H2A PGR 848 73.725 137.650 54.231 1.00 0.00 H ATOM 33761 O35 PGR 848 73.299 137.198 56.095 1.00 0.00 O ATOM 33762 HO5A PGR 848 72.384 137.529 56.132 1.00 0.00 H ATOM 33763 C33 PGR 848 75.589 137.739 55.187 1.00 0.00 C ATOM 33764 H3A PGR 848 76.128 138.558 54.706 1.00 0.00 H ATOM 33765 H3B PGR 848 75.933 137.671 56.223 1.00 0.00 H ATOM 33766 O33 PGR 848 75.023 140.989 58.784 1.00 0.00 O ATOM 33767 O34 PGR 848 73.239 141.800 57.142 1.00 0.00 O ATOM 33768 O21 PGR 848 76.762 142.549 53.924 1.00 0.00 O ATOM 33769 C21 PGR 848 77.151 143.189 52.816 1.00 0.00 C ATOM 33770 O22 PGR 848 78.064 144.000 52.764 1.00 0.00 O ATOM 33771 O36 PGR 848 76.004 136.571 54.412 1.00 0.00 O ATOM 33772 HO6A PGR 848 75.346 135.866 54.546 1.00 0.00 H ATOM 33773 C12 OL 849 76.301 142.722 51.586 1.00 0.00 C ATOM 33774 H2R OL 849 75.699 143.512 51.133 1.00 0.00 H ATOM 33775 H2S OL 849 76.958 142.373 50.787 1.00 0.00 H ATOM 33776 C13 OL 849 75.401 141.495 51.692 1.00 0.00 C ATOM 33777 H3R OL 849 74.782 141.653 52.578 1.00 0.00 H ATOM 33778 H3S OL 849 74.718 141.277 50.869 1.00 0.00 H ATOM 33779 C14 OL 849 76.118 140.136 51.898 1.00 0.00 C ATOM 33780 H4R OL 849 76.922 140.102 51.160 1.00 0.00 H ATOM 33781 H4S OL 849 76.651 140.124 52.851 1.00 0.00 H ATOM 33782 C15 OL 849 75.283 138.824 51.675 1.00 0.00 C ATOM 33783 H5R OL 849 75.879 138.057 52.174 1.00 0.00 H ATOM 33784 H5S OL 849 74.333 138.813 52.213 1.00 0.00 H ATOM 33785 C16 OL 849 74.942 138.413 50.271 1.00 0.00 C ATOM 33786 H6R OL 849 74.514 139.236 49.696 1.00 0.00 H ATOM 33787 H6S OL 849 75.881 138.226 49.746 1.00 0.00 H ATOM 33788 C17 OL 849 74.080 137.145 50.063 1.00 0.00 C ATOM 33789 H7R OL 849 74.730 136.274 50.169 1.00 0.00 H ATOM 33790 H7S OL 849 73.277 137.118 50.803 1.00 0.00 H ATOM 33791 C18 OL 849 73.376 137.205 48.657 1.00 0.00 C ATOM 33792 H8R OL 849 72.876 138.176 48.658 1.00 0.00 H ATOM 33793 H8S OL 849 74.157 137.221 47.894 1.00 0.00 H ATOM 33794 C19 OL 849 72.413 136.130 48.273 1.00 0.00 C ATOM 33795 H9R OL 849 71.744 135.894 49.096 1.00 0.00 H ATOM 33796 C110 OL 849 72.439 135.416 47.142 1.00 0.00 C ATOM 33797 H10R OL 849 71.701 134.623 47.043 1.00 0.00 H ATOM 33798 C111 OL 849 73.306 135.693 45.905 1.00 0.00 C ATOM 33799 H11R OL 849 74.150 136.327 46.181 1.00 0.00 H ATOM 33800 H11S OL 849 73.735 134.774 45.499 1.00 0.00 H ATOM 33801 C112 OL 849 72.487 136.378 44.908 1.00 0.00 C ATOM 33802 H12R OL 849 73.091 136.522 44.010 1.00 0.00 H ATOM 33803 H12S OL 849 71.653 135.721 44.654 1.00 0.00 H ATOM 33804 C113 OL 849 71.988 137.821 45.288 1.00 0.00 C ATOM 33805 H13R OL 849 71.196 137.673 46.025 1.00 0.00 H ATOM 33806 H13S OL 849 72.808 138.273 45.849 1.00 0.00 H ATOM 33807 C114 OL 849 71.521 138.724 44.103 1.00 0.00 C ATOM 33808 H14R OL 849 71.018 139.614 44.487 1.00 0.00 H ATOM 33809 H14S OL 849 72.452 138.986 43.596 1.00 0.00 H ATOM 33810 C115 OL 849 70.522 137.997 43.196 1.00 0.00 C ATOM 33811 H15R OL 849 71.022 137.116 42.789 1.00 0.00 H ATOM 33812 H15S OL 849 69.575 137.760 43.685 1.00 0.00 H ATOM 33813 C116 OL 849 70.157 138.891 41.895 1.00 0.00 C ATOM 33814 H16R OL 849 70.280 139.966 42.042 1.00 0.00 H ATOM 33815 H16S OL 849 70.844 138.611 41.094 1.00 0.00 H ATOM 33816 C117 OL 849 68.706 138.663 41.400 1.00 0.00 C ATOM 33817 H17R OL 849 68.429 137.626 41.198 1.00 0.00 H ATOM 33818 H17S OL 849 68.064 138.927 42.243 1.00 0.00 H ATOM 33819 C118 OL 849 68.304 139.495 40.180 1.00 0.00 C ATOM 33820 H18R OL 849 68.926 139.306 39.302 1.00 0.00 H ATOM 33821 H18S OL 849 68.309 140.573 40.358 1.00 0.00 H ATOM 33822 H18T OL 849 67.337 139.026 39.988 1.00 0.00 H TER 33823 OL 849 ATOM 33823 C116 PA 850 86.960 115.064 37.676 1.00 0.00 C ATOM 33824 H16R PA 850 85.987 115.087 37.179 1.00 0.00 H ATOM 33825 H16S PA 850 87.325 114.042 37.794 1.00 0.00 H ATOM 33826 H16T PA 850 87.733 115.695 37.233 1.00 0.00 H ATOM 33827 C115 PA 850 86.653 115.703 39.016 1.00 0.00 C ATOM 33828 H15R PA 850 86.115 115.105 39.754 1.00 0.00 H ATOM 33829 H15S PA 850 85.963 116.547 38.945 1.00 0.00 H ATOM 33830 C114 PA 850 87.990 116.140 39.705 1.00 0.00 C ATOM 33831 H14R PA 850 88.194 117.040 39.122 1.00 0.00 H ATOM 33832 H14S PA 850 88.788 115.485 39.348 1.00 0.00 H ATOM 33833 C113 PA 850 87.954 116.507 41.206 1.00 0.00 C ATOM 33834 H13R PA 850 88.923 116.983 41.372 1.00 0.00 H ATOM 33835 H13S PA 850 88.074 115.551 41.720 1.00 0.00 H ATOM 33836 C112 PA 850 86.702 117.224 41.603 1.00 0.00 C ATOM 33837 H12R PA 850 85.901 116.483 41.629 1.00 0.00 H ATOM 33838 H12S PA 850 86.409 117.901 40.797 1.00 0.00 H ATOM 33839 C111 PA 850 86.905 117.981 42.946 1.00 0.00 C ATOM 33840 H11R PA 850 86.217 118.811 43.123 1.00 0.00 H ATOM 33841 H11S PA 850 87.773 118.616 42.753 1.00 0.00 H ATOM 33842 C110 PA 850 87.197 117.081 44.151 1.00 0.00 C ATOM 33843 H10R PA 850 88.202 116.660 44.091 1.00 0.00 H ATOM 33844 H10S PA 850 86.456 116.282 44.087 1.00 0.00 H ATOM 33845 C19 PA 850 87.045 117.938 45.402 1.00 0.00 C ATOM 33846 H9R PA 850 85.999 118.055 45.693 1.00 0.00 H ATOM 33847 H9S PA 850 87.272 118.972 45.132 1.00 0.00 H ATOM 33848 C18 PA 850 87.904 117.205 46.488 1.00 0.00 C ATOM 33849 H8R PA 850 88.958 117.238 46.205 1.00 0.00 H ATOM 33850 H8S PA 850 87.566 116.167 46.513 1.00 0.00 H ATOM 33851 C17 PA 850 87.821 117.764 47.880 1.00 0.00 C ATOM 33852 H7R PA 850 88.211 117.089 48.644 1.00 0.00 H ATOM 33853 H7S PA 850 86.766 117.803 48.160 1.00 0.00 H ATOM 33854 C16 PA 850 88.368 119.197 48.191 1.00 0.00 C ATOM 33855 H6R PA 850 87.984 119.881 47.431 1.00 0.00 H ATOM 33856 H6S PA 850 89.384 119.012 47.837 1.00 0.00 H ATOM 33857 C15 PA 850 88.155 119.666 49.572 1.00 0.00 C ATOM 33858 H5R PA 850 88.365 118.932 50.352 1.00 0.00 H ATOM 33859 H5S PA 850 87.074 119.820 49.597 1.00 0.00 H ATOM 33860 C14 PA 850 88.893 120.960 49.735 1.00 0.00 C ATOM 33861 H4R PA 850 88.516 121.523 48.878 1.00 0.00 H ATOM 33862 H4S PA 850 89.936 120.828 49.439 1.00 0.00 H ATOM 33863 C13 PA 850 88.768 121.787 50.980 1.00 0.00 C ATOM 33864 H3R PA 850 87.765 122.019 51.344 1.00 0.00 H ATOM 33865 H3S PA 850 89.310 122.708 50.758 1.00 0.00 H ATOM 33866 C12 PA 850 89.492 121.123 52.133 1.00 0.00 C ATOM 33867 H2R PA 850 89.557 121.845 52.950 1.00 0.00 H ATOM 33868 H2S PA 850 90.482 120.732 51.890 1.00 0.00 H ATOM 33869 C11 PC 851 88.683 119.965 52.729 1.00 0.00 C ATOM 33870 O12 PC 851 89.115 118.800 52.783 1.00 0.00 O ATOM 33871 O11 PC 851 87.579 120.427 53.392 1.00 0.00 O ATOM 33872 C1 PC 851 86.969 119.482 54.337 1.00 0.00 C ATOM 33873 HR PC 851 87.683 119.137 55.090 1.00 0.00 H ATOM 33874 HS PC 851 86.602 118.636 53.750 1.00 0.00 H ATOM 33875 C2 PC 851 85.748 120.192 54.951 1.00 0.00 C ATOM 33876 HX PC 851 86.023 120.941 55.698 1.00 0.00 H ATOM 33877 C3 PC 851 84.871 119.192 55.709 1.00 0.00 C ATOM 33878 HA PC 851 85.427 118.607 56.447 1.00 0.00 H ATOM 33879 HB PC 851 84.329 118.383 55.214 1.00 0.00 H ATOM 33880 O31 PC 851 84.068 120.040 56.467 1.00 0.00 O ATOM 33881 P31 PC 851 83.415 119.613 57.791 1.00 0.00 P ATOM 33882 O32 PC 851 82.003 118.884 57.368 1.00 0.00 O ATOM 33883 C31 PC 851 81.418 119.273 56.138 1.00 0.00 C ATOM 33884 H1A PC 851 81.833 118.709 55.299 1.00 0.00 H ATOM 33885 H1B PC 851 81.665 120.286 55.811 1.00 0.00 H ATOM 33886 C32 PC 851 79.930 119.116 56.029 1.00 0.00 C ATOM 33887 H2A PC 851 79.782 118.833 54.986 1.00 0.00 H ATOM 33888 H2B PC 851 79.323 120.001 56.226 1.00 0.00 H ATOM 33889 N31 PC 851 79.324 118.102 56.900 1.00 0.00 N ATOM 33890 C33 PC 851 79.351 118.392 58.330 1.00 0.00 C ATOM 33891 H3A PC 851 78.644 119.196 58.541 1.00 0.00 H ATOM 33892 H3B PC 851 80.333 118.621 58.746 1.00 0.00 H ATOM 33893 H3C PC 851 78.993 117.502 58.850 1.00 0.00 H ATOM 33894 C34 PC 851 77.901 118.148 56.674 1.00 0.00 C ATOM 33895 H4A PC 851 77.559 118.158 55.638 1.00 0.00 H ATOM 33896 H4B PC 851 77.598 119.107 57.097 1.00 0.00 H ATOM 33897 H4C PC 851 77.524 117.313 57.265 1.00 0.00 H ATOM 33898 C35 PC 851 79.843 116.785 56.696 1.00 0.00 C ATOM 33899 H5A PC 851 79.291 116.169 57.408 1.00 0.00 H ATOM 33900 H5B PC 851 80.916 116.749 56.891 1.00 0.00 H ATOM 33901 H5C PC 851 79.725 116.457 55.662 1.00 0.00 H ATOM 33902 O33 PC 851 84.319 118.662 58.504 1.00 0.00 O ATOM 33903 O34 PC 851 83.046 120.892 58.415 1.00 0.00 O ATOM 33904 O21 PC 851 85.004 120.705 53.847 1.00 0.00 O ATOM 33905 C21 PC 851 84.702 122.009 53.732 1.00 0.00 C ATOM 33906 O22 PC 851 84.967 122.875 54.531 1.00 0.00 O ATOM 33907 C12 OL 852 83.938 122.300 52.437 1.00 0.00 C ATOM 33908 H2R OL 852 83.022 121.721 52.310 1.00 0.00 H ATOM 33909 H2S OL 852 83.653 123.352 52.503 1.00 0.00 H ATOM 33910 C13 OL 852 84.871 122.100 51.209 1.00 0.00 C ATOM 33911 H3R OL 852 85.669 122.845 51.191 1.00 0.00 H ATOM 33912 H3S OL 852 85.409 121.151 51.270 1.00 0.00 H ATOM 33913 C14 OL 852 84.113 122.206 49.851 1.00 0.00 C ATOM 33914 H4R OL 852 83.224 121.574 49.802 1.00 0.00 H ATOM 33915 H4S OL 852 83.513 123.105 49.693 1.00 0.00 H ATOM 33916 C15 OL 852 85.027 121.822 48.674 1.00 0.00 C ATOM 33917 H5R OL 852 86.060 122.070 48.926 1.00 0.00 H ATOM 33918 H5S OL 852 84.926 120.755 48.464 1.00 0.00 H ATOM 33919 C16 OL 852 84.775 122.539 47.363 1.00 0.00 C ATOM 33920 H6R OL 852 83.764 122.412 46.971 1.00 0.00 H ATOM 33921 H6S OL 852 84.979 123.577 47.633 1.00 0.00 H ATOM 33922 C17 OL 852 85.631 122.146 46.185 1.00 0.00 C ATOM 33923 H7R OL 852 85.912 121.091 46.188 1.00 0.00 H ATOM 33924 H7S OL 852 85.153 122.353 45.225 1.00 0.00 H ATOM 33925 C18 OL 852 86.977 122.899 46.213 1.00 0.00 C ATOM 33926 H8R OL 852 86.953 123.971 46.008 1.00 0.00 H ATOM 33927 H8S OL 852 87.461 122.708 47.173 1.00 0.00 H ATOM 33928 C19 OL 852 87.898 122.168 45.286 1.00 0.00 C ATOM 33929 H9R OL 852 88.613 121.510 45.773 1.00 0.00 H ATOM 33930 C110 OL 852 87.929 122.169 43.983 1.00 0.00 C ATOM 33931 H10R OL 852 88.724 121.563 43.556 1.00 0.00 H ATOM 33932 C111 OL 852 86.941 122.970 43.222 1.00 0.00 C ATOM 33933 H11R OL 852 86.474 123.772 43.798 1.00 0.00 H ATOM 33934 H11S OL 852 87.581 123.470 42.492 1.00 0.00 H ATOM 33935 C112 OL 852 85.990 122.222 42.460 1.00 0.00 C ATOM 33936 H12R OL 852 85.750 121.280 42.959 1.00 0.00 H ATOM 33937 H12S OL 852 85.023 122.728 42.415 1.00 0.00 H ATOM 33938 C113 OL 852 86.343 121.854 40.997 1.00 0.00 C ATOM 33939 H13R OL 852 86.389 122.683 40.288 1.00 0.00 H ATOM 33940 H13S OL 852 87.364 121.469 40.970 1.00 0.00 H ATOM 33941 C114 OL 852 85.376 120.855 40.366 1.00 0.00 C ATOM 33942 H14R OL 852 85.018 120.098 41.067 1.00 0.00 H ATOM 33943 H14S OL 852 84.476 121.460 40.236 1.00 0.00 H ATOM 33944 C115 OL 852 85.857 120.222 39.069 1.00 0.00 C ATOM 33945 H15R OL 852 86.387 120.984 38.495 1.00 0.00 H ATOM 33946 H15S OL 852 86.634 119.459 39.151 1.00 0.00 H ATOM 33947 C116 OL 852 84.739 119.636 38.243 1.00 0.00 C ATOM 33948 H16R OL 852 84.311 118.754 38.724 1.00 0.00 H ATOM 33949 H16S OL 852 83.882 120.294 38.086 1.00 0.00 H ATOM 33950 C117 OL 852 85.217 119.140 36.919 1.00 0.00 C ATOM 33951 H17R OL 852 85.787 118.220 37.064 1.00 0.00 H ATOM 33952 H17S OL 852 84.344 118.718 36.417 1.00 0.00 H ATOM 33953 C118 OL 852 85.896 120.053 35.899 1.00 0.00 C ATOM 33954 H18R OL 852 86.840 120.439 36.290 1.00 0.00 H ATOM 33955 H18S OL 852 85.363 120.891 35.444 1.00 0.00 H ATOM 33956 H18T OL 852 86.190 119.531 34.986 1.00 0.00 H TER 33957 OL 852 ATOM 33957 C116 PA 853 54.315 71.408 56.117 1.00 0.00 C ATOM 33958 H16R PA 853 53.671 70.527 56.152 1.00 0.00 H ATOM 33959 H16S PA 853 54.337 71.970 57.053 1.00 0.00 H ATOM 33960 H16T PA 853 55.331 71.066 55.908 1.00 0.00 H ATOM 33961 C115 PA 853 54.012 72.269 54.847 1.00 0.00 C ATOM 33962 H15R PA 853 52.979 72.624 54.866 1.00 0.00 H ATOM 33963 H15S PA 853 54.102 71.728 53.903 1.00 0.00 H ATOM 33964 C114 PA 853 54.865 73.519 54.688 1.00 0.00 C ATOM 33965 H14R PA 853 54.775 74.157 55.570 1.00 0.00 H ATOM 33966 H14S PA 853 54.476 74.125 53.867 1.00 0.00 H ATOM 33967 C113 PA 853 56.372 73.294 54.499 1.00 0.00 C ATOM 33968 H13R PA 853 56.890 72.801 55.324 1.00 0.00 H ATOM 33969 H13S PA 853 56.676 74.343 54.535 1.00 0.00 H ATOM 33970 C112 PA 853 56.659 72.578 53.208 1.00 0.00 C ATOM 33971 H12R PA 853 56.034 73.029 52.434 1.00 0.00 H ATOM 33972 H12S PA 853 56.315 71.543 53.145 1.00 0.00 H ATOM 33973 C111 PA 853 58.109 72.588 52.886 1.00 0.00 C ATOM 33974 H11R PA 853 58.676 72.332 53.784 1.00 0.00 H ATOM 33975 H11S PA 853 58.416 73.587 52.570 1.00 0.00 H ATOM 33976 C110 PA 853 58.558 71.626 51.831 1.00 0.00 C ATOM 33977 H10R PA 853 57.735 71.509 51.123 1.00 0.00 H ATOM 33978 H10S PA 853 58.528 70.618 52.250 1.00 0.00 H ATOM 33979 C19 PA 853 59.762 71.918 51.079 1.00 0.00 C ATOM 33980 H9R PA 853 59.646 72.922 50.666 1.00 0.00 H ATOM 33981 H9S PA 853 59.924 71.199 50.273 1.00 0.00 H ATOM 33982 C18 PA 853 61.100 72.033 51.840 1.00 0.00 C ATOM 33983 H8R PA 853 61.566 71.053 51.723 1.00 0.00 H ATOM 33984 H8S PA 853 61.094 72.240 52.913 1.00 0.00 H ATOM 33985 C17 PA 853 62.092 73.108 51.198 1.00 0.00 C ATOM 33986 H7R PA 853 62.349 72.919 50.153 1.00 0.00 H ATOM 33987 H7S PA 853 63.024 73.031 51.761 1.00 0.00 H ATOM 33988 C16 PA 853 61.595 74.624 51.364 1.00 0.00 C ATOM 33989 H6R PA 853 60.890 74.826 50.555 1.00 0.00 H ATOM 33990 H6S PA 853 62.474 75.220 51.111 1.00 0.00 H ATOM 33991 C15 PA 853 61.192 75.123 52.801 1.00 0.00 C ATOM 33992 H5R PA 853 61.951 74.782 53.508 1.00 0.00 H ATOM 33993 H5S PA 853 60.203 74.730 53.045 1.00 0.00 H ATOM 33994 C14 PA 853 61.079 76.676 52.995 1.00 0.00 C ATOM 33995 H4R PA 853 60.513 77.145 52.188 1.00 0.00 H ATOM 33996 H4S PA 853 62.112 77.028 52.979 1.00 0.00 H ATOM 33997 C13 PA 853 60.688 77.127 54.451 1.00 0.00 C ATOM 33998 H3R PA 853 59.608 77.235 54.572 1.00 0.00 H ATOM 33999 H3S PA 853 60.986 78.173 54.546 1.00 0.00 H ATOM 34000 C12 PA 853 61.301 76.295 55.547 1.00 0.00 C ATOM 34001 H2R PA 853 62.340 76.569 55.743 1.00 0.00 H ATOM 34002 H2S PA 853 61.140 75.234 55.345 1.00 0.00 H ATOM 34003 C11 PC 854 60.743 76.567 56.869 1.00 0.00 C ATOM 34004 O12 PC 854 60.978 75.869 57.831 1.00 0.00 O ATOM 34005 O11 PC 854 59.903 77.603 57.088 1.00 0.00 O ATOM 34006 C1 PC 854 59.362 77.889 58.384 1.00 0.00 C ATOM 34007 HR PC 854 59.323 77.003 59.022 1.00 0.00 H ATOM 34008 HS PC 854 58.344 78.286 58.370 1.00 0.00 H ATOM 34009 C2 PC 854 60.257 78.954 58.988 1.00 0.00 C ATOM 34010 HX PC 854 60.918 79.315 58.196 1.00 0.00 H ATOM 34011 C3 PC 854 60.970 78.463 60.250 1.00 0.00 C ATOM 34012 HA PC 854 61.782 79.100 60.610 1.00 0.00 H ATOM 34013 HB PC 854 61.320 77.439 60.094 1.00 0.00 H ATOM 34014 O31 PC 854 59.993 78.399 61.301 1.00 0.00 O ATOM 34015 P31 PC 854 60.327 77.666 62.681 1.00 0.00 P ATOM 34016 O32 PC 854 60.069 78.783 63.759 1.00 0.00 O ATOM 34017 C31 PC 854 60.903 79.861 63.740 1.00 0.00 C ATOM 34018 H1A PC 854 61.615 79.946 62.915 1.00 0.00 H ATOM 34019 H1B PC 854 61.587 79.792 64.590 1.00 0.00 H ATOM 34020 C32 PC 854 60.160 81.233 63.865 1.00 0.00 C ATOM 34021 H2A PC 854 59.495 81.353 63.009 1.00 0.00 H ATOM 34022 H2B PC 854 60.910 82.024 63.866 1.00 0.00 H ATOM 34023 N31 PC 854 59.306 81.464 65.066 1.00 0.00 N ATOM 34024 C33 PC 854 60.008 81.023 66.331 1.00 0.00 C ATOM 34025 H3A PC 854 61.008 81.454 66.376 1.00 0.00 H ATOM 34026 H3B PC 854 60.158 79.942 66.344 1.00 0.00 H ATOM 34027 H3C PC 854 59.393 81.286 67.193 1.00 0.00 H ATOM 34028 C34 PC 854 59.006 82.955 65.025 1.00 0.00 C ATOM 34029 H4A PC 854 59.957 83.380 65.348 1.00 0.00 H ATOM 34030 H4B PC 854 58.228 83.341 65.685 1.00 0.00 H ATOM 34031 H4C PC 854 58.893 83.327 64.006 1.00 0.00 H ATOM 34032 C35 PC 854 58.001 80.828 65.048 1.00 0.00 C ATOM 34033 H5A PC 854 58.063 79.790 64.717 1.00 0.00 H ATOM 34034 H5B PC 854 57.317 81.388 64.408 1.00 0.00 H ATOM 34035 H5C PC 854 57.666 80.947 66.080 1.00 0.00 H ATOM 34036 O33 PC 854 59.372 76.598 62.940 1.00 0.00 O ATOM 34037 O34 PC 854 61.807 77.245 62.700 1.00 0.00 O ATOM 34038 O21 PC 854 59.356 80.056 59.262 1.00 0.00 O ATOM 34039 C21 PC 854 59.771 81.221 59.847 1.00 0.00 C ATOM 34040 O22 PC 854 60.898 81.474 60.293 1.00 0.00 O ATOM 34041 C12 OL 855 58.621 82.246 59.929 1.00 0.00 C ATOM 34042 H2R OL 855 57.622 81.806 59.884 1.00 0.00 H ATOM 34043 H2S OL 855 58.574 82.873 60.822 1.00 0.00 H ATOM 34044 C13 OL 855 58.800 83.280 58.797 1.00 0.00 C ATOM 34045 H3R OL 855 59.777 83.765 58.852 1.00 0.00 H ATOM 34046 H3S OL 855 58.790 82.772 57.830 1.00 0.00 H ATOM 34047 C14 OL 855 57.738 84.420 58.704 1.00 0.00 C ATOM 34048 H4R OL 855 58.021 85.273 59.325 1.00 0.00 H ATOM 34049 H4S OL 855 57.795 84.811 57.686 1.00 0.00 H ATOM 34050 C15 OL 855 56.284 84.043 59.020 1.00 0.00 C ATOM 34051 H5R OL 855 55.972 83.028 58.765 1.00 0.00 H ATOM 34052 H5S OL 855 56.223 84.164 60.104 1.00 0.00 H ATOM 34053 C16 OL 855 55.303 85.045 58.281 1.00 0.00 C ATOM 34054 H6R OL 855 54.289 84.851 58.636 1.00 0.00 H ATOM 34055 H6S OL 855 55.410 86.050 58.694 1.00 0.00 H ATOM 34056 C17 OL 855 55.254 84.795 56.750 1.00 0.00 C ATOM 34057 H7R OL 855 56.215 84.982 56.268 1.00 0.00 H ATOM 34058 H7S OL 855 55.009 83.739 56.615 1.00 0.00 H ATOM 34059 C18 OL 855 54.120 85.699 56.119 1.00 0.00 C ATOM 34060 H8R OL 855 53.264 85.720 56.796 1.00 0.00 H ATOM 34061 H8S OL 855 54.374 86.760 56.084 1.00 0.00 H ATOM 34062 C19 OL 855 53.690 85.149 54.817 1.00 0.00 C ATOM 34063 H9R OL 855 52.985 84.323 54.853 1.00 0.00 H ATOM 34064 C110 OL 855 54.143 85.665 53.676 1.00 0.00 C ATOM 34065 H10R OL 855 53.738 85.306 52.734 1.00 0.00 H ATOM 34066 C111 OL 855 55.100 86.801 53.344 1.00 0.00 C ATOM 34067 H11R OL 855 55.558 87.172 54.263 1.00 0.00 H ATOM 34068 H11S OL 855 56.018 86.521 52.823 1.00 0.00 H ATOM 34069 C112 OL 855 54.305 87.880 52.606 1.00 0.00 C ATOM 34070 H12R OL 855 53.884 87.336 51.757 1.00 0.00 H ATOM 34071 H12S OL 855 53.592 88.340 53.293 1.00 0.00 H ATOM 34072 C113 OL 855 55.225 89.000 52.126 1.00 0.00 C ATOM 34073 H13R OL 855 55.587 89.642 52.932 1.00 0.00 H ATOM 34074 H13S OL 855 56.098 88.526 51.674 1.00 0.00 H ATOM 34075 C114 OL 855 54.526 89.884 51.034 1.00 0.00 C ATOM 34076 H14R OL 855 54.372 89.231 50.173 1.00 0.00 H ATOM 34077 H14S OL 855 53.498 90.208 51.212 1.00 0.00 H ATOM 34078 C115 OL 855 55.283 91.208 50.714 1.00 0.00 C ATOM 34079 H15R OL 855 55.310 91.765 51.653 1.00 0.00 H ATOM 34080 H15S OL 855 56.280 90.897 50.395 1.00 0.00 H ATOM 34081 C116 OL 855 54.444 91.943 49.704 1.00 0.00 C ATOM 34082 H16R OL 855 54.327 91.414 48.756 1.00 0.00 H ATOM 34083 H16S OL 855 53.365 92.002 49.863 1.00 0.00 H ATOM 34084 C117 OL 855 55.019 93.363 49.412 1.00 0.00 C ATOM 34085 H17R OL 855 54.184 93.934 49.000 1.00 0.00 H ATOM 34086 H17S OL 855 55.352 93.881 50.314 1.00 0.00 H ATOM 34087 C118 OL 855 56.195 93.254 48.471 1.00 0.00 C ATOM 34088 H18R OL 855 55.908 92.746 47.548 1.00 0.00 H ATOM 34089 H18S OL 855 56.927 92.642 49.002 1.00 0.00 H ATOM 34090 H18T OL 855 56.543 94.273 48.290 1.00 0.00 H TER 34091 OL 855 ATOM 34091 C116 PA 856 29.147 122.067 42.551 1.00 0.00 C ATOM 34092 H16R PA 856 30.101 121.977 42.027 1.00 0.00 H ATOM 34093 H16S PA 856 28.956 123.097 42.244 1.00 0.00 H ATOM 34094 H16T PA 856 28.370 121.488 42.048 1.00 0.00 H ATOM 34095 C115 PA 856 29.107 121.733 44.138 1.00 0.00 C ATOM 34096 H15R PA 856 29.426 120.694 44.253 1.00 0.00 H ATOM 34097 H15S PA 856 28.068 121.697 44.471 1.00 0.00 H ATOM 34098 C114 PA 856 30.064 122.562 45.043 1.00 0.00 C ATOM 34099 H14R PA 856 29.808 122.231 46.052 1.00 0.00 H ATOM 34100 H14S PA 856 29.899 123.642 45.052 1.00 0.00 H ATOM 34101 C113 PA 856 31.512 122.288 44.706 1.00 0.00 C ATOM 34102 H13R PA 856 31.828 122.950 43.897 1.00 0.00 H ATOM 34103 H13S PA 856 31.614 121.253 44.373 1.00 0.00 H ATOM 34104 C112 PA 856 32.416 122.575 45.880 1.00 0.00 C ATOM 34105 H12R PA 856 32.289 123.617 46.183 1.00 0.00 H ATOM 34106 H12S PA 856 33.418 122.610 45.447 1.00 0.00 H ATOM 34107 C111 PA 856 32.310 121.563 47.040 1.00 0.00 C ATOM 34108 H11R PA 856 32.254 120.532 46.685 1.00 0.00 H ATOM 34109 H11S PA 856 31.375 121.768 47.566 1.00 0.00 H ATOM 34110 C110 PA 856 33.367 121.900 48.051 1.00 0.00 C ATOM 34111 H10R PA 856 33.082 122.914 48.341 1.00 0.00 H ATOM 34112 H10S PA 856 34.366 121.967 47.616 1.00 0.00 H ATOM 34113 C19 PA 856 33.350 121.009 49.314 1.00 0.00 C ATOM 34114 H9R PA 856 32.327 120.709 49.553 1.00 0.00 H ATOM 34115 H9S PA 856 33.713 121.578 50.173 1.00 0.00 H ATOM 34116 C18 PA 856 34.270 119.756 49.119 1.00 0.00 C ATOM 34117 H8R PA 856 35.313 120.066 49.026 1.00 0.00 H ATOM 34118 H8S PA 856 34.042 119.322 48.143 1.00 0.00 H ATOM 34119 C17 PA 856 34.039 118.587 50.084 1.00 0.00 C ATOM 34120 H7R PA 856 34.198 117.673 49.509 1.00 0.00 H ATOM 34121 H7S PA 856 32.992 118.615 50.393 1.00 0.00 H ATOM 34122 C16 PA 856 34.818 118.488 51.350 1.00 0.00 C ATOM 34123 H6R PA 856 35.838 118.217 51.067 1.00 0.00 H ATOM 34124 H6S PA 856 34.484 117.597 51.886 1.00 0.00 H ATOM 34125 C15 PA 856 35.041 119.848 52.093 1.00 0.00 C ATOM 34126 H5R PA 856 34.093 120.319 52.360 1.00 0.00 H ATOM 34127 H5S PA 856 35.347 120.644 51.412 1.00 0.00 H ATOM 34128 C14 PA 856 36.042 119.801 53.192 1.00 0.00 C ATOM 34129 H4R PA 856 37.065 119.740 52.813 1.00 0.00 H ATOM 34130 H4S PA 856 35.827 118.933 53.818 1.00 0.00 H ATOM 34131 C13 PA 856 36.065 120.917 54.244 1.00 0.00 C ATOM 34132 H3R PA 856 35.050 120.964 54.644 1.00 0.00 H ATOM 34133 H3S PA 856 36.198 121.852 53.697 1.00 0.00 H ATOM 34134 C12 PA 856 37.070 120.847 55.375 1.00 0.00 C ATOM 34135 H2R PA 856 38.076 120.989 54.973 1.00 0.00 H ATOM 34136 H2S PA 856 37.075 119.959 56.010 1.00 0.00 H ATOM 34137 C11 PGR 857 36.741 121.908 56.367 1.00 0.00 C ATOM 34138 O12 PGR 857 35.654 121.965 56.960 1.00 0.00 O ATOM 34139 O11 PGR 857 37.678 122.810 56.570 1.00 0.00 O ATOM 34140 C1 PGR 857 37.587 123.910 57.543 1.00 0.00 C ATOM 34141 HR PGR 857 36.597 124.305 57.302 1.00 0.00 H ATOM 34142 HS PGR 857 38.364 124.654 57.352 1.00 0.00 H ATOM 34143 C2 PGR 857 37.563 123.547 59.043 1.00 0.00 C ATOM 34144 HX PGR 857 36.905 122.685 59.183 1.00 0.00 H ATOM 34145 C3 PGR 857 37.073 124.769 59.800 1.00 0.00 C ATOM 34146 HA PGR 857 36.170 125.166 59.330 1.00 0.00 H ATOM 34147 HB PGR 857 37.864 125.524 59.797 1.00 0.00 H ATOM 34148 O31 PGR 857 36.873 124.535 61.188 1.00 0.00 O ATOM 34149 P31 PGR 857 36.223 125.448 62.257 1.00 0.00 P ATOM 34150 O32 PGR 857 34.604 125.205 62.032 1.00 0.00 O ATOM 34151 C31 PGR 857 33.677 125.856 62.865 1.00 0.00 C ATOM 34152 H1A PGR 857 33.732 126.934 62.694 1.00 0.00 H ATOM 34153 H1B PGR 857 33.880 125.669 63.923 1.00 0.00 H ATOM 34154 C32 PGR 857 32.272 125.345 62.460 1.00 0.00 C ATOM 34155 H2A PGR 857 32.156 125.665 61.421 1.00 0.00 H ATOM 34156 O35 PGR 857 32.198 123.887 62.576 1.00 0.00 O ATOM 34157 HO5A PGR 857 33.017 123.445 62.290 1.00 0.00 H ATOM 34158 C33 PGR 857 31.186 126.010 63.401 1.00 0.00 C ATOM 34159 H3A PGR 857 31.057 125.499 64.359 1.00 0.00 H ATOM 34160 H3B PGR 857 31.347 127.075 63.584 1.00 0.00 H ATOM 34161 O33 PGR 857 36.599 124.921 63.572 1.00 0.00 O ATOM 34162 O34 PGR 857 36.635 126.870 61.935 1.00 0.00 O ATOM 34163 O21 PGR 857 38.875 123.370 59.452 1.00 0.00 O ATOM 34164 C21 PGR 857 39.062 122.651 60.623 1.00 0.00 C ATOM 34165 O22 PGR 857 39.815 123.132 61.491 1.00 0.00 O ATOM 34166 O36 PGR 857 29.945 125.885 62.652 1.00 0.00 O ATOM 34167 HO6A PGR 857 29.323 126.429 63.168 1.00 0.00 H TER 34168 PGR 857 ATOM 34168 C12 OL 858 50.999 68.510 46.214 1.00 0.00 C ATOM 34169 H2R OL 858 51.666 68.413 47.073 1.00 0.00 H ATOM 34170 H2S OL 858 51.663 68.963 45.474 1.00 0.00 H ATOM 34171 C13 OL 858 50.386 67.223 45.742 1.00 0.00 C ATOM 34172 H3R OL 858 50.465 66.338 46.378 1.00 0.00 H ATOM 34173 H3S OL 858 49.342 67.523 45.635 1.00 0.00 H ATOM 34174 C14 OL 858 50.800 66.761 44.420 1.00 0.00 C ATOM 34175 H4R OL 858 50.909 67.528 43.650 1.00 0.00 H ATOM 34176 H4S OL 858 51.845 66.442 44.436 1.00 0.00 H ATOM 34177 C15 OL 858 49.894 65.582 43.863 1.00 0.00 C ATOM 34178 H5R OL 858 50.444 65.090 43.059 1.00 0.00 H ATOM 34179 H5S OL 858 49.880 64.857 44.679 1.00 0.00 H ATOM 34180 C16 OL 858 48.489 66.001 43.265 1.00 0.00 C ATOM 34181 H6R OL 858 47.882 66.507 44.019 1.00 0.00 H ATOM 34182 H6S OL 858 48.637 66.751 42.486 1.00 0.00 H ATOM 34183 C17 OL 858 47.917 64.715 42.647 1.00 0.00 C ATOM 34184 H7R OL 858 48.562 64.452 41.806 1.00 0.00 H ATOM 34185 H7S OL 858 47.942 63.829 43.285 1.00 0.00 H ATOM 34186 C18 OL 858 46.470 64.833 42.302 1.00 0.00 C ATOM 34187 H8R OL 858 45.989 64.566 43.245 1.00 0.00 H ATOM 34188 H8S OL 858 46.125 65.868 42.264 1.00 0.00 H ATOM 34189 C19 OL 858 45.915 63.940 41.281 1.00 0.00 C ATOM 34190 H9R OL 858 46.692 63.325 40.834 1.00 0.00 H ATOM 34191 C110 OL 858 44.657 63.794 40.923 1.00 0.00 C ATOM 34192 H10R OL 858 44.393 63.085 40.143 1.00 0.00 H ATOM 34193 C111 OL 858 43.470 64.476 41.534 1.00 0.00 C ATOM 34194 H11R OL 858 43.667 64.670 42.590 1.00 0.00 H ATOM 34195 H11S OL 858 43.303 65.451 41.072 1.00 0.00 H ATOM 34196 C112 OL 858 42.348 63.445 41.443 1.00 0.00 C ATOM 34197 H12R OL 858 42.690 62.480 41.823 1.00 0.00 H ATOM 34198 H12S OL 858 41.555 63.783 42.114 1.00 0.00 H ATOM 34199 C113 OL 858 41.647 63.207 40.082 1.00 0.00 C ATOM 34200 H13R OL 858 41.432 64.194 39.665 1.00 0.00 H ATOM 34201 H13S OL 858 42.285 62.710 39.349 1.00 0.00 H ATOM 34202 C114 OL 858 40.394 62.389 40.175 1.00 0.00 C ATOM 34203 H14R OL 858 40.652 61.332 40.267 1.00 0.00 H ATOM 34204 H14S OL 858 39.835 62.609 41.087 1.00 0.00 H ATOM 34205 C115 OL 858 39.557 62.587 38.961 1.00 0.00 C ATOM 34206 H15R OL 858 40.072 62.651 38.000 1.00 0.00 H ATOM 34207 H15S OL 858 38.902 61.744 38.734 1.00 0.00 H ATOM 34208 C116 OL 858 38.736 63.847 38.974 1.00 0.00 C ATOM 34209 H16R OL 858 38.252 63.925 39.950 1.00 0.00 H ATOM 34210 H16S OL 858 39.449 64.631 38.709 1.00 0.00 H ATOM 34211 C117 OL 858 37.552 63.757 37.972 1.00 0.00 C ATOM 34212 H17R OL 858 37.286 64.787 37.727 1.00 0.00 H ATOM 34213 H17S OL 858 37.835 63.431 36.969 1.00 0.00 H ATOM 34214 C118 OL 858 36.236 63.132 38.510 1.00 0.00 C ATOM 34215 H18R OL 858 36.064 63.622 39.471 1.00 0.00 H ATOM 34216 H18S OL 858 36.266 62.048 38.643 1.00 0.00 H ATOM 34217 H18T OL 858 35.441 63.342 37.793 1.00 0.00 H TER 34218 OL 858 ATOM 34218 C116 PA 859 48.611 112.283 38.240 1.00 0.00 C ATOM 34219 H16R PA 859 48.122 111.672 37.479 1.00 0.00 H ATOM 34220 H16S PA 859 48.177 112.188 39.238 1.00 0.00 H ATOM 34221 H16T PA 859 49.634 111.903 38.259 1.00 0.00 H ATOM 34222 C115 PA 859 48.478 113.814 37.915 1.00 0.00 C ATOM 34223 H15R PA 859 48.719 113.993 36.865 1.00 0.00 H ATOM 34224 H15S PA 859 49.082 114.436 38.578 1.00 0.00 H ATOM 34225 C114 PA 859 46.965 114.290 38.096 1.00 0.00 C ATOM 34226 H14R PA 859 46.420 113.391 38.391 1.00 0.00 H ATOM 34227 H14S PA 859 46.535 114.524 37.120 1.00 0.00 H ATOM 34228 C113 PA 859 46.774 115.437 39.021 1.00 0.00 C ATOM 34229 H13R PA 859 47.204 116.309 38.523 1.00 0.00 H ATOM 34230 H13S PA 859 47.303 115.190 39.943 1.00 0.00 H ATOM 34231 C112 PA 859 45.344 115.676 39.452 1.00 0.00 C ATOM 34232 H12R PA 859 44.969 114.772 39.934 1.00 0.00 H ATOM 34233 H12S PA 859 44.825 115.884 38.513 1.00 0.00 H ATOM 34234 C111 PA 859 45.036 116.795 40.444 1.00 0.00 C ATOM 34235 H11R PA 859 43.968 117.021 40.469 1.00 0.00 H ATOM 34236 H11S PA 859 45.418 117.705 39.975 1.00 0.00 H ATOM 34237 C110 PA 859 45.573 116.576 41.797 1.00 0.00 C ATOM 34238 H10R PA 859 46.635 116.319 41.790 1.00 0.00 H ATOM 34239 H10S PA 859 45.052 115.723 42.236 1.00 0.00 H ATOM 34240 C19 PA 859 45.496 117.856 42.622 1.00 0.00 C ATOM 34241 H9R PA 859 44.499 118.268 42.450 1.00 0.00 H ATOM 34242 H9S PA 859 46.208 118.564 42.193 1.00 0.00 H ATOM 34243 C18 PA 859 45.668 117.692 44.127 1.00 0.00 C ATOM 34244 H8R PA 859 44.780 117.225 44.557 1.00 0.00 H ATOM 34245 H8S PA 859 45.699 118.706 44.532 1.00 0.00 H ATOM 34246 C17 PA 859 46.846 116.804 44.627 1.00 0.00 C ATOM 34247 H7R PA 859 47.765 116.984 44.064 1.00 0.00 H ATOM 34248 H7S PA 859 46.609 115.758 44.417 1.00 0.00 H ATOM 34249 C16 PA 859 47.046 116.894 46.095 1.00 0.00 C ATOM 34250 H6R PA 859 46.186 116.485 46.628 1.00 0.00 H ATOM 34251 H6S PA 859 47.049 117.944 46.396 1.00 0.00 H ATOM 34252 C15 PA 859 48.348 116.306 46.571 1.00 0.00 C ATOM 34253 H5R PA 859 49.239 116.639 46.034 1.00 0.00 H ATOM 34254 H5S PA 859 48.319 115.219 46.471 1.00 0.00 H ATOM 34255 C14 PA 859 48.572 116.773 48.010 1.00 0.00 C ATOM 34256 H4R PA 859 47.632 116.772 48.565 1.00 0.00 H ATOM 34257 H4S PA 859 48.910 117.812 47.997 1.00 0.00 H ATOM 34258 C13 PA 859 49.513 115.855 48.832 1.00 0.00 C ATOM 34259 H3R PA 859 49.372 116.142 49.876 1.00 0.00 H ATOM 34260 H3S PA 859 50.547 115.999 48.512 1.00 0.00 H ATOM 34261 C12 PA 859 49.200 114.387 48.980 1.00 0.00 C ATOM 34262 H2R PA 859 49.663 113.839 48.156 1.00 0.00 H ATOM 34263 H2S PA 859 48.110 114.327 48.950 1.00 0.00 H ATOM 34264 C11 PGR 860 49.761 113.897 50.234 1.00 0.00 C ATOM 34265 O12 PGR 860 50.789 113.274 50.184 1.00 0.00 O ATOM 34266 O11 PGR 860 49.024 114.220 51.338 1.00 0.00 O ATOM 34267 C1 PGR 860 49.768 114.017 52.557 1.00 0.00 C ATOM 34268 HR PGR 860 50.579 114.749 52.517 1.00 0.00 H ATOM 34269 HS PGR 860 50.143 112.995 52.459 1.00 0.00 H ATOM 34270 C2 PGR 860 48.806 114.266 53.726 1.00 0.00 C ATOM 34271 HX PGR 860 48.084 115.051 53.486 1.00 0.00 H ATOM 34272 C3 PGR 860 49.441 114.675 55.055 1.00 0.00 C ATOM 34273 HA PGR 860 50.159 115.463 54.813 1.00 0.00 H ATOM 34274 HB PGR 860 50.108 113.935 55.504 1.00 0.00 H ATOM 34275 O31 PGR 860 48.462 115.198 55.903 1.00 0.00 O ATOM 34276 P31 PGR 860 48.811 115.710 57.361 1.00 0.00 P ATOM 34277 O32 PGR 860 49.562 117.100 57.137 1.00 0.00 O ATOM 34278 C31 PGR 860 50.974 117.188 57.154 1.00 0.00 C ATOM 34279 H1A PGR 860 51.411 116.700 56.280 1.00 0.00 H ATOM 34280 H1B PGR 860 51.469 116.915 58.089 1.00 0.00 H ATOM 34281 C32 PGR 860 51.233 118.726 56.985 1.00 0.00 C ATOM 34282 H2A PGR 860 50.529 119.200 56.297 1.00 0.00 H ATOM 34283 O35 PGR 860 51.356 119.358 58.293 1.00 0.00 O ATOM 34284 HO5A PGR 860 50.450 119.237 58.630 1.00 0.00 H ATOM 34285 C33 PGR 860 52.609 118.850 56.296 1.00 0.00 C ATOM 34286 H3A PGR 860 53.381 118.643 57.042 1.00 0.00 H ATOM 34287 H3B PGR 860 52.673 118.119 55.486 1.00 0.00 H ATOM 34288 O33 PGR 860 47.562 115.986 58.101 1.00 0.00 O ATOM 34289 O34 PGR 860 49.808 114.713 57.951 1.00 0.00 O ATOM 34290 O21 PGR 860 48.263 112.922 54.055 1.00 0.00 O ATOM 34291 C21 PGR 860 47.101 112.557 53.412 1.00 0.00 C ATOM 34292 O22 PGR 860 46.578 113.324 52.567 1.00 0.00 O ATOM 34293 O36 PGR 860 52.721 120.194 55.802 1.00 0.00 O ATOM 34294 HO6A PGR 860 52.637 120.757 56.593 1.00 0.00 H ATOM 34295 C12 OL 861 46.751 111.106 53.718 1.00 0.00 C ATOM 34296 H2R OL 861 47.493 110.428 53.291 1.00 0.00 H ATOM 34297 H2S OL 861 46.840 111.010 54.802 1.00 0.00 H ATOM 34298 C13 OL 861 45.303 110.714 53.504 1.00 0.00 C ATOM 34299 H3R OL 861 45.156 109.773 54.040 1.00 0.00 H ATOM 34300 H3S OL 861 44.811 111.475 54.114 1.00 0.00 H ATOM 34301 C14 OL 861 44.751 110.601 52.086 1.00 0.00 C ATOM 34302 H4R OL 861 44.856 111.513 51.494 1.00 0.00 H ATOM 34303 H4S OL 861 45.403 109.925 51.529 1.00 0.00 H ATOM 34304 C15 OL 861 43.297 110.135 52.123 1.00 0.00 C ATOM 34305 H5R OL 861 43.236 109.280 52.800 1.00 0.00 H ATOM 34306 H5S OL 861 42.769 111.003 52.525 1.00 0.00 H ATOM 34307 C16 OL 861 42.701 109.741 50.755 1.00 0.00 C ATOM 34308 H6R OL 861 41.894 109.008 50.822 1.00 0.00 H ATOM 34309 H6S OL 861 42.057 110.538 50.377 1.00 0.00 H ATOM 34310 C17 OL 861 43.732 109.248 49.730 1.00 0.00 C ATOM 34311 H7R OL 861 44.387 110.110 49.589 1.00 0.00 H ATOM 34312 H7S OL 861 44.321 108.479 50.234 1.00 0.00 H ATOM 34313 C18 OL 861 43.241 108.773 48.376 1.00 0.00 C ATOM 34314 H8R OL 861 42.890 107.744 48.469 1.00 0.00 H ATOM 34315 H8S OL 861 42.389 109.358 48.022 1.00 0.00 H ATOM 34316 C19 OL 861 44.281 108.615 47.272 1.00 0.00 C ATOM 34317 H9R OL 861 45.245 108.218 47.581 1.00 0.00 H ATOM 34318 C110 OL 861 43.991 108.882 45.960 1.00 0.00 C ATOM 34319 H10R OL 861 44.763 108.689 45.219 1.00 0.00 H ATOM 34320 C111 OL 861 42.688 109.315 45.327 1.00 0.00 C ATOM 34321 H11R OL 861 42.275 110.273 45.649 1.00 0.00 H ATOM 34322 H11S OL 861 42.999 109.726 44.364 1.00 0.00 H ATOM 34323 C112 OL 861 41.636 108.208 45.222 1.00 0.00 C ATOM 34324 H12R OL 861 42.027 107.389 44.614 1.00 0.00 H ATOM 34325 H12S OL 861 41.453 107.811 46.222 1.00 0.00 H ATOM 34326 C113 OL 861 40.278 108.637 44.621 1.00 0.00 C ATOM 34327 H13R OL 861 39.665 109.272 45.264 1.00 0.00 H ATOM 34328 H13S OL 861 40.516 109.176 43.702 1.00 0.00 H ATOM 34329 C114 OL 861 39.244 107.562 44.285 1.00 0.00 C ATOM 34330 H14R OL 861 39.046 107.133 45.270 1.00 0.00 H ATOM 34331 H14S OL 861 38.312 107.944 43.862 1.00 0.00 H ATOM 34332 C115 OL 861 39.830 106.371 43.571 1.00 0.00 C ATOM 34333 H15R OL 861 40.520 106.811 42.847 1.00 0.00 H ATOM 34334 H15S OL 861 40.474 105.747 44.193 1.00 0.00 H ATOM 34335 C116 OL 861 38.664 105.413 43.129 1.00 0.00 C ATOM 34336 H16R OL 861 38.076 105.706 42.256 1.00 0.00 H ATOM 34337 H16S OL 861 39.218 104.567 42.717 1.00 0.00 H ATOM 34338 C117 OL 861 37.732 104.969 44.302 1.00 0.00 C ATOM 34339 H17R OL 861 37.427 105.891 44.802 1.00 0.00 H ATOM 34340 H17S OL 861 36.842 104.458 43.929 1.00 0.00 H ATOM 34341 C118 OL 861 38.504 103.997 45.222 1.00 0.00 C ATOM 34342 H18R OL 861 39.399 104.491 45.608 1.00 0.00 H ATOM 34343 H18S OL 861 38.692 103.132 44.584 1.00 0.00 H ATOM 34344 H18T OL 861 37.995 103.623 46.113 1.00 0.00 H TER 34345 OL 861 ATOM 34345 C116 PA 862 101.516 14.838 39.784 1.00 0.00 C ATOM 34346 H16R PA 862 101.649 14.571 38.733 1.00 0.00 H ATOM 34347 H16S PA 862 102.291 15.538 40.101 1.00 0.00 H ATOM 34348 H16T PA 862 100.563 15.359 39.897 1.00 0.00 H ATOM 34349 C115 PA 862 101.485 13.537 40.603 1.00 0.00 C ATOM 34350 H15R PA 862 102.396 12.985 40.363 1.00 0.00 H ATOM 34351 H15S PA 862 100.678 13.010 40.090 1.00 0.00 H ATOM 34352 C114 PA 862 101.204 13.791 42.117 1.00 0.00 C ATOM 34353 H14R PA 862 100.320 14.413 42.270 1.00 0.00 H ATOM 34354 H14S PA 862 102.070 14.397 42.393 1.00 0.00 H ATOM 34355 C113 PA 862 101.212 12.616 43.036 1.00 0.00 C ATOM 34356 H13R PA 862 101.397 12.805 44.095 1.00 0.00 H ATOM 34357 H13S PA 862 102.190 12.207 42.776 1.00 0.00 H ATOM 34358 C112 PA 862 99.959 11.655 42.915 1.00 0.00 C ATOM 34359 H12R PA 862 99.956 11.344 41.869 1.00 0.00 H ATOM 34360 H12S PA 862 99.021 12.116 43.231 1.00 0.00 H ATOM 34361 C111 PA 862 99.893 10.365 43.803 1.00 0.00 C ATOM 34362 H11R PA 862 99.021 9.817 43.440 1.00 0.00 H ATOM 34363 H11S PA 862 99.825 10.599 44.867 1.00 0.00 H ATOM 34364 C110 PA 862 101.056 9.412 43.688 1.00 0.00 C ATOM 34365 H10R PA 862 102.004 9.924 43.868 1.00 0.00 H ATOM 34366 H10S PA 862 101.110 9.025 42.668 1.00 0.00 H ATOM 34367 C19 PA 862 100.884 8.156 44.460 1.00 0.00 C ATOM 34368 H9R PA 862 101.687 7.495 44.128 1.00 0.00 H ATOM 34369 H9S PA 862 100.088 7.570 43.997 1.00 0.00 H ATOM 34370 C18 PA 862 100.947 8.343 45.945 1.00 0.00 C ATOM 34371 H8R PA 862 99.919 8.265 46.306 1.00 0.00 H ATOM 34372 H8S PA 862 101.331 9.354 46.094 1.00 0.00 H ATOM 34373 C17 PA 862 101.788 7.280 46.614 1.00 0.00 C ATOM 34374 H7R PA 862 102.747 7.255 46.093 1.00 0.00 H ATOM 34375 H7S PA 862 101.338 6.290 46.507 1.00 0.00 H ATOM 34376 C16 PA 862 101.829 7.639 48.092 1.00 0.00 C ATOM 34377 H6R PA 862 101.011 7.169 48.643 1.00 0.00 H ATOM 34378 H6S PA 862 101.853 8.726 48.191 1.00 0.00 H ATOM 34379 C15 PA 862 103.144 7.209 48.728 1.00 0.00 C ATOM 34380 H5R PA 862 104.037 7.450 48.147 1.00 0.00 H ATOM 34381 H5S PA 862 103.057 6.121 48.772 1.00 0.00 H ATOM 34382 C14 PA 862 103.417 7.732 50.147 1.00 0.00 C ATOM 34383 H4R PA 862 102.727 7.321 50.887 1.00 0.00 H ATOM 34384 H4S PA 862 103.113 8.781 50.138 1.00 0.00 H ATOM 34385 C13 PA 862 104.872 7.761 50.618 1.00 0.00 C ATOM 34386 H3R PA 862 105.034 8.198 51.606 1.00 0.00 H ATOM 34387 H3S PA 862 105.408 8.405 49.917 1.00 0.00 H ATOM 34388 C12 PA 862 105.585 6.384 50.603 1.00 0.00 C ATOM 34389 H2R PA 862 105.568 6.053 49.562 1.00 0.00 H ATOM 34390 H2S PA 862 104.830 5.702 51.001 1.00 0.00 H ATOM 34391 C11 PGR 863 106.968 6.283 51.177 1.00 0.00 C ATOM 34392 O12 PGR 863 107.801 5.434 50.927 1.00 0.00 O ATOM 34393 O11 PGR 863 107.174 7.305 52.002 1.00 0.00 O ATOM 34394 C1 PGR 863 108.473 7.396 52.702 1.00 0.00 C ATOM 34395 HR PGR 863 109.179 7.350 51.869 1.00 0.00 H ATOM 34396 HS PGR 863 108.608 6.505 53.322 1.00 0.00 H ATOM 34397 C2 PGR 863 108.598 8.560 53.698 1.00 0.00 C ATOM 34398 HX PGR 863 109.493 8.632 54.321 1.00 0.00 H ATOM 34399 C3 PGR 863 107.347 8.508 54.620 1.00 0.00 C ATOM 34400 HA PGR 863 107.429 7.646 55.287 1.00 0.00 H ATOM 34401 HB PGR 863 106.418 8.463 54.045 1.00 0.00 H ATOM 34402 O31 PGR 863 107.379 9.633 55.437 1.00 0.00 O ATOM 34403 P31 PGR 863 106.235 10.276 56.341 1.00 0.00 P ATOM 34404 O32 PGR 863 105.397 11.061 55.288 1.00 0.00 O ATOM 34405 C31 PGR 863 105.583 12.486 55.142 1.00 0.00 C ATOM 34406 H1A PGR 863 106.642 12.587 54.894 1.00 0.00 H ATOM 34407 H1B PGR 863 105.230 12.938 56.073 1.00 0.00 H ATOM 34408 C32 PGR 863 104.838 13.017 53.986 1.00 0.00 C ATOM 34409 H2A PGR 863 105.209 14.045 53.946 1.00 0.00 H ATOM 34410 O35 PGR 863 103.419 13.099 54.343 1.00 0.00 O ATOM 34411 HO5A PGR 863 103.013 13.436 53.524 1.00 0.00 H ATOM 34412 C33 PGR 863 105.086 12.164 52.740 1.00 0.00 C ATOM 34413 H3A PGR 863 106.040 11.647 52.872 1.00 0.00 H ATOM 34414 H3B PGR 863 104.337 11.369 52.745 1.00 0.00 H ATOM 34415 O33 PGR 863 105.438 9.120 56.843 1.00 0.00 O ATOM 34416 O34 PGR 863 106.845 11.137 57.344 1.00 0.00 O ATOM 34417 O21 PGR 863 108.654 9.858 52.901 1.00 0.00 O ATOM 34418 C21 PGR 863 109.787 10.088 52.172 1.00 0.00 C ATOM 34419 O22 PGR 863 110.684 9.288 52.131 1.00 0.00 O ATOM 34420 O36 PGR 863 105.008 12.940 51.490 1.00 0.00 O ATOM 34421 HO6A PGR 863 105.733 13.586 51.422 1.00 0.00 H ATOM 34422 C12 OL 864 109.914 11.447 51.444 1.00 0.00 C ATOM 34423 H2R OL 864 110.473 12.125 52.091 1.00 0.00 H ATOM 34424 H2S OL 864 110.668 11.189 50.698 1.00 0.00 H ATOM 34425 C13 OL 864 108.656 12.110 50.932 1.00 0.00 C ATOM 34426 H3R OL 864 108.111 12.548 51.770 1.00 0.00 H ATOM 34427 H3S OL 864 108.959 12.967 50.326 1.00 0.00 H ATOM 34428 C14 OL 864 107.643 11.227 50.210 1.00 0.00 C ATOM 34429 H4R OL 864 106.955 10.674 50.852 1.00 0.00 H ATOM 34430 H4S OL 864 106.909 11.929 49.808 1.00 0.00 H ATOM 34431 C15 OL 864 108.332 10.510 49.101 1.00 0.00 C ATOM 34432 H5R OL 864 109.029 11.227 48.663 1.00 0.00 H ATOM 34433 H5S OL 864 108.899 9.684 49.534 1.00 0.00 H ATOM 34434 C16 OL 864 107.367 10.065 48.057 1.00 0.00 C ATOM 34435 H6R OL 864 106.518 9.597 48.560 1.00 0.00 H ATOM 34436 H6S OL 864 107.003 10.928 47.495 1.00 0.00 H ATOM 34437 C17 OL 864 108.017 9.097 46.997 1.00 0.00 C ATOM 34438 H7R OL 864 108.890 9.563 46.536 1.00 0.00 H ATOM 34439 H7S OL 864 108.383 8.218 47.531 1.00 0.00 H ATOM 34440 C18 OL 864 107.108 8.783 45.820 1.00 0.00 C ATOM 34441 H8R OL 864 106.235 8.306 46.270 1.00 0.00 H ATOM 34442 H8S OL 864 106.855 9.779 45.449 1.00 0.00 H ATOM 34443 C19 OL 864 107.875 7.969 44.909 1.00 0.00 C ATOM 34444 H9R OL 864 108.200 7.008 45.298 1.00 0.00 H ATOM 34445 C110 OL 864 108.161 8.375 43.629 1.00 0.00 C ATOM 34446 H10R OL 864 108.750 7.723 42.988 1.00 0.00 H ATOM 34447 C111 OL 864 107.918 9.745 43.084 1.00 0.00 C ATOM 34448 H11R OL 864 108.022 9.699 41.998 1.00 0.00 H ATOM 34449 H11S OL 864 106.907 10.117 43.266 1.00 0.00 H ATOM 34450 C112 OL 864 108.957 10.812 43.641 1.00 0.00 C ATOM 34451 H12R OL 864 108.779 11.863 43.404 1.00 0.00 H ATOM 34452 H12S OL 864 108.873 10.675 44.721 1.00 0.00 H ATOM 34453 C113 OL 864 110.426 10.358 43.179 1.00 0.00 C ATOM 34454 H13R OL 864 110.594 9.341 43.540 1.00 0.00 H ATOM 34455 H13S OL 864 110.384 10.148 42.109 1.00 0.00 H ATOM 34456 C114 OL 864 111.519 11.316 43.586 1.00 0.00 C ATOM 34457 H14R OL 864 111.424 11.591 44.638 1.00 0.00 H ATOM 34458 H14S OL 864 112.436 10.727 43.519 1.00 0.00 H ATOM 34459 C115 OL 864 111.681 12.503 42.670 1.00 0.00 C ATOM 34460 H15R OL 864 112.076 12.098 41.736 1.00 0.00 H ATOM 34461 H15S OL 864 110.745 12.969 42.357 1.00 0.00 H ATOM 34462 C116 OL 864 112.712 13.490 43.240 1.00 0.00 C ATOM 34463 H16R OL 864 112.718 13.558 44.330 1.00 0.00 H ATOM 34464 H16S OL 864 113.775 13.288 43.090 1.00 0.00 H ATOM 34465 C117 OL 864 112.462 14.944 42.625 1.00 0.00 C ATOM 34466 H17R OL 864 111.493 15.281 43.000 1.00 0.00 H ATOM 34467 H17S OL 864 113.108 15.698 43.079 1.00 0.00 H ATOM 34468 C118 OL 864 112.603 14.953 41.144 1.00 0.00 C ATOM 34469 H18R OL 864 111.857 14.360 40.611 1.00 0.00 H ATOM 34470 H18S OL 864 113.608 14.614 40.882 1.00 0.00 H ATOM 34471 H18T OL 864 112.470 15.967 40.762 1.00 0.00 H TER 34472 OL 864 ATOM 34472 C116 PA 865 60.455 114.276 46.503 1.00 0.00 C ATOM 34473 H16R PA 865 59.926 113.321 46.505 1.00 0.00 H ATOM 34474 H16S PA 865 59.936 114.890 45.764 1.00 0.00 H ATOM 34475 H16T PA 865 60.349 114.781 47.466 1.00 0.00 H ATOM 34476 C115 PA 865 61.913 114.140 46.053 1.00 0.00 C ATOM 34477 H15R PA 865 61.949 113.223 45.462 1.00 0.00 H ATOM 34478 H15S PA 865 62.634 113.943 46.849 1.00 0.00 H ATOM 34479 C114 PA 865 62.571 115.142 45.115 1.00 0.00 C ATOM 34480 H14R PA 865 62.091 115.114 44.135 1.00 0.00 H ATOM 34481 H14S PA 865 63.528 114.707 44.818 1.00 0.00 H ATOM 34482 C113 PA 865 62.615 116.574 45.547 1.00 0.00 C ATOM 34483 H13R PA 865 63.085 116.747 46.518 1.00 0.00 H ATOM 34484 H13S PA 865 61.606 116.957 45.711 1.00 0.00 H ATOM 34485 C112 PA 865 63.212 117.422 44.402 1.00 0.00 C ATOM 34486 H12R PA 865 62.618 117.048 43.565 1.00 0.00 H ATOM 34487 H12S PA 865 64.206 117.061 44.129 1.00 0.00 H ATOM 34488 C111 PA 865 63.094 118.906 44.624 1.00 0.00 C ATOM 34489 H11R PA 865 62.043 119.068 44.873 1.00 0.00 H ATOM 34490 H11S PA 865 63.134 119.313 43.611 1.00 0.00 H ATOM 34491 C110 PA 865 64.105 119.530 45.552 1.00 0.00 C ATOM 34492 H10R PA 865 64.106 119.057 46.536 1.00 0.00 H ATOM 34493 H10S PA 865 63.757 120.549 45.736 1.00 0.00 H ATOM 34494 C19 PA 865 65.534 119.567 45.145 1.00 0.00 C ATOM 34495 H9R PA 865 65.620 120.149 44.224 1.00 0.00 H ATOM 34496 H9S PA 865 65.994 118.584 45.026 1.00 0.00 H ATOM 34497 C18 PA 865 66.409 120.139 46.224 1.00 0.00 C ATOM 34498 H8R PA 865 66.304 119.498 47.102 1.00 0.00 H ATOM 34499 H8S PA 865 66.085 121.168 46.390 1.00 0.00 H ATOM 34500 C17 PA 865 67.883 120.195 45.822 1.00 0.00 C ATOM 34501 H7R PA 865 67.974 121.067 45.172 1.00 0.00 H ATOM 34502 H7S PA 865 68.182 119.263 45.337 1.00 0.00 H ATOM 34503 C16 PA 865 68.884 120.358 46.893 1.00 0.00 C ATOM 34504 H6R PA 865 68.573 121.180 47.542 1.00 0.00 H ATOM 34505 H6S PA 865 69.832 120.822 46.613 1.00 0.00 H ATOM 34506 C15 PA 865 69.030 119.165 47.834 1.00 0.00 C ATOM 34507 H5R PA 865 68.902 118.218 47.306 1.00 0.00 H ATOM 34508 H5S PA 865 68.178 119.188 48.517 1.00 0.00 H ATOM 34509 C14 PA 865 70.315 119.141 48.678 1.00 0.00 C ATOM 34510 H4R PA 865 71.216 119.125 48.061 1.00 0.00 H ATOM 34511 H4S PA 865 70.305 118.213 49.252 1.00 0.00 H ATOM 34512 C13 PA 865 70.472 120.356 49.667 1.00 0.00 C ATOM 34513 H3R PA 865 70.488 121.201 48.976 1.00 0.00 H ATOM 34514 H3S PA 865 71.513 120.416 49.993 1.00 0.00 H ATOM 34515 C12 PA 865 69.501 120.411 50.784 1.00 0.00 C ATOM 34516 H2R PA 865 69.661 119.637 51.537 1.00 0.00 H ATOM 34517 H2S PA 865 68.500 120.227 50.387 1.00 0.00 H ATOM 34518 C11 PGR 866 69.487 121.714 51.590 1.00 0.00 C ATOM 34519 O12 PGR 866 68.853 121.790 52.624 1.00 0.00 O ATOM 34520 O11 PGR 866 70.133 122.746 51.002 1.00 0.00 O ATOM 34521 C1 PGR 866 70.158 124.013 51.709 1.00 0.00 C ATOM 34522 HR PGR 866 69.237 124.278 52.235 1.00 0.00 H ATOM 34523 HS PGR 866 70.408 124.790 50.982 1.00 0.00 H ATOM 34524 C2 PGR 866 71.172 123.960 52.937 1.00 0.00 C ATOM 34525 HX PGR 866 70.876 123.132 53.586 1.00 0.00 H ATOM 34526 C3 PGR 866 71.091 125.246 53.766 1.00 0.00 C ATOM 34527 HA PGR 866 70.208 125.801 53.436 1.00 0.00 H ATOM 34528 HB PGR 866 71.965 125.771 53.373 1.00 0.00 H ATOM 34529 O31 PGR 866 71.041 125.038 55.173 1.00 0.00 O ATOM 34530 P31 PGR 866 70.770 126.399 56.044 1.00 0.00 P ATOM 34531 O32 PGR 866 72.183 126.924 56.313 1.00 0.00 O ATOM 34532 C31 PGR 866 72.990 126.441 57.372 1.00 0.00 C ATOM 34533 H1A PGR 866 72.983 125.348 57.386 1.00 0.00 H ATOM 34534 H1B PGR 866 72.658 126.785 58.355 1.00 0.00 H ATOM 34535 C32 PGR 866 74.466 126.917 57.171 1.00 0.00 C ATOM 34536 H2A PGR 866 75.146 126.372 57.831 1.00 0.00 H ATOM 34537 O35 PGR 866 74.558 128.351 57.458 1.00 0.00 O ATOM 34538 HO5A PGR 866 73.693 128.797 57.410 1.00 0.00 H ATOM 34539 C33 PGR 866 74.848 126.677 55.722 1.00 0.00 C ATOM 34540 H3A PGR 866 75.930 126.637 55.570 1.00 0.00 H ATOM 34541 H3B PGR 866 74.411 125.735 55.381 1.00 0.00 H ATOM 34542 O33 PGR 866 70.002 127.351 55.177 1.00 0.00 O ATOM 34543 O34 PGR 866 70.113 125.954 57.266 1.00 0.00 O ATOM 34544 O21 PGR 866 72.533 123.807 52.318 1.00 0.00 O ATOM 34545 C21 PGR 866 72.972 122.559 52.218 1.00 0.00 C ATOM 34546 O22 PGR 866 72.466 121.524 52.524 1.00 0.00 O ATOM 34547 O36 PGR 866 74.399 127.735 54.871 1.00 0.00 O ATOM 34548 HO6A PGR 866 73.475 127.851 55.157 1.00 0.00 H ATOM 34549 C12 OL 867 74.355 122.387 51.669 1.00 0.00 C ATOM 34550 H2R OL 867 74.955 123.262 51.926 1.00 0.00 H ATOM 34551 H2S OL 867 74.844 121.523 52.125 1.00 0.00 H ATOM 34552 C13 OL 867 74.250 122.222 50.161 1.00 0.00 C ATOM 34553 H3R OL 867 73.610 121.374 49.908 1.00 0.00 H ATOM 34554 H3S OL 867 73.876 123.175 49.783 1.00 0.00 H ATOM 34555 C14 OL 867 75.595 121.874 49.421 1.00 0.00 C ATOM 34556 H4R OL 867 75.833 120.836 49.659 1.00 0.00 H ATOM 34557 H4S OL 867 75.417 121.946 48.346 1.00 0.00 H ATOM 34558 C15 OL 867 76.726 122.822 49.787 1.00 0.00 C ATOM 34559 H5R OL 867 77.046 122.723 50.827 1.00 0.00 H ATOM 34560 H5S OL 867 77.643 122.582 49.245 1.00 0.00 H ATOM 34561 C16 OL 867 76.502 124.275 49.381 1.00 0.00 C ATOM 34562 H6R OL 867 76.423 124.159 48.298 1.00 0.00 H ATOM 34563 H6S OL 867 75.588 124.709 49.791 1.00 0.00 H ATOM 34564 C17 OL 867 77.876 125.086 49.598 1.00 0.00 C ATOM 34565 H7R OL 867 78.256 125.356 50.586 1.00 0.00 H ATOM 34566 H7S OL 867 78.723 124.537 49.182 1.00 0.00 H ATOM 34567 C18 OL 867 77.930 126.451 48.857 1.00 0.00 C ATOM 34568 H8R OL 867 78.843 126.972 49.152 1.00 0.00 H ATOM 34569 H8S OL 867 78.050 126.143 47.817 1.00 0.00 H ATOM 34570 C19 OL 867 76.813 127.435 49.133 1.00 0.00 C ATOM 34571 H9R OL 867 76.635 127.881 50.108 1.00 0.00 H ATOM 34572 C110 OL 867 75.987 127.825 48.136 1.00 0.00 C ATOM 34573 H10R OL 867 75.070 128.403 48.219 1.00 0.00 H ATOM 34574 C111 OL 867 75.947 127.523 46.625 1.00 0.00 C ATOM 34575 H11R OL 867 76.080 126.463 46.396 1.00 0.00 H ATOM 34576 H11S OL 867 74.954 127.673 46.195 1.00 0.00 H ATOM 34577 C112 OL 867 76.995 128.279 45.749 1.00 0.00 C ATOM 34578 H12R OL 867 77.028 129.341 45.999 1.00 0.00 H ATOM 34579 H12S OL 867 78.021 128.006 46.004 1.00 0.00 H ATOM 34580 C113 OL 867 76.620 128.113 44.289 1.00 0.00 C ATOM 34581 H13R OL 867 77.527 128.354 43.731 1.00 0.00 H ATOM 34582 H13S OL 867 76.434 127.045 44.156 1.00 0.00 H ATOM 34583 C114 OL 867 75.377 128.893 43.778 1.00 0.00 C ATOM 34584 H14R OL 867 74.611 128.674 44.526 1.00 0.00 H ATOM 34585 H14S OL 867 75.783 129.903 43.865 1.00 0.00 H ATOM 34586 C115 OL 867 74.841 128.470 42.420 1.00 0.00 C ATOM 34587 H15R OL 867 74.290 127.527 42.455 1.00 0.00 H ATOM 34588 H15S OL 867 74.303 129.388 42.174 1.00 0.00 H ATOM 34589 C116 OL 867 75.870 128.417 41.365 1.00 0.00 C ATOM 34590 H16R OL 867 76.236 129.441 41.266 1.00 0.00 H ATOM 34591 H16S OL 867 76.730 127.765 41.533 1.00 0.00 H ATOM 34592 C117 OL 867 75.183 128.100 39.984 1.00 0.00 C ATOM 34593 H17R OL 867 74.962 127.032 39.924 1.00 0.00 H ATOM 34594 H17S OL 867 74.169 128.506 39.991 1.00 0.00 H ATOM 34595 C118 OL 867 75.956 128.561 38.779 1.00 0.00 C ATOM 34596 H18R OL 867 75.936 129.652 38.728 1.00 0.00 H ATOM 34597 H18S OL 867 75.441 128.235 37.873 1.00 0.00 H ATOM 34598 H18T OL 867 76.941 128.091 38.755 1.00 0.00 H TER 34599 OL 867 ATOM 34599 C116 PA 868 8.853 93.117 37.897 1.00 0.00 C ATOM 34600 H16R PA 868 8.341 92.203 37.590 1.00 0.00 H ATOM 34601 H16S PA 868 9.705 93.257 37.229 1.00 0.00 H ATOM 34602 H16T PA 868 8.280 94.038 37.771 1.00 0.00 H ATOM 34603 C115 PA 868 9.194 93.032 39.409 1.00 0.00 C ATOM 34604 H15R PA 868 8.260 93.117 39.967 1.00 0.00 H ATOM 34605 H15S PA 868 9.811 93.837 39.814 1.00 0.00 H ATOM 34606 C114 PA 868 9.869 91.729 39.770 1.00 0.00 C ATOM 34607 H14R PA 868 10.849 91.743 39.287 1.00 0.00 H ATOM 34608 H14S PA 868 9.358 90.943 39.208 1.00 0.00 H ATOM 34609 C113 PA 868 9.940 91.444 41.275 1.00 0.00 C ATOM 34610 H13R PA 868 10.371 90.442 41.334 1.00 0.00 H ATOM 34611 H13S PA 868 8.912 91.247 41.588 1.00 0.00 H ATOM 34612 C112 PA 868 10.722 92.537 42.145 1.00 0.00 C ATOM 34613 H12R PA 868 10.106 93.436 42.081 1.00 0.00 H ATOM 34614 H12S PA 868 11.704 92.699 41.696 1.00 0.00 H ATOM 34615 C111 PA 868 10.769 92.116 43.587 1.00 0.00 C ATOM 34616 H11R PA 868 11.471 91.298 43.759 1.00 0.00 H ATOM 34617 H11S PA 868 9.822 91.712 43.951 1.00 0.00 H ATOM 34618 C110 PA 868 11.472 93.083 44.565 1.00 0.00 C ATOM 34619 H10R PA 868 11.081 94.101 44.518 1.00 0.00 H ATOM 34620 H10S PA 868 12.549 93.146 44.393 1.00 0.00 H ATOM 34621 C19 PA 868 11.325 92.608 46.100 1.00 0.00 C ATOM 34622 H9R PA 868 11.893 91.686 46.245 1.00 0.00 H ATOM 34623 H9S PA 868 10.279 92.314 46.216 1.00 0.00 H ATOM 34624 C18 PA 868 11.714 93.712 47.075 1.00 0.00 C ATOM 34625 H8R PA 868 10.969 94.509 47.130 1.00 0.00 H ATOM 34626 H8S PA 868 12.562 94.323 46.757 1.00 0.00 H ATOM 34627 C17 PA 868 11.961 93.249 48.535 1.00 0.00 C ATOM 34628 H7R PA 868 11.112 92.676 48.914 1.00 0.00 H ATOM 34629 H7S PA 868 11.950 94.168 49.124 1.00 0.00 H ATOM 34630 C16 PA 868 13.285 92.441 48.922 1.00 0.00 C ATOM 34631 H6R PA 868 14.153 93.098 48.836 1.00 0.00 H ATOM 34632 H6S PA 868 13.453 91.634 48.206 1.00 0.00 H ATOM 34633 C15 PA 868 13.082 91.864 50.314 1.00 0.00 C ATOM 34634 H5R PA 868 14.088 91.506 50.544 1.00 0.00 H ATOM 34635 H5S PA 868 12.410 91.004 50.328 1.00 0.00 H ATOM 34636 C14 PA 868 12.730 92.745 51.516 1.00 0.00 C ATOM 34637 H4R PA 868 11.657 92.924 51.614 1.00 0.00 H ATOM 34638 H4S PA 868 13.324 93.660 51.516 1.00 0.00 H ATOM 34639 C13 PA 868 13.084 91.896 52.804 1.00 0.00 C ATOM 34640 H3R PA 868 14.150 91.738 52.979 1.00 0.00 H ATOM 34641 H3S PA 868 12.662 90.888 52.794 1.00 0.00 H ATOM 34642 C12 PA 868 12.609 92.655 54.048 1.00 0.00 C ATOM 34643 H2R PA 868 11.518 92.638 54.094 1.00 0.00 H ATOM 34644 H2S PA 868 13.042 93.656 54.001 1.00 0.00 H ATOM 34645 C11 PC 869 13.141 92.036 55.336 1.00 0.00 C ATOM 34646 O12 PC 869 12.903 90.940 55.811 1.00 0.00 O ATOM 34647 O11 PC 869 13.928 92.920 55.973 1.00 0.00 O ATOM 34648 C1 PC 869 14.776 92.438 57.082 1.00 0.00 C ATOM 34649 HR PC 869 14.152 91.971 57.848 1.00 0.00 H ATOM 34650 HS PC 869 15.335 93.217 57.608 1.00 0.00 H ATOM 34651 C2 PC 869 15.748 91.394 56.557 1.00 0.00 C ATOM 34652 HX PC 869 15.189 90.522 56.207 1.00 0.00 H ATOM 34653 C3 PC 869 16.665 90.841 57.768 1.00 0.00 C ATOM 34654 HA PC 869 17.703 90.725 57.444 1.00 0.00 H ATOM 34655 HB PC 869 16.353 89.842 58.084 1.00 0.00 H ATOM 34656 O31 PC 869 16.687 91.709 58.901 1.00 0.00 O ATOM 34657 P31 PC 869 17.745 91.522 60.093 1.00 0.00 P ATOM 34658 O32 PC 869 17.568 89.959 60.578 1.00 0.00 O ATOM 34659 C31 PC 869 16.325 89.554 61.163 1.00 0.00 C ATOM 34660 H1A PC 869 15.475 89.716 60.495 1.00 0.00 H ATOM 34661 H1B PC 869 16.172 90.157 62.062 1.00 0.00 H ATOM 34662 C32 PC 869 16.406 88.098 61.403 1.00 0.00 C ATOM 34663 H2A PC 869 16.784 87.645 60.485 1.00 0.00 H ATOM 34664 H2B PC 869 15.390 87.769 61.626 1.00 0.00 H ATOM 34665 N31 PC 869 17.267 87.642 62.554 1.00 0.00 N ATOM 34666 C33 PC 869 18.636 88.217 62.492 1.00 0.00 C ATOM 34667 H3A PC 869 19.193 87.947 63.390 1.00 0.00 H ATOM 34668 H3B PC 869 18.532 89.300 62.560 1.00 0.00 H ATOM 34669 H3C PC 869 19.124 87.923 61.561 1.00 0.00 H ATOM 34670 C34 PC 869 16.618 88.034 63.839 1.00 0.00 C ATOM 34671 H4A PC 869 16.443 89.110 63.813 1.00 0.00 H ATOM 34672 H4B PC 869 17.330 87.852 64.646 1.00 0.00 H ATOM 34673 H4C PC 869 15.654 87.536 63.957 1.00 0.00 H ATOM 34674 C35 PC 869 17.382 86.133 62.553 1.00 0.00 C ATOM 34675 H5A PC 869 16.399 85.661 62.498 1.00 0.00 H ATOM 34676 H5B PC 869 18.035 85.704 63.314 1.00 0.00 H ATOM 34677 H5C PC 869 17.805 85.851 61.588 1.00 0.00 H ATOM 34678 O33 PC 869 19.090 91.645 59.451 1.00 0.00 O ATOM 34679 O34 PC 869 17.435 92.413 61.187 1.00 0.00 O ATOM 34680 O21 PC 869 16.503 92.006 55.503 1.00 0.00 O ATOM 34681 C21 PC 869 17.303 91.273 54.676 1.00 0.00 C ATOM 34682 O22 PC 869 17.457 90.065 54.752 1.00 0.00 O ATOM 34683 C12 OL 870 18.119 92.176 53.763 1.00 0.00 C ATOM 34684 H2R OL 870 18.358 93.067 54.347 1.00 0.00 H ATOM 34685 H2S OL 870 19.100 91.769 53.511 1.00 0.00 H ATOM 34686 C13 OL 870 17.251 92.499 52.542 1.00 0.00 C ATOM 34687 H3R OL 870 17.079 91.581 51.976 1.00 0.00 H ATOM 34688 H3S OL 870 16.283 92.747 52.982 1.00 0.00 H ATOM 34689 C14 OL 870 17.748 93.529 51.647 1.00 0.00 C ATOM 34690 H4R OL 870 18.009 94.341 52.330 1.00 0.00 H ATOM 34691 H4S OL 870 18.651 93.169 51.150 1.00 0.00 H ATOM 34692 C15 OL 870 16.851 94.025 50.596 1.00 0.00 C ATOM 34693 H5R OL 870 16.315 93.163 50.194 1.00 0.00 H ATOM 34694 H5S OL 870 16.041 94.665 50.952 1.00 0.00 H ATOM 34695 C16 OL 870 17.533 94.788 49.428 1.00 0.00 C ATOM 34696 H6R OL 870 17.994 94.110 48.707 1.00 0.00 H ATOM 34697 H6S OL 870 16.697 95.135 48.817 1.00 0.00 H ATOM 34698 C17 OL 870 18.569 95.912 49.733 1.00 0.00 C ATOM 34699 H7R OL 870 19.500 95.567 50.186 1.00 0.00 H ATOM 34700 H7S OL 870 18.955 96.255 48.771 1.00 0.00 H ATOM 34701 C18 OL 870 17.916 97.064 50.519 1.00 0.00 C ATOM 34702 H8R OL 870 17.117 97.506 49.920 1.00 0.00 H ATOM 34703 H8S OL 870 17.582 96.751 51.511 1.00 0.00 H ATOM 34704 C19 OL 870 19.029 98.071 50.712 1.00 0.00 C ATOM 34705 H9R OL 870 19.857 97.735 51.331 1.00 0.00 H ATOM 34706 C110 OL 870 19.075 99.374 50.167 1.00 0.00 C ATOM 34707 H10R OL 870 19.943 100.007 50.331 1.00 0.00 H ATOM 34708 C111 OL 870 18.119 100.097 49.290 1.00 0.00 C ATOM 34709 H11R OL 870 17.251 99.498 49.006 1.00 0.00 H ATOM 34710 H11S OL 870 17.644 100.938 49.799 1.00 0.00 H ATOM 34711 C112 OL 870 18.768 100.508 47.949 1.00 0.00 C ATOM 34712 H12R OL 870 19.010 99.683 47.276 1.00 0.00 H ATOM 34713 H12S OL 870 18.035 100.921 47.253 1.00 0.00 H ATOM 34714 C113 OL 870 20.030 101.357 48.038 1.00 0.00 C ATOM 34715 H13R OL 870 19.795 102.285 48.563 1.00 0.00 H ATOM 34716 H13S OL 870 20.743 100.821 48.668 1.00 0.00 H ATOM 34717 C114 OL 870 20.775 101.634 46.741 1.00 0.00 C ATOM 34718 H14R OL 870 20.817 100.779 46.062 1.00 0.00 H ATOM 34719 H14S OL 870 20.066 102.321 46.275 1.00 0.00 H ATOM 34720 C115 OL 870 22.094 102.271 46.970 1.00 0.00 C ATOM 34721 H15R OL 870 21.891 103.243 47.427 1.00 0.00 H ATOM 34722 H15S OL 870 22.751 101.783 47.693 1.00 0.00 H ATOM 34723 C116 OL 870 22.835 102.446 45.624 1.00 0.00 C ATOM 34724 H16R OL 870 23.101 101.425 45.341 1.00 0.00 H ATOM 34725 H16S OL 870 22.199 102.814 44.816 1.00 0.00 H ATOM 34726 C117 OL 870 23.971 103.484 45.694 1.00 0.00 C ATOM 34727 H17R OL 870 23.531 104.478 45.593 1.00 0.00 H ATOM 34728 H17S OL 870 24.317 103.428 46.728 1.00 0.00 H ATOM 34729 C118 OL 870 25.129 103.061 44.792 1.00 0.00 C ATOM 34730 H18R OL 870 24.778 102.836 43.783 1.00 0.00 H ATOM 34731 H18S OL 870 25.499 102.063 45.037 1.00 0.00 H ATOM 34732 H18T OL 870 25.967 103.762 44.816 1.00 0.00 H TER 34733 OL 870 ATOM 34733 C116 PA 871 42.197 18.908 45.974 1.00 0.00 C ATOM 34734 H16R PA 871 41.246 19.335 45.648 1.00 0.00 H ATOM 34735 H16S PA 871 42.466 18.049 45.356 1.00 0.00 H ATOM 34736 H16T PA 871 42.862 19.770 45.888 1.00 0.00 H ATOM 34737 C115 PA 871 42.163 18.572 47.495 1.00 0.00 C ATOM 34738 H15R PA 871 42.233 19.517 48.037 1.00 0.00 H ATOM 34739 H15S PA 871 43.069 18.098 47.878 1.00 0.00 H ATOM 34740 C114 PA 871 41.055 17.706 47.848 1.00 0.00 C ATOM 34741 H14R PA 871 40.834 16.865 47.188 1.00 0.00 H ATOM 34742 H14S PA 871 40.163 18.311 47.673 1.00 0.00 H ATOM 34743 C113 PA 871 41.018 17.074 49.201 1.00 0.00 C ATOM 34744 H13R PA 871 41.880 16.425 49.372 1.00 0.00 H ATOM 34745 H13S PA 871 40.155 16.415 49.317 1.00 0.00 H ATOM 34746 C112 PA 871 41.017 18.045 50.475 1.00 0.00 C ATOM 34747 H12R PA 871 41.956 18.572 50.662 1.00 0.00 H ATOM 34748 H12S PA 871 40.994 17.378 51.339 1.00 0.00 H ATOM 34749 C111 PA 871 39.933 19.082 50.540 1.00 0.00 C ATOM 34750 H11R PA 871 40.033 19.830 49.751 1.00 0.00 H ATOM 34751 H11S PA 871 40.132 19.588 51.487 1.00 0.00 H ATOM 34752 C110 PA 871 38.513 18.662 50.312 1.00 0.00 C ATOM 34753 H10R PA 871 38.276 18.249 49.329 1.00 0.00 H ATOM 34754 H10S PA 871 38.049 19.645 50.413 1.00 0.00 H ATOM 34755 C19 PA 871 37.962 17.870 51.555 1.00 0.00 C ATOM 34756 H9R PA 871 38.131 18.390 52.500 1.00 0.00 H ATOM 34757 H9S PA 871 38.464 16.904 51.633 1.00 0.00 H ATOM 34758 C18 PA 871 36.462 17.567 51.311 1.00 0.00 C ATOM 34759 H8R PA 871 35.898 18.499 51.397 1.00 0.00 H ATOM 34760 H8S PA 871 36.010 16.933 52.076 1.00 0.00 H ATOM 34761 C17 PA 871 36.140 16.946 49.959 1.00 0.00 C ATOM 34762 H7R PA 871 36.479 17.423 49.036 1.00 0.00 H ATOM 34763 H7S PA 871 35.049 16.953 50.007 1.00 0.00 H ATOM 34764 C16 PA 871 36.518 15.507 49.715 1.00 0.00 C ATOM 34765 H6R PA 871 37.598 15.494 49.552 1.00 0.00 H ATOM 34766 H6S PA 871 36.057 15.281 48.751 1.00 0.00 H ATOM 34767 C15 PA 871 35.892 14.514 50.732 1.00 0.00 C ATOM 34768 H5R PA 871 35.739 13.587 50.175 1.00 0.00 H ATOM 34769 H5S PA 871 34.885 14.871 50.957 1.00 0.00 H ATOM 34770 C14 PA 871 36.577 14.218 52.058 1.00 0.00 C ATOM 34771 H4R PA 871 36.849 15.131 52.593 1.00 0.00 H ATOM 34772 H4S PA 871 37.519 13.795 51.701 1.00 0.00 H ATOM 34773 C13 PA 871 35.748 13.215 52.906 1.00 0.00 C ATOM 34774 H3R PA 871 36.472 12.510 53.320 1.00 0.00 H ATOM 34775 H3S PA 871 35.108 12.619 52.253 1.00 0.00 H ATOM 34776 C12 PA 871 34.948 13.850 53.967 1.00 0.00 C ATOM 34777 H2R PA 871 34.306 13.107 54.444 1.00 0.00 H ATOM 34778 H2S PA 871 34.174 14.554 53.657 1.00 0.00 H ATOM 34779 C11 PGR 872 35.755 14.351 55.159 1.00 0.00 C ATOM 34780 O12 PGR 872 36.315 13.576 55.942 1.00 0.00 O ATOM 34781 O11 PGR 872 35.954 15.668 55.125 1.00 0.00 O ATOM 34782 C1 PGR 872 36.803 16.391 56.102 1.00 0.00 C ATOM 34783 HR PGR 872 37.789 15.919 56.095 1.00 0.00 H ATOM 34784 HS PGR 872 36.384 16.239 57.100 1.00 0.00 H ATOM 34785 C2 PGR 872 37.062 17.840 55.748 1.00 0.00 C ATOM 34786 HX PGR 872 37.580 17.874 54.786 1.00 0.00 H ATOM 34787 C3 PGR 872 38.003 18.544 56.794 1.00 0.00 C ATOM 34788 HA PGR 872 38.096 19.616 56.604 1.00 0.00 H ATOM 34789 HB PGR 872 39.011 18.123 56.744 1.00 0.00 H ATOM 34790 O31 PGR 872 37.524 18.401 58.162 1.00 0.00 O ATOM 34791 P31 PGR 872 36.363 19.248 58.695 1.00 0.00 P ATOM 34792 O32 PGR 872 35.078 18.405 58.528 1.00 0.00 O ATOM 34793 C31 PGR 872 34.718 17.279 59.400 1.00 0.00 C ATOM 34794 H1A PGR 872 35.684 16.879 59.718 1.00 0.00 H ATOM 34795 H1B PGR 872 34.220 16.521 58.789 1.00 0.00 H ATOM 34796 C32 PGR 872 33.842 17.704 60.540 1.00 0.00 C ATOM 34797 H2A PGR 872 33.187 18.509 60.197 1.00 0.00 H ATOM 34798 O35 PGR 872 34.720 18.253 61.573 1.00 0.00 O ATOM 34799 HO5A PGR 872 35.348 18.799 61.066 1.00 0.00 H ATOM 34800 C33 PGR 872 32.940 16.596 60.992 1.00 0.00 C ATOM 34801 H3A PGR 872 32.364 16.971 61.841 1.00 0.00 H ATOM 34802 H3B PGR 872 32.273 16.350 60.161 1.00 0.00 H ATOM 34803 O33 PGR 872 36.633 19.263 60.149 1.00 0.00 O ATOM 34804 O34 PGR 872 36.351 20.562 58.031 1.00 0.00 O ATOM 34805 O21 PGR 872 35.716 18.431 55.744 1.00 0.00 O ATOM 34806 C21 PGR 872 35.569 19.457 54.935 1.00 0.00 C ATOM 34807 O22 PGR 872 36.431 19.905 54.178 1.00 0.00 O ATOM 34808 O36 PGR 872 33.774 15.419 61.304 1.00 0.00 O ATOM 34809 HO6A PGR 872 33.047 14.867 61.644 1.00 0.00 H ATOM 34810 C12 OL 873 34.280 20.105 55.237 1.00 0.00 C ATOM 34811 H2R OL 873 33.684 19.399 55.819 1.00 0.00 H ATOM 34812 H2S OL 873 34.420 20.972 55.885 1.00 0.00 H ATOM 34813 C13 OL 873 33.586 20.395 53.936 1.00 0.00 C ATOM 34814 H3R OL 873 32.676 20.959 54.153 1.00 0.00 H ATOM 34815 H3S OL 873 34.220 21.040 53.324 1.00 0.00 H ATOM 34816 C14 OL 873 33.101 19.160 53.193 1.00 0.00 C ATOM 34817 H4R OL 873 34.004 18.551 53.120 1.00 0.00 H ATOM 34818 H4S OL 873 32.378 18.661 53.842 1.00 0.00 H ATOM 34819 C15 OL 873 32.593 19.348 51.755 1.00 0.00 C ATOM 34820 H5R OL 873 31.610 19.825 51.770 1.00 0.00 H ATOM 34821 H5S OL 873 33.153 20.098 51.192 1.00 0.00 H ATOM 34822 C16 OL 873 32.513 18.025 50.919 1.00 0.00 C ATOM 34823 H6R OL 873 33.196 17.256 51.286 1.00 0.00 H ATOM 34824 H6S OL 873 31.478 17.678 50.902 1.00 0.00 H ATOM 34825 C17 OL 873 32.856 18.283 49.447 1.00 0.00 C ATOM 34826 H7R OL 873 32.236 19.160 49.251 1.00 0.00 H ATOM 34827 H7S OL 873 33.845 18.745 49.464 1.00 0.00 H ATOM 34828 C18 OL 873 32.507 17.041 48.624 1.00 0.00 C ATOM 34829 H8R OL 873 32.905 16.117 49.050 1.00 0.00 H ATOM 34830 H8S OL 873 31.432 16.914 48.485 1.00 0.00 H ATOM 34831 C19 OL 873 33.170 17.288 47.286 1.00 0.00 C ATOM 34832 H9R OL 873 34.239 17.192 47.456 1.00 0.00 H ATOM 34833 C110 OL 873 32.689 17.554 46.073 1.00 0.00 C ATOM 34834 H10R OL 873 33.325 17.644 45.197 1.00 0.00 H ATOM 34835 C111 OL 873 31.271 17.734 45.792 1.00 0.00 C ATOM 34836 H11R OL 873 30.842 18.336 46.596 1.00 0.00 H ATOM 34837 H11S OL 873 31.202 18.375 44.910 1.00 0.00 H ATOM 34838 C112 OL 873 30.623 16.354 45.509 1.00 0.00 C ATOM 34839 H12R OL 873 31.271 15.926 44.742 1.00 0.00 H ATOM 34840 H12S OL 873 30.830 15.814 46.436 1.00 0.00 H ATOM 34841 C113 OL 873 29.048 16.290 45.225 1.00 0.00 C ATOM 34842 H13R OL 873 28.726 15.259 45.384 1.00 0.00 H ATOM 34843 H13S OL 873 28.567 16.958 45.942 1.00 0.00 H ATOM 34844 C114 OL 873 28.714 16.712 43.803 1.00 0.00 C ATOM 34845 H14R OL 873 29.154 17.687 43.584 1.00 0.00 H ATOM 34846 H14S OL 873 29.235 15.961 43.206 1.00 0.00 H ATOM 34847 C115 OL 873 27.194 16.802 43.566 1.00 0.00 C ATOM 34848 H15R OL 873 26.834 15.787 43.744 1.00 0.00 H ATOM 34849 H15S OL 873 26.753 17.429 44.344 1.00 0.00 H ATOM 34850 C116 OL 873 26.853 17.224 42.183 1.00 0.00 C ATOM 34851 H16R OL 873 25.864 17.687 42.202 1.00 0.00 H ATOM 34852 H16S OL 873 27.493 18.025 41.807 1.00 0.00 H ATOM 34853 C117 OL 873 26.808 16.064 41.165 1.00 0.00 C ATOM 34854 H17R OL 873 26.545 16.514 40.206 1.00 0.00 H ATOM 34855 H17S OL 873 27.798 15.713 40.865 1.00 0.00 H ATOM 34856 C118 OL 873 25.950 14.862 41.419 1.00 0.00 C ATOM 34857 H18R OL 873 26.452 14.177 42.107 1.00 0.00 H ATOM 34858 H18S OL 873 25.721 14.294 40.515 1.00 0.00 H ATOM 34859 H18T OL 873 24.959 15.082 41.822 1.00 0.00 H TER 34860 OL 873 ATOM 34860 C116 PA 874 23.087 123.574 40.849 1.00 0.00 C ATOM 34861 H16R PA 874 23.899 123.160 40.248 1.00 0.00 H ATOM 34862 H16S PA 874 23.245 124.652 40.773 1.00 0.00 H ATOM 34863 H16T PA 874 22.233 123.235 40.258 1.00 0.00 H ATOM 34864 C115 PA 874 23.232 122.942 42.264 1.00 0.00 C ATOM 34865 H15R PA 874 24.163 123.233 42.754 1.00 0.00 H ATOM 34866 H15S PA 874 23.353 121.863 42.147 1.00 0.00 H ATOM 34867 C114 PA 874 21.895 123.332 43.071 1.00 0.00 C ATOM 34868 H14R PA 874 21.962 124.405 43.263 1.00 0.00 H ATOM 34869 H14S PA 874 22.053 123.046 44.113 1.00 0.00 H ATOM 34870 C113 PA 874 20.610 122.672 42.592 1.00 0.00 C ATOM 34871 H13R PA 874 20.727 121.587 42.632 1.00 0.00 H ATOM 34872 H13S PA 874 20.391 122.996 41.573 1.00 0.00 H ATOM 34873 C112 PA 874 19.476 122.931 43.501 1.00 0.00 C ATOM 34874 H12R PA 874 19.810 122.539 44.464 1.00 0.00 H ATOM 34875 H12S PA 874 18.562 122.388 43.252 1.00 0.00 H ATOM 34876 C111 PA 874 19.116 124.374 43.701 1.00 0.00 C ATOM 34877 H11R PA 874 19.031 124.843 42.719 1.00 0.00 H ATOM 34878 H11S PA 874 19.945 124.827 44.250 1.00 0.00 H ATOM 34879 C110 PA 874 17.898 124.659 44.555 1.00 0.00 C ATOM 34880 H10R PA 874 18.000 124.263 45.568 1.00 0.00 H ATOM 34881 H10S PA 874 17.042 124.176 44.081 1.00 0.00 H ATOM 34882 C19 PA 874 17.548 126.147 44.627 1.00 0.00 C ATOM 34883 H9R PA 874 17.196 126.513 43.661 1.00 0.00 H ATOM 34884 H9S PA 874 18.458 126.688 44.895 1.00 0.00 H ATOM 34885 C18 PA 874 16.470 126.441 45.597 1.00 0.00 C ATOM 34886 H8R PA 874 15.580 125.823 45.457 1.00 0.00 H ATOM 34887 H8S PA 874 16.036 127.389 45.272 1.00 0.00 H ATOM 34888 C17 PA 874 16.997 126.630 47.009 1.00 0.00 C ATOM 34889 H7R PA 874 17.687 127.476 46.984 1.00 0.00 H ATOM 34890 H7S PA 874 17.694 125.829 47.267 1.00 0.00 H ATOM 34891 C16 PA 874 15.948 126.787 48.054 1.00 0.00 C ATOM 34892 H6R PA 874 15.622 125.758 48.224 1.00 0.00 H ATOM 34893 H6S PA 874 15.098 127.376 47.704 1.00 0.00 H ATOM 34894 C15 PA 874 16.377 127.515 49.294 1.00 0.00 C ATOM 34895 H5R PA 874 16.971 128.402 49.063 1.00 0.00 H ATOM 34896 H5S PA 874 17.036 126.859 49.866 1.00 0.00 H ATOM 34897 C14 PA 874 15.163 128.026 50.137 1.00 0.00 C ATOM 34898 H4R PA 874 14.506 127.181 50.352 1.00 0.00 H ATOM 34899 H4S PA 874 14.569 128.703 49.519 1.00 0.00 H ATOM 34900 C13 PA 874 15.604 128.838 51.342 1.00 0.00 C ATOM 34901 H3R PA 874 16.234 129.654 50.981 1.00 0.00 H ATOM 34902 H3S PA 874 16.314 128.283 51.959 1.00 0.00 H ATOM 34903 C12 PA 874 14.437 129.364 52.277 1.00 0.00 C ATOM 34904 H2R PA 874 13.748 129.928 51.645 1.00 0.00 H ATOM 34905 H2S PA 874 13.815 128.536 52.624 1.00 0.00 H ATOM 34906 C11 PGR 875 14.836 130.257 53.365 1.00 0.00 C ATOM 34907 O12 PGR 875 14.060 130.550 54.254 1.00 0.00 O ATOM 34908 O11 PGR 875 16.066 130.819 53.235 1.00 0.00 O ATOM 34909 C1 PGR 875 16.535 131.647 54.300 1.00 0.00 C ATOM 34910 HR PGR 875 16.308 131.023 55.168 1.00 0.00 H ATOM 34911 HS PGR 875 16.004 132.586 54.477 1.00 0.00 H ATOM 34912 C2 PGR 875 18.079 131.919 54.193 1.00 0.00 C ATOM 34913 HX PGR 875 18.688 131.012 54.229 1.00 0.00 H ATOM 34914 C3 PGR 875 18.640 132.724 55.485 1.00 0.00 C ATOM 34915 HA PGR 875 18.358 133.764 55.299 1.00 0.00 H ATOM 34916 HB PGR 875 19.733 132.725 55.524 1.00 0.00 H ATOM 34917 O31 PGR 875 18.056 132.242 56.741 1.00 0.00 O ATOM 34918 P31 PGR 875 18.546 132.852 58.205 1.00 0.00 P ATOM 34919 O32 PGR 875 19.995 132.242 58.479 1.00 0.00 O ATOM 34920 C31 PGR 875 21.161 132.957 58.275 1.00 0.00 C ATOM 34921 H1A PGR 875 21.111 133.942 58.746 1.00 0.00 H ATOM 34922 H1B PGR 875 21.281 133.109 57.199 1.00 0.00 H ATOM 34923 C32 PGR 875 22.367 132.081 58.752 1.00 0.00 C ATOM 34924 H2A PGR 875 23.245 132.675 58.485 1.00 0.00 H ATOM 34925 O35 PGR 875 22.401 130.838 58.113 1.00 0.00 O ATOM 34926 HO5A PGR 875 22.573 130.963 57.163 1.00 0.00 H ATOM 34927 C33 PGR 875 22.353 131.831 60.260 1.00 0.00 C ATOM 34928 H3A PGR 875 23.209 131.235 60.588 1.00 0.00 H ATOM 34929 H3B PGR 875 22.361 132.780 60.802 1.00 0.00 H ATOM 34930 O33 PGR 875 18.552 134.320 58.154 1.00 0.00 O ATOM 34931 O34 PGR 875 17.718 132.204 59.314 1.00 0.00 O ATOM 34932 O21 PGR 875 18.395 132.631 53.022 1.00 0.00 O ATOM 34933 C21 PGR 875 19.699 132.746 52.705 1.00 0.00 C ATOM 34934 O22 PGR 875 20.603 132.032 53.147 1.00 0.00 O ATOM 34935 O36 PGR 875 21.149 131.175 60.801 1.00 0.00 O ATOM 34936 HO6A PGR 875 20.357 131.694 60.572 1.00 0.00 H ATOM 34937 C12 OL 876 19.952 133.810 51.727 1.00 0.00 C ATOM 34938 H2R OL 876 19.661 133.324 50.794 1.00 0.00 H ATOM 34939 H2S OL 876 19.248 134.633 51.866 1.00 0.00 H ATOM 34940 C13 OL 876 21.370 134.172 51.692 1.00 0.00 C ATOM 34941 H3R OL 876 21.744 134.470 52.674 1.00 0.00 H ATOM 34942 H3S OL 876 21.982 133.346 51.324 1.00 0.00 H ATOM 34943 C14 OL 876 21.572 135.411 50.806 1.00 0.00 C ATOM 34944 H4R OL 876 21.157 136.240 51.384 1.00 0.00 H ATOM 34945 H4S OL 876 22.646 135.600 50.856 1.00 0.00 H ATOM 34946 C15 OL 876 21.168 135.376 49.326 1.00 0.00 C ATOM 34947 H5R OL 876 21.309 134.384 48.890 1.00 0.00 H ATOM 34948 H5S OL 876 20.108 135.641 49.315 1.00 0.00 H ATOM 34949 C16 OL 876 21.963 136.416 48.619 1.00 0.00 C ATOM 34950 H6R OL 876 21.908 137.396 49.096 1.00 0.00 H ATOM 34951 H6S OL 876 23.021 136.146 48.598 1.00 0.00 H ATOM 34952 C17 OL 876 21.604 136.566 47.152 1.00 0.00 C ATOM 34953 H7R OL 876 21.947 135.692 46.594 1.00 0.00 H ATOM 34954 H7S OL 876 20.544 136.464 46.912 1.00 0.00 H ATOM 34955 C18 OL 876 21.934 137.947 46.582 1.00 0.00 C ATOM 34956 H8R OL 876 21.261 137.956 45.722 1.00 0.00 H ATOM 34957 H8S OL 876 21.854 138.745 47.322 1.00 0.00 H ATOM 34958 C19 OL 876 23.351 137.962 46.116 1.00 0.00 C ATOM 34959 H9R OL 876 24.099 138.186 46.871 1.00 0.00 H ATOM 34960 C110 OL 876 23.730 137.897 44.873 1.00 0.00 C ATOM 34961 H10R OL 876 24.782 138.110 44.705 1.00 0.00 H ATOM 34962 C111 OL 876 22.968 137.585 43.706 1.00 0.00 C ATOM 34963 H11R OL 876 23.639 136.828 43.296 1.00 0.00 H ATOM 34964 H11S OL 876 22.050 137.008 43.838 1.00 0.00 H ATOM 34965 C112 OL 876 22.846 138.598 42.530 1.00 0.00 C ATOM 34966 H12R OL 876 23.822 139.014 42.273 1.00 0.00 H ATOM 34967 H12S OL 876 22.638 137.955 41.672 1.00 0.00 H ATOM 34968 C113 OL 876 21.839 139.784 42.774 1.00 0.00 C ATOM 34969 H13R OL 876 20.956 139.400 43.290 1.00 0.00 H ATOM 34970 H13S OL 876 22.440 140.500 43.339 1.00 0.00 H ATOM 34971 C114 OL 876 21.460 140.452 41.476 1.00 0.00 C ATOM 34972 H14R OL 876 22.333 140.641 40.847 1.00 0.00 H ATOM 34973 H14S OL 876 20.812 139.863 40.824 1.00 0.00 H ATOM 34974 C115 OL 876 21.003 141.892 41.826 1.00 0.00 C ATOM 34975 H15R OL 876 21.795 142.420 42.362 1.00 0.00 H ATOM 34976 H15S OL 876 20.924 142.381 40.853 1.00 0.00 H ATOM 34977 C116 OL 876 19.649 142.020 42.544 1.00 0.00 C ATOM 34978 H16R OL 876 19.637 141.740 43.600 1.00 0.00 H ATOM 34979 H16S OL 876 19.287 143.037 42.380 1.00 0.00 H ATOM 34980 C117 OL 876 18.511 141.153 41.965 1.00 0.00 C ATOM 34981 H17R OL 876 18.627 141.170 40.880 1.00 0.00 H ATOM 34982 H17S OL 876 18.834 140.124 42.134 1.00 0.00 H ATOM 34983 C118 OL 876 17.108 141.553 42.301 1.00 0.00 C ATOM 34984 H18R OL 876 16.420 140.774 41.968 1.00 0.00 H ATOM 34985 H18S OL 876 16.708 142.506 41.948 1.00 0.00 H ATOM 34986 H18T OL 876 17.038 141.623 43.389 1.00 0.00 H TER 34987 OL 876 ATOM 34987 C116 PA 877 34.352 114.740 47.336 1.00 0.00 C ATOM 34988 H16R PA 877 33.458 115.235 47.721 1.00 0.00 H ATOM 34989 H16S PA 877 34.249 113.655 47.259 1.00 0.00 H ATOM 34990 H16T PA 877 34.298 115.033 46.286 1.00 0.00 H ATOM 34991 C115 PA 877 35.560 115.263 48.165 1.00 0.00 C ATOM 34992 H15R PA 877 35.299 114.973 49.185 1.00 0.00 H ATOM 34993 H15S PA 877 35.527 116.353 48.108 1.00 0.00 H ATOM 34994 C114 PA 877 36.985 114.648 47.845 1.00 0.00 C ATOM 34995 H14R PA 877 37.637 115.042 48.628 1.00 0.00 H ATOM 34996 H14S PA 877 37.401 115.101 46.943 1.00 0.00 H ATOM 34997 C113 PA 877 37.054 113.121 47.800 1.00 0.00 C ATOM 34998 H13R PA 877 36.334 112.698 47.097 1.00 0.00 H ATOM 34999 H13S PA 877 36.802 112.669 48.762 1.00 0.00 H ATOM 35000 C112 PA 877 38.479 112.579 47.395 1.00 0.00 C ATOM 35001 H12R PA 877 39.148 112.930 48.184 1.00 0.00 H ATOM 35002 H12S PA 877 38.859 113.093 46.509 1.00 0.00 H ATOM 35003 C111 PA 877 38.651 111.069 47.037 1.00 0.00 C ATOM 35004 H11R PA 877 39.669 110.943 46.661 1.00 0.00 H ATOM 35005 H11S PA 877 37.990 110.856 46.195 1.00 0.00 H ATOM 35006 C110 PA 877 38.558 110.137 48.248 1.00 0.00 C ATOM 35007 H10R PA 877 37.568 110.113 48.710 1.00 0.00 H ATOM 35008 H10S PA 877 39.255 110.457 49.025 1.00 0.00 H ATOM 35009 C19 PA 877 38.796 108.690 47.832 1.00 0.00 C ATOM 35010 H9R PA 877 39.816 108.479 47.504 1.00 0.00 H ATOM 35011 H9S PA 877 38.128 108.543 46.981 1.00 0.00 H ATOM 35012 C18 PA 877 38.559 107.678 48.879 1.00 0.00 C ATOM 35013 H8R PA 877 37.592 107.948 49.308 1.00 0.00 H ATOM 35014 H8S PA 877 39.344 107.787 49.630 1.00 0.00 H ATOM 35015 C17 PA 877 38.423 106.245 48.353 1.00 0.00 C ATOM 35016 H7R PA 877 39.282 105.891 47.779 1.00 0.00 H ATOM 35017 H7S PA 877 37.719 106.263 47.518 1.00 0.00 H ATOM 35018 C16 PA 877 38.044 105.214 49.458 1.00 0.00 C ATOM 35019 H6R PA 877 37.049 105.448 49.841 1.00 0.00 H ATOM 35020 H6S PA 877 38.867 105.318 50.169 1.00 0.00 H ATOM 35021 C15 PA 877 37.953 103.779 49.025 1.00 0.00 C ATOM 35022 H5R PA 877 38.938 103.342 48.848 1.00 0.00 H ATOM 35023 H5S PA 877 37.246 103.664 48.201 1.00 0.00 H ATOM 35024 C14 PA 877 37.233 102.850 50.088 1.00 0.00 C ATOM 35025 H4R PA 877 37.065 101.854 49.673 1.00 0.00 H ATOM 35026 H4S PA 877 36.192 103.116 50.285 1.00 0.00 H ATOM 35027 C13 PA 877 38.086 102.683 51.332 1.00 0.00 C ATOM 35028 H3R PA 877 38.258 103.568 51.948 1.00 0.00 H ATOM 35029 H3S PA 877 39.109 102.378 51.102 1.00 0.00 H ATOM 35030 C12 PA 877 37.520 101.732 52.330 1.00 0.00 C ATOM 35031 H2R PA 877 38.256 101.671 53.134 1.00 0.00 H ATOM 35032 H2S PA 877 37.397 100.751 51.865 1.00 0.00 H ATOM 35033 C11 PGR 878 36.242 102.140 52.941 1.00 0.00 C ATOM 35034 O12 PGR 878 35.923 103.300 52.912 1.00 0.00 O ATOM 35035 O11 PGR 878 35.669 101.162 53.622 1.00 0.00 O ATOM 35036 C1 PGR 878 34.332 101.363 54.170 1.00 0.00 C ATOM 35037 HR PGR 878 33.564 101.533 53.411 1.00 0.00 H ATOM 35038 HS PGR 878 34.291 102.136 54.941 1.00 0.00 H ATOM 35039 C2 PGR 878 34.127 100.054 54.998 1.00 0.00 C ATOM 35040 HX PGR 878 33.127 100.056 55.441 1.00 0.00 H ATOM 35041 C3 PGR 878 35.181 100.083 56.087 1.00 0.00 C ATOM 35042 HA PGR 878 35.035 100.988 56.683 1.00 0.00 H ATOM 35043 HB PGR 878 36.182 100.223 55.670 1.00 0.00 H ATOM 35044 O31 PGR 878 35.293 98.934 56.890 1.00 0.00 O ATOM 35045 P31 PGR 878 36.593 98.661 57.682 1.00 0.00 P ATOM 35046 O32 PGR 878 37.642 98.194 56.517 1.00 0.00 O ATOM 35047 C31 PGR 878 37.214 97.134 55.650 1.00 0.00 C ATOM 35048 H1A PGR 878 36.149 97.236 55.424 1.00 0.00 H ATOM 35049 H1B PGR 878 37.351 96.131 56.062 1.00 0.00 H ATOM 35050 C32 PGR 878 37.959 97.160 54.292 1.00 0.00 C ATOM 35051 H2A PGR 878 37.515 96.415 53.626 1.00 0.00 H ATOM 35052 O35 PGR 878 39.353 96.867 54.508 1.00 0.00 O ATOM 35053 HO5A PGR 878 39.584 97.405 55.287 1.00 0.00 H ATOM 35054 C33 PGR 878 37.785 98.512 53.635 1.00 0.00 C ATOM 35055 H3A PGR 878 36.741 98.831 53.693 1.00 0.00 H ATOM 35056 H3B PGR 878 38.354 99.356 54.032 1.00 0.00 H ATOM 35057 O33 PGR 878 36.966 100.066 58.153 1.00 0.00 O ATOM 35058 O34 PGR 878 36.280 97.639 58.709 1.00 0.00 O ATOM 35059 O21 PGR 878 34.297 98.864 54.160 1.00 0.00 O ATOM 35060 C21 PGR 878 33.258 98.467 53.383 1.00 0.00 C ATOM 35061 O22 PGR 878 32.159 98.896 53.453 1.00 0.00 O ATOM 35062 O36 PGR 878 38.215 98.417 52.297 1.00 0.00 O ATOM 35063 HO6A PGR 878 39.178 98.557 52.325 1.00 0.00 H ATOM 35064 C12 OL 879 33.746 97.381 52.391 1.00 0.00 C ATOM 35065 H2R OL 879 34.345 97.932 51.662 1.00 0.00 H ATOM 35066 H2S OL 879 34.371 96.658 52.918 1.00 0.00 H ATOM 35067 C13 OL 879 32.690 96.588 51.631 1.00 0.00 C ATOM 35068 H3R OL 879 32.037 97.149 50.959 1.00 0.00 H ATOM 35069 H3S OL 879 33.210 96.087 50.811 1.00 0.00 H ATOM 35070 C14 OL 879 31.722 95.648 52.505 1.00 0.00 C ATOM 35071 H4R OL 879 32.317 95.037 53.187 1.00 0.00 H ATOM 35072 H4S OL 879 31.008 96.205 53.115 1.00 0.00 H ATOM 35073 C15 OL 879 30.993 94.675 51.684 1.00 0.00 C ATOM 35074 H5R OL 879 30.395 94.062 52.361 1.00 0.00 H ATOM 35075 H5S OL 879 30.246 95.307 51.199 1.00 0.00 H ATOM 35076 C16 OL 879 31.913 93.817 50.770 1.00 0.00 C ATOM 35077 H6R OL 879 32.680 94.317 50.175 1.00 0.00 H ATOM 35078 H6S OL 879 32.539 93.205 51.423 1.00 0.00 H ATOM 35079 C17 OL 879 31.161 92.916 49.744 1.00 0.00 C ATOM 35080 H7R OL 879 30.365 93.453 49.225 1.00 0.00 H ATOM 35081 H7S OL 879 31.823 92.578 48.944 1.00 0.00 H ATOM 35082 C18 OL 879 30.471 91.742 50.452 1.00 0.00 C ATOM 35083 H8R OL 879 30.030 92.065 51.398 1.00 0.00 H ATOM 35084 H8S OL 879 29.647 91.280 49.903 1.00 0.00 H ATOM 35085 C19 OL 879 31.570 90.793 50.810 1.00 0.00 C ATOM 35086 H9R OL 879 32.603 91.051 50.593 1.00 0.00 H ATOM 35087 C110 OL 879 31.405 89.462 51.165 1.00 0.00 C ATOM 35088 H10R OL 879 32.334 88.971 51.443 1.00 0.00 H ATOM 35089 C111 OL 879 30.157 88.906 51.792 1.00 0.00 C ATOM 35090 H11R OL 879 30.226 88.900 52.882 1.00 0.00 H ATOM 35091 H11S OL 879 29.295 89.519 51.524 1.00 0.00 H ATOM 35092 C112 OL 879 29.928 87.439 51.236 1.00 0.00 C ATOM 35093 H12R OL 879 28.987 87.025 51.606 1.00 0.00 H ATOM 35094 H12S OL 879 29.895 87.476 50.146 1.00 0.00 H ATOM 35095 C113 OL 879 31.131 86.606 51.627 1.00 0.00 C ATOM 35096 H13R OL 879 31.155 85.764 50.932 1.00 0.00 H ATOM 35097 H13S OL 879 32.064 87.119 51.387 1.00 0.00 H ATOM 35098 C114 OL 879 31.215 86.280 53.127 1.00 0.00 C ATOM 35099 H14R OL 879 30.687 86.941 53.818 1.00 0.00 H ATOM 35100 H14S OL 879 30.621 85.367 53.202 1.00 0.00 H ATOM 35101 C115 OL 879 32.593 85.984 53.677 1.00 0.00 C ATOM 35102 H15R OL 879 33.174 85.278 53.079 1.00 0.00 H ATOM 35103 H15S OL 879 33.287 86.825 53.729 1.00 0.00 H ATOM 35104 C116 OL 879 32.603 85.568 55.146 1.00 0.00 C ATOM 35105 H16R OL 879 33.462 86.074 55.592 1.00 0.00 H ATOM 35106 H16S OL 879 31.805 86.083 55.685 1.00 0.00 H ATOM 35107 C117 OL 879 32.585 84.030 55.469 1.00 0.00 C ATOM 35108 H17R OL 879 31.684 83.524 55.114 1.00 0.00 H ATOM 35109 H17S OL 879 33.455 83.636 54.940 1.00 0.00 H ATOM 35110 C118 OL 879 32.791 83.788 56.936 1.00 0.00 C ATOM 35111 H18R OL 879 33.561 84.454 57.331 1.00 0.00 H ATOM 35112 H18S OL 879 33.122 82.759 57.096 1.00 0.00 H ATOM 35113 H18T OL 879 31.855 83.859 57.493 1.00 0.00 H TER 35114 OL 879 ATOM 35114 C116 PA 880 135.816 1.557 42.006 1.00 0.00 C ATOM 35115 H16R PA 880 136.473 0.857 41.486 1.00 0.00 H ATOM 35116 H16S PA 880 134.918 1.573 41.384 1.00 0.00 H ATOM 35117 H16T PA 880 135.442 1.174 42.958 1.00 0.00 H ATOM 35118 C115 PA 880 136.428 2.968 42.193 1.00 0.00 C ATOM 35119 H15R PA 880 135.657 3.740 42.152 1.00 0.00 H ATOM 35120 H15S PA 880 136.967 3.107 41.253 1.00 0.00 H ATOM 35121 C114 PA 880 137.207 3.122 43.503 1.00 0.00 C ATOM 35122 H14R PA 880 137.203 4.186 43.747 1.00 0.00 H ATOM 35123 H14S PA 880 138.252 2.880 43.301 1.00 0.00 H ATOM 35124 C113 PA 880 136.789 2.429 44.814 1.00 0.00 C ATOM 35125 H13R PA 880 137.095 1.384 44.730 1.00 0.00 H ATOM 35126 H13S PA 880 135.711 2.353 44.973 1.00 0.00 H ATOM 35127 C112 PA 880 137.348 2.825 46.179 1.00 0.00 C ATOM 35128 H12R PA 880 136.661 3.579 46.568 1.00 0.00 H ATOM 35129 H12S PA 880 138.298 3.352 46.065 1.00 0.00 H ATOM 35130 C111 PA 880 137.326 1.610 47.132 1.00 0.00 C ATOM 35131 H11R PA 880 137.939 0.826 46.682 1.00 0.00 H ATOM 35132 H11S PA 880 136.318 1.204 47.231 1.00 0.00 H ATOM 35133 C110 PA 880 137.798 1.935 48.554 1.00 0.00 C ATOM 35134 H10R PA 880 137.086 2.662 48.950 1.00 0.00 H ATOM 35135 H10S PA 880 138.809 2.347 48.597 1.00 0.00 H ATOM 35136 C19 PA 880 137.798 0.639 49.516 1.00 0.00 C ATOM 35137 H9R PA 880 138.574 -0.093 49.284 1.00 0.00 H ATOM 35138 H9S PA 880 136.857 0.100 49.383 1.00 0.00 H ATOM 35139 C18 PA 880 138.104 0.967 50.926 1.00 0.00 C ATOM 35140 H8R PA 880 137.365 1.705 51.244 1.00 0.00 H ATOM 35141 H8S PA 880 139.099 1.411 50.990 1.00 0.00 H ATOM 35142 C17 PA 880 137.943 -0.262 51.769 1.00 0.00 C ATOM 35143 H7R PA 880 138.846 -0.860 51.630 1.00 0.00 H ATOM 35144 H7S PA 880 137.111 -0.834 51.353 1.00 0.00 H ATOM 35145 C16 PA 880 137.740 0.067 53.210 1.00 0.00 C ATOM 35146 H6R PA 880 136.852 0.679 53.382 1.00 0.00 H ATOM 35147 H6S PA 880 138.670 0.602 53.410 1.00 0.00 H ATOM 35148 C15 PA 880 137.743 -1.144 54.137 1.00 0.00 C ATOM 35149 H5R PA 880 138.652 -1.692 53.882 1.00 0.00 H ATOM 35150 H5S PA 880 136.968 -1.836 53.800 1.00 0.00 H ATOM 35151 C14 PA 880 137.487 -0.944 55.602 1.00 0.00 C ATOM 35152 H4R PA 880 138.262 -0.225 55.873 1.00 0.00 H ATOM 35153 H4S PA 880 137.527 -1.965 55.988 1.00 0.00 H ATOM 35154 C13 PA 880 136.133 -0.342 56.010 1.00 0.00 C ATOM 35155 H3R PA 880 135.389 -0.899 55.436 1.00 0.00 H ATOM 35156 H3S PA 880 136.203 0.730 55.814 1.00 0.00 H ATOM 35157 C12 PA 880 135.764 -0.573 57.506 1.00 0.00 C ATOM 35158 H2R PA 880 135.743 -1.643 57.725 1.00 0.00 H ATOM 35159 H2S PA 880 134.820 -0.145 57.848 1.00 0.00 H ATOM 35160 C11 PGR 881 136.721 0.067 58.482 1.00 0.00 C ATOM 35161 O12 PGR 881 136.351 0.918 59.266 1.00 0.00 O ATOM 35162 O11 PGR 881 137.977 -0.320 58.320 1.00 0.00 O ATOM 35163 C1 PGR 881 138.981 0.537 58.740 1.00 0.00 C ATOM 35164 HR PGR 881 138.853 0.666 59.818 1.00 0.00 H ATOM 35165 HS PGR 881 139.030 1.489 58.205 1.00 0.00 H ATOM 35166 C2 PGR 881 140.369 -0.153 58.465 1.00 0.00 C ATOM 35167 HX PGR 881 140.274 -1.213 58.712 1.00 0.00 H ATOM 35168 C3 PGR 881 141.505 0.416 59.401 1.00 0.00 C ATOM 35169 HA PGR 881 140.993 0.607 60.348 1.00 0.00 H ATOM 35170 HB PGR 881 141.768 1.382 58.961 1.00 0.00 H ATOM 35171 O31 PGR 881 142.577 -0.449 59.489 1.00 0.00 O ATOM 35172 P31 PGR 881 143.029 -1.111 60.888 1.00 0.00 P ATOM 35173 O32 PGR 881 141.796 -1.752 61.602 1.00 0.00 O ATOM 35174 C31 PGR 881 141.258 -2.960 61.112 1.00 0.00 C ATOM 35175 H1A PGR 881 141.942 -3.811 61.052 1.00 0.00 H ATOM 35176 H1B PGR 881 140.775 -2.863 60.137 1.00 0.00 H ATOM 35177 C32 PGR 881 140.106 -3.327 62.034 1.00 0.00 C ATOM 35178 H2A PGR 881 139.848 -4.305 61.620 1.00 0.00 H ATOM 35179 O35 PGR 881 138.933 -2.498 61.942 1.00 0.00 O ATOM 35180 HO5A PGR 881 138.449 -2.774 61.143 1.00 0.00 H ATOM 35181 C33 PGR 881 140.432 -3.344 63.577 1.00 0.00 C ATOM 35182 H3A PGR 881 141.327 -3.916 63.832 1.00 0.00 H ATOM 35183 H3B PGR 881 140.575 -2.331 63.961 1.00 0.00 H ATOM 35184 O33 PGR 881 143.959 -2.204 60.683 1.00 0.00 O ATOM 35185 O34 PGR 881 143.463 -0.019 61.793 1.00 0.00 O ATOM 35186 O21 PGR 881 140.833 0.054 57.066 1.00 0.00 O ATOM 35187 C21 PGR 881 141.469 -1.020 56.454 1.00 0.00 C ATOM 35188 O22 PGR 881 141.822 -2.070 57.029 1.00 0.00 O ATOM 35189 O36 PGR 881 139.254 -3.844 64.352 1.00 0.00 O ATOM 35190 HO6A PGR 881 139.190 -4.788 64.121 1.00 0.00 H ATOM 35191 C12 OL 882 141.581 -0.875 54.975 1.00 0.00 C ATOM 35192 H2R OL 882 141.936 -1.798 54.513 1.00 0.00 H ATOM 35193 H2S OL 882 140.543 -1.015 54.665 1.00 0.00 H ATOM 35194 C13 OL 882 142.283 0.352 54.564 1.00 0.00 C ATOM 35195 H3R OL 882 142.200 1.202 55.246 1.00 0.00 H ATOM 35196 H3S OL 882 143.321 0.062 54.739 1.00 0.00 H ATOM 35197 C14 OL 882 142.155 0.766 53.098 1.00 0.00 C ATOM 35198 H4R OL 882 141.150 1.181 53.003 1.00 0.00 H ATOM 35199 H4S OL 882 142.873 1.522 52.773 1.00 0.00 H ATOM 35200 C15 OL 882 142.320 -0.401 52.073 1.00 0.00 C ATOM 35201 H5R OL 882 143.209 -0.987 52.315 1.00 0.00 H ATOM 35202 H5S OL 882 141.516 -1.113 52.267 1.00 0.00 H ATOM 35203 C16 OL 882 142.314 -0.003 50.629 1.00 0.00 C ATOM 35204 H6R OL 882 142.276 -0.957 50.099 1.00 0.00 H ATOM 35205 H6S OL 882 141.319 0.432 50.511 1.00 0.00 H ATOM 35206 C17 OL 882 143.431 0.844 50.044 1.00 0.00 C ATOM 35207 H7R OL 882 143.481 1.759 50.638 1.00 0.00 H ATOM 35208 H7S OL 882 144.403 0.355 50.133 1.00 0.00 H ATOM 35209 C18 OL 882 143.025 1.150 48.587 1.00 0.00 C ATOM 35210 H8R OL 882 142.035 1.608 48.548 1.00 0.00 H ATOM 35211 H8S OL 882 143.780 1.833 48.191 1.00 0.00 H ATOM 35212 C19 OL 882 143.197 -0.009 47.647 1.00 0.00 C ATOM 35213 H9R OL 882 144.169 -0.496 47.668 1.00 0.00 H ATOM 35214 C110 OL 882 142.311 -0.550 46.839 1.00 0.00 C ATOM 35215 H10R OL 882 142.430 -1.439 46.225 1.00 0.00 H ATOM 35216 C111 OL 882 140.970 0.002 46.582 1.00 0.00 C ATOM 35217 H11R OL 882 140.224 -0.726 46.258 1.00 0.00 H ATOM 35218 H11S OL 882 140.560 0.245 47.564 1.00 0.00 H ATOM 35219 C112 OL 882 140.978 1.205 45.616 1.00 0.00 C ATOM 35220 H12R OL 882 140.001 1.692 45.606 1.00 0.00 H ATOM 35221 H12S OL 882 141.582 2.050 45.951 1.00 0.00 H ATOM 35222 C113 OL 882 141.482 0.886 44.210 1.00 0.00 C ATOM 35223 H13R OL 882 142.549 0.873 44.440 1.00 0.00 H ATOM 35224 H13S OL 882 141.276 -0.116 43.829 1.00 0.00 H ATOM 35225 C114 OL 882 141.197 1.979 43.164 1.00 0.00 C ATOM 35226 H14R OL 882 140.146 2.260 43.064 1.00 0.00 H ATOM 35227 H14S OL 882 141.609 2.942 43.472 1.00 0.00 H ATOM 35228 C115 OL 882 141.863 1.708 41.778 1.00 0.00 C ATOM 35229 H15R OL 882 142.930 1.739 42.007 1.00 0.00 H ATOM 35230 H15S OL 882 141.560 0.699 41.488 1.00 0.00 H ATOM 35231 C116 OL 882 141.424 2.776 40.728 1.00 0.00 C ATOM 35232 H16R OL 882 140.355 2.635 40.553 1.00 0.00 H ATOM 35233 H16S OL 882 141.564 3.793 41.100 1.00 0.00 H ATOM 35234 C117 OL 882 142.096 2.606 39.370 1.00 0.00 C ATOM 35235 H17R OL 882 143.159 2.614 39.623 1.00 0.00 H ATOM 35236 H17S OL 882 141.873 1.650 38.890 1.00 0.00 H ATOM 35237 C118 OL 882 141.719 3.674 38.338 1.00 0.00 C ATOM 35238 H18R OL 882 140.633 3.782 38.324 1.00 0.00 H ATOM 35239 H18S OL 882 142.156 3.314 37.405 1.00 0.00 H ATOM 35240 H18T OL 882 142.110 4.662 38.589 1.00 0.00 H TER 35241 OL 882 ATOM 35241 C116 PA 883 130.046 102.289 41.946 1.00 0.00 C ATOM 35242 H16R PA 883 130.701 102.948 42.521 1.00 0.00 H ATOM 35243 H16S PA 883 129.093 102.811 41.841 1.00 0.00 H ATOM 35244 H16T PA 883 130.568 102.169 40.995 1.00 0.00 H ATOM 35245 C115 PA 883 129.607 101.044 42.665 1.00 0.00 C ATOM 35246 H15R PA 883 128.737 100.499 42.292 1.00 0.00 H ATOM 35247 H15S PA 883 129.110 101.399 43.571 1.00 0.00 H ATOM 35248 C114 PA 883 130.797 100.203 43.067 1.00 0.00 C ATOM 35249 H14R PA 883 131.728 100.773 43.037 1.00 0.00 H ATOM 35250 H14S PA 883 130.956 99.461 42.281 1.00 0.00 H ATOM 35251 C113 PA 883 130.722 99.573 44.476 1.00 0.00 C ATOM 35252 H13R PA 883 131.539 98.873 44.660 1.00 0.00 H ATOM 35253 H13S PA 883 129.837 98.934 44.451 1.00 0.00 H ATOM 35254 C112 PA 883 130.616 100.624 45.610 1.00 0.00 C ATOM 35255 H12R PA 883 129.754 101.283 45.490 1.00 0.00 H ATOM 35256 H12S PA 883 131.400 101.355 45.397 1.00 0.00 H ATOM 35257 C111 PA 883 130.729 100.148 47.023 1.00 0.00 C ATOM 35258 H11R PA 883 130.590 101.062 47.605 1.00 0.00 H ATOM 35259 H11S PA 883 131.727 99.734 47.180 1.00 0.00 H ATOM 35260 C110 PA 883 129.587 99.162 47.607 1.00 0.00 C ATOM 35261 H10R PA 883 129.236 98.577 46.755 1.00 0.00 H ATOM 35262 H10S PA 883 128.793 99.885 47.807 1.00 0.00 H ATOM 35263 C19 PA 883 130.055 98.228 48.735 1.00 0.00 C ATOM 35264 H9R PA 883 130.534 98.849 49.495 1.00 0.00 H ATOM 35265 H9S PA 883 130.857 97.579 48.380 1.00 0.00 H ATOM 35266 C18 PA 883 129.047 97.261 49.211 1.00 0.00 C ATOM 35267 H8R PA 883 128.571 96.562 48.520 1.00 0.00 H ATOM 35268 H8S PA 883 128.167 97.861 49.455 1.00 0.00 H ATOM 35269 C17 PA 883 129.631 96.574 50.474 1.00 0.00 C ATOM 35270 H7R PA 883 129.935 97.332 51.199 1.00 0.00 H ATOM 35271 H7S PA 883 130.411 95.936 50.054 1.00 0.00 H ATOM 35272 C16 PA 883 128.533 95.748 51.211 1.00 0.00 C ATOM 35273 H6R PA 883 128.005 95.028 50.582 1.00 0.00 H ATOM 35274 H6S PA 883 127.837 96.470 51.644 1.00 0.00 H ATOM 35275 C15 PA 883 129.036 95.117 52.541 1.00 0.00 C ATOM 35276 H5R PA 883 129.414 95.937 53.155 1.00 0.00 H ATOM 35277 H5S PA 883 129.913 94.542 52.238 1.00 0.00 H ATOM 35278 C14 PA 883 127.998 94.219 53.273 1.00 0.00 C ATOM 35279 H4R PA 883 127.840 93.358 52.619 1.00 0.00 H ATOM 35280 H4S PA 883 127.055 94.761 53.366 1.00 0.00 H ATOM 35281 C13 PA 883 128.446 93.805 54.611 1.00 0.00 C ATOM 35282 H3R PA 883 128.385 94.704 55.227 1.00 0.00 H ATOM 35283 H3S PA 883 129.482 93.470 54.525 1.00 0.00 H ATOM 35284 C12 PA 883 127.585 92.652 55.184 1.00 0.00 C ATOM 35285 H2R PA 883 127.857 91.687 54.751 1.00 0.00 H ATOM 35286 H2S PA 883 126.566 92.965 54.948 1.00 0.00 H ATOM 35287 C11 PGR 884 127.844 92.532 56.657 1.00 0.00 C ATOM 35288 O12 PGR 884 128.152 93.455 57.348 1.00 0.00 O ATOM 35289 O11 PGR 884 127.735 91.214 56.986 1.00 0.00 O ATOM 35290 C1 PGR 884 127.554 90.709 58.364 1.00 0.00 C ATOM 35291 HR PGR 884 128.510 90.894 58.860 1.00 0.00 H ATOM 35292 HS PGR 884 127.389 89.630 58.295 1.00 0.00 H ATOM 35293 C2 PGR 884 126.287 91.271 59.128 1.00 0.00 C ATOM 35294 HX PGR 884 126.301 92.356 58.999 1.00 0.00 H ATOM 35295 C3 PGR 884 126.371 90.919 60.676 1.00 0.00 C ATOM 35296 HA PGR 884 125.517 91.237 61.280 1.00 0.00 H ATOM 35297 HB PGR 884 127.178 91.582 60.997 1.00 0.00 H ATOM 35298 O31 PGR 884 126.693 89.580 60.993 1.00 0.00 O ATOM 35299 P31 PGR 884 126.650 89.255 62.545 1.00 0.00 P ATOM 35300 O32 PGR 884 125.196 89.568 63.031 1.00 0.00 O ATOM 35301 C31 PGR 884 124.114 88.734 62.701 1.00 0.00 C ATOM 35302 H1A PGR 884 123.368 88.827 63.494 1.00 0.00 H ATOM 35303 H1B PGR 884 124.355 87.669 62.728 1.00 0.00 H ATOM 35304 C32 PGR 884 123.462 89.176 61.387 1.00 0.00 C ATOM 35305 H2A PGR 884 124.099 89.175 60.498 1.00 0.00 H ATOM 35306 O35 PGR 884 122.959 90.529 61.486 1.00 0.00 O ATOM 35307 HO5A PGR 884 122.519 90.681 60.631 1.00 0.00 H ATOM 35308 C33 PGR 884 122.280 88.088 61.227 1.00 0.00 C ATOM 35309 H3A PGR 884 122.652 87.080 61.427 1.00 0.00 H ATOM 35310 H3B PGR 884 121.467 88.365 61.904 1.00 0.00 H ATOM 35311 O33 PGR 884 126.887 87.783 62.845 1.00 0.00 O ATOM 35312 O34 PGR 884 127.534 90.233 63.218 1.00 0.00 O ATOM 35313 O21 PGR 884 124.985 90.761 58.712 1.00 0.00 O ATOM 35314 C21 PGR 884 124.216 91.425 57.804 1.00 0.00 C ATOM 35315 O22 PGR 884 124.537 92.517 57.397 1.00 0.00 O ATOM 35316 O36 PGR 884 121.796 88.208 59.880 1.00 0.00 O ATOM 35317 HO6A PGR 884 121.446 89.117 59.867 1.00 0.00 H ATOM 35318 C12 OL 885 122.934 90.743 57.363 1.00 0.00 C ATOM 35319 H2R OL 885 122.944 89.734 57.781 1.00 0.00 H ATOM 35320 H2S OL 885 122.074 91.319 57.712 1.00 0.00 H ATOM 35321 C13 OL 885 122.615 90.932 55.936 1.00 0.00 C ATOM 35322 H3R OL 885 122.334 91.956 55.681 1.00 0.00 H ATOM 35323 H3S OL 885 123.514 90.609 55.407 1.00 0.00 H ATOM 35324 C14 OL 885 121.462 89.954 55.655 1.00 0.00 C ATOM 35325 H4R OL 885 121.633 88.924 55.976 1.00 0.00 H ATOM 35326 H4S OL 885 120.550 90.287 56.155 1.00 0.00 H ATOM 35327 C15 OL 885 121.108 89.896 54.224 1.00 0.00 C ATOM 35328 H5R OL 885 122.000 89.983 53.601 1.00 0.00 H ATOM 35329 H5S OL 885 120.670 88.897 54.166 1.00 0.00 H ATOM 35330 C16 OL 885 120.053 90.916 53.801 1.00 0.00 C ATOM 35331 H6R OL 885 119.100 90.809 54.323 1.00 0.00 H ATOM 35332 H6S OL 885 120.420 91.893 54.122 1.00 0.00 H ATOM 35333 C17 OL 885 119.806 90.992 52.334 1.00 0.00 C ATOM 35334 H7R OL 885 119.116 91.821 52.164 1.00 0.00 H ATOM 35335 H7S OL 885 120.766 91.280 51.901 1.00 0.00 H ATOM 35336 C18 OL 885 119.301 89.774 51.654 1.00 0.00 C ATOM 35337 H8R OL 885 120.110 89.088 51.392 1.00 0.00 H ATOM 35338 H8S OL 885 118.562 89.195 52.211 1.00 0.00 H ATOM 35339 C19 OL 885 118.599 90.105 50.314 1.00 0.00 C ATOM 35340 H9R OL 885 118.282 91.145 50.291 1.00 0.00 H ATOM 35341 C110 OL 885 118.455 89.370 49.208 1.00 0.00 C ATOM 35342 H10R OL 885 117.848 89.755 48.393 1.00 0.00 H ATOM 35343 C111 OL 885 118.890 87.944 48.964 1.00 0.00 C ATOM 35344 H11R OL 885 119.213 87.466 49.891 1.00 0.00 H ATOM 35345 H11S OL 885 118.113 87.411 48.412 1.00 0.00 H ATOM 35346 C112 OL 885 120.094 87.975 48.033 1.00 0.00 C ATOM 35347 H12R OL 885 120.962 88.493 48.447 1.00 0.00 H ATOM 35348 H12S OL 885 120.434 86.959 47.823 1.00 0.00 H ATOM 35349 C113 OL 885 119.749 88.527 46.588 1.00 0.00 C ATOM 35350 H13R OL 885 119.517 89.592 46.661 1.00 0.00 H ATOM 35351 H13S OL 885 120.621 88.303 45.971 1.00 0.00 H ATOM 35352 C114 OL 885 118.610 87.809 45.843 1.00 0.00 C ATOM 35353 H14R OL 885 118.966 86.784 45.718 1.00 0.00 H ATOM 35354 H14S OL 885 117.769 87.856 46.538 1.00 0.00 H ATOM 35355 C115 OL 885 118.240 88.482 44.509 1.00 0.00 C ATOM 35356 H15R OL 885 117.188 88.371 44.238 1.00 0.00 H ATOM 35357 H15S OL 885 118.273 89.569 44.607 1.00 0.00 H ATOM 35358 C116 OL 885 119.246 88.369 43.327 1.00 0.00 C ATOM 35359 H16R OL 885 120.228 88.438 43.800 1.00 0.00 H ATOM 35360 H16S OL 885 119.058 87.332 43.042 1.00 0.00 H ATOM 35361 C117 OL 885 119.320 89.433 42.198 1.00 0.00 C ATOM 35362 H17R OL 885 119.829 90.296 42.632 1.00 0.00 H ATOM 35363 H17S OL 885 120.003 89.037 41.443 1.00 0.00 H ATOM 35364 C118 OL 885 117.861 89.569 41.807 1.00 0.00 C ATOM 35365 H18R OL 885 117.290 88.657 41.623 1.00 0.00 H ATOM 35366 H18S OL 885 117.747 90.061 40.838 1.00 0.00 H ATOM 35367 H18T OL 885 117.334 90.196 42.528 1.00 0.00 H TER 35368 OL 885 ATOM 35368 C116 PA 886 140.421 117.349 42.033 1.00 0.00 C ATOM 35369 H16R PA 886 139.374 117.426 41.730 1.00 0.00 H ATOM 35370 H16S PA 886 140.847 116.809 41.185 1.00 0.00 H ATOM 35371 H16T PA 886 140.820 118.354 42.184 1.00 0.00 H ATOM 35372 C115 PA 886 140.555 116.585 43.273 1.00 0.00 C ATOM 35373 H15R PA 886 141.626 116.688 43.459 1.00 0.00 H ATOM 35374 H15S PA 886 140.404 115.520 43.084 1.00 0.00 H ATOM 35375 C114 PA 886 139.631 117.232 44.398 1.00 0.00 C ATOM 35376 H14R PA 886 139.683 116.572 45.266 1.00 0.00 H ATOM 35377 H14S PA 886 138.601 117.162 44.041 1.00 0.00 H ATOM 35378 C113 PA 886 140.027 118.578 44.904 1.00 0.00 C ATOM 35379 H13R PA 886 140.301 119.192 44.044 1.00 0.00 H ATOM 35380 H13S PA 886 140.802 118.461 45.664 1.00 0.00 H ATOM 35381 C112 PA 886 138.770 119.325 45.478 1.00 0.00 C ATOM 35382 H12R PA 886 138.161 118.611 46.036 1.00 0.00 H ATOM 35383 H12S PA 886 138.254 119.624 44.564 1.00 0.00 H ATOM 35384 C111 PA 886 139.189 120.548 46.371 1.00 0.00 C ATOM 35385 H11R PA 886 138.248 120.857 46.830 1.00 0.00 H ATOM 35386 H11S PA 886 139.565 121.390 45.786 1.00 0.00 H ATOM 35387 C110 PA 886 140.053 120.336 47.607 1.00 0.00 C ATOM 35388 H10R PA 886 140.992 119.956 47.199 1.00 0.00 H ATOM 35389 H10S PA 886 139.644 119.476 48.142 1.00 0.00 H ATOM 35390 C19 PA 886 140.149 121.622 48.388 1.00 0.00 C ATOM 35391 H9R PA 886 139.231 122.214 48.361 1.00 0.00 H ATOM 35392 H9S PA 886 140.967 122.200 47.955 1.00 0.00 H ATOM 35393 C18 PA 886 140.673 121.346 49.823 1.00 0.00 C ATOM 35394 H8R PA 886 141.716 121.055 49.686 1.00 0.00 H ATOM 35395 H8S PA 886 140.122 120.505 50.248 1.00 0.00 H ATOM 35396 C17 PA 886 140.590 122.594 50.735 1.00 0.00 C ATOM 35397 H7R PA 886 139.630 123.111 50.671 1.00 0.00 H ATOM 35398 H7S PA 886 141.288 123.399 50.498 1.00 0.00 H ATOM 35399 C16 PA 886 140.874 122.160 52.174 1.00 0.00 C ATOM 35400 H6R PA 886 141.899 121.786 52.231 1.00 0.00 H ATOM 35401 H6S PA 886 140.317 121.271 52.476 1.00 0.00 H ATOM 35402 C15 PA 886 140.804 123.224 53.209 1.00 0.00 C ATOM 35403 H5R PA 886 139.997 123.897 52.913 1.00 0.00 H ATOM 35404 H5S PA 886 141.637 123.881 52.952 1.00 0.00 H ATOM 35405 C14 PA 886 140.792 122.824 54.703 1.00 0.00 C ATOM 35406 H4R PA 886 141.618 122.135 54.892 1.00 0.00 H ATOM 35407 H4S PA 886 139.924 122.202 54.933 1.00 0.00 H ATOM 35408 C13 PA 886 140.972 123.970 55.769 1.00 0.00 C ATOM 35409 H3R PA 886 141.227 123.580 56.756 1.00 0.00 H ATOM 35410 H3S PA 886 139.994 124.410 55.974 1.00 0.00 H ATOM 35411 C12 PA 886 141.951 124.958 55.424 1.00 0.00 C ATOM 35412 H2R PA 886 141.625 125.456 54.509 1.00 0.00 H ATOM 35413 H2S PA 886 142.901 124.460 55.217 1.00 0.00 H ATOM 35414 C11 PGR 887 142.171 125.950 56.539 1.00 0.00 C ATOM 35415 O12 PGR 887 143.233 125.998 57.108 1.00 0.00 O ATOM 35416 O11 PGR 887 141.175 126.644 56.862 1.00 0.00 O ATOM 35417 C1 PGR 887 141.313 127.475 57.974 1.00 0.00 C ATOM 35418 HR PGR 887 141.718 126.865 58.785 1.00 0.00 H ATOM 35419 HS PGR 887 140.332 127.773 58.351 1.00 0.00 H ATOM 35420 C2 PGR 887 142.243 128.694 57.716 1.00 0.00 C ATOM 35421 HX PGR 887 143.176 128.312 57.294 1.00 0.00 H ATOM 35422 C3 PGR 887 142.482 129.539 58.950 1.00 0.00 C ATOM 35423 HA PGR 887 143.243 130.295 58.738 1.00 0.00 H ATOM 35424 HB PGR 887 142.892 128.890 59.728 1.00 0.00 H ATOM 35425 O31 PGR 887 141.253 130.012 59.445 1.00 0.00 O ATOM 35426 P31 PGR 887 141.177 130.687 60.901 1.00 0.00 P ATOM 35427 O32 PGR 887 141.351 129.481 62.007 1.00 0.00 O ATOM 35428 C31 PGR 887 140.532 128.336 61.904 1.00 0.00 C ATOM 35429 H1A PGR 887 140.508 127.938 60.886 1.00 0.00 H ATOM 35430 H1B PGR 887 139.482 128.609 62.034 1.00 0.00 H ATOM 35431 C32 PGR 887 140.956 127.224 62.889 1.00 0.00 C ATOM 35432 H2A PGR 887 141.082 127.732 63.849 1.00 0.00 H ATOM 35433 O35 PGR 887 142.230 126.654 62.526 1.00 0.00 O ATOM 35434 HO5A PGR 887 142.765 127.460 62.641 1.00 0.00 H ATOM 35435 C33 PGR 887 139.889 126.135 63.022 1.00 0.00 C ATOM 35436 H3A PGR 887 138.852 126.440 63.186 1.00 0.00 H ATOM 35437 H3B PGR 887 139.853 125.451 62.170 1.00 0.00 H ATOM 35438 O33 PGR 887 142.403 131.501 61.038 1.00 0.00 O ATOM 35439 O34 PGR 887 139.844 131.320 61.045 1.00 0.00 O ATOM 35440 O21 PGR 887 141.611 129.386 56.601 1.00 0.00 O ATOM 35441 C21 PGR 887 142.322 130.244 55.825 1.00 0.00 C ATOM 35442 O22 PGR 887 143.531 130.369 55.938 1.00 0.00 O ATOM 35443 O36 PGR 887 140.214 125.341 64.108 1.00 0.00 O ATOM 35444 HO6A PGR 887 141.134 125.635 64.237 1.00 0.00 H ATOM 35445 C12 OL 888 141.579 131.192 55.032 1.00 0.00 C ATOM 35446 H2R OL 888 140.880 130.610 54.427 1.00 0.00 H ATOM 35447 H2S OL 888 140.967 131.773 55.724 1.00 0.00 H ATOM 35448 C13 OL 888 142.413 132.029 54.111 1.00 0.00 C ATOM 35449 H3R OL 888 143.289 132.460 54.601 1.00 0.00 H ATOM 35450 H3S OL 888 142.786 131.483 53.242 1.00 0.00 H ATOM 35451 C14 OL 888 141.604 133.243 53.602 1.00 0.00 C ATOM 35452 H4R OL 888 140.724 132.790 53.141 1.00 0.00 H ATOM 35453 H4S OL 888 141.254 133.908 54.394 1.00 0.00 H ATOM 35454 C15 OL 888 142.309 134.038 52.508 1.00 0.00 C ATOM 35455 H5R OL 888 143.066 134.704 52.928 1.00 0.00 H ATOM 35456 H5S OL 888 142.968 133.301 52.044 1.00 0.00 H ATOM 35457 C16 OL 888 141.379 134.870 51.598 1.00 0.00 C ATOM 35458 H6R OL 888 140.750 134.182 51.029 1.00 0.00 H ATOM 35459 H6S OL 888 140.826 135.519 52.281 1.00 0.00 H ATOM 35460 C17 OL 888 142.097 135.610 50.450 1.00 0.00 C ATOM 35461 H7R OL 888 142.835 136.271 50.909 1.00 0.00 H ATOM 35462 H7S OL 888 142.704 134.909 49.873 1.00 0.00 H ATOM 35463 C18 OL 888 141.107 136.411 49.589 1.00 0.00 C ATOM 35464 H8R OL 888 140.291 135.745 49.298 1.00 0.00 H ATOM 35465 H8S OL 888 140.751 137.253 50.187 1.00 0.00 H ATOM 35466 C19 OL 888 141.744 137.029 48.377 1.00 0.00 C ATOM 35467 H9R OL 888 142.671 137.577 48.530 1.00 0.00 H ATOM 35468 C110 OL 888 141.183 137.113 47.167 1.00 0.00 C ATOM 35469 H10R OL 888 141.764 137.610 46.394 1.00 0.00 H ATOM 35470 C111 OL 888 139.911 136.451 46.712 1.00 0.00 C ATOM 35471 H11R OL 888 140.220 135.489 46.297 1.00 0.00 H ATOM 35472 H11S OL 888 139.184 136.226 47.496 1.00 0.00 H ATOM 35473 C112 OL 888 139.406 137.496 45.721 1.00 0.00 C ATOM 35474 H12R OL 888 139.128 138.395 46.276 1.00 0.00 H ATOM 35475 H12S OL 888 140.164 137.894 45.042 1.00 0.00 H ATOM 35476 C113 OL 888 138.304 137.042 44.837 1.00 0.00 C ATOM 35477 H13R OL 888 138.774 136.326 44.159 1.00 0.00 H ATOM 35478 H13S OL 888 137.622 136.388 45.385 1.00 0.00 H ATOM 35479 C114 OL 888 137.478 138.184 44.245 1.00 0.00 C ATOM 35480 H14R OL 888 136.909 138.518 45.115 1.00 0.00 H ATOM 35481 H14S OL 888 138.184 138.821 43.707 1.00 0.00 H ATOM 35482 C115 OL 888 136.363 137.752 43.392 1.00 0.00 C ATOM 35483 H15R OL 888 136.684 137.131 42.553 1.00 0.00 H ATOM 35484 H15S OL 888 135.722 137.192 44.076 1.00 0.00 H ATOM 35485 C116 OL 888 135.427 138.832 42.823 1.00 0.00 C ATOM 35486 H16R OL 888 135.037 139.500 43.593 1.00 0.00 H ATOM 35487 H16S OL 888 136.019 139.527 42.224 1.00 0.00 H ATOM 35488 C117 OL 888 134.300 138.382 41.998 1.00 0.00 C ATOM 35489 H17R OL 888 133.708 137.581 42.445 1.00 0.00 H ATOM 35490 H17S OL 888 133.694 139.289 41.938 1.00 0.00 H ATOM 35491 C118 OL 888 134.630 137.858 40.582 1.00 0.00 C ATOM 35492 H18R OL 888 133.702 137.556 40.092 1.00 0.00 H ATOM 35493 H18S OL 888 135.308 137.006 40.670 1.00 0.00 H ATOM 35494 H18T OL 888 135.000 138.762 40.093 1.00 0.00 H TER 35495 OL 888 ATOM 35495 C116 PA 889 144.571 7.407 38.226 1.00 0.00 C ATOM 35496 H16R PA 889 143.768 7.483 38.962 1.00 0.00 H ATOM 35497 H16S PA 889 144.266 6.609 37.546 1.00 0.00 H ATOM 35498 H16T PA 889 144.634 8.339 37.662 1.00 0.00 H ATOM 35499 C115 PA 889 145.941 7.065 38.929 1.00 0.00 C ATOM 35500 H15R PA 889 146.193 8.029 39.376 1.00 0.00 H ATOM 35501 H15S PA 889 146.660 6.987 38.111 1.00 0.00 H ATOM 35502 C114 PA 889 145.991 5.858 39.831 1.00 0.00 C ATOM 35503 H14R PA 889 147.026 5.676 40.128 1.00 0.00 H ATOM 35504 H14S PA 889 145.886 4.937 39.253 1.00 0.00 H ATOM 35505 C113 PA 889 145.026 5.956 41.032 1.00 0.00 C ATOM 35506 H13R PA 889 144.024 5.897 40.601 1.00 0.00 H ATOM 35507 H13S PA 889 145.010 6.975 41.424 1.00 0.00 H ATOM 35508 C112 PA 889 145.197 4.855 42.059 1.00 0.00 C ATOM 35509 H12R PA 889 146.228 4.799 42.414 1.00 0.00 H ATOM 35510 H12S PA 889 145.037 3.858 41.642 1.00 0.00 H ATOM 35511 C111 PA 889 144.194 5.087 43.306 1.00 0.00 C ATOM 35512 H11R PA 889 143.145 4.857 43.112 1.00 0.00 H ATOM 35513 H11S PA 889 144.098 6.124 43.634 1.00 0.00 H ATOM 35514 C110 PA 889 144.561 4.072 44.461 1.00 0.00 C ATOM 35515 H10R PA 889 145.653 4.110 44.448 1.00 0.00 H ATOM 35516 H10S PA 889 144.365 3.056 44.113 1.00 0.00 H ATOM 35517 C19 PA 889 143.933 4.422 45.854 1.00 0.00 C ATOM 35518 H9R PA 889 142.901 4.132 46.061 1.00 0.00 H ATOM 35519 H9S PA 889 143.835 5.510 45.875 1.00 0.00 H ATOM 35520 C18 PA 889 144.877 4.161 46.971 1.00 0.00 C ATOM 35521 H8R PA 889 145.922 4.418 46.784 1.00 0.00 H ATOM 35522 H8S PA 889 144.767 3.075 47.023 1.00 0.00 H ATOM 35523 C17 PA 889 144.488 4.850 48.201 1.00 0.00 C ATOM 35524 H7R PA 889 143.424 4.697 48.392 1.00 0.00 H ATOM 35525 H7S PA 889 144.656 5.922 48.077 1.00 0.00 H ATOM 35526 C16 PA 889 145.282 4.570 49.487 1.00 0.00 C ATOM 35527 H6R PA 889 146.269 4.631 49.022 1.00 0.00 H ATOM 35528 H6S PA 889 145.204 3.549 49.867 1.00 0.00 H ATOM 35529 C15 PA 889 145.065 5.471 50.694 1.00 0.00 C ATOM 35530 H5R PA 889 144.050 5.178 50.970 1.00 0.00 H ATOM 35531 H5S PA 889 145.137 6.480 50.283 1.00 0.00 H ATOM 35532 C14 PA 889 146.036 5.227 51.847 1.00 0.00 C ATOM 35533 H4R PA 889 147.087 5.438 51.644 1.00 0.00 H ATOM 35534 H4S PA 889 145.989 4.146 51.995 1.00 0.00 H ATOM 35535 C13 PA 889 145.543 5.856 53.182 1.00 0.00 C ATOM 35536 H3R PA 889 145.361 6.920 53.019 1.00 0.00 H ATOM 35537 H3S PA 889 146.380 5.827 53.883 1.00 0.00 H ATOM 35538 C12 PA 889 144.232 5.287 53.777 1.00 0.00 C ATOM 35539 H2R PA 889 144.420 4.258 54.089 1.00 0.00 H ATOM 35540 H2S PA 889 143.390 5.233 53.084 1.00 0.00 H ATOM 35541 C11 PC 890 143.848 6.167 54.952 1.00 0.00 C ATOM 35542 O12 PC 890 143.610 7.342 54.852 1.00 0.00 O ATOM 35543 O11 PC 890 143.917 5.453 56.092 1.00 0.00 O ATOM 35544 C1 PC 890 143.617 5.934 57.409 1.00 0.00 C ATOM 35545 HR PC 890 143.824 7.001 57.532 1.00 0.00 H ATOM 35546 HS PC 890 144.338 5.515 58.116 1.00 0.00 H ATOM 35547 C2 PC 890 142.121 5.679 57.803 1.00 0.00 C ATOM 35548 HX PC 890 141.945 6.270 58.706 1.00 0.00 H ATOM 35549 C3 PC 890 141.950 4.223 58.161 1.00 0.00 C ATOM 35550 HA PC 890 142.775 4.004 58.844 1.00 0.00 H ATOM 35551 HB PC 890 142.114 3.707 57.211 1.00 0.00 H ATOM 35552 O31 PC 890 140.743 3.974 58.841 1.00 0.00 O ATOM 35553 P31 PC 890 140.532 4.108 60.359 1.00 0.00 P ATOM 35554 O32 PC 890 138.971 3.659 60.658 1.00 0.00 O ATOM 35555 C31 PC 890 137.964 4.625 60.496 1.00 0.00 C ATOM 35556 H1A PC 890 137.949 5.031 59.481 1.00 0.00 H ATOM 35557 H1B PC 890 138.143 5.452 61.187 1.00 0.00 H ATOM 35558 C32 PC 890 136.547 3.993 60.766 1.00 0.00 C ATOM 35559 H2A PC 890 136.552 3.098 60.141 1.00 0.00 H ATOM 35560 H2B PC 890 135.819 4.703 60.370 1.00 0.00 H ATOM 35561 N31 PC 890 136.073 3.711 62.139 1.00 0.00 N ATOM 35562 C33 PC 890 135.898 4.872 62.955 1.00 0.00 C ATOM 35563 H3A PC 890 135.665 4.500 63.954 1.00 0.00 H ATOM 35564 H3B PC 890 135.132 5.520 62.527 1.00 0.00 H ATOM 35565 H3C PC 890 136.848 5.406 63.000 1.00 0.00 H ATOM 35566 C34 PC 890 134.733 3.107 61.935 1.00 0.00 C ATOM 35567 H4A PC 890 134.747 2.323 61.176 1.00 0.00 H ATOM 35568 H4B PC 890 134.045 3.857 61.542 1.00 0.00 H ATOM 35569 H4C PC 890 134.400 2.854 62.943 1.00 0.00 H ATOM 35570 C35 PC 890 136.921 2.735 62.873 1.00 0.00 C ATOM 35571 H5A PC 890 137.273 2.101 62.058 1.00 0.00 H ATOM 35572 H5B PC 890 136.196 2.256 63.532 1.00 0.00 H ATOM 35573 H5C PC 890 137.740 3.133 63.475 1.00 0.00 H ATOM 35574 O33 PC 890 141.489 3.217 61.034 1.00 0.00 O ATOM 35575 O34 PC 890 140.604 5.561 60.616 1.00 0.00 O ATOM 35576 O21 PC 890 141.192 6.015 56.677 1.00 0.00 O ATOM 35577 C21 PC 890 141.093 7.265 56.295 1.00 0.00 C ATOM 35578 O22 PC 890 141.485 8.241 56.944 1.00 0.00 O ATOM 35579 C12 OL 891 140.148 7.252 55.067 1.00 0.00 C ATOM 35580 H2R OL 891 139.960 6.234 54.718 1.00 0.00 H ATOM 35581 H2S OL 891 139.192 7.543 55.506 1.00 0.00 H ATOM 35582 C13 OL 891 140.510 8.175 53.930 1.00 0.00 C ATOM 35583 H3R OL 891 140.802 9.121 54.392 1.00 0.00 H ATOM 35584 H3S OL 891 141.481 7.816 53.584 1.00 0.00 H ATOM 35585 C14 OL 891 139.454 8.375 52.745 1.00 0.00 C ATOM 35586 H4R OL 891 139.389 7.436 52.191 1.00 0.00 H ATOM 35587 H4S OL 891 138.460 8.613 53.129 1.00 0.00 H ATOM 35588 C15 OL 891 140.084 9.354 51.758 1.00 0.00 C ATOM 35589 H5R OL 891 140.390 10.278 52.253 1.00 0.00 H ATOM 35590 H5S OL 891 141.078 9.028 51.445 1.00 0.00 H ATOM 35591 C16 OL 891 139.302 9.837 50.505 1.00 0.00 C ATOM 35592 H6R OL 891 138.700 9.005 50.133 1.00 0.00 H ATOM 35593 H6S OL 891 138.718 10.749 50.650 1.00 0.00 H ATOM 35594 C17 OL 891 140.295 10.162 49.385 1.00 0.00 C ATOM 35595 H7R OL 891 140.891 10.894 49.935 1.00 0.00 H ATOM 35596 H7S OL 891 140.886 9.260 49.210 1.00 0.00 H ATOM 35597 C18 OL 891 139.675 10.625 48.041 1.00 0.00 C ATOM 35598 H8R OL 891 138.873 9.978 47.681 1.00 0.00 H ATOM 35599 H8S OL 891 139.125 11.506 48.379 1.00 0.00 H ATOM 35600 C19 OL 891 140.628 11.133 47.026 1.00 0.00 C ATOM 35601 H9R OL 891 141.403 11.736 47.492 1.00 0.00 H ATOM 35602 C110 OL 891 140.732 10.919 45.710 1.00 0.00 C ATOM 35603 H10R OL 891 141.566 11.321 45.140 1.00 0.00 H ATOM 35604 C111 OL 891 139.774 10.171 44.912 1.00 0.00 C ATOM 35605 H11R OL 891 140.141 9.255 44.446 1.00 0.00 H ATOM 35606 H11S OL 891 138.944 9.969 45.593 1.00 0.00 H ATOM 35607 C112 OL 891 139.263 10.992 43.704 1.00 0.00 C ATOM 35608 H12R OL 891 139.046 12.012 44.029 1.00 0.00 H ATOM 35609 H12S OL 891 140.076 11.202 43.007 1.00 0.00 H ATOM 35610 C113 OL 891 138.149 10.349 42.844 1.00 0.00 C ATOM 35611 H13R OL 891 138.477 9.331 42.624 1.00 0.00 H ATOM 35612 H13S OL 891 137.339 10.356 43.575 1.00 0.00 H ATOM 35613 C114 OL 891 137.702 11.023 41.521 1.00 0.00 C ATOM 35614 H14R OL 891 138.458 10.791 40.768 1.00 0.00 H ATOM 35615 H14S OL 891 136.712 10.665 41.232 1.00 0.00 H ATOM 35616 C115 OL 891 137.447 12.470 41.624 1.00 0.00 C ATOM 35617 H15R OL 891 136.448 12.630 42.036 1.00 0.00 H ATOM 35618 H15S OL 891 138.119 13.045 42.264 1.00 0.00 H ATOM 35619 C116 OL 891 137.613 12.989 40.203 1.00 0.00 C ATOM 35620 H16R OL 891 138.669 13.055 39.934 1.00 0.00 H ATOM 35621 H16S OL 891 137.036 12.342 39.540 1.00 0.00 H ATOM 35622 C117 OL 891 137.091 14.386 40.156 1.00 0.00 C ATOM 35623 H17R OL 891 136.106 14.464 40.622 1.00 0.00 H ATOM 35624 H17S OL 891 137.627 15.044 40.842 1.00 0.00 H ATOM 35625 C118 OL 891 137.190 15.045 38.743 1.00 0.00 C ATOM 35626 H18R OL 891 136.861 16.084 38.675 1.00 0.00 H ATOM 35627 H18S OL 891 136.634 14.400 38.060 1.00 0.00 H ATOM 35628 H18T OL 891 138.205 15.070 38.339 1.00 0.00 H TER 35629 OL 891 ATOM 35629 C116 PA 892 129.246 140.989 43.173 1.00 0.00 C ATOM 35630 H16R PA 892 128.379 141.424 42.671 1.00 0.00 H ATOM 35631 H16S PA 892 130.067 141.623 42.831 1.00 0.00 H ATOM 35632 H16T PA 892 128.937 141.117 44.212 1.00 0.00 H ATOM 35633 C115 PA 892 129.527 139.507 42.898 1.00 0.00 C ATOM 35634 H15R PA 892 129.709 139.406 41.826 1.00 0.00 H ATOM 35635 H15S PA 892 128.751 138.824 43.249 1.00 0.00 H ATOM 35636 C114 PA 892 130.795 139.011 43.526 1.00 0.00 C ATOM 35637 H14R PA 892 131.663 139.654 43.372 1.00 0.00 H ATOM 35638 H14S PA 892 131.087 138.076 43.043 1.00 0.00 H ATOM 35639 C113 PA 892 130.845 138.939 44.980 1.00 0.00 C ATOM 35640 H13R PA 892 129.950 138.594 45.501 1.00 0.00 H ATOM 35641 H13S PA 892 131.026 139.960 45.322 1.00 0.00 H ATOM 35642 C112 PA 892 132.079 138.131 45.396 1.00 0.00 C ATOM 35643 H12R PA 892 132.917 138.105 44.696 1.00 0.00 H ATOM 35644 H12S PA 892 131.916 137.053 45.333 1.00 0.00 H ATOM 35645 C111 PA 892 132.633 138.213 46.869 1.00 0.00 C ATOM 35646 H11R PA 892 132.135 137.509 47.539 1.00 0.00 H ATOM 35647 H11S PA 892 132.324 139.167 47.302 1.00 0.00 H ATOM 35648 C110 PA 892 134.169 138.170 47.005 1.00 0.00 C ATOM 35649 H10R PA 892 134.508 139.055 46.463 1.00 0.00 H ATOM 35650 H10S PA 892 134.509 137.273 46.483 1.00 0.00 H ATOM 35651 C19 PA 892 134.677 138.208 48.408 1.00 0.00 C ATOM 35652 H9R PA 892 133.949 137.716 49.056 1.00 0.00 H ATOM 35653 H9S PA 892 134.840 139.226 48.768 1.00 0.00 H ATOM 35654 C18 PA 892 136.067 137.582 48.594 1.00 0.00 C ATOM 35655 H8R PA 892 136.710 138.259 48.027 1.00 0.00 H ATOM 35656 H8S PA 892 136.110 136.723 47.921 1.00 0.00 H ATOM 35657 C17 PA 892 136.652 137.407 49.994 1.00 0.00 C ATOM 35658 H7R PA 892 137.480 136.696 50.025 1.00 0.00 H ATOM 35659 H7S PA 892 135.949 136.841 50.608 1.00 0.00 H ATOM 35660 C16 PA 892 137.143 138.802 50.647 1.00 0.00 C ATOM 35661 H6R PA 892 136.323 139.498 50.454 1.00 0.00 H ATOM 35662 H6S PA 892 138.060 139.162 50.176 1.00 0.00 H ATOM 35663 C15 PA 892 137.428 138.597 52.099 1.00 0.00 C ATOM 35664 H5R PA 892 138.064 137.713 52.186 1.00 0.00 H ATOM 35665 H5S PA 892 136.553 138.485 52.741 1.00 0.00 H ATOM 35666 C14 PA 892 138.176 139.808 52.800 1.00 0.00 C ATOM 35667 H4R PA 892 137.581 140.715 52.675 1.00 0.00 H ATOM 35668 H4S PA 892 139.112 140.003 52.272 1.00 0.00 H ATOM 35669 C13 PA 892 138.354 139.812 54.316 1.00 0.00 C ATOM 35670 H3R PA 892 138.825 138.892 54.669 1.00 0.00 H ATOM 35671 H3S PA 892 137.352 139.704 54.737 1.00 0.00 H ATOM 35672 C12 PA 892 139.153 141.023 54.779 1.00 0.00 C ATOM 35673 H2R PA 892 138.722 141.933 54.354 1.00 0.00 H ATOM 35674 H2S PA 892 140.174 140.992 54.392 1.00 0.00 H ATOM 35675 C11 PC 893 139.213 141.007 56.292 1.00 0.00 C ATOM 35676 O12 PC 893 138.560 141.794 56.967 1.00 0.00 O ATOM 35677 O11 PC 893 139.971 140.043 56.802 1.00 0.00 O ATOM 35678 C1 PC 893 140.074 140.100 58.250 1.00 0.00 C ATOM 35679 HR PC 893 139.085 140.415 58.592 1.00 0.00 H ATOM 35680 HS PC 893 140.733 140.934 58.505 1.00 0.00 H ATOM 35681 C2 PC 893 140.555 138.685 58.728 1.00 0.00 C ATOM 35682 HX PC 893 139.756 137.994 58.447 1.00 0.00 H ATOM 35683 C3 PC 893 140.801 138.647 60.221 1.00 0.00 C ATOM 35684 HA PC 893 141.134 137.643 60.495 1.00 0.00 H ATOM 35685 HB PC 893 139.907 138.961 60.767 1.00 0.00 H ATOM 35686 O31 PC 893 141.878 139.554 60.512 1.00 0.00 O ATOM 35687 P31 PC 893 142.797 139.287 61.790 1.00 0.00 P ATOM 35688 O32 PC 893 143.326 137.829 61.589 1.00 0.00 O ATOM 35689 C31 PC 893 144.275 137.559 60.621 1.00 0.00 C ATOM 35690 H1A PC 893 145.185 138.142 60.786 1.00 0.00 H ATOM 35691 H1B PC 893 143.919 137.805 59.617 1.00 0.00 H ATOM 35692 C32 PC 893 144.448 136.045 60.837 1.00 0.00 C ATOM 35693 H2A PC 893 145.007 135.824 59.926 1.00 0.00 H ATOM 35694 H2B PC 893 143.465 135.575 60.789 1.00 0.00 H ATOM 35695 N31 PC 893 145.252 135.527 62.010 1.00 0.00 N ATOM 35696 C33 PC 893 145.668 134.139 61.905 1.00 0.00 C ATOM 35697 H3A PC 893 146.405 134.140 61.101 1.00 0.00 H ATOM 35698 H3B PC 893 144.889 133.436 61.604 1.00 0.00 H ATOM 35699 H3C PC 893 146.201 133.855 62.813 1.00 0.00 H ATOM 35700 C34 PC 893 146.481 136.358 62.346 1.00 0.00 C ATOM 35701 H4A PC 893 147.176 136.352 61.505 1.00 0.00 H ATOM 35702 H4B PC 893 146.991 135.866 63.175 1.00 0.00 H ATOM 35703 H4C PC 893 146.167 137.371 62.602 1.00 0.00 H ATOM 35704 C35 PC 893 144.275 135.483 63.239 1.00 0.00 C ATOM 35705 H5A PC 893 144.659 135.037 64.158 1.00 0.00 H ATOM 35706 H5B PC 893 143.319 134.993 63.048 1.00 0.00 H ATOM 35707 H5C PC 893 144.204 136.548 63.466 1.00 0.00 H ATOM 35708 O33 PC 893 144.039 140.146 61.755 1.00 0.00 O ATOM 35709 O34 PC 893 141.902 139.290 63.017 1.00 0.00 O ATOM 35710 O21 PC 893 141.789 138.293 58.118 1.00 0.00 O ATOM 35711 C21 PC 893 141.952 137.112 57.482 1.00 0.00 C ATOM 35712 O22 PC 893 141.097 136.229 57.466 1.00 0.00 O ATOM 35713 C12 OL 894 143.195 136.945 56.802 1.00 0.00 C ATOM 35714 H2R OL 894 144.019 137.452 57.310 1.00 0.00 H ATOM 35715 H2S OL 894 143.482 135.922 57.053 1.00 0.00 H ATOM 35716 C13 OL 894 143.045 137.132 55.295 1.00 0.00 C ATOM 35717 H3R OL 894 143.963 136.789 54.813 1.00 0.00 H ATOM 35718 H3S OL 894 142.207 136.519 54.955 1.00 0.00 H ATOM 35719 C14 OL 894 142.903 138.579 54.890 1.00 0.00 C ATOM 35720 H4R OL 894 141.950 138.936 55.286 1.00 0.00 H ATOM 35721 H4S OL 894 143.783 139.067 55.313 1.00 0.00 H ATOM 35722 C15 OL 894 143.013 138.786 53.398 1.00 0.00 C ATOM 35723 H5R OL 894 144.043 138.754 53.038 1.00 0.00 H ATOM 35724 H5S OL 894 142.500 137.983 52.866 1.00 0.00 H ATOM 35725 C16 OL 894 142.309 140.048 53.040 1.00 0.00 C ATOM 35726 H6R OL 894 141.254 139.766 53.015 1.00 0.00 H ATOM 35727 H6S OL 894 142.595 140.863 53.708 1.00 0.00 H ATOM 35728 C17 OL 894 142.811 140.490 51.645 1.00 0.00 C ATOM 35729 H7R OL 894 142.635 141.553 51.463 1.00 0.00 H ATOM 35730 H7S OL 894 143.890 140.447 51.481 1.00 0.00 H ATOM 35731 C18 OL 894 142.136 139.677 50.439 1.00 0.00 C ATOM 35732 H8R OL 894 142.274 138.613 50.642 1.00 0.00 H ATOM 35733 H8S OL 894 141.077 139.845 50.649 1.00 0.00 H ATOM 35734 C19 OL 894 142.703 140.149 49.107 1.00 0.00 C ATOM 35735 H9R OL 894 143.790 140.141 49.099 1.00 0.00 H ATOM 35736 C110 OL 894 142.000 140.498 48.011 1.00 0.00 C ATOM 35737 H10R OL 894 142.556 140.823 47.135 1.00 0.00 H ATOM 35738 C111 OL 894 140.590 140.653 47.821 1.00 0.00 C ATOM 35739 H11R OL 894 140.209 140.203 46.902 1.00 0.00 H ATOM 35740 H11S OL 894 139.945 140.231 48.595 1.00 0.00 H ATOM 35741 C112 OL 894 140.274 142.167 47.798 1.00 0.00 C ATOM 35742 H12R OL 894 140.852 142.717 48.543 1.00 0.00 H ATOM 35743 H12S OL 894 140.554 142.503 46.797 1.00 0.00 H ATOM 35744 C113 OL 894 138.742 142.495 47.806 1.00 0.00 C ATOM 35745 H13R OL 894 138.105 142.163 48.629 1.00 0.00 H ATOM 35746 H13S OL 894 138.776 143.579 47.929 1.00 0.00 H ATOM 35747 C114 OL 894 138.076 142.174 46.528 1.00 0.00 C ATOM 35748 H14R OL 894 138.602 142.717 45.740 1.00 0.00 H ATOM 35749 H14S OL 894 138.257 141.119 46.313 1.00 0.00 H ATOM 35750 C115 OL 894 136.611 142.450 46.520 1.00 0.00 C ATOM 35751 H15R OL 894 136.057 141.929 47.304 1.00 0.00 H ATOM 35752 H15S OL 894 136.423 143.493 46.782 1.00 0.00 H ATOM 35753 C116 OL 894 135.912 141.920 45.326 1.00 0.00 C ATOM 35754 H16R OL 894 136.545 142.111 44.457 1.00 0.00 H ATOM 35755 H16S OL 894 135.749 140.843 45.401 1.00 0.00 H ATOM 35756 C117 OL 894 134.488 142.527 45.156 1.00 0.00 C ATOM 35757 H17R OL 894 133.871 142.522 46.057 1.00 0.00 H ATOM 35758 H17S OL 894 134.493 143.594 44.923 1.00 0.00 H ATOM 35759 C118 OL 894 133.665 141.895 44.065 1.00 0.00 C ATOM 35760 H18R OL 894 132.721 142.411 43.879 1.00 0.00 H ATOM 35761 H18S OL 894 133.302 140.903 44.342 1.00 0.00 H ATOM 35762 H18T OL 894 134.180 141.754 43.113 1.00 0.00 H TER 35763 OL 894 ATOM 35763 C116 PA 895 -5.840 141.098 42.865 1.00 0.00 C ATOM 35764 H16R PA 895 -5.324 140.766 41.962 1.00 0.00 H ATOM 35765 H16S PA 895 -6.695 141.670 42.499 1.00 0.00 H ATOM 35766 H16T PA 895 -6.120 140.129 43.283 1.00 0.00 H ATOM 35767 C115 PA 895 -4.778 141.823 43.696 1.00 0.00 C ATOM 35768 H15R PA 895 -3.987 141.136 44.002 1.00 0.00 H ATOM 35769 H15S PA 895 -5.200 142.064 44.675 1.00 0.00 H ATOM 35770 C114 PA 895 -4.285 143.181 43.275 1.00 0.00 C ATOM 35771 H14R PA 895 -4.303 143.819 44.160 1.00 0.00 H ATOM 35772 H14S PA 895 -4.985 143.640 42.574 1.00 0.00 H ATOM 35773 C113 PA 895 -2.861 143.183 42.559 1.00 0.00 C ATOM 35774 H13R PA 895 -2.558 144.176 42.221 1.00 0.00 H ATOM 35775 H13S PA 895 -2.920 142.716 41.574 1.00 0.00 H ATOM 35776 C112 PA 895 -1.685 142.520 43.297 1.00 0.00 C ATOM 35777 H12R PA 895 -0.832 142.696 42.639 1.00 0.00 H ATOM 35778 H12S PA 895 -2.036 141.488 43.355 1.00 0.00 H ATOM 35779 C111 PA 895 -1.395 143.241 44.678 1.00 0.00 C ATOM 35780 H11R PA 895 -2.181 143.011 45.401 1.00 0.00 H ATOM 35781 H11S PA 895 -1.498 144.327 44.627 1.00 0.00 H ATOM 35782 C110 PA 895 -0.013 142.855 45.266 1.00 0.00 C ATOM 35783 H10R PA 895 0.687 143.011 44.443 1.00 0.00 H ATOM 35784 H10S PA 895 -0.012 141.763 45.305 1.00 0.00 H ATOM 35785 C19 PA 895 0.415 143.621 46.555 1.00 0.00 C ATOM 35786 H9R PA 895 -0.007 144.623 46.444 1.00 0.00 H ATOM 35787 H9S PA 895 1.488 143.683 46.744 1.00 0.00 H ATOM 35788 C18 PA 895 -0.192 143.017 47.737 1.00 0.00 C ATOM 35789 H8R PA 895 0.107 141.976 47.881 1.00 0.00 H ATOM 35790 H8S PA 895 -1.274 142.891 47.669 1.00 0.00 H ATOM 35791 C17 PA 895 0.227 143.737 48.972 1.00 0.00 C ATOM 35792 H7R PA 895 -0.401 144.630 48.944 1.00 0.00 H ATOM 35793 H7S PA 895 1.307 143.890 48.943 1.00 0.00 H ATOM 35794 C16 PA 895 -0.213 142.975 50.261 1.00 0.00 C ATOM 35795 H6R PA 895 -0.017 141.910 50.122 1.00 0.00 H ATOM 35796 H6S PA 895 -1.304 143.007 50.225 1.00 0.00 H ATOM 35797 C15 PA 895 0.355 143.404 51.675 1.00 0.00 C ATOM 35798 H5R PA 895 0.095 144.461 51.758 1.00 0.00 H ATOM 35799 H5S PA 895 1.444 143.340 51.736 1.00 0.00 H ATOM 35800 C14 PA 895 -0.242 142.684 52.848 1.00 0.00 C ATOM 35801 H4R PA 895 0.186 141.681 52.796 1.00 0.00 H ATOM 35802 H4S PA 895 -1.332 142.709 52.919 1.00 0.00 H ATOM 35803 C13 PA 895 0.107 143.483 54.067 1.00 0.00 C ATOM 35804 H3R PA 895 -0.434 144.431 54.059 1.00 0.00 H ATOM 35805 H3S PA 895 1.141 143.813 53.947 1.00 0.00 H ATOM 35806 C12 PA 895 -0.084 142.762 55.418 1.00 0.00 C ATOM 35807 H2R PA 895 0.614 141.926 55.508 1.00 0.00 H ATOM 35808 H2S PA 895 -0.999 142.178 55.535 1.00 0.00 H ATOM 35809 C11 PC 896 0.152 143.598 56.593 1.00 0.00 C ATOM 35810 O12 PC 896 0.755 143.198 57.587 1.00 0.00 O ATOM 35811 O11 PC 896 -0.430 144.831 56.370 1.00 0.00 O ATOM 35812 C1 PC 896 -0.616 145.689 57.499 1.00 0.00 C ATOM 35813 HR PC 896 -1.173 145.101 58.233 1.00 0.00 H ATOM 35814 HS PC 896 -1.272 146.509 57.198 1.00 0.00 H ATOM 35815 C2 PC 896 0.720 146.232 57.923 1.00 0.00 C ATOM 35816 HX PC 896 1.439 145.452 58.184 1.00 0.00 H ATOM 35817 C3 PC 896 0.531 147.254 59.114 1.00 0.00 C ATOM 35818 HA PC 896 -0.072 146.914 59.960 1.00 0.00 H ATOM 35819 HB PC 896 0.087 148.066 58.531 1.00 0.00 H ATOM 35820 O31 PC 896 1.787 147.692 59.478 1.00 0.00 O ATOM 35821 P31 PC 896 2.549 147.059 60.696 1.00 0.00 P ATOM 35822 O32 PC 896 2.133 148.015 61.913 1.00 0.00 O ATOM 35823 C31 PC 896 1.302 147.417 62.884 1.00 0.00 C ATOM 35824 H1A PC 896 1.780 146.593 63.421 1.00 0.00 H ATOM 35825 H1B PC 896 0.346 147.042 62.507 1.00 0.00 H ATOM 35826 C32 PC 896 1.093 148.578 63.846 1.00 0.00 C ATOM 35827 H2A PC 896 0.587 149.401 63.339 1.00 0.00 H ATOM 35828 H2B PC 896 2.068 149.018 64.060 1.00 0.00 H ATOM 35829 N31 PC 896 0.341 148.319 65.052 1.00 0.00 N ATOM 35830 C33 PC 896 0.956 147.320 65.871 1.00 0.00 C ATOM 35831 H3A PC 896 0.285 146.981 66.661 1.00 0.00 H ATOM 35832 H3B PC 896 1.815 147.759 66.380 1.00 0.00 H ATOM 35833 H3C PC 896 1.145 146.438 65.257 1.00 0.00 H ATOM 35834 C34 PC 896 0.315 149.555 65.772 1.00 0.00 C ATOM 35835 H4A PC 896 1.353 149.691 66.081 1.00 0.00 H ATOM 35836 H4B PC 896 -0.213 149.544 66.727 1.00 0.00 H ATOM 35837 H4C PC 896 0.031 150.405 65.149 1.00 0.00 H ATOM 35838 C35 PC 896 -1.062 147.887 64.807 1.00 0.00 C ATOM 35839 H5A PC 896 -1.582 147.874 65.766 1.00 0.00 H ATOM 35840 H5B PC 896 -0.939 146.860 64.461 1.00 0.00 H ATOM 35841 H5C PC 896 -1.437 148.540 64.017 1.00 0.00 H ATOM 35842 O33 PC 896 2.214 145.642 60.961 1.00 0.00 O ATOM 35843 O34 PC 896 3.957 147.355 60.376 1.00 0.00 O ATOM 35844 O21 PC 896 1.161 147.031 56.756 1.00 0.00 O ATOM 35845 C21 PC 896 2.115 146.549 55.930 1.00 0.00 C ATOM 35846 O22 PC 896 2.749 145.547 56.126 1.00 0.00 O ATOM 35847 C12 OL 897 2.287 147.379 54.740 1.00 0.00 C ATOM 35848 H2R OL 897 2.106 148.411 55.048 1.00 0.00 H ATOM 35849 H2S OL 897 3.314 147.276 54.383 1.00 0.00 H ATOM 35850 C13 OL 897 1.344 147.030 53.484 1.00 0.00 C ATOM 35851 H3R OL 897 1.420 145.941 53.494 1.00 0.00 H ATOM 35852 H3S OL 897 0.279 147.258 53.565 1.00 0.00 H ATOM 35853 C14 OL 897 1.879 147.499 52.189 1.00 0.00 C ATOM 35854 H4R OL 897 2.008 148.584 52.214 1.00 0.00 H ATOM 35855 H4S OL 897 2.870 147.164 51.875 1.00 0.00 H ATOM 35856 C15 OL 897 1.129 147.240 50.925 1.00 0.00 C ATOM 35857 H5R OL 897 1.124 146.173 50.689 1.00 0.00 H ATOM 35858 H5S OL 897 0.103 147.541 50.703 1.00 0.00 H ATOM 35859 C16 OL 897 1.954 147.727 49.754 1.00 0.00 C ATOM 35860 H6R OL 897 2.141 148.803 49.765 1.00 0.00 H ATOM 35861 H6S OL 897 2.949 147.281 49.809 1.00 0.00 H ATOM 35862 C17 OL 897 1.411 147.166 48.376 1.00 0.00 C ATOM 35863 H7R OL 897 1.267 146.096 48.539 1.00 0.00 H ATOM 35864 H7S OL 897 0.391 147.555 48.406 1.00 0.00 H ATOM 35865 C18 OL 897 2.244 147.531 47.177 1.00 0.00 C ATOM 35866 H8R OL 897 1.658 148.319 46.699 1.00 0.00 H ATOM 35867 H8S OL 897 3.208 147.975 47.436 1.00 0.00 H ATOM 35868 C19 OL 897 2.287 146.409 46.160 1.00 0.00 C ATOM 35869 H9R OL 897 2.779 145.510 46.522 1.00 0.00 H ATOM 35870 C110 OL 897 1.728 146.238 44.969 1.00 0.00 C ATOM 35871 H10R OL 897 1.856 145.324 44.394 1.00 0.00 H ATOM 35872 C111 OL 897 1.047 147.259 44.192 1.00 0.00 C ATOM 35873 H11R OL 897 0.012 146.975 43.993 1.00 0.00 H ATOM 35874 H11S OL 897 1.004 148.191 44.760 1.00 0.00 H ATOM 35875 C112 OL 897 1.583 147.642 42.766 1.00 0.00 C ATOM 35876 H12R OL 897 1.206 148.637 42.522 1.00 0.00 H ATOM 35877 H12S OL 897 2.644 147.788 42.980 1.00 0.00 H ATOM 35878 C113 OL 897 1.468 146.611 41.603 1.00 0.00 C ATOM 35879 H13R OL 897 1.795 145.671 42.051 1.00 0.00 H ATOM 35880 H13S OL 897 0.424 146.582 41.285 1.00 0.00 H ATOM 35881 C114 OL 897 2.186 147.022 40.369 1.00 0.00 C ATOM 35882 H14R OL 897 3.225 147.070 40.703 1.00 0.00 H ATOM 35883 H14S OL 897 2.108 146.212 39.640 1.00 0.00 H ATOM 35884 C115 OL 897 1.692 148.301 39.647 1.00 0.00 C ATOM 35885 H15R OL 897 0.603 148.245 39.576 1.00 0.00 H ATOM 35886 H15S OL 897 1.890 149.179 40.266 1.00 0.00 H ATOM 35887 C116 OL 897 2.403 148.662 38.325 1.00 0.00 C ATOM 35888 H16R OL 897 1.911 149.577 37.989 1.00 0.00 H ATOM 35889 H16S OL 897 3.437 148.938 38.539 1.00 0.00 H ATOM 35890 C117 OL 897 2.378 147.662 37.178 1.00 0.00 C ATOM 35891 H17R OL 897 3.190 146.956 37.366 1.00 0.00 H ATOM 35892 H17S OL 897 1.389 147.206 37.108 1.00 0.00 H ATOM 35893 C118 OL 897 2.707 148.149 35.794 1.00 0.00 C ATOM 35894 H18R OL 897 3.745 148.462 35.662 1.00 0.00 H ATOM 35895 H18S OL 897 2.040 148.938 35.440 1.00 0.00 H ATOM 35896 H18T OL 897 2.609 147.352 35.055 1.00 0.00 H TER 35897 OL 897 ATOM 35897 C116 PA 898 33.259 128.527 33.393 1.00 0.00 C ATOM 35898 H16R PA 898 33.415 129.552 33.050 1.00 0.00 H ATOM 35899 H16S PA 898 32.175 128.410 33.333 1.00 0.00 H ATOM 35900 H16T PA 898 33.693 127.796 32.707 1.00 0.00 H ATOM 35901 C115 PA 898 33.871 128.279 34.783 1.00 0.00 C ATOM 35902 H15R PA 898 34.933 128.533 34.811 1.00 0.00 H ATOM 35903 H15S PA 898 33.780 127.196 34.890 1.00 0.00 H ATOM 35904 C114 PA 898 33.236 128.949 35.969 1.00 0.00 C ATOM 35905 H14R PA 898 32.162 128.797 36.093 1.00 0.00 H ATOM 35906 H14S PA 898 33.346 130.016 35.764 1.00 0.00 H ATOM 35907 C113 PA 898 33.970 128.712 37.316 1.00 0.00 C ATOM 35908 H13R PA 898 35.051 128.851 37.254 1.00 0.00 H ATOM 35909 H13S PA 898 33.948 127.694 37.709 1.00 0.00 H ATOM 35910 C112 PA 898 33.288 129.474 38.477 1.00 0.00 C ATOM 35911 H12R PA 898 32.362 128.947 38.716 1.00 0.00 H ATOM 35912 H12S PA 898 33.020 130.511 38.262 1.00 0.00 H ATOM 35913 C111 PA 898 34.038 129.472 39.847 1.00 0.00 C ATOM 35914 H11R PA 898 34.858 130.188 39.757 1.00 0.00 H ATOM 35915 H11S PA 898 34.554 128.525 40.015 1.00 0.00 H ATOM 35916 C110 PA 898 33.172 129.950 41.016 1.00 0.00 C ATOM 35917 H10R PA 898 32.351 129.235 41.109 1.00 0.00 H ATOM 35918 H10S PA 898 32.670 130.912 40.897 1.00 0.00 H ATOM 35919 C19 PA 898 33.866 129.908 42.335 1.00 0.00 C ATOM 35920 H9R PA 898 34.624 130.694 42.355 1.00 0.00 H ATOM 35921 H9S PA 898 34.350 128.942 42.490 1.00 0.00 H ATOM 35922 C18 PA 898 32.890 130.185 43.471 1.00 0.00 C ATOM 35923 H8R PA 898 33.323 129.580 44.271 1.00 0.00 H ATOM 35924 H8S PA 898 31.894 129.772 43.297 1.00 0.00 H ATOM 35925 C17 PA 898 32.825 131.669 43.865 1.00 0.00 C ATOM 35926 H7R PA 898 32.555 132.406 43.106 1.00 0.00 H ATOM 35927 H7S PA 898 33.809 132.017 44.186 1.00 0.00 H ATOM 35928 C16 PA 898 31.935 132.080 45.092 1.00 0.00 C ATOM 35929 H6R PA 898 32.019 133.166 45.176 1.00 0.00 H ATOM 35930 H6S PA 898 32.377 131.805 46.053 1.00 0.00 H ATOM 35931 C15 PA 898 30.499 131.673 45.068 1.00 0.00 C ATOM 35932 H5R PA 898 30.370 130.617 45.312 1.00 0.00 H ATOM 35933 H5S PA 898 30.084 131.844 44.072 1.00 0.00 H ATOM 35934 C14 PA 898 29.762 132.496 45.994 1.00 0.00 C ATOM 35935 H4R PA 898 29.892 133.479 45.536 1.00 0.00 H ATOM 35936 H4S PA 898 30.255 132.552 46.967 1.00 0.00 H ATOM 35937 C13 PA 898 28.308 132.197 46.111 1.00 0.00 C ATOM 35938 H3R PA 898 27.849 132.290 45.125 1.00 0.00 H ATOM 35939 H3S PA 898 27.911 133.042 46.677 1.00 0.00 H ATOM 35940 C12 PA 898 27.865 130.828 46.586 1.00 0.00 C ATOM 35941 H2R PA 898 28.322 130.074 45.942 1.00 0.00 H ATOM 35942 H2S PA 898 26.783 130.756 46.456 1.00 0.00 H ATOM 35943 C11 PC 899 28.211 130.454 48.092 1.00 0.00 C ATOM 35944 O12 PC 899 28.644 131.192 49.000 1.00 0.00 O ATOM 35945 O11 PC 899 28.064 129.133 48.162 1.00 0.00 O ATOM 35946 C1 PC 899 28.385 128.364 49.331 1.00 0.00 C ATOM 35947 HR PC 899 29.457 128.378 49.548 1.00 0.00 H ATOM 35948 HS PC 899 28.332 127.289 49.145 1.00 0.00 H ATOM 35949 C2 PC 899 27.506 128.858 50.514 1.00 0.00 C ATOM 35950 HX PC 899 27.554 129.946 50.596 1.00 0.00 H ATOM 35951 C3 PC 899 28.035 128.398 51.897 1.00 0.00 C ATOM 35952 HA PC 899 29.106 128.613 51.939 1.00 0.00 H ATOM 35953 HB PC 899 27.928 127.316 52.004 1.00 0.00 H ATOM 35954 O31 PC 899 27.248 129.167 52.806 1.00 0.00 O ATOM 35955 P31 PC 899 27.541 129.092 54.327 1.00 0.00 P ATOM 35956 O32 PC 899 27.006 127.703 54.756 1.00 0.00 O ATOM 35957 C31 PC 899 25.861 127.211 54.161 1.00 0.00 C ATOM 35958 H1A PC 899 25.937 126.898 53.117 1.00 0.00 H ATOM 35959 H1B PC 899 25.138 128.030 54.189 1.00 0.00 H ATOM 35960 C32 PC 899 25.419 126.085 55.082 1.00 0.00 C ATOM 35961 H2A PC 899 26.290 125.443 55.220 1.00 0.00 H ATOM 35962 H2B PC 899 24.640 125.436 54.679 1.00 0.00 H ATOM 35963 N31 PC 899 24.905 126.430 56.506 1.00 0.00 N ATOM 35964 C33 PC 899 23.622 127.074 56.528 1.00 0.00 C ATOM 35965 H3A PC 899 23.734 128.079 56.116 1.00 0.00 H ATOM 35966 H3B PC 899 23.225 127.100 57.543 1.00 0.00 H ATOM 35967 H3C PC 899 23.035 126.492 55.815 1.00 0.00 H ATOM 35968 C34 PC 899 24.716 125.088 57.129 1.00 0.00 C ATOM 35969 H4A PC 899 23.793 124.545 56.921 1.00 0.00 H ATOM 35970 H4B PC 899 24.845 125.374 58.174 1.00 0.00 H ATOM 35971 H4C PC 899 25.456 124.330 56.870 1.00 0.00 H ATOM 35972 C35 PC 899 25.968 127.170 57.319 1.00 0.00 C ATOM 35973 H5A PC 899 26.841 126.548 57.116 1.00 0.00 H ATOM 35974 H5B PC 899 25.786 127.122 58.394 1.00 0.00 H ATOM 35975 H5C PC 899 26.166 128.210 57.055 1.00 0.00 H ATOM 35976 O33 PC 899 29.022 129.128 54.530 1.00 0.00 O ATOM 35977 O34 PC 899 26.740 130.138 55.024 1.00 0.00 O ATOM 35978 O21 PC 899 26.088 128.478 50.320 1.00 0.00 O ATOM 35979 C21 PC 899 25.073 129.200 50.815 1.00 0.00 C ATOM 35980 O22 PC 899 25.273 130.295 51.307 1.00 0.00 O ATOM 35981 C12 OL 900 23.696 128.571 50.476 1.00 0.00 C ATOM 35982 H2R OL 900 23.790 128.553 49.388 1.00 0.00 H ATOM 35983 H2S OL 900 23.728 127.506 50.711 1.00 0.00 H ATOM 35984 C13 OL 900 22.587 129.415 51.145 1.00 0.00 C ATOM 35985 H3R OL 900 22.764 129.159 52.192 1.00 0.00 H ATOM 35986 H3S OL 900 22.928 130.443 51.012 1.00 0.00 H ATOM 35987 C14 OL 900 21.136 129.183 50.709 1.00 0.00 C ATOM 35988 H4R OL 900 20.991 128.131 50.963 1.00 0.00 H ATOM 35989 H4S OL 900 20.425 129.694 51.361 1.00 0.00 H ATOM 35990 C15 OL 900 20.861 129.451 49.199 1.00 0.00 C ATOM 35991 H5R OL 900 21.581 128.871 48.618 1.00 0.00 H ATOM 35992 H5S OL 900 19.848 129.114 48.966 1.00 0.00 H ATOM 35993 C16 OL 900 20.929 130.959 48.879 1.00 0.00 C ATOM 35994 H6R OL 900 20.921 131.574 49.782 1.00 0.00 H ATOM 35995 H6S OL 900 21.871 131.187 48.376 1.00 0.00 H ATOM 35996 C17 OL 900 19.776 131.558 48.104 1.00 0.00 C ATOM 35997 H7R OL 900 18.895 131.423 48.734 1.00 0.00 H ATOM 35998 H7S OL 900 19.943 132.633 48.004 1.00 0.00 H ATOM 35999 C18 OL 900 19.608 130.934 46.734 1.00 0.00 C ATOM 36000 H8R OL 900 20.581 130.894 46.239 1.00 0.00 H ATOM 36001 H8S OL 900 19.229 129.911 46.766 1.00 0.00 H ATOM 36002 C19 OL 900 18.838 131.759 45.724 1.00 0.00 C ATOM 36003 H9R OL 900 19.415 132.445 45.110 1.00 0.00 H ATOM 36004 C110 OL 900 17.506 131.630 45.679 1.00 0.00 C ATOM 36005 H10R OL 900 16.872 132.251 45.051 1.00 0.00 H ATOM 36006 C111 OL 900 16.689 130.640 46.509 1.00 0.00 C ATOM 36007 H11R OL 900 16.337 129.932 45.755 1.00 0.00 H ATOM 36008 H11S OL 900 17.274 130.060 47.225 1.00 0.00 H ATOM 36009 C112 OL 900 15.535 131.186 47.217 1.00 0.00 C ATOM 36010 H12R OL 900 14.884 131.826 46.617 1.00 0.00 H ATOM 36011 H12S OL 900 14.789 130.422 47.442 1.00 0.00 H ATOM 36012 C113 OL 900 15.864 131.839 48.485 1.00 0.00 C ATOM 36013 H13R OL 900 16.379 131.148 49.156 1.00 0.00 H ATOM 36014 H13S OL 900 16.560 132.646 48.247 1.00 0.00 H ATOM 36015 C114 OL 900 14.689 132.487 49.163 1.00 0.00 C ATOM 36016 H14R OL 900 14.132 133.153 48.501 1.00 0.00 H ATOM 36017 H14S OL 900 13.954 131.751 49.495 1.00 0.00 H ATOM 36018 C115 OL 900 15.056 133.255 50.429 1.00 0.00 C ATOM 36019 H15R OL 900 15.530 132.517 51.081 1.00 0.00 H ATOM 36020 H15S OL 900 16.024 133.747 50.308 1.00 0.00 H ATOM 36021 C116 OL 900 13.876 134.055 51.097 1.00 0.00 C ATOM 36022 H16R OL 900 13.269 134.442 50.276 1.00 0.00 H ATOM 36023 H16S OL 900 13.127 133.474 51.641 1.00 0.00 H ATOM 36024 C117 OL 900 14.362 135.181 52.025 1.00 0.00 C ATOM 36025 H17R OL 900 15.035 134.736 52.760 1.00 0.00 H ATOM 36026 H17S OL 900 14.931 135.960 51.514 1.00 0.00 H ATOM 36027 C118 OL 900 13.259 135.778 52.833 1.00 0.00 C ATOM 36028 H18R OL 900 13.515 136.367 53.716 1.00 0.00 H ATOM 36029 H18S OL 900 12.709 134.958 53.300 1.00 0.00 H ATOM 36030 H18T OL 900 12.718 136.494 52.209 1.00 0.00 H TER 36031 OL 900 ATOM 36031 C116 PA 901 107.935 -2.178 36.829 1.00 0.00 C ATOM 36032 H16R PA 901 109.010 -2.150 37.018 1.00 0.00 H ATOM 36033 H16S PA 901 107.564 -1.160 36.961 1.00 0.00 H ATOM 36034 H16T PA 901 107.847 -2.312 35.749 1.00 0.00 H ATOM 36035 C115 PA 901 107.244 -3.236 37.676 1.00 0.00 C ATOM 36036 H15R PA 901 107.296 -4.221 37.205 1.00 0.00 H ATOM 36037 H15S PA 901 106.182 -3.003 37.777 1.00 0.00 H ATOM 36038 C114 PA 901 107.887 -3.172 39.013 1.00 0.00 C ATOM 36039 H14R PA 901 108.965 -3.198 38.843 1.00 0.00 H ATOM 36040 H14S PA 901 107.548 -4.097 39.483 1.00 0.00 H ATOM 36041 C113 PA 901 107.574 -1.890 39.837 1.00 0.00 C ATOM 36042 H13R PA 901 106.602 -2.101 40.287 1.00 0.00 H ATOM 36043 H13S PA 901 107.254 -1.020 39.260 1.00 0.00 H ATOM 36044 C112 PA 901 108.527 -1.451 40.863 1.00 0.00 C ATOM 36045 H12R PA 901 109.521 -1.377 40.415 1.00 0.00 H ATOM 36046 H12S PA 901 108.725 -2.368 41.421 1.00 0.00 H ATOM 36047 C111 PA 901 108.215 -0.148 41.535 1.00 0.00 C ATOM 36048 H11R PA 901 107.176 -0.136 41.871 1.00 0.00 H ATOM 36049 H11S PA 901 108.223 0.666 40.806 1.00 0.00 H ATOM 36050 C110 PA 901 109.201 0.062 42.697 1.00 0.00 C ATOM 36051 H10R PA 901 110.183 0.417 42.377 1.00 0.00 H ATOM 36052 H10S PA 901 109.352 -0.834 43.302 1.00 0.00 H ATOM 36053 C19 PA 901 108.637 1.127 43.617 1.00 0.00 C ATOM 36054 H9R PA 901 107.635 0.848 43.947 1.00 0.00 H ATOM 36055 H9S PA 901 108.481 2.079 43.106 1.00 0.00 H ATOM 36056 C18 PA 901 109.555 1.479 44.849 1.00 0.00 C ATOM 36057 H8R PA 901 110.593 1.600 44.533 1.00 0.00 H ATOM 36058 H8S PA 901 109.497 0.634 45.538 1.00 0.00 H ATOM 36059 C17 PA 901 109.058 2.675 45.654 1.00 0.00 C ATOM 36060 H7R PA 901 108.114 2.447 46.154 1.00 0.00 H ATOM 36061 H7S PA 901 108.752 3.396 44.892 1.00 0.00 H ATOM 36062 C16 PA 901 110.062 3.044 46.781 1.00 0.00 C ATOM 36063 H6R PA 901 109.693 3.924 47.311 1.00 0.00 H ATOM 36064 H6S PA 901 111.002 3.313 46.295 1.00 0.00 H ATOM 36065 C15 PA 901 110.285 1.974 47.843 1.00 0.00 C ATOM 36066 H5R PA 901 110.583 1.096 47.266 1.00 0.00 H ATOM 36067 H5S PA 901 109.358 1.701 48.350 1.00 0.00 H ATOM 36068 C14 PA 901 111.349 2.466 48.866 1.00 0.00 C ATOM 36069 H4R PA 901 110.933 3.320 49.404 1.00 0.00 H ATOM 36070 H4S PA 901 112.138 2.997 48.329 1.00 0.00 H ATOM 36071 C13 PA 901 112.010 1.665 49.852 1.00 0.00 C ATOM 36072 H3R PA 901 112.804 2.285 50.272 1.00 0.00 H ATOM 36073 H3S PA 901 112.544 0.849 49.361 1.00 0.00 H ATOM 36074 C12 PA 901 111.061 0.989 50.873 1.00 0.00 C ATOM 36075 H2R PA 901 111.462 0.015 51.160 1.00 0.00 H ATOM 36076 H2S PA 901 110.029 0.906 50.526 1.00 0.00 H ATOM 36077 C11 PC 902 111.060 1.667 52.169 1.00 0.00 C ATOM 36078 O12 PC 902 111.872 1.343 52.991 1.00 0.00 O ATOM 36079 O11 PC 902 110.215 2.654 52.171 1.00 0.00 O ATOM 36080 C1 PC 902 110.126 3.486 53.326 1.00 0.00 C ATOM 36081 HR PC 902 110.039 2.886 54.235 1.00 0.00 H ATOM 36082 HS PC 902 109.165 4.001 53.253 1.00 0.00 H ATOM 36083 C2 PC 902 111.247 4.656 53.398 1.00 0.00 C ATOM 36084 HX PC 902 112.218 4.211 53.168 1.00 0.00 H ATOM 36085 C3 PC 902 111.285 5.437 54.740 1.00 0.00 C ATOM 36086 HA PC 902 111.649 6.458 54.599 1.00 0.00 H ATOM 36087 HB PC 902 111.984 4.958 55.432 1.00 0.00 H ATOM 36088 O31 PC 902 109.949 5.435 55.233 1.00 0.00 O ATOM 36089 P31 PC 902 109.611 5.977 56.681 1.00 0.00 P ATOM 36090 O32 PC 902 109.716 7.559 56.561 1.00 0.00 O ATOM 36091 C31 PC 902 110.203 8.291 57.674 1.00 0.00 C ATOM 36092 H1A PC 902 111.203 7.981 57.986 1.00 0.00 H ATOM 36093 H1B PC 902 109.591 8.065 58.551 1.00 0.00 H ATOM 36094 C32 PC 902 110.330 9.765 57.384 1.00 0.00 C ATOM 36095 H2A PC 902 109.323 10.158 57.239 1.00 0.00 H ATOM 36096 H2B PC 902 110.894 9.942 56.468 1.00 0.00 H ATOM 36097 N31 PC 902 110.748 10.689 58.482 1.00 0.00 N ATOM 36098 C33 PC 902 110.552 12.066 58.074 1.00 0.00 C ATOM 36099 H3A PC 902 109.553 12.253 57.677 1.00 0.00 H ATOM 36100 H3B PC 902 111.279 12.391 57.329 1.00 0.00 H ATOM 36101 H3C PC 902 110.623 12.644 58.997 1.00 0.00 H ATOM 36102 C34 PC 902 110.127 10.440 59.830 1.00 0.00 C ATOM 36103 H4A PC 902 109.157 10.920 59.962 1.00 0.00 H ATOM 36104 H4B PC 902 110.847 10.809 60.561 1.00 0.00 H ATOM 36105 H4C PC 902 110.043 9.366 60.004 1.00 0.00 H ATOM 36106 C35 PC 902 112.233 10.510 58.665 1.00 0.00 C ATOM 36107 H5A PC 902 112.635 11.106 59.485 1.00 0.00 H ATOM 36108 H5B PC 902 112.758 10.814 57.758 1.00 0.00 H ATOM 36109 H5C PC 902 112.475 9.479 58.927 1.00 0.00 H ATOM 36110 O33 PC 902 108.159 5.771 56.858 1.00 0.00 O ATOM 36111 O34 PC 902 110.641 5.430 57.677 1.00 0.00 O ATOM 36112 O21 PC 902 111.008 5.639 52.358 1.00 0.00 O ATOM 36113 C21 PC 902 111.600 5.370 51.144 1.00 0.00 C ATOM 36114 O22 PC 902 112.472 4.536 50.886 1.00 0.00 O ATOM 36115 C12 OL 903 111.116 6.381 50.138 1.00 0.00 C ATOM 36116 H2R OL 903 110.059 6.198 49.931 1.00 0.00 H ATOM 36117 H2S OL 903 111.139 7.380 50.580 1.00 0.00 H ATOM 36118 C13 OL 903 111.995 6.327 48.901 1.00 0.00 C ATOM 36119 H3R OL 903 113.061 6.242 49.124 1.00 0.00 H ATOM 36120 H3S OL 903 111.763 5.414 48.349 1.00 0.00 H ATOM 36121 C14 OL 903 111.770 7.413 47.883 1.00 0.00 C ATOM 36122 H4R OL 903 110.818 7.181 47.401 1.00 0.00 H ATOM 36123 H4S OL 903 111.585 8.392 48.332 1.00 0.00 H ATOM 36124 C15 OL 903 112.875 7.697 46.788 1.00 0.00 C ATOM 36125 H5R OL 903 112.614 8.629 46.283 1.00 0.00 H ATOM 36126 H5S OL 903 113.828 7.992 47.232 1.00 0.00 H ATOM 36127 C16 OL 903 113.222 6.607 45.792 1.00 0.00 C ATOM 36128 H6R OL 903 113.907 7.048 45.064 1.00 0.00 H ATOM 36129 H6S OL 903 113.842 5.916 46.367 1.00 0.00 H ATOM 36130 C17 OL 903 112.171 5.748 45.130 1.00 0.00 C ATOM 36131 H7R OL 903 112.588 4.807 44.765 1.00 0.00 H ATOM 36132 H7S OL 903 111.515 5.346 45.905 1.00 0.00 H ATOM 36133 C18 OL 903 111.479 6.369 43.958 1.00 0.00 C ATOM 36134 H8R OL 903 111.011 7.301 44.281 1.00 0.00 H ATOM 36135 H8S OL 903 112.240 6.625 43.217 1.00 0.00 H ATOM 36136 C19 OL 903 110.295 5.620 43.421 1.00 0.00 C ATOM 36137 H9R OL 903 109.397 5.799 44.007 1.00 0.00 H ATOM 36138 C110 OL 903 110.224 4.771 42.336 1.00 0.00 C ATOM 36139 H10R OL 903 109.254 4.340 42.101 1.00 0.00 H ATOM 36140 C111 OL 903 111.270 4.172 41.567 1.00 0.00 C ATOM 36141 H11R OL 903 112.235 4.556 41.905 1.00 0.00 H ATOM 36142 H11S OL 903 111.362 3.110 41.804 1.00 0.00 H ATOM 36143 C112 OL 903 111.019 4.144 40.074 1.00 0.00 C ATOM 36144 H12R OL 903 109.997 3.812 39.881 1.00 0.00 H ATOM 36145 H12S OL 903 111.099 5.182 39.745 1.00 0.00 H ATOM 36146 C113 OL 903 111.889 3.179 39.179 1.00 0.00 C ATOM 36147 H13R OL 903 112.896 3.597 39.246 1.00 0.00 H ATOM 36148 H13S OL 903 111.932 2.203 39.666 1.00 0.00 H ATOM 36149 C114 OL 903 111.630 3.154 37.674 1.00 0.00 C ATOM 36150 H14R OL 903 111.318 4.117 37.264 1.00 0.00 H ATOM 36151 H14S OL 903 112.642 3.147 37.263 1.00 0.00 H ATOM 36152 C115 OL 903 110.837 2.032 37.144 1.00 0.00 C ATOM 36153 H15R OL 903 110.173 1.725 37.955 1.00 0.00 H ATOM 36154 H15S OL 903 110.191 2.192 36.278 1.00 0.00 H ATOM 36155 C116 OL 903 111.734 0.880 36.742 1.00 0.00 C ATOM 36156 H16R OL 903 111.129 0.326 36.022 1.00 0.00 H ATOM 36157 H16S OL 903 112.515 1.276 36.090 1.00 0.00 H ATOM 36158 C117 OL 903 112.214 0.037 37.932 1.00 0.00 C ATOM 36159 H17R OL 903 112.725 0.544 38.753 1.00 0.00 H ATOM 36160 H17S OL 903 111.378 -0.468 38.422 1.00 0.00 H ATOM 36161 C118 OL 903 113.116 -1.189 37.477 1.00 0.00 C ATOM 36162 H18R OL 903 113.376 -1.872 38.289 1.00 0.00 H ATOM 36163 H18S OL 903 114.082 -0.814 37.134 1.00 0.00 H ATOM 36164 H18T OL 903 112.601 -1.748 36.692 1.00 0.00 H TER 36165 OL 903 ATOM 36165 C116 PA 904 139.700 6.462 39.570 1.00 0.00 C ATOM 36166 H16R PA 904 139.593 5.376 39.533 1.00 0.00 H ATOM 36167 H16S PA 904 140.251 6.774 38.680 1.00 0.00 H ATOM 36168 H16T PA 904 138.730 6.948 39.441 1.00 0.00 H ATOM 36169 C115 PA 904 140.383 6.924 40.854 1.00 0.00 C ATOM 36170 H15R PA 904 140.385 8.016 40.832 1.00 0.00 H ATOM 36171 H15S PA 904 141.410 6.556 40.911 1.00 0.00 H ATOM 36172 C114 PA 904 139.476 6.661 42.087 1.00 0.00 C ATOM 36173 H14R PA 904 138.980 5.702 41.918 1.00 0.00 H ATOM 36174 H14S PA 904 138.716 7.429 42.245 1.00 0.00 H ATOM 36175 C113 PA 904 140.328 6.700 43.395 1.00 0.00 C ATOM 36176 H13R PA 904 140.896 7.625 43.512 1.00 0.00 H ATOM 36177 H13S PA 904 141.196 6.060 43.221 1.00 0.00 H ATOM 36178 C112 PA 904 139.561 6.175 44.652 1.00 0.00 C ATOM 36179 H12R PA 904 139.328 5.126 44.461 1.00 0.00 H ATOM 36180 H12S PA 904 138.669 6.770 44.860 1.00 0.00 H ATOM 36181 C111 PA 904 140.425 6.321 45.928 1.00 0.00 C ATOM 36182 H11R PA 904 140.553 7.383 46.146 1.00 0.00 H ATOM 36183 H11S PA 904 141.418 5.937 45.687 1.00 0.00 H ATOM 36184 C110 PA 904 139.883 5.535 47.096 1.00 0.00 C ATOM 36185 H10R PA 904 140.065 4.485 46.856 1.00 0.00 H ATOM 36186 H10S PA 904 138.815 5.627 47.301 1.00 0.00 H ATOM 36187 C19 PA 904 140.623 5.732 48.455 1.00 0.00 C ATOM 36188 H9R PA 904 140.548 6.730 48.892 1.00 0.00 H ATOM 36189 H9S PA 904 141.695 5.541 48.381 1.00 0.00 H ATOM 36190 C18 PA 904 140.044 4.938 49.604 1.00 0.00 C ATOM 36191 H8R PA 904 139.953 3.876 49.366 1.00 0.00 H ATOM 36192 H8S PA 904 139.013 5.283 49.704 1.00 0.00 H ATOM 36193 C17 PA 904 140.921 5.065 50.917 1.00 0.00 C ATOM 36194 H7R PA 904 141.035 6.115 51.193 1.00 0.00 H ATOM 36195 H7S PA 904 141.952 4.848 50.631 1.00 0.00 H ATOM 36196 C16 PA 904 140.553 4.152 52.155 1.00 0.00 C ATOM 36197 H6R PA 904 141.304 4.309 52.931 1.00 0.00 H ATOM 36198 H6S PA 904 140.651 3.105 51.858 1.00 0.00 H ATOM 36199 C15 PA 904 139.111 4.310 52.770 1.00 0.00 C ATOM 36200 H5R PA 904 138.385 3.850 52.096 1.00 0.00 H ATOM 36201 H5S PA 904 138.803 5.357 52.790 1.00 0.00 H ATOM 36202 C14 PA 904 138.903 3.704 54.202 1.00 0.00 C ATOM 36203 H4R PA 904 139.619 4.140 54.901 1.00 0.00 H ATOM 36204 H4S PA 904 138.977 2.614 54.227 1.00 0.00 H ATOM 36205 C13 PA 904 137.486 4.184 54.734 1.00 0.00 C ATOM 36206 H3R PA 904 136.612 3.660 54.340 1.00 0.00 H ATOM 36207 H3S PA 904 137.240 5.223 54.504 1.00 0.00 H ATOM 36208 C12 PA 904 137.512 4.032 56.274 1.00 0.00 C ATOM 36209 H2R PA 904 138.199 4.807 56.618 1.00 0.00 H ATOM 36210 H2S PA 904 137.839 3.041 56.595 1.00 0.00 H ATOM 36211 C11 PGR 905 136.142 4.294 56.877 1.00 0.00 C ATOM 36212 O12 PGR 905 135.792 5.403 57.283 1.00 0.00 O ATOM 36213 O11 PGR 905 135.430 3.199 57.110 1.00 0.00 O ATOM 36214 C1 PGR 905 134.184 3.191 57.908 1.00 0.00 C ATOM 36215 HR PGR 905 134.207 4.008 58.633 1.00 0.00 H ATOM 36216 HS PGR 905 134.031 2.182 58.299 1.00 0.00 H ATOM 36217 C2 PGR 905 132.893 3.449 57.039 1.00 0.00 C ATOM 36218 HX PGR 905 132.926 4.519 56.820 1.00 0.00 H ATOM 36219 C3 PGR 905 131.562 3.282 57.734 1.00 0.00 C ATOM 36220 HA PGR 905 130.796 3.206 56.958 1.00 0.00 H ATOM 36221 HB PGR 905 131.346 4.206 58.277 1.00 0.00 H ATOM 36222 O31 PGR 905 131.527 2.089 58.592 1.00 0.00 O ATOM 36223 P31 PGR 905 130.128 1.689 59.342 1.00 0.00 P ATOM 36224 O32 PGR 905 130.187 2.471 60.612 1.00 0.00 O ATOM 36225 C31 PGR 905 131.132 2.160 61.600 1.00 0.00 C ATOM 36226 H1A PGR 905 132.177 2.228 61.288 1.00 0.00 H ATOM 36227 H1B PGR 905 131.006 1.084 61.752 1.00 0.00 H ATOM 36228 C32 PGR 905 130.891 3.039 62.852 1.00 0.00 C ATOM 36229 H2A PGR 905 129.815 3.187 62.982 1.00 0.00 H ATOM 36230 O35 PGR 905 131.581 4.311 62.910 1.00 0.00 O ATOM 36231 HO5A PGR 905 131.613 4.611 63.836 1.00 0.00 H ATOM 36232 C33 PGR 905 131.239 2.202 64.198 1.00 0.00 C ATOM 36233 H3A PGR 905 131.022 2.850 65.051 1.00 0.00 H ATOM 36234 H3B PGR 905 130.577 1.339 64.092 1.00 0.00 H ATOM 36235 O33 PGR 905 128.972 2.231 58.511 1.00 0.00 O ATOM 36236 O34 PGR 905 130.110 0.262 59.680 1.00 0.00 O ATOM 36237 O21 PGR 905 132.929 2.595 55.832 1.00 0.00 O ATOM 36238 C21 PGR 905 133.587 3.029 54.722 1.00 0.00 C ATOM 36239 O22 PGR 905 134.063 4.106 54.608 1.00 0.00 O ATOM 36240 O36 PGR 905 132.621 1.775 64.033 1.00 0.00 O ATOM 36241 HO6A PGR 905 132.841 1.275 63.226 1.00 0.00 H ATOM 36242 C12 OL 906 133.654 1.982 53.653 1.00 0.00 C ATOM 36243 H2R OL 906 134.637 1.549 53.453 1.00 0.00 H ATOM 36244 H2S OL 906 133.101 1.148 54.090 1.00 0.00 H ATOM 36245 C13 OL 906 132.844 2.321 52.379 1.00 0.00 C ATOM 36246 H3R OL 906 131.766 2.474 52.466 1.00 0.00 H ATOM 36247 H3S OL 906 133.065 3.352 52.096 1.00 0.00 H ATOM 36248 C14 OL 906 132.968 1.369 51.181 1.00 0.00 C ATOM 36249 H4R OL 906 133.962 0.940 51.036 1.00 0.00 H ATOM 36250 H4S OL 906 132.323 0.519 51.412 1.00 0.00 H ATOM 36251 C15 OL 906 132.625 1.963 49.852 1.00 0.00 C ATOM 36252 H5R OL 906 131.554 2.037 49.651 1.00 0.00 H ATOM 36253 H5S OL 906 133.081 2.943 49.697 1.00 0.00 H ATOM 36254 C16 OL 906 133.121 1.059 48.625 1.00 0.00 C ATOM 36255 H6R OL 906 134.210 1.082 48.548 1.00 0.00 H ATOM 36256 H6S OL 906 132.748 0.033 48.614 1.00 0.00 H ATOM 36257 C17 OL 906 132.655 1.690 47.272 1.00 0.00 C ATOM 36258 H7R OL 906 131.614 1.402 47.109 1.00 0.00 H ATOM 36259 H7S OL 906 132.771 2.775 47.316 1.00 0.00 H ATOM 36260 C18 OL 906 133.325 1.113 46.006 1.00 0.00 C ATOM 36261 H8R OL 906 134.406 1.123 46.163 1.00 0.00 H ATOM 36262 H8S OL 906 133.206 0.040 45.840 1.00 0.00 H ATOM 36263 C19 OL 906 132.997 1.877 44.754 1.00 0.00 C ATOM 36264 H9R OL 906 133.254 2.928 44.861 1.00 0.00 H ATOM 36265 C110 OL 906 132.318 1.464 43.679 1.00 0.00 C ATOM 36266 H10R OL 906 132.196 2.140 42.837 1.00 0.00 H ATOM 36267 C111 OL 906 131.703 0.175 43.434 1.00 0.00 C ATOM 36268 H11R OL 906 131.583 -0.365 44.375 1.00 0.00 H ATOM 36269 H11S OL 906 130.654 0.354 43.193 1.00 0.00 H ATOM 36270 C112 OL 906 132.433 -0.686 42.539 1.00 0.00 C ATOM 36271 H12R OL 906 132.862 -0.112 41.715 1.00 0.00 H ATOM 36272 H12S OL 906 133.361 -0.998 43.023 1.00 0.00 H ATOM 36273 C113 OL 906 131.539 -1.751 41.866 1.00 0.00 C ATOM 36274 H13R OL 906 131.065 -2.412 42.595 1.00 0.00 H ATOM 36275 H13S OL 906 130.838 -1.169 41.263 1.00 0.00 H ATOM 36276 C114 OL 906 132.341 -2.540 40.861 1.00 0.00 C ATOM 36277 H14R OL 906 132.740 -1.991 40.006 1.00 0.00 H ATOM 36278 H14S OL 906 133.277 -2.852 41.328 1.00 0.00 H ATOM 36279 C115 OL 906 131.564 -3.791 40.379 1.00 0.00 C ATOM 36280 H15R OL 906 131.175 -4.468 41.142 1.00 0.00 H ATOM 36281 H15S OL 906 130.694 -3.419 39.833 1.00 0.00 H ATOM 36282 C116 OL 906 132.369 -4.648 39.479 1.00 0.00 C ATOM 36283 H16R OL 906 132.559 -4.012 38.612 1.00 0.00 H ATOM 36284 H16S OL 906 133.339 -4.758 39.968 1.00 0.00 H ATOM 36285 C117 OL 906 131.646 -5.978 39.168 1.00 0.00 C ATOM 36286 H17R OL 906 132.225 -6.512 38.412 1.00 0.00 H ATOM 36287 H17S OL 906 131.746 -6.691 39.989 1.00 0.00 H ATOM 36288 C118 OL 906 130.118 -5.850 38.622 1.00 0.00 C ATOM 36289 H18R OL 906 130.045 -4.957 37.996 1.00 0.00 H ATOM 36290 H18S OL 906 129.325 -5.753 39.366 1.00 0.00 H ATOM 36291 H18T OL 906 129.851 -6.697 37.986 1.00 0.00 H TER 36292 OL 906 ATOM 36292 C116 PA 907 62.376 15.536 35.255 1.00 0.00 C ATOM 36293 H16R PA 907 63.372 15.854 35.570 1.00 0.00 H ATOM 36294 H16S PA 907 62.049 15.993 34.319 1.00 0.00 H ATOM 36295 H16T PA 907 62.460 14.456 35.122 1.00 0.00 H ATOM 36296 C115 PA 907 61.313 15.838 36.323 1.00 0.00 C ATOM 36297 H15R PA 907 61.235 16.909 36.523 1.00 0.00 H ATOM 36298 H15S PA 907 61.561 15.390 37.287 1.00 0.00 H ATOM 36299 C114 PA 907 59.990 15.481 35.761 1.00 0.00 C ATOM 36300 H14R PA 907 59.851 14.410 35.920 1.00 0.00 H ATOM 36301 H14S PA 907 59.934 15.758 34.706 1.00 0.00 H ATOM 36302 C113 PA 907 58.896 16.160 36.560 1.00 0.00 C ATOM 36303 H13R PA 907 58.911 17.220 36.300 1.00 0.00 H ATOM 36304 H13S PA 907 59.230 16.155 37.600 1.00 0.00 H ATOM 36305 C112 PA 907 57.552 15.443 36.233 1.00 0.00 C ATOM 36306 H12R PA 907 57.619 14.417 36.601 1.00 0.00 H ATOM 36307 H12S PA 907 57.553 15.386 35.143 1.00 0.00 H ATOM 36308 C111 PA 907 56.298 16.086 36.845 1.00 0.00 C ATOM 36309 H11R PA 907 55.420 15.458 36.681 1.00 0.00 H ATOM 36310 H11S PA 907 56.130 17.086 36.441 1.00 0.00 H ATOM 36311 C110 PA 907 56.497 16.364 38.375 1.00 0.00 C ATOM 36312 H10R PA 907 55.543 16.755 38.734 1.00 0.00 H ATOM 36313 H10S PA 907 57.156 17.225 38.503 1.00 0.00 H ATOM 36314 C19 PA 907 56.971 15.231 39.165 1.00 0.00 C ATOM 36315 H9R PA 907 57.416 15.768 40.006 1.00 0.00 H ATOM 36316 H9S PA 907 57.752 14.693 38.626 1.00 0.00 H ATOM 36317 C18 PA 907 55.905 14.208 39.743 1.00 0.00 C ATOM 36318 H8R PA 907 55.446 13.797 38.842 1.00 0.00 H ATOM 36319 H8S PA 907 55.146 14.765 40.297 1.00 0.00 H ATOM 36320 C17 PA 907 56.545 13.145 40.546 1.00 0.00 C ATOM 36321 H7R PA 907 57.417 12.785 39.998 1.00 0.00 H ATOM 36322 H7S PA 907 55.764 12.388 40.643 1.00 0.00 H ATOM 36323 C16 PA 907 56.848 13.457 42.004 1.00 0.00 C ATOM 36324 H6R PA 907 56.005 13.961 42.481 1.00 0.00 H ATOM 36325 H6S PA 907 57.732 14.098 41.990 1.00 0.00 H ATOM 36326 C15 PA 907 57.162 12.204 42.798 1.00 0.00 C ATOM 36327 H5R PA 907 57.869 11.575 42.253 1.00 0.00 H ATOM 36328 H5S PA 907 56.248 11.606 42.817 1.00 0.00 H ATOM 36329 C14 PA 907 57.481 12.570 44.257 1.00 0.00 C ATOM 36330 H4R PA 907 56.643 13.086 44.733 1.00 0.00 H ATOM 36331 H4S PA 907 58.317 13.267 44.168 1.00 0.00 H ATOM 36332 C13 PA 907 57.919 11.337 45.090 1.00 0.00 C ATOM 36333 H3R PA 907 58.520 10.749 44.392 1.00 0.00 H ATOM 36334 H3S PA 907 57.044 10.712 45.282 1.00 0.00 H ATOM 36335 C12 PA 907 58.781 11.652 46.376 1.00 0.00 C ATOM 36336 H2R PA 907 58.113 12.180 47.059 1.00 0.00 H ATOM 36337 H2S PA 907 59.623 12.321 46.184 1.00 0.00 H ATOM 36338 C11 PC 908 59.281 10.376 47.045 1.00 0.00 C ATOM 36339 O12 PC 908 58.981 9.181 46.726 1.00 0.00 O ATOM 36340 O11 PC 908 60.147 10.694 47.998 1.00 0.00 O ATOM 36341 C1 PC 908 60.960 9.732 48.624 1.00 0.00 C ATOM 36342 HR PC 908 61.621 9.247 47.901 1.00 0.00 H ATOM 36343 HS PC 908 60.286 8.987 49.055 1.00 0.00 H ATOM 36344 C2 PC 908 61.918 10.302 49.660 1.00 0.00 C ATOM 36345 HX PC 908 62.755 9.659 49.945 1.00 0.00 H ATOM 36346 C3 PC 908 61.147 10.597 50.925 1.00 0.00 C ATOM 36347 HA PC 908 60.409 9.814 51.116 1.00 0.00 H ATOM 36348 HB PC 908 60.713 11.594 50.806 1.00 0.00 H ATOM 36349 O31 PC 908 62.007 10.690 52.033 1.00 0.00 O ATOM 36350 P31 PC 908 61.661 11.303 53.524 1.00 0.00 P ATOM 36351 O32 PC 908 61.184 9.930 54.253 1.00 0.00 O ATOM 36352 C31 PC 908 62.134 8.956 54.662 1.00 0.00 C ATOM 36353 H1A PC 908 62.820 9.444 55.359 1.00 0.00 H ATOM 36354 H1B PC 908 62.602 8.689 53.711 1.00 0.00 H ATOM 36355 C32 PC 908 61.505 7.755 55.338 1.00 0.00 C ATOM 36356 H2A PC 908 61.061 8.028 56.297 1.00 0.00 H ATOM 36357 H2B PC 908 62.294 7.016 55.480 1.00 0.00 H ATOM 36358 N31 PC 908 60.336 7.107 54.569 1.00 0.00 N ATOM 36359 C33 PC 908 59.968 5.914 55.299 1.00 0.00 C ATOM 36360 H3A PC 908 59.264 5.347 54.688 1.00 0.00 H ATOM 36361 H3B PC 908 59.574 6.273 56.250 1.00 0.00 H ATOM 36362 H3C PC 908 60.891 5.360 55.474 1.00 0.00 H ATOM 36363 C34 PC 908 59.082 7.986 54.388 1.00 0.00 C ATOM 36364 H4A PC 908 58.208 7.423 54.056 1.00 0.00 H ATOM 36365 H4B PC 908 59.422 8.647 53.589 1.00 0.00 H ATOM 36366 H4C PC 908 58.887 8.463 55.349 1.00 0.00 H ATOM 36367 C35 PC 908 60.777 6.620 53.232 1.00 0.00 C ATOM 36368 H5A PC 908 61.321 7.416 52.720 1.00 0.00 H ATOM 36369 H5B PC 908 59.861 6.349 52.706 1.00 0.00 H ATOM 36370 H5C PC 908 61.458 5.770 53.297 1.00 0.00 H ATOM 36371 O33 PC 908 62.936 11.747 54.142 1.00 0.00 O ATOM 36372 O34 PC 908 60.503 12.184 53.497 1.00 0.00 O ATOM 36373 O21 PC 908 62.462 11.566 49.158 1.00 0.00 O ATOM 36374 C21 PC 908 63.557 11.607 48.465 1.00 0.00 C ATOM 36375 O22 PC 908 64.334 10.675 48.169 1.00 0.00 O ATOM 36376 C12 OL 909 63.761 13.051 47.997 1.00 0.00 C ATOM 36377 H2R OL 909 62.983 13.705 48.397 1.00 0.00 H ATOM 36378 H2S OL 909 64.775 13.320 48.300 1.00 0.00 H ATOM 36379 C13 OL 909 63.841 13.145 46.455 1.00 0.00 C ATOM 36380 H3R OL 909 64.496 14.003 46.296 1.00 0.00 H ATOM 36381 H3S OL 909 64.393 12.251 46.158 1.00 0.00 H ATOM 36382 C14 OL 909 62.443 13.361 45.812 1.00 0.00 C ATOM 36383 H4R OL 909 61.951 12.387 45.828 1.00 0.00 H ATOM 36384 H4S OL 909 61.897 14.048 46.462 1.00 0.00 H ATOM 36385 C15 OL 909 62.326 13.949 44.475 1.00 0.00 C ATOM 36386 H5R OL 909 62.658 14.984 44.575 1.00 0.00 H ATOM 36387 H5S OL 909 63.063 13.382 43.902 1.00 0.00 H ATOM 36388 C16 OL 909 60.923 13.774 43.878 1.00 0.00 C ATOM 36389 H6R OL 909 60.687 12.709 43.834 1.00 0.00 H ATOM 36390 H6S OL 909 60.188 14.361 44.432 1.00 0.00 H ATOM 36391 C17 OL 909 60.865 14.491 42.524 1.00 0.00 C ATOM 36392 H7R OL 909 59.919 14.259 42.031 1.00 0.00 H ATOM 36393 H7S OL 909 60.775 15.567 42.693 1.00 0.00 H ATOM 36394 C18 OL 909 62.011 14.349 41.581 1.00 0.00 C ATOM 36395 H8R OL 909 62.995 14.605 41.979 1.00 0.00 H ATOM 36396 H8S OL 909 62.068 13.274 41.398 1.00 0.00 H ATOM 36397 C19 OL 909 61.744 15.135 40.293 1.00 0.00 C ATOM 36398 H9R OL 909 61.117 14.538 39.636 1.00 0.00 H ATOM 36399 C110 OL 909 62.207 16.294 39.893 1.00 0.00 C ATOM 36400 H10R OL 909 61.971 16.639 38.890 1.00 0.00 H ATOM 36401 C111 OL 909 62.990 17.197 40.771 1.00 0.00 C ATOM 36402 H11R OL 909 63.080 16.729 41.753 1.00 0.00 H ATOM 36403 H11S OL 909 64.021 17.400 40.473 1.00 0.00 H ATOM 36404 C112 OL 909 62.194 18.534 40.972 1.00 0.00 C ATOM 36405 H12R OL 909 61.320 18.529 41.627 1.00 0.00 H ATOM 36406 H12S OL 909 62.841 19.077 41.664 1.00 0.00 H ATOM 36407 C113 OL 909 61.975 19.448 39.693 1.00 0.00 C ATOM 36408 H13R OL 909 62.919 19.682 39.196 1.00 0.00 H ATOM 36409 H13S OL 909 61.375 18.912 38.955 1.00 0.00 H ATOM 36410 C114 OL 909 61.148 20.731 40.102 1.00 0.00 C ATOM 36411 H14R OL 909 61.393 21.147 41.082 1.00 0.00 H ATOM 36412 H14S OL 909 61.585 21.452 39.408 1.00 0.00 H ATOM 36413 C115 OL 909 59.572 20.607 39.927 1.00 0.00 C ATOM 36414 H15R OL 909 59.288 20.384 38.896 1.00 0.00 H ATOM 36415 H15S OL 909 59.272 19.711 40.475 1.00 0.00 H ATOM 36416 C116 OL 909 58.965 21.838 40.202 1.00 0.00 C ATOM 36417 H16R OL 909 59.238 22.067 41.234 1.00 0.00 H ATOM 36418 H16S OL 909 59.237 22.646 39.519 1.00 0.00 H ATOM 36419 C117 OL 909 57.451 21.710 40.167 1.00 0.00 C ATOM 36420 H17R OL 909 57.147 21.899 39.136 1.00 0.00 H ATOM 36421 H17S OL 909 57.061 20.728 40.440 1.00 0.00 H ATOM 36422 C118 OL 909 56.679 22.738 40.972 1.00 0.00 C ATOM 36423 H18R OL 909 55.663 22.613 40.590 1.00 0.00 H ATOM 36424 H18S OL 909 56.943 23.691 40.510 1.00 0.00 H ATOM 36425 H18T OL 909 56.868 22.629 42.042 1.00 0.00 H TER 36426 OL 909 ATOM 36426 C116 PA 910 112.272 114.246 48.341 1.00 0.00 C ATOM 36427 H16R PA 910 111.352 113.700 48.559 1.00 0.00 H ATOM 36428 H16S PA 910 112.210 114.476 47.275 1.00 0.00 H ATOM 36429 H16T PA 910 112.212 115.236 48.800 1.00 0.00 H ATOM 36430 C115 PA 910 113.590 113.727 48.950 1.00 0.00 C ATOM 36431 H15R PA 910 113.438 113.650 50.029 1.00 0.00 H ATOM 36432 H15S PA 910 114.308 114.549 48.923 1.00 0.00 H ATOM 36433 C114 PA 910 114.093 112.334 48.337 1.00 0.00 C ATOM 36434 H14R PA 910 114.243 112.557 47.278 1.00 0.00 H ATOM 36435 H14S PA 910 113.385 111.505 48.389 1.00 0.00 H ATOM 36436 C113 PA 910 115.426 111.859 48.905 1.00 0.00 C ATOM 36437 H13R PA 910 116.185 112.625 48.732 1.00 0.00 H ATOM 36438 H13S PA 910 115.759 110.958 48.384 1.00 0.00 H ATOM 36439 C112 PA 910 115.400 111.536 50.422 1.00 0.00 C ATOM 36440 H12R PA 910 115.042 112.409 50.972 1.00 0.00 H ATOM 36441 H12S PA 910 116.367 111.201 50.804 1.00 0.00 H ATOM 36442 C111 PA 910 114.329 110.527 50.634 1.00 0.00 C ATOM 36443 H11R PA 910 114.515 109.630 50.039 1.00 0.00 H ATOM 36444 H11S PA 910 113.337 110.874 50.340 1.00 0.00 H ATOM 36445 C110 PA 910 114.097 109.946 51.963 1.00 0.00 C ATOM 36446 H10R PA 910 113.385 109.168 51.680 1.00 0.00 H ATOM 36447 H10S PA 910 113.610 110.717 52.564 1.00 0.00 H ATOM 36448 C19 PA 910 115.392 109.536 52.600 1.00 0.00 C ATOM 36449 H9R PA 910 115.861 110.442 52.992 1.00 0.00 H ATOM 36450 H9S PA 910 116.079 109.027 51.921 1.00 0.00 H ATOM 36451 C18 PA 910 115.180 108.446 53.714 1.00 0.00 C ATOM 36452 H8R PA 910 115.061 107.445 53.296 1.00 0.00 H ATOM 36453 H8S PA 910 114.222 108.543 54.228 1.00 0.00 H ATOM 36454 C17 PA 910 116.264 108.345 54.787 1.00 0.00 C ATOM 36455 H7R PA 910 116.240 109.264 55.377 1.00 0.00 H ATOM 36456 H7S PA 910 117.220 108.146 54.298 1.00 0.00 H ATOM 36457 C16 PA 910 116.062 107.148 55.755 1.00 0.00 C ATOM 36458 H6R PA 910 116.953 107.133 56.386 1.00 0.00 H ATOM 36459 H6S PA 910 116.079 106.249 55.136 1.00 0.00 H ATOM 36460 C15 PA 910 114.733 107.333 56.558 1.00 0.00 C ATOM 36461 H5R PA 910 113.922 107.080 55.872 1.00 0.00 H ATOM 36462 H5S PA 910 114.662 108.388 56.830 1.00 0.00 H ATOM 36463 C14 PA 910 114.606 106.520 57.867 1.00 0.00 C ATOM 36464 H4R PA 910 115.355 106.859 58.586 1.00 0.00 H ATOM 36465 H4S PA 910 114.801 105.451 57.766 1.00 0.00 H ATOM 36466 C13 PA 910 113.253 106.586 58.485 1.00 0.00 C ATOM 36467 H3R PA 910 113.385 105.863 59.293 1.00 0.00 H ATOM 36468 H3S PA 910 112.529 106.180 57.775 1.00 0.00 H ATOM 36469 C12 PA 910 112.865 107.943 59.090 1.00 0.00 C ATOM 36470 H2R PA 910 112.343 108.569 58.363 1.00 0.00 H ATOM 36471 H2S PA 910 113.690 108.545 59.476 1.00 0.00 H ATOM 36472 C11 PGR 911 111.852 107.705 60.166 1.00 0.00 C ATOM 36473 O12 PGR 911 112.167 107.467 61.355 1.00 0.00 O ATOM 36474 O11 PGR 911 110.632 107.990 59.758 1.00 0.00 O ATOM 36475 C1 PGR 911 109.587 108.022 60.736 1.00 0.00 C ATOM 36476 HR PGR 911 109.933 108.332 61.725 1.00 0.00 H ATOM 36477 HS PGR 911 109.195 107.006 60.832 1.00 0.00 H ATOM 36478 C2 PGR 911 108.560 108.963 60.216 1.00 0.00 C ATOM 36479 HX PGR 911 109.010 109.841 59.746 1.00 0.00 H ATOM 36480 C3 PGR 911 107.760 109.495 61.379 1.00 0.00 C ATOM 36481 HA PGR 911 106.886 110.099 61.120 1.00 0.00 H ATOM 36482 HB PGR 911 108.386 110.201 61.932 1.00 0.00 H ATOM 36483 O31 PGR 911 107.390 108.470 62.261 1.00 0.00 O ATOM 36484 P31 PGR 911 106.933 108.767 63.768 1.00 0.00 P ATOM 36485 O32 PGR 911 105.421 108.285 63.966 1.00 0.00 O ATOM 36486 C31 PGR 911 104.438 108.864 63.159 1.00 0.00 C ATOM 36487 H1A PGR 911 104.776 109.027 62.132 1.00 0.00 H ATOM 36488 H1B PGR 911 104.265 109.896 63.474 1.00 0.00 H ATOM 36489 C32 PGR 911 103.116 108.089 63.195 1.00 0.00 C ATOM 36490 H2A PGR 911 102.436 108.424 62.408 1.00 0.00 H ATOM 36491 O35 PGR 911 102.482 108.257 64.456 1.00 0.00 O ATOM 36492 HO5A PGR 911 103.172 107.873 65.026 1.00 0.00 H ATOM 36493 C33 PGR 911 103.330 106.525 62.879 1.00 0.00 C ATOM 36494 H3A PGR 911 102.362 106.019 62.851 1.00 0.00 H ATOM 36495 H3B PGR 911 103.699 106.460 61.852 1.00 0.00 H ATOM 36496 O33 PGR 911 107.808 107.937 64.596 1.00 0.00 O ATOM 36497 O34 PGR 911 106.989 110.260 63.983 1.00 0.00 O ATOM 36498 O21 PGR 911 107.696 108.284 59.297 1.00 0.00 O ATOM 36499 C21 PGR 911 106.996 109.065 58.451 1.00 0.00 C ATOM 36500 O22 PGR 911 107.078 110.281 58.304 1.00 0.00 O ATOM 36501 O36 PGR 911 104.211 105.858 63.863 1.00 0.00 O ATOM 36502 HO6A PGR 911 105.074 106.308 63.832 1.00 0.00 H ATOM 36503 C12 OL 912 106.188 108.339 57.485 1.00 0.00 C ATOM 36504 H2R OL 912 106.628 107.357 57.294 1.00 0.00 H ATOM 36505 H2S OL 912 105.256 108.101 58.003 1.00 0.00 H ATOM 36506 C13 OL 912 105.953 109.066 56.169 1.00 0.00 C ATOM 36507 H3R OL 912 105.553 110.046 56.438 1.00 0.00 H ATOM 36508 H3S OL 912 106.935 109.171 55.704 1.00 0.00 H ATOM 36509 C14 OL 912 104.949 108.393 55.230 1.00 0.00 C ATOM 36510 H4R OL 912 105.336 107.435 54.879 1.00 0.00 H ATOM 36511 H4S OL 912 104.024 108.095 55.727 1.00 0.00 H ATOM 36512 C15 OL 912 104.675 109.280 54.073 1.00 0.00 C ATOM 36513 H5R OL 912 103.705 108.998 53.660 1.00 0.00 H ATOM 36514 H5S OL 912 104.537 110.327 54.349 1.00 0.00 H ATOM 36515 C16 OL 912 105.852 109.261 53.036 1.00 0.00 C ATOM 36516 H6R OL 912 106.711 109.773 53.474 1.00 0.00 H ATOM 36517 H6S OL 912 106.151 108.245 52.771 1.00 0.00 H ATOM 36518 C17 OL 912 105.560 110.094 51.794 1.00 0.00 C ATOM 36519 H7R OL 912 105.471 111.115 52.171 1.00 0.00 H ATOM 36520 H7S OL 912 106.378 110.158 51.073 1.00 0.00 H ATOM 36521 C18 OL 912 104.411 109.652 50.981 1.00 0.00 C ATOM 36522 H8R OL 912 104.700 108.637 50.702 1.00 0.00 H ATOM 36523 H8S OL 912 103.430 109.641 51.461 1.00 0.00 H ATOM 36524 C19 OL 912 104.332 110.592 49.828 1.00 0.00 C ATOM 36525 H9R OL 912 105.105 111.356 49.836 1.00 0.00 H ATOM 36526 C110 OL 912 103.409 110.745 48.915 1.00 0.00 C ATOM 36527 H10R OL 912 103.471 111.560 48.199 1.00 0.00 H ATOM 36528 C111 OL 912 102.162 109.966 48.710 1.00 0.00 C ATOM 36529 H11R OL 912 102.165 109.175 49.463 1.00 0.00 H ATOM 36530 H11S OL 912 101.361 110.690 48.873 1.00 0.00 H ATOM 36531 C112 OL 912 101.962 109.476 47.323 1.00 0.00 C ATOM 36532 H12R OL 912 102.048 110.316 46.632 1.00 0.00 H ATOM 36533 H12S OL 912 102.791 108.791 47.132 1.00 0.00 H ATOM 36534 C113 OL 912 100.576 108.808 47.032 1.00 0.00 C ATOM 36535 H13R OL 912 100.687 108.022 46.281 1.00 0.00 H ATOM 36536 H13S OL 912 100.276 108.228 47.907 1.00 0.00 H ATOM 36537 C114 OL 912 99.539 109.730 46.496 1.00 0.00 C ATOM 36538 H14R OL 912 99.572 110.646 47.090 1.00 0.00 H ATOM 36539 H14S OL 912 99.757 110.022 45.467 1.00 0.00 H ATOM 36540 C115 OL 912 98.142 109.018 46.474 1.00 0.00 C ATOM 36541 H15R OL 912 98.264 107.969 46.193 1.00 0.00 H ATOM 36542 H15S OL 912 97.908 108.805 47.519 1.00 0.00 H ATOM 36543 C116 OL 912 97.102 109.709 45.651 1.00 0.00 C ATOM 36544 H16R OL 912 96.975 110.678 46.139 1.00 0.00 H ATOM 36545 H16S OL 912 97.580 109.909 44.690 1.00 0.00 H ATOM 36546 C117 OL 912 95.786 108.872 45.600 1.00 0.00 C ATOM 36547 H17R OL 912 95.835 107.918 45.071 1.00 0.00 H ATOM 36548 H17S OL 912 95.537 108.710 46.651 1.00 0.00 H ATOM 36549 C118 OL 912 94.629 109.611 44.969 1.00 0.00 C ATOM 36550 H18R OL 912 94.456 110.555 45.490 1.00 0.00 H ATOM 36551 H18S OL 912 93.685 109.076 45.092 1.00 0.00 H ATOM 36552 H18T OL 912 94.839 109.911 43.940 1.00 0.00 H TER 36553 OL 912 ATOM 36553 C116 PA 913 144.932 119.167 40.755 1.00 0.00 C ATOM 36554 H16R PA 913 144.086 118.741 40.213 1.00 0.00 H ATOM 36555 H16S PA 913 144.895 118.506 41.623 1.00 0.00 H ATOM 36556 H16T PA 913 145.877 119.015 40.227 1.00 0.00 H ATOM 36557 C115 PA 913 144.919 120.661 41.125 1.00 0.00 C ATOM 36558 H15R PA 913 144.905 121.149 40.148 1.00 0.00 H ATOM 36559 H15S PA 913 145.796 120.980 41.692 1.00 0.00 H ATOM 36560 C114 PA 913 143.735 121.187 41.889 1.00 0.00 C ATOM 36561 H14R PA 913 142.871 120.948 41.265 1.00 0.00 H ATOM 36562 H14S PA 913 143.706 122.278 41.938 1.00 0.00 H ATOM 36563 C113 PA 913 143.546 120.532 43.295 1.00 0.00 C ATOM 36564 H13R PA 913 143.650 119.469 43.068 1.00 0.00 H ATOM 36565 H13S PA 913 142.573 120.785 43.722 1.00 0.00 H ATOM 36566 C112 PA 913 144.609 120.995 44.338 1.00 0.00 C ATOM 36567 H12R PA 913 144.774 122.074 44.353 1.00 0.00 H ATOM 36568 H12S PA 913 145.501 120.536 43.906 1.00 0.00 H ATOM 36569 C111 PA 913 144.279 120.427 45.734 1.00 0.00 C ATOM 36570 H11R PA 913 143.228 120.719 45.787 1.00 0.00 H ATOM 36571 H11S PA 913 144.776 121.088 46.447 1.00 0.00 H ATOM 36572 C110 PA 913 144.563 118.977 46.070 1.00 0.00 C ATOM 36573 H10R PA 913 145.616 118.766 45.872 1.00 0.00 H ATOM 36574 H10S PA 913 144.013 118.220 45.507 1.00 0.00 H ATOM 36575 C19 PA 913 144.229 118.686 47.532 1.00 0.00 C ATOM 36576 H9R PA 913 143.149 118.641 47.686 1.00 0.00 H ATOM 36577 H9S PA 913 144.757 119.383 48.186 1.00 0.00 H ATOM 36578 C18 PA 913 144.893 117.343 47.941 1.00 0.00 C ATOM 36579 H8R PA 913 145.968 117.462 47.788 1.00 0.00 H ATOM 36580 H8S PA 913 144.529 116.553 47.281 1.00 0.00 H ATOM 36581 C17 PA 913 144.632 116.976 49.413 1.00 0.00 C ATOM 36582 H7R PA 913 143.659 116.507 49.569 1.00 0.00 H ATOM 36583 H7S PA 913 144.626 117.893 50.006 1.00 0.00 H ATOM 36584 C16 PA 913 145.776 116.049 49.867 1.00 0.00 C ATOM 36585 H6R PA 913 146.742 116.548 49.769 1.00 0.00 H ATOM 36586 H6S PA 913 145.872 115.234 49.148 1.00 0.00 H ATOM 36587 C15 PA 913 145.830 115.655 51.306 1.00 0.00 C ATOM 36588 H5R PA 913 146.257 116.524 51.811 1.00 0.00 H ATOM 36589 H5S PA 913 146.496 114.822 51.540 1.00 0.00 H ATOM 36590 C14 PA 913 144.471 115.214 51.817 1.00 0.00 C ATOM 36591 H4R PA 913 144.057 114.478 51.125 1.00 0.00 H ATOM 36592 H4S PA 913 143.854 116.107 51.930 1.00 0.00 H ATOM 36593 C13 PA 913 144.589 114.487 53.125 1.00 0.00 C ATOM 36594 H3R PA 913 145.132 115.143 53.809 1.00 0.00 H ATOM 36595 H3S PA 913 145.375 113.737 53.008 1.00 0.00 H ATOM 36596 C12 PA 913 143.255 113.796 53.544 1.00 0.00 C ATOM 36597 H2R PA 913 142.452 114.485 53.814 1.00 0.00 H ATOM 36598 H2S PA 913 142.902 113.079 52.800 1.00 0.00 H ATOM 36599 C11 PGR 914 143.455 113.107 54.884 1.00 0.00 C ATOM 36600 O12 PGR 914 144.248 112.170 54.954 1.00 0.00 O ATOM 36601 O11 PGR 914 142.774 113.628 55.940 1.00 0.00 O ATOM 36602 C1 PGR 914 142.996 113.017 57.258 1.00 0.00 C ATOM 36603 HR PGR 914 143.906 113.462 57.668 1.00 0.00 H ATOM 36604 HS PGR 914 143.005 111.925 57.214 1.00 0.00 H ATOM 36605 C2 PGR 914 141.701 113.435 58.070 1.00 0.00 C ATOM 36606 HX PGR 914 141.385 114.466 57.889 1.00 0.00 H ATOM 36607 C3 PGR 914 141.962 113.211 59.597 1.00 0.00 C ATOM 36608 HA PGR 914 141.081 112.952 60.190 1.00 0.00 H ATOM 36609 HB PGR 914 142.312 114.122 60.089 1.00 0.00 H ATOM 36610 O31 PGR 914 142.912 112.223 59.734 1.00 0.00 O ATOM 36611 P31 PGR 914 143.800 112.055 61.026 1.00 0.00 P ATOM 36612 O32 PGR 914 143.318 110.599 61.502 1.00 0.00 O ATOM 36613 C31 PGR 914 143.720 109.448 60.714 1.00 0.00 C ATOM 36614 H1A PGR 914 144.811 109.434 60.658 1.00 0.00 H ATOM 36615 H1B PGR 914 143.143 109.648 59.807 1.00 0.00 H ATOM 36616 C32 PGR 914 143.213 108.215 61.482 1.00 0.00 C ATOM 36617 H2A PGR 914 143.378 107.340 60.849 1.00 0.00 H ATOM 36618 O35 PGR 914 141.792 108.443 61.817 1.00 0.00 O ATOM 36619 HO5A PGR 914 141.742 108.984 62.625 1.00 0.00 H ATOM 36620 C33 PGR 914 144.029 108.071 62.793 1.00 0.00 C ATOM 36621 H3A PGR 914 145.095 108.004 62.564 1.00 0.00 H ATOM 36622 H3B PGR 914 143.839 109.012 63.315 1.00 0.00 H ATOM 36623 O33 PGR 914 145.215 111.989 60.691 1.00 0.00 O ATOM 36624 O34 PGR 914 143.329 112.980 62.017 1.00 0.00 O ATOM 36625 O21 PGR 914 140.631 112.522 57.611 1.00 0.00 O ATOM 36626 C21 PGR 914 139.373 112.683 58.017 1.00 0.00 C ATOM 36627 O22 PGR 914 139.002 113.591 58.719 1.00 0.00 O ATOM 36628 O36 PGR 914 143.433 106.890 63.500 1.00 0.00 O ATOM 36629 HO6A PGR 914 143.721 106.941 64.429 1.00 0.00 H ATOM 36630 C12 OL 915 138.511 111.544 57.638 1.00 0.00 C ATOM 36631 H2R OL 915 138.405 110.971 58.561 1.00 0.00 H ATOM 36632 H2S OL 915 137.466 111.796 57.446 1.00 0.00 H ATOM 36633 C13 OL 915 139.146 110.528 56.650 1.00 0.00 C ATOM 36634 H3R OL 915 140.221 110.452 56.828 1.00 0.00 H ATOM 36635 H3S OL 915 138.784 109.519 56.861 1.00 0.00 H ATOM 36636 C14 OL 915 138.845 110.953 55.233 1.00 0.00 C ATOM 36637 H4R OL 915 137.778 111.016 55.007 1.00 0.00 H ATOM 36638 H4S OL 915 139.304 111.932 55.080 1.00 0.00 H ATOM 36639 C15 OL 915 139.272 109.855 54.173 1.00 0.00 C ATOM 36640 H5R OL 915 138.564 109.039 54.015 1.00 0.00 H ATOM 36641 H5S OL 915 139.039 110.451 53.288 1.00 0.00 H ATOM 36642 C16 OL 915 140.659 109.134 54.340 1.00 0.00 C ATOM 36643 H6R OL 915 141.384 109.769 54.855 1.00 0.00 H ATOM 36644 H6S OL 915 140.695 108.324 55.071 1.00 0.00 H ATOM 36645 C17 OL 915 141.218 108.661 52.977 1.00 0.00 C ATOM 36646 H7R OL 915 142.167 108.205 53.267 1.00 0.00 H ATOM 36647 H7S OL 915 140.629 107.859 52.528 1.00 0.00 H ATOM 36648 C18 OL 915 141.478 109.807 51.988 1.00 0.00 C ATOM 36649 H8R OL 915 140.600 110.438 51.832 1.00 0.00 H ATOM 36650 H8S OL 915 142.037 110.460 52.662 1.00 0.00 H ATOM 36651 C19 OL 915 142.202 109.508 50.757 1.00 0.00 C ATOM 36652 H9R OL 915 143.059 108.844 50.837 1.00 0.00 H ATOM 36653 C110 OL 915 141.787 109.917 49.501 1.00 0.00 C ATOM 36654 H10R OL 915 142.347 109.529 48.653 1.00 0.00 H ATOM 36655 C111 OL 915 140.723 110.868 49.134 1.00 0.00 C ATOM 36656 H11R OL 915 140.504 110.807 48.066 1.00 0.00 H ATOM 36657 H11S OL 915 139.798 110.545 49.618 1.00 0.00 H ATOM 36658 C112 OL 915 141.114 112.326 49.373 1.00 0.00 C ATOM 36659 H12R OL 915 140.672 112.499 50.356 1.00 0.00 H ATOM 36660 H12S OL 915 142.192 112.421 49.521 1.00 0.00 H ATOM 36661 C113 OL 915 140.592 113.308 48.284 1.00 0.00 C ATOM 36662 H13R OL 915 140.783 113.075 47.234 1.00 0.00 H ATOM 36663 H13S OL 915 139.509 113.228 48.406 1.00 0.00 H ATOM 36664 C114 OL 915 140.965 114.781 48.510 1.00 0.00 C ATOM 36665 H14R OL 915 142.055 114.855 48.524 1.00 0.00 H ATOM 36666 H14S OL 915 140.580 115.420 47.712 1.00 0.00 H ATOM 36667 C115 OL 915 140.318 115.363 49.750 1.00 0.00 C ATOM 36668 H15R OL 915 139.330 114.930 49.925 1.00 0.00 H ATOM 36669 H15S OL 915 140.987 115.068 50.561 1.00 0.00 H ATOM 36670 C116 OL 915 140.372 116.895 49.735 1.00 0.00 C ATOM 36671 H16R OL 915 141.386 117.294 49.674 1.00 0.00 H ATOM 36672 H16S OL 915 140.035 117.275 48.768 1.00 0.00 H ATOM 36673 C117 OL 915 139.657 117.582 50.925 1.00 0.00 C ATOM 36674 H17R OL 915 139.413 118.626 50.713 1.00 0.00 H ATOM 36675 H17S OL 915 138.750 117.028 51.173 1.00 0.00 H ATOM 36676 C118 OL 915 140.535 117.755 52.189 1.00 0.00 C ATOM 36677 H18R OL 915 139.890 117.828 53.068 1.00 0.00 H ATOM 36678 H18S OL 915 141.160 118.622 51.965 1.00 0.00 H ATOM 36679 H18T OL 915 141.211 116.916 52.365 1.00 0.00 H TER 36680 OL 915 ATOM 36680 C116 PA 916 23.941 108.736 39.579 1.00 0.00 C ATOM 36681 H16R PA 916 23.416 108.726 40.536 1.00 0.00 H ATOM 36682 H16S PA 916 23.720 107.814 39.038 1.00 0.00 H ATOM 36683 H16T PA 916 23.445 109.533 39.022 1.00 0.00 H ATOM 36684 C115 PA 916 25.419 108.798 39.727 1.00 0.00 C ATOM 36685 H15R PA 916 25.739 108.842 38.684 1.00 0.00 H ATOM 36686 H15S PA 916 25.623 107.859 40.247 1.00 0.00 H ATOM 36687 C114 PA 916 25.973 109.989 40.584 1.00 0.00 C ATOM 36688 H14R PA 916 25.434 110.066 41.530 1.00 0.00 H ATOM 36689 H14S PA 916 25.656 110.951 40.178 1.00 0.00 H ATOM 36690 C113 PA 916 27.462 110.177 40.674 1.00 0.00 C ATOM 36691 H13R PA 916 27.855 110.493 39.705 1.00 0.00 H ATOM 36692 H13S PA 916 27.917 109.206 40.879 1.00 0.00 H ATOM 36693 C112 PA 916 27.868 111.161 41.837 1.00 0.00 C ATOM 36694 H12R PA 916 27.601 110.825 42.841 1.00 0.00 H ATOM 36695 H12S PA 916 27.278 112.063 41.662 1.00 0.00 H ATOM 36696 C111 PA 916 29.359 111.482 41.794 1.00 0.00 C ATOM 36697 H11R PA 916 29.478 111.893 40.790 1.00 0.00 H ATOM 36698 H11S PA 916 29.958 110.572 41.871 1.00 0.00 H ATOM 36699 C110 PA 916 29.768 112.633 42.815 1.00 0.00 C ATOM 36700 H10R PA 916 28.931 113.313 42.646 1.00 0.00 H ATOM 36701 H10S PA 916 30.696 113.160 42.584 1.00 0.00 H ATOM 36702 C19 PA 916 29.692 112.182 44.280 1.00 0.00 C ATOM 36703 H9R PA 916 30.125 111.180 44.318 1.00 0.00 H ATOM 36704 H9S PA 916 28.662 112.001 44.595 1.00 0.00 H ATOM 36705 C18 PA 916 30.471 113.105 45.236 1.00 0.00 C ATOM 36706 H8R PA 916 30.084 114.125 45.195 1.00 0.00 H ATOM 36707 H8S PA 916 31.546 113.089 45.043 1.00 0.00 H ATOM 36708 C17 PA 916 30.388 112.731 46.714 1.00 0.00 C ATOM 36709 H7R PA 916 30.947 111.826 46.962 1.00 0.00 H ATOM 36710 H7S PA 916 29.357 112.414 46.880 1.00 0.00 H ATOM 36711 C16 PA 916 30.532 113.936 47.679 1.00 0.00 C ATOM 36712 H6R PA 916 29.600 114.501 47.742 1.00 0.00 H ATOM 36713 H6S PA 916 31.321 114.602 47.324 1.00 0.00 H ATOM 36714 C15 PA 916 30.859 113.473 49.042 1.00 0.00 C ATOM 36715 H5R PA 916 31.925 113.331 48.851 1.00 0.00 H ATOM 36716 H5S PA 916 30.493 112.487 49.335 1.00 0.00 H ATOM 36717 C14 PA 916 30.709 114.568 50.075 1.00 0.00 C ATOM 36718 H4R PA 916 29.660 114.836 50.212 1.00 0.00 H ATOM 36719 H4S PA 916 30.991 115.542 49.670 1.00 0.00 H ATOM 36720 C13 PA 916 31.525 114.466 51.426 1.00 0.00 C ATOM 36721 H3R PA 916 32.539 114.163 51.157 1.00 0.00 H ATOM 36722 H3S PA 916 31.134 113.597 51.960 1.00 0.00 H ATOM 36723 C12 PA 916 31.580 115.755 52.289 1.00 0.00 C ATOM 36724 H2R PA 916 30.569 116.093 52.525 1.00 0.00 H ATOM 36725 H2S PA 916 32.093 116.621 51.865 1.00 0.00 H ATOM 36726 C11 PC 917 32.124 115.405 53.609 1.00 0.00 C ATOM 36727 O12 PC 917 32.881 116.088 54.362 1.00 0.00 O ATOM 36728 O11 PC 917 31.574 114.312 54.114 1.00 0.00 O ATOM 36729 C1 PC 917 31.860 113.836 55.478 1.00 0.00 C ATOM 36730 HR PC 917 31.269 114.464 56.149 1.00 0.00 H ATOM 36731 HS PC 917 32.943 113.895 55.609 1.00 0.00 H ATOM 36732 C2 PC 917 31.468 112.331 55.580 1.00 0.00 C ATOM 36733 HX PC 917 30.392 112.262 55.398 1.00 0.00 H ATOM 36734 C3 PC 917 31.840 111.727 56.979 1.00 0.00 C ATOM 36735 HA PC 917 31.637 110.653 57.009 1.00 0.00 H ATOM 36736 HB PC 917 31.366 112.217 57.833 1.00 0.00 H ATOM 36737 O31 PC 917 33.275 111.916 57.096 1.00 0.00 O ATOM 36738 P31 PC 917 34.191 111.236 58.127 1.00 0.00 P ATOM 36739 O32 PC 917 34.165 109.721 57.830 1.00 0.00 O ATOM 36740 C31 PC 917 33.027 108.876 57.976 1.00 0.00 C ATOM 36741 H1A PC 917 32.571 108.848 56.983 1.00 0.00 H ATOM 36742 H1B PC 917 32.372 109.298 58.742 1.00 0.00 H ATOM 36743 C32 PC 917 33.592 107.496 58.300 1.00 0.00 C ATOM 36744 H2A PC 917 34.512 107.346 57.733 1.00 0.00 H ATOM 36745 H2B PC 917 32.831 106.780 57.987 1.00 0.00 H ATOM 36746 N31 PC 917 33.932 107.117 59.751 1.00 0.00 N ATOM 36747 C33 PC 917 32.705 106.962 60.542 1.00 0.00 C ATOM 36748 H3A PC 917 33.079 106.672 61.525 1.00 0.00 H ATOM 36749 H3B PC 917 32.141 106.133 60.111 1.00 0.00 H ATOM 36750 H3C PC 917 32.110 107.877 60.546 1.00 0.00 H ATOM 36751 C34 PC 917 34.708 105.819 59.944 1.00 0.00 C ATOM 36752 H4A PC 917 35.449 105.859 59.144 1.00 0.00 H ATOM 36753 H4B PC 917 34.089 104.921 59.917 1.00 0.00 H ATOM 36754 H4C PC 917 35.286 105.914 60.864 1.00 0.00 H ATOM 36755 C35 PC 917 34.723 108.200 60.442 1.00 0.00 C ATOM 36756 H5A PC 917 34.868 108.009 61.507 1.00 0.00 H ATOM 36757 H5B PC 917 34.195 109.149 60.337 1.00 0.00 H ATOM 36758 H5C PC 917 35.706 108.406 60.017 1.00 0.00 H ATOM 36759 O33 PC 917 35.593 111.688 57.923 1.00 0.00 O ATOM 36760 O34 PC 917 33.558 111.466 59.420 1.00 0.00 O ATOM 36761 O21 PC 917 32.271 111.597 54.566 1.00 0.00 O ATOM 36762 C21 PC 917 31.763 110.415 54.214 1.00 0.00 C ATOM 36763 O22 PC 917 30.715 109.904 54.597 1.00 0.00 O ATOM 36764 C12 OL 918 32.631 109.619 53.213 1.00 0.00 C ATOM 36765 H2R OL 918 33.689 109.842 53.367 1.00 0.00 H ATOM 36766 H2S OL 918 32.508 108.537 53.298 1.00 0.00 H ATOM 36767 C13 OL 918 32.391 110.209 51.824 1.00 0.00 C ATOM 36768 H3R OL 918 31.452 109.853 51.396 1.00 0.00 H ATOM 36769 H3S OL 918 32.398 111.299 51.887 1.00 0.00 H ATOM 36770 C14 OL 918 33.491 109.768 50.825 1.00 0.00 C ATOM 36771 H4R OL 918 34.546 109.824 51.103 1.00 0.00 H ATOM 36772 H4S OL 918 33.384 108.690 50.693 1.00 0.00 H ATOM 36773 C15 OL 918 33.371 110.401 49.506 1.00 0.00 C ATOM 36774 H5R OL 918 32.333 110.393 49.167 1.00 0.00 H ATOM 36775 H5S OL 918 33.578 111.455 49.706 1.00 0.00 H ATOM 36776 C16 OL 918 34.253 109.815 48.387 1.00 0.00 C ATOM 36777 H6R OL 918 35.284 110.127 48.565 1.00 0.00 H ATOM 36778 H6S OL 918 34.194 108.730 48.498 1.00 0.00 H ATOM 36779 C17 OL 918 33.876 110.248 46.927 1.00 0.00 C ATOM 36780 H7R OL 918 32.797 110.102 46.858 1.00 0.00 H ATOM 36781 H7S OL 918 34.026 111.320 46.782 1.00 0.00 H ATOM 36782 C18 OL 918 34.804 109.600 45.866 1.00 0.00 C ATOM 36783 H8R OL 918 35.718 110.182 45.732 1.00 0.00 H ATOM 36784 H8S OL 918 35.047 108.569 46.130 1.00 0.00 H ATOM 36785 C19 OL 918 34.152 109.776 44.503 1.00 0.00 C ATOM 36786 H9R OL 918 34.240 110.800 44.150 1.00 0.00 H ATOM 36787 C110 OL 918 33.419 108.893 43.918 1.00 0.00 C ATOM 36788 H10R OL 918 32.920 109.094 42.973 1.00 0.00 H ATOM 36789 C111 OL 918 33.215 107.437 44.277 1.00 0.00 C ATOM 36790 H11R OL 918 33.516 106.821 43.427 1.00 0.00 H ATOM 36791 H11S OL 918 33.925 107.090 45.029 1.00 0.00 H ATOM 36792 C112 OL 918 31.810 107.213 44.778 1.00 0.00 C ATOM 36793 H12R OL 918 31.619 107.848 45.645 1.00 0.00 H ATOM 36794 H12S OL 918 31.112 107.668 44.072 1.00 0.00 H ATOM 36795 C113 OL 918 31.391 105.856 45.180 1.00 0.00 C ATOM 36796 H13R OL 918 32.231 105.269 45.560 1.00 0.00 H ATOM 36797 H13S OL 918 30.799 105.915 46.096 1.00 0.00 H ATOM 36798 C114 OL 918 30.807 105.106 43.983 1.00 0.00 C ATOM 36799 H14R OL 918 29.900 105.677 43.775 1.00 0.00 H ATOM 36800 H14S OL 918 31.355 105.167 43.040 1.00 0.00 H ATOM 36801 C115 OL 918 30.523 103.562 44.168 1.00 0.00 C ATOM 36802 H15R OL 918 30.116 103.333 45.155 1.00 0.00 H ATOM 36803 H15S OL 918 29.849 103.252 43.366 1.00 0.00 H ATOM 36804 C116 OL 918 31.821 102.803 44.033 1.00 0.00 C ATOM 36805 H16R OL 918 32.104 102.869 42.981 1.00 0.00 H ATOM 36806 H16S OL 918 32.683 103.334 44.442 1.00 0.00 H ATOM 36807 C117 OL 918 31.743 101.368 44.517 1.00 0.00 C ATOM 36808 H17R OL 918 32.707 100.855 44.502 1.00 0.00 H ATOM 36809 H17S OL 918 31.265 101.347 45.498 1.00 0.00 H ATOM 36810 C118 OL 918 30.927 100.504 43.588 1.00 0.00 C ATOM 36811 H18R OL 918 31.253 100.558 42.548 1.00 0.00 H ATOM 36812 H18S OL 918 29.891 100.850 43.580 1.00 0.00 H ATOM 36813 H18T OL 918 31.004 99.498 44.005 1.00 0.00 H TER 36814 OL 918 ATOM 36814 C116 PA 919 47.280 134.256 29.999 1.00 0.00 C ATOM 36815 H16R PA 919 48.105 134.961 30.123 1.00 0.00 H ATOM 36816 H16S PA 919 46.322 134.725 30.234 1.00 0.00 H ATOM 36817 H16T PA 919 47.277 134.124 28.915 1.00 0.00 H ATOM 36818 C115 PA 919 47.599 132.974 30.853 1.00 0.00 C ATOM 36819 H15R PA 919 48.442 132.464 30.381 1.00 0.00 H ATOM 36820 H15S PA 919 46.822 132.238 30.633 1.00 0.00 H ATOM 36821 C114 PA 919 47.627 133.334 32.318 1.00 0.00 C ATOM 36822 H14R PA 919 46.767 133.958 32.567 1.00 0.00 H ATOM 36823 H14S PA 919 48.469 134.000 32.517 1.00 0.00 H ATOM 36824 C113 PA 919 47.660 132.163 33.300 1.00 0.00 C ATOM 36825 H13R PA 919 48.435 131.454 33.002 1.00 0.00 H ATOM 36826 H13S PA 919 46.701 131.639 33.316 1.00 0.00 H ATOM 36827 C112 PA 919 47.955 132.773 34.721 1.00 0.00 C ATOM 36828 H12R PA 919 47.139 133.398 35.088 1.00 0.00 H ATOM 36829 H12S PA 919 48.886 133.338 34.637 1.00 0.00 H ATOM 36830 C111 PA 919 47.966 131.693 35.714 1.00 0.00 C ATOM 36831 H11R PA 919 48.791 130.995 35.562 1.00 0.00 H ATOM 36832 H11S PA 919 47.042 131.112 35.660 1.00 0.00 H ATOM 36833 C110 PA 919 48.028 132.143 37.186 1.00 0.00 C ATOM 36834 H10R PA 919 47.307 132.922 37.443 1.00 0.00 H ATOM 36835 H10S PA 919 49.023 132.512 37.441 1.00 0.00 H ATOM 36836 C19 PA 919 47.677 131.024 38.255 1.00 0.00 C ATOM 36837 H9R PA 919 48.524 130.351 38.402 1.00 0.00 H ATOM 36838 H9S PA 919 46.813 130.456 37.904 1.00 0.00 H ATOM 36839 C18 PA 919 47.354 131.476 39.723 1.00 0.00 C ATOM 36840 H8R PA 919 47.191 130.502 40.188 1.00 0.00 H ATOM 36841 H8S PA 919 46.379 131.959 39.812 1.00 0.00 H ATOM 36842 C17 PA 919 48.444 132.313 40.475 1.00 0.00 C ATOM 36843 H7R PA 919 47.903 132.735 41.325 1.00 0.00 H ATOM 36844 H7S PA 919 48.792 133.173 39.900 1.00 0.00 H ATOM 36845 C16 PA 919 49.722 131.468 40.857 1.00 0.00 C ATOM 36846 H6R PA 919 50.443 131.285 40.057 1.00 0.00 H ATOM 36847 H6S PA 919 49.412 130.464 41.156 1.00 0.00 H ATOM 36848 C15 PA 919 50.486 132.027 42.061 1.00 0.00 C ATOM 36849 H5R PA 919 49.826 132.484 42.801 1.00 0.00 H ATOM 36850 H5S PA 919 51.162 132.805 41.698 1.00 0.00 H ATOM 36851 C14 PA 919 51.331 131.010 42.732 1.00 0.00 C ATOM 36852 H4R PA 919 52.016 130.534 42.027 1.00 0.00 H ATOM 36853 H4S PA 919 50.737 130.143 43.029 1.00 0.00 H ATOM 36854 C13 PA 919 52.046 131.550 43.905 1.00 0.00 C ATOM 36855 H3R PA 919 51.288 132.073 44.493 1.00 0.00 H ATOM 36856 H3S PA 919 52.778 132.284 43.564 1.00 0.00 H ATOM 36857 C12 PA 919 52.689 130.450 44.671 1.00 0.00 C ATOM 36858 H2R PA 919 53.627 130.172 44.187 1.00 0.00 H ATOM 36859 H2S PA 919 52.246 129.453 44.619 1.00 0.00 H ATOM 36860 C11 PGR 920 52.967 130.753 46.116 1.00 0.00 C ATOM 36861 O12 PGR 920 52.825 131.832 46.681 1.00 0.00 O ATOM 36862 O11 PGR 920 53.475 129.690 46.760 1.00 0.00 O ATOM 36863 C1 PGR 920 53.939 129.804 48.141 1.00 0.00 C ATOM 36864 HR PGR 920 53.183 130.180 48.834 1.00 0.00 H ATOM 36865 HS PGR 920 54.766 130.508 48.259 1.00 0.00 H ATOM 36866 C2 PGR 920 54.635 128.486 48.423 1.00 0.00 C ATOM 36867 HX PGR 920 54.002 127.793 47.863 1.00 0.00 H ATOM 36868 C3 PGR 920 54.734 128.182 49.957 1.00 0.00 C ATOM 36869 HA PGR 920 55.308 127.270 50.141 1.00 0.00 H ATOM 36870 HB PGR 920 53.777 127.926 50.419 1.00 0.00 H ATOM 36871 O31 PGR 920 55.312 129.253 50.616 1.00 0.00 O ATOM 36872 P31 PGR 920 55.176 129.495 52.167 1.00 0.00 P ATOM 36873 O32 PGR 920 53.675 129.744 52.466 1.00 0.00 O ATOM 36874 C31 PGR 920 53.024 130.881 51.890 1.00 0.00 C ATOM 36875 H1A PGR 920 53.033 130.735 50.807 1.00 0.00 H ATOM 36876 H1B PGR 920 53.578 131.812 52.031 1.00 0.00 H ATOM 36877 C32 PGR 920 51.542 130.942 52.358 1.00 0.00 C ATOM 36878 H2A PGR 920 51.495 131.032 53.446 1.00 0.00 H ATOM 36879 O35 PGR 920 50.958 129.619 52.183 1.00 0.00 O ATOM 36880 HO5A PGR 920 50.021 129.739 52.421 1.00 0.00 H ATOM 36881 C33 PGR 920 50.703 132.068 51.706 1.00 0.00 C ATOM 36882 H3A PGR 920 49.660 132.236 51.985 1.00 0.00 H ATOM 36883 H3B PGR 920 51.204 133.023 51.884 1.00 0.00 H ATOM 36884 O33 PGR 920 55.605 128.274 52.955 1.00 0.00 O ATOM 36885 O34 PGR 920 55.939 130.734 52.341 1.00 0.00 O ATOM 36886 O21 PGR 920 55.937 128.424 47.753 1.00 0.00 O ATOM 36887 C21 PGR 920 56.469 127.215 47.616 1.00 0.00 C ATOM 36888 O22 PGR 920 55.845 126.195 47.918 1.00 0.00 O ATOM 36889 O36 PGR 920 50.836 131.771 50.297 1.00 0.00 O ATOM 36890 HO6A PGR 920 50.368 130.930 50.147 1.00 0.00 H ATOM 36891 C12 OL 921 57.950 127.322 47.267 1.00 0.00 C ATOM 36892 H2R OL 921 58.125 128.262 46.741 1.00 0.00 H ATOM 36893 H2S OL 921 58.457 127.333 48.234 1.00 0.00 H ATOM 36894 C13 OL 921 58.415 126.255 46.309 1.00 0.00 C ATOM 36895 H3R OL 921 59.444 126.394 45.971 1.00 0.00 H ATOM 36896 H3S OL 921 58.373 125.252 46.736 1.00 0.00 H ATOM 36897 C14 OL 921 57.603 126.124 44.954 1.00 0.00 C ATOM 36898 H4R OL 921 56.527 126.013 45.101 1.00 0.00 H ATOM 36899 H4S OL 921 57.693 127.084 44.441 1.00 0.00 H ATOM 36900 C15 OL 921 58.180 125.173 44.016 1.00 0.00 C ATOM 36901 H5R OL 921 59.220 125.460 43.847 1.00 0.00 H ATOM 36902 H5S OL 921 57.988 124.198 44.470 1.00 0.00 H ATOM 36903 C16 OL 921 57.510 125.070 42.623 1.00 0.00 C ATOM 36904 H6R OL 921 56.448 124.822 42.687 1.00 0.00 H ATOM 36905 H6S OL 921 57.531 125.993 42.041 1.00 0.00 H ATOM 36906 C17 OL 921 58.293 124.030 41.752 1.00 0.00 C ATOM 36907 H7R OL 921 59.241 123.798 42.243 1.00 0.00 H ATOM 36908 H7S OL 921 57.671 123.133 41.707 1.00 0.00 H ATOM 36909 C18 OL 921 58.493 124.417 40.320 1.00 0.00 C ATOM 36910 H8R OL 921 57.546 124.712 39.864 1.00 0.00 H ATOM 36911 H8S OL 921 59.104 125.322 40.293 1.00 0.00 H ATOM 36912 C19 OL 921 59.087 123.318 39.545 1.00 0.00 C ATOM 36913 H9R OL 921 58.418 122.462 39.501 1.00 0.00 H ATOM 36914 C110 OL 921 60.287 123.335 38.907 1.00 0.00 C ATOM 36915 H10R OL 921 60.491 122.453 38.305 1.00 0.00 H ATOM 36916 C111 OL 921 61.352 124.316 38.791 1.00 0.00 C ATOM 36917 H11R OL 921 61.290 125.032 39.613 1.00 0.00 H ATOM 36918 H11S OL 921 62.308 123.850 39.039 1.00 0.00 H ATOM 36919 C112 OL 921 61.510 124.927 37.408 1.00 0.00 C ATOM 36920 H12R OL 921 61.573 124.126 36.668 1.00 0.00 H ATOM 36921 H12S OL 921 60.615 125.499 37.155 1.00 0.00 H ATOM 36922 C113 OL 921 62.672 125.854 37.208 1.00 0.00 C ATOM 36923 H13R OL 921 62.685 126.512 38.080 1.00 0.00 H ATOM 36924 H13S OL 921 63.577 125.307 37.481 1.00 0.00 H ATOM 36925 C114 OL 921 62.710 126.591 35.858 1.00 0.00 C ATOM 36926 H14R OL 921 62.771 125.867 35.043 1.00 0.00 H ATOM 36927 H14S OL 921 61.756 127.091 35.674 1.00 0.00 H ATOM 36928 C115 OL 921 63.677 127.699 35.770 1.00 0.00 C ATOM 36929 H15R OL 921 64.487 127.539 36.484 1.00 0.00 H ATOM 36930 H15S OL 921 64.229 127.495 34.850 1.00 0.00 H ATOM 36931 C116 OL 921 63.128 129.153 35.759 1.00 0.00 C ATOM 36932 H16R OL 921 62.340 129.264 35.012 1.00 0.00 H ATOM 36933 H16S OL 921 62.575 129.404 36.667 1.00 0.00 H ATOM 36934 C117 OL 921 64.222 130.230 35.416 1.00 0.00 C ATOM 36935 H17R OL 921 65.152 130.109 35.976 1.00 0.00 H ATOM 36936 H17S OL 921 64.522 130.012 34.389 1.00 0.00 H ATOM 36937 C118 OL 921 63.707 131.639 35.675 1.00 0.00 C ATOM 36938 H18R OL 921 62.821 131.906 35.095 1.00 0.00 H ATOM 36939 H18S OL 921 64.563 132.194 35.286 1.00 0.00 H ATOM 36940 H18T OL 921 63.567 131.943 36.715 1.00 0.00 H TER 36941 OL 921 ATOM 36941 C116 PA 922 32.120 97.601 46.940 1.00 0.00 C ATOM 36942 H16R PA 922 31.208 97.972 46.468 1.00 0.00 H ATOM 36943 H16S PA 922 32.175 96.536 46.704 1.00 0.00 H ATOM 36944 H16T PA 922 32.911 98.200 46.486 1.00 0.00 H ATOM 36945 C115 PA 922 32.046 97.799 48.471 1.00 0.00 C ATOM 36946 H15R PA 922 33.110 97.656 48.672 1.00 0.00 H ATOM 36947 H15S PA 922 31.416 97.017 48.899 1.00 0.00 H ATOM 36948 C114 PA 922 31.720 99.250 48.906 1.00 0.00 C ATOM 36949 H14R PA 922 31.269 98.970 49.860 1.00 0.00 H ATOM 36950 H14S PA 922 30.942 99.624 48.238 1.00 0.00 H ATOM 36951 C113 PA 922 32.891 100.315 48.911 1.00 0.00 C ATOM 36952 H13R PA 922 33.441 100.279 47.968 1.00 0.00 H ATOM 36953 H13S PA 922 33.636 100.122 49.686 1.00 0.00 H ATOM 36954 C112 PA 922 32.438 101.758 48.912 1.00 0.00 C ATOM 36955 H12R PA 922 31.837 101.986 49.795 1.00 0.00 H ATOM 36956 H12S PA 922 31.806 101.797 48.023 1.00 0.00 H ATOM 36957 C111 PA 922 33.533 102.789 48.996 1.00 0.00 C ATOM 36958 H11R PA 922 34.316 102.622 48.253 1.00 0.00 H ATOM 36959 H11S PA 922 34.030 102.676 49.961 1.00 0.00 H ATOM 36960 C110 PA 922 33.184 104.181 48.669 1.00 0.00 C ATOM 36961 H10R PA 922 33.091 104.320 47.590 1.00 0.00 H ATOM 36962 H10S PA 922 34.080 104.803 48.719 1.00 0.00 H ATOM 36963 C19 PA 922 32.014 104.704 49.521 1.00 0.00 C ATOM 36964 H9R PA 922 32.143 104.378 50.555 1.00 0.00 H ATOM 36965 H9S PA 922 31.090 104.233 49.179 1.00 0.00 H ATOM 36966 C18 PA 922 31.858 106.183 49.586 1.00 0.00 C ATOM 36967 H8R PA 922 31.283 106.480 48.706 1.00 0.00 H ATOM 36968 H8S PA 922 32.798 106.717 49.435 1.00 0.00 H ATOM 36969 C17 PA 922 31.353 106.706 50.938 1.00 0.00 C ATOM 36970 H7R PA 922 31.397 107.797 50.932 1.00 0.00 H ATOM 36971 H7S PA 922 32.019 106.315 51.710 1.00 0.00 H ATOM 36972 C16 PA 922 29.883 106.309 51.112 1.00 0.00 C ATOM 36973 H6R PA 922 29.647 105.314 50.728 1.00 0.00 H ATOM 36974 H6S PA 922 29.305 107.024 50.522 1.00 0.00 H ATOM 36975 C15 PA 922 29.391 106.390 52.560 1.00 0.00 C ATOM 36976 H5R PA 922 29.760 107.336 52.960 1.00 0.00 H ATOM 36977 H5S PA 922 29.759 105.614 53.235 1.00 0.00 H ATOM 36978 C14 PA 922 27.886 106.539 52.710 1.00 0.00 C ATOM 36979 H4R PA 922 27.548 107.362 52.077 1.00 0.00 H ATOM 36980 H4S PA 922 27.607 106.869 53.713 1.00 0.00 H ATOM 36981 C13 PA 922 27.008 105.351 52.316 1.00 0.00 C ATOM 36982 H3R PA 922 27.474 104.901 51.437 1.00 0.00 H ATOM 36983 H3S PA 922 26.058 105.762 51.970 1.00 0.00 H ATOM 36984 C12 PA 922 26.968 104.285 53.411 1.00 0.00 C ATOM 36985 H2R PA 922 27.885 104.036 53.948 1.00 0.00 H ATOM 36986 H2S PA 922 26.765 103.340 52.902 1.00 0.00 H ATOM 36987 C11 PGR 923 25.960 104.638 54.456 1.00 0.00 C ATOM 36988 O12 PGR 923 26.151 104.636 55.660 1.00 0.00 O ATOM 36989 O11 PGR 923 24.727 104.932 53.887 1.00 0.00 O ATOM 36990 C1 PGR 923 23.631 105.301 54.739 1.00 0.00 C ATOM 36991 HR PGR 923 23.468 104.480 55.442 1.00 0.00 H ATOM 36992 HS PGR 923 22.760 105.411 54.088 1.00 0.00 H ATOM 36993 C2 PGR 923 23.897 106.615 55.380 1.00 0.00 C ATOM 36994 HX PGR 923 24.842 106.466 55.908 1.00 0.00 H ATOM 36995 C3 PGR 923 22.800 107.156 56.329 1.00 0.00 C ATOM 36996 HA PGR 923 21.825 107.392 55.895 1.00 0.00 H ATOM 36997 HB PGR 923 23.263 108.032 56.789 1.00 0.00 H ATOM 36998 O31 PGR 923 22.675 106.181 57.410 1.00 0.00 O ATOM 36999 P31 PGR 923 21.666 106.310 58.658 1.00 0.00 P ATOM 37000 O32 PGR 923 20.247 106.094 58.003 1.00 0.00 O ATOM 37001 C31 PGR 923 19.765 104.773 57.832 1.00 0.00 C ATOM 37002 H1A PGR 923 19.247 104.470 58.746 1.00 0.00 H ATOM 37003 H1B PGR 923 20.613 104.103 57.670 1.00 0.00 H ATOM 37004 C32 PGR 923 18.953 104.607 56.560 1.00 0.00 C ATOM 37005 H2A PGR 923 18.847 103.523 56.462 1.00 0.00 H ATOM 37006 O35 PGR 923 19.633 105.179 55.469 1.00 0.00 O ATOM 37007 HO5A PGR 923 19.333 106.094 55.617 1.00 0.00 H ATOM 37008 C33 PGR 923 17.519 105.250 56.641 1.00 0.00 C ATOM 37009 H3A PGR 923 17.037 105.234 55.660 1.00 0.00 H ATOM 37010 H3B PGR 923 16.910 104.643 57.316 1.00 0.00 H ATOM 37011 O33 PGR 923 21.990 105.205 59.622 1.00 0.00 O ATOM 37012 O34 PGR 923 21.675 107.721 59.017 1.00 0.00 O ATOM 37013 O21 PGR 923 24.005 107.618 54.249 1.00 0.00 O ATOM 37014 C21 PGR 923 24.644 108.772 54.473 1.00 0.00 C ATOM 37015 O22 PGR 923 25.334 108.899 55.471 1.00 0.00 O ATOM 37016 O36 PGR 923 17.478 106.607 57.035 1.00 0.00 O ATOM 37017 HO6A PGR 923 17.890 106.719 57.910 1.00 0.00 H ATOM 37018 C12 OL 924 24.600 109.723 53.288 1.00 0.00 C ATOM 37019 H2R OL 924 24.295 110.667 53.744 1.00 0.00 H ATOM 37020 H2S OL 924 25.651 109.921 53.064 1.00 0.00 H ATOM 37021 C13 OL 924 23.653 109.216 52.184 1.00 0.00 C ATOM 37022 H3R OL 924 23.929 108.178 51.986 1.00 0.00 H ATOM 37023 H3S OL 924 22.621 109.166 52.537 1.00 0.00 H ATOM 37024 C14 OL 924 23.584 110.086 50.963 1.00 0.00 C ATOM 37025 H4R OL 924 23.437 111.122 51.274 1.00 0.00 H ATOM 37026 H4S OL 924 24.489 110.024 50.355 1.00 0.00 H ATOM 37027 C15 OL 924 22.384 109.593 50.111 1.00 0.00 C ATOM 37028 H5R OL 924 22.573 108.574 49.767 1.00 0.00 H ATOM 37029 H5S OL 924 21.446 109.487 50.661 1.00 0.00 H ATOM 37030 C16 OL 924 22.171 110.446 48.860 1.00 0.00 C ATOM 37031 H6R OL 924 21.311 109.997 48.359 1.00 0.00 H ATOM 37032 H6S OL 924 21.824 111.457 49.084 1.00 0.00 H ATOM 37033 C17 OL 924 23.388 110.607 47.999 1.00 0.00 C ATOM 37034 H7R OL 924 22.963 110.966 47.060 1.00 0.00 H ATOM 37035 H7S OL 924 24.077 111.346 48.413 1.00 0.00 H ATOM 37036 C18 OL 924 24.176 109.314 47.729 1.00 0.00 C ATOM 37037 H8R OL 924 25.008 109.581 47.075 1.00 0.00 H ATOM 37038 H8S OL 924 24.786 108.954 48.560 1.00 0.00 H ATOM 37039 C19 OL 924 23.516 108.176 46.868 1.00 0.00 C ATOM 37040 H9R OL 924 22.807 108.560 46.138 1.00 0.00 H ATOM 37041 C110 OL 924 23.677 106.854 47.107 1.00 0.00 C ATOM 37042 H10R OL 924 23.095 106.134 46.538 1.00 0.00 H ATOM 37043 C111 OL 924 24.624 106.185 48.135 1.00 0.00 C ATOM 37044 H11R OL 924 25.487 105.732 47.643 1.00 0.00 H ATOM 37045 H11S OL 924 25.148 106.985 48.661 1.00 0.00 H ATOM 37046 C112 OL 924 23.856 105.209 49.012 1.00 0.00 C ATOM 37047 H12R OL 924 23.607 104.344 48.394 1.00 0.00 H ATOM 37048 H12S OL 924 24.372 104.812 49.888 1.00 0.00 H ATOM 37049 C113 OL 924 22.651 105.702 49.697 1.00 0.00 C ATOM 37050 H13R OL 924 22.886 106.652 50.180 1.00 0.00 H ATOM 37051 H13S OL 924 21.905 105.979 48.949 1.00 0.00 H ATOM 37052 C114 OL 924 22.043 104.741 50.722 1.00 0.00 C ATOM 37053 H14R OL 924 21.845 103.795 50.212 1.00 0.00 H ATOM 37054 H14S OL 924 22.703 104.551 51.571 1.00 0.00 H ATOM 37055 C115 OL 924 20.810 105.401 51.220 1.00 0.00 C ATOM 37056 H15R OL 924 21.177 106.311 51.700 1.00 0.00 H ATOM 37057 H15S OL 924 20.219 105.721 50.359 1.00 0.00 H ATOM 37058 C116 OL 924 20.058 104.444 52.195 1.00 0.00 C ATOM 37059 H16R OL 924 20.787 103.945 52.836 1.00 0.00 H ATOM 37060 H16S OL 924 19.517 105.106 52.875 1.00 0.00 H ATOM 37061 C117 OL 924 19.243 103.417 51.518 1.00 0.00 C ATOM 37062 H17R OL 924 19.961 102.776 51.002 1.00 0.00 H ATOM 37063 H17S OL 924 18.776 102.802 52.290 1.00 0.00 H ATOM 37064 C118 OL 924 18.132 103.860 50.606 1.00 0.00 C ATOM 37065 H18R OL 924 17.260 104.281 51.110 1.00 0.00 H ATOM 37066 H18S OL 924 17.701 103.065 49.994 1.00 0.00 H ATOM 37067 H18T OL 924 18.490 104.592 49.879 1.00 0.00 H TER 37068 OL 924 ATOM 37068 C116 PA 925 29.086 124.476 38.498 1.00 0.00 C ATOM 37069 H16R PA 925 29.193 125.062 37.583 1.00 0.00 H ATOM 37070 H16S PA 925 28.061 124.267 38.809 1.00 0.00 H ATOM 37071 H16T PA 925 29.596 123.510 38.491 1.00 0.00 H ATOM 37072 C115 PA 925 29.787 125.234 39.603 1.00 0.00 C ATOM 37073 H15R PA 925 29.680 124.510 40.414 1.00 0.00 H ATOM 37074 H15S PA 925 29.396 126.234 39.803 1.00 0.00 H ATOM 37075 C114 PA 925 31.280 125.304 39.284 1.00 0.00 C ATOM 37076 H14R PA 925 31.463 126.008 38.470 1.00 0.00 H ATOM 37077 H14S PA 925 31.610 124.315 38.961 1.00 0.00 H ATOM 37078 C113 PA 925 32.130 125.775 40.457 1.00 0.00 C ATOM 37079 H13R PA 925 31.598 126.581 40.967 1.00 0.00 H ATOM 37080 H13S PA 925 33.106 126.163 40.157 1.00 0.00 H ATOM 37081 C112 PA 925 32.435 124.749 41.537 1.00 0.00 C ATOM 37082 H12R PA 925 32.870 123.850 41.095 1.00 0.00 H ATOM 37083 H12S PA 925 31.525 124.362 42.000 1.00 0.00 H ATOM 37084 C111 PA 925 33.356 125.244 42.611 1.00 0.00 C ATOM 37085 H11R PA 925 33.393 124.363 43.255 1.00 0.00 H ATOM 37086 H11S PA 925 32.848 125.988 43.228 1.00 0.00 H ATOM 37087 C110 PA 925 34.754 125.649 42.223 1.00 0.00 C ATOM 37088 H10R PA 925 34.678 126.378 41.413 1.00 0.00 H ATOM 37089 H10S PA 925 35.133 124.739 41.754 1.00 0.00 H ATOM 37090 C19 PA 925 35.481 126.367 43.377 1.00 0.00 C ATOM 37091 H9R PA 925 35.059 127.365 43.512 1.00 0.00 H ATOM 37092 H9S PA 925 36.508 126.623 43.110 1.00 0.00 H ATOM 37093 C18 PA 925 35.380 125.525 44.647 1.00 0.00 C ATOM 37094 H8R PA 925 35.458 124.473 44.363 1.00 0.00 H ATOM 37095 H8S PA 925 34.397 125.723 45.080 1.00 0.00 H ATOM 37096 C17 PA 925 36.400 125.966 45.734 1.00 0.00 C ATOM 37097 H7R PA 925 35.907 125.684 46.667 1.00 0.00 H ATOM 37098 H7S PA 925 36.504 127.049 45.827 1.00 0.00 H ATOM 37099 C16 PA 925 37.731 125.178 45.603 1.00 0.00 C ATOM 37100 H6R PA 925 38.319 125.557 44.764 1.00 0.00 H ATOM 37101 H6S PA 925 37.578 124.119 45.383 1.00 0.00 H ATOM 37102 C15 PA 925 38.549 125.244 46.893 1.00 0.00 C ATOM 37103 H5R PA 925 39.579 124.885 46.854 1.00 0.00 H ATOM 37104 H5S PA 925 38.048 124.641 47.653 1.00 0.00 H ATOM 37105 C14 PA 925 38.734 126.635 47.538 1.00 0.00 C ATOM 37106 H4R PA 925 37.785 126.865 48.027 1.00 0.00 H ATOM 37107 H4S PA 925 39.011 127.409 46.819 1.00 0.00 H ATOM 37108 C13 PA 925 39.762 126.565 48.729 1.00 0.00 C ATOM 37109 H3R PA 925 39.882 127.561 49.161 1.00 0.00 H ATOM 37110 H3S PA 925 40.751 126.382 48.304 1.00 0.00 H ATOM 37111 C12 PA 925 39.417 125.696 49.940 1.00 0.00 C ATOM 37112 H2R PA 925 39.766 124.668 49.817 1.00 0.00 H ATOM 37113 H2S PA 925 38.328 125.775 49.981 1.00 0.00 H ATOM 37114 C11 PC 926 39.991 126.152 51.257 1.00 0.00 C ATOM 37115 O12 PC 926 39.305 126.807 51.993 1.00 0.00 O ATOM 37116 O11 PC 926 41.345 125.947 51.475 1.00 0.00 O ATOM 37117 C1 PC 926 41.921 126.212 52.780 1.00 0.00 C ATOM 37118 HR PC 926 41.596 125.508 53.550 1.00 0.00 H ATOM 37119 HS PC 926 41.565 127.201 53.080 1.00 0.00 H ATOM 37120 C2 PC 926 43.445 126.304 52.738 1.00 0.00 C ATOM 37121 HX PC 926 43.840 125.387 52.293 1.00 0.00 H ATOM 37122 C3 PC 926 44.052 126.315 54.123 1.00 0.00 C ATOM 37123 HA PC 926 45.129 126.464 54.010 1.00 0.00 H ATOM 37124 HB PC 926 43.758 125.396 54.637 1.00 0.00 H ATOM 37125 O31 PC 926 43.432 127.356 54.824 1.00 0.00 O ATOM 37126 P31 PC 926 43.813 127.656 56.337 1.00 0.00 P ATOM 37127 O32 PC 926 43.186 126.452 57.131 1.00 0.00 O ATOM 37128 C31 PC 926 41.840 126.220 57.199 1.00 0.00 C ATOM 37129 H1A PC 926 41.505 126.107 56.165 1.00 0.00 H ATOM 37130 H1B PC 926 41.253 126.889 57.833 1.00 0.00 H ATOM 37131 C32 PC 926 41.782 124.868 57.867 1.00 0.00 C ATOM 37132 H2A PC 926 42.259 124.341 57.039 1.00 0.00 H ATOM 37133 H2B PC 926 40.742 124.541 57.908 1.00 0.00 H ATOM 37134 N31 PC 926 42.447 124.604 59.204 1.00 0.00 N ATOM 37135 C33 PC 926 42.435 123.115 59.321 1.00 0.00 C ATOM 37136 H3A PC 926 43.148 122.759 58.576 1.00 0.00 H ATOM 37137 H3B PC 926 41.443 122.814 58.980 1.00 0.00 H ATOM 37138 H3C PC 926 42.786 122.762 60.292 1.00 0.00 H ATOM 37139 C34 PC 926 43.784 125.167 59.359 1.00 0.00 C ATOM 37140 H4A PC 926 44.198 124.725 60.266 1.00 0.00 H ATOM 37141 H4B PC 926 43.830 126.255 59.410 1.00 0.00 H ATOM 37142 H4C PC 926 44.338 124.775 58.504 1.00 0.00 H ATOM 37143 C35 PC 926 41.680 125.228 60.318 1.00 0.00 C ATOM 37144 H5A PC 926 41.866 126.303 60.315 1.00 0.00 H ATOM 37145 H5B PC 926 42.116 124.962 61.282 1.00 0.00 H ATOM 37146 H5C PC 926 40.658 124.855 60.229 1.00 0.00 H ATOM 37147 O33 PC 926 45.229 127.670 56.520 1.00 0.00 O ATOM 37148 O34 PC 926 43.010 128.810 56.797 1.00 0.00 O ATOM 37149 O21 PC 926 43.796 127.439 51.945 1.00 0.00 O ATOM 37150 C21 PC 926 45.069 127.683 51.576 1.00 0.00 C ATOM 37151 O22 PC 926 45.873 126.749 51.606 1.00 0.00 O ATOM 37152 C12 OL 927 45.243 129.164 51.293 1.00 0.00 C ATOM 37153 H2R OL 927 44.303 129.518 50.864 1.00 0.00 H ATOM 37154 H2S OL 927 45.509 129.517 52.291 1.00 0.00 H ATOM 37155 C13 OL 927 46.295 129.517 50.284 1.00 0.00 C ATOM 37156 H3R OL 927 47.300 129.179 50.542 1.00 0.00 H ATOM 37157 H3S OL 927 46.013 128.950 49.394 1.00 0.00 H ATOM 37158 C14 OL 927 46.292 130.947 49.972 1.00 0.00 C ATOM 37159 H4R OL 927 45.350 131.272 49.525 1.00 0.00 H ATOM 37160 H4S OL 927 46.292 131.501 50.913 1.00 0.00 H ATOM 37161 C15 OL 927 47.494 131.447 49.174 1.00 0.00 C ATOM 37162 H5R OL 927 47.437 132.537 49.184 1.00 0.00 H ATOM 37163 H5S OL 927 48.376 131.194 49.765 1.00 0.00 H ATOM 37164 C16 OL 927 47.529 130.800 47.651 1.00 0.00 C ATOM 37165 H6R OL 927 48.351 131.245 47.086 1.00 0.00 H ATOM 37166 H6S OL 927 47.906 129.775 47.678 1.00 0.00 H ATOM 37167 C17 OL 927 46.266 130.834 46.809 1.00 0.00 C ATOM 37168 H7R OL 927 46.573 130.493 45.818 1.00 0.00 H ATOM 37169 H7S OL 927 45.452 130.185 47.139 1.00 0.00 H ATOM 37170 C18 OL 927 45.528 132.197 46.720 1.00 0.00 C ATOM 37171 H8R OL 927 45.434 132.499 47.765 1.00 0.00 H ATOM 37172 H8S OL 927 46.236 132.903 46.281 1.00 0.00 H ATOM 37173 C19 OL 927 44.247 132.253 45.968 1.00 0.00 C ATOM 37174 H9R OL 927 43.713 131.310 46.053 1.00 0.00 H ATOM 37175 C110 OL 927 43.653 133.241 45.363 1.00 0.00 C ATOM 37176 H10R OL 927 42.716 133.102 44.831 1.00 0.00 H ATOM 37177 C111 OL 927 44.214 134.676 45.383 1.00 0.00 C ATOM 37178 H11R OL 927 43.441 135.327 45.798 1.00 0.00 H ATOM 37179 H11S OL 927 45.014 134.759 46.121 1.00 0.00 H ATOM 37180 C112 OL 927 44.517 135.267 44.019 1.00 0.00 C ATOM 37181 H12R OL 927 45.292 134.704 43.493 1.00 0.00 H ATOM 37182 H12S OL 927 43.653 134.992 43.411 1.00 0.00 H ATOM 37183 C113 OL 927 44.798 136.801 44.012 1.00 0.00 C ATOM 37184 H13R OL 927 44.017 137.184 44.671 1.00 0.00 H ATOM 37185 H13S OL 927 45.719 137.245 44.395 1.00 0.00 H ATOM 37186 C114 OL 927 44.617 137.462 42.672 1.00 0.00 C ATOM 37187 H14R OL 927 44.868 138.525 42.671 1.00 0.00 H ATOM 37188 H14S OL 927 45.323 137.025 41.962 1.00 0.00 H ATOM 37189 C115 OL 927 43.096 137.426 42.222 1.00 0.00 C ATOM 37190 H15R OL 927 42.894 136.370 42.035 1.00 0.00 H ATOM 37191 H15S OL 927 42.419 137.768 43.007 1.00 0.00 H ATOM 37192 C116 OL 927 42.762 137.992 40.851 1.00 0.00 C ATOM 37193 H16R OL 927 43.042 139.045 40.917 1.00 0.00 H ATOM 37194 H16S OL 927 43.374 137.498 40.093 1.00 0.00 H ATOM 37195 C117 OL 927 41.340 137.967 40.295 1.00 0.00 C ATOM 37196 H17R OL 927 41.379 138.298 39.255 1.00 0.00 H ATOM 37197 H17S OL 927 40.876 136.979 40.308 1.00 0.00 H ATOM 37198 C118 OL 927 40.326 138.877 40.933 1.00 0.00 C ATOM 37199 H18R OL 927 40.336 138.763 42.019 1.00 0.00 H ATOM 37200 H18S OL 927 39.272 138.662 40.745 1.00 0.00 H ATOM 37201 H18T OL 927 40.548 139.945 40.880 1.00 0.00 H TER 37202 OL 927 ATOM 37202 C116 PA 928 52.725 135.106 34.773 1.00 0.00 C ATOM 37203 H16R PA 928 53.500 134.716 34.111 1.00 0.00 H ATOM 37204 H16S PA 928 53.194 135.398 35.715 1.00 0.00 H ATOM 37205 H16T PA 928 52.431 136.112 34.466 1.00 0.00 H ATOM 37206 C115 PA 928 51.528 134.182 35.086 1.00 0.00 C ATOM 37207 H15R PA 928 51.184 133.867 34.098 1.00 0.00 H ATOM 37208 H15S PA 928 50.623 134.672 35.450 1.00 0.00 H ATOM 37209 C114 PA 928 51.695 133.066 36.121 1.00 0.00 C ATOM 37210 H14R PA 928 50.728 132.565 36.043 1.00 0.00 H ATOM 37211 H14S PA 928 51.706 133.597 37.075 1.00 0.00 H ATOM 37212 C113 PA 928 52.867 132.085 36.053 1.00 0.00 C ATOM 37213 H13R PA 928 53.727 132.753 35.971 1.00 0.00 H ATOM 37214 H13S PA 928 52.845 131.630 35.060 1.00 0.00 H ATOM 37215 C112 PA 928 52.921 131.052 37.150 1.00 0.00 C ATOM 37216 H12R PA 928 52.022 130.446 37.016 1.00 0.00 H ATOM 37217 H12S PA 928 52.780 131.608 38.080 1.00 0.00 H ATOM 37218 C111 PA 928 54.170 130.188 37.125 1.00 0.00 C ATOM 37219 H11R PA 928 55.075 130.781 36.978 1.00 0.00 H ATOM 37220 H11S PA 928 54.117 129.493 36.284 1.00 0.00 H ATOM 37221 C110 PA 928 54.358 129.311 38.335 1.00 0.00 C ATOM 37222 H10R PA 928 55.187 128.617 38.181 1.00 0.00 H ATOM 37223 H10S PA 928 53.504 128.631 38.370 1.00 0.00 H ATOM 37224 C19 PA 928 54.552 130.176 39.596 1.00 0.00 C ATOM 37225 H9R PA 928 53.567 130.634 39.703 1.00 0.00 H ATOM 37226 H9S PA 928 55.317 130.903 39.315 1.00 0.00 H ATOM 37227 C18 PA 928 54.961 129.491 40.896 1.00 0.00 C ATOM 37228 H8R PA 928 55.622 128.697 40.543 1.00 0.00 H ATOM 37229 H8S PA 928 54.124 128.964 41.357 1.00 0.00 H ATOM 37230 C17 PA 928 55.728 130.253 42.064 1.00 0.00 C ATOM 37231 H7R PA 928 55.073 131.038 42.449 1.00 0.00 H ATOM 37232 H7S PA 928 56.669 130.675 41.705 1.00 0.00 H ATOM 37233 C16 PA 928 55.971 129.270 43.187 1.00 0.00 C ATOM 37234 H6R PA 928 56.604 128.445 42.852 1.00 0.00 H ATOM 37235 H6S PA 928 55.041 128.757 43.440 1.00 0.00 H ATOM 37236 C15 PA 928 56.435 129.955 44.494 1.00 0.00 C ATOM 37237 H5R PA 928 56.445 129.273 45.346 1.00 0.00 H ATOM 37238 H5S PA 928 55.626 130.664 44.681 1.00 0.00 H ATOM 37239 C14 PA 928 57.847 130.665 44.505 1.00 0.00 C ATOM 37240 H4R PA 928 57.909 131.283 43.607 1.00 0.00 H ATOM 37241 H4S PA 928 58.640 129.934 44.338 1.00 0.00 H ATOM 37242 C13 PA 928 58.039 131.439 45.776 1.00 0.00 C ATOM 37243 H3R PA 928 57.796 130.773 46.607 1.00 0.00 H ATOM 37244 H3S PA 928 57.323 132.252 45.912 1.00 0.00 H ATOM 37245 C12 PA 928 59.580 131.850 45.955 1.00 0.00 C ATOM 37246 H2R PA 928 59.883 132.612 45.235 1.00 0.00 H ATOM 37247 H2S PA 928 60.268 131.005 45.885 1.00 0.00 H ATOM 37248 C11 PGR 929 59.816 132.462 47.358 1.00 0.00 C ATOM 37249 O12 PGR 929 58.927 133.032 47.982 1.00 0.00 O ATOM 37250 O11 PGR 929 61.114 132.341 47.796 1.00 0.00 O ATOM 37251 C1 PGR 929 61.318 132.605 49.175 1.00 0.00 C ATOM 37252 HR PGR 929 60.724 131.998 49.863 1.00 0.00 H ATOM 37253 HS PGR 929 60.961 133.617 49.386 1.00 0.00 H ATOM 37254 C2 PGR 929 62.806 132.572 49.451 1.00 0.00 C ATOM 37255 HX PGR 929 63.243 131.675 49.006 1.00 0.00 H ATOM 37256 C3 PGR 929 62.984 132.376 50.964 1.00 0.00 C ATOM 37257 HA PGR 929 63.969 131.998 51.252 1.00 0.00 H ATOM 37258 HB PGR 929 62.355 131.521 51.222 1.00 0.00 H ATOM 37259 O31 PGR 929 62.667 133.496 51.723 1.00 0.00 O ATOM 37260 P31 PGR 929 62.963 133.523 53.331 1.00 0.00 P ATOM 37261 O32 PGR 929 64.551 133.332 53.176 1.00 0.00 O ATOM 37262 C31 PGR 929 65.407 134.333 52.872 1.00 0.00 C ATOM 37263 H1A PGR 929 65.227 135.068 53.661 1.00 0.00 H ATOM 37264 H1B PGR 929 65.251 134.903 51.953 1.00 0.00 H ATOM 37265 C32 PGR 929 66.803 133.869 53.140 1.00 0.00 C ATOM 37266 H2A PGR 929 67.311 134.725 53.591 1.00 0.00 H ATOM 37267 O35 PGR 929 67.467 133.566 51.929 1.00 0.00 O ATOM 37268 HO5A PGR 929 67.311 132.642 51.664 1.00 0.00 H ATOM 37269 C33 PGR 929 67.021 132.730 54.031 1.00 0.00 C ATOM 37270 H3A PGR 929 68.086 132.495 54.112 1.00 0.00 H ATOM 37271 H3B PGR 929 66.771 133.030 55.052 1.00 0.00 H ATOM 37272 O33 PGR 929 62.687 134.885 53.823 1.00 0.00 O ATOM 37273 O34 PGR 929 62.425 132.288 53.969 1.00 0.00 O ATOM 37274 O21 PGR 929 63.491 133.724 48.862 1.00 0.00 O ATOM 37275 C21 PGR 929 64.852 133.722 49.029 1.00 0.00 C ATOM 37276 O22 PGR 929 65.570 132.877 49.553 1.00 0.00 O ATOM 37277 O36 PGR 929 66.350 131.499 53.598 1.00 0.00 O ATOM 37278 HO6A PGR 929 65.407 131.740 53.636 1.00 0.00 H ATOM 37279 C12 OL 930 65.467 134.950 48.356 1.00 0.00 C ATOM 37280 H2R OL 930 64.643 135.485 47.879 1.00 0.00 H ATOM 37281 H2S OL 930 65.899 135.644 49.080 1.00 0.00 H ATOM 37282 C13 OL 930 66.571 134.602 47.318 1.00 0.00 C ATOM 37283 H3R OL 930 67.453 134.164 47.790 1.00 0.00 H ATOM 37284 H3S OL 930 66.288 133.855 46.574 1.00 0.00 H ATOM 37285 C14 OL 930 66.979 135.771 46.470 1.00 0.00 C ATOM 37286 H4R OL 930 66.121 136.177 45.931 1.00 0.00 H ATOM 37287 H4S OL 930 67.316 136.529 47.180 1.00 0.00 H ATOM 37288 C15 OL 930 68.144 135.474 45.457 1.00 0.00 C ATOM 37289 H5R OL 930 68.570 136.328 44.927 1.00 0.00 H ATOM 37290 H5S OL 930 68.948 135.010 46.033 1.00 0.00 H ATOM 37291 C16 OL 930 67.744 134.574 44.323 1.00 0.00 C ATOM 37292 H6R OL 930 67.216 133.715 44.741 1.00 0.00 H ATOM 37293 H6S OL 930 66.943 135.085 43.784 1.00 0.00 H ATOM 37294 C17 OL 930 68.821 134.044 43.381 1.00 0.00 C ATOM 37295 H7R OL 930 69.398 134.953 43.200 1.00 0.00 H ATOM 37296 H7S OL 930 69.475 133.310 43.858 1.00 0.00 H ATOM 37297 C18 OL 930 68.201 133.378 42.159 1.00 0.00 C ATOM 37298 H8R OL 930 67.389 132.733 42.502 1.00 0.00 H ATOM 37299 H8S OL 930 67.748 134.084 41.460 1.00 0.00 H ATOM 37300 C19 OL 930 69.236 132.643 41.387 1.00 0.00 C ATOM 37301 H9R OL 930 69.111 131.598 41.658 1.00 0.00 H ATOM 37302 C110 OL 930 70.010 133.125 40.406 1.00 0.00 C ATOM 37303 H10R OL 930 70.685 132.435 39.906 1.00 0.00 H ATOM 37304 C111 OL 930 70.134 134.564 40.091 1.00 0.00 C ATOM 37305 H11R OL 930 69.259 135.170 40.334 1.00 0.00 H ATOM 37306 H11S OL 930 70.967 135.031 40.622 1.00 0.00 H ATOM 37307 C112 OL 930 70.283 134.695 38.609 1.00 0.00 C ATOM 37308 H12R OL 930 71.103 134.065 38.257 1.00 0.00 H ATOM 37309 H12S OL 930 69.396 134.214 38.192 1.00 0.00 H ATOM 37310 C113 OL 930 70.212 136.068 38.160 1.00 0.00 C ATOM 37311 H13R OL 930 69.263 136.498 38.487 1.00 0.00 H ATOM 37312 H13S OL 930 70.923 136.720 38.672 1.00 0.00 H ATOM 37313 C114 OL 930 70.267 136.285 36.690 1.00 0.00 C ATOM 37314 H14R OL 930 71.280 136.597 36.429 1.00 0.00 H ATOM 37315 H14S OL 930 70.242 135.389 36.065 1.00 0.00 H ATOM 37316 C115 OL 930 69.303 137.344 36.199 1.00 0.00 C ATOM 37317 H15R OL 930 69.195 137.217 35.120 1.00 0.00 H ATOM 37318 H15S OL 930 68.320 137.179 36.645 1.00 0.00 H ATOM 37319 C116 OL 930 69.637 138.785 36.486 1.00 0.00 C ATOM 37320 H16R OL 930 69.958 138.942 37.518 1.00 0.00 H ATOM 37321 H16S OL 930 70.457 139.164 35.873 1.00 0.00 H ATOM 37322 C117 OL 930 68.509 139.683 36.252 1.00 0.00 C ATOM 37323 H17R OL 930 67.694 139.398 36.920 1.00 0.00 H ATOM 37324 H17S OL 930 68.951 140.629 36.573 1.00 0.00 H ATOM 37325 C118 OL 930 67.847 139.731 34.951 1.00 0.00 C ATOM 37326 H18R OL 930 67.574 138.760 34.533 1.00 0.00 H ATOM 37327 H18S OL 930 68.543 140.134 34.212 1.00 0.00 H ATOM 37328 H18T OL 930 66.942 140.342 34.967 1.00 0.00 H TER 37329 OL 930 ATOM 37329 C116 PA 931 52.233 105.199 42.541 1.00 0.00 C ATOM 37330 H16R PA 931 51.699 106.072 42.924 1.00 0.00 H ATOM 37331 H16S PA 931 52.726 105.577 41.642 1.00 0.00 H ATOM 37332 H16T PA 931 52.881 104.784 43.315 1.00 0.00 H ATOM 37333 C115 PA 931 50.977 104.301 42.092 1.00 0.00 C ATOM 37334 H15R PA 931 51.260 103.490 41.418 1.00 0.00 H ATOM 37335 H15S PA 931 50.222 104.880 41.556 1.00 0.00 H ATOM 37336 C114 PA 931 50.145 103.657 43.169 1.00 0.00 C ATOM 37337 H14R PA 931 49.404 103.058 42.635 1.00 0.00 H ATOM 37338 H14S PA 931 49.673 104.392 43.824 1.00 0.00 H ATOM 37339 C113 PA 931 50.943 102.840 44.221 1.00 0.00 C ATOM 37340 H13R PA 931 51.799 103.469 44.475 1.00 0.00 H ATOM 37341 H13S PA 931 51.491 102.009 43.771 1.00 0.00 H ATOM 37342 C112 PA 931 50.105 102.344 45.414 1.00 0.00 C ATOM 37343 H12R PA 931 49.654 103.213 45.897 1.00 0.00 H ATOM 37344 H12S PA 931 50.873 101.840 46.005 1.00 0.00 H ATOM 37345 C111 PA 931 49.073 101.302 44.937 1.00 0.00 C ATOM 37346 H11R PA 931 49.559 100.570 44.289 1.00 0.00 H ATOM 37347 H11S PA 931 48.279 101.788 44.366 1.00 0.00 H ATOM 37348 C110 PA 931 48.448 100.395 46.050 1.00 0.00 C ATOM 37349 H10R PA 931 49.214 99.900 46.651 1.00 0.00 H ATOM 37350 H10S PA 931 48.019 99.535 45.531 1.00 0.00 H ATOM 37351 C19 PA 931 47.397 100.983 46.965 1.00 0.00 C ATOM 37352 H9R PA 931 46.534 101.402 46.443 1.00 0.00 H ATOM 37353 H9S PA 931 47.945 101.844 47.354 1.00 0.00 H ATOM 37354 C18 PA 931 46.800 100.048 47.977 1.00 0.00 C ATOM 37355 H8R PA 931 47.656 99.458 48.310 1.00 0.00 H ATOM 37356 H8S PA 931 46.035 99.459 47.467 1.00 0.00 H ATOM 37357 C17 PA 931 46.278 100.919 49.179 1.00 0.00 C ATOM 37358 H7R PA 931 45.307 101.297 48.851 1.00 0.00 H ATOM 37359 H7S PA 931 46.982 101.735 49.355 1.00 0.00 H ATOM 37360 C16 PA 931 46.173 100.268 50.570 1.00 0.00 C ATOM 37361 H6R PA 931 45.318 99.615 50.756 1.00 0.00 H ATOM 37362 H6S PA 931 45.796 101.127 51.129 1.00 0.00 H ATOM 37363 C15 PA 931 47.385 99.542 51.190 1.00 0.00 C ATOM 37364 H5R PA 931 48.361 99.922 50.883 1.00 0.00 H ATOM 37365 H5S PA 931 47.375 98.480 50.937 1.00 0.00 H ATOM 37366 C14 PA 931 47.270 99.617 52.691 1.00 0.00 C ATOM 37367 H4R PA 931 47.653 100.602 52.967 1.00 0.00 H ATOM 37368 H4S PA 931 47.890 98.890 53.219 1.00 0.00 H ATOM 37369 C13 PA 931 45.874 99.355 53.355 1.00 0.00 C ATOM 37370 H3R PA 931 45.547 98.429 52.878 1.00 0.00 H ATOM 37371 H3S PA 931 45.192 100.142 53.027 1.00 0.00 H ATOM 37372 C12 PA 931 45.847 99.098 54.785 1.00 0.00 C ATOM 37373 H2R PA 931 45.757 100.061 55.291 1.00 0.00 H ATOM 37374 H2S PA 931 46.759 98.613 55.141 1.00 0.00 H ATOM 37375 C11 PGR 932 44.732 98.090 55.144 1.00 0.00 C ATOM 37376 O12 PGR 932 43.576 98.384 54.904 1.00 0.00 O ATOM 37377 O11 PGR 932 45.199 96.912 55.571 1.00 0.00 O ATOM 37378 C1 PGR 932 44.221 95.979 55.977 1.00 0.00 C ATOM 37379 HR PGR 932 43.634 95.675 55.106 1.00 0.00 H ATOM 37380 HS PGR 932 43.603 96.481 56.726 1.00 0.00 H ATOM 37381 C2 PGR 932 44.827 94.783 56.737 1.00 0.00 C ATOM 37382 HX PGR 932 43.992 94.176 57.096 1.00 0.00 H ATOM 37383 C3 PGR 932 45.614 95.181 58.039 1.00 0.00 C ATOM 37384 HA PGR 932 45.028 95.915 58.600 1.00 0.00 H ATOM 37385 HB PGR 932 46.569 95.635 57.762 1.00 0.00 H ATOM 37386 O31 PGR 932 45.837 94.080 58.822 1.00 0.00 O ATOM 37387 P31 PGR 932 46.342 94.174 60.307 1.00 0.00 P ATOM 37388 O32 PGR 932 47.901 94.707 60.118 1.00 0.00 O ATOM 37389 C31 PGR 932 48.967 93.847 60.111 1.00 0.00 C ATOM 37390 H1A PGR 932 48.844 93.119 60.918 1.00 0.00 H ATOM 37391 H1B PGR 932 49.864 94.424 60.349 1.00 0.00 H ATOM 37392 C32 PGR 932 49.356 93.324 58.746 1.00 0.00 C ATOM 37393 H2A PGR 932 49.432 94.168 58.056 1.00 0.00 H ATOM 37394 O35 PGR 932 48.257 92.540 58.291 1.00 0.00 O ATOM 37395 HO5A PGR 932 47.560 93.221 58.285 1.00 0.00 H ATOM 37396 C33 PGR 932 50.607 92.521 58.774 1.00 0.00 C ATOM 37397 H3A PGR 932 50.794 92.096 57.785 1.00 0.00 H ATOM 37398 H3B PGR 932 51.493 93.108 59.032 1.00 0.00 H ATOM 37399 O33 PGR 932 45.538 95.159 61.016 1.00 0.00 O ATOM 37400 O34 PGR 932 46.441 92.778 60.785 1.00 0.00 O ATOM 37401 O21 PGR 932 45.593 93.954 55.860 1.00 0.00 O ATOM 37402 C21 PGR 932 46.723 94.370 55.288 1.00 0.00 C ATOM 37403 O22 PGR 932 47.417 95.271 55.652 1.00 0.00 O ATOM 37404 O36 PGR 932 50.488 91.393 59.654 1.00 0.00 O ATOM 37405 HO6A PGR 932 50.429 91.775 60.548 1.00 0.00 H ATOM 37406 C12 OL 933 47.003 93.489 54.059 1.00 0.00 C ATOM 37407 H2R OL 933 47.872 93.875 53.522 1.00 0.00 H ATOM 37408 H2S OL 933 47.262 92.536 54.525 1.00 0.00 H ATOM 37409 C13 OL 933 45.794 93.476 53.109 1.00 0.00 C ATOM 37410 H3R OL 933 45.908 92.792 52.266 1.00 0.00 H ATOM 37411 H3S OL 933 44.950 93.031 53.641 1.00 0.00 H ATOM 37412 C14 OL 933 45.558 94.917 52.495 1.00 0.00 C ATOM 37413 H4R OL 933 45.379 95.725 53.207 1.00 0.00 H ATOM 37414 H4S OL 933 46.458 95.258 51.978 1.00 0.00 H ATOM 37415 C15 OL 933 44.343 94.834 51.569 1.00 0.00 C ATOM 37416 H5R OL 933 44.559 94.150 50.745 1.00 0.00 H ATOM 37417 H5S OL 933 43.520 94.462 52.183 1.00 0.00 H ATOM 37418 C16 OL 933 43.952 96.134 50.853 1.00 0.00 C ATOM 37419 H6R OL 933 43.067 96.076 50.217 1.00 0.00 H ATOM 37420 H6S OL 933 43.813 96.860 51.656 1.00 0.00 H ATOM 37421 C17 OL 933 45.002 96.763 50.020 1.00 0.00 C ATOM 37422 H7R OL 933 44.725 97.734 49.606 1.00 0.00 H ATOM 37423 H7S OL 933 45.917 96.842 50.609 1.00 0.00 H ATOM 37424 C18 OL 933 45.483 95.874 48.861 1.00 0.00 C ATOM 37425 H8R OL 933 45.844 94.943 49.304 1.00 0.00 H ATOM 37426 H8S OL 933 44.676 95.553 48.199 1.00 0.00 H ATOM 37427 C19 OL 933 46.622 96.447 48.063 1.00 0.00 C ATOM 37428 H9R OL 933 46.379 97.260 47.383 1.00 0.00 H ATOM 37429 C110 OL 933 47.871 95.926 47.963 1.00 0.00 C ATOM 37430 H10R OL 933 48.551 96.236 47.174 1.00 0.00 H ATOM 37431 C111 OL 933 48.402 94.864 48.789 1.00 0.00 C ATOM 37432 H11R OL 933 47.800 94.708 49.686 1.00 0.00 H ATOM 37433 H11S OL 933 48.308 94.006 48.119 1.00 0.00 H ATOM 37434 C112 OL 933 49.929 94.845 49.223 1.00 0.00 C ATOM 37435 H12R OL 933 50.090 93.782 49.412 1.00 0.00 H ATOM 37436 H12S OL 933 50.593 95.078 48.388 1.00 0.00 H ATOM 37437 C113 OL 933 50.239 95.638 50.461 1.00 0.00 C ATOM 37438 H13R OL 933 49.569 95.438 51.300 1.00 0.00 H ATOM 37439 H13S OL 933 51.235 95.450 50.867 1.00 0.00 H ATOM 37440 C114 OL 933 50.037 97.150 50.280 1.00 0.00 C ATOM 37441 H14R OL 933 48.953 97.260 50.353 1.00 0.00 H ATOM 37442 H14S OL 933 50.464 97.738 51.095 1.00 0.00 H ATOM 37443 C115 OL 933 50.624 97.888 49.080 1.00 0.00 C ATOM 37444 H15R OL 933 50.083 97.634 48.167 1.00 0.00 H ATOM 37445 H15S OL 933 50.406 98.958 49.070 1.00 0.00 H ATOM 37446 C116 OL 933 52.064 97.658 48.686 1.00 0.00 C ATOM 37447 H16R OL 933 52.724 97.840 49.537 1.00 0.00 H ATOM 37448 H16S OL 933 52.372 96.619 48.554 1.00 0.00 H ATOM 37449 C117 OL 933 52.532 98.428 47.422 1.00 0.00 C ATOM 37450 H17R OL 933 53.612 98.272 47.385 1.00 0.00 H ATOM 37451 H17S OL 933 52.245 97.959 46.478 1.00 0.00 H ATOM 37452 C118 OL 933 52.438 99.911 47.278 1.00 0.00 C ATOM 37453 H18R OL 933 52.908 100.182 46.331 1.00 0.00 H ATOM 37454 H18S OL 933 52.782 100.482 48.143 1.00 0.00 H ATOM 37455 H18T OL 933 51.373 100.089 47.113 1.00 0.00 H TER 37456 OL 933 ATOM 37456 C116 PA 934 92.715 144.796 37.308 1.00 0.00 C ATOM 37457 H16R PA 934 92.666 145.828 37.660 1.00 0.00 H ATOM 37458 H16S PA 934 91.971 144.848 36.510 1.00 0.00 H ATOM 37459 H16T PA 934 93.679 144.477 36.906 1.00 0.00 H ATOM 37460 C115 PA 934 92.084 143.785 38.365 1.00 0.00 C ATOM 37461 H15R PA 934 91.748 142.842 37.929 1.00 0.00 H ATOM 37462 H15S PA 934 91.162 144.192 38.786 1.00 0.00 H ATOM 37463 C114 PA 934 93.089 143.395 39.337 1.00 0.00 C ATOM 37464 H14R PA 934 93.354 144.248 39.964 1.00 0.00 H ATOM 37465 H14S PA 934 94.029 143.003 38.942 1.00 0.00 H ATOM 37466 C113 PA 934 92.608 142.308 40.353 1.00 0.00 C ATOM 37467 H13R PA 934 92.370 141.390 39.813 1.00 0.00 H ATOM 37468 H13S PA 934 91.688 142.692 40.798 1.00 0.00 H ATOM 37469 C112 PA 934 93.555 142.163 41.480 1.00 0.00 C ATOM 37470 H12R PA 934 93.956 143.112 41.840 1.00 0.00 H ATOM 37471 H12S PA 934 94.448 141.610 41.183 1.00 0.00 H ATOM 37472 C111 PA 934 92.936 141.367 42.709 1.00 0.00 C ATOM 37473 H11R PA 934 92.358 140.492 42.404 1.00 0.00 H ATOM 37474 H11S PA 934 92.121 141.894 43.211 1.00 0.00 H ATOM 37475 C110 PA 934 93.864 141.016 43.862 1.00 0.00 C ATOM 37476 H10R PA 934 94.924 141.251 43.746 1.00 0.00 H ATOM 37477 H10S PA 934 93.803 139.945 44.068 1.00 0.00 H ATOM 37478 C19 PA 934 93.369 141.658 45.263 1.00 0.00 C ATOM 37479 H9R PA 934 93.183 142.717 45.074 1.00 0.00 H ATOM 37480 H9S PA 934 94.266 141.720 45.882 1.00 0.00 H ATOM 37481 C18 PA 934 92.153 140.887 45.911 1.00 0.00 C ATOM 37482 H8R PA 934 92.321 139.810 45.981 1.00 0.00 H ATOM 37483 H8S PA 934 91.324 140.945 45.202 1.00 0.00 H ATOM 37484 C17 PA 934 91.647 141.493 47.153 1.00 0.00 C ATOM 37485 H7R PA 934 90.831 140.863 47.511 1.00 0.00 H ATOM 37486 H7S PA 934 91.350 142.514 46.906 1.00 0.00 H ATOM 37487 C16 PA 934 92.573 141.734 48.342 1.00 0.00 C ATOM 37488 H6R PA 934 91.925 142.149 49.118 1.00 0.00 H ATOM 37489 H6S PA 934 93.260 142.532 48.053 1.00 0.00 H ATOM 37490 C15 PA 934 93.158 140.422 48.875 1.00 0.00 C ATOM 37491 H5R PA 934 94.160 140.657 49.240 1.00 0.00 H ATOM 37492 H5S PA 934 93.412 139.814 48.005 1.00 0.00 H ATOM 37493 C14 PA 934 92.414 139.723 49.969 1.00 0.00 C ATOM 37494 H4R PA 934 91.531 139.286 49.498 1.00 0.00 H ATOM 37495 H4S PA 934 92.124 140.468 50.714 1.00 0.00 H ATOM 37496 C13 PA 934 93.217 138.540 50.584 1.00 0.00 C ATOM 37497 H3R PA 934 94.007 139.076 51.114 1.00 0.00 H ATOM 37498 H3S PA 934 93.669 137.956 49.780 1.00 0.00 H ATOM 37499 C12 PA 934 92.483 137.608 51.545 1.00 0.00 C ATOM 37500 H2R PA 934 93.245 136.995 52.032 1.00 0.00 H ATOM 37501 H2S PA 934 91.842 136.869 51.060 1.00 0.00 H ATOM 37502 C11 PGR 935 91.723 138.324 52.550 1.00 0.00 C ATOM 37503 O12 PGR 935 92.293 138.794 53.484 1.00 0.00 O ATOM 37504 O11 PGR 935 90.428 138.451 52.214 1.00 0.00 O ATOM 37505 C1 PGR 935 89.484 139.082 53.061 1.00 0.00 C ATOM 37506 HR PGR 935 89.449 138.670 54.073 1.00 0.00 H ATOM 37507 HS PGR 935 88.513 138.938 52.580 1.00 0.00 H ATOM 37508 C2 PGR 935 89.955 140.554 53.273 1.00 0.00 C ATOM 37509 HX PGR 935 91.043 140.570 53.378 1.00 0.00 H ATOM 37510 C3 PGR 935 89.218 141.226 54.431 1.00 0.00 C ATOM 37511 HA PGR 935 89.313 140.504 55.247 1.00 0.00 H ATOM 37512 HB PGR 935 88.148 141.289 54.220 1.00 0.00 H ATOM 37513 O31 PGR 935 89.783 142.409 54.842 1.00 0.00 O ATOM 37514 P31 PGR 935 89.690 142.928 56.340 1.00 0.00 P ATOM 37515 O32 PGR 935 88.282 143.707 56.350 1.00 0.00 O ATOM 37516 C31 PGR 935 88.250 145.018 55.787 1.00 0.00 C ATOM 37517 H1A PGR 935 89.036 145.658 56.198 1.00 0.00 H ATOM 37518 H1B PGR 935 87.294 145.358 56.192 1.00 0.00 H ATOM 37519 C32 PGR 935 88.291 144.929 54.188 1.00 0.00 C ATOM 37520 H2A PGR 935 88.068 143.902 53.887 1.00 0.00 H ATOM 37521 O35 PGR 935 89.595 145.354 53.607 1.00 0.00 O ATOM 37522 HO5A PGR 935 89.379 145.562 52.681 1.00 0.00 H ATOM 37523 C33 PGR 935 87.174 145.791 53.592 1.00 0.00 C ATOM 37524 H3A PGR 935 86.198 145.360 53.832 1.00 0.00 H ATOM 37525 H3B PGR 935 87.381 146.813 53.922 1.00 0.00 H ATOM 37526 O33 PGR 935 89.644 141.762 57.259 1.00 0.00 O ATOM 37527 O34 PGR 935 90.794 143.922 56.391 1.00 0.00 O ATOM 37528 O21 PGR 935 89.616 141.325 52.025 1.00 0.00 O ATOM 37529 C21 PGR 935 90.190 142.539 51.801 1.00 0.00 C ATOM 37530 O22 PGR 935 91.118 143.010 52.457 1.00 0.00 O ATOM 37531 O36 PGR 935 87.264 145.800 52.204 1.00 0.00 O ATOM 37532 HO6A PGR 935 86.977 146.675 51.886 1.00 0.00 H ATOM 37533 C12 OL 936 89.490 143.196 50.605 1.00 0.00 C ATOM 37534 H2R OL 936 89.693 142.654 49.679 1.00 0.00 H ATOM 37535 H2S OL 936 88.407 143.245 50.742 1.00 0.00 H ATOM 37536 C13 OL 936 89.990 144.607 50.323 1.00 0.00 C ATOM 37537 H3R OL 936 89.761 145.373 51.066 1.00 0.00 H ATOM 37538 H3S OL 936 91.082 144.622 50.311 1.00 0.00 H ATOM 37539 C14 OL 936 89.584 145.116 48.913 1.00 0.00 C ATOM 37540 H4R OL 936 89.771 144.341 48.167 1.00 0.00 H ATOM 37541 H4S OL 936 88.500 145.225 48.988 1.00 0.00 H ATOM 37542 C15 OL 936 90.174 146.507 48.502 1.00 0.00 C ATOM 37543 H5R OL 936 89.859 147.111 49.355 1.00 0.00 H ATOM 37544 H5S OL 936 91.259 146.521 48.622 1.00 0.00 H ATOM 37545 C16 OL 936 89.668 147.068 47.218 1.00 0.00 C ATOM 37546 H6R OL 936 88.599 146.887 47.091 1.00 0.00 H ATOM 37547 H6S OL 936 89.828 148.148 47.238 1.00 0.00 H ATOM 37548 C17 OL 936 90.370 146.539 45.958 1.00 0.00 C ATOM 37549 H7R OL 936 91.103 147.270 45.610 1.00 0.00 H ATOM 37550 H7S OL 936 91.050 145.709 46.158 1.00 0.00 H ATOM 37551 C18 OL 936 89.477 146.120 44.787 1.00 0.00 C ATOM 37552 H8R OL 936 88.776 145.398 45.210 1.00 0.00 H ATOM 37553 H8S OL 936 88.708 146.882 44.647 1.00 0.00 H ATOM 37554 C19 OL 936 90.244 145.528 43.620 1.00 0.00 C ATOM 37555 H9R OL 936 90.918 144.730 43.922 1.00 0.00 H ATOM 37556 C110 OL 936 90.261 146.068 42.413 1.00 0.00 C ATOM 37557 H10R OL 936 90.865 145.640 41.617 1.00 0.00 H ATOM 37558 C111 OL 936 89.547 147.312 42.002 1.00 0.00 C ATOM 37559 H11R OL 936 88.746 146.988 41.335 1.00 0.00 H ATOM 37560 H11S OL 936 89.091 147.836 42.845 1.00 0.00 H ATOM 37561 C112 OL 936 90.361 148.349 41.351 1.00 0.00 C ATOM 37562 H12R OL 936 91.169 148.583 42.046 1.00 0.00 H ATOM 37563 H12S OL 936 90.787 147.971 40.419 1.00 0.00 H ATOM 37564 C113 OL 936 89.555 149.682 41.095 1.00 0.00 C ATOM 37565 H13R OL 936 89.482 150.161 42.073 1.00 0.00 H ATOM 37566 H13S OL 936 90.215 150.338 40.523 1.00 0.00 H ATOM 37567 C114 OL 936 88.328 149.481 40.192 1.00 0.00 C ATOM 37568 H14R OL 936 88.559 149.040 39.220 1.00 0.00 H ATOM 37569 H14S OL 936 87.646 148.734 40.602 1.00 0.00 H ATOM 37570 C115 OL 936 87.399 150.716 40.116 1.00 0.00 C ATOM 37571 H15R OL 936 86.510 150.522 39.511 1.00 0.00 H ATOM 37572 H15S OL 936 87.077 151.097 41.087 1.00 0.00 H ATOM 37573 C116 OL 936 88.160 151.953 39.543 1.00 0.00 C ATOM 37574 H16R OL 936 89.057 152.233 40.099 1.00 0.00 H ATOM 37575 H16S OL 936 88.505 151.542 38.592 1.00 0.00 H ATOM 37576 C117 OL 936 87.244 153.158 39.153 1.00 0.00 C ATOM 37577 H17R OL 936 87.906 153.867 38.649 1.00 0.00 H ATOM 37578 H17S OL 936 86.617 152.879 38.304 1.00 0.00 H ATOM 37579 C118 OL 936 86.491 153.697 40.271 1.00 0.00 C ATOM 37580 H18R OL 936 85.691 153.000 40.527 1.00 0.00 H ATOM 37581 H18S OL 936 86.071 154.693 40.122 1.00 0.00 H ATOM 37582 H18T OL 936 87.206 153.668 41.096 1.00 0.00 H TER 37583 OL 936 ATOM 37583 C116 PA 937 4.682 21.869 38.987 1.00 0.00 C ATOM 37584 H16R PA 937 5.678 21.467 38.790 1.00 0.00 H ATOM 37585 H16S PA 937 4.718 22.388 39.947 1.00 0.00 H ATOM 37586 H16T PA 937 4.584 22.738 38.332 1.00 0.00 H ATOM 37587 C115 PA 937 3.553 20.836 38.746 1.00 0.00 C ATOM 37588 H15R PA 937 3.533 20.571 37.687 1.00 0.00 H ATOM 37589 H15S PA 937 2.541 21.229 38.868 1.00 0.00 H ATOM 37590 C114 PA 937 3.764 19.503 39.412 1.00 0.00 C ATOM 37591 H14R PA 937 4.682 19.058 39.024 1.00 0.00 H ATOM 37592 H14S PA 937 2.951 18.806 39.196 1.00 0.00 H ATOM 37593 C113 PA 937 3.868 19.497 40.971 1.00 0.00 C ATOM 37594 H13R PA 937 4.747 20.079 41.256 1.00 0.00 H ATOM 37595 H13S PA 937 4.132 18.506 41.344 1.00 0.00 H ATOM 37596 C112 PA 937 2.636 20.031 41.810 1.00 0.00 C ATOM 37597 H12R PA 937 2.410 21.094 41.712 1.00 0.00 H ATOM 37598 H12S PA 937 2.940 19.849 42.843 1.00 0.00 H ATOM 37599 C111 PA 937 1.396 19.088 41.584 1.00 0.00 C ATOM 37600 H11R PA 937 1.648 18.075 41.902 1.00 0.00 H ATOM 37601 H11S PA 937 1.132 19.079 40.524 1.00 0.00 H ATOM 37602 C110 PA 937 0.246 19.558 42.565 1.00 0.00 C ATOM 37603 H10R PA 937 -0.029 20.530 42.150 1.00 0.00 H ATOM 37604 H10S PA 937 0.690 19.766 43.540 1.00 0.00 H ATOM 37605 C19 PA 937 -0.965 18.604 42.712 1.00 0.00 C ATOM 37606 H9R PA 937 -0.624 17.566 42.729 1.00 0.00 H ATOM 37607 H9S PA 937 -1.436 18.608 41.727 1.00 0.00 H ATOM 37608 C18 PA 937 -2.024 18.829 43.735 1.00 0.00 C ATOM 37609 H8R PA 937 -2.794 18.055 43.766 1.00 0.00 H ATOM 37610 H8S PA 937 -2.627 19.686 43.427 1.00 0.00 H ATOM 37611 C17 PA 937 -1.390 19.072 45.155 1.00 0.00 C ATOM 37612 H7R PA 937 -0.740 19.948 45.208 1.00 0.00 H ATOM 37613 H7S PA 937 -0.898 18.157 45.492 1.00 0.00 H ATOM 37614 C16 PA 937 -2.502 19.399 46.204 1.00 0.00 C ATOM 37615 H6R PA 937 -3.039 18.513 46.549 1.00 0.00 H ATOM 37616 H6S PA 937 -3.189 20.126 45.767 1.00 0.00 H ATOM 37617 C15 PA 937 -2.032 20.128 47.442 1.00 0.00 C ATOM 37618 H5R PA 937 -1.792 21.172 47.230 1.00 0.00 H ATOM 37619 H5S PA 937 -1.119 19.688 47.848 1.00 0.00 H ATOM 37620 C14 PA 937 -3.114 20.100 48.465 1.00 0.00 C ATOM 37621 H4R PA 937 -3.124 19.185 49.061 1.00 0.00 H ATOM 37622 H4S PA 937 -4.108 20.324 48.072 1.00 0.00 H ATOM 37623 C13 PA 937 -2.914 21.146 49.539 1.00 0.00 C ATOM 37624 H3R PA 937 -3.423 21.986 49.062 1.00 0.00 H ATOM 37625 H3S PA 937 -1.856 21.411 49.588 1.00 0.00 H ATOM 37626 C12 PA 937 -3.594 20.834 50.821 1.00 0.00 C ATOM 37627 H2R PA 937 -3.001 20.089 51.356 1.00 0.00 H ATOM 37628 H2S PA 937 -4.562 20.385 50.585 1.00 0.00 H ATOM 37629 C11 PGR 938 -3.713 21.969 51.765 1.00 0.00 C ATOM 37630 O12 PGR 938 -4.441 21.908 52.720 1.00 0.00 O ATOM 37631 O11 PGR 938 -3.055 23.056 51.397 1.00 0.00 O ATOM 37632 C1 PGR 938 -3.281 24.302 52.166 1.00 0.00 C ATOM 37633 HR PGR 938 -4.327 24.473 52.433 1.00 0.00 H ATOM 37634 HS PGR 938 -2.942 25.151 51.566 1.00 0.00 H ATOM 37635 C2 PGR 938 -2.457 24.377 53.404 1.00 0.00 C ATOM 37636 HX PGR 938 -2.660 23.530 54.064 1.00 0.00 H ATOM 37637 C3 PGR 938 -2.741 25.647 54.251 1.00 0.00 C ATOM 37638 HA PGR 938 -3.829 25.694 54.348 1.00 0.00 H ATOM 37639 HB PGR 938 -2.285 26.495 53.734 1.00 0.00 H ATOM 37640 O31 PGR 938 -2.143 25.400 55.555 1.00 0.00 O ATOM 37641 P31 PGR 938 -2.457 26.326 56.723 1.00 0.00 P ATOM 37642 O32 PGR 938 -2.083 27.795 56.079 1.00 0.00 O ATOM 37643 C31 PGR 938 -0.826 28.437 56.293 1.00 0.00 C ATOM 37644 H1A PGR 938 -0.519 28.397 57.341 1.00 0.00 H ATOM 37645 H1B PGR 938 -0.918 29.500 56.055 1.00 0.00 H ATOM 37646 C32 PGR 938 0.224 27.960 55.215 1.00 0.00 C ATOM 37647 H2A PGR 938 -0.191 28.217 54.237 1.00 0.00 H ATOM 37648 O35 PGR 938 0.554 26.589 55.238 1.00 0.00 O ATOM 37649 HO5A PGR 938 -0.323 26.184 55.116 1.00 0.00 H ATOM 37650 C33 PGR 938 1.547 28.685 55.421 1.00 0.00 C ATOM 37651 H3A PGR 938 2.082 28.335 54.534 1.00 0.00 H ATOM 37652 H3B PGR 938 1.432 29.772 55.392 1.00 0.00 H ATOM 37653 O33 PGR 938 -3.915 26.255 56.989 1.00 0.00 O ATOM 37654 O34 PGR 938 -1.481 25.931 57.758 1.00 0.00 O ATOM 37655 O21 PGR 938 -1.076 24.495 53.003 1.00 0.00 O ATOM 37656 C21 PGR 938 -0.327 23.350 52.861 1.00 0.00 C ATOM 37657 O22 PGR 938 -0.768 22.244 53.152 1.00 0.00 O ATOM 37658 O36 PGR 938 2.232 28.300 56.580 1.00 0.00 O ATOM 37659 HO6A PGR 938 1.863 28.694 57.390 1.00 0.00 H ATOM 37660 C12 OL 939 1.011 23.594 52.258 1.00 0.00 C ATOM 37661 H2R OL 939 0.713 24.141 51.361 1.00 0.00 H ATOM 37662 H2S OL 939 1.624 24.230 52.901 1.00 0.00 H ATOM 37663 C13 OL 939 1.854 22.336 51.983 1.00 0.00 C ATOM 37664 H3R OL 939 2.881 22.543 51.677 1.00 0.00 H ATOM 37665 H3S OL 939 2.006 21.888 52.968 1.00 0.00 H ATOM 37666 C14 OL 939 1.191 21.387 50.968 1.00 0.00 C ATOM 37667 H4R OL 939 0.099 21.363 50.956 1.00 0.00 H ATOM 37668 H4S OL 939 1.274 21.790 49.957 1.00 0.00 H ATOM 37669 C15 OL 939 1.709 19.983 51.134 1.00 0.00 C ATOM 37670 H5R OL 939 2.757 19.964 50.828 1.00 0.00 H ATOM 37671 H5S OL 939 1.841 19.732 52.189 1.00 0.00 H ATOM 37672 C16 OL 939 1.135 18.862 50.303 1.00 0.00 C ATOM 37673 H6R OL 939 1.304 17.893 50.777 1.00 0.00 H ATOM 37674 H6S OL 939 0.044 18.914 50.337 1.00 0.00 H ATOM 37675 C17 OL 939 1.446 18.827 48.845 1.00 0.00 C ATOM 37676 H7R OL 939 0.781 18.136 48.322 1.00 0.00 H ATOM 37677 H7S OL 939 1.233 19.763 48.324 1.00 0.00 H ATOM 37678 C18 OL 939 2.924 18.448 48.506 1.00 0.00 C ATOM 37679 H8R OL 939 3.508 19.043 49.212 1.00 0.00 H ATOM 37680 H8S OL 939 3.181 17.407 48.711 1.00 0.00 H ATOM 37681 C19 OL 939 3.276 18.822 47.100 1.00 0.00 C ATOM 37682 H9R OL 939 3.167 19.885 46.902 1.00 0.00 H ATOM 37683 C110 OL 939 3.792 18.000 46.099 1.00 0.00 C ATOM 37684 H10R OL 939 4.200 18.524 45.239 1.00 0.00 H ATOM 37685 C111 OL 939 3.990 16.519 46.122 1.00 0.00 C ATOM 37686 H11R OL 939 4.957 16.272 45.678 1.00 0.00 H ATOM 37687 H11S OL 939 4.151 16.176 47.146 1.00 0.00 H ATOM 37688 C112 OL 939 2.863 15.816 45.412 1.00 0.00 C ATOM 37689 H12R OL 939 3.119 14.755 45.447 1.00 0.00 H ATOM 37690 H12S OL 939 1.900 15.907 45.919 1.00 0.00 H ATOM 37691 C113 OL 939 2.639 16.313 43.998 1.00 0.00 C ATOM 37692 H13R OL 939 2.247 17.329 44.073 1.00 0.00 H ATOM 37693 H13S OL 939 3.607 16.295 43.492 1.00 0.00 H ATOM 37694 C114 OL 939 1.562 15.478 43.350 1.00 0.00 C ATOM 37695 H14R OL 939 0.650 15.543 43.948 1.00 0.00 H ATOM 37696 H14S OL 939 1.265 16.009 42.443 1.00 0.00 H ATOM 37697 C115 OL 939 1.934 14.043 42.977 1.00 0.00 C ATOM 37698 H15R OL 939 2.424 13.449 43.752 1.00 0.00 H ATOM 37699 H15S OL 939 1.059 13.409 42.816 1.00 0.00 H ATOM 37700 C116 OL 939 2.806 13.933 41.723 1.00 0.00 C ATOM 37701 H16R OL 939 3.762 14.440 41.867 1.00 0.00 H ATOM 37702 H16S OL 939 2.997 12.881 41.501 1.00 0.00 H ATOM 37703 C117 OL 939 2.264 14.523 40.426 1.00 0.00 C ATOM 37704 H17R OL 939 1.292 14.053 40.258 1.00 0.00 H ATOM 37705 H17S OL 939 2.131 15.605 40.368 1.00 0.00 H ATOM 37706 C118 OL 939 3.109 14.103 39.217 1.00 0.00 C ATOM 37707 H18R OL 939 3.297 13.028 39.183 1.00 0.00 H ATOM 37708 H18S OL 939 4.058 14.626 39.081 1.00 0.00 H ATOM 37709 H18T OL 939 2.421 14.243 38.381 1.00 0.00 H TER 37710 OL 939 ATOM 37710 C116 PA 940 28.644 116.983 36.898 1.00 0.00 C ATOM 37711 H16R PA 940 28.204 116.128 36.381 1.00 0.00 H ATOM 37712 H16S PA 940 29.072 116.419 37.728 1.00 0.00 H ATOM 37713 H16T PA 940 29.434 117.251 36.193 1.00 0.00 H ATOM 37714 C115 PA 940 27.845 118.183 37.285 1.00 0.00 C ATOM 37715 H15R PA 940 27.131 117.882 38.054 1.00 0.00 H ATOM 37716 H15S PA 940 27.141 118.427 36.487 1.00 0.00 H ATOM 37717 C114 PA 940 28.585 119.424 37.818 1.00 0.00 C ATOM 37718 H14R PA 940 28.133 120.410 37.694 1.00 0.00 H ATOM 37719 H14S PA 940 29.524 119.467 37.263 1.00 0.00 H ATOM 37720 C113 PA 940 28.883 119.641 39.300 1.00 0.00 C ATOM 37721 H13R PA 940 28.017 119.955 39.888 1.00 0.00 H ATOM 37722 H13S PA 940 29.567 120.490 39.362 1.00 0.00 H ATOM 37723 C112 PA 940 29.474 118.407 39.912 1.00 0.00 C ATOM 37724 H12R PA 940 30.439 118.168 39.461 1.00 0.00 H ATOM 37725 H12S PA 940 28.744 117.613 39.740 1.00 0.00 H ATOM 37726 C111 PA 940 29.670 118.510 41.430 1.00 0.00 C ATOM 37727 H11R PA 940 28.784 118.854 41.968 1.00 0.00 H ATOM 37728 H11S PA 940 30.424 119.267 41.654 1.00 0.00 H ATOM 37729 C110 PA 940 30.086 117.263 42.112 1.00 0.00 C ATOM 37730 H10R PA 940 30.923 116.860 41.537 1.00 0.00 H ATOM 37731 H10S PA 940 29.257 116.552 42.119 1.00 0.00 H ATOM 37732 C19 PA 940 30.677 117.490 43.530 1.00 0.00 C ATOM 37733 H9R PA 940 30.854 118.563 43.636 1.00 0.00 H ATOM 37734 H9S PA 940 31.643 117.027 43.740 1.00 0.00 H ATOM 37735 C18 PA 940 29.568 117.277 44.551 1.00 0.00 C ATOM 37736 H8R PA 940 29.294 116.222 44.481 1.00 0.00 H ATOM 37737 H8S PA 940 28.632 117.789 44.320 1.00 0.00 H ATOM 37738 C17 PA 940 30.144 117.543 45.931 1.00 0.00 C ATOM 37739 H7R PA 940 30.601 118.533 45.871 1.00 0.00 H ATOM 37740 H7S PA 940 30.987 116.885 46.150 1.00 0.00 H ATOM 37741 C16 PA 940 29.120 117.347 47.056 1.00 0.00 C ATOM 37742 H6R PA 940 28.815 116.299 47.073 1.00 0.00 H ATOM 37743 H6S PA 940 28.244 117.926 46.754 1.00 0.00 H ATOM 37744 C15 PA 940 29.651 117.750 48.364 1.00 0.00 C ATOM 37745 H5R PA 940 29.922 118.779 48.122 1.00 0.00 H ATOM 37746 H5S PA 940 30.610 117.288 48.610 1.00 0.00 H ATOM 37747 C14 PA 940 28.603 117.791 49.486 1.00 0.00 C ATOM 37748 H4R PA 940 28.343 116.761 49.740 1.00 0.00 H ATOM 37749 H4S PA 940 27.649 118.175 49.116 1.00 0.00 H ATOM 37750 C13 PA 940 28.817 118.656 50.730 1.00 0.00 C ATOM 37751 H3R PA 940 29.650 118.306 51.343 1.00 0.00 H ATOM 37752 H3S PA 940 27.966 118.639 51.414 1.00 0.00 H ATOM 37753 C12 PA 940 29.016 120.085 50.322 1.00 0.00 C ATOM 37754 H2R PA 940 28.136 120.389 49.752 1.00 0.00 H ATOM 37755 H2S PA 940 29.969 120.200 49.801 1.00 0.00 H ATOM 37756 C11 PGR 941 29.044 120.990 51.468 1.00 0.00 C ATOM 37757 O12 PGR 941 30.045 121.614 51.759 1.00 0.00 O ATOM 37758 O11 PGR 941 27.845 121.161 52.065 1.00 0.00 O ATOM 37759 C1 PGR 941 27.828 121.977 53.285 1.00 0.00 C ATOM 37760 HR PGR 941 28.600 121.586 53.953 1.00 0.00 H ATOM 37761 HS PGR 941 26.869 121.874 53.799 1.00 0.00 H ATOM 37762 C2 PGR 941 28.069 123.513 53.130 1.00 0.00 C ATOM 37763 HX PGR 941 28.705 123.753 52.275 1.00 0.00 H ATOM 37764 C3 PGR 941 28.641 124.105 54.447 1.00 0.00 C ATOM 37765 HA PGR 941 28.512 125.189 54.502 1.00 0.00 H ATOM 37766 HB PGR 941 29.671 123.753 54.547 1.00 0.00 H ATOM 37767 O31 PGR 941 27.907 123.688 55.551 1.00 0.00 O ATOM 37768 P31 PGR 941 28.312 124.085 57.038 1.00 0.00 P ATOM 37769 O32 PGR 941 29.556 123.148 57.303 1.00 0.00 O ATOM 37770 C31 PGR 941 29.414 121.755 57.472 1.00 0.00 C ATOM 37771 H1A PGR 941 28.856 121.287 56.656 1.00 0.00 H ATOM 37772 H1B PGR 941 28.870 121.457 58.372 1.00 0.00 H ATOM 37773 C32 PGR 941 30.798 121.022 57.499 1.00 0.00 C ATOM 37774 H2A PGR 941 30.713 119.935 57.572 1.00 0.00 H ATOM 37775 O35 PGR 941 31.479 121.387 58.786 1.00 0.00 O ATOM 37776 HO5A PGR 941 30.938 120.856 59.398 1.00 0.00 H ATOM 37777 C33 PGR 941 31.635 121.379 56.192 1.00 0.00 C ATOM 37778 H3A PGR 941 31.168 121.027 55.268 1.00 0.00 H ATOM 37779 H3B PGR 941 31.690 122.462 56.056 1.00 0.00 H ATOM 37780 O33 PGR 941 28.779 125.525 57.081 1.00 0.00 O ATOM 37781 O34 PGR 941 27.271 123.767 57.931 1.00 0.00 O ATOM 37782 O21 PGR 941 26.740 124.098 52.923 1.00 0.00 O ATOM 37783 C21 PGR 941 26.389 124.095 51.657 1.00 0.00 C ATOM 37784 O22 PGR 941 27.156 124.223 50.740 1.00 0.00 O ATOM 37785 O36 PGR 941 32.925 120.802 56.184 1.00 0.00 O ATOM 37786 HO6A PGR 941 32.797 119.838 56.133 1.00 0.00 H ATOM 37787 C12 OL 942 24.906 124.160 51.438 1.00 0.00 C ATOM 37788 H2R OL 942 24.644 125.187 51.700 1.00 0.00 H ATOM 37789 H2S OL 942 24.632 124.247 50.384 1.00 0.00 H ATOM 37790 C13 OL 942 24.115 123.096 52.238 1.00 0.00 C ATOM 37791 H3R OL 942 24.257 123.031 53.318 1.00 0.00 H ATOM 37792 H3S OL 942 23.052 123.189 52.008 1.00 0.00 H ATOM 37793 C14 OL 942 24.311 121.683 51.755 1.00 0.00 C ATOM 37794 H4R OL 942 25.385 121.487 51.790 1.00 0.00 H ATOM 37795 H4S OL 942 24.026 121.122 52.648 1.00 0.00 H ATOM 37796 C15 OL 942 23.714 121.223 50.423 1.00 0.00 C ATOM 37797 H5R OL 942 22.640 121.139 50.604 1.00 0.00 H ATOM 37798 H5S OL 942 23.806 121.912 49.581 1.00 0.00 H ATOM 37799 C16 OL 942 24.155 119.823 50.001 1.00 0.00 C ATOM 37800 H6R OL 942 25.244 119.865 49.931 1.00 0.00 H ATOM 37801 H6S OL 942 23.855 119.174 50.826 1.00 0.00 H ATOM 37802 C17 OL 942 23.789 119.335 48.675 1.00 0.00 C ATOM 37803 H7R OL 942 22.714 119.490 48.560 1.00 0.00 H ATOM 37804 H7S OL 942 24.256 120.029 47.973 1.00 0.00 H ATOM 37805 C18 OL 942 24.027 117.844 48.487 1.00 0.00 C ATOM 37806 H8R OL 942 25.086 117.686 48.271 1.00 0.00 H ATOM 37807 H8S OL 942 23.833 117.221 49.363 1.00 0.00 H ATOM 37808 C19 OL 942 23.367 117.300 47.220 1.00 0.00 C ATOM 37809 H9R OL 942 22.477 116.693 47.369 1.00 0.00 H ATOM 37810 C110 OL 942 23.968 117.278 45.988 1.00 0.00 C ATOM 37811 H10R OL 942 23.576 116.727 45.137 1.00 0.00 H ATOM 37812 C111 OL 942 25.229 117.951 45.627 1.00 0.00 C ATOM 37813 H11R OL 942 25.684 118.553 46.416 1.00 0.00 H ATOM 37814 H11S OL 942 25.929 117.140 45.416 1.00 0.00 H ATOM 37815 C112 OL 942 25.251 118.538 44.152 1.00 0.00 C ATOM 37816 H12R OL 942 26.223 118.990 43.942 1.00 0.00 H ATOM 37817 H12S OL 942 25.028 117.691 43.501 1.00 0.00 H ATOM 37818 C113 OL 942 24.210 119.538 43.812 1.00 0.00 C ATOM 37819 H13R OL 942 24.488 119.961 42.844 1.00 0.00 H ATOM 37820 H13S OL 942 23.341 118.924 43.566 1.00 0.00 H ATOM 37821 C114 OL 942 23.985 120.747 44.747 1.00 0.00 C ATOM 37822 H14R OL 942 23.130 121.199 44.242 1.00 0.00 H ATOM 37823 H14S OL 942 23.541 120.284 45.631 1.00 0.00 H ATOM 37824 C115 OL 942 25.187 121.542 45.148 1.00 0.00 C ATOM 37825 H15R OL 942 25.920 120.831 45.534 1.00 0.00 H ATOM 37826 H15S OL 942 25.712 122.023 44.320 1.00 0.00 H ATOM 37827 C116 OL 942 24.915 122.692 46.145 1.00 0.00 C ATOM 37828 H16R OL 942 24.174 123.353 45.691 1.00 0.00 H ATOM 37829 H16S OL 942 24.726 122.261 47.131 1.00 0.00 H ATOM 37830 C117 OL 942 26.095 123.814 46.236 1.00 0.00 C ATOM 37831 H17R OL 942 26.346 124.080 45.207 1.00 0.00 H ATOM 37832 H17S OL 942 25.847 124.780 46.682 1.00 0.00 H ATOM 37833 C118 OL 942 27.442 123.348 47.069 1.00 0.00 C ATOM 37834 H18R OL 942 27.686 122.297 46.903 1.00 0.00 H ATOM 37835 H18S OL 942 27.280 123.447 48.145 1.00 0.00 H ATOM 37836 H18T OL 942 28.341 123.934 46.868 1.00 0.00 H TER 37837 OL 942 ATOM 37837 C116 PA 943 13.321 111.968 45.793 1.00 0.00 C ATOM 37838 H16R PA 943 12.459 112.638 45.771 1.00 0.00 H ATOM 37839 H16S PA 943 14.118 112.532 45.304 1.00 0.00 H ATOM 37840 H16T PA 943 13.620 111.788 46.828 1.00 0.00 H ATOM 37841 C115 PA 943 13.162 110.677 44.996 1.00 0.00 C ATOM 37842 H15R PA 943 13.009 110.960 43.952 1.00 0.00 H ATOM 37843 H15S PA 943 12.179 110.268 45.238 1.00 0.00 H ATOM 37844 C114 PA 943 14.169 109.615 45.195 1.00 0.00 C ATOM 37845 H14R PA 943 14.209 109.283 46.234 1.00 0.00 H ATOM 37846 H14S PA 943 15.187 109.983 45.051 1.00 0.00 H ATOM 37847 C113 PA 943 13.926 108.448 44.139 1.00 0.00 C ATOM 37848 H13R PA 943 14.195 108.877 43.171 1.00 0.00 H ATOM 37849 H13S PA 943 12.852 108.251 44.145 1.00 0.00 H ATOM 37850 C112 PA 943 14.756 107.173 44.590 1.00 0.00 C ATOM 37851 H12R PA 943 15.628 107.630 45.063 1.00 0.00 H ATOM 37852 H12S PA 943 14.925 106.501 43.747 1.00 0.00 H ATOM 37853 C111 PA 943 13.900 106.402 45.614 1.00 0.00 C ATOM 37854 H11R PA 943 12.973 106.027 45.176 1.00 0.00 H ATOM 37855 H11S PA 943 13.606 107.086 46.413 1.00 0.00 H ATOM 37856 C110 PA 943 14.693 105.315 46.395 1.00 0.00 C ATOM 37857 H10R PA 943 15.705 105.657 46.624 1.00 0.00 H ATOM 37858 H10S PA 943 14.796 104.541 45.631 1.00 0.00 H ATOM 37859 C19 PA 943 14.034 104.718 47.673 1.00 0.00 C ATOM 37860 H9R PA 943 13.070 104.285 47.398 1.00 0.00 H ATOM 37861 H9S PA 943 13.814 105.508 48.395 1.00 0.00 H ATOM 37862 C18 PA 943 14.872 103.655 48.518 1.00 0.00 C ATOM 37863 H8R PA 943 15.719 104.240 48.884 1.00 0.00 H ATOM 37864 H8S PA 943 15.207 102.878 47.829 1.00 0.00 H ATOM 37865 C17 PA 943 14.172 103.027 49.700 1.00 0.00 C ATOM 37866 H7R PA 943 13.273 102.458 49.454 1.00 0.00 H ATOM 37867 H7S PA 943 13.797 103.814 50.357 1.00 0.00 H ATOM 37868 C16 PA 943 15.021 102.075 50.480 1.00 0.00 C ATOM 37869 H6R PA 943 16.026 101.986 50.063 1.00 0.00 H ATOM 37870 H6S PA 943 14.619 101.069 50.344 1.00 0.00 H ATOM 37871 C15 PA 943 14.963 102.309 51.937 1.00 0.00 C ATOM 37872 H5R PA 943 13.954 102.166 52.328 1.00 0.00 H ATOM 37873 H5S PA 943 15.151 103.336 52.258 1.00 0.00 H ATOM 37874 C14 PA 943 16.166 101.487 52.525 1.00 0.00 C ATOM 37875 H4R PA 943 17.069 101.563 51.916 1.00 0.00 H ATOM 37876 H4S PA 943 15.913 100.428 52.440 1.00 0.00 H ATOM 37877 C13 PA 943 16.444 101.824 53.951 1.00 0.00 C ATOM 37878 H3R PA 943 15.648 101.989 54.681 1.00 0.00 H ATOM 37879 H3S PA 943 17.020 102.751 53.898 1.00 0.00 H ATOM 37880 C12 PA 943 17.371 100.818 54.621 1.00 0.00 C ATOM 37881 H2R PA 943 18.277 100.712 54.022 1.00 0.00 H ATOM 37882 H2S PA 943 16.948 99.811 54.601 1.00 0.00 H ATOM 37883 C11 PGR 944 17.647 101.168 56.064 1.00 0.00 C ATOM 37884 O12 PGR 944 16.822 101.713 56.784 1.00 0.00 O ATOM 37885 O11 PGR 944 18.856 100.696 56.431 1.00 0.00 O ATOM 37886 C1 PGR 944 19.155 100.588 57.814 1.00 0.00 C ATOM 37887 HR PGR 944 18.377 100.036 58.347 1.00 0.00 H ATOM 37888 HS PGR 944 19.221 101.578 58.272 1.00 0.00 H ATOM 37889 C2 PGR 944 20.522 99.841 57.915 1.00 0.00 C ATOM 37890 HX PGR 944 20.621 98.900 57.368 1.00 0.00 H ATOM 37891 C3 PGR 944 20.867 99.668 59.400 1.00 0.00 C ATOM 37892 HA PGR 944 21.704 99.002 59.620 1.00 0.00 H ATOM 37893 HB PGR 944 19.961 99.191 59.783 1.00 0.00 H ATOM 37894 O31 PGR 944 20.938 100.956 60.091 1.00 0.00 O ATOM 37895 P31 PGR 944 20.676 100.912 61.673 1.00 0.00 P ATOM 37896 O32 PGR 944 19.127 100.835 61.859 1.00 0.00 O ATOM 37897 C31 PGR 944 18.341 101.932 61.430 1.00 0.00 C ATOM 37898 H1A PGR 944 18.683 102.278 60.451 1.00 0.00 H ATOM 37899 H1B PGR 944 18.385 102.743 62.161 1.00 0.00 H ATOM 37900 C32 PGR 944 16.887 101.629 61.272 1.00 0.00 C ATOM 37901 H2A PGR 944 16.439 101.293 62.211 1.00 0.00 H ATOM 37902 O35 PGR 944 16.695 100.687 60.139 1.00 0.00 O ATOM 37903 HO5A PGR 944 17.137 99.886 60.472 1.00 0.00 H ATOM 37904 C33 PGR 944 15.992 102.865 60.855 1.00 0.00 C ATOM 37905 H3A PGR 944 14.933 102.636 60.993 1.00 0.00 H ATOM 37906 H3B PGR 944 16.292 103.683 61.515 1.00 0.00 H ATOM 37907 O33 PGR 944 21.341 99.684 62.208 1.00 0.00 O ATOM 37908 O34 PGR 944 21.089 102.231 62.229 1.00 0.00 O ATOM 37909 O21 PGR 944 21.543 100.661 57.242 1.00 0.00 O ATOM 37910 C21 PGR 944 22.764 100.202 57.262 1.00 0.00 C ATOM 37911 O22 PGR 944 23.224 99.294 57.941 1.00 0.00 O ATOM 37912 O36 PGR 944 16.355 103.231 59.473 1.00 0.00 O ATOM 37913 HO6A PGR 944 16.061 104.150 59.345 1.00 0.00 H ATOM 37914 C12 OL 945 23.673 101.089 56.416 1.00 0.00 C ATOM 37915 H2R OL 945 23.972 101.991 56.954 1.00 0.00 H ATOM 37916 H2S OL 945 24.588 100.508 56.276 1.00 0.00 H ATOM 37917 C13 OL 945 23.122 101.494 55.036 1.00 0.00 C ATOM 37918 H3R OL 945 22.107 101.822 55.270 1.00 0.00 H ATOM 37919 H3S OL 945 23.572 102.437 54.719 1.00 0.00 H ATOM 37920 C14 OL 945 23.203 100.405 53.900 1.00 0.00 C ATOM 37921 H4R OL 945 24.228 100.066 53.739 1.00 0.00 H ATOM 37922 H4S OL 945 22.512 99.634 54.249 1.00 0.00 H ATOM 37923 C15 OL 945 22.774 100.749 52.525 1.00 0.00 C ATOM 37924 H5R OL 945 21.733 101.079 52.531 1.00 0.00 H ATOM 37925 H5S OL 945 23.395 101.609 52.265 1.00 0.00 H ATOM 37926 C16 OL 945 22.808 99.643 51.549 1.00 0.00 C ATOM 37927 H6R OL 945 22.063 98.931 51.907 1.00 0.00 H ATOM 37928 H6S OL 945 22.643 99.985 50.525 1.00 0.00 H ATOM 37929 C17 OL 945 24.131 98.948 51.537 1.00 0.00 C ATOM 37930 H7R OL 945 24.881 99.703 51.782 1.00 0.00 H ATOM 37931 H7S OL 945 24.178 98.100 52.224 1.00 0.00 H ATOM 37932 C18 OL 945 24.679 98.468 50.242 1.00 0.00 C ATOM 37933 H8R OL 945 24.708 99.282 49.515 1.00 0.00 H ATOM 37934 H8S OL 945 25.758 98.321 50.314 1.00 0.00 H ATOM 37935 C19 OL 945 24.021 97.244 49.808 1.00 0.00 C ATOM 37936 H9R OL 945 24.378 96.274 50.146 1.00 0.00 H ATOM 37937 C110 OL 945 23.053 97.188 48.847 1.00 0.00 C ATOM 37938 H10R OL 945 22.680 96.229 48.497 1.00 0.00 H ATOM 37939 C111 OL 945 22.396 98.258 48.073 1.00 0.00 C ATOM 37940 H11R OL 945 21.557 98.645 48.656 1.00 0.00 H ATOM 37941 H11S OL 945 23.138 99.046 47.933 1.00 0.00 H ATOM 37942 C112 OL 945 21.843 97.868 46.691 1.00 0.00 C ATOM 37943 H12R OL 945 21.339 96.899 46.696 1.00 0.00 H ATOM 37944 H12S OL 945 21.054 98.611 46.553 1.00 0.00 H ATOM 37945 C113 OL 945 22.936 97.902 45.674 1.00 0.00 C ATOM 37946 H13R OL 945 23.417 98.882 45.681 1.00 0.00 H ATOM 37947 H13S OL 945 23.608 97.055 45.831 1.00 0.00 H ATOM 37948 C114 OL 945 22.454 97.617 44.207 1.00 0.00 C ATOM 37949 H14R OL 945 22.215 96.556 44.107 1.00 0.00 H ATOM 37950 H14S OL 945 21.480 98.048 43.969 1.00 0.00 H ATOM 37951 C115 OL 945 23.560 97.980 43.193 1.00 0.00 C ATOM 37952 H15R OL 945 23.865 99.024 43.296 1.00 0.00 H ATOM 37953 H15S OL 945 24.544 97.548 43.389 1.00 0.00 H ATOM 37954 C116 OL 945 23.084 97.662 41.806 1.00 0.00 C ATOM 37955 H16R OL 945 22.869 96.593 41.741 1.00 0.00 H ATOM 37956 H16S OL 945 22.164 98.242 41.712 1.00 0.00 H ATOM 37957 C117 OL 945 24.144 98.110 40.798 1.00 0.00 C ATOM 37958 H17R OL 945 24.428 99.155 40.937 1.00 0.00 H ATOM 37959 H17S OL 945 25.088 97.560 40.799 1.00 0.00 H ATOM 37960 C118 OL 945 23.571 97.793 39.449 1.00 0.00 C ATOM 37961 H18R OL 945 22.628 98.268 39.171 1.00 0.00 H ATOM 37962 H18S OL 945 23.407 96.714 39.472 1.00 0.00 H ATOM 37963 H18T OL 945 24.333 97.968 38.688 1.00 0.00 H TER 37964 OL 945 ATOM 37964 C116 PA 946 8.839 81.849 51.602 1.00 0.00 C ATOM 37965 H16R PA 946 9.755 81.434 52.027 1.00 0.00 H ATOM 37966 H16S PA 946 8.399 80.986 51.097 1.00 0.00 H ATOM 37967 H16T PA 946 8.166 82.160 52.404 1.00 0.00 H ATOM 37968 C115 PA 946 9.052 83.014 50.576 1.00 0.00 C ATOM 37969 H15R PA 946 9.336 82.648 49.587 1.00 0.00 H ATOM 37970 H15S PA 946 10.002 83.474 50.854 1.00 0.00 H ATOM 37971 C114 PA 946 7.835 83.915 50.394 1.00 0.00 C ATOM 37972 H14R PA 946 7.673 84.506 51.297 1.00 0.00 H ATOM 37973 H14S PA 946 6.907 83.358 50.253 1.00 0.00 H ATOM 37974 C113 PA 946 8.169 84.845 49.177 1.00 0.00 C ATOM 37975 H13R PA 946 8.417 84.402 48.211 1.00 0.00 H ATOM 37976 H13S PA 946 9.021 85.467 49.460 1.00 0.00 H ATOM 37977 C112 PA 946 7.084 85.874 48.798 1.00 0.00 C ATOM 37978 H12R PA 946 6.115 85.377 48.716 1.00 0.00 H ATOM 37979 H12S PA 946 7.296 86.317 47.822 1.00 0.00 H ATOM 37980 C111 PA 946 6.951 86.819 49.953 1.00 0.00 C ATOM 37981 H11R PA 946 7.955 87.091 50.288 1.00 0.00 H ATOM 37982 H11S PA 946 6.427 86.276 50.742 1.00 0.00 H ATOM 37983 C110 PA 946 6.048 88.080 49.616 1.00 0.00 C ATOM 37984 H10R PA 946 5.223 87.684 49.020 1.00 0.00 H ATOM 37985 H10S PA 946 6.449 88.872 48.982 1.00 0.00 H ATOM 37986 C19 PA 946 5.564 88.795 50.910 1.00 0.00 C ATOM 37987 H9R PA 946 6.450 89.127 51.455 1.00 0.00 H ATOM 37988 H9S PA 946 4.987 88.164 51.590 1.00 0.00 H ATOM 37989 C18 PA 946 4.715 90.044 50.506 1.00 0.00 C ATOM 37990 H8R PA 946 3.776 89.773 50.018 1.00 0.00 H ATOM 37991 H8S PA 946 5.265 90.679 49.808 1.00 0.00 H ATOM 37992 C17 PA 946 4.289 90.747 51.786 1.00 0.00 C ATOM 37993 H7R PA 946 4.044 90.030 52.573 1.00 0.00 H ATOM 37994 H7S PA 946 3.322 91.162 51.493 1.00 0.00 H ATOM 37995 C16 PA 946 5.163 91.890 52.321 1.00 0.00 C ATOM 37996 H6R PA 946 5.393 92.601 51.525 1.00 0.00 H ATOM 37997 H6S PA 946 6.110 91.416 52.588 1.00 0.00 H ATOM 37998 C15 PA 946 4.705 92.426 53.599 1.00 0.00 C ATOM 37999 H5R PA 946 5.388 93.243 53.838 1.00 0.00 H ATOM 38000 H5S PA 946 4.967 91.804 54.458 1.00 0.00 H ATOM 38001 C14 PA 946 3.272 92.993 53.591 1.00 0.00 C ATOM 38002 H4R PA 946 2.575 92.154 53.632 1.00 0.00 H ATOM 38003 H4S PA 946 3.127 93.331 52.563 1.00 0.00 H ATOM 38004 C13 PA 946 2.998 94.094 54.563 1.00 0.00 C ATOM 38005 H3R PA 946 3.611 94.980 54.385 1.00 0.00 H ATOM 38006 H3S PA 946 3.364 93.818 55.554 1.00 0.00 H ATOM 38007 C12 PA 946 1.578 94.475 54.619 1.00 0.00 C ATOM 38008 H2R PA 946 0.962 93.678 55.042 1.00 0.00 H ATOM 38009 H2S PA 946 1.317 94.650 53.573 1.00 0.00 H ATOM 38010 C11 PGR 947 1.498 95.749 55.440 1.00 0.00 C ATOM 38011 O12 PGR 947 1.499 95.807 56.675 1.00 0.00 O ATOM 38012 O11 PGR 947 1.482 96.847 54.714 1.00 0.00 O ATOM 38013 C1 PGR 947 1.775 98.167 55.340 1.00 0.00 C ATOM 38014 HR PGR 947 1.351 98.222 56.345 1.00 0.00 H ATOM 38015 HS PGR 947 1.411 99.014 54.752 1.00 0.00 H ATOM 38016 C2 PGR 947 3.324 98.333 55.497 1.00 0.00 C ATOM 38017 HX PGR 947 3.678 97.302 55.583 1.00 0.00 H ATOM 38018 C3 PGR 947 3.699 99.095 56.812 1.00 0.00 C ATOM 38019 HA PGR 947 4.762 99.203 57.042 1.00 0.00 H ATOM 38020 HB PGR 947 3.260 98.516 57.629 1.00 0.00 H ATOM 38021 O31 PGR 947 3.178 100.425 56.645 1.00 0.00 O ATOM 38022 P31 PGR 947 3.356 101.585 57.636 1.00 0.00 P ATOM 38023 O32 PGR 947 2.481 101.103 58.853 1.00 0.00 O ATOM 38024 C31 PGR 947 1.029 100.976 58.781 1.00 0.00 C ATOM 38025 H1A PGR 947 0.787 100.247 58.004 1.00 0.00 H ATOM 38026 H1B PGR 947 0.651 101.974 58.544 1.00 0.00 H ATOM 38027 C32 PGR 947 0.414 100.540 60.187 1.00 0.00 C ATOM 38028 H2A PGR 947 -0.667 100.672 60.277 1.00 0.00 H ATOM 38029 O35 PGR 947 1.138 101.377 61.176 1.00 0.00 O ATOM 38030 HO5A PGR 947 0.570 102.157 61.311 1.00 0.00 H ATOM 38031 C33 PGR 947 0.787 99.077 60.528 1.00 0.00 C ATOM 38032 H3A PGR 947 0.410 98.973 61.549 1.00 0.00 H ATOM 38033 H3B PGR 947 0.330 98.338 59.865 1.00 0.00 H ATOM 38034 O33 PGR 947 4.769 101.564 58.042 1.00 0.00 O ATOM 38035 O34 PGR 947 2.795 102.885 57.082 1.00 0.00 O ATOM 38036 O21 PGR 947 3.871 99.013 54.280 1.00 0.00 O ATOM 38037 C21 PGR 947 5.211 98.997 54.024 1.00 0.00 C ATOM 38038 O22 PGR 947 5.993 98.372 54.727 1.00 0.00 O ATOM 38039 O36 PGR 947 2.240 98.806 60.593 1.00 0.00 O ATOM 38040 HO6A PGR 947 2.662 99.601 60.220 1.00 0.00 H ATOM 38041 C12 OL 948 5.535 99.818 52.753 1.00 0.00 C ATOM 38042 H2R OL 948 4.631 100.248 52.316 1.00 0.00 H ATOM 38043 H2S OL 948 5.978 100.758 53.090 1.00 0.00 H ATOM 38044 C13 OL 948 6.231 98.868 51.763 1.00 0.00 C ATOM 38045 H3R OL 948 6.791 99.532 51.102 1.00 0.00 H ATOM 38046 H3S OL 948 6.885 98.111 52.201 1.00 0.00 H ATOM 38047 C14 OL 948 5.238 97.987 50.963 1.00 0.00 C ATOM 38048 H4R OL 948 4.693 97.438 51.734 1.00 0.00 H ATOM 38049 H4S OL 948 4.540 98.731 50.574 1.00 0.00 H ATOM 38050 C15 OL 948 5.794 97.225 49.867 1.00 0.00 C ATOM 38051 H5R OL 948 6.334 97.928 49.230 1.00 0.00 H ATOM 38052 H5S OL 948 6.595 96.629 50.310 1.00 0.00 H ATOM 38053 C16 OL 948 4.890 96.303 49.158 1.00 0.00 C ATOM 38054 H6R OL 948 4.025 96.869 48.805 1.00 0.00 H ATOM 38055 H6S OL 948 5.326 95.851 48.264 1.00 0.00 H ATOM 38056 C17 OL 948 4.352 95.141 50.068 1.00 0.00 C ATOM 38057 H7R OL 948 5.176 94.654 50.594 1.00 0.00 H ATOM 38058 H7S OL 948 3.779 95.496 50.927 1.00 0.00 H ATOM 38059 C18 OL 948 3.574 94.145 49.367 1.00 0.00 C ATOM 38060 H8R OL 948 4.175 93.676 48.586 1.00 0.00 H ATOM 38061 H8S OL 948 3.224 93.342 50.019 1.00 0.00 H ATOM 38062 C19 OL 948 2.384 94.620 48.647 1.00 0.00 C ATOM 38063 H9R OL 948 2.507 95.287 47.797 1.00 0.00 H ATOM 38064 C110 OL 948 1.138 94.252 48.929 1.00 0.00 C ATOM 38065 H10R OL 948 0.318 94.725 48.394 1.00 0.00 H ATOM 38066 C111 OL 948 0.699 93.480 50.175 1.00 0.00 C ATOM 38067 H11R OL 948 1.442 92.729 50.450 1.00 0.00 H ATOM 38068 H11S OL 948 0.611 94.223 50.971 1.00 0.00 H ATOM 38069 C112 OL 948 -0.553 92.632 50.067 1.00 0.00 C ATOM 38070 H12R OL 948 -1.451 93.220 49.866 1.00 0.00 H ATOM 38071 H12S OL 948 -0.513 92.034 49.154 1.00 0.00 H ATOM 38072 C113 OL 948 -0.942 91.871 51.348 1.00 0.00 C ATOM 38073 H13R OL 948 -1.947 91.464 51.215 1.00 0.00 H ATOM 38074 H13S OL 948 -0.345 90.958 51.405 1.00 0.00 H ATOM 38075 C114 OL 948 -0.865 92.642 52.661 1.00 0.00 C ATOM 38076 H14R OL 948 -0.612 91.896 53.417 1.00 0.00 H ATOM 38077 H14S OL 948 -0.063 93.381 52.723 1.00 0.00 H ATOM 38078 C115 OL 948 -2.168 93.349 53.216 1.00 0.00 C ATOM 38079 H15R OL 948 -2.611 94.134 52.600 1.00 0.00 H ATOM 38080 H15S OL 948 -2.910 92.576 53.429 1.00 0.00 H ATOM 38081 C116 OL 948 -1.892 93.979 54.580 1.00 0.00 C ATOM 38082 H16R OL 948 -1.641 93.182 55.283 1.00 0.00 H ATOM 38083 H16S OL 948 -1.079 94.706 54.631 1.00 0.00 H ATOM 38084 C117 OL 948 -3.079 94.660 55.279 1.00 0.00 C ATOM 38085 H17R OL 948 -2.698 95.208 56.144 1.00 0.00 H ATOM 38086 H17S OL 948 -3.518 95.401 54.608 1.00 0.00 H ATOM 38087 C118 OL 948 -4.109 93.624 55.630 1.00 0.00 C ATOM 38088 H18R OL 948 -4.500 93.306 54.661 1.00 0.00 H ATOM 38089 H18S OL 948 -4.969 94.146 56.055 1.00 0.00 H ATOM 38090 H18T OL 948 -3.839 92.809 56.306 1.00 0.00 H TER 38091 OL 948 ATOM 38091 C116 PA 949 20.417 -4.185 46.997 1.00 0.00 C ATOM 38092 H16R PA 949 21.249 -4.314 47.692 1.00 0.00 H ATOM 38093 H16S PA 949 20.561 -5.049 46.345 1.00 0.00 H ATOM 38094 H16T PA 949 19.511 -4.354 47.584 1.00 0.00 H ATOM 38095 C115 PA 949 20.279 -2.887 46.279 1.00 0.00 C ATOM 38096 H15R PA 949 19.479 -3.100 45.567 1.00 0.00 H ATOM 38097 H15S PA 949 21.185 -2.759 45.683 1.00 0.00 H ATOM 38098 C114 PA 949 19.911 -1.708 47.095 1.00 0.00 C ATOM 38099 H14R PA 949 20.617 -1.598 47.920 1.00 0.00 H ATOM 38100 H14S PA 949 18.994 -1.980 47.622 1.00 0.00 H ATOM 38101 C113 PA 949 19.833 -0.427 46.363 1.00 0.00 C ATOM 38102 H13R PA 949 19.123 -0.538 45.541 1.00 0.00 H ATOM 38103 H13S PA 949 20.822 -0.228 45.943 1.00 0.00 H ATOM 38104 C112 PA 949 19.304 0.712 47.082 1.00 0.00 C ATOM 38105 H12R PA 949 19.887 0.813 48.000 1.00 0.00 H ATOM 38106 H12S PA 949 18.241 0.623 47.316 1.00 0.00 H ATOM 38107 C111 PA 949 19.384 1.978 46.302 1.00 0.00 C ATOM 38108 H11R PA 949 18.567 2.632 46.613 1.00 0.00 H ATOM 38109 H11S PA 949 18.996 1.750 45.307 1.00 0.00 H ATOM 38110 C110 PA 949 20.694 2.739 46.333 1.00 0.00 C ATOM 38111 H10R PA 949 20.511 3.656 45.768 1.00 0.00 H ATOM 38112 H10S PA 949 21.395 2.076 45.822 1.00 0.00 H ATOM 38113 C19 PA 949 21.217 3.176 47.703 1.00 0.00 C ATOM 38114 H9R PA 949 22.155 3.642 47.392 1.00 0.00 H ATOM 38115 H9S PA 949 21.629 2.308 48.221 1.00 0.00 H ATOM 38116 C18 PA 949 20.385 4.064 48.556 1.00 0.00 C ATOM 38117 H8R PA 949 19.335 3.773 48.629 1.00 0.00 H ATOM 38118 H8S PA 949 20.368 5.015 48.020 1.00 0.00 H ATOM 38119 C17 PA 949 21.016 4.304 49.952 1.00 0.00 C ATOM 38120 H7R PA 949 20.137 4.618 50.519 1.00 0.00 H ATOM 38121 H7S PA 949 21.724 5.135 49.917 1.00 0.00 H ATOM 38122 C16 PA 949 21.594 3.033 50.585 1.00 0.00 C ATOM 38123 H6R PA 949 21.141 2.144 50.141 1.00 0.00 H ATOM 38124 H6S PA 949 21.114 2.972 51.565 1.00 0.00 H ATOM 38125 C15 PA 949 23.150 2.937 50.575 1.00 0.00 C ATOM 38126 H5R PA 949 23.458 2.788 49.538 1.00 0.00 H ATOM 38127 H5S PA 949 23.331 1.943 50.987 1.00 0.00 H ATOM 38128 C14 PA 949 23.934 4.131 51.204 1.00 0.00 C ATOM 38129 H4R PA 949 23.792 5.001 50.560 1.00 0.00 H ATOM 38130 H4S PA 949 25.003 3.990 51.376 1.00 0.00 H ATOM 38131 C13 PA 949 23.472 4.512 52.594 1.00 0.00 C ATOM 38132 H3R PA 949 23.933 3.826 53.307 1.00 0.00 H ATOM 38133 H3S PA 949 22.381 4.481 52.645 1.00 0.00 H ATOM 38134 C12 PA 949 23.914 5.820 53.090 1.00 0.00 C ATOM 38135 H2R PA 949 23.499 6.644 52.506 1.00 0.00 H ATOM 38136 H2S PA 949 24.993 5.969 53.159 1.00 0.00 H ATOM 38137 C11 PC 950 23.397 6.118 54.464 1.00 0.00 C ATOM 38138 O12 PC 950 22.303 5.807 54.938 1.00 0.00 O ATOM 38139 O11 PC 950 24.181 6.932 55.174 1.00 0.00 O ATOM 38140 C1 PC 950 23.858 7.409 56.547 1.00 0.00 C ATOM 38141 HR PC 950 23.996 6.551 57.210 1.00 0.00 H ATOM 38142 HS PC 950 22.888 7.910 56.591 1.00 0.00 H ATOM 38143 C2 PC 950 24.925 8.520 56.880 1.00 0.00 C ATOM 38144 HX PC 950 25.851 8.178 56.409 1.00 0.00 H ATOM 38145 C3 PC 950 25.182 8.598 58.394 1.00 0.00 C ATOM 38146 HA PC 950 25.573 9.569 58.705 1.00 0.00 H ATOM 38147 HB PC 950 25.962 7.892 58.690 1.00 0.00 H ATOM 38148 O31 PC 950 23.994 8.153 58.960 1.00 0.00 O ATOM 38149 P31 PC 950 23.775 8.266 60.518 1.00 0.00 P ATOM 38150 O32 PC 950 24.996 7.395 60.989 1.00 0.00 O ATOM 38151 C31 PC 950 24.946 5.930 60.756 1.00 0.00 C ATOM 38152 H1A PC 950 24.976 5.845 59.666 1.00 0.00 H ATOM 38153 H1B PC 950 24.005 5.529 61.142 1.00 0.00 H ATOM 38154 C32 PC 950 26.216 5.251 61.308 1.00 0.00 C ATOM 38155 H2A PC 950 27.092 5.893 61.208 1.00 0.00 H ATOM 38156 H2B PC 950 26.324 4.312 60.764 1.00 0.00 H ATOM 38157 N31 PC 950 26.200 4.837 62.752 1.00 0.00 N ATOM 38158 C33 PC 950 26.601 6.044 63.562 1.00 0.00 C ATOM 38159 H3A PC 950 26.120 6.864 63.027 1.00 0.00 H ATOM 38160 H3B PC 950 27.690 6.122 63.562 1.00 0.00 H ATOM 38161 H3C PC 950 26.260 6.003 64.597 1.00 0.00 H ATOM 38162 C34 PC 950 24.937 4.211 63.096 1.00 0.00 C ATOM 38163 H4A PC 950 24.854 3.936 64.149 1.00 0.00 H ATOM 38164 H4B PC 950 24.886 3.349 62.430 1.00 0.00 H ATOM 38165 H4C PC 950 24.155 4.901 62.776 1.00 0.00 H ATOM 38166 C35 PC 950 27.253 3.824 62.891 1.00 0.00 C ATOM 38167 H5A PC 950 26.864 3.002 62.288 1.00 0.00 H ATOM 38168 H5B PC 950 27.291 3.406 63.898 1.00 0.00 H ATOM 38169 H5C PC 950 28.250 4.168 62.610 1.00 0.00 H ATOM 38170 O33 PC 950 23.945 9.706 60.830 1.00 0.00 O ATOM 38171 O34 PC 950 22.574 7.537 60.955 1.00 0.00 O ATOM 38172 O21 PC 950 24.495 9.826 56.351 1.00 0.00 O ATOM 38173 C21 PC 950 25.388 10.775 55.992 1.00 0.00 C ATOM 38174 O22 PC 950 26.599 10.729 56.221 1.00 0.00 O ATOM 38175 C12 OL 951 24.833 12.070 55.414 1.00 0.00 C ATOM 38176 H2R OL 951 23.975 12.274 56.059 1.00 0.00 H ATOM 38177 H2S OL 951 25.488 12.916 55.633 1.00 0.00 H ATOM 38178 C13 OL 951 24.520 11.924 53.898 1.00 0.00 C ATOM 38179 H3R OL 951 24.262 12.877 53.432 1.00 0.00 H ATOM 38180 H3S OL 951 25.464 11.657 53.419 1.00 0.00 H ATOM 38181 C14 OL 951 23.557 10.810 53.479 1.00 0.00 C ATOM 38182 H4R OL 951 23.898 9.845 53.861 1.00 0.00 H ATOM 38183 H4S OL 951 22.600 10.927 53.991 1.00 0.00 H ATOM 38184 C15 OL 951 23.481 10.673 51.943 1.00 0.00 C ATOM 38185 H5R OL 951 22.927 11.514 51.519 1.00 0.00 H ATOM 38186 H5S OL 951 24.521 10.569 51.627 1.00 0.00 H ATOM 38187 C16 OL 951 22.828 9.387 51.479 1.00 0.00 C ATOM 38188 H6R OL 951 23.422 8.494 51.685 1.00 0.00 H ATOM 38189 H6S OL 951 21.951 9.240 52.113 1.00 0.00 H ATOM 38190 C17 OL 951 22.402 9.372 50.083 1.00 0.00 C ATOM 38191 H7R OL 951 21.435 9.837 49.882 1.00 0.00 H ATOM 38192 H7S OL 951 23.151 9.834 49.437 1.00 0.00 H ATOM 38193 C18 OL 951 22.252 8.006 49.433 1.00 0.00 C ATOM 38194 H8R OL 951 21.991 7.383 50.291 1.00 0.00 H ATOM 38195 H8S OL 951 21.497 8.169 48.662 1.00 0.00 H ATOM 38196 C19 OL 951 23.614 7.541 48.889 1.00 0.00 C ATOM 38197 H9R OL 951 24.414 7.822 49.568 1.00 0.00 H ATOM 38198 C110 OL 951 23.985 6.988 47.691 1.00 0.00 C ATOM 38199 H10R OL 951 25.041 6.804 47.509 1.00 0.00 H ATOM 38200 C111 OL 951 23.190 6.698 46.504 1.00 0.00 C ATOM 38201 H11R OL 951 23.063 5.614 46.512 1.00 0.00 H ATOM 38202 H11S OL 951 22.193 7.140 46.567 1.00 0.00 H ATOM 38203 C112 OL 951 23.859 7.225 45.278 1.00 0.00 C ATOM 38204 H12R OL 951 24.886 6.855 45.268 1.00 0.00 H ATOM 38205 H12S OL 951 23.419 6.873 44.343 1.00 0.00 H ATOM 38206 C113 OL 951 23.699 8.728 45.127 1.00 0.00 C ATOM 38207 H13R OL 951 22.650 8.994 45.275 1.00 0.00 H ATOM 38208 H13S OL 951 24.263 9.164 45.953 1.00 0.00 H ATOM 38209 C114 OL 951 24.166 9.261 43.780 1.00 0.00 C ATOM 38210 H14R OL 951 23.665 8.714 42.979 1.00 0.00 H ATOM 38211 H14S OL 951 23.856 10.298 43.639 1.00 0.00 H ATOM 38212 C115 OL 951 25.715 9.109 43.557 1.00 0.00 C ATOM 38213 H15R OL 951 26.319 9.776 44.176 1.00 0.00 H ATOM 38214 H15S OL 951 25.970 8.066 43.758 1.00 0.00 H ATOM 38215 C116 OL 951 26.125 9.484 42.062 1.00 0.00 C ATOM 38216 H16R OL 951 27.208 9.348 42.033 1.00 0.00 H ATOM 38217 H16S OL 951 25.690 8.762 41.368 1.00 0.00 H ATOM 38218 C117 OL 951 25.971 10.972 41.665 1.00 0.00 C ATOM 38219 H17R OL 951 25.011 11.433 41.907 1.00 0.00 H ATOM 38220 H17S OL 951 26.738 11.515 42.220 1.00 0.00 H ATOM 38221 C118 OL 951 26.112 11.225 40.195 1.00 0.00 C ATOM 38222 H18R OL 951 27.104 10.880 39.898 1.00 0.00 H ATOM 38223 H18S OL 951 26.176 12.290 39.958 1.00 0.00 H ATOM 38224 H18T OL 951 25.291 10.789 39.622 1.00 0.00 H TER 38225 OL 951 ATOM 38225 C116 PA 952 16.354 -1.327 49.413 1.00 0.00 C ATOM 38226 H16R PA 952 16.046 -0.474 50.021 1.00 0.00 H ATOM 38227 H16S PA 952 17.297 -1.065 48.928 1.00 0.00 H ATOM 38228 H16T PA 952 16.690 -2.004 50.201 1.00 0.00 H ATOM 38229 C115 PA 952 15.405 -1.683 48.304 1.00 0.00 C ATOM 38230 H15R PA 952 15.403 -0.979 47.469 1.00 0.00 H ATOM 38231 H15S PA 952 14.401 -1.529 48.705 1.00 0.00 H ATOM 38232 C114 PA 952 15.634 -3.152 47.755 1.00 0.00 C ATOM 38233 H14R PA 952 15.563 -3.770 48.653 1.00 0.00 H ATOM 38234 H14S PA 952 16.650 -3.284 47.377 1.00 0.00 H ATOM 38235 C113 PA 952 14.712 -3.685 46.713 1.00 0.00 C ATOM 38236 H13R PA 952 14.825 -3.080 45.811 1.00 0.00 H ATOM 38237 H13S PA 952 13.658 -3.622 46.990 1.00 0.00 H ATOM 38238 C112 PA 952 15.056 -5.125 46.353 1.00 0.00 C ATOM 38239 H12R PA 952 14.604 -5.793 47.089 1.00 0.00 H ATOM 38240 H12S PA 952 16.139 -5.219 46.249 1.00 0.00 H ATOM 38241 C111 PA 952 14.363 -5.572 45.093 1.00 0.00 C ATOM 38242 H11R PA 952 14.627 -6.594 44.813 1.00 0.00 H ATOM 38243 H11S PA 952 14.862 -5.008 44.302 1.00 0.00 H ATOM 38244 C110 PA 952 12.865 -5.276 45.036 1.00 0.00 C ATOM 38245 H10R PA 952 12.569 -5.357 43.988 1.00 0.00 H ATOM 38246 H10S PA 952 12.557 -4.277 45.354 1.00 0.00 H ATOM 38247 C19 PA 952 12.130 -6.305 45.893 1.00 0.00 C ATOM 38248 H9R PA 952 12.890 -7.079 46.016 1.00 0.00 H ATOM 38249 H9S PA 952 11.522 -6.944 45.250 1.00 0.00 H ATOM 38250 C18 PA 952 11.549 -5.809 47.269 1.00 0.00 C ATOM 38251 H8R PA 952 10.748 -5.093 47.072 1.00 0.00 H ATOM 38252 H8S PA 952 12.214 -5.238 47.920 1.00 0.00 H ATOM 38253 C17 PA 952 11.112 -7.067 48.032 1.00 0.00 C ATOM 38254 H7R PA 952 11.880 -7.843 48.029 1.00 0.00 H ATOM 38255 H7S PA 952 10.269 -7.442 47.448 1.00 0.00 H ATOM 38256 C16 PA 952 10.617 -6.861 49.497 1.00 0.00 C ATOM 38257 H6R PA 952 10.071 -7.751 49.816 1.00 0.00 H ATOM 38258 H6S PA 952 9.904 -6.037 49.576 1.00 0.00 H ATOM 38259 C15 PA 952 11.630 -6.442 50.552 1.00 0.00 C ATOM 38260 H5R PA 952 11.660 -5.372 50.338 1.00 0.00 H ATOM 38261 H5S PA 952 12.572 -6.988 50.470 1.00 0.00 H ATOM 38262 C14 PA 952 11.174 -6.860 51.924 1.00 0.00 C ATOM 38263 H4R PA 952 10.963 -7.931 51.933 1.00 0.00 H ATOM 38264 H4S PA 952 10.282 -6.283 52.174 1.00 0.00 H ATOM 38265 C13 PA 952 12.233 -6.487 52.971 1.00 0.00 C ATOM 38266 H3R PA 952 13.142 -7.031 52.707 1.00 0.00 H ATOM 38267 H3S PA 952 12.000 -6.868 53.968 1.00 0.00 H ATOM 38268 C12 PA 952 12.563 -5.041 53.040 1.00 0.00 C ATOM 38269 H2R PA 952 11.608 -4.511 53.044 1.00 0.00 H ATOM 38270 H2S PA 952 13.067 -4.675 52.143 1.00 0.00 H ATOM 38271 C11 PC 953 13.432 -4.714 54.258 1.00 0.00 C ATOM 38272 O12 PC 953 13.416 -5.386 55.239 1.00 0.00 O ATOM 38273 O11 PC 953 14.175 -3.630 54.159 1.00 0.00 O ATOM 38274 C1 PC 953 14.903 -3.066 55.275 1.00 0.00 C ATOM 38275 HR PC 953 15.320 -3.908 55.833 1.00 0.00 H ATOM 38276 HS PC 953 14.220 -2.535 55.944 1.00 0.00 H ATOM 38277 C2 PC 953 15.991 -2.033 54.883 1.00 0.00 C ATOM 38278 HX PC 953 16.804 -2.632 54.465 1.00 0.00 H ATOM 38279 C3 PC 953 16.613 -1.429 56.185 1.00 0.00 C ATOM 38280 HA PC 953 16.904 -2.245 56.850 1.00 0.00 H ATOM 38281 HB PC 953 15.896 -0.745 56.646 1.00 0.00 H ATOM 38282 O31 PC 953 17.783 -0.755 55.842 1.00 0.00 O ATOM 38283 P31 PC 953 18.787 -0.306 56.972 1.00 0.00 P ATOM 38284 O32 PC 953 20.264 -0.609 56.398 1.00 0.00 O ATOM 38285 C31 PC 953 20.782 -1.886 56.692 1.00 0.00 C ATOM 38286 H1A PC 953 20.253 -2.667 56.139 1.00 0.00 H ATOM 38287 H1B PC 953 20.772 -2.179 57.745 1.00 0.00 H ATOM 38288 C32 PC 953 22.270 -1.919 56.314 1.00 0.00 C ATOM 38289 H2A PC 953 22.275 -1.315 55.406 1.00 0.00 H ATOM 38290 H2B PC 953 22.636 -2.882 55.954 1.00 0.00 H ATOM 38291 N31 PC 953 23.357 -1.433 57.309 1.00 0.00 N ATOM 38292 C33 PC 953 23.543 -2.299 58.500 1.00 0.00 C ATOM 38293 H3A PC 953 22.709 -2.262 59.203 1.00 0.00 H ATOM 38294 H3B PC 953 24.310 -1.829 59.118 1.00 0.00 H ATOM 38295 H3C PC 953 23.753 -3.351 58.301 1.00 0.00 H ATOM 38296 C34 PC 953 24.579 -1.448 56.547 1.00 0.00 C ATOM 38297 H4A PC 953 24.663 -0.640 55.819 1.00 0.00 H ATOM 38298 H4B PC 953 24.577 -2.378 55.976 1.00 0.00 H ATOM 38299 H4C PC 953 25.449 -1.262 57.178 1.00 0.00 H ATOM 38300 C35 PC 953 23.080 -0.027 57.595 1.00 0.00 C ATOM 38301 H5A PC 953 22.940 0.418 56.609 1.00 0.00 H ATOM 38302 H5B PC 953 23.941 0.410 58.105 1.00 0.00 H ATOM 38303 H5C PC 953 22.195 0.057 58.227 1.00 0.00 H ATOM 38304 O33 PC 953 18.667 1.149 56.979 1.00 0.00 O ATOM 38305 O34 PC 953 18.415 -1.094 58.216 1.00 0.00 O ATOM 38306 O21 PC 953 15.569 -0.977 53.976 1.00 0.00 O ATOM 38307 C21 PC 953 14.370 -0.322 54.034 1.00 0.00 C ATOM 38308 O22 PC 953 13.518 -0.393 54.886 1.00 0.00 O ATOM 38309 C12 OL 954 14.124 0.389 52.722 1.00 0.00 C ATOM 38310 H2R OL 954 15.036 0.212 52.148 1.00 0.00 H ATOM 38311 H2S OL 954 13.339 -0.163 52.202 1.00 0.00 H ATOM 38312 C13 OL 954 13.967 1.835 52.825 1.00 0.00 C ATOM 38313 H3R OL 954 14.747 2.241 53.473 1.00 0.00 H ATOM 38314 H3S OL 954 14.189 2.356 51.891 1.00 0.00 H ATOM 38315 C14 OL 954 12.595 2.250 53.330 1.00 0.00 C ATOM 38316 H4R OL 954 11.819 1.866 52.664 1.00 0.00 H ATOM 38317 H4S OL 954 12.327 1.931 54.339 1.00 0.00 H ATOM 38318 C15 OL 954 12.397 3.792 53.233 1.00 0.00 C ATOM 38319 H5R OL 954 13.333 4.182 53.638 1.00 0.00 H ATOM 38320 H5S OL 954 12.326 4.026 52.169 1.00 0.00 H ATOM 38321 C16 OL 954 11.393 4.357 54.219 1.00 0.00 C ATOM 38322 H6R OL 954 10.458 3.796 54.171 1.00 0.00 H ATOM 38323 H6S OL 954 11.649 4.098 55.248 1.00 0.00 H ATOM 38324 C17 OL 954 11.245 5.910 54.142 1.00 0.00 C ATOM 38325 H7R OL 954 10.479 6.278 54.828 1.00 0.00 H ATOM 38326 H7S OL 954 12.254 6.167 54.472 1.00 0.00 H ATOM 38327 C18 OL 954 10.984 6.521 52.740 1.00 0.00 C ATOM 38328 H8R OL 954 11.755 6.293 52.001 1.00 0.00 H ATOM 38329 H8S OL 954 9.996 6.116 52.509 1.00 0.00 H ATOM 38330 C19 OL 954 11.112 8.017 52.888 1.00 0.00 C ATOM 38331 H9R OL 954 11.853 8.523 53.501 1.00 0.00 H ATOM 38332 C110 OL 954 10.268 8.900 52.349 1.00 0.00 C ATOM 38333 H10R OL 954 10.516 9.947 52.499 1.00 0.00 H ATOM 38334 C111 OL 954 9.075 8.736 51.540 1.00 0.00 C ATOM 38335 H11R OL 954 8.996 7.790 51.001 1.00 0.00 H ATOM 38336 H11S OL 954 8.117 8.755 52.063 1.00 0.00 H ATOM 38337 C112 OL 954 9.093 9.986 50.550 1.00 0.00 C ATOM 38338 H12R OL 954 8.171 10.074 49.973 1.00 0.00 H ATOM 38339 H12S OL 954 9.203 10.955 51.041 1.00 0.00 H ATOM 38340 C113 OL 954 10.201 10.030 49.534 1.00 0.00 C ATOM 38341 H13R OL 954 11.128 9.659 49.977 1.00 0.00 H ATOM 38342 H13S OL 954 10.029 9.236 48.804 1.00 0.00 H ATOM 38343 C114 OL 954 10.241 11.475 48.843 1.00 0.00 C ATOM 38344 H14R OL 954 9.234 11.865 48.681 1.00 0.00 H ATOM 38345 H14S OL 954 10.734 12.038 49.638 1.00 0.00 H ATOM 38346 C115 OL 954 11.189 11.469 47.615 1.00 0.00 C ATOM 38347 H15R OL 954 12.240 11.215 47.771 1.00 0.00 H ATOM 38348 H15S OL 954 10.774 10.744 46.911 1.00 0.00 H ATOM 38349 C116 OL 954 11.189 12.830 46.926 1.00 0.00 C ATOM 38350 H16R OL 954 10.144 13.065 46.712 1.00 0.00 H ATOM 38351 H16S OL 954 11.573 13.610 47.587 1.00 0.00 H ATOM 38352 C117 OL 954 11.902 12.799 45.547 1.00 0.00 C ATOM 38353 H17R OL 954 12.939 12.654 45.859 1.00 0.00 H ATOM 38354 H17S OL 954 11.688 11.899 44.966 1.00 0.00 H ATOM 38355 C118 OL 954 11.804 14.075 44.715 1.00 0.00 C ATOM 38356 H18R OL 954 12.410 14.057 43.806 1.00 0.00 H ATOM 38357 H18S OL 954 12.112 14.980 45.243 1.00 0.00 H ATOM 38358 H18T OL 954 10.766 14.301 44.462 1.00 0.00 H TER 38359 OL 954 ATOM 38359 C116 PA 955 140.821 128.879 40.402 1.00 0.00 C ATOM 38360 H16R PA 955 140.716 128.230 39.530 1.00 0.00 H ATOM 38361 H16S PA 955 140.221 129.781 40.261 1.00 0.00 H ATOM 38362 H16T PA 955 140.448 128.360 41.287 1.00 0.00 H ATOM 38363 C115 PA 955 142.205 129.441 40.470 1.00 0.00 C ATOM 38364 H15R PA 955 142.281 130.138 39.633 1.00 0.00 H ATOM 38365 H15S PA 955 142.980 128.692 40.296 1.00 0.00 H ATOM 38366 C114 PA 955 142.439 130.157 41.791 1.00 0.00 C ATOM 38367 H14R PA 955 141.615 130.758 42.180 1.00 0.00 H ATOM 38368 H14S PA 955 143.266 130.831 41.560 1.00 0.00 H ATOM 38369 C113 PA 955 142.919 129.124 42.784 1.00 0.00 C ATOM 38370 H13R PA 955 143.615 128.513 42.206 1.00 0.00 H ATOM 38371 H13S PA 955 142.141 128.366 42.896 1.00 0.00 H ATOM 38372 C112 PA 955 143.339 129.741 44.115 1.00 0.00 C ATOM 38373 H12R PA 955 142.503 130.182 44.661 1.00 0.00 H ATOM 38374 H12S PA 955 144.022 130.589 44.025 1.00 0.00 H ATOM 38375 C111 PA 955 143.912 128.688 45.043 1.00 0.00 C ATOM 38376 H11R PA 955 144.754 128.159 44.591 1.00 0.00 H ATOM 38377 H11S PA 955 143.063 128.001 45.072 1.00 0.00 H ATOM 38378 C110 PA 955 144.382 129.305 46.508 1.00 0.00 C ATOM 38379 H10R PA 955 144.664 128.465 47.147 1.00 0.00 H ATOM 38380 H10S PA 955 143.549 129.843 46.964 1.00 0.00 H ATOM 38381 C19 PA 955 145.611 130.256 46.420 1.00 0.00 C ATOM 38382 H9R PA 955 145.301 131.081 45.775 1.00 0.00 H ATOM 38383 H9S PA 955 146.515 129.733 46.101 1.00 0.00 H ATOM 38384 C18 PA 955 145.743 130.985 47.812 1.00 0.00 C ATOM 38385 H8R PA 955 145.961 130.167 48.502 1.00 0.00 H ATOM 38386 H8S PA 955 144.811 131.365 48.237 1.00 0.00 H ATOM 38387 C17 PA 955 146.923 131.945 48.025 1.00 0.00 C ATOM 38388 H7R PA 955 146.770 132.855 47.442 1.00 0.00 H ATOM 38389 H7S PA 955 147.791 131.396 47.651 1.00 0.00 H ATOM 38390 C16 PA 955 147.188 132.309 49.461 1.00 0.00 C ATOM 38391 H6R PA 955 147.915 133.121 49.522 1.00 0.00 H ATOM 38392 H6S PA 955 147.405 131.429 50.070 1.00 0.00 H ATOM 38393 C15 PA 955 145.923 132.804 50.229 1.00 0.00 C ATOM 38394 H5R PA 955 145.013 132.225 50.061 1.00 0.00 H ATOM 38395 H5S PA 955 145.593 133.793 49.902 1.00 0.00 H ATOM 38396 C14 PA 955 146.061 132.886 51.774 1.00 0.00 C ATOM 38397 H4R PA 955 145.159 133.203 52.301 1.00 0.00 H ATOM 38398 H4S PA 955 146.611 133.801 52.003 1.00 0.00 H ATOM 38399 C13 PA 955 146.710 131.734 52.484 1.00 0.00 C ATOM 38400 H3R PA 955 147.758 131.737 52.175 1.00 0.00 H ATOM 38401 H3S PA 955 146.253 130.765 52.272 1.00 0.00 H ATOM 38402 C12 PA 955 146.832 131.919 54.046 1.00 0.00 C ATOM 38403 H2R PA 955 147.565 132.657 54.380 1.00 0.00 H ATOM 38404 H2S PA 955 145.908 132.303 54.482 1.00 0.00 H ATOM 38405 C11 PGR 956 147.181 130.569 54.717 1.00 0.00 C ATOM 38406 O12 PGR 956 147.531 129.580 54.110 1.00 0.00 O ATOM 38407 O11 PGR 956 147.163 130.606 56.074 1.00 0.00 O ATOM 38408 C1 PGR 956 147.585 129.484 56.849 1.00 0.00 C ATOM 38409 HR PGR 956 147.896 129.893 57.814 1.00 0.00 H ATOM 38410 HS PGR 956 148.317 128.930 56.257 1.00 0.00 H ATOM 38411 C2 PGR 956 146.304 128.728 57.134 1.00 0.00 C ATOM 38412 HX PGR 956 145.548 129.305 57.672 1.00 0.00 H ATOM 38413 C3 PGR 956 146.605 127.604 58.184 1.00 0.00 C ATOM 38414 HA PGR 956 147.669 127.486 58.406 1.00 0.00 H ATOM 38415 HB PGR 956 146.229 126.619 57.895 1.00 0.00 H ATOM 38416 O31 PGR 956 145.782 127.926 59.278 1.00 0.00 O ATOM 38417 P31 PGR 956 145.748 127.151 60.652 1.00 0.00 P ATOM 38418 O32 PGR 956 147.168 127.219 61.250 1.00 0.00 O ATOM 38419 C31 PGR 956 147.774 128.436 61.665 1.00 0.00 C ATOM 38420 H1A PGR 956 146.923 129.088 61.878 1.00 0.00 H ATOM 38421 H1B PGR 956 148.429 128.891 60.917 1.00 0.00 H ATOM 38422 C32 PGR 956 148.521 128.310 63.002 1.00 0.00 C ATOM 38423 H2A PGR 956 148.324 129.232 63.555 1.00 0.00 H ATOM 38424 O35 PGR 956 149.906 128.234 62.748 1.00 0.00 O ATOM 38425 HO5A PGR 956 150.101 127.632 62.007 1.00 0.00 H ATOM 38426 C33 PGR 956 148.055 127.063 63.770 1.00 0.00 C ATOM 38427 H3A PGR 956 148.667 127.110 64.674 1.00 0.00 H ATOM 38428 H3B PGR 956 146.994 127.135 64.021 1.00 0.00 H ATOM 38429 O33 PGR 956 144.903 127.826 61.650 1.00 0.00 O ATOM 38430 O34 PGR 956 145.452 125.720 60.316 1.00 0.00 O ATOM 38431 O21 PGR 956 145.734 128.054 55.977 1.00 0.00 O ATOM 38432 C21 PGR 956 146.403 127.158 55.265 1.00 0.00 C ATOM 38433 O22 PGR 956 147.448 126.668 55.574 1.00 0.00 O ATOM 38434 O36 PGR 956 148.320 125.830 63.059 1.00 0.00 O ATOM 38435 HO6A PGR 956 147.852 125.830 62.205 1.00 0.00 H ATOM 38436 C12 OL 957 145.683 126.843 53.988 1.00 0.00 C ATOM 38437 H2R OL 957 146.486 126.751 53.255 1.00 0.00 H ATOM 38438 H2S OL 957 145.225 125.852 53.961 1.00 0.00 H ATOM 38439 C13 OL 957 144.633 127.824 53.478 1.00 0.00 C ATOM 38440 H3R OL 957 143.765 127.590 54.099 1.00 0.00 H ATOM 38441 H3S OL 957 144.965 128.854 53.622 1.00 0.00 H ATOM 38442 C14 OL 957 144.402 127.535 51.956 1.00 0.00 C ATOM 38443 H4R OL 957 144.134 128.487 51.494 1.00 0.00 H ATOM 38444 H4S OL 957 145.398 127.325 51.560 1.00 0.00 H ATOM 38445 C15 OL 957 143.442 126.316 51.651 1.00 0.00 C ATOM 38446 H5R OL 957 143.885 125.456 52.159 1.00 0.00 H ATOM 38447 H5S OL 957 142.503 126.487 52.181 1.00 0.00 H ATOM 38448 C16 OL 957 143.194 125.894 50.215 1.00 0.00 C ATOM 38449 H6R OL 957 144.173 125.729 49.759 1.00 0.00 H ATOM 38450 H6S OL 957 142.660 124.944 50.160 1.00 0.00 H ATOM 38451 C17 OL 957 142.459 126.921 49.364 1.00 0.00 C ATOM 38452 H7R OL 957 141.551 127.184 49.911 1.00 0.00 H ATOM 38453 H7S OL 957 143.022 127.856 49.337 1.00 0.00 H ATOM 38454 C18 OL 957 142.168 126.384 47.914 1.00 0.00 C ATOM 38455 H8R OL 957 141.934 127.281 47.337 1.00 0.00 H ATOM 38456 H8S OL 957 143.124 126.049 47.505 1.00 0.00 H ATOM 38457 C19 OL 957 140.972 125.549 47.842 1.00 0.00 C ATOM 38458 H9R OL 957 140.200 125.758 48.579 1.00 0.00 H ATOM 38459 C110 OL 957 140.564 124.664 46.910 1.00 0.00 C ATOM 38460 H10R OL 957 139.537 124.325 47.017 1.00 0.00 H ATOM 38461 C111 OL 957 141.463 124.195 45.732 1.00 0.00 C ATOM 38462 H11R OL 957 142.167 124.945 45.365 1.00 0.00 H ATOM 38463 H11S OL 957 141.997 123.276 45.981 1.00 0.00 H ATOM 38464 C112 OL 957 140.787 123.984 44.515 1.00 0.00 C ATOM 38465 H12R OL 957 141.399 123.481 43.764 1.00 0.00 H ATOM 38466 H12S OL 957 139.965 123.337 44.827 1.00 0.00 H ATOM 38467 C113 OL 957 140.214 125.275 43.814 1.00 0.00 C ATOM 38468 H13R OL 957 139.452 125.770 44.420 1.00 0.00 H ATOM 38469 H13S OL 957 140.980 126.027 43.616 1.00 0.00 H ATOM 38470 C114 OL 957 139.583 125.069 42.452 1.00 0.00 C ATOM 38471 H14R OL 957 139.361 126.032 41.988 1.00 0.00 H ATOM 38472 H14S OL 957 140.334 124.724 41.738 1.00 0.00 H ATOM 38473 C115 OL 957 138.272 124.340 42.284 1.00 0.00 C ATOM 38474 H15R OL 957 138.536 123.304 42.508 1.00 0.00 H ATOM 38475 H15S OL 957 137.570 124.734 43.022 1.00 0.00 H ATOM 38476 C116 OL 957 137.586 124.574 40.877 1.00 0.00 C ATOM 38477 H16R OL 957 137.556 125.627 40.588 1.00 0.00 H ATOM 38478 H16S OL 957 138.215 124.085 40.130 1.00 0.00 H ATOM 38479 C117 OL 957 136.209 124.051 40.772 1.00 0.00 C ATOM 38480 H17R OL 957 135.443 124.605 41.318 1.00 0.00 H ATOM 38481 H17S OL 957 135.797 124.155 39.766 1.00 0.00 H ATOM 38482 C118 OL 957 136.121 122.535 40.999 1.00 0.00 C ATOM 38483 H18R OL 957 136.459 122.303 42.011 1.00 0.00 H ATOM 38484 H18S OL 957 136.857 122.020 40.378 1.00 0.00 H ATOM 38485 H18T OL 957 135.170 122.050 40.767 1.00 0.00 H TER 38486 OL 957 ATOM 38486 C116 PA 958 15.256 36.518 38.869 1.00 0.00 C ATOM 38487 H16R PA 958 14.683 37.376 39.223 1.00 0.00 H ATOM 38488 H16S PA 958 15.226 36.404 37.784 1.00 0.00 H ATOM 38489 H16T PA 958 16.327 36.524 39.082 1.00 0.00 H ATOM 38490 C115 PA 958 15.007 35.225 39.565 1.00 0.00 C ATOM 38491 H15R PA 958 15.791 34.486 39.387 1.00 0.00 H ATOM 38492 H15S PA 958 14.118 34.668 39.259 1.00 0.00 H ATOM 38493 C114 PA 958 14.808 35.550 41.083 1.00 0.00 C ATOM 38494 H14R PA 958 13.779 35.885 41.229 1.00 0.00 H ATOM 38495 H14S PA 958 15.457 36.342 41.461 1.00 0.00 H ATOM 38496 C113 PA 958 14.901 34.306 41.922 1.00 0.00 C ATOM 38497 H13R PA 958 15.889 33.841 41.950 1.00 0.00 H ATOM 38498 H13S PA 958 14.203 33.554 41.549 1.00 0.00 H ATOM 38499 C112 PA 958 14.625 34.553 43.415 1.00 0.00 C ATOM 38500 H12R PA 958 14.538 33.654 44.029 1.00 0.00 H ATOM 38501 H12S PA 958 13.655 35.055 43.395 1.00 0.00 H ATOM 38502 C111 PA 958 15.585 35.352 44.353 1.00 0.00 C ATOM 38503 H11R PA 958 15.687 36.368 43.966 1.00 0.00 H ATOM 38504 H11S PA 958 16.539 34.823 44.298 1.00 0.00 H ATOM 38505 C110 PA 958 15.103 35.305 45.802 1.00 0.00 C ATOM 38506 H10R PA 958 15.021 34.241 46.032 1.00 0.00 H ATOM 38507 H10S PA 958 14.181 35.869 45.959 1.00 0.00 H ATOM 38508 C19 PA 958 16.097 35.889 46.750 1.00 0.00 C ATOM 38509 H9R PA 958 16.202 36.969 46.623 1.00 0.00 H ATOM 38510 H9S PA 958 17.088 35.497 46.510 1.00 0.00 H ATOM 38511 C18 PA 958 15.762 35.701 48.190 1.00 0.00 C ATOM 38512 H8R PA 958 15.469 34.689 48.476 1.00 0.00 H ATOM 38513 H8S PA 958 14.813 36.235 48.272 1.00 0.00 H ATOM 38514 C17 PA 958 16.838 36.169 49.222 1.00 0.00 C ATOM 38515 H7R PA 958 17.424 37.009 48.843 1.00 0.00 H ATOM 38516 H7S PA 958 17.601 35.400 49.358 1.00 0.00 H ATOM 38517 C16 PA 958 16.316 36.383 50.629 1.00 0.00 C ATOM 38518 H6R PA 958 15.805 35.493 51.001 1.00 0.00 H ATOM 38519 H6S PA 958 15.552 37.163 50.606 1.00 0.00 H ATOM 38520 C15 PA 958 17.393 36.720 51.714 1.00 0.00 C ATOM 38521 H5R PA 958 18.081 37.453 51.287 1.00 0.00 H ATOM 38522 H5S PA 958 17.982 35.806 51.807 1.00 0.00 H ATOM 38523 C14 PA 958 16.683 37.058 53.105 1.00 0.00 C ATOM 38524 H4R PA 958 16.014 36.208 53.257 1.00 0.00 H ATOM 38525 H4S PA 958 16.116 37.988 53.028 1.00 0.00 H ATOM 38526 C13 PA 958 17.648 37.291 54.253 1.00 0.00 C ATOM 38527 H3R PA 958 17.193 37.641 55.183 1.00 0.00 H ATOM 38528 H3S PA 958 18.213 38.171 53.938 1.00 0.00 H ATOM 38529 C12 PA 958 18.776 36.297 54.495 1.00 0.00 C ATOM 38530 H2R PA 958 19.373 36.144 53.594 1.00 0.00 H ATOM 38531 H2S PA 958 18.395 35.371 54.932 1.00 0.00 H ATOM 38532 C11 PGR 959 19.748 36.864 55.462 1.00 0.00 C ATOM 38533 O12 PGR 959 19.651 37.949 56.040 1.00 0.00 O ATOM 38534 O11 PGR 959 20.818 36.069 55.556 1.00 0.00 O ATOM 38535 C1 PGR 959 21.623 36.308 56.750 1.00 0.00 C ATOM 38536 HR PGR 959 21.015 36.291 57.658 1.00 0.00 H ATOM 38537 HS PGR 959 22.057 37.311 56.727 1.00 0.00 H ATOM 38538 C2 PGR 959 22.794 35.341 56.730 1.00 0.00 C ATOM 38539 HX PGR 959 22.516 34.354 56.352 1.00 0.00 H ATOM 38540 C3 PGR 959 23.453 35.199 58.133 1.00 0.00 C ATOM 38541 HA PGR 959 24.070 34.299 58.190 1.00 0.00 H ATOM 38542 HB PGR 959 22.529 35.052 58.698 1.00 0.00 H ATOM 38543 O31 PGR 959 24.141 36.366 58.543 1.00 0.00 O ATOM 38544 P31 PGR 959 24.579 36.508 60.067 1.00 0.00 P ATOM 38545 O32 PGR 959 25.939 35.739 60.225 1.00 0.00 O ATOM 38546 C31 PGR 959 26.055 34.346 60.474 1.00 0.00 C ATOM 38547 H1A PGR 959 25.464 34.030 61.338 1.00 0.00 H ATOM 38548 H1B PGR 959 25.840 33.815 59.543 1.00 0.00 H ATOM 38549 C32 PGR 959 27.429 33.985 60.958 1.00 0.00 C ATOM 38550 H2A PGR 959 27.471 32.904 61.120 1.00 0.00 H ATOM 38551 O35 PGR 959 27.765 34.568 62.218 1.00 0.00 O ATOM 38552 HO5A PGR 959 27.397 35.470 62.196 1.00 0.00 H ATOM 38553 C33 PGR 959 28.566 34.313 59.926 1.00 0.00 C ATOM 38554 H3A PGR 959 28.182 33.821 59.029 1.00 0.00 H ATOM 38555 H3B PGR 959 28.484 35.376 59.682 1.00 0.00 H ATOM 38556 O33 PGR 959 24.911 37.957 60.261 1.00 0.00 O ATOM 38557 O34 PGR 959 23.558 35.827 60.926 1.00 0.00 O ATOM 38558 O21 PGR 959 23.678 35.909 55.764 1.00 0.00 O ATOM 38559 C21 PGR 959 24.825 35.283 55.445 1.00 0.00 C ATOM 38560 O22 PGR 959 25.088 34.157 55.805 1.00 0.00 O ATOM 38561 O36 PGR 959 29.827 33.923 60.365 1.00 0.00 O ATOM 38562 HO6A PGR 959 29.985 32.968 60.262 1.00 0.00 H ATOM 38563 C12 OL 960 25.675 36.159 54.554 1.00 0.00 C ATOM 38564 H2R OL 960 25.872 37.180 54.888 1.00 0.00 H ATOM 38565 H2S OL 960 26.698 35.776 54.520 1.00 0.00 H ATOM 38566 C13 OL 960 25.031 36.232 53.093 1.00 0.00 C ATOM 38567 H3R OL 960 25.652 36.976 52.589 1.00 0.00 H ATOM 38568 H3S OL 960 25.158 35.231 52.676 1.00 0.00 H ATOM 38569 C14 OL 960 23.508 36.643 53.064 1.00 0.00 C ATOM 38570 H4R OL 960 23.204 36.611 52.016 1.00 0.00 H ATOM 38571 H4S OL 960 22.937 35.842 53.538 1.00 0.00 H ATOM 38572 C15 OL 960 23.176 38.103 53.624 1.00 0.00 C ATOM 38573 H5R OL 960 22.130 38.298 53.871 1.00 0.00 H ATOM 38574 H5S OL 960 23.701 38.382 54.540 1.00 0.00 H ATOM 38575 C16 OL 960 23.734 39.109 52.640 1.00 0.00 C ATOM 38576 H6R OL 960 23.422 40.047 53.103 1.00 0.00 H ATOM 38577 H6S OL 960 24.821 39.003 52.615 1.00 0.00 H ATOM 38578 C17 OL 960 23.170 39.147 51.244 1.00 0.00 C ATOM 38579 H7R OL 960 23.345 38.181 50.764 1.00 0.00 H ATOM 38580 H7S OL 960 22.096 39.237 51.415 1.00 0.00 H ATOM 38581 C18 OL 960 23.740 40.306 50.346 1.00 0.00 C ATOM 38582 H8R OL 960 23.782 41.236 50.917 1.00 0.00 H ATOM 38583 H8S OL 960 24.792 40.087 50.152 1.00 0.00 H ATOM 38584 C19 OL 960 22.911 40.343 49.143 1.00 0.00 C ATOM 38585 H9R OL 960 21.846 40.412 49.349 1.00 0.00 H ATOM 38586 C110 OL 960 23.310 40.173 47.875 1.00 0.00 C ATOM 38587 H10R OL 960 22.583 40.168 47.067 1.00 0.00 H ATOM 38588 C111 OL 960 24.779 40.213 47.462 1.00 0.00 C ATOM 38589 H11R OL 960 25.356 40.980 47.983 1.00 0.00 H ATOM 38590 H11S OL 960 25.347 39.313 47.709 1.00 0.00 H ATOM 38591 C112 OL 960 24.895 40.658 45.946 1.00 0.00 C ATOM 38592 H12R OL 960 24.439 41.648 45.887 1.00 0.00 H ATOM 38593 H12S OL 960 25.963 40.841 45.809 1.00 0.00 H ATOM 38594 C113 OL 960 24.351 39.656 44.873 1.00 0.00 C ATOM 38595 H13R OL 960 25.052 38.837 44.696 1.00 0.00 H ATOM 38596 H13S OL 960 23.386 39.245 45.176 1.00 0.00 H ATOM 38597 C114 OL 960 24.083 40.278 43.556 1.00 0.00 C ATOM 38598 H14R OL 960 25.001 40.493 43.004 1.00 0.00 H ATOM 38599 H14S OL 960 23.680 39.420 43.014 1.00 0.00 H ATOM 38600 C115 OL 960 23.350 41.612 43.411 1.00 0.00 C ATOM 38601 H15R OL 960 23.892 42.445 43.863 1.00 0.00 H ATOM 38602 H15S OL 960 23.280 41.923 42.366 1.00 0.00 H ATOM 38603 C116 OL 960 21.958 41.763 43.965 1.00 0.00 C ATOM 38604 H16R OL 960 21.430 40.838 43.725 1.00 0.00 H ATOM 38605 H16S OL 960 22.112 41.886 45.039 1.00 0.00 H ATOM 38606 C117 OL 960 21.254 43.011 43.543 1.00 0.00 C ATOM 38607 H17R OL 960 21.469 43.893 44.150 1.00 0.00 H ATOM 38608 H17S OL 960 21.454 43.390 42.539 1.00 0.00 H ATOM 38609 C118 OL 960 19.736 42.716 43.466 1.00 0.00 C ATOM 38610 H18R OL 960 19.591 41.939 42.713 1.00 0.00 H ATOM 38611 H18S OL 960 19.064 43.494 43.098 1.00 0.00 H ATOM 38612 H18T OL 960 19.251 42.502 44.420 1.00 0.00 H TER 38613 OL 960 ATOM 38613 C116 PA 961 131.545 135.115 42.181 1.00 0.00 C ATOM 38614 H16R PA 961 131.205 135.121 43.219 1.00 0.00 H ATOM 38615 H16S PA 961 130.639 134.901 41.610 1.00 0.00 H ATOM 38616 H16T PA 961 131.823 136.171 42.185 1.00 0.00 H ATOM 38617 C115 PA 961 132.715 134.157 41.850 1.00 0.00 C ATOM 38618 H15R PA 961 132.906 134.303 40.784 1.00 0.00 H ATOM 38619 H15S PA 961 132.316 133.160 42.046 1.00 0.00 H ATOM 38620 C114 PA 961 134.036 134.360 42.648 1.00 0.00 C ATOM 38621 H14R PA 961 134.479 135.307 42.331 1.00 0.00 H ATOM 38622 H14S PA 961 134.865 133.676 42.456 1.00 0.00 H ATOM 38623 C113 PA 961 133.872 134.181 44.203 1.00 0.00 C ATOM 38624 H13R PA 961 133.501 133.159 44.303 1.00 0.00 H ATOM 38625 H13S PA 961 133.100 134.814 44.646 1.00 0.00 H ATOM 38626 C112 PA 961 135.090 134.406 45.027 1.00 0.00 C ATOM 38627 H12R PA 961 135.100 135.490 45.160 1.00 0.00 H ATOM 38628 H12S PA 961 136.057 134.203 44.563 1.00 0.00 H ATOM 38629 C111 PA 961 135.053 133.936 46.458 1.00 0.00 C ATOM 38630 H11R PA 961 134.369 133.085 46.468 1.00 0.00 H ATOM 38631 H11S PA 961 134.640 134.781 47.014 1.00 0.00 H ATOM 38632 C110 PA 961 136.418 133.485 46.947 1.00 0.00 C ATOM 38633 H10R PA 961 136.892 134.448 47.147 1.00 0.00 H ATOM 38634 H10S PA 961 136.974 133.128 46.077 1.00 0.00 H ATOM 38635 C19 PA 961 136.454 132.700 48.223 1.00 0.00 C ATOM 38636 H9R PA 961 137.365 132.099 48.207 1.00 0.00 H ATOM 38637 H9S PA 961 135.672 131.946 48.336 1.00 0.00 H ATOM 38638 C18 PA 961 136.602 133.617 49.429 1.00 0.00 C ATOM 38639 H8R PA 961 135.706 134.193 49.669 1.00 0.00 H ATOM 38640 H8S PA 961 137.235 134.492 49.265 1.00 0.00 H ATOM 38641 C17 PA 961 137.132 132.910 50.674 1.00 0.00 C ATOM 38642 H7R PA 961 138.082 132.502 50.324 1.00 0.00 H ATOM 38643 H7S PA 961 136.339 132.197 50.909 1.00 0.00 H ATOM 38644 C16 PA 961 137.184 133.935 51.821 1.00 0.00 C ATOM 38645 H6R PA 961 136.135 134.176 52.005 1.00 0.00 H ATOM 38646 H6S PA 961 137.834 134.785 51.605 1.00 0.00 H ATOM 38647 C15 PA 961 137.813 133.321 53.081 1.00 0.00 C ATOM 38648 H5R PA 961 138.639 132.701 52.724 1.00 0.00 H ATOM 38649 H5S PA 961 137.160 132.571 53.533 1.00 0.00 H ATOM 38650 C14 PA 961 138.274 134.403 54.051 1.00 0.00 C ATOM 38651 H4R PA 961 138.640 135.335 53.614 1.00 0.00 H ATOM 38652 H4S PA 961 139.116 134.002 54.619 1.00 0.00 H ATOM 38653 C13 PA 961 137.336 134.953 55.098 1.00 0.00 C ATOM 38654 H3R PA 961 137.905 135.167 56.006 1.00 0.00 H ATOM 38655 H3S PA 961 136.514 134.265 55.307 1.00 0.00 H ATOM 38656 C12 PA 961 136.683 136.302 54.641 1.00 0.00 C ATOM 38657 H2R PA 961 136.104 136.039 53.753 1.00 0.00 H ATOM 38658 H2S PA 961 137.498 137.005 54.460 1.00 0.00 H ATOM 38659 C11 PGR 962 135.728 136.765 55.660 1.00 0.00 C ATOM 38660 O12 PGR 962 135.915 136.753 56.872 1.00 0.00 O ATOM 38661 O11 PGR 962 134.621 137.346 55.166 1.00 0.00 O ATOM 38662 C1 PGR 962 133.538 137.775 55.968 1.00 0.00 C ATOM 38663 HR PGR 962 133.239 136.945 56.612 1.00 0.00 H ATOM 38664 HS PGR 962 132.692 138.165 55.397 1.00 0.00 H ATOM 38665 C2 PGR 962 133.928 139.086 56.812 1.00 0.00 C ATOM 38666 HX PGR 962 134.659 138.892 57.601 1.00 0.00 H ATOM 38667 C3 PGR 962 132.669 139.696 57.545 1.00 0.00 C ATOM 38668 HA PGR 962 132.355 138.987 58.316 1.00 0.00 H ATOM 38669 HB PGR 962 131.831 139.798 56.850 1.00 0.00 H ATOM 38670 O31 PGR 962 133.050 140.977 58.079 1.00 0.00 O ATOM 38671 P31 PGR 962 132.081 141.635 59.135 1.00 0.00 P ATOM 38672 O32 PGR 962 131.160 142.638 58.279 1.00 0.00 O ATOM 38673 C31 PGR 962 129.936 142.222 57.831 1.00 0.00 C ATOM 38674 H1A PGR 962 129.256 141.990 58.655 1.00 0.00 H ATOM 38675 H1B PGR 962 130.128 141.294 57.286 1.00 0.00 H ATOM 38676 C32 PGR 962 129.376 143.414 56.987 1.00 0.00 C ATOM 38677 H2A PGR 962 130.092 143.791 56.252 1.00 0.00 H ATOM 38678 O35 PGR 962 128.977 144.449 57.933 1.00 0.00 O ATOM 38679 HO5A PGR 962 129.655 144.740 58.568 1.00 0.00 H ATOM 38680 C33 PGR 962 128.173 142.985 56.155 1.00 0.00 C ATOM 38681 H3A PGR 962 128.292 142.061 55.583 1.00 0.00 H ATOM 38682 H3B PGR 962 127.361 142.734 56.843 1.00 0.00 H ATOM 38683 O33 PGR 962 131.256 140.563 59.703 1.00 0.00 O ATOM 38684 O34 PGR 962 132.863 142.458 60.107 1.00 0.00 O ATOM 38685 O21 PGR 962 134.404 140.257 56.041 1.00 0.00 O ATOM 38686 C21 PGR 962 133.788 140.913 55.045 1.00 0.00 C ATOM 38687 O22 PGR 962 132.771 140.589 54.465 1.00 0.00 O ATOM 38688 O36 PGR 962 127.680 144.052 55.393 1.00 0.00 O ATOM 38689 HO6A PGR 962 128.352 144.276 54.725 1.00 0.00 H ATOM 38690 C12 OL 963 134.604 142.121 54.741 1.00 0.00 C ATOM 38691 H2R OL 963 134.546 142.890 55.515 1.00 0.00 H ATOM 38692 H2S OL 963 135.632 141.754 54.723 1.00 0.00 H ATOM 38693 C13 OL 963 134.301 142.748 53.386 1.00 0.00 C ATOM 38694 H3R OL 963 133.259 143.045 53.245 1.00 0.00 H ATOM 38695 H3S OL 963 134.822 143.703 53.288 1.00 0.00 H ATOM 38696 C14 OL 963 134.658 141.776 52.286 1.00 0.00 C ATOM 38697 H4R OL 963 135.677 141.391 52.355 1.00 0.00 H ATOM 38698 H4S OL 963 134.019 140.891 52.310 1.00 0.00 H ATOM 38699 C15 OL 963 134.583 142.312 50.883 1.00 0.00 C ATOM 38700 H5R OL 963 134.839 143.368 50.985 1.00 0.00 H ATOM 38701 H5S OL 963 135.365 141.896 50.244 1.00 0.00 H ATOM 38702 C16 OL 963 133.240 141.934 50.230 1.00 0.00 C ATOM 38703 H6R OL 963 133.152 140.859 50.054 1.00 0.00 H ATOM 38704 H6S OL 963 132.465 142.153 50.967 1.00 0.00 H ATOM 38705 C17 OL 963 132.941 142.696 48.963 1.00 0.00 C ATOM 38706 H7R OL 963 132.734 143.748 49.174 1.00 0.00 H ATOM 38707 H7S OL 963 133.718 142.739 48.197 1.00 0.00 H ATOM 38708 C18 OL 963 131.521 142.431 48.398 1.00 0.00 C ATOM 38709 H8R OL 963 131.436 141.343 48.357 1.00 0.00 H ATOM 38710 H8S OL 963 130.719 142.725 49.078 1.00 0.00 H ATOM 38711 C19 OL 963 131.309 143.006 47.013 1.00 0.00 C ATOM 38712 H9R OL 963 131.832 142.505 46.202 1.00 0.00 H ATOM 38713 C110 OL 963 130.562 144.077 46.640 1.00 0.00 C ATOM 38714 H10R OL 963 130.581 144.482 45.631 1.00 0.00 H ATOM 38715 C111 OL 963 129.778 144.953 47.587 1.00 0.00 C ATOM 38716 H11R OL 963 130.411 145.102 48.464 1.00 0.00 H ATOM 38717 H11S OL 963 129.672 145.955 47.165 1.00 0.00 H ATOM 38718 C112 OL 963 128.525 144.298 48.007 1.00 0.00 C ATOM 38719 H12R OL 963 127.859 144.205 47.146 1.00 0.00 H ATOM 38720 H12S OL 963 128.627 143.246 48.284 1.00 0.00 H ATOM 38721 C113 OL 963 127.768 145.004 49.045 1.00 0.00 C ATOM 38722 H13R OL 963 127.263 144.208 49.598 1.00 0.00 H ATOM 38723 H13S OL 963 128.440 145.453 49.779 1.00 0.00 H ATOM 38724 C114 OL 963 126.692 145.970 48.486 1.00 0.00 C ATOM 38725 H14R OL 963 127.196 146.610 47.758 1.00 0.00 H ATOM 38726 H14S OL 963 125.919 145.373 47.999 1.00 0.00 H ATOM 38727 C115 OL 963 126.320 147.146 49.413 1.00 0.00 C ATOM 38728 H15R OL 963 125.700 146.739 50.214 1.00 0.00 H ATOM 38729 H15S OL 963 127.165 147.639 49.899 1.00 0.00 H ATOM 38730 C116 OL 963 125.227 148.107 48.927 1.00 0.00 C ATOM 38731 H16R OL 963 125.206 149.061 49.457 1.00 0.00 H ATOM 38732 H16S OL 963 125.449 148.394 47.897 1.00 0.00 H ATOM 38733 C117 OL 963 123.862 147.397 48.940 1.00 0.00 C ATOM 38734 H17R OL 963 123.983 146.424 48.459 1.00 0.00 H ATOM 38735 H17S OL 963 123.485 147.146 49.934 1.00 0.00 H ATOM 38736 C118 OL 963 122.846 148.256 48.224 1.00 0.00 C ATOM 38737 H18R OL 963 121.881 147.744 48.226 1.00 0.00 H ATOM 38738 H18S OL 963 123.110 148.322 47.167 1.00 0.00 H ATOM 38739 H18T OL 963 122.851 149.244 48.688 1.00 0.00 H TER 38740 OL 963 ATOM 38740 C116 PA 964 12.730 17.484 44.332 1.00 0.00 C ATOM 38741 H16R PA 964 13.138 17.407 45.342 1.00 0.00 H ATOM 38742 H16S PA 964 13.531 17.370 43.599 1.00 0.00 H ATOM 38743 H16T PA 964 11.937 16.795 44.032 1.00 0.00 H ATOM 38744 C115 PA 964 12.229 18.945 44.263 1.00 0.00 C ATOM 38745 H15R PA 964 11.295 19.141 44.793 1.00 0.00 H ATOM 38746 H15S PA 964 11.994 19.120 43.211 1.00 0.00 H ATOM 38747 C114 PA 964 13.262 20.007 44.684 1.00 0.00 C ATOM 38748 H14R PA 964 14.112 20.016 43.998 1.00 0.00 H ATOM 38749 H14S PA 964 13.707 19.671 45.623 1.00 0.00 H ATOM 38750 C113 PA 964 12.607 21.426 44.657 1.00 0.00 C ATOM 38751 H13R PA 964 11.579 21.279 44.994 1.00 0.00 H ATOM 38752 H13S PA 964 12.397 21.818 43.659 1.00 0.00 H ATOM 38753 C112 PA 964 13.396 22.439 45.419 1.00 0.00 C ATOM 38754 H12R PA 964 14.388 22.407 44.964 1.00 0.00 H ATOM 38755 H12S PA 964 13.585 22.108 46.442 1.00 0.00 H ATOM 38756 C111 PA 964 12.736 23.832 45.484 1.00 0.00 C ATOM 38757 H11R PA 964 12.699 24.039 44.412 1.00 0.00 H ATOM 38758 H11S PA 964 13.498 24.545 45.804 1.00 0.00 H ATOM 38759 C110 PA 964 11.333 23.846 46.160 1.00 0.00 C ATOM 38760 H10R PA 964 10.888 22.924 45.781 1.00 0.00 H ATOM 38761 H10S PA 964 10.854 24.752 45.780 1.00 0.00 H ATOM 38762 C19 PA 964 11.356 23.827 47.654 1.00 0.00 C ATOM 38763 H9R PA 964 11.984 23.015 48.026 1.00 0.00 H ATOM 38764 H9S PA 964 10.331 23.564 47.921 1.00 0.00 H ATOM 38765 C18 PA 964 11.704 25.139 48.337 1.00 0.00 C ATOM 38766 H8R PA 964 10.983 25.904 48.038 1.00 0.00 H ATOM 38767 H8S PA 964 12.602 25.526 47.851 1.00 0.00 H ATOM 38768 C17 PA 964 11.781 24.963 49.851 1.00 0.00 C ATOM 38769 H7R PA 964 12.288 24.052 50.175 1.00 0.00 H ATOM 38770 H7S PA 964 10.778 24.743 50.223 1.00 0.00 H ATOM 38771 C16 PA 964 12.138 26.180 50.643 1.00 0.00 C ATOM 38772 H6R PA 964 11.521 27.002 50.275 1.00 0.00 H ATOM 38773 H6S PA 964 13.116 26.544 50.324 1.00 0.00 H ATOM 38774 C15 PA 964 12.128 26.027 52.147 1.00 0.00 C ATOM 38775 H5R PA 964 11.080 26.032 52.453 1.00 0.00 H ATOM 38776 H5S PA 964 12.470 26.982 52.551 1.00 0.00 H ATOM 38777 C14 PA 964 12.909 24.814 52.627 1.00 0.00 C ATOM 38778 H4R PA 964 13.959 24.774 52.332 1.00 0.00 H ATOM 38779 H4S PA 964 12.487 23.868 52.281 1.00 0.00 H ATOM 38780 C13 PA 964 12.819 24.829 54.169 1.00 0.00 C ATOM 38781 H3R PA 964 11.827 24.468 54.446 1.00 0.00 H ATOM 38782 H3S PA 964 12.856 25.851 54.550 1.00 0.00 H ATOM 38783 C12 PA 964 13.917 24.028 54.818 1.00 0.00 C ATOM 38784 H2R PA 964 14.844 24.427 54.401 1.00 0.00 H ATOM 38785 H2S PA 964 13.672 22.983 54.621 1.00 0.00 H ATOM 38786 C11 PGR 965 14.080 24.257 56.297 1.00 0.00 C ATOM 38787 O12 PGR 965 13.723 25.239 56.898 1.00 0.00 O ATOM 38788 O11 PGR 965 14.863 23.295 56.865 1.00 0.00 O ATOM 38789 C1 PGR 965 15.035 23.221 58.272 1.00 0.00 C ATOM 38790 HR PGR 965 15.365 24.224 58.553 1.00 0.00 H ATOM 38791 HS PGR 965 15.846 22.568 58.606 1.00 0.00 H ATOM 38792 C2 PGR 965 13.662 22.985 59.006 1.00 0.00 C ATOM 38793 HX PGR 965 13.002 23.823 58.766 1.00 0.00 H ATOM 38794 C3 PGR 965 13.903 22.728 60.510 1.00 0.00 C ATOM 38795 HA PGR 965 14.402 23.516 61.080 1.00 0.00 H ATOM 38796 HB PGR 965 14.454 21.791 60.621 1.00 0.00 H ATOM 38797 O31 PGR 965 12.585 22.448 61.062 1.00 0.00 O ATOM 38798 P31 PGR 965 12.325 22.362 62.605 1.00 0.00 P ATOM 38799 O32 PGR 965 12.395 23.936 63.053 1.00 0.00 O ATOM 38800 C31 PGR 965 12.125 24.270 64.343 1.00 0.00 C ATOM 38801 H1A PGR 965 12.534 25.246 64.614 1.00 0.00 H ATOM 38802 H1B PGR 965 12.522 23.544 65.058 1.00 0.00 H ATOM 38803 C32 PGR 965 10.561 24.304 64.626 1.00 0.00 C ATOM 38804 H2A PGR 965 10.140 23.442 64.102 1.00 0.00 H ATOM 38805 O35 PGR 965 10.019 25.499 64.075 1.00 0.00 O ATOM 38806 HO5A PGR 965 10.370 26.182 64.674 1.00 0.00 H ATOM 38807 C33 PGR 965 10.088 24.373 66.114 1.00 0.00 C ATOM 38808 H3A PGR 965 10.364 23.465 66.657 1.00 0.00 H ATOM 38809 H3B PGR 965 10.537 25.236 66.614 1.00 0.00 H ATOM 38810 O33 PGR 965 10.986 21.786 62.820 1.00 0.00 O ATOM 38811 O34 PGR 965 13.516 21.631 63.196 1.00 0.00 O ATOM 38812 O21 PGR 965 13.306 21.720 58.223 1.00 0.00 O ATOM 38813 C21 PGR 965 12.126 21.138 58.251 1.00 0.00 C ATOM 38814 O22 PGR 965 11.143 21.747 58.751 1.00 0.00 O ATOM 38815 O36 PGR 965 8.672 24.438 66.254 1.00 0.00 O ATOM 38816 HO6A PGR 965 8.382 23.588 65.878 1.00 0.00 H ATOM 38817 C12 OL 966 12.021 19.867 57.452 1.00 0.00 C ATOM 38818 H2R OL 966 12.522 19.048 57.972 1.00 0.00 H ATOM 38819 H2S OL 966 10.951 19.650 57.428 1.00 0.00 H ATOM 38820 C13 OL 966 12.522 20.029 56.019 1.00 0.00 C ATOM 38821 H3R OL 966 13.546 20.410 56.020 1.00 0.00 H ATOM 38822 H3S OL 966 12.702 19.023 55.635 1.00 0.00 H ATOM 38823 C14 OL 966 11.676 20.935 55.122 1.00 0.00 C ATOM 38824 H4R OL 966 10.624 20.665 55.239 1.00 0.00 H ATOM 38825 H4S OL 966 11.771 21.975 55.441 1.00 0.00 H ATOM 38826 C15 OL 966 11.962 20.849 53.604 1.00 0.00 C ATOM 38827 H5R OL 966 12.911 21.319 53.341 1.00 0.00 H ATOM 38828 H5S OL 966 11.907 19.796 53.323 1.00 0.00 H ATOM 38829 C16 OL 966 10.833 21.616 52.905 1.00 0.00 C ATOM 38830 H6R OL 966 9.931 21.016 53.046 1.00 0.00 H ATOM 38831 H6S OL 966 10.716 22.609 53.342 1.00 0.00 H ATOM 38832 C17 OL 966 11.155 21.797 51.403 1.00 0.00 C ATOM 38833 H7R OL 966 10.350 22.347 50.911 1.00 0.00 H ATOM 38834 H7S OL 966 12.027 22.378 51.097 1.00 0.00 H ATOM 38835 C18 OL 966 11.339 20.402 50.758 1.00 0.00 C ATOM 38836 H8R OL 966 12.218 19.813 51.026 1.00 0.00 H ATOM 38837 H8S OL 966 10.538 19.719 51.049 1.00 0.00 H ATOM 38838 C19 OL 966 11.264 20.506 49.202 1.00 0.00 C ATOM 38839 H9R OL 966 10.354 21.000 48.871 1.00 0.00 H ATOM 38840 C110 OL 966 11.930 19.822 48.240 1.00 0.00 C ATOM 38841 H10R OL 966 11.692 19.958 47.188 1.00 0.00 H ATOM 38842 C111 OL 966 13.096 18.910 48.432 1.00 0.00 C ATOM 38843 H11R OL 966 13.812 19.011 47.613 1.00 0.00 H ATOM 38844 H11S OL 966 13.642 19.267 49.307 1.00 0.00 H ATOM 38845 C112 OL 966 12.606 17.517 48.447 1.00 0.00 C ATOM 38846 H12R OL 966 12.032 17.273 47.550 1.00 0.00 H ATOM 38847 H12S OL 966 13.555 17.000 48.291 1.00 0.00 H ATOM 38848 C113 OL 966 11.901 17.101 49.665 1.00 0.00 C ATOM 38849 H13R OL 966 12.635 17.073 50.472 1.00 0.00 H ATOM 38850 H13S OL 966 11.042 17.741 49.877 1.00 0.00 H ATOM 38851 C114 OL 966 11.304 15.683 49.684 1.00 0.00 C ATOM 38852 H14R OL 966 10.517 15.617 48.930 1.00 0.00 H ATOM 38853 H14S OL 966 12.101 14.968 49.470 1.00 0.00 H ATOM 38854 C115 OL 966 10.537 15.292 50.942 1.00 0.00 C ATOM 38855 H15R OL 966 9.566 15.793 50.933 1.00 0.00 H ATOM 38856 H15S OL 966 10.234 14.243 50.923 1.00 0.00 H ATOM 38857 C116 OL 966 11.242 15.499 52.331 1.00 0.00 C ATOM 38858 H16R OL 966 11.420 16.574 52.412 1.00 0.00 H ATOM 38859 H16S OL 966 10.552 15.366 53.166 1.00 0.00 H ATOM 38860 C117 OL 966 12.479 14.689 52.432 1.00 0.00 C ATOM 38861 H17R OL 966 12.246 13.673 52.107 1.00 0.00 H ATOM 38862 H17S OL 966 13.187 14.988 51.655 1.00 0.00 H ATOM 38863 C118 OL 966 13.141 14.650 53.817 1.00 0.00 C ATOM 38864 H18R OL 966 13.611 13.671 53.934 1.00 0.00 H ATOM 38865 H18S OL 966 12.358 14.691 54.577 1.00 0.00 H ATOM 38866 H18T OL 966 13.980 15.331 53.973 1.00 0.00 H TER 38867 OL 966 ATOM 38867 C116 PA 967 5.570 9.716 39.254 1.00 0.00 C ATOM 38868 H16R PA 967 5.589 9.929 40.325 1.00 0.00 H ATOM 38869 H16S PA 967 5.802 10.595 38.649 1.00 0.00 H ATOM 38870 H16T PA 967 6.286 8.991 38.863 1.00 0.00 H ATOM 38871 C115 PA 967 4.194 9.240 38.989 1.00 0.00 C ATOM 38872 H15R PA 967 4.312 8.534 38.164 1.00 0.00 H ATOM 38873 H15S PA 967 3.584 10.007 38.507 1.00 0.00 H ATOM 38874 C114 PA 967 3.470 8.460 40.146 1.00 0.00 C ATOM 38875 H14R PA 967 4.156 7.840 40.726 1.00 0.00 H ATOM 38876 H14S PA 967 2.709 7.872 39.628 1.00 0.00 H ATOM 38877 C113 PA 967 2.612 9.449 41.042 1.00 0.00 C ATOM 38878 H13R PA 967 1.891 9.963 40.403 1.00 0.00 H ATOM 38879 H13S PA 967 3.273 10.240 41.404 1.00 0.00 H ATOM 38880 C112 PA 967 1.919 8.781 42.125 1.00 0.00 C ATOM 38881 H12R PA 967 2.653 8.211 42.698 1.00 0.00 H ATOM 38882 H12S PA 967 1.238 8.081 41.635 1.00 0.00 H ATOM 38883 C111 PA 967 1.162 9.678 43.025 1.00 0.00 C ATOM 38884 H11R PA 967 0.539 10.271 42.353 1.00 0.00 H ATOM 38885 H11S PA 967 1.797 10.442 43.479 1.00 0.00 H ATOM 38886 C110 PA 967 0.353 8.946 43.998 1.00 0.00 C ATOM 38887 H10R PA 967 0.942 8.617 44.857 1.00 0.00 H ATOM 38888 H10S PA 967 0.163 7.941 43.616 1.00 0.00 H ATOM 38889 C19 PA 967 -0.870 9.679 44.440 1.00 0.00 C ATOM 38890 H9R PA 967 -1.663 9.632 43.690 1.00 0.00 H ATOM 38891 H9S PA 967 -0.671 10.752 44.449 1.00 0.00 H ATOM 38892 C18 PA 967 -1.446 9.206 45.799 1.00 0.00 C ATOM 38893 H8R PA 967 -1.544 8.123 45.699 1.00 0.00 H ATOM 38894 H8S PA 967 -2.435 9.650 45.931 1.00 0.00 H ATOM 38895 C17 PA 967 -0.728 9.636 47.050 1.00 0.00 C ATOM 38896 H7R PA 967 -0.519 10.706 46.982 1.00 0.00 H ATOM 38897 H7S PA 967 0.187 9.039 47.049 1.00 0.00 H ATOM 38898 C16 PA 967 -1.604 9.412 48.397 1.00 0.00 C ATOM 38899 H6R PA 967 -1.861 8.380 48.644 1.00 0.00 H ATOM 38900 H6S PA 967 -2.565 9.915 48.264 1.00 0.00 H ATOM 38901 C15 PA 967 -1.103 10.080 49.652 1.00 0.00 C ATOM 38902 H5R PA 967 -1.120 11.168 49.561 1.00 0.00 H ATOM 38903 H5S PA 967 -0.078 9.706 49.696 1.00 0.00 H ATOM 38904 C14 PA 967 -1.856 9.654 50.964 1.00 0.00 C ATOM 38905 H4R PA 967 -1.992 8.571 50.932 1.00 0.00 H ATOM 38906 H4S PA 967 -2.852 10.079 50.828 1.00 0.00 H ATOM 38907 C13 PA 967 -1.218 10.102 52.326 1.00 0.00 C ATOM 38908 H3R PA 967 -0.240 9.672 52.549 1.00 0.00 H ATOM 38909 H3S PA 967 -1.844 9.650 53.098 1.00 0.00 H ATOM 38910 C12 PA 967 -1.299 11.634 52.648 1.00 0.00 C ATOM 38911 H2R PA 967 -2.348 11.884 52.817 1.00 0.00 H ATOM 38912 H2S PA 967 -0.943 12.271 51.836 1.00 0.00 H ATOM 38913 C11 PGR 968 -0.579 11.954 53.936 1.00 0.00 C ATOM 38914 O12 PGR 968 0.485 11.405 54.292 1.00 0.00 O ATOM 38915 O11 PGR 968 -1.071 13.183 54.490 1.00 0.00 O ATOM 38916 C1 PGR 968 -0.645 13.721 55.800 1.00 0.00 C ATOM 38917 HR PGR 968 -0.967 12.893 56.436 1.00 0.00 H ATOM 38918 HS PGR 968 -1.272 14.588 56.027 1.00 0.00 H ATOM 38919 C2 PGR 968 0.879 13.884 56.046 1.00 0.00 C ATOM 38920 HX PGR 968 1.191 12.888 56.371 1.00 0.00 H ATOM 38921 C3 PGR 968 1.193 14.898 57.147 1.00 0.00 C ATOM 38922 HA PGR 968 0.473 14.701 57.946 1.00 0.00 H ATOM 38923 HB PGR 968 0.960 15.930 56.874 1.00 0.00 H ATOM 38924 O31 PGR 968 2.472 14.700 57.579 1.00 0.00 O ATOM 38925 P31 PGR 968 3.044 15.458 58.935 1.00 0.00 P ATOM 38926 O32 PGR 968 3.673 16.852 58.504 1.00 0.00 O ATOM 38927 C31 PGR 968 3.318 18.086 59.158 1.00 0.00 C ATOM 38928 H1A PGR 968 3.457 17.967 60.236 1.00 0.00 H ATOM 38929 H1B PGR 968 2.237 18.159 59.014 1.00 0.00 H ATOM 38930 C32 PGR 968 3.914 19.373 58.530 1.00 0.00 C ATOM 38931 H2A PGR 968 3.675 20.270 59.108 1.00 0.00 H ATOM 38932 O35 PGR 968 3.483 19.640 57.219 1.00 0.00 O ATOM 38933 HO5A PGR 968 3.722 20.574 57.078 1.00 0.00 H ATOM 38934 C33 PGR 968 5.504 19.338 58.509 1.00 0.00 C ATOM 38935 H3A PGR 968 5.949 19.081 59.473 1.00 0.00 H ATOM 38936 H3B PGR 968 5.926 18.657 57.765 1.00 0.00 H ATOM 38937 O33 PGR 968 1.833 15.715 59.779 1.00 0.00 O ATOM 38938 O34 PGR 968 4.248 14.761 59.441 1.00 0.00 O ATOM 38939 O21 PGR 968 1.490 14.370 54.772 1.00 0.00 O ATOM 38940 C21 PGR 968 1.161 15.428 54.110 1.00 0.00 C ATOM 38941 O22 PGR 968 0.580 16.384 54.526 1.00 0.00 O ATOM 38942 O36 PGR 968 6.064 20.623 58.213 1.00 0.00 O ATOM 38943 HO6A PGR 968 5.495 21.303 58.617 1.00 0.00 H ATOM 38944 C12 OL 969 1.548 15.411 52.613 1.00 0.00 C ATOM 38945 H2R OL 969 0.696 15.621 51.964 1.00 0.00 H ATOM 38946 H2S OL 969 2.269 16.201 52.392 1.00 0.00 H ATOM 38947 C13 OL 969 2.087 14.096 52.122 1.00 0.00 C ATOM 38948 H3R OL 969 2.936 13.713 52.692 1.00 0.00 H ATOM 38949 H3S OL 969 1.335 13.352 52.395 1.00 0.00 H ATOM 38950 C14 OL 969 2.307 14.125 50.647 1.00 0.00 C ATOM 38951 H4R OL 969 1.478 14.651 50.167 1.00 0.00 H ATOM 38952 H4S OL 969 3.176 14.626 50.216 1.00 0.00 H ATOM 38953 C15 OL 969 2.293 12.749 49.969 1.00 0.00 C ATOM 38954 H5R OL 969 3.187 12.204 50.278 1.00 0.00 H ATOM 38955 H5S OL 969 1.363 12.198 50.122 1.00 0.00 H ATOM 38956 C16 OL 969 2.360 12.914 48.402 1.00 0.00 C ATOM 38957 H6R OL 969 1.383 13.244 48.043 1.00 0.00 H ATOM 38958 H6S OL 969 3.070 13.675 48.071 1.00 0.00 H ATOM 38959 C17 OL 969 2.671 11.609 47.737 1.00 0.00 C ATOM 38960 H7R OL 969 3.656 11.252 48.045 1.00 0.00 H ATOM 38961 H7S OL 969 1.905 10.927 48.111 1.00 0.00 H ATOM 38962 C18 OL 969 2.747 11.626 46.238 1.00 0.00 C ATOM 38963 H8R OL 969 2.626 10.634 45.799 1.00 0.00 H ATOM 38964 H8S OL 969 1.946 12.291 45.909 1.00 0.00 H ATOM 38965 C19 OL 969 4.023 12.291 45.817 1.00 0.00 C ATOM 38966 H9R OL 969 4.165 13.255 46.299 1.00 0.00 H ATOM 38967 C110 OL 969 4.811 11.965 44.793 1.00 0.00 C ATOM 38968 H10R OL 969 5.595 12.679 44.553 1.00 0.00 H ATOM 38969 C111 OL 969 4.649 10.801 43.838 1.00 0.00 C ATOM 38970 H11R OL 969 3.870 10.106 44.159 1.00 0.00 H ATOM 38971 H11S OL 969 4.346 11.264 42.897 1.00 0.00 H ATOM 38972 C112 OL 969 5.987 10.029 43.519 1.00 0.00 C ATOM 38973 H12R OL 969 5.675 9.267 42.802 1.00 0.00 H ATOM 38974 H12S OL 969 6.681 10.674 42.976 1.00 0.00 H ATOM 38975 C113 OL 969 6.642 9.470 44.723 1.00 0.00 C ATOM 38976 H13R OL 969 7.012 10.203 45.443 1.00 0.00 H ATOM 38977 H13S OL 969 5.982 8.844 45.328 1.00 0.00 H ATOM 38978 C114 OL 969 7.813 8.548 44.331 1.00 0.00 C ATOM 38979 H14R OL 969 7.463 7.898 43.526 1.00 0.00 H ATOM 38980 H14S OL 969 8.653 9.130 43.947 1.00 0.00 H ATOM 38981 C115 OL 969 8.477 7.748 45.466 1.00 0.00 C ATOM 38982 H15R OL 969 9.368 7.305 45.015 1.00 0.00 H ATOM 38983 H15S OL 969 8.801 8.368 46.304 1.00 0.00 H ATOM 38984 C116 OL 969 7.570 6.688 46.063 1.00 0.00 C ATOM 38985 H16R OL 969 6.760 6.605 45.335 1.00 0.00 H ATOM 38986 H16S OL 969 8.052 5.714 46.172 1.00 0.00 H ATOM 38987 C117 OL 969 6.780 7.108 47.304 1.00 0.00 C ATOM 38988 H17R OL 969 6.229 8.050 47.255 1.00 0.00 H ATOM 38989 H17S OL 969 6.022 6.359 47.541 1.00 0.00 H ATOM 38990 C118 OL 969 7.589 7.097 48.557 1.00 0.00 C ATOM 38991 H18R OL 969 8.340 7.887 48.624 1.00 0.00 H ATOM 38992 H18S OL 969 8.049 6.123 48.736 1.00 0.00 H ATOM 38993 H18T OL 969 7.032 7.286 49.477 1.00 0.00 H TER 38994 OL 969 ATOM 38994 C116 PA 970 147.848 116.915 41.268 1.00 0.00 C ATOM 38995 H16R PA 970 147.001 117.095 40.603 1.00 0.00 H ATOM 38996 H16S PA 970 148.032 115.839 41.234 1.00 0.00 H ATOM 38997 H16T PA 970 148.652 117.441 40.749 1.00 0.00 H ATOM 38998 C115 PA 970 147.606 117.478 42.671 1.00 0.00 C ATOM 38999 H15R PA 970 146.809 116.848 43.071 1.00 0.00 H ATOM 39000 H15S PA 970 147.217 118.496 42.593 1.00 0.00 H ATOM 39001 C114 PA 970 148.734 117.307 43.665 1.00 0.00 C ATOM 39002 H14R PA 970 149.604 117.844 43.280 1.00 0.00 H ATOM 39003 H14S PA 970 148.963 116.240 43.645 1.00 0.00 H ATOM 39004 C113 PA 970 148.435 117.839 45.018 1.00 0.00 C ATOM 39005 H13R PA 970 147.506 117.416 45.407 1.00 0.00 H ATOM 39006 H13S PA 970 148.342 118.922 45.124 1.00 0.00 H ATOM 39007 C112 PA 970 149.525 117.487 46.043 1.00 0.00 C ATOM 39008 H12R PA 970 150.476 117.941 45.755 1.00 0.00 H ATOM 39009 H12S PA 970 149.541 116.401 45.932 1.00 0.00 H ATOM 39010 C111 PA 970 149.264 117.702 47.628 1.00 0.00 C ATOM 39011 H11R PA 970 150.238 117.530 48.092 1.00 0.00 H ATOM 39012 H11S PA 970 148.585 116.920 47.973 1.00 0.00 H ATOM 39013 C110 PA 970 148.763 119.073 47.991 1.00 0.00 C ATOM 39014 H10R PA 970 147.833 119.357 47.494 1.00 0.00 H ATOM 39015 H10S PA 970 149.481 119.725 47.490 1.00 0.00 H ATOM 39016 C19 PA 970 148.708 119.316 49.529 1.00 0.00 C ATOM 39017 H9R PA 970 149.731 119.205 49.896 1.00 0.00 H ATOM 39018 H9S PA 970 148.159 118.574 50.113 1.00 0.00 H ATOM 39019 C18 PA 970 148.076 120.642 49.878 1.00 0.00 C ATOM 39020 H8R PA 970 148.519 121.465 49.312 1.00 0.00 H ATOM 39021 H8S PA 970 148.216 120.853 50.940 1.00 0.00 H ATOM 39022 C17 PA 970 146.564 120.623 49.470 1.00 0.00 C ATOM 39023 H7R PA 970 146.213 119.623 49.734 1.00 0.00 H ATOM 39024 H7S PA 970 146.392 120.811 48.408 1.00 0.00 H ATOM 39025 C16 PA 970 145.749 121.648 50.323 1.00 0.00 C ATOM 39026 H6R PA 970 144.850 122.015 49.824 1.00 0.00 H ATOM 39027 H6S PA 970 146.345 122.551 50.178 1.00 0.00 H ATOM 39028 C15 PA 970 145.539 121.375 51.819 1.00 0.00 C ATOM 39029 H5R PA 970 144.825 122.108 52.198 1.00 0.00 H ATOM 39030 H5S PA 970 146.468 121.425 52.392 1.00 0.00 H ATOM 39031 C14 PA 970 144.924 120.012 52.204 1.00 0.00 C ATOM 39032 H4R PA 970 145.575 119.250 51.770 1.00 0.00 H ATOM 39033 H4S PA 970 143.939 120.017 51.733 1.00 0.00 H ATOM 39034 C13 PA 970 144.726 119.921 53.728 1.00 0.00 C ATOM 39035 H3R PA 970 144.415 120.874 54.162 1.00 0.00 H ATOM 39036 H3S PA 970 145.692 119.592 54.114 1.00 0.00 H ATOM 39037 C12 PA 970 143.668 118.957 54.281 1.00 0.00 C ATOM 39038 H2R PA 970 143.849 117.972 53.847 1.00 0.00 H ATOM 39039 H2S PA 970 142.625 119.227 54.106 1.00 0.00 H ATOM 39040 C11 PGR 971 143.831 118.748 55.762 1.00 0.00 C ATOM 39041 O12 PGR 971 144.156 119.572 56.603 1.00 0.00 O ATOM 39042 O11 PGR 971 143.542 117.450 56.155 1.00 0.00 O ATOM 39043 C1 PGR 971 143.657 117.040 57.549 1.00 0.00 C ATOM 39044 HR PGR 971 144.633 117.297 57.969 1.00 0.00 H ATOM 39045 HS PGR 971 143.473 115.962 57.548 1.00 0.00 H ATOM 39046 C2 PGR 971 142.671 117.734 58.466 1.00 0.00 C ATOM 39047 HX PGR 971 142.634 118.819 58.332 1.00 0.00 H ATOM 39048 C3 PGR 971 142.985 117.388 59.913 1.00 0.00 C ATOM 39049 HA PGR 971 144.055 117.541 60.071 1.00 0.00 H ATOM 39050 HB PGR 971 142.638 116.381 60.158 1.00 0.00 H ATOM 39051 O31 PGR 971 142.303 118.322 60.787 1.00 0.00 O ATOM 39052 P31 PGR 971 142.475 118.253 62.401 1.00 0.00 P ATOM 39053 O32 PGR 971 143.966 118.729 62.720 1.00 0.00 O ATOM 39054 C31 PGR 971 144.303 120.077 62.583 1.00 0.00 C ATOM 39055 H1A PGR 971 143.663 120.775 63.128 1.00 0.00 H ATOM 39056 H1B PGR 971 144.347 120.318 61.518 1.00 0.00 H ATOM 39057 C32 PGR 971 145.747 120.390 63.131 1.00 0.00 C ATOM 39058 H2A PGR 971 146.004 121.408 62.828 1.00 0.00 H ATOM 39059 O35 PGR 971 146.596 119.517 62.423 1.00 0.00 O ATOM 39060 HO5A PGR 971 147.542 119.634 62.622 1.00 0.00 H ATOM 39061 C33 PGR 971 145.960 120.269 64.688 1.00 0.00 C ATOM 39062 H3A PGR 971 145.643 121.147 65.257 1.00 0.00 H ATOM 39063 H3B PGR 971 145.357 119.452 65.094 1.00 0.00 H ATOM 39064 O33 PGR 971 141.646 119.302 63.008 1.00 0.00 O ATOM 39065 O34 PGR 971 142.318 116.840 62.844 1.00 0.00 O ATOM 39066 O21 PGR 971 141.338 117.121 58.200 1.00 0.00 O ATOM 39067 C21 PGR 971 140.550 117.668 57.272 1.00 0.00 C ATOM 39068 O22 PGR 971 140.768 118.734 56.678 1.00 0.00 O ATOM 39069 O36 PGR 971 147.367 119.895 65.028 1.00 0.00 O ATOM 39070 HO6A PGR 971 148.042 120.467 64.621 1.00 0.00 H ATOM 39071 C12 OL 972 139.394 116.755 56.959 1.00 0.00 C ATOM 39072 H2R OL 972 139.209 116.079 57.796 1.00 0.00 H ATOM 39073 H2S OL 972 138.517 117.403 57.007 1.00 0.00 H ATOM 39074 C13 OL 972 139.532 116.119 55.631 1.00 0.00 C ATOM 39075 H3R OL 972 139.727 116.931 54.927 1.00 0.00 H ATOM 39076 H3S OL 972 140.426 115.506 55.763 1.00 0.00 H ATOM 39077 C14 OL 972 138.335 115.322 55.249 1.00 0.00 C ATOM 39078 H4R OL 972 138.163 114.515 55.965 1.00 0.00 H ATOM 39079 H4S OL 972 137.467 115.984 55.243 1.00 0.00 H ATOM 39080 C15 OL 972 138.475 114.642 53.899 1.00 0.00 C ATOM 39081 H5R OL 972 138.791 115.398 53.177 1.00 0.00 H ATOM 39082 H5S OL 972 139.253 113.878 53.944 1.00 0.00 H ATOM 39083 C16 OL 972 137.266 113.825 53.406 1.00 0.00 C ATOM 39084 H6R OL 972 137.159 113.019 54.135 1.00 0.00 H ATOM 39085 H6S OL 972 136.365 114.417 53.582 1.00 0.00 H ATOM 39086 C17 OL 972 137.507 113.125 52.057 1.00 0.00 C ATOM 39087 H7R OL 972 137.750 113.818 51.249 1.00 0.00 H ATOM 39088 H7S OL 972 138.337 112.423 52.156 1.00 0.00 H ATOM 39089 C18 OL 972 136.256 112.312 51.656 1.00 0.00 C ATOM 39090 H8R OL 972 135.478 113.077 51.711 1.00 0.00 H ATOM 39091 H8S OL 972 136.259 112.133 50.578 1.00 0.00 H ATOM 39092 C19 OL 972 135.932 111.097 52.485 1.00 0.00 C ATOM 39093 H9R OL 972 135.181 111.146 53.269 1.00 0.00 H ATOM 39094 C110 OL 972 136.294 109.839 52.259 1.00 0.00 C ATOM 39095 H10R OL 972 135.932 109.132 53.000 1.00 0.00 H ATOM 39096 C111 OL 972 137.324 109.365 51.252 1.00 0.00 C ATOM 39097 H11R OL 972 137.670 110.194 50.633 1.00 0.00 H ATOM 39098 H11S OL 972 138.153 108.884 51.776 1.00 0.00 H ATOM 39099 C112 OL 972 136.730 108.103 50.471 1.00 0.00 C ATOM 39100 H12R OL 972 136.809 107.233 51.126 1.00 0.00 H ATOM 39101 H12S OL 972 135.661 108.225 50.282 1.00 0.00 H ATOM 39102 C113 OL 972 137.370 107.714 49.183 1.00 0.00 C ATOM 39103 H13R OL 972 136.997 108.386 48.407 1.00 0.00 H ATOM 39104 H13S OL 972 138.449 107.704 49.350 1.00 0.00 H ATOM 39105 C114 OL 972 137.043 106.347 48.632 1.00 0.00 C ATOM 39106 H14R OL 972 137.529 105.534 49.174 1.00 0.00 H ATOM 39107 H14S OL 972 135.952 106.319 48.682 1.00 0.00 H ATOM 39108 C115 OL 972 137.469 106.279 47.154 1.00 0.00 C ATOM 39109 H15R OL 972 136.891 106.959 46.525 1.00 0.00 H ATOM 39110 H15S OL 972 138.471 106.661 46.947 1.00 0.00 H ATOM 39111 C116 OL 972 137.355 104.865 46.705 1.00 0.00 C ATOM 39112 H16R OL 972 137.977 104.279 47.384 1.00 0.00 H ATOM 39113 H16S OL 972 136.316 104.556 46.840 1.00 0.00 H ATOM 39114 C117 OL 972 137.801 104.574 45.322 1.00 0.00 C ATOM 39115 H17R OL 972 137.175 105.135 44.625 1.00 0.00 H ATOM 39116 H17S OL 972 138.866 104.801 45.235 1.00 0.00 H ATOM 39117 C118 OL 972 137.774 103.070 44.984 1.00 0.00 C ATOM 39118 H18R OL 972 138.150 102.871 43.979 1.00 0.00 H ATOM 39119 H18S OL 972 136.731 102.756 45.057 1.00 0.00 H ATOM 39120 H18T OL 972 138.418 102.513 45.668 1.00 0.00 H TER 39121 OL 972 ATOM 39121 C116 PA 973 135.318 6.051 40.372 1.00 0.00 C ATOM 39122 H16R PA 973 135.220 5.045 40.785 1.00 0.00 H ATOM 39123 H16S PA 973 136.273 6.467 40.700 1.00 0.00 H ATOM 39124 H16T PA 973 135.344 5.826 39.304 1.00 0.00 H ATOM 39125 C115 PA 973 134.105 6.850 40.702 1.00 0.00 C ATOM 39126 H15R PA 973 133.270 6.448 40.125 1.00 0.00 H ATOM 39127 H15S PA 973 134.256 7.876 40.357 1.00 0.00 H ATOM 39128 C114 PA 973 133.683 6.975 42.213 1.00 0.00 C ATOM 39129 H14R PA 973 133.051 6.106 42.408 1.00 0.00 H ATOM 39130 H14S PA 973 133.133 7.890 42.442 1.00 0.00 H ATOM 39131 C113 PA 973 134.896 6.836 43.206 1.00 0.00 C ATOM 39132 H13R PA 973 135.534 7.719 43.128 1.00 0.00 H ATOM 39133 H13S PA 973 135.445 5.899 43.091 1.00 0.00 H ATOM 39134 C112 PA 973 134.308 6.872 44.617 1.00 0.00 C ATOM 39135 H12R PA 973 133.671 5.986 44.638 1.00 0.00 H ATOM 39136 H12S PA 973 133.720 7.759 44.862 1.00 0.00 H ATOM 39137 C111 PA 973 135.360 6.786 45.724 1.00 0.00 C ATOM 39138 H11R PA 973 136.001 7.668 45.669 1.00 0.00 H ATOM 39139 H11S PA 973 135.968 5.892 45.570 1.00 0.00 H ATOM 39140 C110 PA 973 134.912 6.788 47.109 1.00 0.00 C ATOM 39141 H10R PA 973 134.157 6.038 47.355 1.00 0.00 H ATOM 39142 H10S PA 973 134.442 7.717 47.438 1.00 0.00 H ATOM 39143 C19 PA 973 136.088 6.572 48.073 1.00 0.00 C ATOM 39144 H9R PA 973 136.907 7.252 47.831 1.00 0.00 H ATOM 39145 H9S PA 973 136.424 5.534 48.021 1.00 0.00 H ATOM 39146 C18 PA 973 135.779 6.837 49.562 1.00 0.00 C ATOM 39147 H8R PA 973 135.525 7.879 49.766 1.00 0.00 H ATOM 39148 H8S PA 973 136.635 6.620 50.203 1.00 0.00 H ATOM 39149 C17 PA 973 134.593 6.055 50.210 1.00 0.00 C ATOM 39150 H7R PA 973 134.869 5.939 51.260 1.00 0.00 H ATOM 39151 H7S PA 973 134.561 5.022 49.858 1.00 0.00 H ATOM 39152 C16 PA 973 133.246 6.696 50.154 1.00 0.00 C ATOM 39153 H6R PA 973 132.505 5.990 50.534 1.00 0.00 H ATOM 39154 H6S PA 973 133.084 6.889 49.092 1.00 0.00 H ATOM 39155 C15 PA 973 133.213 8.016 51.045 1.00 0.00 C ATOM 39156 H5R PA 973 133.982 8.710 50.700 1.00 0.00 H ATOM 39157 H5S PA 973 133.471 7.807 52.085 1.00 0.00 H ATOM 39158 C14 PA 973 131.864 8.784 50.946 1.00 0.00 C ATOM 39159 H4R PA 973 131.686 9.189 49.947 1.00 0.00 H ATOM 39160 H4S PA 973 131.845 9.718 51.512 1.00 0.00 H ATOM 39161 C13 PA 973 130.646 7.906 51.242 1.00 0.00 C ATOM 39162 H3R PA 973 130.410 7.235 50.414 1.00 0.00 H ATOM 39163 H3S PA 973 129.880 8.682 51.191 1.00 0.00 H ATOM 39164 C12 PA 973 130.580 7.127 52.677 1.00 0.00 C ATOM 39165 H2R PA 973 131.230 6.252 52.606 1.00 0.00 H ATOM 39166 H2S PA 973 129.539 6.804 52.751 1.00 0.00 H ATOM 39167 C11 PGR 974 130.892 8.006 53.818 1.00 0.00 C ATOM 39168 O12 PGR 974 131.991 8.164 54.330 1.00 0.00 O ATOM 39169 O11 PGR 974 129.757 8.669 54.200 1.00 0.00 O ATOM 39170 C1 PGR 974 129.884 9.754 55.118 1.00 0.00 C ATOM 39171 HR PGR 974 130.381 9.434 56.037 1.00 0.00 H ATOM 39172 HS PGR 974 128.859 10.076 55.320 1.00 0.00 H ATOM 39173 C2 PGR 974 130.786 10.898 54.658 1.00 0.00 C ATOM 39174 HX PGR 974 131.818 10.591 54.850 1.00 0.00 H ATOM 39175 C3 PGR 974 130.556 12.210 55.530 1.00 0.00 C ATOM 39176 HA PGR 974 130.832 13.036 54.870 1.00 0.00 H ATOM 39177 HB PGR 974 131.148 12.213 56.449 1.00 0.00 H ATOM 39178 O31 PGR 974 129.191 12.358 55.888 1.00 0.00 O ATOM 39179 P31 PGR 974 128.466 13.644 56.586 1.00 0.00 P ATOM 39180 O32 PGR 974 128.405 13.375 58.201 1.00 0.00 O ATOM 39181 C31 PGR 974 127.767 12.248 58.885 1.00 0.00 C ATOM 39182 H1A PGR 974 128.247 11.367 58.451 1.00 0.00 H ATOM 39183 H1B PGR 974 126.722 12.137 58.584 1.00 0.00 H ATOM 39184 C32 PGR 974 127.965 12.373 60.408 1.00 0.00 C ATOM 39185 H2A PGR 974 127.638 11.402 60.789 1.00 0.00 H ATOM 39186 O35 PGR 974 127.067 13.365 60.881 1.00 0.00 O ATOM 39187 HO5A PGR 974 126.712 13.045 61.729 1.00 0.00 H ATOM 39188 C33 PGR 974 129.421 12.668 60.734 1.00 0.00 C ATOM 39189 H3A PGR 974 130.155 12.011 60.260 1.00 0.00 H ATOM 39190 H3B PGR 974 129.615 13.720 60.513 1.00 0.00 H ATOM 39191 O33 PGR 974 129.319 14.860 56.315 1.00 0.00 O ATOM 39192 O34 PGR 974 127.064 13.747 56.230 1.00 0.00 O ATOM 39193 O21 PGR 974 130.516 11.201 53.269 1.00 0.00 O ATOM 39194 C21 PGR 974 129.337 11.523 52.677 1.00 0.00 C ATOM 39195 O22 PGR 974 128.292 11.518 53.262 1.00 0.00 O ATOM 39196 O36 PGR 974 129.535 12.433 62.163 1.00 0.00 O ATOM 39197 HO6A PGR 974 130.490 12.536 62.321 1.00 0.00 H ATOM 39198 C12 OL 975 129.587 12.119 51.302 1.00 0.00 C ATOM 39199 H2R OL 975 130.081 13.090 51.381 1.00 0.00 H ATOM 39200 H2S OL 975 130.287 11.442 50.808 1.00 0.00 H ATOM 39201 C13 OL 975 128.315 12.229 50.443 1.00 0.00 C ATOM 39202 H3R OL 975 127.588 11.444 50.659 1.00 0.00 H ATOM 39203 H3S OL 975 127.809 13.102 50.860 1.00 0.00 H ATOM 39204 C14 OL 975 128.536 12.469 49.045 1.00 0.00 C ATOM 39205 H4R OL 975 127.549 12.525 48.581 1.00 0.00 H ATOM 39206 H4S OL 975 129.142 13.349 48.818 1.00 0.00 H ATOM 39207 C15 OL 975 129.285 11.348 48.217 1.00 0.00 C ATOM 39208 H5R OL 975 129.360 11.583 47.154 1.00 0.00 H ATOM 39209 H5S OL 975 130.339 11.380 48.499 1.00 0.00 H ATOM 39210 C16 OL 975 128.693 9.922 48.396 1.00 0.00 C ATOM 39211 H6R OL 975 128.807 9.603 49.433 1.00 0.00 H ATOM 39212 H6S OL 975 127.629 9.940 48.150 1.00 0.00 H ATOM 39213 C17 OL 975 129.349 8.893 47.433 1.00 0.00 C ATOM 39214 H7R OL 975 130.375 8.692 47.748 1.00 0.00 H ATOM 39215 H7S OL 975 128.814 7.962 47.632 1.00 0.00 H ATOM 39216 C18 OL 975 129.448 9.202 45.969 1.00 0.00 C ATOM 39217 H8R OL 975 128.457 9.199 45.511 1.00 0.00 H ATOM 39218 H8S OL 975 129.802 10.224 45.817 1.00 0.00 H ATOM 39219 C19 OL 975 130.400 8.188 45.413 1.00 0.00 C ATOM 39220 H9R OL 975 131.449 8.187 45.696 1.00 0.00 H ATOM 39221 C110 OL 975 130.159 7.350 44.459 1.00 0.00 C ATOM 39222 H10R OL 975 130.984 6.749 44.083 1.00 0.00 H ATOM 39223 C111 OL 975 128.800 7.101 43.761 1.00 0.00 C ATOM 39224 H11R OL 975 128.204 6.364 44.303 1.00 0.00 H ATOM 39225 H11S OL 975 128.189 8.005 43.713 1.00 0.00 H ATOM 39226 C112 OL 975 129.015 6.603 42.297 1.00 0.00 C ATOM 39227 H12R OL 975 129.606 7.392 41.826 1.00 0.00 H ATOM 39228 H12S OL 975 129.501 5.633 42.169 1.00 0.00 H ATOM 39229 C113 OL 975 127.694 6.446 41.529 1.00 0.00 C ATOM 39230 H13R OL 975 127.912 5.898 40.610 1.00 0.00 H ATOM 39231 H13S OL 975 127.013 5.805 42.093 1.00 0.00 H ATOM 39232 C114 OL 975 126.952 7.795 41.329 1.00 0.00 C ATOM 39233 H14R OL 975 126.315 8.070 42.173 1.00 0.00 H ATOM 39234 H14S OL 975 127.656 8.621 41.207 1.00 0.00 H ATOM 39235 C115 OL 975 126.107 7.765 40.104 1.00 0.00 C ATOM 39236 H15R OL 975 126.680 7.506 39.211 1.00 0.00 H ATOM 39237 H15S OL 975 125.346 6.982 40.105 1.00 0.00 H ATOM 39238 C116 OL 975 125.263 9.060 39.949 1.00 0.00 C ATOM 39239 H16R OL 975 124.418 9.037 40.641 1.00 0.00 H ATOM 39240 H16S OL 975 125.750 10.022 40.119 1.00 0.00 H ATOM 39241 C117 OL 975 124.722 9.229 38.591 1.00 0.00 C ATOM 39242 H17R OL 975 125.522 9.094 37.861 1.00 0.00 H ATOM 39243 H17S OL 975 123.932 8.490 38.437 1.00 0.00 H ATOM 39244 C118 OL 975 123.957 10.491 38.350 1.00 0.00 C ATOM 39245 H18R OL 975 123.917 10.662 37.272 1.00 0.00 H ATOM 39246 H18S OL 975 124.543 11.314 38.766 1.00 0.00 H ATOM 39247 H18T OL 975 122.952 10.492 38.776 1.00 0.00 H TER 39248 OL 975 ATOM 39248 C116 PA 976 42.642 86.009 42.438 1.00 0.00 C ATOM 39249 H16R PA 976 42.934 86.969 42.007 1.00 0.00 H ATOM 39250 H16S PA 976 41.571 85.895 42.255 1.00 0.00 H ATOM 39251 H16T PA 976 43.112 85.223 41.843 1.00 0.00 H ATOM 39252 C115 PA 976 43.143 86.032 43.886 1.00 0.00 C ATOM 39253 H15R PA 976 44.176 85.688 43.969 1.00 0.00 H ATOM 39254 H15S PA 976 42.570 85.214 44.327 1.00 0.00 H ATOM 39255 C114 PA 976 42.785 87.374 44.598 1.00 0.00 C ATOM 39256 H14R PA 976 41.750 87.645 44.378 1.00 0.00 H ATOM 39257 H14S PA 976 43.485 88.132 44.241 1.00 0.00 H ATOM 39258 C113 PA 976 42.901 87.404 46.136 1.00 0.00 C ATOM 39259 H13R PA 976 43.850 86.880 46.270 1.00 0.00 H ATOM 39260 H13S PA 976 42.178 86.692 46.539 1.00 0.00 H ATOM 39261 C112 PA 976 42.824 88.807 46.767 1.00 0.00 C ATOM 39262 H12R PA 976 41.961 89.349 46.375 1.00 0.00 H ATOM 39263 H12S PA 976 43.708 89.201 46.263 1.00 0.00 H ATOM 39264 C111 PA 976 42.778 88.731 48.294 1.00 0.00 C ATOM 39265 H11R PA 976 43.847 88.633 48.495 1.00 0.00 H ATOM 39266 H11S PA 976 42.294 87.801 48.602 1.00 0.00 H ATOM 39267 C110 PA 976 42.189 89.975 48.958 1.00 0.00 C ATOM 39268 H10R PA 976 42.738 90.823 48.543 1.00 0.00 H ATOM 39269 H10S PA 976 42.520 89.991 49.999 1.00 0.00 H ATOM 39270 C19 PA 976 40.648 90.075 48.911 1.00 0.00 C ATOM 39271 H9R PA 976 40.231 89.173 49.363 1.00 0.00 H ATOM 39272 H9S PA 976 40.299 90.084 47.877 1.00 0.00 H ATOM 39273 C18 PA 976 40.234 91.249 49.808 1.00 0.00 C ATOM 39274 H8R PA 976 40.437 90.985 50.848 1.00 0.00 H ATOM 39275 H8S PA 976 39.148 91.366 49.804 1.00 0.00 H ATOM 39276 C17 PA 976 40.791 92.583 49.409 1.00 0.00 C ATOM 39277 H7R PA 976 40.497 92.871 48.398 1.00 0.00 H ATOM 39278 H7S PA 976 41.882 92.630 49.431 1.00 0.00 H ATOM 39279 C16 PA 976 40.273 93.702 50.284 1.00 0.00 C ATOM 39280 H6R PA 976 40.689 94.614 49.852 1.00 0.00 H ATOM 39281 H6S PA 976 40.808 93.483 51.211 1.00 0.00 H ATOM 39282 C15 PA 976 38.817 93.935 50.473 1.00 0.00 C ATOM 39283 H5R PA 976 38.356 93.139 51.062 1.00 0.00 H ATOM 39284 H5S PA 976 38.430 93.758 49.467 1.00 0.00 H ATOM 39285 C14 PA 976 38.436 95.224 51.085 1.00 0.00 C ATOM 39286 H4R PA 976 39.016 96.077 50.725 1.00 0.00 H ATOM 39287 H4S PA 976 38.630 95.237 52.159 1.00 0.00 H ATOM 39288 C13 PA 976 37.019 95.568 50.898 1.00 0.00 C ATOM 39289 H3R PA 976 36.882 95.781 49.836 1.00 0.00 H ATOM 39290 H3S PA 976 36.799 96.487 51.445 1.00 0.00 H ATOM 39291 C12 PA 976 36.003 94.464 51.224 1.00 0.00 C ATOM 39292 H2R PA 976 36.042 93.554 50.621 1.00 0.00 H ATOM 39293 H2S PA 976 34.998 94.850 51.044 1.00 0.00 H ATOM 39294 C11 PC 977 35.974 94.140 52.646 1.00 0.00 C ATOM 39295 O12 PC 977 36.987 93.924 53.252 1.00 0.00 O ATOM 39296 O11 PC 977 34.719 93.952 53.024 1.00 0.00 O ATOM 39297 C1 PC 977 34.488 93.886 54.451 1.00 0.00 C ATOM 39298 HR PC 977 33.582 94.446 54.695 1.00 0.00 H ATOM 39299 HS PC 977 35.343 94.203 55.053 1.00 0.00 H ATOM 39300 C2 PC 977 34.245 92.429 54.809 1.00 0.00 C ATOM 39301 HX PC 977 33.350 92.129 54.257 1.00 0.00 H ATOM 39302 C3 PC 977 33.896 92.199 56.310 1.00 0.00 C ATOM 39303 HA PC 977 33.359 91.254 56.425 1.00 0.00 H ATOM 39304 HB PC 977 33.243 92.961 56.744 1.00 0.00 H ATOM 39305 O31 PC 977 35.023 92.247 57.189 1.00 0.00 O ATOM 39306 P31 PC 977 34.987 92.499 58.817 1.00 0.00 P ATOM 39307 O32 PC 977 34.793 91.055 59.393 1.00 0.00 O ATOM 39308 C31 PC 977 34.199 90.843 60.624 1.00 0.00 C ATOM 39309 H1A PC 977 33.186 91.243 60.532 1.00 0.00 H ATOM 39310 H1B PC 977 34.801 91.393 61.352 1.00 0.00 H ATOM 39311 C32 PC 977 34.197 89.342 60.807 1.00 0.00 C ATOM 39312 H2A PC 977 35.191 88.940 61.004 1.00 0.00 H ATOM 39313 H2B PC 977 33.818 88.957 59.859 1.00 0.00 H ATOM 39314 N31 PC 977 33.298 88.777 61.862 1.00 0.00 N ATOM 39315 C33 PC 977 31.864 89.017 61.583 1.00 0.00 C ATOM 39316 H3A PC 977 31.387 88.509 62.422 1.00 0.00 H ATOM 39317 H3B PC 977 31.573 88.714 60.577 1.00 0.00 H ATOM 39318 H3C PC 977 31.647 90.073 61.754 1.00 0.00 H ATOM 39319 C34 PC 977 33.560 87.308 61.982 1.00 0.00 C ATOM 39320 H4A PC 977 33.020 86.911 61.121 1.00 0.00 H ATOM 39321 H4B PC 977 33.109 87.008 62.929 1.00 0.00 H ATOM 39322 H4C PC 977 34.620 87.103 61.827 1.00 0.00 H ATOM 39323 C35 PC 977 33.682 89.354 63.144 1.00 0.00 C ATOM 39324 H5A PC 977 33.514 90.424 63.011 1.00 0.00 H ATOM 39325 H5B PC 977 34.734 89.138 63.335 1.00 0.00 H ATOM 39326 H5C PC 977 33.050 88.867 63.888 1.00 0.00 H ATOM 39327 O33 PC 977 36.352 93.021 59.137 1.00 0.00 O ATOM 39328 O34 PC 977 33.852 93.349 59.263 1.00 0.00 O ATOM 39329 O21 PC 977 35.385 91.680 54.309 1.00 0.00 O ATOM 39330 C21 PC 977 35.313 90.343 54.243 1.00 0.00 C ATOM 39331 O22 PC 977 34.301 89.654 54.279 1.00 0.00 O ATOM 39332 C12 OL 978 36.691 89.706 54.068 1.00 0.00 C ATOM 39333 H2R OL 978 37.553 90.345 54.269 1.00 0.00 H ATOM 39334 H2S OL 978 36.856 88.914 54.802 1.00 0.00 H ATOM 39335 C13 OL 978 36.916 89.401 52.562 1.00 0.00 C ATOM 39336 H3R OL 978 37.984 89.322 52.348 1.00 0.00 H ATOM 39337 H3S OL 978 36.438 88.444 52.343 1.00 0.00 H ATOM 39338 C14 OL 978 36.316 90.465 51.490 1.00 0.00 C ATOM 39339 H4R OL 978 35.255 90.663 51.654 1.00 0.00 H ATOM 39340 H4S OL 978 36.865 91.408 51.525 1.00 0.00 H ATOM 39341 C15 OL 978 36.543 89.921 50.067 1.00 0.00 C ATOM 39342 H5R OL 978 37.573 89.564 49.999 1.00 0.00 H ATOM 39343 H5S OL 978 35.929 89.020 50.006 1.00 0.00 H ATOM 39344 C16 OL 978 36.293 90.963 48.976 1.00 0.00 C ATOM 39345 H6R OL 978 37.050 91.750 48.971 1.00 0.00 H ATOM 39346 H6S OL 978 36.367 90.521 47.980 1.00 0.00 H ATOM 39347 C17 OL 978 34.891 91.596 48.864 1.00 0.00 C ATOM 39348 H7R OL 978 34.224 90.748 48.694 1.00 0.00 H ATOM 39349 H7S OL 978 34.529 92.107 49.758 1.00 0.00 H ATOM 39350 C18 OL 978 34.724 92.504 47.708 1.00 0.00 C ATOM 39351 H8R OL 978 35.218 92.087 46.829 1.00 0.00 H ATOM 39352 H8S OL 978 33.641 92.550 47.570 1.00 0.00 H ATOM 39353 C19 OL 978 35.253 93.879 47.896 1.00 0.00 C ATOM 39354 H9R OL 978 34.576 94.500 48.475 1.00 0.00 H ATOM 39355 C110 OL 978 36.372 94.389 47.333 1.00 0.00 C ATOM 39356 H10R OL 978 36.588 95.441 47.505 1.00 0.00 H ATOM 39357 C111 OL 978 37.422 93.622 46.464 1.00 0.00 C ATOM 39358 H11R OL 978 38.408 93.979 46.771 1.00 0.00 H ATOM 39359 H11S OL 978 37.455 92.607 46.866 1.00 0.00 H ATOM 39360 C112 OL 978 37.172 93.555 44.992 1.00 0.00 C ATOM 39361 H12R OL 978 36.224 93.019 44.908 1.00 0.00 H ATOM 39362 H12S OL 978 37.269 94.590 44.659 1.00 0.00 H ATOM 39363 C113 OL 978 38.130 92.797 44.126 1.00 0.00 C ATOM 39364 H13R OL 978 37.759 92.641 43.111 1.00 0.00 H ATOM 39365 H13S OL 978 38.952 93.480 43.904 1.00 0.00 H ATOM 39366 C114 OL 978 38.747 91.476 44.716 1.00 0.00 C ATOM 39367 H14R OL 978 39.514 91.105 44.033 1.00 0.00 H ATOM 39368 H14S OL 978 39.134 91.611 45.728 1.00 0.00 H ATOM 39369 C115 OL 978 37.669 90.440 44.806 1.00 0.00 C ATOM 39370 H15R OL 978 37.938 89.588 45.433 1.00 0.00 H ATOM 39371 H15S OL 978 36.827 90.963 45.265 1.00 0.00 H ATOM 39372 C116 OL 978 37.017 90.127 43.372 1.00 0.00 C ATOM 39373 H16R OL 978 36.609 91.059 42.974 1.00 0.00 H ATOM 39374 H16S OL 978 37.898 89.786 42.826 1.00 0.00 H ATOM 39375 C117 OL 978 35.951 89.105 43.340 1.00 0.00 C ATOM 39376 H17R OL 978 36.218 88.236 43.946 1.00 0.00 H ATOM 39377 H17S OL 978 35.034 89.383 43.862 1.00 0.00 H ATOM 39378 C118 OL 978 35.481 88.571 41.999 1.00 0.00 C ATOM 39379 H18R OL 978 34.697 87.825 42.147 1.00 0.00 H ATOM 39380 H18S OL 978 36.270 88.095 41.414 1.00 0.00 H ATOM 39381 H18T OL 978 34.988 89.268 41.318 1.00 0.00 H TER 39382 OL 978 ATOM 39382 C116 PA 979 5.914 5.427 38.008 1.00 0.00 C ATOM 39383 H16R PA 979 5.164 6.147 37.674 1.00 0.00 H ATOM 39384 H16S PA 979 5.767 4.397 37.677 1.00 0.00 H ATOM 39385 H16T PA 979 6.775 5.616 37.364 1.00 0.00 H ATOM 39386 C115 PA 979 6.360 5.483 39.423 1.00 0.00 C ATOM 39387 H15R PA 979 6.726 6.459 39.748 1.00 0.00 H ATOM 39388 H15S PA 979 7.323 4.974 39.493 1.00 0.00 H ATOM 39389 C114 PA 979 5.355 5.044 40.404 1.00 0.00 C ATOM 39390 H14R PA 979 5.274 3.958 40.329 1.00 0.00 H ATOM 39391 H14S PA 979 4.431 5.511 40.058 1.00 0.00 H ATOM 39392 C113 PA 979 5.553 5.519 41.877 1.00 0.00 C ATOM 39393 H13R PA 979 5.731 6.596 41.861 1.00 0.00 H ATOM 39394 H13S PA 979 6.393 5.018 42.363 1.00 0.00 H ATOM 39395 C112 PA 979 4.259 5.238 42.682 1.00 0.00 C ATOM 39396 H12R PA 979 4.066 4.193 42.429 1.00 0.00 H ATOM 39397 H12S PA 979 3.419 5.747 42.205 1.00 0.00 H ATOM 39398 C111 PA 979 4.338 5.454 44.215 1.00 0.00 C ATOM 39399 H11R PA 979 4.445 6.532 44.351 1.00 0.00 H ATOM 39400 H11S PA 979 5.208 5.031 44.722 1.00 0.00 H ATOM 39401 C110 PA 979 3.122 4.909 44.984 1.00 0.00 C ATOM 39402 H10R PA 979 3.124 3.853 44.707 1.00 0.00 H ATOM 39403 H10S PA 979 2.148 5.219 44.600 1.00 0.00 H ATOM 39404 C19 PA 979 3.181 5.190 46.438 1.00 0.00 C ATOM 39405 H9R PA 979 4.158 4.808 46.739 1.00 0.00 H ATOM 39406 H9S PA 979 2.439 4.553 46.923 1.00 0.00 H ATOM 39407 C18 PA 979 2.894 6.663 46.931 1.00 0.00 C ATOM 39408 H8R PA 979 1.869 6.927 46.663 1.00 0.00 H ATOM 39409 H8S PA 979 3.501 7.356 46.345 1.00 0.00 H ATOM 39410 C17 PA 979 3.103 6.796 48.441 1.00 0.00 C ATOM 39411 H7R PA 979 4.147 6.654 48.727 1.00 0.00 H ATOM 39412 H7S PA 979 2.491 6.136 49.060 1.00 0.00 H ATOM 39413 C16 PA 979 2.854 8.211 48.946 1.00 0.00 C ATOM 39414 H6R PA 979 1.808 8.520 48.907 1.00 0.00 H ATOM 39415 H6S PA 979 3.372 8.865 48.241 1.00 0.00 H ATOM 39416 C15 PA 979 3.553 8.494 50.237 1.00 0.00 C ATOM 39417 H5R PA 979 3.648 9.573 50.376 1.00 0.00 H ATOM 39418 H5S PA 979 4.520 7.999 50.129 1.00 0.00 H ATOM 39419 C14 PA 979 2.753 8.046 51.450 1.00 0.00 C ATOM 39420 H4R PA 979 2.856 6.964 51.551 1.00 0.00 H ATOM 39421 H4S PA 979 1.709 8.252 51.206 1.00 0.00 H ATOM 39422 C13 PA 979 3.205 8.598 52.851 1.00 0.00 C ATOM 39423 H3R PA 979 4.089 8.068 53.209 1.00 0.00 H ATOM 39424 H3S PA 979 2.384 8.472 53.560 1.00 0.00 H ATOM 39425 C12 PA 979 3.349 10.129 52.811 1.00 0.00 C ATOM 39426 H2R PA 979 4.240 10.291 52.200 1.00 0.00 H ATOM 39427 H2S PA 979 2.470 10.694 52.494 1.00 0.00 H ATOM 39428 C11 PGR 980 3.781 10.762 54.188 1.00 0.00 C ATOM 39429 O12 PGR 980 4.153 11.939 54.276 1.00 0.00 O ATOM 39430 O11 PGR 980 3.600 10.003 55.263 1.00 0.00 O ATOM 39431 C1 PGR 980 4.097 10.518 56.520 1.00 0.00 C ATOM 39432 HR PGR 980 3.477 11.373 56.800 1.00 0.00 H ATOM 39433 HS PGR 980 5.129 10.845 56.371 1.00 0.00 H ATOM 39434 C2 PGR 980 4.110 9.513 57.573 1.00 0.00 C ATOM 39435 HX PGR 980 3.226 8.938 57.288 1.00 0.00 H ATOM 39436 C3 PGR 980 3.997 10.092 59.024 1.00 0.00 C ATOM 39437 HA PGR 980 3.069 10.631 59.228 1.00 0.00 H ATOM 39438 HB PGR 980 4.732 10.901 59.008 1.00 0.00 H ATOM 39439 O31 PGR 980 4.296 8.985 59.886 1.00 0.00 O ATOM 39440 P31 PGR 980 4.565 9.160 61.429 1.00 0.00 P ATOM 39441 O32 PGR 980 3.288 8.749 62.262 1.00 0.00 O ATOM 39442 C31 PGR 980 2.665 7.455 62.113 1.00 0.00 C ATOM 39443 H1A PGR 980 3.293 6.666 62.537 1.00 0.00 H ATOM 39444 H1B PGR 980 2.443 7.264 61.060 1.00 0.00 H ATOM 39445 C32 PGR 980 1.354 7.405 62.875 1.00 0.00 C ATOM 39446 H2A PGR 980 0.957 6.387 62.903 1.00 0.00 H ATOM 39447 O35 PGR 980 0.491 8.261 62.198 1.00 0.00 O ATOM 39448 HO5A PGR 980 0.285 7.841 61.344 1.00 0.00 H ATOM 39449 C33 PGR 980 1.515 7.720 64.391 1.00 0.00 C ATOM 39450 H3A PGR 980 2.531 7.489 64.722 1.00 0.00 H ATOM 39451 H3B PGR 980 1.329 8.790 64.517 1.00 0.00 H ATOM 39452 O33 PGR 980 5.599 8.172 61.741 1.00 0.00 O ATOM 39453 O34 PGR 980 4.760 10.646 61.639 1.00 0.00 O ATOM 39454 O21 PGR 980 5.246 8.674 57.477 1.00 0.00 O ATOM 39455 C21 PGR 980 6.480 9.046 57.727 1.00 0.00 C ATOM 39456 O22 PGR 980 6.754 10.218 57.963 1.00 0.00 O ATOM 39457 O36 PGR 980 0.567 7.048 65.184 1.00 0.00 O ATOM 39458 HO6A PGR 980 0.786 7.247 66.112 1.00 0.00 H ATOM 39459 C12 OL 981 7.507 7.976 57.516 1.00 0.00 C ATOM 39460 H2R OL 981 8.329 8.235 58.187 1.00 0.00 H ATOM 39461 H2S OL 981 7.178 7.022 57.933 1.00 0.00 H ATOM 39462 C13 OL 981 8.076 8.035 56.111 1.00 0.00 C ATOM 39463 H3R OL 981 8.135 9.072 55.774 1.00 0.00 H ATOM 39464 H3S OL 981 9.098 7.668 56.227 1.00 0.00 H ATOM 39465 C14 OL 981 7.296 7.369 54.971 1.00 0.00 C ATOM 39466 H4R OL 981 6.249 7.677 54.976 1.00 0.00 H ATOM 39467 H4S OL 981 7.707 7.789 54.051 1.00 0.00 H ATOM 39468 C15 OL 981 7.280 5.846 55.013 1.00 0.00 C ATOM 39469 H5R OL 981 8.291 5.481 55.206 1.00 0.00 H ATOM 39470 H5S OL 981 6.639 5.565 55.851 1.00 0.00 H ATOM 39471 C16 OL 981 6.645 5.190 53.835 1.00 0.00 C ATOM 39472 H6R OL 981 7.041 5.554 52.885 1.00 0.00 H ATOM 39473 H6S OL 981 6.850 4.118 53.809 1.00 0.00 H ATOM 39474 C17 OL 981 5.151 5.249 53.812 1.00 0.00 C ATOM 39475 H7R OL 981 4.817 4.825 54.762 1.00 0.00 H ATOM 39476 H7S OL 981 4.821 6.271 54.013 1.00 0.00 H ATOM 39477 C18 OL 981 4.425 4.467 52.665 1.00 0.00 C ATOM 39478 H8R OL 981 4.608 3.401 52.815 1.00 0.00 H ATOM 39479 H8S OL 981 3.342 4.540 52.784 1.00 0.00 H ATOM 39480 C19 OL 981 4.778 4.988 51.286 1.00 0.00 C ATOM 39481 H9R OL 981 4.399 5.992 51.113 1.00 0.00 H ATOM 39482 C110 OL 981 5.364 4.327 50.242 1.00 0.00 C ATOM 39483 H10R OL 981 5.546 4.895 49.333 1.00 0.00 H ATOM 39484 C111 OL 981 5.918 2.933 50.197 1.00 0.00 C ATOM 39485 H11R OL 981 5.949 2.398 51.148 1.00 0.00 H ATOM 39486 H11S OL 981 5.247 2.256 49.664 1.00 0.00 H ATOM 39487 C112 OL 981 7.354 2.734 49.681 1.00 0.00 C ATOM 39488 H12R OL 981 7.734 1.713 49.604 1.00 0.00 H ATOM 39489 H12S OL 981 7.253 3.219 48.708 1.00 0.00 H ATOM 39490 C113 OL 981 8.387 3.581 50.545 1.00 0.00 C ATOM 39491 H13R OL 981 7.917 4.514 50.863 1.00 0.00 H ATOM 39492 H13S OL 981 8.581 2.957 51.420 1.00 0.00 H ATOM 39493 C114 OL 981 9.669 3.983 49.774 1.00 0.00 C ATOM 39494 H14R OL 981 9.402 4.711 49.005 1.00 0.00 H ATOM 39495 H14S OL 981 10.431 4.478 50.378 1.00 0.00 H ATOM 39496 C115 OL 981 10.451 2.869 49.114 1.00 0.00 C ATOM 39497 H15R OL 981 10.687 2.029 49.771 1.00 0.00 H ATOM 39498 H15S OL 981 9.827 2.327 48.401 1.00 0.00 H ATOM 39499 C116 OL 981 11.668 3.282 48.280 1.00 0.00 C ATOM 39500 H16R OL 981 11.384 3.631 47.285 1.00 0.00 H ATOM 39501 H16S OL 981 12.206 4.155 48.655 1.00 0.00 H ATOM 39502 C117 OL 981 12.625 2.110 48.243 1.00 0.00 C ATOM 39503 H17R OL 981 13.019 1.913 49.242 1.00 0.00 H ATOM 39504 H17S OL 981 12.124 1.168 48.013 1.00 0.00 H ATOM 39505 C118 OL 981 13.859 2.315 47.396 1.00 0.00 C ATOM 39506 H18R OL 981 14.262 3.298 47.646 1.00 0.00 H ATOM 39507 H18S OL 981 13.565 2.181 46.353 1.00 0.00 H ATOM 39508 H18T OL 981 14.649 1.568 47.491 1.00 0.00 H TER 39509 OL 981 ATOM 39509 C116 PA 982 10.333 36.825 40.693 1.00 0.00 C ATOM 39510 H16R PA 982 10.697 36.274 39.824 1.00 0.00 H ATOM 39511 H16S PA 982 10.982 36.573 41.534 1.00 0.00 H ATOM 39512 H16T PA 982 10.449 37.855 40.349 1.00 0.00 H ATOM 39513 C115 PA 982 8.980 36.455 41.227 1.00 0.00 C ATOM 39514 H15R PA 982 9.146 35.466 41.660 1.00 0.00 H ATOM 39515 H15S PA 982 8.323 36.374 40.358 1.00 0.00 H ATOM 39516 C114 PA 982 8.426 37.500 42.250 1.00 0.00 C ATOM 39517 H14R PA 982 7.430 37.732 41.866 1.00 0.00 H ATOM 39518 H14S PA 982 9.018 38.412 42.147 1.00 0.00 H ATOM 39519 C113 PA 982 8.314 36.958 43.675 1.00 0.00 C ATOM 39520 H13R PA 982 8.097 35.888 43.693 1.00 0.00 H ATOM 39521 H13S PA 982 7.450 37.447 44.130 1.00 0.00 H ATOM 39522 C112 PA 982 9.591 37.194 44.551 1.00 0.00 C ATOM 39523 H12R PA 982 9.911 38.226 44.394 1.00 0.00 H ATOM 39524 H12S PA 982 10.410 36.546 44.233 1.00 0.00 H ATOM 39525 C111 PA 982 9.276 37.045 45.982 1.00 0.00 C ATOM 39526 H11R PA 982 8.830 36.068 46.176 1.00 0.00 H ATOM 39527 H11S PA 982 8.524 37.770 46.301 1.00 0.00 H ATOM 39528 C110 PA 982 10.479 37.132 46.797 1.00 0.00 C ATOM 39529 H10R PA 982 10.900 38.135 46.701 1.00 0.00 H ATOM 39530 H10S PA 982 11.263 36.515 46.353 1.00 0.00 H ATOM 39531 C19 PA 982 10.276 36.905 48.273 1.00 0.00 C ATOM 39532 H9R PA 982 9.691 35.987 48.355 1.00 0.00 H ATOM 39533 H9S PA 982 9.602 37.683 48.638 1.00 0.00 H ATOM 39534 C18 PA 982 11.512 36.991 49.139 1.00 0.00 C ATOM 39535 H8R PA 982 11.758 38.050 49.232 1.00 0.00 H ATOM 39536 H8S PA 982 12.306 36.484 48.587 1.00 0.00 H ATOM 39537 C17 PA 982 11.269 36.309 50.506 1.00 0.00 C ATOM 39538 H7R PA 982 10.724 35.390 50.279 1.00 0.00 H ATOM 39539 H7S PA 982 10.572 36.946 51.053 1.00 0.00 H ATOM 39540 C16 PA 982 12.436 36.103 51.421 1.00 0.00 C ATOM 39541 H6R PA 982 12.756 37.136 51.573 1.00 0.00 H ATOM 39542 H6S PA 982 13.259 35.575 50.935 1.00 0.00 H ATOM 39543 C15 PA 982 11.967 35.427 52.742 1.00 0.00 C ATOM 39544 H5R PA 982 11.591 34.451 52.427 1.00 0.00 H ATOM 39545 H5S PA 982 11.053 35.896 53.113 1.00 0.00 H ATOM 39546 C14 PA 982 12.974 35.250 53.889 1.00 0.00 C ATOM 39547 H4R PA 982 13.352 36.234 54.174 1.00 0.00 H ATOM 39548 H4S PA 982 13.781 34.669 53.438 1.00 0.00 H ATOM 39549 C13 PA 982 12.306 34.572 55.043 1.00 0.00 C ATOM 39550 H3R PA 982 11.770 33.710 54.640 1.00 0.00 H ATOM 39551 H3S PA 982 11.520 35.202 55.463 1.00 0.00 H ATOM 39552 C12 PA 982 13.122 33.979 56.110 1.00 0.00 C ATOM 39553 H2R PA 982 13.910 33.370 55.663 1.00 0.00 H ATOM 39554 H2S PA 982 12.460 33.428 56.782 1.00 0.00 H ATOM 39555 C11 PGR 983 14.005 35.051 56.776 1.00 0.00 C ATOM 39556 O12 PGR 983 15.069 35.423 56.342 1.00 0.00 O ATOM 39557 O11 PGR 983 13.357 35.462 57.879 1.00 0.00 O ATOM 39558 C1 PGR 983 13.639 36.690 58.620 1.00 0.00 C ATOM 39559 HR PGR 983 14.512 36.724 59.277 1.00 0.00 H ATOM 39560 HS PGR 983 12.826 36.833 59.336 1.00 0.00 H ATOM 39561 C2 PGR 983 13.903 37.893 57.668 1.00 0.00 C ATOM 39562 HX PGR 983 14.876 37.795 57.181 1.00 0.00 H ATOM 39563 C3 PGR 983 13.870 39.216 58.344 1.00 0.00 C ATOM 39564 HA PGR 983 14.000 40.019 57.614 1.00 0.00 H ATOM 39565 HB PGR 983 14.541 39.330 59.199 1.00 0.00 H ATOM 39566 O31 PGR 983 12.481 39.379 58.776 1.00 0.00 O ATOM 39567 P31 PGR 983 11.848 40.564 59.792 1.00 0.00 P ATOM 39568 O32 PGR 983 10.832 39.780 60.800 1.00 0.00 O ATOM 39569 C31 PGR 983 11.219 38.802 61.760 1.00 0.00 C ATOM 39570 H1A PGR 983 11.944 39.193 62.478 1.00 0.00 H ATOM 39571 H1B PGR 983 11.716 37.986 61.230 1.00 0.00 H ATOM 39572 C32 PGR 983 9.958 38.310 62.540 1.00 0.00 C ATOM 39573 H2A PGR 983 9.183 38.042 61.817 1.00 0.00 H ATOM 39574 O35 PGR 983 9.468 39.374 63.410 1.00 0.00 O ATOM 39575 HO5A PGR 983 9.317 40.167 62.865 1.00 0.00 H ATOM 39576 C33 PGR 983 10.303 37.072 63.440 1.00 0.00 C ATOM 39577 H3A PGR 983 10.684 36.255 62.823 1.00 0.00 H ATOM 39578 H3B PGR 983 11.075 37.340 64.166 1.00 0.00 H ATOM 39579 O33 PGR 983 12.851 41.200 60.731 1.00 0.00 O ATOM 39580 O34 PGR 983 11.066 41.547 59.029 1.00 0.00 O ATOM 39581 O21 PGR 983 12.899 37.818 56.620 1.00 0.00 O ATOM 39582 C21 PGR 983 13.200 38.552 55.487 1.00 0.00 C ATOM 39583 O22 PGR 983 14.339 38.828 55.162 1.00 0.00 O ATOM 39584 O36 PGR 983 9.190 36.418 64.068 1.00 0.00 O ATOM 39585 HO6A PGR 983 8.569 36.075 63.401 1.00 0.00 H ATOM 39586 C12 OL 984 12.044 38.823 54.578 1.00 0.00 C ATOM 39587 H2R OL 984 12.033 38.257 53.644 1.00 0.00 H ATOM 39588 H2S OL 984 11.151 38.541 55.140 1.00 0.00 H ATOM 39589 C13 OL 984 11.932 40.266 54.269 1.00 0.00 C ATOM 39590 H3R OL 984 11.140 40.380 53.526 1.00 0.00 H ATOM 39591 H3S OL 984 11.501 40.855 55.081 1.00 0.00 H ATOM 39592 C14 OL 984 13.081 40.933 53.562 1.00 0.00 C ATOM 39593 H4R OL 984 13.844 41.268 54.267 1.00 0.00 H ATOM 39594 H4S OL 984 13.535 40.272 52.820 1.00 0.00 H ATOM 39595 C15 OL 984 12.539 42.189 52.788 1.00 0.00 C ATOM 39596 H5R OL 984 11.659 42.012 52.166 1.00 0.00 H ATOM 39597 H5S OL 984 12.079 42.959 53.411 1.00 0.00 H ATOM 39598 C16 OL 984 13.654 42.831 51.971 1.00 0.00 C ATOM 39599 H6R OL 984 14.543 42.976 52.588 1.00 0.00 H ATOM 39600 H6S OL 984 13.837 42.149 51.138 1.00 0.00 H ATOM 39601 C17 OL 984 13.351 44.183 51.340 1.00 0.00 C ATOM 39602 H7R OL 984 12.279 44.150 51.134 1.00 0.00 H ATOM 39603 H7S OL 984 13.557 45.023 52.007 1.00 0.00 H ATOM 39604 C18 OL 984 14.017 44.408 50.062 1.00 0.00 C ATOM 39605 H8R OL 984 15.085 44.199 50.158 1.00 0.00 H ATOM 39606 H8S OL 984 13.543 43.825 49.270 1.00 0.00 H ATOM 39607 C19 OL 984 13.905 45.884 49.577 1.00 0.00 C ATOM 39608 H9R OL 984 13.655 46.654 50.302 1.00 0.00 H ATOM 39609 C110 OL 984 13.980 46.251 48.322 1.00 0.00 C ATOM 39610 H10R OL 984 13.772 47.255 47.960 1.00 0.00 H ATOM 39611 C111 OL 984 14.063 45.419 47.122 1.00 0.00 C ATOM 39612 H11R OL 984 15.066 45.494 46.697 1.00 0.00 H ATOM 39613 H11S OL 984 13.814 44.420 47.487 1.00 0.00 H ATOM 39614 C112 OL 984 13.109 45.819 45.975 1.00 0.00 C ATOM 39615 H12R OL 984 12.136 45.873 46.467 1.00 0.00 H ATOM 39616 H12S OL 984 13.320 46.812 45.573 1.00 0.00 H ATOM 39617 C113 OL 984 13.022 44.740 44.944 1.00 0.00 C ATOM 39618 H13R OL 984 14.054 44.541 44.646 1.00 0.00 H ATOM 39619 H13S OL 984 12.754 43.830 45.485 1.00 0.00 H ATOM 39620 C114 OL 984 12.059 45.204 43.855 1.00 0.00 C ATOM 39621 H14R OL 984 11.078 45.437 44.275 1.00 0.00 H ATOM 39622 H14S OL 984 12.360 46.194 43.508 1.00 0.00 H ATOM 39623 C115 OL 984 11.953 44.245 42.630 1.00 0.00 C ATOM 39624 H15R OL 984 12.835 44.276 41.988 1.00 0.00 H ATOM 39625 H15S OL 984 12.068 43.277 43.122 1.00 0.00 H ATOM 39626 C116 OL 984 10.701 44.396 41.745 1.00 0.00 C ATOM 39627 H16R OL 984 9.850 44.085 42.354 1.00 0.00 H ATOM 39628 H16S OL 984 10.457 45.401 41.393 1.00 0.00 H ATOM 39629 C117 OL 984 10.720 43.526 40.508 1.00 0.00 C ATOM 39630 H17R OL 984 11.549 43.948 39.936 1.00 0.00 H ATOM 39631 H17S OL 984 11.065 42.516 40.740 1.00 0.00 H ATOM 39632 C118 OL 984 9.443 43.491 39.650 1.00 0.00 C ATOM 39633 H18R OL 984 9.202 44.450 39.186 1.00 0.00 H ATOM 39634 H18S OL 984 8.540 43.162 40.168 1.00 0.00 H ATOM 39635 H18T OL 984 9.542 42.736 38.868 1.00 0.00 H TER 39636 OL 984 ATOM 39636 C116 PA 985 18.085 98.194 44.795 1.00 0.00 C ATOM 39637 H16R PA 985 17.418 98.161 43.930 1.00 0.00 H ATOM 39638 H16S PA 985 18.982 98.573 44.301 1.00 0.00 H ATOM 39639 H16T PA 985 17.690 99.029 45.378 1.00 0.00 H ATOM 39640 C115 PA 985 18.243 96.838 45.492 1.00 0.00 C ATOM 39641 H15R PA 985 18.744 97.016 46.446 1.00 0.00 H ATOM 39642 H15S PA 985 18.933 96.197 44.939 1.00 0.00 H ATOM 39643 C114 PA 985 16.938 96.143 45.870 1.00 0.00 C ATOM 39644 H14R PA 985 16.195 96.387 45.108 1.00 0.00 H ATOM 39645 H14S PA 985 16.573 96.558 46.812 1.00 0.00 H ATOM 39646 C113 PA 985 17.151 94.580 45.941 1.00 0.00 C ATOM 39647 H13R PA 985 18.062 94.335 46.490 1.00 0.00 H ATOM 39648 H13S PA 985 17.380 94.356 44.897 1.00 0.00 H ATOM 39649 C112 PA 985 15.864 93.822 46.283 1.00 0.00 C ATOM 39650 H12R PA 985 14.946 94.236 45.859 1.00 0.00 H ATOM 39651 H12S PA 985 15.673 93.858 47.358 1.00 0.00 H ATOM 39652 C111 PA 985 16.041 92.234 46.071 1.00 0.00 C ATOM 39653 H11R PA 985 16.058 91.978 45.009 1.00 0.00 H ATOM 39654 H11S PA 985 15.127 91.765 46.442 1.00 0.00 H ATOM 39655 C110 PA 985 17.153 91.604 46.890 1.00 0.00 C ATOM 39656 H10R PA 985 17.091 91.923 47.932 1.00 0.00 H ATOM 39657 H10S PA 985 18.076 92.001 46.463 1.00 0.00 H ATOM 39658 C19 PA 985 17.273 90.036 46.860 1.00 0.00 C ATOM 39659 H9R PA 985 18.323 89.794 46.683 1.00 0.00 H ATOM 39660 H9S PA 985 16.867 89.695 45.905 1.00 0.00 H ATOM 39661 C18 PA 985 16.614 89.337 48.099 1.00 0.00 C ATOM 39662 H8R PA 985 16.578 88.255 47.951 1.00 0.00 H ATOM 39663 H8S PA 985 15.554 89.601 48.096 1.00 0.00 H ATOM 39664 C17 PA 985 17.409 89.495 49.417 1.00 0.00 C ATOM 39665 H7R PA 985 16.824 89.028 50.211 1.00 0.00 H ATOM 39666 H7S PA 985 17.478 90.584 49.474 1.00 0.00 H ATOM 39667 C16 PA 985 18.806 88.927 49.372 1.00 0.00 C ATOM 39668 H6R PA 985 19.618 89.433 48.846 1.00 0.00 H ATOM 39669 H6S PA 985 18.766 87.919 48.953 1.00 0.00 H ATOM 39670 C15 PA 985 19.469 88.790 50.752 1.00 0.00 C ATOM 39671 H5R PA 985 18.873 88.034 51.267 1.00 0.00 H ATOM 39672 H5S PA 985 19.306 89.763 51.220 1.00 0.00 H ATOM 39673 C14 PA 985 20.930 88.503 50.562 1.00 0.00 C ATOM 39674 H4R PA 985 21.429 89.212 49.898 1.00 0.00 H ATOM 39675 H4S PA 985 20.824 87.585 49.981 1.00 0.00 H ATOM 39676 C13 PA 985 21.765 88.231 51.775 1.00 0.00 C ATOM 39677 H3R PA 985 22.727 87.813 51.474 1.00 0.00 H ATOM 39678 H3S PA 985 21.330 87.425 52.370 1.00 0.00 H ATOM 39679 C12 PA 985 21.917 89.463 52.610 1.00 0.00 C ATOM 39680 H2R PA 985 20.955 89.803 53.001 1.00 0.00 H ATOM 39681 H2S PA 985 22.269 90.207 51.892 1.00 0.00 H ATOM 39682 C11 PGR 986 22.870 89.195 53.741 1.00 0.00 C ATOM 39683 O12 PGR 986 23.034 88.067 54.171 1.00 0.00 O ATOM 39684 O11 PGR 986 23.560 90.251 54.174 1.00 0.00 O ATOM 39685 C1 PGR 986 24.625 90.138 55.107 1.00 0.00 C ATOM 39686 HR PGR 986 25.466 89.617 54.644 1.00 0.00 H ATOM 39687 HS PGR 986 24.232 89.779 56.062 1.00 0.00 H ATOM 39688 C2 PGR 986 25.076 91.610 55.415 1.00 0.00 C ATOM 39689 HX PGR 986 25.864 91.555 56.170 1.00 0.00 H ATOM 39690 C3 PGR 986 23.956 92.521 55.983 1.00 0.00 C ATOM 39691 HA PGR 986 23.177 91.947 56.491 1.00 0.00 H ATOM 39692 HB PGR 986 23.604 93.122 55.141 1.00 0.00 H ATOM 39693 O31 PGR 986 24.462 93.528 56.887 1.00 0.00 O ATOM 39694 P31 PGR 986 23.435 94.526 57.553 1.00 0.00 P ATOM 39695 O32 PGR 986 23.235 95.580 56.290 1.00 0.00 O ATOM 39696 C31 PGR 986 24.077 96.707 56.087 1.00 0.00 C ATOM 39697 H1A PGR 986 24.554 96.943 57.043 1.00 0.00 H ATOM 39698 H1B PGR 986 23.511 97.554 55.693 1.00 0.00 H ATOM 39699 C32 PGR 986 25.170 96.389 55.060 1.00 0.00 C ATOM 39700 H2A PGR 986 24.595 96.134 54.166 1.00 0.00 H ATOM 39701 O35 PGR 986 26.022 95.316 55.545 1.00 0.00 O ATOM 39702 HO5A PGR 986 25.472 94.512 55.572 1.00 0.00 H ATOM 39703 C33 PGR 986 26.104 97.580 54.790 1.00 0.00 C ATOM 39704 H3A PGR 986 26.887 97.121 54.182 1.00 0.00 H ATOM 39705 H3B PGR 986 25.599 98.339 54.187 1.00 0.00 H ATOM 39706 O33 PGR 986 22.165 93.813 57.821 1.00 0.00 O ATOM 39707 O34 PGR 986 24.175 95.205 58.693 1.00 0.00 O ATOM 39708 O21 PGR 986 25.604 92.317 54.280 1.00 0.00 O ATOM 39709 C21 PGR 986 26.851 91.974 53.855 1.00 0.00 C ATOM 39710 O22 PGR 986 27.644 91.190 54.280 1.00 0.00 O ATOM 39711 O36 PGR 986 26.692 98.185 55.982 1.00 0.00 O ATOM 39712 HO6A PGR 986 26.964 97.492 56.610 1.00 0.00 H ATOM 39713 C12 OL 987 27.097 92.681 52.528 1.00 0.00 C ATOM 39714 H2R OL 987 27.041 93.763 52.667 1.00 0.00 H ATOM 39715 H2S OL 987 28.110 92.461 52.183 1.00 0.00 H ATOM 39716 C13 OL 987 26.147 92.311 51.374 1.00 0.00 C ATOM 39717 H3R OL 987 26.174 91.220 51.393 1.00 0.00 H ATOM 39718 H3S OL 987 25.142 92.609 51.679 1.00 0.00 H ATOM 39719 C14 OL 987 26.589 92.831 49.972 1.00 0.00 C ATOM 39720 H4R OL 987 27.534 92.382 49.658 1.00 0.00 H ATOM 39721 H4S OL 987 25.839 92.473 49.264 1.00 0.00 H ATOM 39722 C15 OL 987 26.561 94.325 49.903 1.00 0.00 C ATOM 39723 H5R OL 987 25.727 94.695 50.503 1.00 0.00 H ATOM 39724 H5S OL 987 27.422 94.754 50.421 1.00 0.00 H ATOM 39725 C16 OL 987 26.359 94.868 48.475 1.00 0.00 C ATOM 39726 H6R OL 987 26.535 94.001 47.834 1.00 0.00 H ATOM 39727 H6S OL 987 25.320 95.173 48.332 1.00 0.00 H ATOM 39728 C17 OL 987 27.379 96.062 48.192 1.00 0.00 C ATOM 39729 H7R OL 987 27.211 96.886 48.889 1.00 0.00 H ATOM 39730 H7S OL 987 28.419 95.763 48.339 1.00 0.00 H ATOM 39731 C18 OL 987 27.249 96.639 46.733 1.00 0.00 C ATOM 39732 H8R OL 987 27.091 95.857 45.987 1.00 0.00 H ATOM 39733 H8S OL 987 26.313 97.197 46.801 1.00 0.00 H ATOM 39734 C19 OL 987 28.263 97.603 46.326 1.00 0.00 C ATOM 39735 H9R OL 987 29.276 97.210 46.326 1.00 0.00 H ATOM 39736 C110 OL 987 27.970 98.785 45.925 1.00 0.00 C ATOM 39737 H10R OL 987 28.826 99.429 45.740 1.00 0.00 H ATOM 39738 C111 OL 987 26.737 99.620 45.859 1.00 0.00 C ATOM 39739 H11R OL 987 26.756 100.349 45.046 1.00 0.00 H ATOM 39740 H11S OL 987 25.789 99.118 45.652 1.00 0.00 H ATOM 39741 C112 OL 987 26.696 100.429 47.164 1.00 0.00 C ATOM 39742 H12R OL 987 25.792 101.039 47.227 1.00 0.00 H ATOM 39743 H12S OL 987 26.479 99.796 48.026 1.00 0.00 H ATOM 39744 C113 OL 987 27.847 101.371 47.402 1.00 0.00 C ATOM 39745 H13R OL 987 28.832 100.903 47.472 1.00 0.00 H ATOM 39746 H13S OL 987 27.868 102.027 46.530 1.00 0.00 H ATOM 39747 C114 OL 987 27.656 102.360 48.573 1.00 0.00 C ATOM 39748 H14R OL 987 28.500 103.048 48.490 1.00 0.00 H ATOM 39749 H14S OL 987 26.759 102.948 48.368 1.00 0.00 H ATOM 39750 C115 OL 987 27.555 101.858 50.027 1.00 0.00 C ATOM 39751 H15R OL 987 27.825 102.680 50.694 1.00 0.00 H ATOM 39752 H15S OL 987 26.559 101.482 50.270 1.00 0.00 H ATOM 39753 C116 OL 987 28.467 100.650 50.389 1.00 0.00 C ATOM 39754 H16R OL 987 28.118 99.819 49.773 1.00 0.00 H ATOM 39755 H16S OL 987 29.510 100.702 50.072 1.00 0.00 H ATOM 39756 C117 OL 987 28.443 100.235 51.875 1.00 0.00 C ATOM 39757 H17R OL 987 28.983 100.951 52.497 1.00 0.00 H ATOM 39758 H17S OL 987 27.440 100.144 52.298 1.00 0.00 H ATOM 39759 C118 OL 987 28.963 98.804 52.062 1.00 0.00 C ATOM 39760 H18R OL 987 28.985 98.612 53.137 1.00 0.00 H ATOM 39761 H18S OL 987 29.987 98.698 51.699 1.00 0.00 H ATOM 39762 H18T OL 987 28.321 98.045 51.611 1.00 0.00 H TER 39763 OL 987 ATOM 39763 C116 PA 988 104.376 134.792 39.222 1.00 0.00 C ATOM 39764 H16R PA 988 103.842 135.589 39.743 1.00 0.00 H ATOM 39765 H16S PA 988 103.643 134.485 38.473 1.00 0.00 H ATOM 39766 H16T PA 988 105.189 135.206 38.622 1.00 0.00 H ATOM 39767 C115 PA 988 104.932 133.667 40.179 1.00 0.00 C ATOM 39768 H15R PA 988 105.585 134.062 40.961 1.00 0.00 H ATOM 39769 H15S PA 988 105.622 132.961 39.713 1.00 0.00 H ATOM 39770 C114 PA 988 103.777 132.768 40.714 1.00 0.00 C ATOM 39771 H14R PA 988 103.192 132.441 39.851 1.00 0.00 H ATOM 39772 H14S PA 988 103.024 133.375 41.221 1.00 0.00 H ATOM 39773 C113 PA 988 104.254 131.606 41.541 1.00 0.00 C ATOM 39774 H13R PA 988 104.671 131.906 42.505 1.00 0.00 H ATOM 39775 H13S PA 988 105.114 131.151 41.045 1.00 0.00 H ATOM 39776 C112 PA 988 103.243 130.470 41.662 1.00 0.00 C ATOM 39777 H12R PA 988 102.956 130.118 40.669 1.00 0.00 H ATOM 39778 H12S PA 988 102.301 130.887 42.025 1.00 0.00 H ATOM 39779 C111 PA 988 103.644 129.329 42.632 1.00 0.00 C ATOM 39780 H11R PA 988 104.541 128.887 42.193 1.00 0.00 H ATOM 39781 H11S PA 988 102.991 128.468 42.476 1.00 0.00 H ATOM 39782 C110 PA 988 103.776 129.654 44.084 1.00 0.00 C ATOM 39783 H10R PA 988 102.797 129.874 44.515 1.00 0.00 H ATOM 39784 H10S PA 988 104.370 130.570 44.136 1.00 0.00 H ATOM 39785 C19 PA 988 104.480 128.628 45.017 1.00 0.00 C ATOM 39786 H9R PA 988 105.440 128.454 44.526 1.00 0.00 H ATOM 39787 H9S PA 988 103.936 127.696 45.181 1.00 0.00 H ATOM 39788 C18 PA 988 104.818 129.327 46.383 1.00 0.00 C ATOM 39789 H8R PA 988 103.964 129.822 46.850 1.00 0.00 H ATOM 39790 H8S PA 988 105.540 130.135 46.243 1.00 0.00 H ATOM 39791 C17 PA 988 105.370 128.271 47.343 1.00 0.00 C ATOM 39792 H7R PA 988 106.220 127.788 46.857 1.00 0.00 H ATOM 39793 H7S PA 988 104.599 127.507 47.471 1.00 0.00 H ATOM 39794 C16 PA 988 105.766 128.816 48.739 1.00 0.00 C ATOM 39795 H6R PA 988 104.874 129.382 49.016 1.00 0.00 H ATOM 39796 H6S PA 988 106.612 129.501 48.653 1.00 0.00 H ATOM 39797 C15 PA 988 106.116 127.779 49.726 1.00 0.00 C ATOM 39798 H5R PA 988 106.735 127.004 49.270 1.00 0.00 H ATOM 39799 H5S PA 988 105.156 127.263 49.802 1.00 0.00 H ATOM 39800 C14 PA 988 106.760 128.178 51.083 1.00 0.00 C ATOM 39801 H4R PA 988 106.057 128.810 51.630 1.00 0.00 H ATOM 39802 H4S PA 988 107.588 128.864 50.892 1.00 0.00 H ATOM 39803 C13 PA 988 107.160 127.007 52.032 1.00 0.00 C ATOM 39804 H3R PA 988 107.924 126.392 51.553 1.00 0.00 H ATOM 39805 H3S PA 988 106.346 126.316 52.262 1.00 0.00 H ATOM 39806 C12 PA 988 107.774 127.376 53.331 1.00 0.00 C ATOM 39807 H2R PA 988 107.210 128.151 53.854 1.00 0.00 H ATOM 39808 H2S PA 988 108.785 127.787 53.284 1.00 0.00 H ATOM 39809 C11 PGR 989 107.783 126.164 54.192 1.00 0.00 C ATOM 39810 O12 PGR 989 106.836 125.881 54.913 1.00 0.00 O ATOM 39811 O11 PGR 989 108.946 125.504 53.976 1.00 0.00 O ATOM 39812 C1 PGR 989 109.282 124.547 54.921 1.00 0.00 C ATOM 39813 HR PGR 989 109.101 124.879 55.946 1.00 0.00 H ATOM 39814 HS PGR 989 110.329 124.272 54.770 1.00 0.00 H ATOM 39815 C2 PGR 989 108.415 123.283 54.768 1.00 0.00 C ATOM 39816 HX PGR 989 107.520 123.409 54.153 1.00 0.00 H ATOM 39817 C3 PGR 989 107.848 122.834 56.086 1.00 0.00 C ATOM 39818 HA PGR 989 107.409 121.854 55.885 1.00 0.00 H ATOM 39819 HB PGR 989 107.020 123.483 56.383 1.00 0.00 H ATOM 39820 O31 PGR 989 108.931 122.699 57.007 1.00 0.00 O ATOM 39821 P31 PGR 989 108.679 122.134 58.507 1.00 0.00 P ATOM 39822 O32 PGR 989 108.015 120.655 58.327 1.00 0.00 O ATOM 39823 C31 PGR 989 108.810 119.684 57.746 1.00 0.00 C ATOM 39824 H1A PGR 989 109.544 119.418 58.510 1.00 0.00 H ATOM 39825 H1B PGR 989 109.354 120.039 56.867 1.00 0.00 H ATOM 39826 C32 PGR 989 107.986 118.462 57.544 1.00 0.00 C ATOM 39827 H2A PGR 989 107.052 118.750 57.054 1.00 0.00 H ATOM 39828 O35 PGR 989 107.803 117.800 58.821 1.00 0.00 O ATOM 39829 HO5A PGR 989 108.702 117.511 59.058 1.00 0.00 H ATOM 39830 C33 PGR 989 108.732 117.568 56.598 1.00 0.00 C ATOM 39831 H3A PGR 989 107.975 116.836 56.305 1.00 0.00 H ATOM 39832 H3B PGR 989 109.036 118.044 55.662 1.00 0.00 H ATOM 39833 O33 PGR 989 110.040 121.942 58.994 1.00 0.00 O ATOM 39834 O34 PGR 989 107.771 123.078 59.163 1.00 0.00 O ATOM 39835 O21 PGR 989 109.145 122.226 54.157 1.00 0.00 O ATOM 39836 C21 PGR 989 109.329 122.287 52.809 1.00 0.00 C ATOM 39837 O22 PGR 989 108.804 123.196 52.164 1.00 0.00 O ATOM 39838 O36 PGR 989 109.900 116.942 57.222 1.00 0.00 O ATOM 39839 HO6A PGR 989 110.475 117.701 57.430 1.00 0.00 H ATOM 39840 C12 OL 990 109.941 121.082 52.152 1.00 0.00 C ATOM 39841 H2R OL 990 109.195 120.612 51.507 1.00 0.00 H ATOM 39842 H2S OL 990 110.662 121.588 51.507 1.00 0.00 H ATOM 39843 C13 OL 990 110.570 120.153 53.180 1.00 0.00 C ATOM 39844 H3R OL 990 111.376 120.737 53.629 1.00 0.00 H ATOM 39845 H3S OL 990 109.829 119.952 53.957 1.00 0.00 H ATOM 39846 C14 OL 990 111.236 118.903 52.681 1.00 0.00 C ATOM 39847 H4R OL 990 110.563 118.433 51.960 1.00 0.00 H ATOM 39848 H4S OL 990 112.151 119.174 52.150 1.00 0.00 H ATOM 39849 C15 OL 990 111.408 117.882 53.738 1.00 0.00 C ATOM 39850 H5R OL 990 112.132 118.235 54.476 1.00 0.00 H ATOM 39851 H5S OL 990 110.492 117.679 54.298 1.00 0.00 H ATOM 39852 C16 OL 990 112.105 116.533 53.303 1.00 0.00 C ATOM 39853 H6R OL 990 111.432 116.097 52.562 1.00 0.00 H ATOM 39854 H6S OL 990 112.997 116.659 52.685 1.00 0.00 H ATOM 39855 C17 OL 990 112.273 115.518 54.456 1.00 0.00 C ATOM 39856 H7R OL 990 112.895 116.027 55.194 1.00 0.00 H ATOM 39857 H7S OL 990 111.353 115.283 54.996 1.00 0.00 H ATOM 39858 C18 OL 990 113.021 114.206 54.060 1.00 0.00 C ATOM 39859 H8R OL 990 112.275 113.506 53.679 1.00 0.00 H ATOM 39860 H8S OL 990 113.737 114.408 53.261 1.00 0.00 H ATOM 39861 C19 OL 990 113.691 113.721 55.293 1.00 0.00 C ATOM 39862 H9R OL 990 114.368 114.451 55.727 1.00 0.00 H ATOM 39863 C110 OL 990 113.681 112.497 55.855 1.00 0.00 C ATOM 39864 H10R OL 990 114.199 112.279 56.785 1.00 0.00 H ATOM 39865 C111 OL 990 112.854 111.276 55.449 1.00 0.00 C ATOM 39866 H11R OL 990 112.252 111.453 54.555 1.00 0.00 H ATOM 39867 H11S OL 990 113.525 110.471 55.142 1.00 0.00 H ATOM 39868 C112 OL 990 111.905 110.849 56.628 1.00 0.00 C ATOM 39869 H12R OL 990 111.482 109.879 56.362 1.00 0.00 H ATOM 39870 H12S OL 990 112.574 110.843 57.492 1.00 0.00 H ATOM 39871 C113 OL 990 110.781 111.891 56.928 1.00 0.00 C ATOM 39872 H13R OL 990 110.319 111.605 57.875 1.00 0.00 H ATOM 39873 H13S OL 990 111.320 112.798 57.208 1.00 0.00 H ATOM 39874 C114 OL 990 109.757 112.039 55.798 1.00 0.00 C ATOM 39875 H14R OL 990 110.312 112.322 54.902 1.00 0.00 H ATOM 39876 H14S OL 990 109.301 111.073 55.569 1.00 0.00 H ATOM 39877 C115 OL 990 108.753 113.262 56.021 1.00 0.00 C ATOM 39878 H15R OL 990 108.218 113.203 56.971 1.00 0.00 H ATOM 39879 H15S OL 990 109.280 114.207 56.170 1.00 0.00 H ATOM 39880 C116 OL 990 107.621 113.459 54.945 1.00 0.00 C ATOM 39881 H16R OL 990 107.002 112.562 54.877 1.00 0.00 H ATOM 39882 H16S OL 990 106.960 114.288 55.206 1.00 0.00 H ATOM 39883 C117 OL 990 108.245 113.665 53.556 1.00 0.00 C ATOM 39884 H17R OL 990 109.026 114.413 53.707 1.00 0.00 H ATOM 39885 H17S OL 990 108.724 112.747 53.209 1.00 0.00 H ATOM 39886 C118 OL 990 107.250 114.018 52.502 1.00 0.00 C ATOM 39887 H18R OL 990 106.223 113.713 52.709 1.00 0.00 H ATOM 39888 H18S OL 990 107.493 113.610 51.519 1.00 0.00 H ATOM 39889 H18T OL 990 107.210 115.105 52.399 1.00 0.00 H TER 39890 OL 990 ATOM 39890 C116 PA 991 130.934 17.570 41.409 1.00 0.00 C ATOM 39891 H16R PA 991 130.450 17.077 40.564 1.00 0.00 H ATOM 39892 H16S PA 991 131.767 17.973 40.829 1.00 0.00 H ATOM 39893 H16T PA 991 130.150 18.254 41.738 1.00 0.00 H ATOM 39894 C115 PA 991 131.351 16.522 42.396 1.00 0.00 C ATOM 39895 H15R PA 991 132.058 16.909 43.134 1.00 0.00 H ATOM 39896 H15S PA 991 131.915 15.757 41.858 1.00 0.00 H ATOM 39897 C114 PA 991 130.203 15.869 43.170 1.00 0.00 C ATOM 39898 H14R PA 991 129.499 15.357 42.511 1.00 0.00 H ATOM 39899 H14S PA 991 129.624 16.653 43.663 1.00 0.00 H ATOM 39900 C113 PA 991 130.591 15.013 44.423 1.00 0.00 C ATOM 39901 H13R PA 991 131.055 14.062 44.154 1.00 0.00 H ATOM 39902 H13S PA 991 129.719 14.621 44.952 1.00 0.00 H ATOM 39903 C112 PA 991 131.497 15.671 45.530 1.00 0.00 C ATOM 39904 H12R PA 991 131.084 16.671 45.673 1.00 0.00 H ATOM 39905 H12S PA 991 132.435 15.849 45.000 1.00 0.00 H ATOM 39906 C111 PA 991 131.600 14.945 46.908 1.00 0.00 C ATOM 39907 H11R PA 991 132.258 14.076 46.839 1.00 0.00 H ATOM 39908 H11S PA 991 130.632 14.529 47.193 1.00 0.00 H ATOM 39909 C110 PA 991 132.309 15.691 47.966 1.00 0.00 C ATOM 39910 H10R PA 991 131.861 16.684 48.048 1.00 0.00 H ATOM 39911 H10S PA 991 133.340 15.897 47.670 1.00 0.00 H ATOM 39912 C19 PA 991 132.315 15.118 49.368 1.00 0.00 C ATOM 39913 H9R PA 991 132.813 14.146 49.347 1.00 0.00 H ATOM 39914 H9S PA 991 131.329 14.777 49.692 1.00 0.00 H ATOM 39915 C18 PA 991 132.820 16.093 50.414 1.00 0.00 C ATOM 39916 H8R PA 991 132.658 15.736 51.433 1.00 0.00 H ATOM 39917 H8S PA 991 132.222 16.998 50.292 1.00 0.00 H ATOM 39918 C17 PA 991 134.326 16.340 50.344 1.00 0.00 C ATOM 39919 H7R PA 991 134.550 17.215 50.958 1.00 0.00 H ATOM 39920 H7S PA 991 134.539 16.511 49.287 1.00 0.00 H ATOM 39921 C16 PA 991 135.154 15.132 50.819 1.00 0.00 C ATOM 39922 H6R PA 991 135.070 14.308 50.108 1.00 0.00 H ATOM 39923 H6S PA 991 134.709 14.737 51.734 1.00 0.00 H ATOM 39924 C15 PA 991 136.599 15.416 51.092 1.00 0.00 C ATOM 39925 H5R PA 991 136.679 16.257 51.783 1.00 0.00 H ATOM 39926 H5S PA 991 137.081 15.687 50.150 1.00 0.00 H ATOM 39927 C14 PA 991 137.358 14.324 51.724 1.00 0.00 C ATOM 39928 H4R PA 991 137.256 13.398 51.154 1.00 0.00 H ATOM 39929 H4S PA 991 137.011 14.142 52.743 1.00 0.00 H ATOM 39930 C13 PA 991 138.844 14.636 51.940 1.00 0.00 C ATOM 39931 H3R PA 991 138.852 15.470 52.645 1.00 0.00 H ATOM 39932 H3S PA 991 139.471 14.987 51.119 1.00 0.00 H ATOM 39933 C12 PA 991 139.702 13.489 52.566 1.00 0.00 C ATOM 39934 H2R PA 991 139.927 12.660 51.892 1.00 0.00 H ATOM 39935 H2S PA 991 140.637 13.993 52.821 1.00 0.00 H ATOM 39936 C11 PGR 992 139.038 13.035 53.865 1.00 0.00 C ATOM 39937 O12 PGR 992 138.892 11.901 54.131 1.00 0.00 O ATOM 39938 O11 PGR 992 138.637 14.030 54.659 1.00 0.00 O ATOM 39939 C1 PGR 992 138.075 13.778 55.930 1.00 0.00 C ATOM 39940 HR PGR 992 138.247 14.725 56.449 1.00 0.00 H ATOM 39941 HS PGR 992 138.606 12.978 56.453 1.00 0.00 H ATOM 39942 C2 PGR 992 136.591 13.538 55.832 1.00 0.00 C ATOM 39943 HX PGR 992 136.074 14.394 55.392 1.00 0.00 H ATOM 39944 C3 PGR 992 135.945 13.381 57.239 1.00 0.00 C ATOM 39945 HA PGR 992 134.876 13.292 57.026 1.00 0.00 H ATOM 39946 HB PGR 992 136.172 14.195 57.933 1.00 0.00 H ATOM 39947 O31 PGR 992 136.434 12.203 57.784 1.00 0.00 O ATOM 39948 P31 PGR 992 136.078 11.886 59.314 1.00 0.00 P ATOM 39949 O32 PGR 992 134.467 11.685 59.214 1.00 0.00 O ATOM 39950 C31 PGR 992 133.581 12.840 59.585 1.00 0.00 C ATOM 39951 H1A PGR 992 132.581 12.803 59.145 1.00 0.00 H ATOM 39952 H1B PGR 992 133.931 13.802 59.204 1.00 0.00 H ATOM 39953 C32 PGR 992 133.385 12.884 61.135 1.00 0.00 C ATOM 39954 H2A PGR 992 132.876 11.963 61.431 1.00 0.00 H ATOM 39955 O35 PGR 992 134.566 12.825 61.956 1.00 0.00 O ATOM 39956 HO5A PGR 992 135.290 13.046 61.343 1.00 0.00 H ATOM 39957 C33 PGR 992 132.623 14.124 61.529 1.00 0.00 C ATOM 39958 H3A PGR 992 133.369 14.915 61.420 1.00 0.00 H ATOM 39959 H3B PGR 992 131.741 14.186 60.887 1.00 0.00 H ATOM 39960 O33 PGR 992 136.557 10.530 59.725 1.00 0.00 O ATOM 39961 O34 PGR 992 136.448 12.985 60.187 1.00 0.00 O ATOM 39962 O21 PGR 992 136.386 12.281 55.168 1.00 0.00 O ATOM 39963 C21 PGR 992 135.191 11.908 54.659 1.00 0.00 C ATOM 39964 O22 PGR 992 134.149 12.484 54.712 1.00 0.00 O ATOM 39965 O36 PGR 992 132.059 14.078 62.776 1.00 0.00 O ATOM 39966 HO6A PGR 992 131.729 14.975 62.964 1.00 0.00 H ATOM 39967 C12 OL 993 135.326 10.634 53.884 1.00 0.00 C ATOM 39968 H2R OL 993 135.910 9.909 54.455 1.00 0.00 H ATOM 39969 H2S OL 993 134.340 10.177 53.782 1.00 0.00 H ATOM 39970 C13 OL 993 136.047 10.887 52.599 1.00 0.00 C ATOM 39971 H3R OL 993 136.989 11.434 52.668 1.00 0.00 H ATOM 39972 H3S OL 993 136.451 9.915 52.308 1.00 0.00 H ATOM 39973 C14 OL 993 135.179 11.427 51.504 1.00 0.00 C ATOM 39974 H4R OL 993 134.157 11.063 51.631 1.00 0.00 H ATOM 39975 H4S OL 993 135.199 12.503 51.693 1.00 0.00 H ATOM 39976 C15 OL 993 135.661 11.018 50.144 1.00 0.00 C ATOM 39977 H5R OL 993 136.578 11.572 49.936 1.00 0.00 H ATOM 39978 H5S OL 993 136.164 10.050 50.205 1.00 0.00 H ATOM 39979 C16 OL 993 134.653 11.086 49.004 1.00 0.00 C ATOM 39980 H6R OL 993 133.751 10.487 49.142 1.00 0.00 H ATOM 39981 H6S OL 993 134.332 12.117 48.839 1.00 0.00 H ATOM 39982 C17 OL 993 135.205 10.763 47.592 1.00 0.00 C ATOM 39983 H7R OL 993 135.811 11.608 47.259 1.00 0.00 H ATOM 39984 H7S OL 993 135.906 9.927 47.656 1.00 0.00 H ATOM 39985 C18 OL 993 134.172 10.636 46.458 1.00 0.00 C ATOM 39986 H8R OL 993 133.451 9.818 46.503 1.00 0.00 H ATOM 39987 H8S OL 993 133.486 11.468 46.630 1.00 0.00 H ATOM 39988 C19 OL 993 134.877 10.747 45.160 1.00 0.00 C ATOM 39989 H9R OL 993 135.357 9.798 44.936 1.00 0.00 H ATOM 39990 C110 OL 993 134.777 11.792 44.341 1.00 0.00 C ATOM 39991 H10R OL 993 135.369 11.796 43.430 1.00 0.00 H ATOM 39992 C111 OL 993 134.044 13.077 44.512 1.00 0.00 C ATOM 39993 H11R OL 993 133.154 12.917 43.900 1.00 0.00 H ATOM 39994 H11S OL 993 133.784 13.136 45.571 1.00 0.00 H ATOM 39995 C112 OL 993 134.883 14.320 43.979 1.00 0.00 C ATOM 39996 H12R OL 993 134.948 14.268 42.890 1.00 0.00 H ATOM 39997 H12S OL 993 134.142 15.064 44.278 1.00 0.00 H ATOM 39998 C113 OL 993 136.220 14.524 44.650 1.00 0.00 C ATOM 39999 H13R OL 993 136.811 13.607 44.609 1.00 0.00 H ATOM 40000 H13S OL 993 136.743 15.275 44.054 1.00 0.00 H ATOM 40001 C114 OL 993 136.018 14.817 46.126 1.00 0.00 C ATOM 40002 H14R OL 993 135.521 13.971 46.606 1.00 0.00 H ATOM 40003 H14S OL 993 135.208 15.549 46.093 1.00 0.00 H ATOM 40004 C115 OL 993 137.296 15.231 46.850 1.00 0.00 C ATOM 40005 H15R OL 993 137.771 16.034 46.282 1.00 0.00 H ATOM 40006 H15S OL 993 136.885 15.599 47.792 1.00 0.00 H ATOM 40007 C116 OL 993 138.318 14.128 47.224 1.00 0.00 C ATOM 40008 H16R OL 993 137.815 13.285 47.703 1.00 0.00 H ATOM 40009 H16S OL 993 138.791 13.662 46.358 1.00 0.00 H ATOM 40010 C117 OL 993 139.385 14.530 48.181 1.00 0.00 C ATOM 40011 H17R OL 993 138.888 14.742 49.130 1.00 0.00 H ATOM 40012 H17S OL 993 139.986 13.661 48.457 1.00 0.00 H ATOM 40013 C118 OL 993 140.108 15.841 47.873 1.00 0.00 C ATOM 40014 H18R OL 993 140.772 15.738 47.012 1.00 0.00 H ATOM 40015 H18S OL 993 140.704 16.073 48.758 1.00 0.00 H ATOM 40016 H18T OL 993 139.462 16.684 47.620 1.00 0.00 H TER 40017 OL 993 ATOM 40017 C116 PA 994 124.400 38.937 35.495 1.00 0.00 C ATOM 40018 H16R PA 994 125.068 38.123 35.208 1.00 0.00 H ATOM 40019 H16S PA 994 124.100 39.457 34.582 1.00 0.00 H ATOM 40020 H16T PA 994 123.590 38.360 35.947 1.00 0.00 H ATOM 40021 C115 PA 994 125.001 39.870 36.547 1.00 0.00 C ATOM 40022 H15R PA 994 125.762 40.456 36.028 1.00 0.00 H ATOM 40023 H15S PA 994 125.616 39.296 37.245 1.00 0.00 H ATOM 40024 C114 PA 994 124.051 40.784 37.286 1.00 0.00 C ATOM 40025 H14R PA 994 123.243 40.200 37.732 1.00 0.00 H ATOM 40026 H14S PA 994 123.588 41.531 36.638 1.00 0.00 H ATOM 40027 C113 PA 994 124.879 41.503 38.344 1.00 0.00 C ATOM 40028 H13R PA 994 125.749 41.828 37.770 1.00 0.00 H ATOM 40029 H13S PA 994 125.180 40.781 39.107 1.00 0.00 H ATOM 40030 C112 PA 994 124.241 42.744 39.057 1.00 0.00 C ATOM 40031 H12R PA 994 123.522 43.144 38.340 1.00 0.00 H ATOM 40032 H12S PA 994 125.050 43.466 39.189 1.00 0.00 H ATOM 40033 C111 PA 994 123.593 42.432 40.407 1.00 0.00 C ATOM 40034 H11R PA 994 122.684 41.841 40.269 1.00 0.00 H ATOM 40035 H11S PA 994 123.329 43.355 40.926 1.00 0.00 H ATOM 40036 C110 PA 994 124.512 41.637 41.432 1.00 0.00 C ATOM 40037 H10R PA 994 125.545 41.984 41.503 1.00 0.00 H ATOM 40038 H10S PA 994 124.683 40.629 41.048 1.00 0.00 H ATOM 40039 C19 PA 994 123.861 41.539 42.835 1.00 0.00 C ATOM 40040 H9R PA 994 122.945 40.946 42.875 1.00 0.00 H ATOM 40041 H9S PA 994 123.582 42.534 43.187 1.00 0.00 H ATOM 40042 C18 PA 994 124.703 40.824 43.920 1.00 0.00 C ATOM 40043 H8R PA 994 125.656 41.356 43.950 1.00 0.00 H ATOM 40044 H8S PA 994 124.975 39.845 43.522 1.00 0.00 H ATOM 40045 C17 PA 994 124.006 40.885 45.334 1.00 0.00 C ATOM 40046 H7R PA 994 122.980 40.520 45.247 1.00 0.00 H ATOM 40047 H7S PA 994 123.821 41.897 45.700 1.00 0.00 H ATOM 40048 C16 PA 994 124.831 40.193 46.441 1.00 0.00 C ATOM 40049 H6R PA 994 125.821 40.652 46.471 1.00 0.00 H ATOM 40050 H6S PA 994 125.039 39.170 46.120 1.00 0.00 H ATOM 40051 C15 PA 994 124.148 40.232 47.835 1.00 0.00 C ATOM 40052 H5R PA 994 124.424 39.375 48.453 1.00 0.00 H ATOM 40053 H5S PA 994 123.060 40.160 47.761 1.00 0.00 H ATOM 40054 C14 PA 994 124.527 41.468 48.677 1.00 0.00 C ATOM 40055 H4R PA 994 123.963 42.317 48.284 1.00 0.00 H ATOM 40056 H4S PA 994 125.557 41.816 48.581 1.00 0.00 H ATOM 40057 C13 PA 994 123.986 41.395 50.156 1.00 0.00 C ATOM 40058 H3R PA 994 124.432 42.166 50.787 1.00 0.00 H ATOM 40059 H3S PA 994 124.411 40.443 50.482 1.00 0.00 H ATOM 40060 C12 PA 994 122.474 41.451 50.425 1.00 0.00 C ATOM 40061 H2R PA 994 122.003 40.525 50.088 1.00 0.00 H ATOM 40062 H2S PA 994 122.010 42.393 50.122 1.00 0.00 H ATOM 40063 C11 PC 995 122.259 41.558 51.866 1.00 0.00 C ATOM 40064 O12 PC 995 121.824 40.605 52.511 1.00 0.00 O ATOM 40065 O11 PC 995 122.550 42.758 52.324 1.00 0.00 O ATOM 40066 C1 PC 995 122.473 43.081 53.693 1.00 0.00 C ATOM 40067 HR PC 995 121.438 42.986 54.031 1.00 0.00 H ATOM 40068 HS PC 995 122.873 44.098 53.696 1.00 0.00 H ATOM 40069 C2 PC 995 123.419 42.341 54.692 1.00 0.00 C ATOM 40070 HX PC 995 123.174 41.281 54.581 1.00 0.00 H ATOM 40071 C3 PC 995 123.055 42.763 56.092 1.00 0.00 C ATOM 40072 HA PC 995 121.985 42.910 56.261 1.00 0.00 H ATOM 40073 HB PC 995 123.575 43.719 56.185 1.00 0.00 H ATOM 40074 O31 PC 995 123.495 41.952 57.134 1.00 0.00 O ATOM 40075 P31 PC 995 123.388 42.280 58.664 1.00 0.00 P ATOM 40076 O32 PC 995 121.951 41.959 58.949 1.00 0.00 O ATOM 40077 C31 PC 995 121.306 40.826 58.483 1.00 0.00 C ATOM 40078 H1A PC 995 121.648 39.835 58.792 1.00 0.00 H ATOM 40079 H1B PC 995 121.251 40.865 57.392 1.00 0.00 H ATOM 40080 C32 PC 995 119.839 41.081 58.946 1.00 0.00 C ATOM 40081 H2A PC 995 119.166 40.525 58.292 1.00 0.00 H ATOM 40082 H2B PC 995 119.641 42.139 58.767 1.00 0.00 H ATOM 40083 N31 PC 995 119.368 40.532 60.291 1.00 0.00 N ATOM 40084 C33 PC 995 117.999 41.037 60.570 1.00 0.00 C ATOM 40085 H3A PC 995 117.738 40.625 61.546 1.00 0.00 H ATOM 40086 H3B PC 995 117.291 40.568 59.884 1.00 0.00 H ATOM 40087 H3C PC 995 117.840 42.116 60.553 1.00 0.00 H ATOM 40088 C34 PC 995 119.291 39.025 60.480 1.00 0.00 C ATOM 40089 H4A PC 995 120.269 38.621 60.214 1.00 0.00 H ATOM 40090 H4B PC 995 118.583 38.573 59.784 1.00 0.00 H ATOM 40091 H4C PC 995 118.953 38.764 61.484 1.00 0.00 H ATOM 40092 C35 PC 995 120.059 41.137 61.445 1.00 0.00 C ATOM 40093 H5A PC 995 119.854 42.192 61.258 1.00 0.00 H ATOM 40094 H5B PC 995 121.120 40.913 61.325 1.00 0.00 H ATOM 40095 H5C PC 995 119.570 40.953 62.402 1.00 0.00 H ATOM 40096 O33 PC 995 124.333 41.391 59.305 1.00 0.00 O ATOM 40097 O34 PC 995 123.562 43.735 58.784 1.00 0.00 O ATOM 40098 O21 PC 995 124.820 42.462 54.367 1.00 0.00 O ATOM 40099 C21 PC 995 125.860 41.774 54.884 1.00 0.00 C ATOM 40100 O22 PC 995 125.777 41.018 55.819 1.00 0.00 O ATOM 40101 C12 OL 996 127.140 41.934 54.044 1.00 0.00 C ATOM 40102 H2R OL 996 127.902 41.571 54.737 1.00 0.00 H ATOM 40103 H2S OL 996 127.054 41.223 53.220 1.00 0.00 H ATOM 40104 C13 OL 996 127.384 43.372 53.460 1.00 0.00 C ATOM 40105 H3R OL 996 126.607 43.730 52.782 1.00 0.00 H ATOM 40106 H3S OL 996 127.396 44.031 54.331 1.00 0.00 H ATOM 40107 C14 OL 996 128.667 43.704 52.760 1.00 0.00 C ATOM 40108 H4R OL 996 128.845 44.780 52.714 1.00 0.00 H ATOM 40109 H4S OL 996 129.529 43.465 53.387 1.00 0.00 H ATOM 40110 C15 OL 996 128.781 42.935 51.442 1.00 0.00 C ATOM 40111 H5R OL 996 129.795 42.622 51.183 1.00 0.00 H ATOM 40112 H5S OL 996 128.276 41.987 51.635 1.00 0.00 H ATOM 40113 C16 OL 996 128.146 43.521 50.177 1.00 0.00 C ATOM 40114 H6R OL 996 127.069 43.612 50.331 1.00 0.00 H ATOM 40115 H6S OL 996 128.627 44.499 50.241 1.00 0.00 H ATOM 40116 C17 OL 996 128.546 42.829 48.826 1.00 0.00 C ATOM 40117 H7R OL 996 129.630 42.701 48.839 1.00 0.00 H ATOM 40118 H7S OL 996 128.173 41.807 48.736 1.00 0.00 H ATOM 40119 C18 OL 996 128.085 43.632 47.734 1.00 0.00 C ATOM 40120 H8R OL 996 127.125 44.096 47.972 1.00 0.00 H ATOM 40121 H8S OL 996 128.680 44.534 47.578 1.00 0.00 H ATOM 40122 C19 OL 996 127.964 42.985 46.386 1.00 0.00 C ATOM 40123 H9R OL 996 126.990 42.533 46.221 1.00 0.00 H ATOM 40124 C110 OL 996 128.976 42.867 45.572 1.00 0.00 C ATOM 40125 H10R OL 996 128.877 42.208 44.714 1.00 0.00 H ATOM 40126 C111 OL 996 130.291 43.628 45.531 1.00 0.00 C ATOM 40127 H11R OL 996 130.309 44.467 46.230 1.00 0.00 H ATOM 40128 H11S OL 996 131.078 42.999 45.952 1.00 0.00 H ATOM 40129 C112 OL 996 130.594 44.283 44.233 1.00 0.00 C ATOM 40130 H12R OL 996 130.017 45.206 44.323 1.00 0.00 H ATOM 40131 H12S OL 996 131.653 44.545 44.278 1.00 0.00 H ATOM 40132 C113 OL 996 130.498 43.400 42.981 1.00 0.00 C ATOM 40133 H13R OL 996 131.076 42.475 43.040 1.00 0.00 H ATOM 40134 H13S OL 996 129.494 43.204 42.599 1.00 0.00 H ATOM 40135 C114 OL 996 131.111 44.167 41.715 1.00 0.00 C ATOM 40136 H14R OL 996 132.192 44.017 41.674 1.00 0.00 H ATOM 40137 H14S OL 996 130.782 43.520 40.899 1.00 0.00 H ATOM 40138 C115 OL 996 130.589 45.496 41.439 1.00 0.00 C ATOM 40139 H15R OL 996 129.498 45.475 41.396 1.00 0.00 H ATOM 40140 H15S OL 996 130.810 46.075 42.338 1.00 0.00 H ATOM 40141 C116 OL 996 131.373 46.010 40.211 1.00 0.00 C ATOM 40142 H16R OL 996 132.425 46.010 40.503 1.00 0.00 H ATOM 40143 H16S OL 996 131.170 45.346 39.368 1.00 0.00 H ATOM 40144 C117 OL 996 131.100 47.472 39.799 1.00 0.00 C ATOM 40145 H17R OL 996 130.056 47.718 39.592 1.00 0.00 H ATOM 40146 H17S OL 996 131.245 48.028 40.728 1.00 0.00 H ATOM 40147 C118 OL 996 131.989 48.151 38.727 1.00 0.00 C ATOM 40148 H18R OL 996 131.658 49.146 38.424 1.00 0.00 H ATOM 40149 H18S OL 996 132.097 47.548 37.822 1.00 0.00 H ATOM 40150 H18T OL 996 132.935 48.342 39.237 1.00 0.00 H TER 40151 OL 996 ATOM 40151 C116 PA 997 31.780 132.426 35.563 1.00 0.00 C ATOM 40152 H16R PA 997 31.610 131.351 35.474 1.00 0.00 H ATOM 40153 H16S PA 997 32.867 132.528 35.593 1.00 0.00 H ATOM 40154 H16T PA 997 31.387 132.847 34.635 1.00 0.00 H ATOM 40155 C115 PA 997 31.158 132.918 36.929 1.00 0.00 C ATOM 40156 H15R PA 997 31.761 132.529 37.752 1.00 0.00 H ATOM 40157 H15S PA 997 30.232 132.389 37.164 1.00 0.00 H ATOM 40158 C114 PA 997 30.971 134.402 36.917 1.00 0.00 C ATOM 40159 H14R PA 997 30.640 134.798 35.955 1.00 0.00 H ATOM 40160 H14S PA 997 31.907 134.862 37.239 1.00 0.00 H ATOM 40161 C113 PA 997 29.940 134.829 37.953 1.00 0.00 C ATOM 40162 H13R PA 997 28.997 134.307 37.776 1.00 0.00 H ATOM 40163 H13S PA 997 29.931 135.917 37.860 1.00 0.00 H ATOM 40164 C112 PA 997 30.493 134.636 39.351 1.00 0.00 C ATOM 40165 H12R PA 997 30.918 133.641 39.498 1.00 0.00 H ATOM 40166 H12S PA 997 29.642 134.512 40.024 1.00 0.00 H ATOM 40167 C111 PA 997 31.317 135.638 40.026 1.00 0.00 C ATOM 40168 H11R PA 997 30.733 136.560 39.979 1.00 0.00 H ATOM 40169 H11S PA 997 32.214 135.843 39.439 1.00 0.00 H ATOM 40170 C110 PA 997 31.673 135.312 41.441 1.00 0.00 C ATOM 40171 H10R PA 997 32.372 136.071 41.797 1.00 0.00 H ATOM 40172 H10S PA 997 32.251 134.385 41.457 1.00 0.00 H ATOM 40173 C19 PA 997 30.541 135.035 42.508 1.00 0.00 C ATOM 40174 H9R PA 997 31.064 134.561 43.340 1.00 0.00 H ATOM 40175 H9S PA 997 29.809 134.292 42.182 1.00 0.00 H ATOM 40176 C18 PA 997 29.681 136.243 42.893 1.00 0.00 C ATOM 40177 H8R PA 997 29.083 136.509 42.019 1.00 0.00 H ATOM 40178 H8S PA 997 30.325 137.099 43.102 1.00 0.00 H ATOM 40179 C17 PA 997 28.783 136.009 44.177 1.00 0.00 C ATOM 40180 H7R PA 997 29.518 135.773 44.950 1.00 0.00 H ATOM 40181 H7S PA 997 28.310 135.049 43.961 1.00 0.00 H ATOM 40182 C16 PA 997 27.788 137.082 44.489 1.00 0.00 C ATOM 40183 H6R PA 997 26.891 136.811 45.050 1.00 0.00 H ATOM 40184 H6S PA 997 27.391 137.381 43.516 1.00 0.00 H ATOM 40185 C15 PA 997 28.380 138.335 45.015 1.00 0.00 C ATOM 40186 H5R PA 997 27.668 139.156 44.903 1.00 0.00 H ATOM 40187 H5S PA 997 29.264 138.607 44.435 1.00 0.00 H ATOM 40188 C14 PA 997 28.786 138.281 46.465 1.00 0.00 C ATOM 40189 H4R PA 997 29.340 139.178 46.749 1.00 0.00 H ATOM 40190 H4S PA 997 29.453 137.433 46.635 1.00 0.00 H ATOM 40191 C13 PA 997 27.579 138.198 47.467 1.00 0.00 C ATOM 40192 H3R PA 997 28.259 138.199 48.321 1.00 0.00 H ATOM 40193 H3S PA 997 27.195 137.179 47.390 1.00 0.00 H ATOM 40194 C12 PA 997 26.571 139.278 47.546 1.00 0.00 C ATOM 40195 H2R PA 997 25.945 139.296 46.652 1.00 0.00 H ATOM 40196 H2S PA 997 26.997 140.279 47.452 1.00 0.00 H ATOM 40197 C11 PGR 998 25.794 139.417 48.815 1.00 0.00 C ATOM 40198 O12 PGR 998 25.128 140.387 49.084 1.00 0.00 O ATOM 40199 O11 PGR 998 25.828 138.339 49.648 1.00 0.00 O ATOM 40200 C1 PGR 998 25.027 138.244 50.861 1.00 0.00 C ATOM 40201 HR PGR 998 24.013 137.896 50.648 1.00 0.00 H ATOM 40202 HS PGR 998 24.976 139.244 51.297 1.00 0.00 H ATOM 40203 C2 PGR 998 25.722 137.208 51.733 1.00 0.00 C ATOM 40204 HX PGR 998 25.161 137.153 52.669 1.00 0.00 H ATOM 40205 C3 PGR 998 27.093 137.574 52.216 1.00 0.00 C ATOM 40206 HA PGR 998 27.055 138.572 52.659 1.00 0.00 H ATOM 40207 HB PGR 998 27.644 137.688 51.280 1.00 0.00 H ATOM 40208 O31 PGR 998 27.692 136.510 52.954 1.00 0.00 O ATOM 40209 P31 PGR 998 29.285 136.447 53.107 1.00 0.00 P ATOM 40210 O32 PGR 998 29.719 135.843 51.791 1.00 0.00 O ATOM 40211 C31 PGR 998 29.553 134.493 51.485 1.00 0.00 C ATOM 40212 H1A PGR 998 28.469 134.348 51.469 1.00 0.00 H ATOM 40213 H1B PGR 998 30.012 133.868 52.255 1.00 0.00 H ATOM 40214 C32 PGR 998 30.246 134.109 50.142 1.00 0.00 C ATOM 40215 H2A PGR 998 30.145 133.022 50.087 1.00 0.00 H ATOM 40216 O35 PGR 998 31.630 134.539 50.223 1.00 0.00 O ATOM 40217 HO5A PGR 998 32.072 133.927 49.607 1.00 0.00 H ATOM 40218 C33 PGR 998 29.783 134.817 48.879 1.00 0.00 C ATOM 40219 H3A PGR 998 30.547 134.650 48.114 1.00 0.00 H ATOM 40220 H3B PGR 998 28.832 134.419 48.517 1.00 0.00 H ATOM 40221 O33 PGR 998 29.755 137.843 53.140 1.00 0.00 O ATOM 40222 O34 PGR 998 29.709 135.420 54.121 1.00 0.00 O ATOM 40223 O21 PGR 998 25.563 135.975 51.040 1.00 0.00 O ATOM 40224 C21 PGR 998 25.439 134.825 51.678 1.00 0.00 C ATOM 40225 O22 PGR 998 25.463 134.708 52.909 1.00 0.00 O ATOM 40226 O36 PGR 998 29.781 136.220 49.058 1.00 0.00 O ATOM 40227 HO6A PGR 998 30.096 136.388 49.965 1.00 0.00 H ATOM 40228 C12 OL 999 25.471 133.604 50.754 1.00 0.00 C ATOM 40229 H2R OL 999 26.501 133.296 50.562 1.00 0.00 H ATOM 40230 H2S OL 999 24.807 132.834 51.154 1.00 0.00 H ATOM 40231 C13 OL 999 24.903 133.892 49.316 1.00 0.00 C ATOM 40232 H3R OL 999 24.018 134.532 49.342 1.00 0.00 H ATOM 40233 H3S OL 999 25.544 134.547 48.722 1.00 0.00 H ATOM 40234 C14 OL 999 24.635 132.649 48.546 1.00 0.00 C ATOM 40235 H4R OL 999 25.600 132.149 48.660 1.00 0.00 H ATOM 40236 H4S OL 999 23.903 132.062 49.104 1.00 0.00 H ATOM 40237 C15 OL 999 24.292 133.097 47.144 1.00 0.00 C ATOM 40238 H5R OL 999 23.519 133.867 47.200 1.00 0.00 H ATOM 40239 H5S OL 999 25.092 133.489 46.513 1.00 0.00 H ATOM 40240 C16 OL 999 23.827 131.908 46.289 1.00 0.00 C ATOM 40241 H6R OL 999 24.585 131.133 46.420 1.00 0.00 H ATOM 40242 H6S OL 999 22.869 131.546 46.669 1.00 0.00 H ATOM 40243 C17 OL 999 23.707 132.150 44.778 1.00 0.00 C ATOM 40244 H7R OL 999 23.062 132.974 44.465 1.00 0.00 H ATOM 40245 H7S OL 999 24.677 132.473 44.392 1.00 0.00 H ATOM 40246 C18 OL 999 23.209 130.890 44.005 1.00 0.00 C ATOM 40247 H8R OL 999 22.178 130.659 44.284 1.00 0.00 H ATOM 40248 H8S OL 999 23.203 131.067 42.928 1.00 0.00 H ATOM 40249 C19 OL 999 24.151 129.755 44.237 1.00 0.00 C ATOM 40250 H9R OL 999 25.204 129.900 44.009 1.00 0.00 H ATOM 40251 C110 OL 999 23.770 128.578 44.625 1.00 0.00 C ATOM 40252 H10R OL 999 24.491 127.779 44.780 1.00 0.00 H ATOM 40253 C111 OL 999 22.366 128.041 44.807 1.00 0.00 C ATOM 40254 H11R OL 999 21.578 128.797 44.794 1.00 0.00 H ATOM 40255 H11S OL 999 22.054 127.335 44.035 1.00 0.00 H ATOM 40256 C112 OL 999 22.218 127.324 46.145 1.00 0.00 C ATOM 40257 H12R OL 999 22.947 126.515 46.222 1.00 0.00 H ATOM 40258 H12S OL 999 22.425 128.026 46.955 1.00 0.00 H ATOM 40259 C113 OL 999 20.802 126.812 46.469 1.00 0.00 C ATOM 40260 H13R OL 999 20.082 127.627 46.371 1.00 0.00 H ATOM 40261 H13S OL 999 20.481 126.068 45.737 1.00 0.00 H ATOM 40262 C114 OL 999 20.566 126.213 47.974 1.00 0.00 C ATOM 40263 H14R OL 999 20.477 127.031 48.692 1.00 0.00 H ATOM 40264 H14S OL 999 19.633 125.647 47.981 1.00 0.00 H ATOM 40265 C115 OL 999 21.651 125.234 48.505 1.00 0.00 C ATOM 40266 H15R OL 999 22.613 125.749 48.548 1.00 0.00 H ATOM 40267 H15S OL 999 21.412 125.036 49.552 1.00 0.00 H ATOM 40268 C116 OL 999 21.768 123.876 47.757 1.00 0.00 C ATOM 40269 H16R OL 999 21.989 124.004 46.696 1.00 0.00 H ATOM 40270 H16S OL 999 22.656 123.418 48.199 1.00 0.00 H ATOM 40271 C117 OL 999 20.693 122.844 47.950 1.00 0.00 C ATOM 40272 H17R OL 999 20.553 122.813 49.033 1.00 0.00 H ATOM 40273 H17S OL 999 19.764 123.223 47.519 1.00 0.00 H ATOM 40274 C118 OL 999 21.137 121.452 47.411 1.00 0.00 C ATOM 40275 H18R OL 999 20.867 120.541 47.951 1.00 0.00 H ATOM 40276 H18S OL 999 22.228 121.419 47.381 1.00 0.00 H ATOM 40277 H18T OL 999 20.762 121.338 46.392 1.00 0.00 H TER 40278 OL 999 ATOM 40278 C116 PA 1000 68.813 51.231 32.412 1.00 0.00 C ATOM 40279 H16R PA 1000 69.021 51.937 33.218 1.00 0.00 H ATOM 40280 H16S PA 1000 69.558 50.435 32.479 1.00 0.00 H ATOM 40281 H16T PA 1000 67.853 50.728 32.545 1.00 0.00 H ATOM 40282 C115 PA 1000 68.783 51.870 31.018 1.00 0.00 C ATOM 40283 H15R PA 1000 68.035 52.666 31.016 1.00 0.00 H ATOM 40284 H15S PA 1000 68.505 50.971 30.464 1.00 0.00 H ATOM 40285 C114 PA 1000 70.091 52.405 30.577 1.00 0.00 C ATOM 40286 H14R PA 1000 69.875 52.996 29.684 1.00 0.00 H ATOM 40287 H14S PA 1000 70.789 51.671 30.169 1.00 0.00 H ATOM 40288 C113 PA 1000 70.758 53.208 31.595 1.00 0.00 C ATOM 40289 H13R PA 1000 71.331 52.494 32.189 1.00 0.00 H ATOM 40290 H13S PA 1000 70.127 53.626 32.382 1.00 0.00 H ATOM 40291 C112 PA 1000 71.798 54.181 31.062 1.00 0.00 C ATOM 40292 H12R PA 1000 72.358 53.663 30.280 1.00 0.00 H ATOM 40293 H12S PA 1000 72.376 54.471 31.942 1.00 0.00 H ATOM 40294 C111 PA 1000 71.361 55.476 30.442 1.00 0.00 C ATOM 40295 H11R PA 1000 70.690 56.044 31.090 1.00 0.00 H ATOM 40296 H11S PA 1000 70.701 55.277 29.596 1.00 0.00 H ATOM 40297 C110 PA 1000 72.397 56.443 29.897 1.00 0.00 C ATOM 40298 H10R PA 1000 71.798 57.264 29.498 1.00 0.00 H ATOM 40299 H10S PA 1000 72.964 55.925 29.120 1.00 0.00 H ATOM 40300 C19 PA 1000 73.374 56.839 30.913 1.00 0.00 C ATOM 40301 H9R PA 1000 74.021 56.018 31.230 1.00 0.00 H ATOM 40302 H9S PA 1000 72.753 57.097 31.774 1.00 0.00 H ATOM 40303 C18 PA 1000 74.259 58.003 30.510 1.00 0.00 C ATOM 40304 H8R PA 1000 74.657 58.266 31.493 1.00 0.00 H ATOM 40305 H8S PA 1000 73.680 58.910 30.328 1.00 0.00 H ATOM 40306 C17 PA 1000 75.168 57.792 29.285 1.00 0.00 C ATOM 40307 H7R PA 1000 75.637 58.735 28.997 1.00 0.00 H ATOM 40308 H7S PA 1000 74.479 57.459 28.507 1.00 0.00 H ATOM 40309 C16 PA 1000 76.157 56.629 29.391 1.00 0.00 C ATOM 40310 H6R PA 1000 75.605 55.695 29.271 1.00 0.00 H ATOM 40311 H6S PA 1000 76.720 56.563 30.325 1.00 0.00 H ATOM 40312 C15 PA 1000 77.193 56.728 28.176 1.00 0.00 C ATOM 40313 H5R PA 1000 77.747 57.662 28.289 1.00 0.00 H ATOM 40314 H5S PA 1000 76.466 56.792 27.364 1.00 0.00 H ATOM 40315 C14 PA 1000 78.030 55.407 28.124 1.00 0.00 C ATOM 40316 H4R PA 1000 78.529 55.391 27.153 1.00 0.00 H ATOM 40317 H4S PA 1000 77.369 54.544 28.024 1.00 0.00 H ATOM 40318 C13 PA 1000 79.045 55.196 29.242 1.00 0.00 C ATOM 40319 H3R PA 1000 78.583 54.767 30.134 1.00 0.00 H ATOM 40320 H3S PA 1000 79.505 56.168 29.433 1.00 0.00 H ATOM 40321 C12 PA 1000 80.038 54.089 28.825 1.00 0.00 C ATOM 40322 H2R PA 1000 80.863 54.018 29.536 1.00 0.00 H ATOM 40323 H2S PA 1000 80.503 54.356 27.874 1.00 0.00 H ATOM 40324 C11 PGR 1001 79.351 52.777 28.748 1.00 0.00 C ATOM 40325 O12 PGR 1001 78.812 52.223 29.689 1.00 0.00 O ATOM 40326 O11 PGR 1001 79.543 52.216 27.529 1.00 0.00 O ATOM 40327 C1 PGR 1001 78.759 51.013 27.149 1.00 0.00 C ATOM 40328 HR PGR 1001 78.667 50.245 27.921 1.00 0.00 H ATOM 40329 HS PGR 1001 79.457 50.524 26.464 1.00 0.00 H ATOM 40330 C2 PGR 1001 77.427 51.401 26.528 1.00 0.00 C ATOM 40331 HX PGR 1001 76.924 50.468 26.262 1.00 0.00 H ATOM 40332 C3 PGR 1001 77.581 52.238 25.179 1.00 0.00 C ATOM 40333 HA PGR 1001 78.059 51.587 24.443 1.00 0.00 H ATOM 40334 HB PGR 1001 78.322 53.041 25.148 1.00 0.00 H ATOM 40335 O31 PGR 1001 76.313 52.654 24.683 1.00 0.00 O ATOM 40336 P31 PGR 1001 76.278 52.976 23.134 1.00 0.00 P ATOM 40337 O32 PGR 1001 77.371 54.015 22.933 1.00 0.00 O ATOM 40338 C31 PGR 1001 77.290 55.323 23.391 1.00 0.00 C ATOM 40339 H1A PGR 1001 76.326 55.642 22.987 1.00 0.00 H ATOM 40340 H1B PGR 1001 77.384 55.426 24.475 1.00 0.00 H ATOM 40341 C32 PGR 1001 78.490 56.029 22.740 1.00 0.00 C ATOM 40342 H2A PGR 1001 78.325 55.983 21.660 1.00 0.00 H ATOM 40343 O35 PGR 1001 79.701 55.402 23.010 1.00 0.00 O ATOM 40344 HO5A PGR 1001 80.284 55.636 22.266 1.00 0.00 H ATOM 40345 C33 PGR 1001 78.582 57.488 23.167 1.00 0.00 C ATOM 40346 H3A PGR 1001 79.398 58.002 22.654 1.00 0.00 H ATOM 40347 H3B PGR 1001 77.710 58.086 22.888 1.00 0.00 H ATOM 40348 O33 PGR 1001 76.702 51.799 22.434 1.00 0.00 O ATOM 40349 O34 PGR 1001 74.966 53.603 22.857 1.00 0.00 O ATOM 40350 O21 PGR 1001 76.655 52.116 27.556 1.00 0.00 O ATOM 40351 C21 PGR 1001 75.754 51.444 28.320 1.00 0.00 C ATOM 40352 O22 PGR 1001 75.813 50.247 28.558 1.00 0.00 O ATOM 40353 O36 PGR 1001 78.770 57.517 24.585 1.00 0.00 O ATOM 40354 HO6A PGR 1001 79.648 57.167 24.820 1.00 0.00 H ATOM 40355 C12 OL 1002 74.690 52.372 28.892 1.00 0.00 C ATOM 40356 H2R OL 1002 74.568 53.120 28.106 1.00 0.00 H ATOM 40357 H2S OL 1002 73.734 51.845 28.927 1.00 0.00 H ATOM 40358 C13 OL 1002 75.137 53.065 30.243 1.00 0.00 C ATOM 40359 H3R OL 1002 76.157 53.420 30.077 1.00 0.00 H ATOM 40360 H3S OL 1002 74.461 53.912 30.372 1.00 0.00 H ATOM 40361 C14 OL 1002 75.071 52.174 31.508 1.00 0.00 C ATOM 40362 H4R OL 1002 74.093 51.731 31.709 1.00 0.00 H ATOM 40363 H4S OL 1002 75.593 51.233 31.321 1.00 0.00 H ATOM 40364 C15 OL 1002 75.428 52.901 32.717 1.00 0.00 C ATOM 40365 H5R OL 1002 74.854 53.825 32.815 1.00 0.00 H ATOM 40366 H5S OL 1002 75.018 52.222 33.467 1.00 0.00 H ATOM 40367 C16 OL 1002 76.855 53.287 32.904 1.00 0.00 C ATOM 40368 H6R OL 1002 77.509 52.414 32.855 1.00 0.00 H ATOM 40369 H6S OL 1002 77.256 53.910 32.102 1.00 0.00 H ATOM 40370 C17 OL 1002 77.288 53.872 34.223 1.00 0.00 C ATOM 40371 H7R OL 1002 78.360 54.002 34.055 1.00 0.00 H ATOM 40372 H7S OL 1002 76.950 54.887 34.441 1.00 0.00 H ATOM 40373 C18 OL 1002 77.088 53.011 35.470 1.00 0.00 C ATOM 40374 H8R OL 1002 76.061 52.687 35.652 1.00 0.00 H ATOM 40375 H8S OL 1002 77.680 52.104 35.329 1.00 0.00 H ATOM 40376 C19 OL 1002 77.477 53.876 36.694 1.00 0.00 C ATOM 40377 H9R OL 1002 76.930 54.810 36.794 1.00 0.00 H ATOM 40378 C110 OL 1002 78.447 53.544 37.611 1.00 0.00 C ATOM 40379 H10R OL 1002 78.743 54.177 38.443 1.00 0.00 H ATOM 40380 C111 OL 1002 79.240 52.286 37.606 1.00 0.00 C ATOM 40381 H11R OL 1002 78.720 51.533 38.202 1.00 0.00 H ATOM 40382 H11S OL 1002 79.217 51.911 36.580 1.00 0.00 H ATOM 40383 C112 OL 1002 80.750 52.446 38.078 1.00 0.00 C ATOM 40384 H12R OL 1002 81.346 51.591 37.750 1.00 0.00 H ATOM 40385 H12S OL 1002 81.113 53.358 37.600 1.00 0.00 H ATOM 40386 C113 OL 1002 80.881 52.485 39.631 1.00 0.00 C ATOM 40387 H13R OL 1002 80.757 53.468 40.091 1.00 0.00 H ATOM 40388 H13S OL 1002 80.172 51.756 40.028 1.00 0.00 H ATOM 40389 C114 OL 1002 82.279 51.999 40.091 1.00 0.00 C ATOM 40390 H14R OL 1002 82.387 51.044 39.573 1.00 0.00 H ATOM 40391 H14S OL 1002 82.978 52.691 39.616 1.00 0.00 H ATOM 40392 C115 OL 1002 82.405 52.017 41.627 1.00 0.00 C ATOM 40393 H15R OL 1002 82.141 53.016 41.982 1.00 0.00 H ATOM 40394 H15S OL 1002 81.647 51.320 41.989 1.00 0.00 H ATOM 40395 C116 OL 1002 83.725 51.610 42.220 1.00 0.00 C ATOM 40396 H16R OL 1002 83.643 51.521 43.306 1.00 0.00 H ATOM 40397 H16S OL 1002 83.915 50.587 41.888 1.00 0.00 H ATOM 40398 C117 OL 1002 84.805 52.561 41.866 1.00 0.00 C ATOM 40399 H17R OL 1002 85.587 52.248 42.561 1.00 0.00 H ATOM 40400 H17S OL 1002 85.031 52.578 40.798 1.00 0.00 H ATOM 40401 C118 OL 1002 84.469 54.050 42.147 1.00 0.00 C ATOM 40402 H18R OL 1002 83.561 54.430 41.673 1.00 0.00 H ATOM 40403 H18S OL 1002 85.278 54.657 41.736 1.00 0.00 H ATOM 40404 H18T OL 1002 84.309 54.062 43.227 1.00 0.00 H TER 40405 OL 1002 ATOM 40405 C116 PA 1003 66.268 74.569 40.106 1.00 0.00 C ATOM 40406 H16R PA 1003 65.544 74.389 39.309 1.00 0.00 H ATOM 40407 H16S PA 1003 65.651 74.646 41.004 1.00 0.00 H ATOM 40408 H16T PA 1003 66.961 73.744 40.285 1.00 0.00 H ATOM 40409 C115 PA 1003 67.033 75.909 40.077 1.00 0.00 C ATOM 40410 H15R PA 1003 67.481 76.106 41.053 1.00 0.00 H ATOM 40411 H15S PA 1003 66.358 76.751 39.914 1.00 0.00 H ATOM 40412 C114 PA 1003 68.189 75.777 39.043 1.00 0.00 C ATOM 40413 H14R PA 1003 67.676 75.535 38.111 1.00 0.00 H ATOM 40414 H14S PA 1003 68.752 74.854 39.198 1.00 0.00 H ATOM 40415 C113 PA 1003 69.026 76.983 38.859 1.00 0.00 C ATOM 40416 H13R PA 1003 69.599 77.181 39.767 1.00 0.00 H ATOM 40417 H13S PA 1003 68.360 77.846 38.784 1.00 0.00 H ATOM 40418 C112 PA 1003 70.017 76.946 37.687 1.00 0.00 C ATOM 40419 H12R PA 1003 69.471 76.493 36.857 1.00 0.00 H ATOM 40420 H12S PA 1003 70.757 76.165 37.873 1.00 0.00 H ATOM 40421 C111 PA 1003 70.595 78.337 37.365 1.00 0.00 C ATOM 40422 H11R PA 1003 71.313 78.591 38.146 1.00 0.00 H ATOM 40423 H11S PA 1003 69.913 79.190 37.406 1.00 0.00 H ATOM 40424 C110 PA 1003 71.270 78.288 35.989 1.00 0.00 C ATOM 40425 H10R PA 1003 71.019 77.352 35.485 1.00 0.00 H ATOM 40426 H10S PA 1003 72.333 78.106 36.160 1.00 0.00 H ATOM 40427 C19 PA 1003 71.202 79.535 35.151 1.00 0.00 C ATOM 40428 H9R PA 1003 71.193 80.389 35.831 1.00 0.00 H ATOM 40429 H9S PA 1003 70.168 79.598 34.807 1.00 0.00 H ATOM 40430 C18 PA 1003 72.228 79.586 34.003 1.00 0.00 C ATOM 40431 H8R PA 1003 73.225 79.432 34.420 1.00 0.00 H ATOM 40432 H8S PA 1003 72.225 80.566 33.521 1.00 0.00 H ATOM 40433 C17 PA 1003 71.962 78.652 32.866 1.00 0.00 C ATOM 40434 H7R PA 1003 72.186 79.180 31.937 1.00 0.00 H ATOM 40435 H7S PA 1003 70.888 78.501 32.745 1.00 0.00 H ATOM 40436 C16 PA 1003 72.750 77.347 32.994 1.00 0.00 C ATOM 40437 H6R PA 1003 72.232 76.609 33.610 1.00 0.00 H ATOM 40438 H6S PA 1003 73.690 77.426 33.544 1.00 0.00 H ATOM 40439 C15 PA 1003 73.004 76.661 31.634 1.00 0.00 C ATOM 40440 H5R PA 1003 73.520 77.203 30.838 1.00 0.00 H ATOM 40441 H5S PA 1003 72.036 76.415 31.192 1.00 0.00 H ATOM 40442 C14 PA 1003 73.861 75.443 31.833 1.00 0.00 C ATOM 40443 H4R PA 1003 73.550 74.773 32.636 1.00 0.00 H ATOM 40444 H4S PA 1003 74.869 75.712 32.156 1.00 0.00 H ATOM 40445 C13 PA 1003 74.017 74.556 30.553 1.00 0.00 C ATOM 40446 H3R PA 1003 73.074 74.035 30.374 1.00 0.00 H ATOM 40447 H3S PA 1003 74.785 73.801 30.731 1.00 0.00 H ATOM 40448 C12 PA 1003 74.457 75.438 29.353 1.00 0.00 C ATOM 40449 H2R PA 1003 75.230 76.189 29.527 1.00 0.00 H ATOM 40450 H2S PA 1003 73.528 75.888 28.997 1.00 0.00 H ATOM 40451 C11 PC 1004 74.992 74.668 28.222 1.00 0.00 C ATOM 40452 O12 PC 1004 74.383 74.325 27.217 1.00 0.00 O ATOM 40453 O11 PC 1004 76.273 74.243 28.493 1.00 0.00 O ATOM 40454 C1 PC 1004 76.844 73.412 27.434 1.00 0.00 C ATOM 40455 HR PC 1004 76.783 74.032 26.536 1.00 0.00 H ATOM 40456 HS PC 1004 76.307 72.465 27.332 1.00 0.00 H ATOM 40457 C2 PC 1004 78.308 73.108 27.834 1.00 0.00 C ATOM 40458 HX PC 1004 78.795 73.885 28.429 1.00 0.00 H ATOM 40459 C3 PC 1004 79.200 72.880 26.535 1.00 0.00 C ATOM 40460 HA PC 1004 80.217 72.659 26.869 1.00 0.00 H ATOM 40461 HB PC 1004 79.429 73.805 26.000 1.00 0.00 H ATOM 40462 O31 PC 1004 78.628 71.892 25.748 1.00 0.00 O ATOM 40463 P31 PC 1004 79.394 71.128 24.744 1.00 0.00 P ATOM 40464 O32 PC 1004 79.170 71.997 23.416 1.00 0.00 O ATOM 40465 C31 PC 1004 79.870 71.779 22.208 1.00 0.00 C ATOM 40466 H1A PC 1004 79.661 70.754 21.891 1.00 0.00 H ATOM 40467 H1B PC 1004 80.940 71.798 22.434 1.00 0.00 H ATOM 40468 C32 PC 1004 79.578 72.777 21.090 1.00 0.00 C ATOM 40469 H2A PC 1004 80.408 72.670 20.390 1.00 0.00 H ATOM 40470 H2B PC 1004 79.475 73.753 21.568 1.00 0.00 H ATOM 40471 N31 PC 1004 78.227 72.613 20.435 1.00 0.00 N ATOM 40472 C33 PC 1004 77.983 71.263 19.782 1.00 0.00 C ATOM 40473 H3A PC 1004 77.812 70.421 20.455 1.00 0.00 H ATOM 40474 H3B PC 1004 78.846 70.959 19.189 1.00 0.00 H ATOM 40475 H3C PC 1004 77.088 71.247 19.157 1.00 0.00 H ATOM 40476 C34 PC 1004 77.107 72.786 21.428 1.00 0.00 C ATOM 40477 H4A PC 1004 77.207 73.804 21.806 1.00 0.00 H ATOM 40478 H4B PC 1004 77.084 72.100 22.276 1.00 0.00 H ATOM 40479 H4C PC 1004 76.172 72.675 20.877 1.00 0.00 H ATOM 40480 C35 PC 1004 77.983 73.670 19.444 1.00 0.00 C ATOM 40481 H5A PC 1004 78.772 73.560 18.699 1.00 0.00 H ATOM 40482 H5B PC 1004 77.988 74.667 19.887 1.00 0.00 H ATOM 40483 H5C PC 1004 77.030 73.377 19.002 1.00 0.00 H ATOM 40484 O33 PC 1004 80.859 71.119 25.057 1.00 0.00 O ATOM 40485 O34 PC 1004 78.756 69.814 24.543 1.00 0.00 O ATOM 40486 O21 PC 1004 78.175 71.815 28.520 1.00 0.00 O ATOM 40487 C21 PC 1004 79.247 71.157 29.039 1.00 0.00 C ATOM 40488 O22 PC 1004 80.298 71.730 29.295 1.00 0.00 O ATOM 40489 C12 OL 1005 78.847 69.731 29.334 1.00 0.00 C ATOM 40490 H2R OL 1005 78.203 69.369 28.530 1.00 0.00 H ATOM 40491 H2S OL 1005 79.675 69.027 29.439 1.00 0.00 H ATOM 40492 C13 OL 1005 78.216 69.496 30.774 1.00 0.00 C ATOM 40493 H3R OL 1005 78.940 69.655 31.576 1.00 0.00 H ATOM 40494 H3S OL 1005 77.382 70.198 30.854 1.00 0.00 H ATOM 40495 C14 OL 1005 77.572 68.165 30.955 1.00 0.00 C ATOM 40496 H4R OL 1005 76.746 68.124 31.668 1.00 0.00 H ATOM 40497 H4S OL 1005 77.196 67.829 29.987 1.00 0.00 H ATOM 40498 C15 OL 1005 78.526 66.996 31.360 1.00 0.00 C ATOM 40499 H5R OL 1005 77.942 66.151 31.729 1.00 0.00 H ATOM 40500 H5S OL 1005 79.183 66.787 30.514 1.00 0.00 H ATOM 40501 C16 OL 1005 79.503 67.287 32.579 1.00 0.00 C ATOM 40502 H6R OL 1005 80.205 66.451 32.550 1.00 0.00 H ATOM 40503 H6S OL 1005 80.212 68.088 32.357 1.00 0.00 H ATOM 40504 C17 OL 1005 78.792 67.514 33.846 1.00 0.00 C ATOM 40505 H7R OL 1005 78.351 68.502 33.993 1.00 0.00 H ATOM 40506 H7S OL 1005 77.977 66.787 33.827 1.00 0.00 H ATOM 40507 C18 OL 1005 79.710 67.280 35.007 1.00 0.00 C ATOM 40508 H8R OL 1005 80.120 66.269 34.987 1.00 0.00 H ATOM 40509 H8S OL 1005 80.528 68.003 35.004 1.00 0.00 H ATOM 40510 C19 OL 1005 79.071 67.496 36.303 1.00 0.00 C ATOM 40511 H9R OL 1005 78.475 68.405 36.316 1.00 0.00 H ATOM 40512 C110 OL 1005 79.180 66.823 37.406 1.00 0.00 C ATOM 40513 H10R OL 1005 78.526 67.175 38.199 1.00 0.00 H ATOM 40514 C111 OL 1005 80.114 65.698 37.784 1.00 0.00 C ATOM 40515 H11R OL 1005 81.045 65.606 37.221 1.00 0.00 H ATOM 40516 H11S OL 1005 80.478 65.925 38.789 1.00 0.00 H ATOM 40517 C112 OL 1005 79.420 64.304 37.738 1.00 0.00 C ATOM 40518 H12R OL 1005 78.749 64.269 36.877 1.00 0.00 H ATOM 40519 H12S OL 1005 80.314 63.677 37.703 1.00 0.00 H ATOM 40520 C113 OL 1005 78.686 64.028 39.051 1.00 0.00 C ATOM 40521 H13R OL 1005 79.293 64.394 39.882 1.00 0.00 H ATOM 40522 H13S OL 1005 77.789 64.649 39.091 1.00 0.00 H ATOM 40523 C114 OL 1005 78.315 62.519 39.361 1.00 0.00 C ATOM 40524 H14R OL 1005 79.248 61.952 39.349 1.00 0.00 H ATOM 40525 H14S OL 1005 77.871 62.440 40.356 1.00 0.00 H ATOM 40526 C115 OL 1005 77.293 61.778 38.454 1.00 0.00 C ATOM 40527 H15R OL 1005 77.649 61.434 37.481 1.00 0.00 H ATOM 40528 H15S OL 1005 76.990 60.817 38.875 1.00 0.00 H ATOM 40529 C116 OL 1005 76.003 62.526 37.928 1.00 0.00 C ATOM 40530 H16R OL 1005 75.351 62.839 38.746 1.00 0.00 H ATOM 40531 H16S OL 1005 76.265 63.448 37.405 1.00 0.00 H ATOM 40532 C117 OL 1005 75.197 61.576 36.990 1.00 0.00 C ATOM 40533 H17R OL 1005 75.705 61.241 36.083 1.00 0.00 H ATOM 40534 H17S OL 1005 74.952 60.680 37.564 1.00 0.00 H ATOM 40535 C118 OL 1005 73.844 62.233 36.573 1.00 0.00 C ATOM 40536 H18R OL 1005 73.959 63.012 35.818 1.00 0.00 H ATOM 40537 H18S OL 1005 73.292 62.720 37.380 1.00 0.00 H ATOM 40538 H18T OL 1005 73.265 61.451 36.077 1.00 0.00 H TER 40539 OL 1005 ATOM 40539 C116 PA 1006 113.232 69.314 41.470 1.00 0.00 C ATOM 40540 H16R PA 1006 113.762 69.298 40.515 1.00 0.00 H ATOM 40541 H16S PA 1006 113.646 68.460 42.010 1.00 0.00 H ATOM 40542 H16T PA 1006 113.356 70.269 41.986 1.00 0.00 H ATOM 40543 C115 PA 1006 111.717 68.963 41.393 1.00 0.00 C ATOM 40544 H15R PA 1006 111.059 69.724 40.968 1.00 0.00 H ATOM 40545 H15S PA 1006 111.255 68.801 42.369 1.00 0.00 H ATOM 40546 C114 PA 1006 111.504 67.772 40.575 1.00 0.00 C ATOM 40547 H14R PA 1006 111.898 66.959 41.189 1.00 0.00 H ATOM 40548 H14S PA 1006 112.110 67.678 39.671 1.00 0.00 H ATOM 40549 C113 PA 1006 110.094 67.381 40.180 1.00 0.00 C ATOM 40550 H13R PA 1006 109.740 68.165 39.507 1.00 0.00 H ATOM 40551 H13S PA 1006 109.388 67.482 41.007 1.00 0.00 H ATOM 40552 C112 PA 1006 109.933 66.048 39.386 1.00 0.00 C ATOM 40553 H12R PA 1006 108.898 66.049 39.035 1.00 0.00 H ATOM 40554 H12S PA 1006 110.116 65.231 40.086 1.00 0.00 H ATOM 40555 C111 PA 1006 110.756 66.082 38.089 1.00 0.00 C ATOM 40556 H11R PA 1006 111.811 66.164 38.361 1.00 0.00 H ATOM 40557 H11S PA 1006 110.481 67.001 37.566 1.00 0.00 H ATOM 40558 C110 PA 1006 110.462 65.012 37.084 1.00 0.00 C ATOM 40559 H10R PA 1006 109.420 64.950 36.762 1.00 0.00 H ATOM 40560 H10S PA 1006 110.629 64.033 37.536 1.00 0.00 H ATOM 40561 C19 PA 1006 111.306 65.218 35.901 1.00 0.00 C ATOM 40562 H9R PA 1006 112.310 65.582 36.126 1.00 0.00 H ATOM 40563 H9S PA 1006 110.748 65.943 35.305 1.00 0.00 H ATOM 40564 C18 PA 1006 111.547 63.953 35.066 1.00 0.00 C ATOM 40565 H8R PA 1006 110.640 63.345 35.092 1.00 0.00 H ATOM 40566 H8S PA 1006 112.423 63.458 35.491 1.00 0.00 H ATOM 40567 C17 PA 1006 111.877 64.222 33.532 1.00 0.00 C ATOM 40568 H7R PA 1006 112.675 64.965 33.578 1.00 0.00 H ATOM 40569 H7S PA 1006 111.070 64.744 33.014 1.00 0.00 H ATOM 40570 C16 PA 1006 112.323 62.943 32.718 1.00 0.00 C ATOM 40571 H6R PA 1006 111.455 62.292 32.591 1.00 0.00 H ATOM 40572 H6S PA 1006 112.955 62.353 33.385 1.00 0.00 H ATOM 40573 C15 PA 1006 112.892 63.369 31.374 1.00 0.00 C ATOM 40574 H5R PA 1006 113.715 64.070 31.529 1.00 0.00 H ATOM 40575 H5S PA 1006 112.171 64.015 30.869 1.00 0.00 H ATOM 40576 C14 PA 1006 113.208 62.188 30.445 1.00 0.00 C ATOM 40577 H4R PA 1006 112.384 61.477 30.349 1.00 0.00 H ATOM 40578 H4S PA 1006 114.032 61.540 30.750 1.00 0.00 H ATOM 40579 C13 PA 1006 113.572 62.618 29.017 1.00 0.00 C ATOM 40580 H3R PA 1006 112.671 62.757 28.415 1.00 0.00 H ATOM 40581 H3S PA 1006 113.961 61.731 28.512 1.00 0.00 H ATOM 40582 C12 PA 1006 114.570 63.787 28.880 1.00 0.00 C ATOM 40583 H2R PA 1006 115.593 63.486 29.115 1.00 0.00 H ATOM 40584 H2S PA 1006 114.426 64.681 29.491 1.00 0.00 H ATOM 40585 C11 PC 1007 114.457 64.381 27.517 1.00 0.00 C ATOM 40586 O12 PC 1007 115.411 64.406 26.793 1.00 0.00 O ATOM 40587 O11 PC 1007 113.255 64.793 27.211 1.00 0.00 O ATOM 40588 C1 PC 1007 112.978 65.308 25.895 1.00 0.00 C ATOM 40589 HR PC 1007 113.321 64.526 25.212 1.00 0.00 H ATOM 40590 HS PC 1007 113.483 66.229 25.595 1.00 0.00 H ATOM 40591 C2 PC 1007 111.488 65.483 25.761 1.00 0.00 C ATOM 40592 HX PC 1007 111.034 64.545 26.091 1.00 0.00 H ATOM 40593 C3 PC 1007 111.074 65.676 24.346 1.00 0.00 C ATOM 40594 HA PC 1007 111.534 64.885 23.748 1.00 0.00 H ATOM 40595 HB PC 1007 111.399 66.666 24.016 1.00 0.00 H ATOM 40596 O31 PC 1007 109.686 65.433 24.050 1.00 0.00 O ATOM 40597 P31 PC 1007 109.085 65.732 22.624 1.00 0.00 P ATOM 40598 O32 PC 1007 109.857 64.789 21.710 1.00 0.00 O ATOM 40599 C31 PC 1007 109.560 63.450 21.614 1.00 0.00 C ATOM 40600 H1A PC 1007 108.540 63.286 21.260 1.00 0.00 H ATOM 40601 H1B PC 1007 109.571 63.021 22.619 1.00 0.00 H ATOM 40602 C32 PC 1007 110.546 62.844 20.624 1.00 0.00 C ATOM 40603 H2A PC 1007 110.472 61.763 20.752 1.00 0.00 H ATOM 40604 H2B PC 1007 111.547 63.060 21.000 1.00 0.00 H ATOM 40605 N31 PC 1007 110.648 63.109 19.095 1.00 0.00 N ATOM 40606 C33 PC 1007 111.898 62.477 18.620 1.00 0.00 C ATOM 40607 H3A PC 1007 111.965 61.422 18.889 1.00 0.00 H ATOM 40608 H3B PC 1007 112.685 63.126 19.007 1.00 0.00 H ATOM 40609 H3C PC 1007 111.861 62.569 17.533 1.00 0.00 H ATOM 40610 C34 PC 1007 109.463 62.443 18.404 1.00 0.00 C ATOM 40611 H4A PC 1007 108.524 62.735 18.878 1.00 0.00 H ATOM 40612 H4B PC 1007 109.538 61.363 18.537 1.00 0.00 H ATOM 40613 H4C PC 1007 109.312 62.679 17.350 1.00 0.00 H ATOM 40614 C35 PC 1007 110.567 64.554 18.676 1.00 0.00 C ATOM 40615 H5A PC 1007 110.207 64.644 17.650 1.00 0.00 H ATOM 40616 H5B PC 1007 111.552 64.979 18.874 1.00 0.00 H ATOM 40617 H5C PC 1007 109.834 65.056 19.310 1.00 0.00 H ATOM 40618 O33 PC 1007 107.684 65.337 22.692 1.00 0.00 O ATOM 40619 O34 PC 1007 109.445 67.115 22.265 1.00 0.00 O ATOM 40620 O21 PC 1007 111.014 66.476 26.752 1.00 0.00 O ATOM 40621 C21 PC 1007 111.229 67.805 26.700 1.00 0.00 C ATOM 40622 O22 PC 1007 112.107 68.422 26.073 1.00 0.00 O ATOM 40623 C12 OL 1008 110.326 68.512 27.579 1.00 0.00 C ATOM 40624 H2R OL 1008 110.520 69.580 27.463 1.00 0.00 H ATOM 40625 H2S OL 1008 109.313 68.142 27.411 1.00 0.00 H ATOM 40626 C13 OL 1008 110.674 68.164 28.990 1.00 0.00 C ATOM 40627 H3R OL 1008 110.634 67.108 29.265 1.00 0.00 H ATOM 40628 H3S OL 1008 111.751 68.244 29.151 1.00 0.00 H ATOM 40629 C14 OL 1008 109.917 69.094 29.936 1.00 0.00 C ATOM 40630 H4R OL 1008 110.182 70.109 29.634 1.00 0.00 H ATOM 40631 H4S OL 1008 108.869 68.936 29.676 1.00 0.00 H ATOM 40632 C15 OL 1008 110.111 68.716 31.366 1.00 0.00 C ATOM 40633 H5R OL 1008 111.131 68.945 31.678 1.00 0.00 H ATOM 40634 H5S OL 1008 109.564 69.403 32.015 1.00 0.00 H ATOM 40635 C16 OL 1008 109.588 67.295 31.817 1.00 0.00 C ATOM 40636 H6R OL 1008 110.141 66.473 31.356 1.00 0.00 H ATOM 40637 H6S OL 1008 109.683 67.066 32.881 1.00 0.00 H ATOM 40638 C17 OL 1008 108.150 67.013 31.529 1.00 0.00 C ATOM 40639 H7R OL 1008 107.610 67.922 31.804 1.00 0.00 H ATOM 40640 H7S OL 1008 108.029 66.938 30.447 1.00 0.00 H ATOM 40641 C18 OL 1008 107.420 65.866 32.295 1.00 0.00 C ATOM 40642 H8R OL 1008 107.578 65.936 33.373 1.00 0.00 H ATOM 40643 H8S OL 1008 106.352 65.934 32.074 1.00 0.00 H ATOM 40644 C19 OL 1008 107.957 64.596 31.769 1.00 0.00 C ATOM 40645 H9R OL 1008 108.237 64.628 30.719 1.00 0.00 H ATOM 40646 C110 OL 1008 107.801 63.349 32.314 1.00 0.00 C ATOM 40647 H10R OL 1008 108.032 62.542 31.624 1.00 0.00 H ATOM 40648 C111 OL 1008 107.356 62.963 33.706 1.00 0.00 C ATOM 40649 H11R OL 1008 108.188 62.554 34.282 1.00 0.00 H ATOM 40650 H11S OL 1008 106.956 63.788 34.299 1.00 0.00 H ATOM 40651 C112 OL 1008 106.204 61.940 33.514 1.00 0.00 C ATOM 40652 H12R OL 1008 105.414 62.268 32.834 1.00 0.00 H ATOM 40653 H12S OL 1008 106.702 61.120 32.993 1.00 0.00 H ATOM 40654 C113 OL 1008 105.690 61.319 34.813 1.00 0.00 C ATOM 40655 H13R OL 1008 106.545 61.077 35.447 1.00 0.00 H ATOM 40656 H13S OL 1008 105.098 62.093 35.305 1.00 0.00 H ATOM 40657 C114 OL 1008 104.895 60.027 34.502 1.00 0.00 C ATOM 40658 H14R OL 1008 104.014 60.333 33.934 1.00 0.00 H ATOM 40659 H14S OL 1008 105.414 59.276 33.901 1.00 0.00 H ATOM 40660 C115 OL 1008 104.435 59.322 35.825 1.00 0.00 C ATOM 40661 H15R OL 1008 104.045 60.103 36.482 1.00 0.00 H ATOM 40662 H15S OL 1008 103.723 58.523 35.612 1.00 0.00 H ATOM 40663 C116 OL 1008 105.545 58.566 36.465 1.00 0.00 C ATOM 40664 H16R OL 1008 106.004 57.922 35.712 1.00 0.00 H ATOM 40665 H16S OL 1008 106.300 59.255 36.851 1.00 0.00 H ATOM 40666 C117 OL 1008 105.150 57.707 37.642 1.00 0.00 C ATOM 40667 H17R OL 1008 104.451 56.904 37.398 1.00 0.00 H ATOM 40668 H17S OL 1008 106.025 57.114 37.914 1.00 0.00 H ATOM 40669 C118 OL 1008 104.481 58.484 38.876 1.00 0.00 C ATOM 40670 H18R OL 1008 103.588 58.997 38.513 1.00 0.00 H ATOM 40671 H18S OL 1008 105.214 59.245 39.150 1.00 0.00 H ATOM 40672 H18T OL 1008 104.274 57.800 39.702 1.00 0.00 H TER 40673 OL 1008 ATOM 40673 C116 PA 1009 79.753 75.374 41.305 1.00 0.00 C ATOM 40674 H16R PA 1009 78.985 76.147 41.378 1.00 0.00 H ATOM 40675 H16S PA 1009 80.579 75.687 40.664 1.00 0.00 H ATOM 40676 H16T PA 1009 80.199 75.364 42.302 1.00 0.00 H ATOM 40677 C115 PA 1009 79.379 74.058 40.654 1.00 0.00 C ATOM 40678 H15R PA 1009 78.796 73.368 41.267 1.00 0.00 H ATOM 40679 H15S PA 1009 80.300 73.471 40.686 1.00 0.00 H ATOM 40680 C114 PA 1009 79.027 74.263 39.160 1.00 0.00 C ATOM 40681 H14R PA 1009 79.885 74.674 38.624 1.00 0.00 H ATOM 40682 H14S PA 1009 78.258 75.036 39.093 1.00 0.00 H ATOM 40683 C113 PA 1009 78.515 73.029 38.524 1.00 0.00 C ATOM 40684 H13R PA 1009 77.451 72.856 38.694 1.00 0.00 H ATOM 40685 H13S PA 1009 79.023 72.167 38.962 1.00 0.00 H ATOM 40686 C112 PA 1009 78.726 73.041 37.039 1.00 0.00 C ATOM 40687 H12R PA 1009 79.814 73.055 36.946 1.00 0.00 H ATOM 40688 H12S PA 1009 78.271 73.940 36.616 1.00 0.00 H ATOM 40689 C111 PA 1009 78.156 71.787 36.318 1.00 0.00 C ATOM 40690 H11R PA 1009 77.085 71.946 36.461 1.00 0.00 H ATOM 40691 H11S PA 1009 78.480 70.871 36.816 1.00 0.00 H ATOM 40692 C110 PA 1009 78.651 71.633 34.888 1.00 0.00 C ATOM 40693 H10R PA 1009 78.154 70.761 34.459 1.00 0.00 H ATOM 40694 H10S PA 1009 79.721 71.428 34.962 1.00 0.00 H ATOM 40695 C19 PA 1009 78.329 72.848 34.014 1.00 0.00 C ATOM 40696 H9R PA 1009 78.986 73.612 34.436 1.00 0.00 H ATOM 40697 H9S PA 1009 77.310 73.224 34.127 1.00 0.00 H ATOM 40698 C18 PA 1009 78.405 72.654 32.507 1.00 0.00 C ATOM 40699 H8R PA 1009 77.700 71.867 32.228 1.00 0.00 H ATOM 40700 H8S PA 1009 79.378 72.301 32.159 1.00 0.00 H ATOM 40701 C17 PA 1009 77.873 73.883 31.659 1.00 0.00 C ATOM 40702 H7R PA 1009 76.944 74.114 32.185 1.00 0.00 H ATOM 40703 H7S PA 1009 77.573 73.723 30.622 1.00 0.00 H ATOM 40704 C16 PA 1009 78.900 74.972 31.643 1.00 0.00 C ATOM 40705 H6R PA 1009 79.819 74.744 31.098 1.00 0.00 H ATOM 40706 H6S PA 1009 79.225 75.188 32.663 1.00 0.00 H ATOM 40707 C15 PA 1009 78.380 76.326 31.175 1.00 0.00 C ATOM 40708 H5R PA 1009 78.902 76.979 31.878 1.00 0.00 H ATOM 40709 H5S PA 1009 77.308 76.426 31.356 1.00 0.00 H ATOM 40710 C14 PA 1009 78.491 76.696 29.662 1.00 0.00 C ATOM 40711 H4R PA 1009 77.945 75.966 29.059 1.00 0.00 H ATOM 40712 H4S PA 1009 79.520 76.616 29.306 1.00 0.00 H ATOM 40713 C13 PA 1009 77.997 78.120 29.258 1.00 0.00 C ATOM 40714 H3R PA 1009 78.383 78.708 30.093 1.00 0.00 H ATOM 40715 H3S PA 1009 76.913 78.077 29.382 1.00 0.00 H ATOM 40716 C12 PA 1009 78.209 78.554 27.798 1.00 0.00 C ATOM 40717 H2R PA 1009 77.847 79.583 27.843 1.00 0.00 H ATOM 40718 H2S PA 1009 79.283 78.593 27.605 1.00 0.00 H ATOM 40719 C11 PC 1010 77.359 77.791 26.866 1.00 0.00 C ATOM 40720 O12 PC 1010 77.743 76.942 26.031 1.00 0.00 O ATOM 40721 O11 PC 1010 76.079 78.252 27.010 1.00 0.00 O ATOM 40722 C1 PC 1010 75.109 77.883 26.013 1.00 0.00 C ATOM 40723 HR PC 1010 75.048 76.793 25.972 1.00 0.00 H ATOM 40724 HS PC 1010 75.351 78.260 25.016 1.00 0.00 H ATOM 40725 C2 PC 1010 73.812 78.499 26.474 1.00 0.00 C ATOM 40726 HX PC 1010 73.481 77.957 27.364 1.00 0.00 H ATOM 40727 C3 PC 1010 72.664 78.392 25.400 1.00 0.00 C ATOM 40728 HA PC 1010 71.863 79.109 25.601 1.00 0.00 H ATOM 40729 HB PC 1010 72.207 77.409 25.264 1.00 0.00 H ATOM 40730 O31 PC 1010 73.113 78.877 24.159 1.00 0.00 O ATOM 40731 P31 PC 1010 71.983 79.486 23.140 1.00 0.00 P ATOM 40732 O32 PC 1010 72.839 80.248 22.074 1.00 0.00 O ATOM 40733 C31 PC 1010 73.181 81.605 22.265 1.00 0.00 C ATOM 40734 H1A PC 1010 73.586 81.728 23.273 1.00 0.00 H ATOM 40735 H1B PC 1010 72.245 82.150 22.121 1.00 0.00 H ATOM 40736 C32 PC 1010 74.195 82.021 21.178 1.00 0.00 C ATOM 40737 H2A PC 1010 74.407 83.064 21.416 1.00 0.00 H ATOM 40738 H2B PC 1010 73.744 81.821 20.205 1.00 0.00 H ATOM 40739 N31 PC 1010 75.545 81.343 20.991 1.00 0.00 N ATOM 40740 C33 PC 1010 76.307 81.451 22.267 1.00 0.00 C ATOM 40741 H3A PC 1010 77.260 80.965 22.053 1.00 0.00 H ATOM 40742 H3B PC 1010 75.619 81.081 23.029 1.00 0.00 H ATOM 40743 H3C PC 1010 76.408 82.536 22.325 1.00 0.00 H ATOM 40744 C34 PC 1010 75.516 79.900 20.465 1.00 0.00 C ATOM 40745 H4A PC 1010 76.562 79.592 20.429 1.00 0.00 H ATOM 40746 H4B PC 1010 75.029 80.105 19.510 1.00 0.00 H ATOM 40747 H4C PC 1010 74.951 79.270 21.153 1.00 0.00 H ATOM 40748 C35 PC 1010 76.242 82.053 19.882 1.00 0.00 C ATOM 40749 H5A PC 1010 76.703 82.928 20.343 1.00 0.00 H ATOM 40750 H5B PC 1010 75.469 82.397 19.193 1.00 0.00 H ATOM 40751 H5C PC 1010 77.043 81.469 19.426 1.00 0.00 H ATOM 40752 O33 PC 1010 71.432 78.280 22.459 1.00 0.00 O ATOM 40753 O34 PC 1010 71.063 80.435 23.793 1.00 0.00 O ATOM 40754 O21 PC 1010 73.945 79.917 26.826 1.00 0.00 O ATOM 40755 C21 PC 1010 73.054 80.484 27.709 1.00 0.00 C ATOM 40756 O22 PC 1010 72.141 79.895 28.209 1.00 0.00 O ATOM 40757 C12 OL 1011 73.538 81.802 28.149 1.00 0.00 C ATOM 40758 H2R OL 1011 74.259 82.089 27.381 1.00 0.00 H ATOM 40759 H2S OL 1011 72.679 82.450 27.960 1.00 0.00 H ATOM 40760 C13 OL 1011 74.060 81.659 29.571 1.00 0.00 C ATOM 40761 H3R OL 1011 73.962 82.710 29.853 1.00 0.00 H ATOM 40762 H3S OL 1011 73.454 81.077 30.269 1.00 0.00 H ATOM 40763 C14 OL 1011 75.465 81.313 29.632 1.00 0.00 C ATOM 40764 H4R OL 1011 75.715 80.468 28.987 1.00 0.00 H ATOM 40765 H4S OL 1011 76.087 82.105 29.210 1.00 0.00 H ATOM 40766 C15 OL 1011 76.104 81.133 30.968 1.00 0.00 C ATOM 40767 H5R OL 1011 77.184 80.983 30.904 1.00 0.00 H ATOM 40768 H5S OL 1011 75.945 81.987 31.631 1.00 0.00 H ATOM 40769 C16 OL 1011 75.567 79.883 31.704 1.00 0.00 C ATOM 40770 H6R OL 1011 74.476 79.840 31.699 1.00 0.00 H ATOM 40771 H6S OL 1011 75.780 78.988 31.115 1.00 0.00 H ATOM 40772 C17 OL 1011 76.067 79.772 33.164 1.00 0.00 C ATOM 40773 H7R OL 1011 75.817 80.703 33.677 1.00 0.00 H ATOM 40774 H7S OL 1011 75.560 79.050 33.808 1.00 0.00 H ATOM 40775 C18 OL 1011 77.626 79.558 33.342 1.00 0.00 C ATOM 40776 H8R OL 1011 77.873 78.609 32.861 1.00 0.00 H ATOM 40777 H8S OL 1011 78.178 80.374 32.870 1.00 0.00 H ATOM 40778 C19 OL 1011 77.876 79.604 34.861 1.00 0.00 C ATOM 40779 H9R OL 1011 78.095 80.600 35.239 1.00 0.00 H ATOM 40780 C110 OL 1011 77.812 78.566 35.664 1.00 0.00 C ATOM 40781 H10R OL 1011 77.894 78.742 36.734 1.00 0.00 H ATOM 40782 C111 OL 1011 77.701 77.105 35.290 1.00 0.00 C ATOM 40783 H11R OL 1011 78.269 76.911 34.377 1.00 0.00 H ATOM 40784 H11S OL 1011 78.158 76.464 36.046 1.00 0.00 H ATOM 40785 C112 OL 1011 76.197 76.632 35.137 1.00 0.00 C ATOM 40786 H12R OL 1011 75.820 76.924 34.154 1.00 0.00 H ATOM 40787 H12S OL 1011 76.173 75.554 34.963 1.00 0.00 H ATOM 40788 C113 OL 1011 75.253 76.999 36.267 1.00 0.00 C ATOM 40789 H13R OL 1011 75.057 78.073 36.293 1.00 0.00 H ATOM 40790 H13S OL 1011 74.270 76.615 35.986 1.00 0.00 H ATOM 40791 C114 OL 1011 75.735 76.459 37.659 1.00 0.00 C ATOM 40792 H14R OL 1011 75.741 75.370 37.588 1.00 0.00 H ATOM 40793 H14S OL 1011 76.776 76.741 37.834 1.00 0.00 H ATOM 40794 C115 OL 1011 74.846 76.803 38.832 1.00 0.00 C ATOM 40795 H15R OL 1011 75.081 77.827 39.132 1.00 0.00 H ATOM 40796 H15S OL 1011 73.795 76.788 38.535 1.00 0.00 H ATOM 40797 C116 OL 1011 75.109 75.859 39.989 1.00 0.00 C ATOM 40798 H16R OL 1011 74.770 74.852 39.737 1.00 0.00 H ATOM 40799 H16S OL 1011 76.195 75.841 40.103 1.00 0.00 H ATOM 40800 C117 OL 1011 74.482 76.348 41.272 1.00 0.00 C ATOM 40801 H17R OL 1011 74.474 77.439 41.235 1.00 0.00 H ATOM 40802 H17S OL 1011 73.462 75.960 41.308 1.00 0.00 H ATOM 40803 C118 OL 1011 75.191 75.836 42.482 1.00 0.00 C ATOM 40804 H18R OL 1011 74.831 76.287 43.410 1.00 0.00 H ATOM 40805 H18S OL 1011 76.283 75.865 42.473 1.00 0.00 H ATOM 40806 H18T OL 1011 74.927 74.791 42.660 1.00 0.00 H TER 40807 OL 1011 ATOM 40807 C116 PA 1012 108.372 81.888 38.409 1.00 0.00 C ATOM 40808 H16R PA 1012 108.266 81.619 39.462 1.00 0.00 H ATOM 40809 H16S PA 1012 107.879 81.025 37.956 1.00 0.00 H ATOM 40810 H16T PA 1012 107.768 82.796 38.346 1.00 0.00 H ATOM 40811 C115 PA 1012 109.772 82.180 37.832 1.00 0.00 C ATOM 40812 H15R PA 1012 110.245 81.200 37.931 1.00 0.00 H ATOM 40813 H15S PA 1012 110.387 82.915 38.356 1.00 0.00 H ATOM 40814 C114 PA 1012 109.664 82.573 36.325 1.00 0.00 C ATOM 40815 H14R PA 1012 109.325 83.566 36.022 1.00 0.00 H ATOM 40816 H14S PA 1012 108.911 81.885 35.936 1.00 0.00 H ATOM 40817 C113 PA 1012 110.892 82.365 35.510 1.00 0.00 C ATOM 40818 H13R PA 1012 111.196 81.350 35.775 1.00 0.00 H ATOM 40819 H13S PA 1012 111.732 82.967 35.862 1.00 0.00 H ATOM 40820 C112 PA 1012 110.633 82.437 33.956 1.00 0.00 C ATOM 40821 H12R PA 1012 110.155 83.405 33.791 1.00 0.00 H ATOM 40822 H12S PA 1012 109.915 81.664 33.676 1.00 0.00 H ATOM 40823 C111 PA 1012 111.843 82.258 33.044 1.00 0.00 C ATOM 40824 H11R PA 1012 112.649 82.866 33.459 1.00 0.00 H ATOM 40825 H11S PA 1012 111.593 82.601 32.037 1.00 0.00 H ATOM 40826 C110 PA 1012 112.374 80.834 33.082 1.00 0.00 C ATOM 40827 H10R PA 1012 111.737 80.059 32.650 1.00 0.00 H ATOM 40828 H10S PA 1012 112.601 80.488 34.093 1.00 0.00 H ATOM 40829 C19 PA 1012 113.664 80.729 32.252 1.00 0.00 C ATOM 40830 H9R PA 1012 114.547 81.247 32.634 1.00 0.00 H ATOM 40831 H9S PA 1012 113.460 81.205 31.291 1.00 0.00 H ATOM 40832 C18 PA 1012 114.150 79.332 31.896 1.00 0.00 C ATOM 40833 H8R PA 1012 113.483 78.790 31.222 1.00 0.00 H ATOM 40834 H8S PA 1012 114.224 78.739 32.810 1.00 0.00 H ATOM 40835 C17 PA 1012 115.557 79.301 31.335 1.00 0.00 C ATOM 40836 H7R PA 1012 115.803 78.238 31.292 1.00 0.00 H ATOM 40837 H7S PA 1012 116.273 79.644 32.085 1.00 0.00 H ATOM 40838 C16 PA 1012 115.766 79.946 29.972 1.00 0.00 C ATOM 40839 H6R PA 1012 116.153 80.967 29.960 1.00 0.00 H ATOM 40840 H6S PA 1012 114.836 79.931 29.400 1.00 0.00 H ATOM 40841 C15 PA 1012 116.788 79.236 29.130 1.00 0.00 C ATOM 40842 H5R PA 1012 116.682 79.533 28.084 1.00 0.00 H ATOM 40843 H5S PA 1012 116.483 78.188 29.082 1.00 0.00 H ATOM 40844 C14 PA 1012 118.202 79.355 29.745 1.00 0.00 C ATOM 40845 H4R PA 1012 118.300 78.693 30.608 1.00 0.00 H ATOM 40846 H4S PA 1012 118.415 80.338 30.171 1.00 0.00 H ATOM 40847 C13 PA 1012 119.270 78.894 28.781 1.00 0.00 C ATOM 40848 H3R PA 1012 118.949 77.978 28.281 1.00 0.00 H ATOM 40849 H3S PA 1012 120.208 78.657 29.287 1.00 0.00 H ATOM 40850 C12 PA 1012 119.686 79.790 27.592 1.00 0.00 C ATOM 40851 H2R PA 1012 120.026 80.760 27.961 1.00 0.00 H ATOM 40852 H2S PA 1012 118.856 80.047 26.931 1.00 0.00 H ATOM 40853 C11 PGR 1013 120.761 79.040 27.005 1.00 0.00 C ATOM 40854 O12 PGR 1013 121.920 79.383 26.981 1.00 0.00 O ATOM 40855 O11 PGR 1013 120.301 77.948 26.287 1.00 0.00 O ATOM 40856 C1 PGR 1013 121.260 77.143 25.456 1.00 0.00 C ATOM 40857 HR PGR 1013 121.914 77.857 24.948 1.00 0.00 H ATOM 40858 HS PGR 1013 120.606 76.563 24.801 1.00 0.00 H ATOM 40859 C2 PGR 1013 122.115 76.294 26.364 1.00 0.00 C ATOM 40860 HX PGR 1013 122.117 76.721 27.370 1.00 0.00 H ATOM 40861 C3 PGR 1013 123.616 76.147 25.934 1.00 0.00 C ATOM 40862 HA PGR 1013 124.062 75.290 26.444 1.00 0.00 H ATOM 40863 HB PGR 1013 124.179 77.040 26.220 1.00 0.00 H ATOM 40864 O31 PGR 1013 123.630 75.974 24.544 1.00 0.00 O ATOM 40865 P31 PGR 1013 125.043 76.209 23.751 1.00 0.00 P ATOM 40866 O32 PGR 1013 125.028 77.826 23.824 1.00 0.00 O ATOM 40867 C31 PGR 1013 124.186 78.565 23.020 1.00 0.00 C ATOM 40868 H1A PGR 1013 123.153 78.467 23.361 1.00 0.00 H ATOM 40869 H1B PGR 1013 124.148 78.177 21.999 1.00 0.00 H ATOM 40870 C32 PGR 1013 124.565 80.034 22.979 1.00 0.00 C ATOM 40871 H2A PGR 1013 123.923 80.537 22.252 1.00 0.00 H ATOM 40872 O35 PGR 1013 125.963 80.126 22.740 1.00 0.00 O ATOM 40873 HO5A PGR 1013 126.189 79.732 21.878 1.00 0.00 H ATOM 40874 C33 PGR 1013 124.327 80.734 24.352 1.00 0.00 C ATOM 40875 H3A PGR 1013 124.529 81.784 24.126 1.00 0.00 H ATOM 40876 H3B PGR 1013 123.307 80.626 24.729 1.00 0.00 H ATOM 40877 O33 PGR 1013 126.207 75.758 24.601 1.00 0.00 O ATOM 40878 O34 PGR 1013 124.977 75.733 22.348 1.00 0.00 O ATOM 40879 O21 PGR 1013 121.473 74.969 26.462 1.00 0.00 O ATOM 40880 C21 PGR 1013 121.555 74.400 27.680 1.00 0.00 C ATOM 40881 O22 PGR 1013 122.119 74.799 28.677 1.00 0.00 O ATOM 40882 O36 PGR 1013 125.244 80.351 25.344 1.00 0.00 O ATOM 40883 HO6A PGR 1013 125.097 80.769 26.212 1.00 0.00 H ATOM 40884 C12 OL 1014 120.701 73.090 27.584 1.00 0.00 C ATOM 40885 H2R OL 1014 119.885 73.347 26.905 1.00 0.00 H ATOM 40886 H2S OL 1014 121.305 72.377 27.018 1.00 0.00 H ATOM 40887 C13 OL 1014 120.251 72.431 28.899 1.00 0.00 C ATOM 40888 H3R OL 1014 121.173 72.240 29.452 1.00 0.00 H ATOM 40889 H3S OL 1014 119.637 73.126 29.475 1.00 0.00 H ATOM 40890 C14 OL 1014 119.361 71.128 28.707 1.00 0.00 C ATOM 40891 H4R OL 1014 118.452 71.351 28.144 1.00 0.00 H ATOM 40892 H4S OL 1014 119.877 70.404 28.073 1.00 0.00 H ATOM 40893 C15 OL 1014 119.021 70.444 30.101 1.00 0.00 C ATOM 40894 H5R OL 1014 118.544 71.227 30.694 1.00 0.00 H ATOM 40895 H5S OL 1014 118.309 69.638 29.916 1.00 0.00 H ATOM 40896 C16 OL 1014 120.096 69.882 30.971 1.00 0.00 C ATOM 40897 H6R OL 1014 121.002 69.785 30.371 1.00 0.00 H ATOM 40898 H6S OL 1014 120.324 70.544 31.809 1.00 0.00 H ATOM 40899 C17 OL 1014 119.684 68.572 31.721 1.00 0.00 C ATOM 40900 H7R OL 1014 118.923 68.866 32.447 1.00 0.00 H ATOM 40901 H7S OL 1014 119.253 68.003 30.895 1.00 0.00 H ATOM 40902 C18 OL 1014 120.820 67.892 32.391 1.00 0.00 C ATOM 40903 H8R OL 1014 121.605 67.793 31.638 1.00 0.00 H ATOM 40904 H8S OL 1014 121.265 68.453 33.215 1.00 0.00 H ATOM 40905 C19 OL 1014 120.469 66.504 32.812 1.00 0.00 C ATOM 40906 H9R OL 1014 119.969 65.919 32.044 1.00 0.00 H ATOM 40907 C110 OL 1014 120.537 65.954 34.031 1.00 0.00 C ATOM 40908 H10R OL 1014 120.192 64.934 34.183 1.00 0.00 H ATOM 40909 C111 OL 1014 120.971 66.585 35.314 1.00 0.00 C ATOM 40910 H11R OL 1014 121.365 65.822 35.988 1.00 0.00 H ATOM 40911 H11S OL 1014 121.859 67.187 35.110 1.00 0.00 H ATOM 40912 C112 OL 1014 119.859 67.212 36.056 1.00 0.00 C ATOM 40913 H12R OL 1014 118.936 66.659 36.239 1.00 0.00 H ATOM 40914 H12S OL 1014 120.287 67.335 37.053 1.00 0.00 H ATOM 40915 C113 OL 1014 119.390 68.595 35.459 1.00 0.00 C ATOM 40916 H13R OL 1014 120.178 69.230 35.047 1.00 0.00 H ATOM 40917 H13S OL 1014 118.850 68.374 34.536 1.00 0.00 H ATOM 40918 C114 OL 1014 118.538 69.544 36.405 1.00 0.00 C ATOM 40919 H14R OL 1014 117.618 69.112 36.804 1.00 0.00 H ATOM 40920 H14S OL 1014 119.005 69.657 37.385 1.00 0.00 H ATOM 40921 C115 OL 1014 118.113 70.924 35.735 1.00 0.00 C ATOM 40922 H15R OL 1014 118.931 71.325 35.133 1.00 0.00 H ATOM 40923 H15S OL 1014 117.370 70.631 34.989 1.00 0.00 H ATOM 40924 C116 OL 1014 117.503 71.990 36.558 1.00 0.00 C ATOM 40925 H16R OL 1014 118.092 72.278 37.432 1.00 0.00 H ATOM 40926 H16S OL 1014 117.214 72.766 35.846 1.00 0.00 H ATOM 40927 C117 OL 1014 116.166 71.556 37.163 1.00 0.00 C ATOM 40928 H17R OL 1014 115.579 71.317 36.274 1.00 0.00 H ATOM 40929 H17S OL 1014 116.288 70.620 37.711 1.00 0.00 H ATOM 40930 C118 OL 1014 115.394 72.548 38.040 1.00 0.00 C ATOM 40931 H18R OL 1014 116.035 72.889 38.855 1.00 0.00 H ATOM 40932 H18S OL 1014 114.430 72.150 38.365 1.00 0.00 H ATOM 40933 H18T OL 1014 115.196 73.518 37.578 1.00 0.00 H TER 40934 OL 1014 ATOM 40934 C116 PA 1015 92.372 46.337 33.078 1.00 0.00 C ATOM 40935 H16R PA 1015 92.857 45.439 33.467 1.00 0.00 H ATOM 40936 H16S PA 1015 92.515 46.200 32.004 1.00 0.00 H ATOM 40937 H16T PA 1015 91.304 46.341 33.306 1.00 0.00 H ATOM 40938 C115 PA 1015 93.020 47.474 33.778 1.00 0.00 C ATOM 40939 H15R PA 1015 94.107 47.436 33.871 1.00 0.00 H ATOM 40940 H15S PA 1015 92.768 47.385 34.837 1.00 0.00 H ATOM 40941 C114 PA 1015 92.629 48.808 33.209 1.00 0.00 C ATOM 40942 H14R PA 1015 91.546 48.762 33.081 1.00 0.00 H ATOM 40943 H14S PA 1015 93.080 48.940 32.223 1.00 0.00 H ATOM 40944 C113 PA 1015 93.014 49.948 34.065 1.00 0.00 C ATOM 40945 H13R PA 1015 94.096 50.089 34.044 1.00 0.00 H ATOM 40946 H13S PA 1015 92.853 49.747 35.126 1.00 0.00 H ATOM 40947 C112 PA 1015 92.169 51.183 33.761 1.00 0.00 C ATOM 40948 H12R PA 1015 91.119 50.893 33.688 1.00 0.00 H ATOM 40949 H12S PA 1015 92.418 51.478 32.740 1.00 0.00 H ATOM 40950 C111 PA 1015 92.360 52.403 34.687 1.00 0.00 C ATOM 40951 H11R PA 1015 93.402 52.634 34.919 1.00 0.00 H ATOM 40952 H11S PA 1015 91.982 52.240 35.698 1.00 0.00 H ATOM 40953 C110 PA 1015 91.658 53.670 34.315 1.00 0.00 C ATOM 40954 H10R PA 1015 91.889 54.485 35.004 1.00 0.00 H ATOM 40955 H10S PA 1015 90.577 53.529 34.375 1.00 0.00 H ATOM 40956 C19 PA 1015 91.828 54.208 32.906 1.00 0.00 C ATOM 40957 H9R PA 1015 91.470 53.482 32.174 1.00 0.00 H ATOM 40958 H9S PA 1015 92.872 54.342 32.614 1.00 0.00 H ATOM 40959 C18 PA 1015 91.026 55.509 32.630 1.00 0.00 C ATOM 40960 H8R PA 1015 91.569 56.242 33.230 1.00 0.00 H ATOM 40961 H8S PA 1015 90.008 55.438 33.017 1.00 0.00 H ATOM 40962 C17 PA 1015 91.081 55.882 31.144 1.00 0.00 C ATOM 40963 H7R PA 1015 90.388 56.725 31.093 1.00 0.00 H ATOM 40964 H7S PA 1015 90.589 55.036 30.659 1.00 0.00 H ATOM 40965 C16 PA 1015 92.483 56.216 30.570 1.00 0.00 C ATOM 40966 H6R PA 1015 93.047 55.281 30.585 1.00 0.00 H ATOM 40967 H6S PA 1015 92.916 57.023 31.165 1.00 0.00 H ATOM 40968 C15 PA 1015 92.582 56.694 29.112 1.00 0.00 C ATOM 40969 H5R PA 1015 93.597 57.085 29.012 1.00 0.00 H ATOM 40970 H5S PA 1015 91.944 57.576 29.022 1.00 0.00 H ATOM 40971 C14 PA 1015 92.283 55.707 27.966 1.00 0.00 C ATOM 40972 H4R PA 1015 91.306 55.250 28.140 1.00 0.00 H ATOM 40973 H4S PA 1015 93.085 54.967 27.928 1.00 0.00 H ATOM 40974 C13 PA 1015 92.160 56.450 26.612 1.00 0.00 C ATOM 40975 H3R PA 1015 93.059 57.047 26.444 1.00 0.00 H ATOM 40976 H3S PA 1015 91.329 57.153 26.521 1.00 0.00 H ATOM 40977 C12 PA 1015 91.936 55.424 25.448 1.00 0.00 C ATOM 40978 H2R PA 1015 90.887 55.147 25.332 1.00 0.00 H ATOM 40979 H2S PA 1015 92.485 54.535 25.767 1.00 0.00 H ATOM 40980 C11 PGR 1016 92.289 55.940 24.126 1.00 0.00 C ATOM 40981 O12 PGR 1016 93.038 55.378 23.330 1.00 0.00 O ATOM 40982 O11 PGR 1016 91.701 57.110 23.852 1.00 0.00 O ATOM 40983 C1 PGR 1016 92.227 57.996 22.768 1.00 0.00 C ATOM 40984 HR PGR 1016 91.983 57.533 21.808 1.00 0.00 H ATOM 40985 HS PGR 1016 93.305 58.115 22.903 1.00 0.00 H ATOM 40986 C2 PGR 1016 91.457 59.349 22.906 1.00 0.00 C ATOM 40987 HX PGR 1016 90.390 59.183 23.072 1.00 0.00 H ATOM 40988 C3 PGR 1016 91.521 60.304 21.684 1.00 0.00 C ATOM 40989 HA PGR 1016 91.328 61.321 22.035 1.00 0.00 H ATOM 40990 HB PGR 1016 90.806 59.979 20.925 1.00 0.00 H ATOM 40991 O31 PGR 1016 92.861 60.294 21.190 1.00 0.00 O ATOM 40992 P31 PGR 1016 93.126 60.944 19.741 1.00 0.00 P ATOM 40993 O32 PGR 1016 92.504 59.880 18.811 1.00 0.00 O ATOM 40994 C31 PGR 1016 93.051 58.569 18.617 1.00 0.00 C ATOM 40995 H1A PGR 1016 94.117 58.667 18.400 1.00 0.00 H ATOM 40996 H1B PGR 1016 93.038 58.077 19.594 1.00 0.00 H ATOM 40997 C32 PGR 1016 92.265 57.703 17.646 1.00 0.00 C ATOM 40998 H2A PGR 1016 92.559 56.654 17.738 1.00 0.00 H ATOM 40999 O35 PGR 1016 92.549 58.208 16.343 1.00 0.00 O ATOM 41000 HO5A PGR 1016 91.849 58.880 16.254 1.00 0.00 H ATOM 41001 C33 PGR 1016 90.731 57.697 17.922 1.00 0.00 C ATOM 41002 H3A PGR 1016 90.249 56.970 17.262 1.00 0.00 H ATOM 41003 H3B PGR 1016 90.497 57.369 18.938 1.00 0.00 H ATOM 41004 O33 PGR 1016 92.248 62.143 19.640 1.00 0.00 O ATOM 41005 O34 PGR 1016 94.596 61.017 19.456 1.00 0.00 O ATOM 41006 O21 PGR 1016 91.951 59.983 24.022 1.00 0.00 O ATOM 41007 C21 PGR 1016 91.250 60.942 24.634 1.00 0.00 C ATOM 41008 O22 PGR 1016 90.070 61.082 24.401 1.00 0.00 O ATOM 41009 O36 PGR 1016 90.141 58.955 17.628 1.00 0.00 O ATOM 41010 HO6A PGR 1016 90.689 59.622 18.078 1.00 0.00 H ATOM 41011 C12 OL 1017 91.978 61.764 25.628 1.00 0.00 C ATOM 41012 H2R OL 1017 92.911 61.218 25.783 1.00 0.00 H ATOM 41013 H2S OL 1017 92.181 62.773 25.264 1.00 0.00 H ATOM 41014 C13 OL 1017 91.049 61.964 26.878 1.00 0.00 C ATOM 41015 H3R OL 1017 91.630 62.551 27.594 1.00 0.00 H ATOM 41016 H3S OL 1017 90.205 62.634 26.705 1.00 0.00 H ATOM 41017 C14 OL 1017 90.670 60.679 27.525 1.00 0.00 C ATOM 41018 H4R OL 1017 90.046 60.079 26.860 1.00 0.00 H ATOM 41019 H4S OL 1017 91.545 60.055 27.715 1.00 0.00 H ATOM 41020 C15 OL 1017 89.852 60.795 28.841 1.00 0.00 C ATOM 41021 H5R OL 1017 89.038 61.523 28.824 1.00 0.00 H ATOM 41022 H5S OL 1017 89.517 59.765 28.982 1.00 0.00 H ATOM 41023 C16 OL 1017 90.773 61.246 29.961 1.00 0.00 C ATOM 41024 H6R OL 1017 91.582 60.515 29.893 1.00 0.00 H ATOM 41025 H6S OL 1017 91.221 62.190 29.642 1.00 0.00 H ATOM 41026 C17 OL 1017 90.101 61.293 31.346 1.00 0.00 C ATOM 41027 H7R OL 1017 89.959 60.299 31.775 1.00 0.00 H ATOM 41028 H7S OL 1017 90.815 61.709 32.059 1.00 0.00 H ATOM 41029 C18 OL 1017 88.884 62.125 31.494 1.00 0.00 C ATOM 41030 H8R OL 1017 88.059 61.548 31.072 1.00 0.00 H ATOM 41031 H8S OL 1017 88.559 62.211 32.533 1.00 0.00 H ATOM 41032 C19 OL 1017 89.024 63.426 30.794 1.00 0.00 C ATOM 41033 H9R OL 1017 89.064 63.430 29.708 1.00 0.00 H ATOM 41034 C110 OL 1017 88.900 64.578 31.509 1.00 0.00 C ATOM 41035 H10R OL 1017 88.840 65.513 30.958 1.00 0.00 H ATOM 41036 C111 OL 1017 89.122 64.864 32.961 1.00 0.00 C ATOM 41037 H11R OL 1017 88.275 65.498 33.231 1.00 0.00 H ATOM 41038 H11S OL 1017 89.084 63.952 33.561 1.00 0.00 H ATOM 41039 C112 OL 1017 90.330 65.763 33.167 1.00 0.00 C ATOM 41040 H12R OL 1017 91.221 65.294 32.745 1.00 0.00 H ATOM 41041 H12S OL 1017 90.172 66.707 32.641 1.00 0.00 H ATOM 41042 C113 OL 1017 90.626 66.016 34.633 1.00 0.00 C ATOM 41043 H13R OL 1017 91.165 65.129 34.971 1.00 0.00 H ATOM 41044 H13S OL 1017 91.315 66.859 34.714 1.00 0.00 H ATOM 41045 C114 OL 1017 89.577 66.348 35.642 1.00 0.00 C ATOM 41046 H14R OL 1017 88.912 67.168 35.365 1.00 0.00 H ATOM 41047 H14S OL 1017 88.907 65.518 35.877 1.00 0.00 H ATOM 41048 C115 OL 1017 90.191 66.588 37.071 1.00 0.00 C ATOM 41049 H15R OL 1017 90.836 65.715 37.192 1.00 0.00 H ATOM 41050 H15S OL 1017 90.875 67.433 36.968 1.00 0.00 H ATOM 41051 C116 OL 1017 89.213 66.655 38.148 1.00 0.00 C ATOM 41052 H16R OL 1017 88.716 65.704 37.944 1.00 0.00 H ATOM 41053 H16S OL 1017 89.617 66.559 39.157 1.00 0.00 H ATOM 41054 C117 OL 1017 88.187 67.762 38.043 1.00 0.00 C ATOM 41055 H17R OL 1017 87.834 67.877 37.017 1.00 0.00 H ATOM 41056 H17S OL 1017 87.323 67.526 38.668 1.00 0.00 H ATOM 41057 C118 OL 1017 88.793 69.101 38.438 1.00 0.00 C ATOM 41058 H18R OL 1017 88.057 69.877 38.659 1.00 0.00 H ATOM 41059 H18S OL 1017 89.484 69.369 37.636 1.00 0.00 H ATOM 41060 H18T OL 1017 89.387 69.099 39.355 1.00 0.00 H TER 41061 OL 1017 ATOM 41061 C116 PA 1018 86.520 61.790 40.036 1.00 0.00 C ATOM 41062 H16R PA 1018 87.330 61.845 40.767 1.00 0.00 H ATOM 41063 H16S PA 1018 85.768 61.190 40.554 1.00 0.00 H ATOM 41064 H16T PA 1018 86.092 62.783 39.883 1.00 0.00 H ATOM 41065 C115 PA 1018 87.015 61.062 38.774 1.00 0.00 C ATOM 41066 H15R PA 1018 86.158 60.634 38.251 1.00 0.00 H ATOM 41067 H15S PA 1018 87.630 60.308 39.270 1.00 0.00 H ATOM 41068 C114 PA 1018 87.837 61.949 37.917 1.00 0.00 C ATOM 41069 H14R PA 1018 88.387 62.749 38.416 1.00 0.00 H ATOM 41070 H14S PA 1018 87.323 62.412 37.072 1.00 0.00 H ATOM 41071 C113 PA 1018 88.921 61.134 37.114 1.00 0.00 C ATOM 41072 H13R PA 1018 88.395 60.334 36.589 1.00 0.00 H ATOM 41073 H13S PA 1018 89.556 60.600 37.823 1.00 0.00 H ATOM 41074 C112 PA 1018 89.762 62.041 36.172 1.00 0.00 C ATOM 41075 H12R PA 1018 90.152 62.858 36.783 1.00 0.00 H ATOM 41076 H12S PA 1018 89.123 62.452 35.388 1.00 0.00 H ATOM 41077 C111 PA 1018 90.956 61.357 35.548 1.00 0.00 C ATOM 41078 H11R PA 1018 90.436 60.822 34.750 1.00 0.00 H ATOM 41079 H11S PA 1018 91.350 60.528 36.140 1.00 0.00 H ATOM 41080 C110 PA 1018 91.983 62.383 35.050 1.00 0.00 C ATOM 41081 H10R PA 1018 92.274 62.986 35.913 1.00 0.00 H ATOM 41082 H10S PA 1018 91.441 63.030 34.357 1.00 0.00 H ATOM 41083 C19 PA 1018 93.281 61.750 34.488 1.00 0.00 C ATOM 41084 H9R PA 1018 93.003 61.149 33.620 1.00 0.00 H ATOM 41085 H9S PA 1018 93.730 60.989 35.129 1.00 0.00 H ATOM 41086 C18 PA 1018 94.476 62.731 34.160 1.00 0.00 C ATOM 41087 H8R PA 1018 94.683 63.470 34.937 1.00 0.00 H ATOM 41088 H8S PA 1018 94.401 63.431 33.326 1.00 0.00 H ATOM 41089 C17 PA 1018 95.792 62.003 33.804 1.00 0.00 C ATOM 41090 H7R PA 1018 95.724 61.472 32.852 1.00 0.00 H ATOM 41091 H7S PA 1018 95.926 61.192 34.522 1.00 0.00 H ATOM 41092 C16 PA 1018 97.003 62.876 33.683 1.00 0.00 C ATOM 41093 H6R PA 1018 97.770 62.192 33.312 1.00 0.00 H ATOM 41094 H6S PA 1018 97.279 63.235 34.677 1.00 0.00 H ATOM 41095 C15 PA 1018 96.836 64.116 32.817 1.00 0.00 C ATOM 41096 H5R PA 1018 96.136 64.736 33.381 1.00 0.00 H ATOM 41097 H5S PA 1018 96.471 63.913 31.809 1.00 0.00 H ATOM 41098 C14 PA 1018 98.062 64.947 32.642 1.00 0.00 C ATOM 41099 H4R PA 1018 98.943 64.305 32.704 1.00 0.00 H ATOM 41100 H4S PA 1018 98.118 65.716 33.415 1.00 0.00 H ATOM 41101 C13 PA 1018 98.192 65.578 31.265 1.00 0.00 C ATOM 41102 H3R PA 1018 97.247 66.002 30.920 1.00 0.00 H ATOM 41103 H3S PA 1018 98.213 64.723 30.586 1.00 0.00 H ATOM 41104 C12 PA 1018 99.506 66.410 31.028 1.00 0.00 C ATOM 41105 H2R PA 1018 100.216 65.613 31.257 1.00 0.00 H ATOM 41106 H2S PA 1018 99.584 67.198 31.780 1.00 0.00 H ATOM 41107 C11 PGR 1019 99.661 66.992 29.599 1.00 0.00 C ATOM 41108 O12 PGR 1019 98.906 66.743 28.721 1.00 0.00 O ATOM 41109 O11 PGR 1019 100.759 67.774 29.528 1.00 0.00 O ATOM 41110 C1 PGR 1019 101.191 68.378 28.324 1.00 0.00 C ATOM 41111 HR PGR 1019 101.503 67.590 27.634 1.00 0.00 H ATOM 41112 HS PGR 1019 102.090 68.904 28.655 1.00 0.00 H ATOM 41113 C2 PGR 1019 100.284 69.488 27.816 1.00 0.00 C ATOM 41114 HX PGR 1019 99.277 69.214 27.491 1.00 0.00 H ATOM 41115 C3 PGR 1019 101.043 70.246 26.644 1.00 0.00 C ATOM 41116 HA PGR 1019 101.611 69.535 26.039 1.00 0.00 H ATOM 41117 HB PGR 1019 101.780 70.969 27.003 1.00 0.00 H ATOM 41118 O31 PGR 1019 100.006 70.802 25.777 1.00 0.00 O ATOM 41119 P31 PGR 1019 100.336 71.487 24.384 1.00 0.00 P ATOM 41120 O32 PGR 1019 101.595 72.486 24.767 1.00 0.00 O ATOM 41121 C31 PGR 1019 101.260 73.680 25.402 1.00 0.00 C ATOM 41122 H1A PGR 1019 100.736 73.402 26.320 1.00 0.00 H ATOM 41123 H1B PGR 1019 100.497 74.135 24.765 1.00 0.00 H ATOM 41124 C32 PGR 1019 102.426 74.607 25.954 1.00 0.00 C ATOM 41125 H2A PGR 1019 101.998 75.368 26.610 1.00 0.00 H ATOM 41126 O35 PGR 1019 103.045 75.281 24.872 1.00 0.00 O ATOM 41127 HO5A PGR 1019 103.519 74.574 24.399 1.00 0.00 H ATOM 41128 C33 PGR 1019 103.506 73.803 26.688 1.00 0.00 C ATOM 41129 H3A PGR 1019 104.130 74.470 27.288 1.00 0.00 H ATOM 41130 H3B PGR 1019 103.136 72.990 27.318 1.00 0.00 H ATOM 41131 O33 PGR 1019 100.818 70.475 23.457 1.00 0.00 O ATOM 41132 O34 PGR 1019 99.232 72.326 23.962 1.00 0.00 O ATOM 41133 O21 PGR 1019 99.985 70.425 28.959 1.00 0.00 O ATOM 41134 C21 PGR 1019 99.420 71.636 28.829 1.00 0.00 C ATOM 41135 O22 PGR 1019 99.079 72.209 27.827 1.00 0.00 O ATOM 41136 O36 PGR 1019 104.318 73.173 25.775 1.00 0.00 O ATOM 41137 HO6A PGR 1019 104.837 73.867 25.331 1.00 0.00 H ATOM 41138 C12 OL 1020 99.274 72.192 30.222 1.00 0.00 C ATOM 41139 H2R OL 1020 98.275 72.614 30.353 1.00 0.00 H ATOM 41140 H2S OL 1020 99.357 71.440 31.010 1.00 0.00 H ATOM 41141 C13 OL 1020 100.205 73.409 30.440 1.00 0.00 C ATOM 41142 H3R OL 1020 101.206 73.069 30.716 1.00 0.00 H ATOM 41143 H3S OL 1020 100.325 74.018 29.541 1.00 0.00 H ATOM 41144 C14 OL 1020 99.771 74.254 31.733 1.00 0.00 C ATOM 41145 H4R OL 1020 98.742 74.545 31.511 1.00 0.00 H ATOM 41146 H4S OL 1020 99.727 73.559 32.573 1.00 0.00 H ATOM 41147 C15 OL 1020 100.607 75.378 32.161 1.00 0.00 C ATOM 41148 H5R OL 1020 101.643 75.035 32.116 1.00 0.00 H ATOM 41149 H5S OL 1020 100.524 76.146 31.389 1.00 0.00 H ATOM 41150 C16 OL 1020 100.314 75.950 33.575 1.00 0.00 C ATOM 41151 H6R OL 1020 100.881 76.850 33.824 1.00 0.00 H ATOM 41152 H6S OL 1020 99.261 76.238 33.544 1.00 0.00 H ATOM 41153 C17 OL 1020 100.486 74.947 34.645 1.00 0.00 C ATOM 41154 H7R OL 1020 99.495 74.554 34.884 1.00 0.00 H ATOM 41155 H7S OL 1020 100.984 74.069 34.230 1.00 0.00 H ATOM 41156 C18 OL 1020 101.109 75.475 35.904 1.00 0.00 C ATOM 41157 H8R OL 1020 102.026 76.012 35.656 1.00 0.00 H ATOM 41158 H8S OL 1020 100.526 76.254 36.400 1.00 0.00 H ATOM 41159 C19 OL 1020 101.396 74.291 36.832 1.00 0.00 C ATOM 41160 H9R OL 1020 101.842 73.438 36.327 1.00 0.00 H ATOM 41161 C110 OL 1020 101.150 74.377 38.151 1.00 0.00 C ATOM 41162 H10R OL 1020 101.490 73.527 38.738 1.00 0.00 H ATOM 41163 C111 OL 1020 100.777 75.655 38.944 1.00 0.00 C ATOM 41164 H11R OL 1020 101.130 75.620 39.977 1.00 0.00 H ATOM 41165 H11S OL 1020 101.320 76.491 38.498 1.00 0.00 H ATOM 41166 C112 OL 1020 99.270 75.969 38.884 1.00 0.00 C ATOM 41167 H12R OL 1020 99.220 77.022 39.168 1.00 0.00 H ATOM 41168 H12S OL 1020 98.826 76.067 37.891 1.00 0.00 H ATOM 41169 C113 OL 1020 98.362 75.046 39.622 1.00 0.00 C ATOM 41170 H13R OL 1020 97.357 75.354 39.326 1.00 0.00 H ATOM 41171 H13S OL 1020 98.389 74.031 39.222 1.00 0.00 H ATOM 41172 C114 OL 1020 98.573 75.046 41.165 1.00 0.00 C ATOM 41173 H14R OL 1020 99.611 74.764 41.354 1.00 0.00 H ATOM 41174 H14S OL 1020 98.406 76.069 41.507 1.00 0.00 H ATOM 41175 C115 OL 1020 97.550 74.146 41.835 1.00 0.00 C ATOM 41176 H15R OL 1020 96.660 74.771 41.735 1.00 0.00 H ATOM 41177 H15S OL 1020 97.289 73.193 41.371 1.00 0.00 H ATOM 41178 C116 OL 1020 97.734 73.990 43.388 1.00 0.00 C ATOM 41179 H16R OL 1020 96.937 73.307 43.688 1.00 0.00 H ATOM 41180 H16S OL 1020 98.707 73.570 43.653 1.00 0.00 H ATOM 41181 C117 OL 1020 97.653 75.270 44.157 1.00 0.00 C ATOM 41182 H17R OL 1020 98.368 76.007 43.785 1.00 0.00 H ATOM 41183 H17S OL 1020 96.635 75.649 44.053 1.00 0.00 H ATOM 41184 C118 OL 1020 98.080 75.081 45.628 1.00 0.00 C ATOM 41185 H18R OL 1020 97.703 74.125 45.999 1.00 0.00 H ATOM 41186 H18S OL 1020 97.609 75.855 46.238 1.00 0.00 H ATOM 41187 H18T OL 1020 99.135 75.101 45.908 1.00 0.00 H TER 41188 OL 1020 ATOM 41188 C116 PA 1021 42.997 128.639 41.141 1.00 0.00 C ATOM 41189 H16R PA 1021 42.884 129.724 41.087 1.00 0.00 H ATOM 41190 H16S PA 1021 42.644 128.306 42.119 1.00 0.00 H ATOM 41191 H16T PA 1021 42.374 128.198 40.361 1.00 0.00 H ATOM 41192 C115 PA 1021 44.469 128.349 40.815 1.00 0.00 C ATOM 41193 H15R PA 1021 44.639 127.338 41.191 1.00 0.00 H ATOM 41194 H15S PA 1021 44.985 128.947 41.569 1.00 0.00 H ATOM 41195 C114 PA 1021 45.010 128.476 39.417 1.00 0.00 C ATOM 41196 H14R PA 1021 46.025 128.113 39.241 1.00 0.00 H ATOM 41197 H14S PA 1021 45.148 129.549 39.265 1.00 0.00 H ATOM 41198 C113 PA 1021 44.243 127.783 38.353 1.00 0.00 C ATOM 41199 H13R PA 1021 43.309 128.338 38.244 1.00 0.00 H ATOM 41200 H13S PA 1021 44.011 126.753 38.632 1.00 0.00 H ATOM 41201 C112 PA 1021 44.942 127.690 37.086 1.00 0.00 C ATOM 41202 H12R PA 1021 46.018 127.580 37.239 1.00 0.00 H ATOM 41203 H12S PA 1021 44.767 128.665 36.625 1.00 0.00 H ATOM 41204 C111 PA 1021 44.509 126.491 36.119 1.00 0.00 C ATOM 41205 H11R PA 1021 43.424 126.576 36.022 1.00 0.00 H ATOM 41206 H11S PA 1021 44.813 125.541 36.563 1.00 0.00 H ATOM 41207 C110 PA 1021 45.358 126.732 34.841 1.00 0.00 C ATOM 41208 H10R PA 1021 46.429 126.779 35.047 1.00 0.00 H ATOM 41209 H10S PA 1021 45.063 127.668 34.361 1.00 0.00 H ATOM 41210 C19 PA 1021 44.975 125.694 33.770 1.00 0.00 C ATOM 41211 H9R PA 1021 44.904 124.761 34.333 1.00 0.00 H ATOM 41212 H9S PA 1021 45.729 125.449 33.018 1.00 0.00 H ATOM 41213 C18 PA 1021 43.588 126.027 33.022 1.00 0.00 C ATOM 41214 H8R PA 1021 43.759 126.992 32.540 1.00 0.00 H ATOM 41215 H8S PA 1021 42.724 126.002 33.689 1.00 0.00 H ATOM 41216 C17 PA 1021 43.211 125.099 31.852 1.00 0.00 C ATOM 41217 H7R PA 1021 42.921 124.137 32.280 1.00 0.00 H ATOM 41218 H7S PA 1021 44.140 124.878 31.323 1.00 0.00 H ATOM 41219 C16 PA 1021 42.117 125.635 30.898 1.00 0.00 C ATOM 41220 H6R PA 1021 42.314 126.622 30.473 1.00 0.00 H ATOM 41221 H6S PA 1021 41.207 125.708 31.497 1.00 0.00 H ATOM 41222 C15 PA 1021 41.915 124.798 29.681 1.00 0.00 C ATOM 41223 H5R PA 1021 41.008 125.215 29.238 1.00 0.00 H ATOM 41224 H5S PA 1021 41.816 123.720 29.820 1.00 0.00 H ATOM 41225 C14 PA 1021 42.925 125.039 28.660 1.00 0.00 C ATOM 41226 H4R PA 1021 43.950 124.821 28.967 1.00 0.00 H ATOM 41227 H4S PA 1021 43.033 126.092 28.392 1.00 0.00 H ATOM 41228 C13 PA 1021 42.715 124.105 27.350 1.00 0.00 C ATOM 41229 H3R PA 1021 41.741 124.357 26.926 1.00 0.00 H ATOM 41230 H3S PA 1021 42.657 123.108 27.791 1.00 0.00 H ATOM 41231 C12 PA 1021 43.728 124.169 26.270 1.00 0.00 C ATOM 41232 H2R PA 1021 44.734 124.159 26.694 1.00 0.00 H ATOM 41233 H2S PA 1021 43.657 125.126 25.749 1.00 0.00 H ATOM 41234 C11 PGR 1022 43.460 123.004 25.296 1.00 0.00 C ATOM 41235 O12 PGR 1022 42.758 123.185 24.305 1.00 0.00 O ATOM 41236 O11 PGR 1022 43.922 121.791 25.680 1.00 0.00 O ATOM 41237 C1 PGR 1022 43.867 120.595 24.866 1.00 0.00 C ATOM 41238 HR PGR 1022 42.848 120.320 24.582 1.00 0.00 H ATOM 41239 HS PGR 1022 44.253 119.747 25.438 1.00 0.00 H ATOM 41240 C2 PGR 1022 44.663 120.784 23.603 1.00 0.00 C ATOM 41241 HX PGR 1022 44.375 121.684 23.054 1.00 0.00 H ATOM 41242 C3 PGR 1022 44.477 119.556 22.629 1.00 0.00 C ATOM 41243 HA PGR 1022 43.418 119.289 22.623 1.00 0.00 H ATOM 41244 HB PGR 1022 45.046 118.698 22.995 1.00 0.00 H ATOM 41245 O31 PGR 1022 44.878 119.924 21.303 1.00 0.00 O ATOM 41246 P31 PGR 1022 43.949 120.633 20.286 1.00 0.00 P ATOM 41247 O32 PGR 1022 44.109 122.103 20.840 1.00 0.00 O ATOM 41248 C31 PGR 1022 45.337 122.785 20.819 1.00 0.00 C ATOM 41249 H1A PGR 1022 45.672 122.801 19.779 1.00 0.00 H ATOM 41250 H1B PGR 1022 46.034 122.263 21.479 1.00 0.00 H ATOM 41251 C32 PGR 1022 45.017 124.287 21.122 1.00 0.00 C ATOM 41252 H2A PGR 1022 44.993 124.474 22.198 1.00 0.00 H ATOM 41253 O35 PGR 1022 43.880 124.740 20.414 1.00 0.00 O ATOM 41254 HO5A PGR 1022 43.119 124.208 20.708 1.00 0.00 H ATOM 41255 C33 PGR 1022 46.163 125.178 20.632 1.00 0.00 C ATOM 41256 H3A PGR 1022 45.869 126.216 20.807 1.00 0.00 H ATOM 41257 H3B PGR 1022 47.009 124.965 21.290 1.00 0.00 H ATOM 41258 O33 PGR 1022 44.573 120.566 18.943 1.00 0.00 O ATOM 41259 O34 PGR 1022 42.586 120.160 20.432 1.00 0.00 O ATOM 41260 O21 PGR 1022 46.095 120.823 23.916 1.00 0.00 O ATOM 41261 C21 PGR 1022 46.643 122.012 24.239 1.00 0.00 C ATOM 41262 O22 PGR 1022 46.180 123.052 23.902 1.00 0.00 O ATOM 41263 O36 PGR 1022 46.583 124.860 19.285 1.00 0.00 O ATOM 41264 HO6A PGR 1022 45.757 125.003 18.788 1.00 0.00 H ATOM 41265 C12 OL 1023 47.980 121.853 24.988 1.00 0.00 C ATOM 41266 H2R OL 1023 48.700 121.293 24.388 1.00 0.00 H ATOM 41267 H2S OL 1023 48.299 122.892 25.096 1.00 0.00 H ATOM 41268 C13 OL 1023 47.694 121.305 26.406 1.00 0.00 C ATOM 41269 H3R OL 1023 48.310 121.817 27.147 1.00 0.00 H ATOM 41270 H3S OL 1023 46.682 121.419 26.802 1.00 0.00 H ATOM 41271 C14 OL 1023 48.179 119.851 26.411 1.00 0.00 C ATOM 41272 H4R OL 1023 47.856 119.543 25.414 1.00 0.00 H ATOM 41273 H4S OL 1023 49.255 119.666 26.451 1.00 0.00 H ATOM 41274 C15 OL 1023 47.516 118.961 27.491 1.00 0.00 C ATOM 41275 H5R OL 1023 48.151 118.075 27.424 1.00 0.00 H ATOM 41276 H5S OL 1023 47.623 119.412 28.480 1.00 0.00 H ATOM 41277 C16 OL 1023 46.038 118.821 27.252 1.00 0.00 C ATOM 41278 H6R OL 1023 45.512 119.777 27.195 1.00 0.00 H ATOM 41279 H6S OL 1023 45.977 118.411 26.242 1.00 0.00 H ATOM 41280 C17 OL 1023 45.415 117.840 28.195 1.00 0.00 C ATOM 41281 H7R OL 1023 44.392 117.525 27.978 1.00 0.00 H ATOM 41282 H7S OL 1023 46.027 116.936 28.167 1.00 0.00 H ATOM 41283 C18 OL 1023 45.403 118.357 29.662 1.00 0.00 C ATOM 41284 H8R OL 1023 44.948 117.587 30.289 1.00 0.00 H ATOM 41285 H8S OL 1023 46.355 118.581 30.148 1.00 0.00 H ATOM 41286 C19 OL 1023 44.519 119.532 29.769 1.00 0.00 C ATOM 41287 H9R OL 1023 43.717 119.421 29.044 1.00 0.00 H ATOM 41288 C110 OL 1023 44.830 120.708 30.195 1.00 0.00 C ATOM 41289 H10R OL 1023 44.188 121.562 29.996 1.00 0.00 H ATOM 41290 C111 OL 1023 46.065 121.101 30.984 1.00 0.00 C ATOM 41291 H11R OL 1023 46.804 120.299 31.043 1.00 0.00 H ATOM 41292 H11S OL 1023 46.564 121.890 30.417 1.00 0.00 H ATOM 41293 C112 OL 1023 45.676 121.596 32.385 1.00 0.00 C ATOM 41294 H12R OL 1023 44.840 122.296 32.320 1.00 0.00 H ATOM 41295 H12S OL 1023 45.395 120.723 32.979 1.00 0.00 H ATOM 41296 C113 OL 1023 46.713 122.362 33.245 1.00 0.00 C ATOM 41297 H13R OL 1023 47.653 121.841 33.049 1.00 0.00 H ATOM 41298 H13S OL 1023 46.656 123.419 32.975 1.00 0.00 H ATOM 41299 C114 OL 1023 46.509 122.375 34.819 1.00 0.00 C ATOM 41300 H14R OL 1023 45.459 122.634 34.971 1.00 0.00 H ATOM 41301 H14S OL 1023 46.515 121.301 35.020 1.00 0.00 H ATOM 41302 C115 OL 1023 47.553 123.266 35.598 1.00 0.00 C ATOM 41303 H15R OL 1023 48.577 122.886 35.573 1.00 0.00 H ATOM 41304 H15S OL 1023 47.628 124.174 34.997 1.00 0.00 H ATOM 41305 C116 OL 1023 47.119 123.415 37.133 1.00 0.00 C ATOM 41306 H16R OL 1023 46.112 123.835 37.152 1.00 0.00 H ATOM 41307 H16S OL 1023 46.993 122.418 37.560 1.00 0.00 H ATOM 41308 C117 OL 1023 47.981 124.341 37.902 1.00 0.00 C ATOM 41309 H17R OL 1023 48.944 123.846 38.042 1.00 0.00 H ATOM 41310 H17S OL 1023 48.155 125.149 37.188 1.00 0.00 H ATOM 41311 C118 OL 1023 47.403 124.891 39.212 1.00 0.00 C ATOM 41312 H18R OL 1023 48.165 125.519 39.680 1.00 0.00 H ATOM 41313 H18S OL 1023 47.243 123.974 39.782 1.00 0.00 H ATOM 41314 H18T OL 1023 46.467 125.453 39.211 1.00 0.00 H TER 41315 OL 1023 ATOM 41315 C116 PA 1024 82.396 45.057 41.839 1.00 0.00 C ATOM 41316 H16R PA 1024 81.887 44.319 42.462 1.00 0.00 H ATOM 41317 H16S PA 1024 82.783 45.868 42.460 1.00 0.00 H ATOM 41318 H16T PA 1024 83.257 44.560 41.386 1.00 0.00 H ATOM 41319 C115 PA 1024 81.459 45.590 40.769 1.00 0.00 C ATOM 41320 H15R PA 1024 80.543 45.953 41.239 1.00 0.00 H ATOM 41321 H15S PA 1024 81.051 44.735 40.226 1.00 0.00 H ATOM 41322 C114 PA 1024 82.131 46.643 39.922 1.00 0.00 C ATOM 41323 H14R PA 1024 83.082 46.201 39.616 1.00 0.00 H ATOM 41324 H14S PA 1024 82.258 47.432 40.666 1.00 0.00 H ATOM 41325 C113 PA 1024 81.330 46.945 38.635 1.00 0.00 C ATOM 41326 H13R PA 1024 81.007 46.060 38.083 1.00 0.00 H ATOM 41327 H13S PA 1024 82.062 47.485 38.030 1.00 0.00 H ATOM 41328 C112 PA 1024 80.199 47.884 38.908 1.00 0.00 C ATOM 41329 H12R PA 1024 80.586 48.772 39.412 1.00 0.00 H ATOM 41330 H12S PA 1024 79.530 47.324 39.564 1.00 0.00 H ATOM 41331 C111 PA 1024 79.367 48.136 37.669 1.00 0.00 C ATOM 41332 H11R PA 1024 78.659 48.940 37.880 1.00 0.00 H ATOM 41333 H11S PA 1024 78.759 47.230 37.707 1.00 0.00 H ATOM 41334 C110 PA 1024 80.011 48.419 36.284 1.00 0.00 C ATOM 41335 H10R PA 1024 80.605 47.591 35.893 1.00 0.00 H ATOM 41336 H10S PA 1024 80.797 49.155 36.468 1.00 0.00 H ATOM 41337 C19 PA 1024 78.999 48.989 35.323 1.00 0.00 C ATOM 41338 H9R PA 1024 79.540 49.323 34.435 1.00 0.00 H ATOM 41339 H9S PA 1024 78.568 49.920 35.698 1.00 0.00 H ATOM 41340 C18 PA 1024 77.760 48.143 34.961 1.00 0.00 C ATOM 41341 H8R PA 1024 77.092 47.847 35.773 1.00 0.00 H ATOM 41342 H8S PA 1024 78.232 47.235 34.580 1.00 0.00 H ATOM 41343 C17 PA 1024 76.985 48.818 33.890 1.00 0.00 C ATOM 41344 H7R PA 1024 77.636 49.486 33.322 1.00 0.00 H ATOM 41345 H7S PA 1024 76.206 49.481 34.272 1.00 0.00 H ATOM 41346 C16 PA 1024 76.456 47.845 32.866 1.00 0.00 C ATOM 41347 H6R PA 1024 75.865 47.198 33.518 1.00 0.00 H ATOM 41348 H6S PA 1024 77.213 47.129 32.538 1.00 0.00 H ATOM 41349 C15 PA 1024 75.505 48.430 31.825 1.00 0.00 C ATOM 41350 H5R PA 1024 76.070 49.084 31.158 1.00 0.00 H ATOM 41351 H5S PA 1024 74.938 49.165 32.400 1.00 0.00 H ATOM 41352 C14 PA 1024 74.480 47.526 31.178 1.00 0.00 C ATOM 41353 H4R PA 1024 73.863 47.056 31.947 1.00 0.00 H ATOM 41354 H4S PA 1024 74.903 46.713 30.584 1.00 0.00 H ATOM 41355 C13 PA 1024 73.566 48.127 30.168 1.00 0.00 C ATOM 41356 H3R PA 1024 74.130 48.525 29.322 1.00 0.00 H ATOM 41357 H3S PA 1024 73.079 49.001 30.606 1.00 0.00 H ATOM 41358 C12 PA 1024 72.404 47.202 29.758 1.00 0.00 C ATOM 41359 H2R PA 1024 71.712 46.979 30.573 1.00 0.00 H ATOM 41360 H2S PA 1024 72.781 46.274 29.323 1.00 0.00 H ATOM 41361 C11 PC 1025 71.589 47.974 28.746 1.00 0.00 C ATOM 41362 O12 PC 1025 71.912 48.265 27.624 1.00 0.00 O ATOM 41363 O11 PC 1025 70.438 48.501 29.223 1.00 0.00 O ATOM 41364 C1 PC 1025 69.558 49.247 28.321 1.00 0.00 C ATOM 41365 HR PC 1025 70.030 50.089 27.807 1.00 0.00 H ATOM 41366 HS PC 1025 68.735 49.698 28.879 1.00 0.00 H ATOM 41367 C2 PC 1025 68.971 48.325 27.153 1.00 0.00 C ATOM 41368 HX PC 1025 69.808 47.720 26.794 1.00 0.00 H ATOM 41369 C3 PC 1025 68.392 49.143 25.940 1.00 0.00 C ATOM 41370 HA PC 1025 69.197 49.846 25.711 1.00 0.00 H ATOM 41371 HB PC 1025 67.549 49.763 26.255 1.00 0.00 H ATOM 41372 O31 PC 1025 68.138 48.276 24.838 1.00 0.00 O ATOM 41373 P31 PC 1025 67.326 48.670 23.505 1.00 0.00 P ATOM 41374 O32 PC 1025 67.872 47.546 22.535 1.00 0.00 O ATOM 41375 C31 PC 1025 69.077 47.776 21.737 1.00 0.00 C ATOM 41376 H1A PC 1025 69.816 48.177 22.436 1.00 0.00 H ATOM 41377 H1B PC 1025 68.942 48.437 20.877 1.00 0.00 H ATOM 41378 C32 PC 1025 69.367 46.333 21.258 1.00 0.00 C ATOM 41379 H2A PC 1025 68.405 45.970 20.894 1.00 0.00 H ATOM 41380 H2B PC 1025 69.756 45.778 22.113 1.00 0.00 H ATOM 41381 N31 PC 1025 70.392 46.010 20.252 1.00 0.00 N ATOM 41382 C33 PC 1025 70.634 44.555 20.191 1.00 0.00 C ATOM 41383 H3A PC 1025 69.659 44.095 20.359 1.00 0.00 H ATOM 41384 H3B PC 1025 71.308 44.361 21.026 1.00 0.00 H ATOM 41385 H3C PC 1025 71.136 44.203 19.288 1.00 0.00 H ATOM 41386 C34 PC 1025 69.945 46.384 18.921 1.00 0.00 C ATOM 41387 H4A PC 1025 70.679 46.100 18.166 1.00 0.00 H ATOM 41388 H4B PC 1025 69.851 47.463 18.795 1.00 0.00 H ATOM 41389 H4C PC 1025 69.007 45.890 18.665 1.00 0.00 H ATOM 41390 C35 PC 1025 71.685 46.720 20.648 1.00 0.00 C ATOM 41391 H5A PC 1025 71.986 46.215 21.568 1.00 0.00 H ATOM 41392 H5B PC 1025 71.576 47.791 20.821 1.00 0.00 H ATOM 41393 H5C PC 1025 72.436 46.524 19.882 1.00 0.00 H ATOM 41394 O33 PC 1025 65.959 48.341 23.721 1.00 0.00 O ATOM 41395 O34 PC 1025 67.703 50.042 23.045 1.00 0.00 O ATOM 41396 O21 PC 1025 68.109 47.282 27.789 1.00 0.00 O ATOM 41397 C21 PC 1025 66.997 47.614 28.408 1.00 0.00 C ATOM 41398 O22 PC 1025 66.512 48.690 28.521 1.00 0.00 O ATOM 41399 C12 OL 1026 66.244 46.432 28.937 1.00 0.00 C ATOM 41400 H2R OL 1026 65.211 46.388 28.584 1.00 0.00 H ATOM 41401 H2S OL 1026 66.677 45.496 28.581 1.00 0.00 H ATOM 41402 C13 OL 1026 66.177 46.487 30.504 1.00 0.00 C ATOM 41403 H3R OL 1026 65.622 47.379 30.802 1.00 0.00 H ATOM 41404 H3S OL 1026 65.529 45.679 30.852 1.00 0.00 H ATOM 41405 C14 OL 1026 67.527 46.429 31.133 1.00 0.00 C ATOM 41406 H4R OL 1026 67.904 45.404 31.104 1.00 0.00 H ATOM 41407 H4S OL 1026 68.212 46.962 30.470 1.00 0.00 H ATOM 41408 C15 OL 1026 67.551 47.057 32.502 1.00 0.00 C ATOM 41409 H5R OL 1026 67.131 48.064 32.537 1.00 0.00 H ATOM 41410 H5S OL 1026 66.845 46.415 33.033 1.00 0.00 H ATOM 41411 C16 OL 1026 68.967 47.060 32.997 1.00 0.00 C ATOM 41412 H6R OL 1026 69.341 46.036 33.067 1.00 0.00 H ATOM 41413 H6S OL 1026 69.608 47.472 32.215 1.00 0.00 H ATOM 41414 C17 OL 1026 69.178 47.851 34.296 1.00 0.00 C ATOM 41415 H7R OL 1026 68.801 48.842 34.035 1.00 0.00 H ATOM 41416 H7S OL 1026 68.537 47.449 35.084 1.00 0.00 H ATOM 41417 C18 OL 1026 70.610 47.751 34.651 1.00 0.00 C ATOM 41418 H8R OL 1026 70.737 48.135 35.665 1.00 0.00 H ATOM 41419 H8S OL 1026 70.851 46.699 34.821 1.00 0.00 H ATOM 41420 C19 OL 1026 71.444 48.531 33.703 1.00 0.00 C ATOM 41421 H9R OL 1026 71.177 48.628 32.653 1.00 0.00 H ATOM 41422 C110 OL 1026 72.511 49.249 34.108 1.00 0.00 C ATOM 41423 H10R OL 1026 72.943 49.844 33.307 1.00 0.00 H ATOM 41424 C111 OL 1026 73.148 49.380 35.409 1.00 0.00 C ATOM 41425 H11R OL 1026 72.681 48.713 36.138 1.00 0.00 H ATOM 41426 H11S OL 1026 74.151 48.949 35.399 1.00 0.00 H ATOM 41427 C112 OL 1026 73.495 50.809 35.897 1.00 0.00 C ATOM 41428 H12R OL 1026 74.130 51.366 35.205 1.00 0.00 H ATOM 41429 H12S OL 1026 72.556 51.366 35.924 1.00 0.00 H ATOM 41430 C113 OL 1026 73.995 50.789 37.366 1.00 0.00 C ATOM 41431 H13R OL 1026 74.245 51.787 37.733 1.00 0.00 H ATOM 41432 H13S OL 1026 73.242 50.655 38.145 1.00 0.00 H ATOM 41433 C114 OL 1026 75.225 49.896 37.807 1.00 0.00 C ATOM 41434 H14R OL 1026 75.090 48.886 37.416 1.00 0.00 H ATOM 41435 H14S OL 1026 76.191 50.197 37.394 1.00 0.00 H ATOM 41436 C115 OL 1026 75.407 49.866 39.334 1.00 0.00 C ATOM 41437 H15R OL 1026 75.449 50.856 39.794 1.00 0.00 H ATOM 41438 H15S OL 1026 74.486 49.516 39.805 1.00 0.00 H ATOM 41439 C116 OL 1026 76.568 48.981 39.839 1.00 0.00 C ATOM 41440 H16R OL 1026 76.757 48.116 39.200 1.00 0.00 H ATOM 41441 H16S OL 1026 77.530 49.495 39.890 1.00 0.00 H ATOM 41442 C117 OL 1026 76.404 48.436 41.274 1.00 0.00 C ATOM 41443 H17R OL 1026 76.325 49.254 41.993 1.00 0.00 H ATOM 41444 H17S OL 1026 75.428 47.970 41.428 1.00 0.00 H ATOM 41445 C118 OL 1026 77.458 47.520 41.778 1.00 0.00 C ATOM 41446 H18R OL 1026 78.383 48.050 41.540 1.00 0.00 H ATOM 41447 H18S OL 1026 77.521 46.619 41.164 1.00 0.00 H ATOM 41448 H18T OL 1026 77.373 47.230 42.827 1.00 0.00 H TER 41449 OL 1026 ATOM 41449 C116 PA 1027 95.057 89.277 40.766 1.00 0.00 C ATOM 41450 H16R PA 1027 94.200 88.702 41.122 1.00 0.00 H ATOM 41451 H16S PA 1027 95.088 90.190 41.364 1.00 0.00 H ATOM 41452 H16T PA 1027 95.843 88.578 41.059 1.00 0.00 H ATOM 41453 C115 PA 1027 94.864 89.417 39.258 1.00 0.00 C ATOM 41454 H15R PA 1027 94.858 88.393 38.879 1.00 0.00 H ATOM 41455 H15S PA 1027 95.773 89.887 38.878 1.00 0.00 H ATOM 41456 C114 PA 1027 93.523 90.073 38.845 1.00 0.00 C ATOM 41457 H14R PA 1027 93.402 91.069 39.277 1.00 0.00 H ATOM 41458 H14S PA 1027 92.790 89.381 39.265 1.00 0.00 H ATOM 41459 C113 PA 1027 93.281 90.386 37.385 1.00 0.00 C ATOM 41460 H13R PA 1027 92.271 90.771 37.230 1.00 0.00 H ATOM 41461 H13S PA 1027 93.391 89.474 36.795 1.00 0.00 H ATOM 41462 C112 PA 1027 94.275 91.302 36.792 1.00 0.00 C ATOM 41463 H12R PA 1027 94.197 91.296 35.703 1.00 0.00 H ATOM 41464 H12S PA 1027 95.261 90.851 36.922 1.00 0.00 H ATOM 41465 C111 PA 1027 94.186 92.752 37.423 1.00 0.00 C ATOM 41466 H11R PA 1027 94.236 92.750 38.514 1.00 0.00 H ATOM 41467 H11S PA 1027 93.228 93.190 37.136 1.00 0.00 H ATOM 41468 C110 PA 1027 95.292 93.665 36.878 1.00 0.00 C ATOM 41469 H10R PA 1027 95.336 93.566 35.791 1.00 0.00 H ATOM 41470 H10S PA 1027 96.314 93.383 37.138 1.00 0.00 H ATOM 41471 C19 PA 1027 95.025 95.146 37.201 1.00 0.00 C ATOM 41472 H9R PA 1027 94.689 95.201 38.239 1.00 0.00 H ATOM 41473 H9S PA 1027 94.130 95.578 36.748 1.00 0.00 H ATOM 41474 C18 PA 1027 96.029 96.160 36.795 1.00 0.00 C ATOM 41475 H8R PA 1027 96.958 95.982 37.341 1.00 0.00 H ATOM 41476 H8S PA 1027 95.782 97.133 37.225 1.00 0.00 H ATOM 41477 C17 PA 1027 96.412 96.221 35.338 1.00 0.00 C ATOM 41478 H7R PA 1027 96.953 95.313 35.063 1.00 0.00 H ATOM 41479 H7S PA 1027 97.093 97.069 35.237 1.00 0.00 H ATOM 41480 C16 PA 1027 95.276 96.391 34.305 1.00 0.00 C ATOM 41481 H6R PA 1027 94.759 97.323 34.545 1.00 0.00 H ATOM 41482 H6S PA 1027 94.518 95.612 34.403 1.00 0.00 H ATOM 41483 C15 PA 1027 95.785 96.652 32.896 1.00 0.00 C ATOM 41484 H5R PA 1027 96.555 95.927 32.627 1.00 0.00 H ATOM 41485 H5S PA 1027 96.337 97.590 32.985 1.00 0.00 H ATOM 41486 C14 PA 1027 94.772 96.830 31.750 1.00 0.00 C ATOM 41487 H4R PA 1027 95.325 97.202 30.886 1.00 0.00 H ATOM 41488 H4S PA 1027 94.039 97.598 32.008 1.00 0.00 H ATOM 41489 C13 PA 1027 94.184 95.503 31.325 1.00 0.00 C ATOM 41490 H3R PA 1027 93.673 95.124 32.212 1.00 0.00 H ATOM 41491 H3S PA 1027 95.000 94.811 31.109 1.00 0.00 H ATOM 41492 C12 PA 1027 93.158 95.600 30.147 1.00 0.00 C ATOM 41493 H2R PA 1027 92.387 96.319 30.432 1.00 0.00 H ATOM 41494 H2S PA 1027 92.576 94.687 29.998 1.00 0.00 H ATOM 41495 C11 PC 1028 93.843 95.986 28.869 1.00 0.00 C ATOM 41496 O12 PC 1028 93.966 95.132 28.049 1.00 0.00 O ATOM 41497 O11 PC 1028 94.130 97.313 28.632 1.00 0.00 O ATOM 41498 C1 PC 1028 95.155 97.650 27.607 1.00 0.00 C ATOM 41499 HR PC 1028 94.872 97.391 26.583 1.00 0.00 H ATOM 41500 HS PC 1028 96.072 97.077 27.768 1.00 0.00 H ATOM 41501 C2 PC 1028 95.469 99.112 27.699 1.00 0.00 C ATOM 41502 HX PC 1028 94.497 99.611 27.736 1.00 0.00 H ATOM 41503 C3 PC 1028 96.395 99.554 26.571 1.00 0.00 C ATOM 41504 HA PC 1028 96.847 100.498 26.887 1.00 0.00 H ATOM 41505 HB PC 1028 95.924 99.631 25.588 1.00 0.00 H ATOM 41506 O31 PC 1028 97.399 98.577 26.418 1.00 0.00 O ATOM 41507 P31 PC 1028 98.418 98.677 25.108 1.00 0.00 P ATOM 41508 O32 PC 1028 97.878 97.495 24.187 1.00 0.00 O ATOM 41509 C31 PC 1028 97.840 96.187 24.577 1.00 0.00 C ATOM 41510 H1A PC 1028 97.237 96.134 25.487 1.00 0.00 H ATOM 41511 H1B PC 1028 98.896 95.982 24.772 1.00 0.00 H ATOM 41512 C32 PC 1028 97.318 95.336 23.406 1.00 0.00 C ATOM 41513 H2A PC 1028 96.414 95.866 23.104 1.00 0.00 H ATOM 41514 H2B PC 1028 97.136 94.332 23.792 1.00 0.00 H ATOM 41515 N31 PC 1028 98.107 95.045 22.100 1.00 0.00 N ATOM 41516 C33 PC 1028 98.198 96.220 21.214 1.00 0.00 C ATOM 41517 H3A PC 1028 98.788 97.055 21.596 1.00 0.00 H ATOM 41518 H3B PC 1028 97.203 96.510 20.873 1.00 0.00 H ATOM 41519 H3C PC 1028 98.704 95.959 20.283 1.00 0.00 H ATOM 41520 C34 PC 1028 99.455 94.677 22.518 1.00 0.00 C ATOM 41521 H4A PC 1028 100.060 94.614 21.613 1.00 0.00 H ATOM 41522 H4B PC 1028 99.398 93.660 22.908 1.00 0.00 H ATOM 41523 H4C PC 1028 99.843 95.400 23.237 1.00 0.00 H ATOM 41524 C35 PC 1028 97.465 93.936 21.313 1.00 0.00 C ATOM 41525 H5A PC 1028 97.324 93.096 21.995 1.00 0.00 H ATOM 41526 H5B PC 1028 97.944 93.581 20.400 1.00 0.00 H ATOM 41527 H5C PC 1028 96.481 94.300 21.015 1.00 0.00 H ATOM 41528 O33 PC 1028 98.068 99.845 24.223 1.00 0.00 O ATOM 41529 O34 PC 1028 99.815 98.497 25.498 1.00 0.00 O ATOM 41530 O21 PC 1028 96.109 99.277 28.938 1.00 0.00 O ATOM 41531 C21 PC 1028 96.419 100.511 29.434 1.00 0.00 C ATOM 41532 O22 PC 1028 95.835 101.510 29.126 1.00 0.00 O ATOM 41533 C12 OL 1029 97.545 100.526 30.453 1.00 0.00 C ATOM 41534 H2R OL 1029 97.655 101.549 30.821 1.00 0.00 H ATOM 41535 H2S OL 1029 97.297 99.749 31.179 1.00 0.00 H ATOM 41536 C13 OL 1029 98.833 100.047 29.827 1.00 0.00 C ATOM 41537 H3R OL 1029 98.722 98.966 29.725 1.00 0.00 H ATOM 41538 H3S OL 1029 98.952 100.508 28.844 1.00 0.00 H ATOM 41539 C14 OL 1029 100.017 100.500 30.648 1.00 0.00 C ATOM 41540 H4R OL 1029 99.975 101.590 30.705 1.00 0.00 H ATOM 41541 H4S OL 1029 99.833 100.223 31.689 1.00 0.00 H ATOM 41542 C15 OL 1029 101.459 100.198 30.166 1.00 0.00 C ATOM 41543 H5R OL 1029 101.416 99.120 30.000 1.00 0.00 H ATOM 41544 H5S OL 1029 101.660 100.700 29.217 1.00 0.00 H ATOM 41545 C16 OL 1029 102.471 100.426 31.170 1.00 0.00 C ATOM 41546 H6R OL 1029 102.232 99.870 32.080 1.00 0.00 H ATOM 41547 H6S OL 1029 103.436 99.966 30.948 1.00 0.00 H ATOM 41548 C17 OL 1029 102.657 101.943 31.621 1.00 0.00 C ATOM 41549 H7R OL 1029 102.965 102.518 30.746 1.00 0.00 H ATOM 41550 H7S OL 1029 101.701 102.411 31.868 1.00 0.00 H ATOM 41551 C18 OL 1029 103.492 101.956 32.787 1.00 0.00 C ATOM 41552 H8R OL 1029 103.076 101.395 33.627 1.00 0.00 H ATOM 41553 H8S OL 1029 104.495 101.574 32.589 1.00 0.00 H ATOM 41554 C19 OL 1029 103.799 103.287 33.281 1.00 0.00 C ATOM 41555 H9R OL 1029 104.625 103.728 32.728 1.00 0.00 H ATOM 41556 C110 OL 1029 103.311 103.796 34.420 1.00 0.00 C ATOM 41557 H10R OL 1029 103.682 104.733 34.828 1.00 0.00 H ATOM 41558 C111 OL 1029 102.115 103.252 35.164 1.00 0.00 C ATOM 41559 H11R OL 1029 101.217 103.870 35.098 1.00 0.00 H ATOM 41560 H11S OL 1029 101.671 102.344 34.752 1.00 0.00 H ATOM 41561 C112 OL 1029 102.309 103.147 36.637 1.00 0.00 C ATOM 41562 H12R OL 1029 102.416 104.153 37.048 1.00 0.00 H ATOM 41563 H12S OL 1029 101.506 102.670 37.203 1.00 0.00 H ATOM 41564 C113 OL 1029 103.538 102.444 37.038 1.00 0.00 C ATOM 41565 H13R OL 1029 103.611 101.495 36.503 1.00 0.00 H ATOM 41566 H13S OL 1029 104.327 103.186 36.898 1.00 0.00 H ATOM 41567 C114 OL 1029 103.399 102.069 38.606 1.00 0.00 C ATOM 41568 H14R OL 1029 103.545 102.943 39.244 1.00 0.00 H ATOM 41569 H14S OL 1029 102.443 101.626 38.892 1.00 0.00 H ATOM 41570 C115 OL 1029 104.529 101.241 39.210 1.00 0.00 C ATOM 41571 H15R OL 1029 104.246 100.851 40.190 1.00 0.00 H ATOM 41572 H15S OL 1029 104.595 100.317 38.632 1.00 0.00 H ATOM 41573 C116 OL 1029 105.903 101.987 39.251 1.00 0.00 C ATOM 41574 H16R OL 1029 106.368 101.896 38.267 1.00 0.00 H ATOM 41575 H16S OL 1029 105.815 103.050 39.485 1.00 0.00 H ATOM 41576 C117 OL 1029 106.820 101.458 40.280 1.00 0.00 C ATOM 41577 H17R OL 1029 107.646 102.168 40.208 1.00 0.00 H ATOM 41578 H17S OL 1029 106.310 101.570 41.239 1.00 0.00 H ATOM 41579 C118 OL 1029 107.310 100.046 40.021 1.00 0.00 C ATOM 41580 H18R OL 1029 106.649 99.348 40.541 1.00 0.00 H ATOM 41581 H18S OL 1029 108.254 99.797 40.509 1.00 0.00 H ATOM 41582 H18T OL 1029 107.340 99.760 38.968 1.00 0.00 H TER 41583 OL 1029 ATOM 41583 C116 PA 1030 105.013 68.799 36.425 1.00 0.00 C ATOM 41584 H16R PA 1030 104.003 68.904 36.022 1.00 0.00 H ATOM 41585 H16S PA 1030 105.122 69.324 37.376 1.00 0.00 H ATOM 41586 H16T PA 1030 104.946 67.729 36.632 1.00 0.00 H ATOM 41587 C115 PA 1030 106.093 69.170 35.458 1.00 0.00 C ATOM 41588 H15R PA 1030 105.998 70.163 35.015 1.00 0.00 H ATOM 41589 H15S PA 1030 105.826 68.536 34.610 1.00 0.00 H ATOM 41590 C114 PA 1030 107.470 69.000 35.972 1.00 0.00 C ATOM 41591 H14R PA 1030 107.636 67.925 36.062 1.00 0.00 H ATOM 41592 H14S PA 1030 107.587 69.468 36.952 1.00 0.00 H ATOM 41593 C113 PA 1030 108.660 69.625 35.152 1.00 0.00 C ATOM 41594 H13R PA 1030 108.696 70.717 35.174 1.00 0.00 H ATOM 41595 H13S PA 1030 108.533 69.356 34.101 1.00 0.00 H ATOM 41596 C112 PA 1030 109.990 68.948 35.458 1.00 0.00 C ATOM 41597 H12R PA 1030 109.865 67.904 35.165 1.00 0.00 H ATOM 41598 H12S PA 1030 110.164 69.020 36.534 1.00 0.00 H ATOM 41599 C111 PA 1030 111.217 69.613 34.869 1.00 0.00 C ATOM 41600 H11R PA 1030 111.581 70.349 35.589 1.00 0.00 H ATOM 41601 H11S PA 1030 110.875 70.095 33.951 1.00 0.00 H ATOM 41602 C110 PA 1030 112.393 68.685 34.610 1.00 0.00 C ATOM 41603 H10R PA 1030 112.155 67.980 33.810 1.00 0.00 H ATOM 41604 H10S PA 1030 112.487 68.108 35.532 1.00 0.00 H ATOM 41605 C19 PA 1030 113.703 69.384 34.370 1.00 0.00 C ATOM 41606 H9R PA 1030 114.475 68.612 34.372 1.00 0.00 H ATOM 41607 H9S PA 1030 114.030 69.941 35.250 1.00 0.00 H ATOM 41608 C18 PA 1030 113.848 70.074 33.031 1.00 0.00 C ATOM 41609 H8R PA 1030 113.283 70.991 32.847 1.00 0.00 H ATOM 41610 H8S PA 1030 113.641 69.285 32.305 1.00 0.00 H ATOM 41611 C17 PA 1030 115.216 70.610 32.801 1.00 0.00 C ATOM 41612 H7R PA 1030 115.961 69.812 32.817 1.00 0.00 H ATOM 41613 H7S PA 1030 115.598 71.260 33.591 1.00 0.00 H ATOM 41614 C16 PA 1030 115.364 71.408 31.568 1.00 0.00 C ATOM 41615 H6R PA 1030 116.407 71.729 31.525 1.00 0.00 H ATOM 41616 H6S PA 1030 114.796 72.337 31.634 1.00 0.00 H ATOM 41617 C15 PA 1030 115.128 70.588 30.225 1.00 0.00 C ATOM 41618 H5R PA 1030 114.189 70.052 30.379 1.00 0.00 H ATOM 41619 H5S PA 1030 115.884 69.804 30.308 1.00 0.00 H ATOM 41620 C14 PA 1030 115.289 71.403 28.943 1.00 0.00 C ATOM 41621 H4R PA 1030 116.300 71.809 29.017 1.00 0.00 H ATOM 41622 H4S PA 1030 114.630 72.273 28.896 1.00 0.00 H ATOM 41623 C13 PA 1030 115.094 70.529 27.675 1.00 0.00 C ATOM 41624 H3R PA 1030 114.033 70.351 27.489 1.00 0.00 H ATOM 41625 H3S PA 1030 115.603 69.571 27.804 1.00 0.00 H ATOM 41626 C12 PA 1030 115.665 71.225 26.428 1.00 0.00 C ATOM 41627 H2R PA 1030 116.530 71.878 26.557 1.00 0.00 H ATOM 41628 H2S PA 1030 114.795 71.844 26.201 1.00 0.00 H ATOM 41629 C11 PC 1031 115.895 70.316 25.280 1.00 0.00 C ATOM 41630 O12 PC 1031 116.619 70.677 24.370 1.00 0.00 O ATOM 41631 O11 PC 1031 115.267 69.062 25.326 1.00 0.00 O ATOM 41632 C1 PC 1031 115.634 68.024 24.289 1.00 0.00 C ATOM 41633 HR PC 1031 115.656 68.488 23.300 1.00 0.00 H ATOM 41634 HS PC 1031 115.034 67.112 24.342 1.00 0.00 H ATOM 41635 C2 PC 1031 117.066 67.477 24.644 1.00 0.00 C ATOM 41636 HX PC 1031 117.788 68.297 24.676 1.00 0.00 H ATOM 41637 C3 PC 1031 117.563 66.310 23.751 1.00 0.00 C ATOM 41638 HA PC 1031 118.522 66.019 24.187 1.00 0.00 H ATOM 41639 HB PC 1031 117.603 66.650 22.713 1.00 0.00 H ATOM 41640 O31 PC 1031 116.746 65.173 23.668 1.00 0.00 O ATOM 41641 P31 PC 1031 117.380 63.806 23.152 1.00 0.00 P ATOM 41642 O32 PC 1031 117.612 64.074 21.657 1.00 0.00 O ATOM 41643 C31 PC 1031 116.503 64.124 20.715 1.00 0.00 C ATOM 41644 H1A PC 1031 115.980 65.079 20.817 1.00 0.00 H ATOM 41645 H1B PC 1031 115.735 63.363 20.875 1.00 0.00 H ATOM 41646 C32 PC 1031 117.189 64.101 19.309 1.00 0.00 C ATOM 41647 H2A PC 1031 117.601 65.099 19.157 1.00 0.00 H ATOM 41648 H2B PC 1031 116.467 63.852 18.530 1.00 0.00 H ATOM 41649 N31 PC 1031 118.222 63.065 19.009 1.00 0.00 N ATOM 41650 C33 PC 1031 118.401 62.826 17.566 1.00 0.00 C ATOM 41651 H3A PC 1031 118.798 63.728 17.098 1.00 0.00 H ATOM 41652 H3B PC 1031 117.393 62.692 17.169 1.00 0.00 H ATOM 41653 H3C PC 1031 118.992 61.945 17.313 1.00 0.00 H ATOM 41654 C34 PC 1031 119.526 63.625 19.598 1.00 0.00 C ATOM 41655 H4A PC 1031 119.447 63.656 20.686 1.00 0.00 H ATOM 41656 H4B PC 1031 119.665 64.660 19.284 1.00 0.00 H ATOM 41657 H4C PC 1031 120.424 63.145 19.205 1.00 0.00 H ATOM 41658 C35 PC 1031 117.944 61.784 19.650 1.00 0.00 C ATOM 41659 H5A PC 1031 117.750 62.125 20.668 1.00 0.00 H ATOM 41660 H5B PC 1031 118.873 61.228 19.517 1.00 0.00 H ATOM 41661 H5C PC 1031 117.129 61.395 19.038 1.00 0.00 H ATOM 41662 O33 PC 1031 118.731 63.550 23.737 1.00 0.00 O ATOM 41663 O34 PC 1031 116.328 62.760 23.295 1.00 0.00 O ATOM 41664 O21 PC 1031 117.016 66.961 26.013 1.00 0.00 O ATOM 41665 C21 PC 1031 117.733 67.487 27.007 1.00 0.00 C ATOM 41666 O22 PC 1031 118.235 68.558 26.824 1.00 0.00 O ATOM 41667 C12 OL 1032 117.729 66.731 28.255 1.00 0.00 C ATOM 41668 H2R OL 1032 117.949 65.669 28.127 1.00 0.00 H ATOM 41669 H2S OL 1032 118.563 67.066 28.876 1.00 0.00 H ATOM 41670 C13 OL 1032 116.433 66.998 29.004 1.00 0.00 C ATOM 41671 H3R OL 1032 116.221 68.067 29.059 1.00 0.00 H ATOM 41672 H3S OL 1032 115.617 66.584 28.409 1.00 0.00 H ATOM 41673 C14 OL 1032 116.500 66.281 30.421 1.00 0.00 C ATOM 41674 H4R OL 1032 116.594 65.194 30.371 1.00 0.00 H ATOM 41675 H4S OL 1032 117.425 66.656 30.862 1.00 0.00 H ATOM 41676 C15 OL 1032 115.342 66.747 31.288 1.00 0.00 C ATOM 41677 H5R OL 1032 115.461 67.825 31.415 1.00 0.00 H ATOM 41678 H5S OL 1032 114.328 66.683 30.886 1.00 0.00 H ATOM 41679 C16 OL 1032 115.310 66.090 32.695 1.00 0.00 C ATOM 41680 H6R OL 1032 114.477 66.604 33.179 1.00 0.00 H ATOM 41681 H6S OL 1032 114.964 65.055 32.700 1.00 0.00 H ATOM 41682 C17 OL 1032 116.561 66.135 33.630 1.00 0.00 C ATOM 41683 H7R OL 1032 117.380 65.525 33.244 1.00 0.00 H ATOM 41684 H7S OL 1032 116.928 67.158 33.738 1.00 0.00 H ATOM 41685 C18 OL 1032 116.222 65.623 35.016 1.00 0.00 C ATOM 41686 H8R OL 1032 115.966 64.565 34.932 1.00 0.00 H ATOM 41687 H8S OL 1032 117.170 65.710 35.550 1.00 0.00 H ATOM 41688 C19 OL 1032 115.133 66.361 35.663 1.00 0.00 C ATOM 41689 H9R OL 1032 114.435 66.837 34.979 1.00 0.00 H ATOM 41690 C110 OL 1032 114.903 66.554 36.935 1.00 0.00 C ATOM 41691 H10R OL 1032 114.030 67.094 37.292 1.00 0.00 H ATOM 41692 C111 OL 1032 115.793 65.999 38.005 1.00 0.00 C ATOM 41693 H11R OL 1032 116.480 65.218 37.673 1.00 0.00 H ATOM 41694 H11S OL 1032 116.494 66.713 38.443 1.00 0.00 H ATOM 41695 C112 OL 1032 115.013 65.441 39.195 1.00 0.00 C ATOM 41696 H12R OL 1032 114.476 66.287 39.628 1.00 0.00 H ATOM 41697 H12S OL 1032 114.315 64.709 38.783 1.00 0.00 H ATOM 41698 C113 OL 1032 115.869 64.864 40.314 1.00 0.00 C ATOM 41699 H13R OL 1032 116.637 64.194 39.921 1.00 0.00 H ATOM 41700 H13S OL 1032 116.454 65.680 40.744 1.00 0.00 H ATOM 41701 C114 OL 1032 115.119 64.331 41.510 1.00 0.00 C ATOM 41702 H14R OL 1032 114.523 65.162 41.890 1.00 0.00 H ATOM 41703 H14S OL 1032 114.336 63.682 41.112 1.00 0.00 H ATOM 41704 C115 OL 1032 115.904 63.568 42.588 1.00 0.00 C ATOM 41705 H15R OL 1032 116.751 62.959 42.267 1.00 0.00 H ATOM 41706 H15S OL 1032 116.413 64.245 43.278 1.00 0.00 H ATOM 41707 C116 OL 1032 115.094 62.532 43.337 1.00 0.00 C ATOM 41708 H16R OL 1032 114.163 62.992 43.677 1.00 0.00 H ATOM 41709 H16S OL 1032 114.875 61.673 42.700 1.00 0.00 H ATOM 41710 C117 OL 1032 115.726 61.851 44.523 1.00 0.00 C ATOM 41711 H17R OL 1032 116.748 61.491 44.393 1.00 0.00 H ATOM 41712 H17S OL 1032 115.943 62.619 45.268 1.00 0.00 H ATOM 41713 C118 OL 1032 114.969 60.696 45.058 1.00 0.00 C ATOM 41714 H18R OL 1032 113.892 60.845 44.964 1.00 0.00 H ATOM 41715 H18S OL 1032 115.077 60.369 46.095 1.00 0.00 H ATOM 41716 H18T OL 1032 115.309 59.864 44.438 1.00 0.00 H TER 41717 OL 1032 ATOM 41717 C116 PA 1033 110.641 76.532 43.510 1.00 0.00 C ATOM 41718 H16R PA 1033 111.088 76.917 42.591 1.00 0.00 H ATOM 41719 H16S PA 1033 111.298 75.720 43.830 1.00 0.00 H ATOM 41720 H16T PA 1033 110.756 77.320 44.258 1.00 0.00 H ATOM 41721 C115 PA 1033 109.212 75.926 43.390 1.00 0.00 C ATOM 41722 H15R PA 1033 108.481 76.726 43.256 1.00 0.00 H ATOM 41723 H15S PA 1033 108.982 75.472 44.356 1.00 0.00 H ATOM 41724 C114 PA 1033 108.962 75.057 42.081 1.00 0.00 C ATOM 41725 H14R PA 1033 109.594 74.174 42.201 1.00 0.00 H ATOM 41726 H14S PA 1033 109.382 75.708 41.311 1.00 0.00 H ATOM 41727 C113 PA 1033 107.476 74.675 41.968 1.00 0.00 C ATOM 41728 H13R PA 1033 106.999 75.649 41.840 1.00 0.00 H ATOM 41729 H13S PA 1033 107.049 74.155 42.828 1.00 0.00 H ATOM 41730 C112 PA 1033 107.186 73.831 40.771 1.00 0.00 C ATOM 41731 H12R PA 1033 107.785 72.928 40.906 1.00 0.00 H ATOM 41732 H12S PA 1033 107.548 74.472 39.964 1.00 0.00 H ATOM 41733 C111 PA 1033 105.706 73.661 40.582 1.00 0.00 C ATOM 41734 H11R PA 1033 105.233 74.632 40.745 1.00 0.00 H ATOM 41735 H11S PA 1033 105.323 73.011 41.371 1.00 0.00 H ATOM 41736 C110 PA 1033 105.199 73.052 39.288 1.00 0.00 C ATOM 41737 H10R PA 1033 104.130 72.833 39.243 1.00 0.00 H ATOM 41738 H10S PA 1033 105.576 72.027 39.261 1.00 0.00 H ATOM 41739 C19 PA 1033 105.427 73.789 37.937 1.00 0.00 C ATOM 41740 H9R PA 1033 106.481 74.047 37.819 1.00 0.00 H ATOM 41741 H9S PA 1033 105.033 74.806 37.972 1.00 0.00 H ATOM 41742 C18 PA 1033 105.200 72.903 36.737 1.00 0.00 C ATOM 41743 H8R PA 1033 104.116 72.902 36.605 1.00 0.00 H ATOM 41744 H8S PA 1033 105.495 71.865 36.904 1.00 0.00 H ATOM 41745 C17 PA 1033 105.622 73.371 35.338 1.00 0.00 C ATOM 41746 H7R PA 1033 104.986 74.235 35.135 1.00 0.00 H ATOM 41747 H7S PA 1033 105.294 72.622 34.615 1.00 0.00 H ATOM 41748 C16 PA 1033 107.057 73.812 35.059 1.00 0.00 C ATOM 41749 H6R PA 1033 107.796 73.162 35.533 1.00 0.00 H ATOM 41750 H6S PA 1033 107.192 74.746 35.609 1.00 0.00 H ATOM 41751 C15 PA 1033 107.458 74.084 33.569 1.00 0.00 C ATOM 41752 H5R PA 1033 107.414 73.100 33.098 1.00 0.00 H ATOM 41753 H5S PA 1033 108.512 74.356 33.476 1.00 0.00 H ATOM 41754 C14 PA 1033 106.527 74.972 32.755 1.00 0.00 C ATOM 41755 H4R PA 1033 106.448 75.941 33.253 1.00 0.00 H ATOM 41756 H4S PA 1033 105.514 74.571 32.831 1.00 0.00 H ATOM 41757 C13 PA 1033 106.884 75.067 31.293 1.00 0.00 C ATOM 41758 H3R PA 1033 107.050 74.033 30.983 1.00 0.00 H ATOM 41759 H3S PA 1033 107.899 75.471 31.290 1.00 0.00 H ATOM 41760 C12 PA 1033 105.861 76.003 30.489 1.00 0.00 C ATOM 41761 H2R PA 1033 105.817 76.967 30.999 1.00 0.00 H ATOM 41762 H2S PA 1033 104.821 75.672 30.450 1.00 0.00 H ATOM 41763 C11 PC 1034 106.364 76.263 29.089 1.00 0.00 C ATOM 41764 O12 PC 1034 106.095 77.327 28.583 1.00 0.00 O ATOM 41765 O11 PC 1034 106.978 75.247 28.493 1.00 0.00 O ATOM 41766 C1 PC 1034 107.235 75.368 27.046 1.00 0.00 C ATOM 41767 HR PC 1034 107.892 76.198 26.777 1.00 0.00 H ATOM 41768 HS PC 1034 106.335 75.380 26.426 1.00 0.00 H ATOM 41769 C2 PC 1034 107.965 74.117 26.591 1.00 0.00 C ATOM 41770 HX PC 1034 109.032 74.149 26.824 1.00 0.00 H ATOM 41771 C3 PC 1034 107.813 73.994 25.066 1.00 0.00 C ATOM 41772 HA PC 1034 108.352 73.081 24.800 1.00 0.00 H ATOM 41773 HB PC 1034 108.273 74.870 24.602 1.00 0.00 H ATOM 41774 O31 PC 1034 106.428 73.865 24.665 1.00 0.00 O ATOM 41775 P31 PC 1034 106.137 73.993 23.090 1.00 0.00 P ATOM 41776 O32 PC 1034 106.781 72.672 22.492 1.00 0.00 O ATOM 41777 C31 PC 1034 106.273 71.408 22.799 1.00 0.00 C ATOM 41778 H1A PC 1034 105.203 71.422 22.577 1.00 0.00 H ATOM 41779 H1B PC 1034 106.447 71.179 23.853 1.00 0.00 H ATOM 41780 C32 PC 1034 106.860 70.374 21.788 1.00 0.00 C ATOM 41781 H2A PC 1034 106.462 69.373 21.961 1.00 0.00 H ATOM 41782 H2B PC 1034 107.925 70.353 22.025 1.00 0.00 H ATOM 41783 N31 PC 1034 106.840 70.603 20.305 1.00 0.00 N ATOM 41784 C33 PC 1034 107.359 69.455 19.633 1.00 0.00 C ATOM 41785 H3A PC 1034 106.669 68.666 19.932 1.00 0.00 H ATOM 41786 H3B PC 1034 108.355 69.179 19.982 1.00 0.00 H ATOM 41787 H3C PC 1034 107.274 69.586 18.553 1.00 0.00 H ATOM 41788 C34 PC 1034 105.411 70.861 19.812 1.00 0.00 C ATOM 41789 H4A PC 1034 105.386 71.180 18.769 1.00 0.00 H ATOM 41790 H4B PC 1034 104.914 71.612 20.428 1.00 0.00 H ATOM 41791 H4C PC 1034 104.882 69.923 19.983 1.00 0.00 H ATOM 41792 C35 PC 1034 107.547 71.864 19.936 1.00 0.00 C ATOM 41793 H5A PC 1034 107.782 71.950 18.874 1.00 0.00 H ATOM 41794 H5B PC 1034 108.427 71.988 20.569 1.00 0.00 H ATOM 41795 H5C PC 1034 106.874 72.646 20.290 1.00 0.00 H ATOM 41796 O33 PC 1034 104.669 74.011 22.905 1.00 0.00 O ATOM 41797 O34 PC 1034 106.877 75.157 22.527 1.00 0.00 O ATOM 41798 O21 PC 1034 107.300 73.015 27.155 1.00 0.00 O ATOM 41799 C21 PC 1034 107.780 71.769 27.083 1.00 0.00 C ATOM 41800 O22 PC 1034 108.869 71.497 26.580 1.00 0.00 O ATOM 41801 C12 OL 1035 106.956 70.631 27.694 1.00 0.00 C ATOM 41802 H2R OL 1035 106.063 70.442 27.095 1.00 0.00 H ATOM 41803 H2S OL 1035 107.531 69.707 27.610 1.00 0.00 H ATOM 41804 C13 OL 1035 106.588 70.914 29.131 1.00 0.00 C ATOM 41805 H3R OL 1035 106.688 70.009 29.735 1.00 0.00 H ATOM 41806 H3S OL 1035 107.427 71.501 29.512 1.00 0.00 H ATOM 41807 C14 OL 1035 105.101 71.543 29.242 1.00 0.00 C ATOM 41808 H4R OL 1035 105.029 72.408 28.579 1.00 0.00 H ATOM 41809 H4S OL 1035 104.410 70.763 28.915 1.00 0.00 H ATOM 41810 C15 OL 1035 104.693 72.018 30.603 1.00 0.00 C ATOM 41811 H5R OL 1035 105.319 72.891 30.804 1.00 0.00 H ATOM 41812 H5S OL 1035 103.658 72.318 30.426 1.00 0.00 H ATOM 41813 C16 OL 1035 104.649 71.061 31.747 1.00 0.00 C ATOM 41814 H6R OL 1035 105.491 70.372 31.841 1.00 0.00 H ATOM 41815 H6S OL 1035 104.726 71.651 32.663 1.00 0.00 H ATOM 41816 C17 OL 1035 103.338 70.266 31.946 1.00 0.00 C ATOM 41817 H7R OL 1035 102.957 70.004 30.956 1.00 0.00 H ATOM 41818 H7S OL 1035 103.491 69.353 32.526 1.00 0.00 H ATOM 41819 C18 OL 1035 102.330 71.019 32.795 1.00 0.00 C ATOM 41820 H8R OL 1035 102.626 71.114 33.842 1.00 0.00 H ATOM 41821 H8S OL 1035 102.223 72.040 32.421 1.00 0.00 H ATOM 41822 C19 OL 1035 100.930 70.483 32.804 1.00 0.00 C ATOM 41823 H9R OL 1035 100.731 69.976 31.863 1.00 0.00 H ATOM 41824 C110 OL 1035 100.129 70.421 33.907 1.00 0.00 C ATOM 41825 H10R OL 1035 99.192 69.879 33.806 1.00 0.00 H ATOM 41826 C111 OL 1035 100.558 71.084 35.191 1.00 0.00 C ATOM 41827 H11R OL 1035 101.310 71.843 34.966 1.00 0.00 H ATOM 41828 H11S OL 1035 99.773 71.740 35.572 1.00 0.00 H ATOM 41829 C112 OL 1035 101.178 70.129 36.310 1.00 0.00 C ATOM 41830 H12R OL 1035 100.456 69.338 36.519 1.00 0.00 H ATOM 41831 H12S OL 1035 101.996 69.604 35.812 1.00 0.00 H ATOM 41832 C113 OL 1035 101.635 70.886 37.566 1.00 0.00 C ATOM 41833 H13R OL 1035 102.490 71.497 37.269 1.00 0.00 H ATOM 41834 H13S OL 1035 100.813 71.526 37.894 1.00 0.00 H ATOM 41835 C114 OL 1035 102.091 69.959 38.678 1.00 0.00 C ATOM 41836 H14R OL 1035 102.936 69.376 38.305 1.00 0.00 H ATOM 41837 H14S OL 1035 102.523 70.600 39.450 1.00 0.00 H ATOM 41838 C115 OL 1035 100.979 69.085 39.266 1.00 0.00 C ATOM 41839 H15R OL 1035 100.048 69.589 39.531 1.00 0.00 H ATOM 41840 H15S OL 1035 100.761 68.216 38.641 1.00 0.00 H ATOM 41841 C116 OL 1035 101.521 68.355 40.466 1.00 0.00 C ATOM 41842 H16R OL 1035 102.572 68.074 40.372 1.00 0.00 H ATOM 41843 H16S OL 1035 101.381 69.117 41.236 1.00 0.00 H ATOM 41844 C117 OL 1035 100.880 67.038 40.800 1.00 0.00 C ATOM 41845 H17R OL 1035 99.797 67.006 40.937 1.00 0.00 H ATOM 41846 H17S OL 1035 101.050 66.342 39.976 1.00 0.00 H ATOM 41847 C118 OL 1035 101.266 66.592 42.180 1.00 0.00 C ATOM 41848 H18R OL 1035 100.900 65.601 42.456 1.00 0.00 H ATOM 41849 H18S OL 1035 100.901 67.295 42.932 1.00 0.00 H ATOM 41850 H18T OL 1035 102.357 66.600 42.230 1.00 0.00 H TER 41851 OL 1035 ATOM 41851 C116 PA 1036 54.227 56.390 50.116 1.00 0.00 C ATOM 41852 H16R PA 1036 54.724 55.465 50.417 1.00 0.00 H ATOM 41853 H16S PA 1036 53.202 56.302 50.482 1.00 0.00 H ATOM 41854 H16T PA 1036 54.774 57.208 50.588 1.00 0.00 H ATOM 41855 C115 PA 1036 54.180 56.547 48.607 1.00 0.00 C ATOM 41856 H15R PA 1036 53.606 55.735 48.156 1.00 0.00 H ATOM 41857 H15S PA 1036 55.210 56.479 48.250 1.00 0.00 H ATOM 41858 C114 PA 1036 53.487 57.879 48.221 1.00 0.00 C ATOM 41859 H14R PA 1036 53.719 58.805 48.752 1.00 0.00 H ATOM 41860 H14S PA 1036 52.463 57.709 48.560 1.00 0.00 H ATOM 41861 C113 PA 1036 53.536 58.234 46.730 1.00 0.00 C ATOM 41862 H13R PA 1036 54.565 58.398 46.403 1.00 0.00 H ATOM 41863 H13S PA 1036 53.004 59.185 46.649 1.00 0.00 H ATOM 41864 C112 PA 1036 52.901 57.120 45.790 1.00 0.00 C ATOM 41865 H12R PA 1036 51.811 57.079 45.853 1.00 0.00 H ATOM 41866 H12S PA 1036 53.274 56.102 45.920 1.00 0.00 H ATOM 41867 C111 PA 1036 53.160 57.491 44.399 1.00 0.00 C ATOM 41868 H11R PA 1036 54.244 57.386 44.331 1.00 0.00 H ATOM 41869 H11S PA 1036 52.953 58.559 44.304 1.00 0.00 H ATOM 41870 C110 PA 1036 52.530 56.602 43.327 1.00 0.00 C ATOM 41871 H10R PA 1036 51.466 56.467 43.534 1.00 0.00 H ATOM 41872 H10S PA 1036 52.912 55.589 43.473 1.00 0.00 H ATOM 41873 C19 PA 1036 52.764 57.075 41.894 1.00 0.00 C ATOM 41874 H9R PA 1036 53.603 56.524 41.464 1.00 0.00 H ATOM 41875 H9S PA 1036 53.124 58.103 41.973 1.00 0.00 H ATOM 41876 C18 PA 1036 51.574 57.063 40.967 1.00 0.00 C ATOM 41877 H8R PA 1036 50.893 57.813 41.375 1.00 0.00 H ATOM 41878 H8S PA 1036 51.104 56.090 40.809 1.00 0.00 H ATOM 41879 C17 PA 1036 51.916 57.593 39.602 1.00 0.00 C ATOM 41880 H7R PA 1036 52.996 57.571 39.444 1.00 0.00 H ATOM 41881 H7S PA 1036 51.841 58.682 39.640 1.00 0.00 H ATOM 41882 C16 PA 1036 51.138 57.022 38.452 1.00 0.00 C ATOM 41883 H6R PA 1036 50.065 57.138 38.616 1.00 0.00 H ATOM 41884 H6S PA 1036 51.457 55.977 38.460 1.00 0.00 H ATOM 41885 C15 PA 1036 51.493 57.585 37.079 1.00 0.00 C ATOM 41886 H5R PA 1036 52.559 57.782 36.947 1.00 0.00 H ATOM 41887 H5S PA 1036 51.119 58.603 36.953 1.00 0.00 H ATOM 41888 C14 PA 1036 51.017 56.680 35.922 1.00 0.00 C ATOM 41889 H4R PA 1036 49.952 56.505 36.083 1.00 0.00 H ATOM 41890 H4S PA 1036 51.512 55.725 36.114 1.00 0.00 H ATOM 41891 C13 PA 1036 51.336 57.186 34.534 1.00 0.00 C ATOM 41892 H3R PA 1036 52.422 57.206 34.424 1.00 0.00 H ATOM 41893 H3S PA 1036 51.054 58.233 34.399 1.00 0.00 H ATOM 41894 C12 PA 1036 50.806 56.249 33.445 1.00 0.00 C ATOM 41895 H2R PA 1036 49.715 56.266 33.477 1.00 0.00 H ATOM 41896 H2S PA 1036 51.006 55.210 33.714 1.00 0.00 H ATOM 41897 C11 PGR 1037 51.380 56.445 32.081 1.00 0.00 C ATOM 41898 O12 PGR 1037 51.599 55.546 31.315 1.00 0.00 O ATOM 41899 O11 PGR 1037 51.636 57.706 31.781 1.00 0.00 O ATOM 41900 C1 PGR 1037 52.460 57.996 30.620 1.00 0.00 C ATOM 41901 HR PGR 1037 51.922 57.618 29.746 1.00 0.00 H ATOM 41902 HS PGR 1037 53.377 57.403 30.678 1.00 0.00 H ATOM 41903 C2 PGR 1037 52.624 59.558 30.540 1.00 0.00 C ATOM 41904 HX PGR 1037 51.658 60.069 30.556 1.00 0.00 H ATOM 41905 C3 PGR 1037 53.237 59.999 29.209 1.00 0.00 C ATOM 41906 HA PGR 1037 53.311 61.088 29.157 1.00 0.00 H ATOM 41907 HB PGR 1037 52.561 59.674 28.413 1.00 0.00 H ATOM 41908 O31 PGR 1037 54.321 59.240 28.937 1.00 0.00 O ATOM 41909 P31 PGR 1037 55.115 59.412 27.557 1.00 0.00 P ATOM 41910 O32 PGR 1037 54.309 58.549 26.457 1.00 0.00 O ATOM 41911 C31 PGR 1037 53.057 59.069 25.823 1.00 0.00 C ATOM 41912 H1A PGR 1037 53.201 60.080 25.434 1.00 0.00 H ATOM 41913 H1B PGR 1037 52.306 59.022 26.615 1.00 0.00 H ATOM 41914 C32 PGR 1037 52.640 58.258 24.620 1.00 0.00 C ATOM 41915 H2A PGR 1037 51.864 58.852 24.131 1.00 0.00 H ATOM 41916 O35 PGR 1037 52.259 56.858 24.809 1.00 0.00 O ATOM 41917 HO5A PGR 1037 51.409 56.848 25.284 1.00 0.00 H ATOM 41918 C33 PGR 1037 53.833 58.225 23.626 1.00 0.00 C ATOM 41919 H3A PGR 1037 53.426 57.763 22.723 1.00 0.00 H ATOM 41920 H3B PGR 1037 54.127 59.253 23.400 1.00 0.00 H ATOM 41921 O33 PGR 1037 55.077 60.849 27.174 1.00 0.00 O ATOM 41922 O34 PGR 1037 56.398 58.749 27.682 1.00 0.00 O ATOM 41923 O21 PGR 1037 53.502 59.911 31.577 1.00 0.00 O ATOM 41924 C21 PGR 1037 53.016 60.601 32.606 1.00 0.00 C ATOM 41925 O22 PGR 1037 52.089 61.409 32.513 1.00 0.00 O ATOM 41926 O36 PGR 1037 54.894 57.485 24.177 1.00 0.00 O ATOM 41927 HO6A PGR 1037 55.034 57.677 25.121 1.00 0.00 H ATOM 41928 C12 OL 1038 53.726 60.323 33.951 1.00 0.00 C ATOM 41929 H2R OL 1038 53.335 59.411 34.407 1.00 0.00 H ATOM 41930 H2S OL 1038 54.752 60.041 33.708 1.00 0.00 H ATOM 41931 C13 OL 1038 53.847 61.514 34.739 1.00 0.00 C ATOM 41932 H3R OL 1038 54.065 62.426 34.179 1.00 0.00 H ATOM 41933 H3S OL 1038 52.952 61.672 35.344 1.00 0.00 H ATOM 41934 C14 OL 1038 55.000 61.334 35.740 1.00 0.00 C ATOM 41935 H4R OL 1038 54.949 60.382 36.273 1.00 0.00 H ATOM 41936 H4S OL 1038 55.940 61.179 35.206 1.00 0.00 H ATOM 41937 C15 OL 1038 55.260 62.469 36.651 1.00 0.00 C ATOM 41938 H5R OL 1038 55.634 63.298 36.048 1.00 0.00 H ATOM 41939 H5S OL 1038 54.406 62.862 37.206 1.00 0.00 H ATOM 41940 C16 OL 1038 56.385 62.264 37.688 1.00 0.00 C ATOM 41941 H6R OL 1038 57.310 61.913 37.225 1.00 0.00 H ATOM 41942 H6S OL 1038 56.578 63.268 38.071 1.00 0.00 H ATOM 41943 C17 OL 1038 56.134 61.466 38.887 1.00 0.00 C ATOM 41944 H7R OL 1038 55.897 60.459 38.537 1.00 0.00 H ATOM 41945 H7S OL 1038 57.117 61.402 39.357 1.00 0.00 H ATOM 41946 C18 OL 1038 54.996 61.983 39.736 1.00 0.00 C ATOM 41947 H8R OL 1038 55.083 63.015 40.081 1.00 0.00 H ATOM 41948 H8S OL 1038 54.123 61.847 39.095 1.00 0.00 H ATOM 41949 C19 OL 1038 54.883 61.129 40.970 1.00 0.00 C ATOM 41950 H9R OL 1038 54.865 60.052 40.828 1.00 0.00 H ATOM 41951 C110 OL 1038 54.854 61.566 42.226 1.00 0.00 C ATOM 41952 H10R OL 1038 54.715 60.814 42.998 1.00 0.00 H ATOM 41953 C111 OL 1038 55.002 62.992 42.649 1.00 0.00 C ATOM 41954 H11R OL 1038 55.741 63.516 42.038 1.00 0.00 H ATOM 41955 H11S OL 1038 54.064 63.550 42.621 1.00 0.00 H ATOM 41956 C112 OL 1038 55.580 63.140 44.090 1.00 0.00 C ATOM 41957 H12R OL 1038 56.607 62.779 44.007 1.00 0.00 H ATOM 41958 H12S OL 1038 55.621 64.215 44.278 1.00 0.00 H ATOM 41959 C113 OL 1038 54.749 62.408 45.153 1.00 0.00 C ATOM 41960 H13R OL 1038 53.706 62.685 44.986 1.00 0.00 H ATOM 41961 H13S OL 1038 54.846 61.340 44.947 1.00 0.00 H ATOM 41962 C114 OL 1038 55.083 62.668 46.642 1.00 0.00 C ATOM 41963 H14R OL 1038 54.522 62.051 47.347 1.00 0.00 H ATOM 41964 H14S OL 1038 56.121 62.381 46.825 1.00 0.00 H ATOM 41965 C115 OL 1038 54.972 64.157 46.984 1.00 0.00 C ATOM 41966 H15R OL 1038 55.559 64.802 46.327 1.00 0.00 H ATOM 41967 H15S OL 1038 53.928 64.447 46.847 1.00 0.00 H ATOM 41968 C116 OL 1038 55.349 64.614 48.363 1.00 0.00 C ATOM 41969 H16R OL 1038 56.441 64.576 48.382 1.00 0.00 H ATOM 41970 H16S OL 1038 55.064 65.654 48.533 1.00 0.00 H ATOM 41971 C117 OL 1038 54.657 63.903 49.551 1.00 0.00 C ATOM 41972 H17R OL 1038 53.753 63.461 49.126 1.00 0.00 H ATOM 41973 H17S OL 1038 55.338 63.119 49.891 1.00 0.00 H ATOM 41974 C118 OL 1038 54.168 64.854 50.596 1.00 0.00 C ATOM 41975 H18R OL 1038 53.401 65.527 50.207 1.00 0.00 H ATOM 41976 H18S OL 1038 54.925 65.622 50.767 1.00 0.00 H ATOM 41977 H18T OL 1038 53.797 64.395 51.515 1.00 0.00 H TER 41978 OL 1038 ATOM 41978 C116 PA 1039 37.476 33.817 36.036 1.00 0.00 C ATOM 41979 H16R PA 1039 36.930 34.292 36.853 1.00 0.00 H ATOM 41980 H16S PA 1039 37.641 32.762 36.265 1.00 0.00 H ATOM 41981 H16T PA 1039 36.981 33.791 35.062 1.00 0.00 H ATOM 41982 C115 PA 1039 38.876 34.473 35.925 1.00 0.00 C ATOM 41983 H15R PA 1039 39.332 33.983 35.062 1.00 0.00 H ATOM 41984 H15S PA 1039 39.467 34.243 36.814 1.00 0.00 H ATOM 41985 C114 PA 1039 38.969 35.872 35.656 1.00 0.00 C ATOM 41986 H14R PA 1039 39.994 36.240 35.729 1.00 0.00 H ATOM 41987 H14S PA 1039 38.502 36.345 36.522 1.00 0.00 H ATOM 41988 C113 PA 1039 38.236 36.390 34.375 1.00 0.00 C ATOM 41989 H13R PA 1039 37.220 36.660 34.671 1.00 0.00 H ATOM 41990 H13S PA 1039 38.039 35.556 33.698 1.00 0.00 H ATOM 41991 C112 PA 1039 38.937 37.437 33.528 1.00 0.00 C ATOM 41992 H12R PA 1039 39.533 38.117 34.140 1.00 0.00 H ATOM 41993 H12S PA 1039 38.126 38.020 33.087 1.00 0.00 H ATOM 41994 C111 PA 1039 39.974 36.833 32.440 1.00 0.00 C ATOM 41995 H11R PA 1039 39.383 36.208 31.766 1.00 0.00 H ATOM 41996 H11S PA 1039 40.588 36.149 33.029 1.00 0.00 H ATOM 41997 C110 PA 1039 40.764 37.874 31.628 1.00 0.00 C ATOM 41998 H10R PA 1039 41.362 38.432 32.351 1.00 0.00 H ATOM 41999 H10S PA 1039 40.026 38.544 31.183 1.00 0.00 H ATOM 42000 C19 PA 1039 41.879 37.400 30.684 1.00 0.00 C ATOM 42001 H9R PA 1039 42.228 38.223 30.057 1.00 0.00 H ATOM 42002 H9S PA 1039 41.596 36.627 29.966 1.00 0.00 H ATOM 42003 C18 PA 1039 43.106 36.845 31.424 1.00 0.00 C ATOM 42004 H8R PA 1039 42.779 35.983 32.010 1.00 0.00 H ATOM 42005 H8S PA 1039 43.484 37.565 32.152 1.00 0.00 H ATOM 42006 C17 PA 1039 44.184 36.408 30.523 1.00 0.00 C ATOM 42007 H7R PA 1039 44.381 37.201 29.798 1.00 0.00 H ATOM 42008 H7S PA 1039 43.735 35.563 29.997 1.00 0.00 H ATOM 42009 C16 PA 1039 45.478 35.873 31.198 1.00 0.00 C ATOM 42010 H6R PA 1039 45.240 35.050 31.875 1.00 0.00 H ATOM 42011 H6S PA 1039 45.822 36.663 31.869 1.00 0.00 H ATOM 42012 C15 PA 1039 46.640 35.439 30.334 1.00 0.00 C ATOM 42013 H5R PA 1039 46.238 34.779 29.562 1.00 0.00 H ATOM 42014 H5S PA 1039 47.301 34.823 30.948 1.00 0.00 H ATOM 42015 C14 PA 1039 47.586 36.504 29.873 1.00 0.00 C ATOM 42016 H4R PA 1039 47.995 37.049 30.726 1.00 0.00 H ATOM 42017 H4S PA 1039 47.073 37.272 29.291 1.00 0.00 H ATOM 42018 C13 PA 1039 48.644 36.004 28.813 1.00 0.00 C ATOM 42019 H3R PA 1039 48.108 35.576 27.963 1.00 0.00 H ATOM 42020 H3S PA 1039 49.116 35.170 29.336 1.00 0.00 H ATOM 42021 C12 PA 1039 49.723 37.072 28.387 1.00 0.00 C ATOM 42022 H2R PA 1039 50.328 37.304 29.265 1.00 0.00 H ATOM 42023 H2S PA 1039 49.265 37.939 27.906 1.00 0.00 H ATOM 42024 C11 PGR 1040 50.523 36.541 27.243 1.00 0.00 C ATOM 42025 O12 PGR 1040 50.088 35.857 26.324 1.00 0.00 O ATOM 42026 O11 PGR 1040 51.884 36.815 27.423 1.00 0.00 O ATOM 42027 C1 PGR 1040 52.802 36.110 26.514 1.00 0.00 C ATOM 42028 HR PGR 1040 52.423 35.130 26.211 1.00 0.00 H ATOM 42029 HS PGR 1040 53.659 35.934 27.168 1.00 0.00 H ATOM 42030 C2 PGR 1040 53.201 36.891 25.254 1.00 0.00 C ATOM 42031 HX PGR 1040 52.362 37.070 24.576 1.00 0.00 H ATOM 42032 C3 PGR 1040 54.301 36.078 24.517 1.00 0.00 C ATOM 42033 HA PGR 1040 54.081 35.014 24.396 1.00 0.00 H ATOM 42034 HB PGR 1040 55.209 36.208 25.112 1.00 0.00 H ATOM 42035 O31 PGR 1040 54.576 36.623 23.292 1.00 0.00 O ATOM 42036 P31 PGR 1040 55.093 35.704 22.078 1.00 0.00 P ATOM 42037 O32 PGR 1040 56.664 35.412 22.206 1.00 0.00 O ATOM 42038 C31 PGR 1040 57.551 36.480 22.487 1.00 0.00 C ATOM 42039 H1A PGR 1040 57.323 36.849 23.490 1.00 0.00 H ATOM 42040 H1B PGR 1040 57.603 37.264 21.728 1.00 0.00 H ATOM 42041 C32 PGR 1040 59.008 35.894 22.424 1.00 0.00 C ATOM 42042 H2A PGR 1040 58.921 35.321 21.498 1.00 0.00 H ATOM 42043 O35 PGR 1040 59.305 35.064 23.545 1.00 0.00 O ATOM 42044 HO5A PGR 1040 58.585 34.438 23.742 1.00 0.00 H ATOM 42045 C33 PGR 1040 59.976 37.096 22.225 1.00 0.00 C ATOM 42046 H3A PGR 1040 61.009 36.739 22.221 1.00 0.00 H ATOM 42047 H3B PGR 1040 59.753 37.621 21.292 1.00 0.00 H ATOM 42048 O33 PGR 1040 54.352 34.387 22.099 1.00 0.00 O ATOM 42049 O34 PGR 1040 55.024 36.475 20.791 1.00 0.00 O ATOM 42050 O21 PGR 1040 53.867 38.046 25.727 1.00 0.00 O ATOM 42051 C21 PGR 1040 53.075 39.157 25.730 1.00 0.00 C ATOM 42052 O22 PGR 1040 51.907 39.201 25.351 1.00 0.00 O ATOM 42053 O36 PGR 1040 59.883 37.966 23.409 1.00 0.00 O ATOM 42054 HO6A PGR 1040 60.061 37.449 24.215 1.00 0.00 H ATOM 42055 C12 OL 1041 53.726 40.442 26.254 1.00 0.00 C ATOM 42056 H2R OL 1041 54.722 40.479 25.807 1.00 0.00 H ATOM 42057 H2S OL 1041 53.138 41.209 25.745 1.00 0.00 H ATOM 42058 C13 OL 1041 53.698 40.701 27.788 1.00 0.00 C ATOM 42059 H3R OL 1041 53.897 41.746 28.035 1.00 0.00 H ATOM 42060 H3S OL 1041 52.684 40.512 28.146 1.00 0.00 H ATOM 42061 C14 OL 1041 54.639 39.723 28.587 1.00 0.00 C ATOM 42062 H4R OL 1041 54.375 38.712 28.271 1.00 0.00 H ATOM 42063 H4S OL 1041 55.679 39.958 28.350 1.00 0.00 H ATOM 42064 C15 OL 1041 54.505 39.777 30.106 1.00 0.00 C ATOM 42065 H5R OL 1041 54.946 40.700 30.487 1.00 0.00 H ATOM 42066 H5S OL 1041 53.508 39.633 30.530 1.00 0.00 H ATOM 42067 C16 OL 1041 55.257 38.633 30.790 1.00 0.00 C ATOM 42068 H6R OL 1041 54.865 37.652 30.516 1.00 0.00 H ATOM 42069 H6S OL 1041 56.264 38.641 30.369 1.00 0.00 H ATOM 42070 C17 OL 1041 55.403 38.911 32.203 1.00 0.00 C ATOM 42071 H7R OL 1041 56.104 39.746 32.261 1.00 0.00 H ATOM 42072 H7S OL 1041 54.441 39.302 32.541 1.00 0.00 H ATOM 42073 C18 OL 1041 55.833 37.704 32.959 1.00 0.00 C ATOM 42074 H8R OL 1041 55.211 36.816 32.824 1.00 0.00 H ATOM 42075 H8S OL 1041 56.790 37.529 32.462 1.00 0.00 H ATOM 42076 C19 OL 1041 56.024 38.108 34.401 1.00 0.00 C ATOM 42077 H9R OL 1041 56.311 39.147 34.544 1.00 0.00 H ATOM 42078 C110 OL 1041 55.654 37.463 35.510 1.00 0.00 C ATOM 42079 H10R OL 1041 55.792 38.007 36.440 1.00 0.00 H ATOM 42080 C111 OL 1041 55.359 35.996 35.599 1.00 0.00 C ATOM 42081 H11R OL 1041 55.811 35.528 34.723 1.00 0.00 H ATOM 42082 H11S OL 1041 55.844 35.715 36.536 1.00 0.00 H ATOM 42083 C112 OL 1041 53.921 35.615 35.660 1.00 0.00 C ATOM 42084 H12R OL 1041 53.434 35.982 36.566 1.00 0.00 H ATOM 42085 H12S OL 1041 53.514 36.097 34.768 1.00 0.00 H ATOM 42086 C113 OL 1041 53.723 34.087 35.407 1.00 0.00 C ATOM 42087 H13R OL 1041 54.261 33.761 34.515 1.00 0.00 H ATOM 42088 H13S OL 1041 54.340 33.539 36.122 1.00 0.00 H ATOM 42089 C114 OL 1041 52.269 33.542 35.381 1.00 0.00 C ATOM 42090 H14R OL 1041 51.749 33.979 36.236 1.00 0.00 H ATOM 42091 H14S OL 1041 51.765 34.006 34.531 1.00 0.00 H ATOM 42092 C115 OL 1041 52.186 32.004 35.428 1.00 0.00 C ATOM 42093 H15R OL 1041 52.686 31.485 34.607 1.00 0.00 H ATOM 42094 H15S OL 1041 52.750 31.606 36.274 1.00 0.00 H ATOM 42095 C116 OL 1041 50.733 31.535 35.518 1.00 0.00 C ATOM 42096 H16R OL 1041 50.619 30.568 36.012 1.00 0.00 H ATOM 42097 H16S OL 1041 50.248 32.335 36.082 1.00 0.00 H ATOM 42098 C117 OL 1041 49.979 31.478 34.145 1.00 0.00 C ATOM 42099 H17R OL 1041 50.625 31.119 33.341 1.00 0.00 H ATOM 42100 H17S OL 1041 49.192 30.723 34.102 1.00 0.00 H ATOM 42101 C118 OL 1041 49.465 32.710 33.480 1.00 0.00 C ATOM 42102 H18R OL 1041 48.850 33.329 34.135 1.00 0.00 H ATOM 42103 H18S OL 1041 48.781 32.462 32.666 1.00 0.00 H ATOM 42104 H18T OL 1041 50.196 33.331 32.958 1.00 0.00 H TER 42105 OL 1041 ATOM 42105 C116 PA 1042 97.140 81.405 39.357 1.00 0.00 C ATOM 42106 H16R PA 1042 96.511 82.017 40.008 1.00 0.00 H ATOM 42107 H16S PA 1042 97.330 80.515 39.962 1.00 0.00 H ATOM 42108 H16T PA 1042 96.590 81.088 38.468 1.00 0.00 H ATOM 42109 C115 PA 1042 98.467 82.073 39.058 1.00 0.00 C ATOM 42110 H15R PA 1042 99.027 82.338 39.956 1.00 0.00 H ATOM 42111 H15S PA 1042 98.372 82.983 38.462 1.00 0.00 H ATOM 42112 C114 PA 1042 99.570 81.125 38.459 1.00 0.00 C ATOM 42113 H14R PA 1042 99.777 80.252 39.081 1.00 0.00 H ATOM 42114 H14S PA 1042 100.501 81.691 38.376 1.00 0.00 H ATOM 42115 C113 PA 1042 99.133 80.584 37.128 1.00 0.00 C ATOM 42116 H13R PA 1042 98.843 81.447 36.525 1.00 0.00 H ATOM 42117 H13S PA 1042 98.196 80.024 37.170 1.00 0.00 H ATOM 42118 C112 PA 1042 100.157 79.657 36.446 1.00 0.00 C ATOM 42119 H12R PA 1042 99.936 78.647 36.798 1.00 0.00 H ATOM 42120 H12S PA 1042 101.159 79.916 36.794 1.00 0.00 H ATOM 42121 C111 PA 1042 100.084 79.723 34.936 1.00 0.00 C ATOM 42122 H11R PA 1042 99.228 80.308 34.593 1.00 0.00 H ATOM 42123 H11S PA 1042 99.731 78.732 34.642 1.00 0.00 H ATOM 42124 C110 PA 1042 101.424 80.145 34.367 1.00 0.00 C ATOM 42125 H10R PA 1042 102.241 79.571 34.808 1.00 0.00 H ATOM 42126 H10S PA 1042 101.571 81.162 34.735 1.00 0.00 H ATOM 42127 C19 PA 1042 101.591 79.994 32.837 1.00 0.00 C ATOM 42128 H9R PA 1042 100.778 80.523 32.336 1.00 0.00 H ATOM 42129 H9S PA 1042 101.363 78.956 32.584 1.00 0.00 H ATOM 42130 C18 PA 1042 102.967 80.516 32.438 1.00 0.00 C ATOM 42131 H8R PA 1042 102.990 80.608 31.350 1.00 0.00 H ATOM 42132 H8S PA 1042 103.591 79.647 32.659 1.00 0.00 H ATOM 42133 C17 PA 1042 103.342 81.942 32.982 1.00 0.00 C ATOM 42134 H7R PA 1042 104.262 82.304 32.519 1.00 0.00 H ATOM 42135 H7S PA 1042 103.667 81.967 34.024 1.00 0.00 H ATOM 42136 C16 PA 1042 102.356 83.033 32.799 1.00 0.00 C ATOM 42137 H6R PA 1042 102.889 83.897 33.202 1.00 0.00 H ATOM 42138 H6S PA 1042 101.445 82.773 33.343 1.00 0.00 H ATOM 42139 C15 PA 1042 102.043 83.334 31.369 1.00 0.00 C ATOM 42140 H5R PA 1042 101.697 82.360 31.018 1.00 0.00 H ATOM 42141 H5S PA 1042 102.981 83.609 30.883 1.00 0.00 H ATOM 42142 C14 PA 1042 101.123 84.497 31.242 1.00 0.00 C ATOM 42143 H4R PA 1042 101.001 84.675 30.172 1.00 0.00 H ATOM 42144 H4S PA 1042 101.650 85.411 31.525 1.00 0.00 H ATOM 42145 C13 PA 1042 99.767 84.623 31.962 1.00 0.00 C ATOM 42146 H3R PA 1042 99.223 85.490 31.581 1.00 0.00 H ATOM 42147 H3S PA 1042 100.017 84.665 33.024 1.00 0.00 H ATOM 42148 C12 PA 1042 98.811 83.552 31.799 1.00 0.00 C ATOM 42149 H2R PA 1042 98.125 83.671 32.639 1.00 0.00 H ATOM 42150 H2S PA 1042 99.334 82.607 31.961 1.00 0.00 H ATOM 42151 C11 PGR 1043 98.152 83.487 30.433 1.00 0.00 C ATOM 42152 O12 PGR 1043 98.420 84.291 29.578 1.00 0.00 O ATOM 42153 O11 PGR 1043 97.367 82.386 30.187 1.00 0.00 O ATOM 42154 C1 PGR 1043 96.704 82.306 28.897 1.00 0.00 C ATOM 42155 HR PGR 1043 97.312 82.655 28.058 1.00 0.00 H ATOM 42156 HS PGR 1043 95.822 82.948 28.952 1.00 0.00 H ATOM 42157 C2 PGR 1043 96.277 80.873 28.709 1.00 0.00 C ATOM 42158 HX PGR 1043 97.113 80.318 29.141 1.00 0.00 H ATOM 42159 C3 PGR 1043 96.166 80.549 27.204 1.00 0.00 C ATOM 42160 HA PGR 1043 95.621 79.605 27.122 1.00 0.00 H ATOM 42161 HB PGR 1043 97.187 80.456 26.825 1.00 0.00 H ATOM 42162 O31 PGR 1043 95.490 81.655 26.527 1.00 0.00 O ATOM 42163 P31 PGR 1043 95.545 81.825 24.879 1.00 0.00 P ATOM 42164 O32 PGR 1043 94.673 80.486 24.422 1.00 0.00 O ATOM 42165 C31 PGR 1043 95.311 79.300 24.094 1.00 0.00 C ATOM 42166 H1A PGR 1043 96.125 79.153 24.809 1.00 0.00 H ATOM 42167 H1B PGR 1043 95.707 79.315 23.076 1.00 0.00 H ATOM 42168 C32 PGR 1043 94.180 78.357 24.218 1.00 0.00 C ATOM 42169 H2A PGR 1043 93.323 78.720 23.645 1.00 0.00 H ATOM 42170 O35 PGR 1043 93.759 78.149 25.575 1.00 0.00 O ATOM 42171 HO5A PGR 1043 93.607 79.022 25.980 1.00 0.00 H ATOM 42172 C33 PGR 1043 94.590 77.035 23.599 1.00 0.00 C ATOM 42173 H3A PGR 1043 94.979 77.229 22.596 1.00 0.00 H ATOM 42174 H3B PGR 1043 95.376 76.514 24.152 1.00 0.00 H ATOM 42175 O33 PGR 1043 94.746 83.003 24.607 1.00 0.00 O ATOM 42176 O34 PGR 1043 96.930 81.640 24.413 1.00 0.00 O ATOM 42177 O21 PGR 1043 95.016 80.570 29.392 1.00 0.00 O ATOM 42178 C21 PGR 1043 94.705 79.290 29.784 1.00 0.00 C ATOM 42179 O22 PGR 1043 95.353 78.315 29.344 1.00 0.00 O ATOM 42180 O36 PGR 1043 93.528 76.038 23.538 1.00 0.00 O ATOM 42181 HO6A PGR 1043 93.197 75.761 24.412 1.00 0.00 H ATOM 42182 C12 OL 1044 93.432 79.195 30.614 1.00 0.00 C ATOM 42183 H2R OL 1044 93.537 79.850 31.481 1.00 0.00 H ATOM 42184 H2S OL 1044 92.603 79.671 30.087 1.00 0.00 H ATOM 42185 C13 OL 1044 93.132 77.689 31.036 1.00 0.00 C ATOM 42186 H3R OL 1044 93.101 77.185 30.068 1.00 0.00 H ATOM 42187 H3S OL 1044 93.975 77.335 31.632 1.00 0.00 H ATOM 42188 C14 OL 1044 91.853 77.555 31.757 1.00 0.00 C ATOM 42189 H4R OL 1044 91.941 76.620 32.314 1.00 0.00 H ATOM 42190 H4S OL 1044 91.784 78.404 32.441 1.00 0.00 H ATOM 42191 C15 OL 1044 90.642 77.352 30.807 1.00 0.00 C ATOM 42192 H5R OL 1044 90.745 78.073 29.994 1.00 0.00 H ATOM 42193 H5S OL 1044 90.528 76.385 30.312 1.00 0.00 H ATOM 42194 C16 OL 1044 89.346 77.625 31.545 1.00 0.00 C ATOM 42195 H6R OL 1044 89.302 77.353 32.601 1.00 0.00 H ATOM 42196 H6S OL 1044 89.222 78.710 31.579 1.00 0.00 H ATOM 42197 C17 OL 1044 88.098 77.128 30.877 1.00 0.00 C ATOM 42198 H7R OL 1044 87.386 77.952 30.796 1.00 0.00 H ATOM 42199 H7S OL 1044 88.112 76.821 29.829 1.00 0.00 H ATOM 42200 C18 OL 1044 87.351 76.057 31.595 1.00 0.00 C ATOM 42201 H8R OL 1044 87.306 76.347 32.646 1.00 0.00 H ATOM 42202 H8S OL 1044 86.364 76.153 31.139 1.00 0.00 H ATOM 42203 C19 OL 1044 87.862 74.675 31.625 1.00 0.00 C ATOM 42204 H9R OL 1044 88.876 74.748 32.008 1.00 0.00 H ATOM 42205 C110 OL 1044 87.275 73.516 31.318 1.00 0.00 C ATOM 42206 H10R OL 1044 87.793 72.589 31.553 1.00 0.00 H ATOM 42207 C111 OL 1044 86.006 73.296 30.601 1.00 0.00 C ATOM 42208 H11R OL 1044 85.682 74.087 29.923 1.00 0.00 H ATOM 42209 H11S OL 1044 86.133 72.559 29.805 1.00 0.00 H ATOM 42210 C112 OL 1044 84.789 72.831 31.452 1.00 0.00 C ATOM 42211 H12R OL 1044 83.865 72.613 30.912 1.00 0.00 H ATOM 42212 H12S OL 1044 85.048 71.817 31.763 1.00 0.00 H ATOM 42213 C113 OL 1044 84.414 73.774 32.602 1.00 0.00 C ATOM 42214 H13R OL 1044 85.350 73.911 33.149 1.00 0.00 H ATOM 42215 H13S OL 1044 84.064 74.702 32.146 1.00 0.00 H ATOM 42216 C114 OL 1044 83.355 73.244 33.605 1.00 0.00 C ATOM 42217 H14R OL 1044 82.516 73.030 32.941 1.00 0.00 H ATOM 42218 H14S OL 1044 83.695 72.299 34.034 1.00 0.00 H ATOM 42219 C115 OL 1044 83.012 74.347 34.609 1.00 0.00 C ATOM 42220 H15R OL 1044 83.118 75.338 34.161 1.00 0.00 H ATOM 42221 H15S OL 1044 81.991 74.265 34.988 1.00 0.00 H ATOM 42222 C116 OL 1044 83.996 74.311 35.835 1.00 0.00 C ATOM 42223 H16R OL 1044 83.926 73.343 36.335 1.00 0.00 H ATOM 42224 H16S OL 1044 85.037 74.534 35.593 1.00 0.00 H ATOM 42225 C117 OL 1044 83.707 75.285 36.878 1.00 0.00 C ATOM 42226 H17R OL 1044 84.513 75.140 37.601 1.00 0.00 H ATOM 42227 H17S OL 1044 83.762 76.281 36.434 1.00 0.00 H ATOM 42228 C118 OL 1044 82.242 75.195 37.362 1.00 0.00 C ATOM 42229 H18R OL 1044 81.553 75.760 36.730 1.00 0.00 H ATOM 42230 H18S OL 1044 82.186 75.623 38.365 1.00 0.00 H ATOM 42231 H18T OL 1044 81.890 74.161 37.397 1.00 0.00 H TER 42232 OL 1044 ATOM 42232 C116 PA 1045 98.120 69.165 44.725 1.00 0.00 C ATOM 42233 H16R PA 1045 97.710 69.116 45.737 1.00 0.00 H ATOM 42234 H16S PA 1045 99.021 69.766 44.863 1.00 0.00 H ATOM 42235 H16T PA 1045 98.420 68.181 44.358 1.00 0.00 H ATOM 42236 C115 PA 1045 97.244 69.807 43.623 1.00 0.00 C ATOM 42237 H15R PA 1045 97.031 70.828 43.944 1.00 0.00 H ATOM 42238 H15S PA 1045 96.273 69.325 43.761 1.00 0.00 H ATOM 42239 C114 PA 1045 97.834 69.879 42.228 1.00 0.00 C ATOM 42240 H14R PA 1045 98.315 68.931 41.979 1.00 0.00 H ATOM 42241 H14S PA 1045 98.728 70.503 42.166 1.00 0.00 H ATOM 42242 C113 PA 1045 96.828 70.303 41.161 1.00 0.00 C ATOM 42243 H13R PA 1045 96.287 71.171 41.542 1.00 0.00 H ATOM 42244 H13S PA 1045 96.127 69.466 41.135 1.00 0.00 H ATOM 42245 C112 PA 1045 97.493 70.650 39.766 1.00 0.00 C ATOM 42246 H12R PA 1045 97.707 69.740 39.203 1.00 0.00 H ATOM 42247 H12S PA 1045 98.455 71.140 39.929 1.00 0.00 H ATOM 42248 C111 PA 1045 96.743 71.592 38.766 1.00 0.00 C ATOM 42249 H11R PA 1045 96.648 72.533 39.313 1.00 0.00 H ATOM 42250 H11S PA 1045 95.731 71.203 38.636 1.00 0.00 H ATOM 42251 C110 PA 1045 97.364 71.677 37.410 1.00 0.00 C ATOM 42252 H10R PA 1045 97.311 70.671 36.988 1.00 0.00 H ATOM 42253 H10S PA 1045 98.440 71.780 37.565 1.00 0.00 H ATOM 42254 C19 PA 1045 96.872 72.851 36.540 1.00 0.00 C ATOM 42255 H9R PA 1045 97.228 73.806 36.932 1.00 0.00 H ATOM 42256 H9S PA 1045 95.793 72.846 36.706 1.00 0.00 H ATOM 42257 C18 PA 1045 96.972 72.709 35.075 1.00 0.00 C ATOM 42258 H8R PA 1045 96.298 71.876 34.867 1.00 0.00 H ATOM 42259 H8S PA 1045 97.989 72.468 34.756 1.00 0.00 H ATOM 42260 C17 PA 1045 96.500 73.879 34.320 1.00 0.00 C ATOM 42261 H7R PA 1045 97.240 74.663 34.489 1.00 0.00 H ATOM 42262 H7S PA 1045 95.601 74.274 34.799 1.00 0.00 H ATOM 42263 C16 PA 1045 96.328 73.629 32.803 1.00 0.00 C ATOM 42264 H6R PA 1045 95.749 72.706 32.719 1.00 0.00 H ATOM 42265 H6S PA 1045 97.329 73.381 32.444 1.00 0.00 H ATOM 42266 C15 PA 1045 95.632 74.616 31.902 1.00 0.00 C ATOM 42267 H5R PA 1045 96.071 75.611 32.000 1.00 0.00 H ATOM 42268 H5S PA 1045 94.617 74.796 32.264 1.00 0.00 H ATOM 42269 C14 PA 1045 95.436 74.026 30.480 1.00 0.00 C ATOM 42270 H4R PA 1045 95.028 73.042 30.722 1.00 0.00 H ATOM 42271 H4S PA 1045 96.408 73.782 30.046 1.00 0.00 H ATOM 42272 C13 PA 1045 94.406 74.739 29.565 1.00 0.00 C ATOM 42273 H3R PA 1045 94.605 75.812 29.516 1.00 0.00 H ATOM 42274 H3S PA 1045 93.447 74.753 30.086 1.00 0.00 H ATOM 42275 C12 PA 1045 94.282 74.219 28.138 1.00 0.00 C ATOM 42276 H2R PA 1045 93.942 73.184 28.216 1.00 0.00 H ATOM 42277 H2S PA 1045 95.263 74.199 27.659 1.00 0.00 H ATOM 42278 C11 PGR 1046 93.320 74.893 27.227 1.00 0.00 C ATOM 42279 O12 PGR 1046 93.402 74.925 25.995 1.00 0.00 O ATOM 42280 O11 PGR 1046 92.359 75.497 27.898 1.00 0.00 O ATOM 42281 C1 PGR 1046 91.360 76.260 27.178 1.00 0.00 C ATOM 42282 HR PGR 1046 91.852 76.997 26.538 1.00 0.00 H ATOM 42283 HS PGR 1046 90.710 76.770 27.894 1.00 0.00 H ATOM 42284 C2 PGR 1046 90.402 75.365 26.277 1.00 0.00 C ATOM 42285 HX PGR 1046 91.018 74.718 25.648 1.00 0.00 H ATOM 42286 C3 PGR 1046 89.458 76.176 25.394 1.00 0.00 C ATOM 42287 HA PGR 1046 89.983 76.855 24.716 1.00 0.00 H ATOM 42288 HB PGR 1046 88.690 76.667 25.996 1.00 0.00 H ATOM 42289 O31 PGR 1046 88.716 75.221 24.647 1.00 0.00 O ATOM 42290 P31 PGR 1046 87.486 75.701 23.658 1.00 0.00 P ATOM 42291 O32 PGR 1046 86.287 76.209 24.592 1.00 0.00 O ATOM 42292 C31 PGR 1046 85.407 75.375 25.287 1.00 0.00 C ATOM 42293 H1A PGR 1046 86.006 74.648 25.841 1.00 0.00 H ATOM 42294 H1B PGR 1046 84.693 74.849 24.648 1.00 0.00 H ATOM 42295 C32 PGR 1046 84.543 76.014 26.422 1.00 0.00 C ATOM 42296 H2A PGR 1046 84.239 75.151 27.019 1.00 0.00 H ATOM 42297 O35 PGR 1046 83.446 76.778 25.851 1.00 0.00 O ATOM 42298 HO5A PGR 1046 83.862 77.639 25.662 1.00 0.00 H ATOM 42299 C33 PGR 1046 85.378 76.914 27.334 1.00 0.00 C ATOM 42300 H3A PGR 1046 84.817 77.084 28.257 1.00 0.00 H ATOM 42301 H3B PGR 1046 86.285 76.360 27.588 1.00 0.00 H ATOM 42302 O33 PGR 1046 87.953 76.891 22.945 1.00 0.00 O ATOM 42303 O34 PGR 1046 87.003 74.551 22.929 1.00 0.00 O ATOM 42304 O21 PGR 1046 89.682 74.547 27.198 1.00 0.00 O ATOM 42305 C21 PGR 1046 90.140 73.390 27.631 1.00 0.00 C ATOM 42306 O22 PGR 1046 91.069 72.826 27.115 1.00 0.00 O ATOM 42307 O36 PGR 1046 85.787 78.132 26.753 1.00 0.00 O ATOM 42308 HO6A PGR 1046 86.194 78.710 27.424 1.00 0.00 H ATOM 42309 C12 OL 1047 89.213 72.721 28.610 1.00 0.00 C ATOM 42310 H2R OL 1047 88.589 73.506 29.042 1.00 0.00 H ATOM 42311 H2S OL 1047 88.522 72.070 28.071 1.00 0.00 H ATOM 42312 C13 OL 1047 89.979 71.824 29.594 1.00 0.00 C ATOM 42313 H3R OL 1047 89.289 71.281 30.244 1.00 0.00 H ATOM 42314 H3S OL 1047 90.566 71.083 29.047 1.00 0.00 H ATOM 42315 C14 OL 1047 91.023 72.514 30.455 1.00 0.00 C ATOM 42316 H4R OL 1047 91.778 73.056 29.882 1.00 0.00 H ATOM 42317 H4S OL 1047 90.533 73.329 30.992 1.00 0.00 H ATOM 42318 C15 OL 1047 91.555 71.581 31.549 1.00 0.00 C ATOM 42319 H5R OL 1047 90.753 71.141 32.146 1.00 0.00 H ATOM 42320 H5S OL 1047 92.002 70.734 31.026 1.00 0.00 H ATOM 42321 C16 OL 1047 92.679 72.139 32.327 1.00 0.00 C ATOM 42322 H6R OL 1047 93.571 71.522 32.199 1.00 0.00 H ATOM 42323 H6S OL 1047 93.018 73.050 31.828 1.00 0.00 H ATOM 42324 C17 OL 1047 92.491 72.377 33.833 1.00 0.00 C ATOM 42325 H7R OL 1047 92.043 71.509 34.319 1.00 0.00 H ATOM 42326 H7S OL 1047 93.461 72.280 34.325 1.00 0.00 H ATOM 42327 C18 OL 1047 91.937 73.716 34.244 1.00 0.00 C ATOM 42328 H8R OL 1047 92.253 73.869 35.278 1.00 0.00 H ATOM 42329 H8S OL 1047 92.292 74.505 33.579 1.00 0.00 H ATOM 42330 C19 OL 1047 90.408 73.757 34.174 1.00 0.00 C ATOM 42331 H9R OL 1047 89.959 73.433 33.238 1.00 0.00 H ATOM 42332 C110 OL 1047 89.481 74.310 35.017 1.00 0.00 C ATOM 42333 H10R OL 1047 88.465 74.361 34.633 1.00 0.00 H ATOM 42334 C111 OL 1047 89.737 74.983 36.314 1.00 0.00 C ATOM 42335 H11R OL 1047 89.046 74.522 37.023 1.00 0.00 H ATOM 42336 H11S OL 1047 90.768 74.877 36.657 1.00 0.00 H ATOM 42337 C112 OL 1047 89.535 76.535 36.154 1.00 0.00 C ATOM 42338 H12R OL 1047 89.809 77.148 37.015 1.00 0.00 H ATOM 42339 H12S OL 1047 90.218 76.892 35.381 1.00 0.00 H ATOM 42340 C113 OL 1047 88.112 76.879 35.653 1.00 0.00 C ATOM 42341 H13R OL 1047 87.910 76.293 34.753 1.00 0.00 H ATOM 42342 H13S OL 1047 87.286 76.712 36.348 1.00 0.00 H ATOM 42343 C114 OL 1047 88.028 78.384 35.286 1.00 0.00 C ATOM 42344 H14R OL 1047 88.528 79.014 36.025 1.00 0.00 H ATOM 42345 H14S OL 1047 88.698 78.378 34.424 1.00 0.00 H ATOM 42346 C115 OL 1047 86.616 78.883 35.011 1.00 0.00 C ATOM 42347 H15R OL 1047 85.987 78.164 34.483 1.00 0.00 H ATOM 42348 H15S OL 1047 86.184 79.000 36.007 1.00 0.00 H ATOM 42349 C116 OL 1047 86.555 80.263 34.395 1.00 0.00 C ATOM 42350 H16R OL 1047 87.225 80.947 34.919 1.00 0.00 H ATOM 42351 H16S OL 1047 86.995 80.125 33.405 1.00 0.00 H ATOM 42352 C117 OL 1047 85.112 80.849 34.291 1.00 0.00 C ATOM 42353 H17R OL 1047 84.494 80.141 33.735 1.00 0.00 H ATOM 42354 H17S OL 1047 84.691 80.738 35.292 1.00 0.00 H ATOM 42355 C118 OL 1047 84.971 82.184 33.615 1.00 0.00 C ATOM 42356 H18R OL 1047 85.254 82.815 34.461 1.00 0.00 H ATOM 42357 H18S OL 1047 83.898 82.269 33.433 1.00 0.00 H ATOM 42358 H18T OL 1047 85.660 82.299 32.776 1.00 0.00 H TER 42359 OL 1047 ATOM 42359 C116 PA 1048 72.884 99.709 39.160 1.00 0.00 C ATOM 42360 H16R PA 1048 72.882 99.737 40.252 1.00 0.00 H ATOM 42361 H16S PA 1048 71.924 100.100 38.818 1.00 0.00 H ATOM 42362 H16T PA 1048 73.688 100.423 38.967 1.00 0.00 H ATOM 42363 C115 PA 1048 73.197 98.289 38.740 1.00 0.00 C ATOM 42364 H15R PA 1048 73.124 98.117 37.664 1.00 0.00 H ATOM 42365 H15S PA 1048 72.470 97.548 39.076 1.00 0.00 H ATOM 42366 C114 PA 1048 74.565 97.898 39.325 1.00 0.00 C ATOM 42367 H14R PA 1048 74.412 98.092 40.389 1.00 0.00 H ATOM 42368 H14S PA 1048 75.286 98.615 38.929 1.00 0.00 H ATOM 42369 C113 PA 1048 74.955 96.460 38.924 1.00 0.00 C ATOM 42370 H13R PA 1048 75.961 96.207 39.265 1.00 0.00 H ATOM 42371 H13S PA 1048 75.121 96.277 37.860 1.00 0.00 H ATOM 42372 C112 PA 1048 73.892 95.520 39.545 1.00 0.00 C ATOM 42373 H12R PA 1048 72.975 95.298 38.997 1.00 0.00 H ATOM 42374 H12S PA 1048 73.589 95.943 40.505 1.00 0.00 H ATOM 42375 C111 PA 1048 74.521 94.194 39.897 1.00 0.00 C ATOM 42376 H11R PA 1048 73.806 93.463 40.282 1.00 0.00 H ATOM 42377 H11S PA 1048 75.210 94.419 40.714 1.00 0.00 H ATOM 42378 C110 PA 1048 75.495 93.579 38.759 1.00 0.00 C ATOM 42379 H10R PA 1048 75.994 92.704 39.182 1.00 0.00 H ATOM 42380 H10S PA 1048 76.325 94.269 38.590 1.00 0.00 H ATOM 42381 C19 PA 1048 74.625 93.347 37.474 1.00 0.00 C ATOM 42382 H9R PA 1048 74.183 94.280 37.117 1.00 0.00 H ATOM 42383 H9S PA 1048 73.793 92.772 37.886 1.00 0.00 H ATOM 42384 C18 PA 1048 75.249 92.414 36.523 1.00 0.00 C ATOM 42385 H8R PA 1048 74.446 92.116 35.845 1.00 0.00 H ATOM 42386 H8S PA 1048 75.522 91.495 37.045 1.00 0.00 H ATOM 42387 C17 PA 1048 76.472 92.736 35.773 1.00 0.00 C ATOM 42388 H7R PA 1048 77.185 93.234 36.433 1.00 0.00 H ATOM 42389 H7S PA 1048 76.198 93.463 35.006 1.00 0.00 H ATOM 42390 C16 PA 1048 77.160 91.533 35.085 1.00 0.00 C ATOM 42391 H6R PA 1048 77.411 90.782 35.836 1.00 0.00 H ATOM 42392 H6S PA 1048 78.084 91.989 34.723 1.00 0.00 H ATOM 42393 C15 PA 1048 76.351 90.848 33.937 1.00 0.00 C ATOM 42394 H5R PA 1048 75.931 91.560 33.224 1.00 0.00 H ATOM 42395 H5S PA 1048 75.578 90.243 34.415 1.00 0.00 H ATOM 42396 C14 PA 1048 77.170 89.730 33.164 1.00 0.00 C ATOM 42397 H4R PA 1048 77.951 89.326 33.812 1.00 0.00 H ATOM 42398 H4S PA 1048 77.649 90.248 32.331 1.00 0.00 H ATOM 42399 C13 PA 1048 76.293 88.507 32.668 1.00 0.00 C ATOM 42400 H3R PA 1048 75.496 88.946 32.064 1.00 0.00 H ATOM 42401 H3S PA 1048 75.947 88.001 33.572 1.00 0.00 H ATOM 42402 C12 PA 1048 77.081 87.498 31.838 1.00 0.00 C ATOM 42403 H2R PA 1048 76.606 86.520 31.741 1.00 0.00 H ATOM 42404 H2S PA 1048 78.092 87.187 32.109 1.00 0.00 H ATOM 42405 C11 PGR 1049 77.165 88.011 30.419 1.00 0.00 C ATOM 42406 O12 PGR 1049 78.216 88.416 29.872 1.00 0.00 O ATOM 42407 O11 PGR 1049 75.939 88.032 29.753 1.00 0.00 O ATOM 42408 C1 PGR 1049 75.745 88.559 28.425 1.00 0.00 C ATOM 42409 HR PGR 1049 76.507 89.312 28.207 1.00 0.00 H ATOM 42410 HS PGR 1049 74.835 89.164 28.407 1.00 0.00 H ATOM 42411 C2 PGR 1049 75.528 87.326 27.479 1.00 0.00 C ATOM 42412 HX PGR 1049 76.290 86.544 27.524 1.00 0.00 H ATOM 42413 C3 PGR 1049 75.555 87.751 26.100 1.00 0.00 C ATOM 42414 HA PGR 1049 75.063 86.988 25.491 1.00 0.00 H ATOM 42415 HB PGR 1049 76.601 87.887 25.813 1.00 0.00 H ATOM 42416 O31 PGR 1049 74.946 89.065 25.776 1.00 0.00 O ATOM 42417 P31 PGR 1049 74.725 89.504 24.267 1.00 0.00 P ATOM 42418 O32 PGR 1049 76.027 90.355 23.857 1.00 0.00 O ATOM 42419 C31 PGR 1049 77.310 89.878 23.942 1.00 0.00 C ATOM 42420 H1A PGR 1049 77.758 89.951 22.947 1.00 0.00 H ATOM 42421 H1B PGR 1049 77.243 88.798 24.095 1.00 0.00 H ATOM 42422 C32 PGR 1049 78.116 90.576 24.989 1.00 0.00 C ATOM 42423 H2A PGR 1049 79.148 90.222 24.914 1.00 0.00 H ATOM 42424 O35 PGR 1049 77.581 90.431 26.296 1.00 0.00 O ATOM 42425 HO5A PGR 1049 76.708 90.862 26.286 1.00 0.00 H ATOM 42426 C33 PGR 1049 78.254 92.086 24.702 1.00 0.00 C ATOM 42427 H3A PGR 1049 78.304 92.164 23.613 1.00 0.00 H ATOM 42428 H3B PGR 1049 77.287 92.510 24.985 1.00 0.00 H ATOM 42429 O33 PGR 1049 74.577 88.296 23.440 1.00 0.00 O ATOM 42430 O34 PGR 1049 73.541 90.476 24.285 1.00 0.00 O ATOM 42431 O21 PGR 1049 74.219 86.716 27.813 1.00 0.00 O ATOM 42432 C21 PGR 1049 74.156 85.636 28.709 1.00 0.00 C ATOM 42433 O22 PGR 1049 75.102 85.069 29.181 1.00 0.00 O ATOM 42434 O36 PGR 1049 79.307 92.662 25.485 1.00 0.00 O ATOM 42435 HO6A PGR 1049 79.175 92.363 26.403 1.00 0.00 H ATOM 42436 C12 OL 1050 72.784 85.356 29.221 1.00 0.00 C ATOM 42437 H2R OL 1050 72.059 85.171 28.425 1.00 0.00 H ATOM 42438 H2S OL 1050 72.823 84.404 29.754 1.00 0.00 H ATOM 42439 C13 OL 1050 72.271 86.425 30.196 1.00 0.00 C ATOM 42440 H3R OL 1050 73.025 86.644 30.956 1.00 0.00 H ATOM 42441 H3S OL 1050 72.264 87.382 29.671 1.00 0.00 H ATOM 42442 C14 OL 1050 70.968 86.115 30.881 1.00 0.00 C ATOM 42443 H4R OL 1050 70.703 86.920 31.568 1.00 0.00 H ATOM 42444 H4S OL 1050 70.212 85.947 30.111 1.00 0.00 H ATOM 42445 C15 OL 1050 71.058 84.933 31.859 1.00 0.00 C ATOM 42446 H5R OL 1050 70.077 85.011 32.334 1.00 0.00 H ATOM 42447 H5S OL 1050 71.041 83.954 31.377 1.00 0.00 H ATOM 42448 C16 OL 1050 72.082 84.981 33.025 1.00 0.00 C ATOM 42449 H6R OL 1050 73.059 84.845 32.558 1.00 0.00 H ATOM 42450 H6S OL 1050 71.942 85.994 33.408 1.00 0.00 H ATOM 42451 C17 OL 1050 71.714 83.979 34.140 1.00 0.00 C ATOM 42452 H7R OL 1050 70.668 84.010 34.450 1.00 0.00 H ATOM 42453 H7S OL 1050 71.747 82.913 33.904 1.00 0.00 H ATOM 42454 C18 OL 1050 72.596 84.200 35.354 1.00 0.00 C ATOM 42455 H8R OL 1050 72.768 85.265 35.523 1.00 0.00 H ATOM 42456 H8S OL 1050 72.038 83.682 36.137 1.00 0.00 H ATOM 42457 C19 OL 1050 73.940 83.532 35.128 1.00 0.00 C ATOM 42458 H9R OL 1050 74.512 83.976 34.318 1.00 0.00 H ATOM 42459 C110 OL 1050 74.518 82.496 35.787 1.00 0.00 C ATOM 42460 H10R OL 1050 75.536 82.189 35.561 1.00 0.00 H ATOM 42461 C111 OL 1050 73.948 81.741 36.905 1.00 0.00 C ATOM 42462 H11R OL 1050 72.866 81.850 36.999 1.00 0.00 H ATOM 42463 H11S OL 1050 73.974 80.670 36.695 1.00 0.00 H ATOM 42464 C112 OL 1050 74.749 82.008 38.136 1.00 0.00 C ATOM 42465 H12R OL 1050 75.029 83.062 38.186 1.00 0.00 H ATOM 42466 H12S OL 1050 74.127 81.909 39.029 1.00 0.00 H ATOM 42467 C113 OL 1050 76.051 81.254 38.212 1.00 0.00 C ATOM 42468 H13R OL 1050 75.869 80.179 38.146 1.00 0.00 H ATOM 42469 H13S OL 1050 76.730 81.409 37.370 1.00 0.00 H ATOM 42470 C114 OL 1050 76.859 81.350 39.498 1.00 0.00 C ATOM 42471 H14R OL 1050 77.896 81.242 39.173 1.00 0.00 H ATOM 42472 H14S OL 1050 76.639 82.338 39.908 1.00 0.00 H ATOM 42473 C115 OL 1050 76.568 80.277 40.558 1.00 0.00 C ATOM 42474 H15R OL 1050 75.508 80.392 40.794 1.00 0.00 H ATOM 42475 H15S OL 1050 76.663 79.314 40.053 1.00 0.00 H ATOM 42476 C116 OL 1050 77.568 80.238 41.725 1.00 0.00 C ATOM 42477 H16R OL 1050 77.147 79.494 42.405 1.00 0.00 H ATOM 42478 H16S OL 1050 78.496 79.744 41.428 1.00 0.00 H ATOM 42479 C117 OL 1050 77.994 81.665 42.320 1.00 0.00 C ATOM 42480 H17R OL 1050 78.337 82.362 41.553 1.00 0.00 H ATOM 42481 H17S OL 1050 77.184 82.169 42.851 1.00 0.00 H ATOM 42482 C118 OL 1050 79.065 81.446 43.331 1.00 0.00 C ATOM 42483 H18R OL 1050 79.478 82.395 43.680 1.00 0.00 H ATOM 42484 H18S OL 1050 79.898 80.776 43.110 1.00 0.00 H ATOM 42485 H18T OL 1050 78.570 80.977 44.184 1.00 0.00 H TER 42486 OL 1050 ATOM 42486 C116 PA 1051 85.534 47.743 44.422 1.00 0.00 C ATOM 42487 H16R PA 1051 85.136 48.096 45.376 1.00 0.00 H ATOM 42488 H16S PA 1051 84.685 47.864 43.746 1.00 0.00 H ATOM 42489 H16T PA 1051 86.236 48.488 44.043 1.00 0.00 H ATOM 42490 C115 PA 1051 85.830 46.194 44.436 1.00 0.00 C ATOM 42491 H15R PA 1051 84.872 45.671 44.463 1.00 0.00 H ATOM 42492 H15S PA 1051 86.336 46.028 45.390 1.00 0.00 H ATOM 42493 C114 PA 1051 86.660 45.717 43.188 1.00 0.00 C ATOM 42494 H14R PA 1051 87.487 46.398 42.980 1.00 0.00 H ATOM 42495 H14S PA 1051 85.976 45.809 42.341 1.00 0.00 H ATOM 42496 C113 PA 1051 87.105 44.328 43.325 1.00 0.00 C ATOM 42497 H13R PA 1051 86.173 43.766 43.242 1.00 0.00 H ATOM 42498 H13S PA 1051 87.275 44.055 44.369 1.00 0.00 H ATOM 42499 C112 PA 1051 88.106 43.759 42.296 1.00 0.00 C ATOM 42500 H12R PA 1051 88.141 42.675 42.424 1.00 0.00 H ATOM 42501 H12S PA 1051 89.084 44.199 42.502 1.00 0.00 H ATOM 42502 C111 PA 1051 87.909 44.231 40.814 1.00 0.00 C ATOM 42503 H11R PA 1051 88.731 43.822 40.223 1.00 0.00 H ATOM 42504 H11S PA 1051 87.973 45.320 40.765 1.00 0.00 H ATOM 42505 C110 PA 1051 86.650 43.918 40.149 1.00 0.00 C ATOM 42506 H10R PA 1051 85.816 44.308 40.735 1.00 0.00 H ATOM 42507 H10S PA 1051 86.545 42.840 40.010 1.00 0.00 H ATOM 42508 C19 PA 1051 86.595 44.499 38.652 1.00 0.00 C ATOM 42509 H9R PA 1051 87.263 43.922 38.008 1.00 0.00 H ATOM 42510 H9S PA 1051 87.036 45.493 38.756 1.00 0.00 H ATOM 42511 C18 PA 1051 85.243 44.636 38.050 1.00 0.00 C ATOM 42512 H8R PA 1051 84.691 45.365 38.647 1.00 0.00 H ATOM 42513 H8S PA 1051 84.677 43.714 38.198 1.00 0.00 H ATOM 42514 C17 PA 1051 85.188 44.997 36.581 1.00 0.00 C ATOM 42515 H7R PA 1051 85.683 44.305 35.896 1.00 0.00 H ATOM 42516 H7S PA 1051 85.800 45.896 36.484 1.00 0.00 H ATOM 42517 C16 PA 1051 83.775 45.141 36.102 1.00 0.00 C ATOM 42518 H6R PA 1051 83.332 45.922 36.724 1.00 0.00 H ATOM 42519 H6S PA 1051 83.139 44.268 36.268 1.00 0.00 H ATOM 42520 C15 PA 1051 83.674 45.574 34.638 1.00 0.00 C ATOM 42521 H5R PA 1051 83.938 44.719 34.012 1.00 0.00 H ATOM 42522 H5S PA 1051 84.380 46.376 34.413 1.00 0.00 H ATOM 42523 C14 PA 1051 82.323 46.045 34.247 1.00 0.00 C ATOM 42524 H4R PA 1051 82.223 47.079 34.586 1.00 0.00 H ATOM 42525 H4S PA 1051 81.520 45.595 34.834 1.00 0.00 H ATOM 42526 C13 PA 1051 82.002 45.775 32.787 1.00 0.00 C ATOM 42527 H3R PA 1051 81.679 44.746 32.616 1.00 0.00 H ATOM 42528 H3S PA 1051 82.952 45.759 32.249 1.00 0.00 H ATOM 42529 C12 PA 1051 81.071 46.799 32.257 1.00 0.00 C ATOM 42530 H2R PA 1051 81.569 47.764 32.139 1.00 0.00 H ATOM 42531 H2S PA 1051 80.127 46.948 32.787 1.00 0.00 H ATOM 42532 C11 PC 1052 80.734 46.353 30.863 1.00 0.00 C ATOM 42533 O12 PC 1052 79.717 45.770 30.583 1.00 0.00 O ATOM 42534 O11 PC 1052 81.770 46.542 30.014 1.00 0.00 O ATOM 42535 C1 PC 1052 81.816 46.165 28.597 1.00 0.00 C ATOM 42536 HR PC 1052 81.458 45.146 28.428 1.00 0.00 H ATOM 42537 HS PC 1052 82.811 46.196 28.145 1.00 0.00 H ATOM 42538 C2 PC 1052 80.912 47.161 27.729 1.00 0.00 C ATOM 42539 HX PC 1052 79.960 47.284 28.251 1.00 0.00 H ATOM 42540 C3 PC 1052 80.625 46.554 26.362 1.00 0.00 C ATOM 42541 HA PC 1052 80.261 47.362 25.721 1.00 0.00 H ATOM 42542 HB PC 1052 79.878 45.759 26.440 1.00 0.00 H ATOM 42543 O31 PC 1052 81.858 46.017 25.876 1.00 0.00 O ATOM 42544 P31 PC 1052 81.904 45.369 24.464 1.00 0.00 P ATOM 42545 O32 PC 1052 82.251 46.572 23.501 1.00 0.00 O ATOM 42546 C31 PC 1052 81.293 47.626 23.219 1.00 0.00 C ATOM 42547 H1A PC 1052 81.186 48.236 24.119 1.00 0.00 H ATOM 42548 H1B PC 1052 80.354 47.206 22.849 1.00 0.00 H ATOM 42549 C32 PC 1052 81.688 48.605 22.065 1.00 0.00 C ATOM 42550 H2A PC 1052 80.827 49.104 21.617 1.00 0.00 H ATOM 42551 H2B PC 1052 81.966 47.942 21.245 1.00 0.00 H ATOM 42552 N31 PC 1052 82.886 49.486 22.357 1.00 0.00 N ATOM 42553 C33 PC 1052 83.192 50.205 21.089 1.00 0.00 C ATOM 42554 H3A PC 1052 83.367 49.483 20.289 1.00 0.00 H ATOM 42555 H3B PC 1052 83.941 50.995 21.171 1.00 0.00 H ATOM 42556 H3C PC 1052 82.312 50.756 20.754 1.00 0.00 H ATOM 42557 C34 PC 1052 82.470 50.502 23.385 1.00 0.00 C ATOM 42558 H4A PC 1052 81.922 50.005 24.187 1.00 0.00 H ATOM 42559 H4B PC 1052 81.718 51.080 22.846 1.00 0.00 H ATOM 42560 H4C PC 1052 83.248 51.221 23.648 1.00 0.00 H ATOM 42561 C35 PC 1052 84.036 48.613 22.653 1.00 0.00 C ATOM 42562 H5A PC 1052 84.889 49.192 23.011 1.00 0.00 H ATOM 42563 H5B PC 1052 84.212 47.830 21.914 1.00 0.00 H ATOM 42564 H5C PC 1052 83.754 48.078 23.561 1.00 0.00 H ATOM 42565 O33 PC 1052 83.055 44.403 24.406 1.00 0.00 O ATOM 42566 O34 PC 1052 80.547 44.886 24.165 1.00 0.00 O ATOM 42567 O21 PC 1052 81.636 48.421 27.521 1.00 0.00 O ATOM 42568 C21 PC 1052 81.734 49.352 28.472 1.00 0.00 C ATOM 42569 O22 PC 1052 81.175 49.231 29.546 1.00 0.00 O ATOM 42570 C12 OL 1053 82.453 50.638 28.016 1.00 0.00 C ATOM 42571 H2R OL 1053 82.356 50.773 26.937 1.00 0.00 H ATOM 42572 H2S OL 1053 81.925 51.476 28.475 1.00 0.00 H ATOM 42573 C13 OL 1053 83.826 50.642 28.566 1.00 0.00 C ATOM 42574 H3R OL 1053 83.801 50.439 29.639 1.00 0.00 H ATOM 42575 H3S OL 1053 84.289 49.751 28.137 1.00 0.00 H ATOM 42576 C14 OL 1053 84.557 51.851 28.244 1.00 0.00 C ATOM 42577 H4R OL 1053 84.691 51.800 27.161 1.00 0.00 H ATOM 42578 H4S OL 1053 83.997 52.746 28.525 1.00 0.00 H ATOM 42579 C15 OL 1053 85.877 51.973 29.050 1.00 0.00 C ATOM 42580 H5R OL 1053 85.696 51.925 30.126 1.00 0.00 H ATOM 42581 H5S OL 1053 86.442 51.107 28.701 1.00 0.00 H ATOM 42582 C16 OL 1053 86.580 53.245 28.781 1.00 0.00 C ATOM 42583 H6R OL 1053 86.558 53.647 27.765 1.00 0.00 H ATOM 42584 H6S OL 1053 86.060 54.045 29.311 1.00 0.00 H ATOM 42585 C17 OL 1053 88.090 53.248 28.953 1.00 0.00 C ATOM 42586 H7R OL 1053 88.543 52.580 28.217 1.00 0.00 H ATOM 42587 H7S OL 1053 88.393 54.279 28.756 1.00 0.00 H ATOM 42588 C18 OL 1053 88.712 52.977 30.244 1.00 0.00 C ATOM 42589 H8R OL 1053 88.438 51.968 30.560 1.00 0.00 H ATOM 42590 H8S OL 1053 89.795 53.060 30.359 1.00 0.00 H ATOM 42591 C19 OL 1053 88.146 53.906 31.308 1.00 0.00 C ATOM 42592 H9R OL 1053 88.433 54.955 31.323 1.00 0.00 H ATOM 42593 C110 OL 1053 87.455 53.608 32.442 1.00 0.00 C ATOM 42594 H10R OL 1053 87.162 54.405 33.120 1.00 0.00 H ATOM 42595 C111 OL 1053 87.137 52.205 32.861 1.00 0.00 C ATOM 42596 H11R OL 1053 86.065 52.091 32.685 1.00 0.00 H ATOM 42597 H11S OL 1053 87.521 51.390 32.243 1.00 0.00 H ATOM 42598 C112 OL 1053 87.455 52.249 34.382 1.00 0.00 C ATOM 42599 H12R OL 1053 88.488 52.512 34.616 1.00 0.00 H ATOM 42600 H12S OL 1053 86.768 53.019 34.740 1.00 0.00 H ATOM 42601 C113 OL 1053 87.264 50.895 35.115 1.00 0.00 C ATOM 42602 H13R OL 1053 87.469 50.856 36.187 1.00 0.00 H ATOM 42603 H13S OL 1053 86.227 50.552 35.116 1.00 0.00 H ATOM 42604 C114 OL 1053 88.109 49.722 34.517 1.00 0.00 C ATOM 42605 H14R OL 1053 88.035 49.807 33.431 1.00 0.00 H ATOM 42606 H14S OL 1053 89.170 49.939 34.656 1.00 0.00 H ATOM 42607 C115 OL 1053 87.741 48.352 35.108 1.00 0.00 C ATOM 42608 H15R OL 1053 87.583 48.609 36.157 1.00 0.00 H ATOM 42609 H15S OL 1053 86.757 48.090 34.713 1.00 0.00 H ATOM 42610 C116 OL 1053 88.897 47.261 35.129 1.00 0.00 C ATOM 42611 H16R OL 1053 89.201 47.006 34.111 1.00 0.00 H ATOM 42612 H16S OL 1053 89.745 47.720 35.641 1.00 0.00 H ATOM 42613 C117 OL 1053 88.681 45.920 35.829 1.00 0.00 C ATOM 42614 H17R OL 1053 88.228 46.109 36.804 1.00 0.00 H ATOM 42615 H17S OL 1053 87.959 45.301 35.292 1.00 0.00 H ATOM 42616 C118 OL 1053 90.002 45.056 36.062 1.00 0.00 C ATOM 42617 H18R OL 1053 89.747 44.185 36.670 1.00 0.00 H ATOM 42618 H18S OL 1053 90.566 45.668 36.769 1.00 0.00 H ATOM 42619 H18T OL 1053 90.542 44.699 35.183 1.00 0.00 H TER 42620 OL 1053 ATOM 42620 C116 PA 1054 58.606 87.705 42.207 1.00 0.00 C ATOM 42621 H16R PA 1054 59.026 87.217 41.325 1.00 0.00 H ATOM 42622 H16S PA 1054 59.322 87.501 43.006 1.00 0.00 H ATOM 42623 H16T PA 1054 58.660 88.762 41.941 1.00 0.00 H ATOM 42624 C115 PA 1054 57.225 87.289 42.561 1.00 0.00 C ATOM 42625 H15R PA 1054 56.980 87.652 43.562 1.00 0.00 H ATOM 42626 H15S PA 1054 57.202 86.206 42.695 1.00 0.00 H ATOM 42627 C114 PA 1054 56.080 87.672 41.623 1.00 0.00 C ATOM 42628 H14R PA 1054 55.912 88.750 41.658 1.00 0.00 H ATOM 42629 H14S PA 1054 55.207 87.136 42.001 1.00 0.00 H ATOM 42630 C113 PA 1054 56.344 87.266 40.120 1.00 0.00 C ATOM 42631 H13R PA 1054 57.166 87.873 39.736 1.00 0.00 H ATOM 42632 H13S PA 1054 55.478 87.684 39.602 1.00 0.00 H ATOM 42633 C112 PA 1054 56.642 85.776 40.055 1.00 0.00 C ATOM 42634 H12R PA 1054 56.057 85.225 40.794 1.00 0.00 H ATOM 42635 H12S PA 1054 57.697 85.536 40.208 1.00 0.00 H ATOM 42636 C111 PA 1054 56.463 85.194 38.681 1.00 0.00 C ATOM 42637 H11R PA 1054 57.126 85.561 37.895 1.00 0.00 H ATOM 42638 H11S PA 1054 55.478 85.611 38.463 1.00 0.00 H ATOM 42639 C110 PA 1054 56.480 83.591 38.599 1.00 0.00 C ATOM 42640 H10R PA 1054 55.909 83.182 39.435 1.00 0.00 H ATOM 42641 H10S PA 1054 57.490 83.196 38.725 1.00 0.00 H ATOM 42642 C19 PA 1054 55.807 83.067 37.300 1.00 0.00 C ATOM 42643 H9R PA 1054 56.534 83.352 36.537 1.00 0.00 H ATOM 42644 H9S PA 1054 54.955 83.705 37.056 1.00 0.00 H ATOM 42645 C18 PA 1054 55.609 81.501 37.154 1.00 0.00 C ATOM 42646 H8R PA 1054 55.715 81.060 38.147 1.00 0.00 H ATOM 42647 H8S PA 1054 56.552 81.084 36.794 1.00 0.00 H ATOM 42648 C17 PA 1054 54.405 80.961 36.419 1.00 0.00 C ATOM 42649 H7R PA 1054 53.590 81.395 37.003 1.00 0.00 H ATOM 42650 H7S PA 1054 54.325 79.873 36.438 1.00 0.00 H ATOM 42651 C16 PA 1054 54.223 81.607 35.122 1.00 0.00 C ATOM 42652 H6R PA 1054 54.145 82.696 35.091 1.00 0.00 H ATOM 42653 H6S PA 1054 53.215 81.344 34.797 1.00 0.00 H ATOM 42654 C15 PA 1054 55.104 81.137 34.034 1.00 0.00 C ATOM 42655 H5R PA 1054 55.080 80.046 34.065 1.00 0.00 H ATOM 42656 H5S PA 1054 56.125 81.217 34.414 1.00 0.00 H ATOM 42657 C14 PA 1054 54.764 81.772 32.667 1.00 0.00 C ATOM 42658 H4R PA 1054 55.161 82.783 32.556 1.00 0.00 H ATOM 42659 H4S PA 1054 53.687 81.949 32.634 1.00 0.00 H ATOM 42660 C13 PA 1054 55.195 81.077 31.444 1.00 0.00 C ATOM 42661 H3R PA 1054 54.985 81.652 30.540 1.00 0.00 H ATOM 42662 H3S PA 1054 54.722 80.094 31.398 1.00 0.00 H ATOM 42663 C12 PA 1054 56.728 80.843 31.432 1.00 0.00 C ATOM 42664 H2R PA 1054 56.890 80.155 32.265 1.00 0.00 H ATOM 42665 H2S PA 1054 57.177 81.796 31.720 1.00 0.00 H ATOM 42666 C11 PGR 1055 57.191 80.316 30.123 1.00 0.00 C ATOM 42667 O12 PGR 1055 56.551 79.665 29.315 1.00 0.00 O ATOM 42668 O11 PGR 1055 58.594 80.404 30.061 1.00 0.00 O ATOM 42669 C1 PGR 1055 59.230 79.653 28.930 1.00 0.00 C ATOM 42670 HR PGR 1055 58.940 80.060 27.958 1.00 0.00 H ATOM 42671 HS PGR 1055 58.707 78.704 29.069 1.00 0.00 H ATOM 42672 C2 PGR 1055 60.810 79.549 28.996 1.00 0.00 C ATOM 42673 HX PGR 1055 61.207 80.567 28.967 1.00 0.00 H ATOM 42674 C3 PGR 1055 61.446 78.774 27.828 1.00 0.00 C ATOM 42675 HA PGR 1055 62.482 78.493 28.032 1.00 0.00 H ATOM 42676 HB PGR 1055 61.307 79.372 26.923 1.00 0.00 H ATOM 42677 O31 PGR 1055 60.748 77.603 27.637 1.00 0.00 O ATOM 42678 P31 PGR 1055 60.889 76.728 26.316 1.00 0.00 P ATOM 42679 O32 PGR 1055 60.678 75.290 26.843 1.00 0.00 O ATOM 42680 C31 PGR 1055 59.440 74.707 27.181 1.00 0.00 C ATOM 42681 H1A PGR 1055 58.777 74.725 26.313 1.00 0.00 H ATOM 42682 H1B PGR 1055 59.047 75.353 27.970 1.00 0.00 H ATOM 42683 C32 PGR 1055 59.710 73.335 27.755 1.00 0.00 C ATOM 42684 H2A PGR 1055 60.612 73.428 28.366 1.00 0.00 H ATOM 42685 O35 PGR 1055 59.924 72.481 26.594 1.00 0.00 O ATOM 42686 HO5A PGR 1055 60.695 72.948 26.226 1.00 0.00 H ATOM 42687 C33 PGR 1055 58.558 72.838 28.643 1.00 0.00 C ATOM 42688 H3A PGR 1055 58.442 73.593 29.425 1.00 0.00 H ATOM 42689 H3B PGR 1055 57.662 72.732 28.027 1.00 0.00 H ATOM 42690 O33 PGR 1055 59.676 77.145 25.488 1.00 0.00 O ATOM 42691 O34 PGR 1055 62.254 76.909 25.754 1.00 0.00 O ATOM 42692 O21 PGR 1055 61.128 78.783 30.194 1.00 0.00 O ATOM 42693 C21 PGR 1055 62.299 78.961 30.808 1.00 0.00 C ATOM 42694 O22 PGR 1055 63.286 79.557 30.347 1.00 0.00 O ATOM 42695 O36 PGR 1055 58.995 71.665 29.290 1.00 0.00 O ATOM 42696 HO6A PGR 1055 58.167 71.294 29.642 1.00 0.00 H ATOM 42697 C12 OL 1056 62.357 78.291 32.173 1.00 0.00 C ATOM 42698 H2R OL 1056 61.991 77.262 32.161 1.00 0.00 H ATOM 42699 H2S OL 1056 63.350 78.347 32.624 1.00 0.00 H ATOM 42700 C13 OL 1056 61.443 79.040 33.065 1.00 0.00 C ATOM 42701 H3R OL 1056 61.894 79.973 33.409 1.00 0.00 H ATOM 42702 H3S OL 1056 60.502 79.300 32.575 1.00 0.00 H ATOM 42703 C14 OL 1056 61.180 78.221 34.383 1.00 0.00 C ATOM 42704 H4R OL 1056 60.752 77.236 34.186 1.00 0.00 H ATOM 42705 H4S OL 1056 62.074 77.899 34.921 1.00 0.00 H ATOM 42706 C15 OL 1056 60.231 78.996 35.324 1.00 0.00 C ATOM 42707 H5R OL 1056 60.895 79.693 35.839 1.00 0.00 H ATOM 42708 H5S OL 1056 59.491 79.617 34.815 1.00 0.00 H ATOM 42709 C16 OL 1056 59.460 78.253 36.332 1.00 0.00 C ATOM 42710 H6R OL 1056 58.606 77.871 35.770 1.00 0.00 H ATOM 42711 H6S OL 1056 60.071 77.416 36.677 1.00 0.00 H ATOM 42712 C17 OL 1056 59.099 79.146 37.534 1.00 0.00 C ATOM 42713 H7R OL 1056 59.851 79.139 38.326 1.00 0.00 H ATOM 42714 H7S OL 1056 59.051 80.194 37.230 1.00 0.00 H ATOM 42715 C18 OL 1056 57.822 78.731 38.232 1.00 0.00 C ATOM 42716 H8R OL 1056 57.539 79.380 39.063 1.00 0.00 H ATOM 42717 H8S OL 1056 57.034 78.833 37.484 1.00 0.00 H ATOM 42718 C19 OL 1056 57.747 77.374 38.763 1.00 0.00 C ATOM 42719 H9R OL 1056 58.298 77.279 39.694 1.00 0.00 H ATOM 42720 C110 OL 1056 56.860 76.356 38.421 1.00 0.00 C ATOM 42721 H10R OL 1056 56.980 75.382 38.888 1.00 0.00 H ATOM 42722 C111 OL 1056 55.835 76.292 37.360 1.00 0.00 C ATOM 42723 H11R OL 1056 55.835 77.205 36.761 1.00 0.00 H ATOM 42724 H11S OL 1056 56.282 75.563 36.680 1.00 0.00 H ATOM 42725 C112 OL 1056 54.556 75.594 37.778 1.00 0.00 C ATOM 42726 H12R OL 1056 53.988 75.481 36.852 1.00 0.00 H ATOM 42727 H12S OL 1056 54.768 74.634 38.253 1.00 0.00 H ATOM 42728 C113 OL 1056 53.721 76.472 38.628 1.00 0.00 C ATOM 42729 H13R OL 1056 54.419 76.952 39.318 1.00 0.00 H ATOM 42730 H13S OL 1056 53.278 77.283 38.046 1.00 0.00 H ATOM 42731 C114 OL 1056 52.565 75.697 39.331 1.00 0.00 C ATOM 42732 H14R OL 1056 51.656 75.725 38.727 1.00 0.00 H ATOM 42733 H14S OL 1056 52.768 74.627 39.257 1.00 0.00 H ATOM 42734 C115 OL 1056 52.160 76.190 40.781 1.00 0.00 C ATOM 42735 H15R OL 1056 51.553 75.421 41.265 1.00 0.00 H ATOM 42736 H15S OL 1056 53.147 76.257 41.243 1.00 0.00 H ATOM 42737 C116 OL 1056 51.390 77.491 40.909 1.00 0.00 C ATOM 42738 H16R OL 1056 51.860 78.278 40.315 1.00 0.00 H ATOM 42739 H16S OL 1056 50.381 77.405 40.500 1.00 0.00 H ATOM 42740 C117 OL 1056 51.380 77.943 42.400 1.00 0.00 C ATOM 42741 H17R OL 1056 50.923 77.138 42.979 1.00 0.00 H ATOM 42742 H17S OL 1056 52.387 77.785 42.793 1.00 0.00 H ATOM 42743 C118 OL 1056 50.744 79.289 42.579 1.00 0.00 C ATOM 42744 H18R OL 1056 50.540 79.594 43.607 1.00 0.00 H ATOM 42745 H18S OL 1056 49.758 79.343 42.112 1.00 0.00 H ATOM 42746 H18T OL 1056 51.375 80.033 42.087 1.00 0.00 H TER 42747 OL 1056 ATOM 42747 C116 PA 1057 138.433 40.267 39.349 1.00 0.00 C ATOM 42748 H16R PA 1057 138.862 39.264 39.394 1.00 0.00 H ATOM 42749 H16S PA 1057 137.495 40.288 39.909 1.00 0.00 H ATOM 42750 H16T PA 1057 139.198 40.873 39.838 1.00 0.00 H ATOM 42751 C115 PA 1057 138.205 40.695 37.928 1.00 0.00 C ATOM 42752 H15R PA 1057 139.138 40.780 37.367 1.00 0.00 H ATOM 42753 H15S PA 1057 137.707 41.666 37.969 1.00 0.00 H ATOM 42754 C114 PA 1057 137.317 39.655 37.185 1.00 0.00 C ATOM 42755 H14R PA 1057 136.294 39.726 37.561 1.00 0.00 H ATOM 42756 H14S PA 1057 137.685 38.637 37.327 1.00 0.00 H ATOM 42757 C113 PA 1057 137.173 39.978 35.667 1.00 0.00 C ATOM 42758 H13R PA 1057 138.146 39.911 35.178 1.00 0.00 H ATOM 42759 H13S PA 1057 136.872 41.027 35.613 1.00 0.00 H ATOM 42760 C112 PA 1057 136.105 39.209 34.844 1.00 0.00 C ATOM 42761 H12R PA 1057 135.530 39.847 34.170 1.00 0.00 H ATOM 42762 H12S PA 1057 135.388 38.749 35.527 1.00 0.00 H ATOM 42763 C111 PA 1057 136.664 38.008 34.039 1.00 0.00 C ATOM 42764 H11R PA 1057 137.329 37.314 34.557 1.00 0.00 H ATOM 42765 H11S PA 1057 137.341 38.429 33.293 1.00 0.00 H ATOM 42766 C110 PA 1057 135.607 37.100 33.348 1.00 0.00 C ATOM 42767 H10R PA 1057 135.043 36.561 34.111 1.00 0.00 H ATOM 42768 H10S PA 1057 136.140 36.326 32.792 1.00 0.00 H ATOM 42769 C19 PA 1057 134.488 37.812 32.624 1.00 0.00 C ATOM 42770 H9R PA 1057 134.883 38.499 31.872 1.00 0.00 H ATOM 42771 H9S PA 1057 133.854 38.474 33.218 1.00 0.00 H ATOM 42772 C18 PA 1057 133.618 36.815 31.808 1.00 0.00 C ATOM 42773 H8R PA 1057 133.339 36.034 32.518 1.00 0.00 H ATOM 42774 H8S PA 1057 134.180 36.310 31.020 1.00 0.00 H ATOM 42775 C17 PA 1057 132.397 37.500 31.137 1.00 0.00 C ATOM 42776 H7R PA 1057 132.797 38.341 30.567 1.00 0.00 H ATOM 42777 H7S PA 1057 131.916 37.947 32.009 1.00 0.00 H ATOM 42778 C16 PA 1057 131.488 36.628 30.289 1.00 0.00 C ATOM 42779 H6R PA 1057 130.506 36.668 30.766 1.00 0.00 H ATOM 42780 H6S PA 1057 131.732 35.569 30.392 1.00 0.00 H ATOM 42781 C15 PA 1057 131.366 37.086 28.860 1.00 0.00 C ATOM 42782 H5R PA 1057 132.347 37.018 28.386 1.00 0.00 H ATOM 42783 H5S PA 1057 131.089 38.137 28.758 1.00 0.00 H ATOM 42784 C14 PA 1057 130.339 36.461 27.922 1.00 0.00 C ATOM 42785 H4R PA 1057 129.356 36.554 28.388 1.00 0.00 H ATOM 42786 H4S PA 1057 130.460 35.375 27.915 1.00 0.00 H ATOM 42787 C13 PA 1057 130.294 37.104 26.571 1.00 0.00 C ATOM 42788 H3R PA 1057 131.318 37.201 26.203 1.00 0.00 H ATOM 42789 H3S PA 1057 129.882 38.104 26.721 1.00 0.00 H ATOM 42790 C12 PA 1057 129.398 36.207 25.750 1.00 0.00 C ATOM 42791 H2R PA 1057 128.483 36.064 26.329 1.00 0.00 H ATOM 42792 H2S PA 1057 129.856 35.235 25.557 1.00 0.00 H ATOM 42793 C11 PGR 1058 128.979 36.918 24.406 1.00 0.00 C ATOM 42794 O12 PGR 1058 129.345 36.598 23.347 1.00 0.00 O ATOM 42795 O11 PGR 1058 127.998 37.866 24.554 1.00 0.00 O ATOM 42796 C1 PGR 1058 127.379 38.451 23.386 1.00 0.00 C ATOM 42797 HR PGR 1058 128.127 38.828 22.684 1.00 0.00 H ATOM 42798 HS PGR 1058 126.935 39.396 23.711 1.00 0.00 H ATOM 42799 C2 PGR 1058 126.232 37.567 22.866 1.00 0.00 C ATOM 42800 HX PGR 1058 126.624 36.576 22.624 1.00 0.00 H ATOM 42801 C3 PGR 1058 125.510 38.239 21.635 1.00 0.00 C ATOM 42802 HA PGR 1058 124.740 37.543 21.293 1.00 0.00 H ATOM 42803 HB PGR 1058 126.224 38.315 20.811 1.00 0.00 H ATOM 42804 O31 PGR 1058 125.011 39.546 21.844 1.00 0.00 O ATOM 42805 P31 PGR 1058 124.274 40.395 20.741 1.00 0.00 P ATOM 42806 O32 PGR 1058 125.369 41.336 20.076 1.00 0.00 O ATOM 42807 C31 PGR 1058 126.093 40.896 18.930 1.00 0.00 C ATOM 42808 H1A PGR 1058 125.442 41.088 18.074 1.00 0.00 H ATOM 42809 H1B PGR 1058 126.364 39.842 19.035 1.00 0.00 H ATOM 42810 C32 PGR 1058 127.370 41.696 18.682 1.00 0.00 C ATOM 42811 H2A PGR 1058 128.108 41.527 19.471 1.00 0.00 H ATOM 42812 O35 PGR 1058 126.999 43.016 18.694 1.00 0.00 O ATOM 42813 HO5A PGR 1058 126.710 43.229 19.599 1.00 0.00 H ATOM 42814 C33 PGR 1058 128.187 41.177 17.497 1.00 0.00 C ATOM 42815 H3A PGR 1058 128.194 40.084 17.499 1.00 0.00 H ATOM 42816 H3B PGR 1058 127.496 41.507 16.717 1.00 0.00 H ATOM 42817 O33 PGR 1058 123.739 39.500 19.729 1.00 0.00 O ATOM 42818 O34 PGR 1058 123.323 41.231 21.455 1.00 0.00 O ATOM 42819 O21 PGR 1058 125.162 37.431 23.856 1.00 0.00 O ATOM 42820 C21 PGR 1058 125.286 36.438 24.793 1.00 0.00 C ATOM 42821 O22 PGR 1058 126.259 35.704 24.842 1.00 0.00 O ATOM 42822 O36 PGR 1058 129.502 41.809 17.479 1.00 0.00 O ATOM 42823 HO6A PGR 1058 129.806 41.863 18.402 1.00 0.00 H ATOM 42824 C12 OL 1059 124.157 36.200 25.806 1.00 0.00 C ATOM 42825 H2R OL 1059 123.893 37.206 26.141 1.00 0.00 H ATOM 42826 H2S OL 1059 123.392 35.738 25.179 1.00 0.00 H ATOM 42827 C13 OL 1059 124.608 35.221 26.855 1.00 0.00 C ATOM 42828 H3R OL 1059 123.731 34.718 27.266 1.00 0.00 H ATOM 42829 H3S OL 1059 125.167 34.354 26.495 1.00 0.00 H ATOM 42830 C14 OL 1059 125.608 35.862 27.889 1.00 0.00 C ATOM 42831 H4R OL 1059 126.589 35.383 27.902 1.00 0.00 H ATOM 42832 H4S OL 1059 125.817 36.918 27.707 1.00 0.00 H ATOM 42833 C15 OL 1059 125.275 35.722 29.364 1.00 0.00 C ATOM 42834 H5R OL 1059 124.271 36.123 29.520 1.00 0.00 H ATOM 42835 H5S OL 1059 125.237 34.637 29.484 1.00 0.00 H ATOM 42836 C16 OL 1059 126.224 36.393 30.386 1.00 0.00 C ATOM 42837 H6R OL 1059 127.264 36.162 30.145 1.00 0.00 H ATOM 42838 H6S OL 1059 125.958 37.433 30.183 1.00 0.00 H ATOM 42839 C17 OL 1059 125.897 36.150 31.849 1.00 0.00 C ATOM 42840 H7R OL 1059 124.833 36.313 32.035 1.00 0.00 H ATOM 42841 H7S OL 1059 126.141 35.152 32.221 1.00 0.00 H ATOM 42842 C18 OL 1059 126.574 37.082 32.863 1.00 0.00 C ATOM 42843 H8R OL 1059 126.253 38.106 32.662 1.00 0.00 H ATOM 42844 H8S OL 1059 126.148 36.607 33.749 1.00 0.00 H ATOM 42845 C19 OL 1059 128.133 37.155 32.899 1.00 0.00 C ATOM 42846 H9R OL 1059 128.730 36.272 32.685 1.00 0.00 H ATOM 42847 C110 OL 1059 128.756 38.302 33.173 1.00 0.00 C ATOM 42848 H10R OL 1059 129.833 38.320 33.026 1.00 0.00 H ATOM 42849 C111 OL 1059 128.230 39.673 33.522 1.00 0.00 C ATOM 42850 H11R OL 1059 127.147 39.805 33.474 1.00 0.00 H ATOM 42851 H11S OL 1059 128.371 39.745 34.603 1.00 0.00 H ATOM 42852 C112 OL 1059 128.947 40.867 32.796 1.00 0.00 C ATOM 42853 H12R OL 1059 130.007 40.900 33.059 1.00 0.00 H ATOM 42854 H12S OL 1059 128.928 40.623 31.732 1.00 0.00 H ATOM 42855 C113 OL 1059 128.240 42.230 33.037 1.00 0.00 C ATOM 42856 H13R OL 1059 127.194 42.198 32.726 1.00 0.00 H ATOM 42857 H13S OL 1059 128.228 42.531 34.086 1.00 0.00 H ATOM 42858 C114 OL 1059 128.817 43.390 32.219 1.00 0.00 C ATOM 42859 H14R OL 1059 128.526 44.396 32.532 1.00 0.00 H ATOM 42860 H14S OL 1059 129.908 43.386 32.261 1.00 0.00 H ATOM 42861 C115 OL 1059 128.545 43.299 30.750 1.00 0.00 C ATOM 42862 H15R OL 1059 128.871 42.352 30.316 1.00 0.00 H ATOM 42863 H15S OL 1059 127.473 43.202 30.570 1.00 0.00 H ATOM 42864 C116 OL 1059 129.216 44.420 29.869 1.00 0.00 C ATOM 42865 H16R OL 1059 128.728 44.388 28.893 1.00 0.00 H ATOM 42866 H16S OL 1059 128.885 45.370 30.292 1.00 0.00 H ATOM 42867 C117 OL 1059 130.699 44.382 29.802 1.00 0.00 C ATOM 42868 H17R OL 1059 131.164 44.524 30.780 1.00 0.00 H ATOM 42869 H17S OL 1059 131.183 43.504 29.368 1.00 0.00 H ATOM 42870 C118 OL 1059 131.267 45.423 28.938 1.00 0.00 C ATOM 42871 H18R OL 1059 130.600 46.287 28.908 1.00 0.00 H ATOM 42872 H18S OL 1059 131.438 45.103 27.908 1.00 0.00 H ATOM 42873 H18T OL 1059 132.198 45.837 29.330 1.00 0.00 H TER 42874 OL 1059 ATOM 42874 C116 PA 1060 113.088 73.502 42.166 1.00 0.00 C ATOM 42875 H16R PA 1060 112.252 73.650 42.853 1.00 0.00 H ATOM 42876 H16S PA 1060 113.331 72.451 41.998 1.00 0.00 H ATOM 42877 H16T PA 1060 112.849 73.878 41.169 1.00 0.00 H ATOM 42878 C115 PA 1060 114.357 74.191 42.659 1.00 0.00 C ATOM 42879 H15R PA 1060 114.666 73.862 43.653 1.00 0.00 H ATOM 42880 H15S PA 1060 114.181 75.262 42.777 1.00 0.00 H ATOM 42881 C114 PA 1060 115.505 73.980 41.704 1.00 0.00 C ATOM 42882 H14R PA 1060 115.207 74.100 40.661 1.00 0.00 H ATOM 42883 H14S PA 1060 115.825 72.936 41.687 1.00 0.00 H ATOM 42884 C113 PA 1060 116.716 74.826 42.009 1.00 0.00 C ATOM 42885 H13R PA 1060 117.021 74.694 43.049 1.00 0.00 H ATOM 42886 H13S PA 1060 116.313 75.838 41.934 1.00 0.00 H ATOM 42887 C112 PA 1060 117.825 74.645 40.914 1.00 0.00 C ATOM 42888 H12R PA 1060 118.632 75.374 41.015 1.00 0.00 H ATOM 42889 H12S PA 1060 117.374 74.911 39.955 1.00 0.00 H ATOM 42890 C111 PA 1060 118.465 73.225 40.831 1.00 0.00 C ATOM 42891 H11R PA 1060 117.673 72.520 40.566 1.00 0.00 H ATOM 42892 H11S PA 1060 118.835 72.966 41.826 1.00 0.00 H ATOM 42893 C110 PA 1060 119.594 73.140 39.889 1.00 0.00 C ATOM 42894 H10R PA 1060 120.386 73.746 40.334 1.00 0.00 H ATOM 42895 H10S PA 1060 119.405 73.521 38.883 1.00 0.00 H ATOM 42896 C19 PA 1060 120.142 71.720 39.834 1.00 0.00 C ATOM 42897 H9R PA 1060 119.407 71.016 39.440 1.00 0.00 H ATOM 42898 H9S PA 1060 120.392 71.353 40.832 1.00 0.00 H ATOM 42899 C18 PA 1060 121.492 71.689 39.006 1.00 0.00 C ATOM 42900 H8R PA 1060 121.975 70.774 39.355 1.00 0.00 H ATOM 42901 H8S PA 1060 122.113 72.567 39.196 1.00 0.00 H ATOM 42902 C17 PA 1060 121.284 71.645 37.483 1.00 0.00 C ATOM 42903 H7R PA 1060 120.542 72.333 37.072 1.00 0.00 H ATOM 42904 H7S PA 1060 121.032 70.599 37.300 1.00 0.00 H ATOM 42905 C16 PA 1060 122.529 71.737 36.620 1.00 0.00 C ATOM 42906 H6R PA 1060 123.313 70.989 36.758 1.00 0.00 H ATOM 42907 H6S PA 1060 123.054 72.679 36.791 1.00 0.00 H ATOM 42908 C15 PA 1060 122.361 71.846 35.078 1.00 0.00 C ATOM 42909 H5R PA 1060 121.740 72.732 34.929 1.00 0.00 H ATOM 42910 H5S PA 1060 121.837 70.958 34.721 1.00 0.00 H ATOM 42911 C14 PA 1060 123.628 72.017 34.340 1.00 0.00 C ATOM 42912 H4R PA 1060 124.370 71.292 34.681 1.00 0.00 H ATOM 42913 H4S PA 1060 123.976 73.023 34.581 1.00 0.00 H ATOM 42914 C13 PA 1060 123.594 71.657 32.811 1.00 0.00 C ATOM 42915 H3R PA 1060 123.039 72.384 32.214 1.00 0.00 H ATOM 42916 H3S PA 1060 123.090 70.698 32.672 1.00 0.00 H ATOM 42917 C12 PA 1060 124.991 71.642 32.270 1.00 0.00 C ATOM 42918 H2R PA 1060 125.675 71.009 32.839 1.00 0.00 H ATOM 42919 H2S PA 1060 125.381 72.656 32.161 1.00 0.00 H ATOM 42920 C11 PC 1061 124.879 70.921 30.899 1.00 0.00 C ATOM 42921 O12 PC 1061 123.838 70.618 30.356 1.00 0.00 O ATOM 42922 O11 PC 1061 126.087 70.795 30.289 1.00 0.00 O ATOM 42923 C1 PC 1061 125.876 70.367 28.872 1.00 0.00 C ATOM 42924 HR PC 1061 125.161 70.945 28.283 1.00 0.00 H ATOM 42925 HS PC 1061 125.418 69.377 28.943 1.00 0.00 H ATOM 42926 C2 PC 1061 127.193 70.328 28.118 1.00 0.00 C ATOM 42927 HX PC 1061 127.825 71.114 28.539 1.00 0.00 H ATOM 42928 C3 PC 1061 126.990 70.336 26.596 1.00 0.00 C ATOM 42929 HA PC 1061 128.044 70.448 26.331 1.00 0.00 H ATOM 42930 HB PC 1061 126.299 71.101 26.232 1.00 0.00 H ATOM 42931 O31 PC 1061 126.565 69.034 26.194 1.00 0.00 O ATOM 42932 P31 PC 1061 126.371 68.814 24.546 1.00 0.00 P ATOM 42933 O32 PC 1061 125.228 69.827 24.277 1.00 0.00 O ATOM 42934 C31 PC 1061 123.941 69.491 24.768 1.00 0.00 C ATOM 42935 H1A PC 1061 123.866 69.002 25.742 1.00 0.00 H ATOM 42936 H1B PC 1061 123.480 68.764 24.094 1.00 0.00 H ATOM 42937 C32 PC 1061 123.191 70.857 24.822 1.00 0.00 C ATOM 42938 H2A PC 1061 123.902 71.566 25.248 1.00 0.00 H ATOM 42939 H2B PC 1061 122.246 70.743 25.356 1.00 0.00 H ATOM 42940 N31 PC 1061 122.909 71.536 23.474 1.00 0.00 N ATOM 42941 C33 PC 1061 122.167 72.743 23.751 1.00 0.00 C ATOM 42942 H3A PC 1061 122.792 73.489 24.244 1.00 0.00 H ATOM 42943 H3B PC 1061 121.329 72.508 24.409 1.00 0.00 H ATOM 42944 H3C PC 1061 121.792 73.210 22.839 1.00 0.00 H ATOM 42945 C34 PC 1061 124.203 71.851 22.814 1.00 0.00 C ATOM 42946 H4A PC 1061 123.873 72.456 21.969 1.00 0.00 H ATOM 42947 H4B PC 1061 124.659 70.908 22.511 1.00 0.00 H ATOM 42948 H4C PC 1061 124.805 72.499 23.453 1.00 0.00 H ATOM 42949 C35 PC 1061 122.222 70.580 22.520 1.00 0.00 C ATOM 42950 H5A PC 1061 121.822 71.179 21.701 1.00 0.00 H ATOM 42951 H5B PC 1061 121.412 70.160 23.118 1.00 0.00 H ATOM 42952 H5C PC 1061 122.961 69.856 22.172 1.00 0.00 H ATOM 42953 O33 PC 1061 127.565 69.309 23.852 1.00 0.00 O ATOM 42954 O34 PC 1061 125.852 67.494 24.187 1.00 0.00 O ATOM 42955 O21 PC 1061 127.841 69.014 28.445 1.00 0.00 O ATOM 42956 C21 PC 1061 129.163 68.954 28.330 1.00 0.00 C ATOM 42957 O22 PC 1061 129.918 69.877 28.193 1.00 0.00 O ATOM 42958 C12 OL 1062 129.654 67.562 28.530 1.00 0.00 C ATOM 42959 H2R OL 1062 128.943 66.839 28.125 1.00 0.00 H ATOM 42960 H2S OL 1062 130.589 67.486 27.970 1.00 0.00 H ATOM 42961 C13 OL 1062 129.908 67.405 30.074 1.00 0.00 C ATOM 42962 H3R OL 1062 130.334 66.404 30.165 1.00 0.00 H ATOM 42963 H3S OL 1062 130.657 68.042 30.549 1.00 0.00 H ATOM 42964 C14 OL 1062 128.660 67.242 30.917 1.00 0.00 C ATOM 42965 H4R OL 1062 128.013 68.114 30.806 1.00 0.00 H ATOM 42966 H4S OL 1062 127.987 66.444 30.596 1.00 0.00 H ATOM 42967 C15 OL 1062 129.100 66.943 32.330 1.00 0.00 C ATOM 42968 H5R OL 1062 128.416 66.292 32.879 1.00 0.00 H ATOM 42969 H5S OL 1062 130.051 66.415 32.419 1.00 0.00 H ATOM 42970 C16 OL 1062 129.158 68.180 33.250 1.00 0.00 C ATOM 42971 H6R OL 1062 129.848 68.854 32.739 1.00 0.00 H ATOM 42972 H6S OL 1062 128.212 68.707 33.391 1.00 0.00 H ATOM 42973 C17 OL 1062 129.784 68.010 34.598 1.00 0.00 C ATOM 42974 H7R OL 1062 129.412 67.111 35.095 1.00 0.00 H ATOM 42975 H7S OL 1062 130.855 67.895 34.417 1.00 0.00 H ATOM 42976 C18 OL 1062 129.585 69.227 35.530 1.00 0.00 C ATOM 42977 H8R OL 1062 128.558 69.595 35.481 1.00 0.00 H ATOM 42978 H8S OL 1062 129.803 68.866 36.537 1.00 0.00 H ATOM 42979 C19 OL 1062 130.530 70.283 35.036 1.00 0.00 C ATOM 42980 H9R OL 1062 130.279 70.660 34.048 1.00 0.00 H ATOM 42981 C110 OL 1062 131.657 70.820 35.575 1.00 0.00 C ATOM 42982 H10R OL 1062 132.223 71.552 35.004 1.00 0.00 H ATOM 42983 C111 OL 1062 132.325 70.532 36.861 1.00 0.00 C ATOM 42984 H11R OL 1062 131.734 69.795 37.408 1.00 0.00 H ATOM 42985 H11S OL 1062 133.170 69.850 36.753 1.00 0.00 H ATOM 42986 C112 OL 1062 132.445 71.750 37.839 1.00 0.00 C ATOM 42987 H12R OL 1062 133.391 72.253 37.629 1.00 0.00 H ATOM 42988 H12S OL 1062 131.572 72.396 37.721 1.00 0.00 H ATOM 42989 C113 OL 1062 132.514 71.319 39.302 1.00 0.00 C ATOM 42990 H13R OL 1062 131.656 70.695 39.560 1.00 0.00 H ATOM 42991 H13S OL 1062 133.392 70.670 39.295 1.00 0.00 H ATOM 42992 C114 OL 1062 132.589 72.509 40.237 1.00 0.00 C ATOM 42993 H14R OL 1062 133.504 73.103 40.194 1.00 0.00 H ATOM 42994 H14S OL 1062 131.764 73.199 40.043 1.00 0.00 H ATOM 42995 C115 OL 1062 132.518 72.043 41.631 1.00 0.00 C ATOM 42996 H15R OL 1062 131.592 71.500 41.830 1.00 0.00 H ATOM 42997 H15S OL 1062 133.305 71.361 41.959 1.00 0.00 H ATOM 42998 C116 OL 1062 132.419 73.216 42.724 1.00 0.00 C ATOM 42999 H16R OL 1062 133.108 73.979 42.356 1.00 0.00 H ATOM 43000 H16S OL 1062 131.399 73.577 42.579 1.00 0.00 H ATOM 43001 C117 OL 1062 132.667 72.791 44.174 1.00 0.00 C ATOM 43002 H17R OL 1062 131.959 71.972 44.319 1.00 0.00 H ATOM 43003 H17S OL 1062 133.702 72.515 44.388 1.00 0.00 H ATOM 43004 C118 OL 1062 132.371 73.865 45.235 1.00 0.00 C ATOM 43005 H18R OL 1062 133.174 74.600 45.148 1.00 0.00 H ATOM 43006 H18S OL 1062 132.357 73.572 46.287 1.00 0.00 H ATOM 43007 H18T OL 1062 131.450 74.406 45.010 1.00 0.00 H TER 43008 OL 1062 ATOM 43008 C116 PA 1063 111.360 8.324 38.914 1.00 0.00 C ATOM 43009 H16R PA 1063 111.272 7.694 38.026 1.00 0.00 H ATOM 43010 H16S PA 1063 110.843 7.757 39.691 1.00 0.00 H ATOM 43011 H16T PA 1063 112.439 8.431 39.047 1.00 0.00 H ATOM 43012 C115 PA 1063 110.713 9.712 38.671 1.00 0.00 C ATOM 43013 H15R PA 1063 110.639 10.347 39.557 1.00 0.00 H ATOM 43014 H15S PA 1063 109.711 9.571 38.261 1.00 0.00 H ATOM 43015 C114 PA 1063 111.445 10.584 37.767 1.00 0.00 C ATOM 43016 H14R PA 1063 111.785 10.028 36.891 1.00 0.00 H ATOM 43017 H14S PA 1063 112.387 10.954 38.177 1.00 0.00 H ATOM 43018 C113 PA 1063 110.684 11.741 37.171 1.00 0.00 C ATOM 43019 H13R PA 1063 110.421 12.436 37.971 1.00 0.00 H ATOM 43020 H13S PA 1063 109.670 11.388 36.969 1.00 0.00 H ATOM 43021 C112 PA 1063 111.392 12.447 35.996 1.00 0.00 C ATOM 43022 H12R PA 1063 112.034 11.764 35.437 1.00 0.00 H ATOM 43023 H12S PA 1063 112.008 13.082 36.637 1.00 0.00 H ATOM 43024 C111 PA 1063 110.411 13.315 35.194 1.00 0.00 C ATOM 43025 H11R PA 1063 109.734 13.868 35.850 1.00 0.00 H ATOM 43026 H11S PA 1063 109.813 12.672 34.546 1.00 0.00 H ATOM 43027 C110 PA 1063 111.055 14.306 34.233 1.00 0.00 C ATOM 43028 H10R PA 1063 111.676 15.058 34.725 1.00 0.00 H ATOM 43029 H10S PA 1063 110.232 14.927 33.873 1.00 0.00 H ATOM 43030 C19 PA 1063 112.029 13.781 33.201 1.00 0.00 C ATOM 43031 H9R PA 1063 111.512 13.042 32.585 1.00 0.00 H ATOM 43032 H9S PA 1063 112.770 13.145 33.689 1.00 0.00 H ATOM 43033 C18 PA 1063 112.788 14.747 32.360 1.00 0.00 C ATOM 43034 H8R PA 1063 113.247 15.450 33.058 1.00 0.00 H ATOM 43035 H8S PA 1063 111.998 15.344 31.898 1.00 0.00 H ATOM 43036 C17 PA 1063 113.955 14.258 31.564 1.00 0.00 C ATOM 43037 H7R PA 1063 113.578 13.471 30.907 1.00 0.00 H ATOM 43038 H7S PA 1063 114.690 13.675 32.124 1.00 0.00 H ATOM 43039 C16 PA 1063 114.711 15.236 30.703 1.00 0.00 C ATOM 43040 H6R PA 1063 115.459 14.722 30.097 1.00 0.00 H ATOM 43041 H6S PA 1063 115.259 15.915 31.359 1.00 0.00 H ATOM 43042 C15 PA 1063 113.752 15.914 29.696 1.00 0.00 C ATOM 43043 H5R PA 1063 113.134 16.659 30.203 1.00 0.00 H ATOM 43044 H5S PA 1063 113.018 15.311 29.157 1.00 0.00 H ATOM 43045 C14 PA 1063 114.511 16.767 28.662 1.00 0.00 C ATOM 43046 H4R PA 1063 115.004 16.097 27.954 1.00 0.00 H ATOM 43047 H4S PA 1063 115.339 17.242 29.192 1.00 0.00 H ATOM 43048 C13 PA 1063 113.735 17.805 27.880 1.00 0.00 C ATOM 43049 H3R PA 1063 113.272 18.560 28.520 1.00 0.00 H ATOM 43050 H3S PA 1063 112.890 17.323 27.385 1.00 0.00 H ATOM 43051 C12 PA 1063 114.652 18.407 26.849 1.00 0.00 C ATOM 43052 H2R PA 1063 115.197 17.611 26.337 1.00 0.00 H ATOM 43053 H2S PA 1063 115.397 19.135 27.176 1.00 0.00 H ATOM 43054 C11 PC 1064 113.895 19.085 25.769 1.00 0.00 C ATOM 43055 O12 PC 1064 112.869 18.685 25.231 1.00 0.00 O ATOM 43056 O11 PC 1064 114.507 20.236 25.412 1.00 0.00 O ATOM 43057 C1 PC 1064 114.022 21.166 24.462 1.00 0.00 C ATOM 43058 HR PC 1064 113.950 20.692 23.480 1.00 0.00 H ATOM 43059 HS PC 1064 114.765 21.926 24.208 1.00 0.00 H ATOM 43060 C2 PC 1064 112.674 21.878 24.690 1.00 0.00 C ATOM 43061 HX PC 1064 111.958 21.124 25.028 1.00 0.00 H ATOM 43062 C3 PC 1064 112.067 22.550 23.420 1.00 0.00 C ATOM 43063 HA PC 1064 111.150 23.089 23.671 1.00 0.00 H ATOM 43064 HB PC 1064 111.815 21.651 22.852 1.00 0.00 H ATOM 43065 O31 PC 1064 112.970 23.396 22.884 1.00 0.00 O ATOM 43066 P31 PC 1064 112.654 24.331 21.690 1.00 0.00 P ATOM 43067 O32 PC 1064 111.846 25.493 22.372 1.00 0.00 O ATOM 43068 C31 PC 1064 112.489 26.466 23.183 1.00 0.00 C ATOM 43069 H1A PC 1064 113.068 27.190 22.605 1.00 0.00 H ATOM 43070 H1B PC 1064 113.244 26.053 23.857 1.00 0.00 H ATOM 43071 C32 PC 1064 111.468 27.196 24.119 1.00 0.00 C ATOM 43072 H2A PC 1064 112.033 27.785 24.843 1.00 0.00 H ATOM 43073 H2B PC 1064 110.905 26.545 24.790 1.00 0.00 H ATOM 43074 N31 PC 1064 110.598 28.168 23.473 1.00 0.00 N ATOM 43075 C33 PC 1064 109.585 27.452 22.571 1.00 0.00 C ATOM 43076 H3A PC 1064 110.034 27.102 21.640 1.00 0.00 H ATOM 43077 H3B PC 1064 108.825 28.171 22.259 1.00 0.00 H ATOM 43078 H3C PC 1064 109.282 26.575 23.144 1.00 0.00 H ATOM 43079 C34 PC 1064 109.845 28.730 24.632 1.00 0.00 C ATOM 43080 H4A PC 1064 108.860 29.036 24.277 1.00 0.00 H ATOM 43081 H4B PC 1064 110.357 29.526 25.175 1.00 0.00 H ATOM 43082 H4C PC 1064 109.521 27.864 25.210 1.00 0.00 H ATOM 43083 C35 PC 1064 111.477 29.234 22.843 1.00 0.00 C ATOM 43084 H5A PC 1064 112.323 29.512 23.473 1.00 0.00 H ATOM 43085 H5B PC 1064 110.982 30.188 22.653 1.00 0.00 H ATOM 43086 H5C PC 1064 111.855 28.756 21.938 1.00 0.00 H ATOM 43087 O33 PC 1064 113.935 24.869 21.166 1.00 0.00 O ATOM 43088 O34 PC 1064 111.776 23.631 20.760 1.00 0.00 O ATOM 43089 O21 PC 1064 112.961 22.964 25.614 1.00 0.00 O ATOM 43090 C21 PC 1064 112.080 23.362 26.591 1.00 0.00 C ATOM 43091 O22 PC 1064 111.076 22.756 26.874 1.00 0.00 O ATOM 43092 C12 OL 1065 112.609 24.605 27.162 1.00 0.00 C ATOM 43093 H2R OL 1065 113.514 24.980 26.679 1.00 0.00 H ATOM 43094 H2S OL 1065 111.925 25.427 26.943 1.00 0.00 H ATOM 43095 C13 OL 1065 112.970 24.476 28.693 1.00 0.00 C ATOM 43096 H3R OL 1065 113.364 25.458 28.966 1.00 0.00 H ATOM 43097 H3S OL 1065 112.047 24.278 29.242 1.00 0.00 H ATOM 43098 C14 OL 1065 113.980 23.435 28.978 1.00 0.00 C ATOM 43099 H4R OL 1065 113.475 22.550 28.586 1.00 0.00 H ATOM 43100 H4S OL 1065 114.932 23.459 28.442 1.00 0.00 H ATOM 43101 C15 OL 1065 114.269 23.210 30.453 1.00 0.00 C ATOM 43102 H5R OL 1065 113.341 23.074 31.011 1.00 0.00 H ATOM 43103 H5S OL 1065 114.850 22.286 30.501 1.00 0.00 H ATOM 43104 C16 OL 1065 115.169 24.313 31.148 1.00 0.00 C ATOM 43105 H6R OL 1065 116.084 24.473 30.573 1.00 0.00 H ATOM 43106 H6S OL 1065 114.607 25.250 31.146 1.00 0.00 H ATOM 43107 C17 OL 1065 115.585 23.871 32.533 1.00 0.00 C ATOM 43108 H7R OL 1065 114.702 24.004 33.162 1.00 0.00 H ATOM 43109 H7S OL 1065 115.863 22.819 32.443 1.00 0.00 H ATOM 43110 C18 OL 1065 116.678 24.656 33.112 1.00 0.00 C ATOM 43111 H8R OL 1065 117.553 24.604 32.461 1.00 0.00 H ATOM 43112 H8S OL 1065 116.418 25.717 33.119 1.00 0.00 H ATOM 43113 C19 OL 1065 117.020 24.227 34.512 1.00 0.00 C ATOM 43114 H9R OL 1065 116.277 23.649 35.055 1.00 0.00 H ATOM 43115 C110 OL 1065 118.224 24.424 35.098 1.00 0.00 C ATOM 43116 H10R OL 1065 118.444 23.960 36.056 1.00 0.00 H ATOM 43117 C111 OL 1065 119.317 25.276 34.626 1.00 0.00 C ATOM 43118 H11R OL 1065 120.230 24.704 34.448 1.00 0.00 H ATOM 43119 H11S OL 1065 118.987 25.679 33.666 1.00 0.00 H ATOM 43120 C112 OL 1065 119.637 26.396 35.618 1.00 0.00 C ATOM 43121 H12R OL 1065 118.695 26.844 35.940 1.00 0.00 H ATOM 43122 H12S OL 1065 119.995 26.025 36.580 1.00 0.00 H ATOM 43123 C113 OL 1065 120.549 27.481 35.109 1.00 0.00 C ATOM 43124 H13R OL 1065 120.276 27.762 34.089 1.00 0.00 H ATOM 43125 H13S OL 1065 120.509 28.424 35.657 1.00 0.00 H ATOM 43126 C114 OL 1065 122.012 26.986 34.896 1.00 0.00 C ATOM 43127 H14R OL 1065 121.966 25.971 35.296 1.00 0.00 H ATOM 43128 H14S OL 1065 122.167 26.967 33.815 1.00 0.00 H ATOM 43129 C115 OL 1065 123.011 27.872 35.634 1.00 0.00 C ATOM 43130 H15R OL 1065 122.884 28.866 35.199 1.00 0.00 H ATOM 43131 H15S OL 1065 122.864 28.041 36.703 1.00 0.00 H ATOM 43132 C116 OL 1065 124.425 27.456 35.468 1.00 0.00 C ATOM 43133 H16R OL 1065 124.640 27.205 34.427 1.00 0.00 H ATOM 43134 H16S OL 1065 125.090 28.249 35.818 1.00 0.00 H ATOM 43135 C117 OL 1065 124.602 26.038 36.124 1.00 0.00 C ATOM 43136 H17R OL 1065 124.002 26.008 37.036 1.00 0.00 H ATOM 43137 H17S OL 1065 124.228 25.263 35.452 1.00 0.00 H ATOM 43138 C118 OL 1065 126.042 25.699 36.490 1.00 0.00 C ATOM 43139 H18R OL 1065 126.642 25.807 35.584 1.00 0.00 H ATOM 43140 H18S OL 1065 126.108 24.671 36.851 1.00 0.00 H ATOM 43141 H18T OL 1065 126.384 26.360 37.289 1.00 0.00 H TER 43142 OL 1065 ATOM 43142 C116 PA 1066 85.976 29.831 39.920 1.00 0.00 C ATOM 43143 H16R PA 1066 86.555 29.742 38.999 1.00 0.00 H ATOM 43144 H16S PA 1066 86.591 30.328 40.674 1.00 0.00 H ATOM 43145 H16T PA 1066 85.161 30.554 39.847 1.00 0.00 H ATOM 43146 C115 PA 1066 85.555 28.399 40.303 1.00 0.00 C ATOM 43147 H15R PA 1066 84.851 28.344 41.136 1.00 0.00 H ATOM 43148 H15S PA 1066 86.442 27.805 40.530 1.00 0.00 H ATOM 43149 C114 PA 1066 84.726 27.774 39.223 1.00 0.00 C ATOM 43150 H14R PA 1066 84.774 26.688 39.337 1.00 0.00 H ATOM 43151 H14S PA 1066 85.149 28.040 38.253 1.00 0.00 H ATOM 43152 C113 PA 1066 83.237 28.182 39.269 1.00 0.00 C ATOM 43153 H13R PA 1066 83.095 29.229 38.993 1.00 0.00 H ATOM 43154 H13S PA 1066 82.960 28.226 40.324 1.00 0.00 H ATOM 43155 C112 PA 1066 82.306 27.273 38.379 1.00 0.00 C ATOM 43156 H12R PA 1066 81.249 27.434 38.602 1.00 0.00 H ATOM 43157 H12S PA 1066 82.549 26.282 38.767 1.00 0.00 H ATOM 43158 C111 PA 1066 82.373 27.334 36.798 1.00 0.00 C ATOM 43159 H11R PA 1066 82.076 26.365 36.391 1.00 0.00 H ATOM 43160 H11S PA 1066 83.430 27.321 36.525 1.00 0.00 H ATOM 43161 C110 PA 1066 81.710 28.627 36.251 1.00 0.00 C ATOM 43162 H10R PA 1066 82.300 29.497 36.547 1.00 0.00 H ATOM 43163 H10S PA 1066 80.737 28.784 36.720 1.00 0.00 H ATOM 43164 C19 PA 1066 81.489 28.581 34.777 1.00 0.00 C ATOM 43165 H9R PA 1066 80.611 29.207 34.602 1.00 0.00 H ATOM 43166 H9S PA 1066 81.279 27.544 34.506 1.00 0.00 H ATOM 43167 C18 PA 1066 82.614 29.014 33.831 1.00 0.00 C ATOM 43168 H8R PA 1066 83.337 28.230 33.597 1.00 0.00 H ATOM 43169 H8S PA 1066 83.207 29.836 34.237 1.00 0.00 H ATOM 43170 C17 PA 1066 82.190 29.499 32.418 1.00 0.00 C ATOM 43171 H7R PA 1066 81.246 30.040 32.501 1.00 0.00 H ATOM 43172 H7S PA 1066 82.047 28.612 31.798 1.00 0.00 H ATOM 43173 C16 PA 1066 83.237 30.489 31.821 1.00 0.00 C ATOM 43174 H6R PA 1066 84.246 30.075 31.871 1.00 0.00 H ATOM 43175 H6S PA 1066 83.193 31.467 32.304 1.00 0.00 H ATOM 43176 C15 PA 1066 83.060 30.727 30.318 1.00 0.00 C ATOM 43177 H5R PA 1066 82.026 30.935 30.035 1.00 0.00 H ATOM 43178 H5S PA 1066 83.335 29.793 29.824 1.00 0.00 H ATOM 43179 C14 PA 1066 83.877 31.843 29.736 1.00 0.00 C ATOM 43180 H4R PA 1066 84.917 31.519 29.660 1.00 0.00 H ATOM 43181 H4S PA 1066 83.867 32.749 30.345 1.00 0.00 H ATOM 43182 C13 PA 1066 83.468 32.385 28.388 1.00 0.00 C ATOM 43183 H3R PA 1066 84.228 33.093 28.053 1.00 0.00 H ATOM 43184 H3S PA 1066 82.647 33.093 28.521 1.00 0.00 H ATOM 43185 C12 PA 1066 83.128 31.319 27.321 1.00 0.00 C ATOM 43186 H2R PA 1066 82.387 30.623 27.719 1.00 0.00 H ATOM 43187 H2S PA 1066 84.010 30.704 27.130 1.00 0.00 H ATOM 43188 C11 PC 1067 82.839 31.939 26.008 1.00 0.00 C ATOM 43189 O12 PC 1067 83.065 31.325 25.011 1.00 0.00 O ATOM 43190 O11 PC 1067 82.118 33.048 25.941 1.00 0.00 O ATOM 43191 C1 PC 1067 81.504 33.594 24.791 1.00 0.00 C ATOM 43192 HR PC 1067 82.229 33.946 24.051 1.00 0.00 H ATOM 43193 HS PC 1067 80.902 34.467 25.058 1.00 0.00 H ATOM 43194 C2 PC 1067 80.458 32.646 24.127 1.00 0.00 C ATOM 43195 HX PC 1067 80.948 31.669 24.111 1.00 0.00 H ATOM 43196 C3 PC 1067 80.160 33.064 22.671 1.00 0.00 C ATOM 43197 HA PC 1067 79.579 32.264 22.206 1.00 0.00 H ATOM 43198 HB PC 1067 81.095 33.243 22.134 1.00 0.00 H ATOM 43199 O31 PC 1067 79.458 34.307 22.652 1.00 0.00 O ATOM 43200 P31 PC 1067 78.966 34.829 21.236 1.00 0.00 P ATOM 43201 O32 PC 1067 78.052 33.602 20.834 1.00 0.00 O ATOM 43202 C31 PC 1067 76.868 33.427 21.597 1.00 0.00 C ATOM 43203 H1A PC 1067 76.239 34.320 21.546 1.00 0.00 H ATOM 43204 H1B PC 1067 77.158 33.229 22.632 1.00 0.00 H ATOM 43205 C32 PC 1067 76.148 32.203 20.958 1.00 0.00 C ATOM 43206 H2A PC 1067 75.162 32.045 21.396 1.00 0.00 H ATOM 43207 H2B PC 1067 76.676 31.266 21.143 1.00 0.00 H ATOM 43208 N31 PC 1067 75.715 32.247 19.554 1.00 0.00 N ATOM 43209 C33 PC 1067 76.731 32.377 18.472 1.00 0.00 C ATOM 43210 H3A PC 1067 76.380 32.999 17.647 1.00 0.00 H ATOM 43211 H3B PC 1067 76.922 31.442 17.944 1.00 0.00 H ATOM 43212 H3C PC 1067 77.596 32.817 18.971 1.00 0.00 H ATOM 43213 C34 PC 1067 74.926 30.991 19.349 1.00 0.00 C ATOM 43214 H4A PC 1067 74.752 30.834 18.283 1.00 0.00 H ATOM 43215 H4B PC 1067 73.957 31.024 19.847 1.00 0.00 H ATOM 43216 H4C PC 1067 75.415 30.063 19.651 1.00 0.00 H ATOM 43217 C35 PC 1067 74.749 33.391 19.422 1.00 0.00 C ATOM 43218 H5A PC 1067 73.926 33.216 20.117 1.00 0.00 H ATOM 43219 H5B PC 1067 74.288 33.475 18.437 1.00 0.00 H ATOM 43220 H5C PC 1067 75.251 34.344 19.595 1.00 0.00 H ATOM 43221 O33 PC 1067 78.035 35.955 21.429 1.00 0.00 O ATOM 43222 O34 PC 1067 80.144 34.931 20.323 1.00 0.00 O ATOM 43223 O21 PC 1067 79.217 32.499 24.921 1.00 0.00 O ATOM 43224 C21 PC 1067 78.357 31.505 24.666 1.00 0.00 C ATOM 43225 O22 PC 1067 78.558 30.502 23.922 1.00 0.00 O ATOM 43226 C12 OL 1068 77.079 31.706 25.395 1.00 0.00 C ATOM 43227 H2R OL 1068 77.141 32.671 25.901 1.00 0.00 H ATOM 43228 H2S OL 1068 76.275 31.824 24.666 1.00 0.00 H ATOM 43229 C13 OL 1068 76.761 30.367 26.187 1.00 0.00 C ATOM 43230 H3R OL 1068 76.854 29.476 25.563 1.00 0.00 H ATOM 43231 H3S OL 1068 77.525 30.284 26.963 1.00 0.00 H ATOM 43232 C14 OL 1068 75.463 30.395 26.968 1.00 0.00 C ATOM 43233 H4R OL 1068 75.422 31.340 27.514 1.00 0.00 H ATOM 43234 H4S OL 1068 74.677 30.479 26.214 1.00 0.00 H ATOM 43235 C15 OL 1068 75.167 29.193 27.808 1.00 0.00 C ATOM 43236 H5R OL 1068 75.385 28.261 27.282 1.00 0.00 H ATOM 43237 H5S OL 1068 75.828 29.214 28.676 1.00 0.00 H ATOM 43238 C16 OL 1068 73.737 29.342 28.372 1.00 0.00 C ATOM 43239 H6R OL 1068 73.639 30.260 28.956 1.00 0.00 H ATOM 43240 H6S OL 1068 72.859 29.609 27.781 1.00 0.00 H ATOM 43241 C17 OL 1068 73.320 28.026 29.158 1.00 0.00 C ATOM 43242 H7R OL 1068 73.020 27.176 28.541 1.00 0.00 H ATOM 43243 H7S OL 1068 74.218 27.650 29.652 1.00 0.00 H ATOM 43244 C18 OL 1068 72.232 28.357 30.185 1.00 0.00 C ATOM 43245 H8R OL 1068 72.155 27.456 30.798 1.00 0.00 H ATOM 43246 H8S OL 1068 72.748 29.042 30.860 1.00 0.00 H ATOM 43247 C19 OL 1068 70.977 28.978 29.643 1.00 0.00 C ATOM 43248 H9R OL 1068 70.545 28.421 28.815 1.00 0.00 H ATOM 43249 C110 OL 1068 70.429 30.129 29.952 1.00 0.00 C ATOM 43250 H10R OL 1068 69.557 30.485 29.410 1.00 0.00 H ATOM 43251 C111 OL 1068 70.778 30.944 31.147 1.00 0.00 C ATOM 43252 H11R OL 1068 69.825 31.153 31.637 1.00 0.00 H ATOM 43253 H11S OL 1068 71.487 30.435 31.803 1.00 0.00 H ATOM 43254 C112 OL 1068 71.371 32.255 30.809 1.00 0.00 C ATOM 43255 H12R OL 1068 72.413 32.010 30.590 1.00 0.00 H ATOM 43256 H12S OL 1068 71.140 32.632 29.810 1.00 0.00 H ATOM 43257 C113 OL 1068 71.269 33.362 31.859 1.00 0.00 C ATOM 43258 H13R OL 1068 71.618 34.234 31.302 1.00 0.00 H ATOM 43259 H13S OL 1068 70.260 33.621 32.186 1.00 0.00 H ATOM 43260 C114 OL 1068 72.289 33.253 32.989 1.00 0.00 C ATOM 43261 H14R OL 1068 71.954 32.495 33.700 1.00 0.00 H ATOM 43262 H14S OL 1068 73.256 32.854 32.675 1.00 0.00 H ATOM 43263 C115 OL 1068 72.260 34.544 33.722 1.00 0.00 C ATOM 43264 H15R OL 1068 72.672 35.276 33.023 1.00 0.00 H ATOM 43265 H15S OL 1068 71.184 34.720 33.792 1.00 0.00 H ATOM 43266 C116 OL 1068 72.876 34.765 35.058 1.00 0.00 C ATOM 43267 H16R OL 1068 73.946 34.550 35.082 1.00 0.00 H ATOM 43268 H16S OL 1068 72.631 35.811 35.252 1.00 0.00 H ATOM 43269 C117 OL 1068 72.186 33.953 36.175 1.00 0.00 C ATOM 43270 H17R OL 1068 71.105 34.108 36.154 1.00 0.00 H ATOM 43271 H17S OL 1068 72.309 32.884 35.987 1.00 0.00 H ATOM 43272 C118 OL 1068 72.773 34.263 37.555 1.00 0.00 C ATOM 43273 H18R OL 1068 72.419 33.590 38.338 1.00 0.00 H ATOM 43274 H18S OL 1068 72.542 35.297 37.820 1.00 0.00 H ATOM 43275 H18T OL 1068 73.862 34.184 37.552 1.00 0.00 H TER 43276 OL 1068 ATOM 43276 C116 PA 1069 39.165 24.378 38.845 1.00 0.00 C ATOM 43277 H16R PA 1069 39.986 25.069 39.049 1.00 0.00 H ATOM 43278 H16S PA 1069 38.211 24.896 38.959 1.00 0.00 H ATOM 43279 H16T PA 1069 39.238 24.221 37.767 1.00 0.00 H ATOM 43280 C115 PA 1069 39.345 23.091 39.614 1.00 0.00 C ATOM 43281 H15R PA 1069 39.024 23.098 40.658 1.00 0.00 H ATOM 43282 H15S PA 1069 40.391 22.787 39.687 1.00 0.00 H ATOM 43283 C114 PA 1069 38.799 21.920 38.796 1.00 0.00 C ATOM 43284 H14R PA 1069 39.119 22.013 37.756 1.00 0.00 H ATOM 43285 H14S PA 1069 37.723 22.092 38.718 1.00 0.00 H ATOM 43286 C113 PA 1069 39.042 20.517 39.326 1.00 0.00 C ATOM 43287 H13R PA 1069 38.674 20.408 40.349 1.00 0.00 H ATOM 43288 H13S PA 1069 40.101 20.366 39.542 1.00 0.00 H ATOM 43289 C112 PA 1069 38.525 19.355 38.483 1.00 0.00 C ATOM 43290 H12R PA 1069 38.818 19.561 37.451 1.00 0.00 H ATOM 43291 H12S PA 1069 37.435 19.415 38.510 1.00 0.00 H ATOM 43292 C111 PA 1069 38.842 17.938 38.871 1.00 0.00 C ATOM 43293 H11R PA 1069 38.385 17.896 39.862 1.00 0.00 H ATOM 43294 H11S PA 1069 39.903 17.691 38.939 1.00 0.00 H ATOM 43295 C110 PA 1069 38.197 16.994 37.927 1.00 0.00 C ATOM 43296 H10R PA 1069 37.131 17.178 37.777 1.00 0.00 H ATOM 43297 H10S PA 1069 38.353 15.952 38.218 1.00 0.00 H ATOM 43298 C19 PA 1069 38.724 17.074 36.516 1.00 0.00 C ATOM 43299 H9R PA 1069 38.461 18.015 36.028 1.00 0.00 H ATOM 43300 H9S PA 1069 38.228 16.380 35.834 1.00 0.00 H ATOM 43301 C18 PA 1069 40.206 16.841 36.386 1.00 0.00 C ATOM 43302 H8R PA 1069 40.497 15.862 36.773 1.00 0.00 H ATOM 43303 H8S PA 1069 40.737 17.651 36.891 1.00 0.00 H ATOM 43304 C17 PA 1069 40.759 16.858 34.960 1.00 0.00 C ATOM 43305 H7R PA 1069 40.447 15.923 34.490 1.00 0.00 H ATOM 43306 H7S PA 1069 41.849 16.779 34.972 1.00 0.00 H ATOM 43307 C16 PA 1069 40.383 18.034 34.082 1.00 0.00 C ATOM 43308 H6R PA 1069 40.382 18.913 34.731 1.00 0.00 H ATOM 43309 H6S PA 1069 39.317 17.960 33.858 1.00 0.00 H ATOM 43310 C15 PA 1069 41.181 18.216 32.816 1.00 0.00 C ATOM 43311 H5R PA 1069 41.417 17.177 32.579 1.00 0.00 H ATOM 43312 H5S PA 1069 42.174 18.631 33.006 1.00 0.00 H ATOM 43313 C14 PA 1069 40.457 19.017 31.663 1.00 0.00 C ATOM 43314 H4R PA 1069 40.414 20.028 32.073 1.00 0.00 H ATOM 43315 H4S PA 1069 39.432 18.642 31.633 1.00 0.00 H ATOM 43316 C13 PA 1069 41.165 19.096 30.355 1.00 0.00 C ATOM 43317 H3R PA 1069 41.265 18.066 30.007 1.00 0.00 H ATOM 43318 H3S PA 1069 42.194 19.405 30.553 1.00 0.00 H ATOM 43319 C12 PA 1069 40.324 19.857 29.341 1.00 0.00 C ATOM 43320 H2R PA 1069 39.867 20.722 29.826 1.00 0.00 H ATOM 43321 H2S PA 1069 39.417 19.323 29.051 1.00 0.00 H ATOM 43322 C11 PGR 1070 41.076 20.261 28.105 1.00 0.00 C ATOM 43323 O12 PGR 1070 42.106 19.783 27.637 1.00 0.00 O ATOM 43324 O11 PGR 1070 40.450 21.204 27.441 1.00 0.00 O ATOM 43325 C1 PGR 1070 41.119 21.940 26.385 1.00 0.00 C ATOM 43326 HR PGR 1070 41.239 21.316 25.496 1.00 0.00 H ATOM 43327 HS PGR 1070 42.079 22.296 26.767 1.00 0.00 H ATOM 43328 C2 PGR 1070 40.245 23.229 26.040 1.00 0.00 C ATOM 43329 HX PGR 1070 39.183 23.006 26.170 1.00 0.00 H ATOM 43330 C3 PGR 1070 40.572 23.823 24.630 1.00 0.00 C ATOM 43331 HA PGR 1070 40.468 23.057 23.857 1.00 0.00 H ATOM 43332 HB PGR 1070 41.572 24.233 24.468 1.00 0.00 H ATOM 43333 O31 PGR 1070 39.578 24.825 24.354 1.00 0.00 O ATOM 43334 P31 PGR 1070 38.951 25.136 22.915 1.00 0.00 P ATOM 43335 O32 PGR 1070 37.821 24.091 22.950 1.00 0.00 O ATOM 43336 C31 PGR 1070 36.604 24.205 23.810 1.00 0.00 C ATOM 43337 H1A PGR 1070 36.748 24.444 24.867 1.00 0.00 H ATOM 43338 H1B PGR 1070 36.162 23.207 23.756 1.00 0.00 H ATOM 43339 C32 PGR 1070 35.542 25.209 23.333 1.00 0.00 C ATOM 43340 H2A PGR 1070 35.320 25.007 22.282 1.00 0.00 H ATOM 43341 O35 PGR 1070 36.016 26.505 23.416 1.00 0.00 O ATOM 43342 HO5A PGR 1070 36.898 26.440 23.007 1.00 0.00 H ATOM 43343 C33 PGR 1070 34.194 25.153 24.114 1.00 0.00 C ATOM 43344 H3A PGR 1070 33.407 25.670 23.558 1.00 0.00 H ATOM 43345 H3B PGR 1070 33.945 24.104 24.294 1.00 0.00 H ATOM 43346 O33 PGR 1070 38.468 26.513 22.853 1.00 0.00 O ATOM 43347 O34 PGR 1070 39.926 24.700 21.882 1.00 0.00 O ATOM 43348 O21 PGR 1070 40.681 24.162 27.038 1.00 0.00 O ATOM 43349 C21 PGR 1070 39.727 25.016 27.436 1.00 0.00 C ATOM 43350 O22 PGR 1070 38.561 24.868 27.205 1.00 0.00 O ATOM 43351 O36 PGR 1070 34.383 25.769 25.394 1.00 0.00 O ATOM 43352 HO6A PGR 1070 33.574 25.649 25.923 1.00 0.00 H ATOM 43353 C12 OL 1071 40.266 26.231 28.180 1.00 0.00 C ATOM 43354 H2R OL 1071 41.275 26.360 27.783 1.00 0.00 H ATOM 43355 H2S OL 1071 39.726 27.158 27.976 1.00 0.00 H ATOM 43356 C13 OL 1071 40.416 25.948 29.663 1.00 0.00 C ATOM 43357 H3R OL 1071 39.400 25.590 29.844 1.00 0.00 H ATOM 43358 H3S OL 1071 41.115 25.153 29.932 1.00 0.00 H ATOM 43359 C14 OL 1071 40.703 27.106 30.577 1.00 0.00 C ATOM 43360 H4R OL 1071 41.749 27.408 30.495 1.00 0.00 H ATOM 43361 H4S OL 1071 39.925 27.813 30.281 1.00 0.00 H ATOM 43362 C15 OL 1071 40.554 26.713 32.067 1.00 0.00 C ATOM 43363 H5R OL 1071 39.714 26.041 32.253 1.00 0.00 H ATOM 43364 H5S OL 1071 41.372 26.035 32.319 1.00 0.00 H ATOM 43365 C16 OL 1071 40.701 27.885 32.986 1.00 0.00 C ATOM 43366 H6R OL 1071 41.515 28.514 32.621 1.00 0.00 H ATOM 43367 H6S OL 1071 39.896 28.601 32.806 1.00 0.00 H ATOM 43368 C17 OL 1071 40.609 27.415 34.462 1.00 0.00 C ATOM 43369 H7R OL 1071 39.633 26.948 34.607 1.00 0.00 H ATOM 43370 H7S OL 1071 41.329 26.616 34.650 1.00 0.00 H ATOM 43371 C18 OL 1071 40.686 28.489 35.532 1.00 0.00 C ATOM 43372 H8R OL 1071 41.119 28.057 36.437 1.00 0.00 H ATOM 43373 H8S OL 1071 41.473 29.163 35.188 1.00 0.00 H ATOM 43374 C19 OL 1071 39.400 29.218 35.692 1.00 0.00 C ATOM 43375 H9R OL 1071 38.744 29.017 34.849 1.00 0.00 H ATOM 43376 C110 OL 1071 38.982 29.802 36.793 1.00 0.00 C ATOM 43377 H10R OL 1071 38.030 30.319 36.706 1.00 0.00 H ATOM 43378 C111 OL 1071 39.711 30.057 38.026 1.00 0.00 C ATOM 43379 H11R OL 1071 38.996 29.827 38.818 1.00 0.00 H ATOM 43380 H11S OL 1071 40.595 29.416 38.065 1.00 0.00 H ATOM 43381 C112 OL 1071 40.083 31.505 38.186 1.00 0.00 C ATOM 43382 H12R OL 1071 40.728 31.836 37.369 1.00 0.00 H ATOM 43383 H12S OL 1071 39.173 32.108 38.203 1.00 0.00 H ATOM 43384 C113 OL 1071 40.832 31.863 39.448 1.00 0.00 C ATOM 43385 H13R OL 1071 40.087 31.532 40.174 1.00 0.00 H ATOM 43386 H13S OL 1071 41.732 31.246 39.496 1.00 0.00 H ATOM 43387 C114 OL 1071 41.274 33.306 39.525 1.00 0.00 C ATOM 43388 H14R OL 1071 42.106 33.318 38.818 1.00 0.00 H ATOM 43389 H14S OL 1071 40.483 33.977 39.182 1.00 0.00 H ATOM 43390 C115 OL 1071 41.779 33.653 40.918 1.00 0.00 C ATOM 43391 H15R OL 1071 40.947 33.548 41.617 1.00 0.00 H ATOM 43392 H15S OL 1071 42.656 33.049 41.162 1.00 0.00 H ATOM 43393 C116 OL 1071 42.259 35.073 41.037 1.00 0.00 C ATOM 43394 H16R OL 1071 42.989 35.287 40.254 1.00 0.00 H ATOM 43395 H16S OL 1071 41.466 35.809 40.889 1.00 0.00 H ATOM 43396 C117 OL 1071 42.935 35.363 42.397 1.00 0.00 C ATOM 43397 H17R OL 1071 42.333 35.172 43.288 1.00 0.00 H ATOM 43398 H17S OL 1071 43.713 34.599 42.461 1.00 0.00 H ATOM 43399 C118 OL 1071 43.627 36.750 42.522 1.00 0.00 C ATOM 43400 H18R OL 1071 44.499 36.956 41.899 1.00 0.00 H ATOM 43401 H18S OL 1071 44.096 36.819 43.506 1.00 0.00 H ATOM 43402 H18T OL 1071 42.941 37.588 42.387 1.00 0.00 H TER 43403 OL 1071 ATOM 43403 C116 PA 1072 42.094 113.955 42.556 1.00 0.00 C ATOM 43404 H16R PA 1072 42.385 113.138 41.892 1.00 0.00 H ATOM 43405 H16S PA 1072 42.886 114.692 42.702 1.00 0.00 H ATOM 43406 H16T PA 1072 41.214 114.393 42.081 1.00 0.00 H ATOM 43407 C115 PA 1072 41.733 113.514 43.976 1.00 0.00 C ATOM 43408 H15R PA 1072 41.346 114.286 44.644 1.00 0.00 H ATOM 43409 H15S PA 1072 42.627 113.132 44.472 1.00 0.00 H ATOM 43410 C114 PA 1072 40.730 112.390 43.961 1.00 0.00 C ATOM 43411 H14R PA 1072 40.396 111.939 44.898 1.00 0.00 H ATOM 43412 H14S PA 1072 41.285 111.572 43.497 1.00 0.00 H ATOM 43413 C113 PA 1072 39.487 112.663 43.178 1.00 0.00 C ATOM 43414 H13R PA 1072 39.694 112.969 42.150 1.00 0.00 H ATOM 43415 H13S PA 1072 38.939 113.493 43.630 1.00 0.00 H ATOM 43416 C112 PA 1072 38.559 111.486 43.150 1.00 0.00 C ATOM 43417 H12R PA 1072 38.161 111.298 44.150 1.00 0.00 H ATOM 43418 H12S PA 1072 39.114 110.607 42.818 1.00 0.00 H ATOM 43419 C111 PA 1072 37.413 111.835 42.221 1.00 0.00 C ATOM 43420 H11R PA 1072 37.248 112.904 42.071 1.00 0.00 H ATOM 43421 H11S PA 1072 36.489 111.515 42.708 1.00 0.00 H ATOM 43422 C110 PA 1072 37.387 111.234 40.805 1.00 0.00 C ATOM 43423 H10R PA 1072 38.073 111.815 40.185 1.00 0.00 H ATOM 43424 H10S PA 1072 36.356 111.495 40.556 1.00 0.00 H ATOM 43425 C19 PA 1072 37.555 109.640 40.732 1.00 0.00 C ATOM 43426 H9R PA 1072 36.742 109.226 41.331 1.00 0.00 H ATOM 43427 H9S PA 1072 38.560 109.456 41.117 1.00 0.00 H ATOM 43428 C18 PA 1072 37.608 109.106 39.261 1.00 0.00 C ATOM 43429 H8R PA 1072 38.363 109.612 38.656 1.00 0.00 H ATOM 43430 H8S PA 1072 36.645 109.467 38.894 1.00 0.00 H ATOM 43431 C17 PA 1072 37.761 107.608 39.258 1.00 0.00 C ATOM 43432 H7R PA 1072 36.841 107.087 39.530 1.00 0.00 H ATOM 43433 H7S PA 1072 38.569 107.374 39.954 1.00 0.00 H ATOM 43434 C16 PA 1072 38.260 107.084 37.938 1.00 0.00 C ATOM 43435 H6R PA 1072 38.459 106.013 38.008 1.00 0.00 H ATOM 43436 H6S PA 1072 39.264 107.500 37.829 1.00 0.00 H ATOM 43437 C15 PA 1072 37.470 107.287 36.622 1.00 0.00 C ATOM 43438 H5R PA 1072 37.577 108.328 36.311 1.00 0.00 H ATOM 43439 H5S PA 1072 36.391 107.163 36.738 1.00 0.00 H ATOM 43440 C14 PA 1072 37.906 106.385 35.482 1.00 0.00 C ATOM 43441 H4R PA 1072 38.014 105.360 35.842 1.00 0.00 H ATOM 43442 H4S PA 1072 38.932 106.651 35.221 1.00 0.00 H ATOM 43443 C13 PA 1072 37.084 106.409 34.230 1.00 0.00 C ATOM 43444 H3R PA 1072 36.721 107.420 34.033 1.00 0.00 H ATOM 43445 H3S PA 1072 36.168 105.842 34.409 1.00 0.00 H ATOM 43446 C12 PA 1072 37.773 105.715 33.087 1.00 0.00 C ATOM 43447 H2R PA 1072 37.859 104.666 33.380 1.00 0.00 H ATOM 43448 H2S PA 1072 38.751 106.153 32.879 1.00 0.00 H ATOM 43449 C11 PGR 1073 37.007 105.949 31.780 1.00 0.00 C ATOM 43450 O12 PGR 1073 37.479 106.568 30.821 1.00 0.00 O ATOM 43451 O11 PGR 1073 35.769 105.466 31.847 1.00 0.00 O ATOM 43452 C1 PGR 1073 34.863 105.390 30.703 1.00 0.00 C ATOM 43453 HR PGR 1073 34.767 106.388 30.267 1.00 0.00 H ATOM 43454 HS PGR 1073 33.960 104.882 31.051 1.00 0.00 H ATOM 43455 C2 PGR 1073 35.464 104.383 29.578 1.00 0.00 C ATOM 43456 HX PGR 1073 36.501 104.554 29.278 1.00 0.00 H ATOM 43457 C3 PGR 1073 34.475 104.446 28.360 1.00 0.00 C ATOM 43458 HA PGR 1073 34.359 105.473 28.003 1.00 0.00 H ATOM 43459 HB PGR 1073 33.514 104.005 28.638 1.00 0.00 H ATOM 43460 O31 PGR 1073 34.995 103.637 27.240 1.00 0.00 O ATOM 43461 P31 PGR 1073 34.494 103.795 25.730 1.00 0.00 P ATOM 43462 O32 PGR 1073 34.895 105.301 25.389 1.00 0.00 O ATOM 43463 C31 PGR 1073 36.222 105.670 25.044 1.00 0.00 C ATOM 43464 H1A PGR 1073 36.464 105.219 24.078 1.00 0.00 H ATOM 43465 H1B PGR 1073 36.871 105.196 25.784 1.00 0.00 H ATOM 43466 C32 PGR 1073 36.418 107.210 24.968 1.00 0.00 C ATOM 43467 H2A PGR 1073 37.461 107.408 24.709 1.00 0.00 H ATOM 43468 O35 PGR 1073 35.661 107.679 23.920 1.00 0.00 O ATOM 43469 HO5A PGR 1073 35.708 108.650 23.976 1.00 0.00 H ATOM 43470 C33 PGR 1073 36.026 107.834 26.321 1.00 0.00 C ATOM 43471 H3A PGR 1073 36.625 107.478 27.163 1.00 0.00 H ATOM 43472 H3B PGR 1073 36.356 108.869 26.205 1.00 0.00 H ATOM 43473 O33 PGR 1073 35.295 102.872 24.930 1.00 0.00 O ATOM 43474 O34 PGR 1073 33.041 103.628 25.891 1.00 0.00 O ATOM 43475 O21 PGR 1073 35.282 102.948 30.119 1.00 0.00 O ATOM 43476 C21 PGR 1073 36.150 102.445 30.943 1.00 0.00 C ATOM 43477 O22 PGR 1073 37.250 103.003 31.101 1.00 0.00 O ATOM 43478 O36 PGR 1073 34.653 107.639 26.738 1.00 0.00 O ATOM 43479 HO6A PGR 1073 34.491 107.968 27.640 1.00 0.00 H ATOM 43480 C12 OL 1074 35.630 101.220 31.619 1.00 0.00 C ATOM 43481 H2R OL 1074 34.553 101.344 31.751 1.00 0.00 H ATOM 43482 H2S OL 1074 35.886 100.337 31.028 1.00 0.00 H ATOM 43483 C13 OL 1074 36.116 101.133 33.043 1.00 0.00 C ATOM 43484 H3R OL 1074 35.850 100.186 33.518 1.00 0.00 H ATOM 43485 H3S OL 1074 37.195 101.294 33.080 1.00 0.00 H ATOM 43486 C14 OL 1074 35.449 102.170 33.938 1.00 0.00 C ATOM 43487 H4R OL 1074 35.715 103.171 33.590 1.00 0.00 H ATOM 43488 H4S OL 1074 34.359 102.243 33.947 1.00 0.00 H ATOM 43489 C15 OL 1074 35.770 102.146 35.479 1.00 0.00 C ATOM 43490 H5R OL 1074 35.144 102.832 36.053 1.00 0.00 H ATOM 43491 H5S OL 1074 35.461 101.192 35.913 1.00 0.00 H ATOM 43492 C16 OL 1074 37.209 102.384 35.746 1.00 0.00 C ATOM 43493 H6R OL 1074 37.714 101.418 35.806 1.00 0.00 H ATOM 43494 H6S OL 1074 37.792 102.953 35.019 1.00 0.00 H ATOM 43495 C17 OL 1074 37.386 102.962 37.129 1.00 0.00 C ATOM 43496 H7R OL 1074 37.088 104.011 37.190 1.00 0.00 H ATOM 43497 H7S OL 1074 36.745 102.426 37.832 1.00 0.00 H ATOM 43498 C18 OL 1074 38.864 102.927 37.679 1.00 0.00 C ATOM 43499 H8R OL 1074 39.192 101.930 37.376 1.00 0.00 H ATOM 43500 H8S OL 1074 39.496 103.611 37.110 1.00 0.00 H ATOM 43501 C19 OL 1074 38.945 103.362 39.097 1.00 0.00 C ATOM 43502 H9R OL 1074 39.084 104.437 39.181 1.00 0.00 H ATOM 43503 C110 OL 1074 38.882 102.569 40.131 1.00 0.00 C ATOM 43504 H10R OL 1074 38.815 102.967 41.141 1.00 0.00 H ATOM 43505 C111 OL 1074 38.742 101.060 40.006 1.00 0.00 C ATOM 43506 H11R OL 1074 37.832 100.676 40.472 1.00 0.00 H ATOM 43507 H11S OL 1074 38.760 100.570 39.030 1.00 0.00 H ATOM 43508 C112 OL 1074 39.742 100.501 40.967 1.00 0.00 C ATOM 43509 H12R OL 1074 39.636 100.965 41.950 1.00 0.00 H ATOM 43510 H12S OL 1074 39.523 99.437 41.086 1.00 0.00 H ATOM 43511 C113 OL 1074 41.255 100.725 40.529 1.00 0.00 C ATOM 43512 H13R OL 1074 41.602 101.758 40.610 1.00 0.00 H ATOM 43513 H13S OL 1074 41.903 100.167 41.209 1.00 0.00 H ATOM 43514 C114 OL 1074 41.653 100.237 39.057 1.00 0.00 C ATOM 43515 H14R OL 1074 41.288 99.218 38.907 1.00 0.00 H ATOM 43516 H14S OL 1074 40.980 100.760 38.374 1.00 0.00 H ATOM 43517 C115 OL 1074 43.075 100.425 38.626 1.00 0.00 C ATOM 43518 H15R OL 1074 43.562 99.614 39.171 1.00 0.00 H ATOM 43519 H15S OL 1074 43.219 100.064 37.605 1.00 0.00 H ATOM 43520 C116 OL 1074 43.888 101.587 39.013 1.00 0.00 C ATOM 43521 H16R OL 1074 43.493 102.561 38.718 1.00 0.00 H ATOM 43522 H16S OL 1074 43.962 101.677 40.099 1.00 0.00 H ATOM 43523 C117 OL 1074 45.305 101.476 38.456 1.00 0.00 C ATOM 43524 H17R OL 1074 45.735 100.484 38.609 1.00 0.00 H ATOM 43525 H17S OL 1074 45.283 101.685 37.384 1.00 0.00 H ATOM 43526 C118 OL 1074 46.204 102.588 38.831 1.00 0.00 C ATOM 43527 H18R OL 1074 45.619 103.508 38.767 1.00 0.00 H ATOM 43528 H18S OL 1074 47.069 102.632 38.166 1.00 0.00 H ATOM 43529 H18T OL 1074 46.593 102.570 39.851 1.00 0.00 H TER 43530 OL 1074 ATOM 43530 C116 PA 1075 97.479 53.551 26.256 1.00 0.00 C ATOM 43531 H16R PA 1075 98.212 54.213 26.722 1.00 0.00 H ATOM 43532 H16S PA 1075 97.887 52.748 25.638 1.00 0.00 H ATOM 43533 H16T PA 1075 96.897 53.149 27.088 1.00 0.00 H ATOM 43534 C115 PA 1075 96.585 54.442 25.342 1.00 0.00 C ATOM 43535 H15R PA 1075 95.843 53.844 24.809 1.00 0.00 H ATOM 43536 H15S PA 1075 97.171 54.872 24.528 1.00 0.00 H ATOM 43537 C114 PA 1075 95.739 55.595 25.953 1.00 0.00 C ATOM 43538 H14R PA 1075 95.334 55.371 26.942 1.00 0.00 H ATOM 43539 H14S PA 1075 94.927 55.758 25.242 1.00 0.00 H ATOM 43540 C113 PA 1075 96.594 56.896 26.302 1.00 0.00 C ATOM 43541 H13R PA 1075 96.944 57.309 25.354 1.00 0.00 H ATOM 43542 H13S PA 1075 97.459 56.637 26.915 1.00 0.00 H ATOM 43543 C112 PA 1075 95.608 57.980 26.738 1.00 0.00 C ATOM 43544 H12R PA 1075 95.123 57.719 27.681 1.00 0.00 H ATOM 43545 H12S PA 1075 94.782 58.095 26.032 1.00 0.00 H ATOM 43546 C111 PA 1075 96.353 59.263 26.913 1.00 0.00 C ATOM 43547 H11R PA 1075 96.418 59.801 25.965 1.00 0.00 H ATOM 43548 H11S PA 1075 97.360 58.997 27.242 1.00 0.00 H ATOM 43549 C110 PA 1075 95.664 60.210 27.939 1.00 0.00 C ATOM 43550 H10R PA 1075 95.639 59.648 28.875 1.00 0.00 H ATOM 43551 H10S PA 1075 94.669 60.449 27.559 1.00 0.00 H ATOM 43552 C19 PA 1075 96.556 61.443 28.131 1.00 0.00 C ATOM 43553 H9R PA 1075 96.731 61.829 27.125 1.00 0.00 H ATOM 43554 H9S PA 1075 97.551 61.172 28.489 1.00 0.00 H ATOM 43555 C18 PA 1075 95.994 62.649 28.967 1.00 0.00 C ATOM 43556 H8R PA 1075 96.712 63.472 28.961 1.00 0.00 H ATOM 43557 H8S PA 1075 95.983 62.406 30.032 1.00 0.00 H ATOM 43558 C17 PA 1075 94.722 63.182 28.410 1.00 0.00 C ATOM 43559 H7R PA 1075 94.026 62.352 28.269 1.00 0.00 H ATOM 43560 H7S PA 1075 95.007 63.720 27.504 1.00 0.00 H ATOM 43561 C16 PA 1075 94.142 64.164 29.460 1.00 0.00 C ATOM 43562 H6R PA 1075 94.937 64.741 29.937 1.00 0.00 H ATOM 43563 H6S PA 1075 93.850 63.506 30.282 1.00 0.00 H ATOM 43564 C15 PA 1075 93.036 65.117 29.018 1.00 0.00 C ATOM 43565 H5R PA 1075 92.207 64.484 28.697 1.00 0.00 H ATOM 43566 H5S PA 1075 93.337 65.708 28.150 1.00 0.00 H ATOM 43567 C14 PA 1075 92.657 66.064 30.175 1.00 0.00 C ATOM 43568 H4R PA 1075 93.573 66.600 30.432 1.00 0.00 H ATOM 43569 H4S PA 1075 92.484 65.483 31.083 1.00 0.00 H ATOM 43570 C13 PA 1075 91.487 67.055 30.012 1.00 0.00 C ATOM 43571 H3R PA 1075 91.528 67.711 30.884 1.00 0.00 H ATOM 43572 H3S PA 1075 90.522 66.547 30.077 1.00 0.00 H ATOM 43573 C12 PA 1075 91.540 67.794 28.617 1.00 0.00 C ATOM 43574 H2R PA 1075 92.542 68.213 28.510 1.00 0.00 H ATOM 43575 H2S PA 1075 90.819 68.606 28.497 1.00 0.00 H ATOM 43576 C11 PC 1076 91.090 67.031 27.325 1.00 0.00 C ATOM 43577 O12 PC 1076 91.796 66.838 26.318 1.00 0.00 O ATOM 43578 O11 PC 1076 89.795 66.636 27.381 1.00 0.00 O ATOM 43579 C1 PC 1076 88.991 66.215 26.196 1.00 0.00 C ATOM 43580 HR PC 1076 88.151 65.626 26.572 1.00 0.00 H ATOM 43581 HS PC 1076 89.586 65.516 25.601 1.00 0.00 H ATOM 43582 C2 PC 1076 88.538 67.489 25.449 1.00 0.00 C ATOM 43583 HX PC 1076 87.552 67.262 25.037 1.00 0.00 H ATOM 43584 C3 PC 1076 89.621 67.746 24.377 1.00 0.00 C ATOM 43585 HA PC 1076 89.926 66.798 23.926 1.00 0.00 H ATOM 43586 HB PC 1076 90.483 68.293 24.769 1.00 0.00 H ATOM 43587 O31 PC 1076 89.121 68.547 23.291 1.00 0.00 O ATOM 43588 P31 PC 1076 88.633 67.887 21.856 1.00 0.00 P ATOM 43589 O32 PC 1076 89.937 67.202 21.293 1.00 0.00 O ATOM 43590 C31 PC 1076 90.271 67.413 19.997 1.00 0.00 C ATOM 43591 H1A PC 1076 90.703 68.410 19.878 1.00 0.00 H ATOM 43592 H1B PC 1076 89.524 67.065 19.279 1.00 0.00 H ATOM 43593 C32 PC 1076 91.453 66.456 19.737 1.00 0.00 C ATOM 43594 H2A PC 1076 91.074 65.436 19.817 1.00 0.00 H ATOM 43595 H2B PC 1076 92.203 66.562 20.522 1.00 0.00 H ATOM 43596 N31 PC 1076 92.151 66.611 18.457 1.00 0.00 N ATOM 43597 C33 PC 1076 92.698 67.876 17.999 1.00 0.00 C ATOM 43598 H3A PC 1076 92.017 68.633 18.393 1.00 0.00 H ATOM 43599 H3B PC 1076 92.943 67.839 16.937 1.00 0.00 H ATOM 43600 H3C PC 1076 93.644 68.003 18.526 1.00 0.00 H ATOM 43601 C34 PC 1076 93.334 65.720 18.493 1.00 0.00 C ATOM 43602 H4A PC 1076 92.927 64.714 18.613 1.00 0.00 H ATOM 43603 H4B PC 1076 93.876 65.952 19.411 1.00 0.00 H ATOM 43604 H4C PC 1076 93.977 65.938 17.639 1.00 0.00 H ATOM 43605 C35 PC 1076 91.193 66.144 17.430 1.00 0.00 C ATOM 43606 H5A PC 1076 90.557 67.000 17.201 1.00 0.00 H ATOM 43607 H5B PC 1076 90.578 65.350 17.855 1.00 0.00 H ATOM 43608 H5C PC 1076 91.712 65.822 16.526 1.00 0.00 H ATOM 43609 O33 PC 1076 87.634 66.850 22.148 1.00 0.00 O ATOM 43610 O34 PC 1076 88.248 68.994 20.966 1.00 0.00 O ATOM 43611 O21 PC 1076 88.395 68.644 26.308 1.00 0.00 O ATOM 43612 C21 PC 1076 87.440 68.623 27.324 1.00 0.00 C ATOM 43613 O22 PC 1076 86.445 67.884 27.233 1.00 0.00 O ATOM 43614 C12 OL 1077 87.576 69.732 28.322 1.00 0.00 C ATOM 43615 H2R OL 1077 88.638 69.973 28.240 1.00 0.00 H ATOM 43616 H2S OL 1077 87.044 70.600 27.928 1.00 0.00 H ATOM 43617 C13 OL 1077 86.957 69.443 29.725 1.00 0.00 C ATOM 43618 H3R OL 1077 87.013 70.450 30.144 1.00 0.00 H ATOM 43619 H3S OL 1077 85.910 69.131 29.708 1.00 0.00 H ATOM 43620 C14 OL 1077 87.747 68.573 30.726 1.00 0.00 C ATOM 43621 H4R OL 1077 87.711 67.547 30.356 1.00 0.00 H ATOM 43622 H4S OL 1077 88.804 68.849 30.728 1.00 0.00 H ATOM 43623 C15 OL 1077 87.268 68.692 32.100 1.00 0.00 C ATOM 43624 H5R OL 1077 86.198 68.912 32.088 1.00 0.00 H ATOM 43625 H5S OL 1077 87.123 67.733 32.602 1.00 0.00 H ATOM 43626 C16 OL 1077 87.903 69.828 32.967 1.00 0.00 C ATOM 43627 H6R OL 1077 88.963 69.583 33.057 1.00 0.00 H ATOM 43628 H6S OL 1077 87.902 70.779 32.430 1.00 0.00 H ATOM 43629 C17 OL 1077 87.436 70.079 34.381 1.00 0.00 C ATOM 43630 H7R OL 1077 87.459 69.145 34.947 1.00 0.00 H ATOM 43631 H7S OL 1077 88.212 70.659 34.883 1.00 0.00 H ATOM 43632 C18 OL 1077 86.098 70.857 34.565 1.00 0.00 C ATOM 43633 H8R OL 1077 86.145 71.226 35.592 1.00 0.00 H ATOM 43634 H8S OL 1077 86.125 71.794 34.005 1.00 0.00 H ATOM 43635 C19 OL 1077 84.960 69.897 34.450 1.00 0.00 C ATOM 43636 H9R OL 1077 84.875 69.487 33.446 1.00 0.00 H ATOM 43637 C110 OL 1077 84.188 69.375 35.396 1.00 0.00 C ATOM 43638 H10R OL 1077 83.371 68.714 35.120 1.00 0.00 H ATOM 43639 C111 OL 1077 84.199 69.840 36.806 1.00 0.00 C ATOM 43640 H11R OL 1077 84.773 69.177 37.458 1.00 0.00 H ATOM 43641 H11S OL 1077 84.629 70.838 36.911 1.00 0.00 H ATOM 43642 C112 OL 1077 82.706 69.774 37.249 1.00 0.00 C ATOM 43643 H12R OL 1077 82.119 70.207 36.437 1.00 0.00 H ATOM 43644 H12S OL 1077 82.514 68.700 37.209 1.00 0.00 H ATOM 43645 C113 OL 1077 82.276 70.324 38.550 1.00 0.00 C ATOM 43646 H13R OL 1077 83.146 70.263 39.207 1.00 0.00 H ATOM 43647 H13S OL 1077 81.967 71.328 38.249 1.00 0.00 H ATOM 43648 C114 OL 1077 81.128 69.591 39.210 1.00 0.00 C ATOM 43649 H14R OL 1077 80.174 70.038 38.924 1.00 0.00 H ATOM 43650 H14S OL 1077 81.138 68.535 38.931 1.00 0.00 H ATOM 43651 C115 OL 1077 81.221 69.725 40.732 1.00 0.00 C ATOM 43652 H15R OL 1077 82.153 69.291 41.100 1.00 0.00 H ATOM 43653 H15S OL 1077 81.473 70.720 41.106 1.00 0.00 H ATOM 43654 C116 OL 1077 80.101 69.204 41.558 1.00 0.00 C ATOM 43655 H16R OL 1077 80.360 69.288 42.615 1.00 0.00 H ATOM 43656 H16S OL 1077 79.283 69.926 41.578 1.00 0.00 H ATOM 43657 C117 OL 1077 79.651 67.801 41.277 1.00 0.00 C ATOM 43658 H17R OL 1077 78.957 67.577 42.091 1.00 0.00 H ATOM 43659 H17S OL 1077 79.143 67.798 40.311 1.00 0.00 H ATOM 43660 C118 OL 1077 80.700 66.737 41.345 1.00 0.00 C ATOM 43661 H18R OL 1077 80.125 65.810 41.324 1.00 0.00 H ATOM 43662 H18S OL 1077 81.236 66.874 42.287 1.00 0.00 H ATOM 43663 H18T OL 1077 81.547 66.775 40.657 1.00 0.00 H TER 43664 OL 1077 ATOM 43664 C116 PA 1078 118.566 80.191 41.326 1.00 0.00 C ATOM 43665 H16R PA 1078 119.633 79.960 41.356 1.00 0.00 H ATOM 43666 H16S PA 1078 117.981 79.649 42.073 1.00 0.00 H ATOM 43667 H16T PA 1078 118.553 81.257 41.561 1.00 0.00 H ATOM 43668 C115 PA 1078 118.161 80.029 39.891 1.00 0.00 C ATOM 43669 H15R PA 1078 119.037 80.253 39.278 1.00 0.00 H ATOM 43670 H15S PA 1078 117.327 80.682 39.626 1.00 0.00 H ATOM 43671 C114 PA 1078 117.825 78.549 39.596 1.00 0.00 C ATOM 43672 H14R PA 1078 117.009 78.121 40.180 1.00 0.00 H ATOM 43673 H14S PA 1078 118.641 77.825 39.634 1.00 0.00 H ATOM 43674 C113 PA 1078 117.313 78.411 38.104 1.00 0.00 C ATOM 43675 H13R PA 1078 118.115 78.839 37.499 1.00 0.00 H ATOM 43676 H13S PA 1078 116.442 79.051 37.952 1.00 0.00 H ATOM 43677 C112 PA 1078 116.818 77.002 37.798 1.00 0.00 C ATOM 43678 H12R PA 1078 115.984 76.827 38.481 1.00 0.00 H ATOM 43679 H12S PA 1078 117.596 76.251 37.948 1.00 0.00 H ATOM 43680 C111 PA 1078 116.261 76.913 36.352 1.00 0.00 C ATOM 43681 H11R PA 1078 115.523 77.695 36.159 1.00 0.00 H ATOM 43682 H11S PA 1078 115.838 75.922 36.171 1.00 0.00 H ATOM 43683 C110 PA 1078 117.332 77.137 35.325 1.00 0.00 C ATOM 43684 H10R PA 1078 118.123 76.405 35.504 1.00 0.00 H ATOM 43685 H10S PA 1078 117.793 78.089 35.595 1.00 0.00 H ATOM 43686 C19 PA 1078 116.876 77.064 33.857 1.00 0.00 C ATOM 43687 H9R PA 1078 117.740 77.194 33.202 1.00 0.00 H ATOM 43688 H9S PA 1078 116.174 77.866 33.620 1.00 0.00 H ATOM 43689 C18 PA 1078 116.112 75.836 33.394 1.00 0.00 C ATOM 43690 H8R PA 1078 115.925 76.120 32.356 1.00 0.00 H ATOM 43691 H8S PA 1078 115.186 75.761 33.968 1.00 0.00 H ATOM 43692 C17 PA 1078 116.858 74.514 33.426 1.00 0.00 C ATOM 43693 H7R PA 1078 116.284 73.668 33.043 1.00 0.00 H ATOM 43694 H7S PA 1078 117.091 74.339 34.478 1.00 0.00 H ATOM 43695 C16 PA 1078 118.233 74.575 32.741 1.00 0.00 C ATOM 43696 H6R PA 1078 118.783 73.646 32.905 1.00 0.00 H ATOM 43697 H6S PA 1078 118.813 75.096 33.506 1.00 0.00 H ATOM 43698 C15 PA 1078 118.348 75.060 31.371 1.00 0.00 C ATOM 43699 H5R PA 1078 119.389 74.918 31.074 1.00 0.00 H ATOM 43700 H5S PA 1078 118.306 76.150 31.396 1.00 0.00 H ATOM 43701 C14 PA 1078 117.372 74.445 30.344 1.00 0.00 C ATOM 43702 H4R PA 1078 116.342 74.519 30.699 1.00 0.00 H ATOM 43703 H4S PA 1078 117.519 73.364 30.296 1.00 0.00 H ATOM 43704 C13 PA 1078 117.391 75.093 29.003 1.00 0.00 C ATOM 43705 H3R PA 1078 118.377 75.215 28.550 1.00 0.00 H ATOM 43706 H3S PA 1078 116.920 76.048 29.242 1.00 0.00 H ATOM 43707 C12 PA 1078 116.602 74.443 27.854 1.00 0.00 C ATOM 43708 H2R PA 1078 115.554 74.331 28.140 1.00 0.00 H ATOM 43709 H2S PA 1078 116.935 73.411 27.726 1.00 0.00 H ATOM 43710 C11 PGR 1079 116.825 75.325 26.669 1.00 0.00 C ATOM 43711 O12 PGR 1079 117.558 74.905 25.765 1.00 0.00 O ATOM 43712 O11 PGR 1079 116.280 76.551 26.729 1.00 0.00 O ATOM 43713 C1 PGR 1079 116.437 77.613 25.783 1.00 0.00 C ATOM 43714 HR PGR 1079 117.487 77.795 25.540 1.00 0.00 H ATOM 43715 HS PGR 1079 116.040 78.472 26.331 1.00 0.00 H ATOM 43716 C2 PGR 1079 115.631 77.223 24.519 1.00 0.00 C ATOM 43717 HX PGR 1079 115.987 76.276 24.107 1.00 0.00 H ATOM 43718 C3 PGR 1079 115.824 78.188 23.353 1.00 0.00 C ATOM 43719 HA PGR 1079 116.908 78.218 23.214 1.00 0.00 H ATOM 43720 HB PGR 1079 115.471 79.211 23.508 1.00 0.00 H ATOM 43721 O31 PGR 1079 115.273 77.712 22.077 1.00 0.00 O ATOM 43722 P31 PGR 1079 115.597 78.334 20.650 1.00 0.00 P ATOM 43723 O32 PGR 1079 114.743 79.643 20.666 1.00 0.00 O ATOM 43724 C31 PGR 1079 113.431 79.716 21.025 1.00 0.00 C ATOM 43725 H1A PGR 1079 112.790 78.993 20.513 1.00 0.00 H ATOM 43726 H1B PGR 1079 113.358 79.436 22.079 1.00 0.00 H ATOM 43727 C32 PGR 1079 112.837 81.121 20.769 1.00 0.00 C ATOM 43728 H2A PGR 1079 111.753 81.070 20.634 1.00 0.00 H ATOM 43729 O35 PGR 1079 113.408 81.672 19.542 1.00 0.00 O ATOM 43730 HO5A PGR 1079 113.268 81.076 18.785 1.00 0.00 H ATOM 43731 C33 PGR 1079 113.061 82.107 21.994 1.00 0.00 C ATOM 43732 H3A PGR 1079 112.848 83.112 21.620 1.00 0.00 H ATOM 43733 H3B PGR 1079 112.451 81.885 22.873 1.00 0.00 H ATOM 43734 O33 PGR 1079 117.026 78.685 20.580 1.00 0.00 O ATOM 43735 O34 PGR 1079 115.026 77.456 19.580 1.00 0.00 O ATOM 43736 O21 PGR 1079 114.230 77.244 25.033 1.00 0.00 O ATOM 43737 C21 PGR 1079 113.676 76.063 25.227 1.00 0.00 C ATOM 43738 O22 PGR 1079 114.117 74.963 24.910 1.00 0.00 O ATOM 43739 O36 PGR 1079 114.468 82.060 22.283 1.00 0.00 O ATOM 43740 HO6A PGR 1079 114.610 82.722 22.983 1.00 0.00 H ATOM 43741 C12 OL 1080 112.546 76.191 26.214 1.00 0.00 C ATOM 43742 H2R OL 1080 113.046 76.237 27.184 1.00 0.00 H ATOM 43743 H2S OL 1080 112.288 77.249 26.144 1.00 0.00 H ATOM 43744 C13 OL 1080 111.458 75.190 25.928 1.00 0.00 C ATOM 43745 H3R OL 1080 110.632 75.423 26.603 1.00 0.00 H ATOM 43746 H3S OL 1080 110.950 75.300 24.968 1.00 0.00 H ATOM 43747 C14 OL 1080 111.719 73.733 26.183 1.00 0.00 C ATOM 43748 H4R OL 1080 110.797 73.156 26.082 1.00 0.00 H ATOM 43749 H4S OL 1080 112.452 73.356 25.468 1.00 0.00 H ATOM 43750 C15 OL 1080 112.325 73.328 27.564 1.00 0.00 C ATOM 43751 H5R OL 1080 112.422 72.240 27.574 1.00 0.00 H ATOM 43752 H5S OL 1080 113.282 73.826 27.738 1.00 0.00 H ATOM 43753 C16 OL 1080 111.578 73.860 28.787 1.00 0.00 C ATOM 43754 H6R OL 1080 111.600 74.948 28.698 1.00 0.00 H ATOM 43755 H6S OL 1080 110.545 73.549 28.613 1.00 0.00 H ATOM 43756 C17 OL 1080 112.107 73.225 30.001 1.00 0.00 C ATOM 43757 H7R OL 1080 112.199 72.153 29.809 1.00 0.00 H ATOM 43758 H7S OL 1080 113.149 73.456 30.232 1.00 0.00 H ATOM 43759 C18 OL 1080 111.284 73.214 31.207 1.00 0.00 C ATOM 43760 H8R OL 1080 110.330 72.765 30.923 1.00 0.00 H ATOM 43761 H8S OL 1080 111.858 72.590 31.894 1.00 0.00 H ATOM 43762 C19 OL 1080 111.011 74.623 31.636 1.00 0.00 C ATOM 43763 H9R OL 1080 110.785 75.270 30.792 1.00 0.00 H ATOM 43764 C110 OL 1080 111.079 75.136 32.841 1.00 0.00 C ATOM 43765 H10R OL 1080 110.937 76.200 33.015 1.00 0.00 H ATOM 43766 C111 OL 1080 111.471 74.378 34.107 1.00 0.00 C ATOM 43767 H11R OL 1080 110.598 74.427 34.761 1.00 0.00 H ATOM 43768 H11S OL 1080 111.772 73.356 33.865 1.00 0.00 H ATOM 43769 C112 OL 1080 112.658 74.946 34.859 1.00 0.00 C ATOM 43770 H12R OL 1080 113.549 74.622 34.318 1.00 0.00 H ATOM 43771 H12S OL 1080 112.629 76.038 34.861 1.00 0.00 H ATOM 43772 C113 OL 1080 112.903 74.463 36.210 1.00 0.00 C ATOM 43773 H13R OL 1080 113.088 73.389 36.157 1.00 0.00 H ATOM 43774 H13S OL 1080 113.708 75.067 36.634 1.00 0.00 H ATOM 43775 C114 OL 1080 111.717 74.589 37.180 1.00 0.00 C ATOM 43776 H14R OL 1080 110.881 73.960 36.867 1.00 0.00 H ATOM 43777 H14S OL 1080 112.143 74.049 38.028 1.00 0.00 H ATOM 43778 C115 OL 1080 111.162 75.980 37.400 1.00 0.00 C ATOM 43779 H15R OL 1080 110.655 76.341 36.503 1.00 0.00 H ATOM 43780 H15S OL 1080 110.372 75.726 38.109 1.00 0.00 H ATOM 43781 C116 OL 1080 112.144 77.023 38.020 1.00 0.00 C ATOM 43782 H16R OL 1080 113.034 77.069 37.389 1.00 0.00 H ATOM 43783 H16S OL 1080 111.728 77.999 37.761 1.00 0.00 H ATOM 43784 C117 OL 1080 112.249 76.693 39.554 1.00 0.00 C ATOM 43785 H17R OL 1080 111.222 76.782 39.915 1.00 0.00 H ATOM 43786 H17S OL 1080 112.605 75.684 39.775 1.00 0.00 H ATOM 43787 C118 OL 1080 113.240 77.599 40.263 1.00 0.00 C ATOM 43788 H18R OL 1080 113.231 78.665 40.026 1.00 0.00 H ATOM 43789 H18S OL 1080 114.272 77.305 40.059 1.00 0.00 H ATOM 43790 H18T OL 1080 113.078 77.486 41.337 1.00 0.00 H TER 43791 OL 1080 ATOM 43791 C116 PA 1081 27.785 100.482 41.315 1.00 0.00 C ATOM 43792 H16R PA 1081 28.587 99.884 41.754 1.00 0.00 H ATOM 43793 H16S PA 1081 26.858 100.289 41.859 1.00 0.00 H ATOM 43794 H16T PA 1081 28.156 101.470 41.595 1.00 0.00 H ATOM 43795 C115 PA 1081 27.660 100.427 39.819 1.00 0.00 C ATOM 43796 H15R PA 1081 27.112 101.318 39.505 1.00 0.00 H ATOM 43797 H15S PA 1081 27.215 99.477 39.514 1.00 0.00 H ATOM 43798 C114 PA 1081 28.986 100.560 39.096 1.00 0.00 C ATOM 43799 H14R PA 1081 28.749 100.515 38.031 1.00 0.00 H ATOM 43800 H14S PA 1081 29.706 99.774 39.330 1.00 0.00 H ATOM 43801 C113 PA 1081 29.647 101.876 39.340 1.00 0.00 C ATOM 43802 H13R PA 1081 29.923 101.840 40.396 1.00 0.00 H ATOM 43803 H13S PA 1081 28.977 102.737 39.315 1.00 0.00 H ATOM 43804 C112 PA 1081 30.856 102.237 38.471 1.00 0.00 C ATOM 43805 H12R PA 1081 31.646 101.499 38.629 1.00 0.00 H ATOM 43806 H12S PA 1081 31.249 103.176 38.867 1.00 0.00 H ATOM 43807 C111 PA 1081 30.688 102.397 36.861 1.00 0.00 C ATOM 43808 H11R PA 1081 29.723 102.836 36.595 1.00 0.00 H ATOM 43809 H11S PA 1081 30.607 101.393 36.440 1.00 0.00 H ATOM 43810 C110 PA 1081 31.789 103.133 36.182 1.00 0.00 C ATOM 43811 H10R PA 1081 31.533 103.239 35.125 1.00 0.00 H ATOM 43812 H10S PA 1081 32.577 102.378 36.174 1.00 0.00 H ATOM 43813 C19 PA 1081 32.386 104.394 36.769 1.00 0.00 C ATOM 43814 H9R PA 1081 33.042 104.194 37.619 1.00 0.00 H ATOM 43815 H9S PA 1081 31.552 105.020 37.094 1.00 0.00 H ATOM 43816 C18 PA 1081 33.113 105.225 35.657 1.00 0.00 C ATOM 43817 H8R PA 1081 32.641 105.087 34.682 1.00 0.00 H ATOM 43818 H8S PA 1081 34.098 104.809 35.433 1.00 0.00 H ATOM 43819 C17 PA 1081 33.113 106.586 36.120 1.00 0.00 C ATOM 43820 H7R PA 1081 33.870 106.663 36.903 1.00 0.00 H ATOM 43821 H7S PA 1081 32.219 106.950 36.631 1.00 0.00 H ATOM 43822 C16 PA 1081 33.369 107.619 35.069 1.00 0.00 C ATOM 43823 H6R PA 1081 32.590 107.591 34.304 1.00 0.00 H ATOM 43824 H6S PA 1081 34.215 107.253 34.484 1.00 0.00 H ATOM 43825 C15 PA 1081 33.752 108.896 35.767 1.00 0.00 C ATOM 43826 H5R PA 1081 34.825 108.812 35.954 1.00 0.00 H ATOM 43827 H5S PA 1081 33.166 109.056 36.674 1.00 0.00 H ATOM 43828 C14 PA 1081 33.660 110.095 34.852 1.00 0.00 C ATOM 43829 H4R PA 1081 34.040 110.937 35.434 1.00 0.00 H ATOM 43830 H4S PA 1081 32.613 110.344 34.665 1.00 0.00 H ATOM 43831 C13 PA 1081 34.456 110.066 33.527 1.00 0.00 C ATOM 43832 H3R PA 1081 34.009 109.221 32.999 1.00 0.00 H ATOM 43833 H3S PA 1081 35.502 109.883 33.780 1.00 0.00 H ATOM 43834 C12 PA 1081 34.301 111.372 32.738 1.00 0.00 C ATOM 43835 H2R PA 1081 34.779 112.146 33.342 1.00 0.00 H ATOM 43836 H2S PA 1081 33.269 111.726 32.696 1.00 0.00 H ATOM 43837 C11 PGR 1082 34.973 111.244 31.437 1.00 0.00 C ATOM 43838 O12 PGR 1082 35.380 110.155 31.025 1.00 0.00 O ATOM 43839 O11 PGR 1082 34.971 112.437 30.724 1.00 0.00 O ATOM 43840 C1 PGR 1082 35.291 112.380 29.342 1.00 0.00 C ATOM 43841 HR PGR 1082 36.089 111.637 29.264 1.00 0.00 H ATOM 43842 HS PGR 1082 35.630 113.341 28.947 1.00 0.00 H ATOM 43843 C2 PGR 1082 34.197 111.659 28.509 1.00 0.00 C ATOM 43844 HX PGR 1082 34.057 110.641 28.882 1.00 0.00 H ATOM 43845 C3 PGR 1082 34.588 111.395 27.042 1.00 0.00 C ATOM 43846 HA PGR 1082 35.613 111.015 27.019 1.00 0.00 H ATOM 43847 HB PGR 1082 34.676 112.315 26.460 1.00 0.00 H ATOM 43848 O31 PGR 1082 33.678 110.439 26.450 1.00 0.00 O ATOM 43849 P31 PGR 1082 33.584 110.346 24.891 1.00 0.00 P ATOM 43850 O32 PGR 1082 32.876 111.642 24.303 1.00 0.00 O ATOM 43851 C31 PGR 1082 31.549 111.975 24.815 1.00 0.00 C ATOM 43852 H1A PGR 1082 31.646 112.114 25.895 1.00 0.00 H ATOM 43853 H1B PGR 1082 30.835 111.170 24.619 1.00 0.00 H ATOM 43854 C32 PGR 1082 31.102 113.274 24.091 1.00 0.00 C ATOM 43855 H2A PGR 1082 30.159 113.661 24.485 1.00 0.00 H ATOM 43856 O35 PGR 1082 31.097 112.984 22.663 1.00 0.00 O ATOM 43857 HO5A PGR 1082 31.950 112.534 22.522 1.00 0.00 H ATOM 43858 C33 PGR 1082 32.067 114.500 24.315 1.00 0.00 C ATOM 43859 H3A PGR 1082 31.526 115.429 24.119 1.00 0.00 H ATOM 43860 H3B PGR 1082 32.320 114.570 25.376 1.00 0.00 H ATOM 43861 O33 PGR 1082 34.906 110.252 24.418 1.00 0.00 O ATOM 43862 O34 PGR 1082 32.697 109.230 24.722 1.00 0.00 O ATOM 43863 O21 PGR 1082 32.955 112.311 28.683 1.00 0.00 O ATOM 43864 C21 PGR 1082 32.777 113.572 28.286 1.00 0.00 C ATOM 43865 O22 PGR 1082 33.534 114.323 27.758 1.00 0.00 O ATOM 43866 O36 PGR 1082 33.224 114.384 23.448 1.00 0.00 O ATOM 43867 HO6A PGR 1082 33.786 113.663 23.783 1.00 0.00 H ATOM 43868 C12 OL 1083 31.400 114.053 28.713 1.00 0.00 C ATOM 43869 H2R OL 1083 31.282 115.062 28.313 1.00 0.00 H ATOM 43870 H2S OL 1083 30.756 113.297 28.259 1.00 0.00 H ATOM 43871 C13 OL 1083 31.322 114.268 30.190 1.00 0.00 C ATOM 43872 H3R OL 1083 31.765 113.383 30.651 1.00 0.00 H ATOM 43873 H3S OL 1083 32.031 115.064 30.432 1.00 0.00 H ATOM 43874 C14 OL 1083 29.922 114.617 30.727 1.00 0.00 C ATOM 43875 H4R OL 1083 29.580 115.510 30.199 1.00 0.00 H ATOM 43876 H4S OL 1083 29.142 113.904 30.451 1.00 0.00 H ATOM 43877 C15 OL 1083 29.751 114.955 32.253 1.00 0.00 C ATOM 43878 H5R OL 1083 30.445 115.747 32.542 1.00 0.00 H ATOM 43879 H5S OL 1083 28.774 115.398 32.456 1.00 0.00 H ATOM 43880 C16 OL 1083 30.006 113.684 33.117 1.00 0.00 C ATOM 43881 H6R OL 1083 29.285 112.871 33.008 1.00 0.00 H ATOM 43882 H6S OL 1083 31.011 113.268 33.024 1.00 0.00 H ATOM 43883 C17 OL 1083 29.888 114.067 34.559 1.00 0.00 C ATOM 43884 H7R OL 1083 30.537 114.890 34.866 1.00 0.00 H ATOM 43885 H7S OL 1083 28.931 114.529 34.811 1.00 0.00 H ATOM 43886 C18 OL 1083 30.155 112.951 35.630 1.00 0.00 C ATOM 43887 H8R OL 1083 29.599 113.125 36.553 1.00 0.00 H ATOM 43888 H8S OL 1083 29.696 112.063 35.189 1.00 0.00 H ATOM 43889 C19 OL 1083 31.599 112.797 35.851 1.00 0.00 C ATOM 43890 H9R OL 1083 32.264 113.300 35.154 1.00 0.00 H ATOM 43891 C110 OL 1083 32.300 112.421 36.927 1.00 0.00 C ATOM 43892 H10R OL 1083 33.368 112.594 36.819 1.00 0.00 H ATOM 43893 C111 OL 1083 31.754 111.880 38.237 1.00 0.00 C ATOM 43894 H11R OL 1083 30.916 112.503 38.556 1.00 0.00 H ATOM 43895 H11S OL 1083 31.351 110.905 37.955 1.00 0.00 H ATOM 43896 C112 OL 1083 32.827 111.678 39.383 1.00 0.00 C ATOM 43897 H12R OL 1083 32.376 111.182 40.245 1.00 0.00 H ATOM 43898 H12S OL 1083 33.687 111.045 39.155 1.00 0.00 H ATOM 43899 C113 OL 1083 33.543 113.008 39.750 1.00 0.00 C ATOM 43900 H13R OL 1083 34.486 113.066 39.203 1.00 0.00 H ATOM 43901 H13S OL 1083 32.973 113.906 39.505 1.00 0.00 H ATOM 43902 C114 OL 1083 33.884 113.256 41.245 1.00 0.00 C ATOM 43903 H14R OL 1083 32.969 113.315 41.838 1.00 0.00 H ATOM 43904 H14S OL 1083 34.538 112.461 41.610 1.00 0.00 H ATOM 43905 C115 OL 1083 34.761 114.494 41.418 1.00 0.00 C ATOM 43906 H15R OL 1083 35.714 114.439 40.887 1.00 0.00 H ATOM 43907 H15S OL 1083 34.307 115.385 40.981 1.00 0.00 H ATOM 43908 C116 OL 1083 35.034 114.796 42.918 1.00 0.00 C ATOM 43909 H16R OL 1083 34.075 115.133 43.316 1.00 0.00 H ATOM 43910 H16S OL 1083 35.197 113.894 43.513 1.00 0.00 H ATOM 43911 C117 OL 1083 36.077 115.989 43.127 1.00 0.00 C ATOM 43912 H17R OL 1083 37.052 115.528 42.951 1.00 0.00 H ATOM 43913 H17S OL 1083 35.754 116.736 42.399 1.00 0.00 H ATOM 43914 C118 OL 1083 36.033 116.654 44.517 1.00 0.00 C ATOM 43915 H18R OL 1083 35.117 117.238 44.632 1.00 0.00 H ATOM 43916 H18S OL 1083 36.820 117.390 44.692 1.00 0.00 H ATOM 43917 H18T OL 1083 36.205 115.852 45.239 1.00 0.00 H TER 43918 OL 1083 ATOM 43918 C116 PA 1084 95.156 91.788 32.296 1.00 0.00 C ATOM 43919 H16R PA 1084 94.584 92.719 32.312 1.00 0.00 H ATOM 43920 H16S PA 1084 94.793 91.219 33.154 1.00 0.00 H ATOM 43921 H16T PA 1084 94.891 91.142 31.457 1.00 0.00 H ATOM 43922 C115 PA 1084 96.709 91.834 32.273 1.00 0.00 C ATOM 43923 H15R PA 1084 97.040 92.722 31.730 1.00 0.00 H ATOM 43924 H15S PA 1084 97.134 90.966 31.764 1.00 0.00 H ATOM 43925 C114 PA 1084 97.268 91.948 33.675 1.00 0.00 C ATOM 43926 H14R PA 1084 96.708 91.399 34.435 1.00 0.00 H ATOM 43927 H14S PA 1084 97.102 92.983 33.983 1.00 0.00 H ATOM 43928 C113 PA 1084 98.672 91.404 33.697 1.00 0.00 C ATOM 43929 H13R PA 1084 99.397 92.185 33.457 1.00 0.00 H ATOM 43930 H13S PA 1084 98.796 90.656 32.912 1.00 0.00 H ATOM 43931 C112 PA 1084 99.132 90.884 35.069 1.00 0.00 C ATOM 43932 H12R PA 1084 98.305 90.321 35.507 1.00 0.00 H ATOM 43933 H12S PA 1084 99.288 91.731 35.739 1.00 0.00 H ATOM 43934 C111 PA 1084 100.508 90.102 35.069 1.00 0.00 C ATOM 43935 H11R PA 1084 101.017 90.114 36.035 1.00 0.00 H ATOM 43936 H11S PA 1084 101.106 90.433 34.217 1.00 0.00 H ATOM 43937 C110 PA 1084 100.237 88.576 34.936 1.00 0.00 C ATOM 43938 H10R PA 1084 99.659 88.450 34.018 1.00 0.00 H ATOM 43939 H10S PA 1084 99.568 88.256 35.737 1.00 0.00 H ATOM 43940 C19 PA 1084 101.483 87.640 34.872 1.00 0.00 C ATOM 43941 H9R PA 1084 101.080 86.638 35.035 1.00 0.00 H ATOM 43942 H9S PA 1084 102.081 88.056 35.686 1.00 0.00 H ATOM 43943 C18 PA 1084 102.398 87.587 33.632 1.00 0.00 C ATOM 43944 H8R PA 1084 102.696 88.618 33.432 1.00 0.00 H ATOM 43945 H8S PA 1084 101.790 87.231 32.798 1.00 0.00 H ATOM 43946 C17 PA 1084 103.629 86.733 33.848 1.00 0.00 C ATOM 43947 H7R PA 1084 103.231 85.796 34.244 1.00 0.00 H ATOM 43948 H7S PA 1084 104.320 87.000 34.651 1.00 0.00 H ATOM 43949 C16 PA 1084 104.510 86.578 32.623 1.00 0.00 C ATOM 43950 H6R PA 1084 104.956 87.526 32.313 1.00 0.00 H ATOM 43951 H6S PA 1084 103.978 86.216 31.741 1.00 0.00 H ATOM 43952 C15 PA 1084 105.781 85.635 32.805 1.00 0.00 C ATOM 43953 H5R PA 1084 105.352 84.675 33.100 1.00 0.00 H ATOM 43954 H5S PA 1084 106.192 86.003 33.747 1.00 0.00 H ATOM 43955 C14 PA 1084 106.748 85.414 31.616 1.00 0.00 C ATOM 43956 H4R PA 1084 107.153 86.367 31.270 1.00 0.00 H ATOM 43957 H4S PA 1084 106.046 85.020 30.879 1.00 0.00 H ATOM 43958 C13 PA 1084 107.979 84.476 31.865 1.00 0.00 C ATOM 43959 H3R PA 1084 107.714 83.429 32.025 1.00 0.00 H ATOM 43960 H3S PA 1084 108.293 84.772 32.868 1.00 0.00 H ATOM 43961 C12 PA 1084 109.088 84.701 30.908 1.00 0.00 C ATOM 43962 H2R PA 1084 109.844 83.969 31.199 1.00 0.00 H ATOM 43963 H2S PA 1084 109.449 85.729 30.980 1.00 0.00 H ATOM 43964 C11 PGR 1085 108.606 84.424 29.468 1.00 0.00 C ATOM 43965 O12 PGR 1085 108.706 85.087 28.481 1.00 0.00 O ATOM 43966 O11 PGR 1085 107.900 83.283 29.449 1.00 0.00 O ATOM 43967 C1 PGR 1085 107.250 82.797 28.254 1.00 0.00 C ATOM 43968 HR PGR 1085 106.358 83.400 28.063 1.00 0.00 H ATOM 43969 HS PGR 1085 106.752 81.838 28.417 1.00 0.00 H ATOM 43970 C2 PGR 1085 108.272 82.520 27.087 1.00 0.00 C ATOM 43971 HX PGR 1085 109.191 83.099 27.209 1.00 0.00 H ATOM 43972 C3 PGR 1085 107.544 82.707 25.765 1.00 0.00 C ATOM 43973 HA PGR 1085 108.144 82.282 24.956 1.00 0.00 H ATOM 43974 HB PGR 1085 107.423 83.766 25.523 1.00 0.00 H ATOM 43975 O31 PGR 1085 106.219 82.140 25.767 1.00 0.00 O ATOM 43976 P31 PGR 1085 105.163 82.450 24.658 1.00 0.00 P ATOM 43977 O32 PGR 1085 105.750 81.758 23.385 1.00 0.00 O ATOM 43978 C31 PGR 1085 106.001 80.427 23.431 1.00 0.00 C ATOM 43979 H1A PGR 1085 106.870 80.176 24.045 1.00 0.00 H ATOM 43980 H1B PGR 1085 105.143 79.952 23.913 1.00 0.00 H ATOM 43981 C32 PGR 1085 106.256 80.051 21.939 1.00 0.00 C ATOM 43982 H2A PGR 1085 107.063 80.681 21.558 1.00 0.00 H ATOM 43983 O35 PGR 1085 104.980 80.084 21.186 1.00 0.00 O ATOM 43984 HO5A PGR 1085 104.615 80.984 21.123 1.00 0.00 H ATOM 43985 C33 PGR 1085 106.832 78.647 21.907 1.00 0.00 C ATOM 43986 H3A PGR 1085 107.061 78.392 20.870 1.00 0.00 H ATOM 43987 H3B PGR 1085 107.745 78.601 22.506 1.00 0.00 H ATOM 43988 O33 PGR 1085 103.961 81.745 25.084 1.00 0.00 O ATOM 43989 O34 PGR 1085 105.165 83.912 24.473 1.00 0.00 O ATOM 43990 O21 PGR 1085 108.711 81.116 27.179 1.00 0.00 O ATOM 43991 C21 PGR 1085 109.496 80.833 28.225 1.00 0.00 C ATOM 43992 O22 PGR 1085 110.160 81.595 28.920 1.00 0.00 O ATOM 43993 O36 PGR 1085 105.842 77.704 22.343 1.00 0.00 O ATOM 43994 HO6A PGR 1085 106.277 76.840 22.228 1.00 0.00 H ATOM 43995 C12 OL 1086 109.451 79.341 28.497 1.00 0.00 C ATOM 43996 H2R OL 1086 108.535 78.911 28.087 1.00 0.00 H ATOM 43997 H2S OL 1086 110.239 78.840 27.931 1.00 0.00 H ATOM 43998 C13 OL 1086 109.593 78.972 30.035 1.00 0.00 C ATOM 43999 H3R OL 1086 109.650 77.888 30.159 1.00 0.00 H ATOM 44000 H3S OL 1086 110.523 79.396 30.420 1.00 0.00 H ATOM 44001 C14 OL 1086 108.425 79.512 30.852 1.00 0.00 C ATOM 44002 H4R OL 1086 108.419 80.604 30.833 1.00 0.00 H ATOM 44003 H4S OL 1086 107.534 79.307 30.254 1.00 0.00 H ATOM 44004 C15 OL 1086 108.356 79.055 32.334 1.00 0.00 C ATOM 44005 H5R OL 1086 108.293 77.965 32.316 1.00 0.00 H ATOM 44006 H5S OL 1086 109.225 79.390 32.905 1.00 0.00 H ATOM 44007 C16 OL 1086 107.230 79.629 33.132 1.00 0.00 C ATOM 44008 H6R OL 1086 107.197 80.710 32.976 1.00 0.00 H ATOM 44009 H6S OL 1086 106.301 79.442 32.590 1.00 0.00 H ATOM 44010 C17 OL 1086 107.183 79.197 34.689 1.00 0.00 C ATOM 44011 H7R OL 1086 107.460 78.146 34.790 1.00 0.00 H ATOM 44012 H7S OL 1086 108.058 79.591 35.210 1.00 0.00 H ATOM 44013 C18 OL 1086 105.864 79.555 35.417 1.00 0.00 C ATOM 44014 H8R OL 1086 106.087 79.694 36.476 1.00 0.00 H ATOM 44015 H8S OL 1086 105.518 80.546 35.116 1.00 0.00 H ATOM 44016 C19 OL 1086 104.792 78.542 35.232 1.00 0.00 C ATOM 44017 H9R OL 1086 104.317 78.575 34.254 1.00 0.00 H ATOM 44018 C110 OL 1086 104.339 77.766 36.188 1.00 0.00 C ATOM 44019 H10R OL 1086 103.510 77.085 36.019 1.00 0.00 H ATOM 44020 C111 OL 1086 104.854 77.687 37.647 1.00 0.00 C ATOM 44021 H11R OL 1086 104.643 76.669 37.980 1.00 0.00 H ATOM 44022 H11S OL 1086 105.941 77.679 37.752 1.00 0.00 H ATOM 44023 C112 OL 1086 104.250 78.704 38.558 1.00 0.00 C ATOM 44024 H12R OL 1086 104.895 79.585 38.552 1.00 0.00 H ATOM 44025 H12S OL 1086 103.256 78.998 38.213 1.00 0.00 H ATOM 44026 C113 OL 1086 104.051 78.231 39.968 1.00 0.00 C ATOM 44027 H13R OL 1086 103.498 77.318 39.737 1.00 0.00 H ATOM 44028 H13S OL 1086 104.946 77.837 40.453 1.00 0.00 H ATOM 44029 C114 OL 1086 103.326 79.179 40.922 1.00 0.00 C ATOM 44030 H14R OL 1086 103.863 80.125 41.023 1.00 0.00 H ATOM 44031 H14S OL 1086 102.430 79.483 40.377 1.00 0.00 H ATOM 44032 C115 OL 1086 102.978 78.617 42.295 1.00 0.00 C ATOM 44033 H15R OL 1086 103.806 78.749 42.995 1.00 0.00 H ATOM 44034 H15S OL 1086 102.267 79.355 42.671 1.00 0.00 H ATOM 44035 C116 OL 1086 102.427 77.215 42.282 1.00 0.00 C ATOM 44036 H16R OL 1086 102.074 77.046 41.262 1.00 0.00 H ATOM 44037 H16S OL 1086 103.325 76.645 42.531 1.00 0.00 H ATOM 44038 C117 OL 1086 101.414 76.833 43.322 1.00 0.00 C ATOM 44039 H17R OL 1086 100.534 77.472 43.226 1.00 0.00 H ATOM 44040 H17S OL 1086 101.051 75.847 43.025 1.00 0.00 H ATOM 44041 C118 OL 1086 102.001 76.787 44.752 1.00 0.00 C ATOM 44042 H18R OL 1086 102.904 76.175 44.796 1.00 0.00 H ATOM 44043 H18S OL 1086 101.303 76.295 45.433 1.00 0.00 H ATOM 44044 H18T OL 1086 102.279 77.771 45.133 1.00 0.00 H TER 44045 OL 1086 ATOM 44045 C116 PA 1087 71.416 75.017 44.610 1.00 0.00 C ATOM 44046 H16R PA 1087 72.503 74.916 44.635 1.00 0.00 H ATOM 44047 H16S PA 1087 71.045 75.106 45.633 1.00 0.00 H ATOM 44048 H16T PA 1087 71.275 76.008 44.172 1.00 0.00 H ATOM 44049 C115 PA 1087 70.777 73.886 43.702 1.00 0.00 C ATOM 44050 H15R PA 1087 69.737 74.057 43.416 1.00 0.00 H ATOM 44051 H15S PA 1087 70.930 72.982 44.295 1.00 0.00 H ATOM 44052 C114 PA 1087 71.582 73.728 42.361 1.00 0.00 C ATOM 44053 H14R PA 1087 72.662 73.819 42.493 1.00 0.00 H ATOM 44054 H14S PA 1087 71.373 74.545 41.666 1.00 0.00 H ATOM 44055 C113 PA 1087 71.176 72.585 41.506 1.00 0.00 C ATOM 44056 H13R PA 1087 70.247 72.899 41.026 1.00 0.00 H ATOM 44057 H13S PA 1087 70.937 71.792 42.218 1.00 0.00 H ATOM 44058 C112 PA 1087 72.097 72.050 40.407 1.00 0.00 C ATOM 44059 H12R PA 1087 71.809 71.065 40.035 1.00 0.00 H ATOM 44060 H12S PA 1087 73.106 71.889 40.792 1.00 0.00 H ATOM 44061 C111 PA 1087 71.979 72.901 39.090 1.00 0.00 C ATOM 44062 H11R PA 1087 72.322 73.909 39.333 1.00 0.00 H ATOM 44063 H11S PA 1087 70.919 72.996 38.844 1.00 0.00 H ATOM 44064 C110 PA 1087 72.627 72.312 37.822 1.00 0.00 C ATOM 44065 H10R PA 1087 72.153 71.381 37.505 1.00 0.00 H ATOM 44066 H10S PA 1087 73.580 71.927 38.191 1.00 0.00 H ATOM 44067 C19 PA 1087 72.814 73.311 36.797 1.00 0.00 C ATOM 44068 H9R PA 1087 73.256 74.154 37.332 1.00 0.00 H ATOM 44069 H9S PA 1087 71.893 73.736 36.391 1.00 0.00 H ATOM 44070 C18 PA 1087 73.595 72.890 35.536 1.00 0.00 C ATOM 44071 H8R PA 1087 74.662 72.685 35.644 1.00 0.00 H ATOM 44072 H8S PA 1087 73.633 73.769 34.889 1.00 0.00 H ATOM 44073 C17 PA 1087 72.853 71.896 34.662 1.00 0.00 C ATOM 44074 H7R PA 1087 71.832 72.197 34.421 1.00 0.00 H ATOM 44075 H7S PA 1087 72.783 70.971 35.240 1.00 0.00 H ATOM 44076 C16 PA 1087 73.646 71.445 33.402 1.00 0.00 C ATOM 44077 H6R PA 1087 74.410 70.818 33.867 1.00 0.00 H ATOM 44078 H6S PA 1087 74.179 72.274 32.933 1.00 0.00 H ATOM 44079 C15 PA 1087 72.952 70.680 32.405 1.00 0.00 C ATOM 44080 H5R PA 1087 72.279 71.351 31.866 1.00 0.00 H ATOM 44081 H5S PA 1087 72.252 69.999 32.894 1.00 0.00 H ATOM 44082 C14 PA 1087 73.898 70.005 31.422 1.00 0.00 C ATOM 44083 H4R PA 1087 73.290 69.169 31.071 1.00 0.00 H ATOM 44084 H4S PA 1087 74.736 69.530 31.937 1.00 0.00 H ATOM 44085 C13 PA 1087 74.318 70.839 30.236 1.00 0.00 C ATOM 44086 H3R PA 1087 74.908 71.690 30.582 1.00 0.00 H ATOM 44087 H3S PA 1087 73.416 71.287 29.815 1.00 0.00 H ATOM 44088 C12 PA 1087 75.059 70.062 29.209 1.00 0.00 C ATOM 44089 H2R PA 1087 75.631 69.255 29.672 1.00 0.00 H ATOM 44090 H2S PA 1087 75.814 70.610 28.642 1.00 0.00 H ATOM 44091 C11 PGR 1088 74.280 69.470 28.070 1.00 0.00 C ATOM 44092 O12 PGR 1088 74.770 69.451 26.958 1.00 0.00 O ATOM 44093 O11 PGR 1088 73.114 68.835 28.455 1.00 0.00 O ATOM 44094 C1 PGR 1088 72.206 68.181 27.456 1.00 0.00 C ATOM 44095 HR PGR 1088 71.613 67.409 27.955 1.00 0.00 H ATOM 44096 HS PGR 1088 72.847 67.754 26.680 1.00 0.00 H ATOM 44097 C2 PGR 1088 71.225 69.178 26.916 1.00 0.00 C ATOM 44098 HX PGR 1088 70.668 68.712 26.099 1.00 0.00 H ATOM 44099 C3 PGR 1088 71.860 70.484 26.256 1.00 0.00 C ATOM 44100 HA PGR 1088 72.786 70.166 25.770 1.00 0.00 H ATOM 44101 HB PGR 1088 72.123 71.261 26.978 1.00 0.00 H ATOM 44102 O31 PGR 1088 70.930 70.831 25.178 1.00 0.00 O ATOM 44103 P31 PGR 1088 70.949 72.267 24.551 1.00 0.00 P ATOM 44104 O32 PGR 1088 70.394 73.300 25.617 1.00 0.00 O ATOM 44105 C31 PGR 1088 69.175 73.098 26.183 1.00 0.00 C ATOM 44106 H1A PGR 1088 69.245 72.295 26.921 1.00 0.00 H ATOM 44107 H1B PGR 1088 68.569 72.763 25.337 1.00 0.00 H ATOM 44108 C32 PGR 1088 68.577 74.342 26.851 1.00 0.00 C ATOM 44109 H2A PGR 1088 67.659 74.026 27.352 1.00 0.00 H ATOM 44110 O35 PGR 1088 68.156 75.271 25.906 1.00 0.00 O ATOM 44111 HO5A PGR 1088 68.876 75.481 25.285 1.00 0.00 H ATOM 44112 C33 PGR 1088 69.486 74.943 27.918 1.00 0.00 C ATOM 44113 H3A PGR 1088 68.835 75.714 28.338 1.00 0.00 H ATOM 44114 H3B PGR 1088 69.684 74.232 28.725 1.00 0.00 H ATOM 44115 O33 PGR 1088 72.342 72.636 24.137 1.00 0.00 O ATOM 44116 O34 PGR 1088 70.020 72.270 23.406 1.00 0.00 O ATOM 44117 O21 PGR 1088 70.381 69.672 27.977 1.00 0.00 O ATOM 44118 C21 PGR 1088 69.508 68.886 28.559 1.00 0.00 C ATOM 44119 O22 PGR 1088 69.387 67.715 28.296 1.00 0.00 O ATOM 44120 O36 PGR 1088 70.769 75.464 27.422 1.00 0.00 O ATOM 44121 HO6A PGR 1088 71.198 74.692 27.013 1.00 0.00 H ATOM 44122 C12 OL 1089 68.532 69.629 29.429 1.00 0.00 C ATOM 44123 H2R OL 1089 68.073 70.411 28.821 1.00 0.00 H ATOM 44124 H2S OL 1089 67.686 68.974 29.647 1.00 0.00 H ATOM 44125 C13 OL 1089 69.217 70.099 30.694 1.00 0.00 C ATOM 44126 H3R OL 1089 70.048 70.751 30.417 1.00 0.00 H ATOM 44127 H3S OL 1089 68.655 70.743 31.373 1.00 0.00 H ATOM 44128 C14 OL 1089 69.812 68.960 31.543 1.00 0.00 C ATOM 44129 H4R OL 1089 70.612 68.508 30.953 1.00 0.00 H ATOM 44130 H4S OL 1089 70.345 69.367 32.405 1.00 0.00 H ATOM 44131 C15 OL 1089 68.821 67.869 31.904 1.00 0.00 C ATOM 44132 H5R OL 1089 67.967 68.296 32.433 1.00 0.00 H ATOM 44133 H5S OL 1089 68.428 67.331 31.039 1.00 0.00 H ATOM 44134 C16 OL 1089 69.522 66.755 32.668 1.00 0.00 C ATOM 44135 H6R OL 1089 70.167 66.257 31.941 1.00 0.00 H ATOM 44136 H6S OL 1089 70.078 67.142 33.525 1.00 0.00 H ATOM 44137 C17 OL 1089 68.556 65.760 33.359 1.00 0.00 C ATOM 44138 H7R OL 1089 67.909 66.245 34.093 1.00 0.00 H ATOM 44139 H7S OL 1089 67.873 65.411 32.582 1.00 0.00 H ATOM 44140 C18 OL 1089 69.127 64.468 34.003 1.00 0.00 C ATOM 44141 H8R OL 1089 69.405 63.816 33.173 1.00 0.00 H ATOM 44142 H8S OL 1089 70.056 64.678 34.537 1.00 0.00 H ATOM 44143 C19 OL 1089 68.179 63.901 35.041 1.00 0.00 C ATOM 44144 H9R OL 1089 67.853 64.710 35.690 1.00 0.00 H ATOM 44145 C110 OL 1089 67.754 62.634 35.199 1.00 0.00 C ATOM 44146 H10R OL 1089 67.109 62.448 36.054 1.00 0.00 H ATOM 44147 C111 OL 1089 68.075 61.421 34.402 1.00 0.00 C ATOM 44148 H11R OL 1089 67.171 60.884 34.108 1.00 0.00 H ATOM 44149 H11S OL 1089 68.687 61.623 33.521 1.00 0.00 H ATOM 44150 C112 OL 1089 68.954 60.538 35.241 1.00 0.00 C ATOM 44151 H12R OL 1089 69.781 61.134 35.634 1.00 0.00 H ATOM 44152 H12S OL 1089 68.377 60.107 36.062 1.00 0.00 H ATOM 44153 C113 OL 1089 69.565 59.389 34.588 1.00 0.00 C ATOM 44154 H13R OL 1089 68.825 58.852 33.991 1.00 0.00 H ATOM 44155 H13S OL 1089 70.402 59.740 33.980 1.00 0.00 H ATOM 44156 C114 OL 1089 70.249 58.370 35.452 1.00 0.00 C ATOM 44157 H14R OL 1089 70.682 58.891 36.308 1.00 0.00 H ATOM 44158 H14S OL 1089 69.426 57.815 35.905 1.00 0.00 H ATOM 44159 C115 OL 1089 71.150 57.558 34.533 1.00 0.00 C ATOM 44160 H15R OL 1089 70.776 57.484 33.510 1.00 0.00 H ATOM 44161 H15S OL 1089 72.008 58.233 34.510 1.00 0.00 H ATOM 44162 C116 OL 1089 71.597 56.359 35.263 1.00 0.00 C ATOM 44163 H16R OL 1089 72.389 56.589 35.979 1.00 0.00 H ATOM 44164 H16S OL 1089 70.793 56.019 35.919 1.00 0.00 H ATOM 44165 C117 OL 1089 72.091 55.222 34.326 1.00 0.00 C ATOM 44166 H17R OL 1089 71.233 54.972 33.699 1.00 0.00 H ATOM 44167 H17S OL 1089 72.889 55.591 33.678 1.00 0.00 H ATOM 44168 C118 OL 1089 72.666 54.023 35.077 1.00 0.00 C ATOM 44169 H18R OL 1089 73.088 53.296 34.381 1.00 0.00 H ATOM 44170 H18S OL 1089 71.832 53.584 35.628 1.00 0.00 H ATOM 44171 H18T OL 1089 73.485 54.320 35.734 1.00 0.00 H TER 44172 OL 1089 ATOM 44172 C116 PA 1090 110.080 49.552 35.071 1.00 0.00 C ATOM 44173 H16R PA 1090 109.349 48.753 34.933 1.00 0.00 H ATOM 44174 H16S PA 1090 110.082 49.719 36.151 1.00 0.00 H ATOM 44175 H16T PA 1090 111.074 49.198 34.792 1.00 0.00 H ATOM 44176 C115 PA 1090 109.726 50.886 34.510 1.00 0.00 C ATOM 44177 H15R PA 1090 110.394 51.672 34.869 1.00 0.00 H ATOM 44178 H15S PA 1090 108.729 51.116 34.890 1.00 0.00 H ATOM 44179 C114 PA 1090 109.632 50.977 32.999 1.00 0.00 C ATOM 44180 H14R PA 1090 108.829 50.264 32.799 1.00 0.00 H ATOM 44181 H14S PA 1090 110.494 50.556 32.478 1.00 0.00 H ATOM 44182 C113 PA 1090 109.212 52.366 32.440 1.00 0.00 C ATOM 44183 H13R PA 1090 109.391 52.218 31.373 1.00 0.00 H ATOM 44184 H13S PA 1090 109.880 53.108 32.881 1.00 0.00 H ATOM 44185 C112 PA 1090 107.859 52.925 32.758 1.00 0.00 C ATOM 44186 H12R PA 1090 107.784 52.962 33.847 1.00 0.00 H ATOM 44187 H12S PA 1090 107.132 52.164 32.469 1.00 0.00 H ATOM 44188 C111 PA 1090 107.512 54.304 32.090 1.00 0.00 C ATOM 44189 H11R PA 1090 107.863 54.064 31.084 1.00 0.00 H ATOM 44190 H11S PA 1090 108.234 55.094 32.305 1.00 0.00 H ATOM 44191 C110 PA 1090 106.027 54.623 32.184 1.00 0.00 C ATOM 44192 H10R PA 1090 105.563 53.729 31.763 1.00 0.00 H ATOM 44193 H10S PA 1090 105.773 55.324 31.385 1.00 0.00 H ATOM 44194 C19 PA 1090 105.536 55.033 33.510 1.00 0.00 C ATOM 44195 H9R PA 1090 106.011 55.984 33.761 1.00 0.00 H ATOM 44196 H9S PA 1090 105.792 54.312 34.289 1.00 0.00 H ATOM 44197 C18 PA 1090 103.963 55.163 33.491 1.00 0.00 C ATOM 44198 H8R PA 1090 103.534 55.558 34.414 1.00 0.00 H ATOM 44199 H8S PA 1090 103.493 54.187 33.630 1.00 0.00 H ATOM 44200 C17 PA 1090 103.253 55.840 32.388 1.00 0.00 C ATOM 44201 H7R PA 1090 102.211 55.660 32.662 1.00 0.00 H ATOM 44202 H7S PA 1090 103.371 55.433 31.382 1.00 0.00 H ATOM 44203 C16 PA 1090 103.384 57.316 32.383 1.00 0.00 C ATOM 44204 H6R PA 1090 103.425 57.606 33.435 1.00 0.00 H ATOM 44205 H6S PA 1090 102.370 57.663 32.173 1.00 0.00 H ATOM 44206 C15 PA 1090 104.462 58.016 31.480 1.00 0.00 C ATOM 44207 H5R PA 1090 105.495 57.781 31.748 1.00 0.00 H ATOM 44208 H5S PA 1090 104.266 59.070 31.685 1.00 0.00 H ATOM 44209 C14 PA 1090 104.260 57.749 29.993 1.00 0.00 C ATOM 44210 H4R PA 1090 103.191 57.663 29.786 1.00 0.00 H ATOM 44211 H4S PA 1090 104.622 56.751 29.740 1.00 0.00 H ATOM 44212 C13 PA 1090 104.833 58.816 28.981 1.00 0.00 C ATOM 44213 H3R PA 1090 105.674 58.493 28.364 1.00 0.00 H ATOM 44214 H3S PA 1090 105.188 59.753 29.416 1.00 0.00 H ATOM 44215 C12 PA 1090 103.599 59.368 28.144 1.00 0.00 C ATOM 44216 H2R PA 1090 103.758 60.376 27.755 1.00 0.00 H ATOM 44217 H2S PA 1090 102.685 59.413 28.739 1.00 0.00 H ATOM 44218 C11 PGR 1091 103.214 58.520 26.937 1.00 0.00 C ATOM 44219 O12 PGR 1091 103.958 57.876 26.239 1.00 0.00 O ATOM 44220 O11 PGR 1091 101.933 58.727 26.572 1.00 0.00 O ATOM 44221 C1 PGR 1091 101.328 57.867 25.495 1.00 0.00 C ATOM 44222 HR PGR 1091 102.018 57.590 24.694 1.00 0.00 H ATOM 44223 HS PGR 1091 100.438 58.349 25.082 1.00 0.00 H ATOM 44224 C2 PGR 1091 100.879 56.524 26.056 1.00 0.00 C ATOM 44225 HX PGR 1091 101.794 55.997 26.339 1.00 0.00 H ATOM 44226 C3 PGR 1091 100.231 55.651 24.920 1.00 0.00 C ATOM 44227 HA PGR 1091 99.575 54.874 25.321 1.00 0.00 H ATOM 44228 HB PGR 1091 101.038 55.152 24.377 1.00 0.00 H ATOM 44229 O31 PGR 1091 99.522 56.440 24.006 1.00 0.00 O ATOM 44230 P31 PGR 1091 99.259 56.064 22.477 1.00 0.00 P ATOM 44231 O32 PGR 1091 97.799 56.737 22.252 1.00 0.00 O ATOM 44232 C31 PGR 1091 97.659 58.145 22.640 1.00 0.00 C ATOM 44233 H1A PGR 1091 98.228 58.788 21.964 1.00 0.00 H ATOM 44234 H1B PGR 1091 97.780 58.491 23.669 1.00 0.00 H ATOM 44235 C32 PGR 1091 96.077 58.304 22.542 1.00 0.00 C ATOM 44236 H2A PGR 1091 95.605 57.550 23.176 1.00 0.00 H ATOM 44237 O35 PGR 1091 95.632 58.119 21.226 1.00 0.00 O ATOM 44238 HO5A PGR 1091 95.782 57.172 21.059 1.00 0.00 H ATOM 44239 C33 PGR 1091 95.764 59.742 22.986 1.00 0.00 C ATOM 44240 H3A PGR 1091 94.691 59.817 23.182 1.00 0.00 H ATOM 44241 H3B PGR 1091 96.308 60.065 23.878 1.00 0.00 H ATOM 44242 O33 PGR 1091 100.236 56.845 21.682 1.00 0.00 O ATOM 44243 O34 PGR 1091 99.228 54.605 22.350 1.00 0.00 O ATOM 44244 O21 PGR 1091 99.918 56.647 27.113 1.00 0.00 O ATOM 44245 C21 PGR 1091 100.275 56.628 28.406 1.00 0.00 C ATOM 44246 O22 PGR 1091 101.380 56.416 28.850 1.00 0.00 O ATOM 44247 O36 PGR 1091 96.047 60.611 21.838 1.00 0.00 O ATOM 44248 HO6A PGR 1091 95.328 60.510 21.188 1.00 0.00 H ATOM 44249 C12 OL 1092 99.062 56.697 29.261 1.00 0.00 C ATOM 44250 H2R OL 1092 98.403 57.500 28.922 1.00 0.00 H ATOM 44251 H2S OL 1092 98.462 55.787 29.195 1.00 0.00 H ATOM 44252 C13 OL 1092 99.399 56.982 30.729 1.00 0.00 C ATOM 44253 H3R OL 1092 100.122 56.224 31.036 1.00 0.00 H ATOM 44254 H3S OL 1092 99.748 58.003 30.900 1.00 0.00 H ATOM 44255 C14 OL 1092 98.199 56.931 31.677 1.00 0.00 C ATOM 44256 H4R OL 1092 97.944 55.888 31.872 1.00 0.00 H ATOM 44257 H4S OL 1092 98.495 57.427 32.604 1.00 0.00 H ATOM 44258 C15 OL 1092 97.017 57.836 31.321 1.00 0.00 C ATOM 44259 H5R OL 1092 97.347 58.867 31.183 1.00 0.00 H ATOM 44260 H5S OL 1092 96.591 57.545 30.359 1.00 0.00 H ATOM 44261 C16 OL 1092 95.982 57.776 32.427 1.00 0.00 C ATOM 44262 H6R OL 1092 95.237 58.475 32.041 1.00 0.00 H ATOM 44263 H6S OL 1092 95.509 56.792 32.452 1.00 0.00 H ATOM 44264 C17 OL 1092 96.257 58.043 33.880 1.00 0.00 C ATOM 44265 H7R OL 1092 96.857 57.196 34.219 1.00 0.00 H ATOM 44266 H7S OL 1092 96.867 58.941 34.006 1.00 0.00 H ATOM 44267 C18 OL 1092 95.004 58.229 34.763 1.00 0.00 C ATOM 44268 H8R OL 1092 94.357 59.025 34.389 1.00 0.00 H ATOM 44269 H8S OL 1092 94.367 57.351 34.633 1.00 0.00 H ATOM 44270 C19 OL 1092 95.249 58.426 36.168 1.00 0.00 C ATOM 44271 H9R OL 1092 95.193 59.396 36.656 1.00 0.00 H ATOM 44272 C110 OL 1092 95.507 57.393 37.040 1.00 0.00 C ATOM 44273 H10R OL 1092 95.661 57.664 38.081 1.00 0.00 H ATOM 44274 C111 OL 1092 95.757 55.967 36.666 1.00 0.00 C ATOM 44275 H11R OL 1092 95.962 55.844 35.600 1.00 0.00 H ATOM 44276 H11S OL 1092 96.729 55.644 37.043 1.00 0.00 H ATOM 44277 C112 OL 1092 94.779 54.796 37.011 1.00 0.00 C ATOM 44278 H12R OL 1092 93.952 54.685 36.306 1.00 0.00 H ATOM 44279 H12S OL 1092 95.295 53.871 36.746 1.00 0.00 H ATOM 44280 C113 OL 1092 94.245 54.696 38.419 1.00 0.00 C ATOM 44281 H13R OL 1092 94.980 54.876 39.206 1.00 0.00 H ATOM 44282 H13S OL 1092 93.405 55.390 38.490 1.00 0.00 H ATOM 44283 C114 OL 1092 93.718 53.290 38.780 1.00 0.00 C ATOM 44284 H14R OL 1092 92.971 52.914 38.078 1.00 0.00 H ATOM 44285 H14S OL 1092 94.521 52.570 38.614 1.00 0.00 H ATOM 44286 C115 OL 1092 93.141 53.245 40.172 1.00 0.00 C ATOM 44287 H15R OL 1092 92.996 54.243 40.591 1.00 0.00 H ATOM 44288 H15S OL 1092 92.211 52.690 40.031 1.00 0.00 H ATOM 44289 C116 OL 1092 93.866 52.520 41.286 1.00 0.00 C ATOM 44290 H16R OL 1092 94.152 51.525 40.939 1.00 0.00 H ATOM 44291 H16S OL 1092 94.863 52.908 41.505 1.00 0.00 H ATOM 44292 C117 OL 1092 93.010 52.227 42.517 1.00 0.00 C ATOM 44293 H17R OL 1092 92.394 53.099 42.746 1.00 0.00 H ATOM 44294 H17S OL 1092 92.314 51.419 42.282 1.00 0.00 H ATOM 44295 C118 OL 1092 93.814 51.728 43.685 1.00 0.00 C ATOM 44296 H18R OL 1092 93.086 51.279 44.365 1.00 0.00 H ATOM 44297 H18S OL 1092 94.311 52.547 44.209 1.00 0.00 H ATOM 44298 H18T OL 1092 94.413 50.879 43.349 1.00 0.00 H TER 44299 OL 1092 ATOM 44299 C116 PA 1093 63.310 90.740 45.289 1.00 0.00 C ATOM 44300 H16R PA 1093 64.040 91.503 45.013 1.00 0.00 H ATOM 44301 H16S PA 1093 63.596 90.259 46.227 1.00 0.00 H ATOM 44302 H16T PA 1093 62.529 91.479 45.478 1.00 0.00 H ATOM 44303 C115 PA 1093 62.978 89.737 44.218 1.00 0.00 C ATOM 44304 H15R PA 1093 62.118 89.184 44.602 1.00 0.00 H ATOM 44305 H15S PA 1093 63.768 88.985 44.157 1.00 0.00 H ATOM 44306 C114 PA 1093 62.619 90.446 42.865 1.00 0.00 C ATOM 44307 H14R PA 1093 63.437 91.138 42.651 1.00 0.00 H ATOM 44308 H14S PA 1093 61.679 90.985 42.996 1.00 0.00 H ATOM 44309 C113 PA 1093 62.366 89.529 41.631 1.00 0.00 C ATOM 44310 H13R PA 1093 61.943 90.148 40.837 1.00 0.00 H ATOM 44311 H13S PA 1093 61.622 88.735 41.722 1.00 0.00 H ATOM 44312 C112 PA 1093 63.580 88.711 41.171 1.00 0.00 C ATOM 44313 H12R PA 1093 63.287 88.230 40.235 1.00 0.00 H ATOM 44314 H12S PA 1093 63.755 87.883 41.861 1.00 0.00 H ATOM 44315 C111 PA 1093 64.898 89.462 40.926 1.00 0.00 C ATOM 44316 H11R PA 1093 65.705 88.736 40.810 1.00 0.00 H ATOM 44317 H11S PA 1093 65.144 89.928 41.882 1.00 0.00 H ATOM 44318 C110 PA 1093 64.919 90.297 39.666 1.00 0.00 C ATOM 44319 H10R PA 1093 65.877 90.817 39.733 1.00 0.00 H ATOM 44320 H10S PA 1093 64.115 91.023 39.798 1.00 0.00 H ATOM 44321 C19 PA 1093 64.702 89.458 38.358 1.00 0.00 C ATOM 44322 H9R PA 1093 63.850 88.827 38.617 1.00 0.00 H ATOM 44323 H9S PA 1093 65.568 88.799 38.266 1.00 0.00 H ATOM 44324 C18 PA 1093 64.465 90.274 37.098 1.00 0.00 C ATOM 44325 H8R PA 1093 65.316 90.839 36.710 1.00 0.00 H ATOM 44326 H8S PA 1093 63.668 90.981 37.340 1.00 0.00 H ATOM 44327 C17 PA 1093 63.958 89.454 35.923 1.00 0.00 C ATOM 44328 H7R PA 1093 62.928 89.092 35.971 1.00 0.00 H ATOM 44329 H7S PA 1093 64.489 88.507 35.802 1.00 0.00 H ATOM 44330 C16 PA 1093 64.252 90.207 34.547 1.00 0.00 C ATOM 44331 H6R PA 1093 65.285 90.562 34.563 1.00 0.00 H ATOM 44332 H6S PA 1093 63.629 91.102 34.591 1.00 0.00 H ATOM 44333 C15 PA 1093 64.052 89.293 33.363 1.00 0.00 C ATOM 44334 H5R PA 1093 63.026 88.991 33.587 1.00 0.00 H ATOM 44335 H5S PA 1093 64.716 88.429 33.291 1.00 0.00 H ATOM 44336 C14 PA 1093 64.215 90.051 32.010 1.00 0.00 C ATOM 44337 H4R PA 1093 65.235 90.077 31.621 1.00 0.00 H ATOM 44338 H4S PA 1093 63.807 91.055 32.139 1.00 0.00 H ATOM 44339 C13 PA 1093 63.476 89.241 30.941 1.00 0.00 C ATOM 44340 H3R PA 1093 62.397 89.391 30.862 1.00 0.00 H ATOM 44341 H3S PA 1093 63.530 88.163 31.104 1.00 0.00 H ATOM 44342 C12 PA 1093 63.953 89.595 29.577 1.00 0.00 C ATOM 44343 H2R PA 1093 65.042 89.519 29.549 1.00 0.00 H ATOM 44344 H2S PA 1093 63.584 90.529 29.150 1.00 0.00 H ATOM 44345 C11 PGR 1094 63.514 88.545 28.583 1.00 0.00 C ATOM 44346 O12 PGR 1094 62.421 88.669 28.056 1.00 0.00 O ATOM 44347 O11 PGR 1094 64.370 87.517 28.334 1.00 0.00 O ATOM 44348 C1 PGR 1094 64.087 86.511 27.356 1.00 0.00 C ATOM 44349 HR PGR 1094 63.663 87.077 26.522 1.00 0.00 H ATOM 44350 HS PGR 1094 63.270 85.837 27.625 1.00 0.00 H ATOM 44351 C2 PGR 1094 65.358 85.741 26.980 1.00 0.00 C ATOM 44352 HX PGR 1094 66.036 86.590 26.858 1.00 0.00 H ATOM 44353 C3 PGR 1094 65.115 84.949 25.682 1.00 0.00 C ATOM 44354 HA PGR 1094 64.694 85.596 24.908 1.00 0.00 H ATOM 44355 HB PGR 1094 64.408 84.147 25.911 1.00 0.00 H ATOM 44356 O31 PGR 1094 66.293 84.391 25.159 1.00 0.00 O ATOM 44357 P31 PGR 1094 66.289 83.288 24.051 1.00 0.00 P ATOM 44358 O32 PGR 1094 65.980 81.914 24.875 1.00 0.00 O ATOM 44359 C31 PGR 1094 66.765 81.694 25.968 1.00 0.00 C ATOM 44360 H1A PGR 1094 66.248 82.051 26.863 1.00 0.00 H ATOM 44361 H1B PGR 1094 67.712 82.220 25.826 1.00 0.00 H ATOM 44362 C32 PGR 1094 67.102 80.186 25.915 1.00 0.00 C ATOM 44363 H2A PGR 1094 67.452 79.875 24.928 1.00 0.00 H ATOM 44364 O35 PGR 1094 66.012 79.407 26.304 1.00 0.00 O ATOM 44365 HO5A PGR 1094 65.600 79.851 27.067 1.00 0.00 H ATOM 44366 C33 PGR 1094 68.212 79.955 26.861 1.00 0.00 C ATOM 44367 H3A PGR 1094 69.053 80.278 26.242 1.00 0.00 H ATOM 44368 H3B PGR 1094 68.273 80.629 27.719 1.00 0.00 H ATOM 44369 O33 PGR 1094 65.224 83.467 23.072 1.00 0.00 O ATOM 44370 O34 PGR 1094 67.706 83.277 23.638 1.00 0.00 O ATOM 44371 O21 PGR 1094 65.658 84.877 28.134 1.00 0.00 O ATOM 44372 C21 PGR 1094 66.850 84.372 28.350 1.00 0.00 C ATOM 44373 O22 PGR 1094 67.808 84.668 27.672 1.00 0.00 O ATOM 44374 O36 PGR 1094 68.214 78.607 27.340 1.00 0.00 O ATOM 44375 HO6A PGR 1094 69.035 78.506 27.854 1.00 0.00 H ATOM 44376 C12 OL 1095 66.850 83.462 29.512 1.00 0.00 C ATOM 44377 H2R OL 1095 66.264 83.968 30.283 1.00 0.00 H ATOM 44378 H2S OL 1095 66.316 82.538 29.281 1.00 0.00 H ATOM 44379 C13 OL 1095 68.294 83.202 30.006 1.00 0.00 C ATOM 44380 H3R OL 1095 68.787 82.723 29.157 1.00 0.00 H ATOM 44381 H3S OL 1095 68.847 84.116 30.236 1.00 0.00 H ATOM 44382 C14 OL 1095 68.499 82.288 31.208 1.00 0.00 C ATOM 44383 H4R OL 1095 68.118 81.365 30.766 1.00 0.00 H ATOM 44384 H4S OL 1095 69.582 82.220 31.336 1.00 0.00 H ATOM 44385 C15 OL 1095 67.728 82.792 32.409 1.00 0.00 C ATOM 44386 H5R OL 1095 68.059 83.826 32.520 1.00 0.00 H ATOM 44387 H5S OL 1095 66.690 82.805 32.070 1.00 0.00 H ATOM 44388 C16 OL 1095 67.955 81.880 33.625 1.00 0.00 C ATOM 44389 H6R OL 1095 68.875 81.296 33.554 1.00 0.00 H ATOM 44390 H6S OL 1095 67.960 82.473 34.542 1.00 0.00 H ATOM 44391 C17 OL 1095 66.868 80.915 33.686 1.00 0.00 C ATOM 44392 H7R OL 1095 65.969 81.436 34.023 1.00 0.00 H ATOM 44393 H7S OL 1095 66.586 80.637 32.669 1.00 0.00 H ATOM 44394 C18 OL 1095 67.034 79.611 34.497 1.00 0.00 C ATOM 44395 H8R OL 1095 67.888 79.013 34.174 1.00 0.00 H ATOM 44396 H8S OL 1095 67.243 79.817 35.549 1.00 0.00 H ATOM 44397 C19 OL 1095 65.847 78.720 34.497 1.00 0.00 C ATOM 44398 H9R OL 1095 65.681 78.241 33.536 1.00 0.00 H ATOM 44399 C110 OL 1095 65.103 78.355 35.542 1.00 0.00 C ATOM 44400 H10R OL 1095 64.338 77.612 35.336 1.00 0.00 H ATOM 44401 C111 OL 1095 65.279 78.893 36.922 1.00 0.00 C ATOM 44402 H11R OL 1095 66.076 78.327 37.408 1.00 0.00 H ATOM 44403 H11S OL 1095 65.509 79.961 36.918 1.00 0.00 H ATOM 44404 C112 OL 1095 64.031 78.767 37.876 1.00 0.00 C ATOM 44405 H12R OL 1095 64.273 79.375 38.750 1.00 0.00 H ATOM 44406 H12S OL 1095 63.147 79.221 37.424 1.00 0.00 H ATOM 44407 C113 OL 1095 63.590 77.361 38.307 1.00 0.00 C ATOM 44408 H13R OL 1095 63.045 76.995 37.434 1.00 0.00 H ATOM 44409 H13S OL 1095 64.477 76.755 38.505 1.00 0.00 H ATOM 44410 C114 OL 1095 62.667 77.450 39.451 1.00 0.00 C ATOM 44411 H14R OL 1095 63.294 77.849 40.252 1.00 0.00 H ATOM 44412 H14S OL 1095 61.706 77.940 39.279 1.00 0.00 H ATOM 44413 C115 OL 1095 62.135 76.128 39.977 1.00 0.00 C ATOM 44414 H15R OL 1095 61.774 75.604 39.090 1.00 0.00 H ATOM 44415 H15S OL 1095 62.870 75.403 40.333 1.00 0.00 H ATOM 44416 C116 OL 1095 61.096 76.212 41.043 1.00 0.00 C ATOM 44417 H16R OL 1095 60.293 76.914 40.809 1.00 0.00 H ATOM 44418 H16S OL 1095 60.626 75.228 41.104 1.00 0.00 H ATOM 44419 C117 OL 1095 61.587 76.664 42.421 1.00 0.00 C ATOM 44420 H17R OL 1095 61.692 77.736 42.244 1.00 0.00 H ATOM 44421 H17S OL 1095 60.741 76.666 43.111 1.00 0.00 H ATOM 44422 C118 OL 1095 62.819 75.980 42.965 1.00 0.00 C ATOM 44423 H18R OL 1095 63.649 76.251 42.309 1.00 0.00 H ATOM 44424 H18S OL 1095 62.752 74.904 43.144 1.00 0.00 H ATOM 44425 H18T OL 1095 62.988 76.519 43.899 1.00 0.00 H TER 44426 OL 1095 ATOM 44426 C116 PA 1096 128.016 38.860 39.493 1.00 0.00 C ATOM 44427 H16R PA 1096 128.708 39.335 38.794 1.00 0.00 H ATOM 44428 H16S PA 1096 127.928 39.469 40.395 1.00 0.00 H ATOM 44429 H16T PA 1096 127.067 38.753 38.963 1.00 0.00 H ATOM 44430 C115 PA 1096 128.482 37.479 39.850 1.00 0.00 C ATOM 44431 H15R PA 1096 127.704 36.998 40.446 1.00 0.00 H ATOM 44432 H15S PA 1096 129.382 37.518 40.466 1.00 0.00 H ATOM 44433 C114 PA 1096 128.963 36.632 38.659 1.00 0.00 C ATOM 44434 H14R PA 1096 130.028 36.407 38.745 1.00 0.00 H ATOM 44435 H14S PA 1096 129.009 37.019 37.639 1.00 0.00 H ATOM 44436 C113 PA 1096 128.034 35.403 38.544 1.00 0.00 C ATOM 44437 H13R PA 1096 127.096 35.821 38.173 1.00 0.00 H ATOM 44438 H13S PA 1096 128.020 34.912 39.519 1.00 0.00 H ATOM 44439 C112 PA 1096 128.556 34.300 37.615 1.00 0.00 C ATOM 44440 H12R PA 1096 129.634 34.178 37.743 1.00 0.00 H ATOM 44441 H12S PA 1096 128.553 34.473 36.537 1.00 0.00 H ATOM 44442 C111 PA 1096 127.900 32.901 37.735 1.00 0.00 C ATOM 44443 H11R PA 1096 127.726 32.577 38.763 1.00 0.00 H ATOM 44444 H11S PA 1096 128.670 32.181 37.450 1.00 0.00 H ATOM 44445 C110 PA 1096 126.709 32.551 36.786 1.00 0.00 C ATOM 44446 H10R PA 1096 126.540 31.472 36.786 1.00 0.00 H ATOM 44447 H10S PA 1096 127.063 32.846 35.796 1.00 0.00 H ATOM 44448 C19 PA 1096 125.404 33.342 36.982 1.00 0.00 C ATOM 44449 H9R PA 1096 125.668 34.360 37.275 1.00 0.00 H ATOM 44450 H9S PA 1096 125.009 33.057 37.960 1.00 0.00 H ATOM 44451 C18 PA 1096 124.317 33.278 35.826 1.00 0.00 C ATOM 44452 H8R PA 1096 124.084 32.223 35.666 1.00 0.00 H ATOM 44453 H8S PA 1096 124.866 33.544 34.920 1.00 0.00 H ATOM 44454 C17 PA 1096 123.038 34.150 36.141 1.00 0.00 C ATOM 44455 H7R PA 1096 123.318 35.198 36.267 1.00 0.00 H ATOM 44456 H7S PA 1096 122.570 33.864 37.085 1.00 0.00 H ATOM 44457 C16 PA 1096 121.867 34.066 35.108 1.00 0.00 C ATOM 44458 H6R PA 1096 120.968 34.404 35.627 1.00 0.00 H ATOM 44459 H6S PA 1096 121.803 33.016 34.817 1.00 0.00 H ATOM 44460 C15 PA 1096 122.323 34.907 33.793 1.00 0.00 C ATOM 44461 H5R PA 1096 123.308 34.627 33.415 1.00 0.00 H ATOM 44462 H5S PA 1096 122.454 35.955 34.068 1.00 0.00 H ATOM 44463 C14 PA 1096 121.305 34.946 32.706 1.00 0.00 C ATOM 44464 H4R PA 1096 120.475 35.565 33.053 1.00 0.00 H ATOM 44465 H4S PA 1096 121.018 33.922 32.454 1.00 0.00 H ATOM 44466 C13 PA 1096 122.017 35.472 31.478 1.00 0.00 C ATOM 44467 H3R PA 1096 122.885 34.917 31.116 1.00 0.00 H ATOM 44468 H3S PA 1096 122.377 36.494 31.615 1.00 0.00 H ATOM 44469 C12 PA 1096 121.197 35.621 30.262 1.00 0.00 C ATOM 44470 H2R PA 1096 121.784 35.994 29.420 1.00 0.00 H ATOM 44471 H2S PA 1096 120.473 36.409 30.479 1.00 0.00 H ATOM 44472 C11 PGR 1097 120.358 34.421 29.809 1.00 0.00 C ATOM 44473 O12 PGR 1097 120.786 33.531 29.100 1.00 0.00 O ATOM 44474 O11 PGR 1097 119.204 34.400 30.468 1.00 0.00 O ATOM 44475 C1 PGR 1097 118.297 33.338 30.300 1.00 0.00 C ATOM 44476 HR PGR 1097 117.871 32.913 31.213 1.00 0.00 H ATOM 44477 HS PGR 1097 118.722 32.456 29.814 1.00 0.00 H ATOM 44478 C2 PGR 1097 117.152 33.782 29.312 1.00 0.00 C ATOM 44479 HX PGR 1097 116.582 32.923 28.949 1.00 0.00 H ATOM 44480 C3 PGR 1097 117.734 34.457 27.934 1.00 0.00 C ATOM 44481 HA PGR 1097 118.420 33.788 27.408 1.00 0.00 H ATOM 44482 HB PGR 1097 118.248 35.389 28.184 1.00 0.00 H ATOM 44483 O31 PGR 1097 116.683 34.670 26.997 1.00 0.00 O ATOM 44484 P31 PGR 1097 116.993 34.595 25.353 1.00 0.00 P ATOM 44485 O32 PGR 1097 117.494 36.062 25.011 1.00 0.00 O ATOM 44486 C31 PGR 1097 118.257 36.264 23.812 1.00 0.00 C ATOM 44487 H1A PGR 1097 118.998 35.478 23.641 1.00 0.00 H ATOM 44488 H1B PGR 1097 118.845 37.174 23.951 1.00 0.00 H ATOM 44489 C32 PGR 1097 117.470 36.437 22.515 1.00 0.00 C ATOM 44490 H2A PGR 1097 116.778 37.265 22.687 1.00 0.00 H ATOM 44491 O35 PGR 1097 116.748 35.297 22.165 1.00 0.00 O ATOM 44492 HO5A PGR 1097 116.265 34.989 22.952 1.00 0.00 H ATOM 44493 C33 PGR 1097 118.357 36.821 21.322 1.00 0.00 C ATOM 44494 H3A PGR 1097 118.710 37.847 21.451 1.00 0.00 H ATOM 44495 H3B PGR 1097 119.278 36.244 21.443 1.00 0.00 H ATOM 44496 O33 PGR 1097 118.118 33.715 25.062 1.00 0.00 O ATOM 44497 O34 PGR 1097 115.764 34.337 24.588 1.00 0.00 O ATOM 44498 O21 PGR 1097 116.329 34.734 29.932 1.00 0.00 O ATOM 44499 C21 PGR 1097 115.106 35.029 29.472 1.00 0.00 C ATOM 44500 O22 PGR 1097 114.483 34.422 28.656 1.00 0.00 O ATOM 44501 O36 PGR 1097 117.679 36.599 20.060 1.00 0.00 O ATOM 44502 HO6A PGR 1097 116.938 35.972 20.140 1.00 0.00 H ATOM 44503 C12 OL 1098 114.472 36.066 30.391 1.00 0.00 C ATOM 44504 H2R OL 1098 114.649 35.824 31.441 1.00 0.00 H ATOM 44505 H2S OL 1098 115.091 36.964 30.362 1.00 0.00 H ATOM 44506 C13 OL 1098 113.098 36.468 29.805 1.00 0.00 C ATOM 44507 H3R OL 1098 113.042 36.766 28.756 1.00 0.00 H ATOM 44508 H3S OL 1098 112.436 35.600 29.849 1.00 0.00 H ATOM 44509 C14 OL 1098 112.491 37.630 30.460 1.00 0.00 C ATOM 44510 H4R OL 1098 113.125 38.519 30.492 1.00 0.00 H ATOM 44511 H4S OL 1098 111.578 37.844 29.900 1.00 0.00 H ATOM 44512 C15 OL 1098 111.915 37.373 31.824 1.00 0.00 C ATOM 44513 H5R OL 1098 111.159 36.585 31.858 1.00 0.00 H ATOM 44514 H5S OL 1098 112.650 37.083 32.577 1.00 0.00 H ATOM 44515 C16 OL 1098 111.321 38.713 32.238 1.00 0.00 C ATOM 44516 H6R OL 1098 112.076 39.490 32.372 1.00 0.00 H ATOM 44517 H6S OL 1098 110.654 38.968 31.411 1.00 0.00 H ATOM 44518 C17 OL 1098 110.471 38.796 33.495 1.00 0.00 C ATOM 44519 H7R OL 1098 109.700 38.024 33.467 1.00 0.00 H ATOM 44520 H7S OL 1098 111.072 38.442 34.335 1.00 0.00 H ATOM 44521 C18 OL 1098 109.839 40.167 33.623 1.00 0.00 C ATOM 44522 H8R OL 1098 110.666 40.824 33.344 1.00 0.00 H ATOM 44523 H8S OL 1098 108.952 40.281 32.996 1.00 0.00 H ATOM 44524 C19 OL 1098 109.565 40.626 35.059 1.00 0.00 C ATOM 44525 H9R OL 1098 110.267 41.305 35.536 1.00 0.00 H ATOM 44526 C110 OL 1098 108.538 40.348 35.844 1.00 0.00 C ATOM 44527 H10R OL 1098 108.572 40.694 36.874 1.00 0.00 H ATOM 44528 C111 OL 1098 107.418 39.383 35.653 1.00 0.00 C ATOM 44529 H11R OL 1098 106.467 39.882 35.458 1.00 0.00 H ATOM 44530 H11S OL 1098 107.653 38.929 34.689 1.00 0.00 H ATOM 44531 C112 OL 1098 107.259 38.359 36.772 1.00 0.00 C ATOM 44532 H12R OL 1098 107.206 38.979 37.669 1.00 0.00 H ATOM 44533 H12S OL 1098 106.251 37.951 36.670 1.00 0.00 H ATOM 44534 C113 OL 1098 108.361 37.317 36.969 1.00 0.00 C ATOM 44535 H13R OL 1098 109.298 37.873 36.895 1.00 0.00 H ATOM 44536 H13S OL 1098 108.304 36.825 37.942 1.00 0.00 H ATOM 44537 C114 OL 1098 108.380 36.296 35.826 1.00 0.00 C ATOM 44538 H14R OL 1098 107.450 35.724 35.830 1.00 0.00 H ATOM 44539 H14S OL 1098 108.667 36.580 34.811 1.00 0.00 H ATOM 44540 C115 OL 1098 109.414 35.185 36.155 1.00 0.00 C ATOM 44541 H15R OL 1098 109.097 34.609 37.027 1.00 0.00 H ATOM 44542 H15S OL 1098 109.381 34.496 35.309 1.00 0.00 H ATOM 44543 C116 OL 1098 110.845 35.728 36.207 1.00 0.00 C ATOM 44544 H16R OL 1098 110.998 36.278 35.276 1.00 0.00 H ATOM 44545 H16S OL 1098 110.927 36.471 37.004 1.00 0.00 H ATOM 44546 C117 OL 1098 111.862 34.586 36.387 1.00 0.00 C ATOM 44547 H17R OL 1098 111.741 33.944 37.262 1.00 0.00 H ATOM 44548 H17S OL 1098 111.673 33.891 35.566 1.00 0.00 H ATOM 44549 C118 OL 1098 113.363 35.028 36.422 1.00 0.00 C ATOM 44550 H18R OL 1098 114.070 34.268 36.083 1.00 0.00 H ATOM 44551 H18S OL 1098 113.729 35.355 37.398 1.00 0.00 H ATOM 44552 H18T OL 1098 113.535 35.980 35.917 1.00 0.00 H TER 44553 OL 1098 ATOM 44553 C116 PA 1099 24.898 81.449 37.167 1.00 0.00 C ATOM 44554 H16R PA 1099 25.311 82.136 36.425 1.00 0.00 H ATOM 44555 H16S PA 1099 25.581 80.641 37.436 1.00 0.00 H ATOM 44556 H16T PA 1099 24.570 81.984 38.062 1.00 0.00 H ATOM 44557 C115 PA 1099 23.722 80.719 36.538 1.00 0.00 C ATOM 44558 H15R PA 1099 23.170 81.497 36.006 1.00 0.00 H ATOM 44559 H15S PA 1099 22.967 80.411 37.264 1.00 0.00 H ATOM 44560 C114 PA 1099 24.195 79.497 35.707 1.00 0.00 C ATOM 44561 H14R PA 1099 23.406 78.802 35.412 1.00 0.00 H ATOM 44562 H14S PA 1099 24.787 78.925 36.425 1.00 0.00 H ATOM 44563 C113 PA 1099 25.178 79.836 34.530 1.00 0.00 C ATOM 44564 H13R PA 1099 26.185 80.082 34.872 1.00 0.00 H ATOM 44565 H13S PA 1099 24.951 80.784 34.039 1.00 0.00 H ATOM 44566 C112 PA 1099 25.357 78.719 33.501 1.00 0.00 C ATOM 44567 H12R PA 1099 26.122 79.027 32.786 1.00 0.00 H ATOM 44568 H12S PA 1099 24.478 78.638 32.858 1.00 0.00 H ATOM 44569 C111 PA 1099 25.543 77.271 34.089 1.00 0.00 C ATOM 44570 H11R PA 1099 24.608 77.138 34.637 1.00 0.00 H ATOM 44571 H11S PA 1099 26.342 77.281 34.834 1.00 0.00 H ATOM 44572 C110 PA 1099 25.925 76.223 33.085 1.00 0.00 C ATOM 44573 H10R PA 1099 26.782 76.519 32.474 1.00 0.00 H ATOM 44574 H10S PA 1099 25.161 76.212 32.305 1.00 0.00 H ATOM 44575 C19 PA 1099 25.978 74.830 33.685 1.00 0.00 C ATOM 44576 H9R PA 1099 26.639 74.835 34.554 1.00 0.00 H ATOM 44577 H9S PA 1099 26.503 74.174 32.988 1.00 0.00 H ATOM 44578 C18 PA 1099 24.592 74.189 33.924 1.00 0.00 C ATOM 44579 H8R PA 1099 24.045 74.983 34.437 1.00 0.00 H ATOM 44580 H8S PA 1099 24.753 73.410 34.673 1.00 0.00 H ATOM 44581 C17 PA 1099 23.854 73.475 32.760 1.00 0.00 C ATOM 44582 H7R PA 1099 23.116 74.074 32.222 1.00 0.00 H ATOM 44583 H7S PA 1099 23.191 72.822 33.332 1.00 0.00 H ATOM 44584 C16 PA 1099 24.744 72.714 31.739 1.00 0.00 C ATOM 44585 H6R PA 1099 25.549 72.181 32.249 1.00 0.00 H ATOM 44586 H6S PA 1099 25.297 73.400 31.095 1.00 0.00 H ATOM 44587 C15 PA 1099 24.088 71.672 30.855 1.00 0.00 C ATOM 44588 H5R PA 1099 23.293 72.158 30.285 1.00 0.00 H ATOM 44589 H5S PA 1099 23.491 71.009 31.485 1.00 0.00 H ATOM 44590 C14 PA 1099 24.995 70.847 29.835 1.00 0.00 C ATOM 44591 H4R PA 1099 25.831 70.351 30.333 1.00 0.00 H ATOM 44592 H4S PA 1099 25.453 71.527 29.115 1.00 0.00 H ATOM 44593 C13 PA 1099 24.177 69.797 29.009 1.00 0.00 C ATOM 44594 H3R PA 1099 23.200 70.208 28.748 1.00 0.00 H ATOM 44595 H3S PA 1099 23.755 69.098 29.734 1.00 0.00 H ATOM 44596 C12 PA 1099 24.815 69.060 27.791 1.00 0.00 C ATOM 44597 H2R PA 1099 23.931 68.597 27.348 1.00 0.00 H ATOM 44598 H2S PA 1099 25.570 68.294 27.980 1.00 0.00 H ATOM 44599 C11 PC 1100 25.426 69.902 26.781 1.00 0.00 C ATOM 44600 O12 PC 1100 26.547 69.880 26.473 1.00 0.00 O ATOM 44601 O11 PC 1100 24.584 70.849 26.394 1.00 0.00 O ATOM 44602 C1 PC 1100 25.132 71.939 25.605 1.00 0.00 C ATOM 44603 HR PC 1100 25.835 71.557 24.860 1.00 0.00 H ATOM 44604 HS PC 1100 25.697 72.567 26.298 1.00 0.00 H ATOM 44605 C2 PC 1100 23.926 72.809 25.074 1.00 0.00 C ATOM 44606 HX PC 1100 23.003 72.234 24.961 1.00 0.00 H ATOM 44607 C3 PC 1100 24.195 73.380 23.702 1.00 0.00 C ATOM 44608 HA PC 1100 24.666 72.650 23.039 1.00 0.00 H ATOM 44609 HB PC 1100 24.905 74.209 23.770 1.00 0.00 H ATOM 44610 O31 PC 1100 22.935 73.877 23.151 1.00 0.00 O ATOM 44611 P31 PC 1100 22.897 74.682 21.735 1.00 0.00 P ATOM 44612 O32 PC 1100 22.666 76.181 22.291 1.00 0.00 O ATOM 44613 C31 PC 1100 21.338 76.496 22.819 1.00 0.00 C ATOM 44614 H1A PC 1100 21.135 75.888 23.705 1.00 0.00 H ATOM 44615 H1B PC 1100 20.577 76.242 22.078 1.00 0.00 H ATOM 44616 C32 PC 1100 21.230 78.042 23.235 1.00 0.00 C ATOM 44617 H2A PC 1100 21.529 78.609 22.352 1.00 0.00 H ATOM 44618 H2B PC 1100 22.005 78.148 23.995 1.00 0.00 H ATOM 44619 N31 PC 1100 19.970 78.532 23.722 1.00 0.00 N ATOM 44620 C33 PC 1100 18.939 78.478 22.625 1.00 0.00 C ATOM 44621 H3A PC 1100 18.071 79.060 22.940 1.00 0.00 H ATOM 44622 H3B PC 1100 18.656 77.425 22.595 1.00 0.00 H ATOM 44623 H3C PC 1100 19.396 78.750 21.673 1.00 0.00 H ATOM 44624 C34 PC 1100 19.443 77.838 24.935 1.00 0.00 C ATOM 44625 H4A PC 1100 18.653 78.369 25.467 1.00 0.00 H ATOM 44626 H4B PC 1100 20.265 77.629 25.622 1.00 0.00 H ATOM 44627 H4C PC 1100 19.040 76.865 24.652 1.00 0.00 H ATOM 44628 C35 PC 1100 20.168 79.918 24.128 1.00 0.00 C ATOM 44629 H5A PC 1100 19.177 80.347 24.285 1.00 0.00 H ATOM 44630 H5B PC 1100 20.673 80.432 23.309 1.00 0.00 H ATOM 44631 H5C PC 1100 20.816 80.023 24.999 1.00 0.00 H ATOM 44632 O33 PC 1100 24.241 74.675 21.157 1.00 0.00 O ATOM 44633 O34 PC 1100 21.673 74.317 21.004 1.00 0.00 O ATOM 44634 O21 PC 1100 23.657 73.900 26.017 1.00 0.00 O ATOM 44635 C21 PC 1100 22.367 74.400 26.137 1.00 0.00 C ATOM 44636 O22 PC 1100 21.456 74.128 25.391 1.00 0.00 O ATOM 44637 C12 OL 1101 22.257 75.179 27.407 1.00 0.00 C ATOM 44638 H2R OL 1101 22.671 74.483 28.140 1.00 0.00 H ATOM 44639 H2S OL 1101 22.949 76.021 27.481 1.00 0.00 H ATOM 44640 C13 OL 1101 20.827 75.633 27.730 1.00 0.00 C ATOM 44641 H3R OL 1101 20.384 76.027 26.812 1.00 0.00 H ATOM 44642 H3S OL 1101 20.333 74.716 28.055 1.00 0.00 H ATOM 44643 C14 OL 1101 20.866 76.632 28.793 1.00 0.00 C ATOM 44644 H4R OL 1101 21.460 77.505 28.512 1.00 0.00 H ATOM 44645 H4S OL 1101 19.897 77.084 29.013 1.00 0.00 H ATOM 44646 C15 OL 1101 21.199 76.060 30.152 1.00 0.00 C ATOM 44647 H5R OL 1101 20.633 75.156 30.385 1.00 0.00 H ATOM 44648 H5S OL 1101 22.227 75.705 30.052 1.00 0.00 H ATOM 44649 C16 OL 1101 21.116 77.091 31.256 1.00 0.00 C ATOM 44650 H6R OL 1101 21.660 78.013 31.042 1.00 0.00 H ATOM 44651 H6S OL 1101 20.084 77.445 31.308 1.00 0.00 H ATOM 44652 C17 OL 1101 21.610 76.607 32.741 1.00 0.00 C ATOM 44653 H7R OL 1101 21.064 75.679 32.925 1.00 0.00 H ATOM 44654 H7S OL 1101 22.653 76.340 32.561 1.00 0.00 H ATOM 44655 C18 OL 1101 21.469 77.615 33.851 1.00 0.00 C ATOM 44656 H8R OL 1101 21.983 77.272 34.751 1.00 0.00 H ATOM 44657 H8S OL 1101 21.984 78.495 33.462 1.00 0.00 H ATOM 44658 C19 OL 1101 20.131 77.956 34.271 1.00 0.00 C ATOM 44659 H9R OL 1101 19.457 77.842 33.425 1.00 0.00 H ATOM 44660 C110 OL 1101 19.611 78.290 35.470 1.00 0.00 C ATOM 44661 H10R OL 1101 18.551 78.429 35.669 1.00 0.00 H ATOM 44662 C111 OL 1101 20.458 78.344 36.689 1.00 0.00 C ATOM 44663 H11R OL 1101 21.230 77.572 36.658 1.00 0.00 H ATOM 44664 H11S OL 1101 20.908 79.328 36.837 1.00 0.00 H ATOM 44665 C112 OL 1101 19.573 78.178 37.898 1.00 0.00 C ATOM 44666 H12R OL 1101 19.218 79.195 38.076 1.00 0.00 H ATOM 44667 H12S OL 1101 18.694 77.580 37.649 1.00 0.00 H ATOM 44668 C113 OL 1101 20.444 77.674 39.106 1.00 0.00 C ATOM 44669 H13R OL 1101 20.728 76.624 38.998 1.00 0.00 H ATOM 44670 H13S OL 1101 21.405 78.159 38.919 1.00 0.00 H ATOM 44671 C114 OL 1101 19.923 78.005 40.491 1.00 0.00 C ATOM 44672 H14R OL 1101 20.180 79.047 40.695 1.00 0.00 H ATOM 44673 H14S OL 1101 18.832 77.971 40.500 1.00 0.00 H ATOM 44674 C115 OL 1101 20.410 77.121 41.631 1.00 0.00 C ATOM 44675 H15R OL 1101 20.063 76.107 41.425 1.00 0.00 H ATOM 44676 H15S OL 1101 21.499 77.059 41.667 1.00 0.00 H ATOM 44677 C116 OL 1101 19.958 77.581 43.023 1.00 0.00 C ATOM 44678 H16R OL 1101 20.285 78.614 43.154 1.00 0.00 H ATOM 44679 H16S OL 1101 18.868 77.631 43.046 1.00 0.00 H ATOM 44680 C117 OL 1101 20.378 76.673 44.249 1.00 0.00 C ATOM 44681 H17R OL 1101 20.129 77.122 45.213 1.00 0.00 H ATOM 44682 H17S OL 1101 19.857 75.716 44.191 1.00 0.00 H ATOM 44683 C118 OL 1101 21.876 76.357 44.297 1.00 0.00 C ATOM 44684 H18R OL 1101 22.489 77.243 44.471 1.00 0.00 H ATOM 44685 H18S OL 1101 22.224 75.861 43.388 1.00 0.00 H ATOM 44686 H18T OL 1101 22.133 75.634 45.074 1.00 0.00 H TER 44687 OL 1101 ATOM 44687 C116 PA 1102 69.520 92.647 40.374 1.00 0.00 C ATOM 44688 H16R PA 1102 70.094 92.599 41.301 1.00 0.00 H ATOM 44689 H16S PA 1102 68.670 91.974 40.508 1.00 0.00 H ATOM 44690 H16T PA 1102 69.000 93.597 40.233 1.00 0.00 H ATOM 44691 C115 PA 1102 70.160 92.232 39.145 1.00 0.00 C ATOM 44692 H15R PA 1102 70.941 92.982 38.998 1.00 0.00 H ATOM 44693 H15S PA 1102 69.502 92.351 38.281 1.00 0.00 H ATOM 44694 C114 PA 1102 70.760 90.844 39.064 1.00 0.00 C ATOM 44695 H14R PA 1102 70.075 90.032 39.317 1.00 0.00 H ATOM 44696 H14S PA 1102 71.314 90.698 39.993 1.00 0.00 H ATOM 44697 C113 PA 1102 71.534 90.487 37.804 1.00 0.00 C ATOM 44698 H13R PA 1102 72.160 91.300 37.428 1.00 0.00 H ATOM 44699 H13S PA 1102 70.848 90.154 37.022 1.00 0.00 H ATOM 44700 C112 PA 1102 72.461 89.317 38.136 1.00 0.00 C ATOM 44701 H12R PA 1102 71.877 88.493 38.551 1.00 0.00 H ATOM 44702 H12S PA 1102 73.162 89.607 38.921 1.00 0.00 H ATOM 44703 C111 PA 1102 73.180 88.782 36.895 1.00 0.00 C ATOM 44704 H11R PA 1102 73.554 89.558 36.223 1.00 0.00 H ATOM 44705 H11S PA 1102 72.582 88.128 36.258 1.00 0.00 H ATOM 44706 C110 PA 1102 74.368 87.913 37.245 1.00 0.00 C ATOM 44707 H10R PA 1102 73.880 87.057 37.716 1.00 0.00 H ATOM 44708 H10S PA 1102 74.933 88.433 38.021 1.00 0.00 H ATOM 44709 C19 PA 1102 75.242 87.273 36.083 1.00 0.00 C ATOM 44710 H9R PA 1102 75.773 88.083 35.579 1.00 0.00 H ATOM 44711 H9S PA 1102 74.507 86.909 35.362 1.00 0.00 H ATOM 44712 C18 PA 1102 76.184 86.077 36.506 1.00 0.00 C ATOM 44713 H8R PA 1102 75.670 85.385 37.176 1.00 0.00 H ATOM 44714 H8S PA 1102 77.018 86.528 37.048 1.00 0.00 H ATOM 44715 C17 PA 1102 76.759 85.463 35.299 1.00 0.00 C ATOM 44716 H7R PA 1102 77.410 86.204 34.830 1.00 0.00 H ATOM 44717 H7S PA 1102 75.963 85.273 34.576 1.00 0.00 H ATOM 44718 C16 PA 1102 77.572 84.209 35.527 1.00 0.00 C ATOM 44719 H6R PA 1102 77.118 83.561 36.280 1.00 0.00 H ATOM 44720 H6S PA 1102 78.491 84.516 36.031 1.00 0.00 H ATOM 44721 C15 PA 1102 77.918 83.327 34.269 1.00 0.00 C ATOM 44722 H5R PA 1102 77.050 82.711 34.025 1.00 0.00 H ATOM 44723 H5S PA 1102 78.593 82.519 34.559 1.00 0.00 H ATOM 44724 C14 PA 1102 78.471 84.229 33.082 1.00 0.00 C ATOM 44725 H4R PA 1102 79.324 84.804 33.451 1.00 0.00 H ATOM 44726 H4S PA 1102 77.679 84.919 32.783 1.00 0.00 H ATOM 44727 C13 PA 1102 79.109 83.364 32.017 1.00 0.00 C ATOM 44728 H3R PA 1102 78.485 82.882 31.262 1.00 0.00 H ATOM 44729 H3S PA 1102 79.558 82.485 32.484 1.00 0.00 H ATOM 44730 C12 PA 1102 80.264 84.051 31.294 1.00 0.00 C ATOM 44731 H2R PA 1102 81.088 84.138 32.005 1.00 0.00 H ATOM 44732 H2S PA 1102 80.029 85.097 31.088 1.00 0.00 H ATOM 44733 C11 PGR 1103 80.786 83.427 30.045 1.00 0.00 C ATOM 44734 O12 PGR 1103 81.667 83.988 29.393 1.00 0.00 O ATOM 44735 O11 PGR 1103 80.366 82.182 29.881 1.00 0.00 O ATOM 44736 C1 PGR 1103 80.584 81.493 28.604 1.00 0.00 C ATOM 44737 HR PGR 1103 80.454 82.311 27.892 1.00 0.00 H ATOM 44738 HS PGR 1103 79.923 80.653 28.376 1.00 0.00 H ATOM 44739 C2 PGR 1103 81.898 80.770 28.541 1.00 0.00 C ATOM 44740 HX PGR 1103 82.688 81.366 29.004 1.00 0.00 H ATOM 44741 C3 PGR 1103 82.308 80.333 27.117 1.00 0.00 C ATOM 44742 HA PGR 1103 83.158 79.652 27.204 1.00 0.00 H ATOM 44743 HB PGR 1103 82.653 81.188 26.530 1.00 0.00 H ATOM 44744 O31 PGR 1103 81.316 79.650 26.437 1.00 0.00 O ATOM 44745 P31 PGR 1103 81.481 79.327 24.838 1.00 0.00 P ATOM 44746 O32 PGR 1103 81.202 80.717 24.131 1.00 0.00 O ATOM 44747 C31 PGR 1103 80.083 81.551 24.385 1.00 0.00 C ATOM 44748 H1A PGR 1103 79.872 81.590 25.457 1.00 0.00 H ATOM 44749 H1B PGR 1103 79.160 81.194 23.922 1.00 0.00 H ATOM 44750 C32 PGR 1103 80.404 82.966 23.895 1.00 0.00 C ATOM 44751 H2A PGR 1103 79.530 83.620 23.938 1.00 0.00 H ATOM 44752 O35 PGR 1103 80.735 82.809 22.465 1.00 0.00 O ATOM 44753 HO5A PGR 1103 81.565 82.314 22.345 1.00 0.00 H ATOM 44754 C33 PGR 1103 81.635 83.731 24.571 1.00 0.00 C ATOM 44755 H3A PGR 1103 81.411 83.992 25.609 1.00 0.00 H ATOM 44756 H3B PGR 1103 82.557 83.154 24.680 1.00 0.00 H ATOM 44757 O33 PGR 1103 82.899 78.993 24.535 1.00 0.00 O ATOM 44758 O34 PGR 1103 80.331 78.342 24.482 1.00 0.00 O ATOM 44759 O21 PGR 1103 81.763 79.597 29.317 1.00 0.00 O ATOM 44760 C21 PGR 1103 82.855 78.943 29.861 1.00 0.00 C ATOM 44761 O22 PGR 1103 84.062 79.221 29.641 1.00 0.00 O ATOM 44762 O36 PGR 1103 81.913 84.958 23.952 1.00 0.00 O ATOM 44763 HO6A PGR 1103 82.861 85.117 24.107 1.00 0.00 H ATOM 44764 C12 OL 1104 82.531 77.866 30.852 1.00 0.00 C ATOM 44765 H2R OL 1104 81.669 77.273 30.538 1.00 0.00 H ATOM 44766 H2S OL 1104 83.294 77.095 30.980 1.00 0.00 H ATOM 44767 C13 OL 1104 82.167 78.577 32.227 1.00 0.00 C ATOM 44768 H3R OL 1104 82.923 79.322 32.486 1.00 0.00 H ATOM 44769 H3S OL 1104 81.273 79.187 32.081 1.00 0.00 H ATOM 44770 C14 OL 1104 82.038 77.598 33.381 1.00 0.00 C ATOM 44771 H4R OL 1104 81.488 76.741 32.988 1.00 0.00 H ATOM 44772 H4S OL 1104 83.045 77.320 33.699 1.00 0.00 H ATOM 44773 C15 OL 1104 81.223 78.150 34.507 1.00 0.00 C ATOM 44774 H5R OL 1104 80.178 78.352 34.263 1.00 0.00 H ATOM 44775 H5S OL 1104 80.997 77.335 35.197 1.00 0.00 H ATOM 44776 C16 OL 1104 82.007 79.223 35.346 1.00 0.00 C ATOM 44777 H6R OL 1104 83.005 78.810 35.511 1.00 0.00 H ATOM 44778 H6S OL 1104 82.242 80.098 34.737 1.00 0.00 H ATOM 44779 C17 OL 1104 81.540 79.676 36.742 1.00 0.00 C ATOM 44780 H7R OL 1104 82.370 80.279 37.117 1.00 0.00 H ATOM 44781 H7S OL 1104 80.738 80.376 36.499 1.00 0.00 H ATOM 44782 C18 OL 1104 81.064 78.694 37.750 1.00 0.00 C ATOM 44783 H8R OL 1104 80.258 78.053 37.387 1.00 0.00 H ATOM 44784 H8S OL 1104 81.934 78.050 37.897 1.00 0.00 H ATOM 44785 C19 OL 1104 80.744 79.324 39.079 1.00 0.00 C ATOM 44786 H9R OL 1104 80.042 80.144 38.950 1.00 0.00 H ATOM 44787 C110 OL 1104 81.196 79.121 40.353 1.00 0.00 C ATOM 44788 H10R OL 1104 80.777 79.646 41.208 1.00 0.00 H ATOM 44789 C111 OL 1104 82.223 78.168 40.754 1.00 0.00 C ATOM 44790 H11R OL 1104 81.771 77.402 41.387 1.00 0.00 H ATOM 44791 H11S OL 1104 82.649 77.703 39.862 1.00 0.00 H ATOM 44792 C112 OL 1104 83.351 78.900 41.494 1.00 0.00 C ATOM 44793 H12R OL 1104 83.860 79.577 40.805 1.00 0.00 H ATOM 44794 H12S OL 1104 82.794 79.399 42.289 1.00 0.00 H ATOM 44795 C113 OL 1104 84.444 78.012 42.110 1.00 0.00 C ATOM 44796 H13R OL 1104 85.226 78.664 42.506 1.00 0.00 H ATOM 44797 H13S OL 1104 83.881 77.730 43.002 1.00 0.00 H ATOM 44798 C114 OL 1104 84.902 76.834 41.285 1.00 0.00 C ATOM 44799 H14R OL 1104 85.296 76.104 41.996 1.00 0.00 H ATOM 44800 H14S OL 1104 84.046 76.302 40.864 1.00 0.00 H ATOM 44801 C115 OL 1104 86.076 77.135 40.279 1.00 0.00 C ATOM 44802 H15R OL 1104 86.174 76.229 39.676 1.00 0.00 H ATOM 44803 H15S OL 1104 85.901 78.010 39.650 1.00 0.00 H ATOM 44804 C116 OL 1104 87.412 77.262 40.948 1.00 0.00 C ATOM 44805 H16R OL 1104 87.205 78.026 41.700 1.00 0.00 H ATOM 44806 H16S OL 1104 87.566 76.289 41.420 1.00 0.00 H ATOM 44807 C117 OL 1104 88.483 77.547 39.871 1.00 0.00 C ATOM 44808 H17R OL 1104 88.429 76.729 39.150 1.00 0.00 H ATOM 44809 H17S OL 1104 88.195 78.482 39.385 1.00 0.00 H ATOM 44810 C118 OL 1104 89.865 77.441 40.488 1.00 0.00 C ATOM 44811 H18R OL 1104 90.124 76.478 40.934 1.00 0.00 H ATOM 44812 H18S OL 1104 89.976 78.203 41.263 1.00 0.00 H ATOM 44813 H18T OL 1104 90.689 77.458 39.771 1.00 0.00 H TER 44814 OL 1104 ATOM 44814 C116 PA 1105 83.987 53.383 36.733 1.00 0.00 C ATOM 44815 H16R PA 1105 83.070 52.804 36.859 1.00 0.00 H ATOM 44816 H16S PA 1105 84.777 52.764 37.163 1.00 0.00 H ATOM 44817 H16T PA 1105 84.239 53.402 35.671 1.00 0.00 H ATOM 44818 C115 PA 1105 84.155 54.730 37.406 1.00 0.00 C ATOM 44819 H15R PA 1105 85.218 54.961 37.501 1.00 0.00 H ATOM 44820 H15S PA 1105 83.731 54.751 38.412 1.00 0.00 H ATOM 44821 C114 PA 1105 83.648 55.871 36.527 1.00 0.00 C ATOM 44822 H14R PA 1105 82.655 55.604 36.156 1.00 0.00 H ATOM 44823 H14S PA 1105 84.281 55.930 35.639 1.00 0.00 H ATOM 44824 C113 PA 1105 83.446 57.190 37.277 1.00 0.00 C ATOM 44825 H13R PA 1105 84.353 57.747 37.518 1.00 0.00 H ATOM 44826 H13S PA 1105 82.980 56.996 38.245 1.00 0.00 H ATOM 44827 C112 PA 1105 82.605 58.211 36.522 1.00 0.00 C ATOM 44828 H12R PA 1105 81.643 57.795 36.215 1.00 0.00 H ATOM 44829 H12S PA 1105 83.126 58.492 35.605 1.00 0.00 H ATOM 44830 C111 PA 1105 82.288 59.489 37.330 1.00 0.00 C ATOM 44831 H11R PA 1105 83.087 60.233 37.323 1.00 0.00 H ATOM 44832 H11S PA 1105 82.268 59.285 38.403 1.00 0.00 H ATOM 44833 C110 PA 1105 80.973 60.239 36.923 1.00 0.00 C ATOM 44834 H10R PA 1105 80.588 61.025 37.575 1.00 0.00 H ATOM 44835 H10S PA 1105 80.241 59.430 36.879 1.00 0.00 H ATOM 44836 C19 PA 1105 81.040 60.850 35.573 1.00 0.00 C ATOM 44837 H9R PA 1105 81.350 60.170 34.776 1.00 0.00 H ATOM 44838 H9S PA 1105 81.781 61.648 35.490 1.00 0.00 H ATOM 44839 C18 PA 1105 79.710 61.437 35.035 1.00 0.00 C ATOM 44840 H8R PA 1105 79.308 62.104 35.800 1.00 0.00 H ATOM 44841 H8S PA 1105 78.993 60.614 35.019 1.00 0.00 H ATOM 44842 C17 PA 1105 79.660 62.141 33.748 1.00 0.00 C ATOM 44843 H7R PA 1105 79.873 61.391 32.984 1.00 0.00 H ATOM 44844 H7S PA 1105 80.500 62.833 33.662 1.00 0.00 H ATOM 44845 C16 PA 1105 78.335 62.785 33.428 1.00 0.00 C ATOM 44846 H6R PA 1105 78.321 63.555 34.202 1.00 0.00 H ATOM 44847 H6S PA 1105 77.424 62.235 33.674 1.00 0.00 H ATOM 44848 C15 PA 1105 78.289 63.359 32.116 1.00 0.00 C ATOM 44849 H5R PA 1105 79.241 63.879 31.994 1.00 0.00 H ATOM 44850 H5S PA 1105 77.484 64.097 32.104 1.00 0.00 H ATOM 44851 C14 PA 1105 78.103 62.279 31.022 1.00 0.00 C ATOM 44852 H4R PA 1105 77.231 61.665 31.255 1.00 0.00 H ATOM 44853 H4S PA 1105 78.973 61.638 31.181 1.00 0.00 H ATOM 44854 C13 PA 1105 78.108 62.694 29.599 1.00 0.00 C ATOM 44855 H3R PA 1105 79.135 63.006 29.393 1.00 0.00 H ATOM 44856 H3S PA 1105 77.578 63.639 29.465 1.00 0.00 H ATOM 44857 C12 PA 1105 77.554 61.616 28.668 1.00 0.00 C ATOM 44858 H2R PA 1105 76.468 61.545 28.758 1.00 0.00 H ATOM 44859 H2S PA 1105 77.910 60.605 28.876 1.00 0.00 H ATOM 44860 C11 PC 1106 77.781 61.823 27.200 1.00 0.00 C ATOM 44861 O12 PC 1106 77.812 60.987 26.270 1.00 0.00 O ATOM 44862 O11 PC 1106 77.730 63.135 26.913 1.00 0.00 O ATOM 44863 C1 PC 1106 77.998 63.718 25.585 1.00 0.00 C ATOM 44864 HR PC 1106 78.989 63.466 25.200 1.00 0.00 H ATOM 44865 HS PC 1106 77.876 64.797 25.714 1.00 0.00 H ATOM 44866 C2 PC 1106 76.859 63.328 24.616 1.00 0.00 C ATOM 44867 HX PC 1106 76.613 62.266 24.691 1.00 0.00 H ATOM 44868 C3 PC 1106 77.324 63.545 23.151 1.00 0.00 C ATOM 44869 HA PC 1106 76.543 63.327 22.419 1.00 0.00 H ATOM 44870 HB PC 1106 78.181 62.895 22.957 1.00 0.00 H ATOM 44871 O31 PC 1106 77.659 64.923 22.847 1.00 0.00 O ATOM 44872 P31 PC 1106 78.504 65.208 21.564 1.00 0.00 P ATOM 44873 O32 PC 1106 77.405 65.141 20.367 1.00 0.00 O ATOM 44874 C31 PC 1106 76.379 66.041 20.169 1.00 0.00 C ATOM 44875 H1A PC 1106 76.871 66.986 19.925 1.00 0.00 H ATOM 44876 H1B PC 1106 75.613 66.230 20.925 1.00 0.00 H ATOM 44877 C32 PC 1106 75.477 65.601 18.963 1.00 0.00 C ATOM 44878 H2A PC 1106 74.691 66.354 18.887 1.00 0.00 H ATOM 44879 H2B PC 1106 74.892 64.728 19.254 1.00 0.00 H ATOM 44880 N31 PC 1106 76.117 65.277 17.626 1.00 0.00 N ATOM 44881 C33 PC 1106 77.284 66.164 17.343 1.00 0.00 C ATOM 44882 H3A PC 1106 78.148 65.818 17.913 1.00 0.00 H ATOM 44883 H3B PC 1106 77.017 67.151 17.723 1.00 0.00 H ATOM 44884 H3C PC 1106 77.572 66.141 16.291 1.00 0.00 H ATOM 44885 C34 PC 1106 76.479 63.893 17.566 1.00 0.00 C ATOM 44886 H4A PC 1106 77.112 63.794 16.683 1.00 0.00 H ATOM 44887 H4B PC 1106 75.578 63.318 17.343 1.00 0.00 H ATOM 44888 H4C PC 1106 77.034 63.638 18.469 1.00 0.00 H ATOM 44889 C35 PC 1106 74.993 65.431 16.599 1.00 0.00 C ATOM 44890 H5A PC 1106 75.275 64.902 15.687 1.00 0.00 H ATOM 44891 H5B PC 1106 74.916 66.507 16.439 1.00 0.00 H ATOM 44892 H5C PC 1106 74.032 65.072 16.971 1.00 0.00 H ATOM 44893 O33 PC 1106 78.845 66.612 21.644 1.00 0.00 O ATOM 44894 O34 PC 1106 79.549 64.220 21.343 1.00 0.00 O ATOM 44895 O21 PC 1106 75.634 64.064 24.860 1.00 0.00 O ATOM 44896 C21 PC 1106 74.671 63.526 25.686 1.00 0.00 C ATOM 44897 O22 PC 1106 74.636 62.410 26.149 1.00 0.00 O ATOM 44898 C12 OL 1107 73.497 64.537 25.863 1.00 0.00 C ATOM 44899 H2R OL 1107 73.792 65.575 25.691 1.00 0.00 H ATOM 44900 H2S OL 1107 72.822 64.403 25.015 1.00 0.00 H ATOM 44901 C13 OL 1107 72.839 64.431 27.221 1.00 0.00 C ATOM 44902 H3R OL 1107 71.892 64.950 27.059 1.00 0.00 H ATOM 44903 H3S OL 1107 72.605 63.416 27.548 1.00 0.00 H ATOM 44904 C14 OL 1107 73.649 64.966 28.367 1.00 0.00 C ATOM 44905 H4R OL 1107 74.661 64.616 28.155 1.00 0.00 H ATOM 44906 H4S OL 1107 73.704 66.052 28.266 1.00 0.00 H ATOM 44907 C15 OL 1107 73.107 64.667 29.772 1.00 0.00 C ATOM 44908 H5R OL 1107 72.159 65.184 29.934 1.00 0.00 H ATOM 44909 H5S OL 1107 73.014 63.580 29.810 1.00 0.00 H ATOM 44910 C16 OL 1107 74.056 65.091 30.874 1.00 0.00 C ATOM 44911 H6R OL 1107 74.947 64.480 30.710 1.00 0.00 H ATOM 44912 H6S OL 1107 74.144 66.179 30.847 1.00 0.00 H ATOM 44913 C17 OL 1107 73.641 64.725 32.334 1.00 0.00 C ATOM 44914 H7R OL 1107 72.636 65.125 32.481 1.00 0.00 H ATOM 44915 H7S OL 1107 73.669 63.634 32.389 1.00 0.00 H ATOM 44916 C18 OL 1107 74.645 65.273 33.341 1.00 0.00 C ATOM 44917 H8R OL 1107 74.632 64.605 34.206 1.00 0.00 H ATOM 44918 H8S OL 1107 75.636 65.235 32.884 1.00 0.00 H ATOM 44919 C19 OL 1107 74.265 66.691 33.628 1.00 0.00 C ATOM 44920 H9R OL 1107 74.215 67.417 32.821 1.00 0.00 H ATOM 44921 C110 OL 1107 74.092 67.259 34.808 1.00 0.00 C ATOM 44922 H10R OL 1107 73.895 68.327 34.771 1.00 0.00 H ATOM 44923 C111 OL 1107 74.304 66.632 36.133 1.00 0.00 C ATOM 44924 H11R OL 1107 73.403 66.781 36.732 1.00 0.00 H ATOM 44925 H11S OL 1107 74.576 65.582 36.006 1.00 0.00 H ATOM 44926 C112 OL 1107 75.412 67.158 37.089 1.00 0.00 C ATOM 44927 H12R OL 1107 75.214 66.633 38.026 1.00 0.00 H ATOM 44928 H12S OL 1107 76.428 66.811 36.893 1.00 0.00 H ATOM 44929 C113 OL 1107 75.417 68.714 37.114 1.00 0.00 C ATOM 44930 H13R OL 1107 75.795 69.113 36.171 1.00 0.00 H ATOM 44931 H13S OL 1107 74.409 69.078 37.327 1.00 0.00 H ATOM 44932 C114 OL 1107 76.136 69.334 38.328 1.00 0.00 C ATOM 44933 H14R OL 1107 77.143 68.912 38.297 1.00 0.00 H ATOM 44934 H14S OL 1107 76.099 70.410 38.142 1.00 0.00 H ATOM 44935 C115 OL 1107 75.343 69.218 39.629 1.00 0.00 C ATOM 44936 H15R OL 1107 74.385 69.729 39.513 1.00 0.00 H ATOM 44937 H15S OL 1107 75.041 68.206 39.905 1.00 0.00 H ATOM 44938 C116 OL 1107 76.161 69.673 40.860 1.00 0.00 C ATOM 44939 H16R OL 1107 77.140 69.189 40.882 1.00 0.00 H ATOM 44940 H16S OL 1107 76.312 70.731 40.634 1.00 0.00 H ATOM 44941 C117 OL 1107 75.500 69.388 42.197 1.00 0.00 C ATOM 44942 H17R OL 1107 74.442 69.623 42.063 1.00 0.00 H ATOM 44943 H17S OL 1107 75.603 68.348 42.516 1.00 0.00 H ATOM 44944 C118 OL 1107 76.059 70.461 43.168 1.00 0.00 C ATOM 44945 H18R OL 1107 75.627 71.425 42.895 1.00 0.00 H ATOM 44946 H18S OL 1107 77.144 70.565 43.096 1.00 0.00 H ATOM 44947 H18T OL 1107 75.724 70.285 44.192 1.00 0.00 H TER 44948 OL 1107 ATOM 44948 C116 PA 1108 100.553 41.670 44.448 1.00 0.00 C ATOM 44949 H16R PA 1108 101.358 41.391 45.131 1.00 0.00 H ATOM 44950 H16S PA 1108 99.752 41.107 44.932 1.00 0.00 H ATOM 44951 H16T PA 1108 100.205 42.694 44.599 1.00 0.00 H ATOM 44952 C115 PA 1108 100.840 41.375 42.980 1.00 0.00 C ATOM 44953 H15R PA 1108 99.991 41.614 42.336 1.00 0.00 H ATOM 44954 H15S PA 1108 100.933 40.301 43.154 1.00 0.00 H ATOM 44955 C114 PA 1108 102.202 41.766 42.434 1.00 0.00 C ATOM 44956 H14R PA 1108 103.081 41.438 42.991 1.00 0.00 H ATOM 44957 H14S PA 1108 102.500 42.815 42.488 1.00 0.00 H ATOM 44958 C113 PA 1108 102.340 41.279 40.967 1.00 0.00 C ATOM 44959 H13R PA 1108 103.349 41.583 40.681 1.00 0.00 H ATOM 44960 H13S PA 1108 101.724 41.957 40.371 1.00 0.00 H ATOM 44961 C112 PA 1108 102.086 39.761 40.684 1.00 0.00 C ATOM 44962 H12R PA 1108 100.998 39.666 40.660 1.00 0.00 H ATOM 44963 H12S PA 1108 102.436 39.148 41.518 1.00 0.00 H ATOM 44964 C111 PA 1108 102.610 39.360 39.302 1.00 0.00 C ATOM 44965 H11R PA 1108 103.659 39.624 39.152 1.00 0.00 H ATOM 44966 H11S PA 1108 102.077 39.996 38.592 1.00 0.00 H ATOM 44967 C110 PA 1108 102.421 37.927 38.870 1.00 0.00 C ATOM 44968 H10R PA 1108 101.368 37.720 38.671 1.00 0.00 H ATOM 44969 H10S PA 1108 102.729 37.374 39.760 1.00 0.00 H ATOM 44970 C19 PA 1108 103.200 37.489 37.625 1.00 0.00 C ATOM 44971 H9R PA 1108 104.264 37.383 37.846 1.00 0.00 H ATOM 44972 H9S PA 1108 103.185 38.256 36.849 1.00 0.00 H ATOM 44973 C18 PA 1108 102.633 36.141 37.241 1.00 0.00 C ATOM 44974 H8R PA 1108 101.653 36.229 36.767 1.00 0.00 H ATOM 44975 H8S PA 1108 102.381 35.531 38.110 1.00 0.00 H ATOM 44976 C17 PA 1108 103.632 35.305 36.445 1.00 0.00 C ATOM 44977 H7R PA 1108 103.117 34.380 36.177 1.00 0.00 H ATOM 44978 H7S PA 1108 104.392 34.895 37.113 1.00 0.00 H ATOM 44979 C16 PA 1108 104.155 36.025 35.257 1.00 0.00 C ATOM 44980 H6R PA 1108 104.987 36.634 35.618 1.00 0.00 H ATOM 44981 H6S PA 1108 103.373 36.745 35.007 1.00 0.00 H ATOM 44982 C15 PA 1108 104.552 35.162 34.146 1.00 0.00 C ATOM 44983 H5R PA 1108 103.694 34.520 33.933 1.00 0.00 H ATOM 44984 H5S PA 1108 105.388 34.507 34.400 1.00 0.00 H ATOM 44985 C14 PA 1108 104.915 35.836 32.803 1.00 0.00 C ATOM 44986 H4R PA 1108 104.083 36.374 32.344 1.00 0.00 H ATOM 44987 H4S PA 1108 105.195 35.120 32.027 1.00 0.00 H ATOM 44988 C13 PA 1108 106.215 36.726 32.949 1.00 0.00 C ATOM 44989 H3R PA 1108 107.130 36.148 33.092 1.00 0.00 H ATOM 44990 H3S PA 1108 106.208 37.201 33.933 1.00 0.00 H ATOM 44991 C12 PA 1108 106.554 37.772 31.946 1.00 0.00 C ATOM 44992 H2R PA 1108 105.850 38.603 32.014 1.00 0.00 H ATOM 44993 H2S PA 1108 107.541 38.192 32.150 1.00 0.00 H ATOM 44994 C11 PGR 1109 106.564 37.172 30.608 1.00 0.00 C ATOM 44995 O12 PGR 1109 105.602 36.923 29.860 1.00 0.00 O ATOM 44996 O11 PGR 1109 107.823 37.062 30.249 1.00 0.00 O ATOM 44997 C1 PGR 1109 108.105 36.219 29.115 1.00 0.00 C ATOM 44998 HR PGR 1109 107.631 35.243 29.243 1.00 0.00 H ATOM 44999 HS PGR 1109 109.171 35.994 29.202 1.00 0.00 H ATOM 45000 C2 PGR 1109 107.701 36.931 27.830 1.00 0.00 C ATOM 45001 HX PGR 1109 106.797 37.499 28.064 1.00 0.00 H ATOM 45002 C3 PGR 1109 107.370 35.984 26.696 1.00 0.00 C ATOM 45003 HA PGR 1109 106.598 35.351 27.142 1.00 0.00 H ATOM 45004 HB PGR 1109 108.246 35.387 26.433 1.00 0.00 H ATOM 45005 O31 PGR 1109 106.884 36.668 25.529 1.00 0.00 O ATOM 45006 P31 PGR 1109 106.611 35.889 24.198 1.00 0.00 P ATOM 45007 O32 PGR 1109 105.335 35.040 24.387 1.00 0.00 O ATOM 45008 C31 PGR 1109 105.374 33.717 24.808 1.00 0.00 C ATOM 45009 H1A PGR 1109 106.183 33.216 24.271 1.00 0.00 H ATOM 45010 H1B PGR 1109 105.612 33.615 25.870 1.00 0.00 H ATOM 45011 C32 PGR 1109 104.037 32.994 24.548 1.00 0.00 C ATOM 45012 H2A PGR 1109 104.112 32.069 25.126 1.00 0.00 H ATOM 45013 O35 PGR 1109 103.848 32.786 23.192 1.00 0.00 O ATOM 45014 HO5A PGR 1109 103.761 33.664 22.780 1.00 0.00 H ATOM 45015 C33 PGR 1109 102.891 33.766 25.125 1.00 0.00 C ATOM 45016 H3A PGR 1109 103.036 33.994 26.184 1.00 0.00 H ATOM 45017 H3B PGR 1109 102.840 34.606 24.427 1.00 0.00 H ATOM 45018 O33 PGR 1109 106.269 36.839 23.142 1.00 0.00 O ATOM 45019 O34 PGR 1109 107.797 35.001 23.883 1.00 0.00 O ATOM 45020 O21 PGR 1109 108.871 37.715 27.430 1.00 0.00 O ATOM 45021 C21 PGR 1109 108.689 38.846 26.748 1.00 0.00 C ATOM 45022 O22 PGR 1109 107.637 39.391 26.504 1.00 0.00 O ATOM 45023 O36 PGR 1109 101.670 33.032 25.069 1.00 0.00 O ATOM 45024 HO6A PGR 1109 101.661 32.475 24.270 1.00 0.00 H ATOM 45025 C12 OL 1110 109.983 39.510 26.296 1.00 0.00 C ATOM 45026 H2R OL 1110 110.711 38.729 26.525 1.00 0.00 H ATOM 45027 H2S OL 1110 109.966 39.674 25.217 1.00 0.00 H ATOM 45028 C13 OL 1110 110.305 40.800 27.030 1.00 0.00 C ATOM 45029 H3R OL 1110 111.048 41.329 26.430 1.00 0.00 H ATOM 45030 H3S OL 1110 109.352 41.332 27.012 1.00 0.00 H ATOM 45031 C14 OL 1110 110.740 40.569 28.529 1.00 0.00 C ATOM 45032 H4R OL 1110 110.171 39.728 28.931 1.00 0.00 H ATOM 45033 H4S OL 1110 111.786 40.257 28.560 1.00 0.00 H ATOM 45034 C15 OL 1110 110.556 41.758 29.378 1.00 0.00 C ATOM 45035 H5R OL 1110 111.052 41.484 30.311 1.00 0.00 H ATOM 45036 H5S OL 1110 111.078 42.508 28.779 1.00 0.00 H ATOM 45037 C16 OL 1110 109.098 42.285 29.584 1.00 0.00 C ATOM 45038 H6R OL 1110 109.158 43.053 30.358 1.00 0.00 H ATOM 45039 H6S OL 1110 108.750 42.876 28.735 1.00 0.00 H ATOM 45040 C17 OL 1110 107.984 41.260 29.913 1.00 0.00 C ATOM 45041 H7R OL 1110 107.975 40.360 29.295 1.00 0.00 H ATOM 45042 H7S OL 1110 108.206 40.778 30.867 1.00 0.00 H ATOM 45043 C18 OL 1110 106.653 42.007 29.851 1.00 0.00 C ATOM 45044 H8R OL 1110 106.802 43.057 30.111 1.00 0.00 H ATOM 45045 H8S OL 1110 106.353 41.986 28.802 1.00 0.00 H ATOM 45046 C19 OL 1110 105.527 41.374 30.477 1.00 0.00 C ATOM 45047 H9R OL 1110 104.868 40.771 29.858 1.00 0.00 H ATOM 45048 C110 OL 1110 105.256 41.371 31.790 1.00 0.00 C ATOM 45049 H10R OL 1110 104.321 40.942 32.141 1.00 0.00 H ATOM 45050 C111 OL 1110 105.998 42.232 32.791 1.00 0.00 C ATOM 45051 H11R OL 1110 106.595 41.467 33.291 1.00 0.00 H ATOM 45052 H11S OL 1110 106.732 42.879 32.307 1.00 0.00 H ATOM 45053 C112 OL 1110 104.954 42.910 33.612 1.00 0.00 C ATOM 45054 H12R OL 1110 105.299 43.884 33.964 1.00 0.00 H ATOM 45055 H12S OL 1110 104.104 43.072 32.946 1.00 0.00 H ATOM 45056 C113 OL 1110 104.756 42.187 34.940 1.00 0.00 C ATOM 45057 H13R OL 1110 104.629 41.113 34.794 1.00 0.00 H ATOM 45058 H13S OL 1110 105.697 42.217 35.492 1.00 0.00 H ATOM 45059 C114 OL 1110 103.629 42.662 35.807 1.00 0.00 C ATOM 45060 H14R OL 1110 102.693 42.307 35.372 1.00 0.00 H ATOM 45061 H14S OL 1110 103.456 42.173 36.769 1.00 0.00 H ATOM 45062 C115 OL 1110 103.456 44.169 35.923 1.00 0.00 C ATOM 45063 H15R OL 1110 104.286 44.673 36.422 1.00 0.00 H ATOM 45064 H15S OL 1110 103.325 44.644 34.948 1.00 0.00 H ATOM 45065 C116 OL 1110 102.242 44.627 36.828 1.00 0.00 C ATOM 45066 H16R OL 1110 101.361 44.110 36.443 1.00 0.00 H ATOM 45067 H16S OL 1110 102.364 44.217 37.832 1.00 0.00 H ATOM 45068 C117 OL 1110 102.081 46.157 37.166 1.00 0.00 C ATOM 45069 H17R OL 1110 101.163 46.285 37.744 1.00 0.00 H ATOM 45070 H17S OL 1110 102.907 46.451 37.816 1.00 0.00 H ATOM 45071 C118 OL 1110 102.206 47.091 35.995 1.00 0.00 C ATOM 45072 H18R OL 1110 101.774 48.008 36.402 1.00 0.00 H ATOM 45073 H18S OL 1110 101.616 46.813 35.120 1.00 0.00 H ATOM 45074 H18T OL 1110 103.283 47.132 35.820 1.00 0.00 H TER 45075 OL 1110 ATOM 45075 C116 PA 1111 79.280 97.995 45.136 1.00 0.00 C ATOM 45076 H16R PA 1111 79.108 96.917 45.141 1.00 0.00 H ATOM 45077 H16S PA 1111 78.791 98.312 46.060 1.00 0.00 H ATOM 45078 H16T PA 1111 80.305 98.369 45.102 1.00 0.00 H ATOM 45079 C115 PA 1111 78.515 98.517 43.927 1.00 0.00 C ATOM 45080 H15R PA 1111 78.801 97.915 43.062 1.00 0.00 H ATOM 45081 H15S PA 1111 78.737 99.566 43.720 1.00 0.00 H ATOM 45082 C114 PA 1111 76.951 98.213 43.968 1.00 0.00 C ATOM 45083 H14R PA 1111 76.596 98.556 44.942 1.00 0.00 H ATOM 45084 H14S PA 1111 76.881 97.124 43.920 1.00 0.00 H ATOM 45085 C113 PA 1111 76.327 98.778 42.672 1.00 0.00 C ATOM 45086 H13R PA 1111 75.261 98.548 42.604 1.00 0.00 H ATOM 45087 H13S PA 1111 76.796 98.274 41.825 1.00 0.00 H ATOM 45088 C112 PA 1111 76.552 100.328 42.552 1.00 0.00 C ATOM 45089 H12R PA 1111 77.595 100.627 42.433 1.00 0.00 H ATOM 45090 H12S PA 1111 76.209 100.769 43.491 1.00 0.00 H ATOM 45091 C111 PA 1111 75.939 101.018 41.364 1.00 0.00 C ATOM 45092 H11R PA 1111 74.853 100.918 41.400 1.00 0.00 H ATOM 45093 H11S PA 1111 76.317 100.462 40.503 1.00 0.00 H ATOM 45094 C110 PA 1111 76.233 102.505 41.126 1.00 0.00 C ATOM 45095 H10R PA 1111 77.298 102.701 41.269 1.00 0.00 H ATOM 45096 H10S PA 1111 75.785 102.999 41.990 1.00 0.00 H ATOM 45097 C19 PA 1111 75.799 103.085 39.841 1.00 0.00 C ATOM 45098 H9R PA 1111 75.968 104.164 39.846 1.00 0.00 H ATOM 45099 H9S PA 1111 74.723 102.905 39.810 1.00 0.00 H ATOM 45100 C18 PA 1111 76.415 102.511 38.612 1.00 0.00 C ATOM 45101 H8R PA 1111 75.778 102.885 37.807 1.00 0.00 H ATOM 45102 H8S PA 1111 76.237 101.434 38.567 1.00 0.00 H ATOM 45103 C17 PA 1111 77.893 102.867 38.244 1.00 0.00 C ATOM 45104 H7R PA 1111 78.566 102.375 38.949 1.00 0.00 H ATOM 45105 H7S PA 1111 77.970 103.947 38.382 1.00 0.00 H ATOM 45106 C16 PA 1111 78.308 102.264 36.942 1.00 0.00 C ATOM 45107 H6R PA 1111 78.119 101.192 36.857 1.00 0.00 H ATOM 45108 H6S PA 1111 79.386 102.287 36.768 1.00 0.00 H ATOM 45109 C15 PA 1111 77.675 102.919 35.740 1.00 0.00 C ATOM 45110 H5R PA 1111 78.055 103.940 35.670 1.00 0.00 H ATOM 45111 H5S PA 1111 76.597 102.991 35.899 1.00 0.00 H ATOM 45112 C14 PA 1111 78.023 102.106 34.494 1.00 0.00 C ATOM 45113 H4R PA 1111 77.555 101.120 34.462 1.00 0.00 H ATOM 45114 H4S PA 1111 79.111 102.060 34.412 1.00 0.00 H ATOM 45115 C13 PA 1111 77.443 102.823 33.296 1.00 0.00 C ATOM 45116 H3R PA 1111 77.816 103.844 33.398 1.00 0.00 H ATOM 45117 H3S PA 1111 76.354 102.786 33.370 1.00 0.00 H ATOM 45118 C12 PA 1111 77.769 101.982 32.128 1.00 0.00 C ATOM 45119 H2R PA 1111 77.274 101.015 32.239 1.00 0.00 H ATOM 45120 H2S PA 1111 78.841 101.779 32.073 1.00 0.00 H ATOM 45121 C11 PGR 1112 77.481 102.642 30.835 1.00 0.00 C ATOM 45122 O12 PGR 1112 78.321 103.262 30.268 1.00 0.00 O ATOM 45123 O11 PGR 1112 76.313 102.403 30.350 1.00 0.00 O ATOM 45124 C1 PGR 1112 75.831 102.962 29.134 1.00 0.00 C ATOM 45125 HR PGR 1112 76.535 102.684 28.345 1.00 0.00 H ATOM 45126 HS PGR 1112 75.811 104.031 29.359 1.00 0.00 H ATOM 45127 C2 PGR 1112 74.408 102.403 28.891 1.00 0.00 C ATOM 45128 HX PGR 1112 74.380 101.321 29.041 1.00 0.00 H ATOM 45129 C3 PGR 1112 73.945 102.561 27.391 1.00 0.00 C ATOM 45130 HA PGR 1112 72.977 102.072 27.255 1.00 0.00 H ATOM 45131 HB PGR 1112 74.622 102.130 26.649 1.00 0.00 H ATOM 45132 O31 PGR 1112 73.850 103.950 27.020 1.00 0.00 O ATOM 45133 P31 PGR 1112 73.463 104.254 25.466 1.00 0.00 P ATOM 45134 O32 PGR 1112 72.903 105.713 25.305 1.00 0.00 O ATOM 45135 C31 PGR 1112 71.739 106.249 25.889 1.00 0.00 C ATOM 45136 H1A PGR 1112 71.681 106.013 26.954 1.00 0.00 H ATOM 45137 H1B PGR 1112 70.882 105.770 25.409 1.00 0.00 H ATOM 45138 C32 PGR 1112 71.716 107.756 25.601 1.00 0.00 C ATOM 45139 H2A PGR 1112 72.561 108.241 26.097 1.00 0.00 H ATOM 45140 O35 PGR 1112 71.690 107.885 24.239 1.00 0.00 O ATOM 45141 HO5A PGR 1112 72.607 107.792 23.925 1.00 0.00 H ATOM 45142 C33 PGR 1112 70.405 108.402 26.172 1.00 0.00 C ATOM 45143 H3A PGR 1112 69.480 107.966 25.786 1.00 0.00 H ATOM 45144 H3B PGR 1112 70.388 108.289 27.259 1.00 0.00 H ATOM 45145 O33 PGR 1112 74.710 104.246 24.632 1.00 0.00 O ATOM 45146 O34 PGR 1112 72.461 103.262 25.083 1.00 0.00 O ATOM 45147 O21 PGR 1112 73.464 103.038 29.819 1.00 0.00 O ATOM 45148 C21 PGR 1112 72.337 102.381 30.066 1.00 0.00 C ATOM 45149 O22 PGR 1112 72.059 101.224 29.704 1.00 0.00 O ATOM 45150 O36 PGR 1112 70.382 109.801 25.980 1.00 0.00 O ATOM 45151 HO6A PGR 1112 69.655 110.231 26.465 1.00 0.00 H ATOM 45152 C12 OL 1113 71.342 103.125 31.027 1.00 0.00 C ATOM 45153 H2R OL 1113 70.784 102.284 31.442 1.00 0.00 H ATOM 45154 H2S OL 1113 71.772 103.729 31.829 1.00 0.00 H ATOM 45155 C13 OL 1113 70.465 104.161 30.247 1.00 0.00 C ATOM 45156 H3R OL 1113 71.202 104.834 29.804 1.00 0.00 H ATOM 45157 H3S OL 1113 69.872 103.501 29.609 1.00 0.00 H ATOM 45158 C14 OL 1113 69.500 105.059 31.109 1.00 0.00 C ATOM 45159 H4R OL 1113 70.079 105.825 31.630 1.00 0.00 H ATOM 45160 H4S OL 1113 68.954 105.682 30.398 1.00 0.00 H ATOM 45161 C15 OL 1113 68.379 104.409 31.958 1.00 0.00 C ATOM 45162 H5R OL 1113 67.985 103.618 31.316 1.00 0.00 H ATOM 45163 H5S OL 1113 68.770 103.881 32.831 1.00 0.00 H ATOM 45164 C16 OL 1113 67.365 105.310 32.500 1.00 0.00 C ATOM 45165 H6R OL 1113 66.706 104.826 33.223 1.00 0.00 H ATOM 45166 H6S OL 1113 67.879 105.891 33.269 1.00 0.00 H ATOM 45167 C17 OL 1113 66.666 106.227 31.489 1.00 0.00 C ATOM 45168 H7R OL 1113 67.440 106.709 30.888 1.00 0.00 H ATOM 45169 H7S OL 1113 66.082 105.625 30.789 1.00 0.00 H ATOM 45170 C18 OL 1113 65.769 107.346 32.164 1.00 0.00 C ATOM 45171 H8R OL 1113 66.307 108.027 32.827 1.00 0.00 H ATOM 45172 H8S OL 1113 65.342 107.971 31.378 1.00 0.00 H ATOM 45173 C19 OL 1113 64.653 106.630 32.842 1.00 0.00 C ATOM 45174 H9R OL 1113 64.002 106.023 32.218 1.00 0.00 H ATOM 45175 C110 OL 1113 64.466 106.741 34.219 1.00 0.00 C ATOM 45176 H10R OL 1113 63.618 106.194 34.623 1.00 0.00 H ATOM 45177 C111 OL 1113 65.249 107.506 35.187 1.00 0.00 C ATOM 45178 H11R OL 1113 65.298 106.848 36.057 1.00 0.00 H ATOM 45179 H11S OL 1113 66.285 107.613 34.861 1.00 0.00 H ATOM 45180 C112 OL 1113 64.737 108.908 35.623 1.00 0.00 C ATOM 45181 H12R OL 1113 64.537 109.491 34.722 1.00 0.00 H ATOM 45182 H12S OL 1113 63.747 108.857 36.082 1.00 0.00 H ATOM 45183 C113 OL 1113 65.752 109.807 36.442 1.00 0.00 C ATOM 45184 H13R OL 1113 65.805 109.272 37.392 1.00 0.00 H ATOM 45185 H13S OL 1113 66.766 109.754 36.040 1.00 0.00 H ATOM 45186 C114 OL 1113 65.247 111.268 36.605 1.00 0.00 C ATOM 45187 H14R OL 1113 65.427 111.677 35.608 1.00 0.00 H ATOM 45188 H14S OL 1113 64.208 111.256 36.940 1.00 0.00 H ATOM 45189 C115 OL 1113 65.937 112.280 37.575 1.00 0.00 C ATOM 45190 H15R OL 1113 65.453 113.225 37.322 1.00 0.00 H ATOM 45191 H15S OL 1113 65.751 112.120 38.639 1.00 0.00 H ATOM 45192 C116 OL 1113 67.484 112.436 37.284 1.00 0.00 C ATOM 45193 H16R OL 1113 67.965 111.559 37.721 1.00 0.00 H ATOM 45194 H16S OL 1113 67.684 112.356 36.213 1.00 0.00 H ATOM 45195 C117 OL 1113 68.121 113.784 37.692 1.00 0.00 C ATOM 45196 H17R OL 1113 67.926 113.891 38.761 1.00 0.00 H ATOM 45197 H17S OL 1113 69.205 113.725 37.570 1.00 0.00 H ATOM 45198 C118 OL 1113 67.650 115.073 36.994 1.00 0.00 C ATOM 45199 H18R OL 1113 67.882 114.889 35.943 1.00 0.00 H ATOM 45200 H18S OL 1113 68.234 115.945 37.294 1.00 0.00 H ATOM 45201 H18T OL 1113 66.581 115.214 37.168 1.00 0.00 H TER 45202 OL 1113 ATOM 45202 C116 PA 1114 88.926 53.276 40.740 1.00 0.00 C ATOM 45203 H16R PA 1114 89.491 52.359 40.559 1.00 0.00 H ATOM 45204 H16S PA 1114 88.353 53.256 41.669 1.00 0.00 H ATOM 45205 H16T PA 1114 89.546 54.175 40.751 1.00 0.00 H ATOM 45206 C115 PA 1114 88.016 53.615 39.595 1.00 0.00 C ATOM 45207 H15R PA 1114 87.413 54.514 39.744 1.00 0.00 H ATOM 45208 H15S PA 1114 87.303 52.789 39.595 1.00 0.00 H ATOM 45209 C114 PA 1114 88.631 53.503 38.185 1.00 0.00 C ATOM 45210 H14R PA 1114 87.795 53.521 37.483 1.00 0.00 H ATOM 45211 H14S PA 1114 88.882 52.441 38.142 1.00 0.00 H ATOM 45212 C113 PA 1114 89.803 54.475 37.966 1.00 0.00 C ATOM 45213 H13R PA 1114 90.658 54.019 37.462 1.00 0.00 H ATOM 45214 H13S PA 1114 90.234 54.776 38.924 1.00 0.00 H ATOM 45215 C112 PA 1114 89.423 55.708 37.267 1.00 0.00 C ATOM 45216 H12R PA 1114 90.355 56.277 37.259 1.00 0.00 H ATOM 45217 H12S PA 1114 88.799 56.403 37.832 1.00 0.00 H ATOM 45218 C111 PA 1114 88.723 55.545 35.874 1.00 0.00 C ATOM 45219 H11R PA 1114 87.801 54.961 35.909 1.00 0.00 H ATOM 45220 H11S PA 1114 89.350 54.981 35.180 1.00 0.00 H ATOM 45221 C110 PA 1114 88.545 56.954 35.232 1.00 0.00 C ATOM 45222 H10R PA 1114 89.536 57.393 35.093 1.00 0.00 H ATOM 45223 H10S PA 1114 88.026 57.620 35.925 1.00 0.00 H ATOM 45224 C19 PA 1114 87.680 56.930 33.929 1.00 0.00 C ATOM 45225 H9R PA 1114 86.749 56.412 34.170 1.00 0.00 H ATOM 45226 H9S PA 1114 88.152 56.364 33.124 1.00 0.00 H ATOM 45227 C18 PA 1114 87.311 58.329 33.410 1.00 0.00 C ATOM 45228 H8R PA 1114 88.121 59.032 33.613 1.00 0.00 H ATOM 45229 H8S PA 1114 86.614 58.637 34.191 1.00 0.00 H ATOM 45230 C17 PA 1114 86.741 58.455 31.932 1.00 0.00 C ATOM 45231 H7R PA 1114 87.638 58.343 31.320 1.00 0.00 H ATOM 45232 H7S PA 1114 86.238 59.391 31.680 1.00 0.00 H ATOM 45233 C16 PA 1114 85.687 57.381 31.636 1.00 0.00 C ATOM 45234 H6R PA 1114 84.750 57.724 32.079 1.00 0.00 H ATOM 45235 H6S PA 1114 85.947 56.390 32.014 1.00 0.00 H ATOM 45236 C15 PA 1114 85.478 57.300 30.129 1.00 0.00 C ATOM 45237 H5R PA 1114 86.398 56.842 29.760 1.00 0.00 H ATOM 45238 H5S PA 1114 85.673 58.272 29.671 1.00 0.00 H ATOM 45239 C14 PA 1114 84.241 56.696 29.616 1.00 0.00 C ATOM 45240 H4R PA 1114 83.418 57.385 29.820 1.00 0.00 H ATOM 45241 H4S PA 1114 84.084 55.854 30.293 1.00 0.00 H ATOM 45242 C13 PA 1114 84.378 56.285 28.179 1.00 0.00 C ATOM 45243 H3R PA 1114 85.152 55.538 27.993 1.00 0.00 H ATOM 45244 H3S PA 1114 84.739 57.199 27.703 1.00 0.00 H ATOM 45245 C12 PA 1114 83.064 55.696 27.635 1.00 0.00 C ATOM 45246 H2R PA 1114 82.391 56.546 27.766 1.00 0.00 H ATOM 45247 H2S PA 1114 82.663 54.819 28.149 1.00 0.00 H ATOM 45248 C11 PGR 1115 83.061 55.515 26.150 1.00 0.00 C ATOM 45249 O12 PGR 1115 82.454 54.598 25.530 1.00 0.00 O ATOM 45250 O11 PGR 1115 83.796 56.402 25.504 1.00 0.00 O ATOM 45251 C1 PGR 1115 83.907 56.289 24.095 1.00 0.00 C ATOM 45252 HR PGR 1115 84.296 55.301 23.835 1.00 0.00 H ATOM 45253 HS PGR 1115 84.646 56.965 23.658 1.00 0.00 H ATOM 45254 C2 PGR 1115 82.640 56.735 23.430 1.00 0.00 C ATOM 45255 HX PGR 1115 81.789 56.180 23.832 1.00 0.00 H ATOM 45256 C3 PGR 1115 82.872 56.624 21.860 1.00 0.00 C ATOM 45257 HA PGR 1115 83.635 55.918 21.520 1.00 0.00 H ATOM 45258 HB PGR 1115 83.209 57.549 21.386 1.00 0.00 H ATOM 45259 O31 PGR 1115 81.600 56.446 21.188 1.00 0.00 O ATOM 45260 P31 PGR 1115 81.497 56.685 19.615 1.00 0.00 P ATOM 45261 O32 PGR 1115 80.014 56.168 19.311 1.00 0.00 O ATOM 45262 C31 PGR 1115 79.603 54.890 19.627 1.00 0.00 C ATOM 45263 H1A PGR 1115 79.431 54.690 20.687 1.00 0.00 H ATOM 45264 H1B PGR 1115 80.330 54.183 19.217 1.00 0.00 H ATOM 45265 C32 PGR 1115 78.320 54.736 18.738 1.00 0.00 C ATOM 45266 H2A PGR 1115 78.442 55.179 17.747 1.00 0.00 H ATOM 45267 O35 PGR 1115 77.108 55.223 19.480 1.00 0.00 O ATOM 45268 HO5A PGR 1115 77.183 56.193 19.427 1.00 0.00 H ATOM 45269 C33 PGR 1115 78.117 53.216 18.591 1.00 0.00 C ATOM 45270 H3A PGR 1115 78.931 52.771 18.013 1.00 0.00 H ATOM 45271 H3B PGR 1115 78.001 52.830 19.606 1.00 0.00 H ATOM 45272 O33 PGR 1115 81.576 58.173 19.260 1.00 0.00 O ATOM 45273 O34 PGR 1115 82.433 55.701 18.966 1.00 0.00 O ATOM 45274 O21 PGR 1115 82.466 58.198 23.667 1.00 0.00 O ATOM 45275 C21 PGR 1115 81.767 58.592 24.727 1.00 0.00 C ATOM 45276 O22 PGR 1115 81.276 57.777 25.491 1.00 0.00 O ATOM 45277 O36 PGR 1115 76.981 53.088 17.714 1.00 0.00 O ATOM 45278 HO6A PGR 1115 77.139 53.668 16.948 1.00 0.00 H ATOM 45279 C12 OL 1116 81.682 60.090 24.885 1.00 0.00 C ATOM 45280 H2R OL 1116 82.711 60.415 24.716 1.00 0.00 H ATOM 45281 H2S OL 1116 81.133 60.506 24.038 1.00 0.00 H ATOM 45282 C13 OL 1116 81.190 60.534 26.201 1.00 0.00 C ATOM 45283 H3R OL 1116 81.034 61.605 26.348 1.00 0.00 H ATOM 45284 H3S OL 1116 80.265 60.037 26.500 1.00 0.00 H ATOM 45285 C14 OL 1116 82.125 60.159 27.336 1.00 0.00 C ATOM 45286 H4R OL 1116 82.211 59.072 27.402 1.00 0.00 H ATOM 45287 H4S OL 1116 83.168 60.400 27.117 1.00 0.00 H ATOM 45288 C15 OL 1116 81.653 60.663 28.683 1.00 0.00 C ATOM 45289 H5R OL 1116 81.249 61.672 28.585 1.00 0.00 H ATOM 45290 H5S OL 1116 80.765 60.089 28.957 1.00 0.00 H ATOM 45291 C16 OL 1116 82.625 60.432 29.847 1.00 0.00 C ATOM 45292 H6R OL 1116 83.013 59.426 30.020 1.00 0.00 H ATOM 45293 H6S OL 1116 83.520 60.926 29.464 1.00 0.00 H ATOM 45294 C17 OL 1116 82.291 61.127 31.179 1.00 0.00 C ATOM 45295 H7R OL 1116 82.216 62.180 30.900 1.00 0.00 H ATOM 45296 H7S OL 1116 81.290 60.829 31.497 1.00 0.00 H ATOM 45297 C18 OL 1116 83.410 60.821 32.214 1.00 0.00 C ATOM 45298 H8R OL 1116 83.057 61.171 33.187 1.00 0.00 H ATOM 45299 H8S OL 1116 83.571 59.741 32.207 1.00 0.00 H ATOM 45300 C19 OL 1116 84.686 61.448 31.964 1.00 0.00 C ATOM 45301 H9R OL 1116 85.092 61.374 30.958 1.00 0.00 H ATOM 45302 C110 OL 1116 85.413 62.159 32.825 1.00 0.00 C ATOM 45303 H10R OL 1116 86.284 62.662 32.414 1.00 0.00 H ATOM 45304 C111 OL 1116 85.066 62.459 34.269 1.00 0.00 C ATOM 45305 H11R OL 1116 84.380 61.759 34.750 1.00 0.00 H ATOM 45306 H11S OL 1116 85.944 62.414 34.918 1.00 0.00 H ATOM 45307 C112 OL 1116 84.506 63.893 34.252 1.00 0.00 C ATOM 45308 H12R OL 1116 85.141 64.526 33.629 1.00 0.00 H ATOM 45309 H12S OL 1116 83.568 63.828 33.697 1.00 0.00 H ATOM 45310 C113 OL 1116 84.208 64.534 35.679 1.00 0.00 C ATOM 45311 H13R OL 1116 83.218 64.992 35.621 1.00 0.00 H ATOM 45312 H13S OL 1116 84.117 63.818 36.498 1.00 0.00 H ATOM 45313 C114 OL 1116 85.195 65.677 36.059 1.00 0.00 C ATOM 45314 H14R OL 1116 86.243 65.395 36.175 1.00 0.00 H ATOM 45315 H14S OL 1116 85.215 66.404 35.245 1.00 0.00 H ATOM 45316 C115 OL 1116 84.721 66.288 37.345 1.00 0.00 C ATOM 45317 H15R OL 1116 85.408 67.130 37.455 1.00 0.00 H ATOM 45318 H15S OL 1116 83.791 66.808 37.105 1.00 0.00 H ATOM 45319 C116 OL 1116 84.764 65.334 38.506 1.00 0.00 C ATOM 45320 H16R OL 1116 84.105 64.492 38.283 1.00 0.00 H ATOM 45321 H16S OL 1116 85.758 65.009 38.821 1.00 0.00 H ATOM 45322 C117 OL 1116 84.258 66.044 39.757 1.00 0.00 C ATOM 45323 H17R OL 1116 84.967 66.828 40.029 1.00 0.00 H ATOM 45324 H17S OL 1116 83.377 66.672 39.613 1.00 0.00 H ATOM 45325 C118 OL 1116 83.885 65.238 40.888 1.00 0.00 C ATOM 45326 H18R OL 1116 84.697 64.587 41.216 1.00 0.00 H ATOM 45327 H18S OL 1116 83.147 64.547 40.474 1.00 0.00 H ATOM 45328 H18T OL 1116 83.594 65.918 41.692 1.00 0.00 H TER 45329 OL 1116 ATOM 45329 C116 PA 1117 91.954 67.627 41.905 1.00 0.00 C ATOM 45330 H16R PA 1117 92.508 67.380 42.813 1.00 0.00 H ATOM 45331 H16S PA 1117 91.225 66.821 41.799 1.00 0.00 H ATOM 45332 H16T PA 1117 91.464 68.570 42.158 1.00 0.00 H ATOM 45333 C115 PA 1117 93.018 67.621 40.789 1.00 0.00 C ATOM 45334 H15R PA 1117 93.230 66.638 40.362 1.00 0.00 H ATOM 45335 H15S PA 1117 93.895 68.120 41.208 1.00 0.00 H ATOM 45336 C114 PA 1117 92.558 68.591 39.746 1.00 0.00 C ATOM 45337 H14R PA 1117 92.424 69.591 40.163 1.00 0.00 H ATOM 45338 H14S PA 1117 91.509 68.307 39.643 1.00 0.00 H ATOM 45339 C113 PA 1117 93.178 68.618 38.452 1.00 0.00 C ATOM 45340 H13R PA 1117 93.100 67.616 38.025 1.00 0.00 H ATOM 45341 H13S PA 1117 94.251 68.814 38.501 1.00 0.00 H ATOM 45342 C112 PA 1117 92.789 69.755 37.419 1.00 0.00 C ATOM 45343 H12R PA 1117 92.838 70.727 37.915 1.00 0.00 H ATOM 45344 H12S PA 1117 91.747 69.614 37.125 1.00 0.00 H ATOM 45345 C111 PA 1117 93.698 69.671 36.141 1.00 0.00 C ATOM 45346 H11R PA 1117 94.778 69.590 36.285 1.00 0.00 H ATOM 45347 H11S PA 1117 93.435 70.606 35.643 1.00 0.00 H ATOM 45348 C110 PA 1117 93.261 68.551 35.257 1.00 0.00 C ATOM 45349 H10R PA 1117 92.207 68.790 35.104 1.00 0.00 H ATOM 45350 H10S PA 1117 93.166 67.652 35.868 1.00 0.00 H ATOM 45351 C19 PA 1117 93.894 68.381 33.915 1.00 0.00 C ATOM 45352 H9R PA 1117 93.655 69.316 33.404 1.00 0.00 H ATOM 45353 H9S PA 1117 93.312 67.605 33.413 1.00 0.00 H ATOM 45354 C18 PA 1117 95.424 68.047 33.854 1.00 0.00 C ATOM 45355 H8R PA 1117 95.711 67.193 34.471 1.00 0.00 H ATOM 45356 H8S PA 1117 95.950 68.861 34.357 1.00 0.00 H ATOM 45357 C17 PA 1117 95.915 67.895 32.439 1.00 0.00 C ATOM 45358 H7R PA 1117 95.477 66.955 32.096 1.00 0.00 H ATOM 45359 H7S PA 1117 96.987 67.699 32.494 1.00 0.00 H ATOM 45360 C16 PA 1117 95.600 69.014 31.495 1.00 0.00 C ATOM 45361 H6R PA 1117 95.950 69.954 31.927 1.00 0.00 H ATOM 45362 H6S PA 1117 94.525 69.195 31.439 1.00 0.00 H ATOM 45363 C15 PA 1117 96.250 68.804 30.144 1.00 0.00 C ATOM 45364 H5R PA 1117 96.066 67.790 29.783 1.00 0.00 H ATOM 45365 H5S PA 1117 97.334 68.904 30.223 1.00 0.00 H ATOM 45366 C14 PA 1117 95.743 69.779 28.995 1.00 0.00 C ATOM 45367 H4R PA 1117 96.212 70.764 29.044 1.00 0.00 H ATOM 45368 H4S PA 1117 94.668 69.930 28.879 1.00 0.00 H ATOM 45369 C13 PA 1117 96.133 69.189 27.687 1.00 0.00 C ATOM 45370 H3R PA 1117 95.570 68.258 27.596 1.00 0.00 H ATOM 45371 H3S PA 1117 97.211 69.022 27.743 1.00 0.00 H ATOM 45372 C12 PA 1117 95.788 70.118 26.513 1.00 0.00 C ATOM 45373 H2R PA 1117 96.253 71.084 26.717 1.00 0.00 H ATOM 45374 H2S PA 1117 94.717 70.311 26.427 1.00 0.00 H ATOM 45375 C11 PC 1118 96.370 69.525 25.190 1.00 0.00 C ATOM 45376 O12 PC 1118 96.124 69.988 24.120 1.00 0.00 O ATOM 45377 O11 PC 1118 97.397 68.661 25.477 1.00 0.00 O ATOM 45378 C1 PC 1118 98.172 68.191 24.327 1.00 0.00 C ATOM 45379 HR PC 1118 98.546 69.047 23.760 1.00 0.00 H ATOM 45380 HS PC 1118 97.585 67.549 23.665 1.00 0.00 H ATOM 45381 C2 PC 1118 99.420 67.365 24.741 1.00 0.00 C ATOM 45382 HX PC 1118 100.023 67.966 25.427 1.00 0.00 H ATOM 45383 C3 PC 1118 100.257 67.062 23.433 1.00 0.00 C ATOM 45384 HA PC 1118 101.065 66.362 23.661 1.00 0.00 H ATOM 45385 HB PC 1118 100.721 68.010 23.149 1.00 0.00 H ATOM 45386 O31 PC 1118 99.485 66.586 22.350 1.00 0.00 O ATOM 45387 P31 PC 1118 100.078 66.517 20.896 1.00 0.00 P ATOM 45388 O32 PC 1118 101.135 65.376 20.907 1.00 0.00 O ATOM 45389 C31 PC 1118 102.098 65.127 19.902 1.00 0.00 C ATOM 45390 H1A PC 1118 102.798 65.956 19.774 1.00 0.00 H ATOM 45391 H1B PC 1118 101.535 64.844 19.008 1.00 0.00 H ATOM 45392 C32 PC 1118 102.921 63.948 20.474 1.00 0.00 C ATOM 45393 H2A PC 1118 103.212 64.208 21.493 1.00 0.00 H ATOM 45394 H2B PC 1118 103.809 63.789 19.861 1.00 0.00 H ATOM 45395 N31 PC 1118 102.224 62.611 20.497 1.00 0.00 N ATOM 45396 C33 PC 1118 101.612 62.189 19.259 1.00 0.00 C ATOM 45397 H3A PC 1118 101.425 61.131 19.452 1.00 0.00 H ATOM 45398 H3B PC 1118 102.396 62.284 18.506 1.00 0.00 H ATOM 45399 H3C PC 1118 100.770 62.882 19.262 1.00 0.00 H ATOM 45400 C34 PC 1118 103.269 61.628 20.816 1.00 0.00 C ATOM 45401 H4A PC 1118 103.967 61.502 19.987 1.00 0.00 H ATOM 45402 H4B PC 1118 102.737 60.711 21.070 1.00 0.00 H ATOM 45403 H4C PC 1118 103.844 61.999 21.666 1.00 0.00 H ATOM 45404 C35 PC 1118 101.247 62.569 21.591 1.00 0.00 C ATOM 45405 H5A PC 1118 100.605 63.439 21.445 1.00 0.00 H ATOM 45406 H5B PC 1118 101.857 62.604 22.495 1.00 0.00 H ATOM 45407 H5C PC 1118 100.673 61.643 21.543 1.00 0.00 H ATOM 45408 O33 PC 1118 98.909 66.042 20.155 1.00 0.00 O ATOM 45409 O34 PC 1118 100.655 67.858 20.524 1.00 0.00 O ATOM 45410 O21 PC 1118 98.991 66.113 25.357 1.00 0.00 O ATOM 45411 C21 PC 1118 99.905 65.334 25.960 1.00 0.00 C ATOM 45412 O22 PC 1118 100.959 65.691 26.385 1.00 0.00 O ATOM 45413 C12 OL 1119 99.504 63.819 25.941 1.00 0.00 C ATOM 45414 H2R OL 1119 98.416 63.744 25.986 1.00 0.00 H ATOM 45415 H2S OL 1119 99.694 63.453 24.930 1.00 0.00 H ATOM 45416 C13 OL 1119 100.263 63.061 26.963 1.00 0.00 C ATOM 45417 H3R OL 1119 100.225 61.992 26.745 1.00 0.00 H ATOM 45418 H3S OL 1119 101.336 63.259 26.912 1.00 0.00 H ATOM 45419 C14 OL 1119 99.800 63.249 28.464 1.00 0.00 C ATOM 45420 H4R OL 1119 100.059 64.231 28.865 1.00 0.00 H ATOM 45421 H4S OL 1119 98.732 63.047 28.576 1.00 0.00 H ATOM 45422 C15 OL 1119 100.538 62.292 29.418 1.00 0.00 C ATOM 45423 H5R OL 1119 100.731 61.320 28.960 1.00 0.00 H ATOM 45424 H5S OL 1119 101.553 62.693 29.408 1.00 0.00 H ATOM 45425 C16 OL 1119 100.154 62.152 30.843 1.00 0.00 C ATOM 45426 H6R OL 1119 100.286 63.087 31.392 1.00 0.00 H ATOM 45427 H6S OL 1119 99.135 61.796 31.006 1.00 0.00 H ATOM 45428 C17 OL 1119 100.969 61.079 31.577 1.00 0.00 C ATOM 45429 H7R OL 1119 100.568 60.150 31.167 1.00 0.00 H ATOM 45430 H7S OL 1119 102.013 61.304 31.347 1.00 0.00 H ATOM 45431 C18 OL 1119 100.644 61.020 33.135 1.00 0.00 C ATOM 45432 H8R OL 1119 100.956 61.956 33.603 1.00 0.00 H ATOM 45433 H8S OL 1119 99.563 60.885 33.211 1.00 0.00 H ATOM 45434 C19 OL 1119 101.271 59.885 33.880 1.00 0.00 C ATOM 45435 H9R OL 1119 102.075 59.290 33.454 1.00 0.00 H ATOM 45436 C110 OL 1119 100.841 59.420 35.045 1.00 0.00 C ATOM 45437 H10R OL 1119 101.355 58.554 35.454 1.00 0.00 H ATOM 45438 C111 OL 1119 99.670 60.045 35.747 1.00 0.00 C ATOM 45439 H11R OL 1119 99.410 60.993 35.270 1.00 0.00 H ATOM 45440 H11S OL 1119 98.777 59.428 35.633 1.00 0.00 H ATOM 45441 C112 OL 1119 100.077 60.136 37.229 1.00 0.00 C ATOM 45442 H12R OL 1119 100.551 59.162 37.368 1.00 0.00 H ATOM 45443 H12S OL 1119 100.868 60.852 37.465 1.00 0.00 H ATOM 45444 C113 OL 1119 98.837 60.332 38.188 1.00 0.00 C ATOM 45445 H13R OL 1119 98.022 59.673 37.881 1.00 0.00 H ATOM 45446 H13S OL 1119 99.099 59.945 39.175 1.00 0.00 H ATOM 45447 C114 OL 1119 98.413 61.773 38.392 1.00 0.00 C ATOM 45448 H14R OL 1119 99.238 62.347 38.818 1.00 0.00 H ATOM 45449 H14S OL 1119 98.206 62.227 37.421 1.00 0.00 H ATOM 45450 C115 OL 1119 97.165 61.851 39.364 1.00 0.00 C ATOM 45451 H15R OL 1119 97.502 61.182 40.158 1.00 0.00 H ATOM 45452 H15S OL 1119 97.016 62.870 39.725 1.00 0.00 H ATOM 45453 C116 OL 1119 95.954 61.197 38.820 1.00 0.00 C ATOM 45454 H16R OL 1119 95.589 61.789 37.978 1.00 0.00 H ATOM 45455 H16S OL 1119 96.011 60.156 38.494 1.00 0.00 H ATOM 45456 C117 OL 1119 94.936 61.008 39.911 1.00 0.00 C ATOM 45457 H17R OL 1119 95.337 60.432 40.747 1.00 0.00 H ATOM 45458 H17S OL 1119 94.640 61.928 40.419 1.00 0.00 H ATOM 45459 C118 OL 1119 93.597 60.381 39.387 1.00 0.00 C ATOM 45460 H18R OL 1119 92.709 61.016 39.366 1.00 0.00 H ATOM 45461 H18S OL 1119 93.291 59.571 40.053 1.00 0.00 H ATOM 45462 H18T OL 1119 93.839 59.950 38.413 1.00 0.00 H TER 45463 OL 1119 ATOM 45463 C116 PA 1120 65.106 103.161 36.813 1.00 0.00 C ATOM 45464 H16R PA 1120 65.247 103.679 37.763 1.00 0.00 H ATOM 45465 H16S PA 1120 64.945 102.098 37.006 1.00 0.00 H ATOM 45466 H16T PA 1120 64.345 103.752 36.297 1.00 0.00 H ATOM 45467 C115 PA 1120 66.407 103.391 36.145 1.00 0.00 C ATOM 45468 H15R PA 1120 66.533 104.472 36.062 1.00 0.00 H ATOM 45469 H15S PA 1120 66.554 103.167 35.086 1.00 0.00 H ATOM 45470 C114 PA 1120 67.536 102.759 36.975 1.00 0.00 C ATOM 45471 H14R PA 1120 67.462 103.219 37.963 1.00 0.00 H ATOM 45472 H14S PA 1120 68.485 103.018 36.501 1.00 0.00 H ATOM 45473 C113 PA 1120 67.559 101.204 37.248 1.00 0.00 C ATOM 45474 H13R PA 1120 66.793 100.910 37.967 1.00 0.00 H ATOM 45475 H13S PA 1120 68.573 100.943 37.558 1.00 0.00 H ATOM 45476 C112 PA 1120 67.395 100.361 35.931 1.00 0.00 C ATOM 45477 H12R PA 1120 68.073 100.683 35.138 1.00 0.00 H ATOM 45478 H12S PA 1120 66.371 100.578 35.617 1.00 0.00 H ATOM 45479 C111 PA 1120 67.535 98.837 36.243 1.00 0.00 C ATOM 45480 H11R PA 1120 67.131 98.250 35.415 1.00 0.00 H ATOM 45481 H11S PA 1120 67.031 98.617 37.186 1.00 0.00 H ATOM 45482 C110 PA 1120 69.002 98.280 36.354 1.00 0.00 C ATOM 45483 H10R PA 1120 69.512 98.842 37.139 1.00 0.00 H ATOM 45484 H10S PA 1120 69.458 98.661 35.438 1.00 0.00 H ATOM 45485 C19 PA 1120 69.151 96.752 36.353 1.00 0.00 C ATOM 45486 H9R PA 1120 68.912 96.331 35.374 1.00 0.00 H ATOM 45487 H9S PA 1120 68.431 96.369 37.079 1.00 0.00 H ATOM 45488 C18 PA 1120 70.605 96.343 36.790 1.00 0.00 C ATOM 45489 H8R PA 1120 70.802 96.825 37.750 1.00 0.00 H ATOM 45490 H8S PA 1120 71.348 96.843 36.165 1.00 0.00 H ATOM 45491 C17 PA 1120 70.874 94.856 36.688 1.00 0.00 C ATOM 45492 H7R PA 1120 70.268 94.273 37.384 1.00 0.00 H ATOM 45493 H7S PA 1120 71.877 94.855 37.119 1.00 0.00 H ATOM 45494 C16 PA 1120 70.698 94.358 35.268 1.00 0.00 C ATOM 45495 H6R PA 1120 71.424 94.960 34.718 1.00 0.00 H ATOM 45496 H6S PA 1120 69.651 94.522 35.005 1.00 0.00 H ATOM 45497 C15 PA 1120 70.896 92.904 35.204 1.00 0.00 C ATOM 45498 H5R PA 1120 70.100 92.313 35.664 1.00 0.00 H ATOM 45499 H5S PA 1120 71.833 92.641 35.699 1.00 0.00 H ATOM 45500 C14 PA 1120 70.862 92.482 33.753 1.00 0.00 C ATOM 45501 H4R PA 1120 71.474 93.226 33.240 1.00 0.00 H ATOM 45502 H4S PA 1120 69.824 92.629 33.447 1.00 0.00 H ATOM 45503 C13 PA 1120 71.185 90.991 33.429 1.00 0.00 C ATOM 45504 H3R PA 1120 70.576 90.462 32.692 1.00 0.00 H ATOM 45505 H3S PA 1120 71.006 90.415 34.340 1.00 0.00 H ATOM 45506 C12 PA 1120 72.616 90.733 33.032 1.00 0.00 C ATOM 45507 H2R PA 1120 72.725 89.699 32.696 1.00 0.00 H ATOM 45508 H2S PA 1120 73.346 90.857 33.835 1.00 0.00 H ATOM 45509 C11 PGR 1121 73.011 91.653 31.815 1.00 0.00 C ATOM 45510 O12 PGR 1121 74.112 92.194 31.598 1.00 0.00 O ATOM 45511 O11 PGR 1121 72.006 91.785 30.948 1.00 0.00 O ATOM 45512 C1 PGR 1121 72.157 92.578 29.740 1.00 0.00 C ATOM 45513 HR PGR 1121 71.448 92.216 28.990 1.00 0.00 H ATOM 45514 HS PGR 1121 73.188 92.483 29.391 1.00 0.00 H ATOM 45515 C2 PGR 1121 71.740 94.038 30.050 1.00 0.00 C ATOM 45516 HX PGR 1121 70.685 93.935 30.316 1.00 0.00 H ATOM 45517 C3 PGR 1121 71.937 94.928 28.857 1.00 0.00 C ATOM 45518 HA PGR 1121 71.928 95.979 29.157 1.00 0.00 H ATOM 45519 HB PGR 1121 71.043 94.733 28.260 1.00 0.00 H ATOM 45520 O31 PGR 1121 73.112 94.566 28.064 1.00 0.00 O ATOM 45521 P31 PGR 1121 73.344 95.449 26.885 1.00 0.00 P ATOM 45522 O32 PGR 1121 73.739 96.895 27.370 1.00 0.00 O ATOM 45523 C31 PGR 1121 74.955 97.128 27.967 1.00 0.00 C ATOM 45524 H1A PGR 1121 75.853 97.008 27.357 1.00 0.00 H ATOM 45525 H1B PGR 1121 75.018 96.482 28.847 1.00 0.00 H ATOM 45526 C32 PGR 1121 74.902 98.570 28.459 1.00 0.00 C ATOM 45527 H2A PGR 1121 74.038 98.665 29.122 1.00 0.00 H ATOM 45528 O35 PGR 1121 74.501 99.339 27.287 1.00 0.00 O ATOM 45529 HO5A PGR 1121 73.595 99.058 27.066 1.00 0.00 H ATOM 45530 C33 PGR 1121 76.156 99.122 29.226 1.00 0.00 C ATOM 45531 H3A PGR 1121 75.790 100.016 29.738 1.00 0.00 H ATOM 45532 H3B PGR 1121 76.483 98.406 29.985 1.00 0.00 H ATOM 45533 O33 PGR 1121 74.411 94.802 26.136 1.00 0.00 O ATOM 45534 O34 PGR 1121 72.053 95.739 26.183 1.00 0.00 O ATOM 45535 O21 PGR 1121 72.656 94.569 31.055 1.00 0.00 O ATOM 45536 C21 PGR 1121 72.216 95.653 31.695 1.00 0.00 C ATOM 45537 O22 PGR 1121 71.196 96.213 31.367 1.00 0.00 O ATOM 45538 O36 PGR 1121 77.215 99.387 28.334 1.00 0.00 O ATOM 45539 HO6A PGR 1121 78.045 99.492 28.833 1.00 0.00 H ATOM 45540 C12 OL 1122 73.119 96.161 32.792 1.00 0.00 C ATOM 45541 H2R OL 1122 73.163 95.395 33.570 1.00 0.00 H ATOM 45542 H2S OL 1122 74.123 96.332 32.398 1.00 0.00 H ATOM 45543 C13 OL 1122 72.675 97.512 33.412 1.00 0.00 C ATOM 45544 H3R OL 1122 71.645 97.509 33.774 1.00 0.00 H ATOM 45545 H3S OL 1122 73.282 97.707 34.299 1.00 0.00 H ATOM 45546 C14 OL 1122 72.907 98.758 32.507 1.00 0.00 C ATOM 45547 H4R OL 1122 73.940 98.779 32.154 1.00 0.00 H ATOM 45548 H4S OL 1122 72.245 98.727 31.639 1.00 0.00 H ATOM 45549 C15 OL 1122 72.641 100.044 33.151 1.00 0.00 C ATOM 45550 H5R OL 1122 72.469 100.768 32.352 1.00 0.00 H ATOM 45551 H5S OL 1122 71.642 100.117 33.587 1.00 0.00 H ATOM 45552 C16 OL 1122 73.744 100.418 34.230 1.00 0.00 C ATOM 45553 H6R OL 1122 73.861 99.725 35.066 1.00 0.00 H ATOM 45554 H6S OL 1122 74.716 100.477 33.736 1.00 0.00 H ATOM 45555 C17 OL 1122 73.601 101.803 34.773 1.00 0.00 C ATOM 45556 H7R OL 1122 74.532 102.193 35.190 1.00 0.00 H ATOM 45557 H7S OL 1122 73.552 102.460 33.903 1.00 0.00 H ATOM 45558 C18 OL 1122 72.389 102.073 35.709 1.00 0.00 C ATOM 45559 H8R OL 1122 71.491 101.556 35.364 1.00 0.00 H ATOM 45560 H8S OL 1122 72.710 101.733 36.696 1.00 0.00 H ATOM 45561 C19 OL 1122 72.078 103.545 35.671 1.00 0.00 C ATOM 45562 H9R OL 1122 71.671 103.905 34.730 1.00 0.00 H ATOM 45563 C110 OL 1122 72.159 104.445 36.656 1.00 0.00 C ATOM 45564 H10R OL 1122 71.784 105.419 36.354 1.00 0.00 H ATOM 45565 C111 OL 1122 72.733 104.347 38.054 1.00 0.00 C ATOM 45566 H11R OL 1122 73.287 103.409 38.123 1.00 0.00 H ATOM 45567 H11S OL 1122 73.463 105.148 38.191 1.00 0.00 H ATOM 45568 C112 OL 1122 71.651 104.451 39.112 1.00 0.00 C ATOM 45569 H12R OL 1122 71.264 105.464 38.988 1.00 0.00 H ATOM 45570 H12S OL 1122 70.921 103.785 38.647 1.00 0.00 H ATOM 45571 C113 OL 1122 72.079 104.176 40.539 1.00 0.00 C ATOM 45572 H13R OL 1122 72.512 103.177 40.616 1.00 0.00 H ATOM 45573 H13S OL 1122 72.830 104.883 40.897 1.00 0.00 H ATOM 45574 C114 OL 1122 70.990 104.339 41.506 1.00 0.00 C ATOM 45575 H14R OL 1122 71.350 104.373 42.536 1.00 0.00 H ATOM 45576 H14S OL 1122 70.623 105.357 41.362 1.00 0.00 H ATOM 45577 C115 OL 1122 69.901 103.260 41.331 1.00 0.00 C ATOM 45578 H15R OL 1122 69.623 103.198 40.277 1.00 0.00 H ATOM 45579 H15S OL 1122 70.295 102.291 41.643 1.00 0.00 H ATOM 45580 C116 OL 1122 68.697 103.478 42.187 1.00 0.00 C ATOM 45581 H16R OL 1122 69.178 103.350 43.159 1.00 0.00 H ATOM 45582 H16S OL 1122 68.353 104.512 42.256 1.00 0.00 H ATOM 45583 C117 OL 1122 67.504 102.516 42.091 1.00 0.00 C ATOM 45584 H17R OL 1122 67.901 101.518 42.290 1.00 0.00 H ATOM 45585 H17S OL 1122 66.829 102.578 42.947 1.00 0.00 H ATOM 45586 C118 OL 1122 66.743 102.487 40.702 1.00 0.00 C ATOM 45587 H18R OL 1122 66.012 103.297 40.664 1.00 0.00 H ATOM 45588 H18S OL 1122 66.238 101.519 40.738 1.00 0.00 H ATOM 45589 H18T OL 1122 67.399 102.460 39.829 1.00 0.00 H TER 45590 OL 1122 ATOM 45590 C116 PA 1123 89.415 28.517 37.564 1.00 0.00 C ATOM 45591 H16R PA 1123 88.864 27.602 37.337 1.00 0.00 H ATOM 45592 H16S PA 1123 88.777 29.180 38.152 1.00 0.00 H ATOM 45593 H16T PA 1123 90.356 28.429 38.111 1.00 0.00 H ATOM 45594 C115 PA 1123 89.541 29.276 36.244 1.00 0.00 C ATOM 45595 H15R PA 1123 88.691 29.302 35.558 1.00 0.00 H ATOM 45596 H15S PA 1123 90.250 28.770 35.586 1.00 0.00 H ATOM 45597 C114 PA 1123 89.853 30.773 36.432 1.00 0.00 C ATOM 45598 H14R PA 1123 90.242 31.120 35.472 1.00 0.00 H ATOM 45599 H14S PA 1123 90.597 30.998 37.199 1.00 0.00 H ATOM 45600 C113 PA 1123 88.582 31.634 36.709 1.00 0.00 C ATOM 45601 H13R PA 1123 87.824 31.097 37.283 1.00 0.00 H ATOM 45602 H13S PA 1123 88.031 31.732 35.771 1.00 0.00 H ATOM 45603 C112 PA 1123 88.746 32.999 37.347 1.00 0.00 C ATOM 45604 H12R PA 1123 89.223 32.993 38.330 1.00 0.00 H ATOM 45605 H12S PA 1123 87.736 33.338 37.585 1.00 0.00 H ATOM 45606 C111 PA 1123 89.586 33.927 36.382 1.00 0.00 C ATOM 45607 H11R PA 1123 89.333 33.988 35.321 1.00 0.00 H ATOM 45608 H11S PA 1123 90.559 33.433 36.434 1.00 0.00 H ATOM 45609 C110 PA 1123 89.711 35.310 37.010 1.00 0.00 C ATOM 45610 H10R PA 1123 90.308 35.377 37.922 1.00 0.00 H ATOM 45611 H10S PA 1123 88.693 35.528 37.339 1.00 0.00 H ATOM 45612 C19 PA 1123 90.215 36.389 36.072 1.00 0.00 C ATOM 45613 H9R PA 1123 89.968 37.352 36.524 1.00 0.00 H ATOM 45614 H9S PA 1123 89.671 36.318 35.128 1.00 0.00 H ATOM 45615 C18 PA 1123 91.690 36.387 35.831 1.00 0.00 C ATOM 45616 H8R PA 1123 91.989 35.341 35.740 1.00 0.00 H ATOM 45617 H8S PA 1123 92.206 36.650 36.757 1.00 0.00 H ATOM 45618 C17 PA 1123 92.227 37.145 34.610 1.00 0.00 C ATOM 45619 H7R PA 1123 91.877 38.173 34.718 1.00 0.00 H ATOM 45620 H7S PA 1123 91.798 36.599 33.766 1.00 0.00 H ATOM 45621 C16 PA 1123 93.785 37.282 34.360 1.00 0.00 C ATOM 45622 H6R PA 1123 94.161 36.257 34.340 1.00 0.00 H ATOM 45623 H6S PA 1123 94.370 37.725 35.169 1.00 0.00 H ATOM 45624 C15 PA 1123 94.061 37.979 33.033 1.00 0.00 C ATOM 45625 H5R PA 1123 94.026 39.037 33.300 1.00 0.00 H ATOM 45626 H5S PA 1123 93.248 37.718 32.352 1.00 0.00 H ATOM 45627 C14 PA 1123 95.470 37.564 32.539 1.00 0.00 C ATOM 45628 H4R PA 1123 95.558 36.475 32.523 1.00 0.00 H ATOM 45629 H4S PA 1123 96.236 38.094 33.109 1.00 0.00 H ATOM 45630 C13 PA 1123 95.638 38.047 31.101 1.00 0.00 C ATOM 45631 H3R PA 1123 95.404 39.114 31.075 1.00 0.00 H ATOM 45632 H3S PA 1123 94.906 37.596 30.428 1.00 0.00 H ATOM 45633 C12 PA 1123 97.016 37.968 30.524 1.00 0.00 C ATOM 45634 H2R PA 1123 97.536 37.008 30.514 1.00 0.00 H ATOM 45635 H2S PA 1123 97.683 38.570 31.144 1.00 0.00 H ATOM 45636 C11 PGR 1124 97.152 38.592 29.119 1.00 0.00 C ATOM 45637 O12 PGR 1124 97.844 38.059 28.249 1.00 0.00 O ATOM 45638 O11 PGR 1124 96.572 39.789 28.992 1.00 0.00 O ATOM 45639 C1 PGR 1124 96.730 40.594 27.757 1.00 0.00 C ATOM 45640 HR PGR 1124 95.917 41.323 27.812 1.00 0.00 H ATOM 45641 HS PGR 1124 96.557 40.030 26.837 1.00 0.00 H ATOM 45642 C2 PGR 1124 98.167 41.371 27.699 1.00 0.00 C ATOM 45643 HX PGR 1124 98.305 42.022 28.566 1.00 0.00 H ATOM 45644 C3 PGR 1124 98.436 42.257 26.442 1.00 0.00 C ATOM 45645 HA PGR 1124 99.339 42.870 26.505 1.00 0.00 H ATOM 45646 HB PGR 1124 97.572 42.906 26.278 1.00 0.00 H ATOM 45647 O31 PGR 1124 98.560 41.300 25.400 1.00 0.00 O ATOM 45648 P31 PGR 1124 98.446 41.686 23.875 1.00 0.00 P ATOM 45649 O32 PGR 1124 99.851 42.353 23.536 1.00 0.00 O ATOM 45650 C31 PGR 1124 100.985 41.511 23.489 1.00 0.00 C ATOM 45651 H1A PGR 1124 100.723 40.493 23.191 1.00 0.00 H ATOM 45652 H1B PGR 1124 101.471 41.461 24.467 1.00 0.00 H ATOM 45653 C32 PGR 1124 102.080 41.958 22.411 1.00 0.00 C ATOM 45654 H2A PGR 1124 103.040 41.597 22.787 1.00 0.00 H ATOM 45655 O35 PGR 1124 102.074 43.469 22.322 1.00 0.00 O ATOM 45656 HO5A PGR 1124 102.240 43.855 23.201 1.00 0.00 H ATOM 45657 C33 PGR 1124 101.952 41.436 21.027 1.00 0.00 C ATOM 45658 H3A PGR 1124 102.849 41.646 20.439 1.00 0.00 H ATOM 45659 H3B PGR 1124 101.855 40.348 21.058 1.00 0.00 H ATOM 45660 O33 PGR 1124 98.286 40.438 23.172 1.00 0.00 O ATOM 45661 O34 PGR 1124 97.435 42.802 23.691 1.00 0.00 O ATOM 45662 O21 PGR 1124 99.101 40.264 27.627 1.00 0.00 O ATOM 45663 C21 PGR 1124 100.397 40.550 27.799 1.00 0.00 C ATOM 45664 O22 PGR 1124 100.825 41.663 28.111 1.00 0.00 O ATOM 45665 O36 PGR 1124 100.896 42.106 20.338 1.00 0.00 O ATOM 45666 HO6A PGR 1124 100.901 41.852 19.397 1.00 0.00 H ATOM 45667 C12 OL 1125 101.294 39.424 27.303 1.00 0.00 C ATOM 45668 H2R OL 1125 100.667 38.616 26.918 1.00 0.00 H ATOM 45669 H2S OL 1125 101.805 39.720 26.384 1.00 0.00 H ATOM 45670 C13 OL 1125 102.203 38.952 28.435 1.00 0.00 C ATOM 45671 H3R OL 1125 102.786 38.160 27.960 1.00 0.00 H ATOM 45672 H3S OL 1125 103.045 39.625 28.607 1.00 0.00 H ATOM 45673 C14 OL 1125 101.577 38.285 29.685 1.00 0.00 C ATOM 45674 H4R OL 1125 100.704 38.914 29.873 1.00 0.00 H ATOM 45675 H4S OL 1125 101.194 37.295 29.429 1.00 0.00 H ATOM 45676 C15 OL 1125 102.526 38.032 30.896 1.00 0.00 C ATOM 45677 H5R OL 1125 103.282 37.342 30.516 1.00 0.00 H ATOM 45678 H5S OL 1125 103.125 38.906 31.160 1.00 0.00 H ATOM 45679 C16 OL 1125 101.676 37.623 32.120 1.00 0.00 C ATOM 45680 H6R OL 1125 102.321 37.544 32.997 1.00 0.00 H ATOM 45681 H6S OL 1125 100.851 38.331 32.219 1.00 0.00 H ATOM 45682 C17 OL 1125 101.097 36.189 32.108 1.00 0.00 C ATOM 45683 H7R OL 1125 100.373 36.114 31.294 1.00 0.00 H ATOM 45684 H7S OL 1125 101.753 35.404 31.727 1.00 0.00 H ATOM 45685 C18 OL 1125 100.464 35.810 33.476 1.00 0.00 C ATOM 45686 H8R OL 1125 100.015 34.816 33.418 1.00 0.00 H ATOM 45687 H8S OL 1125 101.275 35.792 34.207 1.00 0.00 H ATOM 45688 C19 OL 1125 99.404 36.904 33.842 1.00 0.00 C ATOM 45689 H9R OL 1125 99.400 37.794 33.217 1.00 0.00 H ATOM 45690 C110 OL 1125 98.611 36.779 34.889 1.00 0.00 C ATOM 45691 H10R OL 1125 97.932 37.626 34.943 1.00 0.00 H ATOM 45692 C111 OL 1125 98.428 35.659 35.929 1.00 0.00 C ATOM 45693 H11R OL 1125 98.354 34.617 35.614 1.00 0.00 H ATOM 45694 H11S OL 1125 99.229 35.622 36.671 1.00 0.00 H ATOM 45695 C112 OL 1125 97.225 35.872 36.809 1.00 0.00 C ATOM 45696 H12R OL 1125 97.513 36.476 37.672 1.00 0.00 H ATOM 45697 H12S OL 1125 96.468 36.433 36.256 1.00 0.00 H ATOM 45698 C113 OL 1125 96.532 34.611 37.205 1.00 0.00 C ATOM 45699 H13R OL 1125 96.181 34.229 36.244 1.00 0.00 H ATOM 45700 H13S OL 1125 97.309 33.931 37.560 1.00 0.00 H ATOM 45701 C114 OL 1125 95.295 34.754 38.121 1.00 0.00 C ATOM 45702 H14R OL 1125 95.604 35.257 39.039 1.00 0.00 H ATOM 45703 H14S OL 1125 94.510 35.436 37.786 1.00 0.00 H ATOM 45704 C115 OL 1125 94.632 33.479 38.582 1.00 0.00 C ATOM 45705 H15R OL 1125 94.173 33.135 37.653 1.00 0.00 H ATOM 45706 H15S OL 1125 95.379 32.761 38.928 1.00 0.00 H ATOM 45707 C116 OL 1125 93.594 33.626 39.716 1.00 0.00 C ATOM 45708 H16R OL 1125 93.107 32.650 39.667 1.00 0.00 H ATOM 45709 H16S OL 1125 94.139 33.676 40.661 1.00 0.00 H ATOM 45710 C117 OL 1125 92.478 34.858 39.649 1.00 0.00 C ATOM 45711 H17R OL 1125 92.160 34.929 38.607 1.00 0.00 H ATOM 45712 H17S OL 1125 91.631 34.573 40.276 1.00 0.00 H ATOM 45713 C118 OL 1125 93.069 36.263 40.005 1.00 0.00 C ATOM 45714 H18R OL 1125 92.430 37.091 40.318 1.00 0.00 H ATOM 45715 H18S OL 1125 93.606 36.663 39.142 1.00 0.00 H ATOM 45716 H18T OL 1125 93.867 36.270 40.750 1.00 0.00 H TER 45717 OL 1125 ATOM 45717 C116 PA 1126 44.389 122.461 39.619 1.00 0.00 C ATOM 45718 H16R PA 1126 45.465 122.421 39.439 1.00 0.00 H ATOM 45719 H16S PA 1126 44.169 121.735 40.405 1.00 0.00 H ATOM 45720 H16T PA 1126 44.162 123.435 40.059 1.00 0.00 H ATOM 45721 C115 PA 1126 43.456 122.226 38.508 1.00 0.00 C ATOM 45722 H15R PA 1126 43.483 122.975 37.714 1.00 0.00 H ATOM 45723 H15S PA 1126 42.417 122.287 38.839 1.00 0.00 H ATOM 45724 C114 PA 1126 43.667 120.769 37.972 1.00 0.00 C ATOM 45725 H14R PA 1126 43.233 120.087 38.707 1.00 0.00 H ATOM 45726 H14S PA 1126 44.750 120.651 37.898 1.00 0.00 H ATOM 45727 C113 PA 1126 43.055 120.354 36.680 1.00 0.00 C ATOM 45728 H13R PA 1126 42.867 121.155 35.961 1.00 0.00 H ATOM 45729 H13S PA 1126 42.085 120.023 37.057 1.00 0.00 H ATOM 45730 C112 PA 1126 43.788 119.211 36.001 1.00 0.00 C ATOM 45731 H12R PA 1126 43.679 118.377 36.698 1.00 0.00 H ATOM 45732 H12S PA 1126 44.801 119.583 35.830 1.00 0.00 H ATOM 45733 C111 PA 1126 43.171 118.810 34.671 1.00 0.00 C ATOM 45734 H11R PA 1126 43.324 119.691 34.045 1.00 0.00 H ATOM 45735 H11S PA 1126 42.101 118.601 34.735 1.00 0.00 H ATOM 45736 C110 PA 1126 43.859 117.546 34.079 1.00 0.00 C ATOM 45737 H10R PA 1126 44.946 117.602 34.165 1.00 0.00 H ATOM 45738 H10S PA 1126 43.581 117.615 33.025 1.00 0.00 H ATOM 45739 C19 PA 1126 43.384 116.200 34.655 1.00 0.00 C ATOM 45740 H9R PA 1126 42.299 116.079 34.612 1.00 0.00 H ATOM 45741 H9S PA 1126 43.487 116.280 35.740 1.00 0.00 H ATOM 45742 C18 PA 1126 44.009 114.964 34.066 1.00 0.00 C ATOM 45743 H8R PA 1126 44.076 114.270 34.907 1.00 0.00 H ATOM 45744 H8S PA 1126 45.085 115.041 33.901 1.00 0.00 H ATOM 45745 C17 PA 1126 43.357 114.354 32.852 1.00 0.00 C ATOM 45746 H7R PA 1126 43.583 115.025 32.021 1.00 0.00 H ATOM 45747 H7S PA 1126 42.283 114.453 33.027 1.00 0.00 H ATOM 45748 C16 PA 1126 43.896 112.968 32.558 1.00 0.00 C ATOM 45749 H6R PA 1126 43.485 112.304 33.321 1.00 0.00 H ATOM 45750 H6S PA 1126 44.971 112.986 32.751 1.00 0.00 H ATOM 45751 C15 PA 1126 43.530 112.285 31.188 1.00 0.00 C ATOM 45752 H5R PA 1126 42.450 112.124 31.161 1.00 0.00 H ATOM 45753 H5S PA 1126 44.052 111.326 31.195 1.00 0.00 H ATOM 45754 C14 PA 1126 44.025 113.063 29.991 1.00 0.00 C ATOM 45755 H4R PA 1126 45.115 113.110 29.946 1.00 0.00 H ATOM 45756 H4S PA 1126 43.858 114.116 30.226 1.00 0.00 H ATOM 45757 C13 PA 1126 43.490 112.516 28.622 1.00 0.00 C ATOM 45758 H3R PA 1126 43.562 113.320 27.886 1.00 0.00 H ATOM 45759 H3S PA 1126 42.505 112.070 28.773 1.00 0.00 H ATOM 45760 C12 PA 1126 44.255 111.331 28.003 1.00 0.00 C ATOM 45761 H2R PA 1126 43.829 110.498 28.566 1.00 0.00 H ATOM 45762 H2S PA 1126 45.304 111.386 28.301 1.00 0.00 H ATOM 45763 C11 PC 1127 44.061 111.100 26.496 1.00 0.00 C ATOM 45764 O12 PC 1127 43.928 111.996 25.643 1.00 0.00 O ATOM 45765 O11 PC 1127 44.130 109.822 26.093 1.00 0.00 O ATOM 45766 C1 PC 1127 44.041 109.592 24.656 1.00 0.00 C ATOM 45767 HR PC 1127 43.223 110.143 24.185 1.00 0.00 H ATOM 45768 HS PC 1127 43.990 108.512 24.499 1.00 0.00 H ATOM 45769 C2 PC 1127 45.390 110.021 24.022 1.00 0.00 C ATOM 45770 HX PC 1127 45.757 110.965 24.431 1.00 0.00 H ATOM 45771 C3 PC 1127 45.405 110.119 22.508 1.00 0.00 C ATOM 45772 HA PC 1127 46.385 110.352 22.086 1.00 0.00 H ATOM 45773 HB PC 1127 44.713 110.870 22.118 1.00 0.00 H ATOM 45774 O31 PC 1127 44.923 108.906 21.926 1.00 0.00 O ATOM 45775 P31 PC 1127 44.498 108.849 20.356 1.00 0.00 P ATOM 45776 O32 PC 1127 45.913 108.851 19.586 1.00 0.00 O ATOM 45777 C31 PC 1127 46.586 107.657 19.543 1.00 0.00 C ATOM 45778 H1A PC 1127 45.909 106.904 19.131 1.00 0.00 H ATOM 45779 H1B PC 1127 46.899 107.403 20.559 1.00 0.00 H ATOM 45780 C32 PC 1127 47.912 107.965 18.731 1.00 0.00 C ATOM 45781 H2A PC 1127 48.587 107.157 19.016 1.00 0.00 H ATOM 45782 H2B PC 1127 48.117 109.005 18.989 1.00 0.00 H ATOM 45783 N31 PC 1127 47.849 108.054 17.266 1.00 0.00 N ATOM 45784 C33 PC 1127 49.270 108.234 16.852 1.00 0.00 C ATOM 45785 H3A PC 1127 49.254 108.305 15.763 1.00 0.00 H ATOM 45786 H3B PC 1127 49.905 107.407 17.173 1.00 0.00 H ATOM 45787 H3C PC 1127 49.586 109.148 17.357 1.00 0.00 H ATOM 45788 C34 PC 1127 47.436 106.827 16.650 1.00 0.00 C ATOM 45789 H4A PC 1127 46.405 106.576 16.903 1.00 0.00 H ATOM 45790 H4B PC 1127 48.165 106.028 16.794 1.00 0.00 H ATOM 45791 H4C PC 1127 47.433 107.027 15.578 1.00 0.00 H ATOM 45792 C35 PC 1127 47.009 109.200 16.730 1.00 0.00 C ATOM 45793 H5A PC 1127 47.001 109.997 17.474 1.00 0.00 H ATOM 45794 H5B PC 1127 45.994 108.805 16.668 1.00 0.00 H ATOM 45795 H5C PC 1127 47.345 109.573 15.762 1.00 0.00 H ATOM 45796 O33 PC 1127 43.895 107.541 20.014 1.00 0.00 O ATOM 45797 O34 PC 1127 43.852 110.083 19.959 1.00 0.00 O ATOM 45798 O21 PC 1127 46.372 109.092 24.533 1.00 0.00 O ATOM 45799 C21 PC 1127 47.682 109.245 24.333 1.00 0.00 C ATOM 45800 O22 PC 1127 48.200 110.175 23.691 1.00 0.00 O ATOM 45801 C12 OL 1128 48.559 108.234 25.121 1.00 0.00 C ATOM 45802 H2R OL 1128 47.925 107.375 25.350 1.00 0.00 H ATOM 45803 H2S OL 1128 49.368 107.852 24.494 1.00 0.00 H ATOM 45804 C13 OL 1128 49.201 108.807 26.373 1.00 0.00 C ATOM 45805 H3R OL 1128 49.838 109.594 25.964 1.00 0.00 H ATOM 45806 H3S OL 1128 48.400 109.283 26.942 1.00 0.00 H ATOM 45807 C14 OL 1128 49.922 107.775 27.156 1.00 0.00 C ATOM 45808 H4R OL 1128 49.390 106.832 27.294 1.00 0.00 H ATOM 45809 H4S OL 1128 50.752 107.497 26.503 1.00 0.00 H ATOM 45810 C15 OL 1128 50.300 108.377 28.550 1.00 0.00 C ATOM 45811 H5R OL 1128 50.923 109.251 28.350 1.00 0.00 H ATOM 45812 H5S OL 1128 49.455 108.824 29.079 1.00 0.00 H ATOM 45813 C16 OL 1128 51.051 107.490 29.549 1.00 0.00 C ATOM 45814 H6R OL 1128 51.306 108.029 30.463 1.00 0.00 H ATOM 45815 H6S OL 1128 50.295 106.804 29.937 1.00 0.00 H ATOM 45816 C17 OL 1128 52.270 106.802 28.927 1.00 0.00 C ATOM 45817 H7R OL 1128 52.037 106.397 27.940 1.00 0.00 H ATOM 45818 H7S OL 1128 53.008 107.564 28.669 1.00 0.00 H ATOM 45819 C18 OL 1128 52.793 105.751 29.786 1.00 0.00 C ATOM 45820 H8R OL 1128 53.186 106.190 30.705 1.00 0.00 H ATOM 45821 H8S OL 1128 52.001 105.126 30.205 1.00 0.00 H ATOM 45822 C19 OL 1128 53.905 104.868 29.276 1.00 0.00 C ATOM 45823 H9R OL 1128 54.914 105.192 29.516 1.00 0.00 H ATOM 45824 C110 OL 1128 53.693 103.744 28.553 1.00 0.00 C ATOM 45825 H10R OL 1128 54.609 103.209 28.315 1.00 0.00 H ATOM 45826 C111 OL 1128 52.352 103.203 28.146 1.00 0.00 C ATOM 45827 H11R OL 1128 51.553 103.859 28.499 1.00 0.00 H ATOM 45828 H11S OL 1128 52.280 103.163 27.057 1.00 0.00 H ATOM 45829 C112 OL 1128 52.211 101.796 28.771 1.00 0.00 C ATOM 45830 H12R OL 1128 51.216 101.469 28.463 1.00 0.00 H ATOM 45831 H12S OL 1128 52.911 101.149 28.239 1.00 0.00 H ATOM 45832 C113 OL 1128 52.431 101.722 30.249 1.00 0.00 C ATOM 45833 H13R OL 1128 53.432 102.023 30.567 1.00 0.00 H ATOM 45834 H13S OL 1128 51.740 102.395 30.760 1.00 0.00 H ATOM 45835 C114 OL 1128 52.329 100.269 30.631 1.00 0.00 C ATOM 45836 H14R OL 1128 51.371 99.842 30.329 1.00 0.00 H ATOM 45837 H14S OL 1128 53.114 99.752 30.074 1.00 0.00 H ATOM 45838 C115 OL 1128 52.674 99.982 32.103 1.00 0.00 C ATOM 45839 H15R OL 1128 53.394 100.772 32.324 1.00 0.00 H ATOM 45840 H15S OL 1128 51.876 100.286 32.784 1.00 0.00 H ATOM 45841 C116 OL 1128 53.209 98.610 32.523 1.00 0.00 C ATOM 45842 H16R OL 1128 52.455 97.850 32.307 1.00 0.00 H ATOM 45843 H16S OL 1128 53.968 98.277 31.813 1.00 0.00 H ATOM 45844 C117 OL 1128 53.753 98.494 33.978 1.00 0.00 C ATOM 45845 H17R OL 1128 54.183 99.473 34.200 1.00 0.00 H ATOM 45846 H17S OL 1128 52.965 98.409 34.728 1.00 0.00 H ATOM 45847 C118 OL 1128 54.760 97.324 34.203 1.00 0.00 C ATOM 45848 H18R OL 1128 54.152 96.419 34.136 1.00 0.00 H ATOM 45849 H18S OL 1128 55.206 97.340 35.199 1.00 0.00 H ATOM 45850 H18T OL 1128 55.619 97.419 33.536 1.00 0.00 H TER 45851 OL 1128 ATOM 45851 C116 PA 1129 29.506 96.107 42.945 1.00 0.00 C ATOM 45852 H16R PA 1129 30.152 96.739 42.333 1.00 0.00 H ATOM 45853 H16S PA 1129 29.730 95.056 42.752 1.00 0.00 H ATOM 45854 H16T PA 1129 29.707 96.434 43.968 1.00 0.00 H ATOM 45855 C115 PA 1129 28.142 96.565 42.590 1.00 0.00 C ATOM 45856 H15R PA 1129 28.272 97.643 42.475 1.00 0.00 H ATOM 45857 H15S PA 1129 27.405 96.323 43.359 1.00 0.00 H ATOM 45858 C114 PA 1129 27.593 95.776 41.346 1.00 0.00 C ATOM 45859 H14R PA 1129 26.514 95.929 41.267 1.00 0.00 H ATOM 45860 H14S PA 1129 27.693 94.698 41.493 1.00 0.00 H ATOM 45861 C113 PA 1129 28.294 95.953 40.049 1.00 0.00 C ATOM 45862 H13R PA 1129 29.354 95.730 40.192 1.00 0.00 H ATOM 45863 H13S PA 1129 28.356 97.018 39.816 1.00 0.00 H ATOM 45864 C112 PA 1129 27.748 95.088 38.932 1.00 0.00 C ATOM 45865 H12R PA 1129 26.686 95.303 38.792 1.00 0.00 H ATOM 45866 H12S PA 1129 27.854 94.053 39.263 1.00 0.00 H ATOM 45867 C111 PA 1129 28.263 95.132 37.415 1.00 0.00 C ATOM 45868 H11R PA 1129 27.471 94.811 36.734 1.00 0.00 H ATOM 45869 H11S PA 1129 29.186 94.550 37.372 1.00 0.00 H ATOM 45870 C110 PA 1129 28.706 96.537 36.949 1.00 0.00 C ATOM 45871 H10R PA 1129 29.592 97.002 37.385 1.00 0.00 H ATOM 45872 H10S PA 1129 27.894 97.241 37.143 1.00 0.00 H ATOM 45873 C19 PA 1129 28.960 96.578 35.408 1.00 0.00 C ATOM 45874 H9R PA 1129 28.133 96.079 34.900 1.00 0.00 H ATOM 45875 H9S PA 1129 29.860 96.043 35.098 1.00 0.00 H ATOM 45876 C18 PA 1129 28.860 97.987 34.795 1.00 0.00 C ATOM 45877 H8R PA 1129 28.974 97.945 33.710 1.00 0.00 H ATOM 45878 H8S PA 1129 29.748 98.427 35.253 1.00 0.00 H ATOM 45879 C17 PA 1129 27.705 98.841 35.164 1.00 0.00 C ATOM 45880 H7R PA 1129 27.679 99.143 36.213 1.00 0.00 H ATOM 45881 H7S PA 1129 26.786 98.253 35.129 1.00 0.00 H ATOM 45882 C16 PA 1129 27.566 99.938 34.133 1.00 0.00 C ATOM 45883 H6R PA 1129 27.751 99.490 33.155 1.00 0.00 H ATOM 45884 H6S PA 1129 28.333 100.693 34.317 1.00 0.00 H ATOM 45885 C15 PA 1129 26.222 100.598 34.048 1.00 0.00 C ATOM 45886 H5R PA 1129 25.939 101.095 34.979 1.00 0.00 H ATOM 45887 H5S PA 1129 25.475 99.808 33.949 1.00 0.00 H ATOM 45888 C14 PA 1129 26.164 101.749 32.940 1.00 0.00 C ATOM 45889 H4R PA 1129 26.447 101.363 31.959 1.00 0.00 H ATOM 45890 H4S PA 1129 26.968 102.441 33.202 1.00 0.00 H ATOM 45891 C13 PA 1129 24.782 102.371 32.785 1.00 0.00 C ATOM 45892 H3R PA 1129 24.782 103.357 33.255 1.00 0.00 H ATOM 45893 H3S PA 1129 24.082 101.719 33.312 1.00 0.00 H ATOM 45894 C12 PA 1129 24.300 102.565 31.401 1.00 0.00 C ATOM 45895 H2R PA 1129 23.286 102.962 31.476 1.00 0.00 H ATOM 45896 H2S PA 1129 24.313 101.619 30.855 1.00 0.00 H ATOM 45897 C11 PC 1130 25.132 103.549 30.735 1.00 0.00 C ATOM 45898 O12 PC 1130 26.121 103.252 30.024 1.00 0.00 O ATOM 45899 O11 PC 1130 24.712 104.773 30.952 1.00 0.00 O ATOM 45900 C1 PC 1130 25.278 105.828 30.201 1.00 0.00 C ATOM 45901 HR PC 1130 26.315 105.676 29.890 1.00 0.00 H ATOM 45902 HS PC 1130 25.099 106.734 30.785 1.00 0.00 H ATOM 45903 C2 PC 1130 24.536 106.054 28.860 1.00 0.00 C ATOM 45904 HX PC 1130 24.356 105.072 28.415 1.00 0.00 H ATOM 45905 C3 PC 1130 25.415 106.940 27.974 1.00 0.00 C ATOM 45906 HA PC 1130 26.382 106.447 27.847 1.00 0.00 H ATOM 45907 HB PC 1130 25.560 107.912 28.452 1.00 0.00 H ATOM 45908 O31 PC 1130 24.807 107.087 26.678 1.00 0.00 O ATOM 45909 P31 PC 1130 25.496 108.172 25.663 1.00 0.00 P ATOM 45910 O32 PC 1130 26.692 107.291 24.896 1.00 0.00 O ATOM 45911 C31 PC 1130 27.817 106.915 25.590 1.00 0.00 C ATOM 45912 H1A PC 1130 27.585 106.201 26.384 1.00 0.00 H ATOM 45913 H1B PC 1130 28.212 107.819 26.061 1.00 0.00 H ATOM 45914 C32 PC 1130 28.838 106.346 24.562 1.00 0.00 C ATOM 45915 H2A PC 1130 29.747 106.149 25.132 1.00 0.00 H ATOM 45916 H2B PC 1130 28.960 107.111 23.794 1.00 0.00 H ATOM 45917 N31 PC 1130 28.523 105.137 23.869 1.00 0.00 N ATOM 45918 C33 PC 1130 29.778 104.709 23.386 1.00 0.00 C ATOM 45919 H3A PC 1130 30.109 105.603 22.855 1.00 0.00 H ATOM 45920 H3B PC 1130 29.645 103.855 22.719 1.00 0.00 H ATOM 45921 H3C PC 1130 30.498 104.584 24.196 1.00 0.00 H ATOM 45922 C34 PC 1130 28.071 103.962 24.785 1.00 0.00 C ATOM 45923 H4A PC 1130 28.742 103.997 25.644 1.00 0.00 H ATOM 45924 H4B PC 1130 28.005 102.989 24.296 1.00 0.00 H ATOM 45925 H4C PC 1130 27.101 104.306 25.149 1.00 0.00 H ATOM 45926 C35 PC 1130 27.602 105.311 22.798 1.00 0.00 C ATOM 45927 H5A PC 1130 26.663 105.673 23.221 1.00 0.00 H ATOM 45928 H5B PC 1130 27.315 104.352 22.364 1.00 0.00 H ATOM 45929 H5C PC 1130 28.115 105.966 22.093 1.00 0.00 H ATOM 45930 O33 PC 1130 24.485 108.554 24.599 1.00 0.00 O ATOM 45931 O34 PC 1130 26.035 109.274 26.564 1.00 0.00 O ATOM 45932 O21 PC 1130 23.215 106.690 29.045 1.00 0.00 O ATOM 45933 C21 PC 1130 22.074 105.993 29.438 1.00 0.00 C ATOM 45934 O22 PC 1130 22.136 104.776 29.569 1.00 0.00 O ATOM 45935 C12 OL 1131 20.843 106.737 29.794 1.00 0.00 C ATOM 45936 H2R OL 1131 20.263 107.031 28.917 1.00 0.00 H ATOM 45937 H2S OL 1131 20.142 106.066 30.296 1.00 0.00 H ATOM 45938 C13 OL 1131 21.130 108.056 30.674 1.00 0.00 C ATOM 45939 H3R OL 1131 21.705 108.851 30.196 1.00 0.00 H ATOM 45940 H3S OL 1131 20.140 108.454 30.906 1.00 0.00 H ATOM 45941 C14 OL 1131 21.766 107.805 31.962 1.00 0.00 C ATOM 45942 H4R OL 1131 22.767 107.405 31.786 1.00 0.00 H ATOM 45943 H4S OL 1131 21.889 108.738 32.516 1.00 0.00 H ATOM 45944 C15 OL 1131 21.035 106.751 32.805 1.00 0.00 C ATOM 45945 H5R OL 1131 20.058 107.220 32.946 1.00 0.00 H ATOM 45946 H5S OL 1131 20.924 105.813 32.257 1.00 0.00 H ATOM 45947 C16 OL 1131 21.736 106.454 34.168 1.00 0.00 C ATOM 45948 H6R OL 1131 21.665 107.337 34.807 1.00 0.00 H ATOM 45949 H6S OL 1131 21.281 105.525 34.517 1.00 0.00 H ATOM 45950 C17 OL 1131 23.280 106.167 34.122 1.00 0.00 C ATOM 45951 H7R OL 1131 23.367 105.356 33.396 1.00 0.00 H ATOM 45952 H7S OL 1131 23.717 107.031 33.617 1.00 0.00 H ATOM 45953 C18 OL 1131 23.941 105.961 35.479 1.00 0.00 C ATOM 45954 H8R OL 1131 25.013 106.060 35.294 1.00 0.00 H ATOM 45955 H8S OL 1131 23.670 106.806 36.116 1.00 0.00 H ATOM 45956 C19 OL 1131 23.593 104.694 36.249 1.00 0.00 C ATOM 45957 H9R OL 1131 24.199 103.873 35.873 1.00 0.00 H ATOM 45958 C110 OL 1131 22.704 104.509 37.208 1.00 0.00 C ATOM 45959 H10R OL 1131 22.727 103.512 37.640 1.00 0.00 H ATOM 45960 C111 OL 1131 21.728 105.435 37.782 1.00 0.00 C ATOM 45961 H11R OL 1131 21.872 106.441 37.384 1.00 0.00 H ATOM 45962 H11S OL 1131 20.737 105.237 37.367 1.00 0.00 H ATOM 45963 C112 OL 1131 21.723 105.556 39.287 1.00 0.00 C ATOM 45964 H12R OL 1131 21.272 104.633 39.660 1.00 0.00 H ATOM 45965 H12S OL 1131 22.749 105.570 39.661 1.00 0.00 H ATOM 45966 C113 OL 1131 21.065 106.727 39.975 1.00 0.00 C ATOM 45967 H13R OL 1131 21.351 107.690 39.548 1.00 0.00 H ATOM 45968 H13S OL 1131 19.975 106.770 39.929 1.00 0.00 H ATOM 45969 C114 OL 1131 21.496 106.862 41.414 1.00 0.00 C ATOM 45970 H14R OL 1131 22.586 106.829 41.481 1.00 0.00 H ATOM 45971 H14S OL 1131 21.211 107.851 41.776 1.00 0.00 H ATOM 45972 C115 OL 1131 20.832 105.746 42.286 1.00 0.00 C ATOM 45973 H15R OL 1131 19.796 105.521 42.024 1.00 0.00 H ATOM 45974 H15S OL 1131 21.491 104.880 42.376 1.00 0.00 H ATOM 45975 C116 OL 1131 20.556 106.183 43.820 1.00 0.00 C ATOM 45976 H16R OL 1131 21.576 106.295 44.193 1.00 0.00 H ATOM 45977 H16S OL 1131 20.205 107.217 43.809 1.00 0.00 H ATOM 45978 C117 OL 1131 19.797 105.225 44.753 1.00 0.00 C ATOM 45979 H17R OL 1131 20.430 104.373 45.009 1.00 0.00 H ATOM 45980 H17S OL 1131 19.506 105.678 45.704 1.00 0.00 H ATOM 45981 C118 OL 1131 18.459 104.778 44.181 1.00 0.00 C ATOM 45982 H18R OL 1131 17.683 105.546 44.159 1.00 0.00 H ATOM 45983 H18S OL 1131 18.106 104.004 44.865 1.00 0.00 H ATOM 45984 H18T OL 1131 18.566 104.260 43.225 1.00 0.00 H TER 45985 OL 1131 ATOM 45985 C116 PA 1132 134.555 97.004 42.166 1.00 0.00 C ATOM 45986 H16R PA 1132 135.515 97.065 42.683 1.00 0.00 H ATOM 45987 H16S PA 1132 134.769 96.541 41.200 1.00 0.00 H ATOM 45988 H16T PA 1132 133.945 96.292 42.724 1.00 0.00 H ATOM 45989 C115 PA 1132 133.902 98.368 42.004 1.00 0.00 C ATOM 45990 H15R PA 1132 134.226 98.889 42.907 1.00 0.00 H ATOM 45991 H15S PA 1132 132.813 98.291 42.015 1.00 0.00 H ATOM 45992 C114 PA 1132 134.377 99.227 40.797 1.00 0.00 C ATOM 45993 H14R PA 1132 134.145 98.559 39.965 1.00 0.00 H ATOM 45994 H14S PA 1132 135.457 99.317 40.932 1.00 0.00 H ATOM 45995 C113 PA 1132 133.622 100.496 40.584 1.00 0.00 C ATOM 45996 H13R PA 1132 134.070 101.222 41.266 1.00 0.00 H ATOM 45997 H13S PA 1132 132.582 100.556 40.911 1.00 0.00 H ATOM 45998 C112 PA 1132 133.911 101.224 39.228 1.00 0.00 C ATOM 45999 H12R PA 1132 133.004 101.826 39.138 1.00 0.00 H ATOM 46000 H12S PA 1132 133.888 100.551 38.369 1.00 0.00 H ATOM 46001 C111 PA 1132 135.198 102.105 39.275 1.00 0.00 C ATOM 46002 H11R PA 1132 136.060 101.578 39.690 1.00 0.00 H ATOM 46003 H11S PA 1132 135.039 102.811 40.093 1.00 0.00 H ATOM 46004 C110 PA 1132 135.425 102.783 37.904 1.00 0.00 C ATOM 46005 H10R PA 1132 134.487 103.266 37.624 1.00 0.00 H ATOM 46006 H10S PA 1132 135.547 102.002 37.151 1.00 0.00 H ATOM 46007 C19 PA 1132 136.639 103.751 37.894 1.00 0.00 C ATOM 46008 H9R PA 1132 137.227 103.726 38.814 1.00 0.00 H ATOM 46009 H9S PA 1132 136.244 104.768 37.941 1.00 0.00 H ATOM 46010 C18 PA 1132 137.583 103.565 36.657 1.00 0.00 C ATOM 46011 H8R PA 1132 137.073 103.655 35.695 1.00 0.00 H ATOM 46012 H8S PA 1132 137.842 102.505 36.686 1.00 0.00 H ATOM 46013 C17 PA 1132 138.761 104.603 36.605 1.00 0.00 C ATOM 46014 H7R PA 1132 139.382 104.223 35.791 1.00 0.00 H ATOM 46015 H7S PA 1132 139.461 104.484 37.434 1.00 0.00 H ATOM 46016 C16 PA 1132 138.392 106.071 36.426 1.00 0.00 C ATOM 46017 H6R PA 1132 137.556 106.289 37.094 1.00 0.00 H ATOM 46018 H6S PA 1132 137.860 106.056 35.473 1.00 0.00 H ATOM 46019 C15 PA 1132 139.546 107.179 36.349 1.00 0.00 C ATOM 46020 H5R PA 1132 139.717 107.282 37.422 1.00 0.00 H ATOM 46021 H5S PA 1132 139.187 108.125 35.938 1.00 0.00 H ATOM 46022 C14 PA 1132 140.793 106.768 35.648 1.00 0.00 C ATOM 46023 H4R PA 1132 141.238 105.914 36.163 1.00 0.00 H ATOM 46024 H4S PA 1132 141.538 107.548 35.819 1.00 0.00 H ATOM 46025 C13 PA 1132 140.659 106.330 34.149 1.00 0.00 C ATOM 46026 H3R PA 1132 140.470 107.330 33.754 1.00 0.00 H ATOM 46027 H3S PA 1132 139.772 105.695 34.113 1.00 0.00 H ATOM 46028 C12 PA 1132 142.021 105.836 33.491 1.00 0.00 C ATOM 46029 H2R PA 1132 142.263 104.972 34.112 1.00 0.00 H ATOM 46030 H2S PA 1132 142.829 106.571 33.504 1.00 0.00 H ATOM 46031 C11 PGR 1133 141.857 105.432 32.027 1.00 0.00 C ATOM 46032 O12 PGR 1133 141.334 106.155 31.218 1.00 0.00 O ATOM 46033 O11 PGR 1133 142.319 104.155 31.788 1.00 0.00 O ATOM 46034 C1 PGR 1133 142.014 103.497 30.580 1.00 0.00 C ATOM 46035 HR PGR 1133 140.934 103.369 30.465 1.00 0.00 H ATOM 46036 HS PGR 1133 142.503 102.520 30.582 1.00 0.00 H ATOM 46037 C2 PGR 1133 142.600 104.121 29.319 1.00 0.00 C ATOM 46038 HX PGR 1133 142.355 105.186 29.282 1.00 0.00 H ATOM 46039 C3 PGR 1133 142.085 103.436 28.043 1.00 0.00 C ATOM 46040 HA PGR 1133 140.996 103.468 28.119 1.00 0.00 H ATOM 46041 HB PGR 1133 142.367 102.381 27.991 1.00 0.00 H ATOM 46042 O31 PGR 1133 142.503 104.191 26.878 1.00 0.00 O ATOM 46043 P31 PGR 1133 142.053 103.593 25.426 1.00 0.00 P ATOM 46044 O32 PGR 1133 142.958 102.281 25.204 1.00 0.00 O ATOM 46045 C31 PGR 1133 144.349 102.356 24.836 1.00 0.00 C ATOM 46046 H1A PGR 1133 144.856 102.920 25.623 1.00 0.00 H ATOM 46047 H1B PGR 1133 144.394 102.864 23.869 1.00 0.00 H ATOM 46048 C32 PGR 1133 144.877 100.900 24.582 1.00 0.00 C ATOM 46049 H2A PGR 1133 145.898 100.910 24.192 1.00 0.00 H ATOM 46050 O35 PGR 1133 144.088 100.371 23.531 1.00 0.00 O ATOM 46051 HO5A PGR 1133 143.220 100.147 23.913 1.00 0.00 H ATOM 46052 C33 PGR 1133 144.789 100.060 25.847 1.00 0.00 C ATOM 46053 H3A PGR 1133 145.304 100.513 26.698 1.00 0.00 H ATOM 46054 H3B PGR 1133 143.748 99.931 26.157 1.00 0.00 H ATOM 46055 O33 PGR 1133 140.640 103.220 25.504 1.00 0.00 O ATOM 46056 O34 PGR 1133 142.381 104.639 24.423 1.00 0.00 O ATOM 46057 O21 PGR 1133 144.049 104.171 29.341 1.00 0.00 O ATOM 46058 C21 PGR 1133 144.795 103.068 29.246 1.00 0.00 C ATOM 46059 O22 PGR 1133 144.407 101.909 29.142 1.00 0.00 O ATOM 46060 O36 PGR 1133 145.222 98.772 25.680 1.00 0.00 O ATOM 46061 HO6A PGR 1133 145.070 98.233 26.477 1.00 0.00 H ATOM 46062 C12 OL 1134 146.305 103.341 29.589 1.00 0.00 C ATOM 46063 H2R OL 1134 146.848 102.523 29.110 1.00 0.00 H ATOM 46064 H2S OL 1134 146.584 104.259 29.067 1.00 0.00 H ATOM 46065 C13 OL 1134 146.632 103.541 31.078 1.00 0.00 C ATOM 46066 H3R OL 1134 146.117 102.716 31.576 1.00 0.00 H ATOM 46067 H3S OL 1134 147.681 103.380 31.336 1.00 0.00 H ATOM 46068 C14 OL 1134 146.003 104.702 31.893 1.00 0.00 C ATOM 46069 H4R OL 1134 144.937 104.693 31.657 1.00 0.00 H ATOM 46070 H4S OL 1134 146.113 104.503 32.961 1.00 0.00 H ATOM 46071 C15 OL 1134 146.518 106.050 31.554 1.00 0.00 C ATOM 46072 H5R OL 1134 147.607 106.050 31.638 1.00 0.00 H ATOM 46073 H5S OL 1134 146.260 106.133 30.496 1.00 0.00 H ATOM 46074 C16 OL 1134 145.976 107.211 32.369 1.00 0.00 C ATOM 46075 H6R OL 1134 146.437 108.107 31.949 1.00 0.00 H ATOM 46076 H6S OL 1134 144.897 107.312 32.240 1.00 0.00 H ATOM 46077 C17 OL 1134 146.150 107.161 33.945 1.00 0.00 C ATOM 46078 H7R OL 1134 145.416 106.482 34.383 1.00 0.00 H ATOM 46079 H7S OL 1134 147.173 106.878 34.203 1.00 0.00 H ATOM 46080 C18 OL 1134 145.978 108.494 34.714 1.00 0.00 C ATOM 46081 H8R OL 1134 146.237 108.241 35.745 1.00 0.00 H ATOM 46082 H8S OL 1134 146.699 109.223 34.339 1.00 0.00 H ATOM 46083 C19 OL 1134 144.564 109.040 34.526 1.00 0.00 C ATOM 46084 H9R OL 1134 144.385 109.197 33.466 1.00 0.00 H ATOM 46085 C110 OL 1134 143.680 109.444 35.466 1.00 0.00 C ATOM 46086 H10R OL 1134 142.832 110.054 35.166 1.00 0.00 H ATOM 46087 C111 OL 1134 143.979 109.304 36.963 1.00 0.00 C ATOM 46088 H11R OL 1134 144.148 108.232 37.085 1.00 0.00 H ATOM 46089 H11S OL 1134 145.012 109.624 37.114 1.00 0.00 H ATOM 46090 C112 OL 1134 142.798 109.816 37.910 1.00 0.00 C ATOM 46091 H12R OL 1134 142.845 110.906 37.926 1.00 0.00 H ATOM 46092 H12S OL 1134 141.881 109.540 37.385 1.00 0.00 H ATOM 46093 C113 OL 1134 142.880 109.351 39.440 1.00 0.00 C ATOM 46094 H13R OL 1134 142.034 109.710 40.029 1.00 0.00 H ATOM 46095 H13S OL 1134 142.836 108.265 39.337 1.00 0.00 H ATOM 46096 C114 OL 1134 144.117 109.807 40.221 1.00 0.00 C ATOM 46097 H14R OL 1134 144.968 109.621 39.563 1.00 0.00 H ATOM 46098 H14S OL 1134 144.097 110.884 40.403 1.00 0.00 H ATOM 46099 C115 OL 1134 144.377 108.965 41.464 1.00 0.00 C ATOM 46100 H15R OL 1134 143.515 108.973 42.134 1.00 0.00 H ATOM 46101 H15S OL 1134 144.415 107.897 41.237 1.00 0.00 H ATOM 46102 C116 OL 1134 145.435 109.482 42.463 1.00 0.00 C ATOM 46103 H16R OL 1134 145.279 110.545 42.659 1.00 0.00 H ATOM 46104 H16S OL 1134 145.244 109.048 43.447 1.00 0.00 H ATOM 46105 C117 OL 1134 146.820 109.188 42.009 1.00 0.00 C ATOM 46106 H17R OL 1134 147.020 108.125 42.155 1.00 0.00 H ATOM 46107 H17S OL 1134 146.940 109.327 40.933 1.00 0.00 H ATOM 46108 C118 OL 1134 147.975 109.931 42.727 1.00 0.00 C ATOM 46109 H18R OL 1134 148.992 109.686 42.412 1.00 0.00 H ATOM 46110 H18S OL 1134 147.843 109.728 43.792 1.00 0.00 H ATOM 46111 H18T OL 1134 147.894 111.017 42.811 1.00 0.00 H TER 46112 OL 1134 ATOM 46112 C116 PA 1135 59.393 108.919 35.335 1.00 0.00 C ATOM 46113 H16R PA 1135 59.453 108.612 36.381 1.00 0.00 H ATOM 46114 H16S PA 1135 58.731 108.254 34.776 1.00 0.00 H ATOM 46115 H16T PA 1135 58.876 109.879 35.276 1.00 0.00 H ATOM 46116 C115 PA 1135 60.738 108.799 34.591 1.00 0.00 C ATOM 46117 H15R PA 1135 61.019 107.744 34.562 1.00 0.00 H ATOM 46118 H15S PA 1135 61.534 109.362 35.081 1.00 0.00 H ATOM 46119 C114 PA 1135 60.818 109.482 33.153 1.00 0.00 C ATOM 46120 H14R PA 1135 60.289 108.859 32.429 1.00 0.00 H ATOM 46121 H14S PA 1135 61.858 109.331 32.855 1.00 0.00 H ATOM 46122 C113 PA 1135 60.283 110.863 32.843 1.00 0.00 C ATOM 46123 H13R PA 1135 59.298 111.058 33.273 1.00 0.00 H ATOM 46124 H13S PA 1135 60.163 110.889 31.757 1.00 0.00 H ATOM 46125 C112 PA 1135 61.236 112.018 33.234 1.00 0.00 C ATOM 46126 H12R PA 1135 61.544 111.813 34.262 1.00 0.00 H ATOM 46127 H12S PA 1135 60.682 112.959 33.215 1.00 0.00 H ATOM 46128 C111 PA 1135 62.535 112.189 32.373 1.00 0.00 C ATOM 46129 H11R PA 1135 63.263 111.470 32.755 1.00 0.00 H ATOM 46130 H11S PA 1135 63.047 113.128 32.595 1.00 0.00 H ATOM 46131 C110 PA 1135 62.409 112.201 30.775 1.00 0.00 C ATOM 46132 H10R PA 1135 61.966 113.151 30.470 1.00 0.00 H ATOM 46133 H10S PA 1135 61.700 111.436 30.453 1.00 0.00 H ATOM 46134 C19 PA 1135 63.686 111.867 30.049 1.00 0.00 C ATOM 46135 H9R PA 1135 64.086 110.859 30.175 1.00 0.00 H ATOM 46136 H9S PA 1135 64.568 112.482 30.238 1.00 0.00 H ATOM 46137 C18 PA 1135 63.662 111.919 28.596 1.00 0.00 C ATOM 46138 H8R PA 1135 63.065 111.072 28.250 1.00 0.00 H ATOM 46139 H8S PA 1135 64.640 111.715 28.155 1.00 0.00 H ATOM 46140 C17 PA 1135 63.206 113.220 27.914 1.00 0.00 C ATOM 46141 H7R PA 1135 63.707 114.114 28.292 1.00 0.00 H ATOM 46142 H7S PA 1135 62.186 113.326 28.290 1.00 0.00 H ATOM 46143 C16 PA 1135 63.282 113.213 26.414 1.00 0.00 C ATOM 46144 H6R PA 1135 64.168 112.649 26.115 1.00 0.00 H ATOM 46145 H6S PA 1135 63.342 114.257 26.097 1.00 0.00 H ATOM 46146 C15 PA 1135 62.006 112.655 25.804 1.00 0.00 C ATOM 46147 H5R PA 1135 61.983 111.564 25.850 1.00 0.00 H ATOM 46148 H5S PA 1135 62.248 112.843 24.756 1.00 0.00 H ATOM 46149 C14 PA 1135 60.677 113.335 26.134 1.00 0.00 C ATOM 46150 H4R PA 1135 60.768 114.422 26.078 1.00 0.00 H ATOM 46151 H4S PA 1135 60.443 113.258 27.198 1.00 0.00 H ATOM 46152 C13 PA 1135 59.453 112.829 25.402 1.00 0.00 C ATOM 46153 H3R PA 1135 58.707 113.555 25.731 1.00 0.00 H ATOM 46154 H3S PA 1135 59.239 111.852 25.841 1.00 0.00 H ATOM 46155 C12 PA 1135 59.499 112.799 23.833 1.00 0.00 C ATOM 46156 H2R PA 1135 60.312 112.170 23.465 1.00 0.00 H ATOM 46157 H2S PA 1135 59.730 113.828 23.548 1.00 0.00 H ATOM 46158 C11 PGR 1136 58.147 112.491 23.206 1.00 0.00 C ATOM 46159 O12 PGR 1136 57.447 113.319 22.544 1.00 0.00 O ATOM 46160 O11 PGR 1136 57.790 111.185 23.468 1.00 0.00 O ATOM 46161 C1 PGR 1136 56.558 110.638 22.982 1.00 0.00 C ATOM 46162 HR PGR 1136 56.597 110.657 21.890 1.00 0.00 H ATOM 46163 HS PGR 1136 55.724 111.294 23.246 1.00 0.00 H ATOM 46164 C2 PGR 1136 56.441 109.296 23.654 1.00 0.00 C ATOM 46165 HX PGR 1136 57.317 108.644 23.695 1.00 0.00 H ATOM 46166 C3 PGR 1136 55.263 108.536 22.909 1.00 0.00 C ATOM 46167 HA PGR 1136 55.029 107.630 23.473 1.00 0.00 H ATOM 46168 HB PGR 1136 55.603 108.268 21.906 1.00 0.00 H ATOM 46169 O31 PGR 1136 54.221 109.523 22.839 1.00 0.00 O ATOM 46170 P31 PGR 1136 53.098 109.223 21.835 1.00 0.00 P ATOM 46171 O32 PGR 1136 52.069 110.488 22.043 1.00 0.00 O ATOM 46172 C31 PGR 1136 51.618 110.922 23.332 1.00 0.00 C ATOM 46173 H1A PGR 1136 52.503 111.058 23.960 1.00 0.00 H ATOM 46174 H1B PGR 1136 50.914 110.223 23.790 1.00 0.00 H ATOM 46175 C32 PGR 1136 50.837 112.275 23.076 1.00 0.00 C ATOM 46176 H2A PGR 1136 50.454 112.818 23.944 1.00 0.00 H ATOM 46177 O35 PGR 1136 49.728 111.778 22.306 1.00 0.00 O ATOM 46178 HO5A PGR 1136 49.243 111.192 22.915 1.00 0.00 H ATOM 46179 C33 PGR 1136 51.742 113.159 22.253 1.00 0.00 C ATOM 46180 H3A PGR 1136 52.774 112.918 22.522 1.00 0.00 H ATOM 46181 H3B PGR 1136 51.738 112.798 21.221 1.00 0.00 H ATOM 46182 O33 PGR 1136 53.664 109.206 20.518 1.00 0.00 O ATOM 46183 O34 PGR 1136 52.445 107.959 22.258 1.00 0.00 O ATOM 46184 O21 PGR 1136 55.968 109.590 25.033 1.00 0.00 O ATOM 46185 C21 PGR 1136 55.829 108.581 25.949 1.00 0.00 C ATOM 46186 O22 PGR 1136 56.178 107.406 25.843 1.00 0.00 O ATOM 46187 O36 PGR 1136 51.407 114.513 22.500 1.00 0.00 O ATOM 46188 HO6A PGR 1136 50.589 114.761 22.031 1.00 0.00 H ATOM 46189 C12 OL 1137 54.877 108.857 27.073 1.00 0.00 C ATOM 46190 H2R OL 1137 53.878 108.465 26.872 1.00 0.00 H ATOM 46191 H2S OL 1137 55.232 108.475 28.032 1.00 0.00 H ATOM 46192 C13 OL 1137 54.794 110.311 27.464 1.00 0.00 C ATOM 46193 H3R OL 1137 55.760 110.819 27.494 1.00 0.00 H ATOM 46194 H3S OL 1137 54.204 110.864 26.730 1.00 0.00 H ATOM 46195 C14 OL 1137 53.966 110.589 28.724 1.00 0.00 C ATOM 46196 H4R OL 1137 53.057 109.993 28.624 1.00 0.00 H ATOM 46197 H4S OL 1137 54.433 110.051 29.552 1.00 0.00 H ATOM 46198 C15 OL 1137 53.630 112.089 29.084 1.00 0.00 C ATOM 46199 H5R OL 1137 54.593 112.577 29.246 1.00 0.00 H ATOM 46200 H5S OL 1137 53.108 112.543 28.239 1.00 0.00 H ATOM 46201 C16 OL 1137 52.812 112.372 30.433 1.00 0.00 C ATOM 46202 H6R OL 1137 53.523 112.277 31.256 1.00 0.00 H ATOM 46203 H6S OL 1137 52.479 113.410 30.505 1.00 0.00 H ATOM 46204 C17 OL 1137 51.525 111.543 30.524 1.00 0.00 C ATOM 46205 H7R OL 1137 50.934 111.449 29.610 1.00 0.00 H ATOM 46206 H7S OL 1137 51.835 110.559 30.883 1.00 0.00 H ATOM 46207 C18 OL 1137 50.564 112.187 31.601 1.00 0.00 C ATOM 46208 H8R OL 1137 50.827 111.675 32.529 1.00 0.00 H ATOM 46209 H8S OL 1137 50.686 113.258 31.777 1.00 0.00 H ATOM 46210 C19 OL 1137 49.130 111.835 31.273 1.00 0.00 C ATOM 46211 H9R OL 1137 49.002 110.927 30.691 1.00 0.00 H ATOM 46212 C110 OL 1137 48.077 112.632 31.385 1.00 0.00 C ATOM 46213 H10R OL 1137 47.098 112.333 31.021 1.00 0.00 H ATOM 46214 C111 OL 1137 48.157 114.027 31.905 1.00 0.00 C ATOM 46215 H11R OL 1137 47.210 114.236 32.407 1.00 0.00 H ATOM 46216 H11S OL 1137 48.881 114.037 32.722 1.00 0.00 H ATOM 46217 C112 OL 1137 48.422 115.107 30.899 1.00 0.00 C ATOM 46218 H12R OL 1137 49.279 114.807 30.292 1.00 0.00 H ATOM 46219 H12S OL 1137 47.577 115.207 30.215 1.00 0.00 H ATOM 46220 C113 OL 1137 48.762 116.355 31.644 1.00 0.00 C ATOM 46221 H13R OL 1137 48.023 116.596 32.411 1.00 0.00 H ATOM 46222 H13S OL 1137 49.654 116.030 32.185 1.00 0.00 H ATOM 46223 C114 OL 1137 49.093 117.522 30.780 1.00 0.00 C ATOM 46224 H14R OL 1137 49.941 117.161 30.195 1.00 0.00 H ATOM 46225 H14S OL 1137 48.275 117.642 30.066 1.00 0.00 H ATOM 46226 C115 OL 1137 49.412 118.810 31.523 1.00 0.00 C ATOM 46227 H15R OL 1137 48.636 119.046 32.255 1.00 0.00 H ATOM 46228 H15S OL 1137 50.323 118.661 32.107 1.00 0.00 H ATOM 46229 C116 OL 1137 49.644 119.943 30.558 1.00 0.00 C ATOM 46230 H16R OL 1137 48.895 120.057 29.771 1.00 0.00 H ATOM 46231 H16S OL 1137 49.628 120.881 31.116 1.00 0.00 H ATOM 46232 C117 OL 1137 51.013 119.988 29.907 1.00 0.00 C ATOM 46233 H17R OL 1137 51.678 120.644 30.474 1.00 0.00 H ATOM 46234 H17S OL 1137 51.487 119.016 29.758 1.00 0.00 H ATOM 46235 C118 OL 1137 50.865 120.448 28.448 1.00 0.00 C ATOM 46236 H18R OL 1137 51.810 120.469 27.902 1.00 0.00 H ATOM 46237 H18S OL 1137 50.381 121.416 28.306 1.00 0.00 H ATOM 46238 H18T OL 1137 50.255 119.649 28.022 1.00 0.00 H TER 46239 OL 1137 ATOM 46239 C116 PA 1138 131.577 56.786 41.593 1.00 0.00 C ATOM 46240 H16R PA 1138 132.338 57.003 40.840 1.00 0.00 H ATOM 46241 H16S PA 1138 131.058 55.836 41.452 1.00 0.00 H ATOM 46242 H16T PA 1138 132.169 56.948 42.496 1.00 0.00 H ATOM 46243 C115 PA 1138 130.660 57.975 41.664 1.00 0.00 C ATOM 46244 H15R PA 1138 131.223 58.849 41.998 1.00 0.00 H ATOM 46245 H15S PA 1138 129.943 57.830 42.475 1.00 0.00 H ATOM 46246 C114 PA 1138 129.881 58.265 40.408 1.00 0.00 C ATOM 46247 H14R PA 1138 130.434 58.322 39.467 1.00 0.00 H ATOM 46248 H14S PA 1138 129.580 59.311 40.493 1.00 0.00 H ATOM 46249 C113 PA 1138 128.667 57.449 40.222 1.00 0.00 C ATOM 46250 H13R PA 1138 128.022 57.525 41.100 1.00 0.00 H ATOM 46251 H13S PA 1138 129.070 56.435 40.187 1.00 0.00 H ATOM 46252 C112 PA 1138 127.754 57.707 38.998 1.00 0.00 C ATOM 46253 H12R PA 1138 127.563 58.775 39.121 1.00 0.00 H ATOM 46254 H12S PA 1138 126.790 57.247 39.229 1.00 0.00 H ATOM 46255 C111 PA 1138 128.305 57.517 37.599 1.00 0.00 C ATOM 46256 H11R PA 1138 128.765 56.533 37.490 1.00 0.00 H ATOM 46257 H11S PA 1138 128.942 58.382 37.405 1.00 0.00 H ATOM 46258 C110 PA 1138 127.224 57.546 36.513 1.00 0.00 C ATOM 46259 H10R PA 1138 126.645 58.461 36.660 1.00 0.00 H ATOM 46260 H10S PA 1138 126.548 56.701 36.659 1.00 0.00 H ATOM 46261 C19 PA 1138 127.822 57.576 35.131 1.00 0.00 C ATOM 46262 H9R PA 1138 128.466 56.695 35.112 1.00 0.00 H ATOM 46263 H9S PA 1138 128.437 58.472 35.020 1.00 0.00 H ATOM 46264 C18 PA 1138 126.711 57.444 33.960 1.00 0.00 C ATOM 46265 H8R PA 1138 127.053 57.496 32.925 1.00 0.00 H ATOM 46266 H8S PA 1138 126.149 58.370 34.099 1.00 0.00 H ATOM 46267 C17 PA 1138 125.716 56.281 34.092 1.00 0.00 C ATOM 46268 H7R PA 1138 125.374 56.008 35.093 1.00 0.00 H ATOM 46269 H7S PA 1138 126.141 55.362 33.684 1.00 0.00 H ATOM 46270 C16 PA 1138 124.582 56.412 33.095 1.00 0.00 C ATOM 46271 H6R PA 1138 124.161 55.406 33.050 1.00 0.00 H ATOM 46272 H6S PA 1138 125.047 56.432 32.107 1.00 0.00 H ATOM 46273 C15 PA 1138 123.627 57.538 33.427 1.00 0.00 C ATOM 46274 H5R PA 1138 123.920 58.415 32.846 1.00 0.00 H ATOM 46275 H5S PA 1138 123.666 57.690 34.507 1.00 0.00 H ATOM 46276 C14 PA 1138 122.095 57.200 33.064 1.00 0.00 C ATOM 46277 H4R PA 1138 121.402 58.006 33.316 1.00 0.00 H ATOM 46278 H4S PA 1138 121.900 56.339 33.706 1.00 0.00 H ATOM 46279 C13 PA 1138 121.880 56.849 31.578 1.00 0.00 C ATOM 46280 H3R PA 1138 120.960 56.311 31.341 1.00 0.00 H ATOM 46281 H3S PA 1138 122.718 56.177 31.380 1.00 0.00 H ATOM 46282 C12 PA 1138 121.934 58.044 30.679 1.00 0.00 C ATOM 46283 H2R PA 1138 122.699 58.675 31.138 1.00 0.00 H ATOM 46284 H2S PA 1138 121.023 58.630 30.811 1.00 0.00 H ATOM 46285 C11 PGR 1139 122.149 57.748 29.263 1.00 0.00 C ATOM 46286 O12 PGR 1139 122.647 56.700 28.914 1.00 0.00 O ATOM 46287 O11 PGR 1139 121.568 58.638 28.370 1.00 0.00 O ATOM 46288 C1 PGR 1139 121.703 58.361 26.951 1.00 0.00 C ATOM 46289 HR PGR 1139 122.765 58.180 26.767 1.00 0.00 H ATOM 46290 HS PGR 1139 121.419 59.265 26.406 1.00 0.00 H ATOM 46291 C2 PGR 1139 120.852 57.114 26.474 1.00 0.00 C ATOM 46292 HX PGR 1139 121.420 56.212 26.718 1.00 0.00 H ATOM 46293 C3 PGR 1139 120.623 57.236 24.921 1.00 0.00 C ATOM 46294 HA PGR 1139 121.539 57.583 24.437 1.00 0.00 H ATOM 46295 HB PGR 1139 119.929 58.063 24.752 1.00 0.00 H ATOM 46296 O31 PGR 1139 120.193 55.975 24.418 1.00 0.00 O ATOM 46297 P31 PGR 1139 119.489 55.804 22.940 1.00 0.00 P ATOM 46298 O32 PGR 1139 118.186 56.787 22.980 1.00 0.00 O ATOM 46299 C31 PGR 1139 117.206 56.552 23.961 1.00 0.00 C ATOM 46300 H1A PGR 1139 117.630 56.495 24.967 1.00 0.00 H ATOM 46301 H1B PGR 1139 116.841 55.537 23.781 1.00 0.00 H ATOM 46302 C32 PGR 1139 116.052 57.539 23.962 1.00 0.00 C ATOM 46303 H2A PGR 1139 115.741 57.711 22.928 1.00 0.00 H ATOM 46304 O35 PGR 1139 116.617 58.789 24.444 1.00 0.00 O ATOM 46305 HO5A PGR 1139 115.988 59.496 24.212 1.00 0.00 H ATOM 46306 C33 PGR 1139 114.824 56.913 24.807 1.00 0.00 C ATOM 46307 H3A PGR 1139 114.453 56.019 24.299 1.00 0.00 H ATOM 46308 H3B PGR 1139 115.077 56.587 25.819 1.00 0.00 H ATOM 46309 O33 PGR 1139 120.486 56.199 21.905 1.00 0.00 O ATOM 46310 O34 PGR 1139 118.918 54.456 22.860 1.00 0.00 O ATOM 46311 O21 PGR 1139 119.631 56.974 27.307 1.00 0.00 O ATOM 46312 C21 PGR 1139 118.736 57.990 27.327 1.00 0.00 C ATOM 46313 O22 PGR 1139 118.811 59.077 26.775 1.00 0.00 O ATOM 46314 O36 PGR 1139 113.812 57.814 24.939 1.00 0.00 O ATOM 46315 HO6A PGR 1139 113.138 57.392 25.501 1.00 0.00 H ATOM 46316 C12 OL 1140 117.458 57.524 27.967 1.00 0.00 C ATOM 46317 H2R OL 1140 116.648 58.093 27.506 1.00 0.00 H ATOM 46318 H2S OL 1140 117.292 56.508 27.602 1.00 0.00 H ATOM 46319 C13 OL 1140 117.356 57.630 29.441 1.00 0.00 C ATOM 46320 H3R OL 1140 117.996 56.827 29.811 1.00 0.00 H ATOM 46321 H3S OL 1140 117.728 58.556 29.886 1.00 0.00 H ATOM 46322 C14 OL 1140 116.004 57.333 29.981 1.00 0.00 C ATOM 46323 H4R OL 1140 115.694 56.328 29.688 1.00 0.00 H ATOM 46324 H4S OL 1140 116.195 57.260 31.054 1.00 0.00 H ATOM 46325 C15 OL 1140 114.983 58.323 29.602 1.00 0.00 C ATOM 46326 H5R OL 1140 115.448 59.310 29.562 1.00 0.00 H ATOM 46327 H5S OL 1140 114.679 58.024 28.596 1.00 0.00 H ATOM 46328 C16 OL 1140 113.715 58.395 30.408 1.00 0.00 C ATOM 46329 H6R OL 1140 113.208 59.284 30.027 1.00 0.00 H ATOM 46330 H6S OL 1140 112.987 57.612 30.187 1.00 0.00 H ATOM 46331 C17 OL 1140 114.010 58.484 31.896 1.00 0.00 C ATOM 46332 H7R OL 1140 114.410 57.524 32.231 1.00 0.00 H ATOM 46333 H7S OL 1140 114.785 59.225 32.101 1.00 0.00 H ATOM 46334 C18 OL 1140 112.754 58.787 32.675 1.00 0.00 C ATOM 46335 H8R OL 1140 112.162 59.660 32.393 1.00 0.00 H ATOM 46336 H8S OL 1140 112.043 57.992 32.440 1.00 0.00 H ATOM 46337 C19 OL 1140 112.936 58.807 34.146 1.00 0.00 C ATOM 46338 H9R OL 1140 112.304 58.138 34.724 1.00 0.00 H ATOM 46339 C110 OL 1140 113.744 59.619 34.750 1.00 0.00 C ATOM 46340 H10R OL 1140 113.807 59.524 35.831 1.00 0.00 H ATOM 46341 C111 OL 1140 114.742 60.593 34.247 1.00 0.00 C ATOM 46342 H11R OL 1140 114.490 60.994 33.263 1.00 0.00 H ATOM 46343 H11S OL 1140 114.747 61.511 34.838 1.00 0.00 H ATOM 46344 C112 OL 1140 116.166 59.964 34.468 1.00 0.00 C ATOM 46345 H12R OL 1140 116.250 59.595 35.492 1.00 0.00 H ATOM 46346 H12S OL 1140 116.229 59.132 33.764 1.00 0.00 H ATOM 46347 C113 OL 1140 117.322 60.888 34.169 1.00 0.00 C ATOM 46348 H13R OL 1140 117.537 61.561 35.002 1.00 0.00 H ATOM 46349 H13S OL 1140 118.221 60.274 34.088 1.00 0.00 H ATOM 46350 C114 OL 1140 117.300 61.611 32.839 1.00 0.00 C ATOM 46351 H14R OL 1140 116.977 60.950 32.032 1.00 0.00 H ATOM 46352 H14S OL 1140 116.541 62.386 32.965 1.00 0.00 H ATOM 46353 C115 OL 1140 118.647 62.254 32.371 1.00 0.00 C ATOM 46354 H15R OL 1140 118.901 63.035 33.091 1.00 0.00 H ATOM 46355 H15S OL 1140 119.397 61.478 32.538 1.00 0.00 H ATOM 46356 C116 OL 1140 118.583 62.945 31.027 1.00 0.00 C ATOM 46357 H16R OL 1140 117.815 62.462 30.420 1.00 0.00 H ATOM 46358 H16S OL 1140 118.223 63.928 31.339 1.00 0.00 H ATOM 46359 C117 OL 1140 119.886 62.809 30.218 1.00 0.00 C ATOM 46360 H17R OL 1140 119.853 63.422 29.315 1.00 0.00 H ATOM 46361 H17S OL 1140 120.688 63.141 30.881 1.00 0.00 H ATOM 46362 C118 OL 1140 120.177 61.480 29.728 1.00 0.00 C ATOM 46363 H18R OL 1140 120.952 61.360 28.969 1.00 0.00 H ATOM 46364 H18S OL 1140 119.376 60.799 29.432 1.00 0.00 H ATOM 46365 H18T OL 1140 120.617 60.952 30.576 1.00 0.00 H TER 46366 OL 1140 ATOM 46366 C116 PA 1141 120.961 92.568 40.433 1.00 0.00 C ATOM 46367 H16R PA 1141 120.205 91.812 40.658 1.00 0.00 H ATOM 46368 H16S PA 1141 121.037 93.425 41.105 1.00 0.00 H ATOM 46369 H16T PA 1141 121.875 91.974 40.496 1.00 0.00 H ATOM 46370 C115 PA 1141 120.713 93.036 39.009 1.00 0.00 C ATOM 46371 H15R PA 1141 121.595 93.553 38.624 1.00 0.00 H ATOM 46372 H15S PA 1141 119.925 93.791 38.961 1.00 0.00 H ATOM 46373 C114 PA 1141 120.273 91.864 38.086 1.00 0.00 C ATOM 46374 H14R PA 1141 119.393 91.504 38.623 1.00 0.00 H ATOM 46375 H14S PA 1141 121.014 91.072 38.218 1.00 0.00 H ATOM 46376 C113 PA 1141 119.964 92.176 36.690 1.00 0.00 C ATOM 46377 H13R PA 1141 120.855 92.624 36.245 1.00 0.00 H ATOM 46378 H13S PA 1141 119.179 92.934 36.650 1.00 0.00 H ATOM 46379 C112 PA 1141 119.334 91.008 35.795 1.00 0.00 C ATOM 46380 H12R PA 1141 118.926 91.433 34.875 1.00 0.00 H ATOM 46381 H12S PA 1141 118.492 90.476 36.241 1.00 0.00 H ATOM 46382 C111 PA 1141 120.348 90.014 35.202 1.00 0.00 C ATOM 46383 H11R PA 1141 120.949 89.410 35.886 1.00 0.00 H ATOM 46384 H11S PA 1141 121.117 90.607 34.703 1.00 0.00 H ATOM 46385 C110 PA 1141 119.618 89.025 34.191 1.00 0.00 C ATOM 46386 H10R PA 1141 119.238 89.600 33.344 1.00 0.00 H ATOM 46387 H10S PA 1141 118.757 88.584 34.696 1.00 0.00 H ATOM 46388 C19 PA 1141 120.586 87.942 33.727 1.00 0.00 C ATOM 46389 H9R PA 1141 120.986 87.332 34.539 1.00 0.00 H ATOM 46390 H9S PA 1141 121.523 88.474 33.552 1.00 0.00 H ATOM 46391 C18 PA 1141 120.208 87.091 32.576 1.00 0.00 C ATOM 46392 H8R PA 1141 119.921 87.696 31.713 1.00 0.00 H ATOM 46393 H8S PA 1141 119.265 86.605 32.834 1.00 0.00 H ATOM 46394 C17 PA 1141 121.172 86.069 32.058 1.00 0.00 C ATOM 46395 H7R PA 1141 121.987 86.531 31.497 1.00 0.00 H ATOM 46396 H7S PA 1141 120.642 85.450 31.331 1.00 0.00 H ATOM 46397 C16 PA 1141 121.712 85.208 33.219 1.00 0.00 C ATOM 46398 H6R PA 1141 121.000 84.476 33.607 1.00 0.00 H ATOM 46399 H6S PA 1141 122.149 85.868 33.971 1.00 0.00 H ATOM 46400 C15 PA 1141 122.970 84.311 32.867 1.00 0.00 C ATOM 46401 H5R PA 1141 123.125 83.575 33.659 1.00 0.00 H ATOM 46402 H5S PA 1141 123.899 84.861 32.702 1.00 0.00 H ATOM 46403 C14 PA 1141 122.731 83.183 31.768 1.00 0.00 C ATOM 46404 H4R PA 1141 121.694 82.843 31.797 1.00 0.00 H ATOM 46405 H4S PA 1141 123.258 82.260 32.019 1.00 0.00 H ATOM 46406 C13 PA 1141 123.018 83.649 30.293 1.00 0.00 C ATOM 46407 H3R PA 1141 123.985 83.239 29.992 1.00 0.00 H ATOM 46408 H3S PA 1141 123.159 84.729 30.216 1.00 0.00 H ATOM 46409 C12 PA 1141 121.884 83.113 29.393 1.00 0.00 C ATOM 46410 H2R PA 1141 120.859 83.363 29.675 1.00 0.00 H ATOM 46411 H2S PA 1141 121.977 82.027 29.449 1.00 0.00 H ATOM 46412 C11 PC 1142 122.016 83.455 27.929 1.00 0.00 C ATOM 46413 O12 PC 1142 121.201 83.033 27.127 1.00 0.00 O ATOM 46414 O11 PC 1142 123.088 84.209 27.569 1.00 0.00 O ATOM 46415 C1 PC 1142 123.357 84.543 26.153 1.00 0.00 C ATOM 46416 HR PC 1142 123.062 83.720 25.497 1.00 0.00 H ATOM 46417 HS PC 1142 124.417 84.728 25.964 1.00 0.00 H ATOM 46418 C2 PC 1142 122.505 85.705 25.707 1.00 0.00 C ATOM 46419 HX PC 1142 121.461 85.455 25.914 1.00 0.00 H ATOM 46420 C3 PC 1142 122.347 85.823 24.180 1.00 0.00 C ATOM 46421 HA PC 1142 121.861 86.769 23.928 1.00 0.00 H ATOM 46422 HB PC 1142 121.725 84.972 23.891 1.00 0.00 H ATOM 46423 O31 PC 1142 123.672 85.749 23.616 1.00 0.00 O ATOM 46424 P31 PC 1142 123.896 85.644 22.047 1.00 0.00 P ATOM 46425 O32 PC 1142 123.726 87.094 21.523 1.00 0.00 O ATOM 46426 C31 PC 1142 123.887 87.362 20.162 1.00 0.00 C ATOM 46427 H1A PC 1142 123.130 86.866 19.549 1.00 0.00 H ATOM 46428 H1B PC 1142 124.890 87.020 19.898 1.00 0.00 H ATOM 46429 C32 PC 1142 123.796 88.870 20.082 1.00 0.00 C ATOM 46430 H2A PC 1142 124.330 89.226 19.200 1.00 0.00 H ATOM 46431 H2B PC 1142 124.397 89.289 20.890 1.00 0.00 H ATOM 46432 N31 PC 1142 122.438 89.587 20.134 1.00 0.00 N ATOM 46433 C33 PC 1142 121.739 89.345 21.350 1.00 0.00 C ATOM 46434 H3A PC 1142 121.460 88.295 21.439 1.00 0.00 H ATOM 46435 H3B PC 1142 120.843 89.968 21.372 1.00 0.00 H ATOM 46436 H3C PC 1142 122.357 89.579 22.218 1.00 0.00 H ATOM 46437 C34 PC 1142 122.656 91.045 19.885 1.00 0.00 C ATOM 46438 H4A PC 1142 121.624 91.393 19.826 1.00 0.00 H ATOM 46439 H4B PC 1142 123.107 91.251 18.913 1.00 0.00 H ATOM 46440 H4C PC 1142 123.076 91.566 20.747 1.00 0.00 H ATOM 46441 C35 PC 1142 121.576 89.097 18.968 1.00 0.00 C ATOM 46442 H5A PC 1142 122.191 89.180 18.071 1.00 0.00 H ATOM 46443 H5B PC 1142 120.640 89.657 18.943 1.00 0.00 H ATOM 46444 H5C PC 1142 121.395 88.043 19.186 1.00 0.00 H ATOM 46445 O33 PC 1142 125.282 85.277 21.844 1.00 0.00 O ATOM 46446 O34 PC 1142 122.774 84.889 21.411 1.00 0.00 O ATOM 46447 O21 PC 1142 122.932 86.991 26.310 1.00 0.00 O ATOM 46448 C21 PC 1142 122.194 87.651 27.252 1.00 0.00 C ATOM 46449 O22 PC 1142 121.091 87.255 27.572 1.00 0.00 O ATOM 46450 C12 OL 1143 122.856 88.999 27.637 1.00 0.00 C ATOM 46451 H2R OL 1143 122.871 89.571 26.707 1.00 0.00 H ATOM 46452 H2S OL 1143 122.162 89.609 28.219 1.00 0.00 H ATOM 46453 C13 OL 1143 124.160 88.700 28.360 1.00 0.00 C ATOM 46454 H3R OL 1143 124.869 88.152 27.737 1.00 0.00 H ATOM 46455 H3S OL 1143 124.729 89.631 28.321 1.00 0.00 H ATOM 46456 C14 OL 1143 124.106 88.060 29.745 1.00 0.00 C ATOM 46457 H4R OL 1143 123.617 87.084 29.746 1.00 0.00 H ATOM 46458 H4S OL 1143 125.079 87.814 30.177 1.00 0.00 H ATOM 46459 C15 OL 1143 123.445 88.869 30.805 1.00 0.00 C ATOM 46460 H5R OL 1143 122.415 89.117 30.539 1.00 0.00 H ATOM 46461 H5S OL 1143 123.453 88.329 31.754 1.00 0.00 H ATOM 46462 C16 OL 1143 124.123 90.240 31.164 1.00 0.00 C ATOM 46463 H6R OL 1143 125.153 90.083 31.491 1.00 0.00 H ATOM 46464 H6S OL 1143 124.239 90.923 30.319 1.00 0.00 H ATOM 46465 C17 OL 1143 123.356 91.004 32.244 1.00 0.00 C ATOM 46466 H7R OL 1143 122.282 91.122 32.084 1.00 0.00 H ATOM 46467 H7S OL 1143 123.385 90.393 33.148 1.00 0.00 H ATOM 46468 C18 OL 1143 124.006 92.317 32.678 1.00 0.00 C ATOM 46469 H8R OL 1143 125.090 92.179 32.672 1.00 0.00 H ATOM 46470 H8S OL 1143 123.839 92.867 31.750 1.00 0.00 H ATOM 46471 C19 OL 1143 123.339 93.066 33.771 1.00 0.00 C ATOM 46472 H9R OL 1143 122.422 93.532 33.420 1.00 0.00 H ATOM 46473 C110 OL 1143 123.759 93.202 35.059 1.00 0.00 C ATOM 46474 H10R OL 1143 123.062 93.664 35.753 1.00 0.00 H ATOM 46475 C111 OL 1143 125.047 92.698 35.567 1.00 0.00 C ATOM 46476 H11R OL 1143 124.934 91.864 36.263 1.00 0.00 H ATOM 46477 H11S OL 1143 125.602 92.375 34.684 1.00 0.00 H ATOM 46478 C112 OL 1143 125.799 93.851 36.272 1.00 0.00 C ATOM 46479 H12R OL 1143 125.926 94.742 35.653 1.00 0.00 H ATOM 46480 H12S OL 1143 125.114 94.203 37.047 1.00 0.00 H ATOM 46481 C113 OL 1143 127.205 93.401 36.731 1.00 0.00 C ATOM 46482 H13R OL 1143 127.068 92.664 37.525 1.00 0.00 H ATOM 46483 H13S OL 1143 127.643 92.820 35.917 1.00 0.00 H ATOM 46484 C114 OL 1143 128.004 94.548 37.257 1.00 0.00 C ATOM 46485 H14R OL 1143 128.171 95.443 36.653 1.00 0.00 H ATOM 46486 H14S OL 1143 127.378 94.932 38.065 1.00 0.00 H ATOM 46487 C115 OL 1143 129.300 94.088 37.940 1.00 0.00 C ATOM 46488 H15R OL 1143 128.942 93.210 38.483 1.00 0.00 H ATOM 46489 H15S OL 1143 130.087 93.705 37.288 1.00 0.00 H ATOM 46490 C116 OL 1143 129.697 95.185 38.983 1.00 0.00 C ATOM 46491 H16R OL 1143 129.977 96.087 38.436 1.00 0.00 H ATOM 46492 H16S OL 1143 128.797 95.413 39.558 1.00 0.00 H ATOM 46493 C117 OL 1143 130.909 94.881 39.842 1.00 0.00 C ATOM 46494 H17R OL 1143 131.626 94.371 39.196 1.00 0.00 H ATOM 46495 H17S OL 1143 131.334 95.859 40.079 1.00 0.00 H ATOM 46496 C118 OL 1143 130.722 94.132 41.152 1.00 0.00 C ATOM 46497 H18R OL 1143 129.905 94.573 41.727 1.00 0.00 H ATOM 46498 H18S OL 1143 131.643 93.998 41.723 1.00 0.00 H ATOM 46499 H18T OL 1143 130.263 93.176 40.893 1.00 0.00 H TER 46500 OL 1143 ATOM 46500 C116 PA 1144 84.689 32.452 36.270 1.00 0.00 C ATOM 46501 H16R PA 1144 85.171 31.714 35.627 1.00 0.00 H ATOM 46502 H16S PA 1144 85.007 32.081 37.247 1.00 0.00 H ATOM 46503 H16T PA 1144 85.066 33.468 36.130 1.00 0.00 H ATOM 46504 C115 PA 1144 83.200 32.387 36.151 1.00 0.00 C ATOM 46505 H15R PA 1144 82.751 32.751 37.078 1.00 0.00 H ATOM 46506 H15S PA 1144 82.984 31.324 36.027 1.00 0.00 H ATOM 46507 C114 PA 1144 82.816 33.205 34.918 1.00 0.00 C ATOM 46508 H14R PA 1144 83.495 33.100 34.069 1.00 0.00 H ATOM 46509 H14S PA 1144 82.779 34.249 35.237 1.00 0.00 H ATOM 46510 C113 PA 1144 81.395 32.874 34.367 1.00 0.00 C ATOM 46511 H13R PA 1144 80.594 32.848 35.109 1.00 0.00 H ATOM 46512 H13S PA 1144 81.453 31.828 34.059 1.00 0.00 H ATOM 46513 C112 PA 1144 81.117 33.703 33.146 1.00 0.00 C ATOM 46514 H12R PA 1144 80.210 33.387 32.627 1.00 0.00 H ATOM 46515 H12S PA 1144 81.942 33.571 32.442 1.00 0.00 H ATOM 46516 C111 PA 1144 81.035 35.193 33.470 1.00 0.00 C ATOM 46517 H11R PA 1144 82.009 35.593 33.760 1.00 0.00 H ATOM 46518 H11S PA 1144 80.315 35.424 34.257 1.00 0.00 H ATOM 46519 C110 PA 1144 80.800 36.085 32.265 1.00 0.00 C ATOM 46520 H10R PA 1144 79.946 35.729 31.686 1.00 0.00 H ATOM 46521 H10S PA 1144 81.583 36.004 31.508 1.00 0.00 H ATOM 46522 C19 PA 1144 80.417 37.588 32.524 1.00 0.00 C ATOM 46523 H9R PA 1144 79.422 37.646 32.969 1.00 0.00 H ATOM 46524 H9S PA 1144 80.111 38.097 31.608 1.00 0.00 H ATOM 46525 C18 PA 1144 81.459 38.427 33.247 1.00 0.00 C ATOM 46526 H8R PA 1144 82.434 38.055 32.926 1.00 0.00 H ATOM 46527 H8S PA 1144 81.310 38.189 34.303 1.00 0.00 H ATOM 46528 C17 PA 1144 81.418 39.943 33.018 1.00 0.00 C ATOM 46529 H7R PA 1144 80.391 40.204 33.282 1.00 0.00 H ATOM 46530 H7S PA 1144 81.643 40.199 31.981 1.00 0.00 H ATOM 46531 C16 PA 1144 82.366 40.742 33.974 1.00 0.00 C ATOM 46532 H6R PA 1144 82.471 40.266 34.951 1.00 0.00 H ATOM 46533 H6S PA 1144 81.834 41.673 34.181 1.00 0.00 H ATOM 46534 C15 PA 1144 83.795 40.838 33.371 1.00 0.00 C ATOM 46535 H5R PA 1144 83.695 41.256 32.367 1.00 0.00 H ATOM 46536 H5S PA 1144 84.263 39.866 33.205 1.00 0.00 H ATOM 46537 C14 PA 1144 84.803 41.678 34.101 1.00 0.00 C ATOM 46538 H4R PA 1144 85.244 41.284 35.018 1.00 0.00 H ATOM 46539 H4S PA 1144 84.387 42.636 34.420 1.00 0.00 H ATOM 46540 C13 PA 1144 85.976 42.125 33.194 1.00 0.00 C ATOM 46541 H3R PA 1144 86.652 41.316 32.910 1.00 0.00 H ATOM 46542 H3S PA 1144 86.625 42.725 33.834 1.00 0.00 H ATOM 46543 C12 PA 1144 85.683 42.881 31.924 1.00 0.00 C ATOM 46544 H2R PA 1144 85.049 43.755 32.084 1.00 0.00 H ATOM 46545 H2S PA 1144 85.125 42.209 31.269 1.00 0.00 H ATOM 46546 C11 PGR 1145 86.963 43.155 31.179 1.00 0.00 C ATOM 46547 O12 PGR 1145 87.463 42.443 30.301 1.00 0.00 O ATOM 46548 O11 PGR 1145 87.393 44.383 31.535 1.00 0.00 O ATOM 46549 C1 PGR 1145 88.531 44.821 30.802 1.00 0.00 C ATOM 46550 HR PGR 1145 89.338 44.097 30.939 1.00 0.00 H ATOM 46551 HS PGR 1145 88.858 45.793 31.182 1.00 0.00 H ATOM 46552 C2 PGR 1145 88.228 45.041 29.272 1.00 0.00 C ATOM 46553 HX PGR 1145 87.706 44.266 28.705 1.00 0.00 H ATOM 46554 C3 PGR 1145 89.578 45.332 28.521 1.00 0.00 C ATOM 46555 HA PGR 1145 90.205 44.477 28.787 1.00 0.00 H ATOM 46556 HB PGR 1145 89.949 46.265 28.952 1.00 0.00 H ATOM 46557 O31 PGR 1145 89.344 45.402 27.045 1.00 0.00 O ATOM 46558 P31 PGR 1145 89.330 44.070 26.192 1.00 0.00 P ATOM 46559 O32 PGR 1145 88.118 43.256 26.745 1.00 0.00 O ATOM 46560 C31 PGR 1145 86.772 43.476 26.281 1.00 0.00 C ATOM 46561 H1A PGR 1145 86.546 44.531 26.107 1.00 0.00 H ATOM 46562 H1B PGR 1145 86.066 43.183 27.063 1.00 0.00 H ATOM 46563 C32 PGR 1145 86.406 42.644 24.991 1.00 0.00 C ATOM 46564 H2A PGR 1145 85.320 42.752 24.934 1.00 0.00 H ATOM 46565 O35 PGR 1145 86.886 43.412 23.937 1.00 0.00 O ATOM 46566 HO5A PGR 1145 87.842 43.515 24.090 1.00 0.00 H ATOM 46567 C33 PGR 1145 86.851 41.161 24.795 1.00 0.00 C ATOM 46568 H3A PGR 1145 86.463 40.588 25.641 1.00 0.00 H ATOM 46569 H3B PGR 1145 86.323 40.745 23.933 1.00 0.00 H ATOM 46570 O33 PGR 1145 89.095 44.245 24.714 1.00 0.00 O ATOM 46571 O34 PGR 1145 90.607 43.379 26.572 1.00 0.00 O ATOM 46572 O21 PGR 1145 87.499 46.218 29.128 1.00 0.00 O ATOM 46573 C21 PGR 1145 86.185 46.147 29.214 1.00 0.00 C ATOM 46574 O22 PGR 1145 85.550 45.092 29.215 1.00 0.00 O ATOM 46575 O36 PGR 1145 88.279 41.046 24.639 1.00 0.00 O ATOM 46576 HO6A PGR 1145 88.552 41.287 23.736 1.00 0.00 H ATOM 46577 C12 OL 1146 85.602 47.518 29.170 1.00 0.00 C ATOM 46578 H2R OL 1146 86.181 48.042 28.406 1.00 0.00 H ATOM 46579 H2S OL 1146 84.540 47.510 28.918 1.00 0.00 H ATOM 46580 C13 OL 1146 85.897 48.233 30.453 1.00 0.00 C ATOM 46581 H3R OL 1146 86.942 48.196 30.767 1.00 0.00 H ATOM 46582 H3S OL 1146 85.666 49.293 30.329 1.00 0.00 H ATOM 46583 C14 OL 1146 85.131 47.735 31.689 1.00 0.00 C ATOM 46584 H4R OL 1146 84.151 47.435 31.313 1.00 0.00 H ATOM 46585 H4S OL 1146 85.582 46.877 32.193 1.00 0.00 H ATOM 46586 C15 OL 1146 84.785 48.827 32.783 1.00 0.00 C ATOM 46587 H5R OL 1146 84.449 48.327 33.694 1.00 0.00 H ATOM 46588 H5S OL 1146 85.616 49.492 33.028 1.00 0.00 H ATOM 46589 C16 OL 1146 83.739 49.818 32.340 1.00 0.00 C ATOM 46590 H6R OL 1146 84.182 50.472 31.585 1.00 0.00 H ATOM 46591 H6S OL 1146 82.911 49.271 31.884 1.00 0.00 H ATOM 46592 C17 OL 1146 83.101 50.730 33.357 1.00 0.00 C ATOM 46593 H7R OL 1146 82.678 50.138 34.172 1.00 0.00 H ATOM 46594 H7S OL 1146 83.898 51.262 33.881 1.00 0.00 H ATOM 46595 C18 OL 1146 82.028 51.609 32.751 1.00 0.00 C ATOM 46596 H8R OL 1146 81.074 51.108 32.571 1.00 0.00 H ATOM 46597 H8S OL 1146 81.755 52.348 33.507 1.00 0.00 H ATOM 46598 C19 OL 1146 82.484 52.446 31.554 1.00 0.00 C ATOM 46599 H9R OL 1146 82.623 51.800 30.691 1.00 0.00 H ATOM 46600 C110 OL 1146 82.638 53.754 31.447 1.00 0.00 C ATOM 46601 H10R OL 1146 82.896 54.209 30.495 1.00 0.00 H ATOM 46602 C111 OL 1146 82.434 54.743 32.570 1.00 0.00 C ATOM 46603 H11R OL 1146 82.188 54.288 33.532 1.00 0.00 H ATOM 46604 H11S OL 1146 83.369 55.290 32.708 1.00 0.00 H ATOM 46605 C112 OL 1146 81.313 55.728 32.151 1.00 0.00 C ATOM 46606 H12R OL 1146 81.586 56.143 31.179 1.00 0.00 H ATOM 46607 H12S OL 1146 80.367 55.210 31.975 1.00 0.00 H ATOM 46608 C113 OL 1146 81.126 56.861 33.114 1.00 0.00 C ATOM 46609 H13R OL 1146 81.031 56.627 34.177 1.00 0.00 H ATOM 46610 H13S OL 1146 81.951 57.576 33.084 1.00 0.00 H ATOM 46611 C114 OL 1146 79.972 57.747 32.893 1.00 0.00 C ATOM 46612 H14R OL 1146 80.162 58.672 33.442 1.00 0.00 H ATOM 46613 H14S OL 1146 79.898 58.070 31.853 1.00 0.00 H ATOM 46614 C115 OL 1146 78.684 57.180 33.537 1.00 0.00 C ATOM 46615 H15R OL 1146 78.691 56.090 33.465 1.00 0.00 H ATOM 46616 H15S OL 1146 78.708 57.193 34.629 1.00 0.00 H ATOM 46617 C116 OL 1146 77.353 57.815 33.080 1.00 0.00 C ATOM 46618 H16R OL 1146 77.422 58.896 32.945 1.00 0.00 H ATOM 46619 H16S OL 1146 77.120 57.519 32.055 1.00 0.00 H ATOM 46620 C117 OL 1146 76.110 57.682 33.893 1.00 0.00 C ATOM 46621 H17R OL 1146 75.319 58.376 33.602 1.00 0.00 H ATOM 46622 H17S OL 1146 75.686 56.719 33.602 1.00 0.00 H ATOM 46623 C118 OL 1146 76.237 57.985 35.475 1.00 0.00 C ATOM 46624 H18R OL 1146 76.789 57.282 36.101 1.00 0.00 H ATOM 46625 H18S OL 1146 75.346 58.203 36.068 1.00 0.00 H ATOM 46626 H18T OL 1146 76.731 58.949 35.616 1.00 0.00 H TER 46627 OL 1146 ATOM 46627 C116 PA 1147 59.207 92.129 40.810 1.00 0.00 C ATOM 46628 H16R PA 1147 58.591 92.553 41.605 1.00 0.00 H ATOM 46629 H16S PA 1147 59.491 92.966 40.168 1.00 0.00 H ATOM 46630 H16T PA 1147 60.057 91.744 41.377 1.00 0.00 H ATOM 46631 C115 PA 1147 58.545 91.051 39.987 1.00 0.00 C ATOM 46632 H15R PA 1147 58.128 90.226 40.569 1.00 0.00 H ATOM 46633 H15S PA 1147 59.256 90.507 39.361 1.00 0.00 H ATOM 46634 C114 PA 1147 57.440 91.588 38.988 1.00 0.00 C ATOM 46635 H14R PA 1147 57.881 92.102 38.131 1.00 0.00 H ATOM 46636 H14S PA 1147 56.880 92.335 39.555 1.00 0.00 H ATOM 46637 C113 PA 1147 56.454 90.578 38.412 1.00 0.00 C ATOM 46638 H13R PA 1147 55.856 90.093 39.186 1.00 0.00 H ATOM 46639 H13S PA 1147 57.029 89.746 38.000 1.00 0.00 H ATOM 46640 C112 PA 1147 55.417 91.096 37.476 1.00 0.00 C ATOM 46641 H12R PA 1147 54.788 91.809 38.012 1.00 0.00 H ATOM 46642 H12S PA 1147 54.752 90.257 37.261 1.00 0.00 H ATOM 46643 C111 PA 1147 55.910 91.726 36.199 1.00 0.00 C ATOM 46644 H11R PA 1147 56.804 91.351 35.696 1.00 0.00 H ATOM 46645 H11S PA 1147 56.103 92.783 36.394 1.00 0.00 H ATOM 46646 C110 PA 1147 54.794 91.677 35.135 1.00 0.00 C ATOM 46647 H10R PA 1147 53.872 91.939 35.659 1.00 0.00 H ATOM 46648 H10S PA 1147 54.537 90.692 34.739 1.00 0.00 H ATOM 46649 C19 PA 1147 55.059 92.715 33.986 1.00 0.00 C ATOM 46650 H9R PA 1147 55.888 92.359 33.371 1.00 0.00 H ATOM 46651 H9S PA 1147 55.287 93.681 34.440 1.00 0.00 H ATOM 46652 C18 PA 1147 53.870 92.933 33.116 1.00 0.00 C ATOM 46653 H8R PA 1147 53.115 93.353 33.784 1.00 0.00 H ATOM 46654 H8S PA 1147 53.301 92.019 32.930 1.00 0.00 H ATOM 46655 C17 PA 1147 54.053 93.813 31.851 1.00 0.00 C ATOM 46656 H7R PA 1147 54.081 94.812 32.293 1.00 0.00 H ATOM 46657 H7S PA 1147 53.145 93.721 31.250 1.00 0.00 H ATOM 46658 C16 PA 1147 55.363 93.634 31.122 1.00 0.00 C ATOM 46659 H6R PA 1147 55.361 92.702 30.554 1.00 0.00 H ATOM 46660 H6S PA 1147 56.215 93.591 31.803 1.00 0.00 H ATOM 46661 C15 PA 1147 55.749 94.739 30.167 1.00 0.00 C ATOM 46662 H5R PA 1147 56.704 94.454 29.721 1.00 0.00 H ATOM 46663 H5S PA 1147 55.970 95.539 30.876 1.00 0.00 H ATOM 46664 C14 PA 1147 54.759 95.188 29.106 1.00 0.00 C ATOM 46665 H4R PA 1147 53.865 95.463 29.669 1.00 0.00 H ATOM 46666 H4S PA 1147 54.367 94.350 28.525 1.00 0.00 H ATOM 46667 C13 PA 1147 55.284 96.106 27.987 1.00 0.00 C ATOM 46668 H3R PA 1147 55.535 97.081 28.410 1.00 0.00 H ATOM 46669 H3S PA 1147 54.408 96.209 27.343 1.00 0.00 H ATOM 46670 C12 PA 1147 56.344 95.498 27.055 1.00 0.00 C ATOM 46671 H2R PA 1147 56.221 94.426 26.890 1.00 0.00 H ATOM 46672 H2S PA 1147 57.346 95.732 27.421 1.00 0.00 H ATOM 46673 C11 PGR 1148 56.243 96.326 25.799 1.00 0.00 C ATOM 46674 O12 PGR 1148 55.731 95.979 24.741 1.00 0.00 O ATOM 46675 O11 PGR 1148 57.019 97.421 25.882 1.00 0.00 O ATOM 46676 C1 PGR 1148 57.287 98.181 24.733 1.00 0.00 C ATOM 46677 HR PGR 1148 57.279 97.515 23.866 1.00 0.00 H ATOM 46678 HS PGR 1148 58.268 98.662 24.749 1.00 0.00 H ATOM 46679 C2 PGR 1148 56.134 99.234 24.490 1.00 0.00 C ATOM 46680 HX PGR 1148 55.128 98.881 24.728 1.00 0.00 H ATOM 46681 C3 PGR 1148 56.138 99.922 23.079 1.00 0.00 C ATOM 46682 HA PGR 1148 55.238 100.536 22.984 1.00 0.00 H ATOM 46683 HB PGR 1148 55.978 99.058 22.429 1.00 0.00 H ATOM 46684 O31 PGR 1148 57.302 100.687 22.784 1.00 0.00 O ATOM 46685 P31 PGR 1148 57.783 101.127 21.353 1.00 0.00 P ATOM 46686 O32 PGR 1148 56.882 102.517 21.204 1.00 0.00 O ATOM 46687 C31 PGR 1148 57.169 103.637 21.943 1.00 0.00 C ATOM 46688 H1A PGR 1148 58.233 103.885 21.900 1.00 0.00 H ATOM 46689 H1B PGR 1148 56.810 103.442 22.957 1.00 0.00 H ATOM 46690 C32 PGR 1148 56.343 104.770 21.291 1.00 0.00 C ATOM 46691 H2A PGR 1148 56.712 105.770 21.536 1.00 0.00 H ATOM 46692 O35 PGR 1148 54.987 104.652 21.788 1.00 0.00 O ATOM 46693 HO5A PGR 1148 55.127 104.889 22.722 1.00 0.00 H ATOM 46694 C33 PGR 1148 56.282 104.599 19.774 1.00 0.00 C ATOM 46695 H3A PGR 1148 57.281 104.823 19.390 1.00 0.00 H ATOM 46696 H3B PGR 1148 55.881 103.620 19.503 1.00 0.00 H ATOM 46697 O33 PGR 1148 59.246 101.411 21.323 1.00 0.00 O ATOM 46698 O34 PGR 1148 57.219 100.152 20.377 1.00 0.00 O ATOM 46699 O21 PGR 1148 56.388 100.293 25.436 1.00 0.00 O ATOM 46700 C21 PGR 1148 55.935 100.093 26.696 1.00 0.00 C ATOM 46701 O22 PGR 1148 55.191 99.183 26.980 1.00 0.00 O ATOM 46702 O36 PGR 1148 55.372 105.573 19.215 1.00 0.00 O ATOM 46703 HO6A PGR 1148 54.509 105.391 19.628 1.00 0.00 H ATOM 46704 C12 OL 1149 56.481 101.055 27.698 1.00 0.00 C ATOM 46705 H2R OL 1149 57.559 100.948 27.837 1.00 0.00 H ATOM 46706 H2S OL 1149 56.238 102.071 27.379 1.00 0.00 H ATOM 46707 C13 OL 1149 55.865 100.926 29.088 1.00 0.00 C ATOM 46708 H3R OL 1149 54.828 101.266 29.088 1.00 0.00 H ATOM 46709 H3S OL 1149 55.872 99.858 29.317 1.00 0.00 H ATOM 46710 C14 OL 1149 56.663 101.679 30.093 1.00 0.00 C ATOM 46711 H4R OL 1149 57.728 101.480 29.956 1.00 0.00 H ATOM 46712 H4S OL 1149 56.598 102.762 29.969 1.00 0.00 H ATOM 46713 C15 OL 1149 56.136 101.415 31.503 1.00 0.00 C ATOM 46714 H5R OL 1149 55.072 101.622 31.637 1.00 0.00 H ATOM 46715 H5S OL 1149 56.097 100.333 31.645 1.00 0.00 H ATOM 46716 C16 OL 1149 56.955 101.916 32.608 1.00 0.00 C ATOM 46717 H6R OL 1149 56.616 101.333 33.467 1.00 0.00 H ATOM 46718 H6S OL 1149 58.029 101.761 32.489 1.00 0.00 H ATOM 46719 C17 OL 1149 56.787 103.449 32.883 1.00 0.00 C ATOM 46720 H7R OL 1149 57.235 104.042 32.082 1.00 0.00 H ATOM 46721 H7S OL 1149 55.773 103.850 32.934 1.00 0.00 H ATOM 46722 C18 OL 1149 57.499 103.870 34.241 1.00 0.00 C ATOM 46723 H8R OL 1149 56.956 103.303 34.999 1.00 0.00 H ATOM 46724 H8S OL 1149 58.554 103.594 34.178 1.00 0.00 H ATOM 46725 C19 OL 1149 57.430 105.376 34.292 1.00 0.00 C ATOM 46726 H9R OL 1149 58.224 105.833 33.706 1.00 0.00 H ATOM 46727 C110 OL 1149 56.580 106.182 34.986 1.00 0.00 C ATOM 46728 H10R OL 1149 56.714 107.257 34.902 1.00 0.00 H ATOM 46729 C111 OL 1149 55.336 105.805 35.715 1.00 0.00 C ATOM 46730 H11R OL 1149 54.546 106.400 35.251 1.00 0.00 H ATOM 46731 H11S OL 1149 55.184 104.724 35.685 1.00 0.00 H ATOM 46732 C112 OL 1149 55.442 106.294 37.240 1.00 0.00 C ATOM 46733 H12R OL 1149 54.608 105.895 37.823 1.00 0.00 H ATOM 46734 H12S OL 1149 56.406 105.888 37.553 1.00 0.00 H ATOM 46735 C113 OL 1149 55.453 107.801 37.452 1.00 0.00 C ATOM 46736 H13R OL 1149 56.112 108.263 36.713 1.00 0.00 H ATOM 46737 H13S OL 1149 54.449 108.201 37.300 1.00 0.00 H ATOM 46738 C114 OL 1149 55.723 108.206 38.940 1.00 0.00 C ATOM 46739 H14R OL 1149 54.961 107.684 39.523 1.00 0.00 H ATOM 46740 H14S OL 1149 56.667 107.849 39.357 1.00 0.00 H ATOM 46741 C115 OL 1149 55.831 109.748 39.063 1.00 0.00 C ATOM 46742 H15R OL 1149 56.654 110.166 38.479 1.00 0.00 H ATOM 46743 H15S OL 1149 54.942 110.209 38.629 1.00 0.00 H ATOM 46744 C116 OL 1149 55.885 110.265 40.541 1.00 0.00 C ATOM 46745 H16R OL 1149 55.130 109.767 41.153 1.00 0.00 H ATOM 46746 H16S OL 1149 56.822 109.987 41.028 1.00 0.00 H ATOM 46747 C117 OL 1149 55.760 111.783 40.688 1.00 0.00 C ATOM 46748 H17R OL 1149 54.707 112.063 40.763 1.00 0.00 H ATOM 46749 H17S OL 1149 56.211 111.929 41.672 1.00 0.00 H ATOM 46750 C118 OL 1149 56.541 112.563 39.701 1.00 0.00 C ATOM 46751 H18R OL 1149 57.602 112.411 39.908 1.00 0.00 H ATOM 46752 H18S OL 1149 56.312 113.627 39.783 1.00 0.00 H ATOM 46753 H18T OL 1149 56.441 112.193 38.678 1.00 0.00 H TER 46754 OL 1149 ATOM 46754 C116 PA 1150 70.792 65.719 37.931 1.00 0.00 C ATOM 46755 H16R PA 1150 70.193 64.868 37.600 1.00 0.00 H ATOM 46756 H16S PA 1150 70.505 65.974 38.953 1.00 0.00 H ATOM 46757 H16T PA 1150 71.795 65.285 37.920 1.00 0.00 H ATOM 46758 C115 PA 1150 70.742 66.987 37.173 1.00 0.00 C ATOM 46759 H15R PA 1150 71.003 66.766 36.136 1.00 0.00 H ATOM 46760 H15S PA 1150 71.528 67.688 37.462 1.00 0.00 H ATOM 46761 C114 PA 1150 69.370 67.711 37.166 1.00 0.00 C ATOM 46762 H14R PA 1150 69.154 67.870 38.224 1.00 0.00 H ATOM 46763 H14S PA 1150 68.640 67.039 36.711 1.00 0.00 H ATOM 46764 C113 PA 1150 69.345 69.034 36.362 1.00 0.00 C ATOM 46765 H13R PA 1150 69.752 68.846 35.366 1.00 0.00 H ATOM 46766 H13S PA 1150 69.969 69.785 36.852 1.00 0.00 H ATOM 46767 C112 PA 1150 67.922 69.593 36.207 1.00 0.00 C ATOM 46768 H12R PA 1150 67.397 69.734 37.154 1.00 0.00 H ATOM 46769 H12S PA 1150 67.410 68.923 35.512 1.00 0.00 H ATOM 46770 C111 PA 1150 67.993 70.900 35.491 1.00 0.00 C ATOM 46771 H11R PA 1150 67.035 71.147 35.028 1.00 0.00 H ATOM 46772 H11S PA 1150 68.693 70.835 34.655 1.00 0.00 H ATOM 46773 C110 PA 1150 68.239 72.103 36.324 1.00 0.00 C ATOM 46774 H10R PA 1150 69.134 71.950 36.931 1.00 0.00 H ATOM 46775 H10S PA 1150 67.380 72.071 36.996 1.00 0.00 H ATOM 46776 C19 PA 1150 68.333 73.469 35.697 1.00 0.00 C ATOM 46777 H9R PA 1150 68.547 74.242 36.437 1.00 0.00 H ATOM 46778 H9S PA 1150 67.319 73.685 35.352 1.00 0.00 H ATOM 46779 C18 PA 1150 69.300 73.531 34.436 1.00 0.00 C ATOM 46780 H8R PA 1150 69.283 72.718 33.706 1.00 0.00 H ATOM 46781 H8S PA 1150 70.308 73.531 34.854 1.00 0.00 H ATOM 46782 C17 PA 1150 68.996 74.766 33.655 1.00 0.00 C ATOM 46783 H7R PA 1150 69.123 75.680 34.238 1.00 0.00 H ATOM 46784 H7S PA 1150 67.906 74.790 33.592 1.00 0.00 H ATOM 46785 C16 PA 1150 69.588 74.871 32.285 1.00 0.00 C ATOM 46786 H6R PA 1150 69.163 74.035 31.725 1.00 0.00 H ATOM 46787 H6S PA 1150 70.620 74.546 32.433 1.00 0.00 H ATOM 46788 C15 PA 1150 69.307 76.085 31.545 1.00 0.00 C ATOM 46789 H5R PA 1150 69.890 75.975 30.628 1.00 0.00 H ATOM 46790 H5S PA 1150 69.722 76.921 32.111 1.00 0.00 H ATOM 46791 C14 PA 1150 67.780 76.286 31.256 1.00 0.00 C ATOM 46792 H4R PA 1150 67.086 75.932 32.022 1.00 0.00 H ATOM 46793 H4S PA 1150 67.435 75.624 30.460 1.00 0.00 H ATOM 46794 C13 PA 1150 67.491 77.807 30.950 1.00 0.00 C ATOM 46795 H3R PA 1150 68.024 78.282 30.124 1.00 0.00 H ATOM 46796 H3S PA 1150 67.816 78.368 31.829 1.00 0.00 H ATOM 46797 C12 PA 1150 66.060 78.089 30.632 1.00 0.00 C ATOM 46798 H2R PA 1150 65.851 79.102 30.282 1.00 0.00 H ATOM 46799 H2S PA 1150 65.454 78.015 31.538 1.00 0.00 H ATOM 46800 C11 PGR 1151 65.523 77.245 29.485 1.00 0.00 C ATOM 46801 O12 PGR 1151 66.036 77.111 28.382 1.00 0.00 O ATOM 46802 O11 PGR 1151 64.409 76.602 29.845 1.00 0.00 O ATOM 46803 C1 PGR 1151 63.669 75.699 28.996 1.00 0.00 C ATOM 46804 HR PGR 1151 63.708 76.163 28.007 1.00 0.00 H ATOM 46805 HS PGR 1151 62.646 75.472 29.305 1.00 0.00 H ATOM 46806 C2 PGR 1151 64.498 74.430 28.679 1.00 0.00 C ATOM 46807 HX PGR 1151 65.366 74.693 28.068 1.00 0.00 H ATOM 46808 C3 PGR 1151 63.583 73.583 27.723 1.00 0.00 C ATOM 46809 HA PGR 1151 62.979 74.337 27.212 1.00 0.00 H ATOM 46810 HB PGR 1151 62.823 72.997 28.245 1.00 0.00 H ATOM 46811 O31 PGR 1151 64.355 72.743 26.822 1.00 0.00 O ATOM 46812 P31 PGR 1151 63.760 72.073 25.511 1.00 0.00 P ATOM 46813 O32 PGR 1151 64.379 73.037 24.359 1.00 0.00 O ATOM 46814 C31 PGR 1151 65.768 73.201 24.342 1.00 0.00 C ATOM 46815 H1A PGR 1151 66.289 72.240 24.380 1.00 0.00 H ATOM 46816 H1B PGR 1151 66.035 73.752 25.247 1.00 0.00 H ATOM 46817 C32 PGR 1151 66.247 74.058 23.119 1.00 0.00 C ATOM 46818 H2A PGR 1151 67.316 74.159 22.920 1.00 0.00 H ATOM 46819 O35 PGR 1151 65.723 75.351 23.218 1.00 0.00 O ATOM 46820 HO5A PGR 1151 64.759 75.265 23.330 1.00 0.00 H ATOM 46821 C33 PGR 1151 65.739 73.464 21.709 1.00 0.00 C ATOM 46822 H3A PGR 1151 66.030 74.310 21.081 1.00 0.00 H ATOM 46823 H3B PGR 1151 66.163 72.495 21.434 1.00 0.00 H ATOM 46824 O33 PGR 1151 64.465 70.762 25.422 1.00 0.00 O ATOM 46825 O34 PGR 1151 62.296 72.177 25.347 1.00 0.00 O ATOM 46826 O21 PGR 1151 64.911 73.749 29.845 1.00 0.00 O ATOM 46827 C21 PGR 1151 65.808 72.812 29.828 1.00 0.00 C ATOM 46828 O22 PGR 1151 66.593 72.597 28.938 1.00 0.00 O ATOM 46829 O36 PGR 1151 64.310 73.346 21.767 1.00 0.00 O ATOM 46830 HO6A PGR 1151 64.210 72.818 22.579 1.00 0.00 H ATOM 46831 C12 OL 1152 65.776 71.871 30.943 1.00 0.00 C ATOM 46832 H2R OL 1152 64.813 71.357 30.908 1.00 0.00 H ATOM 46833 H2S OL 1152 66.572 71.127 30.870 1.00 0.00 H ATOM 46834 C13 OL 1152 65.949 72.574 32.357 1.00 0.00 C ATOM 46835 H3R OL 1152 65.816 71.776 33.090 1.00 0.00 H ATOM 46836 H3S OL 1152 66.993 72.892 32.406 1.00 0.00 H ATOM 46837 C14 OL 1152 65.039 73.733 32.721 1.00 0.00 C ATOM 46838 H4R OL 1152 65.078 74.084 33.754 1.00 0.00 H ATOM 46839 H4S OL 1152 65.382 74.599 32.152 1.00 0.00 H ATOM 46840 C15 OL 1152 63.531 73.503 32.603 1.00 0.00 C ATOM 46841 H5R OL 1152 63.355 73.189 31.572 1.00 0.00 H ATOM 46842 H5S OL 1152 63.292 72.778 33.385 1.00 0.00 H ATOM 46843 C16 OL 1152 62.646 74.693 32.780 1.00 0.00 C ATOM 46844 H6R OL 1152 63.022 75.388 33.534 1.00 0.00 H ATOM 46845 H6S OL 1152 62.695 75.234 31.832 1.00 0.00 H ATOM 46846 C17 OL 1152 61.211 74.282 33.007 1.00 0.00 C ATOM 46847 H7R OL 1152 60.937 73.414 33.610 1.00 0.00 H ATOM 46848 H7S OL 1152 60.805 75.106 33.598 1.00 0.00 H ATOM 46849 C18 OL 1152 60.475 74.184 31.634 1.00 0.00 C ATOM 46850 H8R OL 1152 61.041 73.393 31.138 1.00 0.00 H ATOM 46851 H8S OL 1152 59.472 73.783 31.793 1.00 0.00 H ATOM 46852 C19 OL 1152 60.387 75.267 30.620 1.00 0.00 C ATOM 46853 H9R OL 1152 60.956 75.256 29.693 1.00 0.00 H ATOM 46854 C110 OL 1152 59.688 76.378 30.761 1.00 0.00 C ATOM 46855 H10R OL 1152 59.805 77.104 29.961 1.00 0.00 H ATOM 46856 C111 OL 1152 58.763 76.732 31.894 1.00 0.00 C ATOM 46857 H11R OL 1152 58.924 76.087 32.761 1.00 0.00 H ATOM 46858 H11S OL 1152 59.109 77.713 32.226 1.00 0.00 H ATOM 46859 C112 OL 1152 57.308 76.883 31.452 1.00 0.00 C ATOM 46860 H12R OL 1152 57.256 77.608 30.637 1.00 0.00 H ATOM 46861 H12S OL 1152 57.008 75.907 31.067 1.00 0.00 H ATOM 46862 C113 OL 1152 56.529 77.120 32.725 1.00 0.00 C ATOM 46863 H13R OL 1152 56.759 78.029 33.286 1.00 0.00 H ATOM 46864 H13S OL 1152 55.542 77.285 32.289 1.00 0.00 H ATOM 46865 C114 OL 1152 56.605 75.936 33.732 1.00 0.00 C ATOM 46866 H14R OL 1152 57.455 75.991 34.415 1.00 0.00 H ATOM 46867 H14S OL 1152 55.771 76.144 34.405 1.00 0.00 H ATOM 46868 C115 OL 1152 56.363 74.496 33.244 1.00 0.00 C ATOM 46869 H15R OL 1152 55.558 74.593 32.513 1.00 0.00 H ATOM 46870 H15S OL 1152 57.273 74.030 32.859 1.00 0.00 H ATOM 46871 C116 OL 1152 55.743 73.648 34.336 1.00 0.00 C ATOM 46872 H16R OL 1152 56.407 73.766 35.194 1.00 0.00 H ATOM 46873 H16S OL 1152 54.823 74.040 34.775 1.00 0.00 H ATOM 46874 C117 OL 1152 55.430 72.191 33.945 1.00 0.00 C ATOM 46875 H17R OL 1152 55.059 72.178 32.917 1.00 0.00 H ATOM 46876 H17S OL 1152 56.360 71.636 34.078 1.00 0.00 H ATOM 46877 C118 OL 1152 54.337 71.463 34.783 1.00 0.00 C ATOM 46878 H18R OL 1152 53.439 72.068 34.642 1.00 0.00 H ATOM 46879 H18S OL 1152 54.703 71.573 35.806 1.00 0.00 H ATOM 46880 H18T OL 1152 54.217 70.435 34.435 1.00 0.00 H TER 46881 OL 1152 ATOM 46881 C116 PA 1153 93.561 25.827 32.369 1.00 0.00 C ATOM 46882 H16R PA 1153 92.947 26.079 31.502 1.00 0.00 H ATOM 46883 H16S PA 1153 94.453 26.450 32.273 1.00 0.00 H ATOM 46884 H16T PA 1153 92.969 26.119 33.239 1.00 0.00 H ATOM 46885 C115 PA 1153 93.865 24.313 32.432 1.00 0.00 C ATOM 46886 H15R PA 1153 94.675 24.103 33.134 1.00 0.00 H ATOM 46887 H15S PA 1153 94.344 24.046 31.488 1.00 0.00 H ATOM 46888 C114 PA 1153 92.651 23.342 32.743 1.00 0.00 C ATOM 46889 H14R PA 1153 91.822 23.703 32.131 1.00 0.00 H ATOM 46890 H14S PA 1153 92.287 23.419 33.770 1.00 0.00 H ATOM 46891 C113 PA 1153 92.739 21.862 32.326 1.00 0.00 C ATOM 46892 H13R PA 1153 93.604 21.358 32.762 1.00 0.00 H ATOM 46893 H13S PA 1153 93.081 21.898 31.290 1.00 0.00 H ATOM 46894 C112 PA 1153 91.613 21.034 32.543 1.00 0.00 C ATOM 46895 H12R PA 1153 90.738 21.558 32.153 1.00 0.00 H ATOM 46896 H12S PA 1153 91.406 20.904 33.608 1.00 0.00 H ATOM 46897 C111 PA 1153 91.825 19.589 32.048 1.00 0.00 C ATOM 46898 H11R PA 1153 91.008 19.014 32.489 1.00 0.00 H ATOM 46899 H11S PA 1153 92.709 19.210 32.565 1.00 0.00 H ATOM 46900 C110 PA 1153 91.913 19.287 30.549 1.00 0.00 C ATOM 46901 H10R PA 1153 92.273 18.259 30.468 1.00 0.00 H ATOM 46902 H10S PA 1153 92.681 19.799 29.966 1.00 0.00 H ATOM 46903 C19 PA 1153 90.623 19.504 29.834 1.00 0.00 C ATOM 46904 H9R PA 1153 90.190 20.488 30.027 1.00 0.00 H ATOM 46905 H9S PA 1153 89.908 18.786 30.242 1.00 0.00 H ATOM 46906 C18 PA 1153 90.777 19.354 28.340 1.00 0.00 C ATOM 46907 H8R PA 1153 91.131 18.338 28.152 1.00 0.00 H ATOM 46908 H8S PA 1153 91.573 20.057 28.083 1.00 0.00 H ATOM 46909 C17 PA 1153 89.530 19.869 27.569 1.00 0.00 C ATOM 46910 H7R PA 1153 89.130 20.810 27.951 1.00 0.00 H ATOM 46911 H7S PA 1153 88.771 19.095 27.703 1.00 0.00 H ATOM 46912 C16 PA 1153 89.864 20.063 26.087 1.00 0.00 C ATOM 46913 H6R PA 1153 90.179 19.109 25.659 1.00 0.00 H ATOM 46914 H6S PA 1153 90.788 20.599 26.314 1.00 0.00 H ATOM 46915 C15 PA 1153 89.026 21.094 25.169 1.00 0.00 C ATOM 46916 H5R PA 1153 89.013 22.100 25.592 1.00 0.00 H ATOM 46917 H5S PA 1153 88.024 20.661 25.212 1.00 0.00 H ATOM 46918 C14 PA 1153 89.562 21.128 23.753 1.00 0.00 C ATOM 46919 H4R PA 1153 89.804 20.088 23.525 1.00 0.00 H ATOM 46920 H4S PA 1153 90.490 21.695 23.844 1.00 0.00 H ATOM 46921 C13 PA 1153 88.681 21.813 22.804 1.00 0.00 C ATOM 46922 H3R PA 1153 89.187 22.080 21.874 1.00 0.00 H ATOM 46923 H3S PA 1153 88.494 22.791 23.253 1.00 0.00 H ATOM 46924 C12 PA 1153 87.428 21.005 22.498 1.00 0.00 C ATOM 46925 H2R PA 1153 86.777 21.007 23.375 1.00 0.00 H ATOM 46926 H2S PA 1153 87.610 19.959 22.243 1.00 0.00 H ATOM 46927 C11 PGR 1154 86.686 21.468 21.332 1.00 0.00 C ATOM 46928 O12 PGR 1154 87.235 21.635 20.220 1.00 0.00 O ATOM 46929 O11 PGR 1154 85.398 21.681 21.565 1.00 0.00 O ATOM 46930 C1 PGR 1154 84.680 22.486 20.529 1.00 0.00 C ATOM 46931 HR PGR 1154 85.054 22.077 19.588 1.00 0.00 H ATOM 46932 HS PGR 1154 84.806 23.570 20.592 1.00 0.00 H ATOM 46933 C2 PGR 1154 83.119 22.282 20.512 1.00 0.00 C ATOM 46934 HX PGR 1154 82.804 21.240 20.414 1.00 0.00 H ATOM 46935 C3 PGR 1154 82.453 23.011 19.290 1.00 0.00 C ATOM 46936 HA PGR 1154 82.909 22.705 18.345 1.00 0.00 H ATOM 46937 HB PGR 1154 82.719 24.067 19.385 1.00 0.00 H ATOM 46938 O31 PGR 1154 81.043 22.872 19.267 1.00 0.00 O ATOM 46939 P31 PGR 1154 80.162 23.925 18.355 1.00 0.00 P ATOM 46940 O32 PGR 1154 80.039 25.143 19.324 1.00 0.00 O ATOM 46941 C31 PGR 1154 79.599 25.025 20.692 1.00 0.00 C ATOM 46942 H1A PGR 1154 80.216 24.328 21.265 1.00 0.00 H ATOM 46943 H1B PGR 1154 78.571 24.653 20.652 1.00 0.00 H ATOM 46944 C32 PGR 1154 79.518 26.440 21.384 1.00 0.00 C ATOM 46945 H2A PGR 1154 79.162 26.218 22.393 1.00 0.00 H ATOM 46946 O35 PGR 1154 78.625 27.287 20.613 1.00 0.00 O ATOM 46947 HO5A PGR 1154 77.725 26.917 20.625 1.00 0.00 H ATOM 46948 C33 PGR 1154 80.852 27.104 21.608 1.00 0.00 C ATOM 46949 H3A PGR 1154 81.520 26.385 22.087 1.00 0.00 H ATOM 46950 H3B PGR 1154 81.284 27.467 20.672 1.00 0.00 H ATOM 46951 O33 PGR 1154 80.922 24.295 17.101 1.00 0.00 O ATOM 46952 O34 PGR 1154 78.766 23.431 18.179 1.00 0.00 O ATOM 46953 O21 PGR 1154 82.555 22.843 21.685 1.00 0.00 O ATOM 46954 C21 PGR 1154 82.495 22.098 22.839 1.00 0.00 C ATOM 46955 O22 PGR 1154 83.100 21.025 22.965 1.00 0.00 O ATOM 46956 O36 PGR 1154 80.733 28.238 22.446 1.00 0.00 O ATOM 46957 HO6A PGR 1154 81.590 28.685 22.559 1.00 0.00 H ATOM 46958 C12 OL 1155 81.552 22.692 23.882 1.00 0.00 C ATOM 46959 H2R OL 1155 81.979 23.670 24.115 1.00 0.00 H ATOM 46960 H2S OL 1155 80.523 22.788 23.529 1.00 0.00 H ATOM 46961 C13 OL 1155 81.490 21.791 25.028 1.00 0.00 C ATOM 46962 H3R OL 1155 80.937 20.914 24.687 1.00 0.00 H ATOM 46963 H3S OL 1155 82.479 21.458 25.349 1.00 0.00 H ATOM 46964 C14 OL 1155 80.841 22.488 26.226 1.00 0.00 C ATOM 46965 H4R OL 1155 81.395 23.337 26.633 1.00 0.00 H ATOM 46966 H4S OL 1155 79.869 22.778 25.823 1.00 0.00 H ATOM 46967 C15 OL 1155 80.539 21.611 27.452 1.00 0.00 C ATOM 46968 H5R OL 1155 79.793 20.844 27.235 1.00 0.00 H ATOM 46969 H5S OL 1155 81.415 21.087 27.840 1.00 0.00 H ATOM 46970 C16 OL 1155 79.878 22.382 28.568 1.00 0.00 C ATOM 46971 H6R OL 1155 78.903 22.766 28.263 1.00 0.00 H ATOM 46972 H6S OL 1155 79.735 21.598 29.314 1.00 0.00 H ATOM 46973 C17 OL 1155 80.721 23.568 29.068 1.00 0.00 C ATOM 46974 H7R OL 1155 80.593 24.482 28.485 1.00 0.00 H ATOM 46975 H7S OL 1155 80.163 23.747 29.989 1.00 0.00 H ATOM 46976 C18 OL 1155 82.240 23.341 29.397 1.00 0.00 C ATOM 46977 H8R OL 1155 82.493 22.369 29.824 1.00 0.00 H ATOM 46978 H8S OL 1155 82.823 23.363 28.474 1.00 0.00 H ATOM 46979 C19 OL 1155 82.756 24.447 30.229 1.00 0.00 C ATOM 46980 H9R OL 1155 82.398 25.412 29.878 1.00 0.00 H ATOM 46981 C110 OL 1155 83.641 24.382 31.279 1.00 0.00 C ATOM 46982 H10R OL 1155 83.943 25.255 31.851 1.00 0.00 H ATOM 46983 C111 OL 1155 83.945 23.104 31.945 1.00 0.00 C ATOM 46984 H11R OL 1155 84.032 22.368 31.143 1.00 0.00 H ATOM 46985 H11S OL 1155 84.919 23.182 32.431 1.00 0.00 H ATOM 46986 C112 OL 1155 83.069 22.676 33.102 1.00 0.00 C ATOM 46987 H12R OL 1155 82.006 22.661 32.851 1.00 0.00 H ATOM 46988 H12S OL 1155 83.307 21.619 33.238 1.00 0.00 H ATOM 46989 C113 OL 1155 83.273 23.430 34.418 1.00 0.00 C ATOM 46990 H13R OL 1155 84.311 23.354 34.748 1.00 0.00 H ATOM 46991 H13S OL 1155 83.063 24.495 34.303 1.00 0.00 H ATOM 46992 C114 OL 1155 82.457 22.777 35.504 1.00 0.00 C ATOM 46993 H14R OL 1155 81.429 23.043 35.251 1.00 0.00 H ATOM 46994 H14S OL 1155 82.501 21.687 35.460 1.00 0.00 H ATOM 46995 C115 OL 1155 82.746 23.266 36.887 1.00 0.00 C ATOM 46996 H15R OL 1155 83.739 23.717 36.944 1.00 0.00 H ATOM 46997 H15S OL 1155 82.049 24.103 36.973 1.00 0.00 H ATOM 46998 C116 OL 1155 82.557 22.148 37.966 1.00 0.00 C ATOM 46999 H16R OL 1155 83.332 21.397 37.796 1.00 0.00 H ATOM 47000 H16S OL 1155 82.875 22.577 38.919 1.00 0.00 H ATOM 47001 C117 OL 1155 81.165 21.428 37.927 1.00 0.00 C ATOM 47002 H17R OL 1155 81.042 20.832 37.021 1.00 0.00 H ATOM 47003 H17S OL 1155 81.098 20.804 38.821 1.00 0.00 H ATOM 47004 C118 OL 1155 80.032 22.421 37.943 1.00 0.00 C ATOM 47005 H18R OL 1155 79.135 21.917 38.309 1.00 0.00 H ATOM 47006 H18S OL 1155 79.844 22.873 36.967 1.00 0.00 H ATOM 47007 H18T OL 1155 80.206 23.189 38.700 1.00 0.00 H TER 47008 OL 1155 ATOM 47008 C116 PA 1156 47.847 146.746 42.945 1.00 0.00 C ATOM 47009 H16R PA 1156 48.764 146.157 42.879 1.00 0.00 H ATOM 47010 H16S PA 1156 46.980 146.084 42.985 1.00 0.00 H ATOM 47011 H16T PA 1156 48.028 147.226 43.909 1.00 0.00 H ATOM 47012 C115 PA 1156 47.647 147.775 41.869 1.00 0.00 C ATOM 47013 H15R PA 1156 46.878 148.522 42.079 1.00 0.00 H ATOM 47014 H15S PA 1156 47.309 147.316 40.938 1.00 0.00 H ATOM 47015 C114 PA 1156 48.934 148.687 41.739 1.00 0.00 C ATOM 47016 H14R PA 1156 49.806 148.129 42.086 1.00 0.00 H ATOM 47017 H14S PA 1156 48.759 149.501 42.446 1.00 0.00 H ATOM 47018 C113 PA 1156 49.198 149.179 40.310 1.00 0.00 C ATOM 47019 H13R PA 1156 49.994 149.924 40.378 1.00 0.00 H ATOM 47020 H13S PA 1156 48.301 149.736 40.033 1.00 0.00 H ATOM 47021 C112 PA 1156 49.559 148.092 39.379 1.00 0.00 C ATOM 47022 H12R PA 1156 48.805 147.305 39.455 1.00 0.00 H ATOM 47023 H12S PA 1156 50.508 147.651 39.691 1.00 0.00 H ATOM 47024 C111 PA 1156 49.619 148.485 37.925 1.00 0.00 C ATOM 47025 H11R PA 1156 50.153 147.785 37.279 1.00 0.00 H ATOM 47026 H11S PA 1156 50.178 149.395 37.699 1.00 0.00 H ATOM 47027 C110 PA 1156 48.268 148.581 37.272 1.00 0.00 C ATOM 47028 H10R PA 1156 47.800 149.343 37.898 1.00 0.00 H ATOM 47029 H10S PA 1156 47.628 147.734 37.525 1.00 0.00 H ATOM 47030 C19 PA 1156 48.259 148.821 35.786 1.00 0.00 C ATOM 47031 H9R PA 1156 49.108 148.315 35.322 1.00 0.00 H ATOM 47032 H9S PA 1156 48.312 149.869 35.485 1.00 0.00 H ATOM 47033 C18 PA 1156 47.000 148.287 35.178 1.00 0.00 C ATOM 47034 H8R PA 1156 46.176 148.996 35.284 1.00 0.00 H ATOM 47035 H8S PA 1156 46.603 147.379 35.637 1.00 0.00 H ATOM 47036 C17 PA 1156 47.037 148.166 33.666 1.00 0.00 C ATOM 47037 H7R PA 1156 47.750 147.391 33.377 1.00 0.00 H ATOM 47038 H7S PA 1156 47.431 149.047 33.154 1.00 0.00 H ATOM 47039 C16 PA 1156 45.705 147.829 32.886 1.00 0.00 C ATOM 47040 H6R PA 1156 44.907 148.540 33.110 1.00 0.00 H ATOM 47041 H6S PA 1156 45.390 146.864 33.288 1.00 0.00 H ATOM 47042 C15 PA 1156 45.893 147.919 31.406 1.00 0.00 C ATOM 47043 H5R PA 1156 46.531 147.109 31.049 1.00 0.00 H ATOM 47044 H5S PA 1156 46.400 148.859 31.177 1.00 0.00 H ATOM 47045 C14 PA 1156 44.644 147.947 30.603 1.00 0.00 C ATOM 47046 H4R PA 1156 44.250 148.953 30.765 1.00 0.00 H ATOM 47047 H4S PA 1156 44.014 147.235 31.140 1.00 0.00 H ATOM 47048 C13 PA 1156 44.790 147.750 29.136 1.00 0.00 C ATOM 47049 H3R PA 1156 44.981 146.681 29.017 1.00 0.00 H ATOM 47050 H3S PA 1156 45.616 148.387 28.814 1.00 0.00 H ATOM 47051 C12 PA 1156 43.590 148.101 28.301 1.00 0.00 C ATOM 47052 H2R PA 1156 43.269 149.113 28.558 1.00 0.00 H ATOM 47053 H2S PA 1156 42.623 147.628 28.490 1.00 0.00 H ATOM 47054 C11 PC 1157 43.927 148.074 26.809 1.00 0.00 C ATOM 47055 O12 PC 1157 44.792 148.761 26.334 1.00 0.00 O ATOM 47056 O11 PC 1157 43.008 147.489 26.002 1.00 0.00 O ATOM 47057 C1 PC 1157 43.263 147.427 24.570 1.00 0.00 C ATOM 47058 HR PC 1157 43.365 148.473 24.268 1.00 0.00 H ATOM 47059 HS PC 1157 42.373 147.004 24.097 1.00 0.00 H ATOM 47060 C2 PC 1157 44.548 146.674 24.056 1.00 0.00 C ATOM 47061 HX PC 1157 45.392 147.182 24.529 1.00 0.00 H ATOM 47062 C3 PC 1157 44.672 146.905 22.581 1.00 0.00 C ATOM 47063 HA PC 1157 45.635 146.621 22.151 1.00 0.00 H ATOM 47064 HB PC 1157 44.555 147.989 22.511 1.00 0.00 H ATOM 47065 O31 PC 1157 43.632 146.263 21.813 1.00 0.00 O ATOM 47066 P31 PC 1157 43.118 146.920 20.485 1.00 0.00 P ATOM 47067 O32 PC 1157 44.399 146.964 19.542 1.00 0.00 O ATOM 47068 C31 PC 1157 44.917 145.820 18.929 1.00 0.00 C ATOM 47069 H1A PC 1157 44.123 145.378 18.322 1.00 0.00 H ATOM 47070 H1B PC 1157 45.290 145.134 19.694 1.00 0.00 H ATOM 47071 C32 PC 1157 46.115 146.214 18.023 1.00 0.00 C ATOM 47072 H2A PC 1157 45.902 147.136 17.480 1.00 0.00 H ATOM 47073 H2B PC 1157 46.117 145.407 17.288 1.00 0.00 H ATOM 47074 N31 PC 1157 47.491 146.466 18.635 1.00 0.00 N ATOM 47075 C33 PC 1157 48.156 145.274 19.211 1.00 0.00 C ATOM 47076 H3A PC 1157 49.167 145.433 19.590 1.00 0.00 H ATOM 47077 H3B PC 1157 48.233 144.561 18.389 1.00 0.00 H ATOM 47078 H3C PC 1157 47.621 144.824 20.048 1.00 0.00 H ATOM 47079 C34 PC 1157 48.380 147.062 17.624 1.00 0.00 C ATOM 47080 H4A PC 1157 49.414 147.094 17.969 1.00 0.00 H ATOM 47081 H4B PC 1157 48.158 148.068 17.263 1.00 0.00 H ATOM 47082 H4C PC 1157 48.291 146.353 16.800 1.00 0.00 H ATOM 47083 C35 PC 1157 47.419 147.526 19.683 1.00 0.00 C ATOM 47084 H5A PC 1157 47.001 148.390 19.165 1.00 0.00 H ATOM 47085 H5B PC 1157 48.392 147.636 20.166 1.00 0.00 H ATOM 47086 H5C PC 1157 46.705 147.121 20.402 1.00 0.00 H ATOM 47087 O33 PC 1157 42.053 146.021 20.040 1.00 0.00 O ATOM 47088 O34 PC 1157 42.746 148.322 20.871 1.00 0.00 O ATOM 47089 O21 PC 1157 44.393 145.185 24.310 1.00 0.00 O ATOM 47090 C21 PC 1157 44.716 144.812 25.589 1.00 0.00 C ATOM 47091 O22 PC 1157 45.442 145.522 26.306 1.00 0.00 O ATOM 47092 C12 OL 1158 44.271 143.451 25.980 1.00 0.00 C ATOM 47093 H2R OL 1158 43.606 143.018 25.230 1.00 0.00 H ATOM 47094 H2S OL 1158 45.144 142.801 25.889 1.00 0.00 H ATOM 47095 C13 OL 1158 43.602 143.444 27.361 1.00 0.00 C ATOM 47096 H3R OL 1158 44.428 143.781 27.990 1.00 0.00 H ATOM 47097 H3S OL 1158 42.895 144.277 27.374 1.00 0.00 H ATOM 47098 C14 OL 1158 43.238 142.066 27.788 1.00 0.00 C ATOM 47099 H4R OL 1158 42.539 141.585 27.100 1.00 0.00 H ATOM 47100 H4S OL 1158 44.164 141.487 27.803 1.00 0.00 H ATOM 47101 C15 OL 1158 42.457 142.083 29.043 1.00 0.00 C ATOM 47102 H5R OL 1158 42.855 142.912 29.632 1.00 0.00 H ATOM 47103 H5S OL 1158 41.397 142.331 28.948 1.00 0.00 H ATOM 47104 C16 OL 1158 42.331 140.662 29.596 1.00 0.00 C ATOM 47105 H6R OL 1158 41.472 140.650 30.271 1.00 0.00 H ATOM 47106 H6S OL 1158 42.070 139.963 28.799 1.00 0.00 H ATOM 47107 C17 OL 1158 43.487 140.080 30.373 1.00 0.00 C ATOM 47108 H7R OL 1158 44.291 140.156 29.638 1.00 0.00 H ATOM 47109 H7S OL 1158 43.796 140.755 31.174 1.00 0.00 H ATOM 47110 C18 OL 1158 43.243 138.638 30.856 1.00 0.00 C ATOM 47111 H8R OL 1158 42.491 138.721 31.644 1.00 0.00 H ATOM 47112 H8S OL 1158 42.864 137.989 30.064 1.00 0.00 H ATOM 47113 C19 OL 1158 44.516 138.087 31.472 1.00 0.00 C ATOM 47114 H9R OL 1158 45.371 138.755 31.414 1.00 0.00 H ATOM 47115 C110 OL 1158 44.625 136.851 31.985 1.00 0.00 C ATOM 47116 H10R OL 1158 45.587 136.500 32.350 1.00 0.00 H ATOM 47117 C111 OL 1158 43.536 135.882 32.215 1.00 0.00 C ATOM 47118 H11R OL 1158 42.512 136.193 31.997 1.00 0.00 H ATOM 47119 H11S OL 1158 43.711 134.955 31.665 1.00 0.00 H ATOM 47120 C112 OL 1158 43.744 135.288 33.609 1.00 0.00 C ATOM 47121 H12R OL 1158 43.323 134.282 33.651 1.00 0.00 H ATOM 47122 H12S OL 1158 44.790 135.005 33.748 1.00 0.00 H ATOM 47123 C113 OL 1158 43.358 136.226 34.726 1.00 0.00 C ATOM 47124 H13R OL 1158 44.188 136.098 35.423 1.00 0.00 H ATOM 47125 H13S OL 1158 43.425 137.270 34.411 1.00 0.00 H ATOM 47126 C114 OL 1158 41.990 135.975 35.308 1.00 0.00 C ATOM 47127 H14R OL 1158 41.188 136.271 34.629 1.00 0.00 H ATOM 47128 H14S OL 1158 41.858 134.891 35.269 1.00 0.00 H ATOM 47129 C115 OL 1158 41.716 136.408 36.777 1.00 0.00 C ATOM 47130 H15R OL 1158 42.621 136.487 37.383 1.00 0.00 H ATOM 47131 H15S OL 1158 41.426 137.461 36.793 1.00 0.00 H ATOM 47132 C116 OL 1158 40.598 135.740 37.474 1.00 0.00 C ATOM 47133 H16R OL 1158 40.780 134.666 37.544 1.00 0.00 H ATOM 47134 H16S OL 1158 40.538 136.057 38.517 1.00 0.00 H ATOM 47135 C117 OL 1158 39.228 135.958 36.799 1.00 0.00 C ATOM 47136 H17R OL 1158 39.268 136.760 36.058 1.00 0.00 H ATOM 47137 H17S OL 1158 39.033 135.057 36.213 1.00 0.00 H ATOM 47138 C118 OL 1158 38.073 136.064 37.725 1.00 0.00 C ATOM 47139 H18R OL 1158 38.045 135.169 38.350 1.00 0.00 H ATOM 47140 H18S OL 1158 37.096 136.192 37.254 1.00 0.00 H ATOM 47141 H18T OL 1158 38.152 136.934 38.381 1.00 0.00 H TER 47142 OL 1158 ATOM 47142 C116 PA 1159 63.139 60.302 44.058 1.00 0.00 C ATOM 47143 H16R PA 1159 62.665 61.283 44.137 1.00 0.00 H ATOM 47144 H16S PA 1159 63.853 60.315 44.884 1.00 0.00 H ATOM 47145 H16T PA 1159 62.332 59.625 44.345 1.00 0.00 H ATOM 47146 C115 PA 1159 63.816 59.950 42.711 1.00 0.00 C ATOM 47147 H15R PA 1159 64.574 59.179 42.862 1.00 0.00 H ATOM 47148 H15S PA 1159 64.246 60.848 42.264 1.00 0.00 H ATOM 47149 C114 PA 1159 62.790 59.346 41.863 1.00 0.00 C ATOM 47150 H14R PA 1159 62.121 60.135 41.511 1.00 0.00 H ATOM 47151 H14S PA 1159 62.333 58.570 42.480 1.00 0.00 H ATOM 47152 C113 PA 1159 63.493 58.729 40.653 1.00 0.00 C ATOM 47153 H13R PA 1159 64.255 58.057 41.053 1.00 0.00 H ATOM 47154 H13S PA 1159 64.049 59.549 40.194 1.00 0.00 H ATOM 47155 C112 PA 1159 62.542 58.020 39.679 1.00 0.00 C ATOM 47156 H12R PA 1159 63.238 57.681 38.909 1.00 0.00 H ATOM 47157 H12S PA 1159 61.856 58.734 39.218 1.00 0.00 H ATOM 47158 C111 PA 1159 61.655 56.929 40.380 1.00 0.00 C ATOM 47159 H11R PA 1159 60.869 57.322 41.029 1.00 0.00 H ATOM 47160 H11S PA 1159 62.215 56.442 41.181 1.00 0.00 H ATOM 47161 C110 PA 1159 61.144 55.806 39.427 1.00 0.00 C ATOM 47162 H10R PA 1159 60.918 54.950 40.065 1.00 0.00 H ATOM 47163 H10S PA 1159 61.902 55.527 38.693 1.00 0.00 H ATOM 47164 C19 PA 1159 59.844 56.034 38.726 1.00 0.00 C ATOM 47165 H9R PA 1159 60.004 56.743 37.911 1.00 0.00 H ATOM 47166 H9S PA 1159 59.134 56.481 39.424 1.00 0.00 H ATOM 47167 C18 PA 1159 59.253 54.756 38.140 1.00 0.00 C ATOM 47168 H8R PA 1159 58.412 55.057 37.512 1.00 0.00 H ATOM 47169 H8S PA 1159 58.688 54.222 38.907 1.00 0.00 H ATOM 47170 C17 PA 1159 60.185 53.817 37.292 1.00 0.00 C ATOM 47171 H7R PA 1159 59.709 52.943 36.844 1.00 0.00 H ATOM 47172 H7S PA 1159 61.006 53.551 37.961 1.00 0.00 H ATOM 47173 C16 PA 1159 60.778 54.600 36.104 1.00 0.00 C ATOM 47174 H6R PA 1159 61.623 54.034 35.705 1.00 0.00 H ATOM 47175 H6S PA 1159 61.132 55.552 36.503 1.00 0.00 H ATOM 47176 C15 PA 1159 59.752 54.777 35.006 1.00 0.00 C ATOM 47177 H5R PA 1159 60.126 55.562 34.346 1.00 0.00 H ATOM 47178 H5S PA 1159 58.829 55.206 35.402 1.00 0.00 H ATOM 47179 C14 PA 1159 59.365 53.508 34.195 1.00 0.00 C ATOM 47180 H4R PA 1159 58.442 53.046 34.552 1.00 0.00 H ATOM 47181 H4S PA 1159 60.128 52.727 34.189 1.00 0.00 H ATOM 47182 C13 PA 1159 58.962 53.916 32.738 1.00 0.00 C ATOM 47183 H3R PA 1159 59.735 54.581 32.346 1.00 0.00 H ATOM 47184 H3S PA 1159 58.024 54.466 32.833 1.00 0.00 H ATOM 47185 C12 PA 1159 58.820 52.719 31.795 1.00 0.00 C ATOM 47186 H2R PA 1159 57.916 52.111 31.872 1.00 0.00 H ATOM 47187 H2S PA 1159 59.640 52.023 31.984 1.00 0.00 H ATOM 47188 C11 PC 1160 58.835 53.083 30.402 1.00 0.00 C ATOM 47189 O12 PC 1160 58.049 53.855 29.908 1.00 0.00 O ATOM 47190 O11 PC 1160 59.806 52.539 29.697 1.00 0.00 O ATOM 47191 C1 PC 1160 60.009 52.606 28.290 1.00 0.00 C ATOM 47192 HR PC 1160 59.108 52.297 27.754 1.00 0.00 H ATOM 47193 HS PC 1160 60.711 51.787 28.112 1.00 0.00 H ATOM 47194 C2 PC 1160 60.567 53.989 27.872 1.00 0.00 C ATOM 47195 HX PC 1160 60.044 54.790 28.402 1.00 0.00 H ATOM 47196 C3 PC 1160 60.395 54.265 26.349 1.00 0.00 C ATOM 47197 HA PC 1160 59.429 53.868 26.024 1.00 0.00 H ATOM 47198 HB PC 1160 61.175 53.711 25.821 1.00 0.00 H ATOM 47199 O31 PC 1160 60.410 55.612 26.025 1.00 0.00 O ATOM 47200 P31 PC 1160 60.783 56.046 24.470 1.00 0.00 P ATOM 47201 O32 PC 1160 59.755 55.194 23.555 1.00 0.00 O ATOM 47202 C31 PC 1160 59.314 55.812 22.383 1.00 0.00 C ATOM 47203 H1A PC 1160 60.167 56.087 21.757 1.00 0.00 H ATOM 47204 H1B PC 1160 58.688 56.696 22.528 1.00 0.00 H ATOM 47205 C32 PC 1160 58.523 54.863 21.523 1.00 0.00 C ATOM 47206 H2A PC 1160 59.097 53.944 21.392 1.00 0.00 H ATOM 47207 H2B PC 1160 58.328 55.314 20.549 1.00 0.00 H ATOM 47208 N31 PC 1160 57.149 54.385 21.954 1.00 0.00 N ATOM 47209 C33 PC 1160 56.362 55.622 22.401 1.00 0.00 C ATOM 47210 H3A PC 1160 56.221 56.323 21.577 1.00 0.00 H ATOM 47211 H3B PC 1160 56.990 56.160 23.113 1.00 0.00 H ATOM 47212 H3C PC 1160 55.400 55.314 22.812 1.00 0.00 H ATOM 47213 C34 PC 1160 56.457 53.877 20.758 1.00 0.00 C ATOM 47214 H4A PC 1160 56.540 54.627 19.970 1.00 0.00 H ATOM 47215 H4B PC 1160 55.413 53.697 21.022 1.00 0.00 H ATOM 47216 H4C PC 1160 57.018 52.962 20.565 1.00 0.00 H ATOM 47217 C35 PC 1160 57.085 53.396 23.059 1.00 0.00 C ATOM 47218 H5A PC 1160 57.478 52.514 22.551 1.00 0.00 H ATOM 47219 H5B PC 1160 56.031 53.295 23.322 1.00 0.00 H ATOM 47220 H5C PC 1160 57.746 53.682 23.879 1.00 0.00 H ATOM 47221 O33 PC 1160 60.466 57.456 24.258 1.00 0.00 O ATOM 47222 O34 PC 1160 62.139 55.595 24.067 1.00 0.00 O ATOM 47223 O21 PC 1160 61.942 54.041 28.242 1.00 0.00 O ATOM 47224 C21 PC 1160 62.398 54.592 29.379 1.00 0.00 C ATOM 47225 O22 PC 1160 61.662 55.180 30.186 1.00 0.00 O ATOM 47226 C12 OL 1161 63.862 54.321 29.660 1.00 0.00 C ATOM 47227 H2R OL 1161 64.295 53.711 28.865 1.00 0.00 H ATOM 47228 H2S OL 1161 64.472 55.222 29.562 1.00 0.00 H ATOM 47229 C13 OL 1161 64.061 53.424 30.894 1.00 0.00 C ATOM 47230 H3R OL 1161 63.648 52.430 30.707 1.00 0.00 H ATOM 47231 H3S OL 1161 65.121 53.194 31.023 1.00 0.00 H ATOM 47232 C14 OL 1161 63.403 53.915 32.252 1.00 0.00 C ATOM 47233 H4R OL 1161 62.317 53.856 32.165 1.00 0.00 H ATOM 47234 H4S OL 1161 63.586 53.296 33.133 1.00 0.00 H ATOM 47235 C15 OL 1161 63.882 55.327 32.646 1.00 0.00 C ATOM 47236 H5R OL 1161 64.958 55.481 32.539 1.00 0.00 H ATOM 47237 H5S OL 1161 63.500 56.103 31.979 1.00 0.00 H ATOM 47238 C16 OL 1161 63.513 55.675 34.135 1.00 0.00 C ATOM 47239 H6R OL 1161 62.472 55.754 34.455 1.00 0.00 H ATOM 47240 H6S OL 1161 63.971 54.904 34.759 1.00 0.00 H ATOM 47241 C17 OL 1161 64.131 56.967 34.657 1.00 0.00 C ATOM 47242 H7R OL 1161 65.215 56.870 34.571 1.00 0.00 H ATOM 47243 H7S OL 1161 63.981 57.788 33.952 1.00 0.00 H ATOM 47244 C18 OL 1161 63.817 57.225 36.052 1.00 0.00 C ATOM 47245 H8R OL 1161 62.779 57.558 36.120 1.00 0.00 H ATOM 47246 H8S OL 1161 63.842 56.295 36.624 1.00 0.00 H ATOM 47247 C19 OL 1161 64.711 58.389 36.601 1.00 0.00 C ATOM 47248 H9R OL 1161 64.371 59.384 36.328 1.00 0.00 H ATOM 47249 C110 OL 1161 65.732 58.184 37.432 1.00 0.00 C ATOM 47250 H10R OL 1161 66.199 59.098 37.790 1.00 0.00 H ATOM 47251 C111 OL 1161 66.454 56.889 37.824 1.00 0.00 C ATOM 47252 H11R OL 1161 65.826 56.431 38.591 1.00 0.00 H ATOM 47253 H11S OL 1161 66.616 56.210 36.984 1.00 0.00 H ATOM 47254 C112 OL 1161 67.805 57.229 38.502 1.00 0.00 C ATOM 47255 H12R OL 1161 68.225 58.002 37.855 1.00 0.00 H ATOM 47256 H12S OL 1161 67.623 57.819 39.402 1.00 0.00 H ATOM 47257 C113 OL 1161 68.843 56.165 38.941 1.00 0.00 C ATOM 47258 H13R OL 1161 68.301 55.510 39.626 1.00 0.00 H ATOM 47259 H13S OL 1161 68.978 55.576 38.031 1.00 0.00 H ATOM 47260 C114 OL 1161 70.222 56.873 39.239 1.00 0.00 C ATOM 47261 H14R OL 1161 70.563 57.389 38.339 1.00 0.00 H ATOM 47262 H14S OL 1161 70.100 57.571 40.069 1.00 0.00 H ATOM 47263 C115 OL 1161 71.376 55.936 39.544 1.00 0.00 C ATOM 47264 H15R OL 1161 71.369 55.437 40.516 1.00 0.00 H ATOM 47265 H15S OL 1161 71.130 55.211 38.766 1.00 0.00 H ATOM 47266 C116 OL 1161 72.699 56.520 39.318 1.00 0.00 C ATOM 47267 H16R OL 1161 72.806 56.864 38.287 1.00 0.00 H ATOM 47268 H16S OL 1161 72.888 57.296 40.062 1.00 0.00 H ATOM 47269 C117 OL 1161 73.820 55.515 39.438 1.00 0.00 C ATOM 47270 H17R OL 1161 73.889 55.160 40.468 1.00 0.00 H ATOM 47271 H17S OL 1161 73.654 54.673 38.763 1.00 0.00 H ATOM 47272 C118 OL 1161 75.213 55.932 39.049 1.00 0.00 C ATOM 47273 H18R OL 1161 76.066 55.282 39.257 1.00 0.00 H ATOM 47274 H18S OL 1161 75.461 56.834 39.612 1.00 0.00 H ATOM 47275 H18T OL 1161 75.149 56.196 37.992 1.00 0.00 H TER 47276 OL 1161 ATOM 47276 C116 PA 1162 82.738 114.479 39.354 1.00 0.00 C ATOM 47277 H16R PA 1162 81.717 114.330 39.713 1.00 0.00 H ATOM 47278 H16S PA 1162 83.185 115.246 39.991 1.00 0.00 H ATOM 47279 H16T PA 1162 83.251 113.577 39.694 1.00 0.00 H ATOM 47280 C115 PA 1162 82.796 115.046 37.877 1.00 0.00 C ATOM 47281 H15R PA 1162 82.593 114.300 37.106 1.00 0.00 H ATOM 47282 H15S PA 1162 83.851 115.269 37.704 1.00 0.00 H ATOM 47283 C114 PA 1162 82.024 116.359 37.866 1.00 0.00 C ATOM 47284 H14R PA 1162 82.250 116.853 36.919 1.00 0.00 H ATOM 47285 H14S PA 1162 82.535 117.006 38.582 1.00 0.00 H ATOM 47286 C113 PA 1162 80.504 116.257 38.066 1.00 0.00 C ATOM 47287 H13R PA 1162 80.201 117.303 37.985 1.00 0.00 H ATOM 47288 H13S PA 1162 80.233 115.935 39.073 1.00 0.00 H ATOM 47289 C112 PA 1162 79.720 115.682 36.987 1.00 0.00 C ATOM 47290 H12R PA 1162 79.488 114.643 37.229 1.00 0.00 H ATOM 47291 H12S PA 1162 80.247 115.599 36.033 1.00 0.00 H ATOM 47292 C111 PA 1162 78.459 116.351 36.692 1.00 0.00 C ATOM 47293 H11R PA 1162 78.730 117.312 36.251 1.00 0.00 H ATOM 47294 H11S PA 1162 77.913 116.517 37.623 1.00 0.00 H ATOM 47295 C110 PA 1162 77.522 115.649 35.745 1.00 0.00 C ATOM 47296 H10R PA 1162 77.379 114.665 36.196 1.00 0.00 H ATOM 47297 H10S PA 1162 77.933 115.578 34.736 1.00 0.00 H ATOM 47298 C19 PA 1162 76.103 116.247 35.575 1.00 0.00 C ATOM 47299 H9R PA 1162 75.592 116.221 36.540 1.00 0.00 H ATOM 47300 H9S PA 1162 75.629 115.493 34.943 1.00 0.00 H ATOM 47301 C18 PA 1162 76.054 117.635 35.028 1.00 0.00 C ATOM 47302 H8R PA 1162 76.465 118.239 35.840 1.00 0.00 H ATOM 47303 H8S PA 1162 75.010 117.920 34.876 1.00 0.00 H ATOM 47304 C17 PA 1162 76.798 117.716 33.700 1.00 0.00 C ATOM 47305 H7R PA 1162 76.661 116.761 33.187 1.00 0.00 H ATOM 47306 H7S PA 1162 77.887 117.766 33.754 1.00 0.00 H ATOM 47307 C16 PA 1162 76.160 118.806 32.701 1.00 0.00 C ATOM 47308 H6R PA 1162 76.246 119.805 33.135 1.00 0.00 H ATOM 47309 H6S PA 1162 75.083 118.625 32.693 1.00 0.00 H ATOM 47310 C15 PA 1162 76.698 118.977 31.241 1.00 0.00 C ATOM 47311 H5R PA 1162 76.566 118.046 30.686 1.00 0.00 H ATOM 47312 H5S PA 1162 77.777 119.134 31.301 1.00 0.00 H ATOM 47313 C14 PA 1162 76.066 120.145 30.498 1.00 0.00 C ATOM 47314 H4R PA 1162 76.400 121.133 30.822 1.00 0.00 H ATOM 47315 H4S PA 1162 75.020 120.157 30.810 1.00 0.00 H ATOM 47316 C13 PA 1162 76.174 120.049 29.017 1.00 0.00 C ATOM 47317 H3R PA 1162 75.672 119.184 28.578 1.00 0.00 H ATOM 47318 H3S PA 1162 77.210 119.821 28.761 1.00 0.00 H ATOM 47319 C12 PA 1162 75.868 121.417 28.258 1.00 0.00 C ATOM 47320 H2R PA 1162 76.485 122.269 28.552 1.00 0.00 H ATOM 47321 H2S PA 1162 74.803 121.541 28.462 1.00 0.00 H ATOM 47322 C11 PGR 1163 76.021 121.094 26.795 1.00 0.00 C ATOM 47323 O12 PGR 1163 76.934 121.574 26.139 1.00 0.00 O ATOM 47324 O11 PGR 1163 75.083 120.238 26.429 1.00 0.00 O ATOM 47325 C1 PGR 1163 75.048 119.676 25.100 1.00 0.00 C ATOM 47326 HR PGR 1163 74.815 120.493 24.414 1.00 0.00 H ATOM 47327 HS PGR 1163 74.207 118.979 25.145 1.00 0.00 H ATOM 47328 C2 PGR 1163 76.372 118.871 24.843 1.00 0.00 C ATOM 47329 HX PGR 1163 77.111 119.589 24.479 1.00 0.00 H ATOM 47330 C3 PGR 1163 76.109 117.887 23.647 1.00 0.00 C ATOM 47331 HA PGR 1163 75.733 118.445 22.786 1.00 0.00 H ATOM 47332 HB PGR 1163 75.307 117.201 23.932 1.00 0.00 H ATOM 47333 O31 PGR 1163 77.238 117.235 23.312 1.00 0.00 O ATOM 47334 P31 PGR 1163 78.394 117.781 22.491 1.00 0.00 P ATOM 47335 O32 PGR 1163 78.309 116.998 21.107 1.00 0.00 O ATOM 47336 C31 PGR 1163 77.143 116.979 20.263 1.00 0.00 C ATOM 47337 H1A PGR 1163 76.647 117.952 20.305 1.00 0.00 H ATOM 47338 H1B PGR 1163 76.400 116.219 20.519 1.00 0.00 H ATOM 47339 C32 PGR 1163 77.560 116.702 18.794 1.00 0.00 C ATOM 47340 H2A PGR 1163 77.727 115.645 18.570 1.00 0.00 H ATOM 47341 O35 PGR 1163 78.749 117.459 18.498 1.00 0.00 O ATOM 47342 HO5A PGR 1163 79.320 117.284 19.267 1.00 0.00 H ATOM 47343 C33 PGR 1163 76.487 117.140 17.803 1.00 0.00 C ATOM 47344 H3A PGR 1163 76.800 116.777 16.821 1.00 0.00 H ATOM 47345 H3B PGR 1163 75.538 116.691 18.106 1.00 0.00 H ATOM 47346 O33 PGR 1163 78.240 119.223 22.231 1.00 0.00 O ATOM 47347 O34 PGR 1163 79.615 117.314 23.211 1.00 0.00 O ATOM 47348 O21 PGR 1163 76.888 118.105 25.990 1.00 0.00 O ATOM 47349 C21 PGR 1163 76.204 117.204 26.654 1.00 0.00 C ATOM 47350 O22 PGR 1163 75.012 117.065 26.508 1.00 0.00 O ATOM 47351 O36 PGR 1163 76.293 118.499 17.768 1.00 0.00 O ATOM 47352 HO6A PGR 1163 75.740 118.615 16.975 1.00 0.00 H ATOM 47353 C12 OL 1164 77.026 116.505 27.728 1.00 0.00 C ATOM 47354 H2R OL 1164 77.915 116.243 27.150 1.00 0.00 H ATOM 47355 H2S OL 1164 77.284 117.218 28.514 1.00 0.00 H ATOM 47356 C13 OL 1164 76.351 115.335 28.329 1.00 0.00 C ATOM 47357 H3R OL 1164 75.928 114.716 27.535 1.00 0.00 H ATOM 47358 H3S OL 1164 77.071 114.596 28.684 1.00 0.00 H ATOM 47359 C14 OL 1164 75.272 115.783 29.420 1.00 0.00 C ATOM 47360 H4R OL 1164 75.865 115.830 30.336 1.00 0.00 H ATOM 47361 H4S OL 1164 74.971 116.809 29.199 1.00 0.00 H ATOM 47362 C15 OL 1164 74.001 114.877 29.448 1.00 0.00 C ATOM 47363 H5R OL 1164 74.191 114.065 30.154 1.00 0.00 H ATOM 47364 H5S OL 1164 73.144 115.412 29.862 1.00 0.00 H ATOM 47365 C16 OL 1164 73.368 114.366 28.155 1.00 0.00 C ATOM 47366 H6R OL 1164 73.417 115.168 27.415 1.00 0.00 H ATOM 47367 H6S OL 1164 74.006 113.603 27.704 1.00 0.00 H ATOM 47368 C17 OL 1164 72.014 113.646 28.316 1.00 0.00 C ATOM 47369 H7R OL 1164 71.350 114.424 28.700 1.00 0.00 H ATOM 47370 H7S OL 1164 71.702 113.467 27.285 1.00 0.00 H ATOM 47371 C18 OL 1164 71.932 112.406 29.178 1.00 0.00 C ATOM 47372 H8R OL 1164 72.080 112.742 30.206 1.00 0.00 H ATOM 47373 H8S OL 1164 70.918 112.002 29.211 1.00 0.00 H ATOM 47374 C19 OL 1164 72.891 111.316 28.861 1.00 0.00 C ATOM 47375 H9R OL 1164 73.137 111.158 27.814 1.00 0.00 H ATOM 47376 C110 OL 1164 73.608 110.573 29.690 1.00 0.00 C ATOM 47377 H10R OL 1164 74.380 109.968 29.222 1.00 0.00 H ATOM 47378 C111 OL 1164 73.453 110.547 31.215 1.00 0.00 C ATOM 47379 H11R OL 1164 72.474 110.973 31.447 1.00 0.00 H ATOM 47380 H11S OL 1164 73.516 109.489 31.475 1.00 0.00 H ATOM 47381 C112 OL 1164 74.626 111.202 31.902 1.00 0.00 C ATOM 47382 H12R OL 1164 75.527 110.591 31.816 1.00 0.00 H ATOM 47383 H12S OL 1164 74.832 112.051 31.247 1.00 0.00 H ATOM 47384 C113 OL 1164 74.333 111.643 33.324 1.00 0.00 C ATOM 47385 H13R OL 1164 75.124 112.352 33.576 1.00 0.00 H ATOM 47386 H13S OL 1164 73.398 112.206 33.298 1.00 0.00 H ATOM 47387 C114 OL 1164 74.251 110.571 34.409 1.00 0.00 C ATOM 47388 H14R OL 1164 73.684 109.752 33.962 1.00 0.00 H ATOM 47389 H14S OL 1164 75.195 110.195 34.808 1.00 0.00 H ATOM 47390 C115 OL 1164 73.376 111.055 35.582 1.00 0.00 C ATOM 47391 H15R OL 1164 73.768 111.981 36.006 1.00 0.00 H ATOM 47392 H15S OL 1164 72.399 111.355 35.197 1.00 0.00 H ATOM 47393 C116 OL 1164 73.167 109.886 36.601 1.00 0.00 C ATOM 47394 H16R OL 1164 72.649 109.064 36.103 1.00 0.00 H ATOM 47395 H16S OL 1164 74.125 109.407 36.812 1.00 0.00 H ATOM 47396 C117 OL 1164 72.518 110.297 37.938 1.00 0.00 C ATOM 47397 H17R OL 1164 73.146 111.023 38.457 1.00 0.00 H ATOM 47398 H17S OL 1164 71.459 110.486 37.751 1.00 0.00 H ATOM 47399 C118 OL 1164 72.545 109.134 38.854 1.00 0.00 C ATOM 47400 H18R OL 1164 72.118 109.434 39.814 1.00 0.00 H ATOM 47401 H18S OL 1164 73.514 108.634 38.927 1.00 0.00 H ATOM 47402 H18T OL 1164 71.940 108.391 38.331 1.00 0.00 H TER 47403 OL 1164 ATOM 47403 C116 PA 1165 38.018 129.003 39.140 1.00 0.00 C ATOM 47404 H16R PA 1165 38.778 129.699 38.779 1.00 0.00 H ATOM 47405 H16S PA 1165 37.461 129.489 39.945 1.00 0.00 H ATOM 47406 H16T PA 1165 37.291 128.875 38.335 1.00 0.00 H ATOM 47407 C115 PA 1165 38.631 127.677 39.433 1.00 0.00 C ATOM 47408 H15R PA 1165 37.922 126.909 39.751 1.00 0.00 H ATOM 47409 H15S PA 1165 39.302 127.841 40.278 1.00 0.00 H ATOM 47410 C114 PA 1165 39.575 127.040 38.347 1.00 0.00 C ATOM 47411 H14R PA 1165 40.458 127.681 38.398 1.00 0.00 H ATOM 47412 H14S PA 1165 39.319 127.086 37.287 1.00 0.00 H ATOM 47413 C113 PA 1165 39.951 125.664 38.826 1.00 0.00 C ATOM 47414 H13R PA 1165 39.044 125.056 38.843 1.00 0.00 H ATOM 47415 H13S PA 1165 40.340 125.752 39.843 1.00 0.00 H ATOM 47416 C112 PA 1165 40.817 124.830 37.994 1.00 0.00 C ATOM 47417 H12R PA 1165 40.954 123.858 38.472 1.00 0.00 H ATOM 47418 H12S PA 1165 41.768 125.366 37.989 1.00 0.00 H ATOM 47419 C111 PA 1165 40.389 124.551 36.531 1.00 0.00 C ATOM 47420 H11R PA 1165 40.325 125.476 35.954 1.00 0.00 H ATOM 47421 H11S PA 1165 39.331 124.295 36.612 1.00 0.00 H ATOM 47422 C110 PA 1165 41.239 123.444 35.901 1.00 0.00 C ATOM 47423 H10R PA 1165 40.999 122.493 36.382 1.00 0.00 H ATOM 47424 H10S PA 1165 42.305 123.663 35.818 1.00 0.00 H ATOM 47425 C19 PA 1165 40.733 123.284 34.470 1.00 0.00 C ATOM 47426 H9R PA 1165 40.950 124.153 33.845 1.00 0.00 H ATOM 47427 H9S PA 1165 39.651 123.143 34.422 1.00 0.00 H ATOM 47428 C18 PA 1165 41.521 122.141 33.737 1.00 0.00 C ATOM 47429 H8R PA 1165 41.454 121.150 34.191 1.00 0.00 H ATOM 47430 H8S PA 1165 42.606 122.233 33.818 1.00 0.00 H ATOM 47431 C17 PA 1165 40.954 121.991 32.352 1.00 0.00 C ATOM 47432 H7R PA 1165 41.106 122.830 31.669 1.00 0.00 H ATOM 47433 H7S PA 1165 39.878 121.930 32.525 1.00 0.00 H ATOM 47434 C16 PA 1165 41.414 120.741 31.508 1.00 0.00 C ATOM 47435 H6R PA 1165 42.493 120.591 31.585 1.00 0.00 H ATOM 47436 H6S PA 1165 41.200 120.951 30.458 1.00 0.00 H ATOM 47437 C15 PA 1165 40.809 119.336 31.861 1.00 0.00 C ATOM 47438 H5R PA 1165 39.728 119.475 31.800 1.00 0.00 H ATOM 47439 H5S PA 1165 41.052 119.093 32.898 1.00 0.00 H ATOM 47440 C14 PA 1165 41.479 118.279 31.140 1.00 0.00 C ATOM 47441 H4R PA 1165 41.218 117.269 31.464 1.00 0.00 H ATOM 47442 H4S PA 1165 42.532 118.463 31.363 1.00 0.00 H ATOM 47443 C13 PA 1165 41.257 118.217 29.659 1.00 0.00 C ATOM 47444 H3R PA 1165 41.790 118.960 29.062 1.00 0.00 H ATOM 47445 H3S PA 1165 40.207 118.425 29.444 1.00 0.00 H ATOM 47446 C12 PA 1165 41.504 116.787 29.071 1.00 0.00 C ATOM 47447 H2R PA 1165 40.861 116.055 29.564 1.00 0.00 H ATOM 47448 H2S PA 1165 42.530 116.472 29.274 1.00 0.00 H ATOM 47449 C11 PC 1166 41.262 116.708 27.591 1.00 0.00 C ATOM 47450 O12 PC 1166 42.145 116.681 26.733 1.00 0.00 O ATOM 47451 O11 PC 1166 39.961 116.748 27.348 1.00 0.00 O ATOM 47452 C1 PC 1166 39.576 116.569 25.960 1.00 0.00 C ATOM 47453 HR PC 1166 39.965 117.378 25.336 1.00 0.00 H ATOM 47454 HS PC 1166 38.497 116.694 25.837 1.00 0.00 H ATOM 47455 C2 PC 1166 40.017 115.179 25.378 1.00 0.00 C ATOM 47456 HX PC 1166 41.090 115.246 25.181 1.00 0.00 H ATOM 47457 C3 PC 1166 39.405 114.885 24.003 1.00 0.00 C ATOM 47458 HA PC 1166 39.772 115.658 23.324 1.00 0.00 H ATOM 47459 HB PC 1166 38.335 115.105 24.047 1.00 0.00 H ATOM 47460 O31 PC 1166 39.532 113.554 23.545 1.00 0.00 O ATOM 47461 P31 PC 1166 38.585 113.005 22.402 1.00 0.00 P ATOM 47462 O32 PC 1166 39.504 112.892 21.107 1.00 0.00 O ATOM 47463 C31 PC 1166 39.617 114.009 20.310 1.00 0.00 C ATOM 47464 H1A PC 1166 39.998 114.789 20.974 1.00 0.00 H ATOM 47465 H1B PC 1166 38.742 114.312 19.729 1.00 0.00 H ATOM 47466 C32 PC 1166 40.619 113.529 19.181 1.00 0.00 C ATOM 47467 H2A PC 1166 40.250 112.663 18.629 1.00 0.00 H ATOM 47468 H2B PC 1166 41.535 113.218 19.684 1.00 0.00 H ATOM 47469 N31 PC 1166 41.138 114.471 18.178 1.00 0.00 N ATOM 47470 C33 PC 1166 40.080 114.940 17.132 1.00 0.00 C ATOM 47471 H3A PC 1166 39.763 114.253 16.346 1.00 0.00 H ATOM 47472 H3B PC 1166 40.474 115.835 16.648 1.00 0.00 H ATOM 47473 H3C PC 1166 39.187 115.203 17.702 1.00 0.00 H ATOM 47474 C34 PC 1166 41.873 115.701 18.680 1.00 0.00 C ATOM 47475 H4A PC 1166 42.567 116.133 17.957 1.00 0.00 H ATOM 47476 H4B PC 1166 42.516 115.310 19.470 1.00 0.00 H ATOM 47477 H4C PC 1166 41.251 116.460 19.157 1.00 0.00 H ATOM 47478 C35 PC 1166 42.174 113.725 17.427 1.00 0.00 C ATOM 47479 H5A PC 1166 42.950 113.519 18.166 1.00 0.00 H ATOM 47480 H5B PC 1166 42.669 114.309 16.650 1.00 0.00 H ATOM 47481 H5C PC 1166 41.777 112.770 17.080 1.00 0.00 H ATOM 47482 O33 PC 1166 38.185 111.627 22.839 1.00 0.00 O ATOM 47483 O34 PC 1166 37.424 113.932 22.215 1.00 0.00 O ATOM 47484 O21 PC 1166 39.835 114.097 26.360 1.00 0.00 O ATOM 47485 C21 PC 1166 38.499 113.760 26.707 1.00 0.00 C ATOM 47486 O22 PC 1166 37.479 114.256 26.248 1.00 0.00 O ATOM 47487 C12 OL 1167 38.405 112.679 27.741 1.00 0.00 C ATOM 47488 H2R OL 1167 37.429 112.191 27.774 1.00 0.00 H ATOM 47489 H2S OL 1167 39.013 111.803 27.505 1.00 0.00 H ATOM 47490 C13 OL 1167 38.880 113.130 29.073 1.00 0.00 C ATOM 47491 H3R OL 1167 39.723 113.810 28.933 1.00 0.00 H ATOM 47492 H3S OL 1167 38.050 113.714 29.476 1.00 0.00 H ATOM 47493 C14 OL 1167 39.122 112.035 30.076 1.00 0.00 C ATOM 47494 H4R OL 1167 38.545 111.123 29.908 1.00 0.00 H ATOM 47495 H4S OL 1167 40.077 111.506 30.057 1.00 0.00 H ATOM 47496 C15 OL 1167 38.804 112.533 31.451 1.00 0.00 C ATOM 47497 H5R OL 1167 39.464 113.323 31.817 1.00 0.00 H ATOM 47498 H5S OL 1167 37.822 113.010 31.421 1.00 0.00 H ATOM 47499 C16 OL 1167 38.486 111.448 32.492 1.00 0.00 C ATOM 47500 H6R OL 1167 37.812 110.641 32.196 1.00 0.00 H ATOM 47501 H6S OL 1167 39.416 110.906 32.675 1.00 0.00 H ATOM 47502 C17 OL 1167 38.196 111.968 33.892 1.00 0.00 C ATOM 47503 H7R OL 1167 39.002 112.647 34.178 1.00 0.00 H ATOM 47504 H7S OL 1167 37.344 112.643 33.999 1.00 0.00 H ATOM 47505 C18 OL 1167 38.102 110.793 34.914 1.00 0.00 C ATOM 47506 H8R OL 1167 37.089 110.385 34.906 1.00 0.00 H ATOM 47507 H8S OL 1167 38.859 110.034 34.705 1.00 0.00 H ATOM 47508 C19 OL 1167 38.467 111.244 36.258 1.00 0.00 C ATOM 47509 H9R OL 1167 39.244 110.659 36.743 1.00 0.00 H ATOM 47510 C110 OL 1167 37.860 112.169 37.033 1.00 0.00 C ATOM 47511 H10R OL 1167 38.266 112.507 37.983 1.00 0.00 H ATOM 47512 C111 OL 1167 36.609 112.905 36.667 1.00 0.00 C ATOM 47513 H11R OL 1167 36.283 112.914 35.625 1.00 0.00 H ATOM 47514 H11S OL 1167 35.713 112.491 37.132 1.00 0.00 H ATOM 47515 C112 OL 1167 36.546 114.355 37.009 1.00 0.00 C ATOM 47516 H12R OL 1167 36.894 114.432 38.041 1.00 0.00 H ATOM 47517 H12S OL 1167 37.288 114.944 36.466 1.00 0.00 H ATOM 47518 C113 OL 1167 35.155 114.855 36.712 1.00 0.00 C ATOM 47519 H13R OL 1167 34.940 114.620 35.667 1.00 0.00 H ATOM 47520 H13S OL 1167 34.450 114.340 37.368 1.00 0.00 H ATOM 47521 C114 OL 1167 34.996 116.366 36.950 1.00 0.00 C ATOM 47522 H14R OL 1167 35.320 116.696 37.939 1.00 0.00 H ATOM 47523 H14S OL 1167 35.647 116.906 36.259 1.00 0.00 H ATOM 47524 C115 OL 1167 33.542 116.832 36.847 1.00 0.00 C ATOM 47525 H15R OL 1167 32.799 116.309 37.452 1.00 0.00 H ATOM 47526 H15S OL 1167 33.379 117.889 37.071 1.00 0.00 H ATOM 47527 C116 OL 1167 32.950 116.709 35.449 1.00 0.00 C ATOM 47528 H16R OL 1167 33.122 115.707 35.052 1.00 0.00 H ATOM 47529 H16S OL 1167 31.863 116.733 35.551 1.00 0.00 H ATOM 47530 C117 OL 1167 33.366 117.729 34.403 1.00 0.00 C ATOM 47531 H17R OL 1167 33.179 118.738 34.776 1.00 0.00 H ATOM 47532 H17S OL 1167 34.437 117.649 34.201 1.00 0.00 H ATOM 47533 C118 OL 1167 32.620 117.556 33.031 1.00 0.00 C ATOM 47534 H18R OL 1167 32.857 116.624 32.515 1.00 0.00 H ATOM 47535 H18S OL 1167 32.880 118.316 32.292 1.00 0.00 H ATOM 47536 H18T OL 1167 31.545 117.722 33.133 1.00 0.00 H TER 47537 OL 1167 ATOM 47537 C116 PA 1168 86.991 100.095 39.025 1.00 0.00 C ATOM 47538 H16R PA 1168 86.213 100.861 39.047 1.00 0.00 H ATOM 47539 H16S PA 1168 87.343 100.140 37.993 1.00 0.00 H ATOM 47540 H16T PA 1168 87.878 100.523 39.498 1.00 0.00 H ATOM 47541 C115 PA 1168 86.669 98.738 39.544 1.00 0.00 C ATOM 47542 H15R PA 1168 87.610 98.305 39.889 1.00 0.00 H ATOM 47543 H15S PA 1168 86.170 98.106 38.808 1.00 0.00 H ATOM 47544 C114 PA 1168 85.704 98.960 40.807 1.00 0.00 C ATOM 47545 H14R PA 1168 84.791 99.492 40.532 1.00 0.00 H ATOM 47546 H14S PA 1168 86.126 99.694 41.497 1.00 0.00 H ATOM 47547 C113 PA 1168 85.314 97.551 41.511 1.00 0.00 C ATOM 47548 H13R PA 1168 86.224 97.088 41.897 1.00 0.00 H ATOM 47549 H13S PA 1168 84.815 96.896 40.794 1.00 0.00 H ATOM 47550 C112 PA 1168 84.277 97.916 42.628 1.00 0.00 C ATOM 47551 H12R PA 1168 84.836 98.308 43.480 1.00 0.00 H ATOM 47552 H12S PA 1168 83.883 96.957 42.968 1.00 0.00 H ATOM 47553 C111 PA 1168 83.049 98.712 42.291 1.00 0.00 C ATOM 47554 H11R PA 1168 83.428 99.725 42.144 1.00 0.00 H ATOM 47555 H11S PA 1168 82.483 98.889 43.208 1.00 0.00 H ATOM 47556 C110 PA 1168 82.126 98.126 41.166 1.00 0.00 C ATOM 47557 H10R PA 1168 81.704 97.163 41.460 1.00 0.00 H ATOM 47558 H10S PA 1168 82.702 98.061 40.241 1.00 0.00 H ATOM 47559 C19 PA 1168 80.947 99.143 40.942 1.00 0.00 C ATOM 47560 H9R PA 1168 81.351 100.050 40.489 1.00 0.00 H ATOM 47561 H9S PA 1168 80.535 99.375 41.927 1.00 0.00 H ATOM 47562 C18 PA 1168 79.597 98.613 40.333 1.00 0.00 C ATOM 47563 H8R PA 1168 78.947 99.490 40.299 1.00 0.00 H ATOM 47564 H8S PA 1168 79.349 97.767 40.977 1.00 0.00 H ATOM 47565 C17 PA 1168 79.771 98.331 38.845 1.00 0.00 C ATOM 47566 H7R PA 1168 80.328 97.420 38.618 1.00 0.00 H ATOM 47567 H7S PA 1168 80.428 99.061 38.368 1.00 0.00 H ATOM 47568 C16 PA 1168 78.442 98.324 38.148 1.00 0.00 C ATOM 47569 H6R PA 1168 77.861 99.238 38.289 1.00 0.00 H ATOM 47570 H6S PA 1168 77.796 97.585 38.626 1.00 0.00 H ATOM 47571 C15 PA 1168 78.679 98.228 36.650 1.00 0.00 C ATOM 47572 H5R PA 1168 79.223 97.311 36.415 1.00 0.00 H ATOM 47573 H5S PA 1168 79.204 99.095 36.243 1.00 0.00 H ATOM 47574 C14 PA 1168 77.336 98.302 35.877 1.00 0.00 C ATOM 47575 H4R PA 1168 76.983 99.328 35.992 1.00 0.00 H ATOM 47576 H4S PA 1168 76.611 97.652 36.370 1.00 0.00 H ATOM 47577 C13 PA 1168 77.384 98.068 34.356 1.00 0.00 C ATOM 47578 H3R PA 1168 78.265 98.509 33.887 1.00 0.00 H ATOM 47579 H3S PA 1168 76.607 98.696 33.916 1.00 0.00 H ATOM 47580 C12 PA 1168 77.310 96.581 34.059 1.00 0.00 C ATOM 47581 H2R PA 1168 76.368 96.133 34.381 1.00 0.00 H ATOM 47582 H2S PA 1168 78.066 96.040 34.632 1.00 0.00 H ATOM 47583 C11 PGR 1169 77.586 96.252 32.585 1.00 0.00 C ATOM 47584 O12 PGR 1169 76.653 96.328 31.819 1.00 0.00 O ATOM 47585 O11 PGR 1169 78.911 96.128 32.211 1.00 0.00 O ATOM 47586 C1 PGR 1169 79.336 96.289 30.858 1.00 0.00 C ATOM 47587 HR PGR 1169 79.386 97.358 30.633 1.00 0.00 H ATOM 47588 HS PGR 1169 78.636 95.762 30.205 1.00 0.00 H ATOM 47589 C2 PGR 1169 80.773 95.667 30.616 1.00 0.00 C ATOM 47590 HX PGR 1169 81.545 96.180 31.195 1.00 0.00 H ATOM 47591 C3 PGR 1169 81.075 95.731 29.108 1.00 0.00 C ATOM 47592 HA PGR 1169 80.531 96.531 28.600 1.00 0.00 H ATOM 47593 HB PGR 1169 80.717 94.788 28.686 1.00 0.00 H ATOM 47594 O31 PGR 1169 82.468 95.930 28.798 1.00 0.00 O ATOM 47595 P31 PGR 1169 83.065 95.867 27.390 1.00 0.00 P ATOM 47596 O32 PGR 1169 82.316 94.679 26.633 1.00 0.00 O ATOM 47597 C31 PGR 1169 82.655 93.288 26.736 1.00 0.00 C ATOM 47598 H1A PGR 1169 81.728 92.765 26.486 1.00 0.00 H ATOM 47599 H1B PGR 1169 82.947 92.911 27.719 1.00 0.00 H ATOM 47600 C32 PGR 1169 83.787 92.816 25.804 1.00 0.00 C ATOM 47601 H2A PGR 1169 84.040 91.760 25.933 1.00 0.00 H ATOM 47602 O35 PGR 1169 85.056 93.469 26.037 1.00 0.00 O ATOM 47603 HO5A PGR 1169 84.881 94.384 26.319 1.00 0.00 H ATOM 47604 C33 PGR 1169 83.430 93.062 24.346 1.00 0.00 C ATOM 47605 H3A PGR 1169 82.342 92.963 24.321 1.00 0.00 H ATOM 47606 H3B PGR 1169 83.476 94.124 24.091 1.00 0.00 H ATOM 47607 O33 PGR 1169 82.777 97.116 26.625 1.00 0.00 O ATOM 47608 O34 PGR 1169 84.470 95.489 27.640 1.00 0.00 O ATOM 47609 O21 PGR 1169 80.717 94.213 30.926 1.00 0.00 O ATOM 47610 C21 PGR 1169 81.844 93.474 31.187 1.00 0.00 C ATOM 47611 O22 PGR 1169 82.967 93.919 31.141 1.00 0.00 O ATOM 47612 O36 PGR 1169 84.002 92.191 23.410 1.00 0.00 O ATOM 47613 HO6A PGR 1169 83.691 91.328 23.737 1.00 0.00 H ATOM 47614 C12 OL 1170 81.523 92.017 31.605 1.00 0.00 C ATOM 47615 H2R OL 1170 80.594 91.738 31.103 1.00 0.00 H ATOM 47616 H2S OL 1170 82.272 91.290 31.285 1.00 0.00 H ATOM 47617 C13 OL 1170 81.331 91.890 33.144 1.00 0.00 C ATOM 47618 H3R OL 1170 82.256 92.169 33.653 1.00 0.00 H ATOM 47619 H3S OL 1170 80.541 92.518 33.562 1.00 0.00 H ATOM 47620 C14 OL 1170 81.055 90.533 33.604 1.00 0.00 C ATOM 47621 H4R OL 1170 80.149 90.083 33.194 1.00 0.00 H ATOM 47622 H4S OL 1170 81.932 90.025 33.197 1.00 0.00 H ATOM 47623 C15 OL 1170 81.048 90.361 35.043 1.00 0.00 C ATOM 47624 H5R OL 1170 82.003 90.643 35.491 1.00 0.00 H ATOM 47625 H5S OL 1170 80.319 91.053 35.469 1.00 0.00 H ATOM 47626 C16 OL 1170 80.622 88.985 35.547 1.00 0.00 C ATOM 47627 H6R OL 1170 80.821 88.894 36.617 1.00 0.00 H ATOM 47628 H6S OL 1170 79.551 88.818 35.415 1.00 0.00 H ATOM 47629 C17 OL 1170 81.370 87.829 34.906 1.00 0.00 C ATOM 47630 H7R OL 1170 81.250 87.733 33.825 1.00 0.00 H ATOM 47631 H7S OL 1170 82.412 87.721 35.213 1.00 0.00 H ATOM 47632 C18 OL 1170 80.901 86.544 35.447 1.00 0.00 C ATOM 47633 H8R OL 1170 81.032 86.428 36.524 1.00 0.00 H ATOM 47634 H8S OL 1170 79.837 86.378 35.264 1.00 0.00 H ATOM 47635 C19 OL 1170 81.597 85.373 34.791 1.00 0.00 C ATOM 47636 H9R OL 1170 81.406 85.319 33.722 1.00 0.00 H ATOM 47637 C110 OL 1170 82.447 84.529 35.342 1.00 0.00 C ATOM 47638 H10R OL 1170 82.795 83.699 34.731 1.00 0.00 H ATOM 47639 C111 OL 1170 83.016 84.526 36.693 1.00 0.00 C ATOM 47640 H11R OL 1170 84.084 84.717 36.569 1.00 0.00 H ATOM 47641 H11S OL 1170 82.716 85.397 37.280 1.00 0.00 H ATOM 47642 C112 OL 1170 82.966 83.196 37.412 1.00 0.00 C ATOM 47643 H12R OL 1170 83.206 82.328 36.794 1.00 0.00 H ATOM 47644 H12S OL 1170 83.695 83.252 38.224 1.00 0.00 H ATOM 47645 C113 OL 1170 81.562 82.880 37.917 1.00 0.00 C ATOM 47646 H13R OL 1170 80.910 82.735 37.053 1.00 0.00 H ATOM 47647 H13S OL 1170 81.526 81.936 38.463 1.00 0.00 H ATOM 47648 C114 OL 1170 80.924 83.789 38.963 1.00 0.00 C ATOM 47649 H14R OL 1170 81.030 84.810 38.590 1.00 0.00 H ATOM 47650 H14S OL 1170 79.854 83.583 38.892 1.00 0.00 H ATOM 47651 C115 OL 1170 81.385 83.768 40.389 1.00 0.00 C ATOM 47652 H15R OL 1170 81.340 82.764 40.815 1.00 0.00 H ATOM 47653 H15S OL 1170 82.422 84.109 40.368 1.00 0.00 H ATOM 47654 C116 OL 1170 80.586 84.533 41.381 1.00 0.00 C ATOM 47655 H16R OL 1170 79.515 84.320 41.391 1.00 0.00 H ATOM 47656 H16S OL 1170 80.899 84.226 42.381 1.00 0.00 H ATOM 47657 C117 OL 1170 80.963 86.041 41.488 1.00 0.00 C ATOM 47658 H17R OL 1170 82.053 86.108 41.516 1.00 0.00 H ATOM 47659 H17S OL 1170 80.641 86.571 40.589 1.00 0.00 H ATOM 47660 C118 OL 1170 80.309 86.788 42.684 1.00 0.00 C ATOM 47661 H18R OL 1170 80.372 86.270 43.643 1.00 0.00 H ATOM 47662 H18S OL 1170 79.251 86.996 42.511 1.00 0.00 H ATOM 47663 H18T OL 1170 80.784 87.771 42.671 1.00 0.00 H TER 47664 OL 1170 ATOM 47664 C116 PA 1171 78.228 131.363 42.905 1.00 0.00 C ATOM 47665 H16R PA 1171 77.407 130.718 42.585 1.00 0.00 H ATOM 47666 H16S PA 1171 77.882 132.268 43.408 1.00 0.00 H ATOM 47667 H16T PA 1171 78.803 130.802 43.645 1.00 0.00 H ATOM 47668 C115 PA 1171 78.939 131.824 41.629 1.00 0.00 C ATOM 47669 H15R PA 1171 79.368 130.923 41.185 1.00 0.00 H ATOM 47670 H15S PA 1171 79.663 132.598 41.892 1.00 0.00 H ATOM 47671 C114 PA 1171 78.037 132.229 40.463 1.00 0.00 C ATOM 47672 H14R PA 1171 77.122 132.686 40.845 1.00 0.00 H ATOM 47673 H14S PA 1171 77.522 131.368 40.033 1.00 0.00 H ATOM 47674 C113 PA 1171 78.628 133.080 39.327 1.00 0.00 C ATOM 47675 H13R PA 1171 79.535 132.596 38.959 1.00 0.00 H ATOM 47676 H13S PA 1171 79.115 133.908 39.847 1.00 0.00 H ATOM 47677 C112 PA 1171 77.635 133.621 38.276 1.00 0.00 C ATOM 47678 H12R PA 1171 77.999 134.307 37.508 1.00 0.00 H ATOM 47679 H12S PA 1171 76.977 134.234 38.895 1.00 0.00 H ATOM 47680 C111 PA 1171 76.642 132.657 37.650 1.00 0.00 C ATOM 47681 H11R PA 1171 75.828 133.234 37.205 1.00 0.00 H ATOM 47682 H11S PA 1171 76.158 132.052 38.420 1.00 0.00 H ATOM 47683 C110 PA 1171 77.292 131.750 36.532 1.00 0.00 C ATOM 47684 H10R PA 1171 76.448 131.132 36.216 1.00 0.00 H ATOM 47685 H10S PA 1171 78.078 131.136 36.976 1.00 0.00 H ATOM 47686 C19 PA 1171 77.851 132.467 35.252 1.00 0.00 C ATOM 47687 H9R PA 1171 78.919 132.552 35.461 1.00 0.00 H ATOM 47688 H9S PA 1171 77.386 133.421 34.995 1.00 0.00 H ATOM 47689 C18 PA 1171 77.736 131.653 33.982 1.00 0.00 C ATOM 47690 H8R PA 1171 76.664 131.553 33.797 1.00 0.00 H ATOM 47691 H8S PA 1171 78.142 130.654 34.153 1.00 0.00 H ATOM 47692 C17 PA 1171 78.292 132.206 32.581 1.00 0.00 C ATOM 47693 H7R PA 1171 79.353 132.338 32.803 1.00 0.00 H ATOM 47694 H7S PA 1171 77.854 133.186 32.382 1.00 0.00 H ATOM 47695 C16 PA 1171 77.988 131.416 31.387 1.00 0.00 C ATOM 47696 H6R PA 1171 76.910 131.247 31.349 1.00 0.00 H ATOM 47697 H6S PA 1171 78.460 130.436 31.482 1.00 0.00 H ATOM 47698 C15 PA 1171 78.608 131.965 30.148 1.00 0.00 C ATOM 47699 H5R PA 1171 79.694 131.878 30.228 1.00 0.00 H ATOM 47700 H5S PA 1171 78.407 133.036 30.071 1.00 0.00 H ATOM 47701 C14 PA 1171 77.990 131.390 28.862 1.00 0.00 C ATOM 47702 H4R PA 1171 78.448 131.678 27.914 1.00 0.00 H ATOM 47703 H4S PA 1171 76.969 131.774 28.813 1.00 0.00 H ATOM 47704 C13 PA 1171 77.877 129.903 28.772 1.00 0.00 C ATOM 47705 H3R PA 1171 77.158 129.660 27.986 1.00 0.00 H ATOM 47706 H3S PA 1171 77.295 129.448 29.575 1.00 0.00 H ATOM 47707 C12 PA 1171 79.202 129.100 28.568 1.00 0.00 C ATOM 47708 H2R PA 1171 78.999 128.030 28.638 1.00 0.00 H ATOM 47709 H2S PA 1171 79.906 129.411 29.343 1.00 0.00 H ATOM 47710 C11 PGR 1172 79.950 129.375 27.372 1.00 0.00 C ATOM 47711 O12 PGR 1172 80.684 130.304 27.285 1.00 0.00 O ATOM 47712 O11 PGR 1172 79.678 128.437 26.396 1.00 0.00 O ATOM 47713 C1 PGR 1172 80.145 128.714 25.109 1.00 0.00 C ATOM 47714 HR PGR 1172 80.174 127.776 24.548 1.00 0.00 H ATOM 47715 HS PGR 1172 81.182 129.047 25.203 1.00 0.00 H ATOM 47716 C2 PGR 1172 79.357 129.821 24.400 1.00 0.00 C ATOM 47717 HX PGR 1172 78.301 129.543 24.445 1.00 0.00 H ATOM 47718 C3 PGR 1172 80.003 129.966 23.004 1.00 0.00 C ATOM 47719 HA PGR 1172 79.553 130.828 22.506 1.00 0.00 H ATOM 47720 HB PGR 1172 79.770 129.004 22.541 1.00 0.00 H ATOM 47721 O31 PGR 1172 81.380 130.127 23.233 1.00 0.00 O ATOM 47722 P31 PGR 1172 82.361 130.243 22.022 1.00 0.00 P ATOM 47723 O32 PGR 1172 82.420 131.824 21.844 1.00 0.00 O ATOM 47724 C31 PGR 1172 83.125 132.761 22.750 1.00 0.00 C ATOM 47725 H1A PGR 1172 84.193 132.532 22.800 1.00 0.00 H ATOM 47726 H1B PGR 1172 82.693 132.640 23.746 1.00 0.00 H ATOM 47727 C32 PGR 1172 82.676 134.151 22.286 1.00 0.00 C ATOM 47728 H2A PGR 1172 81.607 134.090 22.070 1.00 0.00 H ATOM 47729 O35 PGR 1172 83.380 134.375 21.102 1.00 0.00 O ATOM 47730 HO5A PGR 1172 83.389 135.344 21.001 1.00 0.00 H ATOM 47731 C33 PGR 1172 83.097 135.255 23.239 1.00 0.00 C ATOM 47732 H3A PGR 1172 82.779 135.057 24.265 1.00 0.00 H ATOM 47733 H3B PGR 1172 84.188 135.292 23.179 1.00 0.00 H ATOM 47734 O33 PGR 1172 83.688 129.809 22.554 1.00 0.00 O ATOM 47735 O34 PGR 1172 81.809 129.609 20.812 1.00 0.00 O ATOM 47736 O21 PGR 1172 79.538 131.030 25.214 1.00 0.00 O ATOM 47737 C21 PGR 1172 78.714 132.086 24.898 1.00 0.00 C ATOM 47738 O22 PGR 1172 77.916 132.149 23.975 1.00 0.00 O ATOM 47739 O36 PGR 1172 82.351 136.491 22.967 1.00 0.00 O ATOM 47740 HO6A PGR 1172 82.393 137.060 23.756 1.00 0.00 H ATOM 47741 C12 OL 1173 78.980 133.238 25.800 1.00 0.00 C ATOM 47742 H2R OL 1173 78.085 133.821 26.027 1.00 0.00 H ATOM 47743 H2S OL 1173 79.416 132.889 26.738 1.00 0.00 H ATOM 47744 C13 OL 1173 79.930 134.264 25.150 1.00 0.00 C ATOM 47745 H3R OL 1173 80.873 133.804 24.847 1.00 0.00 H ATOM 47746 H3S OL 1173 79.501 134.359 24.151 1.00 0.00 H ATOM 47747 C14 OL 1173 80.207 135.514 25.966 1.00 0.00 C ATOM 47748 H4R OL 1173 80.875 136.194 25.433 1.00 0.00 H ATOM 47749 H4S OL 1173 79.269 136.014 26.217 1.00 0.00 H ATOM 47750 C15 OL 1173 80.864 135.182 27.358 1.00 0.00 C ATOM 47751 H5R OL 1173 81.061 136.188 27.735 1.00 0.00 H ATOM 47752 H5S OL 1173 80.316 134.649 28.139 1.00 0.00 H ATOM 47753 C16 OL 1173 82.148 134.292 27.352 1.00 0.00 C ATOM 47754 H6R OL 1173 81.729 133.292 27.220 1.00 0.00 H ATOM 47755 H6S OL 1173 82.770 134.323 26.455 1.00 0.00 H ATOM 47756 C17 OL 1173 83.088 134.471 28.545 1.00 0.00 C ATOM 47757 H7R OL 1173 83.373 135.498 28.783 1.00 0.00 H ATOM 47758 H7S OL 1173 82.456 134.172 29.384 1.00 0.00 H ATOM 47759 C18 OL 1173 84.354 133.607 28.571 1.00 0.00 C ATOM 47760 H8R OL 1173 84.657 133.556 29.619 1.00 0.00 H ATOM 47761 H8S OL 1173 84.094 132.626 28.166 1.00 0.00 H ATOM 47762 C19 OL 1173 85.523 134.127 27.626 1.00 0.00 C ATOM 47763 H9R OL 1173 85.205 134.309 26.602 1.00 0.00 H ATOM 47764 C110 OL 1173 86.782 134.331 28.030 1.00 0.00 C ATOM 47765 H10R OL 1173 87.589 134.655 27.379 1.00 0.00 H ATOM 47766 C111 OL 1173 87.443 133.981 29.312 1.00 0.00 C ATOM 47767 H11R OL 1173 87.077 133.134 29.897 1.00 0.00 H ATOM 47768 H11S OL 1173 88.507 133.807 29.134 1.00 0.00 H ATOM 47769 C112 OL 1173 87.593 135.348 30.051 1.00 0.00 C ATOM 47770 H12R OL 1173 88.360 135.214 30.817 1.00 0.00 H ATOM 47771 H12S OL 1173 88.179 135.998 29.398 1.00 0.00 H ATOM 47772 C113 OL 1173 86.325 135.994 30.584 1.00 0.00 C ATOM 47773 H13R OL 1173 86.389 137.068 30.772 1.00 0.00 H ATOM 47774 H13S OL 1173 85.521 135.787 29.874 1.00 0.00 H ATOM 47775 C114 OL 1173 85.819 135.416 31.845 1.00 0.00 C ATOM 47776 H14R OL 1173 86.012 134.342 31.875 1.00 0.00 H ATOM 47777 H14S OL 1173 86.420 135.878 32.631 1.00 0.00 H ATOM 47778 C115 OL 1173 84.369 135.739 32.108 1.00 0.00 C ATOM 47779 H15R OL 1173 83.752 135.396 31.275 1.00 0.00 H ATOM 47780 H15S OL 1173 84.040 135.137 32.958 1.00 0.00 H ATOM 47781 C116 OL 1173 83.936 137.245 32.332 1.00 0.00 C ATOM 47782 H16R OL 1173 84.430 137.642 33.221 1.00 0.00 H ATOM 47783 H16S OL 1173 84.284 137.835 31.482 1.00 0.00 H ATOM 47784 C117 OL 1173 82.444 137.414 32.419 1.00 0.00 C ATOM 47785 H17R OL 1173 81.923 137.296 31.466 1.00 0.00 H ATOM 47786 H17S OL 1173 82.079 136.606 33.057 1.00 0.00 H ATOM 47787 C118 OL 1173 82.028 138.696 33.173 1.00 0.00 C ATOM 47788 H18R OL 1173 80.980 138.600 33.465 1.00 0.00 H ATOM 47789 H18S OL 1173 82.125 139.647 32.644 1.00 0.00 H ATOM 47790 H18T OL 1173 82.542 138.910 34.112 1.00 0.00 H TER 47791 OL 1173 ATOM 47791 C116 PA 1174 39.475 81.218 42.641 1.00 0.00 C ATOM 47792 H16R PA 1174 40.558 81.310 42.541 1.00 0.00 H ATOM 47793 H16S PA 1174 39.153 80.808 43.600 1.00 0.00 H ATOM 47794 H16T PA 1174 39.030 82.208 42.523 1.00 0.00 H ATOM 47795 C115 PA 1174 38.921 80.421 41.481 1.00 0.00 C ATOM 47796 H15R PA 1174 37.843 80.298 41.602 1.00 0.00 H ATOM 47797 H15S PA 1174 39.370 79.438 41.635 1.00 0.00 H ATOM 47798 C114 PA 1174 39.376 80.828 40.104 1.00 0.00 C ATOM 47799 H14R PA 1174 40.429 81.104 40.021 1.00 0.00 H ATOM 47800 H14S PA 1174 38.813 81.722 39.828 1.00 0.00 H ATOM 47801 C113 PA 1174 39.297 79.780 39.024 1.00 0.00 C ATOM 47802 H13R PA 1174 38.273 79.413 39.124 1.00 0.00 H ATOM 47803 H13S PA 1174 39.924 78.903 39.198 1.00 0.00 H ATOM 47804 C112 PA 1174 39.671 80.232 37.569 1.00 0.00 C ATOM 47805 H12R PA 1174 40.581 80.828 37.658 1.00 0.00 H ATOM 47806 H12S PA 1174 38.927 80.848 37.059 1.00 0.00 H ATOM 47807 C111 PA 1174 40.033 79.067 36.721 1.00 0.00 C ATOM 47808 H11R PA 1174 39.280 78.293 36.553 1.00 0.00 H ATOM 47809 H11S PA 1174 40.823 78.524 37.245 1.00 0.00 H ATOM 47810 C110 PA 1174 40.711 79.568 35.363 1.00 0.00 C ATOM 47811 H10R PA 1174 41.365 78.730 35.111 1.00 0.00 H ATOM 47812 H10S PA 1174 41.457 80.328 35.601 1.00 0.00 H ATOM 47813 C19 PA 1174 39.724 80.026 34.249 1.00 0.00 C ATOM 47814 H9R PA 1174 39.018 80.753 34.656 1.00 0.00 H ATOM 47815 H9S PA 1174 39.062 79.178 34.063 1.00 0.00 H ATOM 47816 C18 PA 1174 40.518 80.364 32.933 1.00 0.00 C ATOM 47817 H8R PA 1174 41.259 79.568 32.831 1.00 0.00 H ATOM 47818 H8S PA 1174 41.038 81.305 33.123 1.00 0.00 H ATOM 47819 C17 PA 1174 39.780 80.310 31.634 1.00 0.00 C ATOM 47820 H7R PA 1174 39.452 79.268 31.642 1.00 0.00 H ATOM 47821 H7S PA 1174 40.460 80.615 30.836 1.00 0.00 H ATOM 47822 C16 PA 1174 38.574 81.323 31.554 1.00 0.00 C ATOM 47823 H6R PA 1174 38.838 82.225 32.111 1.00 0.00 H ATOM 47824 H6S PA 1174 37.674 80.998 32.079 1.00 0.00 H ATOM 47825 C15 PA 1174 38.278 81.707 30.125 1.00 0.00 C ATOM 47826 H5R PA 1174 38.139 80.737 29.643 1.00 0.00 H ATOM 47827 H5S PA 1174 39.168 82.264 29.824 1.00 0.00 H ATOM 47828 C14 PA 1174 37.075 82.621 30.131 1.00 0.00 C ATOM 47829 H4R PA 1174 37.301 83.637 30.459 1.00 0.00 H ATOM 47830 H4S PA 1174 36.389 82.263 30.901 1.00 0.00 H ATOM 47831 C13 PA 1174 36.360 82.648 28.826 1.00 0.00 C ATOM 47832 H3R PA 1174 36.127 81.630 28.506 1.00 0.00 H ATOM 47833 H3S PA 1174 37.048 82.947 28.032 1.00 0.00 H ATOM 47834 C12 PA 1174 35.007 83.397 28.883 1.00 0.00 C ATOM 47835 H2R PA 1174 35.128 84.320 29.453 1.00 0.00 H ATOM 47836 H2S PA 1174 34.334 82.724 29.418 1.00 0.00 H ATOM 47837 C11 PGR 1175 34.570 83.643 27.438 1.00 0.00 C ATOM 47838 O12 PGR 1175 34.436 82.834 26.503 1.00 0.00 O ATOM 47839 O11 PGR 1175 34.384 84.948 27.298 1.00 0.00 O ATOM 47840 C1 PGR 1175 33.900 85.481 25.979 1.00 0.00 C ATOM 47841 HR PGR 1175 32.901 85.055 25.852 1.00 0.00 H ATOM 47842 HS PGR 1175 34.525 85.165 25.141 1.00 0.00 H ATOM 47843 C2 PGR 1175 33.757 87.014 25.989 1.00 0.00 C ATOM 47844 HX PGR 1175 32.910 87.238 25.335 1.00 0.00 H ATOM 47845 C3 PGR 1175 35.081 87.743 25.557 1.00 0.00 C ATOM 47846 HA PGR 1175 35.561 87.268 24.698 1.00 0.00 H ATOM 47847 HB PGR 1175 35.875 87.666 26.306 1.00 0.00 H ATOM 47848 O31 PGR 1175 35.078 89.193 25.407 1.00 0.00 O ATOM 47849 P31 PGR 1175 34.467 89.919 24.122 1.00 0.00 P ATOM 47850 O32 PGR 1175 32.836 89.832 24.167 1.00 0.00 O ATOM 47851 C31 PGR 1175 32.071 90.467 25.189 1.00 0.00 C ATOM 47852 H1A PGR 1175 32.351 90.145 26.195 1.00 0.00 H ATOM 47853 H1B PGR 1175 32.259 91.542 25.140 1.00 0.00 H ATOM 47854 C32 PGR 1175 30.567 90.316 25.101 1.00 0.00 C ATOM 47855 H2A PGR 1175 30.080 91.065 25.730 1.00 0.00 H ATOM 47856 O35 PGR 1175 30.172 89.019 25.597 1.00 0.00 O ATOM 47857 HO5A PGR 1175 29.614 88.644 24.892 1.00 0.00 H ATOM 47858 C33 PGR 1175 30.144 90.474 23.676 1.00 0.00 C ATOM 47859 H3A PGR 1175 29.093 90.770 23.718 1.00 0.00 H ATOM 47860 H3B PGR 1175 30.651 91.322 23.208 1.00 0.00 H ATOM 47861 O33 PGR 1175 34.714 91.389 24.289 1.00 0.00 O ATOM 47862 O34 PGR 1175 34.965 89.216 22.930 1.00 0.00 O ATOM 47863 O21 PGR 1175 33.524 87.552 27.351 1.00 0.00 O ATOM 47864 C21 PGR 1175 32.362 87.269 28.005 1.00 0.00 C ATOM 47865 O22 PGR 1175 31.436 86.658 27.473 1.00 0.00 O ATOM 47866 O36 PGR 1175 30.335 89.204 22.992 1.00 0.00 O ATOM 47867 HO6A PGR 1175 31.268 88.986 23.167 1.00 0.00 H ATOM 47868 C12 OL 1176 32.373 87.918 29.378 1.00 0.00 C ATOM 47869 H2R OL 1176 33.318 88.228 29.830 1.00 0.00 H ATOM 47870 H2S OL 1176 31.694 88.772 29.420 1.00 0.00 H ATOM 47871 C13 OL 1176 31.822 86.869 30.313 1.00 0.00 C ATOM 47872 H3R OL 1176 31.441 87.454 31.152 1.00 0.00 H ATOM 47873 H3S OL 1176 30.996 86.337 29.837 1.00 0.00 H ATOM 47874 C14 OL 1176 32.849 85.875 30.787 1.00 0.00 C ATOM 47875 H4R OL 1176 33.313 85.344 29.954 1.00 0.00 H ATOM 47876 H4S OL 1176 33.623 86.572 31.112 1.00 0.00 H ATOM 47877 C15 OL 1176 32.304 84.858 31.827 1.00 0.00 C ATOM 47878 H5R OL 1176 31.690 85.405 32.545 1.00 0.00 H ATOM 47879 H5S OL 1176 31.614 84.381 31.127 1.00 0.00 H ATOM 47880 C16 OL 1176 33.306 83.933 32.357 1.00 0.00 C ATOM 47881 H6R OL 1176 32.874 82.937 32.473 1.00 0.00 H ATOM 47882 H6S OL 1176 34.106 83.729 31.643 1.00 0.00 H ATOM 47883 C17 OL 1176 33.894 84.317 33.644 1.00 0.00 C ATOM 47884 H7R OL 1176 33.213 84.351 34.497 1.00 0.00 H ATOM 47885 H7S OL 1176 34.525 83.540 34.082 1.00 0.00 H ATOM 47886 C18 OL 1176 34.591 85.635 33.735 1.00 0.00 C ATOM 47887 H8R OL 1176 35.091 85.790 32.776 1.00 0.00 H ATOM 47888 H8S OL 1176 33.869 86.451 33.806 1.00 0.00 H ATOM 47889 C19 OL 1176 35.545 85.788 34.874 1.00 0.00 C ATOM 47890 H9R OL 1176 35.054 85.815 35.843 1.00 0.00 H ATOM 47891 C110 OL 1176 36.889 85.890 34.801 1.00 0.00 C ATOM 47892 H10R OL 1176 37.360 86.004 35.774 1.00 0.00 H ATOM 47893 C111 OL 1176 37.762 85.957 33.678 1.00 0.00 C ATOM 47894 H11R OL 1176 37.187 86.288 32.811 1.00 0.00 H ATOM 47895 H11S OL 1176 38.524 86.686 33.961 1.00 0.00 H ATOM 47896 C112 OL 1176 38.349 84.538 33.335 1.00 0.00 C ATOM 47897 H12R OL 1176 37.475 83.929 33.096 1.00 0.00 H ATOM 47898 H12S OL 1176 39.009 84.681 32.476 1.00 0.00 H ATOM 47899 C113 OL 1176 39.315 83.850 34.282 1.00 0.00 C ATOM 47900 H13R OL 1176 38.899 83.589 35.257 1.00 0.00 H ATOM 47901 H13S OL 1176 39.681 82.905 33.876 1.00 0.00 H ATOM 47902 C114 OL 1176 40.563 84.727 34.488 1.00 0.00 C ATOM 47903 H14R OL 1176 40.910 84.923 33.472 1.00 0.00 H ATOM 47904 H14S OL 1176 40.412 85.673 35.012 1.00 0.00 H ATOM 47905 C115 OL 1176 41.538 84.019 35.490 1.00 0.00 C ATOM 47906 H15R OL 1176 41.900 83.053 35.132 1.00 0.00 H ATOM 47907 H15S OL 1176 42.452 84.610 35.586 1.00 0.00 H ATOM 47908 C116 OL 1176 40.955 83.824 36.922 1.00 0.00 C ATOM 47909 H16R OL 1176 40.386 84.738 37.108 1.00 0.00 H ATOM 47910 H16S OL 1176 40.282 82.964 36.944 1.00 0.00 H ATOM 47911 C117 OL 1176 42.025 83.644 37.951 1.00 0.00 C ATOM 47912 H17R OL 1176 42.349 82.601 37.931 1.00 0.00 H ATOM 47913 H17S OL 1176 42.875 84.210 37.564 1.00 0.00 H ATOM 47914 C118 OL 1176 41.757 84.084 39.344 1.00 0.00 C ATOM 47915 H18R OL 1176 42.400 83.562 40.056 1.00 0.00 H ATOM 47916 H18S OL 1176 40.766 83.773 39.681 1.00 0.00 H ATOM 47917 H18T OL 1176 41.831 85.173 39.363 1.00 0.00 H TER 47918 OL 1176 ATOM 47918 C116 PA 1177 31.330 91.105 45.029 1.00 0.00 C ATOM 47919 H16R PA 1177 30.323 91.168 45.447 1.00 0.00 H ATOM 47920 H16S PA 1177 31.988 90.671 45.786 1.00 0.00 H ATOM 47921 H16T PA 1177 31.446 90.386 44.216 1.00 0.00 H ATOM 47922 C115 PA 1177 31.930 92.444 44.594 1.00 0.00 C ATOM 47923 H15R PA 1177 32.020 93.150 45.422 1.00 0.00 H ATOM 47924 H15S PA 1177 31.248 92.959 43.914 1.00 0.00 H ATOM 47925 C114 PA 1177 33.303 92.260 43.948 1.00 0.00 C ATOM 47926 H14R PA 1177 33.319 91.674 43.027 1.00 0.00 H ATOM 47927 H14S PA 1177 33.944 91.767 44.682 1.00 0.00 H ATOM 47928 C113 PA 1177 34.035 93.576 43.562 1.00 0.00 C ATOM 47929 H13R PA 1177 34.977 93.350 43.058 1.00 0.00 H ATOM 47930 H13S PA 1177 34.374 94.014 44.503 1.00 0.00 H ATOM 47931 C112 PA 1177 33.376 94.500 42.684 1.00 0.00 C ATOM 47932 H12R PA 1177 34.096 95.179 42.222 1.00 0.00 H ATOM 47933 H12S PA 1177 32.839 95.133 43.393 1.00 0.00 H ATOM 47934 C111 PA 1177 32.699 93.762 41.481 1.00 0.00 C ATOM 47935 H11R PA 1177 31.721 93.363 41.758 1.00 0.00 H ATOM 47936 H11S PA 1177 33.292 92.953 41.049 1.00 0.00 H ATOM 47937 C110 PA 1177 32.531 94.590 40.142 1.00 0.00 C ATOM 47938 H10R PA 1177 33.479 94.992 39.779 1.00 0.00 H ATOM 47939 H10S PA 1177 31.875 95.460 40.225 1.00 0.00 H ATOM 47940 C19 PA 1177 32.058 93.750 39.084 1.00 0.00 C ATOM 47941 H9R PA 1177 31.090 93.381 39.428 1.00 0.00 H ATOM 47942 H9S PA 1177 32.658 92.838 39.036 1.00 0.00 H ATOM 47943 C18 PA 1177 32.051 94.419 37.709 1.00 0.00 C ATOM 47944 H8R PA 1177 31.348 95.255 37.742 1.00 0.00 H ATOM 47945 H8S PA 1177 31.567 93.724 37.020 1.00 0.00 H ATOM 47946 C17 PA 1177 33.469 94.708 37.170 1.00 0.00 C ATOM 47947 H7R PA 1177 34.117 93.974 37.652 1.00 0.00 H ATOM 47948 H7S PA 1177 33.853 95.642 37.588 1.00 0.00 H ATOM 47949 C16 PA 1177 33.695 94.656 35.679 1.00 0.00 C ATOM 47950 H6R PA 1177 32.876 95.112 35.118 1.00 0.00 H ATOM 47951 H6S PA 1177 33.502 93.623 35.383 1.00 0.00 H ATOM 47952 C15 PA 1177 35.074 95.202 35.373 1.00 0.00 C ATOM 47953 H5R PA 1177 35.818 94.918 36.120 1.00 0.00 H ATOM 47954 H5S PA 1177 35.021 96.291 35.321 1.00 0.00 H ATOM 47955 C14 PA 1177 35.561 94.658 34.010 1.00 0.00 C ATOM 47956 H4R PA 1177 35.649 93.570 34.047 1.00 0.00 H ATOM 47957 H4S PA 1177 36.607 94.964 33.941 1.00 0.00 H ATOM 47958 C13 PA 1177 34.698 95.143 32.770 1.00 0.00 C ATOM 47959 H3R PA 1177 33.642 94.868 32.812 1.00 0.00 H ATOM 47960 H3S PA 1177 35.160 94.759 31.858 1.00 0.00 H ATOM 47961 C12 PA 1177 34.632 96.697 32.535 1.00 0.00 C ATOM 47962 H2R PA 1177 35.605 97.137 32.765 1.00 0.00 H ATOM 47963 H2S PA 1177 33.926 97.228 33.177 1.00 0.00 H ATOM 47964 C11 PGR 1178 34.274 97.076 31.080 1.00 0.00 C ATOM 47965 O12 PGR 1178 34.840 97.970 30.445 1.00 0.00 O ATOM 47966 O11 PGR 1178 33.307 96.242 30.614 1.00 0.00 O ATOM 47967 C1 PGR 1178 33.006 96.409 29.202 1.00 0.00 C ATOM 47968 HR PGR 1178 33.739 95.951 28.533 1.00 0.00 H ATOM 47969 HS PGR 1178 32.864 97.450 28.903 1.00 0.00 H ATOM 47970 C2 PGR 1178 31.629 95.720 28.987 1.00 0.00 C ATOM 47971 HX PGR 1178 31.666 94.729 29.446 1.00 0.00 H ATOM 47972 C3 PGR 1178 31.283 95.662 27.512 1.00 0.00 C ATOM 47973 HA PGR 1178 30.309 95.177 27.409 1.00 0.00 H ATOM 47974 HB PGR 1178 31.992 95.062 26.936 1.00 0.00 H ATOM 47975 O31 PGR 1178 31.441 96.946 26.966 1.00 0.00 O ATOM 47976 P31 PGR 1178 30.543 97.378 25.699 1.00 0.00 P ATOM 47977 O32 PGR 1178 29.224 97.873 26.326 1.00 0.00 O ATOM 47978 C31 PGR 1178 29.134 99.097 27.126 1.00 0.00 C ATOM 47979 H1A PGR 1178 29.329 99.988 26.523 1.00 0.00 H ATOM 47980 H1B PGR 1178 29.818 99.089 27.978 1.00 0.00 H ATOM 47981 C32 PGR 1178 27.720 99.297 27.707 1.00 0.00 C ATOM 47982 H2A PGR 1178 27.397 98.366 28.179 1.00 0.00 H ATOM 47983 O35 PGR 1178 26.811 99.586 26.675 1.00 0.00 O ATOM 47984 HO5A PGR 1178 26.030 99.993 27.091 1.00 0.00 H ATOM 47985 C33 PGR 1178 27.691 100.461 28.726 1.00 0.00 C ATOM 47986 H3A PGR 1178 28.396 100.292 29.543 1.00 0.00 H ATOM 47987 H3B PGR 1178 27.945 101.311 28.087 1.00 0.00 H ATOM 47988 O33 PGR 1178 31.195 98.520 25.070 1.00 0.00 O ATOM 47989 O34 PGR 1178 30.163 96.284 24.829 1.00 0.00 O ATOM 47990 O21 PGR 1178 30.600 96.523 29.686 1.00 0.00 O ATOM 47991 C21 PGR 1178 29.321 96.011 29.783 1.00 0.00 C ATOM 47992 O22 PGR 1178 28.947 94.985 29.268 1.00 0.00 O ATOM 47993 O36 PGR 1178 26.332 100.677 28.980 1.00 0.00 O ATOM 47994 HO6A PGR 1178 26.420 101.508 29.480 1.00 0.00 H ATOM 47995 C12 OL 1179 28.485 96.837 30.683 1.00 0.00 C ATOM 47996 H2R OL 1179 29.168 97.236 31.436 1.00 0.00 H ATOM 47997 H2S OL 1179 28.240 97.696 30.056 1.00 0.00 H ATOM 47998 C13 OL 1179 27.253 96.079 31.050 1.00 0.00 C ATOM 47999 H3R OL 1179 26.452 96.773 31.314 1.00 0.00 H ATOM 48000 H3S OL 1179 26.828 95.567 30.183 1.00 0.00 H ATOM 48001 C14 OL 1179 27.362 94.902 32.051 1.00 0.00 C ATOM 48002 H4R OL 1179 28.086 94.258 31.547 1.00 0.00 H ATOM 48003 H4S OL 1179 27.864 95.083 33.003 1.00 0.00 H ATOM 48004 C15 OL 1179 26.086 94.115 32.319 1.00 0.00 C ATOM 48005 H5R OL 1179 25.357 94.807 32.747 1.00 0.00 H ATOM 48006 H5S OL 1179 25.631 93.649 31.443 1.00 0.00 H ATOM 48007 C16 OL 1179 26.291 92.980 33.329 1.00 0.00 C ATOM 48008 H6R OL 1179 26.976 92.324 32.788 1.00 0.00 H ATOM 48009 H6S OL 1179 26.836 93.271 34.230 1.00 0.00 H ATOM 48010 C17 OL 1179 24.949 92.331 33.817 1.00 0.00 C ATOM 48011 H7R OL 1179 24.289 93.104 34.218 1.00 0.00 H ATOM 48012 H7S OL 1179 24.656 91.986 32.824 1.00 0.00 H ATOM 48013 C18 OL 1179 25.273 91.192 34.718 1.00 0.00 C ATOM 48014 H8R OL 1179 25.566 90.352 34.085 1.00 0.00 H ATOM 48015 H8S OL 1179 26.075 91.460 35.409 1.00 0.00 H ATOM 48016 C19 OL 1179 24.115 90.903 35.571 1.00 0.00 C ATOM 48017 H9R OL 1179 23.271 90.736 34.906 1.00 0.00 H ATOM 48018 C110 OL 1179 23.987 90.849 36.884 1.00 0.00 C ATOM 48019 H10R OL 1179 23.021 90.633 37.333 1.00 0.00 H ATOM 48020 C111 OL 1179 25.060 91.085 37.981 1.00 0.00 C ATOM 48021 H11R OL 1179 25.801 91.795 37.609 1.00 0.00 H ATOM 48022 H11S OL 1179 24.522 91.530 38.821 1.00 0.00 H ATOM 48023 C112 OL 1179 25.648 89.770 38.481 1.00 0.00 C ATOM 48024 H12R OL 1179 24.781 89.130 38.656 1.00 0.00 H ATOM 48025 H12S OL 1179 26.267 89.306 37.711 1.00 0.00 H ATOM 48026 C113 OL 1179 26.357 89.812 39.832 1.00 0.00 C ATOM 48027 H13R OL 1179 27.118 90.588 39.940 1.00 0.00 H ATOM 48028 H13S OL 1179 25.612 90.078 40.584 1.00 0.00 H ATOM 48029 C114 OL 1179 26.933 88.434 40.192 1.00 0.00 C ATOM 48030 H14R OL 1179 26.118 87.760 40.465 1.00 0.00 H ATOM 48031 H14S OL 1179 27.458 88.028 39.326 1.00 0.00 H ATOM 48032 C115 OL 1179 27.897 88.373 41.400 1.00 0.00 C ATOM 48033 H15R OL 1179 27.260 88.578 42.263 1.00 0.00 H ATOM 48034 H15S OL 1179 28.177 87.319 41.350 1.00 0.00 H ATOM 48035 C116 OL 1179 29.169 89.362 41.336 1.00 0.00 C ATOM 48036 H16R OL 1179 28.745 90.364 41.428 1.00 0.00 H ATOM 48037 H16S OL 1179 29.756 89.253 42.251 1.00 0.00 H ATOM 48038 C117 OL 1179 30.135 89.373 40.147 1.00 0.00 C ATOM 48039 H17R OL 1179 30.201 88.405 39.646 1.00 0.00 H ATOM 48040 H17S OL 1179 29.817 90.037 39.340 1.00 0.00 H ATOM 48041 C118 OL 1179 31.571 89.801 40.506 1.00 0.00 C ATOM 48042 H18R OL 1179 32.018 90.154 39.574 1.00 0.00 H ATOM 48043 H18S OL 1179 32.195 89.052 40.996 1.00 0.00 H ATOM 48044 H18T OL 1179 31.492 90.662 41.174 1.00 0.00 H TER 48045 OL 1179 ATOM 48045 C116 PA 1180 103.435 108.666 42.243 1.00 0.00 C ATOM 48046 H16R PA 1180 103.566 107.976 43.079 1.00 0.00 H ATOM 48047 H16S PA 1180 103.654 109.670 42.611 1.00 0.00 H ATOM 48048 H16T PA 1180 104.130 108.304 41.482 1.00 0.00 H ATOM 48049 C115 PA 1180 102.013 108.647 41.667 1.00 0.00 C ATOM 48050 H15R PA 1180 101.823 107.665 41.230 1.00 0.00 H ATOM 48051 H15S PA 1180 101.954 109.238 40.751 1.00 0.00 H ATOM 48052 C114 PA 1180 100.883 109.063 42.543 1.00 0.00 C ATOM 48053 H14R PA 1180 101.129 110.041 42.962 1.00 0.00 H ATOM 48054 H14S PA 1180 100.902 108.342 43.364 1.00 0.00 H ATOM 48055 C113 PA 1180 99.480 109.068 41.773 1.00 0.00 C ATOM 48056 H13R PA 1180 98.671 109.243 42.485 1.00 0.00 H ATOM 48057 H13S PA 1180 99.288 108.082 41.345 1.00 0.00 H ATOM 48058 C112 PA 1180 99.346 110.200 40.698 1.00 0.00 C ATOM 48059 H12R PA 1180 99.934 109.842 39.850 1.00 0.00 H ATOM 48060 H12S PA 1180 99.898 111.093 40.996 1.00 0.00 H ATOM 48061 C111 PA 1180 97.927 110.615 40.282 1.00 0.00 C ATOM 48062 H11R PA 1180 97.469 111.087 41.154 1.00 0.00 H ATOM 48063 H11S PA 1180 97.396 109.672 40.136 1.00 0.00 H ATOM 48064 C110 PA 1180 97.989 111.457 38.945 1.00 0.00 C ATOM 48065 H10R PA 1180 97.457 110.808 38.246 1.00 0.00 H ATOM 48066 H10S PA 1180 98.953 111.478 38.433 1.00 0.00 H ATOM 48067 C19 PA 1180 97.254 112.754 38.987 1.00 0.00 C ATOM 48068 H9R PA 1180 97.772 113.368 39.726 1.00 0.00 H ATOM 48069 H9S PA 1180 96.325 112.556 39.525 1.00 0.00 H ATOM 48070 C18 PA 1180 97.130 113.498 37.663 1.00 0.00 C ATOM 48071 H8R PA 1180 96.362 114.268 37.767 1.00 0.00 H ATOM 48072 H8S PA 1180 96.613 112.743 37.067 1.00 0.00 H ATOM 48073 C17 PA 1180 98.454 114.018 37.192 1.00 0.00 C ATOM 48074 H7R PA 1180 99.241 113.332 37.515 1.00 0.00 H ATOM 48075 H7S PA 1180 98.744 114.915 37.743 1.00 0.00 H ATOM 48076 C16 PA 1180 98.518 114.159 35.733 1.00 0.00 C ATOM 48077 H6R PA 1180 98.211 113.184 35.348 1.00 0.00 H ATOM 48078 H6S PA 1180 99.456 114.531 35.317 1.00 0.00 H ATOM 48079 C15 PA 1180 97.541 115.322 35.352 1.00 0.00 C ATOM 48080 H5R PA 1180 97.718 116.129 36.066 1.00 0.00 H ATOM 48081 H5S PA 1180 96.502 115.018 35.491 1.00 0.00 H ATOM 48082 C14 PA 1180 97.850 115.841 33.963 1.00 0.00 C ATOM 48083 H4R PA 1180 98.856 116.258 33.874 1.00 0.00 H ATOM 48084 H4S PA 1180 97.110 116.601 33.702 1.00 0.00 H ATOM 48085 C13 PA 1180 97.661 114.772 32.774 1.00 0.00 C ATOM 48086 H3R PA 1180 98.478 114.049 32.729 1.00 0.00 H ATOM 48087 H3S PA 1180 97.735 115.320 31.832 1.00 0.00 H ATOM 48088 C12 PA 1180 96.273 114.071 32.868 1.00 0.00 C ATOM 48089 H2R PA 1180 95.490 114.778 33.148 1.00 0.00 H ATOM 48090 H2S PA 1180 96.389 113.278 33.610 1.00 0.00 H ATOM 48091 C11 PGR 1181 95.915 113.401 31.542 1.00 0.00 C ATOM 48092 O12 PGR 1181 95.849 113.968 30.469 1.00 0.00 O ATOM 48093 O11 PGR 1181 95.577 112.139 31.784 1.00 0.00 O ATOM 48094 C1 PGR 1181 95.237 111.293 30.597 1.00 0.00 C ATOM 48095 HR PGR 1181 96.086 110.713 30.228 1.00 0.00 H ATOM 48096 HS PGR 1181 94.890 111.925 29.776 1.00 0.00 H ATOM 48097 C2 PGR 1181 94.154 110.341 31.013 1.00 0.00 C ATOM 48098 HX PGR 1181 94.473 109.948 31.981 1.00 0.00 H ATOM 48099 C3 PGR 1181 93.789 109.198 30.049 1.00 0.00 C ATOM 48100 HA PGR 1181 93.045 108.502 30.445 1.00 0.00 H ATOM 48101 HB PGR 1181 94.686 108.577 29.984 1.00 0.00 H ATOM 48102 O31 PGR 1181 93.398 109.775 28.814 1.00 0.00 O ATOM 48103 P31 PGR 1181 93.345 108.913 27.460 1.00 0.00 P ATOM 48104 O32 PGR 1181 91.743 108.720 27.273 1.00 0.00 O ATOM 48105 C31 PGR 1181 91.098 107.707 27.985 1.00 0.00 C ATOM 48106 H1A PGR 1181 91.604 107.425 28.912 1.00 0.00 H ATOM 48107 H1B PGR 1181 90.860 106.839 27.364 1.00 0.00 H ATOM 48108 C32 PGR 1181 89.715 108.234 28.332 1.00 0.00 C ATOM 48109 H2A PGR 1181 89.154 107.477 28.885 1.00 0.00 H ATOM 48110 O35 PGR 1181 88.991 108.368 27.111 1.00 0.00 O ATOM 48111 HO5A PGR 1181 88.917 107.440 26.826 1.00 0.00 H ATOM 48112 C33 PGR 1181 89.717 109.490 29.121 1.00 0.00 C ATOM 48113 H3A PGR 1181 90.272 109.420 30.060 1.00 0.00 H ATOM 48114 H3B PGR 1181 90.216 110.285 28.560 1.00 0.00 H ATOM 48115 O33 PGR 1181 93.743 109.811 26.358 1.00 0.00 O ATOM 48116 O34 PGR 1181 94.021 107.643 27.681 1.00 0.00 O ATOM 48117 O21 PGR 1181 92.918 111.191 31.178 1.00 0.00 O ATOM 48118 C21 PGR 1181 91.890 110.776 31.942 1.00 0.00 C ATOM 48119 O22 PGR 1181 91.855 109.766 32.539 1.00 0.00 O ATOM 48120 O36 PGR 1181 88.356 109.803 29.432 1.00 0.00 O ATOM 48121 HO6A PGR 1181 88.188 109.377 30.292 1.00 0.00 H ATOM 48122 C12 OL 1182 90.891 111.900 32.043 1.00 0.00 C ATOM 48123 H2R OL 1182 91.333 112.707 32.631 1.00 0.00 H ATOM 48124 H2S OL 1182 90.779 112.414 31.086 1.00 0.00 H ATOM 48125 C13 OL 1182 89.546 111.568 32.627 1.00 0.00 C ATOM 48126 H3R OL 1182 89.067 110.883 31.925 1.00 0.00 H ATOM 48127 H3S OL 1182 89.704 111.064 33.584 1.00 0.00 H ATOM 48128 C14 OL 1182 88.677 112.802 32.848 1.00 0.00 C ATOM 48129 H4R OL 1182 89.151 113.621 33.393 1.00 0.00 H ATOM 48130 H4S OL 1182 88.407 113.188 31.863 1.00 0.00 H ATOM 48131 C15 OL 1182 87.319 112.563 33.640 1.00 0.00 C ATOM 48132 H5R OL 1182 86.780 111.808 33.064 1.00 0.00 H ATOM 48133 H5S OL 1182 87.480 112.091 34.612 1.00 0.00 H ATOM 48134 C16 OL 1182 86.449 113.805 33.905 1.00 0.00 C ATOM 48135 H6R OL 1182 86.845 114.508 34.640 1.00 0.00 H ATOM 48136 H6S OL 1182 86.334 114.418 33.008 1.00 0.00 H ATOM 48137 C17 OL 1182 85.139 113.203 34.388 1.00 0.00 C ATOM 48138 H7R OL 1182 84.779 112.381 33.766 1.00 0.00 H ATOM 48139 H7S OL 1182 85.362 112.788 35.373 1.00 0.00 H ATOM 48140 C18 OL 1182 84.037 114.269 34.371 1.00 0.00 C ATOM 48141 H8R OL 1182 83.095 113.728 34.485 1.00 0.00 H ATOM 48142 H8S OL 1182 84.144 115.043 35.134 1.00 0.00 H ATOM 48143 C19 OL 1182 83.872 114.928 33.053 1.00 0.00 C ATOM 48144 H9R OL 1182 83.904 114.288 32.175 1.00 0.00 H ATOM 48145 C110 OL 1182 83.910 116.241 32.743 1.00 0.00 C ATOM 48146 H10R OL 1182 83.951 116.506 31.690 1.00 0.00 H ATOM 48147 C111 OL 1182 84.232 117.386 33.666 1.00 0.00 C ATOM 48148 H11R OL 1182 84.017 117.244 34.727 1.00 0.00 H ATOM 48149 H11S OL 1182 85.313 117.519 33.576 1.00 0.00 H ATOM 48150 C112 OL 1182 83.506 118.652 33.273 1.00 0.00 C ATOM 48151 H12R OL 1182 84.119 119.485 33.624 1.00 0.00 H ATOM 48152 H12S OL 1182 83.554 118.751 32.186 1.00 0.00 H ATOM 48153 C113 OL 1182 82.154 118.990 33.766 1.00 0.00 C ATOM 48154 H13R OL 1182 81.582 118.060 33.743 1.00 0.00 H ATOM 48155 H13S OL 1182 82.269 119.206 34.830 1.00 0.00 H ATOM 48156 C114 OL 1182 81.571 120.183 33.079 1.00 0.00 C ATOM 48157 H14R OL 1182 82.314 120.969 32.927 1.00 0.00 H ATOM 48158 H14S OL 1182 81.373 119.946 32.032 1.00 0.00 H ATOM 48159 C115 OL 1182 80.389 120.653 33.861 1.00 0.00 C ATOM 48160 H15R OL 1182 79.620 119.878 33.863 1.00 0.00 H ATOM 48161 H15S OL 1182 80.656 120.846 34.902 1.00 0.00 H ATOM 48162 C116 OL 1182 79.764 121.914 33.316 1.00 0.00 C ATOM 48163 H16R OL 1182 80.453 122.646 32.888 1.00 0.00 H ATOM 48164 H16S OL 1182 79.208 121.621 32.423 1.00 0.00 H ATOM 48165 C117 OL 1182 78.877 122.507 34.342 1.00 0.00 C ATOM 48166 H17R OL 1182 78.303 121.678 34.761 1.00 0.00 H ATOM 48167 H17S OL 1182 79.457 122.770 35.228 1.00 0.00 H ATOM 48168 C118 OL 1182 78.069 123.635 33.833 1.00 0.00 C ATOM 48169 H18R OL 1182 78.779 124.422 33.569 1.00 0.00 H ATOM 48170 H18S OL 1182 77.484 124.069 34.647 1.00 0.00 H ATOM 48171 H18T OL 1182 77.370 123.429 33.020 1.00 0.00 H TER 48172 OL 1182 ATOM 48172 C116 PA 1183 56.830 54.992 45.316 1.00 0.00 C ATOM 48173 H16R PA 1183 57.857 55.174 45.640 1.00 0.00 H ATOM 48174 H16S PA 1183 56.180 55.577 45.970 1.00 0.00 H ATOM 48175 H16T PA 1183 56.737 55.287 44.269 1.00 0.00 H ATOM 48176 C115 PA 1183 56.375 53.475 45.431 1.00 0.00 C ATOM 48177 H15R PA 1183 55.319 53.430 45.156 1.00 0.00 H ATOM 48178 H15S PA 1183 56.545 53.064 46.428 1.00 0.00 H ATOM 48179 C114 PA 1183 57.044 52.600 44.330 1.00 0.00 C ATOM 48180 H14R PA 1183 56.872 51.526 44.421 1.00 0.00 H ATOM 48181 H14S PA 1183 58.126 52.722 44.258 1.00 0.00 H ATOM 48182 C113 PA 1183 56.692 53.006 42.850 1.00 0.00 C ATOM 48183 H13R PA 1183 57.161 53.962 42.607 1.00 0.00 H ATOM 48184 H13S PA 1183 55.604 53.071 42.782 1.00 0.00 H ATOM 48185 C112 PA 1183 57.215 51.968 41.791 1.00 0.00 C ATOM 48186 H12R PA 1183 58.076 51.452 42.219 1.00 0.00 H ATOM 48187 H12S PA 1183 57.582 52.462 40.889 1.00 0.00 H ATOM 48188 C111 PA 1183 56.237 50.868 41.312 1.00 0.00 C ATOM 48189 H11R PA 1183 55.371 51.386 40.896 1.00 0.00 H ATOM 48190 H11S PA 1183 56.067 50.187 42.148 1.00 0.00 H ATOM 48191 C110 PA 1183 56.831 49.977 40.132 1.00 0.00 C ATOM 48192 H10R PA 1183 56.174 49.165 39.815 1.00 0.00 H ATOM 48193 H10S PA 1183 57.735 49.515 40.534 1.00 0.00 H ATOM 48194 C19 PA 1183 57.057 50.771 38.765 1.00 0.00 C ATOM 48195 H9R PA 1183 57.786 51.556 38.976 1.00 0.00 H ATOM 48196 H9S PA 1183 56.113 51.273 38.544 1.00 0.00 H ATOM 48197 C18 PA 1183 57.640 49.995 37.599 1.00 0.00 C ATOM 48198 H8R PA 1183 56.991 49.118 37.554 1.00 0.00 H ATOM 48199 H8S PA 1183 58.617 49.526 37.730 1.00 0.00 H ATOM 48200 C17 PA 1183 57.698 50.817 36.320 1.00 0.00 C ATOM 48201 H7R PA 1183 58.057 51.785 36.676 1.00 0.00 H ATOM 48202 H7S PA 1183 56.633 50.936 36.112 1.00 0.00 H ATOM 48203 C16 PA 1183 58.570 50.181 35.279 1.00 0.00 C ATOM 48204 H6R PA 1183 59.545 49.913 35.692 1.00 0.00 H ATOM 48205 H6S PA 1183 58.807 50.771 34.392 1.00 0.00 H ATOM 48206 C15 PA 1183 57.891 48.907 34.622 1.00 0.00 C ATOM 48207 H5R PA 1183 57.754 48.117 35.364 1.00 0.00 H ATOM 48208 H5S PA 1183 58.660 48.483 33.973 1.00 0.00 H ATOM 48209 C14 PA 1183 56.550 49.007 33.811 1.00 0.00 C ATOM 48210 H4R PA 1183 55.680 49.430 34.318 1.00 0.00 H ATOM 48211 H4S PA 1183 56.203 47.984 33.647 1.00 0.00 H ATOM 48212 C13 PA 1183 56.585 49.544 32.377 1.00 0.00 C ATOM 48213 H3R PA 1183 56.631 50.632 32.302 1.00 0.00 H ATOM 48214 H3S PA 1183 55.717 49.127 31.861 1.00 0.00 H ATOM 48215 C12 PA 1183 57.716 48.938 31.583 1.00 0.00 C ATOM 48216 H2R PA 1183 57.866 47.865 31.718 1.00 0.00 H ATOM 48217 H2S PA 1183 58.589 49.473 31.962 1.00 0.00 H ATOM 48218 C11 PGR 1184 57.619 49.267 30.152 1.00 0.00 C ATOM 48219 O12 PGR 1184 57.319 50.397 29.803 1.00 0.00 O ATOM 48220 O11 PGR 1184 58.010 48.287 29.295 1.00 0.00 O ATOM 48221 C1 PGR 1184 58.053 48.536 27.867 1.00 0.00 C ATOM 48222 HR PGR 1184 58.948 49.085 27.562 1.00 0.00 H ATOM 48223 HS PGR 1184 57.114 49.025 27.595 1.00 0.00 H ATOM 48224 C2 PGR 1184 58.155 47.102 27.249 1.00 0.00 C ATOM 48225 HX PGR 1184 59.195 46.812 27.419 1.00 0.00 H ATOM 48226 C3 PGR 1184 57.751 47.237 25.829 1.00 0.00 C ATOM 48227 HA PGR 1184 58.308 48.118 25.501 1.00 0.00 H ATOM 48228 HB PGR 1184 56.668 47.389 25.827 1.00 0.00 H ATOM 48229 O31 PGR 1184 58.098 46.211 24.968 1.00 0.00 O ATOM 48230 P31 PGR 1184 57.739 46.135 23.445 1.00 0.00 P ATOM 48231 O32 PGR 1184 56.123 45.889 23.287 1.00 0.00 O ATOM 48232 C31 PGR 1184 55.241 47.008 23.493 1.00 0.00 C ATOM 48233 H1A PGR 1184 55.182 47.306 24.543 1.00 0.00 H ATOM 48234 H1B PGR 1184 55.553 47.865 22.891 1.00 0.00 H ATOM 48235 C32 PGR 1184 53.787 46.656 22.926 1.00 0.00 C ATOM 48236 H2A PGR 1184 53.067 47.473 23.021 1.00 0.00 H ATOM 48237 O35 PGR 1184 53.358 45.572 23.781 1.00 0.00 O ATOM 48238 HO5A PGR 1184 53.459 45.743 24.735 1.00 0.00 H ATOM 48239 C33 PGR 1184 53.842 46.059 21.456 1.00 0.00 C ATOM 48240 H3A PGR 1184 54.347 46.780 20.808 1.00 0.00 H ATOM 48241 H3B PGR 1184 54.460 45.157 21.484 1.00 0.00 H ATOM 48242 O33 PGR 1184 58.047 47.374 22.776 1.00 0.00 O ATOM 48243 O34 PGR 1184 58.429 44.913 22.975 1.00 0.00 O ATOM 48244 O21 PGR 1184 57.295 46.145 27.842 1.00 0.00 O ATOM 48245 C21 PGR 1184 57.816 44.866 27.904 1.00 0.00 C ATOM 48246 O22 PGR 1184 58.890 44.533 27.509 1.00 0.00 O ATOM 48247 O36 PGR 1184 52.421 45.749 21.117 1.00 0.00 O ATOM 48248 HO6A PGR 1184 52.139 44.937 21.576 1.00 0.00 H ATOM 48249 C12 OL 1185 56.679 44.004 28.468 1.00 0.00 C ATOM 48250 H2R OL 1185 55.841 44.701 28.527 1.00 0.00 H ATOM 48251 H2S OL 1185 56.540 43.294 27.650 1.00 0.00 H ATOM 48252 C13 OL 1185 56.860 43.382 29.854 1.00 0.00 C ATOM 48253 H3R OL 1185 55.924 42.864 30.073 1.00 0.00 H ATOM 48254 H3S OL 1185 57.645 42.623 29.884 1.00 0.00 H ATOM 48255 C14 OL 1185 57.418 44.338 30.938 1.00 0.00 C ATOM 48256 H4R OL 1185 58.174 45.017 30.538 1.00 0.00 H ATOM 48257 H4S OL 1185 56.507 44.852 31.252 1.00 0.00 H ATOM 48258 C15 OL 1185 58.150 43.713 32.119 1.00 0.00 C ATOM 48259 H5R OL 1185 57.508 42.915 32.498 1.00 0.00 H ATOM 48260 H5S OL 1185 59.119 43.318 31.809 1.00 0.00 H ATOM 48261 C16 OL 1185 58.227 44.752 33.215 1.00 0.00 C ATOM 48262 H6R OL 1185 58.751 45.677 32.965 1.00 0.00 H ATOM 48263 H6S OL 1185 57.254 45.001 33.645 1.00 0.00 H ATOM 48264 C17 OL 1185 59.216 44.285 34.354 1.00 0.00 C ATOM 48265 H7R OL 1185 59.278 45.033 35.147 1.00 0.00 H ATOM 48266 H7S OL 1185 58.773 43.407 34.828 1.00 0.00 H ATOM 48267 C18 OL 1185 60.649 44.096 33.887 1.00 0.00 C ATOM 48268 H8R OL 1185 60.704 43.276 33.168 1.00 0.00 H ATOM 48269 H8S OL 1185 60.986 45.056 33.490 1.00 0.00 H ATOM 48270 C19 OL 1185 61.506 43.912 35.073 1.00 0.00 C ATOM 48271 H9R OL 1185 61.216 43.124 35.764 1.00 0.00 H ATOM 48272 C110 OL 1185 62.594 44.629 35.385 1.00 0.00 C ATOM 48273 H10R OL 1185 63.195 44.252 36.209 1.00 0.00 H ATOM 48274 C111 OL 1185 63.246 45.769 34.691 1.00 0.00 C ATOM 48275 H11R OL 1185 64.314 45.666 34.484 1.00 0.00 H ATOM 48276 H11S OL 1185 62.802 46.105 33.751 1.00 0.00 H ATOM 48277 C112 OL 1185 63.107 46.906 35.702 1.00 0.00 C ATOM 48278 H12R OL 1185 62.113 47.358 35.686 1.00 0.00 H ATOM 48279 H12S OL 1185 63.311 46.507 36.698 1.00 0.00 H ATOM 48280 C113 OL 1185 64.063 48.073 35.372 1.00 0.00 C ATOM 48281 H13R OL 1185 63.919 48.928 36.035 1.00 0.00 H ATOM 48282 H13S OL 1185 65.078 47.689 35.489 1.00 0.00 H ATOM 48283 C114 OL 1185 64.001 48.823 34.010 1.00 0.00 C ATOM 48284 H14R OL 1185 64.682 49.677 34.013 1.00 0.00 H ATOM 48285 H14S OL 1185 64.376 48.253 33.158 1.00 0.00 H ATOM 48286 C115 OL 1185 62.511 49.369 33.679 1.00 0.00 C ATOM 48287 H15R OL 1185 61.746 48.656 33.994 1.00 0.00 H ATOM 48288 H15S OL 1185 62.241 50.074 34.467 1.00 0.00 H ATOM 48289 C116 OL 1185 62.345 49.808 32.257 1.00 0.00 C ATOM 48290 H16R OL 1185 61.387 50.323 32.154 1.00 0.00 H ATOM 48291 H16S OL 1185 63.085 50.589 32.073 1.00 0.00 H ATOM 48292 C117 OL 1185 62.354 48.695 31.144 1.00 0.00 C ATOM 48293 H17R OL 1185 62.978 47.829 31.378 1.00 0.00 H ATOM 48294 H17S OL 1185 61.319 48.357 31.069 1.00 0.00 H ATOM 48295 C118 OL 1185 62.775 49.248 29.764 1.00 0.00 C ATOM 48296 H18R OL 1185 62.805 50.339 29.733 1.00 0.00 H ATOM 48297 H18S OL 1185 62.257 48.815 28.906 1.00 0.00 H ATOM 48298 H18T OL 1185 63.802 48.879 29.792 1.00 0.00 H TER 48299 OL 1185 ATOM 48299 C116 PA 1186 43.089 82.384 44.199 1.00 0.00 C ATOM 48300 H16R PA 1186 43.379 82.212 45.238 1.00 0.00 H ATOM 48301 H16S PA 1186 42.150 82.939 44.156 1.00 0.00 H ATOM 48302 H16T PA 1186 43.918 82.991 43.829 1.00 0.00 H ATOM 48303 C115 PA 1186 43.061 81.040 43.433 1.00 0.00 C ATOM 48304 H15R PA 1186 42.110 80.525 43.582 1.00 0.00 H ATOM 48305 H15S PA 1186 43.812 80.437 43.948 1.00 0.00 H ATOM 48306 C114 PA 1186 43.358 81.315 41.934 1.00 0.00 C ATOM 48307 H14R PA 1186 44.316 81.831 41.840 1.00 0.00 H ATOM 48308 H14S PA 1186 42.575 81.934 41.492 1.00 0.00 H ATOM 48309 C113 PA 1186 43.296 79.965 41.172 1.00 0.00 C ATOM 48310 H13R PA 1186 42.271 79.591 41.137 1.00 0.00 H ATOM 48311 H13S PA 1186 43.890 79.243 41.737 1.00 0.00 H ATOM 48312 C112 PA 1186 43.756 80.085 39.702 1.00 0.00 C ATOM 48313 H12R PA 1186 44.759 80.516 39.728 1.00 0.00 H ATOM 48314 H12S PA 1186 43.107 80.730 39.105 1.00 0.00 H ATOM 48315 C111 PA 1186 43.950 78.712 39.169 1.00 0.00 C ATOM 48316 H11R PA 1186 43.100 78.058 39.374 1.00 0.00 H ATOM 48317 H11S PA 1186 44.743 78.138 39.653 1.00 0.00 H ATOM 48318 C110 PA 1186 44.186 78.673 37.660 1.00 0.00 C ATOM 48319 H10R PA 1186 44.939 79.427 37.420 1.00 0.00 H ATOM 48320 H10S PA 1186 43.251 78.974 37.184 1.00 0.00 H ATOM 48321 C19 PA 1186 44.593 77.244 37.239 1.00 0.00 C ATOM 48322 H9R PA 1186 43.958 76.422 37.574 1.00 0.00 H ATOM 48323 H9S PA 1186 45.515 77.153 37.817 1.00 0.00 H ATOM 48324 C18 PA 1186 45.030 77.061 35.808 1.00 0.00 C ATOM 48325 H8R PA 1186 45.254 75.992 35.818 1.00 0.00 H ATOM 48326 H8S PA 1186 45.973 77.559 35.572 1.00 0.00 H ATOM 48327 C17 PA 1186 43.968 77.262 34.797 1.00 0.00 C ATOM 48328 H7R PA 1186 43.687 78.317 34.785 1.00 0.00 H ATOM 48329 H7S PA 1186 43.088 76.716 35.143 1.00 0.00 H ATOM 48330 C16 PA 1186 44.307 76.646 33.433 1.00 0.00 C ATOM 48331 H6R PA 1186 44.598 75.595 33.487 1.00 0.00 H ATOM 48332 H6S PA 1186 45.167 77.159 32.998 1.00 0.00 H ATOM 48333 C15 PA 1186 43.159 76.814 32.313 1.00 0.00 C ATOM 48334 H5R PA 1186 42.854 77.861 32.362 1.00 0.00 H ATOM 48335 H5S PA 1186 42.323 76.149 32.539 1.00 0.00 H ATOM 48336 C14 PA 1186 43.561 76.355 30.906 1.00 0.00 C ATOM 48337 H4R PA 1186 43.680 75.279 31.045 1.00 0.00 H ATOM 48338 H4S PA 1186 44.403 76.895 30.467 1.00 0.00 H ATOM 48339 C13 PA 1186 42.370 76.665 30.001 1.00 0.00 C ATOM 48340 H3R PA 1186 42.137 77.714 30.193 1.00 0.00 H ATOM 48341 H3S PA 1186 41.508 76.049 30.267 1.00 0.00 H ATOM 48342 C12 PA 1186 42.662 76.500 28.469 1.00 0.00 C ATOM 48343 H2R PA 1186 41.700 76.589 27.960 1.00 0.00 H ATOM 48344 H2S PA 1186 43.034 75.508 28.205 1.00 0.00 H ATOM 48345 C11 PC 1187 43.612 77.444 27.832 1.00 0.00 C ATOM 48346 O12 PC 1187 44.786 77.066 27.613 1.00 0.00 O ATOM 48347 O11 PC 1187 43.117 78.714 27.634 1.00 0.00 O ATOM 48348 C1 PC 1187 43.844 79.709 26.883 1.00 0.00 C ATOM 48349 HR PC 1187 43.996 79.275 25.892 1.00 0.00 H ATOM 48350 HS PC 1187 44.825 79.869 27.338 1.00 0.00 H ATOM 48351 C2 PC 1187 43.063 80.936 26.877 1.00 0.00 C ATOM 48352 HX PC 1187 42.063 80.668 26.528 1.00 0.00 H ATOM 48353 C3 PC 1187 43.560 81.914 25.810 1.00 0.00 C ATOM 48354 HA PC 1187 43.115 82.896 25.991 1.00 0.00 H ATOM 48355 HB PC 1187 43.325 81.630 24.781 1.00 0.00 H ATOM 48356 O31 PC 1187 44.985 82.033 25.974 1.00 0.00 O ATOM 48357 P31 PC 1187 45.921 82.623 24.849 1.00 0.00 P ATOM 48358 O32 PC 1187 45.712 84.162 25.034 1.00 0.00 O ATOM 48359 C31 PC 1187 46.403 84.947 25.960 1.00 0.00 C ATOM 48360 H1A PC 1187 47.435 84.636 26.141 1.00 0.00 H ATOM 48361 H1B PC 1187 45.856 84.926 26.906 1.00 0.00 H ATOM 48362 C32 PC 1187 46.395 86.338 25.529 1.00 0.00 C ATOM 48363 H2A PC 1187 46.596 87.013 26.362 1.00 0.00 H ATOM 48364 H2B PC 1187 45.324 86.448 25.349 1.00 0.00 H ATOM 48365 N31 PC 1187 47.101 86.704 24.297 1.00 0.00 N ATOM 48366 C33 PC 1187 47.331 88.134 24.218 1.00 0.00 C ATOM 48367 H3A PC 1187 46.335 88.552 24.370 1.00 0.00 H ATOM 48368 H3B PC 1187 47.610 88.430 23.206 1.00 0.00 H ATOM 48369 H3C PC 1187 47.912 88.562 25.037 1.00 0.00 H ATOM 48370 C34 PC 1187 48.480 86.168 24.210 1.00 0.00 C ATOM 48371 H4A PC 1187 48.646 85.157 24.587 1.00 0.00 H ATOM 48372 H4B PC 1187 49.103 86.843 24.799 1.00 0.00 H ATOM 48373 H4C PC 1187 48.810 86.412 23.199 1.00 0.00 H ATOM 48374 C35 PC 1187 46.436 86.217 23.031 1.00 0.00 C ATOM 48375 H5A PC 1187 47.124 86.353 22.195 1.00 0.00 H ATOM 48376 H5B PC 1187 45.537 86.789 22.797 1.00 0.00 H ATOM 48377 H5C PC 1187 46.232 85.149 23.112 1.00 0.00 H ATOM 48378 O33 PC 1187 47.377 82.371 25.106 1.00 0.00 O ATOM 48379 O34 PC 1187 45.304 82.269 23.572 1.00 0.00 O ATOM 48380 O21 PC 1187 43.119 81.470 28.210 1.00 0.00 O ATOM 48381 C21 PC 1187 42.197 82.396 28.654 1.00 0.00 C ATOM 48382 O22 PC 1187 41.400 83.057 27.993 1.00 0.00 O ATOM 48383 C12 OL 1188 42.332 82.630 30.069 1.00 0.00 C ATOM 48384 H2R OL 1188 41.366 83.011 30.405 1.00 0.00 H ATOM 48385 H2S OL 1188 42.418 81.750 30.711 1.00 0.00 H ATOM 48386 C13 OL 1188 43.632 83.466 30.305 1.00 0.00 C ATOM 48387 H3R OL 1188 44.535 82.857 30.233 1.00 0.00 H ATOM 48388 H3S OL 1188 43.704 84.203 29.502 1.00 0.00 H ATOM 48389 C14 OL 1188 43.705 84.198 31.671 1.00 0.00 C ATOM 48390 H4R OL 1188 42.919 84.951 31.759 1.00 0.00 H ATOM 48391 H4S OL 1188 43.540 83.458 32.457 1.00 0.00 H ATOM 48392 C15 OL 1188 45.056 84.738 32.018 1.00 0.00 C ATOM 48393 H5R OL 1188 45.733 83.888 32.133 1.00 0.00 H ATOM 48394 H5S OL 1188 45.398 85.228 31.104 1.00 0.00 H ATOM 48395 C16 OL 1188 45.137 85.601 33.280 1.00 0.00 C ATOM 48396 H6R OL 1188 44.611 86.505 32.965 1.00 0.00 H ATOM 48397 H6S OL 1188 44.571 85.183 34.115 1.00 0.00 H ATOM 48398 C17 OL 1188 46.580 85.938 33.782 1.00 0.00 C ATOM 48399 H7R OL 1188 46.976 84.966 34.086 1.00 0.00 H ATOM 48400 H7S OL 1188 47.073 86.235 32.855 1.00 0.00 H ATOM 48401 C18 OL 1188 46.864 87.030 34.825 1.00 0.00 C ATOM 48402 H8R OL 1188 46.562 87.994 34.410 1.00 0.00 H ATOM 48403 H8S OL 1188 46.330 86.792 35.747 1.00 0.00 H ATOM 48404 C19 OL 1188 48.303 86.978 35.022 1.00 0.00 C ATOM 48405 H9R OL 1188 48.904 87.145 34.131 1.00 0.00 H ATOM 48406 C110 OL 1188 48.902 86.724 36.210 1.00 0.00 C ATOM 48407 H10R OL 1188 49.977 86.760 36.371 1.00 0.00 H ATOM 48408 C111 OL 1188 48.193 86.537 37.492 1.00 0.00 C ATOM 48409 H11R OL 1188 47.274 85.956 37.386 1.00 0.00 H ATOM 48410 H11S OL 1188 48.877 85.890 38.046 1.00 0.00 H ATOM 48411 C112 OL 1188 48.065 87.914 38.156 1.00 0.00 C ATOM 48412 H12R OL 1188 48.969 88.517 38.054 1.00 0.00 H ATOM 48413 H12S OL 1188 47.241 88.387 37.618 1.00 0.00 H ATOM 48414 C113 OL 1188 47.810 87.843 39.684 1.00 0.00 C ATOM 48415 H13R OL 1188 48.681 87.325 40.091 1.00 0.00 H ATOM 48416 H13S OL 1188 47.814 88.850 40.107 1.00 0.00 H ATOM 48417 C114 OL 1188 46.596 87.065 40.176 1.00 0.00 C ATOM 48418 H14R OL 1188 46.633 86.142 39.595 1.00 0.00 H ATOM 48419 H14S OL 1188 46.691 86.719 41.207 1.00 0.00 H ATOM 48420 C115 OL 1188 45.257 87.755 39.924 1.00 0.00 C ATOM 48421 H15R OL 1188 45.032 87.821 38.858 1.00 0.00 H ATOM 48422 H15S OL 1188 44.474 87.003 40.036 1.00 0.00 H ATOM 48423 C116 OL 1188 44.901 89.045 40.609 1.00 0.00 C ATOM 48424 H16R OL 1188 43.848 89.080 40.899 1.00 0.00 H ATOM 48425 H16S OL 1188 45.347 89.112 41.604 1.00 0.00 H ATOM 48426 C117 OL 1188 45.267 90.283 39.700 1.00 0.00 C ATOM 48427 H17R OL 1188 46.340 90.313 39.502 1.00 0.00 H ATOM 48428 H17S OL 1188 44.797 90.163 38.722 1.00 0.00 H ATOM 48429 C118 OL 1188 44.906 91.605 40.357 1.00 0.00 C ATOM 48430 H18R OL 1188 44.733 92.237 39.483 1.00 0.00 H ATOM 48431 H18S OL 1188 45.701 91.995 40.996 1.00 0.00 H ATOM 48432 H18T OL 1188 43.971 91.622 40.922 1.00 0.00 H TER 48433 OL 1188 ATOM 48433 C116 PA 1189 62.970 108.016 39.285 1.00 0.00 C ATOM 48434 H16R PA 1189 62.709 108.924 38.737 1.00 0.00 H ATOM 48435 H16S PA 1189 63.955 107.698 38.938 1.00 0.00 H ATOM 48436 H16T PA 1189 63.031 108.318 40.332 1.00 0.00 H ATOM 48437 C115 PA 1189 61.939 106.878 38.941 1.00 0.00 C ATOM 48438 H15R PA 1189 60.979 107.254 39.304 1.00 0.00 H ATOM 48439 H15S PA 1189 62.274 106.132 39.664 1.00 0.00 H ATOM 48440 C114 PA 1189 62.015 106.360 37.514 1.00 0.00 C ATOM 48441 H14R PA 1189 62.991 105.899 37.348 1.00 0.00 H ATOM 48442 H14S PA 1189 62.106 107.225 36.854 1.00 0.00 H ATOM 48443 C113 PA 1189 60.831 105.413 37.124 1.00 0.00 C ATOM 48444 H13R PA 1189 60.826 105.394 36.032 1.00 0.00 H ATOM 48445 H13S PA 1189 59.922 105.897 37.487 1.00 0.00 H ATOM 48446 C112 PA 1189 60.919 103.999 37.708 1.00 0.00 C ATOM 48447 H12R PA 1189 60.703 104.085 38.775 1.00 0.00 H ATOM 48448 H12S PA 1189 61.876 103.506 37.526 1.00 0.00 H ATOM 48449 C111 PA 1189 59.899 103.014 37.119 1.00 0.00 C ATOM 48450 H11R PA 1189 59.004 103.490 36.713 1.00 0.00 H ATOM 48451 H11S PA 1189 59.511 102.394 37.930 1.00 0.00 H ATOM 48452 C110 PA 1189 60.288 102.191 35.856 1.00 0.00 C ATOM 48453 H10R PA 1189 61.317 101.824 35.855 1.00 0.00 H ATOM 48454 H10S PA 1189 60.372 102.863 34.999 1.00 0.00 H ATOM 48455 C19 PA 1189 59.436 100.920 35.674 1.00 0.00 C ATOM 48456 H9R PA 1189 58.376 101.181 35.704 1.00 0.00 H ATOM 48457 H9S PA 1189 59.663 100.269 36.520 1.00 0.00 H ATOM 48458 C18 PA 1189 59.694 100.163 34.373 1.00 0.00 C ATOM 48459 H8R PA 1189 60.716 99.781 34.395 1.00 0.00 H ATOM 48460 H8S PA 1189 59.615 100.952 33.622 1.00 0.00 H ATOM 48461 C17 PA 1189 58.585 99.130 34.224 1.00 0.00 C ATOM 48462 H7R PA 1189 57.699 99.747 34.058 1.00 0.00 H ATOM 48463 H7S PA 1189 58.603 98.600 35.179 1.00 0.00 H ATOM 48464 C16 PA 1189 58.932 98.094 33.119 1.00 0.00 C ATOM 48465 H6R PA 1189 57.982 97.675 32.781 1.00 0.00 H ATOM 48466 H6S PA 1189 59.471 97.213 33.472 1.00 0.00 H ATOM 48467 C15 PA 1189 59.512 98.646 31.835 1.00 0.00 C ATOM 48468 H5R PA 1189 60.535 98.988 32.003 1.00 0.00 H ATOM 48469 H5S PA 1189 58.909 99.472 31.452 1.00 0.00 H ATOM 48470 C14 PA 1189 59.407 97.591 30.715 1.00 0.00 C ATOM 48471 H4R PA 1189 58.353 97.350 30.559 1.00 0.00 H ATOM 48472 H4S PA 1189 59.779 96.610 31.020 1.00 0.00 H ATOM 48473 C13 PA 1189 60.025 98.012 29.348 1.00 0.00 C ATOM 48474 H3R PA 1189 61.111 98.065 29.452 1.00 0.00 H ATOM 48475 H3S PA 1189 59.737 99.038 29.110 1.00 0.00 H ATOM 48476 C12 PA 1189 59.733 97.164 28.170 1.00 0.00 C ATOM 48477 H2R PA 1189 58.711 97.337 27.829 1.00 0.00 H ATOM 48478 H2S PA 1189 59.730 96.098 28.409 1.00 0.00 H ATOM 48479 C11 PC 1190 60.768 97.341 27.068 1.00 0.00 C ATOM 48480 O12 PC 1190 60.942 96.406 26.321 1.00 0.00 O ATOM 48481 O11 PC 1190 61.396 98.528 27.044 1.00 0.00 O ATOM 48482 C1 PC 1190 62.462 98.695 26.085 1.00 0.00 C ATOM 48483 HR PC 1190 62.152 98.968 25.073 1.00 0.00 H ATOM 48484 HS PC 1190 62.936 97.727 25.908 1.00 0.00 H ATOM 48485 C2 PC 1190 63.415 99.708 26.751 1.00 0.00 C ATOM 48486 HX PC 1190 62.806 100.492 27.210 1.00 0.00 H ATOM 48487 C3 PC 1190 64.307 100.461 25.765 1.00 0.00 C ATOM 48488 HA PC 1190 65.220 100.933 26.138 1.00 0.00 H ATOM 48489 HB PC 1190 63.647 101.142 25.221 1.00 0.00 H ATOM 48490 O31 PC 1190 64.871 99.524 24.869 1.00 0.00 O ATOM 48491 P31 PC 1190 65.798 100.065 23.673 1.00 0.00 P ATOM 48492 O32 PC 1190 66.729 98.875 23.425 1.00 0.00 O ATOM 48493 C31 PC 1190 67.906 98.677 24.051 1.00 0.00 C ATOM 48494 H1A PC 1190 67.915 98.970 25.103 1.00 0.00 H ATOM 48495 H1B PC 1190 68.686 99.340 23.668 1.00 0.00 H ATOM 48496 C32 PC 1190 68.172 97.148 24.146 1.00 0.00 C ATOM 48497 H2A PC 1190 69.088 97.009 24.722 1.00 0.00 H ATOM 48498 H2B PC 1190 68.456 96.787 23.156 1.00 0.00 H ATOM 48499 N31 PC 1190 67.039 96.230 24.746 1.00 0.00 N ATOM 48500 C33 PC 1190 66.479 96.862 26.025 1.00 0.00 C ATOM 48501 H3A PC 1190 65.966 97.786 25.753 1.00 0.00 H ATOM 48502 H3B PC 1190 67.261 97.168 26.721 1.00 0.00 H ATOM 48503 H3C PC 1190 65.762 96.153 26.443 1.00 0.00 H ATOM 48504 C34 PC 1190 65.945 96.181 23.723 1.00 0.00 C ATOM 48505 H4A PC 1190 66.332 96.099 22.706 1.00 0.00 H ATOM 48506 H4B PC 1190 65.351 97.096 23.722 1.00 0.00 H ATOM 48507 H4C PC 1190 65.313 95.340 24.014 1.00 0.00 H ATOM 48508 C35 PC 1190 67.564 94.866 24.975 1.00 0.00 C ATOM 48509 H5A PC 1190 66.832 94.178 25.399 1.00 0.00 H ATOM 48510 H5B PC 1190 68.475 94.873 25.576 1.00 0.00 H ATOM 48511 H5C PC 1190 67.769 94.451 23.987 1.00 0.00 H ATOM 48512 O33 PC 1190 64.967 100.161 22.455 1.00 0.00 O ATOM 48513 O34 PC 1190 66.588 101.277 24.166 1.00 0.00 O ATOM 48514 O21 PC 1190 64.275 98.986 27.639 1.00 0.00 O ATOM 48515 C21 PC 1190 64.927 99.721 28.517 1.00 0.00 C ATOM 48516 O22 PC 1190 64.849 100.961 28.584 1.00 0.00 O ATOM 48517 C12 OL 1191 65.893 98.906 29.402 1.00 0.00 C ATOM 48518 H2R OL 1191 66.629 98.336 28.832 1.00 0.00 H ATOM 48519 H2S OL 1191 66.537 99.557 29.996 1.00 0.00 H ATOM 48520 C13 OL 1191 65.193 97.879 30.282 1.00 0.00 C ATOM 48521 H3R OL 1191 65.749 97.382 31.080 1.00 0.00 H ATOM 48522 H3S OL 1191 64.426 98.483 30.770 1.00 0.00 H ATOM 48523 C14 OL 1191 64.369 96.853 29.500 1.00 0.00 C ATOM 48524 H4R OL 1191 63.424 97.244 29.118 1.00 0.00 H ATOM 48525 H4S OL 1191 65.007 96.568 28.661 1.00 0.00 H ATOM 48526 C15 OL 1191 63.879 95.621 30.330 1.00 0.00 C ATOM 48527 H5R OL 1191 64.790 95.020 30.384 1.00 0.00 H ATOM 48528 H5S OL 1191 63.559 95.797 31.359 1.00 0.00 H ATOM 48529 C16 OL 1191 62.802 94.799 29.576 1.00 0.00 C ATOM 48530 H6R OL 1191 61.890 95.391 29.475 1.00 0.00 H ATOM 48531 H6S OL 1191 63.229 94.553 28.602 1.00 0.00 H ATOM 48532 C17 OL 1191 62.442 93.498 30.164 1.00 0.00 C ATOM 48533 H7R OL 1191 62.083 92.785 29.419 1.00 0.00 H ATOM 48534 H7S OL 1191 63.314 92.976 30.565 1.00 0.00 H ATOM 48535 C18 OL 1191 61.582 93.598 31.478 1.00 0.00 C ATOM 48536 H8R OL 1191 61.592 92.652 32.023 1.00 0.00 H ATOM 48537 H8S OL 1191 61.996 94.285 32.219 1.00 0.00 H ATOM 48538 C19 OL 1191 60.163 93.981 31.090 1.00 0.00 C ATOM 48539 H9R OL 1191 60.024 94.776 30.362 1.00 0.00 H ATOM 48540 C110 OL 1191 59.020 93.501 31.573 1.00 0.00 C ATOM 48541 H10R OL 1191 58.043 93.899 31.314 1.00 0.00 H ATOM 48542 C111 OL 1191 58.977 92.460 32.671 1.00 0.00 C ATOM 48543 H11R OL 1191 59.872 92.535 33.292 1.00 0.00 H ATOM 48544 H11S OL 1191 58.217 92.740 33.403 1.00 0.00 H ATOM 48545 C112 OL 1191 58.727 91.025 32.146 1.00 0.00 C ATOM 48546 H12R OL 1191 57.966 90.871 31.378 1.00 0.00 H ATOM 48547 H12S OL 1191 59.598 90.667 31.594 1.00 0.00 H ATOM 48548 C113 OL 1191 58.218 90.088 33.163 1.00 0.00 C ATOM 48549 H13R OL 1191 57.232 90.294 33.585 1.00 0.00 H ATOM 48550 H13S OL 1191 58.176 89.172 32.570 1.00 0.00 H ATOM 48551 C114 OL 1191 59.146 89.936 34.366 1.00 0.00 C ATOM 48552 H14R OL 1191 60.191 89.774 34.091 1.00 0.00 H ATOM 48553 H14S OL 1191 59.096 90.870 34.930 1.00 0.00 H ATOM 48554 C115 OL 1191 58.824 88.722 35.303 1.00 0.00 C ATOM 48555 H15R OL 1191 57.881 88.806 35.848 1.00 0.00 H ATOM 48556 H15S OL 1191 58.708 87.898 34.596 1.00 0.00 H ATOM 48557 C116 OL 1191 59.907 88.377 36.355 1.00 0.00 C ATOM 48558 H16R OL 1191 60.856 88.095 35.893 1.00 0.00 H ATOM 48559 H16S OL 1191 60.157 89.209 37.017 1.00 0.00 H ATOM 48560 C117 OL 1191 59.497 87.105 37.143 1.00 0.00 C ATOM 48561 H17R OL 1191 58.551 87.374 37.617 1.00 0.00 H ATOM 48562 H17S OL 1191 59.402 86.202 36.537 1.00 0.00 H ATOM 48563 C118 OL 1191 60.423 86.564 38.158 1.00 0.00 C ATOM 48564 H18R OL 1191 59.973 85.834 38.834 1.00 0.00 H ATOM 48565 H18S OL 1191 60.782 87.468 38.655 1.00 0.00 H ATOM 48566 H18T OL 1191 61.277 86.135 37.631 1.00 0.00 H TER 48567 OL 1191 ATOM 48567 C116 PA 1192 110.935 91.291 40.303 1.00 0.00 C ATOM 48568 H16R PA 1192 109.887 91.493 40.536 1.00 0.00 H ATOM 48569 H16S PA 1192 111.394 92.259 40.517 1.00 0.00 H ATOM 48570 H16T PA 1192 111.216 90.555 41.059 1.00 0.00 H ATOM 48571 C115 PA 1192 110.918 90.796 38.875 1.00 0.00 C ATOM 48572 H15R PA 1192 110.221 89.960 38.781 1.00 0.00 H ATOM 48573 H15S PA 1192 111.940 90.472 38.670 1.00 0.00 H ATOM 48574 C114 PA 1192 110.489 91.890 37.853 1.00 0.00 C ATOM 48575 H14R PA 1192 110.955 92.860 38.036 1.00 0.00 H ATOM 48576 H14S PA 1192 109.414 92.074 37.914 1.00 0.00 H ATOM 48577 C113 PA 1192 110.649 91.576 36.399 1.00 0.00 C ATOM 48578 H13R PA 1192 110.115 90.652 36.168 1.00 0.00 H ATOM 48579 H13S PA 1192 111.677 91.318 36.137 1.00 0.00 H ATOM 48580 C112 PA 1192 110.073 92.627 35.554 1.00 0.00 C ATOM 48581 H12R PA 1192 110.590 93.560 35.791 1.00 0.00 H ATOM 48582 H12S PA 1192 109.031 92.883 35.756 1.00 0.00 H ATOM 48583 C111 PA 1192 110.128 92.306 34.077 1.00 0.00 C ATOM 48584 H11R PA 1192 109.868 93.204 33.512 1.00 0.00 H ATOM 48585 H11S PA 1192 109.457 91.494 33.788 1.00 0.00 H ATOM 48586 C110 PA 1192 111.466 91.894 33.485 1.00 0.00 C ATOM 48587 H10R PA 1192 111.706 90.866 33.762 1.00 0.00 H ATOM 48588 H10S PA 1192 112.277 92.438 33.973 1.00 0.00 H ATOM 48589 C19 PA 1192 111.527 91.836 32.004 1.00 0.00 C ATOM 48590 H9R PA 1192 111.652 92.869 31.673 1.00 0.00 H ATOM 48591 H9S PA 1192 110.633 91.540 31.453 1.00 0.00 H ATOM 48592 C18 PA 1192 112.631 91.047 31.376 1.00 0.00 C ATOM 48593 H8R PA 1192 112.579 91.054 30.286 1.00 0.00 H ATOM 48594 H8S PA 1192 112.590 89.986 31.629 1.00 0.00 H ATOM 48595 C17 PA 1192 113.971 91.439 31.816 1.00 0.00 C ATOM 48596 H7R PA 1192 114.088 91.353 32.898 1.00 0.00 H ATOM 48597 H7S PA 1192 114.184 92.473 31.535 1.00 0.00 H ATOM 48598 C16 PA 1192 115.054 90.658 31.071 1.00 0.00 C ATOM 48599 H6R PA 1192 114.948 90.874 30.006 1.00 0.00 H ATOM 48600 H6S PA 1192 114.843 89.596 31.213 1.00 0.00 H ATOM 48601 C15 PA 1192 116.551 90.985 31.392 1.00 0.00 C ATOM 48602 H5R PA 1192 116.674 90.851 32.468 1.00 0.00 H ATOM 48603 H5S PA 1192 116.856 92.020 31.225 1.00 0.00 H ATOM 48604 C14 PA 1192 117.631 90.100 30.762 1.00 0.00 C ATOM 48605 H4R PA 1192 117.420 89.076 31.078 1.00 0.00 H ATOM 48606 H4S PA 1192 118.590 90.397 31.191 1.00 0.00 H ATOM 48607 C13 PA 1192 117.626 90.240 29.256 1.00 0.00 C ATOM 48608 H3R PA 1192 118.075 91.180 28.931 1.00 0.00 H ATOM 48609 H3S PA 1192 116.636 90.116 28.810 1.00 0.00 H ATOM 48610 C12 PA 1192 118.477 89.152 28.551 1.00 0.00 C ATOM 48611 H2R PA 1192 117.937 88.203 28.597 1.00 0.00 H ATOM 48612 H2S PA 1192 119.406 89.009 29.106 1.00 0.00 H ATOM 48613 C11 PGR 1193 118.697 89.399 27.101 1.00 0.00 C ATOM 48614 O12 PGR 1193 119.809 89.710 26.616 1.00 0.00 O ATOM 48615 O11 PGR 1193 117.573 89.436 26.387 1.00 0.00 O ATOM 48616 C1 PGR 1193 117.629 90.109 25.064 1.00 0.00 C ATOM 48617 HR PGR 1193 116.911 89.688 24.355 1.00 0.00 H ATOM 48618 HS PGR 1193 118.599 89.923 24.595 1.00 0.00 H ATOM 48619 C2 PGR 1193 117.513 91.679 25.127 1.00 0.00 C ATOM 48620 HX PGR 1193 116.705 91.999 25.791 1.00 0.00 H ATOM 48621 C3 PGR 1193 117.196 92.203 23.747 1.00 0.00 C ATOM 48622 HA PGR 1193 116.508 93.051 23.765 1.00 0.00 H ATOM 48623 HB PGR 1193 116.688 91.415 23.184 1.00 0.00 H ATOM 48624 O31 PGR 1193 118.441 92.477 23.082 1.00 0.00 O ATOM 48625 P31 PGR 1193 118.518 92.989 21.641 1.00 0.00 P ATOM 48626 O32 PGR 1193 117.792 94.392 21.722 1.00 0.00 O ATOM 48627 C31 PGR 1193 118.427 95.411 22.341 1.00 0.00 C ATOM 48628 H1A PGR 1193 119.509 95.369 22.195 1.00 0.00 H ATOM 48629 H1B PGR 1193 118.213 95.265 23.403 1.00 0.00 H ATOM 48630 C32 PGR 1193 117.814 96.778 22.089 1.00 0.00 C ATOM 48631 H2A PGR 1193 118.284 97.405 22.851 1.00 0.00 H ATOM 48632 O35 PGR 1193 116.467 96.644 22.300 1.00 0.00 O ATOM 48633 HO5A PGR 1193 116.384 96.357 23.227 1.00 0.00 H ATOM 48634 C33 PGR 1193 118.196 97.234 20.696 1.00 0.00 C ATOM 48635 H3A PGR 1193 118.319 98.320 20.735 1.00 0.00 H ATOM 48636 H3B PGR 1193 119.149 96.800 20.382 1.00 0.00 H ATOM 48637 O33 PGR 1193 119.963 93.193 21.355 1.00 0.00 O ATOM 48638 O34 PGR 1193 117.752 92.081 20.683 1.00 0.00 O ATOM 48639 O21 PGR 1193 118.808 92.199 25.611 1.00 0.00 O ATOM 48640 C21 PGR 1193 118.967 93.471 25.825 1.00 0.00 C ATOM 48641 O22 PGR 1193 118.060 94.262 25.813 1.00 0.00 O ATOM 48642 O36 PGR 1193 117.224 96.909 19.662 1.00 0.00 O ATOM 48643 HO6A PGR 1193 116.892 96.019 19.874 1.00 0.00 H ATOM 48644 C12 OL 1194 120.407 94.012 25.913 1.00 0.00 C ATOM 48645 H2R OL 1194 120.761 94.185 24.895 1.00 0.00 H ATOM 48646 H2S OL 1194 120.555 94.874 26.566 1.00 0.00 H ATOM 48647 C13 OL 1194 121.386 92.963 26.477 1.00 0.00 C ATOM 48648 H3R OL 1194 121.393 92.116 25.788 1.00 0.00 H ATOM 48649 H3S OL 1194 122.380 93.379 26.300 1.00 0.00 H ATOM 48650 C14 OL 1194 121.191 92.554 27.945 1.00 0.00 C ATOM 48651 H4R OL 1194 120.364 91.841 27.965 1.00 0.00 H ATOM 48652 H4S OL 1194 122.001 91.900 28.275 1.00 0.00 H ATOM 48653 C15 OL 1194 121.054 93.637 28.936 1.00 0.00 C ATOM 48654 H5R OL 1194 121.904 94.316 29.034 1.00 0.00 H ATOM 48655 H5S OL 1194 120.222 94.260 28.601 1.00 0.00 H ATOM 48656 C16 OL 1194 120.718 93.027 30.289 1.00 0.00 C ATOM 48657 H6R OL 1194 119.971 92.234 30.218 1.00 0.00 H ATOM 48658 H6S OL 1194 121.633 92.559 30.658 1.00 0.00 H ATOM 48659 C17 OL 1194 120.237 94.039 31.202 1.00 0.00 C ATOM 48660 H7R OL 1194 121.157 94.507 31.557 1.00 0.00 H ATOM 48661 H7S OL 1194 119.697 94.800 30.635 1.00 0.00 H ATOM 48662 C18 OL 1194 119.467 93.384 32.356 1.00 0.00 C ATOM 48663 H8R OL 1194 118.480 93.057 32.023 1.00 0.00 H ATOM 48664 H8S OL 1194 119.970 92.469 32.676 1.00 0.00 H ATOM 48665 C19 OL 1194 119.295 94.465 33.447 1.00 0.00 C ATOM 48666 H9R OL 1194 120.063 95.222 33.586 1.00 0.00 H ATOM 48667 C110 OL 1194 118.098 94.657 34.130 1.00 0.00 C ATOM 48668 H10R OL 1194 118.209 95.423 34.893 1.00 0.00 H ATOM 48669 C111 OL 1194 116.779 93.915 34.075 1.00 0.00 C ATOM 48670 H11R OL 1194 116.733 93.327 33.156 1.00 0.00 H ATOM 48671 H11S OL 1194 116.803 93.225 34.922 1.00 0.00 H ATOM 48672 C112 OL 1194 115.679 94.932 34.152 1.00 0.00 C ATOM 48673 H12R OL 1194 115.896 95.551 35.025 1.00 0.00 H ATOM 48674 H12S OL 1194 115.784 95.534 33.247 1.00 0.00 H ATOM 48675 C113 OL 1194 114.268 94.327 34.156 1.00 0.00 C ATOM 48676 H13R OL 1194 114.204 93.667 33.288 1.00 0.00 H ATOM 48677 H13S OL 1194 114.133 93.702 35.041 1.00 0.00 H ATOM 48678 C114 OL 1194 113.116 95.275 34.107 1.00 0.00 C ATOM 48679 H14R OL 1194 112.930 95.744 33.139 1.00 0.00 H ATOM 48680 H14S OL 1194 112.222 94.649 34.061 1.00 0.00 H ATOM 48681 C115 OL 1194 113.032 96.185 35.303 1.00 0.00 C ATOM 48682 H15R OL 1194 112.687 95.531 36.107 1.00 0.00 H ATOM 48683 H15S OL 1194 113.952 96.620 35.698 1.00 0.00 H ATOM 48684 C116 OL 1194 112.079 97.403 35.095 1.00 0.00 C ATOM 48685 H16R OL 1194 111.255 97.146 34.426 1.00 0.00 H ATOM 48686 H16S OL 1194 111.830 97.672 36.123 1.00 0.00 H ATOM 48687 C117 OL 1194 112.736 98.540 34.235 1.00 0.00 C ATOM 48688 H17R OL 1194 112.073 99.383 34.436 1.00 0.00 H ATOM 48689 H17S OL 1194 113.669 98.894 34.679 1.00 0.00 H ATOM 48690 C118 OL 1194 113.044 98.250 32.739 1.00 0.00 C ATOM 48691 H18R OL 1194 113.178 99.214 32.244 1.00 0.00 H ATOM 48692 H18S OL 1194 112.298 97.702 32.158 1.00 0.00 H ATOM 48693 H18T OL 1194 113.981 97.741 32.504 1.00 0.00 H TER 48694 OL 1194 ATOM 48694 C116 PA 1195 114.594 26.106 39.096 1.00 0.00 C ATOM 48695 H16R PA 1195 114.909 25.264 39.716 1.00 0.00 H ATOM 48696 H16S PA 1195 113.795 25.684 38.483 1.00 0.00 H ATOM 48697 H16T PA 1195 114.092 26.957 39.561 1.00 0.00 H ATOM 48698 C115 PA 1195 115.736 26.524 38.244 1.00 0.00 C ATOM 48699 H15R PA 1195 115.975 25.765 37.496 1.00 0.00 H ATOM 48700 H15S PA 1195 116.668 26.615 38.805 1.00 0.00 H ATOM 48701 C114 PA 1195 115.409 27.706 37.356 1.00 0.00 C ATOM 48702 H14R PA 1195 115.298 28.498 38.100 1.00 0.00 H ATOM 48703 H14S PA 1195 114.417 27.629 36.905 1.00 0.00 H ATOM 48704 C113 PA 1195 116.551 28.124 36.359 1.00 0.00 C ATOM 48705 H13R PA 1195 116.605 27.489 35.472 1.00 0.00 H ATOM 48706 H13S PA 1195 117.522 28.156 36.858 1.00 0.00 H ATOM 48707 C112 PA 1195 116.456 29.554 35.849 1.00 0.00 C ATOM 48708 H12R PA 1195 116.353 30.224 36.705 1.00 0.00 H ATOM 48709 H12S PA 1195 115.577 29.748 35.230 1.00 0.00 H ATOM 48710 C111 PA 1195 117.726 30.031 35.064 1.00 0.00 C ATOM 48711 H11R PA 1195 117.855 29.402 34.180 1.00 0.00 H ATOM 48712 H11S PA 1195 118.561 29.770 35.717 1.00 0.00 H ATOM 48713 C110 PA 1195 117.648 31.519 34.725 1.00 0.00 C ATOM 48714 H10R PA 1195 118.647 31.771 34.365 1.00 0.00 H ATOM 48715 H10S PA 1195 117.489 32.220 35.548 1.00 0.00 H ATOM 48716 C19 PA 1195 116.677 31.873 33.546 1.00 0.00 C ATOM 48717 H9R PA 1195 116.441 31.124 32.787 1.00 0.00 H ATOM 48718 H9S PA 1195 117.285 32.576 32.972 1.00 0.00 H ATOM 48719 C18 PA 1195 115.238 32.364 34.012 1.00 0.00 C ATOM 48720 H8R PA 1195 115.244 33.350 34.481 1.00 0.00 H ATOM 48721 H8S PA 1195 114.726 31.811 34.803 1.00 0.00 H ATOM 48722 C17 PA 1195 114.246 32.433 32.813 1.00 0.00 C ATOM 48723 H7R PA 1195 114.222 31.424 32.398 1.00 0.00 H ATOM 48724 H7S PA 1195 114.680 33.002 31.988 1.00 0.00 H ATOM 48725 C16 PA 1195 112.880 32.869 33.159 1.00 0.00 C ATOM 48726 H6R PA 1195 112.994 33.891 33.526 1.00 0.00 H ATOM 48727 H6S PA 1195 112.352 32.253 33.891 1.00 0.00 H ATOM 48728 C15 PA 1195 111.979 32.979 31.909 1.00 0.00 C ATOM 48729 H5R PA 1195 111.697 32.049 31.411 1.00 0.00 H ATOM 48730 H5S PA 1195 112.481 33.556 31.130 1.00 0.00 H ATOM 48731 C14 PA 1195 110.698 33.685 32.192 1.00 0.00 C ATOM 48732 H4R PA 1195 110.879 34.710 32.521 1.00 0.00 H ATOM 48733 H4S PA 1195 110.254 33.145 33.030 1.00 0.00 H ATOM 48734 C13 PA 1195 109.621 33.777 31.105 1.00 0.00 C ATOM 48735 H3R PA 1195 109.886 34.373 30.230 1.00 0.00 H ATOM 48736 H3S PA 1195 108.675 34.100 31.546 1.00 0.00 H ATOM 48737 C12 PA 1195 109.290 32.292 30.827 1.00 0.00 C ATOM 48738 H2R PA 1195 110.159 31.807 30.378 1.00 0.00 H ATOM 48739 H2S PA 1195 109.100 31.706 31.729 1.00 0.00 H ATOM 48740 C11 PGR 1196 108.221 32.219 29.820 1.00 0.00 C ATOM 48741 O12 PGR 1196 107.330 33.038 29.586 1.00 0.00 O ATOM 48742 O11 PGR 1196 108.277 31.002 29.280 1.00 0.00 O ATOM 48743 C1 PGR 1196 107.186 30.513 28.421 1.00 0.00 C ATOM 48744 HR PGR 1196 106.963 31.307 27.704 1.00 0.00 H ATOM 48745 HS PGR 1196 106.278 30.255 28.972 1.00 0.00 H ATOM 48746 C2 PGR 1196 107.749 29.253 27.797 1.00 0.00 C ATOM 48747 HX PGR 1196 108.759 29.414 27.411 1.00 0.00 H ATOM 48748 C3 PGR 1196 106.778 28.874 26.685 1.00 0.00 C ATOM 48749 HA PGR 1196 106.620 29.783 26.100 1.00 0.00 H ATOM 48750 HB PGR 1196 105.808 28.650 27.138 1.00 0.00 H ATOM 48751 O31 PGR 1196 107.198 27.688 25.947 1.00 0.00 O ATOM 48752 P31 PGR 1196 106.248 27.030 24.798 1.00 0.00 P ATOM 48753 O32 PGR 1196 104.794 26.919 25.542 1.00 0.00 O ATOM 48754 C31 PGR 1196 103.944 28.049 25.661 1.00 0.00 C ATOM 48755 H1A PGR 1196 104.508 28.968 25.485 1.00 0.00 H ATOM 48756 H1B PGR 1196 103.548 28.103 26.679 1.00 0.00 H ATOM 48757 C32 PGR 1196 102.856 27.968 24.581 1.00 0.00 C ATOM 48758 H2A PGR 1196 102.284 27.071 24.831 1.00 0.00 H ATOM 48759 O35 PGR 1196 103.437 28.107 23.259 1.00 0.00 O ATOM 48760 HO5A PGR 1196 104.394 28.147 23.438 1.00 0.00 H ATOM 48761 C33 PGR 1196 101.749 29.095 24.781 1.00 0.00 C ATOM 48762 H3A PGR 1196 101.389 29.047 25.812 1.00 0.00 H ATOM 48763 H3B PGR 1196 102.070 30.108 24.526 1.00 0.00 H ATOM 48764 O33 PGR 1196 106.105 28.043 23.705 1.00 0.00 O ATOM 48765 O34 PGR 1196 106.716 25.677 24.439 1.00 0.00 O ATOM 48766 O21 PGR 1196 107.798 28.287 28.849 1.00 0.00 O ATOM 48767 C21 PGR 1196 108.645 27.300 28.831 1.00 0.00 C ATOM 48768 O22 PGR 1196 109.478 27.060 27.969 1.00 0.00 O ATOM 48769 O36 PGR 1196 100.665 28.713 23.918 1.00 0.00 O ATOM 48770 HO6A PGR 1196 99.855 29.090 24.307 1.00 0.00 H ATOM 48771 C12 OL 1197 108.650 26.597 30.171 1.00 0.00 C ATOM 48772 H2R OL 1197 107.714 26.134 30.489 1.00 0.00 H ATOM 48773 H2S OL 1197 109.188 25.661 30.008 1.00 0.00 H ATOM 48774 C13 OL 1197 109.214 27.487 31.273 1.00 0.00 C ATOM 48775 H3R OL 1197 108.678 28.426 31.427 1.00 0.00 H ATOM 48776 H3S OL 1197 109.134 26.930 32.208 1.00 0.00 H ATOM 48777 C14 OL 1197 110.695 28.004 31.211 1.00 0.00 C ATOM 48778 H4R OL 1197 111.151 27.014 31.131 1.00 0.00 H ATOM 48779 H4S OL 1197 110.810 28.604 30.306 1.00 0.00 H ATOM 48780 C15 OL 1197 111.110 28.816 32.414 1.00 0.00 C ATOM 48781 H5R OL 1197 110.525 29.712 32.631 1.00 0.00 H ATOM 48782 H5S OL 1197 110.998 28.220 33.322 1.00 0.00 H ATOM 48783 C16 OL 1197 112.562 29.351 32.382 1.00 0.00 C ATOM 48784 H6R OL 1197 112.756 29.948 31.488 1.00 0.00 H ATOM 48785 H6S OL 1197 112.816 30.063 33.171 1.00 0.00 H ATOM 48786 C17 OL 1197 113.596 28.214 32.359 1.00 0.00 C ATOM 48787 H7R OL 1197 113.426 27.723 33.319 1.00 0.00 H ATOM 48788 H7S OL 1197 113.299 27.395 31.700 1.00 0.00 H ATOM 48789 C18 OL 1197 115.119 28.672 32.179 1.00 0.00 C ATOM 48790 H8R OL 1197 115.370 29.362 32.987 1.00 0.00 H ATOM 48791 H8S OL 1197 115.893 27.910 32.294 1.00 0.00 H ATOM 48792 C19 OL 1197 115.310 29.316 30.827 1.00 0.00 C ATOM 48793 H9R OL 1197 114.457 29.720 30.288 1.00 0.00 H ATOM 48794 C110 OL 1197 116.447 29.182 30.167 1.00 0.00 C ATOM 48795 H10R OL 1197 116.501 29.659 29.192 1.00 0.00 H ATOM 48796 C111 OL 1197 117.767 28.727 30.689 1.00 0.00 C ATOM 48797 H11R OL 1197 117.791 28.770 31.780 1.00 0.00 H ATOM 48798 H11S OL 1197 118.089 27.758 30.301 1.00 0.00 H ATOM 48799 C112 OL 1197 118.904 29.702 30.310 1.00 0.00 C ATOM 48800 H12R OL 1197 118.829 29.830 29.228 1.00 0.00 H ATOM 48801 H12S OL 1197 118.549 30.667 30.676 1.00 0.00 H ATOM 48802 C113 OL 1197 120.297 29.479 30.833 1.00 0.00 C ATOM 48803 H13R OL 1197 120.330 29.539 31.922 1.00 0.00 H ATOM 48804 H13S OL 1197 120.729 28.528 30.512 1.00 0.00 H ATOM 48805 C114 OL 1197 121.248 30.478 30.204 1.00 0.00 C ATOM 48806 H14R OL 1197 121.109 30.514 29.121 1.00 0.00 H ATOM 48807 H14S OL 1197 121.014 31.479 30.573 1.00 0.00 H ATOM 48808 C115 OL 1197 122.781 30.263 30.518 1.00 0.00 C ATOM 48809 H15R OL 1197 123.167 29.394 29.981 1.00 0.00 H ATOM 48810 H15S OL 1197 123.298 31.149 30.145 1.00 0.00 H ATOM 48811 C116 OL 1197 122.990 30.161 32.041 1.00 0.00 C ATOM 48812 H16R OL 1197 122.419 30.963 32.512 1.00 0.00 H ATOM 48813 H16S OL 1197 122.564 29.210 32.367 1.00 0.00 H ATOM 48814 C117 OL 1197 124.433 30.058 32.518 1.00 0.00 C ATOM 48815 H17R OL 1197 124.470 29.502 33.457 1.00 0.00 H ATOM 48816 H17S OL 1197 124.940 29.357 31.852 1.00 0.00 H ATOM 48817 C118 OL 1197 125.263 31.341 32.381 1.00 0.00 C ATOM 48818 H18R OL 1197 125.280 31.637 31.330 1.00 0.00 H ATOM 48819 H18S OL 1197 126.306 31.186 32.662 1.00 0.00 H ATOM 48820 H18T OL 1197 124.875 32.137 33.020 1.00 0.00 H TER 48821 OL 1197 ATOM 48821 C116 PA 1198 110.811 26.845 38.612 1.00 0.00 C ATOM 48822 H16R PA 1198 110.783 27.926 38.761 1.00 0.00 H ATOM 48823 H16S PA 1198 111.798 26.525 38.951 1.00 0.00 H ATOM 48824 H16T PA 1198 110.041 26.480 39.296 1.00 0.00 H ATOM 48825 C115 PA 1198 110.577 26.389 37.162 1.00 0.00 C ATOM 48826 H15R PA 1198 109.557 26.572 36.817 1.00 0.00 H ATOM 48827 H15S PA 1198 110.731 25.314 37.050 1.00 0.00 H ATOM 48828 C114 PA 1198 111.452 27.098 36.037 1.00 0.00 C ATOM 48829 H14R PA 1198 111.131 26.791 35.039 1.00 0.00 H ATOM 48830 H14S PA 1198 112.460 26.679 36.003 1.00 0.00 H ATOM 48831 C113 PA 1198 111.537 28.642 36.117 1.00 0.00 C ATOM 48832 H13R PA 1198 112.130 28.901 35.238 1.00 0.00 H ATOM 48833 H13S PA 1198 112.332 28.975 36.788 1.00 0.00 H ATOM 48834 C112 PA 1198 110.160 29.218 36.124 1.00 0.00 C ATOM 48835 H12R PA 1198 109.781 28.847 37.079 1.00 0.00 H ATOM 48836 H12S PA 1198 109.565 28.857 35.282 1.00 0.00 H ATOM 48837 C111 PA 1198 110.370 30.784 36.159 1.00 0.00 C ATOM 48838 H11R PA 1198 110.845 31.085 35.223 1.00 0.00 H ATOM 48839 H11S PA 1198 110.939 31.236 36.974 1.00 0.00 H ATOM 48840 C110 PA 1198 108.978 31.431 36.240 1.00 0.00 C ATOM 48841 H10R PA 1198 109.053 32.449 36.628 1.00 0.00 H ATOM 48842 H10S PA 1198 108.498 30.773 36.968 1.00 0.00 H ATOM 48843 C19 PA 1198 108.292 31.427 34.882 1.00 0.00 C ATOM 48844 H9R PA 1198 108.576 30.583 34.251 1.00 0.00 H ATOM 48845 H9S PA 1198 108.666 32.165 34.170 1.00 0.00 H ATOM 48846 C18 PA 1198 106.748 31.470 34.978 1.00 0.00 C ATOM 48847 H8R PA 1198 106.498 32.367 35.547 1.00 0.00 H ATOM 48848 H8S PA 1198 106.208 30.723 35.564 1.00 0.00 H ATOM 48849 C17 PA 1198 105.979 31.508 33.646 1.00 0.00 C ATOM 48850 H7R PA 1198 106.277 30.707 32.966 1.00 0.00 H ATOM 48851 H7S PA 1198 106.290 32.438 33.164 1.00 0.00 H ATOM 48852 C16 PA 1198 104.469 31.500 33.812 1.00 0.00 C ATOM 48853 H6R PA 1198 104.097 32.444 34.216 1.00 0.00 H ATOM 48854 H6S PA 1198 104.130 30.647 34.404 1.00 0.00 H ATOM 48855 C15 PA 1198 103.800 31.300 32.424 1.00 0.00 C ATOM 48856 H5R PA 1198 103.796 30.245 32.140 1.00 0.00 H ATOM 48857 H5S PA 1198 104.402 31.720 31.615 1.00 0.00 H ATOM 48858 C14 PA 1198 102.401 31.871 32.353 1.00 0.00 C ATOM 48859 H4R PA 1198 102.361 32.818 32.894 1.00 0.00 H ATOM 48860 H4S PA 1198 101.554 31.392 32.849 1.00 0.00 H ATOM 48861 C13 PA 1198 101.899 31.955 30.948 1.00 0.00 C ATOM 48862 H3R PA 1198 102.685 32.168 30.221 1.00 0.00 H ATOM 48863 H3S PA 1198 101.221 32.810 30.907 1.00 0.00 H ATOM 48864 C12 PA 1198 101.137 30.790 30.394 1.00 0.00 C ATOM 48865 H2R PA 1198 100.450 30.449 31.171 1.00 0.00 H ATOM 48866 H2S PA 1198 101.722 29.909 30.120 1.00 0.00 H ATOM 48867 C11 PGR 1199 100.467 31.180 29.101 1.00 0.00 C ATOM 48868 O12 PGR 1199 101.128 31.582 28.114 1.00 0.00 O ATOM 48869 O11 PGR 1199 99.184 30.975 29.111 1.00 0.00 O ATOM 48870 C1 PGR 1199 98.418 31.408 27.894 1.00 0.00 C ATOM 48871 HR PGR 1199 98.678 32.402 27.522 1.00 0.00 H ATOM 48872 HS PGR 1199 97.355 31.446 28.147 1.00 0.00 H ATOM 48873 C2 PGR 1199 98.623 30.423 26.745 1.00 0.00 C ATOM 48874 HX PGR 1199 99.673 30.412 26.443 1.00 0.00 H ATOM 48875 C3 PGR 1199 98.040 30.918 25.414 1.00 0.00 C ATOM 48876 HA PGR 1199 98.448 31.928 25.320 1.00 0.00 H ATOM 48877 HB PGR 1199 96.947 30.903 25.415 1.00 0.00 H ATOM 48878 O31 PGR 1199 98.537 30.315 24.255 1.00 0.00 O ATOM 48879 P31 PGR 1199 97.973 30.844 22.846 1.00 0.00 P ATOM 48880 O32 PGR 1199 96.724 29.850 22.612 1.00 0.00 O ATOM 48881 C31 PGR 1199 95.364 30.059 23.042 1.00 0.00 C ATOM 48882 H1A PGR 1199 95.150 30.992 22.515 1.00 0.00 H ATOM 48883 H1B PGR 1199 95.301 30.220 24.122 1.00 0.00 H ATOM 48884 C32 PGR 1199 94.423 28.919 22.664 1.00 0.00 C ATOM 48885 H2A PGR 1199 94.913 28.122 23.229 1.00 0.00 H ATOM 48886 O35 PGR 1199 94.550 28.483 21.242 1.00 0.00 O ATOM 48887 HO5A PGR 1199 95.429 28.773 20.936 1.00 0.00 H ATOM 48888 C33 PGR 1199 93.010 29.055 23.147 1.00 0.00 C ATOM 48889 H3A PGR 1199 92.514 28.160 22.762 1.00 0.00 H ATOM 48890 H3B PGR 1199 92.951 28.914 24.229 1.00 0.00 H ATOM 48891 O33 PGR 1199 97.502 32.267 23.011 1.00 0.00 O ATOM 48892 O34 PGR 1199 98.903 30.493 21.812 1.00 0.00 O ATOM 48893 O21 PGR 1199 98.041 29.110 27.081 1.00 0.00 O ATOM 48894 C21 PGR 1199 96.734 29.058 27.389 1.00 0.00 C ATOM 48895 O22 PGR 1199 95.855 29.838 27.091 1.00 0.00 O ATOM 48896 O36 PGR 1199 92.545 30.359 22.686 1.00 0.00 O ATOM 48897 HO6A PGR 1199 91.605 30.379 22.940 1.00 0.00 H ATOM 48898 C12 OL 1200 96.433 27.862 28.313 1.00 0.00 C ATOM 48899 H2R OL 1200 95.377 28.028 28.537 1.00 0.00 H ATOM 48900 H2S OL 1200 96.747 26.922 27.855 1.00 0.00 H ATOM 48901 C13 OL 1200 97.207 27.956 29.531 1.00 0.00 C ATOM 48902 H3R OL 1200 98.273 28.000 29.296 1.00 0.00 H ATOM 48903 H3S OL 1200 96.902 28.864 30.057 1.00 0.00 H ATOM 48904 C14 OL 1200 97.017 26.633 30.292 1.00 0.00 C ATOM 48905 H4R OL 1200 95.959 26.743 30.541 1.00 0.00 H ATOM 48906 H4S OL 1200 97.160 25.754 29.661 1.00 0.00 H ATOM 48907 C15 OL 1200 97.903 26.462 31.494 1.00 0.00 C ATOM 48908 H5R OL 1200 98.247 27.456 31.787 1.00 0.00 H ATOM 48909 H5S OL 1200 97.316 26.074 32.330 1.00 0.00 H ATOM 48910 C16 OL 1200 99.078 25.490 31.289 1.00 0.00 C ATOM 48911 H6R OL 1200 98.888 24.779 30.482 1.00 0.00 H ATOM 48912 H6S OL 1200 99.920 26.077 30.918 1.00 0.00 H ATOM 48913 C17 OL 1200 99.459 24.732 32.532 1.00 0.00 C ATOM 48914 H7R OL 1200 98.546 24.359 33.001 1.00 0.00 H ATOM 48915 H7S OL 1200 100.068 23.875 32.236 1.00 0.00 H ATOM 48916 C18 OL 1200 100.106 25.537 33.740 1.00 0.00 C ATOM 48917 H8R OL 1200 99.521 26.308 34.246 1.00 0.00 H ATOM 48918 H8S OL 1200 100.364 24.848 34.547 1.00 0.00 H ATOM 48919 C19 OL 1200 101.317 26.300 33.258 1.00 0.00 C ATOM 48920 H9R OL 1200 101.995 25.834 32.548 1.00 0.00 H ATOM 48921 C110 OL 1200 101.550 27.638 33.498 1.00 0.00 C ATOM 48922 H10R OL 1200 102.310 28.183 32.945 1.00 0.00 H ATOM 48923 C111 OL 1200 100.858 28.491 34.506 1.00 0.00 C ATOM 48924 H11R OL 1200 100.582 27.995 35.439 1.00 0.00 H ATOM 48925 H11S OL 1200 101.645 29.219 34.712 1.00 0.00 H ATOM 48926 C112 OL 1200 99.584 29.295 33.950 1.00 0.00 C ATOM 48927 H12R OL 1200 99.736 29.726 32.958 1.00 0.00 H ATOM 48928 H12S OL 1200 98.779 28.562 33.862 1.00 0.00 H ATOM 48929 C113 OL 1200 99.123 30.412 34.857 1.00 0.00 C ATOM 48930 H13R OL 1200 99.777 31.286 34.850 1.00 0.00 H ATOM 48931 H13S OL 1200 98.180 30.881 34.569 1.00 0.00 H ATOM 48932 C114 OL 1200 98.966 30.005 36.278 1.00 0.00 C ATOM 48933 H14R OL 1200 98.557 28.992 36.280 1.00 0.00 H ATOM 48934 H14S OL 1200 100.005 29.861 36.583 1.00 0.00 H ATOM 48935 C115 OL 1200 98.237 31.116 37.131 1.00 0.00 C ATOM 48936 H15R OL 1200 98.814 32.038 37.027 1.00 0.00 H ATOM 48937 H15S OL 1200 97.250 31.350 36.728 1.00 0.00 H ATOM 48938 C116 OL 1200 98.072 30.880 38.611 1.00 0.00 C ATOM 48939 H16R OL 1200 97.429 31.576 39.155 1.00 0.00 H ATOM 48940 H16S OL 1200 97.747 29.859 38.822 1.00 0.00 H ATOM 48941 C117 OL 1200 99.415 30.800 39.325 1.00 0.00 C ATOM 48942 H17R OL 1200 99.878 29.848 39.059 1.00 0.00 H ATOM 48943 H17S OL 1200 100.089 31.584 38.974 1.00 0.00 H ATOM 48944 C118 OL 1200 99.478 30.743 40.807 1.00 0.00 C ATOM 48945 H18R OL 1200 99.369 29.771 41.293 1.00 0.00 H ATOM 48946 H18S OL 1200 98.887 31.485 41.348 1.00 0.00 H ATOM 48947 H18T OL 1200 100.515 31.052 40.954 1.00 0.00 H TER 48948 OL 1200 ATOM 48948 C116 PA 1201 29.563 40.469 34.329 1.00 0.00 C ATOM 48949 H16R PA 1201 29.449 39.548 34.905 1.00 0.00 H ATOM 48950 H16S PA 1201 30.332 41.079 34.808 1.00 0.00 H ATOM 48951 H16T PA 1201 29.953 40.241 33.335 1.00 0.00 H ATOM 48952 C115 PA 1201 28.182 41.182 34.113 1.00 0.00 C ATOM 48953 H15R PA 1201 27.716 40.572 33.336 1.00 0.00 H ATOM 48954 H15S PA 1201 28.438 42.132 33.641 1.00 0.00 H ATOM 48955 C114 PA 1201 27.205 41.405 35.233 1.00 0.00 C ATOM 48956 H14R PA 1201 26.959 40.516 35.816 1.00 0.00 H ATOM 48957 H14S PA 1201 26.221 41.673 34.841 1.00 0.00 H ATOM 48958 C113 PA 1201 27.589 42.580 36.148 1.00 0.00 C ATOM 48959 H13R PA 1201 28.602 42.432 36.529 1.00 0.00 H ATOM 48960 H13S PA 1201 26.901 42.362 36.968 1.00 0.00 H ATOM 48961 C112 PA 1201 27.288 43.910 35.605 1.00 0.00 C ATOM 48962 H12R PA 1201 26.254 43.911 35.255 1.00 0.00 H ATOM 48963 H12S PA 1201 27.729 43.897 34.606 1.00 0.00 H ATOM 48964 C111 PA 1201 27.679 45.040 36.497 1.00 0.00 C ATOM 48965 H11R PA 1201 28.765 45.153 36.504 1.00 0.00 H ATOM 48966 H11S PA 1201 27.255 44.941 37.498 1.00 0.00 H ATOM 48967 C110 PA 1201 27.083 46.331 35.927 1.00 0.00 C ATOM 48968 H10R PA 1201 27.067 47.123 36.678 1.00 0.00 H ATOM 48969 H10S PA 1201 26.038 46.189 35.642 1.00 0.00 H ATOM 48970 C19 PA 1201 27.891 46.917 34.781 1.00 0.00 C ATOM 48971 H9R PA 1201 28.231 46.072 34.180 1.00 0.00 H ATOM 48972 H9S PA 1201 28.843 47.273 35.181 1.00 0.00 H ATOM 48973 C18 PA 1201 27.188 47.850 33.800 1.00 0.00 C ATOM 48974 H8R PA 1201 26.671 48.533 34.478 1.00 0.00 H ATOM 48975 H8S PA 1201 26.378 47.338 33.277 1.00 0.00 H ATOM 48976 C17 PA 1201 28.264 48.392 32.877 1.00 0.00 C ATOM 48977 H7R PA 1201 28.954 47.628 32.512 1.00 0.00 H ATOM 48978 H7S PA 1201 28.677 49.196 33.489 1.00 0.00 H ATOM 48979 C16 PA 1201 27.554 49.024 31.617 1.00 0.00 C ATOM 48980 H6R PA 1201 26.658 49.593 31.874 1.00 0.00 H ATOM 48981 H6S PA 1201 27.337 48.181 30.957 1.00 0.00 H ATOM 48982 C15 PA 1201 28.704 49.864 30.910 1.00 0.00 C ATOM 48983 H5R PA 1201 29.529 49.228 30.584 1.00 0.00 H ATOM 48984 H5S PA 1201 29.077 50.662 31.555 1.00 0.00 H ATOM 48985 C14 PA 1201 28.326 50.620 29.606 1.00 0.00 C ATOM 48986 H4R PA 1201 29.220 51.056 29.156 1.00 0.00 H ATOM 48987 H4S PA 1201 27.648 51.471 29.696 1.00 0.00 H ATOM 48988 C13 PA 1201 27.713 49.785 28.475 1.00 0.00 C ATOM 48989 H3R PA 1201 27.428 50.348 27.584 1.00 0.00 H ATOM 48990 H3S PA 1201 26.738 49.465 28.846 1.00 0.00 H ATOM 48991 C12 PA 1201 28.543 48.570 27.970 1.00 0.00 C ATOM 48992 H2R PA 1201 27.848 47.928 27.425 1.00 0.00 H ATOM 48993 H2S PA 1201 28.861 48.056 28.879 1.00 0.00 H ATOM 48994 C11 PGR 1202 29.692 48.891 27.037 1.00 0.00 C ATOM 48995 O12 PGR 1202 29.812 48.440 25.904 1.00 0.00 O ATOM 48996 O11 PGR 1202 30.613 49.734 27.567 1.00 0.00 O ATOM 48997 C1 PGR 1202 31.724 50.266 26.689 1.00 0.00 C ATOM 48998 HR PGR 1202 32.261 49.483 26.148 1.00 0.00 H ATOM 48999 HS PGR 1202 32.271 50.962 27.330 1.00 0.00 H ATOM 49000 C2 PGR 1202 31.018 51.096 25.591 1.00 0.00 C ATOM 49001 HX PGR 1202 30.364 50.522 24.930 1.00 0.00 H ATOM 49002 C3 PGR 1202 32.205 51.811 24.836 1.00 0.00 C ATOM 49003 HA PGR 1202 33.051 51.167 24.584 1.00 0.00 H ATOM 49004 HB PGR 1202 32.509 52.678 25.429 1.00 0.00 H ATOM 49005 O31 PGR 1202 31.633 52.326 23.656 1.00 0.00 O ATOM 49006 P31 PGR 1202 32.563 52.968 22.602 1.00 0.00 P ATOM 49007 O32 PGR 1202 33.368 54.131 23.380 1.00 0.00 O ATOM 49008 C31 PGR 1202 34.694 53.914 23.800 1.00 0.00 C ATOM 49009 H1A PGR 1202 34.869 52.913 24.203 1.00 0.00 H ATOM 49010 H1B PGR 1202 34.940 54.577 24.634 1.00 0.00 H ATOM 49011 C32 PGR 1202 35.660 54.258 22.675 1.00 0.00 C ATOM 49012 H2A PGR 1202 35.131 54.962 22.027 1.00 0.00 H ATOM 49013 O35 PGR 1202 35.895 53.040 22.058 1.00 0.00 O ATOM 49014 HO5A PGR 1202 35.115 52.486 22.238 1.00 0.00 H ATOM 49015 C33 PGR 1202 37.001 54.695 23.209 1.00 0.00 C ATOM 49016 H3A PGR 1202 37.690 54.971 22.406 1.00 0.00 H ATOM 49017 H3B PGR 1202 36.927 55.490 23.955 1.00 0.00 H ATOM 49018 O33 PGR 1202 33.452 51.860 22.202 1.00 0.00 O ATOM 49019 O34 PGR 1202 31.710 53.641 21.573 1.00 0.00 O ATOM 49020 O21 PGR 1202 30.383 52.173 26.305 1.00 0.00 O ATOM 49021 C21 PGR 1202 29.295 52.719 25.739 1.00 0.00 C ATOM 49022 O22 PGR 1202 28.782 52.409 24.678 1.00 0.00 O ATOM 49023 O36 PGR 1202 37.513 53.526 23.947 1.00 0.00 O ATOM 49024 HO6A PGR 1202 37.349 52.818 23.299 1.00 0.00 H ATOM 49025 C12 OL 1203 28.563 53.585 26.740 1.00 0.00 C ATOM 49026 H2R OL 1203 27.897 54.324 26.291 1.00 0.00 H ATOM 49027 H2S OL 1203 27.924 52.972 27.379 1.00 0.00 H ATOM 49028 C13 OL 1203 29.435 54.403 27.728 1.00 0.00 C ATOM 49029 H3R OL 1203 30.208 53.763 28.158 1.00 0.00 H ATOM 49030 H3S OL 1203 30.001 55.064 27.068 1.00 0.00 H ATOM 49031 C14 OL 1203 28.655 55.154 28.802 1.00 0.00 C ATOM 49032 H4R OL 1203 27.812 55.524 28.215 1.00 0.00 H ATOM 49033 H4S OL 1203 28.223 54.512 29.572 1.00 0.00 H ATOM 49034 C15 OL 1203 29.581 56.229 29.436 1.00 0.00 C ATOM 49035 H5R OL 1203 29.847 56.963 28.673 1.00 0.00 H ATOM 49036 H5S OL 1203 28.863 56.778 30.048 1.00 0.00 H ATOM 49037 C16 OL 1203 30.838 55.758 30.189 1.00 0.00 C ATOM 49038 H6R OL 1203 31.609 55.462 29.474 1.00 0.00 H ATOM 49039 H6S OL 1203 31.140 56.595 30.823 1.00 0.00 H ATOM 49040 C17 OL 1203 30.667 54.664 31.213 1.00 0.00 C ATOM 49041 H7R OL 1203 29.713 54.700 31.742 1.00 0.00 H ATOM 49042 H7S OL 1203 30.619 53.676 30.749 1.00 0.00 H ATOM 49043 C18 OL 1203 31.829 54.529 32.177 1.00 0.00 C ATOM 49044 H8R OL 1203 31.730 53.497 32.519 1.00 0.00 H ATOM 49045 H8S OL 1203 32.776 54.559 31.633 1.00 0.00 H ATOM 49046 C19 OL 1203 31.864 55.586 33.248 1.00 0.00 C ATOM 49047 H9R OL 1203 31.580 56.587 32.935 1.00 0.00 H ATOM 49048 C110 OL 1203 32.021 55.355 34.581 1.00 0.00 C ATOM 49049 H10R OL 1203 31.971 56.173 35.295 1.00 0.00 H ATOM 49050 C111 OL 1203 32.240 54.028 35.267 1.00 0.00 C ATOM 49051 H11R OL 1203 31.619 53.850 36.147 1.00 0.00 H ATOM 49052 H11S OL 1203 32.037 53.163 34.632 1.00 0.00 H ATOM 49053 C112 OL 1203 33.714 53.887 35.590 1.00 0.00 C ATOM 49054 H12R OL 1203 33.962 52.890 35.963 1.00 0.00 H ATOM 49055 H12S OL 1203 34.392 53.923 34.735 1.00 0.00 H ATOM 49056 C113 OL 1203 34.179 54.839 36.729 1.00 0.00 C ATOM 49057 H13R OL 1203 35.269 54.790 36.763 1.00 0.00 H ATOM 49058 H13S OL 1203 33.770 55.787 36.372 1.00 0.00 H ATOM 49059 C114 OL 1203 33.654 54.504 38.121 1.00 0.00 C ATOM 49060 H14R OL 1203 32.572 54.357 38.104 1.00 0.00 H ATOM 49061 H14S OL 1203 34.151 53.665 38.611 1.00 0.00 H ATOM 49062 C115 OL 1203 33.905 55.530 39.219 1.00 0.00 C ATOM 49063 H15R OL 1203 33.410 55.142 40.111 1.00 0.00 H ATOM 49064 H15S OL 1203 34.948 55.392 39.511 1.00 0.00 H ATOM 49065 C116 OL 1203 33.402 56.891 38.839 1.00 0.00 C ATOM 49066 H16R OL 1203 33.742 57.355 37.911 1.00 0.00 H ATOM 49067 H16S OL 1203 32.390 56.519 38.666 1.00 0.00 H ATOM 49068 C117 OL 1203 33.436 57.852 40.027 1.00 0.00 C ATOM 49069 H17R OL 1203 33.566 57.346 40.986 1.00 0.00 H ATOM 49070 H17S OL 1203 34.376 58.408 40.027 1.00 0.00 H ATOM 49071 C118 OL 1203 32.143 58.800 40.247 1.00 0.00 C ATOM 49072 H18R OL 1203 31.719 59.168 39.310 1.00 0.00 H ATOM 49073 H18S OL 1203 32.310 59.617 40.952 1.00 0.00 H ATOM 49074 H18T OL 1203 31.386 58.143 40.682 1.00 0.00 H TER 49075 OL 1203 ATOM 49075 C116 PA 1204 54.037 113.536 36.664 1.00 0.00 C ATOM 49076 H16R PA 1204 53.864 112.464 36.771 1.00 0.00 H ATOM 49077 H16S PA 1204 53.886 113.979 37.651 1.00 0.00 H ATOM 49078 H16T PA 1204 55.087 113.618 36.374 1.00 0.00 H ATOM 49079 C115 PA 1204 53.190 114.098 35.542 1.00 0.00 C ATOM 49080 H15R PA 1204 52.130 114.160 35.799 1.00 0.00 H ATOM 49081 H15S PA 1204 53.357 113.404 34.715 1.00 0.00 H ATOM 49082 C114 PA 1204 53.624 115.438 34.933 1.00 0.00 C ATOM 49083 H14R PA 1204 54.695 115.512 35.134 1.00 0.00 H ATOM 49084 H14S PA 1204 53.224 116.247 35.547 1.00 0.00 H ATOM 49085 C113 PA 1204 53.320 115.644 33.453 1.00 0.00 C ATOM 49086 H13R PA 1204 52.318 116.051 33.302 1.00 0.00 H ATOM 49087 H13S PA 1204 53.344 114.675 32.950 1.00 0.00 H ATOM 49088 C112 PA 1204 54.255 116.633 32.822 1.00 0.00 C ATOM 49089 H12R PA 1204 55.277 116.347 33.082 1.00 0.00 H ATOM 49090 H12S PA 1204 54.153 117.624 33.271 1.00 0.00 H ATOM 49091 C111 PA 1204 54.024 116.690 31.254 1.00 0.00 C ATOM 49092 H11R PA 1204 52.941 116.576 31.163 1.00 0.00 H ATOM 49093 H11S PA 1204 54.276 115.732 30.796 1.00 0.00 H ATOM 49094 C110 PA 1204 54.518 117.931 30.566 1.00 0.00 C ATOM 49095 H10R PA 1204 55.507 118.307 30.836 1.00 0.00 H ATOM 49096 H10S PA 1204 53.813 118.727 30.813 1.00 0.00 H ATOM 49097 C19 PA 1204 54.347 117.757 29.026 1.00 0.00 C ATOM 49098 H9R PA 1204 53.385 117.322 28.747 1.00 0.00 H ATOM 49099 H9S PA 1204 55.105 117.078 28.629 1.00 0.00 H ATOM 49100 C18 PA 1204 54.544 119.029 28.239 1.00 0.00 C ATOM 49101 H8R PA 1204 55.321 119.697 28.617 1.00 0.00 H ATOM 49102 H8S PA 1204 53.678 119.655 28.467 1.00 0.00 H ATOM 49103 C17 PA 1204 54.690 118.766 26.713 1.00 0.00 C ATOM 49104 H7R PA 1204 53.849 118.129 26.434 1.00 0.00 H ATOM 49105 H7S PA 1204 55.629 118.213 26.791 1.00 0.00 H ATOM 49106 C16 PA 1204 54.814 119.978 25.730 1.00 0.00 C ATOM 49107 H6R PA 1204 55.884 120.142 25.582 1.00 0.00 H ATOM 49108 H6S PA 1204 54.557 120.889 26.274 1.00 0.00 H ATOM 49109 C15 PA 1204 54.204 119.751 24.312 1.00 0.00 C ATOM 49110 H5R PA 1204 54.698 118.923 23.799 1.00 0.00 H ATOM 49111 H5S PA 1204 54.581 120.655 23.831 1.00 0.00 H ATOM 49112 C14 PA 1204 52.760 119.448 24.083 1.00 0.00 C ATOM 49113 H4R PA 1204 52.512 118.445 24.438 1.00 0.00 H ATOM 49114 H4S PA 1204 52.594 119.367 23.007 1.00 0.00 H ATOM 49115 C13 PA 1204 51.753 120.432 24.632 1.00 0.00 C ATOM 49116 H3R PA 1204 51.899 120.350 25.711 1.00 0.00 H ATOM 49117 H3S PA 1204 50.708 120.171 24.452 1.00 0.00 H ATOM 49118 C12 PA 1204 52.017 121.831 24.028 1.00 0.00 C ATOM 49119 H2R PA 1204 53.075 122.101 24.010 1.00 0.00 H ATOM 49120 H2S PA 1204 51.645 122.648 24.651 1.00 0.00 H ATOM 49121 C11 PC 1205 51.459 122.016 22.630 1.00 0.00 C ATOM 49122 O12 PC 1205 52.178 121.810 21.656 1.00 0.00 O ATOM 49123 O11 PC 1205 50.246 122.580 22.589 1.00 0.00 O ATOM 49124 C1 PC 1205 49.713 122.958 21.320 1.00 0.00 C ATOM 49125 HR PC 1205 50.347 123.696 20.823 1.00 0.00 H ATOM 49126 HS PC 1205 48.724 123.386 21.500 1.00 0.00 H ATOM 49127 C2 PC 1205 49.449 121.724 20.411 1.00 0.00 C ATOM 49128 HX PC 1205 50.413 121.302 20.118 1.00 0.00 H ATOM 49129 C3 PC 1205 48.762 121.990 19.033 1.00 0.00 C ATOM 49130 HA PC 1205 49.242 122.848 18.555 1.00 0.00 H ATOM 49131 HB PC 1205 47.720 122.318 19.081 1.00 0.00 H ATOM 49132 O31 PC 1205 48.838 120.877 18.108 1.00 0.00 O ATOM 49133 P31 PC 1205 49.751 121.055 16.788 1.00 0.00 P ATOM 49134 O32 PC 1205 51.176 121.186 17.341 1.00 0.00 O ATOM 49135 C31 PC 1205 51.828 120.038 17.940 1.00 0.00 C ATOM 49136 H1A PC 1205 52.019 119.259 17.197 1.00 0.00 H ATOM 49137 H1B PC 1205 51.243 119.619 18.762 1.00 0.00 H ATOM 49138 C32 PC 1205 53.181 120.428 18.432 1.00 0.00 C ATOM 49139 H2A PC 1205 53.036 121.231 19.157 1.00 0.00 H ATOM 49140 H2B PC 1205 53.812 120.906 17.682 1.00 0.00 H ATOM 49141 N31 PC 1205 54.048 119.335 19.147 1.00 0.00 N ATOM 49142 C33 PC 1205 54.084 118.122 18.306 1.00 0.00 C ATOM 49143 H3A PC 1205 53.066 117.734 18.258 1.00 0.00 H ATOM 49144 H3B PC 1205 54.701 117.319 18.713 1.00 0.00 H ATOM 49145 H3C PC 1205 54.332 118.431 17.290 1.00 0.00 H ATOM 49146 C34 PC 1205 55.399 119.983 19.258 1.00 0.00 C ATOM 49147 H4A PC 1205 55.252 121.037 19.500 1.00 0.00 H ATOM 49148 H4B PC 1205 55.903 119.803 18.307 1.00 0.00 H ATOM 49149 H4C PC 1205 55.868 119.370 20.029 1.00 0.00 H ATOM 49150 C35 PC 1205 53.465 119.050 20.502 1.00 0.00 C ATOM 49151 H5A PC 1205 52.398 118.850 20.389 1.00 0.00 H ATOM 49152 H5B PC 1205 53.879 119.752 21.227 1.00 0.00 H ATOM 49153 H5C PC 1205 54.030 118.182 20.844 1.00 0.00 H ATOM 49154 O33 PC 1205 49.623 119.818 16.001 1.00 0.00 O ATOM 49155 O34 PC 1205 49.384 122.349 16.189 1.00 0.00 O ATOM 49156 O21 PC 1205 48.663 120.791 21.195 1.00 0.00 O ATOM 49157 C21 PC 1205 49.261 119.708 21.722 1.00 0.00 C ATOM 49158 O22 PC 1205 50.420 119.443 21.636 1.00 0.00 O ATOM 49159 C12 OL 1206 48.267 118.814 22.318 1.00 0.00 C ATOM 49160 H2R OL 1206 47.673 119.583 22.816 1.00 0.00 H ATOM 49161 H2S OL 1206 47.588 118.428 21.555 1.00 0.00 H ATOM 49162 C13 OL 1206 48.817 117.811 23.252 1.00 0.00 C ATOM 49163 H3R OL 1206 49.433 117.020 22.820 1.00 0.00 H ATOM 49164 H3S OL 1206 49.440 118.436 23.896 1.00 0.00 H ATOM 49165 C14 OL 1206 47.780 117.249 24.110 1.00 0.00 C ATOM 49166 H4R OL 1206 48.266 117.058 25.069 1.00 0.00 H ATOM 49167 H4S OL 1206 46.956 117.928 24.344 1.00 0.00 H ATOM 49168 C15 OL 1206 47.097 116.042 23.447 1.00 0.00 C ATOM 49169 H5R OL 1206 46.677 116.353 22.488 1.00 0.00 H ATOM 49170 H5S OL 1206 47.966 115.427 23.207 1.00 0.00 H ATOM 49171 C16 OL 1206 46.107 115.143 24.234 1.00 0.00 C ATOM 49172 H6R OL 1206 45.278 115.826 24.425 1.00 0.00 H ATOM 49173 H6S OL 1206 45.879 114.379 23.487 1.00 0.00 H ATOM 49174 C17 OL 1206 46.587 114.495 25.592 1.00 0.00 C ATOM 49175 H7R OL 1206 47.076 115.264 26.194 1.00 0.00 H ATOM 49176 H7S OL 1206 45.671 114.234 26.127 1.00 0.00 H ATOM 49177 C18 OL 1206 47.565 113.330 25.514 1.00 0.00 C ATOM 49178 H8R OL 1206 47.203 112.533 24.862 1.00 0.00 H ATOM 49179 H8S OL 1206 48.414 113.682 24.924 1.00 0.00 H ATOM 49180 C19 OL 1206 47.840 113.057 26.962 1.00 0.00 C ATOM 49181 H9R OL 1206 46.967 112.784 27.549 1.00 0.00 H ATOM 49182 C110 OL 1206 49.041 113.176 27.578 1.00 0.00 C ATOM 49183 H10R OL 1206 49.185 113.011 28.642 1.00 0.00 H ATOM 49184 C111 OL 1206 50.268 113.665 26.920 1.00 0.00 C ATOM 49185 H11R OL 1206 50.997 112.867 27.076 1.00 0.00 H ATOM 49186 H11S OL 1206 50.375 113.547 25.840 1.00 0.00 H ATOM 49187 C112 OL 1206 50.715 115.077 27.368 1.00 0.00 C ATOM 49188 H12R OL 1206 49.895 115.789 27.477 1.00 0.00 H ATOM 49189 H12S OL 1206 50.998 115.012 28.421 1.00 0.00 H ATOM 49190 C113 OL 1206 51.698 115.725 26.443 1.00 0.00 C ATOM 49191 H13R OL 1206 51.338 115.906 25.428 1.00 0.00 H ATOM 49192 H13S OL 1206 51.937 116.712 26.844 1.00 0.00 H ATOM 49193 C114 OL 1206 52.981 114.858 26.347 1.00 0.00 C ATOM 49194 H14R OL 1206 53.316 114.804 27.385 1.00 0.00 H ATOM 49195 H14S OL 1206 52.705 113.843 26.055 1.00 0.00 H ATOM 49196 C115 OL 1206 54.016 115.393 25.384 1.00 0.00 C ATOM 49197 H15R OL 1206 53.447 115.782 24.537 1.00 0.00 H ATOM 49198 H15S OL 1206 54.518 116.240 25.855 1.00 0.00 H ATOM 49199 C116 OL 1206 55.059 114.456 24.882 1.00 0.00 C ATOM 49200 H16R OL 1206 54.618 113.915 24.043 1.00 0.00 H ATOM 49201 H16S OL 1206 55.852 115.016 24.382 1.00 0.00 H ATOM 49202 C117 OL 1206 55.605 113.474 25.894 1.00 0.00 C ATOM 49203 H17R OL 1206 54.868 112.829 26.375 1.00 0.00 H ATOM 49204 H17S OL 1206 56.321 112.778 25.451 1.00 0.00 H ATOM 49205 C118 OL 1206 56.146 114.143 27.109 1.00 0.00 C ATOM 49206 H18R OL 1206 55.344 114.576 27.710 1.00 0.00 H ATOM 49207 H18S OL 1206 56.949 114.876 27.014 1.00 0.00 H ATOM 49208 H18T OL 1206 56.635 113.344 27.670 1.00 0.00 H TER 49209 OL 1206 ATOM 49209 C116 PA 1207 105.075 82.737 39.708 1.00 0.00 C ATOM 49210 H16R PA 1207 104.524 83.451 40.325 1.00 0.00 H ATOM 49211 H16S PA 1207 106.122 82.620 39.995 1.00 0.00 H ATOM 49212 H16T PA 1207 104.694 81.723 39.847 1.00 0.00 H ATOM 49213 C115 PA 1207 104.926 83.125 38.235 1.00 0.00 C ATOM 49214 H15R PA 1207 103.883 82.961 37.955 1.00 0.00 H ATOM 49215 H15S PA 1207 105.484 82.447 37.586 1.00 0.00 H ATOM 49216 C114 PA 1207 105.371 84.606 38.001 1.00 0.00 C ATOM 49217 H14R PA 1207 105.393 84.894 36.948 1.00 0.00 H ATOM 49218 H14S PA 1207 106.358 84.814 38.420 1.00 0.00 H ATOM 49219 C113 PA 1207 104.570 85.618 38.826 1.00 0.00 C ATOM 49220 H13R PA 1207 104.657 85.341 39.879 1.00 0.00 H ATOM 49221 H13S PA 1207 103.512 85.506 38.584 1.00 0.00 H ATOM 49222 C112 PA 1207 105.122 86.990 38.524 1.00 0.00 C ATOM 49223 H12R PA 1207 104.434 87.778 38.839 1.00 0.00 H ATOM 49224 H12S PA 1207 105.144 87.032 37.433 1.00 0.00 H ATOM 49225 C111 PA 1207 106.404 87.404 39.222 1.00 0.00 C ATOM 49226 H11R PA 1207 107.323 86.860 38.995 1.00 0.00 H ATOM 49227 H11S PA 1207 106.335 87.267 40.304 1.00 0.00 H ATOM 49228 C110 PA 1207 106.623 88.921 39.028 1.00 0.00 C ATOM 49229 H10R PA 1207 107.511 89.313 39.529 1.00 0.00 H ATOM 49230 H10S PA 1207 105.877 89.492 39.585 1.00 0.00 H ATOM 49231 C19 PA 1207 106.570 89.500 37.561 1.00 0.00 C ATOM 49232 H9R PA 1207 106.722 90.578 37.469 1.00 0.00 H ATOM 49233 H9S PA 1207 105.519 89.354 37.304 1.00 0.00 H ATOM 49234 C18 PA 1207 107.432 88.739 36.587 1.00 0.00 C ATOM 49235 H8R PA 1207 107.040 87.721 36.522 1.00 0.00 H ATOM 49236 H8S PA 1207 108.490 88.796 36.852 1.00 0.00 H ATOM 49237 C17 PA 1207 107.289 89.294 35.180 1.00 0.00 C ATOM 49238 H7R PA 1207 107.380 90.363 35.380 1.00 0.00 H ATOM 49239 H7S PA 1207 106.272 89.402 34.799 1.00 0.00 H ATOM 49240 C16 PA 1207 108.226 88.740 34.050 1.00 0.00 C ATOM 49241 H6R PA 1207 108.302 87.661 33.899 1.00 0.00 H ATOM 49242 H6S PA 1207 109.261 89.038 34.227 1.00 0.00 H ATOM 49243 C15 PA 1207 107.907 89.079 32.632 1.00 0.00 C ATOM 49244 H5R PA 1207 107.644 90.139 32.622 1.00 0.00 H ATOM 49245 H5S PA 1207 107.091 88.478 32.225 1.00 0.00 H ATOM 49246 C14 PA 1207 109.011 88.769 31.632 1.00 0.00 C ATOM 49247 H4R PA 1207 109.159 87.688 31.579 1.00 0.00 H ATOM 49248 H4S PA 1207 109.920 89.246 32.005 1.00 0.00 H ATOM 49249 C13 PA 1207 108.795 89.350 30.268 1.00 0.00 C ATOM 49250 H3R PA 1207 109.667 89.809 29.798 1.00 0.00 H ATOM 49251 H3S PA 1207 108.272 90.264 30.559 1.00 0.00 H ATOM 49252 C12 PA 1207 108.100 88.502 29.232 1.00 0.00 C ATOM 49253 H2R PA 1207 107.231 88.036 29.701 1.00 0.00 H ATOM 49254 H2S PA 1207 108.780 87.742 28.841 1.00 0.00 H ATOM 49255 C11 PGR 1208 107.414 89.337 28.113 1.00 0.00 C ATOM 49256 O12 PGR 1208 107.137 88.954 27.009 1.00 0.00 O ATOM 49257 O11 PGR 1208 107.143 90.571 28.540 1.00 0.00 O ATOM 49258 C1 PGR 1208 106.228 91.415 27.818 1.00 0.00 C ATOM 49259 HR PGR 1208 106.735 91.865 26.961 1.00 0.00 H ATOM 49260 HS PGR 1208 106.028 92.300 28.427 1.00 0.00 H ATOM 49261 C2 PGR 1208 104.833 90.921 27.383 1.00 0.00 C ATOM 49262 HX PGR 1208 104.921 89.923 26.945 1.00 0.00 H ATOM 49263 C3 PGR 1208 104.327 91.863 26.317 1.00 0.00 C ATOM 49264 HA PGR 1208 103.341 91.542 25.973 1.00 0.00 H ATOM 49265 HB PGR 1208 105.099 91.974 25.552 1.00 0.00 H ATOM 49266 O31 PGR 1208 103.961 93.170 26.845 1.00 0.00 O ATOM 49267 P31 PGR 1208 103.606 94.349 25.733 1.00 0.00 P ATOM 49268 O32 PGR 1208 104.750 95.386 25.901 1.00 0.00 O ATOM 49269 C31 PGR 1208 106.013 95.021 25.476 1.00 0.00 C ATOM 49270 H1A PGR 1208 105.930 94.717 24.429 1.00 0.00 H ATOM 49271 H1B PGR 1208 106.378 94.136 26.003 1.00 0.00 H ATOM 49272 C32 PGR 1208 107.141 96.092 25.784 1.00 0.00 C ATOM 49273 H2A PGR 1208 108.007 95.713 25.235 1.00 0.00 H ATOM 49274 O35 PGR 1208 107.292 95.929 27.248 1.00 0.00 O ATOM 49275 HO5A PGR 1208 107.536 94.994 27.370 1.00 0.00 H ATOM 49276 C33 PGR 1208 106.920 97.547 25.521 1.00 0.00 C ATOM 49277 H3A PGR 1208 106.188 97.917 26.243 1.00 0.00 H ATOM 49278 H3B PGR 1208 107.806 98.183 25.591 1.00 0.00 H ATOM 49279 O33 PGR 1208 103.737 93.777 24.316 1.00 0.00 O ATOM 49280 O34 PGR 1208 102.342 95.008 26.081 1.00 0.00 O ATOM 49281 O21 PGR 1208 103.933 90.868 28.552 1.00 0.00 O ATOM 49282 C21 PGR 1208 104.172 89.758 29.306 1.00 0.00 C ATOM 49283 O22 PGR 1208 104.669 88.676 28.860 1.00 0.00 O ATOM 49284 O36 PGR 1208 106.355 97.699 24.219 1.00 0.00 O ATOM 49285 HO6A PGR 1208 106.912 97.306 23.524 1.00 0.00 H ATOM 49286 C12 OL 1209 103.754 89.965 30.778 1.00 0.00 C ATOM 49287 H2R OL 1209 102.681 90.168 30.765 1.00 0.00 H ATOM 49288 H2S OL 1209 103.778 89.004 31.297 1.00 0.00 H ATOM 49289 C13 OL 1209 104.749 90.966 31.375 1.00 0.00 C ATOM 49290 H3R OL 1209 105.752 90.580 31.178 1.00 0.00 H ATOM 49291 H3S OL 1209 104.817 91.934 30.874 1.00 0.00 H ATOM 49292 C14 OL 1209 104.449 91.267 32.841 1.00 0.00 C ATOM 49293 H4R OL 1209 103.426 91.642 32.920 1.00 0.00 H ATOM 49294 H4S OL 1209 104.251 90.309 33.326 1.00 0.00 H ATOM 49295 C15 OL 1209 105.350 92.280 33.561 1.00 0.00 C ATOM 49296 H5R OL 1209 106.407 92.024 33.459 1.00 0.00 H ATOM 49297 H5S OL 1209 105.267 93.279 33.128 1.00 0.00 H ATOM 49298 C16 OL 1209 104.992 92.515 35.041 1.00 0.00 C ATOM 49299 H6R OL 1209 105.281 91.584 35.534 1.00 0.00 H ATOM 49300 H6S OL 1209 105.658 93.220 35.544 1.00 0.00 H ATOM 49301 C17 OL 1209 103.488 92.688 35.378 1.00 0.00 C ATOM 49302 H7R OL 1209 102.907 93.386 34.772 1.00 0.00 H ATOM 49303 H7S OL 1209 103.016 91.723 35.183 1.00 0.00 H ATOM 49304 C18 OL 1209 103.109 93.013 36.792 1.00 0.00 C ATOM 49305 H8R OL 1209 103.634 93.934 37.051 1.00 0.00 H ATOM 49306 H8S OL 1209 102.035 93.194 36.720 1.00 0.00 H ATOM 49307 C19 OL 1209 103.429 91.879 37.732 1.00 0.00 C ATOM 49308 H9R OL 1209 103.115 90.913 37.346 1.00 0.00 H ATOM 49309 C110 OL 1209 104.129 91.913 38.914 1.00 0.00 C ATOM 49310 H10R OL 1209 104.426 90.987 39.399 1.00 0.00 H ATOM 49311 C111 OL 1209 104.870 93.161 39.539 1.00 0.00 C ATOM 49312 H11R OL 1209 105.868 92.917 39.910 1.00 0.00 H ATOM 49313 H11S OL 1209 104.927 94.010 38.855 1.00 0.00 H ATOM 49314 C112 OL 1209 104.131 93.584 40.826 1.00 0.00 C ATOM 49315 H12R OL 1209 104.674 94.452 41.206 1.00 0.00 H ATOM 49316 H12S OL 1209 103.081 93.852 40.696 1.00 0.00 H ATOM 49317 C113 OL 1209 103.991 92.477 41.837 1.00 0.00 C ATOM 49318 H13R OL 1209 103.231 91.790 41.459 1.00 0.00 H ATOM 49319 H13S OL 1209 104.956 91.975 41.744 1.00 0.00 H ATOM 49320 C114 OL 1209 103.629 92.825 43.284 1.00 0.00 C ATOM 49321 H14R OL 1209 103.686 91.886 43.837 1.00 0.00 H ATOM 49322 H14S OL 1209 104.343 93.369 43.906 1.00 0.00 H ATOM 49323 C115 OL 1209 102.227 93.254 43.618 1.00 0.00 C ATOM 49324 H15R OL 1209 102.128 94.337 43.522 1.00 0.00 H ATOM 49325 H15S OL 1209 101.498 92.749 42.981 1.00 0.00 H ATOM 49326 C116 OL 1209 101.803 92.926 44.991 1.00 0.00 C ATOM 49327 H16R OL 1209 101.663 91.867 45.219 1.00 0.00 H ATOM 49328 H16S OL 1209 102.624 93.229 45.645 1.00 0.00 H ATOM 49329 C117 OL 1209 100.631 93.712 45.378 1.00 0.00 C ATOM 49330 H17R OL 1209 100.905 94.762 45.259 1.00 0.00 H ATOM 49331 H17S OL 1209 99.752 93.431 44.793 1.00 0.00 H ATOM 49332 C118 OL 1209 100.340 93.714 46.888 1.00 0.00 C ATOM 49333 H18R OL 1209 101.190 94.020 47.501 1.00 0.00 H ATOM 49334 H18S OL 1209 99.884 92.758 47.153 1.00 0.00 H ATOM 49335 H18T OL 1209 99.648 94.530 47.104 1.00 0.00 H TER 49336 OL 1209 ATOM 49336 C116 PA 1210 52.888 98.369 42.275 1.00 0.00 C ATOM 49337 H16R PA 1210 53.682 98.485 41.535 1.00 0.00 H ATOM 49338 H16S PA 1210 52.140 97.604 42.055 1.00 0.00 H ATOM 49339 H16T PA 1210 53.399 98.072 43.192 1.00 0.00 H ATOM 49340 C115 PA 1210 52.283 99.746 42.289 1.00 0.00 C ATOM 49341 H15R PA 1210 53.016 100.549 42.392 1.00 0.00 H ATOM 49342 H15S PA 1210 51.528 99.834 43.072 1.00 0.00 H ATOM 49343 C114 PA 1210 51.630 100.027 40.951 1.00 0.00 C ATOM 49344 H14R PA 1210 52.353 100.014 40.133 1.00 0.00 H ATOM 49345 H14S PA 1210 51.452 101.099 41.055 1.00 0.00 H ATOM 49346 C113 PA 1210 50.349 99.155 40.607 1.00 0.00 C ATOM 49347 H13R PA 1210 49.750 98.996 41.506 1.00 0.00 H ATOM 49348 H13S PA 1210 50.649 98.202 40.165 1.00 0.00 H ATOM 49349 C112 PA 1210 49.340 99.665 39.594 1.00 0.00 C ATOM 49350 H12R PA 1210 48.918 100.515 40.134 1.00 0.00 H ATOM 49351 H12S PA 1210 48.523 98.947 39.496 1.00 0.00 H ATOM 49352 C111 PA 1210 49.872 99.987 38.136 1.00 0.00 C ATOM 49353 H11R PA 1210 50.305 99.075 37.720 1.00 0.00 H ATOM 49354 H11S PA 1210 50.712 100.681 38.200 1.00 0.00 H ATOM 49355 C110 PA 1210 48.874 100.361 37.138 1.00 0.00 C ATOM 49356 H10R PA 1210 48.673 101.400 37.410 1.00 0.00 H ATOM 49357 H10S PA 1210 47.872 99.935 37.215 1.00 0.00 H ATOM 49358 C19 PA 1210 49.375 100.286 35.655 1.00 0.00 C ATOM 49359 H9R PA 1210 50.298 99.724 35.501 1.00 0.00 H ATOM 49360 H9S PA 1210 49.794 101.274 35.450 1.00 0.00 H ATOM 49361 C18 PA 1210 48.293 99.749 34.624 1.00 0.00 C ATOM 49362 H8R PA 1210 47.453 100.441 34.710 1.00 0.00 H ATOM 49363 H8S PA 1210 47.908 98.747 34.826 1.00 0.00 H ATOM 49364 C17 PA 1210 48.838 99.753 33.221 1.00 0.00 C ATOM 49365 H7R PA 1210 49.757 99.163 33.224 1.00 0.00 H ATOM 49366 H7S PA 1210 49.151 100.791 33.093 1.00 0.00 H ATOM 49367 C16 PA 1210 47.884 99.273 32.185 1.00 0.00 C ATOM 49368 H6R PA 1210 46.906 99.740 32.051 1.00 0.00 H ATOM 49369 H6S PA 1210 47.675 98.245 32.487 1.00 0.00 H ATOM 49370 C15 PA 1210 48.454 99.108 30.835 1.00 0.00 C ATOM 49371 H5R PA 1210 49.227 98.344 30.941 1.00 0.00 H ATOM 49372 H5S PA 1210 48.969 99.964 30.395 1.00 0.00 H ATOM 49373 C14 PA 1210 47.272 98.572 29.848 1.00 0.00 C ATOM 49374 H4R PA 1210 46.751 97.677 30.194 1.00 0.00 H ATOM 49375 H4S PA 1210 47.720 98.139 28.951 1.00 0.00 H ATOM 49376 C13 PA 1210 46.236 99.582 29.435 1.00 0.00 C ATOM 49377 H3R PA 1210 46.734 100.425 28.952 1.00 0.00 H ATOM 49378 H3S PA 1210 45.792 100.096 30.290 1.00 0.00 H ATOM 49379 C12 PA 1210 45.226 98.991 28.425 1.00 0.00 C ATOM 49380 H2R PA 1210 44.288 99.550 28.434 1.00 0.00 H ATOM 49381 H2S PA 1210 45.018 97.969 28.751 1.00 0.00 H ATOM 49382 C11 PGR 1211 45.614 98.995 26.970 1.00 0.00 C ATOM 49383 O12 PGR 1211 45.708 97.988 26.328 1.00 0.00 O ATOM 49384 O11 PGR 1211 45.944 100.219 26.565 1.00 0.00 O ATOM 49385 C1 PGR 1211 46.231 100.394 25.162 1.00 0.00 C ATOM 49386 HR PGR 1211 45.525 99.902 24.488 1.00 0.00 H ATOM 49387 HS PGR 1211 47.273 100.168 24.922 1.00 0.00 H ATOM 49388 C2 PGR 1211 46.263 101.916 24.878 1.00 0.00 C ATOM 49389 HX PGR 1211 45.270 102.360 24.983 1.00 0.00 H ATOM 49390 C3 PGR 1211 46.888 102.200 23.434 1.00 0.00 C ATOM 49391 HA PGR 1211 47.098 103.271 23.388 1.00 0.00 H ATOM 49392 HB PGR 1211 46.108 101.932 22.717 1.00 0.00 H ATOM 49393 O31 PGR 1211 48.039 101.507 23.191 1.00 0.00 O ATOM 49394 P31 PGR 1211 48.706 101.642 21.655 1.00 0.00 P ATOM 49395 O32 PGR 1211 49.924 100.632 21.661 1.00 0.00 O ATOM 49396 C31 PGR 1211 49.896 99.465 22.345 1.00 0.00 C ATOM 49397 H1A PGR 1211 48.927 99.001 22.144 1.00 0.00 H ATOM 49398 H1B PGR 1211 49.993 99.671 23.414 1.00 0.00 H ATOM 49399 C32 PGR 1211 50.986 98.431 22.027 1.00 0.00 C ATOM 49400 H2A PGR 1211 50.640 97.478 22.437 1.00 0.00 H ATOM 49401 O35 PGR 1211 52.146 98.927 22.663 1.00 0.00 O ATOM 49402 HO5A PGR 1211 52.752 98.165 22.674 1.00 0.00 H ATOM 49403 C33 PGR 1211 51.333 98.257 20.524 1.00 0.00 C ATOM 49404 H3A PGR 1211 50.438 97.748 20.157 1.00 0.00 H ATOM 49405 H3B PGR 1211 51.493 99.250 20.096 1.00 0.00 H ATOM 49406 O33 PGR 1211 47.775 101.043 20.734 1.00 0.00 O ATOM 49407 O34 PGR 1211 49.203 103.027 21.410 1.00 0.00 O ATOM 49408 O21 PGR 1211 47.014 102.498 25.958 1.00 0.00 O ATOM 49409 C21 PGR 1211 47.182 103.856 25.983 1.00 0.00 C ATOM 49410 O22 PGR 1211 46.648 104.687 25.244 1.00 0.00 O ATOM 49411 O36 PGR 1211 52.530 97.431 20.450 1.00 0.00 O ATOM 49412 HO6A PGR 1211 53.301 98.022 20.522 1.00 0.00 H ATOM 49413 C12 OL 1212 48.090 104.217 27.110 1.00 0.00 C ATOM 49414 H2R OL 1212 48.959 103.556 27.145 1.00 0.00 H ATOM 49415 H2S OL 1212 48.440 105.219 26.855 1.00 0.00 H ATOM 49416 C13 OL 1212 47.510 104.045 28.475 1.00 0.00 C ATOM 49417 H3R OL 1212 46.649 104.716 28.455 1.00 0.00 H ATOM 49418 H3S OL 1212 47.182 103.031 28.715 1.00 0.00 H ATOM 49419 C14 OL 1212 48.299 104.471 29.584 1.00 0.00 C ATOM 49420 H4R OL 1212 49.023 103.661 29.693 1.00 0.00 H ATOM 49421 H4S OL 1212 48.841 105.398 29.383 1.00 0.00 H ATOM 49422 C15 OL 1212 47.559 104.741 30.865 1.00 0.00 C ATOM 49423 H5R OL 1212 48.380 105.042 31.518 1.00 0.00 H ATOM 49424 H5S OL 1212 46.971 105.661 30.906 1.00 0.00 H ATOM 49425 C16 OL 1212 46.860 103.451 31.411 1.00 0.00 C ATOM 49426 H6R OL 1212 46.104 103.140 30.687 1.00 0.00 H ATOM 49427 H6S OL 1212 47.565 102.622 31.318 1.00 0.00 H ATOM 49428 C17 OL 1212 46.103 103.595 32.738 1.00 0.00 C ATOM 49429 H7R OL 1212 45.303 104.316 32.555 1.00 0.00 H ATOM 49430 H7S OL 1212 45.549 102.676 32.943 1.00 0.00 H ATOM 49431 C18 OL 1212 47.027 103.773 33.954 1.00 0.00 C ATOM 49432 H8R OL 1212 47.682 102.908 34.077 1.00 0.00 H ATOM 49433 H8S OL 1212 47.730 104.599 33.826 1.00 0.00 H ATOM 49434 C19 OL 1212 46.128 103.778 35.123 1.00 0.00 C ATOM 49435 H9R OL 1212 45.405 102.971 35.048 1.00 0.00 H ATOM 49436 C110 OL 1212 46.093 104.630 36.169 1.00 0.00 C ATOM 49437 H10R OL 1212 45.376 104.508 36.978 1.00 0.00 H ATOM 49438 C111 OL 1212 47.058 105.760 36.417 1.00 0.00 C ATOM 49439 H11R OL 1212 47.395 106.123 35.444 1.00 0.00 H ATOM 49440 H11S OL 1212 46.429 106.605 36.705 1.00 0.00 H ATOM 49441 C112 OL 1212 48.180 105.399 37.351 1.00 0.00 C ATOM 49442 H12R OL 1212 47.766 104.935 38.249 1.00 0.00 H ATOM 49443 H12S OL 1212 48.934 104.654 37.093 1.00 0.00 H ATOM 49444 C113 OL 1212 48.812 106.679 37.842 1.00 0.00 C ATOM 49445 H13R OL 1212 48.945 107.444 37.074 1.00 0.00 H ATOM 49446 H13S OL 1212 48.119 107.201 38.504 1.00 0.00 H ATOM 49447 C114 OL 1212 50.162 106.550 38.472 1.00 0.00 C ATOM 49448 H14R OL 1212 50.100 105.789 39.252 1.00 0.00 H ATOM 49449 H14S OL 1212 50.966 106.278 37.785 1.00 0.00 H ATOM 49450 C115 OL 1212 50.585 107.916 39.086 1.00 0.00 C ATOM 49451 H15R OL 1212 51.043 108.393 38.217 1.00 0.00 H ATOM 49452 H15S OL 1212 49.777 108.578 39.403 1.00 0.00 H ATOM 49453 C116 OL 1212 51.710 107.871 40.119 1.00 0.00 C ATOM 49454 H16R OL 1212 51.459 107.313 41.024 1.00 0.00 H ATOM 49455 H16S OL 1212 52.571 107.433 39.611 1.00 0.00 H ATOM 49456 C117 OL 1212 52.331 109.148 40.480 1.00 0.00 C ATOM 49457 H17R OL 1212 53.273 108.902 40.975 1.00 0.00 H ATOM 49458 H17S OL 1212 52.703 109.780 39.671 1.00 0.00 H ATOM 49459 C118 OL 1212 51.559 110.014 41.515 1.00 0.00 C ATOM 49460 H18R OL 1212 52.009 110.964 41.811 1.00 0.00 H ATOM 49461 H18S OL 1212 51.510 109.398 42.415 1.00 0.00 H ATOM 49462 H18T OL 1212 50.550 110.252 41.172 1.00 0.00 H TER 49463 OL 1212 ATOM 49463 C116 PA 1213 12.082 127.756 33.263 1.00 0.00 C ATOM 49464 H16R PA 1213 11.556 128.706 33.147 1.00 0.00 H ATOM 49465 H16S PA 1213 11.466 127.109 33.891 1.00 0.00 H ATOM 49466 H16T PA 1213 12.116 127.255 32.293 1.00 0.00 H ATOM 49467 C115 PA 1213 13.412 128.098 33.881 1.00 0.00 C ATOM 49468 H15R PA 1213 13.734 127.127 34.263 1.00 0.00 H ATOM 49469 H15S PA 1213 13.230 128.750 34.738 1.00 0.00 H ATOM 49470 C114 PA 1213 14.347 128.681 32.744 1.00 0.00 C ATOM 49471 H14R PA 1213 14.177 129.753 32.868 1.00 0.00 H ATOM 49472 H14S PA 1213 14.061 128.411 31.725 1.00 0.00 H ATOM 49473 C113 PA 1213 15.784 128.402 32.811 1.00 0.00 C ATOM 49474 H13R PA 1213 15.985 127.364 33.084 1.00 0.00 H ATOM 49475 H13S PA 1213 16.206 128.956 33.652 1.00 0.00 H ATOM 49476 C112 PA 1213 16.512 129.025 31.747 1.00 0.00 C ATOM 49477 H12R PA 1213 16.445 130.114 31.797 1.00 0.00 H ATOM 49478 H12S PA 1213 16.075 128.550 30.866 1.00 0.00 H ATOM 49479 C111 PA 1213 17.989 128.640 31.614 1.00 0.00 C ATOM 49480 H11R PA 1213 18.334 128.681 30.579 1.00 0.00 H ATOM 49481 H11S PA 1213 18.208 127.598 31.856 1.00 0.00 H ATOM 49482 C110 PA 1213 19.028 129.407 32.387 1.00 0.00 C ATOM 49483 H10R PA 1213 19.891 128.769 32.587 1.00 0.00 H ATOM 49484 H10S PA 1213 18.786 129.422 33.452 1.00 0.00 H ATOM 49485 C19 PA 1213 19.436 130.832 31.797 1.00 0.00 C ATOM 49486 H9R PA 1213 18.500 131.383 31.689 1.00 0.00 H ATOM 49487 H9S PA 1213 19.808 130.616 30.793 1.00 0.00 H ATOM 49488 C18 PA 1213 20.453 131.685 32.457 1.00 0.00 C ATOM 49489 H8R PA 1213 21.318 131.047 32.651 1.00 0.00 H ATOM 49490 H8S PA 1213 20.145 131.861 33.489 1.00 0.00 H ATOM 49491 C17 PA 1213 21.070 132.920 31.650 1.00 0.00 C ATOM 49492 H7R PA 1213 21.536 132.585 30.721 1.00 0.00 H ATOM 49493 H7S PA 1213 21.872 133.454 32.164 1.00 0.00 H ATOM 49494 C16 PA 1213 19.917 133.863 31.169 1.00 0.00 C ATOM 49495 H6R PA 1213 19.668 134.623 31.913 1.00 0.00 H ATOM 49496 H6S PA 1213 18.999 133.458 30.739 1.00 0.00 H ATOM 49497 C15 PA 1213 20.474 134.920 30.210 1.00 0.00 C ATOM 49498 H5R PA 1213 20.818 134.400 29.313 1.00 0.00 H ATOM 49499 H5S PA 1213 21.367 135.431 30.576 1.00 0.00 H ATOM 49500 C14 PA 1213 19.485 135.885 29.698 1.00 0.00 C ATOM 49501 H4R PA 1213 18.906 136.397 30.469 1.00 0.00 H ATOM 49502 H4S PA 1213 18.742 135.341 29.111 1.00 0.00 H ATOM 49503 C13 PA 1213 20.071 136.898 28.644 1.00 0.00 C ATOM 49504 H3R PA 1213 20.842 137.541 29.075 1.00 0.00 H ATOM 49505 H3S PA 1213 19.261 137.470 28.186 1.00 0.00 H ATOM 49506 C12 PA 1213 20.529 136.247 27.433 1.00 0.00 C ATOM 49507 H2R PA 1213 21.473 135.719 27.585 1.00 0.00 H ATOM 49508 H2S PA 1213 19.760 135.563 27.066 1.00 0.00 H ATOM 49509 C11 PGR 1214 20.698 137.262 26.347 1.00 0.00 C ATOM 49510 O12 PGR 1214 19.786 137.571 25.614 1.00 0.00 O ATOM 49511 O11 PGR 1214 21.825 137.993 26.439 1.00 0.00 O ATOM 49512 C1 PGR 1214 22.059 139.073 25.445 1.00 0.00 C ATOM 49513 HR PGR 1214 21.932 138.685 24.431 1.00 0.00 H ATOM 49514 HS PGR 1214 23.073 139.426 25.652 1.00 0.00 H ATOM 49515 C2 PGR 1214 21.094 140.224 25.686 1.00 0.00 C ATOM 49516 HX PGR 1214 20.113 139.846 25.387 1.00 0.00 H ATOM 49517 C3 PGR 1214 21.524 141.509 25.008 1.00 0.00 C ATOM 49518 HA PGR 1214 22.598 141.636 25.168 1.00 0.00 H ATOM 49519 HB PGR 1214 20.975 142.339 25.462 1.00 0.00 H ATOM 49520 O31 PGR 1214 21.320 141.371 23.619 1.00 0.00 O ATOM 49521 P31 PGR 1214 19.928 141.687 22.988 1.00 0.00 P ATOM 49522 O32 PGR 1214 19.623 143.241 23.172 1.00 0.00 O ATOM 49523 C31 PGR 1214 20.396 144.265 22.539 1.00 0.00 C ATOM 49524 H1A PGR 1214 20.415 144.191 21.449 1.00 0.00 H ATOM 49525 H1B PGR 1214 21.445 144.074 22.779 1.00 0.00 H ATOM 49526 C32 PGR 1214 20.002 145.739 22.725 1.00 0.00 C ATOM 49527 H2A PGR 1214 20.697 146.416 22.221 1.00 0.00 H ATOM 49528 O35 PGR 1214 20.029 145.957 24.124 1.00 0.00 O ATOM 49529 HO5A PGR 1214 19.712 145.089 24.434 1.00 0.00 H ATOM 49530 C33 PGR 1214 18.556 146.060 22.208 1.00 0.00 C ATOM 49531 H3A PGR 1214 18.318 145.758 21.185 1.00 0.00 H ATOM 49532 H3B PGR 1214 17.957 145.416 22.857 1.00 0.00 H ATOM 49533 O33 PGR 1214 19.968 141.332 21.540 1.00 0.00 O ATOM 49534 O34 PGR 1214 18.874 141.036 23.813 1.00 0.00 O ATOM 49535 O21 PGR 1214 20.808 140.442 27.052 1.00 0.00 O ATOM 49536 C21 PGR 1214 21.698 140.821 27.978 1.00 0.00 C ATOM 49537 O22 PGR 1214 22.825 141.242 27.799 1.00 0.00 O ATOM 49538 O36 PGR 1214 18.222 147.471 22.381 1.00 0.00 O ATOM 49539 HO6A PGR 1214 17.276 147.546 22.160 1.00 0.00 H ATOM 49540 C12 OL 1215 21.095 140.794 29.334 1.00 0.00 C ATOM 49541 H2R OL 1215 20.320 140.029 29.428 1.00 0.00 H ATOM 49542 H2S OL 1215 21.963 140.701 29.990 1.00 0.00 H ATOM 49543 C13 OL 1215 20.381 142.145 29.603 1.00 0.00 C ATOM 49544 H3R OL 1215 20.049 142.603 28.668 1.00 0.00 H ATOM 49545 H3S OL 1215 19.405 142.000 30.071 1.00 0.00 H ATOM 49546 C14 OL 1215 21.303 143.038 30.405 1.00 0.00 C ATOM 49547 H4R OL 1215 21.541 142.482 31.315 1.00 0.00 H ATOM 49548 H4S OL 1215 22.295 142.986 29.953 1.00 0.00 H ATOM 49549 C15 OL 1215 20.706 144.482 30.532 1.00 0.00 C ATOM 49550 H5R OL 1215 21.411 145.231 30.900 1.00 0.00 H ATOM 49551 H5S OL 1215 20.595 144.729 29.474 1.00 0.00 H ATOM 49552 C16 OL 1215 19.366 144.732 31.166 1.00 0.00 C ATOM 49553 H6R OL 1215 18.710 144.353 30.379 1.00 0.00 H ATOM 49554 H6S OL 1215 19.328 144.147 32.087 1.00 0.00 H ATOM 49555 C17 OL 1215 19.033 146.185 31.523 1.00 0.00 C ATOM 49556 H7R OL 1215 19.893 146.565 32.077 1.00 0.00 H ATOM 49557 H7S OL 1215 18.949 146.721 30.575 1.00 0.00 H ATOM 49558 C18 OL 1215 17.663 146.300 32.244 1.00 0.00 C ATOM 49559 H8R OL 1215 17.476 147.375 32.285 1.00 0.00 H ATOM 49560 H8S OL 1215 16.890 145.907 31.580 1.00 0.00 H ATOM 49561 C19 OL 1215 17.536 145.771 33.668 1.00 0.00 C ATOM 49562 H9R OL 1215 18.379 145.940 34.335 1.00 0.00 H ATOM 49563 C110 OL 1215 16.658 144.822 34.041 1.00 0.00 C ATOM 49564 H10R OL 1215 16.710 144.561 35.095 1.00 0.00 H ATOM 49565 C111 OL 1215 15.377 144.403 33.323 1.00 0.00 C ATOM 49566 H11R OL 1215 15.660 144.138 32.302 1.00 0.00 H ATOM 49567 H11S OL 1215 14.960 143.463 33.692 1.00 0.00 H ATOM 49568 C112 OL 1215 14.376 145.567 33.255 1.00 0.00 C ATOM 49569 H12R OL 1215 14.846 146.511 32.970 1.00 0.00 H ATOM 49570 H12S OL 1215 13.654 145.383 32.456 1.00 0.00 H ATOM 49571 C113 OL 1215 13.602 145.711 34.555 1.00 0.00 C ATOM 49572 H13R OL 1215 12.717 145.073 34.508 1.00 0.00 H ATOM 49573 H13S OL 1215 14.243 145.238 35.302 1.00 0.00 H ATOM 49574 C114 OL 1215 13.234 147.151 34.950 1.00 0.00 C ATOM 49575 H14R OL 1215 14.153 147.739 34.998 1.00 0.00 H ATOM 49576 H14S OL 1215 12.613 147.527 34.134 1.00 0.00 H ATOM 49577 C115 OL 1215 12.628 147.268 36.337 1.00 0.00 C ATOM 49578 H15R OL 1215 11.716 146.671 36.264 1.00 0.00 H ATOM 49579 H15S OL 1215 13.284 146.735 37.028 1.00 0.00 H ATOM 49580 C116 OL 1215 12.476 148.608 36.965 1.00 0.00 C ATOM 49581 H16R OL 1215 13.333 149.283 37.002 1.00 0.00 H ATOM 49582 H16S OL 1215 11.803 149.143 36.291 1.00 0.00 H ATOM 49583 C117 OL 1215 11.660 148.553 38.267 1.00 0.00 C ATOM 49584 H17R OL 1215 11.240 149.536 38.488 1.00 0.00 H ATOM 49585 H17S OL 1215 10.823 147.890 38.039 1.00 0.00 H ATOM 49586 C118 OL 1215 12.444 147.992 39.441 1.00 0.00 C ATOM 49587 H18R OL 1215 12.947 147.060 39.176 1.00 0.00 H ATOM 49588 H18S OL 1215 11.749 147.710 40.235 1.00 0.00 H ATOM 49589 H18T OL 1215 13.236 148.695 39.708 1.00 0.00 H TER 49590 OL 1215 ATOM 49590 C116 PA 1216 64.393 116.677 39.577 1.00 0.00 C ATOM 49591 H16R PA 1216 64.984 117.589 39.467 1.00 0.00 H ATOM 49592 H16S PA 1216 64.963 115.832 39.186 1.00 0.00 H ATOM 49593 H16T PA 1216 64.178 116.582 40.643 1.00 0.00 H ATOM 49594 C115 PA 1216 63.155 116.859 38.784 1.00 0.00 C ATOM 49595 H15R PA 1216 62.668 117.724 39.239 1.00 0.00 H ATOM 49596 H15S PA 1216 62.513 115.978 38.853 1.00 0.00 H ATOM 49597 C114 PA 1216 63.300 117.157 37.251 1.00 0.00 C ATOM 49598 H14R PA 1216 63.993 116.349 37.009 1.00 0.00 H ATOM 49599 H14S PA 1216 63.776 118.139 37.291 1.00 0.00 H ATOM 49600 C113 PA 1216 61.970 116.877 36.496 1.00 0.00 C ATOM 49601 H13R PA 1216 61.209 117.464 37.015 1.00 0.00 H ATOM 49602 H13S PA 1216 61.729 115.817 36.603 1.00 0.00 H ATOM 49603 C112 PA 1216 62.056 117.204 34.963 1.00 0.00 C ATOM 49604 H12R PA 1216 62.145 118.272 34.754 1.00 0.00 H ATOM 49605 H12S PA 1216 61.093 116.814 34.627 1.00 0.00 H ATOM 49606 C111 PA 1216 63.175 116.451 34.213 1.00 0.00 C ATOM 49607 H11R PA 1216 63.439 115.554 34.777 1.00 0.00 H ATOM 49608 H11S PA 1216 64.146 116.949 34.172 1.00 0.00 H ATOM 49609 C110 PA 1216 62.881 116.174 32.740 1.00 0.00 C ATOM 49610 H10R PA 1216 62.604 117.123 32.276 1.00 0.00 H ATOM 49611 H10S PA 1216 61.941 115.643 32.576 1.00 0.00 H ATOM 49612 C19 PA 1216 63.926 115.642 31.697 1.00 0.00 C ATOM 49613 H9R PA 1216 63.460 115.472 30.724 1.00 0.00 H ATOM 49614 H9S PA 1216 64.383 114.707 32.028 1.00 0.00 H ATOM 49615 C18 PA 1216 65.081 116.575 31.442 1.00 0.00 C ATOM 49616 H8R PA 1216 65.652 116.654 32.370 1.00 0.00 H ATOM 49617 H8S PA 1216 64.788 117.607 31.240 1.00 0.00 H ATOM 49618 C17 PA 1216 65.939 116.151 30.317 1.00 0.00 C ATOM 49619 H7R PA 1216 66.295 117.043 29.796 1.00 0.00 H ATOM 49620 H7S PA 1216 65.247 115.725 29.587 1.00 0.00 H ATOM 49621 C16 PA 1216 66.916 115.036 30.407 1.00 0.00 C ATOM 49622 H6R PA 1216 66.312 114.128 30.465 1.00 0.00 H ATOM 49623 H6S PA 1216 67.529 115.150 31.304 1.00 0.00 H ATOM 49624 C15 PA 1216 67.956 114.870 29.239 1.00 0.00 C ATOM 49625 H5R PA 1216 68.581 114.066 29.634 1.00 0.00 H ATOM 49626 H5S PA 1216 68.517 115.796 29.101 1.00 0.00 H ATOM 49627 C14 PA 1216 67.234 114.511 27.914 1.00 0.00 C ATOM 49628 H4R PA 1216 66.598 115.361 27.658 1.00 0.00 H ATOM 49629 H4S PA 1216 66.562 113.698 28.197 1.00 0.00 H ATOM 49630 C13 PA 1216 68.287 114.123 26.888 1.00 0.00 C ATOM 49631 H3R PA 1216 68.849 113.289 27.314 1.00 0.00 H ATOM 49632 H3S PA 1216 69.004 114.940 26.780 1.00 0.00 H ATOM 49633 C12 PA 1216 67.738 113.733 25.578 1.00 0.00 C ATOM 49634 H2R PA 1216 67.017 114.474 25.227 1.00 0.00 H ATOM 49635 H2S PA 1216 67.329 112.732 25.730 1.00 0.00 H ATOM 49636 C11 PGR 1217 68.678 113.526 24.467 1.00 0.00 C ATOM 49637 O12 PGR 1217 69.493 112.596 24.403 1.00 0.00 O ATOM 49638 O11 PGR 1217 68.617 114.496 23.588 1.00 0.00 O ATOM 49639 C1 PGR 1217 69.402 114.497 22.419 1.00 0.00 C ATOM 49640 HR PGR 1217 69.202 113.685 21.715 1.00 0.00 H ATOM 49641 HS PGR 1217 70.464 114.464 22.675 1.00 0.00 H ATOM 49642 C2 PGR 1217 69.105 115.763 21.557 1.00 0.00 C ATOM 49643 HX PGR 1217 68.172 115.629 21.004 1.00 0.00 H ATOM 49644 C3 PGR 1217 70.226 115.819 20.491 1.00 0.00 C ATOM 49645 HA PGR 1217 70.306 114.784 20.152 1.00 0.00 H ATOM 49646 HB PGR 1217 71.038 116.267 21.069 1.00 0.00 H ATOM 49647 O31 PGR 1217 69.952 116.645 19.383 1.00 0.00 O ATOM 49648 P31 PGR 1217 71.108 117.092 18.301 1.00 0.00 P ATOM 49649 O32 PGR 1217 71.577 115.666 17.877 1.00 0.00 O ATOM 49650 C31 PGR 1217 72.942 115.381 17.745 1.00 0.00 C ATOM 49651 H1A PGR 1217 73.321 115.071 18.722 1.00 0.00 H ATOM 49652 H1B PGR 1217 73.450 116.281 17.390 1.00 0.00 H ATOM 49653 C32 PGR 1217 73.289 114.189 16.752 1.00 0.00 C ATOM 49654 H2A PGR 1217 72.612 114.213 15.895 1.00 0.00 H ATOM 49655 O35 PGR 1217 72.951 112.931 17.390 1.00 0.00 O ATOM 49656 HO5A PGR 1217 72.017 113.032 17.648 1.00 0.00 H ATOM 49657 C33 PGR 1217 74.762 114.160 16.448 1.00 0.00 C ATOM 49658 H3A PGR 1217 75.036 113.421 15.690 1.00 0.00 H ATOM 49659 H3B PGR 1217 74.985 115.184 16.138 1.00 0.00 H ATOM 49660 O33 PGR 1217 70.346 117.650 17.144 1.00 0.00 O ATOM 49661 O34 PGR 1217 72.119 117.839 19.006 1.00 0.00 O ATOM 49662 O21 PGR 1217 69.156 116.992 22.253 1.00 0.00 O ATOM 49663 C21 PGR 1217 68.104 117.312 23.092 1.00 0.00 C ATOM 49664 O22 PGR 1217 67.014 116.750 23.017 1.00 0.00 O ATOM 49665 O36 PGR 1217 75.521 114.007 17.626 1.00 0.00 O ATOM 49666 HO6A PGR 1217 75.423 113.096 17.955 1.00 0.00 H ATOM 49667 C12 OL 1218 68.458 118.456 24.045 1.00 0.00 C ATOM 49668 H2R OL 1218 69.096 119.101 23.437 1.00 0.00 H ATOM 49669 H2S OL 1218 67.537 118.997 24.271 1.00 0.00 H ATOM 49670 C13 OL 1218 69.059 118.086 25.410 1.00 0.00 C ATOM 49671 H3R OL 1218 69.213 118.987 26.007 1.00 0.00 H ATOM 49672 H3S OL 1218 68.292 117.460 25.870 1.00 0.00 H ATOM 49673 C14 OL 1218 70.501 117.448 25.492 1.00 0.00 C ATOM 49674 H4R OL 1218 70.445 116.526 24.911 1.00 0.00 H ATOM 49675 H4S OL 1218 71.210 118.019 24.889 1.00 0.00 H ATOM 49676 C15 OL 1218 70.966 117.284 26.974 1.00 0.00 C ATOM 49677 H5R OL 1218 70.107 116.927 27.545 1.00 0.00 H ATOM 49678 H5S OL 1218 71.744 116.520 26.922 1.00 0.00 H ATOM 49679 C16 OL 1218 71.584 118.591 27.502 1.00 0.00 C ATOM 49680 H6R OL 1218 72.287 118.980 26.763 1.00 0.00 H ATOM 49681 H6S OL 1218 70.798 119.346 27.568 1.00 0.00 H ATOM 49682 C17 OL 1218 72.305 118.605 28.887 1.00 0.00 C ATOM 49683 H7R OL 1218 73.147 117.911 28.927 1.00 0.00 H ATOM 49684 H7S OL 1218 72.664 119.631 28.989 1.00 0.00 H ATOM 49685 C18 OL 1218 71.340 118.241 30.012 1.00 0.00 C ATOM 49686 H8R OL 1218 70.471 118.863 29.787 1.00 0.00 H ATOM 49687 H8S OL 1218 71.162 117.164 29.993 1.00 0.00 H ATOM 49688 C19 OL 1218 72.078 118.573 31.296 1.00 0.00 C ATOM 49689 H9R OL 1218 72.663 119.489 31.290 1.00 0.00 H ATOM 49690 C110 OL 1218 72.178 117.877 32.419 1.00 0.00 C ATOM 49691 H10R OL 1218 72.710 118.291 33.272 1.00 0.00 H ATOM 49692 C111 OL 1218 71.482 116.633 32.873 1.00 0.00 C ATOM 49693 H11R OL 1218 71.109 116.211 31.938 1.00 0.00 H ATOM 49694 H11S OL 1218 72.215 115.921 33.260 1.00 0.00 H ATOM 49695 C112 OL 1218 70.439 116.927 34.003 1.00 0.00 C ATOM 49696 H12R OL 1218 69.620 117.517 33.585 1.00 0.00 H ATOM 49697 H12S OL 1218 69.933 116.012 34.320 1.00 0.00 H ATOM 49698 C113 OL 1218 70.904 117.515 35.374 1.00 0.00 C ATOM 49699 H13R OL 1218 71.251 118.541 35.237 1.00 0.00 H ATOM 49700 H13S OL 1218 70.038 117.648 36.026 1.00 0.00 H ATOM 49701 C114 OL 1218 71.909 116.605 36.149 1.00 0.00 C ATOM 49702 H14R OL 1218 72.683 116.320 35.434 1.00 0.00 H ATOM 49703 H14S OL 1218 72.347 117.160 36.981 1.00 0.00 H ATOM 49704 C115 OL 1218 71.474 115.310 36.747 1.00 0.00 C ATOM 49705 H15R OL 1218 70.791 115.429 37.591 1.00 0.00 H ATOM 49706 H15S OL 1218 70.989 114.862 35.877 1.00 0.00 H ATOM 49707 C116 OL 1218 72.559 114.389 37.255 1.00 0.00 C ATOM 49708 H16R OL 1218 72.297 113.349 37.462 1.00 0.00 H ATOM 49709 H16S OL 1218 73.332 114.439 36.486 1.00 0.00 H ATOM 49710 C117 OL 1218 73.172 114.808 38.545 1.00 0.00 C ATOM 49711 H17R OL 1218 74.236 114.570 38.494 1.00 0.00 H ATOM 49712 H17S OL 1218 73.109 115.897 38.512 1.00 0.00 H ATOM 49713 C118 OL 1218 72.490 114.532 39.853 1.00 0.00 C ATOM 49714 H18R OL 1218 72.744 113.495 40.083 1.00 0.00 H ATOM 49715 H18S OL 1218 71.420 114.732 39.776 1.00 0.00 H ATOM 49716 H18T OL 1218 72.876 115.201 40.625 1.00 0.00 H TER 49717 OL 1218 ATOM 49717 C116 PA 1219 77.654 38.827 35.799 1.00 0.00 C ATOM 49718 H16R PA 1219 78.454 39.302 36.370 1.00 0.00 H ATOM 49719 H16S PA 1219 76.817 39.523 35.709 1.00 0.00 H ATOM 49720 H16T PA 1219 78.087 38.674 34.808 1.00 0.00 H ATOM 49721 C115 PA 1219 77.141 37.485 36.431 1.00 0.00 C ATOM 49722 H15R PA 1219 76.322 37.012 35.885 1.00 0.00 H ATOM 49723 H15S PA 1219 76.706 37.715 37.406 1.00 0.00 H ATOM 49724 C114 PA 1219 78.179 36.397 36.665 1.00 0.00 C ATOM 49725 H14R PA 1219 78.465 35.807 35.792 1.00 0.00 H ATOM 49726 H14S PA 1219 77.680 35.676 37.317 1.00 0.00 H ATOM 49727 C113 PA 1219 79.534 36.914 37.266 1.00 0.00 C ATOM 49728 H13R PA 1219 79.375 37.645 38.061 1.00 0.00 H ATOM 49729 H13S PA 1219 80.114 37.509 36.557 1.00 0.00 H ATOM 49730 C112 PA 1219 80.427 35.777 37.809 1.00 0.00 C ATOM 49731 H12R PA 1219 80.695 35.054 37.036 1.00 0.00 H ATOM 49732 H12S PA 1219 79.879 35.230 38.580 1.00 0.00 H ATOM 49733 C111 PA 1219 81.830 36.157 38.337 1.00 0.00 C ATOM 49734 H11R PA 1219 82.438 35.266 38.511 1.00 0.00 H ATOM 49735 H11S PA 1219 81.790 36.421 39.396 1.00 0.00 H ATOM 49736 C110 PA 1219 82.657 37.215 37.538 1.00 0.00 C ATOM 49737 H10R PA 1219 83.243 37.736 38.299 1.00 0.00 H ATOM 49738 H10S PA 1219 82.008 38.035 37.224 1.00 0.00 H ATOM 49739 C19 PA 1219 83.569 36.603 36.467 1.00 0.00 C ATOM 49740 H9R PA 1219 83.107 36.525 35.481 1.00 0.00 H ATOM 49741 H9S PA 1219 83.687 35.568 36.795 1.00 0.00 H ATOM 49742 C18 PA 1219 84.932 37.187 36.212 1.00 0.00 C ATOM 49743 H8R PA 1219 85.516 37.061 37.126 1.00 0.00 H ATOM 49744 H8S PA 1219 84.855 38.263 36.045 1.00 0.00 H ATOM 49745 C17 PA 1219 85.816 36.485 35.055 1.00 0.00 C ATOM 49746 H7R PA 1219 85.841 35.418 35.287 1.00 0.00 H ATOM 49747 H7S PA 1219 86.830 36.891 35.043 1.00 0.00 H ATOM 49748 C16 PA 1219 85.197 36.793 33.630 1.00 0.00 C ATOM 49749 H6R PA 1219 85.044 37.853 33.416 1.00 0.00 H ATOM 49750 H6S PA 1219 84.195 36.368 33.718 1.00 0.00 H ATOM 49751 C15 PA 1219 86.094 36.165 32.514 1.00 0.00 C ATOM 49752 H5R PA 1219 85.517 36.255 31.592 1.00 0.00 H ATOM 49753 H5S PA 1219 86.264 35.086 32.540 1.00 0.00 H ATOM 49754 C14 PA 1219 87.489 36.836 32.486 1.00 0.00 C ATOM 49755 H4R PA 1219 88.048 36.285 31.726 1.00 0.00 H ATOM 49756 H4S PA 1219 88.013 36.852 33.444 1.00 0.00 H ATOM 49757 C13 PA 1219 87.632 38.338 32.144 1.00 0.00 C ATOM 49758 H3R PA 1219 86.980 38.829 32.869 1.00 0.00 H ATOM 49759 H3S PA 1219 87.088 38.557 31.223 1.00 0.00 H ATOM 49760 C12 PA 1219 89.095 38.820 32.384 1.00 0.00 C ATOM 49761 H2R PA 1219 89.370 38.402 33.355 1.00 0.00 H ATOM 49762 H2S PA 1219 89.045 39.910 32.430 1.00 0.00 H ATOM 49763 C11 PC 1220 90.081 38.377 31.334 1.00 0.00 C ATOM 49764 O12 PC 1220 90.095 37.264 30.805 1.00 0.00 O ATOM 49765 O11 PC 1220 90.839 39.458 30.786 1.00 0.00 O ATOM 49766 C1 PC 1220 91.596 39.139 29.610 1.00 0.00 C ATOM 49767 HR PC 1220 90.852 38.842 28.867 1.00 0.00 H ATOM 49768 HS PC 1220 92.376 38.389 29.766 1.00 0.00 H ATOM 49769 C2 PC 1220 92.400 40.412 29.150 1.00 0.00 C ATOM 49770 HX PC 1220 91.794 41.316 29.253 1.00 0.00 H ATOM 49771 C3 PC 1220 92.924 40.410 27.668 1.00 0.00 C ATOM 49772 HA PC 1220 93.776 41.090 27.583 1.00 0.00 H ATOM 49773 HB PC 1220 92.170 40.832 26.999 1.00 0.00 H ATOM 49774 O31 PC 1220 93.359 39.133 27.273 1.00 0.00 O ATOM 49775 P31 PC 1220 93.777 38.715 25.789 1.00 0.00 P ATOM 49776 O32 PC 1220 92.448 38.597 25.006 1.00 0.00 O ATOM 49777 C31 PC 1220 91.295 38.079 25.634 1.00 0.00 C ATOM 49778 H1A PC 1220 91.058 38.560 26.586 1.00 0.00 H ATOM 49779 H1B PC 1220 91.498 37.044 25.920 1.00 0.00 H ATOM 49780 C32 PC 1220 90.173 38.086 24.615 1.00 0.00 C ATOM 49781 H2A PC 1220 90.450 37.657 23.651 1.00 0.00 H ATOM 49782 H2B PC 1220 89.896 39.133 24.480 1.00 0.00 H ATOM 49783 N31 PC 1220 88.868 37.425 24.939 1.00 0.00 N ATOM 49784 C33 PC 1220 89.023 35.917 24.959 1.00 0.00 C ATOM 49785 H3A PC 1220 89.345 35.668 23.947 1.00 0.00 H ATOM 49786 H3B PC 1220 88.047 35.472 25.157 1.00 0.00 H ATOM 49787 H3C PC 1220 89.717 35.544 25.713 1.00 0.00 H ATOM 49788 C34 PC 1220 88.133 37.936 26.102 1.00 0.00 C ATOM 49789 H4A PC 1220 87.271 37.303 26.316 1.00 0.00 H ATOM 49790 H4B PC 1220 87.951 39.001 25.947 1.00 0.00 H ATOM 49791 H4C PC 1220 88.830 37.802 26.931 1.00 0.00 H ATOM 49792 C35 PC 1220 87.903 37.712 23.760 1.00 0.00 C ATOM 49793 H5A PC 1220 87.826 38.800 23.753 1.00 0.00 H ATOM 49794 H5B PC 1220 87.000 37.128 23.946 1.00 0.00 H ATOM 49795 H5C PC 1220 88.307 37.311 22.829 1.00 0.00 H ATOM 49796 O33 PC 1220 94.548 39.824 25.306 1.00 0.00 O ATOM 49797 O34 PC 1220 94.393 37.382 25.839 1.00 0.00 O ATOM 49798 O21 PC 1220 93.569 40.469 30.078 1.00 0.00 O ATOM 49799 C21 PC 1220 94.175 41.627 30.255 1.00 0.00 C ATOM 49800 O22 PC 1220 94.146 42.564 29.471 1.00 0.00 O ATOM 49801 C12 OL 1221 95.066 41.664 31.462 1.00 0.00 C ATOM 49802 H2R OL 1221 94.683 40.965 32.208 1.00 0.00 H ATOM 49803 H2S OL 1221 96.051 41.372 31.092 1.00 0.00 H ATOM 49804 C13 OL 1221 95.156 43.121 32.089 1.00 0.00 C ATOM 49805 H3R OL 1221 95.737 43.751 31.412 1.00 0.00 H ATOM 49806 H3S OL 1221 94.112 43.439 32.062 1.00 0.00 H ATOM 49807 C14 OL 1221 95.808 43.183 33.428 1.00 0.00 C ATOM 49808 H4R OL 1221 96.824 42.848 33.207 1.00 0.00 H ATOM 49809 H4S OL 1221 95.826 44.213 33.790 1.00 0.00 H ATOM 49810 C15 OL 1221 95.273 42.197 34.497 1.00 0.00 C ATOM 49811 H5R OL 1221 95.054 41.173 34.188 1.00 0.00 H ATOM 49812 H5S OL 1221 96.033 42.086 35.273 1.00 0.00 H ATOM 49813 C16 OL 1221 93.974 42.645 35.148 1.00 0.00 C ATOM 49814 H6R OL 1221 94.285 43.347 35.924 1.00 0.00 H ATOM 49815 H6S OL 1221 93.494 43.322 34.439 1.00 0.00 H ATOM 49816 C17 OL 1221 93.105 41.551 35.608 1.00 0.00 C ATOM 49817 H7R OL 1221 92.224 42.007 36.065 1.00 0.00 H ATOM 49818 H7S OL 1221 92.742 40.792 34.912 1.00 0.00 H ATOM 49819 C18 OL 1221 93.864 40.692 36.717 1.00 0.00 C ATOM 49820 H8R OL 1221 94.813 40.391 36.269 1.00 0.00 H ATOM 49821 H8S OL 1221 94.192 41.234 37.606 1.00 0.00 H ATOM 49822 C19 OL 1221 93.090 39.491 37.199 1.00 0.00 C ATOM 49823 H9R OL 1221 93.514 38.563 36.824 1.00 0.00 H ATOM 49824 C110 OL 1221 92.113 39.437 38.082 1.00 0.00 C ATOM 49825 H10R OL 1221 91.653 38.528 38.463 1.00 0.00 H ATOM 49826 C111 OL 1221 91.546 40.754 38.655 1.00 0.00 C ATOM 49827 H11R OL 1221 91.387 41.481 37.856 1.00 0.00 H ATOM 49828 H11S OL 1221 90.500 40.620 38.939 1.00 0.00 H ATOM 49829 C112 OL 1221 92.323 41.199 39.971 1.00 0.00 C ATOM 49830 H12R OL 1221 91.974 40.492 40.727 1.00 0.00 H ATOM 49831 H12S OL 1221 93.401 41.066 39.857 1.00 0.00 H ATOM 49832 C113 OL 1221 92.168 42.689 40.406 1.00 0.00 C ATOM 49833 H13R OL 1221 92.475 43.376 39.614 1.00 0.00 H ATOM 49834 H13S OL 1221 91.164 43.000 40.702 1.00 0.00 H ATOM 49835 C114 OL 1221 93.034 43.117 41.659 1.00 0.00 C ATOM 49836 H14R OL 1221 92.768 42.403 42.441 1.00 0.00 H ATOM 49837 H14S OL 1221 94.119 43.009 41.606 1.00 0.00 H ATOM 49838 C115 OL 1221 92.624 44.539 42.061 1.00 0.00 C ATOM 49839 H15R OL 1221 92.581 45.173 41.172 1.00 0.00 H ATOM 49840 H15S OL 1221 91.603 44.571 42.445 1.00 0.00 H ATOM 49841 C116 OL 1221 93.519 45.019 43.239 1.00 0.00 C ATOM 49842 H16R OL 1221 93.649 44.182 43.928 1.00 0.00 H ATOM 49843 H16S OL 1221 94.529 45.190 42.862 1.00 0.00 H ATOM 49844 C117 OL 1221 93.025 46.241 44.043 1.00 0.00 C ATOM 49845 H17R OL 1221 92.161 45.995 44.664 1.00 0.00 H ATOM 49846 H17S OL 1221 93.887 46.327 44.707 1.00 0.00 H ATOM 49847 C118 OL 1221 92.956 47.643 43.343 1.00 0.00 C ATOM 49848 H18R OL 1221 92.575 48.427 44.000 1.00 0.00 H ATOM 49849 H18S OL 1221 92.407 47.680 42.400 1.00 0.00 H ATOM 49850 H18T OL 1221 93.964 48.001 43.124 1.00 0.00 H TER 49851 OL 1221 ATOM 49851 C116 PA 1222 151.289 34.898 37.450 1.00 0.00 C ATOM 49852 H16R PA 1222 151.159 33.836 37.230 1.00 0.00 H ATOM 49853 H16S PA 1222 150.662 35.070 38.328 1.00 0.00 H ATOM 49854 H16T PA 1222 152.209 35.234 37.933 1.00 0.00 H ATOM 49855 C115 PA 1222 151.020 35.796 36.202 1.00 0.00 C ATOM 49856 H15R PA 1222 150.933 36.870 36.375 1.00 0.00 H ATOM 49857 H15S PA 1222 150.059 35.325 35.985 1.00 0.00 H ATOM 49858 C114 PA 1222 151.867 35.476 34.963 1.00 0.00 C ATOM 49859 H14R PA 1222 152.183 34.432 34.898 1.00 0.00 H ATOM 49860 H14S PA 1222 152.754 36.112 34.949 1.00 0.00 H ATOM 49861 C113 PA 1222 151.144 35.589 33.651 1.00 0.00 C ATOM 49862 H13R PA 1222 150.628 36.545 33.535 1.00 0.00 H ATOM 49863 H13S PA 1222 150.344 34.860 33.796 1.00 0.00 H ATOM 49864 C112 PA 1222 151.890 35.174 32.408 1.00 0.00 C ATOM 49865 H12R PA 1222 152.179 34.121 32.431 1.00 0.00 H ATOM 49866 H12S PA 1222 152.858 35.674 32.480 1.00 0.00 H ATOM 49867 C111 PA 1222 151.214 35.521 31.099 1.00 0.00 C ATOM 49868 H11R PA 1222 151.991 35.512 30.331 1.00 0.00 H ATOM 49869 H11S PA 1222 150.897 36.559 31.221 1.00 0.00 H ATOM 49870 C110 PA 1222 149.963 34.687 30.698 1.00 0.00 C ATOM 49871 H10R PA 1222 149.299 34.662 31.565 1.00 0.00 H ATOM 49872 H10S PA 1222 150.311 33.659 30.579 1.00 0.00 H ATOM 49873 C19 PA 1222 149.250 35.272 29.550 1.00 0.00 C ATOM 49874 H9R PA 1222 148.487 34.526 29.318 1.00 0.00 H ATOM 49875 H9S PA 1222 149.956 35.412 28.730 1.00 0.00 H ATOM 49876 C18 PA 1222 148.631 36.645 29.700 1.00 0.00 C ATOM 49877 H8R PA 1222 149.228 37.312 30.325 1.00 0.00 H ATOM 49878 H8S PA 1222 147.629 36.504 30.111 1.00 0.00 H ATOM 49879 C17 PA 1222 148.445 37.264 28.321 1.00 0.00 C ATOM 49880 H7R PA 1222 148.535 36.386 27.677 1.00 0.00 H ATOM 49881 H7S PA 1222 149.132 38.062 28.030 1.00 0.00 H ATOM 49882 C16 PA 1222 147.014 37.736 27.994 1.00 0.00 C ATOM 49883 H6R PA 1222 146.972 38.587 28.677 1.00 0.00 H ATOM 49884 H6S PA 1222 146.276 36.998 28.313 1.00 0.00 H ATOM 49885 C15 PA 1222 146.754 38.251 26.595 1.00 0.00 C ATOM 49886 H5R PA 1222 147.496 37.750 25.970 1.00 0.00 H ATOM 49887 H5S PA 1222 146.883 39.333 26.519 1.00 0.00 H ATOM 49888 C14 PA 1222 145.380 37.836 26.003 1.00 0.00 C ATOM 49889 H4R PA 1222 144.492 38.193 26.529 1.00 0.00 H ATOM 49890 H4S PA 1222 145.276 36.754 25.898 1.00 0.00 H ATOM 49891 C13 PA 1222 145.158 38.315 24.558 1.00 0.00 C ATOM 49892 H3R PA 1222 144.240 37.771 24.323 1.00 0.00 H ATOM 49893 H3S PA 1222 145.866 37.826 23.886 1.00 0.00 H ATOM 49894 C12 PA 1222 144.929 39.814 24.375 1.00 0.00 C ATOM 49895 H2R PA 1222 145.918 40.257 24.512 1.00 0.00 H ATOM 49896 H2S PA 1222 144.151 40.104 25.085 1.00 0.00 H ATOM 49897 C11 PGR 1223 144.535 40.161 22.931 1.00 0.00 C ATOM 49898 O12 PGR 1223 144.806 41.139 22.323 1.00 0.00 O ATOM 49899 O11 PGR 1223 143.639 39.269 22.439 1.00 0.00 O ATOM 49900 C1 PGR 1223 142.782 39.667 21.281 1.00 0.00 C ATOM 49901 HR PGR 1223 142.375 38.800 20.754 1.00 0.00 H ATOM 49902 HS PGR 1223 143.307 40.310 20.570 1.00 0.00 H ATOM 49903 C2 PGR 1223 141.591 40.452 21.870 1.00 0.00 C ATOM 49904 HX PGR 1223 141.066 39.863 22.626 1.00 0.00 H ATOM 49905 C3 PGR 1223 140.661 40.941 20.667 1.00 0.00 C ATOM 49906 HA PGR 1223 139.983 41.709 21.046 1.00 0.00 H ATOM 49907 HB PGR 1223 140.093 40.084 20.297 1.00 0.00 H ATOM 49908 O31 PGR 1223 141.414 41.437 19.580 1.00 0.00 O ATOM 49909 P31 PGR 1223 140.675 41.823 18.236 1.00 0.00 P ATOM 49910 O32 PGR 1223 140.123 40.412 17.687 1.00 0.00 O ATOM 49911 C31 PGR 1223 140.907 39.698 16.728 1.00 0.00 C ATOM 49912 H1A PGR 1223 141.935 39.711 17.099 1.00 0.00 H ATOM 49913 H1B PGR 1223 140.889 40.314 15.825 1.00 0.00 H ATOM 49914 C32 PGR 1223 140.392 38.248 16.432 1.00 0.00 C ATOM 49915 H2A PGR 1223 140.989 37.821 15.622 1.00 0.00 H ATOM 49916 O35 PGR 1223 139.055 38.458 15.954 1.00 0.00 O ATOM 49917 HO5A PGR 1223 138.573 38.879 16.688 1.00 0.00 H ATOM 49918 C33 PGR 1223 140.438 37.281 17.663 1.00 0.00 C ATOM 49919 H3A PGR 1223 141.478 37.079 17.931 1.00 0.00 H ATOM 49920 H3B PGR 1223 139.996 37.768 18.535 1.00 0.00 H ATOM 49921 O33 PGR 1223 139.487 42.569 18.608 1.00 0.00 O ATOM 49922 O34 PGR 1223 141.587 42.332 17.239 1.00 0.00 O ATOM 49923 O21 PGR 1223 142.188 41.612 22.502 1.00 0.00 O ATOM 49924 C21 PGR 1223 141.312 42.445 23.117 1.00 0.00 C ATOM 49925 O22 PGR 1223 140.171 42.156 23.523 1.00 0.00 O ATOM 49926 O36 PGR 1223 139.677 36.069 17.258 1.00 0.00 O ATOM 49927 HO6A PGR 1223 138.774 36.320 16.995 1.00 0.00 H ATOM 49928 C12 OL 1224 141.964 43.750 23.413 1.00 0.00 C ATOM 49929 H2R OL 1224 142.846 43.881 22.784 1.00 0.00 H ATOM 49930 H2S OL 1224 141.266 44.570 23.228 1.00 0.00 H ATOM 49931 C13 OL 1224 142.471 43.902 24.841 1.00 0.00 C ATOM 49932 H3R OL 1224 141.616 44.288 25.401 1.00 0.00 H ATOM 49933 H3S OL 1224 142.618 42.886 25.214 1.00 0.00 H ATOM 49934 C14 OL 1224 143.610 44.901 24.994 1.00 0.00 C ATOM 49935 H4R OL 1224 144.568 44.632 24.544 1.00 0.00 H ATOM 49936 H4S OL 1224 143.342 45.771 24.391 1.00 0.00 H ATOM 49937 C15 OL 1224 143.752 45.212 26.477 1.00 0.00 C ATOM 49938 H5R OL 1224 142.791 45.491 26.916 1.00 0.00 H ATOM 49939 H5S OL 1224 143.987 44.314 27.053 1.00 0.00 H ATOM 49940 C16 OL 1224 144.504 46.472 26.734 1.00 0.00 C ATOM 49941 H6R OL 1224 145.479 46.338 26.262 1.00 0.00 H ATOM 49942 H6S OL 1224 144.038 47.338 26.259 1.00 0.00 H ATOM 49943 C17 OL 1224 144.771 46.873 28.234 1.00 0.00 C ATOM 49944 H7R OL 1224 143.897 47.399 28.624 1.00 0.00 H ATOM 49945 H7S OL 1224 144.913 45.935 28.775 1.00 0.00 H ATOM 49946 C18 OL 1224 145.922 47.773 28.506 1.00 0.00 C ATOM 49947 H8R OL 1224 146.872 47.281 28.288 1.00 0.00 H ATOM 49948 H8S OL 1224 145.941 48.701 27.930 1.00 0.00 H ATOM 49949 C19 OL 1224 145.832 48.212 29.925 1.00 0.00 C ATOM 49950 H9R OL 1224 145.297 49.143 30.094 1.00 0.00 H ATOM 49951 C110 OL 1224 146.472 47.664 30.911 1.00 0.00 C ATOM 49952 H10R OL 1224 146.494 48.245 31.829 1.00 0.00 H ATOM 49953 C111 OL 1224 147.345 46.423 30.990 1.00 0.00 C ATOM 49954 H11R OL 1224 147.418 45.911 30.029 1.00 0.00 H ATOM 49955 H11S OL 1224 148.370 46.749 31.181 1.00 0.00 H ATOM 49956 C112 OL 1224 147.066 45.385 32.083 1.00 0.00 C ATOM 49957 H12R OL 1224 146.136 44.889 31.796 1.00 0.00 H ATOM 49958 H12S OL 1224 147.902 44.710 31.889 1.00 0.00 H ATOM 49959 C113 OL 1224 147.126 45.876 33.541 1.00 0.00 C ATOM 49960 H13R OL 1224 148.132 46.183 33.835 1.00 0.00 H ATOM 49961 H13S OL 1224 146.393 46.625 33.848 1.00 0.00 H ATOM 49962 C114 OL 1224 146.746 44.685 34.520 1.00 0.00 C ATOM 49963 H14R OL 1224 145.791 44.224 34.258 1.00 0.00 H ATOM 49964 H14S OL 1224 147.525 43.939 34.351 1.00 0.00 H ATOM 49965 C115 OL 1224 146.704 45.134 35.995 1.00 0.00 C ATOM 49966 H15R OL 1224 146.829 44.276 36.660 1.00 0.00 H ATOM 49967 H15S OL 1224 147.673 45.578 36.236 1.00 0.00 H ATOM 49968 C116 OL 1224 145.609 46.090 36.502 1.00 0.00 C ATOM 49969 H16R OL 1224 145.316 46.834 35.758 1.00 0.00 H ATOM 49970 H16S OL 1224 144.727 45.448 36.527 1.00 0.00 H ATOM 49971 C117 OL 1224 145.829 46.607 37.860 1.00 0.00 C ATOM 49972 H17R OL 1224 146.320 45.880 38.510 1.00 0.00 H ATOM 49973 H17S OL 1224 146.313 47.584 37.919 1.00 0.00 H ATOM 49974 C118 OL 1224 144.541 46.756 38.623 1.00 0.00 C ATOM 49975 H18R OL 1224 144.828 46.999 39.648 1.00 0.00 H ATOM 49976 H18S OL 1224 144.100 45.782 38.843 1.00 0.00 H ATOM 49977 H18T OL 1224 143.752 47.428 38.275 1.00 0.00 H TER 49978 OL 1224 ATOM 49978 C116 PA 1225 47.328 69.547 39.085 1.00 0.00 C ATOM 49979 H16R PA 1225 47.904 70.418 39.407 1.00 0.00 H ATOM 49980 H16S PA 1225 46.571 70.020 38.457 1.00 0.00 H ATOM 49981 H16T PA 1225 47.877 69.042 38.286 1.00 0.00 H ATOM 49982 C115 PA 1225 46.845 68.520 40.114 1.00 0.00 C ATOM 49983 H15R PA 1225 46.452 69.115 40.941 1.00 0.00 H ATOM 49984 H15S PA 1225 47.682 67.959 40.537 1.00 0.00 H ATOM 49985 C114 PA 1225 45.907 67.466 39.511 1.00 0.00 C ATOM 49986 H14R PA 1225 45.531 66.785 40.277 1.00 0.00 H ATOM 49987 H14S PA 1225 46.495 66.974 38.733 1.00 0.00 H ATOM 49988 C113 PA 1225 44.565 67.864 38.874 1.00 0.00 C ATOM 49989 H13R PA 1225 44.790 68.659 38.160 1.00 0.00 H ATOM 49990 H13S PA 1225 43.941 68.365 39.617 1.00 0.00 H ATOM 49991 C112 PA 1225 43.730 66.715 38.355 1.00 0.00 C ATOM 49992 H12R PA 1225 43.753 65.830 38.995 1.00 0.00 H ATOM 49993 H12S PA 1225 44.176 66.394 37.411 1.00 0.00 H ATOM 49994 C111 PA 1225 42.254 67.120 38.108 1.00 0.00 C ATOM 49995 H11R PA 1225 42.089 68.141 37.759 1.00 0.00 H ATOM 49996 H11S PA 1225 41.739 67.159 39.070 1.00 0.00 H ATOM 49997 C110 PA 1225 41.389 66.229 37.174 1.00 0.00 C ATOM 49998 H10R PA 1225 40.397 66.664 37.037 1.00 0.00 H ATOM 49999 H10S PA 1225 41.159 65.272 37.647 1.00 0.00 H ATOM 50000 C19 PA 1225 42.007 66.032 35.738 1.00 0.00 C ATOM 50001 H9R PA 1225 43.036 65.721 35.928 1.00 0.00 H ATOM 50002 H9S PA 1225 42.082 67.004 35.247 1.00 0.00 H ATOM 50003 C18 PA 1225 41.274 65.073 34.912 1.00 0.00 C ATOM 50004 H8R PA 1225 41.802 64.976 33.962 1.00 0.00 H ATOM 50005 H8S PA 1225 40.336 65.500 34.552 1.00 0.00 H ATOM 50006 C17 PA 1225 41.125 63.671 35.425 1.00 0.00 C ATOM 50007 H7R PA 1225 40.810 63.601 36.468 1.00 0.00 H ATOM 50008 H7S PA 1225 42.021 63.057 35.316 1.00 0.00 H ATOM 50009 C16 PA 1225 40.206 62.796 34.505 1.00 0.00 C ATOM 50010 H6R PA 1225 40.517 62.808 33.459 1.00 0.00 H ATOM 50011 H6S PA 1225 39.255 63.332 34.532 1.00 0.00 H ATOM 50012 C15 PA 1225 40.065 61.349 35.039 1.00 0.00 C ATOM 50013 H5R PA 1225 39.303 60.910 34.392 1.00 0.00 H ATOM 50014 H5S PA 1225 39.571 61.277 36.010 1.00 0.00 H ATOM 50015 C14 PA 1225 41.256 60.373 34.974 1.00 0.00 C ATOM 50016 H4R PA 1225 40.885 59.354 35.103 1.00 0.00 H ATOM 50017 H4S PA 1225 41.792 60.663 35.880 1.00 0.00 H ATOM 50018 C13 PA 1225 42.106 60.216 33.736 1.00 0.00 C ATOM 50019 H3R PA 1225 42.820 59.426 33.977 1.00 0.00 H ATOM 50020 H3S PA 1225 42.698 61.120 33.580 1.00 0.00 H ATOM 50021 C12 PA 1225 41.387 59.862 32.365 1.00 0.00 C ATOM 50022 H2R PA 1225 41.040 60.713 31.777 1.00 0.00 H ATOM 50023 H2S PA 1225 40.551 59.201 32.605 1.00 0.00 H ATOM 50024 C11 PC 1226 42.332 59.137 31.469 1.00 0.00 C ATOM 50025 O12 PC 1226 42.728 58.036 31.718 1.00 0.00 O ATOM 50026 O11 PC 1226 42.665 59.761 30.288 1.00 0.00 O ATOM 50027 C1 PC 1226 43.600 59.092 29.427 1.00 0.00 C ATOM 50028 HR PC 1226 43.394 59.633 28.500 1.00 0.00 H ATOM 50029 HS PC 1226 43.223 58.066 29.426 1.00 0.00 H ATOM 50030 C2 PC 1226 45.085 59.266 29.746 1.00 0.00 C ATOM 50031 HX PC 1226 45.188 60.272 30.159 1.00 0.00 H ATOM 50032 C3 PC 1226 46.030 58.985 28.571 1.00 0.00 C ATOM 50033 HA PC 1226 47.029 58.976 29.012 1.00 0.00 H ATOM 50034 HB PC 1226 45.959 59.745 27.789 1.00 0.00 H ATOM 50035 O31 PC 1226 45.847 57.638 28.041 1.00 0.00 O ATOM 50036 P31 PC 1226 46.862 57.138 26.935 1.00 0.00 P ATOM 50037 O32 PC 1226 46.767 58.283 25.889 1.00 0.00 O ATOM 50038 C31 PC 1226 45.826 58.181 24.888 1.00 0.00 C ATOM 50039 H1A PC 1226 44.863 57.813 25.251 1.00 0.00 H ATOM 50040 H1B PC 1226 46.150 57.491 24.105 1.00 0.00 H ATOM 50041 C32 PC 1226 45.669 59.511 24.206 1.00 0.00 C ATOM 50042 H2A PC 1226 46.482 59.553 23.479 1.00 0.00 H ATOM 50043 H2B PC 1226 45.759 60.336 24.914 1.00 0.00 H ATOM 50044 N31 PC 1226 44.373 59.668 23.464 1.00 0.00 N ATOM 50045 C33 PC 1226 44.227 58.580 22.409 1.00 0.00 C ATOM 50046 H3A PC 1226 43.351 58.818 21.803 1.00 0.00 H ATOM 50047 H3B PC 1226 44.117 57.575 22.820 1.00 0.00 H ATOM 50048 H3C PC 1226 45.027 58.605 21.667 1.00 0.00 H ATOM 50049 C34 PC 1226 43.178 59.657 24.354 1.00 0.00 C ATOM 50050 H4A PC 1226 43.324 60.240 25.265 1.00 0.00 H ATOM 50051 H4B PC 1226 43.012 58.582 24.438 1.00 0.00 H ATOM 50052 H4C PC 1226 42.401 60.137 23.758 1.00 0.00 H ATOM 50053 C35 PC 1226 44.356 60.950 22.718 1.00 0.00 C ATOM 50054 H5A PC 1226 43.527 61.104 22.026 1.00 0.00 H ATOM 50055 H5B PC 1226 45.327 61.028 22.228 1.00 0.00 H ATOM 50056 H5C PC 1226 44.331 61.772 23.436 1.00 0.00 H ATOM 50057 O33 PC 1226 48.246 57.184 27.400 1.00 0.00 O ATOM 50058 O34 PC 1226 46.325 55.846 26.333 1.00 0.00 O ATOM 50059 O21 PC 1226 45.420 58.497 30.903 1.00 0.00 O ATOM 50060 C21 PC 1226 46.472 58.864 31.595 1.00 0.00 C ATOM 50061 O22 PC 1226 47.062 59.929 31.413 1.00 0.00 O ATOM 50062 C12 OL 1227 46.633 58.043 32.834 1.00 0.00 C ATOM 50063 H2R OL 1227 46.381 56.997 32.649 1.00 0.00 H ATOM 50064 H2S OL 1227 47.678 58.121 33.138 1.00 0.00 H ATOM 50065 C13 OL 1227 45.748 58.579 33.916 1.00 0.00 C ATOM 50066 H3R OL 1227 45.740 59.670 33.976 1.00 0.00 H ATOM 50067 H3S OL 1227 44.724 58.221 33.795 1.00 0.00 H ATOM 50068 C14 OL 1227 46.122 58.035 35.295 1.00 0.00 C ATOM 50069 H4R OL 1227 45.291 58.213 35.981 1.00 0.00 H ATOM 50070 H4S OL 1227 46.289 56.958 35.227 1.00 0.00 H ATOM 50071 C15 OL 1227 47.433 58.561 36.016 1.00 0.00 C ATOM 50072 H5R OL 1227 48.233 57.885 35.705 1.00 0.00 H ATOM 50073 H5S OL 1227 47.613 59.591 35.702 1.00 0.00 H ATOM 50074 C16 OL 1227 47.437 58.390 37.504 1.00 0.00 C ATOM 50075 H6R OL 1227 47.184 57.372 37.806 1.00 0.00 H ATOM 50076 H6S OL 1227 48.408 58.522 37.987 1.00 0.00 H ATOM 50077 C17 OL 1227 46.392 59.218 38.255 1.00 0.00 C ATOM 50078 H7R OL 1227 46.470 60.295 38.091 1.00 0.00 H ATOM 50079 H7S OL 1227 45.391 58.941 37.920 1.00 0.00 H ATOM 50080 C18 OL 1227 46.430 59.007 39.763 1.00 0.00 C ATOM 50081 H8R OL 1227 46.383 57.957 40.058 1.00 0.00 H ATOM 50082 H8S OL 1227 47.452 59.199 40.098 1.00 0.00 H ATOM 50083 C19 OL 1227 45.397 59.867 40.399 1.00 0.00 C ATOM 50084 H9R OL 1227 45.460 60.930 40.179 1.00 0.00 H ATOM 50085 C110 OL 1227 44.402 59.482 41.174 1.00 0.00 C ATOM 50086 H10R OL 1227 43.693 60.227 41.526 1.00 0.00 H ATOM 50087 C111 OL 1227 44.119 58.122 41.706 1.00 0.00 C ATOM 50088 H11R OL 1227 45.003 57.482 41.659 1.00 0.00 H ATOM 50089 H11S OL 1227 43.896 58.195 42.772 1.00 0.00 H ATOM 50090 C112 OL 1227 42.993 57.458 40.937 1.00 0.00 C ATOM 50091 H12R OL 1227 42.103 58.089 40.982 1.00 0.00 H ATOM 50092 H12S OL 1227 43.161 57.457 39.858 1.00 0.00 H ATOM 50093 C113 OL 1227 42.829 56.030 41.380 1.00 0.00 C ATOM 50094 H13R OL 1227 43.784 55.502 41.337 1.00 0.00 H ATOM 50095 H13S OL 1227 42.457 55.962 42.404 1.00 0.00 H ATOM 50096 C114 OL 1227 41.782 55.400 40.462 1.00 0.00 C ATOM 50097 H14R OL 1227 40.966 56.113 40.335 1.00 0.00 H ATOM 50098 H14S OL 1227 42.222 55.399 39.463 1.00 0.00 H ATOM 50099 C115 OL 1227 41.305 54.027 40.801 1.00 0.00 C ATOM 50100 H15R OL 1227 42.073 53.275 40.992 1.00 0.00 H ATOM 50101 H15S OL 1227 40.939 54.077 41.828 1.00 0.00 H ATOM 50102 C116 OL 1227 40.266 53.435 39.887 1.00 0.00 C ATOM 50103 H16R OL 1227 39.583 54.285 39.832 1.00 0.00 H ATOM 50104 H16S OL 1227 40.665 53.253 38.887 1.00 0.00 H ATOM 50105 C117 OL 1227 39.480 52.214 40.397 1.00 0.00 C ATOM 50106 H17R OL 1227 40.187 51.390 40.512 1.00 0.00 H ATOM 50107 H17S OL 1227 39.120 52.317 41.423 1.00 0.00 H ATOM 50108 C118 OL 1227 38.204 51.917 39.529 1.00 0.00 C ATOM 50109 H18R OL 1227 38.491 51.748 38.489 1.00 0.00 H ATOM 50110 H18S OL 1227 37.573 52.805 39.452 1.00 0.00 H ATOM 50111 H18T OL 1227 37.703 50.991 39.817 1.00 0.00 H TER 50112 OL 1227 ATOM 50112 C116 PA 1228 83.072 99.719 37.612 1.00 0.00 C ATOM 50113 H16R PA 1228 83.950 99.725 36.963 1.00 0.00 H ATOM 50114 H16S PA 1228 82.267 99.233 37.058 1.00 0.00 H ATOM 50115 H16T PA 1228 83.253 99.083 38.481 1.00 0.00 H ATOM 50116 C115 PA 1228 82.644 101.146 38.092 1.00 0.00 C ATOM 50117 H15R PA 1228 83.234 101.484 38.947 1.00 0.00 H ATOM 50118 H15S PA 1228 81.624 101.105 38.480 1.00 0.00 H ATOM 50119 C114 PA 1228 82.556 102.202 37.004 1.00 0.00 C ATOM 50120 H14R PA 1228 82.012 101.723 36.188 1.00 0.00 H ATOM 50121 H14S PA 1228 83.588 102.344 36.678 1.00 0.00 H ATOM 50122 C113 PA 1228 81.992 103.607 37.358 1.00 0.00 C ATOM 50123 H13R PA 1228 82.585 104.182 38.073 1.00 0.00 H ATOM 50124 H13S PA 1228 81.103 103.283 37.902 1.00 0.00 H ATOM 50125 C112 PA 1228 81.337 104.426 36.268 1.00 0.00 C ATOM 50126 H12R PA 1228 80.504 103.864 35.840 1.00 0.00 H ATOM 50127 H12S PA 1228 81.987 104.458 35.391 1.00 0.00 H ATOM 50128 C111 PA 1228 80.843 105.714 36.783 1.00 0.00 C ATOM 50129 H11R PA 1228 81.632 106.164 37.390 1.00 0.00 H ATOM 50130 H11S PA 1228 80.036 105.427 37.458 1.00 0.00 H ATOM 50131 C110 PA 1228 80.418 106.772 35.785 1.00 0.00 C ATOM 50132 H10R PA 1228 81.205 107.529 35.770 1.00 0.00 H ATOM 50133 H10S PA 1228 79.540 107.307 36.154 1.00 0.00 H ATOM 50134 C19 PA 1228 80.037 106.341 34.341 1.00 0.00 C ATOM 50135 H9R PA 1228 79.328 105.515 34.429 1.00 0.00 H ATOM 50136 H9S PA 1228 80.943 106.010 33.829 1.00 0.00 H ATOM 50137 C18 PA 1228 79.453 107.462 33.552 1.00 0.00 C ATOM 50138 H8R PA 1228 80.183 108.269 33.463 1.00 0.00 H ATOM 50139 H8S PA 1228 78.671 107.974 34.116 1.00 0.00 H ATOM 50140 C17 PA 1228 78.723 106.970 32.256 1.00 0.00 C ATOM 50141 H7R PA 1228 77.888 106.304 32.483 1.00 0.00 H ATOM 50142 H7S PA 1228 79.382 106.327 31.669 1.00 0.00 H ATOM 50143 C16 PA 1228 78.265 108.111 31.273 1.00 0.00 C ATOM 50144 H6R PA 1228 77.546 108.795 31.728 1.00 0.00 H ATOM 50145 H6S PA 1228 77.610 107.691 30.507 1.00 0.00 H ATOM 50146 C15 PA 1228 79.348 108.895 30.565 1.00 0.00 C ATOM 50147 H5R PA 1228 79.963 108.228 29.956 1.00 0.00 H ATOM 50148 H5S PA 1228 79.975 109.243 31.388 1.00 0.00 H ATOM 50149 C14 PA 1228 78.870 110.126 29.751 1.00 0.00 C ATOM 50150 H4R PA 1228 78.065 110.693 30.223 1.00 0.00 H ATOM 50151 H4S PA 1228 78.443 109.706 28.837 1.00 0.00 H ATOM 50152 C13 PA 1228 79.905 111.129 29.416 1.00 0.00 C ATOM 50153 H3R PA 1228 80.795 110.706 28.946 1.00 0.00 H ATOM 50154 H3S PA 1228 80.413 111.533 30.294 1.00 0.00 H ATOM 50155 C12 PA 1228 79.340 112.350 28.639 1.00 0.00 C ATOM 50156 H2R PA 1228 78.621 112.952 29.199 1.00 0.00 H ATOM 50157 H2S PA 1228 80.232 112.951 28.451 1.00 0.00 H ATOM 50158 C11 PGR 1229 78.663 111.851 27.344 1.00 0.00 C ATOM 50159 O12 PGR 1229 79.264 111.520 26.337 1.00 0.00 O ATOM 50160 O11 PGR 1229 77.289 111.791 27.483 1.00 0.00 O ATOM 50161 C1 PGR 1229 76.448 111.404 26.350 1.00 0.00 C ATOM 50162 HR PGR 1229 76.823 111.933 25.471 1.00 0.00 H ATOM 50163 HS PGR 1229 75.429 111.694 26.618 1.00 0.00 H ATOM 50164 C2 PGR 1229 76.475 109.864 26.107 1.00 0.00 C ATOM 50165 HX PGR 1229 77.515 109.537 26.028 1.00 0.00 H ATOM 50166 C3 PGR 1229 75.770 109.454 24.770 1.00 0.00 C ATOM 50167 HA PGR 1229 75.440 108.424 24.929 1.00 0.00 H ATOM 50168 HB PGR 1229 76.497 109.529 23.957 1.00 0.00 H ATOM 50169 O31 PGR 1229 74.630 110.252 24.514 1.00 0.00 O ATOM 50170 P31 PGR 1229 73.966 110.190 23.094 1.00 0.00 P ATOM 50171 O32 PGR 1229 75.022 110.599 22.024 1.00 0.00 O ATOM 50172 C31 PGR 1229 75.644 111.942 22.011 1.00 0.00 C ATOM 50173 H1A PGR 1229 76.173 112.142 22.946 1.00 0.00 H ATOM 50174 H1B PGR 1229 74.801 112.626 21.885 1.00 0.00 H ATOM 50175 C32 PGR 1229 76.710 112.050 20.920 1.00 0.00 C ATOM 50176 H2A PGR 1229 76.286 111.574 20.032 1.00 0.00 H ATOM 50177 O35 PGR 1229 77.839 111.281 21.336 1.00 0.00 O ATOM 50178 HO5A PGR 1229 78.413 111.940 21.765 1.00 0.00 H ATOM 50179 C33 PGR 1229 77.162 113.531 20.670 1.00 0.00 C ATOM 50180 H3A PGR 1229 77.840 113.545 19.813 1.00 0.00 H ATOM 50181 H3B PGR 1229 76.278 114.132 20.440 1.00 0.00 H ATOM 50182 O33 PGR 1229 73.595 108.783 22.801 1.00 0.00 O ATOM 50183 O34 PGR 1229 72.848 111.136 23.051 1.00 0.00 O ATOM 50184 O21 PGR 1229 75.796 109.239 27.252 1.00 0.00 O ATOM 50185 C21 PGR 1229 75.898 107.923 27.358 1.00 0.00 C ATOM 50186 O22 PGR 1229 76.841 107.266 26.902 1.00 0.00 O ATOM 50187 O36 PGR 1229 77.777 114.140 21.775 1.00 0.00 O ATOM 50188 HO6A PGR 1229 78.139 115.041 21.699 1.00 0.00 H ATOM 50189 C12 OL 1230 74.787 107.250 28.103 1.00 0.00 C ATOM 50190 H2R OL 1230 73.926 107.908 28.231 1.00 0.00 H ATOM 50191 H2S OL 1230 74.444 106.366 27.561 1.00 0.00 H ATOM 50192 C13 OL 1230 75.192 106.918 29.621 1.00 0.00 C ATOM 50193 H3R OL 1230 76.093 106.308 29.524 1.00 0.00 H ATOM 50194 H3S OL 1230 75.376 107.863 30.136 1.00 0.00 H ATOM 50195 C14 OL 1230 74.136 106.157 30.401 1.00 0.00 C ATOM 50196 H4R OL 1230 73.486 106.936 30.806 1.00 0.00 H ATOM 50197 H4S OL 1230 73.530 105.551 29.725 1.00 0.00 H ATOM 50198 C15 OL 1230 74.661 105.486 31.652 1.00 0.00 C ATOM 50199 H5R OL 1230 73.904 104.728 31.861 1.00 0.00 H ATOM 50200 H5S OL 1230 75.603 104.935 31.612 1.00 0.00 H ATOM 50201 C16 OL 1230 74.604 106.424 32.876 1.00 0.00 C ATOM 50202 H6R OL 1230 75.281 107.262 32.694 1.00 0.00 H ATOM 50203 H6S OL 1230 73.649 106.916 33.074 1.00 0.00 H ATOM 50204 C17 OL 1230 74.939 105.736 34.213 1.00 0.00 C ATOM 50205 H7R OL 1230 74.253 104.926 34.468 1.00 0.00 H ATOM 50206 H7S OL 1230 75.934 105.290 34.280 1.00 0.00 H ATOM 50207 C18 OL 1230 74.740 106.724 35.441 1.00 0.00 C ATOM 50208 H8R OL 1230 75.006 107.727 35.100 1.00 0.00 H ATOM 50209 H8S OL 1230 73.654 106.818 35.512 1.00 0.00 H ATOM 50210 C19 OL 1230 75.330 106.283 36.793 1.00 0.00 C ATOM 50211 H9R OL 1230 74.899 105.344 37.130 1.00 0.00 H ATOM 50212 C110 OL 1230 76.257 106.841 37.620 1.00 0.00 C ATOM 50213 H10R OL 1230 76.578 106.222 38.454 1.00 0.00 H ATOM 50214 C111 OL 1230 76.986 108.189 37.384 1.00 0.00 C ATOM 50215 H11R OL 1230 78.043 107.939 37.266 1.00 0.00 H ATOM 50216 H11S OL 1230 76.683 108.538 36.395 1.00 0.00 H ATOM 50217 C112 OL 1230 76.774 109.177 38.506 1.00 0.00 C ATOM 50218 H12R OL 1230 75.736 109.516 38.504 1.00 0.00 H ATOM 50219 H12S OL 1230 77.043 108.782 39.488 1.00 0.00 H ATOM 50220 C113 OL 1230 77.601 110.496 38.357 1.00 0.00 C ATOM 50221 H13R OL 1230 78.607 110.072 38.353 1.00 0.00 H ATOM 50222 H13S OL 1230 77.402 110.920 37.371 1.00 0.00 H ATOM 50223 C114 OL 1230 77.270 111.496 39.497 1.00 0.00 C ATOM 50224 H14R OL 1230 76.189 111.648 39.502 1.00 0.00 H ATOM 50225 H14S OL 1230 77.529 111.163 40.505 1.00 0.00 H ATOM 50226 C115 OL 1230 77.872 112.904 39.326 1.00 0.00 C ATOM 50227 H15R OL 1230 78.949 112.742 39.395 1.00 0.00 H ATOM 50228 H15S OL 1230 77.501 113.220 38.349 1.00 0.00 H ATOM 50229 C116 OL 1230 77.241 113.868 40.240 1.00 0.00 C ATOM 50230 H16R OL 1230 76.208 114.122 39.996 1.00 0.00 H ATOM 50231 H16S OL 1230 77.328 113.358 41.202 1.00 0.00 H ATOM 50232 C117 OL 1230 78.011 115.118 40.394 1.00 0.00 C ATOM 50233 H17R OL 1230 79.048 114.879 40.638 1.00 0.00 H ATOM 50234 H17S OL 1230 78.026 115.719 39.483 1.00 0.00 H ATOM 50235 C118 OL 1230 77.396 116.031 41.456 1.00 0.00 C ATOM 50236 H18R OL 1230 76.340 116.234 41.269 1.00 0.00 H ATOM 50237 H18S OL 1230 77.903 116.997 41.509 1.00 0.00 H ATOM 50238 H18T OL 1230 77.435 115.570 42.445 1.00 0.00 H TER 50239 OL 1230 ATOM 50239 C116 PA 1231 123.970 55.548 38.661 1.00 0.00 C ATOM 50240 H16R PA 1231 124.358 56.386 38.079 1.00 0.00 H ATOM 50241 H16S PA 1231 124.608 54.670 38.538 1.00 0.00 H ATOM 50242 H16T PA 1231 124.076 55.992 39.653 1.00 0.00 H ATOM 50243 C115 PA 1231 122.491 55.352 38.197 1.00 0.00 C ATOM 50244 H15R PA 1231 121.880 56.188 38.544 1.00 0.00 H ATOM 50245 H15S PA 1231 121.981 54.506 38.662 1.00 0.00 H ATOM 50246 C114 PA 1231 122.247 55.290 36.720 1.00 0.00 C ATOM 50247 H14R PA 1231 122.823 55.959 36.077 1.00 0.00 H ATOM 50248 H14S PA 1231 121.213 55.595 36.547 1.00 0.00 H ATOM 50249 C113 PA 1231 122.507 53.883 36.324 1.00 0.00 C ATOM 50250 H13R PA 1231 121.868 53.185 36.870 1.00 0.00 H ATOM 50251 H13S PA 1231 123.538 53.701 36.634 1.00 0.00 H ATOM 50252 C112 PA 1231 122.464 53.554 34.759 1.00 0.00 C ATOM 50253 H12R PA 1231 123.401 53.743 34.231 1.00 0.00 H ATOM 50254 H12S PA 1231 121.703 54.216 34.340 1.00 0.00 H ATOM 50255 C111 PA 1231 122.146 52.018 34.504 1.00 0.00 C ATOM 50256 H11R PA 1231 121.695 51.745 33.548 1.00 0.00 H ATOM 50257 H11S PA 1231 121.258 51.856 35.119 1.00 0.00 H ATOM 50258 C110 PA 1231 123.177 50.984 35.075 1.00 0.00 C ATOM 50259 H10R PA 1231 122.747 50.015 35.336 1.00 0.00 H ATOM 50260 H10S PA 1231 123.532 51.246 36.074 1.00 0.00 H ATOM 50261 C19 PA 1231 124.417 50.683 34.199 1.00 0.00 C ATOM 50262 H9R PA 1231 125.011 51.544 33.886 1.00 0.00 H ATOM 50263 H9S PA 1231 124.141 50.144 33.290 1.00 0.00 H ATOM 50264 C18 PA 1231 125.354 49.662 34.881 1.00 0.00 C ATOM 50265 H8R PA 1231 124.849 48.862 35.427 1.00 0.00 H ATOM 50266 H8S PA 1231 125.939 50.180 35.645 1.00 0.00 H ATOM 50267 C17 PA 1231 126.278 49.094 33.787 1.00 0.00 C ATOM 50268 H7R PA 1231 126.695 49.935 33.229 1.00 0.00 H ATOM 50269 H7S PA 1231 125.618 48.472 33.179 1.00 0.00 H ATOM 50270 C16 PA 1231 127.455 48.185 34.273 1.00 0.00 C ATOM 50271 H6R PA 1231 126.979 47.288 34.676 1.00 0.00 H ATOM 50272 H6S PA 1231 127.904 48.703 35.123 1.00 0.00 H ATOM 50273 C15 PA 1231 128.370 47.619 33.128 1.00 0.00 C ATOM 50274 H5R PA 1231 127.717 47.272 32.323 1.00 0.00 H ATOM 50275 H5S PA 1231 128.886 46.680 33.339 1.00 0.00 H ATOM 50276 C14 PA 1231 129.353 48.684 32.635 1.00 0.00 C ATOM 50277 H4R PA 1231 130.130 48.809 33.391 1.00 0.00 H ATOM 50278 H4S PA 1231 128.929 49.683 32.515 1.00 0.00 H ATOM 50279 C13 PA 1231 129.944 48.350 31.269 1.00 0.00 C ATOM 50280 H3R PA 1231 129.253 48.230 30.431 1.00 0.00 H ATOM 50281 H3S PA 1231 130.426 47.372 31.330 1.00 0.00 H ATOM 50282 C12 PA 1231 131.024 49.347 30.930 1.00 0.00 C ATOM 50283 H2R PA 1231 130.487 50.282 31.102 1.00 0.00 H ATOM 50284 H2S PA 1231 131.872 49.347 31.618 1.00 0.00 H ATOM 50285 C11 PGR 1232 131.590 49.293 29.556 1.00 0.00 C ATOM 50286 O12 PGR 1232 130.982 48.944 28.541 1.00 0.00 O ATOM 50287 O11 PGR 1232 132.840 49.746 29.542 1.00 0.00 O ATOM 50288 C1 PGR 1232 133.531 49.940 28.262 1.00 0.00 C ATOM 50289 HR PGR 1232 133.304 48.979 27.793 1.00 0.00 H ATOM 50290 HS PGR 1232 134.604 49.939 28.470 1.00 0.00 H ATOM 50291 C2 PGR 1232 132.867 51.125 27.495 1.00 0.00 C ATOM 50292 HX PGR 1232 131.778 51.048 27.549 1.00 0.00 H ATOM 50293 C3 PGR 1232 133.220 51.098 26.014 1.00 0.00 C ATOM 50294 HA PGR 1232 132.952 50.086 25.702 1.00 0.00 H ATOM 50295 HB PGR 1232 134.297 51.257 25.920 1.00 0.00 H ATOM 50296 O31 PGR 1232 132.533 51.953 25.133 1.00 0.00 O ATOM 50297 P31 PGR 1232 132.785 51.960 23.583 1.00 0.00 P ATOM 50298 O32 PGR 1232 134.325 52.269 23.397 1.00 0.00 O ATOM 50299 C31 PGR 1232 134.654 53.608 23.385 1.00 0.00 C ATOM 50300 H1A PGR 1232 134.199 53.916 24.330 1.00 0.00 H ATOM 50301 H1B PGR 1232 134.175 54.119 22.546 1.00 0.00 H ATOM 50302 C32 PGR 1232 136.185 53.794 23.380 1.00 0.00 C ATOM 50303 H2A PGR 1232 136.469 54.838 23.227 1.00 0.00 H ATOM 50304 O35 PGR 1232 136.700 52.928 22.355 1.00 0.00 O ATOM 50305 HO5A PGR 1232 137.638 53.182 22.301 1.00 0.00 H ATOM 50306 C33 PGR 1232 136.690 53.327 24.706 1.00 0.00 C ATOM 50307 H3A PGR 1232 136.523 54.191 25.354 1.00 0.00 H ATOM 50308 H3B PGR 1232 136.212 52.458 25.166 1.00 0.00 H ATOM 50309 O33 PGR 1232 132.516 50.620 23.031 1.00 0.00 O ATOM 50310 O34 PGR 1232 131.959 53.008 22.997 1.00 0.00 O ATOM 50311 O21 PGR 1232 133.176 52.372 28.062 1.00 0.00 O ATOM 50312 C21 PGR 1232 134.389 52.934 28.096 1.00 0.00 C ATOM 50313 O22 PGR 1232 135.382 52.357 27.666 1.00 0.00 O ATOM 50314 O36 PGR 1232 138.182 53.158 24.627 1.00 0.00 O ATOM 50315 HO6A PGR 1232 138.444 52.805 25.496 1.00 0.00 H ATOM 50316 C12 OL 1233 134.420 54.288 28.636 1.00 0.00 C ATOM 50317 H2R OL 1233 135.066 54.975 28.086 1.00 0.00 H ATOM 50318 H2S OL 1233 133.478 54.841 28.634 1.00 0.00 H ATOM 50319 C13 OL 1233 135.040 54.364 30.006 1.00 0.00 C ATOM 50320 H3R OL 1233 134.917 55.398 30.335 1.00 0.00 H ATOM 50321 H3S OL 1233 134.512 53.656 30.648 1.00 0.00 H ATOM 50322 C14 OL 1233 136.496 53.903 30.075 1.00 0.00 C ATOM 50323 H4R OL 1233 136.473 52.815 29.983 1.00 0.00 H ATOM 50324 H4S OL 1233 137.048 54.334 29.237 1.00 0.00 H ATOM 50325 C15 OL 1233 137.160 54.389 31.315 1.00 0.00 C ATOM 50326 H5R OL 1233 138.066 53.781 31.355 1.00 0.00 H ATOM 50327 H5S OL 1233 137.435 55.437 31.187 1.00 0.00 H ATOM 50328 C16 OL 1233 136.444 54.082 32.642 1.00 0.00 C ATOM 50329 H6R OL 1233 135.480 54.595 32.685 1.00 0.00 H ATOM 50330 H6S OL 1233 136.167 53.027 32.682 1.00 0.00 H ATOM 50331 C17 OL 1233 137.266 54.166 33.879 1.00 0.00 C ATOM 50332 H7R OL 1233 138.140 53.552 33.648 1.00 0.00 H ATOM 50333 H7S OL 1233 137.602 55.193 34.033 1.00 0.00 H ATOM 50334 C18 OL 1233 136.420 53.811 35.065 1.00 0.00 C ATOM 50335 H8R OL 1233 135.643 54.560 35.230 1.00 0.00 H ATOM 50336 H8S OL 1233 135.803 52.924 34.907 1.00 0.00 H ATOM 50337 C19 OL 1233 137.329 53.593 36.237 1.00 0.00 C ATOM 50338 H9R OL 1233 137.728 52.582 36.280 1.00 0.00 H ATOM 50339 C110 OL 1233 137.797 54.455 37.122 1.00 0.00 C ATOM 50340 H10R OL 1233 138.379 54.086 37.962 1.00 0.00 H ATOM 50341 C111 OL 1233 137.345 55.888 37.191 1.00 0.00 C ATOM 50342 H11R OL 1233 138.210 56.508 36.947 1.00 0.00 H ATOM 50343 H11S OL 1233 136.558 56.163 36.486 1.00 0.00 H ATOM 50344 C112 OL 1233 137.089 56.186 38.678 1.00 0.00 C ATOM 50345 H12R OL 1233 136.576 55.340 39.138 1.00 0.00 H ATOM 50346 H12S OL 1233 138.066 56.269 39.158 1.00 0.00 H ATOM 50347 C113 OL 1233 136.358 57.430 39.007 1.00 0.00 C ATOM 50348 H13R OL 1233 136.481 58.182 38.225 1.00 0.00 H ATOM 50349 H13S OL 1233 135.316 57.110 38.936 1.00 0.00 H ATOM 50350 C114 OL 1233 136.656 58.066 40.437 1.00 0.00 C ATOM 50351 H14R OL 1233 136.255 57.384 41.190 1.00 0.00 H ATOM 50352 H14S OL 1233 137.687 58.214 40.764 1.00 0.00 H ATOM 50353 C115 OL 1233 136.026 59.418 40.523 1.00 0.00 C ATOM 50354 H15R OL 1233 136.320 60.072 39.699 1.00 0.00 H ATOM 50355 H15S OL 1233 134.961 59.307 40.304 1.00 0.00 H ATOM 50356 C116 OL 1233 136.391 60.212 41.784 1.00 0.00 C ATOM 50357 H16R OL 1233 137.006 59.561 42.410 1.00 0.00 H ATOM 50358 H16S OL 1233 136.911 61.095 41.405 1.00 0.00 H ATOM 50359 C117 OL 1233 135.260 60.687 42.607 1.00 0.00 C ATOM 50360 H17R OL 1233 135.695 61.327 43.377 1.00 0.00 H ATOM 50361 H17S OL 1233 134.764 61.512 42.093 1.00 0.00 H ATOM 50362 C118 OL 1233 134.427 59.616 43.249 1.00 0.00 C ATOM 50363 H18R OL 1233 134.008 58.920 42.520 1.00 0.00 H ATOM 50364 H18S OL 1233 133.557 60.032 43.762 1.00 0.00 H ATOM 50365 H18T OL 1233 134.966 58.976 43.950 1.00 0.00 H TER 50366 OL 1233 ATOM 50366 C116 PA 1234 50.342 12.166 34.682 1.00 0.00 C ATOM 50367 H16R PA 1234 50.917 12.479 35.556 1.00 0.00 H ATOM 50368 H16S PA 1234 50.923 12.074 33.762 1.00 0.00 H ATOM 50369 H16T PA 1234 49.964 11.164 34.892 1.00 0.00 H ATOM 50370 C115 PA 1234 49.222 13.141 34.468 1.00 0.00 C ATOM 50371 H15R PA 1234 48.765 13.256 35.454 1.00 0.00 H ATOM 50372 H15S PA 1234 48.398 12.818 33.829 1.00 0.00 H ATOM 50373 C114 PA 1234 49.698 14.522 33.900 1.00 0.00 C ATOM 50374 H14R PA 1234 50.319 14.296 33.030 1.00 0.00 H ATOM 50375 H14S PA 1234 50.381 14.882 34.672 1.00 0.00 H ATOM 50376 C113 PA 1234 48.598 15.603 33.864 1.00 0.00 C ATOM 50377 H13R PA 1234 47.821 15.319 33.151 1.00 0.00 H ATOM 50378 H13S PA 1234 49.038 16.543 33.525 1.00 0.00 H ATOM 50379 C112 PA 1234 47.899 15.848 35.160 1.00 0.00 C ATOM 50380 H12R PA 1234 48.614 15.777 35.983 1.00 0.00 H ATOM 50381 H12S PA 1234 47.255 14.977 35.301 1.00 0.00 H ATOM 50382 C111 PA 1234 46.827 17.010 35.269 1.00 0.00 C ATOM 50383 H11R PA 1234 47.427 17.918 35.358 1.00 0.00 H ATOM 50384 H11S PA 1234 46.256 16.918 36.196 1.00 0.00 H ATOM 50385 C110 PA 1234 45.840 17.007 34.131 1.00 0.00 C ATOM 50386 H10R PA 1234 45.235 16.106 34.008 1.00 0.00 H ATOM 50387 H10S PA 1234 46.283 17.063 33.134 1.00 0.00 H ATOM 50388 C19 PA 1234 44.841 18.164 34.180 1.00 0.00 C ATOM 50389 H9R PA 1234 44.125 18.049 34.997 1.00 0.00 H ATOM 50390 H9S PA 1234 44.156 17.944 33.359 1.00 0.00 H ATOM 50391 C18 PA 1234 45.273 19.611 34.315 1.00 0.00 C ATOM 50392 H8R PA 1234 46.143 19.680 34.972 1.00 0.00 H ATOM 50393 H8S PA 1234 44.501 20.249 34.750 1.00 0.00 H ATOM 50394 C17 PA 1234 45.731 20.142 32.991 1.00 0.00 C ATOM 50395 H7R PA 1234 46.378 19.433 32.471 1.00 0.00 H ATOM 50396 H7S PA 1234 46.353 21.033 33.101 1.00 0.00 H ATOM 50397 C16 PA 1234 44.565 20.411 32.051 1.00 0.00 C ATOM 50398 H6R PA 1234 43.816 21.070 32.495 1.00 0.00 H ATOM 50399 H6S PA 1234 44.026 19.478 31.876 1.00 0.00 H ATOM 50400 C15 PA 1234 44.875 21.079 30.727 1.00 0.00 C ATOM 50401 H5R PA 1234 45.226 22.099 30.898 1.00 0.00 H ATOM 50402 H5S PA 1234 43.933 21.294 30.217 1.00 0.00 H ATOM 50403 C14 PA 1234 45.700 20.112 29.812 1.00 0.00 C ATOM 50404 H4R PA 1234 45.188 19.148 29.794 1.00 0.00 H ATOM 50405 H4S PA 1234 46.650 19.845 30.280 1.00 0.00 H ATOM 50406 C13 PA 1234 46.074 20.725 28.411 1.00 0.00 C ATOM 50407 H3R PA 1234 46.655 21.647 28.482 1.00 0.00 H ATOM 50408 H3S PA 1234 45.207 20.875 27.765 1.00 0.00 H ATOM 50409 C12 PA 1234 47.040 19.751 27.666 1.00 0.00 C ATOM 50410 H2R PA 1234 46.658 18.732 27.585 1.00 0.00 H ATOM 50411 H2S PA 1234 47.980 19.756 28.222 1.00 0.00 H ATOM 50412 C11 PC 1235 47.536 20.258 26.310 1.00 0.00 C ATOM 50413 O12 PC 1235 47.609 19.582 25.350 1.00 0.00 O ATOM 50414 O11 PC 1235 47.907 21.540 26.331 1.00 0.00 O ATOM 50415 C1 PC 1235 48.194 22.209 25.096 1.00 0.00 C ATOM 50416 HR PC 1235 48.852 21.525 24.553 1.00 0.00 H ATOM 50417 HS PC 1235 48.791 23.114 25.238 1.00 0.00 H ATOM 50418 C2 PC 1235 46.834 22.601 24.433 1.00 0.00 C ATOM 50419 HX PC 1235 46.185 21.723 24.489 1.00 0.00 H ATOM 50420 C3 PC 1235 46.932 22.969 23.022 1.00 0.00 C ATOM 50421 HA PC 1235 47.093 22.054 22.447 1.00 0.00 H ATOM 50422 HB PC 1235 47.595 23.755 22.653 1.00 0.00 H ATOM 50423 O31 PC 1235 45.746 23.517 22.640 1.00 0.00 O ATOM 50424 P31 PC 1235 45.416 23.869 21.137 1.00 0.00 P ATOM 50425 O32 PC 1235 46.222 25.180 20.834 1.00 0.00 O ATOM 50426 C31 PC 1235 46.123 25.923 19.662 1.00 0.00 C ATOM 50427 H1A PC 1235 45.222 26.532 19.552 1.00 0.00 H ATOM 50428 H1B PC 1235 46.238 25.188 18.860 1.00 0.00 H ATOM 50429 C32 PC 1235 47.230 26.940 19.618 1.00 0.00 C ATOM 50430 H2A PC 1235 48.132 26.467 20.009 1.00 0.00 H ATOM 50431 H2B PC 1235 47.011 27.715 20.355 1.00 0.00 H ATOM 50432 N31 PC 1235 47.606 27.438 18.284 1.00 0.00 N ATOM 50433 C33 PC 1235 47.942 26.422 17.169 1.00 0.00 C ATOM 50434 H3A PC 1235 48.850 25.915 17.501 1.00 0.00 H ATOM 50435 H3B PC 1235 48.142 26.965 16.244 1.00 0.00 H ATOM 50436 H3C PC 1235 47.107 25.729 17.059 1.00 0.00 H ATOM 50437 C34 PC 1235 46.516 28.335 17.752 1.00 0.00 C ATOM 50438 H4A PC 1235 46.863 28.623 16.758 1.00 0.00 H ATOM 50439 H4B PC 1235 46.447 29.225 18.379 1.00 0.00 H ATOM 50440 H4C PC 1235 45.573 27.790 17.704 1.00 0.00 H ATOM 50441 C35 PC 1235 48.810 28.285 18.313 1.00 0.00 C ATOM 50442 H5A PC 1235 49.185 28.471 17.305 1.00 0.00 H ATOM 50443 H5B PC 1235 49.558 27.617 18.744 1.00 0.00 H ATOM 50444 H5C PC 1235 48.699 29.209 18.883 1.00 0.00 H ATOM 50445 O33 PC 1235 45.948 22.753 20.285 1.00 0.00 O ATOM 50446 O34 PC 1235 43.976 24.174 21.118 1.00 0.00 O ATOM 50447 O21 PC 1235 46.219 23.645 25.233 1.00 0.00 O ATOM 50448 C21 PC 1235 44.890 23.520 25.503 1.00 0.00 C ATOM 50449 O22 PC 1235 44.278 22.455 25.368 1.00 0.00 O ATOM 50450 C12 OL 1236 44.260 24.662 26.316 1.00 0.00 C ATOM 50451 H2R OL 1236 44.771 25.587 26.041 1.00 0.00 H ATOM 50452 H2S OL 1236 43.185 24.780 26.160 1.00 0.00 H ATOM 50453 C13 OL 1236 44.607 24.436 27.840 1.00 0.00 C ATOM 50454 H3R OL 1236 44.107 23.502 28.105 1.00 0.00 H ATOM 50455 H3S OL 1236 45.654 24.142 27.939 1.00 0.00 H ATOM 50456 C14 OL 1236 44.292 25.636 28.765 1.00 0.00 C ATOM 50457 H4R OL 1236 45.105 26.361 28.696 1.00 0.00 H ATOM 50458 H4S OL 1236 43.344 26.121 28.523 1.00 0.00 H ATOM 50459 C15 OL 1236 44.302 25.359 30.254 1.00 0.00 C ATOM 50460 H5R OL 1236 44.093 26.337 30.692 1.00 0.00 H ATOM 50461 H5S OL 1236 43.473 24.660 30.381 1.00 0.00 H ATOM 50462 C16 OL 1236 45.599 24.953 30.949 1.00 0.00 C ATOM 50463 H6R OL 1236 46.029 24.075 30.462 1.00 0.00 H ATOM 50464 H6S OL 1236 46.346 25.723 30.748 1.00 0.00 H ATOM 50465 C17 OL 1236 45.408 24.736 32.465 1.00 0.00 C ATOM 50466 H7R OL 1236 44.678 25.450 32.852 1.00 0.00 H ATOM 50467 H7S OL 1236 44.962 23.752 32.625 1.00 0.00 H ATOM 50468 C18 OL 1236 46.582 24.831 33.366 1.00 0.00 C ATOM 50469 H8R OL 1236 47.311 24.199 32.854 1.00 0.00 H ATOM 50470 H8S OL 1236 46.947 25.860 33.363 1.00 0.00 H ATOM 50471 C19 OL 1236 46.205 24.250 34.696 1.00 0.00 C ATOM 50472 H9R OL 1236 46.103 23.168 34.713 1.00 0.00 H ATOM 50473 C110 OL 1236 45.939 24.957 35.701 1.00 0.00 C ATOM 50474 H10R OL 1236 45.744 24.400 36.614 1.00 0.00 H ATOM 50475 C111 OL 1236 45.789 26.419 35.678 1.00 0.00 C ATOM 50476 H11R OL 1236 46.736 26.944 35.824 1.00 0.00 H ATOM 50477 H11S OL 1236 45.450 26.809 34.716 1.00 0.00 H ATOM 50478 C112 OL 1236 44.843 26.881 36.827 1.00 0.00 C ATOM 50479 H12R OL 1236 44.216 27.704 36.479 1.00 0.00 H ATOM 50480 H12S OL 1236 44.180 26.053 37.085 1.00 0.00 H ATOM 50481 C113 OL 1236 45.532 27.266 38.111 1.00 0.00 C ATOM 50482 H13R OL 1236 45.892 26.314 38.506 1.00 0.00 H ATOM 50483 H13S OL 1236 46.447 27.787 37.820 1.00 0.00 H ATOM 50484 C114 OL 1236 44.762 28.138 39.201 1.00 0.00 C ATOM 50485 H14R OL 1236 44.394 29.062 38.750 1.00 0.00 H ATOM 50486 H14S OL 1236 43.804 27.774 39.580 1.00 0.00 H ATOM 50487 C115 OL 1236 45.659 28.552 40.389 1.00 0.00 C ATOM 50488 H15R OL 1236 46.047 27.701 40.954 1.00 0.00 H ATOM 50489 H15S OL 1236 46.532 28.938 39.859 1.00 0.00 H ATOM 50490 C116 OL 1236 45.068 29.489 41.436 1.00 0.00 C ATOM 50491 H16R OL 1236 45.878 30.052 41.905 1.00 0.00 H ATOM 50492 H16S OL 1236 44.508 30.209 40.836 1.00 0.00 H ATOM 50493 C117 OL 1236 44.112 28.768 42.398 1.00 0.00 C ATOM 50494 H17R OL 1236 43.404 28.185 41.805 1.00 0.00 H ATOM 50495 H17S OL 1236 44.617 28.052 43.049 1.00 0.00 H ATOM 50496 C118 OL 1236 43.381 29.874 43.222 1.00 0.00 C ATOM 50497 H18R OL 1236 42.817 30.584 42.614 1.00 0.00 H ATOM 50498 H18S OL 1236 44.068 30.526 43.766 1.00 0.00 H ATOM 50499 H18T OL 1236 42.690 29.560 44.007 1.00 0.00 H TER 50500 OL 1236 ATOM 50500 C116 PA 1237 72.906 130.953 37.508 1.00 0.00 C ATOM 50501 H16R PA 1237 73.022 129.961 37.066 1.00 0.00 H ATOM 50502 H16S PA 1237 72.358 130.925 38.452 1.00 0.00 H ATOM 50503 H16T PA 1237 73.856 131.398 37.811 1.00 0.00 H ATOM 50504 C115 PA 1237 72.123 131.657 36.532 1.00 0.00 C ATOM 50505 H15R PA 1237 71.617 132.460 37.073 1.00 0.00 H ATOM 50506 H15S PA 1237 71.346 131.000 36.135 1.00 0.00 H ATOM 50507 C114 PA 1237 72.887 132.045 35.267 1.00 0.00 C ATOM 50508 H14R PA 1237 73.306 131.118 34.871 1.00 0.00 H ATOM 50509 H14S PA 1237 73.784 132.620 35.507 1.00 0.00 H ATOM 50510 C113 PA 1237 72.073 132.882 34.286 1.00 0.00 C ATOM 50511 H13R PA 1237 71.960 133.841 34.797 1.00 0.00 H ATOM 50512 H13S PA 1237 71.074 132.485 34.098 1.00 0.00 H ATOM 50513 C112 PA 1237 72.844 133.187 32.946 1.00 0.00 C ATOM 50514 H12R PA 1237 73.798 133.634 33.232 1.00 0.00 H ATOM 50515 H12S PA 1237 72.244 133.957 32.457 1.00 0.00 H ATOM 50516 C111 PA 1237 73.194 131.999 32.112 1.00 0.00 C ATOM 50517 H11R PA 1237 72.288 131.397 32.010 1.00 0.00 H ATOM 50518 H11S PA 1237 73.911 131.319 32.577 1.00 0.00 H ATOM 50519 C110 PA 1237 73.882 132.362 30.793 1.00 0.00 C ATOM 50520 H10R PA 1237 74.777 132.926 31.063 1.00 0.00 H ATOM 50521 H10S PA 1237 73.317 133.031 30.141 1.00 0.00 H ATOM 50522 C19 PA 1237 74.203 131.216 29.873 1.00 0.00 C ATOM 50523 H9R PA 1237 74.914 130.540 30.352 1.00 0.00 H ATOM 50524 H9S PA 1237 74.783 131.732 29.105 1.00 0.00 H ATOM 50525 C18 PA 1237 72.957 130.491 29.378 1.00 0.00 C ATOM 50526 H8R PA 1237 72.159 131.157 29.041 1.00 0.00 H ATOM 50527 H8S PA 1237 72.440 130.066 30.241 1.00 0.00 H ATOM 50528 C17 PA 1237 73.312 129.350 28.445 1.00 0.00 C ATOM 50529 H7R PA 1237 72.413 128.766 28.241 1.00 0.00 H ATOM 50530 H7S PA 1237 73.963 128.686 29.017 1.00 0.00 H ATOM 50531 C16 PA 1237 73.999 129.641 27.081 1.00 0.00 C ATOM 50532 H6R PA 1237 74.171 128.698 26.558 1.00 0.00 H ATOM 50533 H6S PA 1237 75.010 130.016 27.255 1.00 0.00 H ATOM 50534 C15 PA 1237 73.291 130.667 26.153 1.00 0.00 C ATOM 50535 H5R PA 1237 73.369 131.707 26.476 1.00 0.00 H ATOM 50536 H5S PA 1237 72.236 130.393 26.082 1.00 0.00 H ATOM 50537 C14 PA 1237 73.805 130.661 24.650 1.00 0.00 C ATOM 50538 H4R PA 1237 73.463 129.705 24.250 1.00 0.00 H ATOM 50539 H4S PA 1237 74.894 130.740 24.627 1.00 0.00 H ATOM 50540 C13 PA 1237 72.997 131.574 23.677 1.00 0.00 C ATOM 50541 H3R PA 1237 73.192 131.070 22.728 1.00 0.00 H ATOM 50542 H3S PA 1237 73.547 132.515 23.597 1.00 0.00 H ATOM 50543 C12 PA 1237 71.549 131.747 24.068 1.00 0.00 C ATOM 50544 H2R PA 1237 71.584 132.236 25.044 1.00 0.00 H ATOM 50545 H2S PA 1237 70.909 130.868 24.162 1.00 0.00 H ATOM 50546 C11 PGR 1238 70.769 132.612 23.123 1.00 0.00 C ATOM 50547 O12 PGR 1238 70.044 133.500 23.485 1.00 0.00 O ATOM 50548 O11 PGR 1238 70.898 132.196 21.833 1.00 0.00 O ATOM 50549 C1 PGR 1238 70.048 132.742 20.828 1.00 0.00 C ATOM 50550 HR PGR 1238 70.064 133.828 20.949 1.00 0.00 H ATOM 50551 HS PGR 1238 69.012 132.408 20.923 1.00 0.00 H ATOM 50552 C2 PGR 1238 70.602 132.458 19.456 1.00 0.00 C ATOM 50553 HX PGR 1238 71.675 132.665 19.495 1.00 0.00 H ATOM 50554 C3 PGR 1238 69.894 133.292 18.332 1.00 0.00 C ATOM 50555 HA PGR 1238 69.995 134.300 18.742 1.00 0.00 H ATOM 50556 HB PGR 1238 68.839 133.007 18.361 1.00 0.00 H ATOM 50557 O31 PGR 1238 70.653 133.170 17.097 1.00 0.00 O ATOM 50558 P31 PGR 1238 71.066 134.503 16.299 1.00 0.00 P ATOM 50559 O32 PGR 1238 72.420 134.893 17.081 1.00 0.00 O ATOM 50560 C31 PGR 1238 73.606 134.204 16.745 1.00 0.00 C ATOM 50561 H1A PGR 1238 74.044 134.666 15.857 1.00 0.00 H ATOM 50562 H1B PGR 1238 73.274 133.172 16.606 1.00 0.00 H ATOM 50563 C32 PGR 1238 74.548 134.200 17.932 1.00 0.00 C ATOM 50564 H2A PGR 1238 74.105 133.769 18.833 1.00 0.00 H ATOM 50565 O35 PGR 1238 75.142 135.483 18.129 1.00 0.00 O ATOM 50566 HO5A PGR 1238 74.444 136.099 17.843 1.00 0.00 H ATOM 50567 C33 PGR 1238 75.799 133.277 17.703 1.00 0.00 C ATOM 50568 H3A PGR 1238 75.408 132.286 17.460 1.00 0.00 H ATOM 50569 H3B PGR 1238 76.244 133.653 16.778 1.00 0.00 H ATOM 50570 O33 PGR 1238 71.353 134.178 14.884 1.00 0.00 O ATOM 50571 O34 PGR 1238 70.034 135.525 16.628 1.00 0.00 O ATOM 50572 O21 PGR 1238 70.256 131.054 19.327 1.00 0.00 O ATOM 50573 C21 PGR 1238 71.170 130.257 18.819 1.00 0.00 C ATOM 50574 O22 PGR 1238 72.303 130.604 18.572 1.00 0.00 O ATOM 50575 O36 PGR 1238 76.859 133.347 18.755 1.00 0.00 O ATOM 50576 HO6A PGR 1238 77.558 132.748 18.436 1.00 0.00 H ATOM 50577 C12 OL 1239 70.739 128.859 18.541 1.00 0.00 C ATOM 50578 H2R OL 1239 70.251 128.776 17.568 1.00 0.00 H ATOM 50579 H2S OL 1239 71.665 128.282 18.555 1.00 0.00 H ATOM 50580 C13 OL 1239 69.847 128.242 19.602 1.00 0.00 C ATOM 50581 H3R OL 1239 68.811 128.379 19.285 1.00 0.00 H ATOM 50582 H3S OL 1239 70.140 127.192 19.532 1.00 0.00 H ATOM 50583 C14 OL 1239 70.013 128.644 21.122 1.00 0.00 C ATOM 50584 H4R OL 1239 71.061 128.895 21.300 1.00 0.00 H ATOM 50585 H4S OL 1239 69.416 129.556 21.198 1.00 0.00 H ATOM 50586 C15 OL 1239 69.377 127.602 21.970 1.00 0.00 C ATOM 50587 H5R OL 1239 68.307 127.543 21.759 1.00 0.00 H ATOM 50588 H5S OL 1239 69.779 126.620 21.711 1.00 0.00 H ATOM 50589 C16 OL 1239 69.709 127.858 23.472 1.00 0.00 C ATOM 50590 H6R OL 1239 70.793 127.982 23.523 1.00 0.00 H ATOM 50591 H6S OL 1239 69.275 128.845 23.645 1.00 0.00 H ATOM 50592 C17 OL 1239 69.122 126.951 24.473 1.00 0.00 C ATOM 50593 H7R OL 1239 68.099 127.328 24.514 1.00 0.00 H ATOM 50594 H7S OL 1239 69.158 125.886 24.231 1.00 0.00 H ATOM 50595 C18 OL 1239 69.781 127.290 25.841 1.00 0.00 C ATOM 50596 H8R OL 1239 70.852 127.075 25.832 1.00 0.00 H ATOM 50597 H8S OL 1239 69.661 128.375 25.865 1.00 0.00 H ATOM 50598 C19 OL 1239 69.203 126.658 27.103 1.00 0.00 C ATOM 50599 H9R OL 1239 68.920 125.612 27.020 1.00 0.00 H ATOM 50600 C110 OL 1239 69.036 127.116 28.308 1.00 0.00 C ATOM 50601 H10R OL 1239 68.602 126.426 29.028 1.00 0.00 H ATOM 50602 C111 OL 1239 69.442 128.403 28.863 1.00 0.00 C ATOM 50603 H11R OL 1239 69.730 128.220 29.900 1.00 0.00 H ATOM 50604 H11S OL 1239 70.353 128.782 28.394 1.00 0.00 H ATOM 50605 C112 OL 1239 68.194 129.231 28.969 1.00 0.00 C ATOM 50606 H12R OL 1239 67.729 129.325 27.986 1.00 0.00 H ATOM 50607 H12S OL 1239 67.427 128.715 29.550 1.00 0.00 H ATOM 50608 C113 OL 1239 68.497 130.716 29.324 1.00 0.00 C ATOM 50609 H13R OL 1239 69.426 130.653 29.895 1.00 0.00 H ATOM 50610 H13S OL 1239 68.816 131.208 28.403 1.00 0.00 H ATOM 50611 C114 OL 1239 67.304 131.294 29.943 1.00 0.00 C ATOM 50612 H14R OL 1239 66.497 131.315 29.208 1.00 0.00 H ATOM 50613 H14S OL 1239 66.986 130.747 30.833 1.00 0.00 H ATOM 50614 C115 OL 1239 67.483 132.812 30.259 1.00 0.00 C ATOM 50615 H15R OL 1239 68.294 132.934 30.980 1.00 0.00 H ATOM 50616 H15S OL 1239 67.871 133.195 29.312 1.00 0.00 H ATOM 50617 C116 OL 1239 66.231 133.612 30.664 1.00 0.00 C ATOM 50618 H16R OL 1239 65.696 133.692 29.715 1.00 0.00 H ATOM 50619 H16S OL 1239 65.550 133.076 31.327 1.00 0.00 H ATOM 50620 C117 OL 1239 66.416 134.982 31.228 1.00 0.00 C ATOM 50621 H17R OL 1239 67.173 134.825 31.999 1.00 0.00 H ATOM 50622 H17S OL 1239 66.878 135.620 30.472 1.00 0.00 H ATOM 50623 C118 OL 1239 65.185 135.517 31.933 1.00 0.00 C ATOM 50624 H18R OL 1239 64.228 135.736 31.454 1.00 0.00 H ATOM 50625 H18S OL 1239 65.500 136.493 32.309 1.00 0.00 H ATOM 50626 H18T OL 1239 65.000 134.987 32.869 1.00 0.00 H TER 50627 OL 1239 ATOM 50627 C116 PA 1240 41.115 89.588 41.610 1.00 0.00 C ATOM 50628 H16R PA 1240 40.778 90.188 42.458 1.00 0.00 H ATOM 50629 H16S PA 1240 41.964 90.010 41.068 1.00 0.00 H ATOM 50630 H16T PA 1240 41.489 88.647 42.019 1.00 0.00 H ATOM 50631 C115 PA 1240 39.979 89.074 40.718 1.00 0.00 C ATOM 50632 H15R PA 1240 39.425 89.954 40.386 1.00 0.00 H ATOM 50633 H15S PA 1240 39.231 88.549 41.316 1.00 0.00 H ATOM 50634 C114 PA 1240 40.467 88.220 39.494 1.00 0.00 C ATOM 50635 H14R PA 1240 39.523 87.993 38.994 1.00 0.00 H ATOM 50636 H14S PA 1240 40.789 87.220 39.790 1.00 0.00 H ATOM 50637 C113 PA 1240 41.419 88.907 38.634 1.00 0.00 C ATOM 50638 H13R PA 1240 42.457 88.879 38.971 1.00 0.00 H ATOM 50639 H13S PA 1240 41.221 89.973 38.509 1.00 0.00 H ATOM 50640 C112 PA 1240 41.494 88.247 37.301 1.00 0.00 C ATOM 50641 H12R PA 1240 40.538 88.451 36.813 1.00 0.00 H ATOM 50642 H12S PA 1240 41.620 87.171 37.436 1.00 0.00 H ATOM 50643 C111 PA 1240 42.629 88.903 36.484 1.00 0.00 C ATOM 50644 H11R PA 1240 43.386 89.236 37.198 1.00 0.00 H ATOM 50645 H11S PA 1240 42.109 89.773 36.079 1.00 0.00 H ATOM 50646 C110 PA 1240 43.237 88.135 35.338 1.00 0.00 C ATOM 50647 H10R PA 1240 43.311 87.120 35.734 1.00 0.00 H ATOM 50648 H10S PA 1240 44.256 88.286 34.977 1.00 0.00 H ATOM 50649 C19 PA 1240 42.346 87.999 34.090 1.00 0.00 C ATOM 50650 H9R PA 1240 41.367 87.595 34.354 1.00 0.00 H ATOM 50651 H9S PA 1240 42.874 87.204 33.558 1.00 0.00 H ATOM 50652 C18 PA 1240 42.307 89.229 33.174 1.00 0.00 C ATOM 50653 H8R PA 1240 43.340 89.576 33.104 1.00 0.00 H ATOM 50654 H8S PA 1240 41.764 90.037 33.667 1.00 0.00 H ATOM 50655 C17 PA 1240 41.588 89.031 31.834 1.00 0.00 C ATOM 50656 H7R PA 1240 41.877 88.068 31.406 1.00 0.00 H ATOM 50657 H7S PA 1240 41.975 89.766 31.126 1.00 0.00 H ATOM 50658 C16 PA 1240 40.161 89.208 32.038 1.00 0.00 C ATOM 50659 H6R PA 1240 39.933 90.095 32.632 1.00 0.00 H ATOM 50660 H6S PA 1240 39.830 88.363 32.646 1.00 0.00 H ATOM 50661 C15 PA 1240 39.424 89.372 30.729 1.00 0.00 C ATOM 50662 H5R PA 1240 39.783 90.249 30.187 1.00 0.00 H ATOM 50663 H5S PA 1240 38.408 89.615 31.045 1.00 0.00 H ATOM 50664 C14 PA 1240 39.465 88.230 29.816 1.00 0.00 C ATOM 50665 H4R PA 1240 40.426 88.113 29.311 1.00 0.00 H ATOM 50666 H4S PA 1240 38.861 88.622 28.996 1.00 0.00 H ATOM 50667 C13 PA 1240 38.959 86.894 30.350 1.00 0.00 C ATOM 50668 H3R PA 1240 37.900 87.060 30.559 1.00 0.00 H ATOM 50669 H3S PA 1240 39.313 86.560 31.328 1.00 0.00 H ATOM 50670 C12 PA 1240 39.246 85.737 29.429 1.00 0.00 C ATOM 50671 H2R PA 1240 39.214 84.764 29.922 1.00 0.00 H ATOM 50672 H2S PA 1240 40.248 85.821 29.002 1.00 0.00 H ATOM 50673 C11 PC 1241 38.300 85.809 28.182 1.00 0.00 C ATOM 50674 O12 PC 1241 37.217 86.420 28.118 1.00 0.00 O ATOM 50675 O11 PC 1241 38.704 85.006 27.144 1.00 0.00 O ATOM 50676 C1 PC 1241 37.873 85.077 25.940 1.00 0.00 C ATOM 50677 HR PC 1241 37.780 86.061 25.474 1.00 0.00 H ATOM 50678 HS PC 1241 36.835 84.796 26.134 1.00 0.00 H ATOM 50679 C2 PC 1241 38.402 83.998 24.987 1.00 0.00 C ATOM 50680 HX PC 1241 39.480 84.178 25.016 1.00 0.00 H ATOM 50681 C3 PC 1241 37.872 84.121 23.523 1.00 0.00 C ATOM 50682 HA PC 1241 37.862 83.115 23.096 1.00 0.00 H ATOM 50683 HB PC 1241 38.504 84.693 22.841 1.00 0.00 H ATOM 50684 O31 PC 1241 36.516 84.525 23.524 1.00 0.00 O ATOM 50685 P31 PC 1241 35.826 84.641 22.107 1.00 0.00 P ATOM 50686 O32 PC 1241 36.426 83.562 21.100 1.00 0.00 O ATOM 50687 C31 PC 1241 35.809 82.350 20.971 1.00 0.00 C ATOM 50688 H1A PC 1241 34.913 82.395 20.346 1.00 0.00 H ATOM 50689 H1B PC 1241 35.510 81.859 21.901 1.00 0.00 H ATOM 50690 C32 PC 1241 36.618 81.399 20.103 1.00 0.00 C ATOM 50691 H2A PC 1241 36.649 81.918 19.144 1.00 0.00 H ATOM 50692 H2B PC 1241 36.108 80.441 19.993 1.00 0.00 H ATOM 50693 N31 PC 1241 38.072 81.056 20.393 1.00 0.00 N ATOM 50694 C33 PC 1241 38.210 80.417 21.758 1.00 0.00 C ATOM 50695 H3A PC 1241 37.784 79.414 21.811 1.00 0.00 H ATOM 50696 H3B PC 1241 37.829 81.109 22.510 1.00 0.00 H ATOM 50697 H3C PC 1241 39.282 80.259 21.883 1.00 0.00 H ATOM 50698 C34 PC 1241 38.506 80.132 19.388 1.00 0.00 C ATOM 50699 H4A PC 1241 37.998 79.169 19.450 1.00 0.00 H ATOM 50700 H4B PC 1241 39.585 79.984 19.458 1.00 0.00 H ATOM 50701 H4C PC 1241 38.195 80.432 18.386 1.00 0.00 H ATOM 50702 C35 PC 1241 38.914 82.263 20.131 1.00 0.00 C ATOM 50703 H5A PC 1241 38.566 83.116 20.715 1.00 0.00 H ATOM 50704 H5B PC 1241 38.885 82.445 19.056 1.00 0.00 H ATOM 50705 H5C PC 1241 39.951 82.031 20.379 1.00 0.00 H ATOM 50706 O33 PC 1241 34.375 84.337 22.206 1.00 0.00 O ATOM 50707 O34 PC 1241 36.117 85.931 21.504 1.00 0.00 O ATOM 50708 O21 PC 1241 38.043 82.745 25.588 1.00 0.00 O ATOM 50709 C21 PC 1241 38.893 81.679 25.450 1.00 0.00 C ATOM 50710 O22 PC 1241 39.838 81.674 24.686 1.00 0.00 O ATOM 50711 C12 OL 1242 38.644 80.617 26.489 1.00 0.00 C ATOM 50712 H2R OL 1242 38.987 80.935 27.475 1.00 0.00 H ATOM 50713 H2S OL 1242 37.557 80.513 26.481 1.00 0.00 H ATOM 50714 C13 OL 1242 39.357 79.363 26.108 1.00 0.00 C ATOM 50715 H3R OL 1242 39.241 78.932 25.111 1.00 0.00 H ATOM 50716 H3S OL 1242 40.405 79.445 26.406 1.00 0.00 H ATOM 50717 C14 OL 1242 38.725 78.173 26.851 1.00 0.00 C ATOM 50718 H4R OL 1242 37.772 78.009 26.344 1.00 0.00 H ATOM 50719 H4S OL 1242 39.166 77.233 26.510 1.00 0.00 H ATOM 50720 C15 OL 1242 38.371 78.262 28.300 1.00 0.00 C ATOM 50721 H5R OL 1242 39.255 78.349 28.936 1.00 0.00 H ATOM 50722 H5S OL 1242 37.889 79.210 28.549 1.00 0.00 H ATOM 50723 C16 OL 1242 37.589 77.092 28.798 1.00 0.00 C ATOM 50724 H6R OL 1242 37.481 77.255 29.872 1.00 0.00 H ATOM 50725 H6S OL 1242 36.595 77.069 28.348 1.00 0.00 H ATOM 50726 C17 OL 1242 38.151 75.738 28.624 1.00 0.00 C ATOM 50727 H7R OL 1242 37.839 75.303 27.672 1.00 0.00 H ATOM 50728 H7S OL 1242 39.233 75.890 28.616 1.00 0.00 H ATOM 50729 C18 OL 1242 37.707 74.771 29.704 1.00 0.00 C ATOM 50730 H8R OL 1242 38.059 75.061 30.697 1.00 0.00 H ATOM 50731 H8S OL 1242 36.628 74.608 29.674 1.00 0.00 H ATOM 50732 C19 OL 1242 38.230 73.436 29.471 1.00 0.00 C ATOM 50733 H9R OL 1242 37.869 73.041 28.525 1.00 0.00 H ATOM 50734 C110 OL 1242 38.969 72.587 30.213 1.00 0.00 C ATOM 50735 H10R OL 1242 39.180 71.553 29.949 1.00 0.00 H ATOM 50736 C111 OL 1242 39.692 73.003 31.414 1.00 0.00 C ATOM 50737 H11R OL 1242 39.852 74.081 31.471 1.00 0.00 H ATOM 50738 H11S OL 1242 39.177 72.645 32.309 1.00 0.00 H ATOM 50739 C112 OL 1242 41.126 72.440 31.319 1.00 0.00 C ATOM 50740 H12R OL 1242 41.218 71.443 30.885 1.00 0.00 H ATOM 50741 H12S OL 1242 41.669 73.074 30.614 1.00 0.00 H ATOM 50742 C113 OL 1242 41.913 72.428 32.628 1.00 0.00 C ATOM 50743 H13R OL 1242 42.095 73.451 32.964 1.00 0.00 H ATOM 50744 H13S OL 1242 41.253 71.926 33.338 1.00 0.00 H ATOM 50745 C114 OL 1242 43.293 71.761 32.529 1.00 0.00 C ATOM 50746 H14R OL 1242 43.187 70.871 31.906 1.00 0.00 H ATOM 50747 H14S OL 1242 44.021 72.532 32.269 1.00 0.00 H ATOM 50748 C115 OL 1242 43.878 71.162 33.827 1.00 0.00 C ATOM 50749 H15R OL 1242 43.233 70.381 34.236 1.00 0.00 H ATOM 50750 H15S OL 1242 44.837 70.746 33.513 1.00 0.00 H ATOM 50751 C116 OL 1242 44.115 72.214 34.884 1.00 0.00 C ATOM 50752 H16R OL 1242 44.414 73.203 34.532 1.00 0.00 H ATOM 50753 H16S OL 1242 43.138 72.327 35.357 1.00 0.00 H ATOM 50754 C117 OL 1242 45.016 71.795 36.046 1.00 0.00 C ATOM 50755 H17R OL 1242 44.727 70.837 36.484 1.00 0.00 H ATOM 50756 H17S OL 1242 46.046 71.680 35.702 1.00 0.00 H ATOM 50757 C118 OL 1242 45.048 72.910 37.076 1.00 0.00 C ATOM 50758 H18R OL 1242 45.828 72.583 37.767 1.00 0.00 H ATOM 50759 H18S OL 1242 44.060 73.014 37.528 1.00 0.00 H ATOM 50760 H18T OL 1242 45.303 73.866 36.614 1.00 0.00 H TER 50761 OL 1242 ATOM 50761 C116 PA 1243 34.457 133.165 39.297 1.00 0.00 C ATOM 50762 H16R PA 1243 35.256 132.882 39.985 1.00 0.00 H ATOM 50763 H16S PA 1243 33.569 132.533 39.236 1.00 0.00 H ATOM 50764 H16T PA 1243 34.061 134.164 39.494 1.00 0.00 H ATOM 50765 C115 PA 1243 35.130 133.363 37.828 1.00 0.00 C ATOM 50766 H15R PA 1243 35.917 134.119 37.866 1.00 0.00 H ATOM 50767 H15S PA 1243 34.383 133.742 37.128 1.00 0.00 H ATOM 50768 C114 PA 1243 35.882 132.094 37.400 1.00 0.00 C ATOM 50769 H14R PA 1243 35.300 131.250 37.776 1.00 0.00 H ATOM 50770 H14S PA 1243 36.828 132.000 37.938 1.00 0.00 H ATOM 50771 C113 PA 1243 35.972 132.100 35.852 1.00 0.00 C ATOM 50772 H13R PA 1243 34.991 132.200 35.382 1.00 0.00 H ATOM 50773 H13S PA 1243 36.364 131.115 35.588 1.00 0.00 H ATOM 50774 C112 PA 1243 37.045 133.174 35.224 1.00 0.00 C ATOM 50775 H12R PA 1243 37.908 133.190 35.894 1.00 0.00 H ATOM 50776 H12S PA 1243 36.702 134.208 35.284 1.00 0.00 H ATOM 50777 C111 PA 1243 37.393 132.783 33.752 1.00 0.00 C ATOM 50778 H11R PA 1243 36.474 132.847 33.166 1.00 0.00 H ATOM 50779 H11S PA 1243 37.587 131.708 33.782 1.00 0.00 H ATOM 50780 C110 PA 1243 38.567 133.410 33.123 1.00 0.00 C ATOM 50781 H10R PA 1243 38.692 132.994 32.121 1.00 0.00 H ATOM 50782 H10S PA 1243 39.482 133.201 33.681 1.00 0.00 H ATOM 50783 C19 PA 1243 38.450 134.910 33.028 1.00 0.00 C ATOM 50784 H9R PA 1243 38.457 135.404 34.002 1.00 0.00 H ATOM 50785 H9S PA 1243 37.520 135.214 32.543 1.00 0.00 H ATOM 50786 C18 PA 1243 39.633 135.439 32.247 1.00 0.00 C ATOM 50787 H8R PA 1243 39.652 134.870 31.315 1.00 0.00 H ATOM 50788 H8S PA 1243 40.500 135.152 32.845 1.00 0.00 H ATOM 50789 C17 PA 1243 39.600 136.945 31.997 1.00 0.00 C ATOM 50790 H7R PA 1243 40.568 137.326 31.667 1.00 0.00 H ATOM 50791 H7S PA 1243 39.456 137.432 32.964 1.00 0.00 H ATOM 50792 C16 PA 1243 38.451 137.433 31.167 1.00 0.00 C ATOM 50793 H6R PA 1243 38.623 138.507 31.076 1.00 0.00 H ATOM 50794 H6S PA 1243 37.602 137.371 31.850 1.00 0.00 H ATOM 50795 C15 PA 1243 38.289 136.901 29.793 1.00 0.00 C ATOM 50796 H5R PA 1243 37.334 137.159 29.332 1.00 0.00 H ATOM 50797 H5S PA 1243 38.312 135.816 29.914 1.00 0.00 H ATOM 50798 C14 PA 1243 39.492 137.326 28.894 1.00 0.00 C ATOM 50799 H4R PA 1243 40.326 136.740 29.287 1.00 0.00 H ATOM 50800 H4S PA 1243 39.810 138.350 29.105 1.00 0.00 H ATOM 50801 C13 PA 1243 39.336 137.077 27.385 1.00 0.00 C ATOM 50802 H3R PA 1243 38.791 137.954 27.028 1.00 0.00 H ATOM 50803 H3S PA 1243 38.736 136.173 27.258 1.00 0.00 H ATOM 50804 C12 PA 1243 40.583 136.955 26.567 1.00 0.00 C ATOM 50805 H2R PA 1243 41.253 136.179 26.943 1.00 0.00 H ATOM 50806 H2S PA 1243 41.223 137.840 26.565 1.00 0.00 H ATOM 50807 C11 PGR 1244 40.316 136.604 25.061 1.00 0.00 C ATOM 50808 O12 PGR 1244 39.274 137.010 24.552 1.00 0.00 O ATOM 50809 O11 PGR 1244 41.349 136.092 24.349 1.00 0.00 O ATOM 50810 C1 PGR 1244 41.022 135.837 22.920 1.00 0.00 C ATOM 50811 HR PGR 1244 41.158 136.768 22.363 1.00 0.00 H ATOM 50812 HS PGR 1244 40.121 135.246 22.733 1.00 0.00 H ATOM 50813 C2 PGR 1244 42.034 134.904 22.212 1.00 0.00 C ATOM 50814 HX PGR 1244 43.054 135.200 22.470 1.00 0.00 H ATOM 50815 C3 PGR 1244 41.773 134.883 20.686 1.00 0.00 C ATOM 50816 HA PGR 1244 41.827 135.913 20.324 1.00 0.00 H ATOM 50817 HB PGR 1244 40.803 134.424 20.482 1.00 0.00 H ATOM 50818 O31 PGR 1244 42.788 134.159 20.126 1.00 0.00 O ATOM 50819 P31 PGR 1244 42.879 133.910 18.523 1.00 0.00 P ATOM 50820 O32 PGR 1244 41.282 133.534 18.081 1.00 0.00 O ATOM 50821 C31 PGR 1244 40.902 133.971 16.772 1.00 0.00 C ATOM 50822 H1A PGR 1244 41.575 133.506 16.047 1.00 0.00 H ATOM 50823 H1B PGR 1244 40.976 135.060 16.728 1.00 0.00 H ATOM 50824 C32 PGR 1244 39.497 133.419 16.342 1.00 0.00 C ATOM 50825 H2A PGR 1244 39.152 134.088 15.550 1.00 0.00 H ATOM 50826 O35 PGR 1244 39.500 132.118 15.628 1.00 0.00 O ATOM 50827 HO5A PGR 1244 38.559 131.970 15.423 1.00 0.00 H ATOM 50828 C33 PGR 1244 38.354 133.494 17.404 1.00 0.00 C ATOM 50829 H3A PGR 1244 38.443 132.634 18.073 1.00 0.00 H ATOM 50830 H3B PGR 1244 38.428 134.416 17.987 1.00 0.00 H ATOM 50831 O33 PGR 1244 43.402 135.151 17.946 1.00 0.00 O ATOM 50832 O34 PGR 1244 43.709 132.719 18.339 1.00 0.00 O ATOM 50833 O21 PGR 1244 41.741 133.617 22.736 1.00 0.00 O ATOM 50834 C21 PGR 1244 42.487 132.508 22.635 1.00 0.00 C ATOM 50835 O22 PGR 1244 43.651 132.580 22.279 1.00 0.00 O ATOM 50836 O36 PGR 1244 37.064 133.341 16.759 1.00 0.00 O ATOM 50837 HO6A PGR 1244 36.341 133.651 17.334 1.00 0.00 H ATOM 50838 C12 OL 1245 41.691 131.229 22.935 1.00 0.00 C ATOM 50839 H2R OL 1245 40.805 131.224 22.298 1.00 0.00 H ATOM 50840 H2S OL 1245 42.439 130.520 22.574 1.00 0.00 H ATOM 50841 C13 OL 1245 41.346 131.232 24.366 1.00 0.00 C ATOM 50842 H3R OL 1245 40.662 130.381 24.333 1.00 0.00 H ATOM 50843 H3S OL 1245 42.192 131.014 25.021 1.00 0.00 H ATOM 50844 C14 OL 1245 40.416 132.305 24.853 1.00 0.00 C ATOM 50845 H4R OL 1245 40.989 133.229 24.947 1.00 0.00 H ATOM 50846 H4S OL 1245 39.765 132.481 23.994 1.00 0.00 H ATOM 50847 C15 OL 1245 39.728 131.908 26.153 1.00 0.00 C ATOM 50848 H5R OL 1245 39.011 131.090 26.053 1.00 0.00 H ATOM 50849 H5S OL 1245 40.475 131.469 26.816 1.00 0.00 H ATOM 50850 C16 OL 1245 39.084 133.020 27.020 1.00 0.00 C ATOM 50851 H6R OL 1245 39.626 133.940 26.790 1.00 0.00 H ATOM 50852 H6S OL 1245 38.034 133.065 26.723 1.00 0.00 H ATOM 50853 C17 OL 1245 39.183 132.753 28.550 1.00 0.00 C ATOM 50854 H7R OL 1245 40.146 132.420 28.942 1.00 0.00 H ATOM 50855 H7S OL 1245 39.083 133.728 29.032 1.00 0.00 H ATOM 50856 C18 OL 1245 37.986 131.936 29.038 1.00 0.00 C ATOM 50857 H8R OL 1245 37.712 132.308 30.027 1.00 0.00 H ATOM 50858 H8S OL 1245 37.082 132.164 28.469 1.00 0.00 H ATOM 50859 C19 OL 1245 38.187 130.425 28.906 1.00 0.00 C ATOM 50860 H9R OL 1245 38.750 130.125 28.026 1.00 0.00 H ATOM 50861 C110 OL 1245 37.903 129.527 29.888 1.00 0.00 C ATOM 50862 H10R OL 1245 37.998 128.487 29.588 1.00 0.00 H ATOM 50863 C111 OL 1245 37.129 129.715 31.110 1.00 0.00 C ATOM 50864 H11R OL 1245 37.145 130.768 31.396 1.00 0.00 H ATOM 50865 H11S OL 1245 36.102 129.476 30.826 1.00 0.00 H ATOM 50866 C112 OL 1245 37.550 129.006 32.290 1.00 0.00 C ATOM 50867 H12R OL 1245 38.638 128.912 32.278 1.00 0.00 H ATOM 50868 H12S OL 1245 37.311 129.567 33.196 1.00 0.00 H ATOM 50869 C113 OL 1245 37.205 127.542 32.446 1.00 0.00 C ATOM 50870 H13R OL 1245 36.159 127.368 32.185 1.00 0.00 H ATOM 50871 H13S OL 1245 37.802 126.986 31.720 1.00 0.00 H ATOM 50872 C114 OL 1245 37.323 127.059 33.880 1.00 0.00 C ATOM 50873 H14R OL 1245 38.305 127.233 34.325 1.00 0.00 H ATOM 50874 H14S OL 1245 36.729 127.688 34.546 1.00 0.00 H ATOM 50875 C115 OL 1245 36.759 125.660 34.053 1.00 0.00 C ATOM 50876 H15R OL 1245 35.756 125.592 33.627 1.00 0.00 H ATOM 50877 H15S OL 1245 37.430 125.027 33.469 1.00 0.00 H ATOM 50878 C116 OL 1245 36.534 125.142 35.491 1.00 0.00 C ATOM 50879 H16R OL 1245 36.405 124.069 35.335 1.00 0.00 H ATOM 50880 H16S OL 1245 37.435 125.287 36.091 1.00 0.00 H ATOM 50881 C117 OL 1245 35.287 125.651 36.209 1.00 0.00 C ATOM 50882 H17R OL 1245 35.405 126.722 36.387 1.00 0.00 H ATOM 50883 H17S OL 1245 34.387 125.483 35.613 1.00 0.00 H ATOM 50884 C118 OL 1245 35.021 124.851 37.472 1.00 0.00 C ATOM 50885 H18R OL 1245 34.109 125.265 37.905 1.00 0.00 H ATOM 50886 H18S OL 1245 35.786 124.898 38.250 1.00 0.00 H ATOM 50887 H18T OL 1245 34.722 123.805 37.372 1.00 0.00 H TER 50888 OL 1245 ATOM 50888 C116 PA 1246 125.374 6.932 30.913 1.00 0.00 C ATOM 50889 H16R PA 1246 125.288 7.981 30.619 1.00 0.00 H ATOM 50890 H16S PA 1246 125.916 6.517 30.060 1.00 0.00 H ATOM 50891 H16T PA 1246 126.016 6.908 31.795 1.00 0.00 H ATOM 50892 C115 PA 1246 124.035 6.267 31.044 1.00 0.00 C ATOM 50893 H15R PA 1246 123.471 6.456 30.128 1.00 0.00 H ATOM 50894 H15S PA 1246 123.469 6.684 31.880 1.00 0.00 H ATOM 50895 C114 PA 1246 124.067 4.758 31.251 1.00 0.00 C ATOM 50896 H14R PA 1246 124.697 4.717 32.142 1.00 0.00 H ATOM 50897 H14S PA 1246 124.624 4.307 30.427 1.00 0.00 H ATOM 50898 C113 PA 1246 122.699 4.098 31.430 1.00 0.00 C ATOM 50899 H13R PA 1246 122.155 4.425 32.319 1.00 0.00 H ATOM 50900 H13S PA 1246 122.888 3.048 31.664 1.00 0.00 H ATOM 50901 C112 PA 1246 121.847 4.281 30.223 1.00 0.00 C ATOM 50902 H12R PA 1246 122.429 4.153 29.308 1.00 0.00 H ATOM 50903 H12S PA 1246 121.601 5.340 30.327 1.00 0.00 H ATOM 50904 C111 PA 1246 120.485 3.546 30.195 1.00 0.00 C ATOM 50905 H11R PA 1246 120.618 2.483 29.983 1.00 0.00 H ATOM 50906 H11S PA 1246 119.876 3.790 29.322 1.00 0.00 H ATOM 50907 C110 PA 1246 119.554 3.692 31.410 1.00 0.00 C ATOM 50908 H10R PA 1246 119.982 3.314 32.341 1.00 0.00 H ATOM 50909 H10S PA 1246 118.625 3.120 31.454 1.00 0.00 H ATOM 50910 C19 PA 1246 119.198 5.111 31.797 1.00 0.00 C ATOM 50911 H9R PA 1246 120.154 5.406 32.235 1.00 0.00 H ATOM 50912 H9S PA 1246 118.559 5.100 32.682 1.00 0.00 H ATOM 50913 C18 PA 1246 118.737 6.048 30.740 1.00 0.00 C ATOM 50914 H8R PA 1246 118.059 5.529 30.059 1.00 0.00 H ATOM 50915 H8S PA 1246 119.569 6.431 30.146 1.00 0.00 H ATOM 50916 C17 PA 1246 117.899 7.255 31.120 1.00 0.00 C ATOM 50917 H7R PA 1246 118.529 7.990 31.626 1.00 0.00 H ATOM 50918 H7S PA 1246 117.052 7.072 31.784 1.00 0.00 H ATOM 50919 C16 PA 1246 117.171 7.861 29.891 1.00 0.00 C ATOM 50920 H6R PA 1246 116.399 8.517 30.299 1.00 0.00 H ATOM 50921 H6S PA 1246 116.621 7.111 29.318 1.00 0.00 H ATOM 50922 C15 PA 1246 118.020 8.727 28.880 1.00 0.00 C ATOM 50923 H5R PA 1246 118.758 8.109 28.365 1.00 0.00 H ATOM 50924 H5S PA 1246 118.535 9.487 29.471 1.00 0.00 H ATOM 50925 C14 PA 1246 117.279 9.446 27.721 1.00 0.00 C ATOM 50926 H4R PA 1246 116.433 9.941 28.203 1.00 0.00 H ATOM 50927 H4S PA 1246 116.769 8.779 27.023 1.00 0.00 H ATOM 50928 C13 PA 1246 118.043 10.518 26.911 1.00 0.00 C ATOM 50929 H3R PA 1246 118.777 9.896 26.394 1.00 0.00 H ATOM 50930 H3S PA 1246 118.568 11.180 27.603 1.00 0.00 H ATOM 50931 C12 PA 1246 117.260 11.249 25.912 1.00 0.00 C ATOM 50932 H2R PA 1246 116.350 11.664 26.350 1.00 0.00 H ATOM 50933 H2S PA 1246 116.869 10.609 25.119 1.00 0.00 H ATOM 50934 C11 PGR 1247 118.024 12.287 25.189 1.00 0.00 C ATOM 50935 O12 PGR 1247 118.908 12.037 24.387 1.00 0.00 O ATOM 50936 O11 PGR 1247 117.646 13.525 25.488 1.00 0.00 O ATOM 50937 C1 PGR 1247 118.254 14.624 24.744 1.00 0.00 C ATOM 50938 HR PGR 1247 118.340 14.424 23.673 1.00 0.00 H ATOM 50939 HS PGR 1247 119.234 14.881 25.155 1.00 0.00 H ATOM 50940 C2 PGR 1247 117.428 15.908 25.002 1.00 0.00 C ATOM 50941 HX PGR 1247 116.414 15.535 25.167 1.00 0.00 H ATOM 50942 C3 PGR 1247 117.465 16.859 23.868 1.00 0.00 C ATOM 50943 HA PGR 1247 117.271 17.852 24.283 1.00 0.00 H ATOM 50944 HB PGR 1247 116.690 16.450 23.215 1.00 0.00 H ATOM 50945 O31 PGR 1247 118.780 16.829 23.316 1.00 0.00 O ATOM 50946 P31 PGR 1247 119.032 17.336 21.832 1.00 0.00 P ATOM 50947 O32 PGR 1247 118.827 16.011 20.916 1.00 0.00 O ATOM 50948 C31 PGR 1247 117.476 15.620 20.507 1.00 0.00 C ATOM 50949 H1A PGR 1247 117.295 16.188 19.590 1.00 0.00 H ATOM 50950 H1B PGR 1247 116.682 15.898 21.205 1.00 0.00 H ATOM 50951 C32 PGR 1247 117.505 14.104 20.233 1.00 0.00 C ATOM 50952 H2A PGR 1247 116.459 13.906 19.986 1.00 0.00 H ATOM 50953 O35 PGR 1247 117.976 13.454 21.332 1.00 0.00 O ATOM 50954 HO5A PGR 1247 118.880 13.805 21.428 1.00 0.00 H ATOM 50955 C33 PGR 1247 118.344 13.821 18.957 1.00 0.00 C ATOM 50956 H3A PGR 1247 118.159 14.583 18.195 1.00 0.00 H ATOM 50957 H3B PGR 1247 119.397 13.980 19.201 1.00 0.00 H ATOM 50958 O33 PGR 1247 118.019 18.317 21.504 1.00 0.00 O ATOM 50959 O34 PGR 1247 120.469 17.694 21.764 1.00 0.00 O ATOM 50960 O21 PGR 1247 117.718 16.605 26.253 1.00 0.00 O ATOM 50961 C21 PGR 1247 118.954 16.857 26.771 1.00 0.00 C ATOM 50962 O22 PGR 1247 120.021 16.579 26.240 1.00 0.00 O ATOM 50963 O36 PGR 1247 118.207 12.457 18.470 1.00 0.00 O ATOM 50964 HO6A PGR 1247 118.298 11.902 19.265 1.00 0.00 H ATOM 50965 C12 OL 1248 118.855 17.361 28.205 1.00 0.00 C ATOM 50966 H2R OL 1248 119.794 17.848 28.479 1.00 0.00 H ATOM 50967 H2S OL 1248 118.093 18.143 28.199 1.00 0.00 H ATOM 50968 C13 OL 1248 118.336 16.319 29.101 1.00 0.00 C ATOM 50969 H3R OL 1248 118.191 16.759 30.090 1.00 0.00 H ATOM 50970 H3S OL 1248 117.391 15.876 28.778 1.00 0.00 H ATOM 50971 C14 OL 1248 119.429 15.187 29.409 1.00 0.00 C ATOM 50972 H4R OL 1248 119.813 14.694 28.514 1.00 0.00 H ATOM 50973 H4S OL 1248 120.305 15.827 29.534 1.00 0.00 H ATOM 50974 C15 OL 1248 119.086 14.248 30.647 1.00 0.00 C ATOM 50975 H5R OL 1248 120.046 14.146 31.157 1.00 0.00 H ATOM 50976 H5S OL 1248 118.486 14.704 31.438 1.00 0.00 H ATOM 50977 C16 OL 1248 118.664 12.926 30.162 1.00 0.00 C ATOM 50978 H6R OL 1248 117.745 13.002 29.578 1.00 0.00 H ATOM 50979 H6S OL 1248 119.313 12.422 29.443 1.00 0.00 H ATOM 50980 C17 OL 1248 118.365 11.854 31.319 1.00 0.00 C ATOM 50981 H7R OL 1248 118.204 10.840 30.947 1.00 0.00 H ATOM 50982 H7S OL 1248 119.323 11.759 31.834 1.00 0.00 H ATOM 50983 C18 OL 1248 117.296 12.116 32.439 1.00 0.00 C ATOM 50984 H8R OL 1248 117.408 13.066 32.966 1.00 0.00 H ATOM 50985 H8S OL 1248 116.384 12.243 31.852 1.00 0.00 H ATOM 50986 C19 OL 1248 117.068 11.041 33.464 1.00 0.00 C ATOM 50987 H9R OL 1248 117.692 10.159 33.343 1.00 0.00 H ATOM 50988 C110 OL 1248 116.170 11.035 34.489 1.00 0.00 C ATOM 50989 H10R OL 1248 116.098 10.109 35.053 1.00 0.00 H ATOM 50990 C111 OL 1248 115.159 12.082 34.838 1.00 0.00 C ATOM 50991 H11R OL 1248 114.784 12.651 33.984 1.00 0.00 H ATOM 50992 H11S OL 1248 114.291 11.485 35.123 1.00 0.00 H ATOM 50993 C112 OL 1248 115.486 13.118 35.899 1.00 0.00 C ATOM 50994 H12R OL 1248 116.152 13.901 35.530 1.00 0.00 H ATOM 50995 H12S OL 1248 114.643 13.798 36.036 1.00 0.00 H ATOM 50996 C113 OL 1248 116.054 12.630 37.262 1.00 0.00 C ATOM 50997 H13R OL 1248 116.650 11.733 37.084 1.00 0.00 H ATOM 50998 H13S OL 1248 116.666 13.426 37.691 1.00 0.00 H ATOM 50999 C114 OL 1248 114.972 11.918 38.191 1.00 0.00 C ATOM 51000 H14R OL 1248 114.218 12.648 38.493 1.00 0.00 H ATOM 51001 H14S OL 1248 114.435 11.209 37.557 1.00 0.00 H ATOM 51002 C115 OL 1248 115.599 11.203 39.361 1.00 0.00 C ATOM 51003 H15R OL 1248 116.436 10.609 38.990 1.00 0.00 H ATOM 51004 H15S OL 1248 116.034 11.935 40.046 1.00 0.00 H ATOM 51005 C116 OL 1248 114.670 10.276 40.155 1.00 0.00 C ATOM 51006 H16R OL 1248 113.764 10.768 40.513 1.00 0.00 H ATOM 51007 H16S OL 1248 114.444 9.480 39.442 1.00 0.00 H ATOM 51008 C117 OL 1248 115.262 9.657 41.399 1.00 0.00 C ATOM 51009 H17R OL 1248 116.236 9.197 41.216 1.00 0.00 H ATOM 51010 H17S OL 1248 115.426 10.459 42.121 1.00 0.00 H ATOM 51011 C118 OL 1248 114.276 8.603 41.985 1.00 0.00 C ATOM 51012 H18R OL 1248 113.411 9.185 42.309 1.00 0.00 H ATOM 51013 H18S OL 1248 114.764 8.063 42.799 1.00 0.00 H ATOM 51014 H18T OL 1248 113.953 7.807 41.312 1.00 0.00 H TER 51015 OL 1248 ATOM 51015 C116 PA 1249 59.953 46.869 38.335 1.00 0.00 C ATOM 51016 H16R PA 1249 59.431 47.610 38.942 1.00 0.00 H ATOM 51017 H16S PA 1249 59.894 47.276 37.323 1.00 0.00 H ATOM 51018 H16T PA 1249 61.014 47.001 38.558 1.00 0.00 H ATOM 51019 C115 PA 1249 59.403 45.460 38.444 1.00 0.00 C ATOM 51020 H15R PA 1249 59.585 45.191 39.487 1.00 0.00 H ATOM 51021 H15S PA 1249 59.922 44.734 37.814 1.00 0.00 H ATOM 51022 C114 PA 1249 57.899 45.337 38.119 1.00 0.00 C ATOM 51023 H14R PA 1249 57.790 45.483 37.042 1.00 0.00 H ATOM 51024 H14S PA 1249 57.227 45.996 38.671 1.00 0.00 H ATOM 51025 C113 PA 1249 57.342 43.907 38.226 1.00 0.00 C ATOM 51026 H13R PA 1249 58.000 43.437 38.960 1.00 0.00 H ATOM 51027 H13S PA 1249 57.551 43.395 37.285 1.00 0.00 H ATOM 51028 C112 PA 1249 55.823 43.866 38.549 1.00 0.00 C ATOM 51029 H12R PA 1249 55.645 44.617 39.322 1.00 0.00 H ATOM 51030 H12S PA 1249 55.582 42.967 39.120 1.00 0.00 H ATOM 51031 C111 PA 1249 55.009 44.080 37.212 1.00 0.00 C ATOM 51032 H11R PA 1249 55.604 44.637 36.485 1.00 0.00 H ATOM 51033 H11S PA 1249 54.183 44.760 37.428 1.00 0.00 H ATOM 51034 C110 PA 1249 54.729 42.718 36.518 1.00 0.00 C ATOM 51035 H10R PA 1249 53.835 42.233 36.916 1.00 0.00 H ATOM 51036 H10S PA 1249 55.549 42.048 36.787 1.00 0.00 H ATOM 51037 C19 PA 1249 54.774 42.612 35.010 1.00 0.00 C ATOM 51038 H9R PA 1249 54.578 41.585 34.695 1.00 0.00 H ATOM 51039 H9S PA 1249 55.762 42.822 34.595 1.00 0.00 H ATOM 51040 C18 PA 1249 53.937 43.743 34.368 1.00 0.00 C ATOM 51041 H8R PA 1249 54.242 44.743 34.682 1.00 0.00 H ATOM 51042 H8S PA 1249 52.929 43.734 34.787 1.00 0.00 H ATOM 51043 C17 PA 1249 53.784 43.705 32.848 1.00 0.00 C ATOM 51044 H7R PA 1249 53.228 42.803 32.585 1.00 0.00 H ATOM 51045 H7S PA 1249 54.758 43.560 32.374 1.00 0.00 H ATOM 51046 C16 PA 1249 52.983 44.966 32.229 1.00 0.00 C ATOM 51047 H6R PA 1249 53.498 45.901 32.456 1.00 0.00 H ATOM 51048 H6S PA 1249 51.936 44.981 32.539 1.00 0.00 H ATOM 51049 C15 PA 1249 52.853 44.799 30.719 1.00 0.00 C ATOM 51050 H5R PA 1249 52.600 43.762 30.489 1.00 0.00 H ATOM 51051 H5S PA 1249 53.837 44.724 30.250 1.00 0.00 H ATOM 51052 C14 PA 1249 51.881 45.699 29.990 1.00 0.00 C ATOM 51053 H4R PA 1249 51.042 45.624 30.684 1.00 0.00 H ATOM 51054 H4S PA 1249 51.532 45.131 29.125 1.00 0.00 H ATOM 51055 C13 PA 1249 52.366 47.043 29.691 1.00 0.00 C ATOM 51056 H3R PA 1249 52.856 47.509 30.548 1.00 0.00 H ATOM 51057 H3S PA 1249 51.477 47.629 29.447 1.00 0.00 H ATOM 51058 C12 PA 1249 53.400 47.072 28.537 1.00 0.00 C ATOM 51059 H2R PA 1249 54.315 46.581 28.876 1.00 0.00 H ATOM 51060 H2S PA 1249 53.659 48.127 28.428 1.00 0.00 H ATOM 51061 C11 PGR 1250 52.758 46.792 27.157 1.00 0.00 C ATOM 51062 O12 PGR 1250 53.531 46.386 26.305 1.00 0.00 O ATOM 51063 O11 PGR 1250 51.414 46.767 27.084 1.00 0.00 O ATOM 51064 C1 PGR 1250 50.732 46.546 25.837 1.00 0.00 C ATOM 51065 HR PGR 1250 51.210 47.121 25.040 1.00 0.00 H ATOM 51066 HS PGR 1250 49.714 46.942 25.851 1.00 0.00 H ATOM 51067 C2 PGR 1250 50.707 45.061 25.434 1.00 0.00 C ATOM 51068 HX PGR 1250 51.722 44.705 25.627 1.00 0.00 H ATOM 51069 C3 PGR 1250 50.301 44.819 23.966 1.00 0.00 C ATOM 51070 HA PGR 1250 51.066 45.215 23.293 1.00 0.00 H ATOM 51071 HB PGR 1250 49.386 45.380 23.761 1.00 0.00 H ATOM 51072 O31 PGR 1250 50.173 43.471 23.539 1.00 0.00 O ATOM 51073 P31 PGR 1250 49.553 43.207 22.195 1.00 0.00 P ATOM 51074 O32 PGR 1250 50.734 43.157 21.229 1.00 0.00 O ATOM 51075 C31 PGR 1250 51.690 42.023 21.310 1.00 0.00 C ATOM 51076 H1A PGR 1250 51.088 41.112 21.259 1.00 0.00 H ATOM 51077 H1B PGR 1250 52.150 41.965 22.300 1.00 0.00 H ATOM 51078 C32 PGR 1250 52.935 42.094 20.299 1.00 0.00 C ATOM 51079 H2A PGR 1250 53.389 41.111 20.151 1.00 0.00 H ATOM 51080 O35 PGR 1250 53.937 43.010 20.787 1.00 0.00 O ATOM 51081 HO5A PGR 1250 54.532 43.308 20.076 1.00 0.00 H ATOM 51082 C33 PGR 1250 52.492 42.718 18.940 1.00 0.00 C ATOM 51083 H3A PGR 1250 51.720 42.139 18.426 1.00 0.00 H ATOM 51084 H3B PGR 1250 52.104 43.714 19.169 1.00 0.00 H ATOM 51085 O33 PGR 1250 48.911 41.858 22.238 1.00 0.00 O ATOM 51086 O34 PGR 1250 48.693 44.380 21.831 1.00 0.00 O ATOM 51087 O21 PGR 1250 49.856 44.340 26.325 1.00 0.00 O ATOM 51088 C21 PGR 1250 48.474 44.428 26.304 1.00 0.00 C ATOM 51089 O22 PGR 1250 47.785 45.184 25.659 1.00 0.00 O ATOM 51090 O36 PGR 1250 53.665 42.829 18.165 1.00 0.00 O ATOM 51091 HO6A PGR 1250 53.568 43.534 17.500 1.00 0.00 H ATOM 51092 C12 OL 1251 47.729 43.449 27.231 1.00 0.00 C ATOM 51093 H2R OL 1251 46.963 43.990 27.789 1.00 0.00 H ATOM 51094 H2S OL 1251 47.238 42.715 26.588 1.00 0.00 H ATOM 51095 C13 OL 1251 48.700 42.692 28.150 1.00 0.00 C ATOM 51096 H3R OL 1251 49.418 42.095 27.583 1.00 0.00 H ATOM 51097 H3S OL 1251 49.357 43.345 28.726 1.00 0.00 H ATOM 51098 C14 OL 1251 48.118 41.725 29.165 1.00 0.00 C ATOM 51099 H4R OL 1251 47.270 42.117 29.731 1.00 0.00 H ATOM 51100 H4S OL 1251 47.714 40.952 28.508 1.00 0.00 H ATOM 51101 C15 OL 1251 49.122 41.028 30.064 1.00 0.00 C ATOM 51102 H5R OL 1251 48.583 40.194 30.518 1.00 0.00 H ATOM 51103 H5S OL 1251 49.810 40.498 29.403 1.00 0.00 H ATOM 51104 C16 OL 1251 49.691 41.782 31.318 1.00 0.00 C ATOM 51105 H6R OL 1251 50.206 41.027 31.915 1.00 0.00 H ATOM 51106 H6S OL 1251 50.515 42.393 30.943 1.00 0.00 H ATOM 51107 C17 OL 1251 48.636 42.361 32.298 1.00 0.00 C ATOM 51108 H7R OL 1251 47.852 42.991 31.873 1.00 0.00 H ATOM 51109 H7S OL 1251 48.152 41.474 32.711 1.00 0.00 H ATOM 51110 C18 OL 1251 49.265 43.140 33.486 1.00 0.00 C ATOM 51111 H8R OL 1251 49.681 42.414 34.187 1.00 0.00 H ATOM 51112 H8S OL 1251 50.130 43.652 33.059 1.00 0.00 H ATOM 51113 C19 OL 1251 48.358 44.144 34.221 1.00 0.00 C ATOM 51114 H9R OL 1251 47.521 43.685 34.740 1.00 0.00 H ATOM 51115 C110 OL 1251 48.617 45.420 34.440 1.00 0.00 C ATOM 51116 H10R OL 1251 47.930 45.935 35.106 1.00 0.00 H ATOM 51117 C111 OL 1251 49.780 46.311 33.929 1.00 0.00 C ATOM 51118 H11R OL 1251 50.613 46.109 34.605 1.00 0.00 H ATOM 51119 H11S OL 1251 49.995 46.065 32.887 1.00 0.00 H ATOM 51120 C112 OL 1251 49.445 47.788 33.907 1.00 0.00 C ATOM 51121 H12R OL 1251 48.471 48.028 33.474 1.00 0.00 H ATOM 51122 H12S OL 1251 49.397 48.164 34.931 1.00 0.00 H ATOM 51123 C113 OL 1251 50.388 48.644 33.037 1.00 0.00 C ATOM 51124 H13R OL 1251 50.242 48.449 31.973 1.00 0.00 H ATOM 51125 H13S OL 1251 50.070 49.674 33.210 1.00 0.00 H ATOM 51126 C114 OL 1251 51.862 48.494 33.267 1.00 0.00 C ATOM 51127 H14R OL 1251 52.312 47.582 32.869 1.00 0.00 H ATOM 51128 H14S OL 1251 52.409 49.139 32.576 1.00 0.00 H ATOM 51129 C115 OL 1251 52.554 48.878 34.597 1.00 0.00 C ATOM 51130 H15R OL 1251 52.095 48.191 35.312 1.00 0.00 H ATOM 51131 H15S OL 1251 53.611 48.619 34.504 1.00 0.00 H ATOM 51132 C116 OL 1251 52.362 50.339 35.032 1.00 0.00 C ATOM 51133 H16R OL 1251 52.323 50.980 34.148 1.00 0.00 H ATOM 51134 H16S OL 1251 51.344 50.434 35.415 1.00 0.00 H ATOM 51135 C117 OL 1251 53.376 50.726 36.133 1.00 0.00 C ATOM 51136 H17R OL 1251 54.381 50.977 35.788 1.00 0.00 H ATOM 51137 H17S OL 1251 53.029 51.657 36.586 1.00 0.00 H ATOM 51138 C118 OL 1251 53.462 49.634 37.171 1.00 0.00 C ATOM 51139 H18R OL 1251 53.732 48.676 36.723 1.00 0.00 H ATOM 51140 H18S OL 1251 52.472 49.483 37.607 1.00 0.00 H ATOM 51141 H18T OL 1251 54.077 49.959 38.013 1.00 0.00 H TER 51142 OL 1251 ATOM 51142 C116 PA 1252 96.632 7.088 36.242 1.00 0.00 C ATOM 51143 H16R PA 1252 96.623 8.172 36.111 1.00 0.00 H ATOM 51144 H16S PA 1252 97.664 6.865 35.966 1.00 0.00 H ATOM 51145 H16T PA 1252 96.486 6.849 37.298 1.00 0.00 H ATOM 51146 C115 PA 1252 95.700 6.343 35.305 1.00 0.00 C ATOM 51147 H15R PA 1252 95.876 6.618 34.263 1.00 0.00 H ATOM 51148 H15S PA 1252 94.721 6.739 35.583 1.00 0.00 H ATOM 51149 C114 PA 1252 95.666 4.774 35.424 1.00 0.00 C ATOM 51150 H14R PA 1252 95.697 4.557 36.493 1.00 0.00 H ATOM 51151 H14S PA 1252 96.633 4.492 35.001 1.00 0.00 H ATOM 51152 C113 PA 1252 94.732 3.902 34.665 1.00 0.00 C ATOM 51153 H13R PA 1252 93.671 4.042 34.880 1.00 0.00 H ATOM 51154 H13S PA 1252 94.891 2.845 34.888 1.00 0.00 H ATOM 51155 C112 PA 1252 94.794 4.055 33.146 1.00 0.00 C ATOM 51156 H12R PA 1252 95.753 3.722 32.743 1.00 0.00 H ATOM 51157 H12S PA 1252 94.762 5.107 32.854 1.00 0.00 H ATOM 51158 C111 PA 1252 93.805 3.213 32.398 1.00 0.00 C ATOM 51159 H11R PA 1252 92.860 3.760 32.395 1.00 0.00 H ATOM 51160 H11S PA 1252 93.717 2.290 32.976 1.00 0.00 H ATOM 51161 C110 PA 1252 94.238 2.926 30.988 1.00 0.00 C ATOM 51162 H10R PA 1252 95.082 2.233 30.979 1.00 0.00 H ATOM 51163 H10S PA 1252 94.652 3.723 30.368 1.00 0.00 H ATOM 51164 C19 PA 1252 93.132 2.397 30.005 1.00 0.00 C ATOM 51165 H9R PA 1252 93.509 2.152 29.009 1.00 0.00 H ATOM 51166 H9S PA 1252 92.413 3.217 29.964 1.00 0.00 H ATOM 51167 C18 PA 1252 92.421 1.169 30.463 1.00 0.00 C ATOM 51168 H8R PA 1252 92.179 1.323 31.517 1.00 0.00 H ATOM 51169 H8S PA 1252 93.150 0.358 30.527 1.00 0.00 H ATOM 51170 C17 PA 1252 91.149 0.735 29.709 1.00 0.00 C ATOM 51171 H7R PA 1252 90.713 -0.123 30.226 1.00 0.00 H ATOM 51172 H7S PA 1252 91.418 0.374 28.714 1.00 0.00 H ATOM 51173 C16 PA 1252 90.075 1.767 29.647 1.00 0.00 C ATOM 51174 H6R PA 1252 89.901 2.336 30.562 1.00 0.00 H ATOM 51175 H6S PA 1252 89.133 1.269 29.407 1.00 0.00 H ATOM 51176 C15 PA 1252 90.238 2.692 28.416 1.00 0.00 C ATOM 51177 H5R PA 1252 91.091 3.361 28.548 1.00 0.00 H ATOM 51178 H5S PA 1252 89.312 3.261 28.310 1.00 0.00 H ATOM 51179 C14 PA 1252 90.508 2.080 27.060 1.00 0.00 C ATOM 51180 H4R PA 1252 90.137 1.069 26.882 1.00 0.00 H ATOM 51181 H4S PA 1252 91.573 1.845 27.010 1.00 0.00 H ATOM 51182 C13 PA 1252 90.110 3.002 25.820 1.00 0.00 C ATOM 51183 H3R PA 1252 89.028 3.137 25.866 1.00 0.00 H ATOM 51184 H3S PA 1252 90.400 2.453 24.922 1.00 0.00 H ATOM 51185 C12 PA 1252 90.755 4.319 25.794 1.00 0.00 C ATOM 51186 H2R PA 1252 91.792 4.180 26.107 1.00 0.00 H ATOM 51187 H2S PA 1252 90.309 5.012 26.510 1.00 0.00 H ATOM 51188 C11 PGR 1253 90.904 5.035 24.444 1.00 0.00 C ATOM 51189 O12 PGR 1253 91.885 4.976 23.729 1.00 0.00 O ATOM 51190 O11 PGR 1253 89.804 5.664 24.194 1.00 0.00 O ATOM 51191 C1 PGR 1253 89.702 6.083 22.772 1.00 0.00 C ATOM 51192 HR PGR 1253 89.742 5.224 22.097 1.00 0.00 H ATOM 51193 HS PGR 1253 90.448 6.846 22.537 1.00 0.00 H ATOM 51194 C2 PGR 1253 88.319 6.827 22.684 1.00 0.00 C ATOM 51195 HX PGR 1253 87.475 6.244 23.062 1.00 0.00 H ATOM 51196 C3 PGR 1253 88.031 7.114 21.160 1.00 0.00 C ATOM 51197 HA PGR 1253 87.038 7.568 21.210 1.00 0.00 H ATOM 51198 HB PGR 1253 88.004 6.202 20.558 1.00 0.00 H ATOM 51199 O31 PGR 1253 88.895 8.000 20.578 1.00 0.00 O ATOM 51200 P31 PGR 1253 88.733 8.510 19.036 1.00 0.00 P ATOM 51201 O32 PGR 1253 87.207 9.093 19.211 1.00 0.00 O ATOM 51202 C31 PGR 1253 86.892 10.281 19.813 1.00 0.00 C ATOM 51203 H1A PGR 1253 87.272 11.127 19.236 1.00 0.00 H ATOM 51204 H1B PGR 1253 87.368 10.403 20.790 1.00 0.00 H ATOM 51205 C32 PGR 1253 85.361 10.380 19.945 1.00 0.00 C ATOM 51206 H2A PGR 1253 84.998 9.484 20.457 1.00 0.00 H ATOM 51207 O35 PGR 1253 84.710 10.510 18.708 1.00 0.00 O ATOM 51208 HO5A PGR 1253 84.368 9.641 18.431 1.00 0.00 H ATOM 51209 C33 PGR 1253 84.952 11.580 20.787 1.00 0.00 C ATOM 51210 H3A PGR 1253 83.863 11.506 20.836 1.00 0.00 H ATOM 51211 H3B PGR 1253 85.285 11.522 21.827 1.00 0.00 H ATOM 51212 O33 PGR 1253 89.624 9.651 18.880 1.00 0.00 O ATOM 51213 O34 PGR 1253 88.729 7.404 18.048 1.00 0.00 O ATOM 51214 O21 PGR 1253 88.388 8.076 23.377 1.00 0.00 O ATOM 51215 C21 PGR 1253 87.269 8.779 23.516 1.00 0.00 C ATOM 51216 O22 PGR 1253 86.177 8.397 23.154 1.00 0.00 O ATOM 51217 O36 PGR 1253 85.355 12.793 20.199 1.00 0.00 O ATOM 51218 HO6A PGR 1253 86.286 12.909 20.461 1.00 0.00 H ATOM 51219 C12 OL 1254 87.503 10.136 24.184 1.00 0.00 C ATOM 51220 H2R OL 1254 86.706 10.747 23.753 1.00 0.00 H ATOM 51221 H2S OL 1254 87.280 10.067 25.251 1.00 0.00 H ATOM 51222 C13 OL 1254 88.782 10.776 23.803 1.00 0.00 C ATOM 51223 H3R OL 1254 89.634 10.103 23.682 1.00 0.00 H ATOM 51224 H3S OL 1254 88.629 11.204 22.810 1.00 0.00 H ATOM 51225 C14 OL 1254 89.262 11.911 24.737 1.00 0.00 C ATOM 51226 H4R OL 1254 89.424 12.812 24.141 1.00 0.00 H ATOM 51227 H4S OL 1254 88.436 12.187 25.397 1.00 0.00 H ATOM 51228 C15 OL 1254 90.495 11.607 25.624 1.00 0.00 C ATOM 51229 H5R OL 1254 90.208 11.027 26.503 1.00 0.00 H ATOM 51230 H5S OL 1254 91.211 10.971 25.099 1.00 0.00 H ATOM 51231 C16 OL 1254 91.311 12.869 26.128 1.00 0.00 C ATOM 51232 H6R OL 1254 91.312 13.684 25.400 1.00 0.00 H ATOM 51233 H6S OL 1254 90.656 13.397 26.824 1.00 0.00 H ATOM 51234 C17 OL 1254 92.758 12.557 26.493 1.00 0.00 C ATOM 51235 H7R OL 1254 92.740 11.898 27.364 1.00 0.00 H ATOM 51236 H7S OL 1254 93.102 11.872 25.716 1.00 0.00 H ATOM 51237 C18 OL 1254 93.630 13.779 26.596 1.00 0.00 C ATOM 51238 H8R OL 1254 94.633 13.587 26.982 1.00 0.00 H ATOM 51239 H8S OL 1254 93.850 14.192 25.610 1.00 0.00 H ATOM 51240 C19 OL 1254 93.136 14.800 27.544 1.00 0.00 C ATOM 51241 H9R OL 1254 92.294 14.485 28.155 1.00 0.00 H ATOM 51242 C110 OL 1254 93.652 16.022 27.795 1.00 0.00 C ATOM 51243 H10R OL 1254 93.241 16.604 28.616 1.00 0.00 H ATOM 51244 C111 OL 1254 94.772 16.652 27.109 1.00 0.00 C ATOM 51245 H11R OL 1254 95.389 16.057 26.432 1.00 0.00 H ATOM 51246 H11S OL 1254 94.269 17.391 26.482 1.00 0.00 H ATOM 51247 C112 OL 1254 95.743 17.342 28.041 1.00 0.00 C ATOM 51248 H12R OL 1254 96.529 17.898 27.526 1.00 0.00 H ATOM 51249 H12S OL 1254 95.208 18.039 28.689 1.00 0.00 H ATOM 51250 C113 OL 1254 96.343 16.178 28.931 1.00 0.00 C ATOM 51251 H13R OL 1254 95.667 15.858 29.726 1.00 0.00 H ATOM 51252 H13S OL 1254 96.549 15.266 28.367 1.00 0.00 H ATOM 51253 C114 OL 1254 97.527 16.786 29.748 1.00 0.00 C ATOM 51254 H14R OL 1254 98.300 17.291 29.165 1.00 0.00 H ATOM 51255 H14S OL 1254 97.037 17.548 30.357 1.00 0.00 H ATOM 51256 C115 OL 1254 98.195 15.945 30.757 1.00 0.00 C ATOM 51257 H15R OL 1254 97.591 15.808 31.657 1.00 0.00 H ATOM 51258 H15S OL 1254 98.388 14.969 30.308 1.00 0.00 H ATOM 51259 C116 OL 1254 99.593 16.495 31.203 1.00 0.00 C ATOM 51260 H16R OL 1254 100.233 16.708 30.344 1.00 0.00 H ATOM 51261 H16S OL 1254 99.483 17.503 31.609 1.00 0.00 H ATOM 51262 C117 OL 1254 100.266 15.570 32.215 1.00 0.00 C ATOM 51263 H17R OL 1254 99.612 15.526 33.089 1.00 0.00 H ATOM 51264 H17S OL 1254 100.257 14.542 31.846 1.00 0.00 H ATOM 51265 C118 OL 1254 101.694 15.947 32.705 1.00 0.00 C ATOM 51266 H18R OL 1254 101.713 17.026 32.871 1.00 0.00 H ATOM 51267 H18S OL 1254 102.459 15.544 32.039 1.00 0.00 H ATOM 51268 H18T OL 1254 101.854 15.525 33.699 1.00 0.00 H TER 51269 OL 1254 ATOM 51269 C116 PA 1255 31.754 32.820 44.044 1.00 0.00 C ATOM 51270 H16R PA 1255 31.427 31.872 43.613 1.00 0.00 H ATOM 51271 H16S PA 1255 31.061 32.930 44.880 1.00 0.00 H ATOM 51272 H16T PA 1255 32.753 32.709 44.471 1.00 0.00 H ATOM 51273 C115 PA 1255 31.618 33.888 42.945 1.00 0.00 C ATOM 51274 H15R PA 1255 32.265 34.706 43.270 1.00 0.00 H ATOM 51275 H15S PA 1255 30.615 34.305 42.827 1.00 0.00 H ATOM 51276 C114 PA 1255 31.892 33.357 41.593 1.00 0.00 C ATOM 51277 H14R PA 1255 31.074 32.690 41.317 1.00 0.00 H ATOM 51278 H14S PA 1255 32.778 32.720 41.541 1.00 0.00 H ATOM 51279 C113 PA 1255 32.072 34.431 40.553 1.00 0.00 C ATOM 51280 H13R PA 1255 32.709 35.179 41.029 1.00 0.00 H ATOM 51281 H13S PA 1255 31.066 34.849 40.473 1.00 0.00 H ATOM 51282 C112 PA 1255 32.578 33.924 39.237 1.00 0.00 C ATOM 51283 H12R PA 1255 31.962 33.101 38.867 1.00 0.00 H ATOM 51284 H12S PA 1255 33.591 33.521 39.301 1.00 0.00 H ATOM 51285 C111 PA 1255 32.621 34.995 38.223 1.00 0.00 C ATOM 51286 H11R PA 1255 33.138 35.863 38.636 1.00 0.00 H ATOM 51287 H11S PA 1255 31.654 35.499 38.162 1.00 0.00 H ATOM 51288 C110 PA 1255 33.333 34.516 36.964 1.00 0.00 C ATOM 51289 H10R PA 1255 32.756 33.669 36.587 1.00 0.00 H ATOM 51290 H10S PA 1255 34.271 33.998 37.174 1.00 0.00 H ATOM 51291 C19 PA 1255 33.524 35.506 35.807 1.00 0.00 C ATOM 51292 H9R PA 1255 34.177 36.322 36.122 1.00 0.00 H ATOM 51293 H9S PA 1255 32.592 35.952 35.452 1.00 0.00 H ATOM 51294 C18 PA 1255 34.145 34.995 34.519 1.00 0.00 C ATOM 51295 H8R PA 1255 33.551 34.220 34.030 1.00 0.00 H ATOM 51296 H8S PA 1255 35.148 34.598 34.687 1.00 0.00 H ATOM 51297 C17 PA 1255 34.267 36.104 33.478 1.00 0.00 C ATOM 51298 H7R PA 1255 34.977 36.855 33.832 1.00 0.00 H ATOM 51299 H7S PA 1255 33.324 36.652 33.433 1.00 0.00 H ATOM 51300 C16 PA 1255 34.790 35.621 32.110 1.00 0.00 C ATOM 51301 H6R PA 1255 33.933 35.219 31.565 1.00 0.00 H ATOM 51302 H6S PA 1255 35.376 34.716 32.283 1.00 0.00 H ATOM 51303 C15 PA 1255 35.543 36.593 31.217 1.00 0.00 C ATOM 51304 H5R PA 1255 36.587 36.343 31.017 1.00 0.00 H ATOM 51305 H5S PA 1255 35.663 37.589 31.650 1.00 0.00 H ATOM 51306 C14 PA 1255 34.913 36.725 29.861 1.00 0.00 C ATOM 51307 H4R PA 1255 33.836 36.794 30.028 1.00 0.00 H ATOM 51308 H4S PA 1255 35.029 35.838 29.235 1.00 0.00 H ATOM 51309 C13 PA 1255 35.564 37.915 29.020 1.00 0.00 C ATOM 51310 H3R PA 1255 35.383 38.814 29.612 1.00 0.00 H ATOM 51311 H3S PA 1255 34.928 38.010 28.138 1.00 0.00 H ATOM 51312 C12 PA 1255 37.057 37.929 28.681 1.00 0.00 C ATOM 51313 H2R PA 1255 37.610 37.834 29.619 1.00 0.00 H ATOM 51314 H2S PA 1255 37.352 38.895 28.266 1.00 0.00 H ATOM 51315 C11 PGR 1256 37.412 36.954 27.600 1.00 0.00 C ATOM 51316 O12 PGR 1256 38.562 36.624 27.391 1.00 0.00 O ATOM 51317 O11 PGR 1256 36.314 36.714 26.762 1.00 0.00 O ATOM 51318 C1 PGR 1256 36.659 35.837 25.639 1.00 0.00 C ATOM 51319 HR PGR 1256 37.214 34.958 25.976 1.00 0.00 H ATOM 51320 HS PGR 1256 37.360 36.417 25.032 1.00 0.00 H ATOM 51321 C2 PGR 1256 35.445 35.298 24.941 1.00 0.00 C ATOM 51322 HX PGR 1256 35.629 34.344 24.439 1.00 0.00 H ATOM 51323 C3 PGR 1256 34.891 36.228 23.844 1.00 0.00 C ATOM 51324 HA PGR 1256 35.565 36.175 22.985 1.00 0.00 H ATOM 51325 HB PGR 1256 34.802 37.131 24.455 1.00 0.00 H ATOM 51326 O31 PGR 1256 33.668 35.776 23.457 1.00 0.00 O ATOM 51327 P31 PGR 1256 32.661 36.806 22.691 1.00 0.00 P ATOM 51328 O32 PGR 1256 32.317 37.819 23.822 1.00 0.00 O ATOM 51329 C31 PGR 1256 31.641 37.436 24.945 1.00 0.00 C ATOM 51330 H1A PGR 1256 32.097 36.525 25.341 1.00 0.00 H ATOM 51331 H1B PGR 1256 30.609 37.107 24.794 1.00 0.00 H ATOM 51332 C32 PGR 1256 31.685 38.497 25.995 1.00 0.00 C ATOM 51333 H2A PGR 1256 31.109 38.110 26.839 1.00 0.00 H ATOM 51334 O35 PGR 1256 31.049 39.734 25.536 1.00 0.00 O ATOM 51335 HO5A PGR 1256 31.591 40.032 24.784 1.00 0.00 H ATOM 51336 C33 PGR 1256 33.075 38.883 26.435 1.00 0.00 C ATOM 51337 H3A PGR 1256 33.171 39.221 27.470 1.00 0.00 H ATOM 51338 H3B PGR 1256 33.597 37.926 26.357 1.00 0.00 H ATOM 51339 O33 PGR 1256 33.466 37.509 21.674 1.00 0.00 O ATOM 51340 O34 PGR 1256 31.389 36.113 22.238 1.00 0.00 O ATOM 51341 O21 PGR 1256 34.400 35.136 25.938 1.00 0.00 O ATOM 51342 C21 PGR 1256 34.358 33.897 26.538 1.00 0.00 C ATOM 51343 O22 PGR 1256 35.203 33.021 26.463 1.00 0.00 O ATOM 51344 O36 PGR 1256 33.758 39.828 25.562 1.00 0.00 O ATOM 51345 HO6A PGR 1256 33.764 39.442 24.668 1.00 0.00 H ATOM 51346 C12 OL 1257 33.154 33.621 27.313 1.00 0.00 C ATOM 51347 H2R OL 1257 32.636 32.831 26.765 1.00 0.00 H ATOM 51348 H2S OL 1257 33.445 33.189 28.273 1.00 0.00 H ATOM 51349 C13 OL 1257 32.225 34.827 27.576 1.00 0.00 C ATOM 51350 H3R OL 1257 32.806 35.611 28.066 1.00 0.00 H ATOM 51351 H3S OL 1257 31.802 35.237 26.656 1.00 0.00 H ATOM 51352 C14 OL 1257 31.026 34.513 28.595 1.00 0.00 C ATOM 51353 H4R OL 1257 30.329 35.348 28.499 1.00 0.00 H ATOM 51354 H4S OL 1257 30.530 33.559 28.406 1.00 0.00 H ATOM 51355 C15 OL 1257 31.522 34.242 30.015 1.00 0.00 C ATOM 51356 H5R OL 1257 32.150 33.351 30.070 1.00 0.00 H ATOM 51357 H5S OL 1257 32.111 35.077 30.401 1.00 0.00 H ATOM 51358 C16 OL 1257 30.281 33.962 30.990 1.00 0.00 C ATOM 51359 H6R OL 1257 29.687 34.874 31.068 1.00 0.00 H ATOM 51360 H6S OL 1257 29.677 33.105 30.685 1.00 0.00 H ATOM 51361 C17 OL 1257 30.716 33.457 32.397 1.00 0.00 C ATOM 51362 H7R OL 1257 30.650 32.380 32.564 1.00 0.00 H ATOM 51363 H7S OL 1257 31.803 33.526 32.463 1.00 0.00 H ATOM 51364 C18 OL 1257 30.056 34.225 33.493 1.00 0.00 C ATOM 51365 H8R OL 1257 28.970 34.193 33.386 1.00 0.00 H ATOM 51366 H8S OL 1257 30.278 33.805 34.476 1.00 0.00 H ATOM 51367 C19 OL 1257 30.680 35.610 33.449 1.00 0.00 C ATOM 51368 H9R OL 1257 31.761 35.493 33.443 1.00 0.00 H ATOM 51369 C110 OL 1257 30.014 36.767 33.621 1.00 0.00 C ATOM 51370 H10R OL 1257 30.557 37.709 33.594 1.00 0.00 H ATOM 51371 C111 OL 1257 28.554 36.970 33.972 1.00 0.00 C ATOM 51372 H11R OL 1257 28.238 37.995 33.766 1.00 0.00 H ATOM 51373 H11S OL 1257 27.922 36.407 33.282 1.00 0.00 H ATOM 51374 C112 OL 1257 28.157 36.446 35.411 1.00 0.00 C ATOM 51375 H12R OL 1257 27.071 36.354 35.473 1.00 0.00 H ATOM 51376 H12S OL 1257 28.483 35.419 35.588 1.00 0.00 H ATOM 51377 C113 OL 1257 28.508 37.363 36.508 1.00 0.00 C ATOM 51378 H13R OL 1257 29.527 37.754 36.479 1.00 0.00 H ATOM 51379 H13S OL 1257 27.930 38.290 36.502 1.00 0.00 H ATOM 51380 C114 OL 1257 28.130 36.692 37.864 1.00 0.00 C ATOM 51381 H14R OL 1257 27.055 36.498 37.866 1.00 0.00 H ATOM 51382 H14S OL 1257 28.558 35.723 38.131 1.00 0.00 H ATOM 51383 C115 OL 1257 28.440 37.553 39.076 1.00 0.00 C ATOM 51384 H15R OL 1257 29.455 37.944 38.986 1.00 0.00 H ATOM 51385 H15S OL 1257 27.893 38.491 38.964 1.00 0.00 H ATOM 51386 C116 OL 1257 28.300 36.823 40.449 1.00 0.00 C ATOM 51387 H16R OL 1257 27.415 36.191 40.539 1.00 0.00 H ATOM 51388 H16S OL 1257 29.076 36.058 40.518 1.00 0.00 H ATOM 51389 C117 OL 1257 28.301 37.711 41.728 1.00 0.00 C ATOM 51390 H17R OL 1257 29.340 38.042 41.780 1.00 0.00 H ATOM 51391 H17S OL 1257 27.565 38.514 41.649 1.00 0.00 H ATOM 51392 C118 OL 1257 27.973 36.900 42.990 1.00 0.00 C ATOM 51393 H18R OL 1257 28.710 36.102 43.102 1.00 0.00 H ATOM 51394 H18S OL 1257 26.958 36.498 43.014 1.00 0.00 H ATOM 51395 H18T OL 1257 27.952 37.467 43.923 1.00 0.00 H TER 51396 OL 1257 ATOM 51396 C116 PA 1258 78.836 44.298 37.631 1.00 0.00 C ATOM 51397 H16R PA 1258 78.782 45.244 38.174 1.00 0.00 H ATOM 51398 H16S PA 1258 79.688 43.661 37.877 1.00 0.00 H ATOM 51399 H16T PA 1258 77.914 43.822 37.973 1.00 0.00 H ATOM 51400 C115 PA 1258 78.767 44.802 36.234 1.00 0.00 C ATOM 51401 H15R PA 1258 79.637 45.419 35.996 1.00 0.00 H ATOM 51402 H15S PA 1258 77.917 45.487 36.206 1.00 0.00 H ATOM 51403 C114 PA 1258 78.661 43.622 35.216 1.00 0.00 C ATOM 51404 H14R PA 1258 78.112 42.708 35.453 1.00 0.00 H ATOM 51405 H14S PA 1258 79.685 43.256 35.117 1.00 0.00 H ATOM 51406 C113 PA 1258 78.238 44.208 33.790 1.00 0.00 C ATOM 51407 H13R PA 1258 78.865 45.101 33.745 1.00 0.00 H ATOM 51408 H13S PA 1258 77.204 44.554 33.726 1.00 0.00 H ATOM 51409 C112 PA 1258 78.482 43.239 32.670 1.00 0.00 C ATOM 51410 H12R PA 1258 79.551 43.021 32.711 1.00 0.00 H ATOM 51411 H12S PA 1258 78.302 43.605 31.657 1.00 0.00 H ATOM 51412 C111 PA 1258 77.704 41.955 32.818 1.00 0.00 C ATOM 51413 H11R PA 1258 76.686 42.198 33.128 1.00 0.00 H ATOM 51414 H11S PA 1258 78.175 41.305 33.560 1.00 0.00 H ATOM 51415 C110 PA 1258 77.653 41.167 31.550 1.00 0.00 C ATOM 51416 H10R PA 1258 78.635 41.068 31.084 1.00 0.00 H ATOM 51417 H10S PA 1258 77.114 41.613 30.712 1.00 0.00 H ATOM 51418 C19 PA 1258 77.289 39.726 31.688 1.00 0.00 C ATOM 51419 H9R PA 1258 78.075 39.212 32.246 1.00 0.00 H ATOM 51420 H9S PA 1258 77.286 39.390 30.649 1.00 0.00 H ATOM 51421 C18 PA 1258 75.885 39.335 32.249 1.00 0.00 C ATOM 51422 H8R PA 1258 75.061 39.923 31.840 1.00 0.00 H ATOM 51423 H8S PA 1258 75.766 39.738 33.257 1.00 0.00 H ATOM 51424 C17 PA 1258 75.527 37.846 32.084 1.00 0.00 C ATOM 51425 H7R PA 1258 74.730 37.712 32.818 1.00 0.00 H ATOM 51426 H7S PA 1258 76.304 37.179 32.465 1.00 0.00 H ATOM 51427 C16 PA 1258 75.137 37.371 30.679 1.00 0.00 C ATOM 51428 H6R PA 1258 76.082 37.469 30.142 1.00 0.00 H ATOM 51429 H6S PA 1258 74.510 38.086 30.142 1.00 0.00 H ATOM 51430 C15 PA 1258 74.572 35.993 30.519 1.00 0.00 C ATOM 51431 H5R PA 1258 73.802 35.812 31.272 1.00 0.00 H ATOM 51432 H5S PA 1258 75.417 35.349 30.770 1.00 0.00 H ATOM 51433 C14 PA 1258 74.047 35.654 29.123 1.00 0.00 C ATOM 51434 H4R PA 1258 73.110 36.184 28.938 1.00 0.00 H ATOM 51435 H4S PA 1258 73.846 34.590 28.987 1.00 0.00 H ATOM 51436 C13 PA 1258 75.143 35.863 27.986 1.00 0.00 C ATOM 51437 H3R PA 1258 76.099 35.420 28.273 1.00 0.00 H ATOM 51438 H3S PA 1258 75.354 36.922 27.828 1.00 0.00 H ATOM 51439 C12 PA 1258 74.838 35.153 26.686 1.00 0.00 C ATOM 51440 H2R PA 1258 73.883 35.550 26.337 1.00 0.00 H ATOM 51441 H2S PA 1258 74.644 34.135 27.028 1.00 0.00 H ATOM 51442 C11 PGR 1259 75.828 35.150 25.560 1.00 0.00 C ATOM 51443 O12 PGR 1259 75.719 34.548 24.496 1.00 0.00 O ATOM 51444 O11 PGR 1259 76.867 35.936 25.783 1.00 0.00 O ATOM 51445 C1 PGR 1259 77.910 35.966 24.766 1.00 0.00 C ATOM 51446 HR PGR 1259 77.483 36.336 23.830 1.00 0.00 H ATOM 51447 HS PGR 1259 78.178 34.909 24.700 1.00 0.00 H ATOM 51448 C2 PGR 1259 79.012 36.931 25.282 1.00 0.00 C ATOM 51449 HX PGR 1259 78.528 37.818 25.699 1.00 0.00 H ATOM 51450 C3 PGR 1259 79.941 37.306 24.097 1.00 0.00 C ATOM 51451 HA PGR 1259 79.402 37.690 23.226 1.00 0.00 H ATOM 51452 HB PGR 1259 80.345 36.365 23.716 1.00 0.00 H ATOM 51453 O31 PGR 1259 80.999 38.209 24.344 1.00 0.00 O ATOM 51454 P31 PGR 1259 80.949 39.719 24.839 1.00 0.00 P ATOM 51455 O32 PGR 1259 80.426 39.627 26.396 1.00 0.00 O ATOM 51456 C31 PGR 1259 81.331 39.242 27.385 1.00 0.00 C ATOM 51457 H1A PGR 1259 82.293 39.748 27.270 1.00 0.00 H ATOM 51458 H1B PGR 1259 81.557 38.175 27.315 1.00 0.00 H ATOM 51459 C32 PGR 1259 80.843 39.592 28.746 1.00 0.00 C ATOM 51460 H2A PGR 1259 81.088 38.797 29.455 1.00 0.00 H ATOM 51461 O35 PGR 1259 79.419 39.597 28.635 1.00 0.00 O ATOM 51462 HO5A PGR 1259 79.094 38.679 28.646 1.00 0.00 H ATOM 51463 C33 PGR 1259 81.234 41.004 29.270 1.00 0.00 C ATOM 51464 H3A PGR 1259 80.714 41.112 30.225 1.00 0.00 H ATOM 51465 H3B PGR 1259 82.283 41.001 29.577 1.00 0.00 H ATOM 51466 O33 PGR 1259 82.251 40.339 24.677 1.00 0.00 O ATOM 51467 O34 PGR 1259 79.829 40.342 24.063 1.00 0.00 O ATOM 51468 O21 PGR 1259 79.859 36.246 26.206 1.00 0.00 O ATOM 51469 C21 PGR 1259 79.692 36.408 27.482 1.00 0.00 C ATOM 51470 O22 PGR 1259 78.845 37.063 28.050 1.00 0.00 O ATOM 51471 O36 PGR 1259 80.861 42.081 28.319 1.00 0.00 O ATOM 51472 HO6A PGR 1259 81.524 42.263 27.629 1.00 0.00 H ATOM 51473 C12 OL 1260 80.798 35.627 28.179 1.00 0.00 C ATOM 51474 H2R OL 1260 81.613 35.304 27.529 1.00 0.00 H ATOM 51475 H2S OL 1260 81.210 36.363 28.872 1.00 0.00 H ATOM 51476 C13 OL 1260 80.167 34.483 29.055 1.00 0.00 C ATOM 51477 H3R OL 1260 81.057 34.097 29.556 1.00 0.00 H ATOM 51478 H3S OL 1260 79.407 34.867 29.739 1.00 0.00 H ATOM 51479 C14 OL 1260 79.641 33.331 28.190 1.00 0.00 C ATOM 51480 H4R OL 1260 79.005 33.785 27.427 1.00 0.00 H ATOM 51481 H4S OL 1260 80.386 32.785 27.608 1.00 0.00 H ATOM 51482 C15 OL 1260 78.775 32.289 28.964 1.00 0.00 C ATOM 51483 H5R OL 1260 78.487 31.509 28.256 1.00 0.00 H ATOM 51484 H5S OL 1260 79.448 31.855 29.707 1.00 0.00 H ATOM 51485 C16 OL 1260 77.640 32.748 29.738 1.00 0.00 C ATOM 51486 H6R OL 1260 77.679 33.514 30.515 1.00 0.00 H ATOM 51487 H6S OL 1260 77.065 33.230 28.945 1.00 0.00 H ATOM 51488 C17 OL 1260 76.809 31.630 30.383 1.00 0.00 C ATOM 51489 H7R OL 1260 75.762 31.906 30.242 1.00 0.00 H ATOM 51490 H7S OL 1260 76.884 30.628 29.955 1.00 0.00 H ATOM 51491 C18 OL 1260 77.062 31.547 31.921 1.00 0.00 C ATOM 51492 H8R OL 1260 78.083 31.412 32.283 1.00 0.00 H ATOM 51493 H8S OL 1260 76.774 32.538 32.279 1.00 0.00 H ATOM 51494 C19 OL 1260 76.341 30.373 32.652 1.00 0.00 C ATOM 51495 H9R OL 1260 76.563 29.382 32.266 1.00 0.00 H ATOM 51496 C110 OL 1260 75.550 30.542 33.742 1.00 0.00 C ATOM 51497 H10R OL 1260 75.414 29.646 34.342 1.00 0.00 H ATOM 51498 C111 OL 1260 75.211 31.844 34.521 1.00 0.00 C ATOM 51499 H11R OL 1260 75.428 32.765 33.976 1.00 0.00 H ATOM 51500 H11S OL 1260 74.128 31.945 34.621 1.00 0.00 H ATOM 51501 C112 OL 1260 75.855 31.919 35.895 1.00 0.00 C ATOM 51502 H12R OL 1260 75.298 32.688 36.434 1.00 0.00 H ATOM 51503 H12S OL 1260 75.842 30.927 36.351 1.00 0.00 H ATOM 51504 C113 OL 1260 77.306 32.506 35.792 1.00 0.00 C ATOM 51505 H13R OL 1260 77.975 32.110 35.025 1.00 0.00 H ATOM 51506 H13S OL 1260 77.156 33.500 35.365 1.00 0.00 H ATOM 51507 C114 OL 1260 78.044 32.697 37.111 1.00 0.00 C ATOM 51508 H14R OL 1260 78.788 33.494 37.063 1.00 0.00 H ATOM 51509 H14S OL 1260 77.382 32.990 37.929 1.00 0.00 H ATOM 51510 C115 OL 1260 78.902 31.389 37.552 1.00 0.00 C ATOM 51511 H15R OL 1260 78.222 30.575 37.812 1.00 0.00 H ATOM 51512 H15S OL 1260 79.423 31.053 36.653 1.00 0.00 H ATOM 51513 C116 OL 1260 79.856 31.707 38.684 1.00 0.00 C ATOM 51514 H16R OL 1260 80.434 30.806 38.899 1.00 0.00 H ATOM 51515 H16S OL 1260 80.425 32.633 38.569 1.00 0.00 H ATOM 51516 C117 OL 1260 79.090 31.812 40.011 1.00 0.00 C ATOM 51517 H17R OL 1260 78.188 32.415 39.888 1.00 0.00 H ATOM 51518 H17S OL 1260 78.542 30.887 40.200 1.00 0.00 H ATOM 51519 C118 OL 1260 79.981 32.416 41.145 1.00 0.00 C ATOM 51520 H18R OL 1260 79.517 32.548 42.125 1.00 0.00 H ATOM 51521 H18S OL 1260 80.539 33.309 40.855 1.00 0.00 H ATOM 51522 H18T OL 1260 80.810 31.707 41.186 1.00 0.00 H TER 51523 OL 1260 ATOM 51523 C116 PA 1261 143.756 76.805 45.238 1.00 0.00 C ATOM 51524 H16R PA 1261 143.969 75.774 45.528 1.00 0.00 H ATOM 51525 H16S PA 1261 142.797 77.221 45.552 1.00 0.00 H ATOM 51526 H16T PA 1261 144.424 77.413 45.851 1.00 0.00 H ATOM 51527 C115 PA 1261 144.111 76.918 43.769 1.00 0.00 C ATOM 51528 H15R PA 1261 143.305 76.488 43.170 1.00 0.00 H ATOM 51529 H15S PA 1261 145.018 76.337 43.590 1.00 0.00 H ATOM 51530 C114 PA 1261 144.464 78.385 43.522 1.00 0.00 C ATOM 51531 H14R PA 1261 145.180 78.700 44.284 1.00 0.00 H ATOM 51532 H14S PA 1261 143.486 78.789 43.793 1.00 0.00 H ATOM 51533 C113 PA 1261 144.909 78.700 42.141 1.00 0.00 C ATOM 51534 H13R PA 1261 144.185 78.323 41.415 1.00 0.00 H ATOM 51535 H13S PA 1261 145.860 78.257 41.839 1.00 0.00 H ATOM 51536 C112 PA 1261 144.804 80.205 41.790 1.00 0.00 C ATOM 51537 H12R PA 1261 145.508 80.828 42.347 1.00 0.00 H ATOM 51538 H12S PA 1261 143.822 80.589 42.072 1.00 0.00 H ATOM 51539 C111 PA 1261 145.055 80.460 40.316 1.00 0.00 C ATOM 51540 H11R PA 1261 144.225 80.029 39.753 1.00 0.00 H ATOM 51541 H11S PA 1261 145.943 79.912 39.994 1.00 0.00 H ATOM 51542 C110 PA 1261 145.399 81.893 39.952 1.00 0.00 C ATOM 51543 H10R PA 1261 145.761 82.002 38.928 1.00 0.00 H ATOM 51544 H10S PA 1261 146.224 82.280 40.554 1.00 0.00 H ATOM 51545 C19 PA 1261 144.311 82.947 40.258 1.00 0.00 C ATOM 51546 H9R PA 1261 143.985 82.920 41.300 1.00 0.00 H ATOM 51547 H9S PA 1261 143.477 82.711 39.594 1.00 0.00 H ATOM 51548 C18 PA 1261 144.833 84.305 40.062 1.00 0.00 C ATOM 51549 H8R PA 1261 145.402 84.513 39.154 1.00 0.00 H ATOM 51550 H8S PA 1261 145.455 84.531 40.931 1.00 0.00 H ATOM 51551 C17 PA 1261 143.765 85.345 40.285 1.00 0.00 C ATOM 51552 H7R PA 1261 144.219 86.338 40.302 1.00 0.00 H ATOM 51553 H7S PA 1261 143.157 85.230 41.184 1.00 0.00 H ATOM 51554 C16 PA 1261 142.948 85.467 39.033 1.00 0.00 C ATOM 51555 H6R PA 1261 142.599 84.516 38.627 1.00 0.00 H ATOM 51556 H6S PA 1261 143.515 85.951 38.235 1.00 0.00 H ATOM 51557 C15 PA 1261 141.727 86.289 39.350 1.00 0.00 C ATOM 51558 H5R PA 1261 142.105 87.226 39.765 1.00 0.00 H ATOM 51559 H5S PA 1261 141.123 85.996 40.211 1.00 0.00 H ATOM 51560 C14 PA 1261 140.704 86.556 38.224 1.00 0.00 C ATOM 51561 H4R PA 1261 141.199 87.254 37.545 1.00 0.00 H ATOM 51562 H4S PA 1261 139.831 87.089 38.607 1.00 0.00 H ATOM 51563 C13 PA 1261 140.370 85.315 37.482 1.00 0.00 C ATOM 51564 H3R PA 1261 139.877 84.577 38.119 1.00 0.00 H ATOM 51565 H3S PA 1261 141.255 84.840 37.054 1.00 0.00 H ATOM 51566 C12 PA 1261 139.461 85.652 36.325 1.00 0.00 C ATOM 51567 H2R PA 1261 138.538 86.102 36.696 1.00 0.00 H ATOM 51568 H2S PA 1261 140.007 86.348 35.685 1.00 0.00 H ATOM 51569 C11 PGR 1262 139.227 84.372 35.538 1.00 0.00 C ATOM 51570 O12 PGR 1262 140.026 83.574 35.226 1.00 0.00 O ATOM 51571 O11 PGR 1262 137.938 84.244 35.269 1.00 0.00 O ATOM 51572 C1 PGR 1262 137.501 83.018 34.653 1.00 0.00 C ATOM 51573 HR PGR 1262 137.575 82.168 35.336 1.00 0.00 H ATOM 51574 HS PGR 1262 138.108 82.758 33.783 1.00 0.00 H ATOM 51575 C2 PGR 1262 136.059 83.204 34.054 1.00 0.00 C ATOM 51576 HX PGR 1262 135.727 82.235 33.673 1.00 0.00 H ATOM 51577 C3 PGR 1262 135.948 84.260 33.020 1.00 0.00 C ATOM 51578 HA PGR 1262 136.436 85.179 33.354 1.00 0.00 H ATOM 51579 HB PGR 1262 134.915 84.613 32.965 1.00 0.00 H ATOM 51580 O31 PGR 1262 136.402 83.825 31.669 1.00 0.00 O ATOM 51581 P31 PGR 1262 136.111 84.883 30.478 1.00 0.00 P ATOM 51582 O32 PGR 1262 134.639 84.854 30.273 1.00 0.00 O ATOM 51583 C31 PGR 1262 133.988 83.767 29.602 1.00 0.00 C ATOM 51584 H1A PGR 1262 134.334 83.701 28.567 1.00 0.00 H ATOM 51585 H1B PGR 1262 132.948 84.100 29.546 1.00 0.00 H ATOM 51586 C32 PGR 1262 133.948 82.406 30.312 1.00 0.00 C ATOM 51587 H2A PGR 1262 133.736 82.511 31.379 1.00 0.00 H ATOM 51588 O35 PGR 1262 135.012 81.501 30.024 1.00 0.00 O ATOM 51589 HO5A PGR 1262 134.754 81.243 29.120 1.00 0.00 H ATOM 51590 C33 PGR 1262 132.773 81.657 29.699 1.00 0.00 C ATOM 51591 H3A PGR 1262 132.627 80.817 30.383 1.00 0.00 H ATOM 51592 H3B PGR 1262 131.925 82.346 29.720 1.00 0.00 H ATOM 51593 O33 PGR 1262 136.594 86.264 30.756 1.00 0.00 O ATOM 51594 O34 PGR 1262 136.714 84.193 29.282 1.00 0.00 O ATOM 51595 O21 PGR 1262 135.196 83.686 35.124 1.00 0.00 O ATOM 51596 C21 PGR 1262 134.211 82.917 35.602 1.00 0.00 C ATOM 51597 O22 PGR 1262 133.831 81.932 35.106 1.00 0.00 O ATOM 51598 O36 PGR 1262 133.047 81.138 28.393 1.00 0.00 O ATOM 51599 HO6A PGR 1262 132.521 80.320 28.346 1.00 0.00 H ATOM 51600 C12 OL 1263 133.418 83.606 36.722 1.00 0.00 C ATOM 51601 H2R OL 1263 134.200 84.065 37.331 1.00 0.00 H ATOM 51602 H2S OL 1263 132.810 84.440 36.365 1.00 0.00 H ATOM 51603 C13 OL 1263 132.700 82.532 37.535 1.00 0.00 C ATOM 51604 H3R OL 1263 132.090 81.873 36.914 1.00 0.00 H ATOM 51605 H3S OL 1263 133.372 81.886 38.103 1.00 0.00 H ATOM 51606 C14 OL 1263 131.762 83.039 38.532 1.00 0.00 C ATOM 51607 H4R OL 1263 132.399 83.509 39.284 1.00 0.00 H ATOM 51608 H4S OL 1263 131.219 83.911 38.163 1.00 0.00 H ATOM 51609 C15 OL 1263 130.969 81.977 39.213 1.00 0.00 C ATOM 51610 H5R OL 1263 130.517 81.227 38.560 1.00 0.00 H ATOM 51611 H5S OL 1263 131.620 81.260 39.717 1.00 0.00 H ATOM 51612 C16 OL 1263 129.823 82.471 40.228 1.00 0.00 C ATOM 51613 H6R OL 1263 130.371 82.821 41.106 1.00 0.00 H ATOM 51614 H6S OL 1263 129.174 83.255 39.835 1.00 0.00 H ATOM 51615 C17 OL 1263 129.047 81.262 40.818 1.00 0.00 C ATOM 51616 H7R OL 1263 128.556 80.778 39.971 1.00 0.00 H ATOM 51617 H7S OL 1263 129.760 80.557 41.249 1.00 0.00 H ATOM 51618 C18 OL 1263 127.996 81.821 41.732 1.00 0.00 C ATOM 51619 H8R OL 1263 127.522 81.057 42.352 1.00 0.00 H ATOM 51620 H8S OL 1263 128.435 82.547 42.419 1.00 0.00 H ATOM 51621 C19 OL 1263 126.866 82.479 41.022 1.00 0.00 C ATOM 51622 H9R OL 1263 126.567 81.887 40.161 1.00 0.00 H ATOM 51623 C110 OL 1263 126.315 83.693 41.180 1.00 0.00 C ATOM 51624 H10R OL 1263 125.511 84.164 40.621 1.00 0.00 H ATOM 51625 C111 OL 1263 126.653 84.565 42.351 1.00 0.00 C ATOM 51626 H11R OL 1263 127.079 84.038 43.207 1.00 0.00 H ATOM 51627 H11S OL 1263 127.487 85.242 42.155 1.00 0.00 H ATOM 51628 C112 OL 1263 125.393 85.319 42.845 1.00 0.00 C ATOM 51629 H12R OL 1263 125.723 86.269 43.271 1.00 0.00 H ATOM 51630 H12S OL 1263 124.758 85.635 42.014 1.00 0.00 H ATOM 51631 C113 OL 1263 124.511 84.528 43.808 1.00 0.00 C ATOM 51632 H13R OL 1263 123.514 84.394 43.382 1.00 0.00 H ATOM 51633 H13S OL 1263 124.851 83.491 43.836 1.00 0.00 H ATOM 51634 C114 OL 1263 124.489 84.926 45.309 1.00 0.00 C ATOM 51635 H14R OL 1263 123.968 84.147 45.869 1.00 0.00 H ATOM 51636 H14S OL 1263 125.529 84.991 45.635 1.00 0.00 H ATOM 51637 C115 OL 1263 123.569 86.135 45.487 1.00 0.00 C ATOM 51638 H15R OL 1263 123.987 86.991 44.954 1.00 0.00 H ATOM 51639 H15S OL 1263 122.626 85.975 44.960 1.00 0.00 H ATOM 51640 C116 OL 1263 123.236 86.405 47.004 1.00 0.00 C ATOM 51641 H16R OL 1263 122.518 87.224 46.916 1.00 0.00 H ATOM 51642 H16S OL 1263 122.820 85.546 47.535 1.00 0.00 H ATOM 51643 C117 OL 1263 124.433 86.740 47.936 1.00 0.00 C ATOM 51644 H17R OL 1263 124.287 86.645 49.014 1.00 0.00 H ATOM 51645 H17S OL 1263 125.179 85.958 47.781 1.00 0.00 H ATOM 51646 C118 OL 1263 125.089 88.048 47.468 1.00 0.00 C ATOM 51647 H18R OL 1263 124.356 88.702 46.991 1.00 0.00 H ATOM 51648 H18S OL 1263 125.864 87.778 46.747 1.00 0.00 H ATOM 51649 H18T OL 1263 125.550 88.590 48.296 1.00 0.00 H TER 51650 OL 1263 ATOM 51650 C116 PA 1264 118.781 88.113 38.549 1.00 0.00 C ATOM 51651 H16R PA 1264 119.425 88.245 37.677 1.00 0.00 H ATOM 51652 H16S PA 1264 119.524 88.150 39.348 1.00 0.00 H ATOM 51653 H16T PA 1264 118.206 89.032 38.682 1.00 0.00 H ATOM 51654 C115 PA 1264 117.930 86.927 38.433 1.00 0.00 C ATOM 51655 H15R PA 1264 116.919 87.253 38.180 1.00 0.00 H ATOM 51656 H15S PA 1264 117.711 86.530 39.427 1.00 0.00 H ATOM 51657 C114 PA 1264 118.490 85.933 37.433 1.00 0.00 C ATOM 51658 H14R PA 1264 119.567 85.889 37.607 1.00 0.00 H ATOM 51659 H14S PA 1264 118.434 86.350 36.425 1.00 0.00 H ATOM 51660 C113 PA 1264 117.850 84.526 37.462 1.00 0.00 C ATOM 51661 H13R PA 1264 116.801 84.648 37.187 1.00 0.00 H ATOM 51662 H13S PA 1264 117.849 84.152 38.488 1.00 0.00 H ATOM 51663 C112 PA 1264 118.372 83.620 36.417 1.00 0.00 C ATOM 51664 H12R PA 1264 119.289 83.256 36.886 1.00 0.00 H ATOM 51665 H12S PA 1264 118.689 84.243 35.578 1.00 0.00 H ATOM 51666 C111 PA 1264 117.594 82.403 35.955 1.00 0.00 C ATOM 51667 H11R PA 1264 116.614 82.747 35.620 1.00 0.00 H ATOM 51668 H11S PA 1264 117.451 81.782 36.842 1.00 0.00 H ATOM 51669 C110 PA 1264 118.387 81.424 35.068 1.00 0.00 C ATOM 51670 H10R PA 1264 117.727 80.598 34.797 1.00 0.00 H ATOM 51671 H10S PA 1264 119.127 80.928 35.700 1.00 0.00 H ATOM 51672 C19 PA 1264 119.010 81.983 33.744 1.00 0.00 C ATOM 51673 H9R PA 1264 119.666 82.852 33.827 1.00 0.00 H ATOM 51674 H9S PA 1264 118.149 82.407 33.224 1.00 0.00 H ATOM 51675 C18 PA 1264 119.519 80.896 32.741 1.00 0.00 C ATOM 51676 H8R PA 1264 119.800 81.424 31.828 1.00 0.00 H ATOM 51677 H8S PA 1264 118.701 80.244 32.427 1.00 0.00 H ATOM 51678 C17 PA 1264 120.867 80.346 33.279 1.00 0.00 C ATOM 51679 H7R PA 1264 120.655 80.052 34.310 1.00 0.00 H ATOM 51680 H7S PA 1264 121.615 81.141 33.285 1.00 0.00 H ATOM 51681 C16 PA 1264 121.529 79.182 32.508 1.00 0.00 C ATOM 51682 H6R PA 1264 122.469 78.993 33.032 1.00 0.00 H ATOM 51683 H6S PA 1264 121.755 79.547 31.504 1.00 0.00 H ATOM 51684 C15 PA 1264 120.739 77.957 32.475 1.00 0.00 C ATOM 51685 H5R PA 1264 119.972 77.892 31.701 1.00 0.00 H ATOM 51686 H5S PA 1264 120.206 78.069 33.422 1.00 0.00 H ATOM 51687 C14 PA 1264 121.620 76.721 32.462 1.00 0.00 C ATOM 51688 H4R PA 1264 121.049 75.791 32.487 1.00 0.00 H ATOM 51689 H4S PA 1264 122.194 76.626 33.386 1.00 0.00 H ATOM 51690 C13 PA 1264 122.616 76.726 31.351 1.00 0.00 C ATOM 51691 H3R PA 1264 123.369 77.496 31.536 1.00 0.00 H ATOM 51692 H3S PA 1264 122.214 76.902 30.351 1.00 0.00 H ATOM 51693 C12 PA 1264 123.330 75.384 31.337 1.00 0.00 C ATOM 51694 H2R PA 1264 122.556 74.646 31.116 1.00 0.00 H ATOM 51695 H2S PA 1264 123.729 74.963 32.263 1.00 0.00 H ATOM 51696 C11 PGR 1265 124.414 75.370 30.249 1.00 0.00 C ATOM 51697 O12 PGR 1265 124.758 76.306 29.588 1.00 0.00 O ATOM 51698 O11 PGR 1265 124.966 74.142 30.089 1.00 0.00 O ATOM 51699 C1 PGR 1265 125.913 73.949 29.012 1.00 0.00 C ATOM 51700 HR PGR 1265 125.513 74.373 28.088 1.00 0.00 H ATOM 51701 HS PGR 1265 126.104 72.878 28.897 1.00 0.00 H ATOM 51702 C2 PGR 1265 127.276 74.464 29.438 1.00 0.00 C ATOM 51703 HX PGR 1265 127.279 75.334 30.099 1.00 0.00 H ATOM 51704 C3 PGR 1265 128.074 74.828 28.147 1.00 0.00 C ATOM 51705 HA PGR 1265 129.020 75.320 28.385 1.00 0.00 H ATOM 51706 HB PGR 1265 127.450 75.520 27.575 1.00 0.00 H ATOM 51707 O31 PGR 1265 128.357 73.612 27.470 1.00 0.00 O ATOM 51708 P31 PGR 1265 129.637 73.486 26.550 1.00 0.00 P ATOM 51709 O32 PGR 1265 131.048 73.170 27.369 1.00 0.00 O ATOM 51710 C31 PGR 1265 131.802 74.137 28.073 1.00 0.00 C ATOM 51711 H1A PGR 1265 132.360 73.469 28.734 1.00 0.00 H ATOM 51712 H1B PGR 1265 131.166 74.788 28.679 1.00 0.00 H ATOM 51713 C32 PGR 1265 132.759 74.860 27.148 1.00 0.00 C ATOM 51714 H2A PGR 1265 132.260 75.497 26.413 1.00 0.00 H ATOM 51715 O35 PGR 1265 133.534 73.899 26.419 1.00 0.00 O ATOM 51716 HO5A PGR 1265 133.825 73.213 27.046 1.00 0.00 H ATOM 51717 C33 PGR 1265 133.728 75.763 27.976 1.00 0.00 C ATOM 51718 H3A PGR 1265 134.678 75.907 27.456 1.00 0.00 H ATOM 51719 H3B PGR 1265 133.245 76.743 27.962 1.00 0.00 H ATOM 51720 O33 PGR 1265 129.485 72.236 25.825 1.00 0.00 O ATOM 51721 O34 PGR 1265 129.760 74.684 25.830 1.00 0.00 O ATOM 51722 O21 PGR 1265 128.006 73.430 30.134 1.00 0.00 O ATOM 51723 C21 PGR 1265 128.967 73.786 30.982 1.00 0.00 C ATOM 51724 O22 PGR 1265 129.267 74.922 31.255 1.00 0.00 O ATOM 51725 O36 PGR 1265 133.910 75.368 29.324 1.00 0.00 O ATOM 51726 HO6A PGR 1265 134.375 74.513 29.305 1.00 0.00 H ATOM 51727 C12 OL 1266 129.742 72.551 31.505 1.00 0.00 C ATOM 51728 H2R OL 1266 129.285 72.137 32.407 1.00 0.00 H ATOM 51729 H2S OL 1266 129.555 71.680 30.873 1.00 0.00 H ATOM 51730 C13 OL 1266 131.185 72.793 31.816 1.00 0.00 C ATOM 51731 H3R OL 1266 131.651 71.835 32.058 1.00 0.00 H ATOM 51732 H3S OL 1266 131.497 73.193 30.850 1.00 0.00 H ATOM 51733 C14 OL 1266 131.668 73.660 32.987 1.00 0.00 C ATOM 51734 H4R OL 1266 131.008 74.529 33.030 1.00 0.00 H ATOM 51735 H4S OL 1266 131.471 73.151 33.933 1.00 0.00 H ATOM 51736 C15 OL 1266 133.177 73.898 32.881 1.00 0.00 C ATOM 51737 H5R OL 1266 133.891 73.097 33.085 1.00 0.00 H ATOM 51738 H5S OL 1266 133.503 73.954 31.840 1.00 0.00 H ATOM 51739 C16 OL 1266 133.746 75.069 33.707 1.00 0.00 C ATOM 51740 H6R OL 1266 134.722 75.187 33.230 1.00 0.00 H ATOM 51741 H6S OL 1266 133.130 75.963 33.592 1.00 0.00 H ATOM 51742 C17 OL 1266 133.902 74.917 35.256 1.00 0.00 C ATOM 51743 H7R OL 1266 134.465 74.045 35.596 1.00 0.00 H ATOM 51744 H7S OL 1266 134.570 75.682 35.657 1.00 0.00 H ATOM 51745 C18 OL 1266 132.612 74.889 36.078 1.00 0.00 C ATOM 51746 H8R OL 1266 131.887 75.606 35.687 1.00 0.00 H ATOM 51747 H8S OL 1266 132.255 73.872 35.902 1.00 0.00 H ATOM 51748 C19 OL 1266 132.890 74.993 37.565 1.00 0.00 C ATOM 51749 H9R OL 1266 133.844 74.546 37.831 1.00 0.00 H ATOM 51750 C110 OL 1266 132.033 75.550 38.445 1.00 0.00 C ATOM 51751 H10R OL 1266 132.187 75.466 39.518 1.00 0.00 H ATOM 51752 C111 OL 1266 130.646 76.136 38.214 1.00 0.00 C ATOM 51753 H11R OL 1266 130.181 75.624 37.369 1.00 0.00 H ATOM 51754 H11S OL 1266 129.970 76.061 39.069 1.00 0.00 H ATOM 51755 C112 OL 1266 130.837 77.606 37.900 1.00 0.00 C ATOM 51756 H12R OL 1266 131.340 78.208 38.659 1.00 0.00 H ATOM 51757 H12S OL 1266 131.562 77.725 37.091 1.00 0.00 H ATOM 51758 C113 OL 1266 129.588 78.433 37.547 1.00 0.00 C ATOM 51759 H13R OL 1266 128.802 78.077 38.217 1.00 0.00 H ATOM 51760 H13S OL 1266 129.910 79.452 37.769 1.00 0.00 H ATOM 51761 C114 OL 1266 129.136 78.304 36.077 1.00 0.00 C ATOM 51762 H14R OL 1266 128.985 77.242 35.874 1.00 0.00 H ATOM 51763 H14S OL 1266 128.162 78.771 35.918 1.00 0.00 H ATOM 51764 C115 OL 1266 130.142 78.922 35.081 1.00 0.00 C ATOM 51765 H15R OL 1266 130.683 79.833 35.346 1.00 0.00 H ATOM 51766 H15S OL 1266 130.942 78.187 34.969 1.00 0.00 H ATOM 51767 C116 OL 1266 129.583 79.301 33.723 1.00 0.00 C ATOM 51768 H16R OL 1266 129.011 78.427 33.404 1.00 0.00 H ATOM 51769 H16S OL 1266 128.839 80.067 33.953 1.00 0.00 H ATOM 51770 C117 OL 1266 130.687 79.680 32.730 1.00 0.00 C ATOM 51771 H17R OL 1266 131.379 78.840 32.823 1.00 0.00 H ATOM 51772 H17S OL 1266 130.383 79.708 31.681 1.00 0.00 H ATOM 51773 C118 OL 1266 131.278 81.120 32.986 1.00 0.00 C ATOM 51774 H18R OL 1266 131.599 81.172 34.029 1.00 0.00 H ATOM 51775 H18S OL 1266 130.466 81.778 32.669 1.00 0.00 H ATOM 51776 H18T OL 1266 132.109 81.427 32.348 1.00 0.00 H TER 51777 OL 1266 ATOM 51777 C116 PA 1267 129.070 74.337 41.121 1.00 0.00 C ATOM 51778 H16R PA 1267 129.668 73.946 40.296 1.00 0.00 H ATOM 51779 H16S PA 1267 129.543 74.035 42.058 1.00 0.00 H ATOM 51780 H16T PA 1267 129.120 75.425 41.032 1.00 0.00 H ATOM 51781 C115 PA 1267 127.677 73.773 40.957 1.00 0.00 C ATOM 51782 H15R PA 1267 126.974 74.214 41.666 1.00 0.00 H ATOM 51783 H15S PA 1267 127.644 72.712 41.215 1.00 0.00 H ATOM 51784 C114 PA 1267 127.060 73.842 39.584 1.00 0.00 C ATOM 51785 H14R PA 1267 127.306 74.858 39.271 1.00 0.00 H ATOM 51786 H14S PA 1267 125.992 73.612 39.555 1.00 0.00 H ATOM 51787 C113 PA 1267 127.672 72.884 38.577 1.00 0.00 C ATOM 51788 H13R PA 1267 127.365 71.905 38.950 1.00 0.00 H ATOM 51789 H13S PA 1267 128.761 72.940 38.517 1.00 0.00 H ATOM 51790 C112 PA 1267 127.214 73.162 37.151 1.00 0.00 C ATOM 51791 H12R PA 1267 126.253 73.678 37.110 1.00 0.00 H ATOM 51792 H12S PA 1267 127.145 72.132 36.795 1.00 0.00 H ATOM 51793 C111 PA 1267 128.301 73.864 36.359 1.00 0.00 C ATOM 51794 H11R PA 1267 129.299 73.447 36.509 1.00 0.00 H ATOM 51795 H11S PA 1267 128.424 74.909 36.650 1.00 0.00 H ATOM 51796 C110 PA 1267 128.049 73.896 34.803 1.00 0.00 C ATOM 51797 H10R PA 1267 128.131 72.890 34.385 1.00 0.00 H ATOM 51798 H10S PA 1267 128.880 74.519 34.467 1.00 0.00 H ATOM 51799 C19 PA 1267 126.672 74.430 34.329 1.00 0.00 C ATOM 51800 H9R PA 1267 125.850 73.815 34.701 1.00 0.00 H ATOM 51801 H9S PA 1267 126.558 74.291 33.252 1.00 0.00 H ATOM 51802 C18 PA 1267 126.391 75.857 34.618 1.00 0.00 C ATOM 51803 H8R PA 1267 126.983 76.156 35.485 1.00 0.00 H ATOM 51804 H8S PA 1267 125.350 75.863 34.948 1.00 0.00 H ATOM 51805 C17 PA 1267 126.618 76.875 33.525 1.00 0.00 C ATOM 51806 H7R PA 1267 126.095 76.529 32.631 1.00 0.00 H ATOM 51807 H7S PA 1267 127.618 76.735 33.109 1.00 0.00 H ATOM 51808 C16 PA 1267 126.047 78.303 33.789 1.00 0.00 C ATOM 51809 H6R PA 1267 126.619 78.831 34.555 1.00 0.00 H ATOM 51810 H6S PA 1267 125.017 78.279 34.152 1.00 0.00 H ATOM 51811 C15 PA 1267 126.072 79.138 32.492 1.00 0.00 C ATOM 51812 H5R PA 1267 125.362 78.792 31.739 1.00 0.00 H ATOM 51813 H5S PA 1267 127.036 79.093 31.982 1.00 0.00 H ATOM 51814 C14 PA 1267 125.838 80.568 32.735 1.00 0.00 C ATOM 51815 H4R PA 1267 126.398 80.907 33.609 1.00 0.00 H ATOM 51816 H4S PA 1267 124.780 80.613 33.000 1.00 0.00 H ATOM 51817 C13 PA 1267 126.140 81.467 31.536 1.00 0.00 C ATOM 51818 H3R PA 1267 125.428 82.294 31.496 1.00 0.00 H ATOM 51819 H3S PA 1267 125.860 81.017 30.581 1.00 0.00 H ATOM 51820 C12 PA 1267 127.556 82.024 31.540 1.00 0.00 C ATOM 51821 H2R PA 1267 128.252 81.231 31.823 1.00 0.00 H ATOM 51822 H2S PA 1267 127.647 82.838 32.262 1.00 0.00 H ATOM 51823 C11 PC 1268 127.889 82.697 30.246 1.00 0.00 C ATOM 51824 O12 PC 1268 127.195 83.502 29.703 1.00 0.00 O ATOM 51825 O11 PC 1268 129.169 82.510 29.823 1.00 0.00 O ATOM 51826 C1 PC 1268 129.650 83.345 28.678 1.00 0.00 C ATOM 51827 HR PC 1268 128.937 83.492 27.862 1.00 0.00 H ATOM 51828 HS PC 1268 130.548 82.867 28.280 1.00 0.00 H ATOM 51829 C2 PC 1268 129.992 84.762 29.145 1.00 0.00 C ATOM 51830 HX PC 1268 129.108 85.330 29.448 1.00 0.00 H ATOM 51831 C3 PC 1268 130.759 85.519 28.024 1.00 0.00 C ATOM 51832 HA PC 1268 131.251 86.359 28.519 1.00 0.00 H ATOM 51833 HB PC 1268 130.087 85.922 27.262 1.00 0.00 H ATOM 51834 O31 PC 1268 131.689 84.702 27.301 1.00 0.00 O ATOM 51835 P31 PC 1268 132.855 85.384 26.454 1.00 0.00 P ATOM 51836 O32 PC 1268 132.132 86.188 25.339 1.00 0.00 O ATOM 51837 C31 PC 1268 131.436 85.569 24.254 1.00 0.00 C ATOM 51838 H1A PC 1268 130.694 84.914 24.718 1.00 0.00 H ATOM 51839 H1B PC 1268 132.112 84.885 23.735 1.00 0.00 H ATOM 51840 C32 PC 1268 130.902 86.542 23.228 1.00 0.00 C ATOM 51841 H2A PC 1268 130.107 87.100 23.725 1.00 0.00 H ATOM 51842 H2B PC 1268 130.431 85.949 22.443 1.00 0.00 H ATOM 51843 N31 PC 1268 131.831 87.566 22.755 1.00 0.00 N ATOM 51844 C33 PC 1268 133.223 87.223 22.358 1.00 0.00 C ATOM 51845 H3A PC 1268 133.231 86.270 21.827 1.00 0.00 H ATOM 51846 H3B PC 1268 133.832 86.960 23.225 1.00 0.00 H ATOM 51847 H3C PC 1268 133.774 87.990 21.811 1.00 0.00 H ATOM 51848 C34 PC 1268 131.334 88.235 21.529 1.00 0.00 C ATOM 51849 H4A PC 1268 132.123 88.842 21.083 1.00 0.00 H ATOM 51850 H4B PC 1268 130.369 88.725 21.672 1.00 0.00 H ATOM 51851 H4C PC 1268 131.353 87.477 20.744 1.00 0.00 H ATOM 51852 C35 PC 1268 131.909 88.747 23.678 1.00 0.00 C ATOM 51853 H5A PC 1268 132.262 88.345 24.629 1.00 0.00 H ATOM 51854 H5B PC 1268 130.892 89.144 23.666 1.00 0.00 H ATOM 51855 H5C PC 1268 132.612 89.467 23.257 1.00 0.00 H ATOM 51856 O33 PC 1268 133.566 86.306 27.328 1.00 0.00 O ATOM 51857 O34 PC 1268 133.617 84.234 25.947 1.00 0.00 O ATOM 51858 O21 PC 1268 130.820 84.585 30.334 1.00 0.00 O ATOM 51859 C21 PC 1268 130.917 85.574 31.257 1.00 0.00 C ATOM 51860 O22 PC 1268 130.326 86.646 31.174 1.00 0.00 O ATOM 51861 C12 OL 1269 131.990 85.191 32.313 1.00 0.00 C ATOM 51862 H2R OL 1269 132.205 84.125 32.409 1.00 0.00 H ATOM 51863 H2S OL 1269 132.889 85.591 31.839 1.00 0.00 H ATOM 51864 C13 OL 1269 131.875 85.848 33.670 1.00 0.00 C ATOM 51865 H3R OL 1269 132.592 85.558 34.441 1.00 0.00 H ATOM 51866 H3S OL 1269 131.965 86.928 33.538 1.00 0.00 H ATOM 51867 C14 OL 1269 130.447 85.829 34.323 1.00 0.00 C ATOM 51868 H4R OL 1269 130.498 86.400 35.253 1.00 0.00 H ATOM 51869 H4S OL 1269 129.723 86.380 33.718 1.00 0.00 H ATOM 51870 C15 OL 1269 130.050 84.385 34.612 1.00 0.00 C ATOM 51871 H5R OL 1269 129.966 83.795 33.697 1.00 0.00 H ATOM 51872 H5S OL 1269 130.729 83.957 35.352 1.00 0.00 H ATOM 51873 C16 OL 1269 128.648 84.347 35.272 1.00 0.00 C ATOM 51874 H6R OL 1269 128.731 84.966 36.168 1.00 0.00 H ATOM 51875 H6S OL 1269 127.921 84.796 34.591 1.00 0.00 H ATOM 51876 C17 OL 1269 128.188 82.976 35.676 1.00 0.00 C ATOM 51877 H7R OL 1269 128.087 82.267 34.852 1.00 0.00 H ATOM 51878 H7S OL 1269 129.012 82.626 36.301 1.00 0.00 H ATOM 51879 C18 OL 1269 126.892 83.006 36.548 1.00 0.00 C ATOM 51880 H8R OL 1269 127.205 83.720 37.312 1.00 0.00 H ATOM 51881 H8S OL 1269 126.091 83.355 35.893 1.00 0.00 H ATOM 51882 C19 OL 1269 126.663 81.623 37.140 1.00 0.00 C ATOM 51883 H9R OL 1269 127.490 81.132 37.646 1.00 0.00 H ATOM 51884 C110 OL 1269 125.540 80.938 37.290 1.00 0.00 C ATOM 51885 H10R OL 1269 125.609 79.962 37.762 1.00 0.00 H ATOM 51886 C111 OL 1269 124.149 81.371 36.854 1.00 0.00 C ATOM 51887 H11R OL 1269 124.213 82.398 36.487 1.00 0.00 H ATOM 51888 H11S OL 1269 123.826 80.709 36.048 1.00 0.00 H ATOM 51889 C112 OL 1269 123.029 81.293 37.973 1.00 0.00 C ATOM 51890 H12R OL 1269 123.457 81.496 38.957 1.00 0.00 H ATOM 51891 H12S OL 1269 122.254 82.055 37.864 1.00 0.00 H ATOM 51892 C113 OL 1269 122.394 79.860 38.344 1.00 0.00 C ATOM 51893 H13R OL 1269 123.313 79.408 38.722 1.00 0.00 H ATOM 51894 H13S OL 1269 121.611 79.928 39.102 1.00 0.00 H ATOM 51895 C114 OL 1269 121.844 79.006 37.258 1.00 0.00 C ATOM 51896 H14R OL 1269 121.146 79.646 36.713 1.00 0.00 H ATOM 51897 H14S OL 1269 122.646 78.649 36.610 1.00 0.00 H ATOM 51898 C115 OL 1269 121.033 77.904 37.706 1.00 0.00 C ATOM 51899 H15R OL 1269 121.354 77.398 38.619 1.00 0.00 H ATOM 51900 H15S OL 1269 120.082 78.355 37.997 1.00 0.00 H ATOM 51901 C116 OL 1269 120.793 76.725 36.690 1.00 0.00 C ATOM 51902 H16R OL 1269 120.149 75.961 37.132 1.00 0.00 H ATOM 51903 H16S OL 1269 120.499 77.287 35.801 1.00 0.00 H ATOM 51904 C117 OL 1269 122.072 75.889 36.382 1.00 0.00 C ATOM 51905 H17R OL 1269 121.827 75.126 35.640 1.00 0.00 H ATOM 51906 H17S OL 1269 122.786 76.465 35.788 1.00 0.00 H ATOM 51907 C118 OL 1269 122.719 75.388 37.638 1.00 0.00 C ATOM 51908 H18R OL 1269 123.605 74.801 37.389 1.00 0.00 H ATOM 51909 H18S OL 1269 122.016 75.036 38.397 1.00 0.00 H ATOM 51910 H18T OL 1269 123.179 76.212 38.189 1.00 0.00 H TER 51911 OL 1269 ATOM 51911 C116 PA 1270 86.425 0.155 34.678 1.00 0.00 C ATOM 51912 H16R PA 1270 85.423 -0.275 34.641 1.00 0.00 H ATOM 51913 H16S PA 1270 87.141 -0.429 34.096 1.00 0.00 H ATOM 51914 H16T PA 1270 86.477 0.985 33.970 1.00 0.00 H ATOM 51915 C115 PA 1270 86.899 0.263 36.158 1.00 0.00 C ATOM 51916 H15R PA 1270 87.747 0.951 36.156 1.00 0.00 H ATOM 51917 H15S PA 1270 87.413 -0.657 36.445 1.00 0.00 H ATOM 51918 C114 PA 1270 85.824 0.825 37.180 1.00 0.00 C ATOM 51919 H14R PA 1270 86.466 1.079 38.026 1.00 0.00 H ATOM 51920 H14S PA 1270 85.141 0.027 37.477 1.00 0.00 H ATOM 51921 C113 PA 1270 85.024 2.077 36.686 1.00 0.00 C ATOM 51922 H13R PA 1270 84.440 2.436 37.536 1.00 0.00 H ATOM 51923 H13S PA 1270 84.288 1.843 35.915 1.00 0.00 H ATOM 51924 C112 PA 1270 86.019 3.259 36.305 1.00 0.00 C ATOM 51925 H12R PA 1270 86.367 3.035 35.294 1.00 0.00 H ATOM 51926 H12S PA 1270 86.908 3.115 36.922 1.00 0.00 H ATOM 51927 C111 PA 1270 85.364 4.586 36.382 1.00 0.00 C ATOM 51928 H11R PA 1270 85.177 4.764 37.443 1.00 0.00 H ATOM 51929 H11S PA 1270 84.386 4.527 35.901 1.00 0.00 H ATOM 51930 C110 PA 1270 86.184 5.807 35.837 1.00 0.00 C ATOM 51931 H10R PA 1270 87.084 5.784 36.454 1.00 0.00 H ATOM 51932 H10S PA 1270 85.644 6.720 36.097 1.00 0.00 H ATOM 51933 C19 PA 1270 86.437 5.851 34.346 1.00 0.00 C ATOM 51934 H9R PA 1270 86.891 4.919 34.002 1.00 0.00 H ATOM 51935 H9S PA 1270 87.088 6.674 34.044 1.00 0.00 H ATOM 51936 C18 PA 1270 85.222 5.967 33.459 1.00 0.00 C ATOM 51937 H8R PA 1270 84.921 6.993 33.678 1.00 0.00 H ATOM 51938 H8S PA 1270 84.377 5.384 33.832 1.00 0.00 H ATOM 51939 C17 PA 1270 85.362 5.665 31.910 1.00 0.00 C ATOM 51940 H7R PA 1270 86.131 6.362 31.571 1.00 0.00 H ATOM 51941 H7S PA 1270 84.484 5.960 31.331 1.00 0.00 H ATOM 51942 C16 PA 1270 85.588 4.273 31.564 1.00 0.00 C ATOM 51943 H6R PA 1270 84.752 3.743 32.025 1.00 0.00 H ATOM 51944 H6S PA 1270 86.491 3.831 31.990 1.00 0.00 H ATOM 51945 C15 PA 1270 85.662 3.838 30.075 1.00 0.00 C ATOM 51946 H5R PA 1270 86.456 4.406 29.585 1.00 0.00 H ATOM 51947 H5S PA 1270 84.744 4.220 29.624 1.00 0.00 H ATOM 51948 C14 PA 1270 86.036 2.386 29.688 1.00 0.00 C ATOM 51949 H4R PA 1270 85.283 1.665 30.014 1.00 0.00 H ATOM 51950 H4S PA 1270 86.912 1.977 30.196 1.00 0.00 H ATOM 51951 C13 PA 1270 86.044 2.349 28.207 1.00 0.00 C ATOM 51952 H3R PA 1270 86.829 3.032 27.875 1.00 0.00 H ATOM 51953 H3S PA 1270 85.050 2.635 27.858 1.00 0.00 H ATOM 51954 C12 PA 1270 86.191 0.997 27.694 1.00 0.00 C ATOM 51955 H2R PA 1270 85.354 0.319 27.876 1.00 0.00 H ATOM 51956 H2S PA 1270 87.074 0.508 28.111 1.00 0.00 H ATOM 51957 C11 PGR 1271 86.384 1.012 26.167 1.00 0.00 C ATOM 51958 O12 PGR 1271 86.395 -0.014 25.529 1.00 0.00 O ATOM 51959 O11 PGR 1271 86.518 2.317 25.706 1.00 0.00 O ATOM 51960 C1 PGR 1271 86.434 2.479 24.294 1.00 0.00 C ATOM 51961 HR PGR 1271 87.076 1.677 23.922 1.00 0.00 H ATOM 51962 HS PGR 1271 86.901 3.389 23.911 1.00 0.00 H ATOM 51963 C2 PGR 1271 84.958 2.235 23.769 1.00 0.00 C ATOM 51964 HX PGR 1271 84.617 1.253 24.108 1.00 0.00 H ATOM 51965 C3 PGR 1271 84.876 2.041 22.280 1.00 0.00 C ATOM 51966 HA PGR 1271 84.255 2.795 21.790 1.00 0.00 H ATOM 51967 HB PGR 1271 84.425 1.069 22.062 1.00 0.00 H ATOM 51968 O31 PGR 1271 86.116 2.116 21.586 1.00 0.00 O ATOM 51969 P31 PGR 1271 86.234 1.841 20.004 1.00 0.00 P ATOM 51970 O32 PGR 1271 85.634 3.215 19.387 1.00 0.00 O ATOM 51971 C31 PGR 1271 86.221 4.479 19.580 1.00 0.00 C ATOM 51972 H1A PGR 1271 87.304 4.342 19.525 1.00 0.00 H ATOM 51973 H1B PGR 1271 85.968 4.872 20.568 1.00 0.00 H ATOM 51974 C32 PGR 1271 85.825 5.453 18.475 1.00 0.00 C ATOM 51975 H2A PGR 1271 86.392 6.384 18.557 1.00 0.00 H ATOM 51976 O35 PGR 1271 84.480 5.789 18.618 1.00 0.00 O ATOM 51977 HO5A PGR 1271 83.960 4.979 18.466 1.00 0.00 H ATOM 51978 C33 PGR 1271 85.960 4.788 17.078 1.00 0.00 C ATOM 51979 H3A PGR 1271 86.983 4.451 16.892 1.00 0.00 H ATOM 51980 H3B PGR 1271 85.318 3.904 17.064 1.00 0.00 H ATOM 51981 O33 PGR 1271 87.669 1.770 19.727 1.00 0.00 O ATOM 51982 O34 PGR 1271 85.377 0.714 19.727 1.00 0.00 O ATOM 51983 O21 PGR 1271 84.013 3.291 24.223 1.00 0.00 O ATOM 51984 C21 PGR 1271 82.696 3.162 24.068 1.00 0.00 C ATOM 51985 O22 PGR 1271 82.102 2.215 23.540 1.00 0.00 O ATOM 51986 O36 PGR 1271 85.505 5.673 15.982 1.00 0.00 O ATOM 51987 HO6A PGR 1271 84.542 5.794 16.060 1.00 0.00 H ATOM 51988 C12 OL 1272 81.886 4.317 24.675 1.00 0.00 C ATOM 51989 H2R OL 1272 82.350 5.285 24.470 1.00 0.00 H ATOM 51990 H2S OL 1272 80.862 4.476 24.332 1.00 0.00 H ATOM 51991 C13 OL 1272 81.832 4.188 26.223 1.00 0.00 C ATOM 51992 H3R OL 1272 81.381 3.221 26.454 1.00 0.00 H ATOM 51993 H3S OL 1272 82.879 4.122 26.526 1.00 0.00 H ATOM 51994 C14 OL 1272 81.201 5.380 26.956 1.00 0.00 C ATOM 51995 H4R OL 1272 81.549 6.339 26.568 1.00 0.00 H ATOM 51996 H4S OL 1272 80.130 5.372 26.739 1.00 0.00 H ATOM 51997 C15 OL 1272 81.497 5.365 28.474 1.00 0.00 C ATOM 51998 H5R OL 1272 81.137 4.491 29.021 1.00 0.00 H ATOM 51999 H5S OL 1272 82.576 5.355 28.646 1.00 0.00 H ATOM 52000 C16 OL 1272 81.111 6.746 29.118 1.00 0.00 C ATOM 52001 H6R OL 1272 81.504 7.566 28.514 1.00 0.00 H ATOM 52002 H6S OL 1272 80.050 6.941 29.287 1.00 0.00 H ATOM 52003 C17 OL 1272 81.772 6.884 30.442 1.00 0.00 C ATOM 52004 H7R OL 1272 81.401 6.029 31.011 1.00 0.00 H ATOM 52005 H7S OL 1272 82.856 6.884 30.306 1.00 0.00 H ATOM 52006 C18 OL 1272 81.411 8.178 31.162 1.00 0.00 C ATOM 52007 H8R OL 1272 80.337 8.150 31.360 1.00 0.00 H ATOM 52008 H8S OL 1272 81.910 8.367 32.114 1.00 0.00 H ATOM 52009 C19 OL 1272 81.513 9.440 30.404 1.00 0.00 C ATOM 52010 H9R OL 1272 81.001 9.443 29.445 1.00 0.00 H ATOM 52011 C110 OL 1272 82.095 10.589 30.762 1.00 0.00 C ATOM 52012 H10R OL 1272 81.953 11.440 30.101 1.00 0.00 H ATOM 52013 C111 OL 1272 82.864 10.952 31.987 1.00 0.00 C ATOM 52014 H11R OL 1272 82.791 12.022 32.191 1.00 0.00 H ATOM 52015 H11S OL 1272 82.315 10.494 32.812 1.00 0.00 H ATOM 52016 C112 OL 1272 84.269 10.425 31.950 1.00 0.00 C ATOM 52017 H12R OL 1272 84.723 10.477 32.942 1.00 0.00 H ATOM 52018 H12S OL 1272 84.250 9.394 31.591 1.00 0.00 H ATOM 52019 C113 OL 1272 85.214 11.291 31.127 1.00 0.00 C ATOM 52020 H13R OL 1272 84.986 11.189 30.064 1.00 0.00 H ATOM 52021 H13S OL 1272 85.126 12.368 31.280 1.00 0.00 H ATOM 52022 C114 OL 1272 86.634 10.888 31.276 1.00 0.00 C ATOM 52023 H14R OL 1272 87.001 10.964 32.301 1.00 0.00 H ATOM 52024 H14S OL 1272 86.682 9.829 31.016 1.00 0.00 H ATOM 52025 C115 OL 1272 87.596 11.677 30.317 1.00 0.00 C ATOM 52026 H15R OL 1272 87.280 11.707 29.272 1.00 0.00 H ATOM 52027 H15S OL 1272 87.725 12.654 30.787 1.00 0.00 H ATOM 52028 C116 OL 1272 88.959 10.802 30.209 1.00 0.00 C ATOM 52029 H16R OL 1272 89.255 10.431 31.193 1.00 0.00 H ATOM 52030 H16S OL 1272 88.797 9.830 29.737 1.00 0.00 H ATOM 52031 C117 OL 1272 90.076 11.623 29.518 1.00 0.00 C ATOM 52032 H17R OL 1272 90.011 11.521 28.432 1.00 0.00 H ATOM 52033 H17S OL 1272 90.170 12.679 29.781 1.00 0.00 H ATOM 52034 C118 OL 1272 91.524 11.060 29.909 1.00 0.00 C ATOM 52035 H18R OL 1272 91.640 10.006 29.649 1.00 0.00 H ATOM 52036 H18S OL 1272 91.762 11.201 30.965 1.00 0.00 H ATOM 52037 H18T OL 1272 92.303 11.594 29.361 1.00 0.00 H TER 52038 OL 1272 ATOM 52038 C116 PA 1273 64.537 79.654 44.847 1.00 0.00 C ATOM 52039 H16R PA 1273 63.765 79.172 45.452 1.00 0.00 H ATOM 52040 H16S PA 1273 64.636 80.669 45.236 1.00 0.00 H ATOM 52041 H16T PA 1273 65.481 79.108 44.905 1.00 0.00 H ATOM 52042 C115 PA 1273 64.158 79.603 43.332 1.00 0.00 C ATOM 52043 H15R PA 1273 63.704 78.672 42.986 1.00 0.00 H ATOM 52044 H15S PA 1273 65.142 79.682 42.864 1.00 0.00 H ATOM 52045 C114 PA 1273 63.296 80.667 42.728 1.00 0.00 C ATOM 52046 H14R PA 1273 63.456 81.659 43.155 1.00 0.00 H ATOM 52047 H14S PA 1273 62.294 80.628 43.159 1.00 0.00 H ATOM 52048 C113 PA 1273 63.241 80.677 41.194 1.00 0.00 C ATOM 52049 H13R PA 1273 62.953 79.664 40.906 1.00 0.00 H ATOM 52050 H13S PA 1273 64.195 80.785 40.674 1.00 0.00 H ATOM 52051 C112 PA 1273 62.110 81.555 40.632 1.00 0.00 C ATOM 52052 H12R PA 1273 62.202 82.536 41.103 1.00 0.00 H ATOM 52053 H12S PA 1273 61.157 81.114 40.931 1.00 0.00 H ATOM 52054 C111 PA 1273 62.196 81.703 39.135 1.00 0.00 C ATOM 52055 H11R PA 1273 62.085 80.700 38.718 1.00 0.00 H ATOM 52056 H11S PA 1273 63.141 82.142 38.807 1.00 0.00 H ATOM 52057 C110 PA 1273 61.051 82.561 38.534 1.00 0.00 C ATOM 52058 H10R PA 1273 61.083 83.512 39.070 1.00 0.00 H ATOM 52059 H10S PA 1273 60.099 82.119 38.836 1.00 0.00 H ATOM 52060 C19 PA 1273 60.979 82.690 36.958 1.00 0.00 C ATOM 52061 H9R PA 1273 61.087 81.652 36.637 1.00 0.00 H ATOM 52062 H9S PA 1273 61.802 83.315 36.604 1.00 0.00 H ATOM 52063 C18 PA 1273 59.654 83.145 36.460 1.00 0.00 C ATOM 52064 H8R PA 1273 59.580 84.181 36.794 1.00 0.00 H ATOM 52065 H8S PA 1273 58.876 82.561 36.956 1.00 0.00 H ATOM 52066 C17 PA 1273 59.564 83.203 34.934 1.00 0.00 C ATOM 52067 H7R PA 1273 58.554 83.371 34.555 1.00 0.00 H ATOM 52068 H7S PA 1273 59.822 82.219 34.537 1.00 0.00 H ATOM 52069 C16 PA 1273 60.519 84.188 34.311 1.00 0.00 C ATOM 52070 H6R PA 1273 61.504 83.763 34.514 1.00 0.00 H ATOM 52071 H6S PA 1273 60.450 85.112 34.889 1.00 0.00 H ATOM 52072 C15 PA 1273 60.395 84.354 32.780 1.00 0.00 C ATOM 52073 H5R PA 1273 59.345 84.454 32.500 1.00 0.00 H ATOM 52074 H5S PA 1273 60.671 83.378 32.375 1.00 0.00 H ATOM 52075 C14 PA 1273 61.191 85.508 32.251 1.00 0.00 C ATOM 52076 H4R PA 1273 62.275 85.393 32.310 1.00 0.00 H ATOM 52077 H4S PA 1273 60.931 86.357 32.887 1.00 0.00 H ATOM 52078 C13 PA 1273 60.911 85.988 30.767 1.00 0.00 C ATOM 52079 H3R PA 1273 61.414 85.547 29.904 1.00 0.00 H ATOM 52080 H3S PA 1273 61.247 87.027 30.794 1.00 0.00 H ATOM 52081 C12 PA 1273 59.447 86.008 30.402 1.00 0.00 C ATOM 52082 H2R PA 1273 58.775 86.224 31.236 1.00 0.00 H ATOM 52083 H2S PA 1273 59.204 85.034 29.972 1.00 0.00 H ATOM 52084 C11 PGR 1274 59.129 86.933 29.292 1.00 0.00 C ATOM 52085 O12 PGR 1274 59.190 86.636 28.103 1.00 0.00 O ATOM 52086 O11 PGR 1274 59.199 88.159 29.789 1.00 0.00 O ATOM 52087 C1 PGR 1274 59.360 89.312 28.861 1.00 0.00 C ATOM 52088 HR PGR 1274 60.304 89.123 28.343 1.00 0.00 H ATOM 52089 HS PGR 1274 59.480 90.202 29.485 1.00 0.00 H ATOM 52090 C2 PGR 1274 58.090 89.527 27.968 1.00 0.00 C ATOM 52091 HX PGR 1274 57.883 88.556 27.510 1.00 0.00 H ATOM 52092 C3 PGR 1274 58.220 90.544 26.738 1.00 0.00 C ATOM 52093 HA PGR 1274 59.246 90.589 26.366 1.00 0.00 H ATOM 52094 HB PGR 1274 57.942 91.557 27.039 1.00 0.00 H ATOM 52095 O31 PGR 1274 57.447 90.249 25.616 1.00 0.00 O ATOM 52096 P31 PGR 1274 57.350 91.303 24.364 1.00 0.00 P ATOM 52097 O32 PGR 1274 56.361 92.348 24.962 1.00 0.00 O ATOM 52098 C31 PGR 1274 54.977 92.118 25.182 1.00 0.00 C ATOM 52099 H1A PGR 1274 54.565 92.767 25.959 1.00 0.00 H ATOM 52100 H1B PGR 1274 54.757 91.122 25.573 1.00 0.00 H ATOM 52101 C32 PGR 1274 54.083 92.322 23.914 1.00 0.00 C ATOM 52102 H2A PGR 1274 53.028 92.447 24.170 1.00 0.00 H ATOM 52103 O35 PGR 1274 54.064 91.130 23.104 1.00 0.00 O ATOM 52104 HO5A PGR 1274 54.978 90.810 22.996 1.00 0.00 H ATOM 52105 C33 PGR 1274 54.633 93.459 23.044 1.00 0.00 C ATOM 52106 H3A PGR 1274 54.277 94.353 23.563 1.00 0.00 H ATOM 52107 H3B PGR 1274 55.712 93.286 23.074 1.00 0.00 H ATOM 52108 O33 PGR 1274 58.637 92.068 24.192 1.00 0.00 O ATOM 52109 O34 PGR 1274 56.694 90.652 23.181 1.00 0.00 O ATOM 52110 O21 PGR 1274 56.926 89.907 28.749 1.00 0.00 O ATOM 52111 C21 PGR 1274 55.730 89.365 28.532 1.00 0.00 C ATOM 52112 O22 PGR 1274 55.507 88.351 27.917 1.00 0.00 O ATOM 52113 O36 PGR 1274 53.940 93.371 21.772 1.00 0.00 O ATOM 52114 HO6A PGR 1274 54.127 92.456 21.495 1.00 0.00 H ATOM 52115 C12 OL 1275 54.633 90.058 29.121 1.00 0.00 C ATOM 52116 H2R OL 1275 54.809 91.117 29.323 1.00 0.00 H ATOM 52117 H2S OL 1275 53.957 90.090 28.264 1.00 0.00 H ATOM 52118 C13 OL 1275 53.878 89.245 30.187 1.00 0.00 C ATOM 52119 H3R OL 1275 53.025 89.862 30.477 1.00 0.00 H ATOM 52120 H3S OL 1275 53.576 88.276 29.784 1.00 0.00 H ATOM 52121 C14 OL 1275 54.783 89.087 31.404 1.00 0.00 C ATOM 52122 H4R OL 1275 55.788 88.815 31.076 1.00 0.00 H ATOM 52123 H4S OL 1275 54.947 89.971 32.024 1.00 0.00 H ATOM 52124 C15 OL 1275 54.470 87.983 32.412 1.00 0.00 C ATOM 52125 H5R OL 1275 53.549 88.204 32.956 1.00 0.00 H ATOM 52126 H5S OL 1275 54.157 87.059 31.922 1.00 0.00 H ATOM 52127 C16 OL 1275 55.658 87.703 33.346 1.00 0.00 C ATOM 52128 H6R OL 1275 56.541 87.550 32.722 1.00 0.00 H ATOM 52129 H6S OL 1275 55.709 88.622 33.934 1.00 0.00 H ATOM 52130 C17 OL 1275 55.515 86.430 34.220 1.00 0.00 C ATOM 52131 H7R OL 1275 55.561 85.544 33.584 1.00 0.00 H ATOM 52132 H7S OL 1275 56.255 86.416 35.023 1.00 0.00 H ATOM 52133 C18 OL 1275 54.119 86.273 35.007 1.00 0.00 C ATOM 52134 H8R OL 1275 53.323 86.354 34.265 1.00 0.00 H ATOM 52135 H8S OL 1275 54.106 85.244 35.370 1.00 0.00 H ATOM 52136 C19 OL 1275 53.913 87.166 36.153 1.00 0.00 C ATOM 52137 H9R OL 1275 54.346 86.721 37.045 1.00 0.00 H ATOM 52138 C110 OL 1275 52.975 88.134 36.291 1.00 0.00 C ATOM 52139 H10R OL 1275 52.702 88.470 37.288 1.00 0.00 H ATOM 52140 C111 OL 1275 52.290 88.724 35.140 1.00 0.00 C ATOM 52141 H11R OL 1275 52.929 89.458 34.645 1.00 0.00 H ATOM 52142 H11S OL 1275 51.897 87.945 34.484 1.00 0.00 H ATOM 52143 C112 OL 1275 51.082 89.427 35.708 1.00 0.00 C ATOM 52144 H12R OL 1275 50.579 88.819 36.463 1.00 0.00 H ATOM 52145 H12S OL 1275 51.451 90.221 36.361 1.00 0.00 H ATOM 52146 C113 OL 1275 50.070 89.951 34.687 1.00 0.00 C ATOM 52147 H13R OL 1275 50.440 90.871 34.230 1.00 0.00 H ATOM 52148 H13S OL 1275 49.854 89.168 33.958 1.00 0.00 H ATOM 52149 C114 OL 1275 48.696 90.310 35.249 1.00 0.00 C ATOM 52150 H14R OL 1275 48.264 89.437 35.742 1.00 0.00 H ATOM 52151 H14S OL 1275 48.762 90.985 36.105 1.00 0.00 H ATOM 52152 C115 OL 1275 47.682 90.833 34.243 1.00 0.00 C ATOM 52153 H15R OL 1275 48.155 91.762 33.918 1.00 0.00 H ATOM 52154 H15S OL 1275 47.443 90.171 33.409 1.00 0.00 H ATOM 52155 C116 OL 1275 46.394 91.127 34.924 1.00 0.00 C ATOM 52156 H16R OL 1275 45.590 91.168 34.187 1.00 0.00 H ATOM 52157 H16S OL 1275 46.150 90.225 35.490 1.00 0.00 H ATOM 52158 C117 OL 1275 46.279 92.276 35.973 1.00 0.00 C ATOM 52159 H17R OL 1275 46.977 92.226 36.812 1.00 0.00 H ATOM 52160 H17S OL 1275 46.495 93.160 35.370 1.00 0.00 H ATOM 52161 C118 OL 1275 44.881 92.523 36.299 1.00 0.00 C ATOM 52162 H18R OL 1275 44.682 93.325 37.012 1.00 0.00 H ATOM 52163 H18S OL 1275 44.448 91.613 36.719 1.00 0.00 H ATOM 52164 H18T OL 1275 44.340 92.743 35.376 1.00 0.00 H TER 52165 OL 1275 ATOM 52165 C116 PA 1276 58.554 122.377 35.631 1.00 0.00 C ATOM 52166 H16R PA 1276 58.851 121.515 36.231 1.00 0.00 H ATOM 52167 H16S PA 1276 57.654 122.087 35.084 1.00 0.00 H ATOM 52168 H16T PA 1276 58.160 123.173 36.266 1.00 0.00 H ATOM 52169 C115 PA 1276 59.631 122.851 34.675 1.00 0.00 C ATOM 52170 H15R PA 1276 59.894 122.032 34.003 1.00 0.00 H ATOM 52171 H15S PA 1276 60.593 122.967 35.179 1.00 0.00 H ATOM 52172 C114 PA 1276 59.306 124.137 33.873 1.00 0.00 C ATOM 52173 H14R PA 1276 59.414 124.919 34.628 1.00 0.00 H ATOM 52174 H14S PA 1276 58.238 124.243 33.667 1.00 0.00 H ATOM 52175 C113 PA 1276 60.297 124.338 32.749 1.00 0.00 C ATOM 52176 H13R PA 1276 60.179 123.538 32.015 1.00 0.00 H ATOM 52177 H13S PA 1276 61.317 124.320 33.139 1.00 0.00 H ATOM 52178 C112 PA 1276 60.149 125.701 32.213 1.00 0.00 C ATOM 52179 H12R PA 1276 61.112 126.212 32.279 1.00 0.00 H ATOM 52180 H12S PA 1276 59.491 126.289 32.857 1.00 0.00 H ATOM 52181 C111 PA 1276 59.854 125.820 30.698 1.00 0.00 C ATOM 52182 H11R PA 1276 59.598 126.851 30.448 1.00 0.00 H ATOM 52183 H11S PA 1276 58.890 125.374 30.444 1.00 0.00 H ATOM 52184 C110 PA 1276 60.974 125.288 29.822 1.00 0.00 C ATOM 52185 H10R PA 1276 61.176 124.233 30.018 1.00 0.00 H ATOM 52186 H10S PA 1276 61.914 125.721 30.172 1.00 0.00 H ATOM 52187 C19 PA 1276 60.702 125.636 28.263 1.00 0.00 C ATOM 52188 H9R PA 1276 61.028 126.677 28.276 1.00 0.00 H ATOM 52189 H9S PA 1276 59.658 125.586 27.946 1.00 0.00 H ATOM 52190 C18 PA 1276 61.605 124.757 27.416 1.00 0.00 C ATOM 52191 H8R PA 1276 61.572 123.746 27.826 1.00 0.00 H ATOM 52192 H8S PA 1276 62.621 125.045 27.694 1.00 0.00 H ATOM 52193 C17 PA 1276 61.386 124.932 25.882 1.00 0.00 C ATOM 52194 H7R PA 1276 61.739 125.955 25.736 1.00 0.00 H ATOM 52195 H7S PA 1276 60.315 125.052 25.705 1.00 0.00 H ATOM 52196 C16 PA 1276 61.953 123.844 25.054 1.00 0.00 C ATOM 52197 H6R PA 1276 61.412 122.919 25.266 1.00 0.00 H ATOM 52198 H6S PA 1276 62.985 123.769 25.402 1.00 0.00 H ATOM 52199 C15 PA 1276 61.812 124.131 23.554 1.00 0.00 C ATOM 52200 H5R PA 1276 62.342 125.039 23.257 1.00 0.00 H ATOM 52201 H5S PA 1276 60.772 124.442 23.436 1.00 0.00 H ATOM 52202 C14 PA 1276 62.313 122.921 22.651 1.00 0.00 C ATOM 52203 H4R PA 1276 61.649 122.056 22.694 1.00 0.00 H ATOM 52204 H4S PA 1276 63.274 122.602 23.062 1.00 0.00 H ATOM 52205 C13 PA 1276 62.301 123.255 21.156 1.00 0.00 C ATOM 52206 H3R PA 1276 62.509 122.304 20.662 1.00 0.00 H ATOM 52207 H3S PA 1276 63.160 123.863 20.863 1.00 0.00 H ATOM 52208 C12 PA 1276 60.833 123.769 20.695 1.00 0.00 C ATOM 52209 H2R PA 1276 60.733 124.846 20.845 1.00 0.00 H ATOM 52210 H2S PA 1276 60.086 123.356 21.376 1.00 0.00 H ATOM 52211 C11 PGR 1277 60.609 123.413 19.278 1.00 0.00 C ATOM 52212 O12 PGR 1277 61.419 123.488 18.358 1.00 0.00 O ATOM 52213 O11 PGR 1277 59.443 122.743 19.080 1.00 0.00 O ATOM 52214 C1 PGR 1277 59.095 122.171 17.780 1.00 0.00 C ATOM 52215 HR PGR 1277 59.215 122.928 17.000 1.00 0.00 H ATOM 52216 HS PGR 1277 58.048 121.860 17.735 1.00 0.00 H ATOM 52217 C2 PGR 1277 60.029 120.899 17.377 1.00 0.00 C ATOM 52218 HX PGR 1277 61.087 121.088 17.575 1.00 0.00 H ATOM 52219 C3 PGR 1277 59.986 120.704 15.862 1.00 0.00 C ATOM 52220 HA PGR 1277 60.262 121.673 15.441 1.00 0.00 H ATOM 52221 HB PGR 1277 58.993 120.466 15.471 1.00 0.00 H ATOM 52222 O31 PGR 1277 60.843 119.688 15.524 1.00 0.00 O ATOM 52223 P31 PGR 1277 60.999 119.111 14.058 1.00 0.00 P ATOM 52224 O32 PGR 1277 61.660 120.342 13.244 1.00 0.00 O ATOM 52225 C31 PGR 1277 63.073 120.721 13.416 1.00 0.00 C ATOM 52226 H1A PGR 1277 63.407 120.662 14.455 1.00 0.00 H ATOM 52227 H1B PGR 1277 63.174 121.763 13.102 1.00 0.00 H ATOM 52228 C32 PGR 1277 63.915 119.699 12.615 1.00 0.00 C ATOM 52229 H2A PGR 1277 63.395 119.489 11.677 1.00 0.00 H ATOM 52230 O35 PGR 1277 64.313 118.483 13.338 1.00 0.00 O ATOM 52231 HO5A PGR 1277 63.508 118.101 13.731 1.00 0.00 H ATOM 52232 C33 PGR 1277 65.199 120.556 12.223 1.00 0.00 C ATOM 52233 H3A PGR 1277 65.913 119.946 11.664 1.00 0.00 H ATOM 52234 H3B PGR 1277 64.895 121.494 11.752 1.00 0.00 H ATOM 52235 O33 PGR 1277 61.992 118.028 14.209 1.00 0.00 O ATOM 52236 O34 PGR 1277 59.646 118.839 13.522 1.00 0.00 O ATOM 52237 O21 PGR 1277 59.544 119.726 18.024 1.00 0.00 O ATOM 52238 C21 PGR 1277 59.942 119.419 19.271 1.00 0.00 C ATOM 52239 O22 PGR 1277 60.847 119.972 19.899 1.00 0.00 O ATOM 52240 O36 PGR 1277 65.790 120.959 13.483 1.00 0.00 O ATOM 52241 HO6A PGR 1277 65.870 120.116 13.966 1.00 0.00 H ATOM 52242 C12 OL 1278 59.060 118.279 19.725 1.00 0.00 C ATOM 52243 H2R OL 1278 58.025 118.446 19.421 1.00 0.00 H ATOM 52244 H2S OL 1278 59.257 117.424 19.075 1.00 0.00 H ATOM 52245 C13 OL 1278 59.015 118.085 21.243 1.00 0.00 C ATOM 52246 H3R OL 1278 60.059 117.990 21.550 1.00 0.00 H ATOM 52247 H3S OL 1278 58.598 118.990 21.690 1.00 0.00 H ATOM 52248 C14 OL 1278 58.296 116.838 21.620 1.00 0.00 C ATOM 52249 H4R OL 1278 57.442 116.720 20.950 1.00 0.00 H ATOM 52250 H4S OL 1278 58.922 115.959 21.452 1.00 0.00 H ATOM 52251 C15 OL 1278 57.830 116.846 23.042 1.00 0.00 C ATOM 52252 H5R OL 1278 56.937 117.454 23.203 1.00 0.00 H ATOM 52253 H5S OL 1278 57.641 115.779 23.178 1.00 0.00 H ATOM 52254 C16 OL 1278 58.880 117.329 24.047 1.00 0.00 C ATOM 52255 H6R OL 1278 59.707 116.622 23.954 1.00 0.00 H ATOM 52256 H6S OL 1278 59.225 118.317 23.734 1.00 0.00 H ATOM 52257 C17 OL 1278 58.333 117.381 25.521 1.00 0.00 C ATOM 52258 H7R OL 1278 57.466 118.041 25.582 1.00 0.00 H ATOM 52259 H7S OL 1278 58.092 116.361 25.829 1.00 0.00 H ATOM 52260 C18 OL 1278 59.374 118.055 26.496 1.00 0.00 C ATOM 52261 H8R OL 1278 59.888 118.917 26.066 1.00 0.00 H ATOM 52262 H8S OL 1278 58.699 118.470 27.248 1.00 0.00 H ATOM 52263 C19 OL 1278 60.376 117.134 26.941 1.00 0.00 C ATOM 52264 H9R OL 1278 61.029 116.839 26.124 1.00 0.00 H ATOM 52265 C110 OL 1278 60.632 116.651 28.157 1.00 0.00 C ATOM 52266 H10R OL 1278 61.428 115.958 28.421 1.00 0.00 H ATOM 52267 C111 OL 1278 59.957 117.050 29.440 1.00 0.00 C ATOM 52268 H11R OL 1278 60.628 117.776 29.904 1.00 0.00 H ATOM 52269 H11S OL 1278 58.992 117.398 29.067 1.00 0.00 H ATOM 52270 C112 OL 1278 59.782 115.745 30.413 1.00 0.00 C ATOM 52271 H12R OL 1278 60.726 115.331 30.773 1.00 0.00 H ATOM 52272 H12S OL 1278 59.195 116.123 31.253 1.00 0.00 H ATOM 52273 C113 OL 1278 59.025 114.589 29.755 1.00 0.00 C ATOM 52274 H13R OL 1278 58.159 114.876 29.154 1.00 0.00 H ATOM 52275 H13S OL 1278 59.678 114.107 29.025 1.00 0.00 H ATOM 52276 C114 OL 1278 58.500 113.602 30.849 1.00 0.00 C ATOM 52277 H14R OL 1278 58.526 112.623 30.366 1.00 0.00 H ATOM 52278 H14S OL 1278 59.176 113.518 31.703 1.00 0.00 H ATOM 52279 C115 OL 1278 57.068 113.818 31.180 1.00 0.00 C ATOM 52280 H15R OL 1278 56.886 114.831 31.544 1.00 0.00 H ATOM 52281 H15S OL 1278 56.382 113.667 30.343 1.00 0.00 H ATOM 52282 C116 OL 1278 56.572 112.791 32.264 1.00 0.00 C ATOM 52283 H16R OL 1278 55.480 112.798 32.263 1.00 0.00 H ATOM 52284 H16S OL 1278 56.833 111.769 31.980 1.00 0.00 H ATOM 52285 C117 OL 1278 57.024 113.020 33.756 1.00 0.00 C ATOM 52286 H17R OL 1278 58.065 113.341 33.834 1.00 0.00 H ATOM 52287 H17S OL 1278 56.429 113.867 34.104 1.00 0.00 H ATOM 52288 C118 OL 1278 56.743 111.824 34.687 1.00 0.00 C ATOM 52289 H18R OL 1278 55.666 111.639 34.693 1.00 0.00 H ATOM 52290 H18S OL 1278 56.960 112.033 35.736 1.00 0.00 H ATOM 52291 H18T OL 1278 57.184 110.875 34.375 1.00 0.00 H TER 52292 OL 1278 ATOM 52292 C116 PA 1279 116.903 95.602 37.874 1.00 0.00 C ATOM 52293 H16R PA 1279 117.037 96.389 37.129 1.00 0.00 H ATOM 52294 H16S PA 1279 117.507 94.871 37.333 1.00 0.00 H ATOM 52295 H16T PA 1279 117.502 95.989 38.700 1.00 0.00 H ATOM 52296 C115 PA 1279 115.459 95.227 38.209 1.00 0.00 C ATOM 52297 H15R PA 1279 114.985 94.837 37.306 1.00 0.00 H ATOM 52298 H15S PA 1279 114.874 96.117 38.454 1.00 0.00 H ATOM 52299 C114 PA 1279 115.387 94.160 39.275 1.00 0.00 C ATOM 52300 H14R PA 1279 114.362 94.079 39.641 1.00 0.00 H ATOM 52301 H14S PA 1279 115.833 94.392 40.244 1.00 0.00 H ATOM 52302 C113 PA 1279 115.883 92.793 38.871 1.00 0.00 C ATOM 52303 H13R PA 1279 115.722 92.052 39.657 1.00 0.00 H ATOM 52304 H13S PA 1279 116.961 92.737 38.707 1.00 0.00 H ATOM 52305 C112 PA 1279 115.021 92.218 37.765 1.00 0.00 C ATOM 52306 H12R PA 1279 115.353 92.779 36.889 1.00 0.00 H ATOM 52307 H12S PA 1279 113.963 92.479 37.827 1.00 0.00 H ATOM 52308 C111 PA 1279 115.178 90.782 37.560 1.00 0.00 C ATOM 52309 H11R PA 1279 114.298 90.264 37.947 1.00 0.00 H ATOM 52310 H11S PA 1279 116.120 90.431 37.987 1.00 0.00 H ATOM 52311 C110 PA 1279 115.170 90.397 36.114 1.00 0.00 C ATOM 52312 H10R PA 1279 115.971 90.847 35.525 1.00 0.00 H ATOM 52313 H10S PA 1279 114.281 90.654 35.533 1.00 0.00 H ATOM 52314 C19 PA 1279 115.199 88.851 35.982 1.00 0.00 C ATOM 52315 H9R PA 1279 114.214 88.380 36.006 1.00 0.00 H ATOM 52316 H9S PA 1279 115.714 88.391 36.828 1.00 0.00 H ATOM 52317 C18 PA 1279 115.834 88.367 34.677 1.00 0.00 C ATOM 52318 H8R PA 1279 116.863 88.673 34.876 1.00 0.00 H ATOM 52319 H8S PA 1279 115.485 88.975 33.840 1.00 0.00 H ATOM 52320 C17 PA 1279 115.685 86.850 34.365 1.00 0.00 C ATOM 52321 H7R PA 1279 114.685 86.534 34.667 1.00 0.00 H ATOM 52322 H7S PA 1279 116.320 86.315 35.076 1.00 0.00 H ATOM 52323 C16 PA 1279 116.145 86.375 32.992 1.00 0.00 C ATOM 52324 H6R PA 1279 117.167 86.733 32.851 1.00 0.00 H ATOM 52325 H6S PA 1279 115.471 86.928 32.334 1.00 0.00 H ATOM 52326 C15 PA 1279 115.975 84.919 32.763 1.00 0.00 C ATOM 52327 H5R PA 1279 114.923 84.668 32.911 1.00 0.00 H ATOM 52328 H5S PA 1279 116.609 84.326 33.425 1.00 0.00 H ATOM 52329 C14 PA 1279 116.310 84.398 31.391 1.00 0.00 C ATOM 52330 H4R PA 1279 115.626 84.891 30.697 1.00 0.00 H ATOM 52331 H4S PA 1279 116.005 83.349 31.394 1.00 0.00 H ATOM 52332 C13 PA 1279 117.574 84.813 30.702 1.00 0.00 C ATOM 52333 H3R PA 1279 118.380 84.507 31.372 1.00 0.00 H ATOM 52334 H3S PA 1279 117.702 85.897 30.726 1.00 0.00 H ATOM 52335 C12 PA 1279 117.844 84.317 29.268 1.00 0.00 C ATOM 52336 H2R PA 1279 117.870 83.225 29.256 1.00 0.00 H ATOM 52337 H2S PA 1279 118.847 84.544 28.901 1.00 0.00 H ATOM 52338 C11 PGR 1280 116.842 84.788 28.316 1.00 0.00 C ATOM 52339 O12 PGR 1280 116.214 84.043 27.586 1.00 0.00 O ATOM 52340 O11 PGR 1280 116.625 86.145 28.389 1.00 0.00 O ATOM 52341 C1 PGR 1280 115.573 86.795 27.613 1.00 0.00 C ATOM 52342 HR PGR 1280 115.693 86.572 26.549 1.00 0.00 H ATOM 52343 HS PGR 1280 115.559 87.872 27.800 1.00 0.00 H ATOM 52344 C2 PGR 1280 114.199 86.331 28.008 1.00 0.00 C ATOM 52345 HX PGR 1280 114.105 85.243 27.964 1.00 0.00 H ATOM 52346 C3 PGR 1280 113.169 86.885 27.022 1.00 0.00 C ATOM 52347 HA PGR 1280 113.381 87.936 26.807 1.00 0.00 H ATOM 52348 HB PGR 1280 112.186 86.911 27.498 1.00 0.00 H ATOM 52349 O31 PGR 1280 113.207 86.120 25.841 1.00 0.00 O ATOM 52350 P31 PGR 1280 112.140 86.342 24.668 1.00 0.00 P ATOM 52351 O32 PGR 1280 112.948 87.170 23.563 1.00 0.00 O ATOM 52352 C31 PGR 1280 112.928 88.552 23.521 1.00 0.00 C ATOM 52353 H1A PGR 1280 113.172 88.990 24.493 1.00 0.00 H ATOM 52354 H1B PGR 1280 111.893 88.834 23.312 1.00 0.00 H ATOM 52355 C32 PGR 1280 113.956 88.950 22.443 1.00 0.00 C ATOM 52356 H2A PGR 1280 113.694 88.499 21.483 1.00 0.00 H ATOM 52357 O35 PGR 1280 115.273 88.522 22.671 1.00 0.00 O ATOM 52358 HO5A PGR 1280 115.199 87.583 22.922 1.00 0.00 H ATOM 52359 C33 PGR 1280 114.062 90.467 22.274 1.00 0.00 C ATOM 52360 H3A PGR 1280 113.016 90.768 22.174 1.00 0.00 H ATOM 52361 H3B PGR 1280 114.479 90.999 23.132 1.00 0.00 H ATOM 52362 O33 PGR 1280 111.851 84.989 24.186 1.00 0.00 O ATOM 52363 O34 PGR 1280 111.097 87.213 25.173 1.00 0.00 O ATOM 52364 O21 PGR 1280 114.006 86.860 29.357 1.00 0.00 O ATOM 52365 C21 PGR 1280 112.899 86.499 30.005 1.00 0.00 C ATOM 52366 O22 PGR 1280 112.138 85.663 29.570 1.00 0.00 O ATOM 52367 O36 PGR 1280 114.686 90.763 21.046 1.00 0.00 O ATOM 52368 HO6A PGR 1280 115.649 90.626 21.099 1.00 0.00 H ATOM 52369 C12 OL 1281 112.616 87.299 31.233 1.00 0.00 C ATOM 52370 H2R OL 1281 113.442 87.963 31.492 1.00 0.00 H ATOM 52371 H2S OL 1281 111.740 87.932 31.076 1.00 0.00 H ATOM 52372 C13 OL 1281 112.378 86.426 32.437 1.00 0.00 C ATOM 52373 H3R OL 1281 111.533 85.743 32.328 1.00 0.00 H ATOM 52374 H3S OL 1281 113.248 85.789 32.611 1.00 0.00 H ATOM 52375 C14 OL 1281 111.992 87.203 33.657 1.00 0.00 C ATOM 52376 H4R OL 1281 112.780 87.924 33.887 1.00 0.00 H ATOM 52377 H4S OL 1281 111.073 87.773 33.505 1.00 0.00 H ATOM 52378 C15 OL 1281 111.739 86.345 34.935 1.00 0.00 C ATOM 52379 H5R OL 1281 110.871 85.727 34.696 1.00 0.00 H ATOM 52380 H5S OL 1281 112.639 85.769 35.157 1.00 0.00 H ATOM 52381 C16 OL 1281 111.376 87.054 36.268 1.00 0.00 C ATOM 52382 H6R OL 1281 112.144 87.743 36.626 1.00 0.00 H ATOM 52383 H6S OL 1281 110.494 87.622 35.965 1.00 0.00 H ATOM 52384 C17 OL 1281 111.025 85.921 37.297 1.00 0.00 C ATOM 52385 H7R OL 1281 110.192 85.277 37.006 1.00 0.00 H ATOM 52386 H7S OL 1281 111.861 85.219 37.296 1.00 0.00 H ATOM 52387 C18 OL 1281 110.674 86.440 38.738 1.00 0.00 C ATOM 52388 H8R OL 1281 111.094 87.417 38.983 1.00 0.00 H ATOM 52389 H8S OL 1281 109.608 86.680 38.736 1.00 0.00 H ATOM 52390 C19 OL 1281 111.100 85.501 39.882 1.00 0.00 C ATOM 52391 H9R OL 1281 111.970 84.919 39.587 1.00 0.00 H ATOM 52392 C110 OL 1281 110.807 85.477 41.184 1.00 0.00 C ATOM 52393 H10R OL 1281 111.326 84.865 41.917 1.00 0.00 H ATOM 52394 C111 OL 1281 109.639 86.275 41.750 1.00 0.00 C ATOM 52395 H11R OL 1281 109.358 86.969 40.956 1.00 0.00 H ATOM 52396 H11S OL 1281 108.872 85.536 41.991 1.00 0.00 H ATOM 52397 C112 OL 1281 110.111 87.101 42.957 1.00 0.00 C ATOM 52398 H12R OL 1281 110.785 87.828 42.498 1.00 0.00 H ATOM 52399 H12S OL 1281 109.163 87.596 43.178 1.00 0.00 H ATOM 52400 C113 OL 1281 110.811 86.402 44.127 1.00 0.00 C ATOM 52401 H13R OL 1281 110.056 85.801 44.638 1.00 0.00 H ATOM 52402 H13S OL 1281 111.620 85.723 43.854 1.00 0.00 H ATOM 52403 C114 OL 1281 111.397 87.301 45.095 1.00 0.00 C ATOM 52404 H14R OL 1281 111.918 86.780 45.901 1.00 0.00 H ATOM 52405 H14S OL 1281 112.193 87.875 44.616 1.00 0.00 H ATOM 52406 C115 OL 1281 110.412 88.092 45.966 1.00 0.00 C ATOM 52407 H15R OL 1281 109.855 88.857 45.420 1.00 0.00 H ATOM 52408 H15S OL 1281 109.718 87.436 46.495 1.00 0.00 H ATOM 52409 C116 OL 1281 111.205 88.801 47.073 1.00 0.00 C ATOM 52410 H16R OL 1281 111.460 88.066 47.839 1.00 0.00 H ATOM 52411 H16S OL 1281 112.098 89.205 46.592 1.00 0.00 H ATOM 52412 C117 OL 1281 110.385 89.804 47.892 1.00 0.00 C ATOM 52413 H17R OL 1281 109.470 89.370 48.299 1.00 0.00 H ATOM 52414 H17S OL 1281 111.027 90.120 48.717 1.00 0.00 H ATOM 52415 C118 OL 1281 109.883 90.989 47.051 1.00 0.00 C ATOM 52416 H18R OL 1281 109.269 91.706 47.599 1.00 0.00 H ATOM 52417 H18S OL 1281 109.261 90.758 46.184 1.00 0.00 H ATOM 52418 H18T OL 1281 110.684 91.514 46.527 1.00 0.00 H TER 52419 OL 1281 ATOM 52419 C116 PA 1282 16.046 52.680 35.012 1.00 0.00 C ATOM 52420 H16R PA 1282 16.585 53.198 34.217 1.00 0.00 H ATOM 52421 H16S PA 1282 16.564 51.721 35.076 1.00 0.00 H ATOM 52422 H16T PA 1282 16.438 53.182 35.899 1.00 0.00 H ATOM 52423 C115 PA 1282 14.608 52.778 34.742 1.00 0.00 C ATOM 52424 H15R PA 1282 14.004 52.167 35.417 1.00 0.00 H ATOM 52425 H15S PA 1282 14.392 52.262 33.804 1.00 0.00 H ATOM 52426 C114 PA 1282 14.006 54.184 34.815 1.00 0.00 C ATOM 52427 H14R PA 1282 14.210 54.465 35.851 1.00 0.00 H ATOM 52428 H14S PA 1282 12.941 54.248 34.583 1.00 0.00 H ATOM 52429 C113 PA 1282 14.813 55.273 34.030 1.00 0.00 C ATOM 52430 H13R PA 1282 15.873 55.289 34.293 1.00 0.00 H ATOM 52431 H13S PA 1282 14.425 56.276 34.217 1.00 0.00 H ATOM 52432 C112 PA 1282 14.809 55.018 32.492 1.00 0.00 C ATOM 52433 H12R PA 1282 14.849 53.948 32.281 1.00 0.00 H ATOM 52434 H12S PA 1282 15.754 55.398 32.098 1.00 0.00 H ATOM 52435 C111 PA 1282 13.566 55.466 31.702 1.00 0.00 C ATOM 52436 H11R PA 1282 13.456 56.544 31.837 1.00 0.00 H ATOM 52437 H11S PA 1282 12.647 55.167 32.210 1.00 0.00 H ATOM 52438 C110 PA 1282 13.496 55.147 30.165 1.00 0.00 C ATOM 52439 H10R PA 1282 12.709 54.432 29.916 1.00 0.00 H ATOM 52440 H10S PA 1282 14.403 54.606 29.887 1.00 0.00 H ATOM 52441 C19 PA 1282 13.630 56.427 29.289 1.00 0.00 C ATOM 52442 H9R PA 1282 14.435 57.142 29.473 1.00 0.00 H ATOM 52443 H9S PA 1282 12.724 57.019 29.435 1.00 0.00 H ATOM 52444 C18 PA 1282 13.557 56.072 27.838 1.00 0.00 C ATOM 52445 H8R PA 1282 12.520 55.760 27.698 1.00 0.00 H ATOM 52446 H8S PA 1282 14.244 55.249 27.629 1.00 0.00 H ATOM 52447 C17 PA 1282 13.795 57.321 26.957 1.00 0.00 C ATOM 52448 H7R PA 1282 14.843 57.629 26.972 1.00 0.00 H ATOM 52449 H7S PA 1282 13.306 58.240 27.286 1.00 0.00 H ATOM 52450 C16 PA 1282 13.676 56.993 25.483 1.00 0.00 C ATOM 52451 H6R PA 1282 12.866 56.261 25.495 1.00 0.00 H ATOM 52452 H6S PA 1282 14.579 56.475 25.153 1.00 0.00 H ATOM 52453 C15 PA 1282 13.258 58.217 24.617 1.00 0.00 C ATOM 52454 H5R PA 1282 14.058 58.950 24.745 1.00 0.00 H ATOM 52455 H5S PA 1282 12.295 58.576 24.984 1.00 0.00 H ATOM 52456 C14 PA 1282 13.066 57.944 23.103 1.00 0.00 C ATOM 52457 H4R PA 1282 12.214 57.272 22.978 1.00 0.00 H ATOM 52458 H4S PA 1282 13.979 57.466 22.743 1.00 0.00 H ATOM 52459 C13 PA 1282 12.894 59.296 22.307 1.00 0.00 C ATOM 52460 H3R PA 1282 13.696 59.994 22.555 1.00 0.00 H ATOM 52461 H3S PA 1282 11.948 59.707 22.666 1.00 0.00 H ATOM 52462 C12 PA 1282 12.900 59.238 20.769 1.00 0.00 C ATOM 52463 H2R PA 1282 13.077 60.280 20.493 1.00 0.00 H ATOM 52464 H2S PA 1282 11.966 58.855 20.351 1.00 0.00 H ATOM 52465 C11 PGR 1283 14.097 58.471 20.317 1.00 0.00 C ATOM 52466 O12 PGR 1283 15.211 58.885 20.634 1.00 0.00 O ATOM 52467 O11 PGR 1283 13.876 57.336 19.670 1.00 0.00 O ATOM 52468 C1 PGR 1283 14.929 56.391 19.296 1.00 0.00 C ATOM 52469 HR PGR 1283 15.517 56.101 20.170 1.00 0.00 H ATOM 52470 HS PGR 1283 15.512 56.892 18.518 1.00 0.00 H ATOM 52471 C2 PGR 1283 14.438 55.126 18.611 1.00 0.00 C ATOM 52472 HX PGR 1283 15.149 54.320 18.813 1.00 0.00 H ATOM 52473 C3 PGR 1283 14.066 55.436 17.055 1.00 0.00 C ATOM 52474 HA PGR 1283 13.529 54.665 16.496 1.00 0.00 H ATOM 52475 HB PGR 1283 14.990 55.737 16.555 1.00 0.00 H ATOM 52476 O31 PGR 1283 13.191 56.577 16.989 1.00 0.00 O ATOM 52477 P31 PGR 1283 12.860 57.228 15.552 1.00 0.00 P ATOM 52478 O32 PGR 1283 11.744 56.316 14.851 1.00 0.00 O ATOM 52479 C31 PGR 1283 10.558 56.092 15.510 1.00 0.00 C ATOM 52480 H1A PGR 1283 10.192 57.056 15.871 1.00 0.00 H ATOM 52481 H1B PGR 1283 10.705 55.368 16.315 1.00 0.00 H ATOM 52482 C32 PGR 1283 9.619 55.538 14.387 1.00 0.00 C ATOM 52483 H2A PGR 1283 8.571 55.716 14.639 1.00 0.00 H ATOM 52484 O35 PGR 1283 9.920 54.123 14.382 1.00 0.00 O ATOM 52485 HO5A PGR 1283 9.938 53.819 15.308 1.00 0.00 H ATOM 52486 C33 PGR 1283 9.800 56.123 12.947 1.00 0.00 C ATOM 52487 H3A PGR 1283 9.900 57.206 13.052 1.00 0.00 H ATOM 52488 H3B PGR 1283 10.761 55.664 12.701 1.00 0.00 H ATOM 52489 O33 PGR 1283 12.344 58.581 15.771 1.00 0.00 O ATOM 52490 O34 PGR 1283 14.064 57.139 14.758 1.00 0.00 O ATOM 52491 O21 PGR 1283 13.155 54.774 19.232 1.00 0.00 O ATOM 52492 C21 PGR 1283 13.161 54.303 20.495 1.00 0.00 C ATOM 52493 O22 PGR 1283 14.218 54.196 21.118 1.00 0.00 O ATOM 52494 O36 PGR 1283 8.720 55.857 12.062 1.00 0.00 O ATOM 52495 HO6A PGR 1283 7.927 56.066 12.587 1.00 0.00 H ATOM 52496 C12 OL 1284 11.860 53.679 21.123 1.00 0.00 C ATOM 52497 H2R OL 1284 11.197 54.489 21.434 1.00 0.00 H ATOM 52498 H2S OL 1284 11.273 53.293 20.287 1.00 0.00 H ATOM 52499 C13 OL 1284 12.177 52.591 22.184 1.00 0.00 C ATOM 52500 H3R OL 1284 11.426 51.819 22.002 1.00 0.00 H ATOM 52501 H3S OL 1284 13.107 52.111 21.874 1.00 0.00 H ATOM 52502 C14 OL 1284 12.276 53.217 23.500 1.00 0.00 C ATOM 52503 H4R OL 1284 13.083 53.944 23.616 1.00 0.00 H ATOM 52504 H4S OL 1284 11.361 53.716 23.823 1.00 0.00 H ATOM 52505 C15 OL 1284 12.527 52.135 24.602 1.00 0.00 C ATOM 52506 H5R OL 1284 11.805 51.317 24.563 1.00 0.00 H ATOM 52507 H5S OL 1284 13.556 51.794 24.474 1.00 0.00 H ATOM 52508 C16 OL 1284 12.632 52.575 26.090 1.00 0.00 C ATOM 52509 H6R OL 1284 13.500 53.212 26.275 1.00 0.00 H ATOM 52510 H6S OL 1284 11.703 53.048 26.413 1.00 0.00 H ATOM 52511 C17 OL 1284 12.947 51.387 27.038 1.00 0.00 C ATOM 52512 H7R OL 1284 12.060 50.790 26.817 1.00 0.00 H ATOM 52513 H7S OL 1284 13.837 50.781 26.855 1.00 0.00 H ATOM 52514 C18 OL 1284 13.133 51.774 28.485 1.00 0.00 C ATOM 52515 H8R OL 1284 13.979 52.458 28.588 1.00 0.00 H ATOM 52516 H8S OL 1284 12.238 52.345 28.739 1.00 0.00 H ATOM 52517 C19 OL 1284 13.309 50.749 29.552 1.00 0.00 C ATOM 52518 H9R OL 1284 14.118 50.031 29.443 1.00 0.00 H ATOM 52519 C110 OL 1284 12.563 50.613 30.650 1.00 0.00 C ATOM 52520 H10R OL 1284 12.801 49.814 31.347 1.00 0.00 H ATOM 52521 C111 OL 1284 11.545 51.523 31.206 1.00 0.00 C ATOM 52522 H11R OL 1284 11.778 51.838 32.225 1.00 0.00 H ATOM 52523 H11S OL 1284 11.426 52.433 30.615 1.00 0.00 H ATOM 52524 C112 OL 1284 10.254 50.685 31.128 1.00 0.00 C ATOM 52525 H12R OL 1284 10.056 50.333 30.114 1.00 0.00 H ATOM 52526 H12S OL 1284 10.396 49.745 31.666 1.00 0.00 H ATOM 52527 C113 OL 1284 9.028 51.469 31.622 1.00 0.00 C ATOM 52528 H13R OL 1284 8.757 52.293 30.958 1.00 0.00 H ATOM 52529 H13S OL 1284 8.220 50.741 31.516 1.00 0.00 H ATOM 52530 C114 OL 1284 8.992 51.867 33.070 1.00 0.00 C ATOM 52531 H14R OL 1284 9.658 52.706 33.281 1.00 0.00 H ATOM 52532 H14S OL 1284 8.000 52.196 33.386 1.00 0.00 H ATOM 52533 C115 OL 1284 9.414 50.815 34.125 1.00 0.00 C ATOM 52534 H15R OL 1284 8.859 49.884 33.988 1.00 0.00 H ATOM 52535 H15S OL 1284 10.466 50.631 33.901 1.00 0.00 H ATOM 52536 C116 OL 1284 9.260 51.208 35.567 1.00 0.00 C ATOM 52537 H16R OL 1284 8.246 51.381 35.933 1.00 0.00 H ATOM 52538 H16S OL 1284 9.624 50.345 36.129 1.00 0.00 H ATOM 52539 C117 OL 1284 9.987 52.353 36.112 1.00 0.00 C ATOM 52540 H17R OL 1284 9.719 53.234 35.526 1.00 0.00 H ATOM 52541 H17S OL 1284 9.767 52.601 37.152 1.00 0.00 H ATOM 52542 C118 OL 1284 11.452 52.146 36.207 1.00 0.00 C ATOM 52543 H18R OL 1284 11.835 52.224 35.188 1.00 0.00 H ATOM 52544 H18S OL 1284 11.898 51.234 36.608 1.00 0.00 H ATOM 52545 H18T OL 1284 11.877 53.040 36.669 1.00 0.00 H TER 52546 OL 1284 ATOM 52546 C116 PA 1285 135.228 88.336 44.769 1.00 0.00 C ATOM 52547 H16R PA 1285 135.804 87.855 43.976 1.00 0.00 H ATOM 52548 H16S PA 1285 134.704 87.551 45.319 1.00 0.00 H ATOM 52549 H16T PA 1285 135.969 88.754 45.454 1.00 0.00 H ATOM 52550 C115 PA 1285 134.280 89.308 44.178 1.00 0.00 C ATOM 52551 H15R PA 1285 133.965 90.034 44.930 1.00 0.00 H ATOM 52552 H15S PA 1285 133.305 88.822 44.101 1.00 0.00 H ATOM 52553 C114 PA 1285 134.820 90.049 42.944 1.00 0.00 C ATOM 52554 H14R PA 1285 135.222 89.385 42.176 1.00 0.00 H ATOM 52555 H14S PA 1285 135.753 90.565 43.184 1.00 0.00 H ATOM 52556 C113 PA 1285 133.720 90.819 42.223 1.00 0.00 C ATOM 52557 H13R PA 1285 133.258 91.586 42.848 1.00 0.00 H ATOM 52558 H13S PA 1285 132.832 90.226 41.999 1.00 0.00 H ATOM 52559 C112 PA 1285 134.241 91.377 40.867 1.00 0.00 C ATOM 52560 H12R PA 1285 133.471 91.968 40.366 1.00 0.00 H ATOM 52561 H12S PA 1285 134.355 90.506 40.219 1.00 0.00 H ATOM 52562 C111 PA 1285 135.474 92.300 41.003 1.00 0.00 C ATOM 52563 H11R PA 1285 136.317 91.719 41.383 1.00 0.00 H ATOM 52564 H11S PA 1285 135.277 93.168 41.635 1.00 0.00 H ATOM 52565 C110 PA 1285 135.968 92.794 39.637 1.00 0.00 C ATOM 52566 H10R PA 1285 135.195 93.239 39.007 1.00 0.00 H ATOM 52567 H10S PA 1285 136.146 92.046 38.862 1.00 0.00 H ATOM 52568 C19 PA 1285 137.125 93.792 39.786 1.00 0.00 C ATOM 52569 H9R PA 1285 137.856 93.575 40.568 1.00 0.00 H ATOM 52570 H9S PA 1285 136.798 94.745 40.207 1.00 0.00 H ATOM 52571 C18 PA 1285 138.037 94.036 38.516 1.00 0.00 C ATOM 52572 H8R PA 1285 137.392 94.355 37.695 1.00 0.00 H ATOM 52573 H8S PA 1285 138.504 93.091 38.230 1.00 0.00 H ATOM 52574 C17 PA 1285 139.098 95.166 38.703 1.00 0.00 C ATOM 52575 H7R PA 1285 139.656 94.970 39.621 1.00 0.00 H ATOM 52576 H7S PA 1285 138.577 96.075 39.013 1.00 0.00 H ATOM 52577 C16 PA 1285 140.054 95.392 37.543 1.00 0.00 C ATOM 52578 H6R PA 1285 139.409 96.013 36.919 1.00 0.00 H ATOM 52579 H6S PA 1285 140.170 94.325 37.341 1.00 0.00 H ATOM 52580 C15 PA 1285 141.344 96.154 37.719 1.00 0.00 C ATOM 52581 H5R PA 1285 141.984 95.776 38.520 1.00 0.00 H ATOM 52582 H5S PA 1285 141.205 97.229 37.847 1.00 0.00 H ATOM 52583 C14 PA 1285 142.227 95.953 36.459 1.00 0.00 C ATOM 52584 H4R PA 1285 142.602 94.930 36.378 1.00 0.00 H ATOM 52585 H4S PA 1285 143.112 96.540 36.714 1.00 0.00 H ATOM 52586 C13 PA 1285 141.615 96.563 35.190 1.00 0.00 C ATOM 52587 H3R PA 1285 141.372 97.597 35.443 1.00 0.00 H ATOM 52588 H3S PA 1285 140.721 95.948 35.068 1.00 0.00 H ATOM 52589 C12 PA 1285 142.428 96.406 33.938 1.00 0.00 C ATOM 52590 H2R PA 1285 142.402 97.406 33.501 1.00 0.00 H ATOM 52591 H2S PA 1285 143.475 96.321 34.240 1.00 0.00 H ATOM 52592 C11 PGR 1286 141.848 95.321 33.030 1.00 0.00 C ATOM 52593 O12 PGR 1286 140.693 95.362 32.629 1.00 0.00 O ATOM 52594 O11 PGR 1286 142.723 94.287 32.776 1.00 0.00 O ATOM 52595 C1 PGR 1286 142.162 93.058 32.246 1.00 0.00 C ATOM 52596 HR PGR 1286 142.976 92.378 31.983 1.00 0.00 H ATOM 52597 HS PGR 1286 141.469 93.353 31.454 1.00 0.00 H ATOM 52598 C2 PGR 1286 141.448 92.311 33.434 1.00 0.00 C ATOM 52599 HX PGR 1286 142.104 92.349 34.307 1.00 0.00 H ATOM 52600 C3 PGR 1286 141.275 90.852 33.061 1.00 0.00 C ATOM 52601 HA PGR 1286 140.872 90.271 33.895 1.00 0.00 H ATOM 52602 HB PGR 1286 142.219 90.421 32.716 1.00 0.00 H ATOM 52603 O31 PGR 1286 140.492 90.726 31.940 1.00 0.00 O ATOM 52604 P31 PGR 1286 140.422 89.388 31.112 1.00 0.00 P ATOM 52605 O32 PGR 1286 141.900 89.217 30.512 1.00 0.00 O ATOM 52606 C31 PGR 1286 142.568 90.229 29.698 1.00 0.00 C ATOM 52607 H1A PGR 1286 142.119 91.225 29.688 1.00 0.00 H ATOM 52608 H1B PGR 1286 143.611 90.299 30.016 1.00 0.00 H ATOM 52609 C32 PGR 1286 142.521 89.745 28.250 1.00 0.00 C ATOM 52610 H2A PGR 1286 143.136 90.476 27.719 1.00 0.00 H ATOM 52611 O35 PGR 1286 141.150 89.755 27.837 1.00 0.00 O ATOM 52612 HO5A PGR 1286 140.557 89.440 28.542 1.00 0.00 H ATOM 52613 C33 PGR 1286 143.059 88.335 28.132 1.00 0.00 C ATOM 52614 H3A PGR 1286 144.105 88.265 28.440 1.00 0.00 H ATOM 52615 H3B PGR 1286 142.362 87.673 28.653 1.00 0.00 H ATOM 52616 O33 PGR 1286 140.037 88.251 31.987 1.00 0.00 O ATOM 52617 O34 PGR 1286 139.484 89.748 29.996 1.00 0.00 O ATOM 52618 O21 PGR 1286 140.050 92.857 33.700 1.00 0.00 O ATOM 52619 C21 PGR 1286 139.397 92.407 34.768 1.00 0.00 C ATOM 52620 O22 PGR 1286 139.888 91.618 35.521 1.00 0.00 O ATOM 52621 O36 PGR 1286 143.168 87.905 26.774 1.00 0.00 O ATOM 52622 HO6A PGR 1286 143.444 86.976 26.683 1.00 0.00 H ATOM 52623 C12 OL 1287 138.019 93.143 34.912 1.00 0.00 C ATOM 52624 H2R OL 1287 138.158 93.939 35.646 1.00 0.00 H ATOM 52625 H2S OL 1287 137.750 93.596 33.955 1.00 0.00 H ATOM 52626 C13 OL 1287 136.919 92.102 35.168 1.00 0.00 C ATOM 52627 H3R OL 1287 136.963 91.357 34.371 1.00 0.00 H ATOM 52628 H3S OL 1287 137.184 91.587 36.094 1.00 0.00 H ATOM 52629 C14 OL 1287 135.502 92.683 35.432 1.00 0.00 C ATOM 52630 H4R OL 1287 135.592 93.431 36.223 1.00 0.00 H ATOM 52631 H4S OL 1287 134.935 93.013 34.559 1.00 0.00 H ATOM 52632 C15 OL 1287 134.557 91.618 36.058 1.00 0.00 C ATOM 52633 H5R OL 1287 134.626 90.769 35.375 1.00 0.00 H ATOM 52634 H5S OL 1287 135.055 91.458 37.016 1.00 0.00 H ATOM 52635 C16 OL 1287 133.069 91.993 36.091 1.00 0.00 C ATOM 52636 H6R OL 1287 133.059 93.066 36.294 1.00 0.00 H ATOM 52637 H6S OL 1287 132.729 91.960 35.054 1.00 0.00 H ATOM 52638 C17 OL 1287 132.233 90.978 36.959 1.00 0.00 C ATOM 52639 H7R OL 1287 132.403 91.136 38.026 1.00 0.00 H ATOM 52640 H7S OL 1287 131.211 91.328 36.797 1.00 0.00 H ATOM 52641 C18 OL 1287 132.462 89.519 36.513 1.00 0.00 C ATOM 52642 H8R OL 1287 132.502 89.523 35.421 1.00 0.00 H ATOM 52643 H8S OL 1287 133.472 89.297 36.865 1.00 0.00 H ATOM 52644 C19 OL 1287 131.390 88.568 37.091 1.00 0.00 C ATOM 52645 H9R OL 1287 130.472 88.497 36.514 1.00 0.00 H ATOM 52646 C110 OL 1287 131.547 87.866 38.179 1.00 0.00 C ATOM 52647 H10R OL 1287 130.659 87.358 38.544 1.00 0.00 H ATOM 52648 C111 OL 1287 132.685 87.800 39.123 1.00 0.00 C ATOM 52649 H11R OL 1287 133.198 86.851 38.958 1.00 0.00 H ATOM 52650 H11S OL 1287 133.404 88.613 39.003 1.00 0.00 H ATOM 52651 C112 OL 1287 132.124 87.744 40.569 1.00 0.00 C ATOM 52652 H12R OL 1287 133.010 87.754 41.208 1.00 0.00 H ATOM 52653 H12S OL 1287 131.667 88.721 40.739 1.00 0.00 H ATOM 52654 C113 OL 1287 131.316 86.465 40.928 1.00 0.00 C ATOM 52655 H13R OL 1287 130.251 86.596 40.725 1.00 0.00 H ATOM 52656 H13S OL 1287 131.621 85.679 40.234 1.00 0.00 H ATOM 52657 C114 OL 1287 131.517 85.875 42.307 1.00 0.00 C ATOM 52658 H14R OL 1287 131.206 84.830 42.239 1.00 0.00 H ATOM 52659 H14S OL 1287 132.588 85.804 42.510 1.00 0.00 H ATOM 52660 C115 OL 1287 130.743 86.487 43.349 1.00 0.00 C ATOM 52661 H15R OL 1287 131.151 87.499 43.400 1.00 0.00 H ATOM 52662 H15S OL 1287 129.680 86.555 43.109 1.00 0.00 H ATOM 52663 C116 OL 1287 130.972 85.922 44.751 1.00 0.00 C ATOM 52664 H16R OL 1287 130.515 84.950 44.950 1.00 0.00 H ATOM 52665 H16S OL 1287 132.034 85.682 44.837 1.00 0.00 H ATOM 52666 C117 OL 1287 130.532 86.798 45.921 1.00 0.00 C ATOM 52667 H17R OL 1287 130.992 86.477 46.858 1.00 0.00 H ATOM 52668 H17S OL 1287 130.851 87.830 45.764 1.00 0.00 H ATOM 52669 C118 OL 1287 129.031 86.651 46.304 1.00 0.00 C ATOM 52670 H18R OL 1287 128.843 85.621 46.615 1.00 0.00 H ATOM 52671 H18S OL 1287 128.440 86.885 45.417 1.00 0.00 H ATOM 52672 H18T OL 1287 128.719 87.452 46.978 1.00 0.00 H TER 52673 OL 1287 ATOM 52673 C116 PA 1288 29.638 50.599 36.182 1.00 0.00 C ATOM 52674 H16R PA 1288 28.754 50.034 35.881 1.00 0.00 H ATOM 52675 H16S PA 1288 29.610 51.665 35.946 1.00 0.00 H ATOM 52676 H16T PA 1288 29.596 50.548 37.272 1.00 0.00 H ATOM 52677 C115 PA 1288 30.996 50.104 35.617 1.00 0.00 C ATOM 52678 H15R PA 1288 31.219 50.521 34.632 1.00 0.00 H ATOM 52679 H15S PA 1288 30.947 49.020 35.497 1.00 0.00 H ATOM 52680 C114 PA 1288 32.149 50.290 36.579 1.00 0.00 C ATOM 52681 H14R PA 1288 31.924 49.829 37.543 1.00 0.00 H ATOM 52682 H14S PA 1288 32.385 51.343 36.744 1.00 0.00 H ATOM 52683 C113 PA 1288 33.503 49.811 35.994 1.00 0.00 C ATOM 52684 H13R PA 1288 33.778 50.133 34.988 1.00 0.00 H ATOM 52685 H13S PA 1288 33.426 48.731 35.853 1.00 0.00 H ATOM 52686 C112 PA 1288 34.756 50.080 36.742 1.00 0.00 C ATOM 52687 H12R PA 1288 34.605 49.507 37.659 1.00 0.00 H ATOM 52688 H12S PA 1288 34.881 51.089 37.142 1.00 0.00 H ATOM 52689 C111 PA 1288 35.990 49.497 35.986 1.00 0.00 C ATOM 52690 H11R PA 1288 35.900 49.811 34.944 1.00 0.00 H ATOM 52691 H11S PA 1288 35.817 48.420 35.924 1.00 0.00 H ATOM 52692 C110 PA 1288 37.396 49.923 36.468 1.00 0.00 C ATOM 52693 H10R PA 1288 37.494 49.916 37.556 1.00 0.00 H ATOM 52694 H10S PA 1288 37.432 50.981 36.200 1.00 0.00 H ATOM 52695 C19 PA 1288 38.542 49.187 35.805 1.00 0.00 C ATOM 52696 H9R PA 1288 38.565 49.477 34.753 1.00 0.00 H ATOM 52697 H9S PA 1288 38.262 48.134 35.743 1.00 0.00 H ATOM 52698 C18 PA 1288 39.978 49.632 36.319 1.00 0.00 C ATOM 52699 H8R PA 1288 40.100 49.121 37.277 1.00 0.00 H ATOM 52700 H8S PA 1288 39.974 50.723 36.365 1.00 0.00 H ATOM 52701 C17 PA 1288 41.156 49.382 35.430 1.00 0.00 C ATOM 52702 H7R PA 1288 41.082 49.731 34.397 1.00 0.00 H ATOM 52703 H7S PA 1288 41.119 48.321 35.176 1.00 0.00 H ATOM 52704 C16 PA 1288 42.585 49.686 35.893 1.00 0.00 C ATOM 52705 H6R PA 1288 42.621 49.214 36.877 1.00 0.00 H ATOM 52706 H6S PA 1288 42.802 50.749 36.013 1.00 0.00 H ATOM 52707 C15 PA 1288 43.717 49.090 35.099 1.00 0.00 C ATOM 52708 H5R PA 1288 43.372 48.087 34.840 1.00 0.00 H ATOM 52709 H5S PA 1288 44.617 48.795 35.643 1.00 0.00 H ATOM 52710 C14 PA 1288 44.106 50.040 34.008 1.00 0.00 C ATOM 52711 H4R PA 1288 44.489 51.017 34.312 1.00 0.00 H ATOM 52712 H4S PA 1288 43.236 50.242 33.379 1.00 0.00 H ATOM 52713 C13 PA 1288 45.135 49.460 33.046 1.00 0.00 C ATOM 52714 H3R PA 1288 44.758 48.545 32.585 1.00 0.00 H ATOM 52715 H3S PA 1288 46.007 49.169 33.635 1.00 0.00 H ATOM 52716 C12 PA 1288 45.472 50.576 31.946 1.00 0.00 C ATOM 52717 H2R PA 1288 46.447 50.304 31.538 1.00 0.00 H ATOM 52718 H2S PA 1288 45.547 51.604 32.306 1.00 0.00 H ATOM 52719 C11 PGR 1289 44.393 50.674 30.877 1.00 0.00 C ATOM 52720 O12 PGR 1289 43.710 51.674 30.717 1.00 0.00 O ATOM 52721 O11 PGR 1289 44.286 49.554 30.139 1.00 0.00 O ATOM 52722 C1 PGR 1289 43.350 49.436 29.023 1.00 0.00 C ATOM 52723 HR PGR 1289 43.615 48.613 28.355 1.00 0.00 H ATOM 52724 HS PGR 1289 43.284 50.352 28.431 1.00 0.00 H ATOM 52725 C2 PGR 1289 41.944 48.919 29.546 1.00 0.00 C ATOM 52726 HX PGR 1289 42.069 48.198 30.358 1.00 0.00 H ATOM 52727 C3 PGR 1289 41.076 48.378 28.403 1.00 0.00 C ATOM 52728 HA PGR 1289 40.037 48.286 28.729 1.00 0.00 H ATOM 52729 HB PGR 1289 41.459 47.401 28.095 1.00 0.00 H ATOM 52730 O31 PGR 1289 41.098 49.290 27.284 1.00 0.00 O ATOM 52731 P31 PGR 1289 40.762 48.804 25.788 1.00 0.00 P ATOM 52732 O32 PGR 1289 41.916 47.691 25.540 1.00 0.00 O ATOM 52733 C31 PGR 1289 43.214 48.069 25.254 1.00 0.00 C ATOM 52734 H1A PGR 1289 43.313 48.531 24.269 1.00 0.00 H ATOM 52735 H1B PGR 1289 43.492 48.810 26.008 1.00 0.00 H ATOM 52736 C32 PGR 1289 44.245 46.877 25.245 1.00 0.00 C ATOM 52737 H2A PGR 1289 45.227 47.315 25.048 1.00 0.00 H ATOM 52738 O35 PGR 1289 43.951 46.088 24.105 1.00 0.00 O ATOM 52739 HO5A PGR 1289 44.709 46.156 23.497 1.00 0.00 H ATOM 52740 C33 PGR 1289 44.266 46.029 26.534 1.00 0.00 C ATOM 52741 H3A PGR 1289 45.175 45.423 26.512 1.00 0.00 H ATOM 52742 H3B PGR 1289 44.173 46.711 27.384 1.00 0.00 H ATOM 52743 O33 PGR 1289 39.526 48.082 25.807 1.00 0.00 O ATOM 52744 O34 PGR 1289 40.783 49.931 24.872 1.00 0.00 O ATOM 52745 O21 PGR 1289 41.234 50.045 30.135 1.00 0.00 O ATOM 52746 C21 PGR 1289 40.213 49.836 30.898 1.00 0.00 C ATOM 52747 O22 PGR 1289 39.814 48.769 31.277 1.00 0.00 O ATOM 52748 O36 PGR 1289 43.070 45.230 26.454 1.00 0.00 O ATOM 52749 HO6A PGR 1289 43.029 44.734 27.292 1.00 0.00 H ATOM 52750 C12 OL 1290 39.701 51.199 31.150 1.00 0.00 C ATOM 52751 H2R OL 1290 40.153 51.527 32.088 1.00 0.00 H ATOM 52752 H2S OL 1290 40.100 51.952 30.467 1.00 0.00 H ATOM 52753 C13 OL 1290 38.194 51.376 31.013 1.00 0.00 C ATOM 52754 H3R OL 1290 37.962 52.442 30.961 1.00 0.00 H ATOM 52755 H3S OL 1290 37.763 51.028 30.072 1.00 0.00 H ATOM 52756 C14 OL 1290 37.425 50.961 32.261 1.00 0.00 C ATOM 52757 H4R OL 1290 37.716 49.989 32.665 1.00 0.00 H ATOM 52758 H4S OL 1290 37.662 51.689 33.040 1.00 0.00 H ATOM 52759 C15 OL 1290 35.928 50.837 32.005 1.00 0.00 C ATOM 52760 H5R OL 1290 35.609 50.207 31.172 1.00 0.00 H ATOM 52761 H5S OL 1290 35.485 50.336 32.868 1.00 0.00 H ATOM 52762 C16 OL 1290 35.253 52.229 32.002 1.00 0.00 C ATOM 52763 H6R OL 1290 34.198 52.104 32.252 1.00 0.00 H ATOM 52764 H6S OL 1290 35.566 52.820 32.865 1.00 0.00 H ATOM 52765 C17 OL 1290 35.170 52.919 30.648 1.00 0.00 C ATOM 52766 H7R OL 1290 34.724 53.886 30.888 1.00 0.00 H ATOM 52767 H7S OL 1290 36.130 53.162 30.186 1.00 0.00 H ATOM 52768 C18 OL 1290 34.388 52.177 29.603 1.00 0.00 C ATOM 52769 H8R OL 1290 34.567 52.651 28.636 1.00 0.00 H ATOM 52770 H8S OL 1290 34.778 51.181 29.384 1.00 0.00 H ATOM 52771 C19 OL 1290 32.895 52.212 29.897 1.00 0.00 C ATOM 52772 H9R OL 1290 32.398 53.177 29.838 1.00 0.00 H ATOM 52773 C110 OL 1290 32.151 51.084 30.150 1.00 0.00 C ATOM 52774 H10R OL 1290 31.075 51.107 30.300 1.00 0.00 H ATOM 52775 C111 OL 1290 32.560 49.646 30.222 1.00 0.00 C ATOM 52776 H11R OL 1290 32.002 49.003 29.538 1.00 0.00 H ATOM 52777 H11S OL 1290 33.617 49.488 29.997 1.00 0.00 H ATOM 52778 C112 OL 1290 32.303 49.236 31.716 1.00 0.00 C ATOM 52779 H12R OL 1290 33.009 49.867 32.261 1.00 0.00 H ATOM 52780 H12S OL 1290 31.275 49.499 31.971 1.00 0.00 H ATOM 52781 C113 OL 1290 32.775 47.754 32.026 1.00 0.00 C ATOM 52782 H13R OL 1290 32.558 47.237 31.089 1.00 0.00 H ATOM 52783 H13S OL 1290 33.859 47.851 31.937 1.00 0.00 H ATOM 52784 C114 OL 1290 32.255 47.093 33.379 1.00 0.00 C ATOM 52785 H14R OL 1290 32.711 47.666 34.189 1.00 0.00 H ATOM 52786 H14S OL 1290 31.171 47.152 33.496 1.00 0.00 H ATOM 52787 C115 OL 1290 32.667 45.684 33.432 1.00 0.00 C ATOM 52788 H15R OL 1290 32.435 45.274 32.447 1.00 0.00 H ATOM 52789 H15S OL 1290 33.756 45.669 33.509 1.00 0.00 H ATOM 52790 C116 OL 1290 31.998 44.981 34.615 1.00 0.00 C ATOM 52791 H16R OL 1290 32.232 45.419 35.588 1.00 0.00 H ATOM 52792 H16S OL 1290 30.906 44.959 34.633 1.00 0.00 H ATOM 52793 C117 OL 1290 32.472 43.571 34.864 1.00 0.00 C ATOM 52794 H17R OL 1290 32.307 43.071 33.907 1.00 0.00 H ATOM 52795 H17S OL 1290 33.560 43.547 34.954 1.00 0.00 H ATOM 52796 C118 OL 1290 31.739 42.876 36.017 1.00 0.00 C ATOM 52797 H18R OL 1290 32.202 43.105 36.980 1.00 0.00 H ATOM 52798 H18S OL 1290 31.778 41.792 35.892 1.00 0.00 H ATOM 52799 H18T OL 1290 30.674 43.103 36.088 1.00 0.00 H TER 52800 OL 1290 ATOM 52800 C116 PA 1291 82.380 69.552 32.048 1.00 0.00 C ATOM 52801 H16R PA 1291 82.933 70.434 32.378 1.00 0.00 H ATOM 52802 H16S PA 1291 82.152 69.041 32.986 1.00 0.00 H ATOM 52803 H16T PA 1291 81.468 69.917 31.571 1.00 0.00 H ATOM 52804 C115 PA 1291 83.163 68.721 31.029 1.00 0.00 C ATOM 52805 H15R PA 1291 84.146 68.572 31.480 1.00 0.00 H ATOM 52806 H15S PA 1291 83.322 69.261 30.094 1.00 0.00 H ATOM 52807 C114 PA 1291 82.461 67.376 30.683 1.00 0.00 C ATOM 52808 H14R PA 1291 81.515 67.539 30.163 1.00 0.00 H ATOM 52809 H14S PA 1291 82.191 66.743 31.531 1.00 0.00 H ATOM 52810 C113 PA 1291 83.238 66.300 29.875 1.00 0.00 C ATOM 52811 H13R PA 1291 83.239 66.531 28.808 1.00 0.00 H ATOM 52812 H13S PA 1291 82.656 65.377 29.904 1.00 0.00 H ATOM 52813 C112 PA 1291 84.661 66.091 30.381 1.00 0.00 C ATOM 52814 H12R PA 1291 84.646 66.154 31.471 1.00 0.00 H ATOM 52815 H12S PA 1291 85.308 66.896 30.028 1.00 0.00 H ATOM 52816 C111 PA 1291 85.285 64.662 30.038 1.00 0.00 C ATOM 52817 H11R PA 1291 84.721 63.918 30.605 1.00 0.00 H ATOM 52818 H11S PA 1291 86.347 64.739 30.281 1.00 0.00 H ATOM 52819 C110 PA 1291 85.278 64.318 28.546 1.00 0.00 C ATOM 52820 H10R PA 1291 85.729 65.089 27.917 1.00 0.00 H ATOM 52821 H10S PA 1291 84.245 64.174 28.223 1.00 0.00 H ATOM 52822 C19 PA 1291 86.007 63.020 28.194 1.00 0.00 C ATOM 52823 H9R PA 1291 85.786 62.260 28.946 1.00 0.00 H ATOM 52824 H9S PA 1291 87.074 63.174 28.369 1.00 0.00 H ATOM 52825 C18 PA 1291 85.778 62.368 26.852 1.00 0.00 C ATOM 52826 H8R PA 1291 86.240 62.988 26.081 1.00 0.00 H ATOM 52827 H8S PA 1291 84.730 62.279 26.559 1.00 0.00 H ATOM 52828 C17 PA 1291 86.523 61.077 26.789 1.00 0.00 C ATOM 52829 H7R PA 1291 86.486 60.421 27.660 1.00 0.00 H ATOM 52830 H7S PA 1291 87.559 61.395 26.654 1.00 0.00 H ATOM 52831 C16 PA 1291 85.979 60.315 25.600 1.00 0.00 C ATOM 52832 H6R PA 1291 86.402 60.687 24.664 1.00 0.00 H ATOM 52833 H6S PA 1291 84.907 60.368 25.397 1.00 0.00 H ATOM 52834 C15 PA 1291 86.267 58.808 25.594 1.00 0.00 C ATOM 52835 H5R PA 1291 85.805 58.357 24.713 1.00 0.00 H ATOM 52836 H5S PA 1291 85.732 58.226 26.347 1.00 0.00 H ATOM 52837 C14 PA 1291 87.723 58.409 25.723 1.00 0.00 C ATOM 52838 H4R PA 1291 88.053 58.548 26.755 1.00 0.00 H ATOM 52839 H4S PA 1291 88.333 59.174 25.238 1.00 0.00 H ATOM 52840 C13 PA 1291 88.096 56.945 25.221 1.00 0.00 C ATOM 52841 H3R PA 1291 89.187 56.930 25.174 1.00 0.00 H ATOM 52842 H3S PA 1291 87.803 56.743 24.189 1.00 0.00 H ATOM 52843 C12 PA 1291 87.468 55.890 26.101 1.00 0.00 C ATOM 52844 H2R PA 1291 86.419 56.147 26.259 1.00 0.00 H ATOM 52845 H2S PA 1291 87.983 55.906 27.063 1.00 0.00 H ATOM 52846 C11 PGR 1292 87.513 54.523 25.452 1.00 0.00 C ATOM 52847 O12 PGR 1292 86.520 54.141 24.821 1.00 0.00 O ATOM 52848 O11 PGR 1292 88.665 53.826 25.615 1.00 0.00 O ATOM 52849 C1 PGR 1292 88.738 52.524 25.012 1.00 0.00 C ATOM 52850 HR PGR 1292 88.367 52.696 23.999 1.00 0.00 H ATOM 52851 HS PGR 1292 88.153 51.787 25.567 1.00 0.00 H ATOM 52852 C2 PGR 1292 90.133 52.024 25.001 1.00 0.00 C ATOM 52853 HX PGR 1292 90.876 52.697 24.566 1.00 0.00 H ATOM 52854 C3 PGR 1292 90.145 50.690 24.222 1.00 0.00 C ATOM 52855 HA PGR 1292 89.582 50.784 23.289 1.00 0.00 H ATOM 52856 HB PGR 1292 89.665 49.977 24.897 1.00 0.00 H ATOM 52857 O31 PGR 1292 91.481 50.254 24.099 1.00 0.00 O ATOM 52858 P31 PGR 1292 91.753 49.013 23.183 1.00 0.00 P ATOM 52859 O32 PGR 1292 91.021 49.352 21.746 1.00 0.00 O ATOM 52860 C31 PGR 1292 91.754 50.013 20.739 1.00 0.00 C ATOM 52861 H1A PGR 1292 92.394 49.357 20.144 1.00 0.00 H ATOM 52862 H1B PGR 1292 92.425 50.779 21.138 1.00 0.00 H ATOM 52863 C32 PGR 1292 90.674 50.676 19.802 1.00 0.00 C ATOM 52864 H2A PGR 1292 91.129 51.341 19.064 1.00 0.00 H ATOM 52865 O35 PGR 1292 89.709 51.336 20.621 1.00 0.00 O ATOM 52866 HO5A PGR 1292 89.205 50.750 21.214 1.00 0.00 H ATOM 52867 C33 PGR 1292 90.012 49.586 18.976 1.00 0.00 C ATOM 52868 H3A PGR 1292 90.757 48.865 18.632 1.00 0.00 H ATOM 52869 H3B PGR 1292 89.345 49.048 19.655 1.00 0.00 H ATOM 52870 O33 PGR 1292 93.204 48.994 22.978 1.00 0.00 O ATOM 52871 O34 PGR 1292 91.104 47.878 23.862 1.00 0.00 O ATOM 52872 O21 PGR 1292 90.516 51.762 26.401 1.00 0.00 O ATOM 52873 C21 PGR 1292 91.762 51.612 26.791 1.00 0.00 C ATOM 52874 O22 PGR 1292 92.672 52.117 26.178 1.00 0.00 O ATOM 52875 O36 PGR 1292 89.310 50.110 17.896 1.00 0.00 O ATOM 52876 HO6A PGR 1292 88.609 50.642 18.313 1.00 0.00 H ATOM 52877 C12 OL 1293 91.962 51.058 28.179 1.00 0.00 C ATOM 52878 H2R OL 1293 91.890 51.890 28.883 1.00 0.00 H ATOM 52879 H2S OL 1293 91.151 50.385 28.467 1.00 0.00 H ATOM 52880 C13 OL 1293 93.307 50.316 28.291 1.00 0.00 C ATOM 52881 H3R OL 1293 93.150 49.626 29.122 1.00 0.00 H ATOM 52882 H3S OL 1293 93.546 49.666 27.447 1.00 0.00 H ATOM 52883 C14 OL 1293 94.505 51.214 28.627 1.00 0.00 C ATOM 52884 H4R OL 1293 95.366 50.568 28.441 1.00 0.00 H ATOM 52885 H4S OL 1293 94.529 52.096 27.985 1.00 0.00 H ATOM 52886 C15 OL 1293 94.476 51.623 30.129 1.00 0.00 C ATOM 52887 H5R OL 1293 93.843 52.513 30.125 1.00 0.00 H ATOM 52888 H5S OL 1293 93.997 50.916 30.810 1.00 0.00 H ATOM 52889 C16 OL 1293 95.931 51.806 30.549 1.00 0.00 C ATOM 52890 H6R OL 1293 96.573 51.017 30.153 1.00 0.00 H ATOM 52891 H6S OL 1293 96.279 52.745 30.114 1.00 0.00 H ATOM 52892 C17 OL 1293 96.045 52.050 32.061 1.00 0.00 C ATOM 52893 H7R OL 1293 95.181 52.555 32.498 1.00 0.00 H ATOM 52894 H7S OL 1293 96.033 51.078 32.559 1.00 0.00 H ATOM 52895 C18 OL 1293 97.382 52.761 32.403 1.00 0.00 C ATOM 52896 H8R OL 1293 98.103 51.942 32.351 1.00 0.00 H ATOM 52897 H8S OL 1293 97.600 53.523 31.652 1.00 0.00 H ATOM 52898 C19 OL 1293 97.255 53.561 33.718 1.00 0.00 C ATOM 52899 H9R OL 1293 96.242 53.569 34.113 1.00 0.00 H ATOM 52900 C110 OL 1293 98.243 54.162 34.403 1.00 0.00 C ATOM 52901 H10R OL 1293 97.916 54.754 35.254 1.00 0.00 H ATOM 52902 C111 OL 1293 99.665 54.335 34.056 1.00 0.00 C ATOM 52903 H11R OL 1293 100.342 53.504 34.266 1.00 0.00 H ATOM 52904 H11S OL 1293 99.990 54.530 33.032 1.00 0.00 H ATOM 52905 C112 OL 1293 100.406 55.323 34.969 1.00 0.00 C ATOM 52906 H12R OL 1293 101.467 55.284 34.715 1.00 0.00 H ATOM 52907 H12S OL 1293 100.143 56.320 34.608 1.00 0.00 H ATOM 52908 C113 OL 1293 100.104 55.216 36.484 1.00 0.00 C ATOM 52909 H13R OL 1293 99.081 55.570 36.626 1.00 0.00 H ATOM 52910 H13S OL 1293 100.153 54.199 36.879 1.00 0.00 H ATOM 52911 C114 OL 1293 101.025 56.053 37.363 1.00 0.00 C ATOM 52912 H14R OL 1293 102.068 55.749 37.258 1.00 0.00 H ATOM 52913 H14S OL 1293 100.979 57.072 36.975 1.00 0.00 H ATOM 52914 C115 OL 1293 100.767 56.067 38.910 1.00 0.00 C ATOM 52915 H15R OL 1293 101.096 55.152 39.407 1.00 0.00 H ATOM 52916 H15S OL 1293 101.539 56.746 39.277 1.00 0.00 H ATOM 52917 C116 OL 1293 99.356 56.443 39.360 1.00 0.00 C ATOM 52918 H16R OL 1293 99.114 57.270 38.688 1.00 0.00 H ATOM 52919 H16S OL 1293 98.563 55.714 39.180 1.00 0.00 H ATOM 52920 C117 OL 1293 99.140 56.951 40.837 1.00 0.00 C ATOM 52921 H17R OL 1293 99.624 56.217 41.485 1.00 0.00 H ATOM 52922 H17S OL 1293 99.753 57.843 40.979 1.00 0.00 H ATOM 52923 C118 OL 1293 97.724 57.109 41.209 1.00 0.00 C ATOM 52924 H18R OL 1293 97.303 58.027 40.793 1.00 0.00 H ATOM 52925 H18S OL 1293 97.614 57.208 42.291 1.00 0.00 H ATOM 52926 H18T OL 1293 97.081 56.311 40.832 1.00 0.00 H TER 52927 OL 1293 ATOM 52927 C116 PA 1294 93.102 25.430 39.265 1.00 0.00 C ATOM 52928 H16R PA 1294 92.904 26.388 39.752 1.00 0.00 H ATOM 52929 H16S PA 1294 94.177 25.267 39.361 1.00 0.00 H ATOM 52930 H16T PA 1294 92.594 24.728 39.930 1.00 0.00 H ATOM 52931 C115 PA 1294 92.610 25.474 37.808 1.00 0.00 C ATOM 52932 H15R PA 1294 91.540 25.271 37.729 1.00 0.00 H ATOM 52933 H15S PA 1294 93.062 24.632 37.280 1.00 0.00 H ATOM 52934 C114 PA 1294 93.026 26.702 37.039 1.00 0.00 C ATOM 52935 H14R PA 1294 92.424 27.594 37.223 1.00 0.00 H ATOM 52936 H14S PA 1294 92.925 26.469 35.977 1.00 0.00 H ATOM 52937 C113 PA 1294 94.476 27.229 37.302 1.00 0.00 C ATOM 52938 H13R PA 1294 95.144 26.563 36.753 1.00 0.00 H ATOM 52939 H13S PA 1294 94.715 27.244 38.367 1.00 0.00 H ATOM 52940 C112 PA 1294 94.692 28.665 36.743 1.00 0.00 C ATOM 52941 H12R PA 1294 95.696 28.960 37.056 1.00 0.00 H ATOM 52942 H12S PA 1294 94.029 29.435 37.145 1.00 0.00 H ATOM 52943 C111 PA 1294 94.598 28.655 35.222 1.00 0.00 C ATOM 52944 H11R PA 1294 93.540 28.584 34.960 1.00 0.00 H ATOM 52945 H11S PA 1294 94.976 27.767 34.711 1.00 0.00 H ATOM 52946 C110 PA 1294 95.375 29.929 34.632 1.00 0.00 C ATOM 52947 H10R PA 1294 96.377 30.112 35.023 1.00 0.00 H ATOM 52948 H10S PA 1294 94.816 30.801 34.978 1.00 0.00 H ATOM 52949 C19 PA 1294 95.438 29.813 33.085 1.00 0.00 C ATOM 52950 H9R PA 1294 95.925 28.884 32.783 1.00 0.00 H ATOM 52951 H9S PA 1294 96.004 30.716 32.844 1.00 0.00 H ATOM 52952 C18 PA 1294 94.029 29.799 32.454 1.00 0.00 C ATOM 52953 H8R PA 1294 93.521 30.754 32.609 1.00 0.00 H ATOM 52954 H8S PA 1294 93.408 29.044 32.941 1.00 0.00 H ATOM 52955 C17 PA 1294 94.140 29.444 30.947 1.00 0.00 C ATOM 52956 H7R PA 1294 94.520 28.420 30.927 1.00 0.00 H ATOM 52957 H7S PA 1294 94.895 30.031 30.419 1.00 0.00 H ATOM 52958 C16 PA 1294 92.829 29.237 30.288 1.00 0.00 C ATOM 52959 H6R PA 1294 91.998 29.747 30.780 1.00 0.00 H ATOM 52960 H6S PA 1294 92.566 28.193 30.469 1.00 0.00 H ATOM 52961 C15 PA 1294 92.648 29.573 28.823 1.00 0.00 C ATOM 52962 H5R PA 1294 93.610 29.228 28.441 1.00 0.00 H ATOM 52963 H5S PA 1294 92.811 30.653 28.844 1.00 0.00 H ATOM 52964 C14 PA 1294 91.447 28.980 28.171 1.00 0.00 C ATOM 52965 H4R PA 1294 91.134 28.035 28.619 1.00 0.00 H ATOM 52966 H4S PA 1294 91.679 28.584 27.181 1.00 0.00 H ATOM 52967 C13 PA 1294 90.288 29.974 27.968 1.00 0.00 C ATOM 52968 H3R PA 1294 89.873 30.080 28.972 1.00 0.00 H ATOM 52969 H3S PA 1294 89.506 29.463 27.403 1.00 0.00 H ATOM 52970 C12 PA 1294 90.479 31.390 27.355 1.00 0.00 C ATOM 52971 H2R PA 1294 91.114 31.305 26.471 1.00 0.00 H ATOM 52972 H2S PA 1294 91.102 32.004 28.010 1.00 0.00 H ATOM 52973 C11 PC 1295 89.161 32.092 27.002 1.00 0.00 C ATOM 52974 O12 PC 1295 88.563 32.870 27.728 1.00 0.00 O ATOM 52975 O11 PC 1295 88.694 31.693 25.807 1.00 0.00 O ATOM 52976 C1 PC 1295 87.610 32.465 25.142 1.00 0.00 C ATOM 52977 HR PC 1295 88.072 33.336 24.671 1.00 0.00 H ATOM 52978 HS PC 1295 86.893 32.760 25.912 1.00 0.00 H ATOM 52979 C2 PC 1295 86.752 31.749 24.047 1.00 0.00 C ATOM 52980 HX PC 1295 87.378 31.275 23.286 1.00 0.00 H ATOM 52981 C3 PC 1295 85.913 32.847 23.314 1.00 0.00 C ATOM 52982 HA PC 1295 86.464 33.746 23.027 1.00 0.00 H ATOM 52983 HB PC 1295 85.119 33.174 23.990 1.00 0.00 H ATOM 52984 O31 PC 1295 85.384 32.233 22.152 1.00 0.00 O ATOM 52985 P31 PC 1295 84.285 33.140 21.255 1.00 0.00 P ATOM 52986 O32 PC 1295 85.153 33.480 19.970 1.00 0.00 O ATOM 52987 C31 PC 1295 85.997 34.585 19.904 1.00 0.00 C ATOM 52988 H1A PC 1295 86.892 34.399 20.503 1.00 0.00 H ATOM 52989 H1B PC 1295 85.483 35.479 20.267 1.00 0.00 H ATOM 52990 C32 PC 1295 86.484 34.839 18.470 1.00 0.00 C ATOM 52991 H2A PC 1295 86.962 35.805 18.298 1.00 0.00 H ATOM 52992 H2B PC 1295 85.592 34.810 17.842 1.00 0.00 H ATOM 52993 N31 PC 1295 87.392 33.798 17.896 1.00 0.00 N ATOM 52994 C33 PC 1295 87.938 34.330 16.642 1.00 0.00 C ATOM 52995 H3A PC 1295 88.918 34.770 16.833 1.00 0.00 H ATOM 52996 H3B PC 1295 87.218 35.018 16.194 1.00 0.00 H ATOM 52997 H3C PC 1295 88.026 33.452 16.000 1.00 0.00 H ATOM 52998 C34 PC 1295 88.546 33.522 18.788 1.00 0.00 C ATOM 52999 H4A PC 1295 89.225 32.843 18.272 1.00 0.00 H ATOM 53000 H4B PC 1295 88.223 33.160 19.765 1.00 0.00 H ATOM 53001 H4C PC 1295 88.985 34.512 18.920 1.00 0.00 H ATOM 53002 C35 PC 1295 86.767 32.501 17.598 1.00 0.00 C ATOM 53003 H5A PC 1295 87.493 31.687 17.567 1.00 0.00 H ATOM 53004 H5B PC 1295 86.364 32.605 16.590 1.00 0.00 H ATOM 53005 H5C PC 1295 86.073 32.262 18.405 1.00 0.00 H ATOM 53006 O33 PC 1295 83.237 32.218 20.835 1.00 0.00 O ATOM 53007 O34 PC 1295 83.949 34.354 21.886 1.00 0.00 O ATOM 53008 O21 PC 1295 85.941 30.743 24.809 1.00 0.00 O ATOM 53009 C21 PC 1295 86.383 29.500 24.829 1.00 0.00 C ATOM 53010 O22 PC 1295 87.374 29.085 24.164 1.00 0.00 O ATOM 53011 C12 OL 1296 85.528 28.714 25.812 1.00 0.00 C ATOM 53012 H2R OL 1296 84.474 28.938 25.634 1.00 0.00 H ATOM 53013 H2S OL 1296 85.604 27.699 25.415 1.00 0.00 H ATOM 53014 C13 OL 1296 86.174 28.860 27.145 1.00 0.00 C ATOM 53015 H3R OL 1296 87.209 28.530 27.040 1.00 0.00 H ATOM 53016 H3S OL 1296 86.021 29.825 27.632 1.00 0.00 H ATOM 53017 C14 OL 1296 85.473 27.988 28.128 1.00 0.00 C ATOM 53018 H4R OL 1296 84.522 28.501 28.289 1.00 0.00 H ATOM 53019 H4S OL 1296 85.071 27.036 27.776 1.00 0.00 H ATOM 53020 C15 OL 1296 86.257 27.774 29.442 1.00 0.00 C ATOM 53021 H5R OL 1296 85.533 27.391 30.164 1.00 0.00 H ATOM 53022 H5S OL 1296 86.990 26.968 29.382 1.00 0.00 H ATOM 53023 C16 OL 1296 86.844 29.047 30.056 1.00 0.00 C ATOM 53024 H6R OL 1296 87.558 29.548 29.400 1.00 0.00 H ATOM 53025 H6S OL 1296 86.036 29.774 30.169 1.00 0.00 H ATOM 53026 C17 OL 1296 87.346 28.689 31.503 1.00 0.00 C ATOM 53027 H7R OL 1296 86.554 28.260 32.121 1.00 0.00 H ATOM 53028 H7S OL 1296 88.175 27.979 31.512 1.00 0.00 H ATOM 53029 C18 OL 1296 87.881 29.817 32.339 1.00 0.00 C ATOM 53030 H8R OL 1296 88.056 29.390 33.329 1.00 0.00 H ATOM 53031 H8S OL 1296 88.798 30.249 31.932 1.00 0.00 H ATOM 53032 C19 OL 1296 86.883 30.846 32.442 1.00 0.00 C ATOM 53033 H9R OL 1296 86.023 30.662 33.082 1.00 0.00 H ATOM 53034 C110 OL 1296 86.974 32.111 32.082 1.00 0.00 C ATOM 53035 H10R OL 1296 86.347 32.949 32.377 1.00 0.00 H ATOM 53036 C111 OL 1296 87.978 32.651 31.189 1.00 0.00 C ATOM 53037 H11R OL 1296 88.383 32.016 30.399 1.00 0.00 H ATOM 53038 H11S OL 1296 87.516 33.478 30.645 1.00 0.00 H ATOM 53039 C112 OL 1296 89.198 33.128 32.052 1.00 0.00 C ATOM 53040 H12R OL 1296 89.095 34.209 32.158 1.00 0.00 H ATOM 53041 H12S OL 1296 89.128 32.688 33.049 1.00 0.00 H ATOM 53042 C113 OL 1296 90.537 32.747 31.437 1.00 0.00 C ATOM 53043 H13R OL 1296 90.917 31.737 31.607 1.00 0.00 H ATOM 53044 H13S OL 1296 90.368 32.748 30.358 1.00 0.00 H ATOM 53045 C114 OL 1296 91.727 33.644 31.711 1.00 0.00 C ATOM 53046 H14R OL 1296 91.569 34.719 31.599 1.00 0.00 H ATOM 53047 H14S OL 1296 91.893 33.623 32.790 1.00 0.00 H ATOM 53048 C115 OL 1296 92.979 33.246 30.902 1.00 0.00 C ATOM 53049 H15R OL 1296 93.161 32.172 30.831 1.00 0.00 H ATOM 53050 H15S OL 1296 92.767 33.656 29.912 1.00 0.00 H ATOM 53051 C116 OL 1296 94.296 33.927 31.407 1.00 0.00 C ATOM 53052 H16R OL 1296 94.370 34.968 31.086 1.00 0.00 H ATOM 53053 H16S OL 1296 94.295 33.851 32.496 1.00 0.00 H ATOM 53054 C117 OL 1296 95.548 33.285 30.912 1.00 0.00 C ATOM 53055 H17R OL 1296 95.476 32.196 30.884 1.00 0.00 H ATOM 53056 H17S OL 1296 95.652 33.519 29.850 1.00 0.00 H ATOM 53057 C118 OL 1296 96.862 33.819 31.535 1.00 0.00 C ATOM 53058 H18R OL 1296 97.769 33.360 31.135 1.00 0.00 H ATOM 53059 H18S OL 1296 96.897 33.990 32.613 1.00 0.00 H ATOM 53060 H18T OL 1296 97.111 34.856 31.303 1.00 0.00 H TER 53061 OL 1296 ATOM 53061 C116 PA 1297 51.411 61.056 44.774 1.00 0.00 C ATOM 53062 H16R PA 1297 50.747 60.540 45.471 1.00 0.00 H ATOM 53063 H16S PA 1297 51.379 62.129 44.971 1.00 0.00 H ATOM 53064 H16T PA 1297 52.450 60.837 45.027 1.00 0.00 H ATOM 53065 C115 PA 1297 51.237 60.689 43.362 1.00 0.00 C ATOM 53066 H15R PA 1297 51.205 59.623 43.130 1.00 0.00 H ATOM 53067 H15S PA 1297 52.174 61.171 43.073 1.00 0.00 H ATOM 53068 C114 PA 1297 49.946 61.391 42.746 1.00 0.00 C ATOM 53069 H14R PA 1297 49.872 62.434 43.061 1.00 0.00 H ATOM 53070 H14S PA 1297 49.038 60.861 43.043 1.00 0.00 H ATOM 53071 C113 PA 1297 49.945 61.361 41.254 1.00 0.00 C ATOM 53072 H13R PA 1297 49.067 61.851 40.828 1.00 0.00 H ATOM 53073 H13S PA 1297 49.965 60.308 40.962 1.00 0.00 H ATOM 53074 C112 PA 1297 50.941 62.267 40.576 1.00 0.00 C ATOM 53075 H12R PA 1297 51.966 61.905 40.678 1.00 0.00 H ATOM 53076 H12S PA 1297 50.891 63.229 41.092 1.00 0.00 H ATOM 53077 C111 PA 1297 50.729 62.649 39.138 1.00 0.00 C ATOM 53078 H11R PA 1297 51.562 63.192 38.687 1.00 0.00 H ATOM 53079 H11S PA 1297 49.902 63.338 38.953 1.00 0.00 H ATOM 53080 C110 PA 1297 50.447 61.387 38.268 1.00 0.00 C ATOM 53081 H10R PA 1297 49.512 61.002 38.681 1.00 0.00 H ATOM 53082 H10S PA 1297 51.328 60.769 38.453 1.00 0.00 H ATOM 53083 C19 PA 1297 50.179 61.565 36.744 1.00 0.00 C ATOM 53084 H9R PA 1297 49.938 60.551 36.417 1.00 0.00 H ATOM 53085 H9S PA 1297 50.946 61.977 36.086 1.00 0.00 H ATOM 53086 C18 PA 1297 48.888 62.363 36.450 1.00 0.00 C ATOM 53087 H8R PA 1297 48.914 63.342 36.932 1.00 0.00 H ATOM 53088 H8S PA 1297 48.102 61.713 36.841 1.00 0.00 H ATOM 53089 C17 PA 1297 48.602 62.440 34.934 1.00 0.00 C ATOM 53090 H7R PA 1297 48.666 61.479 34.420 1.00 0.00 H ATOM 53091 H7S PA 1297 49.374 63.063 34.477 1.00 0.00 H ATOM 53092 C16 PA 1297 47.140 62.910 34.662 1.00 0.00 C ATOM 53093 H6R PA 1297 46.858 63.829 35.180 1.00 0.00 H ATOM 53094 H6S PA 1297 46.460 62.210 35.152 1.00 0.00 H ATOM 53095 C15 PA 1297 46.892 63.134 33.207 1.00 0.00 C ATOM 53096 H5R PA 1297 47.146 62.298 32.552 1.00 0.00 H ATOM 53097 H5S PA 1297 47.509 63.931 32.785 1.00 0.00 H ATOM 53098 C14 PA 1297 45.462 63.376 32.894 1.00 0.00 C ATOM 53099 H4R PA 1297 45.052 64.295 33.319 1.00 0.00 H ATOM 53100 H4S PA 1297 44.963 62.561 33.422 1.00 0.00 H ATOM 53101 C13 PA 1297 45.012 63.271 31.436 1.00 0.00 C ATOM 53102 H3R PA 1297 45.563 62.503 30.889 1.00 0.00 H ATOM 53103 H3S PA 1297 45.240 64.223 30.953 1.00 0.00 H ATOM 53104 C12 PA 1297 43.494 63.070 31.351 1.00 0.00 C ATOM 53105 H2R PA 1297 43.166 62.155 31.848 1.00 0.00 H ATOM 53106 H2S PA 1297 42.966 63.804 31.964 1.00 0.00 H ATOM 53107 C11 PGR 1298 42.994 63.062 29.891 1.00 0.00 C ATOM 53108 O12 PGR 1298 43.574 62.538 29.003 1.00 0.00 O ATOM 53109 O11 PGR 1298 41.866 63.796 29.764 1.00 0.00 O ATOM 53110 C1 PGR 1298 41.341 63.857 28.414 1.00 0.00 C ATOM 53111 HR PGR 1298 42.060 64.344 27.751 1.00 0.00 H ATOM 53112 HS PGR 1298 40.498 64.548 28.497 1.00 0.00 H ATOM 53113 C2 PGR 1298 40.842 62.539 27.746 1.00 0.00 C ATOM 53114 HX PGR 1298 41.800 62.106 27.448 1.00 0.00 H ATOM 53115 C3 PGR 1298 40.063 62.829 26.427 1.00 0.00 C ATOM 53116 HA PGR 1298 40.548 63.583 25.802 1.00 0.00 H ATOM 53117 HB PGR 1298 39.059 63.201 26.644 1.00 0.00 H ATOM 53118 O31 PGR 1298 39.953 61.669 25.629 1.00 0.00 O ATOM 53119 P31 PGR 1298 38.952 61.658 24.346 1.00 0.00 P ATOM 53120 O32 PGR 1298 37.489 61.932 24.904 1.00 0.00 O ATOM 53121 C31 PGR 1298 36.765 60.970 25.669 1.00 0.00 C ATOM 53122 H1A PGR 1298 37.219 60.795 26.648 1.00 0.00 H ATOM 53123 H1B PGR 1298 36.704 60.025 25.124 1.00 0.00 H ATOM 53124 C32 PGR 1298 35.314 61.415 25.895 1.00 0.00 C ATOM 53125 H2A PGR 1298 34.928 60.663 26.587 1.00 0.00 H ATOM 53126 O35 PGR 1298 34.644 61.383 24.631 1.00 0.00 O ATOM 53127 HO5A PGR 1298 35.313 61.616 23.963 1.00 0.00 H ATOM 53128 C33 PGR 1298 35.249 62.876 26.462 1.00 0.00 C ATOM 53129 H3A PGR 1298 35.701 62.890 27.457 1.00 0.00 H ATOM 53130 H3B PGR 1298 35.836 63.460 25.748 1.00 0.00 H ATOM 53131 O33 PGR 1298 39.238 62.834 23.529 1.00 0.00 O ATOM 53132 O34 PGR 1298 39.028 60.307 23.739 1.00 0.00 O ATOM 53133 O21 PGR 1298 40.117 61.715 28.663 1.00 0.00 O ATOM 53134 C21 PGR 1298 38.954 62.060 29.394 1.00 0.00 C ATOM 53135 O22 PGR 1298 38.458 63.152 29.395 1.00 0.00 O ATOM 53136 O36 PGR 1298 33.904 63.369 26.463 1.00 0.00 O ATOM 53137 HO6A PGR 1298 33.588 63.373 25.542 1.00 0.00 H ATOM 53138 C12 OL 1299 38.295 60.822 29.976 1.00 0.00 C ATOM 53139 H2R OL 1299 37.760 60.298 29.182 1.00 0.00 H ATOM 53140 H2S OL 1299 39.055 60.081 30.236 1.00 0.00 H ATOM 53141 C13 OL 1299 37.313 61.119 31.102 1.00 0.00 C ATOM 53142 H3R OL 1299 37.173 60.244 31.741 1.00 0.00 H ATOM 53143 H3S OL 1299 37.732 61.805 31.841 1.00 0.00 H ATOM 53144 C14 OL 1299 36.040 61.664 30.566 1.00 0.00 C ATOM 53145 H4R OL 1299 36.007 62.722 30.300 1.00 0.00 H ATOM 53146 H4S OL 1299 35.845 61.230 29.584 1.00 0.00 H ATOM 53147 C15 OL 1299 34.858 61.412 31.508 1.00 0.00 C ATOM 53148 H5R OL 1299 34.849 60.387 31.886 1.00 0.00 H ATOM 53149 H5S OL 1299 35.006 62.041 32.389 1.00 0.00 H ATOM 53150 C16 OL 1299 33.523 61.705 30.727 1.00 0.00 C ATOM 53151 H6R OL 1299 33.435 62.595 30.101 1.00 0.00 H ATOM 53152 H6S OL 1299 33.397 60.853 30.056 1.00 0.00 H ATOM 53153 C17 OL 1299 32.310 61.741 31.681 1.00 0.00 C ATOM 53154 H7R OL 1299 32.286 60.816 32.260 1.00 0.00 H ATOM 53155 H7S OL 1299 32.334 62.533 32.432 1.00 0.00 H ATOM 53156 C18 OL 1299 31.008 61.781 30.931 1.00 0.00 C ATOM 53157 H8R OL 1299 30.261 62.031 31.687 1.00 0.00 H ATOM 53158 H8S OL 1299 31.024 62.609 30.219 1.00 0.00 H ATOM 53159 C19 OL 1299 30.696 60.428 30.286 1.00 0.00 C ATOM 53160 H9R OL 1299 30.640 59.640 31.033 1.00 0.00 H ATOM 53161 C110 OL 1299 30.609 60.134 28.990 1.00 0.00 C ATOM 53162 H10R OL 1299 30.327 59.124 28.706 1.00 0.00 H ATOM 53163 C111 OL 1299 31.089 61.041 27.865 1.00 0.00 C ATOM 53164 H11R OL 1299 31.807 61.831 28.092 1.00 0.00 H ATOM 53165 H11S OL 1299 31.662 60.443 27.153 1.00 0.00 H ATOM 53166 C112 OL 1299 29.846 61.486 27.014 1.00 0.00 C ATOM 53167 H12R OL 1299 30.161 62.110 26.175 1.00 0.00 H ATOM 53168 H12S OL 1299 29.480 60.613 26.469 1.00 0.00 H ATOM 53169 C113 OL 1299 28.748 62.190 27.816 1.00 0.00 C ATOM 53170 H13R OL 1299 28.510 61.518 28.644 1.00 0.00 H ATOM 53171 H13S OL 1299 28.991 63.165 28.246 1.00 0.00 H ATOM 53172 C114 OL 1299 27.533 62.251 26.866 1.00 0.00 C ATOM 53173 H14R OL 1299 27.303 61.282 26.418 1.00 0.00 H ATOM 53174 H14S OL 1299 26.654 62.521 27.455 1.00 0.00 H ATOM 53175 C115 OL 1299 27.537 63.355 25.771 1.00 0.00 C ATOM 53176 H15R OL 1299 28.288 63.060 25.035 1.00 0.00 H ATOM 53177 H15S OL 1299 26.563 63.356 25.278 1.00 0.00 H ATOM 53178 C116 OL 1299 27.973 64.818 26.164 1.00 0.00 C ATOM 53179 H16R OL 1299 27.347 65.185 26.980 1.00 0.00 H ATOM 53180 H16S OL 1299 29.003 64.681 26.498 1.00 0.00 H ATOM 53181 C117 OL 1299 27.935 65.741 24.935 1.00 0.00 C ATOM 53182 H17R OL 1299 28.851 65.726 24.340 1.00 0.00 H ATOM 53183 H17S OL 1299 27.100 65.519 24.267 1.00 0.00 H ATOM 53184 C118 OL 1299 27.844 67.183 25.326 1.00 0.00 C ATOM 53185 H18R OL 1299 26.905 67.399 25.840 1.00 0.00 H ATOM 53186 H18S OL 1299 27.915 67.848 24.463 1.00 0.00 H ATOM 53187 H18T OL 1299 28.700 67.448 25.950 1.00 0.00 H TER 53188 OL 1299 ATOM 53188 C116 PA 1300 48.962 128.486 32.713 1.00 0.00 C ATOM 53189 H16R PA 1300 49.517 127.585 32.442 1.00 0.00 H ATOM 53190 H16S PA 1300 49.161 128.489 33.787 1.00 0.00 H ATOM 53191 H16T PA 1300 49.532 129.363 32.400 1.00 0.00 H ATOM 53192 C115 PA 1300 47.598 128.512 32.426 1.00 0.00 C ATOM 53193 H15R PA 1300 47.291 129.392 32.995 1.00 0.00 H ATOM 53194 H15S PA 1300 47.177 127.675 32.987 1.00 0.00 H ATOM 53195 C114 PA 1300 47.340 128.452 30.913 1.00 0.00 C ATOM 53196 H14R PA 1300 47.987 127.609 30.662 1.00 0.00 H ATOM 53197 H14S PA 1300 47.597 129.416 30.468 1.00 0.00 H ATOM 53198 C113 PA 1300 45.931 128.112 30.539 1.00 0.00 C ATOM 53199 H13R PA 1300 45.239 128.771 31.069 1.00 0.00 H ATOM 53200 H13S PA 1300 45.631 127.112 30.859 1.00 0.00 H ATOM 53201 C112 PA 1300 45.658 127.987 28.984 1.00 0.00 C ATOM 53202 H12R PA 1300 44.665 127.555 28.840 1.00 0.00 H ATOM 53203 H12S PA 1300 46.333 127.201 28.640 1.00 0.00 H ATOM 53204 C111 PA 1300 45.739 129.238 28.207 1.00 0.00 C ATOM 53205 H11R PA 1300 46.489 129.949 28.559 1.00 0.00 H ATOM 53206 H11S PA 1300 44.831 129.715 28.582 1.00 0.00 H ATOM 53207 C110 PA 1300 45.547 129.150 26.769 1.00 0.00 C ATOM 53208 H10R PA 1300 46.445 128.701 26.339 1.00 0.00 H ATOM 53209 H10S PA 1300 45.597 130.155 26.346 1.00 0.00 H ATOM 53210 C19 PA 1300 44.312 128.531 26.248 1.00 0.00 C ATOM 53211 H9R PA 1300 44.503 127.457 26.202 1.00 0.00 H ATOM 53212 H9S PA 1300 44.268 128.810 25.193 1.00 0.00 H ATOM 53213 C18 PA 1300 42.974 128.874 26.908 1.00 0.00 C ATOM 53214 H8R PA 1300 42.768 129.946 26.902 1.00 0.00 H ATOM 53215 H8S PA 1300 42.972 128.664 27.980 1.00 0.00 H ATOM 53216 C17 PA 1300 41.867 128.137 26.164 1.00 0.00 C ATOM 53217 H7R PA 1300 42.204 127.112 25.992 1.00 0.00 H ATOM 53218 H7S PA 1300 41.667 128.495 25.152 1.00 0.00 H ATOM 53219 C16 PA 1300 40.466 128.148 26.854 1.00 0.00 C ATOM 53220 H6R PA 1300 40.190 129.198 26.737 1.00 0.00 H ATOM 53221 H6S PA 1300 40.746 127.942 27.890 1.00 0.00 H ATOM 53222 C15 PA 1300 39.430 127.082 26.316 1.00 0.00 C ATOM 53223 H5R PA 1300 38.794 126.986 27.199 1.00 0.00 H ATOM 53224 H5S PA 1300 39.772 126.046 26.264 1.00 0.00 H ATOM 53225 C14 PA 1300 38.691 127.498 25.099 1.00 0.00 C ATOM 53226 H4R PA 1300 39.323 127.734 24.240 1.00 0.00 H ATOM 53227 H4S PA 1300 38.256 128.468 25.350 1.00 0.00 H ATOM 53228 C13 PA 1300 37.609 126.576 24.618 1.00 0.00 C ATOM 53229 H3R PA 1300 37.134 127.104 23.788 1.00 0.00 H ATOM 53230 H3S PA 1300 36.831 126.472 25.377 1.00 0.00 H ATOM 53231 C12 PA 1300 38.132 125.183 24.206 1.00 0.00 C ATOM 53232 H2R PA 1300 38.293 124.694 25.169 1.00 0.00 H ATOM 53233 H2S PA 1300 39.102 125.158 23.705 1.00 0.00 H ATOM 53234 C11 PC 1301 37.173 124.418 23.347 1.00 0.00 C ATOM 53235 O12 PC 1301 37.521 123.865 22.295 1.00 0.00 O ATOM 53236 O11 PC 1301 35.982 124.230 23.968 1.00 0.00 O ATOM 53237 C1 PC 1301 35.007 123.292 23.385 1.00 0.00 C ATOM 53238 HR PC 1301 34.879 123.594 22.342 1.00 0.00 H ATOM 53239 HS PC 1301 34.065 123.480 23.906 1.00 0.00 H ATOM 53240 C2 PC 1301 35.400 121.843 23.612 1.00 0.00 C ATOM 53241 HX PC 1301 36.478 121.776 23.448 1.00 0.00 H ATOM 53242 C3 PC 1301 34.547 120.950 22.622 1.00 0.00 C ATOM 53243 HA PC 1301 33.548 120.777 23.031 1.00 0.00 H ATOM 53244 HB PC 1301 35.006 119.963 22.715 1.00 0.00 H ATOM 53245 O31 PC 1301 34.747 121.466 21.347 1.00 0.00 O ATOM 53246 P31 PC 1301 33.678 121.339 20.202 1.00 0.00 P ATOM 53247 O32 PC 1301 33.710 119.896 19.744 1.00 0.00 O ATOM 53248 C31 PC 1301 34.965 119.272 19.400 1.00 0.00 C ATOM 53249 H1A PC 1301 35.524 119.218 20.338 1.00 0.00 H ATOM 53250 H1B PC 1301 35.418 119.857 18.595 1.00 0.00 H ATOM 53251 C32 PC 1301 34.647 117.858 18.941 1.00 0.00 C ATOM 53252 H2A PC 1301 34.806 117.143 19.750 1.00 0.00 H ATOM 53253 H2B PC 1301 35.462 117.601 18.263 1.00 0.00 H ATOM 53254 N31 PC 1301 33.446 117.478 18.143 1.00 0.00 N ATOM 53255 C33 PC 1301 32.168 117.650 18.908 1.00 0.00 C ATOM 53256 H3A PC 1301 32.207 117.096 19.847 1.00 0.00 H ATOM 53257 H3B PC 1301 31.378 117.275 18.256 1.00 0.00 H ATOM 53258 H3C PC 1301 31.934 118.683 19.169 1.00 0.00 H ATOM 53259 C34 PC 1301 33.270 118.490 16.976 1.00 0.00 C ATOM 53260 H4A PC 1301 34.112 118.363 16.294 1.00 0.00 H ATOM 53261 H4B PC 1301 33.277 119.475 17.445 1.00 0.00 H ATOM 53262 H4C PC 1301 32.381 118.307 16.371 1.00 0.00 H ATOM 53263 C35 PC 1301 33.575 116.114 17.596 1.00 0.00 C ATOM 53264 H5A PC 1301 32.976 116.037 16.687 1.00 0.00 H ATOM 53265 H5B PC 1301 33.150 115.502 18.392 1.00 0.00 H ATOM 53266 H5C PC 1301 34.644 115.936 17.467 1.00 0.00 H ATOM 53267 O33 PC 1301 32.329 121.697 20.842 1.00 0.00 O ATOM 53268 O34 PC 1301 34.146 122.095 19.069 1.00 0.00 O ATOM 53269 O21 PC 1301 35.053 121.588 24.981 1.00 0.00 O ATOM 53270 C21 PC 1301 35.350 120.396 25.499 1.00 0.00 C ATOM 53271 O22 PC 1301 36.144 119.599 24.956 1.00 0.00 O ATOM 53272 C12 OL 1302 34.738 120.167 26.859 1.00 0.00 C ATOM 53273 H2R OL 1302 34.089 121.041 26.944 1.00 0.00 H ATOM 53274 H2S OL 1302 34.132 119.266 26.746 1.00 0.00 H ATOM 53275 C13 OL 1302 35.820 120.029 27.979 1.00 0.00 C ATOM 53276 H3R OL 1302 36.576 119.376 27.537 1.00 0.00 H ATOM 53277 H3S OL 1302 36.217 120.981 28.336 1.00 0.00 H ATOM 53278 C14 OL 1302 35.228 119.441 29.269 1.00 0.00 C ATOM 53279 H4R OL 1302 36.009 119.543 30.025 1.00 0.00 H ATOM 53280 H4S OL 1302 34.394 120.139 29.369 1.00 0.00 H ATOM 53281 C15 OL 1302 34.691 117.979 29.296 1.00 0.00 C ATOM 53282 H5R OL 1302 34.642 117.628 30.328 1.00 0.00 H ATOM 53283 H5S OL 1302 33.694 117.946 28.853 1.00 0.00 H ATOM 53284 C16 OL 1302 35.528 116.849 28.614 1.00 0.00 C ATOM 53285 H6R OL 1302 35.016 115.893 28.742 1.00 0.00 H ATOM 53286 H6S OL 1302 35.738 117.037 27.559 1.00 0.00 H ATOM 53287 C17 OL 1302 36.907 116.669 29.301 1.00 0.00 C ATOM 53288 H7R OL 1302 37.384 115.922 28.663 1.00 0.00 H ATOM 53289 H7S OL 1302 37.576 117.529 29.225 1.00 0.00 H ATOM 53290 C18 OL 1302 36.935 116.119 30.679 1.00 0.00 C ATOM 53291 H8R OL 1302 36.385 116.774 31.358 1.00 0.00 H ATOM 53292 H8S OL 1302 36.369 115.192 30.796 1.00 0.00 H ATOM 53293 C19 OL 1302 38.308 116.052 31.255 1.00 0.00 C ATOM 53294 H9R OL 1302 39.136 115.913 30.565 1.00 0.00 H ATOM 53295 C110 OL 1302 38.712 116.152 32.529 1.00 0.00 C ATOM 53296 H10R OL 1302 39.794 116.179 32.627 1.00 0.00 H ATOM 53297 C111 OL 1302 37.873 116.247 33.802 1.00 0.00 C ATOM 53298 H11R OL 1302 36.795 116.143 33.665 1.00 0.00 H ATOM 53299 H11S OL 1302 38.209 115.501 34.525 1.00 0.00 H ATOM 53300 C112 OL 1302 38.012 117.687 34.266 1.00 0.00 C ATOM 53301 H12R OL 1302 37.859 118.305 33.379 1.00 0.00 H ATOM 53302 H12S OL 1302 37.160 118.003 34.871 1.00 0.00 H ATOM 53303 C113 OL 1302 39.296 118.153 34.871 1.00 0.00 C ATOM 53304 H13R OL 1302 39.327 117.548 35.779 1.00 0.00 H ATOM 53305 H13S OL 1302 40.185 117.919 34.282 1.00 0.00 H ATOM 53306 C114 OL 1302 39.207 119.620 35.321 1.00 0.00 C ATOM 53307 H14R OL 1302 40.149 119.974 35.745 1.00 0.00 H ATOM 53308 H14S OL 1302 39.069 120.185 34.397 1.00 0.00 H ATOM 53309 C115 OL 1302 38.044 120.058 36.190 1.00 0.00 C ATOM 53310 H15R OL 1302 37.127 120.055 35.597 1.00 0.00 H ATOM 53311 H15S OL 1302 37.893 119.365 37.020 1.00 0.00 H ATOM 53312 C116 OL 1302 38.317 121.443 36.800 1.00 0.00 C ATOM 53313 H16R OL 1302 39.347 121.387 37.160 1.00 0.00 H ATOM 53314 H16S OL 1302 38.282 122.127 35.950 1.00 0.00 H ATOM 53315 C117 OL 1302 37.358 121.836 37.945 1.00 0.00 C ATOM 53316 H17R OL 1302 37.428 122.885 38.241 1.00 0.00 H ATOM 53317 H17S OL 1302 36.302 121.697 37.705 1.00 0.00 H ATOM 53318 C118 OL 1302 37.399 120.937 39.245 1.00 0.00 C ATOM 53319 H18R OL 1302 37.011 121.429 40.140 1.00 0.00 H ATOM 53320 H18S OL 1302 38.438 120.757 39.528 1.00 0.00 H ATOM 53321 H18T OL 1302 36.920 119.977 39.042 1.00 0.00 H TER 53322 OL 1302 ATOM 53322 C116 PA 1303 -2.935 9.858 33.634 1.00 0.00 C ATOM 53323 H16R PA 1303 -3.256 10.700 33.016 1.00 0.00 H ATOM 53324 H16S PA 1303 -2.234 10.226 34.386 1.00 0.00 H ATOM 53325 H16T PA 1303 -3.826 9.546 34.183 1.00 0.00 H ATOM 53326 C115 PA 1303 -2.424 8.640 32.894 1.00 0.00 C ATOM 53327 H15R PA 1303 -2.811 8.827 31.890 1.00 0.00 H ATOM 53328 H15S PA 1303 -2.958 7.794 33.331 1.00 0.00 H ATOM 53329 C114 PA 1303 -0.849 8.501 33.003 1.00 0.00 C ATOM 53330 H14R PA 1303 -0.405 9.468 32.758 1.00 0.00 H ATOM 53331 H14S PA 1303 -0.526 7.798 32.232 1.00 0.00 H ATOM 53332 C113 PA 1303 -0.363 7.968 34.389 1.00 0.00 C ATOM 53333 H13R PA 1303 -0.487 8.752 35.139 1.00 0.00 H ATOM 53334 H13S PA 1303 0.727 7.903 34.360 1.00 0.00 H ATOM 53335 C112 PA 1303 -0.899 6.629 34.817 1.00 0.00 C ATOM 53336 H12R PA 1303 -1.847 6.809 35.328 1.00 0.00 H ATOM 53337 H12S PA 1303 -0.255 6.270 35.622 1.00 0.00 H ATOM 53338 C111 PA 1303 -0.950 5.455 33.903 1.00 0.00 C ATOM 53339 H11R PA 1303 -1.752 5.602 33.177 1.00 0.00 H ATOM 53340 H11S PA 1303 -1.204 4.591 34.520 1.00 0.00 H ATOM 53341 C110 PA 1303 0.319 5.096 33.186 1.00 0.00 C ATOM 53342 H10R PA 1303 1.185 5.021 33.847 1.00 0.00 H ATOM 53343 H10S PA 1303 0.637 5.765 32.383 1.00 0.00 H ATOM 53344 C19 PA 1303 0.476 3.631 32.658 1.00 0.00 C ATOM 53345 H9R PA 1303 -0.495 3.211 32.390 1.00 0.00 H ATOM 53346 H9S PA 1303 0.832 2.984 33.461 1.00 0.00 H ATOM 53347 C18 PA 1303 1.485 3.391 31.498 1.00 0.00 C ATOM 53348 H8R PA 1303 1.599 2.310 31.402 1.00 0.00 H ATOM 53349 H8S PA 1303 2.506 3.709 31.719 1.00 0.00 H ATOM 53350 C17 PA 1303 1.116 3.799 30.087 1.00 0.00 C ATOM 53351 H7R PA 1303 0.922 4.873 30.125 1.00 0.00 H ATOM 53352 H7S PA 1303 0.150 3.409 29.760 1.00 0.00 H ATOM 53353 C16 PA 1303 2.166 3.479 29.113 1.00 0.00 C ATOM 53354 H6R PA 1303 1.667 3.519 28.143 1.00 0.00 H ATOM 53355 H6S PA 1303 2.508 2.445 29.187 1.00 0.00 H ATOM 53356 C15 PA 1303 3.264 4.466 29.134 1.00 0.00 C ATOM 53357 H5R PA 1303 4.100 3.998 29.659 1.00 0.00 H ATOM 53358 H5S PA 1303 2.908 5.364 29.644 1.00 0.00 H ATOM 53359 C14 PA 1303 3.516 4.864 27.773 1.00 0.00 C ATOM 53360 H4R PA 1303 2.578 4.975 27.225 1.00 0.00 H ATOM 53361 H4S PA 1303 4.016 4.068 27.218 1.00 0.00 H ATOM 53362 C13 PA 1303 4.378 6.167 27.510 1.00 0.00 C ATOM 53363 H3R PA 1303 5.308 6.147 28.082 1.00 0.00 H ATOM 53364 H3S PA 1303 3.912 7.043 27.967 1.00 0.00 H ATOM 53365 C12 PA 1303 4.520 6.473 26.018 1.00 0.00 C ATOM 53366 H2R PA 1303 3.508 6.582 25.621 1.00 0.00 H ATOM 53367 H2S PA 1303 5.007 5.669 25.462 1.00 0.00 H ATOM 53368 C11 PGR 1304 5.534 7.600 25.780 1.00 0.00 C ATOM 53369 O12 PGR 1304 5.272 8.797 25.745 1.00 0.00 O ATOM 53370 O11 PGR 1304 6.801 7.278 25.674 1.00 0.00 O ATOM 53371 C1 PGR 1304 7.784 8.321 25.554 1.00 0.00 C ATOM 53372 HR PGR 1304 7.971 8.741 26.545 1.00 0.00 H ATOM 53373 HS PGR 1304 7.520 9.214 24.981 1.00 0.00 H ATOM 53374 C2 PGR 1304 9.129 7.810 24.935 1.00 0.00 C ATOM 53375 HX PGR 1304 9.800 8.672 24.914 1.00 0.00 H ATOM 53376 C3 PGR 1304 8.861 7.200 23.515 1.00 0.00 C ATOM 53377 HA PGR 1304 8.380 8.000 22.947 1.00 0.00 H ATOM 53378 HB PGR 1304 8.200 6.355 23.726 1.00 0.00 H ATOM 53379 O31 PGR 1304 10.060 7.019 22.798 1.00 0.00 O ATOM 53380 P31 PGR 1304 10.000 6.642 21.277 1.00 0.00 P ATOM 53381 O32 PGR 1304 10.563 5.157 21.300 1.00 0.00 O ATOM 53382 C31 PGR 1304 9.963 4.050 21.949 1.00 0.00 C ATOM 53383 H1A PGR 1304 9.938 3.166 21.307 1.00 0.00 H ATOM 53384 H1B PGR 1304 8.979 4.234 22.387 1.00 0.00 H ATOM 53385 C32 PGR 1304 10.895 3.617 23.077 1.00 0.00 C ATOM 53386 H2A PGR 1304 10.956 4.476 23.751 1.00 0.00 H ATOM 53387 O35 PGR 1304 12.251 3.420 22.504 1.00 0.00 O ATOM 53388 HO5A PGR 1304 12.810 3.482 23.299 1.00 0.00 H ATOM 53389 C33 PGR 1304 10.356 2.379 23.857 1.00 0.00 C ATOM 53390 H3A PGR 1304 11.091 2.042 24.592 1.00 0.00 H ATOM 53391 H3B PGR 1304 9.542 2.782 24.465 1.00 0.00 H ATOM 53392 O33 PGR 1304 8.575 6.626 20.828 1.00 0.00 O ATOM 53393 O34 PGR 1304 10.943 7.452 20.544 1.00 0.00 O ATOM 53394 O21 PGR 1304 9.680 6.760 25.851 1.00 0.00 O ATOM 53395 C21 PGR 1304 10.958 6.547 26.254 1.00 0.00 C ATOM 53396 O22 PGR 1304 11.844 7.298 25.943 1.00 0.00 O ATOM 53397 O36 PGR 1304 9.866 1.197 23.241 1.00 0.00 O ATOM 53398 HO6A PGR 1304 10.527 0.921 22.581 1.00 0.00 H ATOM 53399 C12 OL 1305 11.199 5.460 27.274 1.00 0.00 C ATOM 53400 H2R OL 1305 10.838 4.518 26.855 1.00 0.00 H ATOM 53401 H2S OL 1305 12.245 5.219 27.473 1.00 0.00 H ATOM 53402 C13 OL 1305 10.430 5.730 28.594 1.00 0.00 C ATOM 53403 H3R OL 1305 10.813 5.170 29.449 1.00 0.00 H ATOM 53404 H3S OL 1305 10.769 6.747 28.802 1.00 0.00 H ATOM 53405 C14 OL 1305 8.872 5.702 28.592 1.00 0.00 C ATOM 53406 H4R OL 1305 8.483 5.865 29.599 1.00 0.00 H ATOM 53407 H4S OL 1305 8.431 6.537 28.044 1.00 0.00 H ATOM 53408 C15 OL 1305 8.219 4.413 27.941 1.00 0.00 C ATOM 53409 H5R OL 1305 7.145 4.304 28.105 1.00 0.00 H ATOM 53410 H5S OL 1305 8.334 4.526 26.861 1.00 0.00 H ATOM 53411 C16 OL 1305 8.895 3.024 28.327 1.00 0.00 C ATOM 53412 H6R OL 1305 9.974 3.032 28.162 1.00 0.00 H ATOM 53413 H6S OL 1305 8.697 2.839 29.385 1.00 0.00 H ATOM 53414 C17 OL 1305 8.330 1.790 27.605 1.00 0.00 C ATOM 53415 H7R OL 1305 7.287 1.769 27.927 1.00 0.00 H ATOM 53416 H7S OL 1305 8.257 1.999 26.535 1.00 0.00 H ATOM 53417 C18 OL 1305 9.231 0.444 27.761 1.00 0.00 C ATOM 53418 H8R OL 1305 9.383 0.137 28.798 1.00 0.00 H ATOM 53419 H8S OL 1305 8.673 -0.345 27.253 1.00 0.00 H ATOM 53420 C19 OL 1305 10.570 0.500 27.125 1.00 0.00 C ATOM 53421 H9R OL 1305 10.538 0.419 26.041 1.00 0.00 H ATOM 53422 C110 OL 1305 11.794 0.543 27.660 1.00 0.00 C ATOM 53423 H10R OL 1305 12.666 0.628 27.016 1.00 0.00 H ATOM 53424 C111 OL 1305 12.125 0.681 29.157 1.00 0.00 C ATOM 53425 H11R OL 1305 11.250 0.977 29.740 1.00 0.00 H ATOM 53426 H11S OL 1305 12.260 -0.338 29.524 1.00 0.00 H ATOM 53427 C112 OL 1305 13.265 1.659 29.418 1.00 0.00 C ATOM 53428 H12R OL 1305 13.437 1.473 30.481 1.00 0.00 H ATOM 53429 H12S OL 1305 14.107 1.309 28.818 1.00 0.00 H ATOM 53430 C113 OL 1305 12.958 3.111 28.986 1.00 0.00 C ATOM 53431 H13R OL 1305 12.789 3.251 27.916 1.00 0.00 H ATOM 53432 H13S OL 1305 11.943 3.291 29.348 1.00 0.00 H ATOM 53433 C114 OL 1305 13.949 4.103 29.443 1.00 0.00 C ATOM 53434 H14R OL 1305 14.898 3.677 29.108 1.00 0.00 H ATOM 53435 H14S OL 1305 13.855 4.998 28.824 1.00 0.00 H ATOM 53436 C115 OL 1305 13.923 4.487 30.952 1.00 0.00 C ATOM 53437 H15R OL 1305 13.002 4.017 31.305 1.00 0.00 H ATOM 53438 H15S OL 1305 14.820 3.989 31.324 1.00 0.00 H ATOM 53439 C116 OL 1305 13.936 5.995 31.277 1.00 0.00 C ATOM 53440 H16R OL 1305 14.813 6.243 30.675 1.00 0.00 H ATOM 53441 H16S OL 1305 12.990 6.478 31.026 1.00 0.00 H ATOM 53442 C117 OL 1305 14.145 6.219 32.759 1.00 0.00 C ATOM 53443 H17R OL 1305 13.365 5.787 33.389 1.00 0.00 H ATOM 53444 H17S OL 1305 15.054 5.674 33.021 1.00 0.00 H ATOM 53445 C118 OL 1305 14.344 7.687 33.112 1.00 0.00 C ATOM 53446 H18R OL 1305 14.838 7.648 34.085 1.00 0.00 H ATOM 53447 H18S OL 1305 13.456 8.320 33.054 1.00 0.00 H ATOM 53448 H18T OL 1305 15.179 8.114 32.552 1.00 0.00 H TER 53449 OL 1305 ATOM 53449 C116 PA 1306 60.739 96.004 42.605 1.00 0.00 C ATOM 53450 H16R PA 1306 59.805 95.548 42.270 1.00 0.00 H ATOM 53451 H16S PA 1306 60.564 97.074 42.474 1.00 0.00 H ATOM 53452 H16T PA 1306 60.793 95.741 43.663 1.00 0.00 H ATOM 53453 C115 PA 1306 62.037 95.830 41.794 1.00 0.00 C ATOM 53454 H15R PA 1306 62.785 96.553 42.125 1.00 0.00 H ATOM 53455 H15S PA 1306 61.899 96.137 40.755 1.00 0.00 H ATOM 53456 C114 PA 1306 62.672 94.448 41.845 1.00 0.00 C ATOM 53457 H14R PA 1306 62.191 93.751 41.155 1.00 0.00 H ATOM 53458 H14S PA 1306 62.442 93.989 42.808 1.00 0.00 H ATOM 53459 C113 PA 1306 64.194 94.361 41.537 1.00 0.00 C ATOM 53460 H13R PA 1306 64.511 93.323 41.656 1.00 0.00 H ATOM 53461 H13S PA 1306 64.810 94.963 42.209 1.00 0.00 H ATOM 53462 C112 PA 1306 64.509 94.654 40.125 1.00 0.00 C ATOM 53463 H12R PA 1306 64.142 95.640 39.833 1.00 0.00 H ATOM 53464 H12S PA 1306 63.838 94.060 39.501 1.00 0.00 H ATOM 53465 C111 PA 1306 65.980 94.501 39.602 1.00 0.00 C ATOM 53466 H11R PA 1306 66.213 93.436 39.654 1.00 0.00 H ATOM 53467 H11S PA 1306 66.703 95.058 40.202 1.00 0.00 H ATOM 53468 C110 PA 1306 66.232 95.023 38.259 1.00 0.00 C ATOM 53469 H10R PA 1306 67.166 94.567 37.922 1.00 0.00 H ATOM 53470 H10S PA 1306 66.403 96.099 38.334 1.00 0.00 H ATOM 53471 C19 PA 1306 65.146 94.700 37.212 1.00 0.00 C ATOM 53472 H9R PA 1306 64.236 95.249 37.461 1.00 0.00 H ATOM 53473 H9S PA 1306 65.088 93.612 37.290 1.00 0.00 H ATOM 53474 C18 PA 1306 65.635 95.109 35.855 1.00 0.00 C ATOM 53475 H8R PA 1306 66.029 96.121 35.746 1.00 0.00 H ATOM 53476 H8S PA 1306 64.870 95.404 35.133 1.00 0.00 H ATOM 53477 C17 PA 1306 66.490 94.113 35.134 1.00 0.00 C ATOM 53478 H7R PA 1306 65.955 93.166 35.036 1.00 0.00 H ATOM 53479 H7S PA 1306 67.281 93.921 35.861 1.00 0.00 H ATOM 53480 C16 PA 1306 67.098 94.547 33.785 1.00 0.00 C ATOM 53481 H6R PA 1306 68.154 94.794 33.912 1.00 0.00 H ATOM 53482 H6S PA 1306 66.621 95.398 33.294 1.00 0.00 H ATOM 53483 C15 PA 1306 67.184 93.337 32.780 1.00 0.00 C ATOM 53484 H5R PA 1306 66.167 93.055 32.502 1.00 0.00 H ATOM 53485 H5S PA 1306 67.678 92.451 33.185 1.00 0.00 H ATOM 53486 C14 PA 1306 67.947 93.726 31.500 1.00 0.00 C ATOM 53487 H4R PA 1306 69.030 93.679 31.637 1.00 0.00 H ATOM 53488 H4S PA 1306 67.587 94.721 31.229 1.00 0.00 H ATOM 53489 C13 PA 1306 67.574 92.834 30.300 1.00 0.00 C ATOM 53490 H3R PA 1306 66.540 92.548 30.504 1.00 0.00 H ATOM 53491 H3S PA 1306 68.114 91.888 30.228 1.00 0.00 H ATOM 53492 C12 PA 1306 67.697 93.638 28.980 1.00 0.00 C ATOM 53493 H2R PA 1306 68.711 94.041 28.998 1.00 0.00 H ATOM 53494 H2S PA 1306 67.003 94.476 28.889 1.00 0.00 H ATOM 53495 C11 PGR 1307 67.597 92.746 27.785 1.00 0.00 C ATOM 53496 O12 PGR 1307 68.407 92.717 26.879 1.00 0.00 O ATOM 53497 O11 PGR 1307 66.521 92.031 27.807 1.00 0.00 O ATOM 53498 C1 PGR 1307 66.130 91.199 26.741 1.00 0.00 C ATOM 53499 HR PGR 1307 65.790 91.626 25.794 1.00 0.00 H ATOM 53500 HS PGR 1307 65.277 90.670 27.175 1.00 0.00 H ATOM 53501 C2 PGR 1307 67.137 90.063 26.451 1.00 0.00 C ATOM 53502 HX PGR 1307 68.113 90.484 26.195 1.00 0.00 H ATOM 53503 C3 PGR 1307 66.779 89.369 25.155 1.00 0.00 C ATOM 53504 HA PGR 1307 67.324 88.436 24.993 1.00 0.00 H ATOM 53505 HB PGR 1307 67.045 90.076 24.366 1.00 0.00 H ATOM 53506 O31 PGR 1307 65.406 89.102 25.179 1.00 0.00 O ATOM 53507 P31 PGR 1307 64.714 88.598 23.888 1.00 0.00 P ATOM 53508 O32 PGR 1307 64.624 89.834 22.928 1.00 0.00 O ATOM 53509 C31 PGR 1307 63.704 90.886 23.088 1.00 0.00 C ATOM 53510 H1A PGR 1307 62.752 90.528 22.688 1.00 0.00 H ATOM 53511 H1B PGR 1307 63.647 91.148 24.148 1.00 0.00 H ATOM 53512 C32 PGR 1307 64.330 92.118 22.359 1.00 0.00 C ATOM 53513 H2A PGR 1307 64.891 91.810 21.473 1.00 0.00 H ATOM 53514 O35 PGR 1307 65.131 92.721 23.367 1.00 0.00 O ATOM 53515 HO5A PGR 1307 64.603 93.018 24.130 1.00 0.00 H ATOM 53516 C33 PGR 1307 63.228 93.077 21.927 1.00 0.00 C ATOM 53517 H3A PGR 1307 63.745 94.036 21.848 1.00 0.00 H ATOM 53518 H3B PGR 1307 62.781 92.784 20.974 1.00 0.00 H ATOM 53519 O33 PGR 1307 65.574 87.554 23.295 1.00 0.00 O ATOM 53520 O34 PGR 1307 63.344 88.157 24.139 1.00 0.00 O ATOM 53521 O21 PGR 1307 67.184 89.023 27.469 1.00 0.00 O ATOM 53522 C21 PGR 1307 67.944 89.268 28.607 1.00 0.00 C ATOM 53523 O22 PGR 1307 68.830 90.087 28.672 1.00 0.00 O ATOM 53524 O36 PGR 1307 62.203 93.014 22.888 1.00 0.00 O ATOM 53525 HO6A PGR 1307 61.560 92.321 22.653 1.00 0.00 H ATOM 53526 C12 OL 1308 67.708 88.117 29.617 1.00 0.00 C ATOM 53527 H2R OL 1308 66.669 87.796 29.525 1.00 0.00 H ATOM 53528 H2S OL 1308 68.238 87.185 29.409 1.00 0.00 H ATOM 53529 C13 OL 1308 68.057 88.652 31.000 1.00 0.00 C ATOM 53530 H3R OL 1308 69.112 88.930 30.953 1.00 0.00 H ATOM 53531 H3S OL 1308 67.546 89.592 31.218 1.00 0.00 H ATOM 53532 C14 OL 1308 67.997 87.619 32.108 1.00 0.00 C ATOM 53533 H4R OL 1308 66.940 87.421 32.292 1.00 0.00 H ATOM 53534 H4S OL 1308 68.448 86.639 31.937 1.00 0.00 H ATOM 53535 C15 OL 1308 68.556 88.223 33.485 1.00 0.00 C ATOM 53536 H5R OL 1308 69.638 88.330 33.386 1.00 0.00 H ATOM 53537 H5S OL 1308 68.301 89.284 33.463 1.00 0.00 H ATOM 53538 C16 OL 1308 68.157 87.503 34.714 1.00 0.00 C ATOM 53539 H6R OL 1308 67.065 87.495 34.721 1.00 0.00 H ATOM 53540 H6S OL 1308 68.553 86.487 34.765 1.00 0.00 H ATOM 53541 C17 OL 1308 68.621 88.179 35.987 1.00 0.00 C ATOM 53542 H7R OL 1308 69.711 88.145 35.932 1.00 0.00 H ATOM 53543 H7S OL 1308 68.419 89.249 36.068 1.00 0.00 H ATOM 53544 C18 OL 1308 68.169 87.359 37.121 1.00 0.00 C ATOM 53545 H8R OL 1308 67.172 87.738 37.354 1.00 0.00 H ATOM 53546 H8S OL 1308 68.040 86.298 36.896 1.00 0.00 H ATOM 53547 C19 OL 1308 68.974 87.527 38.396 1.00 0.00 C ATOM 53548 H9R OL 1308 68.807 88.462 38.924 1.00 0.00 H ATOM 53549 C110 OL 1308 69.815 86.677 38.955 1.00 0.00 C ATOM 53550 H10R OL 1308 70.301 86.896 39.902 1.00 0.00 H ATOM 53551 C111 OL 1308 70.094 85.262 38.639 1.00 0.00 C ATOM 53552 H11R OL 1308 69.598 84.564 39.316 1.00 0.00 H ATOM 53553 H11S OL 1308 69.740 84.998 37.640 1.00 0.00 H ATOM 53554 C112 OL 1308 71.590 84.964 38.714 1.00 0.00 C ATOM 53555 H12R OL 1308 71.724 84.056 38.123 1.00 0.00 H ATOM 53556 H12S OL 1308 72.201 85.695 38.181 1.00 0.00 H ATOM 53557 C113 OL 1308 72.204 84.695 40.103 1.00 0.00 C ATOM 53558 H13R OL 1308 73.227 84.322 40.018 1.00 0.00 H ATOM 53559 H13S OL 1308 72.214 85.668 40.598 1.00 0.00 H ATOM 53560 C114 OL 1308 71.418 83.720 40.878 1.00 0.00 C ATOM 53561 H14R OL 1308 70.483 84.148 41.245 1.00 0.00 H ATOM 53562 H14S OL 1308 71.108 82.873 40.262 1.00 0.00 H ATOM 53563 C115 OL 1308 72.221 83.229 42.162 1.00 0.00 C ATOM 53564 H15R OL 1308 73.089 82.618 41.906 1.00 0.00 H ATOM 53565 H15S OL 1308 72.671 84.081 42.676 1.00 0.00 H ATOM 53566 C116 OL 1308 71.527 82.356 43.074 1.00 0.00 C ATOM 53567 H16R OL 1308 70.663 82.826 43.548 1.00 0.00 H ATOM 53568 H16S OL 1308 71.157 81.519 42.479 1.00 0.00 H ATOM 53569 C117 OL 1308 72.436 81.612 44.011 1.00 0.00 C ATOM 53570 H17R OL 1308 73.116 80.961 43.458 1.00 0.00 H ATOM 53571 H17S OL 1308 72.965 82.334 44.637 1.00 0.00 H ATOM 53572 C118 OL 1308 71.711 80.656 44.987 1.00 0.00 C ATOM 53573 H18R OL 1308 71.169 81.223 45.747 1.00 0.00 H ATOM 53574 H18S OL 1308 72.377 79.933 45.462 1.00 0.00 H ATOM 53575 H18T OL 1308 71.019 79.941 44.538 1.00 0.00 H TER 53576 OL 1308 ATOM 53576 C116 PA 1309 13.408 105.812 40.051 1.00 0.00 C ATOM 53577 H16R PA 1309 12.705 106.545 40.452 1.00 0.00 H ATOM 53578 H16S PA 1309 13.677 105.013 40.745 1.00 0.00 H ATOM 53579 H16T PA 1309 12.939 105.245 39.245 1.00 0.00 H ATOM 53580 C115 PA 1309 14.605 106.528 39.533 1.00 0.00 C ATOM 53581 H15R PA 1309 14.256 107.233 38.775 1.00 0.00 H ATOM 53582 H15S PA 1309 15.287 105.814 39.066 1.00 0.00 H ATOM 53583 C114 PA 1309 15.218 107.335 40.711 1.00 0.00 C ATOM 53584 H14R PA 1309 15.421 106.763 41.619 1.00 0.00 H ATOM 53585 H14S PA 1309 14.431 107.967 41.130 1.00 0.00 H ATOM 53586 C113 PA 1309 16.393 108.216 40.330 1.00 0.00 C ATOM 53587 H13R PA 1309 17.258 107.587 40.111 1.00 0.00 H ATOM 53588 H13S PA 1309 16.653 108.817 41.204 1.00 0.00 H ATOM 53589 C112 PA 1309 16.256 109.186 39.116 1.00 0.00 C ATOM 53590 H12R PA 1309 15.980 108.619 38.224 1.00 0.00 H ATOM 53591 H12S PA 1309 17.156 109.735 38.832 1.00 0.00 H ATOM 53592 C111 PA 1309 15.211 110.278 39.327 1.00 0.00 C ATOM 53593 H11R PA 1309 15.189 110.668 40.346 1.00 0.00 H ATOM 53594 H11S PA 1309 14.212 109.851 39.217 1.00 0.00 H ATOM 53595 C110 PA 1309 15.405 111.409 38.301 1.00 0.00 C ATOM 53596 H10R PA 1309 15.440 111.013 37.284 1.00 0.00 H ATOM 53597 H10S PA 1309 16.436 111.758 38.383 1.00 0.00 H ATOM 53598 C19 PA 1309 14.319 112.518 38.146 1.00 0.00 C ATOM 53599 H9R PA 1309 13.989 112.973 39.082 1.00 0.00 H ATOM 53600 H9S PA 1309 13.402 112.029 37.810 1.00 0.00 H ATOM 53601 C18 PA 1309 14.636 113.630 37.186 1.00 0.00 C ATOM 53602 H8R PA 1309 15.646 113.976 37.412 1.00 0.00 H ATOM 53603 H8S PA 1309 13.958 114.477 37.305 1.00 0.00 H ATOM 53604 C17 PA 1309 14.491 113.236 35.739 1.00 0.00 C ATOM 53605 H7R PA 1309 13.431 113.194 35.480 1.00 0.00 H ATOM 53606 H7S PA 1309 14.942 112.269 35.506 1.00 0.00 H ATOM 53607 C16 PA 1309 14.914 114.381 34.823 1.00 0.00 C ATOM 53608 H6R PA 1309 16.005 114.378 34.784 1.00 0.00 H ATOM 53609 H6S PA 1309 14.458 115.319 35.144 1.00 0.00 H ATOM 53610 C15 PA 1309 14.301 114.196 33.373 1.00 0.00 C ATOM 53611 H5R PA 1309 13.214 114.117 33.439 1.00 0.00 H ATOM 53612 H5S PA 1309 14.619 113.188 33.099 1.00 0.00 H ATOM 53613 C14 PA 1309 14.845 115.224 32.366 1.00 0.00 C ATOM 53614 H4R PA 1309 15.880 115.465 32.616 1.00 0.00 H ATOM 53615 H4S PA 1309 14.244 116.130 32.470 1.00 0.00 H ATOM 53616 C13 PA 1309 14.579 114.685 30.946 1.00 0.00 C ATOM 53617 H3R PA 1309 13.543 114.942 30.715 1.00 0.00 H ATOM 53618 H3S PA 1309 14.627 113.597 30.871 1.00 0.00 H ATOM 53619 C12 PA 1309 15.605 115.318 29.925 1.00 0.00 C ATOM 53620 H2R PA 1309 16.581 115.256 30.412 1.00 0.00 H ATOM 53621 H2S PA 1309 15.363 116.354 29.678 1.00 0.00 H ATOM 53622 C11 PGR 1310 15.508 114.750 28.546 1.00 0.00 C ATOM 53623 O12 PGR 1310 14.561 115.083 27.825 1.00 0.00 O ATOM 53624 O11 PGR 1310 16.532 113.925 28.177 1.00 0.00 O ATOM 53625 C1 PGR 1310 16.629 113.453 26.769 1.00 0.00 C ATOM 53626 HR PGR 1310 15.749 112.953 26.357 1.00 0.00 H ATOM 53627 HS PGR 1310 17.438 112.728 26.642 1.00 0.00 H ATOM 53628 C2 PGR 1310 16.957 114.715 25.845 1.00 0.00 C ATOM 53629 HX PGR 1310 16.053 115.330 25.827 1.00 0.00 H ATOM 53630 C3 PGR 1310 17.230 114.270 24.414 1.00 0.00 C ATOM 53631 HA PGR 1310 17.404 115.066 23.685 1.00 0.00 H ATOM 53632 HB PGR 1310 16.256 113.843 24.163 1.00 0.00 H ATOM 53633 O31 PGR 1310 18.161 113.200 24.343 1.00 0.00 O ATOM 53634 P31 PGR 1310 18.662 112.617 22.954 1.00 0.00 P ATOM 53635 O32 PGR 1310 19.810 113.726 22.510 1.00 0.00 O ATOM 53636 C31 PGR 1310 21.093 113.946 23.122 1.00 0.00 C ATOM 53637 H1A PGR 1310 21.862 114.189 22.384 1.00 0.00 H ATOM 53638 H1B PGR 1310 21.409 113.022 23.613 1.00 0.00 H ATOM 53639 C32 PGR 1310 21.136 115.204 23.989 1.00 0.00 C ATOM 53640 H2A PGR 1310 20.261 115.391 24.616 1.00 0.00 H ATOM 53641 O35 PGR 1310 21.325 116.313 23.112 1.00 0.00 O ATOM 53642 HO5A PGR 1310 20.870 116.135 22.269 1.00 0.00 H ATOM 53643 C33 PGR 1310 22.400 115.279 24.937 1.00 0.00 C ATOM 53644 H3A PGR 1310 22.284 116.241 25.443 1.00 0.00 H ATOM 53645 H3B PGR 1310 22.495 114.515 25.713 1.00 0.00 H ATOM 53646 O33 PGR 1310 19.286 111.340 23.193 1.00 0.00 O ATOM 53647 O34 PGR 1310 17.582 112.601 21.969 1.00 0.00 O ATOM 53648 O21 PGR 1310 18.122 115.371 26.227 1.00 0.00 O ATOM 53649 C21 PGR 1310 17.957 116.587 26.857 1.00 0.00 C ATOM 53650 O22 PGR 1310 16.907 117.005 27.286 1.00 0.00 O ATOM 53651 O36 PGR 1310 23.595 115.348 24.166 1.00 0.00 O ATOM 53652 HO6A PGR 1310 23.610 116.233 23.758 1.00 0.00 H ATOM 53653 C12 OL 1311 19.217 117.372 26.862 1.00 0.00 C ATOM 53654 H2R OL 1311 19.584 117.738 25.901 1.00 0.00 H ATOM 53655 H2S OL 1311 18.964 118.277 27.419 1.00 0.00 H ATOM 53656 C13 OL 1311 20.187 116.530 27.717 1.00 0.00 C ATOM 53657 H3R OL 1311 20.378 115.653 27.095 1.00 0.00 H ATOM 53658 H3S OL 1311 21.156 117.035 27.716 1.00 0.00 H ATOM 53659 C14 OL 1311 19.847 116.235 29.180 1.00 0.00 C ATOM 53660 H4R OL 1311 19.165 115.385 29.112 1.00 0.00 H ATOM 53661 H4S OL 1311 20.752 115.839 29.647 1.00 0.00 H ATOM 53662 C15 OL 1311 19.299 117.450 29.975 1.00 0.00 C ATOM 53663 H5R OL 1311 19.772 118.378 29.648 1.00 0.00 H ATOM 53664 H5S OL 1311 18.263 117.560 29.647 1.00 0.00 H ATOM 53665 C16 OL 1311 19.137 117.325 31.504 1.00 0.00 C ATOM 53666 H6R OL 1311 18.551 116.466 31.838 1.00 0.00 H ATOM 53667 H6S OL 1311 20.128 117.163 31.935 1.00 0.00 H ATOM 53668 C17 OL 1311 18.375 118.522 32.163 1.00 0.00 C ATOM 53669 H7R OL 1311 18.609 118.626 33.225 1.00 0.00 H ATOM 53670 H7S OL 1311 18.749 119.423 31.673 1.00 0.00 H ATOM 53671 C18 OL 1311 16.851 118.573 32.002 1.00 0.00 C ATOM 53672 H8R OL 1311 16.287 118.544 31.068 1.00 0.00 H ATOM 53673 H8S OL 1311 16.582 117.628 32.479 1.00 0.00 H ATOM 53674 C19 OL 1311 16.238 119.808 32.646 1.00 0.00 C ATOM 53675 H9R OL 1311 16.228 120.607 31.910 1.00 0.00 H ATOM 53676 C110 OL 1311 15.687 119.907 33.830 1.00 0.00 C ATOM 53677 H10R OL 1311 15.271 120.882 34.070 1.00 0.00 H ATOM 53678 C111 OL 1311 15.550 118.940 35.010 1.00 0.00 C ATOM 53679 H11R OL 1311 15.003 118.130 34.523 1.00 0.00 H ATOM 53680 H11S OL 1311 16.579 118.633 35.212 1.00 0.00 H ATOM 53681 C112 OL 1311 14.802 119.439 36.262 1.00 0.00 C ATOM 53682 H12R OL 1311 15.355 120.222 36.785 1.00 0.00 H ATOM 53683 H12S OL 1311 13.820 119.823 35.976 1.00 0.00 H ATOM 53684 C113 OL 1311 14.499 118.393 37.247 1.00 0.00 C ATOM 53685 H13R OL 1311 13.789 118.715 38.012 1.00 0.00 H ATOM 53686 H13S OL 1311 14.097 117.508 36.748 1.00 0.00 H ATOM 53687 C114 OL 1311 15.609 118.153 38.217 1.00 0.00 C ATOM 53688 H14R OL 1311 16.476 117.869 37.617 1.00 0.00 H ATOM 53689 H14S OL 1311 15.963 119.112 38.600 1.00 0.00 H ATOM 53690 C115 OL 1311 15.461 117.078 39.314 1.00 0.00 C ATOM 53691 H15R OL 1311 14.408 116.971 39.585 1.00 0.00 H ATOM 53692 H15S OL 1311 15.849 116.147 38.895 1.00 0.00 H ATOM 53693 C116 OL 1311 16.355 117.394 40.502 1.00 0.00 C ATOM 53694 H16R OL 1311 17.414 117.155 40.382 1.00 0.00 H ATOM 53695 H16S OL 1311 16.447 118.450 40.765 1.00 0.00 H ATOM 53696 C117 OL 1311 16.026 116.675 41.794 1.00 0.00 C ATOM 53697 H17R OL 1311 16.887 116.996 42.383 1.00 0.00 H ATOM 53698 H17S OL 1311 15.244 117.245 42.299 1.00 0.00 H ATOM 53699 C118 OL 1311 15.835 115.123 41.925 1.00 0.00 C ATOM 53700 H18R OL 1311 16.497 114.581 41.247 1.00 0.00 H ATOM 53701 H18S OL 1311 14.862 114.777 41.572 1.00 0.00 H ATOM 53702 H18T OL 1311 16.062 114.663 42.889 1.00 0.00 H TER 53703 OL 1311 ATOM 53703 C116 PA 1312 61.376 93.255 35.268 1.00 0.00 C ATOM 53704 H16R PA 1312 61.893 92.563 34.600 1.00 0.00 H ATOM 53705 H16S PA 1312 61.694 94.220 34.867 1.00 0.00 H ATOM 53706 H16T PA 1312 60.297 93.210 35.103 1.00 0.00 H ATOM 53707 C115 PA 1312 61.747 93.164 36.703 1.00 0.00 C ATOM 53708 H15R PA 1312 62.835 93.089 36.641 1.00 0.00 H ATOM 53709 H15S PA 1312 61.358 92.208 37.058 1.00 0.00 H ATOM 53710 C114 PA 1312 61.302 94.363 37.552 1.00 0.00 C ATOM 53711 H14R PA 1312 61.882 95.245 37.275 1.00 0.00 H ATOM 53712 H14S PA 1312 61.565 94.146 38.590 1.00 0.00 H ATOM 53713 C113 PA 1312 59.778 94.698 37.615 1.00 0.00 C ATOM 53714 H13R PA 1312 59.290 93.806 38.013 1.00 0.00 H ATOM 53715 H13S PA 1312 59.446 94.852 36.586 1.00 0.00 H ATOM 53716 C112 PA 1312 59.460 95.899 38.496 1.00 0.00 C ATOM 53717 H12R PA 1312 60.022 96.803 38.254 1.00 0.00 H ATOM 53718 H12S PA 1312 59.660 95.444 39.468 1.00 0.00 H ATOM 53719 C111 PA 1312 57.970 96.438 38.460 1.00 0.00 C ATOM 53720 H11R PA 1312 57.854 97.175 37.663 1.00 0.00 H ATOM 53721 H11S PA 1312 57.792 96.985 39.388 1.00 0.00 H ATOM 53722 C110 PA 1312 56.857 95.456 38.276 1.00 0.00 C ATOM 53723 H10R PA 1312 56.957 94.721 39.077 1.00 0.00 H ATOM 53724 H10S PA 1312 57.066 94.973 37.319 1.00 0.00 H ATOM 53725 C19 PA 1312 55.511 96.135 38.187 1.00 0.00 C ATOM 53726 H9R PA 1312 55.444 96.787 37.315 1.00 0.00 H ATOM 53727 H9S PA 1312 55.370 96.548 39.188 1.00 0.00 H ATOM 53728 C18 PA 1312 54.497 95.056 37.920 1.00 0.00 C ATOM 53729 H8R PA 1312 54.624 94.285 38.683 1.00 0.00 H ATOM 53730 H8S PA 1312 54.742 94.716 36.912 1.00 0.00 H ATOM 53731 C17 PA 1312 53.021 95.405 37.831 1.00 0.00 C ATOM 53732 H7R PA 1312 52.919 96.345 37.284 1.00 0.00 H ATOM 53733 H7S PA 1312 52.621 95.530 38.839 1.00 0.00 H ATOM 53734 C16 PA 1312 52.181 94.317 36.985 1.00 0.00 C ATOM 53735 H6R PA 1312 52.292 93.398 37.565 1.00 0.00 H ATOM 53736 H6S PA 1312 52.677 94.137 36.029 1.00 0.00 H ATOM 53737 C15 PA 1312 50.646 94.553 36.992 1.00 0.00 C ATOM 53738 H5R PA 1312 50.348 94.790 38.016 1.00 0.00 H ATOM 53739 H5S PA 1312 50.115 93.642 36.706 1.00 0.00 H ATOM 53740 C14 PA 1312 50.171 95.703 36.075 1.00 0.00 C ATOM 53741 H4R PA 1312 50.684 96.637 36.317 1.00 0.00 H ATOM 53742 H4S PA 1312 49.144 95.807 36.431 1.00 0.00 H ATOM 53743 C13 PA 1312 50.348 95.390 34.552 1.00 0.00 C ATOM 53744 H3R PA 1312 51.375 95.121 34.295 1.00 0.00 H ATOM 53745 H3S PA 1312 50.135 96.346 34.069 1.00 0.00 H ATOM 53746 C12 PA 1312 49.565 94.233 33.954 1.00 0.00 C ATOM 53747 H2R PA 1312 48.513 94.377 34.208 1.00 0.00 H ATOM 53748 H2S PA 1312 49.941 93.259 34.275 1.00 0.00 H ATOM 53749 C11 PGR 1313 49.710 94.153 32.458 1.00 0.00 C ATOM 53750 O12 PGR 1313 49.585 95.055 31.646 1.00 0.00 O ATOM 53751 O11 PGR 1313 50.074 92.852 32.117 1.00 0.00 O ATOM 53752 C1 PGR 1313 49.901 92.389 30.769 1.00 0.00 C ATOM 53753 HR PGR 1313 50.502 91.476 30.783 1.00 0.00 H ATOM 53754 HS PGR 1313 50.370 93.043 30.030 1.00 0.00 H ATOM 53755 C2 PGR 1313 48.407 92.082 30.476 1.00 0.00 C ATOM 53756 HX PGR 1313 48.011 91.303 31.133 1.00 0.00 H ATOM 53757 C3 PGR 1313 48.250 91.632 29.054 1.00 0.00 C ATOM 53758 HA PGR 1313 47.215 91.616 28.704 1.00 0.00 H ATOM 53759 HB PGR 1313 48.489 90.565 29.024 1.00 0.00 H ATOM 53760 O31 PGR 1313 49.030 92.349 28.152 1.00 0.00 O ATOM 53761 P31 PGR 1313 48.899 91.980 26.601 1.00 0.00 P ATOM 53762 O32 PGR 1313 49.617 90.566 26.346 1.00 0.00 O ATOM 53763 C31 PGR 1313 50.978 90.307 26.675 1.00 0.00 C ATOM 53764 H1A PGR 1313 51.189 90.609 27.704 1.00 0.00 H ATOM 53765 H1B PGR 1313 51.611 90.952 26.061 1.00 0.00 H ATOM 53766 C32 PGR 1313 51.311 88.855 26.439 1.00 0.00 C ATOM 53767 H2A PGR 1313 52.246 88.621 26.955 1.00 0.00 H ATOM 53768 O35 PGR 1313 51.455 88.559 25.057 1.00 0.00 O ATOM 53769 HO5A PGR 1313 51.992 87.781 24.820 1.00 0.00 H ATOM 53770 C33 PGR 1313 50.168 87.985 26.992 1.00 0.00 C ATOM 53771 H3A PGR 1313 49.955 88.352 28.000 1.00 0.00 H ATOM 53772 H3B PGR 1313 49.256 88.241 26.447 1.00 0.00 H ATOM 53773 O33 PGR 1313 47.478 91.711 26.237 1.00 0.00 O ATOM 53774 O34 PGR 1313 49.729 92.976 25.849 1.00 0.00 O ATOM 53775 O21 PGR 1313 47.590 93.298 30.563 1.00 0.00 O ATOM 53776 C21 PGR 1313 46.264 93.111 30.568 1.00 0.00 C ATOM 53777 O22 PGR 1313 45.818 91.994 30.492 1.00 0.00 O ATOM 53778 O36 PGR 1313 50.645 86.556 27.095 1.00 0.00 O ATOM 53779 HO6A PGR 1313 49.991 86.058 27.618 1.00 0.00 H ATOM 53780 C12 OL 1314 45.575 94.407 30.709 1.00 0.00 C ATOM 53781 H2R OL 1314 46.336 95.124 31.025 1.00 0.00 H ATOM 53782 H2S OL 1314 45.079 94.700 29.782 1.00 0.00 H ATOM 53783 C13 OL 1314 44.537 94.187 31.791 1.00 0.00 C ATOM 53784 H3R OL 1314 43.779 93.493 31.422 1.00 0.00 H ATOM 53785 H3S OL 1314 45.133 93.686 32.557 1.00 0.00 H ATOM 53786 C14 OL 1314 43.939 95.493 32.351 1.00 0.00 C ATOM 53787 H4R OL 1314 43.137 95.245 33.049 1.00 0.00 H ATOM 53788 H4S OL 1314 44.834 95.946 32.783 1.00 0.00 H ATOM 53789 C15 OL 1314 43.487 96.452 31.266 1.00 0.00 C ATOM 53790 H5R OL 1314 44.267 96.609 30.518 1.00 0.00 H ATOM 53791 H5S OL 1314 42.650 95.994 30.736 1.00 0.00 H ATOM 53792 C16 OL 1314 42.868 97.767 31.684 1.00 0.00 C ATOM 53793 H6R OL 1314 42.468 98.312 30.826 1.00 0.00 H ATOM 53794 H6S OL 1314 41.984 97.515 32.273 1.00 0.00 H ATOM 53795 C17 OL 1314 43.865 98.731 32.432 1.00 0.00 C ATOM 53796 H7R OL 1314 44.104 98.335 33.421 1.00 0.00 H ATOM 53797 H7S OL 1314 44.789 98.813 31.856 1.00 0.00 H ATOM 53798 C18 OL 1314 43.364 100.137 32.636 1.00 0.00 C ATOM 53799 H8R OL 1314 42.517 100.210 33.322 1.00 0.00 H ATOM 53800 H8S OL 1314 44.194 100.649 33.128 1.00 0.00 H ATOM 53801 C19 OL 1314 43.038 100.948 31.430 1.00 0.00 C ATOM 53802 H9R OL 1314 43.848 101.043 30.711 1.00 0.00 H ATOM 53803 C110 OL 1314 41.860 101.449 31.089 1.00 0.00 C ATOM 53804 H10R OL 1314 41.692 102.032 30.187 1.00 0.00 H ATOM 53805 C111 OL 1314 40.658 101.407 31.968 1.00 0.00 C ATOM 53806 H11R OL 1314 39.799 101.364 31.295 1.00 0.00 H ATOM 53807 H11S OL 1314 40.538 100.556 32.642 1.00 0.00 H ATOM 53808 C112 OL 1314 40.553 102.762 32.691 1.00 0.00 C ATOM 53809 H12R OL 1314 40.681 103.510 31.906 1.00 0.00 H ATOM 53810 H12S OL 1314 39.507 102.842 32.995 1.00 0.00 H ATOM 53811 C113 OL 1314 41.450 103.068 33.846 1.00 0.00 C ATOM 53812 H13R OL 1314 41.348 102.207 34.510 1.00 0.00 H ATOM 53813 H13S OL 1314 42.489 103.313 33.618 1.00 0.00 H ATOM 53814 C114 OL 1314 41.063 104.363 34.522 1.00 0.00 C ATOM 53815 H14R OL 1314 41.142 105.254 33.895 1.00 0.00 H ATOM 53816 H14S OL 1314 40.116 104.174 35.031 1.00 0.00 H ATOM 53817 C115 OL 1314 41.991 104.672 35.732 1.00 0.00 C ATOM 53818 H15R OL 1314 41.811 103.870 36.452 1.00 0.00 H ATOM 53819 H15S OL 1314 43.038 104.708 35.422 1.00 0.00 H ATOM 53820 C116 OL 1314 41.583 106.022 36.456 1.00 0.00 C ATOM 53821 H16R OL 1314 41.714 106.862 35.772 1.00 0.00 H ATOM 53822 H16S OL 1314 40.520 106.080 36.699 1.00 0.00 H ATOM 53823 C117 OL 1314 42.472 106.161 37.615 1.00 0.00 C ATOM 53824 H17R OL 1314 42.491 105.193 38.120 1.00 0.00 H ATOM 53825 H17S OL 1314 43.480 106.406 37.273 1.00 0.00 H ATOM 53826 C118 OL 1314 42.315 107.340 38.533 1.00 0.00 C ATOM 53827 H18R OL 1314 43.244 107.644 39.020 1.00 0.00 H ATOM 53828 H18S OL 1314 41.593 107.131 39.325 1.00 0.00 H ATOM 53829 H18T OL 1314 41.893 108.228 38.057 1.00 0.00 H TER 53830 OL 1314 ATOM 53830 C116 PA 1315 143.906 92.953 46.231 1.00 0.00 C ATOM 53831 H16R PA 1315 143.415 93.538 47.011 1.00 0.00 H ATOM 53832 H16S PA 1315 144.888 93.373 46.003 1.00 0.00 H ATOM 53833 H16T PA 1315 143.942 91.934 46.622 1.00 0.00 H ATOM 53834 C115 PA 1315 143.104 92.943 44.913 1.00 0.00 C ATOM 53835 H15R PA 1315 142.509 93.856 44.846 1.00 0.00 H ATOM 53836 H15S PA 1315 142.552 92.003 44.841 1.00 0.00 H ATOM 53837 C114 PA 1315 143.956 92.841 43.637 1.00 0.00 C ATOM 53838 H14R PA 1315 144.748 93.573 43.810 1.00 0.00 H ATOM 53839 H14S PA 1315 143.357 93.156 42.780 1.00 0.00 H ATOM 53840 C113 PA 1315 144.288 91.457 43.237 1.00 0.00 C ATOM 53841 H13R PA 1315 143.416 90.825 43.055 1.00 0.00 H ATOM 53842 H13S PA 1315 144.870 90.977 44.027 1.00 0.00 H ATOM 53843 C112 PA 1315 145.159 91.385 41.989 1.00 0.00 C ATOM 53844 H12R PA 1315 145.954 92.129 42.076 1.00 0.00 H ATOM 53845 H12S PA 1315 144.429 91.780 41.279 1.00 0.00 H ATOM 53846 C111 PA 1315 145.664 89.995 41.684 1.00 0.00 C ATOM 53847 H11R PA 1315 144.959 89.178 41.517 1.00 0.00 H ATOM 53848 H11S PA 1315 146.082 89.640 42.628 1.00 0.00 H ATOM 53849 C110 PA 1315 146.696 89.952 40.548 1.00 0.00 C ATOM 53850 H10R PA 1315 147.625 90.288 41.012 1.00 0.00 H ATOM 53851 H10S PA 1315 146.530 90.713 39.782 1.00 0.00 H ATOM 53852 C19 PA 1315 146.808 88.573 39.821 1.00 0.00 C ATOM 53853 H9R PA 1315 145.922 88.432 39.197 1.00 0.00 H ATOM 53854 H9S PA 1315 146.927 87.696 40.460 1.00 0.00 H ATOM 53855 C18 PA 1315 148.051 88.532 38.802 1.00 0.00 C ATOM 53856 H8R PA 1315 148.889 89.079 39.237 1.00 0.00 H ATOM 53857 H8S PA 1315 147.774 89.268 38.044 1.00 0.00 H ATOM 53858 C17 PA 1315 148.383 87.087 38.370 1.00 0.00 C ATOM 53859 H7R PA 1315 147.486 86.691 37.888 1.00 0.00 H ATOM 53860 H7S PA 1315 148.596 86.346 39.143 1.00 0.00 H ATOM 53861 C16 PA 1315 149.585 86.994 37.355 1.00 0.00 C ATOM 53862 H6R PA 1315 149.835 85.934 37.428 1.00 0.00 H ATOM 53863 H6S PA 1315 150.403 87.654 37.652 1.00 0.00 H ATOM 53864 C15 PA 1315 149.312 87.305 35.852 1.00 0.00 C ATOM 53865 H5R PA 1315 150.314 87.404 35.428 1.00 0.00 H ATOM 53866 H5S PA 1315 148.869 88.301 35.776 1.00 0.00 H ATOM 53867 C14 PA 1315 148.498 86.128 35.211 1.00 0.00 C ATOM 53868 H4R PA 1315 147.441 86.082 35.482 1.00 0.00 H ATOM 53869 H4S PA 1315 148.888 85.176 35.576 1.00 0.00 H ATOM 53870 C13 PA 1315 148.529 86.341 33.675 1.00 0.00 C ATOM 53871 H3R PA 1315 149.468 86.235 33.127 1.00 0.00 H ATOM 53872 H3S PA 1315 148.286 87.394 33.513 1.00 0.00 H ATOM 53873 C12 PA 1315 147.588 85.432 32.825 1.00 0.00 C ATOM 53874 H2R PA 1315 146.573 85.347 33.220 1.00 0.00 H ATOM 53875 H2S PA 1315 147.935 84.398 32.881 1.00 0.00 H ATOM 53876 C11 PGR 1316 147.676 85.860 31.382 1.00 0.00 C ATOM 53877 O12 PGR 1316 148.507 85.402 30.567 1.00 0.00 O ATOM 53878 O11 PGR 1316 147.015 87.032 31.198 1.00 0.00 O ATOM 53879 C1 PGR 1316 147.169 87.598 29.875 1.00 0.00 C ATOM 53880 HR PGR 1316 146.843 86.886 29.112 1.00 0.00 H ATOM 53881 HS PGR 1316 148.237 87.792 29.752 1.00 0.00 H ATOM 53882 C2 PGR 1316 146.463 88.942 29.718 1.00 0.00 C ATOM 53883 HX PGR 1316 145.415 88.887 30.025 1.00 0.00 H ATOM 53884 C3 PGR 1316 146.590 89.459 28.257 1.00 0.00 C ATOM 53885 HA PGR 1316 146.165 88.745 27.547 1.00 0.00 H ATOM 53886 HB PGR 1316 147.632 89.596 27.956 1.00 0.00 H ATOM 53887 O31 PGR 1316 145.867 90.618 28.327 1.00 0.00 O ATOM 53888 P31 PGR 1316 145.932 91.591 27.142 1.00 0.00 P ATOM 53889 O32 PGR 1316 147.420 92.162 27.075 1.00 0.00 O ATOM 53890 C31 PGR 1316 147.969 92.855 28.148 1.00 0.00 C ATOM 53891 H1A PGR 1316 148.945 92.379 28.280 1.00 0.00 H ATOM 53892 H1B PGR 1316 147.422 92.652 29.072 1.00 0.00 H ATOM 53893 C32 PGR 1316 148.183 94.371 27.995 1.00 0.00 C ATOM 53894 H2A PGR 1316 147.261 94.788 27.583 1.00 0.00 H ATOM 53895 O35 PGR 1316 149.235 94.571 27.060 1.00 0.00 O ATOM 53896 HO5A PGR 1316 148.863 94.365 26.184 1.00 0.00 H ATOM 53897 C33 PGR 1316 148.438 95.131 29.349 1.00 0.00 C ATOM 53898 H3A PGR 1316 148.453 96.202 29.133 1.00 0.00 H ATOM 53899 H3B PGR 1316 147.562 94.931 29.972 1.00 0.00 H ATOM 53900 O33 PGR 1316 145.690 90.835 25.933 1.00 0.00 O ATOM 53901 O34 PGR 1316 144.957 92.658 27.422 1.00 0.00 O ATOM 53902 O21 PGR 1316 147.286 89.878 30.513 1.00 0.00 O ATOM 53903 C21 PGR 1316 146.569 90.685 31.311 1.00 0.00 C ATOM 53904 O22 PGR 1316 145.378 90.622 31.431 1.00 0.00 O ATOM 53905 O36 PGR 1316 149.643 94.653 29.901 1.00 0.00 O ATOM 53906 HO6A PGR 1316 150.361 94.753 29.250 1.00 0.00 H ATOM 53907 C12 OL 1317 147.540 91.707 31.999 1.00 0.00 C ATOM 53908 H2R OL 1317 148.262 91.105 32.553 1.00 0.00 H ATOM 53909 H2S OL 1317 148.127 92.186 31.213 1.00 0.00 H ATOM 53910 C13 OL 1317 146.879 92.739 32.939 1.00 0.00 C ATOM 53911 H3R OL 1317 147.670 93.465 33.137 1.00 0.00 H ATOM 53912 H3S OL 1317 146.186 93.376 32.386 1.00 0.00 H ATOM 53913 C14 OL 1317 146.318 92.161 34.195 1.00 0.00 C ATOM 53914 H4R OL 1317 145.680 91.274 34.203 1.00 0.00 H ATOM 53915 H4S OL 1317 147.144 91.605 34.645 1.00 0.00 H ATOM 53916 C15 OL 1317 145.954 93.269 35.163 1.00 0.00 C ATOM 53917 H5R OL 1317 146.679 94.082 35.073 1.00 0.00 H ATOM 53918 H5S OL 1317 145.001 93.726 34.890 1.00 0.00 H ATOM 53919 C16 OL 1317 145.822 92.914 36.631 1.00 0.00 C ATOM 53920 H6R OL 1317 144.921 92.325 36.813 1.00 0.00 H ATOM 53921 H6S OL 1317 146.688 92.276 36.819 1.00 0.00 H ATOM 53922 C17 OL 1317 145.671 94.103 37.537 1.00 0.00 C ATOM 53923 H7R OL 1317 146.186 94.979 37.136 1.00 0.00 H ATOM 53924 H7S OL 1317 144.632 94.431 37.616 1.00 0.00 H ATOM 53925 C18 OL 1317 146.391 93.828 38.921 1.00 0.00 C ATOM 53926 H8R OL 1317 145.569 93.476 39.547 1.00 0.00 H ATOM 53927 H8S OL 1317 147.098 92.996 38.905 1.00 0.00 H ATOM 53928 C19 OL 1317 147.083 94.949 39.731 1.00 0.00 C ATOM 53929 H9R OL 1317 148.150 94.891 39.533 1.00 0.00 H ATOM 53930 C110 OL 1317 146.441 95.824 40.538 1.00 0.00 C ATOM 53931 H10R OL 1317 147.027 96.503 41.152 1.00 0.00 H ATOM 53932 C111 OL 1317 144.938 95.768 40.884 1.00 0.00 C ATOM 53933 H11R OL 1317 144.258 96.097 40.095 1.00 0.00 H ATOM 53934 H11S OL 1317 144.671 94.724 41.060 1.00 0.00 H ATOM 53935 C112 OL 1317 144.601 96.574 42.116 1.00 0.00 C ATOM 53936 H12R OL 1317 145.166 96.171 42.959 1.00 0.00 H ATOM 53937 H12S OL 1317 144.909 97.603 41.923 1.00 0.00 H ATOM 53938 C113 OL 1317 143.079 96.545 42.301 1.00 0.00 C ATOM 53939 H13R OL 1317 142.667 96.841 41.334 1.00 0.00 H ATOM 53940 H13S OL 1317 142.779 95.513 42.497 1.00 0.00 H ATOM 53941 C114 OL 1317 142.520 97.556 43.339 1.00 0.00 C ATOM 53942 H14R OL 1317 142.963 97.478 44.334 1.00 0.00 H ATOM 53943 H14S OL 1317 142.701 98.576 42.993 1.00 0.00 H ATOM 53944 C115 OL 1317 140.971 97.447 43.579 1.00 0.00 C ATOM 53945 H15R OL 1317 140.865 96.499 44.110 1.00 0.00 H ATOM 53946 H15S OL 1317 140.615 98.168 44.317 1.00 0.00 H ATOM 53947 C116 OL 1317 140.012 97.389 42.452 1.00 0.00 C ATOM 53948 H16R OL 1317 140.109 98.234 41.767 1.00 0.00 H ATOM 53949 H16S OL 1317 140.164 96.486 41.856 1.00 0.00 H ATOM 53950 C117 OL 1317 138.587 97.308 42.933 1.00 0.00 C ATOM 53951 H17R OL 1317 137.894 96.825 42.242 1.00 0.00 H ATOM 53952 H17S OL 1317 138.572 96.695 43.837 1.00 0.00 H ATOM 53953 C118 OL 1317 137.955 98.622 43.252 1.00 0.00 C ATOM 53954 H18R OL 1317 137.053 98.458 43.845 1.00 0.00 H ATOM 53955 H18S OL 1317 137.724 98.954 42.237 1.00 0.00 H ATOM 53956 H18T OL 1317 138.586 99.359 43.753 1.00 0.00 H TER 53957 OL 1317 ATOM 53957 C116 PA 1318 101.745 112.620 44.712 1.00 0.00 C ATOM 53958 H16R PA 1318 102.523 113.333 44.993 1.00 0.00 H ATOM 53959 H16S PA 1318 102.278 111.803 44.222 1.00 0.00 H ATOM 53960 H16T PA 1318 101.318 112.279 45.658 1.00 0.00 H ATOM 53961 C115 PA 1318 100.751 113.308 43.833 1.00 0.00 C ATOM 53962 H15R PA 1318 100.431 114.167 44.426 1.00 0.00 H ATOM 53963 H15S PA 1318 99.896 112.629 43.795 1.00 0.00 H ATOM 53964 C114 PA 1318 101.062 113.732 42.401 1.00 0.00 C ATOM 53965 H14R PA 1318 101.273 112.892 41.735 1.00 0.00 H ATOM 53966 H14S PA 1318 101.924 114.397 42.489 1.00 0.00 H ATOM 53967 C113 PA 1318 99.960 114.462 41.677 1.00 0.00 C ATOM 53968 H13R PA 1318 99.693 115.277 42.353 1.00 0.00 H ATOM 53969 H13S PA 1318 99.034 113.916 41.873 1.00 0.00 H ATOM 53970 C112 PA 1318 100.168 114.945 40.227 1.00 0.00 C ATOM 53971 H12R PA 1318 99.221 115.242 39.772 1.00 0.00 H ATOM 53972 H12S PA 1318 100.554 114.168 39.563 1.00 0.00 H ATOM 53973 C111 PA 1318 101.197 116.098 40.119 1.00 0.00 C ATOM 53974 H11R PA 1318 102.254 115.838 40.202 1.00 0.00 H ATOM 53975 H11S PA 1318 101.046 116.839 40.908 1.00 0.00 H ATOM 53976 C110 PA 1318 101.092 116.952 38.798 1.00 0.00 C ATOM 53977 H10R PA 1318 101.735 117.826 38.920 1.00 0.00 H ATOM 53978 H10S PA 1318 100.069 117.279 38.599 1.00 0.00 H ATOM 53979 C19 PA 1318 101.388 116.089 37.523 1.00 0.00 C ATOM 53980 H9R PA 1318 100.822 115.159 37.448 1.00 0.00 H ATOM 53981 H9S PA 1318 102.423 115.780 37.683 1.00 0.00 H ATOM 53982 C18 PA 1318 101.092 116.839 36.233 1.00 0.00 C ATOM 53983 H8R PA 1318 100.040 117.108 36.112 1.00 0.00 H ATOM 53984 H8S PA 1318 101.334 116.040 35.529 1.00 0.00 H ATOM 53985 C17 PA 1318 101.958 118.091 35.878 1.00 0.00 C ATOM 53986 H7R PA 1318 103.032 117.950 36.018 1.00 0.00 H ATOM 53987 H7S PA 1318 101.739 118.890 36.589 1.00 0.00 H ATOM 53988 C16 PA 1318 101.810 118.498 34.383 1.00 0.00 C ATOM 53989 H6R PA 1318 100.770 118.781 34.212 1.00 0.00 H ATOM 53990 H6S PA 1318 102.080 117.597 33.827 1.00 0.00 H ATOM 53991 C15 PA 1318 102.703 119.635 34.059 1.00 0.00 C ATOM 53992 H5R PA 1318 103.691 119.192 34.202 1.00 0.00 H ATOM 53993 H5S PA 1318 102.736 120.357 34.878 1.00 0.00 H ATOM 53994 C14 PA 1318 102.547 120.247 32.682 1.00 0.00 C ATOM 53995 H4R PA 1318 103.057 121.212 32.657 1.00 0.00 H ATOM 53996 H4S PA 1318 101.473 120.251 32.485 1.00 0.00 H ATOM 53997 C13 PA 1318 103.011 119.322 31.544 1.00 0.00 C ATOM 53998 H3R PA 1318 102.331 118.482 31.390 1.00 0.00 H ATOM 53999 H3S PA 1318 103.968 118.901 31.862 1.00 0.00 H ATOM 54000 C12 PA 1318 103.216 120.115 30.280 1.00 0.00 C ATOM 54001 H2R PA 1318 104.180 120.625 30.222 1.00 0.00 H ATOM 54002 H2S PA 1318 102.435 120.871 30.173 1.00 0.00 H ATOM 54003 C11 PGR 1319 103.343 119.266 29.127 1.00 0.00 C ATOM 54004 O12 PGR 1319 103.916 118.216 29.091 1.00 0.00 O ATOM 54005 O11 PGR 1319 102.664 119.857 28.098 1.00 0.00 O ATOM 54006 C1 PGR 1319 102.682 119.321 26.696 1.00 0.00 C ATOM 54007 HR PGR 1319 101.753 119.671 26.238 1.00 0.00 H ATOM 54008 HS PGR 1319 102.701 118.234 26.805 1.00 0.00 H ATOM 54009 C2 PGR 1319 103.893 119.752 25.787 1.00 0.00 C ATOM 54010 HX PGR 1319 103.991 120.838 25.864 1.00 0.00 H ATOM 54011 C3 PGR 1319 103.733 119.417 24.304 1.00 0.00 C ATOM 54012 HA PGR 1319 104.676 119.161 23.815 1.00 0.00 H ATOM 54013 HB PGR 1319 103.453 120.326 23.766 1.00 0.00 H ATOM 54014 O31 PGR 1319 102.787 118.357 24.164 1.00 0.00 O ATOM 54015 P31 PGR 1319 102.516 117.781 22.727 1.00 0.00 P ATOM 54016 O32 PGR 1319 101.541 118.830 22.132 1.00 0.00 O ATOM 54017 C31 PGR 1319 100.279 119.010 22.801 1.00 0.00 C ATOM 54018 H1A PGR 1319 100.561 119.194 23.842 1.00 0.00 H ATOM 54019 H1B PGR 1319 99.718 118.075 22.728 1.00 0.00 H ATOM 54020 C32 PGR 1319 99.524 120.260 22.251 1.00 0.00 C ATOM 54021 H2A PGR 1319 98.608 120.417 22.827 1.00 0.00 H ATOM 54022 O35 PGR 1319 99.088 119.765 20.926 1.00 0.00 O ATOM 54023 HO5A PGR 1319 98.613 118.919 21.007 1.00 0.00 H ATOM 54024 C33 PGR 1319 100.302 121.547 22.089 1.00 0.00 C ATOM 54025 H3A PGR 1319 101.029 121.651 22.899 1.00 0.00 H ATOM 54026 H3B PGR 1319 100.908 121.567 21.179 1.00 0.00 H ATOM 54027 O33 PGR 1319 103.773 118.007 21.953 1.00 0.00 O ATOM 54028 O34 PGR 1319 101.926 116.409 22.667 1.00 0.00 O ATOM 54029 O21 PGR 1319 105.176 119.188 26.301 1.00 0.00 O ATOM 54030 C21 PGR 1319 105.695 119.891 27.347 1.00 0.00 C ATOM 54031 O22 PGR 1319 105.297 120.976 27.775 1.00 0.00 O ATOM 54032 O36 PGR 1319 99.352 122.670 21.940 1.00 0.00 O ATOM 54033 HO6A PGR 1319 99.474 123.200 21.132 1.00 0.00 H ATOM 54034 C12 OL 1320 106.975 119.251 27.775 1.00 0.00 C ATOM 54035 H2R OL 1320 106.924 118.198 27.492 1.00 0.00 H ATOM 54036 H2S OL 1320 107.752 119.594 27.088 1.00 0.00 H ATOM 54037 C13 OL 1320 107.328 119.260 29.297 1.00 0.00 C ATOM 54038 H3R OL 1320 107.323 120.299 29.632 1.00 0.00 H ATOM 54039 H3S OL 1320 106.493 118.844 29.864 1.00 0.00 H ATOM 54040 C14 OL 1320 108.630 118.635 29.721 1.00 0.00 C ATOM 54041 H4R OL 1320 108.466 117.564 29.584 1.00 0.00 H ATOM 54042 H4S OL 1320 109.454 118.968 29.086 1.00 0.00 H ATOM 54043 C15 OL 1320 108.926 118.805 31.206 1.00 0.00 C ATOM 54044 H5R OL 1320 109.131 119.866 31.362 1.00 0.00 H ATOM 54045 H5S OL 1320 107.992 118.641 31.748 1.00 0.00 H ATOM 54046 C16 OL 1320 110.047 117.804 31.794 1.00 0.00 C ATOM 54047 H6R OL 1320 110.055 116.830 31.301 1.00 0.00 H ATOM 54048 H6S OL 1320 111.039 118.184 31.538 1.00 0.00 H ATOM 54049 C17 OL 1320 110.112 117.832 33.349 1.00 0.00 C ATOM 54050 H7R OL 1320 111.093 117.435 33.618 1.00 0.00 H ATOM 54051 H7S OL 1320 110.028 118.906 33.533 1.00 0.00 H ATOM 54052 C18 OL 1320 109.141 116.977 34.086 1.00 0.00 C ATOM 54053 H8R OL 1320 109.075 117.236 35.145 1.00 0.00 H ATOM 54054 H8S OL 1320 108.123 117.242 33.793 1.00 0.00 H ATOM 54055 C19 OL 1320 109.472 115.508 33.910 1.00 0.00 C ATOM 54056 H9R OL 1320 108.708 114.997 33.330 1.00 0.00 H ATOM 54057 C110 OL 1320 110.303 114.814 34.720 1.00 0.00 C ATOM 54058 H10R OL 1320 110.424 113.739 34.613 1.00 0.00 H ATOM 54059 C111 OL 1320 111.260 115.390 35.705 1.00 0.00 C ATOM 54060 H11R OL 1320 112.254 114.977 35.524 1.00 0.00 H ATOM 54061 H11S OL 1320 111.332 116.466 35.535 1.00 0.00 H ATOM 54062 C112 OL 1320 110.797 115.000 37.126 1.00 0.00 C ATOM 54063 H12R OL 1320 109.776 115.366 37.256 1.00 0.00 H ATOM 54064 H12S OL 1320 110.804 113.913 37.228 1.00 0.00 H ATOM 54065 C113 OL 1320 111.686 115.644 38.099 1.00 0.00 C ATOM 54066 H13R OL 1320 111.855 116.625 37.649 1.00 0.00 H ATOM 54067 H13S OL 1320 111.270 115.652 39.109 1.00 0.00 H ATOM 54068 C114 OL 1320 113.038 114.937 38.302 1.00 0.00 C ATOM 54069 H14R OL 1320 112.871 113.960 38.761 1.00 0.00 H ATOM 54070 H14S OL 1320 113.546 114.819 37.343 1.00 0.00 H ATOM 54071 C115 OL 1320 113.956 115.710 39.233 1.00 0.00 C ATOM 54072 H15R OL 1320 114.194 116.639 38.711 1.00 0.00 H ATOM 54073 H15S OL 1320 113.408 115.960 40.144 1.00 0.00 H ATOM 54074 C116 OL 1320 115.384 115.156 39.508 1.00 0.00 C ATOM 54075 H16R OL 1320 115.279 114.248 40.105 1.00 0.00 H ATOM 54076 H16S OL 1320 115.814 114.844 38.553 1.00 0.00 H ATOM 54077 C117 OL 1320 116.228 116.165 40.326 1.00 0.00 C ATOM 54078 H17R OL 1320 116.297 117.150 39.860 1.00 0.00 H ATOM 54079 H17S OL 1320 115.748 116.299 41.298 1.00 0.00 H ATOM 54080 C118 OL 1320 117.610 115.536 40.725 1.00 0.00 C ATOM 54081 H18R OL 1320 117.558 114.731 41.461 1.00 0.00 H ATOM 54082 H18S OL 1320 118.088 116.363 41.254 1.00 0.00 H ATOM 54083 H18T OL 1320 118.216 115.265 39.858 1.00 0.00 H TER 54084 OL 1320 ATOM 54084 C116 PA 1321 24.200 37.397 35.351 1.00 0.00 C ATOM 54085 H16R PA 1321 24.608 36.403 35.155 1.00 0.00 H ATOM 54086 H16S PA 1321 23.282 37.236 35.920 1.00 0.00 H ATOM 54087 H16T PA 1321 24.900 37.945 35.985 1.00 0.00 H ATOM 54088 C115 PA 1321 23.799 38.104 34.094 1.00 0.00 C ATOM 54089 H15R PA 1321 23.378 37.423 33.351 1.00 0.00 H ATOM 54090 H15S PA 1321 24.789 38.362 33.712 1.00 0.00 H ATOM 54091 C114 PA 1321 22.814 39.268 34.236 1.00 0.00 C ATOM 54092 H14R PA 1321 22.014 39.071 34.953 1.00 0.00 H ATOM 54093 H14S PA 1321 22.498 39.418 33.202 1.00 0.00 H ATOM 54094 C113 PA 1321 23.464 40.556 34.696 1.00 0.00 C ATOM 54095 H13R PA 1321 24.124 40.876 33.887 1.00 0.00 H ATOM 54096 H13S PA 1321 24.044 40.336 35.595 1.00 0.00 H ATOM 54097 C112 PA 1321 22.503 41.667 35.103 1.00 0.00 C ATOM 54098 H12R PA 1321 22.173 41.435 36.118 1.00 0.00 H ATOM 54099 H12S PA 1321 21.647 41.812 34.441 1.00 0.00 H ATOM 54100 C111 PA 1321 23.261 42.951 35.188 1.00 0.00 C ATOM 54101 H11R PA 1321 24.022 42.896 35.968 1.00 0.00 H ATOM 54102 H11S PA 1321 22.564 43.750 35.449 1.00 0.00 H ATOM 54103 C110 PA 1321 23.793 43.300 33.797 1.00 0.00 C ATOM 54104 H10R PA 1321 23.105 42.916 33.041 1.00 0.00 H ATOM 54105 H10S PA 1321 24.749 42.779 33.712 1.00 0.00 H ATOM 54106 C19 PA 1321 23.965 44.776 33.603 1.00 0.00 C ATOM 54107 H9R PA 1321 24.750 45.021 34.322 1.00 0.00 H ATOM 54108 H9S PA 1321 23.053 45.294 33.908 1.00 0.00 H ATOM 54109 C18 PA 1321 24.403 45.207 32.193 1.00 0.00 C ATOM 54110 H8R PA 1321 24.449 46.297 32.160 1.00 0.00 H ATOM 54111 H8S PA 1321 23.681 45.022 31.394 1.00 0.00 H ATOM 54112 C17 PA 1321 25.632 44.426 31.745 1.00 0.00 C ATOM 54113 H7R PA 1321 25.169 43.477 31.467 1.00 0.00 H ATOM 54114 H7S PA 1321 26.417 44.339 32.499 1.00 0.00 H ATOM 54115 C16 PA 1321 26.269 44.950 30.483 1.00 0.00 C ATOM 54116 H6R PA 1321 26.627 45.980 30.538 1.00 0.00 H ATOM 54117 H6S PA 1321 25.561 45.204 29.692 1.00 0.00 H ATOM 54118 C15 PA 1321 27.315 44.084 29.691 1.00 0.00 C ATOM 54119 H5R PA 1321 27.808 44.638 28.889 1.00 0.00 H ATOM 54120 H5S PA 1321 26.806 43.250 29.203 1.00 0.00 H ATOM 54121 C14 PA 1321 28.414 43.477 30.527 1.00 0.00 C ATOM 54122 H4R PA 1321 29.097 42.864 29.935 1.00 0.00 H ATOM 54123 H4S PA 1321 27.933 42.687 31.107 1.00 0.00 H ATOM 54124 C13 PA 1321 29.218 44.408 31.370 1.00 0.00 C ATOM 54125 H3R PA 1321 30.074 43.904 31.823 1.00 0.00 H ATOM 54126 H3S PA 1321 28.645 44.788 32.219 1.00 0.00 H ATOM 54127 C12 PA 1321 29.713 45.687 30.633 1.00 0.00 C ATOM 54128 H2R PA 1321 30.127 46.443 31.303 1.00 0.00 H ATOM 54129 H2S PA 1321 28.893 46.269 30.207 1.00 0.00 H ATOM 54130 C11 PGR 1322 30.775 45.409 29.476 1.00 0.00 C ATOM 54131 O12 PGR 1322 31.376 44.377 29.562 1.00 0.00 O ATOM 54132 O11 PGR 1322 30.804 46.307 28.507 1.00 0.00 O ATOM 54133 C1 PGR 1322 31.697 46.040 27.424 1.00 0.00 C ATOM 54134 HR PGR 1322 31.410 46.593 26.526 1.00 0.00 H ATOM 54135 HS PGR 1322 31.714 44.972 27.192 1.00 0.00 H ATOM 54136 C2 PGR 1322 33.077 46.744 27.739 1.00 0.00 C ATOM 54137 HX PGR 1322 32.925 47.735 28.175 1.00 0.00 H ATOM 54138 C3 PGR 1322 34.009 46.853 26.516 1.00 0.00 C ATOM 54139 HA PGR 1322 35.053 46.789 26.832 1.00 0.00 H ATOM 54140 HB PGR 1322 33.947 47.876 26.135 1.00 0.00 H ATOM 54141 O31 PGR 1322 33.775 45.937 25.392 1.00 0.00 O ATOM 54142 P31 PGR 1322 34.872 45.705 24.275 1.00 0.00 P ATOM 54143 O32 PGR 1322 34.426 46.658 23.165 1.00 0.00 O ATOM 54144 C31 PGR 1322 33.405 46.321 22.316 1.00 0.00 C ATOM 54145 H1A PGR 1322 32.746 45.544 22.712 1.00 0.00 H ATOM 54146 H1B PGR 1322 33.782 45.813 21.425 1.00 0.00 H ATOM 54147 C32 PGR 1322 32.614 47.531 21.804 1.00 0.00 C ATOM 54148 H2A PGR 1322 31.687 47.245 21.299 1.00 0.00 H ATOM 54149 O35 PGR 1322 33.476 48.222 20.875 1.00 0.00 O ATOM 54150 HO5A PGR 1322 33.014 48.582 20.097 1.00 0.00 H ATOM 54151 C33 PGR 1322 32.228 48.519 22.896 1.00 0.00 C ATOM 54152 H3A PGR 1322 31.557 47.907 23.505 1.00 0.00 H ATOM 54153 H3B PGR 1322 33.080 48.838 23.502 1.00 0.00 H ATOM 54154 O33 PGR 1322 36.220 46.149 24.755 1.00 0.00 O ATOM 54155 O34 PGR 1322 34.732 44.350 23.746 1.00 0.00 O ATOM 54156 O21 PGR 1322 33.709 45.924 28.675 1.00 0.00 O ATOM 54157 C21 PGR 1322 34.127 44.641 28.459 1.00 0.00 C ATOM 54158 O22 PGR 1322 33.877 43.955 27.501 1.00 0.00 O ATOM 54159 O36 PGR 1322 31.463 49.542 22.305 1.00 0.00 O ATOM 54160 HO6A PGR 1322 32.055 50.109 21.778 1.00 0.00 H ATOM 54161 C12 OL 1323 35.024 44.159 29.608 1.00 0.00 C ATOM 54162 H2R OL 1323 34.483 43.325 30.059 1.00 0.00 H ATOM 54163 H2S OL 1323 36.007 43.897 29.210 1.00 0.00 H ATOM 54164 C13 OL 1323 35.294 45.349 30.616 1.00 0.00 C ATOM 54165 H3R OL 1323 35.858 46.040 29.986 1.00 0.00 H ATOM 54166 H3S OL 1323 34.277 45.666 30.859 1.00 0.00 H ATOM 54167 C14 OL 1323 35.989 45.010 31.912 1.00 0.00 C ATOM 54168 H4R OL 1323 35.264 44.352 32.396 1.00 0.00 H ATOM 54169 H4S OL 1323 36.829 44.410 31.557 1.00 0.00 H ATOM 54170 C15 OL 1323 36.469 46.122 32.822 1.00 0.00 C ATOM 54171 H5R OL 1323 37.046 46.859 32.260 1.00 0.00 H ATOM 54172 H5S OL 1323 35.696 46.693 33.341 1.00 0.00 H ATOM 54173 C16 OL 1323 37.362 45.560 34.048 1.00 0.00 C ATOM 54174 H6R OL 1323 37.994 44.738 33.706 1.00 0.00 H ATOM 54175 H6S OL 1323 37.979 46.431 34.275 1.00 0.00 H ATOM 54176 C17 OL 1323 36.644 45.067 35.337 1.00 0.00 C ATOM 54177 H7R OL 1323 35.867 45.721 35.739 1.00 0.00 H ATOM 54178 H7S OL 1323 36.108 44.148 35.092 1.00 0.00 H ATOM 54179 C18 OL 1323 37.673 44.659 36.453 1.00 0.00 C ATOM 54180 H8R OL 1323 38.489 44.089 36.002 1.00 0.00 H ATOM 54181 H8S OL 1323 38.271 45.519 36.761 1.00 0.00 H ATOM 54182 C19 OL 1323 37.076 43.817 37.467 1.00 0.00 C ATOM 54183 H9R OL 1323 37.264 42.766 37.264 1.00 0.00 H ATOM 54184 C110 OL 1323 36.375 44.130 38.539 1.00 0.00 C ATOM 54185 H10R OL 1323 36.094 43.313 39.199 1.00 0.00 H ATOM 54186 C111 OL 1323 36.066 45.557 38.965 1.00 0.00 C ATOM 54187 H11R OL 1323 36.345 46.227 38.148 1.00 0.00 H ATOM 54188 H11S OL 1323 35.001 45.616 39.200 1.00 0.00 H ATOM 54189 C112 OL 1323 36.767 46.013 40.237 1.00 0.00 C ATOM 54190 H12R OL 1323 36.245 45.340 40.921 1.00 0.00 H ATOM 54191 H12S OL 1323 37.835 45.791 40.189 1.00 0.00 H ATOM 54192 C113 OL 1323 36.426 47.405 40.742 1.00 0.00 C ATOM 54193 H13R OL 1323 36.701 48.122 39.965 1.00 0.00 H ATOM 54194 H13S OL 1323 35.341 47.519 40.697 1.00 0.00 H ATOM 54195 C114 OL 1323 36.986 47.663 42.152 1.00 0.00 C ATOM 54196 H14R OL 1323 36.751 46.722 42.654 1.00 0.00 H ATOM 54197 H14S OL 1323 38.062 47.849 42.141 1.00 0.00 H ATOM 54198 C115 OL 1323 36.261 48.829 42.862 1.00 0.00 C ATOM 54199 H15R OL 1323 36.156 49.712 42.228 1.00 0.00 H ATOM 54200 H15S OL 1323 35.198 48.589 42.929 1.00 0.00 H ATOM 54201 C116 OL 1323 36.624 49.256 44.226 1.00 0.00 C ATOM 54202 H16R OL 1323 35.767 49.768 44.667 1.00 0.00 H ATOM 54203 H16S OL 1323 36.652 48.372 44.867 1.00 0.00 H ATOM 54204 C117 OL 1323 37.952 49.893 44.327 1.00 0.00 C ATOM 54205 H17R OL 1323 38.045 50.285 45.341 1.00 0.00 H ATOM 54206 H17S OL 1323 38.680 49.078 44.325 1.00 0.00 H ATOM 54207 C118 OL 1323 38.402 50.896 43.281 1.00 0.00 C ATOM 54208 H18R OL 1323 39.282 51.472 43.576 1.00 0.00 H ATOM 54209 H18S OL 1323 37.629 51.664 43.355 1.00 0.00 H ATOM 54210 H18T OL 1323 38.514 50.570 42.245 1.00 0.00 H TER 54211 OL 1323 ATOM 54211 C116 PA 1324 67.232 129.028 33.438 1.00 0.00 C ATOM 54212 H16R PA 1324 67.009 128.431 34.324 1.00 0.00 H ATOM 54213 H16S PA 1324 67.384 128.414 32.548 1.00 0.00 H ATOM 54214 H16T PA 1324 66.341 129.543 33.073 1.00 0.00 H ATOM 54215 C115 PA 1324 68.428 129.961 33.443 1.00 0.00 C ATOM 54216 H15R PA 1324 68.384 130.729 34.219 1.00 0.00 H ATOM 54217 H15S PA 1324 68.465 130.634 32.584 1.00 0.00 H ATOM 54218 C114 PA 1324 69.805 129.217 33.669 1.00 0.00 C ATOM 54219 H14R PA 1324 70.509 130.006 33.939 1.00 0.00 H ATOM 54220 H14S PA 1324 70.163 128.584 32.855 1.00 0.00 H ATOM 54221 C113 PA 1324 69.906 128.229 34.901 1.00 0.00 C ATOM 54222 H13R PA 1324 69.565 127.248 34.565 1.00 0.00 H ATOM 54223 H13S PA 1324 69.242 128.601 35.684 1.00 0.00 H ATOM 54224 C112 PA 1324 71.303 128.112 35.495 1.00 0.00 C ATOM 54225 H12R PA 1324 71.382 127.339 36.262 1.00 0.00 H ATOM 54226 H12S PA 1324 71.263 129.042 36.065 1.00 0.00 H ATOM 54227 C111 PA 1324 72.445 127.978 34.452 1.00 0.00 C ATOM 54228 H11R PA 1324 72.490 128.751 33.682 1.00 0.00 H ATOM 54229 H11S PA 1324 72.240 127.126 33.801 1.00 0.00 H ATOM 54230 C110 PA 1324 73.931 128.030 35.039 1.00 0.00 C ATOM 54231 H10R PA 1324 73.966 127.401 35.931 1.00 0.00 H ATOM 54232 H10S PA 1324 74.291 129.030 35.291 1.00 0.00 H ATOM 54233 C19 PA 1324 74.941 127.316 34.132 1.00 0.00 C ATOM 54234 H9R PA 1324 74.570 126.411 33.646 1.00 0.00 H ATOM 54235 H9S PA 1324 75.672 126.937 34.849 1.00 0.00 H ATOM 54236 C18 PA 1324 75.662 128.257 33.171 1.00 0.00 C ATOM 54237 H8R PA 1324 75.974 129.203 33.618 1.00 0.00 H ATOM 54238 H8S PA 1324 74.861 128.568 32.498 1.00 0.00 H ATOM 54239 C17 PA 1324 76.861 127.549 32.428 1.00 0.00 C ATOM 54240 H7R PA 1324 77.367 126.868 33.116 1.00 0.00 H ATOM 54241 H7S PA 1324 77.616 128.286 32.147 1.00 0.00 H ATOM 54242 C16 PA 1324 76.419 126.754 31.267 1.00 0.00 C ATOM 54243 H6R PA 1324 75.898 127.374 30.534 1.00 0.00 H ATOM 54244 H6S PA 1324 75.657 126.033 31.569 1.00 0.00 H ATOM 54245 C15 PA 1324 77.615 125.957 30.632 1.00 0.00 C ATOM 54246 H5R PA 1324 78.126 125.426 31.437 1.00 0.00 H ATOM 54247 H5S PA 1324 78.483 126.563 30.360 1.00 0.00 H ATOM 54248 C14 PA 1324 77.126 125.057 29.508 1.00 0.00 C ATOM 54249 H4R PA 1324 76.365 124.413 29.952 1.00 0.00 H ATOM 54250 H4S PA 1324 77.890 124.400 29.085 1.00 0.00 H ATOM 54251 C13 PA 1324 76.366 125.848 28.481 1.00 0.00 C ATOM 54252 H3R PA 1324 77.122 126.542 28.108 1.00 0.00 H ATOM 54253 H3S PA 1324 75.455 126.389 28.749 1.00 0.00 H ATOM 54254 C12 PA 1324 75.874 125.022 27.279 1.00 0.00 C ATOM 54255 H2R PA 1324 75.015 124.444 27.627 1.00 0.00 H ATOM 54256 H2S PA 1324 76.533 124.174 27.083 1.00 0.00 H ATOM 54257 C11 PGR 1325 75.648 125.804 25.968 1.00 0.00 C ATOM 54258 O12 PGR 1325 76.557 126.198 25.255 1.00 0.00 O ATOM 54259 O11 PGR 1325 74.327 125.839 25.602 1.00 0.00 O ATOM 54260 C1 PGR 1325 73.977 125.846 24.183 1.00 0.00 C ATOM 54261 HR PGR 1325 74.582 126.603 23.678 1.00 0.00 H ATOM 54262 HS PGR 1325 72.915 126.082 24.070 1.00 0.00 H ATOM 54263 C2 PGR 1325 74.375 124.497 23.485 1.00 0.00 C ATOM 54264 HX PGR 1325 75.400 124.263 23.785 1.00 0.00 H ATOM 54265 C3 PGR 1325 74.375 124.605 21.875 1.00 0.00 C ATOM 54266 HA PGR 1325 74.565 125.657 21.648 1.00 0.00 H ATOM 54267 HB PGR 1325 73.380 124.364 21.493 1.00 0.00 H ATOM 54268 O31 PGR 1325 75.436 123.731 21.309 1.00 0.00 O ATOM 54269 P31 PGR 1325 75.608 123.483 19.665 1.00 0.00 P ATOM 54270 O32 PGR 1325 76.549 124.566 19.106 1.00 0.00 O ATOM 54271 C31 PGR 1325 76.065 125.853 18.929 1.00 0.00 C ATOM 54272 H1A PGR 1325 75.564 126.244 19.818 1.00 0.00 H ATOM 54273 H1B PGR 1325 75.345 125.776 18.110 1.00 0.00 H ATOM 54274 C32 PGR 1325 77.141 126.810 18.321 1.00 0.00 C ATOM 54275 H2A PGR 1325 76.697 127.804 18.226 1.00 0.00 H ATOM 54276 O35 PGR 1325 77.534 126.324 17.006 1.00 0.00 O ATOM 54277 HO5A PGR 1325 78.216 125.719 17.350 1.00 0.00 H ATOM 54278 C33 PGR 1325 78.395 126.813 19.254 1.00 0.00 C ATOM 54279 H3A PGR 1325 78.318 127.415 20.164 1.00 0.00 H ATOM 54280 H3B PGR 1325 78.583 125.836 19.706 1.00 0.00 H ATOM 54281 O33 PGR 1325 76.221 122.127 19.608 1.00 0.00 O ATOM 54282 O34 PGR 1325 74.245 123.618 19.146 1.00 0.00 O ATOM 54283 O21 PGR 1325 73.543 123.392 23.990 1.00 0.00 O ATOM 54284 C21 PGR 1325 72.255 123.377 23.768 1.00 0.00 C ATOM 54285 O22 PGR 1325 71.542 124.262 23.350 1.00 0.00 O ATOM 54286 O36 PGR 1325 79.581 127.251 18.626 1.00 0.00 O ATOM 54287 HO6A PGR 1325 80.280 127.314 19.301 1.00 0.00 H ATOM 54288 C12 OL 1326 71.636 122.092 24.367 1.00 0.00 C ATOM 54289 H2R OL 1326 70.884 121.691 23.685 1.00 0.00 H ATOM 54290 H2S OL 1326 72.325 121.265 24.552 1.00 0.00 H ATOM 54291 C13 OL 1326 71.046 122.437 25.745 1.00 0.00 C ATOM 54292 H3R OL 1326 70.427 123.335 25.706 1.00 0.00 H ATOM 54293 H3S OL 1326 70.391 121.610 26.030 1.00 0.00 H ATOM 54294 C14 OL 1326 71.985 122.549 26.931 1.00 0.00 C ATOM 54295 H4R OL 1326 72.721 121.743 26.965 1.00 0.00 H ATOM 54296 H4S OL 1326 72.403 123.531 26.700 1.00 0.00 H ATOM 54297 C15 OL 1326 71.204 122.663 28.290 1.00 0.00 C ATOM 54298 H5R OL 1326 70.491 123.488 28.234 1.00 0.00 H ATOM 54299 H5S OL 1326 70.605 121.783 28.535 1.00 0.00 H ATOM 54300 C16 OL 1326 72.170 122.786 29.490 1.00 0.00 C ATOM 54301 H6R OL 1326 72.950 122.024 29.535 1.00 0.00 H ATOM 54302 H6S OL 1326 72.722 123.728 29.460 1.00 0.00 H ATOM 54303 C17 OL 1326 71.374 122.726 30.785 1.00 0.00 C ATOM 54304 H7R OL 1326 70.333 123.048 30.705 1.00 0.00 H ATOM 54305 H7S OL 1326 71.232 121.712 31.165 1.00 0.00 H ATOM 54306 C18 OL 1326 71.908 123.631 31.927 1.00 0.00 C ATOM 54307 H8R OL 1326 72.924 123.936 31.666 1.00 0.00 H ATOM 54308 H8S OL 1326 71.417 124.594 31.772 1.00 0.00 H ATOM 54309 C19 OL 1326 71.719 123.135 33.281 1.00 0.00 C ATOM 54310 H9R OL 1326 70.832 123.577 33.727 1.00 0.00 H ATOM 54311 C110 OL 1326 72.511 122.376 34.041 1.00 0.00 C ATOM 54312 H10R OL 1326 72.222 122.268 35.084 1.00 0.00 H ATOM 54313 C111 OL 1326 73.890 121.908 33.653 1.00 0.00 C ATOM 54314 H11R OL 1326 73.961 120.822 33.562 1.00 0.00 H ATOM 54315 H11S OL 1326 74.237 122.492 32.798 1.00 0.00 H ATOM 54316 C112 OL 1326 74.842 121.939 34.885 1.00 0.00 C ATOM 54317 H12R OL 1326 74.523 121.132 35.549 1.00 0.00 H ATOM 54318 H12S OL 1326 75.879 121.697 34.645 1.00 0.00 H ATOM 54319 C113 OL 1326 74.852 123.220 35.709 1.00 0.00 C ATOM 54320 H13R OL 1326 75.178 124.060 35.092 1.00 0.00 H ATOM 54321 H13S OL 1326 73.849 123.471 36.061 1.00 0.00 H ATOM 54322 C114 OL 1326 75.692 123.318 36.921 1.00 0.00 C ATOM 54323 H14R OL 1326 75.380 122.577 37.660 1.00 0.00 H ATOM 54324 H14S OL 1326 76.697 122.955 36.694 1.00 0.00 H ATOM 54325 C115 OL 1326 75.587 124.671 37.676 1.00 0.00 C ATOM 54326 H15R OL 1326 75.924 125.456 36.997 1.00 0.00 H ATOM 54327 H15S OL 1326 74.539 124.951 37.802 1.00 0.00 H ATOM 54328 C116 OL 1326 76.387 124.773 38.996 1.00 0.00 C ATOM 54329 H16R OL 1326 76.266 125.832 39.231 1.00 0.00 H ATOM 54330 H16S OL 1326 75.748 124.279 39.731 1.00 0.00 H ATOM 54331 C117 OL 1326 77.880 124.326 38.925 1.00 0.00 C ATOM 54332 H17R OL 1326 78.233 124.463 39.949 1.00 0.00 H ATOM 54333 H17S OL 1326 77.941 123.253 38.731 1.00 0.00 H ATOM 54334 C118 OL 1326 78.555 125.007 37.705 1.00 0.00 C ATOM 54335 H18R OL 1326 79.580 124.648 37.594 1.00 0.00 H ATOM 54336 H18S OL 1326 78.538 126.097 37.656 1.00 0.00 H ATOM 54337 H18T OL 1326 78.222 124.650 36.728 1.00 0.00 H TER 54338 OL 1326 ATOM 54338 C116 PA 1327 -0.262 51.548 40.012 1.00 0.00 C ATOM 54339 H16R PA 1327 0.737 51.609 40.449 1.00 0.00 H ATOM 54340 H16S PA 1327 -0.669 50.614 40.404 1.00 0.00 H ATOM 54341 H16T PA 1327 -0.707 52.359 40.593 1.00 0.00 H ATOM 54342 C115 PA 1327 -0.500 51.735 38.510 1.00 0.00 C ATOM 54343 H15R PA 1327 -0.049 52.690 38.232 1.00 0.00 H ATOM 54344 H15S PA 1327 -1.577 51.809 38.345 1.00 0.00 H ATOM 54345 C114 PA 1327 0.133 50.591 37.646 1.00 0.00 C ATOM 54346 H14R PA 1327 -0.427 49.667 37.809 1.00 0.00 H ATOM 54347 H14S PA 1327 1.109 50.284 38.026 1.00 0.00 H ATOM 54348 C113 PA 1327 0.241 50.918 36.194 1.00 0.00 C ATOM 54349 H13R PA 1327 0.431 51.959 35.924 1.00 0.00 H ATOM 54350 H13S PA 1327 -0.768 50.845 35.783 1.00 0.00 H ATOM 54351 C112 PA 1327 1.201 49.992 35.470 1.00 0.00 C ATOM 54352 H12R PA 1327 1.225 48.963 35.834 1.00 0.00 H ATOM 54353 H12S PA 1327 2.139 50.535 35.600 1.00 0.00 H ATOM 54354 C111 PA 1327 1.016 49.822 33.921 1.00 0.00 C ATOM 54355 H11R PA 1327 0.010 49.445 33.728 1.00 0.00 H ATOM 54356 H11S PA 1327 1.676 49.044 33.530 1.00 0.00 H ATOM 54357 C110 PA 1327 1.130 51.122 33.129 1.00 0.00 C ATOM 54358 H10R PA 1327 2.006 51.669 33.482 1.00 0.00 H ATOM 54359 H10S PA 1327 0.250 51.747 33.296 1.00 0.00 H ATOM 54360 C19 PA 1327 1.340 50.921 31.666 1.00 0.00 C ATOM 54361 H9R PA 1327 0.572 50.234 31.305 1.00 0.00 H ATOM 54362 H9S PA 1327 2.278 50.378 31.536 1.00 0.00 H ATOM 54363 C18 PA 1327 1.374 52.209 30.792 1.00 0.00 C ATOM 54364 H8R PA 1327 2.132 52.920 31.127 1.00 0.00 H ATOM 54365 H8S PA 1327 0.381 52.655 30.876 1.00 0.00 H ATOM 54366 C17 PA 1327 1.664 51.894 29.309 1.00 0.00 C ATOM 54367 H7R PA 1327 0.837 51.337 28.863 1.00 0.00 H ATOM 54368 H7S PA 1327 2.469 51.160 29.244 1.00 0.00 H ATOM 54369 C16 PA 1327 1.933 53.166 28.480 1.00 0.00 C ATOM 54370 H6R PA 1327 2.768 53.705 28.933 1.00 0.00 H ATOM 54371 H6S PA 1327 1.121 53.895 28.428 1.00 0.00 H ATOM 54372 C15 PA 1327 2.093 52.812 26.994 1.00 0.00 C ATOM 54373 H5R PA 1327 1.089 52.656 26.593 1.00 0.00 H ATOM 54374 H5S PA 1327 2.649 51.873 26.945 1.00 0.00 H ATOM 54375 C14 PA 1327 2.832 53.874 26.189 1.00 0.00 C ATOM 54376 H4R PA 1327 3.810 53.930 26.671 1.00 0.00 H ATOM 54377 H4S PA 1327 2.260 54.803 26.245 1.00 0.00 H ATOM 54378 C13 PA 1327 3.053 53.512 24.684 1.00 0.00 C ATOM 54379 H3R PA 1327 3.618 54.319 24.213 1.00 0.00 H ATOM 54380 H3S PA 1327 2.152 53.431 24.071 1.00 0.00 H ATOM 54381 C12 PA 1327 3.825 52.227 24.343 1.00 0.00 C ATOM 54382 H2R PA 1327 3.189 51.451 24.775 1.00 0.00 H ATOM 54383 H2S PA 1327 4.829 52.285 24.767 1.00 0.00 H ATOM 54384 C11 PGR 1328 3.953 52.061 22.860 1.00 0.00 C ATOM 54385 O12 PGR 1328 2.984 52.114 22.206 1.00 0.00 O ATOM 54386 O11 PGR 1328 5.057 51.527 22.529 1.00 0.00 O ATOM 54387 C1 PGR 1328 5.230 51.004 21.149 1.00 0.00 C ATOM 54388 HR PGR 1328 4.280 50.512 20.924 1.00 0.00 H ATOM 54389 HS PGR 1328 6.077 50.315 21.123 1.00 0.00 H ATOM 54390 C2 PGR 1328 5.442 52.190 20.171 1.00 0.00 C ATOM 54391 HX PGR 1328 4.466 52.654 20.006 1.00 0.00 H ATOM 54392 C3 PGR 1328 5.942 51.641 18.817 1.00 0.00 C ATOM 54393 HA PGR 1328 5.367 50.765 18.503 1.00 0.00 H ATOM 54394 HB PGR 1328 7.023 51.494 18.872 1.00 0.00 H ATOM 54395 O31 PGR 1328 5.761 52.699 17.906 1.00 0.00 O ATOM 54396 P31 PGR 1328 6.198 52.498 16.349 1.00 0.00 P ATOM 54397 O32 PGR 1328 5.067 51.576 15.762 1.00 0.00 O ATOM 54398 C31 PGR 1328 3.696 52.010 15.633 1.00 0.00 C ATOM 54399 H1A PGR 1328 3.311 52.596 16.472 1.00 0.00 H ATOM 54400 H1B PGR 1328 3.176 51.058 15.495 1.00 0.00 H ATOM 54401 C32 PGR 1328 3.537 52.819 14.308 1.00 0.00 C ATOM 54402 H2A PGR 1328 4.253 52.522 13.537 1.00 0.00 H ATOM 54403 O35 PGR 1328 3.585 54.185 14.695 1.00 0.00 O ATOM 54404 HO5A PGR 1328 4.511 54.178 14.996 1.00 0.00 H ATOM 54405 C33 PGR 1328 2.130 52.669 13.733 1.00 0.00 C ATOM 54406 H3A PGR 1328 2.101 53.372 12.897 1.00 0.00 H ATOM 54407 H3B PGR 1328 1.924 51.670 13.340 1.00 0.00 H ATOM 54408 O33 PGR 1328 6.123 53.865 15.718 1.00 0.00 O ATOM 54409 O34 PGR 1328 7.449 51.725 16.134 1.00 0.00 O ATOM 54410 O21 PGR 1328 6.352 53.166 20.727 1.00 0.00 O ATOM 54411 C21 PGR 1328 7.572 52.694 21.103 1.00 0.00 C ATOM 54412 O22 PGR 1328 8.128 51.643 20.989 1.00 0.00 O ATOM 54413 O36 PGR 1328 1.116 52.974 14.659 1.00 0.00 O ATOM 54414 HO6A PGR 1328 1.458 53.791 15.063 1.00 0.00 H ATOM 54415 C12 OL 1329 8.212 53.799 21.861 1.00 0.00 C ATOM 54416 H2R OL 1329 9.276 53.562 21.924 1.00 0.00 H ATOM 54417 H2S OL 1329 7.949 54.707 21.313 1.00 0.00 H ATOM 54418 C13 OL 1329 7.777 54.068 23.368 1.00 0.00 C ATOM 54419 H3R OL 1329 6.715 54.301 23.271 1.00 0.00 H ATOM 54420 H3S OL 1329 8.005 53.165 23.937 1.00 0.00 H ATOM 54421 C14 OL 1329 8.588 55.214 23.983 1.00 0.00 C ATOM 54422 H4R OL 1329 9.646 54.956 23.906 1.00 0.00 H ATOM 54423 H4S OL 1329 8.347 56.067 23.347 1.00 0.00 H ATOM 54424 C15 OL 1329 8.215 55.529 25.379 1.00 0.00 C ATOM 54425 H5R OL 1329 7.136 55.651 25.489 1.00 0.00 H ATOM 54426 H5S OL 1329 8.421 54.633 25.968 1.00 0.00 H ATOM 54427 C16 OL 1329 9.018 56.683 25.953 1.00 0.00 C ATOM 54428 H6R OL 1329 8.773 56.714 27.016 1.00 0.00 H ATOM 54429 H6S OL 1329 10.099 56.551 25.877 1.00 0.00 H ATOM 54430 C17 OL 1329 8.677 58.091 25.441 1.00 0.00 C ATOM 54431 H7R OL 1329 9.081 58.306 24.449 1.00 0.00 H ATOM 54432 H7S OL 1329 7.633 58.024 25.128 1.00 0.00 H ATOM 54433 C18 OL 1329 8.780 59.280 26.387 1.00 0.00 C ATOM 54434 H8R OL 1329 8.639 60.231 25.869 1.00 0.00 H ATOM 54435 H8S OL 1329 8.013 59.195 27.159 1.00 0.00 H ATOM 54436 C19 OL 1329 10.147 59.317 26.999 1.00 0.00 C ATOM 54437 H9R OL 1329 10.894 59.172 26.224 1.00 0.00 H ATOM 54438 C110 OL 1329 10.564 59.142 28.278 1.00 0.00 C ATOM 54439 H10R OL 1329 11.588 58.886 28.540 1.00 0.00 H ATOM 54440 C111 OL 1329 9.665 59.346 29.442 1.00 0.00 C ATOM 54441 H11R OL 1329 10.184 59.876 30.244 1.00 0.00 H ATOM 54442 H11S OL 1329 8.749 59.884 29.189 1.00 0.00 H ATOM 54443 C112 OL 1329 9.288 57.950 29.943 1.00 0.00 C ATOM 54444 H12R OL 1329 8.437 57.412 29.520 1.00 0.00 H ATOM 54445 H12S OL 1329 10.076 57.237 29.691 1.00 0.00 H ATOM 54446 C113 OL 1329 9.001 57.835 31.451 1.00 0.00 C ATOM 54447 H13R OL 1329 9.911 58.237 31.903 1.00 0.00 H ATOM 54448 H13S OL 1329 8.231 58.606 31.532 1.00 0.00 H ATOM 54449 C114 OL 1329 8.676 56.482 32.027 1.00 0.00 C ATOM 54450 H14R OL 1329 7.707 56.131 31.668 1.00 0.00 H ATOM 54451 H14S OL 1329 9.402 55.843 31.519 1.00 0.00 H ATOM 54452 C115 OL 1329 8.747 56.510 33.564 1.00 0.00 C ATOM 54453 H15R OL 1329 8.155 57.397 33.800 1.00 0.00 H ATOM 54454 H15S OL 1329 8.161 55.728 34.050 1.00 0.00 H ATOM 54455 C116 OL 1329 10.131 56.674 34.176 1.00 0.00 C ATOM 54456 H16R OL 1329 10.629 55.709 34.058 1.00 0.00 H ATOM 54457 H16S OL 1329 10.683 57.479 33.686 1.00 0.00 H ATOM 54458 C117 OL 1329 10.097 57.152 35.610 1.00 0.00 C ATOM 54459 H17R OL 1329 10.113 58.244 35.626 1.00 0.00 H ATOM 54460 H17S OL 1329 9.181 56.835 36.112 1.00 0.00 H ATOM 54461 C118 OL 1329 11.224 56.648 36.579 1.00 0.00 C ATOM 54462 H18R OL 1329 12.167 57.160 36.378 1.00 0.00 H ATOM 54463 H18S OL 1329 11.534 55.602 36.543 1.00 0.00 H ATOM 54464 H18T OL 1329 10.822 56.814 37.581 1.00 0.00 H TER 54465 OL 1329 ATOM 54465 C116 PA 1330 51.447 92.699 41.677 1.00 0.00 C ATOM 54466 H16R PA 1330 51.207 93.752 41.520 1.00 0.00 H ATOM 54467 H16S PA 1330 52.327 92.641 42.321 1.00 0.00 H ATOM 54468 H16T PA 1330 50.647 92.112 42.133 1.00 0.00 H ATOM 54469 C115 PA 1330 51.962 92.241 40.281 1.00 0.00 C ATOM 54470 H15R PA 1330 52.716 92.859 39.789 1.00 0.00 H ATOM 54471 H15S PA 1330 51.033 92.274 39.709 1.00 0.00 H ATOM 54472 C114 PA 1330 52.556 90.881 40.208 1.00 0.00 C ATOM 54473 H14R PA 1330 53.555 91.012 40.629 1.00 0.00 H ATOM 54474 H14S PA 1330 52.893 90.491 39.245 1.00 0.00 H ATOM 54475 C113 PA 1330 51.888 89.734 40.970 1.00 0.00 C ATOM 54476 H13R PA 1330 50.800 89.781 40.894 1.00 0.00 H ATOM 54477 H13S PA 1330 52.055 89.944 42.028 1.00 0.00 H ATOM 54478 C112 PA 1330 52.553 88.355 40.620 1.00 0.00 C ATOM 54479 H12R PA 1330 53.582 88.445 40.974 1.00 0.00 H ATOM 54480 H12S PA 1330 52.634 88.116 39.558 1.00 0.00 H ATOM 54481 C111 PA 1330 51.946 87.222 41.411 1.00 0.00 C ATOM 54482 H11R PA 1330 50.874 87.226 41.204 1.00 0.00 H ATOM 54483 H11S PA 1330 52.150 87.466 42.456 1.00 0.00 H ATOM 54484 C110 PA 1330 52.535 85.875 40.945 1.00 0.00 C ATOM 54485 H10R PA 1330 52.577 85.261 41.846 1.00 0.00 H ATOM 54486 H10S PA 1330 53.569 86.077 40.660 1.00 0.00 H ATOM 54487 C19 PA 1330 51.764 85.247 39.777 1.00 0.00 C ATOM 54488 H9R PA 1330 51.680 86.002 38.993 1.00 0.00 H ATOM 54489 H9S PA 1330 50.841 84.867 40.219 1.00 0.00 H ATOM 54490 C18 PA 1330 52.478 84.081 39.133 1.00 0.00 C ATOM 54491 H8R PA 1330 52.860 83.421 39.914 1.00 0.00 H ATOM 54492 H8S PA 1330 53.371 84.365 38.572 1.00 0.00 H ATOM 54493 C17 PA 1330 51.474 83.315 38.317 1.00 0.00 C ATOM 54494 H7R PA 1330 50.459 83.355 38.718 1.00 0.00 H ATOM 54495 H7S PA 1330 51.792 82.277 38.435 1.00 0.00 H ATOM 54496 C16 PA 1330 51.528 83.680 36.771 1.00 0.00 C ATOM 54497 H6R PA 1330 52.557 83.728 36.408 1.00 0.00 H ATOM 54498 H6S PA 1330 51.105 84.686 36.729 1.00 0.00 H ATOM 54499 C15 PA 1330 50.791 82.639 35.871 1.00 0.00 C ATOM 54500 H5R PA 1330 49.981 82.237 36.483 1.00 0.00 H ATOM 54501 H5S PA 1330 51.463 81.814 35.627 1.00 0.00 H ATOM 54502 C14 PA 1330 50.184 83.180 34.586 1.00 0.00 C ATOM 54503 H4R PA 1330 49.448 83.931 34.880 1.00 0.00 H ATOM 54504 H4S PA 1330 49.652 82.415 34.016 1.00 0.00 H ATOM 54505 C13 PA 1330 51.105 83.962 33.635 1.00 0.00 C ATOM 54506 H3R PA 1330 52.046 83.429 33.480 1.00 0.00 H ATOM 54507 H3S PA 1330 51.204 84.903 34.181 1.00 0.00 H ATOM 54508 C12 PA 1330 50.496 84.312 32.211 1.00 0.00 C ATOM 54509 H2R PA 1330 50.913 85.290 31.959 1.00 0.00 H ATOM 54510 H2S PA 1330 49.433 84.491 32.387 1.00 0.00 H ATOM 54511 C11 PC 1331 50.657 83.166 31.251 1.00 0.00 C ATOM 54512 O12 PC 1331 51.314 83.314 30.272 1.00 0.00 O ATOM 54513 O11 PC 1331 49.940 82.150 31.607 1.00 0.00 O ATOM 54514 C1 PC 1331 49.836 81.039 30.714 1.00 0.00 C ATOM 54515 HR PC 1331 49.630 81.485 29.738 1.00 0.00 H ATOM 54516 HS PC 1331 49.025 80.386 31.046 1.00 0.00 H ATOM 54517 C2 PC 1331 51.161 80.175 30.631 1.00 0.00 C ATOM 54518 HX PC 1331 51.876 80.661 31.299 1.00 0.00 H ATOM 54519 C3 PC 1331 51.688 79.918 29.178 1.00 0.00 C ATOM 54520 HA PC 1331 52.556 79.254 29.155 1.00 0.00 H ATOM 54521 HB PC 1331 51.886 80.932 28.820 1.00 0.00 H ATOM 54522 O31 PC 1331 50.625 79.419 28.387 1.00 0.00 O ATOM 54523 P31 PC 1331 50.766 79.363 26.763 1.00 0.00 P ATOM 54524 O32 PC 1331 51.999 78.436 26.482 1.00 0.00 O ATOM 54525 C31 PC 1331 51.873 77.129 26.959 1.00 0.00 C ATOM 54526 H1A PC 1331 50.991 76.589 26.605 1.00 0.00 H ATOM 54527 H1B PC 1331 51.749 77.131 28.045 1.00 0.00 H ATOM 54528 C32 PC 1331 53.150 76.321 26.588 1.00 0.00 C ATOM 54529 H2A PC 1331 53.061 75.284 26.916 1.00 0.00 H ATOM 54530 H2B PC 1331 53.995 76.625 27.208 1.00 0.00 H ATOM 54531 N31 PC 1331 53.689 76.354 25.201 1.00 0.00 N ATOM 54532 C33 PC 1331 54.360 77.659 24.852 1.00 0.00 C ATOM 54533 H3A PC 1331 53.626 78.402 24.538 1.00 0.00 H ATOM 54534 H3B PC 1331 55.192 77.546 24.156 1.00 0.00 H ATOM 54535 H3C PC 1331 54.757 78.055 25.788 1.00 0.00 H ATOM 54536 C34 PC 1331 54.774 75.316 25.106 1.00 0.00 C ATOM 54537 H4A PC 1331 55.492 75.479 25.911 1.00 0.00 H ATOM 54538 H4B PC 1331 55.244 75.388 24.124 1.00 0.00 H ATOM 54539 H4C PC 1331 54.357 74.319 25.256 1.00 0.00 H ATOM 54540 C35 PC 1331 52.685 76.065 24.139 1.00 0.00 C ATOM 54541 H5A PC 1331 53.202 75.891 23.194 1.00 0.00 H ATOM 54542 H5B PC 1331 51.861 76.768 24.012 1.00 0.00 H ATOM 54543 H5C PC 1331 52.274 75.092 24.414 1.00 0.00 H ATOM 54544 O33 PC 1331 49.502 78.643 26.386 1.00 0.00 O ATOM 54545 O34 PC 1331 51.022 80.727 26.313 1.00 0.00 O ATOM 54546 O21 PC 1331 50.753 78.873 31.320 1.00 0.00 O ATOM 54547 C21 PC 1331 51.716 77.991 31.595 1.00 0.00 C ATOM 54548 O22 PC 1331 52.874 78.167 31.222 1.00 0.00 O ATOM 54549 C12 OL 1332 51.232 76.739 32.296 1.00 0.00 C ATOM 54550 H2R OL 1332 50.262 76.968 32.742 1.00 0.00 H ATOM 54551 H2S OL 1332 51.060 75.955 31.555 1.00 0.00 H ATOM 54552 C13 OL 1332 52.256 76.221 33.325 1.00 0.00 C ATOM 54553 H3R OL 1332 51.906 75.266 33.722 1.00 0.00 H ATOM 54554 H3S OL 1332 53.132 75.984 32.716 1.00 0.00 H ATOM 54555 C14 OL 1332 52.723 77.287 34.355 1.00 0.00 C ATOM 54556 H4R OL 1332 53.390 76.693 34.983 1.00 0.00 H ATOM 54557 H4S OL 1332 53.371 78.035 33.892 1.00 0.00 H ATOM 54558 C15 OL 1332 51.574 77.987 35.083 1.00 0.00 C ATOM 54559 H5R OL 1332 51.986 78.604 35.885 1.00 0.00 H ATOM 54560 H5S OL 1332 51.056 78.744 34.490 1.00 0.00 H ATOM 54561 C16 OL 1332 50.401 77.148 35.569 1.00 0.00 C ATOM 54562 H6R OL 1332 49.674 76.885 34.798 1.00 0.00 H ATOM 54563 H6S OL 1332 50.738 76.272 36.128 1.00 0.00 H ATOM 54564 C17 OL 1332 49.548 77.929 36.548 1.00 0.00 C ATOM 54565 H7R OL 1332 50.084 78.464 37.335 1.00 0.00 H ATOM 54566 H7S OL 1332 49.088 78.716 35.947 1.00 0.00 H ATOM 54567 C18 OL 1332 48.478 77.137 37.345 1.00 0.00 C ATOM 54568 H8R OL 1332 47.725 76.783 36.637 1.00 0.00 H ATOM 54569 H8S OL 1332 48.955 76.263 37.794 1.00 0.00 H ATOM 54570 C19 OL 1332 47.780 78.067 38.310 1.00 0.00 C ATOM 54571 H9R OL 1332 47.523 79.023 37.860 1.00 0.00 H ATOM 54572 C110 OL 1332 47.486 77.770 39.583 1.00 0.00 C ATOM 54573 H10R OL 1332 46.888 78.431 40.205 1.00 0.00 H ATOM 54574 C111 OL 1332 47.706 76.447 40.202 1.00 0.00 C ATOM 54575 H11R OL 1332 48.512 75.910 39.698 1.00 0.00 H ATOM 54576 H11S OL 1332 47.949 76.708 41.234 1.00 0.00 H ATOM 54577 C112 OL 1332 46.422 75.690 40.199 1.00 0.00 C ATOM 54578 H12R OL 1332 45.760 76.323 40.795 1.00 0.00 H ATOM 54579 H12S OL 1332 45.878 75.579 39.259 1.00 0.00 H ATOM 54580 C113 OL 1332 46.635 74.328 40.723 1.00 0.00 C ATOM 54581 H13R OL 1332 47.295 73.633 40.201 1.00 0.00 H ATOM 54582 H13S OL 1332 47.036 74.431 41.733 1.00 0.00 H ATOM 54583 C114 OL 1332 45.313 73.528 40.813 1.00 0.00 C ATOM 54584 H14R OL 1332 44.661 73.983 41.562 1.00 0.00 H ATOM 54585 H14S OL 1332 44.726 73.606 39.895 1.00 0.00 H ATOM 54586 C115 OL 1332 45.433 72.041 41.150 1.00 0.00 C ATOM 54587 H15R OL 1332 46.060 71.618 40.363 1.00 0.00 H ATOM 54588 H15S OL 1332 46.003 71.995 42.081 1.00 0.00 H ATOM 54589 C116 OL 1332 44.048 71.283 41.220 1.00 0.00 C ATOM 54590 H16R OL 1332 44.300 70.281 41.574 1.00 0.00 H ATOM 54591 H16S OL 1332 43.504 71.727 42.057 1.00 0.00 H ATOM 54592 C117 OL 1332 43.335 71.137 39.917 1.00 0.00 C ATOM 54593 H17R OL 1332 43.042 72.164 39.692 1.00 0.00 H ATOM 54594 H17S OL 1332 43.953 70.622 39.178 1.00 0.00 H ATOM 54595 C118 OL 1332 42.010 70.292 39.988 1.00 0.00 C ATOM 54596 H18R OL 1332 41.196 70.747 40.556 1.00 0.00 H ATOM 54597 H18S OL 1332 42.317 69.301 40.327 1.00 0.00 H ATOM 54598 H18T OL 1332 41.682 70.122 38.960 1.00 0.00 H TER 54599 OL 1332 ATOM 54599 C116 PA 1333 115.975 5.678 40.802 1.00 0.00 C ATOM 54600 H16R PA 1333 115.766 6.471 41.523 1.00 0.00 H ATOM 54601 H16S PA 1333 116.962 5.910 40.396 1.00 0.00 H ATOM 54602 H16T PA 1333 116.113 4.705 41.279 1.00 0.00 H ATOM 54603 C115 PA 1333 114.929 5.556 39.666 1.00 0.00 C ATOM 54604 H15R PA 1333 113.915 5.826 39.968 1.00 0.00 H ATOM 54605 H15S PA 1333 114.926 4.478 39.495 1.00 0.00 H ATOM 54606 C114 PA 1333 115.204 6.435 38.416 1.00 0.00 C ATOM 54607 H14R PA 1333 116.270 6.289 38.232 1.00 0.00 H ATOM 54608 H14S PA 1333 114.973 7.445 38.761 1.00 0.00 H ATOM 54609 C113 PA 1333 114.388 6.058 37.253 1.00 0.00 C ATOM 54610 H13R PA 1333 113.366 5.922 37.612 1.00 0.00 H ATOM 54611 H13S PA 1333 114.714 5.088 36.871 1.00 0.00 H ATOM 54612 C112 PA 1333 114.314 7.118 36.129 1.00 0.00 C ATOM 54613 H12R PA 1333 115.292 7.278 35.670 1.00 0.00 H ATOM 54614 H12S PA 1333 114.042 8.078 36.573 1.00 0.00 H ATOM 54615 C111 PA 1333 113.492 6.654 34.964 1.00 0.00 C ATOM 54616 H11R PA 1333 112.459 6.675 35.316 1.00 0.00 H ATOM 54617 H11S PA 1333 113.894 5.669 34.716 1.00 0.00 H ATOM 54618 C110 PA 1333 113.572 7.457 33.649 1.00 0.00 C ATOM 54619 H10R PA 1333 112.931 7.027 32.877 1.00 0.00 H ATOM 54620 H10S PA 1333 114.601 7.445 33.283 1.00 0.00 H ATOM 54621 C19 PA 1333 113.330 8.996 33.762 1.00 0.00 C ATOM 54622 H9R PA 1333 113.931 9.426 34.565 1.00 0.00 H ATOM 54623 H9S PA 1333 112.356 9.319 34.137 1.00 0.00 H ATOM 54624 C18 PA 1333 113.601 9.815 32.491 1.00 0.00 C ATOM 54625 H8R PA 1333 114.550 9.527 32.034 1.00 0.00 H ATOM 54626 H8S PA 1333 113.613 10.904 32.557 1.00 0.00 H ATOM 54627 C17 PA 1333 112.526 9.434 31.421 1.00 0.00 C ATOM 54628 H7R PA 1333 111.630 9.041 31.907 1.00 0.00 H ATOM 54629 H7S PA 1333 112.975 8.564 30.936 1.00 0.00 H ATOM 54630 C16 PA 1333 112.220 10.451 30.377 1.00 0.00 C ATOM 54631 H6R PA 1333 111.779 11.348 30.816 1.00 0.00 H ATOM 54632 H6S PA 1333 111.428 10.032 29.753 1.00 0.00 H ATOM 54633 C15 PA 1333 113.316 10.815 29.380 1.00 0.00 C ATOM 54634 H5R PA 1333 113.780 9.941 28.917 1.00 0.00 H ATOM 54635 H5S PA 1333 114.059 11.447 29.871 1.00 0.00 H ATOM 54636 C14 PA 1333 112.713 11.719 28.248 1.00 0.00 C ATOM 54637 H4R PA 1333 112.192 12.569 28.693 1.00 0.00 H ATOM 54638 H4S PA 1333 111.825 11.157 27.952 1.00 0.00 H ATOM 54639 C13 PA 1333 113.579 12.159 27.064 1.00 0.00 C ATOM 54640 H3R PA 1333 114.077 11.242 26.742 1.00 0.00 H ATOM 54641 H3S PA 1333 114.360 12.771 27.520 1.00 0.00 H ATOM 54642 C12 PA 1333 112.798 12.632 25.713 1.00 0.00 C ATOM 54643 H2R PA 1333 111.855 13.104 25.994 1.00 0.00 H ATOM 54644 H2S PA 1333 112.403 11.745 25.213 1.00 0.00 H ATOM 54645 C11 PGR 1334 113.636 13.519 24.876 1.00 0.00 C ATOM 54646 O12 PGR 1334 114.779 13.281 24.559 1.00 0.00 O ATOM 54647 O11 PGR 1334 113.008 14.610 24.509 1.00 0.00 O ATOM 54648 C1 PGR 1334 113.423 15.298 23.227 1.00 0.00 C ATOM 54649 HR PGR 1334 114.471 15.117 22.973 1.00 0.00 H ATOM 54650 HS PGR 1334 113.320 16.369 23.418 1.00 0.00 H ATOM 54651 C2 PGR 1334 112.470 14.965 22.019 1.00 0.00 C ATOM 54652 HX PGR 1334 112.461 13.920 21.701 1.00 0.00 H ATOM 54653 C3 PGR 1334 112.807 15.865 20.799 1.00 0.00 C ATOM 54654 HA PGR 1334 113.831 15.637 20.491 1.00 0.00 H ATOM 54655 HB PGR 1334 112.677 16.899 21.128 1.00 0.00 H ATOM 54656 O31 PGR 1334 111.953 15.521 19.761 1.00 0.00 O ATOM 54657 P31 PGR 1334 112.262 16.105 18.251 1.00 0.00 P ATOM 54658 O32 PGR 1334 113.589 15.475 17.816 1.00 0.00 O ATOM 54659 C31 PGR 1334 113.648 14.305 17.015 1.00 0.00 C ATOM 54660 H1A PGR 1334 113.465 14.583 15.974 1.00 0.00 H ATOM 54661 H1B PGR 1334 112.861 13.634 17.370 1.00 0.00 H ATOM 54662 C32 PGR 1334 114.884 13.509 17.211 1.00 0.00 C ATOM 54663 H2A PGR 1334 115.093 13.597 18.280 1.00 0.00 H ATOM 54664 O35 PGR 1334 115.920 14.182 16.437 1.00 0.00 O ATOM 54665 HO5A PGR 1334 115.796 15.108 16.713 1.00 0.00 H ATOM 54666 C33 PGR 1334 114.820 12.018 16.790 1.00 0.00 C ATOM 54667 H3A PGR 1334 113.953 11.473 17.174 1.00 0.00 H ATOM 54668 H3B PGR 1334 114.709 12.058 15.704 1.00 0.00 H ATOM 54669 O33 PGR 1334 111.104 15.651 17.361 1.00 0.00 O ATOM 54670 O34 PGR 1334 112.596 17.533 18.389 1.00 0.00 O ATOM 54671 O21 PGR 1334 111.107 15.497 22.456 1.00 0.00 O ATOM 54672 C21 PGR 1334 110.363 14.748 23.301 1.00 0.00 C ATOM 54673 O22 PGR 1334 110.642 13.564 23.539 1.00 0.00 O ATOM 54674 O36 PGR 1334 115.964 11.256 17.104 1.00 0.00 O ATOM 54675 HO6A PGR 1334 116.096 11.114 18.058 1.00 0.00 H ATOM 54676 C12 OL 1335 109.304 15.540 23.921 1.00 0.00 C ATOM 54677 H2R OL 1335 109.040 16.325 23.210 1.00 0.00 H ATOM 54678 H2S OL 1335 108.436 14.889 24.043 1.00 0.00 H ATOM 54679 C13 OL 1335 109.801 16.179 25.200 1.00 0.00 C ATOM 54680 H3R OL 1335 110.140 15.490 25.976 1.00 0.00 H ATOM 54681 H3S OL 1335 110.810 16.577 25.076 1.00 0.00 H ATOM 54682 C14 OL 1335 108.785 17.164 25.814 1.00 0.00 C ATOM 54683 H4R OL 1335 108.468 17.874 25.047 1.00 0.00 H ATOM 54684 H4S OL 1335 107.828 16.746 26.134 1.00 0.00 H ATOM 54685 C15 OL 1335 109.291 17.950 26.974 1.00 0.00 C ATOM 54686 H5R OL 1335 110.259 18.407 26.758 1.00 0.00 H ATOM 54687 H5S OL 1335 108.672 18.847 27.049 1.00 0.00 H ATOM 54688 C16 OL 1335 109.361 17.130 28.288 1.00 0.00 C ATOM 54689 H6R OL 1335 108.339 16.888 28.589 1.00 0.00 H ATOM 54690 H6S OL 1335 109.854 16.170 28.117 1.00 0.00 H ATOM 54691 C17 OL 1335 110.067 17.898 29.388 1.00 0.00 C ATOM 54692 H7R OL 1335 111.105 18.093 29.109 1.00 0.00 H ATOM 54693 H7S OL 1335 109.752 18.943 29.362 1.00 0.00 H ATOM 54694 C18 OL 1335 109.949 17.400 30.791 1.00 0.00 C ATOM 54695 H8R OL 1335 108.906 17.467 31.109 1.00 0.00 H ATOM 54696 H8S OL 1335 110.182 16.335 30.854 1.00 0.00 H ATOM 54697 C19 OL 1335 110.863 18.007 31.882 1.00 0.00 C ATOM 54698 H9R OL 1335 111.817 18.378 31.518 1.00 0.00 H ATOM 54699 C110 OL 1335 110.659 18.219 33.213 1.00 0.00 C ATOM 54700 H10R OL 1335 111.454 18.647 33.818 1.00 0.00 H ATOM 54701 C111 OL 1335 109.409 17.924 34.030 1.00 0.00 C ATOM 54702 H11R OL 1335 108.506 17.938 33.416 1.00 0.00 H ATOM 54703 H11S OL 1335 109.370 16.958 34.538 1.00 0.00 H ATOM 54704 C112 OL 1335 109.166 18.898 35.186 1.00 0.00 C ATOM 54705 H12R OL 1335 109.578 19.851 34.848 1.00 0.00 H ATOM 54706 H12S OL 1335 108.101 19.114 35.297 1.00 0.00 H ATOM 54707 C113 OL 1335 109.670 18.447 36.532 1.00 0.00 C ATOM 54708 H13R OL 1335 109.172 17.519 36.819 1.00 0.00 H ATOM 54709 H13S OL 1335 110.708 18.282 36.234 1.00 0.00 H ATOM 54710 C114 OL 1335 109.604 19.489 37.684 1.00 0.00 C ATOM 54711 H14R OL 1335 110.305 20.313 37.531 1.00 0.00 H ATOM 54712 H14S OL 1335 108.600 19.918 37.647 1.00 0.00 H ATOM 54713 C115 OL 1335 110.018 18.887 39.090 1.00 0.00 C ATOM 54714 H15R OL 1335 109.187 18.259 39.419 1.00 0.00 H ATOM 54715 H15S OL 1335 110.926 18.282 39.045 1.00 0.00 H ATOM 54716 C116 OL 1335 110.403 19.931 40.122 1.00 0.00 C ATOM 54717 H16R OL 1335 111.383 20.364 39.912 1.00 0.00 H ATOM 54718 H16S OL 1335 109.717 20.768 39.976 1.00 0.00 H ATOM 54719 C117 OL 1335 110.386 19.205 41.471 1.00 0.00 C ATOM 54720 H17R OL 1335 109.510 18.555 41.506 1.00 0.00 H ATOM 54721 H17S OL 1335 111.322 18.675 41.658 1.00 0.00 H ATOM 54722 C118 OL 1335 110.255 20.070 42.699 1.00 0.00 C ATOM 54723 H18R OL 1335 110.042 19.494 43.602 1.00 0.00 H ATOM 54724 H18S OL 1335 109.531 20.879 42.581 1.00 0.00 H ATOM 54725 H18T OL 1335 111.191 20.559 42.979 1.00 0.00 H TER 54726 OL 1335 ATOM 54726 C116 PA 1336 50.990 85.467 47.906 1.00 0.00 C ATOM 54727 H16R PA 1336 50.032 85.927 48.158 1.00 0.00 H ATOM 54728 H16S PA 1336 51.729 86.259 47.767 1.00 0.00 H ATOM 54729 H16T PA 1336 51.480 84.987 48.757 1.00 0.00 H ATOM 54730 C115 PA 1336 50.888 84.416 46.820 1.00 0.00 C ATOM 54731 H15R PA 1336 50.688 83.430 47.245 1.00 0.00 H ATOM 54732 H15S PA 1336 51.850 84.477 46.307 1.00 0.00 H ATOM 54733 C114 PA 1336 49.813 84.700 45.704 1.00 0.00 C ATOM 54734 H14R PA 1336 49.832 85.753 45.414 1.00 0.00 H ATOM 54735 H14S PA 1336 48.820 84.554 46.133 1.00 0.00 H ATOM 54736 C113 PA 1336 49.963 83.895 44.379 1.00 0.00 C ATOM 54737 H13R PA 1336 50.313 82.879 44.569 1.00 0.00 H ATOM 54738 H13S PA 1336 50.854 84.358 43.950 1.00 0.00 H ATOM 54739 C112 PA 1336 48.745 84.075 43.462 1.00 0.00 C ATOM 54740 H12R PA 1336 48.756 85.141 43.222 1.00 0.00 H ATOM 54741 H12S PA 1336 47.879 83.770 44.054 1.00 0.00 H ATOM 54742 C111 PA 1336 48.658 83.283 42.173 1.00 0.00 C ATOM 54743 H11R PA 1336 48.650 82.222 42.432 1.00 0.00 H ATOM 54744 H11S PA 1336 49.567 83.396 41.578 1.00 0.00 H ATOM 54745 C110 PA 1336 47.431 83.503 41.353 1.00 0.00 C ATOM 54746 H10R PA 1336 47.046 84.525 41.349 1.00 0.00 H ATOM 54747 H10S PA 1336 46.594 82.978 41.817 1.00 0.00 H ATOM 54748 C19 PA 1336 47.621 82.980 39.910 1.00 0.00 C ATOM 54749 H9R PA 1336 47.942 81.936 39.937 1.00 0.00 H ATOM 54750 H9S PA 1336 48.394 83.506 39.345 1.00 0.00 H ATOM 54751 C18 PA 1336 46.379 83.179 39.074 1.00 0.00 C ATOM 54752 H8R PA 1336 46.159 84.245 39.167 1.00 0.00 H ATOM 54753 H8S PA 1336 45.540 82.611 39.481 1.00 0.00 H ATOM 54754 C17 PA 1336 46.673 82.801 37.706 1.00 0.00 C ATOM 54755 H7R PA 1336 47.255 81.885 37.592 1.00 0.00 H ATOM 54756 H7S PA 1336 47.275 83.600 37.269 1.00 0.00 H ATOM 54757 C16 PA 1336 45.279 82.609 36.943 1.00 0.00 C ATOM 54758 H6R PA 1336 44.536 83.396 37.082 1.00 0.00 H ATOM 54759 H6S PA 1336 44.846 81.681 37.323 1.00 0.00 H ATOM 54760 C15 PA 1336 45.556 82.383 35.487 1.00 0.00 C ATOM 54761 H5R PA 1336 45.927 83.302 35.029 1.00 0.00 H ATOM 54762 H5S PA 1336 44.576 82.278 35.017 1.00 0.00 H ATOM 54763 C14 PA 1336 46.537 81.306 35.134 1.00 0.00 C ATOM 54764 H4R PA 1336 46.267 80.337 35.559 1.00 0.00 H ATOM 54765 H4S PA 1336 47.558 81.652 35.305 1.00 0.00 H ATOM 54766 C13 PA 1336 46.502 81.031 33.612 1.00 0.00 C ATOM 54767 H3R PA 1336 46.766 81.973 33.125 1.00 0.00 H ATOM 54768 H3S PA 1336 45.493 80.835 33.243 1.00 0.00 H ATOM 54769 C12 PA 1336 47.262 79.740 33.132 1.00 0.00 C ATOM 54770 H2R PA 1336 47.122 78.966 33.889 1.00 0.00 H ATOM 54771 H2S PA 1336 48.341 79.860 33.015 1.00 0.00 H ATOM 54772 C11 PGR 1337 46.693 79.158 31.886 1.00 0.00 C ATOM 54773 O12 PGR 1337 45.601 79.391 31.377 1.00 0.00 O ATOM 54774 O11 PGR 1337 47.577 78.254 31.319 1.00 0.00 O ATOM 54775 C1 PGR 1337 47.240 77.562 30.013 1.00 0.00 C ATOM 54776 HR PGR 1337 46.868 78.315 29.314 1.00 0.00 H ATOM 54777 HS PGR 1337 46.437 76.856 30.237 1.00 0.00 H ATOM 54778 C2 PGR 1337 48.544 76.802 29.400 1.00 0.00 C ATOM 54779 HX PGR 1337 49.374 77.509 29.315 1.00 0.00 H ATOM 54780 C3 PGR 1337 48.269 76.121 28.002 1.00 0.00 C ATOM 54781 HA PGR 1337 48.302 76.925 27.262 1.00 0.00 H ATOM 54782 HB PGR 1337 47.231 75.786 27.930 1.00 0.00 H ATOM 54783 O31 PGR 1337 49.199 74.987 27.680 1.00 0.00 O ATOM 54784 P31 PGR 1337 49.129 74.251 26.247 1.00 0.00 P ATOM 54785 O32 PGR 1337 47.579 73.790 26.033 1.00 0.00 O ATOM 54786 C31 PGR 1337 46.817 72.888 26.842 1.00 0.00 C ATOM 54787 H1A PGR 1337 46.636 73.311 27.833 1.00 0.00 H ATOM 54788 H1B PGR 1337 47.350 71.947 27.001 1.00 0.00 H ATOM 54789 C32 PGR 1337 45.426 72.585 26.355 1.00 0.00 C ATOM 54790 H2A PGR 1337 45.049 72.021 27.212 1.00 0.00 H ATOM 54791 O35 PGR 1337 45.516 71.839 25.144 1.00 0.00 O ATOM 54792 HO5A PGR 1337 46.145 72.340 24.596 1.00 0.00 H ATOM 54793 C33 PGR 1337 44.747 73.974 26.256 1.00 0.00 C ATOM 54794 H3A PGR 1337 43.703 73.775 26.000 1.00 0.00 H ATOM 54795 H3B PGR 1337 44.692 74.556 27.180 1.00 0.00 H ATOM 54796 O33 PGR 1337 49.463 75.342 25.316 1.00 0.00 O ATOM 54797 O34 PGR 1337 50.032 73.027 26.306 1.00 0.00 O ATOM 54798 O21 PGR 1337 48.914 75.810 30.400 1.00 0.00 O ATOM 54799 C21 PGR 1337 48.120 74.812 30.711 1.00 0.00 C ATOM 54800 O22 PGR 1337 47.018 74.630 30.269 1.00 0.00 O ATOM 54801 O36 PGR 1337 45.261 74.784 25.213 1.00 0.00 O ATOM 54802 HO6A PGR 1337 46.217 74.635 25.102 1.00 0.00 H ATOM 54803 C12 OL 1338 48.750 73.993 31.823 1.00 0.00 C ATOM 54804 H2R OL 1338 48.578 72.979 31.457 1.00 0.00 H ATOM 54805 H2S OL 1338 49.830 74.157 31.810 1.00 0.00 H ATOM 54806 C13 OL 1338 48.219 74.305 33.194 1.00 0.00 C ATOM 54807 H3R OL 1338 48.192 75.392 33.303 1.00 0.00 H ATOM 54808 H3S OL 1338 47.161 74.037 33.244 1.00 0.00 H ATOM 54809 C14 OL 1338 49.001 73.540 34.288 1.00 0.00 C ATOM 54810 H4R OL 1338 50.063 73.784 34.221 1.00 0.00 H ATOM 54811 H4S OL 1338 48.734 74.032 35.226 1.00 0.00 H ATOM 54812 C15 OL 1338 48.726 72.105 34.320 1.00 0.00 C ATOM 54813 H5R OL 1338 47.739 71.975 33.872 1.00 0.00 H ATOM 54814 H5S OL 1338 49.307 71.706 33.486 1.00 0.00 H ATOM 54815 C16 OL 1338 49.029 71.450 35.645 1.00 0.00 C ATOM 54816 H6R OL 1338 48.344 71.896 36.369 1.00 0.00 H ATOM 54817 H6S OL 1338 48.737 70.398 35.639 1.00 0.00 H ATOM 54818 C17 OL 1338 50.491 71.395 36.022 1.00 0.00 C ATOM 54819 H7R OL 1338 51.113 70.929 35.255 1.00 0.00 H ATOM 54820 H7S OL 1338 51.003 72.360 36.022 1.00 0.00 H ATOM 54821 C18 OL 1338 50.760 70.644 37.313 1.00 0.00 C ATOM 54822 H8R OL 1338 49.932 70.627 38.025 1.00 0.00 H ATOM 54823 H8S OL 1338 51.008 69.636 36.973 1.00 0.00 H ATOM 54824 C19 OL 1338 51.910 71.262 38.042 1.00 0.00 C ATOM 54825 H9R OL 1338 52.843 71.174 37.492 1.00 0.00 H ATOM 54826 C110 OL 1338 51.902 72.008 39.098 1.00 0.00 C ATOM 54827 H10R OL 1338 52.837 72.290 39.575 1.00 0.00 H ATOM 54828 C111 OL 1338 50.662 72.471 39.817 1.00 0.00 C ATOM 54829 H11R OL 1338 50.859 73.522 40.039 1.00 0.00 H ATOM 54830 H11S OL 1338 49.739 72.407 39.237 1.00 0.00 H ATOM 54831 C112 OL 1338 50.415 71.831 41.162 1.00 0.00 C ATOM 54832 H12R OL 1338 50.150 70.778 41.053 1.00 0.00 H ATOM 54833 H12S OL 1338 51.349 71.874 41.725 1.00 0.00 H ATOM 54834 C113 OL 1338 49.238 72.425 41.998 1.00 0.00 C ATOM 54835 H13R OL 1338 49.439 73.499 42.007 1.00 0.00 H ATOM 54836 H13S OL 1338 48.239 72.341 41.566 1.00 0.00 H ATOM 54837 C114 OL 1338 49.203 71.978 43.433 1.00 0.00 C ATOM 54838 H14R OL 1338 50.019 72.434 43.998 1.00 0.00 H ATOM 54839 H14S OL 1338 48.339 72.503 43.847 1.00 0.00 H ATOM 54840 C115 OL 1338 49.211 70.463 43.635 1.00 0.00 C ATOM 54841 H15R OL 1338 48.939 69.859 42.767 1.00 0.00 H ATOM 54842 H15S OL 1338 50.226 70.205 43.944 1.00 0.00 H ATOM 54843 C116 OL 1338 48.187 70.058 44.749 1.00 0.00 C ATOM 54844 H16R OL 1338 47.190 70.377 44.439 1.00 0.00 H ATOM 54845 H16S OL 1338 48.212 68.967 44.777 1.00 0.00 H ATOM 54846 C117 OL 1338 48.484 70.664 46.187 1.00 0.00 C ATOM 54847 H17R OL 1338 49.571 70.672 46.287 1.00 0.00 H ATOM 54848 H17S OL 1338 47.998 71.642 46.164 1.00 0.00 H ATOM 54849 C118 OL 1338 47.864 69.868 47.275 1.00 0.00 C ATOM 54850 H18R OL 1338 46.824 70.170 47.135 1.00 0.00 H ATOM 54851 H18S OL 1338 48.266 70.202 48.233 1.00 0.00 H ATOM 54852 H18T OL 1338 48.018 68.787 47.275 1.00 0.00 H TER 54853 OL 1338 ATOM 54853 C116 PA 1339 89.907 86.180 41.384 1.00 0.00 C ATOM 54854 H16R PA 1339 89.058 85.497 41.448 1.00 0.00 H ATOM 54855 H16S PA 1339 89.522 87.198 41.303 1.00 0.00 H ATOM 54856 H16T PA 1339 90.451 86.061 42.324 1.00 0.00 H ATOM 54857 C115 PA 1339 90.798 85.594 40.356 1.00 0.00 C ATOM 54858 H15R PA 1339 91.609 86.324 40.313 1.00 0.00 H ATOM 54859 H15S PA 1339 90.348 85.470 39.369 1.00 0.00 H ATOM 54860 C114 PA 1339 91.422 84.228 40.766 1.00 0.00 C ATOM 54861 H14R PA 1339 91.893 84.271 41.751 1.00 0.00 H ATOM 54862 H14S PA 1339 92.291 84.074 40.123 1.00 0.00 H ATOM 54863 C113 PA 1339 90.374 83.185 40.771 1.00 0.00 C ATOM 54864 H13R PA 1339 89.752 83.429 39.907 1.00 0.00 H ATOM 54865 H13S PA 1339 89.669 83.322 41.594 1.00 0.00 H ATOM 54866 C112 PA 1339 90.897 81.772 40.845 1.00 0.00 C ATOM 54867 H12R PA 1339 90.123 81.054 41.125 1.00 0.00 H ATOM 54868 H12S PA 1339 91.626 81.835 41.657 1.00 0.00 H ATOM 54869 C111 PA 1339 91.602 81.145 39.526 1.00 0.00 C ATOM 54870 H11R PA 1339 92.126 80.249 39.867 1.00 0.00 H ATOM 54871 H11S PA 1339 92.361 81.806 39.102 1.00 0.00 H ATOM 54872 C110 PA 1339 90.589 80.812 38.410 1.00 0.00 C ATOM 54873 H10R PA 1339 90.146 81.682 37.921 1.00 0.00 H ATOM 54874 H10S PA 1339 89.682 80.384 38.842 1.00 0.00 H ATOM 54875 C19 PA 1339 91.086 79.808 37.382 1.00 0.00 C ATOM 54876 H9R PA 1339 90.248 79.288 36.914 1.00 0.00 H ATOM 54877 H9S PA 1339 91.559 78.983 37.919 1.00 0.00 H ATOM 54878 C18 PA 1339 92.144 80.505 36.463 1.00 0.00 C ATOM 54879 H8R PA 1339 92.616 79.657 35.962 1.00 0.00 H ATOM 54880 H8S PA 1339 92.977 81.049 36.912 1.00 0.00 H ATOM 54881 C17 PA 1339 91.479 81.392 35.322 1.00 0.00 C ATOM 54882 H7R PA 1339 91.211 82.407 35.624 1.00 0.00 H ATOM 54883 H7S PA 1339 90.625 80.871 34.885 1.00 0.00 H ATOM 54884 C16 PA 1339 92.428 81.525 34.081 1.00 0.00 C ATOM 54885 H6R PA 1339 92.745 80.520 33.794 1.00 0.00 H ATOM 54886 H6S PA 1339 93.350 81.993 34.431 1.00 0.00 H ATOM 54887 C15 PA 1339 91.766 82.184 32.910 1.00 0.00 C ATOM 54888 H5R PA 1339 92.492 82.459 32.142 1.00 0.00 H ATOM 54889 H5S PA 1339 91.359 83.150 33.215 1.00 0.00 H ATOM 54890 C14 PA 1339 90.604 81.411 32.251 1.00 0.00 C ATOM 54891 H4R PA 1339 89.855 81.122 32.992 1.00 0.00 H ATOM 54892 H4S PA 1339 90.972 80.476 31.824 1.00 0.00 H ATOM 54893 C13 PA 1339 89.924 82.166 31.086 1.00 0.00 C ATOM 54894 H3R PA 1339 89.409 83.013 31.544 1.00 0.00 H ATOM 54895 H3S PA 1339 89.095 81.536 30.757 1.00 0.00 H ATOM 54896 C12 PA 1339 90.918 82.585 29.887 1.00 0.00 C ATOM 54897 H2R PA 1339 91.179 81.604 29.486 1.00 0.00 H ATOM 54898 H2S PA 1339 91.862 83.073 30.141 1.00 0.00 H ATOM 54899 C11 PC 1340 90.220 83.361 28.813 1.00 0.00 C ATOM 54900 O12 PC 1340 89.894 82.842 27.778 1.00 0.00 O ATOM 54901 O11 PC 1340 89.872 84.660 29.183 1.00 0.00 O ATOM 54902 C1 PC 1340 89.281 85.517 28.272 1.00 0.00 C ATOM 54903 HR PC 1340 90.004 85.460 27.454 1.00 0.00 H ATOM 54904 HS PC 1340 89.352 86.514 28.715 1.00 0.00 H ATOM 54905 C2 PC 1340 87.874 85.063 27.672 1.00 0.00 C ATOM 54906 HX PC 1340 87.764 83.986 27.524 1.00 0.00 H ATOM 54907 C3 PC 1340 87.602 85.721 26.323 1.00 0.00 C ATOM 54908 HA PC 1340 88.456 85.571 25.658 1.00 0.00 H ATOM 54909 HB PC 1340 87.463 86.803 26.401 1.00 0.00 H ATOM 54910 O31 PC 1340 86.464 85.198 25.683 1.00 0.00 O ATOM 54911 P31 PC 1340 85.913 85.781 24.328 1.00 0.00 P ATOM 54912 O32 PC 1340 86.662 84.928 23.218 1.00 0.00 O ATOM 54913 C31 PC 1340 86.324 83.617 22.950 1.00 0.00 C ATOM 54914 H1A PC 1340 85.559 83.634 22.170 1.00 0.00 H ATOM 54915 H1B PC 1340 86.039 83.175 23.908 1.00 0.00 H ATOM 54916 C32 PC 1340 87.526 82.835 22.444 1.00 0.00 C ATOM 54917 H2A PC 1340 87.940 83.333 21.566 1.00 0.00 H ATOM 54918 H2B PC 1340 87.273 81.829 22.107 1.00 0.00 H ATOM 54919 N31 PC 1340 88.687 82.752 23.431 1.00 0.00 N ATOM 54920 C33 PC 1340 89.693 81.845 22.908 1.00 0.00 C ATOM 54921 H3A PC 1340 89.817 82.075 21.849 1.00 0.00 H ATOM 54922 H3B PC 1340 89.304 80.829 22.989 1.00 0.00 H ATOM 54923 H3C PC 1340 90.602 81.995 23.493 1.00 0.00 H ATOM 54924 C34 PC 1340 89.321 84.041 23.446 1.00 0.00 C ATOM 54925 H4A PC 1340 90.079 84.019 24.230 1.00 0.00 H ATOM 54926 H4B PC 1340 88.536 84.775 23.633 1.00 0.00 H ATOM 54927 H4C PC 1340 89.846 84.110 22.492 1.00 0.00 H ATOM 54928 C35 PC 1340 88.444 82.323 24.901 1.00 0.00 C ATOM 54929 H5A PC 1340 88.201 81.267 25.028 1.00 0.00 H ATOM 54930 H5B PC 1340 87.867 83.059 25.463 1.00 0.00 H ATOM 54931 H5C PC 1340 89.390 82.416 25.435 1.00 0.00 H ATOM 54932 O33 PC 1340 84.458 85.556 24.343 1.00 0.00 O ATOM 54933 O34 PC 1340 86.390 87.148 24.109 1.00 0.00 O ATOM 54934 O21 PC 1340 86.881 85.356 28.655 1.00 0.00 O ATOM 54935 C21 PC 1340 86.595 86.613 29.164 1.00 0.00 C ATOM 54936 O22 PC 1340 87.237 87.627 28.870 1.00 0.00 O ATOM 54937 C12 OL 1341 85.398 86.489 30.043 1.00 0.00 C ATOM 54938 H2R OL 1341 84.636 87.154 29.632 1.00 0.00 H ATOM 54939 H2S OL 1341 85.004 85.476 30.155 1.00 0.00 H ATOM 54940 C13 OL 1341 85.906 87.013 31.468 1.00 0.00 C ATOM 54941 H3R OL 1341 86.734 86.328 31.661 1.00 0.00 H ATOM 54942 H3S OL 1341 86.423 87.969 31.585 1.00 0.00 H ATOM 54943 C14 OL 1341 85.087 86.786 32.809 1.00 0.00 C ATOM 54944 H4R OL 1341 84.242 87.434 32.564 1.00 0.00 H ATOM 54945 H4S OL 1341 84.607 85.814 32.682 1.00 0.00 H ATOM 54946 C15 OL 1341 85.761 87.187 34.075 1.00 0.00 C ATOM 54947 H5R OL 1341 85.199 86.876 34.958 1.00 0.00 H ATOM 54948 H5S OL 1341 86.660 86.570 34.134 1.00 0.00 H ATOM 54949 C16 OL 1341 86.195 88.564 34.303 1.00 0.00 C ATOM 54950 H6R OL 1341 86.547 88.631 35.335 1.00 0.00 H ATOM 54951 H6S OL 1341 86.945 88.809 33.548 1.00 0.00 H ATOM 54952 C17 OL 1341 85.184 89.754 34.134 1.00 0.00 C ATOM 54953 H7R OL 1341 84.185 89.399 34.394 1.00 0.00 H ATOM 54954 H7S OL 1341 85.184 90.553 34.879 1.00 0.00 H ATOM 54955 C18 OL 1341 84.964 90.254 32.747 1.00 0.00 C ATOM 54956 H8R OL 1341 84.700 89.472 32.033 1.00 0.00 H ATOM 54957 H8S OL 1341 84.067 90.877 32.766 1.00 0.00 H ATOM 54958 C19 OL 1341 86.229 90.866 32.304 1.00 0.00 C ATOM 54959 H9R OL 1341 86.841 90.246 31.653 1.00 0.00 H ATOM 54960 C110 OL 1341 86.564 92.138 32.400 1.00 0.00 C ATOM 54961 H10R OL 1341 87.422 92.385 31.781 1.00 0.00 H ATOM 54962 C111 OL 1341 85.847 93.299 33.163 1.00 0.00 C ATOM 54963 H11R OL 1341 85.564 93.976 32.355 1.00 0.00 H ATOM 54964 H11S OL 1341 84.934 92.857 33.567 1.00 0.00 H ATOM 54965 C112 OL 1341 86.607 93.937 34.315 1.00 0.00 C ATOM 54966 H12R OL 1341 86.849 93.180 35.064 1.00 0.00 H ATOM 54967 H12S OL 1341 87.515 94.261 33.803 1.00 0.00 H ATOM 54968 C113 OL 1341 85.828 95.057 35.056 1.00 0.00 C ATOM 54969 H13R OL 1341 85.222 95.509 34.269 1.00 0.00 H ATOM 54970 H13S OL 1341 85.132 94.544 35.723 1.00 0.00 H ATOM 54971 C114 OL 1341 86.602 96.131 35.781 1.00 0.00 C ATOM 54972 H14R OL 1341 87.331 96.735 35.237 1.00 0.00 H ATOM 54973 H14S OL 1341 85.959 96.894 36.223 1.00 0.00 H ATOM 54974 C115 OL 1341 87.346 95.562 36.935 1.00 0.00 C ATOM 54975 H15R OL 1341 88.097 94.848 36.593 1.00 0.00 H ATOM 54976 H15S OL 1341 87.857 96.407 37.403 1.00 0.00 H ATOM 54977 C116 OL 1341 86.603 94.799 38.059 1.00 0.00 C ATOM 54978 H16R OL 1341 85.577 95.172 38.095 1.00 0.00 H ATOM 54979 H16S OL 1341 86.392 93.785 37.712 1.00 0.00 H ATOM 54980 C117 OL 1341 87.291 94.654 39.415 1.00 0.00 C ATOM 54981 H17R OL 1341 88.179 94.058 39.194 1.00 0.00 H ATOM 54982 H17S OL 1341 87.522 95.688 39.682 1.00 0.00 H ATOM 54983 C118 OL 1341 86.396 94.057 40.504 1.00 0.00 C ATOM 54984 H18R OL 1341 85.503 94.658 40.689 1.00 0.00 H ATOM 54985 H18S OL 1341 87.015 94.030 41.403 1.00 0.00 H ATOM 54986 H18T OL 1341 86.128 93.019 40.296 1.00 0.00 H TER 54987 OL 1341 ATOM 54987 C116 PA 1342 138.247 65.580 37.588 1.00 0.00 C ATOM 54988 H16R PA 1342 138.637 65.524 38.607 1.00 0.00 H ATOM 54989 H16S PA 1342 137.790 66.551 37.389 1.00 0.00 H ATOM 54990 H16T PA 1342 139.158 65.492 36.992 1.00 0.00 H ATOM 54991 C115 PA 1342 137.287 64.517 37.290 1.00 0.00 C ATOM 54992 H15R PA 1342 137.134 64.528 36.209 1.00 0.00 H ATOM 54993 H15S PA 1342 136.338 64.532 37.830 1.00 0.00 H ATOM 54994 C114 PA 1342 137.948 63.205 37.582 1.00 0.00 C ATOM 54995 H14R PA 1342 138.149 63.251 38.654 1.00 0.00 H ATOM 54996 H14S PA 1342 138.899 63.089 37.058 1.00 0.00 H ATOM 54997 C113 PA 1342 137.172 62.049 37.304 1.00 0.00 C ATOM 54998 H13R PA 1342 136.260 62.010 37.903 1.00 0.00 H ATOM 54999 H13S PA 1342 137.838 61.248 37.631 1.00 0.00 H ATOM 55000 C112 PA 1342 136.871 61.928 35.840 1.00 0.00 C ATOM 55001 H12R PA 1342 137.782 62.110 35.265 1.00 0.00 H ATOM 55002 H12S PA 1342 136.137 62.674 35.529 1.00 0.00 H ATOM 55003 C111 PA 1342 136.316 60.560 35.372 1.00 0.00 C ATOM 55004 H11R PA 1342 136.115 59.982 36.277 1.00 0.00 H ATOM 55005 H11S PA 1342 137.120 60.072 34.818 1.00 0.00 H ATOM 55006 C110 PA 1342 134.882 60.694 34.668 1.00 0.00 C ATOM 55007 H10R PA 1342 134.230 61.144 35.419 1.00 0.00 H ATOM 55008 H10S PA 1342 134.394 59.738 34.463 1.00 0.00 H ATOM 55009 C19 PA 1342 134.917 61.502 33.415 1.00 0.00 C ATOM 55010 H9R PA 1342 135.748 61.004 32.911 1.00 0.00 H ATOM 55011 H9S PA 1342 135.169 62.539 33.648 1.00 0.00 H ATOM 55012 C18 PA 1342 133.657 61.462 32.581 1.00 0.00 C ATOM 55013 H8R PA 1342 132.725 61.650 33.118 1.00 0.00 H ATOM 55014 H8S PA 1342 133.556 60.424 32.258 1.00 0.00 H ATOM 55015 C17 PA 1342 133.621 62.537 31.471 1.00 0.00 C ATOM 55016 H7R PA 1342 134.142 63.440 31.797 1.00 0.00 H ATOM 55017 H7S PA 1342 132.578 62.841 31.369 1.00 0.00 H ATOM 55018 C16 PA 1342 134.105 61.983 30.135 1.00 0.00 C ATOM 55019 H6R PA 1342 133.322 61.526 29.527 1.00 0.00 H ATOM 55020 H6S PA 1342 134.771 61.122 30.223 1.00 0.00 H ATOM 55021 C15 PA 1342 134.566 63.166 29.301 1.00 0.00 C ATOM 55022 H5R PA 1342 135.306 63.666 29.928 1.00 0.00 H ATOM 55023 H5S PA 1342 133.682 63.781 29.119 1.00 0.00 H ATOM 55024 C14 PA 1342 135.227 62.873 27.932 1.00 0.00 C ATOM 55025 H4R PA 1342 134.403 62.508 27.315 1.00 0.00 H ATOM 55026 H4S PA 1342 135.844 61.989 28.106 1.00 0.00 H ATOM 55027 C13 PA 1342 135.933 64.075 27.400 1.00 0.00 C ATOM 55028 H3R PA 1342 135.721 64.873 28.115 1.00 0.00 H ATOM 55029 H3S PA 1342 135.504 64.390 26.447 1.00 0.00 H ATOM 55030 C12 PA 1342 137.447 63.945 27.219 1.00 0.00 C ATOM 55031 H2R PA 1342 138.002 63.594 28.092 1.00 0.00 H ATOM 55032 H2S PA 1342 137.845 64.923 26.941 1.00 0.00 H ATOM 55033 C11 PGR 1343 137.721 62.889 26.107 1.00 0.00 C ATOM 55034 O12 PGR 1343 137.842 63.099 24.917 1.00 0.00 O ATOM 55035 O11 PGR 1343 137.746 61.631 26.574 1.00 0.00 O ATOM 55036 C1 PGR 1343 138.267 60.588 25.673 1.00 0.00 C ATOM 55037 HR PGR 1343 137.650 60.519 24.773 1.00 0.00 H ATOM 55038 HS PGR 1343 137.988 59.698 26.242 1.00 0.00 H ATOM 55039 C2 PGR 1343 139.747 60.736 25.345 1.00 0.00 C ATOM 55040 HX PGR 1343 140.017 61.795 25.328 1.00 0.00 H ATOM 55041 C3 PGR 1343 140.263 59.988 24.146 1.00 0.00 C ATOM 55042 HA PGR 1343 141.245 59.538 24.309 1.00 0.00 H ATOM 55043 HB PGR 1343 140.257 60.707 23.323 1.00 0.00 H ATOM 55044 O31 PGR 1343 139.328 58.866 23.944 1.00 0.00 O ATOM 55045 P31 PGR 1343 139.315 57.971 22.595 1.00 0.00 P ATOM 55046 O32 PGR 1343 138.964 59.052 21.559 1.00 0.00 O ATOM 55047 C31 PGR 1343 137.612 58.998 21.031 1.00 0.00 C ATOM 55048 H1A PGR 1343 136.917 59.022 21.874 1.00 0.00 H ATOM 55049 H1B PGR 1343 137.427 58.131 20.390 1.00 0.00 H ATOM 55050 C32 PGR 1343 137.231 60.248 20.236 1.00 0.00 C ATOM 55051 H2A PGR 1343 136.163 60.235 20.003 1.00 0.00 H ATOM 55052 O35 PGR 1343 137.924 60.237 18.940 1.00 0.00 O ATOM 55053 HO5A PGR 1343 138.875 60.219 19.147 1.00 0.00 H ATOM 55054 C33 PGR 1343 137.452 61.539 21.100 1.00 0.00 C ATOM 55055 H3A PGR 1343 136.850 61.281 21.975 1.00 0.00 H ATOM 55056 H3B PGR 1343 138.492 61.738 21.370 1.00 0.00 H ATOM 55057 O33 PGR 1343 140.661 57.423 22.366 1.00 0.00 O ATOM 55058 O34 PGR 1343 138.142 57.013 22.724 1.00 0.00 O ATOM 55059 O21 PGR 1343 140.441 60.165 26.499 1.00 0.00 O ATOM 55060 C21 PGR 1343 141.736 60.474 26.619 1.00 0.00 C ATOM 55061 O22 PGR 1343 142.395 61.183 25.839 1.00 0.00 O ATOM 55062 O36 PGR 1343 136.713 62.663 20.532 1.00 0.00 O ATOM 55063 HO6A PGR 1343 136.783 63.413 21.150 1.00 0.00 H ATOM 55064 C12 OL 1344 142.400 59.970 27.906 1.00 0.00 C ATOM 55065 H2R OL 1344 143.031 59.089 27.771 1.00 0.00 H ATOM 55066 H2S OL 1344 143.155 60.710 28.176 1.00 0.00 H ATOM 55067 C13 OL 1344 141.326 59.872 29.022 1.00 0.00 C ATOM 55068 H3R OL 1344 140.993 60.909 29.101 1.00 0.00 H ATOM 55069 H3S OL 1344 140.386 59.391 28.744 1.00 0.00 H ATOM 55070 C14 OL 1344 141.865 59.400 30.364 1.00 0.00 C ATOM 55071 H4R OL 1344 142.858 59.849 30.433 1.00 0.00 H ATOM 55072 H4S OL 1344 141.262 59.835 31.164 1.00 0.00 H ATOM 55073 C15 OL 1344 141.962 57.896 30.678 1.00 0.00 C ATOM 55074 H5R OL 1344 142.934 57.427 30.509 1.00 0.00 H ATOM 55075 H5S OL 1344 141.764 57.795 31.747 1.00 0.00 H ATOM 55076 C16 OL 1344 140.894 57.060 29.971 1.00 0.00 C ATOM 55077 H6R OL 1344 139.991 57.638 30.176 1.00 0.00 H ATOM 55078 H6S OL 1344 141.084 56.893 28.909 1.00 0.00 H ATOM 55079 C17 OL 1344 140.617 55.747 30.735 1.00 0.00 C ATOM 55080 H7R OL 1344 140.596 56.050 31.784 1.00 0.00 H ATOM 55081 H7S OL 1344 139.688 55.207 30.539 1.00 0.00 H ATOM 55082 C18 OL 1344 141.714 54.730 30.488 1.00 0.00 C ATOM 55083 H8R OL 1344 141.802 54.541 29.416 1.00 0.00 H ATOM 55084 H8S OL 1344 142.654 55.150 30.854 1.00 0.00 H ATOM 55085 C19 OL 1344 141.485 53.399 31.170 1.00 0.00 C ATOM 55086 H9R OL 1344 140.865 52.641 30.698 1.00 0.00 H ATOM 55087 C110 OL 1344 141.989 52.937 32.362 1.00 0.00 C ATOM 55088 H10R OL 1344 141.554 51.993 32.680 1.00 0.00 H ATOM 55089 C111 OL 1344 142.663 53.716 33.443 1.00 0.00 C ATOM 55090 H11R OL 1344 143.709 53.431 33.574 1.00 0.00 H ATOM 55091 H11S OL 1344 142.637 54.777 33.185 1.00 0.00 H ATOM 55092 C112 OL 1344 141.830 53.512 34.740 1.00 0.00 C ATOM 55093 H12R OL 1344 140.892 53.995 34.459 1.00 0.00 H ATOM 55094 H12S OL 1344 141.516 52.477 34.891 1.00 0.00 H ATOM 55095 C113 OL 1344 142.465 54.135 35.930 1.00 0.00 C ATOM 55096 H13R OL 1344 143.282 53.446 36.156 1.00 0.00 H ATOM 55097 H13S OL 1344 142.917 55.094 35.667 1.00 0.00 H ATOM 55098 C114 OL 1344 141.551 54.344 37.090 1.00 0.00 C ATOM 55099 H14R OL 1344 140.873 55.179 36.902 1.00 0.00 H ATOM 55100 H14S OL 1344 140.812 53.541 37.106 1.00 0.00 H ATOM 55101 C115 OL 1344 142.239 54.416 38.415 1.00 0.00 C ATOM 55102 H15R OL 1344 142.638 53.436 38.684 1.00 0.00 H ATOM 55103 H15S OL 1344 143.216 54.896 38.329 1.00 0.00 H ATOM 55104 C116 OL 1344 141.461 55.098 39.613 1.00 0.00 C ATOM 55105 H16R OL 1344 141.088 56.067 39.277 1.00 0.00 H ATOM 55106 H16S OL 1344 140.539 54.534 39.765 1.00 0.00 H ATOM 55107 C117 OL 1344 142.272 55.001 40.940 1.00 0.00 C ATOM 55108 H17R OL 1344 142.781 54.038 41.011 1.00 0.00 H ATOM 55109 H17S OL 1344 143.062 55.752 40.880 1.00 0.00 H ATOM 55110 C118 OL 1344 141.378 55.324 42.159 1.00 0.00 C ATOM 55111 H18R OL 1344 140.806 54.400 42.272 1.00 0.00 H ATOM 55112 H18S OL 1344 140.673 56.157 42.133 1.00 0.00 H ATOM 55113 H18T OL 1344 142.016 55.427 43.039 1.00 0.00 H TER 55114 OL 1344 ATOM 55114 C116 PA 1345 45.440 48.447 47.464 1.00 0.00 C ATOM 55115 H16R PA 1345 44.788 47.599 47.243 1.00 0.00 H ATOM 55116 H16S PA 1345 44.852 49.253 47.907 1.00 0.00 H ATOM 55117 H16T PA 1345 46.146 48.150 48.242 1.00 0.00 H ATOM 55118 C115 PA 1345 46.112 48.909 46.212 1.00 0.00 C ATOM 55119 H15R PA 1345 46.823 48.195 45.790 1.00 0.00 H ATOM 55120 H15S PA 1345 46.722 49.725 46.604 1.00 0.00 H ATOM 55121 C114 PA 1345 45.201 49.462 45.083 1.00 0.00 C ATOM 55122 H14R PA 1345 44.530 50.257 45.418 1.00 0.00 H ATOM 55123 H14S PA 1345 44.558 48.663 44.709 1.00 0.00 H ATOM 55124 C113 PA 1345 45.869 49.960 43.756 1.00 0.00 C ATOM 55125 H13R PA 1345 46.012 48.991 43.274 1.00 0.00 H ATOM 55126 H13S PA 1345 46.864 50.349 43.979 1.00 0.00 H ATOM 55127 C112 PA 1345 45.054 50.890 42.877 1.00 0.00 C ATOM 55128 H12R PA 1345 44.637 51.661 43.529 1.00 0.00 H ATOM 55129 H12S PA 1345 44.124 50.353 42.680 1.00 0.00 H ATOM 55130 C111 PA 1345 45.815 51.372 41.713 1.00 0.00 C ATOM 55131 H11R PA 1345 46.101 50.445 41.211 1.00 0.00 H ATOM 55132 H11S PA 1345 46.789 51.787 41.982 1.00 0.00 H ATOM 55133 C110 PA 1345 44.994 52.304 40.863 1.00 0.00 C ATOM 55134 H10R PA 1345 44.629 53.198 41.373 1.00 0.00 H ATOM 55135 H10S PA 1345 44.084 51.762 40.596 1.00 0.00 H ATOM 55136 C19 PA 1345 45.690 52.626 39.567 1.00 0.00 C ATOM 55137 H9R PA 1345 46.013 51.710 39.068 1.00 0.00 H ATOM 55138 H9S PA 1345 46.651 53.043 39.876 1.00 0.00 H ATOM 55139 C18 PA 1345 44.863 53.676 38.813 1.00 0.00 C ATOM 55140 H8R PA 1345 44.703 54.600 39.372 1.00 0.00 H ATOM 55141 H8S PA 1345 43.893 53.221 38.597 1.00 0.00 H ATOM 55142 C17 PA 1345 45.540 54.177 37.570 1.00 0.00 C ATOM 55143 H7R PA 1345 46.550 54.496 37.838 1.00 0.00 H ATOM 55144 H7S PA 1345 45.051 55.102 37.257 1.00 0.00 H ATOM 55145 C16 PA 1345 45.560 53.240 36.366 1.00 0.00 C ATOM 55146 H6R PA 1345 44.500 53.093 36.150 1.00 0.00 H ATOM 55147 H6S PA 1345 46.020 52.277 36.596 1.00 0.00 H ATOM 55148 C15 PA 1345 46.203 53.843 35.199 1.00 0.00 C ATOM 55149 H5R PA 1345 45.723 54.789 34.941 1.00 0.00 H ATOM 55150 H5S PA 1345 45.919 53.235 34.338 1.00 0.00 H ATOM 55151 C14 PA 1345 47.788 54.134 35.368 1.00 0.00 C ATOM 55152 H4R PA 1345 47.897 54.771 36.248 1.00 0.00 H ATOM 55153 H4S PA 1345 48.092 54.687 34.476 1.00 0.00 H ATOM 55154 C13 PA 1345 48.722 52.967 35.446 1.00 0.00 C ATOM 55155 H3R PA 1345 48.440 52.367 36.314 1.00 0.00 H ATOM 55156 H3S PA 1345 49.715 53.280 35.774 1.00 0.00 H ATOM 55157 C12 PA 1345 48.558 51.869 34.323 1.00 0.00 C ATOM 55158 H2R PA 1345 47.493 51.739 34.118 1.00 0.00 H ATOM 55159 H2S PA 1345 48.941 50.948 34.767 1.00 0.00 H ATOM 55160 C11 PGR 1346 49.218 52.308 33.071 1.00 0.00 C ATOM 55161 O12 PGR 1346 50.415 52.544 32.880 1.00 0.00 O ATOM 55162 O11 PGR 1346 48.296 52.475 32.107 1.00 0.00 O ATOM 55163 C1 PGR 1346 48.654 53.217 30.861 1.00 0.00 C ATOM 55164 HR PGR 1346 49.232 54.115 31.094 1.00 0.00 H ATOM 55165 HS PGR 1346 47.721 53.422 30.330 1.00 0.00 H ATOM 55166 C2 PGR 1346 49.357 52.250 29.885 1.00 0.00 C ATOM 55167 HX PGR 1346 50.382 51.982 30.151 1.00 0.00 H ATOM 55168 C3 PGR 1346 49.395 52.993 28.521 1.00 0.00 C ATOM 55169 HA PGR 1346 49.383 54.076 28.666 1.00 0.00 H ATOM 55170 HB PGR 1346 48.452 52.754 28.022 1.00 0.00 H ATOM 55171 O31 PGR 1346 50.417 52.555 27.722 1.00 0.00 O ATOM 55172 P31 PGR 1346 50.751 53.272 26.401 1.00 0.00 P ATOM 55173 O32 PGR 1346 51.562 54.590 26.801 1.00 0.00 O ATOM 55174 C31 PGR 1346 52.767 54.391 27.532 1.00 0.00 C ATOM 55175 H1A PGR 1346 53.373 53.557 27.168 1.00 0.00 H ATOM 55176 H1B PGR 1346 52.466 54.218 28.568 1.00 0.00 H ATOM 55177 C32 PGR 1346 53.668 55.628 27.579 1.00 0.00 C ATOM 55178 H2A PGR 1346 53.008 56.462 27.831 1.00 0.00 H ATOM 55179 O35 PGR 1346 54.338 55.892 26.299 1.00 0.00 O ATOM 55180 HO5A PGR 1346 53.632 56.176 25.691 1.00 0.00 H ATOM 55181 C33 PGR 1346 54.669 55.425 28.683 1.00 0.00 C ATOM 55182 H3A PGR 1346 54.119 54.927 29.486 1.00 0.00 H ATOM 55183 H3B PGR 1346 55.410 54.706 28.322 1.00 0.00 H ATOM 55184 O33 PGR 1346 51.723 52.409 25.674 1.00 0.00 O ATOM 55185 O34 PGR 1346 49.502 53.736 25.757 1.00 0.00 O ATOM 55186 O21 PGR 1346 48.402 51.166 29.714 1.00 0.00 O ATOM 55187 C21 PGR 1346 48.858 50.035 29.053 1.00 0.00 C ATOM 55188 O22 PGR 1346 49.999 49.898 28.696 1.00 0.00 O ATOM 55189 O36 PGR 1346 55.201 56.721 29.159 1.00 0.00 O ATOM 55190 HO6A PGR 1346 55.332 57.186 28.313 1.00 0.00 H ATOM 55191 C12 OL 1347 47.895 48.828 28.819 1.00 0.00 C ATOM 55192 H2R OL 1347 46.898 49.274 28.831 1.00 0.00 H ATOM 55193 H2S OL 1347 48.172 48.473 27.825 1.00 0.00 H ATOM 55194 C13 OL 1347 47.992 47.805 29.912 1.00 0.00 C ATOM 55195 H3R OL 1347 49.025 47.450 29.908 1.00 0.00 H ATOM 55196 H3S OL 1347 47.690 48.329 30.821 1.00 0.00 H ATOM 55197 C14 OL 1347 47.060 46.640 29.538 1.00 0.00 C ATOM 55198 H4R OL 1347 46.055 46.898 29.197 1.00 0.00 H ATOM 55199 H4S OL 1347 47.579 46.126 28.727 1.00 0.00 H ATOM 55200 C15 OL 1347 46.784 45.597 30.697 1.00 0.00 C ATOM 55201 H5R OL 1347 46.296 44.720 30.266 1.00 0.00 H ATOM 55202 H5S OL 1347 47.741 45.224 31.070 1.00 0.00 H ATOM 55203 C16 OL 1347 45.887 46.077 31.848 1.00 0.00 C ATOM 55204 H6R OL 1347 46.398 46.702 32.584 1.00 0.00 H ATOM 55205 H6S OL 1347 45.180 46.800 31.437 1.00 0.00 H ATOM 55206 C17 OL 1347 44.955 44.971 32.317 1.00 0.00 C ATOM 55207 H7R OL 1347 44.286 44.666 31.509 1.00 0.00 H ATOM 55208 H7S OL 1347 45.429 44.041 32.638 1.00 0.00 H ATOM 55209 C18 OL 1347 44.056 45.417 33.522 1.00 0.00 C ATOM 55210 H8R OL 1347 43.538 46.342 33.261 1.00 0.00 H ATOM 55211 H8S OL 1347 43.212 44.756 33.728 1.00 0.00 H ATOM 55212 C19 OL 1347 44.836 45.721 34.773 1.00 0.00 C ATOM 55213 H9R OL 1347 45.765 46.246 34.562 1.00 0.00 H ATOM 55214 C110 OL 1347 44.596 45.523 36.093 1.00 0.00 C ATOM 55215 H10R OL 1347 45.343 45.859 36.808 1.00 0.00 H ATOM 55216 C111 OL 1347 43.280 44.948 36.493 1.00 0.00 C ATOM 55217 H11R OL 1347 42.728 44.533 35.647 1.00 0.00 H ATOM 55218 H11S OL 1347 43.477 44.075 37.118 1.00 0.00 H ATOM 55219 C112 OL 1347 42.568 46.046 37.227 1.00 0.00 C ATOM 55220 H12R OL 1347 43.185 46.208 38.114 1.00 0.00 H ATOM 55221 H12S OL 1347 42.515 46.957 36.627 1.00 0.00 H ATOM 55222 C113 OL 1347 41.159 45.627 37.716 1.00 0.00 C ATOM 55223 H13R OL 1347 40.438 45.885 36.938 1.00 0.00 H ATOM 55224 H13S OL 1347 41.056 44.550 37.865 1.00 0.00 H ATOM 55225 C114 OL 1347 40.791 46.168 39.050 1.00 0.00 C ATOM 55226 H14R OL 1347 40.878 47.251 39.153 1.00 0.00 H ATOM 55227 H14S OL 1347 39.709 46.064 39.151 1.00 0.00 H ATOM 55228 C115 OL 1347 41.395 45.382 40.254 1.00 0.00 C ATOM 55229 H15R OL 1347 41.218 44.305 40.220 1.00 0.00 H ATOM 55230 H15S OL 1347 42.483 45.468 40.233 1.00 0.00 H ATOM 55231 C116 OL 1347 40.850 45.950 41.600 1.00 0.00 C ATOM 55232 H16R OL 1347 39.766 45.820 41.641 1.00 0.00 H ATOM 55233 H16S OL 1347 41.309 45.326 42.370 1.00 0.00 H ATOM 55234 C117 OL 1347 40.971 47.439 41.920 1.00 0.00 C ATOM 55235 H17R OL 1347 40.353 47.879 41.135 1.00 0.00 H ATOM 55236 H17S OL 1347 40.460 47.870 42.784 1.00 0.00 H ATOM 55237 C118 OL 1347 42.365 47.972 41.909 1.00 0.00 C ATOM 55238 H18R OL 1347 42.826 47.840 42.890 1.00 0.00 H ATOM 55239 H18S OL 1347 42.353 49.056 41.777 1.00 0.00 H ATOM 55240 H18T OL 1347 43.083 47.644 41.154 1.00 0.00 H TER 55241 OL 1347 ATOM 55241 C116 PA 1348 13.502 132.793 44.121 1.00 0.00 C ATOM 55242 H16R PA 1348 13.288 133.684 43.527 1.00 0.00 H ATOM 55243 H16S PA 1348 14.486 132.949 44.570 1.00 0.00 H ATOM 55244 H16T PA 1348 12.668 132.822 44.825 1.00 0.00 H ATOM 55245 C115 PA 1348 13.573 131.471 43.400 1.00 0.00 C ATOM 55246 H15R PA 1348 14.524 131.334 42.882 1.00 0.00 H ATOM 55247 H15S PA 1348 12.838 131.380 42.598 1.00 0.00 H ATOM 55248 C114 PA 1348 13.211 130.264 44.262 1.00 0.00 C ATOM 55249 H14R PA 1348 12.189 130.442 44.600 1.00 0.00 H ATOM 55250 H14S PA 1348 13.786 130.297 45.190 1.00 0.00 H ATOM 55251 C113 PA 1348 13.157 128.896 43.572 1.00 0.00 C ATOM 55252 H13R PA 1348 12.360 128.865 42.827 1.00 0.00 H ATOM 55253 H13S PA 1348 13.030 128.053 44.254 1.00 0.00 H ATOM 55254 C112 PA 1348 14.376 128.619 42.746 1.00 0.00 C ATOM 55255 H12R PA 1348 15.334 128.737 43.256 1.00 0.00 H ATOM 55256 H12S PA 1348 14.530 129.282 41.892 1.00 0.00 H ATOM 55257 C111 PA 1348 14.395 127.319 42.138 1.00 0.00 C ATOM 55258 H11R PA 1348 13.461 126.987 41.681 1.00 0.00 H ATOM 55259 H11S PA 1348 14.546 126.559 42.908 1.00 0.00 H ATOM 55260 C110 PA 1348 15.712 127.127 41.284 1.00 0.00 C ATOM 55261 H10R PA 1348 16.158 126.190 41.624 1.00 0.00 H ATOM 55262 H10S PA 1348 16.386 127.942 41.554 1.00 0.00 H ATOM 55263 C19 PA 1348 15.329 127.091 39.842 1.00 0.00 C ATOM 55264 H9R PA 1348 14.797 128.041 39.752 1.00 0.00 H ATOM 55265 H9S PA 1348 14.733 126.191 39.674 1.00 0.00 H ATOM 55266 C18 PA 1348 16.568 127.161 38.959 1.00 0.00 C ATOM 55267 H8R PA 1348 17.039 126.176 38.936 1.00 0.00 H ATOM 55268 H8S PA 1348 17.213 127.962 39.324 1.00 0.00 H ATOM 55269 C17 PA 1348 16.174 127.496 37.460 1.00 0.00 C ATOM 55270 H7R PA 1348 15.610 128.427 37.555 1.00 0.00 H ATOM 55271 H7S PA 1348 15.488 126.737 37.077 1.00 0.00 H ATOM 55272 C16 PA 1348 17.453 127.609 36.511 1.00 0.00 C ATOM 55273 H6R PA 1348 17.928 128.528 36.859 1.00 0.00 H ATOM 55274 H6S PA 1348 17.128 127.713 35.473 1.00 0.00 H ATOM 55275 C15 PA 1348 18.353 126.406 36.581 1.00 0.00 C ATOM 55276 H5R PA 1348 18.685 126.282 37.614 1.00 0.00 H ATOM 55277 H5S PA 1348 19.308 126.352 36.055 1.00 0.00 H ATOM 55278 C14 PA 1348 17.574 125.083 36.237 1.00 0.00 C ATOM 55279 H4R PA 1348 16.945 124.684 37.036 1.00 0.00 H ATOM 55280 H4S PA 1348 18.437 124.414 36.221 1.00 0.00 H ATOM 55281 C13 PA 1348 16.856 125.103 34.884 1.00 0.00 C ATOM 55282 H3R PA 1348 17.345 125.755 34.157 1.00 0.00 H ATOM 55283 H3S PA 1348 15.995 125.746 35.081 1.00 0.00 H ATOM 55284 C12 PA 1348 16.436 123.759 34.266 1.00 0.00 C ATOM 55285 H2R PA 1348 15.824 123.120 34.906 1.00 0.00 H ATOM 55286 H2S PA 1348 17.313 123.195 33.943 1.00 0.00 H ATOM 55287 C11 PGR 1349 15.569 124.004 32.989 1.00 0.00 C ATOM 55288 O12 PGR 1349 14.823 124.964 32.845 1.00 0.00 O ATOM 55289 O11 PGR 1349 15.724 122.939 32.174 1.00 0.00 O ATOM 55290 C1 PGR 1349 15.236 122.910 30.791 1.00 0.00 C ATOM 55291 HR PGR 1349 14.206 123.235 30.627 1.00 0.00 H ATOM 55292 HS PGR 1349 15.324 121.918 30.340 1.00 0.00 H ATOM 55293 C2 PGR 1349 16.058 123.925 30.019 1.00 0.00 C ATOM 55294 HX PGR 1349 15.939 124.946 30.389 1.00 0.00 H ATOM 55295 C3 PGR 1349 15.529 123.879 28.576 1.00 0.00 C ATOM 55296 HA PGR 1349 16.118 124.584 27.984 1.00 0.00 H ATOM 55297 HB PGR 1349 14.485 124.198 28.552 1.00 0.00 H ATOM 55298 O31 PGR 1349 15.638 122.543 28.183 1.00 0.00 O ATOM 55299 P31 PGR 1349 15.994 122.165 26.667 1.00 0.00 P ATOM 55300 O32 PGR 1349 14.664 122.502 25.853 1.00 0.00 O ATOM 55301 C31 PGR 1349 13.416 122.008 26.205 1.00 0.00 C ATOM 55302 H1A PGR 1349 13.180 122.344 27.218 1.00 0.00 H ATOM 55303 H1B PGR 1349 13.463 120.917 26.253 1.00 0.00 H ATOM 55304 C32 PGR 1349 12.369 122.462 25.153 1.00 0.00 C ATOM 55305 H2A PGR 1349 11.387 122.275 25.596 1.00 0.00 H ATOM 55306 O35 PGR 1349 12.410 121.589 23.962 1.00 0.00 O ATOM 55307 HO5A PGR 1349 12.344 120.641 24.179 1.00 0.00 H ATOM 55308 C33 PGR 1349 12.526 123.899 24.640 1.00 0.00 C ATOM 55309 H3A PGR 1349 12.265 124.481 25.528 1.00 0.00 H ATOM 55310 H3B PGR 1349 13.554 124.164 24.383 1.00 0.00 H ATOM 55311 O33 PGR 1349 17.093 122.976 26.094 1.00 0.00 O ATOM 55312 O34 PGR 1349 16.128 120.679 26.514 1.00 0.00 O ATOM 55313 O21 PGR 1349 17.525 123.566 30.131 1.00 0.00 O ATOM 55314 C21 PGR 1349 18.417 124.546 29.855 1.00 0.00 C ATOM 55315 O22 PGR 1349 18.056 125.683 29.648 1.00 0.00 O ATOM 55316 O36 PGR 1349 11.532 124.211 23.679 1.00 0.00 O ATOM 55317 HO6A PGR 1349 11.292 125.153 23.613 1.00 0.00 H ATOM 55318 C12 OL 1350 19.810 124.159 29.694 1.00 0.00 C ATOM 55319 H2R OL 1350 19.851 123.115 29.378 1.00 0.00 H ATOM 55320 H2S OL 1350 20.136 124.770 28.850 1.00 0.00 H ATOM 55321 C13 OL 1350 20.613 124.421 30.955 1.00 0.00 C ATOM 55322 H3R OL 1350 21.651 124.135 30.777 1.00 0.00 H ATOM 55323 H3S OL 1350 20.716 125.473 31.228 1.00 0.00 H ATOM 55324 C14 OL 1350 20.189 123.734 32.262 1.00 0.00 C ATOM 55325 H4R OL 1350 20.943 124.079 32.973 1.00 0.00 H ATOM 55326 H4S OL 1350 19.194 124.055 32.577 1.00 0.00 H ATOM 55327 C15 OL 1350 20.179 122.221 32.273 1.00 0.00 C ATOM 55328 H5R OL 1350 19.891 122.009 33.305 1.00 0.00 H ATOM 55329 H5S OL 1350 19.415 121.843 31.591 1.00 0.00 H ATOM 55330 C16 OL 1350 21.464 121.623 31.816 1.00 0.00 C ATOM 55331 H6R OL 1350 21.400 120.553 32.022 1.00 0.00 H ATOM 55332 H6S OL 1350 21.512 121.724 30.729 1.00 0.00 H ATOM 55333 C17 OL 1350 22.804 122.121 32.401 1.00 0.00 C ATOM 55334 H7R OL 1350 23.543 121.689 31.723 1.00 0.00 H ATOM 55335 H7S OL 1350 22.951 123.201 32.343 1.00 0.00 H ATOM 55336 C18 OL 1350 22.995 121.491 33.823 1.00 0.00 C ATOM 55337 H8R OL 1350 22.584 122.239 34.504 1.00 0.00 H ATOM 55338 H8S OL 1350 22.379 120.593 33.906 1.00 0.00 H ATOM 55339 C19 OL 1350 24.395 121.218 34.086 1.00 0.00 C ATOM 55340 H9R OL 1350 24.975 120.643 33.370 1.00 0.00 H ATOM 55341 C110 OL 1350 25.037 121.634 35.175 1.00 0.00 C ATOM 55342 H10R OL 1350 26.105 121.436 35.164 1.00 0.00 H ATOM 55343 C111 OL 1350 24.514 122.437 36.265 1.00 0.00 C ATOM 55344 H11R OL 1350 24.736 123.499 36.140 1.00 0.00 H ATOM 55345 H11S OL 1350 23.430 122.316 36.302 1.00 0.00 H ATOM 55346 C112 OL 1350 25.205 121.880 37.535 1.00 0.00 C ATOM 55347 H12R OL 1350 26.283 121.992 37.403 1.00 0.00 H ATOM 55348 H12S OL 1350 25.093 122.608 38.342 1.00 0.00 H ATOM 55349 C113 OL 1350 24.816 120.495 37.922 1.00 0.00 C ATOM 55350 H13R OL 1350 24.708 119.835 37.059 1.00 0.00 H ATOM 55351 H13S OL 1350 25.697 120.096 38.428 1.00 0.00 H ATOM 55352 C114 OL 1350 23.591 120.431 38.757 1.00 0.00 C ATOM 55353 H14R OL 1350 23.723 121.141 39.577 1.00 0.00 H ATOM 55354 H14S OL 1350 22.676 120.670 38.213 1.00 0.00 H ATOM 55355 C115 OL 1350 23.428 119.035 39.276 1.00 0.00 C ATOM 55356 H15R OL 1350 23.446 118.398 38.389 1.00 0.00 H ATOM 55357 H15S OL 1350 24.401 118.884 39.749 1.00 0.00 H ATOM 55358 C116 OL 1350 22.373 118.903 40.311 1.00 0.00 C ATOM 55359 H16R OL 1350 22.617 119.465 41.215 1.00 0.00 H ATOM 55360 H16S OL 1350 21.469 119.390 39.938 1.00 0.00 H ATOM 55361 C117 OL 1350 22.118 117.514 40.873 1.00 0.00 C ATOM 55362 H17R OL 1350 21.929 116.736 40.131 1.00 0.00 H ATOM 55363 H17S OL 1350 23.035 117.313 41.432 1.00 0.00 H ATOM 55364 C118 OL 1350 21.013 117.664 41.871 1.00 0.00 C ATOM 55365 H18R OL 1350 21.063 118.518 42.549 1.00 0.00 H ATOM 55366 H18S OL 1350 21.092 116.809 42.545 1.00 0.00 H ATOM 55367 H18T OL 1350 20.021 117.697 41.416 1.00 0.00 H TER 55368 OL 1350 ATOM 55368 C116 PA 1351 127.251 53.252 38.434 1.00 0.00 C ATOM 55369 H16R PA 1351 126.229 53.188 38.812 1.00 0.00 H ATOM 55370 H16S PA 1351 127.742 54.207 38.635 1.00 0.00 H ATOM 55371 H16T PA 1351 127.846 52.486 38.936 1.00 0.00 H ATOM 55372 C115 PA 1351 127.372 53.037 36.920 1.00 0.00 C ATOM 55373 H15R PA 1351 126.599 53.591 36.384 1.00 0.00 H ATOM 55374 H15S PA 1351 127.091 51.988 36.810 1.00 0.00 H ATOM 55375 C114 PA 1351 128.758 53.199 36.299 1.00 0.00 C ATOM 55376 H14R PA 1351 129.518 52.590 36.792 1.00 0.00 H ATOM 55377 H14S PA 1351 129.064 54.232 36.479 1.00 0.00 H ATOM 55378 C113 PA 1351 128.626 53.054 34.699 1.00 0.00 C ATOM 55379 H13R PA 1351 127.825 53.740 34.418 1.00 0.00 H ATOM 55380 H13S PA 1351 128.200 52.071 34.485 1.00 0.00 H ATOM 55381 C112 PA 1351 129.938 53.259 33.949 1.00 0.00 C ATOM 55382 H12R PA 1351 130.612 52.505 34.360 1.00 0.00 H ATOM 55383 H12S PA 1351 130.302 54.258 34.199 1.00 0.00 H ATOM 55384 C111 PA 1351 129.746 52.975 32.456 1.00 0.00 C ATOM 55385 H11R PA 1351 129.368 51.972 32.248 1.00 0.00 H ATOM 55386 H11S PA 1351 130.727 52.965 31.976 1.00 0.00 H ATOM 55387 C110 PA 1351 128.943 54.089 31.804 1.00 0.00 C ATOM 55388 H10R PA 1351 129.335 55.052 32.136 1.00 0.00 H ATOM 55389 H10S PA 1351 127.915 54.174 32.163 1.00 0.00 H ATOM 55390 C19 PA 1351 128.866 54.064 30.272 1.00 0.00 C ATOM 55391 H9R PA 1351 129.834 54.239 29.798 1.00 0.00 H ATOM 55392 H9S PA 1351 128.439 55.015 29.947 1.00 0.00 H ATOM 55393 C18 PA 1351 128.109 52.837 29.641 1.00 0.00 C ATOM 55394 H8R PA 1351 128.662 51.930 29.898 1.00 0.00 H ATOM 55395 H8S PA 1351 128.042 52.892 28.552 1.00 0.00 H ATOM 55396 C17 PA 1351 126.697 52.731 30.193 1.00 0.00 C ATOM 55397 H7R PA 1351 126.732 52.392 31.231 1.00 0.00 H ATOM 55398 H7S PA 1351 126.323 51.776 29.817 1.00 0.00 H ATOM 55399 C16 PA 1351 125.680 53.847 29.931 1.00 0.00 C ATOM 55400 H6R PA 1351 125.492 53.932 28.859 1.00 0.00 H ATOM 55401 H6S PA 1351 126.075 54.834 30.180 1.00 0.00 H ATOM 55402 C15 PA 1351 124.312 53.658 30.652 1.00 0.00 C ATOM 55403 H5R PA 1351 123.624 54.475 30.427 1.00 0.00 H ATOM 55404 H5S PA 1351 124.503 53.634 31.727 1.00 0.00 H ATOM 55405 C14 PA 1351 123.368 52.461 30.279 1.00 0.00 C ATOM 55406 H4R PA 1351 122.481 52.612 30.897 1.00 0.00 H ATOM 55407 H4S PA 1351 123.929 51.618 30.688 1.00 0.00 H ATOM 55408 C13 PA 1351 123.165 52.149 28.838 1.00 0.00 C ATOM 55409 H3R PA 1351 124.122 52.159 28.313 1.00 0.00 H ATOM 55410 H3S PA 1351 122.452 52.824 28.359 1.00 0.00 H ATOM 55411 C12 PA 1351 122.580 50.766 28.652 1.00 0.00 C ATOM 55412 H2R PA 1351 121.701 50.574 29.271 1.00 0.00 H ATOM 55413 H2S PA 1351 123.319 50.037 28.990 1.00 0.00 H ATOM 55414 C11 PGR 1352 122.181 50.354 27.259 1.00 0.00 C ATOM 55415 O12 PGR 1352 122.950 50.009 26.352 1.00 0.00 O ATOM 55416 O11 PGR 1352 120.833 50.358 27.174 1.00 0.00 O ATOM 55417 C1 PGR 1352 120.256 49.812 25.962 1.00 0.00 C ATOM 55418 HR PGR 1352 120.628 50.338 25.079 1.00 0.00 H ATOM 55419 HS PGR 1352 119.188 50.037 26.017 1.00 0.00 H ATOM 55420 C2 PGR 1352 120.463 48.314 25.881 1.00 0.00 C ATOM 55421 HX PGR 1352 121.494 48.148 26.204 1.00 0.00 H ATOM 55422 C3 PGR 1352 120.310 47.943 24.335 1.00 0.00 C ATOM 55423 HA PGR 1352 120.631 48.700 23.614 1.00 0.00 H ATOM 55424 HB PGR 1352 119.261 47.731 24.114 1.00 0.00 H ATOM 55425 O31 PGR 1352 121.054 46.788 24.026 1.00 0.00 O ATOM 55426 P31 PGR 1352 120.959 46.141 22.597 1.00 0.00 P ATOM 55427 O32 PGR 1352 119.528 45.338 22.481 1.00 0.00 O ATOM 55428 C31 PGR 1352 119.194 44.307 23.448 1.00 0.00 C ATOM 55429 H1A PGR 1352 119.583 44.605 24.425 1.00 0.00 H ATOM 55430 H1B PGR 1352 119.568 43.301 23.241 1.00 0.00 H ATOM 55431 C32 PGR 1352 117.690 44.011 23.550 1.00 0.00 C ATOM 55432 H2A PGR 1352 117.539 43.048 24.044 1.00 0.00 H ATOM 55433 O35 PGR 1352 117.033 44.095 22.242 1.00 0.00 O ATOM 55434 HO5A PGR 1352 117.494 43.431 21.699 1.00 0.00 H ATOM 55435 C33 PGR 1352 116.938 45.047 24.431 1.00 0.00 C ATOM 55436 H3A PGR 1352 115.972 44.549 24.542 1.00 0.00 H ATOM 55437 H3B PGR 1352 117.365 45.083 25.436 1.00 0.00 H ATOM 55438 O33 PGR 1352 120.861 47.228 21.627 1.00 0.00 O ATOM 55439 O34 PGR 1352 122.036 45.173 22.445 1.00 0.00 O ATOM 55440 O21 PGR 1352 119.558 47.570 26.684 1.00 0.00 O ATOM 55441 C21 PGR 1352 119.900 47.500 27.961 1.00 0.00 C ATOM 55442 O22 PGR 1352 120.983 47.854 28.410 1.00 0.00 O ATOM 55443 O36 PGR 1352 116.928 46.354 23.729 1.00 0.00 O ATOM 55444 HO6A PGR 1352 116.444 46.952 24.327 1.00 0.00 H ATOM 55445 C12 OL 1353 118.765 47.023 28.717 1.00 0.00 C ATOM 55446 H2R OL 1353 118.138 46.340 28.139 1.00 0.00 H ATOM 55447 H2S OL 1353 119.237 46.294 29.379 1.00 0.00 H ATOM 55448 C13 OL 1353 118.093 48.108 29.456 1.00 0.00 C ATOM 55449 H3R OL 1353 118.837 48.669 30.025 1.00 0.00 H ATOM 55450 H3S OL 1353 117.751 48.866 28.748 1.00 0.00 H ATOM 55451 C14 OL 1353 117.028 47.667 30.440 1.00 0.00 C ATOM 55452 H4R OL 1353 116.438 46.962 29.851 1.00 0.00 H ATOM 55453 H4S OL 1353 117.432 47.087 31.273 1.00 0.00 H ATOM 55454 C15 OL 1353 116.184 48.789 31.193 1.00 0.00 C ATOM 55455 H5R OL 1353 116.721 49.340 31.968 1.00 0.00 H ATOM 55456 H5S OL 1353 115.850 49.540 30.474 1.00 0.00 H ATOM 55457 C16 OL 1353 114.832 48.212 31.757 1.00 0.00 C ATOM 55458 H6R OL 1353 114.261 47.626 31.034 1.00 0.00 H ATOM 55459 H6S OL 1353 114.969 47.531 32.600 1.00 0.00 H ATOM 55460 C17 OL 1353 113.845 49.265 32.401 1.00 0.00 C ATOM 55461 H7R OL 1353 113.271 49.710 31.586 1.00 0.00 H ATOM 55462 H7S OL 1353 113.076 48.791 33.015 1.00 0.00 H ATOM 55463 C18 OL 1353 114.463 50.189 33.343 1.00 0.00 C ATOM 55464 H8R OL 1353 115.019 50.917 32.748 1.00 0.00 H ATOM 55465 H8S OL 1353 113.661 50.772 33.800 1.00 0.00 H ATOM 55466 C19 OL 1353 115.301 49.510 34.416 1.00 0.00 C ATOM 55467 H9R OL 1353 115.796 48.574 34.170 1.00 0.00 H ATOM 55468 C110 OL 1353 115.633 49.996 35.608 1.00 0.00 C ATOM 55469 H10R OL 1353 116.218 49.479 36.365 1.00 0.00 H ATOM 55470 C111 OL 1353 115.048 51.220 36.253 1.00 0.00 C ATOM 55471 H11R OL 1353 115.683 52.053 35.945 1.00 0.00 H ATOM 55472 H11S OL 1353 114.012 51.333 35.926 1.00 0.00 H ATOM 55473 C112 OL 1353 115.069 51.316 37.799 1.00 0.00 C ATOM 55474 H12R OL 1353 114.618 52.199 38.258 1.00 0.00 H ATOM 55475 H12S OL 1353 114.461 50.503 38.201 1.00 0.00 H ATOM 55476 C113 OL 1353 116.367 51.208 38.450 1.00 0.00 C ATOM 55477 H13R OL 1353 117.035 50.535 37.909 1.00 0.00 H ATOM 55478 H13S OL 1353 116.890 52.141 38.230 1.00 0.00 H ATOM 55479 C114 OL 1353 116.282 50.950 39.953 1.00 0.00 C ATOM 55480 H14R OL 1353 115.528 51.655 40.311 1.00 0.00 H ATOM 55481 H14S OL 1353 116.067 49.897 40.148 1.00 0.00 H ATOM 55482 C115 OL 1353 117.642 51.234 40.580 1.00 0.00 C ATOM 55483 H15R OL 1353 118.433 50.624 40.137 1.00 0.00 H ATOM 55484 H15S OL 1353 117.823 52.194 40.091 1.00 0.00 H ATOM 55485 C116 OL 1353 117.786 51.087 42.123 1.00 0.00 C ATOM 55486 H16R OL 1353 118.852 51.139 42.356 1.00 0.00 H ATOM 55487 H16S OL 1353 117.275 51.917 42.615 1.00 0.00 H ATOM 55488 C117 OL 1353 117.155 49.875 42.786 1.00 0.00 C ATOM 55489 H17R OL 1353 116.069 49.904 42.677 1.00 0.00 H ATOM 55490 H17S OL 1353 117.356 49.006 42.157 1.00 0.00 H ATOM 55491 C118 OL 1353 117.546 49.707 44.207 1.00 0.00 C ATOM 55492 H18R OL 1353 117.101 48.835 44.691 1.00 0.00 H ATOM 55493 H18S OL 1353 117.238 50.645 44.674 1.00 0.00 H ATOM 55494 H18T OL 1353 118.636 49.649 44.182 1.00 0.00 H TER 55495 OL 1353 ATOM 55495 C116 PA 1354 98.303 53.447 43.349 1.00 0.00 C ATOM 55496 H16R PA 1354 97.362 53.825 43.753 1.00 0.00 H ATOM 55497 H16S PA 1354 98.951 54.223 43.762 1.00 0.00 H ATOM 55498 H16T PA 1354 98.604 52.533 43.866 1.00 0.00 H ATOM 55499 C115 PA 1354 98.244 53.289 41.872 1.00 0.00 C ATOM 55500 H15R PA 1354 99.193 53.349 41.336 1.00 0.00 H ATOM 55501 H15S PA 1354 97.638 53.938 41.237 1.00 0.00 H ATOM 55502 C114 PA 1354 97.751 51.949 41.498 1.00 0.00 C ATOM 55503 H14R PA 1354 96.952 51.525 42.110 1.00 0.00 H ATOM 55504 H14S PA 1354 98.602 51.304 41.725 1.00 0.00 H ATOM 55505 C113 PA 1354 97.386 51.616 40.032 1.00 0.00 C ATOM 55506 H13R PA 1354 96.504 52.184 39.731 1.00 0.00 H ATOM 55507 H13S PA 1354 96.961 50.612 39.984 1.00 0.00 H ATOM 55508 C112 PA 1354 98.559 51.748 39.049 1.00 0.00 C ATOM 55509 H12R PA 1354 99.391 51.146 39.420 1.00 0.00 H ATOM 55510 H12S PA 1354 98.851 52.800 39.075 1.00 0.00 H ATOM 55511 C111 PA 1354 98.232 51.138 37.642 1.00 0.00 C ATOM 55512 H11R PA 1354 97.388 51.630 37.154 1.00 0.00 H ATOM 55513 H11S PA 1354 98.056 50.070 37.784 1.00 0.00 H ATOM 55514 C110 PA 1354 99.380 51.243 36.694 1.00 0.00 C ATOM 55515 H10R PA 1354 100.192 50.668 37.143 1.00 0.00 H ATOM 55516 H10S PA 1354 99.659 52.293 36.584 1.00 0.00 H ATOM 55517 C19 PA 1354 99.276 50.742 35.185 1.00 0.00 C ATOM 55518 H9R PA 1354 100.260 50.911 34.743 1.00 0.00 H ATOM 55519 H9S PA 1354 98.569 51.344 34.611 1.00 0.00 H ATOM 55520 C18 PA 1354 98.904 49.158 34.896 1.00 0.00 C ATOM 55521 H8R PA 1354 97.858 48.971 35.148 1.00 0.00 H ATOM 55522 H8S PA 1354 99.302 48.446 35.621 1.00 0.00 H ATOM 55523 C17 PA 1354 99.236 48.735 33.494 1.00 0.00 C ATOM 55524 H7R PA 1354 100.250 49.075 33.275 1.00 0.00 H ATOM 55525 H7S PA 1354 98.745 49.200 32.637 1.00 0.00 H ATOM 55526 C16 PA 1354 99.328 47.222 33.129 1.00 0.00 C ATOM 55527 H6R PA 1354 100.174 46.775 33.655 1.00 0.00 H ATOM 55528 H6S PA 1354 99.518 47.036 32.070 1.00 0.00 H ATOM 55529 C15 PA 1354 98.069 46.400 33.442 1.00 0.00 C ATOM 55530 H5R PA 1354 97.903 46.595 34.504 1.00 0.00 H ATOM 55531 H5S PA 1354 98.349 45.353 33.312 1.00 0.00 H ATOM 55532 C14 PA 1354 96.809 46.684 32.661 1.00 0.00 C ATOM 55533 H4R PA 1354 96.382 47.590 33.094 1.00 0.00 H ATOM 55534 H4S PA 1354 96.045 45.915 32.795 1.00 0.00 H ATOM 55535 C13 PA 1354 97.044 47.079 31.194 1.00 0.00 C ATOM 55536 H3R PA 1354 97.724 46.356 30.738 1.00 0.00 H ATOM 55537 H3S PA 1354 97.519 48.054 31.068 1.00 0.00 H ATOM 55538 C12 PA 1354 95.725 47.175 30.442 1.00 0.00 C ATOM 55539 H2R PA 1354 95.282 48.080 30.863 1.00 0.00 H ATOM 55540 H2S PA 1354 95.059 46.335 30.648 1.00 0.00 H ATOM 55541 C11 PGR 1355 95.809 47.324 28.918 1.00 0.00 C ATOM 55542 O12 PGR 1355 94.900 47.060 28.146 1.00 0.00 O ATOM 55543 O11 PGR 1355 96.924 47.948 28.523 1.00 0.00 O ATOM 55544 C1 PGR 1355 97.410 48.106 27.218 1.00 0.00 C ATOM 55545 HR PGR 1355 96.631 48.227 26.462 1.00 0.00 H ATOM 55546 HS PGR 1355 97.995 47.228 26.929 1.00 0.00 H ATOM 55547 C2 PGR 1355 98.171 49.450 27.189 1.00 0.00 C ATOM 55548 HX PGR 1355 97.483 50.249 27.478 1.00 0.00 H ATOM 55549 C3 PGR 1355 98.808 49.743 25.758 1.00 0.00 C ATOM 55550 HA PGR 1355 99.620 50.468 25.851 1.00 0.00 H ATOM 55551 HB PGR 1355 97.989 50.183 25.183 1.00 0.00 H ATOM 55552 O31 PGR 1355 99.249 48.536 25.112 1.00 0.00 O ATOM 55553 P31 PGR 1355 99.573 48.454 23.584 1.00 0.00 P ATOM 55554 O32 PGR 1355 100.740 49.580 23.464 1.00 0.00 O ATOM 55555 C31 PGR 1355 102.119 49.325 23.668 1.00 0.00 C ATOM 55556 H1A PGR 1355 102.350 48.375 23.179 1.00 0.00 H ATOM 55557 H1B PGR 1355 102.327 49.294 24.740 1.00 0.00 H ATOM 55558 C32 PGR 1355 102.814 50.564 22.938 1.00 0.00 C ATOM 55559 H2A PGR 1355 102.301 51.508 23.137 1.00 0.00 H ATOM 55560 O35 PGR 1355 102.722 50.247 21.547 1.00 0.00 O ATOM 55561 HO5A PGR 1355 101.793 50.439 21.323 1.00 0.00 H ATOM 55562 C33 PGR 1355 104.305 50.698 23.421 1.00 0.00 C ATOM 55563 H3A PGR 1355 104.554 51.756 23.312 1.00 0.00 H ATOM 55564 H3B PGR 1355 104.330 50.431 24.480 1.00 0.00 H ATOM 55565 O33 PGR 1355 100.081 47.139 23.238 1.00 0.00 O ATOM 55566 O34 PGR 1355 98.379 48.839 22.735 1.00 0.00 O ATOM 55567 O21 PGR 1355 99.255 49.371 28.180 1.00 0.00 O ATOM 55568 C21 PGR 1355 99.665 50.553 28.702 1.00 0.00 C ATOM 55569 O22 PGR 1355 99.377 51.632 28.197 1.00 0.00 O ATOM 55570 O36 PGR 1355 105.084 49.792 22.621 1.00 0.00 O ATOM 55571 HO6A PGR 1355 104.789 48.917 22.931 1.00 0.00 H ATOM 55572 C12 OL 1356 100.590 50.487 29.856 1.00 0.00 C ATOM 55573 H2R OL 1356 100.027 50.273 30.767 1.00 0.00 H ATOM 55574 H2S OL 1356 101.291 49.653 29.786 1.00 0.00 H ATOM 55575 C13 OL 1356 101.296 51.845 30.088 1.00 0.00 C ATOM 55576 H3R OL 1356 101.758 52.165 29.152 1.00 0.00 H ATOM 55577 H3S OL 1356 100.695 52.725 30.328 1.00 0.00 H ATOM 55578 C14 OL 1356 102.472 51.715 31.107 1.00 0.00 C ATOM 55579 H4R OL 1356 103.102 50.987 30.589 1.00 0.00 H ATOM 55580 H4S OL 1356 103.006 52.665 31.172 1.00 0.00 H ATOM 55581 C15 OL 1356 102.089 51.243 32.543 1.00 0.00 C ATOM 55582 H5R OL 1356 101.887 52.190 33.046 1.00 0.00 H ATOM 55583 H5S OL 1356 101.091 50.806 32.474 1.00 0.00 H ATOM 55584 C16 OL 1356 103.136 50.292 33.179 1.00 0.00 C ATOM 55585 H6R OL 1356 104.029 50.860 33.447 1.00 0.00 H ATOM 55586 H6S OL 1356 102.732 50.062 34.167 1.00 0.00 H ATOM 55587 C17 OL 1356 103.519 49.011 32.485 1.00 0.00 C ATOM 55588 H7R OL 1356 102.592 48.479 32.261 1.00 0.00 H ATOM 55589 H7S OL 1356 103.977 49.296 31.535 1.00 0.00 H ATOM 55590 C18 OL 1356 104.455 48.100 33.253 1.00 0.00 C ATOM 55591 H8R OL 1356 104.101 48.185 34.282 1.00 0.00 H ATOM 55592 H8S OL 1356 104.450 47.080 32.864 1.00 0.00 H ATOM 55593 C19 OL 1356 105.823 48.611 33.191 1.00 0.00 C ATOM 55594 H9R OL 1356 106.297 48.503 32.218 1.00 0.00 H ATOM 55595 C110 OL 1356 106.577 49.054 34.201 1.00 0.00 C ATOM 55596 H10R OL 1356 107.634 49.009 33.954 1.00 0.00 H ATOM 55597 C111 OL 1356 106.209 49.423 35.614 1.00 0.00 C ATOM 55598 H11R OL 1356 106.453 50.473 35.789 1.00 0.00 H ATOM 55599 H11S OL 1356 105.122 49.352 35.695 1.00 0.00 H ATOM 55600 C112 OL 1356 106.785 48.444 36.613 1.00 0.00 C ATOM 55601 H12R OL 1356 106.349 47.478 36.350 1.00 0.00 H ATOM 55602 H12S OL 1356 107.857 48.247 36.540 1.00 0.00 H ATOM 55603 C113 OL 1356 106.631 48.872 38.102 1.00 0.00 C ATOM 55604 H13R OL 1356 107.225 48.284 38.805 1.00 0.00 H ATOM 55605 H13S OL 1356 106.993 49.902 38.057 1.00 0.00 H ATOM 55606 C114 OL 1356 105.224 48.821 38.518 1.00 0.00 C ATOM 55607 H14R OL 1356 104.568 49.340 37.816 1.00 0.00 H ATOM 55608 H14S OL 1356 104.789 47.821 38.569 1.00 0.00 H ATOM 55609 C115 OL 1356 104.934 49.382 39.846 1.00 0.00 C ATOM 55610 H15R OL 1356 105.153 48.638 40.614 1.00 0.00 H ATOM 55611 H15S OL 1356 105.561 50.253 40.046 1.00 0.00 H ATOM 55612 C116 OL 1356 103.546 49.966 40.083 1.00 0.00 C ATOM 55613 H16R OL 1356 103.255 50.434 39.141 1.00 0.00 H ATOM 55614 H16S OL 1356 102.841 49.132 40.082 1.00 0.00 H ATOM 55615 C117 OL 1356 103.401 50.807 41.358 1.00 0.00 C ATOM 55616 H17R OL 1356 103.346 50.177 42.249 1.00 0.00 H ATOM 55617 H17S OL 1356 104.183 51.567 41.417 1.00 0.00 H ATOM 55618 C118 OL 1356 102.141 51.669 41.339 1.00 0.00 C ATOM 55619 H18R OL 1356 102.293 52.368 40.515 1.00 0.00 H ATOM 55620 H18S OL 1356 102.142 52.311 42.223 1.00 0.00 H ATOM 55621 H18T OL 1356 101.155 51.205 41.271 1.00 0.00 H TER 55622 OL 1356 ATOM 55622 C116 PA 1357 19.687 37.483 45.821 1.00 0.00 C ATOM 55623 H16R PA 1357 20.636 37.429 46.359 1.00 0.00 H ATOM 55624 H16S PA 1357 18.925 37.076 46.489 1.00 0.00 H ATOM 55625 H16T PA 1357 19.504 38.525 45.550 1.00 0.00 H ATOM 55626 C115 PA 1357 19.909 36.706 44.562 1.00 0.00 C ATOM 55627 H15R PA 1357 19.738 35.670 44.860 1.00 0.00 H ATOM 55628 H15S PA 1357 20.976 36.539 44.404 1.00 0.00 H ATOM 55629 C114 PA 1357 19.079 37.200 43.360 1.00 0.00 C ATOM 55630 H14R PA 1357 19.101 38.291 43.414 1.00 0.00 H ATOM 55631 H14S PA 1357 18.009 36.985 43.344 1.00 0.00 H ATOM 55632 C113 PA 1357 19.579 36.559 42.081 1.00 0.00 C ATOM 55633 H13R PA 1357 20.665 36.575 41.972 1.00 0.00 H ATOM 55634 H13S PA 1357 19.296 37.232 41.269 1.00 0.00 H ATOM 55635 C112 PA 1357 19.084 35.174 41.963 1.00 0.00 C ATOM 55636 H12R PA 1357 18.027 35.153 42.236 1.00 0.00 H ATOM 55637 H12S PA 1357 19.474 34.547 42.767 1.00 0.00 H ATOM 55638 C111 PA 1357 19.306 34.542 40.531 1.00 0.00 C ATOM 55639 H11R PA 1357 20.357 34.318 40.340 1.00 0.00 H ATOM 55640 H11S PA 1357 19.081 35.237 39.720 1.00 0.00 H ATOM 55641 C110 PA 1357 18.582 33.199 40.231 1.00 0.00 C ATOM 55642 H10R PA 1357 17.498 33.315 40.291 1.00 0.00 H ATOM 55643 H10S PA 1357 18.741 32.448 41.007 1.00 0.00 H ATOM 55644 C19 PA 1357 18.991 32.639 38.911 1.00 0.00 C ATOM 55645 H9R PA 1357 20.074 32.497 38.932 1.00 0.00 H ATOM 55646 H9S PA 1357 18.768 33.305 38.074 1.00 0.00 H ATOM 55647 C18 PA 1357 18.249 31.300 38.573 1.00 0.00 C ATOM 55648 H8R PA 1357 17.179 31.365 38.783 1.00 0.00 H ATOM 55649 H8S PA 1357 18.593 30.451 39.166 1.00 0.00 H ATOM 55650 C17 PA 1357 18.362 31.038 37.107 1.00 0.00 C ATOM 55651 H7R PA 1357 19.389 31.223 36.786 1.00 0.00 H ATOM 55652 H7S PA 1357 17.817 31.796 36.541 1.00 0.00 H ATOM 55653 C16 PA 1357 17.901 29.574 36.665 1.00 0.00 C ATOM 55654 H6R PA 1357 16.888 29.394 37.032 1.00 0.00 H ATOM 55655 H6S PA 1357 18.597 28.844 37.081 1.00 0.00 H ATOM 55656 C15 PA 1357 17.921 29.448 35.152 1.00 0.00 C ATOM 55657 H5R PA 1357 18.833 29.878 34.734 1.00 0.00 H ATOM 55658 H5S PA 1357 17.085 30.026 34.753 1.00 0.00 H ATOM 55659 C14 PA 1357 17.661 28.002 34.672 1.00 0.00 C ATOM 55660 H4R PA 1357 17.446 27.953 33.603 1.00 0.00 H ATOM 55661 H4S PA 1357 16.704 27.791 35.155 1.00 0.00 H ATOM 55662 C13 PA 1357 18.621 26.959 35.128 1.00 0.00 C ATOM 55663 H3R PA 1357 18.254 26.032 34.681 1.00 0.00 H ATOM 55664 H3S PA 1357 18.553 26.870 36.214 1.00 0.00 H ATOM 55665 C12 PA 1357 20.111 27.159 34.651 1.00 0.00 C ATOM 55666 H2R PA 1357 20.619 26.293 35.080 1.00 0.00 H ATOM 55667 H2S PA 1357 20.461 28.117 35.041 1.00 0.00 H ATOM 55668 C11 PGR 1358 20.192 27.110 33.135 1.00 0.00 C ATOM 55669 O12 PGR 1358 19.293 26.974 32.356 1.00 0.00 O ATOM 55670 O11 PGR 1358 21.465 27.102 32.771 1.00 0.00 O ATOM 55671 C1 PGR 1358 21.762 27.020 31.396 1.00 0.00 C ATOM 55672 HR PGR 1358 21.089 26.344 30.863 1.00 0.00 H ATOM 55673 HS PGR 1358 22.794 26.666 31.323 1.00 0.00 H ATOM 55674 C2 PGR 1358 21.540 28.392 30.747 1.00 0.00 C ATOM 55675 HX PGR 1358 20.516 28.758 30.859 1.00 0.00 H ATOM 55676 C3 PGR 1358 21.790 28.233 29.252 1.00 0.00 C ATOM 55677 HA PGR 1358 21.597 29.196 28.774 1.00 0.00 H ATOM 55678 HB PGR 1358 21.009 27.568 28.875 1.00 0.00 H ATOM 55679 O31 PGR 1358 23.040 27.771 28.827 1.00 0.00 O ATOM 55680 P31 PGR 1358 23.511 27.709 27.328 1.00 0.00 P ATOM 55681 O32 PGR 1358 23.915 29.154 26.952 1.00 0.00 O ATOM 55682 C31 PGR 1358 24.684 29.965 27.802 1.00 0.00 C ATOM 55683 H1A PGR 1358 25.652 29.484 27.964 1.00 0.00 H ATOM 55684 H1B PGR 1358 24.169 29.884 28.762 1.00 0.00 H ATOM 55685 C32 PGR 1358 24.690 31.461 27.341 1.00 0.00 C ATOM 55686 H2A PGR 1358 25.082 32.066 28.162 1.00 0.00 H ATOM 55687 O35 PGR 1358 23.369 31.977 27.174 1.00 0.00 O ATOM 55688 HO5A PGR 1358 22.801 31.216 26.956 1.00 0.00 H ATOM 55689 C33 PGR 1358 25.522 31.692 26.109 1.00 0.00 C ATOM 55690 H3A PGR 1358 25.708 32.766 26.021 1.00 0.00 H ATOM 55691 H3B PGR 1358 26.464 31.200 26.366 1.00 0.00 H ATOM 55692 O33 PGR 1358 24.723 26.842 27.239 1.00 0.00 O ATOM 55693 O34 PGR 1358 22.376 27.323 26.547 1.00 0.00 O ATOM 55694 O21 PGR 1358 22.544 29.264 31.333 1.00 0.00 O ATOM 55695 C21 PGR 1358 22.644 30.567 31.051 1.00 0.00 C ATOM 55696 O22 PGR 1358 21.773 31.223 30.592 1.00 0.00 O ATOM 55697 O36 PGR 1358 24.849 31.247 24.905 1.00 0.00 O ATOM 55698 HO6A PGR 1358 24.532 30.327 24.927 1.00 0.00 H ATOM 55699 C12 OL 1359 24.008 31.142 31.417 1.00 0.00 C ATOM 55700 H2R OL 1359 24.360 31.648 30.516 1.00 0.00 H ATOM 55701 H2S OL 1359 23.788 31.743 32.301 1.00 0.00 H ATOM 55702 C13 OL 1359 25.031 30.036 31.686 1.00 0.00 C ATOM 55703 H3R OL 1359 24.659 29.546 32.588 1.00 0.00 H ATOM 55704 H3S OL 1359 25.005 29.261 30.917 1.00 0.00 H ATOM 55705 C14 OL 1359 26.437 30.524 31.879 1.00 0.00 C ATOM 55706 H4R OL 1359 27.157 29.791 32.249 1.00 0.00 H ATOM 55707 H4S OL 1359 26.886 30.877 30.949 1.00 0.00 H ATOM 55708 C15 OL 1359 26.711 31.645 32.872 1.00 0.00 C ATOM 55709 H5R OL 1359 27.771 31.885 32.769 1.00 0.00 H ATOM 55710 H5S OL 1359 26.277 32.590 32.539 1.00 0.00 H ATOM 55711 C16 OL 1359 26.518 31.333 34.354 1.00 0.00 C ATOM 55712 H6R OL 1359 25.479 31.011 34.445 1.00 0.00 H ATOM 55713 H6S OL 1359 27.212 30.501 34.489 1.00 0.00 H ATOM 55714 C17 OL 1359 26.796 32.517 35.302 1.00 0.00 C ATOM 55715 H7R OL 1359 27.756 32.875 34.923 1.00 0.00 H ATOM 55716 H7S OL 1359 26.193 33.425 35.236 1.00 0.00 H ATOM 55717 C18 OL 1359 27.198 32.139 36.707 1.00 0.00 C ATOM 55718 H8R OL 1359 26.274 31.847 37.211 1.00 0.00 H ATOM 55719 H8S OL 1359 27.831 31.256 36.599 1.00 0.00 H ATOM 55720 C19 OL 1359 27.777 33.222 37.456 1.00 0.00 C ATOM 55721 H9R OL 1359 27.921 34.144 36.899 1.00 0.00 H ATOM 55722 C110 OL 1359 28.074 33.285 38.752 1.00 0.00 C ATOM 55723 H10R OL 1359 28.558 34.138 39.220 1.00 0.00 H ATOM 55724 C111 OL 1359 27.785 32.121 39.715 1.00 0.00 C ATOM 55725 H11R OL 1359 27.664 31.202 39.137 1.00 0.00 H ATOM 55726 H11S OL 1359 28.694 31.978 40.303 1.00 0.00 H ATOM 55727 C112 OL 1359 26.629 32.437 40.682 1.00 0.00 C ATOM 55728 H12R OL 1359 26.670 33.487 40.980 1.00 0.00 H ATOM 55729 H12S OL 1359 25.686 32.286 40.153 1.00 0.00 H ATOM 55730 C113 OL 1359 26.620 31.616 42.015 1.00 0.00 C ATOM 55731 H13R OL 1359 25.679 31.803 42.536 1.00 0.00 H ATOM 55732 H13S OL 1359 26.635 30.535 41.860 1.00 0.00 H ATOM 55733 C114 OL 1359 27.781 31.862 43.009 1.00 0.00 C ATOM 55734 H14R OL 1359 28.708 31.567 42.514 1.00 0.00 H ATOM 55735 H14S OL 1359 27.863 32.918 43.276 1.00 0.00 H ATOM 55736 C115 OL 1359 27.527 31.080 44.360 1.00 0.00 C ATOM 55737 H15R OL 1359 26.511 31.253 44.721 1.00 0.00 H ATOM 55738 H15S OL 1359 27.650 30.021 44.123 1.00 0.00 H ATOM 55739 C116 OL 1359 28.531 31.508 45.455 1.00 0.00 C ATOM 55740 H16R OL 1359 29.544 31.441 45.054 1.00 0.00 H ATOM 55741 H16S OL 1359 28.409 32.579 45.628 1.00 0.00 H ATOM 55742 C117 OL 1359 28.208 30.825 46.788 1.00 0.00 C ATOM 55743 H17R OL 1359 27.154 30.985 47.023 1.00 0.00 H ATOM 55744 H17S OL 1359 28.408 29.760 46.652 1.00 0.00 H ATOM 55745 C118 OL 1359 29.089 31.155 48.009 1.00 0.00 C ATOM 55746 H18R OL 1359 30.130 31.110 47.682 1.00 0.00 H ATOM 55747 H18S OL 1359 28.915 30.391 48.770 1.00 0.00 H ATOM 55748 H18T OL 1359 29.048 32.067 48.609 1.00 0.00 H TER 55749 OL 1359 ATOM 55749 C116 PA 1360 17.658 66.509 38.811 1.00 0.00 C ATOM 55750 H16R PA 1360 16.904 66.785 39.550 1.00 0.00 H ATOM 55751 H16S PA 1360 18.681 66.720 39.129 1.00 0.00 H ATOM 55752 H16T PA 1360 17.594 65.441 38.591 1.00 0.00 H ATOM 55753 C115 PA 1360 17.325 67.415 37.589 1.00 0.00 C ATOM 55754 H15R PA 1360 16.948 68.412 37.825 1.00 0.00 H ATOM 55755 H15S PA 1360 16.349 67.042 37.273 1.00 0.00 H ATOM 55756 C114 PA 1360 18.422 67.411 36.518 1.00 0.00 C ATOM 55757 H14R PA 1360 18.710 66.420 36.160 1.00 0.00 H ATOM 55758 H14S PA 1360 19.315 67.819 36.996 1.00 0.00 H ATOM 55759 C113 PA 1360 18.219 68.314 35.294 1.00 0.00 C ATOM 55760 H13R PA 1360 19.122 68.472 34.700 1.00 0.00 H ATOM 55761 H13S PA 1360 17.716 69.241 35.575 1.00 0.00 H ATOM 55762 C112 PA 1360 17.282 67.721 34.248 1.00 0.00 C ATOM 55763 H12R PA 1360 16.248 67.625 34.584 1.00 0.00 H ATOM 55764 H12S PA 1360 17.528 66.749 33.816 1.00 0.00 H ATOM 55765 C111 PA 1360 17.105 68.548 32.955 1.00 0.00 C ATOM 55766 H11R PA 1360 18.072 68.638 32.456 1.00 0.00 H ATOM 55767 H11S PA 1360 16.868 69.577 33.234 1.00 0.00 H ATOM 55768 C110 PA 1360 16.010 67.917 32.147 1.00 0.00 C ATOM 55769 H10R PA 1360 15.036 67.951 32.639 1.00 0.00 H ATOM 55770 H10S PA 1360 16.161 66.839 32.055 1.00 0.00 H ATOM 55771 C19 PA 1360 15.842 68.667 30.860 1.00 0.00 C ATOM 55772 H9R PA 1360 16.825 68.853 30.422 1.00 0.00 H ATOM 55773 H9S PA 1360 15.454 69.649 31.140 1.00 0.00 H ATOM 55774 C18 PA 1360 14.971 68.014 29.830 1.00 0.00 C ATOM 55775 H8R PA 1360 13.936 68.273 30.064 1.00 0.00 H ATOM 55776 H8S PA 1360 15.258 66.962 29.883 1.00 0.00 H ATOM 55777 C17 PA 1360 15.163 68.461 28.399 1.00 0.00 C ATOM 55778 H7R PA 1360 16.192 68.761 28.191 1.00 0.00 H ATOM 55779 H7S PA 1360 14.629 69.408 28.301 1.00 0.00 H ATOM 55780 C16 PA 1360 14.897 67.363 27.325 1.00 0.00 C ATOM 55781 H6R PA 1360 13.821 67.174 27.314 1.00 0.00 H ATOM 55782 H6S PA 1360 15.496 66.503 27.631 1.00 0.00 H ATOM 55783 C15 PA 1360 15.262 67.795 25.871 1.00 0.00 C ATOM 55784 H5R PA 1360 16.274 68.180 25.733 1.00 0.00 H ATOM 55785 H5S PA 1360 14.611 68.644 25.653 1.00 0.00 H ATOM 55786 C14 PA 1360 14.973 66.738 24.719 1.00 0.00 C ATOM 55787 H4R PA 1360 13.943 66.376 24.736 1.00 0.00 H ATOM 55788 H4S PA 1360 15.673 65.923 24.915 1.00 0.00 H ATOM 55789 C13 PA 1360 15.245 67.345 23.388 1.00 0.00 C ATOM 55790 H3R PA 1360 16.106 68.015 23.445 1.00 0.00 H ATOM 55791 H3S PA 1360 14.406 67.964 23.065 1.00 0.00 H ATOM 55792 C12 PA 1360 15.389 66.239 22.245 1.00 0.00 C ATOM 55793 H2R PA 1360 14.539 65.558 22.312 1.00 0.00 H ATOM 55794 H2S PA 1360 16.323 65.683 22.346 1.00 0.00 H ATOM 55795 C11 PGR 1361 15.335 66.784 20.864 1.00 0.00 C ATOM 55796 O12 PGR 1361 14.691 67.758 20.620 1.00 0.00 O ATOM 55797 O11 PGR 1361 16.141 66.106 20.084 1.00 0.00 O ATOM 55798 C1 PGR 1361 16.280 66.473 18.647 1.00 0.00 C ATOM 55799 HR PGR 1361 15.362 66.533 18.057 1.00 0.00 H ATOM 55800 HS PGR 1361 16.913 65.749 18.129 1.00 0.00 H ATOM 55801 C2 PGR 1361 16.981 67.792 18.558 1.00 0.00 C ATOM 55802 HX PGR 1361 16.542 68.536 19.226 1.00 0.00 H ATOM 55803 C3 PGR 1361 17.002 68.234 17.056 1.00 0.00 C ATOM 55804 HA PGR 1361 15.963 68.345 16.733 1.00 0.00 H ATOM 55805 HB PGR 1361 17.574 67.605 16.370 1.00 0.00 H ATOM 55806 O31 PGR 1361 17.688 69.522 16.992 1.00 0.00 O ATOM 55807 P31 PGR 1361 18.284 69.996 15.607 1.00 0.00 P ATOM 55808 O32 PGR 1361 18.334 71.582 15.636 1.00 0.00 O ATOM 55809 C31 PGR 1361 17.117 72.295 15.638 1.00 0.00 C ATOM 55810 H1A PGR 1361 16.523 72.064 16.526 1.00 0.00 H ATOM 55811 H1B PGR 1361 16.414 71.990 14.858 1.00 0.00 H ATOM 55812 C32 PGR 1361 17.352 73.808 15.448 1.00 0.00 C ATOM 55813 H2A PGR 1361 16.397 74.067 14.983 1.00 0.00 H ATOM 55814 O35 PGR 1361 18.330 74.092 14.438 1.00 0.00 O ATOM 55815 HO5A PGR 1361 19.098 73.578 14.745 1.00 0.00 H ATOM 55816 C33 PGR 1361 17.371 74.714 16.701 1.00 0.00 C ATOM 55817 H3A PGR 1361 17.428 75.763 16.399 1.00 0.00 H ATOM 55818 H3B PGR 1361 16.395 74.710 17.193 1.00 0.00 H ATOM 55819 O33 PGR 1361 19.698 69.605 15.555 1.00 0.00 O ATOM 55820 O34 PGR 1361 17.394 69.564 14.539 1.00 0.00 O ATOM 55821 O21 PGR 1361 18.347 67.548 18.892 1.00 0.00 O ATOM 55822 C21 PGR 1361 18.655 67.417 20.198 1.00 0.00 C ATOM 55823 O22 PGR 1361 17.917 67.737 21.061 1.00 0.00 O ATOM 55824 O36 PGR 1361 18.467 74.361 17.548 1.00 0.00 O ATOM 55825 HO6A PGR 1361 19.227 74.104 16.995 1.00 0.00 H ATOM 55826 C12 OL 1362 20.105 67.059 20.511 1.00 0.00 C ATOM 55827 H2R OL 1362 20.620 66.927 19.557 1.00 0.00 H ATOM 55828 H2S OL 1362 20.612 67.944 20.902 1.00 0.00 H ATOM 55829 C13 OL 1362 20.449 65.767 21.317 1.00 0.00 C ATOM 55830 H3R OL 1362 20.026 64.893 20.819 1.00 0.00 H ATOM 55831 H3S OL 1362 21.494 65.636 21.026 1.00 0.00 H ATOM 55832 C14 OL 1362 20.181 65.828 22.767 1.00 0.00 C ATOM 55833 H4R OL 1362 21.088 65.659 23.352 1.00 0.00 H ATOM 55834 H4S OL 1362 19.932 66.862 23.016 1.00 0.00 H ATOM 55835 C15 OL 1362 19.078 64.903 23.238 1.00 0.00 C ATOM 55836 H5R OL 1362 18.318 64.749 22.469 1.00 0.00 H ATOM 55837 H5S OL 1362 19.577 63.941 23.377 1.00 0.00 H ATOM 55838 C16 OL 1362 18.404 65.456 24.467 1.00 0.00 C ATOM 55839 H6R OL 1362 17.907 66.402 24.243 1.00 0.00 H ATOM 55840 H6S OL 1362 17.549 64.812 24.683 1.00 0.00 H ATOM 55841 C17 OL 1362 19.267 65.754 25.696 1.00 0.00 C ATOM 55842 H7R OL 1362 19.758 64.843 26.044 1.00 0.00 H ATOM 55843 H7S OL 1362 20.151 66.340 25.435 1.00 0.00 H ATOM 55844 C18 OL 1362 18.557 66.469 26.880 1.00 0.00 C ATOM 55845 H8R OL 1362 18.186 67.405 26.457 1.00 0.00 H ATOM 55846 H8S OL 1362 17.636 65.997 27.228 1.00 0.00 H ATOM 55847 C19 OL 1362 19.549 66.609 28.005 1.00 0.00 C ATOM 55848 H9R OL 1362 20.535 66.928 27.678 1.00 0.00 H ATOM 55849 C110 OL 1362 19.309 66.252 29.266 1.00 0.00 C ATOM 55850 H10R OL 1362 20.100 66.306 30.009 1.00 0.00 H ATOM 55851 C111 OL 1362 17.990 65.793 29.866 1.00 0.00 C ATOM 55852 H11R OL 1362 17.651 66.441 30.677 1.00 0.00 H ATOM 55853 H11S OL 1362 17.201 65.926 29.123 1.00 0.00 H ATOM 55854 C112 OL 1362 18.093 64.316 30.382 1.00 0.00 C ATOM 55855 H12R OL 1362 18.599 63.677 29.655 1.00 0.00 H ATOM 55856 H12S OL 1362 18.772 64.173 31.226 1.00 0.00 H ATOM 55857 C113 OL 1362 16.784 63.581 30.636 1.00 0.00 C ATOM 55858 H13R OL 1362 16.157 64.056 31.394 1.00 0.00 H ATOM 55859 H13S OL 1362 16.237 63.695 29.698 1.00 0.00 H ATOM 55860 C114 OL 1362 16.829 61.997 30.935 1.00 0.00 C ATOM 55861 H14R OL 1362 17.110 61.318 30.127 1.00 0.00 H ATOM 55862 H14S OL 1362 17.543 61.734 31.719 1.00 0.00 H ATOM 55863 C115 OL 1362 15.538 61.497 31.496 1.00 0.00 C ATOM 55864 H15R OL 1362 15.143 62.195 32.237 1.00 0.00 H ATOM 55865 H15S OL 1362 14.779 61.480 30.711 1.00 0.00 H ATOM 55866 C116 OL 1362 15.684 60.097 32.152 1.00 0.00 C ATOM 55867 H16R OL 1362 16.485 59.687 31.532 1.00 0.00 H ATOM 55868 H16S OL 1362 16.196 60.268 33.101 1.00 0.00 H ATOM 55869 C117 OL 1362 14.342 59.254 32.395 1.00 0.00 C ATOM 55870 H17R OL 1362 14.162 58.871 31.388 1.00 0.00 H ATOM 55871 H17S OL 1362 14.448 58.356 33.007 1.00 0.00 H ATOM 55872 C118 OL 1362 13.240 60.003 33.123 1.00 0.00 C ATOM 55873 H18R OL 1362 12.669 60.688 32.493 1.00 0.00 H ATOM 55874 H18S OL 1362 13.455 60.350 34.136 1.00 0.00 H ATOM 55875 H18T OL 1362 12.497 59.249 33.392 1.00 0.00 H TER 55876 OL 1362 ATOM 55876 C116 PA 1363 97.590 83.686 42.118 1.00 0.00 C ATOM 55877 H16R PA 1363 98.414 82.995 41.927 1.00 0.00 H ATOM 55878 H16S PA 1363 96.731 83.013 42.071 1.00 0.00 H ATOM 55879 H16T PA 1363 97.717 84.110 43.117 1.00 0.00 H ATOM 55880 C115 PA 1363 97.596 84.925 41.232 1.00 0.00 C ATOM 55881 H15R PA 1363 98.217 84.689 40.366 1.00 0.00 H ATOM 55882 H15S PA 1363 98.284 85.623 41.714 1.00 0.00 H ATOM 55883 C114 PA 1363 96.241 85.598 41.035 1.00 0.00 C ATOM 55884 H14R PA 1363 96.402 86.598 40.627 1.00 0.00 H ATOM 55885 H14S PA 1363 95.807 85.767 42.023 1.00 0.00 H ATOM 55886 C113 PA 1363 95.264 84.823 40.118 1.00 0.00 C ATOM 55887 H13R PA 1363 94.276 85.284 40.179 1.00 0.00 H ATOM 55888 H13S PA 1363 95.178 83.817 40.534 1.00 0.00 H ATOM 55889 C112 PA 1363 95.494 84.797 38.603 1.00 0.00 C ATOM 55890 H12R PA 1363 96.501 84.380 38.536 1.00 0.00 H ATOM 55891 H12S PA 1363 95.617 85.786 38.157 1.00 0.00 H ATOM 55892 C111 PA 1363 94.352 84.145 37.894 1.00 0.00 C ATOM 55893 H11R PA 1363 93.427 84.716 38.001 1.00 0.00 H ATOM 55894 H11S PA 1363 94.198 83.171 38.362 1.00 0.00 H ATOM 55895 C110 PA 1363 94.492 84.007 36.316 1.00 0.00 C ATOM 55896 H10R PA 1363 93.556 83.744 35.821 1.00 0.00 H ATOM 55897 H10S PA 1363 95.109 83.172 35.977 1.00 0.00 H ATOM 55898 C19 PA 1363 94.941 85.210 35.462 1.00 0.00 C ATOM 55899 H9R PA 1363 95.007 84.833 34.440 1.00 0.00 H ATOM 55900 H9S PA 1363 95.973 85.480 35.696 1.00 0.00 H ATOM 55901 C18 PA 1363 94.099 86.442 35.848 1.00 0.00 C ATOM 55902 H8R PA 1363 94.544 87.016 36.663 1.00 0.00 H ATOM 55903 H8S PA 1363 93.128 86.154 36.256 1.00 0.00 H ATOM 55904 C17 PA 1363 93.868 87.322 34.625 1.00 0.00 C ATOM 55905 H7R PA 1363 92.894 87.793 34.775 1.00 0.00 H ATOM 55906 H7S PA 1363 93.733 86.665 33.763 1.00 0.00 H ATOM 55907 C16 PA 1363 94.848 88.396 34.276 1.00 0.00 C ATOM 55908 H6R PA 1363 95.362 88.849 35.126 1.00 0.00 H ATOM 55909 H6S PA 1363 94.223 89.115 33.743 1.00 0.00 H ATOM 55910 C15 PA 1363 95.923 87.926 33.322 1.00 0.00 C ATOM 55911 H5R PA 1363 96.465 87.065 33.717 1.00 0.00 H ATOM 55912 H5S PA 1363 96.681 88.711 33.275 1.00 0.00 H ATOM 55913 C14 PA 1363 95.408 87.574 31.938 1.00 0.00 C ATOM 55914 H4R PA 1363 94.968 88.451 31.458 1.00 0.00 H ATOM 55915 H4S PA 1363 94.579 86.867 32.014 1.00 0.00 H ATOM 55916 C13 PA 1363 96.469 86.979 31.065 1.00 0.00 C ATOM 55917 H3R PA 1363 96.027 86.814 30.080 1.00 0.00 H ATOM 55918 H3S PA 1363 96.883 86.113 31.585 1.00 0.00 H ATOM 55919 C12 PA 1363 97.547 88.039 30.727 1.00 0.00 C ATOM 55920 H2R PA 1363 98.164 88.272 31.598 1.00 0.00 H ATOM 55921 H2S PA 1363 97.023 88.960 30.462 1.00 0.00 H ATOM 55922 C11 PC 1364 98.395 87.531 29.566 1.00 0.00 C ATOM 55923 O12 PC 1364 97.995 87.081 28.572 1.00 0.00 O ATOM 55924 O11 PC 1364 99.765 87.687 29.786 1.00 0.00 O ATOM 55925 C1 PC 1364 100.748 87.376 28.757 1.00 0.00 C ATOM 55926 HR PC 1364 100.826 86.367 28.346 1.00 0.00 H ATOM 55927 HS PC 1364 101.736 87.511 29.203 1.00 0.00 H ATOM 55928 C2 PC 1364 100.679 88.392 27.558 1.00 0.00 C ATOM 55929 HX PC 1364 99.668 88.435 27.147 1.00 0.00 H ATOM 55930 C3 PC 1364 101.539 87.922 26.391 1.00 0.00 C ATOM 55931 HA PC 1364 101.194 86.992 25.933 1.00 0.00 H ATOM 55932 HB PC 1364 102.511 87.641 26.806 1.00 0.00 H ATOM 55933 O31 PC 1364 101.653 88.935 25.443 1.00 0.00 O ATOM 55934 P31 PC 1364 102.484 88.636 24.127 1.00 0.00 P ATOM 55935 O32 PC 1364 101.449 87.825 23.314 1.00 0.00 O ATOM 55936 C31 PC 1364 100.375 88.417 22.688 1.00 0.00 C ATOM 55937 H1A PC 1364 100.526 89.326 22.101 1.00 0.00 H ATOM 55938 H1B PC 1364 99.646 88.792 23.410 1.00 0.00 H ATOM 55939 C32 PC 1364 99.914 87.299 21.751 1.00 0.00 C ATOM 55940 H2A PC 1364 99.763 86.443 22.410 1.00 0.00 H ATOM 55941 H2B PC 1364 100.651 87.167 20.958 1.00 0.00 H ATOM 55942 N31 PC 1364 98.705 87.501 20.991 1.00 0.00 N ATOM 55943 C33 PC 1364 97.473 87.727 21.905 1.00 0.00 C ATOM 55944 H3A PC 1364 97.399 87.066 22.770 1.00 0.00 H ATOM 55945 H3B PC 1364 96.589 87.576 21.284 1.00 0.00 H ATOM 55946 H3C PC 1364 97.442 88.785 22.167 1.00 0.00 H ATOM 55947 C34 PC 1364 98.856 88.642 20.020 1.00 0.00 C ATOM 55948 H4A PC 1364 99.174 89.546 20.542 1.00 0.00 H ATOM 55949 H4B PC 1364 97.978 88.684 19.374 1.00 0.00 H ATOM 55950 H4C PC 1364 99.676 88.373 19.352 1.00 0.00 H ATOM 55951 C35 PC 1364 98.414 86.280 20.322 1.00 0.00 C ATOM 55952 H5A PC 1364 97.508 86.557 19.781 1.00 0.00 H ATOM 55953 H5B PC 1364 98.234 85.426 20.977 1.00 0.00 H ATOM 55954 H5C PC 1364 99.292 86.079 19.707 1.00 0.00 H ATOM 55955 O33 PC 1364 102.787 89.960 23.493 1.00 0.00 O ATOM 55956 O34 PC 1364 103.623 87.652 24.392 1.00 0.00 O ATOM 55957 O21 PC 1364 101.141 89.721 27.973 1.00 0.00 O ATOM 55958 C21 PC 1364 100.223 90.564 28.482 1.00 0.00 C ATOM 55959 O22 PC 1364 98.984 90.287 28.507 1.00 0.00 O ATOM 55960 C12 OL 1365 100.708 91.916 28.932 1.00 0.00 C ATOM 55961 H2R OL 1365 101.796 91.931 28.835 1.00 0.00 H ATOM 55962 H2S OL 1365 100.233 92.545 28.176 1.00 0.00 H ATOM 55963 C13 OL 1365 100.310 92.192 30.404 1.00 0.00 C ATOM 55964 H3R OL 1365 99.417 91.592 30.593 1.00 0.00 H ATOM 55965 H3S OL 1365 101.074 91.747 31.045 1.00 0.00 H ATOM 55966 C14 OL 1365 99.825 93.648 30.718 1.00 0.00 C ATOM 55967 H4R OL 1365 99.327 94.200 29.919 1.00 0.00 H ATOM 55968 H4S OL 1365 99.144 93.617 31.571 1.00 0.00 H ATOM 55969 C15 OL 1365 100.994 94.497 31.276 1.00 0.00 C ATOM 55970 H5R OL 1365 101.455 93.740 31.914 1.00 0.00 H ATOM 55971 H5S OL 1365 101.712 94.796 30.510 1.00 0.00 H ATOM 55972 C16 OL 1365 100.446 95.650 32.019 1.00 0.00 C ATOM 55973 H6R OL 1365 99.667 96.223 31.512 1.00 0.00 H ATOM 55974 H6S OL 1365 99.965 95.340 32.949 1.00 0.00 H ATOM 55975 C17 OL 1365 101.518 96.677 32.213 1.00 0.00 C ATOM 55976 H7R OL 1365 101.640 97.214 31.271 1.00 0.00 H ATOM 55977 H7S OL 1365 101.147 97.333 33.005 1.00 0.00 H ATOM 55978 C18 OL 1365 102.810 96.114 32.734 1.00 0.00 C ATOM 55979 H8R OL 1365 102.642 95.389 33.534 1.00 0.00 H ATOM 55980 H8S OL 1365 103.154 95.572 31.851 1.00 0.00 H ATOM 55981 C19 OL 1365 103.661 97.237 33.194 1.00 0.00 C ATOM 55982 H9R OL 1365 104.074 97.697 32.300 1.00 0.00 H ATOM 55983 C110 OL 1365 104.057 97.497 34.449 1.00 0.00 C ATOM 55984 H10R OL 1365 104.810 98.270 34.574 1.00 0.00 H ATOM 55985 C111 OL 1365 103.800 96.732 35.705 1.00 0.00 C ATOM 55986 H11R OL 1365 103.153 95.853 35.665 1.00 0.00 H ATOM 55987 H11S OL 1365 104.699 96.266 36.112 1.00 0.00 H ATOM 55988 C112 OL 1365 103.276 97.808 36.685 1.00 0.00 C ATOM 55989 H12R OL 1365 103.928 98.683 36.648 1.00 0.00 H ATOM 55990 H12S OL 1365 102.303 98.049 36.251 1.00 0.00 H ATOM 55991 C113 OL 1365 103.135 97.301 38.156 1.00 0.00 C ATOM 55992 H13R OL 1365 102.862 96.244 38.118 1.00 0.00 H ATOM 55993 H13S OL 1365 104.021 97.339 38.793 1.00 0.00 H ATOM 55994 C114 OL 1365 102.026 98.062 38.878 1.00 0.00 C ATOM 55995 H14R OL 1365 102.289 99.076 39.189 1.00 0.00 H ATOM 55996 H14S OL 1365 101.284 98.162 38.083 1.00 0.00 H ATOM 55997 C115 OL 1365 101.526 97.322 40.081 1.00 0.00 C ATOM 55998 H15R OL 1365 101.116 96.356 39.780 1.00 0.00 H ATOM 55999 H15S OL 1365 102.186 97.200 40.943 1.00 0.00 H ATOM 56000 C116 OL 1365 100.365 98.049 40.771 1.00 0.00 C ATOM 56001 H16R OL 1365 100.871 98.984 41.021 1.00 0.00 H ATOM 56002 H16S OL 1365 99.669 98.259 39.957 1.00 0.00 H ATOM 56003 C117 OL 1365 99.809 97.192 41.928 1.00 0.00 C ATOM 56004 H17R OL 1365 99.222 96.491 41.331 1.00 0.00 H ATOM 56005 H17S OL 1365 100.592 96.643 42.457 1.00 0.00 H ATOM 56006 C118 OL 1365 98.871 97.871 42.820 1.00 0.00 C ATOM 56007 H18R OL 1365 98.615 97.343 43.741 1.00 0.00 H ATOM 56008 H18S OL 1365 97.990 98.256 42.302 1.00 0.00 H ATOM 56009 H18T OL 1365 99.326 98.795 43.183 1.00 0.00 H TER 56010 OL 1365 ATOM 56010 C116 PA 1366 134.244 43.045 37.444 1.00 0.00 C ATOM 56011 H16R PA 1366 135.268 42.694 37.583 1.00 0.00 H ATOM 56012 H16S PA 1366 134.164 44.098 37.725 1.00 0.00 H ATOM 56013 H16T PA 1366 134.083 42.944 36.369 1.00 0.00 H ATOM 56014 C115 PA 1366 133.203 42.193 38.166 1.00 0.00 C ATOM 56015 H15R PA 1366 132.215 42.580 37.909 1.00 0.00 H ATOM 56016 H15S PA 1366 133.398 42.459 39.207 1.00 0.00 H ATOM 56017 C114 PA 1366 133.319 40.739 37.813 1.00 0.00 C ATOM 56018 H14R PA 1366 134.327 40.386 38.040 1.00 0.00 H ATOM 56019 H14S PA 1366 133.240 40.555 36.740 1.00 0.00 H ATOM 56020 C113 PA 1366 132.207 39.868 38.543 1.00 0.00 C ATOM 56021 H13R PA 1366 131.226 40.282 38.299 1.00 0.00 H ATOM 56022 H13S PA 1366 132.391 40.071 39.600 1.00 0.00 H ATOM 56023 C112 PA 1366 132.256 38.354 38.239 1.00 0.00 C ATOM 56024 H12R PA 1366 131.690 37.840 39.018 1.00 0.00 H ATOM 56025 H12S PA 1366 133.222 37.848 38.295 1.00 0.00 H ATOM 56026 C111 PA 1366 131.708 37.995 36.883 1.00 0.00 C ATOM 56027 H11R PA 1366 132.259 38.591 36.152 1.00 0.00 H ATOM 56028 H11S PA 1366 130.655 38.285 36.859 1.00 0.00 H ATOM 56029 C110 PA 1366 132.029 36.546 36.472 1.00 0.00 C ATOM 56030 H10R PA 1366 131.632 35.932 37.283 1.00 0.00 H ATOM 56031 H10S PA 1366 133.106 36.396 36.364 1.00 0.00 H ATOM 56032 C19 PA 1366 131.225 36.110 35.283 1.00 0.00 C ATOM 56033 H9R PA 1366 131.507 36.732 34.431 1.00 0.00 H ATOM 56034 H9S PA 1366 130.156 36.260 35.449 1.00 0.00 H ATOM 56035 C18 PA 1366 131.391 34.691 34.850 1.00 0.00 C ATOM 56036 H8R PA 1366 130.833 34.128 35.600 1.00 0.00 H ATOM 56037 H8S PA 1366 132.390 34.250 34.846 1.00 0.00 H ATOM 56038 C17 PA 1366 130.833 34.451 33.492 1.00 0.00 C ATOM 56039 H7R PA 1366 131.287 35.201 32.841 1.00 0.00 H ATOM 56040 H7S PA 1366 129.794 34.786 33.533 1.00 0.00 H ATOM 56041 C16 PA 1366 130.935 33.044 32.985 1.00 0.00 C ATOM 56042 H6R PA 1366 130.355 32.520 33.747 1.00 0.00 H ATOM 56043 H6S PA 1366 131.920 32.590 33.114 1.00 0.00 H ATOM 56044 C15 PA 1366 130.295 32.774 31.587 1.00 0.00 C ATOM 56045 H5R PA 1366 130.368 31.685 31.596 1.00 0.00 H ATOM 56046 H5S PA 1366 130.991 33.137 30.828 1.00 0.00 H ATOM 56047 C14 PA 1366 128.860 33.190 31.548 1.00 0.00 C ATOM 56048 H4R PA 1366 128.737 34.275 31.536 1.00 0.00 H ATOM 56049 H4S PA 1366 128.313 32.949 32.462 1.00 0.00 H ATOM 56050 C13 PA 1366 128.042 32.667 30.392 1.00 0.00 C ATOM 56051 H3R PA 1366 126.993 32.935 30.538 1.00 0.00 H ATOM 56052 H3S PA 1366 128.082 31.577 30.428 1.00 0.00 H ATOM 56053 C12 PA 1366 128.560 33.120 29.015 1.00 0.00 C ATOM 56054 H2R PA 1366 129.555 32.712 28.830 1.00 0.00 H ATOM 56055 H2S PA 1366 128.717 34.201 29.013 1.00 0.00 H ATOM 56056 C11 PGR 1367 127.637 32.792 27.937 1.00 0.00 C ATOM 56057 O12 PGR 1367 126.541 32.365 28.048 1.00 0.00 O ATOM 56058 O11 PGR 1367 128.171 33.057 26.721 1.00 0.00 O ATOM 56059 C1 PGR 1367 127.446 32.720 25.516 1.00 0.00 C ATOM 56060 HR PGR 1367 126.566 33.347 25.354 1.00 0.00 H ATOM 56061 HS PGR 1367 127.201 31.658 25.430 1.00 0.00 H ATOM 56062 C2 PGR 1367 128.304 32.941 24.269 1.00 0.00 C ATOM 56063 HX PGR 1367 128.506 34.012 24.353 1.00 0.00 H ATOM 56064 C3 PGR 1367 127.526 32.876 22.987 1.00 0.00 C ATOM 56065 HA PGR 1367 126.533 33.297 23.168 1.00 0.00 H ATOM 56066 HB PGR 1367 127.362 31.833 22.705 1.00 0.00 H ATOM 56067 O31 PGR 1367 128.140 33.553 21.980 1.00 0.00 O ATOM 56068 P31 PGR 1367 127.788 33.419 20.419 1.00 0.00 P ATOM 56069 O32 PGR 1367 126.169 33.377 20.344 1.00 0.00 O ATOM 56070 C31 PGR 1367 125.375 34.523 20.430 1.00 0.00 C ATOM 56071 H1A PGR 1367 125.675 35.098 19.551 1.00 0.00 H ATOM 56072 H1B PGR 1367 125.561 35.080 21.352 1.00 0.00 H ATOM 56073 C32 PGR 1367 123.847 34.191 20.355 1.00 0.00 C ATOM 56074 H2A PGR 1367 123.535 33.900 21.361 1.00 0.00 H ATOM 56075 O35 PGR 1367 123.733 33.077 19.415 1.00 0.00 O ATOM 56076 HO5A PGR 1367 124.432 32.467 19.713 1.00 0.00 H ATOM 56077 C33 PGR 1367 122.973 35.360 19.719 1.00 0.00 C ATOM 56078 H3A PGR 1367 121.889 35.254 19.808 1.00 0.00 H ATOM 56079 H3B PGR 1367 123.146 36.325 20.201 1.00 0.00 H ATOM 56080 O33 PGR 1367 128.317 34.642 19.844 1.00 0.00 O ATOM 56081 O34 PGR 1367 128.305 32.179 19.913 1.00 0.00 O ATOM 56082 O21 PGR 1367 129.494 32.234 24.261 1.00 0.00 O ATOM 56083 C21 PGR 1367 130.576 32.757 23.583 1.00 0.00 C ATOM 56084 O22 PGR 1367 130.596 33.896 23.057 1.00 0.00 O ATOM 56085 O36 PGR 1367 123.298 35.506 18.357 1.00 0.00 O ATOM 56086 HO6A PGR 1367 124.052 36.118 18.276 1.00 0.00 H ATOM 56087 C12 OL 1368 131.712 31.761 23.608 1.00 0.00 C ATOM 56088 H2R OL 1368 131.208 30.798 23.711 1.00 0.00 H ATOM 56089 H2S OL 1368 132.193 31.822 22.630 1.00 0.00 H ATOM 56090 C13 OL 1368 132.791 32.183 24.653 1.00 0.00 C ATOM 56091 H3R OL 1368 133.614 31.484 24.490 1.00 0.00 H ATOM 56092 H3S OL 1368 133.121 33.216 24.529 1.00 0.00 H ATOM 56093 C14 OL 1368 132.198 31.989 26.028 1.00 0.00 C ATOM 56094 H4R OL 1368 131.527 32.822 26.248 1.00 0.00 H ATOM 56095 H4S OL 1368 131.597 31.081 26.113 1.00 0.00 H ATOM 56096 C15 OL 1368 133.312 32.137 27.051 1.00 0.00 C ATOM 56097 H5R OL 1368 133.040 31.910 28.083 1.00 0.00 H ATOM 56098 H5S OL 1368 134.195 31.547 26.797 1.00 0.00 H ATOM 56099 C16 OL 1368 133.706 33.655 27.122 1.00 0.00 C ATOM 56100 H6R OL 1368 134.054 34.021 26.154 1.00 0.00 H ATOM 56101 H6S OL 1368 132.823 34.292 27.208 1.00 0.00 H ATOM 56102 C17 OL 1368 134.767 33.929 28.193 1.00 0.00 C ATOM 56103 H7R OL 1368 134.297 33.739 29.160 1.00 0.00 H ATOM 56104 H7S OL 1368 135.535 33.161 28.077 1.00 0.00 H ATOM 56105 C18 OL 1368 135.207 35.379 28.200 1.00 0.00 C ATOM 56106 H8R OL 1368 134.359 36.056 28.324 1.00 0.00 H ATOM 56107 H8S OL 1368 135.886 35.575 29.032 1.00 0.00 H ATOM 56108 C19 OL 1368 136.058 35.668 27.001 1.00 0.00 C ATOM 56109 H9R OL 1368 135.985 34.962 26.177 1.00 0.00 H ATOM 56110 C110 OL 1368 137.104 36.561 26.852 1.00 0.00 C ATOM 56111 H10R OL 1368 137.674 36.607 25.928 1.00 0.00 H ATOM 56112 C111 OL 1368 137.595 37.533 27.911 1.00 0.00 C ATOM 56113 H11R OL 1368 137.984 38.426 27.419 1.00 0.00 H ATOM 56114 H11S OL 1368 136.839 37.956 28.576 1.00 0.00 H ATOM 56115 C112 OL 1368 138.803 37.021 28.759 1.00 0.00 C ATOM 56116 H12R OL 1368 139.199 36.089 28.350 1.00 0.00 H ATOM 56117 H12S OL 1368 139.593 37.770 28.665 1.00 0.00 H ATOM 56118 C113 OL 1368 138.507 36.845 30.250 1.00 0.00 C ATOM 56119 H13R OL 1368 138.374 37.860 30.631 1.00 0.00 H ATOM 56120 H13S OL 1368 137.593 36.252 30.326 1.00 0.00 H ATOM 56121 C114 OL 1368 139.534 36.112 31.050 1.00 0.00 C ATOM 56122 H14R OL 1368 139.521 35.033 30.879 1.00 0.00 H ATOM 56123 H14S OL 1368 140.481 36.452 30.625 1.00 0.00 H ATOM 56124 C115 OL 1368 139.668 36.464 32.575 1.00 0.00 C ATOM 56125 H15R OL 1368 140.165 37.423 32.735 1.00 0.00 H ATOM 56126 H15S OL 1368 138.677 36.437 33.032 1.00 0.00 H ATOM 56127 C116 OL 1368 140.599 35.547 33.318 1.00 0.00 C ATOM 56128 H16R OL 1368 140.399 34.509 33.045 1.00 0.00 H ATOM 56129 H16S OL 1368 141.605 35.705 32.923 1.00 0.00 H ATOM 56130 C117 OL 1368 140.572 35.679 34.881 1.00 0.00 C ATOM 56131 H17R OL 1368 139.856 36.447 35.181 1.00 0.00 H ATOM 56132 H17S OL 1368 140.409 34.796 35.502 1.00 0.00 H ATOM 56133 C118 OL 1368 141.933 36.175 35.449 1.00 0.00 C ATOM 56134 H18R OL 1368 142.126 36.026 36.513 1.00 0.00 H ATOM 56135 H18S OL 1368 142.192 37.185 35.124 1.00 0.00 H ATOM 56136 H18T OL 1368 142.749 35.526 35.124 1.00 0.00 H TER 56137 OL 1368 ATOM 56137 C116 PA 1369 139.408 70.179 43.955 1.00 0.00 C ATOM 56138 H16R PA 1369 140.491 70.261 44.064 1.00 0.00 H ATOM 56139 H16S PA 1369 139.250 70.482 42.918 1.00 0.00 H ATOM 56140 H16T PA 1369 139.174 69.125 44.123 1.00 0.00 H ATOM 56141 C115 PA 1369 138.666 71.210 44.876 1.00 0.00 C ATOM 56142 H15R PA 1369 139.071 72.202 44.665 1.00 0.00 H ATOM 56143 H15S PA 1369 139.068 71.038 45.877 1.00 0.00 H ATOM 56144 C114 PA 1369 137.169 71.245 44.747 1.00 0.00 C ATOM 56145 H14R PA 1369 136.694 71.763 45.582 1.00 0.00 H ATOM 56146 H14S PA 1369 136.719 70.267 44.931 1.00 0.00 H ATOM 56147 C113 PA 1369 136.780 71.869 43.397 1.00 0.00 C ATOM 56148 H13R PA 1369 135.768 71.475 43.288 1.00 0.00 H ATOM 56149 H13S PA 1369 137.420 71.369 42.667 1.00 0.00 H ATOM 56150 C112 PA 1369 136.657 73.334 43.404 1.00 0.00 C ATOM 56151 H12R PA 1369 137.685 73.619 43.634 1.00 0.00 H ATOM 56152 H12S PA 1369 136.084 73.710 44.254 1.00 0.00 H ATOM 56153 C111 PA 1369 136.176 73.827 42.131 1.00 0.00 C ATOM 56154 H11R PA 1369 135.882 74.879 42.107 1.00 0.00 H ATOM 56155 H11S PA 1369 135.313 73.215 41.860 1.00 0.00 H ATOM 56156 C110 PA 1369 137.257 73.652 40.993 1.00 0.00 C ATOM 56157 H10R PA 1369 137.333 72.594 40.733 1.00 0.00 H ATOM 56158 H10S PA 1369 138.154 74.074 41.453 1.00 0.00 H ATOM 56159 C19 PA 1369 136.838 74.468 39.777 1.00 0.00 C ATOM 56160 H9R PA 1369 136.764 75.474 40.195 1.00 0.00 H ATOM 56161 H9S PA 1369 135.878 74.123 39.387 1.00 0.00 H ATOM 56162 C18 PA 1369 137.918 74.541 38.641 1.00 0.00 C ATOM 56163 H8R PA 1369 138.028 73.555 38.184 1.00 0.00 H ATOM 56164 H8S PA 1369 138.934 74.748 38.983 1.00 0.00 H ATOM 56165 C17 PA 1369 137.699 75.581 37.594 1.00 0.00 C ATOM 56166 H7R PA 1369 137.489 76.503 38.141 1.00 0.00 H ATOM 56167 H7S PA 1369 136.797 75.295 37.048 1.00 0.00 H ATOM 56168 C16 PA 1369 138.935 75.642 36.670 1.00 0.00 C ATOM 56169 H6R PA 1369 138.946 74.627 36.266 1.00 0.00 H ATOM 56170 H6S PA 1369 139.897 75.859 37.139 1.00 0.00 H ATOM 56171 C15 PA 1369 138.724 76.451 35.368 1.00 0.00 C ATOM 56172 H5R PA 1369 138.438 77.467 35.648 1.00 0.00 H ATOM 56173 H5S PA 1369 137.837 76.071 34.858 1.00 0.00 H ATOM 56174 C14 PA 1369 139.754 76.659 34.246 1.00 0.00 C ATOM 56175 H4R PA 1369 139.131 76.952 33.398 1.00 0.00 H ATOM 56176 H4S PA 1369 140.157 75.658 34.078 1.00 0.00 H ATOM 56177 C13 PA 1369 141.003 77.507 34.485 1.00 0.00 C ATOM 56178 H3R PA 1369 141.653 76.964 35.174 1.00 0.00 H ATOM 56179 H3S PA 1369 140.864 78.501 34.916 1.00 0.00 H ATOM 56180 C12 PA 1369 141.850 77.708 33.217 1.00 0.00 C ATOM 56181 H2R PA 1369 142.107 76.778 32.707 1.00 0.00 H ATOM 56182 H2S PA 1369 142.758 78.315 33.243 1.00 0.00 H ATOM 56183 C11 PC 1370 141.029 78.473 32.164 1.00 0.00 C ATOM 56184 O12 PC 1370 140.265 79.422 32.360 1.00 0.00 O ATOM 56185 O11 PC 1370 141.387 78.040 30.913 1.00 0.00 O ATOM 56186 C1 PC 1370 140.993 78.697 29.685 1.00 0.00 C ATOM 56187 HR PC 1370 139.909 78.685 29.545 1.00 0.00 H ATOM 56188 HS PC 1370 141.421 78.072 28.897 1.00 0.00 H ATOM 56189 C2 PC 1370 141.619 80.103 29.656 1.00 0.00 C ATOM 56190 HX PC 1370 141.116 80.721 30.405 1.00 0.00 H ATOM 56191 C3 PC 1370 141.268 80.742 28.381 1.00 0.00 C ATOM 56192 HA PC 1370 141.825 81.677 28.277 1.00 0.00 H ATOM 56193 HB PC 1370 140.193 80.940 28.354 1.00 0.00 H ATOM 56194 O31 PC 1370 141.637 79.910 27.345 1.00 0.00 O ATOM 56195 P31 PC 1370 141.863 80.456 25.893 1.00 0.00 P ATOM 56196 O32 PC 1370 143.240 81.242 26.149 1.00 0.00 O ATOM 56197 C31 PC 1370 144.472 80.672 26.078 1.00 0.00 C ATOM 56198 H1A PC 1370 144.485 80.275 25.059 1.00 0.00 H ATOM 56199 H1B PC 1370 144.668 79.969 26.892 1.00 0.00 H ATOM 56200 C32 PC 1370 145.480 81.814 26.161 1.00 0.00 C ATOM 56201 H2A PC 1370 146.355 81.568 26.765 1.00 0.00 H ATOM 56202 H2B PC 1370 144.977 82.623 26.691 1.00 0.00 H ATOM 56203 N31 PC 1370 145.973 82.444 24.942 1.00 0.00 N ATOM 56204 C33 PC 1370 144.813 82.840 24.048 1.00 0.00 C ATOM 56205 H3A PC 1370 144.127 82.005 23.893 1.00 0.00 H ATOM 56206 H3B PC 1370 145.171 83.227 23.093 1.00 0.00 H ATOM 56207 H3C PC 1370 144.345 83.655 24.602 1.00 0.00 H ATOM 56208 C34 PC 1370 146.760 83.586 25.306 1.00 0.00 C ATOM 56209 H4A PC 1370 146.115 84.077 26.036 1.00 0.00 H ATOM 56210 H4B PC 1370 146.975 84.184 24.419 1.00 0.00 H ATOM 56211 H4C PC 1370 147.717 83.269 25.723 1.00 0.00 H ATOM 56212 C35 PC 1370 146.884 81.448 24.208 1.00 0.00 C ATOM 56213 H5A PC 1370 147.939 81.620 24.426 1.00 0.00 H ATOM 56214 H5B PC 1370 146.842 81.763 23.164 1.00 0.00 H ATOM 56215 H5C PC 1370 146.504 80.445 24.406 1.00 0.00 H ATOM 56216 O33 PC 1370 142.174 79.409 24.919 1.00 0.00 O ATOM 56217 O34 PC 1370 140.823 81.499 25.554 1.00 0.00 O ATOM 56218 O21 PC 1370 142.983 79.881 29.769 1.00 0.00 O ATOM 56219 C21 PC 1370 143.795 80.930 29.922 1.00 0.00 C ATOM 56220 O22 PC 1370 143.482 82.119 29.912 1.00 0.00 O ATOM 56221 C12 OL 1371 145.251 80.501 30.154 1.00 0.00 C ATOM 56222 H2R OL 1371 145.160 79.545 30.675 1.00 0.00 H ATOM 56223 H2S OL 1371 145.745 80.200 29.228 1.00 0.00 H ATOM 56224 C13 OL 1371 146.033 81.563 30.943 1.00 0.00 C ATOM 56225 H3R OL 1371 147.068 81.703 30.623 1.00 0.00 H ATOM 56226 H3S OL 1371 145.664 82.590 30.894 1.00 0.00 H ATOM 56227 C14 OL 1371 146.165 81.068 32.429 1.00 0.00 C ATOM 56228 H4R OL 1371 146.185 80.015 32.717 1.00 0.00 H ATOM 56229 H4S OL 1371 147.175 81.346 32.738 1.00 0.00 H ATOM 56230 C15 OL 1371 145.073 81.803 33.312 1.00 0.00 C ATOM 56231 H5R OL 1371 145.411 82.824 33.505 1.00 0.00 H ATOM 56232 H5S OL 1371 144.108 81.846 32.802 1.00 0.00 H ATOM 56233 C16 OL 1371 144.820 81.082 34.576 1.00 0.00 C ATOM 56234 H6R OL 1371 144.753 79.998 34.468 1.00 0.00 H ATOM 56235 H6S OL 1371 145.765 81.082 35.123 1.00 0.00 H ATOM 56236 C17 OL 1371 143.704 81.638 35.423 1.00 0.00 C ATOM 56237 H7R OL 1371 143.758 82.728 35.379 1.00 0.00 H ATOM 56238 H7S OL 1371 142.732 81.374 35.003 1.00 0.00 H ATOM 56239 C18 OL 1371 143.747 81.071 36.882 1.00 0.00 C ATOM 56240 H8R OL 1371 143.956 80.000 36.836 1.00 0.00 H ATOM 56241 H8S OL 1371 144.649 81.421 37.389 1.00 0.00 H ATOM 56242 C19 OL 1371 142.533 81.544 37.728 1.00 0.00 C ATOM 56243 H9R OL 1371 142.333 82.603 37.586 1.00 0.00 H ATOM 56244 C110 OL 1371 141.602 80.851 38.427 1.00 0.00 C ATOM 56245 H10R OL 1371 140.776 81.347 38.930 1.00 0.00 H ATOM 56246 C111 OL 1371 141.672 79.365 38.602 1.00 0.00 C ATOM 56247 H11R OL 1371 140.858 78.857 38.081 1.00 0.00 H ATOM 56248 H11S OL 1371 142.598 78.915 38.238 1.00 0.00 H ATOM 56249 C112 OL 1371 141.329 79.154 40.045 1.00 0.00 C ATOM 56250 H12R OL 1371 142.068 79.681 40.651 1.00 0.00 H ATOM 56251 H12S OL 1371 140.314 79.544 40.153 1.00 0.00 H ATOM 56252 C113 OL 1371 141.306 77.702 40.434 1.00 0.00 C ATOM 56253 H13R OL 1371 140.885 77.158 39.586 1.00 0.00 H ATOM 56254 H13S OL 1371 142.312 77.280 40.496 1.00 0.00 H ATOM 56255 C114 OL 1371 140.558 77.473 41.718 1.00 0.00 C ATOM 56256 H14R OL 1371 140.773 76.485 42.130 1.00 0.00 H ATOM 56257 H14S OL 1371 140.885 78.170 42.492 1.00 0.00 H ATOM 56258 C115 OL 1371 139.097 77.589 41.657 1.00 0.00 C ATOM 56259 H15R OL 1371 138.758 78.562 41.297 1.00 0.00 H ATOM 56260 H15S OL 1371 138.638 76.929 40.918 1.00 0.00 H ATOM 56261 C116 OL 1371 138.342 77.324 43.001 1.00 0.00 C ATOM 56262 H16R OL 1371 138.453 76.254 43.191 1.00 0.00 H ATOM 56263 H16S OL 1371 138.952 77.793 43.776 1.00 0.00 H ATOM 56264 C117 OL 1371 136.933 77.904 43.186 1.00 0.00 C ATOM 56265 H17R OL 1371 136.246 77.535 42.421 1.00 0.00 H ATOM 56266 H17S OL 1371 136.520 77.373 44.046 1.00 0.00 H ATOM 56267 C118 OL 1371 136.891 79.421 43.447 1.00 0.00 C ATOM 56268 H18R OL 1371 137.025 80.076 42.583 1.00 0.00 H ATOM 56269 H18S OL 1371 137.597 79.712 44.227 1.00 0.00 H ATOM 56270 H18T OL 1371 135.991 79.710 43.992 1.00 0.00 H TER 56271 OL 1371 ATOM 56271 C116 PA 1372 81.111 151.489 35.739 1.00 0.00 C ATOM 56272 H16R PA 1372 81.882 152.185 35.402 1.00 0.00 H ATOM 56273 H16S PA 1372 81.518 150.707 36.383 1.00 0.00 H ATOM 56274 H16T PA 1372 80.434 152.094 36.345 1.00 0.00 H ATOM 56275 C115 PA 1372 80.640 150.820 34.514 1.00 0.00 C ATOM 56276 H15R PA 1372 80.163 151.518 33.822 1.00 0.00 H ATOM 56277 H15S PA 1372 79.755 150.204 34.686 1.00 0.00 H ATOM 56278 C114 PA 1372 81.544 149.925 33.754 1.00 0.00 C ATOM 56279 H14R PA 1372 82.024 149.144 34.347 1.00 0.00 H ATOM 56280 H14S PA 1372 82.355 150.527 33.339 1.00 0.00 H ATOM 56281 C113 PA 1372 80.742 149.223 32.734 1.00 0.00 C ATOM 56282 H13R PA 1372 80.249 149.882 32.016 1.00 0.00 H ATOM 56283 H13S PA 1372 79.936 148.741 33.291 1.00 0.00 H ATOM 56284 C112 PA 1372 81.715 148.366 31.897 1.00 0.00 C ATOM 56285 H12R PA 1372 82.039 147.468 32.427 1.00 0.00 H ATOM 56286 H12S PA 1372 82.574 148.978 31.617 1.00 0.00 H ATOM 56287 C111 PA 1372 81.046 147.797 30.666 1.00 0.00 C ATOM 56288 H11R PA 1372 80.355 148.457 30.138 1.00 0.00 H ATOM 56289 H11S PA 1372 80.393 147.027 31.080 1.00 0.00 H ATOM 56290 C110 PA 1372 82.098 147.231 29.735 1.00 0.00 C ATOM 56291 H10R PA 1372 82.618 146.423 30.254 1.00 0.00 H ATOM 56292 H10S PA 1372 82.781 148.028 29.436 1.00 0.00 H ATOM 56293 C19 PA 1372 81.424 146.599 28.588 1.00 0.00 C ATOM 56294 H9R PA 1372 80.758 147.361 28.179 1.00 0.00 H ATOM 56295 H9S PA 1372 80.852 145.768 29.004 1.00 0.00 H ATOM 56296 C18 PA 1372 82.312 146.147 27.473 1.00 0.00 C ATOM 56297 H8R PA 1372 82.953 145.363 27.881 1.00 0.00 H ATOM 56298 H8S PA 1372 82.909 147.009 27.167 1.00 0.00 H ATOM 56299 C17 PA 1372 81.619 145.543 26.171 1.00 0.00 C ATOM 56300 H7R PA 1372 81.013 146.319 25.698 1.00 0.00 H ATOM 56301 H7S PA 1372 80.903 144.751 26.398 1.00 0.00 H ATOM 56302 C16 PA 1372 82.488 144.899 25.072 1.00 0.00 C ATOM 56303 H6R PA 1372 83.318 145.559 24.815 1.00 0.00 H ATOM 56304 H6S PA 1372 81.852 144.756 24.196 1.00 0.00 H ATOM 56305 C15 PA 1372 82.984 143.516 25.424 1.00 0.00 C ATOM 56306 H5R PA 1372 82.179 142.812 25.645 1.00 0.00 H ATOM 56307 H5S PA 1372 83.467 143.553 26.403 1.00 0.00 H ATOM 56308 C14 PA 1372 83.900 142.880 24.410 1.00 0.00 C ATOM 56309 H4R PA 1372 84.685 143.607 24.192 1.00 0.00 H ATOM 56310 H4S PA 1372 83.386 142.653 23.474 1.00 0.00 H ATOM 56311 C13 PA 1372 84.575 141.605 24.919 1.00 0.00 C ATOM 56312 H3R PA 1372 83.859 140.837 25.218 1.00 0.00 H ATOM 56313 H3S PA 1372 85.129 141.913 25.807 1.00 0.00 H ATOM 56314 C12 PA 1372 85.727 141.062 24.066 1.00 0.00 C ATOM 56315 H2R PA 1372 86.104 140.211 24.638 1.00 0.00 H ATOM 56316 H2S PA 1372 86.495 141.836 24.005 1.00 0.00 H ATOM 56317 C11 PC 1373 85.199 140.561 22.752 1.00 0.00 C ATOM 56318 O12 PC 1373 85.497 141.125 21.691 1.00 0.00 O ATOM 56319 O11 PC 1373 84.479 139.430 22.818 1.00 0.00 O ATOM 56320 C1 PC 1373 84.005 138.833 21.549 1.00 0.00 C ATOM 56321 HR PC 1373 83.601 139.685 20.996 1.00 0.00 H ATOM 56322 HS PC 1373 83.269 138.032 21.650 1.00 0.00 H ATOM 56323 C2 PC 1373 85.125 138.264 20.668 1.00 0.00 C ATOM 56324 HX PC 1373 85.872 139.020 20.414 1.00 0.00 H ATOM 56325 C3 PC 1373 84.622 137.827 19.324 1.00 0.00 C ATOM 56326 HA PC 1373 85.419 137.348 18.749 1.00 0.00 H ATOM 56327 HB PC 1373 84.261 138.634 18.681 1.00 0.00 H ATOM 56328 O31 PC 1373 83.495 136.918 19.468 1.00 0.00 O ATOM 56329 P31 PC 1373 82.392 136.626 18.274 1.00 0.00 P ATOM 56330 O32 PC 1373 81.750 138.075 18.044 1.00 0.00 O ATOM 56331 C31 PC 1373 81.201 138.394 16.801 1.00 0.00 C ATOM 56332 H1A PC 1373 80.228 137.927 16.628 1.00 0.00 H ATOM 56333 H1B PC 1373 81.841 138.229 15.931 1.00 0.00 H ATOM 56334 C32 PC 1373 80.848 139.864 17.037 1.00 0.00 C ATOM 56335 H2A PC 1373 80.740 140.063 18.104 1.00 0.00 H ATOM 56336 H2B PC 1373 79.887 140.041 16.551 1.00 0.00 H ATOM 56337 N31 PC 1373 81.769 140.973 16.617 1.00 0.00 N ATOM 56338 C33 PC 1373 80.974 142.255 16.764 1.00 0.00 C ATOM 56339 H3A PC 1373 80.076 142.025 16.189 1.00 0.00 H ATOM 56340 H3B PC 1373 81.448 143.149 16.356 1.00 0.00 H ATOM 56341 H3C PC 1373 80.701 142.304 17.820 1.00 0.00 H ATOM 56342 C34 PC 1373 82.970 141.001 17.488 1.00 0.00 C ATOM 56343 H4A PC 1373 82.679 141.480 18.424 1.00 0.00 H ATOM 56344 H4B PC 1373 83.668 141.561 16.864 1.00 0.00 H ATOM 56345 H4C PC 1373 83.238 139.952 17.625 1.00 0.00 H ATOM 56346 C35 PC 1373 82.232 140.893 15.212 1.00 0.00 C ATOM 56347 H5A PC 1373 82.711 139.919 15.103 1.00 0.00 H ATOM 56348 H5B PC 1373 82.888 141.718 14.930 1.00 0.00 H ATOM 56349 H5C PC 1373 81.394 141.029 14.527 1.00 0.00 H ATOM 56350 O33 PC 1373 83.177 136.269 17.075 1.00 0.00 O ATOM 56351 O34 PC 1373 81.294 135.801 18.796 1.00 0.00 O ATOM 56352 O21 PC 1373 85.662 137.126 21.361 1.00 0.00 O ATOM 56353 C21 PC 1373 86.748 137.373 22.062 1.00 0.00 C ATOM 56354 O22 PC 1373 87.468 138.329 21.950 1.00 0.00 O ATOM 56355 C12 OL 1374 87.030 136.276 23.126 1.00 0.00 C ATOM 56356 H2R OL 1374 86.353 135.423 23.040 1.00 0.00 H ATOM 56357 H2S OL 1374 87.831 135.659 22.715 1.00 0.00 H ATOM 56358 C13 OL 1374 87.196 136.780 24.565 1.00 0.00 C ATOM 56359 H3R OL 1374 87.825 136.038 25.063 1.00 0.00 H ATOM 56360 H3S OL 1374 87.675 137.761 24.547 1.00 0.00 H ATOM 56361 C14 OL 1374 85.858 136.959 25.363 1.00 0.00 C ATOM 56362 H4R OL 1374 84.968 137.338 24.856 1.00 0.00 H ATOM 56363 H4S OL 1374 85.556 135.956 25.670 1.00 0.00 H ATOM 56364 C15 OL 1374 85.932 137.777 26.711 1.00 0.00 C ATOM 56365 H5R OL 1374 86.480 137.245 27.492 1.00 0.00 H ATOM 56366 H5S OL 1374 86.388 138.758 26.566 1.00 0.00 H ATOM 56367 C16 OL 1374 84.555 138.240 27.164 1.00 0.00 C ATOM 56368 H6R OL 1374 84.146 138.937 26.430 1.00 0.00 H ATOM 56369 H6S OL 1374 83.989 137.307 27.222 1.00 0.00 H ATOM 56370 C17 OL 1374 84.512 138.878 28.504 1.00 0.00 C ATOM 56371 H7R OL 1374 84.903 138.258 29.313 1.00 0.00 H ATOM 56372 H7S OL 1374 85.153 139.762 28.539 1.00 0.00 H ATOM 56373 C18 OL 1374 83.056 139.198 28.904 1.00 0.00 C ATOM 56374 H8R OL 1374 82.350 138.366 28.917 1.00 0.00 H ATOM 56375 H8S OL 1374 83.183 139.450 29.959 1.00 0.00 H ATOM 56376 C19 OL 1374 82.496 140.398 28.216 1.00 0.00 C ATOM 56377 H9R OL 1374 82.102 140.267 27.212 1.00 0.00 H ATOM 56378 C110 OL 1374 82.379 141.651 28.699 1.00 0.00 C ATOM 56379 H10R OL 1374 81.883 142.312 27.993 1.00 0.00 H ATOM 56380 C111 OL 1374 82.888 142.205 29.985 1.00 0.00 C ATOM 56381 H11R OL 1374 83.416 141.472 30.598 1.00 0.00 H ATOM 56382 H11S OL 1374 83.649 142.969 29.814 1.00 0.00 H ATOM 56383 C112 OL 1374 81.721 142.855 30.706 1.00 0.00 C ATOM 56384 H12R OL 1374 81.183 143.437 29.955 1.00 0.00 H ATOM 56385 H12S OL 1374 80.988 142.109 31.021 1.00 0.00 H ATOM 56386 C113 OL 1374 82.118 143.740 31.814 1.00 0.00 C ATOM 56387 H13R OL 1374 82.711 143.184 32.543 1.00 0.00 H ATOM 56388 H13S OL 1374 82.819 144.558 31.634 1.00 0.00 H ATOM 56389 C114 OL 1374 80.964 144.433 32.564 1.00 0.00 C ATOM 56390 H14R OL 1374 80.578 145.312 32.043 1.00 0.00 H ATOM 56391 H14S OL 1374 80.104 143.761 32.516 1.00 0.00 H ATOM 56392 C115 OL 1374 81.211 144.907 34.018 1.00 0.00 C ATOM 56393 H15R OL 1374 81.671 144.019 34.457 1.00 0.00 H ATOM 56394 H15S OL 1374 82.001 145.660 34.052 1.00 0.00 H ATOM 56395 C116 OL 1374 80.105 145.330 34.933 1.00 0.00 C ATOM 56396 H16R OL 1374 79.646 146.253 34.573 1.00 0.00 H ATOM 56397 H16S OL 1374 79.396 144.523 35.127 1.00 0.00 H ATOM 56398 C117 OL 1374 80.608 145.558 36.341 1.00 0.00 C ATOM 56399 H17R OL 1374 79.776 145.875 36.973 1.00 0.00 H ATOM 56400 H17S OL 1374 80.850 144.609 36.824 1.00 0.00 H ATOM 56401 C118 OL 1374 81.733 146.482 36.468 1.00 0.00 C ATOM 56402 H18R OL 1374 82.661 146.123 36.017 1.00 0.00 H ATOM 56403 H18S OL 1374 81.860 146.801 37.504 1.00 0.00 H ATOM 56404 H18T OL 1374 81.451 147.442 36.033 1.00 0.00 H TER 56405 OL 1374 ATOM 56405 C116 PA 1375 130.365 69.117 44.578 1.00 0.00 C ATOM 56406 H16R PA 1375 130.006 68.607 45.474 1.00 0.00 H ATOM 56407 H16S PA 1375 131.448 69.252 44.586 1.00 0.00 H ATOM 56408 H16T PA 1375 130.018 68.561 43.705 1.00 0.00 H ATOM 56409 C115 PA 1375 129.533 70.427 44.515 1.00 0.00 C ATOM 56410 H15R PA 1375 129.994 71.138 43.826 1.00 0.00 H ATOM 56411 H15S PA 1375 129.578 70.908 45.494 1.00 0.00 H ATOM 56412 C114 PA 1375 128.072 70.290 44.053 1.00 0.00 C ATOM 56413 H14R PA 1375 127.488 71.193 44.249 1.00 0.00 H ATOM 56414 H14S PA 1375 127.504 69.582 44.660 1.00 0.00 H ATOM 56415 C113 PA 1375 128.024 69.931 42.538 1.00 0.00 C ATOM 56416 H13R PA 1375 128.478 68.945 42.424 1.00 0.00 H ATOM 56417 H13S PA 1375 128.586 70.672 41.965 1.00 0.00 H ATOM 56418 C112 PA 1375 126.511 69.977 42.114 1.00 0.00 C ATOM 56419 H12R PA 1375 126.189 71.021 42.097 1.00 0.00 H ATOM 56420 H12S PA 1375 125.870 69.383 42.770 1.00 0.00 H ATOM 56421 C111 PA 1375 126.455 69.341 40.669 1.00 0.00 C ATOM 56422 H11R PA 1375 126.600 68.267 40.809 1.00 0.00 H ATOM 56423 H11S PA 1375 127.272 69.662 40.020 1.00 0.00 H ATOM 56424 C110 PA 1375 125.236 69.798 39.936 1.00 0.00 C ATOM 56425 H10R PA 1375 125.440 70.860 39.778 1.00 0.00 H ATOM 56426 H10S PA 1375 124.324 69.809 40.536 1.00 0.00 H ATOM 56427 C19 PA 1375 124.935 69.086 38.603 1.00 0.00 C ATOM 56428 H9R PA 1375 124.092 69.543 38.080 1.00 0.00 H ATOM 56429 H9S PA 1375 124.675 68.067 38.897 1.00 0.00 H ATOM 56430 C18 PA 1375 126.145 68.942 37.653 1.00 0.00 C ATOM 56431 H8R PA 1375 127.072 68.882 38.228 1.00 0.00 H ATOM 56432 H8S PA 1375 126.260 69.897 37.137 1.00 0.00 H ATOM 56433 C17 PA 1375 126.086 67.854 36.701 1.00 0.00 C ATOM 56434 H7R PA 1375 126.143 66.816 37.035 1.00 0.00 H ATOM 56435 H7S PA 1375 127.014 67.994 36.144 1.00 0.00 H ATOM 56436 C16 PA 1375 124.913 67.932 35.650 1.00 0.00 C ATOM 56437 H6R PA 1375 124.584 68.944 35.409 1.00 0.00 H ATOM 56438 H6S PA 1375 124.019 67.441 36.041 1.00 0.00 H ATOM 56439 C15 PA 1375 125.331 67.219 34.329 1.00 0.00 C ATOM 56440 H5R PA 1375 125.630 66.205 34.605 1.00 0.00 H ATOM 56441 H5S PA 1375 126.226 67.670 33.894 1.00 0.00 H ATOM 56442 C14 PA 1375 124.278 67.306 33.204 1.00 0.00 C ATOM 56443 H4R PA 1375 124.129 68.366 32.990 1.00 0.00 H ATOM 56444 H4S PA 1375 123.301 66.920 33.502 1.00 0.00 H ATOM 56445 C13 PA 1375 124.846 66.470 32.018 1.00 0.00 C ATOM 56446 H3R PA 1375 124.875 65.384 32.125 1.00 0.00 H ATOM 56447 H3S PA 1375 125.873 66.808 31.868 1.00 0.00 H ATOM 56448 C12 PA 1375 124.083 66.645 30.661 1.00 0.00 C ATOM 56449 H2R PA 1375 123.988 67.732 30.627 1.00 0.00 H ATOM 56450 H2S PA 1375 123.040 66.324 30.710 1.00 0.00 H ATOM 56451 C11 PGR 1376 124.724 66.141 29.376 1.00 0.00 C ATOM 56452 O12 PGR 1376 124.962 66.904 28.453 1.00 0.00 O ATOM 56453 O11 PGR 1376 124.852 64.782 29.398 1.00 0.00 O ATOM 56454 C1 PGR 1376 125.317 63.975 28.265 1.00 0.00 C ATOM 56455 HR PGR 1376 124.785 64.216 27.341 1.00 0.00 H ATOM 56456 HS PGR 1376 125.040 62.926 28.404 1.00 0.00 H ATOM 56457 C2 PGR 1376 126.822 63.970 28.237 1.00 0.00 C ATOM 56458 HX PGR 1376 127.078 64.975 28.581 1.00 0.00 H ATOM 56459 C3 PGR 1376 127.440 63.529 26.946 1.00 0.00 C ATOM 56460 HA PGR 1376 128.469 63.178 27.058 1.00 0.00 H ATOM 56461 HB PGR 1376 127.376 64.348 26.225 1.00 0.00 H ATOM 56462 O31 PGR 1376 126.924 62.357 26.388 1.00 0.00 O ATOM 56463 P31 PGR 1376 127.336 61.636 24.991 1.00 0.00 P ATOM 56464 O32 PGR 1376 128.690 60.873 25.257 1.00 0.00 O ATOM 56465 C31 PGR 1376 128.733 59.763 26.154 1.00 0.00 C ATOM 56466 H1A PGR 1376 128.075 58.957 25.816 1.00 0.00 H ATOM 56467 H1B PGR 1376 128.388 60.028 27.156 1.00 0.00 H ATOM 56468 C32 PGR 1376 130.150 59.120 26.329 1.00 0.00 C ATOM 56469 H2A PGR 1376 129.995 58.260 26.985 1.00 0.00 H ATOM 56470 O35 PGR 1376 131.235 60.002 26.936 1.00 0.00 O ATOM 56471 HO5A PGR 1376 132.005 59.485 27.234 1.00 0.00 H ATOM 56472 C33 PGR 1376 130.697 58.736 24.926 1.00 0.00 C ATOM 56473 H3A PGR 1376 131.622 58.162 25.023 1.00 0.00 H ATOM 56474 H3B PGR 1376 129.991 58.142 24.340 1.00 0.00 H ATOM 56475 O33 PGR 1376 126.283 60.625 24.747 1.00 0.00 O ATOM 56476 O34 PGR 1376 127.552 62.562 23.869 1.00 0.00 O ATOM 56477 O21 PGR 1376 127.320 63.145 29.391 1.00 0.00 O ATOM 56478 C21 PGR 1376 128.589 63.415 29.778 1.00 0.00 C ATOM 56479 O22 PGR 1376 129.244 64.278 29.146 1.00 0.00 O ATOM 56480 O36 PGR 1376 130.951 59.953 24.197 1.00 0.00 O ATOM 56481 HO6A PGR 1376 130.123 60.392 23.932 1.00 0.00 H ATOM 56482 C12 OL 1377 129.227 62.478 30.745 1.00 0.00 C ATOM 56483 H2R OL 1377 129.997 62.962 31.349 1.00 0.00 H ATOM 56484 H2S OL 1377 128.425 62.135 31.401 1.00 0.00 H ATOM 56485 C13 OL 1377 129.824 61.238 30.156 1.00 0.00 C ATOM 56486 H3R OL 1377 128.972 60.889 29.570 1.00 0.00 H ATOM 56487 H3S OL 1377 130.655 61.620 29.560 1.00 0.00 H ATOM 56488 C14 OL 1377 130.245 60.229 31.210 1.00 0.00 C ATOM 56489 H4R OL 1377 130.729 60.767 32.027 1.00 0.00 H ATOM 56490 H4S OL 1377 129.406 59.704 31.671 1.00 0.00 H ATOM 56491 C15 OL 1377 131.112 59.089 30.617 1.00 0.00 C ATOM 56492 H5R OL 1377 130.790 58.668 29.662 1.00 0.00 H ATOM 56493 H5S OL 1377 132.083 59.518 30.361 1.00 0.00 H ATOM 56494 C16 OL 1377 131.377 57.944 31.650 1.00 0.00 C ATOM 56495 H6R OL 1377 131.476 58.439 32.618 1.00 0.00 H ATOM 56496 H6S OL 1377 130.570 57.208 31.630 1.00 0.00 H ATOM 56497 C17 OL 1377 132.650 57.107 31.355 1.00 0.00 C ATOM 56498 H7R OL 1377 132.485 56.584 30.411 1.00 0.00 H ATOM 56499 H7S OL 1377 133.511 57.724 31.089 1.00 0.00 H ATOM 56500 C18 OL 1377 132.915 56.142 32.429 1.00 0.00 C ATOM 56501 H8R OL 1377 131.988 55.771 32.872 1.00 0.00 H ATOM 56502 H8S OL 1377 133.315 55.186 32.087 1.00 0.00 H ATOM 56503 C19 OL 1377 133.877 56.645 33.459 1.00 0.00 C ATOM 56504 H9R OL 1377 134.819 57.008 33.058 1.00 0.00 H ATOM 56505 C110 OL 1377 133.710 56.807 34.739 1.00 0.00 C ATOM 56506 H10R OL 1377 134.615 57.140 35.241 1.00 0.00 H ATOM 56507 C111 OL 1377 132.511 56.558 35.549 1.00 0.00 C ATOM 56508 H11R OL 1377 131.700 56.049 35.025 1.00 0.00 H ATOM 56509 H11S OL 1377 132.675 56.067 36.510 1.00 0.00 H ATOM 56510 C112 OL 1377 131.980 57.963 35.916 1.00 0.00 C ATOM 56511 H12R OL 1377 132.072 58.662 35.082 1.00 0.00 H ATOM 56512 H12S OL 1377 130.913 57.975 36.149 1.00 0.00 H ATOM 56513 C113 OL 1377 132.603 58.633 37.122 1.00 0.00 C ATOM 56514 H13R OL 1377 132.536 58.025 38.027 1.00 0.00 H ATOM 56515 H13S OL 1377 133.658 58.831 36.921 1.00 0.00 H ATOM 56516 C114 OL 1377 131.952 59.933 37.547 1.00 0.00 C ATOM 56517 H14R OL 1377 131.363 60.444 36.783 1.00 0.00 H ATOM 56518 H14S OL 1377 131.242 59.673 38.335 1.00 0.00 H ATOM 56519 C115 OL 1377 132.996 60.901 38.089 1.00 0.00 C ATOM 56520 H15R OL 1377 133.594 60.416 38.863 1.00 0.00 H ATOM 56521 H15S OL 1377 133.588 61.230 37.232 1.00 0.00 H ATOM 56522 C116 OL 1377 132.286 62.214 38.723 1.00 0.00 C ATOM 56523 H16R OL 1377 133.153 62.757 39.105 1.00 0.00 H ATOM 56524 H16S OL 1377 131.779 62.860 38.003 1.00 0.00 H ATOM 56525 C117 OL 1377 131.324 62.032 39.962 1.00 0.00 C ATOM 56526 H17R OL 1377 130.377 61.627 39.599 1.00 0.00 H ATOM 56527 H17S OL 1377 131.753 61.305 40.656 1.00 0.00 H ATOM 56528 C118 OL 1377 131.147 63.301 40.672 1.00 0.00 C ATOM 56529 H18R OL 1377 130.820 63.125 41.699 1.00 0.00 H ATOM 56530 H18S OL 1377 130.393 63.995 40.295 1.00 0.00 H ATOM 56531 H18T OL 1377 132.094 63.815 40.848 1.00 0.00 H TER 56532 OL 1377 ATOM 56532 C116 PA 1378 49.170 107.636 44.309 1.00 0.00 C ATOM 56533 H16R PA 1378 49.131 106.631 44.734 1.00 0.00 H ATOM 56534 H16S PA 1378 49.227 108.189 45.249 1.00 0.00 H ATOM 56535 H16T PA 1378 50.129 107.705 43.793 1.00 0.00 H ATOM 56536 C115 PA 1378 47.942 108.201 43.491 1.00 0.00 C ATOM 56537 H15R PA 1378 48.110 109.277 43.419 1.00 0.00 H ATOM 56538 H15S PA 1378 46.976 107.974 43.946 1.00 0.00 H ATOM 56539 C114 PA 1378 47.819 107.685 42.062 1.00 0.00 C ATOM 56540 H14R PA 1378 47.667 106.604 42.079 1.00 0.00 H ATOM 56541 H14S PA 1378 48.830 107.679 41.649 1.00 0.00 H ATOM 56542 C113 PA 1378 46.753 108.235 41.114 1.00 0.00 C ATOM 56543 H13R PA 1378 45.743 108.229 41.529 1.00 0.00 H ATOM 56544 H13S PA 1378 46.792 107.561 40.255 1.00 0.00 H ATOM 56545 C112 PA 1378 47.011 109.707 40.674 1.00 0.00 C ATOM 56546 H12R PA 1378 47.928 109.737 40.081 1.00 0.00 H ATOM 56547 H12S PA 1378 46.954 110.366 41.542 1.00 0.00 H ATOM 56548 C111 PA 1378 45.847 110.278 39.905 1.00 0.00 C ATOM 56549 H11R PA 1378 45.898 111.366 39.831 1.00 0.00 H ATOM 56550 H11S PA 1378 44.917 110.035 40.423 1.00 0.00 H ATOM 56551 C110 PA 1378 45.840 109.786 38.459 1.00 0.00 C ATOM 56552 H10R PA 1378 45.979 108.703 38.474 1.00 0.00 H ATOM 56553 H10S PA 1378 46.738 110.077 37.910 1.00 0.00 H ATOM 56554 C19 PA 1378 44.762 110.219 37.498 1.00 0.00 C ATOM 56555 H9R PA 1378 44.716 111.290 37.289 1.00 0.00 H ATOM 56556 H9S PA 1378 43.796 109.855 37.854 1.00 0.00 H ATOM 56557 C18 PA 1378 44.915 109.532 36.118 1.00 0.00 C ATOM 56558 H8R PA 1378 45.061 108.467 36.311 1.00 0.00 H ATOM 56559 H8S PA 1378 45.836 109.802 35.599 1.00 0.00 H ATOM 56560 C17 PA 1378 43.766 109.910 35.161 1.00 0.00 C ATOM 56561 H7R PA 1378 44.121 110.914 34.919 1.00 0.00 H ATOM 56562 H7S PA 1378 42.756 109.845 35.572 1.00 0.00 H ATOM 56563 C16 PA 1378 43.830 109.108 33.859 1.00 0.00 C ATOM 56564 H6R PA 1378 43.956 108.051 34.104 1.00 0.00 H ATOM 56565 H6S PA 1378 44.730 109.418 33.326 1.00 0.00 H ATOM 56566 C15 PA 1378 42.581 109.143 33.084 1.00 0.00 C ATOM 56567 H5R PA 1378 42.339 110.036 32.503 1.00 0.00 H ATOM 56568 H5S PA 1378 41.733 109.002 33.757 1.00 0.00 H ATOM 56569 C14 PA 1378 42.450 108.079 32.059 1.00 0.00 C ATOM 56570 H4R PA 1378 42.772 107.089 32.388 1.00 0.00 H ATOM 56571 H4S PA 1378 43.110 108.377 31.242 1.00 0.00 H ATOM 56572 C13 PA 1378 41.017 108.001 31.438 1.00 0.00 C ATOM 56573 H3R PA 1378 40.635 109.023 31.474 1.00 0.00 H ATOM 56574 H3S PA 1378 40.501 107.412 32.199 1.00 0.00 H ATOM 56575 C12 PA 1378 40.937 107.618 29.979 1.00 0.00 C ATOM 56576 H2R PA 1378 41.303 108.257 29.172 1.00 0.00 H ATOM 56577 H2S PA 1378 39.865 107.532 29.789 1.00 0.00 H ATOM 56578 C11 PC 1379 41.357 106.137 29.725 1.00 0.00 C ATOM 56579 O12 PC 1379 40.481 105.313 29.512 1.00 0.00 O ATOM 56580 O11 PC 1379 42.695 105.818 29.783 1.00 0.00 O ATOM 56581 C1 PC 1379 43.034 104.505 29.508 1.00 0.00 C ATOM 56582 HR PC 1379 42.445 103.894 30.196 1.00 0.00 H ATOM 56583 HS PC 1379 44.076 104.413 29.824 1.00 0.00 H ATOM 56584 C2 PC 1379 42.816 104.260 27.985 1.00 0.00 C ATOM 56585 HX PC 1379 41.797 104.524 27.691 1.00 0.00 H ATOM 56586 C3 PC 1379 43.014 102.767 27.669 1.00 0.00 C ATOM 56587 HA PC 1379 42.193 102.211 28.128 1.00 0.00 H ATOM 56588 HB PC 1379 43.940 102.435 28.147 1.00 0.00 H ATOM 56589 O31 PC 1379 43.129 102.471 26.250 1.00 0.00 O ATOM 56590 P31 PC 1379 41.965 102.943 25.306 1.00 0.00 P ATOM 56591 O32 PC 1379 42.207 104.482 24.829 1.00 0.00 O ATOM 56592 C31 PC 1379 43.155 104.750 23.848 1.00 0.00 C ATOM 56593 H1A PC 1379 43.037 104.070 23.001 1.00 0.00 H ATOM 56594 H1B PC 1379 44.138 104.650 24.317 1.00 0.00 H ATOM 56595 C32 PC 1379 42.770 106.205 23.406 1.00 0.00 C ATOM 56596 H2A PC 1379 43.621 106.612 22.858 1.00 0.00 H ATOM 56597 H2B PC 1379 42.816 106.945 24.206 1.00 0.00 H ATOM 56598 N31 PC 1379 41.465 106.356 22.586 1.00 0.00 N ATOM 56599 C33 PC 1379 41.655 105.604 21.401 1.00 0.00 C ATOM 56600 H3A PC 1379 42.598 105.954 20.978 1.00 0.00 H ATOM 56601 H3B PC 1379 40.836 105.747 20.695 1.00 0.00 H ATOM 56602 H3C PC 1379 41.615 104.561 21.719 1.00 0.00 H ATOM 56603 C34 PC 1379 40.227 106.008 23.327 1.00 0.00 C ATOM 56604 H4A PC 1379 40.174 104.920 23.383 1.00 0.00 H ATOM 56605 H4B PC 1379 39.426 106.348 22.668 1.00 0.00 H ATOM 56606 H4C PC 1379 40.261 106.514 24.293 1.00 0.00 H ATOM 56607 C35 PC 1379 41.475 107.758 22.070 1.00 0.00 C ATOM 56608 H5A PC 1379 42.494 107.953 21.732 1.00 0.00 H ATOM 56609 H5B PC 1379 41.286 108.281 23.009 1.00 0.00 H ATOM 56610 H5C PC 1379 40.703 107.751 21.300 1.00 0.00 H ATOM 56611 O33 PC 1379 42.126 102.145 24.074 1.00 0.00 O ATOM 56612 O34 PC 1379 40.645 102.853 26.059 1.00 0.00 O ATOM 56613 O21 PC 1379 43.857 104.929 27.239 1.00 0.00 O ATOM 56614 C21 PC 1379 43.723 106.273 27.264 1.00 0.00 C ATOM 56615 O22 PC 1379 42.667 106.851 27.050 1.00 0.00 O ATOM 56616 C12 OL 1380 45.012 106.996 27.343 1.00 0.00 C ATOM 56617 H2R OL 1380 45.823 106.268 27.405 1.00 0.00 H ATOM 56618 H2S OL 1380 45.115 107.537 26.400 1.00 0.00 H ATOM 56619 C13 OL 1380 45.095 107.894 28.637 1.00 0.00 C ATOM 56620 H3R OL 1380 44.212 108.529 28.543 1.00 0.00 H ATOM 56621 H3S OL 1380 44.895 107.328 29.549 1.00 0.00 H ATOM 56622 C14 OL 1380 46.494 108.603 28.704 1.00 0.00 C ATOM 56623 H4R OL 1380 47.249 107.874 28.401 1.00 0.00 H ATOM 56624 H4S OL 1380 46.480 109.344 27.902 1.00 0.00 H ATOM 56625 C15 OL 1380 46.659 109.405 30.050 1.00 0.00 C ATOM 56626 H5R OL 1380 47.599 109.903 29.805 1.00 0.00 H ATOM 56627 H5S OL 1380 46.050 110.275 30.305 1.00 0.00 H ATOM 56628 C16 OL 1380 46.817 108.518 31.259 1.00 0.00 C ATOM 56629 H6R OL 1380 45.825 108.079 31.383 1.00 0.00 H ATOM 56630 H6S OL 1380 47.433 107.637 31.069 1.00 0.00 H ATOM 56631 C17 OL 1380 47.307 109.225 32.481 1.00 0.00 C ATOM 56632 H7R OL 1380 48.295 109.625 32.243 1.00 0.00 H ATOM 56633 H7S OL 1380 46.773 110.175 32.549 1.00 0.00 H ATOM 56634 C18 OL 1380 47.315 108.368 33.743 1.00 0.00 C ATOM 56635 H8R OL 1380 46.296 108.320 34.132 1.00 0.00 H ATOM 56636 H8S OL 1380 47.499 107.365 33.352 1.00 0.00 H ATOM 56637 C19 OL 1380 48.378 108.715 34.720 1.00 0.00 C ATOM 56638 H9R OL 1380 48.071 109.475 35.434 1.00 0.00 H ATOM 56639 C110 OL 1380 49.672 108.309 34.656 1.00 0.00 C ATOM 56640 H10R OL 1380 50.370 108.689 35.397 1.00 0.00 H ATOM 56641 C111 OL 1380 50.348 107.397 33.623 1.00 0.00 C ATOM 56642 H11R OL 1380 49.659 107.300 32.781 1.00 0.00 H ATOM 56643 H11S OL 1380 51.308 107.828 33.331 1.00 0.00 H ATOM 56644 C112 OL 1380 50.773 106.067 34.194 1.00 0.00 C ATOM 56645 H12R OL 1380 51.458 106.241 35.026 1.00 0.00 H ATOM 56646 H12S OL 1380 49.872 105.558 34.543 1.00 0.00 H ATOM 56647 C113 OL 1380 51.504 105.146 33.139 1.00 0.00 C ATOM 56648 H13R OL 1380 51.000 105.102 32.171 1.00 0.00 H ATOM 56649 H13S OL 1380 52.520 105.444 32.870 1.00 0.00 H ATOM 56650 C114 OL 1380 51.497 103.743 33.562 1.00 0.00 C ATOM 56651 H14R OL 1380 50.497 103.448 33.889 1.00 0.00 H ATOM 56652 H14S OL 1380 51.732 103.222 32.632 1.00 0.00 H ATOM 56653 C115 OL 1380 52.511 103.325 34.633 1.00 0.00 C ATOM 56654 H15R OL 1380 52.663 102.255 34.472 1.00 0.00 H ATOM 56655 H15S OL 1380 53.507 103.766 34.548 1.00 0.00 H ATOM 56656 C116 OL 1380 51.941 103.579 36.057 1.00 0.00 C ATOM 56657 H16R OL 1380 51.823 104.651 36.228 1.00 0.00 H ATOM 56658 H16S OL 1380 50.950 103.130 36.150 1.00 0.00 H ATOM 56659 C117 OL 1380 52.796 102.925 37.099 1.00 0.00 C ATOM 56660 H17R OL 1380 52.699 101.853 36.913 1.00 0.00 H ATOM 56661 H17S OL 1380 53.858 103.145 36.976 1.00 0.00 H ATOM 56662 C118 OL 1380 52.370 103.412 38.523 1.00 0.00 C ATOM 56663 H18R OL 1380 53.133 103.100 39.240 1.00 0.00 H ATOM 56664 H18S OL 1380 51.370 103.096 38.827 1.00 0.00 H ATOM 56665 H18T OL 1380 52.419 104.502 38.486 1.00 0.00 H TER 56666 OL 1380 ATOM 56666 C116 PA 1381 36.116 99.188 47.822 1.00 0.00 C ATOM 56667 H16R PA 1381 36.281 98.191 48.234 1.00 0.00 H ATOM 56668 H16S PA 1381 35.035 99.329 47.764 1.00 0.00 H ATOM 56669 H16T PA 1381 36.512 99.859 48.588 1.00 0.00 H ATOM 56670 C115 PA 1381 36.777 99.293 46.572 1.00 0.00 C ATOM 56671 H15R PA 1381 37.840 99.403 46.797 1.00 0.00 H ATOM 56672 H15S PA 1381 36.437 100.215 46.097 1.00 0.00 H ATOM 56673 C114 PA 1381 36.368 98.173 45.556 1.00 0.00 C ATOM 56674 H14R PA 1381 35.291 98.252 45.392 1.00 0.00 H ATOM 56675 H14S PA 1381 36.633 97.218 46.015 1.00 0.00 H ATOM 56676 C113 PA 1381 37.147 98.165 44.211 1.00 0.00 C ATOM 56677 H13R PA 1381 37.981 97.481 44.382 1.00 0.00 H ATOM 56678 H13S PA 1381 37.557 99.164 44.052 1.00 0.00 H ATOM 56679 C112 PA 1381 36.407 97.612 43.020 1.00 0.00 C ATOM 56680 H12R PA 1381 35.482 98.118 42.737 1.00 0.00 H ATOM 56681 H12S PA 1381 36.166 96.602 43.359 1.00 0.00 H ATOM 56682 C111 PA 1381 37.189 97.189 41.753 1.00 0.00 C ATOM 56683 H11R PA 1381 38.036 96.564 42.043 1.00 0.00 H ATOM 56684 H11S PA 1381 37.562 98.111 41.302 1.00 0.00 H ATOM 56685 C110 PA 1381 36.325 96.345 40.827 1.00 0.00 C ATOM 56686 H10R PA 1381 35.395 96.838 40.534 1.00 0.00 H ATOM 56687 H10S PA 1381 35.968 95.439 41.321 1.00 0.00 H ATOM 56688 C19 PA 1381 37.054 95.978 39.537 1.00 0.00 C ATOM 56689 H9R PA 1381 36.480 95.286 38.917 1.00 0.00 H ATOM 56690 H9S PA 1381 37.984 95.498 39.848 1.00 0.00 H ATOM 56691 C18 PA 1381 37.120 97.328 38.660 1.00 0.00 C ATOM 56692 H8R PA 1381 37.417 98.256 39.152 1.00 0.00 H ATOM 56693 H8S PA 1381 36.132 97.535 38.244 1.00 0.00 H ATOM 56694 C17 PA 1381 38.103 97.046 37.516 1.00 0.00 C ATOM 56695 H7R PA 1381 37.955 96.084 37.019 1.00 0.00 H ATOM 56696 H7S PA 1381 39.093 97.025 37.977 1.00 0.00 H ATOM 56697 C16 PA 1381 38.241 98.031 36.325 1.00 0.00 C ATOM 56698 H6R PA 1381 38.822 98.897 36.649 1.00 0.00 H ATOM 56699 H6S PA 1381 37.310 98.523 36.035 1.00 0.00 H ATOM 56700 C15 PA 1381 38.791 97.238 35.064 1.00 0.00 C ATOM 56701 H5R PA 1381 38.017 96.534 34.754 1.00 0.00 H ATOM 56702 H5S PA 1381 39.691 96.713 35.389 1.00 0.00 H ATOM 56703 C14 PA 1381 39.042 98.131 33.880 1.00 0.00 C ATOM 56704 H4R PA 1381 40.120 98.299 33.856 1.00 0.00 H ATOM 56705 H4S PA 1381 38.624 99.118 34.087 1.00 0.00 H ATOM 56706 C13 PA 1381 38.676 97.390 32.581 1.00 0.00 C ATOM 56707 H3R PA 1381 37.634 97.074 32.662 1.00 0.00 H ATOM 56708 H3S PA 1381 39.174 96.420 32.521 1.00 0.00 H ATOM 56709 C12 PA 1381 38.875 98.191 31.356 1.00 0.00 C ATOM 56710 H2R PA 1381 39.931 98.301 31.099 1.00 0.00 H ATOM 56711 H2S PA 1381 38.487 99.185 31.588 1.00 0.00 H ATOM 56712 C11 PC 1382 38.176 97.708 30.141 1.00 0.00 C ATOM 56713 O12 PC 1382 38.217 98.362 29.122 1.00 0.00 O ATOM 56714 O11 PC 1382 37.645 96.488 30.243 1.00 0.00 O ATOM 56715 C1 PC 1382 37.409 95.671 29.130 1.00 0.00 C ATOM 56716 HR PC 1382 36.640 96.250 28.612 1.00 0.00 H ATOM 56717 HS PC 1382 37.028 94.692 29.432 1.00 0.00 H ATOM 56718 C2 PC 1382 38.713 95.508 28.402 1.00 0.00 C ATOM 56719 HX PC 1382 39.131 96.452 28.042 1.00 0.00 H ATOM 56720 C3 PC 1382 38.579 94.639 27.169 1.00 0.00 C ATOM 56721 HA PC 1382 37.557 94.335 26.927 1.00 0.00 H ATOM 56722 HB PC 1382 39.206 93.747 27.245 1.00 0.00 H ATOM 56723 O31 PC 1382 39.053 95.220 26.039 1.00 0.00 O ATOM 56724 P31 PC 1382 39.444 94.302 24.848 1.00 0.00 P ATOM 56725 O32 PC 1382 39.608 95.287 23.642 1.00 0.00 O ATOM 56726 C31 PC 1382 38.471 95.873 23.057 1.00 0.00 C ATOM 56727 H1A PC 1382 37.733 96.117 23.826 1.00 0.00 H ATOM 56728 H1B PC 1382 38.024 95.260 22.270 1.00 0.00 H ATOM 56729 C32 PC 1382 39.115 97.096 22.414 1.00 0.00 C ATOM 56730 H2A PC 1382 39.812 96.741 21.653 1.00 0.00 H ATOM 56731 H2B PC 1382 39.682 97.695 23.128 1.00 0.00 H ATOM 56732 N31 PC 1382 38.216 98.069 21.713 1.00 0.00 N ATOM 56733 C33 PC 1382 37.422 97.329 20.695 1.00 0.00 C ATOM 56734 H3A PC 1382 36.673 96.669 21.136 1.00 0.00 H ATOM 56735 H3B PC 1382 38.046 96.806 19.969 1.00 0.00 H ATOM 56736 H3C PC 1382 36.902 98.113 20.142 1.00 0.00 H ATOM 56737 C34 PC 1382 37.314 98.839 22.691 1.00 0.00 C ATOM 56738 H4A PC 1382 36.782 98.062 23.242 1.00 0.00 H ATOM 56739 H4B PC 1382 36.679 99.565 22.183 1.00 0.00 H ATOM 56740 H4C PC 1382 38.018 99.258 23.412 1.00 0.00 H ATOM 56741 C35 PC 1382 39.104 98.997 20.997 1.00 0.00 C ATOM 56742 H5A PC 1382 39.558 99.580 21.799 1.00 0.00 H ATOM 56743 H5B PC 1382 38.501 99.680 20.397 1.00 0.00 H ATOM 56744 H5C PC 1382 39.942 98.526 20.482 1.00 0.00 H ATOM 56745 O33 PC 1382 40.784 93.750 25.060 1.00 0.00 O ATOM 56746 O34 PC 1382 38.321 93.427 24.519 1.00 0.00 O ATOM 56747 O21 PC 1382 39.683 95.016 29.363 1.00 0.00 O ATOM 56748 C21 PC 1382 39.634 93.758 29.856 1.00 0.00 C ATOM 56749 O22 PC 1382 38.856 92.907 29.477 1.00 0.00 O ATOM 56750 C12 OL 1383 40.560 93.652 31.142 1.00 0.00 C ATOM 56751 H2R OL 1383 41.483 93.080 31.029 1.00 0.00 H ATOM 56752 H2S OL 1383 40.742 94.695 31.411 1.00 0.00 H ATOM 56753 C13 OL 1383 39.859 93.090 32.404 1.00 0.00 C ATOM 56754 H3R OL 1383 39.022 93.759 32.614 1.00 0.00 H ATOM 56755 H3S OL 1383 39.361 92.140 32.202 1.00 0.00 H ATOM 56756 C14 OL 1383 40.824 93.151 33.608 1.00 0.00 C ATOM 56757 H4R OL 1383 41.751 92.663 33.301 1.00 0.00 H ATOM 56758 H4S OL 1383 41.126 94.155 33.914 1.00 0.00 H ATOM 56759 C15 OL 1383 40.172 92.538 34.926 1.00 0.00 C ATOM 56760 H5R OL 1383 39.095 92.705 34.987 1.00 0.00 H ATOM 56761 H5S OL 1383 40.317 91.464 34.797 1.00 0.00 H ATOM 56762 C16 OL 1383 40.733 92.971 36.287 1.00 0.00 C ATOM 56763 H6R OL 1383 41.806 92.768 36.251 1.00 0.00 H ATOM 56764 H6S OL 1383 40.516 94.041 36.290 1.00 0.00 H ATOM 56765 C17 OL 1383 40.069 92.300 37.476 1.00 0.00 C ATOM 56766 H7R OL 1383 39.734 91.289 37.237 1.00 0.00 H ATOM 56767 H7S OL 1383 40.886 92.190 38.191 1.00 0.00 H ATOM 56768 C18 OL 1383 38.921 93.134 38.032 1.00 0.00 C ATOM 56769 H8R OL 1383 39.295 94.114 38.335 1.00 0.00 H ATOM 56770 H8S OL 1383 38.068 93.361 37.388 1.00 0.00 H ATOM 56771 C19 OL 1383 38.428 92.565 39.294 1.00 0.00 C ATOM 56772 H9R OL 1383 39.163 92.399 40.078 1.00 0.00 H ATOM 56773 C110 OL 1383 37.221 92.033 39.579 1.00 0.00 C ATOM 56774 H10R OL 1383 37.164 91.661 40.599 1.00 0.00 H ATOM 56775 C111 OL 1383 35.934 92.100 38.848 1.00 0.00 C ATOM 56776 H11R OL 1383 35.201 92.425 39.589 1.00 0.00 H ATOM 56777 H11S OL 1383 36.025 92.903 38.115 1.00 0.00 H ATOM 56778 C112 OL 1383 35.608 90.780 38.232 1.00 0.00 C ATOM 56779 H12R OL 1383 36.423 90.439 37.590 1.00 0.00 H ATOM 56780 H12S OL 1383 35.468 90.003 38.987 1.00 0.00 H ATOM 56781 C113 OL 1383 34.452 90.812 37.252 1.00 0.00 C ATOM 56782 H13R OL 1383 33.595 91.247 37.771 1.00 0.00 H ATOM 56783 H13S OL 1383 34.665 91.577 36.503 1.00 0.00 H ATOM 56784 C114 OL 1383 34.117 89.488 36.602 1.00 0.00 C ATOM 56785 H14R OL 1383 33.633 89.666 35.639 1.00 0.00 H ATOM 56786 H14S OL 1383 34.960 88.923 36.199 1.00 0.00 H ATOM 56787 C115 OL 1383 33.237 88.520 37.454 1.00 0.00 C ATOM 56788 H15R OL 1383 33.551 88.445 38.497 1.00 0.00 H ATOM 56789 H15S OL 1383 32.278 89.042 37.440 1.00 0.00 H ATOM 56790 C116 OL 1383 32.929 87.162 36.988 1.00 0.00 C ATOM 56791 H16R OL 1383 32.550 87.260 35.968 1.00 0.00 H ATOM 56792 H16S OL 1383 33.834 86.553 36.953 1.00 0.00 H ATOM 56793 C117 OL 1383 31.864 86.362 37.853 1.00 0.00 C ATOM 56794 H17R OL 1383 32.171 86.196 38.887 1.00 0.00 H ATOM 56795 H17S OL 1383 30.883 86.838 37.907 1.00 0.00 H ATOM 56796 C118 OL 1383 31.606 84.971 37.301 1.00 0.00 C ATOM 56797 H18R OL 1383 30.785 84.966 36.581 1.00 0.00 H ATOM 56798 H18S OL 1383 31.187 84.327 38.077 1.00 0.00 H ATOM 56799 H18T OL 1383 32.516 84.623 36.807 1.00 0.00 H TER 56800 OL 1383 ATOM 56800 C116 PA 1384 87.035 22.437 40.009 1.00 0.00 C ATOM 56801 H16R PA 1384 87.426 23.415 39.723 1.00 0.00 H ATOM 56802 H16S PA 1384 87.530 22.235 40.961 1.00 0.00 H ATOM 56803 H16T PA 1384 85.944 22.489 40.017 1.00 0.00 H ATOM 56804 C115 PA 1384 87.367 21.347 38.938 1.00 0.00 C ATOM 56805 H15R PA 1384 87.023 20.390 39.336 1.00 0.00 H ATOM 56806 H15S PA 1384 88.450 21.269 38.820 1.00 0.00 H ATOM 56807 C114 PA 1384 86.672 21.506 37.600 1.00 0.00 C ATOM 56808 H14R PA 1384 87.120 22.445 37.269 1.00 0.00 H ATOM 56809 H14S PA 1384 85.583 21.559 37.542 1.00 0.00 H ATOM 56810 C113 PA 1384 87.195 20.544 36.552 1.00 0.00 C ATOM 56811 H13R PA 1384 86.859 19.545 36.839 1.00 0.00 H ATOM 56812 H13S PA 1384 88.284 20.471 36.515 1.00 0.00 H ATOM 56813 C112 PA 1384 86.747 21.061 35.184 1.00 0.00 C ATOM 56814 H12R PA 1384 87.474 21.858 35.011 1.00 0.00 H ATOM 56815 H12S PA 1384 85.737 21.476 35.153 1.00 0.00 H ATOM 56816 C111 PA 1384 86.888 20.009 34.140 1.00 0.00 C ATOM 56817 H11R PA 1384 86.397 19.134 34.571 1.00 0.00 H ATOM 56818 H11S PA 1384 87.954 19.812 34.015 1.00 0.00 H ATOM 56819 C110 PA 1384 86.362 20.483 32.808 1.00 0.00 C ATOM 56820 H10R PA 1384 86.931 21.263 32.298 1.00 0.00 H ATOM 56821 H10S PA 1384 85.414 21.025 32.814 1.00 0.00 H ATOM 56822 C19 PA 1384 86.189 19.389 31.826 1.00 0.00 C ATOM 56823 H9R PA 1384 85.615 18.594 32.307 1.00 0.00 H ATOM 56824 H9S PA 1384 87.176 18.982 31.597 1.00 0.00 H ATOM 56825 C18 PA 1384 85.388 19.648 30.555 1.00 0.00 C ATOM 56826 H8R PA 1384 84.320 19.694 30.778 1.00 0.00 H ATOM 56827 H8S PA 1384 85.435 18.747 29.941 1.00 0.00 H ATOM 56828 C17 PA 1384 85.918 20.863 29.836 1.00 0.00 C ATOM 56829 H7R PA 1384 86.938 20.512 29.662 1.00 0.00 H ATOM 56830 H7S PA 1384 85.903 21.771 30.441 1.00 0.00 H ATOM 56831 C16 PA 1384 85.305 21.290 28.484 1.00 0.00 C ATOM 56832 H6R PA 1384 84.220 21.411 28.513 1.00 0.00 H ATOM 56833 H6S PA 1384 85.399 20.453 27.789 1.00 0.00 H ATOM 56834 C15 PA 1384 85.900 22.508 27.777 1.00 0.00 C ATOM 56835 H5R PA 1384 86.984 22.490 27.640 1.00 0.00 H ATOM 56836 H5S PA 1384 85.684 23.342 28.449 1.00 0.00 H ATOM 56837 C14 PA 1384 85.322 22.784 26.394 1.00 0.00 C ATOM 56838 H4R PA 1384 84.281 23.032 26.614 1.00 0.00 H ATOM 56839 H4S PA 1384 85.365 21.906 25.747 1.00 0.00 H ATOM 56840 C13 PA 1384 85.923 23.965 25.686 1.00 0.00 C ATOM 56841 H3R PA 1384 86.998 23.840 25.539 1.00 0.00 H ATOM 56842 H3S PA 1384 85.739 24.830 26.327 1.00 0.00 H ATOM 56843 C12 PA 1384 85.172 24.244 24.379 1.00 0.00 C ATOM 56844 H2R PA 1384 84.999 23.292 23.874 1.00 0.00 H ATOM 56845 H2S PA 1384 84.164 24.567 24.649 1.00 0.00 H ATOM 56846 C11 PGR 1385 85.846 25.229 23.450 1.00 0.00 C ATOM 56847 O12 PGR 1385 85.546 26.366 23.437 1.00 0.00 O ATOM 56848 O11 PGR 1385 86.731 24.594 22.621 1.00 0.00 O ATOM 56849 C1 PGR 1385 87.414 25.384 21.671 1.00 0.00 C ATOM 56850 HR PGR 1385 86.669 26.008 21.172 1.00 0.00 H ATOM 56851 HS PGR 1385 87.872 24.817 20.856 1.00 0.00 H ATOM 56852 C2 PGR 1385 88.556 26.284 22.292 1.00 0.00 C ATOM 56853 HX PGR 1385 88.064 27.052 22.894 1.00 0.00 H ATOM 56854 C3 PGR 1385 89.233 27.083 21.241 1.00 0.00 C ATOM 56855 HA PGR 1385 90.234 27.464 21.459 1.00 0.00 H ATOM 56856 HB PGR 1385 88.769 28.052 21.043 1.00 0.00 H ATOM 56857 O31 PGR 1385 89.429 26.347 20.042 1.00 0.00 O ATOM 56858 P31 PGR 1385 89.800 27.088 18.687 1.00 0.00 P ATOM 56859 O32 PGR 1385 89.762 25.905 17.572 1.00 0.00 O ATOM 56860 C31 PGR 1385 90.941 25.356 17.119 1.00 0.00 C ATOM 56861 H1A PGR 1385 91.540 25.009 17.965 1.00 0.00 H ATOM 56862 H1B PGR 1385 91.570 26.101 16.624 1.00 0.00 H ATOM 56863 C32 PGR 1385 90.566 24.110 16.256 1.00 0.00 C ATOM 56864 H2A PGR 1385 89.690 24.414 15.677 1.00 0.00 H ATOM 56865 O35 PGR 1385 90.324 22.884 16.939 1.00 0.00 O ATOM 56866 HO5A PGR 1385 90.942 22.810 17.688 1.00 0.00 H ATOM 56867 C33 PGR 1385 91.660 23.865 15.205 1.00 0.00 C ATOM 56868 H3A PGR 1385 91.456 22.990 14.583 1.00 0.00 H ATOM 56869 H3B PGR 1385 91.583 24.694 14.497 1.00 0.00 H ATOM 56870 O33 PGR 1385 88.716 28.041 18.502 1.00 0.00 O ATOM 56871 O34 PGR 1385 91.177 27.611 18.857 1.00 0.00 O ATOM 56872 O21 PGR 1385 89.436 25.507 23.029 1.00 0.00 O ATOM 56873 C21 PGR 1385 90.414 26.111 23.705 1.00 0.00 C ATOM 56874 O22 PGR 1385 90.341 27.306 23.885 1.00 0.00 O ATOM 56875 O36 PGR 1385 92.971 23.851 15.750 1.00 0.00 O ATOM 56876 HO6A PGR 1385 93.134 23.008 16.210 1.00 0.00 H ATOM 56877 C12 OL 1386 91.425 25.179 24.315 1.00 0.00 C ATOM 56878 H2R OL 1386 91.174 25.017 25.365 1.00 0.00 H ATOM 56879 H2S OL 1386 91.400 24.170 23.899 1.00 0.00 H ATOM 56880 C13 OL 1386 92.930 25.663 24.204 1.00 0.00 C ATOM 56881 H3R OL 1386 93.214 26.100 23.245 1.00 0.00 H ATOM 56882 H3S OL 1386 93.026 26.498 24.901 1.00 0.00 H ATOM 56883 C14 OL 1386 93.906 24.416 24.460 1.00 0.00 C ATOM 56884 H4R OL 1386 93.736 24.305 25.533 1.00 0.00 H ATOM 56885 H4S OL 1386 93.484 23.527 23.988 1.00 0.00 H ATOM 56886 C15 OL 1386 95.362 24.706 24.122 1.00 0.00 C ATOM 56887 H5R OL 1386 95.898 23.763 24.249 1.00 0.00 H ATOM 56888 H5S OL 1386 95.442 24.821 23.039 1.00 0.00 H ATOM 56889 C16 OL 1386 96.070 25.791 24.892 1.00 0.00 C ATOM 56890 H6R OL 1386 95.581 26.752 24.723 1.00 0.00 H ATOM 56891 H6S OL 1386 95.856 25.723 25.961 1.00 0.00 H ATOM 56892 C17 OL 1386 97.556 26.011 24.595 1.00 0.00 C ATOM 56893 H7R OL 1386 97.717 25.923 23.519 1.00 0.00 H ATOM 56894 H7S OL 1386 97.935 26.985 24.909 1.00 0.00 H ATOM 56895 C18 OL 1386 98.447 24.842 25.180 1.00 0.00 C ATOM 56896 H8R OL 1386 98.170 23.986 24.561 1.00 0.00 H ATOM 56897 H8S OL 1386 99.487 25.111 24.981 1.00 0.00 H ATOM 56898 C19 OL 1386 98.329 24.608 26.641 1.00 0.00 C ATOM 56899 H9R OL 1386 97.657 23.762 26.757 1.00 0.00 H ATOM 56900 C110 OL 1386 98.980 25.315 27.551 1.00 0.00 C ATOM 56901 H10R OL 1386 98.934 25.044 28.603 1.00 0.00 H ATOM 56902 C111 OL 1386 99.865 26.573 27.320 1.00 0.00 C ATOM 56903 H11R OL 1386 99.664 27.055 26.361 1.00 0.00 H ATOM 56904 H11S OL 1386 99.686 27.309 28.107 1.00 0.00 H ATOM 56905 C112 OL 1386 101.308 26.117 27.341 1.00 0.00 C ATOM 56906 H12R OL 1386 101.597 25.476 26.506 1.00 0.00 H ATOM 56907 H12S OL 1386 102.022 26.936 27.231 1.00 0.00 H ATOM 56908 C113 OL 1386 101.908 25.634 28.691 1.00 0.00 C ATOM 56909 H13R OL 1386 101.798 26.451 29.407 1.00 0.00 H ATOM 56910 H13S OL 1386 101.264 24.833 29.059 1.00 0.00 H ATOM 56911 C114 OL 1386 103.305 25.061 28.672 1.00 0.00 C ATOM 56912 H14R OL 1386 103.232 24.212 27.988 1.00 0.00 H ATOM 56913 H14S OL 1386 104.013 25.643 28.078 1.00 0.00 H ATOM 56914 C115 OL 1386 104.003 24.790 30.022 1.00 0.00 C ATOM 56915 H15R OL 1386 103.289 24.248 30.646 1.00 0.00 H ATOM 56916 H15S OL 1386 104.810 24.081 29.829 1.00 0.00 H ATOM 56917 C116 OL 1386 104.550 25.996 30.775 1.00 0.00 C ATOM 56918 H16R OL 1386 105.246 26.475 30.083 1.00 0.00 H ATOM 56919 H16S OL 1386 103.756 26.701 31.029 1.00 0.00 H ATOM 56920 C117 OL 1386 105.146 25.622 32.122 1.00 0.00 C ATOM 56921 H17R OL 1386 104.323 25.242 32.732 1.00 0.00 H ATOM 56922 H17S OL 1386 105.807 24.756 32.055 1.00 0.00 H ATOM 56923 C118 OL 1386 105.614 26.806 33.013 1.00 0.00 C ATOM 56924 H18R OL 1386 105.411 26.552 34.055 1.00 0.00 H ATOM 56925 H18S OL 1386 105.105 27.746 32.788 1.00 0.00 H ATOM 56926 H18T OL 1386 106.705 26.809 32.959 1.00 0.00 H TER 56927 OL 1386 ATOM 56927 C116 PA 1387 66.601 41.183 44.863 1.00 0.00 C ATOM 56928 H16R PA 1387 66.794 42.095 45.432 1.00 0.00 H ATOM 56929 H16S PA 1387 67.076 40.381 45.431 1.00 0.00 H ATOM 56930 H16T PA 1387 65.603 40.887 45.195 1.00 0.00 H ATOM 56931 C115 PA 1387 66.997 40.974 43.391 1.00 0.00 C ATOM 56932 H15R PA 1387 66.146 40.800 42.729 1.00 0.00 H ATOM 56933 H15S PA 1387 67.559 40.038 43.399 1.00 0.00 H ATOM 56934 C114 PA 1387 67.881 42.093 42.859 1.00 0.00 C ATOM 56935 H14R PA 1387 68.701 41.993 43.573 1.00 0.00 H ATOM 56936 H14S PA 1387 67.462 43.067 43.121 1.00 0.00 H ATOM 56937 C113 PA 1387 68.246 41.942 41.330 1.00 0.00 C ATOM 56938 H13R PA 1387 69.132 42.526 41.069 1.00 0.00 H ATOM 56939 H13S PA 1387 67.428 42.472 40.839 1.00 0.00 H ATOM 56940 C112 PA 1387 68.497 40.654 40.664 1.00 0.00 C ATOM 56941 H12R PA 1387 67.541 40.128 40.686 1.00 0.00 H ATOM 56942 H12S PA 1387 69.185 40.089 41.297 1.00 0.00 H ATOM 56943 C111 PA 1387 69.038 40.666 39.248 1.00 0.00 C ATOM 56944 H11R PA 1387 69.997 41.183 39.165 1.00 0.00 H ATOM 56945 H11S PA 1387 68.337 41.295 38.695 1.00 0.00 H ATOM 56946 C110 PA 1387 69.175 39.333 38.574 1.00 0.00 C ATOM 56947 H10R PA 1387 68.624 38.612 39.181 1.00 0.00 H ATOM 56948 H10S PA 1387 70.230 39.108 38.744 1.00 0.00 H ATOM 56949 C19 PA 1387 68.782 39.090 37.047 1.00 0.00 C ATOM 56950 H9R PA 1387 69.054 39.848 36.310 1.00 0.00 H ATOM 56951 H9S PA 1387 67.714 39.319 37.053 1.00 0.00 H ATOM 56952 C18 PA 1387 68.977 37.632 36.484 1.00 0.00 C ATOM 56953 H8R PA 1387 68.430 36.821 36.970 1.00 0.00 H ATOM 56954 H8S PA 1387 70.006 37.382 36.748 1.00 0.00 H ATOM 56955 C17 PA 1387 68.807 37.538 34.920 1.00 0.00 C ATOM 56956 H7R PA 1387 68.087 38.260 34.530 1.00 0.00 H ATOM 56957 H7S PA 1387 68.290 36.613 34.656 1.00 0.00 H ATOM 56958 C16 PA 1387 70.165 37.586 34.154 1.00 0.00 C ATOM 56959 H6R PA 1387 70.506 36.589 34.439 1.00 0.00 H ATOM 56960 H6S PA 1387 70.743 38.353 34.674 1.00 0.00 H ATOM 56961 C15 PA 1387 70.297 37.635 32.651 1.00 0.00 C ATOM 56962 H5R PA 1387 69.800 36.797 32.158 1.00 0.00 H ATOM 56963 H5S PA 1387 71.373 37.566 32.478 1.00 0.00 H ATOM 56964 C14 PA 1387 69.781 38.853 32.019 1.00 0.00 C ATOM 56965 H4R PA 1387 70.196 39.722 32.532 1.00 0.00 H ATOM 56966 H4S PA 1387 68.728 38.917 32.301 1.00 0.00 H ATOM 56967 C13 PA 1387 70.064 38.857 30.521 1.00 0.00 C ATOM 56968 H3R PA 1387 69.538 39.720 30.107 1.00 0.00 H ATOM 56969 H3S PA 1387 69.512 37.996 30.138 1.00 0.00 H ATOM 56970 C12 PA 1387 71.583 38.918 30.193 1.00 0.00 C ATOM 56971 H2R PA 1387 72.004 37.910 30.169 1.00 0.00 H ATOM 56972 H2S PA 1387 72.232 39.413 30.918 1.00 0.00 H ATOM 56973 C11 PGR 1388 71.953 39.448 28.850 1.00 0.00 C ATOM 56974 O12 PGR 1388 71.234 39.533 27.888 1.00 0.00 O ATOM 56975 O11 PGR 1388 73.232 39.941 28.765 1.00 0.00 O ATOM 56976 C1 PGR 1388 73.736 40.712 27.638 1.00 0.00 C ATOM 56977 HR PGR 1388 73.312 40.216 26.761 1.00 0.00 H ATOM 56978 HS PGR 1388 74.818 40.562 27.600 1.00 0.00 H ATOM 56979 C2 PGR 1388 73.247 42.179 27.628 1.00 0.00 C ATOM 56980 HX PGR 1388 72.171 42.273 27.793 1.00 0.00 H ATOM 56981 C3 PGR 1388 73.656 42.932 26.324 1.00 0.00 C ATOM 56982 HA PGR 1388 73.516 44.009 26.453 1.00 0.00 H ATOM 56983 HB PGR 1388 72.881 42.606 25.626 1.00 0.00 H ATOM 56984 O31 PGR 1388 74.970 42.608 25.879 1.00 0.00 O ATOM 56985 P31 PGR 1388 75.446 43.144 24.466 1.00 0.00 P ATOM 56986 O32 PGR 1388 75.320 44.650 24.681 1.00 0.00 O ATOM 56987 C31 PGR 1388 75.983 45.305 25.828 1.00 0.00 C ATOM 56988 H1A PGR 1388 76.984 44.927 26.052 1.00 0.00 H ATOM 56989 H1B PGR 1388 75.345 45.210 26.710 1.00 0.00 H ATOM 56990 C32 PGR 1388 76.280 46.782 25.578 1.00 0.00 C ATOM 56991 H2A PGR 1388 76.429 46.836 24.497 1.00 0.00 H ATOM 56992 O35 PGR 1388 77.516 47.126 26.266 1.00 0.00 O ATOM 56993 HO5A PGR 1388 77.309 47.567 27.109 1.00 0.00 H ATOM 56994 C33 PGR 1388 75.081 47.643 25.962 1.00 0.00 C ATOM 56995 H3A PGR 1388 74.204 47.328 25.393 1.00 0.00 H ATOM 56996 H3B PGR 1388 74.894 47.536 27.034 1.00 0.00 H ATOM 56997 O33 PGR 1388 76.823 42.718 24.270 1.00 0.00 O ATOM 56998 O34 PGR 1388 74.364 42.847 23.445 1.00 0.00 O ATOM 56999 O21 PGR 1388 73.918 42.836 28.773 1.00 0.00 O ATOM 57000 C21 PGR 1388 73.253 42.773 29.943 1.00 0.00 C ATOM 57001 O22 PGR 1388 72.148 42.291 30.086 1.00 0.00 O ATOM 57002 O36 PGR 1388 75.176 49.012 25.695 1.00 0.00 O ATOM 57003 HO6A PGR 1388 74.393 49.402 26.123 1.00 0.00 H ATOM 57004 C12 OL 1389 73.936 43.470 31.101 1.00 0.00 C ATOM 57005 H2R OL 1389 74.948 43.111 31.301 1.00 0.00 H ATOM 57006 H2S OL 1389 74.149 44.464 30.700 1.00 0.00 H ATOM 57007 C13 OL 1389 73.235 43.414 32.430 1.00 0.00 C ATOM 57008 H3R OL 1389 72.258 43.824 32.166 1.00 0.00 H ATOM 57009 H3S OL 1389 73.106 42.371 32.728 1.00 0.00 H ATOM 57010 C14 OL 1389 73.854 44.293 33.502 1.00 0.00 C ATOM 57011 H4R OL 1389 74.881 44.205 33.141 1.00 0.00 H ATOM 57012 H4S OL 1389 73.615 45.299 33.152 1.00 0.00 H ATOM 57013 C15 OL 1389 73.705 43.856 35.028 1.00 0.00 C ATOM 57014 H5R OL 1389 72.707 44.115 35.387 1.00 0.00 H ATOM 57015 H5S OL 1389 73.717 42.765 35.083 1.00 0.00 H ATOM 57016 C16 OL 1389 74.793 44.546 35.830 1.00 0.00 C ATOM 57017 H6R OL 1389 75.694 43.935 35.736 1.00 0.00 H ATOM 57018 H6S OL 1389 75.040 45.549 35.476 1.00 0.00 H ATOM 57019 C17 OL 1389 74.580 44.730 37.375 1.00 0.00 C ATOM 57020 H7R OL 1389 74.284 43.751 37.757 1.00 0.00 H ATOM 57021 H7S OL 1389 75.603 44.883 37.724 1.00 0.00 H ATOM 57022 C18 OL 1389 73.526 45.787 37.574 1.00 0.00 C ATOM 57023 H8R OL 1389 73.484 46.617 36.866 1.00 0.00 H ATOM 57024 H8S OL 1389 72.587 45.279 37.346 1.00 0.00 H ATOM 57025 C19 OL 1389 73.668 46.404 38.966 1.00 0.00 C ATOM 57026 H9R OL 1389 74.021 47.429 39.051 1.00 0.00 H ATOM 57027 C110 OL 1389 73.429 45.748 40.098 1.00 0.00 C ATOM 57028 H10R OL 1389 73.669 46.242 41.036 1.00 0.00 H ATOM 57029 C111 OL 1389 72.583 44.534 40.190 1.00 0.00 C ATOM 57030 H11R OL 1389 72.408 44.134 39.188 1.00 0.00 H ATOM 57031 H11S OL 1389 73.240 43.750 40.572 1.00 0.00 H ATOM 57032 C112 OL 1389 71.335 44.609 40.958 1.00 0.00 C ATOM 57033 H12R OL 1389 70.618 45.199 40.385 1.00 0.00 H ATOM 57034 H12S OL 1389 70.990 43.575 41.030 1.00 0.00 H ATOM 57035 C113 OL 1389 71.478 45.227 42.296 1.00 0.00 C ATOM 57036 H13R OL 1389 72.218 44.669 42.873 1.00 0.00 H ATOM 57037 H13S OL 1389 71.895 46.202 42.039 1.00 0.00 H ATOM 57038 C114 OL 1389 70.219 45.322 43.136 1.00 0.00 C ATOM 57039 H14R OL 1389 69.365 45.701 42.569 1.00 0.00 H ATOM 57040 H14S OL 1389 69.976 44.321 43.499 1.00 0.00 H ATOM 57041 C115 OL 1389 70.418 46.177 44.376 1.00 0.00 C ATOM 57042 H15R OL 1389 71.284 45.806 44.928 1.00 0.00 H ATOM 57043 H15S OL 1389 70.648 47.145 43.927 1.00 0.00 H ATOM 57044 C116 OL 1389 69.169 46.296 45.293 1.00 0.00 C ATOM 57045 H16R OL 1389 68.436 46.962 44.834 1.00 0.00 H ATOM 57046 H16S OL 1389 68.627 45.348 45.309 1.00 0.00 H ATOM 57047 C117 OL 1389 69.433 46.822 46.697 1.00 0.00 C ATOM 57048 H17R OL 1389 68.514 47.200 47.149 1.00 0.00 H ATOM 57049 H17S OL 1389 69.713 46.035 47.400 1.00 0.00 H ATOM 57050 C118 OL 1389 70.430 47.974 46.783 1.00 0.00 C ATOM 57051 H18R OL 1389 71.396 47.510 46.574 1.00 0.00 H ATOM 57052 H18S OL 1389 70.633 48.489 47.725 1.00 0.00 H ATOM 57053 H18T OL 1389 70.266 48.760 46.043 1.00 0.00 H TER 57054 OL 1389 ATOM 57054 C116 PA 1390 86.879 134.496 38.106 1.00 0.00 C ATOM 57055 H16R PA 1390 87.397 135.292 38.645 1.00 0.00 H ATOM 57056 H16S PA 1390 85.841 134.584 38.434 1.00 0.00 H ATOM 57057 H16T PA 1390 86.878 134.683 37.030 1.00 0.00 H ATOM 57058 C115 PA 1390 87.525 133.129 38.452 1.00 0.00 C ATOM 57059 H15R PA 1390 87.495 133.039 39.540 1.00 0.00 H ATOM 57060 H15S PA 1390 88.589 133.232 38.227 1.00 0.00 H ATOM 57061 C114 PA 1390 86.761 132.106 37.701 1.00 0.00 C ATOM 57062 H14R PA 1390 87.146 132.219 36.686 1.00 0.00 H ATOM 57063 H14S PA 1390 85.723 132.420 37.570 1.00 0.00 H ATOM 57064 C113 PA 1390 86.922 130.749 38.218 1.00 0.00 C ATOM 57065 H13R PA 1390 87.039 130.808 39.302 1.00 0.00 H ATOM 57066 H13S PA 1390 87.878 130.396 37.824 1.00 0.00 H ATOM 57067 C112 PA 1390 85.862 129.731 37.810 1.00 0.00 C ATOM 57068 H12R PA 1390 84.896 130.223 37.940 1.00 0.00 H ATOM 57069 H12S PA 1390 85.801 128.898 38.514 1.00 0.00 H ATOM 57070 C111 PA 1390 86.139 129.135 36.443 1.00 0.00 C ATOM 57071 H11R PA 1390 87.140 128.754 36.231 1.00 0.00 H ATOM 57072 H11S PA 1390 86.026 129.869 35.643 1.00 0.00 H ATOM 57073 C110 PA 1390 85.137 127.992 36.082 1.00 0.00 C ATOM 57074 H10R PA 1390 84.115 128.362 35.977 1.00 0.00 H ATOM 57075 H10S PA 1390 85.056 127.257 36.886 1.00 0.00 H ATOM 57076 C19 PA 1390 85.380 127.099 34.871 1.00 0.00 C ATOM 57077 H9R PA 1390 84.649 126.288 34.877 1.00 0.00 H ATOM 57078 H9S PA 1390 86.372 126.664 35.011 1.00 0.00 H ATOM 57079 C18 PA 1390 85.374 127.848 33.523 1.00 0.00 C ATOM 57080 H8R PA 1390 86.297 128.433 33.511 1.00 0.00 H ATOM 57081 H8S PA 1390 84.545 128.545 33.388 1.00 0.00 H ATOM 57082 C17 PA 1390 85.480 126.810 32.401 1.00 0.00 C ATOM 57083 H7R PA 1390 85.486 127.335 31.443 1.00 0.00 H ATOM 57084 H7S PA 1390 84.594 126.172 32.424 1.00 0.00 H ATOM 57085 C16 PA 1390 86.761 125.909 32.382 1.00 0.00 C ATOM 57086 H6R PA 1390 86.742 125.264 33.263 1.00 0.00 H ATOM 57087 H6S PA 1390 87.556 126.640 32.542 1.00 0.00 H ATOM 57088 C15 PA 1390 86.907 125.035 31.037 1.00 0.00 C ATOM 57089 H5R PA 1390 87.948 124.795 30.810 1.00 0.00 H ATOM 57090 H5S PA 1390 86.676 125.570 30.113 1.00 0.00 H ATOM 57091 C14 PA 1390 86.050 123.771 31.001 1.00 0.00 C ATOM 57092 H4R PA 1390 85.034 124.138 31.162 1.00 0.00 H ATOM 57093 H4S PA 1390 86.373 123.250 31.905 1.00 0.00 H ATOM 57094 C13 PA 1390 86.224 122.767 29.813 1.00 0.00 C ATOM 57095 H3R PA 1390 87.290 122.691 29.587 1.00 0.00 H ATOM 57096 H3S PA 1390 85.876 123.115 28.839 1.00 0.00 H ATOM 57097 C12 PA 1390 85.512 121.354 30.040 1.00 0.00 C ATOM 57098 H2R PA 1390 84.487 121.387 30.415 1.00 0.00 H ATOM 57099 H2S PA 1390 85.937 120.825 30.895 1.00 0.00 H ATOM 57100 C11 PGR 1391 85.727 120.419 28.901 1.00 0.00 C ATOM 57101 O12 PGR 1391 86.694 119.665 28.828 1.00 0.00 O ATOM 57102 O11 PGR 1391 84.675 120.593 28.077 1.00 0.00 O ATOM 57103 C1 PGR 1391 84.444 119.717 26.876 1.00 0.00 C ATOM 57104 HR PGR 1391 85.375 119.656 26.306 1.00 0.00 H ATOM 57105 HS PGR 1391 83.647 120.166 26.278 1.00 0.00 H ATOM 57106 C2 PGR 1391 84.082 118.268 27.333 1.00 0.00 C ATOM 57107 HX PGR 1391 84.771 118.041 28.151 1.00 0.00 H ATOM 57108 C3 PGR 1391 84.126 117.137 26.218 1.00 0.00 C ATOM 57109 HA PGR 1391 83.612 117.490 25.320 1.00 0.00 H ATOM 57110 HB PGR 1391 83.546 116.280 26.570 1.00 0.00 H ATOM 57111 O31 PGR 1391 85.440 116.725 25.917 1.00 0.00 O ATOM 57112 P31 PGR 1391 85.846 115.228 25.357 1.00 0.00 P ATOM 57113 O32 PGR 1391 86.136 114.558 26.730 1.00 0.00 O ATOM 57114 C31 PGR 1391 86.942 113.361 26.926 1.00 0.00 C ATOM 57115 H1A PGR 1391 86.682 112.663 26.125 1.00 0.00 H ATOM 57116 H1B PGR 1391 86.628 112.893 27.862 1.00 0.00 H ATOM 57117 C32 PGR 1391 88.368 113.764 26.948 1.00 0.00 C ATOM 57118 H2A PGR 1391 88.559 114.797 27.251 1.00 0.00 H ATOM 57119 O35 PGR 1391 88.800 113.616 25.578 1.00 0.00 O ATOM 57120 HO5A PGR 1391 88.110 114.121 25.112 1.00 0.00 H ATOM 57121 C33 PGR 1391 89.177 112.796 27.764 1.00 0.00 C ATOM 57122 H3A PGR 1391 88.916 113.034 28.798 1.00 0.00 H ATOM 57123 H3B PGR 1391 89.024 111.751 27.484 1.00 0.00 H ATOM 57124 O33 PGR 1391 84.680 114.561 24.799 1.00 0.00 O ATOM 57125 O34 PGR 1391 87.105 115.338 24.597 1.00 0.00 O ATOM 57126 O21 PGR 1391 82.778 118.313 27.919 1.00 0.00 O ATOM 57127 C21 PGR 1391 82.569 117.476 28.941 1.00 0.00 C ATOM 57128 O22 PGR 1391 83.320 116.730 29.448 1.00 0.00 O ATOM 57129 O36 PGR 1391 90.613 113.108 27.626 1.00 0.00 O ATOM 57130 HO6A PGR 1391 90.626 114.039 27.910 1.00 0.00 H ATOM 57131 C12 OL 1392 81.125 117.544 29.441 1.00 0.00 C ATOM 57132 H2R OL 1392 80.828 118.548 29.751 1.00 0.00 H ATOM 57133 H2S OL 1392 80.501 117.201 28.613 1.00 0.00 H ATOM 57134 C13 OL 1392 80.929 116.685 30.638 1.00 0.00 C ATOM 57135 H3R OL 1392 81.417 115.717 30.505 1.00 0.00 H ATOM 57136 H3S OL 1392 81.462 117.136 31.477 1.00 0.00 H ATOM 57137 C14 OL 1392 79.446 116.295 30.812 1.00 0.00 C ATOM 57138 H4R OL 1392 78.873 117.224 30.795 1.00 0.00 H ATOM 57139 H4S OL 1392 79.133 115.631 30.003 1.00 0.00 H ATOM 57140 C15 OL 1392 79.059 115.412 32.003 1.00 0.00 C ATOM 57141 H5R OL 1392 79.222 116.154 32.787 1.00 0.00 H ATOM 57142 H5S OL 1392 77.984 115.228 32.049 1.00 0.00 H ATOM 57143 C16 OL 1392 79.935 114.129 32.224 1.00 0.00 C ATOM 57144 H6R OL 1392 79.862 113.493 31.339 1.00 0.00 H ATOM 57145 H6S OL 1392 80.999 114.372 32.177 1.00 0.00 H ATOM 57146 C17 OL 1392 79.493 113.308 33.430 1.00 0.00 C ATOM 57147 H7R OL 1392 79.758 113.795 34.371 1.00 0.00 H ATOM 57148 H7S OL 1392 78.407 113.194 33.444 1.00 0.00 H ATOM 57149 C18 OL 1392 80.138 111.885 33.459 1.00 0.00 C ATOM 57150 H8R OL 1392 79.815 111.435 32.518 1.00 0.00 H ATOM 57151 H8S OL 1392 81.230 111.915 33.451 1.00 0.00 H ATOM 57152 C19 OL 1392 79.663 111.020 34.551 1.00 0.00 C ATOM 57153 H9R OL 1392 78.945 110.243 34.302 1.00 0.00 H ATOM 57154 C110 OL 1392 80.249 111.030 35.806 1.00 0.00 C ATOM 57155 H10R OL 1392 79.830 110.307 36.501 1.00 0.00 H ATOM 57156 C111 OL 1392 81.301 111.946 36.293 1.00 0.00 C ATOM 57157 H11R OL 1392 81.572 112.682 35.533 1.00 0.00 H ATOM 57158 H11S OL 1392 80.996 112.440 37.218 1.00 0.00 H ATOM 57159 C112 OL 1392 82.576 111.114 36.522 1.00 0.00 C ATOM 57160 H12R OL 1392 82.803 110.492 35.654 1.00 0.00 H ATOM 57161 H12S OL 1392 83.307 111.877 36.798 1.00 0.00 H ATOM 57162 C113 OL 1392 82.491 110.081 37.701 1.00 0.00 C ATOM 57163 H13R OL 1392 81.982 109.304 37.128 1.00 0.00 H ATOM 57164 H13S OL 1392 83.426 109.559 37.915 1.00 0.00 H ATOM 57165 C114 OL 1392 81.725 110.485 38.943 1.00 0.00 C ATOM 57166 H14R OL 1392 82.245 111.392 39.260 1.00 0.00 H ATOM 57167 H14S OL 1392 80.747 110.954 38.823 1.00 0.00 H ATOM 57168 C115 OL 1392 81.575 109.384 40.067 1.00 0.00 C ATOM 57169 H15R OL 1392 82.550 109.295 40.551 1.00 0.00 H ATOM 57170 H15S OL 1392 80.909 109.843 40.800 1.00 0.00 H ATOM 57171 C116 OL 1392 81.109 107.985 39.520 1.00 0.00 C ATOM 57172 H16R OL 1392 80.266 108.228 38.870 1.00 0.00 H ATOM 57173 H16S OL 1392 81.838 107.372 38.984 1.00 0.00 H ATOM 57174 C117 OL 1392 80.531 107.106 40.665 1.00 0.00 C ATOM 57175 H17R OL 1392 80.340 106.106 40.271 1.00 0.00 H ATOM 57176 H17S OL 1392 81.248 107.169 41.486 1.00 0.00 H ATOM 57177 C118 OL 1392 79.151 107.503 41.133 1.00 0.00 C ATOM 57178 H18R OL 1392 78.855 106.835 41.944 1.00 0.00 H ATOM 57179 H18S OL 1392 78.438 107.414 40.312 1.00 0.00 H ATOM 57180 H18T OL 1392 79.030 108.517 41.521 1.00 0.00 H TER 57181 OL 1392 ATOM 57181 C116 PA 1393 8.654 48.103 40.204 1.00 0.00 C ATOM 57182 H16R PA 1393 7.655 48.038 40.639 1.00 0.00 H ATOM 57183 H16S PA 1393 9.183 49.009 40.507 1.00 0.00 H ATOM 57184 H16T PA 1393 9.171 47.259 40.666 1.00 0.00 H ATOM 57185 C115 PA 1393 8.725 47.972 38.691 1.00 0.00 C ATOM 57186 H15R PA 1393 8.166 48.838 38.333 1.00 0.00 H ATOM 57187 H15S PA 1393 8.194 47.103 38.296 1.00 0.00 H ATOM 57188 C114 PA 1393 10.059 48.144 37.993 1.00 0.00 C ATOM 57189 H14R PA 1393 10.437 49.127 38.281 1.00 0.00 H ATOM 57190 H14S PA 1393 9.885 48.014 36.923 1.00 0.00 H ATOM 57191 C113 PA 1393 11.127 47.092 38.169 1.00 0.00 C ATOM 57192 H13R PA 1393 10.571 46.180 37.941 1.00 0.00 H ATOM 57193 H13S PA 1393 11.354 46.905 39.221 1.00 0.00 H ATOM 57194 C112 PA 1393 12.426 47.236 37.439 1.00 0.00 C ATOM 57195 H12R PA 1393 13.181 46.489 37.694 1.00 0.00 H ATOM 57196 H12S PA 1393 12.906 48.142 37.815 1.00 0.00 H ATOM 57197 C111 PA 1393 12.160 47.278 35.923 1.00 0.00 C ATOM 57198 H11R PA 1393 11.676 48.219 35.650 1.00 0.00 H ATOM 57199 H11S PA 1393 11.371 46.539 35.773 1.00 0.00 H ATOM 57200 C110 PA 1393 13.330 46.961 35.018 1.00 0.00 C ATOM 57201 H10R PA 1393 13.664 45.956 35.283 1.00 0.00 H ATOM 57202 H10S PA 1393 14.232 47.535 35.239 1.00 0.00 H ATOM 57203 C19 PA 1393 13.042 47.001 33.535 1.00 0.00 C ATOM 57204 H9R PA 1393 12.856 48.005 33.148 1.00 0.00 H ATOM 57205 H9S PA 1393 12.155 46.369 33.456 1.00 0.00 H ATOM 57206 C18 PA 1393 14.097 46.440 32.603 1.00 0.00 C ATOM 57207 H8R PA 1393 14.486 45.457 32.876 1.00 0.00 H ATOM 57208 H8S PA 1393 15.005 47.032 32.740 1.00 0.00 H ATOM 57209 C17 PA 1393 13.811 46.421 31.069 1.00 0.00 C ATOM 57210 H7R PA 1393 13.767 47.461 30.740 1.00 0.00 H ATOM 57211 H7S PA 1393 12.802 46.034 30.910 1.00 0.00 H ATOM 57212 C16 PA 1393 14.759 45.536 30.209 1.00 0.00 C ATOM 57213 H6R PA 1393 14.805 44.508 30.574 1.00 0.00 H ATOM 57214 H6S PA 1393 15.777 45.913 30.326 1.00 0.00 H ATOM 57215 C15 PA 1393 14.406 45.490 28.689 1.00 0.00 C ATOM 57216 H5R PA 1393 14.788 46.388 28.200 1.00 0.00 H ATOM 57217 H5S PA 1393 13.321 45.589 28.618 1.00 0.00 H ATOM 57218 C14 PA 1393 14.898 44.280 27.849 1.00 0.00 C ATOM 57219 H4R PA 1393 14.595 44.571 26.841 1.00 0.00 H ATOM 57220 H4S PA 1393 14.375 43.335 28.013 1.00 0.00 H ATOM 57221 C13 PA 1393 16.454 43.981 27.827 1.00 0.00 C ATOM 57222 H3R PA 1393 16.515 42.966 27.427 1.00 0.00 H ATOM 57223 H3S PA 1393 16.765 43.911 28.872 1.00 0.00 H ATOM 57224 C12 PA 1393 17.434 45.028 27.232 1.00 0.00 C ATOM 57225 H2R PA 1393 17.694 45.886 27.856 1.00 0.00 H ATOM 57226 H2S PA 1393 17.207 45.516 26.282 1.00 0.00 H ATOM 57227 C11 PGR 1394 18.735 44.241 26.919 1.00 0.00 C ATOM 57228 O12 PGR 1394 18.781 43.101 26.483 1.00 0.00 O ATOM 57229 O11 PGR 1394 19.805 44.967 27.164 1.00 0.00 O ATOM 57230 C1 PGR 1394 21.099 44.416 26.829 1.00 0.00 C ATOM 57231 HR PGR 1394 21.100 43.346 27.052 1.00 0.00 H ATOM 57232 HS PGR 1394 21.935 44.883 27.356 1.00 0.00 H ATOM 57233 C2 PGR 1394 21.219 44.599 25.299 1.00 0.00 C ATOM 57234 HX PGR 1394 20.394 44.031 24.861 1.00 0.00 H ATOM 57235 C3 PGR 1394 22.587 44.171 24.732 1.00 0.00 C ATOM 57236 HA PGR 1394 22.897 43.202 25.134 1.00 0.00 H ATOM 57237 HB PGR 1394 23.407 44.839 25.010 1.00 0.00 H ATOM 57238 O31 PGR 1394 22.566 44.208 23.287 1.00 0.00 O ATOM 57239 P31 PGR 1394 21.493 43.320 22.586 1.00 0.00 P ATOM 57240 O32 PGR 1394 20.130 44.107 22.573 1.00 0.00 O ATOM 57241 C31 PGR 1394 19.912 45.313 21.916 1.00 0.00 C ATOM 57242 H1A PGR 1394 20.056 45.296 20.833 1.00 0.00 H ATOM 57243 H1B PGR 1394 20.577 46.101 22.277 1.00 0.00 H ATOM 57244 C32 PGR 1394 18.423 45.714 22.268 1.00 0.00 C ATOM 57245 H2A PGR 1394 18.325 45.851 23.348 1.00 0.00 H ATOM 57246 O35 PGR 1394 17.521 44.681 21.969 1.00 0.00 O ATOM 57247 HO5A PGR 1394 17.944 43.861 22.280 1.00 0.00 H ATOM 57248 C33 PGR 1394 17.952 47.028 21.683 1.00 0.00 C ATOM 57249 H3A PGR 1394 16.930 47.268 21.988 1.00 0.00 H ATOM 57250 H3B PGR 1394 18.578 47.854 22.028 1.00 0.00 H ATOM 57251 O33 PGR 1394 21.881 43.148 21.193 1.00 0.00 O ATOM 57252 O34 PGR 1394 21.228 42.096 23.382 1.00 0.00 O ATOM 57253 O21 PGR 1394 20.957 45.971 24.870 1.00 0.00 O ATOM 57254 C21 PGR 1394 21.780 46.987 25.356 1.00 0.00 C ATOM 57255 O22 PGR 1394 22.528 46.852 26.330 1.00 0.00 O ATOM 57256 O36 PGR 1394 17.963 46.725 20.360 1.00 0.00 O ATOM 57257 HO6A PGR 1394 17.456 45.927 20.125 1.00 0.00 H ATOM 57258 C12 OL 1395 21.671 48.294 24.661 1.00 0.00 C ATOM 57259 H2R OL 1395 22.658 48.747 24.781 1.00 0.00 H ATOM 57260 H2S OL 1395 21.571 48.164 23.581 1.00 0.00 H ATOM 57261 C13 OL 1395 20.563 49.100 25.263 1.00 0.00 C ATOM 57262 H3R OL 1395 20.877 49.161 26.307 1.00 0.00 H ATOM 57263 H3S OL 1395 20.431 50.146 24.977 1.00 0.00 H ATOM 57264 C14 OL 1395 19.307 48.236 25.198 1.00 0.00 C ATOM 57265 H4R OL 1395 19.242 47.746 24.224 1.00 0.00 H ATOM 57266 H4S OL 1395 19.387 47.430 25.931 1.00 0.00 H ATOM 57267 C15 OL 1395 18.032 48.975 25.648 1.00 0.00 C ATOM 57268 H5R OL 1395 17.976 48.932 26.738 1.00 0.00 H ATOM 57269 H5S OL 1395 18.068 50.029 25.366 1.00 0.00 H ATOM 57270 C16 OL 1395 16.857 48.342 24.921 1.00 0.00 C ATOM 57271 H6R OL 1395 16.984 48.458 23.843 1.00 0.00 H ATOM 57272 H6S OL 1395 16.786 47.254 24.982 1.00 0.00 H ATOM 57273 C17 OL 1395 15.541 49.081 25.084 1.00 0.00 C ATOM 57274 H7R OL 1395 15.239 49.104 26.133 1.00 0.00 H ATOM 57275 H7S OL 1395 15.698 50.079 24.671 1.00 0.00 H ATOM 57276 C18 OL 1395 14.341 48.440 24.347 1.00 0.00 C ATOM 57277 H8R OL 1395 13.470 49.095 24.417 1.00 0.00 H ATOM 57278 H8S OL 1395 14.592 48.448 23.285 1.00 0.00 H ATOM 57279 C19 OL 1395 13.885 47.079 24.744 1.00 0.00 C ATOM 57280 H9R OL 1395 14.241 46.240 24.150 1.00 0.00 H ATOM 57281 C110 OL 1395 13.056 46.676 25.693 1.00 0.00 C ATOM 57282 H10R OL 1395 12.981 45.602 25.837 1.00 0.00 H ATOM 57283 C111 OL 1395 12.261 47.536 26.612 1.00 0.00 C ATOM 57284 H11R OL 1395 12.768 47.517 27.579 1.00 0.00 H ATOM 57285 H11S OL 1395 12.182 48.547 26.209 1.00 0.00 H ATOM 57286 C112 OL 1395 10.911 46.815 26.804 1.00 0.00 C ATOM 57287 H12R OL 1395 10.190 46.907 25.989 1.00 0.00 H ATOM 57288 H12S OL 1395 11.073 45.741 26.920 1.00 0.00 H ATOM 57289 C113 OL 1395 10.146 47.350 28.054 1.00 0.00 C ATOM 57290 H13R OL 1395 10.917 47.559 28.798 1.00 0.00 H ATOM 57291 H13S OL 1395 9.880 48.377 27.796 1.00 0.00 H ATOM 57292 C114 OL 1395 8.926 46.643 28.591 1.00 0.00 C ATOM 57293 H14R OL 1395 8.195 46.982 27.854 1.00 0.00 H ATOM 57294 H14S OL 1395 9.009 45.565 28.433 1.00 0.00 H ATOM 57295 C115 OL 1395 8.438 47.133 29.962 1.00 0.00 C ATOM 57296 H15R OL 1395 8.556 48.217 30.007 1.00 0.00 H ATOM 57297 H15S OL 1395 7.355 47.014 30.045 1.00 0.00 H ATOM 57298 C116 OL 1395 9.051 46.539 31.137 1.00 0.00 C ATOM 57299 H16R OL 1395 9.200 45.461 31.038 1.00 0.00 H ATOM 57300 H16S OL 1395 10.067 46.894 31.317 1.00 0.00 H ATOM 57301 C117 OL 1395 8.276 46.986 32.437 1.00 0.00 C ATOM 57302 H17R OL 1395 8.365 48.072 32.505 1.00 0.00 H ATOM 57303 H17S OL 1395 7.207 46.803 32.308 1.00 0.00 H ATOM 57304 C118 OL 1395 8.826 46.243 33.654 1.00 0.00 C ATOM 57305 H18R OL 1395 8.359 46.664 34.547 1.00 0.00 H ATOM 57306 H18S OL 1395 9.873 46.501 33.825 1.00 0.00 H ATOM 57307 H18T OL 1395 8.772 45.153 33.688 1.00 0.00 H TER 57308 OL 1395 ATOM 57308 C116 PA 1396 104.351 9.481 33.328 1.00 0.00 C ATOM 57309 H16R PA 1396 104.880 10.331 33.764 1.00 0.00 H ATOM 57310 H16S PA 1396 105.087 8.973 32.701 1.00 0.00 H ATOM 57311 H16T PA 1396 104.097 8.743 34.091 1.00 0.00 H ATOM 57312 C115 PA 1396 103.204 9.977 32.423 1.00 0.00 C ATOM 57313 H15R PA 1396 102.508 10.556 33.033 1.00 0.00 H ATOM 57314 H15S PA 1396 102.607 9.249 31.868 1.00 0.00 H ATOM 57315 C114 PA 1396 103.788 10.972 31.413 1.00 0.00 C ATOM 57316 H14R PA 1396 104.094 10.311 30.600 1.00 0.00 H ATOM 57317 H14S PA 1396 104.740 11.307 31.832 1.00 0.00 H ATOM 57318 C113 PA 1396 102.836 12.075 31.093 1.00 0.00 C ATOM 57319 H13R PA 1396 102.465 12.702 31.906 1.00 0.00 H ATOM 57320 H13S PA 1396 102.012 11.466 30.715 1.00 0.00 H ATOM 57321 C112 PA 1396 103.454 13.155 30.132 1.00 0.00 C ATOM 57322 H12R PA 1396 104.138 13.811 30.674 1.00 0.00 H ATOM 57323 H12S PA 1396 102.607 13.725 29.745 1.00 0.00 H ATOM 57324 C111 PA 1396 104.172 12.586 28.812 1.00 0.00 C ATOM 57325 H11R PA 1396 104.923 11.811 28.980 1.00 0.00 H ATOM 57326 H11S PA 1396 104.744 13.418 28.395 1.00 0.00 H ATOM 57327 C110 PA 1396 103.105 11.918 27.821 1.00 0.00 C ATOM 57328 H10R PA 1396 102.240 12.579 27.730 1.00 0.00 H ATOM 57329 H10S PA 1396 102.757 11.109 28.465 1.00 0.00 H ATOM 57330 C19 PA 1396 103.615 11.590 26.442 1.00 0.00 C ATOM 57331 H9R PA 1396 104.506 10.975 26.580 1.00 0.00 H ATOM 57332 H9S PA 1396 103.980 12.384 25.787 1.00 0.00 H ATOM 57333 C18 PA 1396 102.742 10.676 25.734 1.00 0.00 C ATOM 57334 H8R PA 1396 102.506 9.827 26.379 1.00 0.00 H ATOM 57335 H8S PA 1396 103.348 10.238 24.937 1.00 0.00 H ATOM 57336 C17 PA 1396 101.436 11.214 25.039 1.00 0.00 C ATOM 57337 H7R PA 1396 100.677 11.142 25.821 1.00 0.00 H ATOM 57338 H7S PA 1396 101.216 10.298 24.486 1.00 0.00 H ATOM 57339 C16 PA 1396 101.579 12.390 24.139 1.00 0.00 C ATOM 57340 H6R PA 1396 102.538 12.492 23.626 1.00 0.00 H ATOM 57341 H6S PA 1396 101.732 13.160 24.899 1.00 0.00 H ATOM 57342 C15 PA 1396 100.386 12.683 23.218 1.00 0.00 C ATOM 57343 H5R PA 1396 100.082 13.727 23.320 1.00 0.00 H ATOM 57344 H5S PA 1396 99.544 12.125 23.634 1.00 0.00 H ATOM 57345 C14 PA 1396 100.634 12.312 21.718 1.00 0.00 C ATOM 57346 H4R PA 1396 101.575 12.733 21.357 1.00 0.00 H ATOM 57347 H4S PA 1396 99.800 12.714 21.138 1.00 0.00 H ATOM 57348 C13 PA 1396 100.646 10.818 21.284 1.00 0.00 C ATOM 57349 H3R PA 1396 101.438 10.215 21.734 1.00 0.00 H ATOM 57350 H3S PA 1396 100.929 10.675 20.239 1.00 0.00 H ATOM 57351 C12 PA 1396 99.361 10.029 21.708 1.00 0.00 C ATOM 57352 H2R PA 1396 98.547 10.537 21.187 1.00 0.00 H ATOM 57353 H2S PA 1396 99.118 10.014 22.772 1.00 0.00 H ATOM 57354 C11 PGR 1397 99.372 8.599 21.139 1.00 0.00 C ATOM 57355 O12 PGR 1397 100.416 8.010 20.881 1.00 0.00 O ATOM 57356 O11 PGR 1397 98.270 7.885 21.122 1.00 0.00 O ATOM 57357 C1 PGR 1397 98.312 6.424 21.085 1.00 0.00 C ATOM 57358 HR PGR 1397 98.876 6.065 21.950 1.00 0.00 H ATOM 57359 HS PGR 1397 98.825 6.204 20.145 1.00 0.00 H ATOM 57360 C2 PGR 1397 96.850 5.854 21.130 1.00 0.00 C ATOM 57361 HX PGR 1397 96.779 4.763 21.104 1.00 0.00 H ATOM 57362 C3 PGR 1397 96.088 6.289 19.851 1.00 0.00 C ATOM 57363 HA PGR 1397 96.693 6.181 18.946 1.00 0.00 H ATOM 57364 HB PGR 1397 95.982 7.362 20.026 1.00 0.00 H ATOM 57365 O31 PGR 1397 94.880 5.590 19.852 1.00 0.00 O ATOM 57366 P31 PGR 1397 93.707 5.760 18.772 1.00 0.00 P ATOM 57367 O32 PGR 1397 93.481 7.358 18.795 1.00 0.00 O ATOM 57368 C31 PGR 1397 92.485 7.988 19.649 1.00 0.00 C ATOM 57369 H1A PGR 1397 92.747 7.715 20.674 1.00 0.00 H ATOM 57370 H1B PGR 1397 91.432 7.744 19.487 1.00 0.00 H ATOM 57371 C32 PGR 1397 92.640 9.474 19.470 1.00 0.00 C ATOM 57372 H2A PGR 1397 92.204 10.034 20.302 1.00 0.00 H ATOM 57373 O35 PGR 1397 92.122 10.016 18.262 1.00 0.00 O ATOM 57374 HO5A PGR 1397 91.183 9.777 18.359 1.00 0.00 H ATOM 57375 C33 PGR 1397 94.142 9.873 19.527 1.00 0.00 C ATOM 57376 H3A PGR 1397 94.569 9.392 20.411 1.00 0.00 H ATOM 57377 H3B PGR 1397 94.661 9.494 18.642 1.00 0.00 H ATOM 57378 O33 PGR 1397 94.351 5.331 17.511 1.00 0.00 O ATOM 57379 O34 PGR 1397 92.481 5.125 19.254 1.00 0.00 O ATOM 57380 O21 PGR 1397 96.189 6.352 22.299 1.00 0.00 O ATOM 57381 C21 PGR 1397 96.314 5.604 23.379 1.00 0.00 C ATOM 57382 O22 PGR 1397 97.081 4.675 23.499 1.00 0.00 O ATOM 57383 O36 PGR 1397 94.326 11.299 19.368 1.00 0.00 O ATOM 57384 HO6A PGR 1397 95.249 11.518 19.587 1.00 0.00 H ATOM 57385 C12 OL 1398 95.213 6.027 24.378 1.00 0.00 C ATOM 57386 H2R OL 1398 94.678 6.954 24.160 1.00 0.00 H ATOM 57387 H2S OL 1398 94.460 5.236 24.346 1.00 0.00 H ATOM 57388 C13 OL 1398 95.790 6.150 25.778 1.00 0.00 C ATOM 57389 H3R OL 1398 96.356 5.242 25.996 1.00 0.00 H ATOM 57390 H3S OL 1398 96.540 6.940 25.705 1.00 0.00 H ATOM 57391 C14 OL 1398 94.650 6.536 26.786 1.00 0.00 C ATOM 57392 H4R OL 1398 93.926 7.223 26.343 1.00 0.00 H ATOM 57393 H4S OL 1398 94.002 5.659 26.843 1.00 0.00 H ATOM 57394 C15 OL 1398 95.247 7.126 28.092 1.00 0.00 C ATOM 57395 H5R OL 1398 95.992 6.423 28.470 1.00 0.00 H ATOM 57396 H5S OL 1398 95.858 8.020 27.943 1.00 0.00 H ATOM 57397 C16 OL 1398 94.267 7.232 29.191 1.00 0.00 C ATOM 57398 H6R OL 1398 93.452 7.911 28.933 1.00 0.00 H ATOM 57399 H6S OL 1398 93.587 6.381 29.258 1.00 0.00 H ATOM 57400 C17 OL 1398 94.790 7.635 30.542 1.00 0.00 C ATOM 57401 H7R OL 1398 95.408 6.848 30.980 1.00 0.00 H ATOM 57402 H7S OL 1398 95.506 8.442 30.373 1.00 0.00 H ATOM 57403 C18 OL 1398 93.749 8.113 31.501 1.00 0.00 C ATOM 57404 H8R OL 1398 92.936 8.720 31.098 1.00 0.00 H ATOM 57405 H8S OL 1398 93.224 7.246 31.907 1.00 0.00 H ATOM 57406 C19 OL 1398 94.429 8.720 32.677 1.00 0.00 C ATOM 57407 H9R OL 1398 94.763 8.100 33.504 1.00 0.00 H ATOM 57408 C110 OL 1398 94.772 10.010 32.609 1.00 0.00 C ATOM 57409 H10R OL 1398 95.256 10.548 33.419 1.00 0.00 H ATOM 57410 C111 OL 1398 94.532 10.914 31.398 1.00 0.00 C ATOM 57411 H11R OL 1398 94.204 10.457 30.462 1.00 0.00 H ATOM 57412 H11S OL 1398 93.752 11.643 31.626 1.00 0.00 H ATOM 57413 C112 OL 1398 95.835 11.621 30.978 1.00 0.00 C ATOM 57414 H12R OL 1398 96.704 10.963 31.040 1.00 0.00 H ATOM 57415 H12S OL 1398 95.733 12.010 29.963 1.00 0.00 H ATOM 57416 C113 OL 1398 96.145 12.789 31.878 1.00 0.00 C ATOM 57417 H13R OL 1398 96.832 13.267 31.176 1.00 0.00 H ATOM 57418 H13S OL 1398 95.197 13.313 32.017 1.00 0.00 H ATOM 57419 C114 OL 1398 96.775 12.515 33.272 1.00 0.00 C ATOM 57420 H14R OL 1398 96.004 12.079 33.912 1.00 0.00 H ATOM 57421 H14S OL 1398 97.523 11.735 33.116 1.00 0.00 H ATOM 57422 C115 OL 1398 97.265 13.753 33.987 1.00 0.00 C ATOM 57423 H15R OL 1398 98.176 14.092 33.490 1.00 0.00 H ATOM 57424 H15S OL 1398 96.454 14.484 34.016 1.00 0.00 H ATOM 57425 C116 OL 1398 97.630 13.382 35.412 1.00 0.00 C ATOM 57426 H16R OL 1398 96.705 13.079 35.907 1.00 0.00 H ATOM 57427 H16S OL 1398 98.249 12.492 35.278 1.00 0.00 H ATOM 57428 C117 OL 1398 98.286 14.571 36.251 1.00 0.00 C ATOM 57429 H17R OL 1398 99.293 14.813 35.903 1.00 0.00 H ATOM 57430 H17S OL 1398 97.646 15.455 36.232 1.00 0.00 H ATOM 57431 C118 OL 1398 98.501 14.193 37.705 1.00 0.00 C ATOM 57432 H18R OL 1398 98.980 13.230 37.897 1.00 0.00 H ATOM 57433 H18S OL 1398 97.501 14.129 38.139 1.00 0.00 H ATOM 57434 H18T OL 1398 99.013 15.016 38.208 1.00 0.00 H TER 57435 OL 1398 ATOM 57435 C116 PA 1399 138.835 100.314 38.718 1.00 0.00 C ATOM 57436 H16R PA 1399 138.543 101.163 38.095 1.00 0.00 H ATOM 57437 H16S PA 1399 139.911 100.434 38.860 1.00 0.00 H ATOM 57438 H16T PA 1399 138.331 100.598 39.644 1.00 0.00 H ATOM 57439 C115 PA 1399 138.329 98.931 38.133 1.00 0.00 C ATOM 57440 H15R PA 1399 138.564 98.044 38.725 1.00 0.00 H ATOM 57441 H15S PA 1399 138.824 98.712 37.184 1.00 0.00 H ATOM 57442 C114 PA 1399 136.832 99.021 37.813 1.00 0.00 C ATOM 57443 H14R PA 1399 136.659 99.639 36.930 1.00 0.00 H ATOM 57444 H14S PA 1399 136.351 99.648 38.566 1.00 0.00 H ATOM 57445 C113 PA 1399 136.145 97.629 37.657 1.00 0.00 C ATOM 57446 H13R PA 1399 136.346 97.204 38.642 1.00 0.00 H ATOM 57447 H13S PA 1399 136.774 97.069 36.961 1.00 0.00 H ATOM 57448 C112 PA 1399 134.641 97.701 37.342 1.00 0.00 C ATOM 57449 H12R PA 1399 134.376 98.216 36.417 1.00 0.00 H ATOM 57450 H12S PA 1399 134.145 98.071 38.242 1.00 0.00 H ATOM 57451 C111 PA 1399 134.146 96.256 37.140 1.00 0.00 C ATOM 57452 H11R PA 1399 134.469 95.680 38.010 1.00 0.00 H ATOM 57453 H11S PA 1399 134.653 95.843 36.265 1.00 0.00 H ATOM 57454 C110 PA 1399 132.591 96.180 36.886 1.00 0.00 C ATOM 57455 H10R PA 1399 132.215 97.008 37.491 1.00 0.00 H ATOM 57456 H10S PA 1399 132.294 95.165 37.159 1.00 0.00 H ATOM 57457 C19 PA 1399 132.175 96.461 35.463 1.00 0.00 C ATOM 57458 H9R PA 1399 132.671 95.796 34.754 1.00 0.00 H ATOM 57459 H9S PA 1399 132.407 97.488 35.174 1.00 0.00 H ATOM 57460 C18 PA 1399 130.624 96.310 35.255 1.00 0.00 C ATOM 57461 H8R PA 1399 130.119 97.018 35.916 1.00 0.00 H ATOM 57462 H8S PA 1399 130.368 95.345 35.699 1.00 0.00 H ATOM 57463 C17 PA 1399 130.269 96.371 33.801 1.00 0.00 C ATOM 57464 H7R PA 1399 130.833 95.572 33.317 1.00 0.00 H ATOM 57465 H7S PA 1399 130.523 97.316 33.317 1.00 0.00 H ATOM 57466 C16 PA 1399 128.842 96.086 33.516 1.00 0.00 C ATOM 57467 H6R PA 1399 128.371 96.919 34.043 1.00 0.00 H ATOM 57468 H6S PA 1399 128.663 95.138 34.026 1.00 0.00 H ATOM 57469 C15 PA 1399 128.325 96.091 32.058 1.00 0.00 C ATOM 57470 H5R PA 1399 129.017 95.511 31.445 1.00 0.00 H ATOM 57471 H5S PA 1399 128.507 97.088 31.652 1.00 0.00 H ATOM 57472 C14 PA 1399 126.897 95.635 31.771 1.00 0.00 C ATOM 57473 H4R PA 1399 126.234 95.970 32.571 1.00 0.00 H ATOM 57474 H4S PA 1399 126.891 94.544 31.835 1.00 0.00 H ATOM 57475 C13 PA 1399 126.387 95.934 30.387 1.00 0.00 C ATOM 57476 H3R PA 1399 127.110 95.469 29.714 1.00 0.00 H ATOM 57477 H3S PA 1399 126.487 96.979 30.085 1.00 0.00 H ATOM 57478 C12 PA 1399 124.987 95.459 30.198 1.00 0.00 C ATOM 57479 H2R PA 1399 124.394 96.077 30.875 1.00 0.00 H ATOM 57480 H2S PA 1399 124.957 94.394 30.440 1.00 0.00 H ATOM 57481 C11 PC 1400 124.485 95.495 28.793 1.00 0.00 C ATOM 57482 O12 PC 1400 124.750 94.651 27.980 1.00 0.00 O ATOM 57483 O11 PC 1400 123.722 96.589 28.552 1.00 0.00 O ATOM 57484 C1 PC 1400 123.214 96.838 27.189 1.00 0.00 C ATOM 57485 HR PC 1400 122.823 95.945 26.696 1.00 0.00 H ATOM 57486 HS PC 1400 124.029 97.181 26.546 1.00 0.00 H ATOM 57487 C2 PC 1400 122.156 97.918 27.228 1.00 0.00 C ATOM 57488 HX PC 1400 121.614 97.724 28.157 1.00 0.00 H ATOM 57489 C3 PC 1400 121.315 98.055 25.979 1.00 0.00 C ATOM 57490 HA PC 1400 120.463 98.716 26.157 1.00 0.00 H ATOM 57491 HB PC 1400 120.925 97.059 25.756 1.00 0.00 H ATOM 57492 O31 PC 1400 122.091 98.518 24.877 1.00 0.00 O ATOM 57493 P31 PC 1400 121.366 98.565 23.462 1.00 0.00 P ATOM 57494 O32 PC 1400 121.339 97.065 23.062 1.00 0.00 O ATOM 57495 C31 PC 1400 122.513 96.281 22.801 1.00 0.00 C ATOM 57496 H1A PC 1400 122.354 95.217 22.993 1.00 0.00 H ATOM 57497 H1B PC 1400 123.298 96.685 23.446 1.00 0.00 H ATOM 57498 C32 PC 1400 122.915 96.652 21.350 1.00 0.00 C ATOM 57499 H2A PC 1400 123.230 97.696 21.356 1.00 0.00 H ATOM 57500 H2B PC 1400 122.045 96.539 20.702 1.00 0.00 H ATOM 57501 N31 PC 1400 124.021 95.958 20.595 1.00 0.00 N ATOM 57502 C33 PC 1400 125.264 95.847 21.320 1.00 0.00 C ATOM 57503 H3A PC 1400 126.122 95.547 20.717 1.00 0.00 H ATOM 57504 H3B PC 1400 125.113 95.112 22.112 1.00 0.00 H ATOM 57505 H3C PC 1400 125.514 96.853 21.658 1.00 0.00 H ATOM 57506 C34 PC 1400 123.575 94.525 20.264 1.00 0.00 C ATOM 57507 H4A PC 1400 123.628 93.945 21.187 1.00 0.00 H ATOM 57508 H4B PC 1400 124.214 94.213 19.437 1.00 0.00 H ATOM 57509 H4C PC 1400 122.529 94.597 19.962 1.00 0.00 H ATOM 57510 C35 PC 1400 124.242 96.792 19.324 1.00 0.00 C ATOM 57511 H5A PC 1400 124.954 96.374 18.610 1.00 0.00 H ATOM 57512 H5B PC 1400 124.659 97.720 19.719 1.00 0.00 H ATOM 57513 H5C PC 1400 123.282 97.006 18.852 1.00 0.00 H ATOM 57514 O33 PC 1400 119.953 98.898 23.678 1.00 0.00 O ATOM 57515 O34 PC 1400 122.150 99.350 22.451 1.00 0.00 O ATOM 57516 O21 PC 1400 122.968 99.128 27.419 1.00 0.00 O ATOM 57517 C21 PC 1400 122.429 100.270 28.025 1.00 0.00 C ATOM 57518 O22 PC 1400 121.262 100.469 28.166 1.00 0.00 O ATOM 57519 C12 OL 1401 123.468 101.199 28.636 1.00 0.00 C ATOM 57520 H2R OL 1401 124.458 100.766 28.788 1.00 0.00 H ATOM 57521 H2S OL 1401 123.679 101.855 27.788 1.00 0.00 H ATOM 57522 C13 OL 1401 123.184 101.945 29.922 1.00 0.00 C ATOM 57523 H3R OL 1401 122.105 102.103 29.978 1.00 0.00 H ATOM 57524 H3S OL 1401 123.321 101.124 30.628 1.00 0.00 H ATOM 57525 C14 OL 1401 123.960 103.083 30.305 1.00 0.00 C ATOM 57526 H4R OL 1401 125.010 102.812 30.177 1.00 0.00 H ATOM 57527 H4S OL 1401 123.801 103.866 29.561 1.00 0.00 H ATOM 57528 C15 OL 1401 123.752 103.570 31.713 1.00 0.00 C ATOM 57529 H5R OL 1401 123.730 102.788 32.474 1.00 0.00 H ATOM 57530 H5S OL 1401 124.644 104.137 31.986 1.00 0.00 H ATOM 57531 C16 OL 1401 122.497 104.446 31.928 1.00 0.00 C ATOM 57532 H6R OL 1401 122.722 105.265 31.242 1.00 0.00 H ATOM 57533 H6S OL 1401 121.567 103.916 31.708 1.00 0.00 H ATOM 57534 C17 OL 1401 122.466 105.116 33.332 1.00 0.00 C ATOM 57535 H7R OL 1401 121.703 105.897 33.363 1.00 0.00 H ATOM 57536 H7S OL 1401 122.323 104.303 34.047 1.00 0.00 H ATOM 57537 C18 OL 1401 123.687 105.901 33.859 1.00 0.00 C ATOM 57538 H8R OL 1401 124.627 105.588 33.398 1.00 0.00 H ATOM 57539 H8S OL 1401 123.558 106.959 33.623 1.00 0.00 H ATOM 57540 C19 OL 1401 123.780 106.006 35.303 1.00 0.00 C ATOM 57541 H9R OL 1401 123.028 106.638 35.767 1.00 0.00 H ATOM 57542 C110 OL 1401 124.698 105.435 36.118 1.00 0.00 C ATOM 57543 H10R OL 1401 124.625 105.623 37.186 1.00 0.00 H ATOM 57544 C111 OL 1401 125.839 104.504 35.747 1.00 0.00 C ATOM 57545 H11R OL 1401 126.081 103.818 36.561 1.00 0.00 H ATOM 57546 H11S OL 1401 125.716 103.931 34.826 1.00 0.00 H ATOM 57547 C112 OL 1401 127.117 105.411 35.537 1.00 0.00 C ATOM 57548 H12R OL 1401 127.917 104.752 35.192 1.00 0.00 H ATOM 57549 H12S OL 1401 126.900 106.165 34.778 1.00 0.00 H ATOM 57550 C113 OL 1401 127.597 106.048 36.796 1.00 0.00 C ATOM 57551 H13R OL 1401 128.407 106.728 36.524 1.00 0.00 H ATOM 57552 H13S OL 1401 126.808 106.704 37.170 1.00 0.00 H ATOM 57553 C114 OL 1401 128.035 105.103 37.911 1.00 0.00 C ATOM 57554 H14R OL 1401 127.108 104.722 38.345 1.00 0.00 H ATOM 57555 H14S OL 1401 128.506 104.243 37.432 1.00 0.00 H ATOM 57556 C115 OL 1401 128.928 105.642 39.070 1.00 0.00 C ATOM 57557 H15R OL 1401 128.274 106.432 39.447 1.00 0.00 H ATOM 57558 H15S OL 1401 128.918 104.883 39.855 1.00 0.00 H ATOM 57559 C116 OL 1401 130.273 106.408 38.992 1.00 0.00 C ATOM 57560 H16R OL 1401 130.110 107.390 38.542 1.00 0.00 H ATOM 57561 H16S OL 1401 130.695 106.556 39.988 1.00 0.00 H ATOM 57562 C117 OL 1401 131.374 105.781 38.085 1.00 0.00 C ATOM 57563 H17R OL 1401 131.021 105.677 37.057 1.00 0.00 H ATOM 57564 H17S OL 1401 132.283 106.375 38.199 1.00 0.00 H ATOM 57565 C118 OL 1401 131.652 104.353 38.527 1.00 0.00 C ATOM 57566 H18R OL 1401 132.507 103.989 37.955 1.00 0.00 H ATOM 57567 H18S OL 1401 130.790 103.709 38.340 1.00 0.00 H ATOM 57568 H18T OL 1401 131.935 104.379 39.581 1.00 0.00 H TER 57569 OL 1401 ATOM 57569 C116 PA 1402 21.918 85.530 38.711 1.00 0.00 C ATOM 57570 H16R PA 1402 21.345 86.400 38.383 1.00 0.00 H ATOM 57571 H16S PA 1402 21.657 85.245 39.732 1.00 0.00 H ATOM 57572 H16T PA 1402 21.652 84.707 38.045 1.00 0.00 H ATOM 57573 C115 PA 1402 23.425 85.780 38.511 1.00 0.00 C ATOM 57574 H15R PA 1402 23.911 84.875 38.881 1.00 0.00 H ATOM 57575 H15S PA 1402 23.739 86.507 39.263 1.00 0.00 H ATOM 57576 C114 PA 1402 23.858 86.119 37.050 1.00 0.00 C ATOM 57577 H14R PA 1402 24.894 86.436 36.912 1.00 0.00 H ATOM 57578 H14S PA 1402 23.186 86.949 36.821 1.00 0.00 H ATOM 57579 C113 PA 1402 23.539 84.960 36.063 1.00 0.00 C ATOM 57580 H13R PA 1402 22.519 85.234 35.785 1.00 0.00 H ATOM 57581 H13S PA 1402 23.282 83.999 36.513 1.00 0.00 H ATOM 57582 C112 PA 1402 24.434 84.938 34.809 1.00 0.00 C ATOM 57583 H12R PA 1402 25.485 84.744 35.030 1.00 0.00 H ATOM 57584 H12S PA 1402 24.400 85.950 34.400 1.00 0.00 H ATOM 57585 C111 PA 1402 24.013 84.003 33.747 1.00 0.00 C ATOM 57586 H11R PA 1402 22.946 84.148 33.571 1.00 0.00 H ATOM 57587 H11S PA 1402 24.251 83.001 34.111 1.00 0.00 H ATOM 57588 C110 PA 1402 24.840 84.271 32.364 1.00 0.00 C ATOM 57589 H10R PA 1402 25.914 84.206 32.547 1.00 0.00 H ATOM 57590 H10S PA 1402 24.742 85.337 32.147 1.00 0.00 H ATOM 57591 C19 PA 1402 24.310 83.565 31.046 1.00 0.00 C ATOM 57592 H9R PA 1402 24.923 83.905 30.210 1.00 0.00 H ATOM 57593 H9S PA 1402 23.277 83.902 30.937 1.00 0.00 H ATOM 57594 C18 PA 1402 24.612 82.125 31.219 1.00 0.00 C ATOM 57595 H8R PA 1402 23.932 81.770 31.996 1.00 0.00 H ATOM 57596 H8S PA 1402 25.635 81.972 31.569 1.00 0.00 H ATOM 57597 C17 PA 1402 24.311 81.274 29.928 1.00 0.00 C ATOM 57598 H7R PA 1402 24.598 81.778 29.003 1.00 0.00 H ATOM 57599 H7S PA 1402 23.235 81.159 29.779 1.00 0.00 H ATOM 57600 C16 PA 1402 25.037 79.938 29.907 1.00 0.00 C ATOM 57601 H6R PA 1402 24.622 79.269 30.663 1.00 0.00 H ATOM 57602 H6S PA 1402 26.107 80.071 30.079 1.00 0.00 H ATOM 57603 C15 PA 1402 24.805 79.173 28.681 1.00 0.00 C ATOM 57604 H5R PA 1402 25.314 79.697 27.869 1.00 0.00 H ATOM 57605 H5S PA 1402 23.743 79.172 28.424 1.00 0.00 H ATOM 57606 C14 PA 1402 25.184 77.707 28.829 1.00 0.00 C ATOM 57607 H4R PA 1402 24.403 77.149 29.349 1.00 0.00 H ATOM 57608 H4S PA 1402 26.063 77.630 29.472 1.00 0.00 H ATOM 57609 C13 PA 1402 25.667 77.040 27.512 1.00 0.00 C ATOM 57610 H3R PA 1402 26.458 77.558 26.966 1.00 0.00 H ATOM 57611 H3S PA 1402 24.787 76.986 26.868 1.00 0.00 H ATOM 57612 C12 PA 1402 26.167 75.625 27.598 1.00 0.00 C ATOM 57613 H2R PA 1402 25.304 74.972 27.742 1.00 0.00 H ATOM 57614 H2S PA 1402 26.776 75.393 28.474 1.00 0.00 H ATOM 57615 C11 PC 1403 26.739 75.303 26.306 1.00 0.00 C ATOM 57616 O12 PC 1403 26.320 75.678 25.234 1.00 0.00 O ATOM 57617 O11 PC 1403 27.710 74.356 26.498 1.00 0.00 O ATOM 57618 C1 PC 1403 28.706 74.249 25.489 1.00 0.00 C ATOM 57619 HR PC 1403 28.264 73.969 24.529 1.00 0.00 H ATOM 57620 HS PC 1403 29.315 73.420 25.858 1.00 0.00 H ATOM 57621 C2 PC 1403 29.588 75.532 25.353 1.00 0.00 C ATOM 57622 HX PC 1403 29.021 76.416 25.050 1.00 0.00 H ATOM 57623 C3 PC 1403 30.532 75.466 24.043 1.00 0.00 C ATOM 57624 HA PC 1403 29.911 75.463 23.144 1.00 0.00 H ATOM 57625 HB PC 1403 31.146 74.565 24.116 1.00 0.00 H ATOM 57626 O31 PC 1403 31.468 76.554 24.156 1.00 0.00 O ATOM 57627 P31 PC 1403 32.413 76.694 22.895 1.00 0.00 P ATOM 57628 O32 PC 1403 31.528 76.823 21.654 1.00 0.00 O ATOM 57629 C31 PC 1403 30.990 78.037 21.304 1.00 0.00 C ATOM 57630 H1A PC 1403 31.753 78.681 20.858 1.00 0.00 H ATOM 57631 H1B PC 1403 30.449 78.501 22.132 1.00 0.00 H ATOM 57632 C32 PC 1403 29.881 77.786 20.226 1.00 0.00 C ATOM 57633 H2A PC 1403 28.853 77.643 20.561 1.00 0.00 H ATOM 57634 H2B PC 1403 30.265 76.961 19.625 1.00 0.00 H ATOM 57635 N31 PC 1403 29.761 78.929 19.217 1.00 0.00 N ATOM 57636 C33 PC 1403 28.782 78.498 18.177 1.00 0.00 C ATOM 57637 H3A PC 1403 28.466 79.343 17.564 1.00 0.00 H ATOM 57638 H3B PC 1403 27.876 78.221 18.718 1.00 0.00 H ATOM 57639 H3C PC 1403 29.286 77.795 17.513 1.00 0.00 H ATOM 57640 C34 PC 1403 29.473 80.209 19.966 1.00 0.00 C ATOM 57641 H4A PC 1403 28.583 79.966 20.548 1.00 0.00 H ATOM 57642 H4B PC 1403 29.158 80.956 19.235 1.00 0.00 H ATOM 57643 H4C PC 1403 30.327 80.571 20.540 1.00 0.00 H ATOM 57644 C35 PC 1403 31.003 79.081 18.474 1.00 0.00 C ATOM 57645 H5A PC 1403 31.281 78.042 18.289 1.00 0.00 H ATOM 57646 H5B PC 1403 31.710 79.600 19.122 1.00 0.00 H ATOM 57647 H5C PC 1403 30.878 79.641 17.546 1.00 0.00 H ATOM 57648 O33 PC 1403 33.181 77.946 23.034 1.00 0.00 O ATOM 57649 O34 PC 1403 33.161 75.459 22.760 1.00 0.00 O ATOM 57650 O21 PC 1403 30.311 75.762 26.589 1.00 0.00 O ATOM 57651 C21 PC 1403 29.929 76.662 27.435 1.00 0.00 C ATOM 57652 O22 PC 1403 29.100 77.474 27.112 1.00 0.00 O ATOM 57653 C12 OL 1404 30.518 76.488 28.857 1.00 0.00 C ATOM 57654 H2R OL 1404 31.490 75.991 28.842 1.00 0.00 H ATOM 57655 H2S OL 1404 30.788 77.501 29.164 1.00 0.00 H ATOM 57656 C13 OL 1404 29.449 75.893 29.776 1.00 0.00 C ATOM 57657 H3R OL 1404 28.534 76.468 29.619 1.00 0.00 H ATOM 57658 H3S OL 1404 29.322 74.837 29.529 1.00 0.00 H ATOM 57659 C14 OL 1404 29.769 75.840 31.326 1.00 0.00 C ATOM 57660 H4R OL 1404 28.926 75.456 31.905 1.00 0.00 H ATOM 57661 H4S OL 1404 30.553 75.112 31.544 1.00 0.00 H ATOM 57662 C15 OL 1404 30.206 77.226 31.827 1.00 0.00 C ATOM 57663 H5R OL 1404 31.235 77.520 31.611 1.00 0.00 H ATOM 57664 H5S OL 1404 29.573 77.885 31.228 1.00 0.00 H ATOM 57665 C16 OL 1404 30.012 77.355 33.314 1.00 0.00 C ATOM 57666 H6R OL 1404 30.113 78.433 33.453 1.00 0.00 H ATOM 57667 H6S OL 1404 28.979 77.127 33.586 1.00 0.00 H ATOM 57668 C17 OL 1404 31.089 76.662 34.104 1.00 0.00 C ATOM 57669 H7R OL 1404 31.172 75.578 34.000 1.00 0.00 H ATOM 57670 H7S OL 1404 32.017 76.974 33.622 1.00 0.00 H ATOM 57671 C18 OL 1404 31.220 76.944 35.605 1.00 0.00 C ATOM 57672 H8R OL 1404 32.245 76.740 35.922 1.00 0.00 H ATOM 57673 H8S OL 1404 31.108 78.018 35.769 1.00 0.00 H ATOM 57674 C19 OL 1404 30.419 76.015 36.371 1.00 0.00 C ATOM 57675 H9R OL 1404 30.801 74.997 36.395 1.00 0.00 H ATOM 57676 C110 OL 1404 29.524 76.241 37.336 1.00 0.00 C ATOM 57677 H10R OL 1404 29.239 75.440 38.013 1.00 0.00 H ATOM 57678 C111 OL 1404 28.834 77.527 37.660 1.00 0.00 C ATOM 57679 H11R OL 1404 29.013 78.239 36.852 1.00 0.00 H ATOM 57680 H11S OL 1404 27.759 77.340 37.688 1.00 0.00 H ATOM 57681 C112 OL 1404 29.421 78.151 38.993 1.00 0.00 C ATOM 57682 H12R OL 1404 28.697 78.889 39.345 1.00 0.00 H ATOM 57683 H12S OL 1404 29.442 77.380 39.766 1.00 0.00 H ATOM 57684 C113 OL 1404 30.821 78.742 38.887 1.00 0.00 C ATOM 57685 H13R OL 1404 31.618 77.998 38.935 1.00 0.00 H ATOM 57686 H13S OL 1404 31.026 79.248 37.941 1.00 0.00 H ATOM 57687 C114 OL 1404 31.371 79.739 39.828 1.00 0.00 C ATOM 57688 H14R OL 1404 30.694 80.584 39.976 1.00 0.00 H ATOM 57689 H14S OL 1404 31.428 79.261 40.808 1.00 0.00 H ATOM 57690 C115 OL 1404 32.822 80.396 39.441 1.00 0.00 C ATOM 57691 H15R OL 1404 33.650 79.735 39.705 1.00 0.00 H ATOM 57692 H15S OL 1404 32.792 80.637 38.377 1.00 0.00 H ATOM 57693 C116 OL 1404 33.146 81.669 40.185 1.00 0.00 C ATOM 57694 H16R OL 1404 32.236 82.260 40.058 1.00 0.00 H ATOM 57695 H16S OL 1404 33.255 81.452 41.249 1.00 0.00 H ATOM 57696 C117 OL 1404 34.332 82.454 39.625 1.00 0.00 C ATOM 57697 H17R OL 1404 34.087 82.798 38.619 1.00 0.00 H ATOM 57698 H17S OL 1404 34.546 83.428 40.070 1.00 0.00 H ATOM 57699 C118 OL 1404 35.688 81.723 39.716 1.00 0.00 C ATOM 57700 H18R OL 1404 35.996 81.317 40.682 1.00 0.00 H ATOM 57701 H18S OL 1404 36.428 82.385 39.262 1.00 0.00 H ATOM 57702 H18T OL 1404 35.666 80.852 39.058 1.00 0.00 H TER 57703 OL 1404 ATOM 57703 C116 PA 1405 8.533 85.441 44.231 1.00 0.00 C ATOM 57704 H16R PA 1405 8.410 84.791 45.101 1.00 0.00 H ATOM 57705 H16S PA 1405 7.772 85.150 43.504 1.00 0.00 H ATOM 57706 H16T PA 1405 8.454 86.460 44.616 1.00 0.00 H ATOM 57707 C115 PA 1405 9.842 84.999 43.576 1.00 0.00 C ATOM 57708 H15R PA 1405 9.580 83.983 43.273 1.00 0.00 H ATOM 57709 H15S PA 1405 10.619 84.891 44.336 1.00 0.00 H ATOM 57710 C114 PA 1405 10.219 85.777 42.360 1.00 0.00 C ATOM 57711 H14R PA 1405 11.153 85.378 41.960 1.00 0.00 H ATOM 57712 H14S PA 1405 10.503 86.711 42.848 1.00 0.00 H ATOM 57713 C113 PA 1405 9.198 85.910 41.208 1.00 0.00 C ATOM 57714 H13R PA 1405 8.423 86.651 41.419 1.00 0.00 H ATOM 57715 H13S PA 1405 8.774 84.960 40.876 1.00 0.00 H ATOM 57716 C112 PA 1405 9.981 86.565 39.995 1.00 0.00 C ATOM 57717 H12R PA 1405 10.871 86.013 39.685 1.00 0.00 H ATOM 57718 H12S PA 1405 10.413 87.522 40.294 1.00 0.00 H ATOM 57719 C111 PA 1405 9.132 86.716 38.746 1.00 0.00 C ATOM 57720 H11R PA 1405 9.857 87.075 38.013 1.00 0.00 H ATOM 57721 H11S PA 1405 8.480 87.552 39.007 1.00 0.00 H ATOM 57722 C110 PA 1405 8.424 85.512 38.294 1.00 0.00 C ATOM 57723 H10R PA 1405 7.733 85.283 39.108 1.00 0.00 H ATOM 57724 H10S PA 1405 9.035 84.621 38.135 1.00 0.00 H ATOM 57725 C19 PA 1405 7.567 85.598 37.019 1.00 0.00 C ATOM 57726 H9R PA 1405 8.182 86.040 36.232 1.00 0.00 H ATOM 57727 H9S PA 1405 6.711 86.264 37.140 1.00 0.00 H ATOM 57728 C18 PA 1405 7.259 84.291 36.272 1.00 0.00 C ATOM 57729 H8R PA 1405 6.702 83.617 36.926 1.00 0.00 H ATOM 57730 H8S PA 1405 8.139 83.744 35.926 1.00 0.00 H ATOM 57731 C17 PA 1405 6.334 84.578 35.101 1.00 0.00 C ATOM 57732 H7R PA 1405 6.728 85.461 34.592 1.00 0.00 H ATOM 57733 H7S PA 1405 5.416 84.775 35.659 1.00 0.00 H ATOM 57734 C16 PA 1405 6.308 83.405 34.093 1.00 0.00 C ATOM 57735 H6R PA 1405 6.236 82.481 34.670 1.00 0.00 H ATOM 57736 H6S PA 1405 7.281 83.457 33.600 1.00 0.00 H ATOM 57737 C15 PA 1405 5.308 83.510 32.930 1.00 0.00 C ATOM 57738 H5R PA 1405 5.756 84.211 32.222 1.00 0.00 H ATOM 57739 H5S PA 1405 4.325 83.927 33.161 1.00 0.00 H ATOM 57740 C14 PA 1405 5.026 82.248 32.242 1.00 0.00 C ATOM 57741 H4R PA 1405 4.120 81.784 32.639 1.00 0.00 H ATOM 57742 H4S PA 1405 5.743 81.456 32.469 1.00 0.00 H ATOM 57743 C13 PA 1405 4.940 82.448 30.697 1.00 0.00 C ATOM 57744 H3R PA 1405 5.814 82.833 30.166 1.00 0.00 H ATOM 57745 H3S PA 1405 4.157 83.146 30.392 1.00 0.00 H ATOM 57746 C12 PA 1405 4.506 81.138 30.057 1.00 0.00 C ATOM 57747 H2R PA 1405 3.624 80.635 30.459 1.00 0.00 H ATOM 57748 H2S PA 1405 5.322 80.507 30.415 1.00 0.00 H ATOM 57749 C11 PGR 1406 4.310 81.223 28.567 1.00 0.00 C ATOM 57750 O12 PGR 1406 3.397 80.652 28.018 1.00 0.00 O ATOM 57751 O11 PGR 1406 5.402 81.709 27.864 1.00 0.00 O ATOM 57752 C1 PGR 1406 5.416 81.481 26.420 1.00 0.00 C ATOM 57753 HR PGR 1406 4.915 80.539 26.181 1.00 0.00 H ATOM 57754 HS PGR 1406 6.465 81.340 26.150 1.00 0.00 H ATOM 57755 C2 PGR 1406 4.871 82.652 25.616 1.00 0.00 C ATOM 57756 HX PGR 1406 3.806 82.762 25.833 1.00 0.00 H ATOM 57757 C3 PGR 1406 5.190 82.469 24.115 1.00 0.00 C ATOM 57758 HA PGR 1406 5.332 81.416 23.858 1.00 0.00 H ATOM 57759 HB PGR 1406 6.187 82.893 23.966 1.00 0.00 H ATOM 57760 O31 PGR 1406 4.258 83.108 23.217 1.00 0.00 O ATOM 57761 P31 PGR 1406 3.857 82.500 21.780 1.00 0.00 P ATOM 57762 O32 PGR 1406 4.622 83.484 20.761 1.00 0.00 O ATOM 57763 C31 PGR 1406 5.891 83.241 20.171 1.00 0.00 C ATOM 57764 H1A PGR 1406 5.797 82.333 19.569 1.00 0.00 H ATOM 57765 H1B PGR 1406 6.750 83.054 20.821 1.00 0.00 H ATOM 57766 C32 PGR 1406 6.227 84.404 19.218 1.00 0.00 C ATOM 57767 H2A PGR 1406 6.494 85.317 19.755 1.00 0.00 H ATOM 57768 O35 PGR 1406 5.184 84.469 18.286 1.00 0.00 O ATOM 57769 HO5A PGR 1406 4.438 84.327 18.895 1.00 0.00 H ATOM 57770 C33 PGR 1406 7.448 84.065 18.339 1.00 0.00 C ATOM 57771 H3A PGR 1406 8.339 83.731 18.877 1.00 0.00 H ATOM 57772 H3B PGR 1406 7.112 83.343 17.591 1.00 0.00 H ATOM 57773 O33 PGR 1406 4.395 81.122 21.611 1.00 0.00 O ATOM 57774 O34 PGR 1406 2.417 82.711 21.592 1.00 0.00 O ATOM 57775 O21 PGR 1406 5.606 83.785 26.257 1.00 0.00 O ATOM 57776 C21 PGR 1406 4.943 84.912 26.260 1.00 0.00 C ATOM 57777 O22 PGR 1406 3.919 85.110 25.614 1.00 0.00 O ATOM 57778 O36 PGR 1406 7.688 85.216 17.502 1.00 0.00 O ATOM 57779 HO6A PGR 1406 6.872 85.478 17.040 1.00 0.00 H ATOM 57780 C12 OL 1407 5.445 85.925 27.273 1.00 0.00 C ATOM 57781 H2R OL 1407 6.436 86.298 27.009 1.00 0.00 H ATOM 57782 H2S OL 1407 4.803 86.806 27.340 1.00 0.00 H ATOM 57783 C13 OL 1407 5.371 85.275 28.639 1.00 0.00 C ATOM 57784 H3R OL 1407 4.352 84.912 28.786 1.00 0.00 H ATOM 57785 H3S OL 1407 6.009 84.388 28.657 1.00 0.00 H ATOM 57786 C14 OL 1407 6.013 86.126 29.780 1.00 0.00 C ATOM 57787 H4R OL 1407 5.579 85.755 30.710 1.00 0.00 H ATOM 57788 H4S OL 1407 7.086 85.934 29.840 1.00 0.00 H ATOM 57789 C15 OL 1407 5.605 87.586 29.701 1.00 0.00 C ATOM 57790 H5R OL 1407 5.849 88.049 28.743 1.00 0.00 H ATOM 57791 H5S OL 1407 4.515 87.570 29.636 1.00 0.00 H ATOM 57792 C16 OL 1407 5.998 88.356 30.989 1.00 0.00 C ATOM 57793 H6R OL 1407 5.490 88.015 31.893 1.00 0.00 H ATOM 57794 H6S OL 1407 7.059 88.192 31.190 1.00 0.00 H ATOM 57795 C17 OL 1407 5.683 89.875 30.929 1.00 0.00 C ATOM 57796 H7R OL 1407 4.607 90.044 31.000 1.00 0.00 H ATOM 57797 H7S OL 1407 6.238 90.423 31.693 1.00 0.00 H ATOM 57798 C18 OL 1407 6.024 90.622 29.623 1.00 0.00 C ATOM 57799 H8R OL 1407 7.094 90.524 29.430 1.00 0.00 H ATOM 57800 H8S OL 1407 5.350 90.297 28.827 1.00 0.00 H ATOM 57801 C19 OL 1407 5.808 92.197 29.818 1.00 0.00 C ATOM 57802 H9R OL 1407 4.765 92.495 29.753 1.00 0.00 H ATOM 57803 C110 OL 1407 6.704 93.130 29.927 1.00 0.00 C ATOM 57804 H10R OL 1407 6.310 94.143 29.911 1.00 0.00 H ATOM 57805 C111 OL 1407 8.147 92.976 29.947 1.00 0.00 C ATOM 57806 H11R OL 1407 8.365 92.049 29.413 1.00 0.00 H ATOM 57807 H11S OL 1407 8.607 93.716 29.289 1.00 0.00 H ATOM 57808 C112 OL 1407 8.804 93.023 31.327 1.00 0.00 C ATOM 57809 H12R OL 1407 8.587 94.023 31.710 1.00 0.00 H ATOM 57810 H12S OL 1407 8.311 92.232 31.896 1.00 0.00 H ATOM 57811 C113 OL 1407 10.334 92.689 31.267 1.00 0.00 C ATOM 57812 H13R OL 1407 10.474 91.663 30.920 1.00 0.00 H ATOM 57813 H13S OL 1407 10.848 93.266 30.496 1.00 0.00 H ATOM 57814 C114 OL 1407 11.163 92.990 32.552 1.00 0.00 C ATOM 57815 H14R OL 1407 12.205 92.697 32.405 1.00 0.00 H ATOM 57816 H14S OL 1407 11.190 94.082 32.576 1.00 0.00 H ATOM 57817 C115 OL 1407 10.685 92.464 33.955 1.00 0.00 C ATOM 57818 H15R OL 1407 11.398 92.816 34.703 1.00 0.00 H ATOM 57819 H15S OL 1407 9.732 92.946 34.188 1.00 0.00 H ATOM 57820 C116 OL 1407 10.578 90.930 33.987 1.00 0.00 C ATOM 57821 H16R OL 1407 10.202 90.586 33.021 1.00 0.00 H ATOM 57822 H16S OL 1407 11.616 90.608 34.096 1.00 0.00 H ATOM 57823 C117 OL 1407 9.656 90.386 35.148 1.00 0.00 C ATOM 57824 H17R OL 1407 10.075 90.559 36.142 1.00 0.00 H ATOM 57825 H17S OL 1407 8.746 90.977 35.265 1.00 0.00 H ATOM 57826 C118 OL 1407 9.357 88.895 34.992 1.00 0.00 C ATOM 57827 H18R OL 1407 10.350 88.502 34.763 1.00 0.00 H ATOM 57828 H18S OL 1407 8.660 88.862 34.152 1.00 0.00 H ATOM 57829 H18T OL 1407 8.895 88.358 35.822 1.00 0.00 H TER 57830 OL 1407 ATOM 57830 C116 PA 1408 2.090 61.320 38.732 1.00 0.00 C ATOM 57831 H16R PA 1408 2.419 60.345 38.367 1.00 0.00 H ATOM 57832 H16S PA 1408 2.071 61.253 39.822 1.00 0.00 H ATOM 57833 H16T PA 1408 2.670 62.152 38.328 1.00 0.00 H ATOM 57834 C115 PA 1408 0.571 61.542 38.268 1.00 0.00 C ATOM 57835 H15R PA 1408 0.360 62.539 38.662 1.00 0.00 H ATOM 57836 H15S PA 1408 -0.104 60.775 38.653 1.00 0.00 H ATOM 57837 C114 PA 1408 0.473 61.681 36.734 1.00 0.00 C ATOM 57838 H14R PA 1408 -0.540 61.634 36.328 1.00 0.00 H ATOM 57839 H14S PA 1408 1.000 60.827 36.304 1.00 0.00 H ATOM 57840 C113 PA 1408 1.246 62.908 36.097 1.00 0.00 C ATOM 57841 H13R PA 1408 2.319 62.785 36.260 1.00 0.00 H ATOM 57842 H13S PA 1408 0.994 63.875 36.537 1.00 0.00 H ATOM 57843 C112 PA 1408 1.012 63.062 34.639 1.00 0.00 C ATOM 57844 H12R PA 1408 -0.035 63.194 34.357 1.00 0.00 H ATOM 57845 H12S PA 1408 1.218 62.104 34.156 1.00 0.00 H ATOM 57846 C111 PA 1408 1.909 64.075 34.011 1.00 0.00 C ATOM 57847 H11R PA 1408 2.925 63.991 34.404 1.00 0.00 H ATOM 57848 H11S PA 1408 1.366 64.989 34.262 1.00 0.00 H ATOM 57849 C110 PA 1408 2.006 63.918 32.526 1.00 0.00 C ATOM 57850 H10R PA 1408 1.002 63.729 32.140 1.00 0.00 H ATOM 57851 H10S PA 1408 2.780 63.192 32.270 1.00 0.00 H ATOM 57852 C19 PA 1408 2.493 65.196 31.837 1.00 0.00 C ATOM 57853 H9R PA 1408 1.677 65.915 31.738 1.00 0.00 H ATOM 57854 H9S PA 1408 2.614 64.877 30.800 1.00 0.00 H ATOM 57855 C18 PA 1408 3.839 65.756 32.392 1.00 0.00 C ATOM 57856 H8R PA 1408 4.434 64.932 32.790 1.00 0.00 H ATOM 57857 H8S PA 1408 3.441 66.427 33.156 1.00 0.00 H ATOM 57858 C17 PA 1408 4.769 66.565 31.464 1.00 0.00 C ATOM 57859 H7R PA 1408 4.942 65.833 30.672 1.00 0.00 H ATOM 57860 H7S PA 1408 5.728 66.823 31.918 1.00 0.00 H ATOM 57861 C16 PA 1408 4.070 67.799 30.951 1.00 0.00 C ATOM 57862 H6R PA 1408 3.619 68.443 31.710 1.00 0.00 H ATOM 57863 H6S PA 1408 3.160 67.534 30.409 1.00 0.00 H ATOM 57864 C15 PA 1408 4.876 68.666 30.017 1.00 0.00 C ATOM 57865 H5R PA 1408 5.660 69.161 30.595 1.00 0.00 H ATOM 57866 H5S PA 1408 4.118 69.376 29.680 1.00 0.00 H ATOM 57867 C14 PA 1408 5.370 67.981 28.788 1.00 0.00 C ATOM 57868 H4R PA 1408 5.590 66.925 28.955 1.00 0.00 H ATOM 57869 H4S PA 1408 6.357 68.373 28.532 1.00 0.00 H ATOM 57870 C13 PA 1408 4.562 68.235 27.552 1.00 0.00 C ATOM 57871 H3R PA 1408 5.022 67.540 26.847 1.00 0.00 H ATOM 57872 H3S PA 1408 4.645 69.283 27.257 1.00 0.00 H ATOM 57873 C12 PA 1408 3.077 67.855 27.489 1.00 0.00 C ATOM 57874 H2R PA 1408 2.447 68.539 28.062 1.00 0.00 H ATOM 57875 H2S PA 1408 2.976 66.916 28.039 1.00 0.00 H ATOM 57876 C11 PGR 1409 2.443 67.721 26.097 1.00 0.00 C ATOM 57877 O12 PGR 1409 1.271 67.811 25.814 1.00 0.00 O ATOM 57878 O11 PGR 1409 3.403 67.343 25.248 1.00 0.00 O ATOM 57879 C1 PGR 1409 3.074 67.157 23.830 1.00 0.00 C ATOM 57880 HR PGR 1409 2.557 68.073 23.533 1.00 0.00 H ATOM 57881 HS PGR 1409 2.628 66.193 23.574 1.00 0.00 H ATOM 57882 C2 PGR 1409 4.497 67.132 23.178 1.00 0.00 C ATOM 57883 HX PGR 1409 5.066 67.894 23.716 1.00 0.00 H ATOM 57884 C3 PGR 1409 4.353 67.578 21.746 1.00 0.00 C ATOM 57885 HA PGR 1409 5.300 67.247 21.312 1.00 0.00 H ATOM 57886 HB PGR 1409 4.173 68.654 21.668 1.00 0.00 H ATOM 57887 O31 PGR 1409 3.125 67.011 21.170 1.00 0.00 O ATOM 57888 P31 PGR 1409 3.009 66.557 19.671 1.00 0.00 P ATOM 57889 O32 PGR 1409 2.898 67.999 18.962 1.00 0.00 O ATOM 57890 C31 PGR 1409 2.103 69.033 19.394 1.00 0.00 C ATOM 57891 H1A PGR 1409 2.610 69.578 20.193 1.00 0.00 H ATOM 57892 H1B PGR 1409 1.173 68.625 19.797 1.00 0.00 H ATOM 57893 C32 PGR 1409 1.792 69.971 18.214 1.00 0.00 C ATOM 57894 H2A PGR 1409 1.656 69.323 17.344 1.00 0.00 H ATOM 57895 O35 PGR 1409 2.775 70.925 17.988 1.00 0.00 O ATOM 57896 HO5A PGR 1409 3.607 70.489 17.733 1.00 0.00 H ATOM 57897 C33 PGR 1409 0.431 70.641 18.421 1.00 0.00 C ATOM 57898 H3A PGR 1409 0.128 71.191 17.526 1.00 0.00 H ATOM 57899 H3B PGR 1409 -0.329 69.861 18.510 1.00 0.00 H ATOM 57900 O33 PGR 1409 4.227 65.933 19.179 1.00 0.00 O ATOM 57901 O34 PGR 1409 1.747 65.795 19.522 1.00 0.00 O ATOM 57902 O21 PGR 1409 4.972 65.774 23.301 1.00 0.00 O ATOM 57903 C21 PGR 1409 6.235 65.554 23.199 1.00 0.00 C ATOM 57904 O22 PGR 1409 6.958 66.535 22.868 1.00 0.00 O ATOM 57905 O36 PGR 1409 0.287 71.565 19.546 1.00 0.00 O ATOM 57906 HO6A PGR 1409 0.329 71.044 20.368 1.00 0.00 H ATOM 57907 C12 OL 1410 6.687 64.186 23.597 1.00 0.00 C ATOM 57908 H2R OL 1410 6.447 63.907 24.625 1.00 0.00 H ATOM 57909 H2S OL 1410 6.046 63.532 23.001 1.00 0.00 H ATOM 57910 C13 OL 1410 8.186 63.882 23.239 1.00 0.00 C ATOM 57911 H3R OL 1410 8.411 64.142 22.203 1.00 0.00 H ATOM 57912 H3S OL 1410 8.799 64.625 23.753 1.00 0.00 H ATOM 57913 C14 OL 1410 8.506 62.422 23.527 1.00 0.00 C ATOM 57914 H4R OL 1410 8.284 62.117 24.552 1.00 0.00 H ATOM 57915 H4S OL 1410 8.007 61.790 22.790 1.00 0.00 H ATOM 57916 C15 OL 1410 10.066 62.175 23.269 1.00 0.00 C ATOM 57917 H5R OL 1410 10.298 61.123 23.091 1.00 0.00 H ATOM 57918 H5S OL 1410 10.316 62.660 22.323 1.00 0.00 H ATOM 57919 C16 OL 1410 10.850 62.604 24.478 1.00 0.00 C ATOM 57920 H6R OL 1410 10.434 63.575 24.754 1.00 0.00 H ATOM 57921 H6S OL 1410 10.810 61.915 25.324 1.00 0.00 H ATOM 57922 C17 OL 1410 12.339 62.789 24.215 1.00 0.00 C ATOM 57923 H7R OL 1410 12.757 61.800 24.013 1.00 0.00 H ATOM 57924 H7S OL 1410 12.460 63.365 23.295 1.00 0.00 H ATOM 57925 C18 OL 1410 13.130 63.369 25.336 1.00 0.00 C ATOM 57926 H8R OL 1410 14.059 63.813 24.974 1.00 0.00 H ATOM 57927 H8S OL 1410 12.677 64.175 25.919 1.00 0.00 H ATOM 57928 C19 OL 1410 13.502 62.244 26.288 1.00 0.00 C ATOM 57929 H9R OL 1410 13.979 61.427 25.754 1.00 0.00 H ATOM 57930 C110 OL 1410 13.339 62.044 27.598 1.00 0.00 C ATOM 57931 H10R OL 1410 13.619 61.096 28.050 1.00 0.00 H ATOM 57932 C111 OL 1410 12.696 62.873 28.680 1.00 0.00 C ATOM 57933 H11R OL 1410 13.403 63.150 29.465 1.00 0.00 H ATOM 57934 H11S OL 1410 12.380 63.859 28.331 1.00 0.00 H ATOM 57935 C112 OL 1410 11.572 62.111 29.424 1.00 0.00 C ATOM 57936 H12R OL 1410 10.936 61.645 28.668 1.00 0.00 H ATOM 57937 H12S OL 1410 12.042 61.198 29.793 1.00 0.00 H ATOM 57938 C113 OL 1410 10.674 62.870 30.406 1.00 0.00 C ATOM 57939 H13R OL 1410 9.990 62.151 30.861 1.00 0.00 H ATOM 57940 H13S OL 1410 11.159 63.360 31.253 1.00 0.00 H ATOM 57941 C114 OL 1410 9.596 63.809 29.635 1.00 0.00 C ATOM 57942 H14R OL 1410 8.982 64.350 30.357 1.00 0.00 H ATOM 57943 H14S OL 1410 10.231 64.594 29.218 1.00 0.00 H ATOM 57944 C115 OL 1410 8.654 63.082 28.771 1.00 0.00 C ATOM 57945 H15R OL 1410 9.220 62.534 28.014 1.00 0.00 H ATOM 57946 H15S OL 1410 8.084 62.331 29.321 1.00 0.00 H ATOM 57947 C116 OL 1410 7.752 64.116 28.025 1.00 0.00 C ATOM 57948 H16R OL 1410 7.362 64.904 28.673 1.00 0.00 H ATOM 57949 H16S OL 1410 8.420 64.707 27.395 1.00 0.00 H ATOM 57950 C117 OL 1410 6.586 63.459 27.284 1.00 0.00 C ATOM 57951 H17R OL 1410 6.010 64.220 26.753 1.00 0.00 H ATOM 57952 H17S OL 1410 6.994 62.718 26.593 1.00 0.00 H ATOM 57953 C118 OL 1410 5.543 62.889 28.192 1.00 0.00 C ATOM 57954 H18R OL 1410 6.098 62.137 28.756 1.00 0.00 H ATOM 57955 H18S OL 1410 4.618 62.520 27.743 1.00 0.00 H ATOM 57956 H18T OL 1410 5.213 63.576 28.974 1.00 0.00 H TER 57957 OL 1410 ATOM 57957 C116 PA 1411 86.972 111.413 38.353 1.00 0.00 C ATOM 57958 H16R PA 1411 86.358 112.258 38.033 1.00 0.00 H ATOM 57959 H16S PA 1411 87.378 110.926 37.464 1.00 0.00 H ATOM 57960 H16T PA 1411 87.865 111.690 38.917 1.00 0.00 H ATOM 57961 C115 PA 1411 86.164 110.397 39.034 1.00 0.00 C ATOM 57962 H15R PA 1411 85.803 109.560 38.432 1.00 0.00 H ATOM 57963 H15S PA 1411 85.202 110.855 39.275 1.00 0.00 H ATOM 57964 C114 PA 1411 86.738 109.871 40.278 1.00 0.00 C ATOM 57965 H14R PA 1411 86.956 110.697 40.958 1.00 0.00 H ATOM 57966 H14S PA 1411 87.760 109.498 40.183 1.00 0.00 H ATOM 57967 C113 PA 1411 85.967 108.660 40.947 1.00 0.00 C ATOM 57968 H13R PA 1411 85.040 108.979 41.428 1.00 0.00 H ATOM 57969 H13S PA 1411 86.590 108.153 41.687 1.00 0.00 H ATOM 57970 C112 PA 1411 85.543 107.545 40.054 1.00 0.00 C ATOM 57971 H12R PA 1411 84.913 107.998 39.285 1.00 0.00 H ATOM 57972 H12S PA 1411 84.898 106.862 40.611 1.00 0.00 H ATOM 57973 C111 PA 1411 86.675 106.659 39.470 1.00 0.00 C ATOM 57974 H11R PA 1411 87.339 106.164 40.181 1.00 0.00 H ATOM 57975 H11S PA 1411 87.351 107.264 38.862 1.00 0.00 H ATOM 57976 C110 PA 1411 85.976 105.532 38.532 1.00 0.00 C ATOM 57977 H10R PA 1411 85.528 105.953 37.630 1.00 0.00 H ATOM 57978 H10S PA 1411 85.164 105.195 39.179 1.00 0.00 H ATOM 57979 C19 PA 1411 86.922 104.421 38.127 1.00 0.00 C ATOM 57980 H9R PA 1411 87.350 103.789 38.908 1.00 0.00 H ATOM 57981 H9S PA 1411 87.812 104.886 37.697 1.00 0.00 H ATOM 57982 C18 PA 1411 86.385 103.414 37.030 1.00 0.00 C ATOM 57983 H8R PA 1411 85.671 103.937 36.390 1.00 0.00 H ATOM 57984 H8S PA 1411 85.806 102.712 37.634 1.00 0.00 H ATOM 57985 C17 PA 1411 87.409 102.702 36.137 1.00 0.00 C ATOM 57986 H7R PA 1411 88.080 101.969 36.590 1.00 0.00 H ATOM 57987 H7S PA 1411 88.023 103.484 35.686 1.00 0.00 H ATOM 57988 C16 PA 1411 86.665 101.984 35.035 1.00 0.00 C ATOM 57989 H6R PA 1411 85.931 102.661 34.593 1.00 0.00 H ATOM 57990 H6S PA 1411 86.167 101.261 35.683 1.00 0.00 H ATOM 57991 C15 PA 1411 87.537 101.228 34.035 1.00 0.00 C ATOM 57992 H5R PA 1411 86.952 100.433 33.569 1.00 0.00 H ATOM 57993 H5S PA 1411 88.426 100.717 34.411 1.00 0.00 H ATOM 57994 C14 PA 1411 88.203 102.185 33.034 1.00 0.00 C ATOM 57995 H4R PA 1411 89.040 102.584 33.610 1.00 0.00 H ATOM 57996 H4S PA 1411 87.628 103.061 32.727 1.00 0.00 H ATOM 57997 C13 PA 1411 88.787 101.342 31.890 1.00 0.00 C ATOM 57998 H3R PA 1411 88.191 100.428 31.892 1.00 0.00 H ATOM 57999 H3S PA 1411 89.771 100.910 32.087 1.00 0.00 H ATOM 58000 C12 PA 1411 88.744 102.153 30.562 1.00 0.00 C ATOM 58001 H2R PA 1411 89.392 103.025 30.664 1.00 0.00 H ATOM 58002 H2S PA 1411 87.770 102.630 30.429 1.00 0.00 H ATOM 58003 C11 PC 1412 89.134 101.336 29.352 1.00 0.00 C ATOM 58004 O12 PC 1412 89.224 101.863 28.275 1.00 0.00 O ATOM 58005 O11 PC 1412 89.468 100.081 29.681 1.00 0.00 O ATOM 58006 C1 PC 1412 89.877 99.143 28.674 1.00 0.00 C ATOM 58007 HR PC 1412 89.027 99.253 27.995 1.00 0.00 H ATOM 58008 HS PC 1412 90.036 98.121 29.027 1.00 0.00 H ATOM 58009 C2 PC 1412 91.212 99.658 27.928 1.00 0.00 C ATOM 58010 HX PC 1412 91.100 100.637 27.454 1.00 0.00 H ATOM 58011 C3 PC 1412 91.541 98.680 26.779 1.00 0.00 C ATOM 58012 HA PC 1412 90.718 98.501 26.082 1.00 0.00 H ATOM 58013 HB PC 1412 91.873 97.689 27.101 1.00 0.00 H ATOM 58014 O31 PC 1412 92.706 99.229 26.063 1.00 0.00 O ATOM 58015 P31 PC 1412 92.595 100.448 24.985 1.00 0.00 P ATOM 58016 O32 PC 1412 92.441 101.582 26.018 1.00 0.00 O ATOM 58017 C31 PC 1412 93.588 102.174 26.514 1.00 0.00 C ATOM 58018 H1A PC 1412 94.515 102.046 25.949 1.00 0.00 H ATOM 58019 H1B PC 1412 93.586 101.816 27.547 1.00 0.00 H ATOM 58020 C32 PC 1412 93.348 103.693 26.558 1.00 0.00 C ATOM 58021 H2A PC 1412 93.951 104.085 27.379 1.00 0.00 H ATOM 58022 H2B PC 1412 92.331 103.996 26.810 1.00 0.00 H ATOM 58023 N31 PC 1412 93.723 104.320 25.280 1.00 0.00 N ATOM 58024 C33 PC 1412 93.194 105.671 25.296 1.00 0.00 C ATOM 58025 H3A PC 1412 92.108 105.572 25.313 1.00 0.00 H ATOM 58026 H3B PC 1412 93.501 106.256 24.427 1.00 0.00 H ATOM 58027 H3C PC 1412 93.593 105.922 26.279 1.00 0.00 H ATOM 58028 C34 PC 1412 95.189 104.555 25.172 1.00 0.00 C ATOM 58029 H4A PC 1412 95.438 105.344 24.459 1.00 0.00 H ATOM 58030 H4B PC 1412 95.629 103.557 25.194 1.00 0.00 H ATOM 58031 H4C PC 1412 95.494 105.037 26.102 1.00 0.00 H ATOM 58032 C35 PC 1412 93.197 103.592 24.113 1.00 0.00 C ATOM 58033 H5A PC 1412 93.190 104.313 23.294 1.00 0.00 H ATOM 58034 H5B PC 1412 92.185 103.253 24.338 1.00 0.00 H ATOM 58035 H5C PC 1412 93.892 102.778 23.904 1.00 0.00 H ATOM 58036 O33 PC 1412 93.921 100.450 24.380 1.00 0.00 O ATOM 58037 O34 PC 1412 91.388 100.204 24.149 1.00 0.00 O ATOM 58038 O21 PC 1412 92.283 99.572 28.902 1.00 0.00 O ATOM 58039 C21 PC 1412 92.414 100.597 29.827 1.00 0.00 C ATOM 58040 O22 PC 1412 91.936 101.713 29.771 1.00 0.00 O ATOM 58041 C12 OL 1413 93.249 100.152 30.995 1.00 0.00 C ATOM 58042 H2R OL 1413 92.873 99.181 31.321 1.00 0.00 H ATOM 58043 H2S OL 1413 94.294 99.987 30.727 1.00 0.00 H ATOM 58044 C13 OL 1413 93.238 101.140 32.222 1.00 0.00 C ATOM 58045 H3R OL 1413 93.614 102.106 31.880 1.00 0.00 H ATOM 58046 H3S OL 1413 92.180 101.305 32.436 1.00 0.00 H ATOM 58047 C14 OL 1413 94.123 100.739 33.365 1.00 0.00 C ATOM 58048 H4R OL 1413 93.889 99.729 33.710 1.00 0.00 H ATOM 58049 H4S OL 1413 95.180 100.719 33.093 1.00 0.00 H ATOM 58050 C15 OL 1413 93.888 101.589 34.530 1.00 0.00 C ATOM 58051 H5R OL 1413 94.770 101.345 35.125 1.00 0.00 H ATOM 58052 H5S OL 1413 94.078 102.623 34.235 1.00 0.00 H ATOM 58053 C16 OL 1413 92.665 101.317 35.349 1.00 0.00 C ATOM 58054 H6R OL 1413 91.853 101.914 34.929 1.00 0.00 H ATOM 58055 H6S OL 1413 92.417 100.258 35.256 1.00 0.00 H ATOM 58056 C17 OL 1413 92.926 101.676 36.846 1.00 0.00 C ATOM 58057 H7R OL 1413 93.898 101.284 37.150 1.00 0.00 H ATOM 58058 H7S OL 1413 93.003 102.766 36.865 1.00 0.00 H ATOM 58059 C18 OL 1413 91.906 101.086 37.854 1.00 0.00 C ATOM 58060 H8R OL 1413 90.884 101.347 37.569 1.00 0.00 H ATOM 58061 H8S OL 1413 91.821 99.999 37.914 1.00 0.00 H ATOM 58062 C19 OL 1413 92.260 101.649 39.184 1.00 0.00 C ATOM 58063 H9R OL 1413 91.755 102.602 39.317 1.00 0.00 H ATOM 58064 C110 OL 1413 93.095 101.117 40.115 1.00 0.00 C ATOM 58065 H10R OL 1413 93.322 101.664 41.027 1.00 0.00 H ATOM 58066 C111 OL 1413 93.917 99.848 39.949 1.00 0.00 C ATOM 58067 H11R OL 1413 93.509 99.103 40.635 1.00 0.00 H ATOM 58068 H11S OL 1413 93.640 99.442 38.974 1.00 0.00 H ATOM 58069 C112 OL 1413 95.412 100.022 40.137 1.00 0.00 C ATOM 58070 H12R OL 1413 95.568 100.671 41.002 1.00 0.00 H ATOM 58071 H12S OL 1413 95.825 99.048 40.406 1.00 0.00 H ATOM 58072 C113 OL 1413 96.133 100.593 38.888 1.00 0.00 C ATOM 58073 H13R OL 1413 95.600 100.017 38.128 1.00 0.00 H ATOM 58074 H13S OL 1413 95.955 101.667 38.803 1.00 0.00 H ATOM 58075 C114 OL 1413 97.622 100.245 38.765 1.00 0.00 C ATOM 58076 H14R OL 1413 98.162 100.721 39.586 1.00 0.00 H ATOM 58077 H14S OL 1413 97.689 99.162 38.895 1.00 0.00 H ATOM 58078 C115 OL 1413 98.283 100.658 37.488 1.00 0.00 C ATOM 58079 H15R OL 1413 98.689 101.669 37.563 1.00 0.00 H ATOM 58080 H15S OL 1413 99.159 100.007 37.524 1.00 0.00 H ATOM 58081 C116 OL 1413 97.416 100.415 36.249 1.00 0.00 C ATOM 58082 H16R OL 1413 97.021 99.398 36.192 1.00 0.00 H ATOM 58083 H16S OL 1413 96.514 101.030 36.228 1.00 0.00 H ATOM 58084 C117 OL 1413 98.148 100.621 34.860 1.00 0.00 C ATOM 58085 H17R OL 1413 97.472 100.305 34.063 1.00 0.00 H ATOM 58086 H17S OL 1413 98.219 101.691 34.656 1.00 0.00 H ATOM 58087 C118 OL 1413 99.512 99.904 34.762 1.00 0.00 C ATOM 58088 H18R OL 1413 99.482 98.841 35.012 1.00 0.00 H ATOM 58089 H18S OL 1413 100.220 100.363 35.455 1.00 0.00 H ATOM 58090 H18T OL 1413 100.021 99.886 33.796 1.00 0.00 H TER 58091 OL 1413 ATOM 58091 C116 PA 1414 114.071 96.045 43.233 1.00 0.00 C ATOM 58092 H16R PA 1414 114.292 95.474 42.329 1.00 0.00 H ATOM 58093 H16S PA 1414 114.594 95.560 44.059 1.00 0.00 H ATOM 58094 H16T PA 1414 114.480 97.058 43.211 1.00 0.00 H ATOM 58095 C115 PA 1414 112.582 95.934 43.451 1.00 0.00 C ATOM 58096 H15R PA 1414 112.318 96.571 44.298 1.00 0.00 H ATOM 58097 H15S PA 1414 112.311 94.932 43.791 1.00 0.00 H ATOM 58098 C114 PA 1414 111.746 96.412 42.213 1.00 0.00 C ATOM 58099 H14R PA 1414 112.259 96.120 41.295 1.00 0.00 H ATOM 58100 H14S PA 1414 111.597 97.491 42.134 1.00 0.00 H ATOM 58101 C113 PA 1414 110.374 95.749 42.124 1.00 0.00 C ATOM 58102 H13R PA 1414 109.739 95.828 43.009 1.00 0.00 H ATOM 58103 H13S PA 1414 110.421 94.659 42.134 1.00 0.00 H ATOM 58104 C112 PA 1414 109.395 96.301 41.071 1.00 0.00 C ATOM 58105 H12R PA 1414 109.038 97.293 41.359 1.00 0.00 H ATOM 58106 H12S PA 1414 108.541 95.620 41.050 1.00 0.00 H ATOM 58107 C111 PA 1414 109.811 96.207 39.608 1.00 0.00 C ATOM 58108 H11R PA 1414 109.972 95.203 39.210 1.00 0.00 H ATOM 58109 H11S PA 1414 110.816 96.631 39.565 1.00 0.00 H ATOM 58110 C110 PA 1414 108.813 97.054 38.819 1.00 0.00 C ATOM 58111 H10R PA 1414 108.836 98.119 39.061 1.00 0.00 H ATOM 58112 H10S PA 1414 107.862 96.735 39.250 1.00 0.00 H ATOM 58113 C19 PA 1414 108.932 96.869 37.348 1.00 0.00 C ATOM 58114 H9R PA 1414 108.490 95.928 37.015 1.00 0.00 H ATOM 58115 H9S PA 1414 109.988 97.052 37.139 1.00 0.00 H ATOM 58116 C18 PA 1414 108.050 97.883 36.650 1.00 0.00 C ATOM 58117 H8R PA 1414 108.388 98.855 37.016 1.00 0.00 H ATOM 58118 H8S PA 1414 106.990 97.875 36.913 1.00 0.00 H ATOM 58119 C17 PA 1414 108.181 97.895 35.088 1.00 0.00 C ATOM 58120 H7R PA 1414 109.197 98.212 34.844 1.00 0.00 H ATOM 58121 H7S PA 1414 107.496 98.661 34.717 1.00 0.00 H ATOM 58122 C16 PA 1414 108.015 96.457 34.384 1.00 0.00 C ATOM 58123 H6R PA 1414 107.062 96.003 34.662 1.00 0.00 H ATOM 58124 H6S PA 1414 108.690 95.679 34.744 1.00 0.00 H ATOM 58125 C15 PA 1414 108.091 96.578 32.908 1.00 0.00 C ATOM 58126 H5R PA 1414 109.057 96.907 32.519 1.00 0.00 H ATOM 58127 H5S PA 1414 107.427 97.363 32.539 1.00 0.00 H ATOM 58128 C14 PA 1414 107.737 95.188 32.356 1.00 0.00 C ATOM 58129 H4R PA 1414 106.661 95.030 32.259 1.00 0.00 H ATOM 58130 H4S PA 1414 108.009 94.363 33.018 1.00 0.00 H ATOM 58131 C13 PA 1414 108.390 94.899 31.037 1.00 0.00 C ATOM 58132 H3R PA 1414 109.455 95.126 31.113 1.00 0.00 H ATOM 58133 H3S PA 1414 108.156 95.610 30.242 1.00 0.00 H ATOM 58134 C12 PA 1414 108.147 93.432 30.591 1.00 0.00 C ATOM 58135 H2R PA 1414 108.604 92.645 31.195 1.00 0.00 H ATOM 58136 H2S PA 1414 107.075 93.266 30.463 1.00 0.00 H ATOM 58137 C11 PGR 1415 108.804 93.325 29.193 1.00 0.00 C ATOM 58138 O12 PGR 1415 108.338 93.729 28.124 1.00 0.00 O ATOM 58139 O11 PGR 1415 109.900 92.551 29.230 1.00 0.00 O ATOM 58140 C1 PGR 1415 110.701 92.348 28.040 1.00 0.00 C ATOM 58141 HR PGR 1415 109.968 92.137 27.258 1.00 0.00 H ATOM 58142 HS PGR 1415 111.358 91.520 28.320 1.00 0.00 H ATOM 58143 C2 PGR 1415 111.485 93.657 27.587 1.00 0.00 C ATOM 58144 HX PGR 1415 110.739 94.455 27.556 1.00 0.00 H ATOM 58145 C3 PGR 1415 111.938 93.632 26.115 1.00 0.00 C ATOM 58146 HA PGR 1415 111.051 93.368 25.533 1.00 0.00 H ATOM 58147 HB PGR 1415 112.711 92.898 25.873 1.00 0.00 H ATOM 58148 O31 PGR 1415 112.373 94.945 25.627 1.00 0.00 O ATOM 58149 P31 PGR 1415 111.286 96.044 25.208 1.00 0.00 P ATOM 58150 O32 PGR 1415 110.553 96.487 26.588 1.00 0.00 O ATOM 58151 C31 PGR 1415 111.178 97.456 27.479 1.00 0.00 C ATOM 58152 H1A PGR 1415 111.234 98.396 26.923 1.00 0.00 H ATOM 58153 H1B PGR 1415 112.120 97.029 27.833 1.00 0.00 H ATOM 58154 C32 PGR 1415 110.156 97.545 28.620 1.00 0.00 C ATOM 58155 H2A PGR 1415 110.205 96.537 29.039 1.00 0.00 H ATOM 58156 O35 PGR 1415 108.859 97.993 28.117 1.00 0.00 O ATOM 58157 HO5A PGR 1415 108.477 97.351 27.492 1.00 0.00 H ATOM 58158 C33 PGR 1415 110.676 98.577 29.698 1.00 0.00 C ATOM 58159 H3A PGR 1415 109.954 98.517 30.516 1.00 0.00 H ATOM 58160 H3B PGR 1415 111.719 98.419 29.987 1.00 0.00 H ATOM 58161 O33 PGR 1415 112.105 97.170 24.712 1.00 0.00 O ATOM 58162 O34 PGR 1415 110.355 95.438 24.306 1.00 0.00 O ATOM 58163 O21 PGR 1415 112.516 94.079 28.571 1.00 0.00 O ATOM 58164 C21 PGR 1415 113.725 93.568 28.495 1.00 0.00 C ATOM 58165 O22 PGR 1415 114.018 92.483 28.056 1.00 0.00 O ATOM 58166 O36 PGR 1415 110.701 99.813 29.028 1.00 0.00 O ATOM 58167 HO6A PGR 1415 109.817 100.023 28.679 1.00 0.00 H ATOM 58168 C12 OL 1416 114.780 94.498 29.148 1.00 0.00 C ATOM 58169 H2R OL 1416 114.296 95.472 29.251 1.00 0.00 H ATOM 58170 H2S OL 1416 115.049 94.167 30.153 1.00 0.00 H ATOM 58171 C13 OL 1416 116.086 94.695 28.276 1.00 0.00 C ATOM 58172 H3R OL 1416 116.458 93.670 28.226 1.00 0.00 H ATOM 58173 H3S OL 1416 115.700 95.070 27.326 1.00 0.00 H ATOM 58174 C14 OL 1416 117.102 95.620 28.843 1.00 0.00 C ATOM 58175 H4R OL 1416 117.493 95.177 29.761 1.00 0.00 H ATOM 58176 H4S OL 1416 117.975 95.735 28.197 1.00 0.00 H ATOM 58177 C15 OL 1416 116.605 97.024 29.145 1.00 0.00 C ATOM 58178 H5R OL 1416 115.941 97.448 28.389 1.00 0.00 H ATOM 58179 H5S OL 1416 115.927 96.837 29.981 1.00 0.00 H ATOM 58180 C16 OL 1416 117.613 98.041 29.591 1.00 0.00 C ATOM 58181 H6R OL 1416 118.414 97.958 28.853 1.00 0.00 H ATOM 58182 H6S OL 1416 117.199 99.051 29.577 1.00 0.00 H ATOM 58183 C17 OL 1416 118.154 97.901 30.968 1.00 0.00 C ATOM 58184 H7R OL 1416 117.469 98.207 31.761 1.00 0.00 H ATOM 58185 H7S OL 1416 118.448 96.872 31.183 1.00 0.00 H ATOM 58186 C18 OL 1416 119.518 98.662 31.179 1.00 0.00 C ATOM 58187 H8R OL 1416 119.887 98.355 32.159 1.00 0.00 H ATOM 58188 H8S OL 1416 120.132 98.357 30.329 1.00 0.00 H ATOM 58189 C19 OL 1416 119.343 100.119 31.232 1.00 0.00 C ATOM 58190 H9R OL 1416 118.944 100.513 30.300 1.00 0.00 H ATOM 58191 C110 OL 1416 119.634 100.929 32.279 1.00 0.00 C ATOM 58192 H10R OL 1416 119.500 102.007 32.233 1.00 0.00 H ATOM 58193 C111 OL 1416 120.374 100.648 33.510 1.00 0.00 C ATOM 58194 H11R OL 1416 120.193 99.613 33.807 1.00 0.00 H ATOM 58195 H11S OL 1416 121.430 100.822 33.289 1.00 0.00 H ATOM 58196 C112 OL 1416 120.061 101.470 34.709 1.00 0.00 C ATOM 58197 H12R OL 1416 120.368 102.493 34.484 1.00 0.00 H ATOM 58198 H12S OL 1416 118.970 101.432 34.666 1.00 0.00 H ATOM 58199 C113 OL 1416 120.432 100.750 36.062 1.00 0.00 C ATOM 58200 H13R OL 1416 119.738 99.916 36.184 1.00 0.00 H ATOM 58201 H13S OL 1416 121.460 100.395 35.962 1.00 0.00 H ATOM 58202 C114 OL 1416 120.426 101.751 37.235 1.00 0.00 C ATOM 58203 H14R OL 1416 121.132 102.577 37.126 1.00 0.00 H ATOM 58204 H14S OL 1416 119.456 102.202 37.458 1.00 0.00 H ATOM 58205 C115 OL 1416 120.708 101.018 38.481 1.00 0.00 C ATOM 58206 H15R OL 1416 119.946 100.236 38.461 1.00 0.00 H ATOM 58207 H15S OL 1416 121.687 100.535 38.527 1.00 0.00 H ATOM 58208 C116 OL 1416 120.311 101.860 39.685 1.00 0.00 C ATOM 58209 H16R OL 1416 120.696 102.869 39.524 1.00 0.00 H ATOM 58210 H16S OL 1416 119.232 101.992 39.781 1.00 0.00 H ATOM 58211 C117 OL 1416 120.944 101.251 40.971 1.00 0.00 C ATOM 58212 H17R OL 1416 120.689 101.832 41.860 1.00 0.00 H ATOM 58213 H17S OL 1416 120.476 100.269 41.069 1.00 0.00 H ATOM 58214 C118 OL 1416 122.484 100.927 41.126 1.00 0.00 C ATOM 58215 H18R OL 1416 123.071 101.747 40.707 1.00 0.00 H ATOM 58216 H18S OL 1416 122.774 99.978 40.670 1.00 0.00 H ATOM 58217 H18T OL 1416 122.775 100.818 42.173 1.00 0.00 H TER 58218 OL 1416 ATOM 58218 C116 PA 1417 67.088 109.500 40.519 1.00 0.00 C ATOM 58219 H16R PA 1417 66.192 110.012 40.876 1.00 0.00 H ATOM 58220 H16S PA 1417 67.166 109.737 39.456 1.00 0.00 H ATOM 58221 H16T PA 1417 67.897 109.989 41.066 1.00 0.00 H ATOM 58222 C115 PA 1417 67.075 108.004 40.688 1.00 0.00 C ATOM 58223 H15R PA 1417 66.211 107.534 40.212 1.00 0.00 H ATOM 58224 H15S PA 1417 66.838 107.860 41.744 1.00 0.00 H ATOM 58225 C114 PA 1417 68.390 107.311 40.229 1.00 0.00 C ATOM 58226 H14R PA 1417 68.176 106.243 40.310 1.00 0.00 H ATOM 58227 H14S PA 1417 69.219 107.544 40.901 1.00 0.00 H ATOM 58228 C113 PA 1417 68.911 107.480 38.804 1.00 0.00 C ATOM 58229 H13R PA 1417 69.968 107.203 38.805 1.00 0.00 H ATOM 58230 H13S PA 1417 68.905 108.558 38.626 1.00 0.00 H ATOM 58231 C112 PA 1417 68.177 106.650 37.742 1.00 0.00 C ATOM 58232 H12R PA 1417 67.225 107.165 37.598 1.00 0.00 H ATOM 58233 H12S PA 1417 67.814 105.675 38.074 1.00 0.00 H ATOM 58234 C111 PA 1417 68.899 106.489 36.419 1.00 0.00 C ATOM 58235 H11R PA 1417 68.340 106.012 35.611 1.00 0.00 H ATOM 58236 H11S PA 1417 69.706 105.792 36.652 1.00 0.00 H ATOM 58237 C110 PA 1417 69.353 107.792 35.738 1.00 0.00 C ATOM 58238 H10R PA 1417 69.846 108.534 36.369 1.00 0.00 H ATOM 58239 H10S PA 1417 68.502 108.443 35.529 1.00 0.00 H ATOM 58240 C19 PA 1417 70.274 107.550 34.535 1.00 0.00 C ATOM 58241 H9R PA 1417 69.704 106.849 33.922 1.00 0.00 H ATOM 58242 H9S PA 1417 71.187 107.084 34.912 1.00 0.00 H ATOM 58243 C18 PA 1417 70.658 108.704 33.667 1.00 0.00 C ATOM 58244 H8R PA 1417 71.133 108.310 32.766 1.00 0.00 H ATOM 58245 H8S PA 1417 71.195 109.390 34.326 1.00 0.00 H ATOM 58246 C17 PA 1417 69.455 109.464 33.149 1.00 0.00 C ATOM 58247 H7R PA 1417 68.739 109.692 33.941 1.00 0.00 H ATOM 58248 H7S PA 1417 69.007 108.818 32.391 1.00 0.00 H ATOM 58249 C16 PA 1417 69.863 110.761 32.372 1.00 0.00 C ATOM 58250 H6R PA 1417 70.378 110.424 31.470 1.00 0.00 H ATOM 58251 H6S PA 1417 70.642 111.217 32.987 1.00 0.00 H ATOM 58252 C15 PA 1417 68.649 111.739 32.136 1.00 0.00 C ATOM 58253 H5R PA 1417 68.998 112.648 31.642 1.00 0.00 H ATOM 58254 H5S PA 1417 68.200 112.078 33.072 1.00 0.00 H ATOM 58255 C14 PA 1417 67.574 111.131 31.321 1.00 0.00 C ATOM 58256 H4R PA 1417 66.591 111.597 31.416 1.00 0.00 H ATOM 58257 H4S PA 1417 67.423 110.147 31.769 1.00 0.00 H ATOM 58258 C13 PA 1417 67.905 111.100 29.780 1.00 0.00 C ATOM 58259 H3R PA 1417 68.935 110.752 29.679 1.00 0.00 H ATOM 58260 H3S PA 1417 67.839 112.142 29.460 1.00 0.00 H ATOM 58261 C12 PA 1417 66.916 110.200 29.026 1.00 0.00 C ATOM 58262 H2R PA 1417 65.879 110.344 29.336 1.00 0.00 H ATOM 58263 H2S PA 1417 67.159 109.155 29.230 1.00 0.00 H ATOM 58264 C11 PC 1418 67.069 110.397 27.574 1.00 0.00 C ATOM 58265 O12 PC 1418 68.040 110.817 26.989 1.00 0.00 O ATOM 58266 O11 PC 1418 65.981 109.985 26.952 1.00 0.00 O ATOM 58267 C1 PC 1418 65.838 110.053 25.526 1.00 0.00 C ATOM 58268 HR PC 1418 65.940 111.101 25.231 1.00 0.00 H ATOM 58269 HS PC 1418 64.804 109.794 25.285 1.00 0.00 H ATOM 58270 C2 PC 1418 66.792 109.016 24.820 1.00 0.00 C ATOM 58271 HX PC 1418 67.828 109.111 25.154 1.00 0.00 H ATOM 58272 C3 PC 1418 66.752 109.079 23.233 1.00 0.00 C ATOM 58273 HA PC 1418 67.264 109.936 22.788 1.00 0.00 H ATOM 58274 HB PC 1418 65.684 108.925 23.058 1.00 0.00 H ATOM 58275 O31 PC 1418 67.283 107.968 22.563 1.00 0.00 O ATOM 58276 P31 PC 1418 67.493 107.977 20.994 1.00 0.00 P ATOM 58277 O32 PC 1418 66.044 108.003 20.400 1.00 0.00 O ATOM 58278 C31 PC 1418 65.218 106.901 20.644 1.00 0.00 C ATOM 58279 H1A PC 1418 64.826 107.063 21.651 1.00 0.00 H ATOM 58280 H1B PC 1418 65.717 105.932 20.728 1.00 0.00 H ATOM 58281 C32 PC 1418 63.982 106.820 19.742 1.00 0.00 C ATOM 58282 H2A PC 1418 63.471 107.778 19.636 1.00 0.00 H ATOM 58283 H2B PC 1418 63.356 106.127 20.305 1.00 0.00 H ATOM 58284 N31 PC 1418 64.114 106.257 18.309 1.00 0.00 N ATOM 58285 C33 PC 1418 62.914 106.714 17.617 1.00 0.00 C ATOM 58286 H3A PC 1418 62.082 106.342 18.216 1.00 0.00 H ATOM 58287 H3B PC 1418 62.827 106.297 16.613 1.00 0.00 H ATOM 58288 H3C PC 1418 62.951 107.804 17.598 1.00 0.00 H ATOM 58289 C34 PC 1418 65.345 106.724 17.666 1.00 0.00 C ATOM 58290 H4A PC 1418 65.463 107.802 17.783 1.00 0.00 H ATOM 58291 H4B PC 1418 65.332 106.489 16.601 1.00 0.00 H ATOM 58292 H4C PC 1418 66.152 106.105 18.061 1.00 0.00 H ATOM 58293 C35 PC 1418 64.190 104.774 18.400 1.00 0.00 C ATOM 58294 H5A PC 1418 64.013 104.402 17.390 1.00 0.00 H ATOM 58295 H5B PC 1418 63.498 104.331 19.118 1.00 0.00 H ATOM 58296 H5C PC 1418 65.221 104.496 18.625 1.00 0.00 H ATOM 58297 O33 PC 1418 68.099 109.298 20.628 1.00 0.00 O ATOM 58298 O34 PC 1418 68.134 106.732 20.583 1.00 0.00 O ATOM 58299 O21 PC 1418 66.296 107.716 25.131 1.00 0.00 O ATOM 58300 C21 PC 1418 66.731 107.121 26.257 1.00 0.00 C ATOM 58301 O22 PC 1418 67.684 107.538 26.914 1.00 0.00 O ATOM 58302 C12 OL 1419 65.949 105.935 26.621 1.00 0.00 C ATOM 58303 H2R OL 1419 65.359 105.738 25.724 1.00 0.00 H ATOM 58304 H2S OL 1419 66.659 105.109 26.696 1.00 0.00 H ATOM 58305 C13 OL 1419 65.123 106.222 27.925 1.00 0.00 C ATOM 58306 H3R OL 1419 64.699 105.285 28.292 1.00 0.00 H ATOM 58307 H3S OL 1419 65.826 106.586 28.677 1.00 0.00 H ATOM 58308 C14 OL 1419 63.943 107.152 27.622 1.00 0.00 C ATOM 58309 H4R OL 1419 64.335 108.142 27.380 1.00 0.00 H ATOM 58310 H4S OL 1419 63.409 106.799 26.738 1.00 0.00 H ATOM 58311 C15 OL 1419 63.050 107.475 28.788 1.00 0.00 C ATOM 58312 H5R OL 1419 63.012 106.615 29.460 1.00 0.00 H ATOM 58313 H5S OL 1419 63.643 108.289 29.208 1.00 0.00 H ATOM 58314 C16 OL 1419 61.562 107.782 28.426 1.00 0.00 C ATOM 58315 H6R OL 1419 61.640 108.632 27.745 1.00 0.00 H ATOM 58316 H6S OL 1419 61.301 106.942 27.780 1.00 0.00 H ATOM 58317 C17 OL 1419 60.771 108.097 29.706 1.00 0.00 C ATOM 58318 H7R OL 1419 60.727 107.281 30.431 1.00 0.00 H ATOM 58319 H7S OL 1419 61.201 108.923 30.276 1.00 0.00 H ATOM 58320 C18 OL 1419 59.394 108.538 29.479 1.00 0.00 C ATOM 58321 H8R OL 1419 58.923 108.580 30.463 1.00 0.00 H ATOM 58322 H8S OL 1419 59.316 109.577 29.152 1.00 0.00 H ATOM 58323 C19 OL 1419 58.582 107.643 28.646 1.00 0.00 C ATOM 58324 H9R OL 1419 58.768 107.779 27.584 1.00 0.00 H ATOM 58325 C110 OL 1419 57.517 106.894 29.035 1.00 0.00 C ATOM 58326 H10R OL 1419 56.848 106.498 28.276 1.00 0.00 H ATOM 58327 C111 OL 1419 57.012 106.597 30.418 1.00 0.00 C ATOM 58328 H11R OL 1419 56.585 105.592 30.423 1.00 0.00 H ATOM 58329 H11S OL 1419 57.865 106.590 31.099 1.00 0.00 H ATOM 58330 C112 OL 1419 56.108 107.762 30.799 1.00 0.00 C ATOM 58331 H12R OL 1419 56.497 108.734 30.491 1.00 0.00 H ATOM 58332 H12S OL 1419 55.118 107.558 30.384 1.00 0.00 H ATOM 58333 C113 OL 1419 55.906 107.957 32.347 1.00 0.00 C ATOM 58334 H13R OL 1419 55.583 107.076 32.905 1.00 0.00 H ATOM 58335 H13S OL 1419 56.826 108.362 32.775 1.00 0.00 H ATOM 58336 C114 OL 1419 54.809 109.014 32.558 1.00 0.00 C ATOM 58337 H14R OL 1419 55.094 110.040 32.315 1.00 0.00 H ATOM 58338 H14S OL 1419 54.012 108.786 31.848 1.00 0.00 H ATOM 58339 C115 OL 1419 54.198 109.008 33.901 1.00 0.00 C ATOM 58340 H15R OL 1419 53.770 108.009 34.003 1.00 0.00 H ATOM 58341 H15S OL 1419 55.054 109.125 34.569 1.00 0.00 H ATOM 58342 C116 OL 1419 53.046 109.938 34.170 1.00 0.00 C ATOM 58343 H16R OL 1419 53.320 110.982 34.006 1.00 0.00 H ATOM 58344 H16S OL 1419 52.320 109.616 33.421 1.00 0.00 H ATOM 58345 C117 OL 1419 52.518 110.034 35.584 1.00 0.00 C ATOM 58346 H17R OL 1419 52.249 109.059 35.994 1.00 0.00 H ATOM 58347 H17S OL 1419 53.267 110.292 36.336 1.00 0.00 H ATOM 58348 C118 OL 1419 51.314 110.921 35.740 1.00 0.00 C ATOM 58349 H18R OL 1419 50.725 110.695 36.631 1.00 0.00 H ATOM 58350 H18S OL 1419 50.578 110.719 34.959 1.00 0.00 H ATOM 58351 H18T OL 1419 51.518 111.994 35.712 1.00 0.00 H TER 58352 OL 1419 ATOM 58352 C116 PA 1420 32.102 107.300 39.992 1.00 0.00 C ATOM 58353 H16R PA 1420 31.550 106.751 39.227 1.00 0.00 H ATOM 58354 H16S PA 1420 32.066 108.333 39.640 1.00 0.00 H ATOM 58355 H16T PA 1420 31.492 107.176 40.889 1.00 0.00 H ATOM 58356 C115 PA 1420 33.599 106.943 40.115 1.00 0.00 C ATOM 58357 H15R PA 1420 34.144 107.756 40.599 1.00 0.00 H ATOM 58358 H15S PA 1420 34.112 107.076 39.160 1.00 0.00 H ATOM 58359 C114 PA 1420 33.758 105.606 40.809 1.00 0.00 C ATOM 58360 H14R PA 1420 33.165 104.857 40.280 1.00 0.00 H ATOM 58361 H14S PA 1420 33.369 105.715 41.824 1.00 0.00 H ATOM 58362 C113 PA 1420 35.183 104.999 40.904 1.00 0.00 C ATOM 58363 H13R PA 1420 35.735 105.654 41.581 1.00 0.00 H ATOM 58364 H13S PA 1420 35.601 105.073 39.898 1.00 0.00 H ATOM 58365 C112 PA 1420 35.183 103.611 41.428 1.00 0.00 C ATOM 58366 H12R PA 1420 35.077 103.619 42.515 1.00 0.00 H ATOM 58367 H12S PA 1420 36.161 103.176 41.209 1.00 0.00 H ATOM 58368 C111 PA 1420 34.212 102.553 40.912 1.00 0.00 C ATOM 58369 H11R PA 1420 34.238 102.467 39.824 1.00 0.00 H ATOM 58370 H11S PA 1420 33.231 102.866 41.279 1.00 0.00 H ATOM 58371 C110 PA 1420 34.657 101.136 41.484 1.00 0.00 C ATOM 58372 H10R PA 1420 34.465 101.109 42.559 1.00 0.00 H ATOM 58373 H10S PA 1420 35.742 101.029 41.550 1.00 0.00 H ATOM 58374 C19 PA 1420 33.812 99.981 40.865 1.00 0.00 C ATOM 58375 H9R PA 1420 32.752 100.190 41.026 1.00 0.00 H ATOM 58376 H9S PA 1420 34.042 99.015 41.318 1.00 0.00 H ATOM 58377 C18 PA 1420 34.209 99.634 39.454 1.00 0.00 C ATOM 58378 H8R PA 1420 35.265 99.363 39.387 1.00 0.00 H ATOM 58379 H8S PA 1420 34.029 100.428 38.727 1.00 0.00 H ATOM 58380 C17 PA 1420 33.378 98.424 38.956 1.00 0.00 C ATOM 58381 H7R PA 1420 32.341 98.541 39.275 1.00 0.00 H ATOM 58382 H7S PA 1420 33.763 97.511 39.415 1.00 0.00 H ATOM 58383 C16 PA 1420 33.305 98.209 37.365 1.00 0.00 C ATOM 58384 H6R PA 1420 32.704 97.321 37.161 1.00 0.00 H ATOM 58385 H6S PA 1420 34.292 97.995 36.949 1.00 0.00 H ATOM 58386 C15 PA 1420 32.821 99.386 36.505 1.00 0.00 C ATOM 58387 H5R PA 1420 33.455 100.263 36.354 1.00 0.00 H ATOM 58388 H5S PA 1420 31.859 99.759 36.862 1.00 0.00 H ATOM 58389 C14 PA 1420 32.627 98.977 35.056 1.00 0.00 C ATOM 58390 H4R PA 1420 31.845 98.216 35.085 1.00 0.00 H ATOM 58391 H4S PA 1420 33.601 98.662 34.675 1.00 0.00 H ATOM 58392 C13 PA 1420 32.171 100.091 34.115 1.00 0.00 C ATOM 58393 H3R PA 1420 32.823 100.945 34.307 1.00 0.00 H ATOM 58394 H3S PA 1420 31.172 100.404 34.424 1.00 0.00 H ATOM 58395 C12 PA 1420 32.254 99.704 32.714 1.00 0.00 C ATOM 58396 H2R PA 1420 31.818 98.706 32.636 1.00 0.00 H ATOM 58397 H2S PA 1420 33.322 99.592 32.519 1.00 0.00 H ATOM 58398 C11 PGR 1421 31.627 100.778 31.787 1.00 0.00 C ATOM 58399 O12 PGR 1421 30.783 100.494 30.934 1.00 0.00 O ATOM 58400 O11 PGR 1421 32.108 101.963 32.091 1.00 0.00 O ATOM 58401 C1 PGR 1421 31.598 103.086 31.312 1.00 0.00 C ATOM 58402 HR PGR 1421 31.802 102.886 30.257 1.00 0.00 H ATOM 58403 HS PGR 1421 32.176 103.961 31.619 1.00 0.00 H ATOM 58404 C2 PGR 1421 30.168 103.529 31.716 1.00 0.00 C ATOM 58405 HX PGR 1421 29.494 102.672 31.777 1.00 0.00 H ATOM 58406 C3 PGR 1421 29.667 104.307 30.493 1.00 0.00 C ATOM 58407 HA PGR 1421 28.619 104.608 30.572 1.00 0.00 H ATOM 58408 HB PGR 1421 29.802 103.613 29.659 1.00 0.00 H ATOM 58409 O31 PGR 1421 30.351 105.509 30.199 1.00 0.00 O ATOM 58410 P31 PGR 1421 30.069 106.205 28.753 1.00 0.00 P ATOM 58411 O32 PGR 1421 28.726 107.030 28.970 1.00 0.00 O ATOM 58412 C31 PGR 1421 28.893 108.277 29.695 1.00 0.00 C ATOM 58413 H1A PGR 1421 29.610 108.941 29.205 1.00 0.00 H ATOM 58414 H1B PGR 1421 29.347 108.025 30.657 1.00 0.00 H ATOM 58415 C32 PGR 1421 27.583 109.025 30.042 1.00 0.00 C ATOM 58416 H2A PGR 1421 26.765 108.353 30.315 1.00 0.00 H ATOM 58417 O35 PGR 1421 27.142 109.909 29.014 1.00 0.00 O ATOM 58418 HO5A PGR 1421 26.908 109.489 28.166 1.00 0.00 H ATOM 58419 C33 PGR 1421 27.805 110.025 31.200 1.00 0.00 C ATOM 58420 H3A PGR 1421 26.889 110.544 31.494 1.00 0.00 H ATOM 58421 H3B PGR 1421 28.071 109.453 32.092 1.00 0.00 H ATOM 58422 O33 PGR 1421 31.152 107.048 28.330 1.00 0.00 O ATOM 58423 O34 PGR 1421 29.621 105.077 27.909 1.00 0.00 O ATOM 58424 O21 PGR 1421 30.228 104.418 32.861 1.00 0.00 O ATOM 58425 C21 PGR 1421 29.227 105.258 33.212 1.00 0.00 C ATOM 58426 O22 PGR 1421 28.159 105.262 32.705 1.00 0.00 O ATOM 58427 O36 PGR 1421 28.849 110.917 30.949 1.00 0.00 O ATOM 58428 HO6A PGR 1421 28.649 111.422 30.141 1.00 0.00 H ATOM 58429 C12 OL 1422 29.780 106.309 34.153 1.00 0.00 C ATOM 58430 H2R OL 1422 30.254 105.828 35.010 1.00 0.00 H ATOM 58431 H2S OL 1422 30.621 106.739 33.605 1.00 0.00 H ATOM 58432 C13 OL 1422 28.584 107.163 34.625 1.00 0.00 C ATOM 58433 H3R OL 1422 28.176 107.787 33.827 1.00 0.00 H ATOM 58434 H3S OL 1422 27.834 106.445 34.963 1.00 0.00 H ATOM 58435 C14 OL 1422 28.909 108.070 35.813 1.00 0.00 C ATOM 58436 H4R OL 1422 29.306 107.466 36.632 1.00 0.00 H ATOM 58437 H4S OL 1422 29.596 108.851 35.481 1.00 0.00 H ATOM 58438 C15 OL 1422 27.662 108.739 36.497 1.00 0.00 C ATOM 58439 H5R OL 1422 26.987 107.951 36.839 1.00 0.00 H ATOM 58440 H5S OL 1422 27.988 109.263 37.398 1.00 0.00 H ATOM 58441 C16 OL 1422 26.891 109.781 35.755 1.00 0.00 C ATOM 58442 H6R OL 1422 26.718 110.625 36.426 1.00 0.00 H ATOM 58443 H6S OL 1422 27.457 110.212 34.927 1.00 0.00 H ATOM 58444 C17 OL 1422 25.636 109.184 35.212 1.00 0.00 C ATOM 58445 H7R OL 1422 25.917 108.262 34.698 1.00 0.00 H ATOM 58446 H7S OL 1422 24.914 108.971 36.002 1.00 0.00 H ATOM 58447 C18 OL 1422 24.961 110.067 34.198 1.00 0.00 C ATOM 58448 H8R OL 1422 25.634 110.159 33.342 1.00 0.00 H ATOM 58449 H8S OL 1422 24.005 109.709 33.811 1.00 0.00 H ATOM 58450 C19 OL 1422 24.729 111.458 34.714 1.00 0.00 C ATOM 58451 H9R OL 1422 23.796 111.486 35.271 1.00 0.00 H ATOM 58452 C110 OL 1422 25.185 112.647 34.290 1.00 0.00 C ATOM 58453 H10R OL 1422 24.672 113.547 34.619 1.00 0.00 H ATOM 58454 C111 OL 1422 26.272 112.893 33.322 1.00 0.00 C ATOM 58455 H11R OL 1422 27.040 113.555 33.728 1.00 0.00 H ATOM 58456 H11S OL 1422 26.923 112.018 33.275 1.00 0.00 H ATOM 58457 C112 OL 1422 25.821 113.479 31.988 1.00 0.00 C ATOM 58458 H12R OL 1422 25.123 114.291 32.202 1.00 0.00 H ATOM 58459 H12S OL 1422 26.626 113.964 31.432 1.00 0.00 H ATOM 58460 C113 OL 1422 25.059 112.546 31.095 1.00 0.00 C ATOM 58461 H13R OL 1422 25.605 112.099 30.262 1.00 0.00 H ATOM 58462 H13S OL 1422 24.850 111.650 31.684 1.00 0.00 H ATOM 58463 C114 OL 1422 23.826 113.248 30.428 1.00 0.00 C ATOM 58464 H14R OL 1422 23.408 114.100 30.968 1.00 0.00 H ATOM 58465 H14S OL 1422 24.295 113.784 29.601 1.00 0.00 H ATOM 58466 C115 OL 1422 22.695 112.338 29.965 1.00 0.00 C ATOM 58467 H15R OL 1422 23.209 111.463 29.562 1.00 0.00 H ATOM 58468 H15S OL 1422 22.106 111.877 30.760 1.00 0.00 H ATOM 58469 C116 OL 1422 21.789 112.976 28.980 1.00 0.00 C ATOM 58470 H16R OL 1422 21.314 113.911 29.283 1.00 0.00 H ATOM 58471 H16S OL 1422 22.429 113.095 28.103 1.00 0.00 H ATOM 58472 C117 OL 1422 20.692 112.024 28.505 1.00 0.00 C ATOM 58473 H17R OL 1422 21.060 110.999 28.431 1.00 0.00 H ATOM 58474 H17S OL 1422 19.872 112.032 29.226 1.00 0.00 H ATOM 58475 C118 OL 1422 20.246 112.336 27.143 1.00 0.00 C ATOM 58476 H18R OL 1422 19.559 111.636 26.662 1.00 0.00 H ATOM 58477 H18S OL 1422 21.143 112.486 26.539 1.00 0.00 H ATOM 58478 H18T OL 1422 19.621 113.231 27.090 1.00 0.00 H TER 58479 OL 1422 ATOM 58479 C116 PA 1423 13.114 86.632 34.841 1.00 0.00 C ATOM 58480 H16R PA 1423 14.156 86.527 35.148 1.00 0.00 H ATOM 58481 H16S PA 1423 12.904 87.702 34.894 1.00 0.00 H ATOM 58482 H16T PA 1423 13.082 86.396 33.776 1.00 0.00 H ATOM 58483 C115 PA 1423 12.055 85.833 35.639 1.00 0.00 C ATOM 58484 H15R PA 1423 11.065 85.758 35.183 1.00 0.00 H ATOM 58485 H15S PA 1423 11.973 86.301 36.622 1.00 0.00 H ATOM 58486 C114 PA 1423 12.539 84.383 35.801 1.00 0.00 C ATOM 58487 H14R PA 1423 13.574 84.285 36.138 1.00 0.00 H ATOM 58488 H14S PA 1423 12.408 83.973 34.797 1.00 0.00 H ATOM 58489 C113 PA 1423 11.492 83.603 36.600 1.00 0.00 C ATOM 58490 H13R PA 1423 10.560 83.964 36.159 1.00 0.00 H ATOM 58491 H13S PA 1423 11.418 83.765 37.677 1.00 0.00 H ATOM 58492 C112 PA 1423 11.739 82.099 36.508 1.00 0.00 C ATOM 58493 H12R PA 1423 11.345 81.697 35.573 1.00 0.00 H ATOM 58494 H12S PA 1423 11.190 81.647 37.337 1.00 0.00 H ATOM 58495 C111 PA 1423 13.191 81.718 36.727 1.00 0.00 C ATOM 58496 H11R PA 1423 13.609 82.116 37.654 1.00 0.00 H ATOM 58497 H11S PA 1423 13.844 82.021 35.906 1.00 0.00 H ATOM 58498 C110 PA 1423 13.189 80.172 36.605 1.00 0.00 C ATOM 58499 H10R PA 1423 12.593 79.822 35.760 1.00 0.00 H ATOM 58500 H10S PA 1423 12.761 79.718 37.501 1.00 0.00 H ATOM 58501 C19 PA 1423 14.590 79.644 36.580 1.00 0.00 C ATOM 58502 H9R PA 1423 14.608 78.571 36.375 1.00 0.00 H ATOM 58503 H9S PA 1423 15.066 79.721 37.560 1.00 0.00 H ATOM 58504 C18 PA 1423 15.672 80.138 35.648 1.00 0.00 C ATOM 58505 H8R PA 1423 16.625 79.754 36.018 1.00 0.00 H ATOM 58506 H8S PA 1423 15.679 81.225 35.750 1.00 0.00 H ATOM 58507 C17 PA 1423 15.580 79.849 34.143 1.00 0.00 C ATOM 58508 H7R PA 1423 14.569 79.546 33.864 1.00 0.00 H ATOM 58509 H7S PA 1423 16.203 78.991 33.884 1.00 0.00 H ATOM 58510 C16 PA 1423 15.950 81.088 33.266 1.00 0.00 C ATOM 58511 H6R PA 1423 16.379 80.743 32.323 1.00 0.00 H ATOM 58512 H6S PA 1423 16.826 81.447 33.810 1.00 0.00 H ATOM 58513 C15 PA 1423 14.810 81.973 32.872 1.00 0.00 C ATOM 58514 H5R PA 1423 14.179 82.145 33.746 1.00 0.00 H ATOM 58515 H5S PA 1423 14.192 81.357 32.215 1.00 0.00 H ATOM 58516 C14 PA 1423 15.125 83.263 32.102 1.00 0.00 C ATOM 58517 H4R PA 1423 14.228 83.885 32.130 1.00 0.00 H ATOM 58518 H4S PA 1423 15.328 83.147 31.036 1.00 0.00 H ATOM 58519 C13 PA 1423 16.302 84.091 32.549 1.00 0.00 C ATOM 58520 H3R PA 1423 17.289 83.637 32.437 1.00 0.00 H ATOM 58521 H3S PA 1423 16.142 84.276 33.613 1.00 0.00 H ATOM 58522 C12 PA 1423 16.220 85.455 31.843 1.00 0.00 C ATOM 58523 H2R PA 1423 16.771 86.190 32.434 1.00 0.00 H ATOM 58524 H2S PA 1423 15.210 85.808 31.625 1.00 0.00 H ATOM 58525 C11 PC 1424 16.813 85.434 30.431 1.00 0.00 C ATOM 58526 O12 PC 1424 16.219 84.905 29.458 1.00 0.00 O ATOM 58527 O11 PC 1424 17.940 86.191 30.403 1.00 0.00 O ATOM 58528 C1 PC 1424 18.546 86.456 29.102 1.00 0.00 C ATOM 58529 HR PC 1424 18.077 85.878 28.302 1.00 0.00 H ATOM 58530 HS PC 1424 19.599 86.188 28.983 1.00 0.00 H ATOM 58531 C2 PC 1424 18.254 87.966 28.753 1.00 0.00 C ATOM 58532 HX PC 1424 17.235 88.184 29.081 1.00 0.00 H ATOM 58533 C3 PC 1424 18.276 88.283 27.191 1.00 0.00 C ATOM 58534 HA PC 1424 19.228 88.727 26.889 1.00 0.00 H ATOM 58535 HB PC 1424 17.532 88.990 26.815 1.00 0.00 H ATOM 58536 O31 PC 1424 18.120 87.085 26.461 1.00 0.00 O ATOM 58537 P31 PC 1424 18.541 87.060 24.971 1.00 0.00 P ATOM 58538 O32 PC 1424 17.509 88.109 24.265 1.00 0.00 O ATOM 58539 C31 PC 1424 16.218 87.665 23.887 1.00 0.00 C ATOM 58540 H1A PC 1424 15.516 87.572 24.719 1.00 0.00 H ATOM 58541 H1B PC 1424 16.314 86.716 23.353 1.00 0.00 H ATOM 58542 C32 PC 1424 15.567 88.713 22.884 1.00 0.00 C ATOM 58543 H2A PC 1424 15.619 89.707 23.331 1.00 0.00 H ATOM 58544 H2B PC 1424 14.501 88.713 22.655 1.00 0.00 H ATOM 58545 N31 PC 1424 16.137 88.877 21.499 1.00 0.00 N ATOM 58546 C33 PC 1424 15.484 90.030 20.759 1.00 0.00 C ATOM 58547 H3A PC 1424 15.602 90.992 21.261 1.00 0.00 H ATOM 58548 H3B PC 1424 14.444 89.884 20.463 1.00 0.00 H ATOM 58549 H3C PC 1424 16.084 90.033 19.849 1.00 0.00 H ATOM 58550 C34 PC 1424 17.563 89.102 21.503 1.00 0.00 C ATOM 58551 H4A PC 1424 17.738 90.117 21.862 1.00 0.00 H ATOM 58552 H4B PC 1424 17.958 88.958 20.496 1.00 0.00 H ATOM 58553 H4C PC 1424 17.942 88.466 22.304 1.00 0.00 H ATOM 58554 C35 PC 1424 15.850 87.697 20.664 1.00 0.00 C ATOM 58555 H5A PC 1424 16.070 87.937 19.622 1.00 0.00 H ATOM 58556 H5B PC 1424 14.803 87.426 20.800 1.00 0.00 H ATOM 58557 H5C PC 1424 16.447 86.851 21.007 1.00 0.00 H ATOM 58558 O33 PC 1424 19.898 87.669 24.877 1.00 0.00 O ATOM 58559 O34 PC 1424 18.324 85.737 24.419 1.00 0.00 O ATOM 58560 O21 PC 1424 19.190 88.757 29.459 1.00 0.00 O ATOM 58561 C21 PC 1424 19.223 90.165 29.453 1.00 0.00 C ATOM 58562 O22 PC 1424 18.272 90.743 29.002 1.00 0.00 O ATOM 58563 C12 OL 1425 20.406 90.715 30.207 1.00 0.00 C ATOM 58564 H2R OL 1425 21.127 89.894 30.194 1.00 0.00 H ATOM 58565 H2S OL 1425 20.948 91.423 29.578 1.00 0.00 H ATOM 58566 C13 OL 1425 19.867 91.062 31.623 1.00 0.00 C ATOM 58567 H3R OL 1425 19.097 91.833 31.554 1.00 0.00 H ATOM 58568 H3S OL 1425 19.440 90.118 31.969 1.00 0.00 H ATOM 58569 C14 OL 1425 20.857 91.441 32.700 1.00 0.00 C ATOM 58570 H4R OL 1425 20.324 91.700 33.617 1.00 0.00 H ATOM 58571 H4S OL 1425 21.677 90.740 32.873 1.00 0.00 H ATOM 58572 C15 OL 1425 21.576 92.737 32.321 1.00 0.00 C ATOM 58573 H5R OL 1425 22.291 92.991 33.106 1.00 0.00 H ATOM 58574 H5S OL 1425 22.187 92.550 31.436 1.00 0.00 H ATOM 58575 C16 OL 1425 20.756 93.960 31.984 1.00 0.00 C ATOM 58576 H6R OL 1425 21.501 94.717 31.728 1.00 0.00 H ATOM 58577 H6S OL 1425 20.246 93.649 31.070 1.00 0.00 H ATOM 58578 C17 OL 1425 19.761 94.552 33.046 1.00 0.00 C ATOM 58579 H7R OL 1425 18.950 93.887 33.349 1.00 0.00 H ATOM 58580 H7S OL 1425 20.325 94.633 33.977 1.00 0.00 H ATOM 58581 C18 OL 1425 19.371 95.975 32.797 1.00 0.00 C ATOM 58582 H8R OL 1425 20.281 96.577 32.787 1.00 0.00 H ATOM 58583 H8S OL 1425 18.860 96.181 31.854 1.00 0.00 H ATOM 58584 C19 OL 1425 18.535 96.456 33.921 1.00 0.00 C ATOM 58585 H9R OL 1425 17.514 96.091 33.994 1.00 0.00 H ATOM 58586 C110 OL 1425 19.060 97.137 34.975 1.00 0.00 C ATOM 58587 H10R OL 1425 18.376 97.388 35.782 1.00 0.00 H ATOM 58588 C111 OL 1425 20.487 97.534 35.189 1.00 0.00 C ATOM 58589 H11R OL 1425 21.055 96.602 35.156 1.00 0.00 H ATOM 58590 H11S OL 1425 20.922 98.197 34.438 1.00 0.00 H ATOM 58591 C112 OL 1425 20.684 98.345 36.516 1.00 0.00 C ATOM 58592 H12R OL 1425 20.522 97.621 37.317 1.00 0.00 H ATOM 58593 H12S OL 1425 21.772 98.431 36.477 1.00 0.00 H ATOM 58594 C113 OL 1425 19.917 99.635 36.679 1.00 0.00 C ATOM 58595 H13R OL 1425 20.075 100.216 35.768 1.00 0.00 H ATOM 58596 H13S OL 1425 18.827 99.602 36.740 1.00 0.00 H ATOM 58597 C114 OL 1425 20.517 100.395 37.802 1.00 0.00 C ATOM 58598 H14R OL 1425 21.598 100.326 37.934 1.00 0.00 H ATOM 58599 H14S OL 1425 20.272 101.445 37.624 1.00 0.00 H ATOM 58600 C115 OL 1425 20.012 99.931 39.177 1.00 0.00 C ATOM 58601 H15R OL 1425 18.932 99.775 39.143 1.00 0.00 H ATOM 58602 H15S OL 1425 20.402 98.927 39.357 1.00 0.00 H ATOM 58603 C116 OL 1425 20.371 100.959 40.241 1.00 0.00 C ATOM 58604 H16R OL 1425 21.457 101.044 40.310 1.00 0.00 H ATOM 58605 H16S OL 1425 20.058 101.965 39.951 1.00 0.00 H ATOM 58606 C117 OL 1425 19.760 100.656 41.635 1.00 0.00 C ATOM 58607 H17R OL 1425 18.743 101.044 41.557 1.00 0.00 H ATOM 58608 H17S OL 1425 19.639 99.576 41.742 1.00 0.00 H ATOM 58609 C118 OL 1425 20.344 101.302 42.937 1.00 0.00 C ATOM 58610 H18R OL 1425 21.419 101.210 43.107 1.00 0.00 H ATOM 58611 H18S OL 1425 19.807 100.889 43.794 1.00 0.00 H ATOM 58612 H18T OL 1425 20.120 102.370 42.967 1.00 0.00 H TER 58613 OL 1425 ATOM 58613 C116 PA 1426 25.125 60.375 42.376 1.00 0.00 C ATOM 58614 H16R PA 1426 24.683 60.993 43.160 1.00 0.00 H ATOM 58615 H16S PA 1426 26.195 60.539 42.518 1.00 0.00 H ATOM 58616 H16T PA 1426 24.944 59.311 42.539 1.00 0.00 H ATOM 58617 C115 PA 1426 24.617 60.795 40.982 1.00 0.00 C ATOM 58618 H15R PA 1426 24.796 61.872 40.979 1.00 0.00 H ATOM 58619 H15S PA 1426 23.543 60.613 40.903 1.00 0.00 H ATOM 58620 C114 PA 1426 25.172 60.141 39.805 1.00 0.00 C ATOM 58621 H14R PA 1426 24.856 59.096 39.826 1.00 0.00 H ATOM 58622 H14S PA 1426 26.261 60.206 39.760 1.00 0.00 H ATOM 58623 C113 PA 1426 24.643 60.774 38.500 1.00 0.00 C ATOM 58624 H13R PA 1426 23.560 60.879 38.408 1.00 0.00 H ATOM 58625 H13S PA 1426 24.923 60.023 37.757 1.00 0.00 H ATOM 58626 C112 PA 1426 25.399 62.037 38.101 1.00 0.00 C ATOM 58627 H12R PA 1426 26.458 61.774 38.084 1.00 0.00 H ATOM 58628 H12S PA 1426 25.415 62.929 38.732 1.00 0.00 H ATOM 58629 C111 PA 1426 25.004 62.502 36.677 1.00 0.00 C ATOM 58630 H11R PA 1426 23.931 62.708 36.657 1.00 0.00 H ATOM 58631 H11S PA 1426 25.297 61.652 36.058 1.00 0.00 H ATOM 58632 C110 PA 1426 25.737 63.790 36.282 1.00 0.00 C ATOM 58633 H10R PA 1426 26.782 63.586 36.528 1.00 0.00 H ATOM 58634 H10S PA 1426 25.521 64.655 36.913 1.00 0.00 H ATOM 58635 C19 PA 1426 25.499 64.081 34.909 1.00 0.00 C ATOM 58636 H9R PA 1426 24.407 64.046 34.884 1.00 0.00 H ATOM 58637 H9S PA 1426 25.876 63.260 34.297 1.00 0.00 H ATOM 58638 C18 PA 1426 26.107 65.398 34.404 1.00 0.00 C ATOM 58639 H8R PA 1426 27.191 65.400 34.533 1.00 0.00 H ATOM 58640 H8S PA 1426 25.766 66.124 35.145 1.00 0.00 H ATOM 58641 C17 PA 1426 25.773 65.686 32.867 1.00 0.00 C ATOM 58642 H7R PA 1426 26.367 66.493 32.433 1.00 0.00 H ATOM 58643 H7S PA 1426 24.762 66.090 32.779 1.00 0.00 H ATOM 58644 C16 PA 1426 25.989 64.478 31.907 1.00 0.00 C ATOM 58645 H6R PA 1426 25.318 63.715 32.308 1.00 0.00 H ATOM 58646 H6S PA 1426 27.027 64.182 32.071 1.00 0.00 H ATOM 58647 C15 PA 1426 25.870 64.696 30.341 1.00 0.00 C ATOM 58648 H5R PA 1426 26.314 64.002 29.625 1.00 0.00 H ATOM 58649 H5S PA 1426 26.426 65.619 30.167 1.00 0.00 H ATOM 58650 C14 PA 1426 24.404 64.934 30.018 1.00 0.00 C ATOM 58651 H4R PA 1426 23.922 65.638 30.698 1.00 0.00 H ATOM 58652 H4S PA 1426 23.892 63.994 30.234 1.00 0.00 H ATOM 58653 C13 PA 1426 23.989 65.445 28.626 1.00 0.00 C ATOM 58654 H3R PA 1426 24.768 66.179 28.409 1.00 0.00 H ATOM 58655 H3S PA 1426 23.059 66.018 28.598 1.00 0.00 H ATOM 58656 C12 PA 1426 23.863 64.406 27.522 1.00 0.00 C ATOM 58657 H2R PA 1426 24.648 63.653 27.421 1.00 0.00 H ATOM 58658 H2S PA 1426 22.986 63.837 27.838 1.00 0.00 H ATOM 58659 C11 PGR 1427 23.807 65.111 26.143 1.00 0.00 C ATOM 58660 O12 PGR 1427 23.482 64.494 25.129 1.00 0.00 O ATOM 58661 O11 PGR 1427 24.132 66.435 26.144 1.00 0.00 O ATOM 58662 C1 PGR 1427 24.266 67.264 24.934 1.00 0.00 C ATOM 58663 HR PGR 1427 24.601 66.562 24.166 1.00 0.00 H ATOM 58664 HS PGR 1427 24.973 68.091 25.043 1.00 0.00 H ATOM 58665 C2 PGR 1427 22.916 67.753 24.515 1.00 0.00 C ATOM 58666 HX PGR 1427 22.165 66.972 24.659 1.00 0.00 H ATOM 58667 C3 PGR 1427 22.921 68.242 23.049 1.00 0.00 C ATOM 58668 HA PGR 1427 21.961 68.557 22.630 1.00 0.00 H ATOM 58669 HB PGR 1427 23.259 67.377 22.473 1.00 0.00 H ATOM 58670 O31 PGR 1427 23.871 69.303 22.950 1.00 0.00 O ATOM 58671 P31 PGR 1427 24.067 70.083 21.514 1.00 0.00 P ATOM 58672 O32 PGR 1427 24.344 68.896 20.561 1.00 0.00 O ATOM 58673 C31 PGR 1427 23.536 68.603 19.410 1.00 0.00 C ATOM 58674 H1A PGR 1427 23.614 69.438 18.709 1.00 0.00 H ATOM 58675 H1B PGR 1427 22.499 68.538 19.751 1.00 0.00 H ATOM 58676 C32 PGR 1427 24.114 67.379 18.726 1.00 0.00 C ATOM 58677 H2A PGR 1427 23.515 67.186 17.832 1.00 0.00 H ATOM 58678 O35 PGR 1427 23.860 66.246 19.508 1.00 0.00 O ATOM 58679 HO5A PGR 1427 24.396 66.305 20.320 1.00 0.00 H ATOM 58680 C33 PGR 1427 25.581 67.461 18.339 1.00 0.00 C ATOM 58681 H3A PGR 1427 25.854 68.373 17.804 1.00 0.00 H ATOM 58682 H3B PGR 1427 26.167 67.454 19.262 1.00 0.00 H ATOM 58683 O33 PGR 1427 22.785 70.777 21.181 1.00 0.00 O ATOM 58684 O34 PGR 1427 25.268 70.924 21.698 1.00 0.00 O ATOM 58685 O21 PGR 1427 22.597 68.881 25.394 1.00 0.00 O ATOM 58686 C21 PGR 1427 21.371 69.282 25.543 1.00 0.00 C ATOM 58687 O22 PGR 1427 20.495 68.759 24.893 1.00 0.00 O ATOM 58688 O36 PGR 1427 25.822 66.332 17.542 1.00 0.00 O ATOM 58689 HO6A PGR 1427 26.781 66.276 17.385 1.00 0.00 H ATOM 58690 C12 OL 1428 21.173 70.449 26.457 1.00 0.00 C ATOM 58691 H2R OL 1428 22.127 70.751 26.895 1.00 0.00 H ATOM 58692 H2S OL 1428 20.807 71.300 25.879 1.00 0.00 H ATOM 58693 C13 OL 1428 20.105 70.159 27.451 1.00 0.00 C ATOM 58694 H3R OL 1428 19.070 70.309 27.138 1.00 0.00 H ATOM 58695 H3S OL 1428 20.222 69.176 27.913 1.00 0.00 H ATOM 58696 C14 OL 1428 20.091 71.254 28.489 1.00 0.00 C ATOM 58697 H4R OL 1428 21.108 71.526 28.778 1.00 0.00 H ATOM 58698 H4S OL 1428 19.756 72.091 27.873 1.00 0.00 H ATOM 58699 C15 OL 1428 19.234 70.918 29.681 1.00 0.00 C ATOM 58700 H5R OL 1428 18.160 70.918 29.483 1.00 0.00 H ATOM 58701 H5S OL 1428 19.330 69.892 30.041 1.00 0.00 H ATOM 58702 C16 OL 1428 19.504 71.915 30.805 1.00 0.00 C ATOM 58703 H6R OL 1428 20.501 71.666 31.174 1.00 0.00 H ATOM 58704 H6S OL 1428 19.550 72.912 30.363 1.00 0.00 H ATOM 58705 C17 OL 1428 18.570 71.854 31.952 1.00 0.00 C ATOM 58706 H7R OL 1428 17.518 71.704 31.701 1.00 0.00 H ATOM 58707 H7S OL 1428 18.851 71.025 32.604 1.00 0.00 H ATOM 58708 C18 OL 1428 18.719 73.137 32.862 1.00 0.00 C ATOM 58709 H8R OL 1428 19.707 72.938 33.281 1.00 0.00 H ATOM 58710 H8S OL 1428 18.818 74.133 32.426 1.00 0.00 H ATOM 58711 C19 OL 1428 17.633 73.122 33.877 1.00 0.00 C ATOM 58712 H9R OL 1428 16.803 72.448 33.678 1.00 0.00 H ATOM 58713 C110 OL 1428 17.715 73.675 35.099 1.00 0.00 C ATOM 58714 H10R OL 1428 16.921 73.504 35.822 1.00 0.00 H ATOM 58715 C111 OL 1428 18.726 74.589 35.651 1.00 0.00 C ATOM 58716 H11R OL 1428 19.205 75.053 34.786 1.00 0.00 H ATOM 58717 H11S OL 1428 18.245 75.380 36.230 1.00 0.00 H ATOM 58718 C112 OL 1428 19.795 73.810 36.527 1.00 0.00 C ATOM 58719 H12R OL 1428 19.270 73.747 37.482 1.00 0.00 H ATOM 58720 H12S OL 1428 19.962 72.751 36.321 1.00 0.00 H ATOM 58721 C113 OL 1428 21.123 74.537 36.619 1.00 0.00 C ATOM 58722 H13R OL 1428 21.383 74.958 35.646 1.00 0.00 H ATOM 58723 H13S OL 1428 21.005 75.442 37.219 1.00 0.00 H ATOM 58724 C114 OL 1428 22.263 73.679 37.193 1.00 0.00 C ATOM 58725 H14R OL 1428 21.998 73.088 38.072 1.00 0.00 H ATOM 58726 H14S OL 1428 22.637 72.956 36.465 1.00 0.00 H ATOM 58727 C115 OL 1428 23.433 74.506 37.566 1.00 0.00 C ATOM 58728 H15R OL 1428 24.360 73.971 37.347 1.00 0.00 H ATOM 58729 H15S OL 1428 23.495 75.419 36.969 1.00 0.00 H ATOM 58730 C116 OL 1428 23.508 74.887 39.053 1.00 0.00 C ATOM 58731 H16R OL 1428 22.575 75.377 39.336 1.00 0.00 H ATOM 58732 H16S OL 1428 23.588 73.998 39.681 1.00 0.00 H ATOM 58733 C117 OL 1428 24.574 75.938 39.463 1.00 0.00 C ATOM 58734 H17R OL 1428 24.342 76.160 40.506 1.00 0.00 H ATOM 58735 H17S OL 1428 25.552 75.454 39.512 1.00 0.00 H ATOM 58736 C118 OL 1428 24.568 77.155 38.647 1.00 0.00 C ATOM 58737 H18R OL 1428 25.080 77.992 39.126 1.00 0.00 H ATOM 58738 H18S OL 1428 23.522 77.421 38.479 1.00 0.00 H ATOM 58739 H18T OL 1428 25.139 77.054 37.722 1.00 0.00 H TER 58740 OL 1428 ATOM 58740 C116 PA 1429 2.684 128.311 33.208 1.00 0.00 C ATOM 58741 H16R PA 1429 2.607 128.916 34.114 1.00 0.00 H ATOM 58742 H16S PA 1429 2.434 128.849 32.292 1.00 0.00 H ATOM 58743 H16T PA 1429 3.745 128.239 32.963 1.00 0.00 H ATOM 58744 C115 PA 1429 1.814 127.035 33.356 1.00 0.00 C ATOM 58745 H15R PA 1429 1.829 126.431 32.446 1.00 0.00 H ATOM 58746 H15S PA 1429 0.790 127.368 33.538 1.00 0.00 H ATOM 58747 C114 PA 1429 2.202 126.239 34.531 1.00 0.00 C ATOM 58748 H14R PA 1429 1.402 125.501 34.621 1.00 0.00 H ATOM 58749 H14S PA 1429 2.184 126.848 35.437 1.00 0.00 H ATOM 58750 C113 PA 1429 3.600 125.478 34.474 1.00 0.00 C ATOM 58751 H13R PA 1429 4.408 126.146 34.170 1.00 0.00 H ATOM 58752 H13S PA 1429 3.509 124.787 33.633 1.00 0.00 H ATOM 58753 C112 PA 1429 3.992 124.827 35.767 1.00 0.00 C ATOM 58754 H12R PA 1429 3.115 124.464 36.307 1.00 0.00 H ATOM 58755 H12S PA 1429 4.235 125.598 36.500 1.00 0.00 H ATOM 58756 C111 PA 1429 5.125 123.777 35.777 1.00 0.00 C ATOM 58757 H11R PA 1429 4.719 122.877 35.311 1.00 0.00 H ATOM 58758 H11S PA 1429 5.277 123.648 36.851 1.00 0.00 H ATOM 58759 C110 PA 1429 6.368 124.357 35.075 1.00 0.00 C ATOM 58760 H10R PA 1429 6.779 125.185 35.657 1.00 0.00 H ATOM 58761 H10S PA 1429 6.224 124.700 34.049 1.00 0.00 H ATOM 58762 C19 PA 1429 7.341 123.237 34.689 1.00 0.00 C ATOM 58763 H9R PA 1429 7.883 122.981 35.602 1.00 0.00 H ATOM 58764 H9S PA 1429 8.134 123.654 34.065 1.00 0.00 H ATOM 58765 C18 PA 1429 6.754 121.914 34.057 1.00 0.00 C ATOM 58766 H8R PA 1429 6.157 121.380 34.800 1.00 0.00 H ATOM 58767 H8S PA 1429 7.493 121.136 33.858 1.00 0.00 H ATOM 58768 C17 PA 1429 5.843 122.161 32.886 1.00 0.00 C ATOM 58769 H7R PA 1429 4.962 122.774 33.089 1.00 0.00 H ATOM 58770 H7S PA 1429 5.422 121.195 32.600 1.00 0.00 H ATOM 58771 C16 PA 1429 6.641 122.783 31.742 1.00 0.00 C ATOM 58772 H6R PA 1429 7.530 122.223 31.444 1.00 0.00 H ATOM 58773 H6S PA 1429 7.073 123.738 32.049 1.00 0.00 H ATOM 58774 C15 PA 1429 5.780 123.063 30.410 1.00 0.00 C ATOM 58775 H5R PA 1429 5.282 122.197 29.969 1.00 0.00 H ATOM 58776 H5S PA 1429 6.419 123.467 29.622 1.00 0.00 H ATOM 58777 C14 PA 1429 4.755 124.000 30.697 1.00 0.00 C ATOM 58778 H4R PA 1429 5.082 124.710 31.459 1.00 0.00 H ATOM 58779 H4S PA 1429 3.999 123.477 31.286 1.00 0.00 H ATOM 58780 C13 PA 1429 4.043 124.525 29.423 1.00 0.00 C ATOM 58781 H3R PA 1429 3.916 123.675 28.749 1.00 0.00 H ATOM 58782 H3S PA 1429 4.667 125.174 28.804 1.00 0.00 H ATOM 58783 C12 PA 1429 2.757 125.144 29.893 1.00 0.00 C ATOM 58784 H2R PA 1429 3.111 125.978 30.503 1.00 0.00 H ATOM 58785 H2S PA 1429 2.094 124.442 30.403 1.00 0.00 H ATOM 58786 C11 PGR 1430 1.994 125.690 28.689 1.00 0.00 C ATOM 58787 O12 PGR 1430 2.530 125.841 27.651 1.00 0.00 O ATOM 58788 O11 PGR 1430 0.704 125.967 28.901 1.00 0.00 O ATOM 58789 C1 PGR 1430 -0.102 126.630 27.877 1.00 0.00 C ATOM 58790 HR PGR 1430 0.459 127.427 27.382 1.00 0.00 H ATOM 58791 HS PGR 1430 -0.945 127.049 28.432 1.00 0.00 H ATOM 58792 C2 PGR 1430 -0.368 125.566 26.793 1.00 0.00 C ATOM 58793 HX PGR 1430 0.539 125.206 26.300 1.00 0.00 H ATOM 58794 C3 PGR 1430 -1.421 126.037 25.712 1.00 0.00 C ATOM 58795 HA PGR 1430 -1.393 127.102 25.465 1.00 0.00 H ATOM 58796 HB PGR 1430 -2.349 125.680 26.166 1.00 0.00 H ATOM 58797 O31 PGR 1430 -1.143 125.228 24.500 1.00 0.00 O ATOM 58798 P31 PGR 1430 -2.318 125.008 23.359 1.00 0.00 P ATOM 58799 O32 PGR 1430 -2.035 126.002 22.200 1.00 0.00 O ATOM 58800 C31 PGR 1430 -1.869 127.384 22.480 1.00 0.00 C ATOM 58801 H1A PGR 1430 -0.941 127.544 23.036 1.00 0.00 H ATOM 58802 H1B PGR 1430 -2.615 127.785 23.171 1.00 0.00 H ATOM 58803 C32 PGR 1430 -1.729 128.211 21.211 1.00 0.00 C ATOM 58804 H2A PGR 1430 -1.521 129.233 21.537 1.00 0.00 H ATOM 58805 O35 PGR 1430 -2.984 128.318 20.538 1.00 0.00 O ATOM 58806 HO5A PGR 1430 -3.560 128.986 20.951 1.00 0.00 H ATOM 58807 C33 PGR 1430 -0.556 127.624 20.340 1.00 0.00 C ATOM 58808 H3A PGR 1430 0.377 127.437 20.877 1.00 0.00 H ATOM 58809 H3B PGR 1430 -0.782 126.631 19.944 1.00 0.00 H ATOM 58810 O33 PGR 1430 -2.256 123.640 22.800 1.00 0.00 O ATOM 58811 O34 PGR 1430 -3.686 125.365 23.807 1.00 0.00 O ATOM 58812 O21 PGR 1430 -0.990 124.408 27.475 1.00 0.00 O ATOM 58813 C21 PGR 1430 -0.985 123.165 26.905 1.00 0.00 C ATOM 58814 O22 PGR 1430 -0.409 122.760 25.920 1.00 0.00 O ATOM 58815 O36 PGR 1430 -0.226 128.664 19.404 1.00 0.00 O ATOM 58816 HO6A PGR 1430 -1.100 128.992 19.128 1.00 0.00 H ATOM 58817 C12 OL 1431 -1.818 122.214 27.698 1.00 0.00 C ATOM 58818 H2R OL 1431 -2.876 122.465 27.598 1.00 0.00 H ATOM 58819 H2S OL 1431 -1.801 121.261 27.165 1.00 0.00 H ATOM 58820 C13 OL 1431 -1.275 122.086 29.117 1.00 0.00 C ATOM 58821 H3R OL 1431 -1.396 123.018 29.674 1.00 0.00 H ATOM 58822 H3S OL 1431 -1.860 121.549 29.867 1.00 0.00 H ATOM 58823 C14 OL 1431 0.217 121.702 29.062 1.00 0.00 C ATOM 58824 H4R OL 1431 0.277 120.902 28.321 1.00 0.00 H ATOM 58825 H4S OL 1431 0.928 122.439 28.683 1.00 0.00 H ATOM 58826 C15 OL 1431 0.717 121.231 30.394 1.00 0.00 C ATOM 58827 H5R OL 1431 0.717 121.939 31.226 1.00 0.00 H ATOM 58828 H5S OL 1431 -0.109 120.567 30.660 1.00 0.00 H ATOM 58829 C16 OL 1431 2.102 120.486 30.427 1.00 0.00 C ATOM 58830 H6R OL 1431 2.110 119.515 29.928 1.00 0.00 H ATOM 58831 H6S OL 1431 2.788 121.046 29.788 1.00 0.00 H ATOM 58832 C17 OL 1431 2.624 120.297 31.883 1.00 0.00 C ATOM 58833 H7R OL 1431 3.622 119.863 31.976 1.00 0.00 H ATOM 58834 H7S OL 1431 2.751 121.299 32.297 1.00 0.00 H ATOM 58835 C18 OL 1431 1.718 119.610 33.009 1.00 0.00 C ATOM 58836 H8R OL 1431 2.182 119.753 33.987 1.00 0.00 H ATOM 58837 H8S OL 1431 0.750 120.079 33.194 1.00 0.00 H ATOM 58838 C19 OL 1431 1.442 118.112 32.857 1.00 0.00 C ATOM 58839 H9R OL 1431 1.324 117.745 31.841 1.00 0.00 H ATOM 58840 C110 OL 1431 1.567 117.099 33.664 1.00 0.00 C ATOM 58841 H10R OL 1431 1.586 116.077 33.293 1.00 0.00 H ATOM 58842 C111 OL 1431 1.677 117.261 35.151 1.00 0.00 C ATOM 58843 H11R OL 1431 2.715 117.336 35.480 1.00 0.00 H ATOM 58844 H11S OL 1431 1.204 118.152 35.570 1.00 0.00 H ATOM 58845 C112 OL 1431 1.274 115.894 35.723 1.00 0.00 C ATOM 58846 H12R OL 1431 0.199 115.725 35.633 1.00 0.00 H ATOM 58847 H12S OL 1431 1.633 115.088 35.080 1.00 0.00 H ATOM 58848 C113 OL 1431 1.660 115.646 37.164 1.00 0.00 C ATOM 58849 H13R OL 1431 2.688 115.296 37.280 1.00 0.00 H ATOM 58850 H13S OL 1431 1.574 116.577 37.729 1.00 0.00 H ATOM 58851 C114 OL 1431 0.932 114.543 37.941 1.00 0.00 C ATOM 58852 H14R OL 1431 1.303 114.575 38.968 1.00 0.00 H ATOM 58853 H14S OL 1431 -0.148 114.697 37.892 1.00 0.00 H ATOM 58854 C115 OL 1431 1.262 113.172 37.401 1.00 0.00 C ATOM 58855 H15R OL 1431 0.731 112.852 36.502 1.00 0.00 H ATOM 58856 H15S OL 1431 2.315 113.072 37.128 1.00 0.00 H ATOM 58857 C116 OL 1431 0.993 112.125 38.464 1.00 0.00 C ATOM 58858 H16R OL 1431 1.404 112.514 39.398 1.00 0.00 H ATOM 58859 H16S OL 1431 -0.087 112.026 38.584 1.00 0.00 H ATOM 58860 C117 OL 1431 1.501 110.805 37.929 1.00 0.00 C ATOM 58861 H17R OL 1431 1.200 110.103 38.709 1.00 0.00 H ATOM 58862 H17S OL 1431 0.975 110.534 37.011 1.00 0.00 H ATOM 58863 C118 OL 1431 3.057 110.634 37.911 1.00 0.00 C ATOM 58864 H18R OL 1431 3.496 110.923 38.869 1.00 0.00 H ATOM 58865 H18S OL 1431 3.292 111.349 37.120 1.00 0.00 H ATOM 58866 H18T OL 1431 3.384 109.603 37.766 1.00 0.00 H TER 58867 OL 1431 ATOM 58867 C116 PA 1432 21.144 65.931 32.166 1.00 0.00 C ATOM 58868 H16R PA 1432 20.309 66.622 32.033 1.00 0.00 H ATOM 58869 H16S PA 1432 20.671 64.949 32.229 1.00 0.00 H ATOM 58870 H16T PA 1432 21.717 65.939 31.236 1.00 0.00 H ATOM 58871 C115 PA 1432 21.856 66.329 33.441 1.00 0.00 C ATOM 58872 H15R PA 1432 22.659 65.618 33.647 1.00 0.00 H ATOM 58873 H15S PA 1432 21.169 66.205 34.280 1.00 0.00 H ATOM 58874 C114 PA 1432 22.355 67.782 33.435 1.00 0.00 C ATOM 58875 H14R PA 1432 21.566 68.525 33.300 1.00 0.00 H ATOM 58876 H14S PA 1432 23.058 67.831 32.601 1.00 0.00 H ATOM 58877 C113 PA 1432 23.299 68.109 34.584 1.00 0.00 C ATOM 58878 H13R PA 1432 24.037 67.321 34.749 1.00 0.00 H ATOM 58879 H13S PA 1432 22.715 68.090 35.507 1.00 0.00 H ATOM 58880 C112 PA 1432 23.856 69.457 34.505 1.00 0.00 C ATOM 58881 H12R PA 1432 23.060 70.137 34.815 1.00 0.00 H ATOM 58882 H12S PA 1432 23.921 69.775 33.462 1.00 0.00 H ATOM 58883 C111 PA 1432 25.121 69.950 35.223 1.00 0.00 C ATOM 58884 H11R PA 1432 25.139 69.704 36.287 1.00 0.00 H ATOM 58885 H11S PA 1432 25.188 71.022 35.026 1.00 0.00 H ATOM 58886 C110 PA 1432 26.334 69.285 34.744 1.00 0.00 C ATOM 58887 H10R PA 1432 26.069 68.240 34.574 1.00 0.00 H ATOM 58888 H10S PA 1432 27.174 69.325 35.441 1.00 0.00 H ATOM 58889 C19 PA 1432 26.784 69.903 33.477 1.00 0.00 C ATOM 58890 H9R PA 1432 27.111 70.914 33.731 1.00 0.00 H ATOM 58891 H9S PA 1432 25.890 70.031 32.863 1.00 0.00 H ATOM 58892 C18 PA 1432 28.008 69.167 32.830 1.00 0.00 C ATOM 58893 H8R PA 1432 27.770 68.120 33.029 1.00 0.00 H ATOM 58894 H8S PA 1432 28.915 69.403 33.390 1.00 0.00 H ATOM 58895 C17 PA 1432 28.342 69.563 31.392 1.00 0.00 C ATOM 58896 H7R PA 1432 27.558 69.162 30.746 1.00 0.00 H ATOM 58897 H7S PA 1432 29.187 68.920 31.137 1.00 0.00 H ATOM 58898 C16 PA 1432 28.557 71.057 31.182 1.00 0.00 C ATOM 58899 H6R PA 1432 29.361 71.369 31.851 1.00 0.00 H ATOM 58900 H6S PA 1432 27.781 71.719 31.572 1.00 0.00 H ATOM 58901 C15 PA 1432 28.954 71.424 29.770 1.00 0.00 C ATOM 58902 H5R PA 1432 29.263 72.471 29.784 1.00 0.00 H ATOM 58903 H5S PA 1432 28.096 71.243 29.119 1.00 0.00 H ATOM 58904 C14 PA 1432 30.173 70.668 29.224 1.00 0.00 C ATOM 58905 H4R PA 1432 29.918 69.606 29.236 1.00 0.00 H ATOM 58906 H4S PA 1432 30.747 70.741 30.149 1.00 0.00 H ATOM 58907 C13 PA 1432 30.984 71.279 28.089 1.00 0.00 C ATOM 58908 H3R PA 1432 30.360 71.073 27.217 1.00 0.00 H ATOM 58909 H3S PA 1432 31.868 70.641 28.033 1.00 0.00 H ATOM 58910 C12 PA 1432 31.268 72.707 28.179 1.00 0.00 C ATOM 58911 H2R PA 1432 31.743 72.851 29.152 1.00 0.00 H ATOM 58912 H2S PA 1432 30.392 73.359 28.190 1.00 0.00 H ATOM 58913 C11 PGR 1433 32.250 73.287 27.178 1.00 0.00 C ATOM 58914 O12 PGR 1433 32.186 73.005 25.993 1.00 0.00 O ATOM 58915 O11 PGR 1433 33.265 73.976 27.774 1.00 0.00 O ATOM 58916 C1 PGR 1433 34.364 74.431 26.971 1.00 0.00 C ATOM 58917 HR PGR 1433 34.554 73.707 26.175 1.00 0.00 H ATOM 58918 HS PGR 1433 35.248 74.538 27.605 1.00 0.00 H ATOM 58919 C2 PGR 1433 34.107 75.809 26.288 1.00 0.00 C ATOM 58920 HX PGR 1433 33.073 75.935 25.956 1.00 0.00 H ATOM 58921 C3 PGR 1433 35.133 76.045 25.102 1.00 0.00 C ATOM 58922 HA PGR 1433 34.937 76.992 24.595 1.00 0.00 H ATOM 58923 HB PGR 1433 34.986 75.192 24.434 1.00 0.00 H ATOM 58924 O31 PGR 1433 36.532 76.041 25.503 1.00 0.00 O ATOM 58925 P31 PGR 1433 37.681 75.700 24.412 1.00 0.00 P ATOM 58926 O32 PGR 1433 38.973 75.134 25.245 1.00 0.00 O ATOM 58927 C31 PGR 1433 39.044 73.683 25.511 1.00 0.00 C ATOM 58928 H1A PGR 1433 39.034 73.093 24.591 1.00 0.00 H ATOM 58929 H1B PGR 1433 38.122 73.437 26.045 1.00 0.00 H ATOM 58930 C32 PGR 1433 40.168 73.163 26.444 1.00 0.00 C ATOM 58931 H2A PGR 1433 40.129 73.758 27.360 1.00 0.00 H ATOM 58932 O35 PGR 1433 41.488 73.171 25.888 1.00 0.00 O ATOM 58933 HO5A PGR 1433 42.091 73.016 26.636 1.00 0.00 H ATOM 58934 C33 PGR 1433 39.849 71.635 26.805 1.00 0.00 C ATOM 58935 H3A PGR 1433 40.645 71.213 27.425 1.00 0.00 H ATOM 58936 H3B PGR 1433 38.936 71.606 27.405 1.00 0.00 H ATOM 58937 O33 PGR 1433 37.189 74.678 23.488 1.00 0.00 O ATOM 58938 O34 PGR 1433 38.141 76.951 23.811 1.00 0.00 O ATOM 58939 O21 PGR 1433 34.359 76.696 27.359 1.00 0.00 O ATOM 58940 C21 PGR 1433 33.857 77.951 27.198 1.00 0.00 C ATOM 58941 O22 PGR 1433 33.049 78.264 26.323 1.00 0.00 O ATOM 58942 O36 PGR 1433 39.789 70.922 25.558 1.00 0.00 O ATOM 58943 HO6A PGR 1433 40.591 71.214 25.088 1.00 0.00 H ATOM 58944 C12 OL 1434 34.369 78.966 28.242 1.00 0.00 C ATOM 58945 H2R OL 1434 35.442 78.770 28.279 1.00 0.00 H ATOM 58946 H2S OL 1434 34.205 79.983 27.879 1.00 0.00 H ATOM 58947 C13 OL 1434 33.708 78.686 29.574 1.00 0.00 C ATOM 58948 H3R OL 1434 32.669 78.902 29.315 1.00 0.00 H ATOM 58949 H3S OL 1434 33.603 77.648 29.896 1.00 0.00 H ATOM 58950 C14 OL 1434 34.545 79.265 30.663 1.00 0.00 C ATOM 58951 H4R OL 1434 35.303 78.487 30.772 1.00 0.00 H ATOM 58952 H4S OL 1434 35.148 80.151 30.454 1.00 0.00 H ATOM 58953 C15 OL 1434 33.811 79.665 31.892 1.00 0.00 C ATOM 58954 H5R OL 1434 33.078 80.401 31.553 1.00 0.00 H ATOM 58955 H5S OL 1434 33.257 78.772 32.188 1.00 0.00 H ATOM 58956 C16 OL 1434 34.644 80.174 33.125 1.00 0.00 C ATOM 58957 H6R OL 1434 35.152 81.124 32.950 1.00 0.00 H ATOM 58958 H6S OL 1434 33.917 80.364 33.917 1.00 0.00 H ATOM 58959 C17 OL 1434 35.723 79.278 33.646 1.00 0.00 C ATOM 58960 H7R OL 1434 35.299 78.305 33.904 1.00 0.00 H ATOM 58961 H7S OL 1434 36.493 79.054 32.906 1.00 0.00 H ATOM 58962 C18 OL 1434 36.342 79.660 34.981 1.00 0.00 C ATOM 58963 H8R OL 1434 36.878 78.754 35.274 1.00 0.00 H ATOM 58964 H8S OL 1434 37.018 80.514 34.906 1.00 0.00 H ATOM 58965 C19 OL 1434 35.316 79.810 36.073 1.00 0.00 C ATOM 58966 H9R OL 1434 34.811 80.770 36.142 1.00 0.00 H ATOM 58967 C110 OL 1434 34.860 79.014 37.053 1.00 0.00 C ATOM 58968 H10R OL 1434 34.126 79.379 37.766 1.00 0.00 H ATOM 58969 C111 OL 1434 35.378 77.611 37.315 1.00 0.00 C ATOM 58970 H11R OL 1434 34.637 76.832 37.126 1.00 0.00 H ATOM 58971 H11S OL 1434 36.205 77.300 36.674 1.00 0.00 H ATOM 58972 C112 OL 1434 35.791 77.486 38.741 1.00 0.00 C ATOM 58973 H12R OL 1434 35.925 78.515 39.080 1.00 0.00 H ATOM 58974 H12S OL 1434 34.964 77.069 39.319 1.00 0.00 H ATOM 58975 C113 OL 1434 37.069 76.705 38.840 1.00 0.00 C ATOM 58976 H13R OL 1434 37.063 75.796 38.236 1.00 0.00 H ATOM 58977 H13S OL 1434 37.862 77.269 38.344 1.00 0.00 H ATOM 58978 C114 OL 1434 37.496 76.511 40.314 1.00 0.00 C ATOM 58979 H14R OL 1434 37.707 77.444 40.842 1.00 0.00 H ATOM 58980 H14S OL 1434 36.590 76.125 40.787 1.00 0.00 H ATOM 58981 C115 OL 1434 38.608 75.526 40.508 1.00 0.00 C ATOM 58982 H15R OL 1434 38.472 74.711 39.794 1.00 0.00 H ATOM 58983 H15S OL 1434 39.465 76.075 40.113 1.00 0.00 H ATOM 58984 C116 OL 1434 38.775 74.993 41.839 1.00 0.00 C ATOM 58985 H16R OL 1434 39.157 75.833 42.423 1.00 0.00 H ATOM 58986 H16S OL 1434 37.797 74.709 42.235 1.00 0.00 H ATOM 58987 C117 OL 1434 39.571 73.739 42.008 1.00 0.00 C ATOM 58988 H17R OL 1434 38.945 72.845 41.983 1.00 0.00 H ATOM 58989 H17S OL 1434 40.282 73.542 41.202 1.00 0.00 H ATOM 58990 C118 OL 1434 40.241 73.569 43.404 1.00 0.00 C ATOM 58991 H18R OL 1434 41.152 74.153 43.550 1.00 0.00 H ATOM 58992 H18S OL 1434 40.591 72.538 43.482 1.00 0.00 H ATOM 58993 H18T OL 1434 39.621 73.760 44.283 1.00 0.00 H TER 58994 OL 1434 ATOM 58994 C116 PA 1435 72.681 0.905 41.122 1.00 0.00 C ATOM 58995 H16R PA 1435 72.475 0.352 42.041 1.00 0.00 H ATOM 58996 H16S PA 1435 73.740 0.774 40.893 1.00 0.00 H ATOM 58997 H16T PA 1435 72.177 0.367 40.316 1.00 0.00 H ATOM 58998 C115 PA 1435 72.292 2.337 41.288 1.00 0.00 C ATOM 58999 H15R PA 1435 72.828 3.003 40.608 1.00 0.00 H ATOM 59000 H15S PA 1435 72.702 2.618 42.261 1.00 0.00 H ATOM 59001 C114 PA 1435 70.849 2.634 41.386 1.00 0.00 C ATOM 59002 H14R PA 1435 70.488 2.035 42.225 1.00 0.00 H ATOM 59003 H14S PA 1435 70.358 2.407 40.438 1.00 0.00 H ATOM 59004 C113 PA 1435 70.523 4.043 41.798 1.00 0.00 C ATOM 59005 H13R PA 1435 70.958 4.041 42.799 1.00 0.00 H ATOM 59006 H13S PA 1435 69.437 4.088 41.901 1.00 0.00 H ATOM 59007 C112 PA 1435 71.230 5.201 40.989 1.00 0.00 C ATOM 59008 H12R PA 1435 72.281 5.191 41.285 1.00 0.00 H ATOM 59009 H12S PA 1435 70.751 6.119 41.335 1.00 0.00 H ATOM 59010 C111 PA 1435 70.977 5.155 39.497 1.00 0.00 C ATOM 59011 H11R PA 1435 71.044 4.161 39.050 1.00 0.00 H ATOM 59012 H11S PA 1435 71.754 5.765 39.030 1.00 0.00 H ATOM 59013 C110 PA 1435 69.718 6.030 39.052 1.00 0.00 C ATOM 59014 H10R PA 1435 69.765 6.962 39.621 1.00 0.00 H ATOM 59015 H10S PA 1435 68.762 5.613 39.377 1.00 0.00 H ATOM 59016 C19 PA 1435 69.658 6.068 37.538 1.00 0.00 C ATOM 59017 H9R PA 1435 68.640 6.286 37.205 1.00 0.00 H ATOM 59018 H9S PA 1435 69.843 5.035 37.236 1.00 0.00 H ATOM 59019 C18 PA 1435 70.742 6.914 36.895 1.00 0.00 C ATOM 59020 H8R PA 1435 71.773 6.642 37.131 1.00 0.00 H ATOM 59021 H8S PA 1435 70.562 7.915 37.293 1.00 0.00 H ATOM 59022 C17 PA 1435 70.684 6.980 35.334 1.00 0.00 C ATOM 59023 H7R PA 1435 69.711 7.349 35.001 1.00 0.00 H ATOM 59024 H7S PA 1435 70.870 6.031 34.826 1.00 0.00 H ATOM 59025 C16 PA 1435 71.850 7.691 34.704 1.00 0.00 C ATOM 59026 H6R PA 1435 72.752 7.138 34.974 1.00 0.00 H ATOM 59027 H6S PA 1435 72.023 8.692 35.103 1.00 0.00 H ATOM 59028 C15 PA 1435 71.715 7.566 33.232 1.00 0.00 C ATOM 59029 H5R PA 1435 70.808 8.172 33.182 1.00 0.00 H ATOM 59030 H5S PA 1435 71.585 6.541 32.878 1.00 0.00 H ATOM 59031 C14 PA 1435 72.852 8.150 32.466 1.00 0.00 C ATOM 59032 H4R PA 1435 73.838 7.724 32.662 1.00 0.00 H ATOM 59033 H4S PA 1435 72.989 9.169 32.834 1.00 0.00 H ATOM 59034 C13 PA 1435 72.692 8.209 30.961 1.00 0.00 C ATOM 59035 H3R PA 1435 72.738 7.158 30.670 1.00 0.00 H ATOM 59036 H3S PA 1435 73.585 8.591 30.462 1.00 0.00 H ATOM 59037 C12 PA 1435 71.450 8.943 30.544 1.00 0.00 C ATOM 59038 H2R PA 1435 71.442 9.960 30.942 1.00 0.00 H ATOM 59039 H2S PA 1435 70.500 8.491 30.836 1.00 0.00 H ATOM 59040 C11 PGR 1436 71.524 9.131 29.097 1.00 0.00 C ATOM 59041 O12 PGR 1436 70.708 8.767 28.287 1.00 0.00 O ATOM 59042 O11 PGR 1436 72.617 9.835 28.710 1.00 0.00 O ATOM 59043 C1 PGR 1436 72.801 10.044 27.341 1.00 0.00 C ATOM 59044 HR PGR 1436 71.981 10.723 27.093 1.00 0.00 H ATOM 59045 HS PGR 1436 72.730 9.078 26.835 1.00 0.00 H ATOM 59046 C2 PGR 1436 74.190 10.698 27.044 1.00 0.00 C ATOM 59047 HX PGR 1436 74.103 11.787 27.056 1.00 0.00 H ATOM 59048 C3 PGR 1436 74.674 10.523 25.629 1.00 0.00 C ATOM 59049 HA PGR 1436 75.577 11.117 25.466 1.00 0.00 H ATOM 59050 HB PGR 1436 73.870 10.828 24.954 1.00 0.00 H ATOM 59051 O31 PGR 1436 74.853 9.148 25.297 1.00 0.00 O ATOM 59052 P31 PGR 1436 75.562 8.826 23.950 1.00 0.00 P ATOM 59053 O32 PGR 1436 74.870 7.463 23.447 1.00 0.00 O ATOM 59054 C31 PGR 1436 75.070 6.271 24.203 1.00 0.00 C ATOM 59055 H1A PGR 1436 75.976 6.363 24.808 1.00 0.00 H ATOM 59056 H1B PGR 1436 74.266 6.293 24.943 1.00 0.00 H ATOM 59057 C32 PGR 1436 75.142 5.106 23.220 1.00 0.00 C ATOM 59058 H2A PGR 1436 75.488 5.515 22.267 1.00 0.00 H ATOM 59059 O35 PGR 1436 73.852 4.708 22.890 1.00 0.00 O ATOM 59060 HO5A PGR 1436 73.411 5.478 22.488 1.00 0.00 H ATOM 59061 C33 PGR 1436 75.927 3.949 23.851 1.00 0.00 C ATOM 59062 H3A PGR 1436 76.995 4.180 23.842 1.00 0.00 H ATOM 59063 H3B PGR 1436 75.534 3.935 24.871 1.00 0.00 H ATOM 59064 O33 PGR 1436 75.176 9.820 22.898 1.00 0.00 O ATOM 59065 O34 PGR 1436 77.010 8.590 24.175 1.00 0.00 O ATOM 59066 O21 PGR 1436 75.179 10.098 27.993 1.00 0.00 O ATOM 59067 C21 PGR 1436 76.468 10.630 27.982 1.00 0.00 C ATOM 59068 O22 PGR 1436 76.844 11.480 27.226 1.00 0.00 O ATOM 59069 O36 PGR 1436 75.768 2.761 22.967 1.00 0.00 O ATOM 59070 HO6A PGR 1436 76.273 2.744 22.135 1.00 0.00 H ATOM 59071 C12 OL 1437 77.287 10.246 29.229 1.00 0.00 C ATOM 59072 H2R OL 1437 77.307 9.163 29.366 1.00 0.00 H ATOM 59073 H2S OL 1437 78.314 10.528 28.986 1.00 0.00 H ATOM 59074 C13 OL 1437 76.828 11.038 30.470 1.00 0.00 C ATOM 59075 H3R OL 1437 76.714 12.120 30.380 1.00 0.00 H ATOM 59076 H3S OL 1437 75.804 10.672 30.566 1.00 0.00 H ATOM 59077 C14 OL 1437 77.556 10.577 31.759 1.00 0.00 C ATOM 59078 H4R OL 1437 77.559 9.491 31.875 1.00 0.00 H ATOM 59079 H4S OL 1437 78.628 10.783 31.725 1.00 0.00 H ATOM 59080 C15 OL 1437 77.008 11.259 33.021 1.00 0.00 C ATOM 59081 H5R OL 1437 77.792 11.083 33.761 1.00 0.00 H ATOM 59082 H5S OL 1437 76.969 12.349 32.965 1.00 0.00 H ATOM 59083 C16 OL 1437 75.631 10.781 33.539 1.00 0.00 C ATOM 59084 H6R OL 1437 74.806 11.200 32.960 1.00 0.00 H ATOM 59085 H6S OL 1437 75.486 9.700 33.583 1.00 0.00 H ATOM 59086 C17 OL 1437 75.420 11.409 34.869 1.00 0.00 C ATOM 59087 H7R OL 1437 76.328 11.155 35.420 1.00 0.00 H ATOM 59088 H7S OL 1437 75.520 12.490 34.753 1.00 0.00 H ATOM 59089 C18 OL 1437 74.226 10.922 35.782 1.00 0.00 C ATOM 59090 H8R OL 1437 73.324 10.920 35.167 1.00 0.00 H ATOM 59091 H8S OL 1437 74.513 9.909 36.071 1.00 0.00 H ATOM 59092 C19 OL 1437 74.002 11.657 37.043 1.00 0.00 C ATOM 59093 H9R OL 1437 74.685 11.444 37.860 1.00 0.00 H ATOM 59094 C110 OL 1437 72.969 12.503 37.241 1.00 0.00 C ATOM 59095 H10R OL 1437 72.781 12.935 38.221 1.00 0.00 H ATOM 59096 C111 OL 1437 72.094 13.057 36.140 1.00 0.00 C ATOM 59097 H11R OL 1437 72.280 12.748 35.109 1.00 0.00 H ATOM 59098 H11S OL 1437 71.163 12.572 36.441 1.00 0.00 H ATOM 59099 C112 OL 1437 71.923 14.548 36.208 1.00 0.00 C ATOM 59100 H12R OL 1437 72.130 14.741 37.262 1.00 0.00 H ATOM 59101 H12S OL 1437 72.827 15.011 35.807 1.00 0.00 H ATOM 59102 C113 OL 1437 70.729 15.220 35.588 1.00 0.00 C ATOM 59103 H13R OL 1437 70.836 16.258 35.909 1.00 0.00 H ATOM 59104 H13S OL 1437 70.981 15.177 34.526 1.00 0.00 H ATOM 59105 C114 OL 1437 69.446 14.583 36.015 1.00 0.00 C ATOM 59106 H14R OL 1437 69.259 13.689 35.417 1.00 0.00 H ATOM 59107 H14S OL 1437 69.539 14.267 37.056 1.00 0.00 H ATOM 59108 C115 OL 1437 68.201 15.383 35.801 1.00 0.00 C ATOM 59109 H15R OL 1437 68.537 16.337 36.214 1.00 0.00 H ATOM 59110 H15S OL 1437 67.932 15.550 34.756 1.00 0.00 H ATOM 59111 C116 OL 1437 66.969 14.686 36.449 1.00 0.00 C ATOM 59112 H16R OL 1437 66.112 15.320 36.215 1.00 0.00 H ATOM 59113 H16S OL 1437 66.752 13.692 36.052 1.00 0.00 H ATOM 59114 C117 OL 1437 66.963 14.713 38.021 1.00 0.00 C ATOM 59115 H17R OL 1437 66.043 14.368 38.498 1.00 0.00 H ATOM 59116 H17S OL 1437 67.727 13.982 38.295 1.00 0.00 H ATOM 59117 C118 OL 1437 67.278 16.085 38.707 1.00 0.00 C ATOM 59118 H18R OL 1437 67.267 15.929 39.788 1.00 0.00 H ATOM 59119 H18S OL 1437 66.527 16.833 38.447 1.00 0.00 H ATOM 59120 H18T OL 1437 68.271 16.495 38.509 1.00 0.00 H TER 59121 OL 1437 ATOM 59121 C116 PA 1438 26.121 68.370 41.000 1.00 0.00 C ATOM 59122 H16R PA 1438 25.315 67.634 41.008 1.00 0.00 H ATOM 59123 H16S PA 1438 25.803 69.363 41.324 1.00 0.00 H ATOM 59124 H16T PA 1438 26.744 68.058 41.841 1.00 0.00 H ATOM 59125 C115 PA 1438 26.813 68.351 39.641 1.00 0.00 C ATOM 59126 H15R PA 1438 27.563 69.142 39.704 1.00 0.00 H ATOM 59127 H15S PA 1438 26.030 68.657 38.943 1.00 0.00 H ATOM 59128 C114 PA 1438 27.400 66.937 39.363 1.00 0.00 C ATOM 59129 H14R PA 1438 26.452 66.397 39.407 1.00 0.00 H ATOM 59130 H14S PA 1438 27.993 66.582 40.208 1.00 0.00 H ATOM 59131 C113 PA 1438 28.137 66.663 38.037 1.00 0.00 C ATOM 59132 H13R PA 1438 28.813 67.498 37.842 1.00 0.00 H ATOM 59133 H13S PA 1438 27.335 66.701 37.296 1.00 0.00 H ATOM 59134 C112 PA 1438 28.975 65.337 37.824 1.00 0.00 C ATOM 59135 H12R PA 1438 28.452 64.383 37.916 1.00 0.00 H ATOM 59136 H12S PA 1438 29.832 65.302 38.501 1.00 0.00 H ATOM 59137 C111 PA 1438 29.684 65.447 36.500 1.00 0.00 C ATOM 59138 H11R PA 1438 30.569 66.053 36.703 1.00 0.00 H ATOM 59139 H11S PA 1438 29.096 65.944 35.726 1.00 0.00 H ATOM 59140 C110 PA 1438 30.202 64.153 35.897 1.00 0.00 C ATOM 59141 H10R PA 1438 29.403 63.429 35.725 1.00 0.00 H ATOM 59142 H10S PA 1438 30.920 63.666 36.560 1.00 0.00 H ATOM 59143 C19 PA 1438 30.817 64.426 34.506 1.00 0.00 C ATOM 59144 H9R PA 1438 31.266 63.450 34.314 1.00 0.00 H ATOM 59145 H9S PA 1438 31.577 65.201 34.628 1.00 0.00 H ATOM 59146 C18 PA 1438 29.890 64.906 33.400 1.00 0.00 C ATOM 59147 H8R PA 1438 29.407 65.878 33.523 1.00 0.00 H ATOM 59148 H8S PA 1438 29.038 64.228 33.310 1.00 0.00 H ATOM 59149 C17 PA 1438 30.660 65.146 32.112 1.00 0.00 C ATOM 59150 H7R PA 1438 31.173 64.232 31.805 1.00 0.00 H ATOM 59151 H7S PA 1438 31.452 65.863 32.333 1.00 0.00 H ATOM 59152 C16 PA 1438 29.776 65.604 30.994 1.00 0.00 C ATOM 59153 H6R PA 1438 29.156 66.489 31.153 1.00 0.00 H ATOM 59154 H6S PA 1438 28.978 64.860 30.959 1.00 0.00 H ATOM 59155 C15 PA 1438 30.345 65.652 29.615 1.00 0.00 C ATOM 59156 H5R PA 1438 29.679 66.181 28.930 1.00 0.00 H ATOM 59157 H5S PA 1438 30.437 64.646 29.198 1.00 0.00 H ATOM 59158 C14 PA 1438 31.659 66.385 29.570 1.00 0.00 C ATOM 59159 H4R PA 1438 32.443 65.759 30.003 1.00 0.00 H ATOM 59160 H4S PA 1438 31.577 67.258 30.221 1.00 0.00 H ATOM 59161 C13 PA 1438 32.005 66.930 28.170 1.00 0.00 C ATOM 59162 H3R PA 1438 32.940 67.494 28.190 1.00 0.00 H ATOM 59163 H3S PA 1438 31.267 67.681 27.882 1.00 0.00 H ATOM 59164 C12 PA 1438 31.881 65.773 27.196 1.00 0.00 C ATOM 59165 H2R PA 1438 30.820 65.634 26.979 1.00 0.00 H ATOM 59166 H2S PA 1438 32.234 64.819 27.591 1.00 0.00 H ATOM 59167 C11 PC 1439 32.552 66.146 25.848 1.00 0.00 C ATOM 59168 O12 PC 1439 32.053 66.107 24.746 1.00 0.00 O ATOM 59169 O11 PC 1439 33.899 66.545 26.005 1.00 0.00 O ATOM 59170 C1 PC 1439 34.651 66.755 24.785 1.00 0.00 C ATOM 59171 HR PC 1439 34.577 65.835 24.200 1.00 0.00 H ATOM 59172 HS PC 1439 35.685 66.859 25.123 1.00 0.00 H ATOM 59173 C2 PC 1439 34.146 68.062 24.016 1.00 0.00 C ATOM 59174 HX PC 1439 33.084 68.101 23.760 1.00 0.00 H ATOM 59175 C3 PC 1439 34.889 68.015 22.660 1.00 0.00 C ATOM 59176 HA PC 1439 34.728 67.017 22.245 1.00 0.00 H ATOM 59177 HB PC 1439 35.959 68.204 22.782 1.00 0.00 H ATOM 59178 O31 PC 1439 34.277 68.926 21.750 1.00 0.00 O ATOM 59179 P31 PC 1439 34.623 68.937 20.181 1.00 0.00 P ATOM 59180 O32 PC 1439 36.045 69.597 20.219 1.00 0.00 O ATOM 59181 C31 PC 1439 36.107 70.938 20.538 1.00 0.00 C ATOM 59182 H1A PC 1439 35.647 71.066 21.521 1.00 0.00 H ATOM 59183 H1B PC 1439 35.653 71.575 19.775 1.00 0.00 H ATOM 59184 C32 PC 1439 37.634 71.343 20.635 1.00 0.00 C ATOM 59185 H2A PC 1439 38.088 70.517 21.186 1.00 0.00 H ATOM 59186 H2B PC 1439 37.738 72.248 21.236 1.00 0.00 H ATOM 59187 N31 PC 1439 38.537 71.374 19.470 1.00 0.00 N ATOM 59188 C33 PC 1439 38.278 72.609 18.673 1.00 0.00 C ATOM 59189 H3A PC 1439 38.921 72.613 17.791 1.00 0.00 H ATOM 59190 H3B PC 1439 38.409 73.443 19.364 1.00 0.00 H ATOM 59191 H3C PC 1439 37.224 72.691 18.405 1.00 0.00 H ATOM 59192 C34 PC 1439 39.914 71.502 20.005 1.00 0.00 C ATOM 59193 H4A PC 1439 40.046 70.540 20.502 1.00 0.00 H ATOM 59194 H4B PC 1439 39.909 72.326 20.720 1.00 0.00 H ATOM 59195 H4C PC 1439 40.570 71.711 19.158 1.00 0.00 H ATOM 59196 C35 PC 1439 38.499 70.063 18.718 1.00 0.00 C ATOM 59197 H5A PC 1439 37.615 70.062 18.079 1.00 0.00 H ATOM 59198 H5B PC 1439 38.254 69.224 19.370 1.00 0.00 H ATOM 59199 H5C PC 1439 39.476 69.924 18.253 1.00 0.00 H ATOM 59200 O33 PC 1439 34.767 67.586 19.619 1.00 0.00 O ATOM 59201 O34 PC 1439 33.670 69.874 19.543 1.00 0.00 O ATOM 59202 O21 PC 1439 34.638 69.177 24.693 1.00 0.00 O ATOM 59203 C21 PC 1439 34.211 69.416 25.918 1.00 0.00 C ATOM 59204 O22 PC 1439 33.115 69.123 26.406 1.00 0.00 O ATOM 59205 C12 OL 1440 35.243 70.184 26.682 1.00 0.00 C ATOM 59206 H2R OL 1440 36.228 69.796 26.412 1.00 0.00 H ATOM 59207 H2S OL 1440 35.157 71.253 26.476 1.00 0.00 H ATOM 59208 C13 OL 1440 34.995 70.036 28.234 1.00 0.00 C ATOM 59209 H3R OL 1440 34.064 70.524 28.532 1.00 0.00 H ATOM 59210 H3S OL 1440 34.843 68.975 28.442 1.00 0.00 H ATOM 59211 C14 OL 1440 36.092 70.607 29.143 1.00 0.00 C ATOM 59212 H4R OL 1440 37.059 70.147 28.925 1.00 0.00 H ATOM 59213 H4S OL 1440 36.199 71.693 29.111 1.00 0.00 H ATOM 59214 C15 OL 1440 35.954 70.359 30.703 1.00 0.00 C ATOM 59215 H5R OL 1440 35.797 69.295 30.897 1.00 0.00 H ATOM 59216 H5S OL 1440 36.783 70.756 31.293 1.00 0.00 H ATOM 59217 C16 OL 1440 34.609 70.757 31.300 1.00 0.00 C ATOM 59218 H6R OL 1440 33.898 70.133 30.756 1.00 0.00 H ATOM 59219 H6S OL 1440 34.602 70.391 32.329 1.00 0.00 H ATOM 59220 C17 OL 1440 34.420 72.326 31.124 1.00 0.00 C ATOM 59221 H7R OL 1440 35.349 72.884 31.259 1.00 0.00 H ATOM 59222 H7S OL 1440 34.062 72.542 30.115 1.00 0.00 H ATOM 59223 C18 OL 1440 33.464 73.060 32.162 1.00 0.00 C ATOM 59224 H8R OL 1440 32.460 72.650 32.040 1.00 0.00 H ATOM 59225 H8S OL 1440 33.758 72.827 33.187 1.00 0.00 H ATOM 59226 C19 OL 1440 33.532 74.525 32.080 1.00 0.00 C ATOM 59227 H9R OL 1440 32.962 74.929 31.247 1.00 0.00 H ATOM 59228 C110 OL 1440 34.217 75.403 32.909 1.00 0.00 C ATOM 59229 H10R OL 1440 34.218 76.453 32.627 1.00 0.00 H ATOM 59230 C111 OL 1440 34.992 75.052 34.180 1.00 0.00 C ATOM 59231 H11R OL 1440 34.798 75.803 34.949 1.00 0.00 H ATOM 59232 H11S OL 1440 34.805 74.051 34.573 1.00 0.00 H ATOM 59233 C112 OL 1440 36.484 75.108 33.919 1.00 0.00 C ATOM 59234 H12R OL 1440 36.864 74.266 33.335 1.00 0.00 H ATOM 59235 H12S OL 1440 36.578 75.873 33.146 1.00 0.00 H ATOM 59236 C113 OL 1440 37.507 75.152 35.032 1.00 0.00 C ATOM 59237 H13R OL 1440 37.178 75.791 35.854 1.00 0.00 H ATOM 59238 H13S OL 1440 37.638 74.132 35.401 1.00 0.00 H ATOM 59239 C114 OL 1440 38.858 75.759 34.695 1.00 0.00 C ATOM 59240 H14R OL 1440 39.333 75.328 33.811 1.00 0.00 H ATOM 59241 H14S OL 1440 38.751 76.838 34.563 1.00 0.00 H ATOM 59242 C115 OL 1440 39.859 75.597 35.885 1.00 0.00 C ATOM 59243 H15R OL 1440 40.804 76.080 35.629 1.00 0.00 H ATOM 59244 H15S OL 1440 39.482 76.120 36.767 1.00 0.00 H ATOM 59245 C116 OL 1440 40.303 74.137 36.175 1.00 0.00 C ATOM 59246 H16R OL 1440 39.521 73.515 36.614 1.00 0.00 H ATOM 59247 H16S OL 1440 40.391 73.608 35.223 1.00 0.00 H ATOM 59248 C117 OL 1440 41.562 74.072 36.954 1.00 0.00 C ATOM 59249 H17R OL 1440 41.630 73.002 37.161 1.00 0.00 H ATOM 59250 H17S OL 1440 42.473 74.402 36.450 1.00 0.00 H ATOM 59251 C118 OL 1440 41.671 74.787 38.227 1.00 0.00 C ATOM 59252 H18R OL 1440 41.724 75.878 38.222 1.00 0.00 H ATOM 59253 H18S OL 1440 42.617 74.544 38.715 1.00 0.00 H ATOM 59254 H18T OL 1440 40.781 74.491 38.786 1.00 0.00 H TER 59255 OL 1440 ATOM 59255 C116 PA 1441 14.547 91.964 41.674 1.00 0.00 C ATOM 59256 H16R PA 1441 15.310 91.197 41.824 1.00 0.00 H ATOM 59257 H16S PA 1441 13.983 91.791 40.755 1.00 0.00 H ATOM 59258 H16T PA 1441 13.815 91.574 42.385 1.00 0.00 H ATOM 59259 C115 PA 1441 14.911 93.418 41.946 1.00 0.00 C ATOM 59260 H15R PA 1441 15.796 93.766 41.410 1.00 0.00 H ATOM 59261 H15S PA 1441 15.159 93.585 42.996 1.00 0.00 H ATOM 59262 C114 PA 1441 13.836 94.555 41.587 1.00 0.00 C ATOM 59263 H14R PA 1441 14.282 95.477 41.965 1.00 0.00 H ATOM 59264 H14S PA 1441 12.949 94.532 42.225 1.00 0.00 H ATOM 59265 C113 PA 1441 13.459 94.537 40.097 1.00 0.00 C ATOM 59266 H13R PA 1441 12.825 93.665 39.921 1.00 0.00 H ATOM 59267 H13S PA 1441 14.363 94.407 39.498 1.00 0.00 H ATOM 59268 C112 PA 1441 12.590 95.725 39.626 1.00 0.00 C ATOM 59269 H12R PA 1441 13.123 96.657 39.825 1.00 0.00 H ATOM 59270 H12S PA 1441 11.597 95.751 40.080 1.00 0.00 H ATOM 59271 C111 PA 1441 12.519 95.730 38.144 1.00 0.00 C ATOM 59272 H11R PA 1441 12.080 94.761 37.895 1.00 0.00 H ATOM 59273 H11S PA 1441 13.494 95.646 37.659 1.00 0.00 H ATOM 59274 C110 PA 1441 11.607 96.815 37.547 1.00 0.00 C ATOM 59275 H10R PA 1441 11.743 97.748 38.097 1.00 0.00 H ATOM 59276 H10S PA 1441 10.550 96.604 37.717 1.00 0.00 H ATOM 59277 C19 PA 1441 11.794 97.014 35.996 1.00 0.00 C ATOM 59278 H9R PA 1441 11.554 96.019 35.615 1.00 0.00 H ATOM 59279 H9S PA 1441 12.863 97.172 35.832 1.00 0.00 H ATOM 59280 C18 PA 1441 10.904 98.175 35.478 1.00 0.00 C ATOM 59281 H8R PA 1441 11.084 99.049 36.108 1.00 0.00 H ATOM 59282 H8S PA 1441 9.843 97.957 35.617 1.00 0.00 H ATOM 59283 C17 PA 1441 11.215 98.452 34.017 1.00 0.00 C ATOM 59284 H7R PA 1441 11.349 97.493 33.512 1.00 0.00 H ATOM 59285 H7S PA 1441 12.089 99.107 33.993 1.00 0.00 H ATOM 59286 C16 PA 1441 10.000 99.109 33.365 1.00 0.00 C ATOM 59287 H6R PA 1441 9.803 100.009 33.951 1.00 0.00 H ATOM 59288 H6S PA 1441 9.199 98.368 33.403 1.00 0.00 H ATOM 59289 C15 PA 1441 10.171 99.627 31.916 1.00 0.00 C ATOM 59290 H5R PA 1441 9.140 99.847 31.630 1.00 0.00 H ATOM 59291 H5S PA 1441 10.380 98.700 31.378 1.00 0.00 H ATOM 59292 C14 PA 1441 11.078 100.826 31.565 1.00 0.00 C ATOM 59293 H4R PA 1441 12.092 100.650 31.929 1.00 0.00 H ATOM 59294 H4S PA 1441 10.706 101.693 32.115 1.00 0.00 H ATOM 59295 C13 PA 1441 11.099 101.117 30.099 1.00 0.00 C ATOM 59296 H3R PA 1441 10.303 100.655 29.510 1.00 0.00 H ATOM 59297 H3S PA 1441 11.997 100.598 29.758 1.00 0.00 H ATOM 59298 C12 PA 1441 11.116 102.588 29.661 1.00 0.00 C ATOM 59299 H2R PA 1441 11.709 103.200 30.343 1.00 0.00 H ATOM 59300 H2S PA 1441 10.118 103.022 29.563 1.00 0.00 H ATOM 59301 C11 PGR 1442 11.668 102.716 28.217 1.00 0.00 C ATOM 59302 O12 PGR 1442 11.388 101.882 27.412 1.00 0.00 O ATOM 59303 O11 PGR 1442 12.491 103.810 27.922 1.00 0.00 O ATOM 59304 C1 PGR 1442 13.197 103.620 26.626 1.00 0.00 C ATOM 59305 HR PGR 1442 12.360 103.511 25.931 1.00 0.00 H ATOM 59306 HS PGR 1442 13.786 102.701 26.680 1.00 0.00 H ATOM 59307 C2 PGR 1442 14.076 104.873 26.335 1.00 0.00 C ATOM 59308 HX PGR 1442 13.416 105.743 26.377 1.00 0.00 H ATOM 59309 C3 PGR 1442 14.551 104.742 24.929 1.00 0.00 C ATOM 59310 HA PGR 1442 13.730 104.529 24.240 1.00 0.00 H ATOM 59311 HB PGR 1442 15.297 103.947 25.010 1.00 0.00 H ATOM 59312 O31 PGR 1442 15.173 106.049 24.749 1.00 0.00 O ATOM 59313 P31 PGR 1442 16.019 106.377 23.438 1.00 0.00 P ATOM 59314 O32 PGR 1442 17.280 105.423 23.672 1.00 0.00 O ATOM 59315 C31 PGR 1442 18.601 105.982 23.793 1.00 0.00 C ATOM 59316 H1A PGR 1442 18.683 106.709 24.604 1.00 0.00 H ATOM 59317 H1B PGR 1442 18.821 106.411 22.812 1.00 0.00 H ATOM 59318 C32 PGR 1442 19.624 104.817 24.153 1.00 0.00 C ATOM 59319 H2A PGR 1442 20.628 105.140 24.440 1.00 0.00 H ATOM 59320 O35 PGR 1442 19.685 103.836 23.097 1.00 0.00 O ATOM 59321 HO5A PGR 1442 20.274 103.155 23.468 1.00 0.00 H ATOM 59322 C33 PGR 1442 19.124 104.240 25.512 1.00 0.00 C ATOM 59323 H3A PGR 1442 19.762 104.505 26.359 1.00 0.00 H ATOM 59324 H3B PGR 1442 18.189 104.721 25.811 1.00 0.00 H ATOM 59325 O33 PGR 1442 15.231 105.920 22.271 1.00 0.00 O ATOM 59326 O34 PGR 1442 16.518 107.790 23.435 1.00 0.00 O ATOM 59327 O21 PGR 1442 15.107 104.929 27.261 1.00 0.00 O ATOM 59328 C21 PGR 1442 15.374 106.176 27.797 1.00 0.00 C ATOM 59329 O22 PGR 1442 14.681 107.154 27.689 1.00 0.00 O ATOM 59330 O36 PGR 1442 18.948 102.777 25.464 1.00 0.00 O ATOM 59331 HO6A PGR 1442 18.364 102.558 24.716 1.00 0.00 H ATOM 59332 C12 OL 1443 16.724 106.212 28.470 1.00 0.00 C ATOM 59333 H2R OL 1443 16.773 105.464 29.263 1.00 0.00 H ATOM 59334 H2S OL 1443 17.562 105.893 27.847 1.00 0.00 H ATOM 59335 C13 OL 1443 16.961 107.510 29.190 1.00 0.00 C ATOM 59336 H3R OL 1443 16.221 107.693 29.973 1.00 0.00 H ATOM 59337 H3S OL 1443 17.829 107.400 29.843 1.00 0.00 H ATOM 59338 C14 OL 1443 17.211 108.771 28.297 1.00 0.00 C ATOM 59339 H4R OL 1443 18.248 108.747 27.955 1.00 0.00 H ATOM 59340 H4S OL 1443 16.604 108.638 27.399 1.00 0.00 H ATOM 59341 C15 OL 1443 16.736 110.084 28.940 1.00 0.00 C ATOM 59342 H5R OL 1443 16.820 110.868 28.184 1.00 0.00 H ATOM 59343 H5S OL 1443 15.666 109.989 29.140 1.00 0.00 H ATOM 59344 C16 OL 1443 17.512 110.417 30.177 1.00 0.00 C ATOM 59345 H6R OL 1443 17.154 109.791 30.998 1.00 0.00 H ATOM 59346 H6S OL 1443 18.578 110.220 30.044 1.00 0.00 H ATOM 59347 C17 OL 1443 17.357 111.831 30.604 1.00 0.00 C ATOM 59348 H7R OL 1443 17.856 112.513 29.914 1.00 0.00 H ATOM 59349 H7S OL 1443 16.301 112.098 30.678 1.00 0.00 H ATOM 59350 C18 OL 1443 18.262 112.129 31.829 1.00 0.00 C ATOM 59351 H8R OL 1443 18.324 111.270 32.500 1.00 0.00 H ATOM 59352 H8S OL 1443 19.316 112.160 31.542 1.00 0.00 H ATOM 59353 C19 OL 1443 17.915 113.235 32.780 1.00 0.00 C ATOM 59354 H9R OL 1443 16.855 113.371 32.978 1.00 0.00 H ATOM 59355 C110 OL 1443 18.639 114.219 33.294 1.00 0.00 C ATOM 59356 H10R OL 1443 18.230 114.896 34.041 1.00 0.00 H ATOM 59357 C111 OL 1443 20.132 114.240 33.017 1.00 0.00 C ATOM 59358 H11R OL 1443 20.248 114.090 31.941 1.00 0.00 H ATOM 59359 H11S OL 1443 20.567 115.232 33.148 1.00 0.00 H ATOM 59360 C112 OL 1443 20.984 113.272 33.856 1.00 0.00 C ATOM 59361 H12R OL 1443 20.843 112.245 33.513 1.00 0.00 H ATOM 59362 H12S OL 1443 22.047 113.513 33.790 1.00 0.00 H ATOM 59363 C113 OL 1443 20.641 113.448 35.405 1.00 0.00 C ATOM 59364 H13R OL 1443 20.864 114.502 35.586 1.00 0.00 H ATOM 59365 H13S OL 1443 19.574 113.274 35.560 1.00 0.00 H ATOM 59366 C114 OL 1443 21.533 112.624 36.313 1.00 0.00 C ATOM 59367 H14R OL 1443 22.567 112.955 36.202 1.00 0.00 H ATOM 59368 H14S OL 1443 21.279 112.874 37.346 1.00 0.00 H ATOM 59369 C115 OL 1443 21.657 111.105 36.049 1.00 0.00 C ATOM 59370 H15R OL 1443 21.958 110.846 35.032 1.00 0.00 H ATOM 59371 H15S OL 1443 22.478 110.891 36.736 1.00 0.00 H ATOM 59372 C116 OL 1443 20.383 110.333 36.437 1.00 0.00 C ATOM 59373 H16R OL 1443 20.568 109.295 36.721 1.00 0.00 H ATOM 59374 H16S OL 1443 20.198 110.895 37.355 1.00 0.00 H ATOM 59375 C117 OL 1443 19.255 110.274 35.359 1.00 0.00 C ATOM 59376 H17R OL 1443 19.282 111.237 34.844 1.00 0.00 H ATOM 59377 H17S OL 1443 19.543 109.551 34.593 1.00 0.00 H ATOM 59378 C118 OL 1443 18.030 109.626 35.831 1.00 0.00 C ATOM 59379 H18R OL 1443 17.466 110.292 36.488 1.00 0.00 H ATOM 59380 H18S OL 1443 18.249 108.685 36.340 1.00 0.00 H ATOM 59381 H18T OL 1443 17.398 109.473 34.954 1.00 0.00 H TER 59382 OL 1443 ATOM 59382 C116 PA 1444 67.798 124.205 38.063 1.00 0.00 C ATOM 59383 H16R PA 1444 68.731 124.633 37.691 1.00 0.00 H ATOM 59384 H16S PA 1444 67.838 123.118 37.965 1.00 0.00 H ATOM 59385 H16T PA 1444 67.663 124.468 39.114 1.00 0.00 H ATOM 59386 C115 PA 1444 66.779 124.858 37.074 1.00 0.00 C ATOM 59387 H15R PA 1444 66.471 125.817 37.494 1.00 0.00 H ATOM 59388 H15S PA 1444 65.777 124.437 37.176 1.00 0.00 H ATOM 59389 C114 PA 1444 67.306 125.129 35.579 1.00 0.00 C ATOM 59390 H14R PA 1444 68.398 125.108 35.553 1.00 0.00 H ATOM 59391 H14S PA 1444 66.867 126.017 35.119 1.00 0.00 H ATOM 59392 C113 PA 1444 66.915 123.936 34.768 1.00 0.00 C ATOM 59393 H13R PA 1444 65.869 123.630 34.834 1.00 0.00 H ATOM 59394 H13S PA 1444 67.531 123.081 35.055 1.00 0.00 H ATOM 59395 C112 PA 1444 67.082 124.095 33.220 1.00 0.00 C ATOM 59396 H12R PA 1444 67.169 123.125 32.726 1.00 0.00 H ATOM 59397 H12S PA 1444 68.006 124.546 32.851 1.00 0.00 H ATOM 59398 C111 PA 1444 66.124 124.883 32.503 1.00 0.00 C ATOM 59399 H11R PA 1444 66.391 125.902 32.791 1.00 0.00 H ATOM 59400 H11S PA 1444 65.116 124.716 32.889 1.00 0.00 H ATOM 59401 C110 PA 1444 66.252 124.829 30.972 1.00 0.00 C ATOM 59402 H10R PA 1444 65.979 123.857 30.556 1.00 0.00 H ATOM 59403 H10S PA 1444 67.295 124.955 30.672 1.00 0.00 H ATOM 59404 C19 PA 1444 65.459 125.904 30.270 1.00 0.00 C ATOM 59405 H9R PA 1444 65.724 126.913 30.592 1.00 0.00 H ATOM 59406 H9S PA 1444 64.399 125.709 30.451 1.00 0.00 H ATOM 59407 C18 PA 1444 65.628 125.806 28.790 1.00 0.00 C ATOM 59408 H8R PA 1444 65.135 124.905 28.418 1.00 0.00 H ATOM 59409 H8S PA 1444 66.654 125.637 28.456 1.00 0.00 H ATOM 59410 C17 PA 1444 65.064 126.976 27.985 1.00 0.00 C ATOM 59411 H7R PA 1444 65.550 127.904 28.293 1.00 0.00 H ATOM 59412 H7S PA 1444 64.092 127.226 28.413 1.00 0.00 H ATOM 59413 C16 PA 1444 64.835 126.755 26.532 1.00 0.00 C ATOM 59414 H6R PA 1444 64.152 125.904 26.559 1.00 0.00 H ATOM 59415 H6S PA 1444 65.766 126.417 26.070 1.00 0.00 H ATOM 59416 C15 PA 1444 64.259 127.980 25.813 1.00 0.00 C ATOM 59417 H5R PA 1444 65.097 128.680 25.810 1.00 0.00 H ATOM 59418 H5S PA 1444 63.415 128.458 26.316 1.00 0.00 H ATOM 59419 C14 PA 1444 63.851 127.653 24.354 1.00 0.00 C ATOM 59420 H4R PA 1444 63.206 126.773 24.316 1.00 0.00 H ATOM 59421 H4S PA 1444 64.705 127.457 23.704 1.00 0.00 H ATOM 59422 C13 PA 1444 63.051 128.842 23.758 1.00 0.00 C ATOM 59423 H3R PA 1444 63.855 129.540 23.517 1.00 0.00 H ATOM 59424 H3S PA 1444 62.257 129.207 24.413 1.00 0.00 H ATOM 59425 C12 PA 1444 62.391 128.408 22.378 1.00 0.00 C ATOM 59426 H2R PA 1444 61.555 127.798 22.726 1.00 0.00 H ATOM 59427 H2S PA 1444 63.015 127.685 21.848 1.00 0.00 H ATOM 59428 C11 PGR 1445 61.598 129.368 21.567 1.00 0.00 C ATOM 59429 O12 PGR 1445 61.346 129.162 20.384 1.00 0.00 O ATOM 59430 O11 PGR 1445 61.426 130.609 22.130 1.00 0.00 O ATOM 59431 C1 PGR 1445 60.719 131.615 21.385 1.00 0.00 C ATOM 59432 HR PGR 1445 61.037 131.674 20.341 1.00 0.00 H ATOM 59433 HS PGR 1445 60.733 132.610 21.837 1.00 0.00 H ATOM 59434 C2 PGR 1445 59.236 131.221 21.333 1.00 0.00 C ATOM 59435 HX PGR 1445 59.135 130.182 21.009 1.00 0.00 H ATOM 59436 C3 PGR 1445 58.465 132.190 20.478 1.00 0.00 C ATOM 59437 HA PGR 1445 58.794 132.331 19.445 1.00 0.00 H ATOM 59438 HB PGR 1445 58.212 133.136 20.963 1.00 0.00 H ATOM 59439 O31 PGR 1445 57.171 131.609 20.239 1.00 0.00 O ATOM 59440 P31 PGR 1445 55.931 132.370 19.415 1.00 0.00 P ATOM 59441 O32 PGR 1445 54.642 131.671 20.040 1.00 0.00 O ATOM 59442 C31 PGR 1445 54.010 132.040 21.268 1.00 0.00 C ATOM 59443 H1A PGR 1445 53.564 133.032 21.162 1.00 0.00 H ATOM 59444 H1B PGR 1445 54.803 132.065 22.020 1.00 0.00 H ATOM 59445 C32 PGR 1445 53.088 130.912 21.736 1.00 0.00 C ATOM 59446 H2A PGR 1445 52.575 131.156 22.670 1.00 0.00 H ATOM 59447 O35 PGR 1445 53.867 129.726 21.948 1.00 0.00 O ATOM 59448 HO5A PGR 1445 54.572 129.708 21.275 1.00 0.00 H ATOM 59449 C33 PGR 1445 51.875 130.637 20.602 1.00 0.00 C ATOM 59450 H3A PGR 1445 51.356 131.584 20.429 1.00 0.00 H ATOM 59451 H3B PGR 1445 52.321 130.182 19.714 1.00 0.00 H ATOM 59452 O33 PGR 1445 55.722 133.788 19.890 1.00 0.00 O ATOM 59453 O34 PGR 1445 55.987 132.019 18.011 1.00 0.00 O ATOM 59454 O21 PGR 1445 58.684 131.362 22.651 1.00 0.00 O ATOM 59455 C21 PGR 1445 57.676 130.534 22.886 1.00 0.00 C ATOM 59456 O22 PGR 1445 57.516 129.441 22.357 1.00 0.00 O ATOM 59457 O36 PGR 1445 50.827 129.813 21.099 1.00 0.00 O ATOM 59458 HO6A PGR 1445 51.236 128.930 21.064 1.00 0.00 H ATOM 59459 C12 OL 1446 56.907 130.901 24.148 1.00 0.00 C ATOM 59460 H2R OL 1446 55.913 130.457 24.062 1.00 0.00 H ATOM 59461 H2S OL 1446 57.352 130.470 25.047 1.00 0.00 H ATOM 59462 C13 OL 1446 56.652 132.407 24.295 1.00 0.00 C ATOM 59463 H3R OL 1446 56.217 133.048 23.526 1.00 0.00 H ATOM 59464 H3S OL 1446 55.883 132.506 25.064 1.00 0.00 H ATOM 59465 C14 OL 1446 57.819 133.167 24.994 1.00 0.00 C ATOM 59466 H4R OL 1446 57.726 133.148 26.082 1.00 0.00 H ATOM 59467 H4S OL 1446 58.755 132.660 24.752 1.00 0.00 H ATOM 59468 C15 OL 1446 58.036 134.610 24.595 1.00 0.00 C ATOM 59469 H5R OL 1446 58.449 134.685 23.587 1.00 0.00 H ATOM 59470 H5S OL 1446 57.047 135.073 24.598 1.00 0.00 H ATOM 59471 C16 OL 1446 59.025 135.347 25.614 1.00 0.00 C ATOM 59472 H6R OL 1446 58.842 135.121 26.666 1.00 0.00 H ATOM 59473 H6S OL 1446 60.036 134.958 25.481 1.00 0.00 H ATOM 59474 C17 OL 1446 59.086 136.918 25.322 1.00 0.00 C ATOM 59475 H7R OL 1446 59.186 137.140 24.257 1.00 0.00 H ATOM 59476 H7S OL 1446 58.152 137.349 25.689 1.00 0.00 H ATOM 59477 C18 OL 1446 60.288 137.618 25.968 1.00 0.00 C ATOM 59478 H8R OL 1446 60.241 137.540 27.056 1.00 0.00 H ATOM 59479 H8S OL 1446 61.163 137.176 25.486 1.00 0.00 H ATOM 59480 C19 OL 1446 60.127 139.037 25.628 1.00 0.00 C ATOM 59481 H9R OL 1446 60.160 139.322 24.580 1.00 0.00 H ATOM 59482 C110 OL 1446 59.736 140.049 26.472 1.00 0.00 C ATOM 59483 H10R OL 1446 59.682 141.001 25.950 1.00 0.00 H ATOM 59484 C111 OL 1446 59.560 139.986 27.965 1.00 0.00 C ATOM 59485 H11R OL 1446 58.944 140.819 28.312 1.00 0.00 H ATOM 59486 H11S OL 1446 58.986 139.061 28.050 1.00 0.00 H ATOM 59487 C112 OL 1446 60.825 140.192 28.792 1.00 0.00 C ATOM 59488 H12R OL 1446 61.592 139.415 28.804 1.00 0.00 H ATOM 59489 H12S OL 1446 61.356 141.045 28.364 1.00 0.00 H ATOM 59490 C113 OL 1446 60.520 140.457 30.267 1.00 0.00 C ATOM 59491 H13R OL 1446 61.508 140.470 30.733 1.00 0.00 H ATOM 59492 H13S OL 1446 59.993 141.402 30.419 1.00 0.00 H ATOM 59493 C114 OL 1446 59.701 139.283 30.823 1.00 0.00 C ATOM 59494 H14R OL 1446 58.789 139.082 30.257 1.00 0.00 H ATOM 59495 H14S OL 1446 60.261 138.352 30.715 1.00 0.00 H ATOM 59496 C115 OL 1446 59.340 139.459 32.297 1.00 0.00 C ATOM 59497 H15R OL 1446 60.202 139.624 32.947 1.00 0.00 H ATOM 59498 H15S OL 1446 58.723 140.359 32.341 1.00 0.00 H ATOM 59499 C116 OL 1446 58.485 138.287 32.723 1.00 0.00 C ATOM 59500 H16R OL 1446 57.724 138.062 31.971 1.00 0.00 H ATOM 59501 H16S OL 1446 59.087 137.377 32.763 1.00 0.00 H ATOM 59502 C117 OL 1446 57.794 138.469 34.028 1.00 0.00 C ATOM 59503 H17R OL 1446 58.565 138.652 34.778 1.00 0.00 H ATOM 59504 H17S OL 1446 57.170 139.365 33.996 1.00 0.00 H ATOM 59505 C118 OL 1446 56.939 137.238 34.465 1.00 0.00 C ATOM 59506 H18R OL 1446 56.515 136.610 33.678 1.00 0.00 H ATOM 59507 H18S OL 1446 56.124 137.543 35.124 1.00 0.00 H ATOM 59508 H18T OL 1446 57.479 136.479 35.035 1.00 0.00 H TER 59509 OL 1446 ATOM 59509 C116 PA 1447 120.228 38.797 35.230 1.00 0.00 C ATOM 59510 H16R PA 1447 120.015 39.059 34.191 1.00 0.00 H ATOM 59511 H16S PA 1447 119.407 38.118 35.471 1.00 0.00 H ATOM 59512 H16T PA 1447 121.105 38.149 35.176 1.00 0.00 H ATOM 59513 C115 PA 1447 120.388 40.029 36.149 1.00 0.00 C ATOM 59514 H15R PA 1447 121.432 40.349 36.127 1.00 0.00 H ATOM 59515 H15S PA 1447 120.218 39.581 37.131 1.00 0.00 H ATOM 59516 C114 PA 1447 119.571 41.323 35.895 1.00 0.00 C ATOM 59517 H14R PA 1447 119.827 42.108 36.610 1.00 0.00 H ATOM 59518 H14S PA 1447 118.551 41.069 36.189 1.00 0.00 H ATOM 59519 C113 PA 1447 119.488 41.845 34.447 1.00 0.00 C ATOM 59520 H13R PA 1447 119.300 41.021 33.756 1.00 0.00 H ATOM 59521 H13S PA 1447 120.495 42.232 34.278 1.00 0.00 H ATOM 59522 C112 PA 1447 118.364 42.826 34.178 1.00 0.00 C ATOM 59523 H12R PA 1447 118.326 43.594 34.953 1.00 0.00 H ATOM 59524 H12S PA 1447 117.369 42.386 34.278 1.00 0.00 H ATOM 59525 C111 PA 1447 118.568 43.570 32.851 1.00 0.00 C ATOM 59526 H11R PA 1447 119.500 44.125 32.975 1.00 0.00 H ATOM 59527 H11S PA 1447 117.717 44.229 32.666 1.00 0.00 H ATOM 59528 C110 PA 1447 118.587 42.633 31.650 1.00 0.00 C ATOM 59529 H10R PA 1447 117.572 42.231 31.607 1.00 0.00 H ATOM 59530 H10S PA 1447 119.276 41.811 31.852 1.00 0.00 H ATOM 59531 C19 PA 1447 119.058 43.157 30.324 1.00 0.00 C ATOM 59532 H9R PA 1447 120.112 43.397 30.482 1.00 0.00 H ATOM 59533 H9S PA 1447 118.560 44.114 30.151 1.00 0.00 H ATOM 59534 C18 PA 1447 118.885 42.305 29.074 1.00 0.00 C ATOM 59535 H8R PA 1447 117.850 41.957 29.092 1.00 0.00 H ATOM 59536 H8S PA 1447 119.568 41.477 29.274 1.00 0.00 H ATOM 59537 C17 PA 1447 119.248 43.033 27.728 1.00 0.00 C ATOM 59538 H7R PA 1447 118.640 43.882 27.407 1.00 0.00 H ATOM 59539 H7S PA 1447 119.337 42.305 26.918 1.00 0.00 H ATOM 59540 C16 PA 1447 120.677 43.566 27.829 1.00 0.00 C ATOM 59541 H6R PA 1447 121.369 42.939 28.395 1.00 0.00 H ATOM 59542 H6S PA 1447 120.627 44.520 28.358 1.00 0.00 H ATOM 59543 C15 PA 1447 121.279 43.867 26.502 1.00 0.00 C ATOM 59544 H5R PA 1447 120.799 44.749 26.074 1.00 0.00 H ATOM 59545 H5S PA 1447 121.166 43.100 25.733 1.00 0.00 H ATOM 59546 C14 PA 1447 122.802 44.322 26.520 1.00 0.00 C ATOM 59547 H4R PA 1447 123.154 45.110 27.189 1.00 0.00 H ATOM 59548 H4S PA 1447 123.121 44.533 25.497 1.00 0.00 H ATOM 59549 C13 PA 1447 123.823 43.261 26.912 1.00 0.00 C ATOM 59550 H3R PA 1447 123.712 42.361 26.303 1.00 0.00 H ATOM 59551 H3S PA 1447 123.504 42.971 27.916 1.00 0.00 H ATOM 59552 C12 PA 1447 125.228 43.816 26.903 1.00 0.00 C ATOM 59553 H2R PA 1447 125.978 43.186 27.386 1.00 0.00 H ATOM 59554 H2S PA 1447 125.307 44.869 27.181 1.00 0.00 H ATOM 59555 C11 PGR 1448 125.720 43.889 25.466 1.00 0.00 C ATOM 59556 O12 PGR 1448 125.814 44.983 24.902 1.00 0.00 O ATOM 59557 O11 PGR 1448 126.012 42.665 24.927 1.00 0.00 O ATOM 59558 C1 PGR 1448 126.509 42.601 23.580 1.00 0.00 C ATOM 59559 HR PGR 1448 125.876 43.179 22.901 1.00 0.00 H ATOM 59560 HS PGR 1448 126.378 41.560 23.274 1.00 0.00 H ATOM 59561 C2 PGR 1448 128.005 42.923 23.520 1.00 0.00 C ATOM 59562 HX PGR 1448 128.099 44.002 23.671 1.00 0.00 H ATOM 59563 C3 PGR 1448 128.483 42.605 22.077 1.00 0.00 C ATOM 59564 HA PGR 1448 127.716 42.878 21.347 1.00 0.00 H ATOM 59565 HB PGR 1448 128.665 41.532 21.975 1.00 0.00 H ATOM 59566 O31 PGR 1448 129.723 43.318 21.907 1.00 0.00 O ATOM 59567 P31 PGR 1448 130.547 43.295 20.537 1.00 0.00 P ATOM 59568 O32 PGR 1448 129.786 44.178 19.555 1.00 0.00 O ATOM 59569 C31 PGR 1448 129.745 45.523 19.763 1.00 0.00 C ATOM 59570 H1A PGR 1448 130.770 45.854 19.952 1.00 0.00 H ATOM 59571 H1B PGR 1448 129.170 45.607 20.688 1.00 0.00 H ATOM 59572 C32 PGR 1448 129.052 46.352 18.671 1.00 0.00 C ATOM 59573 H2A PGR 1448 129.358 47.377 18.896 1.00 0.00 H ATOM 59574 O35 PGR 1448 127.625 46.115 18.901 1.00 0.00 O ATOM 59575 HO5A PGR 1448 127.512 46.309 19.848 1.00 0.00 H ATOM 59576 C33 PGR 1448 129.366 45.911 17.255 1.00 0.00 C ATOM 59577 H3A PGR 1448 128.822 46.623 16.629 1.00 0.00 H ATOM 59578 H3B PGR 1448 130.441 45.948 17.060 1.00 0.00 H ATOM 59579 O33 PGR 1448 131.911 43.906 20.743 1.00 0.00 O ATOM 59580 O34 PGR 1448 130.400 41.939 19.935 1.00 0.00 O ATOM 59581 O21 PGR 1448 128.734 42.095 24.431 1.00 0.00 O ATOM 59582 C21 PGR 1448 128.903 42.298 25.723 1.00 0.00 C ATOM 59583 O22 PGR 1448 128.545 43.321 26.246 1.00 0.00 O ATOM 59584 O36 PGR 1448 128.791 44.548 17.097 1.00 0.00 O ATOM 59585 HO6A PGR 1448 129.239 43.942 17.714 1.00 0.00 H ATOM 59586 C12 OL 1449 129.461 41.190 26.572 1.00 0.00 C ATOM 59587 H2R OL 1449 129.765 40.364 25.926 1.00 0.00 H ATOM 59588 H2S OL 1449 130.348 41.599 27.060 1.00 0.00 H ATOM 59589 C13 OL 1449 128.488 40.709 27.634 1.00 0.00 C ATOM 59590 H3R OL 1449 128.956 39.846 28.111 1.00 0.00 H ATOM 59591 H3S OL 1449 128.300 41.476 28.389 1.00 0.00 H ATOM 59592 C14 OL 1449 127.212 40.177 27.011 1.00 0.00 C ATOM 59593 H4R OL 1449 126.697 40.885 26.359 1.00 0.00 H ATOM 59594 H4S OL 1449 127.446 39.320 26.377 1.00 0.00 H ATOM 59595 C15 OL 1449 126.144 39.815 28.094 1.00 0.00 C ATOM 59596 H5R OL 1449 126.385 38.900 28.639 1.00 0.00 H ATOM 59597 H5S OL 1449 125.994 40.658 28.772 1.00 0.00 H ATOM 59598 C16 OL 1449 124.738 39.700 27.521 1.00 0.00 C ATOM 59599 H6R OL 1449 124.393 40.669 27.154 1.00 0.00 H ATOM 59600 H6S OL 1449 124.806 39.028 26.662 1.00 0.00 H ATOM 59601 C17 OL 1449 123.774 39.068 28.519 1.00 0.00 C ATOM 59602 H7R OL 1449 123.480 38.053 28.246 1.00 0.00 H ATOM 59603 H7S OL 1449 124.240 38.950 29.500 1.00 0.00 H ATOM 59604 C18 OL 1449 122.430 39.875 28.713 1.00 0.00 C ATOM 59605 H8R OL 1449 122.706 40.924 28.589 1.00 0.00 H ATOM 59606 H8S OL 1449 121.731 39.669 27.900 1.00 0.00 H ATOM 59607 C19 OL 1449 121.641 39.548 29.929 1.00 0.00 C ATOM 59608 H9R OL 1449 120.966 38.704 29.814 1.00 0.00 H ATOM 59609 C110 OL 1449 121.632 40.166 31.146 1.00 0.00 C ATOM 59610 H10R OL 1449 121.043 39.803 31.985 1.00 0.00 H ATOM 59611 C111 OL 1449 122.394 41.358 31.558 1.00 0.00 C ATOM 59612 H11R OL 1449 123.019 41.671 30.719 1.00 0.00 H ATOM 59613 H11S OL 1449 121.752 42.229 31.704 1.00 0.00 H ATOM 59614 C112 OL 1449 123.178 40.989 32.803 1.00 0.00 C ATOM 59615 H12R OL 1449 122.549 40.585 33.598 1.00 0.00 H ATOM 59616 H12S OL 1449 123.794 40.104 32.636 1.00 0.00 H ATOM 59617 C113 OL 1449 124.047 42.097 33.425 1.00 0.00 C ATOM 59618 H13R OL 1449 124.671 41.604 34.173 1.00 0.00 H ATOM 59619 H13S OL 1449 124.588 42.599 32.620 1.00 0.00 H ATOM 59620 C114 OL 1449 123.314 43.138 34.288 1.00 0.00 C ATOM 59621 H14R OL 1449 122.727 43.857 33.713 1.00 0.00 H ATOM 59622 H14S OL 1449 122.535 42.640 34.869 1.00 0.00 H ATOM 59623 C115 OL 1449 124.278 43.940 35.204 1.00 0.00 C ATOM 59624 H15R OL 1449 124.895 43.284 35.821 1.00 0.00 H ATOM 59625 H15S OL 1449 124.837 44.643 34.582 1.00 0.00 H ATOM 59626 C116 OL 1449 123.721 44.941 36.129 1.00 0.00 C ATOM 59627 H16R OL 1449 123.036 45.626 35.625 1.00 0.00 H ATOM 59628 H16S OL 1449 123.058 44.523 36.889 1.00 0.00 H ATOM 59629 C117 OL 1449 124.845 45.729 36.902 1.00 0.00 C ATOM 59630 H17R OL 1449 125.571 45.095 37.415 1.00 0.00 H ATOM 59631 H17S OL 1449 125.408 46.358 36.209 1.00 0.00 H ATOM 59632 C118 OL 1449 124.218 46.730 37.866 1.00 0.00 C ATOM 59633 H18R OL 1449 123.616 47.465 37.330 1.00 0.00 H ATOM 59634 H18S OL 1449 124.985 47.270 38.426 1.00 0.00 H ATOM 59635 H18T OL 1449 123.642 46.137 38.579 1.00 0.00 H TER 59636 OL 1449 ATOM 59636 C116 PA 1450 28.227 5.761 43.898 1.00 0.00 C ATOM 59637 H16R PA 1450 27.346 5.560 44.511 1.00 0.00 H ATOM 59638 H16S PA 1450 28.697 6.695 44.214 1.00 0.00 H ATOM 59639 H16T PA 1450 28.893 4.910 44.059 1.00 0.00 H ATOM 59640 C115 PA 1450 28.048 5.943 42.392 1.00 0.00 C ATOM 59641 H15R PA 1450 29.070 5.926 42.007 1.00 0.00 H ATOM 59642 H15S PA 1450 27.552 6.880 42.129 1.00 0.00 H ATOM 59643 C114 PA 1450 27.135 4.787 41.713 1.00 0.00 C ATOM 59644 H14R PA 1450 26.197 4.557 42.222 1.00 0.00 H ATOM 59645 H14S PA 1450 27.773 3.902 41.674 1.00 0.00 H ATOM 59646 C113 PA 1450 26.768 5.182 40.266 1.00 0.00 C ATOM 59647 H13R PA 1450 27.722 5.481 39.825 1.00 0.00 H ATOM 59648 H13S PA 1450 26.165 6.090 40.331 1.00 0.00 H ATOM 59649 C112 PA 1450 26.063 4.228 39.369 1.00 0.00 C ATOM 59650 H12R PA 1450 24.984 4.329 39.501 1.00 0.00 H ATOM 59651 H12S PA 1450 26.302 3.218 39.707 1.00 0.00 H ATOM 59652 C111 PA 1450 26.198 4.464 37.855 1.00 0.00 C ATOM 59653 H11R PA 1450 25.837 5.464 37.606 1.00 0.00 H ATOM 59654 H11S PA 1450 25.420 3.816 37.446 1.00 0.00 H ATOM 59655 C110 PA 1450 27.589 4.373 37.313 1.00 0.00 C ATOM 59656 H10R PA 1450 28.080 3.411 37.472 1.00 0.00 H ATOM 59657 H10S PA 1450 28.260 5.002 37.904 1.00 0.00 H ATOM 59658 C19 PA 1450 27.659 4.772 35.846 1.00 0.00 C ATOM 59659 H9R PA 1450 28.627 5.257 35.699 1.00 0.00 H ATOM 59660 H9S PA 1450 26.900 5.548 35.728 1.00 0.00 H ATOM 59661 C18 PA 1450 27.486 3.565 34.903 1.00 0.00 C ATOM 59662 H8R PA 1450 26.638 2.958 35.227 1.00 0.00 H ATOM 59663 H8S PA 1450 28.286 2.855 35.124 1.00 0.00 H ATOM 59664 C17 PA 1450 27.193 3.860 33.391 1.00 0.00 C ATOM 59665 H7R PA 1450 27.753 4.729 33.038 1.00 0.00 H ATOM 59666 H7S PA 1450 26.154 4.171 33.520 1.00 0.00 H ATOM 59667 C16 PA 1450 27.195 2.511 32.658 1.00 0.00 C ATOM 59668 H6R PA 1450 26.167 2.161 32.772 1.00 0.00 H ATOM 59669 H6S PA 1450 27.860 1.790 33.137 1.00 0.00 H ATOM 59670 C15 PA 1450 27.504 2.654 31.162 1.00 0.00 C ATOM 59671 H5R PA 1450 28.508 3.081 31.119 1.00 0.00 H ATOM 59672 H5S PA 1450 26.724 3.313 30.776 1.00 0.00 H ATOM 59673 C14 PA 1450 27.439 1.327 30.411 1.00 0.00 C ATOM 59674 H4R PA 1450 26.489 0.833 30.627 1.00 0.00 H ATOM 59675 H4S PA 1450 28.223 0.663 30.783 1.00 0.00 H ATOM 59676 C13 PA 1450 27.665 1.536 28.899 1.00 0.00 C ATOM 59677 H3R PA 1450 28.711 1.650 28.604 1.00 0.00 H ATOM 59678 H3S PA 1450 27.277 2.495 28.549 1.00 0.00 H ATOM 59679 C12 PA 1450 27.022 0.462 28.040 1.00 0.00 C ATOM 59680 H2R PA 1450 26.002 0.329 28.407 1.00 0.00 H ATOM 59681 H2S PA 1450 27.527 -0.504 28.095 1.00 0.00 H ATOM 59682 C11 PC 1451 26.960 0.823 26.639 1.00 0.00 C ATOM 59683 O12 PC 1451 27.707 1.554 26.091 1.00 0.00 O ATOM 59684 O11 PC 1451 25.944 0.161 26.012 1.00 0.00 O ATOM 59685 C1 PC 1451 25.709 0.510 24.632 1.00 0.00 C ATOM 59686 HR PC 1451 26.615 0.373 24.037 1.00 0.00 H ATOM 59687 HS PC 1451 25.394 1.553 24.539 1.00 0.00 H ATOM 59688 C2 PC 1451 24.497 -0.212 24.049 1.00 0.00 C ATOM 59689 HX PC 1451 24.539 -1.303 24.116 1.00 0.00 H ATOM 59690 C3 PC 1451 24.493 0.151 22.575 1.00 0.00 C ATOM 59691 HA PC 1451 25.407 -0.120 22.040 1.00 0.00 H ATOM 59692 HB PC 1451 24.364 1.232 22.482 1.00 0.00 H ATOM 59693 O31 PC 1451 23.468 -0.623 22.032 1.00 0.00 O ATOM 59694 P31 PC 1451 23.254 -0.514 20.472 1.00 0.00 P ATOM 59695 O32 PC 1451 21.771 0.065 20.180 1.00 0.00 O ATOM 59696 C31 PC 1451 21.651 1.212 19.430 1.00 0.00 C ATOM 59697 H1A PC 1451 22.107 1.087 18.445 1.00 0.00 H ATOM 59698 H1B PC 1451 22.185 2.010 19.954 1.00 0.00 H ATOM 59699 C32 PC 1451 20.086 1.352 19.435 1.00 0.00 C ATOM 59700 H2A PC 1451 19.890 1.556 20.489 1.00 0.00 H ATOM 59701 H2B PC 1451 19.626 0.416 19.114 1.00 0.00 H ATOM 59702 N31 PC 1451 19.477 2.543 18.647 1.00 0.00 N ATOM 59703 C33 PC 1451 18.110 2.615 19.070 1.00 0.00 C ATOM 59704 H3A PC 1451 17.626 1.755 18.604 1.00 0.00 H ATOM 59705 H3B PC 1451 17.727 3.527 18.610 1.00 0.00 H ATOM 59706 H3C PC 1451 18.057 2.619 20.160 1.00 0.00 H ATOM 59707 C34 PC 1451 20.068 3.887 19.015 1.00 0.00 C ATOM 59708 H4A PC 1451 20.026 4.135 20.076 1.00 0.00 H ATOM 59709 H4B PC 1451 19.402 4.639 18.590 1.00 0.00 H ATOM 59710 H4C PC 1451 21.056 4.062 18.588 1.00 0.00 H ATOM 59711 C35 PC 1451 19.631 2.322 17.167 1.00 0.00 C ATOM 59712 H5A PC 1451 20.659 2.022 16.959 1.00 0.00 H ATOM 59713 H5B PC 1451 19.219 3.207 16.680 1.00 0.00 H ATOM 59714 H5C PC 1451 18.930 1.511 16.961 1.00 0.00 H ATOM 59715 O33 PC 1451 24.243 0.464 19.903 1.00 0.00 O ATOM 59716 O34 PC 1451 23.236 -1.896 19.920 1.00 0.00 O ATOM 59717 O21 PC 1451 23.309 0.336 24.674 1.00 0.00 O ATOM 59718 C21 PC 1451 22.876 -0.222 25.835 1.00 0.00 C ATOM 59719 O22 PC 1451 23.133 -1.383 26.202 1.00 0.00 O ATOM 59720 C12 OL 1452 21.757 0.522 26.604 1.00 0.00 C ATOM 59721 H2R OL 1452 21.589 1.450 26.055 1.00 0.00 H ATOM 59722 H2S OL 1452 20.899 -0.150 26.536 1.00 0.00 H ATOM 59723 C13 OL 1452 22.156 0.780 28.090 1.00 0.00 C ATOM 59724 H3R OL 1452 21.246 1.126 28.585 1.00 0.00 H ATOM 59725 H3S OL 1452 22.477 -0.141 28.582 1.00 0.00 H ATOM 59726 C14 OL 1452 23.267 1.886 28.324 1.00 0.00 C ATOM 59727 H4R OL 1452 24.187 1.708 27.764 1.00 0.00 H ATOM 59728 H4S OL 1452 22.959 2.869 27.961 1.00 0.00 H ATOM 59729 C15 OL 1452 23.526 1.967 29.848 1.00 0.00 C ATOM 59730 H5R OL 1452 23.843 0.995 30.232 1.00 0.00 H ATOM 59731 H5S OL 1452 24.399 2.614 29.954 1.00 0.00 H ATOM 59732 C16 OL 1452 22.311 2.559 30.749 1.00 0.00 C ATOM 59733 H6R OL 1452 21.785 3.356 30.219 1.00 0.00 H ATOM 59734 H6S OL 1452 21.633 1.726 30.943 1.00 0.00 H ATOM 59735 C17 OL 1452 22.703 3.121 32.051 1.00 0.00 C ATOM 59736 H7R OL 1452 23.720 3.514 31.979 1.00 0.00 H ATOM 59737 H7S OL 1452 22.004 3.892 32.379 1.00 0.00 H ATOM 59738 C18 OL 1452 22.810 2.114 33.247 1.00 0.00 C ATOM 59739 H8R OL 1452 21.782 1.809 33.456 1.00 0.00 H ATOM 59740 H8S OL 1452 23.199 1.121 33.013 1.00 0.00 H ATOM 59741 C19 OL 1452 23.549 2.618 34.379 1.00 0.00 C ATOM 59742 H9R OL 1452 24.573 2.895 34.146 1.00 0.00 H ATOM 59743 C110 OL 1452 23.089 2.755 35.601 1.00 0.00 C ATOM 59744 H10R OL 1452 23.754 3.299 36.267 1.00 0.00 H ATOM 59745 C111 OL 1452 21.701 2.614 36.122 1.00 0.00 C ATOM 59746 H11R OL 1452 21.397 3.398 36.818 1.00 0.00 H ATOM 59747 H11S OL 1452 21.086 2.709 35.224 1.00 0.00 H ATOM 59748 C112 OL 1452 21.323 1.220 36.672 1.00 0.00 C ATOM 59749 H12R OL 1452 20.257 1.158 36.900 1.00 0.00 H ATOM 59750 H12S OL 1452 21.309 0.545 35.814 1.00 0.00 H ATOM 59751 C113 OL 1452 22.017 0.625 37.882 1.00 0.00 C ATOM 59752 H13R OL 1452 21.651 -0.395 38.012 1.00 0.00 H ATOM 59753 H13S OL 1452 23.090 0.599 37.682 1.00 0.00 H ATOM 59754 C114 OL 1452 21.819 1.422 39.161 1.00 0.00 C ATOM 59755 H14R OL 1452 22.177 2.449 39.069 1.00 0.00 H ATOM 59756 H14S OL 1452 20.741 1.476 39.326 1.00 0.00 H ATOM 59757 C115 OL 1452 22.435 0.662 40.240 1.00 0.00 C ATOM 59758 H15R OL 1452 21.841 -0.226 40.467 1.00 0.00 H ATOM 59759 H15S OL 1452 23.454 0.322 40.046 1.00 0.00 H ATOM 59760 C116 OL 1452 22.541 1.591 41.476 1.00 0.00 C ATOM 59761 H16R OL 1452 23.269 2.394 41.343 1.00 0.00 H ATOM 59762 H16S OL 1452 21.569 2.088 41.500 1.00 0.00 H ATOM 59763 C117 OL 1452 22.567 0.779 42.779 1.00 0.00 C ATOM 59764 H17R OL 1452 23.336 0.031 42.574 1.00 0.00 H ATOM 59765 H17S OL 1452 22.896 1.382 43.628 1.00 0.00 H ATOM 59766 C118 OL 1452 21.316 0.009 43.098 1.00 0.00 C ATOM 59767 H18R OL 1452 21.546 -0.803 43.791 1.00 0.00 H ATOM 59768 H18S OL 1452 21.014 -0.399 42.132 1.00 0.00 H ATOM 59769 H18T OL 1452 20.491 0.654 43.406 1.00 0.00 H TER 59770 OL 1452 ATOM 59770 C116 PA 1453 42.602 57.308 36.823 1.00 0.00 C ATOM 59771 H16R PA 1453 42.313 58.061 37.560 1.00 0.00 H ATOM 59772 H16S PA 1453 42.895 57.829 35.909 1.00 0.00 H ATOM 59773 H16T PA 1453 43.425 56.734 37.256 1.00 0.00 H ATOM 59774 C115 PA 1453 41.403 56.360 36.693 1.00 0.00 C ATOM 59775 H15R PA 1453 40.556 57.030 36.528 1.00 0.00 H ATOM 59776 H15S PA 1453 41.214 55.812 37.618 1.00 0.00 H ATOM 59777 C114 PA 1453 41.474 55.439 35.496 1.00 0.00 C ATOM 59778 H14R PA 1453 42.239 54.667 35.607 1.00 0.00 H ATOM 59779 H14S PA 1453 41.684 56.039 34.608 1.00 0.00 H ATOM 59780 C113 PA 1453 40.103 54.792 34.998 1.00 0.00 C ATOM 59781 H13R PA 1453 39.614 54.501 35.930 1.00 0.00 H ATOM 59782 H13S PA 1453 40.341 53.869 34.465 1.00 0.00 H ATOM 59783 C112 PA 1453 39.181 55.723 34.213 1.00 0.00 C ATOM 59784 H12R PA 1453 39.610 55.770 33.210 1.00 0.00 H ATOM 59785 H12S PA 1453 39.230 56.730 34.632 1.00 0.00 H ATOM 59786 C111 PA 1453 37.805 55.286 34.220 1.00 0.00 C ATOM 59787 H11R PA 1453 37.436 55.349 35.246 1.00 0.00 H ATOM 59788 H11S PA 1453 37.730 54.244 33.903 1.00 0.00 H ATOM 59789 C110 PA 1453 36.910 56.095 33.286 1.00 0.00 C ATOM 59790 H10R PA 1453 36.951 57.091 33.731 1.00 0.00 H ATOM 59791 H10S PA 1453 35.885 55.744 33.422 1.00 0.00 H ATOM 59792 C19 PA 1453 37.200 56.209 31.744 1.00 0.00 C ATOM 59793 H9R PA 1453 37.530 55.216 31.435 1.00 0.00 H ATOM 59794 H9S PA 1453 38.090 56.767 31.446 1.00 0.00 H ATOM 59795 C18 PA 1453 36.002 56.709 30.952 1.00 0.00 C ATOM 59796 H8R PA 1453 35.946 57.761 31.239 1.00 0.00 H ATOM 59797 H8S PA 1453 35.112 56.154 31.258 1.00 0.00 H ATOM 59798 C17 PA 1453 36.195 56.645 29.448 1.00 0.00 C ATOM 59799 H7R PA 1453 36.294 55.592 29.180 1.00 0.00 H ATOM 59800 H7S PA 1453 37.080 57.235 29.199 1.00 0.00 H ATOM 59801 C16 PA 1453 35.034 57.341 28.616 1.00 0.00 C ATOM 59802 H6R PA 1453 34.742 58.325 28.987 1.00 0.00 H ATOM 59803 H6S PA 1453 34.118 56.750 28.675 1.00 0.00 H ATOM 59804 C15 PA 1453 35.334 57.493 27.099 1.00 0.00 C ATOM 59805 H5R PA 1453 35.835 56.559 26.836 1.00 0.00 H ATOM 59806 H5S PA 1453 36.097 58.270 27.026 1.00 0.00 H ATOM 59807 C14 PA 1453 34.175 57.804 26.204 1.00 0.00 C ATOM 59808 H4R PA 1453 33.750 58.736 26.581 1.00 0.00 H ATOM 59809 H4S PA 1453 33.519 56.975 26.478 1.00 0.00 H ATOM 59810 C13 PA 1453 34.429 57.843 24.686 1.00 0.00 C ATOM 59811 H3R PA 1453 34.738 56.870 24.300 1.00 0.00 H ATOM 59812 H3S PA 1453 35.174 58.608 24.459 1.00 0.00 H ATOM 59813 C12 PA 1453 33.104 58.158 23.989 1.00 0.00 C ATOM 59814 H2R PA 1453 32.626 58.971 24.539 1.00 0.00 H ATOM 59815 H2S PA 1453 32.420 57.321 23.834 1.00 0.00 H ATOM 59816 C11 PC 1454 33.307 58.683 22.622 1.00 0.00 C ATOM 59817 O12 PC 1454 33.948 58.121 21.747 1.00 0.00 O ATOM 59818 O11 PC 1454 32.535 59.808 22.474 1.00 0.00 O ATOM 59819 C1 PC 1454 32.472 60.655 21.304 1.00 0.00 C ATOM 59820 HR PC 1454 33.363 60.580 20.674 1.00 0.00 H ATOM 59821 HS PC 1454 32.351 61.701 21.597 1.00 0.00 H ATOM 59822 C2 PC 1454 31.258 60.105 20.462 1.00 0.00 C ATOM 59823 HX PC 1454 31.552 59.199 19.926 1.00 0.00 H ATOM 59824 C3 PC 1454 30.835 60.965 19.242 1.00 0.00 C ATOM 59825 HA PC 1454 30.240 60.341 18.571 1.00 0.00 H ATOM 59826 HB PC 1454 31.761 61.234 18.727 1.00 0.00 H ATOM 59827 O31 PC 1454 30.238 62.209 19.584 1.00 0.00 O ATOM 59828 P31 PC 1454 29.779 63.166 18.408 1.00 0.00 P ATOM 59829 O32 PC 1454 28.288 62.611 18.153 1.00 0.00 O ATOM 59830 C31 PC 1454 27.570 63.018 17.011 1.00 0.00 C ATOM 59831 H1A PC 1454 28.213 62.737 16.173 1.00 0.00 H ATOM 59832 H1B PC 1454 27.218 64.052 17.046 1.00 0.00 H ATOM 59833 C32 PC 1454 26.324 62.150 16.977 1.00 0.00 C ATOM 59834 H2A PC 1454 26.539 61.131 16.655 1.00 0.00 H ATOM 59835 H2B PC 1454 25.616 62.576 16.264 1.00 0.00 H ATOM 59836 N31 PC 1454 25.494 62.004 18.259 1.00 0.00 N ATOM 59837 C33 PC 1454 26.152 61.034 19.272 1.00 0.00 C ATOM 59838 H3A PC 1454 26.225 60.047 18.814 1.00 0.00 H ATOM 59839 H3B PC 1454 25.572 60.849 20.176 1.00 0.00 H ATOM 59840 H3C PC 1454 27.173 61.319 19.531 1.00 0.00 H ATOM 59841 C34 PC 1454 25.214 63.321 19.002 1.00 0.00 C ATOM 59842 H4A PC 1454 25.114 64.232 18.410 1.00 0.00 H ATOM 59843 H4B PC 1454 25.984 63.336 19.775 1.00 0.00 H ATOM 59844 H4C PC 1454 24.268 63.162 19.520 1.00 0.00 H ATOM 59845 C35 PC 1454 24.157 61.401 17.889 1.00 0.00 C ATOM 59846 H5A PC 1454 24.233 60.432 17.394 1.00 0.00 H ATOM 59847 H5B PC 1454 23.661 62.194 17.327 1.00 0.00 H ATOM 59848 H5C PC 1454 23.580 61.132 18.775 1.00 0.00 H ATOM 59849 O33 PC 1454 29.703 64.541 18.918 1.00 0.00 O ATOM 59850 O34 PC 1454 30.535 62.945 17.182 1.00 0.00 O ATOM 59851 O21 PC 1454 30.018 59.989 21.231 1.00 0.00 O ATOM 59852 C21 PC 1454 29.742 58.879 21.896 1.00 0.00 C ATOM 59853 O22 PC 1454 30.443 57.877 21.709 1.00 0.00 O ATOM 59854 C12 OL 1455 28.570 58.957 22.779 1.00 0.00 C ATOM 59855 H2R OL 1455 28.629 59.888 23.346 1.00 0.00 H ATOM 59856 H2S OL 1455 27.721 59.163 22.123 1.00 0.00 H ATOM 59857 C13 OL 1455 28.338 57.705 23.699 1.00 0.00 C ATOM 59858 H3R OL 1455 27.890 56.872 23.154 1.00 0.00 H ATOM 59859 H3S OL 1455 29.306 57.423 24.119 1.00 0.00 H ATOM 59860 C14 OL 1455 27.499 58.252 24.784 1.00 0.00 C ATOM 59861 H4R OL 1455 27.911 59.088 25.353 1.00 0.00 H ATOM 59862 H4S OL 1455 26.521 58.568 24.415 1.00 0.00 H ATOM 59863 C15 OL 1455 27.148 57.098 25.787 1.00 0.00 C ATOM 59864 H5R OL 1455 26.869 56.144 25.334 1.00 0.00 H ATOM 59865 H5S OL 1455 28.115 56.886 26.247 1.00 0.00 H ATOM 59866 C16 OL 1455 26.129 57.524 26.872 1.00 0.00 C ATOM 59867 H6R OL 1455 25.138 57.481 26.416 1.00 0.00 H ATOM 59868 H6S OL 1455 26.019 56.716 27.598 1.00 0.00 H ATOM 59869 C17 OL 1455 26.167 58.898 27.480 1.00 0.00 C ATOM 59870 H7R OL 1455 27.195 59.099 27.789 1.00 0.00 H ATOM 59871 H7S OL 1455 25.883 59.654 26.745 1.00 0.00 H ATOM 59872 C18 OL 1455 25.107 59.020 28.607 1.00 0.00 C ATOM 59873 H8R OL 1455 24.080 58.843 28.279 1.00 0.00 H ATOM 59874 H8S OL 1455 25.346 58.223 29.314 1.00 0.00 H ATOM 59875 C19 OL 1455 25.319 60.384 29.293 1.00 0.00 C ATOM 59876 H9R OL 1455 24.647 61.142 28.898 1.00 0.00 H ATOM 59877 C110 OL 1455 26.166 60.718 30.301 1.00 0.00 C ATOM 59878 H10R OL 1455 26.116 61.656 30.847 1.00 0.00 H ATOM 59879 C111 OL 1455 27.128 59.674 30.954 1.00 0.00 C ATOM 59880 H11R OL 1455 27.574 59.034 30.190 1.00 0.00 H ATOM 59881 H11S OL 1455 28.011 60.202 31.319 1.00 0.00 H ATOM 59882 C112 OL 1455 26.457 59.031 32.116 1.00 0.00 C ATOM 59883 H12R OL 1455 26.301 59.664 32.992 1.00 0.00 H ATOM 59884 H12S OL 1455 25.455 58.767 31.769 1.00 0.00 H ATOM 59885 C113 OL 1455 27.164 57.803 32.539 1.00 0.00 C ATOM 59886 H13R OL 1455 26.563 57.553 33.415 1.00 0.00 H ATOM 59887 H13S OL 1455 27.000 57.164 31.668 1.00 0.00 H ATOM 59888 C114 OL 1455 28.620 57.882 32.742 1.00 0.00 C ATOM 59889 H14R OL 1455 29.102 58.133 31.795 1.00 0.00 H ATOM 59890 H14S OL 1455 28.931 56.869 33.006 1.00 0.00 H ATOM 59891 C115 OL 1455 29.141 58.923 33.741 1.00 0.00 C ATOM 59892 H15R OL 1455 30.226 59.028 33.684 1.00 0.00 H ATOM 59893 H15S OL 1455 28.630 59.856 33.497 1.00 0.00 H ATOM 59894 C116 OL 1455 28.799 58.629 35.164 1.00 0.00 C ATOM 59895 H16R OL 1455 27.752 58.753 35.450 1.00 0.00 H ATOM 59896 H16S OL 1455 29.008 57.567 35.309 1.00 0.00 H ATOM 59897 C117 OL 1455 29.711 59.357 36.136 1.00 0.00 C ATOM 59898 H17R OL 1455 29.631 60.445 36.184 1.00 0.00 H ATOM 59899 H17S OL 1455 29.356 59.110 37.139 1.00 0.00 H ATOM 59900 C118 OL 1455 31.112 58.901 36.027 1.00 0.00 C ATOM 59901 H18R OL 1455 31.189 57.848 36.306 1.00 0.00 H ATOM 59902 H18S OL 1455 31.738 59.370 36.788 1.00 0.00 H ATOM 59903 H18T OL 1455 31.645 59.075 35.090 1.00 0.00 H TER 59904 OL 1455 ATOM 59904 C116 PA 1456 8.496 32.243 39.517 1.00 0.00 C ATOM 59905 H16R PA 1456 8.078 33.042 40.133 1.00 0.00 H ATOM 59906 H16S PA 1456 9.207 31.709 40.150 1.00 0.00 H ATOM 59907 H16T PA 1456 7.728 31.562 39.144 1.00 0.00 H ATOM 59908 C115 PA 1456 9.016 32.710 38.183 1.00 0.00 C ATOM 59909 H15R PA 1456 8.223 32.690 37.432 1.00 0.00 H ATOM 59910 H15S PA 1456 9.620 31.854 37.873 1.00 0.00 H ATOM 59911 C114 PA 1456 9.688 34.085 38.126 1.00 0.00 C ATOM 59912 H14R PA 1456 10.677 34.198 38.573 1.00 0.00 H ATOM 59913 H14S PA 1456 9.089 34.834 38.648 1.00 0.00 H ATOM 59914 C113 PA 1456 9.801 34.467 36.619 1.00 0.00 C ATOM 59915 H13R PA 1456 8.784 34.390 36.229 1.00 0.00 H ATOM 59916 H13S PA 1456 10.499 33.760 36.167 1.00 0.00 H ATOM 59917 C112 PA 1456 10.354 35.834 36.344 1.00 0.00 C ATOM 59918 H12R PA 1456 11.280 35.946 36.912 1.00 0.00 H ATOM 59919 H12S PA 1456 9.591 36.578 36.584 1.00 0.00 H ATOM 59920 C111 PA 1456 10.857 36.059 34.918 1.00 0.00 C ATOM 59921 H11R PA 1456 9.992 36.251 34.279 1.00 0.00 H ATOM 59922 H11S PA 1456 11.162 35.069 34.574 1.00 0.00 H ATOM 59923 C110 PA 1456 11.851 37.270 34.583 1.00 0.00 C ATOM 59924 H10R PA 1456 12.764 37.024 35.131 1.00 0.00 H ATOM 59925 H10S PA 1456 11.403 38.188 34.968 1.00 0.00 H ATOM 59926 C19 PA 1456 12.335 37.474 33.192 1.00 0.00 C ATOM 59927 H9R PA 1456 12.613 36.504 32.777 1.00 0.00 H ATOM 59928 H9S PA 1456 13.278 38.023 33.210 1.00 0.00 H ATOM 59929 C18 PA 1456 11.400 38.355 32.375 1.00 0.00 C ATOM 59930 H8R PA 1456 12.028 39.079 31.853 1.00 0.00 H ATOM 59931 H8S PA 1456 10.688 38.891 33.005 1.00 0.00 H ATOM 59932 C17 PA 1456 10.719 37.698 31.247 1.00 0.00 C ATOM 59933 H7R PA 1456 10.074 38.464 30.811 1.00 0.00 H ATOM 59934 H7S PA 1456 10.116 36.886 31.659 1.00 0.00 H ATOM 59935 C16 PA 1456 11.631 37.025 30.146 1.00 0.00 C ATOM 59936 H6R PA 1456 12.098 36.135 30.572 1.00 0.00 H ATOM 59937 H6S PA 1456 12.373 37.813 30.001 1.00 0.00 H ATOM 59938 C15 PA 1456 10.928 36.675 28.876 1.00 0.00 C ATOM 59939 H5R PA 1456 10.399 37.527 28.443 1.00 0.00 H ATOM 59940 H5S PA 1456 10.210 35.937 29.240 1.00 0.00 H ATOM 59941 C14 PA 1456 11.727 35.896 27.820 1.00 0.00 C ATOM 59942 H4R PA 1456 11.931 34.870 28.135 1.00 0.00 H ATOM 59943 H4S PA 1456 12.606 36.507 27.602 1.00 0.00 H ATOM 59944 C13 PA 1456 10.893 35.652 26.592 1.00 0.00 C ATOM 59945 H3R PA 1456 10.709 36.645 26.176 1.00 0.00 H ATOM 59946 H3S PA 1456 9.936 35.275 26.958 1.00 0.00 H ATOM 59947 C12 PA 1456 11.316 34.603 25.543 1.00 0.00 C ATOM 59948 H2R PA 1456 11.280 33.582 25.931 1.00 0.00 H ATOM 59949 H2S PA 1456 12.301 34.857 25.145 1.00 0.00 H ATOM 59950 C11 PGR 1457 10.342 34.639 24.386 1.00 0.00 C ATOM 59951 O12 PGR 1457 10.489 34.068 23.319 1.00 0.00 O ATOM 59952 O11 PGR 1457 9.140 35.327 24.648 1.00 0.00 O ATOM 59953 C1 PGR 1457 8.057 35.260 23.667 1.00 0.00 C ATOM 59954 HR PGR 1457 8.388 35.725 22.735 1.00 0.00 H ATOM 59955 HS PGR 1457 7.265 35.818 24.175 1.00 0.00 H ATOM 59956 C2 PGR 1457 7.570 33.795 23.525 1.00 0.00 C ATOM 59957 HX PGR 1457 8.395 33.091 23.392 1.00 0.00 H ATOM 59958 C3 PGR 1457 6.584 33.613 22.343 1.00 0.00 C ATOM 59959 HA PGR 1457 6.398 32.550 22.171 1.00 0.00 H ATOM 59960 HB PGR 1457 7.076 33.970 21.434 1.00 0.00 H ATOM 59961 O31 PGR 1457 5.330 34.283 22.561 1.00 0.00 O ATOM 59962 P31 PGR 1457 4.233 34.117 21.434 1.00 0.00 P ATOM 59963 O32 PGR 1457 3.089 35.022 21.977 1.00 0.00 O ATOM 59964 C31 PGR 1457 2.181 34.506 22.952 1.00 0.00 C ATOM 59965 H1A PGR 1457 1.718 33.554 22.678 1.00 0.00 H ATOM 59966 H1B PGR 1457 1.337 35.197 23.021 1.00 0.00 H ATOM 59967 C32 PGR 1457 2.792 34.475 24.389 1.00 0.00 C ATOM 59968 H2A PGR 1457 3.300 35.439 24.475 1.00 0.00 H ATOM 59969 O35 PGR 1457 3.647 33.379 24.671 1.00 0.00 O ATOM 59970 HO5A PGR 1457 4.332 33.588 24.012 1.00 0.00 H ATOM 59971 C33 PGR 1457 1.664 34.459 25.499 1.00 0.00 C ATOM 59972 H3A PGR 1457 2.139 34.564 26.478 1.00 0.00 H ATOM 59973 H3B PGR 1457 1.017 35.310 25.272 1.00 0.00 H ATOM 59974 O33 PGR 1457 4.815 34.701 20.197 1.00 0.00 O ATOM 59975 O34 PGR 1457 3.674 32.762 21.448 1.00 0.00 O ATOM 59976 O21 PGR 1457 6.848 33.453 24.743 1.00 0.00 O ATOM 59977 C21 PGR 1457 7.606 33.185 25.866 1.00 0.00 C ATOM 59978 O22 PGR 1457 8.803 32.876 25.894 1.00 0.00 O ATOM 59979 O36 PGR 1457 1.003 33.163 25.407 1.00 0.00 O ATOM 59980 HO6A PGR 1457 1.680 32.476 25.539 1.00 0.00 H ATOM 59981 C12 OL 1458 6.722 33.238 27.129 1.00 0.00 C ATOM 59982 H2R OL 1458 7.155 34.074 27.682 1.00 0.00 H ATOM 59983 H2S OL 1458 5.696 33.484 26.848 1.00 0.00 H ATOM 59984 C13 OL 1458 6.685 31.925 27.966 1.00 0.00 C ATOM 59985 H3R OL 1458 6.205 31.190 27.316 1.00 0.00 H ATOM 59986 H3S OL 1458 7.666 31.454 28.058 1.00 0.00 H ATOM 59987 C14 OL 1458 6.065 31.993 29.316 1.00 0.00 C ATOM 59988 H4R OL 1458 6.400 32.762 30.016 1.00 0.00 H ATOM 59989 H4S OL 1458 5.075 32.405 29.109 1.00 0.00 H ATOM 59990 C15 OL 1458 5.854 30.681 30.028 1.00 0.00 C ATOM 59991 H5R OL 1458 6.849 30.230 30.053 1.00 0.00 H ATOM 59992 H5S OL 1458 5.551 30.847 31.064 1.00 0.00 H ATOM 59993 C16 OL 1458 5.047 29.595 29.418 1.00 0.00 C ATOM 59994 H6R OL 1458 5.525 29.341 28.470 1.00 0.00 H ATOM 59995 H6S OL 1458 5.083 28.685 30.021 1.00 0.00 H ATOM 59996 C17 OL 1458 3.497 29.851 29.254 1.00 0.00 C ATOM 59997 H7R OL 1458 3.315 30.869 28.902 1.00 0.00 H ATOM 59998 H7S OL 1458 3.130 29.168 28.484 1.00 0.00 H ATOM 59999 C18 OL 1458 2.619 29.522 30.540 1.00 0.00 C ATOM 60000 H8R OL 1458 3.042 28.638 31.022 1.00 0.00 H ATOM 60001 H8S OL 1458 2.597 30.401 31.187 1.00 0.00 H ATOM 60002 C19 OL 1458 1.234 29.171 29.965 1.00 0.00 C ATOM 60003 H9R OL 1458 1.102 29.527 28.946 1.00 0.00 H ATOM 60004 C110 OL 1458 0.367 28.365 30.582 1.00 0.00 C ATOM 60005 H10R OL 1458 -0.578 28.161 30.087 1.00 0.00 H ATOM 60006 C111 OL 1458 0.641 27.775 31.961 1.00 0.00 C ATOM 60007 H11R OL 1458 1.628 28.031 32.352 1.00 0.00 H ATOM 60008 H11S OL 1458 -0.034 28.273 32.660 1.00 0.00 H ATOM 60009 C112 OL 1458 0.294 26.243 31.997 1.00 0.00 C ATOM 60010 H12R OL 1458 -0.569 26.065 31.352 1.00 0.00 H ATOM 60011 H12S OL 1458 1.087 25.664 31.519 1.00 0.00 H ATOM 60012 C113 OL 1458 0.189 25.441 33.299 1.00 0.00 C ATOM 60013 H13R OL 1458 0.149 24.380 33.045 1.00 0.00 H ATOM 60014 H13S OL 1458 1.026 25.451 34.001 1.00 0.00 H ATOM 60015 C114 OL 1458 -1.024 25.848 34.122 1.00 0.00 C ATOM 60016 H14R OL 1458 -1.012 26.920 34.333 1.00 0.00 H ATOM 60017 H14S OL 1458 -1.809 25.637 33.392 1.00 0.00 H ATOM 60018 C115 OL 1458 -1.254 25.075 35.330 1.00 0.00 C ATOM 60019 H15R OL 1458 -1.318 24.029 35.023 1.00 0.00 H ATOM 60020 H15S OL 1458 -0.293 25.073 35.850 1.00 0.00 H ATOM 60021 C116 OL 1458 -2.464 25.646 36.091 1.00 0.00 C ATOM 60022 H16R OL 1458 -3.261 25.978 35.423 1.00 0.00 H ATOM 60023 H16S OL 1458 -2.887 24.798 36.634 1.00 0.00 H ATOM 60024 C117 OL 1458 -2.133 26.820 36.983 1.00 0.00 C ATOM 60025 H17R OL 1458 -1.643 26.352 37.839 1.00 0.00 H ATOM 60026 H17S OL 1458 -1.388 27.449 36.493 1.00 0.00 H ATOM 60027 C118 OL 1458 -3.256 27.649 37.450 1.00 0.00 C ATOM 60028 H18R OL 1458 -3.872 28.090 36.664 1.00 0.00 H ATOM 60029 H18S OL 1458 -2.899 28.417 38.139 1.00 0.00 H ATOM 60030 H18T OL 1458 -3.867 26.992 38.073 1.00 0.00 H TER 60031 OL 1458 ATOM 60031 C116 PA 1459 8.648 77.605 43.140 1.00 0.00 C ATOM 60032 H16R PA 1459 8.026 77.848 42.276 1.00 0.00 H ATOM 60033 H16S PA 1459 9.148 78.532 43.429 1.00 0.00 H ATOM 60034 H16T PA 1459 8.047 77.149 43.930 1.00 0.00 H ATOM 60035 C115 PA 1459 9.636 76.491 42.761 1.00 0.00 C ATOM 60036 H15R PA 1459 10.129 76.091 43.650 1.00 0.00 H ATOM 60037 H15S PA 1459 10.403 76.949 42.132 1.00 0.00 H ATOM 60038 C114 PA 1459 9.046 75.313 42.000 1.00 0.00 C ATOM 60039 H14R PA 1459 8.564 75.746 41.122 1.00 0.00 H ATOM 60040 H14S PA 1459 8.211 74.933 42.592 1.00 0.00 H ATOM 60041 C113 PA 1459 10.028 74.233 41.457 1.00 0.00 C ATOM 60042 H13R PA 1459 9.514 73.355 41.059 1.00 0.00 H ATOM 60043 H13S PA 1459 10.586 73.879 42.327 1.00 0.00 H ATOM 60044 C112 PA 1459 11.146 74.832 40.554 1.00 0.00 C ATOM 60045 H12R PA 1459 11.826 74.017 40.298 1.00 0.00 H ATOM 60046 H12S PA 1459 11.727 75.598 41.073 1.00 0.00 H ATOM 60047 C111 PA 1459 10.626 75.432 39.262 1.00 0.00 C ATOM 60048 H11R PA 1459 9.964 76.283 39.432 1.00 0.00 H ATOM 60049 H11S PA 1459 10.002 74.725 38.711 1.00 0.00 H ATOM 60050 C110 PA 1459 11.720 75.748 38.366 1.00 0.00 C ATOM 60051 H10R PA 1459 12.390 74.886 38.369 1.00 0.00 H ATOM 60052 H10S PA 1459 12.336 76.512 38.845 1.00 0.00 H ATOM 60053 C19 PA 1459 11.392 76.093 36.907 1.00 0.00 C ATOM 60054 H9R PA 1459 11.011 77.116 36.955 1.00 0.00 H ATOM 60055 H9S PA 1459 10.505 75.540 36.589 1.00 0.00 H ATOM 60056 C18 PA 1459 12.654 75.966 36.009 1.00 0.00 C ATOM 60057 H8R PA 1459 13.081 74.961 36.025 1.00 0.00 H ATOM 60058 H8S PA 1459 13.292 76.771 36.380 1.00 0.00 H ATOM 60059 C17 PA 1459 12.583 76.453 34.598 1.00 0.00 C ATOM 60060 H7R PA 1459 12.223 77.480 34.692 1.00 0.00 H ATOM 60061 H7S PA 1459 11.723 75.948 34.153 1.00 0.00 H ATOM 60062 C16 PA 1459 13.708 76.428 33.585 1.00 0.00 C ATOM 60063 H6R PA 1459 14.233 75.471 33.589 1.00 0.00 H ATOM 60064 H6S PA 1459 14.404 77.165 33.990 1.00 0.00 H ATOM 60065 C15 PA 1459 13.445 76.788 32.168 1.00 0.00 C ATOM 60066 H5R PA 1459 12.462 77.261 32.229 1.00 0.00 H ATOM 60067 H5S PA 1459 13.299 75.862 31.610 1.00 0.00 H ATOM 60068 C14 PA 1459 14.471 77.723 31.530 1.00 0.00 C ATOM 60069 H4R PA 1459 14.471 78.751 31.898 1.00 0.00 H ATOM 60070 H4S PA 1459 14.145 77.812 30.492 1.00 0.00 H ATOM 60071 C13 PA 1459 15.963 77.324 31.272 1.00 0.00 C ATOM 60072 H3R PA 1459 16.018 76.293 30.916 1.00 0.00 H ATOM 60073 H3S PA 1459 16.424 77.231 32.257 1.00 0.00 H ATOM 60074 C12 PA 1459 16.687 78.318 30.404 1.00 0.00 C ATOM 60075 H2R PA 1459 17.721 77.965 30.400 1.00 0.00 H ATOM 60076 H2S PA 1459 16.585 79.336 30.786 1.00 0.00 H ATOM 60077 C11 PC 1460 16.119 78.222 28.985 1.00 0.00 C ATOM 60078 O12 PC 1460 16.061 77.249 28.258 1.00 0.00 O ATOM 60079 O11 PC 1460 15.755 79.461 28.660 1.00 0.00 O ATOM 60080 C1 PC 1460 15.157 79.753 27.358 1.00 0.00 C ATOM 60081 HR PC 1460 15.690 79.111 26.651 1.00 0.00 H ATOM 60082 HS PC 1460 15.247 80.804 27.072 1.00 0.00 H ATOM 60083 C2 PC 1460 13.699 79.332 27.492 1.00 0.00 C ATOM 60084 HX PC 1460 13.657 78.295 27.834 1.00 0.00 H ATOM 60085 C3 PC 1460 13.025 79.434 26.134 1.00 0.00 C ATOM 60086 HA PC 1460 12.011 79.030 26.185 1.00 0.00 H ATOM 60087 HB PC 1460 13.538 78.863 25.356 1.00 0.00 H ATOM 60088 O31 PC 1460 12.924 80.799 25.732 1.00 0.00 O ATOM 60089 P31 PC 1460 12.344 81.106 24.329 1.00 0.00 P ATOM 60090 O32 PC 1460 13.139 80.208 23.354 1.00 0.00 O ATOM 60091 C31 PC 1460 14.448 80.429 23.107 1.00 0.00 C ATOM 60092 H1A PC 1460 14.977 80.232 24.042 1.00 0.00 H ATOM 60093 H1B PC 1460 14.677 81.463 22.834 1.00 0.00 H ATOM 60094 C32 PC 1460 14.982 79.449 22.023 1.00 0.00 C ATOM 60095 H2A PC 1460 14.902 78.372 22.177 1.00 0.00 H ATOM 60096 H2B PC 1460 16.050 79.668 21.984 1.00 0.00 H ATOM 60097 N31 PC 1460 14.531 79.702 20.582 1.00 0.00 N ATOM 60098 C33 PC 1460 15.163 78.638 19.736 1.00 0.00 C ATOM 60099 H3A PC 1460 14.748 78.769 18.735 1.00 0.00 H ATOM 60100 H3B PC 1460 14.849 77.646 20.064 1.00 0.00 H ATOM 60101 H3C PC 1460 16.253 78.651 19.758 1.00 0.00 H ATOM 60102 C34 PC 1460 13.080 79.488 20.429 1.00 0.00 C ATOM 60103 H4A PC 1460 12.823 78.510 20.839 1.00 0.00 H ATOM 60104 H4B PC 1460 12.838 79.566 19.368 1.00 0.00 H ATOM 60105 H4C PC 1460 12.549 80.188 21.076 1.00 0.00 H ATOM 60106 C35 PC 1460 15.002 81.063 20.104 1.00 0.00 C ATOM 60107 H5A PC 1460 14.838 81.147 19.028 1.00 0.00 H ATOM 60108 H5B PC 1460 16.045 81.173 20.406 1.00 0.00 H ATOM 60109 H5C PC 1460 14.367 81.800 20.597 1.00 0.00 H ATOM 60110 O33 PC 1460 11.010 80.524 24.340 1.00 0.00 O ATOM 60111 O34 PC 1460 12.436 82.511 24.039 1.00 0.00 O ATOM 60112 O21 PC 1460 12.915 80.161 28.368 1.00 0.00 O ATOM 60113 C21 PC 1460 11.988 79.564 29.090 1.00 0.00 C ATOM 60114 O22 PC 1460 11.773 78.380 29.094 1.00 0.00 O ATOM 60115 C12 OL 1461 11.018 80.535 29.800 1.00 0.00 C ATOM 60116 H2R OL 1461 10.864 81.401 29.154 1.00 0.00 H ATOM 60117 H2S OL 1461 10.052 80.163 30.146 1.00 0.00 H ATOM 60118 C13 OL 1461 11.825 80.989 31.057 1.00 0.00 C ATOM 60119 H3R OL 1461 12.145 80.139 31.663 1.00 0.00 H ATOM 60120 H3S OL 1461 12.754 81.488 30.772 1.00 0.00 H ATOM 60121 C14 OL 1461 11.109 81.984 31.962 1.00 0.00 C ATOM 60122 H4R OL 1461 10.159 81.498 32.195 1.00 0.00 H ATOM 60123 H4S OL 1461 11.586 82.003 32.944 1.00 0.00 H ATOM 60124 C15 OL 1461 10.613 83.341 31.343 1.00 0.00 C ATOM 60125 H5R OL 1461 11.524 83.698 30.858 1.00 0.00 H ATOM 60126 H5S OL 1461 9.932 83.107 30.523 1.00 0.00 H ATOM 60127 C16 OL 1461 10.175 84.271 32.412 1.00 0.00 C ATOM 60128 H6R OL 1461 9.432 83.750 33.020 1.00 0.00 H ATOM 60129 H6S OL 1461 11.080 84.674 32.872 1.00 0.00 H ATOM 60130 C17 OL 1461 9.317 85.466 31.875 1.00 0.00 C ATOM 60131 H7R OL 1461 8.470 85.033 31.340 1.00 0.00 H ATOM 60132 H7S OL 1461 9.079 86.103 32.729 1.00 0.00 H ATOM 60133 C18 OL 1461 9.910 86.279 30.731 1.00 0.00 C ATOM 60134 H8R OL 1461 10.089 85.575 29.915 1.00 0.00 H ATOM 60135 H8S OL 1461 9.217 87.018 30.325 1.00 0.00 H ATOM 60136 C19 OL 1461 11.187 86.924 31.202 1.00 0.00 C ATOM 60137 H9R OL 1461 11.006 87.650 31.990 1.00 0.00 H ATOM 60138 C110 OL 1461 12.406 86.723 30.657 1.00 0.00 C ATOM 60139 H10R OL 1461 13.242 87.315 31.020 1.00 0.00 H ATOM 60140 C111 OL 1461 12.703 85.793 29.473 1.00 0.00 C ATOM 60141 H11R OL 1461 13.642 85.280 29.690 1.00 0.00 H ATOM 60142 H11S OL 1461 11.929 85.041 29.304 1.00 0.00 H ATOM 60143 C112 OL 1461 12.765 86.625 28.198 1.00 0.00 C ATOM 60144 H12R OL 1461 12.760 85.945 27.344 1.00 0.00 H ATOM 60145 H12S OL 1461 11.824 87.178 28.145 1.00 0.00 H ATOM 60146 C113 OL 1461 13.820 87.739 28.214 1.00 0.00 C ATOM 60147 H13R OL 1461 13.662 88.286 29.146 1.00 0.00 H ATOM 60148 H13S OL 1461 14.806 87.348 28.474 1.00 0.00 H ATOM 60149 C114 OL 1461 13.811 88.731 27.048 1.00 0.00 C ATOM 60150 H14R OL 1461 14.440 89.587 27.300 1.00 0.00 H ATOM 60151 H14S OL 1461 14.200 88.313 26.117 1.00 0.00 H ATOM 60152 C115 OL 1461 12.463 89.331 26.687 1.00 0.00 C ATOM 60153 H15R OL 1461 12.456 89.857 25.730 1.00 0.00 H ATOM 60154 H15S OL 1461 11.855 88.428 26.589 1.00 0.00 H ATOM 60155 C116 OL 1461 11.799 90.261 27.703 1.00 0.00 C ATOM 60156 H16R OL 1461 11.982 89.959 28.736 1.00 0.00 H ATOM 60157 H16S OL 1461 12.177 91.285 27.680 1.00 0.00 H ATOM 60158 C117 OL 1461 10.314 90.362 27.400 1.00 0.00 C ATOM 60159 H17R OL 1461 9.945 91.374 27.579 1.00 0.00 H ATOM 60160 H17S OL 1461 10.044 90.411 26.343 1.00 0.00 H ATOM 60161 C118 OL 1461 9.302 89.502 28.211 1.00 0.00 C ATOM 60162 H18R OL 1461 8.983 90.032 29.111 1.00 0.00 H ATOM 60163 H18S OL 1461 9.751 88.533 28.439 1.00 0.00 H ATOM 60164 H18T OL 1461 8.343 89.288 27.734 1.00 0.00 H TER 60165 OL 1461 ATOM 60165 C116 PA 1462 24.593 96.086 35.820 1.00 0.00 C ATOM 60166 H16R PA 1462 25.180 96.294 36.717 1.00 0.00 H ATOM 60167 H16S PA 1462 24.505 97.049 35.311 1.00 0.00 H ATOM 60168 H16T PA 1462 24.965 95.266 35.202 1.00 0.00 H ATOM 60169 C115 PA 1462 23.246 95.551 36.309 1.00 0.00 C ATOM 60170 H15R PA 1462 22.834 95.166 35.374 1.00 0.00 H ATOM 60171 H15S PA 1462 22.660 96.395 36.679 1.00 0.00 H ATOM 60172 C114 PA 1462 23.213 94.353 37.323 1.00 0.00 C ATOM 60173 H14R PA 1462 23.886 94.563 38.157 1.00 0.00 H ATOM 60174 H14S PA 1462 23.728 93.462 36.958 1.00 0.00 H ATOM 60175 C113 PA 1462 21.776 93.908 37.802 1.00 0.00 C ATOM 60176 H13R PA 1462 21.333 94.523 38.588 1.00 0.00 H ATOM 60177 H13S PA 1462 21.906 92.967 38.341 1.00 0.00 H ATOM 60178 C112 PA 1462 20.810 93.627 36.636 1.00 0.00 C ATOM 60179 H12R PA 1462 21.287 92.706 36.296 1.00 0.00 H ATOM 60180 H12S PA 1462 20.807 94.429 35.894 1.00 0.00 H ATOM 60181 C111 PA 1462 19.397 93.420 37.109 1.00 0.00 C ATOM 60182 H11R PA 1462 18.766 93.202 36.245 1.00 0.00 H ATOM 60183 H11S PA 1462 18.904 94.292 37.543 1.00 0.00 H ATOM 60184 C110 PA 1462 19.191 92.307 38.079 1.00 0.00 C ATOM 60185 H10R PA 1462 18.130 92.063 38.163 1.00 0.00 H ATOM 60186 H10S PA 1462 19.480 92.875 38.966 1.00 0.00 H ATOM 60187 C19 PA 1462 19.969 90.927 38.127 1.00 0.00 C ATOM 60188 H9R PA 1462 19.748 90.485 39.101 1.00 0.00 H ATOM 60189 H9S PA 1462 21.043 91.103 38.044 1.00 0.00 H ATOM 60190 C18 PA 1462 19.538 89.922 37.098 1.00 0.00 C ATOM 60191 H8R PA 1462 19.652 90.408 36.127 1.00 0.00 H ATOM 60192 H8S PA 1462 18.466 89.772 37.238 1.00 0.00 H ATOM 60193 C17 PA 1462 20.273 88.593 37.163 1.00 0.00 C ATOM 60194 H7R PA 1462 19.836 88.057 38.009 1.00 0.00 H ATOM 60195 H7S PA 1462 21.302 88.713 37.508 1.00 0.00 H ATOM 60196 C16 PA 1462 20.220 87.649 35.970 1.00 0.00 C ATOM 60197 H6R PA 1462 19.158 87.410 35.883 1.00 0.00 H ATOM 60198 H6S PA 1462 20.658 86.702 36.290 1.00 0.00 H ATOM 60199 C15 PA 1462 21.109 88.072 34.765 1.00 0.00 C ATOM 60200 H5R PA 1462 22.062 88.451 35.141 1.00 0.00 H ATOM 60201 H5S PA 1462 20.572 88.944 34.386 1.00 0.00 H ATOM 60202 C14 PA 1462 21.325 87.107 33.601 1.00 0.00 C ATOM 60203 H4R PA 1462 20.367 86.916 33.112 1.00 0.00 H ATOM 60204 H4S PA 1462 21.748 86.162 33.946 1.00 0.00 H ATOM 60205 C13 PA 1462 22.175 87.702 32.393 1.00 0.00 C ATOM 60206 H3R PA 1462 23.208 87.880 32.699 1.00 0.00 H ATOM 60207 H3S PA 1462 21.669 88.615 32.075 1.00 0.00 H ATOM 60208 C12 PA 1462 22.315 86.716 31.177 1.00 0.00 C ATOM 60209 H2R PA 1462 21.384 86.625 30.615 1.00 0.00 H ATOM 60210 H2S PA 1462 22.678 85.706 31.379 1.00 0.00 H ATOM 60211 C11 PC 1463 23.219 87.308 30.067 1.00 0.00 C ATOM 60212 O12 PC 1463 23.283 88.515 29.774 1.00 0.00 O ATOM 60213 O11 PC 1463 23.791 86.232 29.385 1.00 0.00 O ATOM 60214 C1 PC 1463 24.821 86.361 28.321 1.00 0.00 C ATOM 60215 HR PC 1463 24.369 86.816 27.436 1.00 0.00 H ATOM 60216 HS PC 1463 25.192 85.387 27.993 1.00 0.00 H ATOM 60217 C2 PC 1463 25.940 87.352 28.757 1.00 0.00 C ATOM 60218 HX PC 1463 25.430 88.241 29.136 1.00 0.00 H ATOM 60219 C3 PC 1463 26.785 87.799 27.534 1.00 0.00 C ATOM 60220 HA PC 1463 27.278 86.925 27.101 1.00 0.00 H ATOM 60221 HB PC 1463 27.496 88.563 27.859 1.00 0.00 H ATOM 60222 O31 PC 1463 26.087 88.302 26.457 1.00 0.00 O ATOM 60223 P31 PC 1463 26.746 88.948 25.169 1.00 0.00 P ATOM 60224 O32 PC 1463 27.274 90.335 25.701 1.00 0.00 O ATOM 60225 C31 PC 1463 26.308 91.219 26.293 1.00 0.00 C ATOM 60226 H1A PC 1463 25.903 90.882 27.251 1.00 0.00 H ATOM 60227 H1B PC 1463 25.427 91.308 25.652 1.00 0.00 H ATOM 60228 C32 PC 1463 27.090 92.566 26.401 1.00 0.00 C ATOM 60229 H2A PC 1463 27.540 92.743 25.423 1.00 0.00 H ATOM 60230 H2B PC 1463 27.951 92.384 27.045 1.00 0.00 H ATOM 60231 N31 PC 1463 26.403 93.793 26.975 1.00 0.00 N ATOM 60232 C33 PC 1463 27.180 95.010 26.612 1.00 0.00 C ATOM 60233 H3A PC 1463 26.624 95.848 27.033 1.00 0.00 H ATOM 60234 H3B PC 1463 27.227 94.941 25.524 1.00 0.00 H ATOM 60235 H3C PC 1463 28.153 94.740 27.024 1.00 0.00 H ATOM 60236 C34 PC 1463 25.052 94.003 26.381 1.00 0.00 C ATOM 60237 H4A PC 1463 25.162 94.122 25.302 1.00 0.00 H ATOM 60238 H4B PC 1463 24.510 94.858 26.787 1.00 0.00 H ATOM 60239 H4C PC 1463 24.360 93.202 26.647 1.00 0.00 H ATOM 60240 C35 PC 1463 26.175 93.693 28.379 1.00 0.00 C ATOM 60241 H5A PC 1463 27.144 93.697 28.881 1.00 0.00 H ATOM 60242 H5B PC 1463 25.723 92.711 28.526 1.00 0.00 H ATOM 60243 H5C PC 1463 25.538 94.491 28.762 1.00 0.00 H ATOM 60244 O33 PC 1463 27.837 87.985 24.867 1.00 0.00 O ATOM 60245 O34 PC 1463 25.721 89.202 24.137 1.00 0.00 O ATOM 60246 O21 PC 1463 26.684 86.572 29.773 1.00 0.00 O ATOM 60247 C21 PC 1463 27.412 87.218 30.752 1.00 0.00 C ATOM 60248 O22 PC 1463 27.434 88.414 30.881 1.00 0.00 O ATOM 60249 C12 OL 1464 28.079 86.250 31.714 1.00 0.00 C ATOM 60250 H2R OL 1464 27.364 85.427 31.784 1.00 0.00 H ATOM 60251 H2S OL 1464 29.028 85.875 31.327 1.00 0.00 H ATOM 60252 C13 OL 1464 28.377 86.796 33.136 1.00 0.00 C ATOM 60253 H3R OL 1464 28.615 86.012 33.858 1.00 0.00 H ATOM 60254 H3S OL 1464 29.334 87.318 33.058 1.00 0.00 H ATOM 60255 C14 OL 1464 27.242 87.618 33.897 1.00 0.00 C ATOM 60256 H4R OL 1464 26.960 88.489 33.302 1.00 0.00 H ATOM 60257 H4S OL 1464 26.392 86.954 34.063 1.00 0.00 H ATOM 60258 C15 OL 1464 27.650 88.055 35.327 1.00 0.00 C ATOM 60259 H5R OL 1464 26.875 88.580 35.888 1.00 0.00 H ATOM 60260 H5S OL 1464 27.851 87.182 35.951 1.00 0.00 H ATOM 60261 C16 OL 1464 28.930 88.882 35.338 1.00 0.00 C ATOM 60262 H6R OL 1464 29.845 88.322 35.132 1.00 0.00 H ATOM 60263 H6S OL 1464 28.886 89.671 34.585 1.00 0.00 H ATOM 60264 C17 OL 1464 29.271 89.742 36.571 1.00 0.00 C ATOM 60265 H7R OL 1464 28.434 90.284 37.016 1.00 0.00 H ATOM 60266 H7S OL 1464 29.539 89.033 37.357 1.00 0.00 H ATOM 60267 C18 OL 1464 30.310 90.867 36.088 1.00 0.00 C ATOM 60268 H8R OL 1464 31.029 90.924 36.908 1.00 0.00 H ATOM 60269 H8S OL 1464 30.947 90.731 35.211 1.00 0.00 H ATOM 60270 C19 OL 1464 29.657 92.236 35.878 1.00 0.00 C ATOM 60271 H9R OL 1464 28.946 92.524 36.648 1.00 0.00 H ATOM 60272 C110 OL 1464 29.880 93.139 34.946 1.00 0.00 C ATOM 60273 H10R OL 1464 29.364 94.095 34.977 1.00 0.00 H ATOM 60274 C111 OL 1464 30.968 93.033 33.946 1.00 0.00 C ATOM 60275 H11R OL 1464 31.321 94.046 33.736 1.00 0.00 H ATOM 60276 H11S OL 1464 31.705 92.438 34.489 1.00 0.00 H ATOM 60277 C112 OL 1464 30.652 92.341 32.603 1.00 0.00 C ATOM 60278 H12R OL 1464 30.332 91.341 32.901 1.00 0.00 H ATOM 60279 H12S OL 1464 29.721 92.790 32.250 1.00 0.00 H ATOM 60280 C113 OL 1464 31.678 92.317 31.523 1.00 0.00 C ATOM 60281 H13R OL 1464 31.367 91.697 30.680 1.00 0.00 H ATOM 60282 H13S OL 1464 31.715 93.329 31.113 1.00 0.00 H ATOM 60283 C114 OL 1464 33.125 91.880 31.948 1.00 0.00 C ATOM 60284 H14R OL 1464 33.616 91.851 30.974 1.00 0.00 H ATOM 60285 H14S OL 1464 33.541 92.712 32.520 1.00 0.00 H ATOM 60286 C115 OL 1464 33.152 90.548 32.714 1.00 0.00 C ATOM 60287 H15R OL 1464 32.777 90.657 33.734 1.00 0.00 H ATOM 60288 H15S OL 1464 32.404 89.940 32.201 1.00 0.00 H ATOM 60289 C116 OL 1464 34.515 89.808 32.721 1.00 0.00 C ATOM 60290 H16R OL 1464 34.357 88.791 33.085 1.00 0.00 H ATOM 60291 H16S OL 1464 34.862 89.725 31.689 1.00 0.00 H ATOM 60292 C117 OL 1464 35.584 90.473 33.541 1.00 0.00 C ATOM 60293 H17R OL 1464 36.028 91.293 32.973 1.00 0.00 H ATOM 60294 H17S OL 1464 35.102 90.969 34.387 1.00 0.00 H ATOM 60295 C118 OL 1464 36.678 89.461 33.985 1.00 0.00 C ATOM 60296 H18R OL 1464 37.442 89.982 34.565 1.00 0.00 H ATOM 60297 H18S OL 1464 37.311 89.058 33.192 1.00 0.00 H ATOM 60298 H18T OL 1464 36.236 88.610 34.509 1.00 0.00 H TER 60299 OL 1464 ATOM 60299 C116 PA 1465 108.448 119.101 48.509 1.00 0.00 C ATOM 60300 H16R PA 1465 108.328 120.150 48.231 1.00 0.00 H ATOM 60301 H16S PA 1465 109.474 119.065 48.881 1.00 0.00 H ATOM 60302 H16T PA 1465 107.822 118.839 49.365 1.00 0.00 H ATOM 60303 C115 PA 1465 108.030 118.249 47.337 1.00 0.00 C ATOM 60304 H15R PA 1465 106.956 118.052 47.356 1.00 0.00 H ATOM 60305 H15S PA 1465 108.483 117.295 47.616 1.00 0.00 H ATOM 60306 C114 PA 1465 108.302 118.933 46.008 1.00 0.00 C ATOM 60307 H14R PA 1465 109.387 118.985 45.893 1.00 0.00 H ATOM 60308 H14S PA 1465 107.926 119.958 45.982 1.00 0.00 H ATOM 60309 C113 PA 1465 107.747 118.066 44.881 1.00 0.00 C ATOM 60310 H13R PA 1465 106.659 118.028 44.969 1.00 0.00 H ATOM 60311 H13S PA 1465 108.112 117.038 44.936 1.00 0.00 H ATOM 60312 C112 PA 1465 108.154 118.558 43.543 1.00 0.00 C ATOM 60313 H12R PA 1465 109.188 118.321 43.285 1.00 0.00 H ATOM 60314 H12S PA 1465 108.145 119.650 43.521 1.00 0.00 H ATOM 60315 C111 PA 1465 107.126 118.076 42.491 1.00 0.00 C ATOM 60316 H11R PA 1465 106.188 118.590 42.710 1.00 0.00 H ATOM 60317 H11S PA 1465 106.946 116.999 42.485 1.00 0.00 H ATOM 60318 C110 PA 1465 107.553 118.347 41.131 1.00 0.00 C ATOM 60319 H10R PA 1465 108.498 117.835 40.937 1.00 0.00 H ATOM 60320 H10S PA 1465 107.681 119.422 40.983 1.00 0.00 H ATOM 60321 C19 PA 1465 106.579 117.763 39.987 1.00 0.00 C ATOM 60322 H9R PA 1465 105.565 118.166 39.985 1.00 0.00 H ATOM 60323 H9S PA 1465 106.484 116.682 40.112 1.00 0.00 H ATOM 60324 C18 PA 1465 107.211 118.074 38.594 1.00 0.00 C ATOM 60325 H8R PA 1465 108.216 117.647 38.616 1.00 0.00 H ATOM 60326 H8S PA 1465 107.429 119.138 38.476 1.00 0.00 H ATOM 60327 C17 PA 1465 106.333 117.576 37.412 1.00 0.00 C ATOM 60328 H7R PA 1465 106.914 117.821 36.521 1.00 0.00 H ATOM 60329 H7S PA 1465 105.382 118.111 37.464 1.00 0.00 H ATOM 60330 C16 PA 1465 106.140 116.079 37.413 1.00 0.00 C ATOM 60331 H6R PA 1465 105.300 115.820 38.061 1.00 0.00 H ATOM 60332 H6S PA 1465 106.975 115.611 37.938 1.00 0.00 H ATOM 60333 C15 PA 1465 106.177 115.464 35.974 1.00 0.00 C ATOM 60334 H5R PA 1465 106.212 114.382 36.117 1.00 0.00 H ATOM 60335 H5S PA 1465 107.092 115.807 35.486 1.00 0.00 H ATOM 60336 C14 PA 1465 105.011 115.771 35.090 1.00 0.00 C ATOM 60337 H4R PA 1465 104.938 116.859 35.047 1.00 0.00 H ATOM 60338 H4S PA 1465 104.105 115.370 35.549 1.00 0.00 H ATOM 60339 C13 PA 1465 105.228 115.203 33.642 1.00 0.00 C ATOM 60340 H3R PA 1465 105.388 114.133 33.788 1.00 0.00 H ATOM 60341 H3S PA 1465 106.155 115.605 33.229 1.00 0.00 H ATOM 60342 C12 PA 1465 104.088 115.390 32.624 1.00 0.00 C ATOM 60343 H2R PA 1465 103.993 116.413 32.255 1.00 0.00 H ATOM 60344 H2S PA 1465 103.082 115.234 33.017 1.00 0.00 H ATOM 60345 C11 PGR 1466 104.242 114.460 31.420 1.00 0.00 C ATOM 60346 O12 PGR 1466 105.293 113.858 31.125 1.00 0.00 O ATOM 60347 O11 PGR 1466 103.108 114.347 30.708 1.00 0.00 O ATOM 60348 C1 PGR 1466 103.023 113.366 29.667 1.00 0.00 C ATOM 60349 HR PGR 1466 103.815 113.482 28.923 1.00 0.00 H ATOM 60350 HS PGR 1466 102.050 113.376 29.169 1.00 0.00 H ATOM 60351 C2 PGR 1466 103.101 111.938 30.312 1.00 0.00 C ATOM 60352 HX PGR 1466 104.012 111.850 30.908 1.00 0.00 H ATOM 60353 C3 PGR 1466 103.200 110.900 29.162 1.00 0.00 C ATOM 60354 HA PGR 1466 103.078 109.927 29.643 1.00 0.00 H ATOM 60355 HB PGR 1466 104.220 111.066 28.805 1.00 0.00 H ATOM 60356 O31 PGR 1466 102.282 111.150 28.129 1.00 0.00 O ATOM 60357 P31 PGR 1466 102.028 110.012 27.045 1.00 0.00 P ATOM 60358 O32 PGR 1466 103.329 110.243 26.135 1.00 0.00 O ATOM 60359 C31 PGR 1466 103.248 111.242 25.136 1.00 0.00 C ATOM 60360 H1A PGR 1466 102.908 112.155 25.632 1.00 0.00 H ATOM 60361 H1B PGR 1466 102.520 111.024 24.351 1.00 0.00 H ATOM 60362 C32 PGR 1466 104.684 111.620 24.626 1.00 0.00 C ATOM 60363 H2A PGR 1466 104.647 112.117 23.654 1.00 0.00 H ATOM 60364 O35 PGR 1466 105.489 110.425 24.440 1.00 0.00 O ATOM 60365 HO5A PGR 1466 106.395 110.705 24.666 1.00 0.00 H ATOM 60366 C33 PGR 1466 105.437 112.389 25.677 1.00 0.00 C ATOM 60367 H3A PGR 1466 105.113 113.418 25.852 1.00 0.00 H ATOM 60368 H3B PGR 1466 105.438 111.741 26.556 1.00 0.00 H ATOM 60369 O33 PGR 1466 102.096 108.689 27.692 1.00 0.00 O ATOM 60370 O34 PGR 1466 100.742 110.398 26.339 1.00 0.00 O ATOM 60371 O21 PGR 1466 101.799 111.784 30.953 1.00 0.00 O ATOM 60372 C21 PGR 1466 101.696 110.640 31.702 1.00 0.00 C ATOM 60373 O22 PGR 1466 102.657 110.002 32.086 1.00 0.00 O ATOM 60374 O36 PGR 1466 106.911 112.505 25.332 1.00 0.00 O ATOM 60375 HO6A PGR 1466 107.313 112.677 26.202 1.00 0.00 H ATOM 60376 C12 OL 1467 100.290 110.451 32.103 1.00 0.00 C ATOM 60377 H2R OL 1467 100.019 111.325 32.699 1.00 0.00 H ATOM 60378 H2S OL 1467 99.680 110.640 31.217 1.00 0.00 H ATOM 60379 C13 OL 1467 100.043 109.054 32.786 1.00 0.00 C ATOM 60380 H3R OL 1467 100.219 108.245 32.074 1.00 0.00 H ATOM 60381 H3S OL 1467 100.712 108.967 33.644 1.00 0.00 H ATOM 60382 C14 OL 1467 98.658 108.963 33.379 1.00 0.00 C ATOM 60383 H4R OL 1467 97.943 108.943 32.553 1.00 0.00 H ATOM 60384 H4S OL 1467 98.503 107.967 33.799 1.00 0.00 H ATOM 60385 C15 OL 1467 98.492 110.093 34.496 1.00 0.00 C ATOM 60386 H5R OL 1467 99.373 110.151 35.138 1.00 0.00 H ATOM 60387 H5S OL 1467 98.389 111.075 34.031 1.00 0.00 H ATOM 60388 C16 OL 1467 97.264 109.997 35.338 1.00 0.00 C ATOM 60389 H6R OL 1467 97.414 109.157 36.019 1.00 0.00 H ATOM 60390 H6S OL 1467 97.190 110.894 35.957 1.00 0.00 H ATOM 60391 C17 OL 1467 95.973 109.873 34.537 1.00 0.00 C ATOM 60392 H7R OL 1467 95.871 110.773 33.927 1.00 0.00 H ATOM 60393 H7S OL 1467 96.222 109.047 33.868 1.00 0.00 H ATOM 60394 C18 OL 1467 94.602 109.492 35.276 1.00 0.00 C ATOM 60395 H8R OL 1467 93.777 109.573 34.564 1.00 0.00 H ATOM 60396 H8S OL 1467 94.513 108.475 35.663 1.00 0.00 H ATOM 60397 C19 OL 1467 94.404 110.429 36.433 1.00 0.00 C ATOM 60398 H9R OL 1467 95.082 110.318 37.275 1.00 0.00 H ATOM 60399 C110 OL 1467 93.533 111.434 36.618 1.00 0.00 C ATOM 60400 H10R OL 1467 93.569 111.942 37.578 1.00 0.00 H ATOM 60401 C111 OL 1467 92.547 111.901 35.596 1.00 0.00 C ATOM 60402 H11R OL 1467 92.609 111.335 34.664 1.00 0.00 H ATOM 60403 H11S OL 1467 91.538 111.682 35.952 1.00 0.00 H ATOM 60404 C112 OL 1467 92.506 113.439 35.351 1.00 0.00 C ATOM 60405 H12R OL 1467 93.466 113.727 34.917 1.00 0.00 H ATOM 60406 H12S OL 1467 91.742 113.613 34.590 1.00 0.00 H ATOM 60407 C113 OL 1467 92.361 114.195 36.626 1.00 0.00 C ATOM 60408 H13R OL 1467 91.683 113.664 37.298 1.00 0.00 H ATOM 60409 H13S OL 1467 93.380 114.131 37.013 1.00 0.00 H ATOM 60410 C114 OL 1467 91.891 115.697 36.519 1.00 0.00 C ATOM 60411 H14R OL 1467 92.378 116.306 35.754 1.00 0.00 H ATOM 60412 H14S OL 1467 90.846 115.739 36.206 1.00 0.00 H ATOM 60413 C115 OL 1467 91.961 116.475 37.877 1.00 0.00 C ATOM 60414 H15R OL 1467 91.531 115.813 38.632 1.00 0.00 H ATOM 60415 H15S OL 1467 92.982 116.726 38.170 1.00 0.00 H ATOM 60416 C116 OL 1467 91.212 117.822 37.838 1.00 0.00 C ATOM 60417 H16R OL 1467 90.128 117.697 37.814 1.00 0.00 H ATOM 60418 H16S OL 1467 91.456 118.360 38.756 1.00 0.00 H ATOM 60419 C117 OL 1467 91.487 118.713 36.593 1.00 0.00 C ATOM 60420 H17R OL 1467 91.150 118.320 35.632 1.00 0.00 H ATOM 60421 H17S OL 1467 90.784 119.547 36.639 1.00 0.00 H ATOM 60422 C118 OL 1467 92.863 119.305 36.524 1.00 0.00 C ATOM 60423 H18R OL 1467 93.556 118.541 36.165 1.00 0.00 H ATOM 60424 H18S OL 1467 93.096 119.693 37.517 1.00 0.00 H ATOM 60425 H18T OL 1467 92.727 120.050 35.737 1.00 0.00 H TER 60426 OL 1467 ATOM 60426 C116 PA 1468 146.710 25.373 40.315 1.00 0.00 C ATOM 60427 H16R PA 1468 145.884 25.830 39.766 1.00 0.00 H ATOM 60428 H16S PA 1468 146.483 25.140 41.357 1.00 0.00 H ATOM 60429 H16T PA 1468 146.887 24.410 39.832 1.00 0.00 H ATOM 60430 C115 PA 1468 147.846 26.402 40.331 1.00 0.00 C ATOM 60431 H15R PA 1468 148.586 25.911 40.967 1.00 0.00 H ATOM 60432 H15S PA 1468 147.560 27.273 40.923 1.00 0.00 H ATOM 60433 C114 PA 1468 148.422 26.571 38.919 1.00 0.00 C ATOM 60434 H14R PA 1468 148.627 25.643 38.382 1.00 0.00 H ATOM 60435 H14S PA 1468 149.420 26.970 39.111 1.00 0.00 H ATOM 60436 C113 PA 1468 147.485 27.497 38.103 1.00 0.00 C ATOM 60437 H13R PA 1468 147.274 28.428 38.632 1.00 0.00 H ATOM 60438 H13S PA 1468 146.522 26.984 38.055 1.00 0.00 H ATOM 60439 C112 PA 1468 147.979 27.924 36.739 1.00 0.00 C ATOM 60440 H12R PA 1468 148.141 27.068 36.080 1.00 0.00 H ATOM 60441 H12S PA 1468 148.961 28.398 36.798 1.00 0.00 H ATOM 60442 C111 PA 1468 147.152 29.039 36.176 1.00 0.00 C ATOM 60443 H11R PA 1468 147.006 29.824 36.921 1.00 0.00 H ATOM 60444 H11S PA 1468 146.186 28.687 35.806 1.00 0.00 H ATOM 60445 C110 PA 1468 147.809 29.815 35.026 1.00 0.00 C ATOM 60446 H10R PA 1468 147.841 29.096 34.204 1.00 0.00 H ATOM 60447 H10S PA 1468 148.805 30.137 35.339 1.00 0.00 H ATOM 60448 C19 PA 1468 147.028 31.077 34.541 1.00 0.00 C ATOM 60449 H9R PA 1468 146.183 31.306 35.194 1.00 0.00 H ATOM 60450 H9S PA 1468 146.570 30.787 33.593 1.00 0.00 H ATOM 60451 C18 PA 1468 147.854 32.388 34.512 1.00 0.00 C ATOM 60452 H8R PA 1468 148.744 32.353 33.880 1.00 0.00 H ATOM 60453 H8S PA 1468 148.249 32.525 35.521 1.00 0.00 H ATOM 60454 C17 PA 1468 146.923 33.594 34.120 1.00 0.00 C ATOM 60455 H7R PA 1468 147.396 34.575 34.044 1.00 0.00 H ATOM 60456 H7S PA 1468 146.355 33.842 35.019 1.00 0.00 H ATOM 60457 C16 PA 1468 145.882 33.319 32.950 1.00 0.00 C ATOM 60458 H6R PA 1468 145.289 34.235 32.914 1.00 0.00 H ATOM 60459 H6S PA 1468 145.207 32.490 33.175 1.00 0.00 H ATOM 60460 C15 PA 1468 146.493 33.148 31.523 1.00 0.00 C ATOM 60461 H5R PA 1468 147.247 32.366 31.634 1.00 0.00 H ATOM 60462 H5S PA 1468 146.800 34.111 31.108 1.00 0.00 H ATOM 60463 C14 PA 1468 145.553 32.453 30.487 1.00 0.00 C ATOM 60464 H4R PA 1468 144.683 33.098 30.345 1.00 0.00 H ATOM 60465 H4S PA 1468 145.250 31.477 30.872 1.00 0.00 H ATOM 60466 C13 PA 1468 146.132 32.178 29.143 1.00 0.00 C ATOM 60467 H3R PA 1468 147.119 31.727 29.259 1.00 0.00 H ATOM 60468 H3S PA 1468 146.306 33.138 28.652 1.00 0.00 H ATOM 60469 C12 PA 1468 145.276 31.228 28.244 1.00 0.00 C ATOM 60470 H2R PA 1468 144.356 31.731 27.937 1.00 0.00 H ATOM 60471 H2S PA 1468 144.996 30.300 28.746 1.00 0.00 H ATOM 60472 C11 PC 1469 145.954 30.631 27.041 1.00 0.00 C ATOM 60473 O12 PC 1469 147.156 30.710 26.836 1.00 0.00 O ATOM 60474 O11 PC 1469 145.103 30.106 26.202 1.00 0.00 O ATOM 60475 C1 PC 1469 145.467 29.527 24.880 1.00 0.00 C ATOM 60476 HR PC 1469 145.829 30.279 24.174 1.00 0.00 H ATOM 60477 HS PC 1469 144.532 29.218 24.406 1.00 0.00 H ATOM 60478 C2 PC 1469 146.584 28.347 25.089 1.00 0.00 C ATOM 60479 HX PC 1469 147.572 28.810 25.154 1.00 0.00 H ATOM 60480 C3 PC 1469 146.646 27.485 23.806 1.00 0.00 C ATOM 60481 HA PC 1469 147.464 26.761 23.763 1.00 0.00 H ATOM 60482 HB PC 1469 146.777 28.172 22.966 1.00 0.00 H ATOM 60483 O31 PC 1469 145.435 26.822 23.607 1.00 0.00 O ATOM 60484 P31 PC 1469 145.244 25.821 22.333 1.00 0.00 P ATOM 60485 O32 PC 1469 146.041 26.585 21.162 1.00 0.00 O ATOM 60486 C31 PC 1469 147.168 25.993 20.583 1.00 0.00 C ATOM 60487 H1A PC 1469 146.943 25.002 20.181 1.00 0.00 H ATOM 60488 H1B PC 1469 148.051 25.810 21.200 1.00 0.00 H ATOM 60489 C32 PC 1469 147.668 26.834 19.382 1.00 0.00 C ATOM 60490 H2A PC 1469 146.779 27.141 18.829 1.00 0.00 H ATOM 60491 H2B PC 1469 148.258 26.184 18.734 1.00 0.00 H ATOM 60492 N31 PC 1469 148.422 28.163 19.619 1.00 0.00 N ATOM 60493 C33 PC 1469 149.591 27.925 20.483 1.00 0.00 C ATOM 60494 H3A PC 1469 149.254 27.857 21.518 1.00 0.00 H ATOM 60495 H3B PC 1469 150.322 28.731 20.397 1.00 0.00 H ATOM 60496 H3C PC 1469 150.114 27.022 20.164 1.00 0.00 H ATOM 60497 C34 PC 1469 149.007 28.697 18.339 1.00 0.00 C ATOM 60498 H4A PC 1469 149.901 28.108 18.129 1.00 0.00 H ATOM 60499 H4B PC 1469 149.355 29.712 18.532 1.00 0.00 H ATOM 60500 H4C PC 1469 148.183 28.666 17.624 1.00 0.00 H ATOM 60501 C35 PC 1469 147.572 29.139 20.322 1.00 0.00 C ATOM 60502 H5A PC 1469 146.896 29.527 19.560 1.00 0.00 H ATOM 60503 H5B PC 1469 148.218 29.909 20.746 1.00 0.00 H ATOM 60504 H5C PC 1469 146.990 28.566 21.046 1.00 0.00 H ATOM 60505 O33 PC 1469 145.954 24.516 22.474 1.00 0.00 O ATOM 60506 O34 PC 1469 143.818 25.713 21.858 1.00 0.00 O ATOM 60507 O21 PC 1469 146.239 27.578 26.194 1.00 0.00 O ATOM 60508 C21 PC 1469 146.916 26.531 26.641 1.00 0.00 C ATOM 60509 O22 PC 1469 147.803 25.964 26.058 1.00 0.00 O ATOM 60510 C12 OL 1470 146.322 25.903 27.804 1.00 0.00 C ATOM 60511 H2R OL 1470 147.076 25.529 28.499 1.00 0.00 H ATOM 60512 H2S OL 1470 145.911 26.682 28.448 1.00 0.00 H ATOM 60513 C13 OL 1470 145.319 24.787 27.492 1.00 0.00 C ATOM 60514 H3R OL 1470 144.629 25.225 26.767 1.00 0.00 H ATOM 60515 H3S OL 1470 145.673 23.868 27.021 1.00 0.00 H ATOM 60516 C14 OL 1470 144.606 24.450 28.809 1.00 0.00 C ATOM 60517 H4R OL 1470 145.362 23.990 29.448 1.00 0.00 H ATOM 60518 H4S OL 1470 144.233 25.301 29.383 1.00 0.00 H ATOM 60519 C15 OL 1470 143.599 23.361 28.637 1.00 0.00 C ATOM 60520 H5R OL 1470 142.595 23.660 28.327 1.00 0.00 H ATOM 60521 H5S OL 1470 143.926 22.626 27.898 1.00 0.00 H ATOM 60522 C16 OL 1470 143.116 22.917 29.947 1.00 0.00 C ATOM 60523 H6R OL 1470 142.282 22.275 29.654 1.00 0.00 H ATOM 60524 H6S OL 1470 143.963 22.392 30.394 1.00 0.00 H ATOM 60525 C17 OL 1470 142.665 24.006 30.961 1.00 0.00 C ATOM 60526 H7R OL 1470 143.452 24.494 31.541 1.00 0.00 H ATOM 60527 H7S OL 1470 142.287 24.841 30.367 1.00 0.00 H ATOM 60528 C18 OL 1470 141.692 23.426 31.979 1.00 0.00 C ATOM 60529 H8R OL 1470 140.788 23.327 31.374 1.00 0.00 H ATOM 60530 H8S OL 1470 142.195 22.550 32.394 1.00 0.00 H ATOM 60531 C19 OL 1470 141.478 24.449 33.069 1.00 0.00 C ATOM 60532 H9R OL 1470 142.332 24.521 33.738 1.00 0.00 H ATOM 60533 C110 OL 1470 140.425 25.272 33.195 1.00 0.00 C ATOM 60534 H10R OL 1470 140.417 26.008 33.995 1.00 0.00 H ATOM 60535 C111 OL 1470 139.245 25.371 32.328 1.00 0.00 C ATOM 60536 H11R OL 1470 138.961 24.399 31.920 1.00 0.00 H ATOM 60537 H11S OL 1470 138.409 25.789 32.893 1.00 0.00 H ATOM 60538 C112 OL 1470 139.494 26.317 31.060 1.00 0.00 C ATOM 60539 H12R OL 1470 139.227 27.352 31.286 1.00 0.00 H ATOM 60540 H12S OL 1470 140.555 26.274 30.805 1.00 0.00 H ATOM 60541 C113 OL 1470 138.930 25.991 29.697 1.00 0.00 C ATOM 60542 H13R OL 1470 139.317 26.781 29.049 1.00 0.00 H ATOM 60543 H13S OL 1470 139.370 25.076 29.295 1.00 0.00 H ATOM 60544 C114 OL 1470 137.389 25.961 29.711 1.00 0.00 C ATOM 60545 H14R OL 1470 137.026 25.306 30.507 1.00 0.00 H ATOM 60546 H14S OL 1470 136.921 26.914 29.965 1.00 0.00 H ATOM 60547 C115 OL 1470 136.835 25.657 28.256 1.00 0.00 C ATOM 60548 H15R OL 1470 137.020 26.401 27.478 1.00 0.00 H ATOM 60549 H15S OL 1470 137.398 24.770 27.960 1.00 0.00 H ATOM 60550 C116 OL 1470 135.300 25.314 28.290 1.00 0.00 C ATOM 60551 H16R OL 1470 135.139 24.640 29.134 1.00 0.00 H ATOM 60552 H16S OL 1470 134.681 26.200 28.442 1.00 0.00 H ATOM 60553 C117 OL 1470 134.910 24.552 27.019 1.00 0.00 C ATOM 60554 H17R OL 1470 134.774 25.243 26.184 1.00 0.00 H ATOM 60555 H17S OL 1470 135.637 23.796 26.715 1.00 0.00 H ATOM 60556 C118 OL 1470 133.476 23.981 27.065 1.00 0.00 C ATOM 60557 H18R OL 1470 132.689 24.736 27.097 1.00 0.00 H ATOM 60558 H18S OL 1470 133.424 23.265 27.888 1.00 0.00 H ATOM 60559 H18T OL 1470 133.267 23.389 26.171 1.00 0.00 H TER 60560 OL 1470 ATOM 60560 C116 PA 1471 60.243 12.174 33.893 1.00 0.00 C ATOM 60561 H16R PA 1471 60.634 13.175 33.700 1.00 0.00 H ATOM 60562 H16S PA 1471 59.289 12.291 34.412 1.00 0.00 H ATOM 60563 H16T PA 1471 59.999 11.586 33.006 1.00 0.00 H ATOM 60564 C115 PA 1471 61.117 11.206 34.812 1.00 0.00 C ATOM 60565 H15R PA 1471 60.425 10.444 35.177 1.00 0.00 H ATOM 60566 H15S PA 1471 61.480 11.819 35.640 1.00 0.00 H ATOM 60567 C114 PA 1471 62.173 10.640 33.990 1.00 0.00 C ATOM 60568 H14R PA 1471 62.521 11.241 33.147 1.00 0.00 H ATOM 60569 H14S PA 1471 61.775 9.822 33.385 1.00 0.00 H ATOM 60570 C113 PA 1471 63.376 10.061 34.717 1.00 0.00 C ATOM 60571 H13R PA 1471 63.018 9.357 35.472 1.00 0.00 H ATOM 60572 H13S PA 1471 63.908 10.877 35.211 1.00 0.00 H ATOM 60573 C112 PA 1471 64.507 9.271 33.909 1.00 0.00 C ATOM 60574 H12R PA 1471 65.465 9.600 34.318 1.00 0.00 H ATOM 60575 H12S PA 1471 64.597 9.584 32.867 1.00 0.00 H ATOM 60576 C111 PA 1471 64.438 7.801 34.099 1.00 0.00 C ATOM 60577 H11R PA 1471 64.024 7.272 33.238 1.00 0.00 H ATOM 60578 H11S PA 1471 63.760 7.456 34.883 1.00 0.00 H ATOM 60579 C110 PA 1471 65.754 7.120 34.138 1.00 0.00 C ATOM 60580 H10R PA 1471 66.267 7.425 35.053 1.00 0.00 H ATOM 60581 H10S PA 1471 66.375 7.578 33.366 1.00 0.00 H ATOM 60582 C19 PA 1471 65.668 5.576 34.078 1.00 0.00 C ATOM 60583 H9R PA 1471 65.313 5.280 33.089 1.00 0.00 H ATOM 60584 H9S PA 1471 64.928 5.205 34.790 1.00 0.00 H ATOM 60585 C18 PA 1471 67.050 4.995 34.278 1.00 0.00 C ATOM 60586 H8R PA 1471 66.865 4.032 34.758 1.00 0.00 H ATOM 60587 H8S PA 1471 67.645 5.442 35.077 1.00 0.00 H ATOM 60588 C17 PA 1471 67.874 5.057 32.984 1.00 0.00 C ATOM 60589 H7R PA 1471 68.352 6.031 32.851 1.00 0.00 H ATOM 60590 H7S PA 1471 67.235 4.909 32.112 1.00 0.00 H ATOM 60591 C16 PA 1471 68.927 4.069 32.880 1.00 0.00 C ATOM 60592 H6R PA 1471 69.505 4.143 33.804 1.00 0.00 H ATOM 60593 H6S PA 1471 69.601 4.456 32.112 1.00 0.00 H ATOM 60594 C15 PA 1471 68.454 2.680 32.742 1.00 0.00 C ATOM 60595 H5R PA 1471 67.844 2.459 33.621 1.00 0.00 H ATOM 60596 H5S PA 1471 69.330 2.028 32.723 1.00 0.00 H ATOM 60597 C14 PA 1471 67.777 2.421 31.325 1.00 0.00 C ATOM 60598 H4R PA 1471 66.843 2.962 31.154 1.00 0.00 H ATOM 60599 H4S PA 1471 67.571 1.350 31.267 1.00 0.00 H ATOM 60600 C13 PA 1471 68.647 2.673 30.152 1.00 0.00 C ATOM 60601 H3R PA 1471 69.632 2.289 30.425 1.00 0.00 H ATOM 60602 H3S PA 1471 68.681 3.764 30.113 1.00 0.00 H ATOM 60603 C12 PA 1471 68.248 2.045 28.849 1.00 0.00 C ATOM 60604 H2R PA 1471 67.749 2.744 28.173 1.00 0.00 H ATOM 60605 H2S PA 1471 67.752 1.082 28.983 1.00 0.00 H ATOM 60606 C11 PGR 1472 69.491 1.829 28.004 1.00 0.00 C ATOM 60607 O12 PGR 1472 70.392 2.683 27.745 1.00 0.00 O ATOM 60608 O11 PGR 1472 69.578 0.568 27.586 1.00 0.00 O ATOM 60609 C1 PGR 1472 70.783 0.219 26.801 1.00 0.00 C ATOM 60610 HR PGR 1472 71.712 0.387 27.352 1.00 0.00 H ATOM 60611 HS PGR 1472 70.756 0.893 25.941 1.00 0.00 H ATOM 60612 C2 PGR 1472 70.748 -1.222 26.276 1.00 0.00 C ATOM 60613 HX PGR 1472 71.626 -1.479 25.679 1.00 0.00 H ATOM 60614 C3 PGR 1472 69.483 -1.576 25.470 1.00 0.00 C ATOM 60615 HA PGR 1472 68.731 -0.783 25.500 1.00 0.00 H ATOM 60616 HB PGR 1472 69.134 -2.496 25.946 1.00 0.00 H ATOM 60617 O31 PGR 1472 69.944 -1.901 24.187 1.00 0.00 O ATOM 60618 P31 PGR 1472 68.919 -2.279 22.953 1.00 0.00 P ATOM 60619 O32 PGR 1472 67.845 -1.108 23.026 1.00 0.00 O ATOM 60620 C31 PGR 1472 67.817 0.021 22.183 1.00 0.00 C ATOM 60621 H1A PGR 1472 68.776 0.540 22.109 1.00 0.00 H ATOM 60622 H1B PGR 1472 67.048 0.652 22.635 1.00 0.00 H ATOM 60623 C32 PGR 1472 67.296 -0.320 20.731 1.00 0.00 C ATOM 60624 H2A PGR 1472 66.552 -1.116 20.816 1.00 0.00 H ATOM 60625 O35 PGR 1472 68.355 -0.783 19.892 1.00 0.00 O ATOM 60626 HO5A PGR 1472 69.047 -1.218 20.422 1.00 0.00 H ATOM 60627 C33 PGR 1472 66.714 0.972 20.142 1.00 0.00 C ATOM 60628 H3A PGR 1472 65.788 1.214 20.671 1.00 0.00 H ATOM 60629 H3B PGR 1472 67.456 1.774 20.148 1.00 0.00 H ATOM 60630 O33 PGR 1472 69.695 -2.274 21.710 1.00 0.00 O ATOM 60631 O34 PGR 1472 68.199 -3.548 23.339 1.00 0.00 O ATOM 60632 O21 PGR 1472 70.643 -2.180 27.384 1.00 0.00 O ATOM 60633 C21 PGR 1472 71.681 -2.442 28.182 1.00 0.00 C ATOM 60634 O22 PGR 1472 72.745 -1.974 27.949 1.00 0.00 O ATOM 60635 O36 PGR 1472 66.384 0.687 18.768 1.00 0.00 O ATOM 60636 HO6A PGR 1472 65.966 1.467 18.360 1.00 0.00 H ATOM 60637 C12 OL 1473 71.316 -3.222 29.388 1.00 0.00 C ATOM 60638 H2R OL 1473 70.474 -3.877 29.155 1.00 0.00 H ATOM 60639 H2S OL 1473 72.156 -3.734 29.862 1.00 0.00 H ATOM 60640 C13 OL 1473 70.831 -2.253 30.429 1.00 0.00 C ATOM 60641 H3R OL 1473 69.996 -1.710 29.981 1.00 0.00 H ATOM 60642 H3S OL 1473 70.473 -2.735 31.341 1.00 0.00 H ATOM 60643 C14 OL 1473 71.924 -1.201 30.876 1.00 0.00 C ATOM 60644 H4R OL 1473 72.913 -1.664 30.842 1.00 0.00 H ATOM 60645 H4S OL 1473 71.873 -0.371 30.168 1.00 0.00 H ATOM 60646 C15 OL 1473 71.647 -0.662 32.264 1.00 0.00 C ATOM 60647 H5R OL 1473 72.315 0.199 32.342 1.00 0.00 H ATOM 60648 H5S OL 1473 70.668 -0.194 32.382 1.00 0.00 H ATOM 60649 C16 OL 1473 71.979 -1.703 33.297 1.00 0.00 C ATOM 60650 H6R OL 1473 71.482 -2.664 33.151 1.00 0.00 H ATOM 60651 H6S OL 1473 73.043 -1.913 33.424 1.00 0.00 H ATOM 60652 C17 OL 1473 71.242 -1.468 34.638 1.00 0.00 C ATOM 60653 H7R OL 1473 70.166 -1.401 34.459 1.00 0.00 H ATOM 60654 H7S OL 1473 71.361 -2.340 35.284 1.00 0.00 H ATOM 60655 C18 OL 1473 71.768 -0.217 35.374 1.00 0.00 C ATOM 60656 H8R OL 1473 72.847 -0.336 35.501 1.00 0.00 H ATOM 60657 H8S OL 1473 71.674 0.525 34.578 1.00 0.00 H ATOM 60658 C19 OL 1473 71.228 0.234 36.651 1.00 0.00 C ATOM 60659 H9R OL 1473 70.865 -0.540 37.323 1.00 0.00 H ATOM 60660 C110 OL 1473 71.039 1.450 37.008 1.00 0.00 C ATOM 60661 H10R OL 1473 70.642 1.726 37.982 1.00 0.00 H ATOM 60662 C111 OL 1473 71.398 2.665 36.264 1.00 0.00 C ATOM 60663 H11R OL 1473 71.142 2.587 35.205 1.00 0.00 H ATOM 60664 H11S OL 1473 70.767 3.479 36.627 1.00 0.00 H ATOM 60665 C112 OL 1473 72.970 3.032 36.350 1.00 0.00 C ATOM 60666 H12R OL 1473 73.166 3.560 37.286 1.00 0.00 H ATOM 60667 H12S OL 1473 73.572 2.151 36.584 1.00 0.00 H ATOM 60668 C113 OL 1473 73.470 3.883 35.115 1.00 0.00 C ATOM 60669 H13R OL 1473 73.005 4.871 35.135 1.00 0.00 H ATOM 60670 H13S OL 1473 74.533 4.052 35.299 1.00 0.00 H ATOM 60671 C114 OL 1473 73.168 3.453 33.663 1.00 0.00 C ATOM 60672 H14R OL 1473 73.486 2.432 33.441 1.00 0.00 H ATOM 60673 H14S OL 1473 72.091 3.447 33.483 1.00 0.00 H ATOM 60674 C115 OL 1473 73.806 4.282 32.596 1.00 0.00 C ATOM 60675 H15R OL 1473 73.572 5.340 32.735 1.00 0.00 H ATOM 60676 H15S OL 1473 74.854 4.013 32.748 1.00 0.00 H ATOM 60677 C116 OL 1473 73.355 3.771 31.192 1.00 0.00 C ATOM 60678 H16R OL 1473 72.298 3.962 30.997 1.00 0.00 H ATOM 60679 H16S OL 1473 73.823 4.515 30.544 1.00 0.00 H ATOM 60680 C117 OL 1473 73.762 2.419 30.802 1.00 0.00 C ATOM 60681 H17R OL 1473 74.790 2.247 31.127 1.00 0.00 H ATOM 60682 H17S OL 1473 73.225 1.689 31.411 1.00 0.00 H ATOM 60683 C118 OL 1473 73.626 2.156 29.318 1.00 0.00 C ATOM 60684 H18R OL 1473 74.049 1.155 29.210 1.00 0.00 H ATOM 60685 H18S OL 1473 74.169 2.826 28.648 1.00 0.00 H ATOM 60686 H18T OL 1473 72.572 2.216 29.040 1.00 0.00 H TER 60687 OL 1473 ATOM 60687 C116 PA 1474 83.096 16.556 37.706 1.00 0.00 C ATOM 60688 H16R PA 1474 82.859 16.210 38.714 1.00 0.00 H ATOM 60689 H16S PA 1474 84.139 16.273 37.549 1.00 0.00 H ATOM 60690 H16T PA 1474 82.464 16.001 37.010 1.00 0.00 H ATOM 60691 C115 PA 1474 83.036 18.033 37.434 1.00 0.00 C ATOM 60692 H15R PA 1474 83.498 18.635 38.219 1.00 0.00 H ATOM 60693 H15S PA 1474 82.030 18.457 37.470 1.00 0.00 H ATOM 60694 C114 PA 1474 83.724 18.363 36.062 1.00 0.00 C ATOM 60695 H14R PA 1474 84.735 17.951 36.066 1.00 0.00 H ATOM 60696 H14S PA 1474 83.948 19.432 36.085 1.00 0.00 H ATOM 60697 C113 PA 1474 82.881 17.855 34.828 1.00 0.00 C ATOM 60698 H13R PA 1474 82.235 17.044 35.171 1.00 0.00 H ATOM 60699 H13S PA 1474 83.641 17.487 34.135 1.00 0.00 H ATOM 60700 C112 PA 1474 82.181 18.920 34.062 1.00 0.00 C ATOM 60701 H12R PA 1474 82.905 19.602 33.612 1.00 0.00 H ATOM 60702 H12S PA 1474 81.600 19.515 34.769 1.00 0.00 H ATOM 60703 C111 PA 1474 81.248 18.303 32.994 1.00 0.00 C ATOM 60704 H11R PA 1474 80.687 17.466 33.415 1.00 0.00 H ATOM 60705 H11S PA 1474 81.747 17.885 32.117 1.00 0.00 H ATOM 60706 C110 PA 1474 80.156 19.209 32.494 1.00 0.00 C ATOM 60707 H10R PA 1474 80.742 19.929 31.919 1.00 0.00 H ATOM 60708 H10S PA 1474 79.751 19.803 33.316 1.00 0.00 H ATOM 60709 C19 PA 1474 79.042 18.599 31.625 1.00 0.00 C ATOM 60710 H9R PA 1474 78.648 17.683 32.072 1.00 0.00 H ATOM 60711 H9S PA 1474 79.563 18.146 30.779 1.00 0.00 H ATOM 60712 C18 PA 1474 78.103 19.638 31.061 1.00 0.00 C ATOM 60713 H8R PA 1474 78.627 20.414 30.499 1.00 0.00 H ATOM 60714 H8S PA 1474 77.719 20.214 31.905 1.00 0.00 H ATOM 60715 C17 PA 1474 76.851 19.113 30.344 1.00 0.00 C ATOM 60716 H7R PA 1474 76.127 18.600 30.981 1.00 0.00 H ATOM 60717 H7S PA 1474 77.185 18.374 29.614 1.00 0.00 H ATOM 60718 C16 PA 1474 76.113 20.268 29.599 1.00 0.00 C ATOM 60719 H6R PA 1474 75.317 19.904 28.947 1.00 0.00 H ATOM 60720 H6S PA 1474 76.845 20.819 29.006 1.00 0.00 H ATOM 60721 C15 PA 1474 75.631 21.326 30.550 1.00 0.00 C ATOM 60722 H5R PA 1474 76.391 21.902 31.082 1.00 0.00 H ATOM 60723 H5S PA 1474 74.969 20.865 31.285 1.00 0.00 H ATOM 60724 C14 PA 1474 74.846 22.383 29.739 1.00 0.00 C ATOM 60725 H4R PA 1474 74.251 22.893 30.500 1.00 0.00 H ATOM 60726 H4S PA 1474 74.181 21.940 28.995 1.00 0.00 H ATOM 60727 C13 PA 1474 75.710 23.406 28.941 1.00 0.00 C ATOM 60728 H3R PA 1474 76.331 23.045 28.119 1.00 0.00 H ATOM 60729 H3S PA 1474 76.514 23.741 29.601 1.00 0.00 H ATOM 60730 C12 PA 1474 74.981 24.697 28.336 1.00 0.00 C ATOM 60731 H2R PA 1474 75.747 25.404 28.011 1.00 0.00 H ATOM 60732 H2S PA 1474 74.580 25.227 29.203 1.00 0.00 H ATOM 60733 C11 PC 1475 73.914 24.495 27.341 1.00 0.00 C ATOM 60734 O12 PC 1475 72.851 25.115 27.294 1.00 0.00 O ATOM 60735 O11 PC 1475 74.117 23.406 26.592 1.00 0.00 O ATOM 60736 C1 PC 1475 73.037 22.920 25.803 1.00 0.00 C ATOM 60737 HR PC 1475 73.387 22.939 24.767 1.00 0.00 H ATOM 60738 HS PC 1475 72.094 23.471 25.799 1.00 0.00 H ATOM 60739 C2 PC 1475 72.777 21.436 26.177 1.00 0.00 C ATOM 60740 HX PC 1475 73.671 20.813 26.260 1.00 0.00 H ATOM 60741 C3 PC 1475 71.933 20.660 25.098 1.00 0.00 C ATOM 60742 HA PC 1475 71.719 19.673 25.515 1.00 0.00 H ATOM 60743 HB PC 1475 72.598 20.495 24.246 1.00 0.00 H ATOM 60744 O31 PC 1475 70.786 21.374 24.684 1.00 0.00 O ATOM 60745 P31 PC 1475 70.002 20.923 23.455 1.00 0.00 P ATOM 60746 O32 PC 1475 68.629 21.694 23.514 1.00 0.00 O ATOM 60747 C31 PC 1475 68.655 23.109 23.594 1.00 0.00 C ATOM 60748 H1A PC 1475 69.514 23.489 23.035 1.00 0.00 H ATOM 60749 H1B PC 1475 68.740 23.525 24.601 1.00 0.00 H ATOM 60750 C32 PC 1475 67.295 23.410 22.780 1.00 0.00 C ATOM 60751 H2A PC 1475 67.175 22.730 21.935 1.00 0.00 H ATOM 60752 H2B PC 1475 67.268 24.393 22.307 1.00 0.00 H ATOM 60753 N31 PC 1475 66.019 23.346 23.588 1.00 0.00 N ATOM 60754 C33 PC 1475 66.020 22.071 24.401 1.00 0.00 C ATOM 60755 H3A PC 1475 66.823 22.108 25.138 1.00 0.00 H ATOM 60756 H3B PC 1475 66.169 21.226 23.727 1.00 0.00 H ATOM 60757 H3C PC 1475 65.076 21.991 24.943 1.00 0.00 H ATOM 60758 C34 PC 1475 65.981 24.419 24.466 1.00 0.00 C ATOM 60759 H4A PC 1475 65.891 25.281 23.803 1.00 0.00 H ATOM 60760 H4B PC 1475 66.813 24.343 25.167 1.00 0.00 H ATOM 60761 H4C PC 1475 65.045 24.349 25.022 1.00 0.00 H ATOM 60762 C35 PC 1475 64.850 23.459 22.720 1.00 0.00 C ATOM 60763 H5A PC 1475 64.866 24.310 22.037 1.00 0.00 H ATOM 60764 H5B PC 1475 64.048 23.553 23.454 1.00 0.00 H ATOM 60765 H5C PC 1475 64.695 22.525 22.178 1.00 0.00 H ATOM 60766 O33 PC 1475 70.760 21.332 22.249 1.00 0.00 O ATOM 60767 O34 PC 1475 69.723 19.498 23.687 1.00 0.00 O ATOM 60768 O21 PC 1475 72.003 21.492 27.365 1.00 0.00 O ATOM 60769 C21 PC 1475 72.102 20.411 28.167 1.00 0.00 C ATOM 60770 O22 PC 1475 72.871 19.487 27.951 1.00 0.00 O ATOM 60771 C12 OL 1476 71.087 20.446 29.259 1.00 0.00 C ATOM 60772 H2R OL 1476 70.554 21.391 29.138 1.00 0.00 H ATOM 60773 H2S OL 1476 70.394 19.659 28.953 1.00 0.00 H ATOM 60774 C13 OL 1476 71.706 20.224 30.673 1.00 0.00 C ATOM 60775 H3R OL 1476 72.392 19.375 30.676 1.00 0.00 H ATOM 60776 H3S OL 1476 72.325 21.080 30.947 1.00 0.00 H ATOM 60777 C14 OL 1476 70.557 19.965 31.708 1.00 0.00 C ATOM 60778 H4R OL 1476 69.920 20.852 31.699 1.00 0.00 H ATOM 60779 H4S OL 1476 69.817 19.267 31.311 1.00 0.00 H ATOM 60780 C15 OL 1476 70.928 19.849 33.182 1.00 0.00 C ATOM 60781 H5R OL 1476 71.613 18.999 33.151 1.00 0.00 H ATOM 60782 H5S OL 1476 71.498 20.621 33.702 1.00 0.00 H ATOM 60783 C16 OL 1476 69.686 19.521 34.065 1.00 0.00 C ATOM 60784 H6R OL 1476 69.008 20.377 34.043 1.00 0.00 H ATOM 60785 H6S OL 1476 69.080 18.680 33.723 1.00 0.00 H ATOM 60786 C17 OL 1476 70.216 19.251 35.452 1.00 0.00 C ATOM 60787 H7R OL 1476 70.314 18.174 35.604 1.00 0.00 H ATOM 60788 H7S OL 1476 71.088 19.863 35.691 1.00 0.00 H ATOM 60789 C18 OL 1476 69.154 19.473 36.499 1.00 0.00 C ATOM 60790 H8R OL 1476 68.882 20.523 36.379 1.00 0.00 H ATOM 60791 H8S OL 1476 68.370 18.761 36.236 1.00 0.00 H ATOM 60792 C19 OL 1476 69.720 19.345 37.891 1.00 0.00 C ATOM 60793 H9R OL 1476 69.425 18.429 38.396 1.00 0.00 H ATOM 60794 C110 OL 1476 70.497 20.196 38.548 1.00 0.00 C ATOM 60795 H10R OL 1476 70.728 19.986 39.589 1.00 0.00 H ATOM 60796 C111 OL 1476 71.000 21.525 38.064 1.00 0.00 C ATOM 60797 H11R OL 1476 70.802 21.559 36.990 1.00 0.00 H ATOM 60798 H11S OL 1476 70.293 22.334 38.263 1.00 0.00 H ATOM 60799 C112 OL 1476 72.463 21.829 38.390 1.00 0.00 C ATOM 60800 H12R OL 1476 72.736 21.465 39.382 1.00 0.00 H ATOM 60801 H12S OL 1476 73.082 21.210 37.736 1.00 0.00 H ATOM 60802 C113 OL 1476 72.886 23.232 38.125 1.00 0.00 C ATOM 60803 H13R OL 1476 72.462 23.526 37.162 1.00 0.00 H ATOM 60804 H13S OL 1476 72.555 23.923 38.903 1.00 0.00 H ATOM 60805 C114 OL 1476 74.405 23.627 38.176 1.00 0.00 C ATOM 60806 H14R OL 1476 74.904 23.350 37.245 1.00 0.00 H ATOM 60807 H14S OL 1476 74.486 24.702 38.348 1.00 0.00 H ATOM 60808 C115 OL 1476 75.135 22.957 39.324 1.00 0.00 C ATOM 60809 H15R OL 1476 74.702 23.314 40.261 1.00 0.00 H ATOM 60810 H15S OL 1476 75.095 21.866 39.325 1.00 0.00 H ATOM 60811 C116 OL 1476 76.700 23.195 39.322 1.00 0.00 C ATOM 60812 H16R OL 1476 77.081 23.052 38.309 1.00 0.00 H ATOM 60813 H16S OL 1476 76.938 24.259 39.384 1.00 0.00 H ATOM 60814 C117 OL 1476 77.443 22.442 40.480 1.00 0.00 C ATOM 60815 H17R OL 1476 78.450 22.864 40.503 1.00 0.00 H ATOM 60816 H17S OL 1476 77.016 22.703 41.451 1.00 0.00 H ATOM 60817 C118 OL 1476 77.543 21.005 40.381 1.00 0.00 C ATOM 60818 H18R OL 1476 78.143 20.589 41.193 1.00 0.00 H ATOM 60819 H18S OL 1476 78.131 20.678 39.521 1.00 0.00 H ATOM 60820 H18T OL 1476 76.635 20.399 40.405 1.00 0.00 H TER 60821 OL 1476 ATOM 60821 C116 PA 1477 50.042 124.192 32.606 1.00 0.00 C ATOM 60822 H16R PA 1477 49.253 124.783 33.076 1.00 0.00 H ATOM 60823 H16S PA 1477 50.987 124.706 32.793 1.00 0.00 H ATOM 60824 H16T PA 1477 50.124 123.307 33.241 1.00 0.00 H ATOM 60825 C115 PA 1477 49.700 123.577 31.226 1.00 0.00 C ATOM 60826 H15R PA 1477 48.809 123.005 31.493 1.00 0.00 H ATOM 60827 H15S PA 1477 50.514 122.945 30.867 1.00 0.00 H ATOM 60828 C114 PA 1477 49.295 124.581 30.200 1.00 0.00 C ATOM 60829 H14R PA 1477 50.198 125.063 29.818 1.00 0.00 H ATOM 60830 H14S PA 1477 48.716 125.423 30.584 1.00 0.00 H ATOM 60831 C113 PA 1477 48.867 123.912 28.857 1.00 0.00 C ATOM 60832 H13R PA 1477 48.080 123.160 28.945 1.00 0.00 H ATOM 60833 H13S PA 1477 49.700 123.359 28.418 1.00 0.00 H ATOM 60834 C112 PA 1477 48.423 124.877 27.728 1.00 0.00 C ATOM 60835 H12R PA 1477 47.794 125.714 28.037 1.00 0.00 H ATOM 60836 H12S PA 1477 47.788 124.322 27.035 1.00 0.00 H ATOM 60837 C111 PA 1477 49.561 125.306 26.778 1.00 0.00 C ATOM 60838 H11R PA 1477 49.386 125.200 25.706 1.00 0.00 H ATOM 60839 H11S PA 1477 50.508 124.769 26.873 1.00 0.00 H ATOM 60840 C110 PA 1477 50.065 126.766 26.900 1.00 0.00 C ATOM 60841 H10R PA 1477 50.854 126.859 26.151 1.00 0.00 H ATOM 60842 H10S PA 1477 50.593 126.888 27.848 1.00 0.00 H ATOM 60843 C19 PA 1477 49.015 127.848 26.615 1.00 0.00 C ATOM 60844 H9R PA 1477 48.345 128.188 27.408 1.00 0.00 H ATOM 60845 H9S PA 1477 48.335 127.481 25.844 1.00 0.00 H ATOM 60846 C18 PA 1477 49.471 129.117 25.832 1.00 0.00 C ATOM 60847 H8R PA 1477 48.529 129.562 25.507 1.00 0.00 H ATOM 60848 H8S PA 1477 50.040 128.831 24.945 1.00 0.00 H ATOM 60849 C17 PA 1477 50.291 130.001 26.725 1.00 0.00 C ATOM 60850 H7R PA 1477 51.229 129.445 26.770 1.00 0.00 H ATOM 60851 H7S PA 1477 49.839 130.100 27.715 1.00 0.00 H ATOM 60852 C16 PA 1477 50.716 131.357 26.133 1.00 0.00 C ATOM 60853 H6R PA 1477 49.786 131.883 25.905 1.00 0.00 H ATOM 60854 H6S PA 1477 51.387 131.163 25.294 1.00 0.00 H ATOM 60855 C15 PA 1477 51.519 132.308 27.032 1.00 0.00 C ATOM 60856 H5R PA 1477 52.444 131.887 27.429 1.00 0.00 H ATOM 60857 H5S PA 1477 50.913 132.455 27.929 1.00 0.00 H ATOM 60858 C14 PA 1477 51.925 133.586 26.341 1.00 0.00 C ATOM 60859 H4R PA 1477 51.978 134.165 27.265 1.00 0.00 H ATOM 60860 H4S PA 1477 51.097 133.925 25.716 1.00 0.00 H ATOM 60861 C13 PA 1477 53.267 133.586 25.523 1.00 0.00 C ATOM 60862 H3R PA 1477 53.168 132.877 24.698 1.00 0.00 H ATOM 60863 H3S PA 1477 54.119 133.320 26.153 1.00 0.00 H ATOM 60864 C12 PA 1477 53.491 134.863 24.766 1.00 0.00 C ATOM 60865 H2R PA 1477 54.243 134.725 23.986 1.00 0.00 H ATOM 60866 H2S PA 1477 53.809 135.714 25.372 1.00 0.00 H ATOM 60867 C11 PGR 1478 52.355 135.377 23.920 1.00 0.00 C ATOM 60868 O12 PGR 1478 52.164 136.572 23.831 1.00 0.00 O ATOM 60869 O11 PGR 1478 51.541 134.354 23.407 1.00 0.00 O ATOM 60870 C1 PGR 1478 50.474 134.752 22.511 1.00 0.00 C ATOM 60871 HR PGR 1478 50.932 135.257 21.657 1.00 0.00 H ATOM 60872 HS PGR 1478 49.785 135.447 22.999 1.00 0.00 H ATOM 60873 C2 PGR 1478 49.611 133.501 22.169 1.00 0.00 C ATOM 60874 HX PGR 1478 50.341 132.689 22.111 1.00 0.00 H ATOM 60875 C3 PGR 1478 48.618 133.743 20.994 1.00 0.00 C ATOM 60876 HA PGR 1478 48.391 134.811 20.941 1.00 0.00 H ATOM 60877 HB PGR 1478 47.702 133.179 21.183 1.00 0.00 H ATOM 60878 O31 PGR 1478 49.310 133.305 19.843 1.00 0.00 O ATOM 60879 P31 PGR 1478 48.797 133.368 18.357 1.00 0.00 P ATOM 60880 O32 PGR 1478 47.967 132.072 18.276 1.00 0.00 O ATOM 60881 C31 PGR 1478 48.504 130.774 18.075 1.00 0.00 C ATOM 60882 H1A PGR 1478 49.452 130.757 18.619 1.00 0.00 H ATOM 60883 H1B PGR 1478 48.711 130.529 17.030 1.00 0.00 H ATOM 60884 C32 PGR 1478 47.489 129.759 18.633 1.00 0.00 C ATOM 60885 H2A PGR 1478 46.539 129.829 18.097 1.00 0.00 H ATOM 60886 O35 PGR 1478 47.230 130.133 20.029 1.00 0.00 O ATOM 60887 HO5A PGR 1478 46.807 131.010 20.008 1.00 0.00 H ATOM 60888 C33 PGR 1478 48.103 128.340 18.561 1.00 0.00 C ATOM 60889 H3A PGR 1478 47.178 127.761 18.512 1.00 0.00 H ATOM 60890 H3B PGR 1478 48.633 128.279 17.608 1.00 0.00 H ATOM 60891 O33 PGR 1478 47.913 134.455 18.160 1.00 0.00 O ATOM 60892 O34 PGR 1478 49.938 133.258 17.426 1.00 0.00 O ATOM 60893 O21 PGR 1478 48.742 133.312 23.379 1.00 0.00 O ATOM 60894 C21 PGR 1478 48.087 132.152 23.548 1.00 0.00 C ATOM 60895 O22 PGR 1478 48.430 131.132 22.949 1.00 0.00 O ATOM 60896 O36 PGR 1478 49.006 128.075 19.720 1.00 0.00 O ATOM 60897 HO6A PGR 1478 49.399 127.189 19.619 1.00 0.00 H ATOM 60898 C12 OL 1479 47.019 132.223 24.650 1.00 0.00 C ATOM 60899 H2R OL 1479 46.366 131.351 24.573 1.00 0.00 H ATOM 60900 H2S OL 1479 47.557 132.040 25.583 1.00 0.00 H ATOM 60901 C13 OL 1479 46.247 133.497 24.692 1.00 0.00 C ATOM 60902 H3R OL 1479 46.878 134.304 25.069 1.00 0.00 H ATOM 60903 H3S OL 1479 46.071 133.685 23.631 1.00 0.00 H ATOM 60904 C14 OL 1479 44.837 133.435 25.403 1.00 0.00 C ATOM 60905 H4R OL 1479 44.282 134.215 24.880 1.00 0.00 H ATOM 60906 H4S OL 1479 44.359 132.478 25.184 1.00 0.00 H ATOM 60907 C15 OL 1479 44.730 133.794 26.921 1.00 0.00 C ATOM 60908 H5R OL 1479 45.387 133.085 27.429 1.00 0.00 H ATOM 60909 H5S OL 1479 45.123 134.799 27.088 1.00 0.00 H ATOM 60910 C16 OL 1479 43.305 133.854 27.592 1.00 0.00 C ATOM 60911 H6R OL 1479 42.927 134.815 27.238 1.00 0.00 H ATOM 60912 H6S OL 1479 42.663 133.043 27.241 1.00 0.00 H ATOM 60913 C17 OL 1479 43.274 133.781 29.129 1.00 0.00 C ATOM 60914 H7R OL 1479 43.906 134.606 29.466 1.00 0.00 H ATOM 60915 H7S OL 1479 42.279 134.018 29.510 1.00 0.00 H ATOM 60916 C18 OL 1479 43.735 132.445 29.738 1.00 0.00 C ATOM 60917 H8R OL 1479 44.661 132.215 29.207 1.00 0.00 H ATOM 60918 H8S OL 1479 43.895 132.574 30.811 1.00 0.00 H ATOM 60919 C19 OL 1479 42.749 131.350 29.604 1.00 0.00 C ATOM 60920 H9R OL 1479 42.522 131.092 28.573 1.00 0.00 H ATOM 60921 C110 OL 1479 41.892 130.942 30.476 1.00 0.00 C ATOM 60922 H10R OL 1479 41.189 130.156 30.212 1.00 0.00 H ATOM 60923 C111 OL 1479 41.786 131.260 31.997 1.00 0.00 C ATOM 60924 H11R OL 1479 41.970 132.333 32.084 1.00 0.00 H ATOM 60925 H11S OL 1479 40.766 131.010 32.297 1.00 0.00 H ATOM 60926 C112 OL 1479 42.886 130.409 32.750 1.00 0.00 C ATOM 60927 H12R OL 1479 42.828 129.344 32.515 1.00 0.00 H ATOM 60928 H12S OL 1479 43.900 130.709 32.477 1.00 0.00 H ATOM 60929 C113 OL 1479 42.888 130.482 34.321 1.00 0.00 C ATOM 60930 H13R OL 1479 43.558 129.721 34.726 1.00 0.00 H ATOM 60931 H13S OL 1479 43.291 131.440 34.659 1.00 0.00 H ATOM 60932 C114 OL 1479 41.491 130.133 34.878 1.00 0.00 C ATOM 60933 H14R OL 1479 40.738 130.857 34.560 1.00 0.00 H ATOM 60934 H14S OL 1479 41.258 129.164 34.432 1.00 0.00 H ATOM 60935 C115 OL 1479 41.440 130.057 36.386 1.00 0.00 C ATOM 60936 H15R OL 1479 40.390 129.904 36.645 1.00 0.00 H ATOM 60937 H15S OL 1479 41.953 129.159 36.735 1.00 0.00 H ATOM 60938 C116 OL 1479 42.033 131.271 37.104 1.00 0.00 C ATOM 60939 H16R OL 1479 43.063 131.510 36.832 1.00 0.00 H ATOM 60940 H16S OL 1479 41.442 132.170 36.912 1.00 0.00 H ATOM 60941 C117 OL 1479 41.989 131.254 38.641 1.00 0.00 C ATOM 60942 H17R OL 1479 40.932 131.031 38.799 1.00 0.00 H ATOM 60943 H17S OL 1479 42.652 130.439 38.940 1.00 0.00 H ATOM 60944 C118 OL 1479 42.408 132.605 39.285 1.00 0.00 C ATOM 60945 H18R OL 1479 41.535 133.257 39.356 1.00 0.00 H ATOM 60946 H18S OL 1479 43.251 133.118 38.818 1.00 0.00 H ATOM 60947 H18T OL 1479 42.774 132.484 40.307 1.00 0.00 H TER 60948 OL 1479 ATOM 60948 C116 PA 1480 48.508 35.842 36.233 1.00 0.00 C ATOM 60949 H16R PA 1480 47.934 35.175 36.878 1.00 0.00 H ATOM 60950 H16S PA 1480 48.734 36.761 36.778 1.00 0.00 H ATOM 60951 H16T PA 1480 49.513 35.463 36.037 1.00 0.00 H ATOM 60952 C115 PA 1480 47.873 36.272 34.905 1.00 0.00 C ATOM 60953 H15R PA 1480 46.955 36.770 35.225 1.00 0.00 H ATOM 60954 H15S PA 1480 47.496 35.454 34.288 1.00 0.00 H ATOM 60955 C114 PA 1480 48.708 37.210 34.052 1.00 0.00 C ATOM 60956 H14R PA 1480 48.815 38.122 34.643 1.00 0.00 H ATOM 60957 H14S PA 1480 48.228 37.579 33.143 1.00 0.00 H ATOM 60958 C113 PA 1480 50.117 36.722 33.706 1.00 0.00 C ATOM 60959 H13R PA 1480 50.136 35.663 33.442 1.00 0.00 H ATOM 60960 H13S PA 1480 50.755 36.815 34.588 1.00 0.00 H ATOM 60961 C112 PA 1480 50.704 37.520 32.619 1.00 0.00 C ATOM 60962 H12R PA 1480 50.546 38.555 32.927 1.00 0.00 H ATOM 60963 H12S PA 1480 50.142 37.464 31.684 1.00 0.00 H ATOM 60964 C111 PA 1480 52.118 37.163 32.225 1.00 0.00 C ATOM 60965 H11R PA 1480 52.756 37.277 33.104 1.00 0.00 H ATOM 60966 H11S PA 1480 52.384 37.866 31.432 1.00 0.00 H ATOM 60967 C110 PA 1480 52.278 35.744 31.782 1.00 0.00 C ATOM 60968 H10R PA 1480 51.349 35.504 31.261 1.00 0.00 H ATOM 60969 H10S PA 1480 52.263 35.121 32.679 1.00 0.00 H ATOM 60970 C19 PA 1480 53.424 35.539 30.805 1.00 0.00 C ATOM 60971 H9R PA 1480 54.370 35.653 31.338 1.00 0.00 H ATOM 60972 H9S PA 1480 53.371 36.215 29.949 1.00 0.00 H ATOM 60973 C18 PA 1480 53.519 34.092 30.322 1.00 0.00 C ATOM 60974 H8R PA 1480 53.902 33.386 31.063 1.00 0.00 H ATOM 60975 H8S PA 1480 54.132 34.169 29.422 1.00 0.00 H ATOM 60976 C17 PA 1480 52.033 33.473 29.906 1.00 0.00 C ATOM 60977 H7R PA 1480 51.687 34.326 29.319 1.00 0.00 H ATOM 60978 H7S PA 1480 51.332 33.415 30.741 1.00 0.00 H ATOM 60979 C16 PA 1480 52.019 32.222 29.042 1.00 0.00 C ATOM 60980 H6R PA 1480 52.688 32.407 28.198 1.00 0.00 H ATOM 60981 H6S PA 1480 51.085 32.147 28.481 1.00 0.00 H ATOM 60982 C15 PA 1480 52.081 30.907 29.768 1.00 0.00 C ATOM 60983 H5R PA 1480 51.967 30.022 29.139 1.00 0.00 H ATOM 60984 H5S PA 1480 51.312 30.901 30.543 1.00 0.00 H ATOM 60985 C14 PA 1480 53.473 30.577 30.435 1.00 0.00 C ATOM 60986 H4R PA 1480 53.291 29.685 31.039 1.00 0.00 H ATOM 60987 H4S PA 1480 53.725 31.390 31.119 1.00 0.00 H ATOM 60988 C13 PA 1480 54.596 30.538 29.431 1.00 0.00 C ATOM 60989 H3R PA 1480 54.525 31.380 28.740 1.00 0.00 H ATOM 60990 H3S PA 1480 54.612 29.618 28.842 1.00 0.00 H ATOM 60991 C12 PA 1480 55.960 30.758 29.998 1.00 0.00 C ATOM 60992 H2R PA 1480 56.196 29.977 30.723 1.00 0.00 H ATOM 60993 H2S PA 1480 55.761 31.707 30.500 1.00 0.00 H ATOM 60994 C11 PGR 1481 57.005 30.783 28.916 1.00 0.00 C ATOM 60995 O12 PGR 1481 56.931 29.995 27.988 1.00 0.00 O ATOM 60996 O11 PGR 1481 58.127 31.528 29.210 1.00 0.00 O ATOM 60997 C1 PGR 1481 59.255 31.528 28.319 1.00 0.00 C ATOM 60998 HR PGR 1481 59.736 30.548 28.267 1.00 0.00 H ATOM 60999 HS PGR 1481 59.992 32.204 28.761 1.00 0.00 H ATOM 61000 C2 PGR 1481 58.817 32.083 26.819 1.00 0.00 C ATOM 61001 HX PGR 1481 57.866 31.600 26.581 1.00 0.00 H ATOM 61002 C3 PGR 1481 59.905 31.583 25.793 1.00 0.00 C ATOM 61003 HA PGR 1481 60.067 30.532 26.046 1.00 0.00 H ATOM 61004 HB PGR 1481 60.861 32.086 25.957 1.00 0.00 H ATOM 61005 O31 PGR 1481 59.414 31.718 24.516 1.00 0.00 O ATOM 61006 P31 PGR 1481 60.196 31.064 23.255 1.00 0.00 P ATOM 61007 O32 PGR 1481 59.128 31.069 22.081 1.00 0.00 O ATOM 61008 C31 PGR 1481 58.063 30.191 22.050 1.00 0.00 C ATOM 61009 H1A PGR 1481 57.683 30.096 23.070 1.00 0.00 H ATOM 61010 H1B PGR 1481 58.371 29.236 21.615 1.00 0.00 H ATOM 61011 C32 PGR 1481 56.853 30.598 21.221 1.00 0.00 C ATOM 61012 H2A PGR 1481 57.052 30.658 20.148 1.00 0.00 H ATOM 61013 O35 PGR 1481 56.551 31.886 21.706 1.00 0.00 O ATOM 61014 HO5A PGR 1481 55.731 32.171 21.264 1.00 0.00 H ATOM 61015 C33 PGR 1481 55.646 29.681 21.520 1.00 0.00 C ATOM 61016 H3A PGR 1481 55.781 28.652 21.177 1.00 0.00 H ATOM 61017 H3B PGR 1481 55.447 29.529 22.584 1.00 0.00 H ATOM 61018 O33 PGR 1481 61.306 31.983 22.960 1.00 0.00 O ATOM 61019 O34 PGR 1481 60.521 29.657 23.646 1.00 0.00 O ATOM 61020 O21 PGR 1481 58.850 33.582 26.694 1.00 0.00 O ATOM 61021 C21 PGR 1481 57.805 34.306 27.193 1.00 0.00 C ATOM 61022 O22 PGR 1481 56.814 33.767 27.739 1.00 0.00 O ATOM 61023 O36 PGR 1481 54.497 30.085 20.775 1.00 0.00 O ATOM 61024 HO6A PGR 1481 54.669 29.829 19.851 1.00 0.00 H ATOM 61025 C12 OL 1482 57.865 35.797 26.897 1.00 0.00 C ATOM 61026 H2R OL 1482 57.755 35.933 25.819 1.00 0.00 H ATOM 61027 H2S OL 1482 57.026 36.216 27.457 1.00 0.00 H ATOM 61028 C13 OL 1482 59.245 36.336 27.211 1.00 0.00 C ATOM 61029 H3R OL 1482 59.992 36.009 26.485 1.00 0.00 H ATOM 61030 H3S OL 1482 59.166 37.413 27.048 1.00 0.00 H ATOM 61031 C14 OL 1482 59.762 35.998 28.573 1.00 0.00 C ATOM 61032 H4R OL 1482 58.980 36.122 29.325 1.00 0.00 H ATOM 61033 H4S OL 1482 59.984 34.930 28.623 1.00 0.00 H ATOM 61034 C15 OL 1482 61.026 36.668 29.003 1.00 0.00 C ATOM 61035 H5R OL 1482 61.376 36.368 29.993 1.00 0.00 H ATOM 61036 H5S OL 1482 61.856 36.441 28.330 1.00 0.00 H ATOM 61037 C16 OL 1482 61.008 38.158 29.143 1.00 0.00 C ATOM 61038 H6R OL 1482 62.022 38.417 29.453 1.00 0.00 H ATOM 61039 H6S OL 1482 60.692 38.678 28.236 1.00 0.00 H ATOM 61040 C17 OL 1482 59.994 38.525 30.252 1.00 0.00 C ATOM 61041 H7R OL 1482 59.037 38.196 29.843 1.00 0.00 H ATOM 61042 H7S OL 1482 60.198 37.896 31.121 1.00 0.00 H ATOM 61043 C18 OL 1482 60.000 39.974 30.747 1.00 0.00 C ATOM 61044 H8R OL 1482 60.980 40.220 31.162 1.00 0.00 H ATOM 61045 H8S OL 1482 59.938 40.628 29.875 1.00 0.00 H ATOM 61046 C19 OL 1482 58.848 40.142 31.663 1.00 0.00 C ATOM 61047 H9R OL 1482 57.886 39.994 31.178 1.00 0.00 H ATOM 61048 C110 OL 1482 58.967 40.164 33.000 1.00 0.00 C ATOM 61049 H10R OL 1482 58.145 40.156 33.711 1.00 0.00 H ATOM 61050 C111 OL 1482 60.232 40.015 33.827 1.00 0.00 C ATOM 61051 H11R OL 1482 60.983 39.518 33.209 1.00 0.00 H ATOM 61052 H11S OL 1482 60.614 40.966 34.204 1.00 0.00 H ATOM 61053 C112 OL 1482 60.068 39.044 35.016 1.00 0.00 C ATOM 61054 H12R OL 1482 60.971 39.159 35.619 1.00 0.00 H ATOM 61055 H12S OL 1482 59.154 39.227 35.584 1.00 0.00 H ATOM 61056 C113 OL 1482 59.869 37.523 34.753 1.00 0.00 C ATOM 61057 H13R OL 1482 58.846 37.368 34.404 1.00 0.00 H ATOM 61058 H13S OL 1482 60.575 37.099 34.036 1.00 0.00 H ATOM 61059 C114 OL 1482 59.990 36.708 36.088 1.00 0.00 C ATOM 61060 H14R OL 1482 60.893 36.961 36.645 1.00 0.00 H ATOM 61061 H14S OL 1482 59.182 37.138 36.683 1.00 0.00 H ATOM 61062 C115 OL 1482 59.848 35.151 35.863 1.00 0.00 C ATOM 61063 H15R OL 1482 58.944 35.042 35.261 1.00 0.00 H ATOM 61064 H15S OL 1482 60.595 34.674 35.226 1.00 0.00 H ATOM 61065 C116 OL 1482 59.524 34.452 37.233 1.00 0.00 C ATOM 61066 H16R OL 1482 58.664 34.936 37.700 1.00 0.00 H ATOM 61067 H16S OL 1482 59.301 33.414 36.979 1.00 0.00 H ATOM 61068 C117 OL 1482 60.650 34.557 38.244 1.00 0.00 C ATOM 61069 H17R OL 1482 60.730 35.534 38.725 1.00 0.00 H ATOM 61070 H17S OL 1482 60.326 33.983 39.115 1.00 0.00 H ATOM 61071 C118 OL 1482 61.922 33.911 37.884 1.00 0.00 C ATOM 61072 H18R OL 1482 62.234 34.348 36.933 1.00 0.00 H ATOM 61073 H18S OL 1482 61.833 32.825 37.810 1.00 0.00 H ATOM 61074 H18T OL 1482 62.777 34.174 38.512 1.00 0.00 H TER 61075 OL 1482 ATOM 61075 C116 PA 1483 94.268 15.868 36.315 1.00 0.00 C ATOM 61076 H16R PA 1483 95.147 15.222 36.362 1.00 0.00 H ATOM 61077 H16S PA 1483 93.398 15.374 36.751 1.00 0.00 H ATOM 61078 H16T PA 1483 94.430 16.679 37.028 1.00 0.00 H ATOM 61079 C115 PA 1483 94.096 16.377 34.885 1.00 0.00 C ATOM 61080 H15R PA 1483 95.013 16.849 34.526 1.00 0.00 H ATOM 61081 H15S PA 1483 93.276 17.097 34.844 1.00 0.00 H ATOM 61082 C114 PA 1483 93.712 15.337 33.867 1.00 0.00 C ATOM 61083 H14R PA 1483 92.712 14.999 34.148 1.00 0.00 H ATOM 61084 H14S PA 1483 94.256 14.392 33.927 1.00 0.00 H ATOM 61085 C113 PA 1483 93.733 15.786 32.443 1.00 0.00 C ATOM 61086 H13R PA 1483 94.802 15.943 32.281 1.00 0.00 H ATOM 61087 H13S PA 1483 93.475 16.844 32.363 1.00 0.00 H ATOM 61088 C112 PA 1483 92.978 14.831 31.412 1.00 0.00 C ATOM 61089 H12R PA 1483 93.331 13.801 31.500 1.00 0.00 H ATOM 61090 H12S PA 1483 93.308 14.947 30.378 1.00 0.00 H ATOM 61091 C111 PA 1483 91.464 14.990 31.603 1.00 0.00 C ATOM 61092 H11R PA 1483 91.312 15.458 32.577 1.00 0.00 H ATOM 61093 H11S PA 1483 91.050 13.989 31.744 1.00 0.00 H ATOM 61094 C110 PA 1483 90.731 15.736 30.502 1.00 0.00 C ATOM 61095 H10R PA 1483 90.962 15.181 29.590 1.00 0.00 H ATOM 61096 H10S PA 1483 91.095 16.738 30.267 1.00 0.00 H ATOM 61097 C19 PA 1483 89.182 15.866 30.699 1.00 0.00 C ATOM 61098 H9R PA 1483 89.107 16.697 31.403 1.00 0.00 H ATOM 61099 H9S PA 1483 88.842 14.936 31.160 1.00 0.00 H ATOM 61100 C18 PA 1483 88.270 16.308 29.576 1.00 0.00 C ATOM 61101 H8R PA 1483 88.702 17.238 29.200 1.00 0.00 H ATOM 61102 H8S PA 1483 87.325 16.629 30.018 1.00 0.00 H ATOM 61103 C17 PA 1483 88.224 15.425 28.372 1.00 0.00 C ATOM 61104 H7R PA 1483 87.708 14.501 28.639 1.00 0.00 H ATOM 61105 H7S PA 1483 89.252 15.177 28.100 1.00 0.00 H ATOM 61106 C16 PA 1483 87.395 16.029 27.179 1.00 0.00 C ATOM 61107 H6R PA 1483 87.639 17.064 26.934 1.00 0.00 H ATOM 61108 H6S PA 1483 86.385 16.204 27.557 1.00 0.00 H ATOM 61109 C15 PA 1483 87.518 15.062 25.985 1.00 0.00 C ATOM 61110 H5R PA 1483 87.138 14.099 26.331 1.00 0.00 H ATOM 61111 H5S PA 1483 88.587 15.036 25.761 1.00 0.00 H ATOM 61112 C14 PA 1483 86.797 15.426 24.680 1.00 0.00 C ATOM 61113 H4R PA 1483 85.724 15.298 24.835 1.00 0.00 H ATOM 61114 H4S PA 1483 86.987 14.726 23.864 1.00 0.00 H ATOM 61115 C13 PA 1483 87.123 16.858 24.125 1.00 0.00 C ATOM 61116 H3R PA 1483 86.666 17.645 24.730 1.00 0.00 H ATOM 61117 H3S PA 1483 86.437 17.033 23.293 1.00 0.00 H ATOM 61118 C12 PA 1483 88.582 17.103 23.718 1.00 0.00 C ATOM 61119 H2R PA 1483 89.378 17.015 24.461 1.00 0.00 H ATOM 61120 H2S PA 1483 88.734 18.144 23.423 1.00 0.00 H ATOM 61121 C11 PGR 1484 89.084 16.212 22.593 1.00 0.00 C ATOM 61122 O12 PGR 1484 88.635 16.217 21.478 1.00 0.00 O ATOM 61123 O11 PGR 1484 90.076 15.504 22.976 1.00 0.00 O ATOM 61124 C1 PGR 1484 91.088 14.909 22.065 1.00 0.00 C ATOM 61125 HR PGR 1484 90.568 14.020 21.701 1.00 0.00 H ATOM 61126 HS PGR 1484 91.902 14.472 22.649 1.00 0.00 H ATOM 61127 C2 PGR 1484 91.609 15.769 20.937 1.00 0.00 C ATOM 61128 HX PGR 1484 90.775 16.407 20.634 1.00 0.00 H ATOM 61129 C3 PGR 1484 92.144 15.001 19.765 1.00 0.00 C ATOM 61130 HA PGR 1484 92.258 13.933 19.968 1.00 0.00 H ATOM 61131 HB PGR 1484 93.147 15.310 19.459 1.00 0.00 H ATOM 61132 O31 PGR 1484 91.225 15.267 18.766 1.00 0.00 O ATOM 61133 P31 PGR 1484 91.055 14.258 17.516 1.00 0.00 P ATOM 61134 O32 PGR 1484 92.370 14.618 16.663 1.00 0.00 O ATOM 61135 C31 PGR 1484 92.525 15.923 16.131 1.00 0.00 C ATOM 61136 H1A PGR 1484 92.618 16.616 16.971 1.00 0.00 H ATOM 61137 H1B PGR 1484 91.552 16.153 15.689 1.00 0.00 H ATOM 61138 C32 PGR 1484 93.687 16.021 15.017 1.00 0.00 C ATOM 61139 H2A PGR 1484 93.649 17.050 14.649 1.00 0.00 H ATOM 61140 O35 PGR 1484 95.027 15.853 15.625 1.00 0.00 O ATOM 61141 HO5A PGR 1484 95.730 16.100 14.999 1.00 0.00 H ATOM 61142 C33 PGR 1484 93.411 15.093 13.812 1.00 0.00 C ATOM 61143 H3A PGR 1484 93.445 14.039 14.099 1.00 0.00 H ATOM 61144 H3B PGR 1484 92.415 15.363 13.452 1.00 0.00 H ATOM 61145 O33 PGR 1484 91.232 12.869 17.988 1.00 0.00 O ATOM 61146 O34 PGR 1484 89.851 14.600 16.694 1.00 0.00 O ATOM 61147 O21 PGR 1484 92.750 16.639 21.360 1.00 0.00 O ATOM 61148 C21 PGR 1484 92.557 17.854 21.885 1.00 0.00 C ATOM 61149 O22 PGR 1484 91.496 18.513 21.792 1.00 0.00 O ATOM 61150 O36 PGR 1484 94.428 15.465 12.872 1.00 0.00 O ATOM 61151 HO6A PGR 1484 94.231 16.359 12.541 1.00 0.00 H ATOM 61152 C12 OL 1485 93.814 18.389 22.588 1.00 0.00 C ATOM 61153 H2R OL 1485 93.964 17.766 23.472 1.00 0.00 H ATOM 61154 H2S OL 1485 94.666 18.209 21.930 1.00 0.00 H ATOM 61155 C13 OL 1485 93.796 19.937 22.829 1.00 0.00 C ATOM 61156 H3R OL 1485 93.846 20.448 21.865 1.00 0.00 H ATOM 61157 H3S OL 1485 92.818 20.221 23.225 1.00 0.00 H ATOM 61158 C14 OL 1485 94.780 20.487 23.870 1.00 0.00 C ATOM 61159 H4R OL 1485 95.708 19.914 23.925 1.00 0.00 H ATOM 61160 H4S OL 1485 95.165 21.467 23.578 1.00 0.00 H ATOM 61161 C15 OL 1485 94.236 20.479 25.245 1.00 0.00 C ATOM 61162 H5R OL 1485 93.270 20.970 25.114 1.00 0.00 H ATOM 61163 H5S OL 1485 94.109 19.425 25.504 1.00 0.00 H ATOM 61164 C16 OL 1485 95.073 21.328 26.177 1.00 0.00 C ATOM 61165 H6R OL 1485 96.058 20.877 26.315 1.00 0.00 H ATOM 61166 H6S OL 1485 95.295 22.292 25.716 1.00 0.00 H ATOM 61167 C17 OL 1485 94.429 21.503 27.603 1.00 0.00 C ATOM 61168 H7R OL 1485 93.445 21.975 27.554 1.00 0.00 H ATOM 61169 H7S OL 1485 94.377 20.494 28.016 1.00 0.00 H ATOM 61170 C18 OL 1485 95.194 22.439 28.584 1.00 0.00 C ATOM 61171 H8R OL 1485 94.736 22.366 29.572 1.00 0.00 H ATOM 61172 H8S OL 1485 96.279 22.359 28.677 1.00 0.00 H ATOM 61173 C19 OL 1485 94.853 23.759 28.049 1.00 0.00 C ATOM 61174 H9R OL 1485 95.588 24.103 27.325 1.00 0.00 H ATOM 61175 C110 OL 1485 93.790 24.523 28.331 1.00 0.00 C ATOM 61176 H10R OL 1485 93.635 25.441 27.771 1.00 0.00 H ATOM 61177 C111 OL 1485 92.611 24.185 29.152 1.00 0.00 C ATOM 61178 H11R OL 1485 92.752 23.234 29.670 1.00 0.00 H ATOM 61179 H11S OL 1485 92.531 24.976 29.901 1.00 0.00 H ATOM 61180 C112 OL 1485 91.465 24.227 28.126 1.00 0.00 C ATOM 61181 H12R OL 1485 91.794 25.094 27.549 1.00 0.00 H ATOM 61182 H12S OL 1485 91.434 23.332 27.501 1.00 0.00 H ATOM 61183 C113 OL 1485 90.100 24.332 28.806 1.00 0.00 C ATOM 61184 H13R OL 1485 90.172 25.296 29.313 1.00 0.00 H ATOM 61185 H13S OL 1485 89.337 24.464 28.036 1.00 0.00 H ATOM 61186 C114 OL 1485 89.651 23.219 29.766 1.00 0.00 C ATOM 61187 H14R OL 1485 89.232 22.382 29.202 1.00 0.00 H ATOM 61188 H14S OL 1485 90.500 22.784 30.297 1.00 0.00 H ATOM 61189 C115 OL 1485 88.442 23.697 30.543 1.00 0.00 C ATOM 61190 H15R OL 1485 87.923 24.378 29.865 1.00 0.00 H ATOM 61191 H15S OL 1485 87.768 22.881 30.811 1.00 0.00 H ATOM 61192 C116 OL 1485 88.823 24.292 31.920 1.00 0.00 C ATOM 61193 H16R OL 1485 89.256 23.570 32.614 1.00 0.00 H ATOM 61194 H16S OL 1485 89.599 25.048 31.785 1.00 0.00 H ATOM 61195 C117 OL 1485 87.636 24.959 32.629 1.00 0.00 C ATOM 61196 H17R OL 1485 87.443 25.916 32.140 1.00 0.00 H ATOM 61197 H17S OL 1485 86.712 24.378 32.603 1.00 0.00 H ATOM 61198 C118 OL 1485 87.776 25.185 34.104 1.00 0.00 C ATOM 61199 H18R OL 1485 88.567 25.929 34.220 1.00 0.00 H ATOM 61200 H18S OL 1485 88.066 24.212 34.507 1.00 0.00 H ATOM 61201 H18T OL 1485 86.860 25.527 34.589 1.00 0.00 H TER 61202 OL 1485 ATOM 61202 C116 PA 1486 32.683 14.852 41.502 1.00 0.00 C ATOM 61203 H16R PA 1486 32.841 15.774 42.066 1.00 0.00 H ATOM 61204 H16S PA 1486 32.292 14.064 42.149 1.00 0.00 H ATOM 61205 H16T PA 1486 31.896 15.180 40.820 1.00 0.00 H ATOM 61206 C115 PA 1486 33.987 14.521 40.839 1.00 0.00 C ATOM 61207 H15R PA 1486 33.857 13.664 40.175 1.00 0.00 H ATOM 61208 H15S PA 1486 34.735 14.224 41.578 1.00 0.00 H ATOM 61209 C114 PA 1486 34.450 15.679 39.980 1.00 0.00 C ATOM 61210 H14R PA 1486 35.491 15.525 39.685 1.00 0.00 H ATOM 61211 H14S PA 1486 34.508 16.546 40.642 1.00 0.00 H ATOM 61212 C113 PA 1486 33.457 15.856 38.826 1.00 0.00 C ATOM 61213 H13R PA 1486 32.902 14.924 38.697 1.00 0.00 H ATOM 61214 H13S PA 1486 34.037 15.989 37.910 1.00 0.00 H ATOM 61215 C112 PA 1486 32.607 17.078 38.824 1.00 0.00 C ATOM 61216 H12R PA 1486 33.330 17.896 38.787 1.00 0.00 H ATOM 61217 H12S PA 1486 31.936 17.070 39.685 1.00 0.00 H ATOM 61218 C111 PA 1486 31.729 17.253 37.525 1.00 0.00 C ATOM 61219 H11R PA 1486 31.483 16.263 37.136 1.00 0.00 H ATOM 61220 H11S PA 1486 32.331 17.699 36.732 1.00 0.00 H ATOM 61221 C110 PA 1486 30.528 18.142 37.818 1.00 0.00 C ATOM 61222 H10R PA 1486 30.931 19.000 38.361 1.00 0.00 H ATOM 61223 H10S PA 1486 29.691 17.728 38.385 1.00 0.00 H ATOM 61224 C19 PA 1486 29.877 18.636 36.468 1.00 0.00 C ATOM 61225 H9R PA 1486 30.572 19.075 35.749 1.00 0.00 H ATOM 61226 H9S PA 1486 29.229 19.511 36.554 1.00 0.00 H ATOM 61227 C18 PA 1486 29.112 17.533 35.696 1.00 0.00 C ATOM 61228 H8R PA 1486 28.219 17.201 36.228 1.00 0.00 H ATOM 61229 H8S PA 1486 29.661 16.598 35.566 1.00 0.00 H ATOM 61230 C17 PA 1486 28.538 17.998 34.311 1.00 0.00 C ATOM 61231 H7R PA 1486 28.116 18.998 34.422 1.00 0.00 H ATOM 61232 H7S PA 1486 27.596 17.501 34.069 1.00 0.00 H ATOM 61233 C16 PA 1486 29.594 17.920 33.180 1.00 0.00 C ATOM 61234 H6R PA 1486 29.734 16.872 32.907 1.00 0.00 H ATOM 61235 H6S PA 1486 30.569 18.300 33.492 1.00 0.00 H ATOM 61236 C15 PA 1486 29.276 18.626 31.847 1.00 0.00 C ATOM 61237 H5R PA 1486 30.097 18.308 31.200 1.00 0.00 H ATOM 61238 H5S PA 1486 29.311 19.711 31.962 1.00 0.00 H ATOM 61239 C14 PA 1486 27.938 18.177 31.232 1.00 0.00 C ATOM 61240 H4R PA 1486 27.073 18.643 31.706 1.00 0.00 H ATOM 61241 H4S PA 1486 27.884 17.104 31.432 1.00 0.00 H ATOM 61242 C13 PA 1486 27.913 18.224 29.719 1.00 0.00 C ATOM 61243 H3R PA 1486 28.517 17.400 29.333 1.00 0.00 H ATOM 61244 H3S PA 1486 28.306 19.189 29.392 1.00 0.00 H ATOM 61245 C12 PA 1486 26.567 17.947 29.111 1.00 0.00 C ATOM 61246 H2R PA 1486 25.760 18.563 29.513 1.00 0.00 H ATOM 61247 H2S PA 1486 26.311 16.918 29.374 1.00 0.00 H ATOM 61248 C11 PGR 1487 26.664 18.087 27.653 1.00 0.00 C ATOM 61249 O12 PGR 1487 26.927 19.162 27.246 1.00 0.00 O ATOM 61250 O11 PGR 1487 26.415 16.942 26.984 1.00 0.00 O ATOM 61251 C1 PGR 1487 26.399 16.869 25.516 1.00 0.00 C ATOM 61252 HR PGR 1487 25.794 17.656 25.059 1.00 0.00 H ATOM 61253 HS PGR 1487 25.988 15.880 25.298 1.00 0.00 H ATOM 61254 C2 PGR 1487 27.897 16.912 24.993 1.00 0.00 C ATOM 61255 HX PGR 1487 28.373 17.781 25.454 1.00 0.00 H ATOM 61256 C3 PGR 1487 27.867 17.007 23.466 1.00 0.00 C ATOM 61257 HA PGR 1487 27.159 17.721 23.040 1.00 0.00 H ATOM 61258 HB PGR 1487 27.620 15.998 23.124 1.00 0.00 H ATOM 61259 O31 PGR 1487 29.128 17.274 22.939 1.00 0.00 O ATOM 61260 P31 PGR 1487 29.712 18.744 22.722 1.00 0.00 P ATOM 61261 O32 PGR 1487 30.045 19.381 24.129 1.00 0.00 O ATOM 61262 C31 PGR 1487 31.062 18.940 24.877 1.00 0.00 C ATOM 61263 H1A PGR 1487 31.901 19.227 24.239 1.00 0.00 H ATOM 61264 H1B PGR 1487 31.072 17.879 25.140 1.00 0.00 H ATOM 61265 C32 PGR 1487 31.277 19.763 26.178 1.00 0.00 C ATOM 61266 H2A PGR 1487 32.237 19.512 26.637 1.00 0.00 H ATOM 61267 O35 PGR 1487 30.175 19.627 27.060 1.00 0.00 O ATOM 61268 HO5A PGR 1487 30.129 18.662 27.185 1.00 0.00 H ATOM 61269 C33 PGR 1487 31.247 21.274 25.877 1.00 0.00 C ATOM 61270 H3A PGR 1487 32.050 21.437 25.154 1.00 0.00 H ATOM 61271 H3B PGR 1487 30.281 21.494 25.416 1.00 0.00 H ATOM 61272 O33 PGR 1487 30.871 18.628 21.850 1.00 0.00 O ATOM 61273 O34 PGR 1487 28.578 19.501 22.231 1.00 0.00 O ATOM 61274 O21 PGR 1487 28.589 15.712 25.333 1.00 0.00 O ATOM 61275 C21 PGR 1487 29.324 15.709 26.489 1.00 0.00 C ATOM 61276 O22 PGR 1487 29.768 16.681 27.017 1.00 0.00 O ATOM 61277 O36 PGR 1487 31.502 21.984 27.173 1.00 0.00 O ATOM 61278 HO6A PGR 1487 30.687 21.808 27.676 1.00 0.00 H ATOM 61279 C12 OL 1488 29.676 14.345 26.928 1.00 0.00 C ATOM 61280 H2R OL 1488 29.070 13.710 26.279 1.00 0.00 H ATOM 61281 H2S OL 1488 30.749 14.197 26.791 1.00 0.00 H ATOM 61282 C13 OL 1488 29.212 14.070 28.425 1.00 0.00 C ATOM 61283 H3R OL 1488 29.575 13.088 28.734 1.00 0.00 H ATOM 61284 H3S OL 1488 29.864 14.642 29.087 1.00 0.00 H ATOM 61285 C14 OL 1488 27.666 14.029 28.683 1.00 0.00 C ATOM 61286 H4R OL 1488 27.216 14.943 28.291 1.00 0.00 H ATOM 61287 H4S OL 1488 27.164 13.251 28.104 1.00 0.00 H ATOM 61288 C15 OL 1488 27.221 14.006 30.121 1.00 0.00 C ATOM 61289 H5R OL 1488 27.748 13.270 30.732 1.00 0.00 H ATOM 61290 H5S OL 1488 27.461 14.961 30.591 1.00 0.00 H ATOM 61291 C16 OL 1488 25.690 13.813 30.215 1.00 0.00 C ATOM 61292 H6R OL 1488 25.262 14.735 29.814 1.00 0.00 H ATOM 61293 H6S OL 1488 25.259 13.145 29.467 1.00 0.00 H ATOM 61294 C17 OL 1488 25.026 13.669 31.625 1.00 0.00 C ATOM 61295 H7R OL 1488 23.937 13.707 31.554 1.00 0.00 H ATOM 61296 H7S OL 1488 25.066 12.670 32.065 1.00 0.00 H ATOM 61297 C18 OL 1488 25.545 14.540 32.826 1.00 0.00 C ATOM 61298 H8R OL 1488 24.952 14.279 33.705 1.00 0.00 H ATOM 61299 H8S OL 1488 26.588 14.251 32.974 1.00 0.00 H ATOM 61300 C19 OL 1488 25.436 16.009 32.511 1.00 0.00 C ATOM 61301 H9R OL 1488 26.041 16.346 31.673 1.00 0.00 H ATOM 61302 C110 OL 1488 24.800 17.035 33.139 1.00 0.00 C ATOM 61303 H10R OL 1488 24.931 18.084 32.890 1.00 0.00 H ATOM 61304 C111 OL 1488 23.884 17.017 34.321 1.00 0.00 C ATOM 61305 H11R OL 1488 23.612 15.983 34.547 1.00 0.00 H ATOM 61306 H11S OL 1488 24.373 17.389 35.224 1.00 0.00 H ATOM 61307 C112 OL 1488 22.685 17.879 33.905 1.00 0.00 C ATOM 61308 H12R OL 1488 23.066 18.878 33.680 1.00 0.00 H ATOM 61309 H12S OL 1488 22.102 17.422 33.103 1.00 0.00 H ATOM 61310 C113 OL 1488 21.734 18.338 34.937 1.00 0.00 C ATOM 61311 H13R OL 1488 21.113 19.117 34.491 1.00 0.00 H ATOM 61312 H13S OL 1488 21.107 17.450 35.044 1.00 0.00 H ATOM 61313 C114 OL 1488 22.226 18.739 36.307 1.00 0.00 C ATOM 61314 H14R OL 1488 21.443 19.032 37.008 1.00 0.00 H ATOM 61315 H14S OL 1488 22.765 17.945 36.829 1.00 0.00 H ATOM 61316 C115 OL 1488 23.032 20.027 36.464 1.00 0.00 C ATOM 61317 H15R OL 1488 23.741 20.253 35.665 1.00 0.00 H ATOM 61318 H15S OL 1488 22.376 20.897 36.401 1.00 0.00 H ATOM 61319 C116 OL 1488 23.837 20.157 37.724 1.00 0.00 C ATOM 61320 H16R OL 1488 24.257 21.162 37.803 1.00 0.00 H ATOM 61321 H16S OL 1488 23.193 19.971 38.586 1.00 0.00 H ATOM 61322 C117 OL 1488 25.013 19.100 37.716 1.00 0.00 C ATOM 61323 H17R OL 1488 24.724 18.063 37.530 1.00 0.00 H ATOM 61324 H17S OL 1488 25.783 19.368 36.990 1.00 0.00 H ATOM 61325 C118 OL 1488 25.539 19.217 39.109 1.00 0.00 C ATOM 61326 H18R OL 1488 25.663 20.234 39.486 1.00 0.00 H ATOM 61327 H18S OL 1488 26.411 18.604 39.347 1.00 0.00 H ATOM 61328 H18T OL 1488 24.889 18.943 39.943 1.00 0.00 H TER 61329 OL 1488 ATOM 61329 C116 PA 1489 39.581 66.929 40.810 1.00 0.00 C ATOM 61330 H16R PA 1489 40.102 66.069 40.384 1.00 0.00 H ATOM 61331 H16S PA 1489 38.899 66.573 41.585 1.00 0.00 H ATOM 61332 H16T PA 1489 40.343 67.526 41.315 1.00 0.00 H ATOM 61333 C115 PA 1489 38.714 67.679 39.789 1.00 0.00 C ATOM 61334 H15R PA 1489 38.169 66.893 39.263 1.00 0.00 H ATOM 61335 H15S PA 1489 39.405 68.107 39.060 1.00 0.00 H ATOM 61336 C114 PA 1489 37.908 68.793 40.420 1.00 0.00 C ATOM 61337 H14R PA 1489 38.471 69.327 41.189 1.00 0.00 H ATOM 61338 H14S PA 1489 37.102 68.348 41.008 1.00 0.00 H ATOM 61339 C113 PA 1489 37.387 69.944 39.574 1.00 0.00 C ATOM 61340 H13R PA 1489 38.288 70.405 39.163 1.00 0.00 H ATOM 61341 H13S PA 1489 36.781 70.538 40.261 1.00 0.00 H ATOM 61342 C112 PA 1489 36.615 69.523 38.365 1.00 0.00 C ATOM 61343 H12R PA 1489 35.693 69.030 38.679 1.00 0.00 H ATOM 61344 H12S PA 1489 37.242 68.723 37.965 1.00 0.00 H ATOM 61345 C111 PA 1489 36.262 70.568 37.305 1.00 0.00 C ATOM 61346 H11R PA 1489 35.608 71.330 37.735 1.00 0.00 H ATOM 61347 H11S PA 1489 35.675 70.205 36.460 1.00 0.00 H ATOM 61348 C110 PA 1489 37.475 71.352 36.821 1.00 0.00 C ATOM 61349 H10R PA 1489 37.867 71.951 37.646 1.00 0.00 H ATOM 61350 H10S PA 1489 37.109 72.105 36.119 1.00 0.00 H ATOM 61351 C19 PA 1489 38.495 70.537 36.068 1.00 0.00 C ATOM 61352 H9R PA 1489 39.073 69.893 36.734 1.00 0.00 H ATOM 61353 H9S PA 1489 39.182 71.300 35.697 1.00 0.00 H ATOM 61354 C18 PA 1489 37.922 69.731 34.825 1.00 0.00 C ATOM 61355 H8R PA 1489 37.444 70.462 34.170 1.00 0.00 H ATOM 61356 H8S PA 1489 37.131 69.026 35.090 1.00 0.00 H ATOM 61357 C17 PA 1489 39.074 68.978 34.090 1.00 0.00 C ATOM 61358 H7R PA 1489 39.337 68.005 34.511 1.00 0.00 H ATOM 61359 H7S PA 1489 40.014 69.532 34.138 1.00 0.00 H ATOM 61360 C16 PA 1489 38.778 68.703 32.626 1.00 0.00 C ATOM 61361 H6R PA 1489 38.580 69.589 32.019 1.00 0.00 H ATOM 61362 H6S PA 1489 37.793 68.234 32.657 1.00 0.00 H ATOM 61363 C15 PA 1489 39.759 67.683 31.977 1.00 0.00 C ATOM 61364 H5R PA 1489 39.396 67.352 31.001 1.00 0.00 H ATOM 61365 H5S PA 1489 40.073 66.803 32.542 1.00 0.00 H ATOM 61366 C14 PA 1489 41.070 68.377 31.602 1.00 0.00 C ATOM 61367 H4R PA 1489 41.596 68.676 32.510 1.00 0.00 H ATOM 61368 H4S PA 1489 40.971 69.216 30.910 1.00 0.00 H ATOM 61369 C13 PA 1489 42.041 67.461 30.879 1.00 0.00 C ATOM 61370 H3R PA 1489 41.497 67.154 29.983 1.00 0.00 H ATOM 61371 H3S PA 1489 42.259 66.490 31.327 1.00 0.00 H ATOM 61372 C12 PA 1489 43.389 68.073 30.421 1.00 0.00 C ATOM 61373 H2R PA 1489 44.168 67.308 30.401 1.00 0.00 H ATOM 61374 H2S PA 1489 43.759 68.771 31.175 1.00 0.00 H ATOM 61375 C11 PGR 1490 43.288 68.849 29.120 1.00 0.00 C ATOM 61376 O12 PGR 1490 42.661 69.912 29.073 1.00 0.00 O ATOM 61377 O11 PGR 1490 43.886 68.274 28.002 1.00 0.00 O ATOM 61378 C1 PGR 1490 43.464 68.595 26.657 1.00 0.00 C ATOM 61379 HR PGR 1490 44.313 68.538 25.970 1.00 0.00 H ATOM 61380 HS PGR 1490 43.162 69.642 26.568 1.00 0.00 H ATOM 61381 C2 PGR 1490 42.320 67.638 26.109 1.00 0.00 C ATOM 61382 HX PGR 1490 42.603 66.602 26.312 1.00 0.00 H ATOM 61383 C3 PGR 1490 42.202 67.787 24.580 1.00 0.00 C ATOM 61384 HA PGR 1490 41.216 67.384 24.336 1.00 0.00 H ATOM 61385 HB PGR 1490 43.060 67.196 24.250 1.00 0.00 H ATOM 61386 O31 PGR 1490 42.334 69.126 24.211 1.00 0.00 O ATOM 61387 P31 PGR 1490 42.555 69.479 22.695 1.00 0.00 P ATOM 61388 O32 PGR 1490 42.365 71.064 22.582 1.00 0.00 O ATOM 61389 C31 PGR 1490 43.202 71.957 23.119 1.00 0.00 C ATOM 61390 H1A PGR 1490 44.236 71.740 22.842 1.00 0.00 H ATOM 61391 H1B PGR 1490 42.990 71.853 24.187 1.00 0.00 H ATOM 61392 C32 PGR 1490 42.973 73.363 22.712 1.00 0.00 C ATOM 61393 H2A PGR 1490 43.667 74.084 23.151 1.00 0.00 H ATOM 61394 O35 PGR 1490 41.658 73.823 23.189 1.00 0.00 O ATOM 61395 HO5A PGR 1490 41.759 73.823 24.158 1.00 0.00 H ATOM 61396 C33 PGR 1490 42.979 73.350 21.152 1.00 0.00 C ATOM 61397 H3A PGR 1490 43.940 72.970 20.795 1.00 0.00 H ATOM 61398 H3B PGR 1490 42.197 72.636 20.880 1.00 0.00 H ATOM 61399 O33 PGR 1490 43.983 69.103 22.337 1.00 0.00 O ATOM 61400 O34 PGR 1490 41.414 68.877 21.978 1.00 0.00 O ATOM 61401 O21 PGR 1490 41.051 67.964 26.712 1.00 0.00 O ATOM 61402 C21 PGR 1490 40.066 66.999 26.630 1.00 0.00 C ATOM 61403 O22 PGR 1490 40.181 65.911 26.039 1.00 0.00 O ATOM 61404 O36 PGR 1490 42.769 74.685 20.659 1.00 0.00 O ATOM 61405 HO6A PGR 1490 42.571 74.689 19.705 1.00 0.00 H ATOM 61406 C12 OL 1491 38.796 67.493 27.261 1.00 0.00 C ATOM 61407 H2R OL 1491 38.989 68.450 27.749 1.00 0.00 H ATOM 61408 H2S OL 1491 38.116 67.610 26.414 1.00 0.00 H ATOM 61409 C13 OL 1491 38.113 66.562 28.246 1.00 0.00 C ATOM 61410 H3R OL 1491 37.944 65.657 27.659 1.00 0.00 H ATOM 61411 H3S OL 1491 38.766 66.184 29.035 1.00 0.00 H ATOM 61412 C14 OL 1491 36.837 67.080 28.765 1.00 0.00 C ATOM 61413 H4R OL 1491 36.954 67.982 29.370 1.00 0.00 H ATOM 61414 H4S OL 1491 36.242 67.416 27.913 1.00 0.00 H ATOM 61415 C15 OL 1491 35.945 66.087 29.535 1.00 0.00 C ATOM 61416 H5R OL 1491 34.971 66.573 29.619 1.00 0.00 H ATOM 61417 H5S OL 1491 35.807 65.239 28.861 1.00 0.00 H ATOM 61418 C16 OL 1491 36.522 65.707 30.867 1.00 0.00 C ATOM 61419 H6R OL 1491 37.294 64.934 30.865 1.00 0.00 H ATOM 61420 H6S OL 1491 36.999 66.516 31.424 1.00 0.00 H ATOM 61421 C17 OL 1491 35.410 65.418 31.842 1.00 0.00 C ATOM 61422 H7R OL 1491 34.646 66.198 31.873 1.00 0.00 H ATOM 61423 H7S OL 1491 34.739 64.587 31.614 1.00 0.00 H ATOM 61424 C18 OL 1491 35.945 65.070 33.228 1.00 0.00 C ATOM 61425 H8R OL 1491 36.765 64.351 33.164 1.00 0.00 H ATOM 61426 H8S OL 1491 36.449 65.955 33.622 1.00 0.00 H ATOM 61427 C19 OL 1491 34.833 64.793 34.197 1.00 0.00 C ATOM 61428 H9R OL 1491 34.212 63.921 34.010 1.00 0.00 H ATOM 61429 C110 OL 1491 34.545 65.413 35.324 1.00 0.00 C ATOM 61430 H10R OL 1491 33.725 65.045 35.934 1.00 0.00 H ATOM 61431 C111 OL 1491 35.188 66.563 35.978 1.00 0.00 C ATOM 61432 H11R OL 1491 35.560 66.387 36.989 1.00 0.00 H ATOM 61433 H11S OL 1491 36.084 66.869 35.434 1.00 0.00 H ATOM 61434 C112 OL 1491 34.094 67.564 36.155 1.00 0.00 C ATOM 61435 H12R OL 1491 33.286 67.100 36.723 1.00 0.00 H ATOM 61436 H12S OL 1491 34.571 68.378 36.704 1.00 0.00 H ATOM 61437 C113 OL 1491 33.507 68.191 34.892 1.00 0.00 C ATOM 61438 H13R OL 1491 34.244 68.815 34.380 1.00 0.00 H ATOM 61439 H13S OL 1491 33.354 67.404 34.151 1.00 0.00 H ATOM 61440 C114 OL 1491 32.185 69.004 34.943 1.00 0.00 C ATOM 61441 H14R OL 1491 31.757 69.085 33.942 1.00 0.00 H ATOM 61442 H14S OL 1491 31.361 68.418 35.355 1.00 0.00 H ATOM 61443 C115 OL 1491 32.258 70.263 35.710 1.00 0.00 C ATOM 61444 H15R OL 1491 32.452 70.104 36.772 1.00 0.00 H ATOM 61445 H15S OL 1491 33.114 70.816 35.317 1.00 0.00 H ATOM 61446 C116 OL 1491 31.196 71.308 35.517 1.00 0.00 C ATOM 61447 H16R OL 1491 31.598 72.237 35.928 1.00 0.00 H ATOM 61448 H16S OL 1491 31.072 71.424 34.438 1.00 0.00 H ATOM 61449 C117 OL 1491 29.822 71.012 36.140 1.00 0.00 C ATOM 61450 H17R OL 1491 29.347 70.065 35.871 1.00 0.00 H ATOM 61451 H17S OL 1491 29.975 70.970 37.220 1.00 0.00 H ATOM 61452 C118 OL 1491 28.894 72.174 35.787 1.00 0.00 C ATOM 61453 H18R OL 1491 29.136 73.129 36.259 1.00 0.00 H ATOM 61454 H18S OL 1491 27.874 71.932 36.093 1.00 0.00 H ATOM 61455 H18T OL 1491 28.868 72.314 34.704 1.00 0.00 H TER 61456 OL 1491 ATOM 61456 C116 PA 1492 128.270 43.880 38.900 1.00 0.00 C ATOM 61457 H16R PA 1492 127.806 43.470 39.799 1.00 0.00 H ATOM 61458 H16S PA 1492 127.575 44.568 38.415 1.00 0.00 H ATOM 61459 H16T PA 1492 128.986 44.656 39.177 1.00 0.00 H ATOM 61460 C115 PA 1492 129.016 42.837 38.134 1.00 0.00 C ATOM 61461 H15R PA 1492 128.480 41.888 38.072 1.00 0.00 H ATOM 61462 H15S PA 1492 129.951 42.678 38.675 1.00 0.00 H ATOM 61463 C114 PA 1492 129.393 43.219 36.673 1.00 0.00 C ATOM 61464 H14R PA 1492 128.429 43.428 36.206 1.00 0.00 H ATOM 61465 H14S PA 1492 129.897 42.384 36.181 1.00 0.00 H ATOM 61466 C113 PA 1492 130.343 44.440 36.578 1.00 0.00 C ATOM 61467 H13R PA 1492 131.279 44.359 37.135 1.00 0.00 H ATOM 61468 H13S PA 1492 129.841 45.291 37.045 1.00 0.00 H ATOM 61469 C112 PA 1492 130.772 44.887 35.125 1.00 0.00 C ATOM 61470 H12R PA 1492 129.839 45.037 34.579 1.00 0.00 H ATOM 61471 H12S PA 1492 131.305 44.145 34.528 1.00 0.00 H ATOM 61472 C111 PA 1492 131.657 46.128 34.977 1.00 0.00 C ATOM 61473 H11R PA 1492 132.437 46.069 35.738 1.00 0.00 H ATOM 61474 H11S PA 1492 131.017 46.998 35.139 1.00 0.00 H ATOM 61475 C110 PA 1492 132.291 46.166 33.547 1.00 0.00 C ATOM 61476 H10R PA 1492 132.717 47.114 33.213 1.00 0.00 H ATOM 61477 H10S PA 1492 131.528 46.102 32.768 1.00 0.00 H ATOM 61478 C19 PA 1492 133.269 45.039 33.110 1.00 0.00 C ATOM 61479 H9R PA 1492 132.754 44.077 33.142 1.00 0.00 H ATOM 61480 H9S PA 1492 134.119 44.924 33.785 1.00 0.00 H ATOM 61481 C18 PA 1492 133.832 45.070 31.656 1.00 0.00 C ATOM 61482 H8R PA 1492 132.949 45.035 31.014 1.00 0.00 H ATOM 61483 H8S PA 1492 134.530 44.242 31.514 1.00 0.00 H ATOM 61484 C17 PA 1492 134.671 46.235 31.351 1.00 0.00 C ATOM 61485 H7R PA 1492 135.455 46.333 32.104 1.00 0.00 H ATOM 61486 H7S PA 1492 134.136 47.187 31.335 1.00 0.00 H ATOM 61487 C16 PA 1492 135.329 45.960 29.950 1.00 0.00 C ATOM 61488 H6R PA 1492 134.876 46.689 29.275 1.00 0.00 H ATOM 61489 H6S PA 1492 135.159 44.964 29.536 1.00 0.00 H ATOM 61490 C15 PA 1492 136.779 46.329 30.033 1.00 0.00 C ATOM 61491 H5R PA 1492 137.256 45.667 30.757 1.00 0.00 H ATOM 61492 H5S PA 1492 136.996 47.342 30.380 1.00 0.00 H ATOM 61493 C14 PA 1492 137.427 46.129 28.657 1.00 0.00 C ATOM 61494 H4R PA 1492 136.693 46.300 27.868 1.00 0.00 H ATOM 61495 H4S PA 1492 137.734 45.082 28.605 1.00 0.00 H ATOM 61496 C13 PA 1492 138.802 46.789 28.496 1.00 0.00 C ATOM 61497 H3R PA 1492 139.343 46.732 29.443 1.00 0.00 H ATOM 61498 H3S PA 1492 138.583 47.817 28.202 1.00 0.00 H ATOM 61499 C12 PA 1492 139.797 46.226 27.522 1.00 0.00 C ATOM 61500 H2R PA 1492 139.876 45.138 27.476 1.00 0.00 H ATOM 61501 H2S PA 1492 140.735 46.638 27.900 1.00 0.00 H ATOM 61502 C11 PC 1493 139.600 46.693 26.074 1.00 0.00 C ATOM 61503 O12 PC 1493 139.235 45.957 25.206 1.00 0.00 O ATOM 61504 O11 PC 1493 139.914 47.975 25.992 1.00 0.00 O ATOM 61505 C1 PC 1493 139.707 48.555 24.673 1.00 0.00 C ATOM 61506 HR PC 1493 138.678 48.415 24.332 1.00 0.00 H ATOM 61507 HS PC 1493 140.407 47.913 24.132 1.00 0.00 H ATOM 61508 C2 PC 1493 140.147 50.041 24.677 1.00 0.00 C ATOM 61509 HX PC 1493 139.389 50.442 25.355 1.00 0.00 H ATOM 61510 C3 PC 1493 140.113 50.613 23.258 1.00 0.00 C ATOM 61511 HA PC 1493 140.491 51.638 23.240 1.00 0.00 H ATOM 61512 HB PC 1493 139.133 50.661 22.775 1.00 0.00 H ATOM 61513 O31 PC 1493 141.084 49.824 22.500 1.00 0.00 O ATOM 61514 P31 PC 1493 141.416 50.245 21.053 1.00 0.00 P ATOM 61515 O32 PC 1493 139.928 50.121 20.464 1.00 0.00 O ATOM 61516 C31 PC 1493 139.292 48.846 20.457 1.00 0.00 C ATOM 61517 H1A PC 1493 139.008 48.547 21.470 1.00 0.00 H ATOM 61518 H1B PC 1493 139.890 48.013 20.078 1.00 0.00 H ATOM 61519 C32 PC 1493 137.875 48.932 19.808 1.00 0.00 C ATOM 61520 H2A PC 1493 137.294 49.716 20.297 1.00 0.00 H ATOM 61521 H2B PC 1493 137.369 47.997 20.054 1.00 0.00 H ATOM 61522 N31 PC 1493 137.821 49.037 18.362 1.00 0.00 N ATOM 61523 C33 PC 1493 138.272 50.398 17.926 1.00 0.00 C ATOM 61524 H3A PC 1493 137.776 51.067 18.631 1.00 0.00 H ATOM 61525 H3B PC 1493 137.916 50.600 16.915 1.00 0.00 H ATOM 61526 H3C PC 1493 139.363 50.422 17.921 1.00 0.00 H ATOM 61527 C34 PC 1493 138.574 47.909 17.762 1.00 0.00 C ATOM 61528 H4A PC 1493 138.369 47.851 16.692 1.00 0.00 H ATOM 61529 H4B PC 1493 138.153 47.023 18.239 1.00 0.00 H ATOM 61530 H4C PC 1493 139.634 47.941 18.019 1.00 0.00 H ATOM 61531 C35 PC 1493 136.429 48.855 17.960 1.00 0.00 C ATOM 61532 H5A PC 1493 136.148 47.909 18.424 1.00 0.00 H ATOM 61533 H5B PC 1493 136.399 48.762 16.874 1.00 0.00 H ATOM 61534 H5C PC 1493 135.767 49.649 18.310 1.00 0.00 H ATOM 61535 O33 PC 1493 141.839 51.620 21.044 1.00 0.00 O ATOM 61536 O34 PC 1493 142.300 49.290 20.396 1.00 0.00 O ATOM 61537 O21 PC 1493 141.412 50.216 25.348 1.00 0.00 O ATOM 61538 C21 PC 1493 141.632 51.445 25.935 1.00 0.00 C ATOM 61539 O22 PC 1493 140.897 52.423 26.021 1.00 0.00 O ATOM 61540 C12 OL 1494 142.964 51.543 26.586 1.00 0.00 C ATOM 61541 H2R OL 1494 143.668 50.866 26.097 1.00 0.00 H ATOM 61542 H2S OL 1494 143.337 52.511 26.245 1.00 0.00 H ATOM 61543 C13 OL 1494 142.820 51.460 28.140 1.00 0.00 C ATOM 61544 H3R OL 1494 143.776 51.794 28.550 1.00 0.00 H ATOM 61545 H3S OL 1494 141.962 52.051 28.468 1.00 0.00 H ATOM 61546 C14 OL 1494 142.521 50.035 28.627 1.00 0.00 C ATOM 61547 H4R OL 1494 141.838 49.657 27.863 1.00 0.00 H ATOM 61548 H4S OL 1494 143.415 49.412 28.552 1.00 0.00 H ATOM 61549 C15 OL 1494 141.818 49.955 29.939 1.00 0.00 C ATOM 61550 H5R OL 1494 142.035 49.037 30.490 1.00 0.00 H ATOM 61551 H5S OL 1494 142.325 50.650 30.611 1.00 0.00 H ATOM 61552 C16 OL 1494 140.272 50.179 29.926 1.00 0.00 C ATOM 61553 H6R OL 1494 140.186 51.149 29.433 1.00 0.00 H ATOM 61554 H6S OL 1494 139.785 49.446 29.280 1.00 0.00 H ATOM 61555 C17 OL 1494 139.655 50.156 31.288 1.00 0.00 C ATOM 61556 H7R OL 1494 139.702 49.187 31.791 1.00 0.00 H ATOM 61557 H7S OL 1494 140.233 50.746 32.002 1.00 0.00 H ATOM 61558 C18 OL 1494 138.301 50.824 31.401 1.00 0.00 C ATOM 61559 H8R OL 1494 138.106 51.050 32.451 1.00 0.00 H ATOM 61560 H8S OL 1494 138.446 51.708 30.777 1.00 0.00 H ATOM 61561 C19 OL 1494 137.072 50.050 30.891 1.00 0.00 C ATOM 61562 H9R OL 1494 137.260 49.500 29.972 1.00 0.00 H ATOM 61563 C110 OL 1494 136.019 49.718 31.620 1.00 0.00 C ATOM 61564 H10R OL 1494 135.245 49.072 31.213 1.00 0.00 H ATOM 61565 C111 OL 1494 135.564 50.283 32.958 1.00 0.00 C ATOM 61566 H11R OL 1494 136.287 50.966 33.408 1.00 0.00 H ATOM 61567 H11S OL 1494 134.786 51.023 32.757 1.00 0.00 H ATOM 61568 C112 OL 1494 135.149 49.284 34.043 1.00 0.00 C ATOM 61569 H12R OL 1494 134.856 48.396 33.480 1.00 0.00 H ATOM 61570 H12S OL 1494 136.019 48.962 34.620 1.00 0.00 H ATOM 61571 C113 OL 1494 134.129 49.863 35.162 1.00 0.00 C ATOM 61572 H13R OL 1494 133.440 50.553 34.671 1.00 0.00 H ATOM 61573 H13S OL 1494 133.432 49.081 35.470 1.00 0.00 H ATOM 61574 C114 OL 1494 134.765 50.467 36.418 1.00 0.00 C ATOM 61575 H14R OL 1494 134.855 49.753 37.240 1.00 0.00 H ATOM 61576 H14S OL 1494 135.722 50.986 36.326 1.00 0.00 H ATOM 61577 C115 OL 1494 133.918 51.561 37.085 1.00 0.00 C ATOM 61578 H15R OL 1494 133.755 52.348 36.346 1.00 0.00 H ATOM 61579 H15S OL 1494 132.896 51.210 37.239 1.00 0.00 H ATOM 61580 C116 OL 1494 134.461 51.923 38.404 1.00 0.00 C ATOM 61581 H16R OL 1494 134.642 51.068 39.058 1.00 0.00 H ATOM 61582 H16S OL 1494 135.457 52.339 38.236 1.00 0.00 H ATOM 61583 C117 OL 1494 133.637 52.949 39.271 1.00 0.00 C ATOM 61584 H17R OL 1494 132.609 52.584 39.330 1.00 0.00 H ATOM 61585 H17S OL 1494 134.120 53.072 40.243 1.00 0.00 H ATOM 61586 C118 OL 1494 133.562 54.323 38.543 1.00 0.00 C ATOM 61587 H18R OL 1494 132.920 54.241 37.664 1.00 0.00 H ATOM 61588 H18S OL 1494 134.513 54.823 38.348 1.00 0.00 H ATOM 61589 H18T OL 1494 132.967 54.951 39.210 1.00 0.00 H TER 61590 OL 1494 ATOM 61590 C116 PA 1495 49.405 52.357 39.376 1.00 0.00 C ATOM 61591 H16R PA 1495 48.802 51.466 39.561 1.00 0.00 H ATOM 61592 H16S PA 1495 48.911 52.935 38.592 1.00 0.00 H ATOM 61593 H16T PA 1495 49.287 52.939 40.293 1.00 0.00 H ATOM 61594 C115 PA 1495 50.871 51.999 39.350 1.00 0.00 C ATOM 61595 H15R PA 1495 51.041 51.331 38.503 1.00 0.00 H ATOM 61596 H15S PA 1495 51.249 51.464 40.224 1.00 0.00 H ATOM 61597 C114 PA 1495 51.895 53.168 39.222 1.00 0.00 C ATOM 61598 H14R PA 1495 51.482 54.066 39.686 1.00 0.00 H ATOM 61599 H14S PA 1495 51.956 53.385 38.154 1.00 0.00 H ATOM 61600 C113 PA 1495 53.335 52.962 39.742 1.00 0.00 C ATOM 61601 H13R PA 1495 53.675 52.119 39.138 1.00 0.00 H ATOM 61602 H13S PA 1495 53.405 52.617 40.776 1.00 0.00 H ATOM 61603 C112 PA 1495 54.259 54.038 39.530 1.00 0.00 C ATOM 61604 H12R PA 1495 55.299 53.753 39.703 1.00 0.00 H ATOM 61605 H12S PA 1495 53.886 54.782 40.237 1.00 0.00 H ATOM 61606 C111 PA 1495 54.363 54.673 38.130 1.00 0.00 C ATOM 61607 H11R PA 1495 53.390 54.744 37.640 1.00 0.00 H ATOM 61608 H11S PA 1495 54.877 53.939 37.507 1.00 0.00 H ATOM 61609 C110 PA 1495 55.197 55.911 38.081 1.00 0.00 C ATOM 61610 H10R PA 1495 55.889 56.101 38.905 1.00 0.00 H ATOM 61611 H10S PA 1495 54.526 56.772 38.104 1.00 0.00 H ATOM 61612 C19 PA 1495 55.827 56.108 36.662 1.00 0.00 C ATOM 61613 H9R PA 1495 55.109 56.127 35.840 1.00 0.00 H ATOM 61614 H9S PA 1495 56.221 55.128 36.386 1.00 0.00 H ATOM 61615 C18 PA 1495 56.693 57.289 36.512 1.00 0.00 C ATOM 61616 H8R PA 1495 57.527 57.312 37.217 1.00 0.00 H ATOM 61617 H8S PA 1495 56.124 58.186 36.765 1.00 0.00 H ATOM 61618 C17 PA 1495 57.187 57.397 35.042 1.00 0.00 C ATOM 61619 H7R PA 1495 56.321 57.552 34.394 1.00 0.00 H ATOM 61620 H7S PA 1495 57.541 56.433 34.672 1.00 0.00 H ATOM 61621 C16 PA 1495 58.439 58.158 34.685 1.00 0.00 C ATOM 61622 H6R PA 1495 58.639 58.138 33.612 1.00 0.00 H ATOM 61623 H6S PA 1495 59.242 57.544 35.099 1.00 0.00 H ATOM 61624 C15 PA 1495 58.746 59.559 35.344 1.00 0.00 C ATOM 61625 H5R PA 1495 58.322 59.443 36.344 1.00 0.00 H ATOM 61626 H5S PA 1495 58.073 60.338 34.980 1.00 0.00 H ATOM 61627 C14 PA 1495 60.275 59.968 35.390 1.00 0.00 C ATOM 61628 H4R PA 1495 61.025 59.398 35.942 1.00 0.00 H ATOM 61629 H4S PA 1495 60.392 60.951 35.851 1.00 0.00 H ATOM 61630 C13 PA 1495 60.925 60.230 34.031 1.00 0.00 C ATOM 61631 H3R PA 1495 60.140 60.807 33.538 1.00 0.00 H ATOM 61632 H3S PA 1495 61.146 59.255 33.590 1.00 0.00 H ATOM 61633 C12 PA 1495 62.127 61.171 34.025 1.00 0.00 C ATOM 61634 H2R PA 1495 62.930 60.610 34.508 1.00 0.00 H ATOM 61635 H2S PA 1495 62.144 62.159 34.490 1.00 0.00 H ATOM 61636 C11 PGR 1496 62.599 61.507 32.635 1.00 0.00 C ATOM 61637 O12 PGR 1496 62.569 60.659 31.762 1.00 0.00 O ATOM 61638 O11 PGR 1496 63.177 62.706 32.543 1.00 0.00 O ATOM 61639 C1 PGR 1496 63.467 63.181 31.211 1.00 0.00 C ATOM 61640 HR PGR 1496 64.078 62.417 30.724 1.00 0.00 H ATOM 61641 HS PGR 1496 64.047 64.105 31.273 1.00 0.00 H ATOM 61642 C2 PGR 1496 62.074 63.455 30.628 1.00 0.00 C ATOM 61643 HX PGR 1496 61.615 62.464 30.581 1.00 0.00 H ATOM 61644 C3 PGR 1496 62.246 64.069 29.189 1.00 0.00 C ATOM 61645 HA PGR 1496 62.931 63.502 28.554 1.00 0.00 H ATOM 61646 HB PGR 1496 62.542 65.121 29.173 1.00 0.00 H ATOM 61647 O31 PGR 1496 60.885 63.986 28.610 1.00 0.00 O ATOM 61648 P31 PGR 1496 60.166 65.181 27.831 1.00 0.00 P ATOM 61649 O32 PGR 1496 60.211 66.362 28.925 1.00 0.00 O ATOM 61650 C31 PGR 1496 61.159 67.420 28.936 1.00 0.00 C ATOM 61651 H1A PGR 1496 61.560 67.725 27.966 1.00 0.00 H ATOM 61652 H1B PGR 1496 61.931 67.022 29.599 1.00 0.00 H ATOM 61653 C32 PGR 1496 60.502 68.593 29.619 1.00 0.00 C ATOM 61654 H2A PGR 1496 60.319 68.253 30.641 1.00 0.00 H ATOM 61655 O35 PGR 1496 59.288 69.015 28.917 1.00 0.00 O ATOM 61656 HO5A PGR 1496 58.866 68.214 28.558 1.00 0.00 H ATOM 61657 C33 PGR 1496 61.348 69.906 29.704 1.00 0.00 C ATOM 61658 H3A PGR 1496 60.802 70.615 30.333 1.00 0.00 H ATOM 61659 H3B PGR 1496 62.216 69.632 30.310 1.00 0.00 H ATOM 61660 O33 PGR 1496 61.004 65.543 26.659 1.00 0.00 O ATOM 61661 O34 PGR 1496 58.784 64.826 27.624 1.00 0.00 O ATOM 61662 O21 PGR 1496 61.409 64.378 31.443 1.00 0.00 O ATOM 61663 C21 PGR 1496 60.067 64.368 31.453 1.00 0.00 C ATOM 61664 O22 PGR 1496 59.436 63.374 31.171 1.00 0.00 O ATOM 61665 O36 PGR 1496 61.635 70.401 28.426 1.00 0.00 O ATOM 61666 HO6A PGR 1496 62.472 69.973 28.174 1.00 0.00 H ATOM 61667 C12 OL 1497 59.440 65.596 32.074 1.00 0.00 C ATOM 61668 H2R OL 1497 59.708 66.526 31.568 1.00 0.00 H ATOM 61669 H2S OL 1497 58.363 65.565 31.899 1.00 0.00 H ATOM 61670 C13 OL 1497 59.860 65.713 33.530 1.00 0.00 C ATOM 61671 H3R OL 1497 60.949 65.780 33.543 1.00 0.00 H ATOM 61672 H3S OL 1497 59.520 66.648 33.980 1.00 0.00 H ATOM 61673 C14 OL 1497 59.328 64.496 34.355 1.00 0.00 C ATOM 61674 H4R OL 1497 58.248 64.417 34.217 1.00 0.00 H ATOM 61675 H4S OL 1497 59.786 63.589 33.955 1.00 0.00 H ATOM 61676 C15 OL 1497 59.722 64.659 35.885 1.00 0.00 C ATOM 61677 H5R OL 1497 59.011 65.185 36.526 1.00 0.00 H ATOM 61678 H5S OL 1497 59.566 63.642 36.252 1.00 0.00 H ATOM 61679 C16 OL 1497 61.219 64.902 36.083 1.00 0.00 C ATOM 61680 H6R OL 1497 61.647 64.154 35.413 1.00 0.00 H ATOM 61681 H6S OL 1497 61.491 65.915 35.777 1.00 0.00 H ATOM 61682 C17 OL 1497 61.627 64.787 37.541 1.00 0.00 C ATOM 61683 H7R OL 1497 61.183 65.614 38.098 1.00 0.00 H ATOM 61684 H7S OL 1497 61.312 63.869 38.042 1.00 0.00 H ATOM 61685 C18 OL 1497 63.163 64.903 37.608 1.00 0.00 C ATOM 61686 H8R OL 1497 63.514 65.815 37.120 1.00 0.00 H ATOM 61687 H8S OL 1497 63.607 64.972 38.603 1.00 0.00 H ATOM 61688 C19 OL 1497 63.706 63.683 36.867 1.00 0.00 C ATOM 61689 H9R OL 1497 63.675 63.816 35.789 1.00 0.00 H ATOM 61690 C110 OL 1497 64.286 62.580 37.357 1.00 0.00 C ATOM 61691 H10R OL 1497 64.727 61.871 36.660 1.00 0.00 H ATOM 61692 C111 OL 1497 64.337 62.118 38.782 1.00 0.00 C ATOM 61693 H11R OL 1497 63.414 62.413 39.286 1.00 0.00 H ATOM 61694 H11S OL 1497 64.326 61.037 38.935 1.00 0.00 H ATOM 61695 C112 OL 1497 65.542 62.668 39.429 1.00 0.00 C ATOM 61696 H12R OL 1497 65.666 63.706 39.116 1.00 0.00 H ATOM 61697 H12S OL 1497 65.359 62.751 40.502 1.00 0.00 H ATOM 61698 C113 OL 1497 66.790 61.856 39.080 1.00 0.00 C ATOM 61699 H13R OL 1497 66.663 60.886 39.565 1.00 0.00 H ATOM 61700 H13S OL 1497 66.807 61.603 38.018 1.00 0.00 H ATOM 61701 C114 OL 1497 68.159 62.406 39.568 1.00 0.00 C ATOM 61702 H14R OL 1497 68.368 63.214 38.864 1.00 0.00 H ATOM 61703 H14S OL 1497 68.033 62.721 40.606 1.00 0.00 H ATOM 61704 C115 OL 1497 69.279 61.379 39.576 1.00 0.00 C ATOM 61705 H15R OL 1497 69.086 60.547 40.256 1.00 0.00 H ATOM 61706 H15S OL 1497 69.432 60.959 38.580 1.00 0.00 H ATOM 61707 C116 OL 1497 70.632 61.894 39.824 1.00 0.00 C ATOM 61708 H16R OL 1497 70.954 62.846 39.396 1.00 0.00 H ATOM 61709 H16S OL 1497 70.746 62.099 40.891 1.00 0.00 H ATOM 61710 C117 OL 1497 71.740 60.777 39.729 1.00 0.00 C ATOM 61711 H17R OL 1497 71.438 59.912 40.323 1.00 0.00 H ATOM 61712 H17S OL 1497 71.805 60.294 38.752 1.00 0.00 H ATOM 61713 C118 OL 1497 73.117 61.190 40.057 1.00 0.00 C ATOM 61714 H18R OL 1497 73.930 60.546 39.715 1.00 0.00 H ATOM 61715 H18S OL 1497 73.193 61.371 41.131 1.00 0.00 H ATOM 61716 H18T OL 1497 73.326 62.118 39.522 1.00 0.00 H TER 61717 OL 1497 ATOM 61717 C116 PA 1498 45.849 139.744 39.653 1.00 0.00 C ATOM 61718 H16R PA 1498 46.397 140.688 39.672 1.00 0.00 H ATOM 61719 H16S PA 1498 46.468 138.936 40.052 1.00 0.00 H ATOM 61720 H16T PA 1498 45.054 139.888 40.388 1.00 0.00 H ATOM 61721 C115 PA 1498 45.378 139.492 38.266 1.00 0.00 C ATOM 61722 H15R PA 1498 44.885 138.519 38.198 1.00 0.00 H ATOM 61723 H15S PA 1498 46.212 139.530 37.562 1.00 0.00 H ATOM 61724 C114 PA 1498 44.417 140.591 37.738 1.00 0.00 C ATOM 61725 H14R PA 1498 45.021 141.501 37.737 1.00 0.00 H ATOM 61726 H14S PA 1498 43.628 140.665 38.489 1.00 0.00 H ATOM 61727 C113 PA 1498 43.751 140.203 36.385 1.00 0.00 C ATOM 61728 H13R PA 1498 43.335 141.149 36.032 1.00 0.00 H ATOM 61729 H13S PA 1498 42.907 139.518 36.495 1.00 0.00 H ATOM 61730 C112 PA 1498 44.618 139.698 35.260 1.00 0.00 C ATOM 61731 H12R PA 1498 43.954 139.618 34.397 1.00 0.00 H ATOM 61732 H12S PA 1498 44.995 138.681 35.385 1.00 0.00 H ATOM 61733 C111 PA 1498 45.722 140.570 34.784 1.00 0.00 C ATOM 61734 H11R PA 1498 46.365 140.036 34.082 1.00 0.00 H ATOM 61735 H11S PA 1498 46.434 140.845 35.566 1.00 0.00 H ATOM 61736 C110 PA 1498 45.215 141.765 34.011 1.00 0.00 C ATOM 61737 H10R PA 1498 44.273 142.172 34.385 1.00 0.00 H ATOM 61738 H10S PA 1498 44.867 141.396 33.044 1.00 0.00 H ATOM 61739 C19 PA 1498 46.167 142.893 33.782 1.00 0.00 C ATOM 61740 H9R PA 1498 47.142 142.492 33.498 1.00 0.00 H ATOM 61741 H9S PA 1498 46.355 143.450 34.703 1.00 0.00 H ATOM 61742 C18 PA 1498 45.557 144.026 32.875 1.00 0.00 C ATOM 61743 H8R PA 1498 46.082 144.960 33.087 1.00 0.00 H ATOM 61744 H8S PA 1498 44.523 144.170 33.196 1.00 0.00 H ATOM 61745 C17 PA 1498 45.558 143.778 31.309 1.00 0.00 C ATOM 61746 H7R PA 1498 45.140 144.609 30.737 1.00 0.00 H ATOM 61747 H7S PA 1498 44.890 142.957 31.040 1.00 0.00 H ATOM 61748 C16 PA 1498 46.940 143.435 30.744 1.00 0.00 C ATOM 61749 H6R PA 1498 47.147 142.502 31.272 1.00 0.00 H ATOM 61750 H6S PA 1498 47.686 144.195 30.985 1.00 0.00 H ATOM 61751 C15 PA 1498 46.858 143.164 29.259 1.00 0.00 C ATOM 61752 H5R PA 1498 46.466 143.930 28.587 1.00 0.00 H ATOM 61753 H5S PA 1498 46.321 142.221 29.134 1.00 0.00 H ATOM 61754 C14 PA 1498 48.165 142.749 28.606 1.00 0.00 C ATOM 61755 H4R PA 1498 48.688 142.061 29.274 1.00 0.00 H ATOM 61756 H4S PA 1498 48.779 143.649 28.536 1.00 0.00 H ATOM 61757 C13 PA 1498 47.919 142.216 27.187 1.00 0.00 C ATOM 61758 H3R PA 1498 47.283 142.992 26.756 1.00 0.00 H ATOM 61759 H3S PA 1498 47.332 141.297 27.246 1.00 0.00 H ATOM 61760 C12 PA 1498 49.119 141.958 26.312 1.00 0.00 C ATOM 61761 H2R PA 1498 49.231 140.879 26.432 1.00 0.00 H ATOM 61762 H2S PA 1498 50.099 142.328 26.620 1.00 0.00 H ATOM 61763 C11 PGR 1499 48.888 142.301 24.835 1.00 0.00 C ATOM 61764 O12 PGR 1499 48.147 143.256 24.459 1.00 0.00 O ATOM 61765 O11 PGR 1499 49.568 141.460 24.006 1.00 0.00 O ATOM 61766 C1 PGR 1499 49.799 141.881 22.605 1.00 0.00 C ATOM 61767 HR PGR 1499 48.902 142.388 22.241 1.00 0.00 H ATOM 61768 HS PGR 1499 50.011 140.991 22.007 1.00 0.00 H ATOM 61769 C2 PGR 1499 51.048 142.681 22.340 1.00 0.00 C ATOM 61770 HX PGR 1499 50.892 142.889 21.279 1.00 0.00 H ATOM 61771 C3 PGR 1499 52.390 141.969 22.601 1.00 0.00 C ATOM 61772 HA PGR 1499 52.480 140.925 22.290 1.00 0.00 H ATOM 61773 HB PGR 1499 52.549 141.951 23.683 1.00 0.00 H ATOM 61774 O31 PGR 1499 53.521 142.496 21.910 1.00 0.00 O ATOM 61775 P31 PGR 1499 53.759 142.125 20.342 1.00 0.00 P ATOM 61776 O32 PGR 1499 54.169 140.592 20.464 1.00 0.00 O ATOM 61777 C31 PGR 1499 55.542 140.154 20.686 1.00 0.00 C ATOM 61778 H1A PGR 1499 55.995 140.653 21.547 1.00 0.00 H ATOM 61779 H1B PGR 1499 56.133 140.387 19.797 1.00 0.00 H ATOM 61780 C32 PGR 1499 55.592 138.662 20.803 1.00 0.00 C ATOM 61781 H2A PGR 1499 56.571 138.320 21.147 1.00 0.00 H ATOM 61782 O35 PGR 1499 55.293 138.001 19.520 1.00 0.00 O ATOM 61783 HO5A PGR 1499 55.445 137.041 19.584 1.00 0.00 H ATOM 61784 C33 PGR 1499 54.563 138.086 21.860 1.00 0.00 C ATOM 61785 H3A PGR 1499 54.687 138.564 22.835 1.00 0.00 H ATOM 61786 H3B PGR 1499 53.492 138.117 21.645 1.00 0.00 H ATOM 61787 O33 PGR 1499 52.428 142.048 19.703 1.00 0.00 O ATOM 61788 O34 PGR 1499 54.840 142.954 19.722 1.00 0.00 O ATOM 61789 O21 PGR 1499 51.053 143.960 23.083 1.00 0.00 O ATOM 61790 C21 PGR 1499 51.459 145.175 22.618 1.00 0.00 C ATOM 61791 O22 PGR 1499 51.879 145.476 21.519 1.00 0.00 O ATOM 61792 O36 PGR 1499 54.886 136.705 22.059 1.00 0.00 O ATOM 61793 HO6A PGR 1499 54.151 136.179 21.698 1.00 0.00 H ATOM 61794 C12 OL 1500 51.521 146.229 23.755 1.00 0.00 C ATOM 61795 H2R OL 1500 52.226 147.030 23.523 1.00 0.00 H ATOM 61796 H2S OL 1500 50.618 146.836 23.850 1.00 0.00 H ATOM 61797 C13 OL 1500 51.839 145.680 25.139 1.00 0.00 C ATOM 61798 H3R OL 1500 51.851 146.457 25.906 1.00 0.00 H ATOM 61799 H3S OL 1500 51.107 144.946 25.481 1.00 0.00 H ATOM 61800 C14 OL 1500 53.186 144.978 25.263 1.00 0.00 C ATOM 61801 H4R OL 1500 53.462 144.386 24.389 1.00 0.00 H ATOM 61802 H4S OL 1500 53.871 145.807 25.452 1.00 0.00 H ATOM 61803 C15 OL 1500 53.237 144.024 26.471 1.00 0.00 C ATOM 61804 H5R OL 1500 52.739 144.350 27.387 1.00 0.00 H ATOM 61805 H5S OL 1500 52.660 143.150 26.162 1.00 0.00 H ATOM 61806 C16 OL 1500 54.680 143.640 26.723 1.00 0.00 C ATOM 61807 H6R OL 1500 54.612 142.752 27.355 1.00 0.00 H ATOM 61808 H6S OL 1500 55.110 143.261 25.793 1.00 0.00 H ATOM 61809 C17 OL 1500 55.454 144.762 27.402 1.00 0.00 C ATOM 61810 H7R OL 1500 55.540 145.650 26.771 1.00 0.00 H ATOM 61811 H7S OL 1500 54.944 145.114 28.301 1.00 0.00 H ATOM 61812 C18 OL 1500 56.864 144.355 27.702 1.00 0.00 C ATOM 61813 H8R OL 1500 57.388 144.155 26.765 1.00 0.00 H ATOM 61814 H8S OL 1500 57.316 145.282 28.061 1.00 0.00 H ATOM 61815 C19 OL 1500 57.045 143.240 28.799 1.00 0.00 C ATOM 61816 H9R OL 1500 56.439 142.339 28.741 1.00 0.00 H ATOM 61817 C110 OL 1500 57.841 143.224 29.913 1.00 0.00 C ATOM 61818 H10R OL 1500 57.711 142.413 30.626 1.00 0.00 H ATOM 61819 C111 OL 1500 58.750 144.315 30.349 1.00 0.00 C ATOM 61820 H11R OL 1500 59.828 144.158 30.277 1.00 0.00 H ATOM 61821 H11S OL 1500 58.675 145.115 29.610 1.00 0.00 H ATOM 61822 C112 OL 1500 58.305 144.823 31.692 1.00 0.00 C ATOM 61823 H12R OL 1500 58.579 144.121 32.482 1.00 0.00 H ATOM 61824 H12S OL 1500 58.835 145.727 31.999 1.00 0.00 H ATOM 61825 C113 OL 1500 56.801 145.161 31.869 1.00 0.00 C ATOM 61826 H13R OL 1500 56.502 145.959 31.187 1.00 0.00 H ATOM 61827 H13S OL 1500 56.151 144.310 31.652 1.00 0.00 H ATOM 61828 C114 OL 1500 56.489 145.693 33.280 1.00 0.00 C ATOM 61829 H14R OL 1500 56.859 144.947 33.987 1.00 0.00 H ATOM 61830 H14S OL 1500 56.893 146.706 33.343 1.00 0.00 H ATOM 61831 C115 OL 1500 55.036 145.994 33.708 1.00 0.00 C ATOM 61832 H15R OL 1500 54.650 146.562 32.859 1.00 0.00 H ATOM 61833 H15S OL 1500 54.469 145.063 33.654 1.00 0.00 H ATOM 61834 C116 OL 1500 54.945 146.562 35.086 1.00 0.00 C ATOM 61835 H16R OL 1500 55.115 145.839 35.887 1.00 0.00 H ATOM 61836 H16S OL 1500 55.791 147.232 35.253 1.00 0.00 H ATOM 61837 C117 OL 1500 53.662 147.351 35.329 1.00 0.00 C ATOM 61838 H17R OL 1500 52.865 146.713 34.941 1.00 0.00 H ATOM 61839 H17S OL 1500 53.506 147.537 36.394 1.00 0.00 H ATOM 61840 C118 OL 1500 53.579 148.555 34.456 1.00 0.00 C ATOM 61841 H18R OL 1500 52.740 149.092 34.902 1.00 0.00 H ATOM 61842 H18S OL 1500 53.373 148.435 33.390 1.00 0.00 H ATOM 61843 H18T OL 1500 54.489 149.147 34.579 1.00 0.00 H TER 61844 OL 1500 ATOM 61844 C116 PA 1501 96.408 41.039 41.424 1.00 0.00 C ATOM 61845 H16R PA 1501 95.648 40.366 41.020 1.00 0.00 H ATOM 61846 H16S PA 1501 96.130 42.095 41.403 1.00 0.00 H ATOM 61847 H16T PA 1501 96.686 40.879 42.468 1.00 0.00 H ATOM 61848 C115 PA 1501 97.670 40.893 40.624 1.00 0.00 C ATOM 61849 H15R PA 1501 98.278 40.092 41.050 1.00 0.00 H ATOM 61850 H15S PA 1501 98.332 41.736 40.830 1.00 0.00 H ATOM 61851 C114 PA 1501 97.476 40.926 39.137 1.00 0.00 C ATOM 61852 H14R PA 1501 97.025 41.885 38.876 1.00 0.00 H ATOM 61853 H14S PA 1501 96.739 40.157 38.898 1.00 0.00 H ATOM 61854 C113 PA 1501 98.667 40.588 38.364 1.00 0.00 C ATOM 61855 H13R PA 1501 99.096 39.643 38.704 1.00 0.00 H ATOM 61856 H13S PA 1501 99.483 41.313 38.353 1.00 0.00 H ATOM 61857 C112 PA 1501 98.521 40.652 36.817 1.00 0.00 C ATOM 61858 H12R PA 1501 98.051 41.625 36.658 1.00 0.00 H ATOM 61859 H12S PA 1501 97.689 40.026 36.488 1.00 0.00 H ATOM 61860 C111 PA 1501 99.875 40.386 36.201 1.00 0.00 C ATOM 61861 H11R PA 1501 100.212 39.408 36.549 1.00 0.00 H ATOM 61862 H11S PA 1501 100.668 40.997 36.638 1.00 0.00 H ATOM 61863 C110 PA 1501 100.015 40.324 34.748 1.00 0.00 C ATOM 61864 H10R PA 1501 99.317 39.593 34.335 1.00 0.00 H ATOM 61865 H10S PA 1501 101.009 40.051 34.389 1.00 0.00 H ATOM 61866 C19 PA 1501 99.628 41.574 33.953 1.00 0.00 C ATOM 61867 H9R PA 1501 100.582 42.087 34.087 1.00 0.00 H ATOM 61868 H9S PA 1501 98.806 42.206 34.297 1.00 0.00 H ATOM 61869 C18 PA 1501 99.408 41.471 32.398 1.00 0.00 C ATOM 61870 H8R PA 1501 98.498 40.916 32.159 1.00 0.00 H ATOM 61871 H8S PA 1501 100.235 40.979 31.882 1.00 0.00 H ATOM 61872 C17 PA 1501 99.172 42.804 31.731 1.00 0.00 C ATOM 61873 H7R PA 1501 98.664 43.473 32.428 1.00 0.00 H ATOM 61874 H7S PA 1501 98.654 42.679 30.778 1.00 0.00 H ATOM 61875 C16 PA 1501 100.536 43.363 31.494 1.00 0.00 C ATOM 61876 H6R PA 1501 101.237 42.692 30.994 1.00 0.00 H ATOM 61877 H6S PA 1501 101.077 43.841 32.313 1.00 0.00 H ATOM 61878 C15 PA 1501 100.490 44.542 30.463 1.00 0.00 C ATOM 61879 H5R PA 1501 100.118 45.435 30.971 1.00 0.00 H ATOM 61880 H5S PA 1501 99.722 44.375 29.705 1.00 0.00 H ATOM 61881 C14 PA 1501 101.827 44.752 29.762 1.00 0.00 C ATOM 61882 H4R PA 1501 101.848 45.448 28.920 1.00 0.00 H ATOM 61883 H4S PA 1501 101.995 43.923 29.071 1.00 0.00 H ATOM 61884 C13 PA 1501 103.018 44.794 30.658 1.00 0.00 C ATOM 61885 H3R PA 1501 103.167 43.825 31.139 1.00 0.00 H ATOM 61886 H3S PA 1501 102.725 45.453 31.479 1.00 0.00 H ATOM 61887 C12 PA 1501 104.434 45.341 30.246 1.00 0.00 C ATOM 61888 H2R PA 1501 104.969 44.773 29.482 1.00 0.00 H ATOM 61889 H2S PA 1501 105.094 45.364 31.116 1.00 0.00 H ATOM 61890 C11 PGR 1502 104.253 46.804 29.808 1.00 0.00 C ATOM 61891 O12 PGR 1502 103.181 47.304 29.499 1.00 0.00 O ATOM 61892 O11 PGR 1502 105.442 47.402 29.724 1.00 0.00 O ATOM 61893 C1 PGR 1502 105.664 48.727 29.171 1.00 0.00 C ATOM 61894 HR PGR 1502 106.362 49.288 29.798 1.00 0.00 H ATOM 61895 HS PGR 1502 104.699 49.231 29.268 1.00 0.00 H ATOM 61896 C2 PGR 1502 106.282 48.740 27.784 1.00 0.00 C ATOM 61897 HX PGR 1502 106.346 49.758 27.393 1.00 0.00 H ATOM 61898 C3 PGR 1502 105.502 47.867 26.807 1.00 0.00 C ATOM 61899 HA PGR 1502 104.482 48.257 26.831 1.00 0.00 H ATOM 61900 HB PGR 1502 105.375 46.823 27.106 1.00 0.00 H ATOM 61901 O31 PGR 1502 105.894 47.970 25.444 1.00 0.00 O ATOM 61902 P31 PGR 1502 105.864 46.727 24.422 1.00 0.00 P ATOM 61903 O32 PGR 1502 107.353 46.286 24.324 1.00 0.00 O ATOM 61904 C31 PGR 1502 107.874 45.455 25.334 1.00 0.00 C ATOM 61905 H1A PGR 1502 107.340 44.505 25.409 1.00 0.00 H ATOM 61906 H1B PGR 1502 107.689 45.996 26.265 1.00 0.00 H ATOM 61907 C32 PGR 1502 109.389 45.206 25.174 1.00 0.00 C ATOM 61908 H2A PGR 1502 109.978 46.126 25.140 1.00 0.00 H ATOM 61909 O35 PGR 1502 109.603 44.255 24.082 1.00 0.00 O ATOM 61910 HO5A PGR 1502 110.520 43.936 23.996 1.00 0.00 H ATOM 61911 C33 PGR 1502 109.832 44.321 26.360 1.00 0.00 C ATOM 61912 H3A PGR 1502 109.565 44.786 27.313 1.00 0.00 H ATOM 61913 H3B PGR 1502 109.331 43.350 26.386 1.00 0.00 H ATOM 61914 O33 PGR 1502 105.115 45.645 25.145 1.00 0.00 O ATOM 61915 O34 PGR 1502 105.418 47.343 23.076 1.00 0.00 O ATOM 61916 O21 PGR 1502 107.654 48.239 27.834 1.00 0.00 O ATOM 61917 C21 PGR 1502 108.722 48.835 28.357 1.00 0.00 C ATOM 61918 O22 PGR 1502 108.699 50.015 28.704 1.00 0.00 O ATOM 61919 O36 PGR 1502 111.315 44.174 26.391 1.00 0.00 O ATOM 61920 HO6A PGR 1502 111.588 43.478 25.767 1.00 0.00 H ATOM 61921 C12 OL 1503 109.961 47.998 28.487 1.00 0.00 C ATOM 61922 H2R OL 1503 109.769 47.106 27.887 1.00 0.00 H ATOM 61923 H2S OL 1503 110.860 48.513 28.141 1.00 0.00 H ATOM 61924 C13 OL 1503 110.387 47.647 29.907 1.00 0.00 C ATOM 61925 H3R OL 1503 111.402 47.259 29.802 1.00 0.00 H ATOM 61926 H3S OL 1503 110.526 48.544 30.513 1.00 0.00 H ATOM 61927 C14 OL 1503 109.391 46.670 30.603 1.00 0.00 C ATOM 61928 H4R OL 1503 108.334 46.840 30.389 1.00 0.00 H ATOM 61929 H4S OL 1503 109.453 45.698 30.110 1.00 0.00 H ATOM 61930 C15 OL 1503 109.530 46.588 32.136 1.00 0.00 C ATOM 61931 H5R OL 1503 110.600 46.653 32.341 1.00 0.00 H ATOM 61932 H5S OL 1503 108.932 47.460 32.410 1.00 0.00 H ATOM 61933 C16 OL 1503 108.872 45.419 32.942 1.00 0.00 C ATOM 61934 H6R OL 1503 107.783 45.507 32.936 1.00 0.00 H ATOM 61935 H6S OL 1503 109.141 44.516 32.391 1.00 0.00 H ATOM 61936 C17 OL 1503 109.319 45.308 34.417 1.00 0.00 C ATOM 61937 H7R OL 1503 110.393 45.157 34.542 1.00 0.00 H ATOM 61938 H7S OL 1503 109.384 46.318 34.827 1.00 0.00 H ATOM 61939 C18 OL 1503 108.505 44.341 35.318 1.00 0.00 C ATOM 61940 H8R OL 1503 107.437 44.556 35.243 1.00 0.00 H ATOM 61941 H8S OL 1503 108.604 43.321 34.940 1.00 0.00 H ATOM 61942 C19 OL 1503 108.938 44.381 36.790 1.00 0.00 C ATOM 61943 H9R OL 1503 109.969 44.625 37.032 1.00 0.00 H ATOM 61944 C110 OL 1503 108.127 44.241 37.828 1.00 0.00 C ATOM 61945 H10R OL 1503 108.419 44.361 38.868 1.00 0.00 H ATOM 61946 C111 OL 1503 106.614 43.884 37.853 1.00 0.00 C ATOM 61947 H11R OL 1503 106.048 44.662 38.370 1.00 0.00 H ATOM 61948 H11S OL 1503 106.210 44.059 36.854 1.00 0.00 H ATOM 61949 C112 OL 1503 106.349 42.424 38.373 1.00 0.00 C ATOM 61950 H12R OL 1503 105.295 42.233 38.157 1.00 0.00 H ATOM 61951 H12S OL 1503 106.987 41.765 37.780 1.00 0.00 H ATOM 61952 C113 OL 1503 106.525 42.223 39.876 1.00 0.00 C ATOM 61953 H13R OL 1503 107.089 43.088 40.231 1.00 0.00 H ATOM 61954 H13S OL 1503 105.565 42.301 40.391 1.00 0.00 H ATOM 61955 C114 OL 1503 107.172 40.947 40.271 1.00 0.00 C ATOM 61956 H14R OL 1503 107.142 40.838 41.357 1.00 0.00 H ATOM 61957 H14S OL 1503 106.563 40.219 39.731 1.00 0.00 H ATOM 61958 C115 OL 1503 108.629 40.652 39.878 1.00 0.00 C ATOM 61959 H15R OL 1503 108.762 40.907 38.825 1.00 0.00 H ATOM 61960 H15S OL 1503 109.157 41.389 40.487 1.00 0.00 H ATOM 61961 C116 OL 1503 109.076 39.230 40.092 1.00 0.00 C ATOM 61962 H16R OL 1503 108.894 39.062 41.156 1.00 0.00 H ATOM 61963 H16S OL 1503 108.384 38.587 39.545 1.00 0.00 H ATOM 61964 C117 OL 1503 110.440 38.856 39.638 1.00 0.00 C ATOM 61965 H17R OL 1503 110.435 38.840 38.546 1.00 0.00 H ATOM 61966 H17S OL 1503 111.207 39.586 39.906 1.00 0.00 H ATOM 61967 C118 OL 1503 111.020 37.452 40.024 1.00 0.00 C ATOM 61968 H18R OL 1503 110.886 37.323 41.100 1.00 0.00 H ATOM 61969 H18S OL 1503 112.087 37.367 39.808 1.00 0.00 H ATOM 61970 H18T OL 1503 110.494 36.596 39.595 1.00 0.00 H TER 61971 OL 1503 ATOM 61971 C116 PA 1504 134.639 4.032 37.000 1.00 0.00 C ATOM 61972 H16R PA 1504 133.780 4.057 36.326 1.00 0.00 H ATOM 61973 H16S PA 1504 134.387 4.357 38.011 1.00 0.00 H ATOM 61974 H16T PA 1504 135.077 3.033 36.953 1.00 0.00 H ATOM 61975 C115 PA 1504 135.494 5.230 36.615 1.00 0.00 C ATOM 61976 H15R PA 1504 136.340 5.089 37.291 1.00 0.00 H ATOM 61977 H15S PA 1504 134.962 6.161 36.823 1.00 0.00 H ATOM 61978 C114 PA 1504 136.009 5.195 35.224 1.00 0.00 C ATOM 61979 H14R PA 1504 135.135 5.101 34.575 1.00 0.00 H ATOM 61980 H14S PA 1504 136.571 4.263 35.134 1.00 0.00 H ATOM 61981 C113 PA 1504 136.884 6.331 34.836 1.00 0.00 C ATOM 61982 H13R PA 1504 137.837 6.295 35.367 1.00 0.00 H ATOM 61983 H13S PA 1504 136.370 7.237 35.163 1.00 0.00 H ATOM 61984 C112 PA 1504 137.158 6.448 33.289 1.00 0.00 C ATOM 61985 H12R PA 1504 136.275 6.451 32.646 1.00 0.00 H ATOM 61986 H12S PA 1504 137.684 5.545 32.973 1.00 0.00 H ATOM 61987 C111 PA 1504 138.074 7.546 32.781 1.00 0.00 C ATOM 61988 H11R PA 1504 137.634 8.535 32.920 1.00 0.00 H ATOM 61989 H11S PA 1504 138.237 7.537 31.701 1.00 0.00 H ATOM 61990 C110 PA 1504 139.373 7.628 33.520 1.00 0.00 C ATOM 61991 H10R PA 1504 139.226 7.731 34.598 1.00 0.00 H ATOM 61992 H10S PA 1504 139.982 8.513 33.321 1.00 0.00 H ATOM 61993 C19 PA 1504 140.290 6.333 33.490 1.00 0.00 C ATOM 61994 H9R PA 1504 139.898 5.558 34.153 1.00 0.00 H ATOM 61995 H9S PA 1504 141.228 6.578 33.992 1.00 0.00 H ATOM 61996 C18 PA 1504 140.638 5.995 32.041 1.00 0.00 C ATOM 61997 H8R PA 1504 141.254 6.782 31.601 1.00 0.00 H ATOM 61998 H8S PA 1504 139.789 6.019 31.354 1.00 0.00 H ATOM 61999 C17 PA 1504 141.426 4.688 31.857 1.00 0.00 C ATOM 62000 H7R PA 1504 140.944 3.732 32.073 1.00 0.00 H ATOM 62001 H7S PA 1504 142.315 4.739 32.489 1.00 0.00 H ATOM 62002 C16 PA 1504 141.883 4.667 30.395 1.00 0.00 C ATOM 62003 H6R PA 1504 142.394 5.605 30.168 1.00 0.00 H ATOM 62004 H6S PA 1504 140.958 4.603 29.818 1.00 0.00 H ATOM 62005 C15 PA 1504 142.529 3.440 30.016 1.00 0.00 C ATOM 62006 H5R PA 1504 141.799 2.635 30.122 1.00 0.00 H ATOM 62007 H5S PA 1504 143.328 3.222 30.728 1.00 0.00 H ATOM 62008 C14 PA 1504 143.261 3.580 28.556 1.00 0.00 C ATOM 62009 H4R PA 1504 143.974 4.406 28.589 1.00 0.00 H ATOM 62010 H4S PA 1504 142.501 3.918 27.848 1.00 0.00 H ATOM 62011 C13 PA 1504 143.866 2.238 28.074 1.00 0.00 C ATOM 62012 H3R PA 1504 143.095 1.465 28.092 1.00 0.00 H ATOM 62013 H3S PA 1504 144.563 1.906 28.847 1.00 0.00 H ATOM 62014 C12 PA 1504 144.582 2.358 26.750 1.00 0.00 C ATOM 62015 H2R PA 1504 145.142 1.455 26.499 1.00 0.00 H ATOM 62016 H2S PA 1504 145.228 3.234 26.669 1.00 0.00 H ATOM 62017 C11 PGR 1505 143.526 2.441 25.693 1.00 0.00 C ATOM 62018 O12 PGR 1505 143.692 3.064 24.663 1.00 0.00 O ATOM 62019 O11 PGR 1505 142.353 1.794 25.861 1.00 0.00 O ATOM 62020 C1 PGR 1505 141.268 1.915 24.920 1.00 0.00 C ATOM 62021 HR PGR 1505 140.907 0.898 24.745 1.00 0.00 H ATOM 62022 HS PGR 1505 141.682 2.385 24.024 1.00 0.00 H ATOM 62023 C2 PGR 1505 140.319 2.862 25.670 1.00 0.00 C ATOM 62024 HX PGR 1505 140.222 2.493 26.695 1.00 0.00 H ATOM 62025 C3 PGR 1505 138.923 2.915 24.981 1.00 0.00 C ATOM 62026 HA PGR 1505 138.449 3.854 25.280 1.00 0.00 H ATOM 62027 HB PGR 1505 138.262 2.113 25.319 1.00 0.00 H ATOM 62028 O31 PGR 1505 138.918 2.799 23.563 1.00 0.00 O ATOM 62029 P31 PGR 1505 137.444 2.787 22.819 1.00 0.00 P ATOM 62030 O32 PGR 1505 137.002 1.203 22.954 1.00 0.00 O ATOM 62031 C31 PGR 1505 137.789 0.100 22.506 1.00 0.00 C ATOM 62032 H1A PGR 1505 137.394 -0.808 22.969 1.00 0.00 H ATOM 62033 H1B PGR 1505 138.807 0.276 22.861 1.00 0.00 H ATOM 62034 C32 PGR 1505 137.764 -0.152 20.942 1.00 0.00 C ATOM 62035 H2A PGR 1505 138.042 -1.201 20.813 1.00 0.00 H ATOM 62036 O35 PGR 1505 138.728 0.750 20.346 1.00 0.00 O ATOM 62037 HO5A PGR 1505 138.450 1.679 20.443 1.00 0.00 H ATOM 62038 C33 PGR 1505 136.450 0.132 20.270 1.00 0.00 C ATOM 62039 H3A PGR 1505 135.806 -0.626 20.722 1.00 0.00 H ATOM 62040 H3B PGR 1505 136.065 1.108 20.575 1.00 0.00 H ATOM 62041 O33 PGR 1505 136.498 3.510 23.716 1.00 0.00 O ATOM 62042 O34 PGR 1505 137.670 3.169 21.396 1.00 0.00 O ATOM 62043 O21 PGR 1505 140.930 4.221 25.666 1.00 0.00 O ATOM 62044 C21 PGR 1505 140.226 5.040 26.457 1.00 0.00 C ATOM 62045 O22 PGR 1505 139.357 4.738 27.218 1.00 0.00 O ATOM 62046 O36 PGR 1505 136.584 0.093 18.891 1.00 0.00 O ATOM 62047 HO6A PGR 1505 137.145 0.827 18.582 1.00 0.00 H ATOM 62048 C12 OL 1506 140.569 6.477 26.251 1.00 0.00 C ATOM 62049 H2R OL 1506 141.239 6.628 25.402 1.00 0.00 H ATOM 62050 H2S OL 1506 139.698 7.124 26.126 1.00 0.00 H ATOM 62051 C13 OL 1506 141.444 7.028 27.390 1.00 0.00 C ATOM 62052 H3R OL 1506 142.141 6.323 27.847 1.00 0.00 H ATOM 62053 H3S OL 1506 142.068 7.780 26.902 1.00 0.00 H ATOM 62054 C14 OL 1506 140.673 7.734 28.488 1.00 0.00 C ATOM 62055 H4R OL 1506 140.035 8.398 27.901 1.00 0.00 H ATOM 62056 H4S OL 1506 140.033 7.027 29.021 1.00 0.00 H ATOM 62057 C15 OL 1506 141.469 8.506 29.488 1.00 0.00 C ATOM 62058 H5R OL 1506 140.844 8.715 30.359 1.00 0.00 H ATOM 62059 H5S OL 1506 142.349 7.973 29.853 1.00 0.00 H ATOM 62060 C16 OL 1506 142.031 9.920 29.227 1.00 0.00 C ATOM 62061 H6R OL 1506 142.540 10.287 30.121 1.00 0.00 H ATOM 62062 H6S OL 1506 142.810 9.853 28.465 1.00 0.00 H ATOM 62063 C17 OL 1506 141.029 10.937 28.773 1.00 0.00 C ATOM 62064 H7R OL 1506 141.505 11.910 28.638 1.00 0.00 H ATOM 62065 H7S OL 1506 140.583 10.744 27.795 1.00 0.00 H ATOM 62066 C18 OL 1506 139.846 11.087 29.745 1.00 0.00 C ATOM 62067 H8R OL 1506 139.183 10.221 29.701 1.00 0.00 H ATOM 62068 H8S OL 1506 140.276 11.112 30.749 1.00 0.00 H ATOM 62069 C19 OL 1506 139.123 12.342 29.491 1.00 0.00 C ATOM 62070 H9R OL 1506 138.372 12.249 28.711 1.00 0.00 H ATOM 62071 C110 OL 1506 139.327 13.533 30.110 1.00 0.00 C ATOM 62072 H10R OL 1506 138.793 14.418 29.775 1.00 0.00 H ATOM 62073 C111 OL 1506 140.178 13.792 31.286 1.00 0.00 C ATOM 62074 H11R OL 1506 141.063 13.154 31.239 1.00 0.00 H ATOM 62075 H11S OL 1506 140.629 14.786 31.334 1.00 0.00 H ATOM 62076 C112 OL 1506 139.393 13.648 32.587 1.00 0.00 C ATOM 62077 H12R OL 1506 138.611 14.396 32.737 1.00 0.00 H ATOM 62078 H12S OL 1506 138.855 12.699 32.556 1.00 0.00 H ATOM 62079 C113 OL 1506 140.225 13.612 33.790 1.00 0.00 C ATOM 62080 H13R OL 1506 141.021 12.880 33.639 1.00 0.00 H ATOM 62081 H13S OL 1506 140.632 14.575 34.106 1.00 0.00 H ATOM 62082 C114 OL 1506 139.371 13.171 34.989 1.00 0.00 C ATOM 62083 H14R OL 1506 139.864 13.500 35.906 1.00 0.00 H ATOM 62084 H14S OL 1506 138.411 13.674 34.865 1.00 0.00 H ATOM 62085 C115 OL 1506 139.321 11.669 35.136 1.00 0.00 C ATOM 62086 H15R OL 1506 138.833 11.281 34.240 1.00 0.00 H ATOM 62087 H15S OL 1506 140.365 11.348 35.158 1.00 0.00 H ATOM 62088 C116 OL 1506 138.754 11.293 36.443 1.00 0.00 C ATOM 62089 H16R OL 1506 139.534 11.484 37.183 1.00 0.00 H ATOM 62090 H16S OL 1506 137.994 11.980 36.819 1.00 0.00 H ATOM 62091 C117 OL 1506 138.131 9.897 36.426 1.00 0.00 C ATOM 62092 H17R OL 1506 137.390 9.909 35.624 1.00 0.00 H ATOM 62093 H17S OL 1506 138.968 9.341 35.997 1.00 0.00 H ATOM 62094 C118 OL 1506 137.689 9.522 37.880 1.00 0.00 C ATOM 62095 H18R OL 1506 137.247 8.527 37.962 1.00 0.00 H ATOM 62096 H18S OL 1506 137.038 10.250 38.368 1.00 0.00 H ATOM 62097 H18T OL 1506 138.531 9.379 38.561 1.00 0.00 H TER 62098 OL 1506 ATOM 62098 C116 PA 1507 17.715 103.806 40.179 1.00 0.00 C ATOM 62099 H16R PA 1507 17.430 104.858 40.107 1.00 0.00 H ATOM 62100 H16S PA 1507 18.732 103.671 39.804 1.00 0.00 H ATOM 62101 H16T PA 1507 17.761 103.448 41.210 1.00 0.00 H ATOM 62102 C115 PA 1507 16.683 102.908 39.525 1.00 0.00 C ATOM 62103 H15R PA 1507 15.668 103.303 39.602 1.00 0.00 H ATOM 62104 H15S PA 1507 16.632 101.941 40.031 1.00 0.00 H ATOM 62105 C114 PA 1507 16.949 102.533 38.160 1.00 0.00 C ATOM 62106 H14R PA 1507 16.145 101.874 37.826 1.00 0.00 H ATOM 62107 H14S PA 1507 17.934 102.061 38.148 1.00 0.00 H ATOM 62108 C113 PA 1507 17.399 103.649 37.190 1.00 0.00 C ATOM 62109 H13R PA 1507 18.305 104.178 37.493 1.00 0.00 H ATOM 62110 H13S PA 1507 16.670 104.460 37.119 1.00 0.00 H ATOM 62111 C112 PA 1507 17.710 103.110 35.766 1.00 0.00 C ATOM 62112 H12R PA 1507 16.827 102.950 35.144 1.00 0.00 H ATOM 62113 H12S PA 1507 18.250 102.168 35.886 1.00 0.00 H ATOM 62114 C111 PA 1507 18.462 104.146 34.861 1.00 0.00 C ATOM 62115 H11R PA 1507 19.387 104.481 35.335 1.00 0.00 H ATOM 62116 H11S PA 1507 17.792 105.002 34.760 1.00 0.00 H ATOM 62117 C110 PA 1507 18.646 103.615 33.477 1.00 0.00 C ATOM 62118 H10R PA 1507 18.763 104.520 32.878 1.00 0.00 H ATOM 62119 H10S PA 1507 17.720 103.164 33.116 1.00 0.00 H ATOM 62120 C19 PA 1507 19.772 102.625 33.273 1.00 0.00 C ATOM 62121 H9R PA 1507 19.715 101.900 34.087 1.00 0.00 H ATOM 62122 H9S PA 1507 20.709 103.159 33.438 1.00 0.00 H ATOM 62123 C18 PA 1507 19.778 101.959 31.917 1.00 0.00 C ATOM 62124 H8R PA 1507 20.613 102.362 31.340 1.00 0.00 H ATOM 62125 H8S PA 1507 18.963 102.227 31.241 1.00 0.00 H ATOM 62126 C17 PA 1507 19.944 100.496 31.922 1.00 0.00 C ATOM 62127 H7R PA 1507 19.156 100.002 32.494 1.00 0.00 H ATOM 62128 H7S PA 1507 20.894 100.085 32.270 1.00 0.00 H ATOM 62129 C16 PA 1507 20.049 100.046 30.434 1.00 0.00 C ATOM 62130 H6R PA 1507 20.831 100.656 29.977 1.00 0.00 H ATOM 62131 H6S PA 1507 19.060 100.233 30.011 1.00 0.00 H ATOM 62132 C15 PA 1507 20.407 98.590 30.269 1.00 0.00 C ATOM 62133 H5R PA 1507 19.674 97.979 30.799 1.00 0.00 H ATOM 62134 H5S PA 1507 21.337 98.332 30.779 1.00 0.00 H ATOM 62135 C14 PA 1507 20.441 98.120 28.748 1.00 0.00 C ATOM 62136 H4R PA 1507 21.312 98.520 28.224 1.00 0.00 H ATOM 62137 H4S PA 1507 19.586 98.507 28.191 1.00 0.00 H ATOM 62138 C13 PA 1507 20.429 96.602 28.637 1.00 0.00 C ATOM 62139 H3R PA 1507 20.570 96.261 29.665 1.00 0.00 H ATOM 62140 H3S PA 1507 21.210 96.179 28.002 1.00 0.00 H ATOM 62141 C12 PA 1507 19.035 95.991 28.280 1.00 0.00 C ATOM 62142 H2R PA 1507 18.332 96.189 29.092 1.00 0.00 H ATOM 62143 H2S PA 1507 19.201 94.915 28.362 1.00 0.00 H ATOM 62144 C11 PGR 1508 18.432 96.278 26.924 1.00 0.00 C ATOM 62145 O12 PGR 1508 18.868 95.850 25.895 1.00 0.00 O ATOM 62146 O11 PGR 1508 17.396 97.118 27.060 1.00 0.00 O ATOM 62147 C1 PGR 1508 16.846 97.676 25.795 1.00 0.00 C ATOM 62148 HR PGR 1508 15.801 97.977 25.907 1.00 0.00 H ATOM 62149 HS PGR 1508 16.911 96.937 24.993 1.00 0.00 H ATOM 62150 C2 PGR 1508 17.455 99.060 25.325 1.00 0.00 C ATOM 62151 HX PGR 1508 16.876 99.552 24.539 1.00 0.00 H ATOM 62152 C3 PGR 1508 18.912 98.878 24.980 1.00 0.00 C ATOM 62153 HA PGR 1508 19.062 97.868 24.591 1.00 0.00 H ATOM 62154 HB PGR 1508 19.599 98.964 25.827 1.00 0.00 H ATOM 62155 O31 PGR 1508 19.220 99.845 23.967 1.00 0.00 O ATOM 62156 P31 PGR 1508 20.732 99.955 23.309 1.00 0.00 P ATOM 62157 O32 PGR 1508 20.786 99.018 22.095 1.00 0.00 O ATOM 62158 C31 PGR 1508 21.128 97.617 22.258 1.00 0.00 C ATOM 62159 H1A PGR 1508 20.310 97.066 22.730 1.00 0.00 H ATOM 62160 H1B PGR 1508 21.982 97.487 22.929 1.00 0.00 H ATOM 62161 C32 PGR 1508 21.356 96.998 20.905 1.00 0.00 C ATOM 62162 H2A PGR 1508 22.100 97.598 20.375 1.00 0.00 H ATOM 62163 O35 PGR 1508 20.143 97.003 20.174 1.00 0.00 O ATOM 62164 HO5A PGR 1508 19.987 97.961 20.084 1.00 0.00 H ATOM 62165 C33 PGR 1508 21.908 95.599 21.011 1.00 0.00 C ATOM 62166 H3A PGR 1508 22.260 95.338 20.010 1.00 0.00 H ATOM 62167 H3B PGR 1508 22.717 95.641 21.744 1.00 0.00 H ATOM 62168 O33 PGR 1508 20.829 101.333 22.809 1.00 0.00 O ATOM 62169 O34 PGR 1508 21.715 99.566 24.286 1.00 0.00 O ATOM 62170 O21 PGR 1508 17.464 100.044 26.394 1.00 0.00 O ATOM 62171 C21 PGR 1508 16.317 100.516 26.905 1.00 0.00 C ATOM 62172 O22 PGR 1508 15.190 100.285 26.482 1.00 0.00 O ATOM 62173 O36 PGR 1508 20.926 94.630 21.382 1.00 0.00 O ATOM 62174 HO6A PGR 1508 21.423 93.794 21.439 1.00 0.00 H ATOM 62175 C12 OL 1509 16.648 101.401 28.071 1.00 0.00 C ATOM 62176 H2R OL 1509 17.493 100.955 28.600 1.00 0.00 H ATOM 62177 H2S OL 1509 17.067 102.333 27.688 1.00 0.00 H ATOM 62178 C13 OL 1509 15.488 101.670 28.968 1.00 0.00 C ATOM 62179 H3R OL 1509 14.859 102.329 28.365 1.00 0.00 H ATOM 62180 H3S OL 1509 14.854 100.814 29.208 1.00 0.00 H ATOM 62181 C14 OL 1509 15.807 102.502 30.176 1.00 0.00 C ATOM 62182 H4R OL 1509 16.538 101.893 30.712 1.00 0.00 H ATOM 62183 H4S OL 1509 16.493 103.287 29.849 1.00 0.00 H ATOM 62184 C15 OL 1509 14.703 103.071 30.965 1.00 0.00 C ATOM 62185 H5R OL 1509 14.334 103.962 30.454 1.00 0.00 H ATOM 62186 H5S OL 1509 13.883 102.357 30.868 1.00 0.00 H ATOM 62187 C16 OL 1509 15.053 103.261 32.445 1.00 0.00 C ATOM 62188 H6R OL 1509 15.322 102.335 32.959 1.00 0.00 H ATOM 62189 H6S OL 1509 15.906 103.943 32.442 1.00 0.00 H ATOM 62190 C17 OL 1509 13.907 103.877 33.284 1.00 0.00 C ATOM 62191 H7R OL 1509 13.644 104.845 32.853 1.00 0.00 H ATOM 62192 H7S OL 1509 13.015 103.249 33.250 1.00 0.00 H ATOM 62193 C18 OL 1509 14.334 104.166 34.716 1.00 0.00 C ATOM 62194 H8R OL 1509 14.374 103.176 35.176 1.00 0.00 H ATOM 62195 H8S OL 1509 15.338 104.580 34.605 1.00 0.00 H ATOM 62196 C19 OL 1509 13.362 104.959 35.550 1.00 0.00 C ATOM 62197 H9R OL 1509 13.569 106.025 35.514 1.00 0.00 H ATOM 62198 C110 OL 1509 12.302 104.408 36.189 1.00 0.00 C ATOM 62199 H10R OL 1509 11.657 105.054 36.780 1.00 0.00 H ATOM 62200 C111 OL 1509 11.762 102.978 36.127 1.00 0.00 C ATOM 62201 H11R OL 1509 12.252 102.570 35.240 1.00 0.00 H ATOM 62202 H11S OL 1509 12.151 102.401 36.968 1.00 0.00 H ATOM 62203 C112 OL 1509 10.239 102.857 35.913 1.00 0.00 C ATOM 62204 H12R OL 1509 10.127 101.781 35.766 1.00 0.00 H ATOM 62205 H12S OL 1509 9.692 103.150 36.811 1.00 0.00 H ATOM 62206 C113 OL 1509 9.739 103.507 34.604 1.00 0.00 C ATOM 62207 H13R OL 1509 10.387 103.252 33.763 1.00 0.00 H ATOM 62208 H13S OL 1509 8.882 102.927 34.255 1.00 0.00 H ATOM 62209 C114 OL 1509 9.512 105.037 34.683 1.00 0.00 C ATOM 62210 H14R OL 1509 8.621 105.232 35.283 1.00 0.00 H ATOM 62211 H14S OL 1509 10.339 105.612 35.106 1.00 0.00 H ATOM 62212 C115 OL 1509 9.035 105.659 33.335 1.00 0.00 C ATOM 62213 H15R OL 1509 8.740 106.696 33.503 1.00 0.00 H ATOM 62214 H15S OL 1509 9.929 105.713 32.709 1.00 0.00 H ATOM 62215 C116 OL 1509 7.895 104.997 32.647 1.00 0.00 C ATOM 62216 H16R OL 1509 8.177 103.980 32.365 1.00 0.00 H ATOM 62217 H16S OL 1509 7.008 104.963 33.283 1.00 0.00 H ATOM 62218 C117 OL 1509 7.417 105.714 31.400 1.00 0.00 C ATOM 62219 H17R OL 1509 7.200 106.742 31.696 1.00 0.00 H ATOM 62220 H17S OL 1509 8.202 105.661 30.642 1.00 0.00 H ATOM 62221 C118 OL 1509 6.197 105.070 30.817 1.00 0.00 C ATOM 62222 H18R OL 1509 6.309 104.039 30.475 1.00 0.00 H ATOM 62223 H18S OL 1509 5.712 105.575 29.979 1.00 0.00 H ATOM 62224 H18T OL 1509 5.455 105.053 31.618 1.00 0.00 H TER 62225 OL 1509 ATOM 62225 C116 PA 1510 101.181 2.864 37.760 1.00 0.00 C ATOM 62226 H16R PA 1510 102.020 2.494 38.352 1.00 0.00 H ATOM 62227 H16S PA 1510 100.847 2.104 37.051 1.00 0.00 H ATOM 62228 H16T PA 1510 100.354 2.960 38.467 1.00 0.00 H ATOM 62229 C115 PA 1510 101.461 4.096 36.898 1.00 0.00 C ATOM 62230 H15R PA 1510 102.233 3.935 36.142 1.00 0.00 H ATOM 62231 H15S PA 1510 101.817 4.840 37.613 1.00 0.00 H ATOM 62232 C114 PA 1510 100.252 4.557 36.111 1.00 0.00 C ATOM 62233 H14R PA 1510 99.493 4.852 36.839 1.00 0.00 H ATOM 62234 H14S PA 1510 99.904 3.744 35.469 1.00 0.00 H ATOM 62235 C113 PA 1510 100.378 5.730 35.143 1.00 0.00 C ATOM 62236 H13R PA 1510 99.495 5.894 34.521 1.00 0.00 H ATOM 62237 H13S PA 1510 101.145 5.516 34.395 1.00 0.00 H ATOM 62238 C112 PA 1510 100.740 7.108 35.725 1.00 0.00 C ATOM 62239 H12R PA 1510 101.700 7.033 36.241 1.00 0.00 H ATOM 62240 H12S PA 1510 100.002 7.400 36.476 1.00 0.00 H ATOM 62241 C111 PA 1510 100.805 8.171 34.604 1.00 0.00 C ATOM 62242 H11R PA 1510 101.551 7.736 33.935 1.00 0.00 H ATOM 62243 H11S PA 1510 101.318 9.095 34.879 1.00 0.00 H ATOM 62244 C110 PA 1510 99.460 8.580 33.950 1.00 0.00 C ATOM 62245 H10R PA 1510 98.909 9.203 34.658 1.00 0.00 H ATOM 62246 H10S PA 1510 98.791 7.738 33.762 1.00 0.00 H ATOM 62247 C19 PA 1510 99.550 9.405 32.685 1.00 0.00 C ATOM 62248 H9R PA 1510 100.477 9.972 32.797 1.00 0.00 H ATOM 62249 H9S PA 1510 98.739 10.134 32.634 1.00 0.00 H ATOM 62250 C18 PA 1510 99.502 8.700 31.381 1.00 0.00 C ATOM 62251 H8R PA 1510 98.553 8.196 31.187 1.00 0.00 H ATOM 62252 H8S PA 1510 100.264 7.918 31.343 1.00 0.00 H ATOM 62253 C17 PA 1510 99.716 9.657 30.157 1.00 0.00 C ATOM 62254 H7R PA 1510 100.784 9.871 30.086 1.00 0.00 H ATOM 62255 H7S PA 1510 99.061 10.510 30.350 1.00 0.00 H ATOM 62256 C16 PA 1510 99.298 9.069 28.781 1.00 0.00 C ATOM 62257 H6R PA 1510 99.172 9.910 28.095 1.00 0.00 H ATOM 62258 H6S PA 1510 98.259 8.731 28.771 1.00 0.00 H ATOM 62259 C15 PA 1510 100.374 7.956 28.323 1.00 0.00 C ATOM 62260 H5R PA 1510 100.371 7.030 28.902 1.00 0.00 H ATOM 62261 H5S PA 1510 101.384 8.341 28.478 1.00 0.00 H ATOM 62262 C14 PA 1510 100.103 7.675 26.799 1.00 0.00 C ATOM 62263 H4R PA 1510 100.045 8.614 26.244 1.00 0.00 H ATOM 62264 H4S PA 1510 99.146 7.154 26.722 1.00 0.00 H ATOM 62265 C13 PA 1510 101.156 6.784 26.124 1.00 0.00 C ATOM 62266 H3R PA 1510 101.116 5.842 26.675 1.00 0.00 H ATOM 62267 H3S PA 1510 102.194 7.075 26.295 1.00 0.00 H ATOM 62268 C12 PA 1510 100.875 6.676 24.602 1.00 0.00 C ATOM 62269 H2R PA 1510 100.853 7.695 24.210 1.00 0.00 H ATOM 62270 H2S PA 1510 99.855 6.358 24.381 1.00 0.00 H ATOM 62271 C11 PC 1511 101.985 5.941 23.935 1.00 0.00 C ATOM 62272 O12 PC 1511 103.098 6.351 23.987 1.00 0.00 O ATOM 62273 O11 PC 1511 101.532 4.987 23.066 1.00 0.00 O ATOM 62274 C1 PC 1511 102.523 4.224 22.215 1.00 0.00 C ATOM 62275 HR PC 1511 103.231 3.681 22.847 1.00 0.00 H ATOM 62276 HS PC 1511 103.093 4.911 21.585 1.00 0.00 H ATOM 62277 C2 PC 1511 101.695 3.121 21.492 1.00 0.00 C ATOM 62278 HX PC 1511 102.477 2.548 20.987 1.00 0.00 H ATOM 62279 C3 PC 1511 100.600 3.676 20.628 1.00 0.00 C ATOM 62280 HA PC 1511 100.945 4.662 20.306 1.00 0.00 H ATOM 62281 HB PC 1511 99.704 3.791 21.242 1.00 0.00 H ATOM 62282 O31 PC 1511 100.244 2.797 19.617 1.00 0.00 O ATOM 62283 P31 PC 1511 98.781 3.010 18.964 1.00 0.00 P ATOM 62284 O32 PC 1511 98.633 4.510 18.517 1.00 0.00 O ATOM 62285 C31 PC 1511 99.429 5.104 17.453 1.00 0.00 C ATOM 62286 H1A PC 1511 99.015 4.952 16.453 1.00 0.00 H ATOM 62287 H1B PC 1511 100.443 4.704 17.371 1.00 0.00 H ATOM 62288 C32 PC 1511 99.639 6.597 17.766 1.00 0.00 C ATOM 62289 H2A PC 1511 100.275 6.514 18.648 1.00 0.00 H ATOM 62290 H2B PC 1511 98.751 7.185 18.006 1.00 0.00 H ATOM 62291 N31 PC 1511 100.418 7.407 16.774 1.00 0.00 N ATOM 62292 C33 PC 1511 99.587 7.464 15.566 1.00 0.00 C ATOM 62293 H3A PC 1511 98.681 8.029 15.788 1.00 0.00 H ATOM 62294 H3B PC 1511 99.378 6.426 15.304 1.00 0.00 H ATOM 62295 H3C PC 1511 100.025 7.848 14.643 1.00 0.00 H ATOM 62296 C34 PC 1511 100.658 8.766 17.239 1.00 0.00 C ATOM 62297 H4A PC 1511 99.710 9.300 17.322 1.00 0.00 H ATOM 62298 H4B PC 1511 101.361 9.406 16.704 1.00 0.00 H ATOM 62299 H4C PC 1511 100.835 8.618 18.306 1.00 0.00 H ATOM 62300 C35 PC 1511 101.755 6.764 16.503 1.00 0.00 C ATOM 62301 H5A PC 1511 101.619 5.753 16.118 1.00 0.00 H ATOM 62302 H5B PC 1511 102.299 6.873 17.443 1.00 0.00 H ATOM 62303 H5C PC 1511 102.240 7.307 15.690 1.00 0.00 H ATOM 62304 O33 PC 1511 98.886 2.209 17.716 1.00 0.00 O ATOM 62305 O34 PC 1511 97.794 2.622 19.964 1.00 0.00 O ATOM 62306 O21 PC 1511 100.986 2.311 22.449 1.00 0.00 O ATOM 62307 C21 PC 1511 101.678 1.355 23.074 1.00 0.00 C ATOM 62308 O22 PC 1511 102.862 1.132 22.907 1.00 0.00 O ATOM 62309 C12 OL 1512 100.766 0.624 24.071 1.00 0.00 C ATOM 62310 H2R OL 1512 99.955 0.178 23.492 1.00 0.00 H ATOM 62311 H2S OL 1512 101.239 -0.309 24.387 1.00 0.00 H ATOM 62312 C13 OL 1512 100.274 1.485 25.213 1.00 0.00 C ATOM 62313 H3R OL 1512 99.488 2.183 24.918 1.00 0.00 H ATOM 62314 H3S OL 1512 99.882 0.792 25.961 1.00 0.00 H ATOM 62315 C14 OL 1512 101.374 2.266 25.889 1.00 0.00 C ATOM 62316 H4R OL 1512 102.332 1.764 25.739 1.00 0.00 H ATOM 62317 H4S OL 1512 101.466 3.185 25.307 1.00 0.00 H ATOM 62318 C15 OL 1512 101.158 2.632 27.372 1.00 0.00 C ATOM 62319 H5R OL 1512 100.116 2.958 27.411 1.00 0.00 H ATOM 62320 H5S OL 1512 101.062 1.798 28.071 1.00 0.00 H ATOM 62321 C16 OL 1512 102.200 3.598 27.972 1.00 0.00 C ATOM 62322 H6R OL 1512 103.180 3.162 28.177 1.00 0.00 H ATOM 62323 H6S OL 1512 102.548 4.354 27.266 1.00 0.00 H ATOM 62324 C17 OL 1512 101.926 4.107 29.405 1.00 0.00 C ATOM 62325 H7R OL 1512 100.961 4.614 29.470 1.00 0.00 H ATOM 62326 H7S OL 1512 101.865 3.218 30.036 1.00 0.00 H ATOM 62327 C18 OL 1512 102.963 5.188 29.944 1.00 0.00 C ATOM 62328 H8R OL 1512 103.950 4.726 29.871 1.00 0.00 H ATOM 62329 H8S OL 1512 102.946 6.025 29.244 1.00 0.00 H ATOM 62330 C19 OL 1512 102.610 5.752 31.273 1.00 0.00 C ATOM 62331 H9R OL 1512 101.719 6.374 31.301 1.00 0.00 H ATOM 62332 C110 OL 1512 103.310 5.770 32.375 1.00 0.00 C ATOM 62333 H10R OL 1512 102.933 6.332 33.226 1.00 0.00 H ATOM 62334 C111 OL 1512 104.718 5.167 32.573 1.00 0.00 C ATOM 62335 H11R OL 1512 105.254 4.970 31.643 1.00 0.00 H ATOM 62336 H11S OL 1512 105.198 5.893 33.233 1.00 0.00 H ATOM 62337 C112 OL 1512 104.609 3.935 33.387 1.00 0.00 C ATOM 62338 H12R OL 1512 103.741 3.939 34.050 1.00 0.00 H ATOM 62339 H12S OL 1512 104.426 2.991 32.871 1.00 0.00 H ATOM 62340 C113 OL 1512 105.928 3.665 34.174 1.00 0.00 C ATOM 62341 H13R OL 1512 106.163 4.509 34.827 1.00 0.00 H ATOM 62342 H13S OL 1512 105.892 2.744 34.759 1.00 0.00 H ATOM 62343 C114 OL 1512 107.191 3.509 33.305 1.00 0.00 C ATOM 62344 H14R OL 1512 106.948 2.889 32.439 1.00 0.00 H ATOM 62345 H14S OL 1512 107.406 4.486 32.867 1.00 0.00 H ATOM 62346 C115 OL 1512 108.490 3.061 33.989 1.00 0.00 C ATOM 62347 H15R OL 1512 108.543 3.337 35.044 1.00 0.00 H ATOM 62348 H15S OL 1512 108.471 1.988 34.193 1.00 0.00 H ATOM 62349 C116 OL 1512 109.797 3.427 33.271 1.00 0.00 C ATOM 62350 H16R OL 1512 109.917 4.502 33.420 1.00 0.00 H ATOM 62351 H16S OL 1512 110.614 2.878 33.743 1.00 0.00 H ATOM 62352 C117 OL 1512 109.857 3.144 31.736 1.00 0.00 C ATOM 62353 H17R OL 1512 109.840 2.073 31.525 1.00 0.00 H ATOM 62354 H17S OL 1512 109.000 3.568 31.210 1.00 0.00 H ATOM 62355 C118 OL 1512 111.194 3.679 31.185 1.00 0.00 C ATOM 62356 H18R OL 1512 112.016 3.249 31.762 1.00 0.00 H ATOM 62357 H18S OL 1512 111.313 4.761 31.271 1.00 0.00 H ATOM 62358 H18T OL 1512 111.358 3.418 30.138 1.00 0.00 H TER 62359 OL 1512 ATOM 62359 C116 PA 1513 126.840 110.770 47.430 1.00 0.00 C ATOM 62360 H16R PA 1513 126.503 109.807 47.818 1.00 0.00 H ATOM 62361 H16S PA 1513 126.849 110.680 46.341 1.00 0.00 H ATOM 62362 H16T PA 1513 126.043 111.509 47.539 1.00 0.00 H ATOM 62363 C115 PA 1513 128.166 111.152 47.996 1.00 0.00 C ATOM 62364 H15R PA 1513 128.849 110.657 47.303 1.00 0.00 H ATOM 62365 H15S PA 1513 128.292 110.725 48.993 1.00 0.00 H ATOM 62366 C114 PA 1513 128.360 112.678 47.877 1.00 0.00 C ATOM 62367 H14R PA 1513 129.191 112.968 48.523 1.00 0.00 H ATOM 62368 H14S PA 1513 127.560 113.139 48.462 1.00 0.00 H ATOM 62369 C113 PA 1513 128.531 113.274 46.480 1.00 0.00 C ATOM 62370 H13R PA 1513 128.654 114.359 46.508 1.00 0.00 H ATOM 62371 H13S PA 1513 127.658 113.126 45.841 1.00 0.00 H ATOM 62372 C112 PA 1513 129.699 112.720 45.561 1.00 0.00 C ATOM 62373 H12R PA 1513 129.728 111.629 45.574 1.00 0.00 H ATOM 62374 H12S PA 1513 130.620 113.205 45.889 1.00 0.00 H ATOM 62375 C111 PA 1513 129.661 113.235 44.125 1.00 0.00 C ATOM 62376 H11R PA 1513 129.227 114.235 44.054 1.00 0.00 H ATOM 62377 H11S PA 1513 128.852 112.653 43.679 1.00 0.00 H ATOM 62378 C110 PA 1513 131.036 113.074 43.445 1.00 0.00 C ATOM 62379 H10R PA 1513 131.439 112.091 43.696 1.00 0.00 H ATOM 62380 H10S PA 1513 131.719 113.803 43.886 1.00 0.00 H ATOM 62381 C19 PA 1513 130.920 113.375 41.978 1.00 0.00 C ATOM 62382 H9R PA 1513 130.597 114.416 41.900 1.00 0.00 H ATOM 62383 H9S PA 1513 130.155 112.735 41.533 1.00 0.00 H ATOM 62384 C18 PA 1513 132.241 113.192 41.219 1.00 0.00 C ATOM 62385 H8R PA 1513 132.776 112.292 41.527 1.00 0.00 H ATOM 62386 H8S PA 1513 132.796 114.100 41.464 1.00 0.00 H ATOM 62387 C17 PA 1513 132.060 113.012 39.729 1.00 0.00 C ATOM 62388 H7R PA 1513 131.540 113.869 39.296 1.00 0.00 H ATOM 62389 H7S PA 1513 131.472 112.125 39.483 1.00 0.00 H ATOM 62390 C16 PA 1513 133.340 112.972 38.854 1.00 0.00 C ATOM 62391 H6R PA 1513 134.089 112.307 39.288 1.00 0.00 H ATOM 62392 H6S PA 1513 133.720 113.992 38.759 1.00 0.00 H ATOM 62393 C15 PA 1513 133.165 112.447 37.397 1.00 0.00 C ATOM 62394 H5R PA 1513 132.521 113.164 36.886 1.00 0.00 H ATOM 62395 H5S PA 1513 132.685 111.484 37.587 1.00 0.00 H ATOM 62396 C14 PA 1513 134.486 112.339 36.606 1.00 0.00 C ATOM 62397 H4R PA 1513 135.107 111.640 37.170 1.00 0.00 H ATOM 62398 H4S PA 1513 135.028 113.274 36.766 1.00 0.00 H ATOM 62399 C13 PA 1513 134.388 111.780 35.120 1.00 0.00 C ATOM 62400 H3R PA 1513 133.547 112.276 34.630 1.00 0.00 H ATOM 62401 H3S PA 1513 134.013 110.756 35.175 1.00 0.00 H ATOM 62402 C12 PA 1513 135.732 111.808 34.298 1.00 0.00 C ATOM 62403 H2R PA 1513 136.596 111.276 34.700 1.00 0.00 H ATOM 62404 H2S PA 1513 135.973 112.865 34.164 1.00 0.00 H ATOM 62405 C11 PC 1514 135.521 111.237 32.995 1.00 0.00 C ATOM 62406 O12 PC 1514 134.645 110.436 32.723 1.00 0.00 O ATOM 62407 O11 PC 1514 136.376 111.770 32.143 1.00 0.00 O ATOM 62408 C1 PC 1514 136.411 111.461 30.742 1.00 0.00 C ATOM 62409 HR PC 1514 136.976 112.254 30.247 1.00 0.00 H ATOM 62410 HS PC 1514 135.381 111.425 30.378 1.00 0.00 H ATOM 62411 C2 PC 1514 137.155 110.112 30.499 1.00 0.00 C ATOM 62412 HX PC 1514 138.192 110.073 30.844 1.00 0.00 H ATOM 62413 C3 PC 1514 137.203 109.780 28.975 1.00 0.00 C ATOM 62414 HA PC 1514 137.608 108.768 28.890 1.00 0.00 H ATOM 62415 HB PC 1514 138.030 110.400 28.619 1.00 0.00 H ATOM 62416 O31 PC 1514 135.980 109.969 28.335 1.00 0.00 O ATOM 62417 P31 PC 1514 135.970 110.221 26.719 1.00 0.00 P ATOM 62418 O32 PC 1514 136.628 108.953 26.133 1.00 0.00 O ATOM 62419 C31 PC 1514 136.795 109.001 24.795 1.00 0.00 C ATOM 62420 H1A PC 1514 137.405 109.858 24.498 1.00 0.00 H ATOM 62421 H1B PC 1514 135.854 108.866 24.255 1.00 0.00 H ATOM 62422 C32 PC 1514 137.593 107.735 24.579 1.00 0.00 C ATOM 62423 H2A PC 1514 136.840 106.958 24.437 1.00 0.00 H ATOM 62424 H2B PC 1514 138.234 107.595 25.451 1.00 0.00 H ATOM 62425 N31 PC 1514 138.487 107.638 23.447 1.00 0.00 N ATOM 62426 C33 PC 1514 137.784 107.814 22.138 1.00 0.00 C ATOM 62427 H3A PC 1514 137.133 106.942 22.056 1.00 0.00 H ATOM 62428 H3B PC 1514 138.453 107.895 21.281 1.00 0.00 H ATOM 62429 H3C PC 1514 137.133 108.681 22.260 1.00 0.00 H ATOM 62430 C34 PC 1514 139.588 108.670 23.452 1.00 0.00 C ATOM 62431 H4A PC 1514 139.957 108.640 24.478 1.00 0.00 H ATOM 62432 H4B PC 1514 139.087 109.636 23.366 1.00 0.00 H ATOM 62433 H4C PC 1514 140.354 108.445 22.709 1.00 0.00 H ATOM 62434 C35 PC 1514 139.170 106.410 23.486 1.00 0.00 C ATOM 62435 H5A PC 1514 140.116 106.620 22.984 1.00 0.00 H ATOM 62436 H5B PC 1514 138.524 105.693 22.977 1.00 0.00 H ATOM 62437 H5C PC 1514 139.367 106.148 24.527 1.00 0.00 H ATOM 62438 O33 PC 1514 134.587 110.301 26.291 1.00 0.00 O ATOM 62439 O34 PC 1514 136.918 111.338 26.477 1.00 0.00 O ATOM 62440 O21 PC 1514 136.440 109.103 31.296 1.00 0.00 O ATOM 62441 C21 PC 1514 137.024 107.951 31.603 1.00 0.00 C ATOM 62442 O22 PC 1514 138.164 107.714 31.356 1.00 0.00 O ATOM 62443 C12 OL 1515 136.196 107.060 32.393 1.00 0.00 C ATOM 62444 H2R OL 1515 135.244 106.825 31.913 1.00 0.00 H ATOM 62445 H2S OL 1515 136.738 106.121 32.527 1.00 0.00 H ATOM 62446 C13 OL 1515 135.930 107.481 33.789 1.00 0.00 C ATOM 62447 H3R OL 1515 136.876 107.501 34.334 1.00 0.00 H ATOM 62448 H3S OL 1515 135.346 108.401 33.851 1.00 0.00 H ATOM 62449 C14 OL 1515 135.111 106.368 34.530 1.00 0.00 C ATOM 62450 H4R OL 1515 134.346 105.951 33.873 1.00 0.00 H ATOM 62451 H4S OL 1515 135.775 105.518 34.705 1.00 0.00 H ATOM 62452 C15 OL 1515 134.315 106.727 35.801 1.00 0.00 C ATOM 62453 H5R OL 1515 134.078 105.835 36.385 1.00 0.00 H ATOM 62454 H5S OL 1515 134.995 107.268 36.462 1.00 0.00 H ATOM 62455 C16 OL 1515 133.023 107.591 35.566 1.00 0.00 C ATOM 62456 H6R OL 1515 132.532 107.731 36.531 1.00 0.00 H ATOM 62457 H6S OL 1515 133.152 108.607 35.188 1.00 0.00 H ATOM 62458 C17 OL 1515 131.945 106.922 34.659 1.00 0.00 C ATOM 62459 H7R OL 1515 132.108 106.948 33.580 1.00 0.00 H ATOM 62460 H7S OL 1515 132.121 105.866 34.873 1.00 0.00 H ATOM 62461 C18 OL 1515 130.534 107.463 34.929 1.00 0.00 C ATOM 62462 H8R OL 1515 129.806 106.713 34.612 1.00 0.00 H ATOM 62463 H8S OL 1515 130.466 107.548 36.015 1.00 0.00 H ATOM 62464 C19 OL 1515 130.234 108.689 34.228 1.00 0.00 C ATOM 62465 H9R OL 1515 130.361 108.601 33.152 1.00 0.00 H ATOM 62466 C110 OL 1515 129.876 109.906 34.715 1.00 0.00 C ATOM 62467 H10R OL 1515 129.806 110.707 33.983 1.00 0.00 H ATOM 62468 C111 OL 1515 129.898 110.235 36.165 1.00 0.00 C ATOM 62469 H11R OL 1515 130.409 109.490 36.779 1.00 0.00 H ATOM 62470 H11S OL 1515 130.450 111.169 36.293 1.00 0.00 H ATOM 62471 C112 OL 1515 128.492 110.160 36.624 1.00 0.00 C ATOM 62472 H12R OL 1515 128.213 111.124 36.192 1.00 0.00 H ATOM 62473 H12S OL 1515 127.797 109.422 36.218 1.00 0.00 H ATOM 62474 C113 OL 1515 128.480 110.061 38.136 1.00 0.00 C ATOM 62475 H13R OL 1515 129.050 109.184 38.450 1.00 0.00 H ATOM 62476 H13S OL 1515 129.079 110.886 38.528 1.00 0.00 H ATOM 62477 C114 OL 1515 127.111 110.130 38.717 1.00 0.00 C ATOM 62478 H14R OL 1515 126.458 110.770 38.120 1.00 0.00 H ATOM 62479 H14S OL 1515 126.604 109.163 38.704 1.00 0.00 H ATOM 62480 C115 OL 1515 127.032 110.532 40.196 1.00 0.00 C ATOM 62481 H15R OL 1515 127.336 109.692 40.824 1.00 0.00 H ATOM 62482 H15S OL 1515 127.702 111.337 40.506 1.00 0.00 H ATOM 62483 C116 OL 1515 125.663 111.042 40.652 1.00 0.00 C ATOM 62484 H16R OL 1515 125.274 111.857 40.039 1.00 0.00 H ATOM 62485 H16S OL 1515 124.834 110.341 40.536 1.00 0.00 H ATOM 62486 C117 OL 1515 125.514 111.525 42.116 1.00 0.00 C ATOM 62487 H17R OL 1515 126.049 112.475 42.168 1.00 0.00 H ATOM 62488 H17S OL 1515 124.496 111.861 42.327 1.00 0.00 H ATOM 62489 C118 OL 1515 126.089 110.647 43.237 1.00 0.00 C ATOM 62490 H18R OL 1515 125.842 111.257 44.108 1.00 0.00 H ATOM 62491 H18S OL 1515 127.167 110.510 43.132 1.00 0.00 H ATOM 62492 H18T OL 1515 125.622 109.667 43.359 1.00 0.00 H TER 62493 OL 1515 ATOM 62493 C116 PA 1516 40.773 143.249 40.615 1.00 0.00 C ATOM 62494 H16R PA 1516 41.256 143.645 39.719 1.00 0.00 H ATOM 62495 H16S PA 1516 40.387 142.242 40.446 1.00 0.00 H ATOM 62496 H16T PA 1516 41.581 143.113 41.336 1.00 0.00 H ATOM 62497 C115 PA 1516 39.605 144.219 41.004 1.00 0.00 C ATOM 62498 H15R PA 1516 39.946 145.251 41.117 1.00 0.00 H ATOM 62499 H15S PA 1516 39.135 144.025 41.970 1.00 0.00 H ATOM 62500 C114 PA 1516 38.511 144.389 39.957 1.00 0.00 C ATOM 62501 H14R PA 1516 37.901 145.199 40.362 1.00 0.00 H ATOM 62502 H14S PA 1516 37.799 143.569 40.070 1.00 0.00 H ATOM 62503 C113 PA 1516 38.975 144.677 38.553 1.00 0.00 C ATOM 62504 H13R PA 1516 39.435 143.788 38.115 1.00 0.00 H ATOM 62505 H13S PA 1516 39.770 145.425 38.564 1.00 0.00 H ATOM 62506 C112 PA 1516 37.763 144.988 37.718 1.00 0.00 C ATOM 62507 H12R PA 1516 37.067 145.608 38.287 1.00 0.00 H ATOM 62508 H12S PA 1516 37.196 144.063 37.594 1.00 0.00 H ATOM 62509 C111 PA 1516 38.081 145.303 36.263 1.00 0.00 C ATOM 62510 H11R PA 1516 38.858 144.598 35.963 1.00 0.00 H ATOM 62511 H11S PA 1516 38.480 146.320 36.263 1.00 0.00 H ATOM 62512 C110 PA 1516 36.855 145.097 35.418 1.00 0.00 C ATOM 62513 H10R PA 1516 36.136 145.904 35.576 1.00 0.00 H ATOM 62514 H10S PA 1516 36.350 144.190 35.759 1.00 0.00 H ATOM 62515 C19 PA 1516 37.296 145.018 33.947 1.00 0.00 C ATOM 62516 H9R PA 1516 37.913 144.117 33.919 1.00 0.00 H ATOM 62517 H9S PA 1516 37.895 145.905 33.731 1.00 0.00 H ATOM 62518 C18 PA 1516 36.167 144.851 32.919 1.00 0.00 C ATOM 62519 H8R PA 1516 35.707 145.819 32.711 1.00 0.00 H ATOM 62520 H8S PA 1516 35.431 144.138 33.296 1.00 0.00 H ATOM 62521 C17 PA 1516 36.391 144.338 31.514 1.00 0.00 C ATOM 62522 H7R PA 1516 37.201 144.945 31.103 1.00 0.00 H ATOM 62523 H7S PA 1516 35.444 144.501 30.995 1.00 0.00 H ATOM 62524 C16 PA 1516 36.845 142.931 31.462 1.00 0.00 C ATOM 62525 H6R PA 1516 36.048 142.273 31.815 1.00 0.00 H ATOM 62526 H6S PA 1516 37.709 142.760 32.107 1.00 0.00 H ATOM 62527 C15 PA 1516 37.120 142.455 29.987 1.00 0.00 C ATOM 62528 H5R PA 1516 36.257 142.759 29.391 1.00 0.00 H ATOM 62529 H5S PA 1516 37.065 141.366 29.937 1.00 0.00 H ATOM 62530 C14 PA 1516 38.395 142.942 29.257 1.00 0.00 C ATOM 62531 H4R PA 1516 39.234 142.607 29.869 1.00 0.00 H ATOM 62532 H4S PA 1516 38.449 144.024 29.397 1.00 0.00 H ATOM 62533 C13 PA 1516 38.356 142.513 27.810 1.00 0.00 C ATOM 62534 H3R PA 1516 39.255 142.902 27.326 1.00 0.00 H ATOM 62535 H3S PA 1516 37.517 143.034 27.345 1.00 0.00 H ATOM 62536 C12 PA 1516 38.346 140.967 27.611 1.00 0.00 C ATOM 62537 H2R PA 1516 37.471 140.364 27.863 1.00 0.00 H ATOM 62538 H2S PA 1516 39.191 140.570 28.178 1.00 0.00 H ATOM 62539 C11 PGR 1517 38.582 140.650 26.136 1.00 0.00 C ATOM 62540 O12 PGR 1517 37.632 140.421 25.351 1.00 0.00 O ATOM 62541 O11 PGR 1517 39.904 140.643 25.824 1.00 0.00 O ATOM 62542 C1 PGR 1517 40.245 140.696 24.444 1.00 0.00 C ATOM 62543 HR PGR 1517 39.814 141.544 23.907 1.00 0.00 H ATOM 62544 HS PGR 1517 39.839 139.790 23.988 1.00 0.00 H ATOM 62545 C2 PGR 1517 41.728 140.688 24.208 1.00 0.00 C ATOM 62546 HX PGR 1517 42.121 141.683 24.436 1.00 0.00 H ATOM 62547 C3 PGR 1517 41.916 140.518 22.677 1.00 0.00 C ATOM 62548 HA PGR 1517 42.987 140.581 22.469 1.00 0.00 H ATOM 62549 HB PGR 1517 41.433 141.396 22.241 1.00 0.00 H ATOM 62550 O31 PGR 1517 41.276 139.427 22.124 1.00 0.00 O ATOM 62551 P31 PGR 1517 41.319 139.113 20.545 1.00 0.00 P ATOM 62552 O32 PGR 1517 40.403 140.162 19.893 1.00 0.00 O ATOM 62553 C31 PGR 1517 39.117 140.361 20.211 1.00 0.00 C ATOM 62554 H1A PGR 1517 39.097 140.550 21.287 1.00 0.00 H ATOM 62555 H1B PGR 1517 38.560 139.491 19.852 1.00 0.00 H ATOM 62556 C32 PGR 1517 38.460 141.482 19.400 1.00 0.00 C ATOM 62557 H2A PGR 1517 37.404 141.479 19.682 1.00 0.00 H ATOM 62558 O35 PGR 1517 38.582 141.184 18.000 1.00 0.00 O ATOM 62559 HO5A PGR 1517 37.806 141.559 17.548 1.00 0.00 H ATOM 62560 C33 PGR 1517 39.074 142.810 19.948 1.00 0.00 C ATOM 62561 H3A PGR 1517 38.367 143.628 19.786 1.00 0.00 H ATOM 62562 H3B PGR 1517 39.161 142.781 21.037 1.00 0.00 H ATOM 62563 O33 PGR 1517 42.654 139.188 20.031 1.00 0.00 O ATOM 62564 O34 PGR 1517 40.605 137.821 20.382 1.00 0.00 O ATOM 62565 O21 PGR 1517 42.413 139.560 24.953 1.00 0.00 O ATOM 62566 C21 PGR 1517 43.720 139.576 25.122 1.00 0.00 C ATOM 62567 O22 PGR 1517 44.373 140.590 24.943 1.00 0.00 O ATOM 62568 O36 PGR 1517 40.316 143.078 19.260 1.00 0.00 O ATOM 62569 HO6A PGR 1517 40.788 143.837 19.648 1.00 0.00 H ATOM 62570 C12 OL 1518 44.321 138.376 25.632 1.00 0.00 C ATOM 62571 H2R OL 1518 43.574 137.913 26.280 1.00 0.00 H ATOM 62572 H2S OL 1518 44.550 137.786 24.742 1.00 0.00 H ATOM 62573 C13 OL 1518 45.532 138.704 26.563 1.00 0.00 C ATOM 62574 H3R OL 1518 46.267 139.390 26.137 1.00 0.00 H ATOM 62575 H3S OL 1518 45.213 139.435 27.309 1.00 0.00 H ATOM 62576 C14 OL 1518 46.166 137.427 27.184 1.00 0.00 C ATOM 62577 H4R OL 1518 45.516 136.932 27.909 1.00 0.00 H ATOM 62578 H4S OL 1518 46.317 136.661 26.421 1.00 0.00 H ATOM 62579 C15 OL 1518 47.527 137.675 27.801 1.00 0.00 C ATOM 62580 H5R OL 1518 48.154 136.840 27.481 1.00 0.00 H ATOM 62581 H5S OL 1518 47.924 138.511 27.221 1.00 0.00 H ATOM 62582 C16 OL 1518 47.725 137.619 29.312 1.00 0.00 C ATOM 62583 H6R OL 1518 46.904 137.131 29.843 1.00 0.00 H ATOM 62584 H6S OL 1518 48.546 136.898 29.317 1.00 0.00 H ATOM 62585 C17 OL 1518 48.184 138.961 29.968 1.00 0.00 C ATOM 62586 H7R OL 1518 49.026 139.330 29.379 1.00 0.00 H ATOM 62587 H7S OL 1518 47.361 139.662 29.811 1.00 0.00 H ATOM 62588 C18 OL 1518 48.432 138.940 31.433 1.00 0.00 C ATOM 62589 H8R OL 1518 47.525 138.796 32.024 1.00 0.00 H ATOM 62590 H8S OL 1518 49.246 138.344 31.850 1.00 0.00 H ATOM 62591 C19 OL 1518 48.930 140.318 31.718 1.00 0.00 C ATOM 62592 H9R OL 1518 48.439 141.088 31.127 1.00 0.00 H ATOM 62593 C110 OL 1518 49.969 140.715 32.429 1.00 0.00 C ATOM 62594 H10R OL 1518 50.159 141.778 32.311 1.00 0.00 H ATOM 62595 C111 OL 1518 50.923 139.847 33.233 1.00 0.00 C ATOM 62596 H11R OL 1518 51.175 138.947 32.670 1.00 0.00 H ATOM 62597 H11S OL 1518 51.876 140.296 33.518 1.00 0.00 H ATOM 62598 C112 OL 1518 50.134 139.448 34.517 1.00 0.00 C ATOM 62599 H12R OL 1518 50.067 140.312 35.181 1.00 0.00 H ATOM 62600 H12S OL 1518 49.097 139.149 34.348 1.00 0.00 H ATOM 62601 C113 OL 1518 50.847 138.249 35.175 1.00 0.00 C ATOM 62602 H13R OL 1518 50.733 137.432 34.459 1.00 0.00 H ATOM 62603 H13S OL 1518 51.924 138.399 35.278 1.00 0.00 H ATOM 62604 C114 OL 1518 50.216 137.862 36.512 1.00 0.00 C ATOM 62605 H14R OL 1518 50.783 136.941 36.659 1.00 0.00 H ATOM 62606 H14S OL 1518 50.543 138.460 37.365 1.00 0.00 H ATOM 62607 C115 OL 1518 48.719 137.597 36.413 1.00 0.00 C ATOM 62608 H15R OL 1518 48.128 138.514 36.376 1.00 0.00 H ATOM 62609 H15S OL 1518 48.583 137.068 35.468 1.00 0.00 H ATOM 62610 C116 OL 1518 48.211 136.742 37.546 1.00 0.00 C ATOM 62611 H16R OL 1518 48.848 135.860 37.457 1.00 0.00 H ATOM 62612 H16S OL 1518 48.370 137.207 38.521 1.00 0.00 H ATOM 62613 C117 OL 1518 46.825 136.234 37.359 1.00 0.00 C ATOM 62614 H17R OL 1518 46.142 137.076 37.227 1.00 0.00 H ATOM 62615 H17S OL 1518 46.794 135.682 36.417 1.00 0.00 H ATOM 62616 C118 OL 1518 46.364 135.451 38.548 1.00 0.00 C ATOM 62617 H18R OL 1518 46.434 135.976 39.503 1.00 0.00 H ATOM 62618 H18S OL 1518 47.031 134.594 38.660 1.00 0.00 H ATOM 62619 H18T OL 1518 45.380 135.008 38.381 1.00 0.00 H TER 62620 OL 1518 ATOM 62620 C116 PA 1519 18.402 58.264 38.509 1.00 0.00 C ATOM 62621 H16R PA 1519 17.615 58.121 39.252 1.00 0.00 H ATOM 62622 H16S PA 1519 19.253 57.803 39.015 1.00 0.00 H ATOM 62623 H16T PA 1519 18.113 57.746 37.592 1.00 0.00 H ATOM 62624 C115 PA 1519 18.726 59.650 38.073 1.00 0.00 C ATOM 62625 H15R PA 1519 19.325 60.097 38.869 1.00 0.00 H ATOM 62626 H15S PA 1519 17.886 60.308 37.842 1.00 0.00 H ATOM 62627 C114 PA 1519 19.597 59.628 36.811 1.00 0.00 C ATOM 62628 H14R PA 1519 18.974 59.360 35.955 1.00 0.00 H ATOM 62629 H14S PA 1519 20.391 58.888 36.934 1.00 0.00 H ATOM 62630 C113 PA 1519 20.065 61.053 36.386 1.00 0.00 C ATOM 62631 H13R PA 1519 20.755 61.422 37.148 1.00 0.00 H ATOM 62632 H13S PA 1519 19.322 61.830 36.196 1.00 0.00 H ATOM 62633 C112 PA 1519 21.009 61.120 35.124 1.00 0.00 C ATOM 62634 H12R PA 1519 21.833 60.408 35.216 1.00 0.00 H ATOM 62635 H12S PA 1519 21.570 62.057 35.109 1.00 0.00 H ATOM 62636 C111 PA 1519 20.282 60.855 33.799 1.00 0.00 C ATOM 62637 H11R PA 1519 19.229 61.132 33.881 1.00 0.00 H ATOM 62638 H11S PA 1519 20.349 59.781 33.618 1.00 0.00 H ATOM 62639 C110 PA 1519 20.832 61.564 32.543 1.00 0.00 C ATOM 62640 H10R PA 1519 21.923 61.596 32.506 1.00 0.00 H ATOM 62641 H10S PA 1519 20.538 62.615 32.520 1.00 0.00 H ATOM 62642 C19 PA 1519 20.337 60.889 31.311 1.00 0.00 C ATOM 62643 H9R PA 1519 19.274 61.067 31.135 1.00 0.00 H ATOM 62644 H9S PA 1519 20.413 59.816 31.498 1.00 0.00 H ATOM 62645 C18 PA 1519 21.131 61.438 30.090 1.00 0.00 C ATOM 62646 H8R PA 1519 22.218 61.359 30.162 1.00 0.00 H ATOM 62647 H8S PA 1519 21.029 62.525 30.120 1.00 0.00 H ATOM 62648 C17 PA 1519 20.818 60.768 28.740 1.00 0.00 C ATOM 62649 H7R PA 1519 19.731 60.750 28.639 1.00 0.00 H ATOM 62650 H7S PA 1519 21.314 59.797 28.690 1.00 0.00 H ATOM 62651 C16 PA 1519 21.301 61.545 27.510 1.00 0.00 C ATOM 62652 H6R PA 1519 22.385 61.673 27.533 1.00 0.00 H ATOM 62653 H6S PA 1519 21.014 62.597 27.447 1.00 0.00 H ATOM 62654 C15 PA 1519 21.006 60.912 26.207 1.00 0.00 C ATOM 62655 H5R PA 1519 19.921 60.876 26.085 1.00 0.00 H ATOM 62656 H5S PA 1519 21.308 59.870 26.081 1.00 0.00 H ATOM 62657 C14 PA 1519 21.549 61.634 24.965 1.00 0.00 C ATOM 62658 H4R PA 1519 22.639 61.698 24.990 1.00 0.00 H ATOM 62659 H4S PA 1519 21.131 62.630 25.127 1.00 0.00 H ATOM 62660 C13 PA 1519 20.979 60.885 23.662 1.00 0.00 C ATOM 62661 H3R PA 1519 21.276 61.506 22.814 1.00 0.00 H ATOM 62662 H3S PA 1519 19.887 60.900 23.643 1.00 0.00 H ATOM 62663 C12 PA 1519 21.552 59.468 23.501 1.00 0.00 C ATOM 62664 H2R PA 1519 21.340 58.742 24.288 1.00 0.00 H ATOM 62665 H2S PA 1519 22.639 59.575 23.529 1.00 0.00 H ATOM 62666 C11 PC 1520 21.205 58.736 22.182 1.00 0.00 C ATOM 62667 O12 PC 1520 21.158 59.337 21.137 1.00 0.00 O ATOM 62668 O11 PC 1520 20.961 57.432 22.311 1.00 0.00 O ATOM 62669 C1 PC 1520 20.523 56.674 21.103 1.00 0.00 C ATOM 62670 HR PC 1520 21.254 56.766 20.296 1.00 0.00 H ATOM 62671 HS PC 1520 19.540 57.084 20.858 1.00 0.00 H ATOM 62672 C2 PC 1520 20.157 55.212 21.457 1.00 0.00 C ATOM 62673 HX PC 1520 20.948 54.803 22.092 1.00 0.00 H ATOM 62674 C3 PC 1520 19.956 54.339 20.151 1.00 0.00 C ATOM 62675 HA PC 1520 19.689 53.331 20.481 1.00 0.00 H ATOM 62676 HB PC 1520 20.832 54.333 19.497 1.00 0.00 H ATOM 62677 O31 PC 1520 18.874 54.892 19.429 1.00 0.00 O ATOM 62678 P31 PC 1520 18.361 54.213 18.039 1.00 0.00 P ATOM 62679 O32 PC 1520 17.370 53.101 18.539 1.00 0.00 O ATOM 62680 C31 PC 1520 17.572 51.772 18.186 1.00 0.00 C ATOM 62681 H1A PC 1520 18.457 51.425 18.725 1.00 0.00 H ATOM 62682 H1B PC 1520 17.861 51.694 17.135 1.00 0.00 H ATOM 62683 C32 PC 1520 16.273 50.990 18.557 1.00 0.00 C ATOM 62684 H2A PC 1520 16.325 50.030 18.043 1.00 0.00 H ATOM 62685 H2B PC 1520 15.500 51.591 18.076 1.00 0.00 H ATOM 62686 N31 PC 1520 15.926 50.768 19.994 1.00 0.00 N ATOM 62687 C33 PC 1520 16.177 51.858 20.927 1.00 0.00 C ATOM 62688 H3A PC 1520 17.168 52.202 20.629 1.00 0.00 H ATOM 62689 H3B PC 1520 16.100 51.639 21.994 1.00 0.00 H ATOM 62690 H3C PC 1520 15.379 52.566 20.701 1.00 0.00 H ATOM 62691 C34 PC 1520 14.498 50.314 20.048 1.00 0.00 C ATOM 62692 H4A PC 1520 13.805 51.034 19.610 1.00 0.00 H ATOM 62693 H4B PC 1520 14.233 50.096 21.083 1.00 0.00 H ATOM 62694 H4C PC 1520 14.469 49.469 19.359 1.00 0.00 H ATOM 62695 C35 PC 1520 16.714 49.658 20.475 1.00 0.00 C ATOM 62696 H5A PC 1520 16.654 48.868 19.725 1.00 0.00 H ATOM 62697 H5B PC 1520 16.154 49.222 21.304 1.00 0.00 H ATOM 62698 H5C PC 1520 17.743 49.997 20.602 1.00 0.00 H ATOM 62699 O33 PC 1520 17.575 55.180 17.297 1.00 0.00 O ATOM 62700 O34 PC 1520 19.581 53.573 17.493 1.00 0.00 O ATOM 62701 O21 PC 1520 18.929 55.300 22.155 1.00 0.00 O ATOM 62702 C21 PC 1520 18.454 54.260 22.915 1.00 0.00 C ATOM 62703 O22 PC 1520 18.942 53.166 23.049 1.00 0.00 O ATOM 62704 C12 OL 1521 17.132 54.586 23.600 1.00 0.00 C ATOM 62705 H2R OL 1521 16.831 55.593 23.304 1.00 0.00 H ATOM 62706 H2S OL 1521 16.378 53.953 23.128 1.00 0.00 H ATOM 62707 C13 OL 1521 17.114 54.254 25.113 1.00 0.00 C ATOM 62708 H3R OL 1521 17.746 54.964 25.651 1.00 0.00 H ATOM 62709 H3S OL 1521 16.103 54.490 25.451 1.00 0.00 H ATOM 62710 C14 OL 1521 17.390 52.847 25.503 1.00 0.00 C ATOM 62711 H4R OL 1521 16.623 52.256 24.997 1.00 0.00 H ATOM 62712 H4S OL 1521 18.342 52.393 25.219 1.00 0.00 H ATOM 62713 C15 OL 1521 17.245 52.526 26.945 1.00 0.00 C ATOM 62714 H5R OL 1521 16.261 52.909 27.226 1.00 0.00 H ATOM 62715 H5S OL 1521 17.285 51.441 27.063 1.00 0.00 H ATOM 62716 C16 OL 1521 18.363 53.100 27.872 1.00 0.00 C ATOM 62717 H6R OL 1521 19.202 52.530 27.468 1.00 0.00 H ATOM 62718 H6S OL 1521 18.666 54.145 27.784 1.00 0.00 H ATOM 62719 C17 OL 1521 18.164 52.671 29.265 1.00 0.00 C ATOM 62720 H7R OL 1521 17.181 53.041 29.561 1.00 0.00 H ATOM 62721 H7S OL 1521 18.035 51.589 29.327 1.00 0.00 H ATOM 62722 C18 OL 1521 19.181 53.234 30.222 1.00 0.00 C ATOM 62723 H8R OL 1521 20.215 52.903 30.111 1.00 0.00 H ATOM 62724 H8S OL 1521 19.199 54.322 30.131 1.00 0.00 H ATOM 62725 C19 OL 1521 18.718 52.826 31.623 1.00 0.00 C ATOM 62726 H9R OL 1521 17.926 53.497 31.947 1.00 0.00 H ATOM 62727 C110 OL 1521 19.014 51.742 32.387 1.00 0.00 C ATOM 62728 H10R OL 1521 18.548 51.607 33.359 1.00 0.00 H ATOM 62729 C111 OL 1521 20.045 50.735 32.070 1.00 0.00 C ATOM 62730 H11R OL 1521 19.644 49.726 31.954 1.00 0.00 H ATOM 62731 H11S OL 1521 20.573 50.816 31.118 1.00 0.00 H ATOM 62732 C112 OL 1521 21.087 50.803 33.263 1.00 0.00 C ATOM 62733 H12R OL 1521 21.690 51.708 33.353 1.00 0.00 H ATOM 62734 H12S OL 1521 20.513 50.755 34.191 1.00 0.00 H ATOM 62735 C113 OL 1521 22.090 49.726 33.304 1.00 0.00 C ATOM 62736 H13R OL 1521 21.521 48.803 33.176 1.00 0.00 H ATOM 62737 H13S OL 1521 22.823 49.787 32.497 1.00 0.00 H ATOM 62738 C114 OL 1521 22.839 49.630 34.601 1.00 0.00 C ATOM 62739 H14R OL 1521 22.111 49.501 35.404 1.00 0.00 H ATOM 62740 H14S OL 1521 23.370 48.677 34.640 1.00 0.00 H ATOM 62741 C115 OL 1521 23.674 50.885 34.902 1.00 0.00 C ATOM 62742 H15R OL 1521 24.203 51.143 33.982 1.00 0.00 H ATOM 62743 H15S OL 1521 23.083 51.784 35.089 1.00 0.00 H ATOM 62744 C116 OL 1521 24.798 50.793 35.993 1.00 0.00 C ATOM 62745 H16R OL 1521 25.588 50.095 35.708 1.00 0.00 H ATOM 62746 H16S OL 1521 25.384 51.715 35.982 1.00 0.00 H ATOM 62747 C117 OL 1521 24.137 50.419 37.307 1.00 0.00 C ATOM 62748 H17R OL 1521 23.169 50.896 37.471 1.00 0.00 H ATOM 62749 H17S OL 1521 23.913 49.351 37.344 1.00 0.00 H ATOM 62750 C118 OL 1521 24.986 50.528 38.556 1.00 0.00 C ATOM 62751 H18R OL 1521 24.452 50.157 39.433 1.00 0.00 H ATOM 62752 H18S OL 1521 25.126 51.605 38.670 1.00 0.00 H ATOM 62753 H18T OL 1521 25.969 50.082 38.391 1.00 0.00 H TER 62754 OL 1521 ATOM 62754 C116 PA 1522 19.997 53.824 35.969 1.00 0.00 C ATOM 62755 H16R PA 1522 18.968 53.465 36.040 1.00 0.00 H ATOM 62756 H16S PA 1522 20.120 54.201 36.986 1.00 0.00 H ATOM 62757 H16T PA 1522 20.636 52.950 35.824 1.00 0.00 H ATOM 62758 C115 PA 1522 20.080 54.863 34.837 1.00 0.00 C ATOM 62759 H15R PA 1522 19.908 54.373 33.876 1.00 0.00 H ATOM 62760 H15S PA 1522 21.050 55.342 34.689 1.00 0.00 H ATOM 62761 C114 PA 1522 19.112 55.950 35.146 1.00 0.00 C ATOM 62762 H14R PA 1522 19.395 56.397 36.101 1.00 0.00 H ATOM 62763 H14S PA 1522 18.174 55.416 35.309 1.00 0.00 H ATOM 62764 C113 PA 1522 19.243 57.097 34.095 1.00 0.00 C ATOM 62765 H13R PA 1522 20.274 57.285 33.790 1.00 0.00 H ATOM 62766 H13S PA 1522 18.770 57.949 34.589 1.00 0.00 H ATOM 62767 C112 PA 1522 18.437 56.663 32.812 1.00 0.00 C ATOM 62768 H12R PA 1522 17.422 56.326 33.033 1.00 0.00 H ATOM 62769 H12S PA 1522 18.981 55.813 32.393 1.00 0.00 H ATOM 62770 C111 PA 1522 18.392 57.707 31.771 1.00 0.00 C ATOM 62771 H11R PA 1522 19.436 57.971 31.594 1.00 0.00 H ATOM 62772 H11S PA 1522 18.144 58.706 32.137 1.00 0.00 H ATOM 62773 C110 PA 1522 17.651 57.476 30.464 1.00 0.00 C ATOM 62774 H10R PA 1522 16.564 57.569 30.493 1.00 0.00 H ATOM 62775 H10S PA 1522 17.874 56.417 30.319 1.00 0.00 H ATOM 62776 C19 PA 1522 18.018 58.400 29.231 1.00 0.00 C ATOM 62777 H9R PA 1522 19.101 58.539 29.225 1.00 0.00 H ATOM 62778 H9S PA 1522 17.546 59.377 29.357 1.00 0.00 H ATOM 62779 C18 PA 1522 17.557 57.766 27.858 1.00 0.00 C ATOM 62780 H8R PA 1522 16.528 57.409 27.938 1.00 0.00 H ATOM 62781 H8S PA 1522 18.133 56.856 27.679 1.00 0.00 H ATOM 62782 C17 PA 1522 17.771 58.661 26.688 1.00 0.00 C ATOM 62783 H7R PA 1522 18.805 59.013 26.686 1.00 0.00 H ATOM 62784 H7S PA 1522 17.191 59.582 26.773 1.00 0.00 H ATOM 62785 C16 PA 1522 17.500 57.981 25.308 1.00 0.00 C ATOM 62786 H6R PA 1522 16.475 57.611 25.371 1.00 0.00 H ATOM 62787 H6S PA 1522 18.199 57.146 25.228 1.00 0.00 H ATOM 62788 C15 PA 1522 17.623 58.960 24.134 1.00 0.00 C ATOM 62789 H5R PA 1522 17.224 58.396 23.288 1.00 0.00 H ATOM 62790 H5S PA 1522 18.633 59.185 23.783 1.00 0.00 H ATOM 62791 C14 PA 1522 16.773 60.292 24.255 1.00 0.00 C ATOM 62792 H4R PA 1522 17.322 61.063 24.800 1.00 0.00 H ATOM 62793 H4S PA 1522 15.779 60.153 24.684 1.00 0.00 H ATOM 62794 C13 PA 1522 16.607 60.801 22.918 1.00 0.00 C ATOM 62795 H3R PA 1522 16.025 60.111 22.304 1.00 0.00 H ATOM 62796 H3S PA 1522 17.520 60.760 22.319 1.00 0.00 H ATOM 62797 C12 PA 1522 15.773 62.152 22.886 1.00 0.00 C ATOM 62798 H2R PA 1522 16.104 62.948 23.557 1.00 0.00 H ATOM 62799 H2S PA 1522 14.758 61.887 23.190 1.00 0.00 H ATOM 62800 C11 PGR 1523 15.623 62.643 21.482 1.00 0.00 C ATOM 62801 O12 PGR 1523 16.525 63.041 20.830 1.00 0.00 O ATOM 62802 O11 PGR 1523 14.377 62.595 21.125 1.00 0.00 O ATOM 62803 C1 PGR 1523 14.059 62.896 19.771 1.00 0.00 C ATOM 62804 HR PGR 1523 14.218 62.042 19.107 1.00 0.00 H ATOM 62805 HS PGR 1523 14.568 63.777 19.371 1.00 0.00 H ATOM 62806 C2 PGR 1523 12.576 63.201 19.653 1.00 0.00 C ATOM 62807 HX PGR 1523 12.006 62.710 20.447 1.00 0.00 H ATOM 62808 C3 PGR 1523 11.916 62.731 18.360 1.00 0.00 C ATOM 62809 HA PGR 1523 10.824 62.766 18.403 1.00 0.00 H ATOM 62810 HB PGR 1523 12.203 61.683 18.238 1.00 0.00 H ATOM 62811 O31 PGR 1523 12.478 63.599 17.417 1.00 0.00 O ATOM 62812 P31 PGR 1523 11.804 63.795 15.939 1.00 0.00 P ATOM 62813 O32 PGR 1523 11.074 65.163 16.126 1.00 0.00 O ATOM 62814 C31 PGR 1523 11.880 66.345 16.329 1.00 0.00 C ATOM 62815 H1A PGR 1523 12.429 66.527 15.401 1.00 0.00 H ATOM 62816 H1B PGR 1523 12.630 66.221 17.115 1.00 0.00 H ATOM 62817 C32 PGR 1523 11.114 67.625 16.614 1.00 0.00 C ATOM 62818 H2A PGR 1523 10.975 67.771 17.688 1.00 0.00 H ATOM 62819 O35 PGR 1523 9.818 67.420 15.925 1.00 0.00 O ATOM 62820 HO5A PGR 1523 9.583 66.616 16.422 1.00 0.00 H ATOM 62821 C33 PGR 1523 11.805 68.836 15.957 1.00 0.00 C ATOM 62822 H3A PGR 1523 11.299 69.783 16.161 1.00 0.00 H ATOM 62823 H3B PGR 1523 12.823 68.760 16.348 1.00 0.00 H ATOM 62824 O33 PGR 1523 12.824 63.949 14.787 1.00 0.00 O ATOM 62825 O34 PGR 1523 10.785 62.711 15.799 1.00 0.00 O ATOM 62826 O21 PGR 1523 12.563 64.622 19.934 1.00 0.00 O ATOM 62827 C21 PGR 1523 11.384 65.187 20.100 1.00 0.00 C ATOM 62828 O22 PGR 1523 10.357 64.566 20.304 1.00 0.00 O ATOM 62829 O36 PGR 1523 11.746 68.725 14.555 1.00 0.00 O ATOM 62830 HO6A PGR 1523 12.172 69.553 14.270 1.00 0.00 H ATOM 62831 C12 OL 1524 11.531 66.653 20.195 1.00 0.00 C ATOM 62832 H2R OL 1524 12.185 67.066 19.424 1.00 0.00 H ATOM 62833 H2S OL 1524 10.539 67.047 19.961 1.00 0.00 H ATOM 62834 C13 OL 1524 11.947 67.070 21.588 1.00 0.00 C ATOM 62835 H3R OL 1524 12.768 66.466 21.981 1.00 0.00 H ATOM 62836 H3S OL 1524 12.269 68.113 21.600 1.00 0.00 H ATOM 62837 C14 OL 1524 10.737 66.896 22.594 1.00 0.00 C ATOM 62838 H4R OL 1524 9.773 67.308 22.290 1.00 0.00 H ATOM 62839 H4S OL 1524 10.490 65.833 22.628 1.00 0.00 H ATOM 62840 C15 OL 1524 11.233 67.472 23.910 1.00 0.00 C ATOM 62841 H5R OL 1524 11.985 66.769 24.274 1.00 0.00 H ATOM 62842 H5S OL 1524 11.594 68.493 23.767 1.00 0.00 H ATOM 62843 C16 OL 1524 10.198 67.483 25.004 1.00 0.00 C ATOM 62844 H6R OL 1524 9.239 67.870 24.652 1.00 0.00 H ATOM 62845 H6S OL 1524 9.988 66.423 25.162 1.00 0.00 H ATOM 62846 C17 OL 1524 10.830 68.158 26.304 1.00 0.00 C ATOM 62847 H7R OL 1524 11.892 67.908 26.304 1.00 0.00 H ATOM 62848 H7S OL 1524 10.688 69.241 26.324 1.00 0.00 H ATOM 62849 C18 OL 1524 10.200 67.639 27.658 1.00 0.00 C ATOM 62850 H8R OL 1524 9.146 67.875 27.819 1.00 0.00 H ATOM 62851 H8S OL 1524 10.247 66.548 27.647 1.00 0.00 H ATOM 62852 C19 OL 1524 11.059 68.085 28.806 1.00 0.00 C ATOM 62853 H9R OL 1524 12.097 67.765 28.777 1.00 0.00 H ATOM 62854 C110 OL 1524 10.685 68.774 29.913 1.00 0.00 C ATOM 62855 H10R OL 1524 11.523 69.136 30.503 1.00 0.00 H ATOM 62856 C111 OL 1524 9.369 69.216 30.421 1.00 0.00 C ATOM 62857 H11R OL 1524 9.389 70.301 30.545 1.00 0.00 H ATOM 62858 H11S OL 1524 8.631 69.099 29.625 1.00 0.00 H ATOM 62859 C112 OL 1524 8.802 68.658 31.795 1.00 0.00 C ATOM 62860 H12R OL 1524 7.752 68.815 31.541 1.00 0.00 H ATOM 62861 H12S OL 1524 8.891 67.572 31.865 1.00 0.00 H ATOM 62862 C113 OL 1524 9.269 69.443 33.012 1.00 0.00 C ATOM 62863 H13R OL 1524 10.265 69.155 33.357 1.00 0.00 H ATOM 62864 H13S OL 1524 9.426 70.473 32.685 1.00 0.00 H ATOM 62865 C114 OL 1524 8.156 69.409 34.084 1.00 0.00 C ATOM 62866 H14R OL 1524 7.244 69.769 33.603 1.00 0.00 H ATOM 62867 H14S OL 1524 7.936 68.426 34.504 1.00 0.00 H ATOM 62868 C115 OL 1524 8.385 70.421 35.211 1.00 0.00 C ATOM 62869 H15R OL 1524 8.722 71.400 34.863 1.00 0.00 H ATOM 62870 H15S OL 1524 7.368 70.603 35.566 1.00 0.00 H ATOM 62871 C116 OL 1524 9.210 70.033 36.454 1.00 0.00 C ATOM 62872 H16R OL 1524 8.845 69.169 37.015 1.00 0.00 H ATOM 62873 H16S OL 1524 10.221 69.745 36.158 1.00 0.00 H ATOM 62874 C117 OL 1524 9.335 71.195 37.515 1.00 0.00 C ATOM 62875 H17R OL 1524 8.462 71.847 37.449 1.00 0.00 H ATOM 62876 H17S OL 1524 9.257 70.747 38.509 1.00 0.00 H ATOM 62877 C118 OL 1524 10.653 71.993 37.532 1.00 0.00 C ATOM 62878 H18R OL 1524 11.590 71.525 37.841 1.00 0.00 H ATOM 62879 H18S OL 1524 10.646 72.948 38.062 1.00 0.00 H ATOM 62880 H18T OL 1524 10.669 72.248 36.471 1.00 0.00 H TER 62881 OL 1524 ATOM 62881 C116 PA 1525 29.483 138.736 35.992 1.00 0.00 C ATOM 62882 H16R PA 1525 28.764 139.397 36.482 1.00 0.00 H ATOM 62883 H16S PA 1525 30.377 138.823 36.612 1.00 0.00 H ATOM 62884 H16T PA 1525 28.896 137.843 36.216 1.00 0.00 H ATOM 62885 C115 PA 1525 29.557 138.942 34.418 1.00 0.00 C ATOM 62886 H15R PA 1525 28.731 138.533 33.832 1.00 0.00 H ATOM 62887 H15S PA 1525 30.436 138.383 34.092 1.00 0.00 H ATOM 62888 C114 PA 1525 29.690 140.383 33.810 1.00 0.00 C ATOM 62889 H14R PA 1525 30.427 140.911 34.418 1.00 0.00 H ATOM 62890 H14S PA 1525 28.793 140.940 34.088 1.00 0.00 H ATOM 62891 C113 PA 1525 29.986 140.420 32.386 1.00 0.00 C ATOM 62892 H13R PA 1525 30.184 141.432 32.028 1.00 0.00 H ATOM 62893 H13S PA 1525 29.132 140.162 31.757 1.00 0.00 H ATOM 62894 C112 PA 1525 31.080 139.545 31.740 1.00 0.00 C ATOM 62895 H12R PA 1525 30.754 139.450 30.702 1.00 0.00 H ATOM 62896 H12S PA 1525 31.164 138.552 32.187 1.00 0.00 H ATOM 62897 C111 PA 1525 32.448 140.119 31.747 1.00 0.00 C ATOM 62898 H11R PA 1525 32.818 140.479 32.710 1.00 0.00 H ATOM 62899 H11S PA 1525 32.407 140.957 31.049 1.00 0.00 H ATOM 62900 C110 PA 1525 33.705 139.352 31.197 1.00 0.00 C ATOM 62901 H10R PA 1525 33.895 138.492 31.842 1.00 0.00 H ATOM 62902 H10S PA 1525 34.608 139.966 31.218 1.00 0.00 H ATOM 62903 C19 PA 1525 33.409 138.661 29.839 1.00 0.00 C ATOM 62904 H9R PA 1525 32.847 139.359 29.215 1.00 0.00 H ATOM 62905 H9S PA 1525 32.754 137.826 30.097 1.00 0.00 H ATOM 62906 C18 PA 1525 34.761 138.332 29.125 1.00 0.00 C ATOM 62907 H8R PA 1525 35.534 137.834 29.714 1.00 0.00 H ATOM 62908 H8S PA 1525 35.167 139.315 28.874 1.00 0.00 H ATOM 62909 C17 PA 1525 34.425 137.507 27.816 1.00 0.00 C ATOM 62910 H7R PA 1525 33.595 137.938 27.253 1.00 0.00 H ATOM 62911 H7S PA 1525 33.984 136.553 28.110 1.00 0.00 H ATOM 62912 C16 PA 1525 35.691 137.342 26.892 1.00 0.00 C ATOM 62913 H6R PA 1525 36.369 136.629 27.365 1.00 0.00 H ATOM 62914 H6S PA 1525 36.301 138.248 26.882 1.00 0.00 H ATOM 62915 C15 PA 1525 35.339 136.761 25.514 1.00 0.00 C ATOM 62916 H5R PA 1525 35.571 137.508 24.751 1.00 0.00 H ATOM 62917 H5S PA 1525 34.285 136.481 25.481 1.00 0.00 H ATOM 62918 C14 PA 1525 36.191 135.558 25.128 1.00 0.00 C ATOM 62919 H4R PA 1525 35.829 134.789 25.814 1.00 0.00 H ATOM 62920 H4S PA 1525 37.272 135.696 25.199 1.00 0.00 H ATOM 62921 C13 PA 1525 36.127 135.163 23.698 1.00 0.00 C ATOM 62922 H3R PA 1525 36.821 134.330 23.568 1.00 0.00 H ATOM 62923 H3S PA 1525 36.484 136.004 23.100 1.00 0.00 H ATOM 62924 C12 PA 1525 34.637 134.715 23.270 1.00 0.00 C ATOM 62925 H2R PA 1525 34.005 135.591 23.428 1.00 0.00 H ATOM 62926 H2S PA 1525 34.396 133.864 23.910 1.00 0.00 H ATOM 62927 C11 PGR 1526 34.491 134.182 21.879 1.00 0.00 C ATOM 62928 O12 PGR 1526 34.303 134.893 20.888 1.00 0.00 O ATOM 62929 O11 PGR 1526 34.424 132.825 21.908 1.00 0.00 O ATOM 62930 C1 PGR 1526 34.120 131.928 20.682 1.00 0.00 C ATOM 62931 HR PGR 1526 33.136 132.189 20.284 1.00 0.00 H ATOM 62932 HS PGR 1526 34.121 130.880 20.993 1.00 0.00 H ATOM 62933 C2 PGR 1526 35.143 132.220 19.571 1.00 0.00 C ATOM 62934 HX PGR 1526 35.196 133.287 19.338 1.00 0.00 H ATOM 62935 C3 PGR 1526 34.890 131.552 18.231 1.00 0.00 C ATOM 62936 HA PGR 1526 34.256 130.678 18.400 1.00 0.00 H ATOM 62937 HB PGR 1526 35.827 131.235 17.767 1.00 0.00 H ATOM 62938 O31 PGR 1526 34.297 132.443 17.299 1.00 0.00 O ATOM 62939 P31 PGR 1526 33.498 131.992 15.954 1.00 0.00 P ATOM 62940 O32 PGR 1526 32.041 131.522 16.479 1.00 0.00 O ATOM 62941 C31 PGR 1526 31.162 132.298 17.232 1.00 0.00 C ATOM 62942 H1A PGR 1526 30.778 133.081 16.574 1.00 0.00 H ATOM 62943 H1B PGR 1526 31.639 132.645 18.152 1.00 0.00 H ATOM 62944 C32 PGR 1526 29.985 131.397 17.637 1.00 0.00 C ATOM 62945 H2A PGR 1526 30.515 130.441 17.615 1.00 0.00 H ATOM 62946 O35 PGR 1526 28.876 131.486 16.726 1.00 0.00 O ATOM 62947 HO5A PGR 1526 28.270 130.763 16.966 1.00 0.00 H ATOM 62948 C33 PGR 1526 29.590 131.723 19.094 1.00 0.00 C ATOM 62949 H3A PGR 1526 28.750 131.058 19.313 1.00 0.00 H ATOM 62950 H3B PGR 1526 30.362 131.478 19.828 1.00 0.00 H ATOM 62951 O33 PGR 1526 33.305 133.163 15.066 1.00 0.00 O ATOM 62952 O34 PGR 1526 34.156 130.833 15.285 1.00 0.00 O ATOM 62953 O21 PGR 1526 36.454 131.751 20.009 1.00 0.00 O ATOM 62954 C21 PGR 1526 37.194 132.601 20.711 1.00 0.00 C ATOM 62955 O22 PGR 1526 37.128 133.802 20.849 1.00 0.00 O ATOM 62956 O36 PGR 1526 29.154 133.076 19.307 1.00 0.00 O ATOM 62957 HO6A PGR 1526 28.226 133.067 19.009 1.00 0.00 H ATOM 62958 C12 OL 1527 38.307 131.792 21.298 1.00 0.00 C ATOM 62959 H2R OL 1527 38.917 131.425 20.470 1.00 0.00 H ATOM 62960 H2S OL 1527 38.961 132.468 21.852 1.00 0.00 H ATOM 62961 C13 OL 1527 37.761 130.653 22.222 1.00 0.00 C ATOM 62962 H3R OL 1527 37.199 129.895 21.672 1.00 0.00 H ATOM 62963 H3S OL 1527 38.575 130.046 22.624 1.00 0.00 H ATOM 62964 C14 OL 1527 37.048 131.084 23.557 1.00 0.00 C ATOM 62965 H4R OL 1527 37.812 131.171 24.331 1.00 0.00 H ATOM 62966 H4S OL 1527 36.591 132.059 23.375 1.00 0.00 H ATOM 62967 C15 OL 1527 35.980 130.109 24.014 1.00 0.00 C ATOM 62968 H5R OL 1527 35.434 129.646 23.189 1.00 0.00 H ATOM 62969 H5S OL 1527 36.558 129.428 24.643 1.00 0.00 H ATOM 62970 C16 OL 1527 34.752 130.657 24.818 1.00 0.00 C ATOM 62971 H6R OL 1527 34.124 131.243 24.144 1.00 0.00 H ATOM 62972 H6S OL 1527 34.205 129.779 25.168 1.00 0.00 H ATOM 62973 C17 OL 1527 35.031 131.650 25.954 1.00 0.00 C ATOM 62974 H7R OL 1527 35.805 131.193 26.574 1.00 0.00 H ATOM 62975 H7S OL 1527 35.432 132.619 25.649 1.00 0.00 H ATOM 62976 C18 OL 1527 33.793 131.938 26.732 1.00 0.00 C ATOM 62977 H8R OL 1527 33.748 132.935 27.175 1.00 0.00 H ATOM 62978 H8S OL 1527 32.923 132.021 26.077 1.00 0.00 H ATOM 62979 C19 OL 1527 33.458 130.980 27.812 1.00 0.00 C ATOM 62980 H9R OL 1527 33.910 129.998 27.700 1.00 0.00 H ATOM 62981 C110 OL 1527 33.020 131.260 28.989 1.00 0.00 C ATOM 62982 H10R OL 1527 32.944 130.370 29.609 1.00 0.00 H ATOM 62983 C111 OL 1527 32.252 132.475 29.507 1.00 0.00 C ATOM 62984 H11R OL 1527 31.795 133.031 28.687 1.00 0.00 H ATOM 62985 H11S OL 1527 31.425 132.023 30.059 1.00 0.00 H ATOM 62986 C112 OL 1527 33.274 133.169 30.427 1.00 0.00 C ATOM 62987 H12R OL 1527 33.592 132.441 31.175 1.00 0.00 H ATOM 62988 H12S OL 1527 34.213 133.393 29.916 1.00 0.00 H ATOM 62989 C113 OL 1527 32.801 134.485 31.084 1.00 0.00 C ATOM 62990 H13R OL 1527 32.739 135.280 30.338 1.00 0.00 H ATOM 62991 H13S OL 1527 31.813 134.269 31.496 1.00 0.00 H ATOM 62992 C114 OL 1527 33.705 134.931 32.304 1.00 0.00 C ATOM 62993 H14R OL 1527 33.841 134.085 32.981 1.00 0.00 H ATOM 62994 H14S OL 1527 34.672 135.214 31.885 1.00 0.00 H ATOM 62995 C115 OL 1527 33.092 136.050 33.158 1.00 0.00 C ATOM 62996 H15R OL 1527 33.003 136.764 32.336 1.00 0.00 H ATOM 62997 H15S OL 1527 32.101 135.713 33.469 1.00 0.00 H ATOM 62998 C116 OL 1527 33.985 136.417 34.226 1.00 0.00 C ATOM 62999 H16R OL 1527 34.280 135.566 34.843 1.00 0.00 H ATOM 63000 H16S OL 1527 34.901 136.851 33.818 1.00 0.00 H ATOM 63001 C117 OL 1527 33.221 137.448 35.239 1.00 0.00 C ATOM 63002 H17R OL 1527 33.222 138.374 34.660 1.00 0.00 H ATOM 63003 H17S OL 1527 32.184 137.157 35.420 1.00 0.00 H ATOM 63004 C118 OL 1527 34.035 137.607 36.506 1.00 0.00 C ATOM 63005 H18R OL 1527 35.124 137.679 36.472 1.00 0.00 H ATOM 63006 H18S OL 1527 33.822 136.885 37.297 1.00 0.00 H ATOM 63007 H18T OL 1527 33.884 138.595 36.946 1.00 0.00 H TER 63008 OL 1527 ATOM 63008 C116 PA 1528 112.849 105.710 37.676 1.00 0.00 C ATOM 63009 H16R PA 1528 112.938 105.191 38.632 1.00 0.00 H ATOM 63010 H16S PA 1528 111.788 105.650 37.423 1.00 0.00 H ATOM 63011 H16T PA 1528 112.997 106.773 37.876 1.00 0.00 H ATOM 63012 C115 PA 1528 113.691 105.123 36.629 1.00 0.00 C ATOM 63013 H15R PA 1528 113.858 104.045 36.673 1.00 0.00 H ATOM 63014 H15S PA 1528 114.662 105.591 36.803 1.00 0.00 H ATOM 63015 C114 PA 1528 113.347 105.514 35.207 1.00 0.00 C ATOM 63016 H14R PA 1528 112.400 104.997 35.038 1.00 0.00 H ATOM 63017 H14S PA 1528 114.015 105.220 34.394 1.00 0.00 H ATOM 63018 C113 PA 1528 113.231 107.013 35.163 1.00 0.00 C ATOM 63019 H13R PA 1528 114.129 107.569 35.442 1.00 0.00 H ATOM 63020 H13S PA 1528 112.447 107.344 35.848 1.00 0.00 H ATOM 63021 C112 PA 1528 112.809 107.568 33.782 1.00 0.00 C ATOM 63022 H12R PA 1528 112.492 108.601 33.938 1.00 0.00 H ATOM 63023 H12S PA 1528 111.953 106.939 33.530 1.00 0.00 H ATOM 63024 C111 PA 1528 113.965 107.517 32.757 1.00 0.00 C ATOM 63025 H11R PA 1528 114.560 106.605 32.832 1.00 0.00 H ATOM 63026 H11S PA 1528 114.709 108.310 32.856 1.00 0.00 H ATOM 63027 C110 PA 1528 113.483 107.557 31.324 1.00 0.00 C ATOM 63028 H10R PA 1528 112.773 108.361 31.118 1.00 0.00 H ATOM 63029 H10S PA 1528 113.012 106.576 31.238 1.00 0.00 H ATOM 63030 C19 PA 1528 114.530 107.789 30.115 1.00 0.00 C ATOM 63031 H9R PA 1528 114.074 107.760 29.123 1.00 0.00 H ATOM 63032 H9S PA 1528 115.106 106.862 30.070 1.00 0.00 H ATOM 63033 C18 PA 1528 115.215 109.148 30.264 1.00 0.00 C ATOM 63034 H8R PA 1528 115.628 109.094 31.273 1.00 0.00 H ATOM 63035 H8S PA 1528 114.436 109.913 30.290 1.00 0.00 H ATOM 63036 C17 PA 1528 116.254 109.233 29.227 1.00 0.00 C ATOM 63037 H7R PA 1528 115.683 108.898 28.358 1.00 0.00 H ATOM 63038 H7S PA 1528 117.019 108.461 29.335 1.00 0.00 H ATOM 63039 C16 PA 1528 116.920 110.518 28.910 1.00 0.00 C ATOM 63040 H6R PA 1528 117.616 110.827 29.693 1.00 0.00 H ATOM 63041 H6S PA 1528 116.181 111.316 28.811 1.00 0.00 H ATOM 63042 C15 PA 1528 117.731 110.391 27.569 1.00 0.00 C ATOM 63043 H5R PA 1528 117.056 109.949 26.833 1.00 0.00 H ATOM 63044 H5S PA 1528 118.566 109.695 27.681 1.00 0.00 H ATOM 63045 C14 PA 1528 118.338 111.662 27.046 1.00 0.00 C ATOM 63046 H4R PA 1528 119.018 112.118 27.769 1.00 0.00 H ATOM 63047 H4S PA 1528 117.598 112.450 26.889 1.00 0.00 H ATOM 63048 C13 PA 1528 119.098 111.523 25.713 1.00 0.00 C ATOM 63049 H3R PA 1528 118.500 111.155 24.878 1.00 0.00 H ATOM 63050 H3S PA 1528 119.697 110.620 25.847 1.00 0.00 H ATOM 63051 C12 PA 1528 119.781 112.773 25.338 1.00 0.00 C ATOM 63052 H2R PA 1528 120.528 112.928 26.119 1.00 0.00 H ATOM 63053 H2S PA 1528 119.050 113.580 25.259 1.00 0.00 H ATOM 63054 C11 PC 1529 120.423 112.685 23.986 1.00 0.00 C ATOM 63055 O12 PC 1529 119.978 112.233 22.960 1.00 0.00 O ATOM 63056 O11 PC 1529 121.755 113.082 24.058 1.00 0.00 O ATOM 63057 C1 PC 1529 122.536 113.034 22.874 1.00 0.00 C ATOM 63058 HR PC 1529 122.543 112.017 22.472 1.00 0.00 H ATOM 63059 HS PC 1529 123.586 113.206 23.121 1.00 0.00 H ATOM 63060 C2 PC 1529 121.995 114.217 22.029 1.00 0.00 C ATOM 63061 HX PC 1529 120.936 114.046 21.819 1.00 0.00 H ATOM 63062 C3 PC 1529 122.810 114.415 20.663 1.00 0.00 C ATOM 63063 HA PC 1529 122.293 115.210 20.119 1.00 0.00 H ATOM 63064 HB PC 1529 122.783 113.513 20.047 1.00 0.00 H ATOM 63065 O31 PC 1529 124.161 114.854 20.851 1.00 0.00 O ATOM 63066 P31 PC 1529 125.096 115.134 19.561 1.00 0.00 P ATOM 63067 O32 PC 1529 125.813 113.806 19.194 1.00 0.00 O ATOM 63068 C31 PC 1529 126.717 113.242 20.132 1.00 0.00 C ATOM 63069 H1A PC 1529 126.275 113.343 21.127 1.00 0.00 H ATOM 63070 H1B PC 1529 127.685 113.686 19.889 1.00 0.00 H ATOM 63071 C32 PC 1529 126.811 111.712 19.693 1.00 0.00 C ATOM 63072 H2A PC 1529 127.043 111.706 18.627 1.00 0.00 H ATOM 63073 H2B PC 1529 125.855 111.196 19.786 1.00 0.00 H ATOM 63074 N31 PC 1529 127.772 110.846 20.449 1.00 0.00 N ATOM 63075 C33 PC 1529 129.138 111.427 20.295 1.00 0.00 C ATOM 63076 H3A PC 1529 129.106 111.917 19.321 1.00 0.00 H ATOM 63077 H3B PC 1529 129.892 110.642 20.215 1.00 0.00 H ATOM 63078 H3C PC 1529 129.296 112.043 21.181 1.00 0.00 H ATOM 63079 C34 PC 1529 127.375 110.744 21.850 1.00 0.00 C ATOM 63080 H4A PC 1529 127.442 111.665 22.431 1.00 0.00 H ATOM 63081 H4B PC 1529 127.997 109.964 22.290 1.00 0.00 H ATOM 63082 H4C PC 1529 126.305 110.528 21.842 1.00 0.00 H ATOM 63083 C35 PC 1529 127.789 109.482 19.891 1.00 0.00 C ATOM 63084 H5A PC 1529 128.426 108.874 20.535 1.00 0.00 H ATOM 63085 H5B PC 1529 128.080 109.543 18.841 1.00 0.00 H ATOM 63086 H5C PC 1529 126.793 109.061 20.037 1.00 0.00 H ATOM 63087 O33 PC 1529 124.208 115.519 18.469 1.00 0.00 O ATOM 63088 O34 PC 1529 126.162 116.016 19.989 1.00 0.00 O ATOM 63089 O21 PC 1529 122.053 115.443 22.759 1.00 0.00 O ATOM 63090 C21 PC 1529 121.002 116.033 23.384 1.00 0.00 C ATOM 63091 O22 PC 1529 119.891 115.516 23.480 1.00 0.00 O ATOM 63092 C12 OL 1530 121.392 117.291 24.129 1.00 0.00 C ATOM 63093 H2R OL 1530 122.429 117.564 23.923 1.00 0.00 H ATOM 63094 H2S OL 1530 120.823 118.165 23.804 1.00 0.00 H ATOM 63095 C13 OL 1530 121.131 117.003 25.607 1.00 0.00 C ATOM 63096 H3R OL 1530 120.055 116.908 25.767 1.00 0.00 H ATOM 63097 H3S OL 1530 121.405 115.996 25.928 1.00 0.00 H ATOM 63098 C14 OL 1530 121.762 117.952 26.513 1.00 0.00 C ATOM 63099 H4R OL 1530 122.847 117.834 26.512 1.00 0.00 H ATOM 63100 H4S OL 1530 121.684 119.022 26.309 1.00 0.00 H ATOM 63101 C15 OL 1530 121.231 117.912 27.919 1.00 0.00 C ATOM 63102 H5R OL 1530 120.144 118.016 27.916 1.00 0.00 H ATOM 63103 H5S OL 1530 121.344 116.870 28.228 1.00 0.00 H ATOM 63104 C16 OL 1530 121.966 118.877 28.819 1.00 0.00 C ATOM 63105 H6R OL 1530 122.846 118.291 29.094 1.00 0.00 H ATOM 63106 H6S OL 1530 122.346 119.780 28.335 1.00 0.00 H ATOM 63107 C17 OL 1530 121.289 119.230 30.090 1.00 0.00 C ATOM 63108 H7R OL 1530 120.278 119.573 29.860 1.00 0.00 H ATOM 63109 H7S OL 1530 121.322 118.367 30.759 1.00 0.00 H ATOM 63110 C18 OL 1530 122.085 120.306 30.927 1.00 0.00 C ATOM 63111 H8R OL 1530 123.053 119.842 31.130 1.00 0.00 H ATOM 63112 H8S OL 1530 122.464 121.136 30.326 1.00 0.00 H ATOM 63113 C19 OL 1530 121.403 120.806 32.184 1.00 0.00 C ATOM 63114 H9R OL 1530 120.593 121.522 32.074 1.00 0.00 H ATOM 63115 C110 OL 1530 121.812 120.472 33.399 1.00 0.00 C ATOM 63116 H10R OL 1530 121.251 120.895 34.228 1.00 0.00 H ATOM 63117 C111 OL 1530 123.106 119.764 33.744 1.00 0.00 C ATOM 63118 H11R OL 1530 123.821 120.021 32.959 1.00 0.00 H ATOM 63119 H11S OL 1530 123.396 120.041 34.759 1.00 0.00 H ATOM 63120 C112 OL 1530 122.990 118.246 33.820 1.00 0.00 C ATOM 63121 H12R OL 1530 123.271 117.894 32.825 1.00 0.00 H ATOM 63122 H12S OL 1530 123.758 117.927 34.528 1.00 0.00 H ATOM 63123 C113 OL 1530 121.645 117.579 34.116 1.00 0.00 C ATOM 63124 H13R OL 1530 120.984 117.894 33.307 1.00 0.00 H ATOM 63125 H13S OL 1530 121.754 116.523 33.860 1.00 0.00 H ATOM 63126 C114 OL 1530 121.142 117.787 35.559 1.00 0.00 C ATOM 63127 H14R OL 1530 121.466 117.029 36.275 1.00 0.00 H ATOM 63128 H14S OL 1530 121.640 118.701 35.890 1.00 0.00 H ATOM 63129 C115 OL 1530 119.638 118.054 35.660 1.00 0.00 C ATOM 63130 H15R OL 1530 119.154 118.374 36.584 1.00 0.00 H ATOM 63131 H15S OL 1530 119.337 118.882 35.015 1.00 0.00 H ATOM 63132 C116 OL 1530 118.798 116.781 35.439 1.00 0.00 C ATOM 63133 H16R OL 1530 118.791 116.445 34.400 1.00 0.00 H ATOM 63134 H16S OL 1530 119.087 115.886 35.994 1.00 0.00 H ATOM 63135 C117 OL 1530 117.294 117.033 35.887 1.00 0.00 C ATOM 63136 H17R OL 1530 117.335 117.295 36.947 1.00 0.00 H ATOM 63137 H17S OL 1530 116.923 117.850 35.266 1.00 0.00 H ATOM 63138 C118 OL 1530 116.439 115.778 35.847 1.00 0.00 C ATOM 63139 H18R OL 1530 115.509 115.949 36.393 1.00 0.00 H ATOM 63140 H18S OL 1530 116.906 114.929 36.350 1.00 0.00 H ATOM 63141 H18T OL 1530 116.213 115.532 34.807 1.00 0.00 H TER 63142 OL 1530 ATOM 63142 C116 PA 1531 107.685 4.213 37.923 1.00 0.00 C ATOM 63143 H16R PA 1531 108.344 3.345 37.848 1.00 0.00 H ATOM 63144 H16S PA 1531 107.257 4.329 36.926 1.00 0.00 H ATOM 63145 H16T PA 1531 106.931 3.853 38.626 1.00 0.00 H ATOM 63146 C115 PA 1531 108.337 5.544 38.470 1.00 0.00 C ATOM 63147 H15R PA 1531 109.358 5.608 38.089 1.00 0.00 H ATOM 63148 H15S PA 1531 108.417 5.401 39.550 1.00 0.00 H ATOM 63149 C114 PA 1531 107.523 6.778 38.160 1.00 0.00 C ATOM 63150 H14R PA 1531 107.999 7.664 38.588 1.00 0.00 H ATOM 63151 H14S PA 1531 106.574 6.710 38.696 1.00 0.00 H ATOM 63152 C113 PA 1531 107.320 7.071 36.661 1.00 0.00 C ATOM 63153 H13R PA 1531 106.607 7.882 36.497 1.00 0.00 H ATOM 63154 H13S PA 1531 106.829 6.224 36.176 1.00 0.00 H ATOM 63155 C112 PA 1531 108.559 7.333 35.849 1.00 0.00 C ATOM 63156 H12R PA 1531 109.179 6.436 35.902 1.00 0.00 H ATOM 63157 H12S PA 1531 109.124 8.081 36.409 1.00 0.00 H ATOM 63158 C111 PA 1531 108.178 7.689 34.373 1.00 0.00 C ATOM 63159 H11R PA 1531 107.516 8.531 34.586 1.00 0.00 H ATOM 63160 H11S PA 1531 107.616 6.844 33.969 1.00 0.00 H ATOM 63161 C110 PA 1531 109.282 7.945 33.391 1.00 0.00 C ATOM 63162 H10R PA 1531 109.879 7.034 33.313 1.00 0.00 H ATOM 63163 H10S PA 1531 110.040 8.669 33.700 1.00 0.00 H ATOM 63164 C19 PA 1531 108.715 8.401 32.058 1.00 0.00 C ATOM 63165 H9R PA 1531 109.572 8.438 31.381 1.00 0.00 H ATOM 63166 H9S PA 1531 108.379 9.438 32.109 1.00 0.00 H ATOM 63167 C18 PA 1531 107.677 7.479 31.399 1.00 0.00 C ATOM 63168 H8R PA 1531 106.763 7.423 31.994 1.00 0.00 H ATOM 63169 H8S PA 1531 108.128 6.495 31.545 1.00 0.00 H ATOM 63170 C17 PA 1531 107.374 7.811 29.922 1.00 0.00 C ATOM 63171 H7R PA 1531 108.254 8.065 29.328 1.00 0.00 H ATOM 63172 H7S PA 1531 106.842 8.759 30.029 1.00 0.00 H ATOM 63173 C16 PA 1531 106.491 6.806 29.233 1.00 0.00 C ATOM 63174 H6R PA 1531 105.613 6.633 29.859 1.00 0.00 H ATOM 63175 H6S PA 1531 106.972 5.827 29.182 1.00 0.00 H ATOM 63176 C15 PA 1531 105.987 7.327 27.857 1.00 0.00 C ATOM 63177 H5R PA 1531 106.799 7.687 27.222 1.00 0.00 H ATOM 63178 H5S PA 1531 105.306 8.152 28.075 1.00 0.00 H ATOM 63179 C14 PA 1531 105.118 6.368 27.059 1.00 0.00 C ATOM 63180 H4R PA 1531 104.788 6.793 26.109 1.00 0.00 H ATOM 63181 H4S PA 1531 104.260 6.171 27.705 1.00 0.00 H ATOM 63182 C13 PA 1531 105.717 4.928 26.917 1.00 0.00 C ATOM 63183 H3R PA 1531 105.448 4.299 27.768 1.00 0.00 H ATOM 63184 H3S PA 1531 106.808 4.981 26.919 1.00 0.00 H ATOM 63185 C12 PA 1531 105.180 4.323 25.588 1.00 0.00 C ATOM 63186 H2R PA 1531 104.095 4.337 25.465 1.00 0.00 H ATOM 63187 H2S PA 1531 105.392 3.253 25.636 1.00 0.00 H ATOM 63188 C11 PGR 1532 105.882 4.868 24.369 1.00 0.00 C ATOM 63189 O12 PGR 1532 105.470 4.774 23.247 1.00 0.00 O ATOM 63190 O11 PGR 1532 107.032 5.468 24.667 1.00 0.00 O ATOM 63191 C1 PGR 1532 107.696 6.202 23.610 1.00 0.00 C ATOM 63192 HR PGR 1532 107.851 5.529 22.763 1.00 0.00 H ATOM 63193 HS PGR 1532 108.721 6.411 23.928 1.00 0.00 H ATOM 63194 C2 PGR 1532 106.900 7.469 23.278 1.00 0.00 C ATOM 63195 HX PGR 1532 105.890 7.387 23.687 1.00 0.00 H ATOM 63196 C3 PGR 1532 106.856 7.655 21.804 1.00 0.00 C ATOM 63197 HA PGR 1532 106.535 8.661 21.520 1.00 0.00 H ATOM 63198 HB PGR 1532 106.252 6.802 21.486 1.00 0.00 H ATOM 63199 O31 PGR 1532 108.076 7.396 21.142 1.00 0.00 O ATOM 63200 P31 PGR 1532 108.278 7.851 19.583 1.00 0.00 P ATOM 63201 O32 PGR 1532 108.363 9.487 19.704 1.00 0.00 O ATOM 63202 C31 PGR 1532 108.523 10.280 18.554 1.00 0.00 C ATOM 63203 H1A PGR 1532 107.733 10.095 17.822 1.00 0.00 H ATOM 63204 H1B PGR 1532 109.495 10.106 18.086 1.00 0.00 H ATOM 63205 C32 PGR 1532 108.556 11.719 18.964 1.00 0.00 C ATOM 63206 H2A PGR 1532 108.870 11.836 20.004 1.00 0.00 H ATOM 63207 O35 PGR 1532 107.166 12.014 18.921 1.00 0.00 O ATOM 63208 HO5A PGR 1532 106.702 11.430 19.547 1.00 0.00 H ATOM 63209 C33 PGR 1532 109.363 12.516 17.966 1.00 0.00 C ATOM 63210 H3A PGR 1532 110.378 12.140 17.811 1.00 0.00 H ATOM 63211 H3B PGR 1532 108.912 12.503 16.970 1.00 0.00 H ATOM 63212 O33 PGR 1532 109.658 7.364 19.224 1.00 0.00 O ATOM 63213 O34 PGR 1532 107.149 7.448 18.734 1.00 0.00 O ATOM 63214 O21 PGR 1532 107.534 8.644 23.850 1.00 0.00 O ATOM 63215 C21 PGR 1532 106.877 9.860 23.844 1.00 0.00 C ATOM 63216 O22 PGR 1532 105.703 10.054 23.729 1.00 0.00 O ATOM 63217 O36 PGR 1532 109.529 13.831 18.557 1.00 0.00 O ATOM 63218 HO6A PGR 1532 110.021 14.406 17.943 1.00 0.00 H ATOM 63219 C12 OL 1533 107.799 11.063 23.922 1.00 0.00 C ATOM 63220 H2R OL 1533 108.762 10.764 23.503 1.00 0.00 H ATOM 63221 H2S OL 1533 107.421 11.829 23.242 1.00 0.00 H ATOM 63222 C13 OL 1533 107.836 11.654 25.347 1.00 0.00 C ATOM 63223 H3R OL 1533 108.570 12.461 25.310 1.00 0.00 H ATOM 63224 H3S OL 1533 106.836 12.052 25.535 1.00 0.00 H ATOM 63225 C14 OL 1533 108.355 10.748 26.399 1.00 0.00 C ATOM 63226 H4R OL 1533 107.646 9.919 26.437 1.00 0.00 H ATOM 63227 H4S OL 1533 109.308 10.388 26.005 1.00 0.00 H ATOM 63228 C15 OL 1533 108.669 11.307 27.838 1.00 0.00 C ATOM 63229 H5R OL 1533 109.179 10.473 28.324 1.00 0.00 H ATOM 63230 H5S OL 1533 109.413 12.107 27.814 1.00 0.00 H ATOM 63231 C16 OL 1533 107.423 11.741 28.634 1.00 0.00 C ATOM 63232 H6R OL 1533 106.911 12.498 28.037 1.00 0.00 H ATOM 63233 H6S OL 1533 106.729 10.897 28.638 1.00 0.00 H ATOM 63234 C17 OL 1533 107.583 12.220 30.112 1.00 0.00 C ATOM 63235 H7R OL 1533 106.613 11.961 30.541 1.00 0.00 H ATOM 63236 H7S OL 1533 108.436 11.709 30.565 1.00 0.00 H ATOM 63237 C18 OL 1533 107.766 13.775 30.159 1.00 0.00 C ATOM 63238 H8R OL 1533 108.487 14.049 29.386 1.00 0.00 H ATOM 63239 H8S OL 1533 106.850 14.295 29.873 1.00 0.00 H ATOM 63240 C19 OL 1533 108.345 14.230 31.486 1.00 0.00 C ATOM 63241 H9R OL 1533 109.388 14.497 31.342 1.00 0.00 H ATOM 63242 C110 OL 1533 107.704 14.303 32.618 1.00 0.00 C ATOM 63243 H10R OL 1533 108.233 14.637 33.507 1.00 0.00 H ATOM 63244 C111 OL 1533 106.251 14.017 32.832 1.00 0.00 C ATOM 63245 H11R OL 1533 105.611 14.878 32.628 1.00 0.00 H ATOM 63246 H11S OL 1533 105.916 13.234 32.148 1.00 0.00 H ATOM 63247 C112 OL 1533 105.937 13.297 34.140 1.00 0.00 C ATOM 63248 H12R OL 1533 104.917 12.911 34.083 1.00 0.00 H ATOM 63249 H12S OL 1533 106.625 12.467 34.310 1.00 0.00 H ATOM 63250 C113 OL 1533 105.947 14.226 35.427 1.00 0.00 C ATOM 63251 H13R OL 1533 105.573 13.539 36.188 1.00 0.00 H ATOM 63252 H13S OL 1533 107.000 14.482 35.563 1.00 0.00 H ATOM 63253 C114 OL 1533 105.180 15.528 35.313 1.00 0.00 C ATOM 63254 H14R OL 1533 105.288 16.075 34.374 1.00 0.00 H ATOM 63255 H14S OL 1533 104.112 15.306 35.275 1.00 0.00 H ATOM 63256 C115 OL 1533 105.424 16.405 36.624 1.00 0.00 C ATOM 63257 H15R OL 1533 105.104 15.834 37.498 1.00 0.00 H ATOM 63258 H15S OL 1533 106.456 16.615 36.912 1.00 0.00 H ATOM 63259 C116 OL 1533 104.753 17.828 36.519 1.00 0.00 C ATOM 63260 H16R OL 1533 105.047 18.439 37.376 1.00 0.00 H ATOM 63261 H16S OL 1533 105.136 18.358 35.645 1.00 0.00 H ATOM 63262 C117 OL 1533 103.267 17.809 36.263 1.00 0.00 C ATOM 63263 H17R OL 1533 103.039 18.872 36.368 1.00 0.00 H ATOM 63264 H17S OL 1533 103.068 17.595 35.210 1.00 0.00 H ATOM 63265 C118 OL 1533 102.413 16.884 37.141 1.00 0.00 C ATOM 63266 H18R OL 1533 101.471 16.666 36.634 1.00 0.00 H ATOM 63267 H18S OL 1533 101.999 17.421 37.997 1.00 0.00 H ATOM 63268 H18T OL 1533 102.868 15.968 37.523 1.00 0.00 H TER 63269 OL 1533 ATOM 63269 C116 PA 1534 149.570 113.434 41.767 1.00 0.00 C ATOM 63270 H16R PA 1534 149.238 112.681 42.485 1.00 0.00 H ATOM 63271 H16S PA 1534 148.890 113.341 40.918 1.00 0.00 H ATOM 63272 H16T PA 1534 149.462 114.434 42.191 1.00 0.00 H ATOM 63273 C115 PA 1534 151.063 113.363 41.373 1.00 0.00 C ATOM 63274 H15R PA 1534 151.104 112.499 40.707 1.00 0.00 H ATOM 63275 H15S PA 1534 151.654 113.188 42.274 1.00 0.00 H ATOM 63276 C114 PA 1534 151.530 114.647 40.708 1.00 0.00 C ATOM 63277 H14R PA 1534 152.622 114.664 40.679 1.00 0.00 H ATOM 63278 H14S PA 1534 151.244 115.581 41.196 1.00 0.00 H ATOM 63279 C113 PA 1534 151.052 114.698 39.199 1.00 0.00 C ATOM 63280 H13R PA 1534 150.913 115.733 38.879 1.00 0.00 H ATOM 63281 H13S PA 1534 150.051 114.266 39.132 1.00 0.00 H ATOM 63282 C112 PA 1534 151.978 114.040 38.174 1.00 0.00 C ATOM 63283 H12R PA 1534 152.149 113.052 38.606 1.00 0.00 H ATOM 63284 H12S PA 1534 152.998 114.431 38.175 1.00 0.00 H ATOM 63285 C111 PA 1534 151.482 114.003 36.713 1.00 0.00 C ATOM 63286 H11R PA 1534 150.644 113.307 36.647 1.00 0.00 H ATOM 63287 H11S PA 1534 152.384 113.534 36.314 1.00 0.00 H ATOM 63288 C110 PA 1534 151.264 115.242 35.866 1.00 0.00 C ATOM 63289 H10R PA 1534 152.265 115.657 36.005 1.00 0.00 H ATOM 63290 H10S PA 1534 150.548 115.938 36.308 1.00 0.00 H ATOM 63291 C19 PA 1534 150.890 114.901 34.457 1.00 0.00 C ATOM 63292 H9R PA 1534 149.888 114.467 34.425 1.00 0.00 H ATOM 63293 H9S PA 1534 151.560 114.131 34.068 1.00 0.00 H ATOM 63294 C18 PA 1534 150.810 115.984 33.445 1.00 0.00 C ATOM 63295 H8R PA 1534 150.425 116.852 33.985 1.00 0.00 H ATOM 63296 H8S PA 1534 150.020 115.758 32.726 1.00 0.00 H ATOM 63297 C17 PA 1534 152.115 116.353 32.751 1.00 0.00 C ATOM 63298 H7R PA 1534 152.498 115.548 32.120 1.00 0.00 H ATOM 63299 H7S PA 1534 152.729 116.397 33.653 1.00 0.00 H ATOM 63300 C16 PA 1534 152.232 117.681 32.156 1.00 0.00 C ATOM 63301 H6R PA 1534 153.295 117.928 32.108 1.00 0.00 H ATOM 63302 H6S PA 1534 151.844 118.457 32.819 1.00 0.00 H ATOM 63303 C15 PA 1534 151.615 117.760 30.780 1.00 0.00 C ATOM 63304 H5R PA 1534 150.537 117.627 30.894 1.00 0.00 H ATOM 63305 H5S PA 1534 151.968 116.948 30.140 1.00 0.00 H ATOM 63306 C14 PA 1534 151.952 119.070 30.115 1.00 0.00 C ATOM 63307 H4R PA 1534 153.025 119.264 30.046 1.00 0.00 H ATOM 63308 H4S PA 1534 151.575 119.795 30.840 1.00 0.00 H ATOM 63309 C13 PA 1534 151.275 119.358 28.797 1.00 0.00 C ATOM 63310 H3R PA 1534 151.576 120.350 28.456 1.00 0.00 H ATOM 63311 H3S PA 1534 150.183 119.354 28.826 1.00 0.00 H ATOM 63312 C12 PA 1534 151.524 118.439 27.605 1.00 0.00 C ATOM 63313 H2R PA 1534 151.787 117.397 27.802 1.00 0.00 H ATOM 63314 H2S PA 1534 152.387 118.959 27.186 1.00 0.00 H ATOM 63315 C11 PC 1535 150.404 118.618 26.556 1.00 0.00 C ATOM 63316 O12 PC 1535 150.347 119.650 25.825 1.00 0.00 O ATOM 63317 O11 PC 1535 149.484 117.671 26.520 1.00 0.00 O ATOM 63318 C1 PC 1535 148.411 117.721 25.606 1.00 0.00 C ATOM 63319 HR PC 1535 148.793 117.837 24.588 1.00 0.00 H ATOM 63320 HS PC 1535 147.808 118.596 25.862 1.00 0.00 H ATOM 63321 C2 PC 1535 147.494 116.523 25.756 1.00 0.00 C ATOM 63322 HX PC 1535 148.080 115.705 26.182 1.00 0.00 H ATOM 63323 C3 PC 1535 146.900 116.011 24.490 1.00 0.00 C ATOM 63324 HA PC 1535 146.227 115.179 24.715 1.00 0.00 H ATOM 63325 HB PC 1535 147.662 115.574 23.840 1.00 0.00 H ATOM 63326 O31 PC 1535 146.278 117.004 23.676 1.00 0.00 O ATOM 63327 P31 PC 1535 145.732 116.634 22.192 1.00 0.00 P ATOM 63328 O32 PC 1535 145.185 118.085 21.779 1.00 0.00 O ATOM 63329 C31 PC 1535 146.064 119.194 21.684 1.00 0.00 C ATOM 63330 H1A PC 1535 146.946 118.890 21.115 1.00 0.00 H ATOM 63331 H1B PC 1535 146.327 119.668 22.634 1.00 0.00 H ATOM 63332 C32 PC 1535 145.359 120.184 20.836 1.00 0.00 C ATOM 63333 H2A PC 1535 145.827 121.155 21.000 1.00 0.00 H ATOM 63334 H2B PC 1535 144.325 120.088 21.172 1.00 0.00 H ATOM 63335 N31 PC 1535 145.282 120.045 19.355 1.00 0.00 N ATOM 63336 C33 PC 1535 144.683 118.739 18.989 1.00 0.00 C ATOM 63337 H3A PC 1535 145.160 117.861 19.427 1.00 0.00 H ATOM 63338 H3B PC 1535 144.641 118.596 17.908 1.00 0.00 H ATOM 63339 H3C PC 1535 143.673 118.662 19.395 1.00 0.00 H ATOM 63340 C34 PC 1535 144.385 121.107 18.851 1.00 0.00 C ATOM 63341 H4A PC 1535 143.601 121.274 19.592 1.00 0.00 H ATOM 63342 H4B PC 1535 143.927 120.834 17.900 1.00 0.00 H ATOM 63343 H4C PC 1535 145.143 121.891 18.818 1.00 0.00 H ATOM 63344 C35 PC 1535 146.749 120.246 18.876 1.00 0.00 C ATOM 63345 H5A PC 1535 147.215 121.214 19.066 1.00 0.00 H ATOM 63346 H5B PC 1535 146.702 120.005 17.813 1.00 0.00 H ATOM 63347 H5C PC 1535 147.331 119.500 19.419 1.00 0.00 H ATOM 63348 O33 PC 1535 146.887 116.193 21.384 1.00 0.00 O ATOM 63349 O34 PC 1535 144.541 115.781 22.324 1.00 0.00 O ATOM 63350 O21 PC 1535 146.504 116.989 26.650 1.00 0.00 O ATOM 63351 C21 PC 1535 145.652 116.172 27.276 1.00 0.00 C ATOM 63352 O22 PC 1535 145.783 114.940 27.386 1.00 0.00 O ATOM 63353 C12 OL 1536 144.625 117.011 27.969 1.00 0.00 C ATOM 63354 H2R OL 1536 144.477 117.985 27.498 1.00 0.00 H ATOM 63355 H2S OL 1536 143.659 116.521 27.827 1.00 0.00 H ATOM 63356 C13 OL 1536 144.868 117.174 29.508 1.00 0.00 C ATOM 63357 H3R OL 1536 144.843 116.210 30.021 1.00 0.00 H ATOM 63358 H3S OL 1536 145.884 117.559 29.615 1.00 0.00 H ATOM 63359 C14 OL 1536 143.723 118.063 30.032 1.00 0.00 C ATOM 63360 H4R OL 1536 143.566 118.929 29.386 1.00 0.00 H ATOM 63361 H4S OL 1536 142.792 117.493 30.043 1.00 0.00 H ATOM 63362 C15 OL 1536 143.772 118.289 31.517 1.00 0.00 C ATOM 63363 H5R OL 1536 143.908 117.355 32.067 1.00 0.00 H ATOM 63364 H5S OL 1536 144.738 118.764 31.701 1.00 0.00 H ATOM 63365 C16 OL 1536 142.678 119.242 32.042 1.00 0.00 C ATOM 63366 H6R OL 1536 142.792 120.217 31.565 1.00 0.00 H ATOM 63367 H6S OL 1536 141.708 118.833 31.752 1.00 0.00 H ATOM 63368 C17 OL 1536 142.704 119.490 33.573 1.00 0.00 C ATOM 63369 H7R OL 1536 142.305 118.579 34.022 1.00 0.00 H ATOM 63370 H7S OL 1536 143.699 119.706 33.968 1.00 0.00 H ATOM 63371 C18 OL 1536 141.791 120.677 34.029 1.00 0.00 C ATOM 63372 H8R OL 1536 142.389 121.590 33.992 1.00 0.00 H ATOM 63373 H8S OL 1536 141.023 120.729 33.254 1.00 0.00 H ATOM 63374 C19 OL 1536 141.032 120.505 35.311 1.00 0.00 C ATOM 63375 H9R OL 1536 141.507 120.958 36.177 1.00 0.00 H ATOM 63376 C110 OL 1536 139.893 119.928 35.551 1.00 0.00 C ATOM 63377 H10R OL 1536 139.552 119.785 36.573 1.00 0.00 H ATOM 63378 C111 OL 1536 139.134 119.114 34.483 1.00 0.00 C ATOM 63379 H11R OL 1536 139.256 119.601 33.513 1.00 0.00 H ATOM 63380 H11S OL 1536 139.543 118.110 34.351 1.00 0.00 H ATOM 63381 C112 OL 1536 137.618 118.971 34.835 1.00 0.00 C ATOM 63382 H12R OL 1536 137.387 119.924 35.316 1.00 0.00 H ATOM 63383 H12S OL 1536 137.055 118.889 33.903 1.00 0.00 H ATOM 63384 C113 OL 1536 137.325 117.814 35.807 1.00 0.00 C ATOM 63385 H13R OL 1536 137.797 116.916 35.403 1.00 0.00 H ATOM 63386 H13S OL 1536 137.853 118.011 36.742 1.00 0.00 H ATOM 63387 C114 OL 1536 135.757 117.676 35.866 1.00 0.00 C ATOM 63388 H14R OL 1536 135.414 118.619 36.297 1.00 0.00 H ATOM 63389 H14S OL 1536 135.298 117.575 34.881 1.00 0.00 H ATOM 63390 C115 OL 1536 135.247 116.482 36.708 1.00 0.00 C ATOM 63391 H15R OL 1536 135.528 115.506 36.307 1.00 0.00 H ATOM 63392 H15S OL 1536 135.834 116.486 37.629 1.00 0.00 H ATOM 63393 C116 OL 1536 133.783 116.622 37.053 1.00 0.00 C ATOM 63394 H16R OL 1536 133.634 115.991 37.932 1.00 0.00 H ATOM 63395 H16S OL 1536 133.488 117.639 37.321 1.00 0.00 H ATOM 63396 C117 OL 1536 132.895 115.971 36.048 1.00 0.00 C ATOM 63397 H17R OL 1536 133.038 116.508 35.108 1.00 0.00 H ATOM 63398 H17S OL 1536 133.365 115.038 35.731 1.00 0.00 H ATOM 63399 C118 OL 1536 131.499 115.774 36.543 1.00 0.00 C ATOM 63400 H18R OL 1536 130.953 116.641 36.921 1.00 0.00 H ATOM 63401 H18S OL 1536 131.424 115.055 37.361 1.00 0.00 H ATOM 63402 H18T OL 1536 130.905 115.382 35.715 1.00 0.00 H TER 63403 OL 1536 ATOM 63403 C116 PA 1537 0.668 55.445 41.766 1.00 0.00 C ATOM 63404 H16R PA 1537 -0.206 54.791 41.774 1.00 0.00 H ATOM 63405 H16S PA 1537 0.318 55.917 42.686 1.00 0.00 H ATOM 63406 H16T PA 1537 1.627 54.939 41.894 1.00 0.00 H ATOM 63407 C115 PA 1537 0.532 56.457 40.602 1.00 0.00 C ATOM 63408 H15R PA 1537 1.215 57.244 40.930 1.00 0.00 H ATOM 63409 H15S PA 1537 -0.467 56.849 40.805 1.00 0.00 H ATOM 63410 C114 PA 1537 0.699 55.827 39.266 1.00 0.00 C ATOM 63411 H14R PA 1537 -0.196 55.238 39.058 1.00 0.00 H ATOM 63412 H14S PA 1537 1.578 55.179 39.251 1.00 0.00 H ATOM 63413 C113 PA 1537 0.896 56.894 38.074 1.00 0.00 C ATOM 63414 H13R PA 1537 1.778 57.517 38.236 1.00 0.00 H ATOM 63415 H13S PA 1537 0.061 57.597 38.050 1.00 0.00 H ATOM 63416 C112 PA 1537 1.226 56.362 36.657 1.00 0.00 C ATOM 63417 H12R PA 1537 2.126 55.745 36.694 1.00 0.00 H ATOM 63418 H12S PA 1537 1.315 57.223 35.991 1.00 0.00 H ATOM 63419 C111 PA 1537 0.046 55.487 36.138 1.00 0.00 C ATOM 63420 H11R PA 1537 -0.903 56.027 36.163 1.00 0.00 H ATOM 63421 H11S PA 1537 -0.180 54.657 36.811 1.00 0.00 H ATOM 63422 C110 PA 1537 0.207 55.170 34.730 1.00 0.00 C ATOM 63423 H10R PA 1537 -0.654 54.517 34.574 1.00 0.00 H ATOM 63424 H10S PA 1537 1.156 54.633 34.682 1.00 0.00 H ATOM 63425 C19 PA 1537 0.302 56.363 33.765 1.00 0.00 C ATOM 63426 H9R PA 1537 1.312 56.761 33.651 1.00 0.00 H ATOM 63427 H9S PA 1537 -0.382 57.164 34.051 1.00 0.00 H ATOM 63428 C18 PA 1537 -0.102 55.843 32.341 1.00 0.00 C ATOM 63429 H8R PA 1537 -1.191 55.883 32.269 1.00 0.00 H ATOM 63430 H8S PA 1537 -0.024 54.773 32.141 1.00 0.00 H ATOM 63431 C17 PA 1537 0.669 56.711 31.322 1.00 0.00 C ATOM 63432 H7R PA 1537 1.733 56.617 31.551 1.00 0.00 H ATOM 63433 H7S PA 1537 0.361 57.744 31.498 1.00 0.00 H ATOM 63434 C16 PA 1537 0.666 56.221 29.877 1.00 0.00 C ATOM 63435 H6R PA 1537 0.551 55.142 30.004 1.00 0.00 H ATOM 63436 H6S PA 1537 1.606 56.446 29.369 1.00 0.00 H ATOM 63437 C15 PA 1537 -0.614 56.674 29.146 1.00 0.00 C ATOM 63438 H5R PA 1537 -0.766 57.754 29.206 1.00 0.00 H ATOM 63439 H5S PA 1537 -1.524 56.342 29.650 1.00 0.00 H ATOM 63440 C14 PA 1537 -0.605 56.256 27.729 1.00 0.00 C ATOM 63441 H4R PA 1537 -0.591 55.165 27.757 1.00 0.00 H ATOM 63442 H4S PA 1537 0.291 56.617 27.219 1.00 0.00 H ATOM 63443 C13 PA 1537 -1.853 56.608 26.971 1.00 0.00 C ATOM 63444 H3R PA 1537 -1.929 57.697 26.980 1.00 0.00 H ATOM 63445 H3S PA 1537 -2.794 56.312 27.440 1.00 0.00 H ATOM 63446 C12 PA 1537 -1.868 56.052 25.563 1.00 0.00 C ATOM 63447 H2R PA 1537 -2.874 56.004 25.141 1.00 0.00 H ATOM 63448 H2S PA 1537 -1.460 55.039 25.575 1.00 0.00 H ATOM 63449 C11 PGR 1538 -1.053 56.864 24.593 1.00 0.00 C ATOM 63450 O12 PGR 1538 -1.416 57.908 24.080 1.00 0.00 O ATOM 63451 O11 PGR 1538 0.198 56.330 24.428 1.00 0.00 O ATOM 63452 C1 PGR 1538 1.019 56.776 23.318 1.00 0.00 C ATOM 63453 HR PGR 1538 0.494 56.813 22.360 1.00 0.00 H ATOM 63454 HS PGR 1538 1.721 55.953 23.162 1.00 0.00 H ATOM 63455 C2 PGR 1538 1.682 58.119 23.727 1.00 0.00 C ATOM 63456 HX PGR 1538 1.143 58.663 24.506 1.00 0.00 H ATOM 63457 C3 PGR 1538 1.698 59.105 22.481 1.00 0.00 C ATOM 63458 HA PGR 1538 1.982 60.091 22.858 1.00 0.00 H ATOM 63459 HB PGR 1538 0.680 59.256 22.112 1.00 0.00 H ATOM 63460 O31 PGR 1538 2.528 58.655 21.479 1.00 0.00 O ATOM 63461 P31 PGR 1538 2.924 59.661 20.246 1.00 0.00 P ATOM 63462 O32 PGR 1538 1.521 59.841 19.490 1.00 0.00 O ATOM 63463 C31 PGR 1538 1.044 58.899 18.546 1.00 0.00 C ATOM 63464 H1A PGR 1538 1.177 57.902 18.973 1.00 0.00 H ATOM 63465 H1B PGR 1538 1.663 58.919 17.644 1.00 0.00 H ATOM 63466 C32 PGR 1538 -0.475 59.188 18.158 1.00 0.00 C ATOM 63467 H2A PGR 1538 -0.753 58.570 17.300 1.00 0.00 H ATOM 63468 O35 PGR 1538 -0.471 60.585 17.812 1.00 0.00 O ATOM 63469 HO5A PGR 1538 0.139 60.732 17.067 1.00 0.00 H ATOM 63470 C33 PGR 1538 -1.524 58.846 19.231 1.00 0.00 C ATOM 63471 H3A PGR 1538 -2.549 58.877 18.855 1.00 0.00 H ATOM 63472 H3B PGR 1538 -1.219 57.931 19.747 1.00 0.00 H ATOM 63473 O33 PGR 1538 3.425 60.919 20.895 1.00 0.00 O ATOM 63474 O34 PGR 1538 3.800 58.895 19.297 1.00 0.00 O ATOM 63475 O21 PGR 1538 2.974 57.847 24.243 1.00 0.00 O ATOM 63476 C21 PGR 1538 3.488 58.797 24.938 1.00 0.00 C ATOM 63477 O22 PGR 1538 2.924 59.867 25.200 1.00 0.00 O ATOM 63478 O36 PGR 1538 -1.559 59.867 20.230 1.00 0.00 O ATOM 63479 HO6A PGR 1538 -1.956 59.409 20.993 1.00 0.00 H ATOM 63480 C12 OL 1539 4.912 58.446 25.431 1.00 0.00 C ATOM 63481 H2R OL 1539 5.515 58.234 24.546 1.00 0.00 H ATOM 63482 H2S OL 1539 5.302 59.363 25.878 1.00 0.00 H ATOM 63483 C13 OL 1539 4.866 57.221 26.377 1.00 0.00 C ATOM 63484 H3R OL 1539 4.822 56.367 25.698 1.00 0.00 H ATOM 63485 H3S OL 1539 5.839 57.124 26.862 1.00 0.00 H ATOM 63486 C14 OL 1539 3.781 57.138 27.403 1.00 0.00 C ATOM 63487 H4R OL 1539 2.814 56.885 26.963 1.00 0.00 H ATOM 63488 H4S OL 1539 4.018 56.271 28.023 1.00 0.00 H ATOM 63489 C15 OL 1539 3.638 58.415 28.304 1.00 0.00 C ATOM 63490 H5R OL 1539 3.635 59.348 27.737 1.00 0.00 H ATOM 63491 H5S OL 1539 2.759 58.385 28.951 1.00 0.00 H ATOM 63492 C16 OL 1539 4.792 58.521 29.353 1.00 0.00 C ATOM 63493 H6R OL 1539 5.068 57.524 29.701 1.00 0.00 H ATOM 63494 H6S OL 1539 5.763 58.793 28.935 1.00 0.00 H ATOM 63495 C17 OL 1539 4.421 59.260 30.687 1.00 0.00 C ATOM 63496 H7R OL 1539 4.049 60.242 30.387 1.00 0.00 H ATOM 63497 H7S OL 1539 3.586 58.769 31.192 1.00 0.00 H ATOM 63498 C18 OL 1539 5.529 59.405 31.712 1.00 0.00 C ATOM 63499 H8R OL 1539 6.150 58.520 31.861 1.00 0.00 H ATOM 63500 H8S OL 1539 6.226 60.163 31.350 1.00 0.00 H ATOM 63501 C19 OL 1539 5.118 59.743 33.136 1.00 0.00 C ATOM 63502 H9R OL 1539 4.053 59.707 33.350 1.00 0.00 H ATOM 63503 C110 OL 1539 5.875 60.382 34.054 1.00 0.00 C ATOM 63504 H10R OL 1539 5.380 60.856 34.897 1.00 0.00 H ATOM 63505 C111 OL 1539 7.394 60.798 33.981 1.00 0.00 C ATOM 63506 H11R OL 1539 7.775 60.234 34.835 1.00 0.00 H ATOM 63507 H11S OL 1539 7.795 60.388 33.052 1.00 0.00 H ATOM 63508 C112 OL 1539 7.525 62.311 34.045 1.00 0.00 C ATOM 63509 H12R OL 1539 7.079 62.822 33.189 1.00 0.00 H ATOM 63510 H12S OL 1539 7.083 62.849 34.887 1.00 0.00 H ATOM 63511 C113 OL 1539 8.929 62.861 33.955 1.00 0.00 C ATOM 63512 H13R OL 1539 9.592 62.326 33.272 1.00 0.00 H ATOM 63513 H13S OL 1539 8.901 63.885 33.577 1.00 0.00 H ATOM 63514 C114 OL 1539 9.689 62.824 35.398 1.00 0.00 C ATOM 63515 H14R OL 1539 9.433 63.672 36.037 1.00 0.00 H ATOM 63516 H14S OL 1539 9.382 61.897 35.887 1.00 0.00 H ATOM 63517 C115 OL 1539 11.216 62.713 35.245 1.00 0.00 C ATOM 63518 H15R OL 1539 11.490 62.140 34.356 1.00 0.00 H ATOM 63519 H15S OL 1539 11.444 63.764 35.058 1.00 0.00 H ATOM 63520 C116 OL 1539 11.971 62.223 36.473 1.00 0.00 C ATOM 63521 H16R OL 1539 13.008 62.018 36.198 1.00 0.00 H ATOM 63522 H16S OL 1539 12.063 62.958 37.275 1.00 0.00 H ATOM 63523 C117 OL 1539 11.441 60.987 37.087 1.00 0.00 C ATOM 63524 H17R OL 1539 10.555 61.235 37.674 1.00 0.00 H ATOM 63525 H17S OL 1539 11.234 60.198 36.361 1.00 0.00 H ATOM 63526 C118 OL 1539 12.466 60.411 38.081 1.00 0.00 C ATOM 63527 H18R OL 1539 12.929 61.208 38.666 1.00 0.00 H ATOM 63528 H18S OL 1539 13.342 60.101 37.507 1.00 0.00 H ATOM 63529 H18T OL 1539 12.168 59.548 38.680 1.00 0.00 H TER 63530 OL 1539 ATOM 63530 C116 PA 1540 54.754 -5.915 31.363 1.00 0.00 C ATOM 63531 H16R PA 1540 54.918 -6.819 30.772 1.00 0.00 H ATOM 63532 H16S PA 1540 54.450 -6.117 32.392 1.00 0.00 H ATOM 63533 H16T PA 1540 55.677 -5.331 31.356 1.00 0.00 H ATOM 63534 C115 PA 1540 53.706 -5.015 30.716 1.00 0.00 C ATOM 63535 H15R PA 1540 52.798 -5.579 30.496 1.00 0.00 H ATOM 63536 H15S PA 1540 54.152 -4.730 29.761 1.00 0.00 H ATOM 63537 C114 PA 1540 53.361 -3.773 31.478 1.00 0.00 C ATOM 63538 H14R PA 1540 54.214 -3.111 31.641 1.00 0.00 H ATOM 63539 H14S PA 1540 52.978 -3.910 32.492 1.00 0.00 H ATOM 63540 C113 PA 1540 52.219 -2.992 30.826 1.00 0.00 C ATOM 63541 H13R PA 1540 51.276 -3.541 30.785 1.00 0.00 H ATOM 63542 H13S PA 1540 52.638 -2.974 29.818 1.00 0.00 H ATOM 63543 C112 PA 1540 51.947 -1.631 31.376 1.00 0.00 C ATOM 63544 H12R PA 1540 52.728 -0.921 31.094 1.00 0.00 H ATOM 63545 H12S PA 1540 52.101 -1.689 32.455 1.00 0.00 H ATOM 63546 C111 PA 1540 50.624 -1.044 30.938 1.00 0.00 C ATOM 63547 H11R PA 1540 49.873 -1.802 31.169 1.00 0.00 H ATOM 63548 H11S PA 1540 50.540 -1.102 29.851 1.00 0.00 H ATOM 63549 C110 PA 1540 50.076 0.260 31.650 1.00 0.00 C ATOM 63550 H10R PA 1540 50.331 0.133 32.704 1.00 0.00 H ATOM 63551 H10S PA 1540 49.001 0.413 31.533 1.00 0.00 H ATOM 63552 C19 PA 1540 50.782 1.548 31.225 1.00 0.00 C ATOM 63553 H9R PA 1540 50.513 1.834 30.206 1.00 0.00 H ATOM 63554 H9S PA 1540 51.874 1.524 31.203 1.00 0.00 H ATOM 63555 C18 PA 1540 50.374 2.709 32.173 1.00 0.00 C ATOM 63556 H8R PA 1540 50.775 2.460 33.158 1.00 0.00 H ATOM 63557 H8S PA 1540 49.285 2.700 32.093 1.00 0.00 H ATOM 63558 C17 PA 1540 50.942 4.051 31.754 1.00 0.00 C ATOM 63559 H7R PA 1540 52.030 4.053 31.653 1.00 0.00 H ATOM 63560 H7S PA 1540 50.726 4.806 32.513 1.00 0.00 H ATOM 63561 C16 PA 1540 50.376 4.493 30.360 1.00 0.00 C ATOM 63562 H6R PA 1540 49.288 4.534 30.270 1.00 0.00 H ATOM 63563 H6S PA 1540 50.618 3.732 29.615 1.00 0.00 H ATOM 63564 C15 PA 1540 50.845 5.831 29.958 1.00 0.00 C ATOM 63565 H5R PA 1540 51.783 5.701 29.414 1.00 0.00 H ATOM 63566 H5S PA 1540 50.967 6.480 30.828 1.00 0.00 H ATOM 63567 C14 PA 1540 49.831 6.539 28.975 1.00 0.00 C ATOM 63568 H4R PA 1540 48.871 6.702 29.469 1.00 0.00 H ATOM 63569 H4S PA 1540 49.413 6.037 28.100 1.00 0.00 H ATOM 63570 C13 PA 1540 50.332 7.889 28.512 1.00 0.00 C ATOM 63571 H3R PA 1540 50.677 8.322 29.453 1.00 0.00 H ATOM 63572 H3S PA 1540 49.519 8.456 28.053 1.00 0.00 H ATOM 63573 C12 PA 1540 51.411 7.780 27.449 1.00 0.00 C ATOM 63574 H2R PA 1540 52.387 7.310 27.588 1.00 0.00 H ATOM 63575 H2S PA 1540 51.754 8.811 27.335 1.00 0.00 H ATOM 63576 C11 PGR 1541 50.709 7.348 26.145 1.00 0.00 C ATOM 63577 O12 PGR 1541 50.252 8.137 25.356 1.00 0.00 O ATOM 63578 O11 PGR 1541 50.862 6.049 25.896 1.00 0.00 O ATOM 63579 C1 PGR 1541 50.594 5.576 24.576 1.00 0.00 C ATOM 63580 HR PGR 1541 49.603 5.977 24.345 1.00 0.00 H ATOM 63581 HS PGR 1541 50.612 4.492 24.710 1.00 0.00 H ATOM 63582 C2 PGR 1541 51.737 5.996 23.594 1.00 0.00 C ATOM 63583 HX PGR 1541 51.880 7.078 23.645 1.00 0.00 H ATOM 63584 C3 PGR 1541 51.507 5.597 22.182 1.00 0.00 C ATOM 63585 HA PGR 1541 50.541 5.974 21.836 1.00 0.00 H ATOM 63586 HB PGR 1541 51.503 4.508 22.277 1.00 0.00 H ATOM 63587 O31 PGR 1541 52.549 6.089 21.417 1.00 0.00 O ATOM 63588 P31 PGR 1541 52.366 6.345 19.849 1.00 0.00 P ATOM 63589 O32 PGR 1541 51.154 7.342 19.776 1.00 0.00 O ATOM 63590 C31 PGR 1541 51.159 8.707 20.155 1.00 0.00 C ATOM 63591 H1A PGR 1541 51.917 9.341 19.689 1.00 0.00 H ATOM 63592 H1B PGR 1541 51.240 8.664 21.244 1.00 0.00 H ATOM 63593 C32 PGR 1541 49.787 9.206 19.741 1.00 0.00 C ATOM 63594 H2A PGR 1541 49.721 10.295 19.809 1.00 0.00 H ATOM 63595 O35 PGR 1541 48.819 8.637 20.621 1.00 0.00 O ATOM 63596 HO5A PGR 1541 48.989 8.938 21.532 1.00 0.00 H ATOM 63597 C33 PGR 1541 49.403 8.887 18.287 1.00 0.00 C ATOM 63598 H3A PGR 1541 50.021 9.554 17.682 1.00 0.00 H ATOM 63599 H3B PGR 1541 49.538 7.882 17.879 1.00 0.00 H ATOM 63600 O33 PGR 1541 53.569 7.151 19.436 1.00 0.00 O ATOM 63601 O34 PGR 1541 51.999 5.133 19.123 1.00 0.00 O ATOM 63602 O21 PGR 1541 52.762 5.133 24.069 1.00 0.00 O ATOM 63603 C21 PGR 1541 53.653 5.672 24.859 1.00 0.00 C ATOM 63604 O22 PGR 1541 53.716 6.822 25.268 1.00 0.00 O ATOM 63605 O36 PGR 1541 48.106 9.283 18.012 1.00 0.00 O ATOM 63606 HO6A PGR 1541 48.116 9.525 17.069 1.00 0.00 H ATOM 63607 C12 OL 1542 54.708 4.653 25.235 1.00 0.00 C ATOM 63608 H2R OL 1542 55.025 4.214 24.286 1.00 0.00 H ATOM 63609 H2S OL 1542 55.590 5.151 25.644 1.00 0.00 H ATOM 63610 C13 OL 1542 54.289 3.425 26.025 1.00 0.00 C ATOM 63611 H3R OL 1542 53.807 2.683 25.384 1.00 0.00 H ATOM 63612 H3S OL 1542 55.305 3.116 26.278 1.00 0.00 H ATOM 63613 C14 OL 1542 53.219 3.556 27.060 1.00 0.00 C ATOM 63614 H4R OL 1542 52.411 4.184 26.680 1.00 0.00 H ATOM 63615 H4S OL 1542 52.744 2.613 27.341 1.00 0.00 H ATOM 63616 C15 OL 1542 53.716 3.925 28.483 1.00 0.00 C ATOM 63617 H5R OL 1542 54.014 4.975 28.476 1.00 0.00 H ATOM 63618 H5S OL 1542 52.845 3.789 29.126 1.00 0.00 H ATOM 63619 C16 OL 1542 54.914 3.174 28.966 1.00 0.00 C ATOM 63620 H6R OL 1542 54.654 2.123 28.821 1.00 0.00 H ATOM 63621 H6S OL 1542 55.799 3.316 28.341 1.00 0.00 H ATOM 63622 C17 OL 1542 55.107 3.411 30.480 1.00 0.00 C ATOM 63623 H7R OL 1542 55.003 4.478 30.687 1.00 0.00 H ATOM 63624 H7S OL 1542 54.276 2.973 31.036 1.00 0.00 H ATOM 63625 C18 OL 1542 56.506 3.014 30.895 1.00 0.00 C ATOM 63626 H8R OL 1542 56.540 3.200 31.971 1.00 0.00 H ATOM 63627 H8S OL 1542 56.740 1.996 30.576 1.00 0.00 H ATOM 63628 C19 OL 1542 57.479 3.992 30.269 1.00 0.00 C ATOM 63629 H9R OL 1542 57.303 5.054 30.417 1.00 0.00 H ATOM 63630 C110 OL 1542 58.545 3.712 29.448 1.00 0.00 C ATOM 63631 H10R OL 1542 59.043 4.573 29.009 1.00 0.00 H ATOM 63632 C111 OL 1542 58.888 2.307 28.964 1.00 0.00 C ATOM 63633 H11R OL 1542 58.097 1.564 29.078 1.00 0.00 H ATOM 63634 H11S OL 1542 59.032 2.428 27.888 1.00 0.00 H ATOM 63635 C112 OL 1542 60.192 1.741 29.495 1.00 0.00 C ATOM 63636 H12R OL 1542 60.227 1.599 30.577 1.00 0.00 H ATOM 63637 H12S OL 1542 60.224 0.751 29.034 1.00 0.00 H ATOM 63638 C113 OL 1542 61.381 2.526 29.142 1.00 0.00 C ATOM 63639 H13R OL 1542 62.241 1.872 28.982 1.00 0.00 H ATOM 63640 H13S OL 1542 61.088 3.105 28.263 1.00 0.00 H ATOM 63641 C114 OL 1542 61.891 3.657 30.181 1.00 0.00 C ATOM 63642 H14R OL 1542 62.552 4.355 29.663 1.00 0.00 H ATOM 63643 H14S OL 1542 60.972 4.185 30.445 1.00 0.00 H ATOM 63644 C115 OL 1542 62.717 3.093 31.314 1.00 0.00 C ATOM 63645 H15R OL 1542 62.468 2.050 31.526 1.00 0.00 H ATOM 63646 H15S OL 1542 63.771 3.133 31.031 1.00 0.00 H ATOM 63647 C116 OL 1542 62.585 3.956 32.558 1.00 0.00 C ATOM 63648 H16R OL 1542 63.185 3.439 33.310 1.00 0.00 H ATOM 63649 H16S OL 1542 62.974 4.959 32.372 1.00 0.00 H ATOM 63650 C117 OL 1542 61.181 4.126 33.120 1.00 0.00 C ATOM 63651 H17R OL 1542 61.229 4.624 34.091 1.00 0.00 H ATOM 63652 H17S OL 1542 60.600 4.853 32.550 1.00 0.00 H ATOM 63653 C118 OL 1542 60.277 2.804 33.434 1.00 0.00 C ATOM 63654 H18R OL 1542 60.813 2.232 34.194 1.00 0.00 H ATOM 63655 H18S OL 1542 60.203 2.192 32.533 1.00 0.00 H ATOM 63656 H18T OL 1542 59.236 2.974 33.715 1.00 0.00 H TER 63657 OL 1542 ATOM 63657 C116 PA 1543 115.899 108.335 39.896 1.00 0.00 C ATOM 63658 H16R PA 1543 114.910 108.659 39.562 1.00 0.00 H ATOM 63659 H16S PA 1543 115.903 108.829 40.870 1.00 0.00 H ATOM 63660 H16T PA 1543 116.066 107.260 39.987 1.00 0.00 H ATOM 63661 C115 PA 1543 116.889 108.838 38.825 1.00 0.00 C ATOM 63662 H15R PA 1543 116.734 108.255 37.915 1.00 0.00 H ATOM 63663 H15S PA 1543 117.822 108.400 39.186 1.00 0.00 H ATOM 63664 C114 PA 1543 117.043 110.333 38.606 1.00 0.00 C ATOM 63665 H14R PA 1543 117.476 110.674 39.548 1.00 0.00 H ATOM 63666 H14S PA 1543 116.062 110.806 38.525 1.00 0.00 H ATOM 63667 C113 PA 1543 117.950 110.821 37.494 1.00 0.00 C ATOM 63668 H13R PA 1543 117.750 110.409 36.503 1.00 0.00 H ATOM 63669 H13S PA 1543 119.003 110.584 37.665 1.00 0.00 H ATOM 63670 C112 PA 1543 118.037 112.338 37.348 1.00 0.00 C ATOM 63671 H12R PA 1543 118.506 112.794 38.222 1.00 0.00 H ATOM 63672 H12S PA 1543 117.062 112.799 37.176 1.00 0.00 H ATOM 63673 C111 PA 1543 118.980 112.747 36.195 1.00 0.00 C ATOM 63674 H11R PA 1543 119.955 112.258 36.251 1.00 0.00 H ATOM 63675 H11S PA 1543 119.200 113.800 36.386 1.00 0.00 H ATOM 63676 C110 PA 1543 118.330 112.598 34.844 1.00 0.00 C ATOM 63677 H10R PA 1543 117.402 113.173 34.851 1.00 0.00 H ATOM 63678 H10S PA 1543 118.155 111.539 34.643 1.00 0.00 H ATOM 63679 C19 PA 1543 119.187 113.189 33.797 1.00 0.00 C ATOM 63680 H9R PA 1543 120.114 112.623 33.687 1.00 0.00 H ATOM 63681 H9S PA 1543 119.488 114.216 34.012 1.00 0.00 H ATOM 63682 C18 PA 1543 118.510 113.330 32.474 1.00 0.00 C ATOM 63683 H8R PA 1543 117.554 113.819 32.669 1.00 0.00 H ATOM 63684 H8S PA 1543 118.274 112.333 32.096 1.00 0.00 H ATOM 63685 C17 PA 1543 119.271 114.138 31.409 1.00 0.00 C ATOM 63686 H7R PA 1543 120.270 113.788 31.140 1.00 0.00 H ATOM 63687 H7S PA 1543 119.305 115.146 31.829 1.00 0.00 H ATOM 63688 C16 PA 1543 118.407 114.352 30.172 1.00 0.00 C ATOM 63689 H6R PA 1543 117.491 114.908 30.383 1.00 0.00 H ATOM 63690 H6S PA 1543 118.094 113.367 29.819 1.00 0.00 H ATOM 63691 C15 PA 1543 119.169 115.216 29.197 1.00 0.00 C ATOM 63692 H5R PA 1543 120.168 114.775 29.231 1.00 0.00 H ATOM 63693 H5S PA 1543 119.228 116.242 29.565 1.00 0.00 H ATOM 63694 C14 PA 1543 118.509 115.423 27.765 1.00 0.00 C ATOM 63695 H4R PA 1543 118.288 114.435 27.356 1.00 0.00 H ATOM 63696 H4S PA 1543 119.285 115.961 27.217 1.00 0.00 H ATOM 63697 C13 PA 1543 117.267 116.321 27.948 1.00 0.00 C ATOM 63698 H3R PA 1543 117.555 117.149 28.599 1.00 0.00 H ATOM 63699 H3S PA 1543 116.449 115.772 28.419 1.00 0.00 H ATOM 63700 C12 PA 1543 116.817 116.979 26.636 1.00 0.00 C ATOM 63701 H2R PA 1543 116.047 117.751 26.697 1.00 0.00 H ATOM 63702 H2S PA 1543 117.650 117.491 26.149 1.00 0.00 H ATOM 63703 C11 PGR 1544 116.358 115.880 25.632 1.00 0.00 C ATOM 63704 O12 PGR 1544 116.929 115.659 24.584 1.00 0.00 O ATOM 63705 O11 PGR 1544 115.436 115.035 26.148 1.00 0.00 O ATOM 63706 C1 PGR 1544 114.845 114.014 25.284 1.00 0.00 C ATOM 63707 HR PGR 1544 115.625 113.339 24.922 1.00 0.00 H ATOM 63708 HS PGR 1544 114.264 114.522 24.510 1.00 0.00 H ATOM 63709 C2 PGR 1544 113.984 113.138 26.104 1.00 0.00 C ATOM 63710 HX PGR 1544 114.654 112.520 26.707 1.00 0.00 H ATOM 63711 C3 PGR 1544 113.135 112.255 25.228 1.00 0.00 C ATOM 63712 HA PGR 1544 112.549 111.554 25.828 1.00 0.00 H ATOM 63713 HB PGR 1544 113.819 111.684 24.595 1.00 0.00 H ATOM 63714 O31 PGR 1544 112.269 113.074 24.431 1.00 0.00 O ATOM 63715 P31 PGR 1544 111.157 112.438 23.579 1.00 0.00 P ATOM 63716 O32 PGR 1544 112.165 111.798 22.464 1.00 0.00 O ATOM 63717 C31 PGR 1544 113.107 112.516 21.690 1.00 0.00 C ATOM 63718 H1A PGR 1544 113.987 112.403 22.328 1.00 0.00 H ATOM 63719 H1B PGR 1544 112.945 113.581 21.502 1.00 0.00 H ATOM 63720 C32 PGR 1544 113.294 111.879 20.308 1.00 0.00 C ATOM 63721 H2A PGR 1544 112.329 111.935 19.798 1.00 0.00 H ATOM 63722 O35 PGR 1544 113.552 110.469 20.452 1.00 0.00 O ATOM 63723 HO5A PGR 1544 114.488 110.372 20.201 1.00 0.00 H ATOM 63724 C33 PGR 1544 114.251 112.493 19.271 1.00 0.00 C ATOM 63725 H3A PGR 1544 113.920 113.506 19.027 1.00 0.00 H ATOM 63726 H3B PGR 1544 115.268 112.609 19.656 1.00 0.00 H ATOM 63727 O33 PGR 1544 110.578 111.265 24.326 1.00 0.00 O ATOM 63728 O34 PGR 1544 110.345 113.468 22.915 1.00 0.00 O ATOM 63729 O21 PGR 1544 113.210 113.906 27.038 1.00 0.00 O ATOM 63730 C21 PGR 1544 112.697 113.259 28.057 1.00 0.00 C ATOM 63731 O22 PGR 1544 113.052 112.142 28.408 1.00 0.00 O ATOM 63732 O36 PGR 1544 114.165 111.711 18.070 1.00 0.00 O ATOM 63733 HO6A PGR 1544 114.731 112.221 17.462 1.00 0.00 H ATOM 63734 C12 OL 1545 111.712 114.191 28.818 1.00 0.00 C ATOM 63735 H2R OL 1545 112.222 114.588 29.698 1.00 0.00 H ATOM 63736 H2S OL 1545 111.402 115.030 28.192 1.00 0.00 H ATOM 63737 C13 OL 1545 110.311 113.637 28.979 1.00 0.00 C ATOM 63738 H3R OL 1545 109.518 114.313 29.306 1.00 0.00 H ATOM 63739 H3S OL 1545 109.914 113.188 28.066 1.00 0.00 H ATOM 63740 C14 OL 1545 110.257 112.476 29.955 1.00 0.00 C ATOM 63741 H4R OL 1545 109.308 111.942 29.867 1.00 0.00 H ATOM 63742 H4S OL 1545 111.031 111.747 29.706 1.00 0.00 H ATOM 63743 C15 OL 1545 110.538 112.994 31.360 1.00 0.00 C ATOM 63744 H5R OL 1545 111.513 113.486 31.373 1.00 0.00 H ATOM 63745 H5S OL 1545 109.742 113.641 31.734 1.00 0.00 H ATOM 63746 C16 OL 1545 110.718 111.840 32.404 1.00 0.00 C ATOM 63747 H6R OL 1545 111.654 111.299 32.249 1.00 0.00 H ATOM 63748 H6S OL 1545 110.804 112.310 33.386 1.00 0.00 H ATOM 63749 C17 OL 1545 109.550 110.769 32.443 1.00 0.00 C ATOM 63750 H7R OL 1545 109.561 110.219 31.500 1.00 0.00 H ATOM 63751 H7S OL 1545 109.699 109.987 33.191 1.00 0.00 H ATOM 63752 C18 OL 1545 108.133 111.277 32.715 1.00 0.00 C ATOM 63753 H8R OL 1545 107.915 111.975 31.904 1.00 0.00 H ATOM 63754 H8S OL 1545 107.358 110.525 32.557 1.00 0.00 H ATOM 63755 C19 OL 1545 107.944 111.802 34.061 1.00 0.00 C ATOM 63756 H9R OL 1545 108.674 112.560 34.332 1.00 0.00 H ATOM 63757 C110 OL 1545 106.944 111.532 34.901 1.00 0.00 C ATOM 63758 H10R OL 1545 107.004 112.068 35.845 1.00 0.00 H ATOM 63759 C111 OL 1545 105.709 110.627 34.727 1.00 0.00 C ATOM 63760 H11R OL 1545 105.565 110.323 33.688 1.00 0.00 H ATOM 63761 H11S OL 1545 105.681 109.725 35.342 1.00 0.00 H ATOM 63762 C112 OL 1545 104.395 111.266 35.227 1.00 0.00 C ATOM 63763 H12R OL 1545 104.027 111.964 34.472 1.00 0.00 H ATOM 63764 H12S OL 1545 103.636 110.480 35.233 1.00 0.00 H ATOM 63765 C113 OL 1545 104.458 111.825 36.699 1.00 0.00 C ATOM 63766 H13R OL 1545 105.499 111.675 36.994 1.00 0.00 H ATOM 63767 H13S OL 1545 104.385 112.907 36.572 1.00 0.00 H ATOM 63768 C114 OL 1545 103.416 111.448 37.648 1.00 0.00 C ATOM 63769 H14R OL 1545 102.409 111.305 37.249 1.00 0.00 H ATOM 63770 H14S OL 1545 103.679 110.449 37.999 1.00 0.00 H ATOM 63771 C115 OL 1545 103.307 112.502 38.825 1.00 0.00 C ATOM 63772 H15R OL 1545 103.076 113.460 38.354 1.00 0.00 H ATOM 63773 H15S OL 1545 102.444 112.351 39.477 1.00 0.00 H ATOM 63774 C116 OL 1545 104.558 112.683 39.629 1.00 0.00 C ATOM 63775 H16R OL 1545 104.971 111.733 39.975 1.00 0.00 H ATOM 63776 H16S OL 1545 105.332 113.007 38.930 1.00 0.00 H ATOM 63777 C117 OL 1545 104.565 113.629 40.886 1.00 0.00 C ATOM 63778 H17R OL 1545 103.957 114.481 40.573 1.00 0.00 H ATOM 63779 H17S OL 1545 104.022 113.270 41.763 1.00 0.00 H ATOM 63780 C118 OL 1545 105.943 114.090 41.425 1.00 0.00 C ATOM 63781 H18R OL 1545 105.814 114.842 42.206 1.00 0.00 H ATOM 63782 H18S OL 1545 106.508 114.478 40.574 1.00 0.00 H ATOM 63783 H18T OL 1545 106.478 113.235 41.841 1.00 0.00 H TER 63784 OL 1545 ATOM 63784 C116 PA 1546 130.470 91.377 44.480 1.00 0.00 C ATOM 63785 H16R PA 1546 130.680 92.301 43.937 1.00 0.00 H ATOM 63786 H16S PA 1546 131.406 91.153 44.997 1.00 0.00 H ATOM 63787 H16T PA 1546 129.741 91.650 45.246 1.00 0.00 H ATOM 63788 C115 PA 1546 129.950 90.292 43.661 1.00 0.00 C ATOM 63789 H15R PA 1546 130.059 89.337 44.179 1.00 0.00 H ATOM 63790 H15S PA 1546 130.476 90.074 42.729 1.00 0.00 H ATOM 63791 C114 PA 1546 128.420 90.585 43.258 1.00 0.00 C ATOM 63792 H14R PA 1546 128.297 91.495 42.667 1.00 0.00 H ATOM 63793 H14S PA 1546 127.879 90.818 44.178 1.00 0.00 H ATOM 63794 C113 PA 1546 127.809 89.355 42.584 1.00 0.00 C ATOM 63795 H13R PA 1546 126.723 89.435 42.513 1.00 0.00 H ATOM 63796 H13S PA 1546 128.141 88.492 43.165 1.00 0.00 H ATOM 63797 C112 PA 1546 128.263 89.195 41.103 1.00 0.00 C ATOM 63798 H12R PA 1546 129.298 88.866 40.987 1.00 0.00 H ATOM 63799 H12S PA 1546 128.207 90.143 40.564 1.00 0.00 H ATOM 63800 C111 PA 1546 127.524 88.160 40.185 1.00 0.00 C ATOM 63801 H11R PA 1546 126.488 88.046 40.511 1.00 0.00 H ATOM 63802 H11S PA 1546 128.068 87.220 40.299 1.00 0.00 H ATOM 63803 C110 PA 1546 127.657 88.601 38.806 1.00 0.00 C ATOM 63804 H10R PA 1546 128.732 88.716 38.650 1.00 0.00 H ATOM 63805 H10S PA 1546 127.197 89.570 38.599 1.00 0.00 H ATOM 63806 C19 PA 1546 127.066 87.511 37.855 1.00 0.00 C ATOM 63807 H9R PA 1546 126.384 86.873 38.421 1.00 0.00 H ATOM 63808 H9S PA 1546 127.801 86.836 37.410 1.00 0.00 H ATOM 63809 C18 PA 1546 126.382 88.096 36.646 1.00 0.00 C ATOM 63810 H8R PA 1546 125.492 88.611 37.016 1.00 0.00 H ATOM 63811 H8S PA 1546 126.104 87.199 36.090 1.00 0.00 H ATOM 63812 C17 PA 1546 127.267 88.959 35.779 1.00 0.00 C ATOM 63813 H7R PA 1546 128.292 88.582 35.753 1.00 0.00 H ATOM 63814 H7S PA 1546 127.463 89.916 36.267 1.00 0.00 H ATOM 63815 C16 PA 1546 126.718 89.128 34.306 1.00 0.00 C ATOM 63816 H6R PA 1546 125.865 89.809 34.340 1.00 0.00 H ATOM 63817 H6S PA 1546 126.311 88.141 34.074 1.00 0.00 H ATOM 63818 C15 PA 1546 127.815 89.647 33.306 1.00 0.00 C ATOM 63819 H5R PA 1546 127.305 89.685 32.342 1.00 0.00 H ATOM 63820 H5S PA 1546 128.638 88.948 33.148 1.00 0.00 H ATOM 63821 C14 PA 1546 128.357 91.069 33.572 1.00 0.00 C ATOM 63822 H4R PA 1546 128.493 91.188 34.649 1.00 0.00 H ATOM 63823 H4S PA 1546 127.608 91.828 33.339 1.00 0.00 H ATOM 63824 C13 PA 1546 129.617 91.337 32.745 1.00 0.00 C ATOM 63825 H3R PA 1546 129.297 91.131 31.721 1.00 0.00 H ATOM 63826 H3S PA 1546 130.302 90.505 32.923 1.00 0.00 H ATOM 63827 C12 PA 1546 130.410 92.668 32.958 1.00 0.00 C ATOM 63828 H2R PA 1546 130.866 92.533 33.942 1.00 0.00 H ATOM 63829 H2S PA 1546 129.792 93.550 33.136 1.00 0.00 H ATOM 63830 C11 PGR 1547 131.462 92.864 31.935 1.00 0.00 C ATOM 63831 O12 PGR 1547 131.157 92.981 30.782 1.00 0.00 O ATOM 63832 O11 PGR 1547 132.642 93.030 32.480 1.00 0.00 O ATOM 63833 C1 PGR 1547 133.593 93.609 31.573 1.00 0.00 C ATOM 63834 HR PGR 1547 133.596 93.051 30.633 1.00 0.00 H ATOM 63835 HS PGR 1547 134.507 93.492 32.161 1.00 0.00 H ATOM 63836 C2 PGR 1547 133.334 95.130 31.313 1.00 0.00 C ATOM 63837 HX PGR 1547 132.399 95.320 31.846 1.00 0.00 H ATOM 63838 C3 PGR 1547 133.126 95.423 29.832 1.00 0.00 C ATOM 63839 HA PGR 1547 132.936 96.490 29.686 1.00 0.00 H ATOM 63840 HB PGR 1547 132.225 94.893 29.512 1.00 0.00 H ATOM 63841 O31 PGR 1547 134.276 94.985 29.136 1.00 0.00 O ATOM 63842 P31 PGR 1547 134.546 95.185 27.605 1.00 0.00 P ATOM 63843 O32 PGR 1547 133.328 94.530 26.962 1.00 0.00 O ATOM 63844 C31 PGR 1547 133.231 93.125 26.962 1.00 0.00 C ATOM 63845 H1A PGR 1547 133.227 92.635 27.939 1.00 0.00 H ATOM 63846 H1B PGR 1547 134.095 92.796 26.379 1.00 0.00 H ATOM 63847 C32 PGR 1547 131.927 92.690 26.160 1.00 0.00 C ATOM 63848 H2A PGR 1547 131.670 91.641 26.327 1.00 0.00 H ATOM 63849 O35 PGR 1547 132.149 92.816 24.722 1.00 0.00 O ATOM 63850 HO5A PGR 1547 132.056 93.780 24.617 1.00 0.00 H ATOM 63851 C33 PGR 1547 130.670 93.379 26.491 1.00 0.00 C ATOM 63852 H3A PGR 1547 129.891 92.661 26.223 1.00 0.00 H ATOM 63853 H3B PGR 1547 130.587 93.512 27.573 1.00 0.00 H ATOM 63854 O33 PGR 1547 134.463 96.681 27.328 1.00 0.00 O ATOM 63855 O34 PGR 1547 135.838 94.553 27.252 1.00 0.00 O ATOM 63856 O21 PGR 1547 134.487 95.910 31.838 1.00 0.00 O ATOM 63857 C21 PGR 1547 134.272 97.253 32.043 1.00 0.00 C ATOM 63858 O22 PGR 1547 133.258 97.892 32.006 1.00 0.00 O ATOM 63859 O36 PGR 1547 130.516 94.573 25.629 1.00 0.00 O ATOM 63860 HO6A PGR 1547 130.989 95.295 26.079 1.00 0.00 H ATOM 63861 C12 OL 1548 135.614 97.891 32.398 1.00 0.00 C ATOM 63862 H2R OL 1548 136.272 97.905 31.527 1.00 0.00 H ATOM 63863 H2S OL 1548 135.322 98.918 32.627 1.00 0.00 H ATOM 63864 C13 OL 1548 136.348 97.262 33.558 1.00 0.00 C ATOM 63865 H3R OL 1548 135.712 97.474 34.421 1.00 0.00 H ATOM 63866 H3S OL 1548 136.401 96.181 33.414 1.00 0.00 H ATOM 63867 C14 OL 1548 137.792 97.713 33.885 1.00 0.00 C ATOM 63868 H4R OL 1548 137.942 97.203 34.839 1.00 0.00 H ATOM 63869 H4S OL 1548 138.478 97.191 33.215 1.00 0.00 H ATOM 63870 C15 OL 1548 138.080 99.174 33.943 1.00 0.00 C ATOM 63871 H5R OL 1548 137.905 99.617 32.960 1.00 0.00 H ATOM 63872 H5S OL 1548 137.412 99.685 34.639 1.00 0.00 H ATOM 63873 C16 OL 1548 139.510 99.489 34.344 1.00 0.00 C ATOM 63874 H6R OL 1548 139.606 99.064 35.345 1.00 0.00 H ATOM 63875 H6S OL 1548 140.163 98.980 33.633 1.00 0.00 H ATOM 63876 C17 OL 1548 139.851 100.977 34.532 1.00 0.00 C ATOM 63877 H7R OL 1548 139.165 101.572 33.925 1.00 0.00 H ATOM 63878 H7S OL 1548 139.476 101.258 35.518 1.00 0.00 H ATOM 63879 C18 OL 1548 141.299 101.311 34.336 1.00 0.00 C ATOM 63880 H8R OL 1548 141.624 101.099 33.315 1.00 0.00 H ATOM 63881 H8S OL 1548 141.422 102.395 34.375 1.00 0.00 H ATOM 63882 C19 OL 1548 142.257 100.707 35.387 1.00 0.00 C ATOM 63883 H9R OL 1548 142.404 99.641 35.233 1.00 0.00 H ATOM 63884 C110 OL 1548 142.829 101.280 36.404 1.00 0.00 C ATOM 63885 H10R OL 1548 143.445 100.586 36.970 1.00 0.00 H ATOM 63886 C111 OL 1548 142.572 102.669 36.912 1.00 0.00 C ATOM 63887 H11R OL 1548 141.957 103.257 36.229 1.00 0.00 H ATOM 63888 H11S OL 1548 142.145 102.539 37.909 1.00 0.00 H ATOM 63889 C112 OL 1548 143.874 103.461 37.013 1.00 0.00 C ATOM 63890 H12R OL 1548 144.627 102.804 37.453 1.00 0.00 H ATOM 63891 H12S OL 1548 144.172 103.715 35.994 1.00 0.00 H ATOM 63892 C113 OL 1548 143.576 104.673 37.952 1.00 0.00 C ATOM 63893 H13R OL 1548 143.236 105.518 37.351 1.00 0.00 H ATOM 63894 H13S OL 1548 142.953 104.294 38.765 1.00 0.00 H ATOM 63895 C114 OL 1548 144.762 105.310 38.688 1.00 0.00 C ATOM 63896 H14R OL 1548 144.374 106.162 39.249 1.00 0.00 H ATOM 63897 H14S OL 1548 145.299 104.667 39.389 1.00 0.00 H ATOM 63898 C115 OL 1548 145.837 105.845 37.748 1.00 0.00 C ATOM 63899 H15R OL 1548 146.371 105.007 37.295 1.00 0.00 H ATOM 63900 H15S OL 1548 145.380 106.352 36.895 1.00 0.00 H ATOM 63901 C116 OL 1548 146.797 106.852 38.472 1.00 0.00 C ATOM 63902 H16R OL 1548 147.659 107.164 37.879 1.00 0.00 H ATOM 63903 H16S OL 1548 146.249 107.773 38.681 1.00 0.00 H ATOM 63904 C117 OL 1548 147.306 106.318 39.789 1.00 0.00 C ATOM 63905 H17R OL 1548 147.939 107.094 40.224 1.00 0.00 H ATOM 63906 H17S OL 1548 146.466 106.169 40.472 1.00 0.00 H ATOM 63907 C118 OL 1548 148.184 105.114 39.668 1.00 0.00 C ATOM 63908 H18R OL 1548 147.856 104.408 38.902 1.00 0.00 H ATOM 63909 H18S OL 1548 148.246 104.586 40.622 1.00 0.00 H ATOM 63910 H18T OL 1548 149.192 105.332 39.310 1.00 0.00 H TER 63911 OL 1548 ATOM 63911 C116 PA 1549 79.019 94.091 41.589 1.00 0.00 C ATOM 63912 H16R PA 1549 78.171 93.921 42.255 1.00 0.00 H ATOM 63913 H16S PA 1549 79.635 94.861 42.058 1.00 0.00 H ATOM 63914 H16T PA 1549 79.647 93.205 41.470 1.00 0.00 H ATOM 63915 C115 PA 1549 78.392 94.494 40.329 1.00 0.00 C ATOM 63916 H15R PA 1549 77.861 95.402 40.621 1.00 0.00 H ATOM 63917 H15S PA 1549 77.632 93.718 40.222 1.00 0.00 H ATOM 63918 C114 PA 1549 79.280 94.636 39.141 1.00 0.00 C ATOM 63919 H14R PA 1549 80.052 95.394 39.288 1.00 0.00 H ATOM 63920 H14S PA 1549 78.604 95.008 38.368 1.00 0.00 H ATOM 63921 C113 PA 1549 80.005 93.333 38.630 1.00 0.00 C ATOM 63922 H13R PA 1549 79.241 92.755 38.107 1.00 0.00 H ATOM 63923 H13S PA 1549 80.385 92.756 39.476 1.00 0.00 H ATOM 63924 C112 PA 1549 81.201 93.687 37.734 1.00 0.00 C ATOM 63925 H12R PA 1549 81.782 92.832 37.382 1.00 0.00 H ATOM 63926 H12S PA 1549 81.891 94.243 38.372 1.00 0.00 H ATOM 63927 C111 PA 1549 80.871 94.461 36.468 1.00 0.00 C ATOM 63928 H11R PA 1549 80.516 95.420 36.854 1.00 0.00 H ATOM 63929 H11S PA 1549 80.182 93.781 35.964 1.00 0.00 H ATOM 63930 C110 PA 1549 82.080 94.817 35.649 1.00 0.00 C ATOM 63931 H10R PA 1549 82.625 93.877 35.539 1.00 0.00 H ATOM 63932 H10S PA 1549 82.754 95.490 36.183 1.00 0.00 H ATOM 63933 C19 PA 1549 81.803 95.343 34.248 1.00 0.00 C ATOM 63934 H9R PA 1549 80.881 94.847 33.936 1.00 0.00 H ATOM 63935 H9S PA 1549 82.677 94.994 33.694 1.00 0.00 H ATOM 63936 C18 PA 1549 81.535 96.832 34.248 1.00 0.00 C ATOM 63937 H8R PA 1549 80.992 97.175 35.131 1.00 0.00 H ATOM 63938 H8S PA 1549 80.985 96.938 33.310 1.00 0.00 H ATOM 63939 C17 PA 1549 82.780 97.758 33.898 1.00 0.00 C ATOM 63940 H7R PA 1549 83.277 97.463 32.971 1.00 0.00 H ATOM 63941 H7S PA 1549 83.554 97.733 34.668 1.00 0.00 H ATOM 63942 C16 PA 1549 82.496 99.227 33.569 1.00 0.00 C ATOM 63943 H6R PA 1549 81.780 99.627 34.290 1.00 0.00 H ATOM 63944 H6S PA 1549 82.030 99.406 32.597 1.00 0.00 H ATOM 63945 C15 PA 1549 83.660 100.075 33.667 1.00 0.00 C ATOM 63946 H5R PA 1549 84.544 99.530 33.332 1.00 0.00 H ATOM 63947 H5S PA 1549 83.764 100.445 34.690 1.00 0.00 H ATOM 63948 C14 PA 1549 83.577 101.349 32.897 1.00 0.00 C ATOM 63949 H4R PA 1549 83.420 100.994 31.877 1.00 0.00 H ATOM 63950 H4S PA 1549 84.569 101.756 32.693 1.00 0.00 H ATOM 63951 C13 PA 1549 82.489 102.259 33.217 1.00 0.00 C ATOM 63952 H3R PA 1549 82.794 102.814 34.107 1.00 0.00 H ATOM 63953 H3S PA 1549 81.625 101.686 33.560 1.00 0.00 H ATOM 63954 C12 PA 1549 82.033 103.251 32.187 1.00 0.00 C ATOM 63955 H2R PA 1549 82.797 104.030 32.138 1.00 0.00 H ATOM 63956 H2S PA 1549 81.105 103.807 32.339 1.00 0.00 H ATOM 63957 C11 PC 1550 81.778 102.632 30.849 1.00 0.00 C ATOM 63958 O12 PC 1550 81.297 101.539 30.697 1.00 0.00 O ATOM 63959 O11 PC 1550 82.112 103.548 29.917 1.00 0.00 O ATOM 63960 C1 PC 1550 82.184 103.055 28.563 1.00 0.00 C ATOM 63961 HR PC 1550 82.002 103.834 27.818 1.00 0.00 H ATOM 63962 HS PC 1550 81.432 102.300 28.321 1.00 0.00 H ATOM 63963 C2 PC 1550 83.537 102.341 28.211 1.00 0.00 C ATOM 63964 HX PC 1550 84.384 102.930 28.574 1.00 0.00 H ATOM 63965 C3 PC 1550 83.762 102.341 26.668 1.00 0.00 C ATOM 63966 HA PC 1550 84.723 101.944 26.333 1.00 0.00 H ATOM 63967 HB PC 1550 83.777 103.371 26.301 1.00 0.00 H ATOM 63968 O31 PC 1550 82.668 101.657 26.077 1.00 0.00 O ATOM 63969 P31 PC 1550 82.466 101.639 24.484 1.00 0.00 P ATOM 63970 O32 PC 1550 81.850 103.061 24.198 1.00 0.00 O ATOM 63971 C31 PC 1550 80.670 103.381 24.781 1.00 0.00 C ATOM 63972 H1A PC 1550 80.764 103.349 25.869 1.00 0.00 H ATOM 63973 H1B PC 1550 79.935 102.632 24.474 1.00 0.00 H ATOM 63974 C32 PC 1550 80.313 104.801 24.295 1.00 0.00 C ATOM 63975 H2A PC 1550 81.099 105.524 24.520 1.00 0.00 H ATOM 63976 H2B PC 1550 79.440 105.121 24.864 1.00 0.00 H ATOM 63977 N31 PC 1550 79.976 105.018 22.863 1.00 0.00 N ATOM 63978 C33 PC 1550 79.748 106.504 22.735 1.00 0.00 C ATOM 63979 H3A PC 1550 79.943 106.721 21.683 1.00 0.00 H ATOM 63980 H3B PC 1550 80.448 107.072 23.349 1.00 0.00 H ATOM 63981 H3C PC 1550 78.685 106.676 22.914 1.00 0.00 H ATOM 63982 C34 PC 1550 81.129 104.544 21.964 1.00 0.00 C ATOM 63983 H4A PC 1550 81.144 103.454 22.002 1.00 0.00 H ATOM 63984 H4B PC 1550 82.079 104.861 22.397 1.00 0.00 H ATOM 63985 H4C PC 1550 80.869 104.941 20.981 1.00 0.00 H ATOM 63986 C35 PC 1550 78.732 104.331 22.500 1.00 0.00 C ATOM 63987 H5A PC 1550 78.617 104.463 21.423 1.00 0.00 H ATOM 63988 H5B PC 1550 77.926 104.669 23.153 1.00 0.00 H ATOM 63989 H5C PC 1550 78.875 103.270 22.711 1.00 0.00 H ATOM 63990 O33 PC 1550 83.808 101.595 23.878 1.00 0.00 O ATOM 63991 O34 PC 1550 81.367 100.668 24.139 1.00 0.00 O ATOM 63992 O21 PC 1550 83.469 100.957 28.669 1.00 0.00 O ATOM 63993 C21 PC 1550 84.589 100.449 29.102 1.00 0.00 C ATOM 63994 O22 PC 1550 85.727 100.987 29.074 1.00 0.00 O ATOM 63995 C12 OL 1551 84.340 99.055 29.716 1.00 0.00 C ATOM 63996 H2R OL 1551 83.564 99.168 30.476 1.00 0.00 H ATOM 63997 H2S OL 1551 84.073 98.346 28.929 1.00 0.00 H ATOM 63998 C13 OL 1551 85.655 98.480 30.214 1.00 0.00 C ATOM 63999 H3R OL 1551 86.284 98.533 29.323 1.00 0.00 H ATOM 64000 H3S OL 1551 86.123 99.188 30.901 1.00 0.00 H ATOM 64001 C14 OL 1551 85.650 97.205 30.929 1.00 0.00 C ATOM 64002 H4R OL 1551 85.137 97.389 31.875 1.00 0.00 H ATOM 64003 H4S OL 1551 84.946 96.649 30.306 1.00 0.00 H ATOM 64004 C15 OL 1551 87.065 96.573 31.266 1.00 0.00 C ATOM 64005 H5R OL 1551 86.906 95.603 31.743 1.00 0.00 H ATOM 64006 H5S OL 1551 87.573 96.246 30.356 1.00 0.00 H ATOM 64007 C16 OL 1551 87.998 97.515 31.938 1.00 0.00 C ATOM 64008 H6R OL 1551 88.088 98.357 31.248 1.00 0.00 H ATOM 64009 H6S OL 1551 87.606 98.037 32.813 1.00 0.00 H ATOM 64010 C17 OL 1551 89.465 97.025 32.283 1.00 0.00 C ATOM 64011 H7R OL 1551 89.386 96.084 32.832 1.00 0.00 H ATOM 64012 H7S OL 1551 89.944 96.745 31.343 1.00 0.00 H ATOM 64013 C18 OL 1551 90.157 98.041 33.143 1.00 0.00 C ATOM 64014 H8R OL 1551 90.631 98.863 32.602 1.00 0.00 H ATOM 64015 H8S OL 1551 89.532 98.386 33.969 1.00 0.00 H ATOM 64016 C19 OL 1551 91.443 97.471 33.707 1.00 0.00 C ATOM 64017 H9R OL 1551 92.388 97.566 33.178 1.00 0.00 H ATOM 64018 C110 OL 1551 91.587 96.857 34.905 1.00 0.00 C ATOM 64019 H10R OL 1551 92.574 96.466 35.137 1.00 0.00 H ATOM 64020 C111 OL 1551 90.745 96.512 36.036 1.00 0.00 C ATOM 64021 H11R OL 1551 89.818 97.089 35.996 1.00 0.00 H ATOM 64022 H11S OL 1551 90.528 95.451 35.898 1.00 0.00 H ATOM 64023 C112 OL 1551 91.542 96.823 37.295 1.00 0.00 C ATOM 64024 H12R OL 1551 92.291 96.045 37.457 1.00 0.00 H ATOM 64025 H12S OL 1551 91.981 97.811 37.141 1.00 0.00 H ATOM 64026 C113 OL 1551 90.680 96.701 38.486 1.00 0.00 C ATOM 64027 H13R OL 1551 89.758 97.281 38.411 1.00 0.00 H ATOM 64028 H13S OL 1551 90.296 95.681 38.552 1.00 0.00 H ATOM 64029 C114 OL 1551 91.444 96.954 39.768 1.00 0.00 C ATOM 64030 H14R OL 1551 92.333 96.335 39.629 1.00 0.00 H ATOM 64031 H14S OL 1551 91.756 97.989 39.921 1.00 0.00 H ATOM 64032 C115 OL 1551 90.687 96.467 41.003 1.00 0.00 C ATOM 64033 H15R OL 1551 89.665 96.844 40.918 1.00 0.00 H ATOM 64034 H15S OL 1551 90.706 95.375 41.008 1.00 0.00 H ATOM 64035 C116 OL 1551 91.280 97.099 42.253 1.00 0.00 C ATOM 64036 H16R OL 1551 92.134 96.488 42.553 1.00 0.00 H ATOM 64037 H16S OL 1551 91.714 98.084 42.069 1.00 0.00 H ATOM 64038 C117 OL 1551 90.275 97.222 43.449 1.00 0.00 C ATOM 64039 H17R OL 1551 89.387 97.761 43.111 1.00 0.00 H ATOM 64040 H17S OL 1551 89.935 96.211 43.684 1.00 0.00 H ATOM 64041 C118 OL 1551 90.829 97.905 44.737 1.00 0.00 C ATOM 64042 H18R OL 1551 90.024 97.783 45.465 1.00 0.00 H ATOM 64043 H18S OL 1551 90.910 98.986 44.608 1.00 0.00 H ATOM 64044 H18T OL 1551 91.871 97.704 44.994 1.00 0.00 H TER 64045 OL 1551 ATOM 64045 C116 PA 1552 145.323 33.300 38.928 1.00 0.00 C ATOM 64046 H16R PA 1552 146.285 33.446 39.423 1.00 0.00 H ATOM 64047 H16S PA 1552 144.564 34.000 39.285 1.00 0.00 H ATOM 64048 H16T PA 1552 145.490 33.541 37.876 1.00 0.00 H ATOM 64049 C115 PA 1552 144.948 31.858 38.940 1.00 0.00 C ATOM 64050 H15R PA 1552 144.920 31.500 39.972 1.00 0.00 H ATOM 64051 H15S PA 1552 145.694 31.189 38.506 1.00 0.00 H ATOM 64052 C114 PA 1552 143.613 31.598 38.243 1.00 0.00 C ATOM 64053 H14R PA 1552 142.860 32.103 38.852 1.00 0.00 H ATOM 64054 H14S PA 1552 143.417 30.534 38.393 1.00 0.00 H ATOM 64055 C113 PA 1552 143.487 31.973 36.702 1.00 0.00 C ATOM 64056 H13R PA 1552 144.252 31.418 36.156 1.00 0.00 H ATOM 64057 H13S PA 1552 143.893 32.944 36.412 1.00 0.00 H ATOM 64058 C112 PA 1552 142.127 31.656 36.084 1.00 0.00 C ATOM 64059 H12R PA 1552 141.452 32.180 36.763 1.00 0.00 H ATOM 64060 H12S PA 1552 141.784 30.630 36.233 1.00 0.00 H ATOM 64061 C111 PA 1552 141.935 32.000 34.567 1.00 0.00 C ATOM 64062 H11R PA 1552 142.088 33.040 34.271 1.00 0.00 H ATOM 64063 H11S PA 1552 140.851 31.908 34.476 1.00 0.00 H ATOM 64064 C110 PA 1552 142.633 31.047 33.608 1.00 0.00 C ATOM 64065 H10R PA 1552 143.718 31.133 33.694 1.00 0.00 H ATOM 64066 H10S PA 1552 142.539 31.464 32.604 1.00 0.00 H ATOM 64067 C19 PA 1552 142.008 29.658 33.710 1.00 0.00 C ATOM 64068 H9R PA 1552 140.932 29.817 33.807 1.00 0.00 H ATOM 64069 H9S PA 1552 142.378 29.144 34.599 1.00 0.00 H ATOM 64070 C18 PA 1552 142.353 28.854 32.443 1.00 0.00 C ATOM 64071 H8R PA 1552 142.033 27.839 32.686 1.00 0.00 H ATOM 64072 H8S PA 1552 143.432 28.728 32.332 1.00 0.00 H ATOM 64073 C17 PA 1552 141.677 29.293 31.103 1.00 0.00 C ATOM 64074 H7R PA 1552 141.636 30.376 30.964 1.00 0.00 H ATOM 64075 H7S PA 1552 140.624 29.054 31.265 1.00 0.00 H ATOM 64076 C16 PA 1552 142.398 28.589 29.868 1.00 0.00 C ATOM 64077 H6R PA 1552 142.544 27.529 30.091 1.00 0.00 H ATOM 64078 H6S PA 1552 143.446 28.892 29.920 1.00 0.00 H ATOM 64079 C15 PA 1552 141.759 28.805 28.498 1.00 0.00 C ATOM 64080 H5R PA 1552 141.751 29.885 28.335 1.00 0.00 H ATOM 64081 H5S PA 1552 140.736 28.449 28.635 1.00 0.00 H ATOM 64082 C14 PA 1552 142.396 28.089 27.319 1.00 0.00 C ATOM 64083 H4R PA 1552 142.381 27.070 27.712 1.00 0.00 H ATOM 64084 H4S PA 1552 143.449 28.234 27.067 1.00 0.00 H ATOM 64085 C13 PA 1552 141.454 28.143 26.119 1.00 0.00 C ATOM 64086 H3R PA 1552 141.456 29.114 25.619 1.00 0.00 H ATOM 64087 H3S PA 1552 140.436 27.858 26.391 1.00 0.00 H ATOM 64088 C12 PA 1552 141.940 27.061 25.158 1.00 0.00 C ATOM 64089 H2R PA 1552 143.022 27.035 25.015 1.00 0.00 H ATOM 64090 H2S PA 1552 141.693 26.082 25.574 1.00 0.00 H ATOM 64091 C11 PGR 1553 141.266 27.293 23.795 1.00 0.00 C ATOM 64092 O12 PGR 1553 140.440 26.501 23.333 1.00 0.00 O ATOM 64093 O11 PGR 1553 141.653 28.432 23.098 1.00 0.00 O ATOM 64094 C1 PGR 1553 141.057 28.701 21.701 1.00 0.00 C ATOM 64095 HR PGR 1553 140.058 29.133 21.811 1.00 0.00 H ATOM 64096 HS PGR 1553 140.890 27.757 21.177 1.00 0.00 H ATOM 64097 C2 PGR 1553 142.011 29.509 20.824 1.00 0.00 C ATOM 64098 HX PGR 1553 141.609 29.570 19.809 1.00 0.00 H ATOM 64099 C3 PGR 1553 143.410 29.004 20.906 1.00 0.00 C ATOM 64100 HA PGR 1553 143.366 27.914 20.836 1.00 0.00 H ATOM 64101 HB PGR 1553 143.837 29.140 21.903 1.00 0.00 H ATOM 64102 O31 PGR 1553 144.323 29.561 19.993 1.00 0.00 O ATOM 64103 P31 PGR 1553 144.120 29.480 18.455 1.00 0.00 P ATOM 64104 O32 PGR 1553 143.181 30.717 18.074 1.00 0.00 O ATOM 64105 C31 PGR 1553 143.728 32.073 18.063 1.00 0.00 C ATOM 64106 H1A PGR 1553 143.885 32.413 19.090 1.00 0.00 H ATOM 64107 H1B PGR 1553 144.634 32.273 17.484 1.00 0.00 H ATOM 64108 C32 PGR 1553 142.707 33.152 17.516 1.00 0.00 C ATOM 64109 H2A PGR 1553 141.823 33.031 18.147 1.00 0.00 H ATOM 64110 O35 PGR 1553 142.343 32.849 16.170 1.00 0.00 O ATOM 64111 HO5A PGR 1553 142.701 32.011 15.827 1.00 0.00 H ATOM 64112 C33 PGR 1553 143.241 34.603 17.610 1.00 0.00 C ATOM 64113 H3A PGR 1553 142.522 35.245 17.095 1.00 0.00 H ATOM 64114 H3B PGR 1553 143.389 34.829 18.669 1.00 0.00 H ATOM 64115 O33 PGR 1553 145.328 29.700 17.658 1.00 0.00 O ATOM 64116 O34 PGR 1553 143.282 28.201 18.178 1.00 0.00 O ATOM 64117 O21 PGR 1553 142.065 30.868 21.325 1.00 0.00 O ATOM 64118 C21 PGR 1553 141.083 31.722 21.139 1.00 0.00 C ATOM 64119 O22 PGR 1553 140.123 31.575 20.434 1.00 0.00 O ATOM 64120 O36 PGR 1553 144.468 34.755 16.871 1.00 0.00 O ATOM 64121 HO6A PGR 1553 144.265 34.591 15.932 1.00 0.00 H ATOM 64122 C12 OL 1554 141.143 32.942 22.027 1.00 0.00 C ATOM 64123 H2R OL 1554 142.204 33.080 22.245 1.00 0.00 H ATOM 64124 H2S OL 1554 140.822 33.804 21.438 1.00 0.00 H ATOM 64125 C13 OL 1554 140.370 32.762 23.252 1.00 0.00 C ATOM 64126 H3R OL 1554 140.304 33.800 23.586 1.00 0.00 H ATOM 64127 H3S OL 1554 139.339 32.476 23.033 1.00 0.00 H ATOM 64128 C14 OL 1554 140.824 31.710 24.308 1.00 0.00 C ATOM 64129 H4R OL 1554 140.124 30.887 24.155 1.00 0.00 H ATOM 64130 H4S OL 1554 141.842 31.407 24.054 1.00 0.00 H ATOM 64131 C15 OL 1554 140.782 32.099 25.817 1.00 0.00 C ATOM 64132 H5R OL 1554 139.821 32.576 26.024 1.00 0.00 H ATOM 64133 H5S OL 1554 140.941 31.204 26.422 1.00 0.00 H ATOM 64134 C16 OL 1554 141.905 33.117 26.081 1.00 0.00 C ATOM 64135 H6R OL 1554 142.807 32.651 25.680 1.00 0.00 H ATOM 64136 H6S OL 1554 141.707 33.927 25.375 1.00 0.00 H ATOM 64137 C17 OL 1554 142.050 33.539 27.511 1.00 0.00 C ATOM 64138 H7R OL 1554 141.038 33.929 27.639 1.00 0.00 H ATOM 64139 H7S OL 1554 142.156 32.697 28.198 1.00 0.00 H ATOM 64140 C18 OL 1554 143.121 34.568 27.752 1.00 0.00 C ATOM 64141 H8R OL 1554 144.114 34.234 27.444 1.00 0.00 H ATOM 64142 H8S OL 1554 142.891 35.490 27.212 1.00 0.00 H ATOM 64143 C19 OL 1554 143.082 34.692 29.230 1.00 0.00 C ATOM 64144 H9R OL 1554 142.968 33.714 29.692 1.00 0.00 H ATOM 64145 C110 OL 1554 143.041 35.791 30.035 1.00 0.00 C ATOM 64146 H10R OL 1554 142.865 35.657 31.099 1.00 0.00 H ATOM 64147 C111 OL 1554 143.205 37.139 29.480 1.00 0.00 C ATOM 64148 H11R OL 1554 143.381 37.177 28.403 1.00 0.00 H ATOM 64149 H11S OL 1554 142.248 37.664 29.432 1.00 0.00 H ATOM 64150 C112 OL 1554 144.143 38.042 30.310 1.00 0.00 C ATOM 64151 H12R OL 1554 145.070 37.544 30.603 1.00 0.00 H ATOM 64152 H12S OL 1554 144.537 38.918 29.790 1.00 0.00 H ATOM 64153 C113 OL 1554 143.352 38.541 31.552 1.00 0.00 C ATOM 64154 H13R OL 1554 142.619 37.778 31.824 1.00 0.00 H ATOM 64155 H13S OL 1554 144.132 38.397 32.303 1.00 0.00 H ATOM 64156 C114 OL 1554 142.794 39.916 31.472 1.00 0.00 C ATOM 64157 H14R OL 1554 143.600 40.489 31.010 1.00 0.00 H ATOM 64158 H14S OL 1554 141.990 39.806 30.740 1.00 0.00 H ATOM 64159 C115 OL 1554 142.179 40.497 32.815 1.00 0.00 C ATOM 64160 H15R OL 1554 141.520 41.283 32.441 1.00 0.00 H ATOM 64161 H15S OL 1554 141.397 39.813 33.150 1.00 0.00 H ATOM 64162 C116 OL 1554 142.983 40.809 33.984 1.00 0.00 C ATOM 64163 H16R OL 1554 143.446 39.958 34.489 1.00 0.00 H ATOM 64164 H16S OL 1554 143.843 41.209 33.443 1.00 0.00 H ATOM 64165 C117 OL 1554 142.444 41.943 34.815 1.00 0.00 C ATOM 64166 H17R OL 1554 141.922 42.635 34.149 1.00 0.00 H ATOM 64167 H17S OL 1554 141.663 41.587 35.490 1.00 0.00 H ATOM 64168 C118 OL 1554 143.396 42.759 35.494 1.00 0.00 C ATOM 64169 H18R OL 1554 143.965 43.442 34.860 1.00 0.00 H ATOM 64170 H18S OL 1554 144.177 42.228 36.042 1.00 0.00 H ATOM 64171 H18T OL 1554 142.906 43.517 36.110 1.00 0.00 H TER 64172 OL 1554 ATOM 64172 C116 PA 1555 82.806 91.338 40.769 1.00 0.00 C ATOM 64173 H16R PA 1555 83.251 92.040 41.477 1.00 0.00 H ATOM 64174 H16S PA 1555 81.748 91.221 41.013 1.00 0.00 H ATOM 64175 H16T PA 1555 82.912 91.844 39.807 1.00 0.00 H ATOM 64176 C115 PA 1555 83.509 89.966 40.763 1.00 0.00 C ATOM 64177 H15R PA 1555 83.633 89.578 41.776 1.00 0.00 H ATOM 64178 H15S PA 1555 84.525 90.159 40.414 1.00 0.00 H ATOM 64179 C114 PA 1555 82.858 88.977 39.824 1.00 0.00 C ATOM 64180 H14R PA 1555 82.839 89.431 38.831 1.00 0.00 H ATOM 64181 H14S PA 1555 81.879 88.695 40.216 1.00 0.00 H ATOM 64182 C113 PA 1555 83.542 87.592 39.646 1.00 0.00 C ATOM 64183 H13R PA 1555 82.802 86.942 39.175 1.00 0.00 H ATOM 64184 H13S PA 1555 83.833 87.231 40.635 1.00 0.00 H ATOM 64185 C112 PA 1555 84.765 87.553 38.710 1.00 0.00 C ATOM 64186 H12R PA 1555 85.426 88.389 38.944 1.00 0.00 H ATOM 64187 H12S PA 1555 84.380 87.879 37.742 1.00 0.00 H ATOM 64188 C111 PA 1555 85.506 86.222 38.976 1.00 0.00 C ATOM 64189 H11R PA 1555 84.724 85.468 38.871 1.00 0.00 H ATOM 64190 H11S PA 1555 85.883 86.242 40.000 1.00 0.00 H ATOM 64191 C110 PA 1555 86.666 86.091 38.005 1.00 0.00 C ATOM 64192 H10R PA 1555 87.330 86.948 38.142 1.00 0.00 H ATOM 64193 H10S PA 1555 86.190 86.139 37.023 1.00 0.00 H ATOM 64194 C19 PA 1555 87.424 84.798 38.093 1.00 0.00 C ATOM 64195 H9R PA 1555 86.799 84.063 38.604 1.00 0.00 H ATOM 64196 H9S PA 1555 88.117 85.198 38.836 1.00 0.00 H ATOM 64197 C18 PA 1555 88.103 84.391 36.773 1.00 0.00 C ATOM 64198 H8R PA 1555 87.276 84.061 36.141 1.00 0.00 H ATOM 64199 H8S PA 1555 88.782 83.548 36.918 1.00 0.00 H ATOM 64200 C17 PA 1555 88.758 85.493 35.985 1.00 0.00 C ATOM 64201 H7R PA 1555 89.532 85.939 36.615 1.00 0.00 H ATOM 64202 H7S PA 1555 88.238 86.453 35.945 1.00 0.00 H ATOM 64203 C16 PA 1555 89.164 85.055 34.485 1.00 0.00 C ATOM 64204 H6R PA 1555 88.399 84.605 33.848 1.00 0.00 H ATOM 64205 H6S PA 1555 90.013 84.376 34.590 1.00 0.00 H ATOM 64206 C15 PA 1555 89.770 86.208 33.646 1.00 0.00 C ATOM 64207 H5R PA 1555 90.712 86.551 34.078 1.00 0.00 H ATOM 64208 H5S PA 1555 89.153 87.108 33.594 1.00 0.00 H ATOM 64209 C14 PA 1555 90.070 85.852 32.160 1.00 0.00 C ATOM 64210 H4R PA 1555 89.162 85.913 31.557 1.00 0.00 H ATOM 64211 H4S PA 1555 90.603 84.898 32.173 1.00 0.00 H ATOM 64212 C13 PA 1555 91.077 86.726 31.386 1.00 0.00 C ATOM 64213 H3R PA 1555 91.105 86.299 30.381 1.00 0.00 H ATOM 64214 H3S PA 1555 92.037 86.574 31.884 1.00 0.00 H ATOM 64215 C12 PA 1555 90.607 88.174 31.211 1.00 0.00 C ATOM 64216 H2R PA 1555 90.906 88.756 32.085 1.00 0.00 H ATOM 64217 H2S PA 1555 89.515 88.142 31.205 1.00 0.00 H ATOM 64218 C11 PGR 1556 91.232 88.831 29.958 1.00 0.00 C ATOM 64219 O12 PGR 1556 90.903 88.591 28.755 1.00 0.00 O ATOM 64220 O11 PGR 1556 92.150 89.732 30.173 1.00 0.00 O ATOM 64221 C1 PGR 1556 92.793 90.432 29.075 1.00 0.00 C ATOM 64222 HR PGR 1556 92.985 89.609 28.381 1.00 0.00 H ATOM 64223 HS PGR 1556 93.740 90.865 29.404 1.00 0.00 H ATOM 64224 C2 PGR 1556 91.915 91.521 28.494 1.00 0.00 C ATOM 64225 HX PGR 1556 90.987 91.035 28.183 1.00 0.00 H ATOM 64226 C3 PGR 1556 92.513 92.351 27.363 1.00 0.00 C ATOM 64227 HA PGR 1556 93.602 92.284 27.307 1.00 0.00 H ATOM 64228 HB PGR 1556 92.286 93.420 27.377 1.00 0.00 H ATOM 64229 O31 PGR 1556 92.014 91.732 26.185 1.00 0.00 O ATOM 64230 P31 PGR 1556 92.453 92.144 24.708 1.00 0.00 P ATOM 64231 O32 PGR 1556 93.947 91.665 24.634 1.00 0.00 O ATOM 64232 C31 PGR 1556 94.196 90.313 24.821 1.00 0.00 C ATOM 64233 H1A PGR 1556 93.614 89.665 24.161 1.00 0.00 H ATOM 64234 H1B PGR 1556 93.921 89.966 25.821 1.00 0.00 H ATOM 64235 C32 PGR 1556 95.688 89.936 24.682 1.00 0.00 C ATOM 64236 H2A PGR 1556 95.803 88.981 24.161 1.00 0.00 H ATOM 64237 O35 PGR 1556 96.312 89.878 25.939 1.00 0.00 O ATOM 64238 HO5A PGR 1556 96.252 88.936 26.183 1.00 0.00 H ATOM 64239 C33 PGR 1556 96.453 91.037 23.856 1.00 0.00 C ATOM 64240 H3A PGR 1556 96.296 90.986 22.775 1.00 0.00 H ATOM 64241 H3B PGR 1556 96.209 92.059 24.154 1.00 0.00 H ATOM 64242 O33 PGR 1556 91.715 91.283 23.698 1.00 0.00 O ATOM 64243 O34 PGR 1556 92.331 93.635 24.615 1.00 0.00 O ATOM 64244 O21 PGR 1556 91.551 92.455 29.494 1.00 0.00 O ATOM 64245 C21 PGR 1556 90.574 92.220 30.352 1.00 0.00 C ATOM 64246 O22 PGR 1556 89.865 91.193 30.344 1.00 0.00 O ATOM 64247 O36 PGR 1556 97.872 90.750 23.948 1.00 0.00 O ATOM 64248 HO6A PGR 1556 98.124 90.527 24.862 1.00 0.00 H ATOM 64249 C12 OL 1557 90.285 93.296 31.361 1.00 0.00 C ATOM 64250 H2R OL 1557 90.839 94.186 31.057 1.00 0.00 H ATOM 64251 H2S OL 1557 89.206 93.439 31.450 1.00 0.00 H ATOM 64252 C13 OL 1557 90.846 92.792 32.731 1.00 0.00 C ATOM 64253 H3R OL 1557 91.921 92.724 32.551 1.00 0.00 H ATOM 64254 H3S OL 1557 90.833 93.634 33.427 1.00 0.00 H ATOM 64255 C14 OL 1557 90.302 91.512 33.396 1.00 0.00 C ATOM 64256 H4R OL 1557 89.216 91.624 33.351 1.00 0.00 H ATOM 64257 H4S OL 1557 90.642 90.680 32.775 1.00 0.00 H ATOM 64258 C15 OL 1557 90.763 91.284 34.823 1.00 0.00 C ATOM 64259 H5R OL 1557 91.835 91.075 34.832 1.00 0.00 H ATOM 64260 H5S OL 1557 90.363 92.143 35.365 1.00 0.00 H ATOM 64261 C16 OL 1557 90.037 90.040 35.510 1.00 0.00 C ATOM 64262 H6R OL 1557 89.748 89.392 34.680 1.00 0.00 H ATOM 64263 H6S OL 1557 90.775 89.672 36.226 1.00 0.00 H ATOM 64264 C17 OL 1557 88.873 90.511 36.408 1.00 0.00 C ATOM 64265 H7R OL 1557 89.188 91.367 37.007 1.00 0.00 H ATOM 64266 H7S OL 1557 87.951 90.770 35.881 1.00 0.00 H ATOM 64267 C18 OL 1557 88.463 89.498 37.526 1.00 0.00 C ATOM 64268 H8R OL 1557 88.025 88.676 36.955 1.00 0.00 H ATOM 64269 H8S OL 1557 89.327 89.197 38.122 1.00 0.00 H ATOM 64270 C19 OL 1557 87.336 90.139 38.288 1.00 0.00 C ATOM 64271 H9R OL 1557 86.406 90.296 37.747 1.00 0.00 H ATOM 64272 C110 OL 1557 87.408 90.468 39.584 1.00 0.00 C ATOM 64273 H10R OL 1557 86.611 91.045 40.045 1.00 0.00 H ATOM 64274 C111 OL 1557 88.589 90.103 40.518 1.00 0.00 C ATOM 64275 H11R OL 1557 88.208 89.751 41.479 1.00 0.00 H ATOM 64276 H11S OL 1557 89.245 89.345 40.085 1.00 0.00 H ATOM 64277 C112 OL 1557 89.443 91.301 40.692 1.00 0.00 C ATOM 64278 H12R OL 1557 89.734 91.699 39.717 1.00 0.00 H ATOM 64279 H12S OL 1557 88.834 92.086 41.145 1.00 0.00 H ATOM 64280 C113 OL 1557 90.687 91.098 41.594 1.00 0.00 C ATOM 64281 H13R OL 1557 90.288 90.882 42.587 1.00 0.00 H ATOM 64282 H13S OL 1557 91.340 90.269 41.312 1.00 0.00 H ATOM 64283 C114 OL 1557 91.320 92.422 41.880 1.00 0.00 C ATOM 64284 H14R OL 1557 91.323 92.907 40.902 1.00 0.00 H ATOM 64285 H14S OL 1557 90.765 92.962 42.651 1.00 0.00 H ATOM 64286 C115 OL 1557 92.826 92.281 42.235 1.00 0.00 C ATOM 64287 H15R OL 1557 92.833 91.894 43.256 1.00 0.00 H ATOM 64288 H15S OL 1557 93.388 91.569 41.628 1.00 0.00 H ATOM 64289 C116 OL 1557 93.693 93.605 42.341 1.00 0.00 C ATOM 64290 H16R OL 1557 93.125 94.419 42.797 1.00 0.00 H ATOM 64291 H16S OL 1557 94.421 93.503 43.149 1.00 0.00 H ATOM 64292 C117 OL 1557 94.404 94.013 41.107 1.00 0.00 C ATOM 64293 H17R OL 1557 95.107 93.214 40.860 1.00 0.00 H ATOM 64294 H17S OL 1557 93.648 94.012 40.318 1.00 0.00 H ATOM 64295 C118 OL 1557 95.034 95.432 41.313 1.00 0.00 C ATOM 64296 H18R OL 1557 95.342 95.816 42.287 1.00 0.00 H ATOM 64297 H18S OL 1557 94.275 96.193 41.118 1.00 0.00 H ATOM 64298 H18T OL 1557 95.924 95.620 40.709 1.00 0.00 H TER 64299 OL 1557 ATOM 64299 C116 PA 1558 146.351 121.299 37.742 1.00 0.00 C ATOM 64300 H16R PA 1558 146.710 122.219 38.210 1.00 0.00 H ATOM 64301 H16S PA 1558 147.166 120.885 37.145 1.00 0.00 H ATOM 64302 H16T PA 1558 145.969 120.646 38.529 1.00 0.00 H ATOM 64303 C115 PA 1558 145.497 121.514 36.572 1.00 0.00 C ATOM 64304 H15R PA 1558 144.481 121.669 36.941 1.00 0.00 H ATOM 64305 H15S PA 1558 145.384 120.704 35.849 1.00 0.00 H ATOM 64306 C114 PA 1558 145.928 122.592 35.673 1.00 0.00 C ATOM 64307 H14R PA 1558 146.863 122.377 35.152 1.00 0.00 H ATOM 64308 H14S PA 1558 146.005 123.557 36.176 1.00 0.00 H ATOM 64309 C113 PA 1558 144.942 122.766 34.563 1.00 0.00 C ATOM 64310 H13R PA 1558 144.013 122.599 35.113 1.00 0.00 H ATOM 64311 H13S PA 1558 145.083 121.925 33.881 1.00 0.00 H ATOM 64312 C112 PA 1558 144.960 124.099 33.786 1.00 0.00 C ATOM 64313 H12R PA 1558 145.968 124.212 33.382 1.00 0.00 H ATOM 64314 H12S PA 1558 144.822 124.845 34.572 1.00 0.00 H ATOM 64315 C111 PA 1558 143.914 124.285 32.669 1.00 0.00 C ATOM 64316 H11R PA 1558 142.906 124.028 33.002 1.00 0.00 H ATOM 64317 H11S PA 1558 144.086 123.525 31.904 1.00 0.00 H ATOM 64318 C110 PA 1558 143.820 125.605 32.041 1.00 0.00 C ATOM 64319 H10R PA 1558 143.288 125.437 31.102 1.00 0.00 H ATOM 64320 H10S PA 1558 144.795 125.923 31.664 1.00 0.00 H ATOM 64321 C19 PA 1558 143.106 126.730 32.843 1.00 0.00 C ATOM 64322 H9R PA 1558 143.728 127.117 33.652 1.00 0.00 H ATOM 64323 H9S PA 1558 142.154 126.466 33.308 1.00 0.00 H ATOM 64324 C18 PA 1558 142.638 127.933 31.975 1.00 0.00 C ATOM 64325 H8R PA 1558 142.161 128.656 32.639 1.00 0.00 H ATOM 64326 H8S PA 1558 141.791 127.650 31.348 1.00 0.00 H ATOM 64327 C17 PA 1558 143.638 128.756 31.121 1.00 0.00 C ATOM 64328 H7R PA 1558 144.056 128.258 30.243 1.00 0.00 H ATOM 64329 H7S PA 1558 144.421 128.917 31.864 1.00 0.00 H ATOM 64330 C16 PA 1558 143.106 130.016 30.599 1.00 0.00 C ATOM 64331 H6R PA 1558 142.675 130.621 31.400 1.00 0.00 H ATOM 64332 H6S PA 1558 142.139 129.748 30.169 1.00 0.00 H ATOM 64333 C15 PA 1558 143.953 130.798 29.570 1.00 0.00 C ATOM 64334 H5R PA 1558 143.277 131.625 29.345 1.00 0.00 H ATOM 64335 H5S PA 1558 144.221 130.252 28.663 1.00 0.00 H ATOM 64336 C14 PA 1558 145.163 131.596 30.008 1.00 0.00 C ATOM 64337 H4R PA 1558 144.817 132.368 30.698 1.00 0.00 H ATOM 64338 H4S PA 1558 145.470 132.160 29.125 1.00 0.00 H ATOM 64339 C13 PA 1558 146.350 130.861 30.666 1.00 0.00 C ATOM 64340 H3R PA 1558 146.377 129.884 30.180 1.00 0.00 H ATOM 64341 H3S PA 1558 146.002 130.595 31.666 1.00 0.00 H ATOM 64342 C12 PA 1558 147.773 131.531 30.644 1.00 0.00 C ATOM 64343 H2R PA 1558 148.432 130.913 31.259 1.00 0.00 H ATOM 64344 H2S PA 1558 147.755 132.533 31.078 1.00 0.00 H ATOM 64345 C11 PGR 1559 148.329 131.488 29.265 1.00 0.00 C ATOM 64346 O12 PGR 1559 147.760 130.878 28.362 1.00 0.00 O ATOM 64347 O11 PGR 1559 149.525 132.126 29.082 1.00 0.00 O ATOM 64348 C1 PGR 1559 149.924 132.083 27.687 1.00 0.00 C ATOM 64349 HR PGR 1559 149.997 131.037 27.376 1.00 0.00 H ATOM 64350 HS PGR 1559 150.929 132.509 27.633 1.00 0.00 H ATOM 64351 C2 PGR 1559 149.063 132.876 26.634 1.00 0.00 C ATOM 64352 HX PGR 1559 148.097 132.381 26.500 1.00 0.00 H ATOM 64353 C3 PGR 1559 149.786 132.971 25.219 1.00 0.00 C ATOM 64354 HA PGR 1559 150.304 132.017 25.093 1.00 0.00 H ATOM 64355 HB PGR 1559 150.514 133.779 25.111 1.00 0.00 H ATOM 64356 O31 PGR 1559 148.742 133.151 24.261 1.00 0.00 O ATOM 64357 P31 PGR 1559 149.027 133.068 22.722 1.00 0.00 P ATOM 64358 O32 PGR 1559 149.282 134.563 22.369 1.00 0.00 O ATOM 64359 C31 PGR 1559 148.290 135.525 21.988 1.00 0.00 C ATOM 64360 H1A PGR 1559 147.495 135.553 22.738 1.00 0.00 H ATOM 64361 H1B PGR 1559 147.908 135.400 20.972 1.00 0.00 H ATOM 64362 C32 PGR 1559 149.024 136.897 22.081 1.00 0.00 C ATOM 64363 H2A PGR 1559 148.338 137.722 22.291 1.00 0.00 H ATOM 64364 O35 PGR 1559 149.772 137.119 20.844 1.00 0.00 O ATOM 64365 HO5A PGR 1559 150.060 138.049 20.842 1.00 0.00 H ATOM 64366 C33 PGR 1559 149.989 136.956 23.335 1.00 0.00 C ATOM 64367 H3A PGR 1559 149.612 136.318 24.139 1.00 0.00 H ATOM 64368 H3B PGR 1559 150.973 136.545 23.096 1.00 0.00 H ATOM 64369 O33 PGR 1559 150.264 132.399 22.481 1.00 0.00 O ATOM 64370 O34 PGR 1559 147.801 132.651 22.073 1.00 0.00 O ATOM 64371 O21 PGR 1559 148.981 134.266 27.092 1.00 0.00 O ATOM 64372 C21 PGR 1559 147.945 134.491 27.850 1.00 0.00 C ATOM 64373 O22 PGR 1559 147.023 133.755 28.003 1.00 0.00 O ATOM 64374 O36 PGR 1559 150.166 138.310 23.692 1.00 0.00 O ATOM 64375 HO6A PGR 1559 150.400 138.997 23.043 1.00 0.00 H ATOM 64376 C12 OL 1560 148.010 135.764 28.613 1.00 0.00 C ATOM 64377 H2R OL 1560 148.560 135.621 29.546 1.00 0.00 H ATOM 64378 H2S OL 1560 148.663 136.319 27.936 1.00 0.00 H ATOM 64379 C13 OL 1560 146.629 136.293 28.646 1.00 0.00 C ATOM 64380 H3R OL 1560 146.275 136.278 27.613 1.00 0.00 H ATOM 64381 H3S OL 1560 146.026 135.558 29.183 1.00 0.00 H ATOM 64382 C14 OL 1560 146.498 137.733 29.186 1.00 0.00 C ATOM 64383 H4R OL 1560 146.929 137.762 30.189 1.00 0.00 H ATOM 64384 H4S OL 1560 147.245 138.337 28.666 1.00 0.00 H ATOM 64385 C15 OL 1560 145.238 138.451 29.043 1.00 0.00 C ATOM 64386 H5R OL 1560 145.178 138.882 28.042 1.00 0.00 H ATOM 64387 H5S OL 1560 144.372 137.792 29.124 1.00 0.00 H ATOM 64388 C16 OL 1560 145.220 139.548 30.046 1.00 0.00 C ATOM 64389 H6R OL 1560 145.408 139.089 31.019 1.00 0.00 H ATOM 64390 H6S OL 1560 146.058 140.232 29.891 1.00 0.00 H ATOM 64391 C17 OL 1560 143.975 140.424 30.008 1.00 0.00 C ATOM 64392 H7R OL 1560 143.691 140.815 29.029 1.00 0.00 H ATOM 64393 H7S OL 1560 143.164 139.788 30.368 1.00 0.00 H ATOM 64394 C18 OL 1560 144.164 141.644 30.927 1.00 0.00 C ATOM 64395 H8R OL 1560 145.037 141.481 31.561 1.00 0.00 H ATOM 64396 H8S OL 1560 144.371 142.538 30.335 1.00 0.00 H ATOM 64397 C19 OL 1560 142.978 141.802 31.829 1.00 0.00 C ATOM 64398 H9R OL 1560 142.125 142.269 31.343 1.00 0.00 H ATOM 64399 C110 OL 1560 142.813 141.297 33.061 1.00 0.00 C ATOM 64400 H10R OL 1560 141.835 141.475 33.503 1.00 0.00 H ATOM 64401 C111 OL 1560 143.757 140.387 33.844 1.00 0.00 C ATOM 64402 H11R OL 1560 144.638 140.147 33.245 1.00 0.00 H ATOM 64403 H11S OL 1560 144.104 140.908 34.739 1.00 0.00 H ATOM 64404 C112 OL 1560 143.056 139.107 34.265 1.00 0.00 C ATOM 64405 H12R OL 1560 143.591 138.612 35.078 1.00 0.00 H ATOM 64406 H12S OL 1560 142.160 139.556 34.699 1.00 0.00 H ATOM 64407 C113 OL 1560 142.829 138.076 33.158 1.00 0.00 C ATOM 64408 H13R OL 1560 142.366 138.524 32.277 1.00 0.00 H ATOM 64409 H13S OL 1560 143.866 137.999 32.824 1.00 0.00 H ATOM 64410 C114 OL 1560 142.178 136.812 33.615 1.00 0.00 C ATOM 64411 H14R OL 1560 142.875 136.090 34.045 1.00 0.00 H ATOM 64412 H14S OL 1560 141.378 137.093 34.304 1.00 0.00 H ATOM 64413 C115 OL 1560 141.624 136.016 32.456 1.00 0.00 C ATOM 64414 H15R OL 1560 141.128 135.103 32.791 1.00 0.00 H ATOM 64415 H15S OL 1560 140.882 136.689 32.022 1.00 0.00 H ATOM 64416 C116 OL 1560 142.747 135.559 31.391 1.00 0.00 C ATOM 64417 H16R OL 1560 143.261 136.414 30.947 1.00 0.00 H ATOM 64418 H16S OL 1560 143.498 134.871 31.785 1.00 0.00 H ATOM 64419 C117 OL 1560 142.094 134.931 30.171 1.00 0.00 C ATOM 64420 H17R OL 1560 141.731 133.946 30.470 1.00 0.00 H ATOM 64421 H17S OL 1560 141.160 135.409 29.869 1.00 0.00 H ATOM 64422 C118 OL 1560 143.069 134.810 28.919 1.00 0.00 C ATOM 64423 H18R OL 1560 143.993 134.342 29.266 1.00 0.00 H ATOM 64424 H18S OL 1560 143.344 135.741 28.419 1.00 0.00 H ATOM 64425 H18T OL 1560 142.700 134.175 28.111 1.00 0.00 H TER 64426 OL 1560 ATOM 64426 C116 PA 1561 119.466 11.695 36.177 1.00 0.00 C ATOM 64427 H16R PA 1561 119.343 12.663 35.687 1.00 0.00 H ATOM 64428 H16S PA 1561 119.315 11.891 37.240 1.00 0.00 H ATOM 64429 H16T PA 1561 118.619 11.121 35.794 1.00 0.00 H ATOM 64430 C115 PA 1561 120.785 10.960 35.964 1.00 0.00 C ATOM 64431 H15R PA 1561 120.910 10.126 36.658 1.00 0.00 H ATOM 64432 H15S PA 1561 121.513 11.724 36.243 1.00 0.00 H ATOM 64433 C114 PA 1561 121.018 10.609 34.468 1.00 0.00 C ATOM 64434 H14R PA 1561 120.990 11.532 33.884 1.00 0.00 H ATOM 64435 H14S PA 1561 120.179 10.000 34.125 1.00 0.00 H ATOM 64436 C113 PA 1561 122.302 9.791 34.326 1.00 0.00 C ATOM 64437 H13R PA 1561 122.346 8.812 34.807 1.00 0.00 H ATOM 64438 H13S PA 1561 123.053 10.384 34.852 1.00 0.00 H ATOM 64439 C112 PA 1561 122.783 9.545 32.940 1.00 0.00 C ATOM 64440 H12R PA 1561 121.999 8.909 32.525 1.00 0.00 H ATOM 64441 H12S PA 1561 123.672 8.918 32.849 1.00 0.00 H ATOM 64442 C111 PA 1561 123.003 10.784 32.020 1.00 0.00 C ATOM 64443 H11R PA 1561 123.800 11.358 32.498 1.00 0.00 H ATOM 64444 H11S PA 1561 122.152 11.466 31.965 1.00 0.00 H ATOM 64445 C110 PA 1561 123.217 10.225 30.542 1.00 0.00 C ATOM 64446 H10R PA 1561 123.837 9.330 30.619 1.00 0.00 H ATOM 64447 H10S PA 1561 123.864 10.899 29.977 1.00 0.00 H ATOM 64448 C19 PA 1561 121.836 10.103 29.832 1.00 0.00 C ATOM 64449 H9R PA 1561 121.244 11.016 29.749 1.00 0.00 H ATOM 64450 H9S PA 1561 121.094 9.402 30.221 1.00 0.00 H ATOM 64451 C18 PA 1561 121.964 9.662 28.314 1.00 0.00 C ATOM 64452 H8R PA 1561 122.814 10.246 27.955 1.00 0.00 H ATOM 64453 H8S PA 1561 121.042 9.964 27.812 1.00 0.00 H ATOM 64454 C17 PA 1561 122.263 8.205 28.062 1.00 0.00 C ATOM 64455 H7R PA 1561 121.509 7.606 28.577 1.00 0.00 H ATOM 64456 H7S PA 1561 123.238 8.004 28.511 1.00 0.00 H ATOM 64457 C16 PA 1561 122.389 7.789 26.668 1.00 0.00 C ATOM 64458 H6R PA 1561 123.094 8.421 26.124 1.00 0.00 H ATOM 64459 H6S PA 1561 121.374 7.978 26.312 1.00 0.00 H ATOM 64460 C15 PA 1561 122.901 6.401 26.360 1.00 0.00 C ATOM 64461 H5R PA 1561 122.832 6.331 25.272 1.00 0.00 H ATOM 64462 H5S PA 1561 122.108 5.813 26.826 1.00 0.00 H ATOM 64463 C14 PA 1561 124.336 6.121 26.876 1.00 0.00 C ATOM 64464 H4R PA 1561 124.206 5.169 27.394 1.00 0.00 H ATOM 64465 H4S PA 1561 124.740 6.739 27.681 1.00 0.00 H ATOM 64466 C13 PA 1561 125.396 5.950 25.826 1.00 0.00 C ATOM 64467 H3R PA 1561 124.973 5.284 25.071 1.00 0.00 H ATOM 64468 H3S PA 1561 126.279 5.477 26.260 1.00 0.00 H ATOM 64469 C12 PA 1561 125.793 7.205 25.092 1.00 0.00 C ATOM 64470 H2R PA 1561 126.223 7.977 25.733 1.00 0.00 H ATOM 64471 H2S PA 1561 124.953 7.710 24.610 1.00 0.00 H ATOM 64472 C11 PGR 1562 126.809 6.934 24.079 1.00 0.00 C ATOM 64473 O12 PGR 1562 126.867 5.934 23.403 1.00 0.00 O ATOM 64474 O11 PGR 1562 127.581 7.989 23.952 1.00 0.00 O ATOM 64475 C1 PGR 1562 128.534 8.015 22.878 1.00 0.00 C ATOM 64476 HR PGR 1562 128.067 8.326 21.940 1.00 0.00 H ATOM 64477 HS PGR 1562 129.016 7.039 22.776 1.00 0.00 H ATOM 64478 C2 PGR 1562 129.553 9.095 23.164 1.00 0.00 C ATOM 64479 HX PGR 1562 129.065 10.017 23.488 1.00 0.00 H ATOM 64480 C3 PGR 1562 130.507 9.343 21.949 1.00 0.00 C ATOM 64481 HA PGR 1562 131.405 9.870 22.282 1.00 0.00 H ATOM 64482 HB PGR 1562 130.002 10.040 21.275 1.00 0.00 H ATOM 64483 O31 PGR 1562 130.961 8.195 21.264 1.00 0.00 O ATOM 64484 P31 PGR 1562 132.058 8.285 20.074 1.00 0.00 P ATOM 64485 O32 PGR 1562 131.367 9.310 18.998 1.00 0.00 O ATOM 64486 C31 PGR 1562 130.159 9.072 18.267 1.00 0.00 C ATOM 64487 H1A PGR 1562 129.863 10.026 17.824 1.00 0.00 H ATOM 64488 H1B PGR 1562 129.299 8.800 18.885 1.00 0.00 H ATOM 64489 C32 PGR 1562 130.406 8.090 17.080 1.00 0.00 C ATOM 64490 H2A PGR 1562 129.541 8.240 16.429 1.00 0.00 H ATOM 64491 O35 PGR 1562 130.357 6.693 17.578 1.00 0.00 O ATOM 64492 HO5A PGR 1562 130.820 6.647 18.433 1.00 0.00 H ATOM 64493 C33 PGR 1562 131.600 8.340 16.220 1.00 0.00 C ATOM 64494 H3A PGR 1562 131.513 9.348 15.806 1.00 0.00 H ATOM 64495 H3B PGR 1562 132.538 8.175 16.756 1.00 0.00 H ATOM 64496 O33 PGR 1562 133.218 9.029 20.563 1.00 0.00 O ATOM 64497 O34 PGR 1562 132.270 6.976 19.391 1.00 0.00 O ATOM 64498 O21 PGR 1562 130.364 8.768 24.384 1.00 0.00 O ATOM 64499 C21 PGR 1562 131.086 9.709 24.970 1.00 0.00 C ATOM 64500 O22 PGR 1562 131.020 10.846 24.637 1.00 0.00 O ATOM 64501 O36 PGR 1562 131.674 7.349 15.175 1.00 0.00 O ATOM 64502 HO6A PGR 1562 132.269 7.728 14.503 1.00 0.00 H ATOM 64503 C12 OL 1563 131.935 9.144 26.105 1.00 0.00 C ATOM 64504 H2R OL 1563 131.533 8.193 26.462 1.00 0.00 H ATOM 64505 H2S OL 1563 132.947 9.081 25.702 1.00 0.00 H ATOM 64506 C13 OL 1563 131.994 10.122 27.292 1.00 0.00 C ATOM 64507 H3R OL 1563 132.463 11.037 26.925 1.00 0.00 H ATOM 64508 H3S OL 1563 130.978 10.462 27.502 1.00 0.00 H ATOM 64509 C14 OL 1563 132.622 9.518 28.542 1.00 0.00 C ATOM 64510 H4R OL 1563 131.926 8.722 28.813 1.00 0.00 H ATOM 64511 H4S OL 1563 133.493 8.959 28.195 1.00 0.00 H ATOM 64512 C15 OL 1563 132.900 10.459 29.659 1.00 0.00 C ATOM 64513 H5R OL 1563 133.613 11.248 29.412 1.00 0.00 H ATOM 64514 H5S OL 1563 131.968 10.955 29.937 1.00 0.00 H ATOM 64515 C16 OL 1563 133.368 9.632 30.881 1.00 0.00 C ATOM 64516 H6R OL 1563 132.521 8.988 31.129 1.00 0.00 H ATOM 64517 H6S OL 1563 134.269 9.014 30.885 1.00 0.00 H ATOM 64518 C17 OL 1563 133.675 10.506 32.116 1.00 0.00 C ATOM 64519 H7R OL 1563 134.350 11.307 31.806 1.00 0.00 H ATOM 64520 H7S OL 1563 132.673 10.878 32.341 1.00 0.00 H ATOM 64521 C18 OL 1563 134.504 9.749 33.173 1.00 0.00 C ATOM 64522 H8R OL 1563 134.159 8.751 33.455 1.00 0.00 H ATOM 64523 H8S OL 1563 135.468 9.588 32.687 1.00 0.00 H ATOM 64524 C19 OL 1563 134.671 10.760 34.303 1.00 0.00 C ATOM 64525 H9R OL 1563 134.952 11.716 33.868 1.00 0.00 H ATOM 64526 C110 OL 1563 134.405 10.638 35.566 1.00 0.00 C ATOM 64527 H10R OL 1563 134.426 11.464 36.272 1.00 0.00 H ATOM 64528 C111 OL 1563 134.121 9.282 36.257 1.00 0.00 C ATOM 64529 H11R OL 1563 134.333 8.448 35.585 1.00 0.00 H ATOM 64530 H11S OL 1563 134.936 9.165 36.974 1.00 0.00 H ATOM 64531 C112 OL 1563 132.724 9.207 36.744 1.00 0.00 C ATOM 64532 H12R OL 1563 132.570 9.989 37.491 1.00 0.00 H ATOM 64533 H12S OL 1563 132.087 9.294 35.862 1.00 0.00 H ATOM 64534 C113 OL 1563 132.385 7.931 37.530 1.00 0.00 C ATOM 64535 H13R OL 1563 132.856 7.052 37.085 1.00 0.00 H ATOM 64536 H13S OL 1563 132.684 7.897 38.579 1.00 0.00 H ATOM 64537 C114 OL 1563 130.853 7.624 37.583 1.00 0.00 C ATOM 64538 H14R OL 1563 130.241 8.476 37.885 1.00 0.00 H ATOM 64539 H14S OL 1563 130.551 7.457 36.547 1.00 0.00 H ATOM 64540 C115 OL 1563 130.410 6.483 38.549 1.00 0.00 C ATOM 64541 H15R OL 1563 130.665 6.814 39.558 1.00 0.00 H ATOM 64542 H15S OL 1563 129.348 6.254 38.439 1.00 0.00 H ATOM 64543 C116 OL 1563 131.130 5.077 38.489 1.00 0.00 C ATOM 64544 H16R OL 1563 130.817 4.541 37.590 1.00 0.00 H ATOM 64545 H16S OL 1563 132.220 5.130 38.504 1.00 0.00 H ATOM 64546 C117 OL 1563 130.615 4.265 39.655 1.00 0.00 C ATOM 64547 H17R OL 1563 130.879 4.764 40.590 1.00 0.00 H ATOM 64548 H17S OL 1563 129.523 4.238 39.652 1.00 0.00 H ATOM 64549 C118 OL 1563 131.298 2.825 39.716 1.00 0.00 C ATOM 64550 H18R OL 1563 130.963 2.152 38.923 1.00 0.00 H ATOM 64551 H18S OL 1563 131.054 2.230 40.599 1.00 0.00 H ATOM 64552 H18T OL 1563 132.387 2.908 39.717 1.00 0.00 H TER 64553 OL 1563 ATOM 64553 C116 PA 1564 60.481 12.381 38.550 1.00 0.00 C ATOM 64554 H16R PA 1564 61.508 12.519 38.206 1.00 0.00 H ATOM 64555 H16S PA 1564 60.390 12.817 39.547 1.00 0.00 H ATOM 64556 H16T PA 1564 59.763 12.787 37.834 1.00 0.00 H ATOM 64557 C115 PA 1564 60.229 10.883 38.587 1.00 0.00 C ATOM 64558 H15R PA 1564 60.625 10.563 39.553 1.00 0.00 H ATOM 64559 H15S PA 1564 60.822 10.509 37.750 1.00 0.00 H ATOM 64560 C114 PA 1564 58.829 10.347 38.582 1.00 0.00 C ATOM 64561 H14R PA 1564 58.407 10.476 39.581 1.00 0.00 H ATOM 64562 H14S PA 1564 58.903 9.260 38.515 1.00 0.00 H ATOM 64563 C113 PA 1564 57.900 10.777 37.482 1.00 0.00 C ATOM 64564 H13R PA 1564 58.110 10.391 36.482 1.00 0.00 H ATOM 64565 H13S PA 1564 57.946 11.858 37.339 1.00 0.00 H ATOM 64566 C112 PA 1564 56.410 10.515 37.784 1.00 0.00 C ATOM 64567 H12R PA 1564 56.007 11.072 38.632 1.00 0.00 H ATOM 64568 H12S PA 1564 56.149 9.517 38.142 1.00 0.00 H ATOM 64569 C111 PA 1564 55.494 10.739 36.553 1.00 0.00 C ATOM 64570 H11R PA 1564 54.515 10.300 36.752 1.00 0.00 H ATOM 64571 H11S PA 1564 55.719 10.249 35.603 1.00 0.00 H ATOM 64572 C110 PA 1564 55.429 12.251 36.205 1.00 0.00 C ATOM 64573 H10R PA 1564 56.447 12.449 35.862 1.00 0.00 H ATOM 64574 H10S PA 1564 55.099 12.958 36.969 1.00 0.00 H ATOM 64575 C19 PA 1564 54.549 12.553 35.010 1.00 0.00 C ATOM 64576 H9R PA 1564 54.507 13.640 34.909 1.00 0.00 H ATOM 64577 H9S PA 1564 53.518 12.231 35.171 1.00 0.00 H ATOM 64578 C18 PA 1564 55.007 11.893 33.690 1.00 0.00 C ATOM 64579 H8R PA 1564 54.748 10.848 33.512 1.00 0.00 H ATOM 64580 H8S PA 1564 56.096 11.956 33.645 1.00 0.00 H ATOM 64581 C17 PA 1564 54.520 12.490 32.410 1.00 0.00 C ATOM 64582 H7R PA 1564 55.048 12.034 31.569 1.00 0.00 H ATOM 64583 H7S PA 1564 54.824 13.537 32.470 1.00 0.00 H ATOM 64584 C16 PA 1564 53.032 12.464 32.234 1.00 0.00 C ATOM 64585 H6R PA 1564 52.443 13.010 32.974 1.00 0.00 H ATOM 64586 H6S PA 1564 52.596 11.463 32.214 1.00 0.00 H ATOM 64587 C15 PA 1564 52.582 12.934 30.857 1.00 0.00 C ATOM 64588 H5R PA 1564 53.071 12.190 30.225 1.00 0.00 H ATOM 64589 H5S PA 1564 53.078 13.876 30.614 1.00 0.00 H ATOM 64590 C14 PA 1564 51.093 12.877 30.604 1.00 0.00 C ATOM 64591 H4R PA 1564 50.692 13.294 29.678 1.00 0.00 H ATOM 64592 H4S PA 1564 50.545 13.544 31.272 1.00 0.00 H ATOM 64593 C13 PA 1564 50.652 11.373 30.734 1.00 0.00 C ATOM 64594 H3R PA 1564 50.739 10.891 31.710 1.00 0.00 H ATOM 64595 H3S PA 1564 51.230 10.762 30.037 1.00 0.00 H ATOM 64596 C12 PA 1564 49.238 11.369 30.323 1.00 0.00 C ATOM 64597 H2R PA 1564 48.575 11.940 30.975 1.00 0.00 H ATOM 64598 H2S PA 1564 48.789 10.386 30.477 1.00 0.00 H ATOM 64599 C11 PC 1565 48.931 11.768 28.928 1.00 0.00 C ATOM 64600 O12 PC 1565 48.035 12.530 28.572 1.00 0.00 O ATOM 64601 O11 PC 1565 49.618 11.012 28.051 1.00 0.00 O ATOM 64602 C1 PC 1565 49.599 11.347 26.644 1.00 0.00 C ATOM 64603 HR PC 1565 48.582 11.375 26.246 1.00 0.00 H ATOM 64604 HS PC 1565 50.248 10.623 26.144 1.00 0.00 H ATOM 64605 C2 PC 1565 50.180 12.794 26.292 1.00 0.00 C ATOM 64606 HX PC 1565 49.495 13.532 26.717 1.00 0.00 H ATOM 64607 C3 PC 1565 50.168 13.078 24.789 1.00 0.00 C ATOM 64608 HA PC 1565 49.128 13.063 24.454 1.00 0.00 H ATOM 64609 HB PC 1565 50.792 12.445 24.154 1.00 0.00 H ATOM 64610 O31 PC 1565 50.548 14.435 24.466 1.00 0.00 O ATOM 64611 P31 PC 1565 50.250 15.055 22.997 1.00 0.00 P ATOM 64612 O32 PC 1565 48.606 14.970 22.933 1.00 0.00 O ATOM 64613 C31 PC 1565 47.881 15.635 21.854 1.00 0.00 C ATOM 64614 H1A PC 1565 48.101 15.131 20.909 1.00 0.00 H ATOM 64615 H1B PC 1565 48.175 16.687 21.804 1.00 0.00 H ATOM 64616 C32 PC 1565 46.408 15.486 22.328 1.00 0.00 C ATOM 64617 H2A PC 1565 45.820 16.191 21.739 1.00 0.00 H ATOM 64618 H2B PC 1565 46.395 15.843 23.359 1.00 0.00 H ATOM 64619 N31 PC 1565 45.734 14.205 22.291 1.00 0.00 N ATOM 64620 C33 PC 1565 46.365 13.271 23.234 1.00 0.00 C ATOM 64621 H3A PC 1565 46.266 13.678 24.242 1.00 0.00 H ATOM 64622 H3B PC 1565 47.419 13.193 22.964 1.00 0.00 H ATOM 64623 H3C PC 1565 45.837 12.318 23.185 1.00 0.00 H ATOM 64624 C34 PC 1565 44.303 14.332 22.492 1.00 0.00 C ATOM 64625 H4A PC 1565 44.118 14.518 23.551 1.00 0.00 H ATOM 64626 H4B PC 1565 43.843 13.385 22.207 1.00 0.00 H ATOM 64627 H4C PC 1565 43.927 15.228 21.995 1.00 0.00 H ATOM 64628 C35 PC 1565 45.843 13.624 20.885 1.00 0.00 C ATOM 64629 H5A PC 1565 46.902 13.377 20.798 1.00 0.00 H ATOM 64630 H5B PC 1565 45.395 14.262 20.121 1.00 0.00 H ATOM 64631 H5C PC 1565 45.409 12.624 20.909 1.00 0.00 H ATOM 64632 O33 PC 1565 50.562 16.521 23.020 1.00 0.00 O ATOM 64633 O34 PC 1565 50.899 14.245 21.975 1.00 0.00 O ATOM 64634 O21 PC 1565 51.514 13.061 26.762 1.00 0.00 O ATOM 64635 C21 PC 1565 52.586 12.396 26.402 1.00 0.00 C ATOM 64636 O22 PC 1565 52.585 11.327 25.804 1.00 0.00 O ATOM 64637 C12 OL 1566 53.833 12.990 27.075 1.00 0.00 C ATOM 64638 H2R OL 1566 53.977 14.053 26.872 1.00 0.00 H ATOM 64639 H2S OL 1566 53.656 12.884 28.147 1.00 0.00 H ATOM 64640 C13 OL 1566 55.159 12.310 26.709 1.00 0.00 C ATOM 64641 H3R OL 1566 55.104 11.232 26.876 1.00 0.00 H ATOM 64642 H3S OL 1566 55.290 12.438 25.633 1.00 0.00 H ATOM 64643 C14 OL 1566 56.310 12.773 27.534 1.00 0.00 C ATOM 64644 H4R OL 1566 57.156 12.709 26.847 1.00 0.00 H ATOM 64645 H4S OL 1566 56.315 13.846 27.740 1.00 0.00 H ATOM 64646 C15 OL 1566 56.544 12.100 28.873 1.00 0.00 C ATOM 64647 H5R OL 1566 55.777 12.406 29.587 1.00 0.00 H ATOM 64648 H5S OL 1566 56.295 11.059 28.659 1.00 0.00 H ATOM 64649 C16 OL 1566 57.931 12.377 29.478 1.00 0.00 C ATOM 64650 H6R OL 1566 58.023 11.736 30.358 1.00 0.00 H ATOM 64651 H6S OL 1566 58.765 12.084 28.836 1.00 0.00 H ATOM 64652 C17 OL 1566 58.168 13.849 29.823 1.00 0.00 C ATOM 64653 H7R OL 1566 58.568 14.241 28.885 1.00 0.00 H ATOM 64654 H7S OL 1566 57.314 14.367 30.264 1.00 0.00 H ATOM 64655 C18 OL 1566 59.357 14.086 30.826 1.00 0.00 C ATOM 64656 H8R OL 1566 59.098 13.852 31.860 1.00 0.00 H ATOM 64657 H8S OL 1566 60.141 13.398 30.502 1.00 0.00 H ATOM 64658 C19 OL 1566 59.834 15.528 30.697 1.00 0.00 C ATOM 64659 H9R OL 1566 59.114 16.330 30.836 1.00 0.00 H ATOM 64660 C110 OL 1566 61.038 15.907 30.456 1.00 0.00 C ATOM 64661 H10R OL 1566 61.269 16.968 30.422 1.00 0.00 H ATOM 64662 C111 OL 1566 62.126 15.015 30.096 1.00 0.00 C ATOM 64663 H11R OL 1566 61.793 14.206 29.442 1.00 0.00 H ATOM 64664 H11S OL 1566 62.847 15.537 29.463 1.00 0.00 H ATOM 64665 C112 OL 1566 62.797 14.321 31.352 1.00 0.00 C ATOM 64666 H12R OL 1566 63.243 14.982 32.098 1.00 0.00 H ATOM 64667 H12S OL 1566 62.062 13.778 31.950 1.00 0.00 H ATOM 64668 C113 OL 1566 63.919 13.341 31.121 1.00 0.00 C ATOM 64669 H13R OL 1566 63.425 12.420 30.807 1.00 0.00 H ATOM 64670 H13S OL 1566 64.539 13.694 30.294 1.00 0.00 H ATOM 64671 C114 OL 1566 64.893 13.057 32.329 1.00 0.00 C ATOM 64672 H14R OL 1566 64.385 12.790 33.258 1.00 0.00 H ATOM 64673 H14S OL 1566 65.527 12.217 32.038 1.00 0.00 H ATOM 64674 C115 OL 1566 65.888 14.209 32.743 1.00 0.00 C ATOM 64675 H15R OL 1566 65.411 15.127 33.092 1.00 0.00 H ATOM 64676 H15S OL 1566 66.552 13.838 33.527 1.00 0.00 H ATOM 64677 C116 OL 1566 66.721 14.872 31.599 1.00 0.00 C ATOM 64678 H16R OL 1566 67.138 13.982 31.123 1.00 0.00 H ATOM 64679 H16S OL 1566 66.087 15.499 30.970 1.00 0.00 H ATOM 64680 C117 OL 1566 67.899 15.728 32.017 1.00 0.00 C ATOM 64681 H17R OL 1566 67.472 16.579 32.553 1.00 0.00 H ATOM 64682 H17S OL 1566 68.562 15.195 32.703 1.00 0.00 H ATOM 64683 C118 OL 1566 68.587 16.283 30.772 1.00 0.00 C ATOM 64684 H18R OL 1566 69.544 16.683 31.114 1.00 0.00 H ATOM 64685 H18S OL 1566 67.947 17.062 30.352 1.00 0.00 H ATOM 64686 H18T OL 1566 68.847 15.516 30.040 1.00 0.00 H TER 64687 OL 1566 ATOM 64687 C116 PA 1567 136.464 143.455 41.819 1.00 0.00 C ATOM 64688 H16R PA 1567 137.483 143.733 42.095 1.00 0.00 H ATOM 64689 H16S PA 1567 136.337 142.456 42.241 1.00 0.00 H ATOM 64690 H16T PA 1567 135.722 144.176 42.168 1.00 0.00 H ATOM 64691 C115 PA 1567 136.372 143.252 40.295 1.00 0.00 C ATOM 64692 H15R PA 1567 135.873 142.299 40.107 1.00 0.00 H ATOM 64693 H15S PA 1567 137.351 143.152 39.823 1.00 0.00 H ATOM 64694 C114 PA 1567 135.601 144.371 39.585 1.00 0.00 C ATOM 64695 H14R PA 1567 136.177 145.296 39.515 1.00 0.00 H ATOM 64696 H14S PA 1567 134.674 144.615 40.108 1.00 0.00 H ATOM 64697 C113 PA 1567 135.256 143.867 38.143 1.00 0.00 C ATOM 64698 H13R PA 1567 134.468 143.118 38.046 1.00 0.00 H ATOM 64699 H13S PA 1567 136.128 143.537 37.574 1.00 0.00 H ATOM 64700 C112 PA 1567 134.591 145.032 37.439 1.00 0.00 C ATOM 64701 H12R PA 1567 135.174 145.908 37.729 1.00 0.00 H ATOM 64702 H12S PA 1567 133.597 145.192 37.861 1.00 0.00 H ATOM 64703 C111 PA 1567 134.556 144.934 35.915 1.00 0.00 C ATOM 64704 H11R PA 1567 134.161 143.966 35.599 1.00 0.00 H ATOM 64705 H11S PA 1567 135.561 145.060 35.507 1.00 0.00 H ATOM 64706 C110 PA 1567 133.712 146.171 35.402 1.00 0.00 C ATOM 64707 H10R PA 1567 134.053 147.001 36.025 1.00 0.00 H ATOM 64708 H10S PA 1567 132.684 145.970 35.710 1.00 0.00 H ATOM 64709 C19 PA 1567 133.741 146.544 33.915 1.00 0.00 C ATOM 64710 H9R PA 1567 133.552 145.646 33.322 1.00 0.00 H ATOM 64711 H9S PA 1567 134.710 146.949 33.615 1.00 0.00 H ATOM 64712 C18 PA 1567 132.580 147.583 33.597 1.00 0.00 C ATOM 64713 H8R PA 1567 132.848 148.429 34.232 1.00 0.00 H ATOM 64714 H8S PA 1567 131.698 147.069 33.987 1.00 0.00 H ATOM 64715 C17 PA 1567 132.366 147.972 32.167 1.00 0.00 C ATOM 64716 H7R PA 1567 133.278 148.372 31.720 1.00 0.00 H ATOM 64717 H7S PA 1567 131.581 148.724 32.064 1.00 0.00 H ATOM 64718 C16 PA 1567 132.001 146.811 31.208 1.00 0.00 C ATOM 64719 H6R PA 1567 131.246 146.253 31.765 1.00 0.00 H ATOM 64720 H6S PA 1567 132.793 146.078 31.039 1.00 0.00 H ATOM 64721 C15 PA 1567 131.555 147.321 29.841 1.00 0.00 C ATOM 64722 H5R PA 1567 132.429 147.808 29.404 1.00 0.00 H ATOM 64723 H5S PA 1567 130.772 148.054 30.044 1.00 0.00 H ATOM 64724 C14 PA 1567 130.990 146.257 28.846 1.00 0.00 C ATOM 64725 H4R PA 1567 130.332 145.567 29.378 1.00 0.00 H ATOM 64726 H4S PA 1567 131.778 145.663 28.377 1.00 0.00 H ATOM 64727 C13 PA 1567 130.343 146.748 27.585 1.00 0.00 C ATOM 64728 H3R PA 1567 131.168 147.261 27.086 1.00 0.00 H ATOM 64729 H3S PA 1567 129.576 147.456 27.904 1.00 0.00 H ATOM 64730 C12 PA 1567 129.736 145.560 26.771 1.00 0.00 C ATOM 64731 H2R PA 1567 128.793 145.297 27.256 1.00 0.00 H ATOM 64732 H2S PA 1567 130.373 144.678 26.870 1.00 0.00 H ATOM 64733 C11 PGR 1568 129.390 145.975 25.320 1.00 0.00 C ATOM 64734 O12 PGR 1568 129.537 145.259 24.303 1.00 0.00 O ATOM 64735 O11 PGR 1568 128.723 147.142 25.333 1.00 0.00 O ATOM 64736 C1 PGR 1568 128.209 147.634 24.048 1.00 0.00 C ATOM 64737 HR PGR 1568 128.929 147.394 23.263 1.00 0.00 H ATOM 64738 HS PGR 1568 128.188 148.717 24.195 1.00 0.00 H ATOM 64739 C2 PGR 1568 126.822 147.083 23.762 1.00 0.00 C ATOM 64740 HX PGR 1568 126.881 145.992 23.797 1.00 0.00 H ATOM 64741 C3 PGR 1568 126.374 147.535 22.400 1.00 0.00 C ATOM 64742 HA PGR 1568 127.182 147.262 21.717 1.00 0.00 H ATOM 64743 HB PGR 1568 126.106 148.595 22.395 1.00 0.00 H ATOM 64744 O31 PGR 1568 125.289 146.688 22.117 1.00 0.00 O ATOM 64745 P31 PGR 1568 124.363 146.931 20.809 1.00 0.00 P ATOM 64746 O32 PGR 1568 123.478 148.259 21.144 1.00 0.00 O ATOM 64747 C31 PGR 1568 122.464 148.236 22.163 1.00 0.00 C ATOM 64748 H1A PGR 1568 122.898 148.553 23.115 1.00 0.00 H ATOM 64749 H1B PGR 1568 122.117 147.200 22.197 1.00 0.00 H ATOM 64750 C32 PGR 1568 121.386 149.335 21.816 1.00 0.00 C ATOM 64751 H2A PGR 1568 120.498 149.020 22.371 1.00 0.00 H ATOM 64752 O35 PGR 1568 121.134 149.240 20.386 1.00 0.00 O ATOM 64753 HO5A PGR 1568 122.020 149.401 20.014 1.00 0.00 H ATOM 64754 C33 PGR 1568 121.873 150.660 22.219 1.00 0.00 C ATOM 64755 H3A PGR 1568 121.926 150.706 23.310 1.00 0.00 H ATOM 64756 H3B PGR 1568 122.845 150.889 21.775 1.00 0.00 H ATOM 64757 O33 PGR 1568 125.306 147.263 19.733 1.00 0.00 O ATOM 64758 O34 PGR 1568 123.456 145.692 20.698 1.00 0.00 O ATOM 64759 O21 PGR 1568 125.901 147.548 24.756 1.00 0.00 O ATOM 64760 C21 PGR 1568 125.494 146.733 25.740 1.00 0.00 C ATOM 64761 O22 PGR 1568 125.795 145.532 25.883 1.00 0.00 O ATOM 64762 O36 PGR 1568 121.049 151.680 21.874 1.00 0.00 O ATOM 64763 HO6A PGR 1568 120.152 151.490 22.203 1.00 0.00 H ATOM 64764 C12 OL 1569 124.655 147.493 26.790 1.00 0.00 C ATOM 64765 H2R OL 1569 125.206 148.410 27.006 1.00 0.00 H ATOM 64766 H2S OL 1569 123.732 147.867 26.343 1.00 0.00 H ATOM 64767 C13 OL 1569 124.440 146.704 28.045 1.00 0.00 C ATOM 64768 H3R OL 1569 123.573 147.131 28.553 1.00 0.00 H ATOM 64769 H3S OL 1569 124.138 145.682 27.807 1.00 0.00 H ATOM 64770 C14 OL 1569 125.649 146.603 28.921 1.00 0.00 C ATOM 64771 H4R OL 1569 126.297 145.977 28.305 1.00 0.00 H ATOM 64772 H4S OL 1569 126.296 147.476 29.024 1.00 0.00 H ATOM 64773 C15 OL 1569 125.440 145.941 30.180 1.00 0.00 C ATOM 64774 H5R OL 1569 125.091 144.931 29.959 1.00 0.00 H ATOM 64775 H5S OL 1569 126.459 145.821 30.554 1.00 0.00 H ATOM 64776 C16 OL 1569 124.468 146.622 31.200 1.00 0.00 C ATOM 64777 H6R OL 1569 124.931 147.578 31.455 1.00 0.00 H ATOM 64778 H6S OL 1569 123.458 146.781 30.817 1.00 0.00 H ATOM 64779 C17 OL 1569 124.373 145.887 32.602 1.00 0.00 C ATOM 64780 H7R OL 1569 123.779 144.971 32.572 1.00 0.00 H ATOM 64781 H7S OL 1569 125.364 145.669 33.006 1.00 0.00 H ATOM 64782 C18 OL 1569 123.689 146.684 33.671 1.00 0.00 C ATOM 64783 H8R OL 1569 123.904 147.754 33.717 1.00 0.00 H ATOM 64784 H8S OL 1569 122.655 146.540 33.354 1.00 0.00 H ATOM 64785 C19 OL 1569 123.941 146.282 35.075 1.00 0.00 C ATOM 64786 H9R OL 1569 124.913 146.553 35.479 1.00 0.00 H ATOM 64787 C110 OL 1569 123.025 145.708 35.870 1.00 0.00 C ATOM 64788 H10R OL 1569 123.330 145.417 36.872 1.00 0.00 H ATOM 64789 C111 OL 1569 121.563 145.368 35.549 1.00 0.00 C ATOM 64790 H11R OL 1569 120.875 145.854 36.243 1.00 0.00 H ATOM 64791 H11S OL 1569 121.247 145.843 34.618 1.00 0.00 H ATOM 64792 C112 OL 1569 121.162 143.911 35.513 1.00 0.00 C ATOM 64793 H12R OL 1569 121.496 143.550 34.538 1.00 0.00 H ATOM 64794 H12S OL 1569 121.821 143.395 36.214 1.00 0.00 H ATOM 64795 C113 OL 1569 119.672 143.664 35.669 1.00 0.00 C ATOM 64796 H13R OL 1569 119.255 144.214 36.516 1.00 0.00 H ATOM 64797 H13S OL 1569 119.280 144.269 34.849 1.00 0.00 H ATOM 64798 C114 OL 1569 119.274 142.259 35.752 1.00 0.00 C ATOM 64799 H14R OL 1569 119.425 141.762 34.791 1.00 0.00 H ATOM 64800 H14S OL 1569 119.758 141.778 36.605 1.00 0.00 H ATOM 64801 C115 OL 1569 117.756 142.158 36.028 1.00 0.00 C ATOM 64802 H15R OL 1569 117.592 142.585 37.019 1.00 0.00 H ATOM 64803 H15S OL 1569 117.245 142.795 35.303 1.00 0.00 H ATOM 64804 C116 OL 1569 117.214 140.757 35.995 1.00 0.00 C ATOM 64805 H16R OL 1569 117.381 140.441 34.963 1.00 0.00 H ATOM 64806 H16S OL 1569 117.805 140.031 36.557 1.00 0.00 H ATOM 64807 C117 OL 1569 115.747 140.673 36.441 1.00 0.00 C ATOM 64808 H17R OL 1569 115.326 139.806 35.927 1.00 0.00 H ATOM 64809 H17S OL 1569 115.735 140.487 37.517 1.00 0.00 H ATOM 64810 C118 OL 1569 114.890 141.956 36.160 1.00 0.00 C ATOM 64811 H18R OL 1569 115.103 142.776 36.849 1.00 0.00 H ATOM 64812 H18S OL 1569 113.826 141.732 36.263 1.00 0.00 H ATOM 64813 H18T OL 1569 114.929 142.335 35.136 1.00 0.00 H TER 64814 OL 1569 ATOM 64814 C116 PA 1570 28.211 82.170 41.514 1.00 0.00 C ATOM 64815 H16R PA 1570 28.205 81.390 40.749 1.00 0.00 H ATOM 64816 H16S PA 1570 27.946 81.500 42.334 1.00 0.00 H ATOM 64817 H16T PA 1570 29.165 82.685 41.647 1.00 0.00 H ATOM 64818 C115 PA 1570 27.081 83.129 41.060 1.00 0.00 C ATOM 64819 H15R PA 1570 26.874 83.831 41.871 1.00 0.00 H ATOM 64820 H15S PA 1570 26.249 82.452 40.855 1.00 0.00 H ATOM 64821 C114 PA 1570 27.440 84.008 39.860 1.00 0.00 C ATOM 64822 H14R PA 1570 28.216 84.719 40.150 1.00 0.00 H ATOM 64823 H14S PA 1570 26.583 84.525 39.423 1.00 0.00 H ATOM 64824 C113 PA 1570 27.990 83.205 38.634 1.00 0.00 C ATOM 64825 H13R PA 1570 27.381 82.305 38.530 1.00 0.00 H ATOM 64826 H13S PA 1570 29.034 82.931 38.798 1.00 0.00 H ATOM 64827 C112 PA 1570 28.055 84.018 37.326 1.00 0.00 C ATOM 64828 H12R PA 1570 28.506 84.991 37.532 1.00 0.00 H ATOM 64829 H12S PA 1570 27.072 84.251 36.911 1.00 0.00 H ATOM 64830 C111 PA 1570 28.794 83.192 36.218 1.00 0.00 C ATOM 64831 H11R PA 1570 29.762 82.886 36.620 1.00 0.00 H ATOM 64832 H11S PA 1570 28.997 83.948 35.457 1.00 0.00 H ATOM 64833 C110 PA 1570 28.088 81.915 35.678 1.00 0.00 C ATOM 64834 H10R PA 1570 27.296 82.251 35.005 1.00 0.00 H ATOM 64835 H10S PA 1570 27.442 81.401 36.394 1.00 0.00 H ATOM 64836 C19 PA 1570 29.055 80.920 35.002 1.00 0.00 C ATOM 64837 H9R PA 1570 28.573 79.970 34.763 1.00 0.00 H ATOM 64838 H9S PA 1570 29.741 80.527 35.755 1.00 0.00 H ATOM 64839 C18 PA 1570 29.910 81.452 33.842 1.00 0.00 C ATOM 64840 H8R PA 1570 30.899 81.007 33.964 1.00 0.00 H ATOM 64841 H8S PA 1570 30.167 82.513 33.816 1.00 0.00 H ATOM 64842 C17 PA 1570 29.263 81.129 32.477 1.00 0.00 C ATOM 64843 H7R PA 1570 28.209 81.391 32.365 1.00 0.00 H ATOM 64844 H7S PA 1570 29.265 80.037 32.481 1.00 0.00 H ATOM 64845 C16 PA 1570 30.051 81.826 31.325 1.00 0.00 C ATOM 64846 H6R PA 1570 31.143 81.803 31.352 1.00 0.00 H ATOM 64847 H6S PA 1570 29.906 82.889 31.525 1.00 0.00 H ATOM 64848 C15 PA 1570 29.590 81.648 29.857 1.00 0.00 C ATOM 64849 H5R PA 1570 29.407 80.587 29.676 1.00 0.00 H ATOM 64850 H5S PA 1570 30.420 81.930 29.206 1.00 0.00 H ATOM 64851 C14 PA 1570 28.315 82.402 29.521 1.00 0.00 C ATOM 64852 H4R PA 1570 28.347 83.403 29.956 1.00 0.00 H ATOM 64853 H4S PA 1570 27.587 81.930 30.183 1.00 0.00 H ATOM 64854 C13 PA 1570 28.004 82.452 28.029 1.00 0.00 C ATOM 64855 H3R PA 1570 27.762 81.427 27.739 1.00 0.00 H ATOM 64856 H3S PA 1570 28.917 82.697 27.482 1.00 0.00 H ATOM 64857 C12 PA 1570 26.922 83.529 27.710 1.00 0.00 C ATOM 64858 H2R PA 1570 27.203 84.579 27.810 1.00 0.00 H ATOM 64859 H2S PA 1570 26.057 83.383 28.360 1.00 0.00 H ATOM 64860 C11 PGR 1571 26.421 83.387 26.301 1.00 0.00 C ATOM 64861 O12 PGR 1571 26.586 82.412 25.625 1.00 0.00 O ATOM 64862 O11 PGR 1571 25.644 84.408 25.915 1.00 0.00 O ATOM 64863 C1 PGR 1571 24.861 84.415 24.669 1.00 0.00 C ATOM 64864 HR PGR 1571 25.440 84.065 23.811 1.00 0.00 H ATOM 64865 HS PGR 1571 24.331 85.364 24.559 1.00 0.00 H ATOM 64866 C2 PGR 1571 23.712 83.356 24.743 1.00 0.00 C ATOM 64867 HX PGR 1571 24.117 82.446 25.194 1.00 0.00 H ATOM 64868 C3 PGR 1571 23.023 83.159 23.339 1.00 0.00 C ATOM 64869 HA PGR 1571 22.163 82.508 23.516 1.00 0.00 H ATOM 64870 HB PGR 1571 23.689 82.659 22.632 1.00 0.00 H ATOM 64871 O31 PGR 1571 22.608 84.402 22.765 1.00 0.00 O ATOM 64872 P31 PGR 1571 21.798 84.501 21.382 1.00 0.00 P ATOM 64873 O32 PGR 1571 22.756 83.802 20.336 1.00 0.00 O ATOM 64874 C31 PGR 1571 24.079 84.293 20.196 1.00 0.00 C ATOM 64875 H1A PGR 1571 24.792 83.524 19.885 1.00 0.00 H ATOM 64876 H1B PGR 1571 24.445 84.642 21.165 1.00 0.00 H ATOM 64877 C32 PGR 1571 24.169 85.500 19.204 1.00 0.00 C ATOM 64878 H2A PGR 1571 25.211 85.520 18.876 1.00 0.00 H ATOM 64879 O35 PGR 1571 23.768 86.732 19.856 1.00 0.00 O ATOM 64880 HO5A PGR 1571 22.891 86.629 20.268 1.00 0.00 H ATOM 64881 C33 PGR 1571 23.293 85.394 17.924 1.00 0.00 C ATOM 64882 H3A PGR 1571 23.523 84.436 17.450 1.00 0.00 H ATOM 64883 H3B PGR 1571 22.236 85.373 18.202 1.00 0.00 H ATOM 64884 O33 PGR 1571 20.503 83.773 21.478 1.00 0.00 O ATOM 64885 O34 PGR 1571 21.723 85.930 21.117 1.00 0.00 O ATOM 64886 O21 PGR 1571 22.764 83.867 25.687 1.00 0.00 O ATOM 64887 C21 PGR 1571 21.877 82.969 26.218 1.00 0.00 C ATOM 64888 O22 PGR 1571 21.936 81.749 26.028 1.00 0.00 O ATOM 64889 O36 PGR 1571 23.537 86.471 17.044 1.00 0.00 O ATOM 64890 HO6A PGR 1571 22.908 86.291 16.322 1.00 0.00 H ATOM 64891 C12 OL 1572 20.859 83.563 27.222 1.00 0.00 C ATOM 64892 H2R OL 1572 21.205 84.453 27.752 1.00 0.00 H ATOM 64893 H2S OL 1572 19.961 83.897 26.699 1.00 0.00 H ATOM 64894 C13 OL 1572 20.459 82.469 28.294 1.00 0.00 C ATOM 64895 H3R OL 1572 20.010 81.636 27.748 1.00 0.00 H ATOM 64896 H3S OL 1572 21.410 82.054 28.636 1.00 0.00 H ATOM 64897 C14 OL 1572 19.576 83.091 29.372 1.00 0.00 C ATOM 64898 H4R OL 1572 20.172 83.681 30.072 1.00 0.00 H ATOM 64899 H4S OL 1572 18.933 83.881 28.978 1.00 0.00 H ATOM 64900 C15 OL 1572 18.748 82.058 30.213 1.00 0.00 C ATOM 64901 H5R OL 1572 18.193 82.681 30.917 1.00 0.00 H ATOM 64902 H5S OL 1572 17.991 81.644 29.543 1.00 0.00 H ATOM 64903 C16 OL 1572 19.658 80.898 30.795 1.00 0.00 C ATOM 64904 H6R OL 1572 19.170 80.260 31.535 1.00 0.00 H ATOM 64905 H6S OL 1572 19.902 80.162 30.026 1.00 0.00 H ATOM 64906 C17 OL 1572 20.927 81.252 31.514 1.00 0.00 C ATOM 64907 H7R OL 1572 21.525 80.363 31.727 1.00 0.00 H ATOM 64908 H7S OL 1572 21.637 81.674 30.799 1.00 0.00 H ATOM 64909 C18 OL 1572 20.918 82.140 32.744 1.00 0.00 C ATOM 64910 H8R OL 1572 21.979 82.386 32.814 1.00 0.00 H ATOM 64911 H8S OL 1572 20.533 83.116 32.440 1.00 0.00 H ATOM 64912 C19 OL 1572 20.333 81.591 34.035 1.00 0.00 C ATOM 64913 H9R OL 1572 20.465 80.520 34.162 1.00 0.00 H ATOM 64914 C110 OL 1572 19.752 82.370 34.991 1.00 0.00 C ATOM 64915 H10R OL 1572 19.504 81.934 35.956 1.00 0.00 H ATOM 64916 C111 OL 1572 19.634 83.850 34.943 1.00 0.00 C ATOM 64917 H11R OL 1572 20.336 84.452 35.523 1.00 0.00 H ATOM 64918 H11S OL 1572 19.760 84.158 33.903 1.00 0.00 H ATOM 64919 C112 OL 1572 18.318 84.382 35.453 1.00 0.00 C ATOM 64920 H12R OL 1572 18.066 85.350 35.013 1.00 0.00 H ATOM 64921 H12S OL 1572 17.570 83.720 35.011 1.00 0.00 H ATOM 64922 C113 OL 1572 18.090 84.487 36.968 1.00 0.00 C ATOM 64923 H13R OL 1572 17.904 83.557 37.509 1.00 0.00 H ATOM 64924 H13S OL 1572 18.983 84.926 37.417 1.00 0.00 H ATOM 64925 C114 OL 1572 16.826 85.385 37.376 1.00 0.00 C ATOM 64926 H14R OL 1572 16.777 86.133 36.582 1.00 0.00 H ATOM 64927 H14S OL 1572 15.899 84.821 37.253 1.00 0.00 H ATOM 64928 C115 OL 1572 16.882 85.983 38.755 1.00 0.00 C ATOM 64929 H15R OL 1572 16.842 85.171 39.485 1.00 0.00 H ATOM 64930 H15S OL 1572 17.871 86.391 38.971 1.00 0.00 H ATOM 64931 C116 OL 1572 15.875 87.033 39.177 1.00 0.00 C ATOM 64932 H16R OL 1572 15.768 87.168 40.256 1.00 0.00 H ATOM 64933 H16S OL 1572 16.141 88.019 38.790 1.00 0.00 H ATOM 64934 C117 OL 1572 14.464 86.684 38.715 1.00 0.00 C ATOM 64935 H17R OL 1572 14.478 86.515 37.637 1.00 0.00 H ATOM 64936 H17S OL 1572 14.108 85.750 39.154 1.00 0.00 H ATOM 64937 C118 OL 1572 13.511 87.773 39.134 1.00 0.00 C ATOM 64938 H18R OL 1572 12.485 87.596 38.805 1.00 0.00 H ATOM 64939 H18S OL 1572 13.653 88.735 38.637 1.00 0.00 H ATOM 64940 H18T OL 1572 13.484 88.002 40.201 1.00 0.00 H TER 64941 OL 1572 ATOM 64941 C116 PA 1573 55.147 72.058 40.431 1.00 0.00 C ATOM 64942 H16R PA 1573 55.139 73.101 40.107 1.00 0.00 H ATOM 64943 H16S PA 1573 56.001 72.008 41.109 1.00 0.00 H ATOM 64944 H16T PA 1573 54.209 71.885 40.963 1.00 0.00 H ATOM 64945 C115 PA 1573 55.446 71.068 39.293 1.00 0.00 C ATOM 64946 H15R PA 1573 54.793 71.361 38.468 1.00 0.00 H ATOM 64947 H15S PA 1573 55.166 70.064 39.617 1.00 0.00 H ATOM 64948 C114 PA 1573 56.646 71.152 38.418 1.00 0.00 C ATOM 64949 H14R PA 1573 56.605 70.413 37.615 1.00 0.00 H ATOM 64950 H14S PA 1573 57.526 70.873 39.002 1.00 0.00 H ATOM 64951 C113 PA 1573 56.945 72.517 37.760 1.00 0.00 C ATOM 64952 H13R PA 1573 56.887 73.124 38.666 1.00 0.00 H ATOM 64953 H13S PA 1573 56.158 72.871 37.090 1.00 0.00 H ATOM 64954 C112 PA 1573 58.337 72.643 37.063 1.00 0.00 C ATOM 64955 H12R PA 1573 58.209 72.210 36.069 1.00 0.00 H ATOM 64956 H12S PA 1573 58.917 71.893 37.605 1.00 0.00 H ATOM 64957 C111 PA 1573 59.038 74.041 37.200 1.00 0.00 C ATOM 64958 H11R PA 1573 59.163 74.446 38.206 1.00 0.00 H ATOM 64959 H11S PA 1573 58.407 74.795 36.725 1.00 0.00 H ATOM 64960 C110 PA 1573 60.416 73.994 36.494 1.00 0.00 C ATOM 64961 H10R PA 1573 60.692 75.034 36.308 1.00 0.00 H ATOM 64962 H10S PA 1573 60.221 73.659 35.474 1.00 0.00 H ATOM 64963 C19 PA 1573 61.459 73.117 37.153 1.00 0.00 C ATOM 64964 H9R PA 1573 61.149 72.072 37.220 1.00 0.00 H ATOM 64965 H9S PA 1573 61.600 73.487 38.170 1.00 0.00 H ATOM 64966 C18 PA 1573 62.808 73.323 36.395 1.00 0.00 C ATOM 64967 H8R PA 1573 63.094 74.373 36.491 1.00 0.00 H ATOM 64968 H8S PA 1573 62.828 73.165 35.315 1.00 0.00 H ATOM 64969 C17 PA 1573 63.858 72.526 37.138 1.00 0.00 C ATOM 64970 H7R PA 1573 63.796 72.812 38.190 1.00 0.00 H ATOM 64971 H7S PA 1573 64.772 72.991 36.763 1.00 0.00 H ATOM 64972 C16 PA 1573 63.873 71.015 36.822 1.00 0.00 C ATOM 64973 H6R PA 1573 63.109 70.485 37.395 1.00 0.00 H ATOM 64974 H6S PA 1573 64.806 70.624 37.234 1.00 0.00 H ATOM 64975 C15 PA 1573 63.683 70.624 35.431 1.00 0.00 C ATOM 64976 H5R PA 1573 64.282 71.237 34.755 1.00 0.00 H ATOM 64977 H5S PA 1573 62.717 70.770 34.943 1.00 0.00 H ATOM 64978 C14 PA 1573 64.064 69.192 35.074 1.00 0.00 C ATOM 64979 H4R PA 1573 63.614 68.434 35.718 1.00 0.00 H ATOM 64980 H4S PA 1573 65.135 69.172 35.286 1.00 0.00 H ATOM 64981 C13 PA 1573 63.996 68.702 33.581 1.00 0.00 C ATOM 64982 H3R PA 1573 64.549 69.358 32.906 1.00 0.00 H ATOM 64983 H3S PA 1573 62.955 68.874 33.298 1.00 0.00 H ATOM 64984 C12 PA 1573 64.567 67.358 33.370 1.00 0.00 C ATOM 64985 H2R PA 1573 63.975 66.605 33.895 1.00 0.00 H ATOM 64986 H2S PA 1573 65.591 67.204 33.716 1.00 0.00 H ATOM 64987 C11 PC 1574 64.601 66.984 31.881 1.00 0.00 C ATOM 64988 O12 PC 1574 63.804 67.332 31.012 1.00 0.00 O ATOM 64989 O11 PC 1574 65.682 66.102 31.649 1.00 0.00 O ATOM 64990 C1 PC 1574 66.070 65.822 30.250 1.00 0.00 C ATOM 64991 HR PC 1574 66.422 66.748 29.789 1.00 0.00 H ATOM 64992 HS PC 1574 65.139 65.574 29.734 1.00 0.00 H ATOM 64993 C2 PC 1574 67.023 64.680 30.012 1.00 0.00 C ATOM 64994 HX PC 1574 67.948 64.983 30.508 1.00 0.00 H ATOM 64995 C3 PC 1574 67.256 64.549 28.529 1.00 0.00 C ATOM 64996 HA PC 1574 67.706 63.575 28.319 1.00 0.00 H ATOM 64997 HB PC 1574 68.029 65.262 28.230 1.00 0.00 H ATOM 64998 O31 PC 1574 66.147 64.732 27.748 1.00 0.00 O ATOM 64999 P31 PC 1574 66.117 64.755 26.115 1.00 0.00 P ATOM 65000 O32 PC 1574 67.110 65.877 25.706 1.00 0.00 O ATOM 65001 C31 PC 1574 66.814 67.252 25.826 1.00 0.00 C ATOM 65002 H1A PC 1574 66.725 67.448 26.897 1.00 0.00 H ATOM 65003 H1B PC 1574 65.838 67.450 25.376 1.00 0.00 H ATOM 65004 C32 PC 1574 67.834 68.139 25.235 1.00 0.00 C ATOM 65005 H2A PC 1574 68.812 67.665 25.321 1.00 0.00 H ATOM 65006 H2B PC 1574 67.844 69.112 25.729 1.00 0.00 H ATOM 65007 N31 PC 1574 67.925 68.470 23.787 1.00 0.00 N ATOM 65008 C33 PC 1574 69.207 69.132 23.517 1.00 0.00 C ATOM 65009 H3A PC 1574 69.245 70.146 23.915 1.00 0.00 H ATOM 65010 H3B PC 1574 69.104 69.259 22.438 1.00 0.00 H ATOM 65011 H3C PC 1574 70.059 68.534 23.844 1.00 0.00 H ATOM 65012 C34 PC 1574 67.914 67.186 23.058 1.00 0.00 C ATOM 65013 H4A PC 1574 67.041 66.569 23.275 1.00 0.00 H ATOM 65014 H4B PC 1574 68.798 66.601 23.315 1.00 0.00 H ATOM 65015 H4C PC 1574 67.955 67.484 22.009 1.00 0.00 H ATOM 65016 C35 PC 1574 66.775 69.322 23.418 1.00 0.00 C ATOM 65017 H5A PC 1574 66.736 69.700 22.395 1.00 0.00 H ATOM 65018 H5B PC 1574 66.861 70.193 24.070 1.00 0.00 H ATOM 65019 H5C PC 1574 65.898 68.690 23.566 1.00 0.00 H ATOM 65020 O33 PC 1574 66.672 63.438 25.667 1.00 0.00 O ATOM 65021 O34 PC 1574 64.758 65.194 25.687 1.00 0.00 O ATOM 65022 O21 PC 1574 66.529 63.357 30.488 1.00 0.00 O ATOM 65023 C21 PC 1574 67.286 62.246 30.373 1.00 0.00 C ATOM 65024 O22 PC 1574 68.508 62.298 30.211 1.00 0.00 O ATOM 65025 C12 OL 1575 66.389 60.962 30.532 1.00 0.00 C ATOM 65026 H2R OL 1575 65.848 60.861 31.475 1.00 0.00 H ATOM 65027 H2S OL 1575 65.612 61.105 29.778 1.00 0.00 H ATOM 65028 C13 OL 1575 67.171 59.706 30.266 1.00 0.00 C ATOM 65029 H3R OL 1575 67.679 59.825 29.307 1.00 0.00 H ATOM 65030 H3S OL 1575 67.873 59.501 31.077 1.00 0.00 H ATOM 65031 C14 OL 1575 66.251 58.433 30.261 1.00 0.00 C ATOM 65032 H4R OL 1575 65.330 58.676 30.796 1.00 0.00 H ATOM 65033 H4S OL 1575 66.016 58.209 29.218 1.00 0.00 H ATOM 65034 C15 OL 1575 66.899 57.165 30.704 1.00 0.00 C ATOM 65035 H5R OL 1575 66.165 56.357 30.668 1.00 0.00 H ATOM 65036 H5S OL 1575 67.722 56.927 30.026 1.00 0.00 H ATOM 65037 C16 OL 1575 67.252 57.108 32.186 1.00 0.00 C ATOM 65038 H6R OL 1575 68.083 57.775 32.423 1.00 0.00 H ATOM 65039 H6S OL 1575 66.402 57.472 32.768 1.00 0.00 H ATOM 65040 C17 OL 1575 67.705 55.723 32.703 1.00 0.00 C ATOM 65041 H7R OL 1575 66.997 54.911 32.527 1.00 0.00 H ATOM 65042 H7S OL 1575 68.669 55.487 32.248 1.00 0.00 H ATOM 65043 C18 OL 1575 67.811 55.727 34.200 1.00 0.00 C ATOM 65044 H8R OL 1575 68.187 56.704 34.510 1.00 0.00 H ATOM 65045 H8S OL 1575 66.763 55.687 34.504 1.00 0.00 H ATOM 65046 C19 OL 1575 68.485 54.568 34.659 1.00 0.00 C ATOM 65047 H9R OL 1575 69.527 54.830 34.827 1.00 0.00 H ATOM 65048 C110 OL 1575 67.922 53.388 35.085 1.00 0.00 C ATOM 65049 H10R OL 1575 68.617 52.581 35.305 1.00 0.00 H ATOM 65050 C111 OL 1575 66.480 53.018 35.091 1.00 0.00 C ATOM 65051 H11R OL 1575 65.929 53.860 34.668 1.00 0.00 H ATOM 65052 H11S OL 1575 66.371 52.209 34.365 1.00 0.00 H ATOM 65053 C112 OL 1575 65.900 52.718 36.496 1.00 0.00 C ATOM 65054 H12R OL 1575 66.446 51.883 36.942 1.00 0.00 H ATOM 65055 H12S OL 1575 66.089 53.515 37.218 1.00 0.00 H ATOM 65056 C113 OL 1575 64.330 52.403 36.455 1.00 0.00 C ATOM 65057 H13R OL 1575 63.920 53.391 36.235 1.00 0.00 H ATOM 65058 H13S OL 1575 63.971 51.779 35.635 1.00 0.00 H ATOM 65059 C114 OL 1575 63.833 51.714 37.771 1.00 0.00 C ATOM 65060 H14R OL 1575 62.813 51.330 37.700 1.00 0.00 H ATOM 65061 H14S OL 1575 64.435 50.830 37.989 1.00 0.00 H ATOM 65062 C115 OL 1575 63.901 52.731 38.875 1.00 0.00 C ATOM 65063 H15R OL 1575 64.982 52.824 39.002 1.00 0.00 H ATOM 65064 H15S OL 1575 63.463 53.636 38.448 1.00 0.00 H ATOM 65065 C116 OL 1575 63.298 52.277 40.203 1.00 0.00 C ATOM 65066 H16R OL 1575 62.238 52.137 39.983 1.00 0.00 H ATOM 65067 H16S OL 1575 63.718 51.301 40.455 1.00 0.00 H ATOM 65068 C117 OL 1575 63.669 53.244 41.334 1.00 0.00 C ATOM 65069 H17R OL 1575 64.728 53.090 41.550 1.00 0.00 H ATOM 65070 H17S OL 1575 63.426 54.292 41.148 1.00 0.00 H ATOM 65071 C118 OL 1575 62.922 52.945 42.680 1.00 0.00 C ATOM 65072 H18R OL 1575 61.856 52.882 42.450 1.00 0.00 H ATOM 65073 H18S OL 1575 63.016 53.778 43.380 1.00 0.00 H ATOM 65074 H18T OL 1575 63.263 52.037 43.180 1.00 0.00 H TER 65075 OL 1575 ATOM 65075 C116 PA 1576 5.766 62.253 39.751 1.00 0.00 C ATOM 65076 H16R PA 1576 4.717 62.000 39.580 1.00 0.00 H ATOM 65077 H16S PA 1576 5.689 62.835 40.671 1.00 0.00 H ATOM 65078 H16T PA 1576 6.190 61.346 40.187 1.00 0.00 H ATOM 65079 C115 PA 1576 6.474 62.938 38.630 1.00 0.00 C ATOM 65080 H15R PA 1576 6.629 62.218 37.824 1.00 0.00 H ATOM 65081 H15S PA 1576 7.430 63.230 39.070 1.00 0.00 H ATOM 65082 C114 PA 1576 5.692 64.172 38.009 1.00 0.00 C ATOM 65083 H14R PA 1576 5.421 64.800 38.860 1.00 0.00 H ATOM 65084 H14S PA 1576 4.813 63.806 37.474 1.00 0.00 H ATOM 65085 C113 PA 1576 6.603 65.011 37.067 1.00 0.00 C ATOM 65086 H13R PA 1576 6.941 64.332 36.281 1.00 0.00 H ATOM 65087 H13S PA 1576 7.497 65.322 37.611 1.00 0.00 H ATOM 65088 C112 PA 1576 5.982 66.105 36.426 1.00 0.00 C ATOM 65089 H12R PA 1576 5.238 65.654 35.767 1.00 0.00 H ATOM 65090 H12S PA 1576 6.702 66.531 35.724 1.00 0.00 H ATOM 65091 C111 PA 1576 5.478 67.209 37.317 1.00 0.00 C ATOM 65092 H11R PA 1576 6.412 67.612 37.712 1.00 0.00 H ATOM 65093 H11S PA 1576 4.967 66.821 38.201 1.00 0.00 H ATOM 65094 C110 PA 1576 4.741 68.259 36.456 1.00 0.00 C ATOM 65095 H10R PA 1576 3.814 67.837 36.064 1.00 0.00 H ATOM 65096 H10S PA 1576 5.339 68.431 35.559 1.00 0.00 H ATOM 65097 C19 PA 1576 4.468 69.478 37.355 1.00 0.00 C ATOM 65098 H9R PA 1576 5.459 69.830 37.648 1.00 0.00 H ATOM 65099 H9S PA 1576 3.990 69.229 38.305 1.00 0.00 H ATOM 65100 C18 PA 1576 3.674 70.593 36.660 1.00 0.00 C ATOM 65101 H8R PA 1576 3.801 71.460 37.311 1.00 0.00 H ATOM 65102 H8S PA 1576 2.603 70.387 36.724 1.00 0.00 H ATOM 65103 C17 PA 1576 4.221 70.825 35.287 1.00 0.00 C ATOM 65104 H7R PA 1576 4.109 69.933 34.667 1.00 0.00 H ATOM 65105 H7S PA 1576 5.298 70.987 35.369 1.00 0.00 H ATOM 65106 C16 PA 1576 3.405 71.898 34.472 1.00 0.00 C ATOM 65107 H6R PA 1576 3.388 72.846 35.014 1.00 0.00 H ATOM 65108 H6S PA 1576 2.359 71.616 34.335 1.00 0.00 H ATOM 65109 C15 PA 1576 3.933 72.118 33.044 1.00 0.00 C ATOM 65110 H5R PA 1576 3.733 71.225 32.449 1.00 0.00 H ATOM 65111 H5S PA 1576 5.024 72.173 33.048 1.00 0.00 H ATOM 65112 C14 PA 1576 3.212 73.158 32.285 1.00 0.00 C ATOM 65113 H4R PA 1576 3.129 74.141 32.754 1.00 0.00 H ATOM 65114 H4S PA 1576 2.128 73.023 32.254 1.00 0.00 H ATOM 65115 C13 PA 1576 3.715 73.204 30.809 1.00 0.00 C ATOM 65116 H3R PA 1576 4.726 73.613 30.761 1.00 0.00 H ATOM 65117 H3S PA 1576 2.992 73.884 30.354 1.00 0.00 H ATOM 65118 C12 PA 1576 3.672 71.841 30.045 1.00 0.00 C ATOM 65119 H2R PA 1576 2.759 71.260 30.193 1.00 0.00 H ATOM 65120 H2S PA 1576 4.505 71.296 30.493 1.00 0.00 H ATOM 65121 C11 PGR 1577 4.102 72.043 28.647 1.00 0.00 C ATOM 65122 O12 PGR 1577 3.398 71.831 27.676 1.00 0.00 O ATOM 65123 O11 PGR 1577 5.431 72.374 28.571 1.00 0.00 O ATOM 65124 C1 PGR 1577 6.167 72.172 27.296 1.00 0.00 C ATOM 65125 HR PGR 1577 5.666 71.409 26.695 1.00 0.00 H ATOM 65126 HS PGR 1577 7.148 71.765 27.556 1.00 0.00 H ATOM 65127 C2 PGR 1577 6.245 73.462 26.427 1.00 0.00 C ATOM 65128 HX PGR 1577 5.176 73.681 26.362 1.00 0.00 H ATOM 65129 C3 PGR 1577 6.956 73.271 25.043 1.00 0.00 C ATOM 65130 HA PGR 1577 6.522 72.429 24.498 1.00 0.00 H ATOM 65131 HB PGR 1577 8.016 73.003 25.079 1.00 0.00 H ATOM 65132 O31 PGR 1577 6.872 74.416 24.176 1.00 0.00 O ATOM 65133 P31 PGR 1577 7.434 74.451 22.704 1.00 0.00 P ATOM 65134 O32 PGR 1577 6.476 73.418 21.995 1.00 0.00 O ATOM 65135 C31 PGR 1577 5.081 73.720 21.933 1.00 0.00 C ATOM 65136 H1A PGR 1577 4.775 74.764 21.829 1.00 0.00 H ATOM 65137 H1B PGR 1577 4.605 73.337 22.839 1.00 0.00 H ATOM 65138 C32 PGR 1577 4.328 72.984 20.877 1.00 0.00 C ATOM 65139 H2A PGR 1577 4.734 71.969 20.907 1.00 0.00 H ATOM 65140 O35 PGR 1577 4.684 73.692 19.634 1.00 0.00 O ATOM 65141 HO5A PGR 1577 5.613 73.979 19.569 1.00 0.00 H ATOM 65142 C33 PGR 1577 2.808 72.829 21.086 1.00 0.00 C ATOM 65143 H3A PGR 1577 2.397 72.370 20.183 1.00 0.00 H ATOM 65144 H3B PGR 1577 2.550 72.195 21.938 1.00 0.00 H ATOM 65145 O33 PGR 1577 7.183 75.742 22.089 1.00 0.00 O ATOM 65146 O34 PGR 1577 8.754 73.852 22.758 1.00 0.00 O ATOM 65147 O21 PGR 1577 7.023 74.400 27.235 1.00 0.00 O ATOM 65148 C21 PGR 1577 6.314 75.329 27.893 1.00 0.00 C ATOM 65149 O22 PGR 1577 5.115 75.462 27.637 1.00 0.00 O ATOM 65150 O36 PGR 1577 2.128 74.087 21.198 1.00 0.00 O ATOM 65151 HO6A PGR 1577 2.578 74.691 20.579 1.00 0.00 H ATOM 65152 C12 OL 1578 7.134 76.427 28.601 1.00 0.00 C ATOM 65153 H2R OL 1578 8.185 76.139 28.681 1.00 0.00 H ATOM 65154 H2S OL 1578 7.292 77.198 27.845 1.00 0.00 H ATOM 65155 C13 OL 1578 6.633 76.995 29.944 1.00 0.00 C ATOM 65156 H3R OL 1578 5.721 77.555 29.728 1.00 0.00 H ATOM 65157 H3S OL 1578 6.338 76.168 30.593 1.00 0.00 H ATOM 65158 C14 OL 1578 7.676 77.849 30.685 1.00 0.00 C ATOM 65159 H4R OL 1578 8.615 77.307 30.816 1.00 0.00 H ATOM 65160 H4S OL 1578 7.978 78.660 30.019 1.00 0.00 H ATOM 65161 C15 OL 1578 7.276 78.363 32.010 1.00 0.00 C ATOM 65162 H5R OL 1578 6.461 79.082 31.902 1.00 0.00 H ATOM 65163 H5S OL 1578 6.917 77.609 32.713 1.00 0.00 H ATOM 65164 C16 OL 1578 8.450 78.877 32.866 1.00 0.00 C ATOM 65165 H6R OL 1578 9.358 78.275 32.788 1.00 0.00 H ATOM 65166 H6S OL 1578 8.665 79.846 32.411 1.00 0.00 H ATOM 65167 C17 OL 1578 7.981 79.082 34.299 1.00 0.00 C ATOM 65168 H7R OL 1578 6.989 79.535 34.242 1.00 0.00 H ATOM 65169 H7S OL 1578 7.951 78.115 34.806 1.00 0.00 H ATOM 65170 C18 OL 1578 8.894 79.911 35.229 1.00 0.00 C ATOM 65171 H8R OL 1578 9.744 79.329 35.590 1.00 0.00 H ATOM 65172 H8S OL 1578 9.348 80.724 34.660 1.00 0.00 H ATOM 65173 C19 OL 1578 8.048 80.520 36.323 1.00 0.00 C ATOM 65174 H9R OL 1578 7.299 81.241 36.005 1.00 0.00 H ATOM 65175 C110 OL 1578 7.993 80.103 37.631 1.00 0.00 C ATOM 65176 H10R OL 1578 7.206 80.579 38.210 1.00 0.00 H ATOM 65177 C111 OL 1578 8.718 78.992 38.281 1.00 0.00 C ATOM 65178 H11R OL 1578 8.011 78.159 38.285 1.00 0.00 H ATOM 65179 H11S OL 1578 9.530 78.587 37.673 1.00 0.00 H ATOM 65180 C112 OL 1578 9.144 79.311 39.739 1.00 0.00 C ATOM 65181 H12R OL 1578 8.232 79.362 40.339 1.00 0.00 H ATOM 65182 H12S OL 1578 9.763 78.488 40.102 1.00 0.00 H ATOM 65183 C113 OL 1578 9.910 80.620 39.867 1.00 0.00 C ATOM 65184 H13R OL 1578 10.715 80.725 39.137 1.00 0.00 H ATOM 65185 H13S OL 1578 9.337 81.491 39.542 1.00 0.00 H ATOM 65186 C114 OL 1578 10.361 80.735 41.351 1.00 0.00 C ATOM 65187 H14R OL 1578 9.430 80.788 41.920 1.00 0.00 H ATOM 65188 H14S OL 1578 10.943 79.829 41.531 1.00 0.00 H ATOM 65189 C115 OL 1578 11.187 81.917 41.814 1.00 0.00 C ATOM 65190 H15R OL 1578 10.668 82.869 41.680 1.00 0.00 H ATOM 65191 H15S OL 1578 11.396 81.768 42.875 1.00 0.00 H ATOM 65192 C116 OL 1578 12.356 82.174 41.004 1.00 0.00 C ATOM 65193 H16R OL 1578 12.866 81.251 40.721 1.00 0.00 H ATOM 65194 H16S OL 1578 12.048 82.690 40.092 1.00 0.00 H ATOM 65195 C117 OL 1578 13.323 83.030 41.730 1.00 0.00 C ATOM 65196 H17R OL 1578 12.871 84.009 41.897 1.00 0.00 H ATOM 65197 H17S OL 1578 13.434 82.611 42.733 1.00 0.00 H ATOM 65198 C118 OL 1578 14.671 83.087 40.952 1.00 0.00 C ATOM 65199 H18R OL 1578 15.362 83.820 41.374 1.00 0.00 H ATOM 65200 H18S OL 1578 14.536 83.294 39.889 1.00 0.00 H ATOM 65201 H18T OL 1578 15.165 82.113 40.984 1.00 0.00 H TER 65202 OL 1578 ATOM 65202 C116 PA 1579 113.402 142.079 40.240 1.00 0.00 C ATOM 65203 H16R PA 1579 113.341 143.169 40.267 1.00 0.00 H ATOM 65204 H16S PA 1579 114.428 141.786 40.009 1.00 0.00 H ATOM 65205 H16T PA 1579 113.226 141.833 41.290 1.00 0.00 H ATOM 65206 C115 PA 1579 112.362 141.516 39.313 1.00 0.00 C ATOM 65207 H15R PA 1579 112.546 142.074 38.392 1.00 0.00 H ATOM 65208 H15S PA 1579 111.383 141.814 39.691 1.00 0.00 H ATOM 65209 C114 PA 1579 112.481 140.023 39.050 1.00 0.00 C ATOM 65210 H14R PA 1579 112.586 139.398 39.939 1.00 0.00 H ATOM 65211 H14S PA 1579 113.349 139.859 38.408 1.00 0.00 H ATOM 65212 C113 PA 1579 111.321 139.591 38.165 1.00 0.00 C ATOM 65213 H13R PA 1579 110.337 139.803 38.588 1.00 0.00 H ATOM 65214 H13S PA 1579 111.310 138.501 38.219 1.00 0.00 H ATOM 65215 C112 PA 1579 111.130 140.228 36.794 1.00 0.00 C ATOM 65216 H12R PA 1579 111.957 139.911 36.154 1.00 0.00 H ATOM 65217 H12S PA 1579 111.256 141.304 36.932 1.00 0.00 H ATOM 65218 C111 PA 1579 109.788 139.940 36.171 1.00 0.00 C ATOM 65219 H11R PA 1579 109.052 140.652 36.552 1.00 0.00 H ATOM 65220 H11S PA 1579 109.274 139.035 36.501 1.00 0.00 H ATOM 65221 C110 PA 1579 109.623 140.042 34.647 1.00 0.00 C ATOM 65222 H10R PA 1579 108.777 140.706 34.461 1.00 0.00 H ATOM 65223 H10S PA 1579 109.397 139.015 34.352 1.00 0.00 H ATOM 65224 C19 PA 1579 110.812 140.455 33.751 1.00 0.00 C ATOM 65225 H9R PA 1579 111.777 140.018 34.016 1.00 0.00 H ATOM 65226 H9S PA 1579 110.864 141.489 34.097 1.00 0.00 H ATOM 65227 C18 PA 1579 110.567 140.437 32.247 1.00 0.00 C ATOM 65228 H8R PA 1579 109.564 140.802 32.017 1.00 0.00 H ATOM 65229 H8S PA 1579 110.636 139.384 31.966 1.00 0.00 H ATOM 65230 C17 PA 1579 111.613 141.162 31.353 1.00 0.00 C ATOM 65231 H7R PA 1579 112.579 140.916 31.799 1.00 0.00 H ATOM 65232 H7S PA 1579 111.625 142.254 31.330 1.00 0.00 H ATOM 65233 C16 PA 1579 111.504 140.673 29.915 1.00 0.00 C ATOM 65234 H6R PA 1579 110.515 141.036 29.626 1.00 0.00 H ATOM 65235 H6S PA 1579 111.600 139.588 29.837 1.00 0.00 H ATOM 65236 C15 PA 1579 112.518 141.299 28.985 1.00 0.00 C ATOM 65237 H5R PA 1579 112.378 142.375 29.108 1.00 0.00 H ATOM 65238 H5S PA 1579 112.258 141.105 27.942 1.00 0.00 H ATOM 65239 C14 PA 1579 113.978 140.970 29.273 1.00 0.00 C ATOM 65240 H4R PA 1579 114.156 139.892 29.261 1.00 0.00 H ATOM 65241 H4S PA 1579 114.276 141.242 30.288 1.00 0.00 H ATOM 65242 C13 PA 1579 115.030 141.435 28.237 1.00 0.00 C ATOM 65243 H3R PA 1579 114.997 142.516 28.087 1.00 0.00 H ATOM 65244 H3S PA 1579 114.772 141.038 27.253 1.00 0.00 H ATOM 65245 C12 PA 1579 116.475 141.055 28.617 1.00 0.00 C ATOM 65246 H2R PA 1579 116.571 140.078 29.096 1.00 0.00 H ATOM 65247 H2S PA 1579 116.859 141.784 29.333 1.00 0.00 H ATOM 65248 C11 PC 1580 117.365 140.917 27.422 1.00 0.00 C ATOM 65249 O12 PC 1580 116.997 141.206 26.298 1.00 0.00 O ATOM 65250 O11 PC 1580 118.560 140.454 27.813 1.00 0.00 O ATOM 65251 C1 PC 1580 119.574 140.540 26.810 1.00 0.00 C ATOM 65252 HR PC 1580 119.229 140.124 25.859 1.00 0.00 H ATOM 65253 HS PC 1580 120.422 139.927 27.127 1.00 0.00 H ATOM 65254 C2 PC 1580 119.987 142.017 26.658 1.00 0.00 C ATOM 65255 HX PC 1580 119.190 142.763 26.612 1.00 0.00 H ATOM 65256 C3 PC 1580 120.680 142.117 25.254 1.00 0.00 C ATOM 65257 HA PC 1580 121.362 142.952 25.431 1.00 0.00 H ATOM 65258 HB PC 1580 119.975 142.398 24.467 1.00 0.00 H ATOM 65259 O31 PC 1580 121.467 140.985 24.853 1.00 0.00 O ATOM 65260 P31 PC 1580 122.559 141.231 23.608 1.00 0.00 P ATOM 65261 O32 PC 1580 121.623 141.333 22.293 1.00 0.00 O ATOM 65262 C31 PC 1580 121.280 140.163 21.586 1.00 0.00 C ATOM 65263 H1A PC 1580 122.228 139.645 21.420 1.00 0.00 H ATOM 65264 H1B PC 1580 120.993 140.433 20.567 1.00 0.00 H ATOM 65265 C32 PC 1580 120.313 139.161 22.361 1.00 0.00 C ATOM 65266 H2A PC 1580 119.363 139.688 22.458 1.00 0.00 H ATOM 65267 H2B PC 1580 120.784 139.114 23.344 1.00 0.00 H ATOM 65268 N31 PC 1580 119.925 137.841 21.607 1.00 0.00 N ATOM 65269 C33 PC 1580 119.009 137.059 22.513 1.00 0.00 C ATOM 65270 H3A PC 1580 119.620 136.735 23.357 1.00 0.00 H ATOM 65271 H3B PC 1580 118.580 136.246 21.925 1.00 0.00 H ATOM 65272 H3C PC 1580 118.196 137.715 22.825 1.00 0.00 H ATOM 65273 C34 PC 1580 119.175 138.048 20.396 1.00 0.00 C ATOM 65274 H4A PC 1580 118.197 138.485 20.603 1.00 0.00 H ATOM 65275 H4B PC 1580 118.973 137.189 19.755 1.00 0.00 H ATOM 65276 H4C PC 1580 119.743 138.767 19.805 1.00 0.00 H ATOM 65277 C35 PC 1580 121.195 136.967 21.448 1.00 0.00 C ATOM 65278 H5A PC 1580 121.586 136.752 22.444 1.00 0.00 H ATOM 65279 H5B PC 1580 121.908 137.528 20.842 1.00 0.00 H ATOM 65280 H5C PC 1580 120.843 136.080 20.918 1.00 0.00 H ATOM 65281 O33 PC 1580 123.202 142.547 23.823 1.00 0.00 O ATOM 65282 O34 PC 1580 123.451 140.054 23.619 1.00 0.00 O ATOM 65283 O21 PC 1580 120.987 142.285 27.651 1.00 0.00 O ATOM 65284 C21 PC 1580 121.545 143.509 27.787 1.00 0.00 C ATOM 65285 O22 PC 1580 121.183 144.466 27.144 1.00 0.00 O ATOM 65286 C12 OL 1581 122.364 143.478 28.993 1.00 0.00 C ATOM 65287 H2R OL 1581 122.776 142.477 29.139 1.00 0.00 H ATOM 65288 H2S OL 1581 123.239 144.111 28.831 1.00 0.00 H ATOM 65289 C13 OL 1581 121.510 144.173 30.104 1.00 0.00 C ATOM 65290 H3R OL 1581 121.935 144.203 31.109 1.00 0.00 H ATOM 65291 H3S OL 1581 121.364 145.209 29.791 1.00 0.00 H ATOM 65292 C14 OL 1581 120.149 143.591 30.297 1.00 0.00 C ATOM 65293 H4R OL 1581 119.595 143.593 29.356 1.00 0.00 H ATOM 65294 H4S OL 1581 120.260 142.526 30.509 1.00 0.00 H ATOM 65295 C15 OL 1581 119.280 144.373 31.315 1.00 0.00 C ATOM 65296 H5R OL 1581 119.830 144.396 32.258 1.00 0.00 H ATOM 65297 H5S OL 1581 119.108 145.430 31.102 1.00 0.00 H ATOM 65298 C16 OL 1581 117.900 143.773 31.455 1.00 0.00 C ATOM 65299 H6R OL 1581 117.429 143.889 30.476 1.00 0.00 H ATOM 65300 H6S OL 1581 117.983 142.689 31.561 1.00 0.00 H ATOM 65301 C17 OL 1581 117.112 144.437 32.512 1.00 0.00 C ATOM 65302 H7R OL 1581 117.605 144.269 33.471 1.00 0.00 H ATOM 65303 H7S OL 1581 116.935 145.514 32.473 1.00 0.00 H ATOM 65304 C18 OL 1581 115.672 143.815 32.565 1.00 0.00 C ATOM 65305 H8R OL 1581 115.192 144.017 31.605 1.00 0.00 H ATOM 65306 H8S OL 1581 115.783 142.729 32.602 1.00 0.00 H ATOM 65307 C19 OL 1581 114.977 144.382 33.772 1.00 0.00 C ATOM 65308 H9R OL 1581 115.629 144.393 34.641 1.00 0.00 H ATOM 65309 C110 OL 1581 113.827 144.980 33.919 1.00 0.00 C ATOM 65310 H10R OL 1581 113.360 145.203 34.875 1.00 0.00 H ATOM 65311 C111 OL 1581 112.868 145.251 32.736 1.00 0.00 C ATOM 65312 H11R OL 1581 112.792 146.337 32.655 1.00 0.00 H ATOM 65313 H11S OL 1581 113.363 144.947 31.811 1.00 0.00 H ATOM 65314 C112 OL 1581 111.451 144.705 32.972 1.00 0.00 C ATOM 65315 H12R OL 1581 111.606 143.625 32.998 1.00 0.00 H ATOM 65316 H12S OL 1581 111.150 145.060 33.959 1.00 0.00 H ATOM 65317 C113 OL 1581 110.459 145.059 31.783 1.00 0.00 C ATOM 65318 H13R OL 1581 110.738 146.036 31.382 1.00 0.00 H ATOM 65319 H13S OL 1581 110.597 144.430 30.902 1.00 0.00 H ATOM 65320 C114 OL 1581 108.981 144.982 32.252 1.00 0.00 C ATOM 65321 H14R OL 1581 108.673 145.707 33.009 1.00 0.00 H ATOM 65322 H14S OL 1581 108.368 145.426 31.465 1.00 0.00 H ATOM 65323 C115 OL 1581 108.482 143.604 32.656 1.00 0.00 C ATOM 65324 H15R OL 1581 108.544 142.878 31.843 1.00 0.00 H ATOM 65325 H15S OL 1581 109.057 143.185 33.484 1.00 0.00 H ATOM 65326 C116 OL 1581 107.017 143.703 33.109 1.00 0.00 C ATOM 65327 H16R OL 1581 106.944 144.500 33.853 1.00 0.00 H ATOM 65328 H16S OL 1581 106.365 144.074 32.316 1.00 0.00 H ATOM 65329 C117 OL 1581 106.390 142.353 33.475 1.00 0.00 C ATOM 65330 H17R OL 1581 106.946 141.631 32.873 1.00 0.00 H ATOM 65331 H17S OL 1581 106.538 142.117 34.531 1.00 0.00 H ATOM 65332 C118 OL 1581 104.853 142.397 33.324 1.00 0.00 C ATOM 65333 H18R OL 1581 104.530 142.366 32.281 1.00 0.00 H ATOM 65334 H18S OL 1581 104.389 143.294 33.738 1.00 0.00 H ATOM 65335 H18T OL 1581 104.498 141.531 33.887 1.00 0.00 H TER 65336 OL 1581 ATOM 65336 C116 PA 1582 59.044 62.147 42.633 1.00 0.00 C ATOM 65337 H16R PA 1582 58.601 61.977 43.616 1.00 0.00 H ATOM 65338 H16S PA 1582 59.375 61.158 42.309 1.00 0.00 H ATOM 65339 H16T PA 1582 58.348 62.627 41.942 1.00 0.00 H ATOM 65340 C115 PA 1582 60.141 63.148 42.774 1.00 0.00 C ATOM 65341 H15R PA 1582 60.721 62.995 43.686 1.00 0.00 H ATOM 65342 H15S PA 1582 59.772 64.168 42.901 1.00 0.00 H ATOM 65343 C114 PA 1582 61.094 63.157 41.602 1.00 0.00 C ATOM 65344 H14R PA 1582 60.575 63.057 40.647 1.00 0.00 H ATOM 65345 H14S PA 1582 61.896 62.432 41.755 1.00 0.00 H ATOM 65346 C113 PA 1582 61.872 64.481 41.384 1.00 0.00 C ATOM 65347 H13R PA 1582 62.350 64.379 40.408 1.00 0.00 H ATOM 65348 H13S PA 1582 62.790 64.608 41.963 1.00 0.00 H ATOM 65349 C112 PA 1582 60.948 65.689 41.369 1.00 0.00 C ATOM 65350 H12R PA 1582 60.386 65.818 42.297 1.00 0.00 H ATOM 65351 H12S PA 1582 60.218 65.528 40.573 1.00 0.00 H ATOM 65352 C111 PA 1582 61.811 66.975 41.159 1.00 0.00 C ATOM 65353 H11R PA 1582 62.243 66.786 40.175 1.00 0.00 H ATOM 65354 H11S PA 1582 62.661 67.039 41.841 1.00 0.00 H ATOM 65355 C110 PA 1582 60.858 68.256 41.031 1.00 0.00 C ATOM 65356 H10R PA 1582 61.363 69.202 41.240 1.00 0.00 H ATOM 65357 H10S PA 1582 60.087 68.120 41.792 1.00 0.00 H ATOM 65358 C19 PA 1582 60.019 68.251 39.734 1.00 0.00 C ATOM 65359 H9R PA 1582 59.190 68.941 39.904 1.00 0.00 H ATOM 65360 H9S PA 1582 59.600 67.256 39.571 1.00 0.00 H ATOM 65361 C18 PA 1582 60.692 68.705 38.438 1.00 0.00 C ATOM 65362 H8R PA 1582 61.695 68.296 38.304 1.00 0.00 H ATOM 65363 H8S PA 1582 60.927 69.762 38.576 1.00 0.00 H ATOM 65364 C17 PA 1582 59.795 68.562 37.228 1.00 0.00 C ATOM 65365 H7R PA 1582 58.794 68.881 37.527 1.00 0.00 H ATOM 65366 H7S PA 1582 59.777 67.481 37.076 1.00 0.00 H ATOM 65367 C16 PA 1582 60.272 69.152 35.959 1.00 0.00 C ATOM 65368 H6R PA 1582 61.145 68.618 35.578 1.00 0.00 H ATOM 65369 H6S PA 1582 60.683 70.153 36.103 1.00 0.00 H ATOM 65370 C15 PA 1582 59.237 69.201 34.955 1.00 0.00 C ATOM 65371 H5R PA 1582 58.414 69.863 35.233 1.00 0.00 H ATOM 65372 H5S PA 1582 58.747 68.243 34.770 1.00 0.00 H ATOM 65373 C14 PA 1582 59.787 69.768 33.657 1.00 0.00 C ATOM 65374 H4R PA 1582 60.381 69.034 33.109 1.00 0.00 H ATOM 65375 H4S PA 1582 60.415 70.618 33.934 1.00 0.00 H ATOM 65376 C13 PA 1582 58.677 70.374 32.711 1.00 0.00 C ATOM 65377 H3R PA 1582 59.119 70.800 31.808 1.00 0.00 H ATOM 65378 H3S PA 1582 58.353 71.280 33.229 1.00 0.00 H ATOM 65379 C12 PA 1582 57.479 69.473 32.236 1.00 0.00 C ATOM 65380 H2R PA 1582 56.881 69.065 33.053 1.00 0.00 H ATOM 65381 H2S PA 1582 57.951 68.630 31.725 1.00 0.00 H ATOM 65382 C11 PGR 1583 56.547 70.142 31.195 1.00 0.00 C ATOM 65383 O12 PGR 1583 56.811 71.187 30.587 1.00 0.00 O ATOM 65384 O11 PGR 1583 55.434 69.490 31.004 1.00 0.00 O ATOM 65385 C1 PGR 1583 54.684 69.682 29.730 1.00 0.00 C ATOM 65386 HR PGR 1583 55.329 69.307 28.931 1.00 0.00 H ATOM 65387 HS PGR 1583 54.473 70.733 29.517 1.00 0.00 H ATOM 65388 C2 PGR 1583 53.423 68.761 29.864 1.00 0.00 C ATOM 65389 HX PGR 1583 53.780 67.794 30.227 1.00 0.00 H ATOM 65390 C3 PGR 1583 52.921 68.436 28.455 1.00 0.00 C ATOM 65391 HA PGR 1583 51.834 68.320 28.458 1.00 0.00 H ATOM 65392 HB PGR 1583 53.505 67.573 28.127 1.00 0.00 H ATOM 65393 O31 PGR 1583 53.088 69.436 27.498 1.00 0.00 O ATOM 65394 P31 PGR 1583 52.589 69.165 25.986 1.00 0.00 P ATOM 65395 O32 PGR 1583 53.220 67.776 25.512 1.00 0.00 O ATOM 65396 C31 PGR 1583 54.630 67.711 25.394 1.00 0.00 C ATOM 65397 H1A PGR 1583 55.071 67.972 26.360 1.00 0.00 H ATOM 65398 H1B PGR 1583 54.932 68.472 24.670 1.00 0.00 H ATOM 65399 C32 PGR 1583 55.092 66.360 24.791 1.00 0.00 C ATOM 65400 H2A PGR 1583 56.169 66.425 24.619 1.00 0.00 H ATOM 65401 O35 PGR 1583 54.415 66.006 23.594 1.00 0.00 O ATOM 65402 HO5A PGR 1583 54.817 65.137 23.418 1.00 0.00 H ATOM 65403 C33 PGR 1583 54.905 65.229 25.768 1.00 0.00 C ATOM 65404 H3A PGR 1583 55.689 65.457 26.495 1.00 0.00 H ATOM 65405 H3B PGR 1583 53.876 65.129 26.121 1.00 0.00 H ATOM 65406 O33 PGR 1583 51.206 68.874 26.097 1.00 0.00 O ATOM 65407 O34 PGR 1583 53.032 70.300 25.112 1.00 0.00 O ATOM 65408 O21 PGR 1583 52.396 69.280 30.723 1.00 0.00 O ATOM 65409 C21 PGR 1583 51.396 68.476 31.110 1.00 0.00 C ATOM 65410 O22 PGR 1583 51.245 67.293 30.824 1.00 0.00 O ATOM 65411 O36 PGR 1583 55.269 63.995 25.092 1.00 0.00 O ATOM 65412 HO6A PGR 1583 56.208 64.014 24.836 1.00 0.00 H ATOM 65413 C12 OL 1584 50.420 69.223 31.991 1.00 0.00 C ATOM 65414 H2R OL 1584 50.879 69.863 32.747 1.00 0.00 H ATOM 65415 H2S OL 1584 50.029 70.052 31.396 1.00 0.00 H ATOM 65416 C13 OL 1584 49.299 68.358 32.506 1.00 0.00 C ATOM 65417 H3R OL 1584 48.412 68.946 32.754 1.00 0.00 H ATOM 65418 H3S OL 1584 49.035 67.645 31.722 1.00 0.00 H ATOM 65419 C14 OL 1584 49.759 67.633 33.785 1.00 0.00 C ATOM 65420 H4R OL 1584 50.700 67.100 33.633 1.00 0.00 H ATOM 65421 H4S OL 1584 49.911 68.487 34.449 1.00 0.00 H ATOM 65422 C15 OL 1584 48.638 66.732 34.475 1.00 0.00 C ATOM 65423 H5R OL 1584 47.844 67.409 34.796 1.00 0.00 H ATOM 65424 H5S OL 1584 48.399 66.062 33.646 1.00 0.00 H ATOM 65425 C16 OL 1584 48.998 66.000 35.721 1.00 0.00 C ATOM 65426 H6R OL 1584 48.122 65.412 36.002 1.00 0.00 H ATOM 65427 H6S OL 1584 49.752 65.295 35.364 1.00 0.00 H ATOM 65428 C17 OL 1584 49.500 66.980 36.856 1.00 0.00 C ATOM 65429 H7R OL 1584 50.348 67.558 36.484 1.00 0.00 H ATOM 65430 H7S OL 1584 48.770 67.780 36.993 1.00 0.00 H ATOM 65431 C18 OL 1584 49.903 66.329 38.107 1.00 0.00 C ATOM 65432 H8R OL 1584 49.128 65.613 38.388 1.00 0.00 H ATOM 65433 H8S OL 1584 50.837 65.781 37.970 1.00 0.00 H ATOM 65434 C19 OL 1584 50.021 67.431 39.107 1.00 0.00 C ATOM 65435 H9R OL 1584 49.123 68.039 39.187 1.00 0.00 H ATOM 65436 C110 OL 1584 51.033 67.677 39.948 1.00 0.00 C ATOM 65437 H10R OL 1584 51.015 68.464 40.697 1.00 0.00 H ATOM 65438 C111 OL 1584 52.106 66.679 40.160 1.00 0.00 C ATOM 65439 H11R OL 1584 52.174 66.516 41.238 1.00 0.00 H ATOM 65440 H11S OL 1584 51.766 65.704 39.806 1.00 0.00 H ATOM 65441 C112 OL 1584 53.505 66.975 39.734 1.00 0.00 C ATOM 65442 H12R OL 1584 53.836 67.866 40.270 1.00 0.00 H ATOM 65443 H12S OL 1584 54.210 66.212 40.072 1.00 0.00 H ATOM 65444 C113 OL 1584 53.613 67.143 38.236 1.00 0.00 C ATOM 65445 H13R OL 1584 52.753 67.705 37.866 1.00 0.00 H ATOM 65446 H13S OL 1584 54.531 67.687 38.009 1.00 0.00 H ATOM 65447 C114 OL 1584 53.787 65.741 37.599 1.00 0.00 C ATOM 65448 H14R OL 1584 54.766 65.296 37.789 1.00 0.00 H ATOM 65449 H14S OL 1584 52.922 65.090 37.748 1.00 0.00 H ATOM 65450 C115 OL 1584 53.712 65.818 36.015 1.00 0.00 C ATOM 65451 H15R OL 1584 53.289 64.943 35.517 1.00 0.00 H ATOM 65452 H15S OL 1584 52.905 66.526 35.816 1.00 0.00 H ATOM 65453 C116 OL 1584 55.074 66.188 35.435 1.00 0.00 C ATOM 65454 H16R OL 1584 55.138 67.202 35.835 1.00 0.00 H ATOM 65455 H16S OL 1584 55.857 65.581 35.895 1.00 0.00 H ATOM 65456 C117 OL 1584 55.140 66.033 33.956 1.00 0.00 C ATOM 65457 H17R OL 1584 56.205 65.977 33.721 1.00 0.00 H ATOM 65458 H17S OL 1584 54.764 65.050 33.667 1.00 0.00 H ATOM 65459 C118 OL 1584 54.459 67.158 33.218 1.00 0.00 C ATOM 65460 H18R OL 1584 54.840 68.107 33.602 1.00 0.00 H ATOM 65461 H18S OL 1584 53.389 66.961 33.312 1.00 0.00 H ATOM 65462 H18T OL 1584 54.697 67.136 32.153 1.00 0.00 H TER 65463 OL 1584 ATOM 65463 C116 PA 1585 20.682 134.601 42.846 1.00 0.00 C ATOM 65464 H16R PA 1585 21.661 134.902 43.225 1.00 0.00 H ATOM 65465 H16S PA 1585 20.333 134.212 43.805 1.00 0.00 H ATOM 65466 H16T PA 1585 20.125 135.478 42.511 1.00 0.00 H ATOM 65467 C115 PA 1585 20.746 133.524 41.843 1.00 0.00 C ATOM 65468 H15R PA 1585 19.740 133.254 41.516 1.00 0.00 H ATOM 65469 H15S PA 1585 21.080 132.623 42.363 1.00 0.00 H ATOM 65470 C114 PA 1585 21.684 133.801 40.730 1.00 0.00 C ATOM 65471 H14R PA 1585 21.727 132.892 40.126 1.00 0.00 H ATOM 65472 H14S PA 1585 22.678 133.953 41.156 1.00 0.00 H ATOM 65473 C113 PA 1585 21.227 135.023 39.903 1.00 0.00 C ATOM 65474 H13R PA 1585 21.201 135.927 40.515 1.00 0.00 H ATOM 65475 H13S PA 1585 20.229 134.836 39.501 1.00 0.00 H ATOM 65476 C112 PA 1585 22.103 135.315 38.678 1.00 0.00 C ATOM 65477 H12R PA 1585 22.220 134.310 38.267 1.00 0.00 H ATOM 65478 H12S PA 1585 23.146 135.484 38.957 1.00 0.00 H ATOM 65479 C111 PA 1585 21.533 136.289 37.708 1.00 0.00 C ATOM 65480 H11R PA 1585 21.181 137.180 38.231 1.00 0.00 H ATOM 65481 H11S PA 1585 20.668 135.823 37.232 1.00 0.00 H ATOM 65482 C110 PA 1585 22.356 136.697 36.534 1.00 0.00 C ATOM 65483 H10R PA 1585 22.708 135.773 36.070 1.00 0.00 H ATOM 65484 H10S PA 1585 23.256 137.179 36.921 1.00 0.00 H ATOM 65485 C19 PA 1585 21.808 137.606 35.416 1.00 0.00 C ATOM 65486 H9R PA 1585 22.584 138.302 35.089 1.00 0.00 H ATOM 65487 H9S PA 1585 20.975 138.083 35.937 1.00 0.00 H ATOM 65488 C18 PA 1585 21.261 136.883 34.239 1.00 0.00 C ATOM 65489 H8R PA 1585 20.854 135.883 34.403 1.00 0.00 H ATOM 65490 H8S PA 1585 22.171 136.756 33.648 1.00 0.00 H ATOM 65491 C17 PA 1585 20.310 137.608 33.288 1.00 0.00 C ATOM 65492 H7R PA 1585 20.179 137.017 32.380 1.00 0.00 H ATOM 65493 H7S PA 1585 20.821 138.499 32.917 1.00 0.00 H ATOM 65494 C16 PA 1585 18.987 137.923 33.983 1.00 0.00 C ATOM 65495 H6R PA 1585 19.166 138.776 34.640 1.00 0.00 H ATOM 65496 H6S PA 1585 18.650 137.130 34.654 1.00 0.00 H ATOM 65497 C15 PA 1585 17.763 138.435 33.209 1.00 0.00 C ATOM 65498 H5R PA 1585 17.025 138.768 33.942 1.00 0.00 H ATOM 65499 H5S PA 1585 17.298 137.624 32.644 1.00 0.00 H ATOM 65500 C14 PA 1585 18.029 139.680 32.294 1.00 0.00 C ATOM 65501 H4R PA 1585 18.692 139.357 31.488 1.00 0.00 H ATOM 65502 H4S PA 1585 18.507 140.433 32.924 1.00 0.00 H ATOM 65503 C13 PA 1585 16.708 140.450 31.854 1.00 0.00 C ATOM 65504 H3R PA 1585 16.993 141.313 31.248 1.00 0.00 H ATOM 65505 H3S PA 1585 16.263 140.829 32.776 1.00 0.00 H ATOM 65506 C12 PA 1585 15.628 139.554 31.227 1.00 0.00 C ATOM 65507 H2R PA 1585 14.800 140.242 31.047 1.00 0.00 H ATOM 65508 H2S PA 1585 15.386 138.651 31.792 1.00 0.00 H ATOM 65509 C11 PGR 1586 16.070 139.129 29.853 1.00 0.00 C ATOM 65510 O12 PGR 1586 17.220 139.249 29.383 1.00 0.00 O ATOM 65511 O11 PGR 1586 15.085 138.625 29.058 1.00 0.00 O ATOM 65512 C1 PGR 1586 15.259 138.064 27.746 1.00 0.00 C ATOM 65513 HR PGR 1586 15.833 138.795 27.170 1.00 0.00 H ATOM 65514 HS PGR 1586 14.286 137.890 27.279 1.00 0.00 H ATOM 65515 C2 PGR 1586 16.038 136.757 27.826 1.00 0.00 C ATOM 65516 HX PGR 1586 17.087 136.987 28.027 1.00 0.00 H ATOM 65517 C3 PGR 1586 16.005 135.963 26.505 1.00 0.00 C ATOM 65518 HA PGR 1586 15.918 136.707 25.709 1.00 0.00 H ATOM 65519 HB PGR 1586 15.127 135.319 26.407 1.00 0.00 H ATOM 65520 O31 PGR 1586 17.227 135.208 26.394 1.00 0.00 O ATOM 65521 P31 PGR 1586 17.429 134.205 25.145 1.00 0.00 P ATOM 65522 O32 PGR 1586 16.514 132.947 25.496 1.00 0.00 O ATOM 65523 C31 PGR 1586 17.011 131.891 26.409 1.00 0.00 C ATOM 65524 H1A PGR 1586 17.879 131.450 25.912 1.00 0.00 H ATOM 65525 H1B PGR 1586 16.270 131.107 26.583 1.00 0.00 H ATOM 65526 C32 PGR 1586 17.259 132.253 27.813 1.00 0.00 C ATOM 65527 H2A PGR 1586 16.467 132.932 28.140 1.00 0.00 H ATOM 65528 O35 PGR 1586 18.574 132.838 28.120 1.00 0.00 O ATOM 65529 HO5A PGR 1586 18.671 133.672 27.625 1.00 0.00 H ATOM 65530 C33 PGR 1586 17.175 131.082 28.803 1.00 0.00 C ATOM 65531 H3A PGR 1586 17.498 131.496 29.762 1.00 0.00 H ATOM 65532 H3B PGR 1586 16.116 130.916 29.017 1.00 0.00 H ATOM 65533 O33 PGR 1586 16.809 134.827 23.929 1.00 0.00 O ATOM 65534 O34 PGR 1586 18.853 133.733 25.080 1.00 0.00 O ATOM 65535 O21 PGR 1586 15.618 135.994 28.983 1.00 0.00 O ATOM 65536 C21 PGR 1586 14.449 135.350 29.061 1.00 0.00 C ATOM 65537 O22 PGR 1586 13.554 135.477 28.293 1.00 0.00 O ATOM 65538 O36 PGR 1586 17.871 129.985 28.308 1.00 0.00 O ATOM 65539 HO6A PGR 1586 18.820 130.200 28.302 1.00 0.00 H ATOM 65540 C12 OL 1587 14.321 134.382 30.188 1.00 0.00 C ATOM 65541 H2R OL 1587 13.471 134.675 30.808 1.00 0.00 H ATOM 65542 H2S OL 1587 14.096 133.399 29.769 1.00 0.00 H ATOM 65543 C13 OL 1587 15.655 134.390 31.026 1.00 0.00 C ATOM 65544 H3R OL 1587 16.504 134.234 30.357 1.00 0.00 H ATOM 65545 H3S OL 1587 15.865 135.376 31.446 1.00 0.00 H ATOM 65546 C14 OL 1587 15.440 133.475 32.139 1.00 0.00 C ATOM 65547 H4R OL 1587 14.532 133.680 32.709 1.00 0.00 H ATOM 65548 H4S OL 1587 15.188 132.445 31.878 1.00 0.00 H ATOM 65549 C15 OL 1587 16.459 133.457 33.219 1.00 0.00 C ATOM 65550 H5R OL 1587 17.454 133.576 32.785 1.00 0.00 H ATOM 65551 H5S OL 1587 16.263 134.348 33.818 1.00 0.00 H ATOM 65552 C16 OL 1587 16.471 132.186 34.056 1.00 0.00 C ATOM 65553 H6R OL 1587 16.205 131.344 33.415 1.00 0.00 H ATOM 65554 H6S OL 1587 17.404 132.010 34.596 1.00 0.00 H ATOM 65555 C17 OL 1587 15.401 132.358 35.138 1.00 0.00 C ATOM 65556 H7R OL 1587 15.574 133.263 35.725 1.00 0.00 H ATOM 65557 H7S OL 1587 14.350 132.379 34.843 1.00 0.00 H ATOM 65558 C18 OL 1587 15.417 131.218 36.098 1.00 0.00 C ATOM 65559 H8R OL 1587 15.418 130.284 35.532 1.00 0.00 H ATOM 65560 H8S OL 1587 16.368 131.114 36.624 1.00 0.00 H ATOM 65561 C19 OL 1587 14.249 131.027 37.004 1.00 0.00 C ATOM 65562 H9R OL 1587 13.465 130.363 36.650 1.00 0.00 H ATOM 65563 C110 OL 1587 14.163 131.363 38.311 1.00 0.00 C ATOM 65564 H10R OL 1587 13.252 131.092 38.839 1.00 0.00 H ATOM 65565 C111 OL 1587 15.161 131.987 39.296 1.00 0.00 C ATOM 65566 H11R OL 1587 15.722 132.774 38.788 1.00 0.00 H ATOM 65567 H11S OL 1587 14.580 132.512 40.059 1.00 0.00 H ATOM 65568 C112 OL 1587 16.190 131.076 39.980 1.00 0.00 C ATOM 65569 H12R OL 1587 15.660 130.358 40.609 1.00 0.00 H ATOM 65570 H12S OL 1587 16.747 130.423 39.304 1.00 0.00 H ATOM 65571 C113 OL 1587 17.205 131.775 40.886 1.00 0.00 C ATOM 65572 H13R OL 1587 17.901 132.372 40.293 1.00 0.00 H ATOM 65573 H13S OL 1587 16.629 132.374 41.594 1.00 0.00 H ATOM 65574 C114 OL 1587 18.014 130.859 41.755 1.00 0.00 C ATOM 65575 H14R OL 1587 18.674 131.484 42.359 1.00 0.00 H ATOM 65576 H14S OL 1587 17.422 130.212 42.406 1.00 0.00 H ATOM 65577 C115 OL 1587 19.038 130.014 40.958 1.00 0.00 C ATOM 65578 H15R OL 1587 18.527 129.474 40.159 1.00 0.00 H ATOM 65579 H15S OL 1587 19.679 130.607 40.303 1.00 0.00 H ATOM 65580 C116 OL 1587 19.943 129.085 41.806 1.00 0.00 C ATOM 65581 H16R OL 1587 20.719 129.744 42.203 1.00 0.00 H ATOM 65582 H16S OL 1587 19.403 128.786 42.707 1.00 0.00 H ATOM 65583 C117 OL 1587 20.394 127.855 40.921 1.00 0.00 C ATOM 65584 H17R OL 1587 20.909 127.102 41.521 1.00 0.00 H ATOM 65585 H17S OL 1587 19.543 127.237 40.628 1.00 0.00 H ATOM 65586 C118 OL 1587 21.110 128.257 39.657 1.00 0.00 C ATOM 65587 H18R OL 1587 20.547 128.612 38.791 1.00 0.00 H ATOM 65588 H18S OL 1587 21.749 127.476 39.241 1.00 0.00 H ATOM 65589 H18T OL 1587 21.800 129.090 39.807 1.00 0.00 H TER 65590 OL 1587 ATOM 65590 C116 PA 1588 108.451 22.870 36.035 1.00 0.00 C ATOM 65591 H16R PA 1588 108.314 22.311 36.963 1.00 0.00 H ATOM 65592 H16S PA 1588 109.093 23.735 36.217 1.00 0.00 H ATOM 65593 H16T PA 1588 109.057 22.214 35.408 1.00 0.00 H ATOM 65594 C115 PA 1588 107.090 23.133 35.418 1.00 0.00 C ATOM 65595 H15R PA 1588 107.048 23.878 34.620 1.00 0.00 H ATOM 65596 H15S PA 1588 106.466 23.527 36.224 1.00 0.00 H ATOM 65597 C114 PA 1588 106.343 21.898 34.895 1.00 0.00 C ATOM 65598 H14R PA 1588 105.333 22.287 34.747 1.00 0.00 H ATOM 65599 H14S PA 1588 106.174 21.177 35.697 1.00 0.00 H ATOM 65600 C113 PA 1588 106.834 21.430 33.511 1.00 0.00 C ATOM 65601 H13R PA 1588 107.877 21.163 33.694 1.00 0.00 H ATOM 65602 H13S PA 1588 106.993 22.286 32.851 1.00 0.00 H ATOM 65603 C112 PA 1588 106.110 20.284 32.962 1.00 0.00 C ATOM 65604 H12R PA 1588 105.066 20.600 33.008 1.00 0.00 H ATOM 65605 H12S PA 1588 106.060 19.402 33.604 1.00 0.00 H ATOM 65606 C111 PA 1588 106.511 19.694 31.581 1.00 0.00 C ATOM 65607 H11R PA 1588 107.378 19.052 31.748 1.00 0.00 H ATOM 65608 H11S PA 1588 106.678 20.436 30.798 1.00 0.00 H ATOM 65609 C110 PA 1588 105.514 18.748 31.060 1.00 0.00 C ATOM 65610 H10R PA 1588 104.544 19.241 31.147 1.00 0.00 H ATOM 65611 H10S PA 1588 105.494 17.842 31.669 1.00 0.00 H ATOM 65612 C19 PA 1588 105.694 18.357 29.608 1.00 0.00 C ATOM 65613 H9R PA 1588 106.744 18.087 29.478 1.00 0.00 H ATOM 65614 H9S PA 1588 105.575 19.147 28.863 1.00 0.00 H ATOM 65615 C18 PA 1588 104.912 17.059 29.194 1.00 0.00 C ATOM 65616 H8R PA 1588 104.863 16.420 30.077 1.00 0.00 H ATOM 65617 H8S PA 1588 105.549 16.478 28.524 1.00 0.00 H ATOM 65618 C17 PA 1588 103.482 17.231 28.531 1.00 0.00 C ATOM 65619 H7R PA 1588 102.673 17.465 29.226 1.00 0.00 H ATOM 65620 H7S PA 1588 103.101 16.296 28.115 1.00 0.00 H ATOM 65621 C16 PA 1588 103.355 18.246 27.371 1.00 0.00 C ATOM 65622 H6R PA 1588 103.365 19.274 27.740 1.00 0.00 H ATOM 65623 H6S PA 1588 102.407 18.065 26.860 1.00 0.00 H ATOM 65624 C15 PA 1588 104.416 18.291 26.256 1.00 0.00 C ATOM 65625 H5R PA 1588 105.292 18.643 26.804 1.00 0.00 H ATOM 65626 H5S PA 1588 104.240 19.085 25.527 1.00 0.00 H ATOM 65627 C14 PA 1588 104.643 17.047 25.461 1.00 0.00 C ATOM 65628 H4R PA 1588 104.283 16.280 26.150 1.00 0.00 H ATOM 65629 H4S PA 1588 105.682 16.817 25.216 1.00 0.00 H ATOM 65630 C13 PA 1588 103.857 17.103 24.203 1.00 0.00 C ATOM 65631 H3R PA 1588 104.337 17.708 23.431 1.00 0.00 H ATOM 65632 H3S PA 1588 102.930 17.643 24.405 1.00 0.00 H ATOM 65633 C12 PA 1588 103.545 15.636 23.683 1.00 0.00 C ATOM 65634 H2R PA 1588 102.925 15.108 24.410 1.00 0.00 H ATOM 65635 H2S PA 1588 104.432 15.011 23.806 1.00 0.00 H ATOM 65636 C11 PGR 1589 102.951 15.490 22.340 1.00 0.00 C ATOM 65637 O12 PGR 1589 103.307 14.692 21.477 1.00 0.00 O ATOM 65638 O11 PGR 1589 102.183 16.602 22.059 1.00 0.00 O ATOM 65639 C1 PGR 1589 101.704 16.915 20.710 1.00 0.00 C ATOM 65640 HR PGR 1589 102.567 16.936 20.040 1.00 0.00 H ATOM 65641 HS PGR 1589 101.180 17.868 20.600 1.00 0.00 H ATOM 65642 C2 PGR 1589 100.619 15.877 20.277 1.00 0.00 C ATOM 65643 HX PGR 1589 101.159 14.928 20.331 1.00 0.00 H ATOM 65644 C3 PGR 1589 100.091 16.138 18.857 1.00 0.00 C ATOM 65645 HA PGR 1589 100.913 16.057 18.141 1.00 0.00 H ATOM 65646 HB PGR 1589 99.768 17.181 18.833 1.00 0.00 H ATOM 65647 O31 PGR 1589 99.163 15.074 18.607 1.00 0.00 O ATOM 65648 P31 PGR 1589 98.078 15.211 17.430 1.00 0.00 P ATOM 65649 O32 PGR 1589 97.069 16.270 18.076 1.00 0.00 O ATOM 65650 C31 PGR 1589 97.283 17.688 18.036 1.00 0.00 C ATOM 65651 H1A PGR 1589 97.660 18.045 17.074 1.00 0.00 H ATOM 65652 H1B PGR 1589 97.863 18.026 18.899 1.00 0.00 H ATOM 65653 C32 PGR 1589 95.932 18.292 18.301 1.00 0.00 C ATOM 65654 H2A PGR 1589 95.531 17.714 19.138 1.00 0.00 H ATOM 65655 O35 PGR 1589 95.109 18.090 17.169 1.00 0.00 O ATOM 65656 HO5A PGR 1589 95.404 17.285 16.706 1.00 0.00 H ATOM 65657 C33 PGR 1589 96.047 19.822 18.666 1.00 0.00 C ATOM 65658 H3A PGR 1589 95.070 20.274 18.858 1.00 0.00 H ATOM 65659 H3B PGR 1589 96.561 20.064 19.599 1.00 0.00 H ATOM 65660 O33 PGR 1589 98.771 15.890 16.342 1.00 0.00 O ATOM 65661 O34 PGR 1589 97.431 13.900 17.352 1.00 0.00 O ATOM 65662 O21 PGR 1589 99.536 15.718 21.253 1.00 0.00 O ATOM 65663 C21 PGR 1589 98.705 16.713 21.422 1.00 0.00 C ATOM 65664 O22 PGR 1589 98.831 17.873 21.219 1.00 0.00 O ATOM 65665 O36 PGR 1589 96.682 20.587 17.618 1.00 0.00 O ATOM 65666 HO6A PGR 1589 96.452 20.188 16.760 1.00 0.00 H ATOM 65667 C12 OL 1590 97.564 16.205 22.227 1.00 0.00 C ATOM 65668 H2R OL 1590 97.944 15.685 23.109 1.00 0.00 H ATOM 65669 H2S OL 1590 97.036 17.050 22.673 1.00 0.00 H ATOM 65670 C13 OL 1590 96.601 15.380 21.381 1.00 0.00 C ATOM 65671 H3R OL 1590 95.895 15.915 20.743 1.00 0.00 H ATOM 65672 H3S OL 1590 97.221 14.704 20.790 1.00 0.00 H ATOM 65673 C14 OL 1590 95.907 14.409 22.274 1.00 0.00 C ATOM 65674 H4R OL 1590 96.546 13.884 22.987 1.00 0.00 H ATOM 65675 H4S OL 1590 95.382 14.918 23.085 1.00 0.00 H ATOM 65676 C15 OL 1590 94.924 13.503 21.596 1.00 0.00 C ATOM 65677 H5R OL 1590 94.113 14.164 21.280 1.00 0.00 H ATOM 65678 H5S OL 1590 95.359 13.153 20.658 1.00 0.00 H ATOM 65679 C16 OL 1590 94.388 12.392 22.462 1.00 0.00 C ATOM 65680 H6R OL 1590 94.048 12.858 23.389 1.00 0.00 H ATOM 65681 H6S OL 1590 93.530 11.886 22.014 1.00 0.00 H ATOM 65682 C17 OL 1590 95.402 11.228 22.552 1.00 0.00 C ATOM 65683 H7R OL 1590 95.681 10.852 21.565 1.00 0.00 H ATOM 65684 H7S OL 1590 96.327 11.732 22.837 1.00 0.00 H ATOM 65685 C18 OL 1590 94.959 10.098 23.488 1.00 0.00 C ATOM 65686 H8R OL 1590 94.508 10.593 24.351 1.00 0.00 H ATOM 65687 H8S OL 1590 94.253 9.393 23.044 1.00 0.00 H ATOM 65688 C19 OL 1590 96.188 9.239 23.828 1.00 0.00 C ATOM 65689 H9R OL 1590 96.615 8.603 23.058 1.00 0.00 H ATOM 65690 C110 OL 1590 96.849 9.334 24.998 1.00 0.00 C ATOM 65691 H10R OL 1590 97.858 8.928 25.010 1.00 0.00 H ATOM 65692 C111 OL 1590 96.697 10.257 26.210 1.00 0.00 C ATOM 65693 H11R OL 1590 95.647 10.517 26.359 1.00 0.00 H ATOM 65694 H11S OL 1590 96.977 9.804 27.164 1.00 0.00 H ATOM 65695 C112 OL 1590 97.624 11.447 26.073 1.00 0.00 C ATOM 65696 H12R OL 1590 98.600 11.054 25.778 1.00 0.00 H ATOM 65697 H12S OL 1590 97.286 12.046 25.225 1.00 0.00 H ATOM 65698 C113 OL 1590 97.658 12.343 27.306 1.00 0.00 C ATOM 65699 H13R OL 1590 96.708 12.782 27.619 1.00 0.00 H ATOM 65700 H13S OL 1590 97.894 11.774 28.207 1.00 0.00 H ATOM 65701 C114 OL 1590 98.757 13.421 27.410 1.00 0.00 C ATOM 65702 H14R OL 1590 98.657 14.043 28.302 1.00 0.00 H ATOM 65703 H14S OL 1590 99.738 12.941 27.404 1.00 0.00 H ATOM 65704 C115 OL 1590 98.782 14.439 26.325 1.00 0.00 C ATOM 65705 H15R OL 1590 98.820 13.916 25.367 1.00 0.00 H ATOM 65706 H15S OL 1590 97.810 14.936 26.302 1.00 0.00 H ATOM 65707 C116 OL 1590 99.926 15.477 26.485 1.00 0.00 C ATOM 65708 H16R OL 1590 99.797 16.042 27.410 1.00 0.00 H ATOM 65709 H16S OL 1590 100.800 14.861 26.708 1.00 0.00 H ATOM 65710 C117 OL 1590 100.032 16.307 25.228 1.00 0.00 C ATOM 65711 H17R OL 1590 101.014 16.784 25.247 1.00 0.00 H ATOM 65712 H17S OL 1590 100.028 15.625 24.375 1.00 0.00 H ATOM 65713 C118 OL 1590 98.939 17.343 25.150 1.00 0.00 C ATOM 65714 H18R OL 1590 98.844 17.752 26.158 1.00 0.00 H ATOM 65715 H18S OL 1590 97.975 16.887 24.912 1.00 0.00 H ATOM 65716 H18T OL 1590 99.129 18.103 24.389 1.00 0.00 H TER 65717 OL 1590 ATOM 65717 C116 PA 1591 -4.028 117.951 38.030 1.00 0.00 C ATOM 65718 H16R PA 1591 -4.720 117.330 38.603 1.00 0.00 H ATOM 65719 H16S PA 1591 -4.557 118.906 37.988 1.00 0.00 H ATOM 65720 H16T PA 1591 -3.119 118.161 38.598 1.00 0.00 H ATOM 65721 C115 PA 1591 -3.614 117.259 36.739 1.00 0.00 C ATOM 65722 H15R PA 1591 -2.786 117.884 36.396 1.00 0.00 H ATOM 65723 H15S PA 1591 -4.487 117.230 36.084 1.00 0.00 H ATOM 65724 C114 PA 1591 -3.276 115.774 36.860 1.00 0.00 C ATOM 65725 H14R PA 1591 -4.098 115.140 37.201 1.00 0.00 H ATOM 65726 H14S PA 1591 -2.527 115.514 37.610 1.00 0.00 H ATOM 65727 C113 PA 1591 -2.725 115.326 35.491 1.00 0.00 C ATOM 65728 H13R PA 1591 -1.770 115.783 35.224 1.00 0.00 H ATOM 65729 H13S PA 1591 -3.439 115.623 34.720 1.00 0.00 H ATOM 65730 C112 PA 1591 -2.454 113.790 35.567 1.00 0.00 C ATOM 65731 H12R PA 1591 -3.279 113.275 36.064 1.00 0.00 H ATOM 65732 H12S PA 1591 -1.548 113.662 36.163 1.00 0.00 H ATOM 65733 C111 PA 1591 -2.342 113.193 34.171 1.00 0.00 C ATOM 65734 H11R PA 1591 -3.321 113.200 33.688 1.00 0.00 H ATOM 65735 H11S PA 1591 -2.197 112.115 34.261 1.00 0.00 H ATOM 65736 C110 PA 1591 -1.236 113.707 33.339 1.00 0.00 C ATOM 65737 H10R PA 1591 -0.343 113.545 33.945 1.00 0.00 H ATOM 65738 H10S PA 1591 -1.496 114.758 33.195 1.00 0.00 H ATOM 65739 C19 PA 1591 -1.071 113.014 31.952 1.00 0.00 C ATOM 65740 H9R PA 1591 -1.982 113.342 31.449 1.00 0.00 H ATOM 65741 H9S PA 1591 -1.222 111.938 32.063 1.00 0.00 H ATOM 65742 C18 PA 1591 0.056 113.540 31.060 1.00 0.00 C ATOM 65743 H8R PA 1591 -0.002 114.628 30.985 1.00 0.00 H ATOM 65744 H8S PA 1591 -0.016 113.112 30.058 1.00 0.00 H ATOM 65745 C17 PA 1591 1.517 113.271 31.673 1.00 0.00 C ATOM 65746 H7R PA 1591 1.738 112.206 31.765 1.00 0.00 H ATOM 65747 H7S PA 1591 1.550 113.533 32.733 1.00 0.00 H ATOM 65748 C16 PA 1591 2.663 113.974 30.880 1.00 0.00 C ATOM 65749 H6R PA 1591 3.586 113.674 31.380 1.00 0.00 H ATOM 65750 H6S PA 1591 2.565 115.050 31.036 1.00 0.00 H ATOM 65751 C15 PA 1591 2.855 113.621 29.467 1.00 0.00 C ATOM 65752 H5R PA 1591 1.994 113.846 28.834 1.00 0.00 H ATOM 65753 H5S PA 1591 2.881 112.531 29.414 1.00 0.00 H ATOM 65754 C14 PA 1591 4.197 114.163 28.901 1.00 0.00 C ATOM 65755 H4R PA 1591 5.104 114.029 29.494 1.00 0.00 H ATOM 65756 H4S PA 1591 4.071 115.234 28.729 1.00 0.00 H ATOM 65757 C13 PA 1591 4.556 113.712 27.430 1.00 0.00 C ATOM 65758 H3R PA 1591 5.250 114.482 27.088 1.00 0.00 H ATOM 65759 H3S PA 1591 3.685 113.829 26.782 1.00 0.00 H ATOM 65760 C12 PA 1591 5.112 112.298 27.325 1.00 0.00 C ATOM 65761 H2R PA 1591 4.454 111.606 27.856 1.00 0.00 H ATOM 65762 H2S PA 1591 6.090 112.291 27.810 1.00 0.00 H ATOM 65763 C11 PGR 1592 5.298 111.880 25.874 1.00 0.00 C ATOM 65764 O12 PGR 1592 4.692 112.400 24.986 1.00 0.00 O ATOM 65765 O11 PGR 1592 6.247 110.967 25.712 1.00 0.00 O ATOM 65766 C1 PGR 1592 6.645 110.449 24.432 1.00 0.00 C ATOM 65767 HR PGR 1592 5.777 110.249 23.798 1.00 0.00 H ATOM 65768 HS PGR 1592 7.197 109.512 24.544 1.00 0.00 H ATOM 65769 C2 PGR 1592 7.467 111.482 23.694 1.00 0.00 C ATOM 65770 HX PGR 1592 6.912 112.419 23.594 1.00 0.00 H ATOM 65771 C3 PGR 1592 7.681 111.070 22.242 1.00 0.00 C ATOM 65772 HA PGR 1592 6.640 111.065 21.910 1.00 0.00 H ATOM 65773 HB PGR 1592 8.131 110.077 22.157 1.00 0.00 H ATOM 65774 O31 PGR 1592 8.475 112.076 21.543 1.00 0.00 O ATOM 65775 P31 PGR 1592 8.626 111.930 20.041 1.00 0.00 P ATOM 65776 O32 PGR 1592 9.873 111.011 19.848 1.00 0.00 O ATOM 65777 C31 PGR 1592 11.093 111.445 20.201 1.00 0.00 C ATOM 65778 H1A PGR 1592 11.123 111.406 21.293 1.00 0.00 H ATOM 65779 H1B PGR 1592 11.272 112.478 19.892 1.00 0.00 H ATOM 65780 C32 PGR 1592 12.193 110.577 19.558 1.00 0.00 C ATOM 65781 H2A PGR 1592 11.914 110.464 18.507 1.00 0.00 H ATOM 65782 O35 PGR 1592 12.210 109.276 20.201 1.00 0.00 O ATOM 65783 HO5A PGR 1592 12.544 108.613 19.570 1.00 0.00 H ATOM 65784 C33 PGR 1592 13.569 111.233 19.644 1.00 0.00 C ATOM 65785 H3A PGR 1592 13.500 112.275 19.322 1.00 0.00 H ATOM 65786 H3B PGR 1592 13.881 111.236 20.691 1.00 0.00 H ATOM 65787 O33 PGR 1592 7.450 111.137 19.599 1.00 0.00 O ATOM 65788 O34 PGR 1592 8.979 113.249 19.510 1.00 0.00 O ATOM 65789 O21 PGR 1592 8.690 111.763 24.366 1.00 0.00 O ATOM 65790 C21 PGR 1592 8.676 112.745 25.261 1.00 0.00 C ATOM 65791 O22 PGR 1592 7.806 113.532 25.534 1.00 0.00 O ATOM 65792 O36 PGR 1592 14.576 110.504 18.984 1.00 0.00 O ATOM 65793 HO6A PGR 1592 15.394 110.823 19.404 1.00 0.00 H ATOM 65794 C12 OL 1593 9.994 113.026 25.891 1.00 0.00 C ATOM 65795 H2R OL 1593 10.706 113.609 25.303 1.00 0.00 H ATOM 65796 H2S OL 1593 9.876 113.778 26.674 1.00 0.00 H ATOM 65797 C13 OL 1593 10.621 111.796 26.526 1.00 0.00 C ATOM 65798 H3R OL 1593 11.046 111.192 25.721 1.00 0.00 H ATOM 65799 H3S OL 1593 11.519 112.005 27.111 1.00 0.00 H ATOM 65800 C14 OL 1593 9.812 110.947 27.474 1.00 0.00 C ATOM 65801 H4R OL 1593 8.879 110.641 26.997 1.00 0.00 H ATOM 65802 H4S OL 1593 10.343 109.993 27.454 1.00 0.00 H ATOM 65803 C15 OL 1593 9.580 111.363 28.867 1.00 0.00 C ATOM 65804 H5R OL 1593 10.548 111.411 29.371 1.00 0.00 H ATOM 65805 H5S OL 1593 9.083 112.335 28.875 1.00 0.00 H ATOM 65806 C16 OL 1593 8.737 110.219 29.469 1.00 0.00 C ATOM 65807 H6R OL 1593 7.950 109.881 28.792 1.00 0.00 H ATOM 65808 H6S OL 1593 9.351 109.346 29.699 1.00 0.00 H ATOM 65809 C17 OL 1593 8.199 110.691 30.817 1.00 0.00 C ATOM 65810 H7R OL 1593 7.684 111.651 30.745 1.00 0.00 H ATOM 65811 H7S OL 1593 7.457 109.915 31.016 1.00 0.00 H ATOM 65812 C18 OL 1593 9.173 110.648 31.990 1.00 0.00 C ATOM 65813 H8R OL 1593 9.628 109.656 32.018 1.00 0.00 H ATOM 65814 H8S OL 1593 9.899 111.459 32.078 1.00 0.00 H ATOM 65815 C19 OL 1593 8.353 110.771 33.229 1.00 0.00 C ATOM 65816 H9R OL 1593 7.779 109.884 33.487 1.00 0.00 H ATOM 65817 C110 OL 1593 8.410 111.676 34.203 1.00 0.00 C ATOM 65818 H10R OL 1593 7.721 111.548 35.034 1.00 0.00 H ATOM 65819 C111 OL 1593 9.279 112.851 34.273 1.00 0.00 C ATOM 65820 H11R OL 1593 9.895 112.882 33.372 1.00 0.00 H ATOM 65821 H11S OL 1593 8.766 113.815 34.270 1.00 0.00 H ATOM 65822 C112 OL 1593 10.119 112.689 35.573 1.00 0.00 C ATOM 65823 H12R OL 1593 10.140 111.620 35.792 1.00 0.00 H ATOM 65824 H12S OL 1593 11.127 113.045 35.348 1.00 0.00 H ATOM 65825 C113 OL 1593 9.541 113.383 36.744 1.00 0.00 C ATOM 65826 H13R OL 1593 9.169 114.383 36.512 1.00 0.00 H ATOM 65827 H13S OL 1593 8.614 112.898 37.059 1.00 0.00 H ATOM 65828 C114 OL 1593 10.602 113.573 37.776 1.00 0.00 C ATOM 65829 H14R OL 1593 10.906 112.635 38.247 1.00 0.00 H ATOM 65830 H14S OL 1593 11.530 113.835 37.262 1.00 0.00 H ATOM 65831 C115 OL 1593 10.383 114.647 38.774 1.00 0.00 C ATOM 65832 H15R OL 1593 11.321 115.145 39.030 1.00 0.00 H ATOM 65833 H15S OL 1593 9.874 115.492 38.306 1.00 0.00 H ATOM 65834 C116 OL 1593 9.835 114.122 40.041 1.00 0.00 C ATOM 65835 H16R OL 1593 9.742 114.996 40.689 1.00 0.00 H ATOM 65836 H16S OL 1593 8.819 113.747 39.897 1.00 0.00 H ATOM 65837 C117 OL 1593 10.566 112.981 40.751 1.00 0.00 C ATOM 65838 H17R OL 1593 10.588 112.083 40.131 1.00 0.00 H ATOM 65839 H17S OL 1593 11.620 113.266 40.781 1.00 0.00 H ATOM 65840 C118 OL 1593 10.119 112.730 42.120 1.00 0.00 C ATOM 65841 H18R OL 1593 9.136 112.256 42.121 1.00 0.00 H ATOM 65842 H18S OL 1593 10.054 113.513 42.879 1.00 0.00 H ATOM 65843 H18T OL 1593 10.778 111.965 42.538 1.00 0.00 H TER 65844 OL 1593 ATOM 65844 C116 PA 1594 115.748 60.407 38.860 1.00 0.00 C ATOM 65845 H16R PA 1594 116.768 60.747 39.053 1.00 0.00 H ATOM 65846 H16S PA 1594 115.237 61.132 39.496 1.00 0.00 H ATOM 65847 H16T PA 1594 115.643 60.679 37.807 1.00 0.00 H ATOM 65848 C115 PA 1594 115.386 58.922 39.079 1.00 0.00 C ATOM 65849 H15R PA 1594 114.346 58.917 38.747 1.00 0.00 H ATOM 65850 H15S PA 1594 115.290 58.622 40.125 1.00 0.00 H ATOM 65851 C114 PA 1594 116.096 57.946 38.142 1.00 0.00 C ATOM 65852 H14R PA 1594 116.492 58.538 37.314 1.00 0.00 H ATOM 65853 H14S PA 1594 115.409 57.190 37.756 1.00 0.00 H ATOM 65854 C113 PA 1594 117.271 57.284 38.842 1.00 0.00 C ATOM 65855 H13R PA 1594 116.916 56.720 39.707 1.00 0.00 H ATOM 65856 H13S PA 1594 117.897 58.101 39.205 1.00 0.00 H ATOM 65857 C112 PA 1594 118.061 56.359 37.996 1.00 0.00 C ATOM 65858 H12R PA 1594 118.754 55.732 38.561 1.00 0.00 H ATOM 65859 H12S PA 1594 118.728 57.023 37.443 1.00 0.00 H ATOM 65860 C111 PA 1594 117.362 55.416 36.944 1.00 0.00 C ATOM 65861 H11R PA 1594 116.558 55.849 36.345 1.00 0.00 H ATOM 65862 H11S PA 1594 116.926 54.539 37.427 1.00 0.00 H ATOM 65863 C110 PA 1594 118.376 54.899 35.902 1.00 0.00 C ATOM 65864 H10R PA 1594 119.193 54.404 36.430 1.00 0.00 H ATOM 65865 H10S PA 1594 118.763 55.764 35.361 1.00 0.00 H ATOM 65866 C19 PA 1594 117.854 53.801 34.965 1.00 0.00 C ATOM 65867 H9R PA 1594 116.890 54.152 34.589 1.00 0.00 H ATOM 65868 H9S PA 1594 117.601 52.918 35.556 1.00 0.00 H ATOM 65869 C18 PA 1594 118.735 53.508 33.788 1.00 0.00 C ATOM 65870 H8R PA 1594 119.608 52.942 34.119 1.00 0.00 H ATOM 65871 H8S PA 1594 119.063 54.431 33.306 1.00 0.00 H ATOM 65872 C17 PA 1594 118.015 52.706 32.695 1.00 0.00 C ATOM 65873 H7R PA 1594 117.014 53.122 32.567 1.00 0.00 H ATOM 65874 H7S PA 1594 117.855 51.685 33.048 1.00 0.00 H ATOM 65875 C16 PA 1594 118.715 52.831 31.349 1.00 0.00 C ATOM 65876 H6R PA 1594 119.787 52.632 31.421 1.00 0.00 H ATOM 65877 H6S PA 1594 118.696 53.915 31.224 1.00 0.00 H ATOM 65878 C15 PA 1594 117.949 52.191 30.195 1.00 0.00 C ATOM 65879 H5R PA 1594 116.886 52.192 30.446 1.00 0.00 H ATOM 65880 H5S PA 1594 118.209 51.131 30.191 1.00 0.00 H ATOM 65881 C14 PA 1594 118.315 52.839 28.857 1.00 0.00 C ATOM 65882 H4R PA 1594 119.333 52.592 28.549 1.00 0.00 H ATOM 65883 H4S PA 1594 118.465 53.900 29.067 1.00 0.00 H ATOM 65884 C13 PA 1594 117.256 52.577 27.801 1.00 0.00 C ATOM 65885 H3R PA 1594 116.248 52.918 28.045 1.00 0.00 H ATOM 65886 H3S PA 1594 117.216 51.488 27.732 1.00 0.00 H ATOM 65887 C12 PA 1594 117.479 52.955 26.296 1.00 0.00 C ATOM 65888 H2R PA 1594 118.354 52.373 26.002 1.00 0.00 H ATOM 65889 H2S PA 1594 117.696 53.932 25.858 1.00 0.00 H ATOM 65890 C11 PGR 1595 116.328 52.234 25.561 1.00 0.00 C ATOM 65891 O12 PGR 1595 116.483 51.113 25.114 1.00 0.00 O ATOM 65892 O11 PGR 1595 115.152 52.908 25.485 1.00 0.00 O ATOM 65893 C1 PGR 1595 113.966 52.228 24.953 1.00 0.00 C ATOM 65894 HR PGR 1595 114.202 51.762 23.993 1.00 0.00 H ATOM 65895 HS PGR 1595 113.134 52.932 24.868 1.00 0.00 H ATOM 65896 C2 PGR 1595 113.508 51.152 25.905 1.00 0.00 C ATOM 65897 HX PGR 1595 114.390 50.683 26.349 1.00 0.00 H ATOM 65898 C3 PGR 1595 112.759 50.023 25.165 1.00 0.00 C ATOM 65899 HA PGR 1595 112.446 49.286 25.908 1.00 0.00 H ATOM 65900 HB PGR 1595 113.475 49.408 24.614 1.00 0.00 H ATOM 65901 O31 PGR 1595 111.626 50.510 24.366 1.00 0.00 O ATOM 65902 P31 PGR 1595 110.832 49.644 23.304 1.00 0.00 P ATOM 65903 O32 PGR 1595 109.661 49.094 24.107 1.00 0.00 O ATOM 65904 C31 PGR 1595 108.797 49.900 24.954 1.00 0.00 C ATOM 65905 H1A PGR 1595 109.280 50.252 25.870 1.00 0.00 H ATOM 65906 H1B PGR 1595 108.067 49.175 25.323 1.00 0.00 H ATOM 65907 C32 PGR 1595 107.973 51.065 24.208 1.00 0.00 C ATOM 65908 H2A PGR 1595 107.341 50.617 23.437 1.00 0.00 H ATOM 65909 O35 PGR 1595 108.718 52.070 23.531 1.00 0.00 O ATOM 65910 HO5A PGR 1595 109.405 51.557 23.070 1.00 0.00 H ATOM 65911 C33 PGR 1595 107.030 51.826 25.190 1.00 0.00 C ATOM 65912 H3A PGR 1595 106.268 51.091 25.463 1.00 0.00 H ATOM 65913 H3B PGR 1595 107.723 52.114 25.984 1.00 0.00 H ATOM 65914 O33 PGR 1595 110.293 50.539 22.225 1.00 0.00 O ATOM 65915 O34 PGR 1595 111.659 48.507 22.872 1.00 0.00 O ATOM 65916 O21 PGR 1595 112.864 51.825 26.987 1.00 0.00 O ATOM 65917 C21 PGR 1595 112.587 51.114 28.112 1.00 0.00 C ATOM 65918 O22 PGR 1595 113.041 49.958 28.279 1.00 0.00 O ATOM 65919 O36 PGR 1595 106.224 52.891 24.612 1.00 0.00 O ATOM 65920 HO6A PGR 1595 105.643 53.228 25.317 1.00 0.00 H ATOM 65921 C12 OL 1596 111.917 51.957 29.151 1.00 0.00 C ATOM 65922 H2R OL 1596 110.865 52.041 28.871 1.00 0.00 H ATOM 65923 H2S OL 1596 111.922 51.224 29.959 1.00 0.00 H ATOM 65924 C13 OL 1596 112.507 53.328 29.359 1.00 0.00 C ATOM 65925 H3R OL 1596 112.528 53.952 28.463 1.00 0.00 H ATOM 65926 H3S OL 1596 111.686 53.742 29.948 1.00 0.00 H ATOM 65927 C14 OL 1596 113.922 53.488 29.966 1.00 0.00 C ATOM 65928 H4R OL 1596 114.623 52.755 29.561 1.00 0.00 H ATOM 65929 H4S OL 1596 114.366 54.440 29.670 1.00 0.00 H ATOM 65930 C15 OL 1596 113.979 53.432 31.443 1.00 0.00 C ATOM 65931 H5R OL 1596 113.917 52.451 31.919 1.00 0.00 H ATOM 65932 H5S OL 1596 114.954 53.709 31.848 1.00 0.00 H ATOM 65933 C16 OL 1596 112.884 54.364 32.140 1.00 0.00 C ATOM 65934 H6R OL 1596 112.662 55.236 31.521 1.00 0.00 H ATOM 65935 H6S OL 1596 111.919 53.854 32.091 1.00 0.00 H ATOM 65936 C17 OL 1596 113.203 54.862 33.489 1.00 0.00 C ATOM 65937 H7R OL 1596 114.096 55.479 33.372 1.00 0.00 H ATOM 65938 H7S OL 1596 112.377 55.514 33.781 1.00 0.00 H ATOM 65939 C18 OL 1596 113.239 53.809 34.593 1.00 0.00 C ATOM 65940 H8R OL 1596 112.408 53.102 34.562 1.00 0.00 H ATOM 65941 H8S OL 1596 114.073 53.118 34.447 1.00 0.00 H ATOM 65942 C19 OL 1596 113.292 54.437 35.935 1.00 0.00 C ATOM 65943 H9R OL 1596 114.269 54.382 36.408 1.00 0.00 H ATOM 65944 C110 OL 1596 112.274 54.830 36.650 1.00 0.00 C ATOM 65945 H10R OL 1596 112.390 55.215 37.659 1.00 0.00 H ATOM 65946 C111 OL 1596 110.906 54.938 36.145 1.00 0.00 C ATOM 65947 H11R OL 1596 110.539 55.962 36.239 1.00 0.00 H ATOM 65948 H11S OL 1596 110.866 54.560 35.121 1.00 0.00 H ATOM 65949 C112 OL 1596 109.988 54.089 37.022 1.00 0.00 C ATOM 65950 H12R OL 1596 110.216 53.021 37.001 1.00 0.00 H ATOM 65951 H12S OL 1596 110.289 54.221 38.064 1.00 0.00 H ATOM 65952 C113 OL 1596 108.561 54.167 36.570 1.00 0.00 C ATOM 65953 H13R OL 1596 108.272 55.219 36.515 1.00 0.00 H ATOM 65954 H13S OL 1596 108.504 53.749 35.562 1.00 0.00 H ATOM 65955 C114 OL 1596 107.549 53.432 37.384 1.00 0.00 C ATOM 65956 H14R OL 1596 107.891 52.404 37.523 1.00 0.00 H ATOM 65957 H14S OL 1596 107.728 53.917 38.346 1.00 0.00 H ATOM 65958 C115 OL 1596 106.068 53.445 36.905 1.00 0.00 C ATOM 65959 H15R OL 1596 105.869 54.515 36.818 1.00 0.00 H ATOM 65960 H15S OL 1596 105.980 53.014 35.906 1.00 0.00 H ATOM 65961 C116 OL 1596 105.150 52.703 37.904 1.00 0.00 C ATOM 65962 H16R OL 1596 105.571 51.695 37.918 1.00 0.00 H ATOM 65963 H16S OL 1596 105.422 53.167 38.854 1.00 0.00 H ATOM 65964 C117 OL 1596 103.688 52.696 37.577 1.00 0.00 C ATOM 65965 H17R OL 1596 103.175 52.354 38.479 1.00 0.00 H ATOM 65966 H17S OL 1596 103.496 53.756 37.400 1.00 0.00 H ATOM 65967 C118 OL 1596 103.186 51.782 36.436 1.00 0.00 C ATOM 65968 H18R OL 1596 103.225 52.306 35.479 1.00 0.00 H ATOM 65969 H18S OL 1596 102.131 51.642 36.680 1.00 0.00 H ATOM 65970 H18T OL 1596 103.619 50.788 36.306 1.00 0.00 H TER 65971 OL 1596 ATOM 65971 C116 PA 1597 75.584 27.763 38.487 1.00 0.00 C ATOM 65972 H16R PA 1597 75.755 27.259 39.441 1.00 0.00 H ATOM 65973 H16S PA 1597 74.559 27.976 38.177 1.00 0.00 H ATOM 65974 H16T PA 1597 76.056 28.737 38.637 1.00 0.00 H ATOM 65975 C115 PA 1597 76.362 26.887 37.529 1.00 0.00 C ATOM 65976 H15R PA 1597 76.451 27.320 36.531 1.00 0.00 H ATOM 65977 H15S PA 1597 75.907 25.921 37.303 1.00 0.00 H ATOM 65978 C114 PA 1597 77.789 26.706 37.957 1.00 0.00 C ATOM 65979 H14R PA 1597 77.925 26.426 39.004 1.00 0.00 H ATOM 65980 H14S PA 1597 78.302 27.664 37.847 1.00 0.00 H ATOM 65981 C113 PA 1597 78.571 25.625 37.083 1.00 0.00 C ATOM 65982 H13R PA 1597 78.257 24.599 37.284 1.00 0.00 H ATOM 65983 H13S PA 1597 79.642 25.641 37.296 1.00 0.00 H ATOM 65984 C112 PA 1597 78.365 25.818 35.547 1.00 0.00 C ATOM 65985 H12R PA 1597 78.681 26.832 35.292 1.00 0.00 H ATOM 65986 H12S PA 1597 77.292 25.781 35.346 1.00 0.00 H ATOM 65987 C111 PA 1597 79.177 24.902 34.541 1.00 0.00 C ATOM 65988 H11R PA 1597 78.932 23.842 34.634 1.00 0.00 H ATOM 65989 H11S PA 1597 80.228 24.873 34.837 1.00 0.00 H ATOM 65990 C110 PA 1597 79.111 25.190 33.011 1.00 0.00 C ATOM 65991 H10R PA 1597 78.486 24.403 32.582 1.00 0.00 H ATOM 65992 H10S PA 1597 80.128 24.988 32.666 1.00 0.00 H ATOM 65993 C19 PA 1597 78.507 26.482 32.453 1.00 0.00 C ATOM 65994 H9R PA 1597 78.967 27.289 33.028 1.00 0.00 H ATOM 65995 H9S PA 1597 77.425 26.626 32.479 1.00 0.00 H ATOM 65996 C18 PA 1597 78.966 26.691 31.043 1.00 0.00 C ATOM 65997 H8R PA 1597 78.631 25.877 30.396 1.00 0.00 H ATOM 65998 H8S PA 1597 80.042 26.538 30.936 1.00 0.00 H ATOM 65999 C17 PA 1597 78.542 28.033 30.605 1.00 0.00 C ATOM 66000 H7R PA 1597 78.585 28.803 31.379 1.00 0.00 H ATOM 66001 H7S PA 1597 77.532 28.099 30.196 1.00 0.00 H ATOM 66002 C16 PA 1597 79.461 28.578 29.517 1.00 0.00 C ATOM 66003 H6R PA 1597 80.447 28.703 29.971 1.00 0.00 H ATOM 66004 H6S PA 1597 78.974 29.492 29.171 1.00 0.00 H ATOM 66005 C15 PA 1597 79.635 27.642 28.283 1.00 0.00 C ATOM 66006 H5R PA 1597 78.678 27.372 27.833 1.00 0.00 H ATOM 66007 H5S PA 1597 79.997 26.617 28.388 1.00 0.00 H ATOM 66008 C14 PA 1597 80.187 28.438 27.131 1.00 0.00 C ATOM 66009 H4R PA 1597 81.095 28.974 27.415 1.00 0.00 H ATOM 66010 H4S PA 1597 79.516 29.255 26.856 1.00 0.00 H ATOM 66011 C13 PA 1597 80.626 27.522 25.949 1.00 0.00 C ATOM 66012 H3R PA 1597 81.528 27.025 26.312 1.00 0.00 H ATOM 66013 H3S PA 1597 80.962 28.078 25.071 1.00 0.00 H ATOM 66014 C12 PA 1597 79.730 26.430 25.334 1.00 0.00 C ATOM 66015 H2R PA 1597 79.513 25.617 26.031 1.00 0.00 H ATOM 66016 H2S PA 1597 80.180 25.882 24.504 1.00 0.00 H ATOM 66017 C11 PGR 1598 78.423 26.925 24.857 1.00 0.00 C ATOM 66018 O12 PGR 1598 78.259 27.749 23.971 1.00 0.00 O ATOM 66019 O11 PGR 1598 77.363 26.244 25.388 1.00 0.00 O ATOM 66020 C1 PGR 1598 76.118 26.331 24.756 1.00 0.00 C ATOM 66021 HR PGR 1598 75.794 27.355 24.557 1.00 0.00 H ATOM 66022 HS PGR 1598 75.399 25.970 25.495 1.00 0.00 H ATOM 66023 C2 PGR 1598 75.925 25.427 23.514 1.00 0.00 C ATOM 66024 HX PGR 1598 76.682 25.578 22.740 1.00 0.00 H ATOM 66025 C3 PGR 1598 74.572 25.675 22.805 1.00 0.00 C ATOM 66026 HA PGR 1598 74.552 26.749 22.602 1.00 0.00 H ATOM 66027 HB PGR 1598 73.786 25.377 23.503 1.00 0.00 H ATOM 66028 O31 PGR 1598 74.553 24.995 21.587 1.00 0.00 O ATOM 66029 P31 PGR 1598 74.923 25.703 20.199 1.00 0.00 P ATOM 66030 O32 PGR 1598 73.609 26.342 19.615 1.00 0.00 O ATOM 66031 C31 PGR 1598 73.017 27.457 20.351 1.00 0.00 C ATOM 66032 H1A PGR 1598 73.753 28.263 20.404 1.00 0.00 H ATOM 66033 H1B PGR 1598 72.757 27.148 21.367 1.00 0.00 H ATOM 66034 C32 PGR 1598 71.825 27.927 19.600 1.00 0.00 C ATOM 66035 H2A PGR 1598 71.284 27.132 19.079 1.00 0.00 H ATOM 66036 O35 PGR 1598 72.378 28.873 18.601 1.00 0.00 O ATOM 66037 HO5A PGR 1598 72.634 28.234 17.911 1.00 0.00 H ATOM 66038 C33 PGR 1598 70.783 28.699 20.396 1.00 0.00 C ATOM 66039 H3A PGR 1598 70.293 28.085 21.156 1.00 0.00 H ATOM 66040 H3B PGR 1598 71.296 29.467 20.980 1.00 0.00 H ATOM 66041 O33 PGR 1598 75.950 26.698 20.501 1.00 0.00 O ATOM 66042 O34 PGR 1598 75.190 24.569 19.287 1.00 0.00 O ATOM 66043 O21 PGR 1598 75.837 24.089 24.029 1.00 0.00 O ATOM 66044 C21 PGR 1598 77.023 23.429 24.105 1.00 0.00 C ATOM 66045 O22 PGR 1598 78.104 23.819 23.739 1.00 0.00 O ATOM 66046 O36 PGR 1598 69.760 29.221 19.582 1.00 0.00 O ATOM 66047 HO6A PGR 1598 70.269 29.765 18.954 1.00 0.00 H ATOM 66048 C12 OL 1599 76.921 22.087 24.807 1.00 0.00 C ATOM 66049 H2R OL 1599 77.477 22.152 25.745 1.00 0.00 H ATOM 66050 H2S OL 1599 75.931 21.820 25.183 1.00 0.00 H ATOM 66051 C13 OL 1599 77.371 20.991 23.896 1.00 0.00 C ATOM 66052 H3R OL 1599 76.768 21.002 22.986 1.00 0.00 H ATOM 66053 H3S OL 1599 78.390 21.248 23.600 1.00 0.00 H ATOM 66054 C14 OL 1599 77.567 19.616 24.523 1.00 0.00 C ATOM 66055 H4R OL 1599 77.909 18.834 23.841 1.00 0.00 H ATOM 66056 H4S OL 1599 78.345 19.721 25.282 1.00 0.00 H ATOM 66057 C15 OL 1599 76.296 19.006 25.164 1.00 0.00 C ATOM 66058 H5R OL 1599 75.854 19.750 25.829 1.00 0.00 H ATOM 66059 H5S OL 1599 75.517 18.841 24.417 1.00 0.00 H ATOM 66060 C16 OL 1599 76.530 17.702 26.040 1.00 0.00 C ATOM 66061 H6R OL 1599 76.928 16.886 25.432 1.00 0.00 H ATOM 66062 H6S OL 1599 77.217 18.026 26.825 1.00 0.00 H ATOM 66063 C17 OL 1599 75.262 17.199 26.744 1.00 0.00 C ATOM 66064 H7R OL 1599 74.757 18.062 27.181 1.00 0.00 H ATOM 66065 H7S OL 1599 74.652 16.770 25.946 1.00 0.00 H ATOM 66066 C18 OL 1599 75.539 16.236 27.863 1.00 0.00 C ATOM 66067 H8R OL 1599 75.935 16.645 28.794 1.00 0.00 H ATOM 66068 H8S OL 1599 74.671 15.738 28.300 1.00 0.00 H ATOM 66069 C19 OL 1599 76.315 15.153 27.257 1.00 0.00 C ATOM 66070 H9R OL 1599 75.949 14.775 26.306 1.00 0.00 H ATOM 66071 C110 OL 1599 77.411 14.582 27.805 1.00 0.00 C ATOM 66072 H10R OL 1599 77.754 13.734 27.217 1.00 0.00 H ATOM 66073 C111 OL 1599 78.213 14.920 28.987 1.00 0.00 C ATOM 66074 H11R OL 1599 78.401 15.994 29.053 1.00 0.00 H ATOM 66075 H11S OL 1599 77.609 14.775 29.885 1.00 0.00 H ATOM 66076 C112 OL 1599 79.529 14.172 29.085 1.00 0.00 C ATOM 66077 H12R OL 1599 79.354 13.104 28.937 1.00 0.00 H ATOM 66078 H12S OL 1599 80.176 14.354 28.225 1.00 0.00 H ATOM 66079 C113 OL 1599 80.333 14.550 30.351 1.00 0.00 C ATOM 66080 H13R OL 1599 81.237 13.962 30.519 1.00 0.00 H ATOM 66081 H13S OL 1599 80.676 15.577 30.205 1.00 0.00 H ATOM 66082 C114 OL 1599 79.450 14.398 31.641 1.00 0.00 C ATOM 66083 H14R OL 1599 78.678 15.169 31.699 1.00 0.00 H ATOM 66084 H14S OL 1599 78.980 13.422 31.505 1.00 0.00 H ATOM 66085 C115 OL 1599 80.308 14.510 32.804 1.00 0.00 C ATOM 66086 H15R OL 1599 81.177 13.850 32.776 1.00 0.00 H ATOM 66087 H15S OL 1599 80.793 15.484 32.702 1.00 0.00 H ATOM 66088 C116 OL 1599 79.525 14.344 34.127 1.00 0.00 C ATOM 66089 H16R OL 1599 78.658 15.003 34.050 1.00 0.00 H ATOM 66090 H16S OL 1599 79.143 13.323 34.074 1.00 0.00 H ATOM 66091 C117 OL 1599 80.291 14.416 35.465 1.00 0.00 C ATOM 66092 H17R OL 1599 80.610 15.447 35.631 1.00 0.00 H ATOM 66093 H17S OL 1599 79.570 14.171 36.248 1.00 0.00 H ATOM 66094 C118 OL 1599 81.439 13.448 35.535 1.00 0.00 C ATOM 66095 H18R OL 1599 81.082 12.634 36.168 1.00 0.00 H ATOM 66096 H18S OL 1599 82.251 13.854 36.142 1.00 0.00 H ATOM 66097 H18T OL 1599 81.778 12.881 34.666 1.00 0.00 H TER 66098 OL 1599 ATOM 66098 C116 PA 1600 95.626 105.998 41.593 1.00 0.00 C ATOM 66099 H16R PA 1600 95.212 106.630 42.382 1.00 0.00 H ATOM 66100 H16S PA 1600 96.466 106.625 41.290 1.00 0.00 H ATOM 66101 H16T PA 1600 95.979 105.118 42.135 1.00 0.00 H ATOM 66102 C115 PA 1600 94.557 105.687 40.623 1.00 0.00 C ATOM 66103 H15R PA 1600 93.978 106.601 40.475 1.00 0.00 H ATOM 66104 H15S PA 1600 93.783 105.045 41.048 1.00 0.00 H ATOM 66105 C114 PA 1600 95.012 104.983 39.354 1.00 0.00 C ATOM 66106 H14R PA 1600 95.392 103.967 39.476 1.00 0.00 H ATOM 66107 H14S PA 1600 95.842 105.570 38.956 1.00 0.00 H ATOM 66108 C113 PA 1600 93.976 104.993 38.145 1.00 0.00 C ATOM 66109 H13R PA 1600 93.204 104.265 38.402 1.00 0.00 H ATOM 66110 H13S PA 1600 94.529 104.623 37.278 1.00 0.00 H ATOM 66111 C112 PA 1600 93.305 106.286 37.786 1.00 0.00 C ATOM 66112 H12R PA 1600 94.074 107.061 37.753 1.00 0.00 H ATOM 66113 H12S PA 1600 92.817 106.620 38.705 1.00 0.00 H ATOM 66114 C111 PA 1600 92.400 106.275 36.464 1.00 0.00 C ATOM 66115 H11R PA 1600 91.603 105.533 36.544 1.00 0.00 H ATOM 66116 H11S PA 1600 93.093 105.996 35.668 1.00 0.00 H ATOM 66117 C110 PA 1600 91.680 107.593 36.165 1.00 0.00 C ATOM 66118 H10R PA 1600 91.336 107.464 35.136 1.00 0.00 H ATOM 66119 H10S PA 1600 92.432 108.369 36.008 1.00 0.00 H ATOM 66120 C19 PA 1600 90.618 107.843 37.278 1.00 0.00 C ATOM 66121 H9R PA 1600 91.178 107.986 38.205 1.00 0.00 H ATOM 66122 H9S PA 1600 89.948 107.000 37.461 1.00 0.00 H ATOM 66123 C18 PA 1600 89.734 109.106 37.183 1.00 0.00 C ATOM 66124 H8R PA 1600 90.410 109.961 37.254 1.00 0.00 H ATOM 66125 H8S PA 1600 89.020 109.167 38.007 1.00 0.00 H ATOM 66126 C17 PA 1600 89.077 109.276 35.744 1.00 0.00 C ATOM 66127 H7R PA 1600 89.838 109.349 34.964 1.00 0.00 H ATOM 66128 H7S PA 1600 88.552 110.234 35.737 1.00 0.00 H ATOM 66129 C16 PA 1600 88.083 108.212 35.504 1.00 0.00 C ATOM 66130 H6R PA 1600 87.434 108.126 36.377 1.00 0.00 H ATOM 66131 H6S PA 1600 88.585 107.254 35.350 1.00 0.00 H ATOM 66132 C15 PA 1600 87.220 108.504 34.409 1.00 0.00 C ATOM 66133 H5R PA 1600 87.956 108.630 33.612 1.00 0.00 H ATOM 66134 H5S PA 1600 86.804 109.510 34.492 1.00 0.00 H ATOM 66135 C14 PA 1600 86.158 107.432 33.982 1.00 0.00 C ATOM 66136 H4R PA 1600 86.608 106.445 34.111 1.00 0.00 H ATOM 66137 H4S PA 1600 86.084 107.703 32.927 1.00 0.00 H ATOM 66138 C13 PA 1600 84.824 107.429 34.635 1.00 0.00 C ATOM 66139 H3R PA 1600 84.414 108.439 34.703 1.00 0.00 H ATOM 66140 H3S PA 1600 84.980 107.168 35.684 1.00 0.00 H ATOM 66141 C12 PA 1600 83.893 106.411 34.039 1.00 0.00 C ATOM 66142 H2R PA 1600 82.885 106.515 34.445 1.00 0.00 H ATOM 66143 H2S PA 1600 84.133 105.425 34.443 1.00 0.00 H ATOM 66144 C11 PGR 1601 83.815 106.440 32.504 1.00 0.00 C ATOM 66145 O12 PGR 1601 83.375 107.435 31.952 1.00 0.00 O ATOM 66146 O11 PGR 1601 84.368 105.442 31.789 1.00 0.00 O ATOM 66147 C1 PGR 1601 84.507 105.686 30.318 1.00 0.00 C ATOM 66148 HR PGR 1601 83.550 105.922 29.845 1.00 0.00 H ATOM 66149 HS PGR 1601 84.675 104.734 29.808 1.00 0.00 H ATOM 66150 C2 PGR 1601 85.770 106.633 30.220 1.00 0.00 C ATOM 66151 HX PGR 1601 85.598 107.659 30.556 1.00 0.00 H ATOM 66152 C3 PGR 1601 86.140 106.696 28.689 1.00 0.00 C ATOM 66153 HA PGR 1601 86.944 107.426 28.562 1.00 0.00 H ATOM 66154 HB PGR 1601 85.286 107.101 28.140 1.00 0.00 H ATOM 66155 O31 PGR 1601 86.342 105.419 28.244 1.00 0.00 O ATOM 66156 P31 PGR 1601 86.867 105.169 26.749 1.00 0.00 P ATOM 66157 O32 PGR 1601 85.770 105.617 25.716 1.00 0.00 O ATOM 66158 C31 PGR 1601 85.800 106.894 25.065 1.00 0.00 C ATOM 66159 H1A PGR 1601 86.471 106.777 24.210 1.00 0.00 H ATOM 66160 H1B PGR 1601 86.327 107.639 25.667 1.00 0.00 H ATOM 66161 C32 PGR 1601 84.419 107.370 24.519 1.00 0.00 C ATOM 66162 H2A PGR 1601 84.683 107.966 23.642 1.00 0.00 H ATOM 66163 O35 PGR 1601 83.646 108.099 25.436 1.00 0.00 O ATOM 66164 HO5A PGR 1601 83.125 107.534 26.034 1.00 0.00 H ATOM 66165 C33 PGR 1601 83.701 106.233 23.940 1.00 0.00 C ATOM 66166 H3A PGR 1601 84.317 105.563 23.335 1.00 0.00 H ATOM 66167 H3B PGR 1601 83.274 105.688 24.786 1.00 0.00 H ATOM 66168 O33 PGR 1601 88.078 105.915 26.485 1.00 0.00 O ATOM 66169 O34 PGR 1601 86.895 103.689 26.396 1.00 0.00 O ATOM 66170 O21 PGR 1601 86.853 106.057 30.925 1.00 0.00 O ATOM 66171 C21 PGR 1601 87.951 106.745 31.261 1.00 0.00 C ATOM 66172 O22 PGR 1601 88.113 107.937 31.133 1.00 0.00 O ATOM 66173 O36 PGR 1601 82.732 106.919 23.134 1.00 0.00 O ATOM 66174 HO6A PGR 1601 83.118 107.130 22.265 1.00 0.00 H ATOM 66175 C12 OL 1602 89.035 105.756 31.764 1.00 0.00 C ATOM 66176 H2R OL 1602 88.654 105.288 32.674 1.00 0.00 H ATOM 66177 H2S OL 1602 89.239 105.098 30.917 1.00 0.00 H ATOM 66178 C13 OL 1602 90.363 106.513 32.241 1.00 0.00 C ATOM 66179 H3R OL 1602 90.714 107.260 31.526 1.00 0.00 H ATOM 66180 H3S OL 1602 90.194 107.178 33.090 1.00 0.00 H ATOM 66181 C14 OL 1602 91.452 105.550 32.435 1.00 0.00 C ATOM 66182 H4R OL 1602 91.165 104.890 33.257 1.00 0.00 H ATOM 66183 H4S OL 1602 91.517 104.965 31.515 1.00 0.00 H ATOM 66184 C15 OL 1602 92.779 106.281 32.684 1.00 0.00 C ATOM 66185 H5R OL 1602 92.940 106.899 31.798 1.00 0.00 H ATOM 66186 H5S OL 1602 92.705 106.999 33.504 1.00 0.00 H ATOM 66187 C16 OL 1602 93.952 105.362 32.820 1.00 0.00 C ATOM 66188 H6R OL 1602 93.786 104.717 33.685 1.00 0.00 H ATOM 66189 H6S OL 1602 94.166 104.826 31.893 1.00 0.00 H ATOM 66190 C17 OL 1602 95.223 106.204 33.193 1.00 0.00 C ATOM 66191 H7R OL 1602 95.302 106.963 32.412 1.00 0.00 H ATOM 66192 H7S OL 1602 95.088 106.706 34.154 1.00 0.00 H ATOM 66193 C18 OL 1602 96.550 105.362 33.273 1.00 0.00 C ATOM 66194 H8R OL 1602 96.720 104.880 32.308 1.00 0.00 H ATOM 66195 H8S OL 1602 97.439 105.969 33.454 1.00 0.00 H ATOM 66196 C19 OL 1602 96.532 104.374 34.335 1.00 0.00 C ATOM 66197 H9R OL 1602 96.067 103.479 33.931 1.00 0.00 H ATOM 66198 C110 OL 1602 97.003 104.325 35.591 1.00 0.00 C ATOM 66199 H10R OL 1602 96.950 103.412 36.178 1.00 0.00 H ATOM 66200 C111 OL 1602 97.633 105.500 36.303 1.00 0.00 C ATOM 66201 H11R OL 1602 97.767 106.395 35.693 1.00 0.00 H ATOM 66202 H11S OL 1602 97.016 105.877 37.122 1.00 0.00 H ATOM 66203 C112 OL 1602 98.974 105.207 36.958 1.00 0.00 C ATOM 66204 H12R OL 1602 98.906 104.137 37.167 1.00 0.00 H ATOM 66205 H12S OL 1602 99.748 105.181 36.188 1.00 0.00 H ATOM 66206 C113 OL 1602 99.399 106.091 38.114 1.00 0.00 C ATOM 66207 H13R OL 1602 98.553 106.076 38.804 1.00 0.00 H ATOM 66208 H13S OL 1602 100.297 105.692 38.592 1.00 0.00 H ATOM 66209 C114 OL 1602 99.768 107.517 37.711 1.00 0.00 C ATOM 66210 H14R OL 1602 98.974 107.828 37.028 1.00 0.00 H ATOM 66211 H14S OL 1602 99.745 108.131 38.614 1.00 0.00 H ATOM 66212 C115 OL 1602 101.074 107.740 37.121 1.00 0.00 C ATOM 66213 H15R OL 1602 101.216 108.785 36.839 1.00 0.00 H ATOM 66214 H15S OL 1602 101.849 107.601 37.877 1.00 0.00 H ATOM 66215 C116 OL 1602 101.469 106.937 35.894 1.00 0.00 C ATOM 66216 H16R OL 1602 101.656 105.893 36.155 1.00 0.00 H ATOM 66217 H16S OL 1602 100.636 106.930 35.188 1.00 0.00 H ATOM 66218 C117 OL 1602 102.711 107.404 35.119 1.00 0.00 C ATOM 66219 H17R OL 1602 102.669 106.790 34.217 1.00 0.00 H ATOM 66220 H17S OL 1602 102.612 108.434 34.769 1.00 0.00 H ATOM 66221 C118 OL 1602 104.074 107.296 35.820 1.00 0.00 C ATOM 66222 H18R OL 1602 104.917 107.641 35.217 1.00 0.00 H ATOM 66223 H18S OL 1602 104.173 106.251 36.122 1.00 0.00 H ATOM 66224 H18T OL 1602 104.137 107.879 36.741 1.00 0.00 H TER 66225 OL 1602 ATOM 66225 C116 PA 1603 87.988 139.876 40.175 1.00 0.00 C ATOM 66226 H16R PA 1603 88.000 140.445 41.107 1.00 0.00 H ATOM 66227 H16S PA 1603 88.933 139.341 40.294 1.00 0.00 H ATOM 66228 H16T PA 1603 87.252 139.070 40.214 1.00 0.00 H ATOM 66229 C115 PA 1603 87.934 140.718 38.883 1.00 0.00 C ATOM 66230 H15R PA 1603 88.786 141.400 38.843 1.00 0.00 H ATOM 66231 H15S PA 1603 86.967 141.224 38.896 1.00 0.00 H ATOM 66232 C114 PA 1603 88.069 139.851 37.678 1.00 0.00 C ATOM 66233 H14R PA 1603 87.401 138.993 37.778 1.00 0.00 H ATOM 66234 H14S PA 1603 89.071 139.485 37.444 1.00 0.00 H ATOM 66235 C113 PA 1603 87.727 140.577 36.393 1.00 0.00 C ATOM 66236 H13R PA 1603 88.379 141.442 36.252 1.00 0.00 H ATOM 66237 H13S PA 1603 86.758 141.047 36.569 1.00 0.00 H ATOM 66238 C112 PA 1603 87.658 139.787 35.020 1.00 0.00 C ATOM 66239 H12R PA 1603 86.742 139.192 35.032 1.00 0.00 H ATOM 66240 H12S PA 1603 88.475 139.127 34.720 1.00 0.00 H ATOM 66241 C111 PA 1603 87.289 140.743 33.860 1.00 0.00 C ATOM 66242 H11R PA 1603 88.002 141.542 33.645 1.00 0.00 H ATOM 66243 H11S PA 1603 86.434 141.369 34.123 1.00 0.00 H ATOM 66244 C110 PA 1603 87.051 139.904 32.539 1.00 0.00 C ATOM 66245 H10R PA 1603 86.443 139.102 32.962 1.00 0.00 H ATOM 66246 H10S PA 1603 87.917 139.480 32.027 1.00 0.00 H ATOM 66247 C19 PA 1603 86.101 140.601 31.573 1.00 0.00 C ATOM 66248 H9R PA 1603 85.183 140.614 32.164 1.00 0.00 H ATOM 66249 H9S PA 1603 85.915 139.932 30.731 1.00 0.00 H ATOM 66250 C18 PA 1603 86.402 142.040 31.160 1.00 0.00 C ATOM 66251 H8R PA 1603 86.469 142.784 31.957 1.00 0.00 H ATOM 66252 H8S PA 1603 85.498 142.418 30.678 1.00 0.00 H ATOM 66253 C17 PA 1603 87.520 142.171 30.127 1.00 0.00 C ATOM 66254 H7R PA 1603 87.306 141.686 29.172 1.00 0.00 H ATOM 66255 H7S PA 1603 88.394 141.592 30.432 1.00 0.00 H ATOM 66256 C16 PA 1603 87.928 143.590 29.684 1.00 0.00 C ATOM 66257 H6R PA 1603 88.215 144.077 30.618 1.00 0.00 H ATOM 66258 H6S PA 1603 87.010 144.094 29.377 1.00 0.00 H ATOM 66259 C15 PA 1603 89.077 143.686 28.645 1.00 0.00 C ATOM 66260 H5R PA 1603 89.820 142.953 28.965 1.00 0.00 H ATOM 66261 H5S PA 1603 89.610 144.639 28.612 1.00 0.00 H ATOM 66262 C14 PA 1603 88.660 143.424 27.248 1.00 0.00 C ATOM 66263 H4R PA 1603 88.142 144.285 26.820 1.00 0.00 H ATOM 66264 H4S PA 1603 87.870 142.671 27.266 1.00 0.00 H ATOM 66265 C13 PA 1603 89.798 143.132 26.243 1.00 0.00 C ATOM 66266 H3R PA 1603 90.408 142.335 26.673 1.00 0.00 H ATOM 66267 H3S PA 1603 90.438 144.012 26.148 1.00 0.00 H ATOM 66268 C12 PA 1603 89.315 142.862 24.756 1.00 0.00 C ATOM 66269 H2R PA 1603 88.795 143.770 24.442 1.00 0.00 H ATOM 66270 H2S PA 1603 88.688 141.970 24.703 1.00 0.00 H ATOM 66271 C11 PGR 1604 90.471 142.505 23.868 1.00 0.00 C ATOM 66272 O12 PGR 1604 90.347 142.098 22.728 1.00 0.00 O ATOM 66273 O11 PGR 1604 91.749 142.594 24.490 1.00 0.00 O ATOM 66274 C1 PGR 1604 93.008 142.383 23.667 1.00 0.00 C ATOM 66275 HR PGR 1604 92.702 141.559 23.018 1.00 0.00 H ATOM 66276 HS PGR 1604 93.889 142.341 24.313 1.00 0.00 H ATOM 66277 C2 PGR 1604 93.386 143.604 22.767 1.00 0.00 C ATOM 66278 HX PGR 1604 92.524 144.069 22.283 1.00 0.00 H ATOM 66279 C3 PGR 1604 94.285 143.186 21.707 1.00 0.00 C ATOM 66280 HA PGR 1604 93.751 142.585 20.966 1.00 0.00 H ATOM 66281 HB PGR 1604 95.154 142.620 22.054 1.00 0.00 H ATOM 66282 O31 PGR 1604 94.800 144.354 21.071 1.00 0.00 O ATOM 66283 P31 PGR 1604 95.657 144.292 19.700 1.00 0.00 P ATOM 66284 O32 PGR 1604 94.582 144.253 18.487 1.00 0.00 O ATOM 66285 C31 PGR 1604 94.004 143.046 18.120 1.00 0.00 C ATOM 66286 H1A PGR 1604 93.077 142.854 18.667 1.00 0.00 H ATOM 66287 H1B PGR 1604 94.609 142.168 18.361 1.00 0.00 H ATOM 66288 C32 PGR 1604 93.780 143.146 16.623 1.00 0.00 C ATOM 66289 H2A PGR 1604 94.746 143.372 16.164 1.00 0.00 H ATOM 66290 O35 PGR 1604 92.892 144.194 16.262 1.00 0.00 O ATOM 66291 HO5A PGR 1604 93.352 144.986 16.592 1.00 0.00 H ATOM 66292 C33 PGR 1604 93.315 141.830 16.052 1.00 0.00 C ATOM 66293 H3A PGR 1604 93.325 141.894 14.961 1.00 0.00 H ATOM 66294 H3B PGR 1604 94.049 141.038 16.220 1.00 0.00 H ATOM 66295 O33 PGR 1604 96.399 145.608 19.597 1.00 0.00 O ATOM 66296 O34 PGR 1604 96.400 142.981 19.693 1.00 0.00 O ATOM 66297 O21 PGR 1604 94.037 144.591 23.580 1.00 0.00 O ATOM 66298 C21 PGR 1604 93.300 145.418 24.287 1.00 0.00 C ATOM 66299 O22 PGR 1604 92.115 145.626 24.049 1.00 0.00 O ATOM 66300 O36 PGR 1604 92.014 141.392 16.428 1.00 0.00 O ATOM 66301 HO6A PGR 1604 92.169 140.868 17.235 1.00 0.00 H ATOM 66302 C12 OL 1605 94.109 146.423 25.107 1.00 0.00 C ATOM 66303 H2R OL 1605 94.548 146.993 24.286 1.00 0.00 H ATOM 66304 H2S OL 1605 93.397 147.031 25.669 1.00 0.00 H ATOM 66305 C13 OL 1605 95.112 145.714 25.950 1.00 0.00 C ATOM 66306 H3R OL 1605 94.607 144.946 26.540 1.00 0.00 H ATOM 66307 H3S OL 1605 95.820 145.194 25.300 1.00 0.00 H ATOM 66308 C14 OL 1605 95.846 146.594 26.876 1.00 0.00 C ATOM 66309 H4R OL 1605 95.159 147.084 27.569 1.00 0.00 H ATOM 66310 H4S OL 1605 96.590 145.951 27.350 1.00 0.00 H ATOM 66311 C15 OL 1605 96.550 147.697 26.153 1.00 0.00 C ATOM 66312 H5R OL 1605 97.123 147.345 25.292 1.00 0.00 H ATOM 66313 H5S OL 1605 95.851 148.394 25.686 1.00 0.00 H ATOM 66314 C16 OL 1605 97.410 148.465 26.963 1.00 0.00 C ATOM 66315 H6R OL 1605 97.997 147.677 27.440 1.00 0.00 H ATOM 66316 H6S OL 1605 98.170 149.018 26.407 1.00 0.00 H ATOM 66317 C17 OL 1605 96.901 149.295 28.147 1.00 0.00 C ATOM 66318 H7R OL 1605 95.983 149.814 27.865 1.00 0.00 H ATOM 66319 H7S OL 1605 96.635 148.462 28.801 1.00 0.00 H ATOM 66320 C18 OL 1605 97.955 150.203 28.835 1.00 0.00 C ATOM 66321 H8R OL 1605 98.911 149.677 28.869 1.00 0.00 H ATOM 66322 H8S OL 1605 98.162 151.101 28.248 1.00 0.00 H ATOM 66323 C19 OL 1605 97.385 150.664 30.169 1.00 0.00 C ATOM 66324 H9R OL 1605 96.411 151.128 30.040 1.00 0.00 H ATOM 66325 C110 OL 1605 98.108 150.643 31.270 1.00 0.00 C ATOM 66326 H10R OL 1605 97.709 151.220 32.100 1.00 0.00 H ATOM 66327 C111 OL 1605 99.341 149.950 31.618 1.00 0.00 C ATOM 66328 H11R OL 1605 99.770 149.351 30.812 1.00 0.00 H ATOM 66329 H11S OL 1605 100.136 150.644 31.899 1.00 0.00 H ATOM 66330 C112 OL 1605 99.357 149.037 32.841 1.00 0.00 C ATOM 66331 H12R OL 1605 100.381 148.881 33.186 1.00 0.00 H ATOM 66332 H12S OL 1605 98.761 149.480 33.642 1.00 0.00 H ATOM 66333 C113 OL 1605 98.779 147.685 32.654 1.00 0.00 C ATOM 66334 H13R OL 1605 97.816 147.771 32.146 1.00 0.00 H ATOM 66335 H13S OL 1605 99.252 147.065 31.889 1.00 0.00 H ATOM 66336 C114 OL 1605 98.618 146.830 33.895 1.00 0.00 C ATOM 66337 H14R OL 1605 99.589 146.540 34.303 1.00 0.00 H ATOM 66338 H14S OL 1605 98.248 147.400 34.750 1.00 0.00 H ATOM 66339 C115 OL 1605 97.760 145.489 33.697 1.00 0.00 C ATOM 66340 H15R OL 1605 96.730 145.673 33.383 1.00 0.00 H ATOM 66341 H15S OL 1605 98.093 144.753 32.963 1.00 0.00 H ATOM 66342 C116 OL 1605 97.629 144.650 34.962 1.00 0.00 C ATOM 66343 H16R OL 1605 98.536 144.269 35.435 1.00 0.00 H ATOM 66344 H16S OL 1605 97.234 145.315 35.733 1.00 0.00 H ATOM 66345 C117 OL 1605 96.657 143.412 34.875 1.00 0.00 C ATOM 66346 H17R OL 1605 95.691 143.920 34.893 1.00 0.00 H ATOM 66347 H17S OL 1605 96.899 142.964 33.909 1.00 0.00 H ATOM 66348 C118 OL 1605 96.849 142.264 35.967 1.00 0.00 C ATOM 66349 H18R OL 1605 97.751 141.679 35.776 1.00 0.00 H ATOM 66350 H18S OL 1605 96.186 141.397 35.928 1.00 0.00 H ATOM 66351 H18T OL 1605 96.914 142.582 37.009 1.00 0.00 H TER 66352 OL 1605 ATOM 66352 C116 PA 1606 30.162 55.168 40.701 1.00 0.00 C ATOM 66353 H16R PA 1606 29.495 54.853 41.506 1.00 0.00 H ATOM 66354 H16S PA 1606 30.289 56.251 40.749 1.00 0.00 H ATOM 66355 H16T PA 1606 31.128 54.688 40.876 1.00 0.00 H ATOM 66356 C115 PA 1606 29.598 54.742 39.315 1.00 0.00 C ATOM 66357 H15R PA 1606 28.886 53.952 39.562 1.00 0.00 H ATOM 66358 H15S PA 1606 30.487 54.461 38.747 1.00 0.00 H ATOM 66359 C114 PA 1606 28.722 55.914 38.777 1.00 0.00 C ATOM 66360 H14R PA 1606 29.263 56.848 38.610 1.00 0.00 H ATOM 66361 H14S PA 1606 28.008 56.223 39.543 1.00 0.00 H ATOM 66362 C113 PA 1606 27.894 55.574 37.527 1.00 0.00 C ATOM 66363 H13R PA 1606 27.448 56.489 37.131 1.00 0.00 H ATOM 66364 H13S PA 1606 27.161 54.869 37.925 1.00 0.00 H ATOM 66365 C112 PA 1606 28.691 54.828 36.484 1.00 0.00 C ATOM 66366 H12R PA 1606 28.970 53.806 36.751 1.00 0.00 H ATOM 66367 H12S PA 1606 29.578 55.465 36.453 1.00 0.00 H ATOM 66368 C111 PA 1606 28.063 54.755 35.065 1.00 0.00 C ATOM 66369 H11R PA 1606 28.952 54.324 34.598 1.00 0.00 H ATOM 66370 H11S PA 1606 27.746 55.728 34.686 1.00 0.00 H ATOM 66371 C110 PA 1606 26.731 53.849 34.878 1.00 0.00 C ATOM 66372 H10R PA 1606 25.790 54.278 35.228 1.00 0.00 H ATOM 66373 H10S PA 1606 26.944 53.002 35.535 1.00 0.00 H ATOM 66374 C19 PA 1606 26.605 53.165 33.509 1.00 0.00 C ATOM 66375 H9R PA 1606 26.082 52.215 33.634 1.00 0.00 H ATOM 66376 H9S PA 1606 27.532 53.058 32.941 1.00 0.00 H ATOM 66377 C18 PA 1606 25.817 54.002 32.499 1.00 0.00 C ATOM 66378 H8R PA 1606 25.887 53.598 31.487 1.00 0.00 H ATOM 66379 H8S PA 1606 26.111 55.027 32.263 1.00 0.00 H ATOM 66380 C17 PA 1606 24.318 54.047 32.605 1.00 0.00 C ATOM 66381 H7R PA 1606 23.929 54.138 33.621 1.00 0.00 H ATOM 66382 H7S PA 1606 23.929 53.070 32.311 1.00 0.00 H ATOM 66383 C16 PA 1606 23.667 55.116 31.709 1.00 0.00 C ATOM 66384 H6R PA 1606 24.137 54.934 30.740 1.00 0.00 H ATOM 66385 H6S PA 1606 24.016 56.135 31.889 1.00 0.00 H ATOM 66386 C15 PA 1606 22.155 55.128 31.577 1.00 0.00 C ATOM 66387 H5R PA 1606 21.773 55.513 32.525 1.00 0.00 H ATOM 66388 H5S PA 1606 21.829 54.106 31.377 1.00 0.00 H ATOM 66389 C14 PA 1606 21.653 56.067 30.464 1.00 0.00 C ATOM 66390 H4R PA 1606 21.863 57.099 30.751 1.00 0.00 H ATOM 66391 H4S PA 1606 20.563 56.016 30.498 1.00 0.00 H ATOM 66392 C13 PA 1606 22.147 55.657 29.002 1.00 0.00 C ATOM 66393 H3R PA 1606 21.802 54.621 28.989 1.00 0.00 H ATOM 66394 H3S PA 1606 23.238 55.678 29.041 1.00 0.00 H ATOM 66395 C12 PA 1606 21.455 56.531 27.956 1.00 0.00 C ATOM 66396 H2R PA 1606 21.910 57.523 27.952 1.00 0.00 H ATOM 66397 H2S PA 1606 20.365 56.602 27.979 1.00 0.00 H ATOM 66398 C11 PGR 1607 21.706 55.939 26.606 1.00 0.00 C ATOM 66399 O12 PGR 1607 22.363 56.431 25.695 1.00 0.00 O ATOM 66400 O11 PGR 1607 21.264 54.701 26.462 1.00 0.00 O ATOM 66401 C1 PGR 1607 21.236 53.966 25.238 1.00 0.00 C ATOM 66402 HR PGR 1607 20.829 54.658 24.496 1.00 0.00 H ATOM 66403 HS PGR 1607 20.478 53.179 25.200 1.00 0.00 H ATOM 66404 C2 PGR 1607 22.675 53.586 24.847 1.00 0.00 C ATOM 66405 HX PGR 1607 23.344 54.408 25.115 1.00 0.00 H ATOM 66406 C3 PGR 1607 22.893 53.215 23.380 1.00 0.00 C ATOM 66407 HA PGR 1607 23.953 52.948 23.345 1.00 0.00 H ATOM 66408 HB PGR 1607 22.665 54.034 22.694 1.00 0.00 H ATOM 66409 O31 PGR 1607 22.133 52.095 23.019 1.00 0.00 O ATOM 66410 P31 PGR 1607 22.194 51.330 21.603 1.00 0.00 P ATOM 66411 O32 PGR 1607 23.707 50.834 21.484 1.00 0.00 O ATOM 66412 C31 PGR 1607 24.609 51.266 20.521 1.00 0.00 C ATOM 66413 H1A PGR 1607 24.691 52.349 20.640 1.00 0.00 H ATOM 66414 H1B PGR 1607 24.325 50.873 19.541 1.00 0.00 H ATOM 66415 C32 PGR 1607 26.058 50.685 20.785 1.00 0.00 C ATOM 66416 H2A PGR 1607 26.082 49.658 20.412 1.00 0.00 H ATOM 66417 O35 PGR 1607 26.496 50.622 22.159 1.00 0.00 O ATOM 66418 HO5A PGR 1607 27.439 50.379 22.183 1.00 0.00 H ATOM 66419 C33 PGR 1607 27.101 51.370 19.934 1.00 0.00 C ATOM 66420 H3A PGR 1607 26.866 51.106 18.899 1.00 0.00 H ATOM 66421 H3B PGR 1607 27.197 52.443 20.120 1.00 0.00 H ATOM 66422 O33 PGR 1607 21.291 50.125 21.661 1.00 0.00 O ATOM 66423 O34 PGR 1607 21.998 52.421 20.564 1.00 0.00 O ATOM 66424 O21 PGR 1607 23.038 52.365 25.504 1.00 0.00 O ATOM 66425 C21 PGR 1607 23.642 52.268 26.702 1.00 0.00 C ATOM 66426 O22 PGR 1607 24.022 53.253 27.314 1.00 0.00 O ATOM 66427 O36 PGR 1607 28.495 50.989 20.342 1.00 0.00 O ATOM 66428 HO6A PGR 1607 28.490 50.036 20.543 1.00 0.00 H ATOM 66429 C12 OL 1608 23.491 50.954 27.350 1.00 0.00 C ATOM 66430 H2R OL 1608 22.407 50.817 27.372 1.00 0.00 H ATOM 66431 H2S OL 1608 23.865 50.173 26.684 1.00 0.00 H ATOM 66432 C13 OL 1608 24.114 50.854 28.741 1.00 0.00 C ATOM 66433 H3R OL 1608 25.159 51.143 28.610 1.00 0.00 H ATOM 66434 H3S OL 1608 23.781 51.684 29.366 1.00 0.00 H ATOM 66435 C14 OL 1608 23.955 49.435 29.257 1.00 0.00 C ATOM 66436 H4R OL 1608 24.496 48.823 28.533 1.00 0.00 H ATOM 66437 H4S OL 1608 24.429 49.317 30.234 1.00 0.00 H ATOM 66438 C15 OL 1608 22.490 48.971 29.395 1.00 0.00 C ATOM 66439 H5R OL 1608 21.873 49.602 30.039 1.00 0.00 H ATOM 66440 H5S OL 1608 21.858 48.849 28.513 1.00 0.00 H ATOM 66441 C16 OL 1608 22.409 47.643 30.203 1.00 0.00 C ATOM 66442 H6R OL 1608 22.939 46.868 29.645 1.00 0.00 H ATOM 66443 H6S OL 1608 22.960 47.830 31.127 1.00 0.00 H ATOM 66444 C17 OL 1608 20.970 47.171 30.365 1.00 0.00 C ATOM 66445 H7R OL 1608 20.403 47.806 31.048 1.00 0.00 H ATOM 66446 H7S OL 1608 20.344 47.436 29.510 1.00 0.00 H ATOM 66447 C18 OL 1608 20.931 45.703 30.876 1.00 0.00 C ATOM 66448 H8R OL 1608 21.273 45.511 31.895 1.00 0.00 H ATOM 66449 H8S OL 1608 21.505 45.001 30.267 1.00 0.00 H ATOM 66450 C19 OL 1608 19.426 45.316 30.873 1.00 0.00 C ATOM 66451 H9R OL 1608 18.806 46.130 31.239 1.00 0.00 H ATOM 66452 C110 OL 1608 18.889 44.080 30.520 1.00 0.00 C ATOM 66453 H10R OL 1608 17.852 43.824 30.721 1.00 0.00 H ATOM 66454 C111 OL 1608 19.777 42.986 29.991 1.00 0.00 C ATOM 66455 H11R OL 1608 19.115 42.440 29.315 1.00 0.00 H ATOM 66456 H11S OL 1608 20.467 43.403 29.255 1.00 0.00 H ATOM 66457 C112 OL 1608 20.338 42.046 31.021 1.00 0.00 C ATOM 66458 H12R OL 1608 20.983 42.686 31.626 1.00 0.00 H ATOM 66459 H12S OL 1608 19.580 41.764 31.755 1.00 0.00 H ATOM 66460 C113 OL 1608 21.103 40.841 30.519 1.00 0.00 C ATOM 66461 H13R OL 1608 21.034 39.996 31.208 1.00 0.00 H ATOM 66462 H13S OL 1608 20.733 40.388 29.596 1.00 0.00 H ATOM 66463 C114 OL 1608 22.531 41.177 30.268 1.00 0.00 C ATOM 66464 H14R OL 1608 22.522 42.067 29.636 1.00 0.00 H ATOM 66465 H14S OL 1608 23.044 41.476 31.184 1.00 0.00 H ATOM 66466 C115 OL 1608 23.200 40.053 29.444 1.00 0.00 C ATOM 66467 H15R OL 1608 23.158 39.054 29.884 1.00 0.00 H ATOM 66468 H15S OL 1608 22.793 39.920 28.440 1.00 0.00 H ATOM 66469 C116 OL 1608 24.660 40.399 29.120 1.00 0.00 C ATOM 66470 H16R OL 1608 25.004 39.661 28.392 1.00 0.00 H ATOM 66471 H16S OL 1608 24.672 41.395 28.671 1.00 0.00 H ATOM 66472 C117 OL 1608 25.677 40.475 30.267 1.00 0.00 C ATOM 66473 H17R OL 1608 26.651 40.780 29.879 1.00 0.00 H ATOM 66474 H17S OL 1608 25.188 41.221 30.898 1.00 0.00 H ATOM 66475 C118 OL 1608 25.765 39.215 30.985 1.00 0.00 C ATOM 66476 H18R OL 1608 24.802 38.959 31.432 1.00 0.00 H ATOM 66477 H18S OL 1608 26.569 39.320 31.718 1.00 0.00 H ATOM 66478 H18T OL 1608 26.115 38.441 30.298 1.00 0.00 H TER 66479 OL 1608 ATOM 66479 C116 PA 1609 133.831 11.517 40.503 1.00 0.00 C ATOM 66480 H16R PA 1609 133.255 10.681 40.100 1.00 0.00 H ATOM 66481 H16S PA 1609 134.113 11.263 41.527 1.00 0.00 H ATOM 66482 H16T PA 1609 134.788 11.439 39.984 1.00 0.00 H ATOM 66483 C115 PA 1609 133.186 12.955 40.269 1.00 0.00 C ATOM 66484 H15R PA 1609 133.809 13.696 40.773 1.00 0.00 H ATOM 66485 H15S PA 1609 132.174 13.037 40.670 1.00 0.00 H ATOM 66486 C114 PA 1609 133.249 13.345 38.835 1.00 0.00 C ATOM 66487 H14R PA 1609 132.871 12.547 38.193 1.00 0.00 H ATOM 66488 H14S PA 1609 134.277 13.458 38.482 1.00 0.00 H ATOM 66489 C113 PA 1609 132.506 14.607 38.460 1.00 0.00 C ATOM 66490 H13R PA 1609 132.683 15.416 39.172 1.00 0.00 H ATOM 66491 H13S PA 1609 131.419 14.517 38.511 1.00 0.00 H ATOM 66492 C112 PA 1609 133.085 15.206 37.159 1.00 0.00 C ATOM 66493 H12R PA 1609 134.165 15.361 37.209 1.00 0.00 H ATOM 66494 H12S PA 1609 132.764 16.240 37.018 1.00 0.00 H ATOM 66495 C111 PA 1609 132.818 14.374 35.862 1.00 0.00 C ATOM 66496 H11R PA 1609 131.776 14.600 35.625 1.00 0.00 H ATOM 66497 H11S PA 1609 132.884 13.334 36.190 1.00 0.00 H ATOM 66498 C110 PA 1609 133.722 14.676 34.587 1.00 0.00 C ATOM 66499 H10R PA 1609 133.412 15.676 34.275 1.00 0.00 H ATOM 66500 H10S PA 1609 133.380 13.997 33.803 1.00 0.00 H ATOM 66501 C19 PA 1609 135.301 14.556 34.857 1.00 0.00 C ATOM 66502 H9R PA 1609 135.604 13.507 34.842 1.00 0.00 H ATOM 66503 H9S PA 1609 135.560 14.795 35.891 1.00 0.00 H ATOM 66504 C18 PA 1609 136.131 15.356 33.843 1.00 0.00 C ATOM 66505 H8R PA 1609 137.198 15.252 34.047 1.00 0.00 H ATOM 66506 H8S PA 1609 135.918 16.391 34.118 1.00 0.00 H ATOM 66507 C17 PA 1609 135.891 15.021 32.308 1.00 0.00 C ATOM 66508 H7R PA 1609 134.808 15.149 32.252 1.00 0.00 H ATOM 66509 H7S PA 1609 136.223 13.995 32.139 1.00 0.00 H ATOM 66510 C16 PA 1609 136.614 16.002 31.341 1.00 0.00 C ATOM 66511 H6R PA 1609 137.676 15.945 31.587 1.00 0.00 H ATOM 66512 H6S PA 1609 136.215 16.989 31.587 1.00 0.00 H ATOM 66513 C15 PA 1609 136.363 15.631 29.953 1.00 0.00 C ATOM 66514 H5R PA 1609 135.286 15.513 29.820 1.00 0.00 H ATOM 66515 H5S PA 1609 136.743 14.618 29.801 1.00 0.00 H ATOM 66516 C14 PA 1609 137.027 16.486 28.905 1.00 0.00 C ATOM 66517 H4R PA 1609 138.074 16.175 28.937 1.00 0.00 H ATOM 66518 H4S PA 1609 137.003 17.507 29.290 1.00 0.00 H ATOM 66519 C13 PA 1609 136.596 16.233 27.401 1.00 0.00 C ATOM 66520 H3R PA 1609 135.506 16.291 27.416 1.00 0.00 H ATOM 66521 H3S PA 1609 136.970 15.257 27.082 1.00 0.00 H ATOM 66522 C12 PA 1609 137.132 17.367 26.561 1.00 0.00 C ATOM 66523 H2R PA 1609 137.929 17.994 26.965 1.00 0.00 H ATOM 66524 H2S PA 1609 136.292 18.062 26.489 1.00 0.00 H ATOM 66525 C11 PC 1610 137.437 17.075 25.161 1.00 0.00 C ATOM 66526 O12 PC 1610 137.166 16.039 24.588 1.00 0.00 O ATOM 66527 O11 PC 1610 137.996 18.115 24.506 1.00 0.00 O ATOM 66528 C1 PC 1610 138.383 17.933 23.132 1.00 0.00 C ATOM 66529 HR PC 1610 137.596 17.962 22.374 1.00 0.00 H ATOM 66530 HS PC 1610 138.907 16.989 22.960 1.00 0.00 H ATOM 66531 C2 PC 1610 139.206 19.134 22.765 1.00 0.00 C ATOM 66532 HX PC 1610 138.643 20.001 23.118 1.00 0.00 H ATOM 66533 C3 PC 1610 139.344 19.172 21.234 1.00 0.00 C ATOM 66534 HA PC 1610 140.086 19.962 21.089 1.00 0.00 H ATOM 66535 HB PC 1610 138.378 19.523 20.861 1.00 0.00 H ATOM 66536 O31 PC 1610 139.687 17.969 20.632 1.00 0.00 O ATOM 66537 P31 PC 1610 139.866 17.829 19.114 1.00 0.00 P ATOM 66538 O32 PC 1610 141.381 18.238 18.896 1.00 0.00 O ATOM 66539 C31 PC 1610 142.165 17.446 18.115 1.00 0.00 C ATOM 66540 H1A PC 1610 141.610 17.234 17.198 1.00 0.00 H ATOM 66541 H1B PC 1610 142.329 16.510 18.655 1.00 0.00 H ATOM 66542 C32 PC 1610 143.482 18.188 17.794 1.00 0.00 C ATOM 66543 H2A PC 1610 144.173 17.485 17.327 1.00 0.00 H ATOM 66544 H2B PC 1610 143.839 18.556 18.757 1.00 0.00 H ATOM 66545 N31 PC 1610 143.450 19.465 16.988 1.00 0.00 N ATOM 66546 C33 PC 1610 144.852 20.067 16.981 1.00 0.00 C ATOM 66547 H3A PC 1610 145.432 19.204 16.650 1.00 0.00 H ATOM 66548 H3B PC 1610 145.157 20.345 17.991 1.00 0.00 H ATOM 66549 H3C PC 1610 144.978 20.910 16.300 1.00 0.00 H ATOM 66550 C34 PC 1610 142.968 19.310 15.581 1.00 0.00 C ATOM 66551 H4A PC 1610 141.996 18.815 15.573 1.00 0.00 H ATOM 66552 H4B PC 1610 143.623 18.629 15.036 1.00 0.00 H ATOM 66553 H4C PC 1610 143.019 20.246 15.022 1.00 0.00 H ATOM 66554 C35 PC 1610 142.686 20.524 17.543 1.00 0.00 C ATOM 66555 H5A PC 1610 143.043 20.687 18.561 1.00 0.00 H ATOM 66556 H5B PC 1610 141.621 20.290 17.503 1.00 0.00 H ATOM 66557 H5C PC 1610 142.768 21.420 16.925 1.00 0.00 H ATOM 66558 O33 PC 1610 139.589 16.400 18.845 1.00 0.00 O ATOM 66559 O34 PC 1610 139.015 18.787 18.406 1.00 0.00 O ATOM 66560 O21 PC 1610 140.499 19.065 23.376 1.00 0.00 O ATOM 66561 C21 PC 1610 141.224 20.152 23.554 1.00 0.00 C ATOM 66562 O22 PC 1610 140.955 21.311 23.241 1.00 0.00 O ATOM 66563 C12 OL 1611 142.516 19.936 24.411 1.00 0.00 C ATOM 66564 H2R OL 1611 143.100 19.153 23.922 1.00 0.00 H ATOM 66565 H2S OL 1611 143.161 20.779 24.152 1.00 0.00 H ATOM 66566 C13 OL 1611 142.221 19.543 25.849 1.00 0.00 C ATOM 66567 H3R OL 1611 141.625 20.405 26.154 1.00 0.00 H ATOM 66568 H3S OL 1611 141.520 18.732 26.057 1.00 0.00 H ATOM 66569 C14 OL 1611 143.490 19.662 26.763 1.00 0.00 C ATOM 66570 H4R OL 1611 143.842 20.695 26.785 1.00 0.00 H ATOM 66571 H4S OL 1611 143.160 19.547 27.798 1.00 0.00 H ATOM 66572 C15 OL 1611 144.673 18.704 26.412 1.00 0.00 C ATOM 66573 H5R OL 1611 144.247 17.699 26.416 1.00 0.00 H ATOM 66574 H5S OL 1611 145.096 18.904 25.425 1.00 0.00 H ATOM 66575 C16 OL 1611 145.942 18.825 27.390 1.00 0.00 C ATOM 66576 H6R OL 1611 146.270 19.863 27.305 1.00 0.00 H ATOM 66577 H6S OL 1611 145.521 18.834 28.397 1.00 0.00 H ATOM 66578 C17 OL 1611 147.042 17.785 27.076 1.00 0.00 C ATOM 66579 H7R OL 1611 146.608 16.783 27.053 1.00 0.00 H ATOM 66580 H7S OL 1611 147.398 17.910 26.051 1.00 0.00 H ATOM 66581 C18 OL 1611 148.274 17.861 27.993 1.00 0.00 C ATOM 66582 H8R OL 1611 148.926 17.057 27.646 1.00 0.00 H ATOM 66583 H8S OL 1611 148.991 18.676 27.878 1.00 0.00 H ATOM 66584 C19 OL 1611 147.945 17.687 29.421 1.00 0.00 C ATOM 66585 H9R OL 1611 147.543 16.720 29.711 1.00 0.00 H ATOM 66586 C110 OL 1611 148.107 18.556 30.404 1.00 0.00 C ATOM 66587 H10R OL 1611 147.754 18.291 31.397 1.00 0.00 H ATOM 66588 C111 OL 1611 148.641 19.976 30.327 1.00 0.00 C ATOM 66589 H11R OL 1611 149.562 20.116 30.898 1.00 0.00 H ATOM 66590 H11S OL 1611 148.901 20.217 29.295 1.00 0.00 H ATOM 66591 C112 OL 1611 147.580 20.975 30.719 1.00 0.00 C ATOM 66592 H12R OL 1611 146.985 21.264 29.850 1.00 0.00 H ATOM 66593 H12S OL 1611 146.827 20.561 31.393 1.00 0.00 H ATOM 66594 C113 OL 1611 148.137 22.178 31.395 1.00 0.00 C ATOM 66595 H13R OL 1611 147.272 22.729 31.771 1.00 0.00 H ATOM 66596 H13S OL 1611 148.674 21.912 32.308 1.00 0.00 H ATOM 66597 C114 OL 1611 148.937 23.108 30.504 1.00 0.00 C ATOM 66598 H14R OL 1611 149.404 22.453 29.765 1.00 0.00 H ATOM 66599 H14S OL 1611 148.241 23.589 29.814 1.00 0.00 H ATOM 66600 C115 OL 1611 149.952 24.006 31.187 1.00 0.00 C ATOM 66601 H15R OL 1611 149.537 24.518 32.057 1.00 0.00 H ATOM 66602 H15S OL 1611 150.597 23.224 31.593 1.00 0.00 H ATOM 66603 C116 OL 1611 150.520 25.025 30.170 1.00 0.00 C ATOM 66604 H16R OL 1611 150.661 24.427 29.268 1.00 0.00 H ATOM 66605 H16S OL 1611 149.769 25.792 29.969 1.00 0.00 H ATOM 66606 C117 OL 1611 151.773 25.825 30.608 1.00 0.00 C ATOM 66607 H17R OL 1611 152.461 24.984 30.722 1.00 0.00 H ATOM 66608 H17S OL 1611 152.142 26.529 29.859 1.00 0.00 H ATOM 66609 C118 OL 1611 151.599 26.469 31.979 1.00 0.00 C ATOM 66610 H18R OL 1611 151.574 25.652 32.702 1.00 0.00 H ATOM 66611 H18S OL 1611 150.765 27.174 31.979 1.00 0.00 H ATOM 66612 H18T OL 1611 152.565 26.935 32.184 1.00 0.00 H TER 66613 OL 1611 ATOM 66613 C116 PA 1612 65.237 44.907 42.632 1.00 0.00 C ATOM 66614 H16R PA 1612 65.291 45.003 43.718 1.00 0.00 H ATOM 66615 H16S PA 1612 64.888 45.826 42.156 1.00 0.00 H ATOM 66616 H16T PA 1612 66.268 44.744 42.311 1.00 0.00 H ATOM 66617 C115 PA 1612 64.418 43.673 42.292 1.00 0.00 C ATOM 66618 H15R PA 1612 63.555 43.714 42.961 1.00 0.00 H ATOM 66619 H15S PA 1612 64.998 42.827 42.666 1.00 0.00 H ATOM 66620 C114 PA 1612 63.838 43.508 40.845 1.00 0.00 C ATOM 66621 H14R PA 1612 64.667 43.654 40.149 1.00 0.00 H ATOM 66622 H14S PA 1612 63.126 44.324 40.705 1.00 0.00 H ATOM 66623 C113 PA 1612 63.063 42.223 40.604 1.00 0.00 C ATOM 66624 H13R PA 1612 62.439 42.036 41.480 1.00 0.00 H ATOM 66625 H13S PA 1612 63.819 41.439 40.685 1.00 0.00 H ATOM 66626 C112 PA 1612 62.030 42.175 39.457 1.00 0.00 C ATOM 66627 H12R PA 1612 61.142 42.788 39.619 1.00 0.00 H ATOM 66628 H12S PA 1612 61.713 41.134 39.357 1.00 0.00 H ATOM 66629 C111 PA 1612 62.591 42.483 38.118 1.00 0.00 C ATOM 66630 H11R PA 1612 62.870 43.537 38.049 1.00 0.00 H ATOM 66631 H11S PA 1612 61.865 42.248 37.337 1.00 0.00 H ATOM 66632 C110 PA 1612 63.897 41.813 37.681 1.00 0.00 C ATOM 66633 H10R PA 1612 64.658 42.181 38.371 1.00 0.00 H ATOM 66634 H10S PA 1612 63.985 42.119 36.636 1.00 0.00 H ATOM 66635 C19 PA 1612 63.892 40.338 37.847 1.00 0.00 C ATOM 66636 H9R PA 1612 62.958 39.964 37.422 1.00 0.00 H ATOM 66637 H9S PA 1612 63.780 40.073 38.901 1.00 0.00 H ATOM 66638 C18 PA 1612 65.023 39.680 37.115 1.00 0.00 C ATOM 66639 H8R PA 1612 65.891 40.048 37.666 1.00 0.00 H ATOM 66640 H8S PA 1612 65.090 39.987 36.069 1.00 0.00 H ATOM 66641 C17 PA 1612 65.046 38.208 37.138 1.00 0.00 C ATOM 66642 H7R PA 1612 64.813 37.969 38.177 1.00 0.00 H ATOM 66643 H7S PA 1612 66.019 37.729 37.013 1.00 0.00 H ATOM 66644 C16 PA 1612 64.194 37.374 36.162 1.00 0.00 C ATOM 66645 H6R PA 1612 63.178 37.762 36.259 1.00 0.00 H ATOM 66646 H6S PA 1612 64.249 36.335 36.493 1.00 0.00 H ATOM 66647 C15 PA 1612 64.728 37.751 34.782 1.00 0.00 C ATOM 66648 H5R PA 1612 65.714 38.214 34.702 1.00 0.00 H ATOM 66649 H5S PA 1612 64.174 38.655 34.520 1.00 0.00 H ATOM 66650 C14 PA 1612 64.766 36.653 33.788 1.00 0.00 C ATOM 66651 H4R PA 1612 63.825 36.148 33.561 1.00 0.00 H ATOM 66652 H4S PA 1612 65.395 35.823 34.115 1.00 0.00 H ATOM 66653 C13 PA 1612 65.335 37.068 32.452 1.00 0.00 C ATOM 66654 H3R PA 1612 65.485 36.202 31.804 1.00 0.00 H ATOM 66655 H3S PA 1612 66.350 37.432 32.622 1.00 0.00 H ATOM 66656 C12 PA 1612 64.519 38.147 31.656 1.00 0.00 C ATOM 66657 H2R PA 1612 64.432 39.079 32.218 1.00 0.00 H ATOM 66658 H2S PA 1612 63.495 37.783 31.548 1.00 0.00 H ATOM 66659 C11 PGR 1613 65.114 38.442 30.311 1.00 0.00 C ATOM 66660 O12 PGR 1613 66.207 37.919 29.954 1.00 0.00 O ATOM 66661 O11 PGR 1613 64.373 39.290 29.543 1.00 0.00 O ATOM 66662 C1 PGR 1613 64.922 39.713 28.234 1.00 0.00 C ATOM 66663 HR PGR 1613 65.299 38.828 27.715 1.00 0.00 H ATOM 66664 HS PGR 1613 65.719 40.427 28.460 1.00 0.00 H ATOM 66665 C2 PGR 1613 63.890 40.358 27.304 1.00 0.00 C ATOM 66666 HX PGR 1613 63.031 39.683 27.290 1.00 0.00 H ATOM 66667 C3 PGR 1613 64.619 40.549 25.895 1.00 0.00 C ATOM 66668 HA PGR 1613 63.902 40.867 25.133 1.00 0.00 H ATOM 66669 HB PGR 1613 65.106 39.581 25.753 1.00 0.00 H ATOM 66670 O31 PGR 1613 65.623 41.578 25.651 1.00 0.00 O ATOM 66671 P31 PGR 1613 66.359 41.838 24.277 1.00 0.00 P ATOM 66672 O32 PGR 1613 65.238 42.371 23.297 1.00 0.00 O ATOM 66673 C31 PGR 1613 64.408 41.616 22.328 1.00 0.00 C ATOM 66674 H1A PGR 1613 63.887 40.764 22.772 1.00 0.00 H ATOM 66675 H1B PGR 1613 65.158 41.179 21.664 1.00 0.00 H ATOM 66676 C32 PGR 1613 63.462 42.556 21.628 1.00 0.00 C ATOM 66677 H2A PGR 1613 64.027 43.453 21.360 1.00 0.00 H ATOM 66678 O35 PGR 1613 62.328 42.793 22.521 1.00 0.00 O ATOM 66679 HO5A PGR 1613 61.966 41.943 22.830 1.00 0.00 H ATOM 66680 C33 PGR 1613 62.896 41.900 20.363 1.00 0.00 C ATOM 66681 H3A PGR 1613 62.328 42.599 19.744 1.00 0.00 H ATOM 66682 H3B PGR 1613 63.685 41.640 19.653 1.00 0.00 H ATOM 66683 O33 PGR 1613 67.239 43.016 24.535 1.00 0.00 O ATOM 66684 O34 PGR 1613 66.939 40.579 23.726 1.00 0.00 O ATOM 66685 O21 PGR 1613 63.462 41.583 27.781 1.00 0.00 O ATOM 66686 C21 PGR 1613 62.183 42.037 27.661 1.00 0.00 C ATOM 66687 O22 PGR 1613 61.299 41.374 27.095 1.00 0.00 O ATOM 66688 O36 PGR 1613 62.240 40.684 20.650 1.00 0.00 O ATOM 66689 HO6A PGR 1613 62.811 40.040 21.105 1.00 0.00 H ATOM 66690 C12 OL 1614 62.063 43.458 28.259 1.00 0.00 C ATOM 66691 H2R OL 1614 62.840 44.104 27.844 1.00 0.00 H ATOM 66692 H2S OL 1614 61.168 43.917 27.836 1.00 0.00 H ATOM 66693 C13 OL 1614 62.178 43.542 29.816 1.00 0.00 C ATOM 66694 H3R OL 1614 62.079 44.593 30.097 1.00 0.00 H ATOM 66695 H3S OL 1614 61.391 43.022 30.365 1.00 0.00 H ATOM 66696 C14 OL 1614 63.524 43.088 30.451 1.00 0.00 C ATOM 66697 H4R OL 1614 63.762 42.063 30.162 1.00 0.00 H ATOM 66698 H4S OL 1614 64.313 43.740 30.069 1.00 0.00 H ATOM 66699 C15 OL 1614 63.552 43.177 31.962 1.00 0.00 C ATOM 66700 H5R OL 1614 63.483 44.258 32.099 1.00 0.00 H ATOM 66701 H5S OL 1614 62.590 42.776 32.287 1.00 0.00 H ATOM 66702 C16 OL 1614 64.752 42.523 32.649 1.00 0.00 C ATOM 66703 H6R OL 1614 64.750 42.544 33.741 1.00 0.00 H ATOM 66704 H6S OL 1614 64.644 41.486 32.323 1.00 0.00 H ATOM 66705 C17 OL 1614 66.111 42.975 32.216 1.00 0.00 C ATOM 66706 H7R OL 1614 66.186 43.241 31.160 1.00 0.00 H ATOM 66707 H7S OL 1614 66.382 43.879 32.765 1.00 0.00 H ATOM 66708 C18 OL 1614 67.205 41.964 32.615 1.00 0.00 C ATOM 66709 H8R OL 1614 67.271 41.767 33.687 1.00 0.00 H ATOM 66710 H8S OL 1614 66.922 41.007 32.169 1.00 0.00 H ATOM 66711 C19 OL 1614 68.456 42.473 32.039 1.00 0.00 C ATOM 66712 H9R OL 1614 68.383 42.650 30.969 1.00 0.00 H ATOM 66713 C110 OL 1614 69.600 42.709 32.644 1.00 0.00 C ATOM 66714 H10R OL 1614 70.397 43.181 32.075 1.00 0.00 H ATOM 66715 C111 OL 1614 69.837 42.423 34.056 1.00 0.00 C ATOM 66716 H11R OL 1614 69.388 41.482 34.383 1.00 0.00 H ATOM 66717 H11S OL 1614 70.896 42.204 34.208 1.00 0.00 H ATOM 66718 C112 OL 1614 69.376 43.575 35.016 1.00 0.00 C ATOM 66719 H12R OL 1614 69.845 44.457 34.575 1.00 0.00 H ATOM 66720 H12S OL 1614 68.289 43.603 34.911 1.00 0.00 H ATOM 66721 C113 OL 1614 69.812 43.183 36.486 1.00 0.00 C ATOM 66722 H13R OL 1614 69.546 42.168 36.788 1.00 0.00 H ATOM 66723 H13S OL 1614 70.904 43.148 36.489 1.00 0.00 H ATOM 66724 C114 OL 1614 69.363 44.195 37.497 1.00 0.00 C ATOM 66725 H14R OL 1614 69.960 43.980 38.386 1.00 0.00 H ATOM 66726 H14S OL 1614 69.808 45.082 37.041 1.00 0.00 H ATOM 66727 C115 OL 1614 67.876 44.262 37.818 1.00 0.00 C ATOM 66728 H15R OL 1614 67.418 44.625 36.896 1.00 0.00 H ATOM 66729 H15S OL 1614 67.578 43.286 38.207 1.00 0.00 H ATOM 66730 C116 OL 1614 67.431 45.428 38.815 1.00 0.00 C ATOM 66731 H16R OL 1614 66.354 45.414 38.995 1.00 0.00 H ATOM 66732 H16S OL 1614 67.958 45.355 39.769 1.00 0.00 H ATOM 66733 C117 OL 1614 67.915 46.785 38.259 1.00 0.00 C ATOM 66734 H17R OL 1614 68.979 46.927 38.460 1.00 0.00 H ATOM 66735 H17S OL 1614 67.749 46.768 37.179 1.00 0.00 H ATOM 66736 C118 OL 1614 67.181 47.980 38.857 1.00 0.00 C ATOM 66737 H18R OL 1614 66.130 47.767 38.650 1.00 0.00 H ATOM 66738 H18S OL 1614 67.375 48.960 38.416 1.00 0.00 H ATOM 66739 H18T OL 1614 67.344 48.021 39.935 1.00 0.00 H TER 66740 OL 1614 ATOM 66740 C116 PA 1615 29.480 130.998 41.698 1.00 0.00 C ATOM 66741 H16R PA 1615 30.496 131.391 41.633 1.00 0.00 H ATOM 66742 H16S PA 1615 29.583 130.081 42.282 1.00 0.00 H ATOM 66743 H16T PA 1615 29.062 131.660 42.459 1.00 0.00 H ATOM 66744 C115 PA 1615 28.689 131.024 40.340 1.00 0.00 C ATOM 66745 H15R PA 1615 28.502 132.052 40.022 1.00 0.00 H ATOM 66746 H15S PA 1615 27.640 130.861 40.597 1.00 0.00 H ATOM 66747 C114 PA 1615 29.282 130.023 39.236 1.00 0.00 C ATOM 66748 H14R PA 1615 29.221 128.991 39.588 1.00 0.00 H ATOM 66749 H14S PA 1615 30.324 130.216 38.970 1.00 0.00 H ATOM 66750 C113 PA 1615 28.478 129.990 37.833 1.00 0.00 C ATOM 66751 H13R PA 1615 28.495 130.968 37.348 1.00 0.00 H ATOM 66752 H13S PA 1615 27.403 129.842 37.958 1.00 0.00 H ATOM 66753 C112 PA 1615 28.939 128.872 36.945 1.00 0.00 C ATOM 66754 H12R PA 1615 28.662 127.883 37.318 1.00 0.00 H ATOM 66755 H12S PA 1615 30.029 128.845 36.989 1.00 0.00 H ATOM 66756 C111 PA 1615 28.438 128.850 35.498 1.00 0.00 C ATOM 66757 H11R PA 1615 28.461 129.819 34.995 1.00 0.00 H ATOM 66758 H11S PA 1615 27.377 128.592 35.492 1.00 0.00 H ATOM 66759 C110 PA 1615 29.283 127.825 34.679 1.00 0.00 C ATOM 66760 H10R PA 1615 30.317 128.145 34.533 1.00 0.00 H ATOM 66761 H10S PA 1615 28.942 127.979 33.653 1.00 0.00 H ATOM 66762 C19 PA 1615 29.307 126.317 35.064 1.00 0.00 C ATOM 66763 H9R PA 1615 29.928 126.000 35.905 1.00 0.00 H ATOM 66764 H9S PA 1615 29.936 125.950 34.251 1.00 0.00 H ATOM 66765 C18 PA 1615 27.956 125.654 35.017 1.00 0.00 C ATOM 66766 H8R PA 1615 27.176 126.231 35.520 1.00 0.00 H ATOM 66767 H8S PA 1615 28.187 124.795 35.651 1.00 0.00 H ATOM 66768 C17 PA 1615 27.542 125.034 33.632 1.00 0.00 C ATOM 66769 H7R PA 1615 27.708 123.965 33.785 1.00 0.00 H ATOM 66770 H7S PA 1615 28.317 125.281 32.904 1.00 0.00 H ATOM 66771 C16 PA 1615 26.150 125.314 33.135 1.00 0.00 C ATOM 66772 H6R PA 1615 25.756 126.298 33.399 1.00 0.00 H ATOM 66773 H6S PA 1615 25.584 124.572 33.702 1.00 0.00 H ATOM 66774 C15 PA 1615 25.876 125.139 31.655 1.00 0.00 C ATOM 66775 H5R PA 1615 26.339 125.914 31.041 1.00 0.00 H ATOM 66776 H5S PA 1615 24.800 124.999 31.536 1.00 0.00 H ATOM 66777 C14 PA 1615 26.310 123.742 31.184 1.00 0.00 C ATOM 66778 H4R PA 1615 25.887 122.979 31.840 1.00 0.00 H ATOM 66779 H4S PA 1615 27.401 123.700 31.151 1.00 0.00 H ATOM 66780 C13 PA 1615 25.656 123.377 29.880 1.00 0.00 C ATOM 66781 H3R PA 1615 26.055 124.064 29.131 1.00 0.00 H ATOM 66782 H3S PA 1615 24.579 123.554 29.925 1.00 0.00 H ATOM 66783 C12 PA 1615 26.077 121.919 29.517 1.00 0.00 C ATOM 66784 H2R PA 1615 25.578 121.192 30.161 1.00 0.00 H ATOM 66785 H2S PA 1615 27.137 121.739 29.709 1.00 0.00 H ATOM 66786 C11 PGR 1616 25.705 121.661 28.047 1.00 0.00 C ATOM 66787 O12 PGR 1616 24.649 122.110 27.637 1.00 0.00 O ATOM 66788 O11 PGR 1616 26.594 120.827 27.394 1.00 0.00 O ATOM 66789 C1 PGR 1616 26.422 120.575 25.937 1.00 0.00 C ATOM 66790 HR PGR 1616 26.422 121.471 25.311 1.00 0.00 H ATOM 66791 HS PGR 1616 25.456 120.088 25.779 1.00 0.00 H ATOM 66792 C2 PGR 1616 27.637 119.738 25.430 1.00 0.00 C ATOM 66793 HX PGR 1616 28.454 119.782 26.155 1.00 0.00 H ATOM 66794 C3 PGR 1616 28.027 120.046 24.045 1.00 0.00 C ATOM 66795 HA PGR 1616 28.762 119.314 23.700 1.00 0.00 H ATOM 66796 HB PGR 1616 28.408 121.068 23.986 1.00 0.00 H ATOM 66797 O31 PGR 1616 26.882 119.967 23.182 1.00 0.00 O ATOM 66798 P31 PGR 1616 26.923 120.300 21.639 1.00 0.00 P ATOM 66799 O32 PGR 1616 27.481 118.963 20.973 1.00 0.00 O ATOM 66800 C31 PGR 1616 26.785 117.754 21.063 1.00 0.00 C ATOM 66801 H1A PGR 1616 25.996 117.890 20.320 1.00 0.00 H ATOM 66802 H1B PGR 1616 26.317 117.549 22.029 1.00 0.00 H ATOM 66803 C32 PGR 1616 27.697 116.548 20.727 1.00 0.00 C ATOM 66804 H2A PGR 1616 27.060 115.745 20.347 1.00 0.00 H ATOM 66805 O35 PGR 1616 28.349 116.125 21.901 1.00 0.00 O ATOM 66806 HO5A PGR 1616 27.880 115.311 22.158 1.00 0.00 H ATOM 66807 C33 PGR 1616 28.672 116.852 19.539 1.00 0.00 C ATOM 66808 H3A PGR 1616 28.115 117.237 18.682 1.00 0.00 H ATOM 66809 H3B PGR 1616 29.356 117.654 19.828 1.00 0.00 H ATOM 66810 O33 PGR 1616 25.615 120.519 21.072 1.00 0.00 O ATOM 66811 O34 PGR 1616 27.913 121.359 21.445 1.00 0.00 O ATOM 66812 O21 PGR 1616 27.229 118.358 25.288 1.00 0.00 O ATOM 66813 C21 PGR 1616 28.194 117.450 25.337 1.00 0.00 C ATOM 66814 O22 PGR 1616 29.353 117.699 25.367 1.00 0.00 O ATOM 66815 O36 PGR 1616 29.439 115.674 19.140 1.00 0.00 O ATOM 66816 HO6A PGR 1616 29.723 115.884 18.232 1.00 0.00 H ATOM 66817 C12 OL 1617 27.553 116.064 25.480 1.00 0.00 C ATOM 66818 H2R OL 1617 26.471 116.148 25.355 1.00 0.00 H ATOM 66819 H2S OL 1617 27.937 115.358 24.741 1.00 0.00 H ATOM 66820 C13 OL 1617 27.760 115.619 26.865 1.00 0.00 C ATOM 66821 H3R OL 1617 27.206 114.679 26.916 1.00 0.00 H ATOM 66822 H3S OL 1617 28.821 115.432 27.041 1.00 0.00 H ATOM 66823 C14 OL 1617 27.192 116.367 28.050 1.00 0.00 C ATOM 66824 H4R OL 1617 27.392 115.796 28.959 1.00 0.00 H ATOM 66825 H4S OL 1617 27.779 117.288 28.060 1.00 0.00 H ATOM 66826 C15 OL 1617 25.781 116.765 27.962 1.00 0.00 C ATOM 66827 H5R OL 1617 25.637 117.492 27.159 1.00 0.00 H ATOM 66828 H5S OL 1617 25.176 115.927 27.608 1.00 0.00 H ATOM 66829 C16 OL 1617 25.139 117.554 29.207 1.00 0.00 C ATOM 66830 H6R OL 1617 25.485 117.126 30.150 1.00 0.00 H ATOM 66831 H6S OL 1617 25.528 118.571 29.288 1.00 0.00 H ATOM 66832 C17 OL 1617 23.582 117.554 29.075 1.00 0.00 C ATOM 66833 H7R OL 1617 23.294 118.229 28.267 1.00 0.00 H ATOM 66834 H7S OL 1617 23.190 116.575 28.790 1.00 0.00 H ATOM 66835 C18 OL 1617 22.915 117.914 30.473 1.00 0.00 C ATOM 66836 H8R OL 1617 23.400 118.805 30.879 1.00 0.00 H ATOM 66837 H8S OL 1617 21.860 118.158 30.332 1.00 0.00 H ATOM 66838 C19 OL 1617 22.866 116.738 31.405 1.00 0.00 C ATOM 66839 H9R OL 1617 22.455 115.899 30.849 1.00 0.00 H ATOM 66840 C110 OL 1617 23.298 116.603 32.642 1.00 0.00 C ATOM 66841 H10R OL 1617 23.345 115.620 33.102 1.00 0.00 H ATOM 66842 C111 OL 1617 23.855 117.800 33.464 1.00 0.00 C ATOM 66843 H11R OL 1617 24.932 117.627 33.520 1.00 0.00 H ATOM 66844 H11S OL 1617 23.593 118.683 32.877 1.00 0.00 H ATOM 66845 C112 OL 1617 23.151 118.003 34.837 1.00 0.00 C ATOM 66846 H12R OL 1617 23.333 118.990 35.268 1.00 0.00 H ATOM 66847 H12S OL 1617 22.079 118.127 34.665 1.00 0.00 H ATOM 66848 C113 OL 1617 23.271 116.853 35.863 1.00 0.00 C ATOM 66849 H13R OL 1617 22.610 116.894 36.731 1.00 0.00 H ATOM 66850 H13S OL 1617 22.905 115.964 35.345 1.00 0.00 H ATOM 66851 C114 OL 1617 24.695 116.335 36.297 1.00 0.00 C ATOM 66852 H14R OL 1617 25.416 116.072 35.521 1.00 0.00 H ATOM 66853 H14S OL 1617 25.141 117.129 36.900 1.00 0.00 H ATOM 66854 C115 OL 1617 24.774 115.060 37.192 1.00 0.00 C ATOM 66855 H15R OL 1617 24.073 115.326 37.986 1.00 0.00 H ATOM 66856 H15S OL 1617 24.260 114.214 36.732 1.00 0.00 H ATOM 66857 C116 OL 1617 26.191 114.602 37.791 1.00 0.00 C ATOM 66858 H16R OL 1617 26.769 114.199 36.957 1.00 0.00 H ATOM 66859 H16S OL 1617 26.776 115.422 38.212 1.00 0.00 H ATOM 66860 C117 OL 1617 26.157 113.548 38.897 1.00 0.00 C ATOM 66861 H17R OL 1617 25.314 112.895 38.661 1.00 0.00 H ATOM 66862 H17S OL 1617 27.109 113.014 38.921 1.00 0.00 H ATOM 66863 C118 OL 1617 26.024 114.053 40.248 1.00 0.00 C ATOM 66864 H18R OL 1617 27.008 114.406 40.562 1.00 0.00 H ATOM 66865 H18S OL 1617 25.657 113.295 40.944 1.00 0.00 H ATOM 66866 H18T OL 1617 25.334 114.899 40.219 1.00 0.00 H TER 66867 OL 1617 ATOM 66867 C116 PA 1618 30.024 28.807 35.356 1.00 0.00 C ATOM 66868 H16R PA 1618 29.595 28.614 36.341 1.00 0.00 H ATOM 66869 H16S PA 1618 29.308 29.180 34.621 1.00 0.00 H ATOM 66870 H16T PA 1618 30.800 29.574 35.382 1.00 0.00 H ATOM 66871 C115 PA 1618 30.813 27.631 34.799 1.00 0.00 C ATOM 66872 H15R PA 1618 31.405 27.148 35.579 1.00 0.00 H ATOM 66873 H15S PA 1618 31.610 28.141 34.254 1.00 0.00 H ATOM 66874 C114 PA 1618 29.969 26.699 33.946 1.00 0.00 C ATOM 66875 H14R PA 1618 29.509 27.181 33.081 1.00 0.00 H ATOM 66876 H14S PA 1618 29.143 26.342 34.564 1.00 0.00 H ATOM 66877 C113 PA 1618 30.739 25.526 33.390 1.00 0.00 C ATOM 66878 H13R PA 1618 31.385 25.106 34.163 1.00 0.00 H ATOM 66879 H13S PA 1618 31.423 25.871 32.612 1.00 0.00 H ATOM 66880 C112 PA 1618 29.917 24.512 32.765 1.00 0.00 C ATOM 66881 H12R PA 1618 30.454 23.795 32.141 1.00 0.00 H ATOM 66882 H12S PA 1618 29.289 25.105 32.097 1.00 0.00 H ATOM 66883 C111 PA 1618 29.009 23.698 33.688 1.00 0.00 C ATOM 66884 H11R PA 1618 28.311 24.340 34.230 1.00 0.00 H ATOM 66885 H11S PA 1618 29.685 23.258 34.425 1.00 0.00 H ATOM 66886 C110 PA 1618 28.275 22.612 33.023 1.00 0.00 C ATOM 66887 H10R PA 1618 28.914 22.046 32.342 1.00 0.00 H ATOM 66888 H10S PA 1618 27.538 23.099 32.380 1.00 0.00 H ATOM 66889 C19 PA 1618 27.596 21.560 33.879 1.00 0.00 C ATOM 66890 H9R PA 1618 28.198 21.195 34.714 1.00 0.00 H ATOM 66891 H9S PA 1618 27.399 20.686 33.255 1.00 0.00 H ATOM 66892 C18 PA 1618 26.304 22.031 34.581 1.00 0.00 C ATOM 66893 H8R PA 1618 26.656 22.868 35.189 1.00 0.00 H ATOM 66894 H8S PA 1618 25.939 21.257 35.259 1.00 0.00 H ATOM 66895 C17 PA 1618 25.056 22.422 33.767 1.00 0.00 C ATOM 66896 H7R PA 1618 25.274 23.329 33.199 1.00 0.00 H ATOM 66897 H7S PA 1618 24.222 22.634 34.439 1.00 0.00 H ATOM 66898 C16 PA 1618 24.506 21.400 32.664 1.00 0.00 C ATOM 66899 H6R PA 1618 24.407 20.432 33.158 1.00 0.00 H ATOM 66900 H6S PA 1618 25.235 21.372 31.851 1.00 0.00 H ATOM 66901 C15 PA 1618 23.187 21.953 32.042 1.00 0.00 C ATOM 66902 H5R PA 1618 23.223 23.001 31.737 1.00 0.00 H ATOM 66903 H5S PA 1618 22.362 21.921 32.756 1.00 0.00 H ATOM 66904 C14 PA 1618 22.503 20.996 31.015 1.00 0.00 C ATOM 66905 H4R PA 1618 21.572 21.498 30.745 1.00 0.00 H ATOM 66906 H4S PA 1618 22.197 20.080 31.524 1.00 0.00 H ATOM 66907 C13 PA 1618 23.252 20.752 29.717 1.00 0.00 C ATOM 66908 H3R PA 1618 23.745 19.781 29.799 1.00 0.00 H ATOM 66909 H3S PA 1618 23.988 21.507 29.431 1.00 0.00 H ATOM 66910 C12 PA 1618 22.272 20.892 28.539 1.00 0.00 C ATOM 66911 H2R PA 1618 21.889 21.910 28.448 1.00 0.00 H ATOM 66912 H2S PA 1618 21.334 20.338 28.611 1.00 0.00 H ATOM 66913 C11 PGR 1619 22.908 20.420 27.298 1.00 0.00 C ATOM 66914 O12 PGR 1619 23.487 19.316 27.119 1.00 0.00 O ATOM 66915 O11 PGR 1619 22.700 21.355 26.404 1.00 0.00 O ATOM 66916 C1 PGR 1619 22.981 21.061 25.002 1.00 0.00 C ATOM 66917 HR PGR 1619 24.038 20.835 24.841 1.00 0.00 H ATOM 66918 HS PGR 1619 22.697 21.930 24.403 1.00 0.00 H ATOM 66919 C2 PGR 1619 22.036 19.958 24.474 1.00 0.00 C ATOM 66920 HX PGR 1619 22.150 19.061 25.088 1.00 0.00 H ATOM 66921 C3 PGR 1619 22.506 19.476 23.078 1.00 0.00 C ATOM 66922 HA PGR 1619 22.069 18.552 22.693 1.00 0.00 H ATOM 66923 HB PGR 1619 23.531 19.127 23.230 1.00 0.00 H ATOM 66924 O31 PGR 1619 22.453 20.424 21.984 1.00 0.00 O ATOM 66925 P31 PGR 1619 23.725 20.896 21.265 1.00 0.00 P ATOM 66926 O32 PGR 1619 23.291 22.144 20.462 1.00 0.00 O ATOM 66927 C31 PGR 1619 22.819 23.337 21.107 1.00 0.00 C ATOM 66928 H1A PGR 1619 23.629 23.804 21.673 1.00 0.00 H ATOM 66929 H1B PGR 1619 21.971 23.146 21.769 1.00 0.00 H ATOM 66930 C32 PGR 1619 22.455 24.346 19.959 1.00 0.00 C ATOM 66931 H2A PGR 1619 21.651 23.875 19.389 1.00 0.00 H ATOM 66932 O35 PGR 1619 23.492 24.594 18.953 1.00 0.00 O ATOM 66933 HO5A PGR 1619 24.207 23.951 19.108 1.00 0.00 H ATOM 66934 C33 PGR 1619 21.943 25.638 20.565 1.00 0.00 C ATOM 66935 H3A PGR 1619 21.515 26.234 19.755 1.00 0.00 H ATOM 66936 H3B PGR 1619 21.124 25.379 21.240 1.00 0.00 H ATOM 66937 O33 PGR 1619 24.678 21.350 22.326 1.00 0.00 O ATOM 66938 O34 PGR 1619 24.209 19.825 20.373 1.00 0.00 O ATOM 66939 O21 PGR 1619 20.614 20.302 24.384 1.00 0.00 O ATOM 66940 C21 PGR 1619 19.710 19.297 24.257 1.00 0.00 C ATOM 66941 O22 PGR 1619 20.133 18.119 24.115 1.00 0.00 O ATOM 66942 O36 PGR 1619 22.947 26.437 21.158 1.00 0.00 O ATOM 66943 HO6A PGR 1619 23.798 26.310 20.702 1.00 0.00 H TER 66944 PGR 1619 ATOM 66944 C12 OL 1620 131.399 126.758 32.425 1.00 0.00 C ATOM 66945 H2R OL 1620 132.269 126.287 32.887 1.00 0.00 H ATOM 66946 H2S OL 1620 131.823 127.406 31.655 1.00 0.00 H ATOM 66947 C13 OL 1620 130.559 125.748 31.586 1.00 0.00 C ATOM 66948 H3R OL 1620 129.620 125.596 32.124 1.00 0.00 H ATOM 66949 H3S OL 1620 130.160 126.249 30.701 1.00 0.00 H ATOM 66950 C14 OL 1620 131.252 124.407 31.317 1.00 0.00 C ATOM 66951 H4R OL 1620 132.185 124.560 30.771 1.00 0.00 H ATOM 66952 H4S OL 1620 131.422 123.959 32.298 1.00 0.00 H ATOM 66953 C15 OL 1620 130.308 123.446 30.560 1.00 0.00 C ATOM 66954 H5R OL 1620 130.845 122.499 30.645 1.00 0.00 H ATOM 66955 H5S OL 1620 129.339 123.412 31.064 1.00 0.00 H ATOM 66956 C16 OL 1620 130.205 123.869 29.149 1.00 0.00 C ATOM 66957 H6R OL 1620 129.650 124.796 28.987 1.00 0.00 H ATOM 66958 H6S OL 1620 131.172 124.132 28.716 1.00 0.00 H ATOM 66959 C17 OL 1620 129.633 122.705 28.261 1.00 0.00 C ATOM 66960 H7R OL 1620 129.770 122.982 27.214 1.00 0.00 H ATOM 66961 H7S OL 1620 130.304 121.858 28.420 1.00 0.00 H ATOM 66962 C18 OL 1620 128.159 122.394 28.456 1.00 0.00 C ATOM 66963 H8R OL 1620 127.929 122.117 29.487 1.00 0.00 H ATOM 66964 H8S OL 1620 127.654 123.322 28.179 1.00 0.00 H ATOM 66965 C19 OL 1620 127.642 121.319 27.504 1.00 0.00 C ATOM 66966 H9R OL 1620 128.293 121.209 26.640 1.00 0.00 H ATOM 66967 C110 OL 1620 126.663 120.432 27.754 1.00 0.00 C ATOM 66968 H10R OL 1620 126.454 119.702 26.976 1.00 0.00 H ATOM 66969 C111 OL 1620 125.645 120.480 28.848 1.00 0.00 C ATOM 66970 H11R OL 1620 125.407 121.498 29.165 1.00 0.00 H ATOM 66971 H11S OL 1620 124.743 120.003 28.458 1.00 0.00 H ATOM 66972 C112 OL 1620 125.996 119.848 30.154 1.00 0.00 C ATOM 66973 H12R OL 1620 126.945 120.152 30.600 1.00 0.00 H ATOM 66974 H12S OL 1620 125.262 120.210 30.878 1.00 0.00 H ATOM 66975 C113 OL 1620 125.935 118.305 30.136 1.00 0.00 C ATOM 66976 H13R OL 1620 125.065 118.072 29.519 1.00 0.00 H ATOM 66977 H13S OL 1620 126.739 117.898 29.519 1.00 0.00 H ATOM 66978 C114 OL 1620 125.900 117.569 31.433 1.00 0.00 C ATOM 66979 H14R OL 1620 125.553 118.237 32.224 1.00 0.00 H ATOM 66980 H14S OL 1620 125.181 116.750 31.359 1.00 0.00 H ATOM 66981 C115 OL 1620 127.183 116.777 31.726 1.00 0.00 C ATOM 66982 H15R OL 1620 127.331 116.102 30.880 1.00 0.00 H ATOM 66983 H15S OL 1620 128.072 117.408 31.672 1.00 0.00 H ATOM 66984 C116 OL 1620 127.139 116.155 33.088 1.00 0.00 C ATOM 66985 H16R OL 1620 127.471 116.833 33.877 1.00 0.00 H ATOM 66986 H16S OL 1620 126.102 115.933 33.348 1.00 0.00 H ATOM 66987 C117 OL 1620 128.011 114.882 33.153 1.00 0.00 C ATOM 66988 H17R OL 1620 127.526 114.068 32.610 1.00 0.00 H ATOM 66989 H17S OL 1620 128.995 115.065 32.717 1.00 0.00 H ATOM 66990 C118 OL 1620 128.325 114.297 34.513 1.00 0.00 C ATOM 66991 H18R OL 1620 129.191 113.634 34.539 1.00 0.00 H ATOM 66992 H18S OL 1620 127.532 113.590 34.764 1.00 0.00 H ATOM 66993 H18T OL 1620 128.328 115.042 35.311 1.00 0.00 H TER 66994 OL 1620 ATOM 66994 C116 PA 1621 67.071 119.359 37.309 1.00 0.00 C ATOM 66995 H16R PA 1621 66.022 119.106 37.472 1.00 0.00 H ATOM 66996 H16S PA 1621 67.391 119.925 38.186 1.00 0.00 H ATOM 66997 H16T PA 1621 67.615 118.413 37.349 1.00 0.00 H ATOM 66998 C115 PA 1621 67.242 120.167 36.018 1.00 0.00 C ATOM 66999 H15R PA 1621 68.271 120.531 36.047 1.00 0.00 H ATOM 67000 H15S PA 1621 66.645 121.069 36.167 1.00 0.00 H ATOM 67001 C114 PA 1621 67.067 119.299 34.721 1.00 0.00 C ATOM 67002 H14R PA 1621 66.039 119.464 34.392 1.00 0.00 H ATOM 67003 H14S PA 1621 67.135 118.217 34.856 1.00 0.00 H ATOM 67004 C113 PA 1621 67.765 119.904 33.521 1.00 0.00 C ATOM 67005 H13R PA 1621 68.823 119.689 33.687 1.00 0.00 H ATOM 67006 H13S PA 1621 67.559 120.976 33.492 1.00 0.00 H ATOM 67007 C112 PA 1621 67.320 119.237 32.225 1.00 0.00 C ATOM 67008 H12R PA 1621 66.237 119.329 32.113 1.00 0.00 H ATOM 67009 H12S PA 1621 67.478 118.191 32.497 1.00 0.00 H ATOM 67010 C111 PA 1621 68.024 119.793 31.008 1.00 0.00 C ATOM 67011 H11R PA 1621 68.111 119.003 30.259 1.00 0.00 H ATOM 67012 H11S PA 1621 69.055 120.064 31.246 1.00 0.00 H ATOM 67013 C110 PA 1621 67.261 120.958 30.327 1.00 0.00 C ATOM 67014 H10R PA 1621 67.521 121.909 30.798 1.00 0.00 H ATOM 67015 H10S PA 1621 66.205 120.896 30.600 1.00 0.00 H ATOM 67016 C19 PA 1621 67.359 120.890 28.763 1.00 0.00 C ATOM 67017 H9R PA 1621 66.898 119.977 28.382 1.00 0.00 H ATOM 67018 H9S PA 1621 68.386 120.736 28.425 1.00 0.00 H ATOM 67019 C18 PA 1621 66.681 122.088 27.995 1.00 0.00 C ATOM 67020 H8R PA 1621 67.042 123.037 28.397 1.00 0.00 H ATOM 67021 H8S PA 1621 65.600 122.027 28.137 1.00 0.00 H ATOM 67022 C17 PA 1621 67.049 122.040 26.495 1.00 0.00 C ATOM 67023 H7R PA 1621 66.833 121.066 26.050 1.00 0.00 H ATOM 67024 H7S PA 1621 68.127 122.197 26.421 1.00 0.00 H ATOM 67025 C16 PA 1621 66.272 123.122 25.674 1.00 0.00 C ATOM 67026 H6R PA 1621 66.250 124.064 26.226 1.00 0.00 H ATOM 67027 H6S PA 1621 65.228 122.805 25.641 1.00 0.00 H ATOM 67028 C15 PA 1621 66.755 123.413 24.274 1.00 0.00 C ATOM 67029 H5R PA 1621 66.817 122.451 23.761 1.00 0.00 H ATOM 67030 H5S PA 1621 67.768 123.737 24.522 1.00 0.00 H ATOM 67031 C14 PA 1621 66.170 124.502 23.505 1.00 0.00 C ATOM 67032 H4R PA 1621 65.997 125.439 24.039 1.00 0.00 H ATOM 67033 H4S PA 1621 65.190 124.165 23.160 1.00 0.00 H ATOM 67034 C13 PA 1621 67.141 124.618 22.328 1.00 0.00 C ATOM 67035 H3R PA 1621 67.425 123.575 22.171 1.00 0.00 H ATOM 67036 H3S PA 1621 68.053 125.177 22.547 1.00 0.00 H ATOM 67037 C12 PA 1621 66.466 125.290 21.049 1.00 0.00 C ATOM 67038 H2R PA 1621 66.078 126.281 21.293 1.00 0.00 H ATOM 67039 H2S PA 1621 65.516 124.821 20.786 1.00 0.00 H ATOM 67040 C11 PGR 1622 67.224 125.343 19.817 1.00 0.00 C ATOM 67041 O12 PGR 1622 68.223 124.699 19.724 1.00 0.00 O ATOM 67042 O11 PGR 1622 66.652 126.079 18.852 1.00 0.00 O ATOM 67043 C1 PGR 1622 67.502 126.141 17.696 1.00 0.00 C ATOM 67044 HR PGR 1622 67.562 125.186 17.167 1.00 0.00 H ATOM 67045 HS PGR 1622 68.469 126.600 17.916 1.00 0.00 H ATOM 67046 C2 PGR 1622 66.847 127.195 16.814 1.00 0.00 C ATOM 67047 HX PGR 1622 65.777 126.975 16.791 1.00 0.00 H ATOM 67048 C3 PGR 1622 67.440 127.083 15.389 1.00 0.00 C ATOM 67049 HA PGR 1622 67.167 127.930 14.755 1.00 0.00 H ATOM 67050 HB PGR 1622 67.149 126.130 14.939 1.00 0.00 H ATOM 67051 O31 PGR 1622 68.905 127.020 15.476 1.00 0.00 O ATOM 67052 P31 PGR 1622 69.784 127.012 14.104 1.00 0.00 P ATOM 67053 O32 PGR 1622 70.526 128.399 14.179 1.00 0.00 O ATOM 67054 C31 PGR 1622 71.652 128.685 15.031 1.00 0.00 C ATOM 67055 H1A PGR 1622 71.517 128.193 15.997 1.00 0.00 H ATOM 67056 H1B PGR 1622 72.583 128.340 14.575 1.00 0.00 H ATOM 67057 C32 PGR 1622 71.867 130.149 15.142 1.00 0.00 C ATOM 67058 H2A PGR 1622 72.630 130.327 15.904 1.00 0.00 H ATOM 67059 O35 PGR 1622 70.662 130.810 15.489 1.00 0.00 O ATOM 67060 HO5A PGR 1622 70.887 131.625 15.973 1.00 0.00 H ATOM 67061 C33 PGR 1622 72.462 130.692 13.891 1.00 0.00 C ATOM 67062 H3A PGR 1622 73.339 130.149 13.530 1.00 0.00 H ATOM 67063 H3B PGR 1622 71.707 130.443 13.142 1.00 0.00 H ATOM 67064 O33 PGR 1622 70.853 126.011 14.209 1.00 0.00 O ATOM 67065 O34 PGR 1622 68.898 127.102 12.910 1.00 0.00 O ATOM 67066 O21 PGR 1622 67.147 128.511 17.373 1.00 0.00 O ATOM 67067 C21 PGR 1622 66.357 129.494 17.064 1.00 0.00 C ATOM 67068 O22 PGR 1622 65.368 129.337 16.430 1.00 0.00 O ATOM 67069 O36 PGR 1622 72.727 132.135 14.065 1.00 0.00 O ATOM 67070 HO6A PGR 1622 71.900 132.626 14.216 1.00 0.00 H ATOM 67071 C12 OL 1623 66.625 130.879 17.553 1.00 0.00 C ATOM 67072 H2R OL 1623 67.612 131.224 17.238 1.00 0.00 H ATOM 67073 H2S OL 1623 65.905 131.592 17.145 1.00 0.00 H ATOM 67074 C13 OL 1623 66.637 130.905 19.107 1.00 0.00 C ATOM 67075 H3R OL 1623 67.467 130.270 19.423 1.00 0.00 H ATOM 67076 H3S OL 1623 67.006 131.888 19.407 1.00 0.00 H ATOM 67077 C14 OL 1623 65.305 130.575 19.878 1.00 0.00 C ATOM 67078 H4R OL 1623 64.794 131.533 19.763 1.00 0.00 H ATOM 67079 H4S OL 1623 64.749 129.792 19.358 1.00 0.00 H ATOM 67080 C15 OL 1623 65.462 130.269 21.331 1.00 0.00 C ATOM 67081 H5R OL 1623 64.520 130.484 21.839 1.00 0.00 H ATOM 67082 H5S OL 1623 65.638 129.238 21.647 1.00 0.00 H ATOM 67083 C16 OL 1623 66.538 131.079 22.140 1.00 0.00 C ATOM 67084 H6R OL 1623 67.560 130.777 21.901 1.00 0.00 H ATOM 67085 H6S OL 1623 66.522 132.120 21.810 1.00 0.00 H ATOM 67086 C17 OL 1623 66.114 131.074 23.604 1.00 0.00 C ATOM 67087 H7R OL 1623 65.105 131.460 23.766 1.00 0.00 H ATOM 67088 H7S OL 1623 66.187 130.075 24.039 1.00 0.00 H ATOM 67089 C18 OL 1623 67.065 131.902 24.545 1.00 0.00 C ATOM 67090 H8R OL 1623 68.009 131.383 24.725 1.00 0.00 H ATOM 67091 H8S OL 1623 67.286 132.894 24.145 1.00 0.00 H ATOM 67092 C19 OL 1623 66.360 132.095 25.910 1.00 0.00 C ATOM 67093 H9R OL 1623 65.937 131.222 26.400 1.00 0.00 H ATOM 67094 C110 OL 1623 66.339 133.194 26.628 1.00 0.00 C ATOM 67095 H10R OL 1623 65.992 133.105 27.654 1.00 0.00 H ATOM 67096 C111 OL 1623 66.815 134.563 26.210 1.00 0.00 C ATOM 67097 H11R OL 1623 67.066 134.687 25.154 1.00 0.00 H ATOM 67098 H11S OL 1623 66.048 135.286 26.495 1.00 0.00 H ATOM 67099 C112 OL 1623 67.953 135.037 27.095 1.00 0.00 C ATOM 67100 H12R OL 1623 68.046 136.121 27.004 1.00 0.00 H ATOM 67101 H12S OL 1623 67.600 134.768 28.093 1.00 0.00 H ATOM 67102 C113 OL 1623 69.347 134.411 26.760 1.00 0.00 C ATOM 67103 H13R OL 1623 69.391 133.328 26.895 1.00 0.00 H ATOM 67104 H13S OL 1623 69.629 134.549 25.714 1.00 0.00 H ATOM 67105 C114 OL 1623 70.507 135.036 27.542 1.00 0.00 C ATOM 67106 H14R OL 1623 70.387 136.119 27.602 1.00 0.00 H ATOM 67107 H14S OL 1623 70.392 134.680 28.569 1.00 0.00 H ATOM 67108 C115 OL 1623 71.961 134.846 27.027 1.00 0.00 C ATOM 67109 H15R OL 1623 72.150 133.778 27.156 1.00 0.00 H ATOM 67110 H15S OL 1623 72.017 134.989 25.946 1.00 0.00 H ATOM 67111 C116 OL 1623 73.140 135.457 27.863 1.00 0.00 C ATOM 67112 H16R OL 1623 73.114 136.513 28.138 1.00 0.00 H ATOM 67113 H16S OL 1623 73.191 134.886 28.793 1.00 0.00 H ATOM 67114 C117 OL 1623 74.543 135.221 27.274 1.00 0.00 C ATOM 67115 H17R OL 1623 74.601 134.265 26.749 1.00 0.00 H ATOM 67116 H17S OL 1623 74.719 136.049 26.584 1.00 0.00 H ATOM 67117 C118 OL 1623 75.626 135.069 28.276 1.00 0.00 C ATOM 67118 H18R OL 1623 75.545 135.821 29.064 1.00 0.00 H ATOM 67119 H18S OL 1623 76.562 135.134 27.718 1.00 0.00 H ATOM 67120 H18T OL 1623 75.700 134.172 28.894 1.00 0.00 H TER 67121 OL 1623 ATOM 67121 C116 PA 1624 148.339 138.669 38.397 1.00 0.00 C ATOM 67122 H16R PA 1624 149.198 139.252 38.737 1.00 0.00 H ATOM 67123 H16S PA 1624 148.503 138.390 37.354 1.00 0.00 H ATOM 67124 H16T PA 1624 148.188 137.712 38.901 1.00 0.00 H ATOM 67125 C115 PA 1624 147.020 139.408 38.473 1.00 0.00 C ATOM 67126 H15R PA 1624 146.727 139.644 39.498 1.00 0.00 H ATOM 67127 H15S PA 1624 146.283 138.659 38.173 1.00 0.00 H ATOM 67128 C114 PA 1624 147.007 140.660 37.544 1.00 0.00 C ATOM 67129 H14R PA 1624 147.813 141.206 38.040 1.00 0.00 H ATOM 67130 H14S PA 1624 146.030 141.135 37.649 1.00 0.00 H ATOM 67131 C113 PA 1624 147.423 140.446 36.042 1.00 0.00 C ATOM 67132 H13R PA 1624 146.983 139.573 35.555 1.00 0.00 H ATOM 67133 H13S PA 1624 148.506 140.315 36.008 1.00 0.00 H ATOM 67134 C112 PA 1624 147.064 141.689 35.154 1.00 0.00 C ATOM 67135 H12R PA 1624 147.531 142.569 35.601 1.00 0.00 H ATOM 67136 H12S PA 1624 145.990 141.751 35.345 1.00 0.00 H ATOM 67137 C111 PA 1624 147.288 141.581 33.661 1.00 0.00 C ATOM 67138 H11R PA 1624 146.812 140.692 33.241 1.00 0.00 H ATOM 67139 H11S PA 1624 148.333 141.291 33.533 1.00 0.00 H ATOM 67140 C110 PA 1624 147.024 142.761 32.788 1.00 0.00 C ATOM 67141 H10R PA 1624 147.579 143.624 33.161 1.00 0.00 H ATOM 67142 H10S PA 1624 146.005 143.154 32.804 1.00 0.00 H ATOM 67143 C19 PA 1624 147.565 142.491 31.397 1.00 0.00 C ATOM 67144 H9R PA 1624 147.058 141.571 31.100 1.00 0.00 H ATOM 67145 H9S PA 1624 148.637 142.287 31.392 1.00 0.00 H ATOM 67146 C18 PA 1624 147.208 143.498 30.323 1.00 0.00 C ATOM 67147 H8R PA 1624 147.703 144.467 30.422 1.00 0.00 H ATOM 67148 H8S PA 1624 146.191 143.801 30.582 1.00 0.00 H ATOM 67149 C17 PA 1624 147.256 142.928 28.963 1.00 0.00 C ATOM 67150 H7R PA 1624 146.655 142.048 28.727 1.00 0.00 H ATOM 67151 H7S PA 1624 148.240 142.588 28.634 1.00 0.00 H ATOM 67152 C16 PA 1624 146.838 143.995 27.893 1.00 0.00 C ATOM 67153 H6R PA 1624 146.895 143.573 26.888 1.00 0.00 H ATOM 67154 H6S PA 1624 147.573 144.798 27.987 1.00 0.00 H ATOM 67155 C15 PA 1624 145.379 144.485 27.877 1.00 0.00 C ATOM 67156 H5R PA 1624 145.272 145.389 27.275 1.00 0.00 H ATOM 67157 H5S PA 1624 145.037 144.708 28.890 1.00 0.00 H ATOM 67158 C14 PA 1624 144.403 143.415 27.298 1.00 0.00 C ATOM 67159 H4R PA 1624 144.525 142.560 27.966 1.00 0.00 H ATOM 67160 H4S PA 1624 144.803 143.022 26.361 1.00 0.00 H ATOM 67161 C13 PA 1624 142.908 143.743 27.119 1.00 0.00 C ATOM 67162 H3R PA 1624 142.754 144.716 26.647 1.00 0.00 H ATOM 67163 H3S PA 1624 142.527 143.888 28.132 1.00 0.00 H ATOM 67164 C12 PA 1624 142.068 142.598 26.545 1.00 0.00 C ATOM 67165 H2R PA 1624 141.040 142.890 26.769 1.00 0.00 H ATOM 67166 H2S PA 1624 142.288 141.593 26.911 1.00 0.00 H ATOM 67167 C11 PC 1625 142.309 142.546 25.045 1.00 0.00 C ATOM 67168 O12 PC 1625 143.136 141.801 24.626 1.00 0.00 O ATOM 67169 O11 PC 1625 141.524 143.368 24.375 1.00 0.00 O ATOM 67170 C1 PC 1625 141.329 143.279 22.947 1.00 0.00 C ATOM 67171 HR PC 1625 142.339 143.139 22.554 1.00 0.00 H ATOM 67172 HS PC 1625 140.931 144.272 22.721 1.00 0.00 H ATOM 67173 C2 PC 1625 140.270 142.163 22.715 1.00 0.00 C ATOM 67174 HX PC 1625 140.762 141.239 23.030 1.00 0.00 H ATOM 67175 C3 PC 1625 139.980 142.050 21.195 1.00 0.00 C ATOM 67176 HA PC 1625 139.587 143.033 20.925 1.00 0.00 H ATOM 67177 HB PC 1625 139.379 141.170 20.951 1.00 0.00 H ATOM 67178 O31 PC 1625 141.183 141.880 20.510 1.00 0.00 O ATOM 67179 P31 PC 1625 141.162 141.596 18.968 1.00 0.00 P ATOM 67180 O32 PC 1625 140.353 142.729 18.284 1.00 0.00 O ATOM 67181 C31 PC 1625 140.760 144.082 18.256 1.00 0.00 C ATOM 67182 H1A PC 1625 141.807 144.163 17.954 1.00 0.00 H ATOM 67183 H1B PC 1625 140.586 144.434 19.276 1.00 0.00 H ATOM 67184 C32 PC 1625 139.705 144.626 17.270 1.00 0.00 C ATOM 67185 H2A PC 1625 138.768 144.816 17.796 1.00 0.00 H ATOM 67186 H2B PC 1625 139.556 143.938 16.437 1.00 0.00 H ATOM 67187 N31 PC 1625 140.092 145.966 16.661 1.00 0.00 N ATOM 67188 C33 PC 1625 140.635 146.946 17.677 1.00 0.00 C ATOM 67189 H3A PC 1625 139.842 147.006 18.423 1.00 0.00 H ATOM 67190 H3B PC 1625 140.660 147.980 17.331 1.00 0.00 H ATOM 67191 H3C PC 1625 141.593 146.572 18.042 1.00 0.00 H ATOM 67192 C34 PC 1625 141.164 145.891 15.575 1.00 0.00 C ATOM 67193 H4A PC 1625 141.484 146.879 15.240 1.00 0.00 H ATOM 67194 H4B PC 1625 140.877 145.342 14.677 1.00 0.00 H ATOM 67195 H4C PC 1625 142.044 145.405 15.999 1.00 0.00 H ATOM 67196 C35 PC 1625 138.905 146.645 16.220 1.00 0.00 C ATOM 67197 H5A PC 1625 139.203 147.470 15.571 1.00 0.00 H ATOM 67198 H5B PC 1625 138.374 147.055 17.080 1.00 0.00 H ATOM 67199 H5C PC 1625 138.267 145.940 15.684 1.00 0.00 H ATOM 67200 O33 PC 1625 142.546 141.729 18.613 1.00 0.00 O ATOM 67201 O34 PC 1625 140.543 140.262 18.715 1.00 0.00 O ATOM 67202 O21 PC 1625 138.990 142.340 23.435 1.00 0.00 O ATOM 67203 C21 PC 1625 138.748 141.550 24.518 1.00 0.00 C ATOM 67204 O22 PC 1625 139.540 140.683 24.849 1.00 0.00 O ATOM 67205 C12 OL 1626 137.459 141.826 25.309 1.00 0.00 C ATOM 67206 H2R OL 1626 136.618 141.278 24.880 1.00 0.00 H ATOM 67207 H2S OL 1626 137.624 141.309 26.256 1.00 0.00 H ATOM 67208 C13 OL 1626 136.990 143.306 25.564 1.00 0.00 C ATOM 67209 H3R OL 1626 136.444 143.624 24.674 1.00 0.00 H ATOM 67210 H3S OL 1626 136.269 143.392 26.379 1.00 0.00 H ATOM 67211 C14 OL 1626 138.172 144.195 25.882 1.00 0.00 C ATOM 67212 H4R OL 1626 139.075 143.943 25.322 1.00 0.00 H ATOM 67213 H4S OL 1626 137.978 145.244 25.649 1.00 0.00 H ATOM 67214 C15 OL 1626 138.487 144.058 27.372 1.00 0.00 C ATOM 67215 H5R OL 1626 137.569 144.261 27.927 1.00 0.00 H ATOM 67216 H5S OL 1626 138.748 143.037 27.657 1.00 0.00 H ATOM 67217 C16 OL 1626 139.517 145.040 27.875 1.00 0.00 C ATOM 67218 H6R OL 1626 140.423 145.036 27.266 1.00 0.00 H ATOM 67219 H6S OL 1626 139.187 146.074 27.750 1.00 0.00 H ATOM 67220 C17 OL 1626 139.955 144.847 29.330 1.00 0.00 C ATOM 67221 H7R OL 1626 139.098 144.772 30.002 1.00 0.00 H ATOM 67222 H7S OL 1626 140.409 143.878 29.548 1.00 0.00 H ATOM 67223 C18 OL 1626 140.885 145.844 29.860 1.00 0.00 C ATOM 67224 H8R OL 1626 141.895 145.801 29.446 1.00 0.00 H ATOM 67225 H8S OL 1626 140.465 146.806 29.560 1.00 0.00 H ATOM 67226 C19 OL 1626 140.886 145.836 31.337 1.00 0.00 C ATOM 67227 H9R OL 1626 139.891 145.899 31.772 1.00 0.00 H ATOM 67228 C110 OL 1626 141.955 145.618 32.127 1.00 0.00 C ATOM 67229 H10R OL 1626 141.811 145.505 33.199 1.00 0.00 H ATOM 67230 C111 OL 1626 143.410 145.512 31.701 1.00 0.00 C ATOM 67231 H11R OL 1626 143.947 144.643 32.086 1.00 0.00 H ATOM 67232 H11S OL 1626 143.557 145.602 30.623 1.00 0.00 H ATOM 67233 C112 OL 1626 144.148 146.651 32.339 1.00 0.00 C ATOM 67234 H12R OL 1626 145.148 146.514 31.920 1.00 0.00 H ATOM 67235 H12S OL 1626 143.732 147.568 31.918 1.00 0.00 H ATOM 67236 C113 OL 1626 144.149 146.734 33.866 1.00 0.00 C ATOM 67237 H13R OL 1626 144.815 147.547 34.165 1.00 0.00 H ATOM 67238 H13S OL 1626 143.175 146.967 34.303 1.00 0.00 H ATOM 67239 C114 OL 1626 144.472 145.501 34.725 1.00 0.00 C ATOM 67240 H14R OL 1626 143.693 144.782 34.461 1.00 0.00 H ATOM 67241 H14S OL 1626 145.437 145.081 34.431 1.00 0.00 H ATOM 67242 C115 OL 1626 144.442 145.710 36.244 1.00 0.00 C ATOM 67243 H15R OL 1626 145.053 146.520 36.647 1.00 0.00 H ATOM 67244 H15S OL 1626 143.428 146.022 36.505 1.00 0.00 H ATOM 67245 C116 OL 1626 144.881 144.437 37.056 1.00 0.00 C ATOM 67246 H16R OL 1626 144.009 143.780 37.053 1.00 0.00 H ATOM 67247 H16S OL 1626 145.734 143.863 36.688 1.00 0.00 H ATOM 67248 C117 OL 1626 145.261 144.848 38.467 1.00 0.00 C ATOM 67249 H17R OL 1626 146.104 145.540 38.414 1.00 0.00 H ATOM 67250 H17S OL 1626 144.429 145.392 38.919 1.00 0.00 H ATOM 67251 C118 OL 1626 145.595 143.715 39.400 1.00 0.00 C ATOM 67252 H18R OL 1626 146.169 144.003 40.283 1.00 0.00 H ATOM 67253 H18S OL 1626 146.364 143.014 39.069 1.00 0.00 H ATOM 67254 H18T OL 1626 144.670 143.201 39.667 1.00 0.00 H TER 67255 OL 1626 ATOM 67255 C116 PA 1627 114.649 40.974 46.133 1.00 0.00 C ATOM 67256 H16R PA 1627 114.641 39.910 46.379 1.00 0.00 H ATOM 67257 H16S PA 1627 114.142 41.326 47.034 1.00 0.00 H ATOM 67258 H16T PA 1627 115.616 41.474 46.220 1.00 0.00 H ATOM 67259 C115 PA 1627 113.837 41.418 44.964 1.00 0.00 C ATOM 67260 H15R PA 1627 113.686 42.491 45.099 1.00 0.00 H ATOM 67261 H15S PA 1627 112.800 41.076 44.957 1.00 0.00 H ATOM 67262 C114 PA 1627 114.508 41.294 43.592 1.00 0.00 C ATOM 67263 H14R PA 1627 114.739 40.233 43.480 1.00 0.00 H ATOM 67264 H14S PA 1627 115.404 41.918 43.550 1.00 0.00 H ATOM 67265 C113 PA 1627 113.638 41.785 42.402 1.00 0.00 C ATOM 67266 H13R PA 1627 113.339 42.836 42.388 1.00 0.00 H ATOM 67267 H13S PA 1627 112.683 41.256 42.370 1.00 0.00 H ATOM 67268 C112 PA 1627 114.231 41.282 41.042 1.00 0.00 C ATOM 67269 H12R PA 1627 114.290 40.192 41.000 1.00 0.00 H ATOM 67270 H12S PA 1627 115.264 41.618 40.930 1.00 0.00 H ATOM 67271 C111 PA 1627 113.450 41.769 39.778 1.00 0.00 C ATOM 67272 H11R PA 1627 113.606 42.849 39.818 1.00 0.00 H ATOM 67273 H11S PA 1627 112.370 41.653 39.888 1.00 0.00 H ATOM 67274 C110 PA 1627 114.110 41.265 38.505 1.00 0.00 C ATOM 67275 H10R PA 1627 115.160 41.019 38.674 1.00 0.00 H ATOM 67276 H10S PA 1627 114.202 42.068 37.770 1.00 0.00 H ATOM 67277 C19 PA 1627 113.457 40.062 37.828 1.00 0.00 C ATOM 67278 H9R PA 1627 112.544 40.329 37.291 1.00 0.00 H ATOM 67279 H9S PA 1627 113.221 39.383 38.651 1.00 0.00 H ATOM 67280 C18 PA 1627 114.306 39.259 36.880 1.00 0.00 C ATOM 67281 H8R PA 1627 113.759 38.391 36.508 1.00 0.00 H ATOM 67282 H8S PA 1627 115.242 38.915 37.325 1.00 0.00 H ATOM 67283 C17 PA 1627 114.614 40.036 35.583 1.00 0.00 C ATOM 67284 H7R PA 1627 114.683 41.110 35.766 1.00 0.00 H ATOM 67285 H7S PA 1627 113.680 40.034 35.018 1.00 0.00 H ATOM 67286 C16 PA 1627 115.800 39.451 34.800 1.00 0.00 C ATOM 67287 H6R PA 1627 115.864 38.381 35.009 1.00 0.00 H ATOM 67288 H6S PA 1627 116.748 39.823 35.195 1.00 0.00 H ATOM 67289 C15 PA 1627 115.768 39.753 33.194 1.00 0.00 C ATOM 67290 H5R PA 1627 115.794 40.835 33.051 1.00 0.00 H ATOM 67291 H5S PA 1627 114.812 39.343 32.862 1.00 0.00 H ATOM 67292 C14 PA 1627 116.917 39.010 32.415 1.00 0.00 C ATOM 67293 H4R PA 1627 116.746 37.941 32.553 1.00 0.00 H ATOM 67294 H4S PA 1627 117.841 39.293 32.924 1.00 0.00 H ATOM 67295 C13 PA 1627 116.876 39.188 30.936 1.00 0.00 C ATOM 67296 H3R PA 1627 116.885 40.230 30.609 1.00 0.00 H ATOM 67297 H3S PA 1627 115.918 38.936 30.475 1.00 0.00 H ATOM 67298 C12 PA 1627 117.913 38.289 30.264 1.00 0.00 C ATOM 67299 H2R PA 1627 117.915 37.299 30.725 1.00 0.00 H ATOM 67300 H2S PA 1627 118.854 38.789 30.500 1.00 0.00 H ATOM 67301 C11 PC 1628 117.725 38.079 28.836 1.00 0.00 C ATOM 67302 O12 PC 1628 118.578 37.575 28.128 1.00 0.00 O ATOM 67303 O11 PC 1628 116.593 38.649 28.308 1.00 0.00 O ATOM 67304 C1 PC 1628 116.265 38.535 26.843 1.00 0.00 C ATOM 67305 HR PC 1628 116.396 37.470 26.637 1.00 0.00 H ATOM 67306 HS PC 1628 116.885 39.254 26.302 1.00 0.00 H ATOM 67307 C2 PC 1628 114.783 38.790 26.570 1.00 0.00 C ATOM 67308 HX PC 1628 114.167 37.991 26.989 1.00 0.00 H ATOM 67309 C3 PC 1628 114.402 39.019 25.087 1.00 0.00 C ATOM 67310 HA PC 1628 115.067 38.430 24.451 1.00 0.00 H ATOM 67311 HB PC 1628 114.501 40.070 24.803 1.00 0.00 H ATOM 67312 O31 PC 1628 113.069 38.672 24.906 1.00 0.00 O ATOM 67313 P31 PC 1628 112.280 38.815 23.545 1.00 0.00 P ATOM 67314 O32 PC 1628 113.175 37.941 22.597 1.00 0.00 O ATOM 67315 C31 PC 1628 113.224 36.534 22.646 1.00 0.00 C ATOM 67316 H1A PC 1628 112.971 36.173 23.646 1.00 0.00 H ATOM 67317 H1B PC 1628 114.204 36.153 22.349 1.00 0.00 H ATOM 67318 C32 PC 1628 112.232 35.949 21.661 1.00 0.00 C ATOM 67319 H2A PC 1628 111.289 36.319 22.068 1.00 0.00 H ATOM 67320 H2B PC 1628 112.247 34.868 21.809 1.00 0.00 H ATOM 67321 N31 PC 1628 112.357 36.225 20.147 1.00 0.00 N ATOM 67322 C33 PC 1628 113.815 36.748 19.833 1.00 0.00 C ATOM 67323 H3A PC 1628 113.964 37.785 20.138 1.00 0.00 H ATOM 67324 H3B PC 1628 113.853 36.780 18.743 1.00 0.00 H ATOM 67325 H3C PC 1628 114.589 36.130 20.289 1.00 0.00 H ATOM 67326 C34 PC 1628 112.235 35.094 19.181 1.00 0.00 C ATOM 67327 H4A PC 1628 111.302 34.558 19.359 1.00 0.00 H ATOM 67328 H4B PC 1628 113.186 34.560 19.180 1.00 0.00 H ATOM 67329 H4C PC 1628 112.089 35.508 18.182 1.00 0.00 H ATOM 67330 C35 PC 1628 111.404 37.297 19.751 1.00 0.00 C ATOM 67331 H5A PC 1628 111.595 37.457 18.688 1.00 0.00 H ATOM 67332 H5B PC 1628 111.462 38.130 20.454 1.00 0.00 H ATOM 67333 H5C PC 1628 110.442 36.788 19.819 1.00 0.00 H ATOM 67334 O33 PC 1628 110.889 38.236 23.509 1.00 0.00 O ATOM 67335 O34 PC 1628 112.560 40.203 23.043 1.00 0.00 O ATOM 67336 O21 PC 1628 114.390 39.933 27.320 1.00 0.00 O ATOM 67337 C21 PC 1628 115.031 41.130 27.146 1.00 0.00 C ATOM 67338 O22 PC 1628 115.907 41.375 26.312 1.00 0.00 O ATOM 67339 C12 OL 1629 114.495 42.213 28.116 1.00 0.00 C ATOM 67340 H2R OL 1629 115.158 43.076 28.025 1.00 0.00 H ATOM 67341 H2S OL 1629 113.524 42.498 27.706 1.00 0.00 H ATOM 67342 C13 OL 1629 114.404 41.888 29.611 1.00 0.00 C ATOM 67343 H3R OL 1629 113.728 41.046 29.778 1.00 0.00 H ATOM 67344 H3S OL 1629 115.371 41.645 30.056 1.00 0.00 H ATOM 67345 C14 OL 1629 113.788 43.100 30.393 1.00 0.00 C ATOM 67346 H4R OL 1629 113.756 43.928 29.681 1.00 0.00 H ATOM 67347 H4S OL 1629 112.753 42.940 30.702 1.00 0.00 H ATOM 67348 C15 OL 1629 114.487 43.591 31.615 1.00 0.00 C ATOM 67349 H5R OL 1629 114.655 42.762 32.307 1.00 0.00 H ATOM 67350 H5S OL 1629 115.509 43.835 31.317 1.00 0.00 H ATOM 67351 C16 OL 1629 113.898 44.676 32.419 1.00 0.00 C ATOM 67352 H6R OL 1629 113.826 45.594 31.831 1.00 0.00 H ATOM 67353 H6S OL 1629 112.865 44.395 32.635 1.00 0.00 H ATOM 67354 C17 OL 1629 114.684 45.057 33.659 1.00 0.00 C ATOM 67355 H7R OL 1629 115.735 45.173 33.385 1.00 0.00 H ATOM 67356 H7S OL 1629 114.340 45.996 34.099 1.00 0.00 H ATOM 67357 C18 OL 1629 114.622 44.029 34.710 1.00 0.00 C ATOM 67358 H8R OL 1629 115.045 43.114 34.291 1.00 0.00 H ATOM 67359 H8S OL 1629 115.321 44.358 35.482 1.00 0.00 H ATOM 67360 C19 OL 1629 113.291 43.825 35.320 1.00 0.00 C ATOM 67361 H9R OL 1629 112.799 42.967 34.871 1.00 0.00 H ATOM 67362 C110 OL 1629 112.750 44.288 36.473 1.00 0.00 C ATOM 67363 H10R OL 1629 111.752 43.937 36.723 1.00 0.00 H ATOM 67364 C111 OL 1629 113.289 45.360 37.340 1.00 0.00 C ATOM 67365 H11R OL 1629 113.756 45.021 38.267 1.00 0.00 H ATOM 67366 H11S OL 1629 114.047 45.911 36.780 1.00 0.00 H ATOM 67367 C112 OL 1629 112.119 46.314 37.756 1.00 0.00 C ATOM 67368 H12R OL 1629 111.434 46.449 36.916 1.00 0.00 H ATOM 67369 H12S OL 1629 111.651 45.718 38.542 1.00 0.00 H ATOM 67370 C113 OL 1629 112.557 47.677 38.148 1.00 0.00 C ATOM 67371 H13R OL 1629 113.447 47.608 38.777 1.00 0.00 H ATOM 67372 H13S OL 1629 112.825 48.168 37.210 1.00 0.00 H ATOM 67373 C114 OL 1629 111.399 48.388 38.847 1.00 0.00 C ATOM 67374 H14R OL 1629 110.480 48.276 38.268 1.00 0.00 H ATOM 67375 H14S OL 1629 111.198 47.788 39.737 1.00 0.00 H ATOM 67376 C115 OL 1629 111.717 49.856 39.187 1.00 0.00 C ATOM 67377 H15R OL 1629 112.771 49.915 39.468 1.00 0.00 H ATOM 67378 H15S OL 1629 111.633 50.424 38.258 1.00 0.00 H ATOM 67379 C116 OL 1629 110.826 50.517 40.308 1.00 0.00 C ATOM 67380 H16R OL 1629 110.486 49.866 41.117 1.00 0.00 H ATOM 67381 H16S OL 1629 111.541 51.177 40.803 1.00 0.00 H ATOM 67382 C117 OL 1629 109.692 51.335 39.761 1.00 0.00 C ATOM 67383 H17R OL 1629 110.192 52.105 39.170 1.00 0.00 H ATOM 67384 H17S OL 1629 109.054 50.798 39.057 1.00 0.00 H ATOM 67385 C118 OL 1629 108.888 51.953 40.788 1.00 0.00 C ATOM 67386 H18R OL 1629 109.352 52.789 41.314 1.00 0.00 H ATOM 67387 H18S OL 1629 108.575 51.281 41.589 1.00 0.00 H ATOM 67388 H18T OL 1629 107.932 52.224 40.334 1.00 0.00 H TER 67389 OL 1629 ATOM 67389 C116 PA 1630 106.215 122.223 42.951 1.00 0.00 C ATOM 67390 H16R PA 1630 106.908 122.904 43.448 1.00 0.00 H ATOM 67391 H16S PA 1630 106.156 121.408 43.675 1.00 0.00 H ATOM 67392 H16T PA 1630 105.250 122.726 43.041 1.00 0.00 H ATOM 67393 C115 PA 1630 106.756 122.148 41.488 1.00 0.00 C ATOM 67394 H15R PA 1630 106.257 121.358 40.923 1.00 0.00 H ATOM 67395 H15S PA 1630 107.794 121.819 41.562 1.00 0.00 H ATOM 67396 C114 PA 1630 106.693 123.443 40.733 1.00 0.00 C ATOM 67397 H14R PA 1630 106.968 124.299 41.352 1.00 0.00 H ATOM 67398 H14S PA 1630 105.692 123.769 40.444 1.00 0.00 H ATOM 67399 C113 PA 1630 107.629 123.512 39.571 1.00 0.00 C ATOM 67400 H13R PA 1630 107.578 122.578 39.008 1.00 0.00 H ATOM 67401 H13S PA 1630 108.566 123.691 40.103 1.00 0.00 H ATOM 67402 C112 PA 1630 107.368 124.707 38.574 1.00 0.00 C ATOM 67403 H12R PA 1630 107.536 125.629 39.134 1.00 0.00 H ATOM 67404 H12S PA 1630 106.287 124.761 38.430 1.00 0.00 H ATOM 67405 C111 PA 1630 108.217 124.770 37.254 1.00 0.00 C ATOM 67406 H11R PA 1630 108.108 123.941 36.553 1.00 0.00 H ATOM 67407 H11S PA 1630 109.260 124.612 37.536 1.00 0.00 H ATOM 67408 C110 PA 1630 108.150 126.191 36.628 1.00 0.00 C ATOM 67409 H10R PA 1630 108.087 126.899 37.457 1.00 0.00 H ATOM 67410 H10S PA 1630 107.132 126.140 36.237 1.00 0.00 H ATOM 67411 C19 PA 1630 109.176 126.580 35.561 1.00 0.00 C ATOM 67412 H9R PA 1630 109.900 125.842 35.210 1.00 0.00 H ATOM 67413 H9S PA 1630 109.840 127.279 36.073 1.00 0.00 H ATOM 67414 C18 PA 1630 108.564 127.442 34.493 1.00 0.00 C ATOM 67415 H8R PA 1630 109.396 128.015 34.079 1.00 0.00 H ATOM 67416 H8S PA 1630 107.789 128.130 34.836 1.00 0.00 H ATOM 67417 C17 PA 1630 107.940 126.639 33.319 1.00 0.00 C ATOM 67418 H7R PA 1630 107.012 126.158 33.635 1.00 0.00 H ATOM 67419 H7S PA 1630 108.568 125.794 33.028 1.00 0.00 H ATOM 67420 C16 PA 1630 107.832 127.520 32.158 1.00 0.00 C ATOM 67421 H6R PA 1630 108.712 128.162 32.084 1.00 0.00 H ATOM 67422 H6S PA 1630 106.958 128.128 32.404 1.00 0.00 H ATOM 67423 C15 PA 1630 107.666 126.818 30.773 1.00 0.00 C ATOM 67424 H5R PA 1630 106.934 126.035 30.985 1.00 0.00 H ATOM 67425 H5S PA 1630 108.590 126.347 30.432 1.00 0.00 H ATOM 67426 C14 PA 1630 107.044 127.696 29.742 1.00 0.00 C ATOM 67427 H4R PA 1630 107.592 128.639 29.686 1.00 0.00 H ATOM 67428 H4S PA 1630 105.977 127.890 29.870 1.00 0.00 H ATOM 67429 C13 PA 1630 107.143 127.046 28.335 1.00 0.00 C ATOM 67430 H3R PA 1630 106.776 126.018 28.334 1.00 0.00 H ATOM 67431 H3S PA 1630 108.221 126.999 28.164 1.00 0.00 H ATOM 67432 C12 PA 1630 106.541 127.923 27.233 1.00 0.00 C ATOM 67433 H2R PA 1630 106.633 128.967 27.540 1.00 0.00 H ATOM 67434 H2S PA 1630 105.482 127.717 27.067 1.00 0.00 H ATOM 67435 C11 PC 1631 107.402 127.687 25.945 1.00 0.00 C ATOM 67436 O12 PC 1631 107.936 126.618 25.658 1.00 0.00 O ATOM 67437 O11 PC 1631 107.303 128.754 25.104 1.00 0.00 O ATOM 67438 C1 PC 1631 107.914 128.630 23.744 1.00 0.00 C ATOM 67439 HR PC 1631 107.496 127.767 23.220 1.00 0.00 H ATOM 67440 HS PC 1631 108.986 128.506 23.913 1.00 0.00 H ATOM 67441 C2 PC 1631 107.469 129.885 23.032 1.00 0.00 C ATOM 67442 HX PC 1631 106.395 130.014 23.190 1.00 0.00 H ATOM 67443 C3 PC 1631 107.795 129.880 21.537 1.00 0.00 C ATOM 67444 HA PC 1631 107.191 129.069 21.120 1.00 0.00 H ATOM 67445 HB PC 1631 108.826 129.548 21.387 1.00 0.00 H ATOM 67446 O31 PC 1631 107.546 131.023 20.827 1.00 0.00 O ATOM 67447 P31 PC 1631 108.036 131.183 19.334 1.00 0.00 P ATOM 67448 O32 PC 1631 109.607 131.417 19.486 1.00 0.00 O ATOM 67449 C31 PC 1631 110.068 132.651 20.099 1.00 0.00 C ATOM 67450 H1A PC 1631 109.655 132.704 21.109 1.00 0.00 H ATOM 67451 H1B PC 1631 109.719 133.530 19.550 1.00 0.00 H ATOM 67452 C32 PC 1631 111.573 132.614 20.254 1.00 0.00 C ATOM 67453 H2A PC 1631 111.960 131.594 20.233 1.00 0.00 H ATOM 67454 H2B PC 1631 111.720 132.904 21.295 1.00 0.00 H ATOM 67455 N31 PC 1631 112.394 133.567 19.441 1.00 0.00 N ATOM 67456 C33 PC 1631 112.060 134.985 19.941 1.00 0.00 C ATOM 67457 H3A PC 1631 110.985 135.170 19.936 1.00 0.00 H ATOM 67458 H3B PC 1631 112.582 135.710 19.315 1.00 0.00 H ATOM 67459 H3C PC 1631 112.381 135.053 20.982 1.00 0.00 H ATOM 67460 C34 PC 1631 113.768 133.265 19.751 1.00 0.00 C ATOM 67461 H4A PC 1631 113.994 132.335 19.227 1.00 0.00 H ATOM 67462 H4B PC 1631 113.981 133.219 20.820 1.00 0.00 H ATOM 67463 H4C PC 1631 114.320 134.130 19.380 1.00 0.00 H ATOM 67464 C35 PC 1631 112.079 133.453 17.997 1.00 0.00 C ATOM 67465 H5A PC 1631 110.997 133.322 17.949 1.00 0.00 H ATOM 67466 H5B PC 1631 112.532 132.515 17.671 1.00 0.00 H ATOM 67467 H5C PC 1631 112.403 134.385 17.533 1.00 0.00 H ATOM 67468 O33 PC 1631 107.735 129.984 18.477 1.00 0.00 O ATOM 67469 O34 PC 1631 107.402 132.456 18.905 1.00 0.00 O ATOM 67470 O21 PC 1631 108.149 130.966 23.651 1.00 0.00 O ATOM 67471 C21 PC 1631 107.676 132.203 23.570 1.00 0.00 C ATOM 67472 O22 PC 1631 106.543 132.456 23.222 1.00 0.00 O ATOM 67473 C12 OL 1632 108.678 133.238 23.970 1.00 0.00 C ATOM 67474 H2R OL 1632 109.581 132.833 24.430 1.00 0.00 H ATOM 67475 H2S OL 1632 109.044 133.506 22.976 1.00 0.00 H ATOM 67476 C13 OL 1632 108.159 134.372 24.817 1.00 0.00 C ATOM 67477 H3R OL 1632 107.646 135.204 24.330 1.00 0.00 H ATOM 67478 H3S OL 1632 107.395 134.039 25.522 1.00 0.00 H ATOM 67479 C14 OL 1632 109.369 135.044 25.481 1.00 0.00 C ATOM 67480 H4R OL 1632 109.999 134.328 26.013 1.00 0.00 H ATOM 67481 H4S OL 1632 109.960 135.483 24.674 1.00 0.00 H ATOM 67482 C15 OL 1632 108.940 136.252 26.454 1.00 0.00 C ATOM 67483 H5R OL 1632 108.119 136.826 26.020 1.00 0.00 H ATOM 67484 H5S OL 1632 108.711 135.861 27.447 1.00 0.00 H ATOM 67485 C16 OL 1632 110.091 137.239 26.726 1.00 0.00 C ATOM 67486 H6R OL 1632 110.149 137.878 25.842 1.00 0.00 H ATOM 67487 H6S OL 1632 109.822 137.972 27.490 1.00 0.00 H ATOM 67488 C17 OL 1632 111.448 136.676 27.127 1.00 0.00 C ATOM 67489 H7R OL 1632 111.927 136.134 26.308 1.00 0.00 H ATOM 67490 H7S OL 1632 112.052 137.579 27.231 1.00 0.00 H ATOM 67491 C18 OL 1632 111.435 135.925 28.457 1.00 0.00 C ATOM 67492 H8R OL 1632 110.880 136.550 29.159 1.00 0.00 H ATOM 67493 H8S OL 1632 110.884 135.005 28.247 1.00 0.00 H ATOM 67494 C19 OL 1632 112.723 135.678 29.097 1.00 0.00 C ATOM 67495 H9R OL 1632 113.498 135.154 28.542 1.00 0.00 H ATOM 67496 C110 OL 1632 113.103 136.095 30.312 1.00 0.00 C ATOM 67497 H10R OL 1632 114.155 135.935 30.532 1.00 0.00 H ATOM 67498 C111 OL 1632 112.382 136.996 31.341 1.00 0.00 C ATOM 67499 H11R OL 1632 112.813 137.945 31.013 1.00 0.00 H ATOM 67500 H11S OL 1632 111.315 137.134 31.153 1.00 0.00 H ATOM 67501 C112 OL 1632 112.528 136.688 32.858 1.00 0.00 C ATOM 67502 H12R OL 1632 113.576 136.387 32.912 1.00 0.00 H ATOM 67503 H12S OL 1632 112.538 137.540 33.541 1.00 0.00 H ATOM 67504 C113 OL 1632 111.547 135.643 33.169 1.00 0.00 C ATOM 67505 H13R OL 1632 110.565 136.104 33.045 1.00 0.00 H ATOM 67506 H13S OL 1632 111.733 134.814 32.482 1.00 0.00 H ATOM 67507 C114 OL 1632 111.610 135.056 34.598 1.00 0.00 C ATOM 67508 H14R OL 1632 110.850 134.304 34.819 1.00 0.00 H ATOM 67509 H14S OL 1632 112.575 134.581 34.786 1.00 0.00 H ATOM 67510 C115 OL 1632 111.485 136.134 35.669 1.00 0.00 C ATOM 67511 H15R OL 1632 112.277 136.879 35.567 1.00 0.00 H ATOM 67512 H15S OL 1632 110.524 136.632 35.525 1.00 0.00 H ATOM 67513 C116 OL 1632 111.401 135.627 37.117 1.00 0.00 C ATOM 67514 H16R OL 1632 111.114 136.473 37.746 1.00 0.00 H ATOM 67515 H16S OL 1632 110.667 134.823 37.191 1.00 0.00 H ATOM 67516 C117 OL 1632 112.758 135.036 37.641 1.00 0.00 C ATOM 67517 H17R OL 1632 113.208 134.331 36.939 1.00 0.00 H ATOM 67518 H17S OL 1632 113.410 135.913 37.655 1.00 0.00 H ATOM 67519 C118 OL 1632 112.611 134.391 39.047 1.00 0.00 C ATOM 67520 H18R OL 1632 111.958 134.958 39.714 1.00 0.00 H ATOM 67521 H18S OL 1632 113.636 134.233 39.388 1.00 0.00 H ATOM 67522 H18T OL 1632 112.108 133.422 39.037 1.00 0.00 H TER 67523 OL 1632 ATOM 67523 C116 PA 1633 105.260 146.843 38.799 1.00 0.00 C ATOM 67524 H16R PA 1633 104.809 146.573 39.757 1.00 0.00 H ATOM 67525 H16S PA 1633 104.901 147.862 38.635 1.00 0.00 H ATOM 67526 H16T PA 1633 106.332 146.727 38.969 1.00 0.00 H ATOM 67527 C115 PA 1633 104.607 145.860 37.832 1.00 0.00 C ATOM 67528 H15R PA 1633 103.533 145.958 38.002 1.00 0.00 H ATOM 67529 H15S PA 1633 104.827 144.819 38.076 1.00 0.00 H ATOM 67530 C114 PA 1633 104.868 146.087 36.338 1.00 0.00 C ATOM 67531 H14R PA 1633 105.865 145.808 35.990 1.00 0.00 H ATOM 67532 H14S PA 1633 104.890 147.175 36.258 1.00 0.00 H ATOM 67533 C113 PA 1633 103.794 145.440 35.417 1.00 0.00 C ATOM 67534 H13R PA 1633 102.848 145.794 35.833 1.00 0.00 H ATOM 67535 H13S PA 1633 103.730 144.353 35.499 1.00 0.00 H ATOM 67536 C112 PA 1633 103.806 145.866 34.051 1.00 0.00 C ATOM 67537 H12R PA 1633 104.639 145.363 33.556 1.00 0.00 H ATOM 67538 H12S PA 1633 103.993 146.941 33.999 1.00 0.00 H ATOM 67539 C111 PA 1633 102.550 145.516 33.294 1.00 0.00 C ATOM 67540 H11R PA 1633 101.759 145.922 33.928 1.00 0.00 H ATOM 67541 H11S PA 1633 102.472 144.434 33.170 1.00 0.00 H ATOM 67542 C110 PA 1633 102.473 146.110 31.907 1.00 0.00 C ATOM 67543 H10R PA 1633 102.528 147.200 31.945 1.00 0.00 H ATOM 67544 H10S PA 1633 101.447 145.918 31.589 1.00 0.00 H ATOM 67545 C19 PA 1633 103.511 145.543 30.938 1.00 0.00 C ATOM 67546 H9R PA 1633 103.226 144.535 30.630 1.00 0.00 H ATOM 67547 H9S PA 1633 104.532 145.575 31.324 1.00 0.00 H ATOM 67548 C18 PA 1633 103.433 146.046 29.512 1.00 0.00 C ATOM 67549 H8R PA 1633 103.263 147.124 29.466 1.00 0.00 H ATOM 67550 H8S PA 1633 102.485 145.705 29.092 1.00 0.00 H ATOM 67551 C17 PA 1633 104.668 145.658 28.741 1.00 0.00 C ATOM 67552 H7R PA 1633 104.830 144.579 28.700 1.00 0.00 H ATOM 67553 H7S PA 1633 105.578 146.140 29.102 1.00 0.00 H ATOM 67554 C16 PA 1633 104.573 146.106 27.247 1.00 0.00 C ATOM 67555 H6R PA 1633 104.499 147.196 27.264 1.00 0.00 H ATOM 67556 H6S PA 1633 103.607 145.781 26.855 1.00 0.00 H ATOM 67557 C15 PA 1633 105.702 145.554 26.365 1.00 0.00 C ATOM 67558 H5R PA 1633 105.541 144.492 26.170 1.00 0.00 H ATOM 67559 H5S PA 1633 106.641 145.828 26.850 1.00 0.00 H ATOM 67560 C14 PA 1633 105.634 146.151 24.886 1.00 0.00 C ATOM 67561 H4R PA 1633 104.921 146.974 24.805 1.00 0.00 H ATOM 67562 H4S PA 1633 105.280 145.291 24.312 1.00 0.00 H ATOM 67563 C13 PA 1633 107.020 146.335 24.300 1.00 0.00 C ATOM 67564 H3R PA 1633 107.564 145.397 24.169 1.00 0.00 H ATOM 67565 H3S PA 1633 107.501 146.914 25.091 1.00 0.00 H ATOM 67566 C12 PA 1633 107.185 147.040 22.952 1.00 0.00 C ATOM 67567 H2R PA 1633 107.043 148.091 23.214 1.00 0.00 H ATOM 67568 H2S PA 1633 106.367 146.650 22.342 1.00 0.00 H ATOM 67569 C11 PGR 1634 108.557 146.779 22.350 1.00 0.00 C ATOM 67570 O12 PGR 1634 109.392 147.598 22.476 1.00 0.00 O ATOM 67571 O11 PGR 1634 108.638 145.611 21.634 1.00 0.00 O ATOM 67572 C1 PGR 1634 109.815 145.282 20.910 1.00 0.00 C ATOM 67573 HR PGR 1634 110.154 146.049 20.210 1.00 0.00 H ATOM 67574 HS PGR 1634 109.505 144.378 20.379 1.00 0.00 H ATOM 67575 C2 PGR 1634 111.080 144.855 21.737 1.00 0.00 C ATOM 67576 HX PGR 1634 111.579 145.716 22.190 1.00 0.00 H ATOM 67577 C3 PGR 1634 112.116 144.058 20.869 1.00 0.00 C ATOM 67578 HA PGR 1634 111.634 143.233 20.339 1.00 0.00 H ATOM 67579 HB PGR 1634 112.882 143.628 21.518 1.00 0.00 H ATOM 67580 O31 PGR 1634 112.940 144.876 19.983 1.00 0.00 O ATOM 67581 P31 PGR 1634 113.852 144.132 18.899 1.00 0.00 P ATOM 67582 O32 PGR 1634 112.842 143.260 18.063 1.00 0.00 O ATOM 67583 C31 PGR 1634 113.277 142.383 17.092 1.00 0.00 C ATOM 67584 H1A PGR 1634 113.882 141.554 17.466 1.00 0.00 H ATOM 67585 H1B PGR 1634 113.876 143.025 16.441 1.00 0.00 H ATOM 67586 C32 PGR 1634 112.023 141.761 16.445 1.00 0.00 C ATOM 67587 H2A PGR 1634 112.350 140.755 16.172 1.00 0.00 H ATOM 67588 O35 PGR 1634 111.613 142.509 15.229 1.00 0.00 O ATOM 67589 HO5A PGR 1634 112.304 142.226 14.603 1.00 0.00 H ATOM 67590 C33 PGR 1634 110.849 141.525 17.452 1.00 0.00 C ATOM 67591 H3A PGR 1634 110.098 140.881 16.988 1.00 0.00 H ATOM 67592 H3B PGR 1634 111.158 140.880 18.278 1.00 0.00 H ATOM 67593 O33 PGR 1634 114.456 145.101 17.971 1.00 0.00 O ATOM 67594 O34 PGR 1634 114.687 143.129 19.599 1.00 0.00 O ATOM 67595 O21 PGR 1634 110.633 143.937 22.737 1.00 0.00 O ATOM 67596 C21 PGR 1634 111.411 143.629 23.827 1.00 0.00 C ATOM 67597 O22 PGR 1634 112.550 143.909 24.001 1.00 0.00 O ATOM 67598 O36 PGR 1634 110.311 142.734 17.900 1.00 0.00 O ATOM 67599 HO6A PGR 1634 110.978 143.444 17.893 1.00 0.00 H ATOM 67600 C12 OL 1635 110.605 142.920 24.880 1.00 0.00 C ATOM 67601 H2R OL 1635 111.300 142.153 25.228 1.00 0.00 H ATOM 67602 H2S OL 1635 110.672 143.631 25.706 1.00 0.00 H ATOM 67603 C13 OL 1635 109.275 142.282 24.499 1.00 0.00 C ATOM 67604 H3R OL 1635 108.735 143.027 23.912 1.00 0.00 H ATOM 67605 H3S OL 1635 109.375 141.483 23.761 1.00 0.00 H ATOM 67606 C14 OL 1635 108.455 141.840 25.778 1.00 0.00 C ATOM 67607 H4R OL 1635 107.991 142.666 26.321 1.00 0.00 H ATOM 67608 H4S OL 1635 107.614 141.196 25.510 1.00 0.00 H ATOM 67609 C15 OL 1635 109.280 140.941 26.709 1.00 0.00 C ATOM 67610 H5R OL 1635 109.927 140.245 26.171 1.00 0.00 H ATOM 67611 H5S OL 1635 110.070 141.574 27.118 1.00 0.00 H ATOM 67612 C16 OL 1635 108.408 140.273 27.802 1.00 0.00 C ATOM 67613 H6R OL 1635 107.732 139.512 27.406 1.00 0.00 H ATOM 67614 H6S OL 1635 109.088 139.792 28.509 1.00 0.00 H ATOM 67615 C17 OL 1635 107.540 141.248 28.579 1.00 0.00 C ATOM 67616 H7R OL 1635 108.036 142.158 28.924 1.00 0.00 H ATOM 67617 H7S OL 1635 106.831 141.664 27.860 1.00 0.00 H ATOM 67618 C18 OL 1635 106.911 140.599 29.794 1.00 0.00 C ATOM 67619 H8R OL 1635 107.587 140.400 30.629 1.00 0.00 H ATOM 67620 H8S OL 1635 106.302 141.418 30.182 1.00 0.00 H ATOM 67621 C19 OL 1635 106.070 139.401 29.484 1.00 0.00 C ATOM 67622 H9R OL 1635 105.951 139.174 28.427 1.00 0.00 H ATOM 67623 C110 OL 1635 105.698 138.437 30.291 1.00 0.00 C ATOM 67624 H10R OL 1635 105.237 137.560 29.845 1.00 0.00 H ATOM 67625 C111 OL 1635 105.842 138.522 31.790 1.00 0.00 C ATOM 67626 H11R OL 1635 106.092 139.574 31.937 1.00 0.00 H ATOM 67627 H11S OL 1635 104.801 138.507 32.122 1.00 0.00 H ATOM 67628 C112 OL 1635 106.633 137.489 32.502 1.00 0.00 C ATOM 67629 H12R OL 1635 106.377 136.509 32.095 1.00 0.00 H ATOM 67630 H12S OL 1635 107.688 137.525 32.223 1.00 0.00 H ATOM 67631 C113 OL 1635 106.410 137.493 33.955 1.00 0.00 C ATOM 67632 H13R OL 1635 106.562 138.549 34.186 1.00 0.00 H ATOM 67633 H13S OL 1635 105.351 137.294 34.135 1.00 0.00 H ATOM 67634 C114 OL 1635 107.139 136.510 34.926 1.00 0.00 C ATOM 67635 H14R OL 1635 108.222 136.487 34.789 1.00 0.00 H ATOM 67636 H14S OL 1635 106.974 136.822 35.959 1.00 0.00 H ATOM 67637 C115 OL 1635 106.845 135.014 34.855 1.00 0.00 C ATOM 67638 H15R OL 1635 107.154 134.686 33.861 1.00 0.00 H ATOM 67639 H15S OL 1635 107.489 134.548 35.604 1.00 0.00 H ATOM 67640 C116 OL 1635 105.398 134.529 34.991 1.00 0.00 C ATOM 67641 H16R OL 1635 104.907 134.780 35.934 1.00 0.00 H ATOM 67642 H16S OL 1635 104.742 134.825 34.170 1.00 0.00 H ATOM 67643 C117 OL 1635 105.213 132.936 35.065 1.00 0.00 C ATOM 67644 H17R OL 1635 104.190 132.559 35.128 1.00 0.00 H ATOM 67645 H17S OL 1635 105.623 132.527 34.139 1.00 0.00 H ATOM 67646 C118 OL 1635 106.059 132.370 36.179 1.00 0.00 C ATOM 67647 H18R OL 1635 106.098 131.288 36.319 1.00 0.00 H ATOM 67648 H18S OL 1635 105.649 132.771 37.108 1.00 0.00 H ATOM 67649 H18T OL 1635 107.120 132.632 36.187 1.00 0.00 H TER 67650 OL 1635 ATOM 67650 C116 PA 1636 137.006 34.035 38.352 1.00 0.00 C ATOM 67651 H16R PA 1636 136.577 33.112 38.747 1.00 0.00 H ATOM 67652 H16S PA 1636 136.186 34.597 37.901 1.00 0.00 H ATOM 67653 H16T PA 1636 137.408 34.533 39.237 1.00 0.00 H ATOM 67654 C115 PA 1636 138.075 33.764 37.321 1.00 0.00 C ATOM 67655 H15R PA 1636 138.989 33.295 37.692 1.00 0.00 H ATOM 67656 H15S PA 1636 138.453 34.703 36.911 1.00 0.00 H ATOM 67657 C114 PA 1636 137.570 32.837 36.258 1.00 0.00 C ATOM 67658 H14R PA 1636 137.259 31.848 36.599 1.00 0.00 H ATOM 67659 H14S PA 1636 138.479 32.524 35.741 1.00 0.00 H ATOM 67660 C113 PA 1636 136.490 33.464 35.302 1.00 0.00 C ATOM 67661 H13R PA 1636 136.644 34.505 35.012 1.00 0.00 H ATOM 67662 H13S PA 1636 135.549 33.396 35.852 1.00 0.00 H ATOM 67663 C112 PA 1636 136.216 32.667 33.997 1.00 0.00 C ATOM 67664 H12R PA 1636 135.249 32.701 33.492 1.00 0.00 H ATOM 67665 H12S PA 1636 136.191 31.611 34.274 1.00 0.00 H ATOM 67666 C111 PA 1636 137.294 32.827 32.923 1.00 0.00 C ATOM 67667 H11R PA 1636 138.306 32.848 33.333 1.00 0.00 H ATOM 67668 H11S PA 1636 137.235 33.838 32.516 1.00 0.00 H ATOM 67669 C110 PA 1636 137.304 31.814 31.718 1.00 0.00 C ATOM 67670 H10R PA 1636 136.526 32.140 31.025 1.00 0.00 H ATOM 67671 H10S PA 1636 137.183 30.809 32.128 1.00 0.00 H ATOM 67672 C19 PA 1636 138.680 31.728 31.028 1.00 0.00 C ATOM 67673 H9R PA 1636 139.483 31.491 31.729 1.00 0.00 H ATOM 67674 H9S PA 1636 138.824 32.773 30.747 1.00 0.00 H ATOM 67675 C18 PA 1636 138.803 30.736 29.809 1.00 0.00 C ATOM 67676 H8R PA 1636 138.868 29.750 30.274 1.00 0.00 H ATOM 67677 H8S PA 1636 139.822 30.877 29.444 1.00 0.00 H ATOM 67678 C17 PA 1636 137.913 31.004 28.636 1.00 0.00 C ATOM 67679 H7R PA 1636 138.038 31.977 28.155 1.00 0.00 H ATOM 67680 H7S PA 1636 136.930 31.220 29.060 1.00 0.00 H ATOM 67681 C16 PA 1636 137.956 29.754 27.702 1.00 0.00 C ATOM 67682 H6R PA 1636 137.539 28.962 28.328 1.00 0.00 H ATOM 67683 H6S PA 1636 138.933 29.401 27.366 1.00 0.00 H ATOM 67684 C15 PA 1636 137.117 29.941 26.420 1.00 0.00 C ATOM 67685 H5R PA 1636 137.155 30.997 26.143 1.00 0.00 H ATOM 67686 H5S PA 1636 136.114 29.626 26.716 1.00 0.00 H ATOM 67687 C14 PA 1636 137.501 29.013 25.355 1.00 0.00 C ATOM 67688 H4R PA 1636 137.759 28.055 25.811 1.00 0.00 H ATOM 67689 H4S PA 1636 138.422 29.346 24.871 1.00 0.00 H ATOM 67690 C13 PA 1636 136.401 29.041 24.228 1.00 0.00 C ATOM 67691 H3R PA 1636 136.775 28.367 23.454 1.00 0.00 H ATOM 67692 H3S PA 1636 136.340 29.950 23.625 1.00 0.00 H ATOM 67693 C12 PA 1636 135.067 28.538 24.557 1.00 0.00 C ATOM 67694 H2R PA 1636 134.469 29.242 25.139 1.00 0.00 H ATOM 67695 H2S PA 1636 135.121 27.630 25.160 1.00 0.00 H ATOM 67696 C11 PGR 1637 134.356 28.101 23.312 1.00 0.00 C ATOM 67697 O12 PGR 1637 134.622 27.107 22.650 1.00 0.00 O ATOM 67698 O11 PGR 1637 133.373 28.951 22.910 1.00 0.00 O ATOM 67699 C1 PGR 1637 132.606 28.650 21.716 1.00 0.00 C ATOM 67700 HR PGR 1637 133.200 28.400 20.833 1.00 0.00 H ATOM 67701 HS PGR 1637 132.023 29.520 21.403 1.00 0.00 H ATOM 67702 C2 PGR 1637 131.559 27.557 22.119 1.00 0.00 C ATOM 67703 HX PGR 1637 132.096 26.684 22.499 1.00 0.00 H ATOM 67704 C3 PGR 1637 130.649 27.113 21.002 1.00 0.00 C ATOM 67705 HA PGR 1637 130.408 26.056 21.140 1.00 0.00 H ATOM 67706 HB PGR 1637 131.225 27.225 20.080 1.00 0.00 H ATOM 67707 O31 PGR 1637 129.517 27.979 20.866 1.00 0.00 O ATOM 67708 P31 PGR 1637 128.441 27.826 19.680 1.00 0.00 P ATOM 67709 O32 PGR 1637 128.899 28.975 18.642 1.00 0.00 O ATOM 67710 C31 PGR 1637 129.874 28.661 17.703 1.00 0.00 C ATOM 67711 H1A PGR 1637 129.456 28.056 16.894 1.00 0.00 H ATOM 67712 H1B PGR 1637 130.724 28.162 18.176 1.00 0.00 H ATOM 67713 C32 PGR 1637 130.451 30.011 17.217 1.00 0.00 C ATOM 67714 H2A PGR 1637 130.490 30.752 18.019 1.00 0.00 H ATOM 67715 O35 PGR 1637 129.582 30.553 16.214 1.00 0.00 O ATOM 67716 HO5A PGR 1637 128.696 30.207 16.426 1.00 0.00 H ATOM 67717 C33 PGR 1637 131.835 29.874 16.525 1.00 0.00 C ATOM 67718 H3A PGR 1637 132.149 30.825 16.088 1.00 0.00 H ATOM 67719 H3B PGR 1637 132.542 29.593 17.309 1.00 0.00 H ATOM 67720 O33 PGR 1637 128.527 26.459 19.106 1.00 0.00 O ATOM 67721 O34 PGR 1637 127.151 28.305 20.240 1.00 0.00 O ATOM 67722 O21 PGR 1637 130.748 28.203 23.149 1.00 0.00 O ATOM 67723 C21 PGR 1637 129.894 27.464 23.876 1.00 0.00 C ATOM 67724 O22 PGR 1637 129.791 26.258 23.745 1.00 0.00 O ATOM 67725 O36 PGR 1637 131.691 28.873 15.496 1.00 0.00 O ATOM 67726 HO6A PGR 1637 132.548 28.447 15.313 1.00 0.00 H ATOM 67727 C12 OL 1638 129.185 28.346 24.862 1.00 0.00 C ATOM 67728 H2R OL 1638 128.923 29.236 24.286 1.00 0.00 H ATOM 67729 H2S OL 1638 128.251 27.952 25.266 1.00 0.00 H ATOM 67730 C13 OL 1638 130.171 28.728 25.900 1.00 0.00 C ATOM 67731 H3R OL 1638 130.885 29.320 25.324 1.00 0.00 H ATOM 67732 H3S OL 1638 129.674 29.325 26.667 1.00 0.00 H ATOM 67733 C14 OL 1638 130.959 27.572 26.553 1.00 0.00 C ATOM 67734 H4R OL 1638 130.238 26.931 27.065 1.00 0.00 H ATOM 67735 H4S OL 1638 131.379 26.932 25.774 1.00 0.00 H ATOM 67736 C15 OL 1638 132.149 27.942 27.402 1.00 0.00 C ATOM 67737 H5R OL 1638 132.660 27.055 27.782 1.00 0.00 H ATOM 67738 H5S OL 1638 132.915 28.340 26.733 1.00 0.00 H ATOM 67739 C16 OL 1638 131.827 28.814 28.621 1.00 0.00 C ATOM 67740 H6R OL 1638 131.614 29.838 28.306 1.00 0.00 H ATOM 67741 H6S OL 1638 130.935 28.578 29.205 1.00 0.00 H ATOM 67742 C17 OL 1638 133.031 29.005 29.547 1.00 0.00 C ATOM 67743 H7R OL 1638 133.206 28.094 30.123 1.00 0.00 H ATOM 67744 H7S OL 1638 133.920 29.093 28.919 1.00 0.00 H ATOM 67745 C18 OL 1638 132.839 30.126 30.578 1.00 0.00 C ATOM 67746 H8R OL 1638 132.636 31.094 30.115 1.00 0.00 H ATOM 67747 H8S OL 1638 131.899 29.999 31.119 1.00 0.00 H ATOM 67748 C19 OL 1638 134.125 30.213 31.464 1.00 0.00 C ATOM 67749 H9R OL 1638 134.898 30.844 31.034 1.00 0.00 H ATOM 67750 C110 OL 1638 134.290 29.706 32.723 1.00 0.00 C ATOM 67751 H10R OL 1638 135.283 29.859 33.138 1.00 0.00 H ATOM 67752 C111 OL 1638 133.232 29.001 33.530 1.00 0.00 C ATOM 67753 H11R OL 1638 132.244 28.948 33.068 1.00 0.00 H ATOM 67754 H11S OL 1638 133.542 27.966 33.688 1.00 0.00 H ATOM 67755 C112 OL 1638 133.143 29.355 34.997 1.00 0.00 C ATOM 67756 H12R OL 1638 133.267 30.412 35.244 1.00 0.00 H ATOM 67757 H12S OL 1638 132.129 29.254 35.390 1.00 0.00 H ATOM 67758 C113 OL 1638 134.057 28.440 35.845 1.00 0.00 C ATOM 67759 H13R OL 1638 133.631 28.468 36.850 1.00 0.00 H ATOM 67760 H13S OL 1638 133.910 27.395 35.567 1.00 0.00 H ATOM 67761 C114 OL 1638 135.513 28.818 35.791 1.00 0.00 C ATOM 67762 H14R OL 1638 135.910 28.499 34.826 1.00 0.00 H ATOM 67763 H14S OL 1638 135.679 29.897 35.821 1.00 0.00 H ATOM 67764 C115 OL 1638 136.324 28.136 36.957 1.00 0.00 C ATOM 67765 H15R OL 1638 136.216 28.500 37.981 1.00 0.00 H ATOM 67766 H15S OL 1638 135.811 27.195 37.165 1.00 0.00 H ATOM 67767 C116 OL 1638 137.779 27.860 36.709 1.00 0.00 C ATOM 67768 H16R OL 1638 138.295 27.376 37.541 1.00 0.00 H ATOM 67769 H16S OL 1638 137.948 27.231 35.833 1.00 0.00 H ATOM 67770 C117 OL 1638 138.697 28.989 36.493 1.00 0.00 C ATOM 67771 H17R OL 1638 139.688 28.624 36.216 1.00 0.00 H ATOM 67772 H17S OL 1638 138.354 29.653 35.696 1.00 0.00 H ATOM 67773 C118 OL 1638 138.785 29.908 37.750 1.00 0.00 C ATOM 67774 H18R OL 1638 137.814 30.180 38.168 1.00 0.00 H ATOM 67775 H18S OL 1638 139.317 30.848 37.589 1.00 0.00 H ATOM 67776 H18T OL 1638 139.412 29.350 38.449 1.00 0.00 H TER 67777 OL 1638 ATOM 67777 C116 PA 1639 67.901 15.722 46.673 1.00 0.00 C ATOM 67778 H16R PA 1639 67.018 16.123 46.171 1.00 0.00 H ATOM 67779 H16S PA 1639 68.583 16.484 47.056 1.00 0.00 H ATOM 67780 H16T PA 1639 67.653 15.114 47.545 1.00 0.00 H ATOM 67781 C115 PA 1639 68.830 14.837 45.852 1.00 0.00 C ATOM 67782 H15R PA 1639 69.460 14.381 46.618 1.00 0.00 H ATOM 67783 H15S PA 1639 69.491 15.421 45.208 1.00 0.00 H ATOM 67784 C114 PA 1639 67.989 13.780 45.124 1.00 0.00 C ATOM 67785 H14R PA 1639 67.153 13.380 45.702 1.00 0.00 H ATOM 67786 H14S PA 1639 68.731 12.980 45.066 1.00 0.00 H ATOM 67787 C113 PA 1639 67.447 14.132 43.666 1.00 0.00 C ATOM 67788 H13R PA 1639 68.344 14.325 43.074 1.00 0.00 H ATOM 67789 H13S PA 1639 66.839 15.019 43.858 1.00 0.00 H ATOM 67790 C112 PA 1639 66.636 13.031 43.040 1.00 0.00 C ATOM 67791 H12R PA 1639 65.831 12.762 43.727 1.00 0.00 H ATOM 67792 H12S PA 1639 67.269 12.141 43.024 1.00 0.00 H ATOM 67793 C111 PA 1639 65.949 13.374 41.723 1.00 0.00 C ATOM 67794 H11R PA 1639 66.675 13.522 40.921 1.00 0.00 H ATOM 67795 H11S PA 1639 65.538 14.371 41.893 1.00 0.00 H ATOM 67796 C110 PA 1639 64.997 12.321 41.243 1.00 0.00 C ATOM 67797 H10R PA 1639 64.618 12.697 40.290 1.00 0.00 H ATOM 67798 H10S PA 1639 64.100 12.292 41.865 1.00 0.00 H ATOM 67799 C19 PA 1639 65.550 10.957 41.159 1.00 0.00 C ATOM 67800 H9R PA 1639 64.854 10.189 40.815 1.00 0.00 H ATOM 67801 H9S PA 1639 65.683 10.715 42.215 1.00 0.00 H ATOM 67802 C18 PA 1639 66.922 10.786 40.397 1.00 0.00 C ATOM 67803 H8R PA 1639 67.359 9.860 40.777 1.00 0.00 H ATOM 67804 H8S PA 1639 67.730 11.472 40.660 1.00 0.00 H ATOM 67805 C17 PA 1639 66.703 10.854 38.890 1.00 0.00 C ATOM 67806 H7R PA 1639 66.435 11.868 38.585 1.00 0.00 H ATOM 67807 H7S PA 1639 65.899 10.183 38.581 1.00 0.00 H ATOM 67808 C16 PA 1639 68.046 10.651 38.074 1.00 0.00 C ATOM 67809 H6R PA 1639 68.520 9.695 38.306 1.00 0.00 H ATOM 67810 H6S PA 1639 68.686 11.506 38.301 1.00 0.00 H ATOM 67811 C15 PA 1639 67.769 10.613 36.506 1.00 0.00 C ATOM 67812 H5R PA 1639 67.331 11.541 36.132 1.00 0.00 H ATOM 67813 H5S PA 1639 66.990 9.868 36.327 1.00 0.00 H ATOM 67814 C14 PA 1639 69.118 10.410 35.737 1.00 0.00 C ATOM 67815 H4R PA 1639 69.692 9.601 36.193 1.00 0.00 H ATOM 67816 H4S PA 1639 69.668 11.335 35.924 1.00 0.00 H ATOM 67817 C13 PA 1639 68.982 10.125 34.171 1.00 0.00 C ATOM 67818 H3R PA 1639 68.448 9.179 34.056 1.00 0.00 H ATOM 67819 H3S PA 1639 69.983 10.039 33.744 1.00 0.00 H ATOM 67820 C12 PA 1639 68.259 11.220 33.392 1.00 0.00 C ATOM 67821 H2R PA 1639 68.707 12.197 33.585 1.00 0.00 H ATOM 67822 H2S PA 1639 67.229 11.245 33.755 1.00 0.00 H ATOM 67823 C11 PC 1640 68.281 10.863 31.949 1.00 0.00 C ATOM 67824 O12 PC 1640 67.802 9.908 31.419 1.00 0.00 O ATOM 67825 O11 PC 1640 69.057 11.758 31.255 1.00 0.00 O ATOM 67826 C1 PC 1640 68.863 11.725 29.835 1.00 0.00 C ATOM 67827 HR PC 1640 67.831 11.895 29.519 1.00 0.00 H ATOM 67828 HS PC 1640 69.140 10.743 29.444 1.00 0.00 H ATOM 67829 C2 PC 1640 69.804 12.754 29.305 1.00 0.00 C ATOM 67830 HX PC 1640 69.571 13.706 29.789 1.00 0.00 H ATOM 67831 C3 PC 1640 69.584 12.986 27.749 1.00 0.00 C ATOM 67832 HA PC 1640 70.421 13.436 27.210 1.00 0.00 H ATOM 67833 HB PC 1640 68.685 13.584 27.579 1.00 0.00 H ATOM 67834 O31 PC 1640 69.230 11.731 27.129 1.00 0.00 O ATOM 67835 P31 PC 1640 68.294 11.733 25.896 1.00 0.00 P ATOM 67836 O32 PC 1640 68.967 10.658 24.935 1.00 0.00 O ATOM 67837 C31 PC 1640 68.896 9.208 25.202 1.00 0.00 C ATOM 67838 H1A PC 1640 67.863 9.002 25.493 1.00 0.00 H ATOM 67839 H1B PC 1640 69.531 8.962 26.057 1.00 0.00 H ATOM 67840 C32 PC 1640 69.403 8.486 23.975 1.00 0.00 C ATOM 67841 H2A PC 1640 70.141 9.116 23.476 1.00 0.00 H ATOM 67842 H2B PC 1640 68.678 8.404 23.163 1.00 0.00 H ATOM 67843 N31 PC 1640 70.018 7.151 24.146 1.00 0.00 N ATOM 67844 C33 PC 1640 71.305 7.209 24.868 1.00 0.00 C ATOM 67845 H3A PC 1640 71.012 7.356 25.908 1.00 0.00 H ATOM 67846 H3B PC 1640 71.965 7.976 24.459 1.00 0.00 H ATOM 67847 H3C PC 1640 71.822 6.249 24.897 1.00 0.00 H ATOM 67848 C34 PC 1640 69.151 6.311 24.916 1.00 0.00 C ATOM 67849 H4A PC 1640 68.849 6.907 25.778 1.00 0.00 H ATOM 67850 H4B PC 1640 69.725 5.455 25.274 1.00 0.00 H ATOM 67851 H4C PC 1640 68.355 5.926 24.277 1.00 0.00 H ATOM 67852 C35 PC 1640 70.291 6.500 22.815 1.00 0.00 C ATOM 67853 H5A PC 1640 70.609 5.465 22.953 1.00 0.00 H ATOM 67854 H5B PC 1640 71.014 7.158 22.330 1.00 0.00 H ATOM 67855 H5C PC 1640 69.377 6.523 22.220 1.00 0.00 H ATOM 67856 O33 PC 1640 66.977 11.282 26.272 1.00 0.00 O ATOM 67857 O34 PC 1640 68.481 12.982 25.135 1.00 0.00 O ATOM 67858 O21 PC 1640 71.195 12.304 29.582 1.00 0.00 O ATOM 67859 C21 PC 1640 72.131 13.285 29.624 1.00 0.00 C ATOM 67860 O22 PC 1640 71.898 14.403 29.310 1.00 0.00 O ATOM 67861 C12 OL 1641 73.494 12.858 30.000 1.00 0.00 C ATOM 67862 H2R OL 1641 73.415 11.783 30.175 1.00 0.00 H ATOM 67863 H2S OL 1641 74.289 12.998 29.265 1.00 0.00 H ATOM 67864 C13 OL 1641 73.812 13.405 31.351 1.00 0.00 C ATOM 67865 H3R OL 1641 73.116 12.906 32.029 1.00 0.00 H ATOM 67866 H3S OL 1641 74.815 13.028 31.563 1.00 0.00 H ATOM 67867 C14 OL 1641 73.820 14.912 31.578 1.00 0.00 C ATOM 67868 H4R OL 1641 74.424 15.344 30.777 1.00 0.00 H ATOM 67869 H4S OL 1641 72.769 15.194 31.491 1.00 0.00 H ATOM 67870 C15 OL 1641 74.347 15.341 32.931 1.00 0.00 C ATOM 67871 H5R OL 1641 73.794 14.796 33.699 1.00 0.00 H ATOM 67872 H5S OL 1641 75.360 14.967 33.090 1.00 0.00 H ATOM 67873 C16 OL 1641 74.318 16.873 33.099 1.00 0.00 C ATOM 67874 H6R OL 1641 74.962 17.300 32.328 1.00 0.00 H ATOM 67875 H6S OL 1641 73.344 17.342 32.946 1.00 0.00 H ATOM 67876 C17 OL 1641 74.956 17.243 34.482 1.00 0.00 C ATOM 67877 H7R OL 1641 74.426 16.841 35.348 1.00 0.00 H ATOM 67878 H7S OL 1641 75.933 16.759 34.434 1.00 0.00 H ATOM 67879 C18 OL 1641 75.205 18.763 34.709 1.00 0.00 C ATOM 67880 H8R OL 1641 74.527 19.342 34.078 1.00 0.00 H ATOM 67881 H8S OL 1641 74.868 19.099 35.692 1.00 0.00 H ATOM 67882 C19 OL 1641 76.613 19.188 34.416 1.00 0.00 C ATOM 67883 H9R OL 1641 76.931 19.230 33.378 1.00 0.00 H ATOM 67884 C110 OL 1641 77.586 19.258 35.290 1.00 0.00 C ATOM 67885 H10R OL 1641 78.521 19.443 34.767 1.00 0.00 H ATOM 67886 C111 OL 1641 77.645 19.173 36.808 1.00 0.00 C ATOM 67887 H11R OL 1641 77.800 20.155 37.259 1.00 0.00 H ATOM 67888 H11S OL 1641 76.677 18.890 37.227 1.00 0.00 H ATOM 67889 C112 OL 1641 78.749 18.183 37.194 1.00 0.00 C ATOM 67890 H12R OL 1641 78.634 17.266 36.613 1.00 0.00 H ATOM 67891 H12S OL 1641 79.704 18.543 36.807 1.00 0.00 H ATOM 67892 C113 OL 1641 78.879 17.911 38.622 1.00 0.00 C ATOM 67893 H13R OL 1641 79.808 17.341 38.700 1.00 0.00 H ATOM 67894 H13S OL 1641 78.982 18.825 39.210 1.00 0.00 H ATOM 67895 C114 OL 1641 77.875 17.028 39.349 1.00 0.00 C ATOM 67896 H14R OL 1641 78.181 16.744 40.358 1.00 0.00 H ATOM 67897 H14S OL 1641 76.924 17.562 39.410 1.00 0.00 H ATOM 67898 C115 OL 1641 77.534 15.731 38.568 1.00 0.00 C ATOM 67899 H15R OL 1641 76.928 15.999 37.700 1.00 0.00 H ATOM 67900 H15S OL 1641 78.351 15.097 38.218 1.00 0.00 H ATOM 67901 C116 OL 1641 76.678 14.756 39.366 1.00 0.00 C ATOM 67902 H16R OL 1641 76.849 13.783 38.900 1.00 0.00 H ATOM 67903 H16S OL 1641 77.005 14.697 40.406 1.00 0.00 H ATOM 67904 C117 OL 1641 75.190 15.067 39.183 1.00 0.00 C ATOM 67905 H17R OL 1641 74.836 16.067 39.443 1.00 0.00 H ATOM 67906 H17S OL 1641 74.894 15.032 38.132 1.00 0.00 H ATOM 67907 C118 OL 1641 74.391 14.046 40.042 1.00 0.00 C ATOM 67908 H18R OL 1641 74.695 14.223 41.075 1.00 0.00 H ATOM 67909 H18S OL 1641 74.666 13.029 39.753 1.00 0.00 H ATOM 67910 H18T OL 1641 73.303 14.133 40.052 1.00 0.00 H TER 67911 OL 1641 ATOM 67911 C116 PA 1642 39.581 121.191 24.270 1.00 0.00 C ATOM 67912 H16R PA 1642 38.990 122.084 24.053 1.00 0.00 H ATOM 67913 H16S PA 1642 38.993 120.296 24.057 1.00 0.00 H ATOM 67914 H16T PA 1642 40.427 121.244 23.583 1.00 0.00 H ATOM 67915 C115 PA 1642 40.099 121.258 25.657 1.00 0.00 C ATOM 67916 H15R PA 1642 41.003 121.852 25.805 1.00 0.00 H ATOM 67917 H15S PA 1642 40.531 120.297 25.944 1.00 0.00 H ATOM 67918 C114 PA 1642 39.063 121.759 26.618 1.00 0.00 C ATOM 67919 H14R PA 1642 38.275 121.005 26.670 1.00 0.00 H ATOM 67920 H14S PA 1642 38.773 122.758 26.287 1.00 0.00 H ATOM 67921 C113 PA 1642 39.597 121.827 28.094 1.00 0.00 C ATOM 67922 H13R PA 1642 40.545 122.348 27.945 1.00 0.00 H ATOM 67923 H13S PA 1642 39.880 120.808 28.364 1.00 0.00 H ATOM 67924 C112 PA 1642 38.741 122.425 29.210 1.00 0.00 C ATOM 67925 H12R PA 1642 39.451 122.546 30.031 1.00 0.00 H ATOM 67926 H12S PA 1642 38.077 121.620 29.529 1.00 0.00 H ATOM 67927 C111 PA 1642 38.091 123.691 28.883 1.00 0.00 C ATOM 67928 H11R PA 1642 37.403 123.382 28.093 1.00 0.00 H ATOM 67929 H11S PA 1642 38.876 124.303 28.434 1.00 0.00 H ATOM 67930 C110 PA 1642 37.193 124.389 29.910 1.00 0.00 C ATOM 67931 H10R PA 1642 37.592 124.435 30.926 1.00 0.00 H ATOM 67932 H10S PA 1642 36.311 123.770 30.085 1.00 0.00 H ATOM 67933 C19 PA 1642 36.501 125.755 29.464 1.00 0.00 C ATOM 67934 H9R PA 1642 37.274 126.520 29.365 1.00 0.00 H ATOM 67935 H9S PA 1642 35.771 125.874 30.267 1.00 0.00 H ATOM 67936 C18 PA 1642 35.569 125.651 28.197 1.00 0.00 C ATOM 67937 H8R PA 1642 34.987 124.743 28.367 1.00 0.00 H ATOM 67938 H8S PA 1642 36.198 125.512 27.316 1.00 0.00 H ATOM 67939 C17 PA 1642 34.605 126.852 27.978 1.00 0.00 C ATOM 67940 H7R PA 1642 35.174 127.736 27.682 1.00 0.00 H ATOM 67941 H7S PA 1642 33.933 127.137 28.790 1.00 0.00 H ATOM 67942 C16 PA 1642 33.629 126.512 26.943 1.00 0.00 C ATOM 67943 H6R PA 1642 32.971 125.726 27.320 1.00 0.00 H ATOM 67944 H6S PA 1642 34.018 126.110 26.005 1.00 0.00 H ATOM 67945 C15 PA 1642 32.576 127.651 26.677 1.00 0.00 C ATOM 67946 H5R PA 1642 33.026 128.503 26.163 1.00 0.00 H ATOM 67947 H5S PA 1642 32.323 128.108 27.637 1.00 0.00 H ATOM 67948 C14 PA 1642 31.209 127.356 26.110 1.00 0.00 C ATOM 67949 H4R PA 1642 30.519 128.195 25.996 1.00 0.00 H ATOM 67950 H4S PA 1642 30.659 126.932 26.953 1.00 0.00 H ATOM 67951 C13 PA 1642 31.200 126.516 24.825 1.00 0.00 C ATOM 67952 H3R PA 1642 30.211 126.440 24.368 1.00 0.00 H ATOM 67953 H3S PA 1642 31.404 125.479 25.098 1.00 0.00 H ATOM 67954 C12 PA 1642 32.102 126.992 23.623 1.00 0.00 C ATOM 67955 H2R PA 1642 32.984 127.512 24.004 1.00 0.00 H ATOM 67956 H2S PA 1642 31.574 127.766 23.063 1.00 0.00 H ATOM 67957 C11 PC 1643 32.551 125.893 22.796 1.00 0.00 C ATOM 67958 O12 PC 1643 32.442 124.674 23.053 1.00 0.00 O ATOM 67959 O11 PC 1643 33.017 126.355 21.622 1.00 0.00 O ATOM 67960 C1 PC 1643 33.701 125.469 20.742 1.00 0.00 C ATOM 67961 HR PC 1643 33.081 124.593 20.537 1.00 0.00 H ATOM 67962 HS PC 1643 34.675 125.195 21.157 1.00 0.00 H ATOM 67963 C2 PC 1643 33.919 126.277 19.487 1.00 0.00 C ATOM 67964 HX PC 1643 33.111 126.990 19.303 1.00 0.00 H ATOM 67965 C3 PC 1643 33.802 125.354 18.238 1.00 0.00 C ATOM 67966 HA PC 1643 32.783 124.960 18.262 1.00 0.00 H ATOM 67967 HB PC 1643 34.445 124.472 18.295 1.00 0.00 H ATOM 67968 O31 PC 1643 33.995 126.139 17.125 1.00 0.00 O ATOM 67969 P31 PC 1643 34.001 125.560 15.631 1.00 0.00 P ATOM 67970 O32 PC 1643 35.378 124.805 15.470 1.00 0.00 O ATOM 67971 C31 PC 1643 36.580 125.468 15.573 1.00 0.00 C ATOM 67972 H1A PC 1643 36.671 125.951 16.549 1.00 0.00 H ATOM 67973 H1B PC 1643 36.689 126.178 14.750 1.00 0.00 H ATOM 67974 C32 PC 1643 37.728 124.467 15.516 1.00 0.00 C ATOM 67975 H2A PC 1643 37.706 123.896 14.587 1.00 0.00 H ATOM 67976 H2B PC 1643 37.666 123.827 16.397 1.00 0.00 H ATOM 67977 N31 PC 1643 39.165 124.952 15.513 1.00 0.00 N ATOM 67978 C33 PC 1643 39.473 125.623 14.233 1.00 0.00 C ATOM 67979 H3A PC 1643 40.430 126.147 14.246 1.00 0.00 H ATOM 67980 H3B PC 1643 38.785 126.470 14.233 1.00 0.00 H ATOM 67981 H3C PC 1643 39.254 124.941 13.410 1.00 0.00 H ATOM 67982 C34 PC 1643 39.504 125.764 16.757 1.00 0.00 C ATOM 67983 H4A PC 1643 39.198 125.104 17.571 1.00 0.00 H ATOM 67984 H4B PC 1643 38.818 126.607 16.665 1.00 0.00 H ATOM 67985 H4C PC 1643 40.582 125.851 16.615 1.00 0.00 H ATOM 67986 C35 PC 1643 40.121 123.820 15.480 1.00 0.00 C ATOM 67987 H5A PC 1643 40.066 123.212 16.384 1.00 0.00 H ATOM 67988 H5B PC 1643 41.106 124.259 15.316 1.00 0.00 H ATOM 67989 H5C PC 1643 39.806 123.214 14.629 1.00 0.00 H ATOM 67990 O33 PC 1643 32.859 124.652 15.437 1.00 0.00 O ATOM 67991 O34 PC 1643 34.018 126.838 14.828 1.00 0.00 O ATOM 67992 O21 PC 1643 35.203 126.821 19.476 1.00 0.00 O ATOM 67993 C21 PC 1643 35.322 128.069 19.944 1.00 0.00 C ATOM 67994 O22 PC 1643 34.405 128.830 20.233 1.00 0.00 O TER 67995 PC 1643 ATOM 67995 C12 OL 1644 63.284 72.605 45.525 1.00 0.00 C ATOM 67996 H2R OL 1644 62.930 71.654 45.930 1.00 0.00 H ATOM 67997 H2S OL 1644 62.372 73.194 45.405 1.00 0.00 H ATOM 67998 C13 OL 1644 63.993 72.496 44.178 1.00 0.00 C ATOM 67999 H3R OL 1644 64.445 73.438 43.860 1.00 0.00 H ATOM 68000 H3S OL 1644 64.757 71.744 44.386 1.00 0.00 H ATOM 68001 C14 OL 1644 63.104 72.003 43.010 1.00 0.00 C ATOM 68002 H4R OL 1644 62.889 70.957 43.237 1.00 0.00 H ATOM 68003 H4S OL 1644 62.167 72.558 42.919 1.00 0.00 H ATOM 68004 C15 OL 1644 63.688 71.882 41.642 1.00 0.00 C ATOM 68005 H5R OL 1644 63.001 71.335 40.994 1.00 0.00 H ATOM 68006 H5S OL 1644 63.670 72.871 41.178 1.00 0.00 H ATOM 68007 C16 OL 1644 65.115 71.222 41.629 1.00 0.00 C ATOM 68008 H6R OL 1644 65.889 71.862 42.059 1.00 0.00 H ATOM 68009 H6S OL 1644 65.105 70.354 42.291 1.00 0.00 H ATOM 68010 C17 OL 1644 65.602 71.014 40.159 1.00 0.00 C ATOM 68011 H7R OL 1644 64.978 70.228 39.727 1.00 0.00 H ATOM 68012 H7S OL 1644 65.332 71.956 39.677 1.00 0.00 H ATOM 68013 C18 OL 1644 67.056 70.615 40.157 1.00 0.00 C ATOM 68014 H8R OL 1644 67.428 70.827 39.152 1.00 0.00 H ATOM 68015 H8S OL 1644 67.654 71.247 40.817 1.00 0.00 H ATOM 68016 C19 OL 1644 67.321 69.141 40.383 1.00 0.00 C ATOM 68017 H9R OL 1644 66.783 68.531 39.662 1.00 0.00 H ATOM 68018 C110 OL 1644 68.287 68.599 41.139 1.00 0.00 C ATOM 68019 H10R OL 1644 68.587 67.554 41.134 1.00 0.00 H ATOM 68020 C111 OL 1644 69.093 69.376 42.196 1.00 0.00 C ATOM 68021 H11R OL 1644 69.750 69.997 41.584 1.00 0.00 H ATOM 68022 H11S OL 1644 68.509 69.977 42.897 1.00 0.00 H ATOM 68023 C112 OL 1644 69.862 68.262 42.895 1.00 0.00 C ATOM 68024 H12R OL 1644 70.071 68.578 43.919 1.00 0.00 H ATOM 68025 H12S OL 1644 69.236 67.391 43.103 1.00 0.00 H ATOM 68026 C113 OL 1644 71.009 67.684 42.101 1.00 0.00 C ATOM 68027 H13R OL 1644 70.625 67.252 41.174 1.00 0.00 H ATOM 68028 H13S OL 1644 71.690 68.434 41.693 1.00 0.00 H ATOM 68029 C114 OL 1644 71.790 66.540 42.734 1.00 0.00 C ATOM 68030 H14R OL 1644 72.207 66.728 43.725 1.00 0.00 H ATOM 68031 H14S OL 1644 71.024 65.773 42.866 1.00 0.00 H ATOM 68032 C115 OL 1644 72.911 65.925 41.943 1.00 0.00 C ATOM 68033 H15R OL 1644 72.577 65.573 40.965 1.00 0.00 H ATOM 68034 H15S OL 1644 73.631 66.741 41.850 1.00 0.00 H ATOM 68035 C116 OL 1644 73.604 64.794 42.710 1.00 0.00 C ATOM 68036 H16R OL 1644 73.806 65.154 43.721 1.00 0.00 H ATOM 68037 H16S OL 1644 72.975 63.908 42.821 1.00 0.00 H ATOM 68038 C117 OL 1644 74.914 64.326 42.093 1.00 0.00 C ATOM 68039 H17R OL 1644 74.879 63.255 42.307 1.00 0.00 H ATOM 68040 H17S OL 1644 74.804 64.458 41.015 1.00 0.00 H ATOM 68041 C118 OL 1644 76.152 65.052 42.576 1.00 0.00 C ATOM 68042 H18R OL 1644 76.234 64.805 43.637 1.00 0.00 H ATOM 68043 H18S OL 1644 76.122 66.142 42.533 1.00 0.00 H ATOM 68044 H18T OL 1644 77.061 64.629 42.144 1.00 0.00 H TER 68045 OL 1644 ATOM 68045 C116 PA 1645 140.103 59.332 39.182 1.00 0.00 C ATOM 68046 H16R PA 1645 140.628 59.100 40.111 1.00 0.00 H ATOM 68047 H16S PA 1645 139.325 58.588 38.997 1.00 0.00 H ATOM 68048 H16T PA 1645 139.597 60.298 39.217 1.00 0.00 H ATOM 68049 C115 PA 1645 140.990 59.295 38.011 1.00 0.00 C ATOM 68050 H15R PA 1645 141.458 58.313 37.913 1.00 0.00 H ATOM 68051 H15S PA 1645 141.819 59.976 38.212 1.00 0.00 H ATOM 68052 C114 PA 1645 140.323 59.564 36.764 1.00 0.00 C ATOM 68053 H14R PA 1645 139.917 60.575 36.694 1.00 0.00 H ATOM 68054 H14S PA 1645 139.380 59.015 36.763 1.00 0.00 H ATOM 68055 C113 PA 1645 141.156 59.156 35.520 1.00 0.00 C ATOM 68056 H13R PA 1645 140.449 58.932 34.718 1.00 0.00 H ATOM 68057 H13S PA 1645 141.627 58.189 35.708 1.00 0.00 H ATOM 68058 C112 PA 1645 142.210 60.209 35.085 1.00 0.00 C ATOM 68059 H12R PA 1645 142.838 60.522 35.921 1.00 0.00 H ATOM 68060 H12S PA 1645 141.564 61.021 34.744 1.00 0.00 H ATOM 68061 C111 PA 1645 143.011 59.734 33.885 1.00 0.00 C ATOM 68062 H11R PA 1645 142.260 59.208 33.291 1.00 0.00 H ATOM 68063 H11S PA 1645 143.721 59.001 34.275 1.00 0.00 H ATOM 68064 C110 PA 1645 143.775 60.848 33.078 1.00 0.00 C ATOM 68065 H10R PA 1645 144.323 61.532 33.728 1.00 0.00 H ATOM 68066 H10S PA 1645 143.033 61.321 32.431 1.00 0.00 H ATOM 68067 C19 PA 1645 144.853 60.194 32.276 1.00 0.00 C ATOM 68068 H9R PA 1645 144.616 59.183 31.936 1.00 0.00 H ATOM 68069 H9S PA 1645 145.695 59.988 32.940 1.00 0.00 H ATOM 68070 C18 PA 1645 145.423 61.040 31.236 1.00 0.00 C ATOM 68071 H8R PA 1645 145.736 61.988 31.680 1.00 0.00 H ATOM 68072 H8S PA 1645 144.625 61.209 30.510 1.00 0.00 H ATOM 68073 C17 PA 1645 146.600 60.461 30.498 1.00 0.00 C ATOM 68074 H7R PA 1645 146.295 59.649 29.835 1.00 0.00 H ATOM 68075 H7S PA 1645 147.254 60.049 31.271 1.00 0.00 H ATOM 68076 C16 PA 1645 147.449 61.451 29.690 1.00 0.00 C ATOM 68077 H6R PA 1645 148.350 61.140 29.158 1.00 0.00 H ATOM 68078 H6S PA 1645 147.888 62.139 30.415 1.00 0.00 H ATOM 68079 C15 PA 1645 146.594 62.300 28.777 1.00 0.00 C ATOM 68080 H5R PA 1645 145.864 62.839 29.385 1.00 0.00 H ATOM 68081 H5S PA 1645 145.986 61.666 28.127 1.00 0.00 H ATOM 68082 C14 PA 1645 147.347 63.257 27.864 1.00 0.00 C ATOM 68083 H4R PA 1645 148.071 62.783 27.198 1.00 0.00 H ATOM 68084 H4S PA 1645 147.972 63.871 28.516 1.00 0.00 H ATOM 68085 C13 PA 1645 146.514 64.200 27.050 1.00 0.00 C ATOM 68086 H3R PA 1645 147.004 65.167 26.917 1.00 0.00 H ATOM 68087 H3S PA 1645 145.787 64.503 27.807 1.00 0.00 H ATOM 68088 C12 PA 1645 145.943 63.503 25.803 1.00 0.00 C ATOM 68089 H2R PA 1645 145.470 62.566 26.103 1.00 0.00 H ATOM 68090 H2S PA 1645 146.773 63.273 25.132 1.00 0.00 H ATOM 68091 C11 PGR 1646 144.860 64.270 25.145 1.00 0.00 C ATOM 68092 O12 PGR 1646 144.590 65.423 25.334 1.00 0.00 O ATOM 68093 O11 PGR 1646 144.070 63.619 24.296 1.00 0.00 O ATOM 68094 C1 PGR 1646 142.996 64.244 23.581 1.00 0.00 C ATOM 68095 HR PGR 1646 142.781 63.635 22.699 1.00 0.00 H ATOM 68096 HS PGR 1646 143.268 65.286 23.395 1.00 0.00 H ATOM 68097 C2 PGR 1646 141.738 64.224 24.455 1.00 0.00 C ATOM 68098 HX PGR 1646 141.647 63.185 24.782 1.00 0.00 H ATOM 68099 C3 PGR 1646 140.511 64.728 23.647 1.00 0.00 C ATOM 68100 HA PGR 1646 139.741 65.076 24.340 1.00 0.00 H ATOM 68101 HB PGR 1646 140.233 63.899 22.990 1.00 0.00 H ATOM 68102 O31 PGR 1646 140.853 65.904 22.860 1.00 0.00 O ATOM 68103 P31 PGR 1646 139.911 66.481 21.601 1.00 0.00 P ATOM 68104 O32 PGR 1646 139.974 65.291 20.582 1.00 0.00 O ATOM 68105 C31 PGR 1646 141.128 65.224 19.715 1.00 0.00 C ATOM 68106 H1A PGR 1646 141.340 64.164 19.552 1.00 0.00 H ATOM 68107 H1B PGR 1646 142.040 65.438 20.279 1.00 0.00 H ATOM 68108 C32 PGR 1646 141.010 65.951 18.340 1.00 0.00 C ATOM 68109 H2A PGR 1646 140.945 67.032 18.484 1.00 0.00 H ATOM 68110 O35 PGR 1646 139.736 65.593 17.710 1.00 0.00 O ATOM 68111 HO5A PGR 1646 139.107 66.009 18.327 1.00 0.00 H ATOM 68112 C33 PGR 1646 142.145 65.693 17.335 1.00 0.00 C ATOM 68113 H3A PGR 1646 141.935 65.990 16.305 1.00 0.00 H ATOM 68114 H3B PGR 1646 143.038 66.284 17.553 1.00 0.00 H ATOM 68115 O33 PGR 1646 138.500 66.669 22.077 1.00 0.00 O ATOM 68116 O34 PGR 1646 140.628 67.694 21.171 1.00 0.00 O ATOM 68117 O21 PGR 1646 141.984 65.136 25.564 1.00 0.00 O ATOM 68118 C21 PGR 1646 141.349 64.946 26.713 1.00 0.00 C ATOM 68119 O22 PGR 1646 140.418 64.201 26.763 1.00 0.00 O ATOM 68120 O36 PGR 1646 142.569 64.326 17.439 1.00 0.00 O ATOM 68121 HO6A PGR 1646 143.532 64.200 17.364 1.00 0.00 H ATOM 68122 C12 OL 1647 141.926 65.682 27.906 1.00 0.00 C ATOM 68123 H2R OL 1647 142.730 66.343 27.576 1.00 0.00 H ATOM 68124 H2S OL 1647 141.319 66.385 28.480 1.00 0.00 H ATOM 68125 C13 OL 1647 142.482 64.724 28.935 1.00 0.00 C ATOM 68126 H3R OL 1647 141.647 64.299 29.496 1.00 0.00 H ATOM 68127 H3S OL 1647 142.945 63.910 28.373 1.00 0.00 H ATOM 68128 C14 OL 1647 143.556 65.423 29.785 1.00 0.00 C ATOM 68129 H4R OL 1647 144.329 65.786 29.104 1.00 0.00 H ATOM 68130 H4S OL 1647 143.172 66.354 30.207 1.00 0.00 H ATOM 68131 C15 OL 1647 144.032 64.519 30.963 1.00 0.00 C ATOM 68132 H5R OL 1647 144.169 63.497 30.603 1.00 0.00 H ATOM 68133 H5S OL 1647 145.028 64.852 31.263 1.00 0.00 H ATOM 68134 C16 OL 1647 143.122 64.658 32.229 1.00 0.00 C ATOM 68135 H6R OL 1647 142.092 64.303 32.154 1.00 0.00 H ATOM 68136 H6S OL 1647 143.425 63.998 33.044 1.00 0.00 H ATOM 68137 C17 OL 1647 143.146 66.014 32.825 1.00 0.00 C ATOM 68138 H7R OL 1647 144.152 66.427 32.728 1.00 0.00 H ATOM 68139 H7S OL 1647 142.422 66.626 32.282 1.00 0.00 H ATOM 68140 C18 OL 1647 142.573 66.187 34.185 1.00 0.00 C ATOM 68141 H8R OL 1647 142.353 67.242 34.365 1.00 0.00 H ATOM 68142 H8S OL 1647 141.660 65.600 34.307 1.00 0.00 H ATOM 68143 C19 OL 1647 143.522 65.753 35.179 1.00 0.00 C ATOM 68144 H9R OL 1647 144.513 66.198 35.162 1.00 0.00 H ATOM 68145 C110 OL 1647 143.399 64.843 36.077 1.00 0.00 C ATOM 68146 H10R OL 1647 144.252 64.801 36.749 1.00 0.00 H ATOM 68147 C111 OL 1647 142.150 63.961 36.543 1.00 0.00 C ATOM 68148 H11R OL 1647 141.189 64.273 36.129 1.00 0.00 H ATOM 68149 H11S OL 1647 142.234 62.926 36.202 1.00 0.00 H ATOM 68150 C112 OL 1647 141.983 63.887 38.087 1.00 0.00 C ATOM 68151 H12R OL 1647 141.620 64.825 38.513 1.00 0.00 H ATOM 68152 H12S OL 1647 141.111 63.281 38.342 1.00 0.00 H ATOM 68153 C113 OL 1647 143.224 63.272 38.925 1.00 0.00 C ATOM 68154 H13R OL 1647 143.482 62.242 38.669 1.00 0.00 H ATOM 68155 H13S OL 1647 144.065 63.872 38.572 1.00 0.00 H ATOM 68156 C114 OL 1647 143.235 63.455 40.451 1.00 0.00 C ATOM 68157 H14R OL 1647 144.146 62.932 40.749 1.00 0.00 H ATOM 68158 H14S OL 1647 143.268 64.520 40.689 1.00 0.00 H ATOM 68159 C115 OL 1647 142.075 62.713 41.264 1.00 0.00 C ATOM 68160 H15R OL 1647 141.685 61.820 40.771 1.00 0.00 H ATOM 68161 H15S OL 1647 142.569 62.313 42.152 1.00 0.00 H ATOM 68162 C116 OL 1647 140.839 63.574 41.348 1.00 0.00 C ATOM 68163 H16R OL 1647 141.068 64.567 41.739 1.00 0.00 H ATOM 68164 H16S OL 1647 140.330 63.741 40.397 1.00 0.00 H ATOM 68165 C117 OL 1647 139.758 63.044 42.191 1.00 0.00 C ATOM 68166 H17R OL 1647 139.451 62.061 41.829 1.00 0.00 H ATOM 68167 H17S OL 1647 140.084 62.954 43.230 1.00 0.00 H ATOM 68168 C118 OL 1647 138.445 63.715 41.868 1.00 0.00 C ATOM 68169 H18R OL 1647 138.584 64.781 41.679 1.00 0.00 H ATOM 68170 H18S OL 1647 137.703 63.618 42.663 1.00 0.00 H ATOM 68171 H18T OL 1647 138.030 63.346 40.928 1.00 0.00 H TER 68172 OL 1647 ATOM 68172 C116 PA 1648 79.686 128.026 40.853 1.00 0.00 C ATOM 68173 H16R PA 1648 79.467 126.956 40.870 1.00 0.00 H ATOM 68174 H16S PA 1648 78.857 128.552 40.373 1.00 0.00 H ATOM 68175 H16T PA 1648 79.673 128.429 41.868 1.00 0.00 H ATOM 68176 C115 PA 1648 81.004 128.441 40.183 1.00 0.00 C ATOM 68177 H15R PA 1648 81.831 127.845 40.575 1.00 0.00 H ATOM 68178 H15S PA 1648 81.336 129.476 40.285 1.00 0.00 H ATOM 68179 C114 PA 1648 80.984 128.174 38.701 1.00 0.00 C ATOM 68180 H14R PA 1648 80.919 127.115 38.443 1.00 0.00 H ATOM 68181 H14S PA 1648 82.006 128.378 38.375 1.00 0.00 H ATOM 68182 C113 PA 1648 80.056 129.049 37.884 1.00 0.00 C ATOM 68183 H13R PA 1648 80.285 130.052 38.250 1.00 0.00 H ATOM 68184 H13S PA 1648 79.039 128.832 38.217 1.00 0.00 H ATOM 68185 C112 PA 1648 80.294 129.133 36.390 1.00 0.00 C ATOM 68186 H12R PA 1648 81.287 129.545 36.196 1.00 0.00 H ATOM 68187 H12S PA 1648 79.569 129.780 35.892 1.00 0.00 H ATOM 68188 C111 PA 1648 80.207 127.767 35.800 1.00 0.00 C ATOM 68189 H11R PA 1648 79.148 127.510 35.729 1.00 0.00 H ATOM 68190 H11S PA 1648 80.810 127.048 36.359 1.00 0.00 H ATOM 68191 C110 PA 1648 80.770 127.857 34.399 1.00 0.00 C ATOM 68192 H10R PA 1648 81.806 128.203 34.411 1.00 0.00 H ATOM 68193 H10S PA 1648 80.307 128.660 33.823 1.00 0.00 H ATOM 68194 C19 PA 1648 80.669 126.565 33.615 1.00 0.00 C ATOM 68195 H9R PA 1648 79.617 126.287 33.518 1.00 0.00 H ATOM 68196 H9S PA 1648 81.104 125.795 34.256 1.00 0.00 H ATOM 68197 C18 PA 1648 81.199 126.671 32.198 1.00 0.00 C ATOM 68198 H8R PA 1648 82.244 126.989 32.208 1.00 0.00 H ATOM 68199 H8S PA 1648 80.827 127.529 31.634 1.00 0.00 H ATOM 68200 C17 PA 1648 81.237 125.285 31.416 1.00 0.00 C ATOM 68201 H7R PA 1648 80.322 124.700 31.527 1.00 0.00 H ATOM 68202 H7S PA 1648 81.954 124.621 31.904 1.00 0.00 H ATOM 68203 C16 PA 1648 81.685 125.452 29.984 1.00 0.00 C ATOM 68204 H6R PA 1648 82.544 126.126 30.010 1.00 0.00 H ATOM 68205 H6S PA 1648 80.855 125.973 29.503 1.00 0.00 H ATOM 68206 C15 PA 1648 82.001 124.159 29.218 1.00 0.00 C ATOM 68207 H5R PA 1648 82.763 123.552 29.711 1.00 0.00 H ATOM 68208 H5S PA 1648 82.631 124.420 28.366 1.00 0.00 H ATOM 68209 C14 PA 1648 80.818 123.238 28.859 1.00 0.00 C ATOM 68210 H4R PA 1648 80.197 123.743 28.116 1.00 0.00 H ATOM 68211 H4S PA 1648 80.157 123.167 29.726 1.00 0.00 H ATOM 68212 C13 PA 1648 81.200 121.825 28.287 1.00 0.00 C ATOM 68213 H3R PA 1648 81.910 121.312 28.939 1.00 0.00 H ATOM 68214 H3S PA 1648 81.646 122.028 27.311 1.00 0.00 H ATOM 68215 C12 PA 1648 79.922 120.914 28.185 1.00 0.00 C ATOM 68216 H2R PA 1648 79.020 121.477 27.932 1.00 0.00 H ATOM 68217 H2S PA 1648 79.772 120.412 29.143 1.00 0.00 H ATOM 68218 C11 PGR 1649 80.120 119.865 27.065 1.00 0.00 C ATOM 68219 O12 PGR 1649 79.610 118.813 27.121 1.00 0.00 O ATOM 68220 O11 PGR 1649 80.863 120.292 26.089 1.00 0.00 O ATOM 68221 C1 PGR 1649 80.780 119.677 24.716 1.00 0.00 C ATOM 68222 HR PGR 1649 79.712 119.837 24.549 1.00 0.00 H ATOM 68223 HS PGR 1649 80.885 118.591 24.790 1.00 0.00 H ATOM 68224 C2 PGR 1649 81.555 120.536 23.714 1.00 0.00 C ATOM 68225 HX PGR 1649 81.022 121.477 23.553 1.00 0.00 H ATOM 68226 C3 PGR 1649 81.692 119.773 22.413 1.00 0.00 C ATOM 68227 HA PGR 1649 80.729 119.419 22.039 1.00 0.00 H ATOM 68228 HB PGR 1649 82.152 118.787 22.516 1.00 0.00 H ATOM 68229 O31 PGR 1649 82.343 120.613 21.374 1.00 0.00 O ATOM 68230 P31 PGR 1649 82.952 119.956 20.065 1.00 0.00 P ATOM 68231 O32 PGR 1649 84.185 119.029 20.547 1.00 0.00 O ATOM 68232 C31 PGR 1649 85.330 119.688 21.130 1.00 0.00 C ATOM 68233 H1A PGR 1649 85.047 120.307 21.985 1.00 0.00 H ATOM 68234 H1B PGR 1649 85.800 120.281 20.342 1.00 0.00 H ATOM 68235 C32 PGR 1649 86.424 118.777 21.680 1.00 0.00 C ATOM 68236 H2A PGR 1649 87.246 119.371 22.086 1.00 0.00 H ATOM 68237 O35 PGR 1649 86.925 117.932 20.660 1.00 0.00 O ATOM 68238 HO5A PGR 1649 87.799 117.681 21.011 1.00 0.00 H ATOM 68239 C33 PGR 1649 85.820 117.917 22.824 1.00 0.00 C ATOM 68240 H3A PGR 1649 86.612 117.347 23.317 1.00 0.00 H ATOM 68241 H3B PGR 1649 85.229 118.539 23.502 1.00 0.00 H ATOM 68242 O33 PGR 1649 81.962 119.043 19.426 1.00 0.00 O ATOM 68243 O34 PGR 1649 83.434 121.040 19.209 1.00 0.00 O ATOM 68244 O21 PGR 1649 82.886 120.885 24.220 1.00 0.00 O ATOM 68245 C21 PGR 1649 83.393 122.107 24.018 1.00 0.00 C ATOM 68246 O22 PGR 1649 82.843 123.055 23.358 1.00 0.00 O ATOM 68247 O36 PGR 1649 84.910 117.072 22.207 1.00 0.00 O ATOM 68248 HO6A PGR 1649 84.498 117.618 21.514 1.00 0.00 H ATOM 68249 C12 OL 1650 84.805 122.389 24.407 1.00 0.00 C ATOM 68250 H2R OL 1650 85.213 121.499 24.890 1.00 0.00 H ATOM 68251 H2S OL 1650 85.326 122.566 23.464 1.00 0.00 H ATOM 68252 C13 OL 1650 84.902 123.607 25.310 1.00 0.00 C ATOM 68253 H3R OL 1650 84.367 124.493 24.962 1.00 0.00 H ATOM 68254 H3S OL 1650 84.375 123.302 26.216 1.00 0.00 H ATOM 68255 C14 OL 1650 86.289 123.945 25.815 1.00 0.00 C ATOM 68256 H4R OL 1650 86.643 123.346 26.656 1.00 0.00 H ATOM 68257 H4S OL 1650 87.046 123.587 25.114 1.00 0.00 H ATOM 68258 C15 OL 1650 86.390 125.432 26.178 1.00 0.00 C ATOM 68259 H5R OL 1650 87.385 125.563 26.608 1.00 0.00 H ATOM 68260 H5S OL 1650 86.451 125.952 25.220 1.00 0.00 H ATOM 68261 C16 OL 1650 85.314 126.000 27.033 1.00 0.00 C ATOM 68262 H6R OL 1650 84.363 126.148 26.517 1.00 0.00 H ATOM 68263 H6S OL 1650 85.034 125.338 27.854 1.00 0.00 H ATOM 68264 C17 OL 1650 85.767 127.296 27.670 1.00 0.00 C ATOM 68265 H7R OL 1650 86.480 127.299 28.496 1.00 0.00 H ATOM 68266 H7S OL 1650 86.280 127.877 26.900 1.00 0.00 H ATOM 68267 C18 OL 1650 84.579 128.189 27.871 1.00 0.00 C ATOM 68268 H8R OL 1650 84.053 128.539 26.979 1.00 0.00 H ATOM 68269 H8S OL 1650 83.919 127.689 28.583 1.00 0.00 H ATOM 68270 C19 OL 1650 84.932 129.441 28.564 1.00 0.00 C ATOM 68271 H9R OL 1650 85.913 129.874 28.384 1.00 0.00 H ATOM 68272 C110 OL 1650 84.193 130.190 29.363 1.00 0.00 C ATOM 68273 H10R OL 1650 84.643 131.089 29.775 1.00 0.00 H ATOM 68274 C111 OL 1650 82.820 129.931 29.800 1.00 0.00 C ATOM 68275 H11R OL 1650 82.167 130.616 29.254 1.00 0.00 H ATOM 68276 H11S OL 1650 82.467 128.961 29.444 1.00 0.00 H ATOM 68277 C112 OL 1650 82.681 130.087 31.325 1.00 0.00 C ATOM 68278 H12R OL 1650 81.693 129.761 31.657 1.00 0.00 H ATOM 68279 H12S OL 1650 83.399 129.329 31.645 1.00 0.00 H ATOM 68280 C113 OL 1650 83.065 131.459 31.929 1.00 0.00 C ATOM 68281 H13R OL 1650 84.124 131.671 31.763 1.00 0.00 H ATOM 68282 H13S OL 1650 82.489 132.199 31.370 1.00 0.00 H ATOM 68283 C114 OL 1650 82.717 131.543 33.422 1.00 0.00 C ATOM 68284 H14R OL 1650 81.648 131.330 33.499 1.00 0.00 H ATOM 68285 H14S OL 1650 83.246 130.805 34.028 1.00 0.00 H ATOM 68286 C115 OL 1650 82.910 132.825 34.155 1.00 0.00 C ATOM 68287 H15R OL 1650 83.980 132.958 34.327 1.00 0.00 H ATOM 68288 H15S OL 1650 82.634 133.731 33.612 1.00 0.00 H ATOM 68289 C116 OL 1650 82.187 132.760 35.526 1.00 0.00 C ATOM 68290 H16R OL 1650 81.117 132.703 35.312 1.00 0.00 H ATOM 68291 H16S OL 1650 82.500 131.818 35.980 1.00 0.00 H ATOM 68292 C117 OL 1650 82.511 133.963 36.466 1.00 0.00 C ATOM 68293 H17R OL 1650 81.980 133.919 37.419 1.00 0.00 H ATOM 68294 H17S OL 1650 83.577 133.812 36.652 1.00 0.00 H ATOM 68295 C118 OL 1650 82.116 135.256 35.782 1.00 0.00 C ATOM 68296 H18R OL 1650 82.635 135.582 34.879 1.00 0.00 H ATOM 68297 H18S OL 1650 82.307 136.072 36.482 1.00 0.00 H ATOM 68298 H18T OL 1650 81.078 135.301 35.445 1.00 0.00 H TER 68299 OL 1650 ATOM 68299 C116 PA 1651 140.122 24.362 37.785 1.00 0.00 C ATOM 68300 H16R PA 1651 140.390 25.415 37.893 1.00 0.00 H ATOM 68301 H16S PA 1651 141.028 23.753 37.802 1.00 0.00 H ATOM 68302 H16T PA 1651 139.462 24.164 38.633 1.00 0.00 H ATOM 68303 C115 PA 1651 139.373 24.156 36.477 1.00 0.00 C ATOM 68304 H15R PA 1651 139.833 24.830 35.752 1.00 0.00 H ATOM 68305 H15S PA 1651 138.455 24.694 36.723 1.00 0.00 H ATOM 68306 C114 PA 1651 139.027 22.769 35.979 1.00 0.00 C ATOM 68307 H14R PA 1651 138.627 22.166 36.797 1.00 0.00 H ATOM 68308 H14S PA 1651 139.946 22.299 35.625 1.00 0.00 H ATOM 68309 C113 PA 1651 137.974 22.715 34.862 1.00 0.00 C ATOM 68310 H13R PA 1651 138.123 21.745 34.383 1.00 0.00 H ATOM 68311 H13S PA 1651 138.207 23.411 34.053 1.00 0.00 H ATOM 68312 C112 PA 1651 136.480 22.959 35.262 1.00 0.00 C ATOM 68313 H12R PA 1651 136.369 23.893 35.817 1.00 0.00 H ATOM 68314 H12S PA 1651 136.111 22.239 35.996 1.00 0.00 H ATOM 68315 C111 PA 1651 135.545 22.842 34.129 1.00 0.00 C ATOM 68316 H11R PA 1651 134.474 22.787 34.335 1.00 0.00 H ATOM 68317 H11S PA 1651 135.802 21.963 33.534 1.00 0.00 H ATOM 68318 C110 PA 1651 135.860 24.017 33.213 1.00 0.00 C ATOM 68319 H10R PA 1651 136.624 23.762 32.476 1.00 0.00 H ATOM 68320 H10S PA 1651 136.357 24.804 33.784 1.00 0.00 H ATOM 68321 C19 PA 1651 134.591 24.476 32.501 1.00 0.00 C ATOM 68322 H9R PA 1651 134.801 25.225 31.735 1.00 0.00 H ATOM 68323 H9S PA 1651 133.984 24.961 33.269 1.00 0.00 H ATOM 68324 C18 PA 1651 133.714 23.365 31.806 1.00 0.00 C ATOM 68325 H8R PA 1651 133.463 22.492 32.412 1.00 0.00 H ATOM 68326 H8S PA 1651 134.417 22.851 31.146 1.00 0.00 H ATOM 68327 C17 PA 1651 132.480 24.000 31.062 1.00 0.00 C ATOM 68328 H7R PA 1651 132.746 24.791 30.358 1.00 0.00 H ATOM 68329 H7S PA 1651 131.911 24.644 31.735 1.00 0.00 H ATOM 68330 C16 PA 1651 131.635 22.921 30.314 1.00 0.00 C ATOM 68331 H6R PA 1651 131.121 22.249 31.005 1.00 0.00 H ATOM 68332 H6S PA 1651 132.289 22.264 29.737 1.00 0.00 H ATOM 68333 C15 PA 1651 130.545 23.614 29.557 1.00 0.00 C ATOM 68334 H5R PA 1651 130.982 24.386 28.920 1.00 0.00 H ATOM 68335 H5S PA 1651 129.902 24.096 30.296 1.00 0.00 H ATOM 68336 C14 PA 1651 129.737 22.596 28.805 1.00 0.00 C ATOM 68337 H4R PA 1651 129.370 21.860 29.523 1.00 0.00 H ATOM 68338 H4S PA 1651 130.387 22.110 28.074 1.00 0.00 H ATOM 68339 C13 PA 1651 128.612 23.241 28.029 1.00 0.00 C ATOM 68340 H3R PA 1651 127.808 23.582 28.685 1.00 0.00 H ATOM 68341 H3S PA 1651 128.258 22.450 27.365 1.00 0.00 H ATOM 68342 C12 PA 1651 129.013 24.309 27.070 1.00 0.00 C ATOM 68343 H2R PA 1651 129.947 23.977 26.611 1.00 0.00 H ATOM 68344 H2S PA 1651 129.189 25.244 27.604 1.00 0.00 H ATOM 68345 C11 PGR 1652 127.946 24.565 25.997 1.00 0.00 C ATOM 68346 O12 PGR 1652 127.273 25.600 25.992 1.00 0.00 O ATOM 68347 O11 PGR 1652 127.726 23.506 25.241 1.00 0.00 O ATOM 68348 C1 PGR 1652 126.667 23.660 24.308 1.00 0.00 C ATOM 68349 HR PGR 1652 126.962 24.406 23.565 1.00 0.00 H ATOM 68350 HS PGR 1652 125.781 24.103 24.770 1.00 0.00 H ATOM 68351 C2 PGR 1652 126.392 22.296 23.665 1.00 0.00 C ATOM 68352 HX PGR 1652 127.310 21.770 23.391 1.00 0.00 H ATOM 68353 C3 PGR 1652 125.468 22.528 22.406 1.00 0.00 C ATOM 68354 HA PGR 1652 125.930 23.185 21.664 1.00 0.00 H ATOM 68355 HB PGR 1652 124.490 22.820 22.799 1.00 0.00 H ATOM 68356 O31 PGR 1652 125.241 21.206 21.809 1.00 0.00 O ATOM 68357 P31 PGR 1652 124.926 20.950 20.295 1.00 0.00 P ATOM 68358 O32 PGR 1652 126.293 21.413 19.576 1.00 0.00 O ATOM 68359 C31 PGR 1652 127.478 20.594 19.471 1.00 0.00 C ATOM 68360 H1A PGR 1652 127.162 19.722 18.893 1.00 0.00 H ATOM 68361 H1B PGR 1652 127.747 20.205 20.457 1.00 0.00 H ATOM 68362 C32 PGR 1652 128.676 21.198 18.742 1.00 0.00 C ATOM 68363 H2A PGR 1652 129.320 20.348 18.502 1.00 0.00 H ATOM 68364 O35 PGR 1652 129.316 21.992 19.652 1.00 0.00 O ATOM 68365 HO5A PGR 1652 128.765 22.767 19.862 1.00 0.00 H ATOM 68366 C33 PGR 1652 128.280 22.046 17.567 1.00 0.00 C ATOM 68367 H3A PGR 1652 127.728 21.470 16.821 1.00 0.00 H ATOM 68368 H3B PGR 1652 127.642 22.818 18.005 1.00 0.00 H ATOM 68369 O33 PGR 1652 124.773 19.499 20.104 1.00 0.00 O ATOM 68370 O34 PGR 1652 123.864 21.876 19.876 1.00 0.00 O ATOM 68371 O21 PGR 1652 125.805 21.346 24.545 1.00 0.00 O ATOM 68372 C21 PGR 1652 124.640 21.590 25.199 1.00 0.00 C ATOM 68373 O22 PGR 1652 123.752 22.367 24.860 1.00 0.00 O ATOM 68374 O36 PGR 1652 129.333 22.642 16.845 1.00 0.00 O ATOM 68375 HO6A PGR 1652 129.722 23.315 17.433 1.00 0.00 H ATOM 68376 C12 OL 1653 124.544 20.821 26.530 1.00 0.00 C ATOM 68377 H2R OL 1653 124.779 19.759 26.426 1.00 0.00 H ATOM 68378 H2S OL 1653 125.313 21.350 27.095 1.00 0.00 H ATOM 68379 C13 OL 1653 123.241 21.104 27.188 1.00 0.00 C ATOM 68380 H3R OL 1653 123.022 22.154 26.983 1.00 0.00 H ATOM 68381 H3S OL 1653 122.441 20.543 26.700 1.00 0.00 H ATOM 68382 C14 OL 1653 123.042 20.933 28.778 1.00 0.00 C ATOM 68383 H4R OL 1653 124.047 20.805 29.184 1.00 0.00 H ATOM 68384 H4S OL 1653 122.607 21.824 29.235 1.00 0.00 H ATOM 68385 C15 OL 1653 122.332 19.654 29.173 1.00 0.00 C ATOM 68386 H5R OL 1653 121.282 19.924 29.308 1.00 0.00 H ATOM 68387 H5S OL 1653 122.395 18.939 28.349 1.00 0.00 H ATOM 68388 C16 OL 1653 122.839 18.990 30.446 1.00 0.00 C ATOM 68389 H6R OL 1653 123.905 18.827 30.618 1.00 0.00 H ATOM 68390 H6S OL 1653 122.655 19.544 31.370 1.00 0.00 H ATOM 68391 C17 OL 1653 122.138 17.695 30.708 1.00 0.00 C ATOM 68392 H7R OL 1653 121.084 17.951 30.836 1.00 0.00 H ATOM 68393 H7S OL 1653 122.244 17.075 29.816 1.00 0.00 H ATOM 68394 C18 OL 1653 122.731 16.844 31.799 1.00 0.00 C ATOM 68395 H8R OL 1653 122.265 15.862 31.698 1.00 0.00 H ATOM 68396 H8S OL 1653 123.788 16.571 31.764 1.00 0.00 H ATOM 68397 C19 OL 1653 122.276 17.350 33.140 1.00 0.00 C ATOM 68398 H9R OL 1653 121.210 17.560 33.144 1.00 0.00 H ATOM 68399 C110 OL 1653 122.992 17.529 34.333 1.00 0.00 C ATOM 68400 H10R OL 1653 122.523 17.827 35.267 1.00 0.00 H ATOM 68401 C111 OL 1653 124.420 17.102 34.533 1.00 0.00 C ATOM 68402 H11R OL 1653 124.442 16.057 34.849 1.00 0.00 H ATOM 68403 H11S OL 1653 124.959 17.136 33.584 1.00 0.00 H ATOM 68404 C112 OL 1653 125.180 17.784 35.633 1.00 0.00 C ATOM 68405 H12R OL 1653 125.266 18.852 35.424 1.00 0.00 H ATOM 68406 H12S OL 1653 124.686 17.605 36.591 1.00 0.00 H ATOM 68407 C113 OL 1653 126.548 17.102 35.825 1.00 0.00 C ATOM 68408 H13R OL 1653 126.527 16.012 35.766 1.00 0.00 H ATOM 68409 H13S OL 1653 127.072 17.492 34.950 1.00 0.00 H ATOM 68410 C114 OL 1653 127.390 17.439 37.040 1.00 0.00 C ATOM 68411 H14R OL 1653 127.026 16.999 37.970 1.00 0.00 H ATOM 68412 H14S OL 1653 128.395 17.039 36.891 1.00 0.00 H ATOM 68413 C115 OL 1653 127.459 18.952 37.328 1.00 0.00 C ATOM 68414 H15R OL 1653 127.835 19.343 36.380 1.00 0.00 H ATOM 68415 H15S OL 1653 126.484 19.362 37.599 1.00 0.00 H ATOM 68416 C116 OL 1653 128.376 19.400 38.437 1.00 0.00 C ATOM 68417 H16R OL 1653 127.876 19.379 39.408 1.00 0.00 H ATOM 68418 H16S OL 1653 129.218 18.706 38.485 1.00 0.00 H ATOM 68419 C117 OL 1653 128.785 20.887 38.334 1.00 0.00 C ATOM 68420 H17R OL 1653 129.429 21.209 39.154 1.00 0.00 H ATOM 68421 H17S OL 1653 129.522 21.000 37.536 1.00 0.00 H ATOM 68422 C118 OL 1653 127.694 21.974 38.268 1.00 0.00 C ATOM 68423 H18R OL 1653 128.125 22.957 38.472 1.00 0.00 H ATOM 68424 H18S OL 1653 126.957 21.846 39.064 1.00 0.00 H ATOM 68425 H18T OL 1653 127.252 22.090 37.276 1.00 0.00 H TER 68426 OL 1653 ATOM 68426 C116 PA 1654 6.055 90.505 37.576 1.00 0.00 C ATOM 68427 H16R PA 1654 7.010 90.043 37.317 1.00 0.00 H ATOM 68428 H16S PA 1654 5.482 89.949 38.321 1.00 0.00 H ATOM 68429 H16T PA 1654 6.416 91.376 38.127 1.00 0.00 H ATOM 68430 C115 PA 1654 5.150 90.808 36.379 1.00 0.00 C ATOM 68431 H15R PA 1654 4.131 90.824 36.772 1.00 0.00 H ATOM 68432 H15S PA 1654 5.298 89.905 35.782 1.00 0.00 H ATOM 68433 C114 PA 1654 5.675 92.077 35.503 1.00 0.00 C ATOM 68434 H14R PA 1654 6.748 91.880 35.455 1.00 0.00 H ATOM 68435 H14S PA 1654 5.605 92.946 36.161 1.00 0.00 H ATOM 68436 C113 PA 1654 5.199 92.356 34.120 1.00 0.00 C ATOM 68437 H13R PA 1654 4.132 92.584 34.172 1.00 0.00 H ATOM 68438 H13S PA 1654 5.396 91.452 33.541 1.00 0.00 H ATOM 68439 C112 PA 1654 5.884 93.486 33.282 1.00 0.00 C ATOM 68440 H12R PA 1654 5.410 93.657 32.313 1.00 0.00 H ATOM 68441 H12S PA 1654 6.915 93.145 33.167 1.00 0.00 H ATOM 68442 C111 PA 1654 6.036 94.863 34.019 1.00 0.00 C ATOM 68443 H11R PA 1654 6.580 94.614 34.933 1.00 0.00 H ATOM 68444 H11S PA 1654 5.052 95.127 34.411 1.00 0.00 H ATOM 68445 C110 PA 1654 6.622 95.914 33.164 1.00 0.00 C ATOM 68446 H10R PA 1654 7.423 95.454 32.580 1.00 0.00 H ATOM 68447 H10S PA 1654 7.024 96.719 33.782 1.00 0.00 H ATOM 68448 C19 PA 1654 5.580 96.490 32.217 1.00 0.00 C ATOM 68449 H9R PA 1654 4.832 96.927 32.882 1.00 0.00 H ATOM 68450 H9S PA 1654 5.097 95.736 31.591 1.00 0.00 H ATOM 68451 C18 PA 1654 6.129 97.586 31.224 1.00 0.00 C ATOM 68452 H8R PA 1654 6.475 98.437 31.815 1.00 0.00 H ATOM 68453 H8S PA 1654 5.312 97.905 30.574 1.00 0.00 H ATOM 68454 C17 PA 1654 7.235 97.005 30.302 1.00 0.00 C ATOM 68455 H7R PA 1654 7.060 95.997 29.920 1.00 0.00 H ATOM 68456 H7S PA 1654 8.174 96.989 30.859 1.00 0.00 H ATOM 68457 C16 PA 1654 7.679 97.912 29.173 1.00 0.00 C ATOM 68458 H6R PA 1654 8.106 98.688 29.813 1.00 0.00 H ATOM 68459 H6S PA 1654 6.881 98.292 28.531 1.00 0.00 H ATOM 68460 C15 PA 1654 8.781 97.279 28.319 1.00 0.00 C ATOM 68461 H5R PA 1654 8.392 96.440 27.738 1.00 0.00 H ATOM 68462 H5S PA 1654 9.640 96.909 28.884 1.00 0.00 H ATOM 68463 C14 PA 1654 9.389 98.290 27.341 1.00 0.00 C ATOM 68464 H4R PA 1654 10.129 97.811 26.697 1.00 0.00 H ATOM 68465 H4S PA 1654 9.924 99.067 27.892 1.00 0.00 H ATOM 68466 C13 PA 1654 8.377 98.883 26.321 1.00 0.00 C ATOM 68467 H3R PA 1654 7.603 99.361 26.925 1.00 0.00 H ATOM 68468 H3S PA 1654 7.849 98.080 25.803 1.00 0.00 H ATOM 68469 C12 PA 1654 8.772 99.945 25.353 1.00 0.00 C ATOM 68470 H2R PA 1654 9.559 99.587 24.687 1.00 0.00 H ATOM 68471 H2S PA 1654 9.208 100.883 25.703 1.00 0.00 H ATOM 68472 C11 PGR 1655 7.528 100.344 24.476 1.00 0.00 C ATOM 68473 O12 PGR 1655 7.367 100.144 23.267 1.00 0.00 O ATOM 68474 O11 PGR 1655 6.619 100.937 25.193 1.00 0.00 O ATOM 68475 C1 PGR 1655 5.240 101.213 24.693 1.00 0.00 C ATOM 68476 HR PGR 1655 5.380 101.827 23.799 1.00 0.00 H ATOM 68477 HS PGR 1655 4.683 101.758 25.459 1.00 0.00 H ATOM 68478 C2 PGR 1655 4.498 99.905 24.273 1.00 0.00 C ATOM 68479 HX PGR 1655 5.163 99.131 23.881 1.00 0.00 H ATOM 68480 C3 PGR 1655 3.300 100.191 23.272 1.00 0.00 C ATOM 68481 HA PGR 1655 3.654 100.667 22.354 1.00 0.00 H ATOM 68482 HB PGR 1655 2.695 100.939 23.790 1.00 0.00 H ATOM 68483 O31 PGR 1655 2.456 99.158 22.978 1.00 0.00 O ATOM 68484 P31 PGR 1655 2.655 98.092 21.807 1.00 0.00 P ATOM 68485 O32 PGR 1655 3.677 97.111 22.442 1.00 0.00 O ATOM 68486 C31 PGR 1655 3.358 95.983 23.305 1.00 0.00 C ATOM 68487 H1A PGR 1655 2.572 96.264 24.010 1.00 0.00 H ATOM 68488 H1B PGR 1655 4.241 95.824 23.929 1.00 0.00 H ATOM 68489 C32 PGR 1655 2.909 94.736 22.505 1.00 0.00 C ATOM 68490 H2A PGR 1655 3.340 94.600 21.510 1.00 0.00 H ATOM 68491 O35 PGR 1655 1.496 94.899 22.269 1.00 0.00 O ATOM 68492 HO5A PGR 1655 1.520 95.733 21.766 1.00 0.00 H ATOM 68493 C33 PGR 1655 3.092 93.501 23.328 1.00 0.00 C ATOM 68494 H3A PGR 1655 2.620 92.617 22.893 1.00 0.00 H ATOM 68495 H3B PGR 1655 4.175 93.388 23.426 1.00 0.00 H ATOM 68496 O33 PGR 1655 1.321 97.458 21.720 1.00 0.00 O ATOM 68497 O34 PGR 1655 3.212 98.705 20.593 1.00 0.00 O ATOM 68498 O21 PGR 1655 3.916 99.346 25.484 1.00 0.00 O ATOM 68499 C21 PGR 1655 4.558 98.448 26.242 1.00 0.00 C ATOM 68500 O22 PGR 1655 5.477 97.727 25.843 1.00 0.00 O ATOM 68501 O36 PGR 1655 2.393 93.571 24.621 1.00 0.00 O ATOM 68502 HO6A PGR 1655 1.451 93.536 24.376 1.00 0.00 H ATOM 68503 C12 OL 1656 4.105 98.389 27.649 1.00 0.00 C ATOM 68504 H2R OL 1656 4.292 97.400 28.073 1.00 0.00 H ATOM 68505 H2S OL 1656 4.615 99.140 28.255 1.00 0.00 H ATOM 68506 C13 OL 1656 2.677 98.928 27.857 1.00 0.00 C ATOM 68507 H3R OL 1656 2.525 99.855 27.301 1.00 0.00 H ATOM 68508 H3S OL 1656 2.024 98.248 27.305 1.00 0.00 H ATOM 68509 C14 OL 1656 2.204 99.032 29.325 1.00 0.00 C ATOM 68510 H4R OL 1656 2.800 98.244 29.790 1.00 0.00 H ATOM 68511 H4S OL 1656 2.562 99.901 29.883 1.00 0.00 H ATOM 68512 C15 OL 1656 0.672 98.976 29.564 1.00 0.00 C ATOM 68513 H5R OL 1656 0.261 99.808 28.987 1.00 0.00 H ATOM 68514 H5S OL 1656 0.328 97.988 29.250 1.00 0.00 H ATOM 68515 C16 OL 1656 0.195 99.166 31.069 1.00 0.00 C ATOM 68516 H6R OL 1656 0.414 100.188 31.385 1.00 0.00 H ATOM 68517 H6S OL 1656 -0.893 99.200 30.977 1.00 0.00 H ATOM 68518 C17 OL 1656 0.637 98.153 32.101 1.00 0.00 C ATOM 68519 H7R OL 1656 -0.275 97.895 32.643 1.00 0.00 H ATOM 68520 H7S OL 1656 1.008 97.279 31.562 1.00 0.00 H ATOM 68521 C18 OL 1656 1.646 98.749 33.089 1.00 0.00 C ATOM 68522 H8R OL 1656 2.487 99.147 32.518 1.00 0.00 H ATOM 68523 H8S OL 1656 1.019 99.467 33.624 1.00 0.00 H ATOM 68524 C19 OL 1656 2.210 97.732 33.985 1.00 0.00 C ATOM 68525 H9R OL 1656 3.225 97.379 33.819 1.00 0.00 H ATOM 68526 C110 OL 1656 1.563 97.113 35.023 1.00 0.00 C ATOM 68527 H10R OL 1656 2.070 96.322 35.569 1.00 0.00 H ATOM 68528 C111 OL 1656 0.213 97.479 35.529 1.00 0.00 C ATOM 68529 H11R OL 1656 -0.235 98.299 34.963 1.00 0.00 H ATOM 68530 H11S OL 1656 -0.465 96.628 35.437 1.00 0.00 H ATOM 68531 C112 OL 1656 0.139 97.813 37.065 1.00 0.00 C ATOM 68532 H12R OL 1656 -0.840 98.184 37.374 1.00 0.00 H ATOM 68533 H12S OL 1656 0.515 97.090 37.792 1.00 0.00 H ATOM 68534 C113 OL 1656 1.087 99.020 37.273 1.00 0.00 C ATOM 68535 H13R OL 1656 1.004 99.149 38.354 1.00 0.00 H ATOM 68536 H13S OL 1656 2.132 98.840 37.009 1.00 0.00 H ATOM 68537 C114 OL 1656 0.599 100.405 36.650 1.00 0.00 C ATOM 68538 H14R OL 1656 0.144 100.258 35.669 1.00 0.00 H ATOM 68539 H14S OL 1656 -0.094 100.874 37.352 1.00 0.00 H ATOM 68540 C115 OL 1656 1.695 101.488 36.432 1.00 0.00 C ATOM 68541 H15R OL 1656 1.950 101.946 37.390 1.00 0.00 H ATOM 68542 H15S OL 1656 2.600 100.929 36.185 1.00 0.00 H ATOM 68543 C116 OL 1656 1.557 102.558 35.331 1.00 0.00 C ATOM 68544 H16R OL 1656 1.483 102.134 34.327 1.00 0.00 H ATOM 68545 H16S OL 1656 0.576 103.002 35.513 1.00 0.00 H ATOM 68546 C117 OL 1656 2.773 103.533 35.297 1.00 0.00 C ATOM 68547 H17R OL 1656 2.414 104.347 35.931 1.00 0.00 H ATOM 68548 H17S OL 1656 3.542 103.011 35.869 1.00 0.00 H ATOM 68549 C118 OL 1656 3.265 103.982 33.935 1.00 0.00 C ATOM 68550 H18R OL 1656 3.199 103.248 33.130 1.00 0.00 H ATOM 68551 H18S OL 1656 4.319 104.263 33.999 1.00 0.00 H ATOM 68552 H18T OL 1656 2.653 104.774 33.500 1.00 0.00 H TER 68553 OL 1656 ATOM 68553 C116 PA 1657 142.636 49.250 35.426 1.00 0.00 C ATOM 68554 H16R PA 1657 143.558 49.071 35.984 1.00 0.00 H ATOM 68555 H16S PA 1657 141.868 49.184 36.199 1.00 0.00 H ATOM 68556 H16T PA 1657 142.720 50.179 34.859 1.00 0.00 H ATOM 68557 C115 PA 1657 142.196 48.133 34.432 1.00 0.00 C ATOM 68558 H15R PA 1657 141.201 48.256 34.000 1.00 0.00 H ATOM 68559 H15S PA 1657 142.047 47.208 34.993 1.00 0.00 H ATOM 68560 C114 PA 1657 143.236 47.988 33.288 1.00 0.00 C ATOM 68561 H14R PA 1657 144.261 47.730 33.561 1.00 0.00 H ATOM 68562 H14S PA 1657 143.427 48.893 32.708 1.00 0.00 H ATOM 68563 C113 PA 1657 142.858 46.915 32.293 1.00 0.00 C ATOM 68564 H13R PA 1657 143.513 47.027 31.427 1.00 0.00 H ATOM 68565 H13S PA 1657 141.872 46.890 31.825 1.00 0.00 H ATOM 68566 C112 PA 1657 142.951 45.560 33.005 1.00 0.00 C ATOM 68567 H12R PA 1657 142.009 45.322 33.502 1.00 0.00 H ATOM 68568 H12S PA 1657 143.697 45.439 33.793 1.00 0.00 H ATOM 68569 C111 PA 1657 143.348 44.405 32.051 1.00 0.00 C ATOM 68570 H11R PA 1657 143.711 43.505 32.550 1.00 0.00 H ATOM 68571 H11S PA 1657 144.131 44.731 31.364 1.00 0.00 H ATOM 68572 C110 PA 1657 142.161 44.085 31.185 1.00 0.00 C ATOM 68573 H10R PA 1657 141.479 44.870 30.853 1.00 0.00 H ATOM 68574 H10S PA 1657 141.439 43.605 31.848 1.00 0.00 H ATOM 68575 C19 PA 1657 142.484 43.164 29.992 1.00 0.00 C ATOM 68576 H9R PA 1657 143.212 42.379 30.206 1.00 0.00 H ATOM 68577 H9S PA 1657 142.951 43.902 29.337 1.00 0.00 H ATOM 68578 C18 PA 1657 141.294 42.563 29.378 1.00 0.00 C ATOM 68579 H8R PA 1657 140.581 43.374 29.217 1.00 0.00 H ATOM 68580 H8S PA 1657 140.651 41.880 29.937 1.00 0.00 H ATOM 68581 C17 PA 1657 141.606 41.948 27.970 1.00 0.00 C ATOM 68582 H7R PA 1657 142.628 42.178 27.661 1.00 0.00 H ATOM 68583 H7S PA 1657 140.981 42.489 27.256 1.00 0.00 H ATOM 68584 C16 PA 1657 141.274 40.446 27.826 1.00 0.00 C ATOM 68585 H6R PA 1657 140.288 40.196 28.221 1.00 0.00 H ATOM 68586 H6S PA 1657 142.021 39.955 28.453 1.00 0.00 H ATOM 68587 C15 PA 1657 141.320 40.046 26.366 1.00 0.00 C ATOM 68588 H5R PA 1657 142.131 40.488 25.782 1.00 0.00 H ATOM 68589 H5S PA 1657 140.457 40.455 25.836 1.00 0.00 H ATOM 68590 C14 PA 1657 141.144 38.540 26.194 1.00 0.00 C ATOM 68591 H4R PA 1657 140.385 38.240 26.919 1.00 0.00 H ATOM 68592 H4S PA 1657 142.107 38.094 26.455 1.00 0.00 H ATOM 68593 C13 PA 1657 140.904 37.932 24.857 1.00 0.00 C ATOM 68594 H3R PA 1657 141.121 36.862 24.835 1.00 0.00 H ATOM 68595 H3S PA 1657 141.640 38.383 24.188 1.00 0.00 H ATOM 68596 C12 PA 1657 139.574 38.246 24.253 1.00 0.00 C ATOM 68597 H2R PA 1657 139.279 39.292 24.144 1.00 0.00 H ATOM 68598 H2S PA 1657 138.855 37.864 24.981 1.00 0.00 H ATOM 68599 C11 PGR 1658 139.455 37.545 22.946 1.00 0.00 C ATOM 68600 O12 PGR 1658 140.072 37.725 21.966 1.00 0.00 O ATOM 68601 O11 PGR 1658 138.495 36.583 23.011 1.00 0.00 O ATOM 68602 C1 PGR 1658 138.262 35.807 21.766 1.00 0.00 C ATOM 68603 HR PGR 1658 138.136 34.758 22.045 1.00 0.00 H ATOM 68604 HS PGR 1658 139.107 35.716 21.078 1.00 0.00 H ATOM 68605 C2 PGR 1658 136.983 36.232 21.053 1.00 0.00 C ATOM 68606 HX PGR 1658 136.611 35.411 20.435 1.00 0.00 H ATOM 68607 C3 PGR 1658 137.408 37.402 20.153 1.00 0.00 C ATOM 68608 HA PGR 1658 138.228 37.136 19.481 1.00 0.00 H ATOM 68609 HB PGR 1658 137.666 38.184 20.872 1.00 0.00 H ATOM 68610 O31 PGR 1658 136.316 37.782 19.346 1.00 0.00 O ATOM 68611 P31 PGR 1658 135.932 36.961 18.069 1.00 0.00 P ATOM 68612 O32 PGR 1658 135.064 35.722 18.598 1.00 0.00 O ATOM 68613 C31 PGR 1658 133.856 35.988 19.267 1.00 0.00 C ATOM 68614 H1A PGR 1658 134.028 36.403 20.263 1.00 0.00 H ATOM 68615 H1B PGR 1658 133.292 36.751 18.724 1.00 0.00 H ATOM 68616 C32 PGR 1658 133.074 34.674 19.446 1.00 0.00 C ATOM 68617 H2A PGR 1658 133.853 34.016 19.838 1.00 0.00 H ATOM 68618 O35 PGR 1658 132.494 34.277 18.203 1.00 0.00 O ATOM 68619 HO5A PGR 1658 132.128 33.412 18.460 1.00 0.00 H ATOM 68620 C33 PGR 1658 131.908 34.848 20.436 1.00 0.00 C ATOM 68621 H3A PGR 1658 131.094 34.148 20.228 1.00 0.00 H ATOM 68622 H3B PGR 1658 132.249 34.645 21.454 1.00 0.00 H ATOM 68623 O33 PGR 1658 134.986 37.751 17.286 1.00 0.00 O ATOM 68624 O34 PGR 1658 137.127 36.471 17.463 1.00 0.00 O ATOM 68625 O21 PGR 1658 136.048 36.709 21.961 1.00 0.00 O ATOM 68626 C21 PGR 1658 135.524 35.861 22.903 1.00 0.00 C ATOM 68627 O22 PGR 1658 135.802 34.685 22.868 1.00 0.00 O ATOM 68628 O36 PGR 1658 131.278 36.091 20.436 1.00 0.00 O ATOM 68629 HO6A PGR 1658 131.177 36.321 19.495 1.00 0.00 H ATOM 68630 C12 OL 1659 134.518 36.440 23.830 1.00 0.00 C ATOM 68631 H2R OL 1659 133.574 36.399 23.283 1.00 0.00 H ATOM 68632 H2S OL 1659 134.631 35.790 24.700 1.00 0.00 H ATOM 68633 C13 OL 1659 134.900 37.772 24.325 1.00 0.00 C ATOM 68634 H3R OL 1659 135.917 37.913 24.698 1.00 0.00 H ATOM 68635 H3S OL 1659 134.771 38.592 23.615 1.00 0.00 H ATOM 68636 C14 OL 1659 134.065 38.234 25.535 1.00 0.00 C ATOM 68637 H4R OL 1659 133.037 38.397 25.206 1.00 0.00 H ATOM 68638 H4S OL 1659 134.012 37.576 26.404 1.00 0.00 H ATOM 68639 C15 OL 1659 134.624 39.534 26.173 1.00 0.00 C ATOM 68640 H5R OL 1659 135.580 39.174 26.558 1.00 0.00 H ATOM 68641 H5S OL 1659 134.891 40.332 25.477 1.00 0.00 H ATOM 68642 C16 OL 1659 133.722 40.013 27.378 1.00 0.00 C ATOM 68643 H6R OL 1659 132.678 39.976 27.061 1.00 0.00 H ATOM 68644 H6S OL 1659 133.817 39.179 28.077 1.00 0.00 H ATOM 68645 C17 OL 1659 134.152 41.358 27.967 1.00 0.00 C ATOM 68646 H7R OL 1659 133.768 42.100 27.264 1.00 0.00 H ATOM 68647 H7S OL 1659 133.565 41.590 28.857 1.00 0.00 H ATOM 68648 C18 OL 1659 135.643 41.723 28.257 1.00 0.00 C ATOM 68649 H8R OL 1659 136.214 41.520 27.349 1.00 0.00 H ATOM 68650 H8S OL 1659 135.937 42.739 28.528 1.00 0.00 H ATOM 68651 C19 OL 1659 136.135 40.749 29.233 1.00 0.00 C ATOM 68652 H9R OL 1659 135.738 39.751 29.066 1.00 0.00 H ATOM 68653 C110 OL 1659 136.928 40.783 30.361 1.00 0.00 C ATOM 68654 H10R OL 1659 137.159 39.900 30.952 1.00 0.00 H ATOM 68655 C111 OL 1659 137.658 41.992 30.801 1.00 0.00 C ATOM 68656 H11R OL 1659 138.719 42.000 30.543 1.00 0.00 H ATOM 68657 H11S OL 1659 137.313 42.830 30.192 1.00 0.00 H ATOM 68658 C112 OL 1659 137.495 42.339 32.222 1.00 0.00 C ATOM 68659 H12R OL 1659 136.596 42.956 32.286 1.00 0.00 H ATOM 68660 H12S OL 1659 137.268 41.474 32.850 1.00 0.00 H ATOM 68661 C113 OL 1659 138.603 43.189 32.773 1.00 0.00 C ATOM 68662 H13R OL 1659 139.593 42.776 32.569 1.00 0.00 H ATOM 68663 H13S OL 1659 138.624 44.136 32.229 1.00 0.00 H ATOM 68664 C114 OL 1659 138.541 43.574 34.233 1.00 0.00 C ATOM 68665 H14R OL 1659 138.270 42.784 34.937 1.00 0.00 H ATOM 68666 H14S OL 1659 139.561 43.897 34.451 1.00 0.00 H ATOM 68667 C115 OL 1659 137.534 44.660 34.423 1.00 0.00 C ATOM 68668 H15R OL 1659 137.486 45.352 33.580 1.00 0.00 H ATOM 68669 H15S OL 1659 136.494 44.330 34.399 1.00 0.00 H ATOM 68670 C116 OL 1659 137.794 45.247 35.790 1.00 0.00 C ATOM 68671 H16R OL 1659 137.061 46.006 36.072 1.00 0.00 H ATOM 68672 H16S OL 1659 137.723 44.377 36.447 1.00 0.00 H ATOM 68673 C117 OL 1659 139.127 46.071 35.905 1.00 0.00 C ATOM 68674 H17R OL 1659 139.994 45.474 35.613 1.00 0.00 H ATOM 68675 H17S OL 1659 139.077 46.960 35.273 1.00 0.00 H ATOM 68676 C118 OL 1659 139.384 46.531 37.374 1.00 0.00 C ATOM 68677 H18R OL 1659 140.400 46.931 37.344 1.00 0.00 H ATOM 68678 H18S OL 1659 139.297 45.650 38.012 1.00 0.00 H ATOM 68679 H18T OL 1659 138.668 47.260 37.761 1.00 0.00 H TER 68680 OL 1659 ATOM 68680 C116 PA 1660 128.396 61.352 36.463 1.00 0.00 C ATOM 68681 H16R PA 1660 127.316 61.378 36.306 1.00 0.00 H ATOM 68682 H16S PA 1660 128.588 60.584 37.215 1.00 0.00 H ATOM 68683 H16T PA 1660 128.871 61.167 35.497 1.00 0.00 H ATOM 68684 C115 PA 1660 128.868 62.697 37.002 1.00 0.00 C ATOM 68685 H15R PA 1660 129.951 62.737 37.135 1.00 0.00 H ATOM 68686 H15S PA 1660 128.395 62.902 37.964 1.00 0.00 H ATOM 68687 C114 PA 1660 128.693 63.811 35.964 1.00 0.00 C ATOM 68688 H14R PA 1660 129.073 64.682 36.503 1.00 0.00 H ATOM 68689 H14S PA 1660 127.617 63.983 35.895 1.00 0.00 H ATOM 68690 C113 PA 1660 129.226 63.629 34.552 1.00 0.00 C ATOM 68691 H13R PA 1660 128.621 64.288 33.926 1.00 0.00 H ATOM 68692 H13S PA 1660 129.036 62.636 34.138 1.00 0.00 H ATOM 68693 C112 PA 1660 130.705 63.881 34.399 1.00 0.00 C ATOM 68694 H12R PA 1660 130.674 64.309 33.395 1.00 0.00 H ATOM 68695 H12S PA 1660 131.138 62.895 34.217 1.00 0.00 H ATOM 68696 C111 PA 1660 131.465 64.756 35.425 1.00 0.00 C ATOM 68697 H11R PA 1660 131.192 64.702 36.481 1.00 0.00 H ATOM 68698 H11S PA 1660 131.336 65.796 35.118 1.00 0.00 H ATOM 68699 C110 PA 1660 132.974 64.471 35.351 1.00 0.00 C ATOM 68700 H10R PA 1660 133.322 64.490 34.316 1.00 0.00 H ATOM 68701 H10S PA 1660 133.210 63.462 35.698 1.00 0.00 H ATOM 68702 C19 PA 1660 133.907 65.563 36.007 1.00 0.00 C ATOM 68703 H9R PA 1660 134.932 65.393 35.670 1.00 0.00 H ATOM 68704 H9S PA 1660 133.897 65.456 37.093 1.00 0.00 H ATOM 68705 C18 PA 1660 133.492 67.044 35.673 1.00 0.00 C ATOM 68706 H8R PA 1660 134.138 67.825 36.079 1.00 0.00 H ATOM 68707 H8S PA 1660 132.542 67.299 36.147 1.00 0.00 H ATOM 68708 C17 PA 1660 133.367 67.402 34.239 1.00 0.00 C ATOM 68709 H7R PA 1660 132.984 68.424 34.226 1.00 0.00 H ATOM 68710 H7S PA 1660 132.591 66.778 33.791 1.00 0.00 H ATOM 68711 C16 PA 1660 134.774 67.444 33.499 1.00 0.00 C ATOM 68712 H6R PA 1660 135.270 66.503 33.744 1.00 0.00 H ATOM 68713 H6S PA 1660 135.404 68.217 33.944 1.00 0.00 H ATOM 68714 C15 PA 1660 134.544 67.419 31.978 1.00 0.00 C ATOM 68715 H5R PA 1660 134.135 66.476 31.608 1.00 0.00 H ATOM 68716 H5S PA 1660 135.554 67.382 31.565 1.00 0.00 H ATOM 68717 C14 PA 1660 133.771 68.565 31.461 1.00 0.00 C ATOM 68718 H4R PA 1660 134.060 69.503 31.941 1.00 0.00 H ATOM 68719 H4S PA 1660 132.697 68.552 31.658 1.00 0.00 H ATOM 68720 C13 PA 1660 134.015 68.595 29.953 1.00 0.00 C ATOM 68721 H3R PA 1660 133.697 67.660 29.488 1.00 0.00 H ATOM 68722 H3S PA 1660 135.104 68.619 29.879 1.00 0.00 H ATOM 68723 C12 PA 1660 133.185 69.678 29.188 1.00 0.00 C ATOM 68724 H2R PA 1660 133.418 70.650 29.628 1.00 0.00 H ATOM 68725 H2S PA 1660 132.108 69.522 29.285 1.00 0.00 H ATOM 68726 C11 PGR 1661 133.584 69.732 27.733 1.00 0.00 C ATOM 68727 O12 PGR 1661 132.802 69.770 26.780 1.00 0.00 O ATOM 68728 O11 PGR 1661 134.916 69.888 27.585 1.00 0.00 O ATOM 68729 C1 PGR 1661 135.490 69.707 26.373 1.00 0.00 C ATOM 68730 HR PGR 1661 134.870 70.148 25.588 1.00 0.00 H ATOM 68731 HS PGR 1661 135.745 68.682 26.089 1.00 0.00 H ATOM 68732 C2 PGR 1661 136.784 70.550 26.339 1.00 0.00 C ATOM 68733 HX PGR 1661 136.604 71.596 26.598 1.00 0.00 H ATOM 68734 C3 PGR 1661 137.432 70.587 24.931 1.00 0.00 C ATOM 68735 HA PGR 1661 136.815 70.983 24.120 1.00 0.00 H ATOM 68736 HB PGR 1661 137.807 69.586 24.706 1.00 0.00 H ATOM 68737 O31 PGR 1661 138.574 71.487 24.934 1.00 0.00 O ATOM 68738 P31 PGR 1661 138.348 73.008 24.518 1.00 0.00 P ATOM 68739 O32 PGR 1661 137.950 72.760 23.056 1.00 0.00 O ATOM 68740 C31 PGR 1661 138.715 72.170 22.052 1.00 0.00 C ATOM 68741 H1A PGR 1661 138.020 71.702 21.350 1.00 0.00 H ATOM 68742 H1B PGR 1661 139.368 71.383 22.436 1.00 0.00 H ATOM 68743 C32 PGR 1661 139.648 73.183 21.384 1.00 0.00 C ATOM 68744 H2A PGR 1661 139.882 72.686 20.439 1.00 0.00 H ATOM 68745 O35 PGR 1661 140.850 73.271 22.175 1.00 0.00 O ATOM 68746 HO5A PGR 1661 140.510 73.513 23.055 1.00 0.00 H ATOM 68747 C33 PGR 1661 138.930 74.582 21.290 1.00 0.00 C ATOM 68748 H3A PGR 1661 138.139 74.428 20.551 1.00 0.00 H ATOM 68749 H3B PGR 1661 138.341 74.882 22.160 1.00 0.00 H ATOM 68750 O33 PGR 1661 137.257 73.643 25.232 1.00 0.00 O ATOM 68751 O34 PGR 1661 139.676 73.705 24.510 1.00 0.00 O ATOM 68752 O21 PGR 1661 137.766 69.901 27.241 1.00 0.00 O ATOM 68753 C21 PGR 1661 137.603 70.009 28.538 1.00 0.00 C ATOM 68754 O22 PGR 1661 136.814 70.741 29.182 1.00 0.00 O ATOM 68755 O36 PGR 1661 139.733 75.611 20.721 1.00 0.00 O ATOM 68756 HO6A PGR 1661 139.204 76.268 20.235 1.00 0.00 H ATOM 68757 C12 OL 1662 138.488 69.019 29.253 1.00 0.00 C ATOM 68758 H2R OL 1662 138.190 68.456 30.140 1.00 0.00 H ATOM 68759 H2S OL 1662 138.666 68.135 28.637 1.00 0.00 H ATOM 68760 C13 OL 1662 139.877 69.689 29.539 1.00 0.00 C ATOM 68761 H3R OL 1662 139.794 70.582 30.161 1.00 0.00 H ATOM 68762 H3S OL 1662 140.603 69.003 29.981 1.00 0.00 H ATOM 68763 C14 OL 1662 140.627 70.154 28.289 1.00 0.00 C ATOM 68764 H4R OL 1662 140.772 69.400 27.513 1.00 0.00 H ATOM 68765 H4S OL 1662 140.130 71.034 27.874 1.00 0.00 H ATOM 68766 C15 OL 1662 142.041 70.714 28.695 1.00 0.00 C ATOM 68767 H5R OL 1662 142.442 71.291 27.858 1.00 0.00 H ATOM 68768 H5S OL 1662 141.801 71.315 29.574 1.00 0.00 H ATOM 68769 C16 OL 1662 143.037 69.557 28.996 1.00 0.00 C ATOM 68770 H6R OL 1662 142.519 68.748 29.514 1.00 0.00 H ATOM 68771 H6S OL 1662 143.302 69.200 27.999 1.00 0.00 H ATOM 68772 C17 OL 1662 144.298 69.929 29.739 1.00 0.00 C ATOM 68773 H7R OL 1662 144.975 70.387 29.014 1.00 0.00 H ATOM 68774 H7S OL 1662 144.061 70.597 30.569 1.00 0.00 H ATOM 68775 C18 OL 1662 145.064 68.816 30.281 1.00 0.00 C ATOM 68776 H8R OL 1662 144.381 68.268 30.935 1.00 0.00 H ATOM 68777 H8S OL 1662 145.280 68.185 29.417 1.00 0.00 H ATOM 68778 C19 OL 1662 146.343 69.191 30.964 1.00 0.00 C ATOM 68779 H9R OL 1662 147.017 69.726 30.299 1.00 0.00 H ATOM 68780 C110 OL 1662 146.651 68.954 32.240 1.00 0.00 C ATOM 68781 H10R OL 1662 147.632 69.325 32.524 1.00 0.00 H ATOM 68782 C111 OL 1662 145.787 68.345 33.257 1.00 0.00 C ATOM 68783 H11R OL 1662 144.733 68.345 32.973 1.00 0.00 H ATOM 68784 H11S OL 1662 146.173 67.330 33.367 1.00 0.00 H ATOM 68785 C112 OL 1662 145.917 68.814 34.658 1.00 0.00 C ATOM 68786 H12R OL 1662 145.403 68.113 35.319 1.00 0.00 H ATOM 68787 H12S OL 1662 146.989 68.780 34.864 1.00 0.00 H ATOM 68788 C113 OL 1662 145.340 70.179 34.902 1.00 0.00 C ATOM 68789 H13R OL 1662 146.118 70.891 34.618 1.00 0.00 H ATOM 68790 H13S OL 1662 144.446 70.452 34.337 1.00 0.00 H ATOM 68791 C114 OL 1662 145.354 70.465 36.373 1.00 0.00 C ATOM 68792 H14R OL 1662 144.836 69.736 36.999 1.00 0.00 H ATOM 68793 H14S OL 1662 146.389 70.357 36.706 1.00 0.00 H ATOM 68794 C115 OL 1662 144.808 71.879 36.748 1.00 0.00 C ATOM 68795 H15R OL 1662 143.786 71.856 36.364 1.00 0.00 H ATOM 68796 H15S OL 1662 144.817 71.965 37.837 1.00 0.00 H ATOM 68797 C116 OL 1662 145.576 73.136 36.201 1.00 0.00 C ATOM 68798 H16R OL 1662 145.640 73.158 35.111 1.00 0.00 H ATOM 68799 H16S OL 1662 144.936 73.981 36.466 1.00 0.00 H ATOM 68800 C117 OL 1662 146.941 73.272 36.723 1.00 0.00 C ATOM 68801 H17R OL 1662 146.872 73.286 37.812 1.00 0.00 H ATOM 68802 H17S OL 1662 147.564 72.425 36.427 1.00 0.00 H ATOM 68803 C118 OL 1662 147.538 74.514 36.267 1.00 0.00 C ATOM 68804 H18R OL 1662 148.557 74.556 36.658 1.00 0.00 H ATOM 68805 H18S OL 1662 147.078 75.402 36.705 1.00 0.00 H ATOM 68806 H18T OL 1662 147.479 74.585 35.179 1.00 0.00 H TER 68807 OL 1662 ATOM 68807 C116 PA 1663 44.453 25.130 41.737 1.00 0.00 C ATOM 68808 H16R PA 1663 44.346 25.895 40.965 1.00 0.00 H ATOM 68809 H16S PA 1663 44.041 25.563 42.651 1.00 0.00 H ATOM 68810 H16T PA 1663 43.707 24.401 41.415 1.00 0.00 H ATOM 68811 C115 PA 1663 45.866 24.583 41.902 1.00 0.00 C ATOM 68812 H15R PA 1663 45.894 23.945 42.788 1.00 0.00 H ATOM 68813 H15S PA 1663 46.460 25.468 42.140 1.00 0.00 H ATOM 68814 C114 PA 1663 46.440 23.809 40.730 1.00 0.00 C ATOM 68815 H14R PA 1663 46.135 24.295 39.800 1.00 0.00 H ATOM 68816 H14S PA 1663 45.904 22.859 40.670 1.00 0.00 H ATOM 68817 C113 PA 1663 47.924 23.600 40.901 1.00 0.00 C ATOM 68818 H13R PA 1663 48.148 23.365 41.943 1.00 0.00 H ATOM 68819 H13S PA 1663 48.337 24.582 40.660 1.00 0.00 H ATOM 68820 C112 PA 1663 48.494 22.586 39.887 1.00 0.00 C ATOM 68821 H12R PA 1663 48.103 21.582 40.061 1.00 0.00 H ATOM 68822 H12S PA 1663 49.557 22.428 40.082 1.00 0.00 H ATOM 68823 C111 PA 1663 48.395 23.005 38.395 1.00 0.00 C ATOM 68824 H11R PA 1663 48.906 23.970 38.414 1.00 0.00 H ATOM 68825 H11S PA 1663 47.366 23.220 38.099 1.00 0.00 H ATOM 68826 C110 PA 1663 49.070 22.081 37.476 1.00 0.00 C ATOM 68827 H10R PA 1663 48.728 21.053 37.608 1.00 0.00 H ATOM 68828 H10S PA 1663 50.089 22.070 37.868 1.00 0.00 H ATOM 68829 C19 PA 1663 49.012 22.419 36.043 1.00 0.00 C ATOM 68830 H9R PA 1663 49.608 23.328 35.934 1.00 0.00 H ATOM 68831 H9S PA 1663 48.032 22.632 35.610 1.00 0.00 H ATOM 68832 C18 PA 1663 49.607 21.325 35.194 1.00 0.00 C ATOM 68833 H8R PA 1663 48.966 20.442 35.227 1.00 0.00 H ATOM 68834 H8S PA 1663 50.618 21.039 35.492 1.00 0.00 H ATOM 68835 C17 PA 1663 49.723 21.791 33.722 1.00 0.00 C ATOM 68836 H7R PA 1663 50.427 22.624 33.666 1.00 0.00 H ATOM 68837 H7S PA 1663 48.748 22.067 33.315 1.00 0.00 H ATOM 68838 C16 PA 1663 50.099 20.692 32.764 1.00 0.00 C ATOM 68839 H6R PA 1663 49.273 20.003 32.577 1.00 0.00 H ATOM 68840 H6S PA 1663 50.813 20.136 33.375 1.00 0.00 H ATOM 68841 C15 PA 1663 50.776 21.161 31.493 1.00 0.00 C ATOM 68842 H5R PA 1663 51.271 20.276 31.087 1.00 0.00 H ATOM 68843 H5S PA 1663 51.554 21.810 31.901 1.00 0.00 H ATOM 68844 C14 PA 1663 49.973 21.879 30.481 1.00 0.00 C ATOM 68845 H4R PA 1663 49.966 22.888 30.897 1.00 0.00 H ATOM 68846 H4S PA 1663 48.987 21.410 30.524 1.00 0.00 H ATOM 68847 C13 PA 1663 50.540 21.921 29.096 1.00 0.00 C ATOM 68848 H3R PA 1663 49.954 22.670 28.560 1.00 0.00 H ATOM 68849 H3S PA 1663 50.428 20.975 28.562 1.00 0.00 H ATOM 68850 C12 PA 1663 52.074 22.178 28.912 1.00 0.00 C ATOM 68851 H2R PA 1663 52.578 21.318 29.358 1.00 0.00 H ATOM 68852 H2S PA 1663 52.259 23.101 29.466 1.00 0.00 H ATOM 68853 C11 PGR 1664 52.398 22.323 27.389 1.00 0.00 C ATOM 68854 O12 PGR 1664 51.685 21.904 26.446 1.00 0.00 O ATOM 68855 O11 PGR 1664 53.640 22.811 27.283 1.00 0.00 O ATOM 68856 C1 PGR 1664 54.172 22.812 25.957 1.00 0.00 C ATOM 68857 HR PGR 1664 53.633 23.589 25.409 1.00 0.00 H ATOM 68858 HS PGR 1664 54.144 21.845 25.449 1.00 0.00 H ATOM 68859 C2 PGR 1664 55.625 23.240 26.165 1.00 0.00 C ATOM 68860 HX PGR 1664 55.755 24.074 26.860 1.00 0.00 H ATOM 68861 C3 PGR 1664 56.074 23.799 24.710 1.00 0.00 C ATOM 68862 HA PGR 1664 57.049 24.289 24.774 1.00 0.00 H ATOM 68863 HB PGR 1664 55.451 24.624 24.356 1.00 0.00 H ATOM 68864 O31 PGR 1664 56.035 22.743 23.659 1.00 0.00 O ATOM 68865 P31 PGR 1664 56.931 22.958 22.311 1.00 0.00 P ATOM 68866 O32 PGR 1664 56.056 23.896 21.302 1.00 0.00 O ATOM 68867 C31 PGR 1664 54.948 23.261 20.652 1.00 0.00 C ATOM 68868 H1A PGR 1664 54.412 22.563 21.301 1.00 0.00 H ATOM 68869 H1B PGR 1664 55.207 22.785 19.703 1.00 0.00 H ATOM 68870 C32 PGR 1664 53.956 24.331 20.261 1.00 0.00 C ATOM 68871 H2A PGR 1664 52.978 23.878 20.080 1.00 0.00 H ATOM 68872 O35 PGR 1664 54.325 24.907 19.009 1.00 0.00 O ATOM 68873 HO5A PGR 1664 55.120 25.433 19.209 1.00 0.00 H ATOM 68874 C33 PGR 1664 53.865 25.424 21.353 1.00 0.00 C ATOM 68875 H3A PGR 1664 54.033 25.067 22.373 1.00 0.00 H ATOM 68876 H3B PGR 1664 54.736 26.041 21.118 1.00 0.00 H ATOM 68877 O33 PGR 1664 58.145 23.736 22.649 1.00 0.00 O ATOM 68878 O34 PGR 1664 57.020 21.689 21.701 1.00 0.00 O ATOM 68879 O21 PGR 1664 56.476 22.110 26.576 1.00 0.00 O ATOM 68880 C21 PGR 1664 57.759 22.382 26.782 1.00 0.00 C ATOM 68881 O22 PGR 1664 58.337 23.444 26.544 1.00 0.00 O ATOM 68882 O36 PGR 1664 52.682 26.185 21.110 1.00 0.00 O ATOM 68883 HO6A PGR 1664 51.909 25.616 21.277 1.00 0.00 H ATOM 68884 C12 OL 1665 58.484 21.187 27.369 1.00 0.00 C ATOM 68885 H2R OL 1665 57.818 20.325 27.441 1.00 0.00 H ATOM 68886 H2S OL 1665 59.210 20.877 26.614 1.00 0.00 H ATOM 68887 C13 OL 1665 59.294 21.468 28.706 1.00 0.00 C ATOM 68888 H3R OL 1665 59.736 20.495 28.931 1.00 0.00 H ATOM 68889 H3S OL 1665 60.078 22.225 28.645 1.00 0.00 H ATOM 68890 C14 OL 1665 58.410 21.811 29.937 1.00 0.00 C ATOM 68891 H4R OL 1665 57.794 22.678 29.693 1.00 0.00 H ATOM 68892 H4S OL 1665 57.787 20.966 30.238 1.00 0.00 H ATOM 68893 C15 OL 1665 59.273 22.178 31.130 1.00 0.00 C ATOM 68894 H5R OL 1665 59.330 23.268 31.094 1.00 0.00 H ATOM 68895 H5S OL 1665 58.692 22.040 32.044 1.00 0.00 H ATOM 68896 C16 OL 1665 60.492 21.428 31.428 1.00 0.00 C ATOM 68897 H6R OL 1665 60.180 20.385 31.513 1.00 0.00 H ATOM 68898 H6S OL 1665 61.150 21.559 30.567 1.00 0.00 H ATOM 68899 C17 OL 1665 61.301 21.875 32.684 1.00 0.00 C ATOM 68900 H7R OL 1665 62.246 21.336 32.780 1.00 0.00 H ATOM 68901 H7S OL 1665 61.540 22.938 32.609 1.00 0.00 H ATOM 68902 C18 OL 1665 60.574 21.516 34.015 1.00 0.00 C ATOM 68903 H8R OL 1665 61.202 21.917 34.813 1.00 0.00 H ATOM 68904 H8S OL 1665 59.609 22.021 33.937 1.00 0.00 H ATOM 68905 C19 OL 1665 60.411 19.985 34.173 1.00 0.00 C ATOM 68906 H9R OL 1665 61.292 19.357 34.284 1.00 0.00 H ATOM 68907 C110 OL 1665 59.311 19.249 34.128 1.00 0.00 C ATOM 68908 H10R OL 1665 59.376 18.164 34.112 1.00 0.00 H ATOM 68909 C111 OL 1665 57.962 19.717 33.939 1.00 0.00 C ATOM 68910 H11R OL 1665 57.542 19.724 34.947 1.00 0.00 H ATOM 68911 H11S OL 1665 57.855 20.785 33.736 1.00 0.00 H ATOM 68912 C112 OL 1665 57.234 18.964 32.776 1.00 0.00 C ATOM 68913 H12R OL 1665 56.325 19.483 32.467 1.00 0.00 H ATOM 68914 H12S OL 1665 57.953 18.958 31.955 1.00 0.00 H ATOM 68915 C113 OL 1665 56.993 17.530 33.097 1.00 0.00 C ATOM 68916 H13R OL 1665 57.891 17.034 33.471 1.00 0.00 H ATOM 68917 H13S OL 1665 56.281 17.518 33.925 1.00 0.00 H ATOM 68918 C114 OL 1665 56.533 16.664 31.876 1.00 0.00 C ATOM 68919 H14R OL 1665 57.186 16.952 31.050 1.00 0.00 H ATOM 68920 H14S OL 1665 56.623 15.598 32.094 1.00 0.00 H ATOM 68921 C115 OL 1665 55.055 16.923 31.507 1.00 0.00 C ATOM 68922 H15R OL 1665 54.979 17.655 30.700 1.00 0.00 H ATOM 68923 H15S OL 1665 54.627 15.986 31.145 1.00 0.00 H ATOM 68924 C116 OL 1665 54.078 17.335 32.603 1.00 0.00 C ATOM 68925 H16R OL 1665 54.339 18.266 33.111 1.00 0.00 H ATOM 68926 H16S OL 1665 53.158 17.392 32.017 1.00 0.00 H ATOM 68927 C117 OL 1665 53.833 16.104 33.508 1.00 0.00 C ATOM 68928 H17R OL 1665 53.122 15.604 32.846 1.00 0.00 H ATOM 68929 H17S OL 1665 54.686 15.425 33.570 1.00 0.00 H ATOM 68930 C118 OL 1665 53.217 16.381 34.833 1.00 0.00 C ATOM 68931 H18R OL 1665 52.163 16.616 34.671 1.00 0.00 H ATOM 68932 H18S OL 1665 53.647 17.211 35.397 1.00 0.00 H ATOM 68933 H18T OL 1665 53.254 15.507 35.487 1.00 0.00 H TER 68934 OL 1665 ATOM 68934 C116 PA 1666 121.205 138.911 44.454 1.00 0.00 C ATOM 68935 H16R PA 1666 120.222 139.327 44.221 1.00 0.00 H ATOM 68936 H16S PA 1666 121.684 139.745 44.971 1.00 0.00 H ATOM 68937 H16T PA 1666 120.901 138.065 45.074 1.00 0.00 H ATOM 68938 C115 PA 1666 121.990 138.479 43.232 1.00 0.00 C ATOM 68939 H15R PA 1666 123.061 138.428 43.439 1.00 0.00 H ATOM 68940 H15S PA 1666 122.086 139.384 42.629 1.00 0.00 H ATOM 68941 C114 PA 1666 121.388 137.483 42.339 1.00 0.00 C ATOM 68942 H14R PA 1666 120.328 137.321 42.541 1.00 0.00 H ATOM 68943 H14S PA 1666 121.948 136.553 42.460 1.00 0.00 H ATOM 68944 C113 PA 1666 121.446 137.769 40.833 1.00 0.00 C ATOM 68945 H13R PA 1666 122.466 137.818 40.447 1.00 0.00 H ATOM 68946 H13S PA 1666 121.113 138.786 40.614 1.00 0.00 H ATOM 68947 C112 PA 1666 120.640 136.831 39.989 1.00 0.00 C ATOM 68948 H12R PA 1666 119.552 136.920 40.010 1.00 0.00 H ATOM 68949 H12S PA 1666 120.783 135.837 40.417 1.00 0.00 H ATOM 68950 C111 PA 1666 121.016 136.738 38.582 1.00 0.00 C ATOM 68951 H11R PA 1666 120.666 135.759 38.248 1.00 0.00 H ATOM 68952 H11S PA 1666 122.100 136.607 38.558 1.00 0.00 H ATOM 68953 C110 PA 1666 120.668 137.783 37.621 1.00 0.00 C ATOM 68954 H10R PA 1666 121.374 138.612 37.702 1.00 0.00 H ATOM 68955 H10S PA 1666 119.805 138.381 37.919 1.00 0.00 H ATOM 68956 C19 PA 1666 120.485 137.193 36.253 1.00 0.00 C ATOM 68957 H9R PA 1666 119.944 136.246 36.297 1.00 0.00 H ATOM 68958 H9S PA 1666 121.448 136.969 35.791 1.00 0.00 H ATOM 68959 C18 PA 1666 119.869 138.168 35.209 1.00 0.00 C ATOM 68960 H8R PA 1666 120.440 139.099 35.203 1.00 0.00 H ATOM 68961 H8S PA 1666 118.885 138.503 35.543 1.00 0.00 H ATOM 68962 C17 PA 1666 119.671 137.616 33.782 1.00 0.00 C ATOM 68963 H7R PA 1666 119.089 136.693 33.837 1.00 0.00 H ATOM 68964 H7S PA 1666 120.581 137.305 33.265 1.00 0.00 H ATOM 68965 C16 PA 1666 118.882 138.608 32.933 1.00 0.00 C ATOM 68966 H6R PA 1666 119.453 139.519 33.124 1.00 0.00 H ATOM 68967 H6S PA 1666 117.961 138.617 33.520 1.00 0.00 H ATOM 68968 C15 PA 1666 118.805 138.244 31.472 1.00 0.00 C ATOM 68969 H5R PA 1666 119.836 138.180 31.117 1.00 0.00 H ATOM 68970 H5S PA 1666 118.302 138.994 30.858 1.00 0.00 H ATOM 68971 C14 PA 1666 118.170 136.946 31.079 1.00 0.00 C ATOM 68972 H4R PA 1666 117.131 137.094 31.382 1.00 0.00 H ATOM 68973 H4S PA 1666 118.527 136.062 31.611 1.00 0.00 H ATOM 68974 C13 PA 1666 118.183 136.670 29.580 1.00 0.00 C ATOM 68975 H3R PA 1666 119.222 136.717 29.247 1.00 0.00 H ATOM 68976 H3S PA 1666 117.643 137.488 29.098 1.00 0.00 H ATOM 68977 C12 PA 1666 117.502 135.261 29.245 1.00 0.00 C ATOM 68978 H2R PA 1666 116.615 135.234 29.880 1.00 0.00 H ATOM 68979 H2S PA 1666 117.987 134.351 29.604 1.00 0.00 H ATOM 68980 C11 PGR 1667 117.264 135.131 27.765 1.00 0.00 C ATOM 68981 O12 PGR 1667 118.099 134.640 27.051 1.00 0.00 O ATOM 68982 O11 PGR 1667 116.139 135.828 27.511 1.00 0.00 O ATOM 68983 C1 PGR 1667 115.805 136.126 26.116 1.00 0.00 C ATOM 68984 HR PGR 1667 116.640 136.730 25.754 1.00 0.00 H ATOM 68985 HS PGR 1667 114.894 136.730 26.134 1.00 0.00 H ATOM 68986 C2 PGR 1667 115.644 134.737 25.371 1.00 0.00 C ATOM 68987 HX PGR 1667 116.348 134.025 25.809 1.00 0.00 H ATOM 68988 C3 PGR 1667 115.969 134.927 23.949 1.00 0.00 C ATOM 68989 HA PGR 1667 115.944 133.940 23.480 1.00 0.00 H ATOM 68990 HB PGR 1667 116.966 135.370 23.898 1.00 0.00 H ATOM 68991 O31 PGR 1667 114.942 135.762 23.313 1.00 0.00 O ATOM 68992 P31 PGR 1667 115.130 136.388 21.850 1.00 0.00 P ATOM 68993 O32 PGR 1667 116.154 137.570 22.135 1.00 0.00 O ATOM 68994 C31 PGR 1667 115.689 138.745 22.784 1.00 0.00 C ATOM 68995 H1A PGR 1667 114.913 139.068 22.086 1.00 0.00 H ATOM 68996 H1B PGR 1667 115.262 138.524 23.766 1.00 0.00 H ATOM 68997 C32 PGR 1667 116.786 139.813 22.851 1.00 0.00 C ATOM 68998 H2A PGR 1667 117.163 139.936 21.832 1.00 0.00 H ATOM 68999 O35 PGR 1667 117.718 139.466 23.934 1.00 0.00 O ATOM 69000 HO5A PGR 1667 117.867 140.259 24.480 1.00 0.00 H ATOM 69001 C33 PGR 1667 116.279 141.172 23.139 1.00 0.00 C ATOM 69002 H3A PGR 1667 117.150 141.811 23.301 1.00 0.00 H ATOM 69003 H3B PGR 1667 115.697 141.544 22.293 1.00 0.00 H ATOM 69004 O33 PGR 1667 115.711 135.365 21.014 1.00 0.00 O ATOM 69005 O34 PGR 1667 113.831 137.041 21.377 1.00 0.00 O ATOM 69006 O21 PGR 1667 114.298 134.256 25.466 1.00 0.00 O ATOM 69007 C21 PGR 1667 114.028 133.574 26.548 1.00 0.00 C ATOM 69008 O22 PGR 1667 114.770 133.440 27.539 1.00 0.00 O ATOM 69009 O36 PGR 1667 115.431 141.117 24.308 1.00 0.00 O ATOM 69010 HO6A PGR 1667 115.903 140.738 25.071 1.00 0.00 H ATOM 69011 C12 OL 1668 112.688 132.908 26.445 1.00 0.00 C ATOM 69012 H2R OL 1668 112.001 133.664 26.058 1.00 0.00 H ATOM 69013 H2S OL 1668 112.615 132.137 25.675 1.00 0.00 H ATOM 69014 C13 OL 1668 112.285 132.260 27.740 1.00 0.00 C ATOM 69015 H3R OL 1668 113.086 131.591 28.060 1.00 0.00 H ATOM 69016 H3S OL 1668 112.289 133.102 28.435 1.00 0.00 H ATOM 69017 C14 OL 1668 110.861 131.758 27.677 1.00 0.00 C ATOM 69018 H4R OL 1668 110.320 131.889 28.617 1.00 0.00 H ATOM 69019 H4S OL 1668 110.283 132.408 27.017 1.00 0.00 H ATOM 69020 C15 OL 1668 110.576 130.347 27.145 1.00 0.00 C ATOM 69021 H5R OL 1668 109.492 130.268 27.036 1.00 0.00 H ATOM 69022 H5S OL 1668 110.990 130.129 26.159 1.00 0.00 H ATOM 69023 C16 OL 1668 110.997 129.181 28.026 1.00 0.00 C ATOM 69024 H6R OL 1668 110.414 128.307 27.730 1.00 0.00 H ATOM 69025 H6S OL 1668 111.938 128.779 27.645 1.00 0.00 H ATOM 69026 C17 OL 1668 110.909 129.326 29.491 1.00 0.00 C ATOM 69027 H7R OL 1668 111.578 130.098 29.876 1.00 0.00 H ATOM 69028 H7S OL 1668 109.915 129.678 29.775 1.00 0.00 H ATOM 69029 C18 OL 1668 111.103 128.070 30.303 1.00 0.00 C ATOM 69030 H8R OL 1668 110.874 128.350 31.333 1.00 0.00 H ATOM 69031 H8S OL 1668 110.425 127.249 30.059 1.00 0.00 H ATOM 69032 C19 OL 1668 112.515 127.531 30.377 1.00 0.00 C ATOM 69033 H9R OL 1668 113.135 127.571 29.485 1.00 0.00 H ATOM 69034 C110 OL 1668 113.000 126.841 31.406 1.00 0.00 C ATOM 69035 H10R OL 1668 113.905 126.309 31.125 1.00 0.00 H ATOM 69036 C111 OL 1668 112.409 126.524 32.737 1.00 0.00 C ATOM 69037 H11R OL 1668 111.579 127.207 32.929 1.00 0.00 H ATOM 69038 H11S OL 1668 111.871 125.583 32.602 1.00 0.00 H ATOM 69039 C112 OL 1668 113.545 126.483 33.754 1.00 0.00 C ATOM 69040 H12R OL 1668 114.291 125.782 33.374 1.00 0.00 H ATOM 69041 H12S OL 1668 114.100 127.420 33.834 1.00 0.00 H ATOM 69042 C113 OL 1668 113.184 126.054 35.161 1.00 0.00 C ATOM 69043 H13R OL 1668 112.588 126.794 35.700 1.00 0.00 H ATOM 69044 H13S OL 1668 112.657 125.098 35.142 1.00 0.00 H ATOM 69045 C114 OL 1668 114.399 125.851 35.999 1.00 0.00 C ATOM 69046 H14R OL 1668 115.150 125.177 35.581 1.00 0.00 H ATOM 69047 H14S OL 1668 115.023 126.745 36.059 1.00 0.00 H ATOM 69048 C115 OL 1668 114.209 125.136 37.341 1.00 0.00 C ATOM 69049 H15R OL 1668 113.941 124.094 37.153 1.00 0.00 H ATOM 69050 H15S OL 1668 115.173 125.223 37.846 1.00 0.00 H ATOM 69051 C116 OL 1668 113.160 125.717 38.286 1.00 0.00 C ATOM 69052 H16R OL 1668 113.537 126.685 38.624 1.00 0.00 H ATOM 69053 H16S OL 1668 112.181 125.713 37.804 1.00 0.00 H ATOM 69054 C117 OL 1668 112.832 124.872 39.563 1.00 0.00 C ATOM 69055 H17R OL 1668 112.333 123.947 39.265 1.00 0.00 H ATOM 69056 H17S OL 1668 113.827 124.719 39.987 1.00 0.00 H ATOM 69057 C118 OL 1668 111.887 125.594 40.470 1.00 0.00 C ATOM 69058 H18R OL 1668 111.473 124.919 41.222 1.00 0.00 H ATOM 69059 H18S OL 1668 111.005 126.008 39.976 1.00 0.00 H ATOM 69060 H18T OL 1668 112.264 126.480 40.987 1.00 0.00 H TER 69061 OL 1668 ATOM 69061 C116 PA 1669 139.737 17.820 43.852 1.00 0.00 C ATOM 69062 H16R PA 1669 140.620 18.450 43.973 1.00 0.00 H ATOM 69063 H16S PA 1669 139.883 16.969 44.521 1.00 0.00 H ATOM 69064 H16T PA 1669 138.832 18.375 44.107 1.00 0.00 H ATOM 69065 C115 PA 1669 139.697 17.521 42.401 1.00 0.00 C ATOM 69066 H15R PA 1669 139.853 18.447 41.844 1.00 0.00 H ATOM 69067 H15S PA 1669 138.734 17.091 42.119 1.00 0.00 H ATOM 69068 C114 PA 1669 140.810 16.562 41.931 1.00 0.00 C ATOM 69069 H14R PA 1669 140.630 15.508 42.152 1.00 0.00 H ATOM 69070 H14S PA 1669 141.787 16.795 42.360 1.00 0.00 H ATOM 69071 C113 PA 1669 141.036 16.730 40.427 1.00 0.00 C ATOM 69072 H13R PA 1669 141.390 17.750 40.265 1.00 0.00 H ATOM 69073 H13S PA 1669 140.059 16.657 39.944 1.00 0.00 H ATOM 69074 C112 PA 1669 141.930 15.671 39.784 1.00 0.00 C ATOM 69075 H12R PA 1669 141.445 14.694 39.849 1.00 0.00 H ATOM 69076 H12S PA 1669 142.865 15.621 40.345 1.00 0.00 H ATOM 69077 C111 PA 1669 142.102 16.035 38.271 1.00 0.00 C ATOM 69078 H11R PA 1669 142.717 16.872 37.933 1.00 0.00 H ATOM 69079 H11S PA 1669 141.109 16.099 37.823 1.00 0.00 H ATOM 69080 C110 PA 1669 142.765 14.900 37.502 1.00 0.00 C ATOM 69081 H10R PA 1669 142.160 14.005 37.663 1.00 0.00 H ATOM 69082 H10S PA 1669 143.731 14.750 37.988 1.00 0.00 H ATOM 69083 C19 PA 1669 143.020 15.265 36.033 1.00 0.00 C ATOM 69084 H9R PA 1669 143.563 16.197 35.860 1.00 0.00 H ATOM 69085 H9S PA 1669 142.060 15.153 35.525 1.00 0.00 H ATOM 69086 C18 PA 1669 144.003 14.327 35.453 1.00 0.00 C ATOM 69087 H8R PA 1669 143.680 13.287 35.525 1.00 0.00 H ATOM 69088 H8S PA 1669 144.951 14.416 35.987 1.00 0.00 H ATOM 69089 C17 PA 1669 144.102 14.619 33.925 1.00 0.00 C ATOM 69090 H7R PA 1669 144.834 15.416 33.779 1.00 0.00 H ATOM 69091 H7S PA 1669 143.157 14.945 33.485 1.00 0.00 H ATOM 69092 C16 PA 1669 144.491 13.346 33.106 1.00 0.00 C ATOM 69093 H6R PA 1669 143.841 12.478 33.233 1.00 0.00 H ATOM 69094 H6S PA 1669 145.433 12.985 33.524 1.00 0.00 H ATOM 69095 C15 PA 1669 144.785 13.589 31.667 1.00 0.00 C ATOM 69096 H5R PA 1669 145.402 14.430 31.343 1.00 0.00 H ATOM 69097 H5S PA 1669 143.826 13.862 31.222 1.00 0.00 H ATOM 69098 C14 PA 1669 145.082 12.310 30.852 1.00 0.00 C ATOM 69099 H4R PA 1669 144.453 11.525 31.278 1.00 0.00 H ATOM 69100 H4S PA 1669 146.076 12.036 31.209 1.00 0.00 H ATOM 69101 C13 PA 1669 144.948 12.532 29.314 1.00 0.00 C ATOM 69102 H3R PA 1669 143.945 12.918 29.118 1.00 0.00 H ATOM 69103 H3S PA 1669 145.006 11.541 28.859 1.00 0.00 H ATOM 69104 C12 PA 1669 146.112 13.448 28.828 1.00 0.00 C ATOM 69105 H2R PA 1669 147.091 13.014 29.039 1.00 0.00 H ATOM 69106 H2S PA 1669 146.106 14.430 29.307 1.00 0.00 H ATOM 69107 C11 PGR 1670 146.001 13.638 27.336 1.00 0.00 C ATOM 69108 O12 PGR 1670 145.397 14.585 26.876 1.00 0.00 O ATOM 69109 O11 PGR 1670 146.373 12.576 26.602 1.00 0.00 O ATOM 69110 C1 PGR 1670 146.520 12.716 25.185 1.00 0.00 C ATOM 69111 HR PGR 1670 145.574 12.911 24.673 1.00 0.00 H ATOM 69112 HS PGR 1670 146.922 11.800 24.744 1.00 0.00 H ATOM 69113 C2 PGR 1670 147.624 13.694 24.752 1.00 0.00 C ATOM 69114 HX PGR 1670 147.399 14.696 25.127 1.00 0.00 H ATOM 69115 C3 PGR 1670 147.689 13.754 23.193 1.00 0.00 C ATOM 69116 HA PGR 1670 148.485 14.447 22.909 1.00 0.00 H ATOM 69117 HB PGR 1670 146.721 14.183 22.923 1.00 0.00 H ATOM 69118 O31 PGR 1670 147.770 12.419 22.637 1.00 0.00 O ATOM 69119 P31 PGR 1670 147.790 12.097 21.093 1.00 0.00 P ATOM 69120 O32 PGR 1670 146.343 12.404 20.635 1.00 0.00 O ATOM 69121 C31 PGR 1670 145.247 11.697 21.066 1.00 0.00 C ATOM 69122 H1A PGR 1670 145.126 11.636 22.151 1.00 0.00 H ATOM 69123 H1B PGR 1670 145.312 10.667 20.708 1.00 0.00 H ATOM 69124 C32 PGR 1670 144.010 12.377 20.405 1.00 0.00 C ATOM 69125 H2A PGR 1670 143.119 11.819 20.706 1.00 0.00 H ATOM 69126 O35 PGR 1670 144.226 12.133 18.977 1.00 0.00 O ATOM 69127 HO5A PGR 1670 144.874 12.837 18.796 1.00 0.00 H ATOM 69128 C33 PGR 1670 143.875 13.888 20.700 1.00 0.00 C ATOM 69129 H3A PGR 1670 142.836 14.221 20.620 1.00 0.00 H ATOM 69130 H3B PGR 1670 144.113 14.017 21.759 1.00 0.00 H ATOM 69131 O33 PGR 1670 148.616 13.094 20.473 1.00 0.00 O ATOM 69132 O34 PGR 1670 148.137 10.674 20.957 1.00 0.00 O ATOM 69133 O21 PGR 1670 148.959 13.312 25.157 1.00 0.00 O ATOM 69134 C21 PGR 1670 149.863 14.268 25.401 1.00 0.00 C ATOM 69135 O22 PGR 1670 149.571 15.456 25.216 1.00 0.00 O ATOM 69136 O36 PGR 1670 144.691 14.700 19.833 1.00 0.00 O ATOM 69137 HO6A PGR 1670 145.601 14.452 20.074 1.00 0.00 H ATOM 69138 C12 OL 1671 151.183 13.770 25.938 1.00 0.00 C ATOM 69139 H2R OL 1671 151.387 12.874 25.348 1.00 0.00 H ATOM 69140 H2S OL 1671 151.868 14.592 25.719 1.00 0.00 H ATOM 69141 C13 OL 1671 151.300 13.391 27.452 1.00 0.00 C ATOM 69142 H3R OL 1671 150.569 12.633 27.741 1.00 0.00 H ATOM 69143 H3S OL 1671 152.248 12.884 27.642 1.00 0.00 H ATOM 69144 C14 OL 1671 151.154 14.476 28.481 1.00 0.00 C ATOM 69145 H4R OL 1671 152.085 15.030 28.343 1.00 0.00 H ATOM 69146 H4S OL 1671 150.606 15.396 28.268 1.00 0.00 H ATOM 69147 C15 OL 1671 150.860 14.155 29.981 1.00 0.00 C ATOM 69148 H5R OL 1671 151.648 13.527 30.403 1.00 0.00 H ATOM 69149 H5S OL 1671 150.971 15.091 30.531 1.00 0.00 H ATOM 69150 C16 OL 1671 149.463 13.607 30.355 1.00 0.00 C ATOM 69151 H6R OL 1671 148.820 14.405 29.979 1.00 0.00 H ATOM 69152 H6S OL 1671 149.180 12.678 29.855 1.00 0.00 H ATOM 69153 C17 OL 1671 149.246 13.396 31.886 1.00 0.00 C ATOM 69154 H7R OL 1671 148.268 12.943 32.060 1.00 0.00 H ATOM 69155 H7S OL 1671 149.982 12.600 32.017 1.00 0.00 H ATOM 69156 C18 OL 1671 149.551 14.600 32.805 1.00 0.00 C ATOM 69157 H8R OL 1671 149.450 14.276 33.843 1.00 0.00 H ATOM 69158 H8S OL 1671 150.600 14.887 32.709 1.00 0.00 H ATOM 69159 C19 OL 1671 148.593 15.730 32.525 1.00 0.00 C ATOM 69160 H9R OL 1671 148.473 15.863 31.453 1.00 0.00 H ATOM 69161 C110 OL 1671 147.698 16.229 33.397 1.00 0.00 C ATOM 69162 H10R OL 1671 147.003 16.993 33.058 1.00 0.00 H ATOM 69163 C111 OL 1671 147.699 16.103 34.933 1.00 0.00 C ATOM 69164 H11R OL 1671 147.190 15.176 35.202 1.00 0.00 H ATOM 69165 H11S OL 1671 148.692 16.050 35.385 1.00 0.00 H ATOM 69166 C112 OL 1671 146.746 17.103 35.590 1.00 0.00 C ATOM 69167 H12R OL 1671 147.140 18.107 35.419 1.00 0.00 H ATOM 69168 H12S OL 1671 145.750 17.040 35.148 1.00 0.00 H ATOM 69169 C113 OL 1671 146.830 16.991 37.136 1.00 0.00 C ATOM 69170 H13R OL 1671 146.587 16.003 37.532 1.00 0.00 H ATOM 69171 H13S OL 1671 147.839 17.202 37.496 1.00 0.00 H ATOM 69172 C114 OL 1671 145.860 18.038 37.883 1.00 0.00 C ATOM 69173 H14R OL 1671 144.805 17.826 37.700 1.00 0.00 H ATOM 69174 H14S OL 1671 145.859 17.852 38.959 1.00 0.00 H ATOM 69175 C115 OL 1671 146.086 19.472 37.581 1.00 0.00 C ATOM 69176 H15R OL 1671 147.073 19.644 38.016 1.00 0.00 H ATOM 69177 H15S OL 1671 146.050 19.679 36.509 1.00 0.00 H ATOM 69178 C116 OL 1671 145.096 20.400 38.330 1.00 0.00 C ATOM 69179 H16R OL 1671 144.086 20.316 37.923 1.00 0.00 H ATOM 69180 H16S OL 1671 144.978 20.008 39.342 1.00 0.00 H ATOM 69181 C117 OL 1671 145.422 21.853 38.213 1.00 0.00 C ATOM 69182 H17R OL 1671 146.290 22.022 38.854 1.00 0.00 H ATOM 69183 H17S OL 1671 145.960 22.008 37.275 1.00 0.00 H ATOM 69184 C118 OL 1671 144.235 22.859 38.486 1.00 0.00 C ATOM 69185 H18R OL 1671 143.388 22.812 37.799 1.00 0.00 H ATOM 69186 H18S OL 1671 144.552 23.881 38.707 1.00 0.00 H ATOM 69187 H18T OL 1671 143.829 22.425 39.402 1.00 0.00 H TER 69188 OL 1671 ATOM 69188 C116 PA 1672 48.775 33.908 42.102 1.00 0.00 C ATOM 69189 H16R PA 1672 48.947 34.036 43.172 1.00 0.00 H ATOM 69190 H16S PA 1672 49.411 34.697 41.695 1.00 0.00 H ATOM 69191 H16T PA 1672 49.173 32.915 41.880 1.00 0.00 H ATOM 69192 C115 PA 1672 47.244 33.977 41.874 1.00 0.00 C ATOM 69193 H15R PA 1672 46.780 34.926 42.149 1.00 0.00 H ATOM 69194 H15S PA 1672 46.875 33.224 42.574 1.00 0.00 H ATOM 69195 C114 PA 1672 46.630 33.808 40.481 1.00 0.00 C ATOM 69196 H14R PA 1672 47.061 34.504 39.759 1.00 0.00 H ATOM 69197 H14S PA 1672 45.545 33.927 40.492 1.00 0.00 H ATOM 69198 C113 PA 1672 47.084 32.521 39.873 1.00 0.00 C ATOM 69199 H13R PA 1672 46.624 31.659 40.361 1.00 0.00 H ATOM 69200 H13S PA 1672 48.172 32.496 39.968 1.00 0.00 H ATOM 69201 C112 PA 1672 46.553 32.417 38.474 1.00 0.00 C ATOM 69202 H12R PA 1672 46.943 33.228 37.856 1.00 0.00 H ATOM 69203 H12S PA 1672 45.541 32.825 38.524 1.00 0.00 H ATOM 69204 C111 PA 1672 46.593 31.178 37.639 1.00 0.00 C ATOM 69205 H11R PA 1672 45.717 30.576 37.891 1.00 0.00 H ATOM 69206 H11S PA 1672 47.445 30.528 37.844 1.00 0.00 H ATOM 69207 C110 PA 1672 46.486 31.434 36.157 1.00 0.00 C ATOM 69208 H10R PA 1672 47.521 31.685 35.914 1.00 0.00 H ATOM 69209 H10S PA 1672 45.828 32.297 36.038 1.00 0.00 H ATOM 69210 C19 PA 1672 46.122 30.198 35.339 1.00 0.00 C ATOM 69211 H9R PA 1672 45.115 29.840 35.566 1.00 0.00 H ATOM 69212 H9S PA 1672 46.809 29.368 35.515 1.00 0.00 H ATOM 69213 C18 PA 1672 46.133 30.501 33.881 1.00 0.00 C ATOM 69214 H8R PA 1672 47.170 30.778 33.682 1.00 0.00 H ATOM 69215 H8S PA 1672 45.502 31.386 33.773 1.00 0.00 H ATOM 69216 C17 PA 1672 45.568 29.465 32.898 1.00 0.00 C ATOM 69217 H7R PA 1672 44.527 29.242 33.140 1.00 0.00 H ATOM 69218 H7S PA 1672 46.116 28.526 32.792 1.00 0.00 H ATOM 69219 C16 PA 1672 45.464 30.072 31.547 1.00 0.00 C ATOM 69220 H6R PA 1672 44.645 30.792 31.599 1.00 0.00 H ATOM 69221 H6S PA 1672 45.184 29.183 30.979 1.00 0.00 H ATOM 69222 C15 PA 1672 46.678 30.701 30.898 1.00 0.00 C ATOM 69223 H5R PA 1672 47.437 29.943 31.105 1.00 0.00 H ATOM 69224 H5S PA 1672 47.086 31.511 31.506 1.00 0.00 H ATOM 69225 C14 PA 1672 46.794 30.914 29.358 1.00 0.00 C ATOM 69226 H4R PA 1672 47.166 29.944 29.023 1.00 0.00 H ATOM 69227 H4S PA 1672 47.550 31.692 29.232 1.00 0.00 H ATOM 69228 C13 PA 1672 45.459 31.317 28.699 1.00 0.00 C ATOM 69229 H3R PA 1672 45.819 32.010 27.935 1.00 0.00 H ATOM 69230 H3S PA 1672 44.845 31.879 29.406 1.00 0.00 H ATOM 69231 C12 PA 1672 44.713 30.109 28.172 1.00 0.00 C ATOM 69232 H2R PA 1672 45.503 29.587 27.629 1.00 0.00 H ATOM 69233 H2S PA 1672 44.430 29.353 28.908 1.00 0.00 H ATOM 69234 C11 PGR 1673 43.590 30.245 27.190 1.00 0.00 C ATOM 69235 O12 PGR 1673 42.670 29.457 27.125 1.00 0.00 O ATOM 69236 O11 PGR 1673 43.681 31.439 26.510 1.00 0.00 O ATOM 69237 C1 PGR 1673 42.840 31.744 25.409 1.00 0.00 C ATOM 69238 HR PGR 1673 42.857 30.926 24.684 1.00 0.00 H ATOM 69239 HS PGR 1673 43.283 32.610 24.910 1.00 0.00 H ATOM 69240 C2 PGR 1673 41.384 32.027 25.860 1.00 0.00 C ATOM 69241 HX PGR 1673 40.837 31.127 26.152 1.00 0.00 H ATOM 69242 C3 PGR 1673 40.605 32.597 24.658 1.00 0.00 C ATOM 69243 HA PGR 1673 39.757 33.072 25.157 1.00 0.00 H ATOM 69244 HB PGR 1673 40.279 31.773 24.018 1.00 0.00 H ATOM 69245 O31 PGR 1673 41.382 33.499 23.881 1.00 0.00 O ATOM 69246 P31 PGR 1673 41.306 33.494 22.257 1.00 0.00 P ATOM 69247 O32 PGR 1673 41.777 32.039 21.845 1.00 0.00 O ATOM 69248 C31 PGR 1673 43.146 31.690 21.495 1.00 0.00 C ATOM 69249 H1A PGR 1673 43.865 32.162 22.169 1.00 0.00 H ATOM 69250 H1B PGR 1673 43.336 32.181 20.537 1.00 0.00 H ATOM 69251 C32 PGR 1673 43.220 30.151 21.292 1.00 0.00 C ATOM 69252 H2A PGR 1673 42.536 29.911 20.474 1.00 0.00 H ATOM 69253 O35 PGR 1673 42.626 29.711 22.503 1.00 0.00 O ATOM 69254 HO5A PGR 1673 41.763 30.158 22.442 1.00 0.00 H ATOM 69255 C33 PGR 1673 44.691 29.592 21.275 1.00 0.00 C ATOM 69256 H3A PGR 1673 45.109 29.939 20.327 1.00 0.00 H ATOM 69257 H3B PGR 1673 45.247 29.981 22.132 1.00 0.00 H ATOM 69258 O33 PGR 1673 39.919 33.613 21.925 1.00 0.00 O ATOM 69259 O34 PGR 1673 42.293 34.492 21.862 1.00 0.00 O ATOM 69260 O21 PGR 1673 41.422 33.005 26.883 1.00 0.00 O ATOM 69261 C21 PGR 1673 40.312 33.259 27.648 1.00 0.00 C ATOM 69262 O22 PGR 1673 39.257 32.611 27.645 1.00 0.00 O ATOM 69263 O36 PGR 1673 44.571 28.146 21.299 1.00 0.00 O ATOM 69264 HO6A PGR 1673 44.007 27.908 20.542 1.00 0.00 H ATOM 69265 C12 OL 1674 40.575 34.338 28.696 1.00 0.00 C ATOM 69266 H2R OL 1674 41.569 34.717 28.450 1.00 0.00 H ATOM 69267 H2S OL 1674 39.928 35.217 28.718 1.00 0.00 H ATOM 69268 C13 OL 1674 40.572 33.667 30.140 1.00 0.00 C ATOM 69269 H3R OL 1674 40.600 34.446 30.906 1.00 0.00 H ATOM 69270 H3S OL 1674 39.631 33.129 30.272 1.00 0.00 H ATOM 69271 C14 OL 1674 41.555 32.531 30.355 1.00 0.00 C ATOM 69272 H4R OL 1674 41.453 31.759 29.589 1.00 0.00 H ATOM 69273 H4S OL 1674 42.538 32.899 30.056 1.00 0.00 H ATOM 69274 C15 OL 1674 41.424 31.904 31.725 1.00 0.00 C ATOM 69275 H5R OL 1674 40.376 32.000 32.016 1.00 0.00 H ATOM 69276 H5S OL 1674 41.574 30.823 31.763 1.00 0.00 H ATOM 69277 C16 OL 1674 42.267 32.675 32.732 1.00 0.00 C ATOM 69278 H6R OL 1674 43.312 32.786 32.433 1.00 0.00 H ATOM 69279 H6S OL 1674 41.897 33.703 32.749 1.00 0.00 H ATOM 69280 C17 OL 1674 42.166 32.081 34.174 1.00 0.00 C ATOM 69281 H7R OL 1674 41.177 31.683 34.412 1.00 0.00 H ATOM 69282 H7S OL 1674 42.859 31.245 34.287 1.00 0.00 H ATOM 69283 C18 OL 1674 42.495 33.164 35.220 1.00 0.00 C ATOM 69284 H8R OL 1674 41.664 33.873 35.202 1.00 0.00 H ATOM 69285 H8S OL 1674 42.684 32.676 36.178 1.00 0.00 H ATOM 69286 C19 OL 1674 43.724 33.879 34.880 1.00 0.00 C ATOM 69287 H9R OL 1674 44.552 33.367 34.397 1.00 0.00 H ATOM 69288 C110 OL 1674 43.824 35.141 35.200 1.00 0.00 C ATOM 69289 H10R OL 1674 44.748 35.647 34.932 1.00 0.00 H ATOM 69290 C111 OL 1674 42.885 36.087 35.860 1.00 0.00 C ATOM 69291 H11R OL 1674 42.988 37.004 35.276 1.00 0.00 H ATOM 69292 H11S OL 1674 41.840 35.810 35.706 1.00 0.00 H ATOM 69293 C112 OL 1674 43.264 36.202 37.366 1.00 0.00 C ATOM 69294 H12R OL 1674 42.531 36.671 38.026 1.00 0.00 H ATOM 69295 H12S OL 1674 43.415 35.176 37.709 1.00 0.00 H ATOM 69296 C113 OL 1674 44.628 36.965 37.424 1.00 0.00 C ATOM 69297 H13R OL 1674 45.415 36.357 36.973 1.00 0.00 H ATOM 69298 H13S OL 1674 44.645 37.860 36.799 1.00 0.00 H ATOM 69299 C114 OL 1674 45.016 37.289 38.870 1.00 0.00 C ATOM 69300 H14R OL 1674 44.458 38.117 39.311 1.00 0.00 H ATOM 69301 H14S OL 1674 44.703 36.452 39.497 1.00 0.00 H ATOM 69302 C115 OL 1674 46.506 37.525 39.176 1.00 0.00 C ATOM 69303 H15R OL 1674 47.067 36.699 38.732 1.00 0.00 H ATOM 69304 H15S OL 1674 46.959 38.382 38.674 1.00 0.00 H ATOM 69305 C116 OL 1674 46.837 37.637 40.720 1.00 0.00 C ATOM 69306 H16R OL 1674 46.278 38.519 41.039 1.00 0.00 H ATOM 69307 H16S OL 1674 46.368 36.817 41.269 1.00 0.00 H ATOM 69308 C117 OL 1674 48.296 37.862 41.146 1.00 0.00 C ATOM 69309 H17R OL 1674 48.324 37.978 42.231 1.00 0.00 H ATOM 69310 H17S OL 1674 48.962 37.036 40.890 1.00 0.00 H ATOM 69311 C118 OL 1674 48.935 39.123 40.541 1.00 0.00 C ATOM 69312 H18R OL 1674 48.479 40.028 40.948 1.00 0.00 H ATOM 69313 H18S OL 1674 48.742 39.075 39.467 1.00 0.00 H ATOM 69314 H18T OL 1674 50.015 39.097 40.698 1.00 0.00 H TER 69315 OL 1674 ATOM 69315 C116 PA 1675 126.688 136.459 41.782 1.00 0.00 C ATOM 69316 H16R PA 1675 127.292 135.839 42.449 1.00 0.00 H ATOM 69317 H16S PA 1675 125.617 136.262 41.863 1.00 0.00 H ATOM 69318 H16T PA 1675 126.751 137.401 42.330 1.00 0.00 H ATOM 69319 C115 PA 1675 127.120 136.380 40.363 1.00 0.00 C ATOM 69320 H15R PA 1675 127.202 137.350 39.868 1.00 0.00 H ATOM 69321 H15S PA 1675 126.438 135.791 39.746 1.00 0.00 H ATOM 69322 C114 PA 1675 128.604 135.963 40.175 1.00 0.00 C ATOM 69323 H14R PA 1675 128.849 135.218 40.935 1.00 0.00 H ATOM 69324 H14S PA 1675 129.247 136.810 40.422 1.00 0.00 H ATOM 69325 C113 PA 1675 129.140 135.751 38.773 1.00 0.00 C ATOM 69326 H13R PA 1675 128.891 136.655 38.212 1.00 0.00 H ATOM 69327 H13S PA 1675 128.621 134.988 38.190 1.00 0.00 H ATOM 69328 C112 PA 1675 130.617 135.593 38.595 1.00 0.00 C ATOM 69329 H12R PA 1675 130.869 134.536 38.697 1.00 0.00 H ATOM 69330 H12S PA 1675 131.178 136.008 39.435 1.00 0.00 H ATOM 69331 C111 PA 1675 131.088 136.064 37.260 1.00 0.00 C ATOM 69332 H11R PA 1675 132.177 136.005 37.313 1.00 0.00 H ATOM 69333 H11S PA 1675 130.905 137.139 37.207 1.00 0.00 H ATOM 69334 C110 PA 1675 130.532 135.242 36.074 1.00 0.00 C ATOM 69335 H10R PA 1675 129.555 135.687 35.870 1.00 0.00 H ATOM 69336 H10S PA 1675 130.287 134.202 36.300 1.00 0.00 H ATOM 69337 C19 PA 1675 131.511 135.188 34.896 1.00 0.00 C ATOM 69338 H9R PA 1675 132.507 134.797 35.118 1.00 0.00 H ATOM 69339 H9S PA 1675 131.648 136.149 34.396 1.00 0.00 H ATOM 69340 C18 PA 1675 131.074 134.327 33.744 1.00 0.00 C ATOM 69341 H8R PA 1675 130.007 134.444 33.539 1.00 0.00 H ATOM 69342 H8S PA 1675 130.925 133.311 34.118 1.00 0.00 H ATOM 69343 C17 PA 1675 131.985 134.352 32.502 1.00 0.00 C ATOM 69344 H7R PA 1675 132.092 135.354 32.082 1.00 0.00 H ATOM 69345 H7S PA 1675 131.451 133.785 31.737 1.00 0.00 H ATOM 69346 C16 PA 1675 133.324 133.677 32.852 1.00 0.00 C ATOM 69347 H6R PA 1675 133.107 132.762 33.406 1.00 0.00 H ATOM 69348 H6S PA 1675 133.815 134.381 33.526 1.00 0.00 H ATOM 69349 C15 PA 1675 134.263 133.418 31.663 1.00 0.00 C ATOM 69350 H5R PA 1675 135.235 133.075 32.025 1.00 0.00 H ATOM 69351 H5S PA 1675 134.352 134.367 31.129 1.00 0.00 H ATOM 69352 C14 PA 1675 133.650 132.316 30.627 1.00 0.00 C ATOM 69353 H4R PA 1675 132.720 132.596 30.127 1.00 0.00 H ATOM 69354 H4S PA 1675 133.418 131.342 31.064 1.00 0.00 H ATOM 69355 C13 PA 1675 134.575 132.079 29.451 1.00 0.00 C ATOM 69356 H3R PA 1675 135.601 131.940 29.798 1.00 0.00 H ATOM 69357 H3S PA 1675 134.796 133.061 29.027 1.00 0.00 H ATOM 69358 C12 PA 1675 133.971 131.116 28.423 1.00 0.00 C ATOM 69359 H2R PA 1675 132.967 131.379 28.083 1.00 0.00 H ATOM 69360 H2S PA 1675 133.863 130.165 28.948 1.00 0.00 H ATOM 69361 C11 PC 1676 134.860 130.891 27.132 1.00 0.00 C ATOM 69362 O12 PC 1676 135.168 131.682 26.313 1.00 0.00 O ATOM 69363 O11 PC 1676 135.114 129.596 27.012 1.00 0.00 O ATOM 69364 C1 PC 1676 135.446 129.162 25.661 1.00 0.00 C ATOM 69365 HR PC 1676 136.051 129.918 25.153 1.00 0.00 H ATOM 69366 HS PC 1676 134.483 128.932 25.198 1.00 0.00 H ATOM 69367 C2 PC 1676 136.175 127.799 25.713 1.00 0.00 C ATOM 69368 HX PC 1676 137.132 127.970 26.213 1.00 0.00 H ATOM 69369 C3 PC 1676 136.517 127.227 24.291 1.00 0.00 C ATOM 69370 HA PC 1676 137.018 126.264 24.418 1.00 0.00 H ATOM 69371 HB PC 1676 137.095 128.038 23.841 1.00 0.00 H ATOM 69372 O31 PC 1676 135.299 126.990 23.614 1.00 0.00 O ATOM 69373 P31 PC 1676 135.145 126.250 22.155 1.00 0.00 P ATOM 69374 O32 PC 1676 135.588 127.399 21.104 1.00 0.00 O ATOM 69375 C31 PC 1676 134.719 128.463 20.734 1.00 0.00 C ATOM 69376 H1A PC 1676 134.297 129.050 21.553 1.00 0.00 H ATOM 69377 H1B PC 1676 133.932 127.957 20.169 1.00 0.00 H ATOM 69378 C32 PC 1676 135.449 129.530 19.942 1.00 0.00 C ATOM 69379 H2A PC 1676 136.269 129.917 20.548 1.00 0.00 H ATOM 69380 H2B PC 1676 134.745 130.346 19.775 1.00 0.00 H ATOM 69381 N31 PC 1676 135.975 129.195 18.613 1.00 0.00 N ATOM 69382 C33 PC 1676 135.990 130.432 17.737 1.00 0.00 C ATOM 69383 H3A PC 1676 136.733 131.158 18.068 1.00 0.00 H ATOM 69384 H3B PC 1676 134.985 130.857 17.706 1.00 0.00 H ATOM 69385 H3C PC 1676 136.205 130.031 16.745 1.00 0.00 H ATOM 69386 C34 PC 1676 137.328 128.673 18.877 1.00 0.00 C ATOM 69387 H4A PC 1676 137.216 127.748 19.444 1.00 0.00 H ATOM 69388 H4B PC 1676 137.956 129.363 19.443 1.00 0.00 H ATOM 69389 H4C PC 1676 137.829 128.421 17.941 1.00 0.00 H ATOM 69390 C35 PC 1676 135.147 128.137 17.893 1.00 0.00 C ATOM 69391 H5A PC 1676 135.386 127.168 18.334 1.00 0.00 H ATOM 69392 H5B PC 1676 135.352 128.085 16.823 1.00 0.00 H ATOM 69393 H5C PC 1676 134.080 128.358 17.945 1.00 0.00 H ATOM 69394 O33 PC 1676 136.129 125.213 22.134 1.00 0.00 O ATOM 69395 O34 PC 1676 133.728 125.970 21.853 1.00 0.00 O ATOM 69396 O21 PC 1676 135.431 126.843 26.479 1.00 0.00 O ATOM 69397 C21 PC 1676 135.882 125.714 26.995 1.00 0.00 C ATOM 69398 O22 PC 1676 137.010 125.246 26.685 1.00 0.00 O ATOM 69399 C12 OL 1677 134.849 124.926 27.799 1.00 0.00 C ATOM 69400 H2R OL 1677 133.876 125.403 27.661 1.00 0.00 H ATOM 69401 H2S OL 1677 134.743 123.900 27.442 1.00 0.00 H ATOM 69402 C13 OL 1677 135.340 124.899 29.200 1.00 0.00 C ATOM 69403 H3R OL 1677 134.791 124.176 29.807 1.00 0.00 H ATOM 69404 H3S OL 1677 136.395 124.618 29.205 1.00 0.00 H ATOM 69405 C14 OL 1677 135.110 126.135 30.033 1.00 0.00 C ATOM 69406 H4R OL 1677 135.650 126.908 29.481 1.00 0.00 H ATOM 69407 H4S OL 1677 134.058 126.423 30.086 1.00 0.00 H ATOM 69408 C15 OL 1677 135.760 126.159 31.407 1.00 0.00 C ATOM 69409 H5R OL 1677 135.588 125.262 32.005 1.00 0.00 H ATOM 69410 H5S OL 1677 136.847 126.147 31.301 1.00 0.00 H ATOM 69411 C16 OL 1677 135.465 127.320 32.355 1.00 0.00 C ATOM 69412 H6R OL 1677 134.474 127.260 32.809 1.00 0.00 H ATOM 69413 H6S OL 1677 136.004 127.210 33.298 1.00 0.00 H ATOM 69414 C17 OL 1677 135.567 128.726 31.735 1.00 0.00 C ATOM 69415 H7R OL 1677 136.525 128.872 31.232 1.00 0.00 H ATOM 69416 H7S OL 1677 134.801 128.804 30.962 1.00 0.00 H ATOM 69417 C18 OL 1677 135.491 129.919 32.750 1.00 0.00 C ATOM 69418 H8R OL 1677 136.270 129.772 33.501 1.00 0.00 H ATOM 69419 H8S OL 1677 135.658 130.880 32.257 1.00 0.00 H ATOM 69420 C19 OL 1677 134.189 129.954 33.485 1.00 0.00 C ATOM 69421 H9R OL 1677 133.405 129.529 32.864 1.00 0.00 H ATOM 69422 C110 OL 1677 133.977 130.151 34.789 1.00 0.00 C ATOM 69423 H10R OL 1677 132.969 129.990 35.163 1.00 0.00 H ATOM 69424 C111 OL 1677 134.963 130.682 35.882 1.00 0.00 C ATOM 69425 H11R OL 1677 134.999 129.934 36.676 1.00 0.00 H ATOM 69426 H11S OL 1677 135.987 130.719 35.505 1.00 0.00 H ATOM 69427 C112 OL 1677 134.503 132.018 36.582 1.00 0.00 C ATOM 69428 H12R OL 1677 134.108 132.714 35.839 1.00 0.00 H ATOM 69429 H12S OL 1677 133.534 131.813 37.043 1.00 0.00 H ATOM 69430 C113 OL 1677 135.623 132.553 37.578 1.00 0.00 C ATOM 69431 H13R OL 1677 135.898 131.729 38.239 1.00 0.00 H ATOM 69432 H13S OL 1677 136.454 132.991 37.022 1.00 0.00 H ATOM 69433 C114 OL 1677 135.001 133.572 38.536 1.00 0.00 C ATOM 69434 H14R OL 1677 134.556 134.358 37.922 1.00 0.00 H ATOM 69435 H14S OL 1677 134.216 133.141 39.161 1.00 0.00 H ATOM 69436 C115 OL 1677 136.075 134.240 39.459 1.00 0.00 C ATOM 69437 H15R OL 1677 136.781 134.769 38.816 1.00 0.00 H ATOM 69438 H15S OL 1677 135.714 135.075 40.062 1.00 0.00 H ATOM 69439 C116 OL 1677 136.638 133.167 40.389 1.00 0.00 C ATOM 69440 H16R OL 1677 135.805 132.738 40.950 1.00 0.00 H ATOM 69441 H16S OL 1677 137.059 132.306 39.865 1.00 0.00 H ATOM 69442 C117 OL 1677 137.533 133.726 41.383 1.00 0.00 C ATOM 69443 H17R OL 1677 138.301 134.427 41.050 1.00 0.00 H ATOM 69444 H17S OL 1677 136.930 134.451 41.933 1.00 0.00 H ATOM 69445 C118 OL 1677 137.995 132.775 42.362 1.00 0.00 C ATOM 69446 H18R OL 1677 138.404 133.284 43.237 1.00 0.00 H ATOM 69447 H18S OL 1677 138.769 132.163 41.893 1.00 0.00 H ATOM 69448 H18T OL 1677 137.165 132.119 42.630 1.00 0.00 H TER 69449 OL 1677 ATOM 69449 C116 PA 1678 125.608 122.278 41.595 1.00 0.00 C ATOM 69450 H16R PA 1678 126.632 122.454 41.259 1.00 0.00 H ATOM 69451 H16S PA 1678 125.494 122.847 42.521 1.00 0.00 H ATOM 69452 H16T PA 1678 124.940 122.831 40.932 1.00 0.00 H ATOM 69453 C115 PA 1678 125.223 120.772 41.545 1.00 0.00 C ATOM 69454 H15R PA 1678 124.289 120.514 42.050 1.00 0.00 H ATOM 69455 H15S PA 1678 126.072 120.247 41.988 1.00 0.00 H ATOM 69456 C114 PA 1678 124.999 120.267 40.118 1.00 0.00 C ATOM 69457 H14R PA 1678 124.042 120.605 39.713 1.00 0.00 H ATOM 69458 H14S PA 1678 124.874 119.183 40.150 1.00 0.00 H ATOM 69459 C113 PA 1678 126.072 120.672 39.056 1.00 0.00 C ATOM 69460 H13R PA 1678 127.069 120.387 39.399 1.00 0.00 H ATOM 69461 H13S PA 1678 126.107 121.762 39.004 1.00 0.00 H ATOM 69462 C112 PA 1678 125.770 120.134 37.647 1.00 0.00 C ATOM 69463 H12R PA 1678 124.884 120.667 37.297 1.00 0.00 H ATOM 69464 H12S PA 1678 125.329 119.137 37.717 1.00 0.00 H ATOM 69465 C111 PA 1678 126.963 120.063 36.690 1.00 0.00 C ATOM 69466 H11R PA 1678 127.761 119.402 37.033 1.00 0.00 H ATOM 69467 H11S PA 1678 127.480 121.020 36.779 1.00 0.00 H ATOM 69468 C110 PA 1678 126.723 119.591 35.254 1.00 0.00 C ATOM 69469 H10R PA 1678 125.849 119.950 34.706 1.00 0.00 H ATOM 69470 H10S PA 1678 126.451 118.535 35.320 1.00 0.00 H ATOM 69471 C19 PA 1678 127.969 119.733 34.431 1.00 0.00 C ATOM 69472 H9R PA 1678 128.074 120.797 34.211 1.00 0.00 H ATOM 69473 H9S PA 1678 127.738 119.182 33.517 1.00 0.00 H ATOM 69474 C18 PA 1678 129.276 119.159 34.942 1.00 0.00 C ATOM 69475 H8R PA 1678 129.082 118.090 35.050 1.00 0.00 H ATOM 69476 H8S PA 1678 129.484 119.519 35.952 1.00 0.00 H ATOM 69477 C17 PA 1678 130.459 119.269 33.969 1.00 0.00 C ATOM 69478 H7R PA 1678 131.342 118.771 34.375 1.00 0.00 H ATOM 69479 H7S PA 1678 130.771 120.313 33.897 1.00 0.00 H ATOM 69480 C16 PA 1678 130.250 118.763 32.585 1.00 0.00 C ATOM 69481 H6R PA 1678 129.470 119.381 32.136 1.00 0.00 H ATOM 69482 H6S PA 1678 129.824 117.758 32.592 1.00 0.00 H ATOM 69483 C15 PA 1678 131.461 118.796 31.776 1.00 0.00 C ATOM 69484 H5R PA 1678 132.218 118.106 32.156 1.00 0.00 H ATOM 69485 H5S PA 1678 131.929 119.773 31.913 1.00 0.00 H ATOM 69486 C14 PA 1678 131.059 118.717 30.304 1.00 0.00 C ATOM 69487 H4R PA 1678 130.462 119.566 29.967 1.00 0.00 H ATOM 69488 H4S PA 1678 130.298 117.940 30.206 1.00 0.00 H ATOM 69489 C13 PA 1678 132.263 118.340 29.367 1.00 0.00 C ATOM 69490 H3R PA 1678 131.858 117.729 28.557 1.00 0.00 H ATOM 69491 H3S PA 1678 132.853 117.553 29.841 1.00 0.00 H ATOM 69492 C12 PA 1678 133.212 119.468 29.083 1.00 0.00 C ATOM 69493 H2R PA 1678 133.655 119.900 29.983 1.00 0.00 H ATOM 69494 H2S PA 1678 132.615 120.338 28.800 1.00 0.00 H ATOM 69495 C11 PGR 1679 134.140 119.043 28.006 1.00 0.00 C ATOM 69496 O12 PGR 1679 134.065 117.907 27.531 1.00 0.00 O ATOM 69497 O11 PGR 1679 134.934 120.025 27.538 1.00 0.00 O ATOM 69498 C1 PGR 1679 135.871 119.520 26.542 1.00 0.00 C ATOM 69499 HR PGR 1679 135.369 119.040 25.698 1.00 0.00 H ATOM 69500 HS PGR 1679 136.363 118.654 26.993 1.00 0.00 H ATOM 69501 C2 PGR 1679 136.933 120.574 26.182 1.00 0.00 C ATOM 69502 HX PGR 1679 136.366 121.502 26.073 1.00 0.00 H ATOM 69503 C3 PGR 1679 137.617 120.281 24.894 1.00 0.00 C ATOM 69504 HA PGR 1679 138.357 121.024 24.584 1.00 0.00 H ATOM 69505 HB PGR 1679 136.881 120.369 24.091 1.00 0.00 H ATOM 69506 O31 PGR 1679 138.190 118.991 24.939 1.00 0.00 O ATOM 69507 P31 PGR 1679 138.999 118.554 23.610 1.00 0.00 P ATOM 69508 O32 PGR 1679 137.899 118.650 22.509 1.00 0.00 O ATOM 69509 C31 PGR 1679 136.855 117.705 22.497 1.00 0.00 C ATOM 69510 H1A PGR 1679 136.277 117.820 23.418 1.00 0.00 H ATOM 69511 H1B PGR 1679 137.354 116.737 22.597 1.00 0.00 H ATOM 69512 C32 PGR 1679 136.004 117.798 21.207 1.00 0.00 C ATOM 69513 H2A PGR 1679 135.060 117.248 21.245 1.00 0.00 H ATOM 69514 O35 PGR 1679 135.556 119.134 20.922 1.00 0.00 O ATOM 69515 HO5A PGR 1679 134.855 119.104 20.247 1.00 0.00 H ATOM 69516 C33 PGR 1679 136.821 117.377 20.003 1.00 0.00 C ATOM 69517 H3A PGR 1679 137.751 117.938 19.881 1.00 0.00 H ATOM 69518 H3B PGR 1679 137.189 116.360 20.160 1.00 0.00 H ATOM 69519 O33 PGR 1679 140.057 119.574 23.380 1.00 0.00 O ATOM 69520 O34 PGR 1679 139.368 117.108 23.634 1.00 0.00 O ATOM 69521 O21 PGR 1679 137.841 120.627 27.260 1.00 0.00 O ATOM 69522 C21 PGR 1679 138.626 121.728 27.324 1.00 0.00 C ATOM 69523 O22 PGR 1679 138.552 122.570 26.457 1.00 0.00 O ATOM 69524 O36 PGR 1679 136.013 117.496 18.833 1.00 0.00 O ATOM 69525 HO6A PGR 1679 135.264 116.882 18.945 1.00 0.00 H ATOM 69526 C12 OL 1680 139.695 121.830 28.339 1.00 0.00 C ATOM 69527 H2R OL 1680 140.566 122.089 27.734 1.00 0.00 H ATOM 69528 H2S OL 1680 139.490 122.740 28.907 1.00 0.00 H ATOM 69529 C13 OL 1680 139.796 120.617 29.204 1.00 0.00 C ATOM 69530 H3R OL 1680 140.073 119.725 28.638 1.00 0.00 H ATOM 69531 H3S OL 1680 140.698 120.821 29.785 1.00 0.00 H ATOM 69532 C14 OL 1680 138.565 120.244 30.104 1.00 0.00 C ATOM 69533 H4R OL 1680 137.750 119.924 29.452 1.00 0.00 H ATOM 69534 H4S OL 1680 138.819 119.342 30.664 1.00 0.00 H ATOM 69535 C15 OL 1680 138.033 121.268 31.080 1.00 0.00 C ATOM 69536 H5R OL 1680 138.796 121.461 31.837 1.00 0.00 H ATOM 69537 H5S OL 1680 138.002 122.252 30.606 1.00 0.00 H ATOM 69538 C16 OL 1680 136.684 120.929 31.675 1.00 0.00 C ATOM 69539 H6R OL 1680 135.969 120.776 30.864 1.00 0.00 H ATOM 69540 H6S OL 1680 136.591 119.954 32.158 1.00 0.00 H ATOM 69541 C17 OL 1680 136.082 122.108 32.495 1.00 0.00 C ATOM 69542 H7R OL 1680 136.647 122.331 33.402 1.00 0.00 H ATOM 69543 H7S OL 1680 136.110 122.980 31.838 1.00 0.00 H ATOM 69544 C18 OL 1680 134.646 121.892 33.028 1.00 0.00 C ATOM 69545 H8R OL 1680 133.968 121.811 32.176 1.00 0.00 H ATOM 69546 H8S OL 1680 134.543 120.905 33.483 1.00 0.00 H ATOM 69547 C19 OL 1680 134.203 122.960 33.944 1.00 0.00 C ATOM 69548 H9R OL 1680 133.531 123.692 33.504 1.00 0.00 H ATOM 69549 C110 OL 1680 134.463 123.103 35.235 1.00 0.00 C ATOM 69550 H10R OL 1680 134.083 123.939 35.817 1.00 0.00 H ATOM 69551 C111 OL 1680 135.190 122.162 36.061 1.00 0.00 C ATOM 69552 H11R OL 1680 135.269 121.145 35.670 1.00 0.00 H ATOM 69553 H11S OL 1680 136.252 122.414 36.068 1.00 0.00 H ATOM 69554 C112 OL 1680 134.740 121.934 37.502 1.00 0.00 C ATOM 69555 H12R OL 1680 135.439 121.149 37.798 1.00 0.00 H ATOM 69556 H12S OL 1680 134.785 122.814 38.147 1.00 0.00 H ATOM 69557 C113 OL 1680 133.280 121.346 37.593 1.00 0.00 C ATOM 69558 H13R OL 1680 132.536 122.071 37.254 1.00 0.00 H ATOM 69559 H13S OL 1680 133.097 120.571 36.846 1.00 0.00 H ATOM 69560 C114 OL 1680 132.954 120.956 39.034 1.00 0.00 C ATOM 69561 H14R OL 1680 133.717 120.294 39.450 1.00 0.00 H ATOM 69562 H14S OL 1680 133.079 121.895 39.578 1.00 0.00 H ATOM 69563 C115 OL 1680 131.553 120.332 39.271 1.00 0.00 C ATOM 69564 H15R OL 1680 131.429 120.190 40.347 1.00 0.00 H ATOM 69565 H15S OL 1680 130.865 121.151 39.055 1.00 0.00 H ATOM 69566 C116 OL 1680 131.263 118.933 38.663 1.00 0.00 C ATOM 69567 H16R OL 1680 131.096 118.990 37.585 1.00 0.00 H ATOM 69568 H16S OL 1680 132.193 118.385 38.822 1.00 0.00 H ATOM 69569 C117 OL 1680 130.027 118.220 39.247 1.00 0.00 C ATOM 69570 H17R OL 1680 129.222 118.954 39.169 1.00 0.00 H ATOM 69571 H17S OL 1680 129.679 117.374 38.651 1.00 0.00 H ATOM 69572 C118 OL 1680 130.311 117.614 40.601 1.00 0.00 C ATOM 69573 H18R OL 1680 129.407 117.175 41.028 1.00 0.00 H ATOM 69574 H18S OL 1680 130.542 118.415 41.306 1.00 0.00 H ATOM 69575 H18T OL 1680 131.111 116.870 40.591 1.00 0.00 H TER 69576 OL 1680 ATOM 69576 C116 PA 1681 15.588 94.312 33.395 1.00 0.00 C ATOM 69577 H16R PA 1681 15.597 95.105 32.645 1.00 0.00 H ATOM 69578 H16S PA 1681 14.772 93.663 33.070 1.00 0.00 H ATOM 69579 H16T PA 1681 16.520 93.761 33.540 1.00 0.00 H ATOM 69580 C115 PA 1681 15.213 94.981 34.774 1.00 0.00 C ATOM 69581 H15R PA 1681 14.282 95.552 34.790 1.00 0.00 H ATOM 69582 H15S PA 1681 15.850 95.840 34.993 1.00 0.00 H ATOM 69583 C114 PA 1681 15.175 93.918 35.885 1.00 0.00 C ATOM 69584 H14R PA 1681 15.297 94.397 36.859 1.00 0.00 H ATOM 69585 H14S PA 1681 16.044 93.271 35.740 1.00 0.00 H ATOM 69586 C113 PA 1681 13.888 92.964 35.968 1.00 0.00 C ATOM 69587 H13R PA 1681 13.742 92.424 35.030 1.00 0.00 H ATOM 69588 H13S PA 1681 12.989 93.565 36.120 1.00 0.00 H ATOM 69589 C112 PA 1681 13.944 91.897 37.065 1.00 0.00 C ATOM 69590 H12R PA 1681 13.129 91.172 37.020 1.00 0.00 H ATOM 69591 H12S PA 1681 13.983 92.207 38.111 1.00 0.00 H ATOM 69592 C111 PA 1681 15.184 90.933 36.883 1.00 0.00 C ATOM 69593 H11R PA 1681 15.243 90.159 37.652 1.00 0.00 H ATOM 69594 H11S PA 1681 16.104 91.511 36.993 1.00 0.00 H ATOM 69595 C110 PA 1681 15.178 90.150 35.549 1.00 0.00 C ATOM 69596 H10R PA 1681 15.085 90.850 34.717 1.00 0.00 H ATOM 69597 H10S PA 1681 14.366 89.421 35.503 1.00 0.00 H ATOM 69598 C19 PA 1681 16.504 89.441 35.190 1.00 0.00 C ATOM 69599 H9R PA 1681 16.926 88.809 35.974 1.00 0.00 H ATOM 69600 H9S PA 1681 17.186 90.278 35.027 1.00 0.00 H ATOM 69601 C18 PA 1681 16.558 88.511 34.000 1.00 0.00 C ATOM 69602 H8R PA 1681 16.161 87.553 34.342 1.00 0.00 H ATOM 69603 H8S PA 1681 17.556 88.215 33.670 1.00 0.00 H ATOM 69604 C17 PA 1681 15.597 88.976 32.797 1.00 0.00 C ATOM 69605 H7R PA 1681 14.542 88.985 33.078 1.00 0.00 H ATOM 69606 H7S PA 1681 15.734 88.273 31.973 1.00 0.00 H ATOM 69607 C16 PA 1681 16.014 90.282 32.126 1.00 0.00 C ATOM 69608 H6R PA 1681 17.060 90.273 31.815 1.00 0.00 H ATOM 69609 H6S PA 1681 15.943 91.053 32.897 1.00 0.00 H ATOM 69610 C15 PA 1681 15.109 90.552 30.875 1.00 0.00 C ATOM 69611 H5R PA 1681 14.041 90.505 31.097 1.00 0.00 H ATOM 69612 H5S PA 1681 15.238 89.745 30.150 1.00 0.00 H ATOM 69613 C14 PA 1681 15.432 91.829 30.272 1.00 0.00 C ATOM 69614 H4R PA 1681 16.441 92.224 30.409 1.00 0.00 H ATOM 69615 H4S PA 1681 14.706 92.542 30.669 1.00 0.00 H ATOM 69616 C13 PA 1681 15.284 91.938 28.719 1.00 0.00 C ATOM 69617 H3R PA 1681 14.394 91.511 28.252 1.00 0.00 H ATOM 69618 H3S PA 1681 16.080 91.276 28.371 1.00 0.00 H ATOM 69619 C12 PA 1681 15.611 93.333 28.167 1.00 0.00 C ATOM 69620 H2R PA 1681 15.211 94.078 28.858 1.00 0.00 H ATOM 69621 H2S PA 1681 16.696 93.360 28.041 1.00 0.00 H ATOM 69622 C11 PGR 1682 14.917 93.718 26.787 1.00 0.00 C ATOM 69623 O12 PGR 1682 14.585 92.860 25.988 1.00 0.00 O ATOM 69624 O11 PGR 1682 15.015 94.990 26.445 1.00 0.00 O ATOM 69625 C1 PGR 1682 14.178 95.514 25.293 1.00 0.00 C ATOM 69626 HR PGR 1682 14.294 94.827 24.450 1.00 0.00 H ATOM 69627 HS PGR 1682 14.442 96.533 24.998 1.00 0.00 H ATOM 69628 C2 PGR 1682 12.732 95.443 25.709 1.00 0.00 C ATOM 69629 HX PGR 1682 12.437 94.429 25.991 1.00 0.00 H ATOM 69630 C3 PGR 1682 11.829 95.823 24.489 1.00 0.00 C ATOM 69631 HA PGR 1682 11.938 96.906 24.387 1.00 0.00 H ATOM 69632 HB PGR 1682 10.792 95.602 24.754 1.00 0.00 H ATOM 69633 O31 PGR 1682 12.316 95.216 23.297 1.00 0.00 O ATOM 69634 P31 PGR 1682 12.376 96.013 21.929 1.00 0.00 P ATOM 69635 O32 PGR 1682 10.786 96.110 21.592 1.00 0.00 O ATOM 69636 C31 PGR 1682 10.313 96.546 20.410 1.00 0.00 C ATOM 69637 H1A PGR 1682 9.496 95.968 19.971 1.00 0.00 H ATOM 69638 H1B PGR 1682 11.139 96.464 19.698 1.00 0.00 H ATOM 69639 C32 PGR 1682 9.744 97.990 20.556 1.00 0.00 C ATOM 69640 H2A PGR 1682 10.605 98.605 20.830 1.00 0.00 H ATOM 69641 O35 PGR 1682 8.662 98.041 21.509 1.00 0.00 O ATOM 69642 HO5A PGR 1682 8.815 97.384 22.212 1.00 0.00 H ATOM 69643 C33 PGR 1682 9.153 98.394 19.093 1.00 0.00 C ATOM 69644 H3A PGR 1682 9.766 98.323 18.191 1.00 0.00 H ATOM 69645 H3B PGR 1682 8.272 97.747 19.050 1.00 0.00 H ATOM 69646 O33 PGR 1682 12.882 97.356 22.132 1.00 0.00 O ATOM 69647 O34 PGR 1682 13.082 95.135 21.009 1.00 0.00 O ATOM 69648 O21 PGR 1682 12.445 96.416 26.791 1.00 0.00 O ATOM 69649 C21 PGR 1682 12.478 95.862 28.061 1.00 0.00 C ATOM 69650 O22 PGR 1682 12.650 94.716 28.265 1.00 0.00 O ATOM 69651 O36 PGR 1682 8.773 99.789 19.271 1.00 0.00 O ATOM 69652 HO6A PGR 1682 8.963 100.436 18.569 1.00 0.00 H ATOM 69653 C12 OL 1683 12.631 96.875 29.154 1.00 0.00 C ATOM 69654 H2R OL 1683 12.060 97.772 28.906 1.00 0.00 H ATOM 69655 H2S OL 1683 12.197 96.498 30.083 1.00 0.00 H ATOM 69656 C13 OL 1683 14.131 97.334 29.380 1.00 0.00 C ATOM 69657 H3R OL 1683 14.768 96.452 29.470 1.00 0.00 H ATOM 69658 H3S OL 1683 14.429 97.994 28.562 1.00 0.00 H ATOM 69659 C14 OL 1683 14.234 98.001 30.782 1.00 0.00 C ATOM 69660 H4R OL 1683 13.901 99.036 30.880 1.00 0.00 H ATOM 69661 H4S OL 1683 13.802 97.523 31.663 1.00 0.00 H ATOM 69662 C15 OL 1683 15.733 98.113 31.066 1.00 0.00 C ATOM 69663 H5R OL 1683 16.089 97.083 31.148 1.00 0.00 H ATOM 69664 H5S OL 1683 16.197 98.463 30.142 1.00 0.00 H ATOM 69665 C16 OL 1683 16.193 98.923 32.260 1.00 0.00 C ATOM 69666 H6R OL 1683 17.241 98.767 32.523 1.00 0.00 H ATOM 69667 H6S OL 1683 15.971 99.979 32.096 1.00 0.00 H ATOM 69668 C17 OL 1683 15.476 98.627 33.563 1.00 0.00 C ATOM 69669 H7R OL 1683 14.389 98.731 33.540 1.00 0.00 H ATOM 69670 H7S OL 1683 15.713 97.627 33.931 1.00 0.00 H ATOM 69671 C18 OL 1683 15.932 99.654 34.552 1.00 0.00 C ATOM 69672 H8R OL 1683 16.965 99.414 34.813 1.00 0.00 H ATOM 69673 H8S OL 1683 15.971 100.675 34.167 1.00 0.00 H ATOM 69674 C19 OL 1683 15.013 99.779 35.722 1.00 0.00 C ATOM 69675 H9R OL 1683 14.144 100.393 35.498 1.00 0.00 H ATOM 69676 C110 OL 1683 15.092 99.146 36.884 1.00 0.00 C ATOM 69677 H10R OL 1683 14.348 99.343 37.651 1.00 0.00 H ATOM 69678 C111 OL 1683 16.032 98.011 37.203 1.00 0.00 C ATOM 69679 H11R OL 1683 15.374 97.153 37.052 1.00 0.00 H ATOM 69680 H11S OL 1683 16.890 97.926 36.532 1.00 0.00 H ATOM 69681 C112 OL 1683 16.301 97.911 38.651 1.00 0.00 C ATOM 69682 H12R OL 1683 16.672 98.866 39.030 1.00 0.00 H ATOM 69683 H12S OL 1683 15.343 97.996 39.168 1.00 0.00 H ATOM 69684 C113 OL 1683 17.136 96.780 39.176 1.00 0.00 C ATOM 69685 H13R OL 1683 17.035 95.793 38.720 1.00 0.00 H ATOM 69686 H13S OL 1683 18.155 97.055 38.898 1.00 0.00 H ATOM 69687 C114 OL 1683 17.154 96.656 40.647 1.00 0.00 C ATOM 69688 H14R OL 1683 16.921 97.604 41.136 1.00 0.00 H ATOM 69689 H14S OL 1683 16.375 95.982 41.011 1.00 0.00 H ATOM 69690 C115 OL 1683 18.529 96.335 41.256 1.00 0.00 C ATOM 69691 H15R OL 1683 19.317 96.982 40.866 1.00 0.00 H ATOM 69692 H15S OL 1683 18.357 96.607 42.300 1.00 0.00 H ATOM 69693 C116 OL 1683 19.087 94.971 41.163 1.00 0.00 C ATOM 69694 H16R OL 1683 18.427 94.316 40.589 1.00 0.00 H ATOM 69695 H16S OL 1683 20.046 95.040 40.646 1.00 0.00 H ATOM 69696 C117 OL 1683 19.505 94.440 42.519 1.00 0.00 C ATOM 69697 H17R OL 1683 20.221 95.131 42.970 1.00 0.00 H ATOM 69698 H17S OL 1683 18.552 94.383 43.050 1.00 0.00 H ATOM 69699 C118 OL 1683 19.938 93.026 42.571 1.00 0.00 C ATOM 69700 H18R OL 1683 20.604 92.781 41.741 1.00 0.00 H ATOM 69701 H18S OL 1683 19.097 92.354 42.387 1.00 0.00 H ATOM 69702 H18T OL 1683 20.301 92.782 43.572 1.00 0.00 H TER 69703 OL 1683 ATOM 69703 C116 PA 1684 24.143 40.665 38.728 1.00 0.00 C ATOM 69704 H16R PA 1684 24.025 41.658 39.168 1.00 0.00 H ATOM 69705 H16S PA 1684 23.249 40.417 38.153 1.00 0.00 H ATOM 69706 H16T PA 1684 24.924 40.829 37.983 1.00 0.00 H ATOM 69707 C115 PA 1684 24.381 39.616 39.711 1.00 0.00 C ATOM 69708 H15R PA 1684 23.729 39.786 40.571 1.00 0.00 H ATOM 69709 H15S PA 1684 25.342 39.637 40.230 1.00 0.00 H ATOM 69710 C114 PA 1684 24.112 38.227 39.259 1.00 0.00 C ATOM 69711 H14R PA 1684 24.930 37.990 38.576 1.00 0.00 H ATOM 69712 H14S PA 1684 23.143 38.223 38.756 1.00 0.00 H ATOM 69713 C113 PA 1684 23.984 37.202 40.426 1.00 0.00 C ATOM 69714 H13R PA 1684 22.998 37.268 40.890 1.00 0.00 H ATOM 69715 H13S PA 1684 24.621 37.202 41.313 1.00 0.00 H ATOM 69716 C112 PA 1684 24.251 35.847 39.869 1.00 0.00 C ATOM 69717 H12R PA 1684 24.179 35.087 40.650 1.00 0.00 H ATOM 69718 H12S PA 1684 25.274 35.859 39.487 1.00 0.00 H ATOM 69719 C111 PA 1684 23.372 35.359 38.789 1.00 0.00 C ATOM 69720 H11R PA 1684 23.424 36.071 37.962 1.00 0.00 H ATOM 69721 H11S PA 1684 22.338 35.380 39.140 1.00 0.00 H ATOM 69722 C110 PA 1684 23.666 33.902 38.350 1.00 0.00 C ATOM 69723 H10R PA 1684 23.312 33.226 39.131 1.00 0.00 H ATOM 69724 H10S PA 1684 24.727 33.688 38.209 1.00 0.00 H ATOM 69725 C19 PA 1684 22.892 33.819 37.016 1.00 0.00 C ATOM 69726 H9R PA 1684 23.479 34.587 36.509 1.00 0.00 H ATOM 69727 H9S PA 1684 21.891 34.190 37.246 1.00 0.00 H ATOM 69728 C18 PA 1684 22.907 32.537 36.246 1.00 0.00 C ATOM 69729 H8R PA 1684 22.393 31.706 36.733 1.00 0.00 H ATOM 69730 H8S PA 1684 23.910 32.104 36.251 1.00 0.00 H ATOM 69731 C17 PA 1684 22.346 32.852 34.843 1.00 0.00 C ATOM 69732 H7R PA 1684 22.358 31.898 34.312 1.00 0.00 H ATOM 69733 H7S PA 1684 23.096 33.539 34.446 1.00 0.00 H ATOM 69734 C16 PA 1684 21.008 33.582 34.740 1.00 0.00 C ATOM 69735 H6R PA 1684 21.055 34.569 35.206 1.00 0.00 H ATOM 69736 H6S PA 1684 20.264 33.060 35.345 1.00 0.00 H ATOM 69737 C15 PA 1684 20.518 33.850 33.303 1.00 0.00 C ATOM 69738 H5R PA 1684 19.534 34.301 33.443 1.00 0.00 H ATOM 69739 H5S PA 1684 20.310 32.989 32.664 1.00 0.00 H ATOM 69740 C14 PA 1684 21.195 34.987 32.472 1.00 0.00 C ATOM 69741 H4R PA 1684 21.467 35.794 33.156 1.00 0.00 H ATOM 69742 H4S PA 1684 20.571 35.411 31.683 1.00 0.00 H ATOM 69743 C13 PA 1684 22.369 34.512 31.592 1.00 0.00 C ATOM 69744 H3R PA 1684 21.913 33.721 30.994 1.00 0.00 H ATOM 69745 H3S PA 1684 23.202 34.136 32.189 1.00 0.00 H ATOM 69746 C12 PA 1684 23.021 35.738 30.773 1.00 0.00 C ATOM 69747 H2R PA 1684 23.561 36.512 31.323 1.00 0.00 H ATOM 69748 H2S PA 1684 22.182 36.239 30.285 1.00 0.00 H ATOM 69749 C11 PC 1685 23.895 35.239 29.613 1.00 0.00 C ATOM 69750 O12 PC 1685 23.568 34.598 28.630 1.00 0.00 O ATOM 69751 O11 PC 1685 25.217 35.542 29.876 1.00 0.00 O ATOM 69752 C1 PC 1685 26.217 35.096 28.923 1.00 0.00 C ATOM 69753 HR PC 1685 25.723 34.469 28.176 1.00 0.00 H ATOM 69754 HS PC 1685 26.979 34.514 29.447 1.00 0.00 H ATOM 69755 C2 PC 1685 26.894 36.288 28.273 1.00 0.00 C ATOM 69756 HX PC 1685 26.029 36.887 27.976 1.00 0.00 H ATOM 69757 C3 PC 1685 27.688 35.978 27.021 1.00 0.00 C ATOM 69758 HA PC 1685 28.479 35.262 27.255 1.00 0.00 H ATOM 69759 HB PC 1685 28.252 36.856 26.694 1.00 0.00 H ATOM 69760 O31 PC 1685 26.856 35.564 25.936 1.00 0.00 O ATOM 69761 P31 PC 1685 27.468 35.295 24.494 1.00 0.00 P ATOM 69762 O32 PC 1685 28.098 36.764 24.155 1.00 0.00 O ATOM 69763 C31 PC 1685 27.311 37.880 24.204 1.00 0.00 C ATOM 69764 H1A PC 1685 26.729 37.865 25.129 1.00 0.00 H ATOM 69765 H1B PC 1685 26.678 37.894 23.313 1.00 0.00 H ATOM 69766 C32 PC 1685 28.122 39.133 24.178 1.00 0.00 C ATOM 69767 H2A PC 1685 28.718 39.078 23.266 1.00 0.00 H ATOM 69768 H2B PC 1685 28.821 39.111 25.015 1.00 0.00 H ATOM 69769 N31 PC 1685 27.355 40.400 24.230 1.00 0.00 N ATOM 69770 C33 PC 1685 26.400 40.455 23.055 1.00 0.00 C ATOM 69771 H3A PC 1685 25.602 39.755 23.306 1.00 0.00 H ATOM 69772 H3B PC 1685 26.912 40.071 22.171 1.00 0.00 H ATOM 69773 H3C PC 1685 26.086 41.488 22.901 1.00 0.00 H ATOM 69774 C34 PC 1685 26.633 40.509 25.479 1.00 0.00 C ATOM 69775 H4A PC 1685 26.070 41.443 25.506 1.00 0.00 H ATOM 69776 H4B PC 1685 27.380 40.488 26.274 1.00 0.00 H ATOM 69777 H4C PC 1685 25.933 39.676 25.560 1.00 0.00 H ATOM 69778 C35 PC 1685 28.210 41.626 24.071 1.00 0.00 C ATOM 69779 H5A PC 1685 28.758 41.853 24.986 1.00 0.00 H ATOM 69780 H5B PC 1685 27.592 42.451 23.713 1.00 0.00 H ATOM 69781 H5C PC 1685 28.904 41.429 23.252 1.00 0.00 H ATOM 69782 O33 PC 1685 28.557 34.272 24.680 1.00 0.00 O ATOM 69783 O34 PC 1685 26.328 35.012 23.556 1.00 0.00 O ATOM 69784 O21 PC 1685 27.774 36.769 29.232 1.00 0.00 O ATOM 69785 C21 PC 1685 28.520 37.886 29.098 1.00 0.00 C ATOM 69786 O22 PC 1685 28.474 38.730 28.201 1.00 0.00 O ATOM 69787 C12 OL 1686 29.538 37.922 30.087 1.00 0.00 C ATOM 69788 H2R OL 1686 29.166 37.971 31.113 1.00 0.00 H ATOM 69789 H2S OL 1686 30.080 36.974 30.067 1.00 0.00 H ATOM 69790 C13 OL 1686 30.511 39.096 29.993 1.00 0.00 C ATOM 69791 H3R OL 1686 30.712 39.150 28.921 1.00 0.00 H ATOM 69792 H3S OL 1686 29.928 40.009 30.125 1.00 0.00 H ATOM 69793 C14 OL 1686 31.632 38.932 30.910 1.00 0.00 C ATOM 69794 H4R OL 1686 31.223 38.849 31.919 1.00 0.00 H ATOM 69795 H4S OL 1686 32.262 38.091 30.613 1.00 0.00 H ATOM 69796 C15 OL 1686 32.600 40.086 30.901 1.00 0.00 C ATOM 69797 H5R OL 1686 33.290 39.948 30.066 1.00 0.00 H ATOM 69798 H5S OL 1686 32.068 41.039 30.909 1.00 0.00 H ATOM 69799 C16 OL 1686 33.454 40.107 32.138 1.00 0.00 C ATOM 69800 H6R OL 1686 32.780 40.191 32.993 1.00 0.00 H ATOM 69801 H6S OL 1686 34.033 39.187 32.242 1.00 0.00 H ATOM 69802 C17 OL 1686 34.366 41.266 32.234 1.00 0.00 C ATOM 69803 H7R OL 1686 35.059 41.193 31.393 1.00 0.00 H ATOM 69804 H7S OL 1686 33.713 42.139 32.190 1.00 0.00 H ATOM 69805 C18 OL 1686 35.026 41.280 33.593 1.00 0.00 C ATOM 69806 H8R OL 1686 35.542 42.226 33.765 1.00 0.00 H ATOM 69807 H8S OL 1686 34.347 41.314 34.447 1.00 0.00 H ATOM 69808 C19 OL 1686 36.053 40.163 33.841 1.00 0.00 C ATOM 69809 H9R OL 1686 36.636 39.863 32.974 1.00 0.00 H ATOM 69810 C110 OL 1686 36.307 39.582 35.002 1.00 0.00 C ATOM 69811 H10R OL 1686 37.037 38.778 35.046 1.00 0.00 H ATOM 69812 C111 OL 1686 35.511 39.909 36.224 1.00 0.00 C ATOM 69813 H11R OL 1686 35.650 40.957 36.501 1.00 0.00 H ATOM 69814 H11S OL 1686 34.459 39.724 35.999 1.00 0.00 H ATOM 69815 C112 OL 1686 35.858 38.953 37.357 1.00 0.00 C ATOM 69816 H12R OL 1686 35.452 37.946 37.242 1.00 0.00 H ATOM 69817 H12S OL 1686 36.949 38.919 37.311 1.00 0.00 H ATOM 69818 C113 OL 1686 35.315 39.478 38.718 1.00 0.00 C ATOM 69819 H13R OL 1686 36.173 39.567 39.387 1.00 0.00 H ATOM 69820 H13S OL 1686 34.977 40.507 38.586 1.00 0.00 H ATOM 69821 C114 OL 1686 34.129 38.717 39.369 1.00 0.00 C ATOM 69822 H14R OL 1686 33.142 38.934 38.957 1.00 0.00 H ATOM 69823 H14S OL 1686 34.247 37.632 39.312 1.00 0.00 H ATOM 69824 C115 OL 1686 33.964 39.089 40.828 1.00 0.00 C ATOM 69825 H15R OL 1686 34.869 38.786 41.360 1.00 0.00 H ATOM 69826 H15S OL 1686 34.011 40.180 40.837 1.00 0.00 H ATOM 69827 C116 OL 1686 32.863 38.385 41.546 1.00 0.00 C ATOM 69828 H16R OL 1686 32.024 38.354 40.847 1.00 0.00 H ATOM 69829 H16S OL 1686 33.271 37.380 41.675 1.00 0.00 H ATOM 69830 C117 OL 1686 32.621 39.046 42.898 1.00 0.00 C ATOM 69831 H17R OL 1686 33.513 39.258 43.491 1.00 0.00 H ATOM 69832 H17S OL 1686 32.348 40.066 42.617 1.00 0.00 H ATOM 69833 C118 OL 1686 31.609 38.257 43.709 1.00 0.00 C ATOM 69834 H18R OL 1686 31.977 37.380 44.246 1.00 0.00 H ATOM 69835 H18S OL 1686 30.634 38.060 43.259 1.00 0.00 H ATOM 69836 H18T OL 1686 31.209 38.808 44.564 1.00 0.00 H TER 69837 OL 1686 ATOM 69837 C116 PA 1687 5.092 144.452 44.272 1.00 0.00 C ATOM 69838 H16R PA 1687 4.985 145.536 44.195 1.00 0.00 H ATOM 69839 H16S PA 1687 6.102 144.286 44.651 1.00 0.00 H ATOM 69840 H16T PA 1687 4.493 144.252 45.163 1.00 0.00 H ATOM 69841 C115 PA 1687 4.630 143.501 43.185 1.00 0.00 C ATOM 69842 H15R PA 1687 3.579 143.720 42.984 1.00 0.00 H ATOM 69843 H15S PA 1687 4.677 142.434 43.414 1.00 0.00 H ATOM 69844 C114 PA 1687 5.271 143.645 41.789 1.00 0.00 C ATOM 69845 H14R PA 1687 6.303 143.341 41.975 1.00 0.00 H ATOM 69846 H14S PA 1687 5.311 144.651 41.365 1.00 0.00 H ATOM 69847 C113 PA 1687 4.733 142.686 40.832 1.00 0.00 C ATOM 69848 H13R PA 1687 4.389 141.810 41.387 1.00 0.00 H ATOM 69849 H13S PA 1687 5.549 142.343 40.192 1.00 0.00 H ATOM 69850 C112 PA 1687 3.660 143.192 39.825 1.00 0.00 C ATOM 69851 H12R PA 1687 3.040 144.027 40.158 1.00 0.00 H ATOM 69852 H12S PA 1687 3.017 142.319 39.693 1.00 0.00 H ATOM 69853 C111 PA 1687 4.186 143.347 38.416 1.00 0.00 C ATOM 69854 H11R PA 1687 4.408 142.339 38.059 1.00 0.00 H ATOM 69855 H11S PA 1687 5.130 143.888 38.509 1.00 0.00 H ATOM 69856 C110 PA 1687 3.194 144.011 37.431 1.00 0.00 C ATOM 69857 H10R PA 1687 2.745 144.945 37.777 1.00 0.00 H ATOM 69858 H10S PA 1687 2.452 143.240 37.215 1.00 0.00 H ATOM 69859 C19 PA 1687 3.757 144.370 36.080 1.00 0.00 C ATOM 69860 H9R PA 1687 4.339 145.266 36.308 1.00 0.00 H ATOM 69861 H9S PA 1687 2.881 144.593 35.468 1.00 0.00 H ATOM 69862 C18 PA 1687 4.632 143.366 35.410 1.00 0.00 C ATOM 69863 H8R PA 1687 4.080 142.442 35.227 1.00 0.00 H ATOM 69864 H8S PA 1687 5.444 142.998 36.040 1.00 0.00 H ATOM 69865 C17 PA 1687 5.165 143.913 34.068 1.00 0.00 C ATOM 69866 H7R PA 1687 5.933 144.665 34.261 1.00 0.00 H ATOM 69867 H7S PA 1687 4.385 144.518 33.601 1.00 0.00 H ATOM 69868 C16 PA 1687 5.731 142.866 33.228 1.00 0.00 C ATOM 69869 H6R PA 1687 4.993 142.114 32.942 1.00 0.00 H ATOM 69870 H6S PA 1687 6.554 142.420 33.790 1.00 0.00 H ATOM 69871 C15 PA 1687 6.309 143.349 31.900 1.00 0.00 C ATOM 69872 H5R PA 1687 7.164 144.000 32.099 1.00 0.00 H ATOM 69873 H5S PA 1687 5.568 143.844 31.268 1.00 0.00 H ATOM 69874 C14 PA 1687 6.971 142.276 31.080 1.00 0.00 C ATOM 69875 H4R PA 1687 6.353 141.388 30.929 1.00 0.00 H ATOM 69876 H4S PA 1687 7.875 141.938 31.591 1.00 0.00 H ATOM 69877 C13 PA 1687 7.369 142.770 29.687 1.00 0.00 C ATOM 69878 H3R PA 1687 7.980 143.665 29.823 1.00 0.00 H ATOM 69879 H3S PA 1687 6.467 143.126 29.186 1.00 0.00 H ATOM 69880 C12 PA 1687 8.194 141.718 28.970 1.00 0.00 C ATOM 69881 H2R PA 1687 7.725 140.732 28.963 1.00 0.00 H ATOM 69882 H2S PA 1687 9.158 141.620 29.475 1.00 0.00 H ATOM 69883 C11 PC 1688 8.658 142.030 27.612 1.00 0.00 C ATOM 69884 O12 PC 1688 8.543 143.137 27.034 1.00 0.00 O ATOM 69885 O11 PC 1688 9.210 140.947 26.979 1.00 0.00 O ATOM 69886 C1 PC 1688 9.682 141.035 25.658 1.00 0.00 C ATOM 69887 HR PC 1688 10.527 141.720 25.562 1.00 0.00 H ATOM 69888 HS PC 1688 8.843 141.279 25.001 1.00 0.00 H ATOM 69889 C2 PC 1688 10.208 139.714 25.166 1.00 0.00 C ATOM 69890 HX PC 1688 11.289 139.668 25.317 1.00 0.00 H ATOM 69891 C3 PC 1688 10.097 139.365 23.641 1.00 0.00 C ATOM 69892 HA PC 1688 10.732 140.063 23.089 1.00 0.00 H ATOM 69893 HB PC 1688 9.074 139.486 23.276 1.00 0.00 H ATOM 69894 O31 PC 1688 10.524 138.035 23.399 1.00 0.00 O ATOM 69895 P31 PC 1688 10.480 137.350 21.976 1.00 0.00 P ATOM 69896 O32 PC 1688 8.966 136.931 21.749 1.00 0.00 O ATOM 69897 C31 PC 1688 8.365 135.980 22.563 1.00 0.00 C ATOM 69898 H1A PC 1688 8.142 136.523 23.485 1.00 0.00 H ATOM 69899 H1B PC 1688 9.067 135.145 22.628 1.00 0.00 H ATOM 69900 C32 PC 1688 7.038 135.651 21.833 1.00 0.00 C ATOM 69901 H2A PC 1688 6.343 136.492 21.803 1.00 0.00 H ATOM 69902 H2B PC 1688 6.510 134.931 22.461 1.00 0.00 H ATOM 69903 N31 PC 1688 7.054 135.012 20.514 1.00 0.00 N ATOM 69904 C33 PC 1688 7.157 136.082 19.450 1.00 0.00 C ATOM 69905 H3A PC 1688 7.955 136.783 19.700 1.00 0.00 H ATOM 69906 H3B PC 1688 6.180 136.560 19.374 1.00 0.00 H ATOM 69907 H3C PC 1688 7.369 135.643 18.474 1.00 0.00 H ATOM 69908 C34 PC 1688 8.138 134.046 20.291 1.00 0.00 C ATOM 69909 H4A PC 1688 8.183 133.380 21.155 1.00 0.00 H ATOM 69910 H4B PC 1688 9.080 134.585 20.184 1.00 0.00 H ATOM 69911 H4C PC 1688 7.939 133.576 19.327 1.00 0.00 H ATOM 69912 C35 PC 1688 5.653 134.396 20.379 1.00 0.00 C ATOM 69913 H5A PC 1688 4.990 135.183 20.743 1.00 0.00 H ATOM 69914 H5B PC 1688 5.575 133.474 20.956 1.00 0.00 H ATOM 69915 H5C PC 1688 5.453 134.383 19.306 1.00 0.00 H ATOM 69916 O33 PC 1688 10.769 138.372 20.956 1.00 0.00 O ATOM 69917 O34 PC 1688 11.291 136.141 22.097 1.00 0.00 O ATOM 69918 O21 PC 1688 9.670 138.613 25.899 1.00 0.00 O ATOM 69919 C21 PC 1688 8.325 138.293 25.843 1.00 0.00 C ATOM 69920 O22 PC 1688 7.434 138.947 25.247 1.00 0.00 O ATOM 69921 C12 OL 1689 7.981 137.001 26.531 1.00 0.00 C ATOM 69922 H2R OL 1689 8.093 136.129 25.883 1.00 0.00 H ATOM 69923 H2S OL 1689 8.674 136.908 27.369 1.00 0.00 H ATOM 69924 C13 OL 1689 6.550 137.052 27.054 1.00 0.00 C ATOM 69925 H3R OL 1689 6.493 137.877 27.767 1.00 0.00 H ATOM 69926 H3S OL 1689 5.830 137.268 26.262 1.00 0.00 H ATOM 69927 C14 OL 1689 6.157 135.725 27.667 1.00 0.00 C ATOM 69928 H4R OL 1689 5.076 135.568 27.670 1.00 0.00 H ATOM 69929 H4S OL 1689 6.408 134.919 26.975 1.00 0.00 H ATOM 69930 C15 OL 1689 6.825 135.457 28.972 1.00 0.00 C ATOM 69931 H5R OL 1689 7.895 135.533 28.764 1.00 0.00 H ATOM 69932 H5S OL 1689 6.701 136.271 29.689 1.00 0.00 H ATOM 69933 C16 OL 1689 6.328 134.183 29.737 1.00 0.00 C ATOM 69934 H6R OL 1689 5.256 134.284 29.922 1.00 0.00 H ATOM 69935 H6S OL 1689 6.507 133.325 29.085 1.00 0.00 H ATOM 69936 C17 OL 1689 6.924 133.982 31.069 1.00 0.00 C ATOM 69937 H7R OL 1689 7.995 133.791 30.968 1.00 0.00 H ATOM 69938 H7S OL 1689 6.816 134.911 31.632 1.00 0.00 H ATOM 69939 C18 OL 1689 6.271 132.746 31.800 1.00 0.00 C ATOM 69940 H8R OL 1689 6.112 131.899 31.129 1.00 0.00 H ATOM 69941 H8S OL 1689 7.080 132.472 32.480 1.00 0.00 H ATOM 69942 C19 OL 1689 5.109 132.829 32.668 1.00 0.00 C ATOM 69943 H9R OL 1689 4.192 132.657 32.111 1.00 0.00 H ATOM 69944 C110 OL 1689 5.115 133.130 33.976 1.00 0.00 C ATOM 69945 H10R OL 1689 4.163 133.330 34.462 1.00 0.00 H ATOM 69946 C111 OL 1689 6.323 133.455 34.756 1.00 0.00 C ATOM 69947 H11R OL 1689 7.128 132.796 34.425 1.00 0.00 H ATOM 69948 H11S OL 1689 6.542 134.492 34.490 1.00 0.00 H ATOM 69949 C112 OL 1689 6.096 133.335 36.283 1.00 0.00 C ATOM 69950 H12R OL 1689 5.026 133.153 36.408 1.00 0.00 H ATOM 69951 H12S OL 1689 6.624 132.501 36.749 1.00 0.00 H ATOM 69952 C113 OL 1689 6.622 134.534 37.116 1.00 0.00 C ATOM 69953 H13R OL 1689 6.274 135.448 36.630 1.00 0.00 H ATOM 69954 H13S OL 1689 6.159 134.491 38.104 1.00 0.00 H ATOM 69955 C114 OL 1689 8.176 134.677 37.250 1.00 0.00 C ATOM 69956 H14R OL 1689 8.553 133.746 37.680 1.00 0.00 H ATOM 69957 H14S OL 1689 8.663 134.767 36.277 1.00 0.00 H ATOM 69958 C115 OL 1689 8.681 135.772 38.046 1.00 0.00 C ATOM 69959 H15R OL 1689 8.030 136.616 37.808 1.00 0.00 H ATOM 69960 H15S OL 1689 8.598 135.538 39.109 1.00 0.00 H ATOM 69961 C116 OL 1689 10.076 136.178 37.736 1.00 0.00 C ATOM 69962 H16R OL 1689 10.256 135.987 36.676 1.00 0.00 H ATOM 69963 H16S OL 1689 10.081 137.267 37.811 1.00 0.00 H ATOM 69964 C117 OL 1689 11.138 135.465 38.567 1.00 0.00 C ATOM 69965 H17R OL 1689 10.966 134.389 38.506 1.00 0.00 H ATOM 69966 H17S OL 1689 12.093 135.668 38.077 1.00 0.00 H ATOM 69967 C118 OL 1689 11.230 135.782 40.092 1.00 0.00 C ATOM 69968 H18R OL 1689 10.277 135.848 40.620 1.00 0.00 H ATOM 69969 H18S OL 1689 11.697 136.761 40.220 1.00 0.00 H ATOM 69970 H18T OL 1689 11.869 134.984 40.475 1.00 0.00 H TER 69971 OL 1689 ATOM 69971 C116 PA 1690 72.763 8.945 39.873 1.00 0.00 C ATOM 69972 H16R PA 1690 72.709 10.034 39.816 1.00 0.00 H ATOM 69973 H16S PA 1690 72.136 8.632 40.711 1.00 0.00 H ATOM 69974 H16T PA 1690 72.180 8.682 38.988 1.00 0.00 H ATOM 69975 C115 PA 1690 74.159 8.258 40.080 1.00 0.00 C ATOM 69976 H15R PA 1690 74.007 7.180 40.166 1.00 0.00 H ATOM 69977 H15S PA 1690 74.501 8.562 41.071 1.00 0.00 H ATOM 69978 C114 PA 1690 75.031 8.348 38.868 1.00 0.00 C ATOM 69979 H14R PA 1690 75.668 9.225 39.005 1.00 0.00 H ATOM 69980 H14S PA 1690 74.448 8.437 37.949 1.00 0.00 H ATOM 69981 C113 PA 1690 76.024 7.195 38.745 1.00 0.00 C ATOM 69982 H13R PA 1690 75.506 6.245 38.602 1.00 0.00 H ATOM 69983 H13S PA 1690 76.685 7.085 39.608 1.00 0.00 H ATOM 69984 C112 PA 1690 76.917 7.157 37.468 1.00 0.00 C ATOM 69985 H12R PA 1690 77.727 6.438 37.607 1.00 0.00 H ATOM 69986 H12S PA 1690 77.518 8.068 37.459 1.00 0.00 H ATOM 69987 C111 PA 1690 76.215 6.893 36.116 1.00 0.00 C ATOM 69988 H11R PA 1690 75.383 7.568 35.910 1.00 0.00 H ATOM 69989 H11S PA 1690 75.720 5.920 36.161 1.00 0.00 H ATOM 69990 C110 PA 1690 77.219 6.842 35.007 1.00 0.00 C ATOM 69991 H10R PA 1690 77.941 6.070 35.281 1.00 0.00 H ATOM 69992 H10S PA 1690 77.909 7.685 35.081 1.00 0.00 H ATOM 69993 C19 PA 1690 76.633 6.668 33.574 1.00 0.00 C ATOM 69994 H9R PA 1690 75.947 7.507 33.442 1.00 0.00 H ATOM 69995 H9S PA 1690 76.094 5.718 33.550 1.00 0.00 H ATOM 69996 C18 PA 1690 77.777 6.797 32.530 1.00 0.00 C ATOM 69997 H8R PA 1690 78.527 6.004 32.501 1.00 0.00 H ATOM 69998 H8S PA 1690 78.127 7.820 32.685 1.00 0.00 H ATOM 69999 C17 PA 1690 77.303 6.786 31.081 1.00 0.00 C ATOM 70000 H7R PA 1690 78.102 7.104 30.407 1.00 0.00 H ATOM 70001 H7S PA 1690 76.570 7.585 30.946 1.00 0.00 H ATOM 70002 C16 PA 1690 76.808 5.507 30.535 1.00 0.00 C ATOM 70003 H6R PA 1690 75.830 5.709 30.093 1.00 0.00 H ATOM 70004 H6S PA 1690 76.593 4.758 31.300 1.00 0.00 H ATOM 70005 C15 PA 1690 77.876 4.858 29.527 1.00 0.00 C ATOM 70006 H5R PA 1690 78.833 4.900 30.051 1.00 0.00 H ATOM 70007 H5S PA 1690 78.082 5.591 28.744 1.00 0.00 H ATOM 70008 C14 PA 1690 77.510 3.437 29.036 1.00 0.00 C ATOM 70009 H4R PA 1690 76.420 3.402 29.109 1.00 0.00 H ATOM 70010 H4S PA 1690 77.821 2.678 29.758 1.00 0.00 H ATOM 70011 C13 PA 1690 78.035 3.113 27.616 1.00 0.00 C ATOM 70012 H3R PA 1690 79.124 3.181 27.665 1.00 0.00 H ATOM 70013 H3S PA 1690 77.699 3.835 26.868 1.00 0.00 H ATOM 70014 C12 PA 1690 77.687 1.675 27.200 1.00 0.00 C ATOM 70015 H2R PA 1690 76.669 1.298 27.317 1.00 0.00 H ATOM 70016 H2S PA 1690 78.288 0.896 27.674 1.00 0.00 H ATOM 70017 C11 PGR 1691 78.016 1.438 25.768 1.00 0.00 C ATOM 70018 O12 PGR 1691 78.760 2.119 25.105 1.00 0.00 O ATOM 70019 O11 PGR 1691 77.302 0.374 25.172 1.00 0.00 O ATOM 70020 C1 PGR 1691 77.535 0.135 23.777 1.00 0.00 C ATOM 70021 HR PGR 1691 77.479 1.049 23.181 1.00 0.00 H ATOM 70022 HS PGR 1691 76.708 -0.482 23.418 1.00 0.00 H ATOM 70023 C2 PGR 1691 78.849 -0.575 23.452 1.00 0.00 C ATOM 70024 HX PGR 1691 79.642 0.176 23.466 1.00 0.00 H ATOM 70025 C3 PGR 1691 78.670 -1.174 21.999 1.00 0.00 C ATOM 70026 HA PGR 1691 78.211 -0.390 21.391 1.00 0.00 H ATOM 70027 HB PGR 1691 77.957 -2.002 21.986 1.00 0.00 H ATOM 70028 O31 PGR 1691 79.905 -1.475 21.498 1.00 0.00 O ATOM 70029 P31 PGR 1691 80.148 -1.716 19.919 1.00 0.00 P ATOM 70030 O32 PGR 1691 80.003 -0.256 19.344 1.00 0.00 O ATOM 70031 C31 PGR 1691 80.897 0.722 19.928 1.00 0.00 C ATOM 70032 H1A PGR 1691 81.852 0.252 20.174 1.00 0.00 H ATOM 70033 H1B PGR 1691 80.519 0.916 20.935 1.00 0.00 H ATOM 70034 C32 PGR 1691 80.930 2.041 19.122 1.00 0.00 C ATOM 70035 H2A PGR 1691 80.046 2.678 19.205 1.00 0.00 H ATOM 70036 O35 PGR 1691 81.322 1.744 17.739 1.00 0.00 O ATOM 70037 HO5A PGR 1691 80.532 1.565 17.199 1.00 0.00 H ATOM 70038 C33 PGR 1691 82.079 2.893 19.630 1.00 0.00 C ATOM 70039 H3A PGR 1691 81.871 3.158 20.669 1.00 0.00 H ATOM 70040 H3B PGR 1691 83.065 2.425 19.688 1.00 0.00 H ATOM 70041 O33 PGR 1691 81.551 -2.184 19.691 1.00 0.00 O ATOM 70042 O34 PGR 1691 79.010 -2.448 19.357 1.00 0.00 O ATOM 70043 O21 PGR 1691 79.281 -1.619 24.363 1.00 0.00 O ATOM 70044 C21 PGR 1691 78.490 -2.616 24.757 1.00 0.00 C ATOM 70045 O22 PGR 1691 77.380 -2.741 24.297 1.00 0.00 O ATOM 70046 O36 PGR 1691 82.221 4.139 18.914 1.00 0.00 O ATOM 70047 HO6A PGR 1691 82.032 3.901 17.989 1.00 0.00 H ATOM 70048 C12 OL 1692 79.086 -3.556 25.726 1.00 0.00 C ATOM 70049 H2R OL 1692 79.115 -4.539 25.252 1.00 0.00 H ATOM 70050 H2S OL 1692 80.141 -3.284 25.797 1.00 0.00 H ATOM 70051 C13 OL 1692 78.369 -3.559 27.060 1.00 0.00 C ATOM 70052 H3R OL 1692 77.288 -3.709 27.060 1.00 0.00 H ATOM 70053 H3S OL 1692 78.695 -4.503 27.502 1.00 0.00 H ATOM 70054 C14 OL 1692 78.707 -2.366 27.922 1.00 0.00 C ATOM 70055 H4R OL 1692 79.734 -2.389 28.293 1.00 0.00 H ATOM 70056 H4S OL 1692 78.671 -1.459 27.315 1.00 0.00 H ATOM 70057 C15 OL 1692 77.766 -2.278 29.170 1.00 0.00 C ATOM 70058 H5R OL 1692 76.780 -2.103 28.734 1.00 0.00 H ATOM 70059 H5S OL 1692 77.710 -3.256 29.653 1.00 0.00 H ATOM 70060 C16 OL 1692 78.011 -1.152 30.109 1.00 0.00 C ATOM 70061 H6R OL 1692 79.029 -1.255 30.490 1.00 0.00 H ATOM 70062 H6S OL 1692 77.926 -0.190 29.600 1.00 0.00 H ATOM 70063 C17 OL 1692 77.071 -1.212 31.315 1.00 0.00 C ATOM 70064 H7R OL 1692 76.060 -0.982 30.972 1.00 0.00 H ATOM 70065 H7S OL 1692 77.035 -2.267 31.593 1.00 0.00 H ATOM 70066 C18 OL 1692 77.437 -0.337 32.492 1.00 0.00 C ATOM 70067 H8R OL 1692 76.856 -0.632 33.368 1.00 0.00 H ATOM 70068 H8S OL 1692 78.458 -0.570 32.805 1.00 0.00 H ATOM 70069 C19 OL 1692 77.339 1.103 32.222 1.00 0.00 C ATOM 70070 H9R OL 1692 77.777 1.362 31.261 1.00 0.00 H ATOM 70071 C110 OL 1692 76.952 2.093 33.108 1.00 0.00 C ATOM 70072 H10R OL 1692 77.043 3.094 32.694 1.00 0.00 H ATOM 70073 C111 OL 1692 76.483 1.901 34.478 1.00 0.00 C ATOM 70074 H11R OL 1692 75.515 2.405 34.513 1.00 0.00 H ATOM 70075 H11S OL 1692 76.431 0.868 34.829 1.00 0.00 H ATOM 70076 C112 OL 1692 77.351 2.524 35.672 1.00 0.00 C ATOM 70077 H12R OL 1692 78.272 1.937 35.700 1.00 0.00 H ATOM 70078 H12S OL 1692 77.484 3.586 35.456 1.00 0.00 H ATOM 70079 C113 OL 1692 76.644 2.247 37.113 1.00 0.00 C ATOM 70080 H13R OL 1692 75.567 2.066 37.092 1.00 0.00 H ATOM 70081 H13S OL 1692 77.030 1.315 37.531 1.00 0.00 H ATOM 70082 C114 OL 1692 76.914 3.373 38.112 1.00 0.00 C ATOM 70083 H14R OL 1692 77.927 3.158 38.459 1.00 0.00 H ATOM 70084 H14S OL 1692 76.772 4.386 37.731 1.00 0.00 H ATOM 70085 C115 OL 1692 75.918 3.233 39.338 1.00 0.00 C ATOM 70086 H15R OL 1692 74.991 3.685 38.978 1.00 0.00 H ATOM 70087 H15S OL 1692 75.462 2.247 39.447 1.00 0.00 H ATOM 70088 C116 OL 1692 76.409 3.831 40.579 1.00 0.00 C ATOM 70089 H16R OL 1692 77.292 3.227 40.798 1.00 0.00 H ATOM 70090 H16S OL 1692 76.751 4.856 40.424 1.00 0.00 H ATOM 70091 C117 OL 1692 75.413 3.843 41.720 1.00 0.00 C ATOM 70092 H17R OL 1692 74.663 4.528 41.319 1.00 0.00 H ATOM 70093 H17S OL 1692 74.999 2.840 41.849 1.00 0.00 H ATOM 70094 C118 OL 1692 76.007 4.479 43.012 1.00 0.00 C ATOM 70095 H18R OL 1692 76.345 5.517 42.990 1.00 0.00 H ATOM 70096 H18S OL 1692 76.801 3.794 43.317 1.00 0.00 H ATOM 70097 H18T OL 1692 75.350 4.456 43.884 1.00 0.00 H TER 70098 OL 1692 ATOM 70098 C116 PA 1693 3.360 79.115 41.661 1.00 0.00 C ATOM 70099 H16R PA 1693 2.464 79.737 41.628 1.00 0.00 H ATOM 70100 H16S PA 1693 4.264 79.551 42.090 1.00 0.00 H ATOM 70101 H16T PA 1693 3.190 78.317 42.387 1.00 0.00 H ATOM 70102 C115 PA 1693 3.666 78.579 40.190 1.00 0.00 C ATOM 70103 H15R PA 1693 3.699 79.450 39.532 1.00 0.00 H ATOM 70104 H15S PA 1693 2.831 78.032 39.748 1.00 0.00 H ATOM 70105 C114 PA 1693 4.969 77.725 40.209 1.00 0.00 C ATOM 70106 H14R PA 1693 4.822 76.883 40.889 1.00 0.00 H ATOM 70107 H14S PA 1693 5.820 78.349 40.489 1.00 0.00 H ATOM 70108 C113 PA 1693 5.356 76.828 38.985 1.00 0.00 C ATOM 70109 H13R PA 1693 5.597 77.360 38.062 1.00 0.00 H ATOM 70110 H13S PA 1693 4.514 76.238 38.616 1.00 0.00 H ATOM 70111 C112 PA 1693 6.468 75.883 39.351 1.00 0.00 C ATOM 70112 H12R PA 1693 6.225 75.358 40.277 1.00 0.00 H ATOM 70113 H12S PA 1693 7.398 76.409 39.577 1.00 0.00 H ATOM 70114 C111 PA 1693 6.853 74.859 38.276 1.00 0.00 C ATOM 70115 H11R PA 1693 6.015 74.187 38.076 1.00 0.00 H ATOM 70116 H11S PA 1693 7.603 74.225 38.752 1.00 0.00 H ATOM 70117 C110 PA 1693 7.432 75.407 36.983 1.00 0.00 C ATOM 70118 H10R PA 1693 8.415 75.804 37.246 1.00 0.00 H ATOM 70119 H10S PA 1693 6.752 76.190 36.639 1.00 0.00 H ATOM 70120 C19 PA 1693 7.546 74.299 35.884 1.00 0.00 C ATOM 70121 H9R PA 1693 6.706 73.602 35.920 1.00 0.00 H ATOM 70122 H9S PA 1693 8.434 73.714 36.132 1.00 0.00 H ATOM 70123 C18 PA 1693 7.748 74.880 34.457 1.00 0.00 C ATOM 70124 H8R PA 1693 8.619 75.531 34.563 1.00 0.00 H ATOM 70125 H8S PA 1693 7.008 75.422 33.864 1.00 0.00 H ATOM 70126 C17 PA 1693 8.405 73.787 33.610 1.00 0.00 C ATOM 70127 H7R PA 1693 7.801 72.883 33.506 1.00 0.00 H ATOM 70128 H7S PA 1693 9.371 73.487 34.023 1.00 0.00 H ATOM 70129 C16 PA 1693 8.606 74.177 32.086 1.00 0.00 C ATOM 70130 H6R PA 1693 9.361 74.962 32.001 1.00 0.00 H ATOM 70131 H6S PA 1693 7.743 74.725 31.704 1.00 0.00 H ATOM 70132 C15 PA 1693 8.917 73.065 31.101 1.00 0.00 C ATOM 70133 H5R PA 1693 8.126 72.315 31.044 1.00 0.00 H ATOM 70134 H5S PA 1693 9.761 72.502 31.503 1.00 0.00 H ATOM 70135 C14 PA 1693 9.158 73.472 29.618 1.00 0.00 C ATOM 70136 H4R PA 1693 9.163 74.552 29.461 1.00 0.00 H ATOM 70137 H4S PA 1693 8.298 73.083 29.068 1.00 0.00 H ATOM 70138 C13 PA 1693 10.313 72.954 28.837 1.00 0.00 C ATOM 70139 H3R PA 1693 10.376 71.879 29.019 1.00 0.00 H ATOM 70140 H3S PA 1693 11.280 73.371 29.126 1.00 0.00 H ATOM 70141 C12 PA 1693 10.041 73.071 27.394 1.00 0.00 C ATOM 70142 H2R PA 1693 9.725 74.107 27.249 1.00 0.00 H ATOM 70143 H2S PA 1693 9.060 72.615 27.249 1.00 0.00 H ATOM 70144 C11 PGR 1694 10.987 72.563 26.328 1.00 0.00 C ATOM 70145 O12 PGR 1694 10.844 72.832 25.150 1.00 0.00 O ATOM 70146 O11 PGR 1694 12.010 71.847 26.792 1.00 0.00 O ATOM 70147 C1 PGR 1694 12.904 71.209 25.945 1.00 0.00 C ATOM 70148 HR PGR 1694 12.326 70.494 25.354 1.00 0.00 H ATOM 70149 HS PGR 1694 13.484 70.446 26.471 1.00 0.00 H ATOM 70150 C2 PGR 1694 13.870 72.163 25.237 1.00 0.00 C ATOM 70151 HX PGR 1694 13.350 73.033 24.829 1.00 0.00 H ATOM 70152 C3 PGR 1694 14.810 71.539 24.230 1.00 0.00 C ATOM 70153 HA PGR 1694 14.301 71.032 23.407 1.00 0.00 H ATOM 70154 HB PGR 1694 15.363 70.784 24.796 1.00 0.00 H ATOM 70155 O31 PGR 1694 15.584 72.631 23.765 1.00 0.00 O ATOM 70156 P31 PGR 1694 15.716 72.858 22.224 1.00 0.00 P ATOM 70157 O32 PGR 1694 16.819 71.821 21.608 1.00 0.00 O ATOM 70158 C31 PGR 1694 17.420 72.117 20.367 1.00 0.00 C ATOM 70159 H1A PGR 1694 17.856 73.113 20.251 1.00 0.00 H ATOM 70160 H1B PGR 1694 16.853 71.798 19.488 1.00 0.00 H ATOM 70161 C32 PGR 1694 18.518 71.043 20.099 1.00 0.00 C ATOM 70162 H2A PGR 1694 18.026 70.110 19.812 1.00 0.00 H ATOM 70163 O35 PGR 1694 19.244 70.839 21.260 1.00 0.00 O ATOM 70164 HO5A PGR 1694 18.618 70.494 21.921 1.00 0.00 H ATOM 70165 C33 PGR 1694 19.428 71.373 18.904 1.00 0.00 C ATOM 70166 H3A PGR 1694 19.965 70.518 18.488 1.00 0.00 H ATOM 70167 H3B PGR 1694 18.860 71.738 18.044 1.00 0.00 H ATOM 70168 O33 PGR 1694 14.363 72.623 21.620 1.00 0.00 O ATOM 70169 O34 PGR 1694 16.273 74.288 22.140 1.00 0.00 O ATOM 70170 O21 PGR 1694 14.821 72.565 26.161 1.00 0.00 O ATOM 70171 C21 PGR 1694 14.549 73.521 27.096 1.00 0.00 C ATOM 70172 O22 PGR 1694 13.547 74.180 27.165 1.00 0.00 O ATOM 70173 O36 PGR 1694 20.446 72.328 19.318 1.00 0.00 O ATOM 70174 HO6A PGR 1694 21.107 72.392 18.604 1.00 0.00 H ATOM 70175 C12 OL 1695 15.697 73.576 28.081 1.00 0.00 C ATOM 70176 H2R OL 1695 16.345 72.699 28.032 1.00 0.00 H ATOM 70177 H2S OL 1695 16.217 74.520 27.904 1.00 0.00 H ATOM 70178 C13 OL 1695 15.187 73.643 29.543 1.00 0.00 C ATOM 70179 H3R OL 1695 16.076 73.591 30.173 1.00 0.00 H ATOM 70180 H3S OL 1695 14.779 74.630 29.771 1.00 0.00 H ATOM 70181 C14 OL 1695 14.169 72.627 30.009 1.00 0.00 C ATOM 70182 H4R OL 1695 13.178 72.892 29.636 1.00 0.00 H ATOM 70183 H4S OL 1695 14.378 71.655 29.557 1.00 0.00 H ATOM 70184 C15 OL 1695 14.131 72.424 31.517 1.00 0.00 C ATOM 70185 H5R OL 1695 15.058 72.010 31.919 1.00 0.00 H ATOM 70186 H5S OL 1695 14.095 73.417 31.971 1.00 0.00 H ATOM 70187 C16 OL 1695 12.917 71.669 32.027 1.00 0.00 C ATOM 70188 H6R OL 1695 12.082 72.130 31.494 1.00 0.00 H ATOM 70189 H6S OL 1695 13.003 70.639 31.676 1.00 0.00 H ATOM 70190 C17 OL 1695 12.778 71.671 33.589 1.00 0.00 C ATOM 70191 H7R OL 1695 13.085 72.639 33.989 1.00 0.00 H ATOM 70192 H7S OL 1695 11.710 71.706 33.813 1.00 0.00 H ATOM 70193 C18 OL 1695 13.510 70.570 34.333 1.00 0.00 C ATOM 70194 H8R OL 1695 13.187 69.699 33.759 1.00 0.00 H ATOM 70195 H8S OL 1695 14.578 70.716 34.162 1.00 0.00 H ATOM 70196 C19 OL 1695 13.192 70.428 35.760 1.00 0.00 C ATOM 70197 H9R OL 1695 12.197 70.004 35.869 1.00 0.00 H ATOM 70198 C110 OL 1695 14.016 70.627 36.844 1.00 0.00 C ATOM 70199 H10R OL 1695 13.595 70.330 37.801 1.00 0.00 H ATOM 70200 C111 OL 1695 15.395 71.008 36.763 1.00 0.00 C ATOM 70201 H11R OL 1695 15.932 70.139 37.150 1.00 0.00 H ATOM 70202 H11S OL 1695 15.827 71.151 35.771 1.00 0.00 H ATOM 70203 C112 OL 1695 15.726 72.191 37.604 1.00 0.00 C ATOM 70204 H12R OL 1695 15.689 71.981 38.675 1.00 0.00 H ATOM 70205 H12S OL 1695 16.793 72.387 37.475 1.00 0.00 H ATOM 70206 C113 OL 1695 14.868 73.370 37.312 1.00 0.00 C ATOM 70207 H13R OL 1695 14.886 73.394 36.221 1.00 0.00 H ATOM 70208 H13S OL 1695 13.808 73.294 37.563 1.00 0.00 H ATOM 70209 C114 OL 1695 15.421 74.665 37.975 1.00 0.00 C ATOM 70210 H14R OL 1695 16.449 74.786 37.627 1.00 0.00 H ATOM 70211 H14S OL 1695 14.878 75.496 37.521 1.00 0.00 H ATOM 70212 C115 OL 1695 15.503 74.787 39.507 1.00 0.00 C ATOM 70213 H15R OL 1695 14.542 74.484 39.929 1.00 0.00 H ATOM 70214 H15S OL 1695 16.219 74.088 39.945 1.00 0.00 H ATOM 70215 C116 OL 1695 16.151 76.106 39.906 1.00 0.00 C ATOM 70216 H16R OL 1695 16.544 76.011 40.920 1.00 0.00 H ATOM 70217 H16S OL 1695 17.003 76.294 39.250 1.00 0.00 H ATOM 70218 C117 OL 1695 15.172 77.289 39.757 1.00 0.00 C ATOM 70219 H17R OL 1695 14.718 77.264 38.764 1.00 0.00 H ATOM 70220 H17S OL 1695 14.346 77.173 40.461 1.00 0.00 H ATOM 70221 C118 OL 1695 15.929 78.605 40.070 1.00 0.00 C ATOM 70222 H18R OL 1695 16.340 78.571 41.081 1.00 0.00 H ATOM 70223 H18S OL 1695 15.152 79.373 40.038 1.00 0.00 H ATOM 70224 H18T OL 1695 16.775 78.763 39.398 1.00 0.00 H TER 70225 OL 1695 ATOM 70225 C116 PA 1696 12.673 143.939 37.554 1.00 0.00 C ATOM 70226 H16R PA 1696 11.820 144.349 37.010 1.00 0.00 H ATOM 70227 H16S PA 1696 13.560 144.168 36.959 1.00 0.00 H ATOM 70228 H16T PA 1696 12.775 144.466 38.506 1.00 0.00 H ATOM 70229 C115 PA 1696 12.607 142.494 37.645 1.00 0.00 C ATOM 70230 H15R PA 1696 11.620 142.107 37.907 1.00 0.00 H ATOM 70231 H15S PA 1696 13.238 142.229 38.496 1.00 0.00 H ATOM 70232 C114 PA 1696 12.961 141.740 36.293 1.00 0.00 C ATOM 70233 H14R PA 1696 13.771 142.262 35.778 1.00 0.00 H ATOM 70234 H14S PA 1696 12.121 141.718 35.596 1.00 0.00 H ATOM 70235 C113 PA 1696 13.450 140.328 36.477 1.00 0.00 C ATOM 70236 H13R PA 1696 12.812 139.829 37.209 1.00 0.00 H ATOM 70237 H13S PA 1696 14.381 140.413 37.042 1.00 0.00 H ATOM 70238 C112 PA 1696 13.427 139.417 35.263 1.00 0.00 C ATOM 70239 H12R PA 1696 14.023 139.821 34.442 1.00 0.00 H ATOM 70240 H12S PA 1696 12.418 139.366 34.849 1.00 0.00 H ATOM 70241 C111 PA 1696 13.930 138.045 35.599 1.00 0.00 C ATOM 70242 H11R PA 1696 13.547 137.664 36.548 1.00 0.00 H ATOM 70243 H11S PA 1696 15.014 138.125 35.696 1.00 0.00 H ATOM 70244 C110 PA 1696 13.663 136.955 34.463 1.00 0.00 C ATOM 70245 H10R PA 1696 14.539 136.362 34.192 1.00 0.00 H ATOM 70246 H10S PA 1696 13.441 137.544 33.571 1.00 0.00 H ATOM 70247 C19 PA 1696 12.305 136.083 34.765 1.00 0.00 C ATOM 70248 H9R PA 1696 11.455 136.733 34.549 1.00 0.00 H ATOM 70249 H9S PA 1696 12.266 136.047 35.855 1.00 0.00 H ATOM 70250 C18 PA 1696 12.265 134.729 34.023 1.00 0.00 C ATOM 70251 H8R PA 1696 12.953 133.923 34.287 1.00 0.00 H ATOM 70252 H8S PA 1696 12.526 134.711 32.962 1.00 0.00 H ATOM 70253 C17 PA 1696 10.906 134.036 34.131 1.00 0.00 C ATOM 70254 H7R PA 1696 10.184 134.584 33.522 1.00 0.00 H ATOM 70255 H7S PA 1696 10.659 134.228 35.177 1.00 0.00 H ATOM 70256 C16 PA 1696 10.794 132.542 33.661 1.00 0.00 C ATOM 70257 H6R PA 1696 9.821 132.137 33.945 1.00 0.00 H ATOM 70258 H6S PA 1696 11.607 132.011 34.161 1.00 0.00 H ATOM 70259 C15 PA 1696 10.886 132.350 32.121 1.00 0.00 C ATOM 70260 H5R PA 1696 11.640 132.946 31.602 1.00 0.00 H ATOM 70261 H5S PA 1696 9.935 132.784 31.807 1.00 0.00 H ATOM 70262 C14 PA 1696 10.921 130.959 31.615 1.00 0.00 C ATOM 70263 H4R PA 1696 10.103 130.402 32.077 1.00 0.00 H ATOM 70264 H4S PA 1696 11.850 130.494 31.952 1.00 0.00 H ATOM 70265 C13 PA 1696 10.795 130.776 30.111 1.00 0.00 C ATOM 70266 H3R PA 1696 11.486 131.492 29.661 1.00 0.00 H ATOM 70267 H3S PA 1696 9.793 131.084 29.803 1.00 0.00 H ATOM 70268 C12 PA 1696 11.066 129.298 29.748 1.00 0.00 C ATOM 70269 H2R PA 1696 10.651 128.567 30.446 1.00 0.00 H ATOM 70270 H2S PA 1696 12.137 129.179 29.925 1.00 0.00 H ATOM 70271 C11 PC 1697 10.761 128.965 28.303 1.00 0.00 C ATOM 70272 O12 PC 1697 11.387 129.628 27.429 1.00 0.00 O ATOM 70273 O11 PC 1697 10.034 127.851 28.108 1.00 0.00 O ATOM 70274 C1 PC 1697 9.813 127.529 26.713 1.00 0.00 C ATOM 70275 HR PC 1697 10.739 127.067 26.363 1.00 0.00 H ATOM 70276 HS PC 1697 9.619 128.411 26.097 1.00 0.00 H ATOM 70277 C2 PC 1697 8.688 126.566 26.565 1.00 0.00 C ATOM 70278 HX PC 1697 8.924 125.729 27.227 1.00 0.00 H ATOM 70279 C3 PC 1697 8.619 126.034 25.120 1.00 0.00 C ATOM 70280 HA PC 1697 7.758 125.371 24.997 1.00 0.00 H ATOM 70281 HB PC 1697 9.516 125.459 24.878 1.00 0.00 H ATOM 70282 O31 PC 1697 8.703 127.206 24.361 1.00 0.00 O ATOM 70283 P31 PC 1697 9.549 127.269 23.005 1.00 0.00 P ATOM 70284 O32 PC 1697 9.160 125.926 22.266 1.00 0.00 O ATOM 70285 C31 PC 1697 8.089 125.990 21.315 1.00 0.00 C ATOM 70286 H1A PC 1697 7.374 126.772 21.583 1.00 0.00 H ATOM 70287 H1B PC 1697 7.636 124.998 21.238 1.00 0.00 H ATOM 70288 C32 PC 1697 8.721 126.256 19.993 1.00 0.00 C ATOM 70289 H2A PC 1697 9.636 125.666 20.061 1.00 0.00 H ATOM 70290 H2B PC 1697 8.972 127.317 19.979 1.00 0.00 H ATOM 70291 N31 PC 1697 7.847 125.948 18.795 1.00 0.00 N ATOM 70292 C33 PC 1697 7.507 124.477 18.711 1.00 0.00 C ATOM 70293 H3A PC 1697 6.974 124.051 19.562 1.00 0.00 H ATOM 70294 H3B PC 1697 8.485 124.069 18.451 1.00 0.00 H ATOM 70295 H3C PC 1697 6.864 124.361 17.837 1.00 0.00 H ATOM 70296 C34 PC 1697 6.548 126.688 18.721 1.00 0.00 C ATOM 70297 H4A PC 1697 6.074 126.591 19.700 1.00 0.00 H ATOM 70298 H4B PC 1697 6.049 126.340 17.816 1.00 0.00 H ATOM 70299 H4C PC 1697 6.808 127.722 18.494 1.00 0.00 H ATOM 70300 C35 PC 1697 8.692 126.322 17.594 1.00 0.00 C ATOM 70301 H5A PC 1697 8.128 126.013 16.713 1.00 0.00 H ATOM 70302 H5B PC 1697 9.613 125.740 17.654 1.00 0.00 H ATOM 70303 H5C PC 1697 8.987 127.369 17.684 1.00 0.00 H ATOM 70304 O33 PC 1697 9.127 128.433 22.244 1.00 0.00 O ATOM 70305 O34 PC 1697 10.969 127.060 23.431 1.00 0.00 O ATOM 70306 O21 PC 1697 7.383 127.086 27.065 1.00 0.00 O ATOM 70307 C21 PC 1697 6.881 128.285 26.816 1.00 0.00 C ATOM 70308 O22 PC 1697 7.363 129.162 26.197 1.00 0.00 O ATOM 70309 C12 OL 1698 5.637 128.525 27.583 1.00 0.00 C ATOM 70310 H2R OL 1698 4.990 129.187 27.005 1.00 0.00 H ATOM 70311 H2S OL 1698 5.080 127.587 27.630 1.00 0.00 H ATOM 70312 C13 OL 1698 5.761 129.130 28.952 1.00 0.00 C ATOM 70313 H3R OL 1698 6.229 130.089 28.720 1.00 0.00 H ATOM 70314 H3S OL 1698 4.790 129.502 29.284 1.00 0.00 H ATOM 70315 C14 OL 1698 6.551 128.228 29.920 1.00 0.00 C ATOM 70316 H4R OL 1698 5.933 127.329 29.986 1.00 0.00 H ATOM 70317 H4S OL 1698 7.470 127.974 29.386 1.00 0.00 H ATOM 70318 C15 OL 1698 6.836 128.784 31.311 1.00 0.00 C ATOM 70319 H5R OL 1698 7.339 129.745 31.182 1.00 0.00 H ATOM 70320 H5S OL 1698 5.866 128.959 31.780 1.00 0.00 H ATOM 70321 C16 OL 1698 7.825 127.839 32.125 1.00 0.00 C ATOM 70322 H6R OL 1698 7.496 126.798 32.111 1.00 0.00 H ATOM 70323 H6S OL 1698 8.763 127.872 31.565 1.00 0.00 H ATOM 70324 C17 OL 1698 8.012 128.338 33.467 1.00 0.00 C ATOM 70325 H7R OL 1698 8.727 127.792 34.087 1.00 0.00 H ATOM 70326 H7S OL 1698 8.638 129.233 33.476 1.00 0.00 H ATOM 70327 C18 OL 1698 6.801 128.579 34.303 1.00 0.00 C ATOM 70328 H8R OL 1698 6.217 129.357 33.807 1.00 0.00 H ATOM 70329 H8S OL 1698 6.147 127.705 34.325 1.00 0.00 H ATOM 70330 C19 OL 1698 7.030 129.065 35.722 1.00 0.00 C ATOM 70331 H9R OL 1698 8.089 129.063 35.967 1.00 0.00 H ATOM 70332 C110 OL 1698 6.216 129.564 36.653 1.00 0.00 C ATOM 70333 H10R OL 1698 6.613 129.943 37.592 1.00 0.00 H ATOM 70334 C111 OL 1698 4.732 129.646 36.690 1.00 0.00 C ATOM 70335 H11R OL 1698 4.479 130.704 36.595 1.00 0.00 H ATOM 70336 H11S OL 1698 4.269 129.273 35.774 1.00 0.00 H ATOM 70337 C112 OL 1698 4.218 128.896 37.963 1.00 0.00 C ATOM 70338 H12R OL 1698 4.834 128.037 38.238 1.00 0.00 H ATOM 70339 H12S OL 1698 4.432 129.555 38.807 1.00 0.00 H ATOM 70340 C113 OL 1698 2.754 128.439 37.893 1.00 0.00 C ATOM 70341 H13R OL 1698 2.737 127.524 37.298 1.00 0.00 H ATOM 70342 H13S OL 1698 2.595 128.188 38.944 1.00 0.00 H ATOM 70343 C114 OL 1698 1.733 129.485 37.409 1.00 0.00 C ATOM 70344 H14R OL 1698 1.551 130.318 38.091 1.00 0.00 H ATOM 70345 H14S OL 1698 2.100 130.031 36.538 1.00 0.00 H ATOM 70346 C115 OL 1698 0.334 128.959 37.133 1.00 0.00 C ATOM 70347 H15R OL 1698 0.491 128.096 36.482 1.00 0.00 H ATOM 70348 H15S OL 1698 -0.195 128.507 37.974 1.00 0.00 H ATOM 70349 C116 OL 1698 -0.581 129.955 36.515 1.00 0.00 C ATOM 70350 H16R OL 1698 -1.563 129.626 36.860 1.00 0.00 H ATOM 70351 H16S OL 1698 -0.497 130.959 36.934 1.00 0.00 H ATOM 70352 C117 OL 1698 -0.540 130.110 35.015 1.00 0.00 C ATOM 70353 H17R OL 1698 0.242 130.805 34.699 1.00 0.00 H ATOM 70354 H17S OL 1698 -0.430 129.176 34.460 1.00 0.00 H ATOM 70355 C118 OL 1698 -1.940 130.493 34.508 1.00 0.00 C ATOM 70356 H18R OL 1698 -2.158 131.471 34.941 1.00 0.00 H ATOM 70357 H18S OL 1698 -2.710 129.746 34.713 1.00 0.00 H ATOM 70358 H18T OL 1698 -1.843 130.655 33.432 1.00 0.00 H TER 70359 OL 1698 ATOM 70359 C116 PA 1699 138.078 60.667 31.252 1.00 0.00 C ATOM 70360 H16R PA 1699 138.487 59.857 30.644 1.00 0.00 H ATOM 70361 H16S PA 1699 136.988 60.724 31.282 1.00 0.00 H ATOM 70362 H16T PA 1699 138.337 60.395 32.277 1.00 0.00 H ATOM 70363 C115 PA 1699 138.775 61.933 30.656 1.00 0.00 C ATOM 70364 H15R PA 1699 138.596 61.803 29.587 1.00 0.00 H ATOM 70365 H15S PA 1699 139.855 61.953 30.818 1.00 0.00 H ATOM 70366 C114 PA 1699 138.260 63.236 31.152 1.00 0.00 C ATOM 70367 H14R PA 1699 137.196 63.441 31.022 1.00 0.00 H ATOM 70368 H14S PA 1699 138.669 64.104 30.630 1.00 0.00 H ATOM 70369 C113 PA 1699 138.611 63.372 32.680 1.00 0.00 C ATOM 70370 H13R PA 1699 139.674 63.200 32.865 1.00 0.00 H ATOM 70371 H13S PA 1699 137.960 62.651 33.179 1.00 0.00 H ATOM 70372 C112 PA 1699 138.254 64.715 33.316 1.00 0.00 C ATOM 70373 H12R PA 1699 138.484 64.688 34.383 1.00 0.00 H ATOM 70374 H12S PA 1699 137.172 64.774 33.179 1.00 0.00 H ATOM 70375 C111 PA 1699 138.876 65.919 32.621 1.00 0.00 C ATOM 70376 H11R PA 1699 138.219 66.280 31.827 1.00 0.00 H ATOM 70377 H11S PA 1699 139.824 65.671 32.139 1.00 0.00 H ATOM 70378 C110 PA 1699 138.930 67.052 33.567 1.00 0.00 C ATOM 70379 H10R PA 1699 139.417 66.712 34.484 1.00 0.00 H ATOM 70380 H10S PA 1699 137.970 67.408 33.948 1.00 0.00 H ATOM 70381 C19 PA 1699 139.513 68.317 32.868 1.00 0.00 C ATOM 70382 H9R PA 1699 138.727 68.743 32.241 1.00 0.00 H ATOM 70383 H9S PA 1699 140.288 68.055 32.145 1.00 0.00 H ATOM 70384 C18 PA 1699 139.984 69.394 33.884 1.00 0.00 C ATOM 70385 H8R PA 1699 140.636 68.848 34.569 1.00 0.00 H ATOM 70386 H8S PA 1699 139.064 69.662 34.407 1.00 0.00 H ATOM 70387 C17 PA 1699 140.725 70.576 33.259 1.00 0.00 C ATOM 70388 H7R PA 1699 139.995 71.148 32.682 1.00 0.00 H ATOM 70389 H7S PA 1699 141.555 70.277 32.616 1.00 0.00 H ATOM 70390 C16 PA 1699 141.326 71.619 34.260 1.00 0.00 C ATOM 70391 H6R PA 1699 142.235 71.166 34.659 1.00 0.00 H ATOM 70392 H6S PA 1699 140.653 71.855 35.087 1.00 0.00 H ATOM 70393 C15 PA 1699 141.661 72.956 33.558 1.00 0.00 C ATOM 70394 H5R PA 1699 141.512 73.754 34.289 1.00 0.00 H ATOM 70395 H5S PA 1699 141.005 73.270 32.744 1.00 0.00 H ATOM 70396 C14 PA 1699 143.078 72.988 32.964 1.00 0.00 C ATOM 70397 H4R PA 1699 143.081 72.378 32.058 1.00 0.00 H ATOM 70398 H4S PA 1699 143.715 72.539 33.729 1.00 0.00 H ATOM 70399 C13 PA 1699 143.498 74.306 32.418 1.00 0.00 C ATOM 70400 H3R PA 1699 143.388 75.027 33.231 1.00 0.00 H ATOM 70401 H3S PA 1699 142.766 74.650 31.685 1.00 0.00 H ATOM 70402 C12 PA 1699 144.881 74.297 31.771 1.00 0.00 C ATOM 70403 H2R PA 1699 145.647 73.866 32.419 1.00 0.00 H ATOM 70404 H2S PA 1699 145.286 75.303 31.644 1.00 0.00 H ATOM 70405 C11 PC 1700 144.727 73.638 30.440 1.00 0.00 C ATOM 70406 O12 PC 1700 143.700 73.588 29.816 1.00 0.00 O ATOM 70407 O11 PC 1700 145.904 73.274 29.981 1.00 0.00 O ATOM 70408 C1 PC 1700 146.011 73.044 28.561 1.00 0.00 C ATOM 70409 HR PC 1700 145.189 72.400 28.237 1.00 0.00 H ATOM 70410 HS PC 1700 146.906 72.466 28.319 1.00 0.00 H ATOM 70411 C2 PC 1700 145.844 74.414 27.834 1.00 0.00 C ATOM 70412 HX PC 1700 144.895 74.882 28.107 1.00 0.00 H ATOM 70413 C3 PC 1700 145.728 74.229 26.309 1.00 0.00 C ATOM 70414 HA PC 1700 145.919 75.145 25.745 1.00 0.00 H ATOM 70415 HB PC 1700 144.697 73.896 26.164 1.00 0.00 H ATOM 70416 O31 PC 1700 146.485 73.175 25.755 1.00 0.00 O ATOM 70417 P31 PC 1700 146.094 72.420 24.406 1.00 0.00 P ATOM 70418 O32 PC 1700 144.666 71.936 24.734 1.00 0.00 O ATOM 70419 C31 PC 1700 144.463 70.794 25.450 1.00 0.00 C ATOM 70420 H1A PC 1700 144.741 70.999 26.487 1.00 0.00 H ATOM 70421 H1B PC 1700 145.011 69.894 25.158 1.00 0.00 H ATOM 70422 C32 PC 1700 143.005 70.500 25.171 1.00 0.00 C ATOM 70423 H2A PC 1700 142.403 71.377 25.414 1.00 0.00 H ATOM 70424 H2B PC 1700 142.619 69.782 25.896 1.00 0.00 H ATOM 70425 N31 PC 1700 142.468 69.955 23.860 1.00 0.00 N ATOM 70426 C33 PC 1700 142.750 70.807 22.722 1.00 0.00 C ATOM 70427 H3A PC 1700 141.970 70.741 21.962 1.00 0.00 H ATOM 70428 H3B PC 1700 143.694 70.477 22.285 1.00 0.00 H ATOM 70429 H3C PC 1700 142.862 71.864 22.969 1.00 0.00 H ATOM 70430 C34 PC 1700 142.988 68.648 23.628 1.00 0.00 C ATOM 70431 H4A PC 1700 142.436 68.035 24.342 1.00 0.00 H ATOM 70432 H4B PC 1700 144.060 68.822 23.734 1.00 0.00 H ATOM 70433 H4C PC 1700 142.753 68.477 22.576 1.00 0.00 H ATOM 70434 C35 PC 1700 140.957 69.876 23.983 1.00 0.00 C ATOM 70435 H5A PC 1700 140.505 70.870 23.985 1.00 0.00 H ATOM 70436 H5B PC 1700 140.655 69.376 24.904 1.00 0.00 H ATOM 70437 H5C PC 1700 140.627 69.298 23.119 1.00 0.00 H ATOM 70438 O33 PC 1700 145.952 73.429 23.384 1.00 0.00 O ATOM 70439 O34 PC 1700 146.928 71.277 24.132 1.00 0.00 O ATOM 70440 O21 PC 1700 147.064 75.244 28.149 1.00 0.00 O ATOM 70441 C21 PC 1700 147.016 76.582 27.977 1.00 0.00 C ATOM 70442 O22 PC 1700 146.342 77.153 27.161 1.00 0.00 O ATOM 70443 C12 OL 1701 147.997 77.339 28.854 1.00 0.00 C ATOM 70444 H2R OL 1701 148.906 76.927 28.411 1.00 0.00 H ATOM 70445 H2S OL 1701 148.128 78.415 28.724 1.00 0.00 H ATOM 70446 C13 OL 1701 147.749 77.049 30.331 1.00 0.00 C ATOM 70447 H3R OL 1701 146.706 77.180 30.626 1.00 0.00 H ATOM 70448 H3S OL 1701 147.954 75.976 30.357 1.00 0.00 H ATOM 70449 C14 OL 1701 148.543 77.837 31.273 1.00 0.00 C ATOM 70450 H4R OL 1701 149.629 77.742 31.330 1.00 0.00 H ATOM 70451 H4S OL 1701 148.234 78.877 31.152 1.00 0.00 H ATOM 70452 C15 OL 1701 148.082 77.577 32.725 1.00 0.00 C ATOM 70453 H5R OL 1701 147.000 77.698 32.798 1.00 0.00 H ATOM 70454 H5S OL 1701 148.257 76.530 32.980 1.00 0.00 H ATOM 70455 C16 OL 1701 148.801 78.407 33.792 1.00 0.00 C ATOM 70456 H6R OL 1701 149.865 78.384 33.547 1.00 0.00 H ATOM 70457 H6S OL 1701 148.581 79.466 33.640 1.00 0.00 H ATOM 70458 C17 OL 1701 148.460 78.034 35.302 1.00 0.00 C ATOM 70459 H7R OL 1701 147.418 77.768 35.492 1.00 0.00 H ATOM 70460 H7S OL 1701 149.033 77.132 35.525 1.00 0.00 H ATOM 70461 C18 OL 1701 148.797 79.113 36.353 1.00 0.00 C ATOM 70462 H8R OL 1701 149.132 78.650 37.284 1.00 0.00 H ATOM 70463 H8S OL 1701 149.631 79.714 35.986 1.00 0.00 H ATOM 70464 C19 OL 1701 147.635 80.023 36.601 1.00 0.00 C ATOM 70465 H9R OL 1701 146.650 79.564 36.631 1.00 0.00 H ATOM 70466 C110 OL 1701 147.809 81.293 36.796 1.00 0.00 C ATOM 70467 H10R OL 1701 146.995 81.961 37.061 1.00 0.00 H ATOM 70468 C111 OL 1701 149.078 82.138 36.661 1.00 0.00 C ATOM 70469 H11R OL 1701 149.745 81.756 35.886 1.00 0.00 H ATOM 70470 H11S OL 1701 148.699 83.124 36.388 1.00 0.00 H ATOM 70471 C112 OL 1701 149.834 82.358 37.921 1.00 0.00 C ATOM 70472 H12R OL 1701 150.122 81.353 38.237 1.00 0.00 H ATOM 70473 H12S OL 1701 150.790 82.885 37.872 1.00 0.00 H ATOM 70474 C113 OL 1701 149.124 83.063 39.090 1.00 0.00 C ATOM 70475 H13R OL 1701 149.119 84.108 38.772 1.00 0.00 H ATOM 70476 H13S OL 1701 148.144 82.581 39.078 1.00 0.00 H ATOM 70477 C114 OL 1701 149.720 82.961 40.424 1.00 0.00 C ATOM 70478 H14R OL 1701 148.984 83.469 41.050 1.00 0.00 H ATOM 70479 H14S OL 1701 149.770 81.909 40.713 1.00 0.00 H ATOM 70480 C115 OL 1701 151.123 83.563 40.508 1.00 0.00 C ATOM 70481 H15R OL 1701 151.791 83.088 39.787 1.00 0.00 H ATOM 70482 H15S OL 1701 151.134 84.611 40.202 1.00 0.00 H ATOM 70483 C116 OL 1701 151.733 83.393 41.928 1.00 0.00 C ATOM 70484 H16R OL 1701 152.779 83.705 41.909 1.00 0.00 H ATOM 70485 H16S OL 1701 151.264 84.156 42.554 1.00 0.00 H ATOM 70486 C117 OL 1701 151.780 81.969 42.454 1.00 0.00 C ATOM 70487 H17R OL 1701 150.768 81.570 42.554 1.00 0.00 H ATOM 70488 H17S OL 1701 152.123 81.306 41.657 1.00 0.00 H ATOM 70489 C118 OL 1701 152.546 81.683 43.732 1.00 0.00 C ATOM 70490 H18R OL 1701 152.038 81.958 44.659 1.00 0.00 H ATOM 70491 H18S OL 1701 153.569 82.065 43.744 1.00 0.00 H ATOM 70492 H18T OL 1701 152.662 80.599 43.788 1.00 0.00 H TER 70493 OL 1701 ATOM 70493 C116 PA 1702 49.259 40.615 45.048 1.00 0.00 C ATOM 70494 H16R PA 1702 49.833 40.786 44.135 1.00 0.00 H ATOM 70495 H16S PA 1702 49.885 39.927 45.620 1.00 0.00 H ATOM 70496 H16T PA 1702 49.261 41.623 45.469 1.00 0.00 H ATOM 70497 C115 PA 1702 47.859 39.985 44.814 1.00 0.00 C ATOM 70498 H15R PA 1702 47.327 39.795 45.748 1.00 0.00 H ATOM 70499 H15S PA 1702 48.133 39.041 44.337 1.00 0.00 H ATOM 70500 C114 PA 1702 47.047 40.815 43.865 1.00 0.00 C ATOM 70501 H14R PA 1702 47.595 41.140 42.978 1.00 0.00 H ATOM 70502 H14S PA 1702 46.843 41.758 44.375 1.00 0.00 H ATOM 70503 C113 PA 1702 45.701 40.136 43.413 1.00 0.00 C ATOM 70504 H13R PA 1702 44.990 40.108 44.240 1.00 0.00 H ATOM 70505 H13S PA 1702 45.920 39.096 43.160 1.00 0.00 H ATOM 70506 C112 PA 1702 45.064 40.927 42.243 1.00 0.00 C ATOM 70507 H12R PA 1702 45.900 40.916 41.541 1.00 0.00 H ATOM 70508 H12S PA 1702 44.715 41.948 42.409 1.00 0.00 H ATOM 70509 C111 PA 1702 43.880 40.210 41.629 1.00 0.00 C ATOM 70510 H11R PA 1702 43.243 39.610 42.282 1.00 0.00 H ATOM 70511 H11S PA 1702 44.411 39.412 41.105 1.00 0.00 H ATOM 70512 C110 PA 1702 42.939 41.038 40.856 1.00 0.00 C ATOM 70513 H10R PA 1702 43.371 41.813 40.220 1.00 0.00 H ATOM 70514 H10S PA 1702 42.259 41.543 41.546 1.00 0.00 H ATOM 70515 C19 PA 1702 42.056 40.214 39.996 1.00 0.00 C ATOM 70516 H9R PA 1702 41.364 39.660 40.635 1.00 0.00 H ATOM 70517 H9S PA 1702 42.646 39.478 39.448 1.00 0.00 H ATOM 70518 C18 PA 1702 41.171 41.126 39.115 1.00 0.00 C ATOM 70519 H8R PA 1702 41.822 41.918 38.738 1.00 0.00 H ATOM 70520 H8S PA 1702 40.278 41.468 39.643 1.00 0.00 H ATOM 70521 C17 PA 1702 40.559 40.415 37.883 1.00 0.00 C ATOM 70522 H7R PA 1702 39.915 39.561 38.102 1.00 0.00 H ATOM 70523 H7S PA 1702 41.453 40.060 37.367 1.00 0.00 H ATOM 70524 C16 PA 1702 39.736 41.347 36.938 1.00 0.00 C ATOM 70525 H6R PA 1702 40.164 42.345 37.049 1.00 0.00 H ATOM 70526 H6S PA 1702 38.662 41.394 37.133 1.00 0.00 H ATOM 70527 C15 PA 1702 39.827 40.966 35.509 1.00 0.00 C ATOM 70528 H5R PA 1702 39.413 39.963 35.386 1.00 0.00 H ATOM 70529 H5S PA 1702 40.885 40.880 35.250 1.00 0.00 H ATOM 70530 C14 PA 1702 39.247 41.898 34.478 1.00 0.00 C ATOM 70531 H4R PA 1702 39.924 42.749 34.576 1.00 0.00 H ATOM 70532 H4S PA 1702 38.309 42.203 34.947 1.00 0.00 H ATOM 70533 C13 PA 1702 39.159 41.428 33.022 1.00 0.00 C ATOM 70534 H3R PA 1702 38.746 40.420 33.090 1.00 0.00 H ATOM 70535 H3S PA 1702 40.123 41.113 32.619 1.00 0.00 H ATOM 70536 C12 PA 1702 38.225 42.252 32.153 1.00 0.00 C ATOM 70537 H2R PA 1702 38.631 43.262 32.232 1.00 0.00 H ATOM 70538 H2S PA 1702 37.226 42.397 32.568 1.00 0.00 H ATOM 70539 C11 PGR 1703 38.179 41.773 30.726 1.00 0.00 C ATOM 70540 O12 PGR 1703 37.263 41.091 30.303 1.00 0.00 O ATOM 70541 O11 PGR 1703 39.281 42.022 29.991 1.00 0.00 O ATOM 70542 C1 PGR 1703 39.523 41.416 28.671 1.00 0.00 C ATOM 70543 HR PGR 1703 38.630 41.499 28.045 1.00 0.00 H ATOM 70544 HS PGR 1703 39.691 40.337 28.715 1.00 0.00 H ATOM 70545 C2 PGR 1703 40.769 42.040 27.895 1.00 0.00 C ATOM 70546 HX PGR 1703 40.553 43.110 27.833 1.00 0.00 H ATOM 70547 C3 PGR 1703 41.037 41.467 26.450 1.00 0.00 C ATOM 70548 HA PGR 1703 40.061 41.125 26.096 1.00 0.00 H ATOM 70549 HB PGR 1703 41.645 40.559 26.479 1.00 0.00 H ATOM 70550 O31 PGR 1703 41.576 42.476 25.577 1.00 0.00 O ATOM 70551 P31 PGR 1703 41.801 42.367 24.090 1.00 0.00 P ATOM 70552 O32 PGR 1703 43.373 42.150 23.879 1.00 0.00 O ATOM 70553 C31 PGR 1703 44.376 43.177 23.912 1.00 0.00 C ATOM 70554 H1A PGR 1703 44.304 43.683 24.878 1.00 0.00 H ATOM 70555 H1B PGR 1703 44.117 43.887 23.122 1.00 0.00 H ATOM 70556 C32 PGR 1703 45.786 42.790 23.766 1.00 0.00 C ATOM 70557 H2A PGR 1703 46.448 43.474 24.304 1.00 0.00 H ATOM 70558 O35 PGR 1703 46.088 42.950 22.398 1.00 0.00 O ATOM 70559 HO5A PGR 1703 47.056 42.840 22.400 1.00 0.00 H ATOM 70560 C33 PGR 1703 46.101 41.313 24.173 1.00 0.00 C ATOM 70561 H3A PGR 1703 45.569 41.119 25.108 1.00 0.00 H ATOM 70562 H3B PGR 1703 45.697 40.576 23.474 1.00 0.00 H ATOM 70563 O33 PGR 1703 41.044 41.143 23.670 1.00 0.00 O ATOM 70564 O34 PGR 1703 41.361 43.655 23.502 1.00 0.00 O ATOM 70565 O21 PGR 1703 41.984 41.806 28.599 1.00 0.00 O ATOM 70566 C21 PGR 1703 42.965 42.622 28.819 1.00 0.00 C ATOM 70567 O22 PGR 1703 42.983 43.783 28.524 1.00 0.00 O ATOM 70568 O36 PGR 1703 47.472 41.053 24.454 1.00 0.00 O ATOM 70569 HO6A PGR 1703 47.951 41.264 23.632 1.00 0.00 H ATOM 70570 C12 OL 1704 44.183 41.890 29.463 1.00 0.00 C ATOM 70571 H2R OL 1704 44.491 41.112 28.762 1.00 0.00 H ATOM 70572 H2S OL 1704 45.019 42.593 29.468 1.00 0.00 H ATOM 70573 C13 OL 1704 43.790 41.237 30.835 1.00 0.00 C ATOM 70574 H3R OL 1704 43.277 41.989 31.437 1.00 0.00 H ATOM 70575 H3S OL 1704 43.145 40.395 30.575 1.00 0.00 H ATOM 70576 C14 OL 1704 45.055 40.664 31.639 1.00 0.00 C ATOM 70577 H4R OL 1704 45.527 39.743 31.290 1.00 0.00 H ATOM 70578 H4S OL 1704 45.884 41.367 31.539 1.00 0.00 H ATOM 70579 C15 OL 1704 44.739 40.213 33.021 1.00 0.00 C ATOM 70580 H5R OL 1704 43.931 39.478 32.990 1.00 0.00 H ATOM 70581 H5S OL 1704 45.483 39.602 33.536 1.00 0.00 H ATOM 70582 C16 OL 1704 44.389 41.384 34.011 1.00 0.00 C ATOM 70583 H6R OL 1704 45.133 42.177 33.916 1.00 0.00 H ATOM 70584 H6S OL 1704 43.427 41.741 33.635 1.00 0.00 H ATOM 70585 C17 OL 1704 44.175 40.961 35.465 1.00 0.00 C ATOM 70586 H7R OL 1704 43.377 41.598 35.853 1.00 0.00 H ATOM 70587 H7S OL 1704 43.655 40.001 35.487 1.00 0.00 H ATOM 70588 C18 OL 1704 45.563 41.078 36.202 1.00 0.00 C ATOM 70589 H8R OL 1704 46.353 40.442 35.796 1.00 0.00 H ATOM 70590 H8S OL 1704 45.927 42.101 36.084 1.00 0.00 H ATOM 70591 C19 OL 1704 45.317 40.675 37.637 1.00 0.00 C ATOM 70592 H9R OL 1704 44.641 39.829 37.727 1.00 0.00 H ATOM 70593 C110 OL 1704 45.698 41.286 38.755 1.00 0.00 C ATOM 70594 H10R OL 1704 45.371 40.964 39.740 1.00 0.00 H ATOM 70595 C111 OL 1704 46.493 42.613 38.811 1.00 0.00 C ATOM 70596 H11R OL 1704 46.211 43.286 37.999 1.00 0.00 H ATOM 70597 H11S OL 1704 46.272 43.216 39.695 1.00 0.00 H ATOM 70598 C112 OL 1704 48.066 42.435 39.064 1.00 0.00 C ATOM 70599 H12R OL 1704 48.326 42.913 40.010 1.00 0.00 H ATOM 70600 H12S OL 1704 48.275 41.380 39.255 1.00 0.00 H ATOM 70601 C113 OL 1704 48.926 42.893 37.817 1.00 0.00 C ATOM 70602 H13R OL 1704 48.607 42.271 36.978 1.00 0.00 H ATOM 70603 H13S OL 1704 48.553 43.899 37.613 1.00 0.00 H ATOM 70604 C114 OL 1704 50.386 42.800 37.972 1.00 0.00 C ATOM 70605 H14R OL 1704 50.780 43.324 37.099 1.00 0.00 H ATOM 70606 H14S OL 1704 50.675 43.259 38.919 1.00 0.00 H ATOM 70607 C115 OL 1704 50.968 41.377 38.063 1.00 0.00 C ATOM 70608 H15R OL 1704 51.980 41.514 38.451 1.00 0.00 H ATOM 70609 H15S OL 1704 50.409 40.847 38.837 1.00 0.00 H ATOM 70610 C116 OL 1704 50.936 40.559 36.779 1.00 0.00 C ATOM 70611 H16R OL 1704 50.005 40.686 36.223 1.00 0.00 H ATOM 70612 H16S OL 1704 51.632 41.022 36.077 1.00 0.00 H ATOM 70613 C117 OL 1704 51.264 39.045 37.052 1.00 0.00 C ATOM 70614 H17R OL 1704 50.580 38.790 37.864 1.00 0.00 H ATOM 70615 H17S OL 1704 51.125 38.490 36.122 1.00 0.00 H ATOM 70616 C118 OL 1704 52.545 38.809 37.695 1.00 0.00 C ATOM 70617 H18R OL 1704 52.670 37.727 37.778 1.00 0.00 H ATOM 70618 H18S OL 1704 52.613 39.276 38.679 1.00 0.00 H ATOM 70619 H18T OL 1704 53.425 39.111 37.124 1.00 0.00 H TER 70620 OL 1704 ATOM 70620 C116 PA 1705 9.620 9.315 37.955 1.00 0.00 C ATOM 70621 H16R PA 1705 9.344 8.675 37.115 1.00 0.00 H ATOM 70622 H16S PA 1705 10.688 9.434 37.760 1.00 0.00 H ATOM 70623 H16T PA 1705 8.995 10.194 37.784 1.00 0.00 H ATOM 70624 C115 PA 1705 9.485 8.737 39.387 1.00 0.00 C ATOM 70625 H15R PA 1705 8.413 8.532 39.408 1.00 0.00 H ATOM 70626 H15S PA 1705 9.806 9.586 39.994 1.00 0.00 H ATOM 70627 C114 PA 1705 10.089 7.445 39.769 1.00 0.00 C ATOM 70628 H14R PA 1705 9.700 6.714 39.058 1.00 0.00 H ATOM 70629 H14S PA 1705 9.700 7.269 40.775 1.00 0.00 H ATOM 70630 C113 PA 1705 11.564 7.435 39.528 1.00 0.00 C ATOM 70631 H13R PA 1705 11.950 8.391 39.888 1.00 0.00 H ATOM 70632 H13S PA 1705 11.920 7.410 38.496 1.00 0.00 H ATOM 70633 C112 PA 1705 12.397 6.386 40.225 1.00 0.00 C ATOM 70634 H12R PA 1705 11.912 5.407 40.232 1.00 0.00 H ATOM 70635 H12S PA 1705 12.332 6.676 41.275 1.00 0.00 H ATOM 70636 C111 PA 1705 13.875 6.308 39.859 1.00 0.00 C ATOM 70637 H11R PA 1705 13.984 5.921 38.844 1.00 0.00 H ATOM 70638 H11S PA 1705 14.386 5.644 40.560 1.00 0.00 H ATOM 70639 C110 PA 1705 14.577 7.618 40.020 1.00 0.00 C ATOM 70640 H10R PA 1705 14.401 7.918 41.055 1.00 0.00 H ATOM 70641 H10S PA 1705 14.237 8.375 39.310 1.00 0.00 H ATOM 70642 C19 PA 1705 16.082 7.547 39.796 1.00 0.00 C ATOM 70643 H9R PA 1705 16.244 7.232 38.763 1.00 0.00 H ATOM 70644 H9S PA 1705 16.456 6.682 40.348 1.00 0.00 H ATOM 70645 C18 PA 1705 16.755 8.900 40.133 1.00 0.00 C ATOM 70646 H8R PA 1705 17.207 8.892 41.126 1.00 0.00 H ATOM 70647 H8S PA 1705 16.023 9.707 40.061 1.00 0.00 H ATOM 70648 C17 PA 1705 17.751 9.197 39.081 1.00 0.00 C ATOM 70649 H7R PA 1705 18.422 8.336 39.053 1.00 0.00 H ATOM 70650 H7S PA 1705 18.318 10.027 39.508 1.00 0.00 H ATOM 70651 C16 PA 1705 17.196 9.619 37.735 1.00 0.00 C ATOM 70652 H6R PA 1705 16.947 10.682 37.730 1.00 0.00 H ATOM 70653 H6S PA 1705 16.195 9.188 37.668 1.00 0.00 H ATOM 70654 C15 PA 1705 18.001 9.209 36.504 1.00 0.00 C ATOM 70655 H5R PA 1705 17.973 8.122 36.403 1.00 0.00 H ATOM 70656 H5S PA 1705 19.023 9.593 36.536 1.00 0.00 H ATOM 70657 C14 PA 1705 17.225 9.818 35.249 1.00 0.00 C ATOM 70658 H4R PA 1705 17.268 10.909 35.256 1.00 0.00 H ATOM 70659 H4S PA 1705 16.151 9.626 35.301 1.00 0.00 H ATOM 70660 C13 PA 1705 17.662 9.320 33.902 1.00 0.00 C ATOM 70661 H3R PA 1705 17.342 8.313 33.627 1.00 0.00 H ATOM 70662 H3S PA 1705 18.748 9.368 33.798 1.00 0.00 H ATOM 70663 C12 PA 1705 17.079 10.174 32.771 1.00 0.00 C ATOM 70664 H2R PA 1705 17.537 11.161 32.861 1.00 0.00 H ATOM 70665 H2S PA 1705 15.994 10.287 32.804 1.00 0.00 H ATOM 70666 C11 PGR 1706 17.487 9.556 31.444 1.00 0.00 C ATOM 70667 O12 PGR 1706 18.628 9.736 31.019 1.00 0.00 O ATOM 70668 O11 PGR 1706 16.483 8.910 30.893 1.00 0.00 O ATOM 70669 C1 PGR 1706 16.543 8.331 29.583 1.00 0.00 C ATOM 70670 HR PGR 1706 16.540 9.099 28.806 1.00 0.00 H ATOM 70671 HS PGR 1706 15.573 7.832 29.512 1.00 0.00 H ATOM 70672 C2 PGR 1706 17.711 7.359 29.446 1.00 0.00 C ATOM 70673 HX PGR 1706 18.702 7.816 29.514 1.00 0.00 H ATOM 70674 C3 PGR 1706 17.738 6.874 28.017 1.00 0.00 C ATOM 70675 HA PGR 1706 18.559 6.160 27.913 1.00 0.00 H ATOM 70676 HB PGR 1706 17.866 7.777 27.415 1.00 0.00 H ATOM 70677 O31 PGR 1706 16.485 6.287 27.722 1.00 0.00 O ATOM 70678 P31 PGR 1706 16.269 5.658 26.234 1.00 0.00 P ATOM 70679 O32 PGR 1706 16.554 4.082 26.508 1.00 0.00 O ATOM 70680 C31 PGR 1706 17.872 3.732 26.937 1.00 0.00 C ATOM 70681 H1A PGR 1706 18.586 4.170 26.234 1.00 0.00 H ATOM 70682 H1B PGR 1706 18.043 4.101 27.951 1.00 0.00 H ATOM 70683 C32 PGR 1706 18.081 2.140 26.973 1.00 0.00 C ATOM 70684 H2A PGR 1706 19.125 1.882 27.168 1.00 0.00 H ATOM 70685 O35 PGR 1706 17.804 1.713 25.638 1.00 0.00 O ATOM 70686 HO5A PGR 1706 18.030 0.766 25.608 1.00 0.00 H ATOM 70687 C33 PGR 1706 17.004 1.470 27.867 1.00 0.00 C ATOM 70688 H3A PGR 1706 17.100 1.741 28.921 1.00 0.00 H ATOM 70689 H3B PGR 1706 16.043 1.943 27.648 1.00 0.00 H ATOM 70690 O33 PGR 1706 14.851 5.918 25.903 1.00 0.00 O ATOM 70691 O34 PGR 1706 17.260 6.198 25.291 1.00 0.00 O ATOM 70692 O21 PGR 1706 17.469 6.242 30.397 1.00 0.00 O ATOM 70693 C21 PGR 1706 18.504 5.380 30.586 1.00 0.00 C ATOM 70694 O22 PGR 1706 19.596 5.588 30.103 1.00 0.00 O ATOM 70695 O36 PGR 1706 17.120 0.016 27.677 1.00 0.00 O ATOM 70696 HO6A PGR 1706 16.398 -0.409 28.175 1.00 0.00 H ATOM 70697 C12 OL 1707 18.165 4.195 31.431 1.00 0.00 C ATOM 70698 H2R OL 1707 17.168 3.813 31.202 1.00 0.00 H ATOM 70699 H2S OL 1707 18.963 3.461 31.298 1.00 0.00 H ATOM 70700 C13 OL 1707 18.115 4.503 32.826 1.00 0.00 C ATOM 70701 H3R OL 1707 17.432 5.355 32.849 1.00 0.00 H ATOM 70702 H3S OL 1707 17.541 3.707 33.305 1.00 0.00 H ATOM 70703 C14 OL 1707 19.359 5.051 33.550 1.00 0.00 C ATOM 70704 H4R OL 1707 19.906 4.132 33.768 1.00 0.00 H ATOM 70705 H4S OL 1707 19.987 5.640 32.878 1.00 0.00 H ATOM 70706 C15 OL 1707 19.161 5.657 34.975 1.00 0.00 C ATOM 70707 H5R OL 1707 20.186 5.819 35.315 1.00 0.00 H ATOM 70708 H5S OL 1707 18.569 6.572 35.047 1.00 0.00 H ATOM 70709 C16 OL 1707 18.478 4.669 35.985 1.00 0.00 C ATOM 70710 H6R OL 1707 17.610 4.273 35.455 1.00 0.00 H ATOM 70711 H6S OL 1707 19.142 3.807 36.071 1.00 0.00 H ATOM 70712 C17 OL 1707 18.070 5.137 37.447 1.00 0.00 C ATOM 70713 H7R OL 1707 18.918 5.581 37.973 1.00 0.00 H ATOM 70714 H7S OL 1707 17.275 5.875 37.318 1.00 0.00 H ATOM 70715 C18 OL 1707 17.654 3.970 38.299 1.00 0.00 C ATOM 70716 H8R OL 1707 18.388 3.162 38.277 1.00 0.00 H ATOM 70717 H8S OL 1707 17.842 4.265 39.333 1.00 0.00 H ATOM 70718 C19 OL 1707 16.250 3.410 38.152 1.00 0.00 C ATOM 70719 H9R OL 1707 15.464 4.153 38.257 1.00 0.00 H ATOM 70720 C110 OL 1707 15.939 2.156 37.925 1.00 0.00 C ATOM 70721 H10R OL 1707 14.879 1.932 37.838 1.00 0.00 H ATOM 70722 C111 OL 1707 16.822 0.938 38.016 1.00 0.00 C ATOM 70723 H11R OL 1707 16.615 0.293 37.160 1.00 0.00 H ATOM 70724 H11S OL 1707 17.827 1.278 37.760 1.00 0.00 H ATOM 70725 C112 OL 1707 16.866 0.153 39.332 1.00 0.00 C ATOM 70726 H12R OL 1707 17.514 0.688 40.029 1.00 0.00 H ATOM 70727 H12S OL 1707 15.929 0.238 39.887 1.00 0.00 H ATOM 70728 C113 OL 1707 17.102 -1.393 39.221 1.00 0.00 C ATOM 70729 H13R OL 1707 17.335 -1.828 40.195 1.00 0.00 H ATOM 70730 H13S OL 1707 16.206 -1.760 38.717 1.00 0.00 H ATOM 70731 C114 OL 1707 18.341 -1.669 38.435 1.00 0.00 C ATOM 70732 H14R OL 1707 18.398 -1.046 37.540 1.00 0.00 H ATOM 70733 H14S OL 1707 19.288 -1.394 38.904 1.00 0.00 H ATOM 70734 C115 OL 1707 18.506 -3.136 37.883 1.00 0.00 C ATOM 70735 H15R OL 1707 19.306 -3.107 37.141 1.00 0.00 H ATOM 70736 H15S OL 1707 18.965 -3.784 38.632 1.00 0.00 H ATOM 70737 C116 OL 1707 17.249 -3.669 37.155 1.00 0.00 C ATOM 70738 H16R OL 1707 16.353 -3.734 37.776 1.00 0.00 H ATOM 70739 H16S OL 1707 16.971 -3.064 36.289 1.00 0.00 H ATOM 70740 C117 OL 1707 17.575 -5.118 36.875 1.00 0.00 C ATOM 70741 H17R OL 1707 16.888 -5.568 36.156 1.00 0.00 H ATOM 70742 H17S OL 1707 18.532 -5.161 36.350 1.00 0.00 H ATOM 70743 C118 OL 1707 17.657 -5.971 38.127 1.00 0.00 C ATOM 70744 H18R OL 1707 16.765 -5.797 38.731 1.00 0.00 H ATOM 70745 H18S OL 1707 18.596 -5.911 38.682 1.00 0.00 H ATOM 70746 H18T OL 1707 17.457 -6.996 37.808 1.00 0.00 H TER 70747 OL 1707 ATOM 70747 C116 PA 1708 57.056 24.716 34.769 1.00 0.00 C ATOM 70748 H16R PA 1708 56.877 25.779 34.943 1.00 0.00 H ATOM 70749 H16S PA 1708 56.132 24.380 34.294 1.00 0.00 H ATOM 70750 H16T PA 1708 57.841 24.523 34.034 1.00 0.00 H ATOM 70751 C115 PA 1708 57.211 23.983 36.120 1.00 0.00 C ATOM 70752 H15R PA 1708 57.412 22.995 35.701 1.00 0.00 H ATOM 70753 H15S PA 1708 56.297 23.825 36.696 1.00 0.00 H ATOM 70754 C114 PA 1708 58.410 24.382 37.004 1.00 0.00 C ATOM 70755 H14R PA 1708 58.590 23.683 37.823 1.00 0.00 H ATOM 70756 H14S PA 1708 58.272 25.375 37.437 1.00 0.00 H ATOM 70757 C113 PA 1708 59.693 24.642 36.182 1.00 0.00 C ATOM 70758 H13R PA 1708 59.476 25.413 35.440 1.00 0.00 H ATOM 70759 H13S PA 1708 59.949 23.726 35.646 1.00 0.00 H ATOM 70760 C112 PA 1708 60.898 24.969 37.043 1.00 0.00 C ATOM 70761 H12R PA 1708 60.988 24.151 37.761 1.00 0.00 H ATOM 70762 H12S PA 1708 60.726 25.899 37.589 1.00 0.00 H ATOM 70763 C111 PA 1708 62.162 25.363 36.287 1.00 0.00 C ATOM 70764 H11R PA 1708 63.096 25.218 36.834 1.00 0.00 H ATOM 70765 H11S PA 1708 62.067 26.396 35.947 1.00 0.00 H ATOM 70766 C110 PA 1708 62.331 24.473 34.999 1.00 0.00 C ATOM 70767 H10R PA 1708 61.644 24.690 34.178 1.00 0.00 H ATOM 70768 H10S PA 1708 62.397 23.407 35.224 1.00 0.00 H ATOM 70769 C19 PA 1708 63.712 24.600 34.371 1.00 0.00 C ATOM 70770 H9R PA 1708 63.848 23.856 33.584 1.00 0.00 H ATOM 70771 H9S PA 1708 64.444 24.269 35.111 1.00 0.00 H ATOM 70772 C18 PA 1708 64.187 25.974 33.943 1.00 0.00 C ATOM 70773 H8R PA 1708 64.104 26.722 34.734 1.00 0.00 H ATOM 70774 H8S PA 1708 63.710 26.333 33.028 1.00 0.00 H ATOM 70775 C17 PA 1708 65.733 25.972 33.607 1.00 0.00 C ATOM 70776 H7R PA 1708 65.992 25.181 32.901 1.00 0.00 H ATOM 70777 H7S PA 1708 66.273 25.679 34.510 1.00 0.00 H ATOM 70778 C16 PA 1708 66.222 27.352 33.076 1.00 0.00 C ATOM 70779 H6R PA 1708 66.645 27.946 33.889 1.00 0.00 H ATOM 70780 H6S PA 1708 65.382 28.002 32.819 1.00 0.00 H ATOM 70781 C15 PA 1708 67.221 27.375 31.956 1.00 0.00 C ATOM 70782 H5R PA 1708 68.160 26.874 32.201 1.00 0.00 H ATOM 70783 H5S PA 1708 67.556 28.403 31.795 1.00 0.00 H ATOM 70784 C14 PA 1708 66.624 26.703 30.705 1.00 0.00 C ATOM 70785 H4R PA 1708 65.595 26.361 30.840 1.00 0.00 H ATOM 70786 H4S PA 1708 67.292 25.878 30.449 1.00 0.00 H ATOM 70787 C13 PA 1708 66.595 27.719 29.576 1.00 0.00 C ATOM 70788 H3R PA 1708 66.294 27.094 28.733 1.00 0.00 H ATOM 70789 H3S PA 1708 67.611 28.085 29.411 1.00 0.00 H ATOM 70790 C12 PA 1708 65.721 28.878 29.626 1.00 0.00 C ATOM 70791 H2R PA 1708 65.741 29.479 30.538 1.00 0.00 H ATOM 70792 H2S PA 1708 64.713 28.488 29.469 1.00 0.00 H ATOM 70793 C11 PGR 1709 65.913 29.814 28.405 1.00 0.00 C ATOM 70794 O12 PGR 1709 65.063 29.980 27.514 1.00 0.00 O ATOM 70795 O11 PGR 1709 67.085 30.443 28.494 1.00 0.00 O ATOM 70796 C1 PGR 1709 67.461 31.393 27.473 1.00 0.00 C ATOM 70797 HR PGR 1709 67.016 30.970 26.569 1.00 0.00 H ATOM 70798 HS PGR 1709 68.547 31.317 27.375 1.00 0.00 H ATOM 70799 C2 PGR 1709 66.790 32.738 27.652 1.00 0.00 C ATOM 70800 HX PGR 1709 65.704 32.613 27.627 1.00 0.00 H ATOM 70801 C3 PGR 1709 67.337 33.661 26.505 1.00 0.00 C ATOM 70802 HA PGR 1709 67.166 33.113 25.575 1.00 0.00 H ATOM 70803 HB PGR 1709 68.424 33.713 26.611 1.00 0.00 H ATOM 70804 O31 PGR 1709 66.731 34.954 26.432 1.00 0.00 O ATOM 70805 P31 PGR 1709 66.580 35.678 25.004 1.00 0.00 P ATOM 70806 O32 PGR 1709 67.995 35.857 24.386 1.00 0.00 O ATOM 70807 C31 PGR 1709 68.518 34.880 23.528 1.00 0.00 C ATOM 70808 H1A PGR 1709 67.862 34.764 22.662 1.00 0.00 H ATOM 70809 H1B PGR 1709 68.704 34.015 24.169 1.00 0.00 H ATOM 70810 C32 PGR 1709 69.924 35.289 22.986 1.00 0.00 C ATOM 70811 H2A PGR 1709 70.418 34.484 22.435 1.00 0.00 H ATOM 70812 O35 PGR 1709 70.718 35.561 24.124 1.00 0.00 O ATOM 70813 HO5A PGR 1709 71.195 34.802 24.504 1.00 0.00 H ATOM 70814 C33 PGR 1709 69.886 36.501 22.012 1.00 0.00 C ATOM 70815 H3A PGR 1709 70.849 36.815 21.601 1.00 0.00 H ATOM 70816 H3B PGR 1709 69.255 36.264 21.152 1.00 0.00 H ATOM 70817 O33 PGR 1709 65.726 34.788 24.106 1.00 0.00 O ATOM 70818 O34 PGR 1709 66.065 37.019 25.216 1.00 0.00 O ATOM 70819 O21 PGR 1709 67.320 33.356 28.858 1.00 0.00 O ATOM 70820 C21 PGR 1709 66.636 33.199 29.999 1.00 0.00 C ATOM 70821 O22 PGR 1709 65.463 32.948 30.047 1.00 0.00 O ATOM 70822 O36 PGR 1709 69.254 37.573 22.668 1.00 0.00 O ATOM 70823 HO6A PGR 1709 68.932 38.250 22.046 1.00 0.00 H ATOM 70824 C12 OL 1710 67.501 33.569 31.198 1.00 0.00 C ATOM 70825 H2R OL 1710 68.415 32.989 31.339 1.00 0.00 H ATOM 70826 H2S OL 1710 68.127 34.444 31.013 1.00 0.00 H ATOM 70827 C13 OL 1710 66.733 33.384 32.532 1.00 0.00 C ATOM 70828 H3R OL 1710 65.726 33.784 32.392 1.00 0.00 H ATOM 70829 H3S OL 1710 66.418 32.360 32.747 1.00 0.00 H ATOM 70830 C14 OL 1710 67.448 34.063 33.699 1.00 0.00 C ATOM 70831 H4R OL 1710 68.510 34.183 33.475 1.00 0.00 H ATOM 70832 H4S OL 1710 67.172 35.112 33.571 1.00 0.00 H ATOM 70833 C15 OL 1710 67.203 33.326 35.079 1.00 0.00 C ATOM 70834 H5R OL 1710 67.771 33.907 35.809 1.00 0.00 H ATOM 70835 H5S OL 1710 66.197 33.444 35.488 1.00 0.00 H ATOM 70836 C16 OL 1710 67.591 31.844 35.228 1.00 0.00 C ATOM 70837 H6R OL 1710 67.560 31.607 36.293 1.00 0.00 H ATOM 70838 H6S OL 1710 66.790 31.205 34.848 1.00 0.00 H ATOM 70839 C17 OL 1710 69.025 31.618 34.626 1.00 0.00 C ATOM 70840 H7R OL 1710 68.970 31.800 33.551 1.00 0.00 H ATOM 70841 H7S OL 1710 69.784 32.321 34.974 1.00 0.00 H ATOM 70842 C18 OL 1710 69.584 30.241 34.846 1.00 0.00 C ATOM 70843 H8R OL 1710 68.877 29.560 34.368 1.00 0.00 H ATOM 70844 H8S OL 1710 70.543 30.137 34.334 1.00 0.00 H ATOM 70845 C19 OL 1710 69.840 29.843 36.313 1.00 0.00 C ATOM 70846 H9R OL 1710 68.950 29.469 36.813 1.00 0.00 H ATOM 70847 C110 OL 1710 71.025 29.600 36.952 1.00 0.00 C ATOM 70848 H10R OL 1710 71.095 29.159 37.943 1.00 0.00 H ATOM 70849 C111 OL 1710 72.385 30.022 36.438 1.00 0.00 C ATOM 70850 H11R OL 1710 72.390 30.766 35.638 1.00 0.00 H ATOM 70851 H11S OL 1710 72.986 30.602 37.142 1.00 0.00 H ATOM 70852 C112 OL 1710 73.157 28.780 36.112 1.00 0.00 C ATOM 70853 H12R OL 1710 74.215 28.995 36.273 1.00 0.00 H ATOM 70854 H12S OL 1710 72.786 28.016 36.799 1.00 0.00 H ATOM 70855 C113 OL 1710 73.078 28.170 34.649 1.00 0.00 C ATOM 70856 H13R OL 1710 72.061 27.935 34.328 1.00 0.00 H ATOM 70857 H13S OL 1710 73.460 29.039 34.110 1.00 0.00 H ATOM 70858 C114 OL 1710 73.925 26.850 34.483 1.00 0.00 C ATOM 70859 H14R OL 1710 74.889 27.010 34.970 1.00 0.00 H ATOM 70860 H14S OL 1710 73.595 25.982 35.058 1.00 0.00 H ATOM 70861 C115 OL 1710 73.997 26.415 33.043 1.00 0.00 C ATOM 70862 H15R OL 1710 72.988 26.136 32.733 1.00 0.00 H ATOM 70863 H15S OL 1710 74.477 27.096 32.337 1.00 0.00 H ATOM 70864 C116 OL 1710 74.974 25.185 32.986 1.00 0.00 C ATOM 70865 H16R OL 1710 75.437 25.105 32.001 1.00 0.00 H ATOM 70866 H16S OL 1710 75.779 25.474 33.664 1.00 0.00 H ATOM 70867 C117 OL 1710 74.398 23.872 33.437 1.00 0.00 C ATOM 70868 H17R OL 1710 73.615 24.032 34.180 1.00 0.00 H ATOM 70869 H17S OL 1710 73.767 23.371 32.700 1.00 0.00 H ATOM 70870 C118 OL 1710 75.293 22.855 34.108 1.00 0.00 C ATOM 70871 H18R OL 1710 76.043 23.299 34.766 1.00 0.00 H ATOM 70872 H18S OL 1710 75.917 22.249 33.448 1.00 0.00 H ATOM 70873 H18T OL 1710 74.769 22.035 34.602 1.00 0.00 H TER 70874 OL 1710 ATOM 70874 C116 PA 1711 94.703 133.426 35.371 1.00 0.00 C ATOM 70875 H16R PA 1711 94.464 132.371 35.218 1.00 0.00 H ATOM 70876 H16S PA 1711 95.073 133.798 34.413 1.00 0.00 H ATOM 70877 H16T PA 1711 93.811 133.964 35.697 1.00 0.00 H ATOM 70878 C115 PA 1711 95.683 133.598 36.546 1.00 0.00 C ATOM 70879 H15R PA 1711 95.165 133.262 37.446 1.00 0.00 H ATOM 70880 H15S PA 1711 95.829 134.653 36.787 1.00 0.00 H ATOM 70881 C114 PA 1711 96.941 132.837 36.448 1.00 0.00 C ATOM 70882 H14R PA 1711 96.642 131.843 36.111 1.00 0.00 H ATOM 70883 H14S PA 1711 97.461 132.669 37.394 1.00 0.00 H ATOM 70884 C113 PA 1711 97.923 133.350 35.387 1.00 0.00 C ATOM 70885 H13R PA 1711 98.296 134.350 35.617 1.00 0.00 H ATOM 70886 H13S PA 1711 97.391 133.529 34.450 1.00 0.00 H ATOM 70887 C112 PA 1711 99.066 132.408 35.120 1.00 0.00 C ATOM 70888 H12R PA 1711 98.692 131.399 34.935 1.00 0.00 H ATOM 70889 H12S PA 1711 99.573 132.447 36.087 1.00 0.00 H ATOM 70890 C111 PA 1711 99.874 132.804 33.881 1.00 0.00 C ATOM 70891 H11R PA 1711 99.218 133.008 33.032 1.00 0.00 H ATOM 70892 H11S PA 1711 100.304 131.818 33.694 1.00 0.00 H ATOM 70893 C110 PA 1711 101.044 133.767 34.164 1.00 0.00 C ATOM 70894 H10R PA 1711 101.699 133.316 34.913 1.00 0.00 H ATOM 70895 H10S PA 1711 100.636 134.668 34.628 1.00 0.00 H ATOM 70896 C19 PA 1711 101.821 133.986 32.910 1.00 0.00 C ATOM 70897 H9R PA 1711 102.357 133.048 32.755 1.00 0.00 H ATOM 70898 H9S PA 1711 102.408 134.832 33.273 1.00 0.00 H ATOM 70899 C18 PA 1711 101.006 134.377 31.713 1.00 0.00 C ATOM 70900 H8R PA 1711 100.421 135.263 31.970 1.00 0.00 H ATOM 70901 H8S PA 1711 100.253 133.689 31.324 1.00 0.00 H ATOM 70902 C17 PA 1711 101.837 134.720 30.500 1.00 0.00 C ATOM 70903 H7R PA 1711 102.569 133.942 30.274 1.00 0.00 H ATOM 70904 H7S PA 1711 102.417 135.635 30.640 1.00 0.00 H ATOM 70905 C16 PA 1711 100.955 135.053 29.240 1.00 0.00 C ATOM 70906 H6R PA 1711 100.313 135.929 29.358 1.00 0.00 H ATOM 70907 H6S PA 1711 100.380 134.148 29.033 1.00 0.00 H ATOM 70908 C15 PA 1711 101.834 135.238 28.038 1.00 0.00 C ATOM 70909 H5R PA 1711 101.165 135.359 27.184 1.00 0.00 H ATOM 70910 H5S PA 1711 102.229 134.257 27.766 1.00 0.00 H ATOM 70911 C14 PA 1711 103.060 136.046 28.165 1.00 0.00 C ATOM 70912 H4R PA 1711 103.824 135.549 28.767 1.00 0.00 H ATOM 70913 H4S PA 1711 102.862 137.021 28.614 1.00 0.00 H ATOM 70914 C13 PA 1711 103.652 136.208 26.767 1.00 0.00 C ATOM 70915 H3R PA 1711 102.936 136.773 26.167 1.00 0.00 H ATOM 70916 H3S PA 1711 103.672 135.200 26.346 1.00 0.00 H ATOM 70917 C12 PA 1711 104.943 137.040 26.607 1.00 0.00 C ATOM 70918 H2R PA 1711 105.645 136.594 27.314 1.00 0.00 H ATOM 70919 H2S PA 1711 104.804 137.949 27.196 1.00 0.00 H ATOM 70920 C11 PGR 1712 105.542 137.273 25.242 1.00 0.00 C ATOM 70921 O12 PGR 1712 105.443 136.398 24.372 1.00 0.00 O ATOM 70922 O11 PGR 1712 106.267 138.364 25.150 1.00 0.00 O ATOM 70923 C1 PGR 1712 106.936 138.702 23.899 1.00 0.00 C ATOM 70924 HR PGR 1712 107.234 137.815 23.334 1.00 0.00 H ATOM 70925 HS PGR 1712 107.803 139.345 24.074 1.00 0.00 H ATOM 70926 C2 PGR 1712 105.920 139.475 22.951 1.00 0.00 C ATOM 70927 HX PGR 1712 105.072 138.834 22.696 1.00 0.00 H ATOM 70928 C3 PGR 1712 106.528 139.849 21.632 1.00 0.00 C ATOM 70929 HA PGR 1712 106.969 138.947 21.200 1.00 0.00 H ATOM 70930 HB PGR 1712 107.316 140.607 21.666 1.00 0.00 H ATOM 70931 O31 PGR 1712 105.540 140.341 20.764 1.00 0.00 O ATOM 70932 P31 PGR 1712 105.499 140.004 19.208 1.00 0.00 P ATOM 70933 O32 PGR 1712 105.278 138.439 19.156 1.00 0.00 O ATOM 70934 C31 PGR 1712 104.142 137.835 19.724 1.00 0.00 C ATOM 70935 H1A PGR 1712 103.277 137.964 19.070 1.00 0.00 H ATOM 70936 H1B PGR 1712 103.980 138.227 20.732 1.00 0.00 H ATOM 70937 C32 PGR 1712 104.368 136.263 19.817 1.00 0.00 C ATOM 70938 H2A PGR 1712 105.087 136.039 20.610 1.00 0.00 H ATOM 70939 O35 PGR 1712 105.013 135.753 18.672 1.00 0.00 O ATOM 70940 HO5A PGR 1712 105.700 136.401 18.433 1.00 0.00 H ATOM 70941 C33 PGR 1712 103.031 135.400 20.021 1.00 0.00 C ATOM 70942 H3A PGR 1712 102.358 135.738 20.813 1.00 0.00 H ATOM 70943 H3B PGR 1712 102.502 135.309 19.069 1.00 0.00 H ATOM 70944 O33 PGR 1712 104.288 140.592 18.608 1.00 0.00 O ATOM 70945 O34 PGR 1712 106.785 140.304 18.620 1.00 0.00 O ATOM 70946 O21 PGR 1712 105.466 140.740 23.678 1.00 0.00 O ATOM 70947 C21 PGR 1712 104.337 140.736 24.478 1.00 0.00 C ATOM 70948 O22 PGR 1712 103.528 139.805 24.581 1.00 0.00 O ATOM 70949 O36 PGR 1712 103.417 134.057 20.430 1.00 0.00 O ATOM 70950 HO6A PGR 1712 104.047 134.252 21.146 1.00 0.00 H ATOM 70951 C12 OL 1713 104.062 142.140 25.148 1.00 0.00 C ATOM 70952 H2R OL 1713 104.726 142.363 25.986 1.00 0.00 H ATOM 70953 H2S OL 1713 104.123 142.945 24.413 1.00 0.00 H ATOM 70954 C13 OL 1713 102.722 142.140 25.811 1.00 0.00 C ATOM 70955 H3R OL 1713 101.947 142.158 25.043 1.00 0.00 H ATOM 70956 H3S OL 1713 102.540 141.221 26.373 1.00 0.00 H ATOM 70957 C14 OL 1713 102.508 143.188 26.869 1.00 0.00 C ATOM 70958 H4R OL 1713 103.442 143.189 27.435 1.00 0.00 H ATOM 70959 H4S OL 1713 102.529 144.155 26.363 1.00 0.00 H ATOM 70960 C15 OL 1713 101.358 143.090 27.795 1.00 0.00 C ATOM 70961 H5R OL 1713 100.816 142.250 27.355 1.00 0.00 H ATOM 70962 H5S OL 1713 101.688 142.645 28.737 1.00 0.00 H ATOM 70963 C16 OL 1713 100.428 144.331 27.699 1.00 0.00 C ATOM 70964 H6R OL 1713 101.005 145.193 28.040 1.00 0.00 H ATOM 70965 H6S OL 1713 100.125 144.440 26.656 1.00 0.00 H ATOM 70966 C17 OL 1713 99.221 144.157 28.632 1.00 0.00 C ATOM 70967 H7R OL 1713 99.624 143.948 29.625 1.00 0.00 H ATOM 70968 H7S OL 1713 98.754 145.141 28.705 1.00 0.00 H ATOM 70969 C18 OL 1713 98.226 143.094 28.139 1.00 0.00 C ATOM 70970 H8R OL 1713 97.532 143.560 27.436 1.00 0.00 H ATOM 70971 H8S OL 1713 98.746 142.359 27.521 1.00 0.00 H ATOM 70972 C19 OL 1713 97.619 142.578 29.373 1.00 0.00 C ATOM 70973 H9R OL 1713 98.264 142.028 30.053 1.00 0.00 H ATOM 70974 C110 OL 1713 96.330 142.728 29.757 1.00 0.00 C ATOM 70975 H10R OL 1713 96.011 142.297 30.702 1.00 0.00 H ATOM 70976 C111 OL 1713 95.257 143.546 29.095 1.00 0.00 C ATOM 70977 H11R OL 1713 94.941 144.315 29.803 1.00 0.00 H ATOM 70978 H11S OL 1713 95.645 144.123 28.253 1.00 0.00 H ATOM 70979 C112 OL 1713 94.080 142.795 28.457 1.00 0.00 C ATOM 70980 H12R OL 1713 93.510 143.588 27.970 1.00 0.00 H ATOM 70981 H12S OL 1713 94.327 142.095 27.656 1.00 0.00 H ATOM 70982 C113 OL 1713 93.199 142.067 29.428 1.00 0.00 C ATOM 70983 H13R OL 1713 92.363 141.548 28.953 1.00 0.00 H ATOM 70984 H13S OL 1713 93.724 141.209 29.852 1.00 0.00 H ATOM 70985 C114 OL 1713 92.612 142.876 30.599 1.00 0.00 C ATOM 70986 H14R OL 1713 93.462 143.252 31.172 1.00 0.00 H ATOM 70987 H14S OL 1713 92.009 143.714 30.245 1.00 0.00 H ATOM 70988 C115 OL 1713 91.824 141.965 31.464 1.00 0.00 C ATOM 70989 H15R OL 1713 90.965 141.487 30.986 1.00 0.00 H ATOM 70990 H15S OL 1713 92.458 141.081 31.560 1.00 0.00 H ATOM 70991 C116 OL 1713 91.489 142.489 32.822 1.00 0.00 C ATOM 70992 H16R OL 1713 91.298 141.576 33.389 1.00 0.00 H ATOM 70993 H16S OL 1713 92.329 143.015 33.280 1.00 0.00 H ATOM 70994 C117 OL 1713 90.294 143.441 32.767 1.00 0.00 C ATOM 70995 H17R OL 1713 90.508 144.332 32.174 1.00 0.00 H ATOM 70996 H17S OL 1713 89.494 142.882 32.278 1.00 0.00 H ATOM 70997 C118 OL 1713 89.716 143.895 34.158 1.00 0.00 C ATOM 70998 H18R OL 1713 88.691 144.252 34.038 1.00 0.00 H ATOM 70999 H18S OL 1713 90.270 144.751 34.550 1.00 0.00 H ATOM 71000 H18T OL 1713 89.698 143.051 34.851 1.00 0.00 H TER 71001 OL 1713 ATOM 71001 C116 PA 1714 16.733 45.941 39.961 1.00 0.00 C ATOM 71002 H16R PA 1714 16.185 46.016 39.019 1.00 0.00 H ATOM 71003 H16S PA 1714 17.125 46.907 40.287 1.00 0.00 H ATOM 71004 H16T PA 1714 15.930 45.678 40.653 1.00 0.00 H ATOM 71005 C115 PA 1714 17.799 44.783 40.105 1.00 0.00 C ATOM 71006 H15R PA 1714 17.709 44.455 41.142 1.00 0.00 H ATOM 71007 H15S PA 1714 18.805 45.206 40.077 1.00 0.00 H ATOM 71008 C114 PA 1714 17.837 43.624 39.095 1.00 0.00 C ATOM 71009 H14R PA 1714 17.933 43.988 38.070 1.00 0.00 H ATOM 71010 H14S PA 1714 16.901 43.066 39.161 1.00 0.00 H ATOM 71011 C113 PA 1714 19.045 42.708 39.199 1.00 0.00 C ATOM 71012 H13R PA 1714 18.884 42.032 40.042 1.00 0.00 H ATOM 71013 H13S PA 1714 20.012 43.196 39.332 1.00 0.00 H ATOM 71014 C112 PA 1714 19.127 41.711 37.981 1.00 0.00 C ATOM 71015 H12R PA 1714 19.449 42.292 37.114 1.00 0.00 H ATOM 71016 H12S PA 1714 18.099 41.426 37.743 1.00 0.00 H ATOM 71017 C111 PA 1714 20.010 40.507 38.220 1.00 0.00 C ATOM 71018 H11R PA 1714 19.737 40.055 39.175 1.00 0.00 H ATOM 71019 H11S PA 1714 21.073 40.747 38.149 1.00 0.00 H ATOM 71020 C110 PA 1714 19.821 39.470 37.148 1.00 0.00 C ATOM 71021 H10R PA 1714 20.655 38.779 37.283 1.00 0.00 H ATOM 71022 H10S PA 1714 20.022 40.016 36.224 1.00 0.00 H ATOM 71023 C19 PA 1714 18.457 38.719 37.126 1.00 0.00 C ATOM 71024 H9R PA 1714 17.755 39.444 36.709 1.00 0.00 H ATOM 71025 H9S PA 1714 18.201 38.461 38.155 1.00 0.00 H ATOM 71026 C18 PA 1714 18.491 37.448 36.241 1.00 0.00 C ATOM 71027 H8R PA 1714 17.482 37.041 36.326 1.00 0.00 H ATOM 71028 H8S PA 1714 19.219 36.700 36.562 1.00 0.00 H ATOM 71029 C17 PA 1714 18.894 37.633 34.791 1.00 0.00 C ATOM 71030 H7R PA 1714 18.682 36.662 34.336 1.00 0.00 H ATOM 71031 H7S PA 1714 19.972 37.801 34.755 1.00 0.00 H ATOM 71032 C16 PA 1714 18.143 38.664 34.006 1.00 0.00 C ATOM 71033 H6R PA 1714 18.391 39.674 34.338 1.00 0.00 H ATOM 71034 H6S PA 1714 17.062 38.551 34.111 1.00 0.00 H ATOM 71035 C15 PA 1714 18.510 38.633 32.549 1.00 0.00 C ATOM 71036 H5R PA 1714 19.587 38.813 32.566 1.00 0.00 H ATOM 71037 H5S PA 1714 18.015 39.476 32.061 1.00 0.00 H ATOM 71038 C14 PA 1714 18.210 37.467 31.703 1.00 0.00 C ATOM 71039 H4R PA 1714 17.129 37.445 31.551 1.00 0.00 H ATOM 71040 H4S PA 1714 18.562 36.559 32.197 1.00 0.00 H ATOM 71041 C13 PA 1714 18.985 37.498 30.385 1.00 0.00 C ATOM 71042 H3R PA 1714 20.037 37.775 30.479 1.00 0.00 H ATOM 71043 H3S PA 1714 18.646 38.261 29.682 1.00 0.00 H ATOM 71044 C12 PA 1714 18.870 36.177 29.654 1.00 0.00 C ATOM 71045 H2R PA 1714 17.890 35.965 29.220 1.00 0.00 H ATOM 71046 H2S PA 1714 19.138 35.362 30.330 1.00 0.00 H ATOM 71047 C11 PC 1715 19.868 36.243 28.533 1.00 0.00 C ATOM 71048 O12 PC 1715 20.554 35.296 28.138 1.00 0.00 O ATOM 71049 O11 PC 1715 20.116 37.482 27.988 1.00 0.00 O ATOM 71050 C1 PC 1715 20.817 37.704 26.707 1.00 0.00 C ATOM 71051 HR PC 1715 21.800 37.237 26.806 1.00 0.00 H ATOM 71052 HS PC 1715 20.884 38.793 26.658 1.00 0.00 H ATOM 71053 C2 PC 1715 20.149 37.130 25.451 1.00 0.00 C ATOM 71054 HX PC 1715 20.007 36.052 25.563 1.00 0.00 H ATOM 71055 C3 PC 1715 21.129 37.419 24.307 1.00 0.00 C ATOM 71056 HA PC 1715 22.051 36.844 24.424 1.00 0.00 H ATOM 71057 HB PC 1715 21.246 38.504 24.243 1.00 0.00 H ATOM 71058 O31 PC 1715 20.429 36.992 23.119 1.00 0.00 O ATOM 71059 P31 PC 1715 20.968 37.223 21.658 1.00 0.00 P ATOM 71060 O32 PC 1715 22.235 36.338 21.540 1.00 0.00 O ATOM 71061 C31 PC 1715 22.054 34.963 21.815 1.00 0.00 C ATOM 71062 H1A PC 1715 21.283 34.563 21.151 1.00 0.00 H ATOM 71063 H1B PC 1715 21.852 34.755 22.868 1.00 0.00 H ATOM 71064 C32 PC 1715 23.388 34.215 21.372 1.00 0.00 C ATOM 71065 H2A PC 1715 23.485 33.340 22.017 1.00 0.00 H ATOM 71066 H2B PC 1715 24.229 34.867 21.616 1.00 0.00 H ATOM 71067 N31 PC 1715 23.536 33.835 19.924 1.00 0.00 N ATOM 71068 C33 PC 1715 23.603 35.049 19.046 1.00 0.00 C ATOM 71069 H3A PC 1715 22.691 35.631 19.192 1.00 0.00 H ATOM 71070 H3B PC 1715 23.577 34.916 17.963 1.00 0.00 H ATOM 71071 H3C PC 1715 24.519 35.592 19.284 1.00 0.00 H ATOM 71072 C34 PC 1715 24.870 33.062 19.837 1.00 0.00 C ATOM 71073 H4A PC 1715 24.681 32.005 20.028 1.00 0.00 H ATOM 71074 H4B PC 1715 25.576 33.413 20.591 1.00 0.00 H ATOM 71075 H4C PC 1715 25.288 33.309 18.860 1.00 0.00 H ATOM 71076 C35 PC 1715 22.450 32.841 19.623 1.00 0.00 C ATOM 71077 H5A PC 1715 22.451 32.730 18.538 1.00 0.00 H ATOM 71078 H5B PC 1715 21.501 33.369 19.730 1.00 0.00 H ATOM 71079 H5C PC 1715 22.536 31.889 20.148 1.00 0.00 H ATOM 71080 O33 PC 1715 19.940 36.740 20.698 1.00 0.00 O ATOM 71081 O34 PC 1715 21.391 38.652 21.554 1.00 0.00 O ATOM 71082 O21 PC 1715 18.957 37.991 25.356 1.00 0.00 O ATOM 71083 C21 PC 1715 17.843 37.599 26.032 1.00 0.00 C ATOM 71084 O22 PC 1715 17.610 36.462 26.516 1.00 0.00 O ATOM 71085 C12 OL 1716 16.879 38.686 26.270 1.00 0.00 C ATOM 71086 H2R OL 1716 17.026 39.569 25.644 1.00 0.00 H ATOM 71087 H2S OL 1716 15.902 38.296 25.978 1.00 0.00 H ATOM 71088 C13 OL 1716 16.750 39.015 27.734 1.00 0.00 C ATOM 71089 H3R OL 1716 16.670 38.044 28.227 1.00 0.00 H ATOM 71090 H3S OL 1716 17.739 39.339 28.066 1.00 0.00 H ATOM 71091 C14 OL 1716 15.680 40.008 28.127 1.00 0.00 C ATOM 71092 H4R OL 1716 15.778 40.934 27.557 1.00 0.00 H ATOM 71093 H4S OL 1716 14.703 39.537 27.996 1.00 0.00 H ATOM 71094 C15 OL 1716 15.831 40.321 29.630 1.00 0.00 C ATOM 71095 H5R OL 1716 15.936 39.359 30.134 1.00 0.00 H ATOM 71096 H5S OL 1716 16.743 40.853 29.908 1.00 0.00 H ATOM 71097 C16 OL 1716 14.634 41.011 30.289 1.00 0.00 C ATOM 71098 H6R OL 1716 14.615 41.922 29.688 1.00 0.00 H ATOM 71099 H6S OL 1716 13.721 40.442 30.103 1.00 0.00 H ATOM 71100 C17 OL 1716 14.719 41.256 31.787 1.00 0.00 C ATOM 71101 H7R OL 1716 13.803 41.628 32.251 1.00 0.00 H ATOM 71102 H7S OL 1716 14.752 40.323 32.353 1.00 0.00 H ATOM 71103 C18 OL 1716 15.885 42.103 32.308 1.00 0.00 C ATOM 71104 H8R OL 1716 16.907 41.907 31.978 1.00 0.00 H ATOM 71105 H8S OL 1716 15.704 43.134 31.996 1.00 0.00 H ATOM 71106 C19 OL 1716 15.823 42.020 33.827 1.00 0.00 C ATOM 71107 H9R OL 1716 14.866 41.696 34.229 1.00 0.00 H ATOM 71108 C110 OL 1716 16.761 42.258 34.744 1.00 0.00 C ATOM 71109 H10R OL 1716 16.450 42.102 35.774 1.00 0.00 H ATOM 71110 C111 OL 1716 18.149 42.789 34.424 1.00 0.00 C ATOM 71111 H11R OL 1716 18.878 42.130 34.901 1.00 0.00 H ATOM 71112 H11S OL 1716 18.399 42.790 33.362 1.00 0.00 H ATOM 71113 C112 OL 1716 18.493 44.205 34.804 1.00 0.00 C ATOM 71114 H12R OL 1716 18.850 44.257 35.835 1.00 0.00 H ATOM 71115 H12S OL 1716 19.266 44.675 34.192 1.00 0.00 H ATOM 71116 C113 OL 1716 17.247 45.158 34.576 1.00 0.00 C ATOM 71117 H13R OL 1716 16.791 45.002 33.595 1.00 0.00 H ATOM 71118 H13S OL 1716 16.579 44.837 35.377 1.00 0.00 H ATOM 71119 C114 OL 1716 17.540 46.584 34.765 1.00 0.00 C ATOM 71120 H14R OL 1716 18.293 47.001 34.093 1.00 0.00 H ATOM 71121 H14S OL 1716 16.653 47.003 34.286 1.00 0.00 H ATOM 71122 C115 OL 1716 17.746 46.957 36.191 1.00 0.00 C ATOM 71123 H15R OL 1716 16.956 46.523 36.808 1.00 0.00 H ATOM 71124 H15S OL 1716 18.701 46.573 36.557 1.00 0.00 H ATOM 71125 C116 OL 1716 17.676 48.529 36.434 1.00 0.00 C ATOM 71126 H16R OL 1716 18.293 48.937 35.631 1.00 0.00 H ATOM 71127 H16S OL 1716 16.689 48.896 36.147 1.00 0.00 H ATOM 71128 C117 OL 1716 18.090 48.884 37.836 1.00 0.00 C ATOM 71129 H17R OL 1716 17.498 48.468 38.654 1.00 0.00 H ATOM 71130 H17S OL 1716 19.095 48.469 37.934 1.00 0.00 H ATOM 71131 C118 OL 1716 17.960 50.420 38.213 1.00 0.00 C ATOM 71132 H18R OL 1716 18.499 51.140 37.593 1.00 0.00 H ATOM 71133 H18S OL 1716 18.172 50.571 39.273 1.00 0.00 H ATOM 71134 H18T OL 1716 16.969 50.847 38.041 1.00 0.00 H TER 71135 OL 1716 ATOM 71135 C116 PA 1717 79.314 138.195 30.041 1.00 0.00 C ATOM 71136 H16R PA 1717 78.687 139.041 29.750 1.00 0.00 H ATOM 71137 H16S PA 1717 80.110 138.077 29.303 1.00 0.00 H ATOM 71138 H16T PA 1717 79.845 138.466 30.956 1.00 0.00 H ATOM 71139 C115 PA 1717 78.624 136.832 30.123 1.00 0.00 C ATOM 71140 H15R PA 1717 79.351 136.018 30.125 1.00 0.00 H ATOM 71141 H15S PA 1717 78.115 136.721 29.163 1.00 0.00 H ATOM 71142 C114 PA 1717 77.636 136.470 31.198 1.00 0.00 C ATOM 71143 H14R PA 1717 77.047 135.623 30.839 1.00 0.00 H ATOM 71144 H14S PA 1717 76.988 137.340 31.323 1.00 0.00 H ATOM 71145 C113 PA 1717 78.051 136.236 32.616 1.00 0.00 C ATOM 71146 H13R PA 1717 78.553 137.150 32.941 1.00 0.00 H ATOM 71147 H13S PA 1717 78.752 135.398 32.600 1.00 0.00 H ATOM 71148 C112 PA 1717 76.889 135.971 33.627 1.00 0.00 C ATOM 71149 H12R PA 1717 77.263 136.093 34.645 1.00 0.00 H ATOM 71150 H12S PA 1717 76.462 134.966 33.604 1.00 0.00 H ATOM 71151 C111 PA 1717 75.642 136.927 33.503 1.00 0.00 C ATOM 71152 H11R PA 1717 75.194 136.866 32.509 1.00 0.00 H ATOM 71153 H11S PA 1717 75.953 137.960 33.670 1.00 0.00 H ATOM 71154 C110 PA 1717 74.589 136.432 34.521 1.00 0.00 C ATOM 71155 H10R PA 1717 75.140 136.501 35.461 1.00 0.00 H ATOM 71156 H10S PA 1717 74.299 135.395 34.338 1.00 0.00 H ATOM 71157 C19 PA 1717 73.383 137.381 34.574 1.00 0.00 C ATOM 71158 H9R PA 1717 73.694 138.391 34.301 1.00 0.00 H ATOM 71159 H9S PA 1717 73.172 137.553 35.632 1.00 0.00 H ATOM 71160 C18 PA 1717 72.192 136.878 33.810 1.00 0.00 C ATOM 71161 H8R PA 1717 71.359 137.460 34.211 1.00 0.00 H ATOM 71162 H8S PA 1717 72.068 135.819 34.046 1.00 0.00 H ATOM 71163 C17 PA 1717 72.238 136.997 32.306 1.00 0.00 C ATOM 71164 H7R PA 1717 73.156 136.446 32.090 1.00 0.00 H ATOM 71165 H7S PA 1717 72.692 137.976 32.139 1.00 0.00 H ATOM 71166 C16 PA 1717 70.975 136.693 31.554 1.00 0.00 C ATOM 71167 H6R PA 1717 70.886 135.615 31.710 1.00 0.00 H ATOM 71168 H6S PA 1717 71.161 136.735 30.479 1.00 0.00 H ATOM 71169 C15 PA 1717 69.709 137.452 31.972 1.00 0.00 C ATOM 71170 H5R PA 1717 69.416 137.344 33.019 1.00 0.00 H ATOM 71171 H5S PA 1717 68.916 137.000 31.373 1.00 0.00 H ATOM 71172 C14 PA 1717 69.838 138.994 31.708 1.00 0.00 C ATOM 71173 H4R PA 1717 70.549 139.304 32.476 1.00 0.00 H ATOM 71174 H4S PA 1717 68.888 139.531 31.661 1.00 0.00 H ATOM 71175 C13 PA 1717 70.258 139.327 30.239 1.00 0.00 C ATOM 71176 H3R PA 1717 71.311 139.185 29.987 1.00 0.00 H ATOM 71177 H3S PA 1717 70.060 140.387 30.065 1.00 0.00 H ATOM 71178 C12 PA 1717 69.265 138.622 29.237 1.00 0.00 C ATOM 71179 H2R PA 1717 68.258 138.748 29.640 1.00 0.00 H ATOM 71180 H2S PA 1717 69.410 137.550 29.386 1.00 0.00 H ATOM 71181 C11 PC 1718 69.428 139.150 27.820 1.00 0.00 C ATOM 71182 O12 PC 1718 68.788 139.971 27.278 1.00 0.00 O ATOM 71183 O11 PC 1718 70.509 138.661 27.162 1.00 0.00 O ATOM 71184 C1 PC 1718 71.074 139.140 25.900 1.00 0.00 C ATOM 71185 HR PC 1718 70.295 139.108 25.135 1.00 0.00 H ATOM 71186 HS PC 1718 71.917 138.541 25.546 1.00 0.00 H ATOM 71187 C2 PC 1718 71.453 140.698 25.899 1.00 0.00 C ATOM 71188 HX PC 1718 70.589 141.268 26.251 1.00 0.00 H ATOM 71189 C3 PC 1718 71.619 141.245 24.517 1.00 0.00 C ATOM 71190 HA PC 1718 72.132 142.210 24.550 1.00 0.00 H ATOM 71191 HB PC 1718 70.684 141.560 24.046 1.00 0.00 H ATOM 71192 O31 PC 1718 72.314 140.326 23.672 1.00 0.00 O ATOM 71193 P31 PC 1718 72.665 140.745 22.210 1.00 0.00 P ATOM 71194 O32 PC 1718 71.336 140.785 21.419 1.00 0.00 O ATOM 71195 C31 PC 1718 70.311 139.798 21.679 1.00 0.00 C ATOM 71196 H1A PC 1718 69.639 140.120 22.479 1.00 0.00 H ATOM 71197 H1B PC 1718 70.904 138.960 22.055 1.00 0.00 H ATOM 71198 C32 PC 1718 69.490 139.448 20.362 1.00 0.00 C ATOM 71199 H2A PC 1718 70.241 139.265 19.593 1.00 0.00 H ATOM 71200 H2B PC 1718 68.866 140.314 20.138 1.00 0.00 H ATOM 71201 N31 PC 1718 68.652 138.212 20.517 1.00 0.00 N ATOM 71202 C33 PC 1718 67.790 138.365 21.674 1.00 0.00 C ATOM 71203 H3A PC 1718 67.266 137.430 21.877 1.00 0.00 H ATOM 71204 H3B PC 1718 67.032 139.106 21.419 1.00 0.00 H ATOM 71205 H3C PC 1718 68.355 138.662 22.558 1.00 0.00 H ATOM 71206 C34 PC 1718 67.739 137.990 19.299 1.00 0.00 C ATOM 71207 H4A PC 1718 68.371 137.772 18.437 1.00 0.00 H ATOM 71208 H4B PC 1718 67.162 138.902 19.144 1.00 0.00 H ATOM 71209 H4C PC 1718 67.033 137.220 19.612 1.00 0.00 H ATOM 71210 C35 PC 1718 69.508 136.975 20.624 1.00 0.00 C ATOM 71211 H5A PC 1718 68.753 136.193 20.528 1.00 0.00 H ATOM 71212 H5B PC 1718 70.110 136.939 21.533 1.00 0.00 H ATOM 71213 H5C PC 1718 70.155 136.939 19.747 1.00 0.00 H ATOM 71214 O33 PC 1718 73.191 142.139 22.184 1.00 0.00 O ATOM 71215 O34 PC 1718 73.381 139.673 21.528 1.00 0.00 O ATOM 71216 O21 PC 1718 72.547 140.962 26.846 1.00 0.00 O ATOM 71217 C21 PC 1718 73.735 140.419 26.581 1.00 0.00 C ATOM 71218 O22 PC 1718 73.954 139.628 25.687 1.00 0.00 O ATOM 71219 C12 OL 1719 74.784 140.935 27.490 1.00 0.00 C ATOM 71220 H2R OL 1719 75.496 141.438 26.832 1.00 0.00 H ATOM 71221 H2S OL 1719 74.327 141.662 28.165 1.00 0.00 H ATOM 71222 C13 OL 1719 75.428 139.743 28.283 1.00 0.00 C ATOM 71223 H3R OL 1719 75.838 139.058 27.539 1.00 0.00 H ATOM 71224 H3S OL 1719 76.208 140.246 28.858 1.00 0.00 H ATOM 71225 C14 OL 1719 74.620 139.217 29.444 1.00 0.00 C ATOM 71226 H4R OL 1719 73.671 138.779 29.127 1.00 0.00 H ATOM 71227 H4S OL 1719 75.159 138.460 30.018 1.00 0.00 H ATOM 71228 C15 OL 1719 74.265 140.224 30.589 1.00 0.00 C ATOM 71229 H5R OL 1719 73.671 141.079 30.258 1.00 0.00 H ATOM 71230 H5S OL 1719 73.544 139.733 31.245 1.00 0.00 H ATOM 71231 C16 OL 1719 75.427 140.650 31.490 1.00 0.00 C ATOM 71232 H6R OL 1719 75.925 139.794 31.950 1.00 0.00 H ATOM 71233 H6S OL 1719 76.124 141.171 30.831 1.00 0.00 H ATOM 71234 C17 OL 1719 74.894 141.383 32.692 1.00 0.00 C ATOM 71235 H7R OL 1719 74.243 142.218 32.425 1.00 0.00 H ATOM 71236 H7S OL 1719 74.263 140.698 33.263 1.00 0.00 H ATOM 71237 C18 OL 1719 76.014 141.855 33.639 1.00 0.00 C ATOM 71238 H8R OL 1719 76.939 141.336 33.379 1.00 0.00 H ATOM 71239 H8S OL 1719 76.177 142.921 33.470 1.00 0.00 H ATOM 71240 C19 OL 1719 75.585 141.749 35.047 1.00 0.00 C ATOM 71241 H9R OL 1719 75.077 142.618 35.458 1.00 0.00 H ATOM 71242 C110 OL 1719 75.947 140.811 36.019 1.00 0.00 C ATOM 71243 H10R OL 1719 75.661 141.041 37.042 1.00 0.00 H ATOM 71244 C111 OL 1719 77.005 139.687 35.846 1.00 0.00 C ATOM 71245 H11R OL 1719 76.508 138.757 36.133 1.00 0.00 H ATOM 71246 H11S OL 1719 77.238 139.553 34.787 1.00 0.00 H ATOM 71247 C112 OL 1719 78.280 139.954 36.605 1.00 0.00 C ATOM 71248 H12R OL 1719 78.087 139.831 37.673 1.00 0.00 H ATOM 71249 H12S OL 1719 78.908 139.068 36.500 1.00 0.00 H ATOM 71250 C113 OL 1719 79.007 141.223 36.209 1.00 0.00 C ATOM 71251 H13R OL 1719 79.122 141.288 35.125 1.00 0.00 H ATOM 71252 H13S OL 1719 78.360 142.039 36.540 1.00 0.00 H ATOM 71253 C114 OL 1719 80.348 141.402 36.913 1.00 0.00 C ATOM 71254 H14R OL 1719 80.486 142.477 36.778 1.00 0.00 H ATOM 71255 H14S OL 1719 80.051 141.116 37.924 1.00 0.00 H ATOM 71256 C115 OL 1719 81.483 140.562 36.460 1.00 0.00 C ATOM 71257 H15R OL 1719 81.337 139.482 36.527 1.00 0.00 H ATOM 71258 H15S OL 1719 81.776 140.659 35.412 1.00 0.00 H ATOM 71259 C116 OL 1719 82.723 140.920 37.132 1.00 0.00 C ATOM 71260 H16R OL 1719 82.914 141.974 36.921 1.00 0.00 H ATOM 71261 H16S OL 1719 82.495 140.721 38.181 1.00 0.00 H ATOM 71262 C117 OL 1719 84.023 140.214 36.816 1.00 0.00 C ATOM 71263 H17R OL 1719 84.326 140.436 35.791 1.00 0.00 H ATOM 71264 H17S OL 1719 84.816 140.538 37.493 1.00 0.00 H ATOM 71265 C118 OL 1719 84.131 138.752 37.088 1.00 0.00 C ATOM 71266 H18R OL 1719 85.166 138.406 37.098 1.00 0.00 H ATOM 71267 H18S OL 1719 83.578 138.080 36.428 1.00 0.00 H ATOM 71268 H18T OL 1719 83.662 138.587 38.060 1.00 0.00 H TER 71269 OL 1719 ATOM 71269 C116 PA 1720 102.398 136.648 35.871 1.00 0.00 C ATOM 71270 H16R PA 1720 101.963 136.388 34.903 1.00 0.00 H ATOM 71271 H16S PA 1720 103.055 135.912 36.339 1.00 0.00 H ATOM 71272 H16T PA 1720 103.012 137.540 35.729 1.00 0.00 H ATOM 71273 C115 PA 1720 101.230 136.879 36.838 1.00 0.00 C ATOM 71274 H15R PA 1720 101.480 137.635 37.585 1.00 0.00 H ATOM 71275 H15S PA 1720 101.057 135.992 37.452 1.00 0.00 H ATOM 71276 C114 PA 1720 99.998 137.529 36.290 1.00 0.00 C ATOM 71277 H14R PA 1720 99.914 137.418 35.207 1.00 0.00 H ATOM 71278 H14S PA 1720 100.012 138.591 36.541 1.00 0.00 H ATOM 71279 C113 PA 1720 98.713 137.020 36.896 1.00 0.00 C ATOM 71280 H13R PA 1720 98.763 137.046 37.986 1.00 0.00 H ATOM 71281 H13S PA 1720 98.643 135.970 36.601 1.00 0.00 H ATOM 71282 C112 PA 1720 97.393 137.632 36.519 1.00 0.00 C ATOM 71283 H12R PA 1720 97.208 138.627 36.930 1.00 0.00 H ATOM 71284 H12S PA 1720 96.542 137.021 36.824 1.00 0.00 H ATOM 71285 C111 PA 1720 97.112 137.823 34.934 1.00 0.00 C ATOM 71286 H11R PA 1720 97.993 138.354 34.565 1.00 0.00 H ATOM 71287 H11S PA 1720 96.192 138.407 34.864 1.00 0.00 H ATOM 71288 C110 PA 1720 97.012 136.574 34.056 1.00 0.00 C ATOM 71289 H10R PA 1720 96.257 135.941 34.527 1.00 0.00 H ATOM 71290 H10S PA 1720 98.001 136.115 34.114 1.00 0.00 H ATOM 71291 C19 PA 1720 96.715 136.785 32.604 1.00 0.00 C ATOM 71292 H9R PA 1720 96.758 135.891 31.977 1.00 0.00 H ATOM 71293 H9S PA 1720 97.585 137.342 32.250 1.00 0.00 H ATOM 71294 C18 PA 1720 95.494 137.651 32.239 1.00 0.00 C ATOM 71295 H8R PA 1720 95.640 138.648 32.658 1.00 0.00 H ATOM 71296 H8S PA 1720 94.592 137.118 32.546 1.00 0.00 H ATOM 71297 C17 PA 1720 95.302 137.866 30.819 1.00 0.00 C ATOM 71298 H7R PA 1720 95.455 136.839 30.479 1.00 0.00 H ATOM 71299 H7S PA 1720 96.091 138.462 30.355 1.00 0.00 H ATOM 71300 C16 PA 1720 93.809 138.250 30.515 1.00 0.00 C ATOM 71301 H6R PA 1720 93.620 139.237 30.942 1.00 0.00 H ATOM 71302 H6S PA 1720 93.172 137.500 30.990 1.00 0.00 H ATOM 71303 C15 PA 1720 93.512 138.253 29.031 1.00 0.00 C ATOM 71304 H5R PA 1720 93.848 137.301 28.615 1.00 0.00 H ATOM 71305 H5S PA 1720 94.138 139.006 28.546 1.00 0.00 H ATOM 71306 C14 PA 1720 92.054 138.513 28.653 1.00 0.00 C ATOM 71307 H4R PA 1720 91.877 139.504 29.077 1.00 0.00 H ATOM 71308 H4S PA 1720 91.471 137.766 29.196 1.00 0.00 H ATOM 71309 C13 PA 1720 91.691 138.393 27.185 1.00 0.00 C ATOM 71310 H3R PA 1720 92.186 137.508 26.779 1.00 0.00 H ATOM 71311 H3S PA 1720 92.092 139.247 26.635 1.00 0.00 H ATOM 71312 C12 PA 1720 90.235 138.275 27.018 1.00 0.00 C ATOM 71313 H2R PA 1720 89.673 138.992 27.620 1.00 0.00 H ATOM 71314 H2S PA 1720 89.818 137.299 27.278 1.00 0.00 H ATOM 71315 C11 PGR 1721 89.933 138.645 25.607 1.00 0.00 C ATOM 71316 O12 PGR 1721 89.570 139.755 25.289 1.00 0.00 O ATOM 71317 O11 PGR 1721 90.163 137.661 24.684 1.00 0.00 O ATOM 71318 C1 PGR 1721 90.329 138.024 23.310 1.00 0.00 C ATOM 71319 HR PGR 1721 89.637 138.779 22.928 1.00 0.00 H ATOM 71320 HS PGR 1721 90.185 137.082 22.776 1.00 0.00 H ATOM 71321 C2 PGR 1721 91.690 138.584 23.006 1.00 0.00 C ATOM 71322 HX PGR 1721 91.977 139.273 23.804 1.00 0.00 H ATOM 71323 C3 PGR 1721 91.752 139.314 21.629 1.00 0.00 C ATOM 71324 HA PGR 1721 92.713 139.803 21.446 1.00 0.00 H ATOM 71325 HB PGR 1721 90.992 140.096 21.700 1.00 0.00 H ATOM 71326 O31 PGR 1721 91.493 138.430 20.588 1.00 0.00 O ATOM 71327 P31 PGR 1721 91.337 138.836 19.026 1.00 0.00 P ATOM 71328 O32 PGR 1721 92.826 138.988 18.524 1.00 0.00 O ATOM 71329 C31 PGR 1721 93.737 137.925 18.660 1.00 0.00 C ATOM 71330 H1A PGR 1721 93.281 136.936 18.567 1.00 0.00 H ATOM 71331 H1B PGR 1721 94.119 137.897 19.684 1.00 0.00 H ATOM 71332 C32 PGR 1721 94.942 138.129 17.764 1.00 0.00 C ATOM 71333 H2A PGR 1721 95.317 139.155 17.806 1.00 0.00 H ATOM 71334 O35 PGR 1721 94.577 137.833 16.432 1.00 0.00 O ATOM 71335 HO5A PGR 1721 95.318 137.984 15.818 1.00 0.00 H ATOM 71336 C33 PGR 1721 96.162 137.324 18.108 1.00 0.00 C ATOM 71337 H3A PGR 1721 96.421 137.465 19.160 1.00 0.00 H ATOM 71338 H3B PGR 1721 95.776 136.331 17.864 1.00 0.00 H ATOM 71339 O33 PGR 1721 90.606 137.698 18.385 1.00 0.00 O ATOM 71340 O34 PGR 1721 90.716 140.188 18.983 1.00 0.00 O ATOM 71341 O21 PGR 1721 92.672 137.475 23.034 1.00 0.00 O ATOM 71342 C21 PGR 1721 93.914 137.756 23.386 1.00 0.00 C ATOM 71343 O22 PGR 1721 94.325 138.899 23.307 1.00 0.00 O ATOM 71344 O36 PGR 1721 97.237 137.616 17.174 1.00 0.00 O ATOM 71345 HO6A PGR 1721 98.032 137.097 17.389 1.00 0.00 H ATOM 71346 C12 OL 1722 94.676 136.646 23.915 1.00 0.00 C ATOM 71347 H2R OL 1722 94.078 135.732 23.897 1.00 0.00 H ATOM 71348 H2S OL 1722 95.446 136.453 23.164 1.00 0.00 H ATOM 71349 C13 OL 1722 95.114 136.882 25.312 1.00 0.00 C ATOM 71350 H3R OL 1722 95.997 137.525 25.323 1.00 0.00 H ATOM 71351 H3S OL 1722 94.408 137.398 25.966 1.00 0.00 H ATOM 71352 C14 OL 1722 95.652 135.554 25.925 1.00 0.00 C ATOM 71353 H4R OL 1722 94.990 134.738 25.628 1.00 0.00 H ATOM 71354 H4S OL 1722 96.617 135.262 25.505 1.00 0.00 H ATOM 71355 C15 OL 1722 95.865 135.643 27.410 1.00 0.00 C ATOM 71356 H5R OL 1722 96.426 136.541 27.679 1.00 0.00 H ATOM 71357 H5S OL 1722 94.907 135.642 27.934 1.00 0.00 H ATOM 71358 C16 OL 1722 96.784 134.583 27.984 1.00 0.00 C ATOM 71359 H6R OL 1722 96.439 133.599 27.659 1.00 0.00 H ATOM 71360 H6S OL 1722 97.814 134.733 27.654 1.00 0.00 H ATOM 71361 C17 OL 1722 96.863 134.659 29.485 1.00 0.00 C ATOM 71362 H7R OL 1722 97.671 135.325 29.795 1.00 0.00 H ATOM 71363 H7S OL 1722 95.949 135.069 29.920 1.00 0.00 H ATOM 71364 C18 OL 1722 97.076 133.247 30.111 1.00 0.00 C ATOM 71365 H8R OL 1722 98.098 132.866 30.051 1.00 0.00 H ATOM 71366 H8S OL 1722 97.072 133.497 31.174 1.00 0.00 H ATOM 71367 C19 OL 1722 96.161 132.087 29.940 1.00 0.00 C ATOM 71368 H9R OL 1722 95.230 132.432 29.498 1.00 0.00 H ATOM 71369 C110 OL 1722 96.484 130.824 29.976 1.00 0.00 C ATOM 71370 H10R OL 1722 95.742 130.176 29.517 1.00 0.00 H ATOM 71371 C111 OL 1722 97.604 130.310 30.784 1.00 0.00 C ATOM 71372 H11R OL 1722 98.206 129.621 30.189 1.00 0.00 H ATOM 71373 H11S OL 1722 98.300 131.074 31.136 1.00 0.00 H ATOM 71374 C112 OL 1722 97.012 129.509 31.872 1.00 0.00 C ATOM 71375 H12R OL 1722 96.271 130.149 32.355 1.00 0.00 H ATOM 71376 H12S OL 1722 96.526 128.629 31.445 1.00 0.00 H ATOM 71377 C113 OL 1722 98.075 129.108 32.857 1.00 0.00 C ATOM 71378 H13R OL 1722 98.996 128.654 32.487 1.00 0.00 H ATOM 71379 H13S OL 1722 98.375 130.078 33.260 1.00 0.00 H ATOM 71380 C114 OL 1722 97.490 128.126 33.802 1.00 0.00 C ATOM 71381 H14R OL 1722 96.724 128.620 34.402 1.00 0.00 H ATOM 71382 H14S OL 1722 97.039 127.415 33.107 1.00 0.00 H ATOM 71383 C115 OL 1722 98.557 127.380 34.665 1.00 0.00 C ATOM 71384 H15R OL 1722 98.066 126.742 35.403 1.00 0.00 H ATOM 71385 H15S OL 1722 99.146 126.700 34.046 1.00 0.00 H ATOM 71386 C116 OL 1722 99.402 128.345 35.578 1.00 0.00 C ATOM 71387 H16R OL 1722 100.055 128.924 34.923 1.00 0.00 H ATOM 71388 H16S OL 1722 98.657 128.934 36.116 1.00 0.00 H ATOM 71389 C117 OL 1722 100.264 127.608 36.600 1.00 0.00 C ATOM 71390 H17R OL 1722 99.652 126.810 37.026 1.00 0.00 H ATOM 71391 H17S OL 1722 101.060 127.121 36.034 1.00 0.00 H ATOM 71392 C118 OL 1722 100.872 128.393 37.636 1.00 0.00 C ATOM 71393 H18R OL 1722 101.329 129.273 37.179 1.00 0.00 H ATOM 71394 H18S OL 1722 101.659 127.890 38.201 1.00 0.00 H ATOM 71395 H18T OL 1722 100.129 128.779 38.338 1.00 0.00 H TER 71396 OL 1722 ATOM 71396 C116 PA 1723 64.229 121.951 37.619 1.00 0.00 C ATOM 71397 H16R PA 1723 65.205 122.436 37.544 1.00 0.00 H ATOM 71398 H16S PA 1723 64.454 120.941 37.968 1.00 0.00 H ATOM 71399 H16T PA 1723 63.611 122.461 38.361 1.00 0.00 H ATOM 71400 C115 PA 1723 63.345 121.728 36.420 1.00 0.00 C ATOM 71401 H15R PA 1723 63.040 122.736 36.133 1.00 0.00 H ATOM 71402 H15S PA 1723 62.524 121.055 36.679 1.00 0.00 H ATOM 71403 C114 PA 1723 64.040 121.073 35.180 1.00 0.00 C ATOM 71404 H14R PA 1723 64.436 120.069 35.351 1.00 0.00 H ATOM 71405 H14S PA 1723 64.905 121.699 34.950 1.00 0.00 H ATOM 71406 C113 PA 1723 63.129 121.020 33.922 1.00 0.00 C ATOM 71407 H13R PA 1723 62.704 122.015 33.779 1.00 0.00 H ATOM 71408 H13S PA 1723 62.375 120.263 34.149 1.00 0.00 H ATOM 71409 C112 PA 1723 63.870 120.633 32.677 1.00 0.00 C ATOM 71410 H12R PA 1723 64.386 119.724 32.992 1.00 0.00 H ATOM 71411 H12S PA 1723 64.593 121.427 32.477 1.00 0.00 H ATOM 71412 C111 PA 1723 62.732 120.445 31.602 1.00 0.00 C ATOM 71413 H11R PA 1723 61.933 121.182 31.708 1.00 0.00 H ATOM 71414 H11S PA 1723 62.287 119.480 31.853 1.00 0.00 H ATOM 71415 C110 PA 1723 63.334 120.320 30.170 1.00 0.00 C ATOM 71416 H10R PA 1723 64.098 119.540 30.152 1.00 0.00 H ATOM 71417 H10S PA 1723 63.794 121.274 29.903 1.00 0.00 H ATOM 71418 C19 PA 1723 62.324 119.931 29.108 1.00 0.00 C ATOM 71419 H9R PA 1723 61.438 120.533 29.320 1.00 0.00 H ATOM 71420 H9S PA 1723 62.135 118.868 29.273 1.00 0.00 H ATOM 71421 C18 PA 1723 62.839 120.200 27.703 1.00 0.00 C ATOM 71422 H8R PA 1723 63.121 121.229 27.469 1.00 0.00 H ATOM 71423 H8S PA 1723 62.009 120.016 27.016 1.00 0.00 H ATOM 71424 C17 PA 1723 63.937 119.132 27.269 1.00 0.00 C ATOM 71425 H7R PA 1723 63.504 118.132 27.196 1.00 0.00 H ATOM 71426 H7S PA 1723 64.748 119.201 27.996 1.00 0.00 H ATOM 71427 C16 PA 1723 64.584 119.492 25.935 1.00 0.00 C ATOM 71428 H6R PA 1723 65.604 119.106 25.988 1.00 0.00 H ATOM 71429 H6S PA 1723 64.855 120.546 26.021 1.00 0.00 H ATOM 71430 C15 PA 1723 63.783 119.182 24.728 1.00 0.00 C ATOM 71431 H5R PA 1723 64.243 119.841 23.989 1.00 0.00 H ATOM 71432 H5S PA 1723 62.819 119.691 24.663 1.00 0.00 H ATOM 71433 C14 PA 1723 63.560 117.751 24.478 1.00 0.00 C ATOM 71434 H4R PA 1723 62.990 117.345 25.316 1.00 0.00 H ATOM 71435 H4S PA 1723 64.538 117.277 24.579 1.00 0.00 H ATOM 71436 C13 PA 1723 62.930 117.387 23.205 1.00 0.00 C ATOM 71437 H3R PA 1723 63.545 117.639 22.339 1.00 0.00 H ATOM 71438 H3S PA 1723 62.029 117.985 23.050 1.00 0.00 H ATOM 71439 C12 PA 1723 62.627 115.933 23.262 1.00 0.00 C ATOM 71440 H2R PA 1723 61.839 115.709 23.984 1.00 0.00 H ATOM 71441 H2S PA 1723 63.457 115.298 23.579 1.00 0.00 H ATOM 71442 C11 PGR 1724 62.161 115.436 21.900 1.00 0.00 C ATOM 71443 O12 PGR 1724 61.910 116.177 20.971 1.00 0.00 O ATOM 71444 O11 PGR 1724 62.005 114.080 21.889 1.00 0.00 O ATOM 71445 C1 PGR 1724 61.789 113.415 20.601 1.00 0.00 C ATOM 71446 HR PGR 1724 62.215 113.946 19.746 1.00 0.00 H ATOM 71447 HS PGR 1724 60.721 113.225 20.467 1.00 0.00 H ATOM 71448 C2 PGR 1724 62.484 112.082 20.493 1.00 0.00 C ATOM 71449 HX PGR 1724 63.574 112.165 20.506 1.00 0.00 H ATOM 71450 C3 PGR 1724 62.142 111.405 19.088 1.00 0.00 C ATOM 71451 HA PGR 1724 62.506 110.376 19.158 1.00 0.00 H ATOM 71452 HB PGR 1724 62.796 111.888 18.357 1.00 0.00 H ATOM 71453 O31 PGR 1724 60.740 111.392 18.778 1.00 0.00 O ATOM 71454 P31 PGR 1724 60.148 111.154 17.352 1.00 0.00 P ATOM 71455 O32 PGR 1724 59.534 112.492 16.827 1.00 0.00 O ATOM 71456 C31 PGR 1724 60.208 113.696 16.895 1.00 0.00 C ATOM 71457 H1A PGR 1724 61.088 113.744 16.249 1.00 0.00 H ATOM 71458 H1B PGR 1724 60.769 113.805 17.827 1.00 0.00 H ATOM 71459 C32 PGR 1724 59.338 114.863 16.525 1.00 0.00 C ATOM 71460 H2A PGR 1724 58.424 114.892 17.124 1.00 0.00 H ATOM 71461 O35 PGR 1724 59.070 114.834 15.077 1.00 0.00 O ATOM 71462 HO5A PGR 1724 58.505 115.617 14.945 1.00 0.00 H ATOM 71463 C33 PGR 1724 60.088 116.141 16.711 1.00 0.00 C ATOM 71464 H3A PGR 1724 60.385 116.247 17.758 1.00 0.00 H ATOM 71465 H3B PGR 1724 60.991 116.133 16.095 1.00 0.00 H ATOM 71466 O33 PGR 1724 61.259 110.833 16.359 1.00 0.00 O ATOM 71467 O34 PGR 1724 58.977 110.171 17.538 1.00 0.00 O ATOM 71468 O21 PGR 1724 61.997 111.237 21.553 1.00 0.00 O ATOM 71469 C21 PGR 1724 62.480 109.975 21.718 1.00 0.00 C ATOM 71470 O22 PGR 1724 63.577 109.664 21.246 1.00 0.00 O ATOM 71471 O36 PGR 1724 59.326 117.357 16.421 1.00 0.00 O ATOM 71472 HO6A PGR 1724 59.957 118.069 16.213 1.00 0.00 H ATOM 71473 C12 OL 1725 61.526 109.084 22.446 1.00 0.00 C ATOM 71474 H2R OL 1725 61.113 109.823 23.137 1.00 0.00 H ATOM 71475 H2S OL 1725 60.762 108.775 21.730 1.00 0.00 H ATOM 71476 C13 OL 1725 62.240 107.840 22.997 1.00 0.00 C ATOM 71477 H3R OL 1725 62.547 107.204 22.164 1.00 0.00 H ATOM 71478 H3S OL 1725 63.044 108.357 23.524 1.00 0.00 H ATOM 71479 C14 OL 1725 61.434 107.076 24.025 1.00 0.00 C ATOM 71480 H4R OL 1725 62.042 106.185 24.196 1.00 0.00 H ATOM 71481 H4S OL 1725 61.442 107.606 24.981 1.00 0.00 H ATOM 71482 C15 OL 1725 59.915 106.769 23.588 1.00 0.00 C ATOM 71483 H5R OL 1725 59.470 107.766 23.559 1.00 0.00 H ATOM 71484 H5S OL 1725 59.819 106.283 22.615 1.00 0.00 H ATOM 71485 C16 OL 1725 59.104 105.923 24.512 1.00 0.00 C ATOM 71486 H6R OL 1725 58.888 106.483 25.425 1.00 0.00 H ATOM 71487 H6S OL 1725 58.175 105.763 23.960 1.00 0.00 H ATOM 71488 C17 OL 1725 59.655 104.487 24.640 1.00 0.00 C ATOM 71489 H7R OL 1725 59.872 103.955 23.712 1.00 0.00 H ATOM 71490 H7S OL 1725 60.591 104.585 25.193 1.00 0.00 H ATOM 71491 C18 OL 1725 58.815 103.586 25.485 1.00 0.00 C ATOM 71492 H8R OL 1725 58.518 104.224 26.320 1.00 0.00 H ATOM 71493 H8S OL 1725 57.889 103.424 24.930 1.00 0.00 H ATOM 71494 C19 OL 1725 59.315 102.287 26.035 1.00 0.00 C ATOM 71495 H9R OL 1725 58.844 101.364 25.705 1.00 0.00 H ATOM 71496 C110 OL 1725 60.181 102.211 27.052 1.00 0.00 C ATOM 71497 H10R OL 1725 60.361 101.178 27.339 1.00 0.00 H ATOM 71498 C111 OL 1725 61.120 103.234 27.570 1.00 0.00 C ATOM 71499 H11R OL 1725 62.138 102.953 27.291 1.00 0.00 H ATOM 71500 H11S OL 1725 60.961 104.218 27.123 1.00 0.00 H ATOM 71501 C112 OL 1725 60.942 103.441 29.017 1.00 0.00 C ATOM 71502 H12R OL 1725 61.570 104.252 29.394 1.00 0.00 H ATOM 71503 H12S OL 1725 59.932 103.821 29.183 1.00 0.00 H ATOM 71504 C113 OL 1725 61.242 102.299 29.854 1.00 0.00 C ATOM 71505 H13R OL 1725 60.577 101.461 29.634 1.00 0.00 H ATOM 71506 H13S OL 1725 62.252 101.948 29.635 1.00 0.00 H ATOM 71507 C114 OL 1725 61.097 102.626 31.348 1.00 0.00 C ATOM 71508 H14R OL 1725 60.137 103.123 31.499 1.00 0.00 H ATOM 71509 H14S OL 1725 60.934 101.651 31.811 1.00 0.00 H ATOM 71510 C115 OL 1725 62.214 103.395 31.924 1.00 0.00 C ATOM 71511 H15R OL 1725 62.312 104.299 31.319 1.00 0.00 H ATOM 71512 H15S OL 1725 61.977 103.627 32.965 1.00 0.00 H ATOM 71513 C116 OL 1725 63.574 102.596 31.976 1.00 0.00 C ATOM 71514 H16R OL 1725 63.884 102.482 30.935 1.00 0.00 H ATOM 71515 H16S OL 1725 64.344 103.175 32.490 1.00 0.00 H ATOM 71516 C117 OL 1725 63.410 101.208 32.547 1.00 0.00 C ATOM 71517 H17R OL 1725 62.995 101.425 33.534 1.00 0.00 H ATOM 71518 H17S OL 1725 62.815 100.548 31.912 1.00 0.00 H ATOM 71519 C118 OL 1725 64.863 100.726 32.791 1.00 0.00 C ATOM 71520 H18R OL 1725 65.315 100.525 31.818 1.00 0.00 H ATOM 71521 H18S OL 1725 64.918 99.844 33.431 1.00 0.00 H ATOM 71522 H18T OL 1725 65.432 101.487 33.329 1.00 0.00 H TER 71523 OL 1725 ATOM 71523 C116 PA 1726 33.183 122.015 31.294 1.00 0.00 C ATOM 71524 H16R PA 1726 32.927 122.227 32.334 1.00 0.00 H ATOM 71525 H16S PA 1726 34.176 121.561 31.282 1.00 0.00 H ATOM 71526 H16T PA 1726 32.451 121.261 30.997 1.00 0.00 H ATOM 71527 C115 PA 1726 33.145 123.295 30.496 1.00 0.00 C ATOM 71528 H15R PA 1726 33.078 123.037 29.437 1.00 0.00 H ATOM 71529 H15S PA 1726 34.042 123.887 30.686 1.00 0.00 H ATOM 71530 C114 PA 1726 31.825 124.091 30.751 1.00 0.00 C ATOM 71531 H14R PA 1726 31.907 124.325 31.815 1.00 0.00 H ATOM 71532 H14S PA 1726 30.905 123.504 30.723 1.00 0.00 H ATOM 71533 C113 PA 1726 31.543 125.318 29.951 1.00 0.00 C ATOM 71534 H13R PA 1726 31.327 125.083 28.907 1.00 0.00 H ATOM 71535 H13S PA 1726 32.414 125.976 29.936 1.00 0.00 H ATOM 71536 C112 PA 1726 30.417 126.188 30.451 1.00 0.00 C ATOM 71537 H12R PA 1726 30.547 126.369 31.519 1.00 0.00 H ATOM 71538 H12S PA 1726 29.453 125.686 30.339 1.00 0.00 H ATOM 71539 C111 PA 1726 30.360 127.645 29.752 1.00 0.00 C ATOM 71540 H11R PA 1726 30.109 127.624 28.689 1.00 0.00 H ATOM 71541 H11S PA 1726 31.355 128.088 29.680 1.00 0.00 H ATOM 71542 C110 PA 1726 29.567 128.784 30.447 1.00 0.00 C ATOM 71543 H10R PA 1726 29.650 129.672 29.817 1.00 0.00 H ATOM 71544 H10S PA 1726 30.139 129.188 31.285 1.00 0.00 H ATOM 71545 C19 PA 1726 28.107 128.532 30.839 1.00 0.00 C ATOM 71546 H9R PA 1726 27.997 127.709 31.549 1.00 0.00 H ATOM 71547 H9S PA 1726 27.612 128.213 29.919 1.00 0.00 H ATOM 71548 C18 PA 1726 27.393 129.685 31.571 1.00 0.00 C ATOM 71549 H8R PA 1726 27.502 130.485 30.836 1.00 0.00 H ATOM 71550 H8S PA 1726 27.910 130.067 32.454 1.00 0.00 H ATOM 71551 C17 PA 1726 26.047 129.406 32.101 1.00 0.00 C ATOM 71552 H7R PA 1726 25.627 130.407 32.219 1.00 0.00 H ATOM 71553 H7S PA 1726 26.110 128.801 33.007 1.00 0.00 H ATOM 71554 C16 PA 1726 25.006 128.712 31.228 1.00 0.00 C ATOM 71555 H6R PA 1726 25.527 127.802 30.924 1.00 0.00 H ATOM 71556 H6S PA 1726 24.867 129.416 30.405 1.00 0.00 H ATOM 71557 C15 PA 1726 23.702 128.382 31.948 1.00 0.00 C ATOM 71558 H5R PA 1726 23.162 129.323 32.075 1.00 0.00 H ATOM 71559 H5S PA 1726 23.891 128.060 32.974 1.00 0.00 H ATOM 71560 C14 PA 1726 22.583 127.676 31.111 1.00 0.00 C ATOM 71561 H4R PA 1726 21.767 127.335 31.753 1.00 0.00 H ATOM 71562 H4S PA 1726 23.094 126.839 30.631 1.00 0.00 H ATOM 71563 C13 PA 1726 22.065 128.582 30.011 1.00 0.00 C ATOM 71564 H3R PA 1726 22.888 129.129 29.547 1.00 0.00 H ATOM 71565 H3S PA 1726 21.327 129.277 30.418 1.00 0.00 H ATOM 71566 C12 PA 1726 21.269 127.829 28.913 1.00 0.00 C ATOM 71567 H2R PA 1726 20.403 127.425 29.441 1.00 0.00 H ATOM 71568 H2S PA 1726 21.844 127.015 28.466 1.00 0.00 H ATOM 71569 C11 PC 1727 20.721 128.698 27.863 1.00 0.00 C ATOM 71570 O12 PC 1727 20.497 129.925 28.038 1.00 0.00 O ATOM 71571 O11 PC 1727 20.287 128.126 26.717 1.00 0.00 O ATOM 71572 C1 PC 1727 19.746 128.804 25.568 1.00 0.00 C ATOM 71573 HR PC 1727 18.838 129.354 25.828 1.00 0.00 H ATOM 71574 HS PC 1727 19.520 128.050 24.809 1.00 0.00 H ATOM 71575 C2 PC 1727 20.703 129.821 24.973 1.00 0.00 C ATOM 71576 HX PC 1727 20.711 130.741 25.564 1.00 0.00 H ATOM 71577 C3 PC 1727 20.269 130.195 23.473 1.00 0.00 C ATOM 71578 HA PC 1727 20.984 130.883 23.014 1.00 0.00 H ATOM 71579 HB PC 1727 19.345 130.777 23.516 1.00 0.00 H ATOM 71580 O31 PC 1727 19.998 128.994 22.751 1.00 0.00 O ATOM 71581 P31 PC 1727 19.608 129.090 21.204 1.00 0.00 P ATOM 71582 O32 PC 1727 18.114 129.557 21.274 1.00 0.00 O ATOM 71583 C31 PC 1727 17.129 128.633 21.071 1.00 0.00 C ATOM 71584 H1A PC 1727 17.172 127.878 21.860 1.00 0.00 H ATOM 71585 H1B PC 1727 17.279 128.069 20.147 1.00 0.00 H ATOM 71586 C32 PC 1727 15.719 129.302 21.112 1.00 0.00 C ATOM 71587 H2A PC 1727 14.993 128.585 20.726 1.00 0.00 H ATOM 71588 H2B PC 1727 15.793 130.111 20.385 1.00 0.00 H ATOM 71589 N31 PC 1727 15.208 129.942 22.476 1.00 0.00 N ATOM 71590 C33 PC 1727 15.159 128.860 23.466 1.00 0.00 C ATOM 71591 H3A PC 1727 14.468 128.116 23.068 1.00 0.00 H ATOM 71592 H3B PC 1727 14.716 129.260 24.379 1.00 0.00 H ATOM 71593 H3C PC 1727 16.107 128.364 23.680 1.00 0.00 H ATOM 71594 C34 PC 1727 16.148 131.022 22.873 1.00 0.00 C ATOM 71595 H4A PC 1727 16.268 131.463 21.883 1.00 0.00 H ATOM 71596 H4B PC 1727 17.072 130.528 23.179 1.00 0.00 H ATOM 71597 H4C PC 1727 15.642 131.582 23.660 1.00 0.00 H ATOM 71598 C35 PC 1727 13.857 130.533 22.376 1.00 0.00 C ATOM 71599 H5A PC 1727 13.457 130.449 23.387 1.00 0.00 H ATOM 71600 H5B PC 1727 13.152 129.953 21.777 1.00 0.00 H ATOM 71601 H5C PC 1727 13.933 131.560 22.018 1.00 0.00 H ATOM 71602 O33 PC 1727 20.265 130.246 20.634 1.00 0.00 O ATOM 71603 O34 PC 1727 19.618 127.713 20.647 1.00 0.00 O ATOM 71604 O21 PC 1727 22.016 129.181 24.857 1.00 0.00 O ATOM 71605 C21 PC 1727 23.003 130.004 25.037 1.00 0.00 C ATOM 71606 O22 PC 1727 22.963 131.213 25.169 1.00 0.00 O ATOM 71607 C12 OL 1728 24.368 129.361 25.106 1.00 0.00 C ATOM 71608 H2R OL 1728 24.704 128.964 24.145 1.00 0.00 H ATOM 71609 H2S OL 1728 25.108 130.124 25.356 1.00 0.00 H ATOM 71610 C13 OL 1728 24.260 128.308 26.240 1.00 0.00 C ATOM 71611 H3R OL 1728 23.963 128.741 27.198 1.00 0.00 H ATOM 71612 H3S OL 1728 23.498 127.583 25.947 1.00 0.00 H ATOM 71613 C14 OL 1728 25.669 127.571 26.354 1.00 0.00 C ATOM 71614 H4R OL 1728 26.140 127.192 25.444 1.00 0.00 H ATOM 71615 H4S OL 1728 26.410 128.290 26.709 1.00 0.00 H ATOM 71616 C15 OL 1728 25.599 126.431 27.388 1.00 0.00 C ATOM 71617 H5R OL 1728 25.128 126.818 28.294 1.00 0.00 H ATOM 71618 H5S OL 1728 24.998 125.617 26.980 1.00 0.00 H ATOM 71619 C16 OL 1728 27.067 126.034 27.687 1.00 0.00 C ATOM 71620 H6R OL 1728 27.724 126.906 27.670 1.00 0.00 H ATOM 71621 H6S OL 1728 27.357 125.674 28.676 1.00 0.00 H ATOM 71622 C17 OL 1728 27.674 124.960 26.735 1.00 0.00 C ATOM 71623 H7R OL 1728 27.056 124.062 26.794 1.00 0.00 H ATOM 71624 H7S OL 1728 27.656 125.323 25.706 1.00 0.00 H ATOM 71625 C18 OL 1728 29.091 124.466 27.021 1.00 0.00 C ATOM 71626 H8R OL 1728 29.676 125.364 27.228 1.00 0.00 H ATOM 71627 H8S OL 1728 29.118 123.988 28.002 1.00 0.00 H ATOM 71628 C19 OL 1728 29.761 123.550 26.041 1.00 0.00 C ATOM 71629 H9R OL 1728 29.315 123.696 25.061 1.00 0.00 H ATOM 71630 C110 OL 1728 30.695 122.644 26.330 1.00 0.00 C ATOM 71631 H10R OL 1728 31.095 122.127 25.462 1.00 0.00 H ATOM 71632 C111 OL 1728 31.293 122.255 27.582 1.00 0.00 C ATOM 71633 H11R OL 1728 32.369 122.418 27.494 1.00 0.00 H ATOM 71634 H11S OL 1728 30.940 122.854 28.424 1.00 0.00 H ATOM 71635 C112 OL 1728 31.209 120.768 27.916 1.00 0.00 C ATOM 71636 H12R OL 1728 31.016 120.137 27.046 1.00 0.00 H ATOM 71637 H12S OL 1728 32.243 120.553 28.193 1.00 0.00 H ATOM 71638 C113 OL 1728 30.221 120.300 29.078 1.00 0.00 C ATOM 71639 H13R OL 1728 30.522 120.890 29.946 1.00 0.00 H ATOM 71640 H13S OL 1728 29.239 120.735 28.882 1.00 0.00 H ATOM 71641 C114 OL 1728 30.241 118.838 29.630 1.00 0.00 C ATOM 71642 H14R OL 1728 29.838 118.239 28.810 1.00 0.00 H ATOM 71643 H14S OL 1728 31.266 118.497 29.789 1.00 0.00 H ATOM 71644 C115 OL 1728 29.540 118.635 30.979 1.00 0.00 C ATOM 71645 H15R OL 1728 29.640 117.561 31.153 1.00 0.00 H ATOM 71646 H15S OL 1728 30.099 119.215 31.716 1.00 0.00 H ATOM 71647 C116 OL 1728 28.082 118.990 31.032 1.00 0.00 C ATOM 71648 H16R OL 1728 27.864 120.017 30.729 1.00 0.00 H ATOM 71649 H16S OL 1728 27.435 118.364 30.414 1.00 0.00 H ATOM 71650 C117 OL 1728 27.404 118.913 32.400 1.00 0.00 C ATOM 71651 H17R OL 1728 26.351 119.155 32.244 1.00 0.00 H ATOM 71652 H17S OL 1728 27.359 117.897 32.799 1.00 0.00 H ATOM 71653 C118 OL 1728 27.850 119.865 33.492 1.00 0.00 C ATOM 71654 H18R OL 1728 28.793 119.605 33.976 1.00 0.00 H ATOM 71655 H18S OL 1728 27.151 119.650 34.303 1.00 0.00 H ATOM 71656 H18T OL 1728 27.755 120.946 33.369 1.00 0.00 H TER 71657 OL 1728 ATOM 71657 C116 PA 1729 113.531 -0.805 43.918 1.00 0.00 C ATOM 71658 H16R PA 1729 113.884 -1.193 44.876 1.00 0.00 H ATOM 71659 H16S PA 1729 112.749 -1.459 43.526 1.00 0.00 H ATOM 71660 H16T PA 1729 113.112 0.197 44.031 1.00 0.00 H ATOM 71661 C115 PA 1729 114.675 -0.539 42.948 1.00 0.00 C ATOM 71662 H15R PA 1729 115.040 -1.534 42.684 1.00 0.00 H ATOM 71663 H15S PA 1729 115.440 -0.059 43.562 1.00 0.00 H ATOM 71664 C114 PA 1729 114.228 0.258 41.794 1.00 0.00 C ATOM 71665 H14R PA 1729 113.600 1.046 42.214 1.00 0.00 H ATOM 71666 H14S PA 1729 113.496 -0.372 41.284 1.00 0.00 H ATOM 71667 C113 PA 1729 115.347 0.881 40.827 1.00 0.00 C ATOM 71668 H13R PA 1729 115.891 1.661 41.363 1.00 0.00 H ATOM 71669 H13S PA 1729 114.789 1.401 40.045 1.00 0.00 H ATOM 71670 C112 PA 1729 116.212 -0.217 40.256 1.00 0.00 C ATOM 71671 H12R PA 1729 115.614 -1.024 39.828 1.00 0.00 H ATOM 71672 H12S PA 1729 116.786 -0.636 41.085 1.00 0.00 H ATOM 71673 C111 PA 1729 117.253 0.273 39.277 1.00 0.00 C ATOM 71674 H11R PA 1729 118.042 -0.480 39.239 1.00 0.00 H ATOM 71675 H11S PA 1729 117.714 1.092 39.833 1.00 0.00 H ATOM 71676 C110 PA 1729 116.706 0.565 37.869 1.00 0.00 C ATOM 71677 H10R PA 1729 115.811 1.191 37.877 1.00 0.00 H ATOM 71678 H10S PA 1729 116.354 -0.425 37.574 1.00 0.00 H ATOM 71679 C19 PA 1729 117.698 1.073 36.813 1.00 0.00 C ATOM 71680 H9R PA 1729 118.566 0.414 36.880 1.00 0.00 H ATOM 71681 H9S PA 1729 117.966 2.116 36.998 1.00 0.00 H ATOM 71682 C18 PA 1729 117.243 1.079 35.334 1.00 0.00 C ATOM 71683 H8R PA 1729 116.617 0.202 35.153 1.00 0.00 H ATOM 71684 H8S PA 1729 118.181 1.077 34.774 1.00 0.00 H ATOM 71685 C17 PA 1729 116.481 2.434 34.968 1.00 0.00 C ATOM 71686 H7R PA 1729 117.080 3.273 35.326 1.00 0.00 H ATOM 71687 H7S PA 1729 115.487 2.443 35.420 1.00 0.00 H ATOM 71688 C16 PA 1729 116.390 2.447 33.479 1.00 0.00 C ATOM 71689 H6R PA 1729 115.805 1.575 33.180 1.00 0.00 H ATOM 71690 H6S PA 1729 117.399 2.227 33.122 1.00 0.00 H ATOM 71691 C15 PA 1729 115.789 3.762 32.907 1.00 0.00 C ATOM 71692 H5R PA 1729 116.519 4.572 32.951 1.00 0.00 H ATOM 71693 H5S PA 1729 114.884 4.101 33.416 1.00 0.00 H ATOM 71694 C14 PA 1729 115.481 3.611 31.409 1.00 0.00 C ATOM 71695 H4R PA 1729 114.740 2.810 31.350 1.00 0.00 H ATOM 71696 H4S PA 1729 116.216 3.074 30.806 1.00 0.00 H ATOM 71697 C13 PA 1729 114.853 4.864 30.753 1.00 0.00 C ATOM 71698 H3R PA 1729 115.590 5.583 30.388 1.00 0.00 H ATOM 71699 H3S PA 1729 114.170 5.425 31.394 1.00 0.00 H ATOM 71700 C12 PA 1729 114.137 4.578 29.448 1.00 0.00 C ATOM 71701 H2R PA 1729 113.561 5.475 29.211 1.00 0.00 H ATOM 71702 H2S PA 1729 113.449 3.731 29.466 1.00 0.00 H ATOM 71703 C11 PC 1730 115.094 4.389 28.312 1.00 0.00 C ATOM 71704 O12 PC 1730 116.073 5.124 28.081 1.00 0.00 O ATOM 71705 O11 PC 1730 114.682 3.438 27.434 1.00 0.00 O ATOM 71706 C1 PC 1730 115.407 3.466 26.158 1.00 0.00 C ATOM 71707 HR PC 1730 115.512 2.437 25.804 1.00 0.00 H ATOM 71708 HS PC 1730 116.431 3.831 26.273 1.00 0.00 H ATOM 71709 C2 PC 1730 114.580 4.270 25.172 1.00 0.00 C ATOM 71710 HX PC 1730 113.568 3.859 25.128 1.00 0.00 H ATOM 71711 C3 PC 1730 115.175 4.247 23.786 1.00 0.00 C ATOM 71712 HA PC 1730 114.682 4.969 23.130 1.00 0.00 H ATOM 71713 HB PC 1730 115.147 3.209 23.446 1.00 0.00 H ATOM 71714 O31 PC 1730 116.493 4.767 23.732 1.00 0.00 O ATOM 71715 P31 PC 1730 117.345 4.682 22.454 1.00 0.00 P ATOM 71716 O32 PC 1730 116.710 5.796 21.505 1.00 0.00 O ATOM 71717 C31 PC 1730 116.972 7.159 21.651 1.00 0.00 C ATOM 71718 H1A PC 1730 118.059 7.272 21.666 1.00 0.00 H ATOM 71719 H1B PC 1730 116.652 7.625 22.586 1.00 0.00 H ATOM 71720 C32 PC 1730 116.171 7.922 20.563 1.00 0.00 C ATOM 71721 H2A PC 1730 116.234 8.975 20.841 1.00 0.00 H ATOM 71722 H2B PC 1730 115.142 7.561 20.548 1.00 0.00 H ATOM 71723 N31 PC 1730 116.820 7.840 19.188 1.00 0.00 N ATOM 71724 C33 PC 1730 117.140 6.426 18.761 1.00 0.00 C ATOM 71725 H3A PC 1730 117.897 6.120 19.485 1.00 0.00 H ATOM 71726 H3B PC 1730 117.614 6.434 17.778 1.00 0.00 H ATOM 71727 H3C PC 1730 116.245 5.804 18.699 1.00 0.00 H ATOM 71728 C34 PC 1730 115.984 8.363 18.059 1.00 0.00 C ATOM 71729 H4A PC 1730 115.573 9.354 18.258 1.00 0.00 H ATOM 71730 H4B PC 1730 115.076 7.764 17.969 1.00 0.00 H ATOM 71731 H4C PC 1730 116.496 8.274 17.100 1.00 0.00 H ATOM 71732 C35 PC 1730 118.137 8.525 19.141 1.00 0.00 C ATOM 71733 H5A PC 1730 118.653 8.414 18.187 1.00 0.00 H ATOM 71734 H5B PC 1730 118.898 8.178 19.841 1.00 0.00 H ATOM 71735 H5C PC 1730 117.992 9.601 19.247 1.00 0.00 H ATOM 71736 O33 PC 1730 118.686 5.035 22.929 1.00 0.00 O ATOM 71737 O34 PC 1730 117.102 3.368 21.900 1.00 0.00 O ATOM 71738 O21 PC 1730 114.508 5.665 25.712 1.00 0.00 O ATOM 71739 C21 PC 1730 113.789 6.626 25.093 1.00 0.00 C ATOM 71740 O22 PC 1730 113.145 6.411 24.123 1.00 0.00 O ATOM 71741 C12 OL 1731 113.805 7.824 25.929 1.00 0.00 C ATOM 71742 H2R OL 1731 114.808 7.978 26.333 1.00 0.00 H ATOM 71743 H2S OL 1731 113.554 8.705 25.335 1.00 0.00 H ATOM 71744 C13 OL 1731 112.763 7.718 27.011 1.00 0.00 C ATOM 71745 H3R OL 1731 112.778 6.832 27.650 1.00 0.00 H ATOM 71746 H3S OL 1731 113.115 8.492 27.698 1.00 0.00 H ATOM 71747 C14 OL 1731 111.356 8.114 26.388 1.00 0.00 C ATOM 71748 H4R OL 1731 111.183 9.160 26.127 1.00 0.00 H ATOM 71749 H4S OL 1731 111.217 7.557 25.460 1.00 0.00 H ATOM 71750 C15 OL 1731 110.140 7.791 27.206 1.00 0.00 C ATOM 71751 H5R OL 1731 109.968 8.530 27.992 1.00 0.00 H ATOM 71752 H5S OL 1731 109.312 7.826 26.496 1.00 0.00 H ATOM 71753 C16 OL 1731 110.074 6.461 27.896 1.00 0.00 C ATOM 71754 H6R OL 1731 110.770 6.484 28.737 1.00 0.00 H ATOM 71755 H6S OL 1731 109.143 6.315 28.448 1.00 0.00 H ATOM 71756 C17 OL 1731 110.231 5.336 26.825 1.00 0.00 C ATOM 71757 H7R OL 1731 109.573 5.571 25.986 1.00 0.00 H ATOM 71758 H7S OL 1731 111.166 5.350 26.262 1.00 0.00 H ATOM 71759 C18 OL 1731 109.931 3.926 27.331 1.00 0.00 C ATOM 71760 H8R OL 1731 110.566 3.602 28.158 1.00 0.00 H ATOM 71761 H8S OL 1731 108.884 3.879 27.639 1.00 0.00 H ATOM 71762 C19 OL 1731 110.023 2.988 26.176 1.00 0.00 C ATOM 71763 H9R OL 1731 109.442 3.348 25.331 1.00 0.00 H ATOM 71764 C110 OL 1731 110.486 1.694 26.150 1.00 0.00 C ATOM 71765 H10R OL 1731 110.463 1.213 25.175 1.00 0.00 H ATOM 71766 C111 OL 1731 111.081 0.929 27.300 1.00 0.00 C ATOM 71767 H11R OL 1731 111.271 1.610 28.133 1.00 0.00 H ATOM 71768 H11S OL 1731 110.501 0.055 27.603 1.00 0.00 H ATOM 71769 C112 OL 1731 112.443 0.338 26.839 1.00 0.00 C ATOM 71770 H12R OL 1731 112.279 0.059 25.796 1.00 0.00 H ATOM 71771 H12S OL 1731 113.251 1.072 26.827 1.00 0.00 H ATOM 71772 C113 OL 1731 112.976 -0.988 27.560 1.00 0.00 C ATOM 71773 H13R OL 1731 112.179 -1.711 27.375 1.00 0.00 H ATOM 71774 H13S OL 1731 113.789 -1.561 27.109 1.00 0.00 H ATOM 71775 C114 OL 1731 113.308 -0.703 29.020 1.00 0.00 C ATOM 71776 H14R OL 1731 112.441 -0.185 29.433 1.00 0.00 H ATOM 71777 H14S OL 1731 113.425 -1.623 29.597 1.00 0.00 H ATOM 71778 C115 OL 1731 114.528 0.271 29.153 1.00 0.00 C ATOM 71779 H15R OL 1731 114.272 1.297 28.877 1.00 0.00 H ATOM 71780 H15S OL 1731 114.748 0.327 30.221 1.00 0.00 H ATOM 71781 C116 OL 1731 115.825 -0.024 28.392 1.00 0.00 C ATOM 71782 H16R OL 1731 116.166 -1.039 28.610 1.00 0.00 H ATOM 71783 H16S OL 1731 115.788 0.154 27.316 1.00 0.00 H ATOM 71784 C117 OL 1731 116.984 0.856 28.740 1.00 0.00 C ATOM 71785 H17R OL 1731 116.711 1.858 28.401 1.00 0.00 H ATOM 71786 H17S OL 1731 117.150 0.928 29.817 1.00 0.00 H ATOM 71787 C118 OL 1731 118.157 0.532 27.960 1.00 0.00 C ATOM 71788 H18R OL 1731 119.007 1.155 28.247 1.00 0.00 H ATOM 71789 H18S OL 1731 117.839 0.837 26.961 1.00 0.00 H ATOM 71790 H18T OL 1731 118.454 -0.517 28.021 1.00 0.00 H TER 71791 OL 1731 ATOM 71791 C116 PA 1732 116.733 136.016 39.513 1.00 0.00 C ATOM 71792 H16R PA 1732 117.277 136.345 40.401 1.00 0.00 H ATOM 71793 H16S PA 1732 116.897 134.938 39.459 1.00 0.00 H ATOM 71794 H16T PA 1732 115.665 136.122 39.713 1.00 0.00 H ATOM 71795 C115 PA 1732 117.128 136.663 38.198 1.00 0.00 C ATOM 71796 H15R PA 1732 118.162 136.337 38.065 1.00 0.00 H ATOM 71797 H15S PA 1732 117.108 137.729 38.436 1.00 0.00 H ATOM 71798 C114 PA 1732 116.407 136.346 36.918 1.00 0.00 C ATOM 71799 H14R PA 1732 116.586 136.985 36.050 1.00 0.00 H ATOM 71800 H14S PA 1732 115.321 136.260 36.996 1.00 0.00 H ATOM 71801 C113 PA 1732 116.739 134.929 36.319 1.00 0.00 C ATOM 71802 H13R PA 1732 116.488 134.253 37.140 1.00 0.00 H ATOM 71803 H13S PA 1732 117.821 134.982 36.176 1.00 0.00 H ATOM 71804 C112 PA 1732 115.993 134.622 35.024 1.00 0.00 C ATOM 71805 H12R PA 1732 115.977 135.550 34.449 1.00 0.00 H ATOM 71806 H12S PA 1732 114.945 134.448 35.278 1.00 0.00 H ATOM 71807 C111 PA 1732 116.552 133.530 34.243 1.00 0.00 C ATOM 71808 H11R PA 1732 116.480 132.622 34.846 1.00 0.00 H ATOM 71809 H11S PA 1732 117.618 133.757 34.174 1.00 0.00 H ATOM 71810 C110 PA 1732 115.873 133.332 32.900 1.00 0.00 C ATOM 71811 H10R PA 1732 115.964 134.183 32.222 1.00 0.00 H ATOM 71812 H10S PA 1732 114.787 133.256 32.981 1.00 0.00 H ATOM 71813 C19 PA 1732 116.504 132.115 32.138 1.00 0.00 C ATOM 71814 H9R PA 1732 117.567 132.079 32.388 1.00 0.00 H ATOM 71815 H9S PA 1732 116.382 132.337 31.076 1.00 0.00 H ATOM 71816 C18 PA 1732 115.716 130.758 32.429 1.00 0.00 C ATOM 71817 H8R PA 1732 114.841 130.556 31.809 1.00 0.00 H ATOM 71818 H8S PA 1732 115.419 130.954 33.462 1.00 0.00 H ATOM 71819 C17 PA 1732 116.588 129.451 32.588 1.00 0.00 C ATOM 71820 H7R PA 1732 115.951 128.628 32.919 1.00 0.00 H ATOM 71821 H7S PA 1732 117.332 129.519 33.384 1.00 0.00 H ATOM 71822 C16 PA 1732 117.216 129.033 31.360 1.00 0.00 C ATOM 71823 H6R PA 1732 117.907 128.227 31.617 1.00 0.00 H ATOM 71824 H6S PA 1732 117.857 129.824 30.964 1.00 0.00 H ATOM 71825 C15 PA 1732 116.217 128.464 30.296 1.00 0.00 C ATOM 71826 H5R PA 1732 115.396 129.170 30.153 1.00 0.00 H ATOM 71827 H5S PA 1732 115.791 127.526 30.659 1.00 0.00 H ATOM 71828 C14 PA 1732 116.957 128.216 28.936 1.00 0.00 C ATOM 71829 H4R PA 1732 117.815 127.548 29.043 1.00 0.00 H ATOM 71830 H4S PA 1732 117.382 129.162 28.593 1.00 0.00 H ATOM 71831 C13 PA 1732 116.166 127.514 27.845 1.00 0.00 C ATOM 71832 H3R PA 1732 116.852 127.370 27.009 1.00 0.00 H ATOM 71833 H3S PA 1732 115.345 128.090 27.412 1.00 0.00 H ATOM 71834 C12 PA 1732 115.548 126.184 28.235 1.00 0.00 C ATOM 71835 H2R PA 1732 114.935 126.320 29.128 1.00 0.00 H ATOM 71836 H2S PA 1732 116.284 125.414 28.476 1.00 0.00 H ATOM 71837 C11 PGR 1733 114.716 125.735 27.046 1.00 0.00 C ATOM 71838 O12 PGR 1733 114.719 126.254 25.935 1.00 0.00 O ATOM 71839 O11 PGR 1733 114.002 124.643 27.383 1.00 0.00 O ATOM 71840 C1 PGR 1733 113.419 123.928 26.299 1.00 0.00 C ATOM 71841 HR PGR 1733 112.923 124.594 25.588 1.00 0.00 H ATOM 71842 HS PGR 1733 112.723 123.175 26.675 1.00 0.00 H ATOM 71843 C2 PGR 1733 114.597 123.209 25.573 1.00 0.00 C ATOM 71844 HX PGR 1733 115.490 123.839 25.546 1.00 0.00 H ATOM 71845 C3 PGR 1733 114.233 122.583 24.242 1.00 0.00 C ATOM 71846 HA PGR 1733 113.295 123.006 23.875 1.00 0.00 H ATOM 71847 HB PGR 1733 114.225 121.505 24.425 1.00 0.00 H ATOM 71848 O31 PGR 1733 115.247 122.933 23.289 1.00 0.00 O ATOM 71849 P31 PGR 1733 115.283 122.156 21.885 1.00 0.00 P ATOM 71850 O32 PGR 1733 113.905 122.553 21.286 1.00 0.00 O ATOM 71851 C31 PGR 1733 113.721 123.351 20.135 1.00 0.00 C ATOM 71852 H1A PGR 1733 114.169 122.959 19.218 1.00 0.00 H ATOM 71853 H1B PGR 1733 114.113 124.344 20.369 1.00 0.00 H ATOM 71854 C32 PGR 1733 112.240 123.598 19.895 1.00 0.00 C ATOM 71855 H2A PGR 1733 111.786 124.194 20.691 1.00 0.00 H ATOM 71856 O35 PGR 1733 111.570 122.298 19.769 1.00 0.00 O ATOM 71857 HO5A PGR 1733 111.801 121.924 20.639 1.00 0.00 H ATOM 71858 C33 PGR 1733 112.112 124.459 18.561 1.00 0.00 C ATOM 71859 H3A PGR 1733 111.079 124.816 18.544 1.00 0.00 H ATOM 71860 H3B PGR 1733 112.740 125.346 18.682 1.00 0.00 H ATOM 71861 O33 PGR 1733 116.317 122.823 21.085 1.00 0.00 O ATOM 71862 O34 PGR 1733 115.355 120.687 22.198 1.00 0.00 O ATOM 71863 O21 PGR 1733 115.129 122.114 26.373 1.00 0.00 O ATOM 71864 C21 PGR 1733 116.349 121.608 26.298 1.00 0.00 C ATOM 71865 O22 PGR 1733 117.205 122.031 25.567 1.00 0.00 O ATOM 71866 O36 PGR 1733 112.401 123.620 17.380 1.00 0.00 O ATOM 71867 HO6A PGR 1733 112.077 124.209 16.676 1.00 0.00 H ATOM 71868 C12 OL 1734 116.620 120.543 27.367 1.00 0.00 C ATOM 71869 H2R OL 1734 115.630 120.167 27.633 1.00 0.00 H ATOM 71870 H2S OL 1734 117.221 119.787 26.857 1.00 0.00 H ATOM 71871 C13 OL 1734 117.411 121.045 28.574 1.00 0.00 C ATOM 71872 H3R OL 1734 117.953 120.216 29.034 1.00 0.00 H ATOM 71873 H3S OL 1734 118.229 121.663 28.199 1.00 0.00 H ATOM 71874 C14 OL 1734 116.442 121.737 29.531 1.00 0.00 C ATOM 71875 H4R OL 1734 116.113 122.575 28.913 1.00 0.00 H ATOM 71876 H4S OL 1734 115.626 121.034 29.711 1.00 0.00 H ATOM 71877 C15 OL 1734 116.968 122.172 30.852 1.00 0.00 C ATOM 71878 H5R OL 1734 117.745 121.416 30.980 1.00 0.00 H ATOM 71879 H5S OL 1734 117.366 123.188 30.881 1.00 0.00 H ATOM 71880 C16 OL 1734 116.063 121.935 32.083 1.00 0.00 C ATOM 71881 H6R OL 1734 115.155 122.523 31.933 1.00 0.00 H ATOM 71882 H6S OL 1734 115.901 120.861 32.199 1.00 0.00 H ATOM 71883 C17 OL 1734 116.714 122.494 33.372 1.00 0.00 C ATOM 71884 H7R OL 1734 116.868 123.575 33.387 1.00 0.00 H ATOM 71885 H7S OL 1734 116.004 122.298 34.178 1.00 0.00 H ATOM 71886 C18 OL 1734 118.034 121.809 33.774 1.00 0.00 C ATOM 71887 H8R OL 1734 118.052 120.729 33.610 1.00 0.00 H ATOM 71888 H8S OL 1734 118.915 122.250 33.302 1.00 0.00 H ATOM 71889 C19 OL 1734 118.343 121.954 35.216 1.00 0.00 C ATOM 71890 H9R OL 1734 118.434 121.025 35.773 1.00 0.00 H ATOM 71891 C110 OL 1734 118.623 123.137 35.872 1.00 0.00 C ATOM 71892 H10R OL 1734 118.946 123.103 36.909 1.00 0.00 H ATOM 71893 C111 OL 1734 118.542 124.550 35.386 1.00 0.00 C ATOM 71894 H11R OL 1734 118.581 124.760 34.316 1.00 0.00 H ATOM 71895 H11S OL 1734 117.586 124.924 35.759 1.00 0.00 H ATOM 71896 C112 OL 1734 119.500 125.443 36.155 1.00 0.00 C ATOM 71897 H12R OL 1734 119.431 125.508 37.242 1.00 0.00 H ATOM 71898 H12S OL 1734 120.462 125.010 35.873 1.00 0.00 H ATOM 71899 C113 OL 1734 119.536 126.961 35.644 1.00 0.00 C ATOM 71900 H13R OL 1734 119.841 126.807 34.607 1.00 0.00 H ATOM 71901 H13S OL 1734 118.508 127.329 35.642 1.00 0.00 H ATOM 71902 C114 OL 1734 120.369 127.869 36.484 1.00 0.00 C ATOM 71903 H14R OL 1734 120.036 127.729 37.515 1.00 0.00 H ATOM 71904 H14S OL 1734 121.426 127.616 36.383 1.00 0.00 H ATOM 71905 C115 OL 1734 120.016 129.351 36.075 1.00 0.00 C ATOM 71906 H15R OL 1734 120.453 129.572 35.098 1.00 0.00 H ATOM 71907 H15S OL 1734 118.951 129.584 36.012 1.00 0.00 H ATOM 71908 C116 OL 1734 120.612 130.375 37.034 1.00 0.00 C ATOM 71909 H16R OL 1734 120.134 130.226 38.004 1.00 0.00 H ATOM 71910 H16S OL 1734 121.692 130.224 37.096 1.00 0.00 H ATOM 71911 C117 OL 1734 120.127 131.855 36.757 1.00 0.00 C ATOM 71912 H17R OL 1734 119.073 131.913 37.035 1.00 0.00 H ATOM 71913 H17S OL 1734 120.688 132.489 37.447 1.00 0.00 H ATOM 71914 C118 OL 1734 120.523 132.286 35.439 1.00 0.00 C ATOM 71915 H18R OL 1734 120.229 131.696 34.568 1.00 0.00 H ATOM 71916 H18S OL 1734 121.596 132.486 35.424 1.00 0.00 H ATOM 71917 H18T OL 1734 120.043 133.252 35.268 1.00 0.00 H TER 71918 OL 1734 ATOM 71918 C116 PA 1735 124.880 61.339 40.134 1.00 0.00 C ATOM 71919 H16R PA 1735 123.965 60.817 39.846 1.00 0.00 H ATOM 71920 H16S PA 1735 124.629 61.866 41.057 1.00 0.00 H ATOM 71921 H16T PA 1735 125.663 60.619 40.379 1.00 0.00 H ATOM 71922 C115 PA 1735 125.481 62.302 39.002 1.00 0.00 C ATOM 71923 H15R PA 1735 125.665 61.653 38.143 1.00 0.00 H ATOM 71924 H15S PA 1735 126.440 62.779 39.214 1.00 0.00 H ATOM 71925 C114 PA 1735 124.426 63.388 38.513 1.00 0.00 C ATOM 71926 H14R PA 1735 124.491 64.248 39.182 1.00 0.00 H ATOM 71927 H14S PA 1735 123.372 63.104 38.541 1.00 0.00 H ATOM 71928 C113 PA 1735 124.766 63.966 37.097 1.00 0.00 C ATOM 71929 H13R PA 1735 125.732 64.475 37.122 1.00 0.00 H ATOM 71930 H13S PA 1735 123.986 64.725 37.001 1.00 0.00 H ATOM 71931 C112 PA 1735 124.624 62.982 35.844 1.00 0.00 C ATOM 71932 H12R PA 1735 124.163 62.033 36.128 1.00 0.00 H ATOM 71933 H12S PA 1735 125.602 62.670 35.472 1.00 0.00 H ATOM 71934 C111 PA 1735 123.788 63.632 34.662 1.00 0.00 C ATOM 71935 H11R PA 1735 124.251 64.522 34.230 1.00 0.00 H ATOM 71936 H11S PA 1735 122.813 63.986 35.004 1.00 0.00 H ATOM 71937 C110 PA 1735 123.404 62.760 33.422 1.00 0.00 C ATOM 71938 H10R PA 1735 122.841 63.310 32.665 1.00 0.00 H ATOM 71939 H10S PA 1735 122.684 61.998 33.731 1.00 0.00 H ATOM 71940 C19 PA 1735 124.563 62.076 32.742 1.00 0.00 C ATOM 71941 H9R PA 1735 124.957 61.273 33.368 1.00 0.00 H ATOM 71942 H9S PA 1735 125.440 62.719 32.643 1.00 0.00 H ATOM 71943 C18 PA 1735 124.284 61.415 31.372 1.00 0.00 C ATOM 71944 H8R PA 1735 124.192 62.190 30.609 1.00 0.00 H ATOM 71945 H8S PA 1735 123.338 60.872 31.423 1.00 0.00 H ATOM 71946 C17 PA 1735 125.471 60.535 30.947 1.00 0.00 C ATOM 71947 H7R PA 1735 125.697 59.834 31.754 1.00 0.00 H ATOM 71948 H7S PA 1735 126.378 61.117 30.771 1.00 0.00 H ATOM 71949 C16 PA 1735 125.231 59.681 29.733 1.00 0.00 C ATOM 71950 H6R PA 1735 125.183 60.326 28.854 1.00 0.00 H ATOM 71951 H6S PA 1735 124.286 59.142 29.835 1.00 0.00 H ATOM 71952 C15 PA 1735 126.316 58.664 29.497 1.00 0.00 C ATOM 71953 H5R PA 1735 126.346 57.951 30.324 1.00 0.00 H ATOM 71954 H5S PA 1735 127.284 59.168 29.456 1.00 0.00 H ATOM 71955 C14 PA 1735 126.214 57.929 28.127 1.00 0.00 C ATOM 71956 H4R PA 1735 126.093 58.547 27.235 1.00 0.00 H ATOM 71957 H4S PA 1735 125.264 57.390 28.102 1.00 0.00 H ATOM 71958 C13 PA 1735 127.393 56.915 27.985 1.00 0.00 C ATOM 71959 H3R PA 1735 127.359 56.272 28.867 1.00 0.00 H ATOM 71960 H3S PA 1735 128.352 57.427 28.086 1.00 0.00 H ATOM 71961 C12 PA 1735 127.279 55.890 26.827 1.00 0.00 C ATOM 71962 H2R PA 1735 126.827 56.401 25.974 1.00 0.00 H ATOM 71963 H2S PA 1735 126.487 55.166 27.029 1.00 0.00 H ATOM 71964 C11 PC 1736 128.583 55.266 26.383 1.00 0.00 C ATOM 71965 O12 PC 1736 129.581 55.838 26.649 1.00 0.00 O ATOM 71966 O11 PC 1736 128.419 54.048 25.816 1.00 0.00 O ATOM 71967 C1 PC 1736 129.610 53.379 25.391 1.00 0.00 C ATOM 71968 HR PC 1736 130.237 53.147 26.255 1.00 0.00 H ATOM 71969 HS PC 1736 130.216 54.107 24.845 1.00 0.00 H ATOM 71970 C2 PC 1736 129.264 52.095 24.637 1.00 0.00 C ATOM 71971 HX PC 1736 130.231 51.606 24.494 1.00 0.00 H ATOM 71972 C3 PC 1736 128.533 52.482 23.378 1.00 0.00 C ATOM 71973 HA PC 1736 129.169 53.220 22.883 1.00 0.00 H ATOM 71974 HB PC 1736 127.536 52.887 23.569 1.00 0.00 H ATOM 71975 O31 PC 1736 128.486 51.290 22.566 1.00 0.00 O ATOM 71976 P31 PC 1736 127.931 51.237 21.099 1.00 0.00 P ATOM 71977 O32 PC 1736 126.497 51.788 21.290 1.00 0.00 O ATOM 71978 C31 PC 1736 125.506 51.068 21.920 1.00 0.00 C ATOM 71979 H1A PC 1736 125.892 50.703 22.876 1.00 0.00 H ATOM 71980 H1B PC 1736 125.365 50.196 21.276 1.00 0.00 H ATOM 71981 C32 PC 1736 124.267 52.005 21.971 1.00 0.00 C ATOM 71982 H2A PC 1736 124.556 52.824 22.630 1.00 0.00 H ATOM 71983 H2B PC 1736 123.447 51.496 22.479 1.00 0.00 H ATOM 71984 N31 PC 1736 123.621 52.421 20.694 1.00 0.00 N ATOM 71985 C33 PC 1736 122.520 53.307 21.167 1.00 0.00 C ATOM 71986 H3A PC 1736 122.201 53.965 20.357 1.00 0.00 H ATOM 71987 H3B PC 1736 122.964 53.878 21.983 1.00 0.00 H ATOM 71988 H3C PC 1736 121.626 52.726 21.401 1.00 0.00 H ATOM 71989 C34 PC 1736 124.527 53.356 19.929 1.00 0.00 C ATOM 71990 H4A PC 1736 124.945 53.987 20.714 1.00 0.00 H ATOM 71991 H4B PC 1736 123.909 53.830 19.165 1.00 0.00 H ATOM 71992 H4C PC 1736 125.333 52.762 19.495 1.00 0.00 H ATOM 71993 C35 PC 1736 123.060 51.388 19.834 1.00 0.00 C ATOM 71994 H5A PC 1736 123.872 50.922 19.274 1.00 0.00 H ATOM 71995 H5B PC 1736 122.476 51.872 19.050 1.00 0.00 H ATOM 71996 H5C PC 1736 122.376 50.721 20.362 1.00 0.00 H ATOM 71997 O33 PC 1736 128.645 52.271 20.360 1.00 0.00 O ATOM 71998 O34 PC 1736 127.995 49.822 20.692 1.00 0.00 O ATOM 71999 O21 PC 1736 128.461 51.210 25.541 1.00 0.00 O ATOM 72000 C21 PC 1736 128.476 49.891 25.281 1.00 0.00 C ATOM 72001 O22 PC 1736 129.253 49.364 24.564 1.00 0.00 O ATOM 72002 C12 OL 1737 127.492 49.155 26.154 1.00 0.00 C ATOM 72003 H2R OL 1737 126.676 49.793 26.500 1.00 0.00 H ATOM 72004 H2S OL 1737 127.100 48.411 25.457 1.00 0.00 H ATOM 72005 C13 OL 1737 128.114 48.396 27.272 1.00 0.00 C ATOM 72006 H3R OL 1737 128.860 47.762 26.788 1.00 0.00 H ATOM 72007 H3S OL 1737 128.671 49.189 27.774 1.00 0.00 H ATOM 72008 C14 OL 1737 127.161 47.400 28.041 1.00 0.00 C ATOM 72009 H4R OL 1737 126.548 46.909 27.283 1.00 0.00 H ATOM 72010 H4S OL 1737 127.724 46.664 28.618 1.00 0.00 H ATOM 72011 C15 OL 1737 126.425 48.118 29.137 1.00 0.00 C ATOM 72012 H5R OL 1737 127.095 48.407 29.950 1.00 0.00 H ATOM 72013 H5S OL 1737 125.940 49.061 28.878 1.00 0.00 H ATOM 72014 C16 OL 1737 125.310 47.184 29.639 1.00 0.00 C ATOM 72015 H6R OL 1737 124.772 47.846 30.321 1.00 0.00 H ATOM 72016 H6S OL 1737 124.697 47.050 28.745 1.00 0.00 H ATOM 72017 C17 OL 1737 125.797 45.859 30.186 1.00 0.00 C ATOM 72018 H7R OL 1737 126.035 45.216 29.335 1.00 0.00 H ATOM 72019 H7S OL 1737 126.776 45.998 30.649 1.00 0.00 H ATOM 72020 C18 OL 1737 124.963 45.070 31.117 1.00 0.00 C ATOM 72021 H8R OL 1737 125.430 44.102 31.313 1.00 0.00 H ATOM 72022 H8S OL 1737 124.867 45.610 32.061 1.00 0.00 H ATOM 72023 C19 OL 1737 123.672 44.861 30.485 1.00 0.00 C ATOM 72024 H9R OL 1737 123.796 44.218 29.618 1.00 0.00 H ATOM 72025 C110 OL 1737 122.494 45.286 30.965 1.00 0.00 C ATOM 72026 H10R OL 1737 121.591 44.989 30.437 1.00 0.00 H ATOM 72027 C111 OL 1737 122.261 46.195 32.098 1.00 0.00 C ATOM 72028 H11R OL 1737 121.582 45.721 32.809 1.00 0.00 H ATOM 72029 H11S OL 1737 123.063 46.309 32.831 1.00 0.00 H ATOM 72030 C112 OL 1737 121.667 47.499 31.543 1.00 0.00 C ATOM 72031 H12R OL 1737 122.331 47.945 30.800 1.00 0.00 H ATOM 72032 H12S OL 1737 120.721 47.292 31.038 1.00 0.00 H ATOM 72033 C113 OL 1737 121.331 48.490 32.673 1.00 0.00 C ATOM 72034 H13R OL 1737 122.220 48.713 33.267 1.00 0.00 H ATOM 72035 H13S OL 1737 121.094 49.446 32.202 1.00 0.00 H ATOM 72036 C114 OL 1737 120.235 48.105 33.631 1.00 0.00 C ATOM 72037 H14R OL 1737 119.347 47.811 33.067 1.00 0.00 H ATOM 72038 H14S OL 1737 120.488 47.237 34.244 1.00 0.00 H ATOM 72039 C115 OL 1737 119.925 49.150 34.667 1.00 0.00 C ATOM 72040 H15R OL 1737 120.848 49.579 35.063 1.00 0.00 H ATOM 72041 H15S OL 1737 119.392 50.006 34.250 1.00 0.00 H ATOM 72042 C116 OL 1737 119.079 48.536 35.791 1.00 0.00 C ATOM 72043 H16R OL 1737 118.705 49.424 36.305 1.00 0.00 H ATOM 72044 H16S OL 1737 118.287 47.956 35.313 1.00 0.00 H ATOM 72045 C117 OL 1737 119.926 47.727 36.754 1.00 0.00 C ATOM 72046 H17R OL 1737 120.479 46.950 36.223 1.00 0.00 H ATOM 72047 H17S OL 1737 120.590 48.427 37.264 1.00 0.00 H ATOM 72048 C118 OL 1737 119.020 47.200 37.878 1.00 0.00 C ATOM 72049 H18R OL 1737 118.145 46.649 37.528 1.00 0.00 H ATOM 72050 H18S OL 1737 118.482 47.865 38.556 1.00 0.00 H ATOM 72051 H18T OL 1737 119.501 46.542 38.605 1.00 0.00 H TER 72052 OL 1737 ATOM 72052 C116 PA 1738 127.048 19.689 30.415 1.00 0.00 C ATOM 72053 H16R PA 1738 127.002 20.532 29.721 1.00 0.00 H ATOM 72054 H16S PA 1738 126.250 19.892 31.132 1.00 0.00 H ATOM 72055 H16T PA 1738 126.708 18.786 29.904 1.00 0.00 H ATOM 72056 C115 PA 1738 128.339 19.450 31.154 1.00 0.00 C ATOM 72057 H15R PA 1738 128.314 20.227 31.921 1.00 0.00 H ATOM 72058 H15S PA 1738 129.140 19.727 30.465 1.00 0.00 H ATOM 72059 C114 PA 1738 128.596 18.059 31.771 1.00 0.00 C ATOM 72060 H14R PA 1738 128.679 17.383 30.918 1.00 0.00 H ATOM 72061 H14S PA 1738 127.785 17.764 32.440 1.00 0.00 H ATOM 72062 C113 PA 1738 129.956 18.001 32.536 1.00 0.00 C ATOM 72063 H13R PA 1738 129.933 18.821 33.257 1.00 0.00 H ATOM 72064 H13S PA 1738 130.759 18.114 31.804 1.00 0.00 H ATOM 72065 C112 PA 1738 130.062 16.671 33.236 1.00 0.00 C ATOM 72066 H12R PA 1738 129.256 16.496 33.952 1.00 0.00 H ATOM 72067 H12S PA 1738 130.930 16.586 33.893 1.00 0.00 H ATOM 72068 C111 PA 1738 130.326 15.434 32.352 1.00 0.00 C ATOM 72069 H11R PA 1738 129.477 15.253 31.690 1.00 0.00 H ATOM 72070 H11S PA 1738 130.357 14.547 32.989 1.00 0.00 H ATOM 72071 C110 PA 1738 131.589 15.569 31.415 1.00 0.00 C ATOM 72072 H10R PA 1738 132.439 15.887 32.022 1.00 0.00 H ATOM 72073 H10S PA 1738 131.583 16.473 30.803 1.00 0.00 H ATOM 72074 C19 PA 1738 131.891 14.348 30.460 1.00 0.00 C ATOM 72075 H9R PA 1738 132.247 13.516 31.071 1.00 0.00 H ATOM 72076 H9S PA 1738 132.730 14.544 29.790 1.00 0.00 H ATOM 72077 C18 PA 1738 130.682 13.878 29.674 1.00 0.00 C ATOM 72078 H8R PA 1738 129.928 13.491 30.363 1.00 0.00 H ATOM 72079 H8S PA 1738 131.011 13.072 29.015 1.00 0.00 H ATOM 72080 C17 PA 1738 130.055 15.011 28.925 1.00 0.00 C ATOM 72081 H7R PA 1738 129.664 15.822 29.543 1.00 0.00 H ATOM 72082 H7S PA 1738 129.130 14.552 28.571 1.00 0.00 H ATOM 72083 C16 PA 1738 130.819 15.567 27.755 1.00 0.00 C ATOM 72084 H6R PA 1738 130.892 14.701 27.093 1.00 0.00 H ATOM 72085 H6S PA 1738 131.802 15.974 28.001 1.00 0.00 H ATOM 72086 C15 PA 1738 130.115 16.612 26.915 1.00 0.00 C ATOM 72087 H5R PA 1738 129.303 16.122 26.372 1.00 0.00 H ATOM 72088 H5S PA 1738 130.719 17.066 26.126 1.00 0.00 H ATOM 72089 C14 PA 1738 129.579 17.772 27.750 1.00 0.00 C ATOM 72090 H4R PA 1738 130.208 17.901 28.633 1.00 0.00 H ATOM 72091 H4S PA 1738 128.625 17.475 28.191 1.00 0.00 H ATOM 72092 C13 PA 1738 129.395 19.126 27.098 1.00 0.00 C ATOM 72093 H3R PA 1738 130.117 19.428 26.336 1.00 0.00 H ATOM 72094 H3S PA 1738 129.548 19.878 27.875 1.00 0.00 H ATOM 72095 C12 PA 1738 128.059 19.228 26.405 1.00 0.00 C ATOM 72096 H2R PA 1738 127.937 20.242 26.021 1.00 0.00 H ATOM 72097 H2S PA 1738 127.210 18.923 27.021 1.00 0.00 H ATOM 72098 C11 PC 1739 128.035 18.391 25.140 1.00 0.00 C ATOM 72099 O12 PC 1739 127.081 17.719 24.858 1.00 0.00 O ATOM 72100 O11 PC 1739 129.104 18.542 24.333 1.00 0.00 O ATOM 72101 C1 PC 1739 129.146 17.609 23.211 1.00 0.00 C ATOM 72102 HR PC 1739 128.469 17.973 22.435 1.00 0.00 H ATOM 72103 HS PC 1739 128.904 16.555 23.369 1.00 0.00 H ATOM 72104 C2 PC 1739 130.545 17.864 22.639 1.00 0.00 C ATOM 72105 HX PC 1739 130.743 18.924 22.818 1.00 0.00 H ATOM 72106 C3 PC 1739 130.584 17.541 21.154 1.00 0.00 C ATOM 72107 HA PC 1739 131.571 17.549 20.683 1.00 0.00 H ATOM 72108 HB PC 1739 130.005 18.298 20.618 1.00 0.00 H ATOM 72109 O31 PC 1739 129.927 16.319 20.846 1.00 0.00 O ATOM 72110 P31 PC 1739 129.947 15.723 19.352 1.00 0.00 P ATOM 72111 O32 PC 1739 131.448 15.404 19.254 1.00 0.00 O ATOM 72112 C31 PC 1739 132.015 14.349 20.060 1.00 0.00 C ATOM 72113 H1A PC 1739 131.293 13.531 20.132 1.00 0.00 H ATOM 72114 H1B PC 1739 132.066 14.630 21.115 1.00 0.00 H ATOM 72115 C32 PC 1739 133.497 14.084 19.571 1.00 0.00 C ATOM 72116 H2A PC 1739 134.027 13.482 20.310 1.00 0.00 H ATOM 72117 H2B PC 1739 134.010 15.040 19.456 1.00 0.00 H ATOM 72118 N31 PC 1739 133.742 13.398 18.258 1.00 0.00 N ATOM 72119 C33 PC 1739 135.167 13.365 17.959 1.00 0.00 C ATOM 72120 H3A PC 1739 135.439 14.392 17.711 1.00 0.00 H ATOM 72121 H3B PC 1739 135.236 12.785 17.037 1.00 0.00 H ATOM 72122 H3C PC 1739 135.713 12.978 18.820 1.00 0.00 H ATOM 72123 C34 PC 1739 133.289 11.978 18.239 1.00 0.00 C ATOM 72124 H4A PC 1739 133.839 11.432 19.007 1.00 0.00 H ATOM 72125 H4B PC 1739 133.466 11.496 17.276 1.00 0.00 H ATOM 72126 H4C PC 1739 132.260 11.919 18.595 1.00 0.00 H ATOM 72127 C35 PC 1739 132.964 14.107 17.256 1.00 0.00 C ATOM 72128 H5A PC 1739 133.269 13.734 16.277 1.00 0.00 H ATOM 72129 H5B PC 1739 133.298 15.143 17.184 1.00 0.00 H ATOM 72130 H5C PC 1739 131.894 14.034 17.456 1.00 0.00 H ATOM 72131 O33 PC 1739 129.280 14.425 19.278 1.00 0.00 O ATOM 72132 O34 PC 1739 129.691 16.775 18.383 1.00 0.00 O ATOM 72133 O21 PC 1739 131.466 17.043 23.388 1.00 0.00 O ATOM 72134 C21 PC 1739 132.812 17.008 23.191 1.00 0.00 C ATOM 72135 O22 PC 1739 133.373 17.706 22.344 1.00 0.00 O ATOM 72136 C12 OL 1740 133.383 16.147 24.244 1.00 0.00 C ATOM 72137 H2R OL 1740 134.226 16.690 24.678 1.00 0.00 H ATOM 72138 H2S OL 1740 132.764 16.179 25.143 1.00 0.00 H ATOM 72139 C13 OL 1740 133.755 14.759 23.857 1.00 0.00 C ATOM 72140 H3R OL 1740 132.914 14.142 23.533 1.00 0.00 H ATOM 72141 H3S OL 1740 134.434 14.763 23.002 1.00 0.00 H ATOM 72142 C14 OL 1740 134.409 14.142 25.067 1.00 0.00 C ATOM 72143 H4R OL 1740 135.046 14.906 25.517 1.00 0.00 H ATOM 72144 H4S OL 1740 133.639 13.931 25.812 1.00 0.00 H ATOM 72145 C15 OL 1740 135.157 12.875 24.798 1.00 0.00 C ATOM 72146 H5R OL 1740 134.558 12.249 24.133 1.00 0.00 H ATOM 72147 H5S OL 1740 136.037 13.260 24.279 1.00 0.00 H ATOM 72148 C16 OL 1740 135.629 12.209 26.081 1.00 0.00 C ATOM 72149 H6R OL 1740 136.271 12.928 26.595 1.00 0.00 H ATOM 72150 H6S OL 1740 134.784 12.105 26.764 1.00 0.00 H ATOM 72151 C17 OL 1740 136.237 10.883 25.765 1.00 0.00 C ATOM 72152 H7R OL 1740 135.529 10.275 25.199 1.00 0.00 H ATOM 72153 H7S OL 1740 137.086 11.068 25.104 1.00 0.00 H ATOM 72154 C18 OL 1740 136.772 10.169 27.061 1.00 0.00 C ATOM 72155 H8R OL 1740 137.591 10.696 27.556 1.00 0.00 H ATOM 72156 H8S OL 1740 135.916 10.090 27.734 1.00 0.00 H ATOM 72157 C19 OL 1740 137.137 8.800 26.680 1.00 0.00 C ATOM 72158 H9R OL 1740 137.191 8.515 25.633 1.00 0.00 H ATOM 72159 C110 OL 1740 137.170 7.765 27.496 1.00 0.00 C ATOM 72160 H10R OL 1740 137.483 6.794 27.122 1.00 0.00 H ATOM 72161 C111 OL 1740 137.070 7.720 29.022 1.00 0.00 C ATOM 72162 H11R OL 1740 137.958 7.196 29.383 1.00 0.00 H ATOM 72163 H11S OL 1740 137.115 8.680 29.540 1.00 0.00 H ATOM 72164 C112 OL 1740 135.851 7.029 29.564 1.00 0.00 C ATOM 72165 H12R OL 1740 135.744 7.481 30.552 1.00 0.00 H ATOM 72166 H12S OL 1740 134.969 7.433 29.063 1.00 0.00 H ATOM 72167 C113 OL 1740 135.862 5.483 29.685 1.00 0.00 C ATOM 72168 H13R OL 1740 136.317 5.016 28.808 1.00 0.00 H ATOM 72169 H13S OL 1740 136.409 5.230 30.595 1.00 0.00 H ATOM 72170 C114 OL 1740 134.448 4.798 29.702 1.00 0.00 C ATOM 72171 H14R OL 1740 134.134 4.684 28.662 1.00 0.00 H ATOM 72172 H14S OL 1740 134.605 3.807 30.134 1.00 0.00 H ATOM 72173 C115 OL 1740 133.357 5.517 30.404 1.00 0.00 C ATOM 72174 H15R OL 1740 133.045 6.496 30.036 1.00 0.00 H ATOM 72175 H15S OL 1740 132.482 4.871 30.309 1.00 0.00 H ATOM 72176 C116 OL 1740 133.721 5.612 31.936 1.00 0.00 C ATOM 72177 H16R OL 1740 134.026 4.671 32.399 1.00 0.00 H ATOM 72178 H16S OL 1740 134.488 6.376 32.074 1.00 0.00 H ATOM 72179 C117 OL 1740 132.564 5.977 32.773 1.00 0.00 C ATOM 72180 H17R OL 1740 132.036 6.879 32.459 1.00 0.00 H ATOM 72181 H17S OL 1740 131.825 5.173 32.793 1.00 0.00 H ATOM 72182 C118 OL 1740 132.873 6.215 34.257 1.00 0.00 C ATOM 72183 H18R OL 1740 132.955 5.278 34.810 1.00 0.00 H ATOM 72184 H18S OL 1740 132.037 6.753 34.708 1.00 0.00 H ATOM 72185 H18T OL 1740 133.830 6.717 34.414 1.00 0.00 H TER 72186 OL 1740 ATOM 72186 C116 PA 1741 3.004 46.559 40.692 1.00 0.00 C ATOM 72187 H16R PA 1741 3.428 46.884 41.644 1.00 0.00 H ATOM 72188 H16S PA 1741 3.626 45.722 40.366 1.00 0.00 H ATOM 72189 H16T PA 1741 2.004 46.154 40.861 1.00 0.00 H ATOM 72190 C115 PA 1741 3.019 47.713 39.660 1.00 0.00 C ATOM 72191 H15R PA 1741 2.352 48.539 39.916 1.00 0.00 H ATOM 72192 H15S PA 1741 2.669 47.295 38.714 1.00 0.00 H ATOM 72193 C114 PA 1741 4.331 48.332 39.354 1.00 0.00 C ATOM 72194 H14R PA 1741 5.091 47.552 39.439 1.00 0.00 H ATOM 72195 H14S PA 1741 4.599 49.050 40.131 1.00 0.00 H ATOM 72196 C113 PA 1741 4.499 49.050 37.980 1.00 0.00 C ATOM 72197 H13R PA 1741 5.400 49.640 38.162 1.00 0.00 H ATOM 72198 H13S PA 1741 3.693 49.761 37.789 1.00 0.00 H ATOM 72199 C112 PA 1741 4.660 48.202 36.792 1.00 0.00 C ATOM 72200 H12R PA 1741 3.862 47.459 36.728 1.00 0.00 H ATOM 72201 H12S PA 1741 5.549 47.588 36.946 1.00 0.00 H ATOM 72202 C111 PA 1741 4.786 49.119 35.488 1.00 0.00 C ATOM 72203 H11R PA 1741 5.804 49.513 35.451 1.00 0.00 H ATOM 72204 H11S PA 1741 4.151 50.003 35.578 1.00 0.00 H ATOM 72205 C110 PA 1741 4.691 48.358 34.169 1.00 0.00 C ATOM 72206 H10R PA 1741 3.673 48.062 33.906 1.00 0.00 H ATOM 72207 H10S PA 1741 5.277 47.456 34.357 1.00 0.00 H ATOM 72208 C19 PA 1741 5.178 49.142 32.909 1.00 0.00 C ATOM 72209 H9R PA 1741 6.260 49.258 32.995 1.00 0.00 H ATOM 72210 H9S PA 1741 4.847 50.183 32.914 1.00 0.00 H ATOM 72211 C18 PA 1741 4.859 48.450 31.606 1.00 0.00 C ATOM 72212 H8R PA 1741 3.801 48.657 31.432 1.00 0.00 H ATOM 72213 H8S PA 1741 5.096 47.388 31.699 1.00 0.00 H ATOM 72214 C17 PA 1741 5.535 49.055 30.418 1.00 0.00 C ATOM 72215 H7R PA 1741 6.594 49.071 30.685 1.00 0.00 H ATOM 72216 H7S PA 1741 5.274 50.114 30.480 1.00 0.00 H ATOM 72217 C16 PA 1741 5.403 48.458 28.988 1.00 0.00 C ATOM 72218 H6R PA 1741 5.392 47.372 28.879 1.00 0.00 H ATOM 72219 H6S PA 1741 6.226 48.826 28.371 1.00 0.00 H ATOM 72220 C15 PA 1741 4.071 48.780 28.208 1.00 0.00 C ATOM 72221 H5R PA 1741 3.866 49.852 28.236 1.00 0.00 H ATOM 72222 H5S PA 1741 3.202 48.292 28.654 1.00 0.00 H ATOM 72223 C14 PA 1741 4.141 48.481 26.692 1.00 0.00 C ATOM 72224 H4R PA 1741 4.375 47.420 26.588 1.00 0.00 H ATOM 72225 H4S PA 1741 5.036 49.042 26.416 1.00 0.00 H ATOM 72226 C13 PA 1741 2.807 48.673 25.877 1.00 0.00 C ATOM 72227 H3R PA 1741 2.502 49.708 26.046 1.00 0.00 H ATOM 72228 H3S PA 1741 2.061 48.108 26.441 1.00 0.00 H ATOM 72229 C12 PA 1741 3.022 48.124 24.483 1.00 0.00 C ATOM 72230 H2R PA 1741 3.935 48.542 24.053 1.00 0.00 H ATOM 72231 H2S PA 1741 3.279 47.071 24.619 1.00 0.00 H ATOM 72232 C11 PGR 1742 1.824 48.314 23.569 1.00 0.00 C ATOM 72233 O12 PGR 1742 1.521 49.366 22.992 1.00 0.00 O ATOM 72234 O11 PGR 1742 1.102 47.185 23.528 1.00 0.00 O ATOM 72235 C1 PGR 1742 0.183 47.004 22.424 1.00 0.00 C ATOM 72236 HR PGR 1742 -0.506 47.851 22.451 1.00 0.00 H ATOM 72237 HS PGR 1742 -0.301 46.042 22.610 1.00 0.00 H ATOM 72238 C2 PGR 1742 0.903 46.924 21.060 1.00 0.00 C ATOM 72239 HX PGR 1742 1.113 47.960 20.781 1.00 0.00 H ATOM 72240 C3 PGR 1742 -0.056 46.363 19.965 1.00 0.00 C ATOM 72241 HA PGR 1742 -0.980 46.941 20.045 1.00 0.00 H ATOM 72242 HB PGR 1742 -0.262 45.294 20.065 1.00 0.00 H ATOM 72243 O31 PGR 1742 0.461 46.529 18.674 1.00 0.00 O ATOM 72244 P31 PGR 1742 0.328 47.883 17.840 1.00 0.00 P ATOM 72245 O32 PGR 1742 -1.040 47.721 17.087 1.00 0.00 O ATOM 72246 C31 PGR 1742 -1.163 46.960 15.928 1.00 0.00 C ATOM 72247 H1A PGR 1742 -0.894 45.971 16.309 1.00 0.00 H ATOM 72248 H1B PGR 1742 -0.504 47.406 15.178 1.00 0.00 H ATOM 72249 C32 PGR 1742 -2.602 47.074 15.536 1.00 0.00 C ATOM 72250 H2A PGR 1742 -3.010 48.075 15.371 1.00 0.00 H ATOM 72251 O35 PGR 1742 -3.468 46.393 16.506 1.00 0.00 O ATOM 72252 HO5A PGR 1742 -2.915 45.984 17.196 1.00 0.00 H ATOM 72253 C33 PGR 1742 -2.685 46.353 14.098 1.00 0.00 C ATOM 72254 H3A PGR 1742 -3.730 46.309 13.782 1.00 0.00 H ATOM 72255 H3B PGR 1742 -2.048 46.828 13.348 1.00 0.00 H ATOM 72256 O33 PGR 1742 0.208 49.014 18.760 1.00 0.00 O ATOM 72257 O34 PGR 1742 1.449 47.874 16.864 1.00 0.00 O ATOM 72258 O21 PGR 1742 2.079 46.081 21.158 1.00 0.00 O ATOM 72259 C21 PGR 1742 3.190 46.309 20.464 1.00 0.00 C ATOM 72260 O22 PGR 1742 3.346 47.306 19.743 1.00 0.00 O ATOM 72261 O36 PGR 1742 -2.042 45.092 14.254 1.00 0.00 O ATOM 72262 HO6A PGR 1742 -2.590 44.544 14.843 1.00 0.00 H ATOM 72263 C12 OL 1743 4.361 45.371 20.654 1.00 0.00 C ATOM 72264 H2R OL 1743 3.976 44.353 20.735 1.00 0.00 H ATOM 72265 H2S OL 1743 5.085 45.485 19.844 1.00 0.00 H ATOM 72266 C13 OL 1743 5.108 45.554 21.904 1.00 0.00 C ATOM 72267 H3R OL 1743 4.430 45.221 22.693 1.00 0.00 H ATOM 72268 H3S OL 1743 6.022 44.962 21.987 1.00 0.00 H ATOM 72269 C14 OL 1743 5.546 46.979 22.165 1.00 0.00 C ATOM 72270 H4R OL 1743 6.120 47.354 21.315 1.00 0.00 H ATOM 72271 H4S OL 1743 4.660 47.599 22.323 1.00 0.00 H ATOM 72272 C15 OL 1743 6.386 47.124 23.457 1.00 0.00 C ATOM 72273 H5R OL 1743 5.590 47.092 24.204 1.00 0.00 H ATOM 72274 H5S OL 1743 7.167 46.361 23.489 1.00 0.00 H ATOM 72275 C16 OL 1743 7.049 48.537 23.614 1.00 0.00 C ATOM 72276 H6R OL 1743 7.677 48.632 22.726 1.00 0.00 H ATOM 72277 H6S OL 1743 6.267 49.290 23.499 1.00 0.00 H ATOM 72278 C17 OL 1743 7.741 48.804 24.834 1.00 0.00 C ATOM 72279 H7R OL 1743 7.125 48.615 25.716 1.00 0.00 H ATOM 72280 H7S OL 1743 8.575 48.128 25.034 1.00 0.00 H ATOM 72281 C18 OL 1743 8.223 50.240 25.081 1.00 0.00 C ATOM 72282 H8R OL 1743 8.417 50.609 24.071 1.00 0.00 H ATOM 72283 H8S OL 1743 7.336 50.834 25.310 1.00 0.00 H ATOM 72284 C19 OL 1743 9.272 50.428 26.079 1.00 0.00 C ATOM 72285 H9R OL 1743 10.232 49.994 25.810 1.00 0.00 H ATOM 72286 C110 OL 1743 9.146 50.801 27.343 1.00 0.00 C ATOM 72287 H10R OL 1743 10.013 50.801 27.999 1.00 0.00 H ATOM 72288 C111 OL 1743 7.867 51.402 27.912 1.00 0.00 C ATOM 72289 H11R OL 1743 7.051 51.367 27.187 1.00 0.00 H ATOM 72290 H11S OL 1743 7.587 50.860 28.818 1.00 0.00 H ATOM 72291 C112 OL 1743 8.148 52.818 28.184 1.00 0.00 C ATOM 72292 H12R OL 1743 8.776 52.864 29.076 1.00 0.00 H ATOM 72293 H12S OL 1743 8.670 53.367 27.397 1.00 0.00 H ATOM 72294 C113 OL 1743 6.846 53.599 28.562 1.00 0.00 C ATOM 72295 H13R OL 1743 6.904 54.667 28.784 1.00 0.00 H ATOM 72296 H13S OL 1743 6.172 53.700 27.709 1.00 0.00 H ATOM 72297 C114 OL 1743 6.032 53.028 29.719 1.00 0.00 C ATOM 72298 H14R OL 1743 5.045 52.717 29.369 1.00 0.00 H ATOM 72299 H14S OL 1743 6.405 52.036 29.980 1.00 0.00 H ATOM 72300 C115 OL 1743 5.932 53.867 30.989 1.00 0.00 C ATOM 72301 H15R OL 1743 6.869 54.394 31.183 1.00 0.00 H ATOM 72302 H15S OL 1743 5.131 54.575 30.766 1.00 0.00 H ATOM 72303 C116 OL 1743 5.535 53.100 32.228 1.00 0.00 C ATOM 72304 H16R OL 1743 4.500 52.752 32.236 1.00 0.00 H ATOM 72305 H16S OL 1743 5.969 52.099 32.271 1.00 0.00 H ATOM 72306 C117 OL 1743 5.912 53.885 33.456 1.00 0.00 C ATOM 72307 H17R OL 1743 5.749 53.164 34.260 1.00 0.00 H ATOM 72308 H17S OL 1743 6.993 54.036 33.433 1.00 0.00 H ATOM 72309 C118 OL 1743 5.072 55.178 33.695 1.00 0.00 C ATOM 72310 H18R OL 1743 4.013 55.001 33.498 1.00 0.00 H ATOM 72311 H18S OL 1743 5.223 56.009 33.002 1.00 0.00 H ATOM 72312 H18T OL 1743 5.105 55.604 34.699 1.00 0.00 H TER 72313 OL 1743 ATOM 72313 C116 PA 1744 59.362 28.694 35.971 1.00 0.00 C ATOM 72314 H16R PA 1744 60.051 28.661 35.125 1.00 0.00 H ATOM 72315 H16S PA 1744 58.338 28.765 35.599 1.00 0.00 H ATOM 72316 H16T PA 1744 59.409 27.655 36.302 1.00 0.00 H ATOM 72317 C115 PA 1744 59.792 29.832 36.973 1.00 0.00 C ATOM 72318 H15R PA 1744 58.924 30.034 37.603 1.00 0.00 H ATOM 72319 H15S PA 1744 59.821 30.764 36.404 1.00 0.00 H ATOM 72320 C114 PA 1744 61.104 29.490 37.796 1.00 0.00 C ATOM 72321 H14R PA 1744 61.021 28.565 38.371 1.00 0.00 H ATOM 72322 H14S PA 1744 61.265 30.256 38.557 1.00 0.00 H ATOM 72323 C113 PA 1744 62.289 29.469 36.850 1.00 0.00 C ATOM 72324 H13R PA 1744 62.428 30.471 36.439 1.00 0.00 H ATOM 72325 H13S PA 1744 62.177 28.734 36.050 1.00 0.00 H ATOM 72326 C112 PA 1744 63.561 29.179 37.636 1.00 0.00 C ATOM 72327 H12R PA 1744 63.519 28.115 37.879 1.00 0.00 H ATOM 72328 H12S PA 1744 63.517 29.870 38.480 1.00 0.00 H ATOM 72329 C111 PA 1744 64.813 29.440 36.913 1.00 0.00 C ATOM 72330 H11R PA 1744 64.842 30.516 36.726 1.00 0.00 H ATOM 72331 H11S PA 1744 64.712 28.932 35.951 1.00 0.00 H ATOM 72332 C110 PA 1744 66.121 29.013 37.589 1.00 0.00 C ATOM 72333 H10R PA 1744 66.101 29.421 38.602 1.00 0.00 H ATOM 72334 H10S PA 1744 67.036 29.404 37.139 1.00 0.00 H ATOM 72335 C19 PA 1744 66.284 27.519 37.736 1.00 0.00 C ATOM 72336 H9R PA 1744 66.197 27.129 36.719 1.00 0.00 H ATOM 72337 H9S PA 1744 65.436 27.150 38.316 1.00 0.00 H ATOM 72338 C18 PA 1744 67.634 27.085 38.384 1.00 0.00 C ATOM 72339 H8R PA 1744 67.501 27.445 39.407 1.00 0.00 H ATOM 72340 H8S PA 1744 68.413 27.587 37.808 1.00 0.00 H ATOM 72341 C17 PA 1744 67.976 25.611 38.393 1.00 0.00 C ATOM 72342 H7R PA 1744 67.116 25.163 38.895 1.00 0.00 H ATOM 72343 H7S PA 1744 68.758 25.343 39.106 1.00 0.00 H ATOM 72344 C16 PA 1744 68.004 24.887 37.085 1.00 0.00 C ATOM 72345 H6R PA 1744 67.077 25.114 36.555 1.00 0.00 H ATOM 72346 H6S PA 1744 68.012 23.830 37.359 1.00 0.00 H ATOM 72347 C15 PA 1744 69.167 25.279 36.150 1.00 0.00 C ATOM 72348 H5R PA 1744 70.174 25.416 36.551 1.00 0.00 H ATOM 72349 H5S PA 1744 68.896 26.211 35.648 1.00 0.00 H ATOM 72350 C14 PA 1744 69.231 24.185 35.048 1.00 0.00 C ATOM 72351 H4R PA 1744 68.264 24.015 34.572 1.00 0.00 H ATOM 72352 H4S PA 1744 69.518 23.148 35.235 1.00 0.00 H ATOM 72353 C13 PA 1744 70.007 24.601 33.801 1.00 0.00 C ATOM 72354 H3R PA 1744 70.876 25.130 34.197 1.00 0.00 H ATOM 72355 H3S PA 1744 69.358 25.294 33.262 1.00 0.00 H ATOM 72356 C12 PA 1744 70.530 23.599 32.756 1.00 0.00 C ATOM 72357 H2R PA 1744 69.808 22.781 32.714 1.00 0.00 H ATOM 72358 H2S PA 1744 71.462 23.221 33.181 1.00 0.00 H ATOM 72359 C11 PGR 1745 70.857 24.196 31.336 1.00 0.00 C ATOM 72360 O12 PGR 1745 71.821 23.761 30.711 1.00 0.00 O ATOM 72361 O11 PGR 1745 69.949 25.030 30.743 1.00 0.00 O ATOM 72362 C1 PGR 1745 70.048 25.497 29.384 1.00 0.00 C ATOM 72363 HR PGR 1745 71.016 25.964 29.188 1.00 0.00 H ATOM 72364 HS PGR 1745 69.384 26.338 29.169 1.00 0.00 H ATOM 72365 C2 PGR 1745 69.723 24.230 28.513 1.00 0.00 C ATOM 72366 HX PGR 1745 70.473 23.444 28.636 1.00 0.00 H ATOM 72367 C3 PGR 1745 69.803 24.627 27.003 1.00 0.00 C ATOM 72368 HA PGR 1745 69.771 23.757 26.343 1.00 0.00 H ATOM 72369 HB PGR 1745 70.710 25.095 26.611 1.00 0.00 H ATOM 72370 O31 PGR 1745 68.663 25.420 26.845 1.00 0.00 O ATOM 72371 P31 PGR 1745 68.575 26.712 25.862 1.00 0.00 P ATOM 72372 O32 PGR 1745 69.734 27.677 26.360 1.00 0.00 O ATOM 72373 C31 PGR 1745 69.545 29.029 26.275 1.00 0.00 C ATOM 72374 H1A PGR 1745 70.015 29.552 27.112 1.00 0.00 H ATOM 72375 H1B PGR 1745 68.493 29.283 26.123 1.00 0.00 H ATOM 72376 C32 PGR 1745 70.304 29.495 25.001 1.00 0.00 C ATOM 72377 H2A PGR 1745 70.396 28.738 24.218 1.00 0.00 H ATOM 72378 O35 PGR 1745 71.679 29.793 25.347 1.00 0.00 O ATOM 72379 HO5A PGR 1745 72.063 28.899 25.399 1.00 0.00 H ATOM 72380 C33 PGR 1745 69.868 30.830 24.379 1.00 0.00 C ATOM 72381 H3A PGR 1745 70.584 31.201 23.642 1.00 0.00 H ATOM 72382 H3B PGR 1745 68.898 30.818 23.874 1.00 0.00 H ATOM 72383 O33 PGR 1745 69.016 26.357 24.510 1.00 0.00 O ATOM 72384 O34 PGR 1745 67.211 27.300 26.086 1.00 0.00 O ATOM 72385 O21 PGR 1745 68.389 23.845 28.784 1.00 0.00 O ATOM 72386 C21 PGR 1745 67.753 22.898 28.065 1.00 0.00 C ATOM 72387 O22 PGR 1745 68.343 22.135 27.302 1.00 0.00 O ATOM 72388 O36 PGR 1745 69.752 31.854 25.484 1.00 0.00 O ATOM 72389 HO6A PGR 1745 70.654 32.103 25.751 1.00 0.00 H ATOM 72390 C12 OL 1746 66.322 22.772 28.295 1.00 0.00 C ATOM 72391 H2R OL 1746 65.834 22.775 27.319 1.00 0.00 H ATOM 72392 H2S OL 1746 66.175 21.739 28.618 1.00 0.00 H ATOM 72393 C13 OL 1746 65.617 23.982 29.004 1.00 0.00 C ATOM 72394 H3R OL 1746 65.977 23.995 30.035 1.00 0.00 H ATOM 72395 H3S OL 1746 65.988 24.948 28.652 1.00 0.00 H ATOM 72396 C14 OL 1746 64.118 23.924 29.007 1.00 0.00 C ATOM 72397 H4R OL 1746 63.674 23.869 28.010 1.00 0.00 H ATOM 72398 H4S OL 1746 63.929 22.885 29.286 1.00 0.00 H ATOM 72399 C15 OL 1746 63.420 24.913 29.989 1.00 0.00 C ATOM 72400 H5R OL 1746 63.726 24.570 30.980 1.00 0.00 H ATOM 72401 H5S OL 1746 63.948 25.863 29.887 1.00 0.00 H ATOM 72402 C16 OL 1746 61.913 24.974 29.973 1.00 0.00 C ATOM 72403 H6R OL 1746 61.560 23.999 30.314 1.00 0.00 H ATOM 72404 H6S OL 1746 61.545 25.626 30.768 1.00 0.00 H ATOM 72405 C17 OL 1746 61.342 25.367 28.631 1.00 0.00 C ATOM 72406 H7R OL 1746 62.183 25.846 28.126 1.00 0.00 H ATOM 72407 H7S OL 1746 61.271 24.449 28.046 1.00 0.00 H ATOM 72408 C18 OL 1746 60.108 26.290 28.729 1.00 0.00 C ATOM 72409 H8R OL 1746 60.293 27.367 28.711 1.00 0.00 H ATOM 72410 H8S OL 1746 59.522 26.072 27.834 1.00 0.00 H ATOM 72411 C19 OL 1746 59.195 25.783 29.756 1.00 0.00 C ATOM 72412 H9R OL 1746 58.843 24.767 29.592 1.00 0.00 H ATOM 72413 C110 OL 1746 58.776 26.395 30.855 1.00 0.00 C ATOM 72414 H10R OL 1746 58.144 25.855 31.555 1.00 0.00 H ATOM 72415 C111 OL 1746 59.065 27.802 31.237 1.00 0.00 C ATOM 72416 H11R OL 1746 58.964 28.320 30.281 1.00 0.00 H ATOM 72417 H11S OL 1746 58.205 28.208 31.773 1.00 0.00 H ATOM 72418 C112 OL 1746 60.413 27.958 31.996 1.00 0.00 C ATOM 72419 H12R OL 1746 60.227 27.734 33.048 1.00 0.00 H ATOM 72420 H12S OL 1746 61.092 27.193 31.615 1.00 0.00 H ATOM 72421 C113 OL 1746 61.002 29.359 31.977 1.00 0.00 C ATOM 72422 H13R OL 1746 61.243 29.795 31.006 1.00 0.00 H ATOM 72423 H13S OL 1746 60.270 29.931 32.552 1.00 0.00 H ATOM 72424 C114 OL 1746 62.292 29.555 32.876 1.00 0.00 C ATOM 72425 H14R OL 1746 62.032 29.060 33.814 1.00 0.00 H ATOM 72426 H14S OL 1746 63.110 28.934 32.504 1.00 0.00 H ATOM 72427 C115 OL 1746 62.627 31.049 33.216 1.00 0.00 C ATOM 72428 H15R OL 1746 61.867 31.523 33.840 1.00 0.00 H ATOM 72429 H15S OL 1746 63.360 31.276 33.993 1.00 0.00 H ATOM 72430 C116 OL 1746 62.893 32.046 32.104 1.00 0.00 C ATOM 72431 H16R OL 1746 63.890 32.014 31.661 1.00 0.00 H ATOM 72432 H16S OL 1746 62.131 31.858 31.345 1.00 0.00 H ATOM 72433 C117 OL 1746 62.624 33.476 32.317 1.00 0.00 C ATOM 72434 H17R OL 1746 61.532 33.496 32.283 1.00 0.00 H ATOM 72435 H17S OL 1746 62.978 33.796 33.299 1.00 0.00 H ATOM 72436 C118 OL 1746 63.116 34.501 31.230 1.00 0.00 C ATOM 72437 H18R OL 1746 64.159 34.820 31.277 1.00 0.00 H ATOM 72438 H18S OL 1746 62.608 35.464 31.317 1.00 0.00 H ATOM 72439 H18T OL 1746 62.832 34.076 30.265 1.00 0.00 H TER 72440 OL 1746 ATOM 72440 C116 PA 1747 28.191 144.863 36.073 1.00 0.00 C ATOM 72441 H16R PA 1747 29.035 145.294 35.531 1.00 0.00 H ATOM 72442 H16S PA 1747 28.586 144.127 36.776 1.00 0.00 H ATOM 72443 H16T PA 1747 27.878 145.732 36.656 1.00 0.00 H ATOM 72444 C115 PA 1747 27.111 144.188 35.220 1.00 0.00 C ATOM 72445 H15R PA 1747 26.302 143.684 35.753 1.00 0.00 H ATOM 72446 H15S PA 1747 27.567 143.367 34.663 1.00 0.00 H ATOM 72447 C114 PA 1747 26.326 145.130 34.373 1.00 0.00 C ATOM 72448 H14R PA 1747 26.994 145.477 33.581 1.00 0.00 H ATOM 72449 H14S PA 1747 25.996 145.924 35.046 1.00 0.00 H ATOM 72450 C113 PA 1747 25.227 144.663 33.418 1.00 0.00 C ATOM 72451 H13R PA 1747 24.898 145.450 32.736 1.00 0.00 H ATOM 72452 H13S PA 1747 24.341 144.550 34.046 1.00 0.00 H ATOM 72453 C112 PA 1747 25.516 143.505 32.510 1.00 0.00 C ATOM 72454 H12R PA 1747 24.612 142.965 32.221 1.00 0.00 H ATOM 72455 H12S PA 1747 26.033 142.749 33.105 1.00 0.00 H ATOM 72456 C111 PA 1747 26.363 143.774 31.279 1.00 0.00 C ATOM 72457 H11R PA 1747 27.388 144.126 31.418 1.00 0.00 H ATOM 72458 H11S PA 1747 25.926 144.543 30.639 1.00 0.00 H ATOM 72459 C110 PA 1747 26.577 142.453 30.427 1.00 0.00 C ATOM 72460 H10R PA 1747 25.609 141.973 30.273 1.00 0.00 H ATOM 72461 H10S PA 1747 27.152 141.724 31.001 1.00 0.00 H ATOM 72462 C19 PA 1747 27.460 142.577 29.142 1.00 0.00 C ATOM 72463 H9R PA 1747 28.429 143.054 29.297 1.00 0.00 H ATOM 72464 H9S PA 1747 26.898 143.247 28.488 1.00 0.00 H ATOM 72465 C18 PA 1747 27.539 141.195 28.371 1.00 0.00 C ATOM 72466 H8R PA 1747 27.907 141.398 27.364 1.00 0.00 H ATOM 72467 H8S PA 1747 26.533 140.785 28.260 1.00 0.00 H ATOM 72468 C17 PA 1747 28.511 140.144 29.017 1.00 0.00 C ATOM 72469 H7R PA 1747 28.169 139.640 29.924 1.00 0.00 H ATOM 72470 H7S PA 1747 29.393 140.727 29.290 1.00 0.00 H ATOM 72471 C16 PA 1747 28.718 138.937 28.097 1.00 0.00 C ATOM 72472 H6R PA 1747 28.901 139.403 27.127 1.00 0.00 H ATOM 72473 H6S PA 1747 27.804 138.390 27.857 1.00 0.00 H ATOM 72474 C15 PA 1747 29.970 138.184 28.463 1.00 0.00 C ATOM 72475 H5R PA 1747 29.662 137.689 29.387 1.00 0.00 H ATOM 72476 H5S PA 1747 30.804 138.837 28.726 1.00 0.00 H ATOM 72477 C14 PA 1747 30.400 137.012 27.547 1.00 0.00 C ATOM 72478 H4R PA 1747 29.556 136.320 27.529 1.00 0.00 H ATOM 72479 H4S PA 1747 31.234 136.465 27.991 1.00 0.00 H ATOM 72480 C13 PA 1747 30.723 137.465 26.112 1.00 0.00 C ATOM 72481 H3R PA 1747 31.463 138.265 26.053 1.00 0.00 H ATOM 72482 H3S PA 1747 29.795 137.827 25.666 1.00 0.00 H ATOM 72483 C12 PA 1747 31.334 136.371 25.286 1.00 0.00 C ATOM 72484 H2R PA 1747 30.702 135.490 25.413 1.00 0.00 H ATOM 72485 H2S PA 1747 32.324 136.019 25.582 1.00 0.00 H ATOM 72486 C11 PC 1748 31.300 136.726 23.832 1.00 0.00 C ATOM 72487 O12 PC 1748 30.303 136.672 23.154 1.00 0.00 O ATOM 72488 O11 PC 1748 32.496 137.199 23.395 1.00 0.00 O ATOM 72489 C1 PC 1748 32.700 137.683 22.055 1.00 0.00 C ATOM 72490 HR PC 1748 32.127 136.984 21.441 1.00 0.00 H ATOM 72491 HS PC 1748 33.715 137.679 21.649 1.00 0.00 H ATOM 72492 C2 PC 1748 32.218 139.155 21.839 1.00 0.00 C ATOM 72493 HX PC 1748 31.145 139.160 22.047 1.00 0.00 H ATOM 72494 C3 PC 1748 32.495 139.596 20.426 1.00 0.00 C ATOM 72495 HA PC 1748 32.547 138.821 19.657 1.00 0.00 H ATOM 72496 HB PC 1748 33.443 140.138 20.404 1.00 0.00 H ATOM 72497 O31 PC 1748 31.394 140.508 20.099 1.00 0.00 O ATOM 72498 P31 PC 1748 31.587 141.297 18.720 1.00 0.00 P ATOM 72499 O32 PC 1748 31.781 140.128 17.686 1.00 0.00 O ATOM 72500 C31 PC 1748 30.714 139.288 17.354 1.00 0.00 C ATOM 72501 H1A PC 1748 30.050 139.674 16.577 1.00 0.00 H ATOM 72502 H1B PC 1748 30.154 138.993 18.245 1.00 0.00 H ATOM 72503 C32 PC 1748 31.246 138.028 16.720 1.00 0.00 C ATOM 72504 H2A PC 1748 31.960 137.474 17.330 1.00 0.00 H ATOM 72505 H2B PC 1748 31.870 138.352 15.886 1.00 0.00 H ATOM 72506 N31 PC 1748 30.324 136.923 16.231 1.00 0.00 N ATOM 72507 C33 PC 1748 31.197 136.088 15.396 1.00 0.00 C ATOM 72508 H3A PC 1748 30.522 135.454 14.819 1.00 0.00 H ATOM 72509 H3B PC 1748 31.907 135.525 16.003 1.00 0.00 H ATOM 72510 H3C PC 1748 31.744 136.725 14.700 1.00 0.00 H ATOM 72511 C34 PC 1748 29.773 136.146 17.358 1.00 0.00 C ATOM 72512 H4A PC 1748 29.065 136.848 17.799 1.00 0.00 H ATOM 72513 H4B PC 1748 30.506 135.820 18.097 1.00 0.00 H ATOM 72514 H4C PC 1748 29.219 135.284 16.981 1.00 0.00 H ATOM 72515 C35 PC 1748 29.216 137.321 15.330 1.00 0.00 C ATOM 72516 H5A PC 1748 29.509 137.841 14.417 1.00 0.00 H ATOM 72517 H5B PC 1748 28.484 137.882 15.913 1.00 0.00 H ATOM 72518 H5C PC 1748 28.644 136.483 14.929 1.00 0.00 H ATOM 72519 O33 PC 1748 30.257 141.904 18.435 1.00 0.00 O ATOM 72520 O34 PC 1748 32.784 142.190 18.725 1.00 0.00 O ATOM 72521 O21 PC 1748 32.870 139.980 22.785 1.00 0.00 O ATOM 72522 C21 PC 1748 32.279 141.081 23.263 1.00 0.00 C ATOM 72523 O22 PC 1748 31.091 141.334 23.130 1.00 0.00 O ATOM 72524 C12 OL 1749 33.192 141.856 24.091 1.00 0.00 C ATOM 72525 H2R OL 1749 33.849 142.404 23.412 1.00 0.00 H ATOM 72526 H2S OL 1749 32.601 142.597 24.633 1.00 0.00 H ATOM 72527 C13 OL 1749 33.851 140.995 25.206 1.00 0.00 C ATOM 72528 H3R OL 1749 33.026 140.490 25.714 1.00 0.00 H ATOM 72529 H3S OL 1749 34.402 140.200 24.700 1.00 0.00 H ATOM 72530 C14 OL 1749 34.649 141.796 26.176 1.00 0.00 C ATOM 72531 H4R OL 1749 35.204 141.132 26.842 1.00 0.00 H ATOM 72532 H4S OL 1749 35.400 142.208 25.498 1.00 0.00 H ATOM 72533 C15 OL 1749 33.958 142.887 26.984 1.00 0.00 C ATOM 72534 H5R OL 1749 34.765 143.320 27.578 1.00 0.00 H ATOM 72535 H5S OL 1749 33.538 143.691 26.377 1.00 0.00 H ATOM 72536 C16 OL 1749 32.817 142.362 27.793 1.00 0.00 C ATOM 72537 H6R OL 1749 32.000 142.024 27.153 1.00 0.00 H ATOM 72538 H6S OL 1749 33.211 141.523 28.370 1.00 0.00 H ATOM 72539 C17 OL 1749 32.164 143.352 28.712 1.00 0.00 C ATOM 72540 H7R OL 1749 31.650 144.138 28.155 1.00 0.00 H ATOM 72541 H7S OL 1749 31.344 142.829 29.209 1.00 0.00 H ATOM 72542 C18 OL 1749 33.108 144.156 29.655 1.00 0.00 C ATOM 72543 H8R OL 1749 33.660 143.527 30.356 1.00 0.00 H ATOM 72544 H8S OL 1749 33.898 144.617 29.058 1.00 0.00 H ATOM 72545 C19 OL 1749 32.388 145.332 30.263 1.00 0.00 C ATOM 72546 H9R OL 1749 32.201 146.148 29.569 1.00 0.00 H ATOM 72547 C110 OL 1749 31.859 145.501 31.460 1.00 0.00 C ATOM 72548 H10R OL 1749 31.422 146.482 31.629 1.00 0.00 H ATOM 72549 C111 OL 1749 32.051 144.618 32.619 1.00 0.00 C ATOM 72550 H11R OL 1749 31.225 143.930 32.810 1.00 0.00 H ATOM 72551 H11S OL 1749 32.913 143.977 32.419 1.00 0.00 H ATOM 72552 C112 OL 1749 32.277 145.370 33.894 1.00 0.00 C ATOM 72553 H12R OL 1749 33.104 146.072 33.772 1.00 0.00 H ATOM 72554 H12S OL 1749 31.350 145.843 34.223 1.00 0.00 H ATOM 72555 C113 OL 1749 32.592 144.670 35.161 1.00 0.00 C ATOM 72556 H13R OL 1749 33.483 144.055 35.015 1.00 0.00 H ATOM 72557 H13S OL 1749 32.895 145.306 35.996 1.00 0.00 H ATOM 72558 C114 OL 1749 31.555 143.619 35.558 1.00 0.00 C ATOM 72559 H14R OL 1749 30.763 144.206 36.027 1.00 0.00 H ATOM 72560 H14S OL 1749 31.084 143.029 34.769 1.00 0.00 H ATOM 72561 C115 OL 1749 32.129 142.648 36.633 1.00 0.00 C ATOM 72562 H15R OL 1749 32.834 141.894 36.277 1.00 0.00 H ATOM 72563 H15S OL 1749 32.646 143.268 37.368 1.00 0.00 H ATOM 72564 C116 OL 1749 30.982 141.917 37.429 1.00 0.00 C ATOM 72565 H16R OL 1749 30.375 142.675 37.928 1.00 0.00 H ATOM 72566 H16S OL 1749 30.313 141.379 36.753 1.00 0.00 H ATOM 72567 C117 OL 1749 31.656 140.981 38.439 1.00 0.00 C ATOM 72568 H17R OL 1749 32.144 140.199 37.852 1.00 0.00 H ATOM 72569 H17S OL 1749 32.492 141.463 38.950 1.00 0.00 H ATOM 72570 C118 OL 1749 30.551 140.421 39.403 1.00 0.00 C ATOM 72571 H18R OL 1749 29.758 139.839 38.930 1.00 0.00 H ATOM 72572 H18S OL 1749 30.120 141.243 39.978 1.00 0.00 H ATOM 72573 H18T OL 1749 30.922 139.741 40.173 1.00 0.00 H TER 72574 OL 1749 ATOM 72574 C116 PA 1750 117.374 104.186 36.958 1.00 0.00 C ATOM 72575 H16R PA 1750 116.645 104.306 36.155 1.00 0.00 H ATOM 72576 H16S PA 1750 116.829 104.292 37.898 1.00 0.00 H ATOM 72577 H16T PA 1750 117.852 103.205 36.912 1.00 0.00 H ATOM 72578 C115 PA 1750 118.431 105.267 36.865 1.00 0.00 C ATOM 72579 H15R PA 1750 119.271 104.958 37.491 1.00 0.00 H ATOM 72580 H15S PA 1750 118.036 106.220 37.224 1.00 0.00 H ATOM 72581 C114 PA 1750 119.024 105.537 35.483 1.00 0.00 C ATOM 72582 H14R PA 1750 119.572 104.634 35.205 1.00 0.00 H ATOM 72583 H14S PA 1750 119.737 106.357 35.597 1.00 0.00 H ATOM 72584 C113 PA 1750 118.061 105.843 34.322 1.00 0.00 C ATOM 72585 H13R PA 1750 117.613 104.856 34.192 1.00 0.00 H ATOM 72586 H13S PA 1750 118.640 105.834 33.396 1.00 0.00 H ATOM 72587 C112 PA 1750 117.167 106.983 34.517 1.00 0.00 C ATOM 72588 H12R PA 1750 116.556 106.775 35.398 1.00 0.00 H ATOM 72589 H12S PA 1750 116.432 107.214 33.743 1.00 0.00 H ATOM 72590 C111 PA 1750 117.881 108.300 34.708 1.00 0.00 C ATOM 72591 H11R PA 1750 118.530 108.336 35.585 1.00 0.00 H ATOM 72592 H11S PA 1750 117.236 109.171 34.847 1.00 0.00 H ATOM 72593 C110 PA 1750 118.593 108.762 33.419 1.00 0.00 C ATOM 72594 H10R PA 1750 118.511 109.787 33.052 1.00 0.00 H ATOM 72595 H10S PA 1750 118.321 108.329 32.454 1.00 0.00 H ATOM 72596 C19 PA 1750 120.117 108.610 33.475 1.00 0.00 C ATOM 72597 H9R PA 1750 120.402 107.622 33.843 1.00 0.00 H ATOM 72598 H9S PA 1750 120.529 109.317 34.198 1.00 0.00 H ATOM 72599 C18 PA 1750 120.943 108.657 32.179 1.00 0.00 C ATOM 72600 H8R PA 1750 120.705 107.750 31.620 1.00 0.00 H ATOM 72601 H8S PA 1750 121.998 108.522 32.423 1.00 0.00 H ATOM 72602 C17 PA 1750 120.781 109.923 31.363 1.00 0.00 C ATOM 72603 H7R PA 1750 121.051 110.659 32.124 1.00 0.00 H ATOM 72604 H7S PA 1750 119.710 110.004 31.168 1.00 0.00 H ATOM 72605 C16 PA 1750 121.681 110.222 30.187 1.00 0.00 C ATOM 72606 H6R PA 1750 122.650 110.216 30.690 1.00 0.00 H ATOM 72607 H6S PA 1750 121.527 111.207 29.741 1.00 0.00 H ATOM 72608 C15 PA 1750 121.558 109.230 29.021 1.00 0.00 C ATOM 72609 H5R PA 1750 120.541 109.287 28.629 1.00 0.00 H ATOM 72610 H5S PA 1750 121.672 108.203 29.375 1.00 0.00 H ATOM 72611 C14 PA 1750 122.655 109.402 27.879 1.00 0.00 C ATOM 72612 H4R PA 1750 122.517 108.558 27.200 1.00 0.00 H ATOM 72613 H4S PA 1750 123.608 109.174 28.360 1.00 0.00 H ATOM 72614 C13 PA 1750 122.768 110.795 27.156 1.00 0.00 C ATOM 72615 H3R PA 1750 123.413 111.433 27.763 1.00 0.00 H ATOM 72616 H3S PA 1750 121.847 111.382 27.159 1.00 0.00 H ATOM 72617 C12 PA 1750 123.655 110.743 25.877 1.00 0.00 C ATOM 72618 H2R PA 1750 124.591 110.253 26.152 1.00 0.00 H ATOM 72619 H2S PA 1750 124.021 111.727 25.575 1.00 0.00 H ATOM 72620 C11 PGR 1751 123.019 110.107 24.669 1.00 0.00 C ATOM 72621 O12 PGR 1751 123.539 109.975 23.603 1.00 0.00 O ATOM 72622 O11 PGR 1751 121.773 109.665 24.886 1.00 0.00 O ATOM 72623 C1 PGR 1751 121.016 109.022 23.839 1.00 0.00 C ATOM 72624 HR PGR 1751 121.140 109.597 22.918 1.00 0.00 H ATOM 72625 HS PGR 1751 119.972 108.938 24.153 1.00 0.00 H ATOM 72626 C2 PGR 1751 121.609 107.692 23.495 1.00 0.00 C ATOM 72627 HX PGR 1751 122.437 107.974 22.840 1.00 0.00 H ATOM 72628 C3 PGR 1751 120.621 106.898 22.699 1.00 0.00 C ATOM 72629 HA PGR 1751 120.368 107.510 21.829 1.00 0.00 H ATOM 72630 HB PGR 1751 119.694 106.689 23.240 1.00 0.00 H ATOM 72631 O31 PGR 1751 121.126 105.757 22.117 1.00 0.00 O ATOM 72632 P31 PGR 1751 120.051 104.722 21.477 1.00 0.00 P ATOM 72633 O32 PGR 1751 119.162 104.231 22.641 1.00 0.00 O ATOM 72634 C31 PGR 1751 119.662 103.540 23.837 1.00 0.00 C ATOM 72635 H1A PGR 1751 120.381 104.150 24.390 1.00 0.00 H ATOM 72636 H1B PGR 1751 120.209 102.617 23.628 1.00 0.00 H ATOM 72637 C32 PGR 1751 118.519 103.212 24.823 1.00 0.00 C ATOM 72638 H2A PGR 1751 118.873 102.944 25.822 1.00 0.00 H ATOM 72639 O35 PGR 1751 117.808 102.098 24.246 1.00 0.00 O ATOM 72640 HO5A PGR 1751 117.028 101.864 24.780 1.00 0.00 H ATOM 72641 C33 PGR 1751 117.619 104.463 25.143 1.00 0.00 C ATOM 72642 H3A PGR 1751 118.367 105.214 25.410 1.00 0.00 H ATOM 72643 H3B PGR 1751 117.214 104.856 24.207 1.00 0.00 H ATOM 72644 O33 PGR 1751 119.199 105.426 20.496 1.00 0.00 O ATOM 72645 O34 PGR 1751 120.811 103.558 21.011 1.00 0.00 O ATOM 72646 O21 PGR 1751 122.014 106.836 24.696 1.00 0.00 O ATOM 72647 C21 PGR 1751 121.158 106.512 25.658 1.00 0.00 C ATOM 72648 O22 PGR 1751 120.026 106.903 25.784 1.00 0.00 O ATOM 72649 O36 PGR 1751 116.614 104.130 26.107 1.00 0.00 O ATOM 72650 HO6A PGR 1751 116.221 104.987 26.351 1.00 0.00 H ATOM 72651 C12 OL 1752 121.861 105.687 26.725 1.00 0.00 C ATOM 72652 H2R OL 1752 122.718 105.136 26.333 1.00 0.00 H ATOM 72653 H2S OL 1752 122.138 106.470 27.434 1.00 0.00 H ATOM 72654 C13 OL 1752 120.935 104.679 27.385 1.00 0.00 C ATOM 72655 H3R OL 1752 120.374 104.223 26.567 1.00 0.00 H ATOM 72656 H3S OL 1752 121.591 103.994 27.927 1.00 0.00 H ATOM 72657 C14 OL 1752 120.099 105.310 28.478 1.00 0.00 C ATOM 72658 H4R OL 1752 120.794 105.631 29.257 1.00 0.00 H ATOM 72659 H4S OL 1752 119.580 106.210 28.141 1.00 0.00 H ATOM 72660 C15 OL 1752 119.001 104.400 29.026 1.00 0.00 C ATOM 72661 H5R OL 1752 118.701 103.864 28.122 1.00 0.00 H ATOM 72662 H5S OL 1752 119.542 103.631 29.582 1.00 0.00 H ATOM 72663 C16 OL 1752 118.000 105.081 29.969 1.00 0.00 C ATOM 72664 H6R OL 1752 118.457 104.976 30.954 1.00 0.00 H ATOM 72665 H6S OL 1752 117.904 106.149 29.766 1.00 0.00 H ATOM 72666 C17 OL 1752 116.664 104.336 30.020 1.00 0.00 C ATOM 72667 H7R OL 1752 115.901 104.965 29.555 1.00 0.00 H ATOM 72668 H7S OL 1752 116.689 103.388 29.480 1.00 0.00 H ATOM 72669 C18 OL 1752 116.291 103.837 31.493 1.00 0.00 C ATOM 72670 H8R OL 1752 117.009 103.066 31.776 1.00 0.00 H ATOM 72671 H8S OL 1752 116.384 104.732 32.112 1.00 0.00 H ATOM 72672 C19 OL 1752 114.870 103.501 31.630 1.00 0.00 C ATOM 72673 H9R OL 1752 114.113 104.113 31.147 1.00 0.00 H ATOM 72674 C110 OL 1752 114.448 102.506 32.477 1.00 0.00 C ATOM 72675 H10R OL 1752 113.395 102.313 32.665 1.00 0.00 H ATOM 72676 C111 OL 1752 115.254 101.392 33.158 1.00 0.00 C ATOM 72677 H11R OL 1752 115.196 100.394 32.718 1.00 0.00 H ATOM 72678 H11S OL 1752 116.331 101.570 33.113 1.00 0.00 H ATOM 72679 C112 OL 1752 114.953 101.457 34.659 1.00 0.00 C ATOM 72680 H12R OL 1752 115.132 102.475 35.011 1.00 0.00 H ATOM 72681 H12S OL 1752 113.885 101.306 34.832 1.00 0.00 H ATOM 72682 C113 OL 1752 115.794 100.485 35.463 1.00 0.00 C ATOM 72683 H13R OL 1752 115.657 99.507 34.998 1.00 0.00 H ATOM 72684 H13S OL 1752 116.823 100.699 35.167 1.00 0.00 H ATOM 72685 C114 OL 1752 115.530 100.678 36.944 1.00 0.00 C ATOM 72686 H14R OL 1752 115.752 101.700 37.260 1.00 0.00 H ATOM 72687 H14S OL 1752 114.466 100.500 37.115 1.00 0.00 H ATOM 72688 C115 OL 1752 116.503 99.890 37.865 1.00 0.00 C ATOM 72689 H15R OL 1752 116.361 98.809 37.920 1.00 0.00 H ATOM 72690 H15S OL 1752 117.539 100.014 37.543 1.00 0.00 H ATOM 72691 C116 OL 1752 116.365 100.325 39.318 1.00 0.00 C ATOM 72692 H16R OL 1752 116.330 101.410 39.433 1.00 0.00 H ATOM 72693 H16S OL 1752 115.413 99.969 39.715 1.00 0.00 H ATOM 72694 C117 OL 1752 117.447 99.693 40.207 1.00 0.00 C ATOM 72695 H17R OL 1752 117.374 98.608 40.115 1.00 0.00 H ATOM 72696 H17S OL 1752 118.439 100.072 39.950 1.00 0.00 H ATOM 72697 C118 OL 1752 117.240 99.957 41.697 1.00 0.00 C ATOM 72698 H18R OL 1752 118.034 99.494 42.285 1.00 0.00 H ATOM 72699 H18S OL 1752 116.351 99.440 42.065 1.00 0.00 H ATOM 72700 H18T OL 1752 117.044 100.987 42.004 1.00 0.00 H TER 72701 OL 1752 ATOM 72701 C116 PA 1753 10.369 131.569 40.268 1.00 0.00 C ATOM 72702 H16R PA 1753 9.490 131.405 39.641 1.00 0.00 H ATOM 72703 H16S PA 1753 10.845 132.477 39.892 1.00 0.00 H ATOM 72704 H16T PA 1753 10.119 131.773 41.311 1.00 0.00 H ATOM 72705 C115 PA 1753 11.224 130.313 40.201 1.00 0.00 C ATOM 72706 H15R PA 1753 11.035 129.626 41.028 1.00 0.00 H ATOM 72707 H15S PA 1753 12.271 130.595 40.332 1.00 0.00 H ATOM 72708 C114 PA 1753 11.013 129.496 38.920 1.00 0.00 C ATOM 72709 H14R PA 1753 11.084 130.041 37.976 1.00 0.00 H ATOM 72710 H14S PA 1753 9.971 129.168 38.896 1.00 0.00 H ATOM 72711 C113 PA 1753 12.036 128.320 38.790 1.00 0.00 C ATOM 72712 H13R PA 1753 11.855 127.781 39.722 1.00 0.00 H ATOM 72713 H13S PA 1753 13.083 128.616 38.699 1.00 0.00 H ATOM 72714 C112 PA 1753 11.668 127.535 37.601 1.00 0.00 C ATOM 72715 H12R PA 1753 11.679 128.152 36.701 1.00 0.00 H ATOM 72716 H12S PA 1753 10.640 127.170 37.658 1.00 0.00 H ATOM 72717 C111 PA 1753 12.613 126.306 37.475 1.00 0.00 C ATOM 72718 H11R PA 1753 12.668 125.792 38.437 1.00 0.00 H ATOM 72719 H11S PA 1753 13.629 126.612 37.220 1.00 0.00 H ATOM 72720 C110 PA 1753 12.103 125.249 36.490 1.00 0.00 C ATOM 72721 H10R PA 1753 11.737 125.791 35.615 1.00 0.00 H ATOM 72722 H10S PA 1753 11.268 124.698 36.926 1.00 0.00 H ATOM 72723 C19 PA 1753 13.069 124.097 36.198 1.00 0.00 C ATOM 72724 H9R PA 1753 13.560 123.724 37.099 1.00 0.00 H ATOM 72725 H9S PA 1753 13.877 124.579 35.644 1.00 0.00 H ATOM 72726 C18 PA 1753 12.641 122.842 35.396 1.00 0.00 C ATOM 72727 H8R PA 1753 12.451 121.995 36.058 1.00 0.00 H ATOM 72728 H8S PA 1753 13.508 122.551 34.799 1.00 0.00 H ATOM 72729 C17 PA 1753 11.506 123.151 34.449 1.00 0.00 C ATOM 72730 H7R PA 1753 11.630 124.067 33.867 1.00 0.00 H ATOM 72731 H7S PA 1753 10.576 123.396 34.966 1.00 0.00 H ATOM 72732 C16 PA 1753 11.102 121.979 33.517 1.00 0.00 C ATOM 72733 H6R PA 1753 10.010 121.989 33.524 1.00 0.00 H ATOM 72734 H6S PA 1753 11.336 121.008 33.958 1.00 0.00 H ATOM 72735 C15 PA 1753 11.892 122.098 32.253 1.00 0.00 C ATOM 72736 H5R PA 1753 12.957 122.237 32.454 1.00 0.00 H ATOM 72737 H5S PA 1753 11.476 123.006 31.813 1.00 0.00 H ATOM 72738 C14 PA 1753 11.680 120.941 31.340 1.00 0.00 C ATOM 72739 H4R PA 1753 10.749 121.139 30.804 1.00 0.00 H ATOM 72740 H4S PA 1753 11.482 120.067 31.964 1.00 0.00 H ATOM 72741 C13 PA 1753 12.753 120.598 30.337 1.00 0.00 C ATOM 72742 H3R PA 1753 13.659 120.289 30.861 1.00 0.00 H ATOM 72743 H3S PA 1753 12.956 121.556 29.853 1.00 0.00 H ATOM 72744 C12 PA 1753 12.234 119.601 29.254 1.00 0.00 C ATOM 72745 H2R PA 1753 11.805 118.709 29.713 1.00 0.00 H ATOM 72746 H2S PA 1753 13.140 119.249 28.756 1.00 0.00 H ATOM 72747 C11 PGR 1754 11.339 120.227 28.226 1.00 0.00 C ATOM 72748 O12 PGR 1754 10.803 121.349 28.286 1.00 0.00 O ATOM 72749 O11 PGR 1754 10.965 119.292 27.338 1.00 0.00 O ATOM 72750 C1 PGR 1754 9.783 119.534 26.505 1.00 0.00 C ATOM 72751 HR PGR 1754 10.167 120.387 25.939 1.00 0.00 H ATOM 72752 HS PGR 1754 8.927 119.711 27.161 1.00 0.00 H ATOM 72753 C2 PGR 1754 9.505 118.422 25.557 1.00 0.00 C ATOM 72754 HX PGR 1754 10.505 118.094 25.264 1.00 0.00 H ATOM 72755 C3 PGR 1754 8.702 118.933 24.364 1.00 0.00 C ATOM 72756 HA PGR 1754 9.229 119.755 23.872 1.00 0.00 H ATOM 72757 HB PGR 1754 7.759 119.321 24.758 1.00 0.00 H ATOM 72758 O31 PGR 1754 8.272 117.881 23.453 1.00 0.00 O ATOM 72759 P31 PGR 1754 7.689 118.211 22.004 1.00 0.00 P ATOM 72760 O32 PGR 1754 6.218 118.645 22.145 1.00 0.00 O ATOM 72761 C31 PGR 1754 5.905 120.012 22.635 1.00 0.00 C ATOM 72762 H1A PGR 1754 6.334 120.708 21.909 1.00 0.00 H ATOM 72763 H1B PGR 1754 6.349 120.226 23.611 1.00 0.00 H ATOM 72764 C32 PGR 1754 4.379 119.967 22.613 1.00 0.00 C ATOM 72765 H2A PGR 1754 3.931 119.301 23.355 1.00 0.00 H ATOM 72766 O35 PGR 1754 3.928 119.540 21.287 1.00 0.00 O ATOM 72767 HO5A PGR 1754 3.885 118.567 21.307 1.00 0.00 H ATOM 72768 C33 PGR 1754 3.705 121.395 22.856 1.00 0.00 C ATOM 72769 H3A PGR 1754 2.656 121.219 23.111 1.00 0.00 H ATOM 72770 H3B PGR 1754 4.194 121.932 23.672 1.00 0.00 H ATOM 72771 O33 PGR 1754 8.546 119.317 21.473 1.00 0.00 O ATOM 72772 O34 PGR 1754 7.649 116.948 21.305 1.00 0.00 O ATOM 72773 O21 PGR 1754 8.685 117.467 26.286 1.00 0.00 O ATOM 72774 C21 PGR 1754 9.378 116.534 27.013 1.00 0.00 C ATOM 72775 O22 PGR 1754 10.508 116.248 26.919 1.00 0.00 O ATOM 72776 O36 PGR 1754 3.776 122.225 21.678 1.00 0.00 O ATOM 72777 HO6A PGR 1754 3.281 121.845 20.930 1.00 0.00 H ATOM 72778 C12 OL 1755 8.433 115.882 27.954 1.00 0.00 C ATOM 72779 H2R OL 1755 7.607 116.531 28.251 1.00 0.00 H ATOM 72780 H2S OL 1755 7.795 115.195 27.394 1.00 0.00 H ATOM 72781 C13 OL 1755 9.045 115.320 29.174 1.00 0.00 C ATOM 72782 H3R OL 1755 8.267 114.724 29.657 1.00 0.00 H ATOM 72783 H3S OL 1755 9.873 114.664 28.901 1.00 0.00 H ATOM 72784 C14 OL 1755 9.491 116.475 30.073 1.00 0.00 C ATOM 72785 H4R OL 1755 10.488 116.739 29.714 1.00 0.00 H ATOM 72786 H4S OL 1755 8.934 117.402 29.921 1.00 0.00 H ATOM 72787 C15 OL 1755 9.703 116.092 31.529 1.00 0.00 C ATOM 72788 H5R OL 1755 8.823 115.890 32.143 1.00 0.00 H ATOM 72789 H5S OL 1755 10.195 115.135 31.347 1.00 0.00 H ATOM 72790 C16 OL 1755 10.702 116.885 32.275 1.00 0.00 C ATOM 72791 H6R OL 1755 11.696 116.874 31.821 1.00 0.00 H ATOM 72792 H6S OL 1755 10.430 117.932 32.133 1.00 0.00 H ATOM 72793 C17 OL 1755 10.658 116.534 33.752 1.00 0.00 C ATOM 72794 H7R OL 1755 9.718 116.893 34.178 1.00 0.00 H ATOM 72795 H7S OL 1755 10.728 115.473 34.002 1.00 0.00 H ATOM 72796 C18 OL 1755 11.645 117.294 34.612 1.00 0.00 C ATOM 72797 H8R OL 1755 12.581 116.763 34.431 1.00 0.00 H ATOM 72798 H8S OL 1755 11.811 118.273 34.156 1.00 0.00 H ATOM 72799 C19 OL 1755 11.321 117.134 36.062 1.00 0.00 C ATOM 72800 H9R OL 1755 11.607 116.189 36.518 1.00 0.00 H ATOM 72801 C110 OL 1755 10.753 118.094 36.796 1.00 0.00 C ATOM 72802 H10R OL 1755 10.835 117.857 37.853 1.00 0.00 H ATOM 72803 C111 OL 1755 10.338 119.398 36.241 1.00 0.00 C ATOM 72804 H11R OL 1755 11.134 120.093 36.518 1.00 0.00 H ATOM 72805 H11S OL 1755 10.190 119.310 35.163 1.00 0.00 H ATOM 72806 C112 OL 1755 8.970 119.843 36.802 1.00 0.00 C ATOM 72807 H12R OL 1755 9.009 119.825 37.893 1.00 0.00 H ATOM 72808 H12S OL 1755 8.840 120.867 36.444 1.00 0.00 H ATOM 72809 C113 OL 1755 7.873 118.888 36.402 1.00 0.00 C ATOM 72810 H13R OL 1755 7.714 118.881 35.321 1.00 0.00 H ATOM 72811 H13S OL 1755 8.153 117.890 36.745 1.00 0.00 H ATOM 72812 C114 OL 1755 6.478 119.224 37.086 1.00 0.00 C ATOM 72813 H14R OL 1755 5.995 120.050 36.560 1.00 0.00 H ATOM 72814 H14S OL 1755 5.784 118.426 36.815 1.00 0.00 H ATOM 72815 C115 OL 1755 6.471 119.452 38.636 1.00 0.00 C ATOM 72816 H15R OL 1755 6.985 120.383 38.884 1.00 0.00 H ATOM 72817 H15S OL 1755 5.448 119.782 38.826 1.00 0.00 H ATOM 72818 C116 OL 1755 6.960 118.323 39.514 1.00 0.00 C ATOM 72819 H16R OL 1755 6.125 117.631 39.645 1.00 0.00 H ATOM 72820 H16S OL 1755 7.815 117.828 39.047 1.00 0.00 H ATOM 72821 C117 OL 1755 7.339 118.783 41.016 1.00 0.00 C ATOM 72822 H17R OL 1755 8.313 119.278 41.036 1.00 0.00 H ATOM 72823 H17S OL 1755 6.617 119.516 41.382 1.00 0.00 H ATOM 72824 C118 OL 1755 7.323 117.678 42.038 1.00 0.00 C ATOM 72825 H18R OL 1755 7.535 118.108 43.019 1.00 0.00 H ATOM 72826 H18S OL 1755 8.032 116.898 41.752 1.00 0.00 H ATOM 72827 H18T OL 1755 6.317 117.259 42.109 1.00 0.00 H TER 72828 OL 1755 ATOM 72828 C116 PA 1756 113.059 22.719 41.457 1.00 0.00 C ATOM 72829 H16R PA 1756 112.607 23.571 41.969 1.00 0.00 H ATOM 72830 H16S PA 1756 114.111 22.829 41.729 1.00 0.00 H ATOM 72831 H16T PA 1756 112.520 21.892 41.923 1.00 0.00 H ATOM 72832 C115 PA 1756 112.747 22.780 40.003 1.00 0.00 C ATOM 72833 H15R PA 1756 112.884 23.790 39.612 1.00 0.00 H ATOM 72834 H15S PA 1756 111.686 22.573 39.853 1.00 0.00 H ATOM 72835 C114 PA 1756 113.613 21.871 39.147 1.00 0.00 C ATOM 72836 H14R PA 1756 113.463 20.868 39.550 1.00 0.00 H ATOM 72837 H14S PA 1756 114.643 22.233 39.182 1.00 0.00 H ATOM 72838 C113 PA 1756 113.120 21.873 37.690 1.00 0.00 C ATOM 72839 H13R PA 1756 112.040 21.728 37.619 1.00 0.00 H ATOM 72840 H13S PA 1756 113.540 20.984 37.215 1.00 0.00 H ATOM 72841 C112 PA 1756 113.594 23.140 36.846 1.00 0.00 C ATOM 72842 H12R PA 1756 114.679 23.116 36.965 1.00 0.00 H ATOM 72843 H12S PA 1756 113.143 24.046 37.256 1.00 0.00 H ATOM 72844 C111 PA 1756 113.397 22.914 35.379 1.00 0.00 C ATOM 72845 H11R PA 1756 113.939 21.992 35.155 1.00 0.00 H ATOM 72846 H11S PA 1756 113.821 23.754 34.824 1.00 0.00 H ATOM 72847 C110 PA 1756 112.033 22.959 34.793 1.00 0.00 C ATOM 72848 H10R PA 1756 111.466 23.848 35.079 1.00 0.00 H ATOM 72849 H10S PA 1756 111.498 22.082 35.162 1.00 0.00 H ATOM 72850 C19 PA 1756 111.886 22.718 33.324 1.00 0.00 C ATOM 72851 H9R PA 1756 112.282 21.711 33.178 1.00 0.00 H ATOM 72852 H9S PA 1756 112.472 23.505 32.844 1.00 0.00 H ATOM 72853 C18 PA 1756 110.439 22.828 32.773 1.00 0.00 C ATOM 72854 H8R PA 1756 109.967 23.752 33.113 1.00 0.00 H ATOM 72855 H8S PA 1756 109.844 21.972 33.100 1.00 0.00 H ATOM 72856 C17 PA 1756 110.365 23.029 31.232 1.00 0.00 C ATOM 72857 H7R PA 1756 111.013 22.262 30.803 1.00 0.00 H ATOM 72858 H7S PA 1756 110.690 24.016 30.893 1.00 0.00 H ATOM 72859 C16 PA 1756 108.969 22.694 30.615 1.00 0.00 C ATOM 72860 H6R PA 1756 108.399 23.594 30.856 1.00 0.00 H ATOM 72861 H6S PA 1756 108.521 21.791 31.035 1.00 0.00 H ATOM 72862 C15 PA 1756 108.830 22.484 29.136 1.00 0.00 C ATOM 72863 H5R PA 1756 109.321 21.607 28.709 1.00 0.00 H ATOM 72864 H5S PA 1756 109.207 23.382 28.643 1.00 0.00 H ATOM 72865 C14 PA 1756 107.364 22.374 28.777 1.00 0.00 C ATOM 72866 H4R PA 1756 106.868 23.288 29.111 1.00 0.00 H ATOM 72867 H4S PA 1756 106.782 21.546 29.188 1.00 0.00 H ATOM 72868 C13 PA 1756 107.192 22.283 27.288 1.00 0.00 C ATOM 72869 H3R PA 1756 107.712 21.343 27.090 1.00 0.00 H ATOM 72870 H3S PA 1756 107.817 22.933 26.673 1.00 0.00 H ATOM 72871 C12 PA 1756 105.774 22.323 26.830 1.00 0.00 C ATOM 72872 H2R PA 1756 105.359 23.332 26.876 1.00 0.00 H ATOM 72873 H2S PA 1756 105.026 21.696 27.318 1.00 0.00 H ATOM 72874 C11 PGR 1757 105.648 21.921 25.333 1.00 0.00 C ATOM 72875 O12 PGR 1757 106.394 21.101 24.817 1.00 0.00 O ATOM 72876 O11 PGR 1757 104.695 22.641 24.662 1.00 0.00 O ATOM 72877 C1 PGR 1757 104.736 22.651 23.204 1.00 0.00 C ATOM 72878 HR PGR 1757 104.671 21.626 22.829 1.00 0.00 H ATOM 72879 HS PGR 1757 105.693 23.045 22.853 1.00 0.00 H ATOM 72880 C2 PGR 1757 103.492 23.402 22.704 1.00 0.00 C ATOM 72881 HX PGR 1757 103.468 23.416 21.612 1.00 0.00 H ATOM 72882 C3 PGR 1757 103.406 24.882 23.147 1.00 0.00 C ATOM 72883 HA PGR 1757 104.316 25.442 22.916 1.00 0.00 H ATOM 72884 HB PGR 1757 103.313 24.811 24.233 1.00 0.00 H ATOM 72885 O31 PGR 1757 102.362 25.592 22.733 1.00 0.00 O ATOM 72886 P31 PGR 1757 101.903 25.840 21.187 1.00 0.00 P ATOM 72887 O32 PGR 1757 101.015 24.559 20.894 1.00 0.00 O ATOM 72888 C31 PGR 1757 99.722 24.390 21.446 1.00 0.00 C ATOM 72889 H1A PGR 1757 99.162 25.311 21.260 1.00 0.00 H ATOM 72890 H1B PGR 1757 99.853 24.273 22.525 1.00 0.00 H ATOM 72891 C32 PGR 1757 98.960 23.278 20.827 1.00 0.00 C ATOM 72892 H2A PGR 1757 99.493 22.326 20.895 1.00 0.00 H ATOM 72893 O35 PGR 1757 98.865 23.683 19.474 1.00 0.00 O ATOM 72894 HO5A PGR 1757 99.800 23.911 19.324 1.00 0.00 H ATOM 72895 C33 PGR 1757 97.530 23.238 21.420 1.00 0.00 C ATOM 72896 H3A PGR 1757 97.480 23.090 22.502 1.00 0.00 H ATOM 72897 H3B PGR 1757 96.985 24.163 21.217 1.00 0.00 H ATOM 72898 O33 PGR 1757 100.967 27.011 21.212 1.00 0.00 O ATOM 72899 O34 PGR 1757 103.059 25.868 20.228 1.00 0.00 O ATOM 72900 O21 PGR 1757 102.269 22.960 23.285 1.00 0.00 O ATOM 72901 C21 PGR 1757 101.842 21.764 23.022 1.00 0.00 C ATOM 72902 O22 PGR 1757 102.480 20.954 22.432 1.00 0.00 O ATOM 72903 O36 PGR 1757 96.895 22.107 20.802 1.00 0.00 O ATOM 72904 HO6A PGR 1757 95.949 22.303 20.681 1.00 0.00 H ATOM 72905 C12 OL 1758 100.416 21.528 23.522 1.00 0.00 C ATOM 72906 H2R OL 1758 99.868 22.471 23.580 1.00 0.00 H ATOM 72907 H2S OL 1758 99.966 20.834 22.810 1.00 0.00 H ATOM 72908 C13 OL 1758 100.428 20.874 24.870 1.00 0.00 C ATOM 72909 H3R OL 1758 99.392 20.581 25.051 1.00 0.00 H ATOM 72910 H3S OL 1758 101.054 19.987 24.986 1.00 0.00 H ATOM 72911 C14 OL 1758 100.858 21.911 25.881 1.00 0.00 C ATOM 72912 H4R OL 1758 101.919 21.877 26.140 1.00 0.00 H ATOM 72913 H4S OL 1758 100.668 22.912 25.489 1.00 0.00 H ATOM 72914 C15 OL 1758 100.203 21.895 27.244 1.00 0.00 C ATOM 72915 H5R OL 1758 100.514 22.689 27.925 1.00 0.00 H ATOM 72916 H5S OL 1758 99.153 22.149 27.083 1.00 0.00 H ATOM 72917 C16 OL 1758 100.246 20.549 28.010 1.00 0.00 C ATOM 72918 H6R OL 1758 99.795 19.799 27.357 1.00 0.00 H ATOM 72919 H6S OL 1758 101.277 20.242 28.194 1.00 0.00 H ATOM 72920 C17 OL 1758 99.651 20.366 29.413 1.00 0.00 C ATOM 72921 H7R OL 1758 98.569 20.215 29.424 1.00 0.00 H ATOM 72922 H7S OL 1758 100.036 19.437 29.840 1.00 0.00 H ATOM 72923 C18 OL 1758 100.023 21.477 30.401 1.00 0.00 C ATOM 72924 H8R OL 1758 99.463 22.351 30.059 1.00 0.00 H ATOM 72925 H8S OL 1758 99.636 21.181 31.378 1.00 0.00 H ATOM 72926 C19 OL 1758 101.464 21.836 30.574 1.00 0.00 C ATOM 72927 H9R OL 1758 101.912 22.322 29.711 1.00 0.00 H ATOM 72928 C110 OL 1758 102.216 21.538 31.591 1.00 0.00 C ATOM 72929 H10R OL 1758 103.285 21.729 31.531 1.00 0.00 H ATOM 72930 C111 OL 1758 101.780 20.921 32.930 1.00 0.00 C ATOM 72931 H11R OL 1758 100.698 20.791 33.009 1.00 0.00 H ATOM 72932 H11S OL 1758 102.177 19.918 33.100 1.00 0.00 H ATOM 72933 C112 OL 1758 102.329 21.774 34.009 1.00 0.00 C ATOM 72934 H12R OL 1758 103.408 21.648 33.895 1.00 0.00 H ATOM 72935 H12S OL 1758 102.056 22.829 33.936 1.00 0.00 H ATOM 72936 C113 OL 1758 102.011 21.209 35.348 1.00 0.00 C ATOM 72937 H13R OL 1758 100.972 21.328 35.663 1.00 0.00 H ATOM 72938 H13S OL 1758 101.964 20.120 35.283 1.00 0.00 H ATOM 72939 C114 OL 1758 103.049 21.688 36.422 1.00 0.00 C ATOM 72940 H14R OL 1758 103.947 21.077 36.308 1.00 0.00 H ATOM 72941 H14S OL 1758 103.280 22.685 36.041 1.00 0.00 H ATOM 72942 C115 OL 1758 102.512 21.976 37.747 1.00 0.00 C ATOM 72943 H15R OL 1758 102.904 22.963 38.004 1.00 0.00 H ATOM 72944 H15S OL 1758 101.433 22.130 37.682 1.00 0.00 H ATOM 72945 C116 OL 1758 102.637 20.975 38.884 1.00 0.00 C ATOM 72946 H16R OL 1758 102.066 21.237 39.777 1.00 0.00 H ATOM 72947 H16S OL 1758 102.273 19.995 38.570 1.00 0.00 H ATOM 72948 C117 OL 1758 104.004 20.792 39.550 1.00 0.00 C ATOM 72949 H17R OL 1758 103.733 19.968 40.214 1.00 0.00 H ATOM 72950 H17S OL 1758 104.810 20.503 38.872 1.00 0.00 H ATOM 72951 C118 OL 1758 104.583 21.972 40.364 1.00 0.00 C ATOM 72952 H18R OL 1758 105.539 21.733 40.835 1.00 0.00 H ATOM 72953 H18S OL 1758 103.959 22.164 41.240 1.00 0.00 H ATOM 72954 H18T OL 1758 104.663 22.846 39.715 1.00 0.00 H TER 72955 OL 1758 ATOM 72955 C116 PA 1759 9.140 20.957 40.728 1.00 0.00 C ATOM 72956 H16R PA 1759 8.157 21.268 41.089 1.00 0.00 H ATOM 72957 H16S PA 1759 9.730 21.710 41.256 1.00 0.00 H ATOM 72958 H16T PA 1759 9.304 19.946 41.108 1.00 0.00 H ATOM 72959 C115 PA 1759 9.365 20.985 39.211 1.00 0.00 C ATOM 72960 H15R PA 1759 8.702 20.322 38.651 1.00 0.00 H ATOM 72961 H15S PA 1759 10.411 20.690 39.103 1.00 0.00 H ATOM 72962 C114 PA 1759 9.260 22.408 38.631 1.00 0.00 C ATOM 72963 H14R PA 1759 9.917 23.020 39.253 1.00 0.00 H ATOM 72964 H14S PA 1759 8.274 22.871 38.715 1.00 0.00 H ATOM 72965 C113 PA 1759 9.700 22.524 37.140 1.00 0.00 C ATOM 72966 H13R PA 1759 9.030 21.874 36.572 1.00 0.00 H ATOM 72967 H13S PA 1759 10.642 22.006 36.949 1.00 0.00 H ATOM 72968 C112 PA 1759 9.733 23.996 36.578 1.00 0.00 C ATOM 72969 H12R PA 1759 10.701 24.417 36.859 1.00 0.00 H ATOM 72970 H12S PA 1759 8.910 24.528 37.061 1.00 0.00 H ATOM 72971 C111 PA 1759 9.642 23.946 35.142 1.00 0.00 C ATOM 72972 H11R PA 1759 8.657 23.547 34.890 1.00 0.00 H ATOM 72973 H11S PA 1759 10.367 23.256 34.708 1.00 0.00 H ATOM 72974 C110 PA 1759 9.726 25.322 34.379 1.00 0.00 C ATOM 72975 H10R PA 1759 10.696 25.800 34.533 1.00 0.00 H ATOM 72976 H10S PA 1759 9.004 26.010 34.823 1.00 0.00 H ATOM 72977 C19 PA 1759 9.684 25.273 32.851 1.00 0.00 C ATOM 72978 H9R PA 1759 8.719 24.921 32.479 1.00 0.00 H ATOM 72979 H9S PA 1759 10.453 24.611 32.448 1.00 0.00 H ATOM 72980 C18 PA 1759 10.014 26.666 32.270 1.00 0.00 C ATOM 72981 H8R PA 1759 11.057 26.835 32.544 1.00 0.00 H ATOM 72982 H8S PA 1759 9.401 27.434 32.747 1.00 0.00 H ATOM 72983 C17 PA 1759 9.713 26.637 30.706 1.00 0.00 C ATOM 72984 H7R PA 1759 8.643 26.464 30.576 1.00 0.00 H ATOM 72985 H7S PA 1759 10.244 25.794 30.258 1.00 0.00 H ATOM 72986 C16 PA 1759 10.181 27.863 29.868 1.00 0.00 C ATOM 72987 H6R PA 1759 11.206 28.086 30.170 1.00 0.00 H ATOM 72988 H6S PA 1759 9.651 28.785 30.119 1.00 0.00 H ATOM 72989 C15 PA 1759 10.133 27.710 28.317 1.00 0.00 C ATOM 72990 H5R PA 1759 10.971 27.228 27.810 1.00 0.00 H ATOM 72991 H5S PA 1759 10.297 28.737 27.984 1.00 0.00 H ATOM 72992 C14 PA 1759 8.723 27.288 27.742 1.00 0.00 C ATOM 72993 H4R PA 1759 8.110 28.192 27.759 1.00 0.00 H ATOM 72994 H4S PA 1759 8.188 26.694 28.486 1.00 0.00 H ATOM 72995 C13 PA 1759 8.685 26.729 26.374 1.00 0.00 C ATOM 72996 H3R PA 1759 9.110 27.509 25.738 1.00 0.00 H ATOM 72997 H3S PA 1759 7.645 26.877 26.076 1.00 0.00 H ATOM 72998 C12 PA 1759 9.263 25.340 26.181 1.00 0.00 C ATOM 72999 H2R PA 1759 10.343 25.397 26.332 1.00 0.00 H ATOM 73000 H2S PA 1759 8.876 24.671 26.952 1.00 0.00 H ATOM 73001 C11 PGR 1760 8.927 24.766 24.824 1.00 0.00 C ATOM 73002 O12 PGR 1760 8.099 25.289 24.050 1.00 0.00 O ATOM 73003 O11 PGR 1760 9.693 23.703 24.456 1.00 0.00 O ATOM 73004 C1 PGR 1760 9.386 22.945 23.230 1.00 0.00 C ATOM 73005 HR PGR 1760 10.044 23.396 22.483 1.00 0.00 H ATOM 73006 HS PGR 1760 8.326 23.077 22.999 1.00 0.00 H ATOM 73007 C2 PGR 1760 9.821 21.514 23.543 1.00 0.00 C ATOM 73008 HX PGR 1760 10.833 21.535 23.956 1.00 0.00 H ATOM 73009 C3 PGR 1760 9.664 20.587 22.294 1.00 0.00 C ATOM 73010 HA PGR 1760 9.814 19.521 22.482 1.00 0.00 H ATOM 73011 HB PGR 1760 10.483 20.819 21.608 1.00 0.00 H ATOM 73012 O31 PGR 1760 8.412 20.733 21.622 1.00 0.00 O ATOM 73013 P31 PGR 1760 8.235 20.335 20.128 1.00 0.00 P ATOM 73014 O32 PGR 1760 9.216 21.317 19.256 1.00 0.00 O ATOM 73015 C31 PGR 1760 8.840 22.716 19.305 1.00 0.00 C ATOM 73016 H1A PGR 1760 8.820 22.984 20.364 1.00 0.00 H ATOM 73017 H1B PGR 1760 7.940 22.898 18.712 1.00 0.00 H ATOM 73018 C32 PGR 1760 9.892 23.620 18.651 1.00 0.00 C ATOM 73019 H2A PGR 1760 9.761 24.600 19.117 1.00 0.00 H ATOM 73020 O35 PGR 1760 9.666 23.654 17.198 1.00 0.00 O ATOM 73021 HO5A PGR 1760 10.598 23.672 16.916 1.00 0.00 H ATOM 73022 C33 PGR 1760 11.314 23.085 18.904 1.00 0.00 C ATOM 73023 H3A PGR 1760 11.306 22.539 19.851 1.00 0.00 H ATOM 73024 H3B PGR 1760 11.637 22.329 18.183 1.00 0.00 H ATOM 73025 O33 PGR 1760 8.736 18.938 19.948 1.00 0.00 O ATOM 73026 O34 PGR 1760 6.770 20.547 19.886 1.00 0.00 O ATOM 73027 O21 PGR 1760 8.919 21.065 24.570 1.00 0.00 O ATOM 73028 C21 PGR 1760 9.170 19.884 25.191 1.00 0.00 C ATOM 73029 O22 PGR 1760 10.178 19.196 25.025 1.00 0.00 O ATOM 73030 O36 PGR 1760 12.250 24.087 18.834 1.00 0.00 O ATOM 73031 HO6A PGR 1760 13.113 23.637 18.875 1.00 0.00 H ATOM 73032 C12 OL 1761 7.952 19.585 26.089 1.00 0.00 C ATOM 73033 H2R OL 1761 7.705 20.509 26.616 1.00 0.00 H ATOM 73034 H2S OL 1761 7.120 19.239 25.472 1.00 0.00 H ATOM 73035 C13 OL 1761 8.032 18.680 27.290 1.00 0.00 C ATOM 73036 H3R OL 1761 7.881 17.631 27.028 1.00 0.00 H ATOM 73037 H3S OL 1761 9.053 18.693 27.676 1.00 0.00 H ATOM 73038 C14 OL 1761 7.027 19.084 28.428 1.00 0.00 C ATOM 73039 H4R OL 1761 7.178 20.120 28.738 1.00 0.00 H ATOM 73040 H4S OL 1761 6.001 19.069 28.055 1.00 0.00 H ATOM 73041 C15 OL 1761 7.020 18.044 29.602 1.00 0.00 C ATOM 73042 H5R OL 1761 6.375 17.256 29.207 1.00 0.00 H ATOM 73043 H5S OL 1761 8.007 17.578 29.569 1.00 0.00 H ATOM 73044 C16 OL 1761 6.493 18.638 30.980 1.00 0.00 C ATOM 73045 H6R OL 1761 7.337 19.123 31.475 1.00 0.00 H ATOM 73046 H6S OL 1761 5.809 19.453 30.734 1.00 0.00 H ATOM 73047 C17 OL 1761 5.765 17.636 31.847 1.00 0.00 C ATOM 73048 H7R OL 1761 4.963 17.245 31.217 1.00 0.00 H ATOM 73049 H7S OL 1761 6.307 16.725 32.110 1.00 0.00 H ATOM 73050 C18 OL 1761 5.081 18.409 32.952 1.00 0.00 C ATOM 73051 H8R OL 1761 4.349 19.149 32.621 1.00 0.00 H ATOM 73052 H8S OL 1761 4.590 17.667 33.585 1.00 0.00 H ATOM 73053 C19 OL 1761 6.120 19.029 33.792 1.00 0.00 C ATOM 73054 H9R OL 1761 6.600 19.884 33.323 1.00 0.00 H ATOM 73055 C110 OL 1761 6.488 18.675 34.983 1.00 0.00 C ATOM 73056 H10R OL 1761 7.172 19.313 35.538 1.00 0.00 H ATOM 73057 C111 OL 1761 5.862 17.560 35.811 1.00 0.00 C ATOM 73058 H11R OL 1761 5.044 18.005 36.381 1.00 0.00 H ATOM 73059 H11S OL 1761 5.444 16.771 35.182 1.00 0.00 H ATOM 73060 C112 OL 1761 6.828 17.049 36.863 1.00 0.00 C ATOM 73061 H12R OL 1761 7.634 16.543 36.327 1.00 0.00 H ATOM 73062 H12S OL 1761 7.219 17.941 37.357 1.00 0.00 H ATOM 73063 C113 OL 1761 6.144 16.143 37.875 1.00 0.00 C ATOM 73064 H13R OL 1761 5.444 16.776 38.425 1.00 0.00 H ATOM 73065 H13S OL 1761 5.603 15.342 37.366 1.00 0.00 H ATOM 73066 C114 OL 1761 7.137 15.621 38.872 1.00 0.00 C ATOM 73067 H14R OL 1761 7.861 14.997 38.344 1.00 0.00 H ATOM 73068 H14S OL 1761 7.841 16.404 39.159 1.00 0.00 H ATOM 73069 C115 OL 1761 6.517 14.957 40.085 1.00 0.00 C ATOM 73070 H15R OL 1761 5.987 15.765 40.593 1.00 0.00 H ATOM 73071 H15S OL 1761 5.920 14.098 39.773 1.00 0.00 H ATOM 73072 C116 OL 1761 7.448 14.411 41.205 1.00 0.00 C ATOM 73073 H16R OL 1761 8.120 15.174 41.603 1.00 0.00 H ATOM 73074 H16S OL 1761 6.781 14.119 42.019 1.00 0.00 H ATOM 73075 C117 OL 1761 8.396 13.298 40.841 1.00 0.00 C ATOM 73076 H17R OL 1761 7.807 12.433 40.528 1.00 0.00 H ATOM 73077 H17S OL 1761 9.141 13.518 40.073 1.00 0.00 H ATOM 73078 C118 OL 1761 9.151 12.703 42.051 1.00 0.00 C ATOM 73079 H18R OL 1761 9.598 13.499 42.650 1.00 0.00 H ATOM 73080 H18S OL 1761 9.929 11.967 41.839 1.00 0.00 H ATOM 73081 H18T OL 1761 8.450 12.196 42.716 1.00 0.00 H TER 73082 OL 1761 ATOM 73082 C116 PA 1762 95.326 65.540 37.608 1.00 0.00 C ATOM 73083 H16R PA 1762 94.476 65.688 38.278 1.00 0.00 H ATOM 73084 H16S PA 1762 95.639 64.554 37.957 1.00 0.00 H ATOM 73085 H16T PA 1762 94.936 65.522 36.588 1.00 0.00 H ATOM 73086 C115 PA 1762 96.249 66.710 37.810 1.00 0.00 C ATOM 73087 H15R PA 1762 96.463 66.651 38.880 1.00 0.00 H ATOM 73088 H15S PA 1762 95.809 67.666 37.519 1.00 0.00 H ATOM 73089 C114 PA 1762 97.469 66.564 36.962 1.00 0.00 C ATOM 73090 H14R PA 1762 98.026 67.498 37.058 1.00 0.00 H ATOM 73091 H14S PA 1762 97.175 66.346 35.933 1.00 0.00 H ATOM 73092 C113 PA 1762 98.347 65.372 37.268 1.00 0.00 C ATOM 73093 H13R PA 1762 97.784 64.437 37.260 1.00 0.00 H ATOM 73094 H13S PA 1762 98.695 65.329 38.302 1.00 0.00 H ATOM 73095 C112 PA 1762 99.514 65.249 36.275 1.00 0.00 C ATOM 73096 H12R PA 1762 99.246 65.373 35.224 1.00 0.00 H ATOM 73097 H12S PA 1762 99.853 64.213 36.342 1.00 0.00 H ATOM 73098 C111 PA 1762 100.803 66.073 36.353 1.00 0.00 C ATOM 73099 H11R PA 1762 100.892 66.626 37.290 1.00 0.00 H ATOM 73100 H11S PA 1762 100.836 66.881 35.619 1.00 0.00 H ATOM 73101 C110 PA 1762 102.088 65.234 36.334 1.00 0.00 C ATOM 73102 H10R PA 1762 102.054 64.519 37.159 1.00 0.00 H ATOM 73103 H10S PA 1762 102.977 65.861 36.424 1.00 0.00 H ATOM 73104 C19 PA 1762 102.429 64.486 34.991 1.00 0.00 C ATOM 73105 H9R PA 1762 101.488 63.957 34.823 1.00 0.00 H ATOM 73106 H9S PA 1762 103.207 63.749 35.198 1.00 0.00 H ATOM 73107 C18 PA 1762 102.782 65.363 33.810 1.00 0.00 C ATOM 73108 H8R PA 1762 103.485 66.054 34.279 1.00 0.00 H ATOM 73109 H8S PA 1762 101.820 65.872 33.715 1.00 0.00 H ATOM 73110 C17 PA 1762 103.431 64.522 32.649 1.00 0.00 C ATOM 73111 H7R PA 1762 102.979 63.533 32.743 1.00 0.00 H ATOM 73112 H7S PA 1762 104.486 64.482 32.928 1.00 0.00 H ATOM 73113 C16 PA 1762 103.289 64.972 31.212 1.00 0.00 C ATOM 73114 H6R PA 1762 103.733 65.967 31.132 1.00 0.00 H ATOM 73115 H6S PA 1762 102.244 65.107 30.926 1.00 0.00 H ATOM 73116 C15 PA 1762 104.094 64.137 30.240 1.00 0.00 C ATOM 73117 H5R PA 1762 103.797 63.098 30.079 1.00 0.00 H ATOM 73118 H5S PA 1762 105.111 64.088 30.633 1.00 0.00 H ATOM 73119 C14 PA 1762 104.207 64.837 28.861 1.00 0.00 C ATOM 73120 H4R PA 1762 104.744 65.780 28.979 1.00 0.00 H ATOM 73121 H4S PA 1762 103.192 65.059 28.526 1.00 0.00 H ATOM 73122 C13 PA 1762 104.763 63.809 27.851 1.00 0.00 C ATOM 73123 H3R PA 1762 105.046 64.296 26.916 1.00 0.00 H ATOM 73124 H3S PA 1762 104.013 63.071 27.561 1.00 0.00 H ATOM 73125 C12 PA 1762 106.015 62.982 28.290 1.00 0.00 C ATOM 73126 H2R PA 1762 105.752 62.256 29.062 1.00 0.00 H ATOM 73127 H2S PA 1762 106.718 63.653 28.788 1.00 0.00 H ATOM 73128 C11 PGR 1763 106.615 62.228 27.132 1.00 0.00 C ATOM 73129 O12 PGR 1763 107.166 62.836 26.221 1.00 0.00 O ATOM 73130 O11 PGR 1763 106.181 60.913 27.062 1.00 0.00 O ATOM 73131 C1 PGR 1763 106.613 60.123 25.937 1.00 0.00 C ATOM 73132 HR PGR 1763 106.397 60.801 25.108 1.00 0.00 H ATOM 73133 HS PGR 1763 106.009 59.223 25.796 1.00 0.00 H ATOM 73134 C2 PGR 1763 108.141 59.734 25.979 1.00 0.00 C ATOM 73135 HX PGR 1763 108.712 60.652 26.142 1.00 0.00 H ATOM 73136 C3 PGR 1763 108.590 59.266 24.630 1.00 0.00 C ATOM 73137 HA PGR 1763 109.591 58.843 24.745 1.00 0.00 H ATOM 73138 HB PGR 1763 108.621 60.064 23.884 1.00 0.00 H ATOM 73139 O31 PGR 1763 107.665 58.271 24.195 1.00 0.00 O ATOM 73140 P31 PGR 1763 107.611 57.756 22.692 1.00 0.00 P ATOM 73141 O32 PGR 1763 108.522 56.514 22.755 1.00 0.00 O ATOM 73142 C31 PGR 1763 109.916 56.585 22.498 1.00 0.00 C ATOM 73143 H1A PGR 1763 110.433 57.220 23.222 1.00 0.00 H ATOM 73144 H1B PGR 1763 110.074 56.921 21.470 1.00 0.00 H ATOM 73145 C32 PGR 1763 110.448 55.113 22.503 1.00 0.00 C ATOM 73146 H2A PGR 1763 111.403 55.138 21.973 1.00 0.00 H ATOM 73147 O35 PGR 1763 109.591 54.265 21.739 1.00 0.00 O ATOM 73148 HO5A PGR 1763 109.993 53.379 21.789 1.00 0.00 H ATOM 73149 C33 PGR 1763 110.701 54.495 23.884 1.00 0.00 C ATOM 73150 H3A PGR 1763 111.105 53.500 23.679 1.00 0.00 H ATOM 73151 H3B PGR 1763 111.443 55.060 24.455 1.00 0.00 H ATOM 73152 O33 PGR 1763 106.185 57.288 22.621 1.00 0.00 O ATOM 73153 O34 PGR 1763 108.043 58.774 21.788 1.00 0.00 O ATOM 73154 O21 PGR 1763 108.331 58.708 26.978 1.00 0.00 O ATOM 73155 C21 PGR 1763 108.347 58.977 28.280 1.00 0.00 C ATOM 73156 O22 PGR 1763 108.122 60.073 28.759 1.00 0.00 O ATOM 73157 O36 PGR 1763 109.453 54.487 24.618 1.00 0.00 O ATOM 73158 HO6A PGR 1763 109.655 54.513 25.571 1.00 0.00 H ATOM 73159 C12 OL 1764 109.068 57.846 29.068 1.00 0.00 C ATOM 73160 H2R OL 1764 109.280 56.950 28.482 1.00 0.00 H ATOM 73161 H2S OL 1764 110.065 58.188 29.353 1.00 0.00 H ATOM 73162 C13 OL 1764 108.414 57.620 30.437 1.00 0.00 C ATOM 73163 H3R OL 1764 107.424 57.240 30.178 1.00 0.00 H ATOM 73164 H3S OL 1764 108.702 56.652 30.854 1.00 0.00 H ATOM 73165 C14 OL 1764 108.623 58.684 31.555 1.00 0.00 C ATOM 73166 H4R OL 1764 109.596 59.114 31.311 1.00 0.00 H ATOM 73167 H4S OL 1764 107.957 59.542 31.447 1.00 0.00 H ATOM 73168 C15 OL 1764 108.584 58.206 33.023 1.00 0.00 C ATOM 73169 H5R OL 1764 107.631 57.762 33.318 1.00 0.00 H ATOM 73170 H5S OL 1764 109.302 57.383 33.044 1.00 0.00 H ATOM 73171 C16 OL 1764 108.950 59.180 34.088 1.00 0.00 C ATOM 73172 H6R OL 1764 109.812 59.776 33.780 1.00 0.00 H ATOM 73173 H6S OL 1764 108.230 59.979 34.275 1.00 0.00 H ATOM 73174 C17 OL 1764 109.498 58.606 35.447 1.00 0.00 C ATOM 73175 H7R OL 1764 108.745 57.896 35.796 1.00 0.00 H ATOM 73176 H7S OL 1764 110.401 58.009 35.306 1.00 0.00 H ATOM 73177 C18 OL 1764 109.904 59.727 36.390 1.00 0.00 C ATOM 73178 H8R OL 1764 110.737 60.222 35.886 1.00 0.00 H ATOM 73179 H8S OL 1764 109.210 60.560 36.524 1.00 0.00 H ATOM 73180 C19 OL 1764 110.379 59.266 37.694 1.00 0.00 C ATOM 73181 H9R OL 1764 111.264 58.638 37.757 1.00 0.00 H ATOM 73182 C110 OL 1764 109.802 59.500 38.911 1.00 0.00 C ATOM 73183 H10R OL 1764 110.350 59.100 39.760 1.00 0.00 H ATOM 73184 C111 OL 1764 108.546 60.145 39.305 1.00 0.00 C ATOM 73185 H11R OL 1764 107.813 59.700 38.630 1.00 0.00 H ATOM 73186 H11S OL 1764 108.290 59.772 40.299 1.00 0.00 H ATOM 73187 C112 OL 1764 108.642 61.639 39.114 1.00 0.00 C ATOM 73188 H12R OL 1764 109.278 62.037 39.907 1.00 0.00 H ATOM 73189 H12S OL 1764 109.025 61.944 38.138 1.00 0.00 H ATOM 73190 C113 OL 1764 107.316 62.428 39.348 1.00 0.00 C ATOM 73191 H13R OL 1764 106.721 62.051 40.183 1.00 0.00 H ATOM 73192 H13S OL 1764 107.582 63.453 39.614 1.00 0.00 H ATOM 73193 C114 OL 1764 106.380 62.273 38.181 1.00 0.00 C ATOM 73194 H14R OL 1764 106.913 62.394 37.236 1.00 0.00 H ATOM 73195 H14S OL 1764 105.813 61.347 38.296 1.00 0.00 H ATOM 73196 C115 OL 1764 105.341 63.430 38.127 1.00 0.00 C ATOM 73197 H15R OL 1764 105.793 64.339 37.725 1.00 0.00 H ATOM 73198 H15S OL 1764 104.600 63.258 37.344 1.00 0.00 H ATOM 73199 C116 OL 1764 104.475 63.712 39.300 1.00 0.00 C ATOM 73200 H16R OL 1764 105.086 63.743 40.204 1.00 0.00 H ATOM 73201 H16S OL 1764 103.968 64.678 39.243 1.00 0.00 H ATOM 73202 C117 OL 1764 103.470 62.709 39.634 1.00 0.00 C ATOM 73203 H17R OL 1764 102.829 62.529 38.768 1.00 0.00 H ATOM 73204 H17S OL 1764 103.973 61.759 39.828 1.00 0.00 H ATOM 73205 C118 OL 1764 102.576 63.057 40.804 1.00 0.00 C ATOM 73206 H18R OL 1764 101.771 62.357 41.035 1.00 0.00 H ATOM 73207 H18S OL 1764 102.197 64.077 40.710 1.00 0.00 H ATOM 73208 H18T OL 1764 103.139 63.194 41.730 1.00 0.00 H TER 73209 OL 1764 ATOM 73209 C116 PA 1765 126.546 98.947 44.459 1.00 0.00 C ATOM 73210 H16R PA 1765 126.641 99.960 44.061 1.00 0.00 H ATOM 73211 H16S PA 1765 127.249 98.798 45.281 1.00 0.00 H ATOM 73212 H16T PA 1765 125.545 98.786 44.863 1.00 0.00 H ATOM 73213 C115 PA 1765 126.741 97.923 43.344 1.00 0.00 C ATOM 73214 H15R PA 1765 126.635 96.961 43.850 1.00 0.00 H ATOM 73215 H15S PA 1765 127.766 97.950 42.969 1.00 0.00 H ATOM 73216 C114 PA 1765 125.759 98.141 42.191 1.00 0.00 C ATOM 73217 H14R PA 1765 125.811 99.200 41.933 1.00 0.00 H ATOM 73218 H14S PA 1765 124.771 97.906 42.591 1.00 0.00 H ATOM 73219 C113 PA 1765 126.036 97.164 41.063 1.00 0.00 C ATOM 73220 H13R PA 1765 125.853 96.173 41.485 1.00 0.00 H ATOM 73221 H13S PA 1765 127.091 97.013 40.826 1.00 0.00 H ATOM 73222 C112 PA 1765 125.286 97.418 39.700 1.00 0.00 C ATOM 73223 H12R PA 1765 124.207 97.251 39.700 1.00 0.00 H ATOM 73224 H12S PA 1765 125.571 96.630 38.999 1.00 0.00 H ATOM 73225 C111 PA 1765 125.867 98.692 39.013 1.00 0.00 C ATOM 73226 H11R PA 1765 125.699 99.513 39.712 1.00 0.00 H ATOM 73227 H11S PA 1765 125.351 99.025 38.110 1.00 0.00 H ATOM 73228 C110 PA 1765 127.393 98.705 38.712 1.00 0.00 C ATOM 73229 H10R PA 1765 127.637 97.687 38.401 1.00 0.00 H ATOM 73230 H10S PA 1765 127.931 98.696 39.662 1.00 0.00 H ATOM 73231 C19 PA 1765 127.891 99.724 37.751 1.00 0.00 C ATOM 73232 H9R PA 1765 127.515 100.643 38.207 1.00 0.00 H ATOM 73233 H9S PA 1765 127.281 99.678 36.847 1.00 0.00 H ATOM 73234 C18 PA 1765 129.320 99.636 37.394 1.00 0.00 C ATOM 73235 H8R PA 1765 129.624 98.602 37.214 1.00 0.00 H ATOM 73236 H8S PA 1765 129.873 100.093 38.217 1.00 0.00 H ATOM 73237 C17 PA 1765 129.753 100.644 36.224 1.00 0.00 C ATOM 73238 H7R PA 1765 129.643 101.696 36.496 1.00 0.00 H ATOM 73239 H7S PA 1765 129.048 100.497 35.403 1.00 0.00 H ATOM 73240 C16 PA 1765 131.237 100.468 35.766 1.00 0.00 C ATOM 73241 H6R PA 1765 131.261 99.514 35.235 1.00 0.00 H ATOM 73242 H6S PA 1765 131.955 100.295 36.571 1.00 0.00 H ATOM 73243 C15 PA 1765 131.773 101.551 34.908 1.00 0.00 C ATOM 73244 H5R PA 1765 131.869 102.506 35.429 1.00 0.00 H ATOM 73245 H5S PA 1765 131.181 101.605 33.993 1.00 0.00 H ATOM 73246 C14 PA 1765 133.193 101.167 34.519 1.00 0.00 C ATOM 73247 H4R PA 1765 133.224 100.276 33.888 1.00 0.00 H ATOM 73248 H4S PA 1765 133.729 100.853 35.417 1.00 0.00 H ATOM 73249 C13 PA 1765 134.004 102.342 33.895 1.00 0.00 C ATOM 73250 H3R PA 1765 135.079 102.154 33.921 1.00 0.00 H ATOM 73251 H3S PA 1765 133.819 103.134 34.624 1.00 0.00 H ATOM 73252 C12 PA 1765 133.531 102.796 32.496 1.00 0.00 C ATOM 73253 H2R PA 1765 133.111 101.966 31.924 1.00 0.00 H ATOM 73254 H2S PA 1765 132.686 103.483 32.412 1.00 0.00 H ATOM 73255 C11 PGR 1766 134.700 103.476 31.697 1.00 0.00 C ATOM 73256 O12 PGR 1766 135.834 103.665 32.090 1.00 0.00 O ATOM 73257 O11 PGR 1766 134.267 103.862 30.429 1.00 0.00 O ATOM 73258 C1 PGR 1766 135.106 104.516 29.548 1.00 0.00 C ATOM 73259 HR PGR 1766 136.002 103.900 29.443 1.00 0.00 H ATOM 73260 HS PGR 1766 135.273 105.483 30.028 1.00 0.00 H ATOM 73261 C2 PGR 1766 134.604 104.801 28.103 1.00 0.00 C ATOM 73262 HX PGR 1766 134.534 103.850 27.569 1.00 0.00 H ATOM 73263 C3 PGR 1766 135.436 105.822 27.289 1.00 0.00 C ATOM 73264 HA PGR 1766 136.500 105.640 27.460 1.00 0.00 H ATOM 73265 HB PGR 1766 135.419 106.843 27.678 1.00 0.00 H ATOM 73266 O31 PGR 1766 135.179 105.894 25.886 1.00 0.00 O ATOM 73267 P31 PGR 1766 135.472 104.748 24.792 1.00 0.00 P ATOM 73268 O32 PGR 1766 134.381 103.687 24.963 1.00 0.00 O ATOM 73269 C31 PGR 1766 133.097 103.930 24.501 1.00 0.00 C ATOM 73270 H1A PGR 1766 133.059 103.993 23.410 1.00 0.00 H ATOM 73271 H1B PGR 1766 132.620 104.802 24.956 1.00 0.00 H ATOM 73272 C32 PGR 1766 132.219 102.686 24.960 1.00 0.00 C ATOM 73273 H2A PGR 1766 132.306 102.690 26.050 1.00 0.00 H ATOM 73274 O35 PGR 1766 132.804 101.548 24.435 1.00 0.00 O ATOM 73275 HO5A PGR 1766 133.492 101.241 25.051 1.00 0.00 H ATOM 73276 C33 PGR 1766 130.758 102.819 24.370 1.00 0.00 C ATOM 73277 H3A PGR 1766 130.249 102.072 24.984 1.00 0.00 H ATOM 73278 H3B PGR 1766 130.261 103.764 24.603 1.00 0.00 H ATOM 73279 O33 PGR 1766 135.305 105.405 23.475 1.00 0.00 O ATOM 73280 O34 PGR 1766 136.723 104.085 25.173 1.00 0.00 O ATOM 73281 O21 PGR 1766 133.254 105.321 28.162 1.00 0.00 O ATOM 73282 C21 PGR 1766 132.879 106.513 28.804 1.00 0.00 C ATOM 73283 O22 PGR 1766 133.534 107.139 29.619 1.00 0.00 O ATOM 73284 O36 PGR 1766 130.887 102.564 22.964 1.00 0.00 O ATOM 73285 HO6A PGR 1766 131.159 101.640 22.821 1.00 0.00 H ATOM 73286 C12 OL 1767 131.474 106.822 28.372 1.00 0.00 C ATOM 73287 H2R OL 1767 131.113 107.767 28.783 1.00 0.00 H ATOM 73288 H2S OL 1767 131.474 106.896 27.282 1.00 0.00 H ATOM 73289 C13 OL 1767 130.454 105.701 28.808 1.00 0.00 C ATOM 73290 H3R OL 1767 129.689 105.463 28.067 1.00 0.00 H ATOM 73291 H3S OL 1767 130.994 104.771 28.996 1.00 0.00 H ATOM 73292 C14 OL 1767 129.947 106.110 30.125 1.00 0.00 C ATOM 73293 H4R OL 1767 130.826 106.193 30.768 1.00 0.00 H ATOM 73294 H4S OL 1767 129.474 107.067 29.896 1.00 0.00 H ATOM 73295 C15 OL 1767 129.066 105.124 30.935 1.00 0.00 C ATOM 73296 H5R OL 1767 128.837 105.533 31.921 1.00 0.00 H ATOM 73297 H5S OL 1767 128.205 105.019 30.271 1.00 0.00 H ATOM 73298 C16 OL 1767 129.683 103.772 31.219 1.00 0.00 C ATOM 73299 H6R OL 1767 129.445 103.061 30.424 1.00 0.00 H ATOM 73300 H6S OL 1767 130.763 103.826 31.372 1.00 0.00 H ATOM 73301 C17 OL 1767 129.015 103.074 32.452 1.00 0.00 C ATOM 73302 H7R OL 1767 129.342 102.039 32.571 1.00 0.00 H ATOM 73303 H7S OL 1767 129.386 103.594 33.338 1.00 0.00 H ATOM 73304 C18 OL 1767 127.488 102.989 32.392 1.00 0.00 C ATOM 73305 H8R OL 1767 127.067 102.591 33.317 1.00 0.00 H ATOM 73306 H8S OL 1767 127.034 103.950 32.143 1.00 0.00 H ATOM 73307 C19 OL 1767 127.166 101.940 31.324 1.00 0.00 C ATOM 73308 H9R OL 1767 127.741 102.173 30.432 1.00 0.00 H ATOM 73309 C110 OL 1767 126.478 100.801 31.424 1.00 0.00 C ATOM 73310 H10R OL 1767 126.447 100.043 30.646 1.00 0.00 H ATOM 73311 C111 OL 1767 125.694 100.311 32.643 1.00 0.00 C ATOM 73312 H11R OL 1767 125.891 101.007 33.461 1.00 0.00 H ATOM 73313 H11S OL 1767 124.629 100.390 32.415 1.00 0.00 H ATOM 73314 C112 OL 1767 126.169 98.926 33.150 1.00 0.00 C ATOM 73315 H12R OL 1767 126.110 98.199 32.337 1.00 0.00 H ATOM 73316 H12S OL 1767 127.220 98.903 33.445 1.00 0.00 H ATOM 73317 C113 OL 1767 125.255 98.337 34.307 1.00 0.00 C ATOM 73318 H13R OL 1767 125.654 97.427 34.760 1.00 0.00 H ATOM 73319 H13S OL 1767 125.234 98.899 35.243 1.00 0.00 H ATOM 73320 C114 OL 1767 123.812 97.937 33.899 1.00 0.00 C ATOM 73321 H14R OL 1767 123.186 98.828 33.808 1.00 0.00 H ATOM 73322 H14S OL 1767 123.881 97.410 32.945 1.00 0.00 H ATOM 73323 C115 OL 1767 123.235 96.927 34.876 1.00 0.00 C ATOM 73324 H15R OL 1767 122.324 96.447 34.512 1.00 0.00 H ATOM 73325 H15S OL 1767 123.946 96.099 34.933 1.00 0.00 H ATOM 73326 C116 OL 1767 123.005 97.505 36.247 1.00 0.00 C ATOM 73327 H16R OL 1767 123.929 98.005 36.545 1.00 0.00 H ATOM 73328 H16S OL 1767 122.412 98.408 36.087 1.00 0.00 H ATOM 73329 C117 OL 1767 122.277 96.529 37.205 1.00 0.00 C ATOM 73330 H17R OL 1767 122.295 95.468 36.947 1.00 0.00 H ATOM 73331 H17S OL 1767 122.854 96.341 38.113 1.00 0.00 H ATOM 73332 C118 OL 1767 120.962 97.048 37.590 1.00 0.00 C ATOM 73333 H18R OL 1767 120.275 96.984 36.744 1.00 0.00 H ATOM 73334 H18S OL 1767 121.192 98.066 37.911 1.00 0.00 H ATOM 73335 H18T OL 1767 120.425 96.520 38.380 1.00 0.00 H TER 73336 OL 1767 ATOM 73336 C116 PA 1768 14.070 20.317 39.965 1.00 0.00 C ATOM 73337 H16R PA 1768 13.690 19.299 40.078 1.00 0.00 H ATOM 73338 H16S PA 1768 14.226 20.599 38.922 1.00 0.00 H ATOM 73339 H16T PA 1768 13.328 21.034 40.323 1.00 0.00 H ATOM 73340 C115 PA 1768 15.400 20.450 40.648 1.00 0.00 C ATOM 73341 H15R PA 1768 15.272 20.380 41.730 1.00 0.00 H ATOM 73342 H15S PA 1768 15.838 21.442 40.518 1.00 0.00 H ATOM 73343 C114 PA 1768 16.383 19.359 40.165 1.00 0.00 C ATOM 73344 H14R PA 1768 15.849 18.412 40.063 1.00 0.00 H ATOM 73345 H14S PA 1768 17.188 19.200 40.885 1.00 0.00 H ATOM 73346 C113 PA 1768 16.922 19.590 38.748 1.00 0.00 C ATOM 73347 H13R PA 1768 17.569 20.464 38.645 1.00 0.00 H ATOM 73348 H13S PA 1768 16.011 19.751 38.167 1.00 0.00 H ATOM 73349 C112 PA 1768 17.582 18.358 38.202 1.00 0.00 C ATOM 73350 H12R PA 1768 16.869 17.533 38.247 1.00 0.00 H ATOM 73351 H12S PA 1768 18.466 18.119 38.797 1.00 0.00 H ATOM 73352 C111 PA 1768 18.001 18.450 36.732 1.00 0.00 C ATOM 73353 H11R PA 1768 18.544 17.534 36.492 1.00 0.00 H ATOM 73354 H11S PA 1768 18.781 19.208 36.626 1.00 0.00 H ATOM 73355 C110 PA 1768 16.897 18.780 35.804 1.00 0.00 C ATOM 73356 H10R PA 1768 16.667 19.831 35.990 1.00 0.00 H ATOM 73357 H10S PA 1768 15.884 18.434 36.019 1.00 0.00 H ATOM 73358 C19 PA 1768 17.160 18.856 34.236 1.00 0.00 C ATOM 73359 H9R PA 1768 18.236 18.948 34.077 1.00 0.00 H ATOM 73360 H9S PA 1768 16.944 19.859 33.862 1.00 0.00 H ATOM 73361 C18 PA 1768 16.687 17.770 33.278 1.00 0.00 C ATOM 73362 H8R PA 1768 17.216 17.888 32.330 1.00 0.00 H ATOM 73363 H8S PA 1768 15.605 17.653 33.189 1.00 0.00 H ATOM 73364 C17 PA 1768 17.068 16.321 33.687 1.00 0.00 C ATOM 73365 H7R PA 1768 16.828 16.125 34.734 1.00 0.00 H ATOM 73366 H7S PA 1768 18.157 16.392 33.717 1.00 0.00 H ATOM 73367 C16 PA 1768 16.592 15.194 32.724 1.00 0.00 C ATOM 73368 H6R PA 1768 17.435 14.563 32.436 1.00 0.00 H ATOM 73369 H6S PA 1768 16.342 15.803 31.853 1.00 0.00 H ATOM 73370 C15 PA 1768 15.499 14.338 33.066 1.00 0.00 C ATOM 73371 H5R PA 1768 14.569 14.908 33.126 1.00 0.00 H ATOM 73372 H5S PA 1768 15.523 14.058 34.122 1.00 0.00 H ATOM 73373 C14 PA 1768 15.302 13.113 32.219 1.00 0.00 C ATOM 73374 H4R PA 1768 14.494 12.561 32.703 1.00 0.00 H ATOM 73375 H4S PA 1768 16.190 12.479 32.161 1.00 0.00 H ATOM 73376 C13 PA 1768 14.987 13.375 30.746 1.00 0.00 C ATOM 73377 H3R PA 1768 15.802 13.950 30.301 1.00 0.00 H ATOM 73378 H3S PA 1768 14.046 13.912 30.609 1.00 0.00 H ATOM 73379 C12 PA 1768 14.774 12.079 29.936 1.00 0.00 C ATOM 73380 H2R PA 1768 13.854 11.572 30.234 1.00 0.00 H ATOM 73381 H2S PA 1768 15.660 11.449 30.034 1.00 0.00 H ATOM 73382 C11 PC 1769 14.772 12.238 28.382 1.00 0.00 C ATOM 73383 O12 PC 1769 15.379 11.458 27.670 1.00 0.00 O ATOM 73384 O11 PC 1769 14.114 13.371 27.918 1.00 0.00 O ATOM 73385 C1 PC 1769 14.082 13.568 26.481 1.00 0.00 C ATOM 73386 HR PC 1769 15.088 13.382 26.097 1.00 0.00 H ATOM 73387 HS PC 1769 13.878 14.634 26.348 1.00 0.00 H ATOM 73388 C2 PC 1769 13.027 12.618 25.795 1.00 0.00 C ATOM 73389 HX PC 1769 13.435 11.612 25.919 1.00 0.00 H ATOM 73390 C3 PC 1769 12.952 13.019 24.319 1.00 0.00 C ATOM 73391 HA PC 1769 13.984 13.049 23.959 1.00 0.00 H ATOM 73392 HB PC 1769 12.487 13.997 24.176 1.00 0.00 H ATOM 73393 O31 PC 1769 12.271 12.072 23.500 1.00 0.00 O ATOM 73394 P31 PC 1769 12.434 12.078 21.901 1.00 0.00 P ATOM 73395 O32 PC 1769 10.983 12.489 21.289 1.00 0.00 O ATOM 73396 C31 PC 1769 10.397 13.780 21.522 1.00 0.00 C ATOM 73397 H1A PC 1769 11.185 14.528 21.401 1.00 0.00 H ATOM 73398 H1B PC 1769 9.902 13.712 22.494 1.00 0.00 H ATOM 73399 C32 PC 1769 9.413 13.850 20.420 1.00 0.00 C ATOM 73400 H2A PC 1769 8.639 14.487 20.851 1.00 0.00 H ATOM 73401 H2B PC 1769 8.874 12.905 20.339 1.00 0.00 H ATOM 73402 N31 PC 1769 9.737 14.305 19.030 1.00 0.00 N ATOM 73403 C33 PC 1769 10.873 15.304 18.928 1.00 0.00 C ATOM 73404 H3A PC 1769 11.220 15.386 17.897 1.00 0.00 H ATOM 73405 H3B PC 1769 11.743 14.950 19.483 1.00 0.00 H ATOM 73406 H3C PC 1769 10.482 16.235 19.340 1.00 0.00 H ATOM 73407 C34 PC 1769 10.171 13.132 18.224 1.00 0.00 C ATOM 73408 H4A PC 1769 10.581 13.393 17.247 1.00 0.00 H ATOM 73409 H4B PC 1769 9.375 12.393 18.329 1.00 0.00 H ATOM 73410 H4C PC 1769 10.964 12.615 18.767 1.00 0.00 H ATOM 73411 C35 PC 1769 8.509 14.883 18.415 1.00 0.00 C ATOM 73412 H5A PC 1769 8.230 15.751 19.014 1.00 0.00 H ATOM 73413 H5B PC 1769 7.695 14.158 18.379 1.00 0.00 H ATOM 73414 H5C PC 1769 8.768 15.148 17.389 1.00 0.00 H ATOM 73415 O33 PC 1769 13.411 13.129 21.546 1.00 0.00 O ATOM 73416 O34 PC 1769 12.631 10.676 21.437 1.00 0.00 O ATOM 73417 O21 PC 1769 11.736 12.523 26.342 1.00 0.00 O ATOM 73418 C21 PC 1769 10.930 13.644 26.547 1.00 0.00 C ATOM 73419 O22 PC 1769 11.267 14.757 26.168 1.00 0.00 O ATOM 73420 C12 OL 1770 9.534 13.345 27.027 1.00 0.00 C ATOM 73421 H2R OL 1770 8.814 14.068 26.638 1.00 0.00 H ATOM 73422 H2S OL 1770 9.182 12.341 26.781 1.00 0.00 H ATOM 73423 C13 OL 1770 9.421 13.481 28.526 1.00 0.00 C ATOM 73424 H3R OL 1770 8.389 13.194 28.744 1.00 0.00 H ATOM 73425 H3S OL 1770 10.076 12.842 29.123 1.00 0.00 H ATOM 73426 C14 OL 1770 9.523 14.935 28.943 1.00 0.00 C ATOM 73427 H4R OL 1770 9.383 15.727 28.203 1.00 0.00 H ATOM 73428 H4S OL 1770 8.700 15.164 29.623 1.00 0.00 H ATOM 73429 C15 OL 1770 10.842 15.088 29.647 1.00 0.00 C ATOM 73430 H5R OL 1770 11.030 14.236 30.304 1.00 0.00 H ATOM 73431 H5S OL 1770 11.655 15.113 28.919 1.00 0.00 H ATOM 73432 C16 OL 1770 10.815 16.361 30.491 1.00 0.00 C ATOM 73433 H6R OL 1770 11.815 16.652 30.819 1.00 0.00 H ATOM 73434 H6S OL 1770 10.630 17.177 29.788 1.00 0.00 H ATOM 73435 C17 OL 1770 9.849 16.422 31.776 1.00 0.00 C ATOM 73436 H7R OL 1770 10.199 17.316 32.297 1.00 0.00 H ATOM 73437 H7S OL 1770 8.847 16.673 31.423 1.00 0.00 H ATOM 73438 C18 OL 1770 9.875 15.284 32.775 1.00 0.00 C ATOM 73439 H8R OL 1770 9.762 14.308 32.299 1.00 0.00 H ATOM 73440 H8S OL 1770 10.814 15.254 33.332 1.00 0.00 H ATOM 73441 C19 OL 1770 8.710 15.457 33.696 1.00 0.00 C ATOM 73442 H9R OL 1770 8.436 16.477 33.954 1.00 0.00 H ATOM 73443 C110 OL 1770 7.890 14.513 34.314 1.00 0.00 C ATOM 73444 H10R OL 1770 7.205 14.921 35.052 1.00 0.00 H ATOM 73445 C111 OL 1770 7.950 13.052 34.149 1.00 0.00 C ATOM 73446 H11R OL 1770 8.609 12.692 33.356 1.00 0.00 H ATOM 73447 H11S OL 1770 8.588 12.739 34.979 1.00 0.00 H ATOM 73448 C112 OL 1770 6.556 12.438 33.884 1.00 0.00 C ATOM 73449 H12R OL 1770 6.117 13.150 33.182 1.00 0.00 H ATOM 73450 H12S OL 1770 6.694 11.485 33.369 1.00 0.00 H ATOM 73451 C113 OL 1770 5.825 12.242 35.177 1.00 0.00 C ATOM 73452 H13R OL 1770 6.267 11.665 35.992 1.00 0.00 H ATOM 73453 H13S OL 1770 5.403 13.161 35.589 1.00 0.00 H ATOM 73454 C114 OL 1770 4.688 11.306 34.872 1.00 0.00 C ATOM 73455 H14R OL 1770 4.249 11.654 33.934 1.00 0.00 H ATOM 73456 H14S OL 1770 5.056 10.318 34.586 1.00 0.00 H ATOM 73457 C115 OL 1770 3.413 11.410 35.754 1.00 0.00 C ATOM 73458 H15R OL 1770 3.577 11.134 36.798 1.00 0.00 H ATOM 73459 H15S OL 1770 3.084 12.451 35.753 1.00 0.00 H ATOM 73460 C116 OL 1770 2.206 10.590 35.297 1.00 0.00 C ATOM 73461 H16R OL 1770 2.081 10.618 34.213 1.00 0.00 H ATOM 73462 H16S OL 1770 2.404 9.559 35.599 1.00 0.00 H ATOM 73463 C117 OL 1770 0.939 11.220 35.964 1.00 0.00 C ATOM 73464 H17R OL 1770 0.874 12.307 35.882 1.00 0.00 H ATOM 73465 H17S OL 1770 0.045 10.788 35.512 1.00 0.00 H ATOM 73466 C118 OL 1770 0.779 11.053 37.531 1.00 0.00 C ATOM 73467 H18R OL 1770 1.648 11.515 38.004 1.00 0.00 H ATOM 73468 H18S OL 1770 0.899 10.010 37.831 1.00 0.00 H ATOM 73469 H18T OL 1770 -0.185 11.278 37.992 1.00 0.00 H TER 73470 OL 1770 ATOM 73470 C116 PA 1771 53.742 2.025 41.325 1.00 0.00 C ATOM 73471 H16R PA 1771 53.927 0.985 41.047 1.00 0.00 H ATOM 73472 H16S PA 1771 52.868 2.272 40.719 1.00 0.00 H ATOM 73473 H16T PA 1771 53.589 2.058 42.405 1.00 0.00 H ATOM 73474 C115 PA 1771 54.924 2.913 41.026 1.00 0.00 C ATOM 73475 H15R PA 1771 55.814 2.507 41.512 1.00 0.00 H ATOM 73476 H15S PA 1771 54.713 3.908 41.425 1.00 0.00 H ATOM 73477 C114 PA 1771 55.216 3.199 39.590 1.00 0.00 C ATOM 73478 H14R PA 1771 54.414 3.700 39.045 1.00 0.00 H ATOM 73479 H14S PA 1771 55.509 2.249 39.137 1.00 0.00 H ATOM 73480 C113 PA 1771 56.438 4.159 39.270 1.00 0.00 C ATOM 73481 H13R PA 1771 57.310 3.997 39.906 1.00 0.00 H ATOM 73482 H13S PA 1771 56.098 5.144 39.595 1.00 0.00 H ATOM 73483 C112 PA 1771 56.904 4.229 37.877 1.00 0.00 C ATOM 73484 H12R PA 1771 57.338 3.320 37.454 1.00 0.00 H ATOM 73485 H12S PA 1771 57.833 4.802 37.895 1.00 0.00 H ATOM 73486 C111 PA 1771 55.990 4.943 36.916 1.00 0.00 C ATOM 73487 H11R PA 1771 55.903 5.994 37.202 1.00 0.00 H ATOM 73488 H11S PA 1771 55.029 4.472 36.700 1.00 0.00 H ATOM 73489 C110 PA 1771 56.705 5.010 35.605 1.00 0.00 C ATOM 73490 H10R PA 1771 55.871 4.917 34.906 1.00 0.00 H ATOM 73491 H10S PA 1771 57.190 4.096 35.256 1.00 0.00 H ATOM 73492 C19 PA 1771 57.638 6.148 35.215 1.00 0.00 C ATOM 73493 H9R PA 1771 58.616 6.224 35.693 1.00 0.00 H ATOM 73494 H9S PA 1771 57.145 7.099 35.428 1.00 0.00 H ATOM 73495 C18 PA 1771 58.031 6.227 33.719 1.00 0.00 C ATOM 73496 H8R PA 1771 57.169 6.065 33.068 1.00 0.00 H ATOM 73497 H8S PA 1771 58.694 5.398 33.462 1.00 0.00 H ATOM 73498 C17 PA 1771 58.627 7.599 33.340 1.00 0.00 C ATOM 73499 H7R PA 1771 59.583 7.777 33.836 1.00 0.00 H ATOM 73500 H7S PA 1771 57.876 8.329 33.650 1.00 0.00 H ATOM 73501 C16 PA 1771 58.862 7.662 31.816 1.00 0.00 C ATOM 73502 H6R PA 1771 57.873 7.448 31.407 1.00 0.00 H ATOM 73503 H6S PA 1771 59.363 6.739 31.517 1.00 0.00 H ATOM 73504 C15 PA 1771 59.568 8.904 31.235 1.00 0.00 C ATOM 73505 H5R PA 1771 59.531 9.736 31.942 1.00 0.00 H ATOM 73506 H5S PA 1771 59.155 9.319 30.313 1.00 0.00 H ATOM 73507 C14 PA 1771 61.032 8.643 30.924 1.00 0.00 C ATOM 73508 H4R PA 1771 60.981 7.859 30.165 1.00 0.00 H ATOM 73509 H4S PA 1771 61.676 8.247 31.712 1.00 0.00 H ATOM 73510 C13 PA 1771 61.847 9.875 30.440 1.00 0.00 C ATOM 73511 H3R PA 1771 61.971 10.681 31.166 1.00 0.00 H ATOM 73512 H3S PA 1771 61.312 10.376 29.631 1.00 0.00 H ATOM 73513 C12 PA 1771 63.312 9.428 29.875 1.00 0.00 C ATOM 73514 H2R PA 1771 63.975 9.217 30.717 1.00 0.00 H ATOM 73515 H2S PA 1771 63.803 10.353 29.567 1.00 0.00 H ATOM 73516 C11 PGR 1772 63.368 8.300 28.963 1.00 0.00 C ATOM 73517 O12 PGR 1772 63.951 7.223 29.243 1.00 0.00 O ATOM 73518 O11 PGR 1772 62.678 8.467 27.872 1.00 0.00 O ATOM 73519 C1 PGR 1772 62.436 7.310 27.076 1.00 0.00 C ATOM 73520 HR PGR 1772 61.780 6.639 27.636 1.00 0.00 H ATOM 73521 HS PGR 1772 63.353 6.859 26.687 1.00 0.00 H ATOM 73522 C2 PGR 1772 61.620 7.702 25.806 1.00 0.00 C ATOM 73523 HX PGR 1772 61.344 6.847 25.184 1.00 0.00 H ATOM 73524 C3 PGR 1772 62.335 8.841 25.056 1.00 0.00 C ATOM 73525 HA PGR 1772 63.359 8.506 24.869 1.00 0.00 H ATOM 73526 HB PGR 1772 62.392 9.691 25.741 1.00 0.00 H ATOM 73527 O31 PGR 1772 61.734 9.086 23.793 1.00 0.00 O ATOM 73528 P31 PGR 1772 62.601 9.313 22.562 1.00 0.00 P ATOM 73529 O32 PGR 1772 63.513 10.615 22.905 1.00 0.00 O ATOM 73530 C31 PGR 1772 62.906 11.813 23.334 1.00 0.00 C ATOM 73531 H1A PGR 1772 62.566 11.561 24.341 1.00 0.00 H ATOM 73532 H1B PGR 1772 62.010 11.948 22.722 1.00 0.00 H ATOM 73533 C32 PGR 1772 63.897 12.974 23.312 1.00 0.00 C ATOM 73534 H2A PGR 1772 63.477 13.773 23.928 1.00 0.00 H ATOM 73535 O35 PGR 1772 64.210 13.319 21.882 1.00 0.00 O ATOM 73536 HO5A PGR 1772 64.419 12.533 21.346 1.00 0.00 H ATOM 73537 C33 PGR 1772 65.175 12.578 24.052 1.00 0.00 C ATOM 73538 H3A PGR 1772 64.917 12.757 25.099 1.00 0.00 H ATOM 73539 H3B PGR 1772 65.604 11.604 23.804 1.00 0.00 H ATOM 73540 O33 PGR 1772 63.433 8.144 22.393 1.00 0.00 O ATOM 73541 O34 PGR 1772 61.724 9.730 21.442 1.00 0.00 O ATOM 73542 O21 PGR 1772 60.350 8.188 26.320 1.00 0.00 O ATOM 73543 C21 PGR 1772 59.391 7.222 26.612 1.00 0.00 C ATOM 73544 O22 PGR 1772 59.619 6.024 26.446 1.00 0.00 O ATOM 73545 O36 PGR 1772 66.146 13.649 23.922 1.00 0.00 O ATOM 73546 HO6A PGR 1772 66.846 13.466 24.575 1.00 0.00 H ATOM 73547 C12 OL 1773 58.200 7.756 27.296 1.00 0.00 C ATOM 73548 H2R OL 1773 58.608 7.791 28.308 1.00 0.00 H ATOM 73549 H2S OL 1773 58.071 8.808 27.033 1.00 0.00 H ATOM 73550 C13 OL 1773 56.921 7.040 27.275 1.00 0.00 C ATOM 73551 H3R OL 1773 56.716 6.783 26.234 1.00 0.00 H ATOM 73552 H3S OL 1773 56.979 6.039 27.708 1.00 0.00 H ATOM 73553 C14 OL 1773 55.748 7.796 27.847 1.00 0.00 C ATOM 73554 H4R OL 1773 55.841 8.825 27.492 1.00 0.00 H ATOM 73555 H4S OL 1773 54.815 7.314 27.549 1.00 0.00 H ATOM 73556 C15 OL 1773 55.875 7.801 29.412 1.00 0.00 C ATOM 73557 H5R OL 1773 55.809 6.743 29.677 1.00 0.00 H ATOM 73558 H5S OL 1773 56.831 8.323 29.494 1.00 0.00 H ATOM 73559 C16 OL 1773 54.665 8.575 30.053 1.00 0.00 C ATOM 73560 H6R OL 1773 54.605 9.619 29.741 1.00 0.00 H ATOM 73561 H6S OL 1773 53.696 8.191 29.725 1.00 0.00 H ATOM 73562 C17 OL 1773 54.768 8.669 31.602 1.00 0.00 C ATOM 73563 H7R OL 1773 55.657 9.284 31.755 1.00 0.00 H ATOM 73564 H7S OL 1773 53.951 9.324 31.914 1.00 0.00 H ATOM 73565 C18 OL 1773 54.592 7.440 32.408 1.00 0.00 C ATOM 73566 H8R OL 1773 53.590 7.032 32.259 1.00 0.00 H ATOM 73567 H8S OL 1773 55.127 6.614 31.933 1.00 0.00 H ATOM 73568 C19 OL 1773 54.804 7.423 33.920 1.00 0.00 C ATOM 73569 H9R OL 1773 55.738 7.871 34.251 1.00 0.00 H ATOM 73570 C110 OL 1773 53.930 7.171 34.853 1.00 0.00 C ATOM 73571 H10R OL 1773 54.252 7.250 35.888 1.00 0.00 H ATOM 73572 C111 OL 1773 52.512 6.749 34.789 1.00 0.00 C ATOM 73573 H11R OL 1773 52.367 6.145 33.891 1.00 0.00 H ATOM 73574 H11S OL 1773 52.333 6.123 35.666 1.00 0.00 H ATOM 73575 C112 OL 1773 51.510 7.874 34.622 1.00 0.00 C ATOM 73576 H12R OL 1773 51.624 8.530 35.488 1.00 0.00 H ATOM 73577 H12S OL 1773 51.778 8.430 33.721 1.00 0.00 H ATOM 73578 C113 OL 1773 50.095 7.319 34.404 1.00 0.00 C ATOM 73579 H13R OL 1773 50.123 6.649 33.542 1.00 0.00 H ATOM 73580 H13S OL 1773 49.947 6.732 35.313 1.00 0.00 H ATOM 73581 C114 OL 1773 48.906 8.316 34.271 1.00 0.00 C ATOM 73582 H14R OL 1773 49.015 9.099 35.025 1.00 0.00 H ATOM 73583 H14S OL 1773 49.116 8.822 33.326 1.00 0.00 H ATOM 73584 C115 OL 1773 47.523 7.750 34.277 1.00 0.00 C ATOM 73585 H15R OL 1773 47.324 7.194 35.196 1.00 0.00 H ATOM 73586 H15S OL 1773 46.882 8.627 34.383 1.00 0.00 H ATOM 73587 C116 OL 1773 47.371 6.956 32.964 1.00 0.00 C ATOM 73588 H16R OL 1773 47.645 7.623 32.144 1.00 0.00 H ATOM 73589 H16S OL 1773 48.083 6.128 32.981 1.00 0.00 H ATOM 73590 C117 OL 1773 45.991 6.276 32.572 1.00 0.00 C ATOM 73591 H17R OL 1773 45.658 5.549 33.316 1.00 0.00 H ATOM 73592 H17S OL 1773 45.224 7.053 32.557 1.00 0.00 H ATOM 73593 C118 OL 1773 45.970 5.700 31.135 1.00 0.00 C ATOM 73594 H18R OL 1773 46.896 5.171 30.904 1.00 0.00 H ATOM 73595 H18S OL 1773 45.934 6.439 30.332 1.00 0.00 H ATOM 73596 H18T OL 1773 45.160 5.055 30.788 1.00 0.00 H TER 73597 OL 1773 ATOM 73597 C116 PA 1774 52.303 127.168 30.367 1.00 0.00 C ATOM 73598 H16R PA 1774 51.920 126.434 29.655 1.00 0.00 H ATOM 73599 H16S PA 1774 51.782 126.925 31.296 1.00 0.00 H ATOM 73600 H16T PA 1774 53.360 126.919 30.486 1.00 0.00 H ATOM 73601 C115 PA 1774 52.106 128.551 29.845 1.00 0.00 C ATOM 73602 H15R PA 1774 51.064 128.593 29.519 1.00 0.00 H ATOM 73603 H15S PA 1774 52.640 128.659 28.899 1.00 0.00 H ATOM 73604 C114 PA 1774 52.494 129.587 30.855 1.00 0.00 C ATOM 73605 H14R PA 1774 53.582 129.497 30.854 1.00 0.00 H ATOM 73606 H14S PA 1774 52.216 129.295 31.870 1.00 0.00 H ATOM 73607 C113 PA 1774 51.970 130.978 30.566 1.00 0.00 C ATOM 73608 H13R PA 1774 50.898 130.890 30.376 1.00 0.00 H ATOM 73609 H13S PA 1774 52.492 131.432 29.720 1.00 0.00 H ATOM 73610 C112 PA 1774 52.203 131.961 31.743 1.00 0.00 C ATOM 73611 H12R PA 1774 53.215 131.751 32.095 1.00 0.00 H ATOM 73612 H12S PA 1774 51.492 131.624 32.500 1.00 0.00 H ATOM 73613 C111 PA 1774 51.876 133.476 31.494 1.00 0.00 C ATOM 73614 H11R PA 1774 52.460 134.099 32.174 1.00 0.00 H ATOM 73615 H11S PA 1774 50.861 133.756 31.785 1.00 0.00 H ATOM 73616 C110 PA 1774 52.049 134.115 30.109 1.00 0.00 C ATOM 73617 H10R PA 1774 51.095 134.023 29.586 1.00 0.00 H ATOM 73618 H10S PA 1774 52.664 133.511 29.439 1.00 0.00 H ATOM 73619 C19 PA 1774 52.244 135.648 30.082 1.00 0.00 C ATOM 73620 H9R PA 1774 53.267 135.852 30.403 1.00 0.00 H ATOM 73621 H9S PA 1774 51.658 136.123 30.873 1.00 0.00 H ATOM 73622 C18 PA 1774 52.103 136.396 28.776 1.00 0.00 C ATOM 73623 H8R PA 1774 51.170 136.171 28.256 1.00 0.00 H ATOM 73624 H8S PA 1774 52.864 136.171 28.026 1.00 0.00 H ATOM 73625 C17 PA 1774 52.077 137.921 29.015 1.00 0.00 C ATOM 73626 H7R PA 1774 53.012 138.312 29.422 1.00 0.00 H ATOM 73627 H7S PA 1774 51.302 138.213 29.727 1.00 0.00 H ATOM 73628 C16 PA 1774 51.733 138.809 27.750 1.00 0.00 C ATOM 73629 H6R PA 1774 51.599 139.820 28.142 1.00 0.00 H ATOM 73630 H6S PA 1774 50.779 138.510 27.310 1.00 0.00 H ATOM 73631 C15 PA 1774 52.747 138.892 26.624 1.00 0.00 C ATOM 73632 H5R PA 1774 52.232 139.491 25.870 1.00 0.00 H ATOM 73633 H5S PA 1774 52.951 137.911 26.190 1.00 0.00 H ATOM 73634 C14 PA 1774 54.100 139.587 26.941 1.00 0.00 C ATOM 73635 H4R PA 1774 54.737 139.098 27.681 1.00 0.00 H ATOM 73636 H4S PA 1774 53.940 140.641 27.177 1.00 0.00 H ATOM 73637 C13 PA 1774 54.983 139.643 25.745 1.00 0.00 C ATOM 73638 H3R PA 1774 54.594 140.222 24.905 1.00 0.00 H ATOM 73639 H3S PA 1774 55.114 138.616 25.396 1.00 0.00 H ATOM 73640 C12 PA 1774 56.429 140.299 26.087 1.00 0.00 C ATOM 73641 H2R PA 1774 56.962 139.662 26.796 1.00 0.00 H ATOM 73642 H2S PA 1774 56.094 141.199 26.607 1.00 0.00 H ATOM 73643 C11 PC 1775 57.256 140.803 24.879 1.00 0.00 C ATOM 73644 O12 PC 1775 57.475 140.011 23.969 1.00 0.00 O ATOM 73645 O11 PC 1775 57.596 142.098 24.930 1.00 0.00 O ATOM 73646 C1 PC 1775 58.287 142.736 23.824 1.00 0.00 C ATOM 73647 HR PC 1775 57.524 142.761 23.042 1.00 0.00 H ATOM 73648 HS PC 1775 59.153 142.138 23.531 1.00 0.00 H ATOM 73649 C2 PC 1775 58.756 144.121 24.271 1.00 0.00 C ATOM 73650 HX PC 1775 57.903 144.694 24.642 1.00 0.00 H ATOM 73651 C3 PC 1775 59.344 144.908 23.097 1.00 0.00 C ATOM 73652 HA PC 1775 58.531 144.945 22.368 1.00 0.00 H ATOM 73653 HB PC 1775 60.246 144.470 22.662 1.00 0.00 H ATOM 73654 O31 PC 1775 59.678 146.251 23.386 1.00 0.00 O ATOM 73655 P31 PC 1775 59.963 147.236 22.156 1.00 0.00 P ATOM 73656 O32 PC 1775 58.762 148.109 22.178 1.00 0.00 O ATOM 73657 C31 PC 1775 57.689 147.815 21.434 1.00 0.00 C ATOM 73658 H1A PC 1775 57.333 146.834 21.762 1.00 0.00 H ATOM 73659 H1B PC 1775 57.941 147.737 20.374 1.00 0.00 H ATOM 73660 C32 PC 1775 56.587 148.886 21.734 1.00 0.00 C ATOM 73661 H2A PC 1775 57.127 149.829 21.829 1.00 0.00 H ATOM 73662 H2B PC 1775 56.151 148.684 22.713 1.00 0.00 H ATOM 73663 N31 PC 1775 55.559 148.940 20.714 1.00 0.00 N ATOM 73664 C33 PC 1775 54.979 147.551 20.455 1.00 0.00 C ATOM 73665 H3A PC 1775 53.961 147.634 20.071 1.00 0.00 H ATOM 73666 H3B PC 1775 54.945 147.068 21.432 1.00 0.00 H ATOM 73667 H3C PC 1775 55.603 146.919 19.822 1.00 0.00 H ATOM 73668 C34 PC 1775 54.418 149.752 21.240 1.00 0.00 C ATOM 73669 H4A PC 1775 54.805 150.755 21.425 1.00 0.00 H ATOM 73670 H4B PC 1775 53.953 149.298 22.116 1.00 0.00 H ATOM 73671 H4C PC 1775 53.645 149.859 20.478 1.00 0.00 H ATOM 73672 C35 PC 1775 56.061 149.454 19.375 1.00 0.00 C ATOM 73673 H5A PC 1775 55.266 149.261 18.653 1.00 0.00 H ATOM 73674 H5B PC 1775 56.880 148.823 19.028 1.00 0.00 H ATOM 73675 H5C PC 1775 56.305 150.508 19.514 1.00 0.00 H ATOM 73676 O33 PC 1775 61.136 148.029 22.547 1.00 0.00 O ATOM 73677 O34 PC 1775 59.986 146.390 20.913 1.00 0.00 O ATOM 73678 O21 PC 1775 59.765 143.844 25.351 1.00 0.00 O ATOM 73679 C21 PC 1775 60.213 144.836 26.190 1.00 0.00 C ATOM 73680 O22 PC 1775 59.638 145.957 26.183 1.00 0.00 O ATOM 73681 C12 OL 1776 61.337 144.331 27.061 1.00 0.00 C ATOM 73682 H2R OL 1776 61.015 144.369 28.104 1.00 0.00 H ATOM 73683 H2S OL 1776 61.453 143.247 26.997 1.00 0.00 H ATOM 73684 C13 OL 1776 62.711 144.841 26.690 1.00 0.00 C ATOM 73685 H3R OL 1776 62.836 144.665 25.620 1.00 0.00 H ATOM 73686 H3S OL 1776 62.720 145.924 26.833 1.00 0.00 H ATOM 73687 C14 OL 1776 63.828 144.222 27.580 1.00 0.00 C ATOM 73688 H4R OL 1776 63.825 143.150 27.377 1.00 0.00 H ATOM 73689 H4S OL 1776 64.754 144.489 27.066 1.00 0.00 H ATOM 73690 C15 OL 1776 63.863 144.531 29.054 1.00 0.00 C ATOM 73691 H5R OL 1776 64.927 144.539 29.302 1.00 0.00 H ATOM 73692 H5S OL 1776 63.488 145.512 29.354 1.00 0.00 H ATOM 73693 C16 OL 1776 63.281 143.414 30.010 1.00 0.00 C ATOM 73694 H6R OL 1776 62.219 143.367 29.759 1.00 0.00 H ATOM 73695 H6S OL 1776 63.771 142.490 29.695 1.00 0.00 H ATOM 73696 C17 OL 1776 63.622 143.584 31.496 1.00 0.00 C ATOM 73697 H7R OL 1776 63.054 142.832 32.048 1.00 0.00 H ATOM 73698 H7S OL 1776 64.669 143.363 31.713 1.00 0.00 H ATOM 73699 C18 OL 1776 63.065 144.865 32.068 1.00 0.00 C ATOM 73700 H8R OL 1776 63.715 145.584 31.565 1.00 0.00 H ATOM 73701 H8S OL 1776 62.024 145.071 31.811 1.00 0.00 H ATOM 73702 C19 OL 1776 63.385 145.096 33.517 1.00 0.00 C ATOM 73703 H9R OL 1776 64.177 145.804 33.746 1.00 0.00 H ATOM 73704 C110 OL 1776 62.663 144.649 34.552 1.00 0.00 C ATOM 73705 H10R OL 1776 62.862 144.888 35.594 1.00 0.00 H ATOM 73706 C111 OL 1776 61.443 143.762 34.409 1.00 0.00 C ATOM 73707 H11R OL 1776 60.691 144.344 33.872 1.00 0.00 H ATOM 73708 H11S OL 1776 61.571 142.841 33.835 1.00 0.00 H ATOM 73709 C112 OL 1776 60.770 143.432 35.726 1.00 0.00 C ATOM 73710 H12R OL 1776 61.535 143.206 36.471 1.00 0.00 H ATOM 73711 H12S OL 1776 60.318 144.335 36.142 1.00 0.00 H ATOM 73712 C113 OL 1776 59.740 142.275 35.529 1.00 0.00 C ATOM 73713 H13R OL 1776 59.015 142.561 34.764 1.00 0.00 H ATOM 73714 H13S OL 1776 60.139 141.364 35.077 1.00 0.00 H ATOM 73715 C114 OL 1776 59.129 141.775 36.810 1.00 0.00 C ATOM 73716 H14R OL 1776 59.129 142.688 37.409 1.00 0.00 H ATOM 73717 H14S OL 1776 58.082 141.467 36.770 1.00 0.00 H ATOM 73718 C115 OL 1776 59.946 140.668 37.560 1.00 0.00 C ATOM 73719 H15R OL 1776 60.073 139.897 36.797 1.00 0.00 H ATOM 73720 H15S OL 1776 60.943 141.077 37.736 1.00 0.00 H ATOM 73721 C116 OL 1776 59.345 140.254 38.895 1.00 0.00 C ATOM 73722 H16R OL 1776 59.215 141.042 39.640 1.00 0.00 H ATOM 73723 H16S OL 1776 58.286 140.056 38.717 1.00 0.00 H ATOM 73724 C117 OL 1776 59.972 138.991 39.462 1.00 0.00 C ATOM 73725 H17R OL 1776 59.290 138.400 40.078 1.00 0.00 H ATOM 73726 H17S OL 1776 60.260 138.324 38.647 1.00 0.00 H ATOM 73727 C118 OL 1776 61.233 139.359 40.322 1.00 0.00 C ATOM 73728 H18R OL 1776 61.871 139.958 39.669 1.00 0.00 H ATOM 73729 H18S OL 1776 61.786 138.465 40.619 1.00 0.00 H ATOM 73730 H18T OL 1776 61.067 139.919 41.244 1.00 0.00 H TER 73731 OL 1776 ATOM 73731 C116 PA 1777 44.674 18.714 38.258 1.00 0.00 C ATOM 73732 H16R PA 1777 43.966 18.382 39.020 1.00 0.00 H ATOM 73733 H16S PA 1777 45.655 18.303 38.502 1.00 0.00 H ATOM 73734 H16T PA 1777 44.341 18.192 37.358 1.00 0.00 H ATOM 73735 C115 PA 1777 44.655 20.245 38.118 1.00 0.00 C ATOM 73736 H15R PA 1777 45.153 20.370 37.155 1.00 0.00 H ATOM 73737 H15S PA 1777 45.181 20.832 38.873 1.00 0.00 H ATOM 73738 C114 PA 1777 43.280 20.802 37.850 1.00 0.00 C ATOM 73739 H14R PA 1777 42.750 20.979 38.788 1.00 0.00 H ATOM 73740 H14S PA 1777 42.707 19.946 37.487 1.00 0.00 H ATOM 73741 C113 PA 1777 43.282 21.926 36.854 1.00 0.00 C ATOM 73742 H13R PA 1777 43.666 21.603 35.884 1.00 0.00 H ATOM 73743 H13S PA 1777 43.881 22.712 37.318 1.00 0.00 H ATOM 73744 C112 PA 1777 41.838 22.509 36.805 1.00 0.00 C ATOM 73745 H12R PA 1777 41.411 22.644 37.801 1.00 0.00 H ATOM 73746 H12S PA 1777 41.236 21.672 36.445 1.00 0.00 H ATOM 73747 C111 PA 1777 41.672 23.796 36.027 1.00 0.00 C ATOM 73748 H11R PA 1777 42.381 24.549 36.377 1.00 0.00 H ATOM 73749 H11S PA 1777 40.624 24.064 36.179 1.00 0.00 H ATOM 73750 C110 PA 1777 41.970 23.690 34.536 1.00 0.00 C ATOM 73751 H10R PA 1777 42.925 23.225 34.281 1.00 0.00 H ATOM 73752 H10S PA 1777 42.132 24.705 34.167 1.00 0.00 H ATOM 73753 C19 PA 1777 40.946 22.949 33.706 1.00 0.00 C ATOM 73754 H9R PA 1777 41.306 21.919 33.646 1.00 0.00 H ATOM 73755 H9S PA 1777 40.892 23.347 32.691 1.00 0.00 H ATOM 73756 C18 PA 1777 39.391 22.948 34.094 1.00 0.00 C ATOM 73757 H8R PA 1777 39.174 24.014 34.188 1.00 0.00 H ATOM 73758 H8S PA 1777 39.237 22.518 35.086 1.00 0.00 H ATOM 73759 C17 PA 1777 38.533 22.288 33.053 1.00 0.00 C ATOM 73760 H7R PA 1777 37.525 22.069 33.412 1.00 0.00 H ATOM 73761 H7S PA 1777 38.947 21.296 32.863 1.00 0.00 H ATOM 73762 C16 PA 1777 38.416 23.033 31.719 1.00 0.00 C ATOM 73763 H6R PA 1777 39.423 23.315 31.403 1.00 0.00 H ATOM 73764 H6S PA 1777 37.953 24.019 31.800 1.00 0.00 H ATOM 73765 C15 PA 1777 37.666 22.143 30.768 1.00 0.00 C ATOM 73766 H5R PA 1777 36.713 21.863 31.221 1.00 0.00 H ATOM 73767 H5S PA 1777 38.113 21.147 30.771 1.00 0.00 H ATOM 73768 C14 PA 1777 37.430 22.590 29.264 1.00 0.00 C ATOM 73769 H4R PA 1777 38.378 23.018 28.932 1.00 0.00 H ATOM 73770 H4S PA 1777 36.693 23.394 29.201 1.00 0.00 H ATOM 73771 C13 PA 1777 36.886 21.530 28.277 1.00 0.00 C ATOM 73772 H3R PA 1777 36.445 20.733 28.879 1.00 0.00 H ATOM 73773 H3S PA 1777 37.723 21.086 27.735 1.00 0.00 H ATOM 73774 C12 PA 1777 35.892 22.019 27.237 1.00 0.00 C ATOM 73775 H2R PA 1777 36.032 23.039 26.871 1.00 0.00 H ATOM 73776 H2S PA 1777 34.880 21.986 27.646 1.00 0.00 H ATOM 73777 C11 PGR 1778 35.922 21.026 26.111 1.00 0.00 C ATOM 73778 O12 PGR 1778 35.083 20.180 25.860 1.00 0.00 O ATOM 73779 O11 PGR 1778 37.036 21.161 25.357 1.00 0.00 O ATOM 73780 C1 PGR 1778 37.211 20.230 24.363 1.00 0.00 C ATOM 73781 HR PGR 1778 37.765 20.748 23.576 1.00 0.00 H ATOM 73782 HS PGR 1778 36.313 19.820 23.894 1.00 0.00 H ATOM 73783 C2 PGR 1778 38.085 19.103 24.727 1.00 0.00 C ATOM 73784 HX PGR 1778 38.833 19.620 25.333 1.00 0.00 H ATOM 73785 C3 PGR 1778 38.648 18.374 23.532 1.00 0.00 C ATOM 73786 HA PGR 1778 39.207 17.496 23.866 1.00 0.00 H ATOM 73787 HB PGR 1778 39.380 19.033 23.057 1.00 0.00 H ATOM 73788 O31 PGR 1778 37.612 17.844 22.669 1.00 0.00 O ATOM 73789 P31 PGR 1778 37.859 17.422 21.211 1.00 0.00 P ATOM 73790 O32 PGR 1778 37.576 18.736 20.284 1.00 0.00 O ATOM 73791 C31 PGR 1778 36.360 19.233 20.060 1.00 0.00 C ATOM 73792 H1A PGR 1778 35.721 19.165 20.944 1.00 0.00 H ATOM 73793 H1B PGR 1778 35.898 18.679 19.238 1.00 0.00 H ATOM 73794 C32 PGR 1778 36.563 20.752 19.716 1.00 0.00 C ATOM 73795 H2A PGR 1778 35.583 21.227 19.629 1.00 0.00 H ATOM 73796 O35 PGR 1778 37.191 20.721 18.466 1.00 0.00 O ATOM 73797 HO5A PGR 1778 36.537 20.636 17.749 1.00 0.00 H ATOM 73798 C33 PGR 1778 37.371 21.581 20.784 1.00 0.00 C ATOM 73799 H3A PGR 1778 37.351 22.635 20.496 1.00 0.00 H ATOM 73800 H3B PGR 1778 36.833 21.417 21.721 1.00 0.00 H ATOM 73801 O33 PGR 1778 39.260 17.144 20.924 1.00 0.00 O ATOM 73802 O34 PGR 1778 36.810 16.417 20.893 1.00 0.00 O ATOM 73803 O21 PGR 1778 37.297 18.171 25.599 1.00 0.00 O ATOM 73804 C21 PGR 1778 37.954 17.667 26.701 1.00 0.00 C ATOM 73805 O22 PGR 1778 39.064 17.956 26.973 1.00 0.00 O ATOM 73806 O36 PGR 1778 38.709 21.174 21.061 1.00 0.00 O ATOM 73807 HO6A PGR 1778 39.085 21.920 21.563 1.00 0.00 H ATOM 73808 C12 OL 1779 36.991 16.782 27.531 1.00 0.00 C ATOM 73809 H2R OL 1779 35.935 16.917 27.288 1.00 0.00 H ATOM 73810 H2S OL 1779 37.177 15.743 27.249 1.00 0.00 H ATOM 73811 C13 OL 1779 37.204 17.074 28.951 1.00 0.00 C ATOM 73812 H3R OL 1779 38.235 16.798 29.184 1.00 0.00 H ATOM 73813 H3S OL 1779 36.987 18.061 29.364 1.00 0.00 H ATOM 73814 C14 OL 1779 36.265 16.184 29.853 1.00 0.00 C ATOM 73815 H4R OL 1779 35.371 16.676 30.243 1.00 0.00 H ATOM 73816 H4S OL 1779 35.882 15.378 29.225 1.00 0.00 H ATOM 73817 C15 OL 1779 36.998 15.617 31.062 1.00 0.00 C ATOM 73818 H5R OL 1779 36.481 14.722 31.413 1.00 0.00 H ATOM 73819 H5S OL 1779 38.001 15.314 30.752 1.00 0.00 H ATOM 73820 C16 OL 1779 37.155 16.615 32.178 1.00 0.00 C ATOM 73821 H6R OL 1779 37.775 16.133 32.937 1.00 0.00 H ATOM 73822 H6S OL 1779 37.574 17.558 31.821 1.00 0.00 H ATOM 73823 C17 OL 1779 35.871 16.950 32.872 1.00 0.00 C ATOM 73824 H7R OL 1779 35.290 17.608 32.222 1.00 0.00 H ATOM 73825 H7S OL 1779 35.341 15.999 32.963 1.00 0.00 H ATOM 73826 C18 OL 1779 35.916 17.687 34.227 1.00 0.00 C ATOM 73827 H8R OL 1779 36.237 17.061 35.062 1.00 0.00 H ATOM 73828 H8S OL 1779 36.647 18.495 34.151 1.00 0.00 H ATOM 73829 C19 OL 1779 34.578 18.247 34.435 1.00 0.00 C ATOM 73830 H9R OL 1779 33.786 17.892 33.780 1.00 0.00 H ATOM 73831 C110 OL 1779 34.253 19.247 35.330 1.00 0.00 C ATOM 73832 H10R OL 1779 33.275 19.700 35.468 1.00 0.00 H ATOM 73833 C111 OL 1779 35.171 19.625 36.452 1.00 0.00 C ATOM 73834 H11R OL 1779 34.849 19.176 37.394 1.00 0.00 H ATOM 73835 H11S OL 1779 36.149 19.186 36.242 1.00 0.00 H ATOM 73836 C112 OL 1779 35.348 21.183 36.680 1.00 0.00 C ATOM 73837 H12R OL 1779 36.348 21.512 36.971 1.00 0.00 H ATOM 73838 H12S OL 1779 35.107 21.657 35.726 1.00 0.00 H ATOM 73839 C113 OL 1779 34.266 21.795 37.573 1.00 0.00 C ATOM 73840 H13R OL 1779 33.794 21.039 38.203 1.00 0.00 H ATOM 73841 H13S OL 1779 34.642 22.535 38.282 1.00 0.00 H ATOM 73842 C114 OL 1779 33.081 22.455 36.844 1.00 0.00 C ATOM 73843 H14R OL 1779 33.465 23.121 36.069 1.00 0.00 H ATOM 73844 H14S OL 1779 32.674 21.775 36.092 1.00 0.00 H ATOM 73845 C115 OL 1779 32.144 23.141 37.824 1.00 0.00 C ATOM 73846 H15R OL 1779 31.885 22.594 38.732 1.00 0.00 H ATOM 73847 H15S OL 1779 32.511 24.081 38.241 1.00 0.00 H ATOM 73848 C116 OL 1779 30.771 23.616 37.139 1.00 0.00 C ATOM 73849 H16R OL 1779 31.066 24.115 36.213 1.00 0.00 H ATOM 73850 H16S OL 1779 30.212 22.726 36.840 1.00 0.00 H ATOM 73851 C117 OL 1779 29.857 24.529 37.954 1.00 0.00 C ATOM 73852 H17R OL 1779 29.387 23.968 38.764 1.00 0.00 H ATOM 73853 H17S OL 1779 30.385 25.347 38.449 1.00 0.00 H ATOM 73854 C118 OL 1779 28.786 25.163 37.015 1.00 0.00 C ATOM 73855 H18R OL 1779 29.324 25.855 36.363 1.00 0.00 H ATOM 73856 H18S OL 1779 27.951 25.689 37.484 1.00 0.00 H ATOM 73857 H18T OL 1779 28.332 24.333 36.469 1.00 0.00 H TER 73858 OL 1779 ATOM 73858 C116 PA 1780 105.075 140.308 40.814 1.00 0.00 C ATOM 73859 H16R PA 1780 105.618 141.226 41.052 1.00 0.00 H ATOM 73860 H16S PA 1780 105.673 139.423 41.043 1.00 0.00 H ATOM 73861 H16T PA 1780 104.166 140.209 41.411 1.00 0.00 H ATOM 73862 C115 PA 1780 104.795 140.283 39.314 1.00 0.00 C ATOM 73863 H15R PA 1780 104.374 139.307 39.064 1.00 0.00 H ATOM 73864 H15S PA 1780 105.704 140.461 38.736 1.00 0.00 H ATOM 73865 C114 PA 1780 103.681 141.228 38.753 1.00 0.00 C ATOM 73866 H14R PA 1780 104.045 142.252 38.851 1.00 0.00 H ATOM 73867 H14S PA 1780 102.781 141.327 39.365 1.00 0.00 H ATOM 73868 C113 PA 1780 103.346 141.046 37.296 1.00 0.00 C ATOM 73869 H13R PA 1780 102.998 140.031 37.094 1.00 0.00 H ATOM 73870 H13S PA 1780 104.237 141.147 36.673 1.00 0.00 H ATOM 73871 C112 PA 1780 102.164 141.988 36.980 1.00 0.00 C ATOM 73872 H12R PA 1780 102.405 142.971 37.391 1.00 0.00 H ATOM 73873 H12S PA 1780 101.316 141.577 37.532 1.00 0.00 H ATOM 73874 C111 PA 1780 101.777 142.070 35.431 1.00 0.00 C ATOM 73875 H11R PA 1780 102.651 142.491 34.930 1.00 0.00 H ATOM 73876 H11S PA 1780 101.031 142.851 35.268 1.00 0.00 H ATOM 73877 C110 PA 1780 101.358 140.814 34.722 1.00 0.00 C ATOM 73878 H10R PA 1780 100.399 140.483 35.126 1.00 0.00 H ATOM 73879 H10S PA 1780 102.152 140.135 35.040 1.00 0.00 H ATOM 73880 C19 PA 1780 101.291 140.913 33.233 1.00 0.00 C ATOM 73881 H9R PA 1780 102.142 141.454 32.814 1.00 0.00 H ATOM 73882 H9S PA 1780 100.500 141.652 33.088 1.00 0.00 H ATOM 73883 C18 PA 1780 101.069 139.597 32.526 1.00 0.00 C ATOM 73884 H8R PA 1780 100.306 139.039 33.071 1.00 0.00 H ATOM 73885 H8S PA 1780 102.024 139.072 32.596 1.00 0.00 H ATOM 73886 C17 PA 1780 100.720 139.780 31.017 1.00 0.00 C ATOM 73887 H7R PA 1780 101.620 139.893 30.407 1.00 0.00 H ATOM 73888 H7S PA 1780 100.197 140.736 30.948 1.00 0.00 H ATOM 73889 C16 PA 1780 99.989 138.662 30.372 1.00 0.00 C ATOM 73890 H6R PA 1780 99.170 138.446 31.061 1.00 0.00 H ATOM 73891 H6S PA 1780 100.605 137.764 30.300 1.00 0.00 H ATOM 73892 C15 PA 1780 99.382 138.921 28.989 1.00 0.00 C ATOM 73893 H5R PA 1780 98.725 139.777 29.159 1.00 0.00 H ATOM 73894 H5S PA 1780 98.615 138.183 28.742 1.00 0.00 H ATOM 73895 C14 PA 1780 100.352 139.150 27.845 1.00 0.00 C ATOM 73896 H4R PA 1780 101.107 138.366 27.759 1.00 0.00 H ATOM 73897 H4S PA 1780 100.879 140.079 28.070 1.00 0.00 H ATOM 73898 C13 PA 1780 99.693 139.206 26.469 1.00 0.00 C ATOM 73899 H3R PA 1780 100.474 139.565 25.795 1.00 0.00 H ATOM 73900 H3S PA 1780 98.870 139.924 26.436 1.00 0.00 H ATOM 73901 C12 PA 1780 99.248 137.877 25.912 1.00 0.00 C ATOM 73902 H2R PA 1780 98.517 137.435 26.593 1.00 0.00 H ATOM 73903 H2S PA 1780 100.072 137.162 25.862 1.00 0.00 H ATOM 73904 C11 PGR 1781 98.629 138.031 24.491 1.00 0.00 C ATOM 73905 O12 PGR 1781 98.169 139.060 24.087 1.00 0.00 O ATOM 73906 O11 PGR 1781 98.815 136.875 23.803 1.00 0.00 O ATOM 73907 C1 PGR 1781 98.605 136.902 22.405 1.00 0.00 C ATOM 73908 HR PGR 1781 99.194 137.749 22.045 1.00 0.00 H ATOM 73909 HS PGR 1781 97.620 137.189 22.027 1.00 0.00 H ATOM 73910 C2 PGR 1781 99.148 135.643 21.816 1.00 0.00 C ATOM 73911 HX PGR 1781 100.238 135.720 21.797 1.00 0.00 H ATOM 73912 C3 PGR 1781 98.496 135.466 20.429 1.00 0.00 C ATOM 73913 HA PGR 1781 98.392 136.436 19.936 1.00 0.00 H ATOM 73914 HB PGR 1781 97.469 135.093 20.444 1.00 0.00 H ATOM 73915 O31 PGR 1781 99.218 134.486 19.715 1.00 0.00 O ATOM 73916 P31 PGR 1781 99.027 134.331 18.169 1.00 0.00 P ATOM 73917 O32 PGR 1781 97.489 133.797 18.053 1.00 0.00 O ATOM 73918 C31 PGR 1781 96.923 133.506 16.789 1.00 0.00 C ATOM 73919 H1A PGR 1781 97.262 132.554 16.373 1.00 0.00 H ATOM 73920 H1B PGR 1781 97.350 134.211 16.070 1.00 0.00 H ATOM 73921 C32 PGR 1781 95.431 133.530 16.929 1.00 0.00 C ATOM 73922 H2A PGR 1781 94.965 134.473 17.228 1.00 0.00 H ATOM 73923 O35 PGR 1781 95.024 132.416 17.650 1.00 0.00 O ATOM 73924 HO5A PGR 1781 95.370 132.521 18.554 1.00 0.00 H ATOM 73925 C33 PGR 1781 94.825 133.382 15.503 1.00 0.00 C ATOM 73926 H3A PGR 1781 95.515 133.911 14.840 1.00 0.00 H ATOM 73927 H3B PGR 1781 94.715 132.320 15.270 1.00 0.00 H ATOM 73928 O33 PGR 1781 99.176 135.681 17.597 1.00 0.00 O ATOM 73929 O34 PGR 1781 99.886 133.273 17.680 1.00 0.00 O ATOM 73930 O21 PGR 1781 98.742 134.523 22.647 1.00 0.00 O ATOM 73931 C21 PGR 1781 99.380 133.395 22.712 1.00 0.00 C ATOM 73932 O22 PGR 1781 100.491 133.218 22.217 1.00 0.00 O ATOM 73933 O36 PGR 1781 93.527 134.047 15.432 1.00 0.00 O ATOM 73934 HO6A PGR 1781 92.975 133.520 16.037 1.00 0.00 H ATOM 73935 C12 OL 1782 98.602 132.375 23.509 1.00 0.00 C ATOM 73936 H2R OL 1782 97.702 132.059 22.977 1.00 0.00 H ATOM 73937 H2S OL 1782 99.107 131.411 23.426 1.00 0.00 H ATOM 73938 C13 OL 1782 98.261 132.685 24.998 1.00 0.00 C ATOM 73939 H3R OL 1782 99.214 132.822 25.514 1.00 0.00 H ATOM 73940 H3S OL 1782 97.712 133.628 25.049 1.00 0.00 H ATOM 73941 C14 OL 1782 97.557 131.492 25.651 1.00 0.00 C ATOM 73942 H4R OL 1782 97.198 131.831 26.626 1.00 0.00 H ATOM 73943 H4S OL 1782 96.668 131.303 25.046 1.00 0.00 H ATOM 73944 C15 OL 1782 98.385 130.279 25.775 1.00 0.00 C ATOM 73945 H5R OL 1782 97.765 129.477 26.181 1.00 0.00 H ATOM 73946 H5S OL 1782 98.822 129.850 24.870 1.00 0.00 H ATOM 73947 C16 OL 1782 99.450 130.343 26.896 1.00 0.00 C ATOM 73948 H6R OL 1782 100.101 131.187 26.659 1.00 0.00 H ATOM 73949 H6S OL 1782 98.928 130.584 27.825 1.00 0.00 H ATOM 73950 C17 OL 1782 100.383 129.185 27.165 1.00 0.00 C ATOM 73951 H7R OL 1782 99.784 128.274 27.221 1.00 0.00 H ATOM 73952 H7S OL 1782 101.096 128.982 26.363 1.00 0.00 H ATOM 73953 C18 OL 1782 101.092 129.431 28.497 1.00 0.00 C ATOM 73954 H8R OL 1782 101.489 130.448 28.523 1.00 0.00 H ATOM 73955 H8S OL 1782 100.299 129.407 29.248 1.00 0.00 H ATOM 73956 C19 OL 1782 102.161 128.421 28.697 1.00 0.00 C ATOM 73957 H9R OL 1782 102.523 127.916 27.805 1.00 0.00 H ATOM 73958 C110 OL 1782 102.632 127.973 29.884 1.00 0.00 C ATOM 73959 H10R OL 1782 103.279 127.101 29.947 1.00 0.00 H ATOM 73960 C111 OL 1782 102.379 128.656 31.166 1.00 0.00 C ATOM 73961 H11R OL 1782 101.702 129.506 31.061 1.00 0.00 H ATOM 73962 H11S OL 1782 101.711 127.980 31.704 1.00 0.00 H ATOM 73963 C112 OL 1782 103.657 128.970 31.948 1.00 0.00 C ATOM 73964 H12R OL 1782 104.101 127.974 31.995 1.00 0.00 H ATOM 73965 H12S OL 1782 104.412 129.579 31.445 1.00 0.00 H ATOM 73966 C113 OL 1782 103.430 129.450 33.370 1.00 0.00 C ATOM 73967 H13R OL 1782 103.172 130.509 33.427 1.00 0.00 H ATOM 73968 H13S OL 1782 102.525 128.894 33.626 1.00 0.00 H ATOM 73969 C114 OL 1782 104.479 129.007 34.331 1.00 0.00 C ATOM 73970 H14R OL 1782 104.844 127.998 34.128 1.00 0.00 H ATOM 73971 H14S OL 1782 105.475 129.452 34.277 1.00 0.00 H ATOM 73972 C115 OL 1782 104.064 129.159 35.761 1.00 0.00 C ATOM 73973 H15R OL 1782 103.700 130.187 35.816 1.00 0.00 H ATOM 73974 H15S OL 1782 103.172 128.616 36.079 1.00 0.00 H ATOM 73975 C116 OL 1782 105.089 128.714 36.803 1.00 0.00 C ATOM 73976 H16R OL 1782 105.154 127.643 36.599 1.00 0.00 H ATOM 73977 H16S OL 1782 106.085 129.133 36.645 1.00 0.00 H ATOM 73978 C117 OL 1782 104.738 128.945 38.315 1.00 0.00 C ATOM 73979 H17R OL 1782 104.700 130.025 38.470 1.00 0.00 H ATOM 73980 H17S OL 1782 103.696 128.628 38.401 1.00 0.00 H ATOM 73981 C118 OL 1782 105.670 128.253 39.254 1.00 0.00 C ATOM 73982 H18R OL 1782 105.352 127.246 39.531 1.00 0.00 H ATOM 73983 H18S OL 1782 105.828 128.855 40.151 1.00 0.00 H ATOM 73984 H18T OL 1782 106.703 128.090 38.938 1.00 0.00 H TER 73985 OL 1782 ATOM 73985 C116 PA 1783 24.191 14.837 37.742 1.00 0.00 C ATOM 73986 H16R PA 1783 24.520 15.803 38.132 1.00 0.00 H ATOM 73987 H16S PA 1783 24.155 14.060 38.507 1.00 0.00 H ATOM 73988 H16T PA 1783 23.184 15.035 37.371 1.00 0.00 H ATOM 73989 C115 PA 1783 25.029 14.368 36.565 1.00 0.00 C ATOM 73990 H15R PA 1783 25.166 15.149 35.814 1.00 0.00 H ATOM 73991 H15S PA 1783 24.500 13.556 36.062 1.00 0.00 H ATOM 73992 C114 PA 1783 26.401 13.954 37.047 1.00 0.00 C ATOM 73993 H14R PA 1783 26.262 13.070 37.673 1.00 0.00 H ATOM 73994 H14S PA 1783 26.985 14.691 37.602 1.00 0.00 H ATOM 73995 C113 PA 1783 27.337 13.614 35.791 1.00 0.00 C ATOM 73996 H13R PA 1783 27.582 14.551 35.287 1.00 0.00 H ATOM 73997 H13S PA 1783 26.833 12.892 35.145 1.00 0.00 H ATOM 73998 C112 PA 1783 28.685 13.016 36.138 1.00 0.00 C ATOM 73999 H12R PA 1783 29.336 13.727 36.650 1.00 0.00 H ATOM 74000 H12S PA 1783 29.303 12.736 35.283 1.00 0.00 H ATOM 74001 C111 PA 1783 28.703 11.725 36.963 1.00 0.00 C ATOM 74002 H11R PA 1783 28.330 11.945 37.966 1.00 0.00 H ATOM 74003 H11S PA 1783 29.683 11.252 37.049 1.00 0.00 H ATOM 74004 C110 PA 1783 27.995 10.538 36.404 1.00 0.00 C ATOM 74005 H10R PA 1783 26.946 10.723 36.643 1.00 0.00 H ATOM 74006 H10S PA 1783 28.285 9.591 36.864 1.00 0.00 H ATOM 74007 C19 PA 1783 28.167 10.346 34.893 1.00 0.00 C ATOM 74008 H9R PA 1783 29.157 10.700 34.598 1.00 0.00 H ATOM 74009 H9S PA 1783 27.447 10.928 34.314 1.00 0.00 H ATOM 74010 C18 PA 1783 28.116 8.836 34.640 1.00 0.00 C ATOM 74011 H8R PA 1783 27.710 8.158 35.393 1.00 0.00 H ATOM 74012 H8S PA 1783 29.162 8.538 34.741 1.00 0.00 H ATOM 74013 C17 PA 1783 27.616 8.294 33.264 1.00 0.00 C ATOM 74014 H7R PA 1783 26.525 8.298 33.233 1.00 0.00 H ATOM 74015 H7S PA 1783 27.876 7.234 33.285 1.00 0.00 H ATOM 74016 C16 PA 1783 28.092 9.060 32.035 1.00 0.00 C ATOM 74017 H6R PA 1783 29.161 9.234 32.174 1.00 0.00 H ATOM 74018 H6S PA 1783 27.614 10.042 32.039 1.00 0.00 H ATOM 74019 C15 PA 1783 27.919 8.263 30.746 1.00 0.00 C ATOM 74020 H5R PA 1783 26.860 7.994 30.730 1.00 0.00 H ATOM 74021 H5S PA 1783 28.470 7.321 30.754 1.00 0.00 H ATOM 74022 C14 PA 1783 28.277 9.074 29.542 1.00 0.00 C ATOM 74023 H4R PA 1783 29.110 9.747 29.758 1.00 0.00 H ATOM 74024 H4S PA 1783 27.422 9.742 29.411 1.00 0.00 H ATOM 74025 C13 PA 1783 28.808 8.259 28.321 1.00 0.00 C ATOM 74026 H3R PA 1783 28.054 7.531 28.013 1.00 0.00 H ATOM 74027 H3S PA 1783 29.567 7.527 28.600 1.00 0.00 H ATOM 74028 C12 PA 1783 29.096 9.117 27.088 1.00 0.00 C ATOM 74029 H2R PA 1783 29.949 8.603 26.641 1.00 0.00 H ATOM 74030 H2S PA 1783 29.411 10.098 27.449 1.00 0.00 H ATOM 74031 C11 PGR 1784 27.926 9.361 26.138 1.00 0.00 C ATOM 74032 O12 PGR 1784 27.608 10.463 25.735 1.00 0.00 O ATOM 74033 O11 PGR 1784 27.251 8.216 25.708 1.00 0.00 O ATOM 74034 C1 PGR 1784 26.155 8.364 24.728 1.00 0.00 C ATOM 74035 HR PGR 1784 26.566 9.062 23.993 1.00 0.00 H ATOM 74036 HS PGR 1784 25.269 8.746 25.241 1.00 0.00 H ATOM 74037 C2 PGR 1784 25.955 7.084 23.980 1.00 0.00 C ATOM 74038 HX PGR 1784 26.966 6.720 23.781 1.00 0.00 H ATOM 74039 C3 PGR 1784 25.110 7.305 22.657 1.00 0.00 C ATOM 74040 HA PGR 1784 25.473 8.168 22.092 1.00 0.00 H ATOM 74041 HB PGR 1784 24.109 7.531 23.032 1.00 0.00 H ATOM 74042 O31 PGR 1784 25.122 6.183 21.804 1.00 0.00 O ATOM 74043 P31 PGR 1784 24.027 5.824 20.800 1.00 0.00 P ATOM 74044 O32 PGR 1784 22.915 4.952 21.524 1.00 0.00 O ATOM 74045 C31 PGR 1784 23.171 3.683 22.036 1.00 0.00 C ATOM 74046 H1A PGR 1784 24.169 3.745 22.477 1.00 0.00 H ATOM 74047 H1B PGR 1784 23.142 2.884 21.290 1.00 0.00 H ATOM 74048 C32 PGR 1784 22.075 3.415 23.039 1.00 0.00 C ATOM 74049 H2A PGR 1784 22.182 2.400 23.430 1.00 0.00 H ATOM 74050 O35 PGR 1784 20.811 3.420 22.425 1.00 0.00 O ATOM 74051 HO5A PGR 1784 20.648 4.310 22.066 1.00 0.00 H ATOM 74052 C33 PGR 1784 22.137 4.429 24.269 1.00 0.00 C ATOM 74053 H3A PGR 1784 23.163 4.419 24.646 1.00 0.00 H ATOM 74054 H3B PGR 1784 21.925 5.440 23.913 1.00 0.00 H ATOM 74055 O33 PGR 1784 23.440 7.071 20.268 1.00 0.00 O ATOM 74056 O34 PGR 1784 24.639 4.947 19.828 1.00 0.00 O ATOM 74057 O21 PGR 1784 25.249 6.108 24.859 1.00 0.00 O ATOM 74058 C21 PGR 1784 26.046 5.432 25.726 1.00 0.00 C ATOM 74059 O22 PGR 1784 27.238 5.448 25.718 1.00 0.00 O ATOM 74060 O36 PGR 1784 21.191 3.921 25.212 1.00 0.00 O ATOM 74061 HO6A PGR 1784 21.367 4.340 26.073 1.00 0.00 H ATOM 74062 C12 OL 1785 25.269 4.706 26.782 1.00 0.00 C ATOM 74063 H2R OL 1785 24.678 3.969 26.234 1.00 0.00 H ATOM 74064 H2S OL 1785 26.006 4.217 27.422 1.00 0.00 H ATOM 74065 C13 OL 1785 24.429 5.712 27.609 1.00 0.00 C ATOM 74066 H3R OL 1785 23.729 6.225 26.947 1.00 0.00 H ATOM 74067 H3S OL 1785 23.712 5.180 28.238 1.00 0.00 H ATOM 74068 C14 OL 1785 25.246 6.604 28.455 1.00 0.00 C ATOM 74069 H4R OL 1785 25.991 6.154 29.114 1.00 0.00 H ATOM 74070 H4S OL 1785 25.847 7.226 27.788 1.00 0.00 H ATOM 74071 C15 OL 1785 24.391 7.547 29.369 1.00 0.00 C ATOM 74072 H5R OL 1785 25.034 8.429 29.409 1.00 0.00 H ATOM 74073 H5S OL 1785 23.489 7.761 28.791 1.00 0.00 H ATOM 74074 C16 OL 1785 23.973 6.973 30.733 1.00 0.00 C ATOM 74075 H6R OL 1785 23.433 6.033 30.603 1.00 0.00 H ATOM 74076 H6S OL 1785 24.867 6.789 31.332 1.00 0.00 H ATOM 74077 C17 OL 1785 23.215 8.023 31.552 1.00 0.00 C ATOM 74078 H7R OL 1785 23.932 8.824 31.746 1.00 0.00 H ATOM 74079 H7S OL 1785 22.424 8.492 30.963 1.00 0.00 H ATOM 74080 C18 OL 1785 22.611 7.342 32.821 1.00 0.00 C ATOM 74081 H8R OL 1785 22.139 6.443 32.420 1.00 0.00 H ATOM 74082 H8S OL 1785 23.509 7.273 33.438 1.00 0.00 H ATOM 74083 C19 OL 1785 21.618 8.297 33.419 1.00 0.00 C ATOM 74084 H9R OL 1785 20.968 8.797 32.706 1.00 0.00 H ATOM 74085 C110 OL 1785 21.515 8.663 34.620 1.00 0.00 C ATOM 74086 H10R OL 1785 20.856 9.485 34.886 1.00 0.00 H ATOM 74087 C111 OL 1785 22.180 8.075 35.777 1.00 0.00 C ATOM 74088 H11R OL 1785 22.384 7.018 35.592 1.00 0.00 H ATOM 74089 H11S OL 1785 23.155 8.551 35.896 1.00 0.00 H ATOM 74090 C112 OL 1785 21.669 8.243 37.127 1.00 0.00 C ATOM 74091 H12R OL 1785 21.647 9.261 37.521 1.00 0.00 H ATOM 74092 H12S OL 1785 20.637 7.918 37.275 1.00 0.00 H ATOM 74093 C113 OL 1785 22.324 7.326 38.106 1.00 0.00 C ATOM 74094 H13R OL 1785 22.481 6.256 37.955 1.00 0.00 H ATOM 74095 H13S OL 1785 23.368 7.634 38.025 1.00 0.00 H ATOM 74096 C114 OL 1785 21.922 7.538 39.526 1.00 0.00 C ATOM 74097 H14R OL 1785 22.469 8.456 39.749 1.00 0.00 H ATOM 74098 H14S OL 1785 20.878 7.605 39.839 1.00 0.00 H ATOM 74099 C115 OL 1785 22.575 6.644 40.548 1.00 0.00 C ATOM 74100 H15R OL 1785 23.659 6.598 40.423 1.00 0.00 H ATOM 74101 H15S OL 1785 22.450 7.101 41.532 1.00 0.00 H ATOM 74102 C116 OL 1785 22.029 5.093 40.684 1.00 0.00 C ATOM 74103 H16R OL 1785 22.047 4.844 39.621 1.00 0.00 H ATOM 74104 H16S OL 1785 22.606 4.344 41.231 1.00 0.00 H ATOM 74105 C117 OL 1785 20.565 4.923 41.316 1.00 0.00 C ATOM 74106 H17R OL 1785 19.902 5.709 40.949 1.00 0.00 H ATOM 74107 H17S OL 1785 20.124 4.041 40.845 1.00 0.00 H ATOM 74108 C118 OL 1785 20.527 4.848 42.824 1.00 0.00 C ATOM 74109 H18R OL 1785 20.182 5.827 43.165 1.00 0.00 H ATOM 74110 H18S OL 1785 21.487 4.932 43.336 1.00 0.00 H ATOM 74111 H18T OL 1785 19.848 4.070 43.181 1.00 0.00 H TER 74112 OL 1785 ATOM 74112 C116 PA 1786 84.151 12.167 41.272 1.00 0.00 C ATOM 74113 H16R PA 1786 84.922 11.686 41.877 1.00 0.00 H ATOM 74114 H16S PA 1786 83.139 11.819 41.493 1.00 0.00 H ATOM 74115 H16T PA 1786 84.246 13.186 41.651 1.00 0.00 H ATOM 74116 C115 PA 1786 84.427 12.015 39.822 1.00 0.00 C ATOM 74117 H15R PA 1786 83.613 12.456 39.243 1.00 0.00 H ATOM 74118 H15S PA 1786 84.257 10.993 39.479 1.00 0.00 H ATOM 74119 C114 PA 1786 85.733 12.622 39.391 1.00 0.00 C ATOM 74120 H14R PA 1786 86.548 12.183 39.971 1.00 0.00 H ATOM 74121 H14S PA 1786 85.645 13.680 39.644 1.00 0.00 H ATOM 74122 C113 PA 1786 86.151 12.408 37.946 1.00 0.00 C ATOM 74123 H13R PA 1786 86.000 11.346 37.743 1.00 0.00 H ATOM 74124 H13S PA 1786 87.154 12.750 37.687 1.00 0.00 H ATOM 74125 C112 PA 1786 85.327 13.267 37.045 1.00 0.00 C ATOM 74126 H12R PA 1786 85.691 14.267 37.290 1.00 0.00 H ATOM 74127 H12S PA 1786 84.305 13.093 37.385 1.00 0.00 H ATOM 74128 C111 PA 1786 85.470 13.131 35.504 1.00 0.00 C ATOM 74129 H11R PA 1786 84.837 12.313 35.155 1.00 0.00 H ATOM 74130 H11S PA 1786 86.534 12.932 35.359 1.00 0.00 H ATOM 74131 C110 PA 1786 85.093 14.322 34.655 1.00 0.00 C ATOM 74132 H10R PA 1786 85.652 15.240 34.847 1.00 0.00 H ATOM 74133 H10S PA 1786 84.021 14.486 34.782 1.00 0.00 H ATOM 74134 C19 PA 1786 85.082 14.093 33.118 1.00 0.00 C ATOM 74135 H9R PA 1786 84.345 13.295 33.005 1.00 0.00 H ATOM 74136 H9S PA 1786 86.000 13.575 32.832 1.00 0.00 H ATOM 74137 C18 PA 1786 84.721 15.245 32.231 1.00 0.00 C ATOM 74138 H8R PA 1786 85.494 16.015 32.266 1.00 0.00 H ATOM 74139 H8S PA 1786 83.783 15.653 32.614 1.00 0.00 H ATOM 74140 C17 PA 1786 84.582 14.881 30.761 1.00 0.00 C ATOM 74141 H7R PA 1786 83.834 14.101 30.602 1.00 0.00 H ATOM 74142 H7S PA 1786 85.506 14.530 30.299 1.00 0.00 H ATOM 74143 C16 PA 1786 84.089 16.174 29.997 1.00 0.00 C ATOM 74144 H6R PA 1786 84.978 16.806 29.941 1.00 0.00 H ATOM 74145 H6S PA 1786 83.288 16.715 30.506 1.00 0.00 H ATOM 74146 C15 PA 1786 83.549 15.832 28.610 1.00 0.00 C ATOM 74147 H5R PA 1786 82.667 15.196 28.702 1.00 0.00 H ATOM 74148 H5S PA 1786 84.227 15.195 28.038 1.00 0.00 H ATOM 74149 C14 PA 1786 83.260 16.970 27.614 1.00 0.00 C ATOM 74150 H4R PA 1786 82.872 16.517 26.699 1.00 0.00 H ATOM 74151 H4S PA 1786 84.166 17.476 27.276 1.00 0.00 H ATOM 74152 C13 PA 1786 82.309 18.027 28.225 1.00 0.00 C ATOM 74153 H3R PA 1786 82.623 18.944 27.722 1.00 0.00 H ATOM 74154 H3S PA 1786 82.583 18.165 29.273 1.00 0.00 H ATOM 74155 C12 PA 1786 80.773 17.796 28.017 1.00 0.00 C ATOM 74156 H2R PA 1786 80.224 18.624 28.469 1.00 0.00 H ATOM 74157 H2S PA 1786 80.594 16.891 28.603 1.00 0.00 H ATOM 74158 C11 PGR 1787 80.445 17.685 26.536 1.00 0.00 C ATOM 74159 O12 PGR 1787 80.576 18.627 25.786 1.00 0.00 O ATOM 74160 O11 PGR 1787 79.987 16.444 26.174 1.00 0.00 O ATOM 74161 C1 PGR 1787 79.588 16.004 24.820 1.00 0.00 C ATOM 74162 HR PGR 1787 78.959 16.783 24.382 1.00 0.00 H ATOM 74163 HS PGR 1787 78.907 15.159 24.949 1.00 0.00 H ATOM 74164 C2 PGR 1787 80.815 15.652 23.986 1.00 0.00 C ATOM 74165 HX PGR 1787 81.513 16.465 24.205 1.00 0.00 H ATOM 74166 C3 PGR 1787 80.382 15.407 22.518 1.00 0.00 C ATOM 74167 HA PGR 1787 81.330 15.578 22.002 1.00 0.00 H ATOM 74168 HB PGR 1787 79.656 16.150 22.177 1.00 0.00 H ATOM 74169 O31 PGR 1787 79.711 14.235 22.282 1.00 0.00 O ATOM 74170 P31 PGR 1787 79.328 13.654 20.814 1.00 0.00 P ATOM 74171 O32 PGR 1787 80.370 12.448 20.578 1.00 0.00 O ATOM 74172 C31 PGR 1787 80.349 11.150 21.195 1.00 0.00 C ATOM 74173 H1A PGR 1787 79.376 10.835 21.580 1.00 0.00 H ATOM 74174 H1B PGR 1787 80.954 11.226 22.103 1.00 0.00 H ATOM 74175 C32 PGR 1787 80.967 10.144 20.178 1.00 0.00 C ATOM 74176 H2A PGR 1787 82.053 10.247 20.235 1.00 0.00 H ATOM 74177 O35 PGR 1787 80.455 10.439 18.885 1.00 0.00 O ATOM 74178 HO5A PGR 1787 79.536 10.734 19.014 1.00 0.00 H ATOM 74179 C33 PGR 1787 80.694 8.617 20.497 1.00 0.00 C ATOM 74180 H3A PGR 1787 80.682 8.447 21.577 1.00 0.00 H ATOM 74181 H3B PGR 1787 79.730 8.291 20.098 1.00 0.00 H ATOM 74182 O33 PGR 1787 77.998 13.040 20.898 1.00 0.00 O ATOM 74183 O34 PGR 1787 79.676 14.579 19.740 1.00 0.00 O ATOM 74184 O21 PGR 1787 81.374 14.434 24.519 1.00 0.00 O ATOM 74185 C21 PGR 1787 82.530 13.946 24.083 1.00 0.00 C ATOM 74186 O22 PGR 1787 83.035 14.343 23.042 1.00 0.00 O ATOM 74187 O36 PGR 1787 81.749 7.870 19.995 1.00 0.00 O ATOM 74188 HO6A PGR 1787 81.671 6.998 20.422 1.00 0.00 H ATOM 74189 C12 OL 1788 83.245 12.813 24.842 1.00 0.00 C ATOM 74190 H2R OL 1788 82.791 11.885 24.488 1.00 0.00 H ATOM 74191 H2S OL 1788 84.319 12.867 24.651 1.00 0.00 H ATOM 74192 C13 OL 1788 83.082 12.832 26.370 1.00 0.00 C ATOM 74193 H3R OL 1788 83.203 13.902 26.551 1.00 0.00 H ATOM 74194 H3S OL 1788 82.036 12.632 26.613 1.00 0.00 H ATOM 74195 C14 OL 1788 84.039 11.899 27.128 1.00 0.00 C ATOM 74196 H4R OL 1788 85.103 12.060 26.943 1.00 0.00 H ATOM 74197 H4S OL 1788 83.986 12.044 28.209 1.00 0.00 H ATOM 74198 C15 OL 1788 83.733 10.385 26.921 1.00 0.00 C ATOM 74199 H5R OL 1788 82.670 10.242 27.127 1.00 0.00 H ATOM 74200 H5S OL 1788 83.788 10.162 25.853 1.00 0.00 H ATOM 74201 C16 OL 1788 84.644 9.460 27.679 1.00 0.00 C ATOM 74202 H6R OL 1788 85.644 9.870 27.522 1.00 0.00 H ATOM 74203 H6S OL 1788 84.403 9.677 28.722 1.00 0.00 H ATOM 74204 C17 OL 1788 84.451 8.032 27.415 1.00 0.00 C ATOM 74205 H7R OL 1788 83.411 7.861 27.701 1.00 0.00 H ATOM 74206 H7S OL 1788 84.568 7.849 26.345 1.00 0.00 H ATOM 74207 C18 OL 1788 85.369 7.071 28.018 1.00 0.00 C ATOM 74208 H8R OL 1788 85.876 7.467 28.900 1.00 0.00 H ATOM 74209 H8S OL 1788 84.710 6.269 28.358 1.00 0.00 H ATOM 74210 C19 OL 1788 86.412 6.431 27.211 1.00 0.00 C ATOM 74211 H9R OL 1788 86.052 5.807 26.397 1.00 0.00 H ATOM 74212 C110 OL 1788 87.748 6.684 27.158 1.00 0.00 C ATOM 74213 H10R OL 1788 88.346 6.166 26.413 1.00 0.00 H ATOM 74214 C111 OL 1788 88.531 7.735 27.872 1.00 0.00 C ATOM 74215 H11R OL 1788 89.008 8.394 27.144 1.00 0.00 H ATOM 74216 H11S OL 1788 87.944 8.458 28.442 1.00 0.00 H ATOM 74217 C112 OL 1788 89.556 7.121 28.874 1.00 0.00 C ATOM 74218 H12R OL 1788 90.107 6.330 28.361 1.00 0.00 H ATOM 74219 H12S OL 1788 90.278 7.905 29.110 1.00 0.00 H ATOM 74220 C113 OL 1788 88.943 6.407 30.137 1.00 0.00 C ATOM 74221 H13R OL 1788 88.324 7.081 30.734 1.00 0.00 H ATOM 74222 H13S OL 1788 88.198 5.723 29.724 1.00 0.00 H ATOM 74223 C114 OL 1788 89.831 5.579 30.943 1.00 0.00 C ATOM 74224 H14R OL 1788 90.339 4.835 30.325 1.00 0.00 H ATOM 74225 H14S OL 1788 90.738 6.150 31.148 1.00 0.00 H ATOM 74226 C115 OL 1788 89.214 4.916 32.169 1.00 0.00 C ATOM 74227 H15R OL 1788 88.617 5.678 32.674 1.00 0.00 H ATOM 74228 H15S OL 1788 88.430 4.248 31.806 1.00 0.00 H ATOM 74229 C116 OL 1788 90.044 4.149 33.134 1.00 0.00 C ATOM 74230 H16R OL 1788 90.639 3.478 32.511 1.00 0.00 H ATOM 74231 H16S OL 1788 90.745 4.794 33.670 1.00 0.00 H ATOM 74232 C117 OL 1788 89.233 3.551 34.393 1.00 0.00 C ATOM 74233 H17R OL 1788 88.864 4.390 34.986 1.00 0.00 H ATOM 74234 H17S OL 1788 88.383 2.950 34.062 1.00 0.00 H ATOM 74235 C118 OL 1788 90.035 2.716 35.345 1.00 0.00 C ATOM 74236 H18R OL 1788 90.393 1.762 34.953 1.00 0.00 H ATOM 74237 H18S OL 1788 89.353 2.469 36.162 1.00 0.00 H ATOM 74238 H18T OL 1788 90.866 3.278 35.777 1.00 0.00 H TER 74239 OL 1788 ATOM 74239 C116 PA 1789 128.588 128.128 41.257 1.00 0.00 C ATOM 74240 H16R PA 1789 128.262 128.280 42.288 1.00 0.00 H ATOM 74241 H16S PA 1789 129.403 127.403 41.198 1.00 0.00 H ATOM 74242 H16T PA 1789 127.671 127.657 40.896 1.00 0.00 H ATOM 74243 C115 PA 1789 128.785 129.444 40.584 1.00 0.00 C ATOM 74244 H15R PA 1789 129.472 129.947 41.267 1.00 0.00 H ATOM 74245 H15S PA 1789 127.825 129.954 40.479 1.00 0.00 H ATOM 74246 C114 PA 1789 129.414 129.457 39.264 1.00 0.00 C ATOM 74247 H14R PA 1789 128.687 129.197 38.492 1.00 0.00 H ATOM 74248 H14S PA 1789 130.200 128.705 39.166 1.00 0.00 H ATOM 74249 C113 PA 1789 130.014 130.817 38.716 1.00 0.00 C ATOM 74250 H13R PA 1789 130.882 131.022 39.347 1.00 0.00 H ATOM 74251 H13S PA 1789 129.480 131.678 39.122 1.00 0.00 H ATOM 74252 C112 PA 1789 130.423 131.093 37.220 1.00 0.00 C ATOM 74253 H12R PA 1789 131.161 130.397 36.816 1.00 0.00 H ATOM 74254 H12S PA 1789 131.091 131.940 37.386 1.00 0.00 H ATOM 74255 C111 PA 1789 129.253 131.430 36.246 1.00 0.00 C ATOM 74256 H11R PA 1789 129.607 131.847 35.301 1.00 0.00 H ATOM 74257 H11S PA 1789 128.755 132.286 36.707 1.00 0.00 H ATOM 74258 C110 PA 1789 128.358 130.263 35.952 1.00 0.00 C ATOM 74259 H10R PA 1789 127.408 130.537 35.489 1.00 0.00 H ATOM 74260 H10S PA 1789 127.954 129.982 36.927 1.00 0.00 H ATOM 74261 C19 PA 1789 129.007 129.119 35.214 1.00 0.00 C ATOM 74262 H9R PA 1789 128.249 128.432 34.830 1.00 0.00 H ATOM 74263 H9S PA 1789 129.394 128.413 35.952 1.00 0.00 H ATOM 74264 C18 PA 1789 130.060 129.477 34.135 1.00 0.00 C ATOM 74265 H8R PA 1789 130.690 128.595 34.004 1.00 0.00 H ATOM 74266 H8S PA 1789 130.857 130.133 34.492 1.00 0.00 H ATOM 74267 C17 PA 1789 129.468 130.040 32.912 1.00 0.00 C ATOM 74268 H7R PA 1789 128.784 130.830 33.229 1.00 0.00 H ATOM 74269 H7S PA 1789 128.791 129.323 32.443 1.00 0.00 H ATOM 74270 C16 PA 1789 130.534 130.715 31.955 1.00 0.00 C ATOM 74271 H6R PA 1789 131.293 129.967 31.719 1.00 0.00 H ATOM 74272 H6S PA 1789 131.066 131.537 32.439 1.00 0.00 H ATOM 74273 C15 PA 1789 129.828 131.123 30.674 1.00 0.00 C ATOM 74274 H5R PA 1789 130.491 131.710 30.034 1.00 0.00 H ATOM 74275 H5S PA 1789 128.988 131.803 30.834 1.00 0.00 H ATOM 74276 C14 PA 1789 129.470 130.021 29.688 1.00 0.00 C ATOM 74277 H4R PA 1789 128.816 130.446 28.923 1.00 0.00 H ATOM 74278 H4S PA 1789 128.826 129.297 30.192 1.00 0.00 H ATOM 74279 C13 PA 1789 130.603 129.158 29.117 1.00 0.00 C ATOM 74280 H3R PA 1789 130.989 128.527 29.920 1.00 0.00 H ATOM 74281 H3S PA 1789 131.375 129.921 28.997 1.00 0.00 H ATOM 74282 C12 PA 1789 130.285 128.272 27.934 1.00 0.00 C ATOM 74283 H2R PA 1789 129.556 127.509 28.217 1.00 0.00 H ATOM 74284 H2S PA 1789 131.254 127.779 27.833 1.00 0.00 H ATOM 74285 C11 PGR 1790 130.020 129.072 26.647 1.00 0.00 C ATOM 74286 O12 PGR 1790 130.840 129.134 25.775 1.00 0.00 O ATOM 74287 O11 PGR 1790 128.908 129.702 26.600 1.00 0.00 O ATOM 74288 C1 PGR 1790 128.304 130.108 25.337 1.00 0.00 C ATOM 74289 HR PGR 1790 129.041 130.652 24.741 1.00 0.00 H ATOM 74290 HS PGR 1790 127.462 130.792 25.462 1.00 0.00 H ATOM 74291 C2 PGR 1790 127.653 128.934 24.556 1.00 0.00 C ATOM 74292 HX PGR 1790 128.219 128.001 24.623 1.00 0.00 H ATOM 74293 C3 PGR 1790 127.466 129.390 23.124 1.00 0.00 C ATOM 74294 HA PGR 1790 126.944 128.735 22.422 1.00 0.00 H ATOM 74295 HB PGR 1790 128.458 129.591 22.713 1.00 0.00 H ATOM 74296 O31 PGR 1790 126.796 130.657 23.042 1.00 0.00 O ATOM 74297 P31 PGR 1790 126.860 131.588 21.848 1.00 0.00 P ATOM 74298 O32 PGR 1790 125.420 132.357 21.894 1.00 0.00 O ATOM 74299 C31 PGR 1790 125.205 133.432 22.867 1.00 0.00 C ATOM 74300 H1A PGR 1790 126.050 134.121 22.948 1.00 0.00 H ATOM 74301 H1B PGR 1790 124.963 133.045 23.860 1.00 0.00 H ATOM 74302 C32 PGR 1790 123.909 134.194 22.431 1.00 0.00 C ATOM 74303 H2A PGR 1790 123.786 135.093 23.040 1.00 0.00 H ATOM 74304 O35 PGR 1790 122.801 133.336 22.651 1.00 0.00 O ATOM 74305 HO5A PGR 1790 122.933 132.607 22.018 1.00 0.00 H ATOM 74306 C33 PGR 1790 123.935 134.596 20.889 1.00 0.00 C ATOM 74307 H3A PGR 1790 123.107 135.270 20.653 1.00 0.00 H ATOM 74308 H3B PGR 1790 124.894 135.061 20.649 1.00 0.00 H ATOM 74309 O33 PGR 1790 127.937 132.621 22.005 1.00 0.00 O ATOM 74310 O34 PGR 1790 126.906 130.824 20.592 1.00 0.00 O ATOM 74311 O21 PGR 1790 126.377 128.711 25.114 1.00 0.00 O ATOM 74312 C21 PGR 1790 125.622 127.682 24.702 1.00 0.00 C ATOM 74313 O22 PGR 1790 126.065 126.670 24.168 1.00 0.00 O ATOM 74314 O36 PGR 1790 123.824 133.310 20.196 1.00 0.00 O ATOM 74315 HO6A PGR 1790 124.534 132.690 20.442 1.00 0.00 H ATOM 74316 C12 OL 1791 124.213 127.780 25.141 1.00 0.00 C ATOM 74317 H2R OL 1791 124.111 128.745 25.643 1.00 0.00 H ATOM 74318 H2S OL 1791 123.524 127.750 24.294 1.00 0.00 H ATOM 74319 C13 OL 1791 123.813 126.706 26.114 1.00 0.00 C ATOM 74320 H3R OL 1791 122.731 126.598 26.010 1.00 0.00 H ATOM 74321 H3S OL 1791 124.317 125.803 25.764 1.00 0.00 H ATOM 74322 C14 OL 1791 124.255 126.928 27.530 1.00 0.00 C ATOM 74323 H4R OL 1791 124.386 127.996 27.715 1.00 0.00 H ATOM 74324 H4S OL 1791 123.339 126.733 28.093 1.00 0.00 H ATOM 74325 C15 OL 1791 125.475 126.099 28.085 1.00 0.00 C ATOM 74326 H5R OL 1791 125.333 125.017 28.072 1.00 0.00 H ATOM 74327 H5S OL 1791 126.473 126.347 27.717 1.00 0.00 H ATOM 74328 C16 OL 1791 125.588 126.282 29.539 1.00 0.00 C ATOM 74329 H6R OL 1791 125.690 127.328 29.837 1.00 0.00 H ATOM 74330 H6S OL 1791 124.583 126.055 29.901 1.00 0.00 H ATOM 74331 C17 OL 1791 126.661 125.477 30.343 1.00 0.00 C ATOM 74332 H7R OL 1791 127.562 125.626 29.744 1.00 0.00 H ATOM 74333 H7S OL 1791 126.819 125.958 31.310 1.00 0.00 H ATOM 74334 C18 OL 1791 126.265 124.034 30.805 1.00 0.00 C ATOM 74335 H8R OL 1791 126.062 123.410 29.932 1.00 0.00 H ATOM 74336 H8S OL 1791 127.152 123.595 31.266 1.00 0.00 H ATOM 74337 C19 OL 1791 125.039 123.911 31.696 1.00 0.00 C ATOM 74338 H9R OL 1791 124.089 124.016 31.178 1.00 0.00 H ATOM 74339 C110 OL 1791 125.012 123.839 32.985 1.00 0.00 C ATOM 74340 H10R OL 1791 124.004 123.814 33.391 1.00 0.00 H ATOM 74341 C111 OL 1791 126.193 123.345 33.885 1.00 0.00 C ATOM 74342 H11R OL 1791 126.098 122.323 34.258 1.00 0.00 H ATOM 74343 H11S OL 1791 127.090 123.226 33.274 1.00 0.00 H ATOM 74344 C112 OL 1791 126.708 124.385 34.837 1.00 0.00 C ATOM 74345 H12R OL 1791 126.882 125.333 34.323 1.00 0.00 H ATOM 74346 H12S OL 1791 125.875 124.715 35.461 1.00 0.00 H ATOM 74347 C113 OL 1791 127.854 124.134 35.666 1.00 0.00 C ATOM 74348 H13R OL 1791 128.006 124.987 36.329 1.00 0.00 H ATOM 74349 H13S OL 1791 127.570 123.282 36.287 1.00 0.00 H ATOM 74350 C114 OL 1791 129.194 123.941 34.929 1.00 0.00 C ATOM 74351 H14R OL 1791 129.201 123.092 34.242 1.00 0.00 H ATOM 74352 H14S OL 1791 129.454 124.763 34.259 1.00 0.00 H ATOM 74353 C115 OL 1791 130.480 123.791 35.764 1.00 0.00 C ATOM 74354 H15R OL 1791 130.279 122.912 36.380 1.00 0.00 H ATOM 74355 H15S OL 1791 131.216 123.473 35.023 1.00 0.00 H ATOM 74356 C116 OL 1791 130.978 124.978 36.642 1.00 0.00 C ATOM 74357 H16R OL 1791 130.098 125.363 37.162 1.00 0.00 H ATOM 74358 H16S OL 1791 131.694 124.538 37.340 1.00 0.00 H ATOM 74359 C117 OL 1791 131.715 126.158 35.934 1.00 0.00 C ATOM 74360 H17R OL 1791 132.523 125.742 35.329 1.00 0.00 H ATOM 74361 H17S OL 1791 131.072 126.657 35.206 1.00 0.00 H ATOM 74362 C118 OL 1791 132.358 127.178 36.781 1.00 0.00 C ATOM 74363 H18R OL 1791 132.990 127.754 36.102 1.00 0.00 H ATOM 74364 H18S OL 1791 132.947 126.681 37.555 1.00 0.00 H ATOM 74365 H18T OL 1791 131.639 127.774 37.348 1.00 0.00 H TER 74366 OL 1791 ATOM 74366 C116 PA 1792 54.874 19.787 43.119 1.00 0.00 C ATOM 74367 H16R PA 1792 55.301 20.455 43.870 1.00 0.00 H ATOM 74368 H16S PA 1792 55.614 19.485 42.374 1.00 0.00 H ATOM 74369 H16T PA 1792 54.556 18.951 43.744 1.00 0.00 H ATOM 74370 C115 PA 1792 53.649 20.413 42.458 1.00 0.00 C ATOM 74371 H15R PA 1792 53.966 21.352 42.000 1.00 0.00 H ATOM 74372 H15S PA 1792 53.058 20.629 43.350 1.00 0.00 H ATOM 74373 C114 PA 1792 52.987 19.387 41.568 1.00 0.00 C ATOM 74374 H14R PA 1792 51.909 19.553 41.516 1.00 0.00 H ATOM 74375 H14S PA 1792 53.009 18.476 42.170 1.00 0.00 H ATOM 74376 C113 PA 1792 53.571 19.184 40.152 1.00 0.00 C ATOM 74377 H13R PA 1792 53.248 18.273 39.641 1.00 0.00 H ATOM 74378 H13S PA 1792 54.652 19.075 40.262 1.00 0.00 H ATOM 74379 C112 PA 1792 53.337 20.394 39.225 1.00 0.00 C ATOM 74380 H12R PA 1792 53.906 21.252 39.592 1.00 0.00 H ATOM 74381 H12S PA 1792 52.264 20.588 39.182 1.00 0.00 H ATOM 74382 C111 PA 1792 53.806 20.153 37.869 1.00 0.00 C ATOM 74383 H11R PA 1792 53.522 19.168 37.492 1.00 0.00 H ATOM 74384 H11S PA 1792 54.890 20.029 37.900 1.00 0.00 H ATOM 74385 C110 PA 1792 53.399 21.284 36.888 1.00 0.00 C ATOM 74386 H10R PA 1792 53.621 22.229 37.390 1.00 0.00 H ATOM 74387 H10S PA 1792 52.331 21.293 36.659 1.00 0.00 H ATOM 74388 C19 PA 1792 54.114 21.173 35.524 1.00 0.00 C ATOM 74389 H9R PA 1792 54.007 20.255 34.943 1.00 0.00 H ATOM 74390 H9S PA 1792 55.186 21.084 35.715 1.00 0.00 H ATOM 74391 C18 PA 1792 53.944 22.430 34.721 1.00 0.00 C ATOM 74392 H8R PA 1792 54.330 23.275 35.297 1.00 0.00 H ATOM 74393 H8S PA 1792 52.877 22.569 34.534 1.00 0.00 H ATOM 74394 C17 PA 1792 54.598 22.437 33.395 1.00 0.00 C ATOM 74395 H7R PA 1792 54.321 21.477 32.956 1.00 0.00 H ATOM 74396 H7S PA 1792 55.688 22.440 33.469 1.00 0.00 H ATOM 74397 C16 PA 1792 54.298 23.562 32.409 1.00 0.00 C ATOM 74398 H6R PA 1792 54.656 24.408 33.001 1.00 0.00 H ATOM 74399 H6S PA 1792 53.267 23.915 32.338 1.00 0.00 H ATOM 74400 C15 PA 1792 55.127 23.573 31.180 1.00 0.00 C ATOM 74401 H5R PA 1792 54.710 22.924 30.406 1.00 0.00 H ATOM 74402 H5S PA 1792 56.165 23.337 31.420 1.00 0.00 H ATOM 74403 C14 PA 1792 55.193 24.919 30.464 1.00 0.00 C ATOM 74404 H4R PA 1792 55.995 24.724 29.748 1.00 0.00 H ATOM 74405 H4S PA 1792 55.707 25.654 31.086 1.00 0.00 H ATOM 74406 C13 PA 1792 54.069 25.303 29.599 1.00 0.00 C ATOM 74407 H3R PA 1792 53.140 25.520 30.130 1.00 0.00 H ATOM 74408 H3S PA 1792 53.803 24.479 28.933 1.00 0.00 H ATOM 74409 C12 PA 1792 54.527 26.474 28.788 1.00 0.00 C ATOM 74410 H2R PA 1792 54.732 27.332 29.431 1.00 0.00 H ATOM 74411 H2S PA 1792 55.495 26.259 28.330 1.00 0.00 H ATOM 74412 C11 PGR 1793 53.501 26.941 27.762 1.00 0.00 C ATOM 74413 O12 PGR 1793 53.017 28.044 27.812 1.00 0.00 O ATOM 74414 O11 PGR 1793 53.174 25.981 26.871 1.00 0.00 O ATOM 74415 C1 PGR 1793 52.405 26.354 25.708 1.00 0.00 C ATOM 74416 HR PGR 1793 53.079 26.262 24.853 1.00 0.00 H ATOM 74417 HS PGR 1793 52.019 27.370 25.820 1.00 0.00 H ATOM 74418 C2 PGR 1793 51.261 25.301 25.615 1.00 0.00 C ATOM 74419 HX PGR 1793 51.718 24.379 25.984 1.00 0.00 H ATOM 74420 C3 PGR 1793 50.732 25.206 24.153 1.00 0.00 C ATOM 74421 HA PGR 1793 49.814 24.614 24.169 1.00 0.00 H ATOM 74422 HB PGR 1793 51.405 24.655 23.490 1.00 0.00 H ATOM 74423 O31 PGR 1793 50.467 26.504 23.594 1.00 0.00 O ATOM 74424 P31 PGR 1793 49.689 26.573 22.243 1.00 0.00 P ATOM 74425 O32 PGR 1793 48.197 26.358 22.740 1.00 0.00 O ATOM 74426 C31 PGR 1793 47.453 27.380 23.352 1.00 0.00 C ATOM 74427 H1A PGR 1793 48.074 27.964 24.037 1.00 0.00 H ATOM 74428 H1B PGR 1793 46.959 28.030 22.625 1.00 0.00 H ATOM 74429 C32 PGR 1793 46.427 26.761 24.333 1.00 0.00 C ATOM 74430 H2A PGR 1793 46.887 25.966 24.925 1.00 0.00 H ATOM 74431 O35 PGR 1793 45.196 26.219 23.679 1.00 0.00 O ATOM 74432 HO5A PGR 1793 45.523 25.722 22.909 1.00 0.00 H ATOM 74433 C33 PGR 1793 45.958 27.864 25.324 1.00 0.00 C ATOM 74434 H3A PGR 1793 45.411 27.390 26.143 1.00 0.00 H ATOM 74435 H3B PGR 1793 46.840 28.385 25.704 1.00 0.00 H ATOM 74436 O33 PGR 1793 49.766 27.931 21.615 1.00 0.00 O ATOM 74437 O34 PGR 1793 50.167 25.403 21.409 1.00 0.00 O ATOM 74438 O21 PGR 1793 50.073 25.778 26.271 1.00 0.00 O ATOM 74439 C21 PGR 1793 49.905 25.517 27.620 1.00 0.00 C ATOM 74440 O22 PGR 1793 50.726 25.183 28.429 1.00 0.00 O ATOM 74441 O36 PGR 1793 45.139 28.787 24.686 1.00 0.00 O ATOM 74442 HO6A PGR 1793 45.741 29.383 24.205 1.00 0.00 H ATOM 74443 C12 OL 1794 48.566 25.911 28.142 1.00 0.00 C ATOM 74444 H2R OL 1794 47.813 25.566 27.430 1.00 0.00 H ATOM 74445 H2S OL 1794 48.357 25.392 29.079 1.00 0.00 H ATOM 74446 C13 OL 1794 48.463 27.389 28.226 1.00 0.00 C ATOM 74447 H3R OL 1794 48.527 27.695 27.180 1.00 0.00 H ATOM 74448 H3S OL 1794 47.466 27.701 28.545 1.00 0.00 H ATOM 74449 C14 OL 1794 49.440 28.196 29.102 1.00 0.00 C ATOM 74450 H4R OL 1794 50.397 27.998 28.614 1.00 0.00 H ATOM 74451 H4S OL 1794 49.234 29.258 28.954 1.00 0.00 H ATOM 74452 C15 OL 1794 49.416 28.069 30.645 1.00 0.00 C ATOM 74453 H5R OL 1794 49.667 29.022 31.115 1.00 0.00 H ATOM 74454 H5S OL 1794 48.412 27.771 30.954 1.00 0.00 H ATOM 74455 C16 OL 1794 50.396 27.030 31.198 1.00 0.00 C ATOM 74456 H6R OL 1794 49.864 26.092 31.025 1.00 0.00 H ATOM 74457 H6S OL 1794 51.375 27.105 30.720 1.00 0.00 H ATOM 74458 C17 OL 1794 50.617 27.086 32.726 1.00 0.00 C ATOM 74459 H7R OL 1794 51.135 27.990 33.052 1.00 0.00 H ATOM 74460 H7S OL 1794 49.670 27.097 33.268 1.00 0.00 H ATOM 74461 C18 OL 1794 51.461 25.887 33.140 1.00 0.00 C ATOM 74462 H8R OL 1794 51.284 24.970 32.574 1.00 0.00 H ATOM 74463 H8S OL 1794 52.475 26.183 32.865 1.00 0.00 H ATOM 74464 C19 OL 1794 51.351 25.589 34.618 1.00 0.00 C ATOM 74465 H9R OL 1794 50.360 25.301 34.957 1.00 0.00 H ATOM 74466 C110 OL 1794 52.192 25.898 35.659 1.00 0.00 C ATOM 74467 H10R OL 1794 51.881 25.637 36.668 1.00 0.00 H ATOM 74468 C111 OL 1794 53.601 26.429 35.403 1.00 0.00 C ATOM 74469 H11R OL 1794 54.313 25.933 36.067 1.00 0.00 H ATOM 74470 H11S OL 1794 53.918 26.226 34.378 1.00 0.00 H ATOM 74471 C112 OL 1794 53.827 27.939 35.525 1.00 0.00 C ATOM 74472 H12R OL 1794 52.889 28.377 35.180 1.00 0.00 H ATOM 74473 H12S OL 1794 53.785 28.419 36.505 1.00 0.00 H ATOM 74474 C113 OL 1794 55.023 28.417 34.819 1.00 0.00 C ATOM 74475 H13R OL 1794 55.872 28.047 35.397 1.00 0.00 H ATOM 74476 H13S OL 1794 55.034 28.077 33.782 1.00 0.00 H ATOM 74477 C114 OL 1794 55.206 29.884 34.724 1.00 0.00 C ATOM 74478 H14R OL 1794 54.310 30.273 34.237 1.00 0.00 H ATOM 74479 H14S OL 1794 55.225 30.299 35.734 1.00 0.00 H ATOM 74480 C115 OL 1794 56.384 30.423 33.925 1.00 0.00 C ATOM 74481 H15R OL 1794 57.257 29.848 34.241 1.00 0.00 H ATOM 74482 H15S OL 1794 56.283 30.125 32.879 1.00 0.00 H ATOM 74483 C116 OL 1794 56.538 31.977 33.834 1.00 0.00 C ATOM 74484 H16R OL 1794 55.587 32.250 33.372 1.00 0.00 H ATOM 74485 H16S OL 1794 56.755 32.296 34.856 1.00 0.00 H ATOM 74486 C117 OL 1794 57.680 32.384 32.787 1.00 0.00 C ATOM 74487 H17R OL 1794 58.716 32.200 33.079 1.00 0.00 H ATOM 74488 H17S OL 1794 57.546 31.717 31.933 1.00 0.00 H ATOM 74489 C118 OL 1794 57.665 33.803 32.324 1.00 0.00 C ATOM 74490 H18R OL 1794 57.648 34.579 33.092 1.00 0.00 H ATOM 74491 H18S OL 1794 56.702 33.899 31.819 1.00 0.00 H ATOM 74492 H18T OL 1794 58.549 33.916 31.692 1.00 0.00 H TER 74493 OL 1794 ATOM 74493 C116 PA 1795 135.897 24.304 42.206 1.00 0.00 C ATOM 74494 H16R PA 1795 136.704 24.986 41.930 1.00 0.00 H ATOM 74495 H16S PA 1795 135.906 24.427 43.291 1.00 0.00 H ATOM 74496 H16T PA 1795 134.890 24.608 41.911 1.00 0.00 H ATOM 74497 C115 PA 1795 136.275 22.872 41.826 1.00 0.00 C ATOM 74498 H15R PA 1795 135.593 22.305 42.463 1.00 0.00 H ATOM 74499 H15S PA 1795 137.300 22.646 42.130 1.00 0.00 H ATOM 74500 C114 PA 1795 136.146 22.508 40.361 1.00 0.00 C ATOM 74501 H14R PA 1795 136.845 23.096 39.764 1.00 0.00 H ATOM 74502 H14S PA 1795 135.155 22.759 39.978 1.00 0.00 H ATOM 74503 C113 PA 1795 136.274 21.021 40.109 1.00 0.00 C ATOM 74504 H13R PA 1795 135.561 20.516 40.765 1.00 0.00 H ATOM 74505 H13S PA 1795 137.262 20.598 40.300 1.00 0.00 H ATOM 74506 C112 PA 1795 135.916 20.585 38.729 1.00 0.00 C ATOM 74507 H12R PA 1795 136.643 20.910 37.982 1.00 0.00 H ATOM 74508 H12S PA 1795 134.975 21.026 38.396 1.00 0.00 H ATOM 74509 C111 PA 1795 135.704 19.058 38.724 1.00 0.00 C ATOM 74510 H11R PA 1795 135.181 18.677 39.604 1.00 0.00 H ATOM 74511 H11S PA 1795 136.676 18.572 38.828 1.00 0.00 H ATOM 74512 C110 PA 1795 134.960 18.483 37.485 1.00 0.00 C ATOM 74513 H10R PA 1795 133.875 18.402 37.572 1.00 0.00 H ATOM 74514 H10S PA 1795 135.154 17.409 37.516 1.00 0.00 H ATOM 74515 C19 PA 1795 135.286 19.062 36.121 1.00 0.00 C ATOM 74516 H9R PA 1795 136.301 18.857 35.776 1.00 0.00 H ATOM 74517 H9S PA 1795 135.217 20.148 36.213 1.00 0.00 H ATOM 74518 C18 PA 1795 134.243 18.618 35.076 1.00 0.00 C ATOM 74519 H8R PA 1795 133.213 18.671 35.434 1.00 0.00 H ATOM 74520 H8S PA 1795 134.325 17.535 34.960 1.00 0.00 H ATOM 74521 C17 PA 1795 134.452 19.401 33.819 1.00 0.00 C ATOM 74522 H7R PA 1795 135.522 19.609 33.749 1.00 0.00 H ATOM 74523 H7S PA 1795 134.093 20.410 34.031 1.00 0.00 H ATOM 74524 C16 PA 1795 133.807 18.778 32.597 1.00 0.00 C ATOM 74525 H6R PA 1795 132.784 18.490 32.848 1.00 0.00 H ATOM 74526 H6S PA 1795 134.344 17.838 32.451 1.00 0.00 H ATOM 74527 C15 PA 1795 133.961 19.550 31.321 1.00 0.00 C ATOM 74528 H5R PA 1795 135.036 19.528 31.129 1.00 0.00 H ATOM 74529 H5S PA 1795 133.706 20.604 31.451 1.00 0.00 H ATOM 74530 C14 PA 1795 133.328 18.798 30.082 1.00 0.00 C ATOM 74531 H4R PA 1795 132.240 18.860 30.153 1.00 0.00 H ATOM 74532 H4S PA 1795 133.551 17.742 29.910 1.00 0.00 H ATOM 74533 C13 PA 1795 133.759 19.555 28.842 1.00 0.00 C ATOM 74534 H3R PA 1795 134.849 19.590 28.895 1.00 0.00 H ATOM 74535 H3S PA 1795 133.242 20.504 28.683 1.00 0.00 H ATOM 74536 C12 PA 1795 133.446 18.700 27.549 1.00 0.00 C ATOM 74537 H2R PA 1795 132.419 18.333 27.485 1.00 0.00 H ATOM 74538 H2S PA 1795 134.154 17.883 27.392 1.00 0.00 H ATOM 74539 C11 PGR 1796 133.621 19.552 26.322 1.00 0.00 C ATOM 74540 O12 PGR 1796 132.815 20.434 26.004 1.00 0.00 O ATOM 74541 O11 PGR 1796 134.637 19.181 25.579 1.00 0.00 O ATOM 74542 C1 PGR 1796 135.034 20.132 24.471 1.00 0.00 C ATOM 74543 HR PGR 1796 134.158 20.478 23.918 1.00 0.00 H ATOM 74544 HS PGR 1796 135.694 19.599 23.782 1.00 0.00 H ATOM 74545 C2 PGR 1796 135.790 21.375 24.906 1.00 0.00 C ATOM 74546 HX PGR 1796 135.216 21.905 25.671 1.00 0.00 H ATOM 74547 C3 PGR 1796 135.766 22.329 23.641 1.00 0.00 C ATOM 74548 HA PGR 1796 136.529 23.102 23.762 1.00 0.00 H ATOM 74549 HB PGR 1796 134.758 22.698 23.436 1.00 0.00 H ATOM 74550 O31 PGR 1796 136.222 21.507 22.570 1.00 0.00 O ATOM 74551 P31 PGR 1796 136.036 21.987 21.007 1.00 0.00 P ATOM 74552 O32 PGR 1796 134.408 21.956 20.864 1.00 0.00 O ATOM 74553 C31 PGR 1796 133.758 20.770 20.496 1.00 0.00 C ATOM 74554 H1A PGR 1796 134.002 19.972 21.202 1.00 0.00 H ATOM 74555 H1B PGR 1796 134.134 20.432 19.527 1.00 0.00 H ATOM 74556 C32 PGR 1796 132.236 20.908 20.435 1.00 0.00 C ATOM 74557 H2A PGR 1796 131.858 19.986 19.987 1.00 0.00 H ATOM 74558 O35 PGR 1796 131.942 22.034 19.639 1.00 0.00 O ATOM 74559 HO5A PGR 1796 130.992 22.018 19.427 1.00 0.00 H ATOM 74560 C33 PGR 1796 131.767 21.161 21.868 1.00 0.00 C ATOM 74561 H3A PGR 1796 132.208 20.351 22.455 1.00 0.00 H ATOM 74562 H3B PGR 1796 132.134 22.136 22.197 1.00 0.00 H ATOM 74563 O33 PGR 1796 136.533 23.371 20.930 1.00 0.00 O ATOM 74564 O34 PGR 1796 136.553 20.976 20.040 1.00 0.00 O ATOM 74565 O21 PGR 1796 137.133 21.161 25.290 1.00 0.00 O ATOM 74566 C21 PGR 1796 137.327 20.727 26.530 1.00 0.00 C ATOM 74567 O22 PGR 1796 136.452 20.440 27.285 1.00 0.00 O ATOM 74568 O36 PGR 1796 130.349 21.035 22.025 1.00 0.00 O ATOM 74569 HO6A PGR 1796 129.882 21.601 21.383 1.00 0.00 H ATOM 74570 C12 OL 1797 138.771 20.837 26.877 1.00 0.00 C ATOM 74571 H2R OL 1797 139.115 19.979 27.457 1.00 0.00 H ATOM 74572 H2S OL 1797 139.389 20.885 25.978 1.00 0.00 H ATOM 74573 C13 OL 1797 139.017 22.095 27.712 1.00 0.00 C ATOM 74574 H3R OL 1797 140.077 22.351 27.759 1.00 0.00 H ATOM 74575 H3S OL 1797 138.583 22.980 27.242 1.00 0.00 H ATOM 74576 C14 OL 1797 138.473 22.072 29.184 1.00 0.00 C ATOM 74577 H4R OL 1797 138.946 22.876 29.752 1.00 0.00 H ATOM 74578 H4S OL 1797 137.426 22.378 29.218 1.00 0.00 H ATOM 74579 C15 OL 1797 138.852 20.836 30.051 1.00 0.00 C ATOM 74580 H5R OL 1797 138.525 19.870 29.662 1.00 0.00 H ATOM 74581 H5S OL 1797 139.918 20.816 30.291 1.00 0.00 H ATOM 74582 C16 OL 1797 138.189 21.085 31.371 1.00 0.00 C ATOM 74583 H6R OL 1797 138.721 21.837 31.957 1.00 0.00 H ATOM 74584 H6S OL 1797 137.178 21.473 31.232 1.00 0.00 H ATOM 74585 C17 OL 1797 137.964 19.802 32.146 1.00 0.00 C ATOM 74586 H7R OL 1797 137.368 20.080 33.017 1.00 0.00 H ATOM 74587 H7S OL 1797 137.326 19.119 31.582 1.00 0.00 H ATOM 74588 C18 OL 1797 139.120 18.949 32.638 1.00 0.00 C ATOM 74589 H8R OL 1797 139.556 18.490 31.748 1.00 0.00 H ATOM 74590 H8S OL 1797 139.814 19.704 33.015 1.00 0.00 H ATOM 74591 C19 OL 1797 138.795 17.875 33.650 1.00 0.00 C ATOM 74592 H9R OL 1797 138.040 17.248 33.183 1.00 0.00 H ATOM 74593 C110 OL 1797 139.343 17.576 34.861 1.00 0.00 C ATOM 74594 H10R OL 1797 139.125 16.621 35.334 1.00 0.00 H ATOM 74595 C111 OL 1797 140.324 18.399 35.530 1.00 0.00 C ATOM 74596 H11R OL 1797 141.262 17.843 35.597 1.00 0.00 H ATOM 74597 H11S OL 1797 140.563 19.329 35.010 1.00 0.00 H ATOM 74598 C112 OL 1797 139.717 18.798 36.891 1.00 0.00 C ATOM 74599 H12R OL 1797 138.735 19.262 36.779 1.00 0.00 H ATOM 74600 H12S OL 1797 139.511 17.829 37.350 1.00 0.00 H ATOM 74601 C113 OL 1797 140.723 19.618 37.705 1.00 0.00 C ATOM 74602 H13R OL 1797 141.549 19.023 38.098 1.00 0.00 H ATOM 74603 H13S OL 1797 141.175 20.501 37.248 1.00 0.00 H ATOM 74604 C114 OL 1797 140.195 20.214 39.003 1.00 0.00 C ATOM 74605 H14R OL 1797 139.401 20.862 38.625 1.00 0.00 H ATOM 74606 H14S OL 1797 139.731 19.481 39.666 1.00 0.00 H ATOM 74607 C115 OL 1797 141.130 21.103 39.736 1.00 0.00 C ATOM 74608 H15R OL 1797 141.897 20.490 40.214 1.00 0.00 H ATOM 74609 H15S OL 1797 141.596 21.768 39.006 1.00 0.00 H ATOM 74610 C116 OL 1797 140.638 21.847 40.917 1.00 0.00 C ATOM 74611 H16R OL 1797 139.888 22.582 40.619 1.00 0.00 H ATOM 74612 H16S OL 1797 140.100 21.196 41.610 1.00 0.00 H ATOM 74613 C117 OL 1797 141.703 22.571 41.760 1.00 0.00 C ATOM 74614 H17R OL 1797 141.673 22.165 42.774 1.00 0.00 H ATOM 74615 H17S OL 1797 142.723 22.464 41.385 1.00 0.00 H ATOM 74616 C118 OL 1797 141.353 24.043 41.905 1.00 0.00 C ATOM 74617 H18R OL 1797 141.896 24.571 42.692 1.00 0.00 H ATOM 74618 H18S OL 1797 140.307 24.239 42.151 1.00 0.00 H ATOM 74619 H18T OL 1797 141.676 24.639 41.049 1.00 0.00 H TER 74620 OL 1797 ATOM 74620 C116 PA 1798 130.030 66.650 38.621 1.00 0.00 C ATOM 74621 H16R PA 1798 129.960 66.918 37.565 1.00 0.00 H ATOM 74622 H16S PA 1798 129.140 66.086 38.907 1.00 0.00 H ATOM 74623 H16T PA 1798 130.837 65.917 38.680 1.00 0.00 H ATOM 74624 C115 PA 1798 130.280 67.896 39.466 1.00 0.00 C ATOM 74625 H15R PA 1798 129.389 68.523 39.385 1.00 0.00 H ATOM 74626 H15S PA 1798 131.042 68.512 38.985 1.00 0.00 H ATOM 74627 C114 PA 1798 130.720 67.449 40.952 1.00 0.00 C ATOM 74628 H14R PA 1798 129.994 66.699 41.273 1.00 0.00 H ATOM 74629 H14S PA 1798 130.636 68.392 41.495 1.00 0.00 H ATOM 74630 C113 PA 1798 132.155 66.883 41.022 1.00 0.00 C ATOM 74631 H13R PA 1798 132.202 65.880 40.592 1.00 0.00 H ATOM 74632 H13S PA 1798 132.363 66.754 42.086 1.00 0.00 H ATOM 74633 C112 PA 1798 133.382 67.626 40.533 1.00 0.00 C ATOM 74634 H12R PA 1798 133.525 68.552 41.095 1.00 0.00 H ATOM 74635 H12S PA 1798 133.162 67.965 39.518 1.00 0.00 H ATOM 74636 C111 PA 1798 134.634 66.829 40.526 1.00 0.00 C ATOM 74637 H11R PA 1798 134.433 65.774 40.331 1.00 0.00 H ATOM 74638 H11S PA 1798 135.114 66.814 41.507 1.00 0.00 H ATOM 74639 C110 PA 1798 135.706 67.287 39.452 1.00 0.00 C ATOM 74640 H10R PA 1798 135.439 66.887 38.471 1.00 0.00 H ATOM 74641 H10S PA 1798 136.645 66.800 39.722 1.00 0.00 H ATOM 74642 C19 PA 1798 135.931 68.765 39.200 1.00 0.00 C ATOM 74643 H9R PA 1798 136.501 69.207 40.020 1.00 0.00 H ATOM 74644 H9S PA 1798 134.973 69.287 39.244 1.00 0.00 H ATOM 74645 C18 PA 1798 136.830 69.115 38.011 1.00 0.00 C ATOM 74646 H8R PA 1798 136.311 68.728 37.132 1.00 0.00 H ATOM 74647 H8S PA 1798 137.839 68.702 37.955 1.00 0.00 H ATOM 74648 C17 PA 1798 136.894 70.634 37.553 1.00 0.00 C ATOM 74649 H7R PA 1798 137.625 71.114 38.207 1.00 0.00 H ATOM 74650 H7S PA 1798 135.971 71.129 37.860 1.00 0.00 H ATOM 74651 C16 PA 1798 137.190 70.870 36.059 1.00 0.00 C ATOM 74652 H6R PA 1798 137.944 70.125 35.795 1.00 0.00 H ATOM 74653 H6S PA 1798 137.625 71.861 35.916 1.00 0.00 H ATOM 74654 C15 PA 1798 136.089 70.716 35.092 1.00 0.00 C ATOM 74655 H5R PA 1798 135.393 71.530 35.306 1.00 0.00 H ATOM 74656 H5S PA 1798 135.549 69.786 35.281 1.00 0.00 H ATOM 74657 C14 PA 1798 136.438 71.030 33.621 1.00 0.00 C ATOM 74658 H4R PA 1798 135.558 70.967 32.978 1.00 0.00 H ATOM 74659 H4S PA 1798 137.104 70.240 33.268 1.00 0.00 H ATOM 74660 C13 PA 1798 137.086 72.312 33.281 1.00 0.00 C ATOM 74661 H3R PA 1798 137.991 72.543 33.846 1.00 0.00 H ATOM 74662 H3S PA 1798 136.413 73.108 33.608 1.00 0.00 H ATOM 74663 C12 PA 1798 137.288 72.433 31.732 1.00 0.00 C ATOM 74664 H2R PA 1798 136.293 72.433 31.281 1.00 0.00 H ATOM 74665 H2S PA 1798 137.984 71.637 31.459 1.00 0.00 H ATOM 74666 C11 PC 1799 137.906 73.796 31.356 1.00 0.00 C ATOM 74667 O12 PC 1799 138.968 73.994 30.779 1.00 0.00 O ATOM 74668 O11 PC 1799 137.041 74.766 31.573 1.00 0.00 O ATOM 74669 C1 PC 1799 137.323 76.024 30.902 1.00 0.00 C ATOM 74670 HR PC 1799 137.618 75.870 29.861 1.00 0.00 H ATOM 74671 HS PC 1799 138.194 76.513 31.345 1.00 0.00 H ATOM 74672 C2 PC 1799 136.095 76.927 31.009 1.00 0.00 C ATOM 74673 HX PC 1799 135.257 76.230 30.930 1.00 0.00 H ATOM 74674 C3 PC 1799 135.922 78.066 29.964 1.00 0.00 C ATOM 74675 HA PC 1799 135.171 78.818 30.222 1.00 0.00 H ATOM 74676 HB PC 1799 135.518 77.617 29.054 1.00 0.00 H ATOM 74677 O31 PC 1799 137.158 78.609 29.685 1.00 0.00 O ATOM 74678 P31 PC 1799 137.346 79.433 28.293 1.00 0.00 P ATOM 74679 O32 PC 1799 138.537 78.775 27.473 1.00 0.00 O ATOM 74680 C31 PC 1799 138.572 77.432 27.289 1.00 0.00 C ATOM 74681 H1A PC 1799 137.557 77.101 27.053 1.00 0.00 H ATOM 74682 H1B PC 1799 138.974 76.847 28.121 1.00 0.00 H ATOM 74683 C32 PC 1799 139.585 77.156 26.164 1.00 0.00 C ATOM 74684 H2A PC 1799 139.750 76.078 26.195 1.00 0.00 H ATOM 74685 H2B PC 1799 140.521 77.707 26.272 1.00 0.00 H ATOM 74686 N31 PC 1799 139.094 77.448 24.761 1.00 0.00 N ATOM 74687 C33 PC 1799 137.738 76.857 24.523 1.00 0.00 C ATOM 74688 H3A PC 1799 137.463 77.049 23.485 1.00 0.00 H ATOM 74689 H3B PC 1799 136.987 77.334 25.154 1.00 0.00 H ATOM 74690 H3C PC 1799 137.784 75.768 24.575 1.00 0.00 H ATOM 74691 C34 PC 1799 138.976 78.920 24.482 1.00 0.00 C ATOM 74692 H4A PC 1799 139.940 79.415 24.351 1.00 0.00 H ATOM 74693 H4B PC 1799 138.418 79.369 25.306 1.00 0.00 H ATOM 74694 H4C PC 1799 138.412 79.133 23.573 1.00 0.00 H ATOM 74695 C35 PC 1799 140.069 76.916 23.763 1.00 0.00 C ATOM 74696 H5A PC 1799 139.750 77.139 22.744 1.00 0.00 H ATOM 74697 H5B PC 1799 140.177 75.840 23.905 1.00 0.00 H ATOM 74698 H5C PC 1799 141.023 77.433 23.879 1.00 0.00 H ATOM 74699 O33 PC 1799 136.160 79.213 27.395 1.00 0.00 O ATOM 74700 O34 PC 1799 137.798 80.812 28.666 1.00 0.00 O ATOM 74701 O21 PC 1799 136.197 77.624 32.351 1.00 0.00 O ATOM 74702 C21 PC 1799 135.146 78.247 32.956 1.00 0.00 C ATOM 74703 O22 PC 1799 133.969 78.045 32.549 1.00 0.00 O ATOM 74704 C12 OL 1800 135.534 79.068 34.169 1.00 0.00 C ATOM 74705 H2R OL 1800 136.586 79.359 34.171 1.00 0.00 H ATOM 74706 H2S OL 1800 134.951 79.983 34.043 1.00 0.00 H ATOM 74707 C13 OL 1800 135.145 78.238 35.397 1.00 0.00 C ATOM 74708 H3R OL 1800 134.126 77.939 35.141 1.00 0.00 H ATOM 74709 H3S OL 1800 135.778 77.351 35.471 1.00 0.00 H ATOM 74710 C14 OL 1800 135.116 78.954 36.766 1.00 0.00 C ATOM 74711 H4R OL 1800 136.122 79.319 36.982 1.00 0.00 H ATOM 74712 H4S OL 1800 134.349 79.730 36.731 1.00 0.00 H ATOM 74713 C15 OL 1800 134.702 78.166 38.064 1.00 0.00 C ATOM 74714 H5R OL 1800 133.720 77.719 37.892 1.00 0.00 H ATOM 74715 H5S OL 1800 135.363 77.309 38.211 1.00 0.00 H ATOM 74716 C16 OL 1800 134.642 78.989 39.397 1.00 0.00 C ATOM 74717 H6R OL 1800 135.618 79.429 39.614 1.00 0.00 H ATOM 74718 H6S OL 1800 133.986 79.860 39.352 1.00 0.00 H ATOM 74719 C17 OL 1800 134.029 78.107 40.535 1.00 0.00 C ATOM 74720 H7R OL 1800 133.089 77.776 40.088 1.00 0.00 H ATOM 74721 H7S OL 1800 134.452 77.113 40.698 1.00 0.00 H ATOM 74722 C18 OL 1800 133.764 78.880 41.814 1.00 0.00 C ATOM 74723 H8R OL 1800 134.687 79.379 42.113 1.00 0.00 H ATOM 74724 H8S OL 1800 132.941 79.591 41.710 1.00 0.00 H ATOM 74725 C19 OL 1800 133.276 77.951 42.862 1.00 0.00 C ATOM 74726 H9R OL 1800 134.073 77.515 43.459 1.00 0.00 H ATOM 74727 C110 OL 1800 132.033 77.524 43.047 1.00 0.00 C ATOM 74728 H10R OL 1800 131.852 76.972 43.966 1.00 0.00 H ATOM 74729 C111 OL 1800 130.753 77.862 42.334 1.00 0.00 C ATOM 74730 H11R OL 1800 130.954 78.729 41.702 1.00 0.00 H ATOM 74731 H11S OL 1800 130.413 76.945 41.849 1.00 0.00 H ATOM 74732 C112 OL 1800 129.686 78.277 43.289 1.00 0.00 C ATOM 74733 H12R OL 1800 130.114 79.031 43.953 1.00 0.00 H ATOM 74734 H12S OL 1800 128.906 78.823 42.754 1.00 0.00 H ATOM 74735 C113 OL 1800 129.101 77.090 44.083 1.00 0.00 C ATOM 74736 H13R OL 1800 129.706 76.260 43.714 1.00 0.00 H ATOM 74737 H13S OL 1800 129.408 77.143 45.129 1.00 0.00 H ATOM 74738 C114 OL 1800 127.639 76.907 43.771 1.00 0.00 C ATOM 74739 H14R OL 1800 127.197 77.795 44.228 1.00 0.00 H ATOM 74740 H14S OL 1800 127.623 76.828 42.682 1.00 0.00 H ATOM 74741 C115 OL 1800 127.088 75.573 44.217 1.00 0.00 C ATOM 74742 H15R OL 1800 127.511 74.769 43.611 1.00 0.00 H ATOM 74743 H15S OL 1800 127.419 75.352 45.234 1.00 0.00 H ATOM 74744 C116 OL 1800 125.608 75.479 43.995 1.00 0.00 C ATOM 74745 H16R OL 1800 125.151 76.247 44.623 1.00 0.00 H ATOM 74746 H16S OL 1800 125.291 75.643 42.963 1.00 0.00 H ATOM 74747 C117 OL 1800 125.024 74.095 44.521 1.00 0.00 C ATOM 74748 H17R OL 1800 124.025 74.023 44.087 1.00 0.00 H ATOM 74749 H17S OL 1800 125.555 73.226 44.125 1.00 0.00 H ATOM 74750 C118 OL 1800 125.005 74.047 46.017 1.00 0.00 C ATOM 74751 H18R OL 1800 124.545 73.158 46.455 1.00 0.00 H ATOM 74752 H18S OL 1800 124.364 74.836 46.418 1.00 0.00 H ATOM 74753 H18T OL 1800 126.015 74.152 46.417 1.00 0.00 H TER 74754 OL 1800 ATOM 74754 C116 PA 1801 55.490 117.819 39.031 1.00 0.00 C ATOM 74755 H16R PA 1801 55.583 116.891 39.599 1.00 0.00 H ATOM 74756 H16S PA 1801 54.461 118.144 39.199 1.00 0.00 H ATOM 74757 H16T PA 1801 56.217 118.435 39.565 1.00 0.00 H ATOM 74758 C115 PA 1801 55.832 117.754 37.568 1.00 0.00 C ATOM 74759 H15R PA 1801 55.501 118.660 37.056 1.00 0.00 H ATOM 74760 H15S PA 1801 55.335 116.870 37.163 1.00 0.00 H ATOM 74761 C114 PA 1801 57.275 117.310 37.272 1.00 0.00 C ATOM 74762 H14R PA 1801 57.604 116.496 37.922 1.00 0.00 H ATOM 74763 H14S PA 1801 57.957 118.107 37.574 1.00 0.00 H ATOM 74764 C113 PA 1801 57.558 117.021 35.777 1.00 0.00 C ATOM 74765 H13R PA 1801 57.123 116.122 35.336 1.00 0.00 H ATOM 74766 H13S PA 1801 58.604 116.708 35.804 1.00 0.00 H ATOM 74767 C112 PA 1801 57.208 118.214 34.881 1.00 0.00 C ATOM 74768 H12R PA 1801 57.448 119.120 35.440 1.00 0.00 H ATOM 74769 H12S PA 1801 56.134 118.248 34.684 1.00 0.00 H ATOM 74770 C111 PA 1801 57.949 118.136 33.549 1.00 0.00 C ATOM 74771 H11R PA 1801 57.403 117.407 32.948 1.00 0.00 H ATOM 74772 H11S PA 1801 58.943 117.686 33.607 1.00 0.00 H ATOM 74773 C110 PA 1801 58.029 119.561 32.885 1.00 0.00 C ATOM 74774 H10R PA 1801 58.703 120.257 33.388 1.00 0.00 H ATOM 74775 H10S PA 1801 56.992 119.902 32.899 1.00 0.00 H ATOM 74776 C19 PA 1801 58.537 119.638 31.437 1.00 0.00 C ATOM 74777 H9R PA 1801 58.028 119.013 30.700 1.00 0.00 H ATOM 74778 H9S PA 1801 59.563 119.263 31.407 1.00 0.00 H ATOM 74779 C18 PA 1801 58.462 121.043 30.754 1.00 0.00 C ATOM 74780 H8R PA 1801 59.270 121.722 31.033 1.00 0.00 H ATOM 74781 H8S PA 1801 57.563 121.535 31.132 1.00 0.00 H ATOM 74782 C17 PA 1801 58.261 121.103 29.278 1.00 0.00 C ATOM 74783 H7R PA 1801 57.261 120.711 29.082 1.00 0.00 H ATOM 74784 H7S PA 1801 58.942 120.525 28.649 1.00 0.00 H ATOM 74785 C16 PA 1801 58.396 122.494 28.829 1.00 0.00 C ATOM 74786 H6R PA 1801 59.454 122.756 28.774 1.00 0.00 H ATOM 74787 H6S PA 1801 57.944 123.106 29.612 1.00 0.00 H ATOM 74788 C15 PA 1801 57.784 122.766 27.457 1.00 0.00 C ATOM 74789 H5R PA 1801 57.754 123.847 27.305 1.00 0.00 H ATOM 74790 H5S PA 1801 56.724 122.509 27.484 1.00 0.00 H ATOM 74791 C14 PA 1801 58.406 122.023 26.253 1.00 0.00 C ATOM 74792 H4R PA 1801 58.290 120.948 26.410 1.00 0.00 H ATOM 74793 H4S PA 1801 59.476 122.190 26.110 1.00 0.00 H ATOM 74794 C13 PA 1801 57.719 122.373 24.896 1.00 0.00 C ATOM 74795 H3R PA 1801 57.932 123.408 24.619 1.00 0.00 H ATOM 74796 H3S PA 1801 56.637 122.403 25.037 1.00 0.00 H ATOM 74797 C12 PA 1801 58.109 121.430 23.775 1.00 0.00 C ATOM 74798 H2R PA 1801 58.027 120.378 24.056 1.00 0.00 H ATOM 74799 H2S PA 1801 59.151 121.451 23.449 1.00 0.00 H ATOM 74800 C11 PGR 1802 57.186 121.663 22.586 1.00 0.00 C ATOM 74801 O12 PGR 1802 56.454 120.841 22.012 1.00 0.00 O ATOM 74802 O11 PGR 1802 57.270 122.955 22.147 1.00 0.00 O ATOM 74803 C1 PGR 1802 56.538 123.370 20.973 1.00 0.00 C ATOM 74804 HR PGR 1802 56.671 122.703 20.117 1.00 0.00 H ATOM 74805 HS PGR 1802 56.977 124.312 20.632 1.00 0.00 H ATOM 74806 C2 PGR 1802 55.020 123.587 21.246 1.00 0.00 C ATOM 74807 HX PGR 1802 54.523 122.613 21.230 1.00 0.00 H ATOM 74808 C3 PGR 1802 54.306 124.265 20.089 1.00 0.00 C ATOM 74809 HA PGR 1802 54.705 125.279 20.013 1.00 0.00 H ATOM 74810 HB PGR 1802 53.250 124.301 20.372 1.00 0.00 H ATOM 74811 O31 PGR 1802 54.499 123.363 18.960 1.00 0.00 O ATOM 74812 P31 PGR 1802 54.350 123.981 17.445 1.00 0.00 P ATOM 74813 O32 PGR 1802 55.481 125.078 17.353 1.00 0.00 O ATOM 74814 C31 PGR 1802 56.939 124.881 17.221 1.00 0.00 C ATOM 74815 H1A PGR 1802 57.083 123.941 16.682 1.00 0.00 H ATOM 74816 H1B PGR 1802 57.468 124.710 18.162 1.00 0.00 H ATOM 74817 C32 PGR 1802 57.486 126.063 16.343 1.00 0.00 C ATOM 74818 H2A PGR 1802 57.207 127.000 16.830 1.00 0.00 H ATOM 74819 O35 PGR 1802 56.884 126.121 15.027 1.00 0.00 O ATOM 74820 HO5A PGR 1802 55.923 126.139 15.188 1.00 0.00 H ATOM 74821 C33 PGR 1802 58.993 126.014 16.212 1.00 0.00 C ATOM 74822 H3A PGR 1802 59.351 126.857 15.616 1.00 0.00 H ATOM 74823 H3B PGR 1802 59.519 125.984 17.169 1.00 0.00 H ATOM 74824 O33 PGR 1802 54.691 122.872 16.510 1.00 0.00 O ATOM 74825 O34 PGR 1802 53.107 124.749 17.254 1.00 0.00 O ATOM 74826 O21 PGR 1802 54.779 124.142 22.563 1.00 0.00 O ATOM 74827 C21 PGR 1802 55.156 125.377 22.848 1.00 0.00 C ATOM 74828 O22 PGR 1802 55.574 126.139 22.012 1.00 0.00 O ATOM 74829 O36 PGR 1802 59.285 124.803 15.463 1.00 0.00 O ATOM 74830 HO6A PGR 1802 60.248 124.802 15.318 1.00 0.00 H ATOM 74831 C12 OL 1803 55.170 125.626 24.319 1.00 0.00 C ATOM 74832 H2R OL 1803 56.137 125.751 24.811 1.00 0.00 H ATOM 74833 H2S OL 1803 54.765 126.615 24.544 1.00 0.00 H ATOM 74834 C13 OL 1803 54.357 124.690 25.214 1.00 0.00 C ATOM 74835 H3R OL 1803 53.341 124.774 24.822 1.00 0.00 H ATOM 74836 H3S OL 1803 54.666 123.667 24.988 1.00 0.00 H ATOM 74837 C14 OL 1803 54.581 125.001 26.664 1.00 0.00 C ATOM 74838 H4R OL 1803 55.649 124.921 26.875 1.00 0.00 H ATOM 74839 H4S OL 1803 54.276 126.046 26.746 1.00 0.00 H ATOM 74840 C15 OL 1803 53.746 124.072 27.551 1.00 0.00 C ATOM 74841 H5R OL 1803 52.677 124.276 27.459 1.00 0.00 H ATOM 74842 H5S OL 1803 53.891 123.044 27.213 1.00 0.00 H ATOM 74843 C16 OL 1803 54.271 124.148 28.972 1.00 0.00 C ATOM 74844 H6R OL 1803 55.327 123.886 29.066 1.00 0.00 H ATOM 74845 H6S OL 1803 54.237 125.201 29.262 1.00 0.00 H ATOM 74846 C17 OL 1803 53.274 123.260 29.838 1.00 0.00 C ATOM 74847 H7R OL 1803 52.243 123.527 29.596 1.00 0.00 H ATOM 74848 H7S OL 1803 53.287 122.215 29.521 1.00 0.00 H ATOM 74849 C18 OL 1803 53.450 123.298 31.410 1.00 0.00 C ATOM 74850 H8R OL 1803 53.532 124.259 31.921 1.00 0.00 H ATOM 74851 H8S OL 1803 52.588 122.804 31.865 1.00 0.00 H ATOM 74852 C19 OL 1803 54.664 122.516 31.733 1.00 0.00 C ATOM 74853 H9R OL 1803 55.630 122.973 31.535 1.00 0.00 H ATOM 74854 C110 OL 1803 54.610 121.461 32.534 1.00 0.00 C ATOM 74855 H10R OL 1803 55.539 121.050 32.921 1.00 0.00 H ATOM 74856 C111 OL 1803 53.509 120.649 33.069 1.00 0.00 C ATOM 74857 H11R OL 1803 52.554 120.714 32.543 1.00 0.00 H ATOM 74858 H11S OL 1803 53.720 119.582 33.169 1.00 0.00 H ATOM 74859 C112 OL 1803 53.367 121.024 34.476 1.00 0.00 C ATOM 74860 H12R OL 1803 54.288 120.904 35.050 1.00 0.00 H ATOM 74861 H12S OL 1803 53.163 122.097 34.476 1.00 0.00 H ATOM 74862 C113 OL 1803 52.244 120.368 35.326 1.00 0.00 C ATOM 74863 H13R OL 1803 52.505 120.675 36.341 1.00 0.00 H ATOM 74864 H13S OL 1803 51.300 120.905 35.214 1.00 0.00 H ATOM 74865 C114 OL 1803 52.160 118.828 35.257 1.00 0.00 C ATOM 74866 H14R OL 1803 51.732 118.479 34.315 1.00 0.00 H ATOM 74867 H14S OL 1803 53.201 118.516 35.151 1.00 0.00 H ATOM 74868 C115 OL 1803 51.569 118.188 36.511 1.00 0.00 C ATOM 74869 H15R OL 1803 52.361 117.560 36.924 1.00 0.00 H ATOM 74870 H15S OL 1803 51.322 118.829 37.360 1.00 0.00 H ATOM 74871 C116 OL 1803 50.257 117.283 36.190 1.00 0.00 C ATOM 74872 H16R OL 1803 50.454 116.780 35.242 1.00 0.00 H ATOM 74873 H16S OL 1803 50.033 116.452 36.863 1.00 0.00 H ATOM 74874 C117 OL 1803 49.000 118.245 36.244 1.00 0.00 C ATOM 74875 H17R OL 1803 48.627 118.581 37.214 1.00 0.00 H ATOM 74876 H17S OL 1803 49.347 119.142 35.728 1.00 0.00 H ATOM 74877 C118 OL 1803 47.749 117.805 35.518 1.00 0.00 C ATOM 74878 H18R OL 1803 46.956 118.449 35.904 1.00 0.00 H ATOM 74879 H18S OL 1803 47.564 116.746 35.709 1.00 0.00 H ATOM 74880 H18T OL 1803 47.974 117.972 34.463 1.00 0.00 H TER 74881 OL 1803 ATOM 74881 C116 PA 1804 133.583 130.108 42.142 1.00 0.00 C ATOM 74882 H16R PA 1804 133.038 129.609 41.339 1.00 0.00 H ATOM 74883 H16S PA 1804 133.311 131.166 42.161 1.00 0.00 H ATOM 74884 H16T PA 1804 133.122 129.814 43.087 1.00 0.00 H ATOM 74885 C115 PA 1804 135.093 129.681 42.174 1.00 0.00 C ATOM 74886 H15R PA 1804 135.183 128.774 42.775 1.00 0.00 H ATOM 74887 H15S PA 1804 135.502 130.389 42.897 1.00 0.00 H ATOM 74888 C114 PA 1804 135.911 129.632 40.857 1.00 0.00 C ATOM 74889 H14R PA 1804 136.904 129.804 41.277 1.00 0.00 H ATOM 74890 H14S PA 1804 135.575 130.446 40.210 1.00 0.00 H ATOM 74891 C113 PA 1804 135.825 128.249 40.223 1.00 0.00 C ATOM 74892 H13R PA 1804 134.774 128.026 40.028 1.00 0.00 H ATOM 74893 H13S PA 1804 136.303 127.507 40.866 1.00 0.00 H ATOM 74894 C112 PA 1804 136.688 128.194 39.062 1.00 0.00 C ATOM 74895 H12R PA 1804 137.740 128.051 39.321 1.00 0.00 H ATOM 74896 H12S PA 1804 136.839 129.116 38.496 1.00 0.00 H ATOM 74897 C111 PA 1804 136.418 127.005 38.064 1.00 0.00 C ATOM 74898 H11R PA 1804 135.503 127.219 37.507 1.00 0.00 H ATOM 74899 H11S PA 1804 136.170 126.079 38.586 1.00 0.00 H ATOM 74900 C110 PA 1804 137.751 126.752 37.276 1.00 0.00 C ATOM 74901 H10R PA 1804 138.515 126.496 38.012 1.00 0.00 H ATOM 74902 H10S PA 1804 138.048 127.688 36.799 1.00 0.00 H ATOM 74903 C19 PA 1804 137.707 125.622 36.259 1.00 0.00 C ATOM 74904 H9R PA 1804 136.776 125.674 35.689 1.00 0.00 H ATOM 74905 H9S PA 1804 137.678 124.621 36.694 1.00 0.00 H ATOM 74906 C18 PA 1804 138.894 125.552 35.272 1.00 0.00 C ATOM 74907 H8R PA 1804 139.770 125.555 35.925 1.00 0.00 H ATOM 74908 H8S PA 1804 138.667 126.405 34.628 1.00 0.00 H ATOM 74909 C17 PA 1804 138.978 124.210 34.454 1.00 0.00 C ATOM 74910 H7R PA 1804 137.959 124.038 34.101 1.00 0.00 H ATOM 74911 H7S PA 1804 139.100 123.415 35.193 1.00 0.00 H ATOM 74912 C16 PA 1804 140.026 124.152 33.388 1.00 0.00 C ATOM 74913 H6R PA 1804 140.134 123.119 33.052 1.00 0.00 H ATOM 74914 H6S PA 1804 141.031 124.420 33.720 1.00 0.00 H ATOM 74915 C15 PA 1804 139.671 125.125 32.283 1.00 0.00 C ATOM 74916 H5R PA 1804 139.783 126.177 32.556 1.00 0.00 H ATOM 74917 H5S PA 1804 138.594 125.026 32.130 1.00 0.00 H ATOM 74918 C14 PA 1804 140.366 124.790 30.991 1.00 0.00 C ATOM 74919 H4R PA 1804 140.192 123.735 30.766 1.00 0.00 H ATOM 74920 H4S PA 1804 141.454 124.826 31.068 1.00 0.00 H ATOM 74921 C13 PA 1804 140.055 125.649 29.765 1.00 0.00 C ATOM 74922 H3R PA 1804 139.695 126.614 30.127 1.00 0.00 H ATOM 74923 H3S PA 1804 139.056 125.447 29.372 1.00 0.00 H ATOM 74924 C12 PA 1804 141.163 125.594 28.765 1.00 0.00 C ATOM 74925 H2R PA 1804 141.347 124.546 28.519 1.00 0.00 H ATOM 74926 H2S PA 1804 142.129 125.949 29.130 1.00 0.00 H ATOM 74927 C11 PGR 1805 140.855 126.363 27.552 1.00 0.00 C ATOM 74928 O12 PGR 1805 139.863 126.082 26.924 1.00 0.00 O ATOM 74929 O11 PGR 1805 141.832 127.269 27.299 1.00 0.00 O ATOM 74930 C1 PGR 1805 141.834 128.093 26.071 1.00 0.00 C ATOM 74931 HR PGR 1805 142.005 127.425 25.222 1.00 0.00 H ATOM 74932 HS PGR 1805 142.640 128.826 26.156 1.00 0.00 H ATOM 74933 C2 PGR 1805 140.522 128.860 25.888 1.00 0.00 C ATOM 74934 HX PGR 1805 139.646 128.212 25.977 1.00 0.00 H ATOM 74935 C3 PGR 1805 140.595 129.378 24.416 1.00 0.00 C ATOM 74936 HA PGR 1805 139.729 130.017 24.229 1.00 0.00 H ATOM 74937 HB PGR 1805 140.580 128.556 23.695 1.00 0.00 H ATOM 74938 O31 PGR 1805 141.726 130.231 24.269 1.00 0.00 O ATOM 74939 P31 PGR 1805 142.035 130.924 22.866 1.00 0.00 P ATOM 74940 O32 PGR 1805 141.097 132.201 22.851 1.00 0.00 O ATOM 74941 C31 PGR 1805 141.647 133.500 23.143 1.00 0.00 C ATOM 74942 H1A PGR 1805 142.268 133.918 22.346 1.00 0.00 H ATOM 74943 H1B PGR 1805 142.275 133.439 24.035 1.00 0.00 H ATOM 74944 C32 PGR 1805 140.560 134.497 23.668 1.00 0.00 C ATOM 74945 H2A PGR 1805 141.023 135.380 24.115 1.00 0.00 H ATOM 74946 O35 PGR 1805 140.007 133.933 24.877 1.00 0.00 O ATOM 74947 HO5A PGR 1805 140.725 133.588 25.437 1.00 0.00 H ATOM 74948 C33 PGR 1805 139.549 134.979 22.613 1.00 0.00 C ATOM 74949 H3A PGR 1805 140.049 135.595 21.861 1.00 0.00 H ATOM 74950 H3B PGR 1805 139.066 134.079 22.223 1.00 0.00 H ATOM 74951 O33 PGR 1805 143.410 131.413 22.851 1.00 0.00 O ATOM 74952 O34 PGR 1805 141.610 130.105 21.767 1.00 0.00 O ATOM 74953 O21 PGR 1805 140.413 129.980 26.828 1.00 0.00 O ATOM 74954 C21 PGR 1805 139.239 130.683 26.850 1.00 0.00 C ATOM 74955 O22 PGR 1805 138.292 130.437 26.058 1.00 0.00 O ATOM 74956 O36 PGR 1805 138.565 135.747 23.150 1.00 0.00 O ATOM 74957 HO6A PGR 1805 138.962 136.509 23.608 1.00 0.00 H ATOM 74958 C12 OL 1806 139.187 131.813 27.870 1.00 0.00 C ATOM 74959 H2R OL 1806 139.687 132.672 27.418 1.00 0.00 H ATOM 74960 H2S OL 1806 138.175 132.204 27.998 1.00 0.00 H ATOM 74961 C13 OL 1806 139.615 131.491 29.289 1.00 0.00 C ATOM 74962 H3R OL 1806 139.466 130.420 29.436 1.00 0.00 H ATOM 74963 H3S OL 1806 140.694 131.651 29.246 1.00 0.00 H ATOM 74964 C14 OL 1806 138.917 132.343 30.338 1.00 0.00 C ATOM 74965 H4R OL 1806 139.031 133.381 30.020 1.00 0.00 H ATOM 74966 H4S OL 1806 137.857 132.099 30.245 1.00 0.00 H ATOM 74967 C15 OL 1806 139.511 132.247 31.792 1.00 0.00 C ATOM 74968 H5R OL 1806 140.540 132.584 31.939 1.00 0.00 H ATOM 74969 H5S OL 1806 138.876 132.844 32.451 1.00 0.00 H ATOM 74970 C16 OL 1806 139.534 130.802 32.349 1.00 0.00 C ATOM 74971 H6R OL 1806 138.802 130.120 31.913 1.00 0.00 H ATOM 74972 H6S OL 1806 140.521 130.429 32.067 1.00 0.00 H ATOM 74973 C17 OL 1806 139.580 130.879 33.937 1.00 0.00 C ATOM 74974 H7R OL 1806 140.200 131.694 34.315 1.00 0.00 H ATOM 74975 H7S OL 1806 138.622 131.062 34.430 1.00 0.00 H ATOM 74976 C18 OL 1806 139.831 129.464 34.495 1.00 0.00 C ATOM 74977 H8R OL 1806 138.915 128.904 34.293 1.00 0.00 H ATOM 74978 H8S OL 1806 140.658 128.907 34.050 1.00 0.00 H ATOM 74979 C19 OL 1806 140.194 129.625 35.920 1.00 0.00 C ATOM 74980 H9R OL 1806 139.719 130.431 36.473 1.00 0.00 H ATOM 74981 C110 OL 1806 141.216 128.976 36.455 1.00 0.00 C ATOM 74982 H10R OL 1806 141.362 129.183 37.512 1.00 0.00 H ATOM 74983 C111 OL 1806 142.102 127.775 36.064 1.00 0.00 C ATOM 74984 H11R OL 1806 141.638 127.291 35.203 1.00 0.00 H ATOM 74985 H11S OL 1806 143.145 128.013 35.844 1.00 0.00 H ATOM 74986 C112 OL 1806 142.162 126.771 37.244 1.00 0.00 C ATOM 74987 H12R OL 1806 142.590 127.199 38.152 1.00 0.00 H ATOM 74988 H12S OL 1806 141.139 126.468 37.477 1.00 0.00 H ATOM 74989 C113 OL 1806 142.998 125.550 36.853 1.00 0.00 C ATOM 74990 H13R OL 1806 142.721 125.201 35.856 1.00 0.00 H ATOM 74991 H13S OL 1806 144.046 125.844 36.759 1.00 0.00 H ATOM 74992 C114 OL 1806 142.917 124.450 37.949 1.00 0.00 C ATOM 74993 H14R OL 1806 143.736 123.729 37.918 1.00 0.00 H ATOM 74994 H14S OL 1806 142.916 124.905 38.942 1.00 0.00 H ATOM 74995 C115 OL 1806 141.663 123.643 37.872 1.00 0.00 C ATOM 74996 H15R OL 1806 140.842 124.336 38.069 1.00 0.00 H ATOM 74997 H15S OL 1806 141.508 123.303 36.846 1.00 0.00 H ATOM 74998 C116 OL 1806 141.533 122.474 38.816 1.00 0.00 C ATOM 74999 H16R OL 1806 142.188 121.624 38.612 1.00 0.00 H ATOM 75000 H16S OL 1806 141.832 122.769 39.823 1.00 0.00 H ATOM 75001 C117 OL 1806 140.124 121.909 38.887 1.00 0.00 C ATOM 75002 H17R OL 1806 139.453 122.753 39.058 1.00 0.00 H ATOM 75003 H17S OL 1806 139.938 121.442 37.918 1.00 0.00 H ATOM 75004 C118 OL 1806 140.005 120.897 40.020 1.00 0.00 C ATOM 75005 H18R OL 1806 140.740 120.090 39.976 1.00 0.00 H ATOM 75006 H18S OL 1806 139.108 120.290 39.882 1.00 0.00 H ATOM 75007 H18T OL 1806 139.962 121.276 41.043 1.00 0.00 H TER 75008 OL 1806 ATOM 75008 C116 PA 1807 133.978 104.511 44.744 1.00 0.00 C ATOM 75009 H16R PA 1807 134.766 103.759 44.822 1.00 0.00 H ATOM 75010 H16S PA 1807 133.158 104.177 45.383 1.00 0.00 H ATOM 75011 H16T PA 1807 134.443 105.405 45.165 1.00 0.00 H ATOM 75012 C115 PA 1807 133.531 104.559 43.297 1.00 0.00 C ATOM 75013 H15R PA 1807 132.733 105.264 43.055 1.00 0.00 H ATOM 75014 H15S PA 1807 133.051 103.599 43.095 1.00 0.00 H ATOM 75015 C114 PA 1807 134.587 104.954 42.181 1.00 0.00 C ATOM 75016 H14R PA 1807 134.011 104.899 41.255 1.00 0.00 H ATOM 75017 H14S PA 1807 135.314 104.156 42.015 1.00 0.00 H ATOM 75018 C113 PA 1807 135.275 106.223 42.422 1.00 0.00 C ATOM 75019 H13R PA 1807 135.926 106.138 43.295 1.00 0.00 H ATOM 75020 H13S PA 1807 134.544 106.955 42.772 1.00 0.00 H ATOM 75021 C112 PA 1807 135.881 106.696 41.053 1.00 0.00 C ATOM 75022 H12R PA 1807 135.174 106.800 40.228 1.00 0.00 H ATOM 75023 H12S PA 1807 136.647 105.935 40.890 1.00 0.00 H ATOM 75024 C111 PA 1807 136.729 107.893 41.065 1.00 0.00 C ATOM 75025 H11R PA 1807 137.660 107.787 41.626 1.00 0.00 H ATOM 75026 H11S PA 1807 136.160 108.716 41.502 1.00 0.00 H ATOM 75027 C110 PA 1807 137.073 108.319 39.652 1.00 0.00 C ATOM 75028 H10R PA 1807 136.083 108.586 39.277 1.00 0.00 H ATOM 75029 H10S PA 1807 137.496 107.548 39.004 1.00 0.00 H ATOM 75030 C19 PA 1807 137.793 109.663 39.630 1.00 0.00 C ATOM 75031 H9R PA 1807 138.738 109.640 40.177 1.00 0.00 H ATOM 75032 H9S PA 1807 137.167 110.349 40.205 1.00 0.00 H ATOM 75033 C18 PA 1807 138.139 110.207 38.233 1.00 0.00 C ATOM 75034 H8R PA 1807 137.284 110.640 37.709 1.00 0.00 H ATOM 75035 H8S PA 1807 138.439 109.425 37.533 1.00 0.00 H ATOM 75036 C17 PA 1807 139.267 111.279 38.184 1.00 0.00 C ATOM 75037 H7R PA 1807 140.197 110.827 38.536 1.00 0.00 H ATOM 75038 H7S PA 1807 138.977 112.054 38.897 1.00 0.00 H ATOM 75039 C16 PA 1807 139.527 111.881 36.654 1.00 0.00 C ATOM 75040 H6R PA 1807 140.404 112.532 36.649 1.00 0.00 H ATOM 75041 H6S PA 1807 138.670 112.518 36.423 1.00 0.00 H ATOM 75042 C15 PA 1807 139.674 110.884 35.554 1.00 0.00 C ATOM 75043 H5R PA 1807 138.736 110.327 35.510 1.00 0.00 H ATOM 75044 H5S PA 1807 140.407 110.166 35.927 1.00 0.00 H ATOM 75045 C14 PA 1807 140.046 111.331 34.159 1.00 0.00 C ATOM 75046 H4R PA 1807 140.859 112.042 34.318 1.00 0.00 H ATOM 75047 H4S PA 1807 139.142 111.802 33.768 1.00 0.00 H ATOM 75048 C13 PA 1807 140.463 110.277 33.089 1.00 0.00 C ATOM 75049 H3R PA 1807 139.696 109.541 32.838 1.00 0.00 H ATOM 75050 H3S PA 1807 141.309 109.681 33.437 1.00 0.00 H ATOM 75051 C12 PA 1807 140.802 111.022 31.837 1.00 0.00 C ATOM 75052 H2R PA 1807 141.659 111.698 31.853 1.00 0.00 H ATOM 75053 H2S PA 1807 139.928 111.601 31.529 1.00 0.00 H ATOM 75054 C11 PGR 1808 141.131 110.052 30.745 1.00 0.00 C ATOM 75055 O12 PGR 1808 140.392 109.280 30.274 1.00 0.00 O ATOM 75056 O11 PGR 1808 142.442 110.231 30.359 1.00 0.00 O ATOM 75057 C1 PGR 1808 142.925 109.510 29.183 1.00 0.00 C ATOM 75058 HR PGR 1808 142.142 109.622 28.428 1.00 0.00 H ATOM 75059 HS PGR 1808 143.133 108.489 29.512 1.00 0.00 H ATOM 75060 C2 PGR 1808 144.254 110.153 28.747 1.00 0.00 C ATOM 75061 HX PGR 1808 144.480 110.965 29.442 1.00 0.00 H ATOM 75062 C3 PGR 1808 144.045 110.707 27.342 1.00 0.00 C ATOM 75063 HA PGR 1808 144.937 111.212 26.962 1.00 0.00 H ATOM 75064 HB PGR 1808 143.226 111.429 27.403 1.00 0.00 H ATOM 75065 O31 PGR 1808 143.736 109.573 26.476 1.00 0.00 O ATOM 75066 P31 PGR 1808 143.518 109.830 24.931 1.00 0.00 P ATOM 75067 O32 PGR 1808 144.900 110.475 24.499 1.00 0.00 O ATOM 75068 C31 PGR 1808 146.116 109.631 24.514 1.00 0.00 C ATOM 75069 H1A PGR 1808 145.853 108.757 23.913 1.00 0.00 H ATOM 75070 H1B PGR 1808 146.285 109.245 25.523 1.00 0.00 H ATOM 75071 C32 PGR 1808 147.361 110.344 23.943 1.00 0.00 C ATOM 75072 H2A PGR 1808 147.501 111.288 24.475 1.00 0.00 H ATOM 75073 O35 PGR 1808 147.239 110.604 22.579 1.00 0.00 O ATOM 75074 HO5A PGR 1808 148.027 111.143 22.387 1.00 0.00 H ATOM 75075 C33 PGR 1808 148.584 109.480 24.293 1.00 0.00 C ATOM 75076 H3A PGR 1808 149.502 109.999 24.003 1.00 0.00 H ATOM 75077 H3B PGR 1808 148.749 109.458 25.374 1.00 0.00 H ATOM 75078 O33 PGR 1808 143.318 108.527 24.330 1.00 0.00 O ATOM 75079 O34 PGR 1808 142.462 110.863 24.895 1.00 0.00 O ATOM 75080 O21 PGR 1808 145.359 109.200 28.713 1.00 0.00 O ATOM 75081 C21 PGR 1808 146.596 109.673 28.429 1.00 0.00 C ATOM 75082 O22 PGR 1808 146.948 110.817 28.392 1.00 0.00 O ATOM 75083 O36 PGR 1808 148.501 108.097 23.826 1.00 0.00 O ATOM 75084 HO6A PGR 1808 148.825 108.002 22.912 1.00 0.00 H ATOM 75085 C12 OL 1809 147.618 108.530 28.146 1.00 0.00 C ATOM 75086 H2R OL 1809 146.947 107.701 27.908 1.00 0.00 H ATOM 75087 H2S OL 1809 148.347 108.872 27.409 1.00 0.00 H ATOM 75088 C13 OL 1809 148.509 108.244 29.345 1.00 0.00 C ATOM 75089 H3R OL 1809 147.888 107.871 30.162 1.00 0.00 H ATOM 75090 H3S OL 1809 149.307 107.541 29.097 1.00 0.00 H ATOM 75091 C14 OL 1809 149.155 109.521 29.989 1.00 0.00 C ATOM 75092 H4R OL 1809 149.467 110.125 29.134 1.00 0.00 H ATOM 75093 H4S OL 1809 148.419 110.190 30.440 1.00 0.00 H ATOM 75094 C15 OL 1809 150.270 109.065 30.868 1.00 0.00 C ATOM 75095 H5R OL 1809 151.142 108.628 30.376 1.00 0.00 H ATOM 75096 H5S OL 1809 150.763 109.936 31.306 1.00 0.00 H ATOM 75097 C16 OL 1809 149.710 108.509 32.240 1.00 0.00 C ATOM 75098 H6R OL 1809 148.820 109.066 32.538 1.00 0.00 H ATOM 75099 H6S OL 1809 149.424 107.463 32.111 1.00 0.00 H ATOM 75100 C17 OL 1809 150.812 108.432 33.281 1.00 0.00 C ATOM 75101 H7R OL 1809 151.620 107.785 32.934 1.00 0.00 H ATOM 75102 H7S OL 1809 151.297 109.409 33.322 1.00 0.00 H ATOM 75103 C18 OL 1809 150.553 108.043 34.716 1.00 0.00 C ATOM 75104 H8R OL 1809 150.025 108.843 35.238 1.00 0.00 H ATOM 75105 H8S OL 1809 150.014 107.126 34.961 1.00 0.00 H ATOM 75106 C19 OL 1809 151.934 107.950 35.277 1.00 0.00 C ATOM 75107 H9R OL 1809 152.560 108.819 35.088 1.00 0.00 H ATOM 75108 C110 OL 1809 152.413 106.990 36.076 1.00 0.00 C ATOM 75109 H10R OL 1809 153.438 107.138 36.406 1.00 0.00 H ATOM 75110 C111 OL 1809 151.733 105.685 36.489 1.00 0.00 C ATOM 75111 H11R OL 1809 150.665 105.910 36.520 1.00 0.00 H ATOM 75112 H11S OL 1809 152.030 105.097 35.618 1.00 0.00 H ATOM 75113 C112 OL 1809 152.361 104.895 37.576 1.00 0.00 C ATOM 75114 H12R OL 1809 153.340 104.468 37.350 1.00 0.00 H ATOM 75115 H12S OL 1809 152.476 105.440 38.515 1.00 0.00 H ATOM 75116 C113 OL 1809 151.410 103.734 37.857 1.00 0.00 C ATOM 75117 H13R OL 1809 150.396 104.116 37.725 1.00 0.00 H ATOM 75118 H13S OL 1809 151.615 102.975 37.099 1.00 0.00 H ATOM 75119 C114 OL 1809 151.543 103.009 39.183 1.00 0.00 C ATOM 75120 H14R OL 1809 152.592 102.727 39.302 1.00 0.00 H ATOM 75121 H14S OL 1809 151.224 103.694 39.971 1.00 0.00 H ATOM 75122 C115 OL 1809 150.531 101.834 39.336 1.00 0.00 C ATOM 75123 H15R OL 1809 149.780 102.187 38.626 1.00 0.00 H ATOM 75124 H15S OL 1809 150.904 100.971 38.780 1.00 0.00 H ATOM 75125 C116 OL 1809 149.902 101.597 40.682 1.00 0.00 C ATOM 75126 H16R OL 1809 150.481 101.099 41.463 1.00 0.00 H ATOM 75127 H16S OL 1809 149.481 102.485 41.159 1.00 0.00 H ATOM 75128 C117 OL 1809 148.719 100.676 40.498 1.00 0.00 C ATOM 75129 H17R OL 1809 147.956 101.215 39.934 1.00 0.00 H ATOM 75130 H17S OL 1809 149.012 99.740 40.018 1.00 0.00 H ATOM 75131 C118 OL 1809 147.876 100.474 41.759 1.00 0.00 C ATOM 75132 H18R OL 1809 147.842 101.491 42.154 1.00 0.00 H ATOM 75133 H18S OL 1809 148.443 99.845 42.449 1.00 0.00 H ATOM 75134 H18T OL 1809 146.898 100.002 41.645 1.00 0.00 H TER 75135 OL 1809 ATOM 75135 C116 PA 1810 -4.206 133.535 39.946 1.00 0.00 C ATOM 75136 H16R PA 1810 -4.799 132.828 40.530 1.00 0.00 H ATOM 75137 H16S PA 1810 -4.086 132.974 39.017 1.00 0.00 H ATOM 75138 H16T PA 1810 -4.732 134.490 39.886 1.00 0.00 H ATOM 75139 C115 PA 1810 -2.730 133.752 40.454 1.00 0.00 C ATOM 75140 H15R PA 1810 -2.142 132.854 40.656 1.00 0.00 H ATOM 75141 H15S PA 1810 -2.801 134.267 41.415 1.00 0.00 H ATOM 75142 C114 PA 1810 -1.764 134.468 39.538 1.00 0.00 C ATOM 75143 H14R PA 1810 -0.754 134.446 39.951 1.00 0.00 H ATOM 75144 H14S PA 1810 -2.009 135.524 39.409 1.00 0.00 H ATOM 75145 C113 PA 1810 -1.546 133.877 38.128 1.00 0.00 C ATOM 75146 H13R PA 1810 -2.466 133.560 37.634 1.00 0.00 H ATOM 75147 H13S PA 1810 -1.011 132.927 38.179 1.00 0.00 H ATOM 75148 C112 PA 1810 -0.914 134.890 37.155 1.00 0.00 C ATOM 75149 H12R PA 1810 -0.116 135.383 37.714 1.00 0.00 H ATOM 75150 H12S PA 1810 -1.619 135.617 36.748 1.00 0.00 H ATOM 75151 C111 PA 1810 -0.446 134.218 35.899 1.00 0.00 C ATOM 75152 H11R PA 1810 -1.184 134.041 35.114 1.00 0.00 H ATOM 75153 H11S PA 1810 0.069 133.267 36.048 1.00 0.00 H ATOM 75154 C110 PA 1810 0.523 135.140 35.181 1.00 0.00 C ATOM 75155 H10R PA 1810 1.096 135.726 35.903 1.00 0.00 H ATOM 75156 H10S PA 1810 -0.035 135.893 34.620 1.00 0.00 H ATOM 75157 C19 PA 1810 1.398 134.353 34.225 1.00 0.00 C ATOM 75158 H9R PA 1810 0.854 133.972 33.358 1.00 0.00 H ATOM 75159 H9S PA 1810 1.953 133.525 34.672 1.00 0.00 H ATOM 75160 C18 PA 1810 2.506 135.241 33.469 1.00 0.00 C ATOM 75161 H8R PA 1810 2.659 134.729 32.516 1.00 0.00 H ATOM 75162 H8S PA 1810 3.487 135.142 33.938 1.00 0.00 H ATOM 75163 C17 PA 1810 2.226 136.754 33.156 1.00 0.00 C ATOM 75164 H7R PA 1810 2.255 137.320 34.090 1.00 0.00 H ATOM 75165 H7S PA 1810 1.235 137.002 32.770 1.00 0.00 H ATOM 75166 C16 PA 1810 3.334 137.398 32.263 1.00 0.00 C ATOM 75167 H6R PA 1810 3.229 136.945 31.276 1.00 0.00 H ATOM 75168 H6S PA 1810 4.360 137.125 32.518 1.00 0.00 H ATOM 75169 C15 PA 1810 3.290 138.913 32.271 1.00 0.00 C ATOM 75170 H5R PA 1810 3.581 139.205 33.283 1.00 0.00 H ATOM 75171 H5S PA 1810 2.274 139.312 32.234 1.00 0.00 H ATOM 75172 C14 PA 1810 4.136 139.622 31.247 1.00 0.00 C ATOM 75173 H4R PA 1810 5.198 139.411 31.388 1.00 0.00 H ATOM 75174 H4S PA 1810 4.008 140.692 31.422 1.00 0.00 H ATOM 75175 C13 PA 1810 3.778 139.420 29.741 1.00 0.00 C ATOM 75176 H3R PA 1810 2.756 139.805 29.721 1.00 0.00 H ATOM 75177 H3S PA 1810 3.913 138.370 29.475 1.00 0.00 H ATOM 75178 C12 PA 1810 4.563 140.346 28.836 1.00 0.00 C ATOM 75179 H2R PA 1810 5.520 139.829 28.731 1.00 0.00 H ATOM 75180 H2S PA 1810 4.857 141.303 29.273 1.00 0.00 H ATOM 75181 C11 PC 1811 3.971 140.461 27.452 1.00 0.00 C ATOM 75182 O12 PC 1811 2.913 139.962 27.144 1.00 0.00 O ATOM 75183 O11 PC 1811 4.834 141.200 26.650 1.00 0.00 O ATOM 75184 C1 PC 1811 4.705 141.505 25.253 1.00 0.00 C ATOM 75185 HR PC 1811 4.282 140.660 24.704 1.00 0.00 H ATOM 75186 HS PC 1811 5.723 141.715 24.915 1.00 0.00 H ATOM 75187 C2 PC 1811 3.767 142.698 25.099 1.00 0.00 C ATOM 75188 HX PC 1811 2.827 142.574 25.643 1.00 0.00 H ATOM 75189 C3 PC 1811 3.445 143.016 23.625 1.00 0.00 C ATOM 75190 HA PC 1811 2.966 143.996 23.554 1.00 0.00 H ATOM 75191 HB PC 1811 2.938 142.127 23.240 1.00 0.00 H ATOM 75192 O31 PC 1811 4.671 143.145 22.893 1.00 0.00 O ATOM 75193 P31 PC 1811 4.770 143.272 21.335 1.00 0.00 P ATOM 75194 O32 PC 1811 4.363 144.804 21.058 1.00 0.00 O ATOM 75195 C31 PC 1811 5.437 145.769 21.056 1.00 0.00 C ATOM 75196 H1A PC 1811 6.097 145.536 21.895 1.00 0.00 H ATOM 75197 H1B PC 1811 5.134 146.811 21.180 1.00 0.00 H ATOM 75198 C32 PC 1811 6.237 145.602 19.750 1.00 0.00 C ATOM 75199 H2A PC 1811 5.570 145.960 18.964 1.00 0.00 H ATOM 75200 H2B PC 1811 6.365 144.544 19.517 1.00 0.00 H ATOM 75201 N31 PC 1811 7.535 146.273 19.683 1.00 0.00 N ATOM 75202 C33 PC 1811 8.481 145.778 20.723 1.00 0.00 C ATOM 75203 H3A PC 1811 8.596 144.695 20.781 1.00 0.00 H ATOM 75204 H3B PC 1811 8.180 146.118 21.715 1.00 0.00 H ATOM 75205 H3C PC 1811 9.435 146.246 20.478 1.00 0.00 H ATOM 75206 C34 PC 1811 8.160 146.029 18.407 1.00 0.00 C ATOM 75207 H4A PC 1811 8.237 144.964 18.185 1.00 0.00 H ATOM 75208 H4B PC 1811 9.132 146.520 18.348 1.00 0.00 H ATOM 75209 H4C PC 1811 7.429 146.326 17.653 1.00 0.00 H ATOM 75210 C35 PC 1811 7.408 147.735 19.897 1.00 0.00 C ATOM 75211 H5A PC 1811 6.650 148.113 19.210 1.00 0.00 H ATOM 75212 H5B PC 1811 8.376 148.135 19.591 1.00 0.00 H ATOM 75213 H5C PC 1811 7.101 147.900 20.931 1.00 0.00 H ATOM 75214 O33 PC 1811 6.169 143.099 21.009 1.00 0.00 O ATOM 75215 O34 PC 1811 3.774 142.411 20.542 1.00 0.00 O ATOM 75216 O21 PC 1811 4.521 143.821 25.760 1.00 0.00 O ATOM 75217 C21 PC 1811 3.891 145.005 25.916 1.00 0.00 C ATOM 75218 O22 PC 1811 2.778 145.208 25.440 1.00 0.00 O ATOM 75219 C12 OL 1812 4.652 145.855 26.768 1.00 0.00 C ATOM 75220 H2R OL 1812 5.705 145.916 26.484 1.00 0.00 H ATOM 75221 H2S OL 1812 4.156 146.794 26.513 1.00 0.00 H ATOM 75222 C13 OL 1812 4.417 145.603 28.266 1.00 0.00 C ATOM 75223 H3R OL 1812 3.349 145.746 28.447 1.00 0.00 H ATOM 75224 H3S OL 1812 4.502 144.569 28.607 1.00 0.00 H ATOM 75225 C14 OL 1812 5.172 146.542 29.206 1.00 0.00 C ATOM 75226 H4R OL 1812 6.251 146.415 29.098 1.00 0.00 H ATOM 75227 H4S OL 1812 4.969 147.522 28.771 1.00 0.00 H ATOM 75228 C15 OL 1812 4.743 146.586 30.706 1.00 0.00 C ATOM 75229 H5R OL 1812 3.681 146.721 30.492 1.00 0.00 H ATOM 75230 H5S OL 1812 4.666 145.631 31.231 1.00 0.00 H ATOM 75231 C16 OL 1812 5.377 147.649 31.546 1.00 0.00 C ATOM 75232 H6R OL 1812 5.336 148.628 31.063 1.00 0.00 H ATOM 75233 H6S OL 1812 4.779 147.725 32.457 1.00 0.00 H ATOM 75234 C17 OL 1812 6.774 147.261 31.876 1.00 0.00 C ATOM 75235 H7R OL 1812 6.826 146.328 32.440 1.00 0.00 H ATOM 75236 H7S OL 1812 7.195 147.076 30.886 1.00 0.00 H ATOM 75237 C18 OL 1812 7.440 148.458 32.578 1.00 0.00 C ATOM 75238 H8R OL 1812 7.435 149.380 31.993 1.00 0.00 H ATOM 75239 H8S OL 1812 6.867 148.706 33.474 1.00 0.00 H ATOM 75240 C19 OL 1812 8.833 148.101 32.945 1.00 0.00 C ATOM 75241 H9R OL 1812 8.920 147.213 33.567 1.00 0.00 H ATOM 75242 C110 OL 1812 9.916 148.832 32.765 1.00 0.00 C ATOM 75243 H10R OL 1812 10.851 148.453 33.168 1.00 0.00 H ATOM 75244 C111 OL 1812 9.988 150.208 32.086 1.00 0.00 C ATOM 75245 H11R OL 1812 10.939 150.340 31.567 1.00 0.00 H ATOM 75246 H11S OL 1812 9.250 150.298 31.286 1.00 0.00 H ATOM 75247 C112 OL 1812 9.995 151.343 33.028 1.00 0.00 C ATOM 75248 H12R OL 1812 10.722 151.067 33.795 1.00 0.00 H ATOM 75249 H12S OL 1812 10.406 152.262 32.605 1.00 0.00 H ATOM 75250 C113 OL 1812 8.650 151.542 33.695 1.00 0.00 C ATOM 75251 H13R OL 1812 7.822 151.158 33.094 1.00 0.00 H ATOM 75252 H13S OL 1812 8.685 150.930 34.599 1.00 0.00 H ATOM 75253 C114 OL 1812 8.346 152.988 34.112 1.00 0.00 C ATOM 75254 H14R OL 1812 9.221 153.304 34.684 1.00 0.00 H ATOM 75255 H14S OL 1812 8.268 153.590 33.204 1.00 0.00 H ATOM 75256 C115 OL 1812 6.985 153.246 34.845 1.00 0.00 C ATOM 75257 H15R OL 1812 7.102 152.955 35.890 1.00 0.00 H ATOM 75258 H15S OL 1812 6.765 154.300 35.025 1.00 0.00 H ATOM 75259 C116 OL 1812 5.836 152.566 34.306 1.00 0.00 C ATOM 75260 H16R OL 1812 6.111 151.511 34.372 1.00 0.00 H ATOM 75261 H16S OL 1812 4.942 152.496 34.929 1.00 0.00 H ATOM 75262 C117 OL 1812 5.504 153.077 32.791 1.00 0.00 C ATOM 75263 H17R OL 1812 5.340 154.132 33.020 1.00 0.00 H ATOM 75264 H17S OL 1812 6.306 152.973 32.056 1.00 0.00 H ATOM 75265 C118 OL 1812 4.276 152.431 32.189 1.00 0.00 C ATOM 75266 H18R OL 1812 3.996 152.961 31.277 1.00 0.00 H ATOM 75267 H18S OL 1812 3.434 152.358 32.881 1.00 0.00 H ATOM 75268 H18T OL 1812 4.584 151.427 31.890 1.00 0.00 H TER 75269 OL 1812 ATOM 75269 C116 PA 1813 32.105 15.462 33.172 1.00 0.00 C ATOM 75270 H16R PA 1813 31.589 15.295 32.224 1.00 0.00 H ATOM 75271 H16S PA 1813 32.953 16.056 32.826 1.00 0.00 H ATOM 75272 H16T PA 1813 31.441 16.098 33.762 1.00 0.00 H ATOM 75273 C115 PA 1813 32.459 14.149 33.884 1.00 0.00 C ATOM 75274 H15R PA 1813 33.297 13.580 33.475 1.00 0.00 H ATOM 75275 H15S PA 1813 31.687 13.391 33.736 1.00 0.00 H ATOM 75276 C114 PA 1813 32.817 14.342 35.341 1.00 0.00 C ATOM 75277 H14R PA 1813 32.007 14.264 36.070 1.00 0.00 H ATOM 75278 H14S PA 1813 33.374 15.278 35.416 1.00 0.00 H ATOM 75279 C113 PA 1813 33.989 13.354 35.855 1.00 0.00 C ATOM 75280 H13R PA 1813 34.421 13.804 36.751 1.00 0.00 H ATOM 75281 H13S PA 1813 34.757 13.425 35.082 1.00 0.00 H ATOM 75282 C112 PA 1813 33.484 11.929 36.043 1.00 0.00 C ATOM 75283 H12R PA 1813 32.989 11.540 35.151 1.00 0.00 H ATOM 75284 H12S PA 1813 32.583 12.049 36.648 1.00 0.00 H ATOM 75285 C111 PA 1813 34.445 10.926 36.663 1.00 0.00 C ATOM 75286 H11R PA 1813 34.727 11.285 37.655 1.00 0.00 H ATOM 75287 H11S PA 1813 35.431 10.982 36.199 1.00 0.00 H ATOM 75288 C110 PA 1813 33.947 9.517 36.613 1.00 0.00 C ATOM 75289 H10R PA 1813 32.907 9.442 36.936 1.00 0.00 H ATOM 75290 H10S PA 1813 34.521 8.873 37.283 1.00 0.00 H ATOM 75291 C19 PA 1813 34.011 8.871 35.260 1.00 0.00 C ATOM 75292 H9R PA 1813 35.057 8.616 35.080 1.00 0.00 H ATOM 75293 H9S PA 1813 33.777 9.561 34.446 1.00 0.00 H ATOM 75294 C18 PA 1813 33.106 7.602 35.197 1.00 0.00 C ATOM 75295 H8R PA 1813 32.069 7.818 35.463 1.00 0.00 H ATOM 75296 H8S PA 1813 33.509 6.957 35.981 1.00 0.00 H ATOM 75297 C17 PA 1813 33.121 6.865 33.899 1.00 0.00 C ATOM 75298 H7R PA 1813 34.175 6.794 33.624 1.00 0.00 H ATOM 75299 H7S PA 1813 32.553 7.394 33.131 1.00 0.00 H ATOM 75300 C16 PA 1813 32.572 5.478 33.983 1.00 0.00 C ATOM 75301 H6R PA 1813 31.598 5.550 34.471 1.00 0.00 H ATOM 75302 H6S PA 1813 33.178 4.861 34.650 1.00 0.00 H ATOM 75303 C15 PA 1813 32.390 4.866 32.606 1.00 0.00 C ATOM 75304 H5R PA 1813 32.362 3.777 32.689 1.00 0.00 H ATOM 75305 H5S PA 1813 33.256 5.003 31.955 1.00 0.00 H ATOM 75306 C14 PA 1813 31.068 5.248 31.998 1.00 0.00 C ATOM 75307 H4R PA 1813 30.816 6.288 32.214 1.00 0.00 H ATOM 75308 H4S PA 1813 30.337 4.655 32.552 1.00 0.00 H ATOM 75309 C13 PA 1813 31.131 4.977 30.383 1.00 0.00 C ATOM 75310 H3R PA 1813 31.650 5.747 29.809 1.00 0.00 H ATOM 75311 H3S PA 1813 30.215 5.179 29.823 1.00 0.00 H ATOM 75312 C12 PA 1813 31.687 3.617 29.967 1.00 0.00 C ATOM 75313 H2R PA 1813 31.110 2.921 30.579 1.00 0.00 H ATOM 75314 H2S PA 1813 32.763 3.490 30.104 1.00 0.00 H ATOM 75315 C11 PGR 1814 31.390 3.369 28.488 1.00 0.00 C ATOM 75316 O12 PGR 1814 31.124 4.271 27.709 1.00 0.00 O ATOM 75317 O11 PGR 1814 31.422 2.067 28.071 1.00 0.00 O ATOM 75318 C1 PGR 1814 31.144 1.696 26.657 1.00 0.00 C ATOM 75319 HR PGR 1814 30.311 2.286 26.266 1.00 0.00 H ATOM 75320 HS PGR 1814 30.827 0.662 26.498 1.00 0.00 H ATOM 75321 C2 PGR 1814 32.281 2.004 25.675 1.00 0.00 C ATOM 75322 HX PGR 1814 32.353 3.089 25.779 1.00 0.00 H ATOM 75323 C3 PGR 1814 32.003 1.501 24.302 1.00 0.00 C ATOM 75324 HA PGR 1814 31.012 1.790 23.942 1.00 0.00 H ATOM 75325 HB PGR 1814 31.991 0.424 24.118 1.00 0.00 H ATOM 75326 O31 PGR 1814 32.825 2.092 23.338 1.00 0.00 O ATOM 75327 P31 PGR 1814 32.784 1.704 21.788 1.00 0.00 P ATOM 75328 O32 PGR 1814 33.646 0.357 21.839 1.00 0.00 O ATOM 75329 C31 PGR 1814 34.985 0.392 21.534 1.00 0.00 C ATOM 75330 H1A PGR 1814 35.393 1.383 21.751 1.00 0.00 H ATOM 75331 H1B PGR 1814 35.145 0.266 20.461 1.00 0.00 H ATOM 75332 C32 PGR 1814 35.760 -0.738 22.235 1.00 0.00 C ATOM 75333 H2A PGR 1814 36.821 -0.476 22.220 1.00 0.00 H ATOM 75334 O35 PGR 1814 35.467 -1.994 21.600 1.00 0.00 O ATOM 75335 HO5A PGR 1814 35.776 -2.636 22.264 1.00 0.00 H ATOM 75336 C33 PGR 1814 35.355 -0.873 23.759 1.00 0.00 C ATOM 75337 H3A PGR 1814 35.318 0.071 24.308 1.00 0.00 H ATOM 75338 H3B PGR 1814 34.308 -1.148 23.913 1.00 0.00 H ATOM 75339 O33 PGR 1814 31.430 1.250 21.498 1.00 0.00 O ATOM 75340 O34 PGR 1814 33.440 2.683 20.883 1.00 0.00 O ATOM 75341 O21 PGR 1814 33.500 1.262 26.042 1.00 0.00 O ATOM 75342 C21 PGR 1814 34.491 1.985 26.540 1.00 0.00 C ATOM 75343 O22 PGR 1814 34.777 3.153 26.471 1.00 0.00 O ATOM 75344 O36 PGR 1814 36.317 -1.706 24.307 1.00 0.00 O ATOM 75345 HO6A PGR 1814 36.222 -2.655 24.114 1.00 0.00 H ATOM 75346 C12 OL 1815 35.532 1.034 27.149 1.00 0.00 C ATOM 75347 H2R OL 1815 34.972 0.227 27.625 1.00 0.00 H ATOM 75348 H2S OL 1815 36.115 0.628 26.319 1.00 0.00 H ATOM 75349 C13 OL 1815 36.387 1.525 28.350 1.00 0.00 C ATOM 75350 H3R OL 1815 36.905 0.667 28.784 1.00 0.00 H ATOM 75351 H3S OL 1815 37.167 2.192 27.978 1.00 0.00 H ATOM 75352 C14 OL 1815 35.555 2.150 29.542 1.00 0.00 C ATOM 75353 H4R OL 1815 35.196 3.105 29.154 1.00 0.00 H ATOM 75354 H4S OL 1815 34.690 1.499 29.684 1.00 0.00 H ATOM 75355 C15 OL 1815 36.428 2.288 30.773 1.00 0.00 C ATOM 75356 H5R OL 1815 36.737 1.284 31.073 1.00 0.00 H ATOM 75357 H5S OL 1815 37.291 2.933 30.592 1.00 0.00 H ATOM 75358 C16 OL 1815 35.665 2.831 31.971 1.00 0.00 C ATOM 75359 H6R OL 1815 35.404 3.865 31.734 1.00 0.00 H ATOM 75360 H6S OL 1815 34.724 2.294 32.107 1.00 0.00 H ATOM 75361 C17 OL 1815 36.520 2.938 33.279 1.00 0.00 C ATOM 75362 H7R OL 1815 36.710 1.885 33.495 1.00 0.00 H ATOM 75363 H7S OL 1815 37.450 3.465 33.054 1.00 0.00 H ATOM 75364 C18 OL 1815 35.888 3.753 34.336 1.00 0.00 C ATOM 75365 H8R OL 1815 35.392 4.657 33.977 1.00 0.00 H ATOM 75366 H8S OL 1815 35.189 3.132 34.899 1.00 0.00 H ATOM 75367 C19 OL 1815 36.920 4.256 35.307 1.00 0.00 C ATOM 75368 H9R OL 1815 37.958 4.320 34.992 1.00 0.00 H ATOM 75369 C110 OL 1815 36.602 4.638 36.571 1.00 0.00 C ATOM 75370 H10R OL 1815 37.365 4.981 37.265 1.00 0.00 H ATOM 75371 C111 OL 1815 35.187 4.652 37.160 1.00 0.00 C ATOM 75372 H11R OL 1815 35.088 5.641 37.614 1.00 0.00 H ATOM 75373 H11S OL 1815 34.431 4.485 36.390 1.00 0.00 H ATOM 75374 C112 OL 1815 34.890 3.620 38.189 1.00 0.00 C ATOM 75375 H12R OL 1815 35.751 3.374 38.813 1.00 0.00 H ATOM 75376 H12S OL 1815 34.107 3.893 38.900 1.00 0.00 H ATOM 75377 C113 OL 1815 34.691 2.178 37.582 1.00 0.00 C ATOM 75378 H13R OL 1815 33.794 2.291 36.970 1.00 0.00 H ATOM 75379 H13S OL 1815 35.536 2.020 36.909 1.00 0.00 H ATOM 75380 C114 OL 1815 34.508 1.063 38.592 1.00 0.00 C ATOM 75381 H14R OL 1815 34.263 0.157 38.035 1.00 0.00 H ATOM 75382 H14S OL 1815 35.468 0.940 39.099 1.00 0.00 H ATOM 75383 C115 OL 1815 33.579 1.220 39.770 1.00 0.00 C ATOM 75384 H15R OL 1815 33.933 2.031 40.411 1.00 0.00 H ATOM 75385 H15S OL 1815 32.562 1.518 39.507 1.00 0.00 H ATOM 75386 C116 OL 1815 33.650 -0.070 40.813 1.00 0.00 C ATOM 75387 H16R OL 1815 34.655 -0.496 40.842 1.00 0.00 H ATOM 75388 H16S OL 1815 33.447 0.151 41.863 1.00 0.00 H ATOM 75389 C117 OL 1815 32.694 -1.143 40.339 1.00 0.00 C ATOM 75390 H17R OL 1815 31.738 -0.618 40.282 1.00 0.00 H ATOM 75391 H17S OL 1815 32.771 -1.450 39.293 1.00 0.00 H ATOM 75392 C118 OL 1815 32.633 -2.368 41.306 1.00 0.00 C ATOM 75393 H18R OL 1815 32.267 -1.927 42.235 1.00 0.00 H ATOM 75394 H18S OL 1815 33.569 -2.928 41.340 1.00 0.00 H ATOM 75395 H18T OL 1815 31.834 -3.000 40.913 1.00 0.00 H TER 75396 OL 1815 ATOM 75396 C116 PA 1816 114.783 106.396 42.958 1.00 0.00 C ATOM 75397 H16R PA 1816 114.844 105.964 41.957 1.00 0.00 H ATOM 75398 H16S PA 1816 115.720 105.967 43.321 1.00 0.00 H ATOM 75399 H16T PA 1816 114.764 107.483 42.862 1.00 0.00 H ATOM 75400 C115 PA 1816 113.698 105.811 43.832 1.00 0.00 C ATOM 75401 H15R PA 1816 113.739 106.196 44.853 1.00 0.00 H ATOM 75402 H15S PA 1816 114.145 104.821 43.941 1.00 0.00 H ATOM 75403 C114 PA 1816 112.299 105.718 43.272 1.00 0.00 C ATOM 75404 H14R PA 1816 112.403 104.981 42.474 1.00 0.00 H ATOM 75405 H14S PA 1816 111.950 106.587 42.710 1.00 0.00 H ATOM 75406 C113 PA 1816 111.172 105.249 44.273 1.00 0.00 C ATOM 75407 H13R PA 1816 110.923 106.117 44.886 1.00 0.00 H ATOM 75408 H13S PA 1816 111.678 104.584 44.976 1.00 0.00 H ATOM 75409 C112 PA 1816 109.915 104.669 43.680 1.00 0.00 C ATOM 75410 H12R PA 1816 109.462 103.984 44.400 1.00 0.00 H ATOM 75411 H12S PA 1816 110.086 103.928 42.895 1.00 0.00 H ATOM 75412 C111 PA 1816 108.889 105.720 43.239 1.00 0.00 C ATOM 75413 H11R PA 1816 108.678 106.277 44.153 1.00 0.00 H ATOM 75414 H11S PA 1816 107.952 105.199 43.031 1.00 0.00 H ATOM 75415 C110 PA 1816 109.238 106.673 42.122 1.00 0.00 C ATOM 75416 H10R PA 1816 110.114 107.256 42.412 1.00 0.00 H ATOM 75417 H10S PA 1816 108.410 107.362 41.938 1.00 0.00 H ATOM 75418 C19 PA 1816 109.576 106.100 40.762 1.00 0.00 C ATOM 75419 H9R PA 1816 110.589 105.714 40.895 1.00 0.00 H ATOM 75420 H9S PA 1816 109.685 106.985 40.132 1.00 0.00 H ATOM 75421 C18 PA 1816 108.586 104.976 40.203 1.00 0.00 C ATOM 75422 H8R PA 1816 107.571 105.144 40.569 1.00 0.00 H ATOM 75423 H8S PA 1816 108.824 103.964 40.534 1.00 0.00 H ATOM 75424 C17 PA 1816 108.814 104.739 38.709 1.00 0.00 C ATOM 75425 H7R PA 1816 108.222 103.860 38.447 1.00 0.00 H ATOM 75426 H7S PA 1816 109.831 104.416 38.478 1.00 0.00 H ATOM 75427 C16 PA 1816 108.420 105.895 37.858 1.00 0.00 C ATOM 75428 H6R PA 1816 109.306 106.509 37.678 1.00 0.00 H ATOM 75429 H6S PA 1816 107.717 106.561 38.363 1.00 0.00 H ATOM 75430 C15 PA 1816 107.796 105.527 36.482 1.00 0.00 C ATOM 75431 H5R PA 1816 106.745 105.285 36.651 1.00 0.00 H ATOM 75432 H5S PA 1816 108.126 104.551 36.121 1.00 0.00 H ATOM 75433 C14 PA 1816 108.099 106.668 35.482 1.00 0.00 C ATOM 75434 H4R PA 1816 109.171 106.874 35.462 1.00 0.00 H ATOM 75435 H4S PA 1816 107.727 107.650 35.785 1.00 0.00 H ATOM 75436 C13 PA 1816 107.790 106.258 34.033 1.00 0.00 C ATOM 75437 H3R PA 1816 106.709 106.114 33.969 1.00 0.00 H ATOM 75438 H3S PA 1816 108.247 105.295 33.796 1.00 0.00 H ATOM 75439 C12 PA 1816 108.109 107.300 32.941 1.00 0.00 C ATOM 75440 H2R PA 1816 109.117 107.665 33.150 1.00 0.00 H ATOM 75441 H2S PA 1816 107.474 108.151 33.194 1.00 0.00 H ATOM 75442 C11 PC 1817 108.127 106.761 31.523 1.00 0.00 C ATOM 75443 O12 PC 1817 107.446 105.821 31.145 1.00 0.00 O ATOM 75444 O11 PC 1817 108.799 107.508 30.663 1.00 0.00 O ATOM 75445 C1 PC 1817 108.778 107.219 29.239 1.00 0.00 C ATOM 75446 HR PC 1817 108.772 108.195 28.746 1.00 0.00 H ATOM 75447 HS PC 1817 107.859 106.669 29.020 1.00 0.00 H ATOM 75448 C2 PC 1817 109.967 106.431 28.833 1.00 0.00 C ATOM 75449 HX PC 1817 110.820 106.976 29.244 1.00 0.00 H ATOM 75450 C3 PC 1817 110.226 106.407 27.327 1.00 0.00 C ATOM 75451 HA PC 1817 111.206 106.058 26.993 1.00 0.00 H ATOM 75452 HB PC 1817 110.157 107.429 26.946 1.00 0.00 H ATOM 75453 O31 PC 1817 109.331 105.550 26.693 1.00 0.00 O ATOM 75454 P31 PC 1817 109.136 105.633 25.126 1.00 0.00 P ATOM 75455 O32 PC 1817 110.487 105.114 24.612 1.00 0.00 O ATOM 75456 C31 PC 1817 110.575 104.728 23.265 1.00 0.00 C ATOM 75457 H1A PC 1817 110.716 105.502 22.505 1.00 0.00 H ATOM 75458 H1B PC 1817 109.713 104.143 22.932 1.00 0.00 H ATOM 75459 C32 PC 1817 111.938 103.989 23.382 1.00 0.00 C ATOM 75460 H2A PC 1817 111.936 103.111 22.733 1.00 0.00 H ATOM 75461 H2B PC 1817 112.077 103.611 24.396 1.00 0.00 H ATOM 75462 N31 PC 1817 113.205 104.754 23.114 1.00 0.00 N ATOM 75463 C33 PC 1817 113.321 105.904 24.053 1.00 0.00 C ATOM 75464 H3A PC 1817 113.685 105.597 25.034 1.00 0.00 H ATOM 75465 H3B PC 1817 112.339 106.375 24.118 1.00 0.00 H ATOM 75466 H3C PC 1817 114.012 106.568 23.532 1.00 0.00 H ATOM 75467 C34 PC 1817 114.405 103.916 23.345 1.00 0.00 C ATOM 75468 H4A PC 1817 114.370 103.425 24.318 1.00 0.00 H ATOM 75469 H4B PC 1817 115.241 104.614 23.401 1.00 0.00 H ATOM 75470 H4C PC 1817 114.602 103.233 22.517 1.00 0.00 H ATOM 75471 C35 PC 1817 113.278 105.239 21.693 1.00 0.00 C ATOM 75472 H5A PC 1817 112.402 105.851 21.474 1.00 0.00 H ATOM 75473 H5B PC 1817 113.407 104.305 21.143 1.00 0.00 H ATOM 75474 H5C PC 1817 114.175 105.849 21.579 1.00 0.00 H ATOM 75475 O33 PC 1817 108.109 104.644 24.786 1.00 0.00 O ATOM 75476 O34 PC 1817 108.984 106.999 24.532 1.00 0.00 O ATOM 75477 O21 PC 1817 109.987 105.037 29.347 1.00 0.00 O ATOM 75478 C21 PC 1817 111.260 104.476 29.611 1.00 0.00 C ATOM 75479 O22 PC 1817 112.281 104.927 29.157 1.00 0.00 O ATOM 75480 C12 OL 1818 111.298 103.078 30.222 1.00 0.00 C ATOM 75481 H2R OL 1818 111.055 102.437 29.372 1.00 0.00 H ATOM 75482 H2S OL 1818 112.332 102.881 30.512 1.00 0.00 H ATOM 75483 C13 OL 1818 110.371 102.937 31.412 1.00 0.00 C ATOM 75484 H3R OL 1818 111.029 103.105 32.268 1.00 0.00 H ATOM 75485 H3S OL 1818 109.563 103.672 31.386 1.00 0.00 H ATOM 75486 C14 OL 1818 109.642 101.554 31.532 1.00 0.00 C ATOM 75487 H4R OL 1818 109.046 101.340 30.642 1.00 0.00 H ATOM 75488 H4S OL 1818 110.492 100.891 31.703 1.00 0.00 H ATOM 75489 C15 OL 1818 108.738 101.475 32.805 1.00 0.00 C ATOM 75490 H5R OL 1818 107.959 102.218 32.627 1.00 0.00 H ATOM 75491 H5S OL 1818 108.235 100.506 32.772 1.00 0.00 H ATOM 75492 C16 OL 1818 109.415 101.791 34.085 1.00 0.00 C ATOM 75493 H6R OL 1818 110.303 101.161 34.173 1.00 0.00 H ATOM 75494 H6S OL 1818 109.733 102.835 34.135 1.00 0.00 H ATOM 75495 C17 OL 1818 108.622 101.581 35.307 1.00 0.00 C ATOM 75496 H7R OL 1818 107.811 102.312 35.300 1.00 0.00 H ATOM 75497 H7S OL 1818 108.050 100.651 35.281 1.00 0.00 H ATOM 75498 C18 OL 1818 109.386 101.803 36.559 1.00 0.00 C ATOM 75499 H8R OL 1818 109.829 102.789 36.407 1.00 0.00 H ATOM 75500 H8S OL 1818 108.664 101.829 37.378 1.00 0.00 H ATOM 75501 C19 OL 1818 110.466 100.688 36.707 1.00 0.00 C ATOM 75502 H9R OL 1818 110.674 100.063 35.843 1.00 0.00 H ATOM 75503 C110 OL 1818 111.249 100.516 37.773 1.00 0.00 C ATOM 75504 H10R OL 1818 111.994 99.727 37.707 1.00 0.00 H ATOM 75505 C111 OL 1818 111.287 101.457 38.978 1.00 0.00 C ATOM 75506 H11R OL 1818 112.217 102.024 39.057 1.00 0.00 H ATOM 75507 H11S OL 1818 110.480 102.186 39.074 1.00 0.00 H ATOM 75508 C112 OL 1818 111.199 100.582 40.144 1.00 0.00 C ATOM 75509 H12R OL 1818 110.221 100.099 40.204 1.00 0.00 H ATOM 75510 H12S OL 1818 111.985 99.824 40.134 1.00 0.00 H ATOM 75511 C113 OL 1818 111.229 101.388 41.432 1.00 0.00 C ATOM 75512 H13R OL 1818 112.213 101.861 41.470 1.00 0.00 H ATOM 75513 H13S OL 1818 110.530 102.226 41.469 1.00 0.00 H ATOM 75514 C114 OL 1818 111.147 100.504 42.668 1.00 0.00 C ATOM 75515 H14R OL 1818 110.094 100.237 42.783 1.00 0.00 H ATOM 75516 H14S OL 1818 111.658 99.572 42.417 1.00 0.00 H ATOM 75517 C115 OL 1818 111.576 101.035 44.054 1.00 0.00 C ATOM 75518 H15R OL 1818 112.665 100.971 43.998 1.00 0.00 H ATOM 75519 H15S OL 1818 111.229 102.061 44.192 1.00 0.00 H ATOM 75520 C116 OL 1818 110.829 100.112 45.122 1.00 0.00 C ATOM 75521 H16R OL 1818 109.903 100.647 45.346 1.00 0.00 H ATOM 75522 H16S OL 1818 110.691 99.140 44.646 1.00 0.00 H ATOM 75523 C117 OL 1818 111.662 99.752 46.338 1.00 0.00 C ATOM 75524 H17R OL 1818 110.978 99.538 47.162 1.00 0.00 H ATOM 75525 H17S OL 1818 112.249 98.874 46.059 1.00 0.00 H ATOM 75526 C118 OL 1818 112.684 100.714 46.903 1.00 0.00 C ATOM 75527 H18R OL 1818 113.371 101.057 46.127 1.00 0.00 H ATOM 75528 H18S OL 1818 113.208 100.128 47.661 1.00 0.00 H ATOM 75529 H18T OL 1818 112.193 101.495 47.488 1.00 0.00 H TER 75530 OL 1818 ATOM 75530 C116 PA 1819 36.950 27.115 38.075 1.00 0.00 C ATOM 75531 H16R PA 1819 37.763 27.102 38.803 1.00 0.00 H ATOM 75532 H16S PA 1819 36.276 26.445 38.612 1.00 0.00 H ATOM 75533 H16T PA 1819 36.545 28.126 37.988 1.00 0.00 H ATOM 75534 C115 PA 1819 37.021 26.511 36.613 1.00 0.00 C ATOM 75535 H15R PA 1819 37.604 25.590 36.542 1.00 0.00 H ATOM 75536 H15S PA 1819 37.686 27.135 36.014 1.00 0.00 H ATOM 75537 C114 PA 1819 35.751 26.323 35.786 1.00 0.00 C ATOM 75538 H14R PA 1819 35.687 27.306 35.316 1.00 0.00 H ATOM 75539 H14S PA 1819 34.888 26.207 36.446 1.00 0.00 H ATOM 75540 C113 PA 1819 35.891 25.292 34.681 1.00 0.00 C ATOM 75541 H13R PA 1819 36.241 24.407 35.217 1.00 0.00 H ATOM 75542 H13S PA 1819 36.620 25.561 33.914 1.00 0.00 H ATOM 75543 C112 PA 1819 34.567 25.040 33.928 1.00 0.00 C ATOM 75544 H12R PA 1819 34.321 25.894 33.292 1.00 0.00 H ATOM 75545 H12S PA 1819 33.746 24.971 34.645 1.00 0.00 H ATOM 75546 C111 PA 1819 34.728 23.775 33.137 1.00 0.00 C ATOM 75547 H11R PA 1819 35.119 23.026 33.828 1.00 0.00 H ATOM 75548 H11S PA 1819 35.599 23.951 32.501 1.00 0.00 H ATOM 75549 C110 PA 1819 33.444 23.195 32.485 1.00 0.00 C ATOM 75550 H10R PA 1819 32.882 24.049 32.101 1.00 0.00 H ATOM 75551 H10S PA 1819 32.780 22.908 33.304 1.00 0.00 H ATOM 75552 C19 PA 1819 33.596 22.115 31.474 1.00 0.00 C ATOM 75553 H9R PA 1819 34.235 21.294 31.805 1.00 0.00 H ATOM 75554 H9S PA 1819 34.061 22.566 30.595 1.00 0.00 H ATOM 75555 C18 PA 1819 32.166 21.676 31.094 1.00 0.00 C ATOM 75556 H8R PA 1819 31.616 22.585 30.842 1.00 0.00 H ATOM 75557 H8S PA 1819 31.541 21.262 31.889 1.00 0.00 H ATOM 75558 C17 PA 1819 32.076 20.549 30.010 1.00 0.00 C ATOM 75559 H7R PA 1819 32.446 20.986 29.080 1.00 0.00 H ATOM 75560 H7S PA 1819 31.019 20.387 29.791 1.00 0.00 H ATOM 75561 C16 PA 1819 32.714 19.211 30.314 1.00 0.00 C ATOM 75562 H6R PA 1819 32.235 18.874 31.236 1.00 0.00 H ATOM 75563 H6S PA 1819 33.762 19.421 30.534 1.00 0.00 H ATOM 75564 C15 PA 1819 32.668 18.269 29.158 1.00 0.00 C ATOM 75565 H5R PA 1819 33.531 18.449 28.514 1.00 0.00 H ATOM 75566 H5S PA 1819 31.761 18.511 28.601 1.00 0.00 H ATOM 75567 C14 PA 1819 32.573 16.731 29.412 1.00 0.00 C ATOM 75568 H4R PA 1819 31.611 16.331 29.741 1.00 0.00 H ATOM 75569 H4S PA 1819 33.306 16.463 30.175 1.00 0.00 H ATOM 75570 C13 PA 1819 33.104 15.862 28.307 1.00 0.00 C ATOM 75571 H3R PA 1819 34.033 16.231 27.867 1.00 0.00 H ATOM 75572 H3S PA 1819 32.451 15.929 27.434 1.00 0.00 H ATOM 75573 C12 PA 1819 33.181 14.350 28.660 1.00 0.00 C ATOM 75574 H2R PA 1819 32.184 13.959 28.874 1.00 0.00 H ATOM 75575 H2S PA 1819 33.822 14.108 29.510 1.00 0.00 H ATOM 75576 C11 PC 1820 33.770 13.742 27.435 1.00 0.00 C ATOM 75577 O12 PC 1820 34.815 14.065 26.870 1.00 0.00 O ATOM 75578 O11 PC 1820 33.085 12.687 26.960 1.00 0.00 O ATOM 75579 C1 PC 1820 33.632 12.070 25.782 1.00 0.00 C ATOM 75580 HR PC 1820 34.567 11.581 26.065 1.00 0.00 H ATOM 75581 HS PC 1820 33.807 12.886 25.076 1.00 0.00 H ATOM 75582 C2 PC 1820 32.626 11.035 25.306 1.00 0.00 C ATOM 75583 HX PC 1820 33.159 10.445 24.556 1.00 0.00 H ATOM 75584 C3 PC 1820 31.314 11.615 24.968 1.00 0.00 C ATOM 75585 HA PC 1820 31.567 12.550 24.461 1.00 0.00 H ATOM 75586 HB PC 1820 30.759 11.838 25.882 1.00 0.00 H ATOM 75587 O31 PC 1820 30.511 10.778 24.134 1.00 0.00 O ATOM 75588 P31 PC 1820 30.866 10.605 22.589 1.00 0.00 P ATOM 75589 O32 PC 1820 32.004 9.496 22.729 1.00 0.00 O ATOM 75590 C31 PC 1820 31.668 8.241 23.318 1.00 0.00 C ATOM 75591 H1A PC 1820 30.709 7.861 22.957 1.00 0.00 H ATOM 75592 H1B PC 1820 31.593 8.381 24.400 1.00 0.00 H ATOM 75593 C32 PC 1820 32.762 7.238 22.806 1.00 0.00 C ATOM 75594 H2A PC 1820 33.793 7.588 22.867 1.00 0.00 H ATOM 75595 H2B PC 1820 32.464 7.075 21.769 1.00 0.00 H ATOM 75596 N31 PC 1820 32.836 5.889 23.419 1.00 0.00 N ATOM 75597 C33 PC 1820 34.070 5.210 22.944 1.00 0.00 C ATOM 75598 H3A PC 1820 34.093 4.207 23.374 1.00 0.00 H ATOM 75599 H3B PC 1820 34.994 5.673 23.295 1.00 0.00 H ATOM 75600 H3C PC 1820 34.089 5.155 21.855 1.00 0.00 H ATOM 75601 C34 PC 1820 32.861 5.888 24.919 1.00 0.00 C ATOM 75602 H4A PC 1820 31.988 6.368 25.364 1.00 0.00 H ATOM 75603 H4B PC 1820 33.842 6.312 25.138 1.00 0.00 H ATOM 75604 H4C PC 1820 32.891 4.851 25.257 1.00 0.00 H ATOM 75605 C35 PC 1820 31.619 5.070 23.018 1.00 0.00 C ATOM 75606 H5A PC 1820 31.617 4.101 23.520 1.00 0.00 H ATOM 75607 H5B PC 1820 31.544 5.035 21.930 1.00 0.00 H ATOM 75608 H5C PC 1820 30.726 5.634 23.290 1.00 0.00 H ATOM 75609 O33 PC 1820 29.743 9.999 21.820 1.00 0.00 O ATOM 75610 O34 PC 1820 31.537 11.786 22.001 1.00 0.00 O ATOM 75611 O21 PC 1820 32.368 10.148 26.379 1.00 0.00 O ATOM 75612 C21 PC 1820 33.234 9.139 26.649 1.00 0.00 C ATOM 75613 O22 PC 1820 34.144 8.719 25.946 1.00 0.00 O ATOM 75614 C12 OL 1821 32.866 8.596 27.944 1.00 0.00 C ATOM 75615 H2R OL 1821 32.195 9.252 28.501 1.00 0.00 H ATOM 75616 H2S OL 1821 32.205 7.752 27.736 1.00 0.00 H ATOM 75617 C13 OL 1821 34.080 8.347 28.978 1.00 0.00 C ATOM 75618 H3R OL 1821 34.605 9.300 29.069 1.00 0.00 H ATOM 75619 H3S OL 1821 33.563 8.269 29.936 1.00 0.00 H ATOM 75620 C14 OL 1821 35.134 7.257 28.631 1.00 0.00 C ATOM 75621 H4R OL 1821 34.604 6.340 28.365 1.00 0.00 H ATOM 75622 H4S OL 1821 35.578 7.391 27.642 1.00 0.00 H ATOM 75623 C15 OL 1821 36.281 7.228 29.658 1.00 0.00 C ATOM 75624 H5R OL 1821 37.036 6.691 29.079 1.00 0.00 H ATOM 75625 H5S OL 1821 36.772 8.202 29.715 1.00 0.00 H ATOM 75626 C16 OL 1821 35.950 6.548 30.887 1.00 0.00 C ATOM 75627 H6R OL 1821 35.157 7.135 31.354 1.00 0.00 H ATOM 75628 H6S OL 1821 35.564 5.554 30.651 1.00 0.00 H ATOM 75629 C17 OL 1821 37.153 6.519 31.888 1.00 0.00 C ATOM 75630 H7R OL 1821 37.557 7.527 31.998 1.00 0.00 H ATOM 75631 H7S OL 1821 36.831 6.176 32.873 1.00 0.00 H ATOM 75632 C18 OL 1821 38.327 5.634 31.368 1.00 0.00 C ATOM 75633 H8R OL 1821 37.856 4.828 30.801 1.00 0.00 H ATOM 75634 H8S OL 1821 38.911 6.138 30.595 1.00 0.00 H ATOM 75635 C19 OL 1821 39.223 5.001 32.457 1.00 0.00 C ATOM 75636 H9R OL 1821 39.179 5.454 33.444 1.00 0.00 H ATOM 75637 C110 OL 1821 40.062 4.021 32.187 1.00 0.00 C ATOM 75638 H10R OL 1821 40.623 3.609 33.022 1.00 0.00 H ATOM 75639 C111 OL 1821 40.430 3.386 30.890 1.00 0.00 C ATOM 75640 H11R OL 1821 40.094 3.878 29.975 1.00 0.00 H ATOM 75641 H11S OL 1821 41.517 3.386 30.788 1.00 0.00 H ATOM 75642 C112 OL 1821 40.054 1.878 30.755 1.00 0.00 C ATOM 75643 H12R OL 1821 39.012 1.791 31.072 1.00 0.00 H ATOM 75644 H12S OL 1821 40.208 1.557 29.723 1.00 0.00 H ATOM 75645 C113 OL 1821 40.883 1.021 31.702 1.00 0.00 C ATOM 75646 H13R OL 1821 41.943 1.279 31.750 1.00 0.00 H ATOM 75647 H13S OL 1821 40.445 1.051 32.701 1.00 0.00 H ATOM 75648 C114 OL 1821 40.798 -0.509 31.454 1.00 0.00 C ATOM 75649 H14R OL 1821 39.780 -0.757 31.147 1.00 0.00 H ATOM 75650 H14S OL 1821 41.452 -0.772 30.620 1.00 0.00 H ATOM 75651 C115 OL 1821 41.053 -1.416 32.714 1.00 0.00 C ATOM 75652 H15R OL 1821 41.940 -1.078 33.255 1.00 0.00 H ATOM 75653 H15S OL 1821 40.274 -1.251 33.461 1.00 0.00 H ATOM 75654 C116 OL 1821 41.205 -2.986 32.559 1.00 0.00 C ATOM 75655 H16R OL 1821 40.519 -3.490 31.874 1.00 0.00 H ATOM 75656 H16S OL 1821 42.210 -3.275 32.245 1.00 0.00 H ATOM 75657 C117 OL 1821 40.974 -3.719 33.840 1.00 0.00 C ATOM 75658 H17R OL 1821 41.829 -3.441 34.460 1.00 0.00 H ATOM 75659 H17S OL 1821 39.967 -3.441 34.159 1.00 0.00 H ATOM 75660 C118 OL 1821 40.978 -5.213 33.582 1.00 0.00 C ATOM 75661 H18R OL 1821 41.011 -5.903 34.428 1.00 0.00 H ATOM 75662 H18S OL 1821 41.870 -5.446 32.998 1.00 0.00 H ATOM 75663 H18T OL 1821 40.150 -5.524 32.942 1.00 0.00 H TER 75664 OL 1821 ATOM 75664 C116 PA 1822 117.586 123.238 41.478 1.00 0.00 C ATOM 75665 H16R PA 1822 116.553 123.525 41.682 1.00 0.00 H ATOM 75666 H16S PA 1822 118.189 123.918 42.083 1.00 0.00 H ATOM 75667 H16T PA 1822 117.884 122.269 41.883 1.00 0.00 H ATOM 75668 C115 PA 1822 117.956 123.334 40.012 1.00 0.00 C ATOM 75669 H15R PA 1822 118.943 122.894 39.860 1.00 0.00 H ATOM 75670 H15S PA 1822 118.200 124.364 39.742 1.00 0.00 H ATOM 75671 C114 PA 1822 117.011 122.590 39.078 1.00 0.00 C ATOM 75672 H14R PA 1822 117.023 123.064 38.094 1.00 0.00 H ATOM 75673 H14S PA 1822 115.979 122.722 39.410 1.00 0.00 H ATOM 75674 C113 PA 1822 117.300 121.144 38.849 1.00 0.00 C ATOM 75675 H13R PA 1822 117.336 120.537 39.755 1.00 0.00 H ATOM 75676 H13S PA 1822 118.324 121.008 38.494 1.00 0.00 H ATOM 75677 C112 PA 1822 116.402 120.506 37.751 1.00 0.00 C ATOM 75678 H12R PA 1822 116.784 119.519 37.481 1.00 0.00 H ATOM 75679 H12S PA 1822 116.329 121.122 36.852 1.00 0.00 H ATOM 75680 C111 PA 1822 114.954 120.158 38.121 1.00 0.00 C ATOM 75681 H11R PA 1822 114.186 120.922 38.257 1.00 0.00 H ATOM 75682 H11S PA 1822 114.853 119.774 39.138 1.00 0.00 H ATOM 75683 C110 PA 1822 114.234 119.231 37.089 1.00 0.00 C ATOM 75684 H10R PA 1822 113.238 118.988 37.465 1.00 0.00 H ATOM 75685 H10S PA 1822 114.741 118.270 36.977 1.00 0.00 H ATOM 75686 C19 PA 1822 114.159 119.641 35.649 1.00 0.00 C ATOM 75687 H9R PA 1822 115.172 119.727 35.251 1.00 0.00 H ATOM 75688 H9S PA 1822 113.605 120.579 35.578 1.00 0.00 H ATOM 75689 C18 PA 1822 113.418 118.653 34.765 1.00 0.00 C ATOM 75690 H8R PA 1822 112.476 118.301 35.191 1.00 0.00 H ATOM 75691 H8S PA 1822 113.920 117.683 34.762 1.00 0.00 H ATOM 75692 C17 PA 1822 113.341 119.278 33.354 1.00 0.00 C ATOM 75693 H7R PA 1822 112.759 118.629 32.696 1.00 0.00 H ATOM 75694 H7S PA 1822 114.334 119.421 32.921 1.00 0.00 H ATOM 75695 C16 PA 1822 112.655 120.598 33.270 1.00 0.00 C ATOM 75696 H6R PA 1822 113.232 121.369 33.785 1.00 0.00 H ATOM 75697 H6S PA 1822 111.730 120.454 33.832 1.00 0.00 H ATOM 75698 C15 PA 1822 112.239 121.035 31.867 1.00 0.00 C ATOM 75699 H5R PA 1822 111.666 120.297 31.302 1.00 0.00 H ATOM 75700 H5S PA 1822 113.099 121.352 31.273 1.00 0.00 H ATOM 75701 C14 PA 1822 111.413 122.269 31.842 1.00 0.00 C ATOM 75702 H4R PA 1822 111.948 123.123 32.260 1.00 0.00 H ATOM 75703 H4S PA 1822 110.516 122.159 32.455 1.00 0.00 H ATOM 75704 C13 PA 1822 110.961 122.611 30.421 1.00 0.00 C ATOM 75705 H3R PA 1822 110.633 121.713 29.893 1.00 0.00 H ATOM 75706 H3S PA 1822 111.864 122.919 29.889 1.00 0.00 H ATOM 75707 C12 PA 1822 109.946 123.706 30.280 1.00 0.00 C ATOM 75708 H2R PA 1822 110.282 124.703 30.571 1.00 0.00 H ATOM 75709 H2S PA 1822 108.969 123.410 30.669 1.00 0.00 H ATOM 75710 C11 PGR 1823 109.542 123.872 28.785 1.00 0.00 C ATOM 75711 O12 PGR 1823 110.250 124.520 28.084 1.00 0.00 O ATOM 75712 O11 PGR 1823 108.388 123.291 28.419 1.00 0.00 O ATOM 75713 C1 PGR 1823 107.938 123.177 27.059 1.00 0.00 C ATOM 75714 HR PGR 1823 107.496 124.133 26.767 1.00 0.00 H ATOM 75715 HS PGR 1823 107.045 122.551 26.981 1.00 0.00 H ATOM 75716 C2 PGR 1823 109.069 122.662 26.094 1.00 0.00 C ATOM 75717 HX PGR 1823 109.995 123.241 26.096 1.00 0.00 H ATOM 75718 C3 PGR 1823 108.579 122.498 24.669 1.00 0.00 C ATOM 75719 HA PGR 1823 109.323 122.519 23.869 1.00 0.00 H ATOM 75720 HB PGR 1823 107.906 123.336 24.472 1.00 0.00 H ATOM 75721 O31 PGR 1823 107.758 121.326 24.431 1.00 0.00 O ATOM 75722 P31 PGR 1823 107.380 120.786 22.980 1.00 0.00 P ATOM 75723 O32 PGR 1823 107.132 119.263 23.238 1.00 0.00 O ATOM 75724 C31 PGR 1823 108.199 118.460 23.806 1.00 0.00 C ATOM 75725 H1A PGR 1823 109.186 118.514 23.340 1.00 0.00 H ATOM 75726 H1B PGR 1823 108.196 118.912 24.801 1.00 0.00 H ATOM 75727 C32 PGR 1823 107.847 116.963 24.005 1.00 0.00 C ATOM 75728 H2A PGR 1823 108.556 116.459 24.667 1.00 0.00 H ATOM 75729 O35 PGR 1823 107.893 116.233 22.703 1.00 0.00 O ATOM 75730 HO5A PGR 1823 107.723 115.304 22.944 1.00 0.00 H ATOM 75731 C33 PGR 1823 106.425 116.792 24.485 1.00 0.00 C ATOM 75732 H3A PGR 1823 106.305 117.369 25.406 1.00 0.00 H ATOM 75733 H3B PGR 1823 105.704 117.075 23.714 1.00 0.00 H ATOM 75734 O33 PGR 1823 106.235 121.497 22.475 1.00 0.00 O ATOM 75735 O34 PGR 1823 108.642 120.968 22.173 1.00 0.00 O ATOM 75736 O21 PGR 1823 109.462 121.425 26.665 1.00 0.00 O ATOM 75737 C21 PGR 1823 110.459 120.761 26.057 1.00 0.00 C ATOM 75738 O22 PGR 1823 111.145 121.313 25.242 1.00 0.00 O ATOM 75739 O36 PGR 1823 106.107 115.520 24.806 1.00 0.00 O ATOM 75740 HO6A PGR 1823 105.163 115.350 24.637 1.00 0.00 H ATOM 75741 C12 OL 1824 110.820 119.442 26.685 1.00 0.00 C ATOM 75742 H2R OL 1824 110.051 119.158 27.406 1.00 0.00 H ATOM 75743 H2S OL 1824 110.831 118.746 25.844 1.00 0.00 H ATOM 75744 C13 OL 1824 112.142 119.552 27.431 1.00 0.00 C ATOM 75745 H3R OL 1824 112.933 119.766 26.710 1.00 0.00 H ATOM 75746 H3S OL 1824 112.242 120.448 28.047 1.00 0.00 H ATOM 75747 C14 OL 1824 112.422 118.242 28.263 1.00 0.00 C ATOM 75748 H4R OL 1824 111.626 118.258 29.010 1.00 0.00 H ATOM 75749 H4S OL 1824 112.372 117.403 27.566 1.00 0.00 H ATOM 75750 C15 OL 1824 113.750 118.189 29.021 1.00 0.00 C ATOM 75751 H5R OL 1824 114.498 118.121 28.229 1.00 0.00 H ATOM 75752 H5S OL 1824 113.710 119.178 29.481 1.00 0.00 H ATOM 75753 C16 OL 1824 113.808 117.059 29.963 1.00 0.00 C ATOM 75754 H6R OL 1824 113.018 117.107 30.716 1.00 0.00 H ATOM 75755 H6S OL 1824 113.775 116.116 29.414 1.00 0.00 H ATOM 75756 C17 OL 1824 115.070 116.947 30.875 1.00 0.00 C ATOM 75757 H7R OL 1824 116.028 116.853 30.360 1.00 0.00 H ATOM 75758 H7S OL 1824 115.103 117.896 31.414 1.00 0.00 H ATOM 75759 C18 OL 1824 115.003 115.829 31.938 1.00 0.00 C ATOM 75760 H8R OL 1824 115.843 115.731 32.629 1.00 0.00 H ATOM 75761 H8S OL 1824 114.183 116.101 32.606 1.00 0.00 H ATOM 75762 C19 OL 1824 114.682 114.473 31.374 1.00 0.00 C ATOM 75763 H9R OL 1824 114.772 114.388 30.294 1.00 0.00 H ATOM 75764 C110 OL 1824 114.204 113.402 32.081 1.00 0.00 C ATOM 75765 H10R OL 1824 114.038 112.424 31.638 1.00 0.00 H ATOM 75766 C111 OL 1824 114.024 113.422 33.599 1.00 0.00 C ATOM 75767 H11R OL 1824 114.744 114.121 34.030 1.00 0.00 H ATOM 75768 H11S OL 1824 112.978 113.486 33.906 1.00 0.00 H ATOM 75769 C112 OL 1824 114.632 112.044 34.011 1.00 0.00 C ATOM 75770 H12R OL 1824 113.903 111.311 33.660 1.00 0.00 H ATOM 75771 H12S OL 1824 115.603 111.963 33.517 1.00 0.00 H ATOM 75772 C113 OL 1824 114.844 111.840 35.477 1.00 0.00 C ATOM 75773 H13R OL 1824 115.370 110.907 35.689 1.00 0.00 H ATOM 75774 H13S OL 1824 115.612 112.532 35.828 1.00 0.00 H ATOM 75775 C114 OL 1824 113.568 111.958 36.515 1.00 0.00 C ATOM 75776 H14R OL 1824 113.939 111.761 37.523 1.00 0.00 H ATOM 75777 H14S OL 1824 113.154 112.955 36.678 1.00 0.00 H ATOM 75778 C115 OL 1824 112.469 110.935 36.155 1.00 0.00 C ATOM 75779 H15R OL 1824 112.193 110.870 35.100 1.00 0.00 H ATOM 75780 H15S OL 1824 112.889 109.981 36.480 1.00 0.00 H ATOM 75781 C116 OL 1824 111.184 111.119 37.031 1.00 0.00 C ATOM 75782 H16R OL 1824 111.416 111.308 38.082 1.00 0.00 H ATOM 75783 H16S OL 1824 110.633 111.992 36.676 1.00 0.00 H ATOM 75784 C117 OL 1824 110.203 109.872 37.006 1.00 0.00 C ATOM 75785 H17R OL 1824 110.047 109.751 35.932 1.00 0.00 H ATOM 75786 H17S OL 1824 110.683 108.955 37.355 1.00 0.00 H ATOM 75787 C118 OL 1824 108.874 110.119 37.813 1.00 0.00 C ATOM 75788 H18R OL 1824 108.888 110.053 38.903 1.00 0.00 H ATOM 75789 H18S OL 1824 108.054 109.458 37.524 1.00 0.00 H ATOM 75790 H18T OL 1824 108.437 111.100 37.614 1.00 0.00 H TER 75791 OL 1824 ATOM 75791 C116 PA 1825 22.217 25.839 38.679 1.00 0.00 C ATOM 75792 H16R PA 1825 22.318 26.298 37.693 1.00 0.00 H ATOM 75793 H16S PA 1825 23.141 25.659 39.233 1.00 0.00 H ATOM 75794 H16T PA 1825 21.587 26.459 39.320 1.00 0.00 H ATOM 75795 C115 PA 1825 21.539 24.519 38.505 1.00 0.00 C ATOM 75796 H15R PA 1825 21.299 24.014 39.443 1.00 0.00 H ATOM 75797 H15S PA 1825 22.227 23.818 38.029 1.00 0.00 H ATOM 75798 C114 PA 1825 20.292 24.376 37.662 1.00 0.00 C ATOM 75799 H14R PA 1825 20.572 24.432 36.608 1.00 0.00 H ATOM 75800 H14S PA 1825 19.730 25.281 37.899 1.00 0.00 H ATOM 75801 C113 PA 1825 19.493 23.032 37.740 1.00 0.00 C ATOM 75802 H13R PA 1825 19.016 22.770 38.686 1.00 0.00 H ATOM 75803 H13S PA 1825 20.240 22.238 37.681 1.00 0.00 H ATOM 75804 C112 PA 1825 18.610 22.622 36.563 1.00 0.00 C ATOM 75805 H12R PA 1825 17.821 23.336 36.316 1.00 0.00 H ATOM 75806 H12S PA 1825 17.980 21.789 36.880 1.00 0.00 H ATOM 75807 C111 PA 1825 19.302 22.259 35.194 1.00 0.00 C ATOM 75808 H11R PA 1825 19.735 21.262 35.300 1.00 0.00 H ATOM 75809 H11S PA 1825 20.123 22.958 35.023 1.00 0.00 H ATOM 75810 C110 PA 1825 18.353 22.496 34.027 1.00 0.00 C ATOM 75811 H10R PA 1825 18.139 23.560 33.901 1.00 0.00 H ATOM 75812 H10S PA 1825 17.384 22.081 34.314 1.00 0.00 H ATOM 75813 C19 PA 1825 18.792 21.917 32.684 1.00 0.00 C ATOM 75814 H9R PA 1825 18.839 20.834 32.814 1.00 0.00 H ATOM 75815 H9S PA 1825 19.764 22.345 32.430 1.00 0.00 H ATOM 75816 C18 PA 1825 17.895 22.351 31.445 1.00 0.00 C ATOM 75817 H8R PA 1825 17.906 23.443 31.440 1.00 0.00 H ATOM 75818 H8S PA 1825 16.856 22.111 31.682 1.00 0.00 H ATOM 75819 C17 PA 1825 18.324 21.779 30.102 1.00 0.00 C ATOM 75820 H7R PA 1825 19.356 22.087 29.919 1.00 0.00 H ATOM 75821 H7S PA 1825 17.825 22.251 29.253 1.00 0.00 H ATOM 75822 C16 PA 1825 18.131 20.345 29.995 1.00 0.00 C ATOM 75823 H6R PA 1825 18.825 19.880 30.700 1.00 0.00 H ATOM 75824 H6S PA 1825 18.484 20.022 29.014 1.00 0.00 H ATOM 75825 C15 PA 1825 16.761 19.788 30.283 1.00 0.00 C ATOM 75826 H5R PA 1825 16.332 20.005 31.263 1.00 0.00 H ATOM 75827 H5S PA 1825 16.765 18.700 30.189 1.00 0.00 H ATOM 75828 C14 PA 1825 15.823 20.201 29.204 1.00 0.00 C ATOM 75829 H4R PA 1825 16.284 20.010 28.233 1.00 0.00 H ATOM 75830 H4S PA 1825 15.675 21.283 29.212 1.00 0.00 H ATOM 75831 C13 PA 1825 14.424 19.781 29.378 1.00 0.00 C ATOM 75832 H3R PA 1825 13.962 20.153 28.461 1.00 0.00 H ATOM 75833 H3S PA 1825 14.043 20.313 30.251 1.00 0.00 H ATOM 75834 C12 PA 1825 14.100 18.316 29.700 1.00 0.00 C ATOM 75835 H2R PA 1825 14.262 18.000 30.733 1.00 0.00 H ATOM 75836 H2S PA 1825 13.016 18.208 29.621 1.00 0.00 H ATOM 75837 C11 PGR 1826 14.611 17.321 28.713 1.00 0.00 C ATOM 75838 O12 PGR 1826 13.821 16.651 28.006 1.00 0.00 O ATOM 75839 O11 PGR 1826 15.986 17.299 28.537 1.00 0.00 O ATOM 75840 C1 PGR 1826 16.621 16.266 27.705 1.00 0.00 C ATOM 75841 HR PGR 1826 16.175 16.505 26.736 1.00 0.00 H ATOM 75842 HS PGR 1826 16.366 15.251 28.018 1.00 0.00 H ATOM 75843 C2 PGR 1826 18.177 16.570 27.534 1.00 0.00 C ATOM 75844 HX PGR 1826 18.283 17.567 27.100 1.00 0.00 H ATOM 75845 C3 PGR 1826 18.869 15.667 26.409 1.00 0.00 C ATOM 75846 HA PGR 1826 19.919 15.916 26.234 1.00 0.00 H ATOM 75847 HB PGR 1826 18.385 16.002 25.488 1.00 0.00 H ATOM 75848 O31 PGR 1826 18.604 14.268 26.469 1.00 0.00 O ATOM 75849 P31 PGR 1826 19.042 13.294 25.248 1.00 0.00 P ATOM 75850 O32 PGR 1826 20.546 13.019 25.553 1.00 0.00 O ATOM 75851 C31 PGR 1826 21.083 12.106 26.512 1.00 0.00 C ATOM 75852 H1A PGR 1826 20.585 11.142 26.382 1.00 0.00 H ATOM 75853 H1B PGR 1826 20.976 12.442 27.547 1.00 0.00 H ATOM 75854 C32 PGR 1826 22.618 11.963 26.054 1.00 0.00 C ATOM 75855 H2A PGR 1826 23.060 12.906 26.385 1.00 0.00 H ATOM 75856 O35 PGR 1826 22.732 11.981 24.647 1.00 0.00 O ATOM 75857 HO5A PGR 1826 22.342 12.816 24.332 1.00 0.00 H ATOM 75858 C33 PGR 1826 23.436 10.804 26.696 1.00 0.00 C ATOM 75859 H3A PGR 1826 24.470 11.032 26.426 1.00 0.00 H ATOM 75860 H3B PGR 1826 23.377 10.720 27.785 1.00 0.00 H ATOM 75861 O33 PGR 1826 18.292 12.019 25.312 1.00 0.00 O ATOM 75862 O34 PGR 1826 19.051 14.090 23.983 1.00 0.00 O ATOM 75863 O21 PGR 1826 18.776 16.405 28.837 1.00 0.00 O ATOM 75864 C21 PGR 1826 20.054 16.579 29.147 1.00 0.00 C ATOM 75865 O22 PGR 1826 20.926 17.046 28.470 1.00 0.00 O ATOM 75866 O36 PGR 1826 22.945 9.557 26.065 1.00 0.00 O ATOM 75867 HO6A PGR 1826 23.029 9.508 25.096 1.00 0.00 H ATOM 75868 C12 OL 1827 20.302 16.139 30.519 1.00 0.00 C ATOM 75869 H2R OL 1827 20.597 16.963 31.172 1.00 0.00 H ATOM 75870 H2S OL 1827 19.413 15.703 30.978 1.00 0.00 H ATOM 75871 C13 OL 1827 21.505 15.164 30.543 1.00 0.00 C ATOM 75872 H3R OL 1827 22.407 15.632 30.144 1.00 0.00 H ATOM 75873 H3S OL 1827 21.855 14.945 31.554 1.00 0.00 H ATOM 75874 C14 OL 1827 21.263 13.805 29.824 1.00 0.00 C ATOM 75875 H4R OL 1827 21.199 13.927 28.740 1.00 0.00 H ATOM 75876 H4S OL 1827 22.155 13.185 29.931 1.00 0.00 H ATOM 75877 C15 OL 1827 20.041 12.951 30.296 1.00 0.00 C ATOM 75878 H5R OL 1827 19.170 13.400 29.815 1.00 0.00 H ATOM 75879 H5S OL 1827 20.040 11.935 29.895 1.00 0.00 H ATOM 75880 C16 OL 1827 19.876 12.768 31.793 1.00 0.00 C ATOM 75881 H6R OL 1827 19.737 13.750 32.250 1.00 0.00 H ATOM 75882 H6S OL 1827 18.962 12.231 32.056 1.00 0.00 H ATOM 75883 C17 OL 1827 21.015 12.015 32.360 1.00 0.00 C ATOM 75884 H7R OL 1827 20.946 10.991 31.988 1.00 0.00 H ATOM 75885 H7S OL 1827 21.982 12.359 31.986 1.00 0.00 H ATOM 75886 C18 OL 1827 21.097 12.034 33.847 1.00 0.00 C ATOM 75887 H8R OL 1827 20.197 11.661 34.340 1.00 0.00 H ATOM 75888 H8S OL 1827 21.740 11.227 34.204 1.00 0.00 H ATOM 75889 C19 OL 1827 21.615 13.253 34.492 1.00 0.00 C ATOM 75890 H9R OL 1827 22.639 13.557 34.290 1.00 0.00 H ATOM 75891 C110 OL 1827 21.010 14.018 35.313 1.00 0.00 C ATOM 75892 H10R OL 1827 21.657 14.794 35.712 1.00 0.00 H ATOM 75893 C111 OL 1827 19.549 13.837 35.746 1.00 0.00 C ATOM 75894 H11R OL 1827 19.101 14.808 35.965 1.00 0.00 H ATOM 75895 H11S OL 1827 18.997 13.395 34.913 1.00 0.00 H ATOM 75896 C112 OL 1827 19.389 12.828 36.972 1.00 0.00 C ATOM 75897 H12R OL 1827 18.350 12.822 37.309 1.00 0.00 H ATOM 75898 H12S OL 1827 19.688 11.862 36.559 1.00 0.00 H ATOM 75899 C113 OL 1827 20.229 13.226 38.197 1.00 0.00 C ATOM 75900 H13R OL 1827 21.276 13.088 37.921 1.00 0.00 H ATOM 75901 H13S OL 1827 20.006 14.261 38.465 1.00 0.00 H ATOM 75902 C114 OL 1827 19.967 12.385 39.375 1.00 0.00 C ATOM 75903 H14R OL 1827 18.908 12.547 39.589 1.00 0.00 H ATOM 75904 H14S OL 1827 20.108 11.348 39.065 1.00 0.00 H ATOM 75905 C115 OL 1827 20.742 12.713 40.632 1.00 0.00 C ATOM 75906 H15R OL 1827 21.806 12.610 40.408 1.00 0.00 H ATOM 75907 H15S OL 1827 20.749 13.733 41.020 1.00 0.00 H ATOM 75908 C116 OL 1827 20.367 11.846 41.828 1.00 0.00 C ATOM 75909 H16R OL 1827 20.809 12.263 42.735 1.00 0.00 H ATOM 75910 H16S OL 1827 19.288 11.862 42.000 1.00 0.00 H ATOM 75911 C117 OL 1827 20.891 10.384 41.713 1.00 0.00 C ATOM 75912 H17R OL 1827 20.534 9.885 40.810 1.00 0.00 H ATOM 75913 H17S OL 1827 21.971 10.257 41.622 1.00 0.00 H ATOM 75914 C118 OL 1827 20.501 9.518 42.940 1.00 0.00 C ATOM 75915 H18R OL 1827 19.427 9.661 43.076 1.00 0.00 H ATOM 75916 H18S OL 1827 21.057 9.770 43.845 1.00 0.00 H ATOM 75917 H18T OL 1827 20.701 8.450 42.839 1.00 0.00 H TER 75918 OL 1827 ATOM 75918 C116 PA 1828 62.976 128.427 31.609 1.00 0.00 C ATOM 75919 H16R PA 1828 62.263 128.016 30.891 1.00 0.00 H ATOM 75920 H16S PA 1828 62.272 128.646 32.414 1.00 0.00 H ATOM 75921 H16T PA 1828 63.497 127.545 31.989 1.00 0.00 H ATOM 75922 C115 PA 1828 63.703 129.466 30.785 1.00 0.00 C ATOM 75923 H15R PA 1828 64.446 129.032 30.113 1.00 0.00 H ATOM 75924 H15S PA 1828 64.345 130.070 31.428 1.00 0.00 H ATOM 75925 C114 PA 1828 62.790 130.280 30.070 1.00 0.00 C ATOM 75926 H14R PA 1828 62.175 129.681 29.394 1.00 0.00 H ATOM 75927 H14S PA 1828 63.424 130.895 29.428 1.00 0.00 H ATOM 75928 C113 PA 1828 61.980 131.206 30.987 1.00 0.00 C ATOM 75929 H13R PA 1828 62.501 131.739 31.785 1.00 0.00 H ATOM 75930 H13S PA 1828 61.194 130.613 31.459 1.00 0.00 H ATOM 75931 C112 PA 1828 61.164 132.243 30.188 1.00 0.00 C ATOM 75932 H12R PA 1828 60.300 132.609 30.747 1.00 0.00 H ATOM 75933 H12S PA 1828 60.733 131.850 29.265 1.00 0.00 H ATOM 75934 C111 PA 1828 61.978 133.512 29.860 1.00 0.00 C ATOM 75935 H11R PA 1828 62.662 133.258 29.047 1.00 0.00 H ATOM 75936 H11S PA 1828 62.680 133.885 30.609 1.00 0.00 H ATOM 75937 C110 PA 1828 61.178 134.665 29.256 1.00 0.00 C ATOM 75938 H10R PA 1828 60.290 134.725 29.889 1.00 0.00 H ATOM 75939 H10S PA 1828 60.824 134.318 28.283 1.00 0.00 H ATOM 75940 C19 PA 1828 61.876 136.034 29.272 1.00 0.00 C ATOM 75941 H9R PA 1828 62.151 136.165 30.320 1.00 0.00 H ATOM 75942 H9S PA 1828 61.195 136.874 29.123 1.00 0.00 H ATOM 75943 C18 PA 1828 63.149 136.157 28.461 1.00 0.00 C ATOM 75944 H8R PA 1828 62.880 136.070 27.406 1.00 0.00 H ATOM 75945 H8S PA 1828 63.833 135.314 28.579 1.00 0.00 H ATOM 75946 C17 PA 1828 63.876 137.451 28.614 1.00 0.00 C ATOM 75947 H7R PA 1828 64.110 137.665 29.659 1.00 0.00 H ATOM 75948 H7S PA 1828 63.209 138.240 28.259 1.00 0.00 H ATOM 75949 C16 PA 1828 65.153 137.681 27.793 1.00 0.00 C ATOM 75950 H6R PA 1828 65.069 137.235 26.800 1.00 0.00 H ATOM 75951 H6S PA 1828 65.969 137.059 28.166 1.00 0.00 H ATOM 75952 C15 PA 1828 65.573 139.159 27.589 1.00 0.00 C ATOM 75953 H5R PA 1828 66.540 139.226 27.088 1.00 0.00 H ATOM 75954 H5S PA 1828 65.790 139.594 28.567 1.00 0.00 H ATOM 75955 C14 PA 1828 64.532 140.142 26.969 1.00 0.00 C ATOM 75956 H4R PA 1828 64.998 141.126 27.059 1.00 0.00 H ATOM 75957 H4S PA 1828 63.658 140.322 27.598 1.00 0.00 H ATOM 75958 C13 PA 1828 64.231 139.855 25.509 1.00 0.00 C ATOM 75959 H3R PA 1828 63.694 138.910 25.403 1.00 0.00 H ATOM 75960 H3S PA 1828 65.088 139.845 24.832 1.00 0.00 H ATOM 75961 C12 PA 1828 63.420 140.865 24.780 1.00 0.00 C ATOM 75962 H2R PA 1828 63.772 141.859 25.061 1.00 0.00 H ATOM 75963 H2S PA 1828 62.435 140.824 25.250 1.00 0.00 H ATOM 75964 C11 PC 1829 63.504 140.422 23.332 1.00 0.00 C ATOM 75965 O12 PC 1829 64.074 141.149 22.533 1.00 0.00 O ATOM 75966 O11 PC 1829 62.765 139.380 23.095 1.00 0.00 O ATOM 75967 C1 PC 1829 62.516 138.870 21.685 1.00 0.00 C ATOM 75968 HR PC 1829 62.159 139.709 21.083 1.00 0.00 H ATOM 75969 HS PC 1829 61.725 138.117 21.659 1.00 0.00 H ATOM 75970 C2 PC 1829 63.730 138.132 21.069 1.00 0.00 C ATOM 75971 HX PC 1829 64.649 138.647 21.363 1.00 0.00 H ATOM 75972 C3 PC 1829 63.815 138.156 19.509 1.00 0.00 C ATOM 75973 HA PC 1829 64.618 137.531 19.111 1.00 0.00 H ATOM 75974 HB PC 1829 63.941 139.181 19.150 1.00 0.00 H ATOM 75975 O31 PC 1829 62.562 137.682 19.011 1.00 0.00 O ATOM 75976 P31 PC 1829 62.363 137.758 17.474 1.00 0.00 P ATOM 75977 O32 PC 1829 62.841 139.234 17.096 1.00 0.00 O ATOM 75978 C31 PC 1829 62.007 140.291 17.352 1.00 0.00 C ATOM 75979 H1A PC 1829 62.068 140.647 18.383 1.00 0.00 H ATOM 75980 H1B PC 1829 60.962 140.009 17.204 1.00 0.00 H ATOM 75981 C32 PC 1829 62.360 141.317 16.308 1.00 0.00 C ATOM 75982 H2A PC 1829 62.330 140.831 15.331 1.00 0.00 H ATOM 75983 H2B PC 1829 63.401 141.502 16.576 1.00 0.00 H ATOM 75984 N31 PC 1829 61.543 142.515 16.189 1.00 0.00 N ATOM 75985 C33 PC 1829 62.190 143.297 15.060 1.00 0.00 C ATOM 75986 H3A PC 1829 62.046 142.667 14.181 1.00 0.00 H ATOM 75987 H3B PC 1829 63.257 143.387 15.274 1.00 0.00 H ATOM 75988 H3C PC 1829 61.610 144.187 14.810 1.00 0.00 H ATOM 75989 C34 PC 1829 60.123 142.331 16.018 1.00 0.00 C ATOM 75990 H4A PC 1829 59.930 141.818 15.075 1.00 0.00 H ATOM 75991 H4B PC 1829 59.722 143.319 15.786 1.00 0.00 H ATOM 75992 H4C PC 1829 59.612 141.826 16.839 1.00 0.00 H ATOM 75993 C35 PC 1829 61.694 143.344 17.346 1.00 0.00 C ATOM 75994 H5A PC 1829 61.074 144.240 17.302 1.00 0.00 H ATOM 75995 H5B PC 1829 62.758 143.528 17.499 1.00 0.00 H ATOM 75996 H5C PC 1829 61.251 142.729 18.132 1.00 0.00 H ATOM 75997 O33 PC 1829 63.365 136.838 16.973 1.00 0.00 O ATOM 75998 O34 PC 1829 60.971 137.513 17.096 1.00 0.00 O ATOM 75999 O21 PC 1829 63.674 136.718 21.424 1.00 0.00 O ATOM 76000 C21 PC 1829 63.986 136.202 22.629 1.00 0.00 C ATOM 76001 O22 PC 1829 64.765 136.613 23.450 1.00 0.00 O ATOM 76002 C12 OL 1830 63.307 134.920 22.867 1.00 0.00 C ATOM 76003 H2R OL 1830 62.327 134.944 22.387 1.00 0.00 H ATOM 76004 H2S OL 1830 63.815 134.138 22.298 1.00 0.00 H ATOM 76005 C13 OL 1830 63.195 134.531 24.289 1.00 0.00 C ATOM 76006 H3R OL 1830 64.194 134.665 24.707 1.00 0.00 H ATOM 76007 H3S OL 1830 62.634 135.278 24.854 1.00 0.00 H ATOM 76008 C14 OL 1830 62.753 133.126 24.681 1.00 0.00 C ATOM 76009 H4R OL 1830 61.704 133.080 24.380 1.00 0.00 H ATOM 76010 H4S OL 1830 63.226 132.413 24.004 1.00 0.00 H ATOM 76011 C15 OL 1830 62.798 132.861 26.149 1.00 0.00 C ATOM 76012 H5R OL 1830 63.837 133.084 26.401 1.00 0.00 H ATOM 76013 H5S OL 1830 62.181 133.570 26.705 1.00 0.00 H ATOM 76014 C16 OL 1830 62.442 131.416 26.567 1.00 0.00 C ATOM 76015 H6R OL 1830 63.096 130.756 25.993 1.00 0.00 H ATOM 76016 H6S OL 1830 62.662 131.208 27.616 1.00 0.00 H ATOM 76017 C17 OL 1830 60.952 130.954 26.283 1.00 0.00 C ATOM 76018 H7R OL 1830 60.465 131.690 26.927 1.00 0.00 H ATOM 76019 H7S OL 1830 60.728 131.100 25.225 1.00 0.00 H ATOM 76020 C18 OL 1830 60.606 129.523 26.883 1.00 0.00 C ATOM 76021 H8R OL 1830 61.421 128.796 26.893 1.00 0.00 H ATOM 76022 H8S OL 1830 60.144 129.664 27.862 1.00 0.00 H ATOM 76023 C19 OL 1830 59.515 128.944 26.041 1.00 0.00 C ATOM 76024 H9R OL 1830 59.622 128.857 24.963 1.00 0.00 H ATOM 76025 C110 OL 1830 58.322 128.475 26.505 1.00 0.00 C ATOM 76026 H10R OL 1830 57.596 128.003 25.849 1.00 0.00 H ATOM 76027 C111 OL 1830 57.755 128.493 27.849 1.00 0.00 C ATOM 76028 H11R OL 1830 57.949 127.474 28.192 1.00 0.00 H ATOM 76029 H11S OL 1830 58.328 129.177 28.478 1.00 0.00 H ATOM 76030 C112 OL 1830 56.247 128.727 27.815 1.00 0.00 C ATOM 76031 H12R OL 1830 55.773 128.165 27.007 1.00 0.00 H ATOM 76032 H12S OL 1830 55.773 128.219 28.658 1.00 0.00 H ATOM 76033 C113 OL 1830 55.755 130.192 27.732 1.00 0.00 C ATOM 76034 H13R OL 1830 55.927 130.555 26.717 1.00 0.00 H ATOM 76035 H13S OL 1830 54.704 130.018 27.971 1.00 0.00 H ATOM 76036 C114 OL 1830 56.487 131.197 28.696 1.00 0.00 C ATOM 76037 H14R OL 1830 56.250 130.930 29.728 1.00 0.00 H ATOM 76038 H14S OL 1830 57.576 131.222 28.619 1.00 0.00 H ATOM 76039 C115 OL 1830 55.933 132.633 28.466 1.00 0.00 C ATOM 76040 H15R OL 1830 55.850 132.698 27.379 1.00 0.00 H ATOM 76041 H15S OL 1830 54.938 132.807 28.880 1.00 0.00 H ATOM 76042 C116 OL 1830 56.917 133.691 28.942 1.00 0.00 C ATOM 76043 H16R OL 1830 57.082 133.497 30.004 1.00 0.00 H ATOM 76044 H16S OL 1830 57.888 133.506 28.477 1.00 0.00 H ATOM 76045 C117 OL 1830 56.485 135.193 28.986 1.00 0.00 C ATOM 76046 H17R OL 1830 56.520 135.590 27.970 1.00 0.00 H ATOM 76047 H17S OL 1830 55.399 135.171 29.098 1.00 0.00 H ATOM 76048 C118 OL 1830 57.301 136.111 29.947 1.00 0.00 C ATOM 76049 H18R OL 1830 57.407 135.680 30.945 1.00 0.00 H ATOM 76050 H18S OL 1830 56.699 136.999 30.152 1.00 0.00 H ATOM 76051 H18T OL 1830 58.250 136.502 29.574 1.00 0.00 H TER 76052 OL 1830 ATOM 76052 C116 PA 1831 92.971 138.875 35.584 1.00 0.00 C ATOM 76053 H16R PA 1831 92.838 139.139 36.635 1.00 0.00 H ATOM 76054 H16S PA 1831 93.587 139.663 35.145 1.00 0.00 H ATOM 76055 H16T PA 1831 93.514 137.934 35.476 1.00 0.00 H ATOM 76056 C115 PA 1831 91.667 138.576 34.782 1.00 0.00 C ATOM 76057 H15R PA 1831 91.122 139.497 34.564 1.00 0.00 H ATOM 76058 H15S PA 1831 91.086 137.962 35.473 1.00 0.00 H ATOM 76059 C114 PA 1831 91.940 137.810 33.530 1.00 0.00 C ATOM 76060 H14R PA 1831 92.605 136.967 33.731 1.00 0.00 H ATOM 76061 H14S PA 1831 92.544 138.492 32.927 1.00 0.00 H ATOM 76062 C113 PA 1831 90.666 137.334 32.792 1.00 0.00 C ATOM 76063 H13R PA 1831 90.970 136.860 31.857 1.00 0.00 H ATOM 76064 H13S PA 1831 90.076 138.176 32.424 1.00 0.00 H ATOM 76065 C112 PA 1831 89.779 136.498 33.651 1.00 0.00 C ATOM 76066 H12R PA 1831 88.924 136.167 33.057 1.00 0.00 H ATOM 76067 H12S PA 1831 89.295 136.969 34.508 1.00 0.00 H ATOM 76068 C111 PA 1831 90.397 135.219 34.185 1.00 0.00 C ATOM 76069 H11R PA 1831 91.122 135.559 34.928 1.00 0.00 H ATOM 76070 H11S PA 1831 90.935 134.742 33.363 1.00 0.00 H ATOM 76071 C110 PA 1831 89.473 134.058 34.570 1.00 0.00 C ATOM 76072 H10R PA 1831 88.732 134.438 35.276 1.00 0.00 H ATOM 76073 H10S PA 1831 90.011 133.247 35.066 1.00 0.00 H ATOM 76074 C19 PA 1831 88.785 133.457 33.457 1.00 0.00 C ATOM 76075 H9R PA 1831 89.403 133.068 32.646 1.00 0.00 H ATOM 76076 H9S PA 1831 88.212 134.161 32.850 1.00 0.00 H ATOM 76077 C18 PA 1831 87.963 132.271 33.852 1.00 0.00 C ATOM 76078 H8R PA 1831 87.222 132.656 34.555 1.00 0.00 H ATOM 76079 H8S PA 1831 88.546 131.501 34.361 1.00 0.00 H ATOM 76080 C17 PA 1831 87.047 131.697 32.760 1.00 0.00 C ATOM 76081 H7R PA 1831 86.444 132.356 32.131 1.00 0.00 H ATOM 76082 H7S PA 1831 86.308 130.964 33.092 1.00 0.00 H ATOM 76083 C16 PA 1831 87.971 131.069 31.654 1.00 0.00 C ATOM 76084 H6R PA 1831 88.670 130.369 32.116 1.00 0.00 H ATOM 76085 H6S PA 1831 88.614 131.868 31.281 1.00 0.00 H ATOM 76086 C15 PA 1831 87.350 130.177 30.518 1.00 0.00 C ATOM 76087 H5R PA 1831 86.669 130.805 29.941 1.00 0.00 H ATOM 76088 H5S PA 1831 86.730 129.453 31.052 1.00 0.00 H ATOM 76089 C14 PA 1831 88.379 129.463 29.538 1.00 0.00 C ATOM 76090 H4R PA 1831 88.748 130.373 29.061 1.00 0.00 H ATOM 76091 H4S PA 1831 87.859 128.854 28.795 1.00 0.00 H ATOM 76092 C13 PA 1831 89.435 128.614 30.195 1.00 0.00 C ATOM 76093 H3R PA 1831 88.981 127.856 30.838 1.00 0.00 H ATOM 76094 H3S PA 1831 90.058 129.274 30.803 1.00 0.00 H ATOM 76095 C12 PA 1831 90.373 127.872 29.255 1.00 0.00 C ATOM 76096 H2R PA 1831 91.271 127.513 29.762 1.00 0.00 H ATOM 76097 H2S PA 1831 90.764 128.575 28.517 1.00 0.00 H ATOM 76098 C11 PC 1832 89.819 126.745 28.573 1.00 0.00 C ATOM 76099 O12 PC 1832 89.227 126.880 27.528 1.00 0.00 O ATOM 76100 O11 PC 1832 90.008 125.615 29.251 1.00 0.00 O ATOM 76101 C1 PC 1832 89.746 124.337 28.527 1.00 0.00 C ATOM 76102 HR PC 1832 88.733 124.409 28.124 1.00 0.00 H ATOM 76103 HS PC 1832 89.840 123.483 29.203 1.00 0.00 H ATOM 76104 C2 PC 1832 90.720 124.225 27.372 1.00 0.00 C ATOM 76105 HX PC 1832 91.079 125.157 26.928 1.00 0.00 H ATOM 76106 C3 PC 1832 90.174 123.199 26.372 1.00 0.00 C ATOM 76107 HA PC 1832 89.094 123.326 26.260 1.00 0.00 H ATOM 76108 HB PC 1832 90.418 122.168 26.639 1.00 0.00 H ATOM 76109 O31 PC 1832 90.693 123.509 25.074 1.00 0.00 O ATOM 76110 P31 PC 1832 90.265 122.613 23.798 1.00 0.00 P ATOM 76111 O32 PC 1832 88.943 123.201 23.442 1.00 0.00 O ATOM 76112 C31 PC 1832 88.840 124.250 22.492 1.00 0.00 C ATOM 76113 H1A PC 1832 89.198 123.959 21.501 1.00 0.00 H ATOM 76114 H1B PC 1832 89.401 125.147 22.770 1.00 0.00 H ATOM 76115 C32 PC 1832 87.377 124.599 22.494 1.00 0.00 C ATOM 76116 H2A PC 1832 87.097 124.751 23.537 1.00 0.00 H ATOM 76117 H2B PC 1832 86.861 123.724 22.099 1.00 0.00 H ATOM 76118 N31 PC 1832 86.851 125.762 21.670 1.00 0.00 N ATOM 76119 C33 PC 1832 85.430 126.275 22.017 1.00 0.00 C ATOM 76120 H3A PC 1832 85.313 127.102 21.316 1.00 0.00 H ATOM 76121 H3B PC 1832 85.332 126.730 23.004 1.00 0.00 H ATOM 76122 H3C PC 1832 84.680 125.497 21.866 1.00 0.00 H ATOM 76123 C34 PC 1832 87.760 126.953 21.781 1.00 0.00 C ATOM 76124 H4A PC 1832 88.683 126.863 21.206 1.00 0.00 H ATOM 76125 H4B PC 1832 88.054 127.118 22.819 1.00 0.00 H ATOM 76126 H4C PC 1832 87.243 127.881 21.533 1.00 0.00 H ATOM 76127 C35 PC 1832 86.762 125.428 20.226 1.00 0.00 C ATOM 76128 H5A PC 1832 86.116 126.158 19.737 1.00 0.00 H ATOM 76129 H5B PC 1832 86.194 124.500 20.145 1.00 0.00 H ATOM 76130 H5C PC 1832 87.698 125.378 19.667 1.00 0.00 H ATOM 76131 O33 PC 1832 91.193 122.918 22.752 1.00 0.00 O ATOM 76132 O34 PC 1832 90.114 121.191 24.153 1.00 0.00 O ATOM 76133 O21 PC 1832 91.859 123.687 28.118 1.00 0.00 O ATOM 76134 C21 PC 1832 93.120 123.703 27.590 1.00 0.00 C ATOM 76135 O22 PC 1832 93.445 124.337 26.629 1.00 0.00 O ATOM 76136 C12 OL 1833 94.008 122.845 28.497 1.00 0.00 C ATOM 76137 H2R OL 1833 94.842 122.496 27.885 1.00 0.00 H ATOM 76138 H2S OL 1833 94.276 123.576 29.264 1.00 0.00 H ATOM 76139 C13 OL 1833 93.368 121.708 29.312 1.00 0.00 C ATOM 76140 H3R OL 1833 92.855 121.997 30.232 1.00 0.00 H ATOM 76141 H3S OL 1833 92.654 121.036 28.833 1.00 0.00 H ATOM 76142 C14 OL 1833 94.468 120.738 29.807 1.00 0.00 C ATOM 76143 H4R OL 1833 95.467 121.176 29.868 1.00 0.00 H ATOM 76144 H4S OL 1833 94.156 120.481 30.821 1.00 0.00 H ATOM 76145 C15 OL 1833 94.525 119.590 28.689 1.00 0.00 C ATOM 76146 H5R OL 1833 93.533 119.143 28.594 1.00 0.00 H ATOM 76147 H5S OL 1833 94.788 120.004 27.714 1.00 0.00 H ATOM 76148 C16 OL 1833 95.511 118.444 29.128 1.00 0.00 C ATOM 76149 H6R OL 1833 95.332 117.664 28.386 1.00 0.00 H ATOM 76150 H6S OL 1833 96.554 118.634 28.868 1.00 0.00 H ATOM 76151 C17 OL 1833 95.443 117.964 30.553 1.00 0.00 C ATOM 76152 H7R OL 1833 95.943 116.994 30.541 1.00 0.00 H ATOM 76153 H7S OL 1833 95.944 118.641 31.248 1.00 0.00 H ATOM 76154 C18 OL 1833 93.931 117.780 31.104 1.00 0.00 C ATOM 76155 H8R OL 1833 93.332 118.689 31.016 1.00 0.00 H ATOM 76156 H8S OL 1833 93.412 117.155 30.375 1.00 0.00 H ATOM 76157 C19 OL 1833 93.912 117.203 32.427 1.00 0.00 C ATOM 76158 H9R OL 1833 94.813 117.313 33.024 1.00 0.00 H ATOM 76159 C110 OL 1833 92.996 116.331 32.977 1.00 0.00 C ATOM 76160 H10R OL 1833 93.145 115.987 33.997 1.00 0.00 H ATOM 76161 C111 OL 1833 91.704 115.793 32.318 1.00 0.00 C ATOM 76162 H11R OL 1833 91.678 115.970 31.241 1.00 0.00 H ATOM 76163 H11S OL 1833 91.571 114.721 32.475 1.00 0.00 H ATOM 76164 C112 OL 1833 90.342 116.391 32.851 1.00 0.00 C ATOM 76165 H12R OL 1833 89.607 115.872 32.233 1.00 0.00 H ATOM 76166 H12S OL 1833 90.064 116.157 33.881 1.00 0.00 H ATOM 76167 C113 OL 1833 90.152 117.882 32.492 1.00 0.00 C ATOM 76168 H13R OL 1833 90.769 118.493 33.154 1.00 0.00 H ATOM 76169 H13S OL 1833 90.462 118.038 31.457 1.00 0.00 H ATOM 76170 C114 OL 1833 88.710 118.373 32.725 1.00 0.00 C ATOM 76171 H14R OL 1833 88.000 117.671 32.283 1.00 0.00 H ATOM 76172 H14S OL 1833 88.501 118.313 33.795 1.00 0.00 H ATOM 76173 C115 OL 1833 88.433 119.859 32.313 1.00 0.00 C ATOM 76174 H15R OL 1833 88.336 119.894 31.226 1.00 0.00 H ATOM 76175 H15S OL 1833 87.453 120.173 32.679 1.00 0.00 H ATOM 76176 C116 OL 1833 89.486 120.963 32.871 1.00 0.00 C ATOM 76177 H16R OL 1833 89.646 120.824 33.942 1.00 0.00 H ATOM 76178 H16S OL 1833 90.504 120.767 32.528 1.00 0.00 H ATOM 76179 C117 OL 1833 89.042 122.399 32.584 1.00 0.00 C ATOM 76180 H17R OL 1833 88.665 122.475 31.562 1.00 0.00 H ATOM 76181 H17S OL 1833 88.309 122.467 33.390 1.00 0.00 H ATOM 76182 C118 OL 1833 90.093 123.524 32.720 1.00 0.00 C ATOM 76183 H18R OL 1833 90.478 123.671 33.731 1.00 0.00 H ATOM 76184 H18S OL 1833 89.596 124.431 32.371 1.00 0.00 H ATOM 76185 H18T OL 1833 90.975 123.273 32.127 1.00 0.00 H TER 76186 OL 1833 ATOM 76186 C116 PA 1834 60.662 25.020 41.802 1.00 0.00 C ATOM 76187 H16R PA 1834 60.015 24.905 42.674 1.00 0.00 H ATOM 76188 H16S PA 1834 60.014 24.820 40.946 1.00 0.00 H ATOM 76189 H16T PA 1834 60.885 26.067 41.588 1.00 0.00 H ATOM 76190 C115 PA 1834 61.929 24.121 41.994 1.00 0.00 C ATOM 76191 H15R PA 1834 61.562 23.152 42.339 1.00 0.00 H ATOM 76192 H15S PA 1834 62.477 24.424 42.888 1.00 0.00 H ATOM 76193 C114 PA 1834 62.769 24.047 40.755 1.00 0.00 C ATOM 76194 H14R PA 1834 62.858 25.070 40.384 1.00 0.00 H ATOM 76195 H14S PA 1834 62.288 23.572 39.897 1.00 0.00 H ATOM 76196 C113 PA 1834 64.127 23.460 40.955 1.00 0.00 C ATOM 76197 H13R PA 1834 63.969 22.466 41.379 1.00 0.00 H ATOM 76198 H13S PA 1834 64.778 23.923 41.699 1.00 0.00 H ATOM 76199 C112 PA 1834 65.015 23.337 39.736 1.00 0.00 C ATOM 76200 H12R PA 1834 66.004 22.919 39.935 1.00 0.00 H ATOM 76201 H12S PA 1834 65.172 24.324 39.294 1.00 0.00 H ATOM 76202 C111 PA 1834 64.346 22.437 38.684 1.00 0.00 C ATOM 76203 H11R PA 1834 63.503 22.861 38.135 1.00 0.00 H ATOM 76204 H11S PA 1834 63.964 21.602 39.276 1.00 0.00 H ATOM 76205 C110 PA 1834 65.381 21.909 37.687 1.00 0.00 C ATOM 76206 H10R PA 1834 66.266 21.432 38.115 1.00 0.00 H ATOM 76207 H10S PA 1834 65.538 22.803 37.079 1.00 0.00 H ATOM 76208 C19 PA 1834 64.726 20.879 36.803 1.00 0.00 C ATOM 76209 H9R PA 1834 63.857 21.347 36.335 1.00 0.00 H ATOM 76210 H9S PA 1834 64.544 19.976 37.390 1.00 0.00 H ATOM 76211 C18 PA 1834 65.644 20.540 35.607 1.00 0.00 C ATOM 76212 H8R PA 1834 66.706 20.609 35.854 1.00 0.00 H ATOM 76213 H8S PA 1834 65.481 21.394 34.947 1.00 0.00 H ATOM 76214 C17 PA 1834 65.439 19.203 34.918 1.00 0.00 C ATOM 76215 H7R PA 1834 64.415 18.823 34.941 1.00 0.00 H ATOM 76216 H7S PA 1834 65.943 18.555 35.638 1.00 0.00 H ATOM 76217 C16 PA 1834 66.138 18.992 33.572 1.00 0.00 C ATOM 76218 H6R PA 1834 66.497 17.972 33.419 1.00 0.00 H ATOM 76219 H6S PA 1834 67.051 19.589 33.618 1.00 0.00 H ATOM 76220 C15 PA 1834 65.202 19.497 32.389 1.00 0.00 C ATOM 76221 H5R PA 1834 65.667 20.430 32.064 1.00 0.00 H ATOM 76222 H5S PA 1834 64.253 19.786 32.847 1.00 0.00 H ATOM 76223 C14 PA 1834 65.006 18.475 31.315 1.00 0.00 C ATOM 76224 H4R PA 1834 64.203 17.828 31.675 1.00 0.00 H ATOM 76225 H4S PA 1834 65.859 17.815 31.142 1.00 0.00 H ATOM 76226 C13 PA 1834 64.499 18.911 29.903 1.00 0.00 C ATOM 76227 H3R PA 1834 64.542 17.998 29.305 1.00 0.00 H ATOM 76228 H3S PA 1834 65.228 19.632 29.528 1.00 0.00 H ATOM 76229 C12 PA 1834 63.156 19.677 29.852 1.00 0.00 C ATOM 76230 H2R PA 1834 63.363 20.598 30.401 1.00 0.00 H ATOM 76231 H2S PA 1834 62.360 19.095 30.321 1.00 0.00 H ATOM 76232 C11 PC 1835 62.880 19.936 28.365 1.00 0.00 C ATOM 76233 O12 PC 1835 63.193 20.975 27.809 1.00 0.00 O ATOM 76234 O11 PC 1835 62.384 18.823 27.776 1.00 0.00 O ATOM 76235 C1 PC 1835 61.841 18.809 26.443 1.00 0.00 C ATOM 76236 HR PC 1835 62.660 19.130 25.795 1.00 0.00 H ATOM 76237 HS PC 1835 61.099 19.604 26.336 1.00 0.00 H ATOM 76238 C2 PC 1835 61.089 17.469 26.153 1.00 0.00 C ATOM 76239 HX PC 1835 61.523 16.718 26.818 1.00 0.00 H ATOM 76240 C3 PC 1835 61.162 17.015 24.709 1.00 0.00 C ATOM 76241 HA PC 1835 60.722 16.017 24.775 1.00 0.00 H ATOM 76242 HB PC 1835 62.221 17.045 24.442 1.00 0.00 H ATOM 76243 O31 PC 1835 60.451 17.842 23.809 1.00 0.00 O ATOM 76244 P31 PC 1835 60.556 17.494 22.260 1.00 0.00 P ATOM 76245 O32 PC 1835 59.593 16.241 21.985 1.00 0.00 O ATOM 76246 C31 PC 1835 58.214 16.423 22.165 1.00 0.00 C ATOM 76247 H1A PC 1835 57.887 17.336 21.659 1.00 0.00 H ATOM 76248 H1B PC 1835 58.039 16.611 23.227 1.00 0.00 H ATOM 76249 C32 PC 1835 57.485 15.150 21.668 1.00 0.00 C ATOM 76250 H2A PC 1835 57.553 15.153 20.580 1.00 0.00 H ATOM 76251 H2B PC 1835 56.407 15.189 21.826 1.00 0.00 H ATOM 76252 N31 PC 1835 57.848 13.803 22.207 1.00 0.00 N ATOM 76253 C33 PC 1835 58.805 13.271 21.286 1.00 0.00 C ATOM 76254 H3A PC 1835 58.824 12.217 21.570 1.00 0.00 H ATOM 76255 H3B PC 1835 59.722 13.833 21.466 1.00 0.00 H ATOM 76256 H3C PC 1835 58.411 13.405 20.278 1.00 0.00 H ATOM 76257 C34 PC 1835 58.595 13.893 23.564 1.00 0.00 C ATOM 76258 H4A PC 1835 59.463 14.542 23.437 1.00 0.00 H ATOM 76259 H4B PC 1835 58.881 12.869 23.810 1.00 0.00 H ATOM 76260 H4C PC 1835 57.862 14.299 24.263 1.00 0.00 H ATOM 76261 C35 PC 1835 56.633 12.841 22.510 1.00 0.00 C ATOM 76262 H5A PC 1835 56.172 12.712 21.530 1.00 0.00 H ATOM 76263 H5B PC 1835 55.930 13.245 23.240 1.00 0.00 H ATOM 76264 H5C PC 1835 57.082 11.873 22.738 1.00 0.00 H ATOM 76265 O33 PC 1835 60.048 18.703 21.606 1.00 0.00 O ATOM 76266 O34 PC 1835 61.950 17.071 21.989 1.00 0.00 O ATOM 76267 O21 PC 1835 59.714 17.605 26.689 1.00 0.00 O ATOM 76268 C21 PC 1835 58.916 16.570 26.888 1.00 0.00 C ATOM 76269 O22 PC 1835 59.103 15.421 26.389 1.00 0.00 O ATOM 76270 C12 OL 1836 57.730 16.858 27.741 1.00 0.00 C ATOM 76271 H2R OL 1836 57.363 15.873 28.038 1.00 0.00 H ATOM 76272 H2S OL 1836 58.059 17.296 28.685 1.00 0.00 H ATOM 76273 C13 OL 1836 56.606 17.660 27.160 1.00 0.00 C ATOM 76274 H3R OL 1836 57.087 18.574 26.808 1.00 0.00 H ATOM 76275 H3S OL 1836 56.137 17.132 26.327 1.00 0.00 H ATOM 76276 C14 OL 1836 55.460 18.035 28.146 1.00 0.00 C ATOM 76277 H4R OL 1836 55.103 17.116 28.616 1.00 0.00 H ATOM 76278 H4S OL 1836 55.732 18.680 28.984 1.00 0.00 H ATOM 76279 C15 OL 1836 54.322 18.783 27.548 1.00 0.00 C ATOM 76280 H5R OL 1836 54.428 19.870 27.543 1.00 0.00 H ATOM 76281 H5S OL 1836 54.220 18.511 26.496 1.00 0.00 H ATOM 76282 C16 OL 1836 52.976 18.649 28.323 1.00 0.00 C ATOM 76283 H6R OL 1836 53.210 19.059 29.308 1.00 0.00 H ATOM 76284 H6S OL 1836 52.390 19.468 27.902 1.00 0.00 H ATOM 76285 C17 OL 1836 52.127 17.382 28.273 1.00 0.00 C ATOM 76286 H7R OL 1836 52.424 16.770 27.418 1.00 0.00 H ATOM 76287 H7S OL 1836 52.337 16.756 29.143 1.00 0.00 H ATOM 76288 C18 OL 1836 50.658 17.687 28.259 1.00 0.00 C ATOM 76289 H8R OL 1836 50.307 18.203 29.155 1.00 0.00 H ATOM 76290 H8S OL 1836 50.331 18.319 27.431 1.00 0.00 H ATOM 76291 C19 OL 1836 49.906 16.359 28.115 1.00 0.00 C ATOM 76292 H9R OL 1836 50.238 15.760 27.271 1.00 0.00 H ATOM 76293 C110 OL 1836 48.849 15.851 28.824 1.00 0.00 C ATOM 76294 H10R OL 1836 48.403 14.871 28.678 1.00 0.00 H ATOM 76295 C111 OL 1836 48.176 16.531 29.974 1.00 0.00 C ATOM 76296 H11R OL 1836 48.520 16.236 30.967 1.00 0.00 H ATOM 76297 H11S OL 1836 48.410 17.576 29.760 1.00 0.00 H ATOM 76298 C112 OL 1836 46.693 16.267 30.129 1.00 0.00 C ATOM 76299 H12R OL 1836 46.258 16.780 30.990 1.00 0.00 H ATOM 76300 H12S OL 1836 46.222 16.663 29.227 1.00 0.00 H ATOM 76301 C113 OL 1836 46.352 14.772 30.318 1.00 0.00 C ATOM 76302 H13R OL 1836 47.081 14.135 29.814 1.00 0.00 H ATOM 76303 H13S OL 1836 46.543 14.604 31.380 1.00 0.00 H ATOM 76304 C114 OL 1836 44.901 14.303 30.161 1.00 0.00 C ATOM 76305 H14R OL 1836 44.689 14.115 29.107 1.00 0.00 H ATOM 76306 H14S OL 1836 44.855 13.290 30.566 1.00 0.00 H ATOM 76307 C115 OL 1836 43.900 15.226 30.857 1.00 0.00 C ATOM 76308 H15R OL 1836 44.315 15.568 31.808 1.00 0.00 H ATOM 76309 H15S OL 1836 43.747 16.122 30.252 1.00 0.00 H ATOM 76310 C116 OL 1836 42.511 14.729 31.174 1.00 0.00 C ATOM 76311 H16R OL 1836 42.615 13.887 31.862 1.00 0.00 H ATOM 76312 H16S OL 1836 41.901 15.459 31.711 1.00 0.00 H ATOM 76313 C117 OL 1836 41.735 14.317 29.916 1.00 0.00 C ATOM 76314 H17R OL 1836 41.422 15.255 29.454 1.00 0.00 H ATOM 76315 H17S OL 1836 42.296 13.804 29.132 1.00 0.00 H ATOM 76316 C118 OL 1836 40.469 13.454 30.238 1.00 0.00 C ATOM 76317 H18R OL 1836 39.753 13.587 29.425 1.00 0.00 H ATOM 76318 H18S OL 1836 40.120 13.829 31.203 1.00 0.00 H ATOM 76319 H18T OL 1836 40.738 12.396 30.254 1.00 0.00 H TER 76320 OL 1836 ATOM 76320 C116 PA 1837 111.249 121.329 37.878 1.00 0.00 C ATOM 76321 H16R PA 1837 111.127 122.233 38.479 1.00 0.00 H ATOM 76322 H16S PA 1837 111.919 121.569 37.050 1.00 0.00 H ATOM 76323 H16T PA 1837 111.734 120.691 38.620 1.00 0.00 H ATOM 76324 C115 PA 1837 109.945 120.706 37.311 1.00 0.00 C ATOM 76325 H15R PA 1837 109.219 120.822 38.119 1.00 0.00 H ATOM 76326 H15S PA 1837 110.172 119.642 37.225 1.00 0.00 H ATOM 76327 C114 PA 1837 109.421 121.206 36.017 1.00 0.00 C ATOM 76328 H14R PA 1837 110.263 121.147 35.324 1.00 0.00 H ATOM 76329 H14S PA 1837 109.176 122.270 35.998 1.00 0.00 H ATOM 76330 C113 PA 1837 108.120 120.540 35.585 1.00 0.00 C ATOM 76331 H13R PA 1837 107.299 120.704 36.285 1.00 0.00 H ATOM 76332 H13S PA 1837 108.463 119.503 35.601 1.00 0.00 H ATOM 76333 C112 PA 1837 107.643 120.757 34.183 1.00 0.00 C ATOM 76334 H12R PA 1837 107.119 119.849 33.876 1.00 0.00 H ATOM 76335 H12S PA 1837 108.387 120.976 33.414 1.00 0.00 H ATOM 76336 C111 PA 1837 106.766 122.009 33.958 1.00 0.00 C ATOM 76337 H11R PA 1837 107.314 122.894 34.287 1.00 0.00 H ATOM 76338 H11S PA 1837 105.997 122.021 34.733 1.00 0.00 H ATOM 76339 C110 PA 1837 106.144 122.038 32.598 1.00 0.00 C ATOM 76340 H10R PA 1837 105.233 121.437 32.643 1.00 0.00 H ATOM 76341 H10S PA 1837 106.909 121.573 31.973 1.00 0.00 H ATOM 76342 C19 PA 1837 105.824 123.426 31.960 1.00 0.00 C ATOM 76343 H9R PA 1837 106.730 123.993 31.737 1.00 0.00 H ATOM 76344 H9S PA 1837 105.221 124.021 32.649 1.00 0.00 H ATOM 76345 C18 PA 1837 105.021 123.276 30.658 1.00 0.00 C ATOM 76346 H8R PA 1837 104.261 122.501 30.779 1.00 0.00 H ATOM 76347 H8S PA 1837 105.638 123.100 29.774 1.00 0.00 H ATOM 76348 C17 PA 1837 104.263 124.644 30.333 1.00 0.00 C ATOM 76349 H7R PA 1837 104.795 125.551 30.626 1.00 0.00 H ATOM 76350 H7S PA 1837 103.354 124.613 30.937 1.00 0.00 H ATOM 76351 C16 PA 1837 103.873 124.797 28.893 1.00 0.00 C ATOM 76352 H6R PA 1837 104.667 124.320 28.314 1.00 0.00 H ATOM 76353 H6S PA 1837 103.778 125.876 28.758 1.00 0.00 H ATOM 76354 C15 PA 1837 102.468 124.030 28.647 1.00 0.00 C ATOM 76355 H5R PA 1837 101.608 124.571 29.048 1.00 0.00 H ATOM 76356 H5S PA 1837 102.549 123.119 29.244 1.00 0.00 H ATOM 76357 C14 PA 1837 102.154 123.605 27.210 1.00 0.00 C ATOM 76358 H4R PA 1837 102.911 122.939 26.790 1.00 0.00 H ATOM 76359 H4S PA 1837 102.037 124.463 26.545 1.00 0.00 H ATOM 76360 C13 PA 1837 100.861 122.908 27.065 1.00 0.00 C ATOM 76361 H3R PA 1837 100.099 123.665 27.261 1.00 0.00 H ATOM 76362 H3S PA 1837 100.758 122.079 27.768 1.00 0.00 H ATOM 76363 C12 PA 1837 100.649 122.221 25.724 1.00 0.00 C ATOM 76364 H2R PA 1837 101.321 121.429 25.387 1.00 0.00 H ATOM 76365 H2S PA 1837 100.667 122.926 24.890 1.00 0.00 H ATOM 76366 C11 PGR 1838 99.255 121.612 25.768 1.00 0.00 C ATOM 76367 O12 PGR 1838 98.283 122.278 25.451 1.00 0.00 O ATOM 76368 O11 PGR 1838 99.178 120.344 26.190 1.00 0.00 O ATOM 76369 C1 PGR 1838 97.924 119.548 26.118 1.00 0.00 C ATOM 76370 HR PGR 1838 97.497 119.704 25.124 1.00 0.00 H ATOM 76371 HS PGR 1838 97.270 119.855 26.938 1.00 0.00 H ATOM 76372 C2 PGR 1838 98.397 118.075 26.292 1.00 0.00 C ATOM 76373 HX PGR 1838 99.355 117.874 25.805 1.00 0.00 H ATOM 76374 C3 PGR 1838 97.459 116.960 25.692 1.00 0.00 C ATOM 76375 HA PGR 1838 96.424 116.962 26.044 1.00 0.00 H ATOM 76376 HB PGR 1838 97.997 116.010 25.737 1.00 0.00 H ATOM 76377 O31 PGR 1838 97.469 117.293 24.271 1.00 0.00 O ATOM 76378 P31 PGR 1838 96.818 116.248 23.199 1.00 0.00 P ATOM 76379 O32 PGR 1838 95.492 115.560 23.875 1.00 0.00 O ATOM 76380 C31 PGR 1838 94.225 116.190 24.030 1.00 0.00 C ATOM 76381 H1A PGR 1838 93.756 116.286 23.047 1.00 0.00 H ATOM 76382 H1B PGR 1838 94.411 117.156 24.505 1.00 0.00 H ATOM 76383 C32 PGR 1838 93.167 115.392 24.907 1.00 0.00 C ATOM 76384 H2A PGR 1838 93.442 115.167 25.941 1.00 0.00 H ATOM 76385 O35 PGR 1838 92.917 114.146 24.305 1.00 0.00 O ATOM 76386 HO5A PGR 1838 93.735 113.913 23.831 1.00 0.00 H ATOM 76387 C33 PGR 1838 91.826 116.194 24.972 1.00 0.00 C ATOM 76388 H3A PGR 1838 92.090 117.209 25.280 1.00 0.00 H ATOM 76389 H3B PGR 1838 91.452 116.308 23.951 1.00 0.00 H ATOM 76390 O33 PGR 1838 96.429 117.088 22.018 1.00 0.00 O ATOM 76391 O34 PGR 1838 97.768 115.174 22.986 1.00 0.00 O ATOM 76392 O21 PGR 1838 98.537 117.911 27.738 1.00 0.00 O ATOM 76393 C21 PGR 1838 99.711 117.429 28.247 1.00 0.00 C ATOM 76394 O22 PGR 1838 100.683 117.073 27.645 1.00 0.00 O ATOM 76395 O36 PGR 1838 90.924 115.600 25.877 1.00 0.00 O ATOM 76396 HO6A PGR 1838 90.091 116.097 25.794 1.00 0.00 H ATOM 76397 C12 OL 1839 99.701 117.447 29.788 1.00 0.00 C ATOM 76398 H2R OL 1839 98.829 116.876 30.112 1.00 0.00 H ATOM 76399 H2S OL 1839 100.644 117.097 30.214 1.00 0.00 H ATOM 76400 C13 OL 1839 99.561 118.880 30.313 1.00 0.00 C ATOM 76401 H3R OL 1839 100.484 119.464 30.295 1.00 0.00 H ATOM 76402 H3S OL 1839 98.851 119.394 29.661 1.00 0.00 H ATOM 76403 C14 OL 1839 99.037 118.890 31.691 1.00 0.00 C ATOM 76404 H4R OL 1839 98.135 118.277 31.745 1.00 0.00 H ATOM 76405 H4S OL 1839 99.711 118.432 32.418 1.00 0.00 H ATOM 76406 C15 OL 1839 98.624 120.256 32.201 1.00 0.00 C ATOM 76407 H5R OL 1839 99.471 120.734 32.699 1.00 0.00 H ATOM 76408 H5S OL 1839 98.398 120.942 31.382 1.00 0.00 H ATOM 76409 C16 OL 1839 97.536 120.241 33.267 1.00 0.00 C ATOM 76410 H6R OL 1839 97.238 121.266 33.501 1.00 0.00 H ATOM 76411 H6S OL 1839 96.608 119.949 32.771 1.00 0.00 H ATOM 76412 C17 OL 1839 97.819 119.523 34.546 1.00 0.00 C ATOM 76413 H7R OL 1839 96.890 119.153 34.985 1.00 0.00 H ATOM 76414 H7S OL 1839 98.309 118.612 34.197 1.00 0.00 H ATOM 76415 C18 OL 1839 98.679 120.447 35.475 1.00 0.00 C ATOM 76416 H8R OL 1839 99.187 119.803 36.197 1.00 0.00 H ATOM 76417 H8S OL 1839 99.415 121.058 34.949 1.00 0.00 H ATOM 76418 C19 OL 1839 97.666 121.298 36.233 1.00 0.00 C ATOM 76419 H9R OL 1839 96.666 120.874 36.273 1.00 0.00 H ATOM 76420 C110 OL 1839 97.845 122.555 36.600 1.00 0.00 C ATOM 76421 H10R OL 1839 97.030 123.117 37.048 1.00 0.00 H ATOM 76422 C111 OL 1839 99.199 123.257 36.605 1.00 0.00 C ATOM 76423 H11R OL 1839 99.984 122.523 36.412 1.00 0.00 H ATOM 76424 H11S OL 1839 99.140 124.007 35.814 1.00 0.00 H ATOM 76425 C112 OL 1839 99.544 123.924 37.920 1.00 0.00 C ATOM 76426 H12R OL 1839 98.781 124.680 38.117 1.00 0.00 H ATOM 76427 H12S OL 1839 99.451 123.164 38.699 1.00 0.00 H ATOM 76428 C113 OL 1839 100.864 124.523 38.073 1.00 0.00 C ATOM 76429 H13R OL 1839 101.534 123.666 37.979 1.00 0.00 H ATOM 76430 H13S OL 1839 101.039 125.209 37.241 1.00 0.00 H ATOM 76431 C114 OL 1839 101.176 125.109 39.501 1.00 0.00 C ATOM 76432 H14R OL 1839 100.650 126.065 39.526 1.00 0.00 H ATOM 76433 H14S OL 1839 100.680 124.481 40.244 1.00 0.00 H ATOM 76434 C115 OL 1839 102.675 125.369 39.749 1.00 0.00 C ATOM 76435 H15R OL 1839 103.295 124.473 39.686 1.00 0.00 H ATOM 76436 H15S OL 1839 103.065 126.068 39.006 1.00 0.00 H ATOM 76437 C116 OL 1839 102.999 126.001 41.072 1.00 0.00 C ATOM 76438 H16R OL 1839 104.066 125.967 41.303 1.00 0.00 H ATOM 76439 H16S OL 1839 102.776 127.061 40.935 1.00 0.00 H ATOM 76440 C117 OL 1839 102.150 125.399 42.227 1.00 0.00 C ATOM 76441 H17R OL 1839 102.457 126.050 43.049 1.00 0.00 H ATOM 76442 H17S OL 1839 101.099 125.626 42.042 1.00 0.00 H ATOM 76443 C118 OL 1839 102.536 123.963 42.596 1.00 0.00 C ATOM 76444 H18R OL 1839 103.528 123.922 43.051 1.00 0.00 H ATOM 76445 H18S OL 1839 102.638 123.283 41.748 1.00 0.00 H ATOM 76446 H18T OL 1839 101.866 123.480 43.310 1.00 0.00 H TER 76447 OL 1839 ATOM 76447 C116 PA 1840 129.731 11.657 42.559 1.00 0.00 C ATOM 76448 H16R PA 1840 129.373 12.095 43.493 1.00 0.00 H ATOM 76449 H16S PA 1840 130.696 12.134 42.377 1.00 0.00 H ATOM 76450 H16T PA 1840 129.896 10.585 42.682 1.00 0.00 H ATOM 76451 C115 PA 1840 128.752 11.704 41.372 1.00 0.00 C ATOM 76452 H15R PA 1840 128.308 12.702 41.386 1.00 0.00 H ATOM 76453 H15S PA 1840 127.980 10.931 41.358 1.00 0.00 H ATOM 76454 C114 PA 1840 129.458 11.794 40.069 1.00 0.00 C ATOM 76455 H14R PA 1840 130.224 11.016 40.097 1.00 0.00 H ATOM 76456 H14S PA 1840 129.913 12.786 40.051 1.00 0.00 H ATOM 76457 C113 PA 1840 128.478 11.582 38.895 1.00 0.00 C ATOM 76458 H13R PA 1840 127.504 11.799 39.339 1.00 0.00 H ATOM 76459 H13S PA 1840 128.452 10.532 38.597 1.00 0.00 H ATOM 76460 C112 PA 1840 128.628 12.448 37.734 1.00 0.00 C ATOM 76461 H12R PA 1840 129.653 12.328 37.378 1.00 0.00 H ATOM 76462 H12S PA 1840 128.513 13.482 38.067 1.00 0.00 H ATOM 76463 C111 PA 1840 127.791 12.115 36.510 1.00 0.00 C ATOM 76464 H11R PA 1840 126.749 11.978 36.805 1.00 0.00 H ATOM 76465 H11S PA 1840 128.106 11.189 36.024 1.00 0.00 H ATOM 76466 C110 PA 1840 127.882 13.242 35.480 1.00 0.00 C ATOM 76467 H10R PA 1840 128.922 13.270 35.149 1.00 0.00 H ATOM 76468 H10S PA 1840 127.690 14.255 35.838 1.00 0.00 H ATOM 76469 C19 PA 1840 127.018 12.986 34.220 1.00 0.00 C ATOM 76470 H9R PA 1840 126.089 12.606 34.649 1.00 0.00 H ATOM 76471 H9S PA 1840 127.404 12.090 33.729 1.00 0.00 H ATOM 76472 C18 PA 1840 126.834 14.108 33.202 1.00 0.00 C ATOM 76473 H8R PA 1840 127.776 14.658 33.175 1.00 0.00 H ATOM 76474 H8S PA 1840 126.156 14.817 33.682 1.00 0.00 H ATOM 76475 C17 PA 1840 126.197 13.639 31.869 1.00 0.00 C ATOM 76476 H7R PA 1840 125.233 13.159 32.050 1.00 0.00 H ATOM 76477 H7S PA 1840 126.861 12.807 31.624 1.00 0.00 H ATOM 76478 C16 PA 1840 126.275 14.684 30.791 1.00 0.00 C ATOM 76479 H6R PA 1840 127.320 14.964 30.648 1.00 0.00 H ATOM 76480 H6S PA 1840 125.771 15.619 31.047 1.00 0.00 H ATOM 76481 C15 PA 1840 125.784 14.140 29.409 1.00 0.00 C ATOM 76482 H5R PA 1840 126.071 13.123 29.133 1.00 0.00 H ATOM 76483 H5S PA 1840 126.225 14.761 28.626 1.00 0.00 H ATOM 76484 C14 PA 1840 124.255 13.933 29.231 1.00 0.00 C ATOM 76485 H4R PA 1840 123.687 14.841 29.444 1.00 0.00 H ATOM 76486 H4S PA 1840 123.985 13.290 30.072 1.00 0.00 H ATOM 76487 C13 PA 1840 123.778 13.414 27.899 1.00 0.00 C ATOM 76488 H3R PA 1840 124.086 12.367 27.868 1.00 0.00 H ATOM 76489 H3S PA 1840 124.272 13.985 27.110 1.00 0.00 H ATOM 76490 C12 PA 1840 122.269 13.510 27.587 1.00 0.00 C ATOM 76491 H2R PA 1840 121.959 14.511 27.894 1.00 0.00 H ATOM 76492 H2S PA 1840 121.683 12.885 28.263 1.00 0.00 H ATOM 76493 C11 PGR 1841 121.982 13.032 26.179 1.00 0.00 C ATOM 76494 O12 PGR 1841 121.681 13.741 25.221 1.00 0.00 O ATOM 76495 O11 PGR 1841 122.186 11.732 26.010 1.00 0.00 O ATOM 76496 C1 PGR 1841 122.271 11.234 24.575 1.00 0.00 C ATOM 76497 HR PGR 1841 121.351 11.613 24.122 1.00 0.00 H ATOM 76498 HS PGR 1841 122.268 10.143 24.634 1.00 0.00 H ATOM 76499 C2 PGR 1841 123.608 11.708 23.901 1.00 0.00 C ATOM 76500 HX PGR 1841 123.556 12.797 23.977 1.00 0.00 H ATOM 76501 C3 PGR 1841 123.586 11.280 22.451 1.00 0.00 C ATOM 76502 HA PGR 1841 122.567 11.203 22.065 1.00 0.00 H ATOM 76503 HB PGR 1841 124.022 10.279 22.497 1.00 0.00 H ATOM 76504 O31 PGR 1841 124.242 12.233 21.613 1.00 0.00 O ATOM 76505 P31 PGR 1841 123.502 13.559 21.055 1.00 0.00 P ATOM 76506 O32 PGR 1841 122.428 12.920 19.973 1.00 0.00 O ATOM 76507 C31 PGR 1841 122.895 12.343 18.782 1.00 0.00 C ATOM 76508 H1A PGR 1841 123.683 11.608 18.965 1.00 0.00 H ATOM 76509 H1B PGR 1841 123.379 13.101 18.162 1.00 0.00 H ATOM 76510 C32 PGR 1841 121.829 11.522 17.963 1.00 0.00 C ATOM 76511 H2A PGR 1841 120.949 12.151 17.809 1.00 0.00 H ATOM 76512 O35 PGR 1841 121.454 10.366 18.658 1.00 0.00 O ATOM 76513 HO5A PGR 1841 120.996 10.698 19.451 1.00 0.00 H ATOM 76514 C33 PGR 1841 122.196 11.369 16.420 1.00 0.00 C ATOM 76515 H3A PGR 1841 121.279 11.110 15.884 1.00 0.00 H ATOM 76516 H3B PGR 1841 122.698 12.211 15.936 1.00 0.00 H ATOM 76517 O33 PGR 1841 122.729 14.228 22.082 1.00 0.00 O ATOM 76518 O34 PGR 1841 124.460 14.412 20.271 1.00 0.00 O ATOM 76519 O21 PGR 1841 124.749 11.178 24.656 1.00 0.00 O ATOM 76520 C21 PGR 1841 125.922 11.794 24.563 1.00 0.00 C ATOM 76521 O22 PGR 1841 126.102 12.789 23.869 1.00 0.00 O ATOM 76522 O36 PGR 1841 123.078 10.284 16.307 1.00 0.00 O ATOM 76523 HO6A PGR 1841 122.755 9.633 16.955 1.00 0.00 H ATOM 76524 C12 OL 1842 126.964 11.230 25.534 1.00 0.00 C ATOM 76525 H2R OL 1842 127.183 10.205 25.227 1.00 0.00 H ATOM 76526 H2S OL 1842 127.898 11.795 25.509 1.00 0.00 H ATOM 76527 C13 OL 1842 126.379 11.093 27.000 1.00 0.00 C ATOM 76528 H3R OL 1842 126.157 12.052 27.473 1.00 0.00 H ATOM 76529 H3S OL 1842 125.489 10.461 26.985 1.00 0.00 H ATOM 76530 C14 OL 1842 127.445 10.346 27.900 1.00 0.00 C ATOM 76531 H4R OL 1842 127.364 9.301 27.591 1.00 0.00 H ATOM 76532 H4S OL 1842 128.422 10.709 27.575 1.00 0.00 H ATOM 76533 C15 OL 1842 127.407 10.538 29.415 1.00 0.00 C ATOM 76534 H5R OL 1842 127.708 11.558 29.660 1.00 0.00 H ATOM 76535 H5S OL 1842 126.357 10.512 29.716 1.00 0.00 H ATOM 76536 C16 OL 1842 128.343 9.596 30.164 1.00 0.00 C ATOM 76537 H6R OL 1842 127.955 8.600 29.944 1.00 0.00 H ATOM 76538 H6S OL 1842 129.324 9.791 29.725 1.00 0.00 H ATOM 76539 C17 OL 1842 128.354 9.685 31.694 1.00 0.00 C ATOM 76540 H7R OL 1842 128.693 10.668 32.025 1.00 0.00 H ATOM 76541 H7S OL 1842 127.318 9.659 32.038 1.00 0.00 H ATOM 76542 C18 OL 1842 129.100 8.468 32.333 1.00 0.00 C ATOM 76543 H8R OL 1842 128.567 7.544 32.097 1.00 0.00 H ATOM 76544 H8S OL 1842 130.105 8.301 31.940 1.00 0.00 H ATOM 76545 C19 OL 1842 129.251 8.742 33.789 1.00 0.00 C ATOM 76546 H9R OL 1842 129.931 9.557 34.022 1.00 0.00 H ATOM 76547 C110 OL 1842 128.590 8.221 34.825 1.00 0.00 C ATOM 76548 H10R OL 1842 128.670 8.655 35.818 1.00 0.00 H ATOM 76549 C111 OL 1842 127.802 6.938 34.870 1.00 0.00 C ATOM 76550 H11R OL 1842 127.689 6.483 33.884 1.00 0.00 H ATOM 76551 H11S OL 1842 128.449 6.325 35.502 1.00 0.00 H ATOM 76552 C112 OL 1842 126.387 7.152 35.438 1.00 0.00 C ATOM 76553 H12R OL 1842 126.245 7.566 36.438 1.00 0.00 H ATOM 76554 H12S OL 1842 125.916 7.781 34.679 1.00 0.00 H ATOM 76555 C113 OL 1842 125.553 5.791 35.499 1.00 0.00 C ATOM 76556 H13R OL 1842 125.898 5.136 34.697 1.00 0.00 H ATOM 76557 H13S OL 1842 126.033 5.384 36.392 1.00 0.00 H ATOM 76558 C114 OL 1842 124.042 6.053 35.653 1.00 0.00 C ATOM 76559 H14R OL 1842 123.865 6.254 36.711 1.00 0.00 H ATOM 76560 H14S OL 1842 123.674 6.777 34.922 1.00 0.00 H ATOM 76561 C115 OL 1842 123.273 4.822 35.346 1.00 0.00 C ATOM 76562 H15R OL 1842 123.414 4.348 34.373 1.00 0.00 H ATOM 76563 H15S OL 1842 123.519 3.981 35.998 1.00 0.00 H ATOM 76564 C116 OL 1842 121.737 5.148 35.339 1.00 0.00 C ATOM 76565 H16R OL 1842 121.553 5.571 36.328 1.00 0.00 H ATOM 76566 H16S OL 1842 121.572 5.934 34.599 1.00 0.00 H ATOM 76567 C117 OL 1842 120.930 3.875 35.035 1.00 0.00 C ATOM 76568 H17R OL 1842 119.988 4.079 34.522 1.00 0.00 H ATOM 76569 H17S OL 1842 121.405 3.299 34.238 1.00 0.00 H ATOM 76570 C118 OL 1842 120.478 3.112 36.320 1.00 0.00 C ATOM 76571 H18R OL 1842 120.128 2.119 36.032 1.00 0.00 H ATOM 76572 H18S OL 1842 119.788 3.704 36.926 1.00 0.00 H ATOM 76573 H18T OL 1842 121.371 2.953 36.928 1.00 0.00 H TER 76574 OL 1842 ATOM 76574 C116 PA 1843 14.482 29.249 47.069 1.00 0.00 C ATOM 76575 H16R PA 1843 14.432 30.207 46.547 1.00 0.00 H ATOM 76576 H16S PA 1843 15.395 28.666 46.933 1.00 0.00 H ATOM 76577 H16T PA 1843 14.539 29.386 48.151 1.00 0.00 H ATOM 76578 C115 PA 1843 13.244 28.403 46.659 1.00 0.00 C ATOM 76579 H15R PA 1843 12.483 28.829 47.316 1.00 0.00 H ATOM 76580 H15S PA 1843 13.453 27.353 46.872 1.00 0.00 H ATOM 76581 C114 PA 1843 12.577 28.615 45.222 1.00 0.00 C ATOM 76582 H14R PA 1843 12.118 29.597 45.088 1.00 0.00 H ATOM 76583 H14S PA 1843 11.852 27.826 45.011 1.00 0.00 H ATOM 76584 C113 PA 1843 13.581 28.496 44.092 1.00 0.00 C ATOM 76585 H13R PA 1843 14.170 27.593 44.268 1.00 0.00 H ATOM 76586 H13S PA 1843 14.348 29.268 44.181 1.00 0.00 H ATOM 76587 C112 PA 1843 12.978 28.549 42.683 1.00 0.00 C ATOM 76588 H12R PA 1843 12.087 27.919 42.639 1.00 0.00 H ATOM 76589 H12S PA 1843 13.648 28.168 41.910 1.00 0.00 H ATOM 76590 C111 PA 1843 12.496 29.906 42.192 1.00 0.00 C ATOM 76591 H11R PA 1843 12.039 30.416 43.043 1.00 0.00 H ATOM 76592 H11S PA 1843 11.527 29.834 41.694 1.00 0.00 H ATOM 76593 C110 PA 1843 13.478 30.762 41.403 1.00 0.00 C ATOM 76594 H10R PA 1843 14.436 30.664 41.919 1.00 0.00 H ATOM 76595 H10S PA 1843 13.204 31.798 41.612 1.00 0.00 H ATOM 76596 C19 PA 1843 13.430 30.514 39.874 1.00 0.00 C ATOM 76597 H9R PA 1843 12.389 30.376 39.574 1.00 0.00 H ATOM 76598 H9S PA 1843 13.693 29.478 39.651 1.00 0.00 H ATOM 76599 C18 PA 1843 14.175 31.554 39.075 1.00 0.00 C ATOM 76600 H8R PA 1843 15.169 31.794 39.458 1.00 0.00 H ATOM 76601 H8S PA 1843 13.724 32.534 39.246 1.00 0.00 H ATOM 76602 C17 PA 1843 14.160 31.226 37.540 1.00 0.00 C ATOM 76603 H7R PA 1843 13.084 31.061 37.449 1.00 0.00 H ATOM 76604 H7S PA 1843 14.653 30.284 37.291 1.00 0.00 H ATOM 76605 C16 PA 1843 14.569 32.339 36.631 1.00 0.00 C ATOM 76606 H6R PA 1843 15.586 32.599 36.934 1.00 0.00 H ATOM 76607 H6S PA 1843 14.058 33.242 36.973 1.00 0.00 H ATOM 76608 C15 PA 1843 14.690 32.035 35.117 1.00 0.00 C ATOM 76609 H5R PA 1843 13.776 31.646 34.664 1.00 0.00 H ATOM 76610 H5S PA 1843 15.551 31.385 34.946 1.00 0.00 H ATOM 76611 C14 PA 1843 14.950 33.307 34.257 1.00 0.00 C ATOM 76612 H4R PA 1843 15.889 33.853 34.371 1.00 0.00 H ATOM 76613 H4S PA 1843 14.213 34.085 34.465 1.00 0.00 H ATOM 76614 C13 PA 1843 15.011 32.987 32.765 1.00 0.00 C ATOM 76615 H3R PA 1843 14.339 32.239 32.340 1.00 0.00 H ATOM 76616 H3S PA 1843 15.974 32.503 32.588 1.00 0.00 H ATOM 76617 C12 PA 1843 14.883 34.283 31.897 1.00 0.00 C ATOM 76618 H2R PA 1843 15.458 35.064 32.399 1.00 0.00 H ATOM 76619 H2S PA 1843 13.903 34.763 31.852 1.00 0.00 H ATOM 76620 C11 PGR 1844 15.489 33.986 30.560 1.00 0.00 C ATOM 76621 O12 PGR 1844 16.608 33.530 30.301 1.00 0.00 O ATOM 76622 O11 PGR 1844 14.597 34.373 29.612 1.00 0.00 O ATOM 76623 C1 PGR 1844 15.038 34.143 28.234 1.00 0.00 C ATOM 76624 HR PGR 1844 16.092 34.407 28.119 1.00 0.00 H ATOM 76625 HS PGR 1844 14.410 34.672 27.513 1.00 0.00 H ATOM 76626 C2 PGR 1844 14.766 32.650 27.888 1.00 0.00 C ATOM 76627 HX PGR 1844 15.292 32.069 28.650 1.00 0.00 H ATOM 76628 C3 PGR 1844 15.237 32.194 26.499 1.00 0.00 C ATOM 76629 HA PGR 1844 14.811 31.207 26.300 1.00 0.00 H ATOM 76630 HB PGR 1844 16.314 32.029 26.588 1.00 0.00 H ATOM 76631 O31 PGR 1844 14.895 33.071 25.418 1.00 0.00 O ATOM 76632 P31 PGR 1844 15.365 32.786 23.934 1.00 0.00 P ATOM 76633 O32 PGR 1844 16.979 32.820 23.956 1.00 0.00 O ATOM 76634 C31 PGR 1844 17.644 34.020 24.178 1.00 0.00 C ATOM 76635 H1A PGR 1844 17.294 34.231 25.192 1.00 0.00 H ATOM 76636 H1B PGR 1844 17.384 34.899 23.583 1.00 0.00 H ATOM 76637 C32 PGR 1844 19.168 33.858 24.128 1.00 0.00 C ATOM 76638 H2A PGR 1844 19.684 34.821 24.093 1.00 0.00 H ATOM 76639 O35 PGR 1844 19.449 33.131 22.942 1.00 0.00 O ATOM 76640 HO5A PGR 1844 18.723 32.482 22.917 1.00 0.00 H ATOM 76641 C33 PGR 1844 19.585 33.095 25.366 1.00 0.00 C ATOM 76642 H3A PGR 1844 19.060 33.421 26.268 1.00 0.00 H ATOM 76643 H3B PGR 1844 19.594 32.026 25.141 1.00 0.00 H ATOM 76644 O33 PGR 1844 14.986 31.390 23.559 1.00 0.00 O ATOM 76645 O34 PGR 1844 14.901 33.914 23.083 1.00 0.00 O ATOM 76646 O21 PGR 1844 13.362 32.282 27.969 1.00 0.00 O ATOM 76647 C21 PGR 1844 12.935 31.194 28.566 1.00 0.00 C ATOM 76648 O22 PGR 1844 13.689 30.325 28.990 1.00 0.00 O ATOM 76649 O36 PGR 1844 20.950 33.547 25.666 1.00 0.00 O ATOM 76650 HO6A PGR 1844 21.461 33.409 24.849 1.00 0.00 H ATOM 76651 C12 OL 1845 11.435 31.258 28.749 1.00 0.00 C ATOM 76652 H2R OL 1845 10.818 31.227 27.849 1.00 0.00 H ATOM 76653 H2S OL 1845 11.118 30.405 29.352 1.00 0.00 H ATOM 76654 C13 OL 1845 11.133 32.437 29.703 1.00 0.00 C ATOM 76655 H3R OL 1845 11.714 32.213 30.600 1.00 0.00 H ATOM 76656 H3S OL 1845 11.344 33.448 29.348 1.00 0.00 H ATOM 76657 C14 OL 1845 9.607 32.492 30.031 1.00 0.00 C ATOM 76658 H4R OL 1845 8.965 32.732 29.182 1.00 0.00 H ATOM 76659 H4S OL 1845 9.233 31.504 30.307 1.00 0.00 H ATOM 76660 C15 OL 1845 9.143 33.515 30.989 1.00 0.00 C ATOM 76661 H5R OL 1845 9.103 34.520 30.564 1.00 0.00 H ATOM 76662 H5S OL 1845 8.098 33.310 31.230 1.00 0.00 H ATOM 76663 C16 OL 1845 9.835 33.618 32.304 1.00 0.00 C ATOM 76664 H6R OL 1845 10.817 34.069 32.148 1.00 0.00 H ATOM 76665 H6S OL 1845 9.395 34.390 32.939 1.00 0.00 H ATOM 76666 C17 OL 1845 9.895 32.263 33.059 1.00 0.00 C ATOM 76667 H7R OL 1845 9.826 31.412 32.379 1.00 0.00 H ATOM 76668 H7S OL 1845 10.843 32.230 33.599 1.00 0.00 H ATOM 76669 C18 OL 1845 8.683 32.139 34.029 1.00 0.00 C ATOM 76670 H8R OL 1845 8.956 31.588 34.931 1.00 0.00 H ATOM 76671 H8S OL 1845 8.291 33.142 34.208 1.00 0.00 H ATOM 76672 C19 OL 1845 7.536 31.453 33.345 1.00 0.00 C ATOM 76673 H9R OL 1845 7.069 31.925 32.484 1.00 0.00 H ATOM 76674 C110 OL 1845 6.989 30.312 33.749 1.00 0.00 C ATOM 76675 H10R OL 1845 6.160 29.936 33.155 1.00 0.00 H ATOM 76676 C111 OL 1845 7.339 29.350 34.785 1.00 0.00 C ATOM 76677 H11R OL 1845 7.556 28.348 34.409 1.00 0.00 H ATOM 76678 H11S OL 1845 8.147 29.727 35.415 1.00 0.00 H ATOM 76679 C112 OL 1845 6.134 28.981 35.648 1.00 0.00 C ATOM 76680 H12R OL 1845 5.844 29.890 36.178 1.00 0.00 H ATOM 76681 H12S OL 1845 5.356 28.759 34.914 1.00 0.00 H ATOM 76682 C113 OL 1845 6.356 27.768 36.586 1.00 0.00 C ATOM 76683 H13R OL 1845 7.333 28.001 37.016 1.00 0.00 H ATOM 76684 H13S OL 1845 5.742 27.760 37.489 1.00 0.00 H ATOM 76685 C114 OL 1845 6.311 26.374 35.911 1.00 0.00 C ATOM 76686 H14R OL 1845 6.797 26.437 34.936 1.00 0.00 H ATOM 76687 H14S OL 1845 6.937 25.663 36.454 1.00 0.00 H ATOM 76688 C115 OL 1845 4.936 25.740 35.840 1.00 0.00 C ATOM 76689 H15R OL 1845 4.512 25.874 36.837 1.00 0.00 H ATOM 76690 H15S OL 1845 4.375 26.351 35.130 1.00 0.00 H ATOM 76691 C116 OL 1845 4.908 24.253 35.502 1.00 0.00 C ATOM 76692 H16R OL 1845 5.447 23.977 34.593 1.00 0.00 H ATOM 76693 H16S OL 1845 5.483 23.720 36.262 1.00 0.00 H ATOM 76694 C117 OL 1845 3.572 23.558 35.368 1.00 0.00 C ATOM 76695 H17R OL 1845 3.037 23.598 36.320 1.00 0.00 H ATOM 76696 H17S OL 1845 3.062 23.990 34.505 1.00 0.00 H ATOM 76697 C118 OL 1845 3.789 22.041 35.099 1.00 0.00 C ATOM 76698 H18R OL 1845 2.878 21.453 35.228 1.00 0.00 H ATOM 76699 H18S OL 1845 4.560 21.657 35.770 1.00 0.00 H ATOM 76700 H18T OL 1845 4.049 21.980 34.040 1.00 0.00 H TER 76701 OL 1845 ATOM 76701 C116 PA 1846 112.268 130.921 37.179 1.00 0.00 C ATOM 76702 H16R PA 1846 112.482 129.908 37.529 1.00 0.00 H ATOM 76703 H16S PA 1846 111.217 131.157 37.006 1.00 0.00 H ATOM 76704 H16T PA 1846 112.491 131.582 38.019 1.00 0.00 H ATOM 76705 C115 PA 1846 112.965 131.272 35.916 1.00 0.00 C ATOM 76706 H15R PA 1846 114.042 131.149 36.044 1.00 0.00 H ATOM 76707 H15S PA 1846 112.938 132.342 35.697 1.00 0.00 H ATOM 76708 C114 PA 1846 112.424 130.643 34.570 1.00 0.00 C ATOM 76709 H14R PA 1846 112.527 129.556 34.595 1.00 0.00 H ATOM 76710 H14S PA 1846 113.041 131.052 33.766 1.00 0.00 H ATOM 76711 C113 PA 1846 110.951 131.006 34.387 1.00 0.00 C ATOM 76712 H13R PA 1846 110.764 132.029 34.721 1.00 0.00 H ATOM 76713 H13S PA 1846 110.337 130.477 35.118 1.00 0.00 H ATOM 76714 C112 PA 1846 110.392 130.668 32.994 1.00 0.00 C ATOM 76715 H12R PA 1846 110.606 129.606 32.855 1.00 0.00 H ATOM 76716 H12S PA 1846 110.953 131.246 32.258 1.00 0.00 H ATOM 76717 C111 PA 1846 108.859 131.044 32.818 1.00 0.00 C ATOM 76718 H11R PA 1846 108.277 130.598 33.628 1.00 0.00 H ATOM 76719 H11S PA 1846 108.497 130.610 31.884 1.00 0.00 H ATOM 76720 C110 PA 1846 108.479 132.544 32.819 1.00 0.00 C ATOM 76721 H10R PA 1846 108.910 133.154 33.616 1.00 0.00 H ATOM 76722 H10S PA 1846 107.432 132.711 33.079 1.00 0.00 H ATOM 76723 C19 PA 1846 108.892 133.194 31.504 1.00 0.00 C ATOM 76724 H9R PA 1846 109.601 132.649 30.876 1.00 0.00 H ATOM 76725 H9S PA 1846 109.370 134.089 31.909 1.00 0.00 H ATOM 76726 C18 PA 1846 107.824 133.913 30.727 1.00 0.00 C ATOM 76727 H8R PA 1846 108.192 134.777 30.170 1.00 0.00 H ATOM 76728 H8S PA 1846 107.118 134.290 31.470 1.00 0.00 H ATOM 76729 C17 PA 1846 107.050 133.005 29.697 1.00 0.00 C ATOM 76730 H7R PA 1846 106.513 132.226 30.243 1.00 0.00 H ATOM 76731 H7S PA 1846 107.723 132.619 28.929 1.00 0.00 H ATOM 76732 C16 PA 1846 106.003 133.802 28.956 1.00 0.00 C ATOM 76733 H6R PA 1846 106.416 134.772 28.671 1.00 0.00 H ATOM 76734 H6S PA 1846 105.270 134.102 29.707 1.00 0.00 H ATOM 76735 C15 PA 1846 105.483 133.109 27.702 1.00 0.00 C ATOM 76736 H5R PA 1846 106.362 132.990 27.065 1.00 0.00 H ATOM 76737 H5S PA 1846 104.774 133.741 27.163 1.00 0.00 H ATOM 76738 C14 PA 1846 104.730 131.748 27.902 1.00 0.00 C ATOM 76739 H4R PA 1846 103.862 131.874 28.553 1.00 0.00 H ATOM 76740 H4S PA 1846 105.307 131.052 28.514 1.00 0.00 H ATOM 76741 C13 PA 1846 104.343 130.937 26.642 1.00 0.00 C ATOM 76742 H3R PA 1846 103.783 130.017 26.824 1.00 0.00 H ATOM 76743 H3S PA 1846 105.199 130.584 26.062 1.00 0.00 H ATOM 76744 C12 PA 1846 103.289 131.588 25.818 1.00 0.00 C ATOM 76745 H2R PA 1846 103.455 132.616 25.491 1.00 0.00 H ATOM 76746 H2S PA 1846 102.379 131.727 26.405 1.00 0.00 H ATOM 76747 C11 PC 1847 103.119 130.905 24.503 1.00 0.00 C ATOM 76748 O12 PC 1847 104.051 130.788 23.703 1.00 0.00 O ATOM 76749 O11 PC 1847 101.841 130.604 24.238 1.00 0.00 O ATOM 76750 C1 PC 1847 101.577 129.801 23.054 1.00 0.00 C ATOM 76751 HR PC 1847 102.320 130.121 22.319 1.00 0.00 H ATOM 76752 HS PC 1847 100.566 129.872 22.646 1.00 0.00 H ATOM 76753 C2 PC 1847 101.891 128.301 23.341 1.00 0.00 C ATOM 76754 HX PC 1847 102.737 128.336 24.033 1.00 0.00 H ATOM 76755 C3 PC 1847 102.455 127.627 22.027 1.00 0.00 C ATOM 76756 HA PC 1847 102.663 126.565 22.184 1.00 0.00 H ATOM 76757 HB PC 1847 103.446 128.034 21.808 1.00 0.00 H ATOM 76758 O31 PC 1847 101.523 127.781 20.927 1.00 0.00 O ATOM 76759 P31 PC 1847 101.623 126.959 19.573 1.00 0.00 P ATOM 76760 O32 PC 1847 100.448 127.446 18.638 1.00 0.00 O ATOM 76761 C31 PC 1847 100.529 128.751 18.035 1.00 0.00 C ATOM 76762 H1A PC 1847 101.218 128.678 17.191 1.00 0.00 H ATOM 76763 H1B PC 1847 100.887 129.459 18.787 1.00 0.00 H ATOM 76764 C32 PC 1847 99.091 129.010 17.658 1.00 0.00 C ATOM 76765 H2A PC 1847 98.706 128.058 17.288 1.00 0.00 H ATOM 76766 H2B PC 1847 99.011 129.775 16.885 1.00 0.00 H ATOM 76767 N31 PC 1847 98.161 129.418 18.774 1.00 0.00 N ATOM 76768 C33 PC 1847 98.665 130.608 19.592 1.00 0.00 C ATOM 76769 H3A PC 1847 97.853 130.705 20.314 1.00 0.00 H ATOM 76770 H3B PC 1847 98.781 131.488 18.958 1.00 0.00 H ATOM 76771 H3C PC 1847 99.637 130.380 20.031 1.00 0.00 H ATOM 76772 C34 PC 1847 96.853 129.788 18.249 1.00 0.00 C ATOM 76773 H4A PC 1847 96.930 130.478 17.408 1.00 0.00 H ATOM 76774 H4B PC 1847 96.408 130.246 19.134 1.00 0.00 H ATOM 76775 H4C PC 1847 96.273 128.878 18.091 1.00 0.00 H ATOM 76776 C35 PC 1847 97.928 128.301 19.751 1.00 0.00 C ATOM 76777 H5A PC 1847 97.139 128.532 20.469 1.00 0.00 H ATOM 76778 H5B PC 1847 98.876 128.180 20.277 1.00 0.00 H ATOM 76779 H5C PC 1847 97.627 127.375 19.259 1.00 0.00 H ATOM 76780 O33 PC 1847 102.795 127.296 18.733 1.00 0.00 O ATOM 76781 O34 PC 1847 101.388 125.532 19.883 1.00 0.00 O ATOM 76782 O21 PC 1847 100.643 127.657 23.925 1.00 0.00 O ATOM 76783 C21 PC 1847 100.702 126.432 24.392 1.00 0.00 C ATOM 76784 O22 PC 1847 101.706 125.738 24.364 1.00 0.00 O ATOM 76785 C12 OL 1848 99.419 125.800 24.896 1.00 0.00 C ATOM 76786 H2R OL 1848 99.151 125.165 24.048 1.00 0.00 H ATOM 76787 H2S OL 1848 99.604 125.256 25.825 1.00 0.00 H ATOM 76788 C13 OL 1848 98.370 126.821 25.158 1.00 0.00 C ATOM 76789 H3R OL 1848 98.619 127.491 25.984 1.00 0.00 H ATOM 76790 H3S OL 1848 98.213 127.501 24.319 1.00 0.00 H ATOM 76791 C14 OL 1848 96.995 126.337 25.589 1.00 0.00 C ATOM 76792 H4R OL 1848 96.332 127.201 25.666 1.00 0.00 H ATOM 76793 H4S OL 1848 96.622 125.675 24.805 1.00 0.00 H ATOM 76794 C15 OL 1848 96.979 125.388 26.825 1.00 0.00 C ATOM 76795 H5R OL 1848 95.922 125.139 26.943 1.00 0.00 H ATOM 76796 H5S OL 1848 97.443 124.419 26.628 1.00 0.00 H ATOM 76797 C16 OL 1848 97.766 125.931 28.086 1.00 0.00 C ATOM 76798 H6R OL 1848 98.795 126.076 27.750 1.00 0.00 H ATOM 76799 H6S OL 1848 97.372 126.937 28.245 1.00 0.00 H ATOM 76800 C17 OL 1848 97.589 125.180 29.404 1.00 0.00 C ATOM 76801 H7R OL 1848 96.552 124.861 29.530 1.00 0.00 H ATOM 76802 H7S OL 1848 98.252 124.313 29.362 1.00 0.00 H ATOM 76803 C18 OL 1848 98.049 126.001 30.608 1.00 0.00 C ATOM 76804 H8R OL 1848 99.109 126.137 30.382 1.00 0.00 H ATOM 76805 H8S OL 1848 97.625 127.000 30.727 1.00 0.00 H ATOM 76806 C19 OL 1848 97.925 125.199 31.836 1.00 0.00 C ATOM 76807 H9R OL 1848 96.873 125.105 32.092 1.00 0.00 H ATOM 76808 C110 OL 1848 98.846 124.538 32.468 1.00 0.00 C ATOM 76809 H10R OL 1848 98.476 123.871 33.242 1.00 0.00 H ATOM 76810 C111 OL 1848 100.275 124.682 32.360 1.00 0.00 C ATOM 76811 H11R OL 1848 100.651 123.783 31.867 1.00 0.00 H ATOM 76812 H11S OL 1848 100.629 125.559 31.813 1.00 0.00 H ATOM 76813 C112 OL 1848 100.972 124.639 33.728 1.00 0.00 C ATOM 76814 H12R OL 1848 100.442 125.298 34.419 1.00 0.00 H ATOM 76815 H12S OL 1848 100.849 123.625 34.113 1.00 0.00 H ATOM 76816 C113 OL 1848 102.523 124.851 33.591 1.00 0.00 C ATOM 76817 H13R OL 1848 102.866 124.155 32.823 1.00 0.00 H ATOM 76818 H13S OL 1848 102.843 125.792 33.138 1.00 0.00 H ATOM 76819 C114 OL 1848 103.397 124.823 34.899 1.00 0.00 C ATOM 76820 H14R OL 1848 104.451 124.927 34.633 1.00 0.00 H ATOM 76821 H14S OL 1848 103.271 125.673 35.573 1.00 0.00 H ATOM 76822 C115 OL 1848 103.254 123.465 35.529 1.00 0.00 C ATOM 76823 H15R OL 1848 102.211 123.283 35.799 1.00 0.00 H ATOM 76824 H15S OL 1848 103.476 122.684 34.800 1.00 0.00 H ATOM 76825 C116 OL 1848 104.133 123.073 36.715 1.00 0.00 C ATOM 76826 H16R OL 1848 105.146 123.435 36.524 1.00 0.00 H ATOM 76827 H16S OL 1848 103.921 123.650 37.618 1.00 0.00 H ATOM 76828 C117 OL 1848 104.088 121.647 37.178 1.00 0.00 C ATOM 76829 H17R OL 1848 103.051 121.307 37.135 1.00 0.00 H ATOM 76830 H17S OL 1848 104.518 120.952 36.453 1.00 0.00 H ATOM 76831 C118 OL 1848 104.713 121.331 38.509 1.00 0.00 C ATOM 76832 H18R OL 1848 105.674 121.849 38.476 1.00 0.00 H ATOM 76833 H18S OL 1848 104.890 120.288 38.781 1.00 0.00 H ATOM 76834 H18T OL 1848 104.145 121.727 39.354 1.00 0.00 H TER 76835 OL 1848 ATOM 76835 C116 PA 1849 5.339 44.464 38.262 1.00 0.00 C ATOM 76836 H16R PA 1849 6.054 44.505 39.086 1.00 0.00 H ATOM 76837 H16S PA 1849 4.587 43.794 38.684 1.00 0.00 H ATOM 76838 H16T PA 1849 4.929 45.473 38.185 1.00 0.00 H ATOM 76839 C115 PA 1849 5.917 44.131 36.863 1.00 0.00 C ATOM 76840 H15R PA 1849 6.302 43.112 36.934 1.00 0.00 H ATOM 76841 H15S PA 1849 6.736 44.825 36.661 1.00 0.00 H ATOM 76842 C114 PA 1849 4.915 44.273 35.704 1.00 0.00 C ATOM 76843 H14R PA 1849 4.311 45.173 35.834 1.00 0.00 H ATOM 76844 H14S PA 1849 4.144 43.507 35.802 1.00 0.00 H ATOM 76845 C113 PA 1849 5.650 44.168 34.381 1.00 0.00 C ATOM 76846 H13R PA 1849 6.229 43.247 34.292 1.00 0.00 H ATOM 76847 H13S PA 1849 6.420 44.940 34.317 1.00 0.00 H ATOM 76848 C112 PA 1849 4.868 44.361 33.077 1.00 0.00 C ATOM 76849 H12R PA 1849 4.509 45.389 33.008 1.00 0.00 H ATOM 76850 H12S PA 1849 3.978 43.729 33.118 1.00 0.00 H ATOM 76851 C111 PA 1849 5.756 44.087 31.887 1.00 0.00 C ATOM 76852 H11R PA 1849 6.122 43.066 32.017 1.00 0.00 H ATOM 76853 H11S PA 1849 6.671 44.683 31.886 1.00 0.00 H ATOM 76854 C110 PA 1849 5.077 44.268 30.484 1.00 0.00 C ATOM 76855 H10R PA 1849 4.825 45.327 30.560 1.00 0.00 H ATOM 76856 H10S PA 1849 4.173 43.662 30.575 1.00 0.00 H ATOM 76857 C19 PA 1849 5.901 44.022 29.216 1.00 0.00 C ATOM 76858 H9R PA 1849 6.276 42.996 29.218 1.00 0.00 H ATOM 76859 H9S PA 1849 6.748 44.704 29.109 1.00 0.00 H ATOM 76860 C18 PA 1849 5.116 44.133 27.898 1.00 0.00 C ATOM 76861 H8R PA 1849 4.758 45.134 27.647 1.00 0.00 H ATOM 76862 H8S PA 1849 4.230 43.533 28.112 1.00 0.00 H ATOM 76863 C17 PA 1849 5.837 43.470 26.708 1.00 0.00 C ATOM 76864 H7R PA 1849 5.080 43.409 25.923 1.00 0.00 H ATOM 76865 H7S PA 1849 6.046 42.431 26.971 1.00 0.00 H ATOM 76866 C16 PA 1849 7.112 44.166 26.312 1.00 0.00 C ATOM 76867 H6R PA 1849 7.778 44.257 27.172 1.00 0.00 H ATOM 76868 H6S PA 1849 6.825 45.199 26.103 1.00 0.00 H ATOM 76869 C15 PA 1849 7.779 43.606 25.078 1.00 0.00 C ATOM 76870 H5R PA 1849 7.020 43.550 24.295 1.00 0.00 H ATOM 76871 H5S PA 1849 8.033 42.576 25.334 1.00 0.00 H ATOM 76872 C14 PA 1849 9.000 44.354 24.468 1.00 0.00 C ATOM 76873 H4R PA 1849 9.865 44.204 25.117 1.00 0.00 H ATOM 76874 H4S PA 1849 8.857 45.427 24.606 1.00 0.00 H ATOM 76875 C13 PA 1849 9.386 43.935 23.061 1.00 0.00 C ATOM 76876 H3R PA 1849 8.732 44.321 22.276 1.00 0.00 H ATOM 76877 H3S PA 1849 9.313 42.853 22.927 1.00 0.00 H ATOM 76878 C12 PA 1849 10.670 44.611 22.547 1.00 0.00 C ATOM 76879 H2R PA 1849 11.498 44.468 23.244 1.00 0.00 H ATOM 76880 H2S PA 1849 10.655 45.695 22.414 1.00 0.00 H ATOM 76881 C11 PGR 1850 11.055 44.064 21.263 1.00 0.00 C ATOM 76882 O12 PGR 1850 10.329 44.215 20.307 1.00 0.00 O ATOM 76883 O11 PGR 1850 12.237 43.369 21.305 1.00 0.00 O ATOM 76884 C1 PGR 1850 12.785 42.886 20.068 1.00 0.00 C ATOM 76885 HR PGR 1850 13.082 43.716 19.422 1.00 0.00 H ATOM 76886 HS PGR 1850 12.028 42.305 19.536 1.00 0.00 H ATOM 76887 C2 PGR 1850 14.071 42.122 20.367 1.00 0.00 C ATOM 76888 HX PGR 1850 14.842 42.754 20.813 1.00 0.00 H ATOM 76889 C3 PGR 1850 14.514 41.453 19.041 1.00 0.00 C ATOM 76890 HA PGR 1850 15.223 40.648 19.253 1.00 0.00 H ATOM 76891 HB PGR 1850 14.781 42.299 18.403 1.00 0.00 H ATOM 76892 O31 PGR 1850 13.303 40.824 18.479 1.00 0.00 O ATOM 76893 P31 PGR 1850 13.159 40.307 16.913 1.00 0.00 P ATOM 76894 O32 PGR 1850 13.322 41.645 15.924 1.00 0.00 O ATOM 76895 C31 PGR 1850 14.505 42.020 15.219 1.00 0.00 C ATOM 76896 H1A PGR 1850 14.837 41.201 14.576 1.00 0.00 H ATOM 76897 H1B PGR 1850 15.372 42.221 15.855 1.00 0.00 H ATOM 76898 C32 PGR 1850 14.236 43.184 14.200 1.00 0.00 C ATOM 76899 H2A PGR 1850 13.684 43.991 14.689 1.00 0.00 H ATOM 76900 O35 PGR 1850 13.467 42.722 13.072 1.00 0.00 O ATOM 76901 HO5A PGR 1850 13.407 43.483 12.467 1.00 0.00 H ATOM 76902 C33 PGR 1850 15.539 43.851 13.694 1.00 0.00 C ATOM 76903 H3A PGR 1850 15.255 44.637 12.990 1.00 0.00 H ATOM 76904 H3B PGR 1850 16.063 44.361 14.506 1.00 0.00 H ATOM 76905 O33 PGR 1850 14.281 39.407 16.689 1.00 0.00 O ATOM 76906 O34 PGR 1850 11.854 39.618 16.705 1.00 0.00 O ATOM 76907 O21 PGR 1850 13.732 41.007 21.246 1.00 0.00 O ATOM 76908 C21 PGR 1850 13.841 41.264 22.603 1.00 0.00 C ATOM 76909 O22 PGR 1850 14.436 42.218 23.085 1.00 0.00 O ATOM 76910 O36 PGR 1850 16.488 42.954 13.059 1.00 0.00 O ATOM 76911 HO6A PGR 1850 16.047 42.351 12.434 1.00 0.00 H ATOM 76912 C12 OL 1851 12.974 40.324 23.363 1.00 0.00 C ATOM 76913 H2R OL 1851 12.084 40.877 23.671 1.00 0.00 H ATOM 76914 H2S OL 1851 12.520 39.592 22.691 1.00 0.00 H ATOM 76915 C13 OL 1851 13.666 39.649 24.552 1.00 0.00 C ATOM 76916 H3R OL 1851 14.476 39.073 24.099 1.00 0.00 H ATOM 76917 H3S OL 1851 14.121 40.373 25.231 1.00 0.00 H ATOM 76918 C14 OL 1851 12.673 38.801 25.367 1.00 0.00 C ATOM 76919 H4R OL 1851 12.437 37.906 24.789 1.00 0.00 H ATOM 76920 H4S OL 1851 13.166 38.334 26.222 1.00 0.00 H ATOM 76921 C15 OL 1851 11.346 39.327 25.923 1.00 0.00 C ATOM 76922 H5R OL 1851 10.640 39.460 25.100 1.00 0.00 H ATOM 76923 H5S OL 1851 10.920 38.602 26.619 1.00 0.00 H ATOM 76924 C16 OL 1851 11.454 40.564 26.720 1.00 0.00 C ATOM 76925 H6R OL 1851 11.959 40.315 27.655 1.00 0.00 H ATOM 76926 H6S OL 1851 12.121 41.221 26.158 1.00 0.00 H ATOM 76927 C17 OL 1851 10.194 41.241 27.205 1.00 0.00 C ATOM 76928 H7R OL 1851 9.585 41.679 26.411 1.00 0.00 H ATOM 76929 H7S OL 1851 9.556 40.475 27.650 1.00 0.00 H ATOM 76930 C18 OL 1851 10.540 42.202 28.273 1.00 0.00 C ATOM 76931 H8R OL 1851 11.261 41.752 28.958 1.00 0.00 H ATOM 76932 H8S OL 1851 10.913 43.043 27.685 1.00 0.00 H ATOM 76933 C19 OL 1851 9.452 42.768 29.051 1.00 0.00 C ATOM 76934 H9R OL 1851 8.694 43.323 28.505 1.00 0.00 H ATOM 76935 C110 OL 1851 9.295 42.747 30.393 1.00 0.00 C ATOM 76936 H10R OL 1851 8.455 43.253 30.861 1.00 0.00 H ATOM 76937 C111 OL 1851 10.210 42.028 31.387 1.00 0.00 C ATOM 76938 H11R OL 1851 9.634 41.264 31.913 1.00 0.00 H ATOM 76939 H11S OL 1851 11.126 41.684 30.902 1.00 0.00 H ATOM 76940 C112 OL 1851 10.671 42.975 32.501 1.00 0.00 C ATOM 76941 H12R OL 1851 11.630 43.388 32.181 1.00 0.00 H ATOM 76942 H12S OL 1851 9.985 43.823 32.540 1.00 0.00 H ATOM 76943 C113 OL 1851 10.730 42.438 33.909 1.00 0.00 C ATOM 76944 H13R OL 1851 9.747 42.168 34.302 1.00 0.00 H ATOM 76945 H13S OL 1851 11.393 41.570 33.891 1.00 0.00 H ATOM 76946 C114 OL 1851 11.395 43.405 34.936 1.00 0.00 C ATOM 76947 H14R OL 1851 12.423 43.695 34.705 1.00 0.00 H ATOM 76948 H14S OL 1851 10.841 44.338 35.054 1.00 0.00 H ATOM 76949 C115 OL 1851 11.409 42.714 36.294 1.00 0.00 C ATOM 76950 H15R OL 1851 11.059 43.514 36.949 1.00 0.00 H ATOM 76951 H15S OL 1851 10.646 41.935 36.353 1.00 0.00 H ATOM 76952 C116 OL 1851 12.735 42.015 36.573 1.00 0.00 C ATOM 76953 H16R OL 1851 12.868 41.085 36.016 1.00 0.00 H ATOM 76954 H16S OL 1851 13.568 42.668 36.305 1.00 0.00 H ATOM 76955 C117 OL 1851 12.854 41.547 38.036 1.00 0.00 C ATOM 76956 H17R OL 1851 12.555 42.369 38.690 1.00 0.00 H ATOM 76957 H17S OL 1851 12.242 40.676 38.279 1.00 0.00 H ATOM 76958 C118 OL 1851 14.359 41.286 38.373 1.00 0.00 C ATOM 76959 H18R OL 1851 14.453 41.342 39.460 1.00 0.00 H ATOM 76960 H18S OL 1851 15.069 42.021 37.988 1.00 0.00 H ATOM 76961 H18T OL 1851 14.791 40.313 38.128 1.00 0.00 H TER 76962 OL 1851 ATOM 76962 C116 PA 1852 26.017 134.703 41.604 1.00 0.00 C ATOM 76963 H16R PA 1852 25.748 133.732 42.025 1.00 0.00 H ATOM 76964 H16S PA 1852 25.048 135.195 41.490 1.00 0.00 H ATOM 76965 H16T PA 1852 26.567 135.237 42.382 1.00 0.00 H ATOM 76966 C115 PA 1852 26.761 134.626 40.172 1.00 0.00 C ATOM 76967 H15R PA 1852 26.193 134.158 39.366 1.00 0.00 H ATOM 76968 H15S PA 1852 27.698 134.112 40.393 1.00 0.00 H ATOM 76969 C114 PA 1852 27.123 136.006 39.706 1.00 0.00 C ATOM 76970 H14R PA 1852 27.533 135.923 38.698 1.00 0.00 H ATOM 76971 H14S PA 1852 27.966 136.320 40.326 1.00 0.00 H ATOM 76972 C113 PA 1852 26.156 137.143 39.719 1.00 0.00 C ATOM 76973 H13R PA 1852 26.094 137.670 40.673 1.00 0.00 H ATOM 76974 H13S PA 1852 25.153 136.769 39.502 1.00 0.00 H ATOM 76975 C112 PA 1852 26.426 138.183 38.690 1.00 0.00 C ATOM 76976 H12R PA 1852 27.405 138.585 38.958 1.00 0.00 H ATOM 76977 H12S PA 1852 25.735 139.004 38.894 1.00 0.00 H ATOM 76978 C111 PA 1852 26.168 137.751 37.226 1.00 0.00 C ATOM 76979 H11R PA 1852 25.317 137.072 37.135 1.00 0.00 H ATOM 76980 H11S PA 1852 27.056 137.263 36.820 1.00 0.00 H ATOM 76981 C110 PA 1852 25.867 138.869 36.271 1.00 0.00 C ATOM 76982 H10R PA 1852 26.666 139.613 36.265 1.00 0.00 H ATOM 76983 H10S PA 1852 24.961 139.324 36.677 1.00 0.00 H ATOM 76984 C19 PA 1852 25.440 138.472 34.831 1.00 0.00 C ATOM 76985 H9R PA 1852 24.621 137.750 34.816 1.00 0.00 H ATOM 76986 H9S PA 1852 26.326 137.995 34.408 1.00 0.00 H ATOM 76987 C18 PA 1852 25.032 139.714 33.967 1.00 0.00 C ATOM 76988 H8R PA 1852 25.925 140.314 33.779 1.00 0.00 H ATOM 76989 H8S PA 1852 24.495 140.455 34.563 1.00 0.00 H ATOM 76990 C17 PA 1852 24.528 139.433 32.542 1.00 0.00 C ATOM 76991 H7R PA 1852 24.582 140.411 32.057 1.00 0.00 H ATOM 76992 H7S PA 1852 23.473 139.159 32.468 1.00 0.00 H ATOM 76993 C16 PA 1852 25.342 138.404 31.649 1.00 0.00 C ATOM 76994 H6R PA 1852 25.099 137.372 31.907 1.00 0.00 H ATOM 76995 H6S PA 1852 26.422 138.526 31.755 1.00 0.00 H ATOM 76996 C15 PA 1852 24.864 138.562 30.133 1.00 0.00 C ATOM 76997 H5R PA 1852 25.392 139.390 29.656 1.00 0.00 H ATOM 76998 H5S PA 1852 23.880 139.035 30.105 1.00 0.00 H ATOM 76999 C14 PA 1852 25.096 137.370 29.225 1.00 0.00 C ATOM 77000 H4R PA 1852 26.132 137.092 29.431 1.00 0.00 H ATOM 77001 H4S PA 1852 25.044 137.653 28.171 1.00 0.00 H ATOM 77002 C13 PA 1852 24.084 136.262 29.487 1.00 0.00 C ATOM 77003 H3R PA 1852 23.014 136.462 29.400 1.00 0.00 H ATOM 77004 H3S PA 1852 24.204 135.998 30.540 1.00 0.00 H ATOM 77005 C12 PA 1852 24.460 134.997 28.702 1.00 0.00 C ATOM 77006 H2R PA 1852 23.816 134.145 28.928 1.00 0.00 H ATOM 77007 H2S PA 1852 25.457 134.738 29.064 1.00 0.00 H ATOM 77008 C11 PGR 1853 24.464 135.182 27.160 1.00 0.00 C ATOM 77009 O12 PGR 1853 23.559 134.897 26.431 1.00 0.00 O ATOM 77010 O11 PGR 1853 25.575 135.842 26.787 1.00 0.00 O ATOM 77011 C1 PGR 1853 25.699 136.201 25.393 1.00 0.00 C ATOM 77012 HR PGR 1853 25.998 137.246 25.508 1.00 0.00 H ATOM 77013 HS PGR 1853 24.829 136.008 24.761 1.00 0.00 H ATOM 77014 C2 PGR 1853 26.947 135.453 24.834 1.00 0.00 C ATOM 77015 HX PGR 1853 27.834 135.920 25.270 1.00 0.00 H ATOM 77016 C3 PGR 1853 26.985 135.514 23.297 1.00 0.00 C ATOM 77017 HA PGR 1853 27.756 134.800 22.997 1.00 0.00 H ATOM 77018 HB PGR 1853 27.322 136.509 22.996 1.00 0.00 H ATOM 77019 O31 PGR 1853 25.733 135.287 22.730 1.00 0.00 O ATOM 77020 P31 PGR 1853 25.592 135.575 21.106 1.00 0.00 P ATOM 77021 O32 PGR 1853 25.517 134.159 20.626 1.00 0.00 O ATOM 77022 C31 PGR 1853 24.376 133.322 20.849 1.00 0.00 C ATOM 77023 H1A PGR 1853 24.342 132.631 20.002 1.00 0.00 H ATOM 77024 H1B PGR 1853 23.471 133.924 20.736 1.00 0.00 H ATOM 77025 C32 PGR 1853 24.278 132.493 22.163 1.00 0.00 C ATOM 77026 H2A PGR 1853 23.349 131.932 22.032 1.00 0.00 H ATOM 77027 O35 PGR 1853 24.264 133.173 23.433 1.00 0.00 O ATOM 77028 HO5A PGR 1853 25.168 133.537 23.442 1.00 0.00 H ATOM 77029 C33 PGR 1853 25.473 131.549 22.174 1.00 0.00 C ATOM 77030 H3A PGR 1853 25.364 130.868 23.022 1.00 0.00 H ATOM 77031 H3B PGR 1853 25.446 130.999 21.230 1.00 0.00 H ATOM 77032 O33 PGR 1853 24.353 136.374 20.921 1.00 0.00 O ATOM 77033 O34 PGR 1853 26.862 136.100 20.611 1.00 0.00 O ATOM 77034 O21 PGR 1853 26.875 134.074 25.318 1.00 0.00 O ATOM 77035 C21 PGR 1853 28.056 133.398 25.250 1.00 0.00 C ATOM 77036 O22 PGR 1853 29.115 133.822 24.800 1.00 0.00 O ATOM 77037 O36 PGR 1853 26.648 132.365 22.277 1.00 0.00 O ATOM 77038 HO6A PGR 1853 26.465 133.225 21.857 1.00 0.00 H ATOM 77039 C12 OL 1854 28.135 132.144 26.071 1.00 0.00 C ATOM 77040 H2R OL 1854 27.128 131.735 26.179 1.00 0.00 H ATOM 77041 H2S OL 1854 28.722 131.385 25.550 1.00 0.00 H ATOM 77042 C13 OL 1854 28.662 132.444 27.544 1.00 0.00 C ATOM 77043 H3R OL 1854 28.886 131.478 28.002 1.00 0.00 H ATOM 77044 H3S OL 1854 29.606 132.986 27.460 1.00 0.00 H ATOM 77045 C14 OL 1854 27.762 133.292 28.389 1.00 0.00 C ATOM 77046 H4R OL 1854 27.584 134.207 27.821 1.00 0.00 H ATOM 77047 H4S OL 1854 26.841 132.705 28.383 1.00 0.00 H ATOM 77048 C15 OL 1854 28.379 133.534 29.820 1.00 0.00 C ATOM 77049 H5R OL 1854 28.651 132.519 30.117 1.00 0.00 H ATOM 77050 H5S OL 1854 29.210 134.236 29.729 1.00 0.00 H ATOM 77051 C16 OL 1854 27.395 134.074 30.913 1.00 0.00 C ATOM 77052 H6R OL 1854 27.073 135.076 30.621 1.00 0.00 H ATOM 77053 H6S OL 1854 26.485 133.472 30.889 1.00 0.00 H ATOM 77054 C17 OL 1854 28.122 134.017 32.233 1.00 0.00 C ATOM 77055 H7R OL 1854 28.585 133.032 32.321 1.00 0.00 H ATOM 77056 H7S OL 1854 28.898 134.785 32.254 1.00 0.00 H ATOM 77057 C18 OL 1854 27.124 134.186 33.408 1.00 0.00 C ATOM 77058 H8R OL 1854 26.782 135.220 33.327 1.00 0.00 H ATOM 77059 H8S OL 1854 26.229 133.572 33.290 1.00 0.00 H ATOM 77060 C19 OL 1854 27.624 133.881 34.750 1.00 0.00 C ATOM 77061 H9R OL 1854 28.498 134.511 34.893 1.00 0.00 H ATOM 77062 C110 OL 1854 27.106 133.125 35.742 1.00 0.00 C ATOM 77063 H10R OL 1854 27.633 133.158 36.692 1.00 0.00 H ATOM 77064 C111 OL 1854 25.911 132.109 35.662 1.00 0.00 C ATOM 77065 H11R OL 1854 25.268 132.226 34.787 1.00 0.00 H ATOM 77066 H11S OL 1854 26.289 131.084 35.674 1.00 0.00 H ATOM 77067 C112 OL 1854 25.046 132.375 36.904 1.00 0.00 C ATOM 77068 H12R OL 1854 25.698 132.373 37.780 1.00 0.00 H ATOM 77069 H12S OL 1854 24.772 133.429 36.990 1.00 0.00 H ATOM 77070 C113 OL 1854 23.862 131.467 37.160 1.00 0.00 C ATOM 77071 H13R OL 1854 24.228 130.635 37.765 1.00 0.00 H ATOM 77072 H13S OL 1854 23.271 132.059 37.861 1.00 0.00 H ATOM 77073 C114 OL 1854 22.940 131.095 35.903 1.00 0.00 C ATOM 77074 H14R OL 1854 22.691 132.004 35.352 1.00 0.00 H ATOM 77075 H14S OL 1854 23.602 130.570 35.210 1.00 0.00 H ATOM 77076 C115 OL 1854 21.618 130.383 36.344 1.00 0.00 C ATOM 77077 H15R OL 1854 21.071 130.201 35.417 1.00 0.00 H ATOM 77078 H15S OL 1854 21.807 129.415 36.812 1.00 0.00 H ATOM 77079 C116 OL 1854 20.619 131.132 37.179 1.00 0.00 C ATOM 77080 H16R OL 1854 19.815 130.400 37.280 1.00 0.00 H ATOM 77081 H16S OL 1854 21.012 131.249 38.191 1.00 0.00 H ATOM 77082 C117 OL 1854 19.899 132.341 36.629 1.00 0.00 C ATOM 77083 H17R OL 1854 20.646 133.074 36.317 1.00 0.00 H ATOM 77084 H17S OL 1854 19.336 131.947 35.780 1.00 0.00 H ATOM 77085 C118 OL 1854 18.910 133.058 37.575 1.00 0.00 C ATOM 77086 H18R OL 1854 19.435 133.296 38.503 1.00 0.00 H ATOM 77087 H18S OL 1854 18.117 132.334 37.768 1.00 0.00 H ATOM 77088 H18T OL 1854 18.367 133.852 37.057 1.00 0.00 H TER 77089 OL 1854 ATOM 77089 C116 PA 1855 12.436 14.394 35.912 1.00 0.00 C ATOM 77090 H16R PA 1855 11.379 14.211 35.707 1.00 0.00 H ATOM 77091 H16S PA 1855 12.834 13.771 36.716 1.00 0.00 H ATOM 77092 H16T PA 1855 13.031 14.321 34.999 1.00 0.00 H ATOM 77093 C115 PA 1855 12.535 15.881 36.420 1.00 0.00 C ATOM 77094 H15R PA 1855 12.633 16.571 35.580 1.00 0.00 H ATOM 77095 H15S PA 1855 13.430 15.977 37.039 1.00 0.00 H ATOM 77096 C114 PA 1855 11.397 16.312 37.326 1.00 0.00 C ATOM 77097 H14R PA 1855 11.199 15.608 38.136 1.00 0.00 H ATOM 77098 H14S PA 1855 10.619 16.278 36.560 1.00 0.00 H ATOM 77099 C113 PA 1855 11.472 17.723 37.795 1.00 0.00 C ATOM 77100 H13R PA 1855 12.335 17.900 38.440 1.00 0.00 H ATOM 77101 H13S PA 1855 10.539 17.841 38.351 1.00 0.00 H ATOM 77102 C112 PA 1855 11.526 18.873 36.761 1.00 0.00 C ATOM 77103 H12R PA 1855 12.442 18.679 36.199 1.00 0.00 H ATOM 77104 H12S PA 1855 11.519 19.848 37.251 1.00 0.00 H ATOM 77105 C111 PA 1855 10.361 18.861 35.762 1.00 0.00 C ATOM 77106 H11R PA 1855 9.475 19.349 36.174 1.00 0.00 H ATOM 77107 H11S PA 1855 10.076 17.828 35.555 1.00 0.00 H ATOM 77108 C110 PA 1855 10.619 19.648 34.543 1.00 0.00 C ATOM 77109 H10R PA 1855 11.386 19.141 33.954 1.00 0.00 H ATOM 77110 H10S PA 1855 10.916 20.638 34.894 1.00 0.00 H ATOM 77111 C19 PA 1855 9.459 19.915 33.608 1.00 0.00 C ATOM 77112 H9R PA 1855 8.753 20.447 34.249 1.00 0.00 H ATOM 77113 H9S PA 1855 8.817 19.098 33.271 1.00 0.00 H ATOM 77114 C18 PA 1855 9.746 20.823 32.324 1.00 0.00 C ATOM 77115 H8R PA 1855 9.975 21.821 32.704 1.00 0.00 H ATOM 77116 H8S PA 1855 8.789 21.001 31.830 1.00 0.00 H ATOM 77117 C17 PA 1855 10.671 20.297 31.175 1.00 0.00 C ATOM 77118 H7R PA 1855 11.013 19.302 31.467 1.00 0.00 H ATOM 77119 H7S PA 1855 11.562 20.923 31.258 1.00 0.00 H ATOM 77120 C16 PA 1855 10.166 20.341 29.716 1.00 0.00 C ATOM 77121 H6R PA 1855 9.421 19.545 29.650 1.00 0.00 H ATOM 77122 H6S PA 1855 10.911 20.053 28.972 1.00 0.00 H ATOM 77123 C15 PA 1855 9.580 21.672 29.247 1.00 0.00 C ATOM 77124 H5R PA 1855 8.638 21.935 29.731 1.00 0.00 H ATOM 77125 H5S PA 1855 9.280 21.547 28.204 1.00 0.00 H ATOM 77126 C14 PA 1855 10.473 22.905 29.398 1.00 0.00 C ATOM 77127 H4R PA 1855 10.781 23.002 30.441 1.00 0.00 H ATOM 77128 H4S PA 1855 10.054 23.772 28.883 1.00 0.00 H ATOM 77129 C13 PA 1855 11.844 22.845 28.707 1.00 0.00 C ATOM 77130 H3R PA 1855 12.509 22.091 29.133 1.00 0.00 H ATOM 77131 H3S PA 1855 12.433 23.763 28.774 1.00 0.00 H ATOM 77132 C12 PA 1855 11.692 22.526 27.254 1.00 0.00 C ATOM 77133 H2R PA 1855 10.961 23.171 26.762 1.00 0.00 H ATOM 77134 H2S PA 1855 11.366 21.512 27.014 1.00 0.00 H ATOM 77135 C11 PGR 1856 12.922 22.691 26.521 1.00 0.00 C ATOM 77136 O12 PGR 1856 12.948 22.483 25.322 1.00 0.00 O ATOM 77137 O11 PGR 1856 14.015 23.211 27.110 1.00 0.00 O ATOM 77138 C1 PGR 1856 15.354 23.176 26.409 1.00 0.00 C ATOM 77139 HR PGR 1856 15.259 22.358 25.690 1.00 0.00 H ATOM 77140 HS PGR 1856 16.214 23.043 27.070 1.00 0.00 H ATOM 77141 C2 PGR 1856 15.535 24.445 25.506 1.00 0.00 C ATOM 77142 HX PGR 1856 14.749 24.466 24.746 1.00 0.00 H ATOM 77143 C3 PGR 1856 16.916 24.555 24.823 1.00 0.00 C ATOM 77144 HA PGR 1856 17.051 23.627 24.260 1.00 0.00 H ATOM 77145 HB PGR 1856 17.799 24.768 25.431 1.00 0.00 H ATOM 77146 O31 PGR 1856 16.900 25.501 23.771 1.00 0.00 O ATOM 77147 P31 PGR 1856 18.152 25.470 22.763 1.00 0.00 P ATOM 77148 O32 PGR 1856 17.719 26.734 21.873 1.00 0.00 O ATOM 77149 C31 PGR 1856 18.000 28.025 22.245 1.00 0.00 C ATOM 77150 H1A PGR 1856 19.022 28.324 21.996 1.00 0.00 H ATOM 77151 H1B PGR 1856 17.846 28.131 23.322 1.00 0.00 H ATOM 77152 C32 PGR 1856 17.137 29.094 21.645 1.00 0.00 C ATOM 77153 H2A PGR 1856 16.071 28.893 21.780 1.00 0.00 H ATOM 77154 O35 PGR 1856 17.366 29.104 20.262 1.00 0.00 O ATOM 77155 HO5A PGR 1856 17.272 30.048 20.043 1.00 0.00 H ATOM 77156 C33 PGR 1856 17.526 30.459 22.184 1.00 0.00 C ATOM 77157 H3A PGR 1856 16.934 31.264 21.740 1.00 0.00 H ATOM 77158 H3B PGR 1856 17.380 30.513 23.266 1.00 0.00 H ATOM 77159 O33 PGR 1856 19.402 25.732 23.569 1.00 0.00 O ATOM 77160 O34 PGR 1856 18.091 24.264 21.918 1.00 0.00 O ATOM 77161 O21 PGR 1856 15.373 25.551 26.366 1.00 0.00 O ATOM 77162 C21 PGR 1856 14.191 26.121 26.654 1.00 0.00 C ATOM 77163 O22 PGR 1856 13.059 25.745 26.309 1.00 0.00 O ATOM 77164 O36 PGR 1856 18.851 30.857 21.979 1.00 0.00 O ATOM 77165 HO6A PGR 1856 19.110 30.844 21.041 1.00 0.00 H ATOM 77166 C12 OL 1857 14.256 27.372 27.543 1.00 0.00 C ATOM 77167 H2R OL 1857 15.235 27.854 27.527 1.00 0.00 H ATOM 77168 H2S OL 1857 13.617 28.120 27.069 1.00 0.00 H ATOM 77169 C13 OL 1857 13.779 27.086 29.055 1.00 0.00 C ATOM 77170 H3R OL 1857 13.883 27.970 29.689 1.00 0.00 H ATOM 77171 H3S OL 1857 12.725 26.816 29.153 1.00 0.00 H ATOM 77172 C14 OL 1857 14.623 26.023 29.775 1.00 0.00 C ATOM 77173 H4R OL 1857 14.888 25.185 29.126 1.00 0.00 H ATOM 77174 H4S OL 1857 15.596 26.372 30.126 1.00 0.00 H ATOM 77175 C15 OL 1857 13.810 25.465 30.938 1.00 0.00 C ATOM 77176 H5R OL 1857 13.402 26.301 31.511 1.00 0.00 H ATOM 77177 H5S OL 1857 12.977 24.945 30.461 1.00 0.00 H ATOM 77178 C16 OL 1857 14.565 24.571 31.905 1.00 0.00 C ATOM 77179 H6R OL 1857 15.334 24.097 31.292 1.00 0.00 H ATOM 77180 H6S OL 1857 15.053 25.237 32.619 1.00 0.00 H ATOM 77181 C17 OL 1857 13.764 23.492 32.628 1.00 0.00 C ATOM 77182 H7R OL 1857 13.051 24.068 33.221 1.00 0.00 H ATOM 77183 H7S OL 1857 13.191 22.921 31.895 1.00 0.00 H ATOM 77184 C18 OL 1857 14.603 22.527 33.483 1.00 0.00 C ATOM 77185 H8R OL 1857 14.906 21.731 32.800 1.00 0.00 H ATOM 77186 H8S OL 1857 15.454 23.041 33.935 1.00 0.00 H ATOM 77187 C19 OL 1857 13.824 21.867 34.614 1.00 0.00 C ATOM 77188 H9R OL 1857 13.321 20.922 34.424 1.00 0.00 H ATOM 77189 C110 OL 1857 13.701 22.249 35.917 1.00 0.00 C ATOM 77190 H10R OL 1857 13.172 21.616 36.624 1.00 0.00 H ATOM 77191 C111 OL 1857 14.516 23.345 36.585 1.00 0.00 C ATOM 77192 H11R OL 1857 15.110 22.929 37.402 1.00 0.00 H ATOM 77193 H11S OL 1857 15.212 23.856 35.916 1.00 0.00 H ATOM 77194 C112 OL 1857 13.741 24.360 37.420 1.00 0.00 C ATOM 77195 H12R OL 1857 12.877 23.867 37.870 1.00 0.00 H ATOM 77196 H12S OL 1857 14.378 24.707 38.237 1.00 0.00 H ATOM 77197 C113 OL 1857 13.336 25.661 36.671 1.00 0.00 C ATOM 77198 H13R OL 1857 14.183 26.075 36.120 1.00 0.00 H ATOM 77199 H13S OL 1857 12.613 25.260 35.958 1.00 0.00 H ATOM 77200 C114 OL 1857 12.713 26.780 37.510 1.00 0.00 C ATOM 77201 H14R OL 1857 12.117 26.380 38.333 1.00 0.00 H ATOM 77202 H14S OL 1857 13.513 27.261 38.078 1.00 0.00 H ATOM 77203 C115 OL 1857 12.021 27.738 36.648 1.00 0.00 C ATOM 77204 H15R OL 1857 11.124 27.252 36.258 1.00 0.00 H ATOM 77205 H15S OL 1857 11.527 28.498 37.256 1.00 0.00 H ATOM 77206 C116 OL 1857 12.812 28.333 35.520 1.00 0.00 C ATOM 77207 H16R OL 1857 13.747 28.697 35.950 1.00 0.00 H ATOM 77208 H16S OL 1857 13.020 27.508 34.834 1.00 0.00 H ATOM 77209 C117 OL 1857 12.037 29.339 34.701 1.00 0.00 C ATOM 77210 H17R OL 1857 10.971 29.117 34.621 1.00 0.00 H ATOM 77211 H17S OL 1857 12.081 30.278 35.258 1.00 0.00 H ATOM 77212 C118 OL 1857 12.662 29.554 33.301 1.00 0.00 C ATOM 77213 H18R OL 1857 11.939 30.232 32.843 1.00 0.00 H ATOM 77214 H18S OL 1857 12.912 28.632 32.771 1.00 0.00 H ATOM 77215 H18T OL 1857 13.577 30.130 33.456 1.00 0.00 H TER 77216 OL 1857 ATOM 77216 C116 PA 1858 40.798 13.194 37.878 1.00 0.00 C ATOM 77217 H16R PA 1858 40.394 12.347 38.436 1.00 0.00 H ATOM 77218 H16S PA 1858 40.526 13.072 36.827 1.00 0.00 H ATOM 77219 H16T PA 1858 40.253 14.076 38.222 1.00 0.00 H ATOM 77220 C115 PA 1858 42.238 13.276 37.923 1.00 0.00 C ATOM 77221 H15R PA 1858 42.619 12.257 37.829 1.00 0.00 H ATOM 77222 H15S PA 1858 42.573 13.540 38.928 1.00 0.00 H ATOM 77223 C114 PA 1858 42.905 14.201 36.887 1.00 0.00 C ATOM 77224 H14R PA 1858 42.400 15.168 36.926 1.00 0.00 H ATOM 77225 H14S PA 1858 42.666 13.744 35.924 1.00 0.00 H ATOM 77226 C113 PA 1858 44.427 14.411 37.146 1.00 0.00 C ATOM 77227 H13R PA 1858 44.523 14.867 38.134 1.00 0.00 H ATOM 77228 H13S PA 1858 44.956 14.974 36.374 1.00 0.00 H ATOM 77229 C112 PA 1858 45.181 13.089 37.456 1.00 0.00 C ATOM 77230 H12R PA 1858 44.847 12.823 38.461 1.00 0.00 H ATOM 77231 H12S PA 1858 46.252 13.276 37.560 1.00 0.00 H ATOM 77232 C111 PA 1858 44.985 12.001 36.466 1.00 0.00 C ATOM 77233 H11R PA 1858 43.932 11.715 36.437 1.00 0.00 H ATOM 77234 H11S PA 1858 45.496 11.109 36.835 1.00 0.00 H ATOM 77235 C110 PA 1858 45.521 12.295 35.085 1.00 0.00 C ATOM 77236 H10R PA 1858 46.456 12.846 35.208 1.00 0.00 H ATOM 77237 H10S PA 1858 44.833 12.968 34.569 1.00 0.00 H ATOM 77238 C19 PA 1858 45.803 11.141 34.154 1.00 0.00 C ATOM 77239 H9R PA 1858 44.940 10.472 34.138 1.00 0.00 H ATOM 77240 H9S PA 1858 46.643 10.560 34.539 1.00 0.00 H ATOM 77241 C18 PA 1858 45.972 11.523 32.723 1.00 0.00 C ATOM 77242 H8R PA 1858 46.774 12.252 32.589 1.00 0.00 H ATOM 77243 H8S PA 1858 45.103 12.135 32.472 1.00 0.00 H ATOM 77244 C17 PA 1858 46.151 10.307 31.807 1.00 0.00 C ATOM 77245 H7R PA 1858 45.554 9.486 32.208 1.00 0.00 H ATOM 77246 H7S PA 1858 47.200 10.050 31.973 1.00 0.00 H ATOM 77247 C16 PA 1858 45.970 10.543 30.318 1.00 0.00 C ATOM 77248 H6R PA 1858 46.485 11.449 29.993 1.00 0.00 H ATOM 77249 H6S PA 1858 44.916 10.696 30.075 1.00 0.00 H ATOM 77250 C15 PA 1858 46.426 9.319 29.484 1.00 0.00 C ATOM 77251 H5R PA 1858 45.917 8.405 29.795 1.00 0.00 H ATOM 77252 H5S PA 1858 47.454 9.041 29.726 1.00 0.00 H ATOM 77253 C14 PA 1858 46.206 9.421 27.972 1.00 0.00 C ATOM 77254 H4R PA 1858 47.038 9.975 27.533 1.00 0.00 H ATOM 77255 H4S PA 1858 45.313 10.030 27.819 1.00 0.00 H ATOM 77256 C13 PA 1858 46.167 8.034 27.230 1.00 0.00 C ATOM 77257 H3R PA 1858 45.162 7.633 27.379 1.00 0.00 H ATOM 77258 H3S PA 1858 46.795 7.329 27.778 1.00 0.00 H ATOM 77259 C12 PA 1858 46.552 8.043 25.757 1.00 0.00 C ATOM 77260 H2R PA 1858 47.613 7.849 25.588 1.00 0.00 H ATOM 77261 H2S PA 1858 46.310 8.910 25.138 1.00 0.00 H ATOM 77262 C11 PGR 1859 45.757 6.946 25.045 1.00 0.00 C ATOM 77263 O12 PGR 1859 46.226 5.905 24.621 1.00 0.00 O ATOM 77264 O11 PGR 1859 44.396 7.115 25.062 1.00 0.00 O ATOM 77265 C1 PGR 1859 43.492 6.008 24.694 1.00 0.00 C ATOM 77266 HR PGR 1859 43.755 5.144 25.310 1.00 0.00 H ATOM 77267 HS PGR 1859 43.379 5.742 23.640 1.00 0.00 H ATOM 77268 C2 PGR 1859 42.089 6.437 25.185 1.00 0.00 C ATOM 77269 HX PGR 1859 41.392 5.619 24.986 1.00 0.00 H ATOM 77270 C3 PGR 1859 41.548 7.580 24.279 1.00 0.00 C ATOM 77271 HA PGR 1859 41.413 7.140 23.287 1.00 0.00 H ATOM 77272 HB PGR 1859 42.221 8.436 24.371 1.00 0.00 H ATOM 77273 O31 PGR 1859 40.199 8.004 24.669 1.00 0.00 O ATOM 77274 P31 PGR 1859 39.392 9.234 23.890 1.00 0.00 P ATOM 77275 O32 PGR 1859 40.124 10.585 24.244 1.00 0.00 O ATOM 77276 C31 PGR 1859 40.256 11.051 25.572 1.00 0.00 C ATOM 77277 H1A PGR 1859 40.155 10.245 26.304 1.00 0.00 H ATOM 77278 H1B PGR 1859 39.494 11.763 25.901 1.00 0.00 H ATOM 77279 C32 PGR 1859 41.610 11.732 25.696 1.00 0.00 C ATOM 77280 H2A PGR 1859 41.835 12.059 26.714 1.00 0.00 H ATOM 77281 O35 PGR 1859 41.736 12.858 24.786 1.00 0.00 O ATOM 77282 HO5A PGR 1859 42.514 13.368 25.073 1.00 0.00 H ATOM 77283 C33 PGR 1859 42.695 10.728 25.219 1.00 0.00 C ATOM 77284 H3A PGR 1859 42.875 9.878 25.884 1.00 0.00 H ATOM 77285 H3B PGR 1859 42.267 10.426 24.260 1.00 0.00 H ATOM 77286 O33 PGR 1859 39.614 9.114 22.417 1.00 0.00 O ATOM 77287 O34 PGR 1859 37.952 9.269 24.400 1.00 0.00 O ATOM 77288 O21 PGR 1859 42.217 6.997 26.544 1.00 0.00 O ATOM 77289 C21 PGR 1859 42.061 6.195 27.644 1.00 0.00 C ATOM 77290 O22 PGR 1859 41.989 4.984 27.590 1.00 0.00 O ATOM 77291 O36 PGR 1859 43.933 11.382 24.844 1.00 0.00 O ATOM 77292 HO6A PGR 1859 44.256 11.877 25.618 1.00 0.00 H ATOM 77293 C12 OL 1860 42.011 7.025 28.861 1.00 0.00 C ATOM 77294 H2R OL 1860 42.149 8.054 28.525 1.00 0.00 H ATOM 77295 H2S OL 1860 40.950 7.065 29.116 1.00 0.00 H ATOM 77296 C13 OL 1860 42.951 6.546 29.982 1.00 0.00 C ATOM 77297 H3R OL 1860 42.843 5.459 30.002 1.00 0.00 H ATOM 77298 H3S OL 1860 43.985 6.769 29.708 1.00 0.00 H ATOM 77299 C14 OL 1860 42.586 7.192 31.391 1.00 0.00 C ATOM 77300 H4R OL 1860 41.668 6.717 31.744 1.00 0.00 H ATOM 77301 H4S OL 1860 43.293 6.775 32.110 1.00 0.00 H ATOM 77302 C15 OL 1860 42.636 8.672 31.486 1.00 0.00 C ATOM 77303 H5R OL 1860 43.610 9.049 31.166 1.00 0.00 H ATOM 77304 H5S OL 1860 41.960 9.053 30.718 1.00 0.00 H ATOM 77305 C16 OL 1860 42.255 9.305 32.812 1.00 0.00 C ATOM 77306 H6R OL 1860 41.402 8.678 33.078 1.00 0.00 H ATOM 77307 H6S OL 1860 42.969 9.101 33.612 1.00 0.00 H ATOM 77308 C17 OL 1860 41.958 10.770 32.645 1.00 0.00 C ATOM 77309 H7R OL 1860 42.858 11.242 32.246 1.00 0.00 H ATOM 77310 H7S OL 1860 41.129 10.909 31.947 1.00 0.00 H ATOM 77311 C18 OL 1860 41.474 11.447 33.903 1.00 0.00 C ATOM 77312 H8R OL 1860 40.772 10.783 34.412 1.00 0.00 H ATOM 77313 H8S OL 1860 42.331 11.427 34.580 1.00 0.00 H ATOM 77314 C19 OL 1860 40.991 12.852 33.788 1.00 0.00 C ATOM 77315 H9R OL 1860 41.810 13.525 33.549 1.00 0.00 H ATOM 77316 C110 OL 1860 39.718 13.336 33.863 1.00 0.00 C ATOM 77317 H10R OL 1860 39.602 14.372 33.554 1.00 0.00 H ATOM 77318 C111 OL 1860 38.481 12.648 34.344 1.00 0.00 C ATOM 77319 H11R OL 1860 38.163 13.276 35.179 1.00 0.00 H ATOM 77320 H11S OL 1860 38.584 11.641 34.753 1.00 0.00 H ATOM 77321 C112 OL 1860 37.495 12.661 33.263 1.00 0.00 C ATOM 77322 H12R OL 1860 36.595 12.291 33.760 1.00 0.00 H ATOM 77323 H12S OL 1860 37.332 13.636 32.798 1.00 0.00 H ATOM 77324 C113 OL 1860 37.718 11.565 32.136 1.00 0.00 C ATOM 77325 H13R OL 1860 38.527 11.795 31.439 1.00 0.00 H ATOM 77326 H13S OL 1860 38.125 10.652 32.576 1.00 0.00 H ATOM 77327 C114 OL 1860 36.621 11.301 31.154 1.00 0.00 C ATOM 77328 H14R OL 1860 36.431 12.193 30.553 1.00 0.00 H ATOM 77329 H14S OL 1860 36.991 10.462 30.561 1.00 0.00 H ATOM 77330 C115 OL 1860 35.293 10.861 31.671 1.00 0.00 C ATOM 77331 H15R OL 1860 35.137 9.801 31.463 1.00 0.00 H ATOM 77332 H15S OL 1860 35.173 10.844 32.756 1.00 0.00 H ATOM 77333 C116 OL 1860 34.204 11.617 31.031 1.00 0.00 C ATOM 77334 H16R OL 1860 34.405 12.664 31.267 1.00 0.00 H ATOM 77335 H16S OL 1860 34.236 11.635 29.939 1.00 0.00 H ATOM 77336 C117 OL 1860 32.844 11.054 31.442 1.00 0.00 C ATOM 77337 H17R OL 1860 32.783 10.039 31.043 1.00 0.00 H ATOM 77338 H17S OL 1860 32.784 11.050 32.533 1.00 0.00 H ATOM 77339 C118 OL 1860 31.690 11.958 30.880 1.00 0.00 C ATOM 77340 H18R OL 1860 31.719 11.949 29.788 1.00 0.00 H ATOM 77341 H18S OL 1860 31.726 13.028 31.097 1.00 0.00 H ATOM 77342 H18T OL 1860 30.794 11.490 31.293 1.00 0.00 H TER 77343 OL 1860 ATOM 77343 C116 PA 1861 128.534 113.929 38.612 1.00 0.00 C ATOM 77344 H16R PA 1861 128.149 113.006 38.176 1.00 0.00 H ATOM 77345 H16S PA 1861 129.372 113.544 39.198 1.00 0.00 H ATOM 77346 H16T PA 1861 128.913 114.595 37.834 1.00 0.00 H ATOM 77347 C115 PA 1861 127.516 114.572 39.506 1.00 0.00 C ATOM 77348 H15R PA 1861 128.013 115.233 40.219 1.00 0.00 H ATOM 77349 H15S PA 1861 126.977 113.855 40.130 1.00 0.00 H ATOM 77350 C114 PA 1861 126.489 115.408 38.714 1.00 0.00 C ATOM 77351 H14R PA 1861 127.090 116.239 38.338 1.00 0.00 H ATOM 77352 H14S PA 1861 125.671 115.740 39.356 1.00 0.00 H ATOM 77353 C113 PA 1861 125.813 114.690 37.556 1.00 0.00 C ATOM 77354 H13R PA 1861 125.591 113.649 37.801 1.00 0.00 H ATOM 77355 H13S PA 1861 126.480 114.689 36.691 1.00 0.00 H ATOM 77356 C112 PA 1861 124.545 115.366 37.061 1.00 0.00 C ATOM 77357 H12R PA 1861 124.714 116.248 36.439 1.00 0.00 H ATOM 77358 H12S PA 1861 123.918 115.764 37.861 1.00 0.00 H ATOM 77359 C111 PA 1861 123.558 114.524 36.244 1.00 0.00 C ATOM 77360 H11R PA 1861 122.571 114.991 36.231 1.00 0.00 H ATOM 77361 H11S PA 1861 123.436 113.615 36.836 1.00 0.00 H ATOM 77362 C110 PA 1861 124.038 114.145 34.803 1.00 0.00 C ATOM 77363 H10R PA 1861 125.045 113.731 34.883 1.00 0.00 H ATOM 77364 H10S PA 1861 124.159 115.102 34.292 1.00 0.00 H ATOM 77365 C19 PA 1861 123.158 113.287 33.970 1.00 0.00 C ATOM 77366 H9R PA 1861 122.233 113.856 33.854 1.00 0.00 H ATOM 77367 H9S PA 1861 122.949 112.341 34.474 1.00 0.00 H ATOM 77368 C18 PA 1861 123.629 112.856 32.609 1.00 0.00 C ATOM 77369 H8R PA 1861 123.018 112.017 32.271 1.00 0.00 H ATOM 77370 H8S PA 1861 124.636 112.456 32.741 1.00 0.00 H ATOM 77371 C17 PA 1861 123.410 114.003 31.533 1.00 0.00 C ATOM 77372 H7R PA 1861 123.587 114.945 32.056 1.00 0.00 H ATOM 77373 H7S PA 1861 122.351 114.112 31.292 1.00 0.00 H ATOM 77374 C16 PA 1861 124.192 113.796 30.265 1.00 0.00 C ATOM 77375 H6R PA 1861 124.051 112.743 30.013 1.00 0.00 H ATOM 77376 H6S PA 1861 125.236 113.957 30.542 1.00 0.00 H ATOM 77377 C15 PA 1861 123.796 114.668 29.066 1.00 0.00 C ATOM 77378 H5R PA 1861 123.672 115.737 29.249 1.00 0.00 H ATOM 77379 H5S PA 1861 122.784 114.350 28.803 1.00 0.00 H ATOM 77380 C14 PA 1861 124.847 114.625 27.985 1.00 0.00 C ATOM 77381 H4R PA 1861 124.993 113.553 27.836 1.00 0.00 H ATOM 77382 H4S PA 1861 125.828 115.035 28.237 1.00 0.00 H ATOM 77383 C13 PA 1861 124.508 115.313 26.620 1.00 0.00 C ATOM 77384 H3R PA 1861 124.168 116.289 26.971 1.00 0.00 H ATOM 77385 H3S PA 1861 123.638 114.803 26.201 1.00 0.00 H ATOM 77386 C12 PA 1861 125.652 115.211 25.654 1.00 0.00 C ATOM 77387 H2R PA 1861 125.318 114.830 24.687 1.00 0.00 H ATOM 77388 H2S PA 1861 126.336 114.460 26.054 1.00 0.00 H ATOM 77389 C11 PGR 1862 126.389 116.496 25.462 1.00 0.00 C ATOM 77390 O12 PGR 1862 127.426 116.765 26.024 1.00 0.00 O ATOM 77391 O11 PGR 1862 125.662 117.408 24.810 1.00 0.00 O ATOM 77392 C1 PGR 1862 126.314 118.656 24.365 1.00 0.00 C ATOM 77393 HR PGR 1862 127.010 118.366 23.574 1.00 0.00 H ATOM 77394 HS PGR 1862 126.855 119.215 25.133 1.00 0.00 H ATOM 77395 C2 PGR 1862 125.240 119.697 23.849 1.00 0.00 C ATOM 77396 HX PGR 1862 124.472 119.182 23.266 1.00 0.00 H ATOM 77397 C3 PGR 1862 125.912 120.755 22.890 1.00 0.00 C ATOM 77398 HA PGR 1862 125.286 121.649 22.944 1.00 0.00 H ATOM 77399 HB PGR 1862 125.813 120.438 21.849 1.00 0.00 H ATOM 77400 O31 PGR 1862 127.246 120.910 23.253 1.00 0.00 O ATOM 77401 P31 PGR 1862 128.189 122.007 22.539 1.00 0.00 P ATOM 77402 O32 PGR 1862 129.661 121.264 22.850 1.00 0.00 O ATOM 77403 C31 PGR 1862 130.227 121.396 24.217 1.00 0.00 C ATOM 77404 H1A PGR 1862 129.490 121.105 24.970 1.00 0.00 H ATOM 77405 H1B PGR 1862 130.364 122.466 24.393 1.00 0.00 H ATOM 77406 C32 PGR 1862 131.626 120.799 24.303 1.00 0.00 C ATOM 77407 H2A PGR 1862 131.550 119.710 24.246 1.00 0.00 H ATOM 77408 O35 PGR 1862 132.340 121.396 23.187 1.00 0.00 O ATOM 77409 HO5A PGR 1862 132.430 122.323 23.475 1.00 0.00 H ATOM 77410 C33 PGR 1862 132.292 121.142 25.634 1.00 0.00 C ATOM 77411 H3A PGR 1862 131.669 120.679 26.403 1.00 0.00 H ATOM 77412 H3B PGR 1862 133.275 120.665 25.616 1.00 0.00 H ATOM 77413 O33 PGR 1862 128.096 122.041 21.100 1.00 0.00 O ATOM 77414 O34 PGR 1862 128.055 123.327 23.255 1.00 0.00 O ATOM 77415 O21 PGR 1862 124.713 120.461 24.953 1.00 0.00 O ATOM 77416 C21 PGR 1862 123.564 121.152 24.921 1.00 0.00 C ATOM 77417 O22 PGR 1862 122.829 121.128 23.973 1.00 0.00 O ATOM 77418 O36 PGR 1862 132.160 122.582 25.922 1.00 0.00 O ATOM 77419 HO6A PGR 1862 132.941 122.939 25.464 1.00 0.00 H ATOM 77420 C12 OL 1863 123.414 122.172 26.043 1.00 0.00 C ATOM 77421 H2R OL 1863 124.209 122.054 26.783 1.00 0.00 H ATOM 77422 H2S OL 1863 123.646 123.176 25.681 1.00 0.00 H ATOM 77423 C13 OL 1863 122.041 122.256 26.642 1.00 0.00 C ATOM 77424 H3R OL 1863 121.364 122.449 25.808 1.00 0.00 H ATOM 77425 H3S OL 1863 121.790 121.276 27.053 1.00 0.00 H ATOM 77426 C14 OL 1863 122.004 123.226 27.889 1.00 0.00 C ATOM 77427 H4R OL 1863 122.930 123.081 28.449 1.00 0.00 H ATOM 77428 H4S OL 1863 122.022 124.271 27.572 1.00 0.00 H ATOM 77429 C15 OL 1863 120.831 122.983 28.811 1.00 0.00 C ATOM 77430 H5R OL 1863 119.858 123.150 28.346 1.00 0.00 H ATOM 77431 H5S OL 1863 120.749 121.956 29.173 1.00 0.00 H ATOM 77432 C16 OL 1863 120.754 123.918 30.030 1.00 0.00 C ATOM 77433 H6R OL 1863 119.922 123.623 30.673 1.00 0.00 H ATOM 77434 H6S OL 1863 121.694 123.798 30.573 1.00 0.00 H ATOM 77435 C17 OL 1863 120.701 125.434 29.827 1.00 0.00 C ATOM 77436 H7R OL 1863 121.505 125.708 29.140 1.00 0.00 H ATOM 77437 H7S OL 1863 119.853 125.796 29.242 1.00 0.00 H ATOM 77438 C18 OL 1863 120.813 126.285 31.036 1.00 0.00 C ATOM 77439 H8R OL 1863 119.835 126.468 31.487 1.00 0.00 H ATOM 77440 H8S OL 1863 121.372 125.748 31.805 1.00 0.00 H ATOM 77441 C19 OL 1863 121.220 127.615 30.740 1.00 0.00 C ATOM 77442 H9R OL 1863 120.694 128.012 29.876 1.00 0.00 H ATOM 77443 C110 OL 1863 122.136 128.403 31.267 1.00 0.00 C ATOM 77444 H10R OL 1863 122.276 129.379 30.810 1.00 0.00 H ATOM 77445 C111 OL 1863 122.920 128.112 32.453 1.00 0.00 C ATOM 77446 H11R OL 1863 122.231 127.584 33.116 1.00 0.00 H ATOM 77447 H11S OL 1863 123.815 127.553 32.174 1.00 0.00 H ATOM 77448 C112 OL 1863 123.351 129.438 33.137 1.00 0.00 C ATOM 77449 H12R OL 1863 123.416 130.226 32.383 1.00 0.00 H ATOM 77450 H12S OL 1863 122.500 129.798 33.719 1.00 0.00 H ATOM 77451 C113 OL 1863 124.515 129.295 34.146 1.00 0.00 C ATOM 77452 H13R OL 1863 125.306 128.857 33.534 1.00 0.00 H ATOM 77453 H13S OL 1863 124.663 130.339 34.431 1.00 0.00 H ATOM 77454 C114 OL 1863 124.063 128.436 35.283 1.00 0.00 C ATOM 77455 H14R OL 1863 123.320 128.930 35.911 1.00 0.00 H ATOM 77456 H14S OL 1863 123.700 127.535 34.784 1.00 0.00 H ATOM 77457 C115 OL 1863 125.189 127.917 36.197 1.00 0.00 C ATOM 77458 H15R OL 1863 125.893 127.247 35.699 1.00 0.00 H ATOM 77459 H15S OL 1863 125.753 128.770 36.580 1.00 0.00 H ATOM 77460 C116 OL 1863 124.666 127.137 37.448 1.00 0.00 C ATOM 77461 H16R OL 1863 124.191 127.881 38.091 1.00 0.00 H ATOM 77462 H16S OL 1863 123.870 126.447 37.160 1.00 0.00 H ATOM 77463 C117 OL 1863 125.688 126.622 38.469 1.00 0.00 C ATOM 77464 H17R OL 1863 126.594 126.243 37.992 1.00 0.00 H ATOM 77465 H17S OL 1863 125.946 127.449 39.133 1.00 0.00 H ATOM 77466 C118 OL 1863 125.074 125.421 39.266 1.00 0.00 C ATOM 77467 H18R OL 1863 124.233 125.838 39.825 1.00 0.00 H ATOM 77468 H18S OL 1863 125.727 124.887 39.960 1.00 0.00 H ATOM 77469 H18T OL 1863 124.651 124.686 38.577 1.00 0.00 H TER 77470 OL 1863 ATOM 77470 C116 PA 1864 130.367 -2.374 32.569 1.00 0.00 C ATOM 77471 H16R PA 1864 131.412 -2.597 32.799 1.00 0.00 H ATOM 77472 H16S PA 1864 130.303 -2.085 31.518 1.00 0.00 H ATOM 77473 H16T PA 1864 129.752 -3.262 32.727 1.00 0.00 H ATOM 77474 C115 PA 1864 129.874 -1.360 33.580 1.00 0.00 C ATOM 77475 H15R PA 1864 130.408 -0.414 33.466 1.00 0.00 H ATOM 77476 H15S PA 1864 130.160 -1.673 34.587 1.00 0.00 H ATOM 77477 C114 PA 1864 128.394 -1.140 33.718 1.00 0.00 C ATOM 77478 H14R PA 1864 127.959 -2.103 33.993 1.00 0.00 H ATOM 77479 H14S PA 1864 127.949 -0.883 32.755 1.00 0.00 H ATOM 77480 C113 PA 1864 127.941 -0.351 34.865 1.00 0.00 C ATOM 77481 H13R PA 1864 128.248 -0.786 35.819 1.00 0.00 H ATOM 77482 H13S PA 1864 126.869 -0.508 35.001 1.00 0.00 H ATOM 77483 C112 PA 1864 128.286 1.128 34.881 1.00 0.00 C ATOM 77484 H12R PA 1864 129.292 1.244 35.288 1.00 0.00 H ATOM 77485 H12S PA 1864 127.651 1.592 35.638 1.00 0.00 H ATOM 77486 C111 PA 1864 128.176 1.794 33.535 1.00 0.00 C ATOM 77487 H11R PA 1864 127.213 1.735 33.023 1.00 0.00 H ATOM 77488 H11S PA 1864 128.898 1.365 32.837 1.00 0.00 H ATOM 77489 C110 PA 1864 128.415 3.322 33.582 1.00 0.00 C ATOM 77490 H10R PA 1864 129.251 3.432 34.277 1.00 0.00 H ATOM 77491 H10S PA 1864 127.575 3.820 34.072 1.00 0.00 H ATOM 77492 C19 PA 1864 128.877 4.010 32.306 1.00 0.00 C ATOM 77493 H9R PA 1864 129.509 3.365 31.691 1.00 0.00 H ATOM 77494 H9S PA 1864 129.504 4.892 32.455 1.00 0.00 H ATOM 77495 C18 PA 1864 127.773 4.370 31.269 1.00 0.00 C ATOM 77496 H8R PA 1864 127.360 5.332 31.580 1.00 0.00 H ATOM 77497 H8S PA 1864 126.943 3.668 31.361 1.00 0.00 H ATOM 77498 C17 PA 1864 128.181 4.599 29.782 1.00 0.00 C ATOM 77499 H7R PA 1864 127.239 4.773 29.259 1.00 0.00 H ATOM 77500 H7S PA 1864 128.599 3.678 29.370 1.00 0.00 H ATOM 77501 C16 PA 1864 129.174 5.831 29.656 1.00 0.00 C ATOM 77502 H6R PA 1864 129.930 5.839 30.444 1.00 0.00 H ATOM 77503 H6S PA 1864 128.573 6.706 29.912 1.00 0.00 H ATOM 77504 C15 PA 1864 129.746 5.923 28.199 1.00 0.00 C ATOM 77505 H5R PA 1864 130.428 5.077 28.092 1.00 0.00 H ATOM 77506 H5S PA 1864 130.379 6.789 27.992 1.00 0.00 H ATOM 77507 C14 PA 1864 128.773 5.813 27.067 1.00 0.00 C ATOM 77508 H4R PA 1864 128.165 6.720 27.080 1.00 0.00 H ATOM 77509 H4S PA 1864 128.168 4.922 27.248 1.00 0.00 H ATOM 77510 C13 PA 1864 129.344 5.684 25.644 1.00 0.00 C ATOM 77511 H3R PA 1864 129.483 6.663 25.179 1.00 0.00 H ATOM 77512 H3S PA 1864 128.543 5.082 25.210 1.00 0.00 H ATOM 77513 C12 PA 1864 130.532 4.811 25.322 1.00 0.00 C ATOM 77514 H2R PA 1864 130.322 3.763 25.545 1.00 0.00 H ATOM 77515 H2S PA 1864 131.426 5.168 25.838 1.00 0.00 H ATOM 77516 C11 PC 1865 130.942 4.905 23.868 1.00 0.00 C ATOM 77517 O12 PC 1865 131.693 5.695 23.372 1.00 0.00 O ATOM 77518 O11 PC 1865 130.213 4.015 23.121 1.00 0.00 O ATOM 77519 C1 PC 1865 129.939 4.161 21.731 1.00 0.00 C ATOM 77520 HR PC 1865 129.742 5.191 21.424 1.00 0.00 H ATOM 77521 HS PC 1865 129.153 3.480 21.395 1.00 0.00 H ATOM 77522 C2 PC 1865 131.172 3.662 21.024 1.00 0.00 C ATOM 77523 HX PC 1865 132.084 4.198 21.299 1.00 0.00 H ATOM 77524 C3 PC 1865 130.993 3.801 19.560 1.00 0.00 C ATOM 77525 HA PC 1865 131.676 3.078 19.106 1.00 0.00 H ATOM 77526 HB PC 1865 131.164 4.817 19.195 1.00 0.00 H ATOM 77527 O31 PC 1865 129.777 3.219 19.178 1.00 0.00 O ATOM 77528 P31 PC 1865 129.552 2.650 17.656 1.00 0.00 P ATOM 77529 O32 PC 1865 129.853 1.061 17.758 1.00 0.00 O ATOM 77530 C31 PC 1865 129.268 0.353 18.708 1.00 0.00 C ATOM 77531 H1A PC 1865 128.358 0.816 19.098 1.00 0.00 H ATOM 77532 H1B PC 1865 129.885 0.506 19.596 1.00 0.00 H ATOM 77533 C32 PC 1865 129.116 -1.084 18.339 1.00 0.00 C ATOM 77534 H2A PC 1865 128.995 -1.577 19.305 1.00 0.00 H ATOM 77535 H2B PC 1865 130.018 -1.459 17.853 1.00 0.00 H ATOM 77536 N31 PC 1865 127.875 -1.350 17.532 1.00 0.00 N ATOM 77537 C33 PC 1865 126.577 -1.128 18.249 1.00 0.00 C ATOM 77538 H3A PC 1865 126.632 -1.926 18.991 1.00 0.00 H ATOM 77539 H3B PC 1865 125.686 -1.309 17.646 1.00 0.00 H ATOM 77540 H3C PC 1865 126.474 -0.124 18.662 1.00 0.00 H ATOM 77541 C34 PC 1865 127.836 -0.732 16.182 1.00 0.00 C ATOM 77542 H4A PC 1865 127.693 0.301 16.505 1.00 0.00 H ATOM 77543 H4B PC 1865 126.941 -1.007 15.621 1.00 0.00 H ATOM 77544 H4C PC 1865 128.790 -0.900 15.681 1.00 0.00 H ATOM 77545 C35 PC 1865 127.927 -2.828 17.436 1.00 0.00 C ATOM 77546 H5A PC 1865 128.720 -3.217 16.795 1.00 0.00 H ATOM 77547 H5B PC 1865 126.981 -3.263 17.110 1.00 0.00 H ATOM 77548 H5C PC 1865 128.183 -3.162 18.442 1.00 0.00 H ATOM 77549 O33 PC 1865 128.121 2.816 17.349 1.00 0.00 O ATOM 77550 O34 PC 1865 130.619 3.281 16.806 1.00 0.00 O ATOM 77551 O21 PC 1865 131.325 2.267 21.298 1.00 0.00 O ATOM 77552 C21 PC 1865 132.567 1.774 21.125 1.00 0.00 C ATOM 77553 O22 PC 1865 133.548 2.406 20.980 1.00 0.00 O ATOM 77554 C12 OL 1866 132.775 0.370 21.378 1.00 0.00 C ATOM 77555 H2R OL 1866 132.001 -0.236 20.903 1.00 0.00 H ATOM 77556 H2S OL 1866 133.760 0.215 20.933 1.00 0.00 H ATOM 77557 C13 OL 1866 132.737 -0.125 22.850 1.00 0.00 C ATOM 77558 H3R OL 1866 132.070 0.452 23.494 1.00 0.00 H ATOM 77559 H3S OL 1866 132.180 -1.063 22.909 1.00 0.00 H ATOM 77560 C14 OL 1866 134.102 -0.150 23.424 1.00 0.00 C ATOM 77561 H4R OL 1866 134.776 -0.763 22.822 1.00 0.00 H ATOM 77562 H4S OL 1866 134.469 0.873 23.530 1.00 0.00 H ATOM 77563 C15 OL 1866 134.008 -0.550 24.886 1.00 0.00 C ATOM 77564 H5R OL 1866 133.091 -1.121 25.050 1.00 0.00 H ATOM 77565 H5S OL 1866 134.752 -1.291 25.185 1.00 0.00 H ATOM 77566 C16 OL 1866 134.097 0.535 26.023 1.00 0.00 C ATOM 77567 H6R OL 1866 133.521 1.350 25.580 1.00 0.00 H ATOM 77568 H6S OL 1866 133.677 0.279 26.998 1.00 0.00 H ATOM 77569 C17 OL 1866 135.518 1.010 26.289 1.00 0.00 C ATOM 77570 H7R OL 1866 136.074 0.217 26.793 1.00 0.00 H ATOM 77571 H7S OL 1866 136.110 1.006 25.371 1.00 0.00 H ATOM 77572 C18 OL 1866 135.625 2.436 27.019 1.00 0.00 C ATOM 77573 H8R OL 1866 135.469 3.141 26.200 1.00 0.00 H ATOM 77574 H8S OL 1866 134.675 2.489 27.555 1.00 0.00 H ATOM 77575 C19 OL 1866 136.865 2.640 27.772 1.00 0.00 C ATOM 77576 H9R OL 1866 137.713 3.169 27.344 1.00 0.00 H ATOM 77577 C110 OL 1866 137.171 2.084 28.943 1.00 0.00 C ATOM 77578 H10R OL 1866 138.171 2.244 29.339 1.00 0.00 H ATOM 77579 C111 OL 1866 136.381 1.058 29.781 1.00 0.00 C ATOM 77580 H11R OL 1866 135.341 0.957 29.463 1.00 0.00 H ATOM 77581 H11S OL 1866 136.687 0.016 29.672 1.00 0.00 H ATOM 77582 C112 OL 1866 136.339 1.374 31.273 1.00 0.00 C ATOM 77583 H12R OL 1866 135.960 2.377 31.478 1.00 0.00 H ATOM 77584 H12S OL 1866 135.617 0.642 31.639 1.00 0.00 H ATOM 77585 C113 OL 1866 137.649 1.123 32.050 1.00 0.00 C ATOM 77586 H13R OL 1866 137.793 0.042 32.100 1.00 0.00 H ATOM 77587 H13S OL 1866 138.480 1.567 31.497 1.00 0.00 H ATOM 77588 C114 OL 1866 137.600 1.777 33.345 1.00 0.00 C ATOM 77589 H14R OL 1866 137.429 2.838 33.154 1.00 0.00 H ATOM 77590 H14S OL 1866 136.760 1.408 33.937 1.00 0.00 H ATOM 77591 C115 OL 1866 138.946 1.537 34.089 1.00 0.00 C ATOM 77592 H15R OL 1866 138.956 0.462 34.282 1.00 0.00 H ATOM 77593 H15S OL 1866 139.809 1.727 33.449 1.00 0.00 H ATOM 77594 C116 OL 1866 138.931 2.132 35.497 1.00 0.00 C ATOM 77595 H16R OL 1866 139.970 2.102 35.835 1.00 0.00 H ATOM 77596 H16S OL 1866 138.766 3.203 35.359 1.00 0.00 H ATOM 77597 C117 OL 1866 137.986 1.444 36.529 1.00 0.00 C ATOM 77598 H17R OL 1866 137.047 1.509 35.975 1.00 0.00 H ATOM 77599 H17S OL 1866 138.184 0.384 36.701 1.00 0.00 H ATOM 77600 C118 OL 1866 138.032 2.064 38.002 1.00 0.00 C ATOM 77601 H18R OL 1866 137.224 1.669 38.623 1.00 0.00 H ATOM 77602 H18S OL 1866 137.877 3.134 37.849 1.00 0.00 H ATOM 77603 H18T OL 1866 139.058 1.917 38.346 1.00 0.00 H TER 77604 OL 1866 ATOM 77604 C116 PA 1867 129.708 139.685 34.142 1.00 0.00 C ATOM 77605 H16R PA 1867 130.081 140.255 34.996 1.00 0.00 H ATOM 77606 H16S PA 1867 128.836 140.274 33.851 1.00 0.00 H ATOM 77607 H16T PA 1867 130.440 139.891 33.358 1.00 0.00 H ATOM 77608 C115 PA 1867 129.369 138.242 34.534 1.00 0.00 C ATOM 77609 H15R PA 1867 129.014 138.136 35.561 1.00 0.00 H ATOM 77610 H15S PA 1867 130.323 137.712 34.525 1.00 0.00 H ATOM 77611 C114 PA 1867 128.283 137.702 33.618 1.00 0.00 C ATOM 77612 H14R PA 1867 127.353 138.259 33.752 1.00 0.00 H ATOM 77613 H14S PA 1867 127.951 136.753 34.043 1.00 0.00 H ATOM 77614 C113 PA 1867 128.632 137.555 32.125 1.00 0.00 C ATOM 77615 H13R PA 1867 129.581 137.020 32.057 1.00 0.00 H ATOM 77616 H13S PA 1867 128.973 138.549 31.831 1.00 0.00 H ATOM 77617 C112 PA 1867 127.557 137.003 31.319 1.00 0.00 C ATOM 77618 H12R PA 1867 126.626 136.839 31.865 1.00 0.00 H ATOM 77619 H12S PA 1867 127.791 135.943 31.199 1.00 0.00 H ATOM 77620 C111 PA 1867 127.329 137.654 29.915 1.00 0.00 C ATOM 77621 H11R PA 1867 128.251 137.528 29.344 1.00 0.00 H ATOM 77622 H11S PA 1867 127.266 138.741 30.003 1.00 0.00 H ATOM 77623 C110 PA 1867 126.192 136.975 29.132 1.00 0.00 C ATOM 77624 H10R PA 1867 126.318 135.933 29.433 1.00 0.00 H ATOM 77625 H10S PA 1867 126.220 136.959 28.040 1.00 0.00 H ATOM 77626 C19 PA 1867 124.789 137.335 29.579 1.00 0.00 C ATOM 77627 H9R PA 1867 124.694 138.414 29.437 1.00 0.00 H ATOM 77628 H9S PA 1867 124.629 137.112 30.636 1.00 0.00 H ATOM 77629 C18 PA 1867 123.693 136.523 28.766 1.00 0.00 C ATOM 77630 H8R PA 1867 123.936 135.464 28.876 1.00 0.00 H ATOM 77631 H8S PA 1867 123.703 136.896 27.739 1.00 0.00 H ATOM 77632 C17 PA 1867 122.317 136.795 29.337 1.00 0.00 C ATOM 77633 H7R PA 1867 121.602 136.220 28.745 1.00 0.00 H ATOM 77634 H7S PA 1867 122.075 137.831 29.089 1.00 0.00 H ATOM 77635 C16 PA 1867 122.037 136.574 30.792 1.00 0.00 C ATOM 77636 H6R PA 1867 120.960 136.714 30.912 1.00 0.00 H ATOM 77637 H6S PA 1867 122.509 137.308 31.448 1.00 0.00 H ATOM 77638 C15 PA 1867 122.278 135.094 31.292 1.00 0.00 C ATOM 77639 H5R PA 1867 122.412 135.048 32.374 1.00 0.00 H ATOM 77640 H5S PA 1867 123.320 134.854 31.072 1.00 0.00 H ATOM 77641 C14 PA 1867 121.253 134.017 30.609 1.00 0.00 C ATOM 77642 H4R PA 1867 121.287 134.213 29.535 1.00 0.00 H ATOM 77643 H4S PA 1867 120.221 134.164 30.934 1.00 0.00 H ATOM 77644 C13 PA 1867 121.525 132.520 30.981 1.00 0.00 C ATOM 77645 H3R PA 1867 121.613 132.497 32.069 1.00 0.00 H ATOM 77646 H3S PA 1867 122.435 132.256 30.437 1.00 0.00 H ATOM 77647 C12 PA 1867 120.384 131.524 30.706 1.00 0.00 C ATOM 77648 H2R PA 1867 119.440 131.858 31.142 1.00 0.00 H ATOM 77649 H2S PA 1867 120.584 130.564 31.188 1.00 0.00 H ATOM 77650 C11 PC 1868 120.147 131.328 29.201 1.00 0.00 C ATOM 77651 O12 PC 1868 119.098 131.662 28.721 1.00 0.00 O ATOM 77652 O11 PC 1868 121.133 130.645 28.626 1.00 0.00 O ATOM 77653 C1 PC 1868 120.929 130.144 27.287 1.00 0.00 C ATOM 77654 HR PC 1868 119.985 129.664 27.017 1.00 0.00 H ATOM 77655 HS PC 1868 121.675 129.351 27.189 1.00 0.00 H ATOM 77656 C2 PC 1868 121.230 131.146 26.201 1.00 0.00 C ATOM 77657 HX PC 1868 120.666 132.068 26.365 1.00 0.00 H ATOM 77658 C3 PC 1868 120.888 130.620 24.847 1.00 0.00 C ATOM 77659 HA PC 1868 121.494 131.086 24.067 1.00 0.00 H ATOM 77660 HB PC 1868 119.852 130.870 24.605 1.00 0.00 H ATOM 77661 O31 PC 1868 121.010 129.258 24.832 1.00 0.00 O ATOM 77662 P31 PC 1868 120.636 128.549 23.415 1.00 0.00 P ATOM 77663 O32 PC 1868 119.065 128.498 23.407 1.00 0.00 O ATOM 77664 C31 PC 1868 118.395 128.005 24.470 1.00 0.00 C ATOM 77665 H1A PC 1868 118.495 128.723 25.288 1.00 0.00 H ATOM 77666 H1B PC 1868 118.707 127.050 24.899 1.00 0.00 H ATOM 77667 C32 PC 1868 116.884 128.056 24.113 1.00 0.00 C ATOM 77668 H2A PC 1868 116.586 129.080 23.883 1.00 0.00 H ATOM 77669 H2B PC 1868 116.340 127.703 24.990 1.00 0.00 H ATOM 77670 N31 PC 1868 116.263 127.148 23.005 1.00 0.00 N ATOM 77671 C33 PC 1868 114.836 127.379 22.820 1.00 0.00 C ATOM 77672 H3A PC 1868 114.662 128.418 22.538 1.00 0.00 H ATOM 77673 H3B PC 1868 114.260 127.220 23.733 1.00 0.00 H ATOM 77674 H3C PC 1868 114.413 126.735 22.047 1.00 0.00 H ATOM 77675 C34 PC 1868 116.894 127.577 21.687 1.00 0.00 C ATOM 77676 H4A PC 1868 116.739 128.625 21.430 1.00 0.00 H ATOM 77677 H4B PC 1868 116.471 127.032 20.842 1.00 0.00 H ATOM 77678 H4C PC 1868 117.972 127.417 21.734 1.00 0.00 H ATOM 77679 C35 PC 1868 116.514 125.705 23.225 1.00 0.00 C ATOM 77680 H5A PC 1868 116.065 125.143 22.405 1.00 0.00 H ATOM 77681 H5B PC 1868 116.410 125.294 24.231 1.00 0.00 H ATOM 77682 H5C PC 1868 117.586 125.555 23.093 1.00 0.00 H ATOM 77683 O33 PC 1868 120.997 129.427 22.262 1.00 0.00 O ATOM 77684 O34 PC 1868 121.129 127.180 23.511 1.00 0.00 O ATOM 77685 O21 PC 1868 122.647 131.533 26.141 1.00 0.00 O ATOM 77686 C21 PC 1868 123.062 132.539 26.944 1.00 0.00 C ATOM 77687 O22 PC 1868 122.295 133.249 27.559 1.00 0.00 O ATOM 77688 C12 OL 1869 124.633 132.706 27.006 1.00 0.00 C ATOM 77689 H2R OL 1869 124.965 133.074 26.033 1.00 0.00 H ATOM 77690 H2S OL 1869 125.059 133.552 27.550 1.00 0.00 H ATOM 77691 C13 OL 1869 125.361 131.405 27.540 1.00 0.00 C ATOM 77692 H3R OL 1869 125.018 130.593 26.895 1.00 0.00 H ATOM 77693 H3S OL 1869 126.427 131.469 27.310 1.00 0.00 H ATOM 77694 C14 OL 1869 125.087 131.190 29.055 1.00 0.00 C ATOM 77695 H4R OL 1869 124.023 131.005 29.214 1.00 0.00 H ATOM 77696 H4S OL 1869 125.643 130.323 29.417 1.00 0.00 H ATOM 77697 C15 OL 1869 125.613 132.298 29.981 1.00 0.00 C ATOM 77698 H5R OL 1869 126.554 132.771 29.693 1.00 0.00 H ATOM 77699 H5S OL 1869 124.854 133.082 30.022 1.00 0.00 H ATOM 77700 C16 OL 1869 126.079 131.788 31.398 1.00 0.00 C ATOM 77701 H6R OL 1869 125.272 131.185 31.821 1.00 0.00 H ATOM 77702 H6S OL 1869 126.810 130.978 31.355 1.00 0.00 H ATOM 77703 C17 OL 1869 126.446 132.787 32.388 1.00 0.00 C ATOM 77704 H7R OL 1869 126.663 132.198 33.281 1.00 0.00 H ATOM 77705 H7S OL 1869 127.418 133.215 32.136 1.00 0.00 H ATOM 77706 C18 OL 1869 125.358 133.844 32.719 1.00 0.00 C ATOM 77707 H8R OL 1869 125.047 134.401 31.832 1.00 0.00 H ATOM 77708 H8S OL 1869 124.449 133.300 32.986 1.00 0.00 H ATOM 77709 C19 OL 1869 125.578 134.899 33.787 1.00 0.00 C ATOM 77710 H9R OL 1869 126.351 135.598 33.479 1.00 0.00 H ATOM 77711 C110 OL 1869 124.974 135.180 34.958 1.00 0.00 C ATOM 77712 H10R OL 1869 125.323 136.041 35.524 1.00 0.00 H ATOM 77713 C111 OL 1869 123.929 134.451 35.713 1.00 0.00 C ATOM 77714 H11R OL 1869 122.904 134.747 35.479 1.00 0.00 H ATOM 77715 H11S OL 1869 123.971 133.377 35.521 1.00 0.00 H ATOM 77716 C112 OL 1869 124.157 134.544 37.182 1.00 0.00 C ATOM 77717 H12R OL 1869 125.189 134.419 37.517 1.00 0.00 H ATOM 77718 H12S OL 1869 123.992 135.578 37.494 1.00 0.00 H ATOM 77719 C113 OL 1869 123.213 133.672 38.025 1.00 0.00 C ATOM 77720 H13R OL 1869 122.192 134.039 37.902 1.00 0.00 H ATOM 77721 H13S OL 1869 123.271 132.642 37.669 1.00 0.00 H ATOM 77722 C114 OL 1869 123.497 133.745 39.577 1.00 0.00 C ATOM 77723 H14R OL 1869 124.540 133.489 39.775 1.00 0.00 H ATOM 77724 H14S OL 1869 123.273 134.767 39.889 1.00 0.00 H ATOM 77725 C115 OL 1869 122.674 132.798 40.373 1.00 0.00 C ATOM 77726 H15R OL 1869 122.551 133.088 41.419 1.00 0.00 H ATOM 77727 H15S OL 1869 121.668 132.792 39.949 1.00 0.00 H ATOM 77728 C116 OL 1869 123.047 131.331 40.248 1.00 0.00 C ATOM 77729 H16R OL 1869 123.365 131.238 39.207 1.00 0.00 H ATOM 77730 H16S OL 1869 123.904 131.211 40.915 1.00 0.00 H ATOM 77731 C117 OL 1869 121.895 130.389 40.588 1.00 0.00 C ATOM 77732 H17R OL 1869 121.523 130.651 41.581 1.00 0.00 H ATOM 77733 H17S OL 1869 120.966 130.636 40.069 1.00 0.00 H ATOM 77734 C118 OL 1869 122.051 128.898 40.455 1.00 0.00 C ATOM 77735 H18R OL 1869 121.296 128.313 40.984 1.00 0.00 H ATOM 77736 H18S OL 1869 123.004 128.680 40.943 1.00 0.00 H ATOM 77737 H18T OL 1869 122.162 128.606 39.409 1.00 0.00 H TER 77738 OL 1869 ATOM 77738 C116 PA 1870 142.500 21.354 34.708 1.00 0.00 C ATOM 77739 H16R PA 1870 142.356 20.930 35.704 1.00 0.00 H ATOM 77740 H16S PA 1870 141.671 20.956 34.119 1.00 0.00 H ATOM 77741 H16T PA 1870 142.394 22.435 34.817 1.00 0.00 H ATOM 77742 C115 PA 1870 143.843 20.824 34.248 1.00 0.00 C ATOM 77743 H15R PA 1870 144.578 21.091 35.011 1.00 0.00 H ATOM 77744 H15S PA 1870 144.300 21.176 33.320 1.00 0.00 H ATOM 77745 C114 PA 1870 143.845 19.302 34.315 1.00 0.00 C ATOM 77746 H14R PA 1870 143.740 19.037 35.370 1.00 0.00 H ATOM 77747 H14S PA 1870 144.917 19.137 34.190 1.00 0.00 H ATOM 77748 C113 PA 1870 143.104 18.597 33.225 1.00 0.00 C ATOM 77749 H13R PA 1870 142.057 18.884 33.106 1.00 0.00 H ATOM 77750 H13S PA 1870 143.155 17.547 33.520 1.00 0.00 H ATOM 77751 C112 PA 1870 143.754 18.796 31.797 1.00 0.00 C ATOM 77752 H12R PA 1870 144.737 18.318 31.786 1.00 0.00 H ATOM 77753 H12S PA 1870 143.773 19.840 31.477 1.00 0.00 H ATOM 77754 C111 PA 1870 142.992 18.083 30.613 1.00 0.00 C ATOM 77755 H11R PA 1870 143.634 18.197 29.737 1.00 0.00 H ATOM 77756 H11S PA 1870 142.081 18.610 30.322 1.00 0.00 H ATOM 77757 C110 PA 1870 142.664 16.647 30.984 1.00 0.00 C ATOM 77758 H10R PA 1870 141.872 16.561 31.731 1.00 0.00 H ATOM 77759 H10S PA 1870 143.456 16.241 31.617 1.00 0.00 H ATOM 77760 C19 PA 1870 142.607 15.656 29.770 1.00 0.00 C ATOM 77761 H9R PA 1870 142.384 14.634 30.085 1.00 0.00 H ATOM 77762 H9S PA 1870 143.554 15.596 29.229 1.00 0.00 H ATOM 77763 C18 PA 1870 141.618 16.198 28.660 1.00 0.00 C ATOM 77764 H8R PA 1870 142.166 17.066 28.289 1.00 0.00 H ATOM 77765 H8S PA 1870 140.761 16.585 29.214 1.00 0.00 H ATOM 77766 C17 PA 1870 141.354 15.122 27.535 1.00 0.00 C ATOM 77767 H7R PA 1870 140.984 14.158 27.890 1.00 0.00 H ATOM 77768 H7S PA 1870 142.356 14.843 27.204 1.00 0.00 H ATOM 77769 C16 PA 1870 140.525 15.649 26.381 1.00 0.00 C ATOM 77770 H6R PA 1870 141.066 16.523 26.011 1.00 0.00 H ATOM 77771 H6S PA 1870 139.590 16.126 26.685 1.00 0.00 H ATOM 77772 C15 PA 1870 140.318 14.659 25.207 1.00 0.00 C ATOM 77773 H5R PA 1870 141.290 14.447 24.757 1.00 0.00 H ATOM 77774 H5S PA 1870 139.856 15.299 24.451 1.00 0.00 H ATOM 77775 C14 PA 1870 139.485 13.371 25.504 1.00 0.00 C ATOM 77776 H4R PA 1870 138.500 13.603 25.914 1.00 0.00 H ATOM 77777 H4S PA 1870 140.078 12.826 26.242 1.00 0.00 H ATOM 77778 C13 PA 1870 139.253 12.644 24.251 1.00 0.00 C ATOM 77779 H3R PA 1870 138.654 13.266 23.584 1.00 0.00 H ATOM 77780 H3S PA 1870 138.849 11.668 24.528 1.00 0.00 H ATOM 77781 C12 PA 1870 140.544 12.150 23.548 1.00 0.00 C ATOM 77782 H2R PA 1870 141.003 12.827 22.824 1.00 0.00 H ATOM 77783 H2S PA 1870 141.181 11.667 24.291 1.00 0.00 H ATOM 77784 C11 PGR 1871 140.224 11.010 22.686 1.00 0.00 C ATOM 77785 O12 PGR 1871 139.123 10.725 22.345 1.00 0.00 O ATOM 77786 O11 PGR 1871 141.293 10.154 22.533 1.00 0.00 O ATOM 77787 C1 PGR 1871 140.988 8.938 21.814 1.00 0.00 C ATOM 77788 HR PGR 1871 140.595 9.250 20.843 1.00 0.00 H ATOM 77789 HS PGR 1871 140.215 8.385 22.353 1.00 0.00 H ATOM 77790 C2 PGR 1871 142.261 8.162 21.573 1.00 0.00 C ATOM 77791 HX PGR 1871 142.982 8.851 21.128 1.00 0.00 H ATOM 77792 C3 PGR 1871 142.123 6.999 20.593 1.00 0.00 C ATOM 77793 HA PGR 1871 141.490 7.248 19.738 1.00 0.00 H ATOM 77794 HB PGR 1871 141.599 6.254 21.197 1.00 0.00 H ATOM 77795 O31 PGR 1871 143.412 6.609 20.224 1.00 0.00 O ATOM 77796 P31 PGR 1871 143.631 5.823 18.843 1.00 0.00 P ATOM 77797 O32 PGR 1871 143.509 6.898 17.701 1.00 0.00 O ATOM 77798 C31 PGR 1871 144.560 7.849 17.483 1.00 0.00 C ATOM 77799 H1A PGR 1871 145.538 7.363 17.433 1.00 0.00 H ATOM 77800 H1B PGR 1871 144.687 8.547 18.315 1.00 0.00 H ATOM 77801 C32 PGR 1871 144.348 8.699 16.210 1.00 0.00 C ATOM 77802 H2A PGR 1871 143.346 9.133 16.153 1.00 0.00 H ATOM 77803 O35 PGR 1871 144.513 7.979 14.981 1.00 0.00 O ATOM 77804 HO5A PGR 1871 144.125 8.553 14.297 1.00 0.00 H ATOM 77805 C33 PGR 1871 145.258 10.003 16.179 1.00 0.00 C ATOM 77806 H3A PGR 1871 145.168 10.458 15.190 1.00 0.00 H ATOM 77807 H3B PGR 1871 144.944 10.732 16.931 1.00 0.00 H ATOM 77808 O33 PGR 1871 144.981 5.234 18.798 1.00 0.00 O ATOM 77809 O34 PGR 1871 142.484 4.921 18.597 1.00 0.00 O ATOM 77810 O21 PGR 1871 142.761 7.594 22.799 1.00 0.00 O ATOM 77811 C21 PGR 1871 143.973 8.040 23.261 1.00 0.00 C ATOM 77812 O22 PGR 1871 144.598 8.947 22.768 1.00 0.00 O ATOM 77813 O36 PGR 1871 146.588 9.566 16.402 1.00 0.00 O ATOM 77814 HO6A PGR 1871 146.679 9.221 17.308 1.00 0.00 H ATOM 77815 C12 OL 1872 144.400 7.261 24.438 1.00 0.00 C ATOM 77816 H2R OL 1872 143.524 7.177 25.085 1.00 0.00 H ATOM 77817 H2S OL 1872 144.717 6.265 24.121 1.00 0.00 H ATOM 77818 C13 OL 1872 145.647 7.819 25.150 1.00 0.00 C ATOM 77819 H3R OL 1872 146.562 7.354 24.776 1.00 0.00 H ATOM 77820 H3S OL 1872 145.656 8.910 25.178 1.00 0.00 H ATOM 77821 C14 OL 1872 145.527 7.365 26.658 1.00 0.00 C ATOM 77822 H4R OL 1872 144.515 7.685 26.913 1.00 0.00 H ATOM 77823 H4S OL 1872 145.586 6.275 26.680 1.00 0.00 H ATOM 77824 C15 OL 1872 146.501 8.018 27.616 1.00 0.00 C ATOM 77825 H5R OL 1872 147.489 7.666 27.309 1.00 0.00 H ATOM 77826 H5S OL 1872 146.470 9.077 27.350 1.00 0.00 H ATOM 77827 C16 OL 1872 146.257 7.712 29.097 1.00 0.00 C ATOM 77828 H6R OL 1872 145.417 8.345 29.391 1.00 0.00 H ATOM 77829 H6S OL 1872 145.908 6.682 29.194 1.00 0.00 H ATOM 77830 C17 OL 1872 147.498 7.874 30.006 1.00 0.00 C ATOM 77831 H7R OL 1872 147.193 7.415 30.948 1.00 0.00 H ATOM 77832 H7S OL 1872 148.328 7.278 29.620 1.00 0.00 H ATOM 77833 C18 OL 1872 148.202 9.272 30.153 1.00 0.00 C ATOM 77834 H8R OL 1872 147.361 9.969 30.179 1.00 0.00 H ATOM 77835 H8S OL 1872 148.614 9.373 31.159 1.00 0.00 H ATOM 77836 C19 OL 1872 149.059 9.642 28.943 1.00 0.00 C ATOM 77837 H9R OL 1872 148.582 9.662 27.966 1.00 0.00 H ATOM 77838 C110 OL 1872 150.317 9.977 28.957 1.00 0.00 C ATOM 77839 H10R OL 1872 150.706 10.325 28.003 1.00 0.00 H ATOM 77840 C111 OL 1872 151.249 10.042 30.121 1.00 0.00 C ATOM 77841 H11R OL 1872 151.299 11.029 30.586 1.00 0.00 H ATOM 77842 H11S OL 1872 150.999 9.310 30.891 1.00 0.00 H ATOM 77843 C112 OL 1872 152.710 9.849 29.715 1.00 0.00 C ATOM 77844 H12R OL 1872 152.831 8.883 29.220 1.00 0.00 H ATOM 77845 H12S OL 1872 153.059 10.458 28.879 1.00 0.00 H ATOM 77846 C113 OL 1872 153.700 9.937 30.906 1.00 0.00 C ATOM 77847 H13R OL 1872 153.682 10.939 31.339 1.00 0.00 H ATOM 77848 H13S OL 1872 153.339 9.305 31.721 1.00 0.00 H ATOM 77849 C114 OL 1872 155.132 9.662 30.330 1.00 0.00 C ATOM 77850 H14R OL 1872 155.057 8.915 29.538 1.00 0.00 H ATOM 77851 H14S OL 1872 155.382 10.553 29.749 1.00 0.00 H ATOM 77852 C115 OL 1872 156.083 9.262 31.421 1.00 0.00 C ATOM 77853 H15R OL 1872 155.934 8.248 31.797 1.00 0.00 H ATOM 77854 H15S OL 1872 157.113 9.449 31.108 1.00 0.00 H ATOM 77855 C116 OL 1872 155.882 10.122 32.754 1.00 0.00 C ATOM 77856 H16R OL 1872 155.892 11.194 32.547 1.00 0.00 H ATOM 77857 H16S OL 1872 154.993 9.881 33.340 1.00 0.00 H ATOM 77858 C117 OL 1872 157.039 9.876 33.726 1.00 0.00 C ATOM 77859 H17R OL 1872 157.011 8.836 34.057 1.00 0.00 H ATOM 77860 H17S OL 1872 157.957 10.004 33.148 1.00 0.00 H ATOM 77861 C118 OL 1872 157.124 10.816 34.954 1.00 0.00 C ATOM 77862 H18R OL 1872 157.675 10.253 35.710 1.00 0.00 H ATOM 77863 H18S OL 1872 156.116 10.966 35.346 1.00 0.00 H ATOM 77864 H18T OL 1872 157.527 11.801 34.712 1.00 0.00 H TER 77865 OL 1872 ATOM 77865 C116 PA 1873 141.347 115.026 31.081 1.00 0.00 C ATOM 77866 H16R PA 1873 141.171 113.948 31.051 1.00 0.00 H ATOM 77867 H16S PA 1873 141.862 115.027 32.044 1.00 0.00 H ATOM 77868 H16T PA 1873 141.869 115.478 30.235 1.00 0.00 H ATOM 77869 C115 PA 1873 139.980 115.701 31.309 1.00 0.00 C ATOM 77870 H15R PA 1873 139.387 115.658 30.393 1.00 0.00 H ATOM 77871 H15S PA 1873 140.027 116.770 31.528 1.00 0.00 H ATOM 77872 C114 PA 1873 139.210 114.941 32.387 1.00 0.00 C ATOM 77873 H14R PA 1873 139.809 114.743 33.279 1.00 0.00 H ATOM 77874 H14S PA 1873 138.888 114.035 31.868 1.00 0.00 H ATOM 77875 C113 PA 1873 137.907 115.594 32.809 1.00 0.00 C ATOM 77876 H13R PA 1873 138.106 116.575 33.246 1.00 0.00 H ATOM 77877 H13S PA 1873 137.379 114.986 33.546 1.00 0.00 H ATOM 77878 C112 PA 1873 136.887 115.833 31.669 1.00 0.00 C ATOM 77879 H12R PA 1873 136.828 114.847 31.205 1.00 0.00 H ATOM 77880 H12S PA 1873 137.323 116.572 30.993 1.00 0.00 H ATOM 77881 C111 PA 1873 135.545 116.434 32.158 1.00 0.00 C ATOM 77882 H11R PA 1873 135.043 116.937 31.329 1.00 0.00 H ATOM 77883 H11S PA 1873 135.762 117.225 32.879 1.00 0.00 H ATOM 77884 C110 PA 1873 134.547 115.381 32.643 1.00 0.00 C ATOM 77885 H10R PA 1873 133.760 115.844 33.241 1.00 0.00 H ATOM 77886 H10S PA 1873 134.956 114.564 33.241 1.00 0.00 H ATOM 77887 C19 PA 1873 133.774 114.674 31.614 1.00 0.00 C ATOM 77888 H9R PA 1873 134.464 114.366 30.826 1.00 0.00 H ATOM 77889 H9S PA 1873 133.268 115.485 31.087 1.00 0.00 H ATOM 77890 C18 PA 1873 132.851 113.555 31.971 1.00 0.00 C ATOM 77891 H8R PA 1873 132.498 113.985 32.910 1.00 0.00 H ATOM 77892 H8S PA 1873 133.277 112.586 32.238 1.00 0.00 H ATOM 77893 C17 PA 1873 131.784 113.412 30.843 1.00 0.00 C ATOM 77894 H7R PA 1873 132.182 113.011 29.909 1.00 0.00 H ATOM 77895 H7S PA 1873 131.340 114.364 30.544 1.00 0.00 H ATOM 77896 C16 PA 1873 130.569 112.611 31.326 1.00 0.00 C ATOM 77897 H6R PA 1873 130.288 113.059 32.281 1.00 0.00 H ATOM 77898 H6S PA 1873 130.897 111.631 31.677 1.00 0.00 H ATOM 77899 C15 PA 1873 129.419 112.490 30.305 1.00 0.00 C ATOM 77900 H5R PA 1873 129.780 112.768 29.313 1.00 0.00 H ATOM 77901 H5S PA 1873 128.690 113.265 30.553 1.00 0.00 H ATOM 77902 C14 PA 1873 128.660 111.095 30.429 1.00 0.00 C ATOM 77903 H4R PA 1873 127.788 111.284 31.058 1.00 0.00 H ATOM 77904 H4S PA 1873 129.283 110.391 30.985 1.00 0.00 H ATOM 77905 C13 PA 1873 128.312 110.498 29.145 1.00 0.00 C ATOM 77906 H3R PA 1873 127.887 109.496 29.242 1.00 0.00 H ATOM 77907 H3S PA 1873 129.267 110.353 28.636 1.00 0.00 H ATOM 77908 C12 PA 1873 127.179 111.323 28.340 1.00 0.00 C ATOM 77909 H2R PA 1873 127.355 112.395 28.457 1.00 0.00 H ATOM 77910 H2S PA 1873 126.153 111.256 28.709 1.00 0.00 H ATOM 77911 C11 PGR 1874 127.142 110.981 26.858 1.00 0.00 C ATOM 77912 O12 PGR 1874 126.768 111.716 26.020 1.00 0.00 O ATOM 77913 O11 PGR 1874 127.541 109.706 26.616 1.00 0.00 O ATOM 77914 C1 PGR 1874 127.317 109.211 25.259 1.00 0.00 C ATOM 77915 HR PGR 1874 127.918 109.776 24.542 1.00 0.00 H ATOM 77916 HS PGR 1874 126.284 109.454 24.996 1.00 0.00 H ATOM 77917 C2 PGR 1874 127.582 107.713 25.211 1.00 0.00 C ATOM 77918 HX PGR 1874 128.558 107.434 25.617 1.00 0.00 H ATOM 77919 C3 PGR 1874 127.556 107.356 23.721 1.00 0.00 C ATOM 77920 HA PGR 1874 127.876 106.313 23.795 1.00 0.00 H ATOM 77921 HB PGR 1874 128.267 107.953 23.144 1.00 0.00 H ATOM 77922 O31 PGR 1874 126.270 107.457 23.126 1.00 0.00 O ATOM 77923 P31 PGR 1874 125.925 106.777 21.679 1.00 0.00 P ATOM 77924 O32 PGR 1874 125.290 105.432 22.000 1.00 0.00 O ATOM 77925 C31 PGR 1874 124.070 105.406 22.710 1.00 0.00 C ATOM 77926 H1A PGR 1874 123.363 106.047 22.176 1.00 0.00 H ATOM 77927 H1B PGR 1874 124.203 105.821 23.712 1.00 0.00 H ATOM 77928 C32 PGR 1874 123.524 103.963 22.848 1.00 0.00 C ATOM 77929 H2A PGR 1874 122.435 103.952 22.948 1.00 0.00 H ATOM 77930 O35 PGR 1874 124.110 103.328 23.998 1.00 0.00 O ATOM 77931 HO5A PGR 1874 123.966 102.378 24.156 1.00 0.00 H ATOM 77932 C33 PGR 1874 123.901 103.029 21.687 1.00 0.00 C ATOM 77933 H3A PGR 1874 123.941 103.639 20.780 1.00 0.00 H ATOM 77934 H3B PGR 1874 124.851 102.533 21.901 1.00 0.00 H ATOM 77935 O33 PGR 1874 124.932 107.663 21.057 1.00 0.00 O ATOM 77936 O34 PGR 1874 127.155 106.506 20.911 1.00 0.00 O ATOM 77937 O21 PGR 1874 126.561 107.089 25.978 1.00 0.00 O ATOM 77938 C21 PGR 1874 126.807 105.925 26.612 1.00 0.00 C ATOM 77939 O22 PGR 1874 127.884 105.418 26.614 1.00 0.00 O ATOM 77940 O36 PGR 1874 122.947 101.997 21.554 1.00 0.00 O ATOM 77941 HO6A PGR 1874 122.115 102.501 21.498 1.00 0.00 H ATOM 77942 C12 OL 1875 125.599 105.413 27.375 1.00 0.00 C ATOM 77943 H2R OL 1875 124.891 105.134 26.591 1.00 0.00 H ATOM 77944 H2S OL 1875 125.810 104.482 27.904 1.00 0.00 H ATOM 77945 C13 OL 1875 125.044 106.545 28.242 1.00 0.00 C ATOM 77946 H3R OL 1875 124.703 107.419 27.682 1.00 0.00 H ATOM 77947 H3S OL 1875 124.171 106.023 28.640 1.00 0.00 H ATOM 77948 C14 OL 1875 125.859 107.066 29.312 1.00 0.00 C ATOM 77949 H4R OL 1875 126.373 106.213 29.760 1.00 0.00 H ATOM 77950 H4S OL 1875 126.605 107.678 28.802 1.00 0.00 H ATOM 77951 C15 OL 1875 125.217 107.905 30.323 1.00 0.00 C ATOM 77952 H5R OL 1875 124.916 108.775 29.736 1.00 0.00 H ATOM 77953 H5S OL 1875 124.330 107.422 30.739 1.00 0.00 H ATOM 77954 C16 OL 1875 126.115 108.098 31.488 1.00 0.00 C ATOM 77955 H6R OL 1875 126.301 107.142 31.982 1.00 0.00 H ATOM 77956 H6S OL 1875 127.090 108.360 31.071 1.00 0.00 H ATOM 77957 C17 OL 1875 125.600 109.264 32.363 1.00 0.00 C ATOM 77958 H7R OL 1875 125.721 110.220 31.850 1.00 0.00 H ATOM 77959 H7S OL 1875 124.540 109.136 32.591 1.00 0.00 H ATOM 77960 C18 OL 1875 126.299 109.344 33.716 1.00 0.00 C ATOM 77961 H8R OL 1875 126.133 108.422 34.276 1.00 0.00 H ATOM 77962 H8S OL 1875 127.343 109.271 33.406 1.00 0.00 H ATOM 77963 C19 OL 1875 126.055 110.519 34.443 1.00 0.00 C ATOM 77964 H9R OL 1875 126.634 111.345 34.037 1.00 0.00 H ATOM 77965 C110 OL 1875 125.352 110.606 35.612 1.00 0.00 C ATOM 77966 H10R OL 1875 125.382 111.581 36.092 1.00 0.00 H ATOM 77967 C111 OL 1875 124.398 109.601 36.239 1.00 0.00 C ATOM 77968 H11R OL 1875 123.889 109.117 35.403 1.00 0.00 H ATOM 77969 H11S OL 1875 124.899 108.837 36.838 1.00 0.00 H ATOM 77970 C112 OL 1875 123.199 110.355 36.958 1.00 0.00 C ATOM 77971 H12R OL 1875 123.528 110.565 37.978 1.00 0.00 H ATOM 77972 H12S OL 1875 122.916 111.335 36.568 1.00 0.00 H ATOM 77973 C113 OL 1875 121.870 109.489 37.072 1.00 0.00 C ATOM 77974 H13R OL 1875 120.976 110.053 37.344 1.00 0.00 H ATOM 77975 H13S OL 1875 121.708 109.005 36.106 1.00 0.00 H ATOM 77976 C114 OL 1875 122.116 108.327 38.130 1.00 0.00 C ATOM 77977 H14R OL 1875 121.440 107.481 37.989 1.00 0.00 H ATOM 77978 H14S OL 1875 123.057 107.812 37.926 1.00 0.00 H ATOM 77979 C115 OL 1875 121.961 108.816 39.568 1.00 0.00 C ATOM 77980 H15R OL 1875 122.568 109.723 39.608 1.00 0.00 H ATOM 77981 H15S OL 1875 120.950 109.205 39.705 1.00 0.00 H ATOM 77982 C116 OL 1875 122.368 107.848 40.666 1.00 0.00 C ATOM 77983 H16R OL 1875 123.354 107.421 40.470 1.00 0.00 H ATOM 77984 H16S OL 1875 122.508 108.466 41.555 1.00 0.00 H ATOM 77985 C117 OL 1875 121.286 106.789 40.847 1.00 0.00 C ATOM 77986 H17R OL 1875 120.301 107.222 41.033 1.00 0.00 H ATOM 77987 H17S OL 1875 121.122 106.232 39.922 1.00 0.00 H ATOM 77988 C118 OL 1875 121.514 105.814 42.056 1.00 0.00 C ATOM 77989 H18R OL 1875 121.233 106.346 42.967 1.00 0.00 H ATOM 77990 H18S OL 1875 122.587 105.654 42.177 1.00 0.00 H ATOM 77991 H18T OL 1875 120.967 104.871 41.993 1.00 0.00 H TER 77992 OL 1875 ATOM 77992 C116 PA 1876 15.560 101.373 43.099 1.00 0.00 C ATOM 77993 H16R PA 1876 16.535 101.044 43.466 1.00 0.00 H ATOM 77994 H16S PA 1876 14.798 101.746 43.787 1.00 0.00 H ATOM 77995 H16T PA 1876 15.810 102.249 42.497 1.00 0.00 H ATOM 77996 C115 PA 1876 14.924 100.439 42.067 1.00 0.00 C ATOM 77997 H15R PA 1876 14.592 99.530 42.575 1.00 0.00 H ATOM 77998 H15S PA 1876 15.704 100.120 41.373 1.00 0.00 H ATOM 77999 C114 PA 1876 13.780 101.081 41.269 1.00 0.00 C ATOM 78000 H14R PA 1876 13.948 102.087 40.878 1.00 0.00 H ATOM 78001 H14S PA 1876 12.935 101.229 41.945 1.00 0.00 H ATOM 78002 C113 PA 1876 13.411 100.274 39.973 1.00 0.00 C ATOM 78003 H13R PA 1876 13.537 99.252 40.338 1.00 0.00 H ATOM 78004 H13S PA 1876 14.127 100.512 39.185 1.00 0.00 H ATOM 78005 C112 PA 1876 12.033 100.502 39.333 1.00 0.00 C ATOM 78006 H12R PA 1876 12.053 100.496 38.241 1.00 0.00 H ATOM 78007 H12S PA 1876 11.945 101.583 39.465 1.00 0.00 H ATOM 78008 C111 PA 1876 10.893 99.792 40.018 1.00 0.00 C ATOM 78009 H11R PA 1876 10.906 99.949 41.098 1.00 0.00 H ATOM 78010 H11S PA 1876 10.952 98.702 39.975 1.00 0.00 H ATOM 78011 C110 PA 1876 9.458 100.196 39.529 1.00 0.00 C ATOM 78012 H10R PA 1876 9.358 101.282 39.485 1.00 0.00 H ATOM 78013 H10S PA 1876 8.762 99.917 40.324 1.00 0.00 H ATOM 78014 C19 PA 1876 9.129 99.503 38.199 1.00 0.00 C ATOM 78015 H9R PA 1876 9.158 98.412 38.236 1.00 0.00 H ATOM 78016 H9S PA 1876 9.935 99.862 37.556 1.00 0.00 H ATOM 78017 C18 PA 1876 7.762 100.084 37.725 1.00 0.00 C ATOM 78018 H8R PA 1876 7.819 101.175 37.730 1.00 0.00 H ATOM 78019 H8S PA 1876 6.982 99.779 38.425 1.00 0.00 H ATOM 78020 C17 PA 1876 7.383 99.559 36.273 1.00 0.00 C ATOM 78021 H7R PA 1876 7.258 98.487 36.440 1.00 0.00 H ATOM 78022 H7S PA 1876 8.180 99.561 35.526 1.00 0.00 H ATOM 78023 C16 PA 1876 6.121 100.335 35.623 1.00 0.00 C ATOM 78024 H6R PA 1876 6.039 101.407 35.814 1.00 0.00 H ATOM 78025 H6S PA 1876 5.185 99.954 36.036 1.00 0.00 H ATOM 78026 C15 PA 1876 5.964 100.074 34.115 1.00 0.00 C ATOM 78027 H5R PA 1876 5.477 99.104 33.988 1.00 0.00 H ATOM 78028 H5S PA 1876 7.013 100.154 33.823 1.00 0.00 H ATOM 78029 C14 PA 1876 5.170 101.162 33.377 1.00 0.00 C ATOM 78030 H4R PA 1876 5.470 102.125 33.794 1.00 0.00 H ATOM 78031 H4S PA 1876 4.110 101.134 33.640 1.00 0.00 H ATOM 78032 C13 PA 1876 5.293 101.306 31.833 1.00 0.00 C ATOM 78033 H3R PA 1876 4.597 102.066 31.471 1.00 0.00 H ATOM 78034 H3S PA 1876 4.881 100.422 31.341 1.00 0.00 H ATOM 78035 C12 PA 1876 6.606 101.466 31.333 1.00 0.00 C ATOM 78036 H2R PA 1876 7.184 100.555 31.500 1.00 0.00 H ATOM 78037 H2S PA 1876 7.204 102.280 31.747 1.00 0.00 H ATOM 78038 C11 PGR 1877 6.656 101.568 29.831 1.00 0.00 C ATOM 78039 O12 PGR 1877 5.747 101.313 29.053 1.00 0.00 O ATOM 78040 O11 PGR 1877 7.771 102.268 29.433 1.00 0.00 O ATOM 78041 C1 PGR 1877 7.876 102.647 28.043 1.00 0.00 C ATOM 78042 HR PGR 1877 7.248 102.003 27.423 1.00 0.00 H ATOM 78043 HS PGR 1877 8.853 102.366 27.640 1.00 0.00 H ATOM 78044 C2 PGR 1877 7.869 104.162 27.846 1.00 0.00 C ATOM 78045 HX PGR 1877 7.006 104.592 28.360 1.00 0.00 H ATOM 78046 C3 PGR 1877 7.867 104.419 26.309 1.00 0.00 C ATOM 78047 HA PGR 1877 7.612 105.457 26.080 1.00 0.00 H ATOM 78048 HB PGR 1877 6.986 103.841 26.017 1.00 0.00 H ATOM 78049 O31 PGR 1877 8.975 104.019 25.669 1.00 0.00 O ATOM 78050 P31 PGR 1877 9.059 103.968 24.049 1.00 0.00 P ATOM 78051 O32 PGR 1877 9.368 105.448 23.644 1.00 0.00 O ATOM 78052 C31 PGR 1877 10.528 106.101 23.984 1.00 0.00 C ATOM 78053 H1A PGR 1877 11.388 105.961 23.324 1.00 0.00 H ATOM 78054 H1B PGR 1877 10.761 105.741 24.989 1.00 0.00 H ATOM 78055 C32 PGR 1877 10.195 107.620 23.915 1.00 0.00 C ATOM 78056 H2A PGR 1877 9.174 107.697 24.298 1.00 0.00 H ATOM 78057 O35 PGR 1877 10.314 108.083 22.568 1.00 0.00 O ATOM 78058 HO5A PGR 1877 9.438 107.853 22.208 1.00 0.00 H ATOM 78059 C33 PGR 1877 11.143 108.439 24.748 1.00 0.00 C ATOM 78060 H3A PGR 1877 11.031 109.520 24.632 1.00 0.00 H ATOM 78061 H3B PGR 1877 10.882 108.399 25.809 1.00 0.00 H ATOM 78062 O33 PGR 1877 10.218 103.150 23.597 1.00 0.00 O ATOM 78063 O34 PGR 1877 7.721 103.566 23.560 1.00 0.00 O ATOM 78064 O21 PGR 1877 9.094 104.750 28.459 1.00 0.00 O ATOM 78065 C21 PGR 1877 9.276 106.095 28.346 1.00 0.00 C ATOM 78066 O22 PGR 1877 8.449 106.887 28.017 1.00 0.00 O ATOM 78067 O36 PGR 1877 12.439 107.906 24.620 1.00 0.00 O ATOM 78068 HO6A PGR 1877 12.946 108.316 25.343 1.00 0.00 H ATOM 78069 C12 OL 1878 10.757 106.436 28.623 1.00 0.00 C ATOM 78070 H2R OL 1878 11.436 105.803 28.048 1.00 0.00 H ATOM 78071 H2S OL 1878 11.035 107.466 28.386 1.00 0.00 H ATOM 78072 C13 OL 1878 11.084 106.260 30.102 1.00 0.00 C ATOM 78073 H3R OL 1878 10.362 106.832 30.688 1.00 0.00 H ATOM 78074 H3S OL 1878 10.909 105.204 30.314 1.00 0.00 H ATOM 78075 C14 OL 1878 12.536 106.564 30.456 1.00 0.00 C ATOM 78076 H4R OL 1878 12.722 105.871 31.280 1.00 0.00 H ATOM 78077 H4S OL 1878 13.228 106.149 29.720 1.00 0.00 H ATOM 78078 C15 OL 1878 12.978 108.014 30.872 1.00 0.00 C ATOM 78079 H5R OL 1878 14.067 108.069 30.920 1.00 0.00 H ATOM 78080 H5S OL 1878 12.614 108.741 30.143 1.00 0.00 H ATOM 78081 C16 OL 1878 12.417 108.455 32.235 1.00 0.00 C ATOM 78082 H6R OL 1878 11.370 108.183 32.380 1.00 0.00 H ATOM 78083 H6S OL 1878 12.865 107.859 33.033 1.00 0.00 H ATOM 78084 C17 OL 1878 12.575 109.988 32.403 1.00 0.00 C ATOM 78085 H7R OL 1878 13.611 110.326 32.333 1.00 0.00 H ATOM 78086 H7S OL 1878 12.000 110.458 31.602 1.00 0.00 H ATOM 78087 C18 OL 1878 12.269 110.397 33.863 1.00 0.00 C ATOM 78088 H8R OL 1878 12.469 111.469 33.817 1.00 0.00 H ATOM 78089 H8S OL 1878 11.203 110.278 34.069 1.00 0.00 H ATOM 78090 C19 OL 1878 13.148 109.756 34.878 1.00 0.00 C ATOM 78091 H9R OL 1878 14.197 109.999 34.731 1.00 0.00 H ATOM 78092 C110 OL 1878 12.719 109.002 35.882 1.00 0.00 C ATOM 78093 H10R OL 1878 13.428 108.697 36.648 1.00 0.00 H ATOM 78094 C111 OL 1878 11.336 108.621 36.306 1.00 0.00 C ATOM 78095 H11R OL 1878 10.585 109.199 35.764 1.00 0.00 H ATOM 78096 H11S OL 1878 11.151 107.560 36.125 1.00 0.00 H ATOM 78097 C112 OL 1878 11.290 108.814 37.782 1.00 0.00 C ATOM 78098 H12R OL 1878 12.029 108.178 38.274 1.00 0.00 H ATOM 78099 H12S OL 1878 11.586 109.843 37.998 1.00 0.00 H ATOM 78100 C113 OL 1878 9.887 108.559 38.272 1.00 0.00 C ATOM 78101 H13R OL 1878 9.477 107.640 37.848 1.00 0.00 H ATOM 78102 H13S OL 1878 10.063 108.552 39.349 1.00 0.00 H ATOM 78103 C114 OL 1878 8.837 109.724 38.164 1.00 0.00 C ATOM 78104 H14R OL 1878 9.350 110.688 38.134 1.00 0.00 H ATOM 78105 H14S OL 1878 8.288 109.618 37.226 1.00 0.00 H ATOM 78106 C115 OL 1878 7.724 109.762 39.276 1.00 0.00 C ATOM 78107 H15R OL 1878 8.219 109.934 40.234 1.00 0.00 H ATOM 78108 H15S OL 1878 7.025 110.589 39.140 1.00 0.00 H ATOM 78109 C116 OL 1878 6.862 108.491 39.356 1.00 0.00 C ATOM 78110 H16R OL 1878 6.510 108.249 38.351 1.00 0.00 H ATOM 78111 H16S OL 1878 7.412 107.662 39.806 1.00 0.00 H ATOM 78112 C117 OL 1878 5.497 108.706 40.037 1.00 0.00 C ATOM 78113 H17R OL 1878 5.080 109.604 39.577 1.00 0.00 H ATOM 78114 H17S OL 1878 4.904 107.842 39.732 1.00 0.00 H ATOM 78115 C118 OL 1878 5.662 108.837 41.593 1.00 0.00 C ATOM 78116 H18R OL 1878 4.751 108.651 42.166 1.00 0.00 H ATOM 78117 H18S OL 1878 6.133 109.766 41.922 1.00 0.00 H ATOM 78118 H18T OL 1878 6.374 108.088 41.945 1.00 0.00 H TER 78119 OL 1878 ATOM 78119 C116 PA 1879 24.506 35.306 43.628 1.00 0.00 C ATOM 78120 H16R PA 1879 24.436 36.387 43.767 1.00 0.00 H ATOM 78121 H16S PA 1879 24.966 35.212 42.643 1.00 0.00 H ATOM 78122 H16T PA 1879 25.188 34.892 44.374 1.00 0.00 H ATOM 78123 C115 PA 1879 23.172 34.651 43.717 1.00 0.00 C ATOM 78124 H15R PA 1879 22.367 35.109 43.138 1.00 0.00 H ATOM 78125 H15S PA 1879 22.780 34.619 44.736 1.00 0.00 H ATOM 78126 C114 PA 1879 23.305 33.217 43.230 1.00 0.00 C ATOM 78127 H14R PA 1879 24.123 32.764 43.795 1.00 0.00 H ATOM 78128 H14S PA 1879 23.472 33.086 42.159 1.00 0.00 H ATOM 78129 C113 PA 1879 21.943 32.432 43.467 1.00 0.00 C ATOM 78130 H13R PA 1879 21.201 33.051 42.957 1.00 0.00 H ATOM 78131 H13S PA 1879 21.550 32.659 44.460 1.00 0.00 H ATOM 78132 C112 PA 1879 21.822 30.958 42.956 1.00 0.00 C ATOM 78133 H12R PA 1879 20.784 30.634 43.058 1.00 0.00 H ATOM 78134 H12S PA 1879 22.449 30.259 43.514 1.00 0.00 H ATOM 78135 C111 PA 1879 22.170 30.864 41.477 1.00 0.00 C ATOM 78136 H11R PA 1879 23.242 30.877 41.269 1.00 0.00 H ATOM 78137 H11S PA 1879 21.874 31.786 40.972 1.00 0.00 H ATOM 78138 C110 PA 1879 21.607 29.610 40.776 1.00 0.00 C ATOM 78139 H10R PA 1879 20.536 29.770 40.912 1.00 0.00 H ATOM 78140 H10S PA 1879 21.862 28.619 41.158 1.00 0.00 H ATOM 78141 C19 PA 1879 22.072 29.643 39.278 1.00 0.00 C ATOM 78142 H9R PA 1879 21.736 30.595 38.863 1.00 0.00 H ATOM 78143 H9S PA 1879 21.494 28.913 38.708 1.00 0.00 H ATOM 78144 C18 PA 1879 23.607 29.424 39.109 1.00 0.00 C ATOM 78145 H8R PA 1879 23.751 28.597 39.808 1.00 0.00 H ATOM 78146 H8S PA 1879 24.235 30.254 39.441 1.00 0.00 H ATOM 78147 C17 PA 1879 23.968 29.111 37.666 1.00 0.00 C ATOM 78148 H7R PA 1879 24.041 29.995 37.028 1.00 0.00 H ATOM 78149 H7S PA 1879 23.199 28.528 37.155 1.00 0.00 H ATOM 78150 C16 PA 1879 25.340 28.361 37.660 1.00 0.00 C ATOM 78151 H6R PA 1879 25.362 27.578 38.421 1.00 0.00 H ATOM 78152 H6S PA 1879 26.138 29.059 37.922 1.00 0.00 H ATOM 78153 C15 PA 1879 25.691 27.770 36.268 1.00 0.00 C ATOM 78154 H5R PA 1879 26.770 27.663 36.143 1.00 0.00 H ATOM 78155 H5S PA 1879 25.427 28.552 35.552 1.00 0.00 H ATOM 78156 C14 PA 1879 24.984 26.477 35.857 1.00 0.00 C ATOM 78157 H4R PA 1879 23.905 26.631 35.789 1.00 0.00 H ATOM 78158 H4S PA 1879 25.109 25.713 36.626 1.00 0.00 H ATOM 78159 C13 PA 1879 25.440 25.982 34.458 1.00 0.00 C ATOM 78160 H3R PA 1879 24.707 25.315 34.001 1.00 0.00 H ATOM 78161 H3S PA 1879 26.318 25.342 34.571 1.00 0.00 H ATOM 78162 C12 PA 1879 25.556 27.059 33.413 1.00 0.00 C ATOM 78163 H2R PA 1879 26.249 27.844 33.720 1.00 0.00 H ATOM 78164 H2S PA 1879 24.605 27.596 33.421 1.00 0.00 H ATOM 78165 C11 PGR 1880 25.806 26.561 32.070 1.00 0.00 C ATOM 78166 O12 PGR 1880 25.082 25.671 31.562 1.00 0.00 O ATOM 78167 O11 PGR 1880 26.870 27.191 31.483 1.00 0.00 O ATOM 78168 C1 PGR 1880 27.031 26.967 30.061 1.00 0.00 C ATOM 78169 HR PGR 1880 26.066 27.189 29.598 1.00 0.00 H ATOM 78170 HS PGR 1880 27.207 25.925 29.783 1.00 0.00 H ATOM 78171 C2 PGR 1880 27.935 27.957 29.367 1.00 0.00 C ATOM 78172 HX PGR 1880 27.506 28.957 29.475 1.00 0.00 H ATOM 78173 C3 PGR 1880 28.208 27.624 27.902 1.00 0.00 C ATOM 78174 HA PGR 1880 27.425 27.162 27.295 1.00 0.00 H ATOM 78175 HB PGR 1880 29.008 26.880 27.860 1.00 0.00 H ATOM 78176 O31 PGR 1880 28.635 28.727 27.175 1.00 0.00 O ATOM 78177 P31 PGR 1880 29.158 28.643 25.715 1.00 0.00 P ATOM 78178 O32 PGR 1880 30.679 28.322 25.876 1.00 0.00 O ATOM 78179 C31 PGR 1880 31.566 29.306 26.367 1.00 0.00 C ATOM 78180 H1A PGR 1880 31.198 29.662 27.333 1.00 0.00 H ATOM 78181 H1B PGR 1880 31.417 30.141 25.678 1.00 0.00 H ATOM 78182 C32 PGR 1880 32.988 28.857 26.309 1.00 0.00 C ATOM 78183 H2A PGR 1880 33.037 27.986 26.968 1.00 0.00 H ATOM 78184 O35 PGR 1880 33.347 28.421 24.965 1.00 0.00 O ATOM 78185 HO5A PGR 1880 32.584 28.071 24.469 1.00 0.00 H ATOM 78186 C33 PGR 1880 34.015 29.907 26.711 1.00 0.00 C ATOM 78187 H3A PGR 1880 34.049 30.686 25.946 1.00 0.00 H ATOM 78188 H3B PGR 1880 33.725 30.406 27.639 1.00 0.00 H ATOM 78189 O33 PGR 1880 28.439 27.551 25.027 1.00 0.00 O ATOM 78190 O34 PGR 1880 28.929 29.999 25.081 1.00 0.00 O ATOM 78191 O21 PGR 1880 29.148 27.903 30.077 1.00 0.00 O ATOM 78192 C21 PGR 1880 29.952 28.985 30.106 1.00 0.00 C ATOM 78193 O22 PGR 1880 29.688 30.072 29.684 1.00 0.00 O ATOM 78194 O36 PGR 1880 35.286 29.257 26.874 1.00 0.00 O ATOM 78195 HO6A PGR 1880 35.970 29.949 26.916 1.00 0.00 H ATOM 78196 C12 OL 1881 31.251 28.660 30.818 1.00 0.00 C ATOM 78197 H2R OL 1881 31.724 29.533 31.273 1.00 0.00 H ATOM 78198 H2S OL 1881 30.954 28.076 31.691 1.00 0.00 H ATOM 78199 C13 OL 1881 32.298 28.070 29.918 1.00 0.00 C ATOM 78200 H3R OL 1881 31.727 27.336 29.347 1.00 0.00 H ATOM 78201 H3S OL 1881 32.585 28.803 29.162 1.00 0.00 H ATOM 78202 C14 OL 1881 33.560 27.477 30.583 1.00 0.00 C ATOM 78203 H4R OL 1881 33.973 28.268 31.213 1.00 0.00 H ATOM 78204 H4S OL 1881 33.279 26.668 31.259 1.00 0.00 H ATOM 78205 C15 OL 1881 34.611 26.988 29.600 1.00 0.00 C ATOM 78206 H5R OL 1881 34.183 26.213 28.961 1.00 0.00 H ATOM 78207 H5S OL 1881 34.793 27.775 28.866 1.00 0.00 H ATOM 78208 C16 OL 1881 35.894 26.580 30.220 1.00 0.00 C ATOM 78209 H6R OL 1881 35.646 25.802 30.945 1.00 0.00 H ATOM 78210 H6S OL 1881 36.486 26.030 29.485 1.00 0.00 H ATOM 78211 C17 OL 1881 36.810 27.591 30.966 1.00 0.00 C ATOM 78212 H7R OL 1881 36.219 28.053 31.760 1.00 0.00 H ATOM 78213 H7S OL 1881 37.693 27.161 31.444 1.00 0.00 H ATOM 78214 C18 OL 1881 37.310 28.649 29.912 1.00 0.00 C ATOM 78215 H8R OL 1881 37.965 28.248 29.136 1.00 0.00 H ATOM 78216 H8S OL 1881 36.456 28.965 29.310 1.00 0.00 H ATOM 78217 C19 OL 1881 37.965 29.820 30.611 1.00 0.00 C ATOM 78218 H9R OL 1881 39.015 29.666 30.845 1.00 0.00 H ATOM 78219 C110 OL 1881 37.372 30.965 30.983 1.00 0.00 C ATOM 78220 H10R OL 1881 37.962 31.647 31.591 1.00 0.00 H ATOM 78221 C111 OL 1881 35.969 31.392 30.803 1.00 0.00 C ATOM 78222 H11R OL 1881 35.827 32.217 30.102 1.00 0.00 H ATOM 78223 H11S OL 1881 35.482 30.505 30.393 1.00 0.00 H ATOM 78224 C112 OL 1881 35.376 31.749 32.154 1.00 0.00 C ATOM 78225 H12R OL 1881 36.041 32.418 32.705 1.00 0.00 H ATOM 78226 H12S OL 1881 34.414 32.260 32.086 1.00 0.00 H ATOM 78227 C113 OL 1881 35.051 30.576 33.069 1.00 0.00 C ATOM 78228 H13R OL 1881 34.265 30.004 32.571 1.00 0.00 H ATOM 78229 H13S OL 1881 35.878 29.864 33.105 1.00 0.00 H ATOM 78230 C114 OL 1881 34.673 31.102 34.489 1.00 0.00 C ATOM 78231 H14R OL 1881 35.567 31.396 35.042 1.00 0.00 H ATOM 78232 H14S OL 1881 34.004 31.957 34.371 1.00 0.00 H ATOM 78233 C115 OL 1881 34.136 29.928 35.342 1.00 0.00 C ATOM 78234 H15R OL 1881 33.328 29.476 34.762 1.00 0.00 H ATOM 78235 H15S OL 1881 34.939 29.189 35.314 1.00 0.00 H ATOM 78236 C116 OL 1881 33.882 30.170 36.781 1.00 0.00 C ATOM 78237 H16R OL 1881 34.696 30.655 37.324 1.00 0.00 H ATOM 78238 H16S OL 1881 33.037 30.862 36.810 1.00 0.00 H ATOM 78239 C117 OL 1881 33.553 28.874 37.596 1.00 0.00 C ATOM 78240 H17R OL 1881 32.716 28.458 37.030 1.00 0.00 H ATOM 78241 H17S OL 1881 34.274 28.054 37.609 1.00 0.00 H ATOM 78242 C118 OL 1881 32.969 28.953 39.022 1.00 0.00 C ATOM 78243 H18R OL 1881 33.052 27.922 39.369 1.00 0.00 H ATOM 78244 H18S OL 1881 31.961 29.373 39.028 1.00 0.00 H ATOM 78245 H18T OL 1881 33.733 29.487 39.591 1.00 0.00 H TER 78246 OL 1881 ATOM 78246 C116 PA 1882 132.854 26.439 40.183 1.00 0.00 C ATOM 78247 H16R PA 1882 133.829 26.717 40.587 1.00 0.00 H ATOM 78248 H16S PA 1882 132.463 25.713 40.899 1.00 0.00 H ATOM 78249 H16T PA 1882 132.227 27.332 40.219 1.00 0.00 H ATOM 78250 C115 PA 1882 132.812 25.869 38.813 1.00 0.00 C ATOM 78251 H15R PA 1882 133.349 24.928 38.674 1.00 0.00 H ATOM 78252 H15S PA 1882 133.357 26.487 38.097 1.00 0.00 H ATOM 78253 C114 PA 1882 131.365 25.538 38.378 1.00 0.00 C ATOM 78254 H14R PA 1882 130.599 26.279 38.615 1.00 0.00 H ATOM 78255 H14S PA 1882 131.092 24.644 38.943 1.00 0.00 H ATOM 78256 C113 PA 1882 131.265 25.170 36.868 1.00 0.00 C ATOM 78257 H13R PA 1882 132.008 24.388 36.698 1.00 0.00 H ATOM 78258 H13S PA 1882 131.627 25.934 36.177 1.00 0.00 H ATOM 78259 C112 PA 1882 129.932 24.758 36.297 1.00 0.00 C ATOM 78260 H12R PA 1882 129.182 25.528 36.487 1.00 0.00 H ATOM 78261 H12S PA 1882 129.467 23.966 36.888 1.00 0.00 H ATOM 78262 C111 PA 1882 130.044 24.346 34.825 1.00 0.00 C ATOM 78263 H11R PA 1882 130.888 23.656 34.761 1.00 0.00 H ATOM 78264 H11S PA 1882 130.393 25.292 34.408 1.00 0.00 H ATOM 78265 C110 PA 1882 128.707 23.861 34.182 1.00 0.00 C ATOM 78266 H10R PA 1882 128.803 24.081 33.117 1.00 0.00 H ATOM 78267 H10S PA 1882 127.884 24.482 34.541 1.00 0.00 H ATOM 78268 C19 PA 1882 128.313 22.515 34.467 1.00 0.00 C ATOM 78269 H9R PA 1882 128.367 22.222 35.518 1.00 0.00 H ATOM 78270 H9S PA 1882 128.950 21.828 33.906 1.00 0.00 H ATOM 78271 C18 PA 1882 126.951 22.116 33.931 1.00 0.00 C ATOM 78272 H8R PA 1882 126.850 21.028 33.930 1.00 0.00 H ATOM 78273 H8S PA 1882 127.065 22.311 32.863 1.00 0.00 H ATOM 78274 C17 PA 1882 125.741 22.867 34.633 1.00 0.00 C ATOM 78275 H7R PA 1882 125.707 23.951 34.505 1.00 0.00 H ATOM 78276 H7S PA 1882 125.776 22.800 35.722 1.00 0.00 H ATOM 78277 C16 PA 1882 124.346 22.544 34.030 1.00 0.00 C ATOM 78278 H6R PA 1882 123.608 22.427 34.827 1.00 0.00 H ATOM 78279 H6S PA 1882 124.486 21.602 33.496 1.00 0.00 H ATOM 78280 C15 PA 1882 123.871 23.562 33.008 1.00 0.00 C ATOM 78281 H5R PA 1882 123.655 24.549 33.422 1.00 0.00 H ATOM 78282 H5S PA 1882 122.851 23.231 32.797 1.00 0.00 H ATOM 78283 C14 PA 1882 124.701 23.645 31.673 1.00 0.00 C ATOM 78284 H4R PA 1882 124.676 22.786 30.999 1.00 0.00 H ATOM 78285 H4S PA 1882 125.753 23.752 31.946 1.00 0.00 H ATOM 78286 C13 PA 1882 124.121 24.756 30.757 1.00 0.00 C ATOM 78287 H3R PA 1882 124.186 25.702 31.299 1.00 0.00 H ATOM 78288 H3S PA 1882 123.072 24.468 30.661 1.00 0.00 H ATOM 78289 C12 PA 1882 124.840 24.708 29.429 1.00 0.00 C ATOM 78290 H2R PA 1882 124.953 23.680 29.077 1.00 0.00 H ATOM 78291 H2S PA 1882 125.890 25.000 29.484 1.00 0.00 H ATOM 78292 C11 PGR 1883 124.118 25.510 28.319 1.00 0.00 C ATOM 78293 O12 PGR 1883 124.548 26.610 28.121 1.00 0.00 O ATOM 78294 O11 PGR 1883 123.089 24.992 27.738 1.00 0.00 O ATOM 78295 C1 PGR 1883 122.509 25.611 26.554 1.00 0.00 C ATOM 78296 HR PGR 1883 123.334 25.771 25.855 1.00 0.00 H ATOM 78297 HS PGR 1883 122.147 26.617 26.780 1.00 0.00 H ATOM 78298 C2 PGR 1883 121.478 24.635 26.005 1.00 0.00 C ATOM 78299 HX PGR 1883 121.932 23.640 26.010 1.00 0.00 H ATOM 78300 C3 PGR 1883 121.106 24.983 24.570 1.00 0.00 C ATOM 78301 HA PGR 1883 120.165 24.484 24.324 1.00 0.00 H ATOM 78302 HB PGR 1883 121.840 24.568 23.874 1.00 0.00 H ATOM 78303 O31 PGR 1883 120.972 26.418 24.366 1.00 0.00 O ATOM 78304 P31 PGR 1883 120.052 27.015 23.167 1.00 0.00 P ATOM 78305 O32 PGR 1883 118.608 26.899 23.896 1.00 0.00 O ATOM 78306 C31 PGR 1883 118.336 27.405 25.164 1.00 0.00 C ATOM 78307 H1A PGR 1883 118.112 28.472 25.085 1.00 0.00 H ATOM 78308 H1B PGR 1883 119.195 27.307 25.833 1.00 0.00 H ATOM 78309 C32 PGR 1883 117.187 26.692 25.901 1.00 0.00 C ATOM 78310 H2A PGR 1883 117.575 25.672 25.964 1.00 0.00 H ATOM 78311 O35 PGR 1883 115.976 26.691 25.106 1.00 0.00 O ATOM 78312 HO5A PGR 1883 116.000 25.887 24.557 1.00 0.00 H ATOM 78313 C33 PGR 1883 116.978 27.243 27.367 1.00 0.00 C ATOM 78314 H3A PGR 1883 116.249 26.607 27.876 1.00 0.00 H ATOM 78315 H3B PGR 1883 117.945 27.273 27.875 1.00 0.00 H ATOM 78316 O33 PGR 1883 120.376 28.472 23.079 1.00 0.00 O ATOM 78317 O34 PGR 1883 120.123 26.124 21.946 1.00 0.00 O ATOM 78318 O21 PGR 1883 120.195 24.533 26.724 1.00 0.00 O ATOM 78319 C21 PGR 1883 119.545 23.325 26.855 1.00 0.00 C ATOM 78320 O22 PGR 1883 120.040 22.266 26.522 1.00 0.00 O ATOM 78321 O36 PGR 1883 116.515 28.597 27.129 1.00 0.00 O ATOM 78322 HO6A PGR 1883 115.701 28.620 26.595 1.00 0.00 H ATOM 78323 C12 OL 1884 118.151 23.471 27.453 1.00 0.00 C ATOM 78324 H2R OL 1884 118.219 24.433 27.967 1.00 0.00 H ATOM 78325 H2S OL 1884 117.380 23.521 26.681 1.00 0.00 H ATOM 78326 C13 OL 1884 117.842 22.392 28.499 1.00 0.00 C ATOM 78327 H3R OL 1884 116.797 22.556 28.772 1.00 0.00 H ATOM 78328 H3S OL 1884 117.809 21.389 28.068 1.00 0.00 H ATOM 78329 C14 OL 1884 118.870 22.431 29.720 1.00 0.00 C ATOM 78330 H4R OL 1884 119.731 21.993 29.211 1.00 0.00 H ATOM 78331 H4S OL 1884 119.195 23.447 29.953 1.00 0.00 H ATOM 78332 C15 OL 1884 118.321 21.629 30.898 1.00 0.00 C ATOM 78333 H5R OL 1884 117.728 22.325 31.495 1.00 0.00 H ATOM 78334 H5S OL 1884 117.626 20.932 30.425 1.00 0.00 H ATOM 78335 C16 OL 1884 119.420 21.030 31.742 1.00 0.00 C ATOM 78336 H6R OL 1884 118.853 20.219 32.206 1.00 0.00 H ATOM 78337 H6S OL 1884 120.231 20.673 31.105 1.00 0.00 H ATOM 78338 C17 OL 1884 120.002 21.922 32.811 1.00 0.00 C ATOM 78339 H7R OL 1884 120.495 22.815 32.423 1.00 0.00 H ATOM 78340 H7S OL 1884 119.223 22.392 33.414 1.00 0.00 H ATOM 78341 C18 OL 1884 121.081 21.204 33.698 1.00 0.00 C ATOM 78342 H8R OL 1884 121.892 20.720 33.150 1.00 0.00 H ATOM 78343 H8S OL 1884 121.559 21.993 34.282 1.00 0.00 H ATOM 78344 C19 OL 1884 120.432 20.171 34.595 1.00 0.00 C ATOM 78345 H9R OL 1884 120.034 19.324 34.041 1.00 0.00 H ATOM 78346 C110 OL 1884 120.197 20.063 35.896 1.00 0.00 C ATOM 78347 H10R OL 1884 119.653 19.231 36.336 1.00 0.00 H ATOM 78348 C111 OL 1884 120.902 20.999 36.888 1.00 0.00 C ATOM 78349 H11R OL 1884 121.398 21.859 36.433 1.00 0.00 H ATOM 78350 H11S OL 1884 120.140 21.374 37.574 1.00 0.00 H ATOM 78351 C112 OL 1884 122.011 20.369 37.730 1.00 0.00 C ATOM 78352 H12R OL 1884 121.601 19.364 37.849 1.00 0.00 H ATOM 78353 H12S OL 1884 122.871 20.292 37.062 1.00 0.00 H ATOM 78354 C113 OL 1884 122.383 21.054 39.052 1.00 0.00 C ATOM 78355 H13R OL 1884 122.543 22.078 38.708 1.00 0.00 H ATOM 78356 H13S OL 1884 121.620 21.063 39.834 1.00 0.00 H ATOM 78357 C114 OL 1884 123.666 20.473 39.746 1.00 0.00 C ATOM 78358 H14R OL 1884 123.618 19.446 40.115 1.00 0.00 H ATOM 78359 H14S OL 1884 124.474 20.549 39.016 1.00 0.00 H ATOM 78360 C115 OL 1884 123.988 21.286 41.058 1.00 0.00 C ATOM 78361 H15R OL 1884 124.904 20.947 41.547 1.00 0.00 H ATOM 78362 H15S OL 1884 124.188 22.330 40.808 1.00 0.00 H ATOM 78363 C116 OL 1884 122.928 21.261 42.118 1.00 0.00 C ATOM 78364 H16R OL 1884 122.011 21.758 41.792 1.00 0.00 H ATOM 78365 H16S OL 1884 122.634 20.237 42.355 1.00 0.00 H ATOM 78366 C117 OL 1884 123.404 22.011 43.311 1.00 0.00 C ATOM 78367 H17R OL 1884 124.407 21.614 43.481 1.00 0.00 H ATOM 78368 H17S OL 1884 123.618 23.063 43.111 1.00 0.00 H ATOM 78369 C118 OL 1884 122.481 22.013 44.491 1.00 0.00 C ATOM 78370 H18R OL 1884 121.673 22.730 44.332 1.00 0.00 H ATOM 78371 H18S OL 1884 123.009 22.274 45.411 1.00 0.00 H ATOM 78372 H18T OL 1884 122.083 21.004 44.614 1.00 0.00 H TER 78373 OL 1884 ATOM 78373 C116 PA 1885 126.858 142.941 37.205 1.00 0.00 C ATOM 78374 H16R PA 1885 126.234 143.671 37.725 1.00 0.00 H ATOM 78375 H16S PA 1885 126.834 142.970 36.114 1.00 0.00 H ATOM 78376 H16T PA 1885 127.868 143.176 37.549 1.00 0.00 H ATOM 78377 C115 PA 1885 126.562 141.468 37.573 1.00 0.00 C ATOM 78378 H15R PA 1885 126.763 141.237 38.622 1.00 0.00 H ATOM 78379 H15S PA 1885 127.380 140.906 37.117 1.00 0.00 H ATOM 78380 C114 PA 1885 125.257 140.945 36.989 1.00 0.00 C ATOM 78381 H14R PA 1885 125.339 141.015 35.903 1.00 0.00 H ATOM 78382 H14S PA 1885 124.470 141.568 37.419 1.00 0.00 H ATOM 78383 C113 PA 1885 124.847 139.476 37.343 1.00 0.00 C ATOM 78384 H13R PA 1885 124.414 139.383 38.341 1.00 0.00 H ATOM 78385 H13S PA 1885 125.672 138.767 37.257 1.00 0.00 H ATOM 78386 C112 PA 1885 123.849 139.026 36.232 1.00 0.00 C ATOM 78387 H12R PA 1885 123.123 139.840 36.165 1.00 0.00 H ATOM 78388 H12S PA 1885 123.316 138.096 36.440 1.00 0.00 H ATOM 78389 C111 PA 1885 124.423 138.806 34.852 1.00 0.00 C ATOM 78390 H11R PA 1885 124.853 137.803 34.810 1.00 0.00 H ATOM 78391 H11S PA 1885 125.303 139.390 34.577 1.00 0.00 H ATOM 78392 C110 PA 1885 123.288 138.891 33.715 1.00 0.00 C ATOM 78393 H10R PA 1885 122.407 138.358 34.078 1.00 0.00 H ATOM 78394 H10S PA 1885 123.486 138.407 32.757 1.00 0.00 H ATOM 78395 C19 PA 1885 122.688 140.285 33.461 1.00 0.00 C ATOM 78396 H9R PA 1885 122.328 140.653 34.424 1.00 0.00 H ATOM 78397 H9S PA 1885 121.956 140.385 32.657 1.00 0.00 H ATOM 78398 C18 PA 1885 123.726 141.340 33.028 1.00 0.00 C ATOM 78399 H8R PA 1885 124.420 141.360 33.871 1.00 0.00 H ATOM 78400 H8S PA 1885 123.433 142.379 32.863 1.00 0.00 H ATOM 78401 C17 PA 1885 124.622 141.085 31.821 1.00 0.00 C ATOM 78402 H7R PA 1885 124.014 140.958 30.923 1.00 0.00 H ATOM 78403 H7S PA 1885 125.286 140.221 31.898 1.00 0.00 H ATOM 78404 C16 PA 1885 125.334 142.385 31.416 1.00 0.00 C ATOM 78405 H6R PA 1885 125.900 143.005 32.114 1.00 0.00 H ATOM 78406 H6S PA 1885 124.673 143.106 30.930 1.00 0.00 H ATOM 78407 C15 PA 1885 126.299 142.147 30.200 1.00 0.00 C ATOM 78408 H5R PA 1885 126.258 143.033 29.562 1.00 0.00 H ATOM 78409 H5S PA 1885 125.757 141.485 29.521 1.00 0.00 H ATOM 78410 C14 PA 1885 127.709 141.574 30.546 1.00 0.00 C ATOM 78411 H4R PA 1885 127.680 140.494 30.702 1.00 0.00 H ATOM 78412 H4S PA 1885 128.012 141.956 31.523 1.00 0.00 H ATOM 78413 C13 PA 1885 128.731 141.824 29.520 1.00 0.00 C ATOM 78414 H3R PA 1885 129.514 141.077 29.660 1.00 0.00 H ATOM 78415 H3S PA 1885 129.162 142.820 29.640 1.00 0.00 H ATOM 78416 C12 PA 1885 128.309 141.904 28.063 1.00 0.00 C ATOM 78417 H2R PA 1885 129.013 142.337 27.349 1.00 0.00 H ATOM 78418 H2S PA 1885 127.378 142.447 27.887 1.00 0.00 H ATOM 78419 C11 PGR 1886 128.015 140.572 27.493 1.00 0.00 C ATOM 78420 O12 PGR 1886 126.854 140.272 27.187 1.00 0.00 O ATOM 78421 O11 PGR 1886 129.117 139.885 27.113 1.00 0.00 O ATOM 78422 C1 PGR 1886 128.792 138.673 26.390 1.00 0.00 C ATOM 78423 HR PGR 1886 128.196 138.880 25.497 1.00 0.00 H ATOM 78424 HS PGR 1886 128.126 138.099 27.040 1.00 0.00 H ATOM 78425 C2 PGR 1886 130.199 138.169 25.881 1.00 0.00 C ATOM 78426 HX PGR 1886 130.580 139.014 25.302 1.00 0.00 H ATOM 78427 C3 PGR 1886 130.211 137.048 24.843 1.00 0.00 C ATOM 78428 HA PGR 1886 129.641 137.391 23.975 1.00 0.00 H ATOM 78429 HB PGR 1886 129.666 136.214 25.294 1.00 0.00 H ATOM 78430 O31 PGR 1886 131.535 136.624 24.393 1.00 0.00 O ATOM 78431 P31 PGR 1886 131.661 135.564 23.201 1.00 0.00 P ATOM 78432 O32 PGR 1886 130.716 136.151 22.107 1.00 0.00 O ATOM 78433 C31 PGR 1886 130.856 137.445 21.632 1.00 0.00 C ATOM 78434 H1A PGR 1886 131.915 137.578 21.396 1.00 0.00 H ATOM 78435 H1B PGR 1886 130.649 138.035 22.529 1.00 0.00 H ATOM 78436 C32 PGR 1886 129.926 137.851 20.528 1.00 0.00 C ATOM 78437 H2A PGR 1886 128.876 137.740 20.811 1.00 0.00 H ATOM 78438 O35 PGR 1886 130.241 137.107 19.289 1.00 0.00 O ATOM 78439 HO5A PGR 1886 129.550 137.364 18.652 1.00 0.00 H ATOM 78440 C33 PGR 1886 130.062 139.295 20.115 1.00 0.00 C ATOM 78441 H3A PGR 1886 129.759 140.028 20.866 1.00 0.00 H ATOM 78442 H3B PGR 1886 131.107 139.522 19.887 1.00 0.00 H ATOM 78443 O33 PGR 1886 133.059 135.430 22.677 1.00 0.00 O ATOM 78444 O34 PGR 1886 130.981 134.341 23.684 1.00 0.00 O ATOM 78445 O21 PGR 1886 131.120 137.703 26.955 1.00 0.00 O ATOM 78446 C21 PGR 1886 130.914 136.612 27.683 1.00 0.00 C ATOM 78447 O22 PGR 1886 129.914 135.949 27.810 1.00 0.00 O ATOM 78448 O36 PGR 1886 129.289 139.596 18.923 1.00 0.00 O ATOM 78449 HO6A PGR 1886 129.597 139.133 18.123 1.00 0.00 H ATOM 78450 C12 OL 1887 132.251 136.179 28.364 1.00 0.00 C ATOM 78451 H2R OL 1887 131.977 135.369 29.043 1.00 0.00 H ATOM 78452 H2S OL 1887 133.010 135.843 27.655 1.00 0.00 H ATOM 78453 C13 OL 1887 132.749 137.380 29.149 1.00 0.00 C ATOM 78454 H3R OL 1887 133.549 137.130 29.849 1.00 0.00 H ATOM 78455 H3S OL 1887 133.201 138.075 28.439 1.00 0.00 H ATOM 78456 C14 OL 1887 131.692 137.927 30.073 1.00 0.00 C ATOM 78457 H4R OL 1887 130.869 138.350 29.493 1.00 0.00 H ATOM 78458 H4S OL 1887 131.251 137.096 30.626 1.00 0.00 H ATOM 78459 C15 OL 1887 132.273 138.998 31.003 1.00 0.00 C ATOM 78460 H5R OL 1887 132.912 139.755 30.543 1.00 0.00 H ATOM 78461 H5S OL 1887 131.447 139.604 31.383 1.00 0.00 H ATOM 78462 C16 OL 1887 132.980 138.457 32.265 1.00 0.00 C ATOM 78463 H6R OL 1887 132.343 137.736 32.781 1.00 0.00 H ATOM 78464 H6S OL 1887 133.832 137.820 32.018 1.00 0.00 H ATOM 78465 C17 OL 1887 133.441 139.466 33.297 1.00 0.00 C ATOM 78466 H7R OL 1887 134.370 139.913 32.938 1.00 0.00 H ATOM 78467 H7S OL 1887 132.708 140.262 33.148 1.00 0.00 H ATOM 78468 C18 OL 1887 133.442 138.927 34.751 1.00 0.00 C ATOM 78469 H8R OL 1887 132.479 138.512 35.056 1.00 0.00 H ATOM 78470 H8S OL 1887 134.232 138.173 34.755 1.00 0.00 H ATOM 78471 C19 OL 1887 133.749 140.028 35.690 1.00 0.00 C ATOM 78472 H9R OL 1887 133.000 140.814 35.741 1.00 0.00 H ATOM 78473 C110 OL 1887 134.776 140.292 36.530 1.00 0.00 C ATOM 78474 H10R OL 1887 134.760 141.189 37.144 1.00 0.00 H ATOM 78475 C111 OL 1887 135.937 139.327 36.749 1.00 0.00 C ATOM 78476 H11R OL 1887 136.228 139.382 37.800 1.00 0.00 H ATOM 78477 H11S OL 1887 135.637 138.294 36.561 1.00 0.00 H ATOM 78478 C112 OL 1887 137.033 139.817 35.789 1.00 0.00 C ATOM 78479 H12R OL 1887 137.806 139.064 35.619 1.00 0.00 H ATOM 78480 H12S OL 1887 136.624 139.863 34.778 1.00 0.00 H ATOM 78481 C113 OL 1887 137.609 141.307 36.148 1.00 0.00 C ATOM 78482 H13R OL 1887 138.286 141.590 35.340 1.00 0.00 H ATOM 78483 H13S OL 1887 136.776 142.001 36.014 1.00 0.00 H ATOM 78484 C114 OL 1887 138.330 141.591 37.504 1.00 0.00 C ATOM 78485 H14R OL 1887 137.583 141.388 38.274 1.00 0.00 H ATOM 78486 H14S OL 1887 139.044 140.781 37.664 1.00 0.00 H ATOM 78487 C115 OL 1887 139.018 142.954 37.541 1.00 0.00 C ATOM 78488 H15R OL 1887 138.226 143.670 37.316 1.00 0.00 H ATOM 78489 H15S OL 1887 139.345 143.061 38.577 1.00 0.00 H ATOM 78490 C116 OL 1887 140.090 143.159 36.528 1.00 0.00 C ATOM 78491 H16R OL 1887 140.700 142.261 36.417 1.00 0.00 H ATOM 78492 H16S OL 1887 139.741 143.344 35.510 1.00 0.00 H ATOM 78493 C117 OL 1887 140.987 144.375 36.753 1.00 0.00 C ATOM 78494 H17R OL 1887 141.843 144.246 36.087 1.00 0.00 H ATOM 78495 H17S OL 1887 140.423 145.286 36.542 1.00 0.00 H ATOM 78496 C118 OL 1887 141.538 144.533 38.135 1.00 0.00 C ATOM 78497 H18R OL 1887 142.394 145.205 38.225 1.00 0.00 H ATOM 78498 H18S OL 1887 141.770 143.517 38.461 1.00 0.00 H ATOM 78499 H18T OL 1887 140.882 144.940 38.907 1.00 0.00 H TER 78500 OL 1887 ATOM 78500 C116 PA 1888 95.032 121.588 43.296 1.00 0.00 C ATOM 78501 H16R PA 1888 96.019 122.056 43.323 1.00 0.00 H ATOM 78502 H16S PA 1888 95.185 120.768 44.000 1.00 0.00 H ATOM 78503 H16T PA 1888 94.356 122.341 43.706 1.00 0.00 H ATOM 78504 C115 PA 1888 94.605 121.019 41.940 1.00 0.00 C ATOM 78505 H15R PA 1888 93.555 120.727 42.002 1.00 0.00 H ATOM 78506 H15S PA 1888 95.224 120.142 41.741 1.00 0.00 H ATOM 78507 C114 PA 1888 94.715 122.093 40.890 1.00 0.00 C ATOM 78508 H14R PA 1888 95.763 122.365 40.755 1.00 0.00 H ATOM 78509 H14S PA 1888 94.157 122.957 41.258 1.00 0.00 H ATOM 78510 C113 PA 1888 94.198 121.839 39.471 1.00 0.00 C ATOM 78511 H13R PA 1888 93.145 121.586 39.612 1.00 0.00 H ATOM 78512 H13S PA 1888 94.756 120.967 39.125 1.00 0.00 H ATOM 78513 C112 PA 1888 94.330 123.038 38.557 1.00 0.00 C ATOM 78514 H12R PA 1888 95.336 123.459 38.614 1.00 0.00 H ATOM 78515 H12S PA 1888 93.693 123.829 38.959 1.00 0.00 H ATOM 78516 C111 PA 1888 93.862 122.929 37.098 1.00 0.00 C ATOM 78517 H11R PA 1888 92.938 122.375 36.921 1.00 0.00 H ATOM 78518 H11S PA 1888 94.487 122.221 36.549 1.00 0.00 H ATOM 78519 C110 PA 1888 93.837 124.168 36.251 1.00 0.00 C ATOM 78520 H10R PA 1888 94.789 124.664 36.452 1.00 0.00 H ATOM 78521 H10S PA 1888 92.994 124.823 36.478 1.00 0.00 H ATOM 78522 C19 PA 1888 93.712 123.951 34.713 1.00 0.00 C ATOM 78523 H9R PA 1888 92.785 123.399 34.541 1.00 0.00 H ATOM 78524 H9S PA 1888 94.433 123.229 34.324 1.00 0.00 H ATOM 78525 C18 PA 1888 93.911 125.276 33.925 1.00 0.00 C ATOM 78526 H8R PA 1888 94.930 125.603 34.138 1.00 0.00 H ATOM 78527 H8S PA 1888 93.209 126.003 34.341 1.00 0.00 H ATOM 78528 C17 PA 1888 93.608 125.254 32.404 1.00 0.00 C ATOM 78529 H7R PA 1888 92.552 125.010 32.269 1.00 0.00 H ATOM 78530 H7S PA 1888 94.176 124.377 32.086 1.00 0.00 H ATOM 78531 C16 PA 1888 94.018 126.481 31.703 1.00 0.00 C ATOM 78532 H6R PA 1888 95.008 126.840 31.991 1.00 0.00 H ATOM 78533 H6S PA 1888 93.350 127.284 32.021 1.00 0.00 H ATOM 78534 C15 PA 1888 93.855 126.362 30.215 1.00 0.00 C ATOM 78535 H5R PA 1888 92.791 126.148 30.095 1.00 0.00 H ATOM 78536 H5S PA 1888 94.435 125.578 29.723 1.00 0.00 H ATOM 78537 C14 PA 1888 94.297 127.668 29.523 1.00 0.00 C ATOM 78538 H4R PA 1888 95.335 127.871 29.796 1.00 0.00 H ATOM 78539 H4S PA 1888 93.872 128.554 29.998 1.00 0.00 H ATOM 78540 C13 PA 1888 94.049 127.740 28.039 1.00 0.00 C ATOM 78541 H3R PA 1888 93.135 127.206 27.768 1.00 0.00 H ATOM 78542 H3S PA 1888 94.773 127.263 27.376 1.00 0.00 H ATOM 78543 C12 PA 1888 93.978 129.168 27.469 1.00 0.00 C ATOM 78544 H2R PA 1888 93.331 129.783 28.097 1.00 0.00 H ATOM 78545 H2S PA 1888 94.911 129.733 27.509 1.00 0.00 H ATOM 78546 C11 PGR 1889 93.694 129.132 25.971 1.00 0.00 C ATOM 78547 O12 PGR 1889 94.489 128.789 25.130 1.00 0.00 O ATOM 78548 O11 PGR 1889 92.545 129.705 25.678 1.00 0.00 O ATOM 78549 C1 PGR 1889 92.159 129.899 24.314 1.00 0.00 C ATOM 78550 HR PGR 1889 91.867 129.015 23.741 1.00 0.00 H ATOM 78551 HS PGR 1889 92.966 130.403 23.775 1.00 0.00 H ATOM 78552 C2 PGR 1889 90.946 130.917 24.394 1.00 0.00 C ATOM 78553 HX PGR 1889 90.280 130.489 25.147 1.00 0.00 H ATOM 78554 C3 PGR 1889 90.193 130.960 22.992 1.00 0.00 C ATOM 78555 HA PGR 1889 89.449 131.755 23.090 1.00 0.00 H ATOM 78556 HB PGR 1889 89.583 130.069 22.817 1.00 0.00 H ATOM 78557 O31 PGR 1889 91.139 131.134 21.932 1.00 0.00 O ATOM 78558 P31 PGR 1889 90.787 131.217 20.434 1.00 0.00 P ATOM 78559 O32 PGR 1889 89.949 129.896 20.098 1.00 0.00 O ATOM 78560 C31 PGR 1889 90.503 128.613 20.101 1.00 0.00 C ATOM 78561 H1A PGR 1889 90.249 128.161 21.063 1.00 0.00 H ATOM 78562 H1B PGR 1889 91.595 128.647 20.115 1.00 0.00 H ATOM 78563 C32 PGR 1889 90.007 127.882 18.900 1.00 0.00 C ATOM 78564 H2A PGR 1889 90.409 128.313 17.980 1.00 0.00 H ATOM 78565 O35 PGR 1889 88.609 127.805 18.767 1.00 0.00 O ATOM 78566 HO5A PGR 1889 88.260 128.707 18.883 1.00 0.00 H ATOM 78567 C33 PGR 1889 90.535 126.451 18.747 1.00 0.00 C ATOM 78568 H3A PGR 1889 90.050 125.817 18.001 1.00 0.00 H ATOM 78569 H3B PGR 1889 91.615 126.351 18.611 1.00 0.00 H ATOM 78570 O33 PGR 1889 89.848 132.348 20.215 1.00 0.00 O ATOM 78571 O34 PGR 1889 92.054 131.165 19.686 1.00 0.00 O ATOM 78572 O21 PGR 1889 91.430 132.185 24.706 1.00 0.00 O ATOM 78573 C21 PGR 1889 90.514 133.091 25.110 1.00 0.00 C ATOM 78574 O22 PGR 1889 89.370 132.826 25.313 1.00 0.00 O ATOM 78575 O36 PGR 1889 90.370 125.921 20.037 1.00 0.00 O ATOM 78576 HO6A PGR 1889 90.727 125.019 19.945 1.00 0.00 H ATOM 78577 C12 OL 1890 91.114 134.500 25.236 1.00 0.00 C ATOM 78578 H2R OL 1890 91.567 134.775 24.281 1.00 0.00 H ATOM 78579 H2S OL 1890 90.373 135.285 25.398 1.00 0.00 H ATOM 78580 C13 OL 1890 92.277 134.510 26.187 1.00 0.00 C ATOM 78581 H3R OL 1890 92.980 133.864 25.655 1.00 0.00 H ATOM 78582 H3S OL 1890 92.739 135.496 26.267 1.00 0.00 H ATOM 78583 C14 OL 1890 91.937 133.930 27.564 1.00 0.00 C ATOM 78584 H4R OL 1890 91.006 133.363 27.635 1.00 0.00 H ATOM 78585 H4S OL 1890 92.630 133.100 27.717 1.00 0.00 H ATOM 78586 C15 OL 1890 92.118 134.917 28.643 1.00 0.00 C ATOM 78587 H5R OL 1890 93.135 135.309 28.698 1.00 0.00 H ATOM 78588 H5S OL 1890 91.393 135.727 28.532 1.00 0.00 H ATOM 78589 C16 OL 1890 91.676 134.251 29.987 1.00 0.00 C ATOM 78590 H6R OL 1890 91.734 134.965 30.811 1.00 0.00 H ATOM 78591 H6S OL 1890 90.622 133.979 29.898 1.00 0.00 H ATOM 78592 C17 OL 1890 92.528 133.039 30.458 1.00 0.00 C ATOM 78593 H7R OL 1890 92.598 132.132 29.855 1.00 0.00 H ATOM 78594 H7S OL 1890 93.537 133.457 30.468 1.00 0.00 H ATOM 78595 C18 OL 1890 92.369 132.566 31.934 1.00 0.00 C ATOM 78596 H8R OL 1890 92.455 133.453 32.566 1.00 0.00 H ATOM 78597 H8S OL 1890 91.311 132.310 32.023 1.00 0.00 H ATOM 78598 C19 OL 1890 93.372 131.617 32.311 1.00 0.00 C ATOM 78599 H9R OL 1890 94.342 131.850 31.880 1.00 0.00 H ATOM 78600 C110 OL 1890 93.173 130.628 33.110 1.00 0.00 C ATOM 78601 H10R OL 1890 93.982 129.905 33.183 1.00 0.00 H ATOM 78602 C111 OL 1890 91.898 130.285 33.783 1.00 0.00 C ATOM 78603 H11R OL 1890 92.059 130.450 34.850 1.00 0.00 H ATOM 78604 H11S OL 1890 91.016 130.760 33.349 1.00 0.00 H ATOM 78605 C112 OL 1890 91.573 128.800 33.692 1.00 0.00 C ATOM 78606 H12R OL 1890 91.352 128.636 32.635 1.00 0.00 H ATOM 78607 H12S OL 1890 92.480 128.231 33.906 1.00 0.00 H ATOM 78608 C113 OL 1890 90.422 128.256 34.623 1.00 0.00 C ATOM 78609 H13R OL 1890 90.925 128.239 35.593 1.00 0.00 H ATOM 78610 H13S OL 1890 89.608 128.983 34.667 1.00 0.00 H ATOM 78611 C114 OL 1890 90.025 126.884 34.142 1.00 0.00 C ATOM 78612 H14R OL 1890 89.330 127.115 33.331 1.00 0.00 H ATOM 78613 H14S OL 1890 90.821 126.219 33.802 1.00 0.00 H ATOM 78614 C115 OL 1890 89.210 126.118 35.231 1.00 0.00 C ATOM 78615 H15R OL 1890 88.381 126.762 35.531 1.00 0.00 H ATOM 78616 H15S OL 1890 88.775 125.221 34.784 1.00 0.00 H ATOM 78617 C116 OL 1890 89.992 125.750 36.546 1.00 0.00 C ATOM 78618 H16R OL 1890 90.978 125.412 36.224 1.00 0.00 H ATOM 78619 H16S OL 1890 90.237 126.714 36.998 1.00 0.00 H ATOM 78620 C117 OL 1890 89.423 124.709 37.548 1.00 0.00 C ATOM 78621 H17R OL 1890 90.276 124.450 38.178 1.00 0.00 H ATOM 78622 H17S OL 1890 88.683 125.218 38.169 1.00 0.00 H ATOM 78623 C118 OL 1890 88.837 123.490 36.920 1.00 0.00 C ATOM 78624 H18R OL 1890 87.807 123.739 36.655 1.00 0.00 H ATOM 78625 H18S OL 1890 88.959 122.571 37.497 1.00 0.00 H ATOM 78626 H18T OL 1890 89.359 123.317 35.977 1.00 0.00 H TER 78627 OL 1890 ATOM 78627 C116 PA 1891 5.061 41.054 41.037 1.00 0.00 C ATOM 78628 H16R PA 1891 4.184 41.085 40.387 1.00 0.00 H ATOM 78629 H16S PA 1891 4.913 41.801 41.819 1.00 0.00 H ATOM 78630 H16T PA 1891 4.998 40.118 41.596 1.00 0.00 H ATOM 78631 C115 PA 1891 6.417 41.081 40.272 1.00 0.00 C ATOM 78632 H15R PA 1891 7.187 40.979 41.040 1.00 0.00 H ATOM 78633 H15S PA 1891 6.500 42.082 39.846 1.00 0.00 H ATOM 78634 C114 PA 1891 6.634 40.070 39.075 1.00 0.00 C ATOM 78635 H14R PA 1891 5.930 40.349 38.288 1.00 0.00 H ATOM 78636 H14S PA 1891 6.309 39.097 39.449 1.00 0.00 H ATOM 78637 C113 PA 1891 8.064 40.047 38.545 1.00 0.00 C ATOM 78638 H13R PA 1891 8.855 39.729 39.226 1.00 0.00 H ATOM 78639 H13S PA 1891 8.416 40.986 38.112 1.00 0.00 H ATOM 78640 C112 PA 1891 8.199 39.229 37.143 1.00 0.00 C ATOM 78641 H12R PA 1891 7.814 38.223 37.320 1.00 0.00 H ATOM 78642 H12S PA 1891 9.267 39.169 36.922 1.00 0.00 H ATOM 78643 C111 PA 1891 7.303 39.767 36.038 1.00 0.00 C ATOM 78644 H11R PA 1891 7.327 40.859 36.040 1.00 0.00 H ATOM 78645 H11S PA 1891 6.276 39.526 36.318 1.00 0.00 H ATOM 78646 C110 PA 1891 7.621 39.216 34.610 1.00 0.00 C ATOM 78647 H10R PA 1891 7.233 38.208 34.451 1.00 0.00 H ATOM 78648 H10S PA 1891 8.686 39.152 34.377 1.00 0.00 H ATOM 78649 C19 PA 1891 6.910 40.026 33.423 1.00 0.00 C ATOM 78650 H9R PA 1891 7.347 41.027 33.420 1.00 0.00 H ATOM 78651 H9S PA 1891 5.853 40.082 33.691 1.00 0.00 H ATOM 78652 C18 PA 1891 7.040 39.235 32.103 1.00 0.00 C ATOM 78653 H8R PA 1891 6.331 38.412 32.217 1.00 0.00 H ATOM 78654 H8S PA 1891 7.971 38.666 32.109 1.00 0.00 H ATOM 78655 C17 PA 1891 6.734 40.002 30.818 1.00 0.00 C ATOM 78656 H7R PA 1891 7.534 40.674 30.498 1.00 0.00 H ATOM 78657 H7S PA 1891 5.916 40.716 30.938 1.00 0.00 H ATOM 78658 C16 PA 1891 6.412 38.964 29.750 1.00 0.00 C ATOM 78659 H6R PA 1891 5.589 38.320 30.068 1.00 0.00 H ATOM 78660 H6S PA 1891 7.358 38.449 29.569 1.00 0.00 H ATOM 78661 C15 PA 1891 6.087 39.440 28.289 1.00 0.00 C ATOM 78662 H5R PA 1891 6.717 40.291 28.021 1.00 0.00 H ATOM 78663 H5S PA 1891 5.035 39.722 28.207 1.00 0.00 H ATOM 78664 C14 PA 1891 6.394 38.217 27.444 1.00 0.00 C ATOM 78665 H4R PA 1891 5.877 37.372 27.902 1.00 0.00 H ATOM 78666 H4S PA 1891 7.459 37.977 27.478 1.00 0.00 H ATOM 78667 C13 PA 1891 6.190 38.411 25.952 1.00 0.00 C ATOM 78668 H3R PA 1891 5.121 38.294 25.763 1.00 0.00 H ATOM 78669 H3S PA 1891 6.509 37.464 25.512 1.00 0.00 H ATOM 78670 C12 PA 1891 6.736 39.732 25.328 1.00 0.00 C ATOM 78671 H2R PA 1891 7.616 40.111 25.852 1.00 0.00 H ATOM 78672 H2S PA 1891 5.934 40.443 25.535 1.00 0.00 H ATOM 78673 C11 PGR 1892 6.916 39.608 23.852 1.00 0.00 C ATOM 78674 O12 PGR 1892 8.010 39.731 23.338 1.00 0.00 O ATOM 78675 O11 PGR 1892 5.827 39.438 23.127 1.00 0.00 O ATOM 78676 C1 PGR 1892 5.960 39.227 21.689 1.00 0.00 C ATOM 78677 HR PGR 1892 6.242 38.174 21.606 1.00 0.00 H ATOM 78678 HS PGR 1892 6.701 39.926 21.294 1.00 0.00 H ATOM 78679 C2 PGR 1892 4.569 39.376 20.945 1.00 0.00 C ATOM 78680 HX PGR 1892 3.887 38.636 21.373 1.00 0.00 H ATOM 78681 C3 PGR 1892 4.734 39.314 19.427 1.00 0.00 C ATOM 78682 HA PGR 1892 3.747 39.254 18.963 1.00 0.00 H ATOM 78683 HB PGR 1892 5.101 38.327 19.134 1.00 0.00 H ATOM 78684 O31 PGR 1892 5.501 40.347 18.866 1.00 0.00 O ATOM 78685 P31 PGR 1892 5.500 40.743 17.360 1.00 0.00 P ATOM 78686 O32 PGR 1892 3.926 41.003 16.944 1.00 0.00 O ATOM 78687 C31 PGR 1892 3.232 42.205 17.434 1.00 0.00 C ATOM 78688 H1A PGR 1892 3.744 43.146 17.216 1.00 0.00 H ATOM 78689 H1B PGR 1892 3.138 42.228 18.522 1.00 0.00 H ATOM 78690 C32 PGR 1892 1.782 42.129 16.920 1.00 0.00 C ATOM 78691 H2A PGR 1892 1.314 41.174 17.173 1.00 0.00 H ATOM 78692 O35 PGR 1892 1.776 42.245 15.479 1.00 0.00 O ATOM 78693 HO5A PGR 1892 2.462 41.578 15.297 1.00 0.00 H ATOM 78694 C33 PGR 1892 0.965 43.372 17.615 1.00 0.00 C ATOM 78695 H3A PGR 1892 -0.078 43.515 17.322 1.00 0.00 H ATOM 78696 H3B PGR 1892 0.941 43.286 18.704 1.00 0.00 H ATOM 78697 O33 PGR 1892 6.243 42.002 17.134 1.00 0.00 O ATOM 78698 O34 PGR 1892 5.902 39.514 16.620 1.00 0.00 O ATOM 78699 O21 PGR 1892 4.012 40.723 21.272 1.00 0.00 O ATOM 78700 C21 PGR 1892 2.691 40.787 21.256 1.00 0.00 C ATOM 78701 O22 PGR 1892 1.952 39.895 20.984 1.00 0.00 O ATOM 78702 O36 PGR 1892 1.676 44.600 17.418 1.00 0.00 O ATOM 78703 HO6A PGR 1892 1.251 45.358 17.859 1.00 0.00 H ATOM 78704 C12 OL 1893 2.252 42.092 21.688 1.00 0.00 C ATOM 78705 H2R OL 1893 2.750 42.825 21.051 1.00 0.00 H ATOM 78706 H2S OL 1893 1.175 42.178 21.528 1.00 0.00 H ATOM 78707 C13 OL 1893 2.521 42.260 23.168 1.00 0.00 C ATOM 78708 H3R OL 1893 2.115 41.467 23.800 1.00 0.00 H ATOM 78709 H3S OL 1893 3.603 42.354 23.279 1.00 0.00 H ATOM 78710 C14 OL 1893 1.858 43.553 23.574 1.00 0.00 C ATOM 78711 H4R OL 1893 2.213 44.351 22.918 1.00 0.00 H ATOM 78712 H4S OL 1893 0.825 43.277 23.353 1.00 0.00 H ATOM 78713 C15 OL 1893 1.988 43.899 25.067 1.00 0.00 C ATOM 78714 H5R OL 1893 2.993 43.791 25.479 1.00 0.00 H ATOM 78715 H5S OL 1893 1.862 44.977 25.190 1.00 0.00 H ATOM 78716 C16 OL 1893 1.109 42.965 25.906 1.00 0.00 C ATOM 78717 H6R OL 1893 0.093 43.044 25.514 1.00 0.00 H ATOM 78718 H6S OL 1893 1.407 41.915 25.867 1.00 0.00 H ATOM 78719 C17 OL 1893 0.994 43.421 27.397 1.00 0.00 C ATOM 78720 H7R OL 1893 2.031 43.446 27.738 1.00 0.00 H ATOM 78721 H7S OL 1893 0.684 44.452 27.581 1.00 0.00 H ATOM 78722 C18 OL 1893 0.188 42.475 28.372 1.00 0.00 C ATOM 78723 H8R OL 1893 -0.792 42.231 27.955 1.00 0.00 H ATOM 78724 H8S OL 1893 0.622 41.475 28.313 1.00 0.00 H ATOM 78725 C19 OL 1893 0.163 42.803 29.773 1.00 0.00 C ATOM 78726 H9R OL 1893 -0.416 43.695 30.001 1.00 0.00 H ATOM 78727 C110 OL 1893 0.624 42.092 30.806 1.00 0.00 C ATOM 78728 H10R OL 1893 0.418 42.418 31.822 1.00 0.00 H ATOM 78729 C111 OL 1893 1.494 40.863 30.812 1.00 0.00 C ATOM 78730 H11R OL 1893 0.887 40.090 30.336 1.00 0.00 H ATOM 78731 H11S OL 1893 2.430 41.033 30.276 1.00 0.00 H ATOM 78732 C112 OL 1893 1.636 40.331 32.359 1.00 0.00 C ATOM 78733 H12R OL 1893 2.493 40.863 32.777 1.00 0.00 H ATOM 78734 H12S OL 1893 0.742 40.566 32.939 1.00 0.00 H ATOM 78735 C113 OL 1893 1.802 38.868 32.467 1.00 0.00 C ATOM 78736 H13R OL 1893 0.877 38.365 32.177 1.00 0.00 H ATOM 78737 H13S OL 1893 2.586 38.555 31.774 1.00 0.00 H ATOM 78738 C114 OL 1893 2.292 38.406 33.845 1.00 0.00 C ATOM 78739 H14R OL 1893 2.374 37.318 33.802 1.00 0.00 H ATOM 78740 H14S OL 1893 3.298 38.781 34.043 1.00 0.00 H ATOM 78741 C115 OL 1893 1.582 38.942 35.080 1.00 0.00 C ATOM 78742 H15R OL 1893 2.072 38.727 36.032 1.00 0.00 H ATOM 78743 H15S OL 1893 1.688 40.026 35.006 1.00 0.00 H ATOM 78744 C116 OL 1893 0.110 38.513 35.216 1.00 0.00 C ATOM 78745 H16R OL 1893 -0.275 39.127 36.032 1.00 0.00 H ATOM 78746 H16S OL 1893 -0.438 38.928 34.367 1.00 0.00 H ATOM 78747 C117 OL 1893 -0.087 37.059 35.382 1.00 0.00 C ATOM 78748 H17R OL 1893 -1.172 36.959 35.317 1.00 0.00 H ATOM 78749 H17S OL 1893 0.364 36.612 34.493 1.00 0.00 H ATOM 78750 C118 OL 1893 0.445 36.539 36.705 1.00 0.00 C ATOM 78751 H18R OL 1893 1.496 36.244 36.663 1.00 0.00 H ATOM 78752 H18S OL 1893 -0.241 35.739 36.991 1.00 0.00 H ATOM 78753 H18T OL 1893 0.292 37.202 37.559 1.00 0.00 H TER 78754 OL 1893 ATOM 78754 C116 PA 1894 6.296 147.497 46.399 1.00 0.00 C ATOM 78755 H16R PA 1894 5.894 148.324 46.987 1.00 0.00 H ATOM 78756 H16S PA 1894 7.206 147.245 46.948 1.00 0.00 H ATOM 78757 H16T PA 1894 5.543 146.709 46.330 1.00 0.00 H ATOM 78758 C115 PA 1894 6.733 148.051 45.033 1.00 0.00 C ATOM 78759 H15R PA 1894 7.229 149.019 45.128 1.00 0.00 H ATOM 78760 H15S PA 1894 5.820 148.185 44.449 1.00 0.00 H ATOM 78761 C114 PA 1894 7.665 147.067 44.395 1.00 0.00 C ATOM 78762 H14R PA 1894 7.292 146.050 44.531 1.00 0.00 H ATOM 78763 H14S PA 1894 8.621 146.982 44.917 1.00 0.00 H ATOM 78764 C113 PA 1894 7.976 147.290 42.893 1.00 0.00 C ATOM 78765 H13R PA 1894 8.549 146.440 42.516 1.00 0.00 H ATOM 78766 H13S PA 1894 8.646 148.124 42.675 1.00 0.00 H ATOM 78767 C112 PA 1894 6.784 147.466 41.908 1.00 0.00 C ATOM 78768 H12R PA 1894 6.428 148.498 41.929 1.00 0.00 H ATOM 78769 H12S PA 1894 5.965 146.817 42.224 1.00 0.00 H ATOM 78770 C111 PA 1894 7.260 147.163 40.456 1.00 0.00 C ATOM 78771 H11R PA 1894 7.726 146.179 40.539 1.00 0.00 H ATOM 78772 H11S PA 1894 8.147 147.756 40.226 1.00 0.00 H ATOM 78773 C110 PA 1894 6.124 147.192 39.352 1.00 0.00 C ATOM 78774 H10R PA 1894 5.491 148.068 39.508 1.00 0.00 H ATOM 78775 H10S PA 1894 5.590 146.308 39.709 1.00 0.00 H ATOM 78776 C19 PA 1894 6.615 147.228 37.935 1.00 0.00 C ATOM 78777 H9R PA 1894 7.004 148.201 37.629 1.00 0.00 H ATOM 78778 H9S PA 1894 5.816 147.144 37.195 1.00 0.00 H ATOM 78779 C18 PA 1894 7.650 146.178 37.684 1.00 0.00 C ATOM 78780 H8R PA 1894 7.257 145.167 37.809 1.00 0.00 H ATOM 78781 H8S PA 1894 8.406 146.253 38.468 1.00 0.00 H ATOM 78782 C17 PA 1894 8.329 146.318 36.331 1.00 0.00 C ATOM 78783 H7R PA 1894 8.919 147.235 36.269 1.00 0.00 H ATOM 78784 H7S PA 1894 7.570 146.575 35.589 1.00 0.00 H ATOM 78785 C16 PA 1894 9.124 145.028 35.992 1.00 0.00 C ATOM 78786 H6R PA 1894 8.425 144.223 36.228 1.00 0.00 H ATOM 78787 H6S PA 1894 9.949 144.813 36.675 1.00 0.00 H ATOM 78788 C15 PA 1894 9.528 144.873 34.502 1.00 0.00 C ATOM 78789 H5R PA 1894 10.248 145.665 34.288 1.00 0.00 H ATOM 78790 H5S PA 1894 8.688 144.914 33.806 1.00 0.00 H ATOM 78791 C14 PA 1894 10.251 143.606 34.110 1.00 0.00 C ATOM 78792 H4R PA 1894 9.656 142.791 34.525 1.00 0.00 H ATOM 78793 H4S PA 1894 11.214 143.715 34.612 1.00 0.00 H ATOM 78794 C13 PA 1894 10.550 143.377 32.568 1.00 0.00 C ATOM 78795 H3R PA 1894 10.888 144.363 32.242 1.00 0.00 H ATOM 78796 H3S PA 1894 9.669 143.204 31.946 1.00 0.00 H ATOM 78797 C12 PA 1894 11.538 142.325 32.215 1.00 0.00 C ATOM 78798 H2R PA 1894 11.045 141.353 32.148 1.00 0.00 H ATOM 78799 H2S PA 1894 12.318 142.118 32.951 1.00 0.00 H ATOM 78800 C11 PGR 1895 12.218 142.562 30.943 1.00 0.00 C ATOM 78801 O12 PGR 1895 13.365 142.915 30.977 1.00 0.00 O ATOM 78802 O11 PGR 1895 11.366 142.509 29.819 1.00 0.00 O ATOM 78803 C1 PGR 1895 12.044 142.659 28.557 1.00 0.00 C ATOM 78804 HR PGR 1895 12.660 143.562 28.567 1.00 0.00 H ATOM 78805 HS PGR 1895 11.258 142.744 27.803 1.00 0.00 H ATOM 78806 C2 PGR 1895 12.906 141.380 28.343 1.00 0.00 C ATOM 78807 HX PGR 1895 13.723 141.247 29.058 1.00 0.00 H ATOM 78808 C3 PGR 1895 13.698 141.515 26.981 1.00 0.00 C ATOM 78809 HA PGR 1895 14.197 140.556 26.821 1.00 0.00 H ATOM 78810 HB PGR 1895 14.450 142.308 27.001 1.00 0.00 H ATOM 78811 O31 PGR 1895 12.854 141.784 25.935 1.00 0.00 O ATOM 78812 P31 PGR 1895 13.464 142.006 24.426 1.00 0.00 P ATOM 78813 O32 PGR 1895 13.866 143.582 24.434 1.00 0.00 O ATOM 78814 C31 PGR 1895 12.934 144.565 24.885 1.00 0.00 C ATOM 78815 H1A PGR 1895 13.054 144.368 25.953 1.00 0.00 H ATOM 78816 H1B PGR 1895 11.927 144.322 24.535 1.00 0.00 H ATOM 78817 C32 PGR 1895 13.469 145.969 24.474 1.00 0.00 C ATOM 78818 H2A PGR 1895 12.721 146.728 24.715 1.00 0.00 H ATOM 78819 O35 PGR 1895 13.576 145.895 23.069 1.00 0.00 O ATOM 78820 HO5A PGR 1895 14.178 145.182 22.790 1.00 0.00 H ATOM 78821 C33 PGR 1895 14.849 146.262 25.099 1.00 0.00 C ATOM 78822 H3A PGR 1895 14.860 145.804 26.092 1.00 0.00 H ATOM 78823 H3B PGR 1895 15.619 145.739 24.527 1.00 0.00 H ATOM 78824 O33 PGR 1895 14.826 141.363 24.353 1.00 0.00 O ATOM 78825 O34 PGR 1895 12.425 141.660 23.437 1.00 0.00 O ATOM 78826 O21 PGR 1895 12.160 140.174 28.250 1.00 0.00 O ATOM 78827 C21 PGR 1895 11.969 139.380 29.377 1.00 0.00 C ATOM 78828 O22 PGR 1895 12.456 139.608 30.461 1.00 0.00 O ATOM 78829 O36 PGR 1895 15.033 147.684 25.219 1.00 0.00 O ATOM 78830 HO6A PGR 1895 15.980 147.872 25.347 1.00 0.00 H ATOM 78831 C12 OL 1896 11.260 138.089 28.962 1.00 0.00 C ATOM 78832 H2R OL 1896 10.367 138.458 28.452 1.00 0.00 H ATOM 78833 H2S OL 1896 11.900 137.678 28.178 1.00 0.00 H ATOM 78834 C13 OL 1896 10.888 137.204 30.180 1.00 0.00 C ATOM 78835 H3R OL 1896 10.097 136.491 29.932 1.00 0.00 H ATOM 78836 H3S OL 1896 11.755 136.614 30.484 1.00 0.00 H ATOM 78837 C14 OL 1896 10.346 137.842 31.496 1.00 0.00 C ATOM 78838 H4R OL 1896 10.100 136.981 32.121 1.00 0.00 H ATOM 78839 H4S OL 1896 11.082 138.434 32.043 1.00 0.00 H ATOM 78840 C15 OL 1896 9.096 138.675 31.305 1.00 0.00 C ATOM 78841 H5R OL 1896 9.302 139.677 30.925 1.00 0.00 H ATOM 78842 H5S OL 1896 8.380 138.206 30.626 1.00 0.00 H ATOM 78843 C16 OL 1896 8.401 138.976 32.623 1.00 0.00 C ATOM 78844 H6R OL 1896 9.195 139.232 33.328 1.00 0.00 H ATOM 78845 H6S OL 1896 7.879 139.919 32.449 1.00 0.00 H ATOM 78846 C17 OL 1896 7.522 137.812 33.206 1.00 0.00 C ATOM 78847 H7R OL 1896 6.502 137.687 32.836 1.00 0.00 H ATOM 78848 H7S OL 1896 7.909 136.853 32.856 1.00 0.00 H ATOM 78849 C18 OL 1896 7.507 137.763 34.699 1.00 0.00 C ATOM 78850 H8R OL 1896 7.156 136.748 34.898 1.00 0.00 H ATOM 78851 H8S OL 1896 8.540 137.839 35.044 1.00 0.00 H ATOM 78852 C19 OL 1896 6.606 138.837 35.300 1.00 0.00 C ATOM 78853 H9R OL 1896 5.557 138.796 35.020 1.00 0.00 H ATOM 78854 C110 OL 1896 6.834 139.672 36.297 1.00 0.00 C ATOM 78855 H10R OL 1896 6.006 140.273 36.666 1.00 0.00 H ATOM 78856 C111 OL 1896 8.101 139.869 37.051 1.00 0.00 C ATOM 78857 H11R OL 1896 8.468 138.988 37.581 1.00 0.00 H ATOM 78858 H11S OL 1896 8.866 140.108 36.310 1.00 0.00 H ATOM 78859 C112 OL 1896 7.990 140.921 38.211 1.00 0.00 C ATOM 78860 H12R OL 1896 7.837 141.892 37.735 1.00 0.00 H ATOM 78861 H12S OL 1896 7.143 140.717 38.869 1.00 0.00 H ATOM 78862 C113 OL 1896 9.250 141.107 39.160 1.00 0.00 C ATOM 78863 H13R OL 1896 9.278 140.267 39.858 1.00 0.00 H ATOM 78864 H13S OL 1896 10.151 140.926 38.569 1.00 0.00 H ATOM 78865 C114 OL 1896 9.305 142.365 40.080 1.00 0.00 C ATOM 78866 H14R OL 1896 9.406 143.283 39.496 1.00 0.00 H ATOM 78867 H14S OL 1896 8.313 142.490 40.518 1.00 0.00 H ATOM 78868 C115 OL 1896 10.418 142.483 41.079 1.00 0.00 C ATOM 78869 H15R OL 1896 10.692 141.595 41.653 1.00 0.00 H ATOM 78870 H15S OL 1896 11.345 142.591 40.514 1.00 0.00 H ATOM 78871 C116 OL 1896 10.349 143.763 41.906 1.00 0.00 C ATOM 78872 H16R OL 1896 10.306 144.591 41.196 1.00 0.00 H ATOM 78873 H16S OL 1896 9.346 143.814 42.335 1.00 0.00 H ATOM 78874 C117 OL 1896 11.429 143.848 42.996 1.00 0.00 C ATOM 78875 H17R OL 1896 11.086 143.104 43.719 1.00 0.00 H ATOM 78876 H17S OL 1896 12.366 143.468 42.583 1.00 0.00 H ATOM 78877 C118 OL 1896 11.785 145.170 43.620 1.00 0.00 C ATOM 78878 H18R OL 1896 12.241 144.995 44.596 1.00 0.00 H ATOM 78879 H18S OL 1896 10.877 145.725 43.866 1.00 0.00 H ATOM 78880 H18T OL 1896 12.479 145.775 43.034 1.00 0.00 H TER 78881 OL 1896 ATOM 78881 C116 PA 1897 144.093 137.973 41.892 1.00 0.00 C ATOM 78882 H16R PA 1897 144.878 137.561 42.531 1.00 0.00 H ATOM 78883 H16S PA 1897 143.627 137.140 41.361 1.00 0.00 H ATOM 78884 H16T PA 1897 143.254 138.389 42.453 1.00 0.00 H ATOM 78885 C115 PA 1897 144.624 138.897 40.742 1.00 0.00 C ATOM 78886 H15R PA 1897 145.341 138.343 40.132 1.00 0.00 H ATOM 78887 H15S PA 1897 145.104 139.715 41.284 1.00 0.00 H ATOM 78888 C114 PA 1897 143.547 139.409 39.844 1.00 0.00 C ATOM 78889 H14R PA 1897 144.123 139.895 39.054 1.00 0.00 H ATOM 78890 H14S PA 1897 142.911 140.103 40.399 1.00 0.00 H ATOM 78891 C113 PA 1897 142.695 138.301 39.164 1.00 0.00 C ATOM 78892 H13R PA 1897 142.081 137.851 39.948 1.00 0.00 H ATOM 78893 H13S PA 1897 143.327 137.539 38.703 1.00 0.00 H ATOM 78894 C112 PA 1897 141.868 138.806 37.965 1.00 0.00 C ATOM 78895 H12R PA 1897 142.528 138.834 37.095 1.00 0.00 H ATOM 78896 H12S PA 1897 141.593 139.851 38.123 1.00 0.00 H ATOM 78897 C111 PA 1897 140.615 138.068 37.670 1.00 0.00 C ATOM 78898 H11R PA 1897 139.940 138.723 37.115 1.00 0.00 H ATOM 78899 H11S PA 1897 140.136 137.946 38.643 1.00 0.00 H ATOM 78900 C110 PA 1897 140.980 136.621 37.239 1.00 0.00 C ATOM 78901 H10R PA 1897 141.625 136.211 38.019 1.00 0.00 H ATOM 78902 H10S PA 1897 141.679 136.594 36.401 1.00 0.00 H ATOM 78903 C19 PA 1897 139.763 135.654 37.097 1.00 0.00 C ATOM 78904 H9R PA 1897 139.271 135.459 38.052 1.00 0.00 H ATOM 78905 H9S PA 1897 140.155 134.672 36.823 1.00 0.00 H ATOM 78906 C18 PA 1897 138.881 136.166 36.003 1.00 0.00 C ATOM 78907 H8R PA 1897 139.387 136.400 35.064 1.00 0.00 H ATOM 78908 H8S PA 1897 138.377 137.042 36.417 1.00 0.00 H ATOM 78909 C17 PA 1897 137.727 135.192 35.736 1.00 0.00 C ATOM 78910 H7R PA 1897 137.037 135.016 36.563 1.00 0.00 H ATOM 78911 H7S PA 1897 138.106 134.206 35.458 1.00 0.00 H ATOM 78912 C16 PA 1897 136.734 135.671 34.660 1.00 0.00 C ATOM 78913 H6R PA 1897 136.169 136.544 34.993 1.00 0.00 H ATOM 78914 H6S PA 1897 136.066 134.850 34.392 1.00 0.00 H ATOM 78915 C15 PA 1897 137.429 135.923 33.261 1.00 0.00 C ATOM 78916 H5R PA 1897 137.975 135.040 32.925 1.00 0.00 H ATOM 78917 H5S PA 1897 138.200 136.687 33.382 1.00 0.00 H ATOM 78918 C14 PA 1897 136.525 136.406 32.120 1.00 0.00 C ATOM 78919 H4R PA 1897 135.998 137.324 32.387 1.00 0.00 H ATOM 78920 H4S PA 1897 135.708 135.684 32.057 1.00 0.00 H ATOM 78921 C13 PA 1897 137.169 136.363 30.747 1.00 0.00 C ATOM 78922 H3R PA 1897 137.529 135.382 30.430 1.00 0.00 H ATOM 78923 H3S PA 1897 138.121 136.889 30.845 1.00 0.00 H ATOM 78924 C12 PA 1897 136.244 136.742 29.607 1.00 0.00 C ATOM 78925 H2R PA 1897 136.030 137.803 29.753 1.00 0.00 H ATOM 78926 H2S PA 1897 135.328 136.148 29.622 1.00 0.00 H ATOM 78927 C11 PGR 1898 136.837 136.719 28.175 1.00 0.00 C ATOM 78928 O12 PGR 1898 137.751 136.079 27.729 1.00 0.00 O ATOM 78929 O11 PGR 1898 136.052 137.446 27.350 1.00 0.00 O ATOM 78930 C1 PGR 1898 136.071 137.312 25.916 1.00 0.00 C ATOM 78931 HR PGR 1898 136.232 136.276 25.607 1.00 0.00 H ATOM 78932 HS PGR 1898 136.834 137.969 25.488 1.00 0.00 H ATOM 78933 C2 PGR 1898 134.732 137.820 25.279 1.00 0.00 C ATOM 78934 HX PGR 1898 133.788 137.282 25.395 1.00 0.00 H ATOM 78935 C3 PGR 1898 135.110 137.882 23.761 1.00 0.00 C ATOM 78936 HA PGR 1898 134.194 138.155 23.230 1.00 0.00 H ATOM 78937 HB PGR 1898 135.533 136.915 23.480 1.00 0.00 H ATOM 78938 O31 PGR 1898 136.096 138.875 23.485 1.00 0.00 O ATOM 78939 P31 PGR 1898 136.638 139.331 22.083 1.00 0.00 P ATOM 78940 O32 PGR 1898 136.219 140.839 22.170 1.00 0.00 O ATOM 78941 C31 PGR 1898 134.855 141.313 22.219 1.00 0.00 C ATOM 78942 H1A PGR 1898 134.827 142.297 22.694 1.00 0.00 H ATOM 78943 H1B PGR 1898 134.263 140.550 22.730 1.00 0.00 H ATOM 78944 C32 PGR 1898 134.198 141.503 20.794 1.00 0.00 C ATOM 78945 H2A PGR 1898 133.390 142.237 20.744 1.00 0.00 H ATOM 78946 O35 PGR 1898 133.581 140.251 20.457 1.00 0.00 O ATOM 78947 HO5A PGR 1898 134.300 139.664 20.753 1.00 0.00 H ATOM 78948 C33 PGR 1898 135.245 141.988 19.805 1.00 0.00 C ATOM 78949 H3A PGR 1898 135.757 142.858 20.224 1.00 0.00 H ATOM 78950 H3B PGR 1898 136.007 141.213 19.692 1.00 0.00 H ATOM 78951 O33 PGR 1898 138.113 139.168 22.000 1.00 0.00 O ATOM 78952 O34 PGR 1898 135.828 138.661 21.013 1.00 0.00 O ATOM 78953 O21 PGR 1898 134.516 139.206 25.755 1.00 0.00 O ATOM 78954 C21 PGR 1898 133.520 139.970 25.284 1.00 0.00 C ATOM 78955 O22 PGR 1898 132.715 139.656 24.478 1.00 0.00 O ATOM 78956 O36 PGR 1898 134.694 142.159 18.449 1.00 0.00 O ATOM 78957 HO6A PGR 1898 134.333 141.360 18.026 1.00 0.00 H ATOM 78958 C12 OL 1899 133.598 141.310 25.896 1.00 0.00 C ATOM 78959 H2R OL 1899 134.653 141.525 26.079 1.00 0.00 H ATOM 78960 H2S OL 1899 133.352 142.065 25.145 1.00 0.00 H ATOM 78961 C13 OL 1899 132.773 141.400 27.183 1.00 0.00 C ATOM 78962 H3R OL 1899 131.779 141.017 26.940 1.00 0.00 H ATOM 78963 H3S OL 1899 133.186 140.671 27.883 1.00 0.00 H ATOM 78964 C14 OL 1899 132.560 142.792 27.725 1.00 0.00 C ATOM 78965 H4R OL 1899 132.287 143.404 26.862 1.00 0.00 H ATOM 78966 H4S OL 1899 131.774 142.644 28.469 1.00 0.00 H ATOM 78967 C15 OL 1899 133.780 143.442 28.391 1.00 0.00 C ATOM 78968 H5R OL 1899 134.626 143.539 27.708 1.00 0.00 H ATOM 78969 H5S OL 1899 133.557 144.482 28.637 1.00 0.00 H ATOM 78970 C16 OL 1899 134.312 142.485 29.509 1.00 0.00 C ATOM 78971 H6R OL 1899 133.401 142.109 29.979 1.00 0.00 H ATOM 78972 H6S OL 1899 134.704 141.571 29.058 1.00 0.00 H ATOM 78973 C17 OL 1899 135.329 143.219 30.424 1.00 0.00 C ATOM 78974 H7R OL 1899 136.238 143.348 29.833 1.00 0.00 H ATOM 78975 H7S OL 1899 134.870 144.204 30.531 1.00 0.00 H ATOM 78976 C18 OL 1899 135.540 142.421 31.626 1.00 0.00 C ATOM 78977 H8R OL 1899 134.599 142.200 32.134 1.00 0.00 H ATOM 78978 H8S OL 1899 135.976 141.479 31.285 1.00 0.00 H ATOM 78979 C19 OL 1899 136.390 143.067 32.629 1.00 0.00 C ATOM 78980 H9R OL 1899 136.005 144.037 32.932 1.00 0.00 H ATOM 78981 C110 OL 1899 137.665 142.704 32.918 1.00 0.00 C ATOM 78982 H10R OL 1899 138.167 143.333 33.649 1.00 0.00 H ATOM 78983 C111 OL 1899 138.282 141.390 32.652 1.00 0.00 C ATOM 78984 H11R OL 1899 138.837 141.028 33.520 1.00 0.00 H ATOM 78985 H11S OL 1899 137.481 140.733 32.306 1.00 0.00 H ATOM 78986 C112 OL 1899 139.325 141.463 31.563 1.00 0.00 C ATOM 78987 H12R OL 1899 139.081 142.345 30.966 1.00 0.00 H ATOM 78988 H12S OL 1899 140.316 141.640 31.988 1.00 0.00 H ATOM 78989 C113 OL 1899 139.289 140.301 30.494 1.00 0.00 C ATOM 78990 H13R OL 1899 139.542 139.371 31.007 1.00 0.00 H ATOM 78991 H13S OL 1899 138.335 140.105 30.000 1.00 0.00 H ATOM 78992 C114 OL 1899 140.280 140.499 29.338 1.00 0.00 C ATOM 78993 H14R OL 1899 140.048 141.409 28.781 1.00 0.00 H ATOM 78994 H14S OL 1899 141.277 140.599 29.772 1.00 0.00 H ATOM 78995 C115 OL 1899 140.291 139.431 28.208 1.00 0.00 C ATOM 78996 H15R OL 1899 139.270 139.289 27.848 1.00 0.00 H ATOM 78997 H15S OL 1899 140.807 139.843 27.337 1.00 0.00 H ATOM 78998 C116 OL 1899 140.886 138.067 28.551 1.00 0.00 C ATOM 78999 H16R OL 1899 141.848 138.256 29.031 1.00 0.00 H ATOM 79000 H16S OL 1899 140.355 137.540 29.346 1.00 0.00 H ATOM 79001 C117 OL 1899 140.957 137.163 27.365 1.00 0.00 C ATOM 79002 H17R OL 1899 141.098 136.125 27.675 1.00 0.00 H ATOM 79003 H17S OL 1899 139.959 137.214 26.924 1.00 0.00 H ATOM 79004 C118 OL 1899 142.063 137.531 26.372 1.00 0.00 C ATOM 79005 H18R OL 1899 143.032 137.533 26.875 1.00 0.00 H ATOM 79006 H18S OL 1899 141.913 138.474 25.843 1.00 0.00 H ATOM 79007 H18T OL 1899 142.250 136.801 25.581 1.00 0.00 H TER 79008 OL 1899 ATOM 79008 Na+ Na+ 1900 121.541 21.994 21.053 1.00 0.00 NA TER 79009 Na+ 1900 ATOM 79009 Na+ Na+ 1901 125.216 40.325 57.690 1.00 0.00 NA TER 79010 Na+ 1901 ATOM 79010 Na+ Na+ 1902 127.519 53.123 138.888 1.00 0.00 NA TER 79011 Na+ 1902 ATOM 79011 Na+ Na+ 1903 117.043 4.145 139.380 1.00 0.00 NA TER 79012 Na+ 1903 ATOM 79012 Na+ Na+ 1904 138.871 34.194 13.768 1.00 0.00 NA TER 79013 Na+ 1904 ATOM 79013 Na+ Na+ 1905 18.118 122.125 24.184 1.00 0.00 NA TER 79014 Na+ 1905 ATOM 79014 Na+ Na+ 1906 138.307 91.615 30.042 1.00 0.00 NA TER 79015 Na+ 1906 ATOM 79015 Na+ Na+ 1907 137.264 17.084 64.680 1.00 0.00 NA TER 79016 Na+ 1907 ATOM 79016 Na+ Na+ 1908 65.105 143.048 57.488 1.00 0.00 NA TER 79017 Na+ 1908 ATOM 79017 Na+ Na+ 1909 109.966 93.392 56.448 1.00 0.00 NA TER 79018 Na+ 1909 ATOM 79018 Na+ Na+ 1910 2.827 91.653 60.382 1.00 0.00 NA TER 79019 Na+ 1910 ATOM 79019 Na+ Na+ 1911 117.576 46.224 21.639 1.00 0.00 NA TER 79020 Na+ 1911 ATOM 79020 Na+ Na+ 1912 57.559 144.758 55.507 1.00 0.00 NA TER 79021 Na+ 1912 ATOM 79021 Na+ Na+ 1913 66.908 77.291 26.353 1.00 0.00 NA TER 79022 Na+ 1913 ATOM 79022 Na+ Na+ 1914 108.789 45.012 22.240 1.00 0.00 NA TER 79023 Na+ 1914 ATOM 79023 Na+ Na+ 1915 101.936 74.168 78.749 1.00 0.00 NA TER 79024 Na+ 1915 ATOM 79024 Na+ Na+ 1916 145.566 61.548 19.741 1.00 0.00 NA TER 79025 Na+ 1916 ATOM 79025 Na+ Na+ 1917 90.153 141.806 15.416 1.00 0.00 NA TER 79026 Na+ 1917 ATOM 79026 Na+ Na+ 1918 73.055 59.031 81.511 1.00 0.00 NA TER 79027 Na+ 1918 ATOM 79027 Na+ Na+ 1919 75.112 52.569 18.477 1.00 0.00 NA TER 79028 Na+ 1919 ATOM 79028 Na+ Na+ 1920 6.208 70.160 55.525 1.00 0.00 NA TER 79029 Na+ 1920 ATOM 79029 Na+ Na+ 1921 85.430 108.733 14.947 1.00 0.00 NA TER 79030 Na+ 1921 ATOM 79030 Na+ Na+ 1922 22.773 68.941 61.839 1.00 0.00 NA TER 79031 Na+ 1922 ATOM 79031 Na+ Na+ 1923 139.838 25.646 19.503 1.00 0.00 NA TER 79032 Na+ 1923 ATOM 79032 Na+ Na+ 1924 108.124 128.088 59.490 1.00 0.00 NA TER 79033 Na+ 1924 ATOM 79033 Na+ Na+ 1925 34.558 116.336 23.488 1.00 0.00 NA TER 79034 Na+ 1925 ATOM 79034 Na+ Na+ 1926 103.527 132.261 19.162 1.00 0.00 NA TER 79035 Na+ 1926 ATOM 79035 Na+ Na+ 1927 39.779 53.381 141.112 1.00 0.00 NA TER 79036 Na+ 1927 ATOM 79036 Na+ Na+ 1928 4.965 87.060 99.898 1.00 0.00 NA TER 79037 Na+ 1928 ATOM 79037 Na+ Na+ 1929 63.891 29.272 25.595 1.00 0.00 NA TER 79038 Na+ 1929 ATOM 79038 Na+ Na+ 1930 4.787 50.559 60.480 1.00 0.00 NA TER 79039 Na+ 1930 ATOM 79039 Na+ Na+ 1931 138.514 58.389 54.996 1.00 0.00 NA TER 79040 Na+ 1931 ATOM 79040 Na+ Na+ 1932 69.473 29.336 69.432 1.00 0.00 NA TER 79041 Na+ 1932 ATOM 79041 Na+ Na+ 1933 103.533 8.552 56.148 1.00 0.00 NA TER 79042 Na+ 1933 ATOM 79042 Na+ Na+ 1934 115.395 28.463 19.939 1.00 0.00 NA TER 79043 Na+ 1934 ATOM 79043 Na+ Na+ 1935 28.647 126.038 16.096 1.00 0.00 NA TER 79044 Na+ 1935 ATOM 79044 Na+ Na+ 1936 32.410 79.351 24.482 1.00 0.00 NA TER 79045 Na+ 1936 ATOM 79045 Na+ Na+ 1937 95.279 51.066 74.028 1.00 0.00 NA TER 79046 Na+ 1937 ATOM 79046 Na+ Na+ 1938 103.147 112.567 59.130 1.00 0.00 NA TER 79047 Na+ 1938 ATOM 79047 Na+ Na+ 1939 92.581 105.998 66.364 1.00 0.00 NA TER 79048 Na+ 1939 ATOM 79048 Na+ Na+ 1940 60.693 128.462 67.330 1.00 0.00 NA TER 79049 Na+ 1940 ATOM 79049 Na+ Na+ 1941 25.748 133.429 54.699 1.00 0.00 NA TER 79050 Na+ 1941 ATOM 79050 Na+ Na+ 1942 101.902 28.786 21.930 1.00 0.00 NA TER 79051 Na+ 1942 ATOM 79051 Na+ Na+ 1943 54.972 12.596 71.338 1.00 0.00 NA TER 79052 Na+ 1943 ATOM 79052 Na+ Na+ 1944 51.096 116.573 11.016 1.00 0.00 NA TER 79053 Na+ 1944 ATOM 79053 Na+ Na+ 1945 70.419 37.057 57.335 1.00 0.00 NA TER 79054 Na+ 1945 ATOM 79054 Na+ Na+ 1946 85.114 35.359 58.818 1.00 0.00 NA TER 79055 Na+ 1946 ATOM 79055 Na+ Na+ 1947 12.411 108.765 22.516 1.00 0.00 NA TER 79056 Na+ 1947 ATOM 79056 Na+ Na+ 1948 92.489 116.639 57.124 1.00 0.00 NA TER 79057 Na+ 1948 ATOM 79057 Na+ Na+ 1949 78.693 29.142 22.282 1.00 0.00 NA TER 79058 Na+ 1949 ATOM 79058 Na+ Na+ 1950 52.756 30.253 22.067 1.00 0.00 NA TER 79059 Na+ 1950 ATOM 79059 Na+ Na+ 1951 71.333 94.956 21.681 1.00 0.00 NA TER 79060 Na+ 1951 ATOM 79060 Na+ Na+ 1952 104.840 105.457 146.659 1.00 0.00 NA TER 79061 Na+ 1952 ATOM 79061 Na+ Na+ 1953 57.515 103.928 12.595 1.00 0.00 NA TER 79062 Na+ 1953 ATOM 79062 Na+ Na+ 1954 109.009 97.002 156.950 1.00 0.00 NA TER 79063 Na+ 1954 ATOM 79063 Na+ Na+ 1955 113.689 85.313 67.871 1.00 0.00 NA TER 79064 Na+ 1955 ATOM 79064 Na+ Na+ 1956 56.884 30.305 58.284 1.00 0.00 NA TER 79065 Na+ 1956 ATOM 79065 Na+ Na+ 1957 11.036 117.496 59.166 1.00 0.00 NA TER 79066 Na+ 1957 ATOM 79066 Na+ Na+ 1958 41.201 75.874 21.680 1.00 0.00 NA TER 79067 Na+ 1958 ATOM 79067 Na+ Na+ 1959 70.267 92.083 59.570 1.00 0.00 NA TER 79068 Na+ 1959 ATOM 79068 Na+ Na+ 1960 101.357 5.797 121.218 1.00 0.00 NA TER 79069 Na+ 1960 ATOM 79069 Na+ Na+ 1961 59.642 70.857 12.724 1.00 0.00 NA TER 79070 Na+ 1961 ATOM 79070 Na+ Na+ 1962 99.393 91.743 61.955 1.00 0.00 NA TER 79071 Na+ 1962 ATOM 79071 Na+ Na+ 1963 63.861 45.826 25.291 1.00 0.00 NA TER 79072 Na+ 1963 ATOM 79072 Na+ Na+ 1964 18.191 27.430 115.957 1.00 0.00 NA TER 79073 Na+ 1964 ATOM 79073 Na+ Na+ 1965 129.575 35.448 21.578 1.00 0.00 NA TER 79074 Na+ 1965 ATOM 79074 Na+ Na+ 1966 48.999 119.470 61.292 1.00 0.00 NA TER 79075 Na+ 1966 ATOM 79075 Na+ Na+ 1967 98.831 129.512 63.624 1.00 0.00 NA TER 79076 Na+ 1967 ATOM 79076 Na+ Na+ 1968 90.407 36.807 93.866 1.00 0.00 NA TER 79077 Na+ 1968 ATOM 79077 Na+ Na+ 1969 36.325 45.402 150.304 1.00 0.00 NA TER 79078 Na+ 1969 ATOM 79078 Na+ Na+ 1970 128.522 73.361 22.139 1.00 0.00 NA TER 79079 Na+ 1970 ATOM 79079 Na+ Na+ 1971 76.076 99.617 111.069 1.00 0.00 NA TER 79080 Na+ 1971 ATOM 79080 Na+ Na+ 1972 73.535 2.549 23.298 1.00 0.00 NA TER 79081 Na+ 1972 ATOM 79081 Na+ Na+ 1973 40.766 141.610 17.916 1.00 0.00 NA TER 79082 Na+ 1973 ATOM 79082 Na+ Na+ 1974 23.629 20.913 16.370 1.00 0.00 NA TER 79083 Na+ 1974 ATOM 79083 Na+ Na+ 1975 125.666 15.819 21.512 1.00 0.00 NA TER 79084 Na+ 1975 ATOM 79084 Na+ Na+ 1976 1.820 140.494 64.771 1.00 0.00 NA TER 79085 Na+ 1976 ATOM 79085 Na+ Na+ 1977 22.958 47.492 59.550 1.00 0.00 NA TER 79086 Na+ 1977 ATOM 79086 Na+ Na+ 1978 11.725 62.005 58.615 1.00 0.00 NA TER 79087 Na+ 1978 ATOM 79087 Na+ Na+ 1979 127.018 79.431 24.338 1.00 0.00 NA TER 79088 Na+ 1979 ATOM 79088 Na+ Na+ 1980 101.229 138.491 61.050 1.00 0.00 NA TER 79089 Na+ 1980 ATOM 79089 Na+ Na+ 1981 107.152 79.143 135.815 1.00 0.00 NA TER 79090 Na+ 1981 ATOM 79090 Na+ Na+ 1982 11.774 120.655 56.445 1.00 0.00 NA TER 79091 Na+ 1982 ATOM 79091 Na+ Na+ 1983 11.904 34.352 13.137 1.00 0.00 NA TER 79092 Na+ 1983 ATOM 79092 Na+ Na+ 1984 70.303 84.366 20.530 1.00 0.00 NA TER 79093 Na+ 1984 ATOM 79093 Na+ Na+ 1985 137.537 84.522 27.382 1.00 0.00 NA TER 79094 Na+ 1985 ATOM 79094 Na+ Na+ 1986 80.016 91.472 91.698 1.00 0.00 NA TER 79095 Na+ 1986 ATOM 79095 Na+ Na+ 1987 88.505 72.896 22.133 1.00 0.00 NA TER 79096 Na+ 1987 ATOM 79096 Na+ Na+ 1988 62.692 3.102 158.189 1.00 0.00 NA TER 79097 Na+ 1988 ATOM 79097 Na+ Na+ 1989 41.672 10.994 19.538 1.00 0.00 NA TER 79098 Na+ 1989 ATOM 79098 Na+ Na+ 1990 3.442 17.192 105.111 1.00 0.00 NA TER 79099 Na+ 1990 ATOM 79099 Na+ Na+ 1991 27.059 61.005 71.787 1.00 0.00 NA TER 79100 Na+ 1991 ATOM 79100 Na+ Na+ 1992 133.399 28.580 57.801 1.00 0.00 NA TER 79101 Na+ 1992 ATOM 79101 Na+ Na+ 1993 124.676 22.560 58.122 1.00 0.00 NA TER 79102 Na+ 1993 ATOM 79102 Na+ Na+ 1994 11.454 62.592 54.799 1.00 0.00 NA TER 79103 Na+ 1994 ATOM 79103 Na+ Na+ 1995 114.013 68.279 60.159 1.00 0.00 NA TER 79104 Na+ 1995 ATOM 79104 Na+ Na+ 1996 19.368 2.516 24.005 1.00 0.00 NA TER 79105 Na+ 1996 ATOM 79105 Na+ Na+ 1997 134.918 58.714 16.087 1.00 0.00 NA TER 79106 Na+ 1997 ATOM 79106 Na+ Na+ 1998 71.396 2.011 55.027 1.00 0.00 NA TER 79107 Na+ 1998 ATOM 79107 Na+ Na+ 1999 53.394 22.565 58.213 1.00 0.00 NA TER 79108 Na+ 1999 ATOM 79108 Na+ Na+ 2000 32.980 9.875 16.845 1.00 0.00 NA TER 79109 Na+ 2000 ATOM 79109 Na+ Na+ 2001 107.060 87.482 25.162 1.00 0.00 NA TER 79110 Na+ 2001 ATOM 79110 Na+ Na+ 2002 145.664 51.690 15.810 1.00 0.00 NA TER 79111 Na+ 2002 ATOM 79111 Na+ Na+ 2003 88.958 75.099 108.639 1.00 0.00 NA TER 79112 Na+ 2003 ATOM 79112 Na+ Na+ 2004 18.270 69.919 140.849 1.00 0.00 NA TER 79113 Na+ 2004 ATOM 79113 Na+ Na+ 2005 84.650 12.643 18.255 1.00 0.00 NA TER 79114 Na+ 2005 ATOM 79114 Na+ Na+ 2006 100.886 44.230 20.631 1.00 0.00 NA TER 79115 Na+ 2006 ATOM 79115 Na+ Na+ 2007 13.130 36.554 21.086 1.00 0.00 NA TER 79116 Na+ 2007 ATOM 79116 Na+ Na+ 2008 19.571 126.869 18.570 1.00 0.00 NA TER 79117 Na+ 2008 ATOM 79117 Na+ Na+ 2009 69.749 37.363 24.878 1.00 0.00 NA TER 79118 Na+ 2009 ATOM 79118 Na+ Na+ 2010 100.368 109.965 72.290 1.00 0.00 NA TER 79119 Na+ 2010 ATOM 79119 Na+ Na+ 2011 136.773 117.044 12.909 1.00 0.00 NA TER 79120 Na+ 2011 ATOM 79120 Na+ Na+ 2012 104.537 49.851 20.419 1.00 0.00 NA TER 79121 Na+ 2012 ATOM 79121 Na+ Na+ 2013 100.957 133.616 3.725 1.00 0.00 NA TER 79122 Na+ 2013 ATOM 79122 Na+ Na+ 2014 102.837 2.745 6.225 1.00 0.00 NA TER 79123 Na+ 2014 ATOM 79123 Na+ Na+ 2015 126.806 85.943 61.628 1.00 0.00 NA TER 79124 Na+ 2015 ATOM 79124 Na+ Na+ 2016 143.748 69.832 14.647 1.00 0.00 NA TER 79125 Na+ 2016 ATOM 79125 Na+ Na+ 2017 119.658 30.505 22.961 1.00 0.00 NA TER 79126 Na+ 2017 ATOM 79126 Na+ Na+ 2018 121.779 126.352 21.720 1.00 0.00 NA TER 79127 Na+ 2018 ATOM 79127 Na+ Na+ 2019 130.832 70.657 26.472 1.00 0.00 NA TER 79128 Na+ 2019 ATOM 79128 Na+ Na+ 2020 22.330 17.894 65.981 1.00 0.00 NA TER 79129 Na+ 2020 ATOM 79129 Na+ Na+ 2021 138.669 27.981 85.699 1.00 0.00 NA TER 79130 Na+ 2021 ATOM 79130 Na+ Na+ 2022 10.204 104.638 58.321 1.00 0.00 NA TER 79131 Na+ 2022 ATOM 79131 Na+ Na+ 2023 4.957 62.118 16.922 1.00 0.00 NA TER 79132 Na+ 2023 ATOM 79132 Na+ Na+ 2024 33.559 107.331 24.944 1.00 0.00 NA TER 79133 Na+ 2024 ATOM 79133 Na+ Na+ 2025 20.176 95.865 70.684 1.00 0.00 NA TER 79134 Na+ 2025 ATOM 79134 Na+ Na+ 2026 7.667 12.145 58.945 1.00 0.00 NA TER 79135 Na+ 2026 ATOM 79135 Na+ Na+ 2027 76.954 135.320 19.450 1.00 0.00 NA TER 79136 Na+ 2027 ATOM 79136 Na+ Na+ 2028 125.895 15.103 55.032 1.00 0.00 NA TER 79137 Na+ 2028 ATOM 79137 Na+ Na+ 2029 143.399 103.628 60.165 1.00 0.00 NA TER 79138 Na+ 2029 ATOM 79138 Na+ Na+ 2030 9.746 28.697 19.356 1.00 0.00 NA TER 79139 Na+ 2030 ATOM 79139 Na+ Na+ 2031 27.520 94.262 61.300 1.00 0.00 NA TER 79140 Na+ 2031 ATOM 79140 Na+ Na+ 2032 66.881 14.879 15.749 1.00 0.00 NA TER 79141 Na+ 2032 ATOM 79141 Na+ Na+ 2033 74.570 21.389 91.752 1.00 0.00 NA TER 79142 Na+ 2033 ATOM 79142 Na+ Na+ 2034 16.180 60.581 15.745 1.00 0.00 NA TER 79143 Na+ 2034 ATOM 79143 Na+ Na+ 2035 136.191 132.948 24.708 1.00 0.00 NA TER 79144 Na+ 2035 ATOM 79144 Na+ Na+ 2036 61.909 16.084 54.652 1.00 0.00 NA TER 79145 Na+ 2036 ATOM 79145 Na+ Na+ 2037 48.711 129.401 21.368 1.00 0.00 NA TER 79146 Na+ 2037 ATOM 79146 Na+ Na+ 2038 69.251 104.146 23.829 1.00 0.00 NA TER 79147 Na+ 2038 ATOM 79147 Na+ Na+ 2039 53.214 66.753 20.653 1.00 0.00 NA TER 79148 Na+ 2039 ATOM 79148 Na+ Na+ 2040 93.016 109.918 148.130 1.00 0.00 NA TER 79149 Na+ 2040 ATOM 79149 Na+ Na+ 2041 59.761 70.638 27.509 1.00 0.00 NA TER 79150 Na+ 2041 ATOM 79150 Na+ Na+ 2042 128.155 42.854 64.272 1.00 0.00 NA TER 79151 Na+ 2042 ATOM 79151 Na+ Na+ 2043 40.602 44.447 21.773 1.00 0.00 NA TER 79152 Na+ 2043 ATOM 79152 Na+ Na+ 2044 107.375 14.145 18.549 1.00 0.00 NA TER 79153 Na+ 2044 ATOM 79153 Na+ Na+ 2045 91.086 113.034 25.251 1.00 0.00 NA TER 79154 Na+ 2045 ATOM 79154 Na+ Na+ 2046 23.175 140.483 19.153 1.00 0.00 NA TER 79155 Na+ 2046 ATOM 79155 Na+ Na+ 2047 23.397 41.607 20.435 1.00 0.00 NA TER 79156 Na+ 2047 ATOM 79156 Na+ Na+ 2048 111.011 117.677 65.670 1.00 0.00 NA TER 79157 Na+ 2048 ATOM 79157 Na+ Na+ 2049 114.101 121.670 60.572 1.00 0.00 NA TER 79158 Na+ 2049 ATOM 79158 Na+ Na+ 2050 25.463 61.087 63.594 1.00 0.00 NA TER 79159 Na+ 2050 ATOM 79159 Na+ Na+ 2051 56.878 12.742 54.077 1.00 0.00 NA TER 79160 Na+ 2051 ATOM 79160 Na+ Na+ 2052 42.013 45.415 24.600 1.00 0.00 NA TER 79161 Na+ 2052 ATOM 79161 Na+ Na+ 2053 51.708 100.442 69.337 1.00 0.00 NA TER 79162 Na+ 2053 ATOM 79162 Na+ Na+ 2054 113.917 62.898 154.897 1.00 0.00 NA TER 79163 Na+ 2054 ATOM 79163 Na+ Na+ 2055 41.371 94.533 87.685 1.00 0.00 NA TER 79164 Na+ 2055 ATOM 79164 Na+ Na+ 2056 31.268 35.233 61.385 1.00 0.00 NA TER 79165 Na+ 2056 ATOM 79165 Na+ Na+ 2057 41.124 135.591 55.415 1.00 0.00 NA TER 79166 Na+ 2057 ATOM 79166 Na+ Na+ 2058 132.425 104.143 62.886 1.00 0.00 NA TER 79167 Na+ 2058 ATOM 79167 Na+ Na+ 2059 129.069 131.575 16.096 1.00 0.00 NA TER 79168 Na+ 2059 ATOM 79168 Na+ Na+ 2060 129.754 49.280 63.751 1.00 0.00 NA TER 79169 Na+ 2060 ATOM 79169 Na+ Na+ 2061 95.647 21.799 98.408 1.00 0.00 NA TER 79170 Na+ 2061 ATOM 79170 Na+ Na+ 2062 119.288 135.455 125.235 1.00 0.00 NA TER 79171 Na+ 2062 ATOM 79171 Na+ Na+ 2063 94.485 78.229 64.569 1.00 0.00 NA TER 79172 Na+ 2063 ATOM 79172 Na+ Na+ 2064 16.657 138.195 21.414 1.00 0.00 NA TER 79173 Na+ 2064 ATOM 79173 Na+ Na+ 2065 57.983 84.582 15.831 1.00 0.00 NA TER 79174 Na+ 2065 ATOM 79174 Na+ Na+ 2066 11.419 122.196 22.004 1.00 0.00 NA TER 79175 Na+ 2066 ATOM 79175 Na+ Na+ 2067 49.049 77.399 24.745 1.00 0.00 NA TER 79176 Na+ 2067 ATOM 79176 Na+ Na+ 2068 128.760 126.319 58.666 1.00 0.00 NA TER 79177 Na+ 2068 ATOM 79177 Na+ Na+ 2069 0.790 51.010 21.790 1.00 0.00 NA TER 79178 Na+ 2069 ATOM 79178 Na+ Na+ 2070 84.824 93.293 21.759 1.00 0.00 NA TER 79179 Na+ 2070 ATOM 79179 Na+ Na+ 2071 59.176 40.167 23.684 1.00 0.00 NA TER 79180 Na+ 2071 ATOM 79180 Na+ Na+ 2072 91.168 132.375 59.251 1.00 0.00 NA TER 79181 Na+ 2072 ATOM 79181 Na+ Na+ 2073 38.508 11.796 63.409 1.00 0.00 NA TER 79182 Na+ 2073 ATOM 79182 Na+ Na+ 2074 88.338 102.178 26.230 1.00 0.00 NA TER 79183 Na+ 2074 ATOM 79183 Na+ Na+ 2075 65.004 14.252 61.700 1.00 0.00 NA TER 79184 Na+ 2075 ATOM 79184 Na+ Na+ 2076 21.859 28.683 24.991 1.00 0.00 NA TER 79185 Na+ 2076 ATOM 79185 Na+ Na+ 2077 77.236 82.777 56.318 1.00 0.00 NA TER 79186 Na+ 2077 ATOM 79186 Na+ Na+ 2078 101.146 124.624 58.533 1.00 0.00 NA TER 79187 Na+ 2078 ATOM 79187 Na+ Na+ 2079 48.603 99.848 114.415 1.00 0.00 NA TER 79188 Na+ 2079 ATOM 79188 Na+ Na+ 2080 21.645 90.035 22.351 1.00 0.00 NA TER 79189 Na+ 2080 ATOM 79189 Na+ Na+ 2081 1.157 130.539 19.310 1.00 0.00 NA TER 79190 Na+ 2081 ATOM 79190 Na+ Na+ 2082 87.636 59.581 61.497 1.00 0.00 NA TER 79191 Na+ 2082 ATOM 79191 Na+ Na+ 2083 140.627 9.655 60.268 1.00 0.00 NA TER 79192 Na+ 2083 ATOM 79192 Na+ Na+ 2084 27.401 121.218 66.208 1.00 0.00 NA TER 79193 Na+ 2084 ATOM 79193 Na+ Na+ 2085 10.075 67.526 13.844 1.00 0.00 NA TER 79194 Na+ 2085 ATOM 79194 Na+ Na+ 2086 16.353 100.317 149.534 1.00 0.00 NA TER 79195 Na+ 2086 ATOM 79195 Na+ Na+ 2087 43.627 27.646 23.278 1.00 0.00 NA TER 79196 Na+ 2087 ATOM 79196 Na+ Na+ 2088 84.449 70.056 22.808 1.00 0.00 NA TER 79197 Na+ 2088 ATOM 79197 Na+ Na+ 2089 112.718 30.700 62.461 1.00 0.00 NA TER 79198 Na+ 2089 ATOM 79198 Na+ Na+ 2090 20.335 110.591 99.334 1.00 0.00 NA TER 79199 Na+ 2090 ATOM 79199 Na+ Na+ 2091 79.880 90.288 74.870 1.00 0.00 NA TER 79200 Na+ 2091 ATOM 79200 Na+ Na+ 2092 49.226 85.265 112.417 1.00 0.00 NA TER 79201 Na+ 2092 ATOM 79201 Na+ Na+ 2093 137.397 82.237 30.171 1.00 0.00 NA TER 79202 Na+ 2093 ATOM 79202 Na+ Na+ 2094 69.933 78.340 58.431 1.00 0.00 NA TER 79203 Na+ 2094 ATOM 79203 Na+ Na+ 2095 122.887 135.146 58.198 1.00 0.00 NA TER 79204 Na+ 2095 ATOM 79204 Na+ Na+ 2096 107.619 108.908 21.806 1.00 0.00 NA TER 79205 Na+ 2096 ATOM 79205 Na+ Na+ 2097 19.377 2.262 60.978 1.00 0.00 NA TER 79206 Na+ 2097 ATOM 79206 Na+ Na+ 2098 2.876 40.173 11.766 1.00 0.00 NA TER 79207 Na+ 2098 ATOM 79207 Na+ Na+ 2099 101.597 113.750 61.884 1.00 0.00 NA TER 79208 Na+ 2099 ATOM 79208 Na+ Na+ 2100 129.826 142.786 63.133 1.00 0.00 NA TER 79209 Na+ 2100 ATOM 79209 Na+ Na+ 2101 1.617 40.815 59.001 1.00 0.00 NA TER 79210 Na+ 2101 ATOM 79210 Na+ Na+ 2102 40.411 24.844 68.423 1.00 0.00 NA TER 79211 Na+ 2102 ATOM 79211 Na+ Na+ 2103 93.731 30.690 18.009 1.00 0.00 NA TER 79212 Na+ 2103 ATOM 79212 Na+ Na+ 2104 127.041 95.123 62.408 1.00 0.00 NA TER 79213 Na+ 2104 ATOM 79213 Na+ Na+ 2105 97.935 21.869 18.756 1.00 0.00 NA TER 79214 Na+ 2105 ATOM 79214 Na+ Na+ 2106 2.561 26.147 55.980 1.00 0.00 NA TER 79215 Na+ 2106 ATOM 79215 Na+ Na+ 2107 118.958 40.922 147.440 1.00 0.00 NA TER 79216 Na+ 2107 ATOM 79216 Na+ Na+ 2108 25.413 121.483 19.061 1.00 0.00 NA TER 79217 Na+ 2108 ATOM 79217 Na+ Na+ 2109 110.259 65.296 65.863 1.00 0.00 NA TER 79218 Na+ 2109 ATOM 79218 Na+ Na+ 2110 8.463 144.156 136.763 1.00 0.00 NA TER 79219 Na+ 2110 ATOM 79219 Na+ Na+ 2111 122.815 96.953 57.280 1.00 0.00 NA TER 79220 Na+ 2111 ATOM 79220 Na+ Na+ 2112 134.742 123.819 18.288 1.00 0.00 NA TER 79221 Na+ 2112 ATOM 79221 Na+ Na+ 2113 25.348 97.967 101.621 1.00 0.00 NA TER 79222 Na+ 2113 ATOM 79222 Na+ Na+ 2114 94.658 142.782 58.846 1.00 0.00 NA TER 79223 Na+ 2114 ATOM 79223 Na+ Na+ 2115 93.652 46.076 26.593 1.00 0.00 NA TER 79224 Na+ 2115 ATOM 79224 Na+ Na+ 2116 139.562 63.514 119.900 1.00 0.00 NA TER 79225 Na+ 2116 ATOM 79225 Na+ Na+ 2117 37.240 128.964 8.372 1.00 0.00 NA TER 79226 Na+ 2117 ATOM 79226 Na+ Na+ 2118 33.787 41.931 26.506 1.00 0.00 NA TER 79227 Na+ 2118 ATOM 79227 Na+ Na+ 2119 145.044 3.257 74.474 1.00 0.00 NA TER 79228 Na+ 2119 ATOM 79228 Na+ Na+ 2120 90.677 86.389 2.209 1.00 0.00 NA TER 79229 Na+ 2120 ATOM 79229 Na+ Na+ 2121 49.113 60.256 110.156 1.00 0.00 NA TER 79230 Na+ 2121 ATOM 79230 Na+ Na+ 2122 103.895 78.298 21.475 1.00 0.00 NA TER 79231 Na+ 2122 ATOM 79231 Na+ Na+ 2123 79.796 99.297 25.468 1.00 0.00 NA TER 79232 Na+ 2123 ATOM 79232 Na+ Na+ 2124 125.748 114.950 60.929 1.00 0.00 NA TER 79233 Na+ 2124 ATOM 79233 Na+ Na+ 2125 95.734 139.846 70.258 1.00 0.00 NA TER 79234 Na+ 2125 ATOM 79234 Na+ Na+ 2126 58.035 109.326 56.372 1.00 0.00 NA TER 79235 Na+ 2126 ATOM 79235 Na+ Na+ 2127 58.837 139.069 69.079 1.00 0.00 NA TER 79236 Na+ 2127 ATOM 79236 Na+ Na+ 2128 38.791 66.051 21.308 1.00 0.00 NA TER 79237 Na+ 2128 ATOM 79237 Na+ Na+ 2129 13.792 7.431 24.563 1.00 0.00 NA TER 79238 Na+ 2129 ATOM 79238 Na+ Na+ 2130 129.625 38.821 130.454 1.00 0.00 NA TER 79239 Na+ 2130 ATOM 79239 Na+ Na+ 2131 125.112 137.573 14.564 1.00 0.00 NA TER 79240 Na+ 2131 ATOM 79240 Na+ Na+ 2132 5.539 124.597 72.180 1.00 0.00 NA TER 79241 Na+ 2132 ATOM 79241 Na+ Na+ 2133 28.252 55.386 56.587 1.00 0.00 NA TER 79242 Na+ 2133 ATOM 79242 Na+ Na+ 2134 0.695 122.714 68.793 1.00 0.00 NA TER 79243 Na+ 2134 ATOM 79243 Na+ Na+ 2135 4.859 107.918 94.503 1.00 0.00 NA TER 79244 Na+ 2135 ATOM 79244 Na+ Na+ 2136 53.228 95.353 21.063 1.00 0.00 NA TER 79245 Na+ 2136 ATOM 79245 Na+ Na+ 2137 11.056 26.977 60.457 1.00 0.00 NA TER 79246 Na+ 2137 ATOM 79246 Na+ Na+ 2138 33.865 121.824 58.063 1.00 0.00 NA TER 79247 Na+ 2138 ATOM 79247 Na+ Na+ 2139 32.295 49.955 59.380 1.00 0.00 NA TER 79248 Na+ 2139 ATOM 79248 Na+ Na+ 2140 75.194 106.025 56.252 1.00 0.00 NA TER 79249 Na+ 2140 ATOM 79249 Na+ Na+ 2141 77.446 107.178 59.047 1.00 0.00 NA TER 79250 Na+ 2141 ATOM 79250 Na+ Na+ 2142 23.212 104.374 11.112 1.00 0.00 NA TER 79251 Na+ 2142 ATOM 79251 Na+ Na+ 2143 22.508 141.962 123.371 1.00 0.00 NA TER 79252 Na+ 2143 ATOM 79252 Na+ Na+ 2144 39.067 101.478 26.247 1.00 0.00 NA TER 79253 Na+ 2144 ATOM 79253 Na+ Na+ 2145 58.050 59.384 26.431 1.00 0.00 NA TER 79254 Na+ 2145 ATOM 79254 Na+ Na+ 2146 29.119 130.563 66.882 1.00 0.00 NA TER 79255 Na+ 2146 ATOM 79255 Na+ Na+ 2147 34.023 132.277 57.917 1.00 0.00 NA TER 79256 Na+ 2147 ATOM 79256 Na+ Na+ 2148 89.650 136.152 65.879 1.00 0.00 NA TER 79257 Na+ 2148 ATOM 79257 Na+ Na+ 2149 73.009 141.715 59.464 1.00 0.00 NA TER 79258 Na+ 2149 ATOM 79258 Na+ Na+ 2150 21.137 129.181 59.530 1.00 0.00 NA TER 79259 Na+ 2150 ATOM 79259 Na+ Na+ 2151 125.845 90.926 67.142 1.00 0.00 NA TER 79260 Na+ 2151 ATOM 79260 Na+ Na+ 2152 22.718 133.579 24.809 1.00 0.00 NA TER 79261 Na+ 2152 ATOM 79261 Na+ Na+ 2153 142.925 114.490 23.035 1.00 0.00 NA TER 79262 Na+ 2153 ATOM 79262 Na+ Na+ 2154 125.092 56.597 56.409 1.00 0.00 NA TER 79263 Na+ 2154 ATOM 79263 Na+ Na+ 2155 92.707 13.012 57.130 1.00 0.00 NA TER 79264 Na+ 2155 ATOM 79264 Na+ Na+ 2156 5.929 47.124 63.773 1.00 0.00 NA TER 79265 Na+ 2156 ATOM 79265 Na+ Na+ 2157 35.319 40.873 12.010 1.00 0.00 NA TER 79266 Na+ 2157 ATOM 79266 Na+ Na+ 2158 15.589 101.556 58.462 1.00 0.00 NA TER 79267 Na+ 2158 ATOM 79267 Na+ Na+ 2159 100.898 78.702 23.740 1.00 0.00 NA TER 79268 Na+ 2159 ATOM 79268 Na+ Na+ 2160 78.363 80.839 102.264 1.00 0.00 NA TER 79269 Na+ 2160 ATOM 79269 Na+ Na+ 2161 79.015 41.454 27.377 1.00 0.00 NA TER 79270 Na+ 2161 ATOM 79270 Na+ Na+ 2162 45.411 133.576 14.686 1.00 0.00 NA TER 79271 Na+ 2162 ATOM 79271 Na+ Na+ 2163 19.399 19.367 72.088 1.00 0.00 NA TER 79272 Na+ 2163 ATOM 79272 Na+ Na+ 2164 7.975 100.220 21.277 1.00 0.00 NA TER 79273 Na+ 2164 ATOM 79273 Na+ Na+ 2165 81.271 17.543 16.891 1.00 0.00 NA TER 79274 Na+ 2165 ATOM 79274 Na+ Na+ 2166 39.160 20.051 19.134 1.00 0.00 NA TER 79275 Na+ 2166 ATOM 79275 Na+ Na+ 2167 144.882 94.987 23.430 1.00 0.00 NA TER 79276 Na+ 2167 ATOM 79276 Na+ Na+ 2168 83.570 12.766 66.112 1.00 0.00 NA TER 79277 Na+ 2168 ATOM 79277 Na+ Na+ 2169 38.279 40.962 65.476 1.00 0.00 NA TER 79278 Na+ 2169 ATOM 79278 Na+ Na+ 2170 95.199 91.339 18.733 1.00 0.00 NA TER 79279 Na+ 2170 ATOM 79279 Na+ Na+ 2171 103.915 83.641 129.025 1.00 0.00 NA TER 79280 Na+ 2171 ATOM 79280 Na+ Na+ 2172 122.286 64.660 141.251 1.00 0.00 NA TER 79281 Na+ 2172 ATOM 79281 Na+ Na+ 2173 77.461 40.795 13.198 1.00 0.00 NA TER 79282 Na+ 2173 ATOM 79282 Na+ Na+ 2174 121.090 65.858 62.238 1.00 0.00 NA TER 79283 Na+ 2174 ATOM 79283 Na+ Na+ 2175 47.679 48.105 22.168 1.00 0.00 NA TER 79284 Na+ 2175 ATOM 79284 Na+ Na+ 2176 35.573 27.736 25.204 1.00 0.00 NA TER 79285 Na+ 2176 ATOM 79285 Na+ Na+ 2177 100.767 84.220 112.608 1.00 0.00 NA TER 79286 Na+ 2177 ATOM 79286 Na+ Na+ 2178 31.706 138.551 53.432 1.00 0.00 NA TER 79287 Na+ 2178 ATOM 79287 Na+ Na+ 2179 41.466 96.337 59.129 1.00 0.00 NA TER 79288 Na+ 2179 ATOM 79288 Na+ Na+ 2180 88.188 54.107 57.369 1.00 0.00 NA TER 79289 Na+ 2180 ATOM 79289 Na+ Na+ 2181 21.943 73.114 58.287 1.00 0.00 NA TER 79290 Na+ 2181 ATOM 79290 Na+ Na+ 2182 142.985 89.064 80.379 1.00 0.00 NA TER 79291 Na+ 2182 ATOM 79291 Na+ Na+ 2183 13.865 58.393 58.034 1.00 0.00 NA TER 79292 Na+ 2183 ATOM 79292 Na+ Na+ 2184 85.227 142.516 20.187 1.00 0.00 NA TER 79293 Na+ 2184 ATOM 79293 Na+ Na+ 2185 117.757 115.499 22.629 1.00 0.00 NA TER 79294 Na+ 2185 ATOM 79294 Na+ Na+ 2186 0.687 114.976 63.013 1.00 0.00 NA TER 79295 Na+ 2186 ATOM 79295 Na+ Na+ 2187 26.381 45.860 72.623 1.00 0.00 NA TER 79296 Na+ 2187 ATOM 79296 Na+ Na+ 2188 9.954 109.260 13.898 1.00 0.00 NA TER 79297 Na+ 2188 ATOM 79297 Na+ Na+ 2189 43.884 61.206 57.592 1.00 0.00 NA TER 79298 Na+ 2189 ATOM 79298 Na+ Na+ 2190 81.212 59.347 63.531 1.00 0.00 NA TER 79299 Na+ 2190 ATOM 79299 Na+ Na+ 2191 18.967 140.662 65.571 1.00 0.00 NA TER 79300 Na+ 2191 ATOM 79300 Na+ Na+ 2192 95.203 73.051 22.107 1.00 0.00 NA TER 79301 Na+ 2192 ATOM 79301 Na+ Na+ 2193 99.006 21.757 56.926 1.00 0.00 NA TER 79302 Na+ 2193 ATOM 79302 Na+ Na+ 2194 116.715 34.466 1.561 1.00 0.00 NA TER 79303 Na+ 2194 ATOM 79303 Na+ Na+ 2195 58.032 124.691 13.682 1.00 0.00 NA TER 79304 Na+ 2195 ATOM 79304 Na+ Na+ 2196 9.999 52.472 12.836 1.00 0.00 NA TER 79305 Na+ 2196 ATOM 79305 Na+ Na+ 2197 143.261 76.018 61.184 1.00 0.00 NA TER 79306 Na+ 2197 ATOM 79306 Na+ Na+ 2198 17.863 103.922 21.928 1.00 0.00 NA TER 79307 Na+ 2198 ATOM 79307 Na+ Na+ 2199 134.238 79.227 59.986 1.00 0.00 NA TER 79308 Na+ 2199 ATOM 79308 Na+ Na+ 2200 64.723 21.537 14.442 1.00 0.00 NA TER 79309 Na+ 2200 ATOM 79309 Na+ Na+ 2201 126.797 23.126 69.878 1.00 0.00 NA TER 79310 Na+ 2201 ATOM 79310 Na+ Na+ 2202 134.979 7.460 57.236 1.00 0.00 NA TER 79311 Na+ 2202 ATOM 79311 Na+ Na+ 2203 133.794 6.383 23.677 1.00 0.00 NA TER 79312 Na+ 2203 ATOM 79312 Na+ Na+ 2204 79.146 35.048 59.417 1.00 0.00 NA TER 79313 Na+ 2204 ATOM 79313 Na+ Na+ 2205 145.781 73.950 21.245 1.00 0.00 NA TER 79314 Na+ 2205 ATOM 79314 Na+ Na+ 2206 135.451 56.551 56.118 1.00 0.00 NA TER 79315 Na+ 2206 ATOM 79315 Na+ Na+ 2207 71.887 52.469 25.195 1.00 0.00 NA TER 79316 Na+ 2207 ATOM 79316 Na+ Na+ 2208 96.912 44.498 22.320 1.00 0.00 NA TER 79317 Na+ 2208 ATOM 79317 Na+ Na+ 2209 55.124 86.404 27.250 1.00 0.00 NA TER 79318 Na+ 2209 ATOM 79318 Na+ Na+ 2210 125.642 56.272 65.024 1.00 0.00 NA TER 79319 Na+ 2210 ATOM 79319 Na+ Na+ 2211 81.765 130.653 14.466 1.00 0.00 NA TER 79320 Na+ 2211 ATOM 79320 Na+ Na+ 2212 117.810 12.184 16.302 1.00 0.00 NA TER 79321 Na+ 2212 ATOM 79321 Na+ Na+ 2213 101.775 31.931 118.340 1.00 0.00 NA TER 79322 Na+ 2213 ATOM 79322 Na+ Na+ 2214 42.202 84.617 57.626 1.00 0.00 NA TER 79323 Na+ 2214 ATOM 79323 Na+ Na+ 2215 66.655 31.706 65.364 1.00 0.00 NA TER 79324 Na+ 2215 ATOM 79324 Na+ Na+ 2216 104.865 108.383 25.052 1.00 0.00 NA TER 79325 Na+ 2216 ATOM 79325 Na+ Na+ 2217 27.788 61.513 53.146 1.00 0.00 NA TER 79326 Na+ 2217 ATOM 79326 Na+ Na+ 2218 104.088 76.967 62.811 1.00 0.00 NA TER 79327 Na+ 2218 ATOM 79327 Na+ Na+ 2219 107.656 29.812 65.443 1.00 0.00 NA TER 79328 Na+ 2219 ATOM 79328 Na+ Na+ 2220 117.382 82.504 64.173 1.00 0.00 NA TER 79329 Na+ 2220 ATOM 79329 Na+ Na+ 2221 51.904 39.769 100.346 1.00 0.00 NA TER 79330 Na+ 2221 ATOM 79330 Na+ Na+ 2222 92.276 135.518 14.471 1.00 0.00 NA TER 79331 Na+ 2222 ATOM 79331 Na+ Na+ 2223 37.708 14.498 85.487 1.00 0.00 NA TER 79332 Na+ 2223 ATOM 79332 Na+ Na+ 2224 144.632 67.298 155.494 1.00 0.00 NA TER 79333 Na+ 2224 ATOM 79333 Na+ Na+ 2225 30.020 103.257 58.667 1.00 0.00 NA TER 79334 Na+ 2225 ATOM 79334 Na+ Na+ 2226 55.626 44.840 128.159 1.00 0.00 NA TER 79335 Na+ 2226 ATOM 79335 Na+ Na+ 2227 9.609 26.729 105.197 1.00 0.00 NA TER 79336 Na+ 2227 ATOM 79336 Na+ Na+ 2228 113.356 136.011 116.908 1.00 0.00 NA TER 79337 Na+ 2228 ATOM 79337 Na+ Na+ 2229 51.391 101.650 63.426 1.00 0.00 NA TER 79338 Na+ 2229 ATOM 79338 Na+ Na+ 2230 18.406 94.120 91.328 1.00 0.00 NA TER 79339 Na+ 2230 ATOM 79339 Na+ Na+ 2231 138.898 124.672 25.616 1.00 0.00 NA TER 79340 Na+ 2231 ATOM 79340 Na+ Na+ 2232 31.982 89.129 4.959 1.00 0.00 NA TER 79341 Na+ 2232 ATOM 79341 Na+ Na+ 2233 117.080 56.871 61.846 1.00 0.00 NA TER 79342 Na+ 2233 ATOM 79342 Na+ Na+ 2234 60.354 91.783 97.429 1.00 0.00 NA TER 79343 Na+ 2234 ATOM 79343 Na+ Na+ 2235 95.927 123.329 97.575 1.00 0.00 NA TER 79344 Na+ 2235 ATOM 79344 Na+ Na+ 2236 5.575 109.772 140.302 1.00 0.00 NA TER 79345 Na+ 2236 ATOM 79345 Na+ Na+ 2237 57.550 58.043 29.365 1.00 0.00 NA TER 79346 Na+ 2237 ATOM 79346 Na+ Na+ 2238 79.294 24.364 60.052 1.00 0.00 NA TER 79347 Na+ 2238 ATOM 79347 Na+ Na+ 2239 38.600 28.954 153.245 1.00 0.00 NA TER 79348 Na+ 2239 ATOM 79348 Na+ Na+ 2240 5.854 77.109 59.404 1.00 0.00 NA TER 79349 Na+ 2240 ATOM 79349 Na+ Na+ 2241 84.510 84.605 120.343 1.00 0.00 NA TER 79350 Na+ 2241 ATOM 79350 Na+ Na+ 2242 103.081 34.377 62.266 1.00 0.00 NA TER 79351 Na+ 2242 ATOM 79351 Na+ Na+ 2243 1.541 99.768 19.533 1.00 0.00 NA TER 79352 Na+ 2243 ATOM 79352 Na+ Na+ 2244 126.506 44.812 17.561 1.00 0.00 NA TER 79353 Na+ 2244 ATOM 79353 Na+ Na+ 2245 135.734 95.077 104.104 1.00 0.00 NA TER 79354 Na+ 2245 ATOM 79354 Na+ Na+ 2246 125.200 70.789 60.309 1.00 0.00 NA TER 79355 Na+ 2246 ATOM 79355 Na+ Na+ 2247 99.819 141.307 17.930 1.00 0.00 NA TER 79356 Na+ 2247 ATOM 79356 Na+ Na+ 2248 145.119 130.831 121.559 1.00 0.00 NA TER 79357 Na+ 2248 ATOM 79357 Na+ Na+ 2249 29.037 26.331 23.136 1.00 0.00 NA TER 79358 Na+ 2249 ATOM 79358 Na+ Na+ 2250 63.955 80.583 23.208 1.00 0.00 NA TER 79359 Na+ 2250 ATOM 79359 Na+ Na+ 2251 35.726 12.692 21.544 1.00 0.00 NA TER 79360 Na+ 2251 ATOM 79360 Na+ Na+ 2252 105.196 1.026 55.388 1.00 0.00 NA TER 79361 Na+ 2252 ATOM 79361 Na+ Na+ 2253 14.880 26.075 71.465 1.00 0.00 NA TER 79362 Na+ 2253 ATOM 79362 Na+ Na+ 2254 24.131 107.572 22.677 1.00 0.00 NA TER 79363 Na+ 2254 ATOM 79363 Na+ Na+ 2255 51.271 136.991 16.665 1.00 0.00 NA TER 79364 Na+ 2255 ATOM 79364 Na+ Na+ 2256 64.066 74.959 60.729 1.00 0.00 NA TER 79365 Na+ 2256 ATOM 79365 Na+ Na+ 2257 101.609 121.602 17.355 1.00 0.00 NA TER 79366 Na+ 2257 ATOM 79366 Na+ Na+ 2258 54.612 142.702 15.968 1.00 0.00 NA TER 79367 Na+ 2258 ATOM 79367 Na+ Na+ 2259 25.772 145.476 18.717 1.00 0.00 NA TER 79368 Na+ 2259 ATOM 79368 Na+ Na+ 2260 64.234 22.217 58.696 1.00 0.00 NA TER 79369 Na+ 2260 ATOM 79369 Na+ Na+ 2261 25.347 16.967 96.830 1.00 0.00 NA TER 79370 Na+ 2261 ATOM 79370 Na+ Na+ 2262 139.583 107.382 29.789 1.00 0.00 NA TER 79371 Na+ 2262 ATOM 79371 Na+ Na+ 2263 65.868 14.599 21.817 1.00 0.00 NA TER 79372 Na+ 2263 ATOM 79372 Na+ Na+ 2264 37.331 49.250 21.981 1.00 0.00 NA TER 79373 Na+ 2264 ATOM 79373 Na+ Na+ 2265 71.704 18.720 57.200 1.00 0.00 NA TER 79374 Na+ 2265 ATOM 79374 Na+ Na+ 2266 124.018 100.245 22.463 1.00 0.00 NA TER 79375 Na+ 2266 ATOM 79375 Na+ Na+ 2267 48.606 90.337 58.497 1.00 0.00 NA TER 79376 Na+ 2267 ATOM 79376 Na+ Na+ 2268 21.273 72.220 21.283 1.00 0.00 NA TER 79377 Na+ 2268 ATOM 79377 Na+ Na+ 2269 48.035 3.347 67.219 1.00 0.00 NA TER 79378 Na+ 2269 ATOM 79378 Na+ Na+ 2270 131.162 5.273 16.041 1.00 0.00 NA TER 79379 Na+ 2270 ATOM 79379 Na+ Na+ 2271 133.783 39.213 59.844 1.00 0.00 NA TER 79380 Na+ 2271 ATOM 79380 Na+ Na+ 2272 68.382 0.301 18.051 1.00 0.00 NA TER 79381 Na+ 2272 ATOM 79381 Na+ Na+ 2273 12.403 37.455 16.119 1.00 0.00 NA TER 79382 Na+ 2273 ATOM 79382 Na+ Na+ 2274 118.061 145.742 21.381 1.00 0.00 NA TER 79383 Na+ 2274 ATOM 79383 Na+ Na+ 2275 45.312 56.303 54.976 1.00 0.00 NA TER 79384 Na+ 2275 ATOM 79384 Na+ Na+ 2276 89.301 143.831 19.093 1.00 0.00 NA TER 79385 Na+ 2276 ATOM 79385 Na+ Na+ 2277 113.147 97.134 59.707 1.00 0.00 NA TER 79386 Na+ 2277 ATOM 79386 Na+ Na+ 2278 34.591 2.206 83.165 1.00 0.00 NA TER 79387 Na+ 2278 ATOM 79387 Na+ Na+ 2279 91.939 1.852 58.718 1.00 0.00 NA TER 79388 Na+ 2279 ATOM 79388 Na+ Na+ 2280 84.017 114.916 22.420 1.00 0.00 NA TER 79389 Na+ 2280 ATOM 79389 Na+ Na+ 2281 126.252 19.763 59.329 1.00 0.00 NA TER 79390 Na+ 2281 ATOM 79390 Na+ Na+ 2282 46.979 96.322 25.434 1.00 0.00 NA TER 79391 Na+ 2282 ATOM 79391 Na+ Na+ 2283 15.638 140.727 61.739 1.00 0.00 NA TER 79392 Na+ 2283 ATOM 79392 Na+ Na+ 2284 126.473 118.699 83.980 1.00 0.00 NA TER 79393 Na+ 2284 ATOM 79393 Na+ Na+ 2285 49.398 34.605 60.147 1.00 0.00 NA TER 79394 Na+ 2285 ATOM 79394 Na+ Na+ 2286 79.740 76.416 24.858 1.00 0.00 NA TER 79395 Na+ 2286 ATOM 79395 Na+ Na+ 2287 46.835 45.042 58.288 1.00 0.00 NA TER 79396 Na+ 2287 ATOM 79396 Na+ Na+ 2288 72.359 119.921 18.862 1.00 0.00 NA TER 79397 Na+ 2288 ATOM 79397 Na+ Na+ 2289 45.930 86.849 65.422 1.00 0.00 NA TER 79398 Na+ 2289 ATOM 79398 Na+ Na+ 2290 40.142 70.242 4.758 1.00 0.00 NA TER 79399 Na+ 2290 ATOM 79399 Na+ Na+ 2291 20.541 95.573 61.111 1.00 0.00 NA TER 79400 Na+ 2291 ATOM 79400 Na+ Na+ 2292 113.620 56.714 9.987 1.00 0.00 NA TER 79401 Na+ 2292 ATOM 79401 Na+ Na+ 2293 45.894 30.857 144.489 1.00 0.00 NA TER 79402 Na+ 2293 ATOM 79402 Na+ Na+ 2294 142.154 104.856 67.919 1.00 0.00 NA TER 79403 Na+ 2294 ATOM 79403 Na+ Na+ 2295 21.909 33.617 27.661 1.00 0.00 NA TER 79404 Na+ 2295 ATOM 79404 Na+ Na+ 2296 140.931 23.346 22.345 1.00 0.00 NA TER 79405 Na+ 2296 ATOM 79405 Na+ Na+ 2297 145.811 58.217 90.503 1.00 0.00 NA TER 79406 Na+ 2297 ATOM 79406 Na+ Na+ 2298 78.405 119.274 17.669 1.00 0.00 NA TER 79407 Na+ 2298 ATOM 79407 Na+ Na+ 2299 9.141 84.403 59.458 1.00 0.00 NA TER 79408 Na+ 2299 ATOM 79408 Na+ Na+ 2300 16.967 40.913 65.694 1.00 0.00 NA TER 79409 Na+ 2300 ATOM 79409 Na+ Na+ 2301 32.980 120.281 65.871 1.00 0.00 NA TER 79410 Na+ 2301 ATOM 79410 Na+ Na+ 2302 76.843 95.849 20.271 1.00 0.00 NA TER 79411 Na+ 2302 ATOM 79411 Na+ Na+ 2303 15.900 58.713 154.258 1.00 0.00 NA TER 79412 Na+ 2303 ATOM 79412 Na+ Na+ 2304 83.725 122.878 62.243 1.00 0.00 NA TER 79413 Na+ 2304 ATOM 79413 Na+ Na+ 2305 97.268 112.461 14.194 1.00 0.00 NA TER 79414 Na+ 2305 ATOM 79414 Na+ Na+ 2306 98.324 70.889 18.149 1.00 0.00 NA TER 79415 Na+ 2306 ATOM 79415 Na+ Na+ 2307 131.510 137.423 63.183 1.00 0.00 NA TER 79416 Na+ 2307 ATOM 79416 Na+ Na+ 2308 0.475 78.566 59.806 1.00 0.00 NA TER 79417 Na+ 2308 ATOM 79417 Na+ Na+ 2309 29.510 68.842 18.570 1.00 0.00 NA TER 79418 Na+ 2309 ATOM 79418 Na+ Na+ 2310 77.707 27.522 16.781 1.00 0.00 NA TER 79419 Na+ 2310 ATOM 79419 Na+ Na+ 2311 17.318 0.939 100.595 1.00 0.00 NA TER 79420 Na+ 2311 ATOM 79420 Na+ Na+ 2312 77.761 42.634 22.428 1.00 0.00 NA TER 79421 Na+ 2312 ATOM 79421 Na+ Na+ 2313 142.023 105.017 1.217 1.00 0.00 NA TER 79422 Na+ 2313 ATOM 79422 Na+ Na+ 2314 59.476 105.549 147.816 1.00 0.00 NA TER 79423 Na+ 2314 ATOM 79423 Na+ Na+ 2315 68.365 143.416 52.859 1.00 0.00 NA TER 79424 Na+ 2315 ATOM 79424 Na+ Na+ 2316 50.450 81.870 63.811 1.00 0.00 NA TER 79425 Na+ 2316 ATOM 79425 Na+ Na+ 2317 33.818 74.801 62.254 1.00 0.00 NA TER 79426 Na+ 2317 ATOM 79426 Na+ Na+ 2318 22.760 52.676 112.821 1.00 0.00 NA TER 79427 Na+ 2318 ATOM 79427 Na+ Na+ 2319 107.836 54.172 23.195 1.00 0.00 NA TER 79428 Na+ 2319 ATOM 79428 Na+ Na+ 2320 139.147 26.870 109.812 1.00 0.00 NA TER 79429 Na+ 2320 ATOM 79429 Na+ Na+ 2321 10.709 74.283 23.378 1.00 0.00 NA TER 79430 Na+ 2321 ATOM 79430 Na+ Na+ 2322 95.098 121.114 20.755 1.00 0.00 NA TER 79431 Na+ 2322 ATOM 79431 Na+ Na+ 2323 129.346 110.988 60.523 1.00 0.00 NA TER 79432 Na+ 2323 ATOM 79432 Na+ Na+ 2324 83.533 91.858 58.961 1.00 0.00 NA TER 79433 Na+ 2324 ATOM 79433 Na+ Na+ 2325 90.846 10.933 105.423 1.00 0.00 NA TER 79434 Na+ 2325 ATOM 79434 Na+ Na+ 2326 109.307 134.395 76.183 1.00 0.00 NA TER 79435 Na+ 2326 ATOM 79435 Na+ Na+ 2327 129.983 116.546 21.819 1.00 0.00 NA TER 79436 Na+ 2327 ATOM 79436 Na+ Na+ 2328 77.349 140.627 62.674 1.00 0.00 NA TER 79437 Na+ 2328 ATOM 79437 Na+ Na+ 2329 88.177 89.403 64.611 1.00 0.00 NA TER 79438 Na+ 2329 ATOM 79438 Na+ Na+ 2330 127.292 142.205 68.627 1.00 0.00 NA TER 79439 Na+ 2330 ATOM 79439 Na+ Na+ 2331 93.192 11.751 17.461 1.00 0.00 NA TER 79440 Na+ 2331 ATOM 79440 Na+ Na+ 2332 98.329 36.150 23.983 1.00 0.00 NA TER 79441 Na+ 2332 ATOM 79441 Na+ Na+ 2333 24.962 11.086 21.321 1.00 0.00 NA TER 79442 Na+ 2333 ATOM 79442 Na+ Na+ 2334 49.033 116.848 63.518 1.00 0.00 NA TER 79443 Na+ 2334 ATOM 79443 Na+ Na+ 2335 94.807 98.105 152.450 1.00 0.00 NA TER 79444 Na+ 2335 ATOM 79444 Na+ Na+ 2336 95.901 1.729 19.712 1.00 0.00 NA TER 79445 Na+ 2336 ATOM 79445 Na+ Na+ 2337 28.431 142.737 18.917 1.00 0.00 NA TER 79446 Na+ 2337 ATOM 79446 Na+ Na+ 2338 1.493 142.130 59.551 1.00 0.00 NA TER 79447 Na+ 2338 ATOM 79447 Na+ Na+ 2339 138.778 92.937 65.590 1.00 0.00 NA TER 79448 Na+ 2339 ATOM 79448 Na+ Na+ 2340 68.110 128.510 56.581 1.00 0.00 NA TER 79449 Na+ 2340 ATOM 79449 Na+ Na+ 2341 109.621 44.302 57.364 1.00 0.00 NA TER 79450 Na+ 2341 ATOM 79450 Na+ Na+ 2342 69.989 9.984 2.709 1.00 0.00 NA TER 79451 Na+ 2342 ATOM 79451 Na+ Na+ 2343 68.383 83.214 88.876 1.00 0.00 NA TER 79452 Na+ 2343 ATOM 79452 Na+ Na+ 2344 12.966 77.259 3.372 1.00 0.00 NA TER 79453 Na+ 2344 ATOM 79453 Na+ Na+ 2345 125.555 61.499 18.215 1.00 0.00 NA TER 79454 Na+ 2345 ATOM 79454 Na+ Na+ 2346 34.002 39.590 0.412 1.00 0.00 NA TER 79455 Na+ 2346 ATOM 79455 Na+ Na+ 2347 59.659 34.819 57.283 1.00 0.00 NA TER 79456 Na+ 2347 ATOM 79456 Na+ Na+ 2348 71.018 110.969 24.263 1.00 0.00 NA TER 79457 Na+ 2348 ATOM 79457 Na+ Na+ 2349 116.375 100.702 20.978 1.00 0.00 NA TER 79458 Na+ 2349 ATOM 79458 Na+ Na+ 2350 83.303 54.349 66.006 1.00 0.00 NA TER 79459 Na+ 2350 ATOM 79459 Na+ Na+ 2351 6.630 143.178 57.103 1.00 0.00 NA TER 79460 Na+ 2351 ATOM 79460 Na+ Na+ 2352 91.273 144.226 54.336 1.00 0.00 NA TER 79461 Na+ 2352 ATOM 79461 Na+ Na+ 2353 39.951 82.202 64.732 1.00 0.00 NA TER 79462 Na+ 2353 ATOM 79462 Na+ Na+ 2354 24.292 34.522 64.956 1.00 0.00 NA TER 79463 Na+ 2354 ATOM 79463 Na+ Na+ 2355 57.759 118.744 88.765 1.00 0.00 NA TER 79464 Na+ 2355 ATOM 79464 Na+ Na+ 2356 115.564 81.935 20.277 1.00 0.00 NA TER 79465 Na+ 2356 ATOM 79465 Na+ Na+ 2357 8.246 39.747 67.102 1.00 0.00 NA TER 79466 Na+ 2357 ATOM 79466 Na+ Na+ 2358 111.260 2.364 101.445 1.00 0.00 NA TER 79467 Na+ 2358 ATOM 79467 Na+ Na+ 2359 87.674 144.202 81.357 1.00 0.00 NA TER 79468 Na+ 2359 ATOM 79468 Na+ Na+ 2360 62.739 2.375 97.909 1.00 0.00 NA TER 79469 Na+ 2360 ATOM 79469 Na+ Na+ 2361 44.254 31.871 61.727 1.00 0.00 NA TER 79470 Na+ 2361 ATOM 79470 Na+ Na+ 2362 85.878 101.545 102.781 1.00 0.00 NA TER 79471 Na+ 2362 ATOM 79471 Na+ Na+ 2363 69.903 83.836 62.062 1.00 0.00 NA TER 79472 Na+ 2363 ATOM 79472 Na+ Na+ 2364 130.658 49.939 22.374 1.00 0.00 NA TER 79473 Na+ 2364 ATOM 79473 Na+ Na+ 2365 40.486 96.208 155.438 1.00 0.00 NA TER 79474 Na+ 2365 ATOM 79474 Na+ Na+ 2366 86.406 39.094 101.801 1.00 0.00 NA TER 79475 Na+ 2366 ATOM 79475 Na+ Na+ 2367 116.328 79.526 13.563 1.00 0.00 NA TER 79476 Na+ 2367 ATOM 79476 Na+ Na+ 2368 16.696 10.265 19.733 1.00 0.00 NA TER 79477 Na+ 2368 ATOM 79477 Na+ Na+ 2369 137.683 21.278 16.286 1.00 0.00 NA TER 79478 Na+ 2369 ATOM 79478 Na+ Na+ 2370 145.835 53.886 140.174 1.00 0.00 NA TER 79479 Na+ 2370 ATOM 79479 Na+ Na+ 2371 145.675 122.421 59.165 1.00 0.00 NA TER 79480 Na+ 2371 ATOM 79480 Na+ Na+ 2372 1.764 13.094 62.513 1.00 0.00 NA TER 79481 Na+ 2372 ATOM 79481 Na+ Na+ 2373 144.355 132.954 157.402 1.00 0.00 NA TER 79482 Na+ 2373 ATOM 79482 Na+ Na+ 2374 70.083 129.072 54.000 1.00 0.00 NA TER 79483 Na+ 2374 ATOM 79483 Na+ Na+ 2375 97.903 100.217 20.225 1.00 0.00 NA TER 79484 Na+ 2375 ATOM 79484 Na+ Na+ 2376 144.790 100.526 121.870 1.00 0.00 NA TER 79485 Na+ 2376 ATOM 79485 Na+ Na+ 2377 52.848 2.432 52.247 1.00 0.00 NA TER 79486 Na+ 2377 ATOM 79486 Na+ Na+ 2378 128.396 35.099 17.712 1.00 0.00 NA TER 79487 Na+ 2378 ATOM 79487 Na+ Na+ 2379 111.455 121.621 17.636 1.00 0.00 NA TER 79488 Na+ 2379 ATOM 79488 Na+ Na+ 2380 103.624 100.823 26.060 1.00 0.00 NA TER 79489 Na+ 2380 ATOM 79489 Na+ Na+ 2381 145.512 139.470 21.288 1.00 0.00 NA TER 79490 Na+ 2381 ATOM 79490 Na+ Na+ 2382 100.104 144.789 19.338 1.00 0.00 NA TER 79491 Na+ 2382 ATOM 79491 Na+ Na+ 2383 12.084 18.014 24.843 1.00 0.00 NA TER 79492 Na+ 2383 ATOM 79492 Na+ Na+ 2384 28.533 87.923 22.263 1.00 0.00 NA TER 79493 Na+ 2384 ATOM 79493 Na+ Na+ 2385 116.625 141.522 155.171 1.00 0.00 NA TER 79494 Na+ 2385 ATOM 79494 Na+ Na+ 2386 126.292 145.775 56.159 1.00 0.00 NA TER 79495 Na+ 2386 ATOM 79495 Na+ Na+ 2387 121.637 16.051 21.422 1.00 0.00 NA TER 79496 Na+ 2387 ATOM 79496 Na+ Na+ 2388 98.344 120.357 60.581 1.00 0.00 NA TER 79497 Na+ 2388 ATOM 79497 Na+ Na+ 2389 43.649 17.804 61.784 1.00 0.00 NA TER 79498 Na+ 2389 ATOM 79498 Na+ Na+ 2390 61.987 133.290 56.197 1.00 0.00 NA TER 79499 Na+ 2390 ATOM 79499 Na+ Na+ 2391 115.108 103.306 66.454 1.00 0.00 NA TER 79500 Na+ 2391 ATOM 79500 Na+ Na+ 2392 82.300 49.151 57.074 1.00 0.00 NA TER 79501 Na+ 2392 ATOM 79501 Na+ Na+ 2393 72.811 85.260 118.769 1.00 0.00 NA TER 79502 Na+ 2393 ATOM 79502 Na+ Na+ 2394 98.025 57.752 86.491 1.00 0.00 NA TER 79503 Na+ 2394 ATOM 79503 Na+ Na+ 2395 83.771 84.511 60.306 1.00 0.00 NA TER 79504 Na+ 2395 ATOM 79504 Na+ Na+ 2396 21.468 132.509 17.041 1.00 0.00 NA TER 79505 Na+ 2396 ATOM 79505 Na+ Na+ 2397 39.498 41.561 61.294 1.00 0.00 NA TER 79506 Na+ 2397 ATOM 79506 Cl- Cl- 2398 44.882 27.213 116.052 1.00 0.00 CL TER 79507 Cl- 2398 ATOM 79507 Cl- Cl- 2399 109.494 116.808 72.303 1.00 0.00 CL TER 79508 Cl- 2399 ATOM 79508 Cl- Cl- 2400 18.368 118.049 99.618 1.00 0.00 CL TER 79509 Cl- 2400 ATOM 79509 Cl- Cl- 2401 33.380 135.710 88.165 1.00 0.00 CL TER 79510 Cl- 2401 ATOM 79510 Cl- Cl- 2402 145.730 49.434 109.201 1.00 0.00 CL TER 79511 Cl- 2402 ATOM 79511 Cl- Cl- 2403 15.723 96.295 98.660 1.00 0.00 CL TER 79512 Cl- 2403 ATOM 79512 Cl- Cl- 2404 113.170 63.022 5.413 1.00 0.00 CL TER 79513 Cl- 2404 ATOM 79513 Cl- Cl- 2405 25.385 30.953 155.220 1.00 0.00 CL TER 79514 Cl- 2405 ATOM 79514 Cl- Cl- 2406 122.080 69.021 84.115 1.00 0.00 CL TER 79515 Cl- 2406 ATOM 79515 Cl- Cl- 2407 29.088 52.562 77.482 1.00 0.00 CL TER 79516 Cl- 2407 ATOM 79516 Cl- Cl- 2408 40.139 110.690 155.454 1.00 0.00 CL TER 79517 Cl- 2408 ATOM 79517 Cl- Cl- 2409 105.395 51.230 108.418 1.00 0.00 CL TER 79518 Cl- 2409 ATOM 79518 Cl- Cl- 2410 16.675 136.397 93.946 1.00 0.00 CL TER 79519 Cl- 2410 ATOM 79519 Cl- Cl- 2411 36.298 38.008 71.196 1.00 0.00 CL TER 79520 Cl- 2411 ATOM 79520 Cl- Cl- 2412 49.177 87.606 141.353 1.00 0.00 CL TER 79521 Cl- 2412 ATOM 79521 Cl- Cl- 2413 70.438 44.236 127.874 1.00 0.00 CL TER 79522 Cl- 2413 ATOM 79522 Cl- Cl- 2414 103.149 99.712 151.174 1.00 0.00 CL TER 79523 Cl- 2414 ATOM 79523 Cl- Cl- 2415 110.572 88.559 152.387 1.00 0.00 CL TER 79524 Cl- 2415 ATOM 79524 Cl- Cl- 2416 117.901 38.111 153.866 1.00 0.00 CL TER 79525 Cl- 2416 ATOM 79525 Cl- Cl- 2417 98.075 17.193 99.454 1.00 0.00 CL TER 79526 Cl- 2417 ATOM 79526 Cl- Cl- 2418 74.373 22.930 88.006 1.00 0.00 CL TER 79527 Cl- 2418 ATOM 79527 Cl- Cl- 2419 76.238 68.444 75.858 1.00 0.00 CL TER 79528 Cl- 2419 ATOM 79528 Cl- Cl- 2420 75.930 108.922 132.762 1.00 0.00 CL TER 79529 Cl- 2420 ATOM 79529 Cl- Cl- 2421 110.207 136.201 118.722 1.00 0.00 CL TER 79530 Cl- 2421 ATOM 79530 Cl- Cl- 2422 14.945 130.400 8.724 1.00 0.00 CL TER 79531 Cl- 2422 ATOM 79531 Cl- Cl- 2423 65.104 73.585 115.618 1.00 0.00 CL TER 79532 Cl- 2423 ATOM 79532 Cl- Cl- 2424 108.104 66.909 147.662 1.00 0.00 CL TER 79533 Cl- 2424 ATOM 79533 Cl- Cl- 2425 108.893 26.424 118.058 1.00 0.00 CL TER 79534 Cl- 2425 ATOM 79534 Cl- Cl- 2426 5.433 24.300 104.680 1.00 0.00 CL TER 79535 Cl- 2426 ATOM 79535 Cl- Cl- 2427 45.948 20.496 96.731 1.00 0.00 CL TER 79536 Cl- 2427 ATOM 79536 Cl- Cl- 2428 50.113 15.010 78.748 1.00 0.00 CL TER 79537 Cl- 2428 ATOM 79537 Cl- Cl- 2429 83.324 103.674 108.320 1.00 0.00 CL TER 79538 Cl- 2429 ATOM 79538 Cl- Cl- 2430 144.286 11.332 88.904 1.00 0.00 CL TER 79539 Cl- 2430 ATOM 79539 Cl- Cl- 2431 0.615 64.375 107.459 1.00 0.00 CL TER 79540 Cl- 2431 ATOM 79540 Cl- Cl- 2432 53.520 65.078 103.760 1.00 0.00 CL TER 79541 Cl- 2432 ATOM 79541 Cl- Cl- 2433 115.615 35.139 135.988 1.00 0.00 CL TER 79542 Cl- 2433 ATOM 79542 Cl- Cl- 2434 134.093 91.208 88.762 1.00 0.00 CL TER 79543 Cl- 2434 ATOM 79543 Cl- Cl- 2435 98.419 117.491 133.225 1.00 0.00 CL TER 79544 Cl- 2435 ATOM 79544 Cl- Cl- 2436 2.333 106.694 131.314 1.00 0.00 CL TER 79545 Cl- 2436 ATOM 79545 Cl- Cl- 2437 104.644 140.120 100.527 1.00 0.00 CL TER 79546 Cl- 2437 ATOM 79546 Cl- Cl- 2438 113.234 56.608 150.197 1.00 0.00 CL TER 79547 Cl- 2438 ATOM 79547 Cl- Cl- 2439 28.944 18.000 90.701 1.00 0.00 CL TER 79548 Cl- 2439 ATOM 79548 Cl- Cl- 2440 111.789 7.507 118.266 1.00 0.00 CL TER 79549 Cl- 2440 ATOM 79549 Cl- Cl- 2441 86.895 55.943 70.291 1.00 0.00 CL TER 79550 Cl- 2441 ATOM 79550 Cl- Cl- 2442 23.925 30.254 3.267 1.00 0.00 CL TER 79551 Cl- 2442 ATOM 79551 Cl- Cl- 2443 67.660 14.838 142.066 1.00 0.00 CL TER 79552 Cl- 2443 ATOM 79552 Cl- Cl- 2444 60.069 109.146 99.239 1.00 0.00 CL TER 79553 Cl- 2444 ATOM 79553 Cl- Cl- 2445 132.484 5.093 127.871 1.00 0.00 CL TER 79554 Cl- 2445 ATOM 79554 Cl- Cl- 2446 29.838 117.024 16.278 1.00 0.00 CL TER 79555 Cl- 2446 ATOM 79555 Cl- Cl- 2447 33.689 13.223 131.675 1.00 0.00 CL TER 79556 Cl- 2447 ATOM 79556 Cl- Cl- 2448 64.801 8.735 18.244 1.00 0.00 CL TER 79557 Cl- 2448 ATOM 79557 Cl- Cl- 2449 14.032 54.838 146.358 1.00 0.00 CL TER 79558 Cl- 2449 ATOM 79558 Cl- Cl- 2450 125.893 39.174 141.231 1.00 0.00 CL TER 79559 Cl- 2450 ATOM 79559 Cl- Cl- 2451 82.626 97.397 94.258 1.00 0.00 CL TER 79560 Cl- 2451 ATOM 79560 Cl- Cl- 2452 50.098 5.834 64.774 1.00 0.00 CL TER 79561 Cl- 2452 ATOM 79561 Cl- Cl- 2453 74.323 74.288 70.842 1.00 0.00 CL TER 79562 Cl- 2453 ATOM 79562 Cl- Cl- 2454 13.086 96.022 87.960 1.00 0.00 CL TER 79563 Cl- 2454 ATOM 79563 Cl- Cl- 2455 45.608 102.998 114.485 1.00 0.00 CL TER 79564 Cl- 2455 ATOM 79564 Cl- Cl- 2456 58.489 139.390 116.933 1.00 0.00 CL TER 79565 Cl- 2456 ATOM 79565 Cl- Cl- 2457 36.702 78.064 69.811 1.00 0.00 CL TER 79566 Cl- 2457 ATOM 79566 Cl- Cl- 2458 126.326 110.763 149.731 1.00 0.00 CL TER 79567 Cl- 2458 ATOM 79567 Cl- Cl- 2459 32.644 80.780 91.468 1.00 0.00 CL TER 79568 Cl- 2459 ATOM 79568 Cl- Cl- 2460 42.839 116.469 79.702 1.00 0.00 CL TER 79569 Cl- 2460 ATOM 79569 Cl- Cl- 2461 117.469 127.067 148.618 1.00 0.00 CL TER 79570 Cl- 2461 ATOM 79570 Cl- Cl- 2462 133.483 134.989 151.018 1.00 0.00 CL TER 79571 Cl- 2462 ATOM 79571 Cl- Cl- 2463 39.321 113.060 92.896 1.00 0.00 CL TER 79572 Cl- 2463 ATOM 79572 Cl- Cl- 2464 139.222 80.729 134.694 1.00 0.00 CL TER 79573 Cl- 2464 ATOM 79573 Cl- Cl- 2465 10.287 83.198 83.019 1.00 0.00 CL TER 79574 Cl- 2465 ATOM 79574 Cl- Cl- 2466 26.748 9.945 121.113 1.00 0.00 CL TER 79575 Cl- 2466 ATOM 79575 Cl- Cl- 2467 41.453 65.181 77.814 1.00 0.00 CL TER 79576 Cl- 2467 ATOM 79576 Cl- Cl- 2468 137.176 47.005 139.897 1.00 0.00 CL TER 79577 Cl- 2468 ATOM 79577 Cl- Cl- 2469 93.810 78.804 16.489 1.00 0.00 CL TER 79578 Cl- 2469 ATOM 79578 Cl- Cl- 2470 91.203 4.836 130.052 1.00 0.00 CL TER 79579 Cl- 2470 ATOM 79579 Cl- Cl- 2471 71.188 143.350 100.148 1.00 0.00 CL TER 79580 Cl- 2471 ATOM 79580 Cl- Cl- 2472 92.850 89.646 5.320 1.00 0.00 CL TER 79581 Cl- 2472 ATOM 79581 Cl- Cl- 2473 57.434 26.371 88.096 1.00 0.00 CL TER 79582 Cl- 2473 ATOM 79582 Cl- Cl- 2474 4.091 108.822 90.250 1.00 0.00 CL TER 79583 Cl- 2474 ATOM 79583 Cl- Cl- 2475 112.825 112.914 141.633 1.00 0.00 CL TER 79584 Cl- 2475 ATOM 79584 Cl- Cl- 2476 2.858 113.622 152.657 1.00 0.00 CL TER 79585 Cl- 2476 ATOM 79585 O WAT 2477 93.058 1.650 60.788 1.00 0.00 O ATOM 79586 H1 WAT 2477 93.215 2.503 61.194 1.00 0.00 H ATOM 79587 H2 WAT 2477 93.863 1.157 60.947 1.00 0.00 H TER 79589 WAT 2477 ATOM 79589 O WAT 2478 65.363 81.478 103.845 1.00 0.00 O ATOM 79590 H1 WAT 2478 66.155 81.034 104.150 1.00 0.00 H ATOM 79591 H2 WAT 2478 65.292 82.251 104.405 1.00 0.00 H TER 79593 WAT 2478 ATOM 79593 O WAT 2479 97.158 19.710 112.340 1.00 0.00 O ATOM 79594 H1 WAT 2479 96.782 18.881 112.637 1.00 0.00 H ATOM 79595 H2 WAT 2479 97.904 19.855 112.921 1.00 0.00 H TER 79597 WAT 2479 ATOM 79597 O WAT 2480 82.771 87.072 152.831 1.00 0.00 O ATOM 79598 H1 WAT 2480 83.471 87.453 152.300 1.00 0.00 H ATOM 79599 H2 WAT 2480 82.799 87.565 153.651 1.00 0.00 H TER 79601 WAT 2480 ATOM 79601 O WAT 2481 120.227 70.863 7.069 1.00 0.00 O ATOM 79602 H1 WAT 2481 119.870 70.244 7.706 1.00 0.00 H ATOM 79603 H2 WAT 2481 119.634 71.613 7.105 1.00 0.00 H TER 79605 WAT 2481 ATOM 79605 O WAT 2482 75.001 46.075 147.235 1.00 0.00 O ATOM 79606 H1 WAT 2482 75.378 46.148 148.112 1.00 0.00 H ATOM 79607 H2 WAT 2482 74.130 45.706 147.379 1.00 0.00 H TER 79609 WAT 2482 ATOM 79609 O WAT 2483 72.856 76.617 84.242 1.00 0.00 O ATOM 79610 H1 WAT 2483 73.105 75.945 83.608 1.00 0.00 H ATOM 79611 H2 WAT 2483 72.871 77.434 83.744 1.00 0.00 H TER 79613 WAT 2483 ATOM 79613 O WAT 2484 82.730 97.353 111.255 1.00 0.00 O ATOM 79614 H1 WAT 2484 82.053 97.135 111.896 1.00 0.00 H ATOM 79615 H2 WAT 2484 83.554 97.211 111.720 1.00 0.00 H TER 79617 WAT 2484 ATOM 79617 O WAT 2485 99.681 49.144 4.401 1.00 0.00 O ATOM 79618 H1 WAT 2485 99.909 49.519 3.550 1.00 0.00 H ATOM 79619 H2 WAT 2485 100.155 49.682 5.034 1.00 0.00 H TER 79621 WAT 2485 ATOM 79621 O WAT 2486 81.793 50.444 15.553 1.00 0.00 O ATOM 79622 H1 WAT 2486 80.924 50.611 15.919 1.00 0.00 H ATOM 79623 H2 WAT 2486 82.133 49.712 16.067 1.00 0.00 H TER 79625 WAT 2486 ATOM 79625 O WAT 2487 123.994 86.985 144.355 1.00 0.00 O ATOM 79626 H1 WAT 2487 123.972 86.484 145.169 1.00 0.00 H ATOM 79627 H2 WAT 2487 124.822 87.465 144.391 1.00 0.00 H TER 79629 WAT 2487 ATOM 79629 O WAT 2488 121.564 8.667 116.318 1.00 0.00 O ATOM 79630 H1 WAT 2488 121.650 9.550 116.676 1.00 0.00 H ATOM 79631 H2 WAT 2488 121.412 8.112 117.083 1.00 0.00 H TER 79633 WAT 2488 ATOM 79633 O WAT 2489 4.916 3.291 74.457 1.00 0.00 O ATOM 79634 H1 WAT 2489 5.366 2.710 75.071 1.00 0.00 H ATOM 79635 H2 WAT 2489 4.766 4.095 74.954 1.00 0.00 H TER 79637 WAT 2489 ATOM 79637 O WAT 2490 9.615 92.674 96.035 1.00 0.00 O ATOM 79638 H1 WAT 2490 8.910 92.062 95.826 1.00 0.00 H ATOM 79639 H2 WAT 2490 10.157 92.208 96.672 1.00 0.00 H TER 79641 WAT 2490 ATOM 79641 O WAT 2491 109.373 59.508 109.698 1.00 0.00 O ATOM 79642 H1 WAT 2491 109.139 58.600 109.891 1.00 0.00 H ATOM 79643 H2 WAT 2491 108.713 60.028 110.157 1.00 0.00 H TER 79645 WAT 2491 ATOM 79645 O WAT 2492 64.652 79.075 79.641 1.00 0.00 O ATOM 79646 H1 WAT 2492 63.909 79.629 79.403 1.00 0.00 H ATOM 79647 H2 WAT 2492 64.532 78.902 80.575 1.00 0.00 H TER 79649 WAT 2492 ATOM 79649 O WAT 2493 92.106 125.417 156.599 1.00 0.00 O ATOM 79650 H1 WAT 2493 91.531 126.139 156.851 1.00 0.00 H ATOM 79651 H2 WAT 2493 92.613 125.760 155.862 1.00 0.00 H TER 79653 WAT 2493 ATOM 79653 O WAT 2494 113.386 93.642 69.652 1.00 0.00 O ATOM 79654 H1 WAT 2494 113.501 93.102 70.434 1.00 0.00 H ATOM 79655 H2 WAT 2494 113.256 94.528 69.990 1.00 0.00 H TER 79657 WAT 2494 ATOM 79657 O WAT 2495 12.861 84.384 134.686 1.00 0.00 O ATOM 79658 H1 WAT 2495 11.953 84.083 134.650 1.00 0.00 H ATOM 79659 H2 WAT 2495 13.095 84.329 135.613 1.00 0.00 H TER 79661 WAT 2495 ATOM 79661 O WAT 2496 77.693 91.230 18.203 1.00 0.00 O ATOM 79662 H1 WAT 2496 77.701 90.460 18.772 1.00 0.00 H ATOM 79663 H2 WAT 2496 78.528 91.190 17.736 1.00 0.00 H TER 79665 WAT 2496 ATOM 79665 O WAT 2497 12.519 134.523 109.309 1.00 0.00 O ATOM 79666 H1 WAT 2497 12.815 135.409 109.102 1.00 0.00 H ATOM 79667 H2 WAT 2497 12.480 134.500 110.265 1.00 0.00 H TER 79669 WAT 2497 ATOM 79669 O WAT 2498 49.379 53.302 128.094 1.00 0.00 O ATOM 79670 H1 WAT 2498 49.259 53.306 129.043 1.00 0.00 H ATOM 79671 H2 WAT 2498 49.179 52.404 127.831 1.00 0.00 H TER 79673 WAT 2498 ATOM 79673 O WAT 2499 33.639 31.262 23.389 1.00 0.00 O ATOM 79674 H1 WAT 2499 33.293 31.992 23.903 1.00 0.00 H ATOM 79675 H2 WAT 2499 32.927 30.621 23.374 1.00 0.00 H TER 79677 WAT 2499 ATOM 79677 O WAT 2500 143.042 108.559 69.231 1.00 0.00 O ATOM 79678 H1 WAT 2500 142.686 108.005 68.537 1.00 0.00 H ATOM 79679 H2 WAT 2500 142.282 109.024 69.580 1.00 0.00 H TER 79681 WAT 2500 ATOM 79681 O WAT 2501 139.257 86.462 90.801 1.00 0.00 O ATOM 79682 H1 WAT 2501 139.099 87.318 91.200 1.00 0.00 H ATOM 79683 H2 WAT 2501 140.209 86.404 90.727 1.00 0.00 H TER 79685 WAT 2501 ATOM 79685 O WAT 2502 49.625 86.891 14.162 1.00 0.00 O ATOM 79686 H1 WAT 2502 49.918 85.986 14.060 1.00 0.00 H ATOM 79687 H2 WAT 2502 50.183 87.247 14.854 1.00 0.00 H TER 79689 WAT 2502 ATOM 79689 O WAT 2503 95.522 104.338 107.403 1.00 0.00 O ATOM 79690 H1 WAT 2503 96.119 104.137 108.124 1.00 0.00 H ATOM 79691 H2 WAT 2503 95.250 103.482 107.072 1.00 0.00 H TER 79693 WAT 2503 ATOM 79693 O WAT 2504 121.786 50.514 158.519 1.00 0.00 O ATOM 79694 H1 WAT 2504 120.897 50.500 158.874 1.00 0.00 H ATOM 79695 H2 WAT 2504 121.947 49.612 158.241 1.00 0.00 H TER 79697 WAT 2504 ATOM 79697 O WAT 2505 89.474 56.619 140.502 1.00 0.00 O ATOM 79698 H1 WAT 2505 89.559 57.421 141.018 1.00 0.00 H ATOM 79699 H2 WAT 2505 88.844 56.087 140.989 1.00 0.00 H TER 79701 WAT 2505 ATOM 79701 O WAT 2506 76.754 12.072 103.269 1.00 0.00 O ATOM 79702 H1 WAT 2506 76.919 11.623 102.440 1.00 0.00 H ATOM 79703 H2 WAT 2506 77.153 12.935 103.157 1.00 0.00 H TER 79705 WAT 2506 ATOM 79705 O WAT 2507 15.990 137.173 68.893 1.00 0.00 O ATOM 79706 H1 WAT 2507 15.962 137.943 69.461 1.00 0.00 H ATOM 79707 H2 WAT 2507 16.728 136.659 69.222 1.00 0.00 H TER 79709 WAT 2507 ATOM 79709 O WAT 2508 124.674 94.675 10.318 1.00 0.00 O ATOM 79710 H1 WAT 2508 125.233 94.055 10.786 1.00 0.00 H ATOM 79711 H2 WAT 2508 125.238 95.041 9.637 1.00 0.00 H TER 79713 WAT 2508 ATOM 79713 O WAT 2509 115.564 141.135 96.297 1.00 0.00 O ATOM 79714 H1 WAT 2509 114.742 140.672 96.139 1.00 0.00 H ATOM 79715 H2 WAT 2509 115.744 140.992 97.227 1.00 0.00 H TER 79717 WAT 2509 ATOM 79717 O WAT 2510 141.645 55.005 86.574 1.00 0.00 O ATOM 79718 H1 WAT 2510 140.752 54.827 86.868 1.00 0.00 H ATOM 79719 H2 WAT 2510 141.600 55.879 86.186 1.00 0.00 H TER 79721 WAT 2510 ATOM 79721 O WAT 2511 28.864 134.410 132.075 1.00 0.00 O ATOM 79722 H1 WAT 2511 28.514 134.094 132.909 1.00 0.00 H ATOM 79723 H2 WAT 2511 29.813 134.330 132.168 1.00 0.00 H TER 79725 WAT 2511 ATOM 79725 O WAT 2512 78.179 79.109 18.766 1.00 0.00 O ATOM 79726 H1 WAT 2512 78.575 79.675 19.428 1.00 0.00 H ATOM 79727 H2 WAT 2512 77.886 79.710 18.081 1.00 0.00 H TER 79729 WAT 2512 ATOM 79729 O WAT 2513 39.923 55.681 77.455 1.00 0.00 O ATOM 79730 H1 WAT 2513 39.097 55.721 76.972 1.00 0.00 H ATOM 79731 H2 WAT 2513 39.681 55.880 78.359 1.00 0.00 H TER 79733 WAT 2513 ATOM 79733 O WAT 2514 90.621 25.003 0.501 1.00 0.00 O ATOM 79734 H1 WAT 2514 90.750 25.489 1.316 1.00 0.00 H ATOM 79735 H2 WAT 2514 90.828 24.096 0.727 1.00 0.00 H TER 79737 WAT 2514 ATOM 79737 O WAT 2515 15.044 131.224 13.531 1.00 0.00 O ATOM 79738 H1 WAT 2515 14.332 130.722 13.929 1.00 0.00 H ATOM 79739 H2 WAT 2515 14.708 131.475 12.670 1.00 0.00 H TER 79741 WAT 2515 ATOM 79741 O WAT 2516 20.554 98.074 92.000 1.00 0.00 O ATOM 79742 H1 WAT 2516 20.905 98.537 92.760 1.00 0.00 H ATOM 79743 H2 WAT 2516 20.015 97.376 92.372 1.00 0.00 H TER 79745 WAT 2516 ATOM 79745 O WAT 2517 73.997 86.392 156.026 1.00 0.00 O ATOM 79746 H1 WAT 2517 73.579 85.883 155.331 1.00 0.00 H ATOM 79747 H2 WAT 2517 74.890 86.537 155.714 1.00 0.00 H TER 79749 WAT 2517 ATOM 79749 O WAT 2518 127.879 87.500 30.696 1.00 0.00 O ATOM 79750 H1 WAT 2518 127.962 87.718 29.768 1.00 0.00 H ATOM 79751 H2 WAT 2518 128.764 87.255 30.965 1.00 0.00 H TER 79753 WAT 2518 ATOM 79753 O WAT 2519 143.690 85.678 101.770 1.00 0.00 O ATOM 79754 H1 WAT 2519 143.332 86.058 100.968 1.00 0.00 H ATOM 79755 H2 WAT 2519 142.926 85.337 102.235 1.00 0.00 H TER 79757 WAT 2519 ATOM 79757 O WAT 2520 6.521 32.249 68.934 1.00 0.00 O ATOM 79758 H1 WAT 2520 6.467 31.400 68.497 1.00 0.00 H ATOM 79759 H2 WAT 2520 5.672 32.351 69.365 1.00 0.00 H TER 79761 WAT 2520 ATOM 79761 O WAT 2521 112.489 126.971 121.662 1.00 0.00 O ATOM 79762 H1 WAT 2521 113.337 127.096 121.236 1.00 0.00 H ATOM 79763 H2 WAT 2521 112.606 127.333 122.541 1.00 0.00 H TER 79765 WAT 2521 ATOM 79765 O WAT 2522 7.442 119.326 91.430 1.00 0.00 O ATOM 79766 H1 WAT 2522 6.679 119.270 90.855 1.00 0.00 H ATOM 79767 H2 WAT 2522 8.054 118.679 91.079 1.00 0.00 H TER 79769 WAT 2522 ATOM 79769 O WAT 2523 52.046 121.622 49.564 1.00 0.00 O ATOM 79770 H1 WAT 2523 51.206 121.169 49.632 1.00 0.00 H ATOM 79771 H2 WAT 2523 51.819 122.506 49.275 1.00 0.00 H TER 79773 WAT 2523 ATOM 79773 O WAT 2524 114.343 99.941 112.577 1.00 0.00 O ATOM 79774 H1 WAT 2524 113.855 99.137 112.399 1.00 0.00 H ATOM 79775 H2 WAT 2524 114.277 100.056 113.525 1.00 0.00 H TER 79777 WAT 2524 ATOM 79777 O WAT 2525 26.684 69.150 52.505 1.00 0.00 O ATOM 79778 H1 WAT 2525 26.215 68.407 52.885 1.00 0.00 H ATOM 79779 H2 WAT 2525 26.305 69.251 51.632 1.00 0.00 H TER 79781 WAT 2525 ATOM 79781 O WAT 2526 11.149 25.331 82.381 1.00 0.00 O ATOM 79782 H1 WAT 2526 11.686 24.694 82.854 1.00 0.00 H ATOM 79783 H2 WAT 2526 11.651 25.525 81.589 1.00 0.00 H TER 79785 WAT 2526 ATOM 79785 O WAT 2527 39.141 99.890 101.690 1.00 0.00 O ATOM 79786 H1 WAT 2527 38.587 99.180 101.364 1.00 0.00 H ATOM 79787 H2 WAT 2527 39.369 99.625 102.581 1.00 0.00 H TER 79789 WAT 2527 ATOM 79789 O WAT 2528 9.461 31.226 64.027 1.00 0.00 O ATOM 79790 H1 WAT 2528 9.214 30.434 64.504 1.00 0.00 H ATOM 79791 H2 WAT 2528 8.827 31.282 63.312 1.00 0.00 H TER 79793 WAT 2528 ATOM 79793 O WAT 2529 15.332 24.913 65.947 1.00 0.00 O ATOM 79794 H1 WAT 2529 15.284 24.254 65.254 1.00 0.00 H ATOM 79795 H2 WAT 2529 16.251 25.178 65.962 1.00 0.00 H TER 79797 WAT 2529 ATOM 79797 O WAT 2530 127.302 100.989 70.554 1.00 0.00 O ATOM 79798 H1 WAT 2530 126.758 100.345 70.102 1.00 0.00 H ATOM 79799 H2 WAT 2530 126.949 101.019 71.444 1.00 0.00 H TER 79801 WAT 2530 ATOM 79801 O WAT 2531 71.796 98.643 120.486 1.00 0.00 O ATOM 79802 H1 WAT 2531 72.232 99.458 120.733 1.00 0.00 H ATOM 79803 H2 WAT 2531 71.611 98.208 121.318 1.00 0.00 H TER 79805 WAT 2531 ATOM 79805 O WAT 2532 68.521 139.306 3.543 1.00 0.00 O ATOM 79806 H1 WAT 2532 68.342 140.075 4.085 1.00 0.00 H ATOM 79807 H2 WAT 2532 68.417 138.564 4.138 1.00 0.00 H TER 79809 WAT 2532 ATOM 79809 O WAT 2533 42.117 64.693 136.414 1.00 0.00 O ATOM 79810 H1 WAT 2533 41.841 64.037 137.054 1.00 0.00 H ATOM 79811 H2 WAT 2533 42.505 65.392 136.939 1.00 0.00 H TER 79813 WAT 2533 ATOM 79813 O WAT 2534 101.118 124.036 17.611 1.00 0.00 O ATOM 79814 H1 WAT 2534 101.216 124.507 18.439 1.00 0.00 H ATOM 79815 H2 WAT 2534 100.334 124.414 17.212 1.00 0.00 H TER 79817 WAT 2534 ATOM 79817 O WAT 2535 82.412 61.715 129.618 1.00 0.00 O ATOM 79818 H1 WAT 2535 81.503 61.637 129.906 1.00 0.00 H ATOM 79819 H2 WAT 2535 82.823 60.897 129.896 1.00 0.00 H TER 79821 WAT 2535 ATOM 79821 O WAT 2536 18.661 8.820 104.730 1.00 0.00 O ATOM 79822 H1 WAT 2536 17.990 8.182 104.488 1.00 0.00 H ATOM 79823 H2 WAT 2536 19.291 8.789 104.010 1.00 0.00 H TER 79825 WAT 2536 ATOM 79825 O WAT 2537 13.939 131.926 11.105 1.00 0.00 O ATOM 79826 H1 WAT 2537 13.128 131.430 11.213 1.00 0.00 H ATOM 79827 H2 WAT 2537 14.373 131.515 10.357 1.00 0.00 H TER 79829 WAT 2537 ATOM 79829 O WAT 2538 37.682 47.209 60.681 1.00 0.00 O ATOM 79830 H1 WAT 2538 36.943 47.783 60.885 1.00 0.00 H ATOM 79831 H2 WAT 2538 38.452 47.699 60.969 1.00 0.00 H TER 79833 WAT 2538 ATOM 79833 O WAT 2539 95.652 115.065 134.482 1.00 0.00 O ATOM 79834 H1 WAT 2539 96.605 115.029 134.399 1.00 0.00 H ATOM 79835 H2 WAT 2539 95.461 115.989 134.643 1.00 0.00 H TER 79837 WAT 2539 ATOM 79837 O WAT 2540 72.089 44.347 85.542 1.00 0.00 O ATOM 79838 H1 WAT 2540 71.805 45.001 84.903 1.00 0.00 H ATOM 79839 H2 WAT 2540 71.332 43.770 85.646 1.00 0.00 H TER 79841 WAT 2540 ATOM 79841 O WAT 2541 6.657 79.784 60.639 1.00 0.00 O ATOM 79842 H1 WAT 2541 7.125 79.305 59.955 1.00 0.00 H ATOM 79843 H2 WAT 2541 5.917 80.188 60.185 1.00 0.00 H TER 79845 WAT 2541 ATOM 79845 O WAT 2542 16.874 57.667 73.401 1.00 0.00 O ATOM 79846 H1 WAT 2542 16.773 58.618 73.366 1.00 0.00 H ATOM 79847 H2 WAT 2542 16.204 57.332 72.805 1.00 0.00 H TER 79849 WAT 2542 ATOM 79849 O WAT 2543 10.457 115.347 126.254 1.00 0.00 O ATOM 79850 H1 WAT 2543 10.979 115.737 126.955 1.00 0.00 H ATOM 79851 H2 WAT 2543 10.475 115.997 125.552 1.00 0.00 H TER 79853 WAT 2543 ATOM 79853 O WAT 2544 31.537 8.164 68.389 1.00 0.00 O ATOM 79854 H1 WAT 2544 32.136 8.722 67.894 1.00 0.00 H ATOM 79855 H2 WAT 2544 31.469 7.363 67.869 1.00 0.00 H TER 79857 WAT 2544 ATOM 79857 O WAT 2545 125.271 35.033 94.989 1.00 0.00 O ATOM 79858 H1 WAT 2545 125.976 35.679 94.949 1.00 0.00 H ATOM 79859 H2 WAT 2545 125.559 34.328 94.408 1.00 0.00 H TER 79861 WAT 2545 ATOM 79861 O WAT 2546 138.331 70.410 109.456 1.00 0.00 O ATOM 79862 H1 WAT 2546 137.504 70.648 109.875 1.00 0.00 H ATOM 79863 H2 WAT 2546 139.001 70.640 110.100 1.00 0.00 H TER 79865 WAT 2546 ATOM 79865 O WAT 2547 145.679 94.116 103.118 1.00 0.00 O ATOM 79866 H1 WAT 2547 145.348 94.469 102.292 1.00 0.00 H ATOM 79867 H2 WAT 2547 146.627 94.072 102.996 1.00 0.00 H TER 79869 WAT 2547 ATOM 79869 O WAT 2548 110.635 124.642 72.770 1.00 0.00 O ATOM 79870 H1 WAT 2548 110.208 124.712 73.624 1.00 0.00 H ATOM 79871 H2 WAT 2548 110.889 125.539 72.556 1.00 0.00 H TER 79873 WAT 2548 ATOM 79873 O WAT 2549 63.171 93.551 53.201 1.00 0.00 O ATOM 79874 H1 WAT 2549 64.000 93.638 53.671 1.00 0.00 H ATOM 79875 H2 WAT 2549 62.896 92.649 53.365 1.00 0.00 H TER 79877 WAT 2549 ATOM 79877 O WAT 2550 105.910 101.715 3.833 1.00 0.00 O ATOM 79878 H1 WAT 2550 106.791 101.388 4.014 1.00 0.00 H ATOM 79879 H2 WAT 2550 105.390 101.433 4.586 1.00 0.00 H TER 79881 WAT 2550 ATOM 79881 O WAT 2551 83.332 57.571 0.383 1.00 0.00 O ATOM 79882 H1 WAT 2551 83.745 57.692 1.238 1.00 0.00 H ATOM 79883 H2 WAT 2551 82.874 58.396 0.219 1.00 0.00 H TER 79885 WAT 2551 ATOM 79885 O WAT 2552 13.471 112.088 142.025 1.00 0.00 O ATOM 79886 H1 WAT 2552 13.724 112.341 142.913 1.00 0.00 H ATOM 79887 H2 WAT 2552 13.085 111.217 142.125 1.00 0.00 H TER 79889 WAT 2552 ATOM 79889 O WAT 2553 100.081 13.316 71.391 1.00 0.00 O ATOM 79890 H1 WAT 2553 99.817 12.400 71.480 1.00 0.00 H ATOM 79891 H2 WAT 2553 101.034 13.300 71.478 1.00 0.00 H TER 79893 WAT 2553 ATOM 79893 O WAT 2554 50.882 71.585 82.817 1.00 0.00 O ATOM 79894 H1 WAT 2554 49.990 71.850 83.041 1.00 0.00 H ATOM 79895 H2 WAT 2554 51.439 72.106 83.395 1.00 0.00 H TER 79897 WAT 2554 ATOM 79897 O WAT 2555 111.692 32.304 63.496 1.00 0.00 O ATOM 79898 H1 WAT 2555 111.619 33.040 62.888 1.00 0.00 H ATOM 79899 H2 WAT 2555 112.109 32.676 64.273 1.00 0.00 H TER 79901 WAT 2555 ATOM 79901 O WAT 2556 0.545 112.778 94.292 1.00 0.00 O ATOM 79902 H1 WAT 2556 1.288 113.149 93.816 1.00 0.00 H ATOM 79903 H2 WAT 2556 0.591 111.839 94.113 1.00 0.00 H TER 79905 WAT 2556 ATOM 79905 O WAT 2557 6.032 53.333 84.332 1.00 0.00 O ATOM 79906 H1 WAT 2557 5.603 53.411 85.184 1.00 0.00 H ATOM 79907 H2 WAT 2557 6.717 52.679 84.467 1.00 0.00 H TER 79909 WAT 2557 ATOM 79909 O WAT 2558 107.698 20.231 85.841 1.00 0.00 O ATOM 79910 H1 WAT 2558 108.017 20.674 86.627 1.00 0.00 H ATOM 79911 H2 WAT 2558 107.469 20.942 85.242 1.00 0.00 H TER 79913 WAT 2558 ATOM 79913 O WAT 2559 95.630 28.103 113.116 1.00 0.00 O ATOM 79914 H1 WAT 2559 96.176 27.363 112.849 1.00 0.00 H ATOM 79915 H2 WAT 2559 95.314 28.477 112.293 1.00 0.00 H TER 79917 WAT 2559 ATOM 79917 O WAT 2560 30.519 128.971 135.378 1.00 0.00 O ATOM 79918 H1 WAT 2560 30.285 128.836 134.460 1.00 0.00 H ATOM 79919 H2 WAT 2560 30.234 129.865 135.568 1.00 0.00 H TER 79921 WAT 2560 ATOM 79921 O WAT 2561 96.374 106.095 4.137 1.00 0.00 O ATOM 79922 H1 WAT 2561 97.331 106.106 4.166 1.00 0.00 H ATOM 79923 H2 WAT 2561 96.105 106.574 4.921 1.00 0.00 H TER 79925 WAT 2561 ATOM 79925 O WAT 2562 9.976 75.302 115.684 1.00 0.00 O ATOM 79926 H1 WAT 2562 10.362 75.708 116.460 1.00 0.00 H ATOM 79927 H2 WAT 2562 9.835 74.389 115.936 1.00 0.00 H TER 79929 WAT 2562 ATOM 79929 O WAT 2563 142.250 58.162 72.753 1.00 0.00 O ATOM 79930 H1 WAT 2563 142.904 58.709 72.319 1.00 0.00 H ATOM 79931 H2 WAT 2563 141.986 58.668 73.521 1.00 0.00 H TER 79933 WAT 2563 ATOM 79933 O WAT 2564 60.026 94.500 144.613 1.00 0.00 O ATOM 79934 H1 WAT 2564 60.874 94.703 145.007 1.00 0.00 H ATOM 79935 H2 WAT 2564 60.224 93.845 143.943 1.00 0.00 H TER 79937 WAT 2564 ATOM 79937 O WAT 2565 64.294 72.733 156.238 1.00 0.00 O ATOM 79938 H1 WAT 2565 64.135 72.774 157.181 1.00 0.00 H ATOM 79939 H2 WAT 2565 65.248 72.725 156.156 1.00 0.00 H TER 79941 WAT 2565 ATOM 79941 O WAT 2566 126.908 45.783 107.891 1.00 0.00 O ATOM 79942 H1 WAT 2566 126.850 45.240 108.677 1.00 0.00 H ATOM 79943 H2 WAT 2566 126.366 46.547 108.088 1.00 0.00 H TER 79945 WAT 2566 ATOM 79945 O WAT 2567 76.455 108.162 2.104 1.00 0.00 O ATOM 79946 H1 WAT 2567 76.360 109.038 1.729 1.00 0.00 H ATOM 79947 H2 WAT 2567 76.356 107.571 1.358 1.00 0.00 H TER 79949 WAT 2567 ATOM 79949 O WAT 2568 90.924 143.744 110.481 1.00 0.00 O ATOM 79950 H1 WAT 2568 91.327 144.266 111.175 1.00 0.00 H ATOM 79951 H2 WAT 2568 90.758 142.893 110.887 1.00 0.00 H TER 79953 WAT 2568 ATOM 79953 O WAT 2569 1.775 91.183 56.253 1.00 0.00 O ATOM 79954 H1 WAT 2569 1.219 91.931 56.469 1.00 0.00 H ATOM 79955 H2 WAT 2569 1.213 90.609 55.732 1.00 0.00 H TER 79957 WAT 2569 ATOM 79957 O WAT 2570 14.297 41.252 4.180 1.00 0.00 O ATOM 79958 H1 WAT 2570 14.097 41.640 3.328 1.00 0.00 H ATOM 79959 H2 WAT 2570 14.649 40.386 3.971 1.00 0.00 H TER 79961 WAT 2570 ATOM 79961 O WAT 2571 29.562 4.942 145.520 1.00 0.00 O ATOM 79962 H1 WAT 2571 29.779 5.327 146.369 1.00 0.00 H ATOM 79963 H2 WAT 2571 29.743 4.008 145.628 1.00 0.00 H TER 79965 WAT 2571 ATOM 79965 O WAT 2572 121.970 29.096 138.193 1.00 0.00 O ATOM 79966 H1 WAT 2572 121.825 28.167 138.369 1.00 0.00 H ATOM 79967 H2 WAT 2572 122.905 29.159 137.996 1.00 0.00 H TER 79969 WAT 2572 ATOM 79969 O WAT 2573 79.238 9.946 75.236 1.00 0.00 O ATOM 79970 H1 WAT 2573 79.914 9.276 75.139 1.00 0.00 H ATOM 79971 H2 WAT 2573 79.613 10.726 74.825 1.00 0.00 H TER 79973 WAT 2573 ATOM 79973 O WAT 2574 70.981 19.661 100.252 1.00 0.00 O ATOM 79974 H1 WAT 2574 71.630 19.071 99.868 1.00 0.00 H ATOM 79975 H2 WAT 2574 70.725 20.236 99.532 1.00 0.00 H TER 79977 WAT 2574 ATOM 79977 O WAT 2575 35.490 95.717 76.306 1.00 0.00 O ATOM 79978 H1 WAT 2575 36.305 96.219 76.316 1.00 0.00 H ATOM 79979 H2 WAT 2575 34.800 96.379 76.316 1.00 0.00 H TER 79981 WAT 2575 ATOM 79981 O WAT 2576 10.342 54.192 130.892 1.00 0.00 O ATOM 79982 H1 WAT 2576 9.735 53.460 130.998 1.00 0.00 H ATOM 79983 H2 WAT 2576 11.161 53.883 131.279 1.00 0.00 H TER 79985 WAT 2576 ATOM 79985 O WAT 2577 6.715 4.123 154.315 1.00 0.00 O ATOM 79986 H1 WAT 2577 7.369 4.260 153.630 1.00 0.00 H ATOM 79987 H2 WAT 2577 6.530 5.002 154.648 1.00 0.00 H TER 79989 WAT 2577 ATOM 79989 O WAT 2578 90.024 64.309 144.731 1.00 0.00 O ATOM 79990 H1 WAT 2578 90.059 63.742 143.960 1.00 0.00 H ATOM 79991 H2 WAT 2578 90.712 63.973 145.306 1.00 0.00 H TER 79993 WAT 2578 ATOM 79993 O WAT 2579 27.184 145.493 74.351 1.00 0.00 O ATOM 79994 H1 WAT 2579 27.257 145.629 73.406 1.00 0.00 H ATOM 79995 H2 WAT 2579 27.892 146.019 74.723 1.00 0.00 H TER 79997 WAT 2579 ATOM 79997 O WAT 2580 81.124 25.106 56.404 1.00 0.00 O ATOM 79998 H1 WAT 2580 81.049 25.144 57.357 1.00 0.00 H ATOM 79999 H2 WAT 2580 81.888 25.646 56.202 1.00 0.00 H TER 80001 WAT 2580 ATOM 80001 O WAT 2581 21.222 23.705 8.527 1.00 0.00 O ATOM 80002 H1 WAT 2581 20.868 22.831 8.690 1.00 0.00 H ATOM 80003 H2 WAT 2581 20.450 24.258 8.410 1.00 0.00 H TER 80005 WAT 2581 ATOM 80005 O WAT 2582 37.447 1.127 147.233 1.00 0.00 O ATOM 80006 H1 WAT 2582 37.768 1.466 148.068 1.00 0.00 H ATOM 80007 H2 WAT 2582 38.177 0.612 146.887 1.00 0.00 H TER 80009 WAT 2582 ATOM 80009 O WAT 2583 73.853 49.921 58.712 1.00 0.00 O ATOM 80010 H1 WAT 2583 73.317 50.568 59.170 1.00 0.00 H ATOM 80011 H2 WAT 2583 74.323 49.462 59.409 1.00 0.00 H TER 80013 WAT 2583 ATOM 80013 O WAT 2584 41.493 63.989 154.644 1.00 0.00 O ATOM 80014 H1 WAT 2584 40.855 64.558 154.213 1.00 0.00 H ATOM 80015 H2 WAT 2584 41.268 63.108 154.347 1.00 0.00 H TER 80017 WAT 2584 ATOM 80017 O WAT 2585 32.431 137.231 103.287 1.00 0.00 O ATOM 80018 H1 WAT 2585 32.102 137.032 102.411 1.00 0.00 H ATOM 80019 H2 WAT 2585 33.332 137.520 103.145 1.00 0.00 H TER 80021 WAT 2585 ATOM 80021 O WAT 2586 48.821 71.659 66.990 1.00 0.00 O ATOM 80022 H1 WAT 2586 48.191 72.246 66.573 1.00 0.00 H ATOM 80023 H2 WAT 2586 49.676 72.031 66.772 1.00 0.00 H TER 80025 WAT 2586 ATOM 80025 O WAT 2587 27.925 88.139 130.296 1.00 0.00 O ATOM 80026 H1 WAT 2587 28.255 87.885 129.434 1.00 0.00 H ATOM 80027 H2 WAT 2587 27.649 89.049 130.188 1.00 0.00 H TER 80029 WAT 2587 ATOM 80029 O WAT 2588 142.066 66.169 108.827 1.00 0.00 O ATOM 80030 H1 WAT 2588 142.536 65.341 108.733 1.00 0.00 H ATOM 80031 H2 WAT 2588 141.721 66.349 107.952 1.00 0.00 H TER 80033 WAT 2588 ATOM 80033 O WAT 2589 7.404 89.995 15.086 1.00 0.00 O ATOM 80034 H1 WAT 2589 6.946 89.286 15.537 1.00 0.00 H ATOM 80035 H2 WAT 2589 6.873 90.772 15.259 1.00 0.00 H TER 80037 WAT 2589 ATOM 80037 O WAT 2590 107.930 4.023 144.271 1.00 0.00 O ATOM 80038 H1 WAT 2590 108.530 4.128 143.532 1.00 0.00 H ATOM 80039 H2 WAT 2590 107.567 4.897 144.411 1.00 0.00 H TER 80041 WAT 2590 ATOM 80041 O WAT 2591 30.096 135.738 59.484 1.00 0.00 O ATOM 80042 H1 WAT 2591 30.058 136.016 58.569 1.00 0.00 H ATOM 80043 H2 WAT 2591 29.675 134.878 59.490 1.00 0.00 H TER 80045 WAT 2591 ATOM 80045 O WAT 2592 111.956 107.700 83.999 1.00 0.00 O ATOM 80046 H1 WAT 2592 111.432 108.044 84.722 1.00 0.00 H ATOM 80047 H2 WAT 2592 111.561 108.080 83.215 1.00 0.00 H TER 80049 WAT 2592 ATOM 80049 O WAT 2593 86.831 74.217 81.087 1.00 0.00 O ATOM 80050 H1 WAT 2593 87.442 74.905 80.822 1.00 0.00 H ATOM 80051 H2 WAT 2593 86.299 74.621 81.773 1.00 0.00 H TER 80053 WAT 2593 ATOM 80053 O WAT 2594 62.752 112.724 121.112 1.00 0.00 O ATOM 80054 H1 WAT 2594 63.479 112.417 120.569 1.00 0.00 H ATOM 80055 H2 WAT 2594 62.698 113.662 120.931 1.00 0.00 H TER 80057 WAT 2594 ATOM 80057 O WAT 2595 10.005 53.893 96.756 1.00 0.00 O ATOM 80058 H1 WAT 2595 10.574 54.252 97.438 1.00 0.00 H ATOM 80059 H2 WAT 2595 10.608 53.544 96.100 1.00 0.00 H TER 80061 WAT 2595 ATOM 80061 O WAT 2596 7.138 25.390 125.531 1.00 0.00 O ATOM 80062 H1 WAT 2596 6.560 25.480 126.289 1.00 0.00 H ATOM 80063 H2 WAT 2596 6.745 24.690 125.011 1.00 0.00 H TER 80065 WAT 2596 ATOM 80065 O WAT 2597 108.896 55.375 92.848 1.00 0.00 O ATOM 80066 H1 WAT 2597 108.143 54.828 92.623 1.00 0.00 H ATOM 80067 H2 WAT 2597 109.157 55.776 92.019 1.00 0.00 H TER 80069 WAT 2597 ATOM 80069 O WAT 2598 71.003 14.588 3.645 1.00 0.00 O ATOM 80070 H1 WAT 2598 71.519 13.983 4.179 1.00 0.00 H ATOM 80071 H2 WAT 2598 71.454 15.428 3.730 1.00 0.00 H TER 80073 WAT 2598 ATOM 80073 O WAT 2599 73.447 105.652 74.356 1.00 0.00 O ATOM 80074 H1 WAT 2599 73.465 106.154 75.171 1.00 0.00 H ATOM 80075 H2 WAT 2599 74.366 105.587 74.094 1.00 0.00 H TER 80077 WAT 2599 ATOM 80077 O WAT 2600 91.491 105.779 18.423 1.00 0.00 O ATOM 80078 H1 WAT 2600 91.539 106.710 18.206 1.00 0.00 H ATOM 80079 H2 WAT 2600 91.657 105.744 19.365 1.00 0.00 H TER 80081 WAT 2600 ATOM 80081 O WAT 2601 116.586 13.422 79.747 1.00 0.00 O ATOM 80082 H1 WAT 2601 117.458 13.117 79.496 1.00 0.00 H ATOM 80083 H2 WAT 2601 116.314 13.988 79.025 1.00 0.00 H TER 80085 WAT 2601 ATOM 80085 O WAT 2602 110.166 107.861 79.349 1.00 0.00 O ATOM 80086 H1 WAT 2602 110.110 106.942 79.614 1.00 0.00 H ATOM 80087 H2 WAT 2602 110.839 107.873 78.669 1.00 0.00 H TER 80089 WAT 2602 ATOM 80089 O WAT 2603 135.535 125.150 68.366 1.00 0.00 O ATOM 80090 H1 WAT 2603 135.799 125.455 67.497 1.00 0.00 H ATOM 80091 H2 WAT 2603 134.605 124.944 68.275 1.00 0.00 H TER 80093 WAT 2603 ATOM 80093 O WAT 2604 13.567 99.468 19.971 1.00 0.00 O ATOM 80094 H1 WAT 2604 13.216 99.007 20.733 1.00 0.00 H ATOM 80095 H2 WAT 2604 13.016 100.246 19.887 1.00 0.00 H TER 80097 WAT 2604 ATOM 80097 O WAT 2605 41.483 114.725 14.209 1.00 0.00 O ATOM 80098 H1 WAT 2605 40.829 115.047 13.588 1.00 0.00 H ATOM 80099 H2 WAT 2605 41.775 115.507 14.677 1.00 0.00 H TER 80101 WAT 2605 ATOM 80101 O WAT 2606 71.196 15.231 80.758 1.00 0.00 O ATOM 80102 H1 WAT 2606 71.993 15.750 80.649 1.00 0.00 H ATOM 80103 H2 WAT 2606 71.510 14.342 80.925 1.00 0.00 H TER 80105 WAT 2606 ATOM 80105 O WAT 2607 94.925 138.053 6.200 1.00 0.00 O ATOM 80106 H1 WAT 2607 95.055 137.119 6.363 1.00 0.00 H ATOM 80107 H2 WAT 2607 93.974 138.167 6.203 1.00 0.00 H TER 80109 WAT 2607 ATOM 80109 O WAT 2608 135.736 1.066 66.965 1.00 0.00 O ATOM 80110 H1 WAT 2608 136.359 0.877 67.667 1.00 0.00 H ATOM 80111 H2 WAT 2608 136.252 0.995 66.162 1.00 0.00 H TER 80113 WAT 2608 ATOM 80113 O WAT 2609 56.681 115.381 6.775 1.00 0.00 O ATOM 80114 H1 WAT 2609 57.157 114.837 6.146 1.00 0.00 H ATOM 80115 H2 WAT 2609 57.122 115.222 7.610 1.00 0.00 H TER 80117 WAT 2609 ATOM 80117 O WAT 2610 22.852 44.859 78.612 1.00 0.00 O ATOM 80118 H1 WAT 2610 21.975 44.861 78.996 1.00 0.00 H ATOM 80119 H2 WAT 2610 23.249 44.046 78.926 1.00 0.00 H TER 80121 WAT 2610 ATOM 80121 O WAT 2611 3.995 78.980 23.047 1.00 0.00 O ATOM 80122 H1 WAT 2611 4.133 79.782 22.543 1.00 0.00 H ATOM 80123 H2 WAT 2611 3.389 79.235 23.742 1.00 0.00 H TER 80125 WAT 2611 ATOM 80125 O WAT 2612 47.018 128.030 54.629 1.00 0.00 O ATOM 80126 H1 WAT 2612 46.331 127.829 55.265 1.00 0.00 H ATOM 80127 H2 WAT 2612 47.526 127.221 54.562 1.00 0.00 H TER 80129 WAT 2612 ATOM 80129 O WAT 2613 70.108 12.072 112.599 1.00 0.00 O ATOM 80130 H1 WAT 2613 70.791 12.367 113.202 1.00 0.00 H ATOM 80131 H2 WAT 2613 69.695 12.879 112.292 1.00 0.00 H TER 80133 WAT 2613 ATOM 80133 O WAT 2614 41.928 70.485 103.630 1.00 0.00 O ATOM 80134 H1 WAT 2614 41.565 69.599 103.614 1.00 0.00 H ATOM 80135 H2 WAT 2614 42.470 70.536 102.843 1.00 0.00 H TER 80137 WAT 2614 ATOM 80137 O WAT 2615 68.310 5.209 141.932 1.00 0.00 O ATOM 80138 H1 WAT 2615 67.998 4.355 141.633 1.00 0.00 H ATOM 80139 H2 WAT 2615 68.280 5.762 141.151 1.00 0.00 H TER 80141 WAT 2615 ATOM 80141 O WAT 2616 93.324 109.179 106.003 1.00 0.00 O ATOM 80142 H1 WAT 2616 93.113 108.732 105.183 1.00 0.00 H ATOM 80143 H2 WAT 2616 92.500 109.188 106.490 1.00 0.00 H TER 80145 WAT 2616 ATOM 80145 O WAT 2617 55.067 133.072 135.538 1.00 0.00 O ATOM 80146 H1 WAT 2617 54.523 133.548 134.911 1.00 0.00 H ATOM 80147 H2 WAT 2617 55.957 133.375 135.361 1.00 0.00 H TER 80149 WAT 2617 ATOM 80149 O WAT 2618 115.450 75.063 150.076 1.00 0.00 O ATOM 80150 H1 WAT 2618 115.363 76.008 149.951 1.00 0.00 H ATOM 80151 H2 WAT 2618 115.798 74.969 150.962 1.00 0.00 H TER 80153 WAT 2618 ATOM 80153 O WAT 2619 110.304 138.942 158.643 1.00 0.00 O ATOM 80154 H1 WAT 2619 110.663 139.785 158.919 1.00 0.00 H ATOM 80155 H2 WAT 2619 110.930 138.615 157.997 1.00 0.00 H TER 80157 WAT 2619 ATOM 80157 O WAT 2620 131.786 138.568 82.469 1.00 0.00 O ATOM 80158 H1 WAT 2620 132.633 138.159 82.290 1.00 0.00 H ATOM 80159 H2 WAT 2620 131.540 138.241 83.334 1.00 0.00 H TER 80161 WAT 2620 ATOM 80161 O WAT 2621 89.751 100.146 112.850 1.00 0.00 O ATOM 80162 H1 WAT 2621 89.901 100.017 111.914 1.00 0.00 H ATOM 80163 H2 WAT 2621 88.813 99.993 112.965 1.00 0.00 H TER 80165 WAT 2621 ATOM 80165 O WAT 2622 47.989 38.025 75.321 1.00 0.00 O ATOM 80166 H1 WAT 2622 48.008 38.693 74.635 1.00 0.00 H ATOM 80167 H2 WAT 2622 48.910 37.813 75.474 1.00 0.00 H TER 80169 WAT 2622 ATOM 80169 O WAT 2623 27.003 117.156 4.360 1.00 0.00 O ATOM 80170 H1 WAT 2623 27.110 116.621 5.146 1.00 0.00 H ATOM 80171 H2 WAT 2623 27.859 117.129 3.933 1.00 0.00 H TER 80173 WAT 2623 ATOM 80173 O WAT 2624 96.517 35.105 9.971 1.00 0.00 O ATOM 80174 H1 WAT 2624 96.037 35.567 10.659 1.00 0.00 H ATOM 80175 H2 WAT 2624 96.020 35.281 9.172 1.00 0.00 H TER 80177 WAT 2624 ATOM 80177 O WAT 2625 71.883 97.256 143.311 1.00 0.00 O ATOM 80178 H1 WAT 2625 71.330 97.979 143.605 1.00 0.00 H ATOM 80179 H2 WAT 2625 72.511 97.130 144.022 1.00 0.00 H TER 80181 WAT 2625 ATOM 80181 O WAT 2626 3.241 72.881 116.906 1.00 0.00 O ATOM 80182 H1 WAT 2626 3.397 73.011 117.842 1.00 0.00 H ATOM 80183 H2 WAT 2626 3.977 73.317 116.477 1.00 0.00 H TER 80185 WAT 2626 ATOM 80185 O WAT 2627 22.992 135.084 157.367 1.00 0.00 O ATOM 80186 H1 WAT 2627 22.519 134.858 158.167 1.00 0.00 H ATOM 80187 H2 WAT 2627 22.395 134.841 156.659 1.00 0.00 H TER 80189 WAT 2627 ATOM 80189 O WAT 2628 106.323 138.768 12.226 1.00 0.00 O ATOM 80190 H1 WAT 2628 106.027 138.698 13.134 1.00 0.00 H ATOM 80191 H2 WAT 2628 106.758 139.619 12.180 1.00 0.00 H TER 80193 WAT 2628 ATOM 80193 O WAT 2629 61.293 110.283 129.464 1.00 0.00 O ATOM 80194 H1 WAT 2629 61.437 109.426 129.865 1.00 0.00 H ATOM 80195 H2 WAT 2629 61.324 110.116 128.522 1.00 0.00 H TER 80197 WAT 2629 ATOM 80197 O WAT 2630 23.303 144.672 142.221 1.00 0.00 O ATOM 80198 H1 WAT 2630 22.822 143.847 142.279 1.00 0.00 H ATOM 80199 H2 WAT 2630 22.818 145.187 141.577 1.00 0.00 H TER 80201 WAT 2630 ATOM 80201 O WAT 2631 114.630 143.638 132.892 1.00 0.00 O ATOM 80202 H1 WAT 2631 114.658 143.799 131.949 1.00 0.00 H ATOM 80203 H2 WAT 2631 114.274 144.446 133.262 1.00 0.00 H TER 80205 WAT 2631 ATOM 80205 O WAT 2632 85.079 59.403 97.862 1.00 0.00 O ATOM 80206 H1 WAT 2632 84.859 60.311 98.069 1.00 0.00 H ATOM 80207 H2 WAT 2632 85.749 59.468 97.181 1.00 0.00 H TER 80209 WAT 2632 ATOM 80209 O WAT 2633 128.138 8.207 148.330 1.00 0.00 O ATOM 80210 H1 WAT 2633 128.035 8.196 147.378 1.00 0.00 H ATOM 80211 H2 WAT 2633 129.070 8.378 148.468 1.00 0.00 H TER 80213 WAT 2633 ATOM 80213 O WAT 2634 81.721 100.722 79.102 1.00 0.00 O ATOM 80214 H1 WAT 2634 81.510 101.152 79.930 1.00 0.00 H ATOM 80215 H2 WAT 2634 81.699 101.426 78.454 1.00 0.00 H TER 80217 WAT 2634 ATOM 80217 O WAT 2635 145.358 99.469 64.190 1.00 0.00 O ATOM 80218 H1 WAT 2635 145.788 98.627 64.341 1.00 0.00 H ATOM 80219 H2 WAT 2635 144.749 99.301 63.471 1.00 0.00 H TER 80221 WAT 2635 ATOM 80221 O WAT 2636 103.403 27.079 144.532 1.00 0.00 O ATOM 80222 H1 WAT 2636 102.857 27.806 144.232 1.00 0.00 H ATOM 80223 H2 WAT 2636 103.686 26.644 143.727 1.00 0.00 H TER 80225 WAT 2636 ATOM 80225 O WAT 2637 93.718 118.644 1.893 1.00 0.00 O ATOM 80226 H1 WAT 2637 93.390 119.271 1.248 1.00 0.00 H ATOM 80227 H2 WAT 2637 94.403 118.161 1.432 1.00 0.00 H TER 80229 WAT 2637 ATOM 80229 O WAT 2638 39.781 84.323 146.984 1.00 0.00 O ATOM 80230 H1 WAT 2638 39.201 83.897 146.353 1.00 0.00 H ATOM 80231 H2 WAT 2638 40.663 84.131 146.666 1.00 0.00 H TER 80233 WAT 2638 ATOM 80233 O WAT 2639 24.692 113.007 24.416 1.00 0.00 O ATOM 80234 H1 WAT 2639 24.810 112.705 25.317 1.00 0.00 H ATOM 80235 H2 WAT 2639 24.162 113.800 24.496 1.00 0.00 H TER 80237 WAT 2639 ATOM 80237 O WAT 2640 127.429 119.215 86.081 1.00 0.00 O ATOM 80238 H1 WAT 2640 127.272 120.105 86.396 1.00 0.00 H ATOM 80239 H2 WAT 2640 128.373 119.179 85.926 1.00 0.00 H TER 80241 WAT 2640 ATOM 80241 O WAT 2641 129.628 116.070 153.459 1.00 0.00 O ATOM 80242 H1 WAT 2641 130.358 115.605 153.051 1.00 0.00 H ATOM 80243 H2 WAT 2641 128.936 115.413 153.532 1.00 0.00 H TER 80245 WAT 2641 ATOM 80245 O WAT 2642 51.411 0.792 19.235 1.00 0.00 O ATOM 80246 H1 WAT 2642 51.704 0.121 19.852 1.00 0.00 H ATOM 80247 H2 WAT 2642 51.435 0.360 18.381 1.00 0.00 H TER 80249 WAT 2642 ATOM 80249 O WAT 2643 8.423 5.218 76.228 1.00 0.00 O ATOM 80250 H1 WAT 2643 9.041 5.249 75.498 1.00 0.00 H ATOM 80251 H2 WAT 2643 8.477 4.318 76.550 1.00 0.00 H TER 80253 WAT 2643 ATOM 80253 O WAT 2644 110.962 5.290 67.486 1.00 0.00 O ATOM 80254 H1 WAT 2644 111.090 5.886 68.224 1.00 0.00 H ATOM 80255 H2 WAT 2644 111.650 5.528 66.864 1.00 0.00 H TER 80257 WAT 2644 ATOM 80257 O WAT 2645 79.231 7.020 63.926 1.00 0.00 O ATOM 80258 H1 WAT 2645 79.859 7.697 64.178 1.00 0.00 H ATOM 80259 H2 WAT 2645 79.712 6.463 63.314 1.00 0.00 H TER 80261 WAT 2645 ATOM 80261 O WAT 2646 35.953 74.564 18.828 1.00 0.00 O ATOM 80262 H1 WAT 2646 35.234 75.110 18.511 1.00 0.00 H ATOM 80263 H2 WAT 2646 36.001 74.752 19.766 1.00 0.00 H TER 80265 WAT 2646 ATOM 80265 O WAT 2647 78.134 28.639 108.220 1.00 0.00 O ATOM 80266 H1 WAT 2647 78.575 27.829 108.476 1.00 0.00 H ATOM 80267 H2 WAT 2647 78.717 29.035 107.573 1.00 0.00 H TER 80269 WAT 2647 ATOM 80269 O WAT 2648 100.226 89.380 118.694 1.00 0.00 O ATOM 80270 H1 WAT 2648 99.748 90.176 118.929 1.00 0.00 H ATOM 80271 H2 WAT 2648 99.542 88.738 118.505 1.00 0.00 H TER 80273 WAT 2648 ATOM 80273 O WAT 2649 71.249 109.502 88.860 1.00 0.00 O ATOM 80274 H1 WAT 2649 70.408 109.496 88.404 1.00 0.00 H ATOM 80275 H2 WAT 2649 71.786 110.120 88.364 1.00 0.00 H TER 80277 WAT 2649 ATOM 80277 O WAT 2650 25.790 10.224 153.264 1.00 0.00 O ATOM 80278 H1 WAT 2650 25.892 9.845 154.137 1.00 0.00 H ATOM 80279 H2 WAT 2650 25.402 9.522 152.742 1.00 0.00 H TER 80281 WAT 2650 ATOM 80281 O WAT 2651 31.667 45.538 57.928 1.00 0.00 O ATOM 80282 H1 WAT 2651 32.033 44.834 57.393 1.00 0.00 H ATOM 80283 H2 WAT 2651 31.046 45.980 57.350 1.00 0.00 H TER 80285 WAT 2651 ATOM 80285 O WAT 2652 40.495 108.234 151.028 1.00 0.00 O ATOM 80286 H1 WAT 2652 39.953 108.562 151.746 1.00 0.00 H ATOM 80287 H2 WAT 2652 39.901 108.197 150.278 1.00 0.00 H TER 80289 WAT 2652 ATOM 80289 O WAT 2653 103.008 91.293 157.679 1.00 0.00 O ATOM 80290 H1 WAT 2653 102.975 92.078 157.132 1.00 0.00 H ATOM 80291 H2 WAT 2653 102.382 91.464 158.382 1.00 0.00 H TER 80293 WAT 2653 ATOM 80293 O WAT 2654 69.037 20.021 129.074 1.00 0.00 O ATOM 80294 H1 WAT 2654 68.973 19.954 128.122 1.00 0.00 H ATOM 80295 H2 WAT 2654 68.582 20.836 129.288 1.00 0.00 H TER 80297 WAT 2654 ATOM 80297 O WAT 2655 138.354 76.300 90.104 1.00 0.00 O ATOM 80298 H1 WAT 2655 137.601 76.586 90.622 1.00 0.00 H ATOM 80299 H2 WAT 2655 138.029 75.551 89.604 1.00 0.00 H TER 80301 WAT 2655 ATOM 80301 O WAT 2656 141.969 40.684 78.454 1.00 0.00 O ATOM 80302 H1 WAT 2656 142.738 41.007 78.924 1.00 0.00 H ATOM 80303 H2 WAT 2656 141.358 40.426 79.144 1.00 0.00 H TER 80305 WAT 2656 ATOM 80305 O WAT 2657 120.006 123.715 56.575 1.00 0.00 O ATOM 80306 H1 WAT 2657 119.904 123.569 57.516 1.00 0.00 H ATOM 80307 H2 WAT 2657 120.741 124.325 56.507 1.00 0.00 H TER 80309 WAT 2657 ATOM 80309 O WAT 2658 8.147 15.565 84.368 1.00 0.00 O ATOM 80310 H1 WAT 2658 7.382 15.637 84.938 1.00 0.00 H ATOM 80311 H2 WAT 2658 8.505 14.697 84.554 1.00 0.00 H TER 80313 WAT 2658 ATOM 80313 O WAT 2659 17.483 112.358 118.977 1.00 0.00 O ATOM 80314 H1 WAT 2659 18.302 112.735 118.654 1.00 0.00 H ATOM 80315 H2 WAT 2659 17.760 111.661 119.573 1.00 0.00 H TER 80317 WAT 2659 ATOM 80317 O WAT 2660 92.118 45.716 154.693 1.00 0.00 O ATOM 80318 H1 WAT 2660 92.211 46.319 155.430 1.00 0.00 H ATOM 80319 H2 WAT 2660 91.744 46.250 153.992 1.00 0.00 H TER 80321 WAT 2660 ATOM 80321 O WAT 2661 48.964 88.852 115.470 1.00 0.00 O ATOM 80322 H1 WAT 2661 49.155 89.239 116.324 1.00 0.00 H ATOM 80323 H2 WAT 2661 48.010 88.877 115.404 1.00 0.00 H TER 80325 WAT 2661 ATOM 80325 O WAT 2662 63.452 93.367 15.379 1.00 0.00 O ATOM 80326 H1 WAT 2662 63.578 93.317 16.326 1.00 0.00 H ATOM 80327 H2 WAT 2662 63.859 94.196 15.126 1.00 0.00 H TER 80329 WAT 2662 ATOM 80329 O WAT 2663 121.069 134.325 10.948 1.00 0.00 O ATOM 80330 H1 WAT 2663 121.744 133.899 10.420 1.00 0.00 H ATOM 80331 H2 WAT 2663 121.090 133.859 11.784 1.00 0.00 H TER 80333 WAT 2663 ATOM 80333 O WAT 2664 31.299 40.306 96.558 1.00 0.00 O ATOM 80334 H1 WAT 2664 30.719 40.884 96.064 1.00 0.00 H ATOM 80335 H2 WAT 2664 31.167 40.558 97.472 1.00 0.00 H TER 80337 WAT 2664 ATOM 80337 O WAT 2665 94.058 57.573 63.506 1.00 0.00 O ATOM 80338 H1 WAT 2665 93.813 58.469 63.274 1.00 0.00 H ATOM 80339 H2 WAT 2665 94.959 57.483 63.196 1.00 0.00 H TER 80341 WAT 2665 ATOM 80341 O WAT 2666 41.816 68.525 142.745 1.00 0.00 O ATOM 80342 H1 WAT 2666 42.605 68.516 143.288 1.00 0.00 H ATOM 80343 H2 WAT 2666 41.464 67.638 142.821 1.00 0.00 H TER 80345 WAT 2666 ATOM 80345 O WAT 2667 51.033 11.071 70.718 1.00 0.00 O ATOM 80346 H1 WAT 2667 50.992 11.906 70.253 1.00 0.00 H ATOM 80347 H2 WAT 2667 50.752 10.423 70.073 1.00 0.00 H TER 80349 WAT 2667 ATOM 80349 O WAT 2668 59.925 88.772 85.599 1.00 0.00 O ATOM 80350 H1 WAT 2668 59.408 88.513 84.836 1.00 0.00 H ATOM 80351 H2 WAT 2668 60.505 89.460 85.273 1.00 0.00 H TER 80353 WAT 2668 ATOM 80353 O WAT 2669 71.146 102.777 145.943 1.00 0.00 O ATOM 80354 H1 WAT 2669 71.820 103.363 145.600 1.00 0.00 H ATOM 80355 H2 WAT 2669 70.980 103.097 146.830 1.00 0.00 H TER 80357 WAT 2669 ATOM 80357 O WAT 2670 79.295 57.683 76.706 1.00 0.00 O ATOM 80358 H1 WAT 2670 79.758 57.532 75.882 1.00 0.00 H ATOM 80359 H2 WAT 2670 79.083 58.616 76.694 1.00 0.00 H TER 80361 WAT 2670 ATOM 80361 O WAT 2671 115.664 103.808 124.934 1.00 0.00 O ATOM 80362 H1 WAT 2671 115.673 104.098 124.022 1.00 0.00 H ATOM 80363 H2 WAT 2671 115.824 104.605 125.440 1.00 0.00 H TER 80365 WAT 2671 ATOM 80365 O WAT 2672 83.845 40.746 132.424 1.00 0.00 O ATOM 80366 H1 WAT 2672 82.966 40.398 132.271 1.00 0.00 H ATOM 80367 H2 WAT 2672 83.984 40.638 133.365 1.00 0.00 H TER 80369 WAT 2672 ATOM 80369 O WAT 2673 26.865 18.195 14.098 1.00 0.00 O ATOM 80370 H1 WAT 2673 26.654 18.258 13.166 1.00 0.00 H ATOM 80371 H2 WAT 2673 26.042 18.394 14.544 1.00 0.00 H TER 80373 WAT 2673 ATOM 80373 O WAT 2674 93.011 68.822 153.602 1.00 0.00 O ATOM 80374 H1 WAT 2674 93.275 67.902 153.625 1.00 0.00 H ATOM 80375 H2 WAT 2674 92.295 68.850 152.967 1.00 0.00 H TER 80377 WAT 2674 ATOM 80377 O WAT 2675 4.204 38.227 138.299 1.00 0.00 O ATOM 80378 H1 WAT 2675 3.804 37.359 138.348 1.00 0.00 H ATOM 80379 H2 WAT 2675 5.139 38.066 138.421 1.00 0.00 H TER 80381 WAT 2675 ATOM 80381 O WAT 2676 112.027 80.174 93.318 1.00 0.00 O ATOM 80382 H1 WAT 2676 111.614 79.477 93.829 1.00 0.00 H ATOM 80383 H2 WAT 2676 112.941 79.902 93.237 1.00 0.00 H TER 80385 WAT 2676 ATOM 80385 O WAT 2677 6.689 141.917 10.418 1.00 0.00 O ATOM 80386 H1 WAT 2677 7.430 141.348 10.208 1.00 0.00 H ATOM 80387 H2 WAT 2677 6.408 142.266 9.572 1.00 0.00 H TER 80389 WAT 2677 ATOM 80389 O WAT 2678 111.324 14.619 11.522 1.00 0.00 O ATOM 80390 H1 WAT 2678 111.674 13.728 11.520 1.00 0.00 H ATOM 80391 H2 WAT 2678 111.883 15.097 10.909 1.00 0.00 H TER 80393 WAT 2678 ATOM 80393 O WAT 2679 108.119 63.445 143.131 1.00 0.00 O ATOM 80394 H1 WAT 2679 108.457 64.035 143.804 1.00 0.00 H ATOM 80395 H2 WAT 2679 107.180 63.392 143.309 1.00 0.00 H TER 80397 WAT 2679 ATOM 80397 O WAT 2680 123.897 15.201 54.034 1.00 0.00 O ATOM 80398 H1 WAT 2680 123.898 14.471 53.415 1.00 0.00 H ATOM 80399 H2 WAT 2680 123.624 15.956 53.514 1.00 0.00 H TER 80401 WAT 2680 ATOM 80401 O WAT 2681 79.212 74.841 74.552 1.00 0.00 O ATOM 80402 H1 WAT 2681 78.276 74.668 74.448 1.00 0.00 H ATOM 80403 H2 WAT 2681 79.283 75.266 75.406 1.00 0.00 H TER 80405 WAT 2681 ATOM 80405 O WAT 2682 84.064 20.168 150.094 1.00 0.00 O ATOM 80406 H1 WAT 2682 84.307 21.003 150.495 1.00 0.00 H ATOM 80407 H2 WAT 2682 83.618 20.412 149.283 1.00 0.00 H TER 80409 WAT 2682 ATOM 80409 O WAT 2683 81.304 21.938 62.453 1.00 0.00 O ATOM 80410 H1 WAT 2683 81.555 21.550 61.615 1.00 0.00 H ATOM 80411 H2 WAT 2683 82.106 21.920 62.975 1.00 0.00 H TER 80413 WAT 2683 ATOM 80413 O WAT 2684 128.092 92.310 20.908 1.00 0.00 O ATOM 80414 H1 WAT 2684 128.897 92.226 21.418 1.00 0.00 H ATOM 80415 H2 WAT 2684 127.449 91.787 21.388 1.00 0.00 H TER 80417 WAT 2684 ATOM 80417 O WAT 2685 61.585 51.790 120.254 1.00 0.00 O ATOM 80418 H1 WAT 2685 60.984 51.360 120.863 1.00 0.00 H ATOM 80419 H2 WAT 2685 62.380 51.937 120.767 1.00 0.00 H TER 80421 WAT 2685 ATOM 80421 O WAT 2686 125.752 35.050 101.237 1.00 0.00 O ATOM 80422 H1 WAT 2686 124.998 35.362 101.737 1.00 0.00 H ATOM 80423 H2 WAT 2686 126.420 34.869 101.898 1.00 0.00 H TER 80425 WAT 2686 ATOM 80425 O WAT 2687 39.711 133.949 77.478 1.00 0.00 O ATOM 80426 H1 WAT 2687 40.245 134.247 78.215 1.00 0.00 H ATOM 80427 H2 WAT 2687 39.125 134.683 77.295 1.00 0.00 H TER 80429 WAT 2687 ATOM 80429 O WAT 2688 56.578 119.465 10.371 1.00 0.00 O ATOM 80430 H1 WAT 2688 57.384 118.949 10.357 1.00 0.00 H ATOM 80431 H2 WAT 2688 56.376 119.619 9.448 1.00 0.00 H TER 80433 WAT 2688 ATOM 80433 O WAT 2689 59.868 110.667 146.899 1.00 0.00 O ATOM 80434 H1 WAT 2689 59.604 110.212 146.099 1.00 0.00 H ATOM 80435 H2 WAT 2689 60.617 111.201 146.635 1.00 0.00 H TER 80437 WAT 2689 ATOM 80437 O WAT 2690 11.350 113.250 6.816 1.00 0.00 O ATOM 80438 H1 WAT 2690 10.686 112.780 7.321 1.00 0.00 H ATOM 80439 H2 WAT 2690 11.111 113.094 5.902 1.00 0.00 H TER 80441 WAT 2690 ATOM 80441 O WAT 2691 67.544 140.018 67.995 1.00 0.00 O ATOM 80442 H1 WAT 2691 67.611 140.020 68.949 1.00 0.00 H ATOM 80443 H2 WAT 2691 66.854 140.652 67.802 1.00 0.00 H TER 80445 WAT 2691 ATOM 80445 O WAT 2692 84.778 88.923 146.537 1.00 0.00 O ATOM 80446 H1 WAT 2692 84.755 89.195 145.620 1.00 0.00 H ATOM 80447 H2 WAT 2692 85.710 88.891 146.754 1.00 0.00 H TER 80449 WAT 2692 ATOM 80449 O WAT 2693 105.144 66.263 119.176 1.00 0.00 O ATOM 80450 H1 WAT 2693 105.630 65.572 118.727 1.00 0.00 H ATOM 80451 H2 WAT 2693 104.423 65.806 119.610 1.00 0.00 H TER 80453 WAT 2693 ATOM 80453 O WAT 2694 11.081 11.049 109.133 1.00 0.00 O ATOM 80454 H1 WAT 2694 12.002 11.169 108.901 1.00 0.00 H ATOM 80455 H2 WAT 2694 10.828 10.236 108.697 1.00 0.00 H TER 80457 WAT 2694 ATOM 80457 O WAT 2695 55.741 45.333 16.602 1.00 0.00 O ATOM 80458 H1 WAT 2695 56.025 44.988 17.448 1.00 0.00 H ATOM 80459 H2 WAT 2695 56.555 45.518 16.133 1.00 0.00 H TER 80461 WAT 2695 ATOM 80461 O WAT 2696 97.384 75.277 13.825 1.00 0.00 O ATOM 80462 H1 WAT 2696 97.224 76.197 13.614 1.00 0.00 H ATOM 80463 H2 WAT 2696 96.529 74.940 14.092 1.00 0.00 H TER 80465 WAT 2696 ATOM 80465 O WAT 2697 107.039 23.902 98.052 1.00 0.00 O ATOM 80466 H1 WAT 2697 107.539 23.938 97.237 1.00 0.00 H ATOM 80467 H2 WAT 2697 107.469 23.219 98.567 1.00 0.00 H TER 80469 WAT 2697 ATOM 80469 O WAT 2698 86.445 10.752 138.983 1.00 0.00 O ATOM 80470 H1 WAT 2698 86.755 10.059 138.400 1.00 0.00 H ATOM 80471 H2 WAT 2698 87.182 11.360 139.045 1.00 0.00 H TER 80473 WAT 2698 ATOM 80473 O WAT 2699 87.125 98.178 107.946 1.00 0.00 O ATOM 80474 H1 WAT 2699 86.190 98.384 107.917 1.00 0.00 H ATOM 80475 H2 WAT 2699 87.422 98.287 107.043 1.00 0.00 H TER 80477 WAT 2699 ATOM 80477 O WAT 2700 21.879 11.659 144.534 1.00 0.00 O ATOM 80478 H1 WAT 2700 22.026 11.103 143.769 1.00 0.00 H ATOM 80479 H2 WAT 2700 22.747 11.764 144.924 1.00 0.00 H TER 80481 WAT 2700 ATOM 80481 O WAT 2701 80.483 18.957 134.245 1.00 0.00 O ATOM 80482 H1 WAT 2701 79.722 18.586 133.798 1.00 0.00 H ATOM 80483 H2 WAT 2701 80.872 19.549 133.601 1.00 0.00 H TER 80485 WAT 2701 ATOM 80485 O WAT 2702 24.358 97.365 27.105 1.00 0.00 O ATOM 80486 H1 WAT 2702 25.144 97.566 26.596 1.00 0.00 H ATOM 80487 H2 WAT 2702 24.145 98.185 27.551 1.00 0.00 H TER 80489 WAT 2702 ATOM 80489 O WAT 2703 56.208 99.042 100.534 1.00 0.00 O ATOM 80490 H1 WAT 2703 55.837 98.241 100.164 1.00 0.00 H ATOM 80491 H2 WAT 2703 55.566 99.324 101.187 1.00 0.00 H TER 80493 WAT 2703 ATOM 80493 O WAT 2704 138.208 55.473 123.134 1.00 0.00 O ATOM 80494 H1 WAT 2704 137.953 54.838 122.466 1.00 0.00 H ATOM 80495 H2 WAT 2704 137.482 55.470 123.758 1.00 0.00 H TER 80497 WAT 2704 ATOM 80497 O WAT 2705 110.515 62.984 64.518 1.00 0.00 O ATOM 80498 H1 WAT 2705 109.644 62.819 64.879 1.00 0.00 H ATOM 80499 H2 WAT 2705 110.397 62.916 63.570 1.00 0.00 H TER 80501 WAT 2705 ATOM 80501 O WAT 2706 97.195 108.217 131.582 1.00 0.00 O ATOM 80502 H1 WAT 2706 96.655 107.462 131.816 1.00 0.00 H ATOM 80503 H2 WAT 2706 96.665 108.976 131.826 1.00 0.00 H TER 80505 WAT 2706 ATOM 80505 O WAT 2707 139.107 104.473 5.108 1.00 0.00 O ATOM 80506 H1 WAT 2707 139.105 103.516 5.137 1.00 0.00 H ATOM 80507 H2 WAT 2707 138.331 104.699 4.596 1.00 0.00 H TER 80509 WAT 2707 ATOM 80509 O WAT 2708 121.091 10.865 120.836 1.00 0.00 O ATOM 80510 H1 WAT 2708 120.842 10.146 120.256 1.00 0.00 H ATOM 80511 H2 WAT 2708 121.360 11.568 120.245 1.00 0.00 H TER 80513 WAT 2708 ATOM 80513 O WAT 2709 136.133 99.362 156.088 1.00 0.00 O ATOM 80514 H1 WAT 2709 136.916 99.574 155.580 1.00 0.00 H ATOM 80515 H2 WAT 2709 135.431 99.322 155.439 1.00 0.00 H TER 80517 WAT 2709 ATOM 80517 O WAT 2710 7.271 123.134 23.576 1.00 0.00 O ATOM 80518 H1 WAT 2710 7.679 122.744 24.349 1.00 0.00 H ATOM 80519 H2 WAT 2710 6.383 123.351 23.858 1.00 0.00 H TER 80521 WAT 2710 ATOM 80521 O WAT 2711 105.048 24.290 120.109 1.00 0.00 O ATOM 80522 H1 WAT 2711 105.672 24.873 120.542 1.00 0.00 H ATOM 80523 H2 WAT 2711 105.591 23.606 119.717 1.00 0.00 H TER 80525 WAT 2711 ATOM 80525 O WAT 2712 6.101 120.988 6.197 1.00 0.00 O ATOM 80526 H1 WAT 2712 6.145 121.828 5.740 1.00 0.00 H ATOM 80527 H2 WAT 2712 5.778 121.207 7.071 1.00 0.00 H TER 80529 WAT 2712 ATOM 80529 O WAT 2713 3.172 12.155 146.196 1.00 0.00 O ATOM 80530 H1 WAT 2713 2.704 11.380 146.508 1.00 0.00 H ATOM 80531 H2 WAT 2713 2.481 12.760 145.928 1.00 0.00 H TER 80533 WAT 2713 ATOM 80533 O WAT 2714 7.268 38.718 74.732 1.00 0.00 O ATOM 80534 H1 WAT 2714 6.984 37.833 74.960 1.00 0.00 H ATOM 80535 H2 WAT 2714 7.881 38.959 75.426 1.00 0.00 H TER 80537 WAT 2714 ATOM 80537 O WAT 2715 40.357 104.553 150.873 1.00 0.00 O ATOM 80538 H1 WAT 2715 40.964 105.010 151.455 1.00 0.00 H ATOM 80539 H2 WAT 2715 39.489 104.773 151.212 1.00 0.00 H TER 80541 WAT 2715 ATOM 80541 O WAT 2716 48.702 75.547 65.868 1.00 0.00 O ATOM 80542 H1 WAT 2716 49.004 75.339 66.752 1.00 0.00 H ATOM 80543 H2 WAT 2716 49.480 75.447 65.319 1.00 0.00 H TER 80545 WAT 2716 ATOM 80545 O WAT 2717 71.180 98.776 127.514 1.00 0.00 O ATOM 80546 H1 WAT 2717 70.495 98.310 127.993 1.00 0.00 H ATOM 80547 H2 WAT 2717 71.319 98.254 126.725 1.00 0.00 H TER 80549 WAT 2717 ATOM 80549 O WAT 2718 79.956 113.091 63.242 1.00 0.00 O ATOM 80550 H1 WAT 2718 79.040 113.035 63.513 1.00 0.00 H ATOM 80551 H2 WAT 2718 79.920 113.385 62.332 1.00 0.00 H TER 80553 WAT 2718 ATOM 80553 O WAT 2719 60.878 129.063 52.530 1.00 0.00 O ATOM 80554 H1 WAT 2719 60.310 129.194 51.771 1.00 0.00 H ATOM 80555 H2 WAT 2719 60.373 128.495 53.112 1.00 0.00 H TER 80557 WAT 2719 ATOM 80557 O WAT 2720 111.402 69.402 137.138 1.00 0.00 O ATOM 80558 H1 WAT 2720 112.264 69.742 136.898 1.00 0.00 H ATOM 80559 H2 WAT 2720 111.212 69.808 137.984 1.00 0.00 H TER 80561 WAT 2720 ATOM 80561 O WAT 2721 83.215 122.069 4.482 1.00 0.00 O ATOM 80562 H1 WAT 2721 84.024 122.496 4.765 1.00 0.00 H ATOM 80563 H2 WAT 2721 82.626 122.149 5.232 1.00 0.00 H TER 80565 WAT 2721 ATOM 80565 O WAT 2722 6.201 65.832 116.691 1.00 0.00 O ATOM 80566 H1 WAT 2722 6.894 65.274 117.044 1.00 0.00 H ATOM 80567 H2 WAT 2722 5.708 66.117 117.460 1.00 0.00 H TER 80569 WAT 2722 ATOM 80569 O WAT 2723 98.461 128.383 93.748 1.00 0.00 O ATOM 80570 H1 WAT 2723 98.272 129.001 94.454 1.00 0.00 H ATOM 80571 H2 WAT 2723 98.890 128.912 93.075 1.00 0.00 H TER 80573 WAT 2723 ATOM 80573 O WAT 2724 61.632 9.904 99.043 1.00 0.00 O ATOM 80574 H1 WAT 2724 61.150 10.604 99.482 1.00 0.00 H ATOM 80575 H2 WAT 2724 62.433 10.325 98.730 1.00 0.00 H TER 80577 WAT 2724 ATOM 80577 O WAT 2725 1.067 64.189 110.595 1.00 0.00 O ATOM 80578 H1 WAT 2725 0.885 64.410 109.682 1.00 0.00 H ATOM 80579 H2 WAT 2725 1.901 64.618 110.784 1.00 0.00 H TER 80581 WAT 2725 ATOM 80581 O WAT 2726 54.186 34.828 77.122 1.00 0.00 O ATOM 80582 H1 WAT 2726 54.732 34.056 76.976 1.00 0.00 H ATOM 80583 H2 WAT 2726 54.120 35.241 76.261 1.00 0.00 H TER 80585 WAT 2726 ATOM 80585 O WAT 2727 42.528 75.819 6.035 1.00 0.00 O ATOM 80586 H1 WAT 2727 43.439 75.833 6.327 1.00 0.00 H ATOM 80587 H2 WAT 2727 42.050 76.287 6.719 1.00 0.00 H TER 80589 WAT 2727 ATOM 80589 O WAT 2728 34.507 114.728 155.114 1.00 0.00 O ATOM 80590 H1 WAT 2728 34.375 115.418 155.764 1.00 0.00 H ATOM 80591 H2 WAT 2728 35.388 114.884 154.775 1.00 0.00 H TER 80593 WAT 2728 ATOM 80593 O WAT 2729 71.172 35.144 4.650 1.00 0.00 O ATOM 80594 H1 WAT 2729 70.613 34.790 5.342 1.00 0.00 H ATOM 80595 H2 WAT 2729 71.384 34.389 4.102 1.00 0.00 H TER 80597 WAT 2729 ATOM 80597 O WAT 2730 112.425 97.847 21.863 1.00 0.00 O ATOM 80598 H1 WAT 2730 112.214 97.588 22.760 1.00 0.00 H ATOM 80599 H2 WAT 2730 113.376 97.950 21.861 1.00 0.00 H TER 80601 WAT 2730 ATOM 80601 O WAT 2731 96.073 40.474 79.002 1.00 0.00 O ATOM 80602 H1 WAT 2731 95.857 39.865 78.296 1.00 0.00 H ATOM 80603 H2 WAT 2731 95.663 41.299 78.741 1.00 0.00 H TER 80605 WAT 2731 ATOM 80605 O WAT 2732 102.961 55.135 110.715 1.00 0.00 O ATOM 80606 H1 WAT 2732 103.391 55.613 110.006 1.00 0.00 H ATOM 80607 H2 WAT 2732 103.059 54.213 110.476 1.00 0.00 H TER 80609 WAT 2732 ATOM 80609 O WAT 2733 38.915 123.941 107.015 1.00 0.00 O ATOM 80610 H1 WAT 2733 38.298 124.671 107.077 1.00 0.00 H ATOM 80611 H2 WAT 2733 39.381 123.950 107.851 1.00 0.00 H TER 80613 WAT 2733 ATOM 80613 O WAT 2734 27.689 90.671 5.612 1.00 0.00 O ATOM 80614 H1 WAT 2734 28.134 91.438 5.251 1.00 0.00 H ATOM 80615 H2 WAT 2734 27.967 89.947 5.051 1.00 0.00 H TER 80617 WAT 2734 ATOM 80617 O WAT 2735 48.378 89.937 139.129 1.00 0.00 O ATOM 80618 H1 WAT 2735 49.079 90.565 139.304 1.00 0.00 H ATOM 80619 H2 WAT 2735 48.458 89.287 139.827 1.00 0.00 H TER 80621 WAT 2735 ATOM 80621 O WAT 2736 84.606 37.992 83.462 1.00 0.00 O ATOM 80622 H1 WAT 2736 85.030 37.793 82.627 1.00 0.00 H ATOM 80623 H2 WAT 2736 85.141 37.542 84.115 1.00 0.00 H TER 80625 WAT 2736 ATOM 80625 O WAT 2737 29.917 36.887 72.315 1.00 0.00 O ATOM 80626 H1 WAT 2737 29.232 36.237 72.471 1.00 0.00 H ATOM 80627 H2 WAT 2737 29.716 37.244 71.450 1.00 0.00 H TER 80629 WAT 2737 ATOM 80629 O WAT 2738 124.693 94.738 107.690 1.00 0.00 O ATOM 80630 H1 WAT 2738 124.810 95.683 107.594 1.00 0.00 H ATOM 80631 H2 WAT 2738 125.235 94.358 106.999 1.00 0.00 H TER 80633 WAT 2738 ATOM 80633 O WAT 2739 28.318 140.327 113.430 1.00 0.00 O ATOM 80634 H1 WAT 2739 28.876 140.501 114.188 1.00 0.00 H ATOM 80635 H2 WAT 2739 27.446 140.191 113.801 1.00 0.00 H TER 80637 WAT 2739 ATOM 80637 O WAT 2740 85.345 93.476 108.674 1.00 0.00 O ATOM 80638 H1 WAT 2740 85.348 92.629 109.120 1.00 0.00 H ATOM 80639 H2 WAT 2740 84.423 93.637 108.473 1.00 0.00 H TER 80641 WAT 2740 ATOM 80641 O WAT 2741 2.590 104.637 0.476 1.00 0.00 O ATOM 80642 H1 WAT 2741 2.976 104.466 1.335 1.00 0.00 H ATOM 80643 H2 WAT 2741 3.230 105.195 0.033 1.00 0.00 H TER 80645 WAT 2741 ATOM 80645 O WAT 2742 56.411 10.858 16.575 1.00 0.00 O ATOM 80646 H1 WAT 2742 56.701 10.832 17.487 1.00 0.00 H ATOM 80647 H2 WAT 2742 57.031 10.298 16.110 1.00 0.00 H TER 80649 WAT 2742 ATOM 80649 O WAT 2743 14.827 115.079 1.832 1.00 0.00 O ATOM 80650 H1 WAT 2743 15.121 115.664 2.530 1.00 0.00 H ATOM 80651 H2 WAT 2743 13.873 115.074 1.910 1.00 0.00 H TER 80653 WAT 2743 ATOM 80653 O WAT 2744 115.564 46.761 55.083 1.00 0.00 O ATOM 80654 H1 WAT 2744 116.233 47.337 55.452 1.00 0.00 H ATOM 80655 H2 WAT 2744 116.059 46.099 54.599 1.00 0.00 H TER 80657 WAT 2744 ATOM 80657 O WAT 2745 126.666 36.662 109.706 1.00 0.00 O ATOM 80658 H1 WAT 2745 126.869 36.635 110.641 1.00 0.00 H ATOM 80659 H2 WAT 2745 126.178 37.478 109.591 1.00 0.00 H TER 80661 WAT 2745 ATOM 80661 O WAT 2746 2.023 24.092 24.162 1.00 0.00 O ATOM 80662 H1 WAT 2746 2.016 24.739 24.868 1.00 0.00 H ATOM 80663 H2 WAT 2746 1.333 24.379 23.566 1.00 0.00 H TER 80665 WAT 2746 ATOM 80665 O WAT 2747 72.708 142.887 65.797 1.00 0.00 O ATOM 80666 H1 WAT 2747 73.219 143.693 65.717 1.00 0.00 H ATOM 80667 H2 WAT 2747 71.804 143.186 65.895 1.00 0.00 H TER 80669 WAT 2747 ATOM 80669 O WAT 2748 120.820 85.629 108.866 1.00 0.00 O ATOM 80670 H1 WAT 2748 120.590 86.068 109.685 1.00 0.00 H ATOM 80671 H2 WAT 2748 120.127 84.981 108.739 1.00 0.00 H TER 80673 WAT 2748 ATOM 80673 O WAT 2749 90.322 5.730 88.011 1.00 0.00 O ATOM 80674 H1 WAT 2749 89.554 5.545 87.471 1.00 0.00 H ATOM 80675 H2 WAT 2749 90.481 4.916 88.489 1.00 0.00 H TER 80677 WAT 2749 ATOM 80677 O WAT 2750 136.513 84.159 57.215 1.00 0.00 O ATOM 80678 H1 WAT 2750 135.591 83.976 57.395 1.00 0.00 H ATOM 80679 H2 WAT 2750 136.608 84.007 56.274 1.00 0.00 H TER 80681 WAT 2750 ATOM 80681 O WAT 2751 80.542 37.902 74.509 1.00 0.00 O ATOM 80682 H1 WAT 2751 80.146 37.809 73.643 1.00 0.00 H ATOM 80683 H2 WAT 2751 81.325 37.352 74.474 1.00 0.00 H TER 80685 WAT 2751 ATOM 80685 O WAT 2752 29.345 71.296 2.063 1.00 0.00 O ATOM 80686 H1 WAT 2752 29.215 72.067 1.511 1.00 0.00 H ATOM 80687 H2 WAT 2752 29.071 70.561 1.515 1.00 0.00 H TER 80689 WAT 2752 ATOM 80689 O WAT 2753 6.978 60.112 155.006 1.00 0.00 O ATOM 80690 H1 WAT 2753 6.050 60.003 155.213 1.00 0.00 H ATOM 80691 H2 WAT 2753 7.320 60.652 155.719 1.00 0.00 H TER 80693 WAT 2753 ATOM 80693 O WAT 2754 119.185 134.151 70.528 1.00 0.00 O ATOM 80694 H1 WAT 2754 118.921 134.951 70.984 1.00 0.00 H ATOM 80695 H2 WAT 2754 118.880 133.442 71.094 1.00 0.00 H TER 80697 WAT 2754 ATOM 80697 O WAT 2755 77.765 39.270 89.734 1.00 0.00 O ATOM 80698 H1 WAT 2755 77.103 38.584 89.646 1.00 0.00 H ATOM 80699 H2 WAT 2755 78.104 39.162 90.623 1.00 0.00 H TER 80701 WAT 2755 ATOM 80701 O WAT 2756 48.180 13.803 153.872 1.00 0.00 O ATOM 80702 H1 WAT 2756 47.505 13.630 153.215 1.00 0.00 H ATOM 80703 H2 WAT 2756 47.770 13.565 154.704 1.00 0.00 H TER 80705 WAT 2756 ATOM 80705 O WAT 2757 13.395 3.920 25.186 1.00 0.00 O ATOM 80706 H1 WAT 2757 13.947 4.649 25.469 1.00 0.00 H ATOM 80707 H2 WAT 2757 13.998 3.181 25.101 1.00 0.00 H TER 80709 WAT 2757 ATOM 80709 O WAT 2758 47.629 0.194 70.431 1.00 0.00 O ATOM 80710 H1 WAT 2758 48.250 0.923 70.419 1.00 0.00 H ATOM 80711 H2 WAT 2758 48.179 -0.588 70.479 1.00 0.00 H TER 80713 WAT 2758 ATOM 80713 O WAT 2759 92.069 12.033 87.828 1.00 0.00 O ATOM 80714 H1 WAT 2759 91.320 11.439 87.865 1.00 0.00 H ATOM 80715 H2 WAT 2759 92.513 11.808 87.011 1.00 0.00 H TER 80717 WAT 2759 ATOM 80717 O WAT 2760 40.790 98.852 112.998 1.00 0.00 O ATOM 80718 H1 WAT 2760 40.704 99.791 112.835 1.00 0.00 H ATOM 80719 H2 WAT 2760 39.993 98.470 112.631 1.00 0.00 H TER 80721 WAT 2760 ATOM 80721 O WAT 2761 127.462 46.771 124.137 1.00 0.00 O ATOM 80722 H1 WAT 2761 127.400 47.553 124.686 1.00 0.00 H ATOM 80723 H2 WAT 2761 127.329 46.042 124.743 1.00 0.00 H TER 80725 WAT 2761 ATOM 80725 O WAT 2762 143.029 48.227 149.674 1.00 0.00 O ATOM 80726 H1 WAT 2762 142.780 47.448 150.170 1.00 0.00 H ATOM 80727 H2 WAT 2762 142.244 48.457 149.178 1.00 0.00 H TER 80729 WAT 2762 ATOM 80729 O WAT 2763 102.338 21.915 115.752 1.00 0.00 O ATOM 80730 H1 WAT 2763 102.153 21.814 116.686 1.00 0.00 H ATOM 80731 H2 WAT 2763 103.055 22.548 115.717 1.00 0.00 H TER 80733 WAT 2763 ATOM 80733 O WAT 2764 132.562 121.296 79.860 1.00 0.00 O ATOM 80734 H1 WAT 2764 133.260 121.571 79.265 1.00 0.00 H ATOM 80735 H2 WAT 2764 132.503 120.349 79.740 1.00 0.00 H TER 80737 WAT 2764 ATOM 80737 O WAT 2765 50.236 70.103 141.514 1.00 0.00 O ATOM 80738 H1 WAT 2765 50.699 70.741 142.057 1.00 0.00 H ATOM 80739 H2 WAT 2765 50.191 70.511 140.649 1.00 0.00 H TER 80741 WAT 2765 ATOM 80741 O WAT 2766 132.672 122.537 158.066 1.00 0.00 O ATOM 80742 H1 WAT 2766 132.098 121.869 157.691 1.00 0.00 H ATOM 80743 H2 WAT 2766 132.768 123.188 157.371 1.00 0.00 H TER 80745 WAT 2766 ATOM 80745 O WAT 2767 38.760 34.372 3.817 1.00 0.00 O ATOM 80746 H1 WAT 2767 37.851 34.313 4.111 1.00 0.00 H ATOM 80747 H2 WAT 2767 38.893 35.302 3.636 1.00 0.00 H TER 80749 WAT 2767 ATOM 80749 O WAT 2768 33.313 101.565 88.781 1.00 0.00 O ATOM 80750 H1 WAT 2768 33.477 100.657 88.526 1.00 0.00 H ATOM 80751 H2 WAT 2768 33.713 102.086 88.085 1.00 0.00 H TER 80753 WAT 2768 ATOM 80753 O WAT 2769 73.171 113.975 75.589 1.00 0.00 O ATOM 80754 H1 WAT 2769 73.747 113.212 75.635 1.00 0.00 H ATOM 80755 H2 WAT 2769 73.712 114.660 75.197 1.00 0.00 H TER 80757 WAT 2769 ATOM 80757 O WAT 2770 2.784 124.770 139.182 1.00 0.00 O ATOM 80758 H1 WAT 2770 2.474 124.921 140.074 1.00 0.00 H ATOM 80759 H2 WAT 2770 3.555 125.331 139.098 1.00 0.00 H TER 80761 WAT 2770 ATOM 80761 O WAT 2771 63.948 106.695 146.035 1.00 0.00 O ATOM 80762 H1 WAT 2771 63.201 107.275 146.185 1.00 0.00 H ATOM 80763 H2 WAT 2771 63.943 106.101 146.786 1.00 0.00 H TER 80765 WAT 2771 ATOM 80765 O WAT 2772 116.584 108.728 118.821 1.00 0.00 O ATOM 80766 H1 WAT 2772 116.377 108.693 117.888 1.00 0.00 H ATOM 80767 H2 WAT 2772 117.271 108.072 118.939 1.00 0.00 H TER 80769 WAT 2772 ATOM 80769 O WAT 2773 81.992 64.795 119.233 1.00 0.00 O ATOM 80770 H1 WAT 2773 81.890 65.688 119.560 1.00 0.00 H ATOM 80771 H2 WAT 2773 82.905 64.575 119.416 1.00 0.00 H TER 80773 WAT 2773 ATOM 80773 O WAT 2774 3.423 106.174 81.450 1.00 0.00 O ATOM 80774 H1 WAT 2774 3.179 105.340 81.049 1.00 0.00 H ATOM 80775 H2 WAT 2774 3.694 106.723 80.714 1.00 0.00 H TER 80777 WAT 2774 ATOM 80777 O WAT 2775 141.891 104.514 101.176 1.00 0.00 O ATOM 80778 H1 WAT 2775 141.982 105.401 101.523 1.00 0.00 H ATOM 80779 H2 WAT 2775 142.566 104.450 100.501 1.00 0.00 H TER 80781 WAT 2775 ATOM 80781 O WAT 2776 136.894 13.840 10.015 1.00 0.00 O ATOM 80782 H1 WAT 2776 137.756 14.257 9.992 1.00 0.00 H ATOM 80783 H2 WAT 2776 136.402 14.270 9.316 1.00 0.00 H TER 80785 WAT 2776 ATOM 80785 O WAT 2777 64.607 122.801 89.255 1.00 0.00 O ATOM 80786 H1 WAT 2777 65.171 122.211 89.755 1.00 0.00 H ATOM 80787 H2 WAT 2777 64.399 123.509 89.864 1.00 0.00 H TER 80789 WAT 2777 ATOM 80789 O WAT 2778 0.828 31.057 85.617 1.00 0.00 O ATOM 80790 H1 WAT 2778 0.562 31.618 84.888 1.00 0.00 H ATOM 80791 H2 WAT 2778 0.191 31.243 86.307 1.00 0.00 H TER 80793 WAT 2778 ATOM 80793 O WAT 2779 129.383 141.671 69.760 1.00 0.00 O ATOM 80794 H1 WAT 2779 129.473 140.761 70.043 1.00 0.00 H ATOM 80795 H2 WAT 2779 130.276 142.014 69.767 1.00 0.00 H TER 80797 WAT 2779 ATOM 80797 O WAT 2780 122.595 83.652 74.919 1.00 0.00 O ATOM 80798 H1 WAT 2780 123.480 83.873 74.631 1.00 0.00 H ATOM 80799 H2 WAT 2780 122.644 82.726 75.155 1.00 0.00 H TER 80801 WAT 2780 ATOM 80801 O WAT 2781 24.316 135.402 58.038 1.00 0.00 O ATOM 80802 H1 WAT 2781 23.802 135.645 58.808 1.00 0.00 H ATOM 80803 H2 WAT 2781 25.176 135.169 58.387 1.00 0.00 H TER 80805 WAT 2781 ATOM 80805 O WAT 2782 141.340 1.302 62.705 1.00 0.00 O ATOM 80806 H1 WAT 2782 141.485 2.011 62.078 1.00 0.00 H ATOM 80807 H2 WAT 2782 142.104 0.733 62.604 1.00 0.00 H TER 80809 WAT 2782 ATOM 80809 O WAT 2783 50.636 12.728 9.726 1.00 0.00 O ATOM 80810 H1 WAT 2783 51.207 13.332 10.200 1.00 0.00 H ATOM 80811 H2 WAT 2783 49.756 12.932 10.041 1.00 0.00 H TER 80813 WAT 2783 ATOM 80813 O WAT 2784 31.253 132.600 13.442 1.00 0.00 O ATOM 80814 H1 WAT 2784 31.264 131.662 13.252 1.00 0.00 H ATOM 80815 H2 WAT 2784 31.938 132.719 14.100 1.00 0.00 H TER 80817 WAT 2784 ATOM 80817 O WAT 2785 39.250 139.167 145.563 1.00 0.00 O ATOM 80818 H1 WAT 2785 39.292 139.018 144.619 1.00 0.00 H ATOM 80819 H2 WAT 2785 38.621 138.519 145.880 1.00 0.00 H TER 80821 WAT 2785 ATOM 80821 O WAT 2786 115.448 95.208 157.298 1.00 0.00 O ATOM 80822 H1 WAT 2786 116.006 94.573 156.849 1.00 0.00 H ATOM 80823 H2 WAT 2786 114.627 94.741 157.450 1.00 0.00 H TER 80825 WAT 2786 ATOM 80825 O WAT 2787 136.036 17.302 62.622 1.00 0.00 O ATOM 80826 H1 WAT 2787 135.193 17.753 62.584 1.00 0.00 H ATOM 80827 H2 WAT 2787 136.071 16.789 61.814 1.00 0.00 H TER 80829 WAT 2787 ATOM 80829 O WAT 2788 9.543 22.626 104.161 1.00 0.00 O ATOM 80830 H1 WAT 2788 10.364 22.200 104.410 1.00 0.00 H ATOM 80831 H2 WAT 2788 9.710 22.972 103.284 1.00 0.00 H TER 80833 WAT 2788 ATOM 80833 O WAT 2789 121.506 118.356 149.372 1.00 0.00 O ATOM 80834 H1 WAT 2789 120.924 117.910 149.986 1.00 0.00 H ATOM 80835 H2 WAT 2789 121.974 118.997 149.908 1.00 0.00 H TER 80837 WAT 2789 ATOM 80837 O WAT 2790 119.825 7.929 3.041 1.00 0.00 O ATOM 80838 H1 WAT 2790 120.326 8.451 3.667 1.00 0.00 H ATOM 80839 H2 WAT 2790 119.555 7.155 3.536 1.00 0.00 H TER 80841 WAT 2790 ATOM 80841 O WAT 2791 118.707 99.024 136.255 1.00 0.00 O ATOM 80842 H1 WAT 2791 118.383 99.520 135.503 1.00 0.00 H ATOM 80843 H2 WAT 2791 118.912 99.690 136.911 1.00 0.00 H TER 80845 WAT 2791 ATOM 80845 O WAT 2792 137.513 8.382 75.840 1.00 0.00 O ATOM 80846 H1 WAT 2792 137.078 8.370 76.692 1.00 0.00 H ATOM 80847 H2 WAT 2792 136.797 8.401 75.205 1.00 0.00 H TER 80849 WAT 2792 ATOM 80849 O WAT 2793 26.525 59.307 57.972 1.00 0.00 O ATOM 80850 H1 WAT 2793 27.400 58.956 58.135 1.00 0.00 H ATOM 80851 H2 WAT 2793 26.172 58.756 57.274 1.00 0.00 H TER 80853 WAT 2793 ATOM 80853 O WAT 2794 129.483 71.805 83.529 1.00 0.00 O ATOM 80854 H1 WAT 2794 128.564 71.932 83.768 1.00 0.00 H ATOM 80855 H2 WAT 2794 129.767 72.661 83.210 1.00 0.00 H TER 80857 WAT 2794 ATOM 80857 O WAT 2795 3.549 143.175 124.051 1.00 0.00 O ATOM 80858 H1 WAT 2795 4.336 142.630 124.024 1.00 0.00 H ATOM 80859 H2 WAT 2795 2.826 142.549 124.079 1.00 0.00 H TER 80861 WAT 2795 ATOM 80861 O WAT 2796 60.434 141.884 93.534 1.00 0.00 O ATOM 80862 H1 WAT 2796 60.241 142.070 94.453 1.00 0.00 H ATOM 80863 H2 WAT 2796 60.069 142.629 93.057 1.00 0.00 H TER 80865 WAT 2796 ATOM 80865 O WAT 2797 2.084 50.167 19.864 1.00 0.00 O ATOM 80866 H1 WAT 2797 2.776 49.885 19.265 1.00 0.00 H ATOM 80867 H2 WAT 2797 1.283 49.794 19.497 1.00 0.00 H TER 80869 WAT 2797 ATOM 80869 O WAT 2798 75.447 28.976 114.290 1.00 0.00 O ATOM 80870 H1 WAT 2798 75.843 28.245 114.764 1.00 0.00 H ATOM 80871 H2 WAT 2798 74.564 29.048 114.654 1.00 0.00 H TER 80873 WAT 2798 ATOM 80873 O WAT 2799 84.769 129.773 9.156 1.00 0.00 O ATOM 80874 H1 WAT 2799 84.775 129.064 9.800 1.00 0.00 H ATOM 80875 H2 WAT 2799 83.853 129.845 8.887 1.00 0.00 H TER 80877 WAT 2799 ATOM 80877 O WAT 2800 111.037 36.178 139.367 1.00 0.00 O ATOM 80878 H1 WAT 2800 111.338 35.606 140.073 1.00 0.00 H ATOM 80879 H2 WAT 2800 111.841 36.503 138.963 1.00 0.00 H TER 80881 WAT 2800 ATOM 80881 O WAT 2801 83.271 54.080 157.780 1.00 0.00 O ATOM 80882 H1 WAT 2801 82.622 54.713 158.086 1.00 0.00 H ATOM 80883 H2 WAT 2801 84.104 54.406 158.121 1.00 0.00 H TER 80885 WAT 2801 ATOM 80885 O WAT 2802 96.770 62.715 71.143 1.00 0.00 O ATOM 80886 H1 WAT 2802 96.832 62.363 72.031 1.00 0.00 H ATOM 80887 H2 WAT 2802 97.543 63.274 71.053 1.00 0.00 H TER 80889 WAT 2802 ATOM 80889 O WAT 2803 14.914 36.279 91.317 1.00 0.00 O ATOM 80890 H1 WAT 2803 14.897 36.874 90.568 1.00 0.00 H ATOM 80891 H2 WAT 2803 14.900 36.856 92.081 1.00 0.00 H TER 80893 WAT 2803 ATOM 80893 O WAT 2804 24.376 54.355 100.634 1.00 0.00 O ATOM 80894 H1 WAT 2804 24.654 55.271 100.617 1.00 0.00 H ATOM 80895 H2 WAT 2804 24.572 54.028 99.756 1.00 0.00 H TER 80897 WAT 2804 ATOM 80897 O WAT 2805 107.892 76.901 129.624 1.00 0.00 O ATOM 80898 H1 WAT 2805 108.147 76.153 130.164 1.00 0.00 H ATOM 80899 H2 WAT 2805 106.957 76.772 129.463 1.00 0.00 H TER 80901 WAT 2805 ATOM 80901 O WAT 2806 94.606 21.121 72.259 1.00 0.00 O ATOM 80902 H1 WAT 2806 94.697 20.316 72.769 1.00 0.00 H ATOM 80903 H2 WAT 2806 93.744 21.461 72.500 1.00 0.00 H TER 80905 WAT 2806 ATOM 80905 O WAT 2807 51.727 40.045 127.198 1.00 0.00 O ATOM 80906 H1 WAT 2807 51.585 40.948 127.484 1.00 0.00 H ATOM 80907 H2 WAT 2807 51.704 40.089 126.243 1.00 0.00 H TER 80909 WAT 2807 ATOM 80909 O WAT 2808 136.221 94.343 81.441 1.00 0.00 O ATOM 80910 H1 WAT 2808 135.743 93.780 80.832 1.00 0.00 H ATOM 80911 H2 WAT 2808 136.793 93.745 81.922 1.00 0.00 H TER 80913 WAT 2808 ATOM 80913 O WAT 2809 119.126 8.193 131.699 1.00 0.00 O ATOM 80914 H1 WAT 2809 120.019 8.508 131.558 1.00 0.00 H ATOM 80915 H2 WAT 2809 118.827 8.664 132.476 1.00 0.00 H TER 80917 WAT 2809 ATOM 80917 O WAT 2810 13.855 110.164 145.163 1.00 0.00 O ATOM 80918 H1 WAT 2810 13.462 109.469 144.635 1.00 0.00 H ATOM 80919 H2 WAT 2810 13.185 110.381 145.811 1.00 0.00 H TER 80921 WAT 2810 ATOM 80921 O WAT 2811 25.844 23.664 151.500 1.00 0.00 O ATOM 80922 H1 WAT 2811 25.429 23.015 150.932 1.00 0.00 H ATOM 80923 H2 WAT 2811 25.229 23.776 152.225 1.00 0.00 H TER 80925 WAT 2811 ATOM 80925 O WAT 2812 41.620 22.203 10.875 1.00 0.00 O ATOM 80926 H1 WAT 2812 40.748 21.861 11.072 1.00 0.00 H ATOM 80927 H2 WAT 2812 42.167 21.424 10.777 1.00 0.00 H TER 80929 WAT 2812 ATOM 80929 O WAT 2813 17.107 47.811 121.174 1.00 0.00 O ATOM 80930 H1 WAT 2813 17.263 47.791 122.118 1.00 0.00 H ATOM 80931 H2 WAT 2813 17.437 48.665 120.895 1.00 0.00 H TER 80933 WAT 2813 ATOM 80933 O WAT 2814 63.447 39.914 17.199 1.00 0.00 O ATOM 80934 H1 WAT 2814 62.588 39.493 17.163 1.00 0.00 H ATOM 80935 H2 WAT 2814 63.253 40.847 17.284 1.00 0.00 H TER 80937 WAT 2814 ATOM 80937 O WAT 2815 106.442 100.174 115.968 1.00 0.00 O ATOM 80938 H1 WAT 2815 106.499 100.421 115.045 1.00 0.00 H ATOM 80939 H2 WAT 2815 106.302 101.002 116.429 1.00 0.00 H TER 80941 WAT 2815 ATOM 80941 O WAT 2816 104.712 19.250 120.696 1.00 0.00 O ATOM 80942 H1 WAT 2816 104.816 18.468 121.238 1.00 0.00 H ATOM 80943 H2 WAT 2816 104.115 19.809 121.193 1.00 0.00 H TER 80945 WAT 2816 ATOM 80945 O WAT 2817 82.741 55.143 107.127 1.00 0.00 O ATOM 80946 H1 WAT 2817 82.438 56.051 107.123 1.00 0.00 H ATOM 80947 H2 WAT 2817 83.581 55.173 107.586 1.00 0.00 H TER 80949 WAT 2817 ATOM 80949 O WAT 2818 3.708 136.329 129.490 1.00 0.00 O ATOM 80950 H1 WAT 2818 3.778 136.751 130.346 1.00 0.00 H ATOM 80951 H2 WAT 2818 2.814 136.518 129.203 1.00 0.00 H TER 80953 WAT 2818 ATOM 80953 O WAT 2819 131.654 97.313 98.321 1.00 0.00 O ATOM 80954 H1 WAT 2819 131.083 97.608 97.612 1.00 0.00 H ATOM 80955 H2 WAT 2819 131.169 97.516 99.120 1.00 0.00 H TER 80957 WAT 2819 ATOM 80957 O WAT 2820 21.702 97.301 137.045 1.00 0.00 O ATOM 80958 H1 WAT 2820 20.911 96.781 136.898 1.00 0.00 H ATOM 80959 H2 WAT 2820 21.394 98.208 137.051 1.00 0.00 H TER 80961 WAT 2820 ATOM 80961 O WAT 2821 68.328 67.589 5.430 1.00 0.00 O ATOM 80962 H1 WAT 2821 69.169 68.041 5.500 1.00 0.00 H ATOM 80963 H2 WAT 2821 68.553 66.709 5.130 1.00 0.00 H TER 80965 WAT 2821 ATOM 80965 O WAT 2822 9.569 55.553 93.612 1.00 0.00 O ATOM 80966 H1 WAT 2822 10.279 55.679 94.242 1.00 0.00 H ATOM 80967 H2 WAT 2822 10.000 55.210 92.830 1.00 0.00 H TER 80969 WAT 2822 ATOM 80969 O WAT 2823 98.440 18.330 116.576 1.00 0.00 O ATOM 80970 H1 WAT 2823 99.042 18.143 117.296 1.00 0.00 H ATOM 80971 H2 WAT 2823 97.571 18.284 116.973 1.00 0.00 H TER 80973 WAT 2823 ATOM 80973 O WAT 2824 75.993 46.279 92.799 1.00 0.00 O ATOM 80974 H1 WAT 2824 75.366 45.983 92.139 1.00 0.00 H ATOM 80975 H2 WAT 2824 75.723 45.834 93.602 1.00 0.00 H TER 80977 WAT 2824 ATOM 80977 O WAT 2825 100.312 65.809 143.717 1.00 0.00 O ATOM 80978 H1 WAT 2825 101.210 65.757 143.390 1.00 0.00 H ATOM 80979 H2 WAT 2825 100.405 65.837 144.669 1.00 0.00 H TER 80981 WAT 2825 ATOM 80981 O WAT 2826 119.777 43.029 14.397 1.00 0.00 O ATOM 80982 H1 WAT 2826 119.548 43.171 13.479 1.00 0.00 H ATOM 80983 H2 WAT 2826 119.878 42.080 14.475 1.00 0.00 H TER 80985 WAT 2826 ATOM 80985 O WAT 2827 95.060 117.860 102.424 1.00 0.00 O ATOM 80986 H1 WAT 2827 94.492 118.625 102.331 1.00 0.00 H ATOM 80987 H2 WAT 2827 94.906 117.555 103.318 1.00 0.00 H TER 80989 WAT 2827 ATOM 80989 O WAT 2828 29.489 131.838 150.540 1.00 0.00 O ATOM 80990 H1 WAT 2828 29.128 131.149 149.982 1.00 0.00 H ATOM 80991 H2 WAT 2828 28.721 132.293 150.886 1.00 0.00 H TER 80993 WAT 2828 ATOM 80993 O WAT 2829 25.117 62.556 107.852 1.00 0.00 O ATOM 80994 H1 WAT 2829 24.771 62.860 108.691 1.00 0.00 H ATOM 80995 H2 WAT 2829 24.365 62.576 107.261 1.00 0.00 H TER 80997 WAT 2829 ATOM 80997 O WAT 2830 113.319 109.468 112.788 1.00 0.00 O ATOM 80998 H1 WAT 2830 113.715 108.607 112.653 1.00 0.00 H ATOM 80999 H2 WAT 2830 114.049 110.030 113.044 1.00 0.00 H TER 81001 WAT 2830 ATOM 81001 O WAT 2831 53.481 143.352 13.915 1.00 0.00 O ATOM 81002 H1 WAT 2831 53.938 142.910 13.200 1.00 0.00 H ATOM 81003 H2 WAT 2831 52.701 143.727 13.505 1.00 0.00 H TER 81005 WAT 2831 ATOM 81005 O WAT 2832 21.315 48.781 123.320 1.00 0.00 O ATOM 81006 H1 WAT 2832 21.101 47.859 123.462 1.00 0.00 H ATOM 81007 H2 WAT 2832 20.577 49.123 122.815 1.00 0.00 H TER 81009 WAT 2832 ATOM 81009 O WAT 2833 128.505 73.512 5.873 1.00 0.00 O ATOM 81010 H1 WAT 2833 128.966 73.506 6.712 1.00 0.00 H ATOM 81011 H2 WAT 2833 128.601 74.409 5.553 1.00 0.00 H TER 81013 WAT 2833 ATOM 81013 O WAT 2834 120.213 95.988 155.213 1.00 0.00 O ATOM 81014 H1 WAT 2834 120.775 96.003 154.438 1.00 0.00 H ATOM 81015 H2 WAT 2834 119.962 96.902 155.345 1.00 0.00 H TER 81017 WAT 2834 ATOM 81017 O WAT 2835 72.396 112.748 1.788 1.00 0.00 O ATOM 81018 H1 WAT 2835 72.109 112.610 0.885 1.00 0.00 H ATOM 81019 H2 WAT 2835 71.831 112.178 2.309 1.00 0.00 H TER 81021 WAT 2835 ATOM 81021 O WAT 2836 121.965 109.308 12.975 1.00 0.00 O ATOM 81022 H1 WAT 2836 122.799 109.642 12.645 1.00 0.00 H ATOM 81023 H2 WAT 2836 121.646 108.733 12.280 1.00 0.00 H TER 81025 WAT 2836 ATOM 81025 O WAT 2837 79.195 135.151 157.138 1.00 0.00 O ATOM 81026 H1 WAT 2837 78.566 135.288 157.847 1.00 0.00 H ATOM 81027 H2 WAT 2837 79.883 134.613 157.529 1.00 0.00 H TER 81029 WAT 2837 ATOM 81029 O WAT 2838 67.305 38.551 125.176 1.00 0.00 O ATOM 81030 H1 WAT 2838 67.396 37.600 125.111 1.00 0.00 H ATOM 81031 H2 WAT 2838 68.125 38.842 125.575 1.00 0.00 H TER 81033 WAT 2838 ATOM 81033 O WAT 2839 57.551 122.977 61.126 1.00 0.00 O ATOM 81034 H1 WAT 2839 57.431 123.084 62.070 1.00 0.00 H ATOM 81035 H2 WAT 2839 58.190 122.270 61.045 1.00 0.00 H TER 81037 WAT 2839 ATOM 81037 O WAT 2840 95.722 36.746 16.449 1.00 0.00 O ATOM 81038 H1 WAT 2840 96.184 36.943 17.263 1.00 0.00 H ATOM 81039 H2 WAT 2840 95.366 37.588 16.164 1.00 0.00 H TER 81041 WAT 2840 ATOM 81041 O WAT 2841 39.943 46.495 96.321 1.00 0.00 O ATOM 81042 H1 WAT 2841 39.729 47.132 97.003 1.00 0.00 H ATOM 81043 H2 WAT 2841 39.273 45.816 96.409 1.00 0.00 H TER 81045 WAT 2841 ATOM 81045 O WAT 2842 81.102 57.564 81.707 1.00 0.00 O ATOM 81046 H1 WAT 2842 81.363 56.693 81.409 1.00 0.00 H ATOM 81047 H2 WAT 2842 80.422 57.835 81.090 1.00 0.00 H TER 81049 WAT 2842 ATOM 81049 O WAT 2843 58.609 37.308 75.383 1.00 0.00 O ATOM 81050 H1 WAT 2843 58.518 36.386 75.143 1.00 0.00 H ATOM 81051 H2 WAT 2843 59.042 37.292 76.236 1.00 0.00 H TER 81053 WAT 2843 ATOM 81053 O WAT 2844 59.044 32.519 106.053 1.00 0.00 O ATOM 81054 H1 WAT 2844 59.865 32.277 105.625 1.00 0.00 H ATOM 81055 H2 WAT 2844 58.957 31.894 106.773 1.00 0.00 H TER 81057 WAT 2844 ATOM 81057 O WAT 2845 64.378 128.116 7.259 1.00 0.00 O ATOM 81058 H1 WAT 2845 64.855 127.755 8.007 1.00 0.00 H ATOM 81059 H2 WAT 2845 65.017 128.118 6.546 1.00 0.00 H TER 81061 WAT 2845 ATOM 81061 O WAT 2846 11.012 139.462 117.452 1.00 0.00 O ATOM 81062 H1 WAT 2846 11.589 139.334 116.699 1.00 0.00 H ATOM 81063 H2 WAT 2846 11.385 138.907 118.137 1.00 0.00 H TER 81065 WAT 2846 ATOM 81065 O WAT 2847 0.089 106.519 86.351 1.00 0.00 O ATOM 81066 H1 WAT 2847 0.574 105.857 86.844 1.00 0.00 H ATOM 81067 H2 WAT 2847 0.742 106.912 85.772 1.00 0.00 H TER 81069 WAT 2847 ATOM 81069 O WAT 2848 46.213 13.829 69.185 1.00 0.00 O ATOM 81070 H1 WAT 2848 46.698 14.365 68.558 1.00 0.00 H ATOM 81071 H2 WAT 2848 45.469 14.374 69.442 1.00 0.00 H TER 81073 WAT 2848 ATOM 81073 O WAT 2849 59.441 74.668 82.826 1.00 0.00 O ATOM 81074 H1 WAT 2849 59.493 74.395 83.742 1.00 0.00 H ATOM 81075 H2 WAT 2849 59.867 73.961 82.341 1.00 0.00 H TER 81077 WAT 2849 ATOM 81077 O WAT 2850 56.356 124.084 12.288 1.00 0.00 O ATOM 81078 H1 WAT 2850 55.618 124.616 11.990 1.00 0.00 H ATOM 81079 H2 WAT 2850 55.982 123.507 12.954 1.00 0.00 H TER 81081 WAT 2850 ATOM 81081 O WAT 2851 129.187 66.323 123.441 1.00 0.00 O ATOM 81082 H1 WAT 2851 129.188 66.450 122.493 1.00 0.00 H ATOM 81083 H2 WAT 2851 129.033 67.197 123.800 1.00 0.00 H TER 81085 WAT 2851 ATOM 81085 O WAT 2852 67.957 73.121 132.226 1.00 0.00 O ATOM 81086 H1 WAT 2852 68.685 73.692 132.469 1.00 0.00 H ATOM 81087 H2 WAT 2852 68.372 72.376 131.791 1.00 0.00 H TER 81089 WAT 2852 ATOM 81089 O WAT 2853 135.360 144.602 10.917 1.00 0.00 O ATOM 81090 H1 WAT 2853 135.882 144.320 11.669 1.00 0.00 H ATOM 81091 H2 WAT 2853 134.557 144.085 10.977 1.00 0.00 H TER 81093 WAT 2853 ATOM 81093 O WAT 2854 129.982 77.025 26.595 1.00 0.00 O ATOM 81094 H1 WAT 2854 129.060 77.279 26.559 1.00 0.00 H ATOM 81095 H2 WAT 2854 129.994 76.120 26.283 1.00 0.00 H TER 81097 WAT 2854 ATOM 81097 O WAT 2855 129.539 116.819 148.194 1.00 0.00 O ATOM 81098 H1 WAT 2855 129.494 117.477 148.888 1.00 0.00 H ATOM 81099 H2 WAT 2855 128.711 116.343 148.260 1.00 0.00 H TER 81101 WAT 2855 ATOM 81101 O WAT 2856 49.318 11.781 145.495 1.00 0.00 O ATOM 81102 H1 WAT 2856 48.740 11.131 145.096 1.00 0.00 H ATOM 81103 H2 WAT 2856 49.963 11.264 145.978 1.00 0.00 H TER 81105 WAT 2856 ATOM 81105 O WAT 2857 16.473 136.369 77.508 1.00 0.00 O ATOM 81106 H1 WAT 2857 16.529 136.179 78.444 1.00 0.00 H ATOM 81107 H2 WAT 2857 17.023 137.144 77.388 1.00 0.00 H TER 81109 WAT 2857 ATOM 81109 O WAT 2858 138.700 33.905 91.125 1.00 0.00 O ATOM 81110 H1 WAT 2858 139.070 33.175 90.628 1.00 0.00 H ATOM 81111 H2 WAT 2858 139.449 34.471 91.313 1.00 0.00 H TER 81113 WAT 2858 ATOM 81113 O WAT 2859 106.811 115.005 151.626 1.00 0.00 O ATOM 81114 H1 WAT 2859 107.134 114.333 152.227 1.00 0.00 H ATOM 81115 H2 WAT 2859 106.517 115.715 152.197 1.00 0.00 H TER 81117 WAT 2859 ATOM 81117 O WAT 2860 141.824 126.096 147.564 1.00 0.00 O ATOM 81118 H1 WAT 2860 140.959 126.341 147.237 1.00 0.00 H ATOM 81119 H2 WAT 2860 141.886 125.156 147.397 1.00 0.00 H TER 81121 WAT 2860 ATOM 81121 O WAT 2861 2.957 16.103 74.608 1.00 0.00 O ATOM 81122 H1 WAT 2861 3.637 15.566 75.016 1.00 0.00 H ATOM 81123 H2 WAT 2861 3.038 16.956 75.035 1.00 0.00 H TER 81125 WAT 2861 ATOM 81125 O WAT 2862 69.167 16.821 27.167 1.00 0.00 O ATOM 81126 H1 WAT 2862 69.127 17.720 26.841 1.00 0.00 H ATOM 81127 H2 WAT 2862 70.069 16.716 27.468 1.00 0.00 H TER 81129 WAT 2862 ATOM 81129 O WAT 2863 53.426 93.257 122.977 1.00 0.00 O ATOM 81130 H1 WAT 2863 53.467 92.565 123.637 1.00 0.00 H ATOM 81131 H2 WAT 2863 54.163 93.076 122.394 1.00 0.00 H TER 81133 WAT 2863 ATOM 81133 O WAT 2864 37.099 110.841 9.800 1.00 0.00 O ATOM 81134 H1 WAT 2864 37.382 111.226 8.971 1.00 0.00 H ATOM 81135 H2 WAT 2864 36.327 111.350 10.049 1.00 0.00 H TER 81137 WAT 2864 ATOM 81137 O WAT 2865 100.002 33.683 1.311 1.00 0.00 O ATOM 81138 H1 WAT 2865 99.714 33.927 0.431 1.00 0.00 H ATOM 81139 H2 WAT 2865 100.617 32.963 1.171 1.00 0.00 H TER 81141 WAT 2865 ATOM 81141 O WAT 2866 73.667 109.727 137.282 1.00 0.00 O ATOM 81142 H1 WAT 2866 74.016 110.545 136.930 1.00 0.00 H ATOM 81143 H2 WAT 2866 73.995 109.051 136.689 1.00 0.00 H TER 81145 WAT 2866 ATOM 81145 O WAT 2867 128.194 4.408 64.560 1.00 0.00 O ATOM 81146 H1 WAT 2867 127.679 3.822 64.005 1.00 0.00 H ATOM 81147 H2 WAT 2867 128.388 5.160 64.000 1.00 0.00 H TER 81149 WAT 2867 ATOM 81149 O WAT 2868 8.274 134.305 110.843 1.00 0.00 O ATOM 81150 H1 WAT 2868 8.863 133.693 110.400 1.00 0.00 H ATOM 81151 H2 WAT 2868 8.102 134.985 110.191 1.00 0.00 H TER 81153 WAT 2868 ATOM 81153 O WAT 2869 49.418 2.706 124.545 1.00 0.00 O ATOM 81154 H1 WAT 2869 48.866 3.460 124.751 1.00 0.00 H ATOM 81155 H2 WAT 2869 49.561 2.764 123.600 1.00 0.00 H TER 81157 WAT 2869 ATOM 81157 O WAT 2870 144.782 70.102 127.532 1.00 0.00 O ATOM 81158 H1 WAT 2870 145.383 69.926 126.808 1.00 0.00 H ATOM 81159 H2 WAT 2870 145.128 69.588 128.262 1.00 0.00 H TER 81161 WAT 2870 ATOM 81161 O WAT 2871 97.295 101.298 8.188 1.00 0.00 O ATOM 81162 H1 WAT 2871 97.052 100.431 7.863 1.00 0.00 H ATOM 81163 H2 WAT 2871 96.479 101.799 8.167 1.00 0.00 H TER 81165 WAT 2871 ATOM 81165 O WAT 2872 15.950 74.340 131.067 1.00 0.00 O ATOM 81166 H1 WAT 2872 16.846 74.239 130.744 1.00 0.00 H ATOM 81167 H2 WAT 2872 15.792 73.551 131.585 1.00 0.00 H TER 81169 WAT 2872 ATOM 81169 O WAT 2873 99.461 44.140 79.065 1.00 0.00 O ATOM 81170 H1 WAT 2873 99.000 43.804 78.297 1.00 0.00 H ATOM 81171 H2 WAT 2873 100.089 43.453 79.287 1.00 0.00 H TER 81173 WAT 2873 ATOM 81173 O WAT 2874 75.566 22.527 58.474 1.00 0.00 O ATOM 81174 H1 WAT 2874 74.613 22.575 58.408 1.00 0.00 H ATOM 81175 H2 WAT 2874 75.856 22.294 57.592 1.00 0.00 H TER 81177 WAT 2874 ATOM 81177 O WAT 2875 83.732 103.681 7.864 1.00 0.00 O ATOM 81178 H1 WAT 2875 83.136 104.349 8.202 1.00 0.00 H ATOM 81179 H2 WAT 2875 84.327 103.501 8.592 1.00 0.00 H TER 81181 WAT 2875 ATOM 81181 O WAT 2876 117.534 135.717 62.267 1.00 0.00 O ATOM 81182 H1 WAT 2876 117.037 135.559 61.465 1.00 0.00 H ATOM 81183 H2 WAT 2876 118.082 136.475 62.063 1.00 0.00 H TER 81185 WAT 2876 ATOM 81185 O WAT 2877 75.188 144.154 116.730 1.00 0.00 O ATOM 81186 H1 WAT 2877 74.967 144.637 115.933 1.00 0.00 H ATOM 81187 H2 WAT 2877 74.678 143.346 116.669 1.00 0.00 H TER 81189 WAT 2877 ATOM 81189 O WAT 2878 145.199 70.557 0.927 1.00 0.00 O ATOM 81190 H1 WAT 2878 145.991 70.147 1.275 1.00 0.00 H ATOM 81191 H2 WAT 2878 145.072 71.334 1.471 1.00 0.00 H TER 81193 WAT 2878 ATOM 81193 O WAT 2879 56.992 5.181 154.752 1.00 0.00 O ATOM 81194 H1 WAT 2879 56.153 5.154 155.212 1.00 0.00 H ATOM 81195 H2 WAT 2879 57.212 6.112 154.711 1.00 0.00 H TER 81197 WAT 2879 ATOM 81197 O WAT 2880 103.934 15.045 62.730 1.00 0.00 O ATOM 81198 H1 WAT 2880 104.891 15.061 62.752 1.00 0.00 H ATOM 81199 H2 WAT 2880 103.719 14.816 61.825 1.00 0.00 H TER 81201 WAT 2880 ATOM 81201 O WAT 2881 1.819 12.339 124.623 1.00 0.00 O ATOM 81202 H1 WAT 2881 1.923 11.487 124.200 1.00 0.00 H ATOM 81203 H2 WAT 2881 2.320 12.942 124.073 1.00 0.00 H TER 81205 WAT 2881 ATOM 81205 O WAT 2882 46.444 60.652 131.573 1.00 0.00 O ATOM 81206 H1 WAT 2882 46.551 60.318 132.463 1.00 0.00 H ATOM 81207 H2 WAT 2882 45.950 59.970 131.118 1.00 0.00 H TER 81209 WAT 2882 ATOM 81209 O WAT 2883 59.608 27.251 95.289 1.00 0.00 O ATOM 81210 H1 WAT 2883 59.984 27.866 95.919 1.00 0.00 H ATOM 81211 H2 WAT 2883 59.109 27.802 94.685 1.00 0.00 H TER 81213 WAT 2883 ATOM 81213 O WAT 2884 52.432 126.629 18.994 1.00 0.00 O ATOM 81214 H1 WAT 2884 52.142 127.301 18.377 1.00 0.00 H ATOM 81215 H2 WAT 2884 52.687 125.890 18.442 1.00 0.00 H TER 81217 WAT 2884 ATOM 81217 O WAT 2885 135.734 53.509 89.041 1.00 0.00 O ATOM 81218 H1 WAT 2885 135.531 52.945 89.787 1.00 0.00 H ATOM 81219 H2 WAT 2885 136.504 53.108 88.639 1.00 0.00 H TER 81221 WAT 2885 ATOM 81221 O WAT 2886 41.301 127.988 65.792 1.00 0.00 O ATOM 81222 H1 WAT 2886 41.539 128.800 66.240 1.00 0.00 H ATOM 81223 H2 WAT 2886 40.460 128.180 65.377 1.00 0.00 H TER 81225 WAT 2886 ATOM 81225 O WAT 2887 127.420 88.242 123.660 1.00 0.00 O ATOM 81226 H1 WAT 2887 127.919 88.113 124.467 1.00 0.00 H ATOM 81227 H2 WAT 2887 127.230 87.356 123.351 1.00 0.00 H TER 81229 WAT 2887 ATOM 81229 O WAT 2888 23.926 124.429 153.573 1.00 0.00 O ATOM 81230 H1 WAT 2888 23.406 124.909 154.217 1.00 0.00 H ATOM 81231 H2 WAT 2888 24.517 123.888 154.098 1.00 0.00 H TER 81233 WAT 2888 ATOM 81233 O WAT 2889 36.279 71.776 90.213 1.00 0.00 O ATOM 81234 H1 WAT 2889 36.286 71.740 89.256 1.00 0.00 H ATOM 81235 H2 WAT 2889 36.791 71.014 90.485 1.00 0.00 H TER 81237 WAT 2889 ATOM 81237 O WAT 2890 59.138 48.852 73.851 1.00 0.00 O ATOM 81238 H1 WAT 2890 58.891 47.934 73.741 1.00 0.00 H ATOM 81239 H2 WAT 2890 60.028 48.820 74.203 1.00 0.00 H TER 81241 WAT 2890 ATOM 81241 O WAT 2891 86.382 135.196 121.147 1.00 0.00 O ATOM 81242 H1 WAT 2891 87.171 135.594 121.514 1.00 0.00 H ATOM 81243 H2 WAT 2891 86.621 134.978 120.246 1.00 0.00 H TER 81245 WAT 2891 ATOM 81245 O WAT 2892 29.365 19.417 123.826 1.00 0.00 O ATOM 81246 H1 WAT 2892 30.050 20.024 124.106 1.00 0.00 H ATOM 81247 H2 WAT 2892 28.589 19.966 123.712 1.00 0.00 H TER 81249 WAT 2892 ATOM 81249 O WAT 2893 19.572 129.301 103.756 1.00 0.00 O ATOM 81250 H1 WAT 2893 19.629 128.346 103.791 1.00 0.00 H ATOM 81251 H2 WAT 2893 18.663 129.478 103.513 1.00 0.00 H TER 81253 WAT 2893 ATOM 81253 O WAT 2894 62.053 108.101 96.975 1.00 0.00 O ATOM 81254 H1 WAT 2894 61.400 107.960 96.289 1.00 0.00 H ATOM 81255 H2 WAT 2894 61.539 108.317 97.753 1.00 0.00 H TER 81257 WAT 2894 ATOM 81257 O WAT 2895 96.330 97.590 76.588 1.00 0.00 O ATOM 81258 H1 WAT 2895 96.628 97.543 77.497 1.00 0.00 H ATOM 81259 H2 WAT 2895 97.137 97.599 76.072 1.00 0.00 H TER 81261 WAT 2895 ATOM 81261 O WAT 2896 53.273 122.458 148.472 1.00 0.00 O ATOM 81262 H1 WAT 2896 53.226 121.840 147.742 1.00 0.00 H ATOM 81263 H2 WAT 2896 54.075 122.218 148.937 1.00 0.00 H TER 81265 WAT 2896 ATOM 81265 O WAT 2897 20.338 110.557 116.822 1.00 0.00 O ATOM 81266 H1 WAT 2897 20.644 109.725 116.462 1.00 0.00 H ATOM 81267 H2 WAT 2897 20.807 111.222 116.318 1.00 0.00 H TER 81269 WAT 2897 ATOM 81269 O WAT 2898 134.393 61.202 3.449 1.00 0.00 O ATOM 81270 H1 WAT 2898 134.793 60.354 3.255 1.00 0.00 H ATOM 81271 H2 WAT 2898 133.855 61.041 4.224 1.00 0.00 H TER 81273 WAT 2898 ATOM 81273 O WAT 2899 16.123 139.231 19.348 1.00 0.00 O ATOM 81274 H1 WAT 2899 16.961 139.490 18.965 1.00 0.00 H ATOM 81275 H2 WAT 2899 15.717 138.676 18.682 1.00 0.00 H TER 81277 WAT 2899 ATOM 81277 O WAT 2900 104.275 20.442 82.960 1.00 0.00 O ATOM 81278 H1 WAT 2900 104.853 20.201 82.236 1.00 0.00 H ATOM 81279 H2 WAT 2900 103.845 21.245 82.667 1.00 0.00 H TER 81281 WAT 2900 ATOM 81281 O WAT 2901 52.029 78.653 4.319 1.00 0.00 O ATOM 81282 H1 WAT 2901 51.521 79.223 3.743 1.00 0.00 H ATOM 81283 H2 WAT 2901 51.702 78.846 5.198 1.00 0.00 H TER 81285 WAT 2901 ATOM 81285 O WAT 2902 75.987 28.162 18.411 1.00 0.00 O ATOM 81286 H1 WAT 2902 75.163 27.878 18.017 1.00 0.00 H ATOM 81287 H2 WAT 2902 75.979 27.777 19.287 1.00 0.00 H TER 81289 WAT 2902 ATOM 81289 O WAT 2903 110.131 116.176 78.542 1.00 0.00 O ATOM 81290 H1 WAT 2903 109.200 116.277 78.339 1.00 0.00 H ATOM 81291 H2 WAT 2903 110.147 115.640 79.335 1.00 0.00 H TER 81293 WAT 2903 ATOM 81293 O WAT 2904 0.006 106.389 10.481 1.00 0.00 O ATOM 81294 H1 WAT 2904 0.641 106.966 10.907 1.00 0.00 H ATOM 81295 H2 WAT 2904 0.508 105.605 10.257 1.00 0.00 H TER 81297 WAT 2904 ATOM 81297 O WAT 2905 93.047 66.914 124.098 1.00 0.00 O ATOM 81298 H1 WAT 2905 92.154 67.226 124.244 1.00 0.00 H ATOM 81299 H2 WAT 2905 92.961 66.257 123.407 1.00 0.00 H TER 81301 WAT 2905 ATOM 81301 O WAT 2906 78.793 0.409 95.634 1.00 0.00 O ATOM 81302 H1 WAT 2906 78.465 1.085 96.227 1.00 0.00 H ATOM 81303 H2 WAT 2906 78.965 0.872 94.814 1.00 0.00 H TER 81305 WAT 2906 ATOM 81305 O WAT 2907 94.083 108.898 88.530 1.00 0.00 O ATOM 81306 H1 WAT 2907 93.678 108.557 87.733 1.00 0.00 H ATOM 81307 H2 WAT 2907 94.857 108.350 88.659 1.00 0.00 H TER 81309 WAT 2907 ATOM 81309 O WAT 2908 5.518 64.443 20.726 1.00 0.00 O ATOM 81310 H1 WAT 2908 4.967 65.090 20.285 1.00 0.00 H ATOM 81311 H2 WAT 2908 6.407 64.648 20.436 1.00 0.00 H TER 81313 WAT 2908 ATOM 81313 O WAT 2909 94.056 97.750 107.274 1.00 0.00 O ATOM 81314 H1 WAT 2909 94.625 97.380 106.599 1.00 0.00 H ATOM 81315 H2 WAT 2909 93.680 96.988 107.714 1.00 0.00 H TER 81317 WAT 2909 ATOM 81317 O WAT 2910 30.241 31.125 59.657 1.00 0.00 O ATOM 81318 H1 WAT 2910 31.035 31.033 59.131 1.00 0.00 H ATOM 81319 H2 WAT 2910 29.549 31.296 59.018 1.00 0.00 H TER 81321 WAT 2910 ATOM 81321 O WAT 2911 22.866 13.092 97.111 1.00 0.00 O ATOM 81322 H1 WAT 2911 22.366 12.547 96.503 1.00 0.00 H ATOM 81323 H2 WAT 2911 22.203 13.488 97.677 1.00 0.00 H TER 81325 WAT 2911 ATOM 81325 O WAT 2912 19.169 53.774 76.766 1.00 0.00 O ATOM 81326 H1 WAT 2912 18.380 53.247 76.891 1.00 0.00 H ATOM 81327 H2 WAT 2912 18.972 54.326 76.010 1.00 0.00 H TER 81329 WAT 2912 ATOM 81329 O WAT 2913 136.848 91.162 99.362 1.00 0.00 O ATOM 81330 H1 WAT 2913 136.177 91.845 99.364 1.00 0.00 H ATOM 81331 H2 WAT 2913 137.513 91.479 99.974 1.00 0.00 H TER 81333 WAT 2913 ATOM 81333 O WAT 2914 67.055 108.809 102.709 1.00 0.00 O ATOM 81334 H1 WAT 2914 67.840 109.035 102.210 1.00 0.00 H ATOM 81335 H2 WAT 2914 67.255 107.956 103.095 1.00 0.00 H TER 81337 WAT 2914 ATOM 81337 O WAT 2915 135.593 135.912 59.316 1.00 0.00 O ATOM 81338 H1 WAT 2915 134.638 135.853 59.314 1.00 0.00 H ATOM 81339 H2 WAT 2915 135.822 136.130 58.412 1.00 0.00 H TER 81341 WAT 2915 ATOM 81341 O WAT 2916 29.486 69.108 98.573 1.00 0.00 O ATOM 81342 H1 WAT 2916 29.774 68.540 99.287 1.00 0.00 H ATOM 81343 H2 WAT 2916 29.040 69.834 99.009 1.00 0.00 H TER 81345 WAT 2916 ATOM 81345 O WAT 2917 87.977 140.759 148.824 1.00 0.00 O ATOM 81346 H1 WAT 2917 87.579 140.012 149.271 1.00 0.00 H ATOM 81347 H2 WAT 2917 88.588 141.123 149.464 1.00 0.00 H TER 81349 WAT 2917 ATOM 81349 O WAT 2918 64.941 10.129 124.282 1.00 0.00 O ATOM 81350 H1 WAT 2918 65.712 9.713 123.896 1.00 0.00 H ATOM 81351 H2 WAT 2918 64.866 10.966 123.822 1.00 0.00 H TER 81353 WAT 2918 ATOM 81353 O WAT 2919 136.157 49.255 152.049 1.00 0.00 O ATOM 81354 H1 WAT 2919 136.084 49.663 151.186 1.00 0.00 H ATOM 81355 H2 WAT 2919 136.495 48.378 151.871 1.00 0.00 H TER 81357 WAT 2919 ATOM 81357 O WAT 2920 22.741 32.488 23.944 1.00 0.00 O ATOM 81358 H1 WAT 2920 23.469 32.145 24.463 1.00 0.00 H ATOM 81359 H2 WAT 2920 22.346 31.713 23.544 1.00 0.00 H TER 81361 WAT 2920 ATOM 81361 O WAT 2921 40.871 48.219 60.156 1.00 0.00 O ATOM 81362 H1 WAT 2921 40.695 47.708 59.366 1.00 0.00 H ATOM 81363 H2 WAT 2921 41.781 48.500 60.061 1.00 0.00 H TER 81365 WAT 2921 ATOM 81365 O WAT 2922 76.207 27.652 88.921 1.00 0.00 O ATOM 81366 H1 WAT 2922 77.062 27.484 88.526 1.00 0.00 H ATOM 81367 H2 WAT 2922 76.097 26.950 89.562 1.00 0.00 H TER 81369 WAT 2922 ATOM 81369 O WAT 2923 40.126 14.479 14.383 1.00 0.00 O ATOM 81370 H1 WAT 2923 40.729 14.624 13.654 1.00 0.00 H ATOM 81371 H2 WAT 2923 39.265 14.699 14.030 1.00 0.00 H TER 81373 WAT 2923 ATOM 81373 O WAT 2924 35.481 8.317 151.971 1.00 0.00 O ATOM 81374 H1 WAT 2924 35.983 7.502 151.941 1.00 0.00 H ATOM 81375 H2 WAT 2924 34.579 8.049 151.792 1.00 0.00 H TER 81377 WAT 2924 ATOM 81377 O WAT 2925 5.588 81.287 156.357 1.00 0.00 O ATOM 81378 H1 WAT 2925 4.941 81.100 157.037 1.00 0.00 H ATOM 81379 H2 WAT 2925 6.432 81.116 156.775 1.00 0.00 H TER 81381 WAT 2925 ATOM 81381 O WAT 2926 132.930 74.112 122.714 1.00 0.00 O ATOM 81382 H1 WAT 2926 132.926 74.954 122.258 1.00 0.00 H ATOM 81383 H2 WAT 2926 132.698 74.327 123.617 1.00 0.00 H TER 81385 WAT 2926 ATOM 81385 O WAT 2927 88.046 57.189 100.441 1.00 0.00 O ATOM 81386 H1 WAT 2927 87.902 58.115 100.249 1.00 0.00 H ATOM 81387 H2 WAT 2927 87.232 56.760 100.177 1.00 0.00 H TER 81389 WAT 2927 ATOM 81389 O WAT 2928 21.101 2.711 148.142 1.00 0.00 O ATOM 81390 H1 WAT 2928 21.585 2.340 148.880 1.00 0.00 H ATOM 81391 H2 WAT 2928 20.850 3.587 148.436 1.00 0.00 H TER 81393 WAT 2928 ATOM 81393 O WAT 2929 113.978 120.957 132.806 1.00 0.00 O ATOM 81394 H1 WAT 2929 113.349 120.509 133.372 1.00 0.00 H ATOM 81395 H2 WAT 2929 113.450 121.582 132.309 1.00 0.00 H TER 81397 WAT 2929 ATOM 81397 O WAT 2930 81.784 72.426 134.682 1.00 0.00 O ATOM 81398 H1 WAT 2930 81.542 71.699 135.256 1.00 0.00 H ATOM 81399 H2 WAT 2930 81.197 72.342 133.930 1.00 0.00 H TER 81401 WAT 2930 ATOM 81401 O WAT 2931 115.822 127.412 11.077 1.00 0.00 O ATOM 81402 H1 WAT 2931 116.598 126.934 10.782 1.00 0.00 H ATOM 81403 H2 WAT 2931 116.070 128.334 11.014 1.00 0.00 H TER 81405 WAT 2931 ATOM 81405 O WAT 2932 143.959 75.007 121.784 1.00 0.00 O ATOM 81406 H1 WAT 2932 144.472 74.279 121.434 1.00 0.00 H ATOM 81407 H2 WAT 2932 144.267 75.772 121.299 1.00 0.00 H TER 81409 WAT 2932 ATOM 81409 O WAT 2933 1.251 26.769 86.547 1.00 0.00 O ATOM 81410 H1 WAT 2933 1.375 27.676 86.827 1.00 0.00 H ATOM 81411 H2 WAT 2933 2.005 26.585 85.988 1.00 0.00 H TER 81413 WAT 2933 ATOM 81413 O WAT 2934 111.852 3.744 104.984 1.00 0.00 O ATOM 81414 H1 WAT 2934 111.083 3.245 105.262 1.00 0.00 H ATOM 81415 H2 WAT 2934 111.819 4.545 105.507 1.00 0.00 H TER 81417 WAT 2934 ATOM 81417 O WAT 2935 41.867 141.216 141.036 1.00 0.00 O ATOM 81418 H1 WAT 2935 41.889 140.386 140.561 1.00 0.00 H ATOM 81419 H2 WAT 2935 42.782 141.387 141.260 1.00 0.00 H TER 81421 WAT 2935 ATOM 81421 O WAT 2936 129.769 119.154 2.428 1.00 0.00 O ATOM 81422 H1 WAT 2936 128.952 118.789 2.088 1.00 0.00 H ATOM 81423 H2 WAT 2936 130.410 118.994 1.735 1.00 0.00 H TER 81425 WAT 2936 ATOM 81425 O WAT 2937 85.011 102.298 79.024 1.00 0.00 O ATOM 81426 H1 WAT 2937 85.703 102.774 78.564 1.00 0.00 H ATOM 81427 H2 WAT 2937 85.472 101.801 79.700 1.00 0.00 H TER 81429 WAT 2937 ATOM 81429 O WAT 2938 84.315 76.457 123.082 1.00 0.00 O ATOM 81430 H1 WAT 2938 84.947 77.097 122.756 1.00 0.00 H ATOM 81431 H2 WAT 2938 84.695 76.141 123.902 1.00 0.00 H TER 81433 WAT 2938 ATOM 81433 O WAT 2939 94.826 38.655 63.240 1.00 0.00 O ATOM 81434 H1 WAT 2939 93.904 38.907 63.302 1.00 0.00 H ATOM 81435 H2 WAT 2939 94.945 38.406 62.323 1.00 0.00 H TER 81437 WAT 2939 ATOM 81437 O WAT 2940 90.182 121.100 16.461 1.00 0.00 O ATOM 81438 H1 WAT 2940 90.457 120.317 15.984 1.00 0.00 H ATOM 81439 H2 WAT 2940 89.739 121.637 15.803 1.00 0.00 H TER 81441 WAT 2940 ATOM 81441 O WAT 2941 46.854 21.785 79.946 1.00 0.00 O ATOM 81442 H1 WAT 2941 46.926 22.740 79.961 1.00 0.00 H ATOM 81443 H2 WAT 2941 47.219 21.530 79.099 1.00 0.00 H TER 81445 WAT 2941 ATOM 81445 O WAT 2942 117.896 129.224 82.838 1.00 0.00 O ATOM 81446 H1 WAT 2942 117.687 129.675 83.655 1.00 0.00 H ATOM 81447 H2 WAT 2942 117.150 129.405 82.266 1.00 0.00 H TER 81449 WAT 2942 ATOM 81449 O WAT 2943 27.376 11.478 10.848 1.00 0.00 O ATOM 81450 H1 WAT 2943 27.573 10.568 11.072 1.00 0.00 H ATOM 81451 H2 WAT 2943 27.308 11.480 9.894 1.00 0.00 H TER 81453 WAT 2943 ATOM 81453 O WAT 2944 23.113 113.582 77.896 1.00 0.00 O ATOM 81454 H1 WAT 2944 24.068 113.566 77.828 1.00 0.00 H ATOM 81455 H2 WAT 2944 22.848 114.339 77.374 1.00 0.00 H TER 81457 WAT 2944 ATOM 81457 O WAT 2945 24.473 125.966 105.748 1.00 0.00 O ATOM 81458 H1 WAT 2945 23.822 126.501 106.202 1.00 0.00 H ATOM 81459 H2 WAT 2945 24.617 125.219 106.328 1.00 0.00 H TER 81461 WAT 2945 ATOM 81461 O WAT 2946 143.306 106.945 11.535 1.00 0.00 O ATOM 81462 H1 WAT 2946 144.146 106.877 11.081 1.00 0.00 H ATOM 81463 H2 WAT 2946 142.821 107.610 11.045 1.00 0.00 H TER 81465 WAT 2946 ATOM 81465 O WAT 2947 41.178 98.410 128.324 1.00 0.00 O ATOM 81466 H1 WAT 2947 40.305 98.802 128.308 1.00 0.00 H ATOM 81467 H2 WAT 2947 41.705 98.979 127.763 1.00 0.00 H TER 81469 WAT 2947 ATOM 81469 O WAT 2948 3.267 40.557 88.980 1.00 0.00 O ATOM 81470 H1 WAT 2948 2.397 40.398 89.346 1.00 0.00 H ATOM 81471 H2 WAT 2948 3.130 40.567 88.032 1.00 0.00 H TER 81473 WAT 2948 ATOM 81473 O WAT 2949 30.302 96.006 3.643 1.00 0.00 O ATOM 81474 H1 WAT 2949 30.166 95.501 4.445 1.00 0.00 H ATOM 81475 H2 WAT 2949 29.519 96.552 3.569 1.00 0.00 H TER 81477 WAT 2949 ATOM 81477 O WAT 2950 76.976 111.004 6.393 1.00 0.00 O ATOM 81478 H1 WAT 2950 77.315 110.127 6.573 1.00 0.00 H ATOM 81479 H2 WAT 2950 77.631 111.595 6.764 1.00 0.00 H TER 81481 WAT 2950 ATOM 81481 O WAT 2951 79.899 0.794 55.944 1.00 0.00 O ATOM 81482 H1 WAT 2951 79.526 0.370 56.717 1.00 0.00 H ATOM 81483 H2 WAT 2951 79.894 1.727 56.157 1.00 0.00 H TER 81485 WAT 2951 ATOM 81485 O WAT 2952 92.227 29.871 19.874 1.00 0.00 O ATOM 81486 H1 WAT 2952 91.924 28.970 19.761 1.00 0.00 H ATOM 81487 H2 WAT 2952 92.853 29.824 20.596 1.00 0.00 H TER 81489 WAT 2952 ATOM 81489 O WAT 2953 101.424 134.878 122.932 1.00 0.00 O ATOM 81490 H1 WAT 2953 100.989 135.726 122.847 1.00 0.00 H ATOM 81491 H2 WAT 2953 101.415 134.515 122.046 1.00 0.00 H TER 81493 WAT 2953 ATOM 81493 O WAT 2954 134.517 115.001 145.436 1.00 0.00 O ATOM 81494 H1 WAT 2954 133.626 114.660 145.510 1.00 0.00 H ATOM 81495 H2 WAT 2954 135.075 114.276 145.715 1.00 0.00 H TER 81497 WAT 2954 ATOM 81497 O WAT 2955 87.260 7.443 158.471 1.00 0.00 O ATOM 81498 H1 WAT 2955 87.965 7.332 159.108 1.00 0.00 H ATOM 81499 H2 WAT 2955 86.926 6.557 158.327 1.00 0.00 H TER 81501 WAT 2955 ATOM 81501 O WAT 2956 11.285 101.853 103.317 1.00 0.00 O ATOM 81502 H1 WAT 2956 11.556 100.938 103.237 1.00 0.00 H ATOM 81503 H2 WAT 2956 11.781 102.185 104.065 1.00 0.00 H TER 81505 WAT 2956 ATOM 81505 O WAT 2957 37.615 140.380 62.393 1.00 0.00 O ATOM 81506 H1 WAT 2957 36.974 140.939 61.953 1.00 0.00 H ATOM 81507 H2 WAT 2957 38.140 140.013 61.682 1.00 0.00 H TER 81509 WAT 2957 ATOM 81509 O WAT 2958 124.455 102.126 71.204 1.00 0.00 O ATOM 81510 H1 WAT 2958 124.374 101.595 70.412 1.00 0.00 H ATOM 81511 H2 WAT 2958 125.195 102.708 71.027 1.00 0.00 H TER 81513 WAT 2958 ATOM 81513 O WAT 2959 123.680 59.472 106.809 1.00 0.00 O ATOM 81514 H1 WAT 2959 124.220 59.187 106.071 1.00 0.00 H ATOM 81515 H2 WAT 2959 123.106 60.144 106.440 1.00 0.00 H TER 81517 WAT 2959 ATOM 81517 O WAT 2960 90.584 68.489 152.476 1.00 0.00 O ATOM 81518 H1 WAT 2960 90.701 67.656 152.019 1.00 0.00 H ATOM 81519 H2 WAT 2960 89.645 68.535 152.653 1.00 0.00 H TER 81521 WAT 2960 ATOM 81521 O WAT 2961 78.499 62.402 75.035 1.00 0.00 O ATOM 81522 H1 WAT 2961 78.714 61.755 74.363 1.00 0.00 H ATOM 81523 H2 WAT 2961 79.101 63.128 74.870 1.00 0.00 H TER 81525 WAT 2961 ATOM 81525 O WAT 2962 128.016 137.181 127.095 1.00 0.00 O ATOM 81526 H1 WAT 2962 128.359 138.008 126.756 1.00 0.00 H ATOM 81527 H2 WAT 2962 128.225 137.200 128.029 1.00 0.00 H TER 81529 WAT 2962 ATOM 81529 O WAT 2963 118.133 142.357 128.654 1.00 0.00 O ATOM 81530 H1 WAT 2963 117.580 141.849 128.059 1.00 0.00 H ATOM 81531 H2 WAT 2963 119.027 142.116 128.413 1.00 0.00 H TER 81533 WAT 2963 ATOM 81533 O WAT 2964 86.075 9.739 11.030 1.00 0.00 O ATOM 81534 H1 WAT 2964 86.350 10.596 11.356 1.00 0.00 H ATOM 81535 H2 WAT 2964 85.243 9.571 11.472 1.00 0.00 H TER 81537 WAT 2964 ATOM 81537 O WAT 2965 34.524 136.693 93.753 1.00 0.00 O ATOM 81538 H1 WAT 2965 33.705 137.143 93.545 1.00 0.00 H ATOM 81539 H2 WAT 2965 34.252 135.898 94.211 1.00 0.00 H TER 81541 WAT 2965 ATOM 81541 O WAT 2966 16.401 7.779 90.675 1.00 0.00 O ATOM 81542 H1 WAT 2966 17.344 7.681 90.541 1.00 0.00 H ATOM 81543 H2 WAT 2966 16.015 7.036 90.210 1.00 0.00 H TER 81545 WAT 2966 ATOM 81545 O WAT 2967 100.989 39.807 13.190 1.00 0.00 O ATOM 81546 H1 WAT 2967 101.115 39.054 13.767 1.00 0.00 H ATOM 81547 H2 WAT 2967 101.535 40.495 13.571 1.00 0.00 H TER 81549 WAT 2967 ATOM 81549 O WAT 2968 72.979 132.692 60.988 1.00 0.00 O ATOM 81550 H1 WAT 2968 72.924 132.467 60.059 1.00 0.00 H ATOM 81551 H2 WAT 2968 72.719 133.612 61.028 1.00 0.00 H TER 81553 WAT 2968 ATOM 81553 O WAT 2969 106.762 37.322 96.738 1.00 0.00 O ATOM 81554 H1 WAT 2969 105.959 37.220 96.227 1.00 0.00 H ATOM 81555 H2 WAT 2969 107.381 37.730 96.132 1.00 0.00 H TER 81557 WAT 2969 ATOM 81557 O WAT 2970 106.294 92.193 114.042 1.00 0.00 O ATOM 81558 H1 WAT 2970 106.682 91.736 114.788 1.00 0.00 H ATOM 81559 H2 WAT 2970 107.002 92.740 113.702 1.00 0.00 H TER 81561 WAT 2970 ATOM 81561 O WAT 2971 72.080 56.689 137.232 1.00 0.00 O ATOM 81562 H1 WAT 2971 72.221 56.325 138.106 1.00 0.00 H ATOM 81563 H2 WAT 2971 71.805 55.940 136.703 1.00 0.00 H TER 81565 WAT 2971 ATOM 81565 O WAT 2972 8.928 49.097 141.822 1.00 0.00 O ATOM 81566 H1 WAT 2972 8.775 49.427 140.936 1.00 0.00 H ATOM 81567 H2 WAT 2972 8.221 48.469 141.969 1.00 0.00 H TER 81569 WAT 2972 ATOM 81569 O WAT 2973 103.346 3.057 112.228 1.00 0.00 O ATOM 81570 H1 WAT 2973 104.202 2.853 112.604 1.00 0.00 H ATOM 81571 H2 WAT 2973 102.720 2.798 112.903 1.00 0.00 H TER 81573 WAT 2973 ATOM 81573 O WAT 2974 19.366 84.565 78.371 1.00 0.00 O ATOM 81574 H1 WAT 2974 18.668 84.920 78.921 1.00 0.00 H ATOM 81575 H2 WAT 2974 20.159 84.660 78.899 1.00 0.00 H TER 81577 WAT 2974 ATOM 81577 O WAT 2975 44.563 6.657 55.486 1.00 0.00 O ATOM 81578 H1 WAT 2975 44.661 5.921 54.883 1.00 0.00 H ATOM 81579 H2 WAT 2975 45.456 6.970 55.629 1.00 0.00 H TER 81581 WAT 2975 ATOM 81581 O WAT 2976 51.159 139.705 20.218 1.00 0.00 O ATOM 81582 H1 WAT 2976 51.272 139.364 21.105 1.00 0.00 H ATOM 81583 H2 WAT 2976 51.684 140.505 20.200 1.00 0.00 H TER 81585 WAT 2976 ATOM 81585 O WAT 2977 42.240 41.831 125.672 1.00 0.00 O ATOM 81586 H1 WAT 2977 41.423 41.509 126.051 1.00 0.00 H ATOM 81587 H2 WAT 2977 42.571 41.095 125.157 1.00 0.00 H TER 81589 WAT 2977 ATOM 81589 O WAT 2978 16.463 10.204 15.375 1.00 0.00 O ATOM 81590 H1 WAT 2978 16.542 9.269 15.565 1.00 0.00 H ATOM 81591 H2 WAT 2978 16.366 10.616 16.233 1.00 0.00 H TER 81593 WAT 2978 ATOM 81593 O WAT 2979 96.390 113.819 20.986 1.00 0.00 O ATOM 81594 H1 WAT 2979 95.883 113.279 21.593 1.00 0.00 H ATOM 81595 H2 WAT 2979 96.933 114.369 21.551 1.00 0.00 H TER 81597 WAT 2979 ATOM 81597 O WAT 2980 36.796 29.834 20.205 1.00 0.00 O ATOM 81598 H1 WAT 2980 37.109 28.936 20.315 1.00 0.00 H ATOM 81599 H2 WAT 2980 37.390 30.362 20.739 1.00 0.00 H TER 81601 WAT 2980 ATOM 81601 O WAT 2981 23.694 138.905 149.554 1.00 0.00 O ATOM 81602 H1 WAT 2981 24.283 139.430 150.096 1.00 0.00 H ATOM 81603 H2 WAT 2981 24.188 138.107 149.365 1.00 0.00 H TER 81605 WAT 2981 ATOM 81605 O WAT 2982 119.399 93.624 115.060 1.00 0.00 O ATOM 81606 H1 WAT 2982 120.254 93.816 115.445 1.00 0.00 H ATOM 81607 H2 WAT 2982 119.534 93.719 114.117 1.00 0.00 H TER 81609 WAT 2982 ATOM 81609 O WAT 2983 82.961 13.759 3.711 1.00 0.00 O ATOM 81610 H1 WAT 2983 83.520 13.556 4.461 1.00 0.00 H ATOM 81611 H2 WAT 2983 83.103 14.692 3.553 1.00 0.00 H TER 81613 WAT 2983 ATOM 81613 O WAT 2984 17.161 53.291 93.490 1.00 0.00 O ATOM 81614 H1 WAT 2984 16.767 53.204 94.358 1.00 0.00 H ATOM 81615 H2 WAT 2984 17.663 52.484 93.374 1.00 0.00 H TER 81617 WAT 2984 ATOM 81617 O WAT 2985 46.990 103.597 89.501 1.00 0.00 O ATOM 81618 H1 WAT 2985 46.811 103.864 88.600 1.00 0.00 H ATOM 81619 H2 WAT 2985 47.677 102.934 89.423 1.00 0.00 H TER 81621 WAT 2985 ATOM 81621 O WAT 2986 95.733 56.671 133.013 1.00 0.00 O ATOM 81622 H1 WAT 2986 95.691 55.716 132.963 1.00 0.00 H ATOM 81623 H2 WAT 2986 95.541 56.871 133.929 1.00 0.00 H TER 81625 WAT 2986 ATOM 81625 O WAT 2987 40.130 126.183 136.225 1.00 0.00 O ATOM 81626 H1 WAT 2987 41.018 126.347 135.908 1.00 0.00 H ATOM 81627 H2 WAT 2987 40.232 125.487 136.874 1.00 0.00 H TER 81629 WAT 2987 ATOM 81629 O WAT 2988 136.219 104.392 155.719 1.00 0.00 O ATOM 81630 H1 WAT 2988 135.801 103.687 156.215 1.00 0.00 H ATOM 81631 H2 WAT 2988 135.491 104.936 155.417 1.00 0.00 H TER 81633 WAT 2988 ATOM 81633 O WAT 2989 80.994 84.815 66.662 1.00 0.00 O ATOM 81634 H1 WAT 2989 81.659 85.043 67.310 1.00 0.00 H ATOM 81635 H2 WAT 2989 80.393 85.560 66.663 1.00 0.00 H TER 81637 WAT 2989 ATOM 81637 O WAT 2990 145.021 107.573 7.886 1.00 0.00 O ATOM 81638 H1 WAT 2990 145.510 107.207 8.623 1.00 0.00 H ATOM 81639 H2 WAT 2990 144.368 106.904 7.676 1.00 0.00 H TER 81641 WAT 2990 ATOM 81641 O WAT 2991 25.260 19.495 -0.171 1.00 0.00 O ATOM 81642 H1 WAT 2991 25.718 19.236 0.629 1.00 0.00 H ATOM 81643 H2 WAT 2991 24.443 19.886 0.137 1.00 0.00 H TER 81645 WAT 2991 ATOM 81645 O WAT 2992 106.856 121.963 112.381 1.00 0.00 O ATOM 81646 H1 WAT 2992 106.680 121.559 113.230 1.00 0.00 H ATOM 81647 H2 WAT 2992 106.850 122.904 112.557 1.00 0.00 H TER 81649 WAT 2992 ATOM 81649 O WAT 2993 63.115 134.351 6.169 1.00 0.00 O ATOM 81650 H1 WAT 2993 62.346 134.292 6.736 1.00 0.00 H ATOM 81651 H2 WAT 2993 62.898 133.801 5.416 1.00 0.00 H TER 81653 WAT 2993 ATOM 81653 O WAT 2994 104.239 59.986 127.744 1.00 0.00 O ATOM 81654 H1 WAT 2994 104.547 60.383 128.559 1.00 0.00 H ATOM 81655 H2 WAT 2994 104.365 59.046 127.874 1.00 0.00 H TER 81657 WAT 2994 ATOM 81657 O WAT 2995 55.437 142.199 132.580 1.00 0.00 O ATOM 81658 H1 WAT 2995 54.693 142.443 133.129 1.00 0.00 H ATOM 81659 H2 WAT 2995 56.151 142.046 133.199 1.00 0.00 H TER 81661 WAT 2995 ATOM 81661 O WAT 2996 71.559 123.567 125.760 1.00 0.00 O ATOM 81662 H1 WAT 2996 71.972 124.410 125.946 1.00 0.00 H ATOM 81663 H2 WAT 2996 71.662 123.065 126.568 1.00 0.00 H TER 81665 WAT 2996 ATOM 81665 O WAT 2997 13.912 17.311 130.631 1.00 0.00 O ATOM 81666 H1 WAT 2997 13.181 17.317 131.249 1.00 0.00 H ATOM 81667 H2 WAT 2997 14.493 16.622 130.955 1.00 0.00 H TER 81669 WAT 2997 ATOM 81669 O WAT 2998 16.520 124.337 145.953 1.00 0.00 O ATOM 81670 H1 WAT 2998 17.182 123.694 146.204 1.00 0.00 H ATOM 81671 H2 WAT 2998 15.964 123.877 145.325 1.00 0.00 H TER 81673 WAT 2998 ATOM 81673 O WAT 2999 73.467 139.055 82.014 1.00 0.00 O ATOM 81674 H1 WAT 2999 74.373 138.917 81.740 1.00 0.00 H ATOM 81675 H2 WAT 2999 73.430 138.706 82.904 1.00 0.00 H TER 81677 WAT 2999 ATOM 81677 O WAT 3000 107.131 101.034 65.304 1.00 0.00 O ATOM 81678 H1 WAT 3000 106.548 101.757 65.070 1.00 0.00 H ATOM 81679 H2 WAT 3000 106.568 100.260 65.296 1.00 0.00 H TER 81681 WAT 3000 ATOM 81681 O WAT 3001 44.182 133.273 87.724 1.00 0.00 O ATOM 81682 H1 WAT 3001 43.372 132.775 87.833 1.00 0.00 H ATOM 81683 H2 WAT 3001 44.775 132.669 87.276 1.00 0.00 H TER 81685 WAT 3001 ATOM 81685 O WAT 3002 14.593 1.116 114.424 1.00 0.00 O ATOM 81686 H1 WAT 3002 14.595 1.301 115.363 1.00 0.00 H ATOM 81687 H2 WAT 3002 13.875 1.647 114.077 1.00 0.00 H TER 81689 WAT 3002 ATOM 81689 O WAT 3003 3.383 92.531 112.553 1.00 0.00 O ATOM 81690 H1 WAT 3003 2.861 92.106 113.233 1.00 0.00 H ATOM 81691 H2 WAT 3003 3.357 93.461 112.777 1.00 0.00 H TER 81693 WAT 3003 ATOM 81693 O WAT 3004 129.273 10.109 132.791 1.00 0.00 O ATOM 81694 H1 WAT 3004 129.692 9.506 132.177 1.00 0.00 H ATOM 81695 H2 WAT 3004 128.434 9.697 132.996 1.00 0.00 H TER 81697 WAT 3004 ATOM 81697 O WAT 3005 119.801 124.071 16.588 1.00 0.00 O ATOM 81698 H1 WAT 3005 118.865 123.893 16.684 1.00 0.00 H ATOM 81699 H2 WAT 3005 120.184 123.795 17.420 1.00 0.00 H TER 81701 WAT 3005 ATOM 81701 O WAT 3006 37.559 13.276 149.284 1.00 0.00 O ATOM 81702 H1 WAT 3006 37.773 12.600 148.640 1.00 0.00 H ATOM 81703 H2 WAT 3006 37.063 13.929 148.791 1.00 0.00 H TER 81705 WAT 3006 ATOM 81705 O WAT 3007 134.869 119.459 85.579 1.00 0.00 O ATOM 81706 H1 WAT 3007 134.701 120.377 85.364 1.00 0.00 H ATOM 81707 H2 WAT 3007 134.088 119.178 86.055 1.00 0.00 H TER 81709 WAT 3007 ATOM 81709 O WAT 3008 76.615 2.018 91.019 1.00 0.00 O ATOM 81710 H1 WAT 3008 76.350 2.779 90.502 1.00 0.00 H ATOM 81711 H2 WAT 3008 75.859 1.833 91.577 1.00 0.00 H TER 81713 WAT 3008 ATOM 81713 O WAT 3009 37.445 43.552 102.235 1.00 0.00 O ATOM 81714 H1 WAT 3009 38.323 43.928 102.310 1.00 0.00 H ATOM 81715 H2 WAT 3009 37.596 42.627 102.042 1.00 0.00 H TER 81717 WAT 3009 ATOM 81717 O WAT 3010 10.482 35.542 74.047 1.00 0.00 O ATOM 81718 H1 WAT 3010 10.708 34.761 73.541 1.00 0.00 H ATOM 81719 H2 WAT 3010 9.819 35.986 73.519 1.00 0.00 H TER 81721 WAT 3010 ATOM 81721 O WAT 3011 100.590 137.955 18.121 1.00 0.00 O ATOM 81722 H1 WAT 3011 99.861 138.407 18.544 1.00 0.00 H ATOM 81723 H2 WAT 3011 100.242 137.091 17.900 1.00 0.00 H TER 81725 WAT 3011 ATOM 81725 O WAT 3012 131.102 45.948 149.333 1.00 0.00 O ATOM 81726 H1 WAT 3012 130.590 45.360 148.778 1.00 0.00 H ATOM 81727 H2 WAT 3012 130.650 46.790 149.271 1.00 0.00 H TER 81729 WAT 3012 ATOM 81729 O WAT 3013 40.510 88.710 139.240 1.00 0.00 O ATOM 81730 H1 WAT 3013 40.859 88.538 138.365 1.00 0.00 H ATOM 81731 H2 WAT 3013 39.597 88.956 139.090 1.00 0.00 H TER 81733 WAT 3013 ATOM 81733 O WAT 3014 36.438 87.696 154.720 1.00 0.00 O ATOM 81734 H1 WAT 3014 36.983 87.861 153.951 1.00 0.00 H ATOM 81735 H2 WAT 3014 35.544 87.669 154.378 1.00 0.00 H TER 81737 WAT 3014 ATOM 81737 O WAT 3015 139.760 20.218 105.944 1.00 0.00 O ATOM 81738 H1 WAT 3015 140.265 20.986 105.677 1.00 0.00 H ATOM 81739 H2 WAT 3015 138.991 20.227 105.373 1.00 0.00 H TER 81741 WAT 3015 ATOM 81741 O WAT 3016 140.942 88.712 103.951 1.00 0.00 O ATOM 81742 H1 WAT 3016 140.253 88.056 103.843 1.00 0.00 H ATOM 81743 H2 WAT 3016 141.506 88.356 104.637 1.00 0.00 H TER 81745 WAT 3016 ATOM 81745 O WAT 3017 101.163 68.592 135.950 1.00 0.00 O ATOM 81746 H1 WAT 3017 101.279 68.690 136.895 1.00 0.00 H ATOM 81747 H2 WAT 3017 100.640 67.796 135.855 1.00 0.00 H TER 81749 WAT 3017 ATOM 81749 O WAT 3018 105.391 37.346 91.795 1.00 0.00 O ATOM 81750 H1 WAT 3018 105.425 37.993 91.091 1.00 0.00 H ATOM 81751 H2 WAT 3018 106.307 37.120 91.957 1.00 0.00 H TER 81753 WAT 3018 ATOM 81753 O WAT 3019 46.802 136.796 10.850 1.00 0.00 O ATOM 81754 H1 WAT 3019 46.876 136.943 9.907 1.00 0.00 H ATOM 81755 H2 WAT 3019 46.201 137.476 11.153 1.00 0.00 H TER 81757 WAT 3019 ATOM 81757 O WAT 3020 118.064 5.399 73.337 1.00 0.00 O ATOM 81758 H1 WAT 3020 117.503 5.152 74.072 1.00 0.00 H ATOM 81759 H2 WAT 3020 118.028 4.647 72.745 1.00 0.00 H TER 81761 WAT 3020 ATOM 81761 O WAT 3021 96.512 23.881 136.950 1.00 0.00 O ATOM 81762 H1 WAT 3021 95.631 23.974 137.315 1.00 0.00 H ATOM 81763 H2 WAT 3021 96.560 22.967 136.671 1.00 0.00 H TER 81765 WAT 3021 ATOM 81765 O WAT 3022 51.616 94.407 100.797 1.00 0.00 O ATOM 81766 H1 WAT 3022 50.928 94.394 101.462 1.00 0.00 H ATOM 81767 H2 WAT 3022 51.699 93.494 100.520 1.00 0.00 H TER 81769 WAT 3022 ATOM 81769 O WAT 3023 76.609 76.727 106.112 1.00 0.00 O ATOM 81770 H1 WAT 3023 75.956 77.404 105.935 1.00 0.00 H ATOM 81771 H2 WAT 3023 76.290 75.956 105.643 1.00 0.00 H TER 81773 WAT 3023 ATOM 81773 O WAT 3024 65.421 31.487 4.412 1.00 0.00 O ATOM 81774 H1 WAT 3024 66.181 32.054 4.278 1.00 0.00 H ATOM 81775 H2 WAT 3024 65.676 30.649 4.025 1.00 0.00 H TER 81777 WAT 3024 ATOM 81777 O WAT 3025 115.579 103.371 1.646 1.00 0.00 O ATOM 81778 H1 WAT 3025 116.140 103.141 0.905 1.00 0.00 H ATOM 81779 H2 WAT 3025 114.688 103.249 1.319 1.00 0.00 H TER 81781 WAT 3025 ATOM 81781 O WAT 3026 89.872 41.102 153.084 1.00 0.00 O ATOM 81782 H1 WAT 3026 89.383 41.463 152.344 1.00 0.00 H ATOM 81783 H2 WAT 3026 89.207 40.678 153.627 1.00 0.00 H TER 81785 WAT 3026 ATOM 81785 O WAT 3027 25.127 117.010 17.836 1.00 0.00 O ATOM 81786 H1 WAT 3027 25.577 116.166 17.865 1.00 0.00 H ATOM 81787 H2 WAT 3027 24.785 117.069 16.943 1.00 0.00 H TER 81789 WAT 3027 ATOM 81789 O WAT 3028 113.303 12.504 88.084 1.00 0.00 O ATOM 81790 H1 WAT 3028 113.080 12.356 89.004 1.00 0.00 H ATOM 81791 H2 WAT 3028 112.833 11.817 87.611 1.00 0.00 H TER 81793 WAT 3028 ATOM 81793 O WAT 3029 137.175 58.906 63.534 1.00 0.00 O ATOM 81794 H1 WAT 3029 136.405 58.458 63.183 1.00 0.00 H ATOM 81795 H2 WAT 3029 136.869 59.792 63.728 1.00 0.00 H TER 81797 WAT 3029 ATOM 81797 O WAT 3030 103.722 48.553 3.601 1.00 0.00 O ATOM 81798 H1 WAT 3030 102.961 47.976 3.545 1.00 0.00 H ATOM 81799 H2 WAT 3030 103.552 49.238 2.955 1.00 0.00 H TER 81801 WAT 3030 ATOM 81801 O WAT 3031 46.143 90.674 109.557 1.00 0.00 O ATOM 81802 H1 WAT 3031 46.925 90.735 109.008 1.00 0.00 H ATOM 81803 H2 WAT 3031 46.063 91.539 109.958 1.00 0.00 H TER 81805 WAT 3031 ATOM 81805 O WAT 3032 144.165 31.532 62.474 1.00 0.00 O ATOM 81806 H1 WAT 3032 144.678 32.326 62.320 1.00 0.00 H ATOM 81807 H2 WAT 3032 144.778 30.815 62.309 1.00 0.00 H TER 81809 WAT 3032 ATOM 81809 O WAT 3033 50.986 48.902 90.860 1.00 0.00 O ATOM 81810 H1 WAT 3033 51.493 49.234 90.120 1.00 0.00 H ATOM 81811 H2 WAT 3033 50.722 48.021 90.594 1.00 0.00 H TER 81813 WAT 3033 ATOM 81813 O WAT 3034 128.880 32.408 93.922 1.00 0.00 O ATOM 81814 H1 WAT 3034 128.790 32.611 94.853 1.00 0.00 H ATOM 81815 H2 WAT 3034 127.986 32.439 93.582 1.00 0.00 H TER 81817 WAT 3034 ATOM 81817 O WAT 3035 69.692 93.920 105.582 1.00 0.00 O ATOM 81818 H1 WAT 3035 70.202 94.539 106.104 1.00 0.00 H ATOM 81819 H2 WAT 3035 69.664 93.125 106.115 1.00 0.00 H TER 81821 WAT 3035 ATOM 81821 O WAT 3036 11.599 88.387 60.466 1.00 0.00 O ATOM 81822 H1 WAT 3036 11.849 88.582 59.563 1.00 0.00 H ATOM 81823 H2 WAT 3036 10.871 88.982 60.648 1.00 0.00 H TER 81825 WAT 3036 ATOM 81825 O WAT 3037 96.388 145.003 99.369 1.00 0.00 O ATOM 81826 H1 WAT 3037 96.268 145.734 99.975 1.00 0.00 H ATOM 81827 H2 WAT 3037 97.213 145.195 98.923 1.00 0.00 H TER 81829 WAT 3037 ATOM 81829 O WAT 3038 137.304 88.372 88.704 1.00 0.00 O ATOM 81830 H1 WAT 3038 137.767 87.568 88.471 1.00 0.00 H ATOM 81831 H2 WAT 3038 136.427 88.259 88.336 1.00 0.00 H TER 81833 WAT 3038 ATOM 81833 O WAT 3039 97.683 138.041 84.692 1.00 0.00 O ATOM 81834 H1 WAT 3039 96.985 137.771 84.096 1.00 0.00 H ATOM 81835 H2 WAT 3039 97.313 138.779 85.177 1.00 0.00 H TER 81837 WAT 3039 ATOM 81837 O WAT 3040 56.063 68.362 5.066 1.00 0.00 O ATOM 81838 H1 WAT 3040 56.816 68.647 5.583 1.00 0.00 H ATOM 81839 H2 WAT 3040 55.349 68.934 5.346 1.00 0.00 H TER 81841 WAT 3040 ATOM 81841 O WAT 3041 99.322 85.951 119.390 1.00 0.00 O ATOM 81842 H1 WAT 3041 99.766 86.480 120.052 1.00 0.00 H ATOM 81843 H2 WAT 3041 98.465 85.759 119.771 1.00 0.00 H TER 81845 WAT 3041 ATOM 81845 O WAT 3042 122.815 47.684 13.667 1.00 0.00 O ATOM 81846 H1 WAT 3042 123.661 47.537 13.244 1.00 0.00 H ATOM 81847 H2 WAT 3042 122.370 46.838 13.613 1.00 0.00 H TER 81849 WAT 3042 ATOM 81849 O WAT 3043 115.168 10.474 8.876 1.00 0.00 O ATOM 81850 H1 WAT 3043 115.887 10.384 8.251 1.00 0.00 H ATOM 81851 H2 WAT 3043 114.865 9.578 9.023 1.00 0.00 H TER 81853 WAT 3043 ATOM 81853 O WAT 3044 34.542 62.802 136.169 1.00 0.00 O ATOM 81854 H1 WAT 3044 35.183 62.222 135.758 1.00 0.00 H ATOM 81855 H2 WAT 3044 34.222 62.309 136.924 1.00 0.00 H TER 81857 WAT 3044 ATOM 81857 O WAT 3045 44.628 114.890 69.438 1.00 0.00 O ATOM 81858 H1 WAT 3045 45.195 114.869 68.667 1.00 0.00 H ATOM 81859 H2 WAT 3045 44.322 115.795 69.485 1.00 0.00 H TER 81861 WAT 3045 ATOM 81861 O WAT 3046 31.231 64.050 134.902 1.00 0.00 O ATOM 81862 H1 WAT 3046 31.354 63.397 135.591 1.00 0.00 H ATOM 81863 H2 WAT 3046 32.019 63.981 134.363 1.00 0.00 H TER 81865 WAT 3046 ATOM 81865 O WAT 3047 36.068 4.177 103.622 1.00 0.00 O ATOM 81866 H1 WAT 3047 35.195 3.795 103.715 1.00 0.00 H ATOM 81867 H2 WAT 3047 36.211 4.650 104.441 1.00 0.00 H TER 81869 WAT 3047 ATOM 81869 O WAT 3048 7.318 43.748 111.209 1.00 0.00 O ATOM 81870 H1 WAT 3048 7.830 44.426 111.650 1.00 0.00 H ATOM 81871 H2 WAT 3048 6.408 43.972 111.402 1.00 0.00 H TER 81873 WAT 3048 ATOM 81873 O WAT 3049 117.293 38.582 71.757 1.00 0.00 O ATOM 81874 H1 WAT 3049 116.498 38.878 71.312 1.00 0.00 H ATOM 81875 H2 WAT 3049 117.150 38.805 72.676 1.00 0.00 H TER 81877 WAT 3049 ATOM 81877 O WAT 3050 5.918 62.643 88.059 1.00 0.00 O ATOM 81878 H1 WAT 3050 6.563 62.397 88.723 1.00 0.00 H ATOM 81879 H2 WAT 3050 6.200 63.507 87.761 1.00 0.00 H TER 81881 WAT 3050 ATOM 81881 O WAT 3051 126.521 88.379 18.151 1.00 0.00 O ATOM 81882 H1 WAT 3051 127.437 88.407 18.428 1.00 0.00 H ATOM 81883 H2 WAT 3051 126.387 87.479 17.857 1.00 0.00 H TER 81885 WAT 3051 ATOM 81885 O WAT 3052 34.145 110.563 7.867 1.00 0.00 O ATOM 81886 H1 WAT 3052 33.612 110.706 7.085 1.00 0.00 H ATOM 81887 H2 WAT 3052 35.043 110.516 7.540 1.00 0.00 H TER 81889 WAT 3052 ATOM 81889 O WAT 3053 143.232 69.251 90.086 1.00 0.00 O ATOM 81890 H1 WAT 3053 143.242 68.666 89.328 1.00 0.00 H ATOM 81891 H2 WAT 3053 143.109 70.124 89.713 1.00 0.00 H TER 81893 WAT 3053 ATOM 81893 O WAT 3054 64.052 136.520 68.582 1.00 0.00 O ATOM 81894 H1 WAT 3054 63.760 135.851 67.962 1.00 0.00 H ATOM 81895 H2 WAT 3054 64.971 136.668 68.359 1.00 0.00 H TER 81897 WAT 3054 ATOM 81897 O WAT 3055 31.546 12.034 100.422 1.00 0.00 O ATOM 81898 H1 WAT 3055 32.394 12.305 100.073 1.00 0.00 H ATOM 81899 H2 WAT 3055 31.748 11.298 101.000 1.00 0.00 H TER 81901 WAT 3055 ATOM 81901 O WAT 3056 41.180 83.504 0.367 1.00 0.00 O ATOM 81902 H1 WAT 3056 41.335 84.050 -0.403 1.00 0.00 H ATOM 81903 H2 WAT 3056 40.344 83.813 0.716 1.00 0.00 H TER 81905 WAT 3056 ATOM 81905 O WAT 3057 54.720 25.498 60.860 1.00 0.00 O ATOM 81906 H1 WAT 3057 54.268 25.214 61.654 1.00 0.00 H ATOM 81907 H2 WAT 3057 54.088 25.344 60.157 1.00 0.00 H TER 81909 WAT 3057 ATOM 81909 O WAT 3058 30.004 95.544 108.735 1.00 0.00 O ATOM 81910 H1 WAT 3058 29.780 94.752 109.223 1.00 0.00 H ATOM 81911 H2 WAT 3058 30.905 95.738 108.993 1.00 0.00 H TER 81913 WAT 3058 ATOM 81913 O WAT 3059 90.856 42.523 79.913 1.00 0.00 O ATOM 81914 H1 WAT 3059 90.901 41.644 79.536 1.00 0.00 H ATOM 81915 H2 WAT 3059 90.135 42.476 80.542 1.00 0.00 H TER 81917 WAT 3059 ATOM 81917 O WAT 3060 96.671 114.410 131.261 1.00 0.00 O ATOM 81918 H1 WAT 3060 97.177 114.211 132.049 1.00 0.00 H ATOM 81919 H2 WAT 3060 96.924 113.730 130.637 1.00 0.00 H TER 81921 WAT 3060 ATOM 81921 O WAT 3061 14.781 62.240 118.176 1.00 0.00 O ATOM 81922 H1 WAT 3061 14.889 61.476 118.741 1.00 0.00 H ATOM 81923 H2 WAT 3061 14.325 61.905 117.404 1.00 0.00 H TER 81925 WAT 3061 ATOM 81925 O WAT 3062 118.724 107.791 19.086 1.00 0.00 O ATOM 81926 H1 WAT 3062 118.764 107.082 19.728 1.00 0.00 H ATOM 81927 H2 WAT 3062 119.505 108.315 19.258 1.00 0.00 H TER 81929 WAT 3062 ATOM 81929 O WAT 3063 27.107 112.175 20.382 1.00 0.00 O ATOM 81930 H1 WAT 3063 27.860 111.828 20.861 1.00 0.00 H ATOM 81931 H2 WAT 3063 27.016 111.596 19.626 1.00 0.00 H TER 81933 WAT 3063 ATOM 81933 O WAT 3064 124.866 28.738 57.594 1.00 0.00 O ATOM 81934 H1 WAT 3064 124.684 28.380 56.726 1.00 0.00 H ATOM 81935 H2 WAT 3064 124.233 29.448 57.698 1.00 0.00 H TER 81937 WAT 3064 ATOM 81937 O WAT 3065 118.063 108.981 147.090 1.00 0.00 O ATOM 81938 H1 WAT 3065 118.111 108.733 146.167 1.00 0.00 H ATOM 81939 H2 WAT 3065 117.266 109.507 147.156 1.00 0.00 H TER 81941 WAT 3065 ATOM 81941 O WAT 3066 27.462 23.916 11.636 1.00 0.00 O ATOM 81942 H1 WAT 3066 28.294 23.944 12.108 1.00 0.00 H ATOM 81943 H2 WAT 3066 27.383 24.784 11.239 1.00 0.00 H TER 81945 WAT 3066 ATOM 81945 O WAT 3067 69.339 100.939 109.231 1.00 0.00 O ATOM 81946 H1 WAT 3067 68.848 101.320 108.503 1.00 0.00 H ATOM 81947 H2 WAT 3067 70.168 101.417 109.238 1.00 0.00 H TER 81949 WAT 3067 ATOM 81949 O WAT 3068 91.296 80.046 135.224 1.00 0.00 O ATOM 81950 H1 WAT 3068 90.646 80.497 135.763 1.00 0.00 H ATOM 81951 H2 WAT 3068 91.294 80.525 134.395 1.00 0.00 H TER 81953 WAT 3068 ATOM 81953 O WAT 3069 11.148 18.994 123.420 1.00 0.00 O ATOM 81954 H1 WAT 3069 10.586 19.769 123.400 1.00 0.00 H ATOM 81955 H2 WAT 3069 11.144 18.720 124.337 1.00 0.00 H TER 81957 WAT 3069 ATOM 81957 O WAT 3070 28.077 96.572 23.268 1.00 0.00 O ATOM 81958 H1 WAT 3070 27.189 96.772 23.565 1.00 0.00 H ATOM 81959 H2 WAT 3070 28.606 96.595 24.066 1.00 0.00 H TER 81961 WAT 3070 ATOM 81961 O WAT 3071 123.299 142.118 77.509 1.00 0.00 O ATOM 81962 H1 WAT 3071 124.078 142.329 78.023 1.00 0.00 H ATOM 81963 H2 WAT 3071 122.867 141.422 78.005 1.00 0.00 H TER 81965 WAT 3071 ATOM 81965 O WAT 3072 116.937 117.838 77.025 1.00 0.00 O ATOM 81966 H1 WAT 3072 117.404 117.018 77.187 1.00 0.00 H ATOM 81967 H2 WAT 3072 117.507 118.324 76.428 1.00 0.00 H TER 81969 WAT 3072 ATOM 81969 O WAT 3073 112.049 37.132 75.321 1.00 0.00 O ATOM 81970 H1 WAT 3073 111.807 36.373 74.790 1.00 0.00 H ATOM 81971 H2 WAT 3073 111.250 37.658 75.365 1.00 0.00 H TER 81973 WAT 3073 ATOM 81973 O WAT 3074 136.651 145.432 80.711 1.00 0.00 O ATOM 81974 H1 WAT 3074 137.122 146.255 80.846 1.00 0.00 H ATOM 81975 H2 WAT 3074 136.953 144.865 81.421 1.00 0.00 H TER 81977 WAT 3074 ATOM 81977 O WAT 3075 44.866 50.810 129.262 1.00 0.00 O ATOM 81978 H1 WAT 3075 44.089 50.435 128.847 1.00 0.00 H ATOM 81979 H2 WAT 3075 44.861 50.451 130.149 1.00 0.00 H TER 81981 WAT 3075 ATOM 81981 O WAT 3076 80.272 101.249 86.536 1.00 0.00 O ATOM 81982 H1 WAT 3076 80.572 101.847 87.221 1.00 0.00 H ATOM 81983 H2 WAT 3076 81.069 100.819 86.227 1.00 0.00 H TER 81985 WAT 3076 ATOM 81985 O WAT 3077 47.656 76.637 155.464 1.00 0.00 O ATOM 81986 H1 WAT 3077 47.688 77.076 156.314 1.00 0.00 H ATOM 81987 H2 WAT 3077 46.839 76.940 155.069 1.00 0.00 H TER 81989 WAT 3077 ATOM 81989 O WAT 3078 89.833 143.931 123.885 1.00 0.00 O ATOM 81990 H1 WAT 3078 90.221 143.850 124.757 1.00 0.00 H ATOM 81991 H2 WAT 3078 88.905 143.738 124.018 1.00 0.00 H TER 81993 WAT 3078 ATOM 81993 O WAT 3079 22.927 26.427 71.873 1.00 0.00 O ATOM 81994 H1 WAT 3079 23.631 27.069 71.956 1.00 0.00 H ATOM 81995 H2 WAT 3079 23.006 26.099 70.977 1.00 0.00 H TER 81997 WAT 3079 ATOM 81997 O WAT 3080 82.329 61.283 126.777 1.00 0.00 O ATOM 81998 H1 WAT 3080 82.012 61.225 127.678 1.00 0.00 H ATOM 81999 H2 WAT 3080 83.153 61.765 126.843 1.00 0.00 H TER 82001 WAT 3080 ATOM 82001 O WAT 3081 116.403 27.851 156.617 1.00 0.00 O ATOM 82002 H1 WAT 3081 115.687 28.053 156.015 1.00 0.00 H ATOM 82003 H2 WAT 3081 116.766 28.704 156.852 1.00 0.00 H TER 82005 WAT 3081 ATOM 82005 O WAT 3082 94.285 87.508 75.332 1.00 0.00 O ATOM 82006 H1 WAT 3082 95.031 87.183 74.829 1.00 0.00 H ATOM 82007 H2 WAT 3082 94.555 87.419 76.246 1.00 0.00 H TER 82009 WAT 3082 ATOM 82009 O WAT 3083 69.391 95.982 9.627 1.00 0.00 O ATOM 82010 H1 WAT 3083 68.896 95.494 8.968 1.00 0.00 H ATOM 82011 H2 WAT 3083 69.693 95.315 10.243 1.00 0.00 H TER 82013 WAT 3083 ATOM 82013 O WAT 3084 69.231 115.904 110.228 1.00 0.00 O ATOM 82014 H1 WAT 3084 68.443 115.382 110.078 1.00 0.00 H ATOM 82015 H2 WAT 3084 69.953 115.289 110.100 1.00 0.00 H TER 82017 WAT 3084 ATOM 82017 O WAT 3085 122.412 57.904 141.267 1.00 0.00 O ATOM 82018 H1 WAT 3085 122.099 58.590 141.857 1.00 0.00 H ATOM 82019 H2 WAT 3085 121.740 57.224 141.312 1.00 0.00 H TER 82021 WAT 3085 ATOM 82021 O WAT 3086 99.642 70.685 70.723 1.00 0.00 O ATOM 82022 H1 WAT 3086 98.904 70.090 70.855 1.00 0.00 H ATOM 82023 H2 WAT 3086 100.259 70.185 70.189 1.00 0.00 H TER 82025 WAT 3086 ATOM 82025 O WAT 3087 49.903 87.218 87.899 1.00 0.00 O ATOM 82026 H1 WAT 3087 50.258 87.716 88.636 1.00 0.00 H ATOM 82027 H2 WAT 3087 49.207 86.685 88.283 1.00 0.00 H TER 82029 WAT 3087 ATOM 82029 O WAT 3088 145.743 60.023 137.387 1.00 0.00 O ATOM 82030 H1 WAT 3088 144.801 60.044 137.218 1.00 0.00 H ATOM 82031 H2 WAT 3088 146.139 60.325 136.570 1.00 0.00 H TER 82033 WAT 3088 ATOM 82033 O WAT 3089 79.454 12.014 127.481 1.00 0.00 O ATOM 82034 H1 WAT 3089 79.835 12.523 128.197 1.00 0.00 H ATOM 82035 H2 WAT 3089 79.191 12.669 126.835 1.00 0.00 H TER 82037 WAT 3089 ATOM 82037 O WAT 3090 83.180 25.311 153.654 1.00 0.00 O ATOM 82038 H1 WAT 3090 82.269 25.164 153.402 1.00 0.00 H ATOM 82039 H2 WAT 3090 83.279 24.838 154.480 1.00 0.00 H TER 82041 WAT 3090 ATOM 82041 O WAT 3091 73.235 18.438 99.062 1.00 0.00 O ATOM 82042 H1 WAT 3091 73.640 18.703 98.236 1.00 0.00 H ATOM 82043 H2 WAT 3091 73.743 18.891 99.735 1.00 0.00 H TER 82045 WAT 3091 ATOM 82045 O WAT 3092 144.167 50.111 103.796 1.00 0.00 O ATOM 82046 H1 WAT 3092 144.068 49.933 104.731 1.00 0.00 H ATOM 82047 H2 WAT 3092 143.990 51.048 103.711 1.00 0.00 H TER 82049 WAT 3092 ATOM 82049 O WAT 3093 32.014 74.445 16.930 1.00 0.00 O ATOM 82050 H1 WAT 3093 32.422 73.664 17.304 1.00 0.00 H ATOM 82051 H2 WAT 3093 31.123 74.440 17.280 1.00 0.00 H TER 82053 WAT 3093 ATOM 82053 O WAT 3094 130.270 27.195 90.222 1.00 0.00 O ATOM 82054 H1 WAT 3094 129.895 27.610 89.445 1.00 0.00 H ATOM 82055 H2 WAT 3094 130.166 27.846 90.915 1.00 0.00 H TER 82057 WAT 3094 ATOM 82057 O WAT 3095 56.681 16.756 103.922 1.00 0.00 O ATOM 82058 H1 WAT 3095 56.156 16.256 103.296 1.00 0.00 H ATOM 82059 H2 WAT 3095 56.861 17.584 103.476 1.00 0.00 H TER 82061 WAT 3095 ATOM 82061 O WAT 3096 50.275 55.624 151.984 1.00 0.00 O ATOM 82062 H1 WAT 3096 50.960 55.408 152.617 1.00 0.00 H ATOM 82063 H2 WAT 3096 50.005 56.512 152.216 1.00 0.00 H TER 82065 WAT 3096 ATOM 82065 O WAT 3097 57.690 31.178 98.752 1.00 0.00 O ATOM 82066 H1 WAT 3097 57.807 30.320 98.343 1.00 0.00 H ATOM 82067 H2 WAT 3097 57.133 31.007 99.512 1.00 0.00 H TER 82069 WAT 3097 ATOM 82069 O WAT 3098 117.225 31.338 116.570 1.00 0.00 O ATOM 82070 H1 WAT 3098 117.554 30.987 117.397 1.00 0.00 H ATOM 82071 H2 WAT 3098 116.443 31.833 116.814 1.00 0.00 H TER 82073 WAT 3098 ATOM 82073 O WAT 3099 80.752 63.611 125.835 1.00 0.00 O ATOM 82074 H1 WAT 3099 80.765 62.657 125.914 1.00 0.00 H ATOM 82075 H2 WAT 3099 80.862 63.926 126.733 1.00 0.00 H TER 82077 WAT 3099 ATOM 82077 O WAT 3100 1.239 4.416 81.388 1.00 0.00 O ATOM 82078 H1 WAT 3100 0.420 3.934 81.496 1.00 0.00 H ATOM 82079 H2 WAT 3100 1.289 4.597 80.450 1.00 0.00 H TER 82081 WAT 3100 ATOM 82081 O WAT 3101 28.531 10.544 146.065 1.00 0.00 O ATOM 82082 H1 WAT 3101 27.946 10.584 146.822 1.00 0.00 H ATOM 82083 H2 WAT 3101 28.951 11.404 146.042 1.00 0.00 H TER 82085 WAT 3101 ATOM 82085 O WAT 3102 54.285 8.856 127.527 1.00 0.00 O ATOM 82086 H1 WAT 3102 54.094 8.202 128.199 1.00 0.00 H ATOM 82087 H2 WAT 3102 54.729 8.366 126.835 1.00 0.00 H TER 82089 WAT 3102 ATOM 82089 O WAT 3103 117.644 11.450 2.146 1.00 0.00 O ATOM 82090 H1 WAT 3103 118.442 11.372 2.669 1.00 0.00 H ATOM 82091 H2 WAT 3103 117.475 12.391 2.104 1.00 0.00 H TER 82093 WAT 3103 ATOM 82093 O WAT 3104 24.650 47.241 82.766 1.00 0.00 O ATOM 82094 H1 WAT 3104 25.277 47.114 83.478 1.00 0.00 H ATOM 82095 H2 WAT 3104 24.836 48.120 82.437 1.00 0.00 H TER 82097 WAT 3104 ATOM 82097 O WAT 3105 38.725 68.328 21.680 1.00 0.00 O ATOM 82098 H1 WAT 3105 38.268 68.683 22.443 1.00 0.00 H ATOM 82099 H2 WAT 3105 39.652 68.482 21.863 1.00 0.00 H TER 82101 WAT 3105 ATOM 82101 O WAT 3106 79.224 80.821 2.004 1.00 0.00 O ATOM 82102 H1 WAT 3106 79.626 80.612 2.847 1.00 0.00 H ATOM 82103 H2 WAT 3106 78.920 81.723 2.101 1.00 0.00 H TER 82105 WAT 3106 ATOM 82105 O WAT 3107 74.070 119.876 154.200 1.00 0.00 O ATOM 82106 H1 WAT 3107 74.402 120.747 154.417 1.00 0.00 H ATOM 82107 H2 WAT 3107 74.779 119.465 153.705 1.00 0.00 H TER 82109 WAT 3107 ATOM 82109 O WAT 3108 50.400 17.955 115.109 1.00 0.00 O ATOM 82110 H1 WAT 3108 50.447 17.238 115.742 1.00 0.00 H ATOM 82111 H2 WAT 3108 49.465 18.058 114.933 1.00 0.00 H TER 82113 WAT 3108 ATOM 82113 O WAT 3109 51.279 50.774 2.492 1.00 0.00 O ATOM 82114 H1 WAT 3109 50.544 50.815 1.881 1.00 0.00 H ATOM 82115 H2 WAT 3109 51.956 51.320 2.091 1.00 0.00 H TER 82117 WAT 3109 ATOM 82117 O WAT 3110 76.201 74.653 129.330 1.00 0.00 O ATOM 82118 H1 WAT 3110 76.733 75.443 129.432 1.00 0.00 H ATOM 82119 H2 WAT 3110 75.540 74.892 128.680 1.00 0.00 H TER 82121 WAT 3110 ATOM 82121 O WAT 3111 86.284 60.478 139.290 1.00 0.00 O ATOM 82122 H1 WAT 3111 85.860 60.373 138.439 1.00 0.00 H ATOM 82123 H2 WAT 3111 85.569 60.693 139.889 1.00 0.00 H TER 82125 WAT 3111 ATOM 82125 O WAT 3112 89.759 134.508 21.495 1.00 0.00 O ATOM 82126 H1 WAT 3112 89.200 135.108 21.000 1.00 0.00 H ATOM 82127 H2 WAT 3112 89.863 133.749 20.921 1.00 0.00 H TER 82129 WAT 3112 ATOM 82129 O WAT 3113 39.457 55.157 113.596 1.00 0.00 O ATOM 82130 H1 WAT 3113 39.971 55.432 114.355 1.00 0.00 H ATOM 82131 H2 WAT 3113 38.621 54.870 113.963 1.00 0.00 H TER 82133 WAT 3113 ATOM 82133 O WAT 3114 99.297 100.497 100.554 1.00 0.00 O ATOM 82134 H1 WAT 3114 98.713 100.377 99.805 1.00 0.00 H ATOM 82135 H2 WAT 3114 100.061 100.948 100.193 1.00 0.00 H TER 82137 WAT 3114 ATOM 82137 O WAT 3115 110.810 116.365 147.137 1.00 0.00 O ATOM 82138 H1 WAT 3115 111.663 116.490 147.552 1.00 0.00 H ATOM 82139 H2 WAT 3115 111.002 115.879 146.335 1.00 0.00 H TER 82141 WAT 3115 ATOM 82141 O WAT 3116 85.698 142.363 91.971 1.00 0.00 O ATOM 82142 H1 WAT 3116 85.210 142.481 92.786 1.00 0.00 H ATOM 82143 H2 WAT 3116 85.048 142.498 91.281 1.00 0.00 H TER 82145 WAT 3116 ATOM 82145 O WAT 3117 79.167 113.471 129.030 1.00 0.00 O ATOM 82146 H1 WAT 3117 79.746 114.004 129.575 1.00 0.00 H ATOM 82147 H2 WAT 3117 78.300 113.857 129.154 1.00 0.00 H TER 82149 WAT 3117 ATOM 82149 O WAT 3118 128.093 118.100 67.935 1.00 0.00 O ATOM 82150 H1 WAT 3118 128.167 118.104 68.889 1.00 0.00 H ATOM 82151 H2 WAT 3118 128.991 117.976 67.626 1.00 0.00 H TER 82153 WAT 3118 ATOM 82153 O WAT 3119 61.239 7.026 82.980 1.00 0.00 O ATOM 82154 H1 WAT 3119 60.780 6.235 82.696 1.00 0.00 H ATOM 82155 H2 WAT 3119 61.776 7.274 82.227 1.00 0.00 H TER 82157 WAT 3119 ATOM 82157 O WAT 3120 84.138 74.241 1.659 1.00 0.00 O ATOM 82158 H1 WAT 3120 84.055 73.868 2.537 1.00 0.00 H ATOM 82159 H2 WAT 3120 84.266 73.483 1.088 1.00 0.00 H TER 82161 WAT 3120 ATOM 82161 O WAT 3121 73.036 40.704 156.639 1.00 0.00 O ATOM 82162 H1 WAT 3121 72.415 41.077 156.014 1.00 0.00 H ATOM 82163 H2 WAT 3121 73.515 40.045 156.137 1.00 0.00 H TER 82165 WAT 3121 ATOM 82165 O WAT 3122 76.885 93.412 117.690 1.00 0.00 O ATOM 82166 H1 WAT 3122 77.621 92.901 117.354 1.00 0.00 H ATOM 82167 H2 WAT 3122 76.970 93.357 118.642 1.00 0.00 H TER 82169 WAT 3122 ATOM 82169 O WAT 3123 29.697 131.542 136.189 1.00 0.00 O ATOM 82170 H1 WAT 3123 28.812 131.748 136.488 1.00 0.00 H ATOM 82171 H2 WAT 3123 30.265 131.828 136.905 1.00 0.00 H TER 82173 WAT 3123 ATOM 82173 O WAT 3124 139.800 81.332 123.080 1.00 0.00 O ATOM 82174 H1 WAT 3124 139.756 81.784 123.922 1.00 0.00 H ATOM 82175 H2 WAT 3124 139.859 80.404 123.308 1.00 0.00 H TER 82177 WAT 3124 ATOM 82177 O WAT 3125 20.094 130.977 18.040 1.00 0.00 O ATOM 82178 H1 WAT 3125 20.047 130.618 18.926 1.00 0.00 H ATOM 82179 H2 WAT 3125 19.275 130.704 17.628 1.00 0.00 H TER 82181 WAT 3125 ATOM 82181 O WAT 3126 91.657 103.798 134.967 1.00 0.00 O ATOM 82182 H1 WAT 3126 92.320 103.534 135.605 1.00 0.00 H ATOM 82183 H2 WAT 3126 91.195 104.523 135.388 1.00 0.00 H TER 82185 WAT 3126 ATOM 82185 O WAT 3127 36.310 54.937 123.932 1.00 0.00 O ATOM 82186 H1 WAT 3127 37.017 54.495 123.462 1.00 0.00 H ATOM 82187 H2 WAT 3127 35.753 55.298 123.242 1.00 0.00 H TER 82189 WAT 3127 ATOM 82189 O WAT 3128 39.599 49.031 158.072 1.00 0.00 O ATOM 82190 H1 WAT 3128 40.292 49.690 158.069 1.00 0.00 H ATOM 82191 H2 WAT 3128 39.123 49.179 157.255 1.00 0.00 H TER 82193 WAT 3128 ATOM 82193 O WAT 3129 9.430 109.242 140.904 1.00 0.00 O ATOM 82194 H1 WAT 3129 9.630 108.453 140.400 1.00 0.00 H ATOM 82195 H2 WAT 3129 10.264 109.488 141.305 1.00 0.00 H TER 82197 WAT 3129 ATOM 82197 O WAT 3130 57.759 89.183 71.021 1.00 0.00 O ATOM 82198 H1 WAT 3130 57.476 88.432 70.499 1.00 0.00 H ATOM 82199 H2 WAT 3130 57.977 89.855 70.375 1.00 0.00 H TER 82201 WAT 3130 ATOM 82201 O WAT 3131 95.986 89.729 116.138 1.00 0.00 O ATOM 82202 H1 WAT 3131 95.886 89.450 115.228 1.00 0.00 H ATOM 82203 H2 WAT 3131 95.092 89.769 116.476 1.00 0.00 H TER 82205 WAT 3131 ATOM 82205 O WAT 3132 130.446 136.194 134.085 1.00 0.00 O ATOM 82206 H1 WAT 3132 129.785 136.505 134.704 1.00 0.00 H ATOM 82207 H2 WAT 3132 129.962 136.041 133.274 1.00 0.00 H TER 82209 WAT 3132 ATOM 82209 O WAT 3133 95.989 128.662 79.352 1.00 0.00 O ATOM 82210 H1 WAT 3133 96.243 129.476 79.787 1.00 0.00 H ATOM 82211 H2 WAT 3133 96.124 127.984 80.015 1.00 0.00 H TER 82213 WAT 3133 ATOM 82213 O WAT 3134 36.255 142.565 16.304 1.00 0.00 O ATOM 82214 H1 WAT 3134 35.441 142.118 16.074 1.00 0.00 H ATOM 82215 H2 WAT 3134 36.128 142.844 17.211 1.00 0.00 H TER 82217 WAT 3134 ATOM 82217 O WAT 3135 122.463 141.471 73.967 1.00 0.00 O ATOM 82218 H1 WAT 3135 121.677 141.563 74.505 1.00 0.00 H ATOM 82219 H2 WAT 3135 123.103 141.056 74.546 1.00 0.00 H TER 82221 WAT 3135 ATOM 82221 O WAT 3136 17.769 112.574 7.421 1.00 0.00 O ATOM 82222 H1 WAT 3136 17.122 112.539 8.126 1.00 0.00 H ATOM 82223 H2 WAT 3136 17.431 113.237 6.819 1.00 0.00 H TER 82225 WAT 3136 ATOM 82225 O WAT 3137 127.397 108.734 93.585 1.00 0.00 O ATOM 82226 H1 WAT 3137 128.304 109.017 93.698 1.00 0.00 H ATOM 82227 H2 WAT 3137 127.339 107.915 94.078 1.00 0.00 H TER 82229 WAT 3137 ATOM 82229 O WAT 3138 74.218 45.441 90.730 1.00 0.00 O ATOM 82230 H1 WAT 3138 73.915 46.002 90.017 1.00 0.00 H ATOM 82231 H2 WAT 3138 74.384 44.594 90.315 1.00 0.00 H TER 82233 WAT 3138 ATOM 82233 O WAT 3139 106.807 36.442 14.636 1.00 0.00 O ATOM 82234 H1 WAT 3139 106.231 36.205 15.363 1.00 0.00 H ATOM 82235 H2 WAT 3139 107.630 36.694 15.056 1.00 0.00 H TER 82237 WAT 3139 ATOM 82237 O WAT 3140 91.911 105.424 93.170 1.00 0.00 O ATOM 82238 H1 WAT 3140 91.838 106.273 93.605 1.00 0.00 H ATOM 82239 H2 WAT 3140 91.994 104.794 93.885 1.00 0.00 H TER 82241 WAT 3140 ATOM 82241 O WAT 3141 80.223 26.333 131.517 1.00 0.00 O ATOM 82242 H1 WAT 3141 80.159 25.967 130.635 1.00 0.00 H ATOM 82243 H2 WAT 3141 79.319 26.530 131.762 1.00 0.00 H TER 82245 WAT 3141 ATOM 82245 O WAT 3142 13.525 53.791 7.692 1.00 0.00 O ATOM 82246 H1 WAT 3142 13.371 53.479 8.584 1.00 0.00 H ATOM 82247 H2 WAT 3142 14.368 53.410 7.447 1.00 0.00 H TER 82249 WAT 3142 ATOM 82249 O WAT 3143 62.986 46.563 131.393 1.00 0.00 O ATOM 82250 H1 WAT 3143 63.457 46.090 132.079 1.00 0.00 H ATOM 82251 H2 WAT 3143 63.633 46.685 130.699 1.00 0.00 H TER 82253 WAT 3143 ATOM 82253 O WAT 3144 23.315 119.996 119.939 1.00 0.00 O ATOM 82254 H1 WAT 3144 22.888 120.853 119.950 1.00 0.00 H ATOM 82255 H2 WAT 3144 22.786 119.457 120.527 1.00 0.00 H TER 82257 WAT 3144 ATOM 82257 O WAT 3145 140.287 38.816 107.760 1.00 0.00 O ATOM 82258 H1 WAT 3145 141.179 38.528 107.568 1.00 0.00 H ATOM 82259 H2 WAT 3145 140.098 39.473 107.090 1.00 0.00 H TER 82261 WAT 3145 ATOM 82261 O WAT 3146 76.694 19.676 98.998 1.00 0.00 O ATOM 82262 H1 WAT 3146 76.718 20.440 98.422 1.00 0.00 H ATOM 82263 H2 WAT 3146 76.940 18.942 98.434 1.00 0.00 H TER 82265 WAT 3146 ATOM 82265 O WAT 3147 10.413 35.767 0.886 1.00 0.00 O ATOM 82266 H1 WAT 3147 10.805 35.292 1.620 1.00 0.00 H ATOM 82267 H2 WAT 3147 10.081 36.576 1.275 1.00 0.00 H TER 82269 WAT 3147 ATOM 82269 O WAT 3148 134.937 12.930 154.291 1.00 0.00 O ATOM 82270 H1 WAT 3148 134.519 12.425 153.593 1.00 0.00 H ATOM 82271 H2 WAT 3148 134.407 13.724 154.363 1.00 0.00 H TER 82273 WAT 3148 ATOM 82273 O WAT 3149 28.928 29.021 132.841 1.00 0.00 O ATOM 82274 H1 WAT 3149 29.445 28.216 132.808 1.00 0.00 H ATOM 82275 H2 WAT 3149 28.142 28.780 133.332 1.00 0.00 H TER 82277 WAT 3149 ATOM 82277 O WAT 3150 127.714 145.918 150.222 1.00 0.00 O ATOM 82278 H1 WAT 3150 127.226 145.717 151.021 1.00 0.00 H ATOM 82279 H2 WAT 3150 128.614 145.659 150.420 1.00 0.00 H TER 82281 WAT 3150 ATOM 82281 O WAT 3151 48.895 40.619 158.825 1.00 0.00 O ATOM 82282 H1 WAT 3151 48.488 39.860 158.408 1.00 0.00 H ATOM 82283 H2 WAT 3151 49.679 40.788 158.301 1.00 0.00 H TER 82285 WAT 3151 ATOM 82285 O WAT 3152 140.811 50.134 119.697 1.00 0.00 O ATOM 82286 H1 WAT 3152 141.480 50.588 119.184 1.00 0.00 H ATOM 82287 H2 WAT 3152 139.988 50.546 119.436 1.00 0.00 H TER 82289 WAT 3152 ATOM 82289 O WAT 3153 3.215 19.224 101.031 1.00 0.00 O ATOM 82290 H1 WAT 3153 3.281 20.130 100.728 1.00 0.00 H ATOM 82291 H2 WAT 3153 2.570 19.255 101.738 1.00 0.00 H TER 82293 WAT 3153 ATOM 82293 O WAT 3154 87.559 145.249 18.295 1.00 0.00 O ATOM 82294 H1 WAT 3154 87.912 145.930 17.722 1.00 0.00 H ATOM 82295 H2 WAT 3154 86.801 145.657 18.713 1.00 0.00 H TER 82297 WAT 3154 ATOM 82297 O WAT 3155 103.963 104.565 108.076 1.00 0.00 O ATOM 82298 H1 WAT 3155 104.769 104.109 107.834 1.00 0.00 H ATOM 82299 H2 WAT 3155 104.241 105.219 108.718 1.00 0.00 H TER 82301 WAT 3155 ATOM 82301 O WAT 3156 80.220 31.504 108.521 1.00 0.00 O ATOM 82302 H1 WAT 3156 80.419 30.568 108.521 1.00 0.00 H ATOM 82303 H2 WAT 3156 81.075 31.931 108.573 1.00 0.00 H TER 82305 WAT 3156 ATOM 82305 O WAT 3157 55.330 137.827 97.225 1.00 0.00 O ATOM 82306 H1 WAT 3157 54.961 137.515 98.051 1.00 0.00 H ATOM 82307 H2 WAT 3157 55.433 138.770 97.350 1.00 0.00 H TER 82309 WAT 3157 ATOM 82309 O WAT 3158 94.755 131.320 158.829 1.00 0.00 O ATOM 82310 H1 WAT 3158 94.800 131.159 157.886 1.00 0.00 H ATOM 82311 H2 WAT 3158 94.184 130.627 159.162 1.00 0.00 H TER 82313 WAT 3158 ATOM 82313 O WAT 3159 37.686 95.680 63.099 1.00 0.00 O ATOM 82314 H1 WAT 3159 37.851 96.184 62.302 1.00 0.00 H ATOM 82315 H2 WAT 3159 37.184 94.921 62.803 1.00 0.00 H TER 82317 WAT 3159 ATOM 82317 O WAT 3160 135.645 98.392 121.928 1.00 0.00 O ATOM 82318 H1 WAT 3160 136.155 98.084 122.677 1.00 0.00 H ATOM 82319 H2 WAT 3160 135.180 99.162 122.255 1.00 0.00 H TER 82321 WAT 3160 ATOM 82321 O WAT 3161 91.209 50.146 113.011 1.00 0.00 O ATOM 82322 H1 WAT 3161 91.888 50.688 113.412 1.00 0.00 H ATOM 82323 H2 WAT 3161 91.489 49.247 113.180 1.00 0.00 H TER 82325 WAT 3161 ATOM 82325 O WAT 3162 26.691 124.487 85.934 1.00 0.00 O ATOM 82326 H1 WAT 3162 27.324 124.107 86.544 1.00 0.00 H ATOM 82327 H2 WAT 3162 26.047 123.792 85.794 1.00 0.00 H TER 82329 WAT 3162 ATOM 82329 O WAT 3163 125.043 18.643 23.570 1.00 0.00 O ATOM 82330 H1 WAT 3163 125.823 18.284 23.993 1.00 0.00 H ATOM 82331 H2 WAT 3163 125.359 19.417 23.104 1.00 0.00 H TER 82333 WAT 3163 ATOM 82333 O WAT 3164 29.952 121.218 121.374 1.00 0.00 O ATOM 82334 H1 WAT 3164 29.399 121.819 120.874 1.00 0.00 H ATOM 82335 H2 WAT 3164 30.844 121.433 121.103 1.00 0.00 H TER 82337 WAT 3164 ATOM 82337 O WAT 3165 13.260 126.176 86.092 1.00 0.00 O ATOM 82338 H1 WAT 3165 13.303 126.361 87.030 1.00 0.00 H ATOM 82339 H2 WAT 3165 12.910 125.286 86.039 1.00 0.00 H TER 82341 WAT 3165 ATOM 82341 O WAT 3166 72.314 35.413 19.309 1.00 0.00 O ATOM 82342 H1 WAT 3166 72.207 36.245 18.847 1.00 0.00 H ATOM 82343 H2 WAT 3166 72.849 34.880 18.721 1.00 0.00 H TER 82345 WAT 3166 ATOM 82345 O WAT 3167 142.304 117.398 83.105 1.00 0.00 O ATOM 82346 H1 WAT 3167 143.241 117.526 83.248 1.00 0.00 H ATOM 82347 H2 WAT 3167 142.203 116.451 83.005 1.00 0.00 H TER 82349 WAT 3167 ATOM 82349 O WAT 3168 87.576 74.667 69.006 1.00 0.00 O ATOM 82350 H1 WAT 3168 88.323 74.314 69.489 1.00 0.00 H ATOM 82351 H2 WAT 3168 86.851 74.640 69.631 1.00 0.00 H TER 82353 WAT 3168 ATOM 82353 O WAT 3169 28.899 90.501 8.259 1.00 0.00 O ATOM 82354 H1 WAT 3169 28.628 90.789 7.387 1.00 0.00 H ATOM 82355 H2 WAT 3169 28.340 89.747 8.448 1.00 0.00 H TER 82357 WAT 3169 ATOM 82357 O WAT 3170 15.834 10.854 115.457 1.00 0.00 O ATOM 82358 H1 WAT 3170 15.412 11.668 115.730 1.00 0.00 H ATOM 82359 H2 WAT 3170 15.997 10.971 114.521 1.00 0.00 H TER 82361 WAT 3170 ATOM 82361 O WAT 3171 114.965 136.295 106.316 1.00 0.00 O ATOM 82362 H1 WAT 3171 114.985 137.250 106.260 1.00 0.00 H ATOM 82363 H2 WAT 3171 115.841 136.021 106.043 1.00 0.00 H TER 82365 WAT 3171 ATOM 82365 O WAT 3172 15.111 57.296 135.401 1.00 0.00 O ATOM 82366 H1 WAT 3172 15.601 58.076 135.144 1.00 0.00 H ATOM 82367 H2 WAT 3172 15.562 56.574 134.964 1.00 0.00 H TER 82369 WAT 3172 ATOM 82369 O WAT 3173 125.630 17.279 98.161 1.00 0.00 O ATOM 82370 H1 WAT 3173 126.112 16.608 98.645 1.00 0.00 H ATOM 82371 H2 WAT 3173 126.275 17.968 98.002 1.00 0.00 H TER 82373 WAT 3173 ATOM 82373 O WAT 3174 100.605 127.804 73.894 1.00 0.00 O ATOM 82374 H1 WAT 3174 100.320 127.462 74.741 1.00 0.00 H ATOM 82375 H2 WAT 3174 101.501 127.481 73.795 1.00 0.00 H TER 82377 WAT 3174 ATOM 82377 O WAT 3175 47.873 112.282 77.172 1.00 0.00 O ATOM 82378 H1 WAT 3175 48.116 111.766 76.403 1.00 0.00 H ATOM 82379 H2 WAT 3175 47.339 111.688 77.700 1.00 0.00 H TER 82381 WAT 3175 ATOM 82381 O WAT 3176 115.855 96.452 3.041 1.00 0.00 O ATOM 82382 H1 WAT 3176 116.464 95.980 2.473 1.00 0.00 H ATOM 82383 H2 WAT 3176 116.383 96.713 3.795 1.00 0.00 H TER 82385 WAT 3176 ATOM 82385 O WAT 3177 123.760 126.435 119.801 1.00 0.00 O ATOM 82386 H1 WAT 3177 123.864 127.281 120.237 1.00 0.00 H ATOM 82387 H2 WAT 3177 123.223 126.627 119.032 1.00 0.00 H TER 82389 WAT 3177 ATOM 82389 O WAT 3178 89.151 21.153 77.219 1.00 0.00 O ATOM 82390 H1 WAT 3178 89.752 21.659 77.767 1.00 0.00 H ATOM 82391 H2 WAT 3178 89.585 20.307 77.105 1.00 0.00 H TER 82393 WAT 3178 ATOM 82393 O WAT 3179 124.419 30.579 1.219 1.00 0.00 O ATOM 82394 H1 WAT 3179 124.411 30.326 0.296 1.00 0.00 H ATOM 82395 H2 WAT 3179 124.448 31.535 1.206 1.00 0.00 H TER 82397 WAT 3179 ATOM 82397 O WAT 3180 23.574 114.485 99.060 1.00 0.00 O ATOM 82398 H1 WAT 3180 23.041 113.713 99.250 1.00 0.00 H ATOM 82399 H2 WAT 3180 24.468 114.219 99.274 1.00 0.00 H TER 82401 WAT 3180 ATOM 82401 O WAT 3181 59.294 122.160 57.920 1.00 0.00 O ATOM 82402 H1 WAT 3181 59.879 121.819 58.597 1.00 0.00 H ATOM 82403 H2 WAT 3181 59.877 122.410 57.204 1.00 0.00 H TER 82405 WAT 3181 ATOM 82405 O WAT 3182 94.988 112.084 1.110 1.00 0.00 O ATOM 82406 H1 WAT 3182 94.216 111.646 0.752 1.00 0.00 H ATOM 82407 H2 WAT 3182 94.664 112.933 1.410 1.00 0.00 H TER 82409 WAT 3182 ATOM 82409 O WAT 3183 135.475 87.283 152.748 1.00 0.00 O ATOM 82410 H1 WAT 3183 135.014 87.979 153.216 1.00 0.00 H ATOM 82411 H2 WAT 3183 135.216 86.479 153.199 1.00 0.00 H TER 82413 WAT 3183 ATOM 82413 O WAT 3184 2.399 22.109 85.784 1.00 0.00 O ATOM 82414 H1 WAT 3184 3.322 21.854 85.761 1.00 0.00 H ATOM 82415 H2 WAT 3184 2.367 22.837 86.404 1.00 0.00 H TER 82417 WAT 3184 ATOM 82417 O WAT 3185 91.944 97.645 84.894 1.00 0.00 O ATOM 82418 H1 WAT 3185 92.189 97.136 84.121 1.00 0.00 H ATOM 82419 H2 WAT 3185 91.274 97.117 85.327 1.00 0.00 H TER 82421 WAT 3185 ATOM 82421 O WAT 3186 104.749 100.860 102.954 1.00 0.00 O ATOM 82422 H1 WAT 3186 103.877 101.119 102.656 1.00 0.00 H ATOM 82423 H2 WAT 3186 104.609 100.029 103.408 1.00 0.00 H TER 82425 WAT 3186 ATOM 82425 O WAT 3187 32.058 108.129 140.140 1.00 0.00 O ATOM 82426 H1 WAT 3187 32.573 108.357 140.914 1.00 0.00 H ATOM 82427 H2 WAT 3187 31.886 108.967 139.711 1.00 0.00 H TER 82429 WAT 3187 ATOM 82429 O WAT 3188 118.792 125.054 112.458 1.00 0.00 O ATOM 82430 H1 WAT 3188 119.671 124.884 112.796 1.00 0.00 H ATOM 82431 H2 WAT 3188 118.738 124.533 111.657 1.00 0.00 H TER 82433 WAT 3188 ATOM 82433 O WAT 3189 22.438 16.967 3.526 1.00 0.00 O ATOM 82434 H1 WAT 3189 21.945 16.344 2.992 1.00 0.00 H ATOM 82435 H2 WAT 3189 21.994 17.804 3.389 1.00 0.00 H TER 82437 WAT 3189 ATOM 82437 O WAT 3190 57.167 8.761 102.723 1.00 0.00 O ATOM 82438 H1 WAT 3190 56.860 8.888 101.826 1.00 0.00 H ATOM 82439 H2 WAT 3190 57.910 9.359 102.808 1.00 0.00 H TER 82441 WAT 3190 ATOM 82441 O WAT 3191 4.978 90.789 121.527 1.00 0.00 O ATOM 82442 H1 WAT 3191 4.274 91.323 121.894 1.00 0.00 H ATOM 82443 H2 WAT 3191 5.671 90.820 122.187 1.00 0.00 H TER 82445 WAT 3191 ATOM 82445 O WAT 3192 117.702 23.635 91.744 1.00 0.00 O ATOM 82446 H1 WAT 3192 118.083 24.218 92.401 1.00 0.00 H ATOM 82447 H2 WAT 3192 117.442 22.857 92.237 1.00 0.00 H TER 82449 WAT 3192 ATOM 82449 O WAT 3193 48.880 113.020 129.039 1.00 0.00 O ATOM 82450 H1 WAT 3193 48.172 112.434 128.773 1.00 0.00 H ATOM 82451 H2 WAT 3193 49.648 112.453 129.106 1.00 0.00 H TER 82453 WAT 3193 ATOM 82453 O WAT 3194 84.894 99.916 139.644 1.00 0.00 O ATOM 82454 H1 WAT 3194 85.280 99.378 138.952 1.00 0.00 H ATOM 82455 H2 WAT 3194 85.645 100.289 140.105 1.00 0.00 H TER 82457 WAT 3194 ATOM 82457 O WAT 3195 31.947 88.025 0.343 1.00 0.00 O ATOM 82458 H1 WAT 3195 31.313 87.689 -0.291 1.00 0.00 H ATOM 82459 H2 WAT 3195 32.757 87.555 0.143 1.00 0.00 H TER 82461 WAT 3195 ATOM 82461 O WAT 3196 75.681 95.392 148.731 1.00 0.00 O ATOM 82462 H1 WAT 3196 76.120 95.944 149.379 1.00 0.00 H ATOM 82463 H2 WAT 3196 76.395 94.974 148.250 1.00 0.00 H TER 82465 WAT 3196 ATOM 82465 O WAT 3197 85.997 12.601 65.679 1.00 0.00 O ATOM 82466 H1 WAT 3197 86.357 13.043 66.448 1.00 0.00 H ATOM 82467 H2 WAT 3197 86.252 13.156 64.942 1.00 0.00 H TER 82469 WAT 3197 ATOM 82469 O WAT 3198 121.254 61.111 101.285 1.00 0.00 O ATOM 82470 H1 WAT 3198 120.531 60.503 101.443 1.00 0.00 H ATOM 82471 H2 WAT 3198 120.858 61.832 100.796 1.00 0.00 H TER 82473 WAT 3198 ATOM 82473 O WAT 3199 35.195 41.839 135.445 1.00 0.00 O ATOM 82474 H1 WAT 3199 35.185 41.514 136.345 1.00 0.00 H ATOM 82475 H2 WAT 3199 36.099 42.118 135.300 1.00 0.00 H TER 82477 WAT 3199 ATOM 82477 O WAT 3200 112.693 101.817 82.244 1.00 0.00 O ATOM 82478 H1 WAT 3200 113.020 101.204 81.586 1.00 0.00 H ATOM 82479 H2 WAT 3200 111.881 101.421 82.559 1.00 0.00 H TER 82481 WAT 3200 ATOM 82481 O WAT 3201 0.995 125.900 110.758 1.00 0.00 O ATOM 82482 H1 WAT 3201 1.531 126.094 109.988 1.00 0.00 H ATOM 82483 H2 WAT 3201 0.237 125.431 110.410 1.00 0.00 H TER 82485 WAT 3201 ATOM 82485 O WAT 3202 40.295 -0.156 27.206 1.00 0.00 O ATOM 82486 H1 WAT 3202 39.497 -0.213 26.679 1.00 0.00 H ATOM 82487 H2 WAT 3202 40.426 0.783 27.340 1.00 0.00 H TER 82489 WAT 3202 ATOM 82489 O WAT 3203 140.494 70.658 62.799 1.00 0.00 O ATOM 82490 H1 WAT 3203 141.349 70.881 62.429 1.00 0.00 H ATOM 82491 H2 WAT 3203 140.167 69.954 62.238 1.00 0.00 H TER 82493 WAT 3203 ATOM 82493 O WAT 3204 13.482 30.472 93.022 1.00 0.00 O ATOM 82494 H1 WAT 3204 13.461 31.082 92.285 1.00 0.00 H ATOM 82495 H2 WAT 3204 13.344 31.022 93.793 1.00 0.00 H TER 82497 WAT 3204 ATOM 82497 O WAT 3205 139.114 137.409 72.883 1.00 0.00 O ATOM 82498 H1 WAT 3205 139.014 138.145 72.280 1.00 0.00 H ATOM 82499 H2 WAT 3205 139.646 136.775 72.401 1.00 0.00 H TER 82501 WAT 3205 ATOM 82501 O WAT 3206 91.618 121.169 119.795 1.00 0.00 O ATOM 82502 H1 WAT 3206 91.940 121.754 119.110 1.00 0.00 H ATOM 82503 H2 WAT 3206 91.345 121.754 120.502 1.00 0.00 H TER 82505 WAT 3206 ATOM 82505 O WAT 3207 87.848 29.840 118.382 1.00 0.00 O ATOM 82506 H1 WAT 3207 88.220 30.570 118.876 1.00 0.00 H ATOM 82507 H2 WAT 3207 88.243 29.060 118.772 1.00 0.00 H TER 82509 WAT 3207 ATOM 82509 O WAT 3208 19.682 107.217 17.991 1.00 0.00 O ATOM 82510 H1 WAT 3208 20.029 106.892 17.160 1.00 0.00 H ATOM 82511 H2 WAT 3208 19.210 108.016 17.757 1.00 0.00 H TER 82513 WAT 3208 ATOM 82513 O WAT 3209 72.723 41.127 73.741 1.00 0.00 O ATOM 82514 H1 WAT 3209 73.171 40.383 74.142 1.00 0.00 H ATOM 82515 H2 WAT 3209 73.389 41.541 73.192 1.00 0.00 H TER 82517 WAT 3209 ATOM 82517 O WAT 3210 144.764 9.348 112.757 1.00 0.00 O ATOM 82518 H1 WAT 3210 144.463 8.446 112.867 1.00 0.00 H ATOM 82519 H2 WAT 3210 143.960 9.867 112.731 1.00 0.00 H TER 82521 WAT 3210 ATOM 82521 O WAT 3211 33.231 93.568 24.113 1.00 0.00 O ATOM 82522 H1 WAT 3211 33.618 92.692 24.113 1.00 0.00 H ATOM 82523 H2 WAT 3211 32.982 93.720 23.201 1.00 0.00 H TER 82525 WAT 3211 ATOM 82525 O WAT 3212 137.622 130.025 67.667 1.00 0.00 O ATOM 82526 H1 WAT 3212 137.229 130.162 66.805 1.00 0.00 H ATOM 82527 H2 WAT 3212 138.524 129.762 67.480 1.00 0.00 H TER 82529 WAT 3212 ATOM 82529 O WAT 3213 83.994 55.281 121.276 1.00 0.00 O ATOM 82530 H1 WAT 3213 83.659 56.137 121.544 1.00 0.00 H ATOM 82531 H2 WAT 3213 84.724 55.483 120.691 1.00 0.00 H TER 82533 WAT 3213 ATOM 82533 O WAT 3214 89.817 13.862 3.398 1.00 0.00 O ATOM 82534 H1 WAT 3214 89.126 14.517 3.494 1.00 0.00 H ATOM 82535 H2 WAT 3214 89.481 13.254 2.740 1.00 0.00 H TER 82537 WAT 3214 ATOM 82537 O WAT 3215 60.472 142.444 129.713 1.00 0.00 O ATOM 82538 H1 WAT 3215 61.275 141.926 129.772 1.00 0.00 H ATOM 82539 H2 WAT 3215 60.031 142.115 128.929 1.00 0.00 H TER 82541 WAT 3215 ATOM 82541 O WAT 3216 67.431 68.360 19.697 1.00 0.00 O ATOM 82542 H1 WAT 3216 67.471 67.834 18.898 1.00 0.00 H ATOM 82543 H2 WAT 3216 68.126 69.010 19.590 1.00 0.00 H TER 82545 WAT 3216 ATOM 82545 O WAT 3217 37.614 105.100 54.219 1.00 0.00 O ATOM 82546 H1 WAT 3217 37.026 104.390 53.961 1.00 0.00 H ATOM 82547 H2 WAT 3217 37.650 105.045 55.174 1.00 0.00 H TER 82549 WAT 3217 ATOM 82549 O WAT 3218 22.282 136.362 19.642 1.00 0.00 O ATOM 82550 H1 WAT 3218 23.109 136.407 20.123 1.00 0.00 H ATOM 82551 H2 WAT 3218 21.609 136.484 20.312 1.00 0.00 H TER 82553 WAT 3218 ATOM 82553 O WAT 3219 127.465 13.997 79.879 1.00 0.00 O ATOM 82554 H1 WAT 3219 126.620 13.662 79.580 1.00 0.00 H ATOM 82555 H2 WAT 3219 127.682 14.690 79.256 1.00 0.00 H TER 82557 WAT 3219 ATOM 82557 O WAT 3220 79.909 10.077 27.022 1.00 0.00 O ATOM 82558 H1 WAT 3220 79.565 10.915 26.716 1.00 0.00 H ATOM 82559 H2 WAT 3220 80.460 9.767 26.303 1.00 0.00 H TER 82561 WAT 3220 ATOM 82561 O WAT 3221 93.241 38.490 9.131 1.00 0.00 O ATOM 82562 H1 WAT 3221 92.740 38.951 8.459 1.00 0.00 H ATOM 82563 H2 WAT 3221 94.056 38.987 9.206 1.00 0.00 H TER 82565 WAT 3221 ATOM 82565 O WAT 3222 84.381 71.622 60.660 1.00 0.00 O ATOM 82566 H1 WAT 3222 83.915 70.835 60.943 1.00 0.00 H ATOM 82567 H2 WAT 3222 84.251 71.649 59.712 1.00 0.00 H TER 82569 WAT 3222 ATOM 82569 O WAT 3223 119.682 71.133 139.724 1.00 0.00 O ATOM 82570 H1 WAT 3223 119.306 71.997 139.893 1.00 0.00 H ATOM 82571 H2 WAT 3223 120.448 71.089 140.296 1.00 0.00 H TER 82573 WAT 3223 ATOM 82573 O WAT 3224 80.199 141.565 8.803 1.00 0.00 O ATOM 82574 H1 WAT 3224 79.943 142.413 8.439 1.00 0.00 H ATOM 82575 H2 WAT 3224 80.747 141.170 8.126 1.00 0.00 H TER 82577 WAT 3224 ATOM 82577 O WAT 3225 84.461 138.627 11.821 1.00 0.00 O ATOM 82578 H1 WAT 3225 85.299 139.058 11.991 1.00 0.00 H ATOM 82579 H2 WAT 3225 84.571 137.743 12.169 1.00 0.00 H TER 82581 WAT 3225 ATOM 82581 O WAT 3226 25.764 13.465 121.122 1.00 0.00 O ATOM 82582 H1 WAT 3226 26.073 12.645 121.507 1.00 0.00 H ATOM 82583 H2 WAT 3226 24.863 13.551 121.434 1.00 0.00 H TER 82585 WAT 3226 ATOM 82585 O WAT 3227 51.107 51.201 62.477 1.00 0.00 O ATOM 82586 H1 WAT 3227 50.220 51.151 62.834 1.00 0.00 H ATOM 82587 H2 WAT 3227 51.071 51.918 61.844 1.00 0.00 H TER 82589 WAT 3227 ATOM 82589 O WAT 3228 42.829 56.157 15.055 1.00 0.00 O ATOM 82590 H1 WAT 3228 43.776 56.256 15.161 1.00 0.00 H ATOM 82591 H2 WAT 3228 42.656 55.246 15.292 1.00 0.00 H TER 82593 WAT 3228 ATOM 82593 O WAT 3229 142.647 39.991 58.881 1.00 0.00 O ATOM 82594 H1 WAT 3229 142.164 40.483 58.217 1.00 0.00 H ATOM 82595 H2 WAT 3229 142.807 40.627 59.579 1.00 0.00 H TER 82597 WAT 3229 ATOM 82597 O WAT 3230 77.906 94.136 125.532 1.00 0.00 O ATOM 82598 H1 WAT 3230 77.964 94.225 124.580 1.00 0.00 H ATOM 82599 H2 WAT 3230 78.811 94.005 125.815 1.00 0.00 H TER 82601 WAT 3230 ATOM 82601 O WAT 3231 22.303 28.737 149.438 1.00 0.00 O ATOM 82602 H1 WAT 3231 22.161 28.966 150.357 1.00 0.00 H ATOM 82603 H2 WAT 3231 21.428 28.741 149.052 1.00 0.00 H TER 82605 WAT 3231 ATOM 82605 O WAT 3232 124.460 145.628 69.695 1.00 0.00 O ATOM 82606 H1 WAT 3232 125.314 145.223 69.541 1.00 0.00 H ATOM 82607 H2 WAT 3232 124.650 146.386 70.247 1.00 0.00 H TER 82609 WAT 3232 ATOM 82609 O WAT 3233 63.371 25.439 158.220 1.00 0.00 O ATOM 82610 H1 WAT 3233 63.299 26.152 158.856 1.00 0.00 H ATOM 82611 H2 WAT 3233 63.382 24.644 158.752 1.00 0.00 H TER 82613 WAT 3233 ATOM 82613 O WAT 3234 37.501 9.149 90.468 1.00 0.00 O ATOM 82614 H1 WAT 3234 37.592 8.880 91.382 1.00 0.00 H ATOM 82615 H2 WAT 3234 38.168 8.644 90.003 1.00 0.00 H TER 82617 WAT 3234 ATOM 82617 O WAT 3235 77.000 117.864 144.834 1.00 0.00 O ATOM 82618 H1 WAT 3235 76.361 117.213 144.546 1.00 0.00 H ATOM 82619 H2 WAT 3235 77.132 118.425 144.070 1.00 0.00 H TER 82621 WAT 3235 ATOM 82621 O WAT 3236 15.838 112.790 82.129 1.00 0.00 O ATOM 82622 H1 WAT 3236 14.890 112.915 82.118 1.00 0.00 H ATOM 82623 H2 WAT 3236 16.035 112.522 83.027 1.00 0.00 H TER 82625 WAT 3236 ATOM 82625 O WAT 3237 15.774 42.709 10.476 1.00 0.00 O ATOM 82626 H1 WAT 3237 16.185 43.551 10.279 1.00 0.00 H ATOM 82627 H2 WAT 3237 15.205 42.539 9.726 1.00 0.00 H TER 82629 WAT 3237 ATOM 82629 O WAT 3238 137.193 35.449 64.628 1.00 0.00 O ATOM 82630 H1 WAT 3238 137.051 35.745 65.528 1.00 0.00 H ATOM 82631 H2 WAT 3238 136.630 36.014 64.099 1.00 0.00 H TER 82633 WAT 3238 ATOM 82633 O WAT 3239 10.858 137.623 135.623 1.00 0.00 O ATOM 82634 H1 WAT 3239 10.337 137.703 134.824 1.00 0.00 H ATOM 82635 H2 WAT 3239 11.694 137.262 135.328 1.00 0.00 H TER 82637 WAT 3239 ATOM 82637 O WAT 3240 91.324 88.777 86.484 1.00 0.00 O ATOM 82638 H1 WAT 3240 91.510 87.915 86.114 1.00 0.00 H ATOM 82639 H2 WAT 3240 90.401 88.737 86.733 1.00 0.00 H TER 82641 WAT 3240 ATOM 82641 O WAT 3241 55.476 79.210 65.208 1.00 0.00 O ATOM 82642 H1 WAT 3241 55.634 79.201 66.152 1.00 0.00 H ATOM 82643 H2 WAT 3241 56.071 78.546 64.860 1.00 0.00 H TER 82645 WAT 3241 ATOM 82645 O WAT 3242 57.891 58.078 142.579 1.00 0.00 O ATOM 82646 H1 WAT 3242 58.424 57.695 141.882 1.00 0.00 H ATOM 82647 H2 WAT 3242 57.639 57.333 143.124 1.00 0.00 H TER 82649 WAT 3242 ATOM 82649 O WAT 3243 38.287 25.185 115.615 1.00 0.00 O ATOM 82650 H1 WAT 3243 39.175 24.854 115.749 1.00 0.00 H ATOM 82651 H2 WAT 3243 37.790 24.424 115.315 1.00 0.00 H TER 82653 WAT 3243 ATOM 82653 O WAT 3244 126.468 120.868 155.194 1.00 0.00 O ATOM 82654 H1 WAT 3244 126.897 120.593 156.004 1.00 0.00 H ATOM 82655 H2 WAT 3244 125.674 120.335 155.151 1.00 0.00 H TER 82657 WAT 3244 ATOM 82657 O WAT 3245 34.827 71.530 80.301 1.00 0.00 O ATOM 82658 H1 WAT 3245 34.178 72.038 80.789 1.00 0.00 H ATOM 82659 H2 WAT 3245 35.001 72.053 79.519 1.00 0.00 H TER 82661 WAT 3245 ATOM 82661 O WAT 3246 81.724 134.820 119.468 1.00 0.00 O ATOM 82662 H1 WAT 3246 80.907 135.291 119.632 1.00 0.00 H ATOM 82663 H2 WAT 3246 81.494 133.897 119.578 1.00 0.00 H TER 82665 WAT 3246 ATOM 82665 O WAT 3247 48.161 2.923 76.497 1.00 0.00 O ATOM 82666 H1 WAT 3247 48.797 2.292 76.159 1.00 0.00 H ATOM 82667 H2 WAT 3247 48.580 3.774 76.373 1.00 0.00 H TER 82669 WAT 3247 ATOM 82669 O WAT 3248 1.473 39.854 155.143 1.00 0.00 O ATOM 82670 H1 WAT 3248 2.238 39.701 154.588 1.00 0.00 H ATOM 82671 H2 WAT 3248 0.777 40.094 154.531 1.00 0.00 H TER 82673 WAT 3248 ATOM 82673 O WAT 3249 50.780 141.592 118.589 1.00 0.00 O ATOM 82674 H1 WAT 3249 51.527 140.994 118.601 1.00 0.00 H ATOM 82675 H2 WAT 3249 50.033 141.046 118.835 1.00 0.00 H TER 82677 WAT 3249 ATOM 82677 O WAT 3250 118.819 13.472 136.088 1.00 0.00 O ATOM 82678 H1 WAT 3250 118.960 14.350 135.734 1.00 0.00 H ATOM 82679 H2 WAT 3250 118.291 13.028 135.424 1.00 0.00 H TER 82681 WAT 3250 ATOM 82681 O WAT 3251 0.533 16.436 143.204 1.00 0.00 O ATOM 82682 H1 WAT 3251 0.323 15.916 142.429 1.00 0.00 H ATOM 82683 H2 WAT 3251 0.848 17.270 142.856 1.00 0.00 H TER 82685 WAT 3251 ATOM 82685 O WAT 3252 82.143 94.055 18.526 1.00 0.00 O ATOM 82686 H1 WAT 3252 82.788 93.660 17.939 1.00 0.00 H ATOM 82687 H2 WAT 3252 81.473 93.379 18.634 1.00 0.00 H TER 82689 WAT 3252 ATOM 82689 O WAT 3253 118.931 127.122 77.357 1.00 0.00 O ATOM 82690 H1 WAT 3253 119.222 126.666 78.147 1.00 0.00 H ATOM 82691 H2 WAT 3253 118.331 126.508 76.934 1.00 0.00 H TER 82693 WAT 3253 ATOM 82693 O WAT 3254 65.614 121.212 20.844 1.00 0.00 O ATOM 82694 H1 WAT 3254 65.881 121.780 20.121 1.00 0.00 H ATOM 82695 H2 WAT 3254 66.421 120.774 21.115 1.00 0.00 H TER 82697 WAT 3254 ATOM 82697 O WAT 3255 116.374 119.002 100.094 1.00 0.00 O ATOM 82698 H1 WAT 3255 116.358 119.116 99.144 1.00 0.00 H ATOM 82699 H2 WAT 3255 116.929 118.235 100.234 1.00 0.00 H TER 82701 WAT 3255 ATOM 82701 O WAT 3256 114.993 36.803 84.628 1.00 0.00 O ATOM 82702 H1 WAT 3256 115.010 35.910 84.284 1.00 0.00 H ATOM 82703 H2 WAT 3256 115.843 36.910 85.056 1.00 0.00 H TER 82705 WAT 3256 ATOM 82705 O WAT 3257 86.223 31.331 107.459 1.00 0.00 O ATOM 82706 H1 WAT 3257 85.534 30.991 108.030 1.00 0.00 H ATOM 82707 H2 WAT 3257 86.453 30.593 106.895 1.00 0.00 H TER 82709 WAT 3257 ATOM 82709 O WAT 3258 48.906 134.950 115.438 1.00 0.00 O ATOM 82710 H1 WAT 3258 48.295 134.777 114.722 1.00 0.00 H ATOM 82711 H2 WAT 3258 49.061 134.092 115.833 1.00 0.00 H TER 82713 WAT 3258 ATOM 82713 O WAT 3259 109.070 140.560 144.994 1.00 0.00 O ATOM 82714 H1 WAT 3259 109.021 139.950 144.258 1.00 0.00 H ATOM 82715 H2 WAT 3259 109.971 140.882 144.979 1.00 0.00 H TER 82717 WAT 3259 ATOM 82717 O WAT 3260 129.367 31.790 70.966 1.00 0.00 O ATOM 82718 H1 WAT 3260 129.085 31.068 70.405 1.00 0.00 H ATOM 82719 H2 WAT 3260 129.249 31.461 71.857 1.00 0.00 H TER 82721 WAT 3260 ATOM 82721 O WAT 3261 99.769 5.687 123.002 1.00 0.00 O ATOM 82722 H1 WAT 3261 99.283 4.864 123.053 1.00 0.00 H ATOM 82723 H2 WAT 3261 99.857 5.971 123.911 1.00 0.00 H TER 82725 WAT 3261 ATOM 82725 O WAT 3262 112.306 55.132 152.813 1.00 0.00 O ATOM 82726 H1 WAT 3262 112.855 54.348 152.826 1.00 0.00 H ATOM 82727 H2 WAT 3262 112.334 55.430 151.904 1.00 0.00 H TER 82729 WAT 3262 ATOM 82729 O WAT 3263 121.231 76.303 146.388 1.00 0.00 O ATOM 82730 H1 WAT 3263 121.203 75.873 147.244 1.00 0.00 H ATOM 82731 H2 WAT 3263 122.121 76.649 146.323 1.00 0.00 H TER 82733 WAT 3263 ATOM 82733 O WAT 3264 99.008 105.682 114.882 1.00 0.00 O ATOM 82734 H1 WAT 3264 98.051 105.659 114.880 1.00 0.00 H ATOM 82735 H2 WAT 3264 99.262 105.020 115.525 1.00 0.00 H TER 82737 WAT 3264 ATOM 82737 O WAT 3265 109.493 96.612 84.868 1.00 0.00 O ATOM 82738 H1 WAT 3265 109.694 97.381 85.403 1.00 0.00 H ATOM 82739 H2 WAT 3265 110.211 96.004 85.045 1.00 0.00 H TER 82741 WAT 3265 ATOM 82741 O WAT 3266 65.635 14.928 144.795 1.00 0.00 O ATOM 82742 H1 WAT 3266 66.348 15.016 144.163 1.00 0.00 H ATOM 82743 H2 WAT 3266 66.025 15.180 145.632 1.00 0.00 H TER 82745 WAT 3266 ATOM 82745 O WAT 3267 43.617 76.306 91.864 1.00 0.00 O ATOM 82746 H1 WAT 3267 43.151 76.056 91.067 1.00 0.00 H ATOM 82747 H2 WAT 3267 42.946 76.707 92.417 1.00 0.00 H TER 82749 WAT 3267 ATOM 82749 O WAT 3268 134.859 89.692 5.658 1.00 0.00 O ATOM 82750 H1 WAT 3268 134.336 90.460 5.427 1.00 0.00 H ATOM 82751 H2 WAT 3268 134.537 89.000 5.080 1.00 0.00 H TER 82753 WAT 3268 ATOM 82753 O WAT 3269 76.805 114.280 80.169 1.00 0.00 O ATOM 82754 H1 WAT 3269 76.946 114.819 79.391 1.00 0.00 H ATOM 82755 H2 WAT 3269 77.552 113.682 80.185 1.00 0.00 H TER 82757 WAT 3269 ATOM 82757 O WAT 3270 50.834 82.321 7.279 1.00 0.00 O ATOM 82758 H1 WAT 3270 50.102 81.967 6.773 1.00 0.00 H ATOM 82759 H2 WAT 3270 51.557 81.718 7.108 1.00 0.00 H TER 82761 WAT 3270 ATOM 82761 O WAT 3271 54.459 23.026 154.189 1.00 0.00 O ATOM 82762 H1 WAT 3271 53.828 23.131 154.902 1.00 0.00 H ATOM 82763 H2 WAT 3271 54.939 23.854 154.170 1.00 0.00 H TER 82765 WAT 3271 ATOM 82765 O WAT 3272 102.474 116.934 122.985 1.00 0.00 O ATOM 82766 H1 WAT 3272 102.551 116.016 122.726 1.00 0.00 H ATOM 82767 H2 WAT 3272 102.223 117.390 122.182 1.00 0.00 H TER 82769 WAT 3272 ATOM 82769 O WAT 3273 40.219 136.377 119.646 1.00 0.00 O ATOM 82770 H1 WAT 3273 40.827 135.785 120.088 1.00 0.00 H ATOM 82771 H2 WAT 3273 40.240 137.177 120.170 1.00 0.00 H TER 82773 WAT 3273 ATOM 82773 O WAT 3274 7.509 67.481 8.231 1.00 0.00 O ATOM 82774 H1 WAT 3274 8.152 67.016 7.696 1.00 0.00 H ATOM 82775 H2 WAT 3274 8.028 68.102 8.743 1.00 0.00 H TER 82777 WAT 3274 ATOM 82777 O WAT 3275 25.789 1.478 12.512 1.00 0.00 O ATOM 82778 H1 WAT 3275 26.190 1.950 13.242 1.00 0.00 H ATOM 82779 H2 WAT 3275 24.889 1.319 12.797 1.00 0.00 H TER 82781 WAT 3275 ATOM 82781 O WAT 3276 9.301 100.564 54.713 1.00 0.00 O ATOM 82782 H1 WAT 3276 9.368 101.456 55.053 1.00 0.00 H ATOM 82783 H2 WAT 3276 10.100 100.443 54.199 1.00 0.00 H TER 82785 WAT 3276 ATOM 82785 O WAT 3277 140.381 79.416 84.578 1.00 0.00 O ATOM 82786 H1 WAT 3277 140.868 78.596 84.497 1.00 0.00 H ATOM 82787 H2 WAT 3277 140.388 79.787 83.696 1.00 0.00 H TER 82789 WAT 3277 ATOM 82789 O WAT 3278 46.121 42.882 125.779 1.00 0.00 O ATOM 82790 H1 WAT 3278 46.284 42.118 125.226 1.00 0.00 H ATOM 82791 H2 WAT 3278 45.838 43.563 125.170 1.00 0.00 H TER 82793 WAT 3278 ATOM 82793 O WAT 3279 36.121 40.440 107.469 1.00 0.00 O ATOM 82794 H1 WAT 3279 37.030 40.718 107.588 1.00 0.00 H ATOM 82795 H2 WAT 3279 35.992 39.756 108.125 1.00 0.00 H TER 82797 WAT 3279 ATOM 82797 O WAT 3280 27.306 47.880 112.524 1.00 0.00 O ATOM 82798 H1 WAT 3280 26.895 48.212 111.726 1.00 0.00 H ATOM 82799 H2 WAT 3280 27.899 48.581 112.797 1.00 0.00 H TER 82801 WAT 3280 ATOM 82801 O WAT 3281 25.778 27.237 8.090 1.00 0.00 O ATOM 82802 H1 WAT 3281 25.916 26.789 7.256 1.00 0.00 H ATOM 82803 H2 WAT 3281 26.219 28.080 7.984 1.00 0.00 H TER 82805 WAT 3281 ATOM 82805 O WAT 3282 70.828 9.345 130.878 1.00 0.00 O ATOM 82806 H1 WAT 3282 70.500 8.829 131.615 1.00 0.00 H ATOM 82807 H2 WAT 3282 71.778 9.353 130.994 1.00 0.00 H TER 82809 WAT 3282 ATOM 82809 O WAT 3283 127.534 4.983 154.896 1.00 0.00 O ATOM 82810 H1 WAT 3283 128.064 4.669 155.628 1.00 0.00 H ATOM 82811 H2 WAT 3283 127.898 4.541 154.129 1.00 0.00 H TER 82813 WAT 3283 ATOM 82813 O WAT 3284 87.361 7.413 13.026 1.00 0.00 O ATOM 82814 H1 WAT 3284 87.284 7.315 13.975 1.00 0.00 H ATOM 82815 H2 WAT 3284 88.196 6.997 12.809 1.00 0.00 H TER 82817 WAT 3284 ATOM 82817 O WAT 3285 55.315 96.907 57.234 1.00 0.00 O ATOM 82818 H1 WAT 3285 54.549 96.346 57.114 1.00 0.00 H ATOM 82819 H2 WAT 3285 55.923 96.374 57.746 1.00 0.00 H TER 82821 WAT 3285 ATOM 82821 O WAT 3286 58.762 39.932 85.968 1.00 0.00 O ATOM 82822 H1 WAT 3286 58.433 39.327 85.304 1.00 0.00 H ATOM 82823 H2 WAT 3286 59.711 39.802 85.961 1.00 0.00 H TER 82825 WAT 3286 ATOM 82825 O WAT 3287 29.123 56.892 144.265 1.00 0.00 O ATOM 82826 H1 WAT 3287 29.987 57.302 144.243 1.00 0.00 H ATOM 82827 H2 WAT 3287 28.582 57.442 143.697 1.00 0.00 H TER 82829 WAT 3287 ATOM 82829 O WAT 3288 15.043 52.322 53.717 1.00 0.00 O ATOM 82830 H1 WAT 3288 15.347 51.608 54.278 1.00 0.00 H ATOM 82831 H2 WAT 3288 15.837 52.812 53.503 1.00 0.00 H TER 82833 WAT 3288 ATOM 82833 O WAT 3289 71.437 63.899 104.273 1.00 0.00 O ATOM 82834 H1 WAT 3289 71.274 63.319 105.017 1.00 0.00 H ATOM 82835 H2 WAT 3289 71.571 64.761 104.666 1.00 0.00 H TER 82837 WAT 3289 ATOM 82837 O WAT 3290 107.115 80.795 130.488 1.00 0.00 O ATOM 82838 H1 WAT 3290 106.383 80.339 130.902 1.00 0.00 H ATOM 82839 H2 WAT 3290 107.812 80.774 131.145 1.00 0.00 H TER 82841 WAT 3290 ATOM 82841 O WAT 3291 77.666 76.785 1.521 1.00 0.00 O ATOM 82842 H1 WAT 3291 76.935 76.196 1.331 1.00 0.00 H ATOM 82843 H2 WAT 3291 78.281 76.250 2.021 1.00 0.00 H TER 82845 WAT 3291 ATOM 82845 O WAT 3292 75.923 33.402 74.838 1.00 0.00 O ATOM 82846 H1 WAT 3292 75.915 33.291 75.789 1.00 0.00 H ATOM 82847 H2 WAT 3292 76.419 34.208 74.696 1.00 0.00 H TER 82849 WAT 3292 ATOM 82849 O WAT 3293 56.345 16.441 95.650 1.00 0.00 O ATOM 82850 H1 WAT 3293 56.869 16.196 94.887 1.00 0.00 H ATOM 82851 H2 WAT 3293 56.973 16.833 96.256 1.00 0.00 H TER 82853 WAT 3293 ATOM 82853 O WAT 3294 46.600 47.379 20.198 1.00 0.00 O ATOM 82854 H1 WAT 3294 46.994 46.512 20.101 1.00 0.00 H ATOM 82855 H2 WAT 3294 46.802 47.827 19.377 1.00 0.00 H TER 82857 WAT 3294 ATOM 82857 O WAT 3295 68.417 61.091 24.371 1.00 0.00 O ATOM 82858 H1 WAT 3295 67.868 61.792 24.723 1.00 0.00 H ATOM 82859 H2 WAT 3295 69.246 61.177 24.842 1.00 0.00 H TER 82861 WAT 3295 ATOM 82861 O WAT 3296 89.440 22.139 66.381 1.00 0.00 O ATOM 82862 H1 WAT 3296 89.493 22.590 65.538 1.00 0.00 H ATOM 82863 H2 WAT 3296 90.075 22.590 66.936 1.00 0.00 H TER 82865 WAT 3296 ATOM 82865 O WAT 3297 6.068 35.619 8.659 1.00 0.00 O ATOM 82866 H1 WAT 3297 6.727 36.312 8.610 1.00 0.00 H ATOM 82867 H2 WAT 3297 5.487 35.788 7.918 1.00 0.00 H TER 82869 WAT 3297 ATOM 82869 O WAT 3298 41.839 111.191 0.766 1.00 0.00 O ATOM 82870 H1 WAT 3298 41.765 112.124 0.968 1.00 0.00 H ATOM 82871 H2 WAT 3298 42.767 111.061 0.572 1.00 0.00 H TER 82873 WAT 3298 ATOM 82873 O WAT 3299 38.953 31.656 110.394 1.00 0.00 O ATOM 82874 H1 WAT 3299 39.545 31.715 109.644 1.00 0.00 H ATOM 82875 H2 WAT 3299 38.378 32.416 110.305 1.00 0.00 H TER 82877 WAT 3299 ATOM 82877 O WAT 3300 12.946 95.424 106.128 1.00 0.00 O ATOM 82878 H1 WAT 3300 13.223 95.896 105.343 1.00 0.00 H ATOM 82879 H2 WAT 3300 13.434 95.837 106.841 1.00 0.00 H TER 82881 WAT 3300 ATOM 82881 O WAT 3301 17.966 57.200 89.678 1.00 0.00 O ATOM 82882 H1 WAT 3301 17.996 56.250 89.789 1.00 0.00 H ATOM 82883 H2 WAT 3301 17.176 57.470 90.146 1.00 0.00 H TER 82885 WAT 3301 ATOM 82885 O WAT 3302 120.818 137.046 144.261 1.00 0.00 O ATOM 82886 H1 WAT 3302 121.229 137.879 144.030 1.00 0.00 H ATOM 82887 H2 WAT 3302 119.878 137.223 144.224 1.00 0.00 H TER 82889 WAT 3302 ATOM 82889 O WAT 3303 93.464 118.580 79.268 1.00 0.00 O ATOM 82890 H1 WAT 3303 94.223 118.137 79.647 1.00 0.00 H ATOM 82891 H2 WAT 3303 92.715 118.220 79.741 1.00 0.00 H TER 82893 WAT 3303 ATOM 82893 O WAT 3304 45.777 126.064 128.175 1.00 0.00 O ATOM 82894 H1 WAT 3304 45.145 126.601 127.698 1.00 0.00 H ATOM 82895 H2 WAT 3304 45.446 125.170 128.088 1.00 0.00 H TER 82897 WAT 3304 ATOM 82897 O WAT 3305 110.799 130.548 1.055 1.00 0.00 O ATOM 82898 H1 WAT 3305 110.348 131.302 1.434 1.00 0.00 H ATOM 82899 H2 WAT 3305 111.018 130.822 0.165 1.00 0.00 H TER 82901 WAT 3305 ATOM 82901 O WAT 3306 136.905 140.903 126.466 1.00 0.00 O ATOM 82902 H1 WAT 3306 137.158 140.083 126.042 1.00 0.00 H ATOM 82903 H2 WAT 3306 136.662 140.648 127.356 1.00 0.00 H TER 82905 WAT 3306 ATOM 82905 O WAT 3307 81.395 46.173 96.795 1.00 0.00 O ATOM 82906 H1 WAT 3307 81.342 46.352 97.734 1.00 0.00 H ATOM 82907 H2 WAT 3307 82.180 46.640 96.507 1.00 0.00 H TER 82909 WAT 3307 ATOM 82909 O WAT 3308 129.608 93.184 116.719 1.00 0.00 O ATOM 82910 H1 WAT 3308 130.449 93.068 117.161 1.00 0.00 H ATOM 82911 H2 WAT 3308 129.106 92.402 116.950 1.00 0.00 H TER 82913 WAT 3308 ATOM 82913 O WAT 3309 125.479 119.298 99.478 1.00 0.00 O ATOM 82914 H1 WAT 3309 126.047 120.013 99.189 1.00 0.00 H ATOM 82915 H2 WAT 3309 124.822 119.219 98.787 1.00 0.00 H TER 82917 WAT 3309 ATOM 82917 O WAT 3310 138.084 11.663 96.764 1.00 0.00 O ATOM 82918 H1 WAT 3310 137.234 11.270 96.565 1.00 0.00 H ATOM 82919 H2 WAT 3310 138.151 11.618 97.718 1.00 0.00 H TER 82921 WAT 3310 ATOM 82921 O WAT 3311 112.506 117.476 71.485 1.00 0.00 O ATOM 82922 H1 WAT 3311 112.557 118.237 70.908 1.00 0.00 H ATOM 82923 H2 WAT 3311 111.569 117.361 71.647 1.00 0.00 H TER 82925 WAT 3311 ATOM 82925 O WAT 3312 59.075 98.859 19.103 1.00 0.00 O ATOM 82926 H1 WAT 3312 58.438 99.375 19.598 1.00 0.00 H ATOM 82927 H2 WAT 3312 59.924 99.228 19.347 1.00 0.00 H TER 82929 WAT 3312 ATOM 82929 O WAT 3313 129.110 5.651 148.768 1.00 0.00 O ATOM 82930 H1 WAT 3313 129.442 5.162 148.015 1.00 0.00 H ATOM 82931 H2 WAT 3313 128.795 6.475 148.399 1.00 0.00 H TER 82933 WAT 3313 ATOM 82933 O WAT 3314 141.567 46.051 150.727 1.00 0.00 O ATOM 82934 H1 WAT 3314 141.862 45.632 151.535 1.00 0.00 H ATOM 82935 H2 WAT 3314 140.789 46.545 150.984 1.00 0.00 H TER 82937 WAT 3314 ATOM 82937 O WAT 3315 49.058 22.462 152.178 1.00 0.00 O ATOM 82938 H1 WAT 3315 49.377 21.564 152.264 1.00 0.00 H ATOM 82939 H2 WAT 3315 49.488 22.939 152.888 1.00 0.00 H TER 82941 WAT 3315 ATOM 82941 O WAT 3316 82.761 46.179 9.470 1.00 0.00 O ATOM 82942 H1 WAT 3316 83.426 45.672 9.005 1.00 0.00 H ATOM 82943 H2 WAT 3316 81.932 45.769 9.224 1.00 0.00 H TER 82945 WAT 3316 ATOM 82945 O WAT 3317 20.044 52.498 4.115 1.00 0.00 O ATOM 82946 H1 WAT 3317 19.669 53.334 3.837 1.00 0.00 H ATOM 82947 H2 WAT 3317 20.983 52.593 3.958 1.00 0.00 H TER 82949 WAT 3317 ATOM 82949 O WAT 3318 38.398 91.930 80.465 1.00 0.00 O ATOM 82950 H1 WAT 3318 37.748 92.615 80.618 1.00 0.00 H ATOM 82951 H2 WAT 3318 37.933 91.113 80.650 1.00 0.00 H TER 82953 WAT 3318 ATOM 82953 O WAT 3319 17.993 142.171 103.958 1.00 0.00 O ATOM 82954 H1 WAT 3319 18.905 141.881 103.968 1.00 0.00 H ATOM 82955 H2 WAT 3319 17.549 141.545 103.385 1.00 0.00 H TER 82957 WAT 3319 ATOM 82957 O WAT 3320 74.014 32.965 14.884 1.00 0.00 O ATOM 82958 H1 WAT 3320 74.345 33.452 14.130 1.00 0.00 H ATOM 82959 H2 WAT 3320 74.676 32.294 15.046 1.00 0.00 H TER 82961 WAT 3320 ATOM 82961 O WAT 3321 128.479 47.395 64.727 1.00 0.00 O ATOM 82962 H1 WAT 3321 127.967 47.457 65.534 1.00 0.00 H ATOM 82963 H2 WAT 3321 127.888 46.980 64.100 1.00 0.00 H TER 82965 WAT 3321 ATOM 82965 O WAT 3322 72.106 141.273 146.649 1.00 0.00 O ATOM 82966 H1 WAT 3322 72.132 140.398 147.036 1.00 0.00 H ATOM 82967 H2 WAT 3322 71.521 141.185 145.896 1.00 0.00 H TER 82969 WAT 3322 ATOM 82969 O WAT 3323 32.097 139.664 67.983 1.00 0.00 O ATOM 82970 H1 WAT 3323 31.721 140.195 67.281 1.00 0.00 H ATOM 82971 H2 WAT 3323 32.013 140.208 68.766 1.00 0.00 H TER 82973 WAT 3323 ATOM 82973 O WAT 3324 114.465 65.634 67.833 1.00 0.00 O ATOM 82974 H1 WAT 3324 114.483 64.783 67.394 1.00 0.00 H ATOM 82975 H2 WAT 3324 115.278 66.060 67.562 1.00 0.00 H TER 82977 WAT 3324 ATOM 82977 O WAT 3325 40.031 71.183 11.940 1.00 0.00 O ATOM 82978 H1 WAT 3325 40.877 71.512 12.245 1.00 0.00 H ATOM 82979 H2 WAT 3325 39.654 70.748 12.704 1.00 0.00 H TER 82981 WAT 3325 ATOM 82981 O WAT 3326 7.041 94.247 18.420 1.00 0.00 O ATOM 82982 H1 WAT 3326 6.877 94.135 17.484 1.00 0.00 H ATOM 82983 H2 WAT 3326 7.436 93.419 18.695 1.00 0.00 H TER 82985 WAT 3326 ATOM 82985 O WAT 3327 100.084 8.323 89.986 1.00 0.00 O ATOM 82986 H1 WAT 3327 100.546 9.028 90.439 1.00 0.00 H ATOM 82987 H2 WAT 3327 100.777 7.810 89.571 1.00 0.00 H TER 82989 WAT 3327 ATOM 82989 O WAT 3328 66.141 45.060 74.985 1.00 0.00 O ATOM 82990 H1 WAT 3328 66.298 44.649 74.135 1.00 0.00 H ATOM 82991 H2 WAT 3328 66.983 45.006 75.437 1.00 0.00 H TER 82993 WAT 3328 ATOM 82993 O WAT 3329 137.029 120.417 100.593 1.00 0.00 O ATOM 82994 H1 WAT 3329 137.569 120.933 99.995 1.00 0.00 H ATOM 82995 H2 WAT 3329 136.912 120.982 101.357 1.00 0.00 H TER 82997 WAT 3329 ATOM 82997 O WAT 3330 116.964 67.041 107.239 1.00 0.00 O ATOM 82998 H1 WAT 3330 117.008 66.798 106.314 1.00 0.00 H ATOM 82999 H2 WAT 3330 116.215 66.552 107.579 1.00 0.00 H TER 83001 WAT 3330 ATOM 83001 O WAT 3331 67.370 96.175 95.969 1.00 0.00 O ATOM 83002 H1 WAT 3331 67.565 95.412 95.425 1.00 0.00 H ATOM 83003 H2 WAT 3331 68.222 96.585 96.120 1.00 0.00 H TER 83005 WAT 3331 ATOM 83005 O WAT 3332 141.263 94.865 62.818 1.00 0.00 O ATOM 83006 H1 WAT 3332 141.081 94.101 63.365 1.00 0.00 H ATOM 83007 H2 WAT 3332 140.671 95.542 63.146 1.00 0.00 H TER 83009 WAT 3332 ATOM 83009 O WAT 3333 79.570 99.203 90.004 1.00 0.00 O ATOM 83010 H1 WAT 3333 80.222 98.649 89.575 1.00 0.00 H ATOM 83011 H2 WAT 3333 78.735 98.923 89.631 1.00 0.00 H TER 83013 WAT 3333 ATOM 83013 O WAT 3334 79.822 108.909 78.084 1.00 0.00 O ATOM 83014 H1 WAT 3334 79.346 109.225 78.852 1.00 0.00 H ATOM 83015 H2 WAT 3334 79.850 107.959 78.194 1.00 0.00 H TER 83017 WAT 3334 ATOM 83017 O WAT 3335 63.879 5.709 63.775 1.00 0.00 O ATOM 83018 H1 WAT 3335 63.686 6.224 62.992 1.00 0.00 H ATOM 83019 H2 WAT 3335 64.779 5.409 63.648 1.00 0.00 H TER 83021 WAT 3335 ATOM 83021 O WAT 3336 113.939 109.218 124.750 1.00 0.00 O ATOM 83022 H1 WAT 3336 113.489 108.400 124.541 1.00 0.00 H ATOM 83023 H2 WAT 3336 113.238 109.865 124.827 1.00 0.00 H TER 83025 WAT 3336 ATOM 83025 O WAT 3337 0.570 38.081 147.326 1.00 0.00 O ATOM 83026 H1 WAT 3337 0.907 38.971 147.435 1.00 0.00 H ATOM 83027 H2 WAT 3337 -0.080 38.155 146.627 1.00 0.00 H TER 83029 WAT 3337 ATOM 83029 O WAT 3338 49.612 49.816 77.157 1.00 0.00 O ATOM 83030 H1 WAT 3338 50.496 49.452 77.133 1.00 0.00 H ATOM 83031 H2 WAT 3338 49.400 49.992 76.240 1.00 0.00 H TER 83033 WAT 3338 ATOM 83033 O WAT 3339 43.337 130.948 101.316 1.00 0.00 O ATOM 83034 H1 WAT 3339 42.550 131.203 101.799 1.00 0.00 H ATOM 83035 H2 WAT 3339 43.447 131.635 100.659 1.00 0.00 H TER 83037 WAT 3339 ATOM 83037 O WAT 3340 19.056 13.526 81.484 1.00 0.00 O ATOM 83038 H1 WAT 3340 19.351 14.432 81.391 1.00 0.00 H ATOM 83039 H2 WAT 3340 19.580 13.177 82.206 1.00 0.00 H TER 83041 WAT 3340 ATOM 83041 O WAT 3341 144.360 38.923 10.777 1.00 0.00 O ATOM 83042 H1 WAT 3341 144.534 39.820 11.061 1.00 0.00 H ATOM 83043 H2 WAT 3341 144.955 38.786 10.039 1.00 0.00 H TER 83045 WAT 3341 ATOM 83045 O WAT 3342 57.091 61.286 25.610 1.00 0.00 O ATOM 83046 H1 WAT 3342 56.298 61.468 26.114 1.00 0.00 H ATOM 83047 H2 WAT 3342 57.525 62.136 25.531 1.00 0.00 H TER 83049 WAT 3342 ATOM 83049 O WAT 3343 49.532 5.552 16.928 1.00 0.00 O ATOM 83050 H1 WAT 3343 49.564 4.616 16.735 1.00 0.00 H ATOM 83051 H2 WAT 3343 49.357 5.597 17.868 1.00 0.00 H TER 83053 WAT 3343 ATOM 83053 O WAT 3344 96.007 88.939 133.620 1.00 0.00 O ATOM 83054 H1 WAT 3344 95.826 89.735 133.120 1.00 0.00 H ATOM 83055 H2 WAT 3344 95.803 88.225 133.015 1.00 0.00 H TER 83057 WAT 3344 ATOM 83057 O WAT 3345 65.693 140.014 102.147 1.00 0.00 O ATOM 83058 H1 WAT 3345 65.497 140.942 102.019 1.00 0.00 H ATOM 83059 H2 WAT 3345 66.556 140.006 102.561 1.00 0.00 H TER 83061 WAT 3345 ATOM 83061 O WAT 3346 6.937 105.825 112.253 1.00 0.00 O ATOM 83062 H1 WAT 3346 7.361 106.592 112.639 1.00 0.00 H ATOM 83063 H2 WAT 3346 6.363 105.496 112.945 1.00 0.00 H TER 83065 WAT 3346 ATOM 83065 O WAT 3347 47.117 27.445 0.376 1.00 0.00 O ATOM 83066 H1 WAT 3347 46.302 26.959 0.250 1.00 0.00 H ATOM 83067 H2 WAT 3347 47.639 26.891 0.957 1.00 0.00 H TER 83069 WAT 3347 ATOM 83069 O WAT 3348 41.839 120.770 5.217 1.00 0.00 O ATOM 83070 H1 WAT 3348 41.918 121.382 5.949 1.00 0.00 H ATOM 83071 H2 WAT 3348 42.742 120.541 4.997 1.00 0.00 H TER 83073 WAT 3348 ATOM 83073 O WAT 3349 118.672 80.980 110.797 1.00 0.00 O ATOM 83074 H1 WAT 3349 119.335 81.103 111.477 1.00 0.00 H ATOM 83075 H2 WAT 3349 118.818 80.090 110.478 1.00 0.00 H TER 83077 WAT 3349 ATOM 83077 O WAT 3350 108.171 52.663 123.203 1.00 0.00 O ATOM 83078 H1 WAT 3350 107.452 52.827 123.813 1.00 0.00 H ATOM 83079 H2 WAT 3350 107.748 52.295 122.427 1.00 0.00 H TER 83081 WAT 3350 ATOM 83081 O WAT 3351 142.062 44.301 105.640 1.00 0.00 O ATOM 83082 H1 WAT 3351 141.885 44.040 106.544 1.00 0.00 H ATOM 83083 H2 WAT 3351 141.197 44.471 105.266 1.00 0.00 H TER 83085 WAT 3351 ATOM 83085 O WAT 3352 105.313 17.699 135.942 1.00 0.00 O ATOM 83086 H1 WAT 3352 105.815 18.421 136.320 1.00 0.00 H ATOM 83087 H2 WAT 3352 105.505 17.739 135.005 1.00 0.00 H TER 83089 WAT 3352 ATOM 83089 O WAT 3353 33.512 67.425 143.765 1.00 0.00 O ATOM 83090 H1 WAT 3353 33.035 67.382 142.937 1.00 0.00 H ATOM 83091 H2 WAT 3353 33.263 68.269 144.142 1.00 0.00 H TER 83093 WAT 3353 ATOM 83093 O WAT 3354 125.543 137.467 62.567 1.00 0.00 O ATOM 83094 H1 WAT 3354 125.492 138.390 62.319 1.00 0.00 H ATOM 83095 H2 WAT 3354 125.704 137.006 61.744 1.00 0.00 H TER 83097 WAT 3354 ATOM 83097 O WAT 3355 91.975 111.923 115.782 1.00 0.00 O ATOM 83098 H1 WAT 3355 91.336 112.288 115.170 1.00 0.00 H ATOM 83099 H2 WAT 3355 91.673 111.028 115.938 1.00 0.00 H TER 83101 WAT 3355 ATOM 83101 O WAT 3356 119.479 92.290 147.902 1.00 0.00 O ATOM 83102 H1 WAT 3356 118.726 91.742 148.126 1.00 0.00 H ATOM 83103 H2 WAT 3356 119.637 92.111 146.975 1.00 0.00 H TER 83105 WAT 3356 ATOM 83105 O WAT 3357 122.327 75.965 127.482 1.00 0.00 O ATOM 83106 H1 WAT 3357 121.920 76.309 126.687 1.00 0.00 H ATOM 83107 H2 WAT 3357 122.758 75.158 127.201 1.00 0.00 H TER 83109 WAT 3357 ATOM 83109 O WAT 3358 140.588 55.784 118.515 1.00 0.00 O ATOM 83110 H1 WAT 3358 139.727 56.009 118.868 1.00 0.00 H ATOM 83111 H2 WAT 3358 140.861 56.565 118.034 1.00 0.00 H TER 83113 WAT 3358 ATOM 83113 O WAT 3359 80.486 74.749 93.769 1.00 0.00 O ATOM 83114 H1 WAT 3359 80.696 74.052 94.390 1.00 0.00 H ATOM 83115 H2 WAT 3359 80.830 75.545 94.175 1.00 0.00 H TER 83117 WAT 3359 ATOM 83117 O WAT 3360 52.680 81.143 139.767 1.00 0.00 O ATOM 83118 H1 WAT 3360 52.118 81.482 139.070 1.00 0.00 H ATOM 83119 H2 WAT 3360 53.410 80.729 139.306 1.00 0.00 H TER 83121 WAT 3360 ATOM 83121 O WAT 3361 47.870 96.722 129.125 1.00 0.00 O ATOM 83122 H1 WAT 3361 47.500 97.372 129.722 1.00 0.00 H ATOM 83123 H2 WAT 3361 48.637 96.382 129.586 1.00 0.00 H TER 83125 WAT 3361 ATOM 83125 O WAT 3362 142.736 35.308 123.744 1.00 0.00 O ATOM 83126 H1 WAT 3362 142.575 36.114 124.235 1.00 0.00 H ATOM 83127 H2 WAT 3362 142.107 34.681 124.101 1.00 0.00 H TER 83129 WAT 3362 ATOM 83129 O WAT 3363 39.315 35.903 15.940 1.00 0.00 O ATOM 83130 H1 WAT 3363 38.729 35.789 16.688 1.00 0.00 H ATOM 83131 H2 WAT 3363 39.000 35.272 15.292 1.00 0.00 H TER 83133 WAT 3363 ATOM 83133 O WAT 3364 91.315 98.632 91.426 1.00 0.00 O ATOM 83134 H1 WAT 3364 91.189 98.193 92.267 1.00 0.00 H ATOM 83135 H2 WAT 3364 92.076 99.197 91.561 1.00 0.00 H TER 83137 WAT 3364 ATOM 83137 O WAT 3365 66.374 51.681 139.636 1.00 0.00 O ATOM 83138 H1 WAT 3365 65.713 52.369 139.566 1.00 0.00 H ATOM 83139 H2 WAT 3365 67.143 52.041 139.193 1.00 0.00 H TER 83141 WAT 3365 ATOM 83141 O WAT 3366 28.832 5.958 139.436 1.00 0.00 O ATOM 83142 H1 WAT 3366 29.033 6.306 140.304 1.00 0.00 H ATOM 83143 H2 WAT 3366 29.495 6.345 138.864 1.00 0.00 H TER 83145 WAT 3366 ATOM 83145 O WAT 3367 2.006 54.460 10.286 1.00 0.00 O ATOM 83146 H1 WAT 3367 1.980 54.771 9.381 1.00 0.00 H ATOM 83147 H2 WAT 3367 1.239 54.857 10.698 1.00 0.00 H TER 83149 WAT 3367 ATOM 83149 O WAT 3368 38.500 66.573 6.235 1.00 0.00 O ATOM 83150 H1 WAT 3368 37.958 65.874 5.870 1.00 0.00 H ATOM 83151 H2 WAT 3368 38.097 66.774 7.079 1.00 0.00 H TER 83153 WAT 3368 ATOM 83153 O WAT 3369 114.667 60.881 155.429 1.00 0.00 O ATOM 83154 H1 WAT 3369 115.615 60.751 155.441 1.00 0.00 H ATOM 83155 H2 WAT 3369 114.375 60.597 156.295 1.00 0.00 H TER 83157 WAT 3369 ATOM 83157 O WAT 3370 125.386 37.189 9.642 1.00 0.00 O ATOM 83158 H1 WAT 3370 125.142 38.113 9.578 1.00 0.00 H ATOM 83159 H2 WAT 3370 124.763 36.737 9.072 1.00 0.00 H TER 83161 WAT 3370 ATOM 83161 O WAT 3371 114.426 17.260 92.515 1.00 0.00 O ATOM 83162 H1 WAT 3371 113.525 16.949 92.601 1.00 0.00 H ATOM 83163 H2 WAT 3371 114.512 17.493 91.591 1.00 0.00 H TER 83165 WAT 3371 ATOM 83165 O WAT 3372 143.027 21.408 80.956 1.00 0.00 O ATOM 83166 H1 WAT 3372 143.118 21.351 80.005 1.00 0.00 H ATOM 83167 H2 WAT 3372 143.262 20.535 81.271 1.00 0.00 H TER 83169 WAT 3372 ATOM 83169 O WAT 3373 56.912 11.649 71.144 1.00 0.00 O ATOM 83170 H1 WAT 3373 57.580 12.142 70.667 1.00 0.00 H ATOM 83171 H2 WAT 3373 57.407 11.028 71.677 1.00 0.00 H TER 83173 WAT 3373 ATOM 83173 O WAT 3374 19.950 130.676 11.492 1.00 0.00 O ATOM 83174 H1 WAT 3374 19.717 131.087 12.325 1.00 0.00 H ATOM 83175 H2 WAT 3374 19.220 130.885 10.909 1.00 0.00 H TER 83177 WAT 3374 ATOM 83177 O WAT 3375 2.017 88.840 18.872 1.00 0.00 O ATOM 83178 H1 WAT 3375 2.708 89.502 18.845 1.00 0.00 H ATOM 83179 H2 WAT 3375 1.297 89.226 18.373 1.00 0.00 H TER 83181 WAT 3375 ATOM 83181 O WAT 3376 72.104 132.377 135.647 1.00 0.00 O ATOM 83182 H1 WAT 3376 72.087 131.953 134.789 1.00 0.00 H ATOM 83183 H2 WAT 3376 71.556 133.155 135.542 1.00 0.00 H TER 83185 WAT 3376 ATOM 83185 O WAT 3377 66.441 11.708 101.999 1.00 0.00 O ATOM 83186 H1 WAT 3377 66.683 10.797 102.164 1.00 0.00 H ATOM 83187 H2 WAT 3377 65.489 11.689 101.901 1.00 0.00 H TER 83189 WAT 3377 ATOM 83189 O WAT 3378 28.160 91.884 138.789 1.00 0.00 O ATOM 83190 H1 WAT 3378 28.596 91.387 138.097 1.00 0.00 H ATOM 83191 H2 WAT 3378 27.357 91.395 138.967 1.00 0.00 H TER 83193 WAT 3378 ATOM 83193 O WAT 3379 128.477 4.230 138.663 1.00 0.00 O ATOM 83194 H1 WAT 3379 128.266 3.384 139.058 1.00 0.00 H ATOM 83195 H2 WAT 3379 127.910 4.283 137.894 1.00 0.00 H TER 83197 WAT 3379 ATOM 83197 O WAT 3380 137.506 88.220 94.273 1.00 0.00 O ATOM 83198 H1 WAT 3380 137.340 88.449 93.359 1.00 0.00 H ATOM 83199 H2 WAT 3380 136.782 87.640 94.510 1.00 0.00 H TER 83201 WAT 3380 ATOM 83201 O WAT 3381 36.953 95.905 150.460 1.00 0.00 O ATOM 83202 H1 WAT 3381 37.567 95.187 150.303 1.00 0.00 H ATOM 83203 H2 WAT 3381 37.445 96.694 150.237 1.00 0.00 H TER 83205 WAT 3381 ATOM 83205 O WAT 3382 62.418 84.623 81.981 1.00 0.00 O ATOM 83206 H1 WAT 3382 63.153 84.342 82.527 1.00 0.00 H ATOM 83207 H2 WAT 3382 61.952 85.264 82.518 1.00 0.00 H TER 83209 WAT 3382 ATOM 83209 O WAT 3383 30.623 93.856 55.925 1.00 0.00 O ATOM 83210 H1 WAT 3383 30.620 93.777 56.879 1.00 0.00 H ATOM 83211 H2 WAT 3383 31.138 94.644 55.751 1.00 0.00 H TER 83213 WAT 3383 ATOM 83213 O WAT 3384 103.685 28.056 4.123 1.00 0.00 O ATOM 83214 H1 WAT 3384 103.083 27.320 4.231 1.00 0.00 H ATOM 83215 H2 WAT 3384 103.733 28.456 4.991 1.00 0.00 H TER 83217 WAT 3384 ATOM 83217 O WAT 3385 136.295 119.662 122.380 1.00 0.00 O ATOM 83218 H1 WAT 3385 136.388 120.596 122.568 1.00 0.00 H ATOM 83219 H2 WAT 3385 136.386 119.598 121.429 1.00 0.00 H TER 83221 WAT 3385 ATOM 83221 O WAT 3386 59.576 141.128 50.586 1.00 0.00 O ATOM 83222 H1 WAT 3386 60.242 141.711 50.949 1.00 0.00 H ATOM 83223 H2 WAT 3386 58.943 141.016 51.296 1.00 0.00 H TER 83225 WAT 3386 ATOM 83225 O WAT 3387 93.986 96.707 139.473 1.00 0.00 O ATOM 83226 H1 WAT 3387 93.392 97.170 140.063 1.00 0.00 H ATOM 83227 H2 WAT 3387 93.483 96.594 138.667 1.00 0.00 H TER 83229 WAT 3387 ATOM 83229 O WAT 3388 124.592 61.009 114.205 1.00 0.00 O ATOM 83230 H1 WAT 3388 125.085 60.554 114.888 1.00 0.00 H ATOM 83231 H2 WAT 3388 125.195 61.051 113.462 1.00 0.00 H TER 83233 WAT 3388 ATOM 83233 O WAT 3389 15.887 133.103 155.571 1.00 0.00 O ATOM 83234 H1 WAT 3389 16.007 133.697 154.830 1.00 0.00 H ATOM 83235 H2 WAT 3389 16.483 133.435 156.242 1.00 0.00 H TER 83237 WAT 3389 ATOM 83237 O WAT 3390 32.117 49.109 16.229 1.00 0.00 O ATOM 83238 H1 WAT 3390 32.829 49.471 15.702 1.00 0.00 H ATOM 83239 H2 WAT 3390 32.435 48.250 16.505 1.00 0.00 H TER 83241 WAT 3390 ATOM 83241 O WAT 3391 46.186 84.363 3.079 1.00 0.00 O ATOM 83242 H1 WAT 3391 46.897 84.810 3.538 1.00 0.00 H ATOM 83243 H2 WAT 3391 46.078 84.856 2.266 1.00 0.00 H TER 83245 WAT 3391 ATOM 83245 O WAT 3392 132.670 77.517 63.774 1.00 0.00 O ATOM 83246 H1 WAT 3392 132.467 76.787 64.359 1.00 0.00 H ATOM 83247 H2 WAT 3392 131.847 77.998 63.697 1.00 0.00 H TER 83249 WAT 3392 ATOM 83249 O WAT 3393 93.777 22.113 153.330 1.00 0.00 O ATOM 83250 H1 WAT 3393 93.629 22.792 153.988 1.00 0.00 H ATOM 83251 H2 WAT 3393 93.303 21.350 153.661 1.00 0.00 H TER 83253 WAT 3393 ATOM 83253 O WAT 3394 55.723 97.587 109.683 1.00 0.00 O ATOM 83254 H1 WAT 3394 54.827 97.427 109.981 1.00 0.00 H ATOM 83255 H2 WAT 3394 55.710 98.487 109.357 1.00 0.00 H TER 83257 WAT 3394 ATOM 83257 O WAT 3395 87.845 102.882 110.821 1.00 0.00 O ATOM 83258 H1 WAT 3395 88.172 101.989 110.715 1.00 0.00 H ATOM 83259 H2 WAT 3395 88.540 103.337 111.296 1.00 0.00 H TER 83261 WAT 3395 ATOM 83261 O WAT 3396 96.743 138.033 58.989 1.00 0.00 O ATOM 83262 H1 WAT 3396 96.353 138.024 58.114 1.00 0.00 H ATOM 83263 H2 WAT 3396 96.072 138.428 59.546 1.00 0.00 H TER 83265 WAT 3396 ATOM 83265 O WAT 3397 100.963 15.376 121.524 1.00 0.00 O ATOM 83266 H1 WAT 3397 100.295 15.573 122.182 1.00 0.00 H ATOM 83267 H2 WAT 3397 101.420 16.207 121.392 1.00 0.00 H TER 83269 WAT 3397 ATOM 83269 O WAT 3398 122.128 31.419 62.481 1.00 0.00 O ATOM 83270 H1 WAT 3398 121.229 31.359 62.806 1.00 0.00 H ATOM 83271 H2 WAT 3398 122.325 32.355 62.492 1.00 0.00 H TER 83273 WAT 3398 ATOM 83273 O WAT 3399 4.605 100.440 13.505 1.00 0.00 O ATOM 83274 H1 WAT 3399 5.400 99.940 13.687 1.00 0.00 H ATOM 83275 H2 WAT 3399 4.841 101.346 13.703 1.00 0.00 H TER 83277 WAT 3399 ATOM 83277 O WAT 3400 78.706 75.731 91.776 1.00 0.00 O ATOM 83278 H1 WAT 3400 78.318 76.573 92.012 1.00 0.00 H ATOM 83279 H2 WAT 3400 79.325 75.547 92.482 1.00 0.00 H TER 83281 WAT 3400 ATOM 83281 O WAT 3401 13.071 115.602 115.664 1.00 0.00 O ATOM 83282 H1 WAT 3401 13.975 115.406 115.910 1.00 0.00 H ATOM 83283 H2 WAT 3401 12.575 115.500 116.477 1.00 0.00 H TER 83285 WAT 3401 ATOM 83285 O WAT 3402 129.574 136.396 69.275 1.00 0.00 O ATOM 83286 H1 WAT 3402 129.934 137.166 68.836 1.00 0.00 H ATOM 83287 H2 WAT 3402 128.931 136.047 68.657 1.00 0.00 H TER 83289 WAT 3402 ATOM 83289 O WAT 3403 32.112 9.623 146.352 1.00 0.00 O ATOM 83290 H1 WAT 3403 31.481 9.381 145.674 1.00 0.00 H ATOM 83291 H2 WAT 3403 32.768 8.927 146.328 1.00 0.00 H TER 83293 WAT 3403 ATOM 83293 O WAT 3404 136.240 68.569 124.235 1.00 0.00 O ATOM 83294 H1 WAT 3404 136.180 69.522 124.301 1.00 0.00 H ATOM 83295 H2 WAT 3404 136.589 68.411 123.357 1.00 0.00 H TER 83297 WAT 3404 ATOM 83297 O WAT 3405 99.134 93.084 112.442 1.00 0.00 O ATOM 83298 H1 WAT 3405 98.840 92.532 113.167 1.00 0.00 H ATOM 83299 H2 WAT 3405 99.456 92.466 111.786 1.00 0.00 H TER 83301 WAT 3405 ATOM 83301 O WAT 3406 84.187 116.467 106.251 1.00 0.00 O ATOM 83302 H1 WAT 3406 83.460 117.077 106.370 1.00 0.00 H ATOM 83303 H2 WAT 3406 83.853 115.630 106.576 1.00 0.00 H TER 83305 WAT 3406 ATOM 83305 O WAT 3407 24.839 86.194 150.771 1.00 0.00 O ATOM 83306 H1 WAT 3407 24.726 86.926 151.377 1.00 0.00 H ATOM 83307 H2 WAT 3407 25.620 86.419 150.266 1.00 0.00 H TER 83309 WAT 3407 ATOM 83309 O WAT 3408 125.255 117.245 60.673 1.00 0.00 O ATOM 83310 H1 WAT 3408 125.820 117.995 60.486 1.00 0.00 H ATOM 83311 H2 WAT 3408 124.552 117.604 61.214 1.00 0.00 H TER 83313 WAT 3408 ATOM 83313 O WAT 3409 25.419 57.967 19.805 1.00 0.00 O ATOM 83314 H1 WAT 3409 25.415 57.016 19.697 1.00 0.00 H ATOM 83315 H2 WAT 3409 24.502 58.223 19.707 1.00 0.00 H TER 83317 WAT 3409 ATOM 83317 O WAT 3410 9.770 119.370 80.056 1.00 0.00 O ATOM 83318 H1 WAT 3410 8.918 119.686 80.354 1.00 0.00 H ATOM 83319 H2 WAT 3410 10.209 120.150 79.716 1.00 0.00 H TER 83321 WAT 3410 ATOM 83321 O WAT 3411 141.941 78.564 156.757 1.00 0.00 O ATOM 83322 H1 WAT 3411 141.036 78.447 157.045 1.00 0.00 H ATOM 83323 H2 WAT 3411 141.882 78.631 155.804 1.00 0.00 H TER 83325 WAT 3411 ATOM 83325 O WAT 3412 76.723 116.545 4.659 1.00 0.00 O ATOM 83326 H1 WAT 3412 76.143 115.939 5.119 1.00 0.00 H ATOM 83327 H2 WAT 3412 76.940 117.210 5.313 1.00 0.00 H TER 83329 WAT 3412 ATOM 83329 O WAT 3413 85.201 78.470 89.419 1.00 0.00 O ATOM 83330 H1 WAT 3413 86.130 78.701 89.426 1.00 0.00 H ATOM 83331 H2 WAT 3413 84.820 79.028 88.741 1.00 0.00 H TER 83333 WAT 3413 ATOM 83333 O WAT 3414 42.170 41.231 139.061 1.00 0.00 O ATOM 83334 H1 WAT 3414 42.381 41.757 139.832 1.00 0.00 H ATOM 83335 H2 WAT 3414 41.219 41.305 138.974 1.00 0.00 H TER 83337 WAT 3414 ATOM 83337 O WAT 3415 98.338 12.105 1.203 1.00 0.00 O ATOM 83338 H1 WAT 3415 97.514 12.590 1.263 1.00 0.00 H ATOM 83339 H2 WAT 3415 98.075 11.185 1.205 1.00 0.00 H TER 83341 WAT 3415 ATOM 83341 O WAT 3416 49.399 57.122 18.597 1.00 0.00 O ATOM 83342 H1 WAT 3416 49.475 58.064 18.444 1.00 0.00 H ATOM 83343 H2 WAT 3416 49.788 56.987 19.461 1.00 0.00 H TER 83345 WAT 3416 ATOM 83345 O WAT 3417 15.185 141.362 72.480 1.00 0.00 O ATOM 83346 H1 WAT 3417 15.323 141.808 73.315 1.00 0.00 H ATOM 83347 H2 WAT 3417 14.454 141.830 72.077 1.00 0.00 H TER 83349 WAT 3417 ATOM 83349 O WAT 3418 116.018 69.350 9.117 1.00 0.00 O ATOM 83350 H1 WAT 3418 115.669 70.162 8.749 1.00 0.00 H ATOM 83351 H2 WAT 3418 116.965 69.486 9.144 1.00 0.00 H TER 83353 WAT 3418 ATOM 83353 O WAT 3419 114.418 97.669 133.906 1.00 0.00 O ATOM 83354 H1 WAT 3419 114.318 98.466 134.427 1.00 0.00 H ATOM 83355 H2 WAT 3419 114.169 97.930 133.019 1.00 0.00 H TER 83357 WAT 3419 ATOM 83357 O WAT 3420 17.879 75.393 81.060 1.00 0.00 O ATOM 83358 H1 WAT 3420 18.165 75.551 80.160 1.00 0.00 H ATOM 83359 H2 WAT 3420 17.367 76.169 81.288 1.00 0.00 H TER 83361 WAT 3420 ATOM 83361 O WAT 3421 137.201 41.544 7.811 1.00 0.00 O ATOM 83362 H1 WAT 3421 137.139 42.409 7.405 1.00 0.00 H ATOM 83363 H2 WAT 3421 136.637 40.987 7.276 1.00 0.00 H TER 83365 WAT 3421 ATOM 83365 O WAT 3422 136.221 134.307 126.718 1.00 0.00 O ATOM 83366 H1 WAT 3422 135.700 133.603 127.105 1.00 0.00 H ATOM 83367 H2 WAT 3422 137.112 134.143 127.027 1.00 0.00 H TER 83369 WAT 3422 ATOM 83369 O WAT 3423 34.412 78.355 134.039 1.00 0.00 O ATOM 83370 H1 WAT 3423 35.084 78.440 134.716 1.00 0.00 H ATOM 83371 H2 WAT 3423 34.882 78.020 133.275 1.00 0.00 H TER 83373 WAT 3423 ATOM 83373 O WAT 3424 108.118 17.056 82.680 1.00 0.00 O ATOM 83374 H1 WAT 3424 107.190 16.912 82.864 1.00 0.00 H ATOM 83375 H2 WAT 3424 108.300 17.927 83.032 1.00 0.00 H TER 83377 WAT 3424 ATOM 83377 O WAT 3425 20.868 105.224 97.537 1.00 0.00 O ATOM 83378 H1 WAT 3425 20.664 104.647 96.801 1.00 0.00 H ATOM 83379 H2 WAT 3425 20.494 106.070 97.288 1.00 0.00 H TER 83381 WAT 3425 ATOM 83381 O WAT 3426 88.846 2.129 119.967 1.00 0.00 O ATOM 83382 H1 WAT 3426 88.664 2.728 119.243 1.00 0.00 H ATOM 83383 H2 WAT 3426 89.776 2.254 120.155 1.00 0.00 H TER 83385 WAT 3426 ATOM 83385 O WAT 3427 36.327 71.057 106.878 1.00 0.00 O ATOM 83386 H1 WAT 3427 36.481 71.960 107.155 1.00 0.00 H ATOM 83387 H2 WAT 3427 36.114 70.592 107.687 1.00 0.00 H TER 83389 WAT 3427 ATOM 83389 O WAT 3428 76.479 14.018 158.166 1.00 0.00 O ATOM 83390 H1 WAT 3428 76.409 13.658 157.281 1.00 0.00 H ATOM 83391 H2 WAT 3428 77.290 13.644 158.512 1.00 0.00 H TER 83393 WAT 3428 ATOM 83393 O WAT 3429 26.464 42.595 2.390 1.00 0.00 O ATOM 83394 H1 WAT 3429 26.536 41.677 2.653 1.00 0.00 H ATOM 83395 H2 WAT 3429 25.727 42.612 1.780 1.00 0.00 H TER 83397 WAT 3429 ATOM 83397 O WAT 3430 29.863 38.045 105.828 1.00 0.00 O ATOM 83398 H1 WAT 3430 28.955 37.760 105.726 1.00 0.00 H ATOM 83399 H2 WAT 3430 30.382 37.271 105.610 1.00 0.00 H TER 83401 WAT 3430 ATOM 83401 O WAT 3431 120.711 92.001 140.645 1.00 0.00 O ATOM 83402 H1 WAT 3431 119.768 92.078 140.502 1.00 0.00 H ATOM 83403 H2 WAT 3431 121.087 92.741 140.169 1.00 0.00 H TER 83405 WAT 3431 ATOM 83405 O WAT 3432 69.384 115.942 10.273 1.00 0.00 O ATOM 83406 H1 WAT 3432 69.342 115.789 11.217 1.00 0.00 H ATOM 83407 H2 WAT 3432 68.836 115.254 9.895 1.00 0.00 H TER 83409 WAT 3432 ATOM 83409 O WAT 3433 129.465 133.922 97.502 1.00 0.00 O ATOM 83410 H1 WAT 3433 129.373 133.096 97.975 1.00 0.00 H ATOM 83411 H2 WAT 3433 130.348 133.889 97.132 1.00 0.00 H TER 83413 WAT 3433 ATOM 83413 O WAT 3434 96.517 27.830 135.629 1.00 0.00 O ATOM 83414 H1 WAT 3434 97.473 27.858 135.589 1.00 0.00 H ATOM 83415 H2 WAT 3434 96.275 27.091 135.071 1.00 0.00 H TER 83417 WAT 3434 ATOM 83417 O WAT 3435 39.936 103.694 117.281 1.00 0.00 O ATOM 83418 H1 WAT 3435 39.660 103.335 118.124 1.00 0.00 H ATOM 83419 H2 WAT 3435 40.445 104.473 117.506 1.00 0.00 H TER 83421 WAT 3435 ATOM 83421 O WAT 3436 126.911 43.489 62.313 1.00 0.00 O ATOM 83422 H1 WAT 3436 126.603 44.220 61.777 1.00 0.00 H ATOM 83423 H2 WAT 3436 126.635 42.707 61.835 1.00 0.00 H TER 83425 WAT 3436 ATOM 83425 O WAT 3437 9.014 111.818 156.901 1.00 0.00 O ATOM 83426 H1 WAT 3437 8.979 111.469 156.010 1.00 0.00 H ATOM 83427 H2 WAT 3437 8.188 112.290 157.006 1.00 0.00 H TER 83429 WAT 3437 ATOM 83429 O WAT 3438 77.485 118.043 132.114 1.00 0.00 O ATOM 83430 H1 WAT 3438 76.726 117.916 132.684 1.00 0.00 H ATOM 83431 H2 WAT 3438 78.041 118.660 132.590 1.00 0.00 H TER 83433 WAT 3438 ATOM 83433 O WAT 3439 7.981 84.635 117.634 1.00 0.00 O ATOM 83434 H1 WAT 3439 7.678 84.071 116.922 1.00 0.00 H ATOM 83435 H2 WAT 3439 7.981 84.068 118.405 1.00 0.00 H TER 83437 WAT 3439 ATOM 83437 O WAT 3440 145.774 139.343 96.152 1.00 0.00 O ATOM 83438 H1 WAT 3440 145.449 138.445 96.218 1.00 0.00 H ATOM 83439 H2 WAT 3440 146.170 139.390 95.281 1.00 0.00 H TER 83441 WAT 3440 ATOM 83441 O WAT 3441 60.002 25.331 135.249 1.00 0.00 O ATOM 83442 H1 WAT 3441 60.210 24.437 135.523 1.00 0.00 H ATOM 83443 H2 WAT 3441 60.771 25.614 134.754 1.00 0.00 H TER 83445 WAT 3441 ATOM 83445 O WAT 3442 113.096 63.762 129.604 1.00 0.00 O ATOM 83446 H1 WAT 3442 113.735 64.448 129.796 1.00 0.00 H ATOM 83447 H2 WAT 3442 113.422 63.349 128.804 1.00 0.00 H TER 83449 WAT 3442 ATOM 83449 O WAT 3443 39.333 128.878 88.530 1.00 0.00 O ATOM 83450 H1 WAT 3443 39.978 128.265 88.882 1.00 0.00 H ATOM 83451 H2 WAT 3443 39.720 129.192 87.713 1.00 0.00 H TER 83453 WAT 3443 ATOM 83453 O WAT 3444 54.724 111.481 59.170 1.00 0.00 O ATOM 83454 H1 WAT 3444 55.396 111.055 58.637 1.00 0.00 H ATOM 83455 H2 WAT 3444 54.817 112.413 58.972 1.00 0.00 H TER 83457 WAT 3444 ATOM 83457 O WAT 3445 5.465 27.442 137.079 1.00 0.00 O ATOM 83458 H1 WAT 3445 5.483 27.790 136.187 1.00 0.00 H ATOM 83459 H2 WAT 3445 5.286 26.508 136.968 1.00 0.00 H TER 83461 WAT 3445 ATOM 83461 O WAT 3446 120.612 94.692 85.877 1.00 0.00 O ATOM 83462 H1 WAT 3446 120.760 94.948 86.787 1.00 0.00 H ATOM 83463 H2 WAT 3446 121.379 94.168 85.648 1.00 0.00 H TER 83465 WAT 3446 ATOM 83465 O WAT 3447 96.182 135.623 92.111 1.00 0.00 O ATOM 83466 H1 WAT 3447 95.812 134.773 92.348 1.00 0.00 H ATOM 83467 H2 WAT 3447 96.908 135.747 92.722 1.00 0.00 H TER 83469 WAT 3447 ATOM 83469 O WAT 3448 60.608 141.244 110.556 1.00 0.00 O ATOM 83470 H1 WAT 3448 60.073 141.961 110.897 1.00 0.00 H ATOM 83471 H2 WAT 3448 61.449 141.338 111.003 1.00 0.00 H TER 83473 WAT 3448 ATOM 83473 O WAT 3449 89.338 115.489 29.777 1.00 0.00 O ATOM 83474 H1 WAT 3449 90.216 115.567 29.402 1.00 0.00 H ATOM 83475 H2 WAT 3449 88.814 116.128 29.295 1.00 0.00 H TER 83477 WAT 3449 ATOM 83477 O WAT 3450 104.478 22.774 148.342 1.00 0.00 O ATOM 83478 H1 WAT 3450 104.017 23.057 149.131 1.00 0.00 H ATOM 83479 H2 WAT 3450 103.935 23.093 147.621 1.00 0.00 H TER 83481 WAT 3450 ATOM 83481 O WAT 3451 1.742 6.865 56.083 1.00 0.00 O ATOM 83482 H1 WAT 3451 1.152 7.595 55.892 1.00 0.00 H ATOM 83483 H2 WAT 3451 1.958 6.967 57.010 1.00 0.00 H TER 83485 WAT 3451 ATOM 83485 O WAT 3452 51.444 142.475 64.812 1.00 0.00 O ATOM 83486 H1 WAT 3452 50.597 142.426 64.369 1.00 0.00 H ATOM 83487 H2 WAT 3452 51.892 143.209 64.391 1.00 0.00 H TER 83489 WAT 3452 ATOM 83489 O WAT 3453 28.815 28.100 129.783 1.00 0.00 O ATOM 83490 H1 WAT 3453 29.010 28.001 130.715 1.00 0.00 H ATOM 83491 H2 WAT 3453 29.056 29.005 129.582 1.00 0.00 H TER 83493 WAT 3453 ATOM 83493 O WAT 3454 141.610 61.477 0.456 1.00 0.00 O ATOM 83494 H1 WAT 3454 142.300 61.847 1.007 1.00 0.00 H ATOM 83495 H2 WAT 3454 140.807 61.900 0.761 1.00 0.00 H TER 83497 WAT 3454 ATOM 83497 O WAT 3455 44.085 70.105 111.680 1.00 0.00 O ATOM 83498 H1 WAT 3455 43.408 70.716 111.973 1.00 0.00 H ATOM 83499 H2 WAT 3455 44.909 70.557 111.861 1.00 0.00 H TER 83501 WAT 3455 ATOM 83501 O WAT 3456 134.662 26.649 84.219 1.00 0.00 O ATOM 83502 H1 WAT 3456 133.889 26.692 84.783 1.00 0.00 H ATOM 83503 H2 WAT 3456 134.800 25.714 84.072 1.00 0.00 H TER 83505 WAT 3456 ATOM 83505 O WAT 3457 61.622 35.754 152.740 1.00 0.00 O ATOM 83506 H1 WAT 3457 62.192 35.058 152.411 1.00 0.00 H ATOM 83507 H2 WAT 3457 62.008 36.004 153.579 1.00 0.00 H TER 83509 WAT 3457 ATOM 83509 O WAT 3458 69.266 82.520 144.863 1.00 0.00 O ATOM 83510 H1 WAT 3458 68.753 81.721 144.987 1.00 0.00 H ATOM 83511 H2 WAT 3458 69.760 82.364 144.058 1.00 0.00 H TER 83513 WAT 3458 ATOM 83513 O WAT 3459 6.758 84.709 121.405 1.00 0.00 O ATOM 83514 H1 WAT 3459 5.974 85.115 121.776 1.00 0.00 H ATOM 83515 H2 WAT 3459 7.377 85.432 121.303 1.00 0.00 H TER 83517 WAT 3459 ATOM 83517 O WAT 3460 59.865 138.903 112.396 1.00 0.00 O ATOM 83518 H1 WAT 3460 60.234 139.678 111.973 1.00 0.00 H ATOM 83519 H2 WAT 3460 60.509 138.213 112.234 1.00 0.00 H TER 83521 WAT 3460 ATOM 83521 O WAT 3461 109.688 17.007 6.226 1.00 0.00 O ATOM 83522 H1 WAT 3461 109.337 16.199 5.850 1.00 0.00 H ATOM 83523 H2 WAT 3461 109.067 17.685 5.960 1.00 0.00 H TER 83525 WAT 3461 ATOM 83525 O WAT 3462 63.706 129.518 120.981 1.00 0.00 O ATOM 83526 H1 WAT 3462 64.126 129.118 121.743 1.00 0.00 H ATOM 83527 H2 WAT 3462 63.651 128.810 120.339 1.00 0.00 H TER 83529 WAT 3462 ATOM 83529 O WAT 3463 73.895 103.885 151.422 1.00 0.00 O ATOM 83530 H1 WAT 3463 73.344 104.656 151.554 1.00 0.00 H ATOM 83531 H2 WAT 3463 73.596 103.261 152.083 1.00 0.00 H TER 83533 WAT 3463 ATOM 83533 O WAT 3464 118.206 85.926 7.783 1.00 0.00 O ATOM 83534 H1 WAT 3464 117.427 85.705 7.273 1.00 0.00 H ATOM 83535 H2 WAT 3464 118.071 85.493 8.627 1.00 0.00 H TER 83537 WAT 3464 ATOM 83537 O WAT 3465 145.492 54.445 1.096 1.00 0.00 O ATOM 83538 H1 WAT 3465 145.967 55.274 1.148 1.00 0.00 H ATOM 83539 H2 WAT 3465 145.755 53.968 1.882 1.00 0.00 H TER 83541 WAT 3465 ATOM 83541 O WAT 3466 42.898 112.770 23.352 1.00 0.00 O ATOM 83542 H1 WAT 3466 42.138 112.194 23.269 1.00 0.00 H ATOM 83543 H2 WAT 3466 43.323 112.491 24.162 1.00 0.00 H TER 83545 WAT 3466 ATOM 83545 O WAT 3467 61.153 126.297 118.842 1.00 0.00 O ATOM 83546 H1 WAT 3467 60.294 126.568 118.518 1.00 0.00 H ATOM 83547 H2 WAT 3467 61.754 126.967 118.516 1.00 0.00 H TER 83549 WAT 3467 ATOM 83549 O WAT 3468 61.673 101.637 86.091 1.00 0.00 O ATOM 83550 H1 WAT 3468 61.956 100.864 85.603 1.00 0.00 H ATOM 83551 H2 WAT 3468 60.867 101.363 86.528 1.00 0.00 H TER 83553 WAT 3468 ATOM 83553 O WAT 3469 128.907 32.268 146.161 1.00 0.00 O ATOM 83554 H1 WAT 3469 129.705 32.714 146.443 1.00 0.00 H ATOM 83555 H2 WAT 3469 128.273 32.450 146.854 1.00 0.00 H TER 83557 WAT 3469 ATOM 83557 O WAT 3470 122.262 67.349 135.059 1.00 0.00 O ATOM 83558 H1 WAT 3470 122.366 68.299 135.097 1.00 0.00 H ATOM 83559 H2 WAT 3470 123.150 67.016 134.925 1.00 0.00 H TER 83561 WAT 3470 ATOM 83561 O WAT 3471 114.742 38.164 3.125 1.00 0.00 O ATOM 83562 H1 WAT 3471 114.378 39.037 2.975 1.00 0.00 H ATOM 83563 H2 WAT 3471 115.612 38.327 3.488 1.00 0.00 H TER 83565 WAT 3471 ATOM 83565 O WAT 3472 54.682 139.972 58.820 1.00 0.00 O ATOM 83566 H1 WAT 3472 54.542 139.386 58.076 1.00 0.00 H ATOM 83567 H2 WAT 3472 55.548 140.350 58.667 1.00 0.00 H TER 83569 WAT 3472 ATOM 83569 O WAT 3473 19.923 135.112 76.717 1.00 0.00 O ATOM 83570 H1 WAT 3473 20.736 135.427 76.323 1.00 0.00 H ATOM 83571 H2 WAT 3473 19.778 134.256 76.313 1.00 0.00 H TER 83573 WAT 3473 ATOM 83573 O WAT 3474 84.386 112.168 135.008 1.00 0.00 O ATOM 83574 H1 WAT 3474 84.193 111.427 134.433 1.00 0.00 H ATOM 83575 H2 WAT 3474 84.919 112.755 134.472 1.00 0.00 H TER 83577 WAT 3474 ATOM 83577 O WAT 3475 80.833 110.256 10.330 1.00 0.00 O ATOM 83578 H1 WAT 3475 80.530 110.281 11.238 1.00 0.00 H ATOM 83579 H2 WAT 3475 81.707 110.644 10.358 1.00 0.00 H TER 83581 WAT 3475 ATOM 83581 O WAT 3476 59.383 43.336 107.986 1.00 0.00 O ATOM 83582 H1 WAT 3476 59.518 43.027 108.881 1.00 0.00 H ATOM 83583 H2 WAT 3476 60.267 43.491 107.651 1.00 0.00 H TER 83585 WAT 3476 ATOM 83585 O WAT 3477 79.094 4.221 137.097 1.00 0.00 O ATOM 83586 H1 WAT 3477 79.723 3.934 137.760 1.00 0.00 H ATOM 83587 H2 WAT 3477 78.262 4.278 137.567 1.00 0.00 H TER 83589 WAT 3477 ATOM 83589 O WAT 3478 82.809 144.780 130.835 1.00 0.00 O ATOM 83590 H1 WAT 3478 82.535 145.621 131.200 1.00 0.00 H ATOM 83591 H2 WAT 3478 82.113 144.547 130.220 1.00 0.00 H TER 83593 WAT 3478 ATOM 83593 O WAT 3479 104.450 37.669 10.748 1.00 0.00 O ATOM 83594 H1 WAT 3479 104.808 38.136 11.503 1.00 0.00 H ATOM 83595 H2 WAT 3479 104.358 36.764 11.048 1.00 0.00 H TER 83597 WAT 3479 ATOM 83597 O WAT 3480 97.456 118.884 136.125 1.00 0.00 O ATOM 83598 H1 WAT 3480 97.845 119.757 136.075 1.00 0.00 H ATOM 83599 H2 WAT 3480 97.867 118.398 135.410 1.00 0.00 H TER 83601 WAT 3480 ATOM 83601 O WAT 3481 140.508 132.024 100.701 1.00 0.00 O ATOM 83602 H1 WAT 3481 140.873 132.634 100.061 1.00 0.00 H ATOM 83603 H2 WAT 3481 140.847 132.329 101.543 1.00 0.00 H TER 83605 WAT 3481 ATOM 83605 O WAT 3482 110.508 18.669 3.361 1.00 0.00 O ATOM 83606 H1 WAT 3482 110.390 19.223 2.589 1.00 0.00 H ATOM 83607 H2 WAT 3482 110.470 17.774 3.022 1.00 0.00 H TER 83609 WAT 3482 ATOM 83609 O WAT 3483 4.726 145.725 1.498 1.00 0.00 O ATOM 83610 H1 WAT 3483 5.343 146.418 1.736 1.00 0.00 H ATOM 83611 H2 WAT 3483 5.274 145.034 1.126 1.00 0.00 H TER 83613 WAT 3483 ATOM 83613 O WAT 3484 103.203 46.754 106.834 1.00 0.00 O ATOM 83614 H1 WAT 3484 103.734 46.167 106.296 1.00 0.00 H ATOM 83615 H2 WAT 3484 102.556 47.115 106.228 1.00 0.00 H TER 83617 WAT 3484 ATOM 83617 O WAT 3485 14.434 70.302 105.419 1.00 0.00 O ATOM 83618 H1 WAT 3485 13.582 70.109 105.029 1.00 0.00 H ATOM 83619 H2 WAT 3485 14.890 70.818 104.754 1.00 0.00 H TER 83621 WAT 3485 ATOM 83621 O WAT 3486 49.041 132.337 82.655 1.00 0.00 O ATOM 83622 H1 WAT 3486 48.849 132.269 81.719 1.00 0.00 H ATOM 83623 H2 WAT 3486 48.336 131.849 83.080 1.00 0.00 H TER 83625 WAT 3486 ATOM 83625 O WAT 3487 114.826 38.777 12.088 1.00 0.00 O ATOM 83626 H1 WAT 3487 114.541 37.907 11.808 1.00 0.00 H ATOM 83627 H2 WAT 3487 114.022 39.212 12.373 1.00 0.00 H TER 83629 WAT 3487 ATOM 83629 O WAT 3488 121.985 31.304 90.487 1.00 0.00 O ATOM 83630 H1 WAT 3488 122.510 31.737 91.160 1.00 0.00 H ATOM 83631 H2 WAT 3488 121.710 32.013 89.905 1.00 0.00 H TER 83633 WAT 3488 ATOM 83633 O WAT 3489 61.915 36.068 14.599 1.00 0.00 O ATOM 83634 H1 WAT 3489 61.779 35.125 14.501 1.00 0.00 H ATOM 83635 H2 WAT 3489 61.156 36.368 15.098 1.00 0.00 H TER 83637 WAT 3489 ATOM 83637 O WAT 3490 93.749 32.292 153.457 1.00 0.00 O ATOM 83638 H1 WAT 3490 93.788 33.248 153.443 1.00 0.00 H ATOM 83639 H2 WAT 3490 93.058 32.089 154.088 1.00 0.00 H TER 83641 WAT 3490 ATOM 83641 O WAT 3491 81.516 17.100 61.840 1.00 0.00 O ATOM 83642 H1 WAT 3491 81.252 16.333 62.348 1.00 0.00 H ATOM 83643 H2 WAT 3491 81.557 16.786 60.936 1.00 0.00 H TER 83645 WAT 3491 ATOM 83645 O WAT 3492 57.250 105.769 136.869 1.00 0.00 O ATOM 83646 H1 WAT 3492 57.065 106.030 137.771 1.00 0.00 H ATOM 83647 H2 WAT 3492 58.165 105.491 136.883 1.00 0.00 H TER 83649 WAT 3492 ATOM 83649 O WAT 3493 108.526 131.649 134.473 1.00 0.00 O ATOM 83650 H1 WAT 3493 107.775 132.223 134.627 1.00 0.00 H ATOM 83651 H2 WAT 3493 108.173 130.928 133.951 1.00 0.00 H TER 83653 WAT 3493 ATOM 83653 O WAT 3494 115.478 103.491 59.704 1.00 0.00 O ATOM 83654 H1 WAT 3494 114.625 103.073 59.592 1.00 0.00 H ATOM 83655 H2 WAT 3494 116.109 102.777 59.615 1.00 0.00 H TER 83657 WAT 3494 ATOM 83657 O WAT 3495 87.412 5.906 155.443 1.00 0.00 O ATOM 83658 H1 WAT 3495 86.473 6.088 155.411 1.00 0.00 H ATOM 83659 H2 WAT 3495 87.519 5.337 156.205 1.00 0.00 H TER 83661 WAT 3495 ATOM 83661 O WAT 3496 117.274 30.336 87.884 1.00 0.00 O ATOM 83662 H1 WAT 3496 117.269 29.380 87.828 1.00 0.00 H ATOM 83663 H2 WAT 3496 118.127 30.592 87.531 1.00 0.00 H TER 83665 WAT 3496 ATOM 83665 O WAT 3497 108.333 43.753 5.804 1.00 0.00 O ATOM 83666 H1 WAT 3497 108.707 42.970 5.400 1.00 0.00 H ATOM 83667 H2 WAT 3497 108.452 43.617 6.744 1.00 0.00 H TER 83669 WAT 3497 ATOM 83669 O WAT 3498 48.110 53.957 80.728 1.00 0.00 O ATOM 83670 H1 WAT 3498 48.611 53.903 81.542 1.00 0.00 H ATOM 83671 H2 WAT 3498 48.734 54.293 80.084 1.00 0.00 H TER 83673 WAT 3498 ATOM 83673 O WAT 3499 138.621 82.011 0.015 1.00 0.00 O ATOM 83674 H1 WAT 3499 138.518 82.740 0.627 1.00 0.00 H ATOM 83675 H2 WAT 3499 139.029 81.319 0.535 1.00 0.00 H TER 83677 WAT 3499 ATOM 83677 O WAT 3500 120.729 97.738 99.572 1.00 0.00 O ATOM 83678 H1 WAT 3500 121.494 97.296 99.939 1.00 0.00 H ATOM 83679 H2 WAT 3500 120.192 97.031 99.214 1.00 0.00 H TER 83681 WAT 3500 ATOM 83681 O WAT 3501 72.133 32.839 64.292 1.00 0.00 O ATOM 83682 H1 WAT 3501 72.748 33.573 64.285 1.00 0.00 H ATOM 83683 H2 WAT 3501 71.633 32.938 63.482 1.00 0.00 H TER 83685 WAT 3501 ATOM 83685 O WAT 3502 72.748 78.305 52.589 1.00 0.00 O ATOM 83686 H1 WAT 3502 73.192 77.469 52.445 1.00 0.00 H ATOM 83687 H2 WAT 3502 73.458 78.931 52.730 1.00 0.00 H TER 83689 WAT 3502 ATOM 83689 O WAT 3503 79.800 58.173 96.325 1.00 0.00 O ATOM 83690 H1 WAT 3503 79.521 59.066 96.122 1.00 0.00 H ATOM 83691 H2 WAT 3503 79.031 57.634 96.142 1.00 0.00 H TER 83693 WAT 3503 ATOM 83693 O WAT 3504 129.095 89.669 130.974 1.00 0.00 O ATOM 83694 H1 WAT 3504 129.104 89.642 131.930 1.00 0.00 H ATOM 83695 H2 WAT 3504 130.004 89.509 130.721 1.00 0.00 H TER 83697 WAT 3504 ATOM 83697 O WAT 3505 72.277 60.988 145.423 1.00 0.00 O ATOM 83698 H1 WAT 3505 72.603 61.869 145.606 1.00 0.00 H ATOM 83699 H2 WAT 3505 71.575 60.855 146.061 1.00 0.00 H TER 83701 WAT 3505 ATOM 83701 O WAT 3506 124.449 111.984 83.702 1.00 0.00 O ATOM 83702 H1 WAT 3506 124.013 112.571 83.084 1.00 0.00 H ATOM 83703 H2 WAT 3506 123.826 111.889 84.422 1.00 0.00 H TER 83705 WAT 3506 ATOM 83705 O WAT 3507 106.491 3.480 120.437 1.00 0.00 O ATOM 83706 H1 WAT 3507 105.604 3.134 120.339 1.00 0.00 H ATOM 83707 H2 WAT 3507 106.954 3.176 119.656 1.00 0.00 H TER 83709 WAT 3507 ATOM 83709 O WAT 3508 13.249 86.772 118.937 1.00 0.00 O ATOM 83710 H1 WAT 3508 13.294 87.370 118.191 1.00 0.00 H ATOM 83711 H2 WAT 3508 13.841 87.153 119.585 1.00 0.00 H TER 83713 WAT 3508 ATOM 83713 O WAT 3509 12.904 50.785 0.968 1.00 0.00 O ATOM 83714 H1 WAT 3509 12.345 50.028 0.794 1.00 0.00 H ATOM 83715 H2 WAT 3509 13.625 50.699 0.345 1.00 0.00 H TER 83717 WAT 3509 ATOM 83717 O WAT 3510 29.760 55.653 13.557 1.00 0.00 O ATOM 83718 H1 WAT 3510 28.983 55.423 14.067 1.00 0.00 H ATOM 83719 H2 WAT 3510 30.265 56.226 14.134 1.00 0.00 H TER 83721 WAT 3510 ATOM 83721 O WAT 3511 90.616 10.631 156.892 1.00 0.00 O ATOM 83722 H1 WAT 3511 89.923 11.155 157.295 1.00 0.00 H ATOM 83723 H2 WAT 3511 90.509 10.777 155.952 1.00 0.00 H TER 83725 WAT 3511 ATOM 83725 O WAT 3512 70.388 138.524 95.877 1.00 0.00 O ATOM 83726 H1 WAT 3512 70.319 139.443 95.618 1.00 0.00 H ATOM 83727 H2 WAT 3512 69.945 138.044 95.177 1.00 0.00 H TER 83729 WAT 3512 ATOM 83729 O WAT 3513 100.968 41.549 116.257 1.00 0.00 O ATOM 83730 H1 WAT 3513 101.317 41.939 117.058 1.00 0.00 H ATOM 83731 H2 WAT 3513 101.732 41.170 115.823 1.00 0.00 H TER 83733 WAT 3513 ATOM 83733 O WAT 3514 57.673 38.644 93.852 1.00 0.00 O ATOM 83734 H1 WAT 3514 56.729 38.494 93.807 1.00 0.00 H ATOM 83735 H2 WAT 3514 57.799 39.502 93.447 1.00 0.00 H TER 83737 WAT 3514 ATOM 83737 O WAT 3515 5.291 49.191 109.695 1.00 0.00 O ATOM 83738 H1 WAT 3515 5.783 48.387 109.864 1.00 0.00 H ATOM 83739 H2 WAT 3515 4.428 48.888 109.412 1.00 0.00 H TER 83741 WAT 3515 ATOM 83741 O WAT 3516 16.396 52.895 10.956 1.00 0.00 O ATOM 83742 H1 WAT 3516 17.311 52.909 11.234 1.00 0.00 H ATOM 83743 H2 WAT 3516 15.967 52.301 11.573 1.00 0.00 H TER 83745 WAT 3516 ATOM 83745 O WAT 3517 138.129 59.921 84.034 1.00 0.00 O ATOM 83746 H1 WAT 3517 137.778 59.051 83.848 1.00 0.00 H ATOM 83747 H2 WAT 3517 137.361 60.447 84.258 1.00 0.00 H TER 83749 WAT 3517 ATOM 83749 O WAT 3518 142.209 43.980 135.367 1.00 0.00 O ATOM 83750 H1 WAT 3518 143.037 44.278 135.743 1.00 0.00 H ATOM 83751 H2 WAT 3518 141.539 44.472 135.842 1.00 0.00 H TER 83753 WAT 3518 ATOM 83753 O WAT 3519 142.837 27.103 13.123 1.00 0.00 O ATOM 83754 H1 WAT 3519 143.601 27.623 12.874 1.00 0.00 H ATOM 83755 H2 WAT 3519 142.973 26.908 14.051 1.00 0.00 H TER 83757 WAT 3519 ATOM 83757 O WAT 3520 21.813 100.545 110.873 1.00 0.00 O ATOM 83758 H1 WAT 3520 22.594 100.481 111.422 1.00 0.00 H ATOM 83759 H2 WAT 3520 21.376 101.344 111.170 1.00 0.00 H TER 83761 WAT 3520 ATOM 83761 O WAT 3521 80.642 115.848 129.957 1.00 0.00 O ATOM 83762 H1 WAT 3521 79.990 115.906 130.655 1.00 0.00 H ATOM 83763 H2 WAT 3521 80.240 116.301 129.216 1.00 0.00 H TER 83765 WAT 3521 ATOM 83765 O WAT 3522 141.605 77.168 119.343 1.00 0.00 O ATOM 83766 H1 WAT 3522 141.543 77.462 120.252 1.00 0.00 H ATOM 83767 H2 WAT 3522 140.912 76.514 119.255 1.00 0.00 H TER 83769 WAT 3522 ATOM 83769 O WAT 3523 140.135 31.386 120.633 1.00 0.00 O ATOM 83770 H1 WAT 3523 140.200 32.337 120.543 1.00 0.00 H ATOM 83771 H2 WAT 3523 140.881 31.146 121.183 1.00 0.00 H TER 83773 WAT 3523 ATOM 83773 O WAT 3524 42.677 103.336 114.906 1.00 0.00 O ATOM 83774 H1 WAT 3524 43.625 103.298 114.775 1.00 0.00 H ATOM 83775 H2 WAT 3524 42.550 104.048 115.532 1.00 0.00 H TER 83777 WAT 3524 ATOM 83777 O WAT 3525 89.099 37.350 75.903 1.00 0.00 O ATOM 83778 H1 WAT 3525 88.259 36.901 76.006 1.00 0.00 H ATOM 83779 H2 WAT 3525 89.298 37.690 76.775 1.00 0.00 H TER 83781 WAT 3525 ATOM 83781 O WAT 3526 41.789 139.615 10.933 1.00 0.00 O ATOM 83782 H1 WAT 3526 42.720 139.776 10.776 1.00 0.00 H ATOM 83783 H2 WAT 3526 41.679 139.744 11.875 1.00 0.00 H TER 83785 WAT 3526 ATOM 83785 O WAT 3527 33.654 101.278 102.745 1.00 0.00 O ATOM 83786 H1 WAT 3527 34.508 101.428 103.150 1.00 0.00 H ATOM 83787 H2 WAT 3527 33.358 100.443 103.110 1.00 0.00 H TER 83789 WAT 3527 ATOM 83789 O WAT 3528 50.182 146.074 68.179 1.00 0.00 O ATOM 83790 H1 WAT 3528 50.362 145.185 67.873 1.00 0.00 H ATOM 83791 H2 WAT 3528 49.259 146.216 67.970 1.00 0.00 H TER 83793 WAT 3528 ATOM 83793 O WAT 3529 12.410 52.547 95.655 1.00 0.00 O ATOM 83794 H1 WAT 3529 11.809 52.164 95.016 1.00 0.00 H ATOM 83795 H2 WAT 3529 12.723 51.801 96.168 1.00 0.00 H TER 83797 WAT 3529 ATOM 83797 O WAT 3530 128.374 13.784 109.227 1.00 0.00 O ATOM 83798 H1 WAT 3530 127.689 13.691 108.566 1.00 0.00 H ATOM 83799 H2 WAT 3530 128.986 13.072 109.041 1.00 0.00 H TER 83801 WAT 3530 ATOM 83801 O WAT 3531 120.248 0.168 87.267 1.00 0.00 O ATOM 83802 H1 WAT 3531 119.846 0.790 87.873 1.00 0.00 H ATOM 83803 H2 WAT 3531 120.533 0.704 86.527 1.00 0.00 H TER 83805 WAT 3531 ATOM 83805 O WAT 3532 18.559 24.521 132.185 1.00 0.00 O ATOM 83806 H1 WAT 3532 18.810 25.333 132.624 1.00 0.00 H ATOM 83807 H2 WAT 3532 18.075 24.029 132.849 1.00 0.00 H TER 83809 WAT 3532 ATOM 83809 O WAT 3533 130.326 1.727 108.845 1.00 0.00 O ATOM 83810 H1 WAT 3533 130.616 1.885 109.743 1.00 0.00 H ATOM 83811 H2 WAT 3533 129.391 1.536 108.925 1.00 0.00 H TER 83813 WAT 3533 ATOM 83813 O WAT 3534 76.268 31.494 81.953 1.00 0.00 O ATOM 83814 H1 WAT 3534 75.660 32.148 81.610 1.00 0.00 H ATOM 83815 H2 WAT 3534 76.887 31.997 82.482 1.00 0.00 H TER 83817 WAT 3534 ATOM 83817 O WAT 3535 63.986 142.014 62.534 1.00 0.00 O ATOM 83818 H1 WAT 3535 63.111 142.108 62.157 1.00 0.00 H ATOM 83819 H2 WAT 3535 64.172 141.077 62.477 1.00 0.00 H TER 83821 WAT 3535 ATOM 83821 O WAT 3536 55.548 69.592 84.002 1.00 0.00 O ATOM 83822 H1 WAT 3536 55.865 70.445 83.708 1.00 0.00 H ATOM 83823 H2 WAT 3536 54.942 69.794 84.715 1.00 0.00 H TER 83825 WAT 3536 ATOM 83825 O WAT 3537 109.504 8.439 85.033 1.00 0.00 O ATOM 83826 H1 WAT 3537 109.314 8.485 84.096 1.00 0.00 H ATOM 83827 H2 WAT 3537 110.108 7.702 85.118 1.00 0.00 H TER 83829 WAT 3537 ATOM 83829 O WAT 3538 79.246 134.423 65.121 1.00 0.00 O ATOM 83830 H1 WAT 3538 79.826 134.602 65.861 1.00 0.00 H ATOM 83831 H2 WAT 3538 78.381 134.312 65.516 1.00 0.00 H TER 83833 WAT 3538 ATOM 83833 O WAT 3539 49.354 69.618 112.385 1.00 0.00 O ATOM 83834 H1 WAT 3539 48.816 69.635 111.594 1.00 0.00 H ATOM 83835 H2 WAT 3539 50.251 69.731 112.068 1.00 0.00 H TER 83837 WAT 3539 ATOM 83837 O WAT 3540 66.072 17.859 105.669 1.00 0.00 O ATOM 83838 H1 WAT 3540 66.569 17.048 105.778 1.00 0.00 H ATOM 83839 H2 WAT 3540 66.674 18.548 105.947 1.00 0.00 H TER 83841 WAT 3540 ATOM 83841 O WAT 3541 131.802 27.838 73.582 1.00 0.00 O ATOM 83842 H1 WAT 3541 131.427 26.958 73.633 1.00 0.00 H ATOM 83843 H2 WAT 3541 132.198 27.879 72.711 1.00 0.00 H TER 83845 WAT 3541 ATOM 83845 O WAT 3542 68.379 96.096 81.476 1.00 0.00 O ATOM 83846 H1 WAT 3542 68.471 95.944 80.536 1.00 0.00 H ATOM 83847 H2 WAT 3542 67.522 96.512 81.569 1.00 0.00 H TER 83849 WAT 3542 ATOM 83849 O WAT 3543 75.468 6.364 19.751 1.00 0.00 O ATOM 83850 H1 WAT 3543 74.636 6.737 20.041 1.00 0.00 H ATOM 83851 H2 WAT 3543 76.134 6.922 20.154 1.00 0.00 H TER 83853 WAT 3543 ATOM 83853 O WAT 3544 67.902 9.219 102.651 1.00 0.00 O ATOM 83854 H1 WAT 3544 68.538 9.926 102.541 1.00 0.00 H ATOM 83855 H2 WAT 3544 68.426 8.464 102.916 1.00 0.00 H TER 83857 WAT 3544 ATOM 83857 O WAT 3545 100.746 17.112 70.154 1.00 0.00 O ATOM 83858 H1 WAT 3545 101.495 16.589 69.869 1.00 0.00 H ATOM 83859 H2 WAT 3545 101.113 17.977 70.334 1.00 0.00 H TER 83861 WAT 3545 ATOM 83861 O WAT 3546 90.487 67.980 124.860 1.00 0.00 O ATOM 83862 H1 WAT 3546 90.539 68.548 124.091 1.00 0.00 H ATOM 83863 H2 WAT 3546 89.811 68.381 125.407 1.00 0.00 H TER 83865 WAT 3546 ATOM 83865 O WAT 3547 74.298 104.493 107.549 1.00 0.00 O ATOM 83866 H1 WAT 3547 73.653 105.189 107.671 1.00 0.00 H ATOM 83867 H2 WAT 3547 74.148 104.181 106.657 1.00 0.00 H TER 83869 WAT 3547 ATOM 83869 O WAT 3548 48.216 70.289 105.620 1.00 0.00 O ATOM 83870 H1 WAT 3548 48.096 69.386 105.324 1.00 0.00 H ATOM 83871 H2 WAT 3548 48.247 70.803 104.813 1.00 0.00 H TER 83873 WAT 3548 ATOM 83873 O WAT 3549 75.517 109.103 88.011 1.00 0.00 O ATOM 83874 H1 WAT 3549 74.965 108.490 88.497 1.00 0.00 H ATOM 83875 H2 WAT 3549 75.466 108.804 87.103 1.00 0.00 H TER 83877 WAT 3549 ATOM 83877 O WAT 3550 19.629 84.742 1.675 1.00 0.00 O ATOM 83878 H1 WAT 3550 19.334 84.893 2.573 1.00 0.00 H ATOM 83879 H2 WAT 3550 20.303 84.067 1.755 1.00 0.00 H TER 83881 WAT 3550 ATOM 83881 O WAT 3551 132.673 107.631 18.068 1.00 0.00 O ATOM 83882 H1 WAT 3551 132.847 107.473 17.140 1.00 0.00 H ATOM 83883 H2 WAT 3551 132.219 106.842 18.364 1.00 0.00 H TER 83885 WAT 3551 ATOM 83885 O WAT 3552 43.019 105.623 111.328 1.00 0.00 O ATOM 83886 H1 WAT 3552 42.078 105.637 111.149 1.00 0.00 H ATOM 83887 H2 WAT 3552 43.119 106.149 112.121 1.00 0.00 H TER 83889 WAT 3552 ATOM 83889 O WAT 3553 126.165 87.843 74.660 1.00 0.00 O ATOM 83890 H1 WAT 3553 126.622 87.008 74.764 1.00 0.00 H ATOM 83891 H2 WAT 3553 126.169 88.229 75.536 1.00 0.00 H TER 83893 WAT 3553 ATOM 83893 O WAT 3554 56.088 120.887 1.289 1.00 0.00 O ATOM 83894 H1 WAT 3554 55.245 120.760 0.853 1.00 0.00 H ATOM 83895 H2 WAT 3554 56.176 120.129 1.866 1.00 0.00 H TER 83897 WAT 3554 ATOM 83897 O WAT 3555 124.816 24.093 83.370 1.00 0.00 O ATOM 83898 H1 WAT 3555 124.445 24.950 83.580 1.00 0.00 H ATOM 83899 H2 WAT 3555 125.503 24.280 82.730 1.00 0.00 H TER 83901 WAT 3555 ATOM 83901 O WAT 3556 103.626 36.670 107.032 1.00 0.00 O ATOM 83902 H1 WAT 3556 103.799 36.502 107.958 1.00 0.00 H ATOM 83903 H2 WAT 3556 102.928 37.325 107.034 1.00 0.00 H TER 83905 WAT 3556 ATOM 83905 O WAT 3557 114.122 19.305 19.381 1.00 0.00 O ATOM 83906 H1 WAT 3557 114.499 19.765 18.630 1.00 0.00 H ATOM 83907 H2 WAT 3557 113.493 18.694 18.996 1.00 0.00 H TER 83909 WAT 3557 ATOM 83909 O WAT 3558 75.143 15.611 112.482 1.00 0.00 O ATOM 83910 H1 WAT 3558 75.545 16.355 112.033 1.00 0.00 H ATOM 83911 H2 WAT 3558 74.258 15.907 112.693 1.00 0.00 H TER 83913 WAT 3558 ATOM 83913 O WAT 3559 143.947 140.543 104.586 1.00 0.00 O ATOM 83914 H1 WAT 3559 144.222 141.453 104.692 1.00 0.00 H ATOM 83915 H2 WAT 3559 143.681 140.270 105.464 1.00 0.00 H TER 83917 WAT 3559 ATOM 83917 O WAT 3560 6.233 11.570 155.583 1.00 0.00 O ATOM 83918 H1 WAT 3560 6.830 11.347 154.869 1.00 0.00 H ATOM 83919 H2 WAT 3560 5.494 12.001 155.152 1.00 0.00 H TER 83921 WAT 3560 ATOM 83921 O WAT 3561 102.171 27.492 84.707 1.00 0.00 O ATOM 83922 H1 WAT 3561 102.326 26.688 84.212 1.00 0.00 H ATOM 83923 H2 WAT 3561 102.791 28.122 84.340 1.00 0.00 H TER 83925 WAT 3561 ATOM 83925 O WAT 3562 94.520 142.963 116.393 1.00 0.00 O ATOM 83926 H1 WAT 3562 93.563 142.944 116.380 1.00 0.00 H ATOM 83927 H2 WAT 3562 94.744 143.137 117.308 1.00 0.00 H TER 83929 WAT 3562 ATOM 83929 O WAT 3563 125.600 90.941 105.560 1.00 0.00 O ATOM 83930 H1 WAT 3563 124.701 91.130 105.289 1.00 0.00 H ATOM 83931 H2 WAT 3563 126.110 90.996 104.752 1.00 0.00 H TER 83933 WAT 3563 ATOM 83933 O WAT 3564 59.276 120.489 85.372 1.00 0.00 O ATOM 83934 H1 WAT 3564 58.939 120.337 84.489 1.00 0.00 H ATOM 83935 H2 WAT 3564 60.066 119.950 85.421 1.00 0.00 H TER 83937 WAT 3564 ATOM 83937 O WAT 3565 76.526 107.375 92.885 1.00 0.00 O ATOM 83938 H1 WAT 3565 76.841 107.897 92.147 1.00 0.00 H ATOM 83939 H2 WAT 3565 76.512 106.477 92.554 1.00 0.00 H TER 83941 WAT 3565 ATOM 83941 O WAT 3566 37.565 5.806 12.950 1.00 0.00 O ATOM 83942 H1 WAT 3566 36.836 5.953 13.553 1.00 0.00 H ATOM 83943 H2 WAT 3566 37.167 5.834 12.080 1.00 0.00 H TER 83945 WAT 3566 ATOM 83945 O WAT 3567 75.396 31.246 1.588 1.00 0.00 O ATOM 83946 H1 WAT 3567 74.673 31.311 0.964 1.00 0.00 H ATOM 83947 H2 WAT 3567 75.160 30.509 2.152 1.00 0.00 H TER 83949 WAT 3567 ATOM 83949 O WAT 3568 74.284 118.401 95.084 1.00 0.00 O ATOM 83950 H1 WAT 3568 73.760 117.897 95.707 1.00 0.00 H ATOM 83951 H2 WAT 3568 74.412 117.808 94.343 1.00 0.00 H TER 83953 WAT 3568 ATOM 83953 O WAT 3569 84.344 113.782 100.964 1.00 0.00 O ATOM 83954 H1 WAT 3569 84.010 114.502 101.499 1.00 0.00 H ATOM 83955 H2 WAT 3569 84.181 112.998 101.488 1.00 0.00 H TER 83957 WAT 3569 ATOM 83957 O WAT 3570 21.540 35.833 82.554 1.00 0.00 O ATOM 83958 H1 WAT 3570 22.185 36.316 83.070 1.00 0.00 H ATOM 83959 H2 WAT 3570 20.754 36.379 82.582 1.00 0.00 H TER 83961 WAT 3570 ATOM 83961 O WAT 3571 33.138 117.603 124.856 1.00 0.00 O ATOM 83962 H1 WAT 3571 33.289 118.373 125.404 1.00 0.00 H ATOM 83963 H2 WAT 3571 33.300 117.909 123.964 1.00 0.00 H TER 83965 WAT 3571 ATOM 83965 O WAT 3572 22.891 94.780 131.551 1.00 0.00 O ATOM 83966 H1 WAT 3572 22.747 93.933 131.973 1.00 0.00 H ATOM 83967 H2 WAT 3572 22.967 94.573 130.619 1.00 0.00 H TER 83969 WAT 3572 ATOM 83969 O WAT 3573 94.147 57.585 69.064 1.00 0.00 O ATOM 83970 H1 WAT 3573 93.974 58.355 69.606 1.00 0.00 H ATOM 83971 H2 WAT 3573 93.817 57.823 68.198 1.00 0.00 H TER 83973 WAT 3573 ATOM 83973 O WAT 3574 109.872 126.374 100.316 1.00 0.00 O ATOM 83974 H1 WAT 3574 109.343 125.708 100.756 1.00 0.00 H ATOM 83975 H2 WAT 3574 109.495 126.439 99.439 1.00 0.00 H TER 83977 WAT 3574 ATOM 83977 O WAT 3575 88.217 141.573 77.133 1.00 0.00 O ATOM 83978 H1 WAT 3575 88.074 142.445 76.764 1.00 0.00 H ATOM 83979 H2 WAT 3575 87.963 140.972 76.433 1.00 0.00 H TER 83981 WAT 3575 ATOM 83981 O WAT 3576 30.926 140.664 98.023 1.00 0.00 O ATOM 83982 H1 WAT 3576 30.382 139.963 97.665 1.00 0.00 H ATOM 83983 H2 WAT 3576 30.300 141.288 98.391 1.00 0.00 H TER 83985 WAT 3576 ATOM 83985 O WAT 3577 23.746 135.954 103.743 1.00 0.00 O ATOM 83986 H1 WAT 3577 23.945 136.060 102.813 1.00 0.00 H ATOM 83987 H2 WAT 3577 23.845 136.832 104.111 1.00 0.00 H TER 83989 WAT 3577 ATOM 83989 O WAT 3578 141.784 127.289 157.550 1.00 0.00 O ATOM 83990 H1 WAT 3578 142.010 126.534 158.093 1.00 0.00 H ATOM 83991 H2 WAT 3578 142.596 127.504 157.090 1.00 0.00 H TER 83993 WAT 3578 ATOM 83993 O WAT 3579 116.857 11.041 76.576 1.00 0.00 O ATOM 83994 H1 WAT 3579 116.006 10.687 76.835 1.00 0.00 H ATOM 83995 H2 WAT 3579 117.264 10.339 76.068 1.00 0.00 H TER 83997 WAT 3579 ATOM 83997 O WAT 3580 27.592 78.989 66.461 1.00 0.00 O ATOM 83998 H1 WAT 3580 28.195 78.290 66.209 1.00 0.00 H ATOM 83999 H2 WAT 3580 27.669 79.637 65.761 1.00 0.00 H TER 84001 WAT 3580 ATOM 84001 O WAT 3581 34.163 87.896 139.327 1.00 0.00 O ATOM 84002 H1 WAT 3581 34.530 88.699 139.698 1.00 0.00 H ATOM 84003 H2 WAT 3581 33.585 88.199 138.627 1.00 0.00 H TER 84005 WAT 3581 ATOM 84005 O WAT 3582 142.606 140.221 76.667 1.00 0.00 O ATOM 84006 H1 WAT 3582 143.411 139.879 76.279 1.00 0.00 H ATOM 84007 H2 WAT 3582 142.011 140.334 75.925 1.00 0.00 H TER 84009 WAT 3582 ATOM 84009 O WAT 3583 68.408 68.013 89.798 1.00 0.00 O ATOM 84010 H1 WAT 3583 68.123 67.506 89.038 1.00 0.00 H ATOM 84011 H2 WAT 3583 68.016 68.877 89.670 1.00 0.00 H TER 84013 WAT 3583 ATOM 84013 O WAT 3584 117.003 79.282 79.091 1.00 0.00 O ATOM 84014 H1 WAT 3584 117.462 79.130 78.265 1.00 0.00 H ATOM 84015 H2 WAT 3584 116.075 79.231 78.862 1.00 0.00 H TER 84017 WAT 3584 ATOM 84017 O WAT 3585 2.023 58.851 9.805 1.00 0.00 O ATOM 84018 H1 WAT 3585 2.678 58.414 10.348 1.00 0.00 H ATOM 84019 H2 WAT 3585 1.262 58.947 10.377 1.00 0.00 H TER 84021 WAT 3585 ATOM 84021 O WAT 3586 100.528 80.393 85.787 1.00 0.00 O ATOM 84022 H1 WAT 3586 101.262 80.945 85.514 1.00 0.00 H ATOM 84023 H2 WAT 3586 100.009 80.275 84.991 1.00 0.00 H TER 84025 WAT 3586 ATOM 84025 O WAT 3587 98.540 93.895 82.877 1.00 0.00 O ATOM 84026 H1 WAT 3587 98.636 93.112 82.335 1.00 0.00 H ATOM 84027 H2 WAT 3587 99.172 93.774 83.586 1.00 0.00 H TER 84029 WAT 3587 ATOM 84029 O WAT 3588 35.823 77.379 101.982 1.00 0.00 O ATOM 84030 H1 WAT 3588 36.316 78.022 101.473 1.00 0.00 H ATOM 84031 H2 WAT 3588 36.383 76.603 101.994 1.00 0.00 H TER 84033 WAT 3588 ATOM 84033 O WAT 3589 100.912 95.163 115.979 1.00 0.00 O ATOM 84034 H1 WAT 3589 100.837 95.496 115.085 1.00 0.00 H ATOM 84035 H2 WAT 3589 100.280 95.679 116.480 1.00 0.00 H TER 84037 WAT 3589 ATOM 84037 O WAT 3590 139.569 102.836 117.315 1.00 0.00 O ATOM 84038 H1 WAT 3590 140.079 103.646 117.341 1.00 0.00 H ATOM 84039 H2 WAT 3590 138.673 103.111 117.509 1.00 0.00 H TER 84041 WAT 3590 ATOM 84041 O WAT 3591 93.929 49.665 115.647 1.00 0.00 O ATOM 84042 H1 WAT 3591 93.941 48.787 115.268 1.00 0.00 H ATOM 84043 H2 WAT 3591 94.624 49.650 116.306 1.00 0.00 H TER 84045 WAT 3591 ATOM 84045 O WAT 3592 97.439 55.236 8.433 1.00 0.00 O ATOM 84046 H1 WAT 3592 98.026 54.803 9.052 1.00 0.00 H ATOM 84047 H2 WAT 3592 96.821 55.716 8.985 1.00 0.00 H TER 84049 WAT 3592 ATOM 84049 O WAT 3593 85.104 108.665 103.691 1.00 0.00 O ATOM 84050 H1 WAT 3593 84.827 107.933 104.242 1.00 0.00 H ATOM 84051 H2 WAT 3593 84.287 109.046 103.369 1.00 0.00 H TER 84053 WAT 3593 ATOM 84053 O WAT 3594 63.247 93.971 83.591 1.00 0.00 O ATOM 84054 H1 WAT 3594 63.238 93.957 84.548 1.00 0.00 H ATOM 84055 H2 WAT 3594 63.422 93.065 83.339 1.00 0.00 H TER 84057 WAT 3594 ATOM 84057 O WAT 3595 122.901 130.703 21.023 1.00 0.00 O ATOM 84058 H1 WAT 3595 122.490 131.061 20.236 1.00 0.00 H ATOM 84059 H2 WAT 3595 122.168 130.405 21.562 1.00 0.00 H TER 84061 WAT 3595 ATOM 84061 O WAT 3596 18.253 104.017 16.596 1.00 0.00 O ATOM 84062 H1 WAT 3596 17.374 103.916 16.961 1.00 0.00 H ATOM 84063 H2 WAT 3596 18.806 103.463 17.147 1.00 0.00 H TER 84065 WAT 3596 ATOM 84065 O WAT 3597 86.518 64.999 12.081 1.00 0.00 O ATOM 84066 H1 WAT 3597 87.183 65.128 11.405 1.00 0.00 H ATOM 84067 H2 WAT 3597 86.241 64.089 11.974 1.00 0.00 H TER 84069 WAT 3597 ATOM 84069 O WAT 3598 85.377 59.670 155.327 1.00 0.00 O ATOM 84070 H1 WAT 3598 84.769 58.958 155.129 1.00 0.00 H ATOM 84071 H2 WAT 3598 85.629 59.525 156.239 1.00 0.00 H TER 84073 WAT 3598 ATOM 84073 O WAT 3599 59.873 61.945 1.290 1.00 0.00 O ATOM 84074 H1 WAT 3599 60.711 62.401 1.371 1.00 0.00 H ATOM 84075 H2 WAT 3599 59.988 61.141 1.796 1.00 0.00 H TER 84077 WAT 3599 ATOM 84077 O WAT 3600 59.841 128.397 72.139 1.00 0.00 O ATOM 84078 H1 WAT 3600 59.434 129.194 72.479 1.00 0.00 H ATOM 84079 H2 WAT 3600 59.188 127.713 72.289 1.00 0.00 H TER 84081 WAT 3600 ATOM 84081 O WAT 3601 65.772 3.129 105.956 1.00 0.00 O ATOM 84082 H1 WAT 3601 64.838 3.250 106.129 1.00 0.00 H ATOM 84083 H2 WAT 3601 65.880 2.181 105.877 1.00 0.00 H TER 84085 WAT 3601 ATOM 84085 O WAT 3602 134.529 90.612 147.099 1.00 0.00 O ATOM 84086 H1 WAT 3602 133.637 90.412 147.382 1.00 0.00 H ATOM 84087 H2 WAT 3602 134.423 91.009 146.235 1.00 0.00 H TER 84089 WAT 3602 ATOM 84089 O WAT 3603 23.077 95.554 61.243 1.00 0.00 O ATOM 84090 H1 WAT 3603 23.809 95.414 61.844 1.00 0.00 H ATOM 84091 H2 WAT 3603 23.454 95.421 60.373 1.00 0.00 H TER 84093 WAT 3603 ATOM 84093 O WAT 3604 30.846 42.261 154.228 1.00 0.00 O ATOM 84094 H1 WAT 3604 30.134 42.300 154.867 1.00 0.00 H ATOM 84095 H2 WAT 3604 30.416 42.033 153.404 1.00 0.00 H TER 84097 WAT 3604 ATOM 84097 O WAT 3605 139.959 107.629 16.513 1.00 0.00 O ATOM 84098 H1 WAT 3605 139.582 107.240 15.723 1.00 0.00 H ATOM 84099 H2 WAT 3605 140.905 107.569 16.381 1.00 0.00 H TER 84101 WAT 3605 ATOM 84101 O WAT 3606 135.448 75.388 11.441 1.00 0.00 O ATOM 84102 H1 WAT 3606 134.684 74.839 11.620 1.00 0.00 H ATOM 84103 H2 WAT 3606 135.604 75.855 12.261 1.00 0.00 H TER 84105 WAT 3606 ATOM 84105 O WAT 3607 74.584 29.853 23.392 1.00 0.00 O ATOM 84106 H1 WAT 3607 74.314 30.754 23.210 1.00 0.00 H ATOM 84107 H2 WAT 3607 74.087 29.607 24.173 1.00 0.00 H TER 84109 WAT 3607 ATOM 84109 O WAT 3608 129.907 10.486 8.472 1.00 0.00 O ATOM 84110 H1 WAT 3608 129.476 11.144 9.018 1.00 0.00 H ATOM 84111 H2 WAT 3608 129.320 9.730 8.501 1.00 0.00 H TER 84113 WAT 3608 ATOM 84113 O WAT 3609 90.547 80.697 154.122 1.00 0.00 O ATOM 84114 H1 WAT 3609 91.490 80.844 154.042 1.00 0.00 H ATOM 84115 H2 WAT 3609 90.296 81.178 154.910 1.00 0.00 H TER 84117 WAT 3609 ATOM 84117 O WAT 3610 70.362 91.418 117.033 1.00 0.00 O ATOM 84118 H1 WAT 3610 70.889 90.672 117.320 1.00 0.00 H ATOM 84119 H2 WAT 3610 70.608 92.127 117.628 1.00 0.00 H TER 84121 WAT 3610 ATOM 84121 O WAT 3611 41.533 114.164 143.452 1.00 0.00 O ATOM 84122 H1 WAT 3611 41.296 113.250 143.612 1.00 0.00 H ATOM 84123 H2 WAT 3611 40.753 114.660 143.700 1.00 0.00 H TER 84125 WAT 3611 ATOM 84125 O WAT 3612 7.720 107.554 115.823 1.00 0.00 O ATOM 84126 H1 WAT 3612 7.113 108.205 116.175 1.00 0.00 H ATOM 84127 H2 WAT 3612 7.165 106.810 115.589 1.00 0.00 H TER 84129 WAT 3612 ATOM 84129 O WAT 3613 142.700 47.314 22.261 1.00 0.00 O ATOM 84130 H1 WAT 3613 142.373 46.540 21.803 1.00 0.00 H ATOM 84131 H2 WAT 3613 142.564 48.033 21.644 1.00 0.00 H TER 84133 WAT 3613 ATOM 84133 O WAT 3614 99.157 143.366 127.453 1.00 0.00 O ATOM 84134 H1 WAT 3614 98.373 143.164 126.942 1.00 0.00 H ATOM 84135 H2 WAT 3614 99.130 142.750 128.186 1.00 0.00 H TER 84137 WAT 3614 ATOM 84137 O WAT 3615 66.365 114.163 90.329 1.00 0.00 O ATOM 84138 H1 WAT 3615 66.415 114.467 91.235 1.00 0.00 H ATOM 84139 H2 WAT 3615 65.873 114.847 89.873 1.00 0.00 H TER 84141 WAT 3615 ATOM 84141 O WAT 3616 19.269 67.012 109.748 1.00 0.00 O ATOM 84142 H1 WAT 3616 20.090 66.682 110.113 1.00 0.00 H ATOM 84143 H2 WAT 3616 18.613 66.367 110.014 1.00 0.00 H TER 84145 WAT 3616 ATOM 84145 O WAT 3617 121.982 119.794 145.270 1.00 0.00 O ATOM 84146 H1 WAT 3617 121.244 120.122 145.785 1.00 0.00 H ATOM 84147 H2 WAT 3617 122.365 119.105 145.812 1.00 0.00 H TER 84149 WAT 3617 ATOM 84149 O WAT 3618 110.617 110.195 14.449 1.00 0.00 O ATOM 84150 H1 WAT 3618 111.104 110.152 15.272 1.00 0.00 H ATOM 84151 H2 WAT 3618 110.166 111.038 14.481 1.00 0.00 H TER 84153 WAT 3618 ATOM 84153 O WAT 3619 33.179 86.825 22.813 1.00 0.00 O ATOM 84154 H1 WAT 3619 33.582 86.031 22.463 1.00 0.00 H ATOM 84155 H2 WAT 3619 33.670 87.541 22.410 1.00 0.00 H TER 84157 WAT 3619 ATOM 84157 O WAT 3620 105.070 16.829 150.950 1.00 0.00 O ATOM 84158 H1 WAT 3620 106.008 17.002 151.029 1.00 0.00 H ATOM 84159 H2 WAT 3620 104.665 17.696 150.954 1.00 0.00 H TER 84161 WAT 3620 ATOM 84161 O WAT 3621 8.585 91.578 87.100 1.00 0.00 O ATOM 84162 H1 WAT 3621 9.031 91.863 87.898 1.00 0.00 H ATOM 84163 H2 WAT 3621 8.637 92.332 86.513 1.00 0.00 H TER 84165 WAT 3621 ATOM 84165 O WAT 3622 17.238 66.617 0.556 1.00 0.00 O ATOM 84166 H1 WAT 3622 17.573 67.124 -0.184 1.00 0.00 H ATOM 84167 H2 WAT 3622 16.921 65.803 0.164 1.00 0.00 H TER 84169 WAT 3622 ATOM 84169 O WAT 3623 63.843 87.047 157.194 1.00 0.00 O ATOM 84170 H1 WAT 3623 63.387 87.371 157.970 1.00 0.00 H ATOM 84171 H2 WAT 3623 64.749 87.333 157.311 1.00 0.00 H TER 84173 WAT 3623 ATOM 84173 O WAT 3624 14.237 50.758 111.067 1.00 0.00 O ATOM 84174 H1 WAT 3624 13.773 51.580 111.225 1.00 0.00 H ATOM 84175 H2 WAT 3624 13.717 50.315 110.397 1.00 0.00 H TER 84177 WAT 3624 ATOM 84177 O WAT 3625 119.919 122.349 76.954 1.00 0.00 O ATOM 84178 H1 WAT 3625 120.658 122.792 77.373 1.00 0.00 H ATOM 84179 H2 WAT 3625 120.092 121.417 77.087 1.00 0.00 H TER 84181 WAT 3625 ATOM 84181 O WAT 3626 143.696 88.733 5.061 1.00 0.00 O ATOM 84182 H1 WAT 3626 144.601 88.881 5.335 1.00 0.00 H ATOM 84183 H2 WAT 3626 143.219 89.494 5.392 1.00 0.00 H TER 84185 WAT 3626 ATOM 84185 O WAT 3627 49.996 120.301 2.795 1.00 0.00 O ATOM 84186 H1 WAT 3627 49.702 121.162 2.497 1.00 0.00 H ATOM 84187 H2 WAT 3627 50.686 120.490 3.431 1.00 0.00 H TER 84189 WAT 3627 ATOM 84189 O WAT 3628 44.600 4.927 110.914 1.00 0.00 O ATOM 84190 H1 WAT 3628 45.161 5.620 110.564 1.00 0.00 H ATOM 84191 H2 WAT 3628 43.718 5.299 110.893 1.00 0.00 H TER 84193 WAT 3628 ATOM 84193 O WAT 3629 107.169 48.806 121.153 1.00 0.00 O ATOM 84194 H1 WAT 3629 106.902 48.459 122.004 1.00 0.00 H ATOM 84195 H2 WAT 3629 106.397 48.697 120.597 1.00 0.00 H TER 84197 WAT 3629 ATOM 84197 O WAT 3630 75.829 75.466 134.365 1.00 0.00 O ATOM 84198 H1 WAT 3630 75.844 76.037 135.133 1.00 0.00 H ATOM 84199 H2 WAT 3630 75.640 76.052 133.633 1.00 0.00 H TER 84201 WAT 3630 ATOM 84201 O WAT 3631 130.456 136.688 65.116 1.00 0.00 O ATOM 84202 H1 WAT 3631 129.561 136.717 64.778 1.00 0.00 H ATOM 84203 H2 WAT 3631 130.506 135.858 65.591 1.00 0.00 H TER 84205 WAT 3631 ATOM 84205 O WAT 3632 110.568 7.248 141.860 1.00 0.00 O ATOM 84206 H1 WAT 3632 110.289 7.257 142.775 1.00 0.00 H ATOM 84207 H2 WAT 3632 110.551 8.168 141.595 1.00 0.00 H TER 84209 WAT 3632 ATOM 84209 O WAT 3633 65.675 78.000 85.646 1.00 0.00 O ATOM 84210 H1 WAT 3633 64.917 78.029 86.230 1.00 0.00 H ATOM 84211 H2 WAT 3633 65.317 77.724 84.802 1.00 0.00 H TER 84213 WAT 3633 ATOM 84213 O WAT 3634 98.716 46.949 158.047 1.00 0.00 O ATOM 84214 H1 WAT 3634 98.484 46.628 158.918 1.00 0.00 H ATOM 84215 H2 WAT 3634 97.875 47.132 157.627 1.00 0.00 H TER 84217 WAT 3634 ATOM 84217 O WAT 3635 53.002 27.443 128.390 1.00 0.00 O ATOM 84218 H1 WAT 3635 52.600 28.307 128.298 1.00 0.00 H ATOM 84219 H2 WAT 3635 52.534 26.892 127.763 1.00 0.00 H TER 84221 WAT 3635 ATOM 84221 O WAT 3636 67.848 3.725 93.248 1.00 0.00 O ATOM 84222 H1 WAT 3636 68.386 3.027 93.620 1.00 0.00 H ATOM 84223 H2 WAT 3636 67.167 3.878 93.903 1.00 0.00 H TER 84225 WAT 3636 ATOM 84225 O WAT 3637 56.035 0.244 78.880 1.00 0.00 O ATOM 84226 H1 WAT 3637 55.402 -0.157 78.284 1.00 0.00 H ATOM 84227 H2 WAT 3637 55.533 0.427 79.674 1.00 0.00 H TER 84229 WAT 3637 ATOM 84229 O WAT 3638 50.097 12.695 80.997 1.00 0.00 O ATOM 84230 H1 WAT 3638 50.118 13.422 80.375 1.00 0.00 H ATOM 84231 H2 WAT 3638 50.850 12.846 81.568 1.00 0.00 H TER 84233 WAT 3638 ATOM 84233 O WAT 3639 144.248 66.556 124.580 1.00 0.00 O ATOM 84234 H1 WAT 3639 143.730 66.076 123.933 1.00 0.00 H ATOM 84235 H2 WAT 3639 143.791 67.391 124.682 1.00 0.00 H TER 84237 WAT 3639 ATOM 84237 O WAT 3640 10.872 37.071 111.681 1.00 0.00 O ATOM 84238 H1 WAT 3640 10.119 37.565 111.356 1.00 0.00 H ATOM 84239 H2 WAT 3640 10.833 37.175 112.632 1.00 0.00 H TER 84241 WAT 3640 ATOM 84241 O WAT 3641 74.965 2.542 16.841 1.00 0.00 O ATOM 84242 H1 WAT 3641 75.595 2.808 17.511 1.00 0.00 H ATOM 84243 H2 WAT 3641 74.236 2.164 17.334 1.00 0.00 H TER 84245 WAT 3641 ATOM 84245 O WAT 3642 23.275 145.294 65.461 1.00 0.00 O ATOM 84246 H1 WAT 3642 22.433 145.178 65.021 1.00 0.00 H ATOM 84247 H2 WAT 3642 23.899 144.817 64.913 1.00 0.00 H TER 84249 WAT 3642 ATOM 84249 O WAT 3643 33.874 24.627 3.838 1.00 0.00 O ATOM 84250 H1 WAT 3643 34.605 24.611 4.456 1.00 0.00 H ATOM 84251 H2 WAT 3643 33.107 24.818 4.378 1.00 0.00 H TER 84253 WAT 3643 ATOM 84253 O WAT 3644 127.770 70.087 57.023 1.00 0.00 O ATOM 84254 H1 WAT 3644 127.062 70.725 57.114 1.00 0.00 H ATOM 84255 H2 WAT 3644 128.565 70.617 56.979 1.00 0.00 H TER 84257 WAT 3644 ATOM 84257 O WAT 3645 93.511 2.424 71.950 1.00 0.00 O ATOM 84258 H1 WAT 3645 93.302 3.038 71.246 1.00 0.00 H ATOM 84259 H2 WAT 3645 94.435 2.585 72.142 1.00 0.00 H TER 84261 WAT 3645 ATOM 84261 O WAT 3646 108.283 23.187 129.716 1.00 0.00 O ATOM 84262 H1 WAT 3646 107.598 23.425 130.342 1.00 0.00 H ATOM 84263 H2 WAT 3646 107.806 22.895 128.939 1.00 0.00 H TER 84265 WAT 3646 ATOM 84265 O WAT 3647 124.765 33.337 0.701 1.00 0.00 O ATOM 84266 H1 WAT 3647 125.264 34.052 1.095 1.00 0.00 H ATOM 84267 H2 WAT 3647 125.206 33.169 -0.132 1.00 0.00 H TER 84269 WAT 3647 ATOM 84269 O WAT 3648 57.037 104.000 67.116 1.00 0.00 O ATOM 84270 H1 WAT 3648 57.620 104.758 67.066 1.00 0.00 H ATOM 84271 H2 WAT 3648 57.333 103.423 66.412 1.00 0.00 H TER 84273 WAT 3648 ATOM 84273 O WAT 3649 130.655 12.538 86.103 1.00 0.00 O ATOM 84274 H1 WAT 3649 129.717 12.460 85.930 1.00 0.00 H ATOM 84275 H2 WAT 3649 130.739 13.345 86.610 1.00 0.00 H TER 84277 WAT 3649 ATOM 84277 O WAT 3650 110.086 141.411 122.844 1.00 0.00 O ATOM 84278 H1 WAT 3650 110.309 142.009 123.557 1.00 0.00 H ATOM 84279 H2 WAT 3650 110.569 140.609 123.045 1.00 0.00 H TER 84281 WAT 3650 ATOM 84281 O WAT 3651 27.461 87.180 63.811 1.00 0.00 O ATOM 84282 H1 WAT 3651 27.965 86.460 63.432 1.00 0.00 H ATOM 84283 H2 WAT 3651 26.597 87.107 63.405 1.00 0.00 H TER 84285 WAT 3651 ATOM 84285 O WAT 3652 129.678 23.939 7.189 1.00 0.00 O ATOM 84286 H1 WAT 3652 130.093 23.307 7.775 1.00 0.00 H ATOM 84287 H2 WAT 3652 130.251 24.706 7.220 1.00 0.00 H TER 84289 WAT 3652 ATOM 84289 O WAT 3653 34.538 96.793 158.126 1.00 0.00 O ATOM 84290 H1 WAT 3653 34.621 97.230 157.279 1.00 0.00 H ATOM 84291 H2 WAT 3653 35.415 96.840 158.507 1.00 0.00 H TER 84293 WAT 3653 ATOM 84293 O WAT 3654 116.406 112.702 86.488 1.00 0.00 O ATOM 84294 H1 WAT 3654 116.624 111.776 86.384 1.00 0.00 H ATOM 84295 H2 WAT 3654 116.583 113.088 85.630 1.00 0.00 H TER 84297 WAT 3654 ATOM 84297 O WAT 3655 75.479 9.474 6.939 1.00 0.00 O ATOM 84298 H1 WAT 3655 74.734 9.939 7.319 1.00 0.00 H ATOM 84299 H2 WAT 3655 75.089 8.730 6.480 1.00 0.00 H TER 84301 WAT 3655 ATOM 84301 O WAT 3656 54.719 52.284 156.554 1.00 0.00 O ATOM 84302 H1 WAT 3656 55.355 52.669 155.951 1.00 0.00 H ATOM 84303 H2 WAT 3656 53.869 52.467 156.154 1.00 0.00 H TER 84305 WAT 3656 ATOM 84305 O WAT 3657 19.959 113.116 90.813 1.00 0.00 O ATOM 84306 H1 WAT 3657 20.641 112.966 90.159 1.00 0.00 H ATOM 84307 H2 WAT 3657 19.341 112.396 90.684 1.00 0.00 H TER 84309 WAT 3657 ATOM 84309 O WAT 3658 121.396 103.809 62.263 1.00 0.00 O ATOM 84310 H1 WAT 3658 121.524 104.022 61.339 1.00 0.00 H ATOM 84311 H2 WAT 3658 120.941 102.967 62.255 1.00 0.00 H TER 84313 WAT 3658 ATOM 84313 O WAT 3659 11.103 116.278 85.000 1.00 0.00 O ATOM 84314 H1 WAT 3659 11.339 117.178 85.222 1.00 0.00 H ATOM 84315 H2 WAT 3659 10.324 116.363 84.449 1.00 0.00 H TER 84317 WAT 3659 ATOM 84317 O WAT 3660 81.191 67.844 104.171 1.00 0.00 O ATOM 84318 H1 WAT 3660 81.700 68.648 104.271 1.00 0.00 H ATOM 84319 H2 WAT 3660 80.313 68.144 103.937 1.00 0.00 H TER 84321 WAT 3660 ATOM 84321 O WAT 3661 53.458 21.461 107.231 1.00 0.00 O ATOM 84322 H1 WAT 3661 53.647 22.319 107.610 1.00 0.00 H ATOM 84323 H2 WAT 3661 53.565 20.849 107.960 1.00 0.00 H TER 84325 WAT 3661 ATOM 84325 O WAT 3662 86.764 45.795 157.200 1.00 0.00 O ATOM 84326 H1 WAT 3662 85.930 45.907 156.744 1.00 0.00 H ATOM 84327 H2 WAT 3662 87.127 46.679 157.255 1.00 0.00 H TER 84329 WAT 3662 ATOM 84329 O WAT 3663 58.067 96.860 134.017 1.00 0.00 O ATOM 84330 H1 WAT 3663 57.541 96.217 133.542 1.00 0.00 H ATOM 84331 H2 WAT 3663 58.970 96.662 133.768 1.00 0.00 H TER 84333 WAT 3663 ATOM 84333 O WAT 3664 3.054 83.126 67.082 1.00 0.00 O ATOM 84334 H1 WAT 3664 2.792 84.005 67.354 1.00 0.00 H ATOM 84335 H2 WAT 3664 3.828 83.265 66.536 1.00 0.00 H TER 84337 WAT 3664 ATOM 84337 O WAT 3665 13.580 84.492 137.475 1.00 0.00 O ATOM 84338 H1 WAT 3665 14.460 84.774 137.227 1.00 0.00 H ATOM 84339 H2 WAT 3665 13.204 85.250 137.923 1.00 0.00 H TER 84341 WAT 3665 ATOM 84341 O WAT 3666 124.798 54.439 85.760 1.00 0.00 O ATOM 84342 H1 WAT 3666 124.147 54.671 85.097 1.00 0.00 H ATOM 84343 H2 WAT 3666 124.291 54.324 86.563 1.00 0.00 H TER 84345 WAT 3666 ATOM 84345 O WAT 3667 11.739 31.316 109.741 1.00 0.00 O ATOM 84346 H1 WAT 3667 12.491 31.104 110.295 1.00 0.00 H ATOM 84347 H2 WAT 3667 11.503 32.210 109.990 1.00 0.00 H TER 84349 WAT 3667 ATOM 84349 O WAT 3668 134.395 6.861 54.937 1.00 0.00 O ATOM 84350 H1 WAT 3668 133.595 7.272 54.609 1.00 0.00 H ATOM 84351 H2 WAT 3668 134.344 5.957 54.629 1.00 0.00 H TER 84353 WAT 3668 ATOM 84353 O WAT 3669 81.903 8.573 139.871 1.00 0.00 O ATOM 84354 H1 WAT 3669 81.551 7.694 139.732 1.00 0.00 H ATOM 84355 H2 WAT 3669 81.849 8.991 139.012 1.00 0.00 H TER 84357 WAT 3669 ATOM 84357 O WAT 3670 118.196 36.768 146.092 1.00 0.00 O ATOM 84358 H1 WAT 3670 117.862 37.609 146.406 1.00 0.00 H ATOM 84359 H2 WAT 3670 118.167 36.197 146.860 1.00 0.00 H TER 84361 WAT 3670 ATOM 84361 O WAT 3671 115.205 51.670 102.614 1.00 0.00 O ATOM 84362 H1 WAT 3671 115.154 50.729 102.443 1.00 0.00 H ATOM 84363 H2 WAT 3671 114.966 51.758 103.537 1.00 0.00 H TER 84365 WAT 3671 ATOM 84365 O WAT 3672 145.539 107.233 138.715 1.00 0.00 O ATOM 84366 H1 WAT 3672 146.265 107.725 139.099 1.00 0.00 H ATOM 84367 H2 WAT 3672 145.133 107.846 138.101 1.00 0.00 H TER 84369 WAT 3672 ATOM 84369 O WAT 3673 120.624 72.177 128.202 1.00 0.00 O ATOM 84370 H1 WAT 3673 121.161 72.844 127.777 1.00 0.00 H ATOM 84371 H2 WAT 3673 120.871 72.223 129.126 1.00 0.00 H TER 84373 WAT 3673 ATOM 84373 O WAT 3674 114.925 88.313 142.167 1.00 0.00 O ATOM 84374 H1 WAT 3674 115.017 88.056 141.249 1.00 0.00 H ATOM 84375 H2 WAT 3674 114.179 87.804 142.484 1.00 0.00 H TER 84377 WAT 3674 ATOM 84377 O WAT 3675 40.472 116.131 5.949 1.00 0.00 O ATOM 84378 H1 WAT 3675 40.319 115.735 6.807 1.00 0.00 H ATOM 84379 H2 WAT 3675 40.770 117.019 6.145 1.00 0.00 H TER 84381 WAT 3675 ATOM 84381 O WAT 3676 17.884 42.866 66.454 1.00 0.00 O ATOM 84382 H1 WAT 3676 18.236 42.892 67.344 1.00 0.00 H ATOM 84383 H2 WAT 3676 17.765 43.785 66.217 1.00 0.00 H TER 84385 WAT 3676 ATOM 84385 O WAT 3677 46.775 139.481 137.452 1.00 0.00 O ATOM 84386 H1 WAT 3677 45.909 139.082 137.372 1.00 0.00 H ATOM 84387 H2 WAT 3677 47.121 139.484 136.559 1.00 0.00 H TER 84389 WAT 3677 ATOM 84389 O WAT 3678 117.236 13.923 86.017 1.00 0.00 O ATOM 84390 H1 WAT 3678 116.310 13.961 85.777 1.00 0.00 H ATOM 84391 H2 WAT 3678 117.498 14.840 86.104 1.00 0.00 H TER 84393 WAT 3678 ATOM 84393 O WAT 3679 99.273 21.351 2.590 1.00 0.00 O ATOM 84394 H1 WAT 3679 98.488 21.294 3.135 1.00 0.00 H ATOM 84395 H2 WAT 3679 99.127 22.121 2.041 1.00 0.00 H TER 84397 WAT 3679 ATOM 84397 O WAT 3680 18.025 63.214 139.536 1.00 0.00 O ATOM 84398 H1 WAT 3680 17.458 62.809 138.880 1.00 0.00 H ATOM 84399 H2 WAT 3680 17.918 62.669 140.315 1.00 0.00 H TER 84401 WAT 3680 ATOM 84401 O WAT 3681 58.784 111.395 130.276 1.00 0.00 O ATOM 84402 H1 WAT 3681 59.561 110.877 130.066 1.00 0.00 H ATOM 84403 H2 WAT 3681 58.960 112.256 129.897 1.00 0.00 H TER 84405 WAT 3681 ATOM 84405 O WAT 3682 95.718 137.571 146.883 1.00 0.00 O ATOM 84406 H1 WAT 3682 95.340 138.142 146.214 1.00 0.00 H ATOM 84407 H2 WAT 3682 96.585 137.940 147.051 1.00 0.00 H TER 84409 WAT 3682 ATOM 84409 O WAT 3683 95.449 24.595 141.791 1.00 0.00 O ATOM 84410 H1 WAT 3683 95.091 25.155 141.103 1.00 0.00 H ATOM 84411 H2 WAT 3683 96.386 24.788 141.795 1.00 0.00 H TER 84413 WAT 3683 ATOM 84413 O WAT 3684 29.258 93.765 143.295 1.00 0.00 O ATOM 84414 H1 WAT 3684 28.737 94.106 144.022 1.00 0.00 H ATOM 84415 H2 WAT 3684 29.320 94.497 142.682 1.00 0.00 H TER 84417 WAT 3684 ATOM 84417 O WAT 3685 109.584 73.297 17.124 1.00 0.00 O ATOM 84418 H1 WAT 3685 109.879 73.851 16.401 1.00 0.00 H ATOM 84419 H2 WAT 3685 109.750 72.403 16.824 1.00 0.00 H TER 84421 WAT 3685 ATOM 84421 O WAT 3686 68.646 20.084 114.030 1.00 0.00 O ATOM 84422 H1 WAT 3686 68.631 19.481 113.287 1.00 0.00 H ATOM 84423 H2 WAT 3686 69.533 20.443 114.029 1.00 0.00 H TER 84425 WAT 3686 ATOM 84425 O WAT 3687 88.229 53.691 131.441 1.00 0.00 O ATOM 84426 H1 WAT 3687 88.977 53.177 131.742 1.00 0.00 H ATOM 84427 H2 WAT 3687 87.465 53.229 131.788 1.00 0.00 H TER 84429 WAT 3687 ATOM 84429 O WAT 3688 107.003 83.472 136.211 1.00 0.00 O ATOM 84430 H1 WAT 3688 106.348 82.810 136.433 1.00 0.00 H ATOM 84431 H2 WAT 3688 107.050 84.032 136.986 1.00 0.00 H TER 84433 WAT 3688 ATOM 84433 O WAT 3689 76.413 7.834 63.609 1.00 0.00 O ATOM 84434 H1 WAT 3689 76.409 8.682 63.165 1.00 0.00 H ATOM 84435 H2 WAT 3689 77.331 7.562 63.597 1.00 0.00 H TER 84437 WAT 3689 ATOM 84437 O WAT 3690 43.087 22.097 0.512 1.00 0.00 O ATOM 84438 H1 WAT 3690 42.484 22.376 1.201 1.00 0.00 H ATOM 84439 H2 WAT 3690 43.955 22.310 0.853 1.00 0.00 H TER 84441 WAT 3690 ATOM 84441 O WAT 3691 136.078 86.415 27.214 1.00 0.00 O ATOM 84442 H1 WAT 3691 136.298 87.090 27.856 1.00 0.00 H ATOM 84443 H2 WAT 3691 135.177 86.170 27.425 1.00 0.00 H TER 84445 WAT 3691 ATOM 84445 O WAT 3692 101.723 140.179 122.536 1.00 0.00 O ATOM 84446 H1 WAT 3692 101.643 139.399 123.086 1.00 0.00 H ATOM 84447 H2 WAT 3692 101.097 140.036 121.826 1.00 0.00 H TER 84449 WAT 3692 ATOM 84449 O WAT 3693 109.968 90.475 1.927 1.00 0.00 O ATOM 84450 H1 WAT 3693 109.362 91.214 1.871 1.00 0.00 H ATOM 84451 H2 WAT 3693 110.561 90.704 2.642 1.00 0.00 H TER 84453 WAT 3693 ATOM 84453 O WAT 3694 142.950 110.453 157.067 1.00 0.00 O ATOM 84454 H1 WAT 3694 142.060 110.613 157.380 1.00 0.00 H ATOM 84455 H2 WAT 3694 143.407 110.087 157.824 1.00 0.00 H TER 84457 WAT 3694 ATOM 84457 O WAT 3695 60.083 51.712 18.699 1.00 0.00 O ATOM 84458 H1 WAT 3695 59.534 51.091 18.220 1.00 0.00 H ATOM 84459 H2 WAT 3695 60.969 51.358 18.620 1.00 0.00 H TER 84461 WAT 3695 ATOM 84461 O WAT 3696 0.120 69.678 103.457 1.00 0.00 O ATOM 84462 H1 WAT 3696 0.375 70.532 103.108 1.00 0.00 H ATOM 84463 H2 WAT 3696 0.934 69.303 103.791 1.00 0.00 H TER 84465 WAT 3696 ATOM 84465 O WAT 3697 38.219 49.636 1.414 1.00 0.00 O ATOM 84466 H1 WAT 3697 38.586 49.356 0.575 1.00 0.00 H ATOM 84467 H2 WAT 3697 38.947 50.064 1.863 1.00 0.00 H TER 84469 WAT 3697 ATOM 84469 O WAT 3698 84.490 58.228 77.181 1.00 0.00 O ATOM 84470 H1 WAT 3698 84.516 59.048 77.674 1.00 0.00 H ATOM 84471 H2 WAT 3698 85.388 58.106 76.872 1.00 0.00 H TER 84473 WAT 3698 ATOM 84473 O WAT 3699 120.377 25.008 153.087 1.00 0.00 O ATOM 84474 H1 WAT 3699 119.750 25.396 153.698 1.00 0.00 H ATOM 84475 H2 WAT 3699 120.115 25.345 152.230 1.00 0.00 H TER 84477 WAT 3699 ATOM 84477 O WAT 3700 47.059 32.351 101.970 1.00 0.00 O ATOM 84478 H1 WAT 3700 47.703 33.006 102.239 1.00 0.00 H ATOM 84479 H2 WAT 3700 47.159 31.642 102.606 1.00 0.00 H TER 84481 WAT 3700 ATOM 84481 O WAT 3701 17.430 40.973 20.024 1.00 0.00 O ATOM 84482 H1 WAT 3701 18.031 41.067 20.764 1.00 0.00 H ATOM 84483 H2 WAT 3701 17.591 41.748 19.485 1.00 0.00 H TER 84485 WAT 3701 ATOM 84485 O WAT 3702 2.055 54.899 97.947 1.00 0.00 O ATOM 84486 H1 WAT 3702 2.850 54.370 98.008 1.00 0.00 H ATOM 84487 H2 WAT 3702 2.262 55.700 98.427 1.00 0.00 H TER 84489 WAT 3702 ATOM 84489 O WAT 3703 15.802 92.012 75.581 1.00 0.00 O ATOM 84490 H1 WAT 3703 15.792 91.149 75.995 1.00 0.00 H ATOM 84491 H2 WAT 3703 15.312 91.893 74.767 1.00 0.00 H TER 84493 WAT 3703 ATOM 84493 O WAT 3704 48.364 135.137 1.276 1.00 0.00 O ATOM 84494 H1 WAT 3704 49.307 134.975 1.265 1.00 0.00 H ATOM 84495 H2 WAT 3704 48.114 135.160 0.352 1.00 0.00 H TER 84497 WAT 3704 ATOM 84497 O WAT 3705 145.489 92.544 10.955 1.00 0.00 O ATOM 84498 H1 WAT 3705 145.664 91.937 10.236 1.00 0.00 H ATOM 84499 H2 WAT 3705 145.352 91.981 11.716 1.00 0.00 H TER 84501 WAT 3705 ATOM 84501 O WAT 3706 80.380 91.246 150.336 1.00 0.00 O ATOM 84502 H1 WAT 3706 80.084 90.341 150.238 1.00 0.00 H ATOM 84503 H2 WAT 3706 79.666 91.771 149.974 1.00 0.00 H TER 84505 WAT 3706 ATOM 84505 O WAT 3707 86.756 96.755 68.762 1.00 0.00 O ATOM 84506 H1 WAT 3707 87.318 97.162 68.103 1.00 0.00 H ATOM 84507 H2 WAT 3707 86.397 95.981 68.328 1.00 0.00 H TER 84509 WAT 3707 ATOM 84509 O WAT 3708 98.724 116.594 157.471 1.00 0.00 O ATOM 84510 H1 WAT 3708 97.817 116.638 157.165 1.00 0.00 H ATOM 84511 H2 WAT 3708 98.702 115.969 158.195 1.00 0.00 H TER 84513 WAT 3708 ATOM 84513 O WAT 3709 117.442 122.706 82.301 1.00 0.00 O ATOM 84514 H1 WAT 3709 118.005 123.307 81.812 1.00 0.00 H ATOM 84515 H2 WAT 3709 116.926 122.261 81.629 1.00 0.00 H TER 84517 WAT 3709 ATOM 84517 O WAT 3710 113.881 63.794 22.629 1.00 0.00 O ATOM 84518 H1 WAT 3710 114.724 63.499 22.975 1.00 0.00 H ATOM 84519 H2 WAT 3710 113.255 63.136 22.931 1.00 0.00 H TER 84521 WAT 3710 ATOM 84521 O WAT 3711 39.033 135.520 138.776 1.00 0.00 O ATOM 84522 H1 WAT 3711 39.627 135.314 139.498 1.00 0.00 H ATOM 84523 H2 WAT 3711 39.177 136.451 138.605 1.00 0.00 H TER 84525 WAT 3711 ATOM 84525 O WAT 3712 5.252 29.247 90.563 1.00 0.00 O ATOM 84526 H1 WAT 3712 4.707 28.574 90.155 1.00 0.00 H ATOM 84527 H2 WAT 3712 5.309 28.985 91.481 1.00 0.00 H TER 84529 WAT 3712 ATOM 84529 O WAT 3713 144.996 10.221 84.877 1.00 0.00 O ATOM 84530 H1 WAT 3713 145.369 10.144 85.755 1.00 0.00 H ATOM 84531 H2 WAT 3713 145.099 11.146 84.654 1.00 0.00 H TER 84533 WAT 3713 ATOM 84533 O WAT 3714 73.718 40.853 145.186 1.00 0.00 O ATOM 84534 H1 WAT 3714 73.817 41.753 144.873 1.00 0.00 H ATOM 84535 H2 WAT 3714 73.006 40.493 144.657 1.00 0.00 H TER 84537 WAT 3714 ATOM 84537 O WAT 3715 134.016 11.137 89.861 1.00 0.00 O ATOM 84538 H1 WAT 3715 133.848 11.965 89.411 1.00 0.00 H ATOM 84539 H2 WAT 3715 133.235 10.611 89.693 1.00 0.00 H TER 84541 WAT 3715 ATOM 84541 O WAT 3716 34.087 134.575 154.218 1.00 0.00 O ATOM 84542 H1 WAT 3716 34.762 134.704 153.552 1.00 0.00 H ATOM 84543 H2 WAT 3716 34.569 134.298 154.997 1.00 0.00 H TER 84545 WAT 3716 ATOM 84545 O WAT 3717 4.932 120.995 2.582 1.00 0.00 O ATOM 84546 H1 WAT 3717 5.236 121.696 2.006 1.00 0.00 H ATOM 84547 H2 WAT 3717 4.029 121.233 2.795 1.00 0.00 H TER 84549 WAT 3717 ATOM 84549 O WAT 3718 88.107 1.680 157.322 1.00 0.00 O ATOM 84550 H1 WAT 3718 88.592 1.274 158.041 1.00 0.00 H ATOM 84551 H2 WAT 3718 87.230 1.302 157.381 1.00 0.00 H TER 84553 WAT 3718 ATOM 84553 O WAT 3719 54.444 12.404 17.401 1.00 0.00 O ATOM 84554 H1 WAT 3719 53.607 12.112 17.040 1.00 0.00 H ATOM 84555 H2 WAT 3719 55.062 11.714 17.161 1.00 0.00 H TER 84557 WAT 3719 ATOM 84557 O WAT 3720 140.150 3.032 141.215 1.00 0.00 O ATOM 84558 H1 WAT 3720 139.653 2.216 141.157 1.00 0.00 H ATOM 84559 H2 WAT 3720 140.683 3.045 140.420 1.00 0.00 H TER 84561 WAT 3720 ATOM 84561 O WAT 3721 47.464 111.992 93.956 1.00 0.00 O ATOM 84562 H1 WAT 3721 46.793 111.642 93.370 1.00 0.00 H ATOM 84563 H2 WAT 3721 47.377 112.942 93.880 1.00 0.00 H TER 84565 WAT 3721 ATOM 84565 O WAT 3722 24.032 42.575 0.616 1.00 0.00 O ATOM 84566 H1 WAT 3722 23.963 42.726 -0.327 1.00 0.00 H ATOM 84567 H2 WAT 3722 23.426 41.853 0.787 1.00 0.00 H TER 84569 WAT 3722 ATOM 84569 O WAT 3723 91.153 2.211 3.556 1.00 0.00 O ATOM 84570 H1 WAT 3723 91.859 1.570 3.480 1.00 0.00 H ATOM 84571 H2 WAT 3723 90.546 1.826 4.188 1.00 0.00 H TER 84573 WAT 3723 ATOM 84573 O WAT 3724 9.347 48.980 16.976 1.00 0.00 O ATOM 84574 H1 WAT 3724 8.392 48.962 17.034 1.00 0.00 H ATOM 84575 H2 WAT 3724 9.641 49.014 17.886 1.00 0.00 H TER 84577 WAT 3724 ATOM 84577 O WAT 3725 87.702 7.315 15.739 1.00 0.00 O ATOM 84578 H1 WAT 3725 88.129 7.242 16.593 1.00 0.00 H ATOM 84579 H2 WAT 3725 86.832 6.940 15.875 1.00 0.00 H TER 84581 WAT 3725 ATOM 84581 O WAT 3726 40.226 87.068 134.044 1.00 0.00 O ATOM 84582 H1 WAT 3726 41.084 86.865 133.672 1.00 0.00 H ATOM 84583 H2 WAT 3726 39.869 87.744 133.468 1.00 0.00 H TER 84585 WAT 3726 ATOM 84585 O WAT 3727 87.021 112.707 76.987 1.00 0.00 O ATOM 84586 H1 WAT 3727 87.933 112.906 76.776 1.00 0.00 H ATOM 84587 H2 WAT 3727 86.512 113.263 76.397 1.00 0.00 H TER 84589 WAT 3727 ATOM 84589 O WAT 3728 37.972 119.644 140.500 1.00 0.00 O ATOM 84590 H1 WAT 3728 38.593 120.156 139.982 1.00 0.00 H ATOM 84591 H2 WAT 3728 37.625 120.265 141.141 1.00 0.00 H TER 84593 WAT 3728 ATOM 84593 O WAT 3729 101.471 84.632 19.257 1.00 0.00 O ATOM 84594 H1 WAT 3729 100.825 83.939 19.396 1.00 0.00 H ATOM 84595 H2 WAT 3729 102.309 84.172 19.210 1.00 0.00 H TER 84597 WAT 3729 ATOM 84597 O WAT 3730 37.692 123.740 101.303 1.00 0.00 O ATOM 84598 H1 WAT 3730 36.887 124.255 101.364 1.00 0.00 H ATOM 84599 H2 WAT 3730 37.777 123.538 100.371 1.00 0.00 H TER 84601 WAT 3730 ATOM 84601 O WAT 3731 142.873 132.251 133.403 1.00 0.00 O ATOM 84602 H1 WAT 3731 143.620 132.718 133.777 1.00 0.00 H ATOM 84603 H2 WAT 3731 142.140 132.471 133.979 1.00 0.00 H TER 84605 WAT 3731 ATOM 84605 O WAT 3732 96.735 94.744 3.407 1.00 0.00 O ATOM 84606 H1 WAT 3732 96.861 94.482 4.319 1.00 0.00 H ATOM 84607 H2 WAT 3732 97.101 95.627 3.358 1.00 0.00 H TER 84609 WAT 3732 ATOM 84609 O WAT 3733 83.123 82.304 123.973 1.00 0.00 O ATOM 84610 H1 WAT 3733 82.300 82.748 124.174 1.00 0.00 H ATOM 84611 H2 WAT 3733 83.706 82.543 124.694 1.00 0.00 H TER 84613 WAT 3733 ATOM 84613 O WAT 3734 111.463 3.009 139.737 1.00 0.00 O ATOM 84614 H1 WAT 3734 111.301 3.184 140.664 1.00 0.00 H ATOM 84615 H2 WAT 3734 111.139 3.789 139.286 1.00 0.00 H TER 84617 WAT 3734 ATOM 84617 O WAT 3735 8.026 52.668 73.851 1.00 0.00 O ATOM 84618 H1 WAT 3735 8.469 53.516 73.823 1.00 0.00 H ATOM 84619 H2 WAT 3735 7.124 52.861 73.595 1.00 0.00 H TER 84621 WAT 3735 ATOM 84621 O WAT 3736 78.094 107.267 110.103 1.00 0.00 O ATOM 84622 H1 WAT 3736 77.582 107.358 109.299 1.00 0.00 H ATOM 84623 H2 WAT 3736 78.895 106.823 109.827 1.00 0.00 H TER 84625 WAT 3736 ATOM 84625 O WAT 3737 63.267 39.564 158.051 1.00 0.00 O ATOM 84626 H1 WAT 3737 63.354 38.849 158.682 1.00 0.00 H ATOM 84627 H2 WAT 3737 63.776 40.280 158.429 1.00 0.00 H TER 84629 WAT 3737 ATOM 84629 O WAT 3738 45.101 126.686 157.246 1.00 0.00 O ATOM 84630 H1 WAT 3738 44.695 126.082 157.868 1.00 0.00 H ATOM 84631 H2 WAT 3738 45.984 126.824 157.587 1.00 0.00 H TER 84633 WAT 3738 ATOM 84633 O WAT 3739 113.513 7.775 153.326 1.00 0.00 O ATOM 84634 H1 WAT 3739 113.049 8.611 153.289 1.00 0.00 H ATOM 84635 H2 WAT 3739 112.946 7.165 152.853 1.00 0.00 H TER 84637 WAT 3739 ATOM 84637 O WAT 3740 139.488 139.468 63.428 1.00 0.00 O ATOM 84638 H1 WAT 3740 139.257 138.628 63.033 1.00 0.00 H ATOM 84639 H2 WAT 3740 140.439 139.526 63.331 1.00 0.00 H TER 84641 WAT 3740 ATOM 84641 O WAT 3741 12.292 65.175 116.625 1.00 0.00 O ATOM 84642 H1 WAT 3741 11.791 64.811 115.895 1.00 0.00 H ATOM 84643 H2 WAT 3741 12.800 65.887 116.236 1.00 0.00 H TER 84645 WAT 3741 ATOM 84645 O WAT 3742 33.678 76.033 66.330 1.00 0.00 O ATOM 84646 H1 WAT 3742 33.045 75.328 66.465 1.00 0.00 H ATOM 84647 H2 WAT 3742 33.206 76.828 66.578 1.00 0.00 H TER 84649 WAT 3742 ATOM 84649 O WAT 3743 45.404 46.704 80.208 1.00 0.00 O ATOM 84650 H1 WAT 3743 44.661 47.230 79.913 1.00 0.00 H ATOM 84651 H2 WAT 3743 45.036 45.833 80.356 1.00 0.00 H TER 84653 WAT 3743 ATOM 84653 O WAT 3744 91.526 142.829 75.311 1.00 0.00 O ATOM 84654 H1 WAT 3744 92.406 142.746 75.679 1.00 0.00 H ATOM 84655 H2 WAT 3744 91.347 143.769 75.329 1.00 0.00 H TER 84657 WAT 3744 ATOM 84657 O WAT 3745 139.509 46.955 146.587 1.00 0.00 O ATOM 84658 H1 WAT 3745 138.615 47.290 146.522 1.00 0.00 H ATOM 84659 H2 WAT 3745 139.415 46.095 146.997 1.00 0.00 H TER 84661 WAT 3745 ATOM 84661 O WAT 3746 116.732 35.606 10.680 1.00 0.00 O ATOM 84662 H1 WAT 3746 117.527 36.066 10.949 1.00 0.00 H ATOM 84663 H2 WAT 3746 117.046 34.881 10.139 1.00 0.00 H TER 84665 WAT 3746 ATOM 84665 O WAT 3747 138.488 108.029 130.451 1.00 0.00 O ATOM 84666 H1 WAT 3747 138.925 107.996 131.303 1.00 0.00 H ATOM 84667 H2 WAT 3747 137.866 107.302 130.473 1.00 0.00 H TER 84669 WAT 3747 ATOM 84669 O WAT 3748 45.141 134.908 141.023 1.00 0.00 O ATOM 84670 H1 WAT 3748 44.731 134.762 141.876 1.00 0.00 H ATOM 84671 H2 WAT 3748 44.593 134.422 140.408 1.00 0.00 H TER 84673 WAT 3748 ATOM 84673 O WAT 3749 41.375 25.786 150.755 1.00 0.00 O ATOM 84674 H1 WAT 3749 41.461 25.078 151.394 1.00 0.00 H ATOM 84675 H2 WAT 3749 42.271 25.959 150.467 1.00 0.00 H TER 84677 WAT 3749 ATOM 84677 O WAT 3750 34.345 96.683 81.375 1.00 0.00 O ATOM 84678 H1 WAT 3750 34.936 97.075 80.731 1.00 0.00 H ATOM 84679 H2 WAT 3750 33.517 97.146 81.253 1.00 0.00 H TER 84681 WAT 3750 ATOM 84681 O WAT 3751 23.569 40.083 25.630 1.00 0.00 O ATOM 84682 H1 WAT 3751 23.550 40.428 24.737 1.00 0.00 H ATOM 84683 H2 WAT 3751 22.818 40.493 26.060 1.00 0.00 H TER 84685 WAT 3751 ATOM 84685 O WAT 3752 40.840 131.967 125.151 1.00 0.00 O ATOM 84686 H1 WAT 3752 39.919 131.732 125.039 1.00 0.00 H ATOM 84687 H2 WAT 3752 41.295 131.485 124.461 1.00 0.00 H TER 84689 WAT 3752 ATOM 84689 O WAT 3753 65.349 100.032 146.638 1.00 0.00 O ATOM 84690 H1 WAT 3753 64.512 99.691 146.324 1.00 0.00 H ATOM 84691 H2 WAT 3753 65.980 99.772 145.967 1.00 0.00 H TER 84693 WAT 3753 ATOM 84693 O WAT 3754 119.086 77.941 10.211 1.00 0.00 O ATOM 84694 H1 WAT 3754 118.500 78.463 9.663 1.00 0.00 H ATOM 84695 H2 WAT 3754 118.623 77.856 11.044 1.00 0.00 H TER 84697 WAT 3754 ATOM 84697 O WAT 3755 41.508 92.717 110.015 1.00 0.00 O ATOM 84698 H1 WAT 3755 41.688 92.970 109.109 1.00 0.00 H ATOM 84699 H2 WAT 3755 40.577 92.903 110.135 1.00 0.00 H TER 84701 WAT 3755 ATOM 84701 O WAT 3756 38.471 106.016 113.614 1.00 0.00 O ATOM 84702 H1 WAT 3756 37.852 106.189 112.905 1.00 0.00 H ATOM 84703 H2 WAT 3756 39.217 105.596 113.183 1.00 0.00 H TER 84705 WAT 3756 ATOM 84705 O WAT 3757 96.000 135.858 131.010 1.00 0.00 O ATOM 84706 H1 WAT 3757 96.950 135.760 131.063 1.00 0.00 H ATOM 84707 H2 WAT 3757 95.755 135.396 130.208 1.00 0.00 H TER 84709 WAT 3757 ATOM 84709 O WAT 3758 9.325 15.278 73.035 1.00 0.00 O ATOM 84710 H1 WAT 3758 9.020 15.745 72.258 1.00 0.00 H ATOM 84711 H2 WAT 3758 10.268 15.442 73.058 1.00 0.00 H TER 84713 WAT 3758 ATOM 84713 O WAT 3759 117.578 102.298 62.957 1.00 0.00 O ATOM 84714 H1 WAT 3759 117.019 101.522 63.002 1.00 0.00 H ATOM 84715 H2 WAT 3759 118.399 101.980 62.580 1.00 0.00 H TER 84717 WAT 3759 ATOM 84717 O WAT 3760 87.433 142.921 121.142 1.00 0.00 O ATOM 84718 H1 WAT 3760 87.071 143.726 121.512 1.00 0.00 H ATOM 84719 H2 WAT 3760 86.768 142.256 121.318 1.00 0.00 H TER 84721 WAT 3760 ATOM 84721 O WAT 3761 90.185 33.716 67.486 1.00 0.00 O ATOM 84722 H1 WAT 3761 90.822 33.710 66.773 1.00 0.00 H ATOM 84723 H2 WAT 3761 89.388 34.072 67.093 1.00 0.00 H TER 84725 WAT 3761 ATOM 84725 O WAT 3762 70.880 11.350 85.213 1.00 0.00 O ATOM 84726 H1 WAT 3762 70.744 11.428 84.268 1.00 0.00 H ATOM 84727 H2 WAT 3762 71.714 11.793 85.372 1.00 0.00 H TER 84729 WAT 3762 ATOM 84729 O WAT 3763 142.596 82.727 75.085 1.00 0.00 O ATOM 84730 H1 WAT 3763 142.350 83.000 74.201 1.00 0.00 H ATOM 84731 H2 WAT 3763 141.830 82.934 75.621 1.00 0.00 H TER 84733 WAT 3763 ATOM 84733 O WAT 3764 65.525 125.161 157.795 1.00 0.00 O ATOM 84734 H1 WAT 3764 66.190 124.683 157.300 1.00 0.00 H ATOM 84735 H2 WAT 3764 65.441 125.998 157.337 1.00 0.00 H TER 84737 WAT 3764 ATOM 84737 O WAT 3765 29.997 143.918 130.874 1.00 0.00 O ATOM 84738 H1 WAT 3765 30.136 143.210 130.245 1.00 0.00 H ATOM 84739 H2 WAT 3765 30.181 144.717 130.380 1.00 0.00 H TER 84741 WAT 3765 ATOM 84741 O WAT 3766 110.084 125.893 151.559 1.00 0.00 O ATOM 84742 H1 WAT 3766 110.519 125.249 152.118 1.00 0.00 H ATOM 84743 H2 WAT 3766 110.227 126.730 152.000 1.00 0.00 H TER 84745 WAT 3766 ATOM 84745 O WAT 3767 26.480 141.732 11.934 1.00 0.00 O ATOM 84746 H1 WAT 3767 25.807 141.225 11.479 1.00 0.00 H ATOM 84747 H2 WAT 3767 26.665 142.466 11.347 1.00 0.00 H TER 84749 WAT 3767 ATOM 84749 O WAT 3768 75.494 29.027 3.229 1.00 0.00 O ATOM 84750 H1 WAT 3768 74.698 28.989 3.759 1.00 0.00 H ATOM 84751 H2 WAT 3768 76.194 29.202 3.859 1.00 0.00 H TER 84753 WAT 3768 ATOM 84753 O WAT 3769 26.100 90.106 93.526 1.00 0.00 O ATOM 84754 H1 WAT 3769 25.708 90.636 92.832 1.00 0.00 H ATOM 84755 H2 WAT 3769 26.850 89.683 93.110 1.00 0.00 H TER 84757 WAT 3769 ATOM 84757 O WAT 3770 123.671 112.896 10.999 1.00 0.00 O ATOM 84758 H1 WAT 3770 124.288 113.325 10.406 1.00 0.00 H ATOM 84759 H2 WAT 3770 124.168 112.761 11.805 1.00 0.00 H TER 84761 WAT 3770 ATOM 84761 O WAT 3771 11.890 119.707 134.417 1.00 0.00 O ATOM 84762 H1 WAT 3771 12.077 119.576 135.347 1.00 0.00 H ATOM 84763 H2 WAT 3771 11.409 120.534 134.384 1.00 0.00 H TER 84765 WAT 3771 ATOM 84765 O WAT 3772 78.899 145.379 58.813 1.00 0.00 O ATOM 84766 H1 WAT 3772 78.844 146.314 59.007 1.00 0.00 H ATOM 84767 H2 WAT 3772 79.806 145.146 59.010 1.00 0.00 H TER 84769 WAT 3772 ATOM 84769 O WAT 3773 4.859 49.648 138.893 1.00 0.00 O ATOM 84770 H1 WAT 3773 4.032 49.225 138.661 1.00 0.00 H ATOM 84771 H2 WAT 3773 4.652 50.169 139.669 1.00 0.00 H TER 84773 WAT 3773 ATOM 84773 O WAT 3774 27.333 91.853 61.136 1.00 0.00 O ATOM 84774 H1 WAT 3774 26.886 91.537 60.351 1.00 0.00 H ATOM 84775 H2 WAT 3774 27.601 91.057 61.596 1.00 0.00 H TER 84777 WAT 3774 ATOM 84777 O WAT 3775 136.958 118.099 102.209 1.00 0.00 O ATOM 84778 H1 WAT 3775 136.906 118.913 101.709 1.00 0.00 H ATOM 84779 H2 WAT 3775 137.011 117.413 101.543 1.00 0.00 H TER 84781 WAT 3775 ATOM 84781 O WAT 3776 60.020 36.516 55.352 1.00 0.00 O ATOM 84782 H1 WAT 3776 59.963 37.470 55.300 1.00 0.00 H ATOM 84783 H2 WAT 3776 59.435 36.203 54.662 1.00 0.00 H TER 84785 WAT 3776 ATOM 84785 O WAT 3777 50.348 70.693 20.158 1.00 0.00 O ATOM 84786 H1 WAT 3777 49.784 70.343 19.469 1.00 0.00 H ATOM 84787 H2 WAT 3777 49.934 70.411 20.974 1.00 0.00 H TER 84789 WAT 3777 ATOM 84789 O WAT 3778 18.186 94.931 61.373 1.00 0.00 O ATOM 84790 H1 WAT 3778 17.474 95.331 60.873 1.00 0.00 H ATOM 84791 H2 WAT 3778 18.013 93.991 61.327 1.00 0.00 H TER 84793 WAT 3778 ATOM 84793 O WAT 3779 84.384 138.738 86.722 1.00 0.00 O ATOM 84794 H1 WAT 3779 85.054 138.063 86.611 1.00 0.00 H ATOM 84795 H2 WAT 3779 84.419 139.246 85.912 1.00 0.00 H TER 84797 WAT 3779 ATOM 84797 O WAT 3780 121.979 122.396 0.349 1.00 0.00 O ATOM 84798 H1 WAT 3780 122.334 121.518 0.492 1.00 0.00 H ATOM 84799 H2 WAT 3780 121.049 122.253 0.174 1.00 0.00 H TER 84801 WAT 3780 ATOM 84801 O WAT 3781 88.318 119.300 79.224 1.00 0.00 O ATOM 84802 H1 WAT 3781 87.505 119.649 79.588 1.00 0.00 H ATOM 84803 H2 WAT 3781 88.364 119.669 78.342 1.00 0.00 H TER 84805 WAT 3781 ATOM 84805 O WAT 3782 137.764 134.517 101.417 1.00 0.00 O ATOM 84806 H1 WAT 3782 137.503 134.479 100.497 1.00 0.00 H ATOM 84807 H2 WAT 3782 137.007 134.892 101.866 1.00 0.00 H TER 84809 WAT 3782 ATOM 84809 O WAT 3783 49.007 130.007 112.543 1.00 0.00 O ATOM 84810 H1 WAT 3783 48.884 129.257 111.960 1.00 0.00 H ATOM 84811 H2 WAT 3783 48.303 129.927 113.187 1.00 0.00 H TER 84813 WAT 3783 ATOM 84813 O WAT 3784 41.533 66.902 152.057 1.00 0.00 O ATOM 84814 H1 WAT 3784 40.834 66.353 152.413 1.00 0.00 H ATOM 84815 H2 WAT 3784 41.138 67.771 151.978 1.00 0.00 H TER 84817 WAT 3784 ATOM 84817 O WAT 3785 12.108 121.796 127.953 1.00 0.00 O ATOM 84818 H1 WAT 3785 11.982 121.104 127.304 1.00 0.00 H ATOM 84819 H2 WAT 3785 12.636 121.388 128.639 1.00 0.00 H TER 84821 WAT 3785 ATOM 84821 O WAT 3786 71.512 55.176 122.311 1.00 0.00 O ATOM 84822 H1 WAT 3786 71.858 55.816 121.690 1.00 0.00 H ATOM 84823 H2 WAT 3786 71.340 54.397 121.782 1.00 0.00 H TER 84825 WAT 3786 ATOM 84825 O WAT 3787 112.572 120.294 74.559 1.00 0.00 O ATOM 84826 H1 WAT 3787 111.650 120.060 74.457 1.00 0.00 H ATOM 84827 H2 WAT 3787 112.651 121.147 74.131 1.00 0.00 H TER 84829 WAT 3787 ATOM 84829 O WAT 3788 87.571 54.430 142.229 1.00 0.00 O ATOM 84830 H1 WAT 3788 86.957 53.942 142.778 1.00 0.00 H ATOM 84831 H2 WAT 3788 88.216 53.779 141.954 1.00 0.00 H TER 84833 WAT 3788 ATOM 84833 O WAT 3789 79.834 121.789 132.276 1.00 0.00 O ATOM 84834 H1 WAT 3789 80.681 121.867 131.837 1.00 0.00 H ATOM 84835 H2 WAT 3789 79.712 122.632 132.713 1.00 0.00 H TER 84837 WAT 3789 ATOM 84837 O WAT 3790 18.451 26.545 69.117 1.00 0.00 O ATOM 84838 H1 WAT 3790 19.349 26.481 68.792 1.00 0.00 H ATOM 84839 H2 WAT 3790 17.919 26.669 68.331 1.00 0.00 H TER 84841 WAT 3790 ATOM 84841 O WAT 3791 30.595 47.697 7.808 1.00 0.00 O ATOM 84842 H1 WAT 3791 31.179 47.779 7.054 1.00 0.00 H ATOM 84843 H2 WAT 3791 29.717 47.816 7.445 1.00 0.00 H TER 84845 WAT 3791 ATOM 84845 O WAT 3792 39.547 118.177 110.134 1.00 0.00 O ATOM 84846 H1 WAT 3792 39.134 118.736 109.477 1.00 0.00 H ATOM 84847 H2 WAT 3792 38.911 118.137 110.848 1.00 0.00 H TER 84849 WAT 3792 ATOM 84849 O WAT 3793 27.996 107.538 67.068 1.00 0.00 O ATOM 84850 H1 WAT 3793 27.532 107.393 67.893 1.00 0.00 H ATOM 84851 H2 WAT 3793 28.922 107.504 67.305 1.00 0.00 H TER 84853 WAT 3793 ATOM 84853 O WAT 3794 128.712 42.510 107.055 1.00 0.00 O ATOM 84854 H1 WAT 3794 128.476 43.174 106.407 1.00 0.00 H ATOM 84855 H2 WAT 3794 129.289 42.968 107.666 1.00 0.00 H TER 84857 WAT 3794 ATOM 84857 O WAT 3795 87.123 32.929 3.044 1.00 0.00 O ATOM 84858 H1 WAT 3795 86.739 32.116 2.715 1.00 0.00 H ATOM 84859 H2 WAT 3795 88.048 32.721 3.172 1.00 0.00 H TER 84861 WAT 3795 ATOM 84861 O WAT 3796 25.661 94.647 149.846 1.00 0.00 O ATOM 84862 H1 WAT 3796 26.455 94.113 149.867 1.00 0.00 H ATOM 84863 H2 WAT 3796 25.903 95.416 149.330 1.00 0.00 H TER 84865 WAT 3796 ATOM 84865 O WAT 3797 85.349 133.243 123.352 1.00 0.00 O ATOM 84866 H1 WAT 3797 85.827 133.903 122.850 1.00 0.00 H ATOM 84867 H2 WAT 3797 86.001 132.567 123.540 1.00 0.00 H TER 84869 WAT 3797 ATOM 84869 O WAT 3798 117.299 20.953 155.530 1.00 0.00 O ATOM 84870 H1 WAT 3798 117.144 21.004 154.587 1.00 0.00 H ATOM 84871 H2 WAT 3798 117.402 20.018 155.706 1.00 0.00 H TER 84873 WAT 3798 ATOM 84873 O WAT 3799 7.724 81.221 65.242 1.00 0.00 O ATOM 84874 H1 WAT 3799 8.009 80.310 65.324 1.00 0.00 H ATOM 84875 H2 WAT 3799 7.983 81.474 64.356 1.00 0.00 H TER 84877 WAT 3799 ATOM 84877 O WAT 3800 114.299 75.398 85.507 1.00 0.00 O ATOM 84878 H1 WAT 3800 115.115 75.216 85.042 1.00 0.00 H ATOM 84879 H2 WAT 3800 114.117 74.595 85.996 1.00 0.00 H TER 84881 WAT 3800 ATOM 84881 O WAT 3801 74.302 140.815 5.663 1.00 0.00 O ATOM 84882 H1 WAT 3801 74.253 141.769 5.601 1.00 0.00 H ATOM 84883 H2 WAT 3801 75.159 140.643 6.052 1.00 0.00 H TER 84885 WAT 3801 ATOM 84885 O WAT 3802 68.308 122.938 9.963 1.00 0.00 O ATOM 84886 H1 WAT 3802 67.365 122.859 9.819 1.00 0.00 H ATOM 84887 H2 WAT 3802 68.407 122.917 10.915 1.00 0.00 H TER 84889 WAT 3802 ATOM 84889 O WAT 3803 20.646 105.831 151.884 1.00 0.00 O ATOM 84890 H1 WAT 3803 20.030 106.560 151.964 1.00 0.00 H ATOM 84891 H2 WAT 3803 21.327 106.022 152.530 1.00 0.00 H TER 84893 WAT 3803 ATOM 84893 O WAT 3804 -0.090 92.726 83.421 1.00 0.00 O ATOM 84894 H1 WAT 3804 0.749 92.699 82.961 1.00 0.00 H ATOM 84895 H2 WAT 3804 -0.123 93.601 83.808 1.00 0.00 H TER 84897 WAT 3804 ATOM 84897 O WAT 3805 138.756 84.085 127.361 1.00 0.00 O ATOM 84898 H1 WAT 3805 138.939 85.024 127.407 1.00 0.00 H ATOM 84899 H2 WAT 3805 138.613 83.824 128.271 1.00 0.00 H TER 84901 WAT 3805 ATOM 84901 O WAT 3806 66.964 31.133 119.409 1.00 0.00 O ATOM 84902 H1 WAT 3806 67.789 31.598 119.266 1.00 0.00 H ATOM 84903 H2 WAT 3806 67.220 30.317 119.838 1.00 0.00 H TER 84905 WAT 3806 ATOM 84905 O WAT 3807 51.727 130.093 79.459 1.00 0.00 O ATOM 84906 H1 WAT 3807 52.069 129.215 79.288 1.00 0.00 H ATOM 84907 H2 WAT 3807 50.907 129.943 79.929 1.00 0.00 H TER 84909 WAT 3807 ATOM 84909 O WAT 3808 77.806 31.653 93.314 1.00 0.00 O ATOM 84910 H1 WAT 3808 76.862 31.657 93.159 1.00 0.00 H ATOM 84911 H2 WAT 3808 77.940 30.959 93.959 1.00 0.00 H TER 84913 WAT 3808 ATOM 84913 O WAT 3809 94.952 95.278 122.356 1.00 0.00 O ATOM 84914 H1 WAT 3809 95.529 94.546 122.138 1.00 0.00 H ATOM 84915 H2 WAT 3809 94.120 94.867 122.589 1.00 0.00 H TER 84917 WAT 3809 ATOM 84917 O WAT 3810 119.185 114.617 69.262 1.00 0.00 O ATOM 84918 H1 WAT 3810 119.151 115.492 68.876 1.00 0.00 H ATOM 84919 H2 WAT 3810 118.681 114.070 68.659 1.00 0.00 H TER 84921 WAT 3810 ATOM 84921 O WAT 3811 63.698 81.570 77.869 1.00 0.00 O ATOM 84922 H1 WAT 3811 62.748 81.678 77.910 1.00 0.00 H ATOM 84923 H2 WAT 3811 63.843 81.018 77.101 1.00 0.00 H TER 84925 WAT 3811 ATOM 84925 O WAT 3812 143.867 49.572 145.828 1.00 0.00 O ATOM 84926 H1 WAT 3812 144.250 49.793 144.979 1.00 0.00 H ATOM 84927 H2 WAT 3812 142.931 49.736 145.718 1.00 0.00 H TER 84929 WAT 3812 ATOM 84929 O WAT 3813 98.620 37.838 63.723 1.00 0.00 O ATOM 84930 H1 WAT 3813 98.066 37.457 63.042 1.00 0.00 H ATOM 84931 H2 WAT 3813 99.149 38.490 63.264 1.00 0.00 H TER 84933 WAT 3813 ATOM 84933 O WAT 3814 96.601 67.962 113.320 1.00 0.00 O ATOM 84934 H1 WAT 3814 96.309 68.448 114.091 1.00 0.00 H ATOM 84935 H2 WAT 3814 95.881 67.360 113.130 1.00 0.00 H TER 84937 WAT 3814 ATOM 84937 O WAT 3815 90.226 108.185 57.230 1.00 0.00 O ATOM 84938 H1 WAT 3815 91.005 107.706 56.948 1.00 0.00 H ATOM 84939 H2 WAT 3815 89.498 107.727 56.810 1.00 0.00 H TER 84941 WAT 3815 ATOM 84941 O WAT 3816 83.695 102.190 132.977 1.00 0.00 O ATOM 84942 H1 WAT 3816 83.743 103.087 133.306 1.00 0.00 H ATOM 84943 H2 WAT 3816 83.862 102.269 132.038 1.00 0.00 H TER 84945 WAT 3816 ATOM 84945 O WAT 3817 122.087 79.277 129.374 1.00 0.00 O ATOM 84946 H1 WAT 3817 122.077 80.018 129.980 1.00 0.00 H ATOM 84947 H2 WAT 3817 122.703 79.536 128.689 1.00 0.00 H TER 84949 WAT 3817 ATOM 84949 O WAT 3818 20.397 93.934 111.705 1.00 0.00 O ATOM 84950 H1 WAT 3818 19.689 93.706 112.308 1.00 0.00 H ATOM 84951 H2 WAT 3818 20.520 94.875 111.825 1.00 0.00 H TER 84953 WAT 3818 ATOM 84953 O WAT 3819 104.868 115.570 128.981 1.00 0.00 O ATOM 84954 H1 WAT 3819 104.631 116.429 129.332 1.00 0.00 H ATOM 84955 H2 WAT 3819 105.135 115.063 129.748 1.00 0.00 H TER 84957 WAT 3819 ATOM 84957 O WAT 3820 71.793 12.595 81.543 1.00 0.00 O ATOM 84958 H1 WAT 3820 71.947 12.009 80.802 1.00 0.00 H ATOM 84959 H2 WAT 3820 72.625 12.606 82.017 1.00 0.00 H TER 84961 WAT 3820 ATOM 84961 O WAT 3821 104.711 53.616 14.930 1.00 0.00 O ATOM 84962 H1 WAT 3821 105.191 54.060 15.629 1.00 0.00 H ATOM 84963 H2 WAT 3821 103.900 54.115 14.842 1.00 0.00 H TER 84965 WAT 3821 ATOM 84965 O WAT 3822 100.637 76.935 68.496 1.00 0.00 O ATOM 84966 H1 WAT 3822 99.761 77.314 68.431 1.00 0.00 H ATOM 84967 H2 WAT 3822 101.125 77.334 67.776 1.00 0.00 H TER 84969 WAT 3822 ATOM 84969 O WAT 3823 103.350 97.927 148.671 1.00 0.00 O ATOM 84970 H1 WAT 3823 103.073 98.463 147.928 1.00 0.00 H ATOM 84971 H2 WAT 3823 103.190 98.478 149.437 1.00 0.00 H TER 84973 WAT 3823 ATOM 84973 O WAT 3824 4.440 79.645 18.757 1.00 0.00 O ATOM 84974 H1 WAT 3824 4.377 80.248 19.497 1.00 0.00 H ATOM 84975 H2 WAT 3824 3.825 78.942 18.967 1.00 0.00 H TER 84977 WAT 3824 ATOM 84977 O WAT 3825 69.537 116.554 125.064 1.00 0.00 O ATOM 84978 H1 WAT 3825 69.158 116.654 124.190 1.00 0.00 H ATOM 84979 H2 WAT 3825 70.020 115.729 125.022 1.00 0.00 H TER 84981 WAT 3825 ATOM 84981 O WAT 3826 53.891 122.162 81.020 1.00 0.00 O ATOM 84982 H1 WAT 3826 53.323 122.660 81.609 1.00 0.00 H ATOM 84983 H2 WAT 3826 54.511 121.722 81.601 1.00 0.00 H TER 84985 WAT 3826 ATOM 84985 O WAT 3827 79.422 42.330 6.308 1.00 0.00 O ATOM 84986 H1 WAT 3827 79.109 43.234 6.270 1.00 0.00 H ATOM 84987 H2 WAT 3827 79.373 42.022 5.403 1.00 0.00 H TER 84989 WAT 3827 ATOM 84989 O WAT 3828 22.529 145.103 118.674 1.00 0.00 O ATOM 84990 H1 WAT 3828 22.838 145.978 118.905 1.00 0.00 H ATOM 84991 H2 WAT 3828 21.626 145.236 118.385 1.00 0.00 H TER 84993 WAT 3828 ATOM 84993 O WAT 3829 137.441 84.656 66.217 1.00 0.00 O ATOM 84994 H1 WAT 3829 138.362 84.824 66.414 1.00 0.00 H ATOM 84995 H2 WAT 3829 137.274 85.147 65.413 1.00 0.00 H TER 84997 WAT 3829 ATOM 84997 O WAT 3830 72.255 65.800 90.363 1.00 0.00 O ATOM 84998 H1 WAT 3830 71.449 65.769 90.879 1.00 0.00 H ATOM 84999 H2 WAT 3830 72.365 66.726 90.147 1.00 0.00 H TER 85001 WAT 3830 ATOM 85001 O WAT 3831 106.250 15.246 126.233 1.00 0.00 O ATOM 85002 H1 WAT 3831 106.230 16.011 126.808 1.00 0.00 H ATOM 85003 H2 WAT 3831 106.283 14.498 126.829 1.00 0.00 H TER 85005 WAT 3831 ATOM 85005 O WAT 3832 136.240 63.258 97.448 1.00 0.00 O ATOM 85006 H1 WAT 3832 136.929 63.581 96.866 1.00 0.00 H ATOM 85007 H2 WAT 3832 135.500 63.845 97.291 1.00 0.00 H TER 85009 WAT 3832 ATOM 85009 O WAT 3833 53.687 3.853 9.817 1.00 0.00 O ATOM 85010 H1 WAT 3833 53.126 4.239 10.489 1.00 0.00 H ATOM 85011 H2 WAT 3833 53.076 3.503 9.168 1.00 0.00 H TER 85013 WAT 3833 ATOM 85013 O WAT 3834 35.311 39.771 96.519 1.00 0.00 O ATOM 85014 H1 WAT 3834 34.898 38.918 96.656 1.00 0.00 H ATOM 85015 H2 WAT 3834 34.863 40.135 95.756 1.00 0.00 H TER 85017 WAT 3834 ATOM 85017 O WAT 3835 121.249 53.448 136.115 1.00 0.00 O ATOM 85018 H1 WAT 3835 120.531 54.076 136.037 1.00 0.00 H ATOM 85019 H2 WAT 3835 121.947 53.813 135.571 1.00 0.00 H TER 85021 WAT 3835 ATOM 85021 O WAT 3836 117.120 138.906 11.206 1.00 0.00 O ATOM 85022 H1 WAT 3836 116.920 138.483 12.041 1.00 0.00 H ATOM 85023 H2 WAT 3836 118.013 139.234 11.312 1.00 0.00 H TER 85025 WAT 3836 ATOM 85025 O WAT 3837 87.851 90.939 88.411 1.00 0.00 O ATOM 85026 H1 WAT 3837 87.470 91.180 89.255 1.00 0.00 H ATOM 85027 H2 WAT 3837 88.704 91.372 88.400 1.00 0.00 H TER 85029 WAT 3837 ATOM 85029 O WAT 3838 61.128 106.276 140.124 1.00 0.00 O ATOM 85030 H1 WAT 3838 60.828 107.168 140.298 1.00 0.00 H ATOM 85031 H2 WAT 3838 61.984 106.387 139.710 1.00 0.00 H TER 85033 WAT 3838 ATOM 85033 O WAT 3839 145.626 0.302 143.938 1.00 0.00 O ATOM 85034 H1 WAT 3839 146.495 0.693 143.851 1.00 0.00 H ATOM 85035 H2 WAT 3839 145.446 0.322 144.878 1.00 0.00 H TER 85037 WAT 3839 ATOM 85037 O WAT 3840 38.423 144.800 92.220 1.00 0.00 O ATOM 85038 H1 WAT 3840 38.225 145.346 92.981 1.00 0.00 H ATOM 85039 H2 WAT 3840 38.695 143.960 92.591 1.00 0.00 H TER 85041 WAT 3840 ATOM 85041 O WAT 3841 96.418 76.721 126.427 1.00 0.00 O ATOM 85042 H1 WAT 3841 96.751 77.192 127.191 1.00 0.00 H ATOM 85043 H2 WAT 3841 97.198 76.340 126.022 1.00 0.00 H TER 85045 WAT 3841 ATOM 85045 O WAT 3842 27.928 101.453 93.906 1.00 0.00 O ATOM 85046 H1 WAT 3842 28.396 100.671 94.199 1.00 0.00 H ATOM 85047 H2 WAT 3842 28.235 102.148 94.489 1.00 0.00 H TER 85049 WAT 3842 ATOM 85049 O WAT 3843 49.258 129.281 80.446 1.00 0.00 O ATOM 85050 H1 WAT 3843 48.700 130.034 80.640 1.00 0.00 H ATOM 85051 H2 WAT 3843 48.645 128.576 80.236 1.00 0.00 H TER 85053 WAT 3843 ATOM 85053 O WAT 3844 37.789 85.070 125.657 1.00 0.00 O ATOM 85054 H1 WAT 3844 36.979 85.111 125.149 1.00 0.00 H ATOM 85055 H2 WAT 3844 38.378 85.684 125.218 1.00 0.00 H TER 85057 WAT 3844 ATOM 85057 O WAT 3845 115.283 25.257 82.203 1.00 0.00 O ATOM 85058 H1 WAT 3845 115.012 24.362 82.409 1.00 0.00 H ATOM 85059 H2 WAT 3845 114.468 25.710 81.988 1.00 0.00 H TER 85061 WAT 3845 ATOM 85061 O WAT 3846 47.484 117.723 65.097 1.00 0.00 O ATOM 85062 H1 WAT 3846 46.701 118.143 65.453 1.00 0.00 H ATOM 85063 H2 WAT 3846 47.196 116.842 64.858 1.00 0.00 H TER 85065 WAT 3846 ATOM 85065 O WAT 3847 5.293 79.404 122.171 1.00 0.00 O ATOM 85066 H1 WAT 3847 4.690 80.103 121.917 1.00 0.00 H ATOM 85067 H2 WAT 3847 4.770 78.828 122.729 1.00 0.00 H TER 85069 WAT 3847 ATOM 85069 O WAT 3848 88.557 105.748 14.326 1.00 0.00 O ATOM 85070 H1 WAT 3848 87.932 105.986 13.641 1.00 0.00 H ATOM 85071 H2 WAT 3848 88.191 104.957 14.721 1.00 0.00 H TER 85073 WAT 3848 ATOM 85073 O WAT 3849 26.627 54.031 23.914 1.00 0.00 O ATOM 85074 H1 WAT 3849 26.475 53.174 24.311 1.00 0.00 H ATOM 85075 H2 WAT 3849 27.392 53.904 23.353 1.00 0.00 H TER 85077 WAT 3849 ATOM 85077 O WAT 3850 42.513 37.772 7.955 1.00 0.00 O ATOM 85078 H1 WAT 3850 42.555 37.278 7.136 1.00 0.00 H ATOM 85079 H2 WAT 3850 41.811 37.353 8.452 1.00 0.00 H TER 85081 WAT 3850 ATOM 85081 O WAT 3851 69.307 34.421 14.112 1.00 0.00 O ATOM 85082 H1 WAT 3851 68.880 34.123 13.308 1.00 0.00 H ATOM 85083 H2 WAT 3851 69.849 33.680 14.384 1.00 0.00 H TER 85085 WAT 3851 ATOM 85085 O WAT 3852 12.950 70.464 82.085 1.00 0.00 O ATOM 85086 H1 WAT 3852 12.493 71.071 82.667 1.00 0.00 H ATOM 85087 H2 WAT 3852 12.289 69.812 81.851 1.00 0.00 H TER 85089 WAT 3852 ATOM 85089 O WAT 3853 101.802 58.701 139.367 1.00 0.00 O ATOM 85090 H1 WAT 3853 101.086 59.017 138.816 1.00 0.00 H ATOM 85091 H2 WAT 3853 101.656 59.120 140.215 1.00 0.00 H TER 85093 WAT 3853 ATOM 85093 O WAT 3854 90.245 86.729 95.610 1.00 0.00 O ATOM 85094 H1 WAT 3854 89.956 86.978 96.488 1.00 0.00 H ATOM 85095 H2 WAT 3854 89.561 87.063 95.029 1.00 0.00 H TER 85097 WAT 3854 ATOM 85097 O WAT 3855 59.228 51.226 78.768 1.00 0.00 O ATOM 85098 H1 WAT 3855 58.709 50.753 78.118 1.00 0.00 H ATOM 85099 H2 WAT 3855 60.096 51.303 78.371 1.00 0.00 H TER 85101 WAT 3855 ATOM 85101 O WAT 3856 93.631 137.208 132.839 1.00 0.00 O ATOM 85102 H1 WAT 3856 94.299 137.008 132.183 1.00 0.00 H ATOM 85103 H2 WAT 3856 94.121 137.574 133.575 1.00 0.00 H TER 85105 WAT 3856 ATOM 85105 O WAT 3857 101.287 8.035 55.389 1.00 0.00 O ATOM 85106 H1 WAT 3857 101.018 8.932 55.195 1.00 0.00 H ATOM 85107 H2 WAT 3857 101.325 7.606 54.534 1.00 0.00 H TER 85109 WAT 3857 ATOM 85109 O WAT 3858 24.071 59.403 131.603 1.00 0.00 O ATOM 85110 H1 WAT 3858 24.005 59.656 130.682 1.00 0.00 H ATOM 85111 H2 WAT 3858 23.963 58.452 131.598 1.00 0.00 H TER 85113 WAT 3858 ATOM 85113 O WAT 3859 99.827 21.398 6.573 1.00 0.00 O ATOM 85114 H1 WAT 3859 100.339 21.962 5.993 1.00 0.00 H ATOM 85115 H2 WAT 3859 100.479 20.856 7.017 1.00 0.00 H TER 85117 WAT 3859 ATOM 85117 O WAT 3860 97.364 140.393 52.873 1.00 0.00 O ATOM 85118 H1 WAT 3860 97.264 141.345 52.838 1.00 0.00 H ATOM 85119 H2 WAT 3860 98.235 140.230 52.511 1.00 0.00 H TER 85121 WAT 3860 ATOM 85121 O WAT 3861 100.596 62.632 100.134 1.00 0.00 O ATOM 85122 H1 WAT 3861 100.214 62.751 99.264 1.00 0.00 H ATOM 85123 H2 WAT 3861 100.571 63.503 100.529 1.00 0.00 H TER 85125 WAT 3861 ATOM 85125 O WAT 3862 43.375 82.913 131.512 1.00 0.00 O ATOM 85126 H1 WAT 3862 44.162 82.746 132.031 1.00 0.00 H ATOM 85127 H2 WAT 3862 43.679 82.900 130.605 1.00 0.00 H TER 85129 WAT 3862 ATOM 85129 O WAT 3863 92.305 128.634 126.753 1.00 0.00 O ATOM 85130 H1 WAT 3863 92.921 127.980 127.083 1.00 0.00 H ATOM 85131 H2 WAT 3863 92.656 128.884 125.898 1.00 0.00 H TER 85133 WAT 3863 ATOM 85133 O WAT 3864 87.540 57.921 77.112 1.00 0.00 O ATOM 85134 H1 WAT 3864 88.089 58.679 76.913 1.00 0.00 H ATOM 85135 H2 WAT 3864 87.798 57.665 77.998 1.00 0.00 H TER 85137 WAT 3864 ATOM 85137 O WAT 3865 141.486 141.631 121.165 1.00 0.00 O ATOM 85138 H1 WAT 3865 140.723 142.062 121.550 1.00 0.00 H ATOM 85139 H2 WAT 3865 142.086 142.348 120.956 1.00 0.00 H TER 85141 WAT 3865 ATOM 85141 O WAT 3866 138.557 91.106 5.106 1.00 0.00 O ATOM 85142 H1 WAT 3866 137.914 90.802 4.465 1.00 0.00 H ATOM 85143 H2 WAT 3866 138.957 91.874 4.698 1.00 0.00 H TER 85145 WAT 3866 ATOM 85145 O WAT 3867 126.690 130.176 123.978 1.00 0.00 O ATOM 85146 H1 WAT 3867 127.433 129.664 124.296 1.00 0.00 H ATOM 85147 H2 WAT 3867 127.069 130.779 123.339 1.00 0.00 H TER 85149 WAT 3867 ATOM 85149 O WAT 3868 10.788 76.978 80.365 1.00 0.00 O ATOM 85150 H1 WAT 3868 10.914 76.086 80.043 1.00 0.00 H ATOM 85151 H2 WAT 3868 11.110 77.536 79.657 1.00 0.00 H TER 85153 WAT 3868 ATOM 85153 O WAT 3869 126.143 77.102 3.176 1.00 0.00 O ATOM 85154 H1 WAT 3869 125.505 77.447 3.801 1.00 0.00 H ATOM 85155 H2 WAT 3869 126.915 77.656 3.290 1.00 0.00 H TER 85157 WAT 3869 ATOM 85157 O WAT 3870 28.221 80.125 72.518 1.00 0.00 O ATOM 85158 H1 WAT 3870 27.336 79.771 72.435 1.00 0.00 H ATOM 85159 H2 WAT 3870 28.285 80.775 71.818 1.00 0.00 H TER 85161 WAT 3870 ATOM 85161 O WAT 3871 52.296 120.281 128.835 1.00 0.00 O ATOM 85162 H1 WAT 3871 52.796 120.538 129.609 1.00 0.00 H ATOM 85163 H2 WAT 3871 52.255 121.075 128.302 1.00 0.00 H TER 85165 WAT 3871 ATOM 85165 O WAT 3872 141.715 90.431 72.040 1.00 0.00 O ATOM 85166 H1 WAT 3872 141.670 89.477 72.094 1.00 0.00 H ATOM 85167 H2 WAT 3872 141.172 90.738 72.766 1.00 0.00 H TER 85169 WAT 3872 ATOM 85169 O WAT 3873 42.045 51.148 121.231 1.00 0.00 O ATOM 85170 H1 WAT 3873 42.170 50.200 121.243 1.00 0.00 H ATOM 85171 H2 WAT 3873 41.752 51.363 122.117 1.00 0.00 H TER 85173 WAT 3873 ATOM 85173 O WAT 3874 134.180 29.419 84.722 1.00 0.00 O ATOM 85174 H1 WAT 3874 134.543 30.128 84.190 1.00 0.00 H ATOM 85175 H2 WAT 3874 134.947 28.959 85.064 1.00 0.00 H TER 85177 WAT 3874 ATOM 85177 O WAT 3875 74.152 16.144 91.479 1.00 0.00 O ATOM 85178 H1 WAT 3875 74.494 16.745 92.141 1.00 0.00 H ATOM 85179 H2 WAT 3875 73.207 16.293 91.486 1.00 0.00 H TER 85181 WAT 3875 ATOM 85181 O WAT 3876 120.533 140.997 83.401 1.00 0.00 O ATOM 85182 H1 WAT 3876 120.243 141.829 83.773 1.00 0.00 H ATOM 85183 H2 WAT 3876 121.100 141.246 82.670 1.00 0.00 H TER 85185 WAT 3876 ATOM 85185 O WAT 3877 93.499 4.003 69.630 1.00 0.00 O ATOM 85186 H1 WAT 3877 92.752 4.595 69.547 1.00 0.00 H ATOM 85187 H2 WAT 3877 94.258 4.583 69.695 1.00 0.00 H TER 85189 WAT 3877 ATOM 85189 O WAT 3878 115.967 18.988 119.632 1.00 0.00 O ATOM 85190 H1 WAT 3878 115.993 19.560 118.864 1.00 0.00 H ATOM 85191 H2 WAT 3878 115.455 19.477 120.276 1.00 0.00 H TER 85193 WAT 3878 ATOM 85193 O WAT 3879 104.349 80.828 154.497 1.00 0.00 O ATOM 85194 H1 WAT 3879 104.495 80.009 154.025 1.00 0.00 H ATOM 85195 H2 WAT 3879 104.215 80.561 155.406 1.00 0.00 H TER 85197 WAT 3879 ATOM 85197 O WAT 3880 74.820 98.641 103.710 1.00 0.00 O ATOM 85198 H1 WAT 3880 75.680 98.585 104.127 1.00 0.00 H ATOM 85199 H2 WAT 3880 74.744 97.830 103.208 1.00 0.00 H TER 85201 WAT 3880 ATOM 85201 O WAT 3881 50.995 84.283 145.813 1.00 0.00 O ATOM 85202 H1 WAT 3881 51.669 84.788 146.269 1.00 0.00 H ATOM 85203 H2 WAT 3881 50.534 84.929 145.277 1.00 0.00 H TER 85205 WAT 3881 ATOM 85205 O WAT 3882 30.826 47.766 143.246 1.00 0.00 O ATOM 85206 H1 WAT 3882 30.439 48.627 143.090 1.00 0.00 H ATOM 85207 H2 WAT 3882 30.271 47.161 142.755 1.00 0.00 H TER 85209 WAT 3882 ATOM 85209 O WAT 3883 44.663 2.606 78.750 1.00 0.00 O ATOM 85210 H1 WAT 3883 44.765 3.093 77.932 1.00 0.00 H ATOM 85211 H2 WAT 3883 43.918 2.026 78.592 1.00 0.00 H TER 85213 WAT 3883 ATOM 85213 O WAT 3884 98.068 125.767 107.293 1.00 0.00 O ATOM 85214 H1 WAT 3884 98.954 125.409 107.252 1.00 0.00 H ATOM 85215 H2 WAT 3884 97.892 125.864 108.229 1.00 0.00 H TER 85217 WAT 3884 ATOM 85217 O WAT 3885 38.063 18.382 118.226 1.00 0.00 O ATOM 85218 H1 WAT 3885 37.926 19.251 118.605 1.00 0.00 H ATOM 85219 H2 WAT 3885 38.797 18.019 118.720 1.00 0.00 H TER 85221 WAT 3885 ATOM 85221 O WAT 3886 106.975 108.295 115.244 1.00 0.00 O ATOM 85222 H1 WAT 3886 107.467 107.473 115.260 1.00 0.00 H ATOM 85223 H2 WAT 3886 106.067 108.028 115.106 1.00 0.00 H TER 85225 WAT 3886 ATOM 85225 O WAT 3887 142.369 11.575 9.974 1.00 0.00 O ATOM 85226 H1 WAT 3887 142.517 11.718 10.909 1.00 0.00 H ATOM 85227 H2 WAT 3887 142.785 12.325 9.549 1.00 0.00 H TER 85229 WAT 3887 ATOM 85229 O WAT 3888 90.724 140.764 13.441 1.00 0.00 O ATOM 85230 H1 WAT 3888 90.350 141.198 12.675 1.00 0.00 H ATOM 85231 H2 WAT 3888 91.532 140.364 13.119 1.00 0.00 H TER 85233 WAT 3888 ATOM 85233 O WAT 3889 114.544 123.125 155.692 1.00 0.00 O ATOM 85234 H1 WAT 3889 115.195 123.298 156.371 1.00 0.00 H ATOM 85235 H2 WAT 3889 115.053 122.804 154.948 1.00 0.00 H TER 85237 WAT 3889 ATOM 85237 O WAT 3890 111.925 54.366 86.734 1.00 0.00 O ATOM 85238 H1 WAT 3890 112.382 55.162 86.462 1.00 0.00 H ATOM 85239 H2 WAT 3890 111.170 54.311 86.148 1.00 0.00 H TER 85241 WAT 3890 ATOM 85241 O WAT 3891 128.289 115.380 61.397 1.00 0.00 O ATOM 85242 H1 WAT 3891 128.515 116.195 61.845 1.00 0.00 H ATOM 85243 H2 WAT 3891 129.133 114.995 61.159 1.00 0.00 H TER 85245 WAT 3891 ATOM 85245 O WAT 3892 131.054 48.218 2.110 1.00 0.00 O ATOM 85246 H1 WAT 3892 131.513 47.615 2.695 1.00 0.00 H ATOM 85247 H2 WAT 3892 130.267 47.742 1.845 1.00 0.00 H TER 85249 WAT 3892 ATOM 85249 O WAT 3893 117.977 10.279 147.582 1.00 0.00 O ATOM 85250 H1 WAT 3893 117.848 9.659 148.300 1.00 0.00 H ATOM 85251 H2 WAT 3893 117.158 10.246 147.088 1.00 0.00 H TER 85253 WAT 3893 ATOM 85253 O WAT 3894 47.992 72.166 115.690 1.00 0.00 O ATOM 85254 H1 WAT 3894 48.215 71.239 115.603 1.00 0.00 H ATOM 85255 H2 WAT 3894 48.833 72.603 115.823 1.00 0.00 H TER 85257 WAT 3894 ATOM 85257 O WAT 3895 2.290 128.128 104.361 1.00 0.00 O ATOM 85258 H1 WAT 3895 2.662 128.530 103.576 1.00 0.00 H ATOM 85259 H2 WAT 3895 1.345 128.252 104.269 1.00 0.00 H TER 85261 WAT 3895 ATOM 85261 O WAT 3896 90.877 134.624 158.305 1.00 0.00 O ATOM 85262 H1 WAT 3896 90.118 134.110 158.581 1.00 0.00 H ATOM 85263 H2 WAT 3896 90.671 135.519 158.573 1.00 0.00 H TER 85265 WAT 3896 ATOM 85265 O WAT 3897 136.909 48.383 107.126 1.00 0.00 O ATOM 85266 H1 WAT 3897 136.289 48.517 107.842 1.00 0.00 H ATOM 85267 H2 WAT 3897 136.381 48.016 106.417 1.00 0.00 H TER 85269 WAT 3897 ATOM 85269 O WAT 3898 36.818 41.150 148.139 1.00 0.00 O ATOM 85270 H1 WAT 3898 36.060 40.963 148.693 1.00 0.00 H ATOM 85271 H2 WAT 3898 37.532 40.649 148.533 1.00 0.00 H TER 85273 WAT 3898 ATOM 85273 O WAT 3899 17.301 34.177 136.560 1.00 0.00 O ATOM 85274 H1 WAT 3899 18.230 34.282 136.769 1.00 0.00 H ATOM 85275 H2 WAT 3899 17.257 34.276 135.609 1.00 0.00 H TER 85277 WAT 3899 ATOM 85277 O WAT 3900 90.123 15.281 98.689 1.00 0.00 O ATOM 85278 H1 WAT 3900 90.194 15.437 97.747 1.00 0.00 H ATOM 85279 H2 WAT 3900 90.142 14.328 98.776 1.00 0.00 H TER 85281 WAT 3900 ATOM 85281 O WAT 3901 71.716 22.295 78.029 1.00 0.00 O ATOM 85282 H1 WAT 3901 71.524 22.774 78.835 1.00 0.00 H ATOM 85283 H2 WAT 3901 72.160 22.933 77.471 1.00 0.00 H TER 85285 WAT 3901 ATOM 85285 O WAT 3902 28.110 62.651 11.641 1.00 0.00 O ATOM 85286 H1 WAT 3902 27.404 62.034 11.833 1.00 0.00 H ATOM 85287 H2 WAT 3902 28.257 63.112 12.467 1.00 0.00 H TER 85289 WAT 3902 ATOM 85289 O WAT 3903 69.846 104.619 68.015 1.00 0.00 O ATOM 85290 H1 WAT 3903 69.347 104.172 67.332 1.00 0.00 H ATOM 85291 H2 WAT 3903 70.385 103.932 68.408 1.00 0.00 H TER 85293 WAT 3903 ATOM 85293 O WAT 3904 53.063 127.593 144.882 1.00 0.00 O ATOM 85294 H1 WAT 3904 52.307 127.518 145.464 1.00 0.00 H ATOM 85295 H2 WAT 3904 53.811 127.690 145.473 1.00 0.00 H TER 85297 WAT 3904 ATOM 85297 O WAT 3905 116.788 0.933 23.204 1.00 0.00 O ATOM 85298 H1 WAT 3905 116.845 1.752 22.713 1.00 0.00 H ATOM 85299 H2 WAT 3905 117.398 1.047 23.933 1.00 0.00 H TER 85301 WAT 3905 ATOM 85301 O WAT 3906 16.655 103.966 144.091 1.00 0.00 O ATOM 85302 H1 WAT 3906 16.699 103.412 143.312 1.00 0.00 H ATOM 85303 H2 WAT 3906 16.225 103.420 144.749 1.00 0.00 H TER 85305 WAT 3906 ATOM 85305 O WAT 3907 67.479 123.349 72.997 1.00 0.00 O ATOM 85306 H1 WAT 3907 68.228 123.771 73.419 1.00 0.00 H ATOM 85307 H2 WAT 3907 67.195 122.684 73.624 1.00 0.00 H TER 85309 WAT 3907 ATOM 85309 O WAT 3908 48.091 116.238 144.845 1.00 0.00 O ATOM 85310 H1 WAT 3908 48.202 116.814 145.601 1.00 0.00 H ATOM 85311 H2 WAT 3908 48.919 116.306 144.369 1.00 0.00 H TER 85313 WAT 3908 ATOM 85313 O WAT 3909 13.611 46.584 140.230 1.00 0.00 O ATOM 85314 H1 WAT 3909 13.193 45.970 140.832 1.00 0.00 H ATOM 85315 H2 WAT 3909 14.207 46.044 139.712 1.00 0.00 H TER 85317 WAT 3909 ATOM 85317 O WAT 3910 116.512 141.594 85.836 1.00 0.00 O ATOM 85318 H1 WAT 3910 117.058 141.170 85.174 1.00 0.00 H ATOM 85319 H2 WAT 3910 116.456 142.506 85.551 1.00 0.00 H TER 85321 WAT 3910 ATOM 85321 O WAT 3911 68.258 41.875 121.711 1.00 0.00 O ATOM 85322 H1 WAT 3911 69.199 41.822 121.879 1.00 0.00 H ATOM 85323 H2 WAT 3911 68.067 42.813 121.706 1.00 0.00 H TER 85325 WAT 3911 ATOM 85325 O WAT 3912 33.528 99.468 92.059 1.00 0.00 O ATOM 85326 H1 WAT 3912 33.698 100.053 92.797 1.00 0.00 H ATOM 85327 H2 WAT 3912 34.360 99.429 91.588 1.00 0.00 H TER 85329 WAT 3912 ATOM 85329 O WAT 3913 9.464 36.317 125.393 1.00 0.00 O ATOM 85330 H1 WAT 3913 10.342 35.998 125.186 1.00 0.00 H ATOM 85331 H2 WAT 3913 9.612 37.124 125.885 1.00 0.00 H TER 85333 WAT 3913 ATOM 85333 O WAT 3914 101.700 35.432 9.015 1.00 0.00 O ATOM 85334 H1 WAT 3914 100.913 35.037 9.390 1.00 0.00 H ATOM 85335 H2 WAT 3914 102.063 35.963 9.724 1.00 0.00 H TER 85337 WAT 3914 ATOM 85337 O WAT 3915 135.196 77.372 121.781 1.00 0.00 O ATOM 85338 H1 WAT 3915 135.924 76.837 122.096 1.00 0.00 H ATOM 85339 H2 WAT 3915 134.875 77.823 122.562 1.00 0.00 H TER 85341 WAT 3915 ATOM 85341 O WAT 3916 38.626 90.269 157.586 1.00 0.00 O ATOM 85342 H1 WAT 3916 37.732 89.988 157.779 1.00 0.00 H ATOM 85343 H2 WAT 3916 38.719 90.142 156.642 1.00 0.00 H TER 85345 WAT 3916 ATOM 85345 O WAT 3917 121.759 24.697 85.251 1.00 0.00 O ATOM 85346 H1 WAT 3917 120.990 25.257 85.142 1.00 0.00 H ATOM 85347 H2 WAT 3917 121.741 24.114 84.493 1.00 0.00 H TER 85349 WAT 3917 ATOM 85349 O WAT 3918 52.030 52.372 156.097 1.00 0.00 O ATOM 85350 H1 WAT 3918 51.914 52.976 155.363 1.00 0.00 H ATOM 85351 H2 WAT 3918 52.024 52.933 156.872 1.00 0.00 H TER 85353 WAT 3918 ATOM 85353 O WAT 3919 87.887 91.789 117.124 1.00 0.00 O ATOM 85354 H1 WAT 3919 88.272 92.662 117.050 1.00 0.00 H ATOM 85355 H2 WAT 3919 88.057 91.379 116.276 1.00 0.00 H TER 85357 WAT 3919 ATOM 85357 O WAT 3920 59.647 13.836 58.980 1.00 0.00 O ATOM 85358 H1 WAT 3920 59.681 14.191 59.869 1.00 0.00 H ATOM 85359 H2 WAT 3920 59.161 13.016 59.069 1.00 0.00 H TER 85361 WAT 3920 ATOM 85361 O WAT 3921 112.513 31.809 127.727 1.00 0.00 O ATOM 85362 H1 WAT 3921 112.471 31.108 127.077 1.00 0.00 H ATOM 85363 H2 WAT 3921 111.680 32.271 127.636 1.00 0.00 H TER 85365 WAT 3921 ATOM 85365 O WAT 3922 69.601 145.682 83.875 1.00 0.00 O ATOM 85366 H1 WAT 3922 68.863 146.291 83.910 1.00 0.00 H ATOM 85367 H2 WAT 3922 69.196 144.820 83.779 1.00 0.00 H TER 85369 WAT 3922 ATOM 85369 O WAT 3923 4.978 49.401 113.865 1.00 0.00 O ATOM 85370 H1 WAT 3923 5.666 49.749 113.298 1.00 0.00 H ATOM 85371 H2 WAT 3923 4.936 48.470 113.649 1.00 0.00 H TER 85373 WAT 3923 ATOM 85373 O WAT 3924 26.036 31.098 98.137 1.00 0.00 O ATOM 85374 H1 WAT 3924 25.955 31.988 98.480 1.00 0.00 H ATOM 85375 H2 WAT 3924 26.629 30.659 98.746 1.00 0.00 H TER 85377 WAT 3924 ATOM 85377 O WAT 3925 120.676 64.580 67.717 1.00 0.00 O ATOM 85378 H1 WAT 3925 120.083 65.059 68.295 1.00 0.00 H ATOM 85379 H2 WAT 3925 121.232 65.256 67.330 1.00 0.00 H TER 85381 WAT 3925 ATOM 85381 O WAT 3926 121.888 28.102 4.942 1.00 0.00 O ATOM 85382 H1 WAT 3926 121.270 28.214 5.665 1.00 0.00 H ATOM 85383 H2 WAT 3926 121.344 28.140 4.155 1.00 0.00 H TER 85385 WAT 3926 ATOM 85385 O WAT 3927 31.759 50.343 138.968 1.00 0.00 O ATOM 85386 H1 WAT 3927 30.885 50.374 139.359 1.00 0.00 H ATOM 85387 H2 WAT 3927 32.310 49.952 139.645 1.00 0.00 H TER 85389 WAT 3927 ATOM 85389 O WAT 3928 99.554 76.781 120.987 1.00 0.00 O ATOM 85390 H1 WAT 3928 99.438 75.914 120.599 1.00 0.00 H ATOM 85391 H2 WAT 3928 99.634 77.370 120.237 1.00 0.00 H TER 85393 WAT 3928 ATOM 85393 O WAT 3929 91.866 133.788 82.047 1.00 0.00 O ATOM 85394 H1 WAT 3929 91.501 134.534 82.524 1.00 0.00 H ATOM 85395 H2 WAT 3929 91.763 133.048 82.645 1.00 0.00 H TER 85397 WAT 3929 ATOM 85397 O WAT 3930 110.842 8.515 75.558 1.00 0.00 O ATOM 85398 H1 WAT 3930 111.697 8.285 75.922 1.00 0.00 H ATOM 85399 H2 WAT 3930 110.263 8.564 76.318 1.00 0.00 H TER 85401 WAT 3930 ATOM 85401 O WAT 3931 85.668 110.699 139.325 1.00 0.00 O ATOM 85402 H1 WAT 3931 85.781 111.530 138.865 1.00 0.00 H ATOM 85403 H2 WAT 3931 84.726 110.533 139.294 1.00 0.00 H TER 85405 WAT 3931 ATOM 85405 O WAT 3932 119.848 4.117 64.948 1.00 0.00 O ATOM 85406 H1 WAT 3932 120.245 4.896 64.558 1.00 0.00 H ATOM 85407 H2 WAT 3932 119.366 3.709 64.229 1.00 0.00 H TER 85409 WAT 3932 ATOM 85409 O WAT 3933 26.563 106.082 110.794 1.00 0.00 O ATOM 85410 H1 WAT 3933 26.721 105.223 110.403 1.00 0.00 H ATOM 85411 H2 WAT 3933 26.110 106.577 110.111 1.00 0.00 H TER 85413 WAT 3933 ATOM 85413 O WAT 3934 37.498 72.114 15.691 1.00 0.00 O ATOM 85414 H1 WAT 3934 36.896 72.765 15.331 1.00 0.00 H ATOM 85415 H2 WAT 3934 36.933 71.396 15.977 1.00 0.00 H TER 85417 WAT 3934 ATOM 85417 O WAT 3935 31.629 134.169 55.539 1.00 0.00 O ATOM 85418 H1 WAT 3935 30.770 134.421 55.198 1.00 0.00 H ATOM 85419 H2 WAT 3935 31.713 133.242 55.316 1.00 0.00 H TER 85421 WAT 3935 ATOM 85421 O WAT 3936 45.668 116.617 129.811 1.00 0.00 O ATOM 85422 H1 WAT 3936 45.299 117.423 129.452 1.00 0.00 H ATOM 85423 H2 WAT 3936 46.611 116.778 129.842 1.00 0.00 H TER 85425 WAT 3936 ATOM 85425 O WAT 3937 135.008 113.908 81.069 1.00 0.00 O ATOM 85426 H1 WAT 3937 134.269 114.506 80.959 1.00 0.00 H ATOM 85427 H2 WAT 3937 134.905 113.269 80.364 1.00 0.00 H TER 85429 WAT 3937 ATOM 85429 O WAT 3938 80.199 132.774 81.630 1.00 0.00 O ATOM 85430 H1 WAT 3938 81.043 132.827 81.181 1.00 0.00 H ATOM 85431 H2 WAT 3938 79.833 133.655 81.555 1.00 0.00 H TER 85433 WAT 3938 ATOM 85433 O WAT 3939 14.323 36.928 124.941 1.00 0.00 O ATOM 85434 H1 WAT 3939 14.211 37.849 124.703 1.00 0.00 H ATOM 85435 H2 WAT 3939 14.703 36.523 124.162 1.00 0.00 H TER 85437 WAT 3939 ATOM 85437 O WAT 3940 6.406 86.816 88.035 1.00 0.00 O ATOM 85438 H1 WAT 3940 6.540 87.504 88.687 1.00 0.00 H ATOM 85439 H2 WAT 3940 5.839 87.217 87.377 1.00 0.00 H TER 85441 WAT 3940 ATOM 85441 O WAT 3941 92.986 28.484 64.777 1.00 0.00 O ATOM 85442 H1 WAT 3941 92.582 27.685 65.116 1.00 0.00 H ATOM 85443 H2 WAT 3941 93.112 28.311 63.844 1.00 0.00 H TER 85445 WAT 3941 ATOM 85445 O WAT 3942 117.681 45.219 0.592 1.00 0.00 O ATOM 85446 H1 WAT 3942 117.610 45.193 -0.363 1.00 0.00 H ATOM 85447 H2 WAT 3942 117.383 44.356 0.878 1.00 0.00 H TER 85449 WAT 3942 ATOM 85449 O WAT 3943 123.844 144.314 16.307 1.00 0.00 O ATOM 85450 H1 WAT 3943 123.157 144.510 16.944 1.00 0.00 H ATOM 85451 H2 WAT 3943 123.654 144.888 15.566 1.00 0.00 H TER 85453 WAT 3943 ATOM 85453 O WAT 3944 131.695 100.586 98.580 1.00 0.00 O ATOM 85454 H1 WAT 3944 130.995 100.036 98.229 1.00 0.00 H ATOM 85455 H2 WAT 3944 132.263 99.978 99.054 1.00 0.00 H TER 85457 WAT 3944 ATOM 85457 O WAT 3945 29.331 35.236 149.008 1.00 0.00 O ATOM 85458 H1 WAT 3945 29.074 34.711 149.766 1.00 0.00 H ATOM 85459 H2 WAT 3945 29.602 34.592 148.352 1.00 0.00 H TER 85461 WAT 3945 ATOM 85461 O WAT 3946 101.763 4.287 73.163 1.00 0.00 O ATOM 85462 H1 WAT 3946 102.347 4.694 72.523 1.00 0.00 H ATOM 85463 H2 WAT 3946 101.673 4.941 73.856 1.00 0.00 H TER 85465 WAT 3946 ATOM 85465 O WAT 3947 60.025 91.254 22.210 1.00 0.00 O ATOM 85466 H1 WAT 3947 59.724 91.803 21.485 1.00 0.00 H ATOM 85467 H2 WAT 3947 59.438 91.472 22.934 1.00 0.00 H TER 85469 WAT 3947 ATOM 85469 O WAT 3948 24.964 65.630 125.578 1.00 0.00 O ATOM 85470 H1 WAT 3948 24.777 65.725 126.513 1.00 0.00 H ATOM 85471 H2 WAT 3948 25.776 65.125 125.546 1.00 0.00 H TER 85473 WAT 3948 ATOM 85473 O WAT 3949 116.985 118.928 148.540 1.00 0.00 O ATOM 85474 H1 WAT 3949 116.187 119.365 148.244 1.00 0.00 H ATOM 85475 H2 WAT 3949 117.663 119.234 147.938 1.00 0.00 H TER 85477 WAT 3949 ATOM 85477 O WAT 3950 31.873 122.332 89.841 1.00 0.00 O ATOM 85478 H1 WAT 3950 31.039 122.709 90.120 1.00 0.00 H ATOM 85479 H2 WAT 3950 32.089 121.698 90.524 1.00 0.00 H TER 85481 WAT 3950 ATOM 85481 O WAT 3951 15.583 78.492 15.281 1.00 0.00 O ATOM 85482 H1 WAT 3951 15.301 77.593 15.450 1.00 0.00 H ATOM 85483 H2 WAT 3951 14.935 79.034 15.731 1.00 0.00 H TER 85485 WAT 3951 ATOM 85485 O WAT 3952 85.155 86.771 69.897 1.00 0.00 O ATOM 85486 H1 WAT 3952 85.418 87.688 69.823 1.00 0.00 H ATOM 85487 H2 WAT 3952 85.764 86.301 69.327 1.00 0.00 H TER 85489 WAT 3952 ATOM 85489 O WAT 3953 67.884 56.589 6.319 1.00 0.00 O ATOM 85490 H1 WAT 3953 68.591 56.183 6.822 1.00 0.00 H ATOM 85491 H2 WAT 3953 67.088 56.361 6.799 1.00 0.00 H TER 85493 WAT 3953 ATOM 85493 O WAT 3954 42.846 133.996 76.156 1.00 0.00 O ATOM 85494 H1 WAT 3954 43.781 133.847 76.297 1.00 0.00 H ATOM 85495 H2 WAT 3954 42.475 133.119 76.064 1.00 0.00 H TER 85497 WAT 3954 ATOM 85497 O WAT 3955 27.096 142.453 14.644 1.00 0.00 O ATOM 85498 H1 WAT 3955 26.817 141.552 14.809 1.00 0.00 H ATOM 85499 H2 WAT 3955 26.867 142.609 13.727 1.00 0.00 H TER 85501 WAT 3955 ATOM 85501 O WAT 3956 55.992 24.871 53.974 1.00 0.00 O ATOM 85502 H1 WAT 3956 56.210 24.132 53.405 1.00 0.00 H ATOM 85503 H2 WAT 3956 56.429 24.672 54.802 1.00 0.00 H TER 85505 WAT 3956 ATOM 85505 O WAT 3957 92.903 5.786 74.188 1.00 0.00 O ATOM 85506 H1 WAT 3957 93.539 5.910 74.892 1.00 0.00 H ATOM 85507 H2 WAT 3957 93.272 6.262 73.444 1.00 0.00 H TER 85509 WAT 3957 ATOM 85509 O WAT 3958 143.584 50.102 138.454 1.00 0.00 O ATOM 85510 H1 WAT 3958 144.324 49.725 137.979 1.00 0.00 H ATOM 85511 H2 WAT 3958 142.825 49.606 138.148 1.00 0.00 H TER 85513 WAT 3958 ATOM 85513 O WAT 3959 127.265 14.808 69.299 1.00 0.00 O ATOM 85514 H1 WAT 3959 126.539 14.337 69.709 1.00 0.00 H ATOM 85515 H2 WAT 3959 126.850 15.350 68.628 1.00 0.00 H TER 85517 WAT 3959 ATOM 85517 O WAT 3960 120.961 81.282 15.729 1.00 0.00 O ATOM 85518 H1 WAT 3960 121.401 80.462 15.507 1.00 0.00 H ATOM 85519 H2 WAT 3960 120.454 81.076 16.515 1.00 0.00 H TER 85521 WAT 3960 ATOM 85521 O WAT 3961 52.700 73.208 0.806 1.00 0.00 O ATOM 85522 H1 WAT 3961 53.143 73.985 0.464 1.00 0.00 H ATOM 85523 H2 WAT 3961 51.768 73.418 0.745 1.00 0.00 H TER 85525 WAT 3961 ATOM 85525 O WAT 3962 63.523 43.823 129.640 1.00 0.00 O ATOM 85526 H1 WAT 3962 63.177 44.494 130.228 1.00 0.00 H ATOM 85527 H2 WAT 3962 64.426 43.693 129.931 1.00 0.00 H TER 85529 WAT 3962 ATOM 85529 O WAT 3963 90.031 126.735 71.911 1.00 0.00 O ATOM 85530 H1 WAT 3963 89.531 126.052 72.358 1.00 0.00 H ATOM 85531 H2 WAT 3963 89.500 126.959 71.147 1.00 0.00 H TER 85533 WAT 3963 ATOM 85533 O WAT 3964 11.051 33.118 72.943 1.00 0.00 O ATOM 85534 H1 WAT 3964 11.935 32.931 73.259 1.00 0.00 H ATOM 85535 H2 WAT 3964 11.056 32.830 72.031 1.00 0.00 H TER 85537 WAT 3964 ATOM 85537 O WAT 3965 50.513 144.550 61.965 1.00 0.00 O ATOM 85538 H1 WAT 3965 50.849 143.881 61.367 1.00 0.00 H ATOM 85539 H2 WAT 3965 50.384 145.321 61.413 1.00 0.00 H TER 85541 WAT 3965 ATOM 85541 O WAT 3966 41.831 36.631 20.519 1.00 0.00 O ATOM 85542 H1 WAT 3966 41.833 35.774 20.946 1.00 0.00 H ATOM 85543 H2 WAT 3966 42.655 37.036 20.791 1.00 0.00 H TER 85545 WAT 3966 ATOM 85545 O WAT 3967 20.755 80.097 129.171 1.00 0.00 O ATOM 85546 H1 WAT 3967 21.257 80.910 129.123 1.00 0.00 H ATOM 85547 H2 WAT 3967 20.508 79.914 128.264 1.00 0.00 H TER 85549 WAT 3967 ATOM 85549 O WAT 3968 14.346 53.755 126.958 1.00 0.00 O ATOM 85550 H1 WAT 3968 15.001 53.999 126.304 1.00 0.00 H ATOM 85551 H2 WAT 3968 13.792 53.114 126.513 1.00 0.00 H TER 85553 WAT 3968 ATOM 85553 O WAT 3969 92.654 28.345 90.173 1.00 0.00 O ATOM 85554 H1 WAT 3969 93.348 28.900 90.528 1.00 0.00 H ATOM 85555 H2 WAT 3969 92.220 28.894 89.520 1.00 0.00 H TER 85557 WAT 3969 ATOM 85557 O WAT 3970 40.659 113.453 82.556 1.00 0.00 O ATOM 85558 H1 WAT 3970 41.615 113.423 82.535 1.00 0.00 H ATOM 85559 H2 WAT 3970 40.451 113.963 83.338 1.00 0.00 H TER 85561 WAT 3970 ATOM 85561 O WAT 3971 142.549 142.039 97.095 1.00 0.00 O ATOM 85562 H1 WAT 3971 141.791 141.693 96.624 1.00 0.00 H ATOM 85563 H2 WAT 3971 142.954 142.651 96.481 1.00 0.00 H TER 85565 WAT 3971 ATOM 85565 O WAT 3972 40.911 63.115 151.597 1.00 0.00 O ATOM 85566 H1 WAT 3972 41.719 63.606 151.743 1.00 0.00 H ATOM 85567 H2 WAT 3972 41.186 62.198 151.587 1.00 0.00 H TER 85569 WAT 3972 ATOM 85569 O WAT 3973 130.944 80.010 6.666 1.00 0.00 O ATOM 85570 H1 WAT 3973 131.038 79.193 7.157 1.00 0.00 H ATOM 85571 H2 WAT 3973 130.223 80.467 7.099 1.00 0.00 H TER 85573 WAT 3973 ATOM 85573 O WAT 3974 22.459 67.145 137.612 1.00 0.00 O ATOM 85574 H1 WAT 3974 23.021 66.503 138.045 1.00 0.00 H ATOM 85575 H2 WAT 3974 21.609 66.710 137.540 1.00 0.00 H TER 85577 WAT 3974 ATOM 85577 O WAT 3975 127.747 74.479 157.992 1.00 0.00 O ATOM 85578 H1 WAT 3975 127.129 74.773 157.323 1.00 0.00 H ATOM 85579 H2 WAT 3975 127.209 73.990 158.616 1.00 0.00 H TER 85581 WAT 3975 ATOM 85581 O WAT 3976 99.159 36.499 75.930 1.00 0.00 O ATOM 85582 H1 WAT 3976 99.128 35.554 75.780 1.00 0.00 H ATOM 85583 H2 WAT 3976 99.443 36.866 75.093 1.00 0.00 H TER 85585 WAT 3976 ATOM 85585 O WAT 3977 83.926 13.262 128.107 1.00 0.00 O ATOM 85586 H1 WAT 3977 84.252 12.418 128.421 1.00 0.00 H ATOM 85587 H2 WAT 3977 84.712 13.738 127.840 1.00 0.00 H TER 85589 WAT 3977 ATOM 85589 O WAT 3978 72.038 111.738 79.512 1.00 0.00 O ATOM 85590 H1 WAT 3978 72.570 111.566 80.289 1.00 0.00 H ATOM 85591 H2 WAT 3978 72.500 112.442 79.056 1.00 0.00 H TER 85593 WAT 3978 ATOM 85593 O WAT 3979 31.198 106.341 56.024 1.00 0.00 O ATOM 85594 H1 WAT 3979 30.531 107.019 55.914 1.00 0.00 H ATOM 85595 H2 WAT 3979 31.992 106.724 55.651 1.00 0.00 H TER 85597 WAT 3979 ATOM 85597 O WAT 3980 36.040 29.614 11.929 1.00 0.00 O ATOM 85598 H1 WAT 3980 35.875 30.364 12.501 1.00 0.00 H ATOM 85599 H2 WAT 3980 35.737 28.858 12.432 1.00 0.00 H TER 85601 WAT 3980 ATOM 85601 O WAT 3981 0.297 43.170 87.295 1.00 0.00 O ATOM 85602 H1 WAT 3981 -0.109 44.019 87.119 1.00 0.00 H ATOM 85603 H2 WAT 3981 1.191 43.383 87.563 1.00 0.00 H TER 85605 WAT 3981 ATOM 85605 O WAT 3982 44.635 75.999 70.866 1.00 0.00 O ATOM 85606 H1 WAT 3982 43.853 75.684 71.319 1.00 0.00 H ATOM 85607 H2 WAT 3982 45.273 76.148 71.564 1.00 0.00 H TER 85609 WAT 3982 ATOM 85609 O WAT 3983 78.520 79.564 124.881 1.00 0.00 O ATOM 85610 H1 WAT 3983 79.237 79.171 125.379 1.00 0.00 H ATOM 85611 H2 WAT 3983 77.736 79.367 125.394 1.00 0.00 H TER 85613 WAT 3983 ATOM 85613 O WAT 3984 2.351 106.290 137.120 1.00 0.00 O ATOM 85614 H1 WAT 3984 1.896 107.086 137.393 1.00 0.00 H ATOM 85615 H2 WAT 3984 3.278 106.483 137.261 1.00 0.00 H TER 85617 WAT 3984 ATOM 85617 O WAT 3985 120.571 137.528 25.320 1.00 0.00 O ATOM 85618 H1 WAT 3985 120.581 136.581 25.459 1.00 0.00 H ATOM 85619 H2 WAT 3985 121.487 137.793 25.410 1.00 0.00 H TER 85621 WAT 3985 ATOM 85621 O WAT 3986 92.416 92.486 89.988 1.00 0.00 O ATOM 85622 H1 WAT 3986 91.786 93.149 90.270 1.00 0.00 H ATOM 85623 H2 WAT 3986 93.259 92.939 89.991 1.00 0.00 H TER 85625 WAT 3986 ATOM 85625 O WAT 3987 112.353 123.550 105.877 1.00 0.00 O ATOM 85626 H1 WAT 3987 112.951 123.273 105.183 1.00 0.00 H ATOM 85627 H2 WAT 3987 112.845 124.207 106.369 1.00 0.00 H TER 85629 WAT 3987 ATOM 85629 O WAT 3988 48.934 104.086 77.359 1.00 0.00 O ATOM 85630 H1 WAT 3988 48.294 104.745 77.089 1.00 0.00 H ATOM 85631 H2 WAT 3988 49.368 104.471 78.121 1.00 0.00 H TER 85633 WAT 3988 ATOM 85633 O WAT 3989 89.149 84.537 136.002 1.00 0.00 O ATOM 85634 H1 WAT 3989 88.418 84.850 135.469 1.00 0.00 H ATOM 85635 H2 WAT 3989 89.915 84.627 135.434 1.00 0.00 H TER 85637 WAT 3989 ATOM 85637 O WAT 3990 46.356 63.070 142.727 1.00 0.00 O ATOM 85638 H1 WAT 3990 46.555 62.133 142.741 1.00 0.00 H ATOM 85639 H2 WAT 3990 47.071 63.473 143.219 1.00 0.00 H TER 85641 WAT 3990 ATOM 85641 O WAT 3991 56.889 113.700 139.818 1.00 0.00 O ATOM 85642 H1 WAT 3991 56.232 113.232 140.334 1.00 0.00 H ATOM 85643 H2 WAT 3991 57.710 113.558 140.288 1.00 0.00 H TER 85645 WAT 3991 ATOM 85645 O WAT 3992 78.976 70.171 3.717 1.00 0.00 O ATOM 85646 H1 WAT 3992 78.315 69.755 3.164 1.00 0.00 H ATOM 85647 H2 WAT 3992 78.543 70.284 4.564 1.00 0.00 H TER 85649 WAT 3992 ATOM 85649 O WAT 3993 0.799 127.333 112.962 1.00 0.00 O ATOM 85650 H1 WAT 3993 0.969 126.730 112.238 1.00 0.00 H ATOM 85651 H2 WAT 3993 0.095 126.917 113.459 1.00 0.00 H TER 85653 WAT 3993 ATOM 85653 O WAT 3994 57.196 135.229 142.545 1.00 0.00 O ATOM 85654 H1 WAT 3994 56.475 134.663 142.268 1.00 0.00 H ATOM 85655 H2 WAT 3994 57.189 135.175 143.500 1.00 0.00 H TER 85657 WAT 3994 ATOM 85657 O WAT 3995 55.947 142.047 17.570 1.00 0.00 O ATOM 85658 H1 WAT 3995 55.562 142.405 18.370 1.00 0.00 H ATOM 85659 H2 WAT 3995 56.777 141.665 17.854 1.00 0.00 H TER 85661 WAT 3995 ATOM 85661 O WAT 3996 1.056 58.921 113.277 1.00 0.00 O ATOM 85662 H1 WAT 3996 0.586 58.854 112.445 1.00 0.00 H ATOM 85663 H2 WAT 3996 0.795 58.139 113.763 1.00 0.00 H TER 85665 WAT 3996 ATOM 85665 O WAT 3997 26.776 107.854 1.740 1.00 0.00 O ATOM 85666 H1 WAT 3997 25.949 107.756 2.213 1.00 0.00 H ATOM 85667 H2 WAT 3997 26.540 108.324 0.940 1.00 0.00 H TER 85669 WAT 3997 ATOM 85669 O WAT 3998 110.336 143.797 103.927 1.00 0.00 O ATOM 85670 H1 WAT 3998 109.625 144.432 103.838 1.00 0.00 H ATOM 85671 H2 WAT 3998 109.898 142.945 103.923 1.00 0.00 H TER 85673 WAT 3998 ATOM 85673 O WAT 3999 47.890 92.687 158.749 1.00 0.00 O ATOM 85674 H1 WAT 3999 47.013 92.418 159.020 1.00 0.00 H ATOM 85675 H2 WAT 3999 47.823 92.802 157.801 1.00 0.00 H TER 85677 WAT 3999 ATOM 85677 O WAT 4000 6.310 92.023 21.687 1.00 0.00 O ATOM 85678 H1 WAT 4000 6.770 92.634 22.262 1.00 0.00 H ATOM 85679 H2 WAT 4000 5.697 91.566 22.264 1.00 0.00 H TER 85681 WAT 4000 ATOM 85681 O WAT 4001 100.097 72.652 101.617 1.00 0.00 O ATOM 85682 H1 WAT 4001 100.073 71.695 101.614 1.00 0.00 H ATOM 85683 H2 WAT 4001 100.388 72.882 102.499 1.00 0.00 H TER 85685 WAT 4001 ATOM 85685 O WAT 4002 48.738 82.073 117.063 1.00 0.00 O ATOM 85686 H1 WAT 4002 48.835 81.572 116.254 1.00 0.00 H ATOM 85687 H2 WAT 4002 49.148 82.917 116.873 1.00 0.00 H TER 85689 WAT 4002 ATOM 85689 O WAT 4003 6.227 124.389 90.640 1.00 0.00 O ATOM 85690 H1 WAT 4003 6.139 125.042 89.946 1.00 0.00 H ATOM 85691 H2 WAT 4003 7.131 124.081 90.567 1.00 0.00 H TER 85693 WAT 4003 ATOM 85693 O WAT 4004 7.186 121.694 11.496 1.00 0.00 O ATOM 85694 H1 WAT 4004 6.918 122.602 11.356 1.00 0.00 H ATOM 85695 H2 WAT 4004 7.911 121.752 12.119 1.00 0.00 H TER 85697 WAT 4004 ATOM 85697 O WAT 4005 90.323 118.583 15.074 1.00 0.00 O ATOM 85698 H1 WAT 4005 90.763 118.100 15.774 1.00 0.00 H ATOM 85699 H2 WAT 4005 91.010 118.742 14.425 1.00 0.00 H TER 85701 WAT 4005 ATOM 85701 O WAT 4006 68.006 44.734 86.116 1.00 0.00 O ATOM 85702 H1 WAT 4006 67.563 45.346 85.528 1.00 0.00 H ATOM 85703 H2 WAT 4006 68.732 45.238 86.484 1.00 0.00 H TER 85705 WAT 4006 ATOM 85705 O WAT 4007 126.773 60.802 16.503 1.00 0.00 O ATOM 85706 H1 WAT 4007 126.818 59.914 16.856 1.00 0.00 H ATOM 85707 H2 WAT 4007 126.408 60.693 15.625 1.00 0.00 H TER 85709 WAT 4007 ATOM 85709 O WAT 4008 45.541 137.826 55.316 1.00 0.00 O ATOM 85710 H1 WAT 4008 45.595 137.347 56.143 1.00 0.00 H ATOM 85711 H2 WAT 4008 45.812 137.191 54.653 1.00 0.00 H TER 85713 WAT 4008 ATOM 85713 O WAT 4009 57.797 52.372 6.868 1.00 0.00 O ATOM 85714 H1 WAT 4009 58.373 52.263 6.111 1.00 0.00 H ATOM 85715 H2 WAT 4009 58.232 51.890 7.571 1.00 0.00 H TER 85717 WAT 4009 ATOM 85717 O WAT 4010 64.568 37.721 18.396 1.00 0.00 O ATOM 85718 H1 WAT 4010 65.342 38.096 18.815 1.00 0.00 H ATOM 85719 H2 WAT 4010 64.201 38.440 17.883 1.00 0.00 H TER 85721 WAT 4010 ATOM 85721 O WAT 4011 13.400 122.774 107.981 1.00 0.00 O ATOM 85722 H1 WAT 4011 13.858 122.897 108.812 1.00 0.00 H ATOM 85723 H2 WAT 4011 13.980 122.209 107.469 1.00 0.00 H TER 85725 WAT 4011 ATOM 85725 O WAT 4012 117.731 123.781 78.075 1.00 0.00 O ATOM 85726 H1 WAT 4012 117.213 124.268 77.434 1.00 0.00 H ATOM 85727 H2 WAT 4012 118.265 123.186 77.549 1.00 0.00 H TER 85729 WAT 4012 ATOM 85729 O WAT 4013 9.822 52.680 90.077 1.00 0.00 O ATOM 85730 H1 WAT 4013 9.264 53.320 89.634 1.00 0.00 H ATOM 85731 H2 WAT 4013 9.312 52.405 90.839 1.00 0.00 H TER 85733 WAT 4013 ATOM 85733 O WAT 4014 37.469 9.946 75.199 1.00 0.00 O ATOM 85734 H1 WAT 4014 38.180 9.442 75.594 1.00 0.00 H ATOM 85735 H2 WAT 4014 37.365 10.704 75.774 1.00 0.00 H TER 85737 WAT 4014 ATOM 85737 O WAT 4015 77.864 48.482 58.855 1.00 0.00 O ATOM 85738 H1 WAT 4015 78.781 48.660 58.648 1.00 0.00 H ATOM 85739 H2 WAT 4015 77.891 47.711 59.422 1.00 0.00 H TER 85741 WAT 4015 ATOM 85741 O WAT 4016 66.223 2.634 71.682 1.00 0.00 O ATOM 85742 H1 WAT 4016 67.111 2.484 72.006 1.00 0.00 H ATOM 85743 H2 WAT 4016 66.281 2.473 70.740 1.00 0.00 H TER 85745 WAT 4016 ATOM 85745 O WAT 4017 48.121 61.986 89.619 1.00 0.00 O ATOM 85746 H1 WAT 4017 47.871 62.793 89.170 1.00 0.00 H ATOM 85747 H2 WAT 4017 48.138 61.324 88.927 1.00 0.00 H TER 85749 WAT 4017 ATOM 85749 O WAT 4018 49.426 83.651 158.213 1.00 0.00 O ATOM 85750 H1 WAT 4018 50.371 83.497 158.193 1.00 0.00 H ATOM 85751 H2 WAT 4018 49.152 83.574 157.299 1.00 0.00 H TER 85753 WAT 4018 ATOM 85753 O WAT 4019 133.856 108.314 140.882 1.00 0.00 O ATOM 85754 H1 WAT 4019 133.787 108.348 141.836 1.00 0.00 H ATOM 85755 H2 WAT 4019 132.950 108.337 140.575 1.00 0.00 H TER 85757 WAT 4019 ATOM 85757 O WAT 4020 23.664 84.800 66.897 1.00 0.00 O ATOM 85758 H1 WAT 4020 24.363 85.349 66.541 1.00 0.00 H ATOM 85759 H2 WAT 4020 23.176 84.505 66.127 1.00 0.00 H TER 85761 WAT 4020 ATOM 85761 O WAT 4021 53.886 134.105 126.421 1.00 0.00 O ATOM 85762 H1 WAT 4021 53.562 134.804 126.990 1.00 0.00 H ATOM 85763 H2 WAT 4021 54.755 133.899 126.766 1.00 0.00 H TER 85765 WAT 4021 ATOM 85765 O WAT 4022 83.425 18.771 88.181 1.00 0.00 O ATOM 85766 H1 WAT 4022 82.586 19.233 88.194 1.00 0.00 H ATOM 85767 H2 WAT 4022 83.324 18.073 88.829 1.00 0.00 H TER 85769 WAT 4022 ATOM 85769 O WAT 4023 119.672 38.700 126.969 1.00 0.00 O ATOM 85770 H1 WAT 4023 119.023 38.785 126.270 1.00 0.00 H ATOM 85771 H2 WAT 4023 120.080 39.564 127.024 1.00 0.00 H TER 85773 WAT 4023 ATOM 85773 O WAT 4024 59.283 45.717 87.269 1.00 0.00 O ATOM 85774 H1 WAT 4024 58.607 46.013 87.879 1.00 0.00 H ATOM 85775 H2 WAT 4024 59.973 45.362 87.830 1.00 0.00 H TER 85777 WAT 4024 ATOM 85777 O WAT 4025 13.827 16.901 122.011 1.00 0.00 O ATOM 85778 H1 WAT 4025 13.617 17.780 122.329 1.00 0.00 H ATOM 85779 H2 WAT 4025 13.814 16.353 122.796 1.00 0.00 H TER 85781 WAT 4025 ATOM 85781 O WAT 4026 62.701 20.180 131.644 1.00 0.00 O ATOM 85782 H1 WAT 4026 62.233 20.091 130.814 1.00 0.00 H ATOM 85783 H2 WAT 4026 62.589 19.333 132.075 1.00 0.00 H TER 85785 WAT 4026 ATOM 85785 O WAT 4027 77.426 112.915 10.191 1.00 0.00 O ATOM 85786 H1 WAT 4027 77.669 112.849 11.115 1.00 0.00 H ATOM 85787 H2 WAT 4027 76.884 112.143 10.030 1.00 0.00 H TER 85789 WAT 4027 ATOM 85789 O WAT 4028 48.164 68.712 8.140 1.00 0.00 O ATOM 85790 H1 WAT 4028 48.304 69.058 9.021 1.00 0.00 H ATOM 85791 H2 WAT 4028 47.435 69.226 7.793 1.00 0.00 H TER 85793 WAT 4028 ATOM 85793 O WAT 4029 123.776 47.531 153.456 1.00 0.00 O ATOM 85794 H1 WAT 4029 123.221 47.609 154.232 1.00 0.00 H ATOM 85795 H2 WAT 4029 124.582 47.126 153.779 1.00 0.00 H TER 85797 WAT 4029 ATOM 85797 O WAT 4030 32.789 20.181 0.011 1.00 0.00 O ATOM 85798 H1 WAT 4030 33.500 19.696 0.429 1.00 0.00 H ATOM 85799 H2 WAT 4030 32.516 20.821 0.668 1.00 0.00 H TER 85801 WAT 4030 ATOM 85801 O WAT 4031 8.416 134.025 148.517 1.00 0.00 O ATOM 85802 H1 WAT 4031 9.355 134.129 148.363 1.00 0.00 H ATOM 85803 H2 WAT 4031 8.361 133.497 149.313 1.00 0.00 H TER 85805 WAT 4031 ATOM 85805 O WAT 4032 2.809 132.465 146.026 1.00 0.00 O ATOM 85806 H1 WAT 4032 2.729 131.521 146.163 1.00 0.00 H ATOM 85807 H2 WAT 4032 3.285 132.779 146.795 1.00 0.00 H TER 85809 WAT 4032 ATOM 85809 O WAT 4033 53.347 98.667 114.086 1.00 0.00 O ATOM 85810 H1 WAT 4033 53.862 99.474 114.087 1.00 0.00 H ATOM 85811 H2 WAT 4033 52.470 98.944 113.823 1.00 0.00 H TER 85813 WAT 4033 ATOM 85813 O WAT 4034 127.556 86.476 104.185 1.00 0.00 O ATOM 85814 H1 WAT 4034 127.286 86.106 103.344 1.00 0.00 H ATOM 85815 H2 WAT 4034 126.924 87.175 104.353 1.00 0.00 H TER 85817 WAT 4034 ATOM 85817 O WAT 4035 25.615 33.460 127.634 1.00 0.00 O ATOM 85818 H1 WAT 4035 25.043 33.879 128.277 1.00 0.00 H ATOM 85819 H2 WAT 4035 25.146 33.544 126.804 1.00 0.00 H TER 85821 WAT 4035 ATOM 85821 O WAT 4036 107.357 61.472 96.923 1.00 0.00 O ATOM 85822 H1 WAT 4036 108.248 61.344 97.249 1.00 0.00 H ATOM 85823 H2 WAT 4036 106.923 60.633 97.075 1.00 0.00 H TER 85825 WAT 4036 ATOM 85825 O WAT 4037 97.075 30.311 118.615 1.00 0.00 O ATOM 85826 H1 WAT 4037 97.838 29.790 118.363 1.00 0.00 H ATOM 85827 H2 WAT 4037 97.115 30.348 119.571 1.00 0.00 H TER 85829 WAT 4037 ATOM 85829 O WAT 4038 74.035 1.723 72.350 1.00 0.00 O ATOM 85830 H1 WAT 4038 73.680 0.977 72.833 1.00 0.00 H ATOM 85831 H2 WAT 4038 74.610 2.162 72.977 1.00 0.00 H TER 85833 WAT 4038 ATOM 85833 O WAT 4039 95.252 70.862 117.790 1.00 0.00 O ATOM 85834 H1 WAT 4039 95.255 71.794 117.574 1.00 0.00 H ATOM 85835 H2 WAT 4039 94.325 70.630 117.842 1.00 0.00 H TER 85837 WAT 4039 ATOM 85837 O WAT 4040 1.031 58.625 153.587 1.00 0.00 O ATOM 85838 H1 WAT 4040 0.373 58.189 154.129 1.00 0.00 H ATOM 85839 H2 WAT 4040 1.370 59.328 154.141 1.00 0.00 H TER 85841 WAT 4040 ATOM 85841 O WAT 4041 13.461 76.958 75.199 1.00 0.00 O ATOM 85842 H1 WAT 4041 13.818 76.241 74.675 1.00 0.00 H ATOM 85843 H2 WAT 4041 13.345 76.582 76.072 1.00 0.00 H TER 85845 WAT 4041 ATOM 85845 O WAT 4042 18.020 24.322 112.043 1.00 0.00 O ATOM 85846 H1 WAT 4042 17.770 24.843 112.806 1.00 0.00 H ATOM 85847 H2 WAT 4042 17.681 24.814 111.295 1.00 0.00 H TER 85849 WAT 4042 ATOM 85849 O WAT 4043 6.798 11.666 2.842 1.00 0.00 O ATOM 85850 H1 WAT 4043 5.973 11.734 3.321 1.00 0.00 H ATOM 85851 H2 WAT 4043 6.564 11.234 2.020 1.00 0.00 H TER 85853 WAT 4043 ATOM 85853 O WAT 4044 86.762 130.442 102.180 1.00 0.00 O ATOM 85854 H1 WAT 4044 87.086 131.120 101.587 1.00 0.00 H ATOM 85855 H2 WAT 4044 86.163 130.904 102.767 1.00 0.00 H TER 85857 WAT 4044 ATOM 85857 O WAT 4045 69.324 41.578 61.440 1.00 0.00 O ATOM 85858 H1 WAT 4045 68.717 42.221 61.073 1.00 0.00 H ATOM 85859 H2 WAT 4045 69.789 41.227 60.680 1.00 0.00 H TER 85861 WAT 4045 ATOM 85861 O WAT 4046 23.953 51.978 88.364 1.00 0.00 O ATOM 85862 H1 WAT 4046 24.847 52.320 88.347 1.00 0.00 H ATOM 85863 H2 WAT 4046 23.418 52.687 88.008 1.00 0.00 H TER 85865 WAT 4046 ATOM 85865 O WAT 4047 108.656 65.610 119.447 1.00 0.00 O ATOM 85866 H1 WAT 4047 108.132 65.419 120.225 1.00 0.00 H ATOM 85867 H2 WAT 4047 109.162 64.812 119.297 1.00 0.00 H TER 85869 WAT 4047 ATOM 85869 O WAT 4048 123.894 46.545 69.676 1.00 0.00 O ATOM 85870 H1 WAT 4048 124.632 46.009 69.968 1.00 0.00 H ATOM 85871 H2 WAT 4048 123.356 46.660 70.460 1.00 0.00 H TER 85873 WAT 4048 ATOM 85873 O WAT 4049 55.939 32.309 154.104 1.00 0.00 O ATOM 85874 H1 WAT 4049 55.127 31.883 154.378 1.00 0.00 H ATOM 85875 H2 WAT 4049 55.841 33.217 154.391 1.00 0.00 H TER 85877 WAT 4049 ATOM 85877 O WAT 4050 13.291 7.579 129.291 1.00 0.00 O ATOM 85878 H1 WAT 4050 13.792 7.164 128.589 1.00 0.00 H ATOM 85879 H2 WAT 4050 13.677 7.234 130.097 1.00 0.00 H TER 85881 WAT 4050 ATOM 85881 O WAT 4051 20.781 17.085 131.091 1.00 0.00 O ATOM 85882 H1 WAT 4051 20.668 16.556 131.880 1.00 0.00 H ATOM 85883 H2 WAT 4051 20.527 17.969 131.357 1.00 0.00 H TER 85885 WAT 4051 ATOM 85885 O WAT 4052 33.132 0.982 9.021 1.00 0.00 O ATOM 85886 H1 WAT 4052 33.392 0.286 9.625 1.00 0.00 H ATOM 85887 H2 WAT 4052 33.951 1.263 8.612 1.00 0.00 H TER 85889 WAT 4052 ATOM 85889 O WAT 4053 89.860 111.106 108.805 1.00 0.00 O ATOM 85890 H1 WAT 4053 89.176 110.991 109.464 1.00 0.00 H ATOM 85891 H2 WAT 4053 89.391 111.377 108.016 1.00 0.00 H TER 85893 WAT 4053 ATOM 85893 O WAT 4054 69.278 78.246 134.154 1.00 0.00 O ATOM 85894 H1 WAT 4054 68.372 78.317 134.455 1.00 0.00 H ATOM 85895 H2 WAT 4054 69.408 77.309 134.005 1.00 0.00 H TER 85897 WAT 4054 ATOM 85897 O WAT 4055 65.880 77.994 130.876 1.00 0.00 O ATOM 85898 H1 WAT 4055 65.965 77.062 131.078 1.00 0.00 H ATOM 85899 H2 WAT 4055 66.781 78.316 130.848 1.00 0.00 H TER 85901 WAT 4055 ATOM 85901 O WAT 4056 11.278 12.649 90.738 1.00 0.00 O ATOM 85902 H1 WAT 4056 11.373 11.990 90.051 1.00 0.00 H ATOM 85903 H2 WAT 4056 11.660 12.242 91.515 1.00 0.00 H TER 85905 WAT 4056 ATOM 85905 O WAT 4057 25.524 109.646 101.996 1.00 0.00 O ATOM 85906 H1 WAT 4057 25.558 108.824 101.506 1.00 0.00 H ATOM 85907 H2 WAT 4057 26.442 109.881 102.134 1.00 0.00 H TER 85909 WAT 4057 ATOM 85909 O WAT 4058 71.533 122.177 153.988 1.00 0.00 O ATOM 85910 H1 WAT 4058 71.787 121.254 153.990 1.00 0.00 H ATOM 85911 H2 WAT 4058 72.146 122.596 154.592 1.00 0.00 H TER 85913 WAT 4058 ATOM 85913 O WAT 4059 118.858 90.241 58.073 1.00 0.00 O ATOM 85914 H1 WAT 4059 118.363 89.424 58.012 1.00 0.00 H ATOM 85915 H2 WAT 4059 118.200 90.907 58.271 1.00 0.00 H TER 85917 WAT 4059 ATOM 85917 O WAT 4060 -0.036 36.502 66.591 1.00 0.00 O ATOM 85918 H1 WAT 4060 0.194 37.271 67.112 1.00 0.00 H ATOM 85919 H2 WAT 4060 0.687 36.408 65.971 1.00 0.00 H TER 85921 WAT 4060 ATOM 85921 O WAT 4061 65.297 91.265 151.235 1.00 0.00 O ATOM 85922 H1 WAT 4061 65.744 91.878 150.651 1.00 0.00 H ATOM 85923 H2 WAT 4061 64.879 90.636 150.647 1.00 0.00 H TER 85925 WAT 4061 ATOM 85925 O WAT 4062 2.231 12.462 115.646 1.00 0.00 O ATOM 85926 H1 WAT 4062 3.000 13.020 115.767 1.00 0.00 H ATOM 85927 H2 WAT 4062 2.383 11.715 116.224 1.00 0.00 H TER 85929 WAT 4062 ATOM 85929 O WAT 4063 97.458 118.053 88.421 1.00 0.00 O ATOM 85930 H1 WAT 4063 96.825 118.269 89.105 1.00 0.00 H ATOM 85931 H2 WAT 4063 98.310 118.242 88.815 1.00 0.00 H TER 85933 WAT 4063 ATOM 85933 O WAT 4064 126.044 37.424 92.510 1.00 0.00 O ATOM 85934 H1 WAT 4064 126.643 37.488 93.254 1.00 0.00 H ATOM 85935 H2 WAT 4064 125.273 37.924 92.779 1.00 0.00 H TER 85937 WAT 4064 ATOM 85937 O WAT 4065 30.103 27.684 104.577 1.00 0.00 O ATOM 85938 H1 WAT 4065 29.597 27.281 103.871 1.00 0.00 H ATOM 85939 H2 WAT 4065 30.996 27.367 104.442 1.00 0.00 H TER 85941 WAT 4065 ATOM 85941 O WAT 4066 57.568 30.822 52.861 1.00 0.00 O ATOM 85942 H1 WAT 4066 57.087 31.141 53.625 1.00 0.00 H ATOM 85943 H2 WAT 4066 57.730 31.606 52.335 1.00 0.00 H TER 85945 WAT 4066 ATOM 85945 O WAT 4067 83.143 120.642 153.776 1.00 0.00 O ATOM 85946 H1 WAT 4067 83.294 120.753 154.715 1.00 0.00 H ATOM 85947 H2 WAT 4067 82.253 120.295 153.715 1.00 0.00 H TER 85949 WAT 4067 ATOM 85949 O WAT 4068 47.862 140.956 118.739 1.00 0.00 O ATOM 85950 H1 WAT 4068 47.866 141.690 118.125 1.00 0.00 H ATOM 85951 H2 WAT 4068 47.109 141.121 119.306 1.00 0.00 H TER 85953 WAT 4068 ATOM 85953 O WAT 4069 56.499 32.438 139.063 1.00 0.00 O ATOM 85954 H1 WAT 4069 56.971 33.192 138.710 1.00 0.00 H ATOM 85955 H2 WAT 4069 57.158 31.745 139.113 1.00 0.00 H TER 85957 WAT 4069 ATOM 85957 O WAT 4070 136.676 138.049 65.773 1.00 0.00 O ATOM 85958 H1 WAT 4070 136.503 137.470 66.515 1.00 0.00 H ATOM 85959 H2 WAT 4070 136.793 138.914 66.166 1.00 0.00 H TER 85961 WAT 4070 ATOM 85961 O WAT 4071 103.019 55.608 125.278 1.00 0.00 O ATOM 85962 H1 WAT 4071 102.531 56.275 124.794 1.00 0.00 H ATOM 85963 H2 WAT 4071 103.885 55.603 124.871 1.00 0.00 H TER 85965 WAT 4071 ATOM 85965 O WAT 4072 0.621 119.318 122.764 1.00 0.00 O ATOM 85966 H1 WAT 4072 -0.007 119.805 122.229 1.00 0.00 H ATOM 85967 H2 WAT 4072 1.466 119.724 122.570 1.00 0.00 H TER 85969 WAT 4072 ATOM 85969 O WAT 4073 124.536 125.303 5.275 1.00 0.00 O ATOM 85970 H1 WAT 4073 124.010 124.551 5.548 1.00 0.00 H ATOM 85971 H2 WAT 4073 123.938 126.048 5.333 1.00 0.00 H TER 85973 WAT 4073 ATOM 85973 O WAT 4074 33.658 24.689 144.143 1.00 0.00 O ATOM 85974 H1 WAT 4074 33.630 23.908 143.590 1.00 0.00 H ATOM 85975 H2 WAT 4074 33.470 25.413 143.546 1.00 0.00 H TER 85977 WAT 4074 ATOM 85977 O WAT 4075 55.513 6.344 104.929 1.00 0.00 O ATOM 85978 H1 WAT 4075 54.697 6.835 105.022 1.00 0.00 H ATOM 85979 H2 WAT 4075 55.555 6.123 103.998 1.00 0.00 H TER 85981 WAT 4075 ATOM 85981 O WAT 4076 92.884 50.837 74.070 1.00 0.00 O ATOM 85982 H1 WAT 4076 92.275 51.258 74.677 1.00 0.00 H ATOM 85983 H2 WAT 4076 92.706 51.252 73.226 1.00 0.00 H TER 85985 WAT 4076 ATOM 85985 O WAT 4077 13.083 140.468 6.620 1.00 0.00 O ATOM 85986 H1 WAT 4077 13.790 139.830 6.527 1.00 0.00 H ATOM 85987 H2 WAT 4077 13.056 140.661 7.558 1.00 0.00 H TER 85989 WAT 4077 ATOM 85989 O WAT 4078 145.025 106.525 74.419 1.00 0.00 O ATOM 85990 H1 WAT 4078 144.925 107.462 74.247 1.00 0.00 H ATOM 85991 H2 WAT 4078 145.912 106.439 74.768 1.00 0.00 H TER 85993 WAT 4078 ATOM 85993 O WAT 4079 140.344 78.473 108.664 1.00 0.00 O ATOM 85994 H1 WAT 4079 140.106 77.770 108.060 1.00 0.00 H ATOM 85995 H2 WAT 4079 140.413 79.251 108.110 1.00 0.00 H TER 85997 WAT 4079 ATOM 85997 O WAT 4080 104.331 36.944 125.762 1.00 0.00 O ATOM 85998 H1 WAT 4080 104.711 37.647 126.289 1.00 0.00 H ATOM 85999 H2 WAT 4080 105.081 36.539 125.327 1.00 0.00 H TER 86001 WAT 4080 ATOM 86001 O WAT 4081 110.434 46.489 21.844 1.00 0.00 O ATOM 86002 H1 WAT 4081 110.779 47.289 22.242 1.00 0.00 H ATOM 86003 H2 WAT 4081 110.107 46.770 20.989 1.00 0.00 H TER 86005 WAT 4081 ATOM 86005 O WAT 4082 6.400 105.079 109.644 1.00 0.00 O ATOM 86006 H1 WAT 4082 6.379 105.447 110.527 1.00 0.00 H ATOM 86007 H2 WAT 4082 5.801 105.631 109.141 1.00 0.00 H TER 86009 WAT 4082 ATOM 86009 O WAT 4083 126.552 138.619 122.876 1.00 0.00 O ATOM 86010 H1 WAT 4083 126.041 137.811 122.830 1.00 0.00 H ATOM 86011 H2 WAT 4083 127.320 138.388 123.398 1.00 0.00 H TER 86013 WAT 4083 ATOM 86013 O WAT 4084 139.137 136.342 129.653 1.00 0.00 O ATOM 86014 H1 WAT 4084 138.947 136.972 128.958 1.00 0.00 H ATOM 86015 H2 WAT 4084 140.065 136.472 129.848 1.00 0.00 H TER 86017 WAT 4084 ATOM 86017 O WAT 4085 121.482 100.008 90.948 1.00 0.00 O ATOM 86018 H1 WAT 4085 121.040 99.178 91.131 1.00 0.00 H ATOM 86019 H2 WAT 4085 121.423 100.497 91.769 1.00 0.00 H TER 86021 WAT 4085 ATOM 86021 O WAT 4086 42.757 15.281 19.501 1.00 0.00 O ATOM 86022 H1 WAT 4086 42.392 15.526 20.351 1.00 0.00 H ATOM 86023 H2 WAT 4086 42.316 14.461 19.278 1.00 0.00 H TER 86025 WAT 4086 ATOM 86025 O WAT 4087 78.602 108.439 9.545 1.00 0.00 O ATOM 86026 H1 WAT 4087 77.964 109.152 9.501 1.00 0.00 H ATOM 86027 H2 WAT 4087 79.381 108.838 9.933 1.00 0.00 H TER 86029 WAT 4087 ATOM 86029 O WAT 4088 112.178 65.432 85.306 1.00 0.00 O ATOM 86030 H1 WAT 4088 112.852 66.019 85.649 1.00 0.00 H ATOM 86031 H2 WAT 4088 111.355 65.897 85.458 1.00 0.00 H TER 86033 WAT 4088 ATOM 86033 O WAT 4089 140.359 88.078 84.408 1.00 0.00 O ATOM 86034 H1 WAT 4089 140.622 88.014 85.327 1.00 0.00 H ATOM 86035 H2 WAT 4089 139.588 87.516 84.339 1.00 0.00 H TER 86037 WAT 4089 ATOM 86037 O WAT 4090 74.890 43.494 153.788 1.00 0.00 O ATOM 86038 H1 WAT 4090 74.785 42.901 153.044 1.00 0.00 H ATOM 86039 H2 WAT 4090 74.226 44.170 153.652 1.00 0.00 H TER 86041 WAT 4090 ATOM 86041 O WAT 4091 137.529 127.376 153.094 1.00 0.00 O ATOM 86042 H1 WAT 4091 137.532 128.270 152.752 1.00 0.00 H ATOM 86043 H2 WAT 4091 136.941 126.898 152.510 1.00 0.00 H TER 86045 WAT 4091 ATOM 86045 O WAT 4092 6.864 29.632 114.041 1.00 0.00 O ATOM 86046 H1 WAT 4092 7.105 30.203 114.771 1.00 0.00 H ATOM 86047 H2 WAT 4092 7.559 28.975 114.012 1.00 0.00 H TER 86049 WAT 4092 ATOM 86049 O WAT 4093 144.223 124.970 109.919 1.00 0.00 O ATOM 86050 H1 WAT 4093 143.807 125.470 109.217 1.00 0.00 H ATOM 86051 H2 WAT 4093 143.704 125.173 110.697 1.00 0.00 H TER 86053 WAT 4093 ATOM 86053 O WAT 4094 96.150 73.711 136.065 1.00 0.00 O ATOM 86054 H1 WAT 4094 95.652 73.988 136.835 1.00 0.00 H ATOM 86055 H2 WAT 4094 96.124 74.467 135.479 1.00 0.00 H TER 86057 WAT 4094 ATOM 86057 O WAT 4095 117.584 6.717 128.691 1.00 0.00 O ATOM 86058 H1 WAT 4095 118.268 6.119 128.388 1.00 0.00 H ATOM 86059 H2 WAT 4095 117.093 6.212 129.339 1.00 0.00 H TER 86061 WAT 4095 ATOM 86061 O WAT 4096 132.098 142.493 1.929 1.00 0.00 O ATOM 86062 H1 WAT 4096 131.593 142.897 1.224 1.00 0.00 H ATOM 86063 H2 WAT 4096 132.642 141.839 1.489 1.00 0.00 H TER 86065 WAT 4096 ATOM 86065 O WAT 4097 96.114 22.118 14.893 1.00 0.00 O ATOM 86066 H1 WAT 4097 96.435 22.785 14.287 1.00 0.00 H ATOM 86067 H2 WAT 4097 95.297 21.810 14.501 1.00 0.00 H TER 86069 WAT 4097 ATOM 86069 O WAT 4098 78.836 78.923 14.984 1.00 0.00 O ATOM 86070 H1 WAT 4098 79.493 78.436 15.481 1.00 0.00 H ATOM 86071 H2 WAT 4098 78.604 79.659 15.549 1.00 0.00 H TER 86073 WAT 4098 ATOM 86073 O WAT 4099 88.899 114.892 109.009 1.00 0.00 O ATOM 86074 H1 WAT 4099 88.594 115.323 109.807 1.00 0.00 H ATOM 86075 H2 WAT 4099 88.350 114.112 108.932 1.00 0.00 H TER 86077 WAT 4099 ATOM 86077 O WAT 4100 13.045 53.494 130.425 1.00 0.00 O ATOM 86078 H1 WAT 4100 12.842 53.862 129.565 1.00 0.00 H ATOM 86079 H2 WAT 4100 13.613 54.145 130.836 1.00 0.00 H TER 86081 WAT 4100 ATOM 86081 O WAT 4101 75.576 7.278 11.633 1.00 0.00 O ATOM 86082 H1 WAT 4101 74.877 7.725 12.111 1.00 0.00 H ATOM 86083 H2 WAT 4101 75.131 6.860 10.895 1.00 0.00 H TER 86085 WAT 4101 ATOM 86085 O WAT 4102 96.582 23.389 17.703 1.00 0.00 O ATOM 86086 H1 WAT 4102 96.377 22.912 16.898 1.00 0.00 H ATOM 86087 H2 WAT 4102 95.927 24.087 17.740 1.00 0.00 H TER 86089 WAT 4102 ATOM 86089 O WAT 4103 36.453 112.585 75.744 1.00 0.00 O ATOM 86090 H1 WAT 4103 35.673 112.057 75.574 1.00 0.00 H ATOM 86091 H2 WAT 4103 36.607 113.056 74.925 1.00 0.00 H TER 86093 WAT 4103 ATOM 86093 O WAT 4104 20.171 51.421 71.980 1.00 0.00 O ATOM 86094 H1 WAT 4104 19.897 52.333 72.079 1.00 0.00 H ATOM 86095 H2 WAT 4104 20.634 51.399 71.143 1.00 0.00 H TER 86097 WAT 4104 ATOM 86097 O WAT 4105 109.327 2.036 152.538 1.00 0.00 O ATOM 86098 H1 WAT 4105 109.862 2.482 153.194 1.00 0.00 H ATOM 86099 H2 WAT 4105 108.815 1.400 153.039 1.00 0.00 H TER 86101 WAT 4105 ATOM 86101 O WAT 4106 112.294 124.728 142.449 1.00 0.00 O ATOM 86102 H1 WAT 4106 112.639 125.028 143.291 1.00 0.00 H ATOM 86103 H2 WAT 4106 112.971 124.145 142.107 1.00 0.00 H TER 86105 WAT 4106 ATOM 86105 O WAT 4107 80.174 15.396 70.647 1.00 0.00 O ATOM 86106 H1 WAT 4107 79.780 15.772 71.434 1.00 0.00 H ATOM 86107 H2 WAT 4107 81.037 15.095 70.932 1.00 0.00 H TER 86109 WAT 4107 ATOM 86109 O WAT 4108 22.704 125.204 103.379 1.00 0.00 O ATOM 86110 H1 WAT 4108 23.435 125.110 102.769 1.00 0.00 H ATOM 86111 H2 WAT 4108 23.117 125.398 104.221 1.00 0.00 H TER 86113 WAT 4108 ATOM 86113 O WAT 4109 103.707 24.548 112.682 1.00 0.00 O ATOM 86114 H1 WAT 4109 102.979 23.940 112.557 1.00 0.00 H ATOM 86115 H2 WAT 4109 103.377 25.387 112.361 1.00 0.00 H TER 86117 WAT 4109 ATOM 86117 O WAT 4110 29.342 94.559 138.486 1.00 0.00 O ATOM 86118 H1 WAT 4110 30.234 94.304 138.720 1.00 0.00 H ATOM 86119 H2 WAT 4110 28.831 93.755 138.579 1.00 0.00 H TER 86121 WAT 4110 ATOM 86121 O WAT 4111 13.590 91.348 63.808 1.00 0.00 O ATOM 86122 H1 WAT 4111 13.968 91.965 63.181 1.00 0.00 H ATOM 86123 H2 WAT 4111 13.652 90.497 63.374 1.00 0.00 H TER 86125 WAT 4111 ATOM 86125 O WAT 4112 104.653 91.699 69.589 1.00 0.00 O ATOM 86126 H1 WAT 4112 104.166 90.949 69.247 1.00 0.00 H ATOM 86127 H2 WAT 4112 105.388 91.804 68.984 1.00 0.00 H TER 86129 WAT 4112 ATOM 86129 O WAT 4113 97.584 100.829 102.886 1.00 0.00 O ATOM 86130 H1 WAT 4113 98.203 100.724 102.164 1.00 0.00 H ATOM 86131 H2 WAT 4113 97.870 101.625 103.333 1.00 0.00 H TER 86133 WAT 4113 ATOM 86133 O WAT 4114 95.726 121.506 102.116 1.00 0.00 O ATOM 86134 H1 WAT 4114 95.484 122.311 102.573 1.00 0.00 H ATOM 86135 H2 WAT 4114 94.899 121.168 101.774 1.00 0.00 H TER 86137 WAT 4114 ATOM 86137 O WAT 4115 129.302 92.541 88.274 1.00 0.00 O ATOM 86138 H1 WAT 4115 129.293 92.039 87.459 1.00 0.00 H ATOM 86139 H2 WAT 4115 128.463 92.342 88.688 1.00 0.00 H TER 86141 WAT 4115 ATOM 86141 O WAT 4116 14.830 9.108 12.191 1.00 0.00 O ATOM 86142 H1 WAT 4116 14.704 8.679 13.038 1.00 0.00 H ATOM 86143 H2 WAT 4116 14.157 9.788 12.164 1.00 0.00 H TER 86145 WAT 4116 ATOM 86145 O WAT 4117 56.459 104.885 124.278 1.00 0.00 O ATOM 86146 H1 WAT 4117 55.755 104.243 124.187 1.00 0.00 H ATOM 86147 H2 WAT 4117 56.262 105.552 123.620 1.00 0.00 H TER 86149 WAT 4117 ATOM 86149 O WAT 4118 18.174 145.151 107.184 1.00 0.00 O ATOM 86150 H1 WAT 4118 17.991 145.985 107.617 1.00 0.00 H ATOM 86151 H2 WAT 4118 19.079 144.951 107.421 1.00 0.00 H TER 86153 WAT 4118 ATOM 86153 O WAT 4119 124.849 19.669 146.654 1.00 0.00 O ATOM 86154 H1 WAT 4119 124.200 19.437 147.318 1.00 0.00 H ATOM 86155 H2 WAT 4119 124.798 18.961 146.012 1.00 0.00 H TER 86157 WAT 4119 ATOM 86157 O WAT 4120 2.293 133.766 101.006 1.00 0.00 O ATOM 86158 H1 WAT 4120 3.000 134.278 101.400 1.00 0.00 H ATOM 86159 H2 WAT 4120 2.724 133.241 100.332 1.00 0.00 H TER 86161 WAT 4120 ATOM 86161 O WAT 4121 22.939 128.487 0.826 1.00 0.00 O ATOM 86162 H1 WAT 4121 22.063 128.634 1.183 1.00 0.00 H ATOM 86163 H2 WAT 4121 22.998 129.088 0.083 1.00 0.00 H TER 86165 WAT 4121 ATOM 86165 O WAT 4122 32.085 106.911 17.060 1.00 0.00 O ATOM 86166 H1 WAT 4122 31.486 106.544 17.710 1.00 0.00 H ATOM 86167 H2 WAT 4122 32.259 106.187 16.458 1.00 0.00 H TER 86169 WAT 4122 ATOM 86169 O WAT 4123 113.916 19.123 103.202 1.00 0.00 O ATOM 86170 H1 WAT 4123 114.347 18.495 102.622 1.00 0.00 H ATOM 86171 H2 WAT 4123 114.572 19.804 103.349 1.00 0.00 H TER 86173 WAT 4123 ATOM 86173 O WAT 4124 111.053 139.558 130.263 1.00 0.00 O ATOM 86174 H1 WAT 4124 111.120 140.207 130.963 1.00 0.00 H ATOM 86175 H2 WAT 4124 111.438 138.764 130.635 1.00 0.00 H TER 86177 WAT 4124 ATOM 86177 O WAT 4125 110.401 97.355 97.472 1.00 0.00 O ATOM 86178 H1 WAT 4125 111.196 97.840 97.690 1.00 0.00 H ATOM 86179 H2 WAT 4125 110.650 96.435 97.559 1.00 0.00 H TER 86181 WAT 4125 ATOM 86181 O WAT 4126 109.601 43.794 144.742 1.00 0.00 O ATOM 86182 H1 WAT 4126 108.894 44.144 145.284 1.00 0.00 H ATOM 86183 H2 WAT 4126 110.058 44.569 144.415 1.00 0.00 H TER 86185 WAT 4126 ATOM 86185 O WAT 4127 61.798 80.498 99.064 1.00 0.00 O ATOM 86186 H1 WAT 4127 61.704 80.828 99.957 1.00 0.00 H ATOM 86187 H2 WAT 4127 60.962 80.069 98.878 1.00 0.00 H TER 86189 WAT 4127 ATOM 86189 O WAT 4128 75.269 128.631 146.564 1.00 0.00 O ATOM 86190 H1 WAT 4128 74.985 129.209 145.856 1.00 0.00 H ATOM 86191 H2 WAT 4128 76.204 128.502 146.409 1.00 0.00 H TER 86193 WAT 4128 ATOM 86193 O WAT 4129 91.168 51.001 89.923 1.00 0.00 O ATOM 86194 H1 WAT 4129 90.371 51.080 90.446 1.00 0.00 H ATOM 86195 H2 WAT 4129 91.866 50.882 90.568 1.00 0.00 H TER 86197 WAT 4129 ATOM 86197 O WAT 4130 85.909 81.771 27.126 1.00 0.00 O ATOM 86198 H1 WAT 4130 85.375 82.559 27.228 1.00 0.00 H ATOM 86199 H2 WAT 4130 85.559 81.344 26.343 1.00 0.00 H TER 86201 WAT 4130 ATOM 86201 O WAT 4131 31.346 27.509 152.512 1.00 0.00 O ATOM 86202 H1 WAT 4131 31.558 26.717 153.006 1.00 0.00 H ATOM 86203 H2 WAT 4131 30.457 27.359 152.190 1.00 0.00 H TER 86205 WAT 4131 ATOM 86205 O WAT 4132 13.560 85.052 158.571 1.00 0.00 O ATOM 86206 H1 WAT 4132 14.170 85.788 158.622 1.00 0.00 H ATOM 86207 H2 WAT 4132 12.834 85.303 159.142 1.00 0.00 H TER 86209 WAT 4132 ATOM 86209 O WAT 4133 5.893 135.719 115.438 1.00 0.00 O ATOM 86210 H1 WAT 4133 6.143 135.566 114.527 1.00 0.00 H ATOM 86211 H2 WAT 4133 6.349 135.037 115.930 1.00 0.00 H TER 86213 WAT 4133 ATOM 86213 O WAT 4134 10.301 40.833 65.577 1.00 0.00 O ATOM 86214 H1 WAT 4134 10.107 40.659 64.656 1.00 0.00 H ATOM 86215 H2 WAT 4134 11.225 40.603 65.676 1.00 0.00 H TER 86217 WAT 4134 ATOM 86217 O WAT 4135 119.598 25.669 8.305 1.00 0.00 O ATOM 86218 H1 WAT 4135 119.477 26.617 8.258 1.00 0.00 H ATOM 86219 H2 WAT 4135 120.478 25.523 7.958 1.00 0.00 H TER 86221 WAT 4135 ATOM 86221 O WAT 4136 84.039 133.942 117.389 1.00 0.00 O ATOM 86222 H1 WAT 4136 83.460 134.221 118.099 1.00 0.00 H ATOM 86223 H2 WAT 4136 84.905 134.258 117.648 1.00 0.00 H TER 86225 WAT 4136 ATOM 86225 O WAT 4137 35.488 90.607 82.584 1.00 0.00 O ATOM 86226 H1 WAT 4137 35.881 90.308 83.404 1.00 0.00 H ATOM 86227 H2 WAT 4137 35.813 89.993 81.925 1.00 0.00 H TER 86229 WAT 4137 ATOM 86229 O WAT 4138 31.668 36.264 105.070 1.00 0.00 O ATOM 86230 H1 WAT 4138 31.626 35.820 104.223 1.00 0.00 H ATOM 86231 H2 WAT 4138 32.425 36.845 104.998 1.00 0.00 H TER 86233 WAT 4138 ATOM 86233 O WAT 4139 86.219 115.509 97.964 1.00 0.00 O ATOM 86234 H1 WAT 4139 86.509 115.354 97.065 1.00 0.00 H ATOM 86235 H2 WAT 4139 85.339 115.875 97.873 1.00 0.00 H TER 86237 WAT 4139 ATOM 86237 O WAT 4140 133.111 81.625 25.865 1.00 0.00 O ATOM 86238 H1 WAT 4140 133.065 81.421 26.799 1.00 0.00 H ATOM 86239 H2 WAT 4140 133.248 82.572 25.832 1.00 0.00 H TER 86241 WAT 4140 ATOM 86241 O WAT 4141 14.138 102.913 14.908 1.00 0.00 O ATOM 86242 H1 WAT 4141 14.509 103.773 14.711 1.00 0.00 H ATOM 86243 H2 WAT 4141 14.117 102.462 14.064 1.00 0.00 H TER 86245 WAT 4141 ATOM 86245 O WAT 4142 103.924 101.860 77.030 1.00 0.00 O ATOM 86246 H1 WAT 4142 103.314 101.438 77.635 1.00 0.00 H ATOM 86247 H2 WAT 4142 103.712 102.792 77.088 1.00 0.00 H TER 86249 WAT 4142 ATOM 86249 O WAT 4143 47.135 85.352 126.239 1.00 0.00 O ATOM 86250 H1 WAT 4143 47.762 86.028 126.497 1.00 0.00 H ATOM 86251 H2 WAT 4143 46.470 85.822 125.736 1.00 0.00 H TER 86253 WAT 4143 ATOM 86253 O WAT 4144 105.734 34.226 104.304 1.00 0.00 O ATOM 86254 H1 WAT 4144 105.638 33.816 103.444 1.00 0.00 H ATOM 86255 H2 WAT 4144 105.892 35.150 104.112 1.00 0.00 H TER 86257 WAT 4144 ATOM 86257 O WAT 4145 48.586 12.291 5.989 1.00 0.00 O ATOM 86258 H1 WAT 4145 48.717 12.285 5.041 1.00 0.00 H ATOM 86259 H2 WAT 4145 49.465 12.396 6.352 1.00 0.00 H TER 86261 WAT 4145 ATOM 86261 O WAT 4146 44.114 128.402 4.519 1.00 0.00 O ATOM 86262 H1 WAT 4146 43.993 127.847 5.289 1.00 0.00 H ATOM 86263 H2 WAT 4146 44.033 129.295 4.852 1.00 0.00 H TER 86265 WAT 4146 ATOM 86265 O WAT 4147 56.926 115.724 154.105 1.00 0.00 O ATOM 86266 H1 WAT 4147 57.628 116.332 153.875 1.00 0.00 H ATOM 86267 H2 WAT 4147 57.284 115.205 154.825 1.00 0.00 H TER 86269 WAT 4147 ATOM 86269 O WAT 4148 75.237 54.591 11.790 1.00 0.00 O ATOM 86270 H1 WAT 4148 74.723 54.246 12.520 1.00 0.00 H ATOM 86271 H2 WAT 4148 74.955 55.502 11.708 1.00 0.00 H TER 86273 WAT 4148 ATOM 86273 O WAT 4149 98.973 4.925 8.300 1.00 0.00 O ATOM 86274 H1 WAT 4149 98.941 4.530 9.172 1.00 0.00 H ATOM 86275 H2 WAT 4149 98.527 4.294 7.735 1.00 0.00 H TER 86277 WAT 4149 ATOM 86277 O WAT 4150 71.529 83.251 146.513 1.00 0.00 O ATOM 86278 H1 WAT 4150 70.898 82.784 145.964 1.00 0.00 H ATOM 86279 H2 WAT 4150 71.015 83.558 147.260 1.00 0.00 H TER 86281 WAT 4150 ATOM 86281 O WAT 4151 125.353 27.299 118.565 1.00 0.00 O ATOM 86282 H1 WAT 4151 125.392 26.515 118.017 1.00 0.00 H ATOM 86283 H2 WAT 4151 126.266 27.569 118.663 1.00 0.00 H TER 86285 WAT 4151 ATOM 86285 O WAT 4152 4.834 102.017 141.270 1.00 0.00 O ATOM 86286 H1 WAT 4152 4.324 102.690 140.818 1.00 0.00 H ATOM 86287 H2 WAT 4152 5.724 102.125 140.933 1.00 0.00 H TER 86289 WAT 4152 ATOM 86289 O WAT 4153 128.527 53.846 80.506 1.00 0.00 O ATOM 86290 H1 WAT 4153 127.897 53.900 79.787 1.00 0.00 H ATOM 86291 H2 WAT 4153 128.007 54.010 81.292 1.00 0.00 H TER 86293 WAT 4153 ATOM 86293 O WAT 4154 110.536 85.944 137.394 1.00 0.00 O ATOM 86294 H1 WAT 4154 111.293 85.875 137.975 1.00 0.00 H ATOM 86295 H2 WAT 4154 109.799 85.637 137.923 1.00 0.00 H TER 86297 WAT 4154 ATOM 86297 O WAT 4155 47.358 63.965 87.694 1.00 0.00 O ATOM 86298 H1 WAT 4155 47.715 63.549 86.909 1.00 0.00 H ATOM 86299 H2 WAT 4155 46.448 64.158 87.471 1.00 0.00 H TER 86301 WAT 4155 ATOM 86301 O WAT 4156 100.513 91.504 83.303 1.00 0.00 O ATOM 86302 H1 WAT 4156 101.081 91.699 84.048 1.00 0.00 H ATOM 86303 H2 WAT 4156 100.974 91.871 82.548 1.00 0.00 H TER 86305 WAT 4156 ATOM 86305 O WAT 4157 62.851 126.811 89.883 1.00 0.00 O ATOM 86306 H1 WAT 4157 63.594 127.080 89.344 1.00 0.00 H ATOM 86307 H2 WAT 4157 62.082 127.101 89.393 1.00 0.00 H TER 86309 WAT 4157 ATOM 86309 O WAT 4158 136.718 0.760 119.723 1.00 0.00 O ATOM 86310 H1 WAT 4158 136.689 1.209 118.878 1.00 0.00 H ATOM 86311 H2 WAT 4158 135.822 0.817 120.055 1.00 0.00 H TER 86313 WAT 4158 ATOM 86313 O WAT 4159 70.153 36.436 54.951 1.00 0.00 O ATOM 86314 H1 WAT 4159 69.581 36.853 54.307 1.00 0.00 H ATOM 86315 H2 WAT 4159 71.001 36.371 54.512 1.00 0.00 H TER 86317 WAT 4159 ATOM 86317 O WAT 4160 95.719 85.693 123.146 1.00 0.00 O ATOM 86318 H1 WAT 4160 95.436 86.560 122.857 1.00 0.00 H ATOM 86319 H2 WAT 4160 95.061 85.095 122.792 1.00 0.00 H TER 86321 WAT 4160 ATOM 86321 O WAT 4161 92.526 90.132 153.678 1.00 0.00 O ATOM 86322 H1 WAT 4161 92.989 90.817 154.159 1.00 0.00 H ATOM 86323 H2 WAT 4161 91.605 90.262 153.904 1.00 0.00 H TER 86325 WAT 4161 ATOM 86325 O WAT 4162 37.622 120.003 59.809 1.00 0.00 O ATOM 86326 H1 WAT 4162 38.287 119.876 59.133 1.00 0.00 H ATOM 86327 H2 WAT 4162 37.717 119.243 60.384 1.00 0.00 H TER 86329 WAT 4162 ATOM 86329 O WAT 4163 112.216 144.619 4.168 1.00 0.00 O ATOM 86330 H1 WAT 4163 111.707 145.429 4.157 1.00 0.00 H ATOM 86331 H2 WAT 4163 112.815 144.722 4.907 1.00 0.00 H TER 86333 WAT 4163 ATOM 86333 O WAT 4164 123.503 36.994 5.233 1.00 0.00 O ATOM 86334 H1 WAT 4164 123.655 36.731 6.141 1.00 0.00 H ATOM 86335 H2 WAT 4164 123.322 36.174 4.773 1.00 0.00 H TER 86337 WAT 4164 ATOM 86337 O WAT 4165 141.590 72.276 157.865 1.00 0.00 O ATOM 86338 H1 WAT 4165 141.024 72.721 158.496 1.00 0.00 H ATOM 86339 H2 WAT 4165 141.130 72.360 157.030 1.00 0.00 H TER 86341 WAT 4165 ATOM 86341 O WAT 4166 29.748 122.480 97.841 1.00 0.00 O ATOM 86342 H1 WAT 4166 29.444 121.981 97.083 1.00 0.00 H ATOM 86343 H2 WAT 4166 30.204 123.233 97.464 1.00 0.00 H TER 86345 WAT 4166 ATOM 86345 O WAT 4167 108.205 62.881 150.528 1.00 0.00 O ATOM 86346 H1 WAT 4167 108.404 62.777 151.458 1.00 0.00 H ATOM 86347 H2 WAT 4167 108.668 63.679 150.272 1.00 0.00 H TER 86349 WAT 4167 ATOM 86349 O WAT 4168 135.070 41.842 116.505 1.00 0.00 O ATOM 86350 H1 WAT 4168 135.420 40.959 116.384 1.00 0.00 H ATOM 86351 H2 WAT 4168 134.946 42.174 115.615 1.00 0.00 H TER 86353 WAT 4168 ATOM 86353 O WAT 4169 93.722 9.552 76.477 1.00 0.00 O ATOM 86354 H1 WAT 4169 94.203 9.331 75.679 1.00 0.00 H ATOM 86355 H2 WAT 4169 94.133 10.358 76.788 1.00 0.00 H TER 86357 WAT 4169 ATOM 86357 O WAT 4170 99.562 28.956 95.174 1.00 0.00 O ATOM 86358 H1 WAT 4170 99.917 29.770 94.816 1.00 0.00 H ATOM 86359 H2 WAT 4170 99.977 28.870 96.032 1.00 0.00 H TER 86361 WAT 4170 ATOM 86361 O WAT 4171 140.000 32.180 147.932 1.00 0.00 O ATOM 86362 H1 WAT 4171 140.362 32.948 148.373 1.00 0.00 H ATOM 86363 H2 WAT 4171 140.765 31.719 147.586 1.00 0.00 H TER 86365 WAT 4171 ATOM 86365 O WAT 4172 136.815 92.013 152.588 1.00 0.00 O ATOM 86366 H1 WAT 4172 137.726 92.065 152.300 1.00 0.00 H ATOM 86367 H2 WAT 4172 136.820 91.352 153.280 1.00 0.00 H TER 86369 WAT 4172 ATOM 86369 O WAT 4173 60.786 80.497 22.213 1.00 0.00 O ATOM 86370 H1 WAT 4173 60.469 80.322 23.099 1.00 0.00 H ATOM 86371 H2 WAT 4173 61.511 79.884 22.093 1.00 0.00 H TER 86373 WAT 4173 ATOM 86373 O WAT 4174 83.950 137.868 117.667 1.00 0.00 O ATOM 86374 H1 WAT 4174 83.610 138.582 118.205 1.00 0.00 H ATOM 86375 H2 WAT 4174 83.172 137.473 117.274 1.00 0.00 H TER 86377 WAT 4174 ATOM 86377 O WAT 4175 134.229 81.426 109.856 1.00 0.00 O ATOM 86378 H1 WAT 4175 134.415 81.588 108.931 1.00 0.00 H ATOM 86379 H2 WAT 4175 134.960 80.886 110.156 1.00 0.00 H TER 86381 WAT 4175 ATOM 86381 O WAT 4176 130.256 29.200 92.050 1.00 0.00 O ATOM 86382 H1 WAT 4176 130.606 29.808 91.399 1.00 0.00 H ATOM 86383 H2 WAT 4176 129.341 29.460 92.154 1.00 0.00 H TER 86385 WAT 4176 ATOM 86385 O WAT 4177 75.517 104.771 9.381 1.00 0.00 O ATOM 86386 H1 WAT 4177 74.873 104.983 8.706 1.00 0.00 H ATOM 86387 H2 WAT 4177 75.778 105.619 9.738 1.00 0.00 H TER 86389 WAT 4177 ATOM 86389 O WAT 4178 117.131 41.966 141.003 1.00 0.00 O ATOM 86390 H1 WAT 4178 117.248 41.016 140.985 1.00 0.00 H ATOM 86391 H2 WAT 4178 117.770 42.273 141.646 1.00 0.00 H TER 86393 WAT 4178 ATOM 86393 O WAT 4179 32.724 124.568 2.315 1.00 0.00 O ATOM 86394 H1 WAT 4179 32.639 125.479 2.598 1.00 0.00 H ATOM 86395 H2 WAT 4179 32.298 124.543 1.458 1.00 0.00 H TER 86397 WAT 4179 ATOM 86397 O WAT 4180 105.179 73.661 12.860 1.00 0.00 O ATOM 86398 H1 WAT 4180 105.596 73.541 12.007 1.00 0.00 H ATOM 86399 H2 WAT 4180 104.767 72.817 13.046 1.00 0.00 H TER 86401 WAT 4180 ATOM 86401 O WAT 4181 120.460 95.502 145.662 1.00 0.00 O ATOM 86402 H1 WAT 4181 119.521 95.316 145.640 1.00 0.00 H ATOM 86403 H2 WAT 4181 120.649 95.883 144.805 1.00 0.00 H TER 86405 WAT 4181 ATOM 86405 O WAT 4182 44.943 9.436 102.116 1.00 0.00 O ATOM 86406 H1 WAT 4182 44.614 8.701 101.598 1.00 0.00 H ATOM 86407 H2 WAT 4182 45.043 9.081 102.999 1.00 0.00 H TER 86409 WAT 4182 ATOM 86409 O WAT 4183 28.770 100.894 114.869 1.00 0.00 O ATOM 86410 H1 WAT 4183 29.403 101.516 115.228 1.00 0.00 H ATOM 86411 H2 WAT 4183 29.307 100.211 114.468 1.00 0.00 H TER 86413 WAT 4183 ATOM 86413 O WAT 4184 17.984 106.667 141.746 1.00 0.00 O ATOM 86414 H1 WAT 4184 17.666 106.025 141.111 1.00 0.00 H ATOM 86415 H2 WAT 4184 18.752 106.254 142.141 1.00 0.00 H TER 86417 WAT 4184 ATOM 86417 O WAT 4185 28.528 104.072 11.667 1.00 0.00 O ATOM 86418 H1 WAT 4185 28.104 104.344 10.853 1.00 0.00 H ATOM 86419 H2 WAT 4185 29.016 103.283 11.431 1.00 0.00 H TER 86421 WAT 4185 ATOM 86421 O WAT 4186 120.758 76.992 125.381 1.00 0.00 O ATOM 86422 H1 WAT 4186 121.272 77.799 125.385 1.00 0.00 H ATOM 86423 H2 WAT 4186 119.937 77.232 124.952 1.00 0.00 H TER 86425 WAT 4186 ATOM 86425 O WAT 4187 104.232 19.484 150.773 1.00 0.00 O ATOM 86426 H1 WAT 4187 104.005 19.620 149.853 1.00 0.00 H ATOM 86427 H2 WAT 4187 103.413 19.631 151.247 1.00 0.00 H TER 86429 WAT 4187 ATOM 86429 O WAT 4188 2.669 57.909 143.075 1.00 0.00 O ATOM 86430 H1 WAT 4188 1.917 57.949 142.484 1.00 0.00 H ATOM 86431 H2 WAT 4188 2.334 57.478 143.861 1.00 0.00 H TER 86433 WAT 4188 ATOM 86433 O WAT 4189 117.183 71.405 93.035 1.00 0.00 O ATOM 86434 H1 WAT 4189 117.506 71.558 93.923 1.00 0.00 H ATOM 86435 H2 WAT 4189 116.237 71.298 93.139 1.00 0.00 H TER 86437 WAT 4189 ATOM 86437 O WAT 4190 78.801 88.742 143.053 1.00 0.00 O ATOM 86438 H1 WAT 4190 79.336 88.447 143.790 1.00 0.00 H ATOM 86439 H2 WAT 4190 79.373 89.335 142.565 1.00 0.00 H TER 86441 WAT 4190 ATOM 86441 O WAT 4191 90.996 80.575 100.431 1.00 0.00 O ATOM 86442 H1 WAT 4191 91.945 80.559 100.560 1.00 0.00 H ATOM 86443 H2 WAT 4191 90.635 80.608 101.317 1.00 0.00 H TER 86445 WAT 4191 ATOM 86445 O WAT 4192 95.861 76.229 64.928 1.00 0.00 O ATOM 86446 H1 WAT 4192 95.579 75.549 64.316 1.00 0.00 H ATOM 86447 H2 WAT 4192 96.817 76.184 64.912 1.00 0.00 H TER 86449 WAT 4192 ATOM 86449 O WAT 4193 45.533 83.073 92.711 1.00 0.00 O ATOM 86450 H1 WAT 4193 45.146 83.948 92.741 1.00 0.00 H ATOM 86451 H2 WAT 4193 45.330 82.751 91.833 1.00 0.00 H TER 86453 WAT 4193 ATOM 86453 O WAT 4194 62.058 41.830 145.367 1.00 0.00 O ATOM 86454 H1 WAT 4194 62.603 41.640 146.130 1.00 0.00 H ATOM 86455 H2 WAT 4194 61.918 42.776 145.402 1.00 0.00 H TER 86457 WAT 4194 ATOM 86457 O WAT 4195 25.294 107.952 16.052 1.00 0.00 O ATOM 86458 H1 WAT 4195 24.437 108.368 16.145 1.00 0.00 H ATOM 86459 H2 WAT 4195 25.103 107.094 15.674 1.00 0.00 H TER 86461 WAT 4195 ATOM 86461 O WAT 4196 63.604 126.537 78.295 1.00 0.00 O ATOM 86462 H1 WAT 4196 63.016 126.505 77.541 1.00 0.00 H ATOM 86463 H2 WAT 4196 63.827 127.464 78.385 1.00 0.00 H TER 86465 WAT 4196 ATOM 86465 O WAT 4197 97.742 11.121 117.580 1.00 0.00 O ATOM 86466 H1 WAT 4197 97.490 11.790 118.217 1.00 0.00 H ATOM 86467 H2 WAT 4197 98.699 11.155 117.563 1.00 0.00 H TER 86469 WAT 4197 ATOM 86469 O WAT 4198 44.529 53.509 130.157 1.00 0.00 O ATOM 86470 H1 WAT 4198 44.682 52.600 129.898 1.00 0.00 H ATOM 86471 H2 WAT 4198 43.586 53.633 130.051 1.00 0.00 H TER 86473 WAT 4198 ATOM 86473 O WAT 4199 69.194 43.156 91.221 1.00 0.00 O ATOM 86474 H1 WAT 4199 68.755 42.490 90.692 1.00 0.00 H ATOM 86475 H2 WAT 4199 69.053 42.874 92.125 1.00 0.00 H TER 86477 WAT 4199 ATOM 86477 O WAT 4200 8.461 138.146 126.484 1.00 0.00 O ATOM 86478 H1 WAT 4200 8.430 138.745 127.230 1.00 0.00 H ATOM 86479 H2 WAT 4200 8.569 137.280 126.876 1.00 0.00 H TER 86481 WAT 4200 ATOM 86481 O WAT 4201 14.858 115.199 62.711 1.00 0.00 O ATOM 86482 H1 WAT 4201 14.440 114.624 62.071 1.00 0.00 H ATOM 86483 H2 WAT 4201 15.700 114.782 62.894 1.00 0.00 H TER 86485 WAT 4201 ATOM 86485 O WAT 4202 71.858 68.431 79.170 1.00 0.00 O ATOM 86486 H1 WAT 4202 70.991 68.779 78.961 1.00 0.00 H ATOM 86487 H2 WAT 4202 71.756 67.481 79.106 1.00 0.00 H TER 86489 WAT 4202 ATOM 86489 O WAT 4203 7.925 131.203 66.834 1.00 0.00 O ATOM 86490 H1 WAT 4203 7.249 131.881 66.869 1.00 0.00 H ATOM 86491 H2 WAT 4203 8.510 131.485 66.130 1.00 0.00 H TER 86493 WAT 4203 ATOM 86493 O WAT 4204 79.946 89.193 70.269 1.00 0.00 O ATOM 86494 H1 WAT 4204 79.540 89.295 69.408 1.00 0.00 H ATOM 86495 H2 WAT 4204 80.702 89.779 70.249 1.00 0.00 H TER 86497 WAT 4204 ATOM 86497 O WAT 4205 21.975 32.220 88.504 1.00 0.00 O ATOM 86498 H1 WAT 4205 22.478 31.423 88.338 1.00 0.00 H ATOM 86499 H2 WAT 4205 21.831 32.219 89.451 1.00 0.00 H TER 86501 WAT 4205 ATOM 86501 O WAT 4206 139.331 123.453 135.390 1.00 0.00 O ATOM 86502 H1 WAT 4206 139.141 122.681 135.922 1.00 0.00 H ATOM 86503 H2 WAT 4206 139.833 123.115 134.648 1.00 0.00 H TER 86505 WAT 4206 ATOM 86505 O WAT 4207 30.592 89.930 16.725 1.00 0.00 O ATOM 86506 H1 WAT 4207 30.082 90.227 17.478 1.00 0.00 H ATOM 86507 H2 WAT 4207 30.742 88.999 16.890 1.00 0.00 H TER 86509 WAT 4207 ATOM 86509 O WAT 4208 51.557 87.927 143.525 1.00 0.00 O ATOM 86510 H1 WAT 4208 52.303 87.396 143.248 1.00 0.00 H ATOM 86511 H2 WAT 4208 50.882 87.753 142.868 1.00 0.00 H TER 86513 WAT 4208 ATOM 86513 O WAT 4209 9.275 130.549 99.404 1.00 0.00 O ATOM 86514 H1 WAT 4209 8.989 131.252 99.987 1.00 0.00 H ATOM 86515 H2 WAT 4209 8.516 129.969 99.337 1.00 0.00 H TER 86517 WAT 4209 ATOM 86517 O WAT 4210 20.141 64.511 92.409 1.00 0.00 O ATOM 86518 H1 WAT 4210 20.504 64.733 91.552 1.00 0.00 H ATOM 86519 H2 WAT 4210 19.893 65.354 92.789 1.00 0.00 H TER 86521 WAT 4210 ATOM 86521 O WAT 4211 95.557 86.921 154.365 1.00 0.00 O ATOM 86522 H1 WAT 4211 96.427 86.521 154.385 1.00 0.00 H ATOM 86523 H2 WAT 4211 95.549 87.514 155.116 1.00 0.00 H TER 86525 WAT 4211 ATOM 86525 O WAT 4212 93.714 44.757 133.155 1.00 0.00 O ATOM 86526 H1 WAT 4212 93.860 45.217 132.328 1.00 0.00 H ATOM 86527 H2 WAT 4212 94.411 44.101 133.190 1.00 0.00 H TER 86529 WAT 4212 ATOM 86529 O WAT 4213 48.180 47.921 7.529 1.00 0.00 O ATOM 86530 H1 WAT 4213 47.721 48.669 7.145 1.00 0.00 H ATOM 86531 H2 WAT 4213 49.107 48.110 7.384 1.00 0.00 H TER 86533 WAT 4213 ATOM 86533 O WAT 4214 20.247 96.948 107.129 1.00 0.00 O ATOM 86534 H1 WAT 4214 20.883 96.769 107.822 1.00 0.00 H ATOM 86535 H2 WAT 4214 19.775 97.724 107.433 1.00 0.00 H TER 86537 WAT 4214 ATOM 86537 O WAT 4215 90.781 67.860 135.688 1.00 0.00 O ATOM 86538 H1 WAT 4215 90.702 68.145 134.778 1.00 0.00 H ATOM 86539 H2 WAT 4215 91.547 68.329 136.020 1.00 0.00 H TER 86541 WAT 4215 ATOM 86541 O WAT 4216 81.115 88.437 120.952 1.00 0.00 O ATOM 86542 H1 WAT 4216 81.372 87.515 120.984 1.00 0.00 H ATOM 86543 H2 WAT 4216 81.274 88.698 120.045 1.00 0.00 H TER 86545 WAT 4216 ATOM 86545 O WAT 4217 99.389 19.944 19.508 1.00 0.00 O ATOM 86546 H1 WAT 4217 100.336 19.981 19.372 1.00 0.00 H ATOM 86547 H2 WAT 4217 99.274 19.309 20.215 1.00 0.00 H TER 86549 WAT 4217 ATOM 86549 O WAT 4218 67.918 25.694 130.573 1.00 0.00 O ATOM 86550 H1 WAT 4218 67.114 25.857 130.080 1.00 0.00 H ATOM 86551 H2 WAT 4218 68.510 25.289 129.940 1.00 0.00 H TER 86553 WAT 4218 ATOM 86553 O WAT 4219 70.350 11.367 147.457 1.00 0.00 O ATOM 86554 H1 WAT 4219 69.563 11.862 147.228 1.00 0.00 H ATOM 86555 H2 WAT 4219 71.002 12.035 147.664 1.00 0.00 H TER 86557 WAT 4219 ATOM 86557 O WAT 4220 43.110 23.612 16.530 1.00 0.00 O ATOM 86558 H1 WAT 4220 43.830 24.216 16.345 1.00 0.00 H ATOM 86559 H2 WAT 4220 43.465 23.012 17.185 1.00 0.00 H TER 86561 WAT 4220 ATOM 86561 O WAT 4221 119.656 126.700 58.174 1.00 0.00 O ATOM 86562 H1 WAT 4221 120.165 126.470 58.951 1.00 0.00 H ATOM 86563 H2 WAT 4221 120.095 126.245 57.456 1.00 0.00 H TER 86565 WAT 4221 ATOM 86565 O WAT 4222 88.759 118.541 11.870 1.00 0.00 O ATOM 86566 H1 WAT 4222 88.736 117.705 12.336 1.00 0.00 H ATOM 86567 H2 WAT 4222 89.537 118.485 11.315 1.00 0.00 H TER 86569 WAT 4222 ATOM 86569 O WAT 4223 10.386 137.623 149.959 1.00 0.00 O ATOM 86570 H1 WAT 4223 11.043 138.108 150.459 1.00 0.00 H ATOM 86571 H2 WAT 4223 9.665 138.243 149.846 1.00 0.00 H TER 86573 WAT 4223 ATOM 86573 O WAT 4224 32.252 41.661 66.101 1.00 0.00 O ATOM 86574 H1 WAT 4224 32.871 41.010 65.769 1.00 0.00 H ATOM 86575 H2 WAT 4224 31.407 41.211 66.097 1.00 0.00 H TER 86577 WAT 4224 ATOM 86577 O WAT 4225 96.485 62.724 88.111 1.00 0.00 O ATOM 86578 H1 WAT 4225 96.082 63.540 88.406 1.00 0.00 H ATOM 86579 H2 WAT 4225 97.423 62.910 88.099 1.00 0.00 H TER 86581 WAT 4225 ATOM 86581 O WAT 4226 1.244 37.981 74.192 1.00 0.00 O ATOM 86582 H1 WAT 4226 1.264 38.001 73.235 1.00 0.00 H ATOM 86583 H2 WAT 4226 2.021 37.479 74.437 1.00 0.00 H TER 86585 WAT 4226 ATOM 86585 O WAT 4227 31.264 84.362 130.241 1.00 0.00 O ATOM 86586 H1 WAT 4227 31.441 85.223 129.862 1.00 0.00 H ATOM 86587 H2 WAT 4227 30.847 84.552 131.081 1.00 0.00 H TER 86589 WAT 4227 ATOM 86589 O WAT 4228 31.276 31.761 73.291 1.00 0.00 O ATOM 86590 H1 WAT 4228 31.583 32.476 72.732 1.00 0.00 H ATOM 86591 H2 WAT 4228 32.060 31.241 73.466 1.00 0.00 H TER 86593 WAT 4228 ATOM 86593 O WAT 4229 75.530 145.162 99.837 1.00 0.00 O ATOM 86594 H1 WAT 4229 76.015 145.197 100.662 1.00 0.00 H ATOM 86595 H2 WAT 4229 75.020 145.971 99.825 1.00 0.00 H TER 86597 WAT 4229 ATOM 86597 O WAT 4230 100.859 95.431 13.610 1.00 0.00 O ATOM 86598 H1 WAT 4230 100.317 94.721 13.955 1.00 0.00 H ATOM 86599 H2 WAT 4230 100.558 96.210 14.077 1.00 0.00 H TER 86601 WAT 4230 ATOM 86601 O WAT 4231 50.277 130.538 141.062 1.00 0.00 O ATOM 86602 H1 WAT 4231 50.120 129.722 141.536 1.00 0.00 H ATOM 86603 H2 WAT 4231 49.455 131.023 141.141 1.00 0.00 H TER 86605 WAT 4231 ATOM 86605 O WAT 4232 104.860 5.337 131.465 1.00 0.00 O ATOM 86606 H1 WAT 4232 105.482 5.290 132.191 1.00 0.00 H ATOM 86607 H2 WAT 4232 104.023 5.079 131.851 1.00 0.00 H TER 86609 WAT 4232 ATOM 86609 O WAT 4233 89.188 5.598 97.174 1.00 0.00 O ATOM 86610 H1 WAT 4233 88.394 5.716 96.653 1.00 0.00 H ATOM 86611 H2 WAT 4233 89.055 4.767 97.629 1.00 0.00 H TER 86613 WAT 4233 ATOM 86613 O WAT 4234 123.359 53.037 143.078 1.00 0.00 O ATOM 86614 H1 WAT 4234 123.763 53.529 143.793 1.00 0.00 H ATOM 86615 H2 WAT 4234 124.080 52.541 142.691 1.00 0.00 H TER 86617 WAT 4234 ATOM 86617 O WAT 4235 68.920 119.604 12.110 1.00 0.00 O ATOM 86618 H1 WAT 4235 68.342 119.122 12.702 1.00 0.00 H ATOM 86619 H2 WAT 4235 68.649 120.518 12.204 1.00 0.00 H TER 86621 WAT 4235 ATOM 86621 O WAT 4236 69.619 10.361 78.213 1.00 0.00 O ATOM 86622 H1 WAT 4236 69.618 10.994 77.496 1.00 0.00 H ATOM 86623 H2 WAT 4236 69.017 9.674 77.928 1.00 0.00 H TER 86625 WAT 4236 ATOM 86625 O WAT 4237 6.268 10.240 130.482 1.00 0.00 O ATOM 86626 H1 WAT 4237 6.363 9.553 129.822 1.00 0.00 H ATOM 86627 H2 WAT 4237 7.088 10.731 130.438 1.00 0.00 H TER 86629 WAT 4237 ATOM 86629 O WAT 4238 115.203 97.944 156.453 1.00 0.00 O ATOM 86630 H1 WAT 4238 115.664 98.030 155.618 1.00 0.00 H ATOM 86631 H2 WAT 4238 115.452 97.078 156.776 1.00 0.00 H TER 86633 WAT 4238 ATOM 86633 O WAT 4239 13.854 99.394 78.793 1.00 0.00 O ATOM 86634 H1 WAT 4239 14.762 99.141 78.957 1.00 0.00 H ATOM 86635 H2 WAT 4239 13.543 98.764 78.143 1.00 0.00 H TER 86637 WAT 4239 ATOM 86637 O WAT 4240 32.358 144.294 93.383 1.00 0.00 O ATOM 86638 H1 WAT 4240 31.824 144.263 94.177 1.00 0.00 H ATOM 86639 H2 WAT 4240 33.105 143.728 93.576 1.00 0.00 H TER 86641 WAT 4240 ATOM 86641 O WAT 4241 24.323 121.552 139.987 1.00 0.00 O ATOM 86642 H1 WAT 4241 23.576 122.052 139.660 1.00 0.00 H ATOM 86643 H2 WAT 4241 24.056 120.637 139.899 1.00 0.00 H TER 86645 WAT 4241 ATOM 86645 O WAT 4242 37.340 55.098 76.377 1.00 0.00 O ATOM 86646 H1 WAT 4242 37.413 55.285 75.441 1.00 0.00 H ATOM 86647 H2 WAT 4242 36.771 55.789 76.716 1.00 0.00 H TER 86649 WAT 4242 ATOM 86649 O WAT 4243 37.237 31.947 129.035 1.00 0.00 O ATOM 86650 H1 WAT 4243 37.398 32.481 128.257 1.00 0.00 H ATOM 86651 H2 WAT 4243 37.886 31.245 128.982 1.00 0.00 H TER 86653 WAT 4243 ATOM 86653 O WAT 4244 78.558 102.996 145.973 1.00 0.00 O ATOM 86654 H1 WAT 4244 78.126 103.660 145.436 1.00 0.00 H ATOM 86655 H2 WAT 4244 79.429 103.355 146.145 1.00 0.00 H TER 86657 WAT 4244 ATOM 86657 O WAT 4245 55.295 124.911 9.083 1.00 0.00 O ATOM 86658 H1 WAT 4245 56.040 124.454 9.474 1.00 0.00 H ATOM 86659 H2 WAT 4245 54.785 125.221 9.831 1.00 0.00 H TER 86661 WAT 4245 ATOM 86661 O WAT 4246 48.157 64.967 123.510 1.00 0.00 O ATOM 86662 H1 WAT 4246 48.926 65.537 123.530 1.00 0.00 H ATOM 86663 H2 WAT 4246 48.255 64.406 124.280 1.00 0.00 H TER 86665 WAT 4246 ATOM 86665 O WAT 4247 57.869 29.227 81.786 1.00 0.00 O ATOM 86666 H1 WAT 4247 58.707 29.571 81.476 1.00 0.00 H ATOM 86667 H2 WAT 4247 57.988 28.277 81.793 1.00 0.00 H TER 86669 WAT 4247 ATOM 86669 O WAT 4248 116.741 108.503 67.412 1.00 0.00 O ATOM 86670 H1 WAT 4248 117.006 108.177 66.552 1.00 0.00 H ATOM 86671 H2 WAT 4248 115.805 108.309 67.464 1.00 0.00 H TER 86673 WAT 4248 ATOM 86673 O WAT 4249 85.150 45.920 150.920 1.00 0.00 O ATOM 86674 H1 WAT 4249 84.292 46.220 150.622 1.00 0.00 H ATOM 86675 H2 WAT 4249 85.182 46.167 151.845 1.00 0.00 H TER 86677 WAT 4249 ATOM 86677 O WAT 4250 131.450 9.420 58.804 1.00 0.00 O ATOM 86678 H1 WAT 4250 132.032 9.156 59.517 1.00 0.00 H ATOM 86679 H2 WAT 4250 130.590 9.504 59.215 1.00 0.00 H TER 86681 WAT 4250 ATOM 86681 O WAT 4251 42.076 15.633 136.992 1.00 0.00 O ATOM 86682 H1 WAT 4251 42.653 15.379 136.272 1.00 0.00 H ATOM 86683 H2 WAT 4251 41.491 14.884 137.105 1.00 0.00 H TER 86685 WAT 4251 ATOM 86685 O WAT 4252 27.182 23.851 87.389 1.00 0.00 O ATOM 86686 H1 WAT 4252 28.043 23.998 87.782 1.00 0.00 H ATOM 86687 H2 WAT 4252 27.206 22.941 87.095 1.00 0.00 H TER 86689 WAT 4252 ATOM 86689 O WAT 4253 4.810 85.026 98.561 1.00 0.00 O ATOM 86690 H1 WAT 4253 4.613 85.207 97.642 1.00 0.00 H ATOM 86691 H2 WAT 4253 4.578 84.106 98.680 1.00 0.00 H TER 86693 WAT 4253 ATOM 86693 O WAT 4254 10.916 144.475 117.669 1.00 0.00 O ATOM 86694 H1 WAT 4254 10.675 144.774 116.792 1.00 0.00 H ATOM 86695 H2 WAT 4254 10.203 144.780 118.230 1.00 0.00 H TER 86697 WAT 4254 ATOM 86697 O WAT 4255 83.285 90.713 125.955 1.00 0.00 O ATOM 86698 H1 WAT 4255 82.473 90.958 126.400 1.00 0.00 H ATOM 86699 H2 WAT 4255 83.760 91.537 125.852 1.00 0.00 H TER 86701 WAT 4255 ATOM 86701 O WAT 4256 0.836 109.132 113.984 1.00 0.00 O ATOM 86702 H1 WAT 4256 0.042 108.604 114.071 1.00 0.00 H ATOM 86703 H2 WAT 4256 1.547 108.539 114.228 1.00 0.00 H TER 86705 WAT 4256 ATOM 86705 O WAT 4257 6.163 96.179 135.977 1.00 0.00 O ATOM 86706 H1 WAT 4257 6.733 95.790 135.315 1.00 0.00 H ATOM 86707 H2 WAT 4257 5.589 95.463 136.250 1.00 0.00 H TER 86709 WAT 4257 ATOM 86709 O WAT 4258 38.656 9.812 64.991 1.00 0.00 O ATOM 86710 H1 WAT 4258 38.027 9.095 64.914 1.00 0.00 H ATOM 86711 H2 WAT 4258 38.534 10.144 65.880 1.00 0.00 H TER 86713 WAT 4258 ATOM 86713 O WAT 4259 80.859 114.277 110.933 1.00 0.00 O ATOM 86714 H1 WAT 4259 81.164 113.534 111.453 1.00 0.00 H ATOM 86715 H2 WAT 4259 81.479 114.979 111.132 1.00 0.00 H TER 86717 WAT 4259 ATOM 86717 O WAT 4260 23.950 96.396 135.691 1.00 0.00 O ATOM 86718 H1 WAT 4260 24.567 96.199 136.396 1.00 0.00 H ATOM 86719 H2 WAT 4260 23.257 96.903 136.115 1.00 0.00 H TER 86721 WAT 4260 ATOM 86721 O WAT 4261 15.875 86.289 82.147 1.00 0.00 O ATOM 86722 H1 WAT 4261 15.162 86.658 81.625 1.00 0.00 H ATOM 86723 H2 WAT 4261 15.474 85.559 82.618 1.00 0.00 H TER 86725 WAT 4261 ATOM 86725 O WAT 4262 135.190 68.359 106.363 1.00 0.00 O ATOM 86726 H1 WAT 4262 134.947 68.067 105.484 1.00 0.00 H ATOM 86727 H2 WAT 4262 135.924 68.957 106.222 1.00 0.00 H TER 86729 WAT 4262 ATOM 86729 O WAT 4263 81.900 33.210 76.508 1.00 0.00 O ATOM 86730 H1 WAT 4263 81.760 32.454 77.079 1.00 0.00 H ATOM 86731 H2 WAT 4263 82.729 33.027 76.066 1.00 0.00 H TER 86733 WAT 4263 ATOM 86733 O WAT 4264 108.089 30.334 70.693 1.00 0.00 O ATOM 86734 H1 WAT 4264 108.336 30.489 71.605 1.00 0.00 H ATOM 86735 H2 WAT 4264 107.802 31.189 70.374 1.00 0.00 H TER 86737 WAT 4264 ATOM 86737 O WAT 4265 126.057 114.019 122.241 1.00 0.00 O ATOM 86738 H1 WAT 4265 125.573 114.057 121.415 1.00 0.00 H ATOM 86739 H2 WAT 4265 125.461 113.581 122.848 1.00 0.00 H TER 86741 WAT 4265 ATOM 86741 O WAT 4266 75.531 117.587 61.698 1.00 0.00 O ATOM 86742 H1 WAT 4266 74.919 117.587 62.434 1.00 0.00 H ATOM 86743 H2 WAT 4266 76.237 117.003 61.974 1.00 0.00 H TER 86745 WAT 4266 ATOM 86745 O WAT 4267 145.480 84.198 60.986 1.00 0.00 O ATOM 86746 H1 WAT 4267 145.539 84.719 61.787 1.00 0.00 H ATOM 86747 H2 WAT 4267 145.770 84.791 60.293 1.00 0.00 H TER 86749 WAT 4267 ATOM 86749 O WAT 4268 44.673 73.184 134.391 1.00 0.00 O ATOM 86750 H1 WAT 4268 44.578 72.245 134.555 1.00 0.00 H ATOM 86751 H2 WAT 4268 44.382 73.299 133.486 1.00 0.00 H TER 86753 WAT 4268 ATOM 86753 O WAT 4269 25.641 45.989 117.075 1.00 0.00 O ATOM 86754 H1 WAT 4269 25.766 46.072 116.130 1.00 0.00 H ATOM 86755 H2 WAT 4269 24.701 45.841 117.180 1.00 0.00 H TER 86757 WAT 4269 ATOM 86757 O WAT 4270 116.551 6.390 123.493 1.00 0.00 O ATOM 86758 H1 WAT 4270 116.703 5.747 124.186 1.00 0.00 H ATOM 86759 H2 WAT 4270 116.851 5.956 122.695 1.00 0.00 H TER 86761 WAT 4270 ATOM 86761 O WAT 4271 80.800 72.144 97.967 1.00 0.00 O ATOM 86762 H1 WAT 4271 80.603 73.070 97.828 1.00 0.00 H ATOM 86763 H2 WAT 4271 79.960 71.755 98.211 1.00 0.00 H TER 86765 WAT 4271 ATOM 86765 O WAT 4272 112.315 91.096 145.715 1.00 0.00 O ATOM 86766 H1 WAT 4272 112.556 91.455 144.861 1.00 0.00 H ATOM 86767 H2 WAT 4272 113.083 90.596 145.990 1.00 0.00 H TER 86769 WAT 4272 ATOM 86769 O WAT 4273 126.049 32.357 126.374 1.00 0.00 O ATOM 86770 H1 WAT 4273 126.309 31.711 127.031 1.00 0.00 H ATOM 86771 H2 WAT 4273 126.609 33.114 126.548 1.00 0.00 H TER 86773 WAT 4273 ATOM 86773 O WAT 4274 70.187 127.820 98.433 1.00 0.00 O ATOM 86774 H1 WAT 4274 69.459 128.437 98.510 1.00 0.00 H ATOM 86775 H2 WAT 4274 70.133 127.498 97.533 1.00 0.00 H TER 86777 WAT 4274 ATOM 86777 O WAT 4275 15.870 5.171 143.464 1.00 0.00 O ATOM 86778 H1 WAT 4275 16.540 4.825 144.054 1.00 0.00 H ATOM 86779 H2 WAT 4275 15.874 4.571 142.719 1.00 0.00 H TER 86781 WAT 4275 ATOM 86781 O WAT 4276 119.864 118.127 119.913 1.00 0.00 O ATOM 86782 H1 WAT 4276 120.336 118.541 119.191 1.00 0.00 H ATOM 86783 H2 WAT 4276 120.347 118.387 120.696 1.00 0.00 H TER 86785 WAT 4276 ATOM 86785 O WAT 4277 20.223 142.193 16.696 1.00 0.00 O ATOM 86786 H1 WAT 4277 20.592 142.102 17.575 1.00 0.00 H ATOM 86787 H2 WAT 4277 19.288 142.023 16.810 1.00 0.00 H TER 86789 WAT 4277 ATOM 86789 O WAT 4278 27.330 26.451 10.418 1.00 0.00 O ATOM 86790 H1 WAT 4278 28.267 26.534 10.242 1.00 0.00 H ATOM 86791 H2 WAT 4278 26.916 26.541 9.560 1.00 0.00 H TER 86793 WAT 4278 ATOM 86793 O WAT 4279 121.112 75.458 74.011 1.00 0.00 O ATOM 86794 H1 WAT 4279 121.417 74.702 74.513 1.00 0.00 H ATOM 86795 H2 WAT 4279 120.484 75.094 73.387 1.00 0.00 H TER 86797 WAT 4279 ATOM 86797 O WAT 4280 136.343 20.269 101.751 1.00 0.00 O ATOM 86798 H1 WAT 4280 135.461 20.640 101.722 1.00 0.00 H ATOM 86799 H2 WAT 4280 136.203 19.324 101.807 1.00 0.00 H TER 86801 WAT 4280 ATOM 86801 O WAT 4281 94.086 104.250 111.089 1.00 0.00 O ATOM 86802 H1 WAT 4281 93.955 103.866 111.956 1.00 0.00 H ATOM 86803 H2 WAT 4281 93.203 104.457 110.783 1.00 0.00 H TER 86805 WAT 4281 ATOM 86805 O WAT 4282 84.021 126.541 57.721 1.00 0.00 O ATOM 86806 H1 WAT 4282 83.731 126.085 56.931 1.00 0.00 H ATOM 86807 H2 WAT 4282 83.303 126.425 58.343 1.00 0.00 H TER 86809 WAT 4282 ATOM 86809 O WAT 4283 128.067 142.086 112.357 1.00 0.00 O ATOM 86810 H1 WAT 4283 128.465 141.324 111.936 1.00 0.00 H ATOM 86811 H2 WAT 4283 128.239 142.810 111.754 1.00 0.00 H TER 86813 WAT 4283 ATOM 86813 O WAT 4284 65.138 91.526 147.203 1.00 0.00 O ATOM 86814 H1 WAT 4284 65.676 92.128 147.717 1.00 0.00 H ATOM 86815 H2 WAT 4284 64.921 92.015 146.410 1.00 0.00 H TER 86817 WAT 4284 ATOM 86817 O WAT 4285 86.497 121.603 114.698 1.00 0.00 O ATOM 86818 H1 WAT 4285 86.630 121.331 113.790 1.00 0.00 H ATOM 86819 H2 WAT 4285 85.595 121.348 114.894 1.00 0.00 H TER 86821 WAT 4285 ATOM 86821 O WAT 4286 20.974 81.200 147.375 1.00 0.00 O ATOM 86822 H1 WAT 4286 20.385 81.886 147.061 1.00 0.00 H ATOM 86823 H2 WAT 4286 21.852 81.557 147.238 1.00 0.00 H TER 86825 WAT 4286 ATOM 86825 O WAT 4287 40.061 60.582 3.181 1.00 0.00 O ATOM 86826 H1 WAT 4287 40.900 60.190 2.936 1.00 0.00 H ATOM 86827 H2 WAT 4287 39.515 59.839 3.436 1.00 0.00 H TER 86829 WAT 4287 ATOM 86829 O WAT 4288 0.707 59.623 26.908 1.00 0.00 O ATOM 86830 H1 WAT 4288 1.543 59.710 26.450 1.00 0.00 H ATOM 86831 H2 WAT 4288 0.065 60.006 26.310 1.00 0.00 H TER 86833 WAT 4288 ATOM 86833 O WAT 4289 82.171 124.456 18.983 1.00 0.00 O ATOM 86834 H1 WAT 4289 82.029 125.280 19.448 1.00 0.00 H ATOM 86835 H2 WAT 4289 81.687 123.806 19.493 1.00 0.00 H TER 86837 WAT 4289 ATOM 86837 O WAT 4290 95.370 31.060 5.581 1.00 0.00 O ATOM 86838 H1 WAT 4290 96.144 31.465 5.972 1.00 0.00 H ATOM 86839 H2 WAT 4290 95.028 30.486 6.266 1.00 0.00 H TER 86841 WAT 4290 ATOM 86841 O WAT 4291 98.083 118.157 4.608 1.00 0.00 O ATOM 86842 H1 WAT 4291 98.836 118.388 5.152 1.00 0.00 H ATOM 86843 H2 WAT 4291 97.350 118.633 4.998 1.00 0.00 H TER 86845 WAT 4291 ATOM 86845 O WAT 4292 27.644 100.346 103.537 1.00 0.00 O ATOM 86846 H1 WAT 4292 28.505 100.065 103.844 1.00 0.00 H ATOM 86847 H2 WAT 4292 27.066 99.609 103.734 1.00 0.00 H TER 86849 WAT 4292 ATOM 86849 O WAT 4293 35.477 121.561 154.535 1.00 0.00 O ATOM 86850 H1 WAT 4293 35.417 121.791 153.608 1.00 0.00 H ATOM 86851 H2 WAT 4293 35.113 120.677 154.587 1.00 0.00 H TER 86853 WAT 4293 ATOM 86853 O WAT 4294 1.971 82.811 127.845 1.00 0.00 O ATOM 86854 H1 WAT 4294 2.832 82.966 128.232 1.00 0.00 H ATOM 86855 H2 WAT 4294 1.358 82.922 128.572 1.00 0.00 H TER 86857 WAT 4294 ATOM 86857 O WAT 4295 88.060 56.807 74.729 1.00 0.00 O ATOM 86858 H1 WAT 4295 87.969 56.989 75.665 1.00 0.00 H ATOM 86859 H2 WAT 4295 87.161 56.718 74.414 1.00 0.00 H TER 86861 WAT 4295 ATOM 86861 O WAT 4296 49.530 106.482 88.273 1.00 0.00 O ATOM 86862 H1 WAT 4296 49.233 107.123 87.628 1.00 0.00 H ATOM 86863 H2 WAT 4296 49.216 105.642 87.938 1.00 0.00 H TER 86865 WAT 4296 ATOM 86865 O WAT 4297 1.917 117.785 94.329 1.00 0.00 O ATOM 86866 H1 WAT 4297 2.416 117.888 93.519 1.00 0.00 H ATOM 86867 H2 WAT 4297 1.266 118.486 94.300 1.00 0.00 H TER 86869 WAT 4297 ATOM 86869 O WAT 4298 47.634 137.915 150.683 1.00 0.00 O ATOM 86870 H1 WAT 4298 46.774 137.840 150.269 1.00 0.00 H ATOM 86871 H2 WAT 4298 48.156 138.421 150.060 1.00 0.00 H TER 86873 WAT 4298 ATOM 86873 O WAT 4299 30.684 31.480 62.829 1.00 0.00 O ATOM 86874 H1 WAT 4299 31.099 32.020 62.156 1.00 0.00 H ATOM 86875 H2 WAT 4299 31.186 31.661 63.624 1.00 0.00 H TER 86877 WAT 4299 ATOM 86877 O WAT 4300 30.001 86.866 157.666 1.00 0.00 O ATOM 86878 H1 WAT 4300 29.424 87.328 157.058 1.00 0.00 H ATOM 86879 H2 WAT 4300 30.103 85.994 157.285 1.00 0.00 H TER 86881 WAT 4300 ATOM 86881 O WAT 4301 12.870 23.744 151.647 1.00 0.00 O ATOM 86882 H1 WAT 4301 12.925 22.851 151.306 1.00 0.00 H ATOM 86883 H2 WAT 4301 12.466 24.247 150.940 1.00 0.00 H TER 86885 WAT 4301 ATOM 86885 O WAT 4302 30.199 44.598 100.467 1.00 0.00 O ATOM 86886 H1 WAT 4302 31.150 44.695 100.430 1.00 0.00 H ATOM 86887 H2 WAT 4302 30.013 44.410 101.387 1.00 0.00 H TER 86889 WAT 4302 ATOM 86889 O WAT 4303 134.004 141.605 101.582 1.00 0.00 O ATOM 86890 H1 WAT 4303 134.065 142.005 100.715 1.00 0.00 H ATOM 86891 H2 WAT 4303 134.913 141.443 101.836 1.00 0.00 H TER 86893 WAT 4303 ATOM 86893 O WAT 4304 57.199 13.785 82.921 1.00 0.00 O ATOM 86894 H1 WAT 4304 58.135 13.693 83.102 1.00 0.00 H ATOM 86895 H2 WAT 4304 56.797 13.028 83.347 1.00 0.00 H TER 86897 WAT 4304 ATOM 86897 O WAT 4305 52.065 5.453 106.838 1.00 0.00 O ATOM 86898 H1 WAT 4305 51.698 6.337 106.823 1.00 0.00 H ATOM 86899 H2 WAT 4305 51.422 4.935 107.322 1.00 0.00 H TER 86901 WAT 4305 ATOM 86901 O WAT 4306 123.665 28.630 146.202 1.00 0.00 O ATOM 86902 H1 WAT 4306 123.733 29.474 146.649 1.00 0.00 H ATOM 86903 H2 WAT 4306 124.069 28.779 145.347 1.00 0.00 H TER 86905 WAT 4306 ATOM 86905 O WAT 4307 70.254 100.773 155.525 1.00 0.00 O ATOM 86906 H1 WAT 4307 69.363 100.458 155.369 1.00 0.00 H ATOM 86907 H2 WAT 4307 70.813 100.026 155.310 1.00 0.00 H TER 86909 WAT 4307 ATOM 86909 O WAT 4308 126.460 32.013 59.501 1.00 0.00 O ATOM 86910 H1 WAT 4308 125.806 32.592 59.892 1.00 0.00 H ATOM 86911 H2 WAT 4308 126.088 31.769 58.654 1.00 0.00 H TER 86913 WAT 4308 ATOM 86913 O WAT 4309 18.486 85.171 127.701 1.00 0.00 O ATOM 86914 H1 WAT 4309 18.095 84.623 128.382 1.00 0.00 H ATOM 86915 H2 WAT 4309 17.944 85.016 126.928 1.00 0.00 H TER 86917 WAT 4309 ATOM 86917 O WAT 4310 29.347 23.313 145.897 1.00 0.00 O ATOM 86918 H1 WAT 4310 29.132 23.963 146.565 1.00 0.00 H ATOM 86919 H2 WAT 4310 29.557 23.830 145.119 1.00 0.00 H TER 86921 WAT 4310 ATOM 86921 O WAT 4311 1.761 141.217 77.927 1.00 0.00 O ATOM 86922 H1 WAT 4311 1.470 141.667 77.134 1.00 0.00 H ATOM 86923 H2 WAT 4311 1.845 141.912 78.580 1.00 0.00 H TER 86925 WAT 4311 ATOM 86925 O WAT 4312 51.448 13.881 127.459 1.00 0.00 O ATOM 86926 H1 WAT 4312 51.327 14.299 128.312 1.00 0.00 H ATOM 86927 H2 WAT 4312 50.576 13.885 127.065 1.00 0.00 H TER 86929 WAT 4312 ATOM 86929 O WAT 4313 76.420 29.590 76.622 1.00 0.00 O ATOM 86930 H1 WAT 4313 75.540 29.873 76.871 1.00 0.00 H ATOM 86931 H2 WAT 4313 76.515 29.873 75.712 1.00 0.00 H TER 86933 WAT 4313 ATOM 86933 O WAT 4314 104.974 13.484 83.175 1.00 0.00 O ATOM 86934 H1 WAT 4314 104.757 12.750 83.750 1.00 0.00 H ATOM 86935 H2 WAT 4314 104.848 13.140 82.291 1.00 0.00 H TER 86937 WAT 4314 ATOM 86937 O WAT 4315 34.626 55.347 104.718 1.00 0.00 O ATOM 86938 H1 WAT 4315 34.805 55.190 103.791 1.00 0.00 H ATOM 86939 H2 WAT 4315 33.766 55.768 104.728 1.00 0.00 H TER 86941 WAT 4315 ATOM 86941 O WAT 4316 127.289 126.781 81.815 1.00 0.00 O ATOM 86942 H1 WAT 4316 127.003 125.973 81.390 1.00 0.00 H ATOM 86943 H2 WAT 4316 128.233 126.814 81.658 1.00 0.00 H TER 86945 WAT 4316 ATOM 86945 O WAT 4317 127.670 53.669 115.201 1.00 0.00 O ATOM 86946 H1 WAT 4317 128.599 53.761 115.415 1.00 0.00 H ATOM 86947 H2 WAT 4317 127.221 54.219 115.842 1.00 0.00 H TER 86949 WAT 4317 ATOM 86949 O WAT 4318 28.192 52.085 126.302 1.00 0.00 O ATOM 86950 H1 WAT 4318 29.043 52.133 125.868 1.00 0.00 H ATOM 86951 H2 WAT 4318 28.353 52.424 127.183 1.00 0.00 H TER 86953 WAT 4318 ATOM 86953 O WAT 4319 36.086 40.590 104.688 1.00 0.00 O ATOM 86954 H1 WAT 4319 36.159 39.668 104.441 1.00 0.00 H ATOM 86955 H2 WAT 4319 36.184 40.591 105.640 1.00 0.00 H TER 86957 WAT 4319 ATOM 86957 O WAT 4320 12.367 96.779 69.771 1.00 0.00 O ATOM 86958 H1 WAT 4320 11.789 96.995 70.502 1.00 0.00 H ATOM 86959 H2 WAT 4320 11.891 96.111 69.279 1.00 0.00 H TER 86961 WAT 4320 ATOM 86961 O WAT 4321 81.232 87.948 133.292 1.00 0.00 O ATOM 86962 H1 WAT 4321 80.432 87.484 133.044 1.00 0.00 H ATOM 86963 H2 WAT 4321 81.545 88.339 132.476 1.00 0.00 H TER 86965 WAT 4321 ATOM 86965 O WAT 4322 122.016 39.459 7.270 1.00 0.00 O ATOM 86966 H1 WAT 4322 122.726 39.771 6.709 1.00 0.00 H ATOM 86967 H2 WAT 4322 121.334 39.179 6.659 1.00 0.00 H TER 86969 WAT 4322 ATOM 86969 O WAT 4323 45.310 75.091 117.509 1.00 0.00 O ATOM 86970 H1 WAT 4323 44.805 75.535 116.827 1.00 0.00 H ATOM 86971 H2 WAT 4323 44.871 75.329 118.325 1.00 0.00 H TER 86973 WAT 4323 ATOM 86973 O WAT 4324 36.578 145.230 97.785 1.00 0.00 O ATOM 86974 H1 WAT 4324 36.559 144.580 97.082 1.00 0.00 H ATOM 86975 H2 WAT 4324 35.830 145.799 97.605 1.00 0.00 H TER 86977 WAT 4324 ATOM 86977 O WAT 4325 123.530 2.957 128.720 1.00 0.00 O ATOM 86978 H1 WAT 4325 124.458 3.076 128.921 1.00 0.00 H ATOM 86979 H2 WAT 4325 123.341 3.623 128.059 1.00 0.00 H TER 86981 WAT 4325 ATOM 86981 O WAT 4326 71.338 51.347 157.698 1.00 0.00 O ATOM 86982 H1 WAT 4326 70.506 51.820 157.696 1.00 0.00 H ATOM 86983 H2 WAT 4326 71.123 50.485 158.053 1.00 0.00 H TER 86985 WAT 4326 ATOM 86985 O WAT 4327 42.801 59.914 157.052 1.00 0.00 O ATOM 86986 H1 WAT 4327 43.387 59.668 157.768 1.00 0.00 H ATOM 86987 H2 WAT 4327 42.276 60.631 157.408 1.00 0.00 H TER 86989 WAT 4327 ATOM 86989 O WAT 4328 139.862 144.123 140.236 1.00 0.00 O ATOM 86990 H1 WAT 4328 139.557 143.674 139.448 1.00 0.00 H ATOM 86991 H2 WAT 4328 140.800 143.935 140.270 1.00 0.00 H TER 86993 WAT 4328 ATOM 86993 O WAT 4329 127.148 145.119 102.273 1.00 0.00 O ATOM 86994 H1 WAT 4329 127.428 144.698 101.460 1.00 0.00 H ATOM 86995 H2 WAT 4329 127.739 144.768 102.940 1.00 0.00 H TER 86997 WAT 4329 ATOM 86997 O WAT 4330 87.962 1.478 71.962 1.00 0.00 O ATOM 86998 H1 WAT 4330 87.179 1.113 72.374 1.00 0.00 H ATOM 86999 H2 WAT 4330 88.184 2.238 72.501 1.00 0.00 H TER 87001 WAT 4330 ATOM 87001 O WAT 4331 60.118 44.289 25.042 1.00 0.00 O ATOM 87002 H1 WAT 4331 59.471 44.572 24.395 1.00 0.00 H ATOM 87003 H2 WAT 4331 59.746 44.550 25.884 1.00 0.00 H TER 87005 WAT 4331 ATOM 87005 O WAT 4332 140.555 15.928 153.764 1.00 0.00 O ATOM 87006 H1 WAT 4332 140.163 15.958 152.891 1.00 0.00 H ATOM 87007 H2 WAT 4332 140.692 14.996 153.933 1.00 0.00 H TER 87009 WAT 4332 ATOM 87009 O WAT 4333 65.534 3.227 117.396 1.00 0.00 O ATOM 87010 H1 WAT 4333 66.078 3.121 116.617 1.00 0.00 H ATOM 87011 H2 WAT 4333 66.159 3.300 118.118 1.00 0.00 H TER 87013 WAT 4333 ATOM 87013 O WAT 4334 74.311 92.602 6.361 1.00 0.00 O ATOM 87014 H1 WAT 4334 74.992 93.037 5.847 1.00 0.00 H ATOM 87015 H2 WAT 4334 73.490 92.946 6.010 1.00 0.00 H TER 87017 WAT 4334 ATOM 87017 O WAT 4335 100.895 107.827 149.521 1.00 0.00 O ATOM 87018 H1 WAT 4335 100.662 106.937 149.257 1.00 0.00 H ATOM 87019 H2 WAT 4335 101.533 108.112 148.866 1.00 0.00 H TER 87021 WAT 4335 ATOM 87021 O WAT 4336 94.410 89.249 140.058 1.00 0.00 O ATOM 87022 H1 WAT 4336 94.734 89.809 139.353 1.00 0.00 H ATOM 87023 H2 WAT 4336 94.936 88.452 139.992 1.00 0.00 H TER 87025 WAT 4336 ATOM 87025 O WAT 4337 4.733 30.055 97.222 1.00 0.00 O ATOM 87026 H1 WAT 4337 4.148 29.400 96.840 1.00 0.00 H ATOM 87027 H2 WAT 4337 5.591 29.630 97.235 1.00 0.00 H TER 87029 WAT 4337 ATOM 87029 O WAT 4338 81.621 23.609 149.276 1.00 0.00 O ATOM 87030 H1 WAT 4338 82.192 23.129 148.675 1.00 0.00 H ATOM 87031 H2 WAT 4338 81.921 24.516 149.218 1.00 0.00 H TER 87033 WAT 4338 ATOM 87033 O WAT 4339 25.704 130.041 154.891 1.00 0.00 O ATOM 87034 H1 WAT 4339 24.939 130.587 155.070 1.00 0.00 H ATOM 87035 H2 WAT 4339 25.495 129.197 155.290 1.00 0.00 H TER 87037 WAT 4339 ATOM 87037 O WAT 4340 121.039 114.223 143.057 1.00 0.00 O ATOM 87038 H1 WAT 4340 121.622 113.894 142.372 1.00 0.00 H ATOM 87039 H2 WAT 4340 121.498 114.981 143.418 1.00 0.00 H TER 87041 WAT 4340 ATOM 87041 O WAT 4341 118.685 47.454 55.964 1.00 0.00 O ATOM 87042 H1 WAT 4341 119.360 47.043 55.424 1.00 0.00 H ATOM 87043 H2 WAT 4341 118.714 46.975 56.791 1.00 0.00 H TER 87045 WAT 4341 ATOM 87045 O WAT 4342 36.620 43.050 57.175 1.00 0.00 O ATOM 87046 H1 WAT 4342 35.874 43.230 57.748 1.00 0.00 H ATOM 87047 H2 WAT 4342 36.757 42.106 57.250 1.00 0.00 H TER 87049 WAT 4342 ATOM 87049 O WAT 4343 2.875 138.213 95.486 1.00 0.00 O ATOM 87050 H1 WAT 4343 2.652 138.990 94.973 1.00 0.00 H ATOM 87051 H2 WAT 4343 3.828 138.145 95.416 1.00 0.00 H TER 87053 WAT 4343 ATOM 87053 O WAT 4344 113.289 93.445 158.068 1.00 0.00 O ATOM 87054 H1 WAT 4344 112.339 93.398 157.967 1.00 0.00 H ATOM 87055 H2 WAT 4344 113.462 93.024 158.910 1.00 0.00 H TER 87057 WAT 4344 ATOM 87057 O WAT 4345 76.230 118.331 152.716 1.00 0.00 O ATOM 87058 H1 WAT 4345 76.986 118.764 152.319 1.00 0.00 H ATOM 87059 H2 WAT 4345 76.610 117.691 153.318 1.00 0.00 H TER 87061 WAT 4345 ATOM 87061 O WAT 4346 86.360 13.328 119.283 1.00 0.00 O ATOM 87062 H1 WAT 4346 86.974 12.600 119.379 1.00 0.00 H ATOM 87063 H2 WAT 4346 86.700 14.007 119.866 1.00 0.00 H TER 87065 WAT 4346 ATOM 87065 O WAT 4347 72.327 36.792 114.141 1.00 0.00 O ATOM 87066 H1 WAT 4347 71.936 37.598 113.802 1.00 0.00 H ATOM 87067 H2 WAT 4347 73.086 37.087 114.643 1.00 0.00 H TER 87069 WAT 4347 ATOM 87069 O WAT 4348 136.636 116.177 131.032 1.00 0.00 O ATOM 87070 H1 WAT 4348 135.823 116.381 130.570 1.00 0.00 H ATOM 87071 H2 WAT 4348 137.328 116.489 130.448 1.00 0.00 H TER 87073 WAT 4348 ATOM 87073 O WAT 4349 85.246 31.166 143.391 1.00 0.00 O ATOM 87074 H1 WAT 4349 84.629 31.366 144.095 1.00 0.00 H ATOM 87075 H2 WAT 4349 85.465 30.243 143.520 1.00 0.00 H TER 87077 WAT 4349 ATOM 87077 O WAT 4350 36.060 133.098 57.165 1.00 0.00 O ATOM 87078 H1 WAT 4350 36.462 132.691 56.398 1.00 0.00 H ATOM 87079 H2 WAT 4350 36.425 133.983 57.187 1.00 0.00 H TER 87081 WAT 4350 ATOM 87081 O WAT 4351 38.282 42.192 95.292 1.00 0.00 O ATOM 87082 H1 WAT 4351 39.227 42.274 95.165 1.00 0.00 H ATOM 87083 H2 WAT 4351 38.020 43.027 95.680 1.00 0.00 H TER 87085 WAT 4351 ATOM 87085 O WAT 4352 110.420 75.756 7.600 1.00 0.00 O ATOM 87086 H1 WAT 4352 109.693 76.231 7.196 1.00 0.00 H ATOM 87087 H2 WAT 4352 110.346 75.955 8.534 1.00 0.00 H TER 87089 WAT 4352 ATOM 87089 O WAT 4353 33.555 86.127 86.000 1.00 0.00 O ATOM 87090 H1 WAT 4353 33.458 86.412 86.909 1.00 0.00 H ATOM 87091 H2 WAT 4353 33.164 86.832 85.485 1.00 0.00 H TER 87093 WAT 4353 ATOM 87093 O WAT 4354 61.824 49.309 74.136 1.00 0.00 O ATOM 87094 H1 WAT 4354 61.708 48.456 74.555 1.00 0.00 H ATOM 87095 H2 WAT 4354 61.647 49.148 73.210 1.00 0.00 H TER 87097 WAT 4354 ATOM 87097 O WAT 4355 120.920 47.831 157.832 1.00 0.00 O ATOM 87098 H1 WAT 4355 121.198 47.775 156.917 1.00 0.00 H ATOM 87099 H2 WAT 4355 120.687 46.933 158.067 1.00 0.00 H TER 87101 WAT 4355 ATOM 87101 O WAT 4356 145.474 97.260 23.583 1.00 0.00 O ATOM 87102 H1 WAT 4356 145.609 97.828 24.342 1.00 0.00 H ATOM 87103 H2 WAT 4356 146.234 97.422 23.024 1.00 0.00 H TER 87105 WAT 4356 ATOM 87105 O WAT 4357 55.762 27.000 127.478 1.00 0.00 O ATOM 87106 H1 WAT 4357 56.050 27.653 128.116 1.00 0.00 H ATOM 87107 H2 WAT 4357 54.891 26.739 127.779 1.00 0.00 H TER 87109 WAT 4357 ATOM 87109 O WAT 4358 67.408 115.049 2.936 1.00 0.00 O ATOM 87110 H1 WAT 4358 67.370 114.232 2.438 1.00 0.00 H ATOM 87111 H2 WAT 4358 66.739 115.604 2.537 1.00 0.00 H TER 87113 WAT 4358 ATOM 87113 O WAT 4359 27.917 97.474 144.964 1.00 0.00 O ATOM 87114 H1 WAT 4359 27.059 97.515 144.541 1.00 0.00 H ATOM 87115 H2 WAT 4359 28.528 97.789 144.297 1.00 0.00 H TER 87117 WAT 4359 ATOM 87117 O WAT 4360 27.750 12.998 79.186 1.00 0.00 O ATOM 87118 H1 WAT 4360 28.304 13.662 78.775 1.00 0.00 H ATOM 87119 H2 WAT 4360 27.831 12.232 78.618 1.00 0.00 H TER 87121 WAT 4360 ATOM 87121 O WAT 4361 46.517 104.870 148.605 1.00 0.00 O ATOM 87122 H1 WAT 4361 46.533 105.776 148.912 1.00 0.00 H ATOM 87123 H2 WAT 4361 45.786 104.840 147.987 1.00 0.00 H TER 87125 WAT 4361 ATOM 87125 O WAT 4362 134.329 11.853 97.228 1.00 0.00 O ATOM 87126 H1 WAT 4362 134.361 10.999 97.660 1.00 0.00 H ATOM 87127 H2 WAT 4362 135.080 12.329 97.581 1.00 0.00 H TER 87129 WAT 4362 ATOM 87129 O WAT 4363 104.525 7.782 130.517 1.00 0.00 O ATOM 87130 H1 WAT 4363 104.653 7.097 131.173 1.00 0.00 H ATOM 87131 H2 WAT 4363 103.947 7.385 129.866 1.00 0.00 H TER 87133 WAT 4363 ATOM 87133 O WAT 4364 5.593 94.481 75.084 1.00 0.00 O ATOM 87134 H1 WAT 4364 4.758 94.279 75.506 1.00 0.00 H ATOM 87135 H2 WAT 4364 5.756 93.736 74.505 1.00 0.00 H TER 87137 WAT 4364 ATOM 87137 O WAT 4365 0.784 106.069 92.670 1.00 0.00 O ATOM 87138 H1 WAT 4365 0.798 105.661 91.805 1.00 0.00 H ATOM 87139 H2 WAT 4365 0.270 106.868 92.550 1.00 0.00 H TER 87141 WAT 4365 ATOM 87141 O WAT 4366 0.908 4.875 17.149 1.00 0.00 O ATOM 87142 H1 WAT 4366 0.729 5.291 16.306 1.00 0.00 H ATOM 87143 H2 WAT 4366 0.152 5.099 17.693 1.00 0.00 H TER 87145 WAT 4366 ATOM 87145 O WAT 4367 88.927 98.716 15.417 1.00 0.00 O ATOM 87146 H1 WAT 4367 88.935 97.764 15.521 1.00 0.00 H ATOM 87147 H2 WAT 4367 89.022 99.054 16.308 1.00 0.00 H TER 87149 WAT 4367 ATOM 87149 O WAT 4368 144.817 18.716 150.162 1.00 0.00 O ATOM 87150 H1 WAT 4368 145.295 19.519 150.372 1.00 0.00 H ATOM 87151 H2 WAT 4368 145.453 18.174 149.695 1.00 0.00 H TER 87153 WAT 4368 ATOM 87153 O WAT 4369 22.105 122.800 20.799 1.00 0.00 O ATOM 87154 H1 WAT 4369 22.564 123.608 20.568 1.00 0.00 H ATOM 87155 H2 WAT 4369 22.641 122.410 21.490 1.00 0.00 H TER 87157 WAT 4369 ATOM 87157 O WAT 4370 106.656 137.936 99.078 1.00 0.00 O ATOM 87158 H1 WAT 4370 106.196 137.750 98.259 1.00 0.00 H ATOM 87159 H2 WAT 4370 106.014 138.404 99.612 1.00 0.00 H TER 87161 WAT 4370 ATOM 87161 O WAT 4371 142.099 47.769 120.396 1.00 0.00 O ATOM 87162 H1 WAT 4371 141.977 47.344 121.245 1.00 0.00 H ATOM 87163 H2 WAT 4371 141.562 48.560 120.445 1.00 0.00 H TER 87165 WAT 4371 ATOM 87165 O WAT 4372 40.905 37.201 65.329 1.00 0.00 O ATOM 87166 H1 WAT 4372 41.372 37.639 66.041 1.00 0.00 H ATOM 87167 H2 WAT 4372 41.564 37.089 64.644 1.00 0.00 H TER 87169 WAT 4372 ATOM 87169 O WAT 4373 93.478 102.747 113.674 1.00 0.00 O ATOM 87170 H1 WAT 4373 93.981 101.935 113.738 1.00 0.00 H ATOM 87171 H2 WAT 4373 92.566 102.461 113.631 1.00 0.00 H TER 87173 WAT 4373 ATOM 87173 O WAT 4374 63.965 62.704 13.086 1.00 0.00 O ATOM 87174 H1 WAT 4374 64.729 62.848 12.528 1.00 0.00 H ATOM 87175 H2 WAT 4374 64.144 61.874 13.528 1.00 0.00 H TER 87177 WAT 4374 ATOM 87177 O WAT 4375 90.106 66.579 76.666 1.00 0.00 O ATOM 87178 H1 WAT 4375 90.002 67.182 77.403 1.00 0.00 H ATOM 87179 H2 WAT 4375 89.396 66.809 76.066 1.00 0.00 H TER 87181 WAT 4375 ATOM 87181 O WAT 4376 82.106 33.375 157.364 1.00 0.00 O ATOM 87182 H1 WAT 4376 82.117 32.699 156.686 1.00 0.00 H ATOM 87183 H2 WAT 4376 83.007 33.405 157.687 1.00 0.00 H TER 87185 WAT 4376 ATOM 87185 O WAT 4377 32.802 104.327 148.422 1.00 0.00 O ATOM 87186 H1 WAT 4377 33.611 103.909 148.128 1.00 0.00 H ATOM 87187 H2 WAT 4377 32.190 104.200 147.697 1.00 0.00 H TER 87189 WAT 4377 ATOM 87189 O WAT 4378 73.422 87.941 129.753 1.00 0.00 O ATOM 87190 H1 WAT 4378 73.212 87.502 130.577 1.00 0.00 H ATOM 87191 H2 WAT 4378 73.901 88.727 130.016 1.00 0.00 H TER 87193 WAT 4378 ATOM 87193 O WAT 4379 110.826 59.891 11.572 1.00 0.00 O ATOM 87194 H1 WAT 4379 110.906 60.072 10.635 1.00 0.00 H ATOM 87195 H2 WAT 4379 110.456 60.694 11.940 1.00 0.00 H TER 87197 WAT 4379 ATOM 87197 O WAT 4380 130.559 99.781 94.364 1.00 0.00 O ATOM 87198 H1 WAT 4380 131.106 99.000 94.439 1.00 0.00 H ATOM 87199 H2 WAT 4380 131.104 100.411 93.892 1.00 0.00 H TER 87201 WAT 4380 ATOM 87201 O WAT 4381 37.240 79.080 149.008 1.00 0.00 O ATOM 87202 H1 WAT 4381 37.007 79.867 148.516 1.00 0.00 H ATOM 87203 H2 WAT 4381 37.952 78.685 148.505 1.00 0.00 H TER 87205 WAT 4381 ATOM 87205 O WAT 4382 110.601 119.550 80.690 1.00 0.00 O ATOM 87206 H1 WAT 4382 111.180 120.312 80.678 1.00 0.00 H ATOM 87207 H2 WAT 4382 110.240 119.510 79.804 1.00 0.00 H TER 87209 WAT 4382 ATOM 87209 O WAT 4383 122.829 93.600 155.393 1.00 0.00 O ATOM 87210 H1 WAT 4383 123.331 92.821 155.632 1.00 0.00 H ATOM 87211 H2 WAT 4383 122.531 93.958 156.230 1.00 0.00 H TER 87213 WAT 4383 ATOM 87213 O WAT 4384 97.600 62.262 123.194 1.00 0.00 O ATOM 87214 H1 WAT 4384 98.008 62.750 122.479 1.00 0.00 H ATOM 87215 H2 WAT 4384 96.795 61.909 122.815 1.00 0.00 H TER 87217 WAT 4384 ATOM 87217 O WAT 4385 111.312 138.799 78.242 1.00 0.00 O ATOM 87218 H1 WAT 4385 111.220 138.577 77.315 1.00 0.00 H ATOM 87219 H2 WAT 4385 112.254 138.916 78.368 1.00 0.00 H TER 87221 WAT 4385 ATOM 87221 O WAT 4386 26.653 124.965 13.049 1.00 0.00 O ATOM 87222 H1 WAT 4386 27.591 124.814 12.933 1.00 0.00 H ATOM 87223 H2 WAT 4386 26.467 125.737 12.514 1.00 0.00 H TER 87225 WAT 4386 ATOM 87225 O WAT 4387 63.368 104.625 67.153 1.00 0.00 O ATOM 87226 H1 WAT 4387 64.003 104.384 66.479 1.00 0.00 H ATOM 87227 H2 WAT 4387 63.459 105.574 67.240 1.00 0.00 H TER 87229 WAT 4387 ATOM 87229 O WAT 4388 22.709 135.656 76.364 1.00 0.00 O ATOM 87230 H1 WAT 4388 22.637 136.465 76.871 1.00 0.00 H ATOM 87231 H2 WAT 4388 23.219 135.903 75.592 1.00 0.00 H TER 87233 WAT 4388 ATOM 87233 O WAT 4389 120.464 96.387 81.231 1.00 0.00 O ATOM 87234 H1 WAT 4389 119.518 96.258 81.160 1.00 0.00 H ATOM 87235 H2 WAT 4389 120.596 96.712 82.121 1.00 0.00 H TER 87237 WAT 4389 ATOM 87237 O WAT 4390 65.079 57.539 90.115 1.00 0.00 O ATOM 87238 H1 WAT 4390 65.555 56.709 90.145 1.00 0.00 H ATOM 87239 H2 WAT 4390 65.763 58.208 90.135 1.00 0.00 H TER 87241 WAT 4390 ATOM 87241 O WAT 4391 96.647 131.016 103.722 1.00 0.00 O ATOM 87242 H1 WAT 4391 97.545 131.118 104.036 1.00 0.00 H ATOM 87243 H2 WAT 4391 96.433 130.100 103.900 1.00 0.00 H TER 87245 WAT 4391 ATOM 87245 O WAT 4392 128.531 82.365 58.851 1.00 0.00 O ATOM 87246 H1 WAT 4392 128.380 81.701 58.179 1.00 0.00 H ATOM 87247 H2 WAT 4392 128.723 81.865 59.644 1.00 0.00 H TER 87249 WAT 4392 ATOM 87249 O WAT 4393 16.197 21.680 146.359 1.00 0.00 O ATOM 87250 H1 WAT 4393 16.052 20.738 146.271 1.00 0.00 H ATOM 87251 H2 WAT 4393 16.388 21.807 147.288 1.00 0.00 H TER 87253 WAT 4393 ATOM 87253 O WAT 4394 34.975 39.017 17.281 1.00 0.00 O ATOM 87254 H1 WAT 4394 34.690 39.028 18.194 1.00 0.00 H ATOM 87255 H2 WAT 4394 34.421 38.357 16.865 1.00 0.00 H TER 87257 WAT 4394 ATOM 87257 O WAT 4395 142.714 36.964 142.135 1.00 0.00 O ATOM 87258 H1 WAT 4395 142.172 37.563 141.622 1.00 0.00 H ATOM 87259 H2 WAT 4395 143.508 37.463 142.327 1.00 0.00 H TER 87261 WAT 4395 ATOM 87261 O WAT 4396 48.519 88.107 18.365 1.00 0.00 O ATOM 87262 H1 WAT 4396 48.137 88.210 19.236 1.00 0.00 H ATOM 87263 H2 WAT 4396 48.155 87.284 18.040 1.00 0.00 H TER 87265 WAT 4396 ATOM 87265 O WAT 4397 143.778 129.723 17.709 1.00 0.00 O ATOM 87266 H1 WAT 4397 143.757 130.636 17.421 1.00 0.00 H ATOM 87267 H2 WAT 4397 144.064 129.235 16.937 1.00 0.00 H TER 87269 WAT 4397 ATOM 87269 O WAT 4398 138.478 79.536 145.551 1.00 0.00 O ATOM 87270 H1 WAT 4398 138.364 78.623 145.285 1.00 0.00 H ATOM 87271 H2 WAT 4398 138.262 79.542 146.483 1.00 0.00 H TER 87273 WAT 4398 ATOM 87273 O WAT 4399 21.422 34.474 118.345 1.00 0.00 O ATOM 87274 H1 WAT 4399 22.252 34.715 118.757 1.00 0.00 H ATOM 87275 H2 WAT 4399 20.882 34.150 119.066 1.00 0.00 H TER 87277 WAT 4399 ATOM 87277 O WAT 4400 1.908 29.201 127.832 1.00 0.00 O ATOM 87278 H1 WAT 4400 2.623 28.719 127.416 1.00 0.00 H ATOM 87279 H2 WAT 4400 1.951 30.075 127.444 1.00 0.00 H TER 87281 WAT 4400 ATOM 87281 O WAT 4401 104.619 94.339 29.679 1.00 0.00 O ATOM 87282 H1 WAT 4401 104.736 93.695 28.980 1.00 0.00 H ATOM 87283 H2 WAT 4401 103.810 94.797 29.448 1.00 0.00 H TER 87285 WAT 4401 ATOM 87285 O WAT 4402 -0.054 54.992 64.941 1.00 0.00 O ATOM 87286 H1 WAT 4402 0.761 54.964 65.442 1.00 0.00 H ATOM 87287 H2 WAT 4402 -0.510 54.184 65.179 1.00 0.00 H TER 87289 WAT 4402 ATOM 87289 O WAT 4403 55.952 93.414 73.591 1.00 0.00 O ATOM 87290 H1 WAT 4403 56.899 93.547 73.580 1.00 0.00 H ATOM 87291 H2 WAT 4403 55.798 92.733 72.935 1.00 0.00 H TER 87293 WAT 4403 ATOM 87293 O WAT 4404 86.615 53.043 100.779 1.00 0.00 O ATOM 87294 H1 WAT 4404 87.333 52.421 100.900 1.00 0.00 H ATOM 87295 H2 WAT 4404 86.083 52.950 101.569 1.00 0.00 H TER 87297 WAT 4404 ATOM 87297 O WAT 4405 101.657 26.632 79.245 1.00 0.00 O ATOM 87298 H1 WAT 4405 101.967 27.477 78.919 1.00 0.00 H ATOM 87299 H2 WAT 4405 102.456 26.127 79.398 1.00 0.00 H TER 87301 WAT 4405 ATOM 87301 O WAT 4406 85.341 131.780 103.995 1.00 0.00 O ATOM 87302 H1 WAT 4406 85.458 131.452 104.887 1.00 0.00 H ATOM 87303 H2 WAT 4406 84.430 131.577 103.783 1.00 0.00 H TER 87305 WAT 4406 ATOM 87305 O WAT 4407 59.987 32.383 89.304 1.00 0.00 O ATOM 87306 H1 WAT 4407 59.663 32.614 88.434 1.00 0.00 H ATOM 87307 H2 WAT 4407 60.308 31.486 89.210 1.00 0.00 H TER 87309 WAT 4407 ATOM 87309 O WAT 4408 63.300 25.425 93.783 1.00 0.00 O ATOM 87310 H1 WAT 4408 63.919 25.668 94.472 1.00 0.00 H ATOM 87311 H2 WAT 4408 62.735 24.768 94.189 1.00 0.00 H TER 87313 WAT 4408 ATOM 87313 O WAT 4409 120.850 117.052 83.919 1.00 0.00 O ATOM 87314 H1 WAT 4409 121.070 117.629 84.651 1.00 0.00 H ATOM 87315 H2 WAT 4409 120.126 117.494 83.475 1.00 0.00 H TER 87317 WAT 4409 ATOM 87317 O WAT 4410 20.190 130.039 107.240 1.00 0.00 O ATOM 87318 H1 WAT 4410 20.275 129.211 106.768 1.00 0.00 H ATOM 87319 H2 WAT 4410 20.318 129.805 108.160 1.00 0.00 H TER 87321 WAT 4410 ATOM 87321 O WAT 4411 6.735 55.694 63.435 1.00 0.00 O ATOM 87322 H1 WAT 4411 5.983 55.519 62.869 1.00 0.00 H ATOM 87323 H2 WAT 4411 7.432 55.955 62.833 1.00 0.00 H TER 87325 WAT 4411 ATOM 87325 O WAT 4412 134.467 94.703 74.491 1.00 0.00 O ATOM 87326 H1 WAT 4412 134.361 93.832 74.873 1.00 0.00 H ATOM 87327 H2 WAT 4412 135.415 94.830 74.442 1.00 0.00 H TER 87329 WAT 4412 ATOM 87329 O WAT 4413 124.403 122.809 103.163 1.00 0.00 O ATOM 87330 H1 WAT 4413 124.027 123.598 102.773 1.00 0.00 H ATOM 87331 H2 WAT 4413 124.205 122.114 102.536 1.00 0.00 H TER 87333 WAT 4413 ATOM 87333 O WAT 4414 9.027 97.396 1.139 1.00 0.00 O ATOM 87334 H1 WAT 4414 8.133 97.273 1.459 1.00 0.00 H ATOM 87335 H2 WAT 4414 9.567 97.388 1.929 1.00 0.00 H TER 87337 WAT 4414 ATOM 87337 O WAT 4415 80.670 124.619 105.697 1.00 0.00 O ATOM 87338 H1 WAT 4415 81.150 124.776 106.510 1.00 0.00 H ATOM 87339 H2 WAT 4415 79.848 125.097 105.808 1.00 0.00 H TER 87341 WAT 4415 ATOM 87341 O WAT 4416 36.985 60.201 127.843 1.00 0.00 O ATOM 87342 H1 WAT 4416 37.732 60.064 128.425 1.00 0.00 H ATOM 87343 H2 WAT 4416 36.258 59.756 128.279 1.00 0.00 H TER 87345 WAT 4416 ATOM 87345 O WAT 4417 39.687 114.945 64.885 1.00 0.00 O ATOM 87346 H1 WAT 4417 39.642 114.675 63.968 1.00 0.00 H ATOM 87347 H2 WAT 4417 40.586 114.749 65.149 1.00 0.00 H TER 87349 WAT 4417 ATOM 87349 O WAT 4418 63.012 109.864 119.628 1.00 0.00 O ATOM 87350 H1 WAT 4418 62.445 109.093 119.647 1.00 0.00 H ATOM 87351 H2 WAT 4418 62.529 110.504 119.105 1.00 0.00 H TER 87353 WAT 4418 ATOM 87353 O WAT 4419 122.465 0.295 105.334 1.00 0.00 O ATOM 87354 H1 WAT 4419 121.875 1.041 105.438 1.00 0.00 H ATOM 87355 H2 WAT 4419 123.201 0.640 104.829 1.00 0.00 H TER 87357 WAT 4419 ATOM 87357 O WAT 4420 136.088 5.396 93.667 1.00 0.00 O ATOM 87358 H1 WAT 4420 135.827 4.753 93.008 1.00 0.00 H ATOM 87359 H2 WAT 4420 135.444 6.100 93.584 1.00 0.00 H TER 87361 WAT 4420 ATOM 87361 O WAT 4421 112.894 78.821 102.001 1.00 0.00 O ATOM 87362 H1 WAT 4421 112.166 78.875 101.381 1.00 0.00 H ATOM 87363 H2 WAT 4421 112.716 79.513 102.639 1.00 0.00 H TER 87365 WAT 4421 ATOM 87365 O WAT 4422 50.353 77.285 110.454 1.00 0.00 O ATOM 87366 H1 WAT 4422 50.691 78.038 109.968 1.00 0.00 H ATOM 87367 H2 WAT 4422 49.462 77.535 110.695 1.00 0.00 H TER 87369 WAT 4422 ATOM 87369 O WAT 4423 91.188 63.522 123.983 1.00 0.00 O ATOM 87370 H1 WAT 4423 92.113 63.578 123.747 1.00 0.00 H ATOM 87371 H2 WAT 4423 91.184 63.083 124.833 1.00 0.00 H TER 87373 WAT 4423 ATOM 87373 O WAT 4424 132.477 23.705 64.852 1.00 0.00 O ATOM 87374 H1 WAT 4424 131.759 24.338 64.882 1.00 0.00 H ATOM 87375 H2 WAT 4424 133.251 24.231 64.653 1.00 0.00 H TER 87377 WAT 4424 ATOM 87377 O WAT 4425 111.180 78.488 116.662 1.00 0.00 O ATOM 87378 H1 WAT 4425 111.435 77.644 116.289 1.00 0.00 H ATOM 87379 H2 WAT 4425 111.886 78.702 117.273 1.00 0.00 H TER 87381 WAT 4425 ATOM 87381 O WAT 4426 144.808 59.133 148.423 1.00 0.00 O ATOM 87382 H1 WAT 4426 145.565 58.657 148.080 1.00 0.00 H ATOM 87383 H2 WAT 4426 145.118 59.515 149.244 1.00 0.00 H TER 87385 WAT 4426 ATOM 87385 O WAT 4427 83.036 142.593 2.702 1.00 0.00 O ATOM 87386 H1 WAT 4427 83.311 141.825 3.202 1.00 0.00 H ATOM 87387 H2 WAT 4427 82.087 142.630 2.821 1.00 0.00 H TER 87389 WAT 4427 ATOM 87389 O WAT 4428 130.717 42.574 96.482 1.00 0.00 O ATOM 87390 H1 WAT 4428 130.819 42.924 95.597 1.00 0.00 H ATOM 87391 H2 WAT 4428 130.265 43.267 96.963 1.00 0.00 H TER 87393 WAT 4428 ATOM 87393 O WAT 4429 127.642 93.712 150.950 1.00 0.00 O ATOM 87394 H1 WAT 4429 126.946 93.107 150.693 1.00 0.00 H ATOM 87395 H2 WAT 4429 127.620 94.399 150.284 1.00 0.00 H TER 87397 WAT 4429 ATOM 87397 O WAT 4430 70.855 77.286 5.750 1.00 0.00 O ATOM 87398 H1 WAT 4430 71.025 76.934 4.877 1.00 0.00 H ATOM 87399 H2 WAT 4430 70.765 76.513 6.307 1.00 0.00 H TER 87401 WAT 4430 ATOM 87401 O WAT 4431 127.717 12.431 102.647 1.00 0.00 O ATOM 87402 H1 WAT 4431 128.584 12.132 102.373 1.00 0.00 H ATOM 87403 H2 WAT 4431 127.883 13.243 103.125 1.00 0.00 H TER 87405 WAT 4431 ATOM 87405 O WAT 4432 77.053 82.556 83.810 1.00 0.00 O ATOM 87406 H1 WAT 4432 76.853 82.092 84.623 1.00 0.00 H ATOM 87407 H2 WAT 4432 76.211 82.909 83.523 1.00 0.00 H TER 87409 WAT 4432 ATOM 87409 O WAT 4433 106.121 31.364 153.331 1.00 0.00 O ATOM 87410 H1 WAT 4433 105.170 31.419 153.232 1.00 0.00 H ATOM 87411 H2 WAT 4433 106.253 31.137 154.252 1.00 0.00 H TER 87413 WAT 4433 ATOM 87413 O WAT 4434 84.981 14.718 93.231 1.00 0.00 O ATOM 87414 H1 WAT 4434 85.900 14.809 92.981 1.00 0.00 H ATOM 87415 H2 WAT 4434 84.516 14.612 92.401 1.00 0.00 H TER 87417 WAT 4434 ATOM 87417 O WAT 4435 30.086 119.367 126.847 1.00 0.00 O ATOM 87418 H1 WAT 4435 29.492 119.140 126.132 1.00 0.00 H ATOM 87419 H2 WAT 4435 29.715 120.166 127.222 1.00 0.00 H TER 87421 WAT 4435 ATOM 87421 O WAT 4436 110.813 142.619 154.950 1.00 0.00 O ATOM 87422 H1 WAT 4436 110.086 143.235 155.037 1.00 0.00 H ATOM 87423 H2 WAT 4436 110.928 142.259 155.829 1.00 0.00 H TER 87425 WAT 4436 ATOM 87425 O WAT 4437 52.837 29.537 63.295 1.00 0.00 O ATOM 87426 H1 WAT 4437 53.365 30.290 63.562 1.00 0.00 H ATOM 87427 H2 WAT 4437 52.275 29.359 64.049 1.00 0.00 H TER 87429 WAT 4437 ATOM 87429 O WAT 4438 28.966 70.591 10.552 1.00 0.00 O ATOM 87430 H1 WAT 4438 29.881 70.451 10.795 1.00 0.00 H ATOM 87431 H2 WAT 4438 28.630 71.192 11.217 1.00 0.00 H TER 87433 WAT 4438 ATOM 87433 O WAT 4439 41.679 50.075 15.216 1.00 0.00 O ATOM 87434 H1 WAT 4439 40.797 50.102 15.587 1.00 0.00 H ATOM 87435 H2 WAT 4439 41.998 50.974 15.290 1.00 0.00 H TER 87437 WAT 4439 ATOM 87437 O WAT 4440 126.141 80.940 81.629 1.00 0.00 O ATOM 87438 H1 WAT 4440 126.241 81.652 82.261 1.00 0.00 H ATOM 87439 H2 WAT 4440 126.585 80.195 82.035 1.00 0.00 H TER 87441 WAT 4440 ATOM 87441 O WAT 4441 43.853 119.748 135.508 1.00 0.00 O ATOM 87442 H1 WAT 4441 44.176 118.894 135.223 1.00 0.00 H ATOM 87443 H2 WAT 4441 44.357 120.379 134.994 1.00 0.00 H TER 87445 WAT 4441 ATOM 87445 O WAT 4442 59.746 76.781 86.781 1.00 0.00 O ATOM 87446 H1 WAT 4442 59.491 77.674 86.551 1.00 0.00 H ATOM 87447 H2 WAT 4442 59.928 76.817 87.720 1.00 0.00 H TER 87449 WAT 4442 ATOM 87449 O WAT 4443 20.414 102.800 141.960 1.00 0.00 O ATOM 87450 H1 WAT 4443 19.768 102.604 141.281 1.00 0.00 H ATOM 87451 H2 WAT 4443 20.654 103.713 141.806 1.00 0.00 H TER 87453 WAT 4443 ATOM 87453 O WAT 4444 88.763 68.955 127.437 1.00 0.00 O ATOM 87454 H1 WAT 4444 87.998 68.865 126.868 1.00 0.00 H ATOM 87455 H2 WAT 4444 88.396 69.096 128.310 1.00 0.00 H TER 87457 WAT 4444 ATOM 87457 O WAT 4445 50.046 68.954 157.054 1.00 0.00 O ATOM 87458 H1 WAT 4445 49.965 69.069 156.107 1.00 0.00 H ATOM 87459 H2 WAT 4445 50.803 69.489 157.295 1.00 0.00 H TER 87461 WAT 4445 ATOM 87461 O WAT 4446 117.000 102.915 21.617 1.00 0.00 O ATOM 87462 H1 WAT 4446 116.882 103.704 21.089 1.00 0.00 H ATOM 87463 H2 WAT 4446 117.570 103.191 22.336 1.00 0.00 H TER 87465 WAT 4446 ATOM 87465 O WAT 4447 88.214 5.738 103.146 1.00 0.00 O ATOM 87466 H1 WAT 4447 89.141 5.563 103.307 1.00 0.00 H ATOM 87467 H2 WAT 4447 87.945 6.297 103.875 1.00 0.00 H TER 87469 WAT 4447 ATOM 87469 O WAT 4448 127.692 20.878 109.694 1.00 0.00 O ATOM 87470 H1 WAT 4448 126.788 20.564 109.685 1.00 0.00 H ATOM 87471 H2 WAT 4448 127.991 20.773 108.791 1.00 0.00 H TER 87473 WAT 4448 ATOM 87473 O WAT 4449 36.826 109.983 142.076 1.00 0.00 O ATOM 87474 H1 WAT 4449 35.989 110.405 141.885 1.00 0.00 H ATOM 87475 H2 WAT 4449 37.449 110.410 141.487 1.00 0.00 H TER 87477 WAT 4449 ATOM 87477 O WAT 4450 141.553 119.244 69.540 1.00 0.00 O ATOM 87478 H1 WAT 4450 140.926 119.968 69.519 1.00 0.00 H ATOM 87479 H2 WAT 4450 141.492 118.850 68.670 1.00 0.00 H TER 87481 WAT 4450 ATOM 87481 O WAT 4451 73.640 83.614 136.835 1.00 0.00 O ATOM 87482 H1 WAT 4451 74.371 84.154 137.134 1.00 0.00 H ATOM 87483 H2 WAT 4451 72.908 84.226 136.752 1.00 0.00 H TER 87485 WAT 4451 ATOM 87485 O WAT 4452 31.871 78.103 121.846 1.00 0.00 O ATOM 87486 H1 WAT 4452 31.367 78.739 122.353 1.00 0.00 H ATOM 87487 H2 WAT 4452 32.781 78.262 122.098 1.00 0.00 H TER 87489 WAT 4452 ATOM 87489 O WAT 4453 138.156 1.135 140.929 1.00 0.00 O ATOM 87490 H1 WAT 4453 137.775 0.527 140.296 1.00 0.00 H ATOM 87491 H2 WAT 4453 137.434 1.715 141.168 1.00 0.00 H TER 87493 WAT 4453 ATOM 87493 O WAT 4454 86.899 15.284 66.747 1.00 0.00 O ATOM 87494 H1 WAT 4454 86.761 16.128 66.317 1.00 0.00 H ATOM 87495 H2 WAT 4454 87.835 15.270 66.950 1.00 0.00 H TER 87497 WAT 4454 ATOM 87497 O WAT 4455 110.226 64.669 0.910 1.00 0.00 O ATOM 87498 H1 WAT 4455 109.913 64.500 0.021 1.00 0.00 H ATOM 87499 H2 WAT 4455 109.742 65.445 1.191 1.00 0.00 H TER 87501 WAT 4455 ATOM 87501 O WAT 4456 75.362 89.421 70.203 1.00 0.00 O ATOM 87502 H1 WAT 4456 75.940 89.940 70.762 1.00 0.00 H ATOM 87503 H2 WAT 4456 75.578 89.698 69.313 1.00 0.00 H TER 87505 WAT 4456 ATOM 87505 O WAT 4457 30.862 144.188 57.374 1.00 0.00 O ATOM 87506 H1 WAT 4457 30.625 145.068 57.079 1.00 0.00 H ATOM 87507 H2 WAT 4457 31.746 144.285 57.729 1.00 0.00 H TER 87509 WAT 4457 ATOM 87509 O WAT 4458 54.235 102.472 75.667 1.00 0.00 O ATOM 87510 H1 WAT 4458 54.731 101.687 75.902 1.00 0.00 H ATOM 87511 H2 WAT 4458 54.701 103.188 76.099 1.00 0.00 H TER 87513 WAT 4458 ATOM 87513 O WAT 4459 69.037 70.150 135.615 1.00 0.00 O ATOM 87514 H1 WAT 4459 68.248 69.618 135.723 1.00 0.00 H ATOM 87515 H2 WAT 4459 69.259 70.433 136.502 1.00 0.00 H TER 87517 WAT 4459 ATOM 87517 O WAT 4460 12.911 131.054 143.588 1.00 0.00 O ATOM 87518 H1 WAT 4460 12.053 131.438 143.769 1.00 0.00 H ATOM 87519 H2 WAT 4460 12.792 130.117 143.741 1.00 0.00 H TER 87521 WAT 4460 ATOM 87521 O WAT 4461 111.875 87.114 71.331 1.00 0.00 O ATOM 87522 H1 WAT 4461 111.795 86.706 70.469 1.00 0.00 H ATOM 87523 H2 WAT 4461 112.752 87.499 71.333 1.00 0.00 H TER 87525 WAT 4461 ATOM 87525 O WAT 4462 120.604 113.222 125.012 1.00 0.00 O ATOM 87526 H1 WAT 4462 120.385 112.317 124.791 1.00 0.00 H ATOM 87527 H2 WAT 4462 119.796 113.710 124.853 1.00 0.00 H TER 87529 WAT 4462 ATOM 87529 O WAT 4463 114.811 107.614 78.491 1.00 0.00 O ATOM 87530 H1 WAT 4463 114.474 107.156 79.261 1.00 0.00 H ATOM 87531 H2 WAT 4463 115.670 107.939 78.763 1.00 0.00 H TER 87533 WAT 4463 ATOM 87533 O WAT 4464 74.329 4.749 27.291 1.00 0.00 O ATOM 87534 H1 WAT 4464 74.954 5.407 27.596 1.00 0.00 H ATOM 87535 H2 WAT 4464 73.474 5.094 27.545 1.00 0.00 H TER 87537 WAT 4464 ATOM 87537 O WAT 4465 35.556 120.311 72.237 1.00 0.00 O ATOM 87538 H1 WAT 4465 34.772 120.370 72.783 1.00 0.00 H ATOM 87539 H2 WAT 4465 35.259 120.569 71.364 1.00 0.00 H TER 87541 WAT 4465 ATOM 87541 O WAT 4466 37.994 107.145 119.643 1.00 0.00 O ATOM 87542 H1 WAT 4466 37.897 106.227 119.392 1.00 0.00 H ATOM 87543 H2 WAT 4466 37.269 107.307 120.247 1.00 0.00 H TER 87545 WAT 4466 ATOM 87545 O WAT 4467 41.284 30.337 6.478 1.00 0.00 O ATOM 87546 H1 WAT 4467 40.878 30.681 7.274 1.00 0.00 H ATOM 87547 H2 WAT 4467 41.859 29.637 6.786 1.00 0.00 H TER 87549 WAT 4467 ATOM 87549 O WAT 4468 17.382 128.723 131.210 1.00 0.00 O ATOM 87550 H1 WAT 4468 17.548 129.639 130.987 1.00 0.00 H ATOM 87551 H2 WAT 4468 17.877 128.579 132.016 1.00 0.00 H TER 87553 WAT 4468 ATOM 87553 O WAT 4469 79.233 88.794 150.954 1.00 0.00 O ATOM 87554 H1 WAT 4469 79.198 89.223 151.809 1.00 0.00 H ATOM 87555 H2 WAT 4469 79.522 87.902 151.145 1.00 0.00 H TER 87557 WAT 4469 ATOM 87557 O WAT 4470 58.688 2.938 115.286 1.00 0.00 O ATOM 87558 H1 WAT 4470 59.119 2.903 114.432 1.00 0.00 H ATOM 87559 H2 WAT 4470 58.140 3.722 115.246 1.00 0.00 H TER 87561 WAT 4470 ATOM 87561 O WAT 4471 14.805 76.451 2.043 1.00 0.00 O ATOM 87562 H1 WAT 4471 14.959 76.596 1.109 1.00 0.00 H ATOM 87563 H2 WAT 4471 14.927 75.509 2.162 1.00 0.00 H TER 87565 WAT 4471 ATOM 87565 O WAT 4472 99.200 105.081 107.939 1.00 0.00 O ATOM 87566 H1 WAT 4472 98.899 105.886 108.361 1.00 0.00 H ATOM 87567 H2 WAT 4472 99.053 105.231 107.005 1.00 0.00 H TER 87569 WAT 4472 ATOM 87569 O WAT 4473 132.384 60.409 8.659 1.00 0.00 O ATOM 87570 H1 WAT 4473 132.591 60.964 9.411 1.00 0.00 H ATOM 87571 H2 WAT 4473 132.957 59.649 8.757 1.00 0.00 H TER 87573 WAT 4473 ATOM 87573 O WAT 4474 60.973 75.261 142.243 1.00 0.00 O ATOM 87574 H1 WAT 4474 61.054 75.835 143.005 1.00 0.00 H ATOM 87575 H2 WAT 4474 60.518 74.487 142.574 1.00 0.00 H TER 87577 WAT 4474 ATOM 87577 O WAT 4475 21.593 51.981 18.089 1.00 0.00 O ATOM 87578 H1 WAT 4475 21.787 52.249 18.987 1.00 0.00 H ATOM 87579 H2 WAT 4475 20.796 52.460 17.862 1.00 0.00 H TER 87581 WAT 4475 ATOM 87581 O WAT 4476 142.766 23.725 62.927 1.00 0.00 O ATOM 87582 H1 WAT 4476 142.356 23.362 62.142 1.00 0.00 H ATOM 87583 H2 WAT 4476 142.113 23.604 63.616 1.00 0.00 H TER 87585 WAT 4476 ATOM 87585 O WAT 4477 1.781 94.436 71.534 1.00 0.00 O ATOM 87586 H1 WAT 4477 0.973 94.813 71.883 1.00 0.00 H ATOM 87587 H2 WAT 4477 2.471 95.028 71.834 1.00 0.00 H TER 87589 WAT 4477 ATOM 87589 O WAT 4478 50.926 130.667 119.843 1.00 0.00 O ATOM 87590 H1 WAT 4478 51.602 130.584 120.515 1.00 0.00 H ATOM 87591 H2 WAT 4478 50.623 131.572 119.919 1.00 0.00 H TER 87593 WAT 4478 ATOM 87593 O WAT 4479 38.500 127.506 20.528 1.00 0.00 O ATOM 87594 H1 WAT 4479 38.086 126.670 20.315 1.00 0.00 H ATOM 87595 H2 WAT 4479 38.484 127.997 19.706 1.00 0.00 H TER 87597 WAT 4479 ATOM 87597 O WAT 4480 127.273 26.200 82.466 1.00 0.00 O ATOM 87598 H1 WAT 4480 127.553 26.819 83.140 1.00 0.00 H ATOM 87599 H2 WAT 4480 128.012 25.598 82.372 1.00 0.00 H TER 87601 WAT 4480 ATOM 87601 O WAT 4481 8.634 86.773 67.091 1.00 0.00 O ATOM 87602 H1 WAT 4481 8.937 87.388 67.760 1.00 0.00 H ATOM 87603 H2 WAT 4481 9.419 86.286 66.841 1.00 0.00 H TER 87605 WAT 4481 ATOM 87605 O WAT 4482 126.815 39.013 156.438 1.00 0.00 O ATOM 87606 H1 WAT 4482 127.061 39.822 156.888 1.00 0.00 H ATOM 87607 H2 WAT 4482 127.645 38.560 156.289 1.00 0.00 H TER 87609 WAT 4482 ATOM 87609 O WAT 4483 68.892 77.333 141.238 1.00 0.00 O ATOM 87610 H1 WAT 4483 68.362 78.009 141.661 1.00 0.00 H ATOM 87611 H2 WAT 4483 68.926 77.596 140.318 1.00 0.00 H TER 87613 WAT 4483 ATOM 87613 O WAT 4484 79.335 95.673 156.400 1.00 0.00 O ATOM 87614 H1 WAT 4484 78.710 96.322 156.722 1.00 0.00 H ATOM 87615 H2 WAT 4484 79.067 94.854 156.817 1.00 0.00 H TER 87617 WAT 4484 ATOM 87617 O WAT 4485 119.818 30.822 139.489 1.00 0.00 O ATOM 87618 H1 WAT 4485 119.999 31.751 139.631 1.00 0.00 H ATOM 87619 H2 WAT 4485 120.580 30.500 139.008 1.00 0.00 H TER 87621 WAT 4485 ATOM 87621 O WAT 4486 118.426 94.811 128.554 1.00 0.00 O ATOM 87622 H1 WAT 4486 117.911 94.343 129.212 1.00 0.00 H ATOM 87623 H2 WAT 4486 119.171 95.165 129.041 1.00 0.00 H TER 87625 WAT 4486 ATOM 87625 O WAT 4487 131.828 6.269 75.624 1.00 0.00 O ATOM 87626 H1 WAT 4487 131.995 5.872 74.769 1.00 0.00 H ATOM 87627 H2 WAT 4487 131.489 7.141 75.422 1.00 0.00 H TER 87629 WAT 4487 ATOM 87629 O WAT 4488 33.636 87.479 5.468 1.00 0.00 O ATOM 87630 H1 WAT 4488 33.330 87.033 6.257 1.00 0.00 H ATOM 87631 H2 WAT 4488 34.253 88.137 5.788 1.00 0.00 H TER 87633 WAT 4488 ATOM 87633 O WAT 4489 52.426 143.832 156.987 1.00 0.00 O ATOM 87634 H1 WAT 4489 53.376 143.773 157.087 1.00 0.00 H ATOM 87635 H2 WAT 4489 52.192 143.068 156.460 1.00 0.00 H TER 87637 WAT 4489 ATOM 87637 O WAT 4490 100.588 0.631 129.724 1.00 0.00 O ATOM 87638 H1 WAT 4490 100.942 1.515 129.632 1.00 0.00 H ATOM 87639 H2 WAT 4490 101.185 0.080 129.219 1.00 0.00 H TER 87641 WAT 4490 ATOM 87641 O WAT 4491 84.348 85.977 127.939 1.00 0.00 O ATOM 87642 H1 WAT 4491 84.600 86.825 127.572 1.00 0.00 H ATOM 87643 H2 WAT 4491 83.724 86.192 128.632 1.00 0.00 H TER 87645 WAT 4491 ATOM 87645 O WAT 4492 38.284 23.035 65.704 1.00 0.00 O ATOM 87646 H1 WAT 4492 37.673 23.767 65.626 1.00 0.00 H ATOM 87647 H2 WAT 4492 37.726 22.258 65.730 1.00 0.00 H TER 87649 WAT 4492 ATOM 87649 O WAT 4493 7.209 55.819 17.043 1.00 0.00 O ATOM 87650 H1 WAT 4493 6.827 55.961 17.909 1.00 0.00 H ATOM 87651 H2 WAT 4493 6.705 55.093 16.675 1.00 0.00 H TER 87653 WAT 4493 ATOM 87653 O WAT 4494 46.400 29.400 148.028 1.00 0.00 O ATOM 87654 H1 WAT 4494 46.830 29.698 148.829 1.00 0.00 H ATOM 87655 H2 WAT 4494 46.731 28.511 147.894 1.00 0.00 H TER 87657 WAT 4494 ATOM 87657 O WAT 4495 37.053 43.475 99.000 1.00 0.00 O ATOM 87658 H1 WAT 4495 36.959 43.730 99.918 1.00 0.00 H ATOM 87659 H2 WAT 4495 36.474 42.719 98.901 1.00 0.00 H TER 87661 WAT 4495 ATOM 87661 O WAT 4496 14.002 65.924 145.115 1.00 0.00 O ATOM 87662 H1 WAT 4496 14.215 66.850 145.224 1.00 0.00 H ATOM 87663 H2 WAT 4496 13.252 65.918 144.520 1.00 0.00 H TER 87665 WAT 4496 ATOM 87665 O WAT 4497 126.230 71.275 134.431 1.00 0.00 O ATOM 87666 H1 WAT 4497 125.964 71.769 133.656 1.00 0.00 H ATOM 87667 H2 WAT 4497 126.228 71.919 135.139 1.00 0.00 H TER 87669 WAT 4497 ATOM 87669 O WAT 4498 94.124 98.411 126.171 1.00 0.00 O ATOM 87670 H1 WAT 4498 94.222 99.292 125.812 1.00 0.00 H ATOM 87671 H2 WAT 4498 94.489 97.836 125.498 1.00 0.00 H TER 87673 WAT 4498 ATOM 87673 O WAT 4499 134.251 87.799 146.052 1.00 0.00 O ATOM 87674 H1 WAT 4499 134.441 87.317 146.857 1.00 0.00 H ATOM 87675 H2 WAT 4499 134.187 88.713 146.330 1.00 0.00 H TER 87677 WAT 4499 ATOM 87677 O WAT 4500 42.645 122.570 157.016 1.00 0.00 O ATOM 87678 H1 WAT 4500 42.105 123.347 157.162 1.00 0.00 H ATOM 87679 H2 WAT 4500 42.335 122.216 156.182 1.00 0.00 H TER 87681 WAT 4500 ATOM 87681 O WAT 4501 39.694 53.653 110.973 1.00 0.00 O ATOM 87682 H1 WAT 4501 40.521 53.178 111.059 1.00 0.00 H ATOM 87683 H2 WAT 4501 39.508 53.972 111.856 1.00 0.00 H TER 87685 WAT 4501 ATOM 87685 O WAT 4502 11.479 56.745 84.445 1.00 0.00 O ATOM 87686 H1 WAT 4502 10.978 56.242 85.087 1.00 0.00 H ATOM 87687 H2 WAT 4502 10.869 56.880 83.719 1.00 0.00 H TER 87689 WAT 4502 ATOM 87689 O WAT 4503 6.602 83.069 139.936 1.00 0.00 O ATOM 87690 H1 WAT 4503 5.914 82.417 140.071 1.00 0.00 H ATOM 87691 H2 WAT 4503 7.120 82.724 139.209 1.00 0.00 H TER 87693 WAT 4503 ATOM 87693 O WAT 4504 18.582 138.749 64.481 1.00 0.00 O ATOM 87694 H1 WAT 4504 18.516 137.912 64.939 1.00 0.00 H ATOM 87695 H2 WAT 4504 18.752 138.511 63.570 1.00 0.00 H TER 87697 WAT 4504 ATOM 87697 O WAT 4505 72.793 135.016 62.657 1.00 0.00 O ATOM 87698 H1 WAT 4505 73.600 135.208 63.135 1.00 0.00 H ATOM 87699 H2 WAT 4505 72.526 135.859 62.290 1.00 0.00 H TER 87701 WAT 4505 ATOM 87701 O WAT 4506 57.871 102.756 77.566 1.00 0.00 O ATOM 87702 H1 WAT 4506 58.328 103.592 77.480 1.00 0.00 H ATOM 87703 H2 WAT 4506 57.719 102.472 76.665 1.00 0.00 H TER 87705 WAT 4506 ATOM 87705 O WAT 4507 91.986 139.008 70.864 1.00 0.00 O ATOM 87706 H1 WAT 4507 92.827 138.997 70.406 1.00 0.00 H ATOM 87707 H2 WAT 4507 91.416 139.536 70.305 1.00 0.00 H TER 87709 WAT 4507 ATOM 87709 O WAT 4508 114.813 20.459 80.909 1.00 0.00 O ATOM 87710 H1 WAT 4508 114.475 20.786 80.076 1.00 0.00 H ATOM 87711 H2 WAT 4508 114.382 19.612 81.026 1.00 0.00 H TER 87713 WAT 4508 ATOM 87713 O WAT 4509 11.789 101.040 140.998 1.00 0.00 O ATOM 87714 H1 WAT 4509 11.434 100.170 140.818 1.00 0.00 H ATOM 87715 H2 WAT 4509 11.018 101.602 141.080 1.00 0.00 H TER 87717 WAT 4509 ATOM 87717 O WAT 4510 97.916 120.587 122.542 1.00 0.00 O ATOM 87718 H1 WAT 4510 97.167 120.831 121.998 1.00 0.00 H ATOM 87719 H2 WAT 4510 97.535 120.371 123.393 1.00 0.00 H TER 87721 WAT 4510 ATOM 87721 O WAT 4511 137.401 6.584 128.814 1.00 0.00 O ATOM 87722 H1 WAT 4511 137.894 7.085 129.464 1.00 0.00 H ATOM 87723 H2 WAT 4511 136.858 7.235 128.371 1.00 0.00 H TER 87725 WAT 4511 ATOM 87725 O WAT 4512 140.095 95.384 156.235 1.00 0.00 O ATOM 87726 H1 WAT 4512 140.776 95.250 155.575 1.00 0.00 H ATOM 87727 H2 WAT 4512 139.469 95.974 155.816 1.00 0.00 H TER 87729 WAT 4512 ATOM 87729 O WAT 4513 57.939 123.994 9.730 1.00 0.00 O ATOM 87730 H1 WAT 4513 58.445 124.550 9.138 1.00 0.00 H ATOM 87731 H2 WAT 4513 58.364 124.100 10.581 1.00 0.00 H TER 87733 WAT 4513 ATOM 87733 O WAT 4514 134.764 103.825 99.637 1.00 0.00 O ATOM 87734 H1 WAT 4514 135.206 102.989 99.486 1.00 0.00 H ATOM 87735 H2 WAT 4514 133.851 103.586 99.799 1.00 0.00 H TER 87737 WAT 4514 ATOM 87737 O WAT 4515 103.077 136.333 90.798 1.00 0.00 O ATOM 87738 H1 WAT 4515 103.049 135.405 90.564 1.00 0.00 H ATOM 87739 H2 WAT 4515 102.966 136.793 89.966 1.00 0.00 H TER 87741 WAT 4515 ATOM 87741 O WAT 4516 28.525 122.612 69.999 1.00 0.00 O ATOM 87742 H1 WAT 4516 28.089 122.464 70.838 1.00 0.00 H ATOM 87743 H2 WAT 4516 28.057 123.353 69.614 1.00 0.00 H TER 87745 WAT 4516 ATOM 87745 O WAT 4517 102.892 95.261 22.355 1.00 0.00 O ATOM 87746 H1 WAT 4517 103.177 94.683 23.063 1.00 0.00 H ATOM 87747 H2 WAT 4517 102.292 95.876 22.774 1.00 0.00 H TER 87749 WAT 4517 ATOM 87749 O WAT 4518 4.978 86.070 101.901 1.00 0.00 O ATOM 87750 H1 WAT 4518 4.995 86.789 102.534 1.00 0.00 H ATOM 87751 H2 WAT 4518 5.735 85.531 102.131 1.00 0.00 H TER 87753 WAT 4518 ATOM 87753 O WAT 4519 20.346 74.984 123.921 1.00 0.00 O ATOM 87754 H1 WAT 4519 20.567 75.587 123.212 1.00 0.00 H ATOM 87755 H2 WAT 4519 19.634 74.450 123.567 1.00 0.00 H TER 87757 WAT 4519 ATOM 87757 O WAT 4520 125.022 50.488 17.318 1.00 0.00 O ATOM 87758 H1 WAT 4520 125.727 49.886 17.555 1.00 0.00 H ATOM 87759 H2 WAT 4520 124.343 49.926 16.944 1.00 0.00 H TER 87761 WAT 4520 ATOM 87761 O WAT 4521 30.408 71.523 58.480 1.00 0.00 O ATOM 87762 H1 WAT 4521 30.221 71.946 57.641 1.00 0.00 H ATOM 87763 H2 WAT 4521 30.311 72.221 59.127 1.00 0.00 H TER 87765 WAT 4521 ATOM 87765 O WAT 4522 28.979 73.694 158.647 1.00 0.00 O ATOM 87766 H1 WAT 4522 29.590 73.717 157.911 1.00 0.00 H ATOM 87767 H2 WAT 4522 28.125 73.533 158.244 1.00 0.00 H TER 87769 WAT 4522 ATOM 87769 O WAT 4523 54.343 95.001 72.150 1.00 0.00 O ATOM 87770 H1 WAT 4523 53.446 94.770 72.390 1.00 0.00 H ATOM 87771 H2 WAT 4523 54.890 94.410 72.667 1.00 0.00 H TER 87773 WAT 4523 ATOM 87773 O WAT 4524 120.089 9.398 63.210 1.00 0.00 O ATOM 87774 H1 WAT 4524 119.210 9.753 63.073 1.00 0.00 H ATOM 87775 H2 WAT 4524 119.957 8.452 63.276 1.00 0.00 H TER 87777 WAT 4524 ATOM 87777 O WAT 4525 128.374 112.475 140.730 1.00 0.00 O ATOM 87778 H1 WAT 4525 127.435 112.351 140.592 1.00 0.00 H ATOM 87779 H2 WAT 4525 128.643 113.065 140.026 1.00 0.00 H TER 87781 WAT 4525 ATOM 87781 O WAT 4526 142.058 131.572 68.071 1.00 0.00 O ATOM 87782 H1 WAT 4526 142.559 130.757 68.111 1.00 0.00 H ATOM 87783 H2 WAT 4526 141.808 131.743 68.979 1.00 0.00 H TER 87785 WAT 4526 ATOM 87785 O WAT 4527 50.764 93.257 77.582 1.00 0.00 O ATOM 87786 H1 WAT 4527 51.013 92.506 78.120 1.00 0.00 H ATOM 87787 H2 WAT 4527 51.585 93.554 77.190 1.00 0.00 H TER 87789 WAT 4527 ATOM 87789 O WAT 4528 140.394 141.597 103.575 1.00 0.00 O ATOM 87790 H1 WAT 4528 140.444 141.101 102.758 1.00 0.00 H ATOM 87791 H2 WAT 4528 140.224 142.498 103.299 1.00 0.00 H TER 87793 WAT 4528 ATOM 87793 O WAT 4529 126.407 42.321 127.956 1.00 0.00 O ATOM 87794 H1 WAT 4529 126.425 43.122 127.432 1.00 0.00 H ATOM 87795 H2 WAT 4529 125.484 42.069 127.976 1.00 0.00 H TER 87797 WAT 4529 ATOM 87797 O WAT 4530 91.980 86.142 68.750 1.00 0.00 O ATOM 87798 H1 WAT 4530 92.171 86.263 69.680 1.00 0.00 H ATOM 87799 H2 WAT 4530 91.032 86.011 68.716 1.00 0.00 H TER 87801 WAT 4530 ATOM 87801 O WAT 4531 9.071 42.411 99.928 1.00 0.00 O ATOM 87802 H1 WAT 4531 9.779 41.794 100.113 1.00 0.00 H ATOM 87803 H2 WAT 4531 8.467 42.309 100.663 1.00 0.00 H TER 87805 WAT 4531 ATOM 87805 O WAT 4532 40.104 32.395 115.777 1.00 0.00 O ATOM 87806 H1 WAT 4532 40.733 31.693 115.614 1.00 0.00 H ATOM 87807 H2 WAT 4532 39.951 32.785 114.916 1.00 0.00 H TER 87809 WAT 4532 ATOM 87809 O WAT 4533 30.600 36.795 88.997 1.00 0.00 O ATOM 87810 H1 WAT 4533 31.205 36.420 89.638 1.00 0.00 H ATOM 87811 H2 WAT 4533 29.885 37.153 89.523 1.00 0.00 H TER 87813 WAT 4533 ATOM 87813 O WAT 4534 72.316 83.188 11.146 1.00 0.00 O ATOM 87814 H1 WAT 4534 72.499 83.062 10.215 1.00 0.00 H ATOM 87815 H2 WAT 4534 71.958 84.074 11.202 1.00 0.00 H TER 87817 WAT 4534 ATOM 87817 O WAT 4535 80.334 2.232 151.663 1.00 0.00 O ATOM 87818 H1 WAT 4535 80.422 1.513 152.289 1.00 0.00 H ATOM 87819 H2 WAT 4535 80.762 1.912 150.869 1.00 0.00 H TER 87821 WAT 4535 ATOM 87821 O WAT 4536 6.849 129.780 128.662 1.00 0.00 O ATOM 87822 H1 WAT 4536 6.074 130.334 128.569 1.00 0.00 H ATOM 87823 H2 WAT 4536 6.624 129.168 129.362 1.00 0.00 H TER 87825 WAT 4536 ATOM 87825 O WAT 4537 119.406 91.839 74.169 1.00 0.00 O ATOM 87826 H1 WAT 4537 119.284 92.399 74.935 1.00 0.00 H ATOM 87827 H2 WAT 4537 120.318 91.977 73.914 1.00 0.00 H TER 87829 WAT 4537 ATOM 87829 O WAT 4538 139.823 38.543 78.350 1.00 0.00 O ATOM 87830 H1 WAT 4538 139.699 38.667 79.291 1.00 0.00 H ATOM 87831 H2 WAT 4538 140.490 37.860 78.284 1.00 0.00 H TER 87833 WAT 4538 ATOM 87833 O WAT 4539 4.464 76.000 156.005 1.00 0.00 O ATOM 87834 H1 WAT 4539 3.994 76.311 155.231 1.00 0.00 H ATOM 87835 H2 WAT 4539 4.152 75.104 156.130 1.00 0.00 H TER 87837 WAT 4539 ATOM 87837 O WAT 4540 17.775 82.975 150.630 1.00 0.00 O ATOM 87838 H1 WAT 4540 17.165 82.426 151.123 1.00 0.00 H ATOM 87839 H2 WAT 4540 17.763 83.816 151.087 1.00 0.00 H TER 87841 WAT 4540 ATOM 87841 O WAT 4541 14.805 20.160 119.625 1.00 0.00 O ATOM 87842 H1 WAT 4541 14.965 20.034 120.560 1.00 0.00 H ATOM 87843 H2 WAT 4541 14.143 19.504 119.405 1.00 0.00 H TER 87845 WAT 4541 ATOM 87845 O WAT 4542 108.350 49.842 77.321 1.00 0.00 O ATOM 87846 H1 WAT 4542 108.187 50.408 76.566 1.00 0.00 H ATOM 87847 H2 WAT 4542 108.337 48.955 76.962 1.00 0.00 H TER 87849 WAT 4542 ATOM 87849 O WAT 4543 37.003 105.643 16.589 1.00 0.00 O ATOM 87850 H1 WAT 4543 36.270 106.114 16.986 1.00 0.00 H ATOM 87851 H2 WAT 4543 36.703 104.736 16.534 1.00 0.00 H TER 87853 WAT 4543 ATOM 87853 O WAT 4544 105.482 92.942 152.697 1.00 0.00 O ATOM 87854 H1 WAT 4544 105.809 92.535 153.499 1.00 0.00 H ATOM 87855 H2 WAT 4544 105.368 93.865 152.926 1.00 0.00 H TER 87857 WAT 4544 ATOM 87857 O WAT 4545 3.362 89.094 10.802 1.00 0.00 O ATOM 87858 H1 WAT 4545 3.677 88.901 11.685 1.00 0.00 H ATOM 87859 H2 WAT 4545 2.409 89.051 10.873 1.00 0.00 H TER 87861 WAT 4545 ATOM 87861 O WAT 4546 10.461 96.501 82.623 1.00 0.00 O ATOM 87862 H1 WAT 4546 10.956 96.805 81.862 1.00 0.00 H ATOM 87863 H2 WAT 4546 10.604 97.176 83.287 1.00 0.00 H TER 87865 WAT 4546 ATOM 87865 O WAT 4547 107.165 8.980 115.145 1.00 0.00 O ATOM 87866 H1 WAT 4547 106.575 9.669 114.840 1.00 0.00 H ATOM 87867 H2 WAT 4547 106.887 8.808 116.044 1.00 0.00 H TER 87869 WAT 4547 ATOM 87869 O WAT 4548 66.090 104.907 3.624 1.00 0.00 O ATOM 87870 H1 WAT 4548 65.252 104.598 3.280 1.00 0.00 H ATOM 87871 H2 WAT 4548 66.169 104.483 4.478 1.00 0.00 H TER 87873 WAT 4548 ATOM 87873 O WAT 4549 115.748 129.703 123.194 1.00 0.00 O ATOM 87874 H1 WAT 4549 116.590 129.471 123.586 1.00 0.00 H ATOM 87875 H2 WAT 4549 115.106 129.191 123.686 1.00 0.00 H TER 87877 WAT 4549 ATOM 87877 O WAT 4550 56.487 108.711 71.589 1.00 0.00 O ATOM 87878 H1 WAT 4550 56.507 108.390 72.490 1.00 0.00 H ATOM 87879 H2 WAT 4550 55.847 109.423 71.602 1.00 0.00 H TER 87881 WAT 4550 ATOM 87881 O WAT 4551 39.064 77.659 147.510 1.00 0.00 O ATOM 87882 H1 WAT 4551 39.947 77.474 147.831 1.00 0.00 H ATOM 87883 H2 WAT 4551 38.759 76.825 147.152 1.00 0.00 H TER 87885 WAT 4551 ATOM 87885 O WAT 4552 47.369 77.725 65.062 1.00 0.00 O ATOM 87886 H1 WAT 4552 47.860 77.826 64.246 1.00 0.00 H ATOM 87887 H2 WAT 4552 47.555 76.829 65.343 1.00 0.00 H TER 87889 WAT 4552 ATOM 87889 O WAT 4553 22.783 62.656 106.514 1.00 0.00 O ATOM 87890 H1 WAT 4553 23.171 62.898 105.673 1.00 0.00 H ATOM 87891 H2 WAT 4553 21.893 62.378 106.296 1.00 0.00 H TER 87893 WAT 4553 ATOM 87893 O WAT 4554 138.544 14.259 5.659 1.00 0.00 O ATOM 87894 H1 WAT 4554 138.790 13.334 5.628 1.00 0.00 H ATOM 87895 H2 WAT 4554 137.588 14.255 5.612 1.00 0.00 H TER 87897 WAT 4554 ATOM 87897 O WAT 4555 90.005 5.345 19.453 1.00 0.00 O ATOM 87898 H1 WAT 4555 90.943 5.370 19.265 1.00 0.00 H ATOM 87899 H2 WAT 4555 89.660 6.144 19.055 1.00 0.00 H TER 87901 WAT 4555 ATOM 87901 O WAT 4556 74.270 124.048 64.094 1.00 0.00 O ATOM 87902 H1 WAT 4556 74.810 123.982 64.881 1.00 0.00 H ATOM 87903 H2 WAT 4556 74.691 123.462 63.465 1.00 0.00 H TER 87905 WAT 4556 ATOM 87905 O WAT 4557 28.686 67.628 157.034 1.00 0.00 O ATOM 87906 H1 WAT 4557 28.918 66.753 156.723 1.00 0.00 H ATOM 87907 H2 WAT 4557 28.517 68.129 156.236 1.00 0.00 H TER 87909 WAT 4557 ATOM 87909 O WAT 4558 79.027 21.448 75.755 1.00 0.00 O ATOM 87910 H1 WAT 4558 79.719 21.883 75.257 1.00 0.00 H ATOM 87911 H2 WAT 4558 78.221 21.879 75.471 1.00 0.00 H TER 87913 WAT 4558 ATOM 87913 O WAT 4559 83.252 111.691 9.521 1.00 0.00 O ATOM 87914 H1 WAT 4559 83.569 111.367 8.678 1.00 0.00 H ATOM 87915 H2 WAT 4559 83.051 112.614 9.363 1.00 0.00 H TER 87917 WAT 4559 ATOM 87917 O WAT 4560 123.569 123.517 131.425 1.00 0.00 O ATOM 87918 H1 WAT 4560 123.272 122.618 131.572 1.00 0.00 H ATOM 87919 H2 WAT 4560 124.250 123.654 132.083 1.00 0.00 H TER 87921 WAT 4560 ATOM 87921 O WAT 4561 123.738 19.797 80.870 1.00 0.00 O ATOM 87922 H1 WAT 4561 122.940 19.488 81.298 1.00 0.00 H ATOM 87923 H2 WAT 4561 124.383 19.853 81.575 1.00 0.00 H TER 87925 WAT 4561 ATOM 87925 O WAT 4562 112.754 44.555 140.467 1.00 0.00 O ATOM 87926 H1 WAT 4562 111.847 44.779 140.255 1.00 0.00 H ATOM 87927 H2 WAT 4562 113.218 45.393 140.446 1.00 0.00 H TER 87929 WAT 4562 ATOM 87929 O WAT 4563 74.998 42.109 151.313 1.00 0.00 O ATOM 87930 H1 WAT 4563 75.821 42.133 150.825 1.00 0.00 H ATOM 87931 H2 WAT 4563 74.858 41.181 151.502 1.00 0.00 H TER 87933 WAT 4563 ATOM 87933 O WAT 4564 34.411 51.543 101.909 1.00 0.00 O ATOM 87934 H1 WAT 4564 35.080 50.950 101.567 1.00 0.00 H ATOM 87935 H2 WAT 4564 33.641 51.374 101.366 1.00 0.00 H TER 87937 WAT 4564 ATOM 87937 O WAT 4565 76.104 70.390 24.959 1.00 0.00 O ATOM 87938 H1 WAT 4565 75.594 69.867 25.577 1.00 0.00 H ATOM 87939 H2 WAT 4565 76.995 70.047 25.032 1.00 0.00 H TER 87941 WAT 4565 ATOM 87941 O WAT 4566 1.866 112.148 138.873 1.00 0.00 O ATOM 87942 H1 WAT 4566 1.669 112.343 139.789 1.00 0.00 H ATOM 87943 H2 WAT 4566 1.538 112.906 138.390 1.00 0.00 H TER 87945 WAT 4566 ATOM 87945 O WAT 4567 81.144 104.568 102.632 1.00 0.00 O ATOM 87946 H1 WAT 4567 80.640 105.003 103.320 1.00 0.00 H ATOM 87947 H2 WAT 4567 80.592 104.635 101.853 1.00 0.00 H TER 87949 WAT 4567 ATOM 87949 O WAT 4568 0.835 112.808 26.187 1.00 0.00 O ATOM 87950 H1 WAT 4568 0.498 113.589 26.626 1.00 0.00 H ATOM 87951 H2 WAT 4568 1.161 112.256 26.898 1.00 0.00 H TER 87953 WAT 4568 ATOM 87953 O WAT 4569 112.941 140.202 155.419 1.00 0.00 O ATOM 87954 H1 WAT 4569 113.674 140.125 154.808 1.00 0.00 H ATOM 87955 H2 WAT 4569 112.162 140.108 154.871 1.00 0.00 H TER 87957 WAT 4569 ATOM 87957 O WAT 4570 84.603 83.642 64.828 1.00 0.00 O ATOM 87958 H1 WAT 4570 84.335 83.048 65.529 1.00 0.00 H ATOM 87959 H2 WAT 4570 83.788 84.048 64.533 1.00 0.00 H TER 87961 WAT 4570 ATOM 87961 O WAT 4571 72.630 45.194 130.420 1.00 0.00 O ATOM 87962 H1 WAT 4571 73.380 45.711 130.713 1.00 0.00 H ATOM 87963 H2 WAT 4571 72.809 45.014 129.498 1.00 0.00 H TER 87965 WAT 4571 ATOM 87965 O WAT 4572 66.937 18.568 121.023 1.00 0.00 O ATOM 87966 H1 WAT 4572 67.767 18.135 120.827 1.00 0.00 H ATOM 87967 H2 WAT 4572 66.997 19.414 120.579 1.00 0.00 H TER 87969 WAT 4572 ATOM 87969 O WAT 4573 139.829 99.142 66.834 1.00 0.00 O ATOM 87970 H1 WAT 4573 140.054 99.158 65.904 1.00 0.00 H ATOM 87971 H2 WAT 4573 140.054 98.256 67.119 1.00 0.00 H TER 87973 WAT 4573 ATOM 87973 O WAT 4574 74.190 113.232 78.297 1.00 0.00 O ATOM 87974 H1 WAT 4574 74.098 113.796 77.529 1.00 0.00 H ATOM 87975 H2 WAT 4574 75.112 113.314 78.545 1.00 0.00 H TER 87977 WAT 4574 ATOM 87977 O WAT 4575 76.123 47.502 104.284 1.00 0.00 O ATOM 87978 H1 WAT 4575 76.886 47.139 103.834 1.00 0.00 H ATOM 87979 H2 WAT 4575 75.919 48.303 103.800 1.00 0.00 H TER 87981 WAT 4575 ATOM 87981 O WAT 4576 31.093 59.564 11.557 1.00 0.00 O ATOM 87982 H1 WAT 4576 31.641 59.006 12.110 1.00 0.00 H ATOM 87983 H2 WAT 4576 30.846 60.294 12.124 1.00 0.00 H TER 87985 WAT 4576 ATOM 87985 O WAT 4577 36.721 38.590 121.359 1.00 0.00 O ATOM 87986 H1 WAT 4577 36.319 39.126 122.043 1.00 0.00 H ATOM 87987 H2 WAT 4577 37.465 39.108 121.054 1.00 0.00 H TER 87989 WAT 4577 ATOM 87989 O WAT 4578 102.083 34.044 135.278 1.00 0.00 O ATOM 87990 H1 WAT 4578 101.934 33.454 136.017 1.00 0.00 H ATOM 87991 H2 WAT 4578 101.206 34.318 135.009 1.00 0.00 H TER 87993 WAT 4578 ATOM 87993 O WAT 4579 31.724 101.518 20.663 1.00 0.00 O ATOM 87994 H1 WAT 4579 30.795 101.745 20.707 1.00 0.00 H ATOM 87995 H2 WAT 4579 32.145 102.113 21.284 1.00 0.00 H TER 87997 WAT 4579 ATOM 87997 O WAT 4580 145.181 56.629 5.085 1.00 0.00 O ATOM 87998 H1 WAT 4580 146.117 56.436 5.123 1.00 0.00 H ATOM 87999 H2 WAT 4580 144.974 56.982 5.950 1.00 0.00 H TER 88001 WAT 4580 ATOM 88001 O WAT 4581 93.399 129.034 0.835 1.00 0.00 O ATOM 88002 H1 WAT 4581 93.434 128.399 0.120 1.00 0.00 H ATOM 88003 H2 WAT 4581 94.003 128.689 1.493 1.00 0.00 H TER 88005 WAT 4581 ATOM 88005 O WAT 4582 133.678 103.173 67.029 1.00 0.00 O ATOM 88006 H1 WAT 4582 133.131 102.387 67.024 1.00 0.00 H ATOM 88007 H2 WAT 4582 134.575 102.840 67.057 1.00 0.00 H TER 88009 WAT 4582 ATOM 88009 O WAT 4583 77.048 18.984 8.869 1.00 0.00 O ATOM 88010 H1 WAT 4583 76.854 18.449 8.099 1.00 0.00 H ATOM 88011 H2 WAT 4583 76.210 19.055 9.327 1.00 0.00 H TER 88013 WAT 4583 ATOM 88013 O WAT 4584 105.809 121.443 134.407 1.00 0.00 O ATOM 88014 H1 WAT 4584 105.992 120.700 134.983 1.00 0.00 H ATOM 88015 H2 WAT 4584 105.066 121.157 133.876 1.00 0.00 H TER 88017 WAT 4584 ATOM 88017 O WAT 4585 48.825 51.196 14.445 1.00 0.00 O ATOM 88018 H1 WAT 4585 48.076 51.785 14.535 1.00 0.00 H ATOM 88019 H2 WAT 4585 49.366 51.598 13.765 1.00 0.00 H TER 88021 WAT 4585 ATOM 88021 O WAT 4586 136.021 8.662 127.394 1.00 0.00 O ATOM 88022 H1 WAT 4586 136.053 9.164 128.208 1.00 0.00 H ATOM 88023 H2 WAT 4586 135.088 8.579 127.199 1.00 0.00 H TER 88025 WAT 4586 ATOM 88025 O WAT 4587 35.252 32.145 78.857 1.00 0.00 O ATOM 88026 H1 WAT 4587 34.547 31.989 79.486 1.00 0.00 H ATOM 88027 H2 WAT 4587 35.187 33.077 78.650 1.00 0.00 H TER 88029 WAT 4587 ATOM 88029 O WAT 4588 74.361 92.019 108.662 1.00 0.00 O ATOM 88030 H1 WAT 4588 73.852 92.787 108.405 1.00 0.00 H ATOM 88031 H2 WAT 4588 75.182 92.377 108.999 1.00 0.00 H TER 88033 WAT 4588 ATOM 88033 O WAT 4589 133.395 0.803 91.057 1.00 0.00 O ATOM 88034 H1 WAT 4589 134.254 1.019 91.419 1.00 0.00 H ATOM 88035 H2 WAT 4589 133.377 -0.154 91.037 1.00 0.00 H TER 88037 WAT 4589 ATOM 88037 O WAT 4590 81.391 101.669 19.857 1.00 0.00 O ATOM 88038 H1 WAT 4590 82.302 101.745 20.141 1.00 0.00 H ATOM 88039 H2 WAT 4590 81.299 102.329 19.170 1.00 0.00 H TER 88041 WAT 4590 ATOM 88041 O WAT 4591 108.298 77.508 153.730 1.00 0.00 O ATOM 88042 H1 WAT 4591 108.512 77.995 154.526 1.00 0.00 H ATOM 88043 H2 WAT 4591 107.448 77.855 153.459 1.00 0.00 H TER 88045 WAT 4591 ATOM 88045 O WAT 4592 119.086 84.352 148.444 1.00 0.00 O ATOM 88046 H1 WAT 4592 118.540 85.045 148.073 1.00 0.00 H ATOM 88047 H2 WAT 4592 118.583 84.022 149.188 1.00 0.00 H TER 88049 WAT 4592 ATOM 88049 O WAT 4593 59.020 128.749 69.161 1.00 0.00 O ATOM 88050 H1 WAT 4593 58.275 129.332 69.302 1.00 0.00 H ATOM 88051 H2 WAT 4593 59.401 128.633 70.031 1.00 0.00 H TER 88053 WAT 4593 ATOM 88053 O WAT 4594 60.168 39.887 124.900 1.00 0.00 O ATOM 88054 H1 WAT 4594 59.391 40.000 124.353 1.00 0.00 H ATOM 88055 H2 WAT 4594 60.346 38.947 124.871 1.00 0.00 H TER 88057 WAT 4594 ATOM 88057 O WAT 4595 86.785 84.828 131.612 1.00 0.00 O ATOM 88058 H1 WAT 4595 86.473 85.718 131.780 1.00 0.00 H ATOM 88059 H2 WAT 4595 85.987 84.312 131.496 1.00 0.00 H TER 88061 WAT 4595 ATOM 88061 O WAT 4596 130.534 65.173 88.838 1.00 0.00 O ATOM 88062 H1 WAT 4596 131.327 65.657 88.607 1.00 0.00 H ATOM 88063 H2 WAT 4596 130.463 64.495 88.167 1.00 0.00 H TER 88065 WAT 4596 ATOM 88065 O WAT 4597 134.167 95.193 130.387 1.00 0.00 O ATOM 88066 H1 WAT 4597 133.929 94.312 130.675 1.00 0.00 H ATOM 88067 H2 WAT 4597 134.599 95.585 131.146 1.00 0.00 H TER 88069 WAT 4597 ATOM 88069 O WAT 4598 102.073 6.542 66.315 1.00 0.00 O ATOM 88070 H1 WAT 4598 102.746 5.864 66.372 1.00 0.00 H ATOM 88071 H2 WAT 4598 101.282 6.072 66.051 1.00 0.00 H TER 88073 WAT 4598 ATOM 88073 O WAT 4599 144.167 25.436 152.922 1.00 0.00 O ATOM 88074 H1 WAT 4599 144.984 24.946 152.828 1.00 0.00 H ATOM 88075 H2 WAT 4599 144.211 26.109 152.243 1.00 0.00 H TER 88077 WAT 4599 ATOM 88077 O WAT 4600 114.685 60.868 58.912 1.00 0.00 O ATOM 88078 H1 WAT 4600 115.351 61.088 59.564 1.00 0.00 H ATOM 88079 H2 WAT 4600 114.253 60.090 59.265 1.00 0.00 H TER 88081 WAT 4600 ATOM 88081 O WAT 4601 19.186 123.435 121.370 1.00 0.00 O ATOM 88082 H1 WAT 4601 18.616 123.799 120.694 1.00 0.00 H ATOM 88083 H2 WAT 4601 18.744 122.634 121.650 1.00 0.00 H TER 88085 WAT 4601 ATOM 88085 O WAT 4602 105.710 60.431 119.396 1.00 0.00 O ATOM 88086 H1 WAT 4602 106.235 60.836 118.705 1.00 0.00 H ATOM 88087 H2 WAT 4602 105.818 59.490 119.256 1.00 0.00 H TER 88089 WAT 4602 ATOM 88089 O WAT 4603 50.715 117.686 61.743 1.00 0.00 O ATOM 88090 H1 WAT 4603 51.576 117.670 62.161 1.00 0.00 H ATOM 88091 H2 WAT 4603 50.664 116.857 61.268 1.00 0.00 H TER 88093 WAT 4603 ATOM 88093 O WAT 4604 62.291 78.746 17.474 1.00 0.00 O ATOM 88094 H1 WAT 4604 62.995 79.184 16.995 1.00 0.00 H ATOM 88095 H2 WAT 4604 61.695 79.453 17.723 1.00 0.00 H TER 88097 WAT 4604 ATOM 88097 O WAT 4605 29.651 144.477 66.428 1.00 0.00 O ATOM 88098 H1 WAT 4605 29.762 144.723 65.510 1.00 0.00 H ATOM 88099 H2 WAT 4605 29.331 145.273 66.852 1.00 0.00 H TER 88101 WAT 4605 ATOM 88101 O WAT 4606 98.969 79.797 14.718 1.00 0.00 O ATOM 88102 H1 WAT 4606 99.343 80.630 14.430 1.00 0.00 H ATOM 88103 H2 WAT 4606 98.029 79.967 14.784 1.00 0.00 H TER 88105 WAT 4606 ATOM 88105 O WAT 4607 116.381 121.525 146.318 1.00 0.00 O ATOM 88106 H1 WAT 4607 116.147 122.382 146.674 1.00 0.00 H ATOM 88107 H2 WAT 4607 115.542 121.088 146.173 1.00 0.00 H TER 88109 WAT 4607 ATOM 88109 O WAT 4608 97.530 95.612 138.835 1.00 0.00 O ATOM 88110 H1 WAT 4608 97.024 95.136 138.178 1.00 0.00 H ATOM 88111 H2 WAT 4608 97.260 96.524 138.732 1.00 0.00 H TER 88113 WAT 4608 ATOM 88113 O WAT 4609 34.081 145.940 139.295 1.00 0.00 O ATOM 88114 H1 WAT 4609 34.220 144.993 139.324 1.00 0.00 H ATOM 88115 H2 WAT 4609 34.952 146.314 139.428 1.00 0.00 H TER 88117 WAT 4609 ATOM 88117 O WAT 4610 21.407 75.918 14.801 1.00 0.00 O ATOM 88118 H1 WAT 4610 21.036 75.660 13.957 1.00 0.00 H ATOM 88119 H2 WAT 4610 21.289 75.149 15.359 1.00 0.00 H TER 88121 WAT 4610 ATOM 88121 O WAT 4611 100.270 69.445 97.853 1.00 0.00 O ATOM 88122 H1 WAT 4611 100.864 70.101 97.489 1.00 0.00 H ATOM 88123 H2 WAT 4611 99.395 69.787 97.670 1.00 0.00 H TER 88125 WAT 4611 ATOM 88125 O WAT 4612 97.695 38.463 66.537 1.00 0.00 O ATOM 88126 H1 WAT 4612 97.527 37.688 67.073 1.00 0.00 H ATOM 88127 H2 WAT 4612 97.872 38.116 65.663 1.00 0.00 H TER 88129 WAT 4612 ATOM 88129 O WAT 4613 134.243 18.649 99.896 1.00 0.00 O ATOM 88130 H1 WAT 4613 134.654 17.929 100.374 1.00 0.00 H ATOM 88131 H2 WAT 4613 133.649 18.220 99.280 1.00 0.00 H TER 88133 WAT 4613 ATOM 88133 O WAT 4614 38.755 28.533 17.956 1.00 0.00 O ATOM 88134 H1 WAT 4614 39.611 28.316 17.587 1.00 0.00 H ATOM 88135 H2 WAT 4614 38.908 29.331 18.462 1.00 0.00 H TER 88137 WAT 4614 ATOM 88137 O WAT 4615 52.984 62.039 20.439 1.00 0.00 O ATOM 88138 H1 WAT 4615 53.156 61.798 21.349 1.00 0.00 H ATOM 88139 H2 WAT 4615 53.700 61.638 19.946 1.00 0.00 H TER 88141 WAT 4615 ATOM 88141 O WAT 4616 140.888 57.665 96.207 1.00 0.00 O ATOM 88142 H1 WAT 4616 140.937 57.720 95.253 1.00 0.00 H ATOM 88143 H2 WAT 4616 140.052 58.075 96.428 1.00 0.00 H TER 88145 WAT 4616 ATOM 88145 O WAT 4617 105.482 116.185 143.191 1.00 0.00 O ATOM 88146 H1 WAT 4617 106.397 116.230 142.914 1.00 0.00 H ATOM 88147 H2 WAT 4617 104.996 116.601 142.479 1.00 0.00 H TER 88149 WAT 4617 ATOM 88149 O WAT 4618 136.030 128.680 155.294 1.00 0.00 O ATOM 88150 H1 WAT 4618 136.467 128.442 154.476 1.00 0.00 H ATOM 88151 H2 WAT 4618 136.734 128.703 155.943 1.00 0.00 H TER 88153 WAT 4618 ATOM 88153 O WAT 4619 107.329 126.379 125.118 1.00 0.00 O ATOM 88154 H1 WAT 4619 108.000 126.830 125.629 1.00 0.00 H ATOM 88155 H2 WAT 4619 107.774 126.124 124.309 1.00 0.00 H TER 88157 WAT 4619 ATOM 88157 O WAT 4620 70.800 134.143 149.713 1.00 0.00 O ATOM 88158 H1 WAT 4620 70.808 133.352 150.253 1.00 0.00 H ATOM 88159 H2 WAT 4620 71.362 133.930 148.968 1.00 0.00 H TER 88161 WAT 4620 ATOM 88161 O WAT 4621 131.281 112.476 138.543 1.00 0.00 O ATOM 88162 H1 WAT 4621 131.845 112.959 137.940 1.00 0.00 H ATOM 88163 H2 WAT 4621 131.109 111.646 138.098 1.00 0.00 H TER 88165 WAT 4621 ATOM 88165 O WAT 4622 99.963 68.192 6.942 1.00 0.00 O ATOM 88166 H1 WAT 4622 100.908 68.337 6.894 1.00 0.00 H ATOM 88167 H2 WAT 4622 99.592 68.816 6.319 1.00 0.00 H TER 88169 WAT 4622 ATOM 88169 O WAT 4623 99.995 138.416 77.806 1.00 0.00 O ATOM 88170 H1 WAT 4623 100.951 138.436 77.771 1.00 0.00 H ATOM 88171 H2 WAT 4623 99.771 137.493 77.682 1.00 0.00 H TER 88173 WAT 4623 ATOM 88173 O WAT 4624 66.993 72.153 134.629 1.00 0.00 O ATOM 88174 H1 WAT 4624 67.277 72.621 133.844 1.00 0.00 H ATOM 88175 H2 WAT 4624 67.657 71.475 134.757 1.00 0.00 H TER 88177 WAT 4624 ATOM 88177 O WAT 4625 89.427 109.901 77.552 1.00 0.00 O ATOM 88178 H1 WAT 4625 88.660 110.288 77.973 1.00 0.00 H ATOM 88179 H2 WAT 4625 89.941 109.541 78.275 1.00 0.00 H TER 88181 WAT 4625 ATOM 88181 O WAT 4626 45.855 106.649 115.324 1.00 0.00 O ATOM 88182 H1 WAT 4626 45.645 107.553 115.561 1.00 0.00 H ATOM 88183 H2 WAT 4626 45.860 106.179 116.158 1.00 0.00 H TER 88185 WAT 4626 ATOM 88185 O WAT 4627 134.678 120.798 143.806 1.00 0.00 O ATOM 88186 H1 WAT 4627 133.784 120.742 143.468 1.00 0.00 H ATOM 88187 H2 WAT 4627 134.741 121.679 144.173 1.00 0.00 H TER 88189 WAT 4627 ATOM 88189 O WAT 4628 18.810 132.512 61.700 1.00 0.00 O ATOM 88190 H1 WAT 4628 18.312 132.614 60.889 1.00 0.00 H ATOM 88191 H2 WAT 4628 19.292 133.335 61.790 1.00 0.00 H TER 88193 WAT 4628 ATOM 88193 O WAT 4629 144.700 33.597 115.676 1.00 0.00 O ATOM 88194 H1 WAT 4629 145.487 33.927 115.241 1.00 0.00 H ATOM 88195 H2 WAT 4629 144.897 32.679 115.862 1.00 0.00 H TER 88197 WAT 4629 ATOM 88197 O WAT 4630 54.407 35.798 130.318 1.00 0.00 O ATOM 88198 H1 WAT 4630 53.982 35.128 130.854 1.00 0.00 H ATOM 88199 H2 WAT 4630 54.213 35.541 129.416 1.00 0.00 H TER 88201 WAT 4630 ATOM 88201 O WAT 4631 18.515 88.763 5.506 1.00 0.00 O ATOM 88202 H1 WAT 4631 18.195 87.930 5.851 1.00 0.00 H ATOM 88203 H2 WAT 4631 17.728 89.302 5.415 1.00 0.00 H TER 88205 WAT 4631 ATOM 88205 O WAT 4632 36.522 63.579 77.729 1.00 0.00 O ATOM 88206 H1 WAT 4632 35.762 64.139 77.883 1.00 0.00 H ATOM 88207 H2 WAT 4632 36.157 62.698 77.642 1.00 0.00 H TER 88209 WAT 4632 ATOM 88209 O WAT 4633 102.141 77.758 120.877 1.00 0.00 O ATOM 88210 H1 WAT 4633 101.308 77.351 121.115 1.00 0.00 H ATOM 88211 H2 WAT 4633 102.113 78.620 121.292 1.00 0.00 H TER 88213 WAT 4633 ATOM 88213 O WAT 4634 96.926 104.122 112.311 1.00 0.00 O ATOM 88214 H1 WAT 4634 97.208 103.407 112.882 1.00 0.00 H ATOM 88215 H2 WAT 4634 96.776 104.858 112.906 1.00 0.00 H TER 88217 WAT 4634 ATOM 88217 O WAT 4635 16.991 16.161 96.376 1.00 0.00 O ATOM 88218 H1 WAT 4635 17.336 16.471 95.539 1.00 0.00 H ATOM 88219 H2 WAT 4635 16.720 16.957 96.833 1.00 0.00 H TER 88221 WAT 4635 ATOM 88221 O WAT 4636 34.686 5.906 121.438 1.00 0.00 O ATOM 88222 H1 WAT 4636 35.444 5.972 122.019 1.00 0.00 H ATOM 88223 H2 WAT 4636 33.931 6.007 122.017 1.00 0.00 H TER 88225 WAT 4636 ATOM 88225 O WAT 4637 112.103 43.050 13.486 1.00 0.00 O ATOM 88226 H1 WAT 4637 112.330 43.980 13.495 1.00 0.00 H ATOM 88227 H2 WAT 4637 111.283 43.009 12.993 1.00 0.00 H TER 88229 WAT 4637 ATOM 88229 O WAT 4638 44.608 126.249 141.213 1.00 0.00 O ATOM 88230 H1 WAT 4638 44.562 125.332 140.942 1.00 0.00 H ATOM 88231 H2 WAT 4638 44.764 126.211 142.157 1.00 0.00 H TER 88233 WAT 4638 ATOM 88233 O WAT 4639 52.719 73.057 107.093 1.00 0.00 O ATOM 88234 H1 WAT 4639 53.010 73.780 107.649 1.00 0.00 H ATOM 88235 H2 WAT 4639 52.011 72.644 107.587 1.00 0.00 H TER 88237 WAT 4639 ATOM 88237 O WAT 4640 53.805 102.633 153.716 1.00 0.00 O ATOM 88238 H1 WAT 4640 54.575 103.186 153.847 1.00 0.00 H ATOM 88239 H2 WAT 4640 54.157 101.805 153.391 1.00 0.00 H TER 88241 WAT 4640 ATOM 88241 O WAT 4641 120.344 96.084 129.962 1.00 0.00 O ATOM 88242 H1 WAT 4641 120.586 95.183 130.175 1.00 0.00 H ATOM 88243 H2 WAT 4641 121.026 96.380 129.360 1.00 0.00 H TER 88245 WAT 4641 ATOM 88245 O WAT 4642 106.922 40.740 67.669 1.00 0.00 O ATOM 88246 H1 WAT 4642 107.034 39.790 67.622 1.00 0.00 H ATOM 88247 H2 WAT 4642 106.004 40.861 67.911 1.00 0.00 H TER 88249 WAT 4642 ATOM 88249 O WAT 4643 135.734 53.716 126.736 1.00 0.00 O ATOM 88250 H1 WAT 4643 134.908 53.276 126.935 1.00 0.00 H ATOM 88251 H2 WAT 4643 135.772 54.446 127.354 1.00 0.00 H TER 88253 WAT 4643 ATOM 88253 O WAT 4644 37.420 118.125 70.720 1.00 0.00 O ATOM 88254 H1 WAT 4644 36.482 118.275 70.841 1.00 0.00 H ATOM 88255 H2 WAT 4644 37.482 117.211 70.443 1.00 0.00 H TER 88257 WAT 4644 ATOM 88257 O WAT 4645 92.177 2.169 135.882 1.00 0.00 O ATOM 88258 H1 WAT 4645 92.708 2.942 136.075 1.00 0.00 H ATOM 88259 H2 WAT 4645 91.607 2.444 135.164 1.00 0.00 H TER 88261 WAT 4645 ATOM 88261 O WAT 4646 116.796 95.511 114.540 1.00 0.00 O ATOM 88262 H1 WAT 4646 117.509 94.897 114.714 1.00 0.00 H ATOM 88263 H2 WAT 4646 116.143 95.317 115.212 1.00 0.00 H TER 88265 WAT 4646 ATOM 88265 O WAT 4647 88.479 101.941 76.642 1.00 0.00 O ATOM 88266 H1 WAT 4647 87.795 102.611 76.640 1.00 0.00 H ATOM 88267 H2 WAT 4647 88.003 101.112 76.687 1.00 0.00 H TER 88269 WAT 4647 ATOM 88269 O WAT 4648 60.338 120.998 64.264 1.00 0.00 O ATOM 88270 H1 WAT 4648 61.047 120.843 63.640 1.00 0.00 H ATOM 88271 H2 WAT 4648 60.777 121.326 65.049 1.00 0.00 H TER 88273 WAT 4648 ATOM 88273 O WAT 4649 45.234 121.961 60.227 1.00 0.00 O ATOM 88274 H1 WAT 4649 45.157 121.020 60.071 1.00 0.00 H ATOM 88275 H2 WAT 4649 45.553 122.316 59.397 1.00 0.00 H TER 88277 WAT 4649 ATOM 88277 O WAT 4650 82.965 91.167 147.302 1.00 0.00 O ATOM 88278 H1 WAT 4650 83.470 90.357 147.368 1.00 0.00 H ATOM 88279 H2 WAT 4650 83.218 91.670 148.077 1.00 0.00 H TER 88281 WAT 4650 ATOM 88281 O WAT 4651 23.172 70.319 102.954 1.00 0.00 O ATOM 88282 H1 WAT 4651 23.925 70.721 103.387 1.00 0.00 H ATOM 88283 H2 WAT 4651 22.435 70.502 103.538 1.00 0.00 H TER 88285 WAT 4651 ATOM 88285 O WAT 4652 64.920 131.812 73.463 1.00 0.00 O ATOM 88286 H1 WAT 4652 64.190 131.797 72.844 1.00 0.00 H ATOM 88287 H2 WAT 4652 64.881 130.961 73.899 1.00 0.00 H TER 88289 WAT 4652 ATOM 88289 O WAT 4653 94.851 123.020 116.369 1.00 0.00 O ATOM 88290 H1 WAT 4653 94.671 122.560 115.549 1.00 0.00 H ATOM 88291 H2 WAT 4653 95.799 122.947 116.482 1.00 0.00 H TER 88293 WAT 4653 ATOM 88293 O WAT 4654 72.796 66.640 122.346 1.00 0.00 O ATOM 88294 H1 WAT 4654 72.017 66.607 121.791 1.00 0.00 H ATOM 88295 H2 WAT 4654 73.529 66.659 121.730 1.00 0.00 H TER 88297 WAT 4654 ATOM 88297 O WAT 4655 6.747 102.186 99.189 1.00 0.00 O ATOM 88298 H1 WAT 4655 7.232 101.716 99.868 1.00 0.00 H ATOM 88299 H2 WAT 4655 6.145 101.534 98.830 1.00 0.00 H TER 88301 WAT 4655 ATOM 88301 O WAT 4656 16.803 33.213 122.569 1.00 0.00 O ATOM 88302 H1 WAT 4656 17.258 32.784 123.294 1.00 0.00 H ATOM 88303 H2 WAT 4656 17.279 32.933 121.787 1.00 0.00 H TER 88305 WAT 4656 ATOM 88305 O WAT 4657 100.757 118.708 106.193 1.00 0.00 O ATOM 88306 H1 WAT 4657 101.465 118.725 105.548 1.00 0.00 H ATOM 88307 H2 WAT 4657 100.479 117.792 106.219 1.00 0.00 H TER 88309 WAT 4657 ATOM 88309 O WAT 4658 75.133 136.516 116.379 1.00 0.00 O ATOM 88310 H1 WAT 4658 74.688 135.922 116.984 1.00 0.00 H ATOM 88311 H2 WAT 4658 74.993 136.128 115.516 1.00 0.00 H TER 88313 WAT 4658 ATOM 88313 O WAT 4659 110.896 101.819 135.586 1.00 0.00 O ATOM 88314 H1 WAT 4659 111.342 101.285 136.243 1.00 0.00 H ATOM 88315 H2 WAT 4659 110.555 102.567 136.076 1.00 0.00 H TER 88317 WAT 4659 ATOM 88317 O WAT 4660 114.798 102.998 105.722 1.00 0.00 O ATOM 88318 H1 WAT 4660 114.521 103.757 105.210 1.00 0.00 H ATOM 88319 H2 WAT 4660 114.395 102.250 105.280 1.00 0.00 H TER 88321 WAT 4660 ATOM 88321 O WAT 4661 0.981 59.142 83.973 1.00 0.00 O ATOM 88322 H1 WAT 4661 1.749 59.450 83.492 1.00 0.00 H ATOM 88323 H2 WAT 4661 1.010 59.618 84.802 1.00 0.00 H TER 88325 WAT 4661 ATOM 88325 O WAT 4662 116.910 8.310 135.128 1.00 0.00 O ATOM 88326 H1 WAT 4662 117.150 8.623 136.000 1.00 0.00 H ATOM 88327 H2 WAT 4662 117.445 8.833 134.531 1.00 0.00 H TER 88329 WAT 4662 ATOM 88329 O WAT 4663 120.372 66.958 130.633 1.00 0.00 O ATOM 88330 H1 WAT 4663 120.297 66.761 131.567 1.00 0.00 H ATOM 88331 H2 WAT 4663 119.490 66.825 130.288 1.00 0.00 H TER 88333 WAT 4663 ATOM 88333 O WAT 4664 62.515 94.117 126.383 1.00 0.00 O ATOM 88334 H1 WAT 4664 62.971 94.753 125.831 1.00 0.00 H ATOM 88335 H2 WAT 4664 62.202 94.629 127.129 1.00 0.00 H TER 88337 WAT 4664 ATOM 88337 O WAT 4665 51.080 118.796 108.647 1.00 0.00 O ATOM 88338 H1 WAT 4665 51.117 119.537 109.252 1.00 0.00 H ATOM 88339 H2 WAT 4665 51.607 119.072 107.897 1.00 0.00 H TER 88341 WAT 4665 ATOM 88341 O WAT 4666 28.756 13.712 65.626 1.00 0.00 O ATOM 88342 H1 WAT 4666 28.239 14.317 66.159 1.00 0.00 H ATOM 88343 H2 WAT 4666 28.936 14.197 64.821 1.00 0.00 H TER 88345 WAT 4666 ATOM 88345 O WAT 4667 22.968 6.459 119.255 1.00 0.00 O ATOM 88346 H1 WAT 4667 23.882 6.714 119.380 1.00 0.00 H ATOM 88347 H2 WAT 4667 22.936 6.115 118.362 1.00 0.00 H TER 88349 WAT 4667 ATOM 88349 O WAT 4668 144.514 3.536 12.723 1.00 0.00 O ATOM 88350 H1 WAT 4668 143.684 4.004 12.632 1.00 0.00 H ATOM 88351 H2 WAT 4668 144.443 3.085 13.564 1.00 0.00 H TER 88353 WAT 4668 ATOM 88353 O WAT 4669 58.833 2.447 71.162 1.00 0.00 O ATOM 88354 H1 WAT 4669 59.106 3.360 71.251 1.00 0.00 H ATOM 88355 H2 WAT 4669 57.884 2.468 71.284 1.00 0.00 H TER 88357 WAT 4669 ATOM 88357 O WAT 4670 134.930 49.266 70.598 1.00 0.00 O ATOM 88358 H1 WAT 4670 135.805 49.311 70.983 1.00 0.00 H ATOM 88359 H2 WAT 4670 134.808 48.339 70.389 1.00 0.00 H TER 88361 WAT 4670 ATOM 88361 O WAT 4671 83.237 101.725 112.272 1.00 0.00 O ATOM 88362 H1 WAT 4671 83.617 100.948 111.862 1.00 0.00 H ATOM 88363 H2 WAT 4671 83.971 102.333 112.358 1.00 0.00 H TER 88365 WAT 4671 ATOM 88365 O WAT 4672 86.541 93.875 129.691 1.00 0.00 O ATOM 88366 H1 WAT 4672 85.989 94.396 129.107 1.00 0.00 H ATOM 88367 H2 WAT 4672 86.149 93.991 130.557 1.00 0.00 H TER 88369 WAT 4672 ATOM 88369 O WAT 4673 140.518 133.965 150.453 1.00 0.00 O ATOM 88370 H1 WAT 4673 141.348 134.150 150.893 1.00 0.00 H ATOM 88371 H2 WAT 4673 140.667 134.221 149.543 1.00 0.00 H TER 88373 WAT 4673 ATOM 88373 O WAT 4674 91.284 131.755 108.453 1.00 0.00 O ATOM 88374 H1 WAT 4674 92.026 131.928 107.872 1.00 0.00 H ATOM 88375 H2 WAT 4674 90.585 131.463 107.868 1.00 0.00 H TER 88377 WAT 4674 ATOM 88377 O WAT 4675 29.217 144.843 134.620 1.00 0.00 O ATOM 88378 H1 WAT 4675 29.461 144.280 133.885 1.00 0.00 H ATOM 88379 H2 WAT 4675 29.208 144.257 135.377 1.00 0.00 H TER 88381 WAT 4675 ATOM 88381 O WAT 4676 14.934 132.851 142.002 1.00 0.00 O ATOM 88382 H1 WAT 4676 14.734 131.925 142.138 1.00 0.00 H ATOM 88383 H2 WAT 4676 15.701 132.849 141.430 1.00 0.00 H TER 88385 WAT 4676 ATOM 88385 O WAT 4677 58.362 132.098 69.044 1.00 0.00 O ATOM 88386 H1 WAT 4677 57.625 131.601 69.399 1.00 0.00 H ATOM 88387 H2 WAT 4677 58.718 132.570 69.797 1.00 0.00 H TER 88389 WAT 4677 ATOM 88389 O WAT 4678 14.531 100.678 134.980 1.00 0.00 O ATOM 88390 H1 WAT 4678 14.039 101.128 135.666 1.00 0.00 H ATOM 88391 H2 WAT 4678 14.502 101.276 134.233 1.00 0.00 H TER 88393 WAT 4678 ATOM 88393 O WAT 4679 61.912 85.129 14.815 1.00 0.00 O ATOM 88394 H1 WAT 4679 61.235 84.847 15.430 1.00 0.00 H ATOM 88395 H2 WAT 4679 62.003 86.069 14.973 1.00 0.00 H TER 88397 WAT 4679 ATOM 88397 O WAT 4680 107.697 95.322 114.794 1.00 0.00 O ATOM 88398 H1 WAT 4680 108.219 94.564 115.058 1.00 0.00 H ATOM 88399 H2 WAT 4680 108.334 96.031 114.706 1.00 0.00 H TER 88401 WAT 4680 ATOM 88401 O WAT 4681 97.961 15.503 106.568 1.00 0.00 O ATOM 88402 H1 WAT 4681 98.058 15.285 107.495 1.00 0.00 H ATOM 88403 H2 WAT 4681 98.772 15.959 106.343 1.00 0.00 H TER 88405 WAT 4681 ATOM 88405 O WAT 4682 9.421 71.713 100.668 1.00 0.00 O ATOM 88406 H1 WAT 4682 8.944 72.075 101.415 1.00 0.00 H ATOM 88407 H2 WAT 4682 9.107 72.217 99.917 1.00 0.00 H TER 88409 WAT 4682 ATOM 88409 O WAT 4683 124.692 80.436 74.663 1.00 0.00 O ATOM 88410 H1 WAT 4683 125.501 80.707 75.095 1.00 0.00 H ATOM 88411 H2 WAT 4683 124.932 80.341 73.742 1.00 0.00 H TER 88413 WAT 4683 ATOM 88413 O WAT 4684 21.499 84.162 144.049 1.00 0.00 O ATOM 88414 H1 WAT 4684 21.609 83.311 144.474 1.00 0.00 H ATOM 88415 H2 WAT 4684 21.532 84.794 144.766 1.00 0.00 H TER 88417 WAT 4684 ATOM 88417 O WAT 4685 140.357 4.119 74.951 1.00 0.00 O ATOM 88418 H1 WAT 4685 139.581 4.645 74.755 1.00 0.00 H ATOM 88419 H2 WAT 4685 140.024 3.383 75.464 1.00 0.00 H TER 88421 WAT 4685 ATOM 88421 O WAT 4686 75.270 40.172 20.943 1.00 0.00 O ATOM 88422 H1 WAT 4686 74.965 41.077 20.877 1.00 0.00 H ATOM 88423 H2 WAT 4686 76.159 40.244 21.292 1.00 0.00 H TER 88425 WAT 4686 ATOM 88425 O WAT 4687 60.488 109.325 14.169 1.00 0.00 O ATOM 88426 H1 WAT 4687 60.588 109.927 14.907 1.00 0.00 H ATOM 88427 H2 WAT 4687 59.955 109.808 13.537 1.00 0.00 H TER 88429 WAT 4687 ATOM 88429 O WAT 4688 91.615 50.219 155.045 1.00 0.00 O ATOM 88430 H1 WAT 4688 91.754 51.112 154.730 1.00 0.00 H ATOM 88431 H2 WAT 4688 92.200 49.683 154.511 1.00 0.00 H TER 88433 WAT 4688 ATOM 88433 O WAT 4689 124.777 12.633 97.160 1.00 0.00 O ATOM 88434 H1 WAT 4689 124.198 13.325 96.839 1.00 0.00 H ATOM 88435 H2 WAT 4689 125.570 13.093 97.434 1.00 0.00 H TER 88437 WAT 4689 ATOM 88437 O WAT 4690 2.802 36.208 19.034 1.00 0.00 O ATOM 88438 H1 WAT 4690 3.369 35.588 19.491 1.00 0.00 H ATOM 88439 H2 WAT 4690 1.914 35.940 19.271 1.00 0.00 H TER 88441 WAT 4690 ATOM 88441 O WAT 4691 60.248 133.090 96.491 1.00 0.00 O ATOM 88442 H1 WAT 4691 60.206 133.539 97.336 1.00 0.00 H ATOM 88443 H2 WAT 4691 59.519 133.455 95.989 1.00 0.00 H TER 88445 WAT 4691 ATOM 88445 O WAT 4692 74.493 76.218 150.346 1.00 0.00 O ATOM 88446 H1 WAT 4692 74.882 75.824 149.565 1.00 0.00 H ATOM 88447 H2 WAT 4692 73.675 76.606 150.036 1.00 0.00 H TER 88449 WAT 4692 ATOM 88449 O WAT 4693 28.969 131.491 107.224 1.00 0.00 O ATOM 88450 H1 WAT 4693 29.774 131.518 107.742 1.00 0.00 H ATOM 88451 H2 WAT 4693 28.998 132.289 106.696 1.00 0.00 H TER 88453 WAT 4693 ATOM 88453 O WAT 4694 119.362 4.010 138.901 1.00 0.00 O ATOM 88454 H1 WAT 4694 119.830 4.357 139.660 1.00 0.00 H ATOM 88455 H2 WAT 4694 119.615 3.087 138.865 1.00 0.00 H TER 88457 WAT 4694 ATOM 88457 O WAT 4695 48.984 124.460 123.183 1.00 0.00 O ATOM 88458 H1 WAT 4695 48.589 125.063 122.553 1.00 0.00 H ATOM 88459 H2 WAT 4695 49.202 125.009 123.936 1.00 0.00 H TER 88461 WAT 4695 ATOM 88461 O WAT 4696 128.272 131.761 73.406 1.00 0.00 O ATOM 88462 H1 WAT 4696 127.546 131.481 73.963 1.00 0.00 H ATOM 88463 H2 WAT 4696 127.960 132.566 72.992 1.00 0.00 H TER 88465 WAT 4696 ATOM 88465 O WAT 4697 103.312 86.085 88.845 1.00 0.00 O ATOM 88466 H1 WAT 4697 103.315 86.745 88.151 1.00 0.00 H ATOM 88467 H2 WAT 4697 103.383 86.589 89.655 1.00 0.00 H TER 88469 WAT 4697 ATOM 88469 O WAT 4698 20.762 63.993 122.931 1.00 0.00 O ATOM 88470 H1 WAT 4698 21.148 63.221 123.344 1.00 0.00 H ATOM 88471 H2 WAT 4698 20.926 64.703 123.551 1.00 0.00 H TER 88473 WAT 4698 ATOM 88473 O WAT 4699 120.583 114.965 114.788 1.00 0.00 O ATOM 88474 H1 WAT 4699 120.686 115.361 113.922 1.00 0.00 H ATOM 88475 H2 WAT 4699 120.620 115.703 115.395 1.00 0.00 H TER 88477 WAT 4699 ATOM 88477 O WAT 4700 138.398 72.129 55.902 1.00 0.00 O ATOM 88478 H1 WAT 4700 138.355 71.214 55.623 1.00 0.00 H ATOM 88479 H2 WAT 4700 139.229 72.448 55.550 1.00 0.00 H TER 88481 WAT 4700 ATOM 88481 O WAT 4701 13.255 27.903 148.472 1.00 0.00 O ATOM 88482 H1 WAT 4701 13.938 28.250 147.898 1.00 0.00 H ATOM 88483 H2 WAT 4701 13.203 28.533 149.191 1.00 0.00 H TER 88485 WAT 4701 ATOM 88485 O WAT 4702 57.828 70.252 26.106 1.00 0.00 O ATOM 88486 H1 WAT 4702 57.492 69.593 25.499 1.00 0.00 H ATOM 88487 H2 WAT 4702 57.048 70.713 26.415 1.00 0.00 H TER 88489 WAT 4702 ATOM 88489 O WAT 4703 34.262 5.620 149.372 1.00 0.00 O ATOM 88490 H1 WAT 4703 34.053 4.837 149.881 1.00 0.00 H ATOM 88491 H2 WAT 4703 33.546 5.695 148.741 1.00 0.00 H TER 88493 WAT 4703 ATOM 88493 O WAT 4704 99.256 34.162 57.198 1.00 0.00 O ATOM 88494 H1 WAT 4704 99.337 34.897 56.590 1.00 0.00 H ATOM 88495 H2 WAT 4704 98.982 33.427 56.649 1.00 0.00 H TER 88497 WAT 4704 ATOM 88497 O WAT 4705 112.048 140.998 145.209 1.00 0.00 O ATOM 88498 H1 WAT 4705 112.270 141.247 144.312 1.00 0.00 H ATOM 88499 H2 WAT 4705 112.097 140.042 145.212 1.00 0.00 H TER 88501 WAT 4705 ATOM 88501 O WAT 4706 5.280 111.136 70.957 1.00 0.00 O ATOM 88502 H1 WAT 4706 4.796 111.667 71.589 1.00 0.00 H ATOM 88503 H2 WAT 4706 5.350 111.692 70.181 1.00 0.00 H TER 88505 WAT 4706 ATOM 88505 O WAT 4707 131.491 135.654 153.564 1.00 0.00 O ATOM 88506 H1 WAT 4707 131.998 135.448 152.779 1.00 0.00 H ATOM 88507 H2 WAT 4707 130.674 135.167 153.456 1.00 0.00 H TER 88509 WAT 4707 ATOM 88509 O WAT 4708 58.744 51.529 12.575 1.00 0.00 O ATOM 88510 H1 WAT 4708 58.824 52.130 13.316 1.00 0.00 H ATOM 88511 H2 WAT 4708 58.128 50.861 12.875 1.00 0.00 H TER 88513 WAT 4708 ATOM 88513 O WAT 4709 52.575 74.145 126.195 1.00 0.00 O ATOM 88514 H1 WAT 4709 52.281 73.928 127.080 1.00 0.00 H ATOM 88515 H2 WAT 4709 52.076 74.928 125.962 1.00 0.00 H TER 88517 WAT 4709 ATOM 88517 O WAT 4710 20.626 89.413 102.257 1.00 0.00 O ATOM 88518 H1 WAT 4710 21.240 90.147 102.265 1.00 0.00 H ATOM 88519 H2 WAT 4710 19.762 89.823 102.217 1.00 0.00 H TER 88521 WAT 4710 ATOM 88521 O WAT 4711 127.681 8.173 145.618 1.00 0.00 O ATOM 88522 H1 WAT 4711 128.382 8.746 145.306 1.00 0.00 H ATOM 88523 H2 WAT 4711 127.025 8.197 144.922 1.00 0.00 H TER 88525 WAT 4711 ATOM 88525 O WAT 4712 18.796 44.621 130.971 1.00 0.00 O ATOM 88526 H1 WAT 4712 19.719 44.753 130.757 1.00 0.00 H ATOM 88527 H2 WAT 4712 18.358 44.563 130.122 1.00 0.00 H TER 88529 WAT 4712 ATOM 88529 O WAT 4713 138.810 81.416 69.092 1.00 0.00 O ATOM 88530 H1 WAT 4713 138.207 81.488 68.353 1.00 0.00 H ATOM 88531 H2 WAT 4713 139.254 80.579 68.959 1.00 0.00 H TER 88533 WAT 4713 ATOM 88533 O WAT 4714 130.007 114.775 78.094 1.00 0.00 O ATOM 88534 H1 WAT 4714 130.510 114.965 78.886 1.00 0.00 H ATOM 88535 H2 WAT 4714 130.529 115.147 77.383 1.00 0.00 H TER 88537 WAT 4714 ATOM 88537 O WAT 4715 20.073 44.020 158.249 1.00 0.00 O ATOM 88538 H1 WAT 4715 20.809 43.439 158.054 1.00 0.00 H ATOM 88539 H2 WAT 4715 20.010 44.015 159.204 1.00 0.00 H TER 88541 WAT 4715 ATOM 88541 O WAT 4716 15.807 112.186 132.275 1.00 0.00 O ATOM 88542 H1 WAT 4716 14.951 112.601 132.378 1.00 0.00 H ATOM 88543 H2 WAT 4716 15.713 111.631 131.502 1.00 0.00 H TER 88545 WAT 4716 ATOM 88545 O WAT 4717 109.272 41.647 4.287 1.00 0.00 O ATOM 88546 H1 WAT 4717 109.201 41.232 3.427 1.00 0.00 H ATOM 88547 H2 WAT 4717 110.212 41.657 4.470 1.00 0.00 H TER 88549 WAT 4717 ATOM 88549 O WAT 4718 99.556 63.961 59.873 1.00 0.00 O ATOM 88550 H1 WAT 4718 98.816 64.305 60.373 1.00 0.00 H ATOM 88551 H2 WAT 4718 100.068 63.466 60.513 1.00 0.00 H TER 88553 WAT 4718 ATOM 88553 O WAT 4719 93.495 28.505 103.187 1.00 0.00 O ATOM 88554 H1 WAT 4719 93.689 28.841 104.062 1.00 0.00 H ATOM 88555 H2 WAT 4719 94.145 27.817 103.046 1.00 0.00 H TER 88557 WAT 4719 ATOM 88557 O WAT 4720 43.032 89.341 134.298 1.00 0.00 O ATOM 88558 H1 WAT 4720 42.629 88.625 133.806 1.00 0.00 H ATOM 88559 H2 WAT 4720 43.660 89.727 133.687 1.00 0.00 H TER 88561 WAT 4720 ATOM 88561 O WAT 4721 41.089 7.218 142.216 1.00 0.00 O ATOM 88562 H1 WAT 4721 41.618 7.402 141.440 1.00 0.00 H ATOM 88563 H2 WAT 4721 40.783 6.320 142.090 1.00 0.00 H TER 88565 WAT 4721 ATOM 88565 O WAT 4722 4.235 119.145 144.542 1.00 0.00 O ATOM 88566 H1 WAT 4722 4.329 118.216 144.332 1.00 0.00 H ATOM 88567 H2 WAT 4722 3.717 119.502 143.821 1.00 0.00 H TER 88569 WAT 4722 ATOM 88569 O WAT 4723 131.312 73.539 109.814 1.00 0.00 O ATOM 88570 H1 WAT 4723 131.481 74.193 109.136 1.00 0.00 H ATOM 88571 H2 WAT 4723 130.595 73.908 110.330 1.00 0.00 H TER 88573 WAT 4723 ATOM 88573 O WAT 4724 56.953 135.803 80.549 1.00 0.00 O ATOM 88574 H1 WAT 4724 57.648 135.315 80.992 1.00 0.00 H ATOM 88575 H2 WAT 4724 56.761 135.288 79.766 1.00 0.00 H TER 88577 WAT 4724 ATOM 88577 O WAT 4725 122.391 17.652 11.523 1.00 0.00 O ATOM 88578 H1 WAT 4725 121.904 16.923 11.907 1.00 0.00 H ATOM 88579 H2 WAT 4725 121.754 18.096 10.962 1.00 0.00 H TER 88581 WAT 4725 ATOM 88581 O WAT 4726 62.328 91.455 119.894 1.00 0.00 O ATOM 88582 H1 WAT 4726 62.823 91.137 120.650 1.00 0.00 H ATOM 88583 H2 WAT 4726 61.945 92.281 120.190 1.00 0.00 H TER 88585 WAT 4726 ATOM 88585 O WAT 4727 47.964 24.903 75.124 1.00 0.00 O ATOM 88586 H1 WAT 4727 48.001 25.759 75.552 1.00 0.00 H ATOM 88587 H2 WAT 4727 48.224 25.075 74.219 1.00 0.00 H TER 88589 WAT 4727 ATOM 88589 O WAT 4728 109.724 64.924 149.457 1.00 0.00 O ATOM 88590 H1 WAT 4728 109.208 65.422 148.824 1.00 0.00 H ATOM 88591 H2 WAT 4728 110.572 64.799 149.030 1.00 0.00 H TER 88593 WAT 4728 ATOM 88593 O WAT 4729 71.606 114.249 110.358 1.00 0.00 O ATOM 88594 H1 WAT 4729 71.454 113.309 110.263 1.00 0.00 H ATOM 88595 H2 WAT 4729 71.750 114.560 109.464 1.00 0.00 H TER 88597 WAT 4729 ATOM 88597 O WAT 4730 75.271 97.163 91.015 1.00 0.00 O ATOM 88598 H1 WAT 4730 75.075 97.020 90.089 1.00 0.00 H ATOM 88599 H2 WAT 4730 74.922 98.034 91.202 1.00 0.00 H TER 88601 WAT 4730 ATOM 88601 O WAT 4731 77.318 135.752 110.520 1.00 0.00 O ATOM 88602 H1 WAT 4731 77.275 136.254 109.707 1.00 0.00 H ATOM 88603 H2 WAT 4731 78.095 136.086 110.968 1.00 0.00 H TER 88605 WAT 4731 ATOM 88605 O WAT 4732 56.345 99.841 15.946 1.00 0.00 O ATOM 88606 H1 WAT 4732 56.346 100.597 16.533 1.00 0.00 H ATOM 88607 H2 WAT 4732 55.606 99.310 16.241 1.00 0.00 H TER 88609 WAT 4732 ATOM 88609 O WAT 4733 77.768 42.311 104.254 1.00 0.00 O ATOM 88610 H1 WAT 4733 78.087 43.200 104.411 1.00 0.00 H ATOM 88611 H2 WAT 4733 78.491 41.874 103.803 1.00 0.00 H TER 88613 WAT 4733 ATOM 88613 O WAT 4734 94.009 133.737 64.745 1.00 0.00 O ATOM 88614 H1 WAT 4734 94.601 133.917 64.016 1.00 0.00 H ATOM 88615 H2 WAT 4734 93.882 132.789 64.722 1.00 0.00 H TER 88617 WAT 4734 ATOM 88617 O WAT 4735 109.041 127.686 18.628 1.00 0.00 O ATOM 88618 H1 WAT 4735 108.485 128.462 18.561 1.00 0.00 H ATOM 88619 H2 WAT 4735 109.824 127.990 19.086 1.00 0.00 H TER 88621 WAT 4735 ATOM 88621 O WAT 4736 142.397 74.647 13.316 1.00 0.00 O ATOM 88622 H1 WAT 4736 141.811 74.716 14.070 1.00 0.00 H ATOM 88623 H2 WAT 4736 142.964 73.903 13.521 1.00 0.00 H TER 88625 WAT 4736 ATOM 88625 O WAT 4737 48.890 75.371 101.586 1.00 0.00 O ATOM 88626 H1 WAT 4737 48.890 76.021 100.883 1.00 0.00 H ATOM 88627 H2 WAT 4737 48.933 75.888 102.390 1.00 0.00 H TER 88629 WAT 4737 ATOM 88629 O WAT 4738 32.667 0.296 141.709 1.00 0.00 O ATOM 88630 H1 WAT 4738 32.849 1.143 142.116 1.00 0.00 H ATOM 88631 H2 WAT 4738 33.110 0.338 140.861 1.00 0.00 H TER 88633 WAT 4738 ATOM 88633 O WAT 4739 21.513 102.881 122.312 1.00 0.00 O ATOM 88634 H1 WAT 4739 20.934 103.213 122.998 1.00 0.00 H ATOM 88635 H2 WAT 4739 20.952 102.322 121.774 1.00 0.00 H TER 88637 WAT 4739 ATOM 88637 O WAT 4740 92.832 99.842 121.923 1.00 0.00 O ATOM 88638 H1 WAT 4740 93.527 99.850 121.265 1.00 0.00 H ATOM 88639 H2 WAT 4740 93.294 99.891 122.760 1.00 0.00 H TER 88641 WAT 4740 ATOM 88641 O WAT 4741 46.128 5.061 18.952 1.00 0.00 O ATOM 88642 H1 WAT 4741 47.032 5.232 19.216 1.00 0.00 H ATOM 88643 H2 WAT 4741 45.667 4.887 19.773 1.00 0.00 H TER 88645 WAT 4741 ATOM 88645 O WAT 4742 97.861 133.991 105.101 1.00 0.00 O ATOM 88646 H1 WAT 4742 97.940 134.348 104.217 1.00 0.00 H ATOM 88647 H2 WAT 4742 97.710 134.756 105.656 1.00 0.00 H TER 88649 WAT 4742 ATOM 88649 O WAT 4743 54.696 96.392 151.749 1.00 0.00 O ATOM 88650 H1 WAT 4743 54.017 97.055 151.622 1.00 0.00 H ATOM 88651 H2 WAT 4743 54.476 95.980 152.584 1.00 0.00 H TER 88653 WAT 4743 ATOM 88653 O WAT 4744 23.190 81.229 111.428 1.00 0.00 O ATOM 88654 H1 WAT 4744 22.752 81.572 110.649 1.00 0.00 H ATOM 88655 H2 WAT 4744 22.613 80.533 111.740 1.00 0.00 H TER 88657 WAT 4744 ATOM 88657 O WAT 4745 26.516 15.539 149.592 1.00 0.00 O ATOM 88658 H1 WAT 4745 26.997 16.125 149.007 1.00 0.00 H ATOM 88659 H2 WAT 4745 27.142 15.325 150.284 1.00 0.00 H TER 88661 WAT 4745 ATOM 88661 O WAT 4746 41.123 95.925 111.009 1.00 0.00 O ATOM 88662 H1 WAT 4746 41.270 96.741 110.531 1.00 0.00 H ATOM 88663 H2 WAT 4746 41.137 95.246 110.334 1.00 0.00 H TER 88665 WAT 4746 ATOM 88665 O WAT 4747 44.613 25.156 107.097 1.00 0.00 O ATOM 88666 H1 WAT 4747 45.368 24.854 107.602 1.00 0.00 H ATOM 88667 H2 WAT 4747 44.175 24.352 106.818 1.00 0.00 H TER 88669 WAT 4747 ATOM 88669 O WAT 4748 89.139 49.794 133.920 1.00 0.00 O ATOM 88670 H1 WAT 4748 88.192 49.757 133.780 1.00 0.00 H ATOM 88671 H2 WAT 4748 89.420 50.574 133.442 1.00 0.00 H TER 88673 WAT 4748 ATOM 88673 O WAT 4749 127.615 96.406 137.613 1.00 0.00 O ATOM 88674 H1 WAT 4749 128.234 95.699 137.794 1.00 0.00 H ATOM 88675 H2 WAT 4749 127.894 97.121 138.184 1.00 0.00 H TER 88677 WAT 4749 ATOM 88677 O WAT 4750 98.864 33.349 155.774 1.00 0.00 O ATOM 88678 H1 WAT 4750 99.441 33.237 155.019 1.00 0.00 H ATOM 88679 H2 WAT 4750 99.301 34.008 156.314 1.00 0.00 H TER 88681 WAT 4750 ATOM 88681 O WAT 4751 24.245 22.759 117.233 1.00 0.00 O ATOM 88682 H1 WAT 4751 24.958 23.396 117.267 1.00 0.00 H ATOM 88683 H2 WAT 4751 23.892 22.747 118.123 1.00 0.00 H TER 88685 WAT 4751 ATOM 88685 O WAT 4752 121.311 87.531 128.032 1.00 0.00 O ATOM 88686 H1 WAT 4752 121.488 87.843 127.144 1.00 0.00 H ATOM 88687 H2 WAT 4752 120.561 86.944 127.935 1.00 0.00 H TER 88689 WAT 4752 ATOM 88689 O WAT 4753 63.279 118.217 100.286 1.00 0.00 O ATOM 88690 H1 WAT 4753 63.018 118.417 99.387 1.00 0.00 H ATOM 88691 H2 WAT 4753 62.724 117.478 100.537 1.00 0.00 H TER 88693 WAT 4753 ATOM 88693 O WAT 4754 66.454 48.052 69.384 1.00 0.00 O ATOM 88694 H1 WAT 4754 66.239 47.687 68.525 1.00 0.00 H ATOM 88695 H2 WAT 4754 67.231 48.590 69.228 1.00 0.00 H TER 88697 WAT 4754 ATOM 88697 O WAT 4755 99.208 131.486 77.105 1.00 0.00 O ATOM 88698 H1 WAT 4755 98.705 131.019 76.438 1.00 0.00 H ATOM 88699 H2 WAT 4755 99.458 130.810 77.735 1.00 0.00 H TER 88701 WAT 4755 ATOM 88701 O WAT 4756 1.401 75.799 23.924 1.00 0.00 O ATOM 88702 H1 WAT 4756 1.001 74.951 23.730 1.00 0.00 H ATOM 88703 H2 WAT 4756 2.259 75.581 24.288 1.00 0.00 H TER 88705 WAT 4756 ATOM 88705 O WAT 4757 104.634 104.173 142.310 1.00 0.00 O ATOM 88706 H1 WAT 4757 105.144 104.792 142.833 1.00 0.00 H ATOM 88707 H2 WAT 4757 104.566 104.585 141.449 1.00 0.00 H TER 88709 WAT 4757 ATOM 88709 O WAT 4758 137.315 28.314 125.211 1.00 0.00 O ATOM 88710 H1 WAT 4758 136.925 27.478 124.954 1.00 0.00 H ATOM 88711 H2 WAT 4758 136.629 28.753 125.714 1.00 0.00 H TER 88713 WAT 4758 ATOM 88713 O WAT 4759 66.472 21.360 5.140 1.00 0.00 O ATOM 88714 H1 WAT 4759 65.535 21.198 5.247 1.00 0.00 H ATOM 88715 H2 WAT 4759 66.597 21.421 4.192 1.00 0.00 H TER 88717 WAT 4759 ATOM 88717 O WAT 4760 99.026 95.520 0.496 1.00 0.00 O ATOM 88718 H1 WAT 4760 98.946 94.644 0.875 1.00 0.00 H ATOM 88719 H2 WAT 4760 98.721 96.108 1.187 1.00 0.00 H TER 88721 WAT 4760 ATOM 88721 O WAT 4761 95.122 15.480 115.387 1.00 0.00 O ATOM 88722 H1 WAT 4761 94.172 15.436 115.499 1.00 0.00 H ATOM 88723 H2 WAT 4761 95.470 15.431 116.277 1.00 0.00 H TER 88725 WAT 4761 ATOM 88725 O WAT 4762 103.377 139.031 147.563 1.00 0.00 O ATOM 88726 H1 WAT 4762 103.478 139.439 146.703 1.00 0.00 H ATOM 88727 H2 WAT 4762 103.920 139.561 148.145 1.00 0.00 H TER 88729 WAT 4762 ATOM 88729 O WAT 4763 101.332 115.310 11.657 1.00 0.00 O ATOM 88730 H1 WAT 4763 101.752 116.170 11.630 1.00 0.00 H ATOM 88731 H2 WAT 4763 102.060 114.689 11.690 1.00 0.00 H TER 88733 WAT 4763 ATOM 88733 O WAT 4764 95.147 7.521 122.270 1.00 0.00 O ATOM 88734 H1 WAT 4764 95.808 8.122 121.925 1.00 0.00 H ATOM 88735 H2 WAT 4764 95.317 7.493 123.212 1.00 0.00 H TER 88737 WAT 4764 ATOM 88737 O WAT 4765 38.121 142.049 103.683 1.00 0.00 O ATOM 88738 H1 WAT 4765 38.082 141.119 103.906 1.00 0.00 H ATOM 88739 H2 WAT 4765 38.704 142.088 102.925 1.00 0.00 H TER 88741 WAT 4765 ATOM 88741 O WAT 4766 65.665 140.480 96.099 1.00 0.00 O ATOM 88742 H1 WAT 4766 65.391 139.663 96.516 1.00 0.00 H ATOM 88743 H2 WAT 4766 65.723 140.266 95.168 1.00 0.00 H TER 88745 WAT 4766 ATOM 88745 O WAT 4767 54.237 11.929 9.070 1.00 0.00 O ATOM 88746 H1 WAT 4767 53.558 12.554 8.813 1.00 0.00 H ATOM 88747 H2 WAT 4767 54.376 12.097 10.002 1.00 0.00 H TER 88749 WAT 4767 ATOM 88749 O WAT 4768 73.439 49.953 154.865 1.00 0.00 O ATOM 88750 H1 WAT 4768 74.347 50.084 155.137 1.00 0.00 H ATOM 88751 H2 WAT 4768 73.020 49.537 155.618 1.00 0.00 H TER 88753 WAT 4768 ATOM 88753 O WAT 4769 134.082 49.471 124.651 1.00 0.00 O ATOM 88754 H1 WAT 4769 134.696 49.504 123.918 1.00 0.00 H ATOM 88755 H2 WAT 4769 134.338 48.691 125.143 1.00 0.00 H TER 88757 WAT 4769 ATOM 88757 O WAT 4770 131.170 103.625 74.894 1.00 0.00 O ATOM 88758 H1 WAT 4770 131.949 103.951 74.444 1.00 0.00 H ATOM 88759 H2 WAT 4770 130.646 104.407 75.065 1.00 0.00 H TER 88761 WAT 4770 ATOM 88761 O WAT 4771 2.971 33.009 158.042 1.00 0.00 O ATOM 88762 H1 WAT 4771 3.734 32.625 158.474 1.00 0.00 H ATOM 88763 H2 WAT 4771 3.118 32.848 157.110 1.00 0.00 H TER 88765 WAT 4771 ATOM 88765 O WAT 4772 88.737 46.397 104.395 1.00 0.00 O ATOM 88766 H1 WAT 4772 89.261 47.111 104.032 1.00 0.00 H ATOM 88767 H2 WAT 4772 89.379 45.733 104.648 1.00 0.00 H TER 88769 WAT 4772 ATOM 88769 O WAT 4773 111.612 55.679 134.233 1.00 0.00 O ATOM 88770 H1 WAT 4773 111.571 56.635 134.246 1.00 0.00 H ATOM 88771 H2 WAT 4773 110.705 55.399 134.360 1.00 0.00 H TER 88773 WAT 4773 ATOM 88773 O WAT 4774 76.414 8.689 66.151 1.00 0.00 O ATOM 88774 H1 WAT 4774 76.375 8.327 65.266 1.00 0.00 H ATOM 88775 H2 WAT 4774 77.142 8.226 66.567 1.00 0.00 H TER 88777 WAT 4774 ATOM 88777 O WAT 4775 30.157 71.313 68.598 1.00 0.00 O ATOM 88778 H1 WAT 4775 30.598 72.116 68.874 1.00 0.00 H ATOM 88779 H2 WAT 4775 30.708 70.965 67.898 1.00 0.00 H TER 88781 WAT 4775 ATOM 88781 O WAT 4776 85.838 113.470 89.984 1.00 0.00 O ATOM 88782 H1 WAT 4776 85.967 113.783 89.089 1.00 0.00 H ATOM 88783 H2 WAT 4776 84.892 113.347 90.061 1.00 0.00 H TER 88785 WAT 4776 ATOM 88785 O WAT 4777 89.497 73.725 5.109 1.00 0.00 O ATOM 88786 H1 WAT 4777 88.979 73.098 5.614 1.00 0.00 H ATOM 88787 H2 WAT 4777 90.380 73.653 5.472 1.00 0.00 H TER 88789 WAT 4777 ATOM 88789 O WAT 4778 16.386 108.894 145.775 1.00 0.00 O ATOM 88790 H1 WAT 4778 16.216 108.055 145.348 1.00 0.00 H ATOM 88791 H2 WAT 4778 15.680 109.465 145.470 1.00 0.00 H TER 88793 WAT 4778 ATOM 88793 O WAT 4779 90.874 116.545 155.756 1.00 0.00 O ATOM 88794 H1 WAT 4779 91.510 115.856 155.566 1.00 0.00 H ATOM 88795 H2 WAT 4779 91.194 117.306 155.273 1.00 0.00 H TER 88797 WAT 4779 ATOM 88797 O WAT 4780 84.559 48.612 11.018 1.00 0.00 O ATOM 88798 H1 WAT 4780 84.915 48.357 11.869 1.00 0.00 H ATOM 88799 H2 WAT 4780 83.611 48.525 11.119 1.00 0.00 H TER 88801 WAT 4780 ATOM 88801 O WAT 4781 12.900 92.618 147.777 1.00 0.00 O ATOM 88802 H1 WAT 4781 12.908 93.426 148.289 1.00 0.00 H ATOM 88803 H2 WAT 4781 13.688 92.150 148.055 1.00 0.00 H TER 88805 WAT 4781 ATOM 88805 O WAT 4782 125.467 1.824 71.285 1.00 0.00 O ATOM 88806 H1 WAT 4782 125.303 1.415 72.135 1.00 0.00 H ATOM 88807 H2 WAT 4782 126.343 1.525 71.041 1.00 0.00 H TER 88809 WAT 4782 ATOM 88809 O WAT 4783 36.687 56.797 105.393 1.00 0.00 O ATOM 88810 H1 WAT 4783 35.920 56.364 105.018 1.00 0.00 H ATOM 88811 H2 WAT 4783 36.357 57.640 105.705 1.00 0.00 H TER 88813 WAT 4783 ATOM 88813 O WAT 4784 31.274 67.083 66.084 1.00 0.00 O ATOM 88814 H1 WAT 4784 32.187 66.999 65.808 1.00 0.00 H ATOM 88815 H2 WAT 4784 31.089 66.267 66.549 1.00 0.00 H TER 88817 WAT 4784 ATOM 88817 O WAT 4785 112.766 74.281 93.207 1.00 0.00 O ATOM 88818 H1 WAT 4785 112.427 74.967 92.632 1.00 0.00 H ATOM 88819 H2 WAT 4785 112.519 74.564 94.088 1.00 0.00 H TER 88821 WAT 4785 ATOM 88821 O WAT 4786 143.507 42.993 72.072 1.00 0.00 O ATOM 88822 H1 WAT 4786 144.318 43.500 72.108 1.00 0.00 H ATOM 88823 H2 WAT 4786 143.353 42.721 72.977 1.00 0.00 H TER 88825 WAT 4786 ATOM 88825 O WAT 4787 7.802 62.197 111.410 1.00 0.00 O ATOM 88826 H1 WAT 4787 8.186 63.074 111.406 1.00 0.00 H ATOM 88827 H2 WAT 4787 8.506 61.628 111.718 1.00 0.00 H TER 88829 WAT 4787 ATOM 88829 O WAT 4788 68.116 140.044 92.640 1.00 0.00 O ATOM 88830 H1 WAT 4788 68.898 139.543 92.872 1.00 0.00 H ATOM 88831 H2 WAT 4788 67.706 139.536 91.940 1.00 0.00 H TER 88833 WAT 4788 ATOM 88833 O WAT 4789 40.415 144.624 102.452 1.00 0.00 O ATOM 88834 H1 WAT 4789 39.601 145.053 102.715 1.00 0.00 H ATOM 88835 H2 WAT 4789 40.634 145.021 101.609 1.00 0.00 H TER 88837 WAT 4789 ATOM 88837 O WAT 4790 9.461 26.052 153.813 1.00 0.00 O ATOM 88838 H1 WAT 4790 8.935 26.661 154.331 1.00 0.00 H ATOM 88839 H2 WAT 4790 9.380 26.369 152.914 1.00 0.00 H TER 88841 WAT 4790 ATOM 88841 O WAT 4791 20.862 144.541 64.409 1.00 0.00 O ATOM 88842 H1 WAT 4791 20.307 145.007 65.034 1.00 0.00 H ATOM 88843 H2 WAT 4791 20.686 144.966 63.569 1.00 0.00 H TER 88845 WAT 4791 ATOM 88845 O WAT 4792 16.804 43.486 146.771 1.00 0.00 O ATOM 88846 H1 WAT 4792 17.363 44.248 146.925 1.00 0.00 H ATOM 88847 H2 WAT 4792 15.995 43.683 147.242 1.00 0.00 H TER 88849 WAT 4792 ATOM 88849 O WAT 4793 56.172 0.112 53.925 1.00 0.00 O ATOM 88850 H1 WAT 4793 56.437 0.988 53.647 1.00 0.00 H ATOM 88851 H2 WAT 4793 55.861 -0.310 53.124 1.00 0.00 H TER 88853 WAT 4793 ATOM 88853 O WAT 4794 133.064 111.439 121.776 1.00 0.00 O ATOM 88854 H1 WAT 4794 132.108 111.402 121.824 1.00 0.00 H ATOM 88855 H2 WAT 4794 133.293 112.261 122.210 1.00 0.00 H TER 88857 WAT 4794 ATOM 88857 O WAT 4795 29.061 71.547 75.079 1.00 0.00 O ATOM 88858 H1 WAT 4795 29.347 71.082 74.293 1.00 0.00 H ATOM 88859 H2 WAT 4795 28.895 70.855 75.720 1.00 0.00 H TER 88861 WAT 4795 ATOM 88861 O WAT 4796 15.983 143.334 84.534 1.00 0.00 O ATOM 88862 H1 WAT 4796 16.342 143.396 83.649 1.00 0.00 H ATOM 88863 H2 WAT 4796 16.747 143.200 85.094 1.00 0.00 H TER 88865 WAT 4796 ATOM 88865 O WAT 4797 40.695 98.621 154.974 1.00 0.00 O ATOM 88866 H1 WAT 4797 39.919 99.168 154.853 1.00 0.00 H ATOM 88867 H2 WAT 4797 41.387 99.237 155.214 1.00 0.00 H TER 88869 WAT 4797 ATOM 88869 O WAT 4798 80.769 110.301 6.860 1.00 0.00 O ATOM 88870 H1 WAT 4798 80.265 110.831 7.477 1.00 0.00 H ATOM 88871 H2 WAT 4798 80.423 110.541 6.000 1.00 0.00 H TER 88873 WAT 4798 ATOM 88873 O WAT 4799 85.623 22.796 132.110 1.00 0.00 O ATOM 88874 H1 WAT 4799 84.810 22.811 131.605 1.00 0.00 H ATOM 88875 H2 WAT 4799 85.457 22.168 132.813 1.00 0.00 H TER 88877 WAT 4799 ATOM 88877 O WAT 4800 36.071 15.510 18.547 1.00 0.00 O ATOM 88878 H1 WAT 4800 36.276 15.867 19.411 1.00 0.00 H ATOM 88879 H2 WAT 4800 35.435 16.124 18.178 1.00 0.00 H TER 88881 WAT 4800 ATOM 88881 O WAT 4801 84.677 25.133 70.508 1.00 0.00 O ATOM 88882 H1 WAT 4801 84.383 24.826 71.366 1.00 0.00 H ATOM 88883 H2 WAT 4801 85.263 25.864 70.703 1.00 0.00 H TER 88885 WAT 4801 ATOM 88885 O WAT 4802 81.887 1.987 93.534 1.00 0.00 O ATOM 88886 H1 WAT 4802 82.106 1.328 94.192 1.00 0.00 H ATOM 88887 H2 WAT 4802 82.150 1.593 92.703 1.00 0.00 H TER 88889 WAT 4802 ATOM 88889 O WAT 4803 68.326 18.724 73.086 1.00 0.00 O ATOM 88890 H1 WAT 4803 68.926 18.020 73.330 1.00 0.00 H ATOM 88891 H2 WAT 4803 67.737 18.325 72.445 1.00 0.00 H TER 88893 WAT 4803 ATOM 88893 O WAT 4804 91.567 73.932 145.542 1.00 0.00 O ATOM 88894 H1 WAT 4804 92.147 73.955 144.782 1.00 0.00 H ATOM 88895 H2 WAT 4804 91.657 74.798 145.939 1.00 0.00 H TER 88897 WAT 4804 ATOM 88897 O WAT 4805 138.186 96.074 135.620 1.00 0.00 O ATOM 88898 H1 WAT 4805 138.059 95.212 135.225 1.00 0.00 H ATOM 88899 H2 WAT 4805 139.066 96.039 135.994 1.00 0.00 H TER 88901 WAT 4805 ATOM 88901 O WAT 4806 72.834 112.428 141.397 1.00 0.00 O ATOM 88902 H1 WAT 4806 71.958 112.053 141.482 1.00 0.00 H ATOM 88903 H2 WAT 4806 72.727 113.346 141.647 1.00 0.00 H TER 88905 WAT 4806 ATOM 88905 O WAT 4807 75.415 33.798 132.455 1.00 0.00 O ATOM 88906 H1 WAT 4807 75.682 32.893 132.614 1.00 0.00 H ATOM 88907 H2 WAT 4807 76.184 34.209 132.060 1.00 0.00 H TER 88909 WAT 4807 ATOM 88909 O WAT 4808 66.335 28.463 130.894 1.00 0.00 O ATOM 88910 H1 WAT 4808 67.149 28.387 130.396 1.00 0.00 H ATOM 88911 H2 WAT 4808 65.682 28.727 130.246 1.00 0.00 H TER 88913 WAT 4808 ATOM 88913 O WAT 4809 43.344 106.975 113.674 1.00 0.00 O ATOM 88914 H1 WAT 4809 42.722 106.791 114.377 1.00 0.00 H ATOM 88915 H2 WAT 4809 44.204 106.852 114.076 1.00 0.00 H TER 88917 WAT 4809 ATOM 88917 O WAT 4810 0.186 34.031 78.992 1.00 0.00 O ATOM 88918 H1 WAT 4810 -0.072 34.299 79.874 1.00 0.00 H ATOM 88919 H2 WAT 4810 0.760 34.734 78.687 1.00 0.00 H TER 88921 WAT 4810 ATOM 88921 O WAT 4811 143.018 58.012 120.398 1.00 0.00 O ATOM 88922 H1 WAT 4811 143.938 58.275 120.352 1.00 0.00 H ATOM 88923 H2 WAT 4811 142.888 57.756 121.311 1.00 0.00 H TER 88925 WAT 4811 ATOM 88925 O WAT 4812 110.585 40.098 123.466 1.00 0.00 O ATOM 88926 H1 WAT 4812 111.474 40.009 123.810 1.00 0.00 H ATOM 88927 H2 WAT 4812 110.019 39.920 124.217 1.00 0.00 H TER 88929 WAT 4812 ATOM 88929 O WAT 4813 29.718 110.410 8.979 1.00 0.00 O ATOM 88930 H1 WAT 4813 30.241 110.015 9.677 1.00 0.00 H ATOM 88931 H2 WAT 4813 29.569 109.696 8.358 1.00 0.00 H TER 88933 WAT 4813 ATOM 88933 O WAT 4814 11.784 28.973 119.833 1.00 0.00 O ATOM 88934 H1 WAT 4814 11.327 28.583 119.087 1.00 0.00 H ATOM 88935 H2 WAT 4814 11.084 29.269 120.414 1.00 0.00 H TER 88937 WAT 4814 ATOM 88937 O WAT 4815 96.005 144.286 95.383 1.00 0.00 O ATOM 88938 H1 WAT 4815 95.229 144.180 95.932 1.00 0.00 H ATOM 88939 H2 WAT 4815 95.665 144.603 94.546 1.00 0.00 H TER 88941 WAT 4815 ATOM 88941 O WAT 4816 22.486 137.526 117.070 1.00 0.00 O ATOM 88942 H1 WAT 4816 22.420 136.575 117.162 1.00 0.00 H ATOM 88943 H2 WAT 4816 22.906 137.656 116.220 1.00 0.00 H TER 88945 WAT 4816 ATOM 88945 O WAT 4817 3.238 55.942 118.815 1.00 0.00 O ATOM 88946 H1 WAT 4817 3.182 55.329 118.083 1.00 0.00 H ATOM 88947 H2 WAT 4817 3.668 55.445 119.511 1.00 0.00 H TER 88949 WAT 4817 ATOM 88949 O WAT 4818 29.938 117.329 58.174 1.00 0.00 O ATOM 88950 H1 WAT 4818 29.985 117.384 57.220 1.00 0.00 H ATOM 88951 H2 WAT 4818 30.532 116.612 58.401 1.00 0.00 H TER 88953 WAT 4818 ATOM 88953 O WAT 4819 54.453 45.840 134.188 1.00 0.00 O ATOM 88954 H1 WAT 4819 54.042 45.726 135.045 1.00 0.00 H ATOM 88955 H2 WAT 4819 53.751 45.666 133.561 1.00 0.00 H TER 88957 WAT 4819 ATOM 88957 O WAT 4820 54.983 80.772 155.659 1.00 0.00 O ATOM 88958 H1 WAT 4820 54.053 80.554 155.723 1.00 0.00 H ATOM 88959 H2 WAT 4820 55.408 80.202 156.300 1.00 0.00 H TER 88961 WAT 4820 ATOM 88961 O WAT 4821 124.071 133.609 145.351 1.00 0.00 O ATOM 88962 H1 WAT 4821 124.461 132.775 145.610 1.00 0.00 H ATOM 88963 H2 WAT 4821 123.155 133.399 145.167 1.00 0.00 H TER 88965 WAT 4821 ATOM 88965 O WAT 4822 9.605 82.007 100.456 1.00 0.00 O ATOM 88966 H1 WAT 4822 9.160 82.553 99.809 1.00 0.00 H ATOM 88967 H2 WAT 4822 9.219 82.263 101.293 1.00 0.00 H TER 88969 WAT 4822 ATOM 88969 O WAT 4823 11.162 141.556 19.024 1.00 0.00 O ATOM 88970 H1 WAT 4823 10.404 140.972 19.028 1.00 0.00 H ATOM 88971 H2 WAT 4823 11.333 141.733 19.949 1.00 0.00 H TER 88973 WAT 4823 ATOM 88973 O WAT 4824 45.255 82.602 73.456 1.00 0.00 O ATOM 88974 H1 WAT 4824 44.713 82.216 72.767 1.00 0.00 H ATOM 88975 H2 WAT 4824 45.218 81.968 74.172 1.00 0.00 H TER 88977 WAT 4824 ATOM 88977 O WAT 4825 139.964 25.269 150.353 1.00 0.00 O ATOM 88978 H1 WAT 4825 139.710 26.190 150.301 1.00 0.00 H ATOM 88979 H2 WAT 4825 140.723 25.262 150.937 1.00 0.00 H TER 88981 WAT 4825 ATOM 88981 O WAT 4826 114.100 134.066 9.789 1.00 0.00 O ATOM 88982 H1 WAT 4826 114.813 134.075 9.150 1.00 0.00 H ATOM 88983 H2 WAT 4826 113.309 133.946 9.263 1.00 0.00 H TER 88985 WAT 4826 ATOM 88985 O WAT 4827 58.455 137.348 110.135 1.00 0.00 O ATOM 88986 H1 WAT 4827 59.067 137.848 110.674 1.00 0.00 H ATOM 88987 H2 WAT 4827 58.352 137.872 109.340 1.00 0.00 H TER 88989 WAT 4827 ATOM 88989 O WAT 4828 48.269 94.956 8.062 1.00 0.00 O ATOM 88990 H1 WAT 4828 48.271 95.302 8.955 1.00 0.00 H ATOM 88991 H2 WAT 4828 47.756 95.590 7.561 1.00 0.00 H TER 88993 WAT 4828 ATOM 88993 O WAT 4829 53.366 28.196 73.565 1.00 0.00 O ATOM 88994 H1 WAT 4829 52.552 27.707 73.690 1.00 0.00 H ATOM 88995 H2 WAT 4829 53.783 27.778 72.811 1.00 0.00 H TER 88997 WAT 4829 ATOM 88997 O WAT 4830 89.916 137.452 5.365 1.00 0.00 O ATOM 88998 H1 WAT 4830 89.576 136.963 6.115 1.00 0.00 H ATOM 88999 H2 WAT 4830 90.015 136.796 4.676 1.00 0.00 H TER 89001 WAT 4830 ATOM 89001 O WAT 4831 29.986 15.342 89.050 1.00 0.00 O ATOM 89002 H1 WAT 4831 29.604 16.144 89.406 1.00 0.00 H ATOM 89003 H2 WAT 4831 30.574 15.644 88.357 1.00 0.00 H TER 89005 WAT 4831 ATOM 89005 O WAT 4832 40.820 53.505 116.263 1.00 0.00 O ATOM 89006 H1 WAT 4832 40.958 52.949 117.030 1.00 0.00 H ATOM 89007 H2 WAT 4832 40.314 52.960 115.660 1.00 0.00 H TER 89009 WAT 4832 ATOM 89009 O WAT 4833 115.346 105.672 66.893 1.00 0.00 O ATOM 89010 H1 WAT 4833 116.035 105.857 66.254 1.00 0.00 H ATOM 89011 H2 WAT 4833 114.915 106.516 67.031 1.00 0.00 H TER 89013 WAT 4833 ATOM 89013 O WAT 4834 128.672 75.105 17.972 1.00 0.00 O ATOM 89014 H1 WAT 4834 128.905 75.994 17.704 1.00 0.00 H ATOM 89015 H2 WAT 4834 129.085 74.541 17.318 1.00 0.00 H TER 89017 WAT 4834 ATOM 89017 O WAT 4835 33.611 31.097 122.937 1.00 0.00 O ATOM 89018 H1 WAT 4835 34.159 30.486 123.430 1.00 0.00 H ATOM 89019 H2 WAT 4835 33.159 31.608 123.609 1.00 0.00 H TER 89021 WAT 4835 ATOM 89021 O WAT 4836 125.630 75.710 76.272 1.00 0.00 O ATOM 89022 H1 WAT 4836 125.374 74.799 76.414 1.00 0.00 H ATOM 89023 H2 WAT 4836 125.009 76.035 75.620 1.00 0.00 H TER 89025 WAT 4836 ATOM 89025 O WAT 4837 79.066 80.427 64.500 1.00 0.00 O ATOM 89026 H1 WAT 4837 79.713 81.116 64.650 1.00 0.00 H ATOM 89027 H2 WAT 4837 79.229 80.137 63.602 1.00 0.00 H TER 89029 WAT 4837 ATOM 89029 O WAT 4838 136.944 84.865 135.826 1.00 0.00 O ATOM 89030 H1 WAT 4838 137.708 84.292 135.885 1.00 0.00 H ATOM 89031 H2 WAT 4838 136.566 84.673 134.968 1.00 0.00 H TER 89033 WAT 4838 ATOM 89033 O WAT 4839 83.178 8.222 56.794 1.00 0.00 O ATOM 89034 H1 WAT 4839 82.517 7.708 56.331 1.00 0.00 H ATOM 89035 H2 WAT 4839 83.237 7.815 57.658 1.00 0.00 H TER 89037 WAT 4839 ATOM 89037 O WAT 4840 6.900 6.710 154.905 1.00 0.00 O ATOM 89038 H1 WAT 4840 7.311 6.872 155.754 1.00 0.00 H ATOM 89039 H2 WAT 4840 6.075 7.194 154.943 1.00 0.00 H TER 89041 WAT 4840 ATOM 89041 O WAT 4841 77.930 3.563 97.681 1.00 0.00 O ATOM 89042 H1 WAT 4841 77.175 3.117 97.298 1.00 0.00 H ATOM 89043 H2 WAT 4841 78.664 3.317 97.118 1.00 0.00 H TER 89045 WAT 4841 ATOM 89045 O WAT 4842 62.012 106.663 61.054 1.00 0.00 O ATOM 89046 H1 WAT 4842 61.494 106.875 60.277 1.00 0.00 H ATOM 89047 H2 WAT 4842 62.916 106.644 60.741 1.00 0.00 H TER 89049 WAT 4842 ATOM 89049 O WAT 4843 47.991 74.330 16.937 1.00 0.00 O ATOM 89050 H1 WAT 4843 47.584 74.520 17.782 1.00 0.00 H ATOM 89051 H2 WAT 4843 48.105 73.379 16.934 1.00 0.00 H TER 89053 WAT 4843 ATOM 89053 O WAT 4844 35.190 21.916 16.462 1.00 0.00 O ATOM 89054 H1 WAT 4844 35.083 22.071 15.524 1.00 0.00 H ATOM 89055 H2 WAT 4844 34.720 22.637 16.880 1.00 0.00 H TER 89057 WAT 4844 ATOM 89057 O WAT 4845 98.002 21.432 124.573 1.00 0.00 O ATOM 89058 H1 WAT 4845 97.225 21.173 125.068 1.00 0.00 H ATOM 89059 H2 WAT 4845 98.362 22.172 125.062 1.00 0.00 H TER 89061 WAT 4845 ATOM 89061 O WAT 4846 49.558 1.645 121.998 1.00 0.00 O ATOM 89062 H1 WAT 4846 50.130 2.265 121.545 1.00 0.00 H ATOM 89063 H2 WAT 4846 50.156 1.081 122.488 1.00 0.00 H TER 89065 WAT 4846 ATOM 89065 O WAT 4847 11.962 99.385 105.965 1.00 0.00 O ATOM 89066 H1 WAT 4847 11.714 99.477 106.885 1.00 0.00 H ATOM 89067 H2 WAT 4847 11.138 99.212 105.511 1.00 0.00 H TER 89069 WAT 4847 ATOM 89069 O WAT 4848 16.170 108.234 121.762 1.00 0.00 O ATOM 89070 H1 WAT 4848 15.796 109.102 121.913 1.00 0.00 H ATOM 89071 H2 WAT 4848 16.340 107.891 122.640 1.00 0.00 H TER 89073 WAT 4848 ATOM 89073 O WAT 4849 47.625 98.924 67.439 1.00 0.00 O ATOM 89074 H1 WAT 4849 47.299 99.454 66.712 1.00 0.00 H ATOM 89075 H2 WAT 4849 47.488 98.020 67.157 1.00 0.00 H TER 89077 WAT 4849 ATOM 89077 O WAT 4850 52.165 75.721 6.255 1.00 0.00 O ATOM 89078 H1 WAT 4850 51.743 74.942 6.618 1.00 0.00 H ATOM 89079 H2 WAT 4850 51.634 75.946 5.490 1.00 0.00 H TER 89081 WAT 4850 ATOM 89081 O WAT 4851 38.258 15.753 122.958 1.00 0.00 O ATOM 89082 H1 WAT 4851 39.214 15.741 122.995 1.00 0.00 H ATOM 89083 H2 WAT 4851 38.051 16.441 122.325 1.00 0.00 H TER 89085 WAT 4851 ATOM 89085 O WAT 4852 46.814 36.594 72.584 1.00 0.00 O ATOM 89086 H1 WAT 4852 47.504 37.240 72.737 1.00 0.00 H ATOM 89087 H2 WAT 4852 46.983 35.906 73.227 1.00 0.00 H TER 89089 WAT 4852 ATOM 89089 O WAT 4853 107.549 74.584 137.623 1.00 0.00 O ATOM 89090 H1 WAT 4853 107.279 73.695 137.394 1.00 0.00 H ATOM 89091 H2 WAT 4853 108.398 74.474 138.050 1.00 0.00 H TER 89093 WAT 4853 ATOM 89093 O WAT 4854 7.045 49.872 59.820 1.00 0.00 O ATOM 89094 H1 WAT 4854 7.573 49.676 59.046 1.00 0.00 H ATOM 89095 H2 WAT 4854 7.478 50.627 60.220 1.00 0.00 H TER 89097 WAT 4854 ATOM 89097 O WAT 4855 29.979 140.325 148.929 1.00 0.00 O ATOM 89098 H1 WAT 4855 29.431 141.088 149.112 1.00 0.00 H ATOM 89099 H2 WAT 4855 29.573 139.915 148.165 1.00 0.00 H TER 89101 WAT 4855 ATOM 89101 O WAT 4856 73.403 113.708 58.918 1.00 0.00 O ATOM 89102 H1 WAT 4856 74.280 113.351 59.056 1.00 0.00 H ATOM 89103 H2 WAT 4856 72.818 112.961 59.040 1.00 0.00 H TER 89105 WAT 4856 ATOM 89105 O WAT 4857 112.905 60.891 82.603 1.00 0.00 O ATOM 89106 H1 WAT 4857 113.484 60.421 83.202 1.00 0.00 H ATOM 89107 H2 WAT 4857 113.490 61.456 82.097 1.00 0.00 H TER 89109 WAT 4857 ATOM 89109 O WAT 4858 73.986 28.664 86.211 1.00 0.00 O ATOM 89110 H1 WAT 4858 74.330 27.819 86.500 1.00 0.00 H ATOM 89111 H2 WAT 4858 74.347 28.781 85.332 1.00 0.00 H TER 89113 WAT 4858 ATOM 89113 O WAT 4859 66.363 23.717 157.552 1.00 0.00 O ATOM 89114 H1 WAT 4859 66.130 24.139 156.725 1.00 0.00 H ATOM 89115 H2 WAT 4859 65.952 22.854 157.504 1.00 0.00 H TER 89117 WAT 4859 ATOM 89117 O WAT 4860 98.181 120.302 11.503 1.00 0.00 O ATOM 89118 H1 WAT 4860 97.646 119.558 11.779 1.00 0.00 H ATOM 89119 H2 WAT 4860 99.036 120.143 11.902 1.00 0.00 H TER 89121 WAT 4860 ATOM 89121 O WAT 4861 1.604 34.004 128.345 1.00 0.00 O ATOM 89122 H1 WAT 4861 1.013 34.260 129.054 1.00 0.00 H ATOM 89123 H2 WAT 4861 1.225 34.404 127.563 1.00 0.00 H TER 89125 WAT 4861 ATOM 89125 O WAT 4862 1.479 103.213 144.225 1.00 0.00 O ATOM 89126 H1 WAT 4862 1.299 103.960 144.795 1.00 0.00 H ATOM 89127 H2 WAT 4862 1.338 103.549 143.339 1.00 0.00 H TER 89129 WAT 4862 ATOM 89129 O WAT 4863 9.044 58.753 57.400 1.00 0.00 O ATOM 89130 H1 WAT 4863 9.321 58.510 56.516 1.00 0.00 H ATOM 89131 H2 WAT 4863 9.571 58.200 57.977 1.00 0.00 H TER 89133 WAT 4863 ATOM 89133 O WAT 4864 127.988 127.459 144.042 1.00 0.00 O ATOM 89134 H1 WAT 4864 127.226 127.464 143.462 1.00 0.00 H ATOM 89135 H2 WAT 4864 128.128 128.380 144.261 1.00 0.00 H TER 89137 WAT 4864 ATOM 89137 O WAT 4865 46.824 9.072 133.672 1.00 0.00 O ATOM 89138 H1 WAT 4865 46.659 9.492 134.516 1.00 0.00 H ATOM 89139 H2 WAT 4865 47.361 8.309 133.885 1.00 0.00 H TER 89141 WAT 4865 ATOM 89141 O WAT 4866 127.313 57.303 21.587 1.00 0.00 O ATOM 89142 H1 WAT 4866 126.825 56.656 22.096 1.00 0.00 H ATOM 89143 H2 WAT 4866 126.894 57.296 20.726 1.00 0.00 H TER 89145 WAT 4866 ATOM 89145 O WAT 4867 106.372 106.427 133.978 1.00 0.00 O ATOM 89146 H1 WAT 4867 105.672 107.079 133.943 1.00 0.00 H ATOM 89147 H2 WAT 4867 106.804 106.584 134.817 1.00 0.00 H TER 89149 WAT 4867 ATOM 89149 O WAT 4868 129.270 5.047 102.560 1.00 0.00 O ATOM 89150 H1 WAT 4868 129.912 5.188 103.255 1.00 0.00 H ATOM 89151 H2 WAT 4868 129.496 4.192 102.194 1.00 0.00 H TER 89153 WAT 4868 ATOM 89153 O WAT 4869 113.097 7.689 21.562 1.00 0.00 O ATOM 89154 H1 WAT 4869 113.607 8.327 22.061 1.00 0.00 H ATOM 89155 H2 WAT 4869 112.910 6.989 22.189 1.00 0.00 H TER 89157 WAT 4869 ATOM 89157 O WAT 4870 81.843 52.754 86.152 1.00 0.00 O ATOM 89158 H1 WAT 4870 82.291 52.684 86.995 1.00 0.00 H ATOM 89159 H2 WAT 4870 81.038 52.249 86.266 1.00 0.00 H TER 89161 WAT 4870 ATOM 89161 O WAT 4871 31.776 55.842 120.093 1.00 0.00 O ATOM 89162 H1 WAT 4871 32.724 55.713 120.069 1.00 0.00 H ATOM 89163 H2 WAT 4871 31.618 56.569 119.492 1.00 0.00 H TER 89165 WAT 4871 ATOM 89165 O WAT 4872 64.316 64.487 65.412 1.00 0.00 O ATOM 89166 H1 WAT 4872 64.159 65.026 64.637 1.00 0.00 H ATOM 89167 H2 WAT 4872 63.597 64.706 66.006 1.00 0.00 H TER 89169 WAT 4872 ATOM 89169 O WAT 4873 34.256 35.516 2.961 1.00 0.00 O ATOM 89170 H1 WAT 4873 33.439 35.100 2.686 1.00 0.00 H ATOM 89171 H2 WAT 4873 34.082 35.820 3.852 1.00 0.00 H TER 89173 WAT 4873 ATOM 89173 O WAT 4874 47.316 62.202 4.535 1.00 0.00 O ATOM 89174 H1 WAT 4874 47.905 62.934 4.716 1.00 0.00 H ATOM 89175 H2 WAT 4874 47.898 61.477 4.308 1.00 0.00 H TER 89177 WAT 4874 ATOM 89177 O WAT 4875 24.483 92.383 70.869 1.00 0.00 O ATOM 89178 H1 WAT 4875 25.440 92.425 70.859 1.00 0.00 H ATOM 89179 H2 WAT 4875 24.279 91.740 71.549 1.00 0.00 H TER 89181 WAT 4875 ATOM 89181 O WAT 4876 2.475 77.387 157.233 1.00 0.00 O ATOM 89182 H1 WAT 4876 3.212 76.868 156.911 1.00 0.00 H ATOM 89183 H2 WAT 4876 1.862 77.412 156.498 1.00 0.00 H TER 89185 WAT 4876 ATOM 89185 O WAT 4877 17.889 16.431 140.720 1.00 0.00 O ATOM 89186 H1 WAT 4877 18.695 16.124 140.305 1.00 0.00 H ATOM 89187 H2 WAT 4877 17.501 17.027 140.080 1.00 0.00 H TER 89189 WAT 4877 ATOM 89189 O WAT 4878 143.479 114.702 92.075 1.00 0.00 O ATOM 89190 H1 WAT 4878 144.005 114.587 91.284 1.00 0.00 H ATOM 89191 H2 WAT 4878 142.596 114.438 91.816 1.00 0.00 H TER 89193 WAT 4878 ATOM 89193 O WAT 4879 99.175 0.211 20.913 1.00 0.00 O ATOM 89194 H1 WAT 4879 99.000 1.145 20.800 1.00 0.00 H ATOM 89195 H2 WAT 4879 98.621 -0.049 21.649 1.00 0.00 H TER 89197 WAT 4879 ATOM 89197 O WAT 4880 141.032 44.639 88.974 1.00 0.00 O ATOM 89198 H1 WAT 4880 141.445 45.436 88.642 1.00 0.00 H ATOM 89199 H2 WAT 4880 141.765 44.071 89.212 1.00 0.00 H TER 89201 WAT 4880 ATOM 89201 O WAT 4881 29.401 34.627 9.164 1.00 0.00 O ATOM 89202 H1 WAT 4881 29.779 35.498 9.044 1.00 0.00 H ATOM 89203 H2 WAT 4881 28.736 34.746 9.842 1.00 0.00 H TER 89205 WAT 4881 ATOM 89205 O WAT 4882 43.752 118.156 92.100 1.00 0.00 O ATOM 89206 H1 WAT 4882 44.044 117.245 92.085 1.00 0.00 H ATOM 89207 H2 WAT 4882 43.905 118.441 93.001 1.00 0.00 H TER 89209 WAT 4882 ATOM 89209 O WAT 4883 18.260 33.532 98.185 1.00 0.00 O ATOM 89210 H1 WAT 4883 18.835 34.248 97.916 1.00 0.00 H ATOM 89211 H2 WAT 4883 17.888 33.203 97.366 1.00 0.00 H TER 89213 WAT 4883 ATOM 89213 O WAT 4884 99.430 40.203 91.493 1.00 0.00 O ATOM 89214 H1 WAT 4884 99.008 39.567 90.916 1.00 0.00 H ATOM 89215 H2 WAT 4884 99.521 39.744 92.329 1.00 0.00 H TER 89217 WAT 4884 ATOM 89217 O WAT 4885 45.091 6.262 121.750 1.00 0.00 O ATOM 89218 H1 WAT 4885 45.212 5.531 121.144 1.00 0.00 H ATOM 89219 H2 WAT 4885 44.603 5.887 122.483 1.00 0.00 H TER 89221 WAT 4885 ATOM 89221 O WAT 4886 119.485 12.625 61.093 1.00 0.00 O ATOM 89222 H1 WAT 4886 118.873 12.536 61.824 1.00 0.00 H ATOM 89223 H2 WAT 4886 119.167 12.004 60.437 1.00 0.00 H TER 89225 WAT 4886 ATOM 89225 O WAT 4887 123.744 43.235 87.060 1.00 0.00 O ATOM 89226 H1 WAT 4887 124.387 43.863 87.391 1.00 0.00 H ATOM 89227 H2 WAT 4887 124.271 42.522 86.699 1.00 0.00 H TER 89229 WAT 4887 ATOM 89229 O WAT 4888 24.155 111.292 145.665 1.00 0.00 O ATOM 89230 H1 WAT 4888 23.958 112.226 145.599 1.00 0.00 H ATOM 89231 H2 WAT 4888 23.905 110.933 144.814 1.00 0.00 H TER 89233 WAT 4888 ATOM 89233 O WAT 4889 144.461 48.856 58.615 1.00 0.00 O ATOM 89234 H1 WAT 4889 144.124 49.446 57.941 1.00 0.00 H ATOM 89235 H2 WAT 4889 143.920 48.071 58.539 1.00 0.00 H TER 89237 WAT 4889 ATOM 89237 O WAT 4890 141.040 66.931 106.139 1.00 0.00 O ATOM 89238 H1 WAT 4890 141.914 67.279 105.963 1.00 0.00 H ATOM 89239 H2 WAT 4890 140.999 66.119 105.635 1.00 0.00 H TER 89241 WAT 4890 ATOM 89241 O WAT 4891 55.255 53.354 31.573 1.00 0.00 O ATOM 89242 H1 WAT 4891 55.193 53.106 30.651 1.00 0.00 H ATOM 89243 H2 WAT 4891 54.353 53.323 31.891 1.00 0.00 H TER 89245 WAT 4891 ATOM 89245 O WAT 4892 103.102 54.390 28.354 1.00 0.00 O ATOM 89246 H1 WAT 4892 102.617 55.136 28.705 1.00 0.00 H ATOM 89247 H2 WAT 4892 103.784 54.783 27.809 1.00 0.00 H TER 89249 WAT 4892 ATOM 89249 O WAT 4893 22.576 110.062 153.221 1.00 0.00 O ATOM 89250 H1 WAT 4893 23.098 110.541 153.865 1.00 0.00 H ATOM 89251 H2 WAT 4893 22.932 109.174 153.237 1.00 0.00 H TER 89253 WAT 4893 ATOM 89253 O WAT 4894 123.653 95.587 144.490 1.00 0.00 O ATOM 89254 H1 WAT 4894 123.289 94.786 144.865 1.00 0.00 H ATOM 89255 H2 WAT 4894 123.835 95.363 143.577 1.00 0.00 H TER 89257 WAT 4894 ATOM 89257 O WAT 4895 109.411 33.409 60.493 1.00 0.00 O ATOM 89258 H1 WAT 4895 109.431 32.489 60.229 1.00 0.00 H ATOM 89259 H2 WAT 4895 108.664 33.777 60.023 1.00 0.00 H TER 89261 WAT 4895 ATOM 89261 O WAT 4896 81.628 68.913 138.096 1.00 0.00 O ATOM 89262 H1 WAT 4896 82.253 69.136 137.406 1.00 0.00 H ATOM 89263 H2 WAT 4896 81.872 68.028 138.364 1.00 0.00 H TER 89265 WAT 4896 ATOM 89265 O WAT 4897 43.265 34.653 70.724 1.00 0.00 O ATOM 89266 H1 WAT 4897 42.811 35.058 71.463 1.00 0.00 H ATOM 89267 H2 WAT 4897 44.040 35.199 70.591 1.00 0.00 H TER 89269 WAT 4897 ATOM 89269 O WAT 4898 82.787 4.158 16.141 1.00 0.00 O ATOM 89270 H1 WAT 4898 82.125 4.186 15.450 1.00 0.00 H ATOM 89271 H2 WAT 4898 83.457 3.562 15.806 1.00 0.00 H TER 89273 WAT 4898 ATOM 89273 O WAT 4899 16.193 144.772 73.765 1.00 0.00 O ATOM 89274 H1 WAT 4899 16.584 143.939 74.031 1.00 0.00 H ATOM 89275 H2 WAT 4899 15.261 144.576 73.661 1.00 0.00 H TER 89277 WAT 4899 ATOM 89277 O WAT 4900 142.235 131.195 2.788 1.00 0.00 O ATOM 89278 H1 WAT 4900 142.081 131.878 3.441 1.00 0.00 H ATOM 89279 H2 WAT 4900 141.602 130.510 3.005 1.00 0.00 H TER 89281 WAT 4900 ATOM 89281 O WAT 4901 3.626 25.432 136.133 1.00 0.00 O ATOM 89282 H1 WAT 4901 2.882 25.147 136.665 1.00 0.00 H ATOM 89283 H2 WAT 4901 3.232 25.938 135.423 1.00 0.00 H TER 89285 WAT 4901 ATOM 89285 O WAT 4902 18.478 28.289 77.349 1.00 0.00 O ATOM 89286 H1 WAT 4902 18.020 27.594 76.877 1.00 0.00 H ATOM 89287 H2 WAT 4902 18.501 27.987 78.257 1.00 0.00 H TER 89289 WAT 4902 ATOM 89289 O WAT 4903 142.102 100.722 106.112 1.00 0.00 O ATOM 89290 H1 WAT 4903 141.673 101.487 105.730 1.00 0.00 H ATOM 89291 H2 WAT 4903 142.671 100.393 105.415 1.00 0.00 H TER 89293 WAT 4903 ATOM 89293 O WAT 4904 19.705 38.683 72.090 1.00 0.00 O ATOM 89294 H1 WAT 4904 18.784 38.848 72.289 1.00 0.00 H ATOM 89295 H2 WAT 4904 19.716 38.474 71.156 1.00 0.00 H TER 89297 WAT 4904 ATOM 89297 O WAT 4905 128.125 40.637 126.574 1.00 0.00 O ATOM 89298 H1 WAT 4905 128.063 40.936 125.667 1.00 0.00 H ATOM 89299 H2 WAT 4905 127.718 41.336 127.085 1.00 0.00 H TER 89301 WAT 4905 ATOM 89301 O WAT 4906 19.629 47.633 103.327 1.00 0.00 O ATOM 89302 H1 WAT 4906 20.301 47.301 103.923 1.00 0.00 H ATOM 89303 H2 WAT 4906 18.819 47.218 103.624 1.00 0.00 H TER 89305 WAT 4906 ATOM 89305 O WAT 4907 120.089 143.545 125.073 1.00 0.00 O ATOM 89306 H1 WAT 4907 120.409 144.419 125.300 1.00 0.00 H ATOM 89307 H2 WAT 4907 120.089 143.068 125.903 1.00 0.00 H TER 89309 WAT 4907 ATOM 89309 O WAT 4908 18.380 44.577 117.792 1.00 0.00 O ATOM 89310 H1 WAT 4908 18.945 44.869 117.077 1.00 0.00 H ATOM 89311 H2 WAT 4908 18.937 44.620 118.570 1.00 0.00 H TER 89313 WAT 4908 ATOM 89313 O WAT 4909 9.546 71.895 130.744 1.00 0.00 O ATOM 89314 H1 WAT 4909 9.243 71.796 131.647 1.00 0.00 H ATOM 89315 H2 WAT 4909 9.109 72.687 130.430 1.00 0.00 H TER 89317 WAT 4909 ATOM 89317 O WAT 4910 74.990 92.585 140.460 1.00 0.00 O ATOM 89318 H1 WAT 4910 75.372 91.800 140.853 1.00 0.00 H ATOM 89319 H2 WAT 4910 75.565 93.297 140.739 1.00 0.00 H TER 89321 WAT 4910 ATOM 89321 O WAT 4911 0.337 84.188 140.231 1.00 0.00 O ATOM 89322 H1 WAT 4911 -0.234 84.627 139.601 1.00 0.00 H ATOM 89323 H2 WAT 4911 1.167 84.660 140.172 1.00 0.00 H TER 89325 WAT 4911 ATOM 89325 O WAT 4912 35.558 68.915 108.449 1.00 0.00 O ATOM 89326 H1 WAT 4912 35.729 68.863 109.390 1.00 0.00 H ATOM 89327 H2 WAT 4912 35.417 68.007 108.182 1.00 0.00 H TER 89329 WAT 4912 ATOM 89329 O WAT 4913 103.722 10.897 75.564 1.00 0.00 O ATOM 89330 H1 WAT 4913 103.747 10.575 76.465 1.00 0.00 H ATOM 89331 H2 WAT 4913 102.805 10.808 75.304 1.00 0.00 H TER 89333 WAT 4913 ATOM 89333 O WAT 4914 96.438 72.389 75.242 1.00 0.00 O ATOM 89334 H1 WAT 4914 96.028 73.254 75.225 1.00 0.00 H ATOM 89335 H2 WAT 4914 97.340 72.557 75.512 1.00 0.00 H TER 89337 WAT 4914 ATOM 89337 O WAT 4915 139.652 36.640 65.027 1.00 0.00 O ATOM 89338 H1 WAT 4915 140.220 37.019 64.357 1.00 0.00 H ATOM 89339 H2 WAT 4915 138.876 36.349 64.548 1.00 0.00 H TER 89341 WAT 4915 ATOM 89341 O WAT 4916 98.192 54.740 153.989 1.00 0.00 O ATOM 89342 H1 WAT 4916 97.677 53.939 153.894 1.00 0.00 H ATOM 89343 H2 WAT 4916 97.987 55.054 154.870 1.00 0.00 H TER 89345 WAT 4916 ATOM 89345 O WAT 4917 2.398 110.536 67.893 1.00 0.00 O ATOM 89346 H1 WAT 4917 1.980 109.679 67.810 1.00 0.00 H ATOM 89347 H2 WAT 4917 3.278 110.409 67.539 1.00 0.00 H TER 89349 WAT 4917 ATOM 89349 O WAT 4918 101.903 135.372 105.199 1.00 0.00 O ATOM 89350 H1 WAT 4918 101.327 136.056 105.540 1.00 0.00 H ATOM 89351 H2 WAT 4918 102.617 135.848 104.776 1.00 0.00 H TER 89353 WAT 4918 ATOM 89353 O WAT 4919 10.608 19.707 90.356 1.00 0.00 O ATOM 89354 H1 WAT 4919 11.253 19.346 89.748 1.00 0.00 H ATOM 89355 H2 WAT 4919 9.766 19.388 90.029 1.00 0.00 H TER 89357 WAT 4919 ATOM 89357 O WAT 4920 17.780 89.873 102.734 1.00 0.00 O ATOM 89358 H1 WAT 4920 17.154 89.225 102.410 1.00 0.00 H ATOM 89359 H2 WAT 4920 17.367 90.717 102.552 1.00 0.00 H TER 89361 WAT 4920 ATOM 89361 O WAT 4921 65.009 38.200 133.725 1.00 0.00 O ATOM 89362 H1 WAT 4921 64.185 38.181 133.238 1.00 0.00 H ATOM 89363 H2 WAT 4921 65.665 38.451 133.075 1.00 0.00 H TER 89365 WAT 4921 ATOM 89365 O WAT 4922 108.174 89.928 74.553 1.00 0.00 O ATOM 89366 H1 WAT 4922 108.339 89.855 73.612 1.00 0.00 H ATOM 89367 H2 WAT 4922 107.416 89.366 74.708 1.00 0.00 H TER 89369 WAT 4922 ATOM 89369 O WAT 4923 87.003 0.802 93.797 1.00 0.00 O ATOM 89370 H1 WAT 4923 87.616 1.209 93.184 1.00 0.00 H ATOM 89371 H2 WAT 4923 86.234 0.596 93.265 1.00 0.00 H TER 89373 WAT 4923 ATOM 89373 O WAT 4924 114.707 56.372 89.780 1.00 0.00 O ATOM 89374 H1 WAT 4924 114.451 56.053 90.645 1.00 0.00 H ATOM 89375 H2 WAT 4924 114.093 57.082 89.594 1.00 0.00 H TER 89377 WAT 4924 ATOM 89377 O WAT 4925 74.079 144.252 92.220 1.00 0.00 O ATOM 89378 H1 WAT 4925 73.826 144.886 91.549 1.00 0.00 H ATOM 89379 H2 WAT 4925 73.745 143.415 91.897 1.00 0.00 H TER 89381 WAT 4925 ATOM 89381 O WAT 4926 4.913 83.887 142.725 1.00 0.00 O ATOM 89382 H1 WAT 4926 5.604 83.473 143.241 1.00 0.00 H ATOM 89383 H2 WAT 4926 4.615 83.201 142.128 1.00 0.00 H TER 89385 WAT 4926 ATOM 89385 O WAT 4927 35.955 8.939 127.247 1.00 0.00 O ATOM 89386 H1 WAT 4927 35.773 8.265 126.593 1.00 0.00 H ATOM 89387 H2 WAT 4927 36.625 8.551 127.810 1.00 0.00 H TER 89389 WAT 4927 ATOM 89389 O WAT 4928 137.706 110.310 80.159 1.00 0.00 O ATOM 89390 H1 WAT 4928 136.825 110.434 79.807 1.00 0.00 H ATOM 89391 H2 WAT 4928 137.565 110.000 81.054 1.00 0.00 H TER 89393 WAT 4928 ATOM 89393 O WAT 4929 50.503 133.568 4.485 1.00 0.00 O ATOM 89394 H1 WAT 4929 50.546 133.715 3.541 1.00 0.00 H ATOM 89395 H2 WAT 4929 49.770 132.964 4.601 1.00 0.00 H TER 89397 WAT 4929 ATOM 89397 O WAT 4930 73.860 88.587 134.125 1.00 0.00 O ATOM 89398 H1 WAT 4930 73.323 87.818 134.319 1.00 0.00 H ATOM 89399 H2 WAT 4930 73.232 89.305 134.050 1.00 0.00 H TER 89401 WAT 4930 ATOM 89401 O WAT 4931 39.008 92.136 66.277 1.00 0.00 O ATOM 89402 H1 WAT 4931 38.437 92.035 65.515 1.00 0.00 H ATOM 89403 H2 WAT 4931 38.521 91.735 66.996 1.00 0.00 H TER 89405 WAT 4931 ATOM 89405 O WAT 4932 50.615 124.661 16.690 1.00 0.00 O ATOM 89406 H1 WAT 4932 51.555 124.707 16.866 1.00 0.00 H ATOM 89407 H2 WAT 4932 50.455 123.741 16.480 1.00 0.00 H TER 89409 WAT 4932 ATOM 89409 O WAT 4933 13.411 61.637 144.663 1.00 0.00 O ATOM 89410 H1 WAT 4933 12.824 61.699 143.909 1.00 0.00 H ATOM 89411 H2 WAT 4933 14.139 62.220 144.448 1.00 0.00 H TER 89413 WAT 4933 ATOM 89413 O WAT 4934 144.408 55.718 14.191 1.00 0.00 O ATOM 89414 H1 WAT 4934 145.004 55.149 13.704 1.00 0.00 H ATOM 89415 H2 WAT 4934 144.758 56.600 14.060 1.00 0.00 H TER 89417 WAT 4934 ATOM 89417 O WAT 4935 42.089 53.577 32.082 1.00 0.00 O ATOM 89418 H1 WAT 4935 42.621 54.369 32.163 1.00 0.00 H ATOM 89419 H2 WAT 4935 42.657 52.952 31.631 1.00 0.00 H TER 89421 WAT 4935 ATOM 89421 O WAT 4936 33.842 93.307 68.830 1.00 0.00 O ATOM 89422 H1 WAT 4936 33.855 93.619 67.926 1.00 0.00 H ATOM 89423 H2 WAT 4936 34.403 93.922 69.304 1.00 0.00 H TER 89425 WAT 4936 ATOM 89425 O WAT 4937 96.211 126.086 127.647 1.00 0.00 O ATOM 89426 H1 WAT 4937 96.972 126.206 127.079 1.00 0.00 H ATOM 89427 H2 WAT 4937 96.575 125.774 128.475 1.00 0.00 H TER 89429 WAT 4937 ATOM 89429 O WAT 4938 95.324 47.246 138.744 1.00 0.00 O ATOM 89430 H1 WAT 4938 95.018 47.675 137.945 1.00 0.00 H ATOM 89431 H2 WAT 4938 94.548 47.195 139.301 1.00 0.00 H TER 89433 WAT 4938 ATOM 89433 O WAT 4939 98.468 64.581 148.545 1.00 0.00 O ATOM 89434 H1 WAT 4939 99.192 64.709 147.932 1.00 0.00 H ATOM 89435 H2 WAT 4939 98.478 65.366 149.094 1.00 0.00 H TER 89437 WAT 4939 ATOM 89437 O WAT 4940 41.033 57.243 23.884 1.00 0.00 O ATOM 89438 H1 WAT 4940 41.349 57.146 24.782 1.00 0.00 H ATOM 89439 H2 WAT 4940 40.143 57.583 23.979 1.00 0.00 H TER 89441 WAT 4940 ATOM 89441 O WAT 4941 70.427 137.992 17.563 1.00 0.00 O ATOM 89442 H1 WAT 4941 71.343 138.165 17.345 1.00 0.00 H ATOM 89443 H2 WAT 4941 70.309 137.060 17.380 1.00 0.00 H TER 89445 WAT 4941 ATOM 89445 O WAT 4942 77.164 91.869 105.701 1.00 0.00 O ATOM 89446 H1 WAT 4942 77.356 92.050 104.781 1.00 0.00 H ATOM 89447 H2 WAT 4942 76.728 91.017 105.692 1.00 0.00 H TER 89449 WAT 4942 ATOM 89449 O WAT 4943 53.660 19.356 109.369 1.00 0.00 O ATOM 89450 H1 WAT 4943 54.600 19.521 109.440 1.00 0.00 H ATOM 89451 H2 WAT 4943 53.547 18.466 109.703 1.00 0.00 H TER 89453 WAT 4943 ATOM 89453 O WAT 4944 78.004 134.216 86.417 1.00 0.00 O ATOM 89454 H1 WAT 4944 78.654 134.533 85.791 1.00 0.00 H ATOM 89455 H2 WAT 4944 77.748 133.357 86.082 1.00 0.00 H TER 89457 WAT 4944 ATOM 89457 O WAT 4945 107.554 78.934 61.847 1.00 0.00 O ATOM 89458 H1 WAT 4945 108.474 79.161 61.713 1.00 0.00 H ATOM 89459 H2 WAT 4945 107.169 79.716 62.242 1.00 0.00 H TER 89461 WAT 4945 ATOM 89461 O WAT 4946 81.894 10.933 121.951 1.00 0.00 O ATOM 89462 H1 WAT 4946 82.240 11.193 121.098 1.00 0.00 H ATOM 89463 H2 WAT 4946 80.961 10.781 121.796 1.00 0.00 H TER 89465 WAT 4946 ATOM 89465 O WAT 4947 30.204 99.278 65.909 1.00 0.00 O ATOM 89466 H1 WAT 4947 30.912 99.724 65.444 1.00 0.00 H ATOM 89467 H2 WAT 4947 30.564 99.099 66.778 1.00 0.00 H TER 89469 WAT 4947 ATOM 89469 O WAT 4948 86.445 127.673 101.313 1.00 0.00 O ATOM 89470 H1 WAT 4948 86.545 128.613 101.464 1.00 0.00 H ATOM 89471 H2 WAT 4948 87.260 127.410 100.885 1.00 0.00 H TER 89473 WAT 4948 ATOM 89473 O WAT 4949 69.490 134.672 66.750 1.00 0.00 O ATOM 89474 H1 WAT 4949 70.140 134.655 66.047 1.00 0.00 H ATOM 89475 H2 WAT 4949 69.876 135.238 67.418 1.00 0.00 H TER 89477 WAT 4949 ATOM 89477 O WAT 4950 106.821 103.641 15.687 1.00 0.00 O ATOM 89478 H1 WAT 4950 107.528 103.699 16.330 1.00 0.00 H ATOM 89479 H2 WAT 4950 106.153 103.104 16.113 1.00 0.00 H TER 89481 WAT 4950 ATOM 89481 O WAT 4951 47.305 13.427 98.753 1.00 0.00 O ATOM 89482 H1 WAT 4951 47.056 14.271 98.376 1.00 0.00 H ATOM 89483 H2 WAT 4951 48.037 13.130 98.212 1.00 0.00 H TER 89485 WAT 4951 ATOM 89485 O WAT 4952 45.939 71.495 73.408 1.00 0.00 O ATOM 89486 H1 WAT 4952 46.758 71.600 72.924 1.00 0.00 H ATOM 89487 H2 WAT 4952 45.855 72.303 73.914 1.00 0.00 H TER 89489 WAT 4952 ATOM 89489 O WAT 4953 129.730 79.143 10.242 1.00 0.00 O ATOM 89490 H1 WAT 4953 128.833 79.245 9.925 1.00 0.00 H ATOM 89491 H2 WAT 4953 130.177 78.660 9.547 1.00 0.00 H TER 89493 WAT 4953 ATOM 89493 O WAT 4954 101.022 109.397 94.319 1.00 0.00 O ATOM 89494 H1 WAT 4954 100.069 109.327 94.268 1.00 0.00 H ATOM 89495 H2 WAT 4954 101.343 108.566 93.969 1.00 0.00 H TER 89497 WAT 4954 ATOM 89497 O WAT 4955 126.989 89.406 158.139 1.00 0.00 O ATOM 89498 H1 WAT 4955 126.855 88.647 158.706 1.00 0.00 H ATOM 89499 H2 WAT 4955 127.350 90.077 158.718 1.00 0.00 H TER 89501 WAT 4955 ATOM 89501 O WAT 4956 88.847 62.255 120.538 1.00 0.00 O ATOM 89502 H1 WAT 4956 88.762 61.842 119.678 1.00 0.00 H ATOM 89503 H2 WAT 4956 89.729 62.626 120.539 1.00 0.00 H TER 89505 WAT 4956 ATOM 89505 O WAT 4957 38.400 123.353 126.414 1.00 0.00 O ATOM 89506 H1 WAT 4957 38.645 124.137 126.906 1.00 0.00 H ATOM 89507 H2 WAT 4957 39.230 123.012 126.079 1.00 0.00 H TER 89509 WAT 4957 ATOM 89509 O WAT 4958 16.358 88.594 113.023 1.00 0.00 O ATOM 89510 H1 WAT 4958 15.772 88.135 112.421 1.00 0.00 H ATOM 89511 H2 WAT 4958 16.825 89.222 112.471 1.00 0.00 H TER 89513 WAT 4958 ATOM 89513 O WAT 4959 126.998 111.889 135.207 1.00 0.00 O ATOM 89514 H1 WAT 4959 126.305 111.275 134.962 1.00 0.00 H ATOM 89515 H2 WAT 4959 126.898 112.620 134.597 1.00 0.00 H TER 89517 WAT 4959 ATOM 89517 O WAT 4960 50.729 32.191 114.129 1.00 0.00 O ATOM 89518 H1 WAT 4960 50.717 32.248 113.173 1.00 0.00 H ATOM 89519 H2 WAT 4960 50.192 32.928 114.419 1.00 0.00 H TER 89521 WAT 4960 ATOM 89521 O WAT 4961 38.082 23.986 68.230 1.00 0.00 O ATOM 89522 H1 WAT 4961 38.223 23.699 67.328 1.00 0.00 H ATOM 89523 H2 WAT 4961 37.221 24.404 68.217 1.00 0.00 H TER 89525 WAT 4961 ATOM 89525 O WAT 4962 74.685 124.158 1.220 1.00 0.00 O ATOM 89526 H1 WAT 4962 74.452 123.314 1.608 1.00 0.00 H ATOM 89527 H2 WAT 4962 74.546 124.791 1.924 1.00 0.00 H TER 89529 WAT 4962 ATOM 89529 O WAT 4963 38.097 29.784 114.839 1.00 0.00 O ATOM 89530 H1 WAT 4963 38.230 30.480 115.483 1.00 0.00 H ATOM 89531 H2 WAT 4963 37.759 29.048 115.349 1.00 0.00 H TER 89533 WAT 4963 ATOM 89533 O WAT 4964 42.897 17.412 23.473 1.00 0.00 O ATOM 89534 H1 WAT 4964 42.538 17.167 24.326 1.00 0.00 H ATOM 89535 H2 WAT 4964 43.761 17.773 23.672 1.00 0.00 H TER 89537 WAT 4964 ATOM 89537 O WAT 4965 80.455 8.724 11.977 1.00 0.00 O ATOM 89538 H1 WAT 4965 80.338 8.006 12.599 1.00 0.00 H ATOM 89539 H2 WAT 4965 79.617 8.781 11.517 1.00 0.00 H TER 89541 WAT 4965 ATOM 89541 O WAT 4966 126.523 137.844 152.656 1.00 0.00 O ATOM 89542 H1 WAT 4966 126.562 138.741 152.324 1.00 0.00 H ATOM 89543 H2 WAT 4966 127.323 137.745 153.172 1.00 0.00 H TER 89545 WAT 4966 ATOM 89545 O WAT 4967 10.139 136.898 12.163 1.00 0.00 O ATOM 89546 H1 WAT 4967 10.838 136.691 11.543 1.00 0.00 H ATOM 89547 H2 WAT 4967 10.110 137.854 12.181 1.00 0.00 H TER 89549 WAT 4967 ATOM 89549 O WAT 4968 32.702 55.139 74.244 1.00 0.00 O ATOM 89550 H1 WAT 4968 32.778 54.753 75.116 1.00 0.00 H ATOM 89551 H2 WAT 4968 32.393 56.030 74.402 1.00 0.00 H TER 89553 WAT 4968 ATOM 89553 O WAT 4969 7.080 1.681 125.019 1.00 0.00 O ATOM 89554 H1 WAT 4969 6.829 2.537 124.673 1.00 0.00 H ATOM 89555 H2 WAT 4969 7.204 1.829 125.956 1.00 0.00 H TER 89557 WAT 4969 ATOM 89557 O WAT 4970 99.097 127.218 143.813 1.00 0.00 O ATOM 89558 H1 WAT 4970 98.793 127.684 143.035 1.00 0.00 H ATOM 89559 H2 WAT 4970 99.564 127.880 144.323 1.00 0.00 H TER 89561 WAT 4970 ATOM 89561 O WAT 4971 5.838 40.303 63.994 1.00 0.00 O ATOM 89562 H1 WAT 4971 6.349 40.880 63.426 1.00 0.00 H ATOM 89563 H2 WAT 4971 6.396 39.537 64.123 1.00 0.00 H TER 89565 WAT 4971 ATOM 89565 O WAT 4972 64.148 50.754 114.169 1.00 0.00 O ATOM 89566 H1 WAT 4972 63.821 50.212 114.888 1.00 0.00 H ATOM 89567 H2 WAT 4972 63.359 51.106 113.758 1.00 0.00 H TER 89569 WAT 4972 ATOM 89569 O WAT 4973 106.651 44.241 79.856 1.00 0.00 O ATOM 89570 H1 WAT 4973 106.104 44.695 80.496 1.00 0.00 H ATOM 89571 H2 WAT 4973 106.028 43.843 79.248 1.00 0.00 H TER 89573 WAT 4973 ATOM 89573 O WAT 4974 121.790 38.672 24.589 1.00 0.00 O ATOM 89574 H1 WAT 4974 122.535 39.272 24.554 1.00 0.00 H ATOM 89575 H2 WAT 4974 121.651 38.516 25.523 1.00 0.00 H TER 89577 WAT 4974 ATOM 89577 O WAT 4975 114.617 49.508 147.831 1.00 0.00 O ATOM 89578 H1 WAT 4975 113.849 49.925 147.440 1.00 0.00 H ATOM 89579 H2 WAT 4975 114.644 48.637 147.435 1.00 0.00 H TER 89581 WAT 4975 ATOM 89581 O WAT 4976 57.586 37.747 101.697 1.00 0.00 O ATOM 89582 H1 WAT 4976 58.178 37.314 102.312 1.00 0.00 H ATOM 89583 H2 WAT 4976 57.200 38.464 102.200 1.00 0.00 H TER 89585 WAT 4976 ATOM 89585 O WAT 4977 144.976 83.976 97.285 1.00 0.00 O ATOM 89586 H1 WAT 4977 144.194 84.077 97.828 1.00 0.00 H ATOM 89587 H2 WAT 4977 145.529 84.721 97.520 1.00 0.00 H TER 89589 WAT 4977 ATOM 89589 O WAT 4978 7.641 7.190 112.465 1.00 0.00 O ATOM 89590 H1 WAT 4978 7.663 6.614 113.229 1.00 0.00 H ATOM 89591 H2 WAT 4978 8.560 7.291 112.215 1.00 0.00 H TER 89593 WAT 4978 ATOM 89593 O WAT 4979 40.936 11.196 127.884 1.00 0.00 O ATOM 89594 H1 WAT 4979 41.035 10.577 127.162 1.00 0.00 H ATOM 89595 H2 WAT 4979 40.132 11.674 127.682 1.00 0.00 H TER 89597 WAT 4979 ATOM 89597 O WAT 4980 43.879 112.666 153.289 1.00 0.00 O ATOM 89598 H1 WAT 4980 44.717 113.094 153.113 1.00 0.00 H ATOM 89599 H2 WAT 4980 43.306 113.374 153.584 1.00 0.00 H TER 89601 WAT 4980 ATOM 89601 O WAT 4981 89.302 38.906 145.014 1.00 0.00 O ATOM 89602 H1 WAT 4981 89.576 39.783 145.282 1.00 0.00 H ATOM 89603 H2 WAT 4981 90.114 38.400 144.982 1.00 0.00 H TER 89605 WAT 4981 ATOM 89605 O WAT 4982 41.916 131.766 83.286 1.00 0.00 O ATOM 89606 H1 WAT 4982 41.018 131.772 82.954 1.00 0.00 H ATOM 89607 H2 WAT 4982 42.005 132.597 83.752 1.00 0.00 H TER 89609 WAT 4982 ATOM 89609 O WAT 4983 89.165 123.450 76.512 1.00 0.00 O ATOM 89610 H1 WAT 4983 90.111 123.307 76.529 1.00 0.00 H ATOM 89611 H2 WAT 4983 88.798 122.598 76.278 1.00 0.00 H TER 89613 WAT 4983 ATOM 89613 O WAT 4984 82.306 28.058 89.627 1.00 0.00 O ATOM 89614 H1 WAT 4984 82.790 28.507 90.321 1.00 0.00 H ATOM 89615 H2 WAT 4984 81.584 28.650 89.417 1.00 0.00 H TER 89617 WAT 4984 ATOM 89617 O WAT 4985 80.038 0.538 73.494 1.00 0.00 O ATOM 89618 H1 WAT 4985 79.976 0.846 74.398 1.00 0.00 H ATOM 89619 H2 WAT 4985 79.655 1.244 72.973 1.00 0.00 H TER 89621 WAT 4985 ATOM 89621 O WAT 4986 129.066 127.754 20.245 1.00 0.00 O ATOM 89622 H1 WAT 4986 129.208 128.698 20.307 1.00 0.00 H ATOM 89623 H2 WAT 4986 129.492 127.396 21.024 1.00 0.00 H TER 89625 WAT 4986 ATOM 89625 O WAT 4987 110.307 135.452 156.245 1.00 0.00 O ATOM 89626 H1 WAT 4987 110.439 134.640 155.755 1.00 0.00 H ATOM 89627 H2 WAT 4987 111.186 135.816 156.347 1.00 0.00 H TER 89629 WAT 4987 ATOM 89629 O WAT 4988 40.674 71.634 142.855 1.00 0.00 O ATOM 89630 H1 WAT 4988 40.931 72.469 142.463 1.00 0.00 H ATOM 89631 H2 WAT 4988 40.613 71.030 142.114 1.00 0.00 H TER 89633 WAT 4988 ATOM 89633 O WAT 4989 14.349 2.036 68.467 1.00 0.00 O ATOM 89634 H1 WAT 4989 13.618 2.379 67.953 1.00 0.00 H ATOM 89635 H2 WAT 4989 14.134 1.113 68.601 1.00 0.00 H TER 89637 WAT 4989 ATOM 89637 O WAT 4990 91.355 137.619 152.734 1.00 0.00 O ATOM 89638 H1 WAT 4990 91.595 138.545 152.768 1.00 0.00 H ATOM 89639 H2 WAT 4990 91.017 137.426 153.608 1.00 0.00 H TER 89641 WAT 4990 ATOM 89641 O WAT 4991 105.676 143.031 74.863 1.00 0.00 O ATOM 89642 H1 WAT 4991 104.973 143.021 74.213 1.00 0.00 H ATOM 89643 H2 WAT 4991 106.147 143.847 74.692 1.00 0.00 H TER 89645 WAT 4991 ATOM 89645 O WAT 4992 1.360 103.903 9.716 1.00 0.00 O ATOM 89646 H1 WAT 4992 1.850 103.723 10.519 1.00 0.00 H ATOM 89647 H2 WAT 4992 1.499 103.127 9.172 1.00 0.00 H TER 89649 WAT 4992 ATOM 89649 O WAT 4993 103.446 121.073 6.072 1.00 0.00 O ATOM 89650 H1 WAT 4993 103.991 120.787 6.805 1.00 0.00 H ATOM 89651 H2 WAT 4993 103.013 121.866 6.390 1.00 0.00 H TER 89653 WAT 4993 ATOM 89653 O WAT 4994 110.199 6.934 16.599 1.00 0.00 O ATOM 89654 H1 WAT 4994 110.149 7.089 17.542 1.00 0.00 H ATOM 89655 H2 WAT 4994 111.032 6.480 16.475 1.00 0.00 H TER 89657 WAT 4994 ATOM 89657 O WAT 4995 76.403 133.008 102.555 1.00 0.00 O ATOM 89658 H1 WAT 4995 75.586 133.490 102.428 1.00 0.00 H ATOM 89659 H2 WAT 4995 76.697 132.797 101.669 1.00 0.00 H TER 89661 WAT 4995 ATOM 89661 O WAT 4996 55.150 5.825 143.974 1.00 0.00 O ATOM 89662 H1 WAT 4996 55.808 6.012 144.643 1.00 0.00 H ATOM 89663 H2 WAT 4996 55.255 6.527 143.332 1.00 0.00 H TER 89665 WAT 4996 ATOM 89665 O WAT 4997 105.447 68.314 155.794 1.00 0.00 O ATOM 89666 H1 WAT 4997 106.194 67.944 156.265 1.00 0.00 H ATOM 89667 H2 WAT 4997 105.799 69.091 155.359 1.00 0.00 H TER 89669 WAT 4997 ATOM 89669 O WAT 4998 49.737 83.406 21.450 1.00 0.00 O ATOM 89670 H1 WAT 4998 48.804 83.204 21.377 1.00 0.00 H ATOM 89671 H2 WAT 4998 49.944 83.249 22.371 1.00 0.00 H TER 89673 WAT 4998 ATOM 89673 O WAT 4999 21.834 121.526 74.910 1.00 0.00 O ATOM 89674 H1 WAT 4999 22.022 122.424 74.634 1.00 0.00 H ATOM 89675 H2 WAT 4999 22.425 120.986 74.386 1.00 0.00 H TER 89677 WAT 4999 ATOM 89677 O WAT 5000 6.947 6.068 82.705 1.00 0.00 O ATOM 89678 H1 WAT 5000 6.968 5.115 82.617 1.00 0.00 H ATOM 89679 H2 WAT 5000 7.219 6.394 81.848 1.00 0.00 H TER 89681 WAT 5000 ATOM 89681 O WAT 5001 110.294 70.446 70.768 1.00 0.00 O ATOM 89682 H1 WAT 5001 109.440 70.858 70.638 1.00 0.00 H ATOM 89683 H2 WAT 5001 110.213 69.589 70.348 1.00 0.00 H TER 89685 WAT 5001 ATOM 89685 O WAT 5002 88.212 51.101 124.374 1.00 0.00 O ATOM 89686 H1 WAT 5002 89.103 51.024 124.032 1.00 0.00 H ATOM 89687 H2 WAT 5002 87.750 50.345 124.012 1.00 0.00 H TER 89689 WAT 5002 ATOM 89689 O WAT 5003 19.271 26.314 92.914 1.00 0.00 O ATOM 89690 H1 WAT 5003 18.828 27.064 92.516 1.00 0.00 H ATOM 89691 H2 WAT 5003 18.950 26.297 93.816 1.00 0.00 H TER 89693 WAT 5003 ATOM 89693 O WAT 5004 67.262 29.167 155.277 1.00 0.00 O ATOM 89694 H1 WAT 5004 67.805 29.516 154.570 1.00 0.00 H ATOM 89695 H2 WAT 5004 66.455 28.889 154.844 1.00 0.00 H TER 89697 WAT 5004 ATOM 89697 O WAT 5005 113.495 41.653 117.830 1.00 0.00 O ATOM 89698 H1 WAT 5005 113.632 41.171 117.014 1.00 0.00 H ATOM 89699 H2 WAT 5005 113.445 42.570 117.560 1.00 0.00 H TER 89701 WAT 5005 ATOM 89701 O WAT 5006 6.786 71.639 116.979 1.00 0.00 O ATOM 89702 H1 WAT 5006 6.042 71.136 116.647 1.00 0.00 H ATOM 89703 H2 WAT 5006 6.539 71.868 117.875 1.00 0.00 H TER 89705 WAT 5006 ATOM 89705 O WAT 5007 28.358 3.455 90.055 1.00 0.00 O ATOM 89706 H1 WAT 5007 27.475 3.109 90.184 1.00 0.00 H ATOM 89707 H2 WAT 5007 28.468 4.099 90.754 1.00 0.00 H TER 89709 WAT 5007 ATOM 89709 O WAT 5008 81.173 77.559 22.095 1.00 0.00 O ATOM 89710 H1 WAT 5008 81.015 77.866 22.988 1.00 0.00 H ATOM 89711 H2 WAT 5008 82.097 77.310 22.087 1.00 0.00 H TER 89713 WAT 5008 ATOM 89713 O WAT 5009 119.817 117.375 127.499 1.00 0.00 O ATOM 89714 H1 WAT 5009 119.272 118.103 127.799 1.00 0.00 H ATOM 89715 H2 WAT 5009 120.000 116.871 128.292 1.00 0.00 H TER 89717 WAT 5009 ATOM 89717 O WAT 5010 65.199 115.204 154.449 1.00 0.00 O ATOM 89718 H1 WAT 5010 65.231 115.578 153.568 1.00 0.00 H ATOM 89719 H2 WAT 5010 65.868 115.684 154.937 1.00 0.00 H TER 89721 WAT 5010 ATOM 89721 O WAT 5011 94.112 87.060 63.482 1.00 0.00 O ATOM 89722 H1 WAT 5011 93.293 86.704 63.828 1.00 0.00 H ATOM 89723 H2 WAT 5011 94.182 87.929 63.878 1.00 0.00 H TER 89725 WAT 5011 ATOM 89725 O WAT 5012 84.538 120.152 129.552 1.00 0.00 O ATOM 89726 H1 WAT 5012 85.135 120.896 129.468 1.00 0.00 H ATOM 89727 H2 WAT 5012 85.110 119.384 129.548 1.00 0.00 H TER 89729 WAT 5012 ATOM 89729 O WAT 5013 110.731 28.885 9.748 1.00 0.00 O ATOM 89730 H1 WAT 5013 111.107 28.694 8.889 1.00 0.00 H ATOM 89731 H2 WAT 5013 111.421 28.653 10.369 1.00 0.00 H TER 89733 WAT 5013 ATOM 89733 O WAT 5014 28.651 75.226 110.115 1.00 0.00 O ATOM 89734 H1 WAT 5014 29.533 75.051 110.443 1.00 0.00 H ATOM 89735 H2 WAT 5014 28.243 75.760 110.796 1.00 0.00 H TER 89737 WAT 5014 ATOM 89737 O WAT 5015 121.402 52.862 157.094 1.00 0.00 O ATOM 89738 H1 WAT 5015 121.701 52.576 156.231 1.00 0.00 H ATOM 89739 H2 WAT 5015 121.483 52.083 157.645 1.00 0.00 H TER 89741 WAT 5015 ATOM 89741 O WAT 5016 98.888 56.221 1.535 1.00 0.00 O ATOM 89742 H1 WAT 5016 99.411 56.411 0.756 1.00 0.00 H ATOM 89743 H2 WAT 5016 99.166 55.345 1.802 1.00 0.00 H TER 89745 WAT 5016 ATOM 89745 O WAT 5017 110.430 66.408 13.641 1.00 0.00 O ATOM 89746 H1 WAT 5017 110.235 66.656 12.737 1.00 0.00 H ATOM 89747 H2 WAT 5017 109.785 66.885 14.164 1.00 0.00 H TER 89749 WAT 5017 ATOM 89749 O WAT 5018 96.844 71.213 145.089 1.00 0.00 O ATOM 89750 H1 WAT 5018 97.502 70.733 145.593 1.00 0.00 H ATOM 89751 H2 WAT 5018 96.040 70.704 145.199 1.00 0.00 H TER 89753 WAT 5018 ATOM 89753 O WAT 5019 140.655 42.865 77.218 1.00 0.00 O ATOM 89754 H1 WAT 5019 141.074 43.307 76.480 1.00 0.00 H ATOM 89755 H2 WAT 5019 141.375 42.654 77.812 1.00 0.00 H TER 89757 WAT 5019 ATOM 89757 O WAT 5020 11.723 110.547 14.825 1.00 0.00 O ATOM 89758 H1 WAT 5020 12.247 110.316 15.591 1.00 0.00 H ATOM 89759 H2 WAT 5020 12.285 110.340 14.078 1.00 0.00 H TER 89761 WAT 5020 ATOM 89761 O WAT 5021 23.565 114.976 68.440 1.00 0.00 O ATOM 89762 H1 WAT 5021 23.960 114.238 68.905 1.00 0.00 H ATOM 89763 H2 WAT 5021 24.159 115.145 67.709 1.00 0.00 H TER 89765 WAT 5021 ATOM 89765 O WAT 5022 52.533 81.591 115.790 1.00 0.00 O ATOM 89766 H1 WAT 5022 53.408 81.863 115.514 1.00 0.00 H ATOM 89767 H2 WAT 5022 52.005 82.388 115.734 1.00 0.00 H TER 89769 WAT 5022 ATOM 89769 O WAT 5023 111.122 27.838 112.598 1.00 0.00 O ATOM 89770 H1 WAT 5023 111.880 27.764 112.017 1.00 0.00 H ATOM 89771 H2 WAT 5023 110.970 26.945 112.907 1.00 0.00 H TER 89773 WAT 5023 ATOM 89773 O WAT 5024 128.655 65.111 13.635 1.00 0.00 O ATOM 89774 H1 WAT 5024 129.287 64.686 14.214 1.00 0.00 H ATOM 89775 H2 WAT 5024 129.168 65.367 12.868 1.00 0.00 H TER 89777 WAT 5024 ATOM 89777 O WAT 5025 6.759 116.089 24.758 1.00 0.00 O ATOM 89778 H1 WAT 5025 7.113 115.243 25.032 1.00 0.00 H ATOM 89779 H2 WAT 5025 7.531 116.612 24.537 1.00 0.00 H TER 89781 WAT 5025 ATOM 89781 O WAT 5026 57.253 129.819 99.091 1.00 0.00 O ATOM 89782 H1 WAT 5026 56.374 130.193 99.028 1.00 0.00 H ATOM 89783 H2 WAT 5026 57.490 129.611 98.188 1.00 0.00 H TER 89785 WAT 5026 ATOM 89785 O WAT 5027 42.791 99.921 122.245 1.00 0.00 O ATOM 89786 H1 WAT 5027 42.850 100.832 121.957 1.00 0.00 H ATOM 89787 H2 WAT 5027 43.586 99.511 121.905 1.00 0.00 H TER 89789 WAT 5027 ATOM 89789 O WAT 5028 38.880 80.903 76.324 1.00 0.00 O ATOM 89790 H1 WAT 5028 39.430 80.224 76.715 1.00 0.00 H ATOM 89791 H2 WAT 5028 39.066 81.688 76.838 1.00 0.00 H TER 89793 WAT 5028 ATOM 89793 O WAT 5029 33.834 76.801 157.626 1.00 0.00 O ATOM 89794 H1 WAT 5029 32.997 76.552 158.018 1.00 0.00 H ATOM 89795 H2 WAT 5029 34.246 75.969 157.393 1.00 0.00 H TER 89797 WAT 5029 ATOM 89797 O WAT 5030 97.912 60.506 2.442 1.00 0.00 O ATOM 89798 H1 WAT 5030 97.438 61.222 2.020 1.00 0.00 H ATOM 89799 H2 WAT 5030 97.514 60.435 3.310 1.00 0.00 H TER 89801 WAT 5030 ATOM 89801 O WAT 5031 18.336 91.878 26.698 1.00 0.00 O ATOM 89802 H1 WAT 5031 18.169 91.414 27.519 1.00 0.00 H ATOM 89803 H2 WAT 5031 19.261 92.122 26.745 1.00 0.00 H TER 89805 WAT 5031 ATOM 89805 O WAT 5032 71.033 4.377 89.775 1.00 0.00 O ATOM 89806 H1 WAT 5032 71.708 4.913 89.358 1.00 0.00 H ATOM 89807 H2 WAT 5032 70.943 4.746 90.653 1.00 0.00 H TER 89809 WAT 5032 ATOM 89809 O WAT 5033 46.198 4.370 95.349 1.00 0.00 O ATOM 89810 H1 WAT 5033 46.589 3.967 96.124 1.00 0.00 H ATOM 89811 H2 WAT 5033 46.754 4.086 94.624 1.00 0.00 H TER 89813 WAT 5033 ATOM 89813 O WAT 5034 45.721 121.695 111.064 1.00 0.00 O ATOM 89814 H1 WAT 5034 46.341 122.301 111.469 1.00 0.00 H ATOM 89815 H2 WAT 5034 45.645 120.975 111.690 1.00 0.00 H TER 89817 WAT 5034 ATOM 89817 O WAT 5035 3.401 77.213 19.456 1.00 0.00 O ATOM 89818 H1 WAT 5035 2.823 77.308 20.213 1.00 0.00 H ATOM 89819 H2 WAT 5035 4.265 77.048 19.833 1.00 0.00 H TER 89821 WAT 5035 ATOM 89821 O WAT 5036 143.064 17.994 135.219 1.00 0.00 O ATOM 89822 H1 WAT 5036 143.330 18.005 134.300 1.00 0.00 H ATOM 89823 H2 WAT 5036 143.438 17.185 135.567 1.00 0.00 H TER 89825 WAT 5036 ATOM 89825 O WAT 5037 56.733 68.959 60.318 1.00 0.00 O ATOM 89826 H1 WAT 5037 56.153 69.479 59.762 1.00 0.00 H ATOM 89827 H2 WAT 5037 57.605 69.091 59.944 1.00 0.00 H TER 89829 WAT 5037 ATOM 89829 O WAT 5038 36.487 4.596 128.739 1.00 0.00 O ATOM 89830 H1 WAT 5038 36.970 3.833 129.055 1.00 0.00 H ATOM 89831 H2 WAT 5038 35.730 4.229 128.283 1.00 0.00 H TER 89833 WAT 5038 ATOM 89833 O WAT 5039 77.168 7.394 1.524 1.00 0.00 O ATOM 89834 H1 WAT 5039 77.752 7.089 2.218 1.00 0.00 H ATOM 89835 H2 WAT 5039 77.596 7.120 0.713 1.00 0.00 H TER 89837 WAT 5039 ATOM 89837 O WAT 5040 127.425 71.348 130.593 1.00 0.00 O ATOM 89838 H1 WAT 5040 127.204 70.424 130.474 1.00 0.00 H ATOM 89839 H2 WAT 5040 128.369 71.349 130.755 1.00 0.00 H TER 89841 WAT 5040 ATOM 89841 O WAT 5041 142.306 53.222 97.236 1.00 0.00 O ATOM 89842 H1 WAT 5041 143.065 53.196 96.653 1.00 0.00 H ATOM 89843 H2 WAT 5041 142.330 54.099 97.620 1.00 0.00 H TER 89845 WAT 5041 ATOM 89845 O WAT 5042 130.324 84.320 8.914 1.00 0.00 O ATOM 89846 H1 WAT 5042 129.839 84.027 8.142 1.00 0.00 H ATOM 89847 H2 WAT 5042 131.194 83.935 8.809 1.00 0.00 H TER 89849 WAT 5042 ATOM 89849 O WAT 5043 4.720 65.791 109.892 1.00 0.00 O ATOM 89850 H1 WAT 5043 5.252 66.075 109.149 1.00 0.00 H ATOM 89851 H2 WAT 5043 3.833 66.078 109.675 1.00 0.00 H TER 89853 WAT 5043 ATOM 89853 O WAT 5044 24.514 29.206 85.046 1.00 0.00 O ATOM 89854 H1 WAT 5044 25.380 29.612 85.092 1.00 0.00 H ATOM 89855 H2 WAT 5044 23.906 29.944 85.003 1.00 0.00 H TER 89857 WAT 5044 ATOM 89857 O WAT 5045 105.021 53.379 6.974 1.00 0.00 O ATOM 89858 H1 WAT 5045 104.669 52.567 6.610 1.00 0.00 H ATOM 89859 H2 WAT 5045 105.821 53.112 7.426 1.00 0.00 H TER 89861 WAT 5045 ATOM 89861 O WAT 5046 36.604 79.125 23.900 1.00 0.00 O ATOM 89862 H1 WAT 5046 37.355 78.533 23.922 1.00 0.00 H ATOM 89863 H2 WAT 5046 36.122 78.873 23.112 1.00 0.00 H TER 89865 WAT 5046 ATOM 89865 O WAT 5047 98.358 32.673 3.167 1.00 0.00 O ATOM 89866 H1 WAT 5047 98.815 33.109 2.448 1.00 0.00 H ATOM 89867 H2 WAT 5047 97.437 32.681 2.905 1.00 0.00 H TER 89869 WAT 5047 ATOM 89869 O WAT 5048 110.375 31.954 148.301 1.00 0.00 O ATOM 89870 H1 WAT 5048 109.852 31.294 147.846 1.00 0.00 H ATOM 89871 H2 WAT 5048 110.534 32.630 147.642 1.00 0.00 H TER 89873 WAT 5048 ATOM 89873 O WAT 5049 117.854 30.220 121.672 1.00 0.00 O ATOM 89874 H1 WAT 5049 118.806 30.301 121.608 1.00 0.00 H ATOM 89875 H2 WAT 5049 117.712 29.357 122.061 1.00 0.00 H TER 89877 WAT 5049 ATOM 89877 O WAT 5050 83.463 103.395 137.153 1.00 0.00 O ATOM 89878 H1 WAT 5050 83.449 103.817 136.293 1.00 0.00 H ATOM 89879 H2 WAT 5050 83.271 104.102 137.770 1.00 0.00 H TER 89881 WAT 5050 ATOM 89881 O WAT 5051 4.033 114.991 121.196 1.00 0.00 O ATOM 89882 H1 WAT 5051 4.417 115.557 120.526 1.00 0.00 H ATOM 89883 H2 WAT 5051 3.363 114.489 120.732 1.00 0.00 H TER 89885 WAT 5051 ATOM 89885 O WAT 5052 95.583 132.346 139.341 1.00 0.00 O ATOM 89886 H1 WAT 5052 95.463 132.516 138.406 1.00 0.00 H ATOM 89887 H2 WAT 5052 94.714 132.092 139.652 1.00 0.00 H TER 89889 WAT 5052 ATOM 89889 O WAT 5053 48.749 134.313 152.701 1.00 0.00 O ATOM 89890 H1 WAT 5053 47.928 134.801 152.760 1.00 0.00 H ATOM 89891 H2 WAT 5053 49.231 134.740 151.993 1.00 0.00 H TER 89893 WAT 5053 ATOM 89893 O WAT 5054 142.920 84.945 3.239 1.00 0.00 O ATOM 89894 H1 WAT 5054 142.466 85.470 2.580 1.00 0.00 H ATOM 89895 H2 WAT 5054 142.625 85.304 4.076 1.00 0.00 H TER 89897 WAT 5054 ATOM 89897 O WAT 5055 24.879 95.434 97.855 1.00 0.00 O ATOM 89898 H1 WAT 5055 24.037 95.072 98.133 1.00 0.00 H ATOM 89899 H2 WAT 5055 24.754 95.649 96.931 1.00 0.00 H TER 89901 WAT 5055 ATOM 89901 O WAT 5056 123.020 16.597 154.924 1.00 0.00 O ATOM 89902 H1 WAT 5056 122.730 17.504 155.017 1.00 0.00 H ATOM 89903 H2 WAT 5056 122.494 16.250 154.203 1.00 0.00 H TER 89905 WAT 5056 ATOM 89905 O WAT 5057 58.836 33.170 134.305 1.00 0.00 O ATOM 89906 H1 WAT 5057 58.973 33.086 135.249 1.00 0.00 H ATOM 89907 H2 WAT 5057 59.008 32.294 133.960 1.00 0.00 H TER 89909 WAT 5057 ATOM 89909 O WAT 5058 55.982 76.932 7.213 1.00 0.00 O ATOM 89910 H1 WAT 5058 56.666 77.052 6.555 1.00 0.00 H ATOM 89911 H2 WAT 5058 56.147 77.618 7.859 1.00 0.00 H TER 89913 WAT 5058 ATOM 89913 O WAT 5059 4.889 40.948 107.983 1.00 0.00 O ATOM 89914 H1 WAT 5059 5.029 41.188 107.066 1.00 0.00 H ATOM 89915 H2 WAT 5059 3.944 41.031 108.110 1.00 0.00 H TER 89917 WAT 5059 ATOM 89917 O WAT 5060 112.865 11.489 7.350 1.00 0.00 O ATOM 89918 H1 WAT 5060 113.661 11.472 7.880 1.00 0.00 H ATOM 89919 H2 WAT 5060 112.156 11.355 7.978 1.00 0.00 H TER 89921 WAT 5060 ATOM 89921 O WAT 5061 8.669 120.283 136.636 1.00 0.00 O ATOM 89922 H1 WAT 5061 9.404 120.334 137.247 1.00 0.00 H ATOM 89923 H2 WAT 5061 7.899 120.477 137.170 1.00 0.00 H TER 89925 WAT 5061 ATOM 89925 O WAT 5062 118.002 119.160 13.193 1.00 0.00 O ATOM 89926 H1 WAT 5062 118.398 118.615 13.873 1.00 0.00 H ATOM 89927 H2 WAT 5062 118.649 119.172 12.488 1.00 0.00 H TER 89929 WAT 5062 ATOM 89929 O WAT 5063 79.858 47.978 123.713 1.00 0.00 O ATOM 89930 H1 WAT 5063 79.518 48.685 123.165 1.00 0.00 H ATOM 89931 H2 WAT 5063 79.812 47.201 123.157 1.00 0.00 H TER 89933 WAT 5063 ATOM 89933 O WAT 5064 2.418 48.571 138.509 1.00 0.00 O ATOM 89934 H1 WAT 5064 2.150 47.654 138.579 1.00 0.00 H ATOM 89935 H2 WAT 5064 1.980 49.005 139.242 1.00 0.00 H TER 89937 WAT 5064 ATOM 89937 O WAT 5065 134.263 69.346 75.632 1.00 0.00 O ATOM 89938 H1 WAT 5065 134.686 68.542 75.932 1.00 0.00 H ATOM 89939 H2 WAT 5065 133.594 69.526 76.292 1.00 0.00 H TER 89941 WAT 5065 ATOM 89941 O WAT 5066 86.348 98.798 12.403 1.00 0.00 O ATOM 89942 H1 WAT 5066 85.615 99.170 11.913 1.00 0.00 H ATOM 89943 H2 WAT 5066 87.111 99.297 12.110 1.00 0.00 H TER 89945 WAT 5066 ATOM 89945 O WAT 5067 140.303 83.980 80.013 1.00 0.00 O ATOM 89946 H1 WAT 5067 139.718 83.524 80.618 1.00 0.00 H ATOM 89947 H2 WAT 5067 141.114 84.100 80.508 1.00 0.00 H TER 89949 WAT 5067 ATOM 89949 O WAT 5068 122.510 144.253 147.311 1.00 0.00 O ATOM 89950 H1 WAT 5068 123.021 144.987 147.651 1.00 0.00 H ATOM 89951 H2 WAT 5068 122.162 143.821 148.091 1.00 0.00 H TER 89953 WAT 5068 ATOM 89953 O WAT 5069 58.621 7.336 73.522 1.00 0.00 O ATOM 89954 H1 WAT 5069 58.535 7.845 72.716 1.00 0.00 H ATOM 89955 H2 WAT 5069 59.166 6.588 73.277 1.00 0.00 H TER 89957 WAT 5069 ATOM 89957 O WAT 5070 124.264 72.771 119.858 1.00 0.00 O ATOM 89958 H1 WAT 5070 123.661 73.359 120.312 1.00 0.00 H ATOM 89959 H2 WAT 5070 124.637 72.227 120.552 1.00 0.00 H TER 89961 WAT 5070 ATOM 89961 O WAT 5071 4.447 57.134 87.852 1.00 0.00 O ATOM 89962 H1 WAT 5071 5.392 57.281 87.822 1.00 0.00 H ATOM 89963 H2 WAT 5071 4.276 56.857 88.752 1.00 0.00 H TER 89965 WAT 5071 ATOM 89965 O WAT 5072 47.270 87.683 73.224 1.00 0.00 O ATOM 89966 H1 WAT 5072 47.710 88.158 73.929 1.00 0.00 H ATOM 89967 H2 WAT 5072 46.726 87.037 73.675 1.00 0.00 H TER 89969 WAT 5072 ATOM 89969 O WAT 5073 103.582 108.638 80.547 1.00 0.00 O ATOM 89970 H1 WAT 5073 103.189 109.074 79.791 1.00 0.00 H ATOM 89971 H2 WAT 5073 104.022 109.340 81.026 1.00 0.00 H TER 89973 WAT 5073 ATOM 89973 O WAT 5074 73.049 18.264 128.735 1.00 0.00 O ATOM 89974 H1 WAT 5074 73.621 18.393 127.978 1.00 0.00 H ATOM 89975 H2 WAT 5074 72.301 17.776 128.390 1.00 0.00 H TER 89977 WAT 5074 ATOM 89977 O WAT 5075 88.549 111.341 72.850 1.00 0.00 O ATOM 89978 H1 WAT 5075 87.815 111.125 72.275 1.00 0.00 H ATOM 89979 H2 WAT 5075 88.221 111.166 73.732 1.00 0.00 H TER 89981 WAT 5075 ATOM 89981 O WAT 5076 103.865 11.316 70.057 1.00 0.00 O ATOM 89982 H1 WAT 5076 104.552 11.664 69.489 1.00 0.00 H ATOM 89983 H2 WAT 5076 103.268 10.863 69.461 1.00 0.00 H TER 89985 WAT 5076 ATOM 89985 O WAT 5077 1.599 9.535 126.728 1.00 0.00 O ATOM 89986 H1 WAT 5077 0.758 9.879 126.427 1.00 0.00 H ATOM 89987 H2 WAT 5077 2.233 9.861 126.090 1.00 0.00 H TER 89989 WAT 5077 ATOM 89989 O WAT 5078 27.726 56.344 148.387 1.00 0.00 O ATOM 89990 H1 WAT 5078 28.412 55.891 147.896 1.00 0.00 H ATOM 89991 H2 WAT 5078 28.034 57.248 148.450 1.00 0.00 H TER 89993 WAT 5078 ATOM 89993 O WAT 5079 52.632 62.363 73.564 1.00 0.00 O ATOM 89994 H1 WAT 5079 52.318 62.885 74.302 1.00 0.00 H ATOM 89995 H2 WAT 5079 52.290 62.813 72.791 1.00 0.00 H TER 89997 WAT 5079 ATOM 89997 O WAT 5080 58.568 57.183 27.407 1.00 0.00 O ATOM 89998 H1 WAT 5080 57.978 56.581 26.954 1.00 0.00 H ATOM 89999 H2 WAT 5080 59.433 56.784 27.317 1.00 0.00 H TER 90001 WAT 5080 ATOM 90001 O WAT 5081 105.837 100.188 91.602 1.00 0.00 O ATOM 90002 H1 WAT 5081 106.125 100.315 90.697 1.00 0.00 H ATOM 90003 H2 WAT 5081 106.642 100.008 92.087 1.00 0.00 H TER 90005 WAT 5081 ATOM 90005 O WAT 5082 41.881 105.059 72.149 1.00 0.00 O ATOM 90006 H1 WAT 5082 41.381 104.429 72.669 1.00 0.00 H ATOM 90007 H2 WAT 5082 41.542 104.958 71.260 1.00 0.00 H TER 90009 WAT 5082 ATOM 90009 O WAT 5083 15.232 87.239 67.506 1.00 0.00 O ATOM 90010 H1 WAT 5083 14.487 86.969 66.969 1.00 0.00 H ATOM 90011 H2 WAT 5083 15.856 86.517 67.430 1.00 0.00 H TER 90013 WAT 5083 ATOM 90013 O WAT 5084 16.745 56.783 144.959 1.00 0.00 O ATOM 90014 H1 WAT 5084 16.108 56.072 144.893 1.00 0.00 H ATOM 90015 H2 WAT 5084 16.220 57.555 145.175 1.00 0.00 H TER 90017 WAT 5084 ATOM 90017 O WAT 5085 20.429 141.899 146.417 1.00 0.00 O ATOM 90018 H1 WAT 5085 20.407 142.576 147.093 1.00 0.00 H ATOM 90019 H2 WAT 5085 19.932 141.171 146.790 1.00 0.00 H TER 90021 WAT 5085 ATOM 90021 O WAT 5086 70.484 114.777 147.083 1.00 0.00 O ATOM 90022 H1 WAT 5086 69.768 114.855 147.714 1.00 0.00 H ATOM 90023 H2 WAT 5086 70.291 113.972 146.601 1.00 0.00 H TER 90025 WAT 5086 ATOM 90025 O WAT 5087 12.184 114.938 138.944 1.00 0.00 O ATOM 90026 H1 WAT 5087 13.069 114.884 139.302 1.00 0.00 H ATOM 90027 H2 WAT 5087 11.999 114.054 138.627 1.00 0.00 H TER 90029 WAT 5087 ATOM 90029 O WAT 5088 93.300 83.965 148.345 1.00 0.00 O ATOM 90030 H1 WAT 5088 94.003 84.605 148.455 1.00 0.00 H ATOM 90031 H2 WAT 5088 92.563 84.474 148.007 1.00 0.00 H TER 90033 WAT 5088 ATOM 90033 O WAT 5089 29.162 76.711 15.371 1.00 0.00 O ATOM 90034 H1 WAT 5089 29.288 77.660 15.342 1.00 0.00 H ATOM 90035 H2 WAT 5089 28.563 76.527 14.648 1.00 0.00 H TER 90037 WAT 5089 ATOM 90037 O WAT 5090 46.024 49.311 23.141 1.00 0.00 O ATOM 90038 H1 WAT 5090 45.302 49.887 22.891 1.00 0.00 H ATOM 90039 H2 WAT 5090 46.615 49.872 23.644 1.00 0.00 H TER 90041 WAT 5090 ATOM 90041 O WAT 5091 71.172 85.138 136.920 1.00 0.00 O ATOM 90042 H1 WAT 5091 71.244 85.800 137.607 1.00 0.00 H ATOM 90043 H2 WAT 5091 70.233 84.966 136.850 1.00 0.00 H TER 90045 WAT 5091 ATOM 90045 O WAT 5092 60.561 118.355 134.115 1.00 0.00 O ATOM 90046 H1 WAT 5092 60.318 118.422 135.038 1.00 0.00 H ATOM 90047 H2 WAT 5092 59.741 118.149 133.666 1.00 0.00 H TER 90049 WAT 5092 ATOM 90049 O WAT 5093 56.745 33.508 23.961 1.00 0.00 O ATOM 90050 H1 WAT 5093 56.467 34.196 23.356 1.00 0.00 H ATOM 90051 H2 WAT 5093 56.863 32.736 23.409 1.00 0.00 H TER 90053 WAT 5093 ATOM 90053 O WAT 5094 67.943 9.742 144.377 1.00 0.00 O ATOM 90054 H1 WAT 5094 67.479 9.993 145.176 1.00 0.00 H ATOM 90055 H2 WAT 5094 67.316 9.204 143.894 1.00 0.00 H TER 90057 WAT 5094 ATOM 90057 O WAT 5095 41.539 26.862 130.605 1.00 0.00 O ATOM 90058 H1 WAT 5095 40.670 27.040 130.245 1.00 0.00 H ATOM 90059 H2 WAT 5095 42.039 27.658 130.426 1.00 0.00 H TER 90061 WAT 5095 ATOM 90061 O WAT 5096 59.404 48.021 140.759 1.00 0.00 O ATOM 90062 H1 WAT 5096 59.866 48.822 140.510 1.00 0.00 H ATOM 90063 H2 WAT 5096 59.469 47.458 139.988 1.00 0.00 H TER 90065 WAT 5096 ATOM 90065 O WAT 5097 14.398 7.231 14.548 1.00 0.00 O ATOM 90066 H1 WAT 5097 13.852 6.767 15.182 1.00 0.00 H ATOM 90067 H2 WAT 5097 14.441 6.644 13.793 1.00 0.00 H TER 90069 WAT 5097 ATOM 90069 O WAT 5098 71.077 70.335 153.609 1.00 0.00 O ATOM 90070 H1 WAT 5098 71.828 70.472 153.031 1.00 0.00 H ATOM 90071 H2 WAT 5098 71.415 69.781 154.313 1.00 0.00 H TER 90073 WAT 5098 ATOM 90073 O WAT 5099 35.365 56.043 141.417 1.00 0.00 O ATOM 90074 H1 WAT 5099 35.771 56.229 142.264 1.00 0.00 H ATOM 90075 H2 WAT 5099 34.428 55.988 141.607 1.00 0.00 H TER 90077 WAT 5099 ATOM 90077 O WAT 5100 52.580 142.042 109.638 1.00 0.00 O ATOM 90078 H1 WAT 5100 52.463 142.791 109.053 1.00 0.00 H ATOM 90079 H2 WAT 5100 51.747 141.972 110.106 1.00 0.00 H TER 90081 WAT 5100 ATOM 90081 O WAT 5101 43.986 117.319 113.768 1.00 0.00 O ATOM 90082 H1 WAT 5101 43.882 117.574 114.685 1.00 0.00 H ATOM 90083 H2 WAT 5101 43.433 117.933 113.285 1.00 0.00 H TER 90085 WAT 5101 ATOM 90085 O WAT 5102 77.361 72.658 127.764 1.00 0.00 O ATOM 90086 H1 WAT 5102 77.426 73.523 128.167 1.00 0.00 H ATOM 90087 H2 WAT 5102 76.537 72.682 127.277 1.00 0.00 H TER 90089 WAT 5102 ATOM 90089 O WAT 5103 89.705 30.774 19.278 1.00 0.00 O ATOM 90090 H1 WAT 5103 89.452 30.011 18.759 1.00 0.00 H ATOM 90091 H2 WAT 5103 90.646 30.668 19.418 1.00 0.00 H TER 90093 WAT 5103 ATOM 90093 O WAT 5104 65.061 144.594 -0.205 1.00 0.00 O ATOM 90094 H1 WAT 5104 65.772 144.073 0.168 1.00 0.00 H ATOM 90095 H2 WAT 5104 64.360 144.545 0.445 1.00 0.00 H TER 90097 WAT 5104 ATOM 90097 O WAT 5105 68.223 80.962 124.247 1.00 0.00 O ATOM 90098 H1 WAT 5105 67.569 80.860 123.555 1.00 0.00 H ATOM 90099 H2 WAT 5105 69.060 80.808 123.811 1.00 0.00 H TER 90101 WAT 5105 ATOM 90101 O WAT 5106 39.878 141.090 106.571 1.00 0.00 O ATOM 90102 H1 WAT 5106 39.887 141.933 106.117 1.00 0.00 H ATOM 90103 H2 WAT 5106 39.295 140.541 106.046 1.00 0.00 H TER 90105 WAT 5106 ATOM 90105 O WAT 5107 81.477 100.132 116.856 1.00 0.00 O ATOM 90106 H1 WAT 5107 81.093 99.932 116.003 1.00 0.00 H ATOM 90107 H2 WAT 5107 81.703 101.061 116.805 1.00 0.00 H TER 90109 WAT 5107 ATOM 90109 O WAT 5108 24.447 95.793 90.823 1.00 0.00 O ATOM 90110 H1 WAT 5108 24.591 95.465 91.711 1.00 0.00 H ATOM 90111 H2 WAT 5108 24.081 96.669 90.948 1.00 0.00 H TER 90113 WAT 5108 ATOM 90113 O WAT 5109 53.420 90.285 150.006 1.00 0.00 O ATOM 90114 H1 WAT 5109 53.990 90.972 149.662 1.00 0.00 H ATOM 90115 H2 WAT 5109 52.975 89.934 149.234 1.00 0.00 H TER 90117 WAT 5109 ATOM 90117 O WAT 5110 57.438 119.355 2.926 1.00 0.00 O ATOM 90118 H1 WAT 5110 58.388 119.281 3.009 1.00 0.00 H ATOM 90119 H2 WAT 5110 57.101 119.100 3.785 1.00 0.00 H TER 90121 WAT 5110 ATOM 90121 O WAT 5111 32.793 113.685 140.095 1.00 0.00 O ATOM 90122 H1 WAT 5111 33.390 114.292 140.532 1.00 0.00 H ATOM 90123 H2 WAT 5111 32.695 112.959 140.711 1.00 0.00 H TER 90125 WAT 5111 ATOM 90125 O WAT 5112 128.303 73.004 94.985 1.00 0.00 O ATOM 90126 H1 WAT 5112 129.124 73.406 95.269 1.00 0.00 H ATOM 90127 H2 WAT 5112 128.248 72.191 95.489 1.00 0.00 H TER 90129 WAT 5112 ATOM 90129 O WAT 5113 88.661 87.698 71.005 1.00 0.00 O ATOM 90130 H1 WAT 5113 88.936 86.913 71.479 1.00 0.00 H ATOM 90131 H2 WAT 5113 87.828 87.941 71.407 1.00 0.00 H TER 90133 WAT 5113 ATOM 90133 O WAT 5114 46.156 111.293 136.466 1.00 0.00 O ATOM 90134 H1 WAT 5114 46.313 110.679 137.183 1.00 0.00 H ATOM 90135 H2 WAT 5114 46.846 111.102 135.830 1.00 0.00 H TER 90137 WAT 5114 ATOM 90137 O WAT 5115 67.543 27.367 134.456 1.00 0.00 O ATOM 90138 H1 WAT 5115 68.330 27.213 133.933 1.00 0.00 H ATOM 90139 H2 WAT 5115 67.691 26.875 135.263 1.00 0.00 H TER 90141 WAT 5115 ATOM 90141 O WAT 5116 132.951 2.305 124.733 1.00 0.00 O ATOM 90142 H1 WAT 5116 132.693 1.952 125.585 1.00 0.00 H ATOM 90143 H2 WAT 5116 132.715 1.618 124.108 1.00 0.00 H TER 90145 WAT 5116 ATOM 90145 O WAT 5117 59.234 17.816 88.388 1.00 0.00 O ATOM 90146 H1 WAT 5117 59.544 16.912 88.336 1.00 0.00 H ATOM 90147 H2 WAT 5117 58.505 17.783 89.007 1.00 0.00 H TER 90149 WAT 5117 ATOM 90149 O WAT 5118 77.567 108.138 6.690 1.00 0.00 O ATOM 90150 H1 WAT 5118 76.850 108.036 7.316 1.00 0.00 H ATOM 90151 H2 WAT 5118 78.360 108.021 7.212 1.00 0.00 H TER 90153 WAT 5118 ATOM 90153 O WAT 5119 39.865 4.744 141.409 1.00 0.00 O ATOM 90154 H1 WAT 5119 39.084 5.053 140.950 1.00 0.00 H ATOM 90155 H2 WAT 5119 39.530 4.369 142.224 1.00 0.00 H TER 90157 WAT 5119 ATOM 90157 O WAT 5120 75.691 39.157 111.585 1.00 0.00 O ATOM 90158 H1 WAT 5120 75.346 38.313 111.293 1.00 0.00 H ATOM 90159 H2 WAT 5120 76.400 39.351 110.971 1.00 0.00 H TER 90161 WAT 5120 ATOM 90161 O WAT 5121 112.348 8.336 61.109 1.00 0.00 O ATOM 90162 H1 WAT 5121 113.256 8.041 61.175 1.00 0.00 H ATOM 90163 H2 WAT 5121 111.874 7.577 60.770 1.00 0.00 H TER 90165 WAT 5121 ATOM 90165 O WAT 5122 2.726 85.295 139.864 1.00 0.00 O ATOM 90166 H1 WAT 5122 3.499 85.598 140.341 1.00 0.00 H ATOM 90167 H2 WAT 5122 3.064 84.642 139.251 1.00 0.00 H TER 90169 WAT 5122 ATOM 90169 O WAT 5123 71.384 139.326 127.290 1.00 0.00 O ATOM 90170 H1 WAT 5123 71.956 140.035 126.995 1.00 0.00 H ATOM 90171 H2 WAT 5123 71.731 139.080 128.147 1.00 0.00 H TER 90173 WAT 5123 ATOM 90173 O WAT 5124 59.253 6.740 47.567 1.00 0.00 O ATOM 90174 H1 WAT 5124 59.970 6.693 48.198 1.00 0.00 H ATOM 90175 H2 WAT 5124 59.389 7.571 47.111 1.00 0.00 H TER 90177 WAT 5124 ATOM 90177 O WAT 5125 54.596 115.954 103.870 1.00 0.00 O ATOM 90178 H1 WAT 5125 54.796 115.712 102.965 1.00 0.00 H ATOM 90179 H2 WAT 5125 53.738 115.562 104.038 1.00 0.00 H TER 90181 WAT 5125 ATOM 90181 O WAT 5126 123.165 42.129 143.212 1.00 0.00 O ATOM 90182 H1 WAT 5126 124.086 42.129 142.949 1.00 0.00 H ATOM 90183 H2 WAT 5126 122.738 41.541 142.588 1.00 0.00 H TER 90185 WAT 5126 ATOM 90185 O WAT 5127 74.053 67.503 4.178 1.00 0.00 O ATOM 90186 H1 WAT 5127 74.216 67.170 5.060 1.00 0.00 H ATOM 90187 H2 WAT 5127 74.292 66.779 3.600 1.00 0.00 H TER 90189 WAT 5127 ATOM 90189 O WAT 5128 3.072 120.012 60.097 1.00 0.00 O ATOM 90190 H1 WAT 5128 3.738 120.589 59.723 1.00 0.00 H ATOM 90191 H2 WAT 5128 2.300 120.569 60.195 1.00 0.00 H TER 90193 WAT 5128 ATOM 90193 O WAT 5129 112.234 140.464 112.428 1.00 0.00 O ATOM 90194 H1 WAT 5129 111.901 139.804 111.820 1.00 0.00 H ATOM 90195 H2 WAT 5129 113.027 140.797 112.010 1.00 0.00 H TER 90197 WAT 5129 ATOM 90197 O WAT 5130 20.329 130.305 8.194 1.00 0.00 O ATOM 90198 H1 WAT 5130 19.802 131.090 8.341 1.00 0.00 H ATOM 90199 H2 WAT 5130 20.934 130.550 7.494 1.00 0.00 H TER 90201 WAT 5130 ATOM 90201 O WAT 5131 45.138 23.445 150.099 1.00 0.00 O ATOM 90202 H1 WAT 5131 44.720 23.172 149.282 1.00 0.00 H ATOM 90203 H2 WAT 5131 44.952 24.382 150.162 1.00 0.00 H TER 90205 WAT 5131 ATOM 90205 O WAT 5132 54.511 31.840 134.711 1.00 0.00 O ATOM 90206 H1 WAT 5132 53.622 31.492 134.637 1.00 0.00 H ATOM 90207 H2 WAT 5132 54.498 32.363 135.512 1.00 0.00 H TER 90209 WAT 5132 ATOM 90209 O WAT 5133 68.438 86.117 85.208 1.00 0.00 O ATOM 90210 H1 WAT 5133 68.518 87.052 85.021 1.00 0.00 H ATOM 90211 H2 WAT 5133 68.661 85.687 84.382 1.00 0.00 H TER 90213 WAT 5133 ATOM 90213 O WAT 5134 45.858 107.750 146.641 1.00 0.00 O ATOM 90214 H1 WAT 5134 46.667 107.297 146.878 1.00 0.00 H ATOM 90215 H2 WAT 5134 46.111 108.333 145.925 1.00 0.00 H TER 90217 WAT 5134 ATOM 90217 O WAT 5135 120.667 63.154 107.900 1.00 0.00 O ATOM 90218 H1 WAT 5135 120.402 62.755 108.729 1.00 0.00 H ATOM 90219 H2 WAT 5135 120.422 64.075 107.989 1.00 0.00 H TER 90221 WAT 5135 ATOM 90221 O WAT 5136 120.900 129.368 156.357 1.00 0.00 O ATOM 90222 H1 WAT 5136 121.551 128.787 156.751 1.00 0.00 H ATOM 90223 H2 WAT 5136 121.322 129.698 155.564 1.00 0.00 H TER 90225 WAT 5136 ATOM 90225 O WAT 5137 23.819 137.725 70.472 1.00 0.00 O ATOM 90226 H1 WAT 5137 24.467 137.643 69.772 1.00 0.00 H ATOM 90227 H2 WAT 5137 24.312 138.068 71.217 1.00 0.00 H TER 90229 WAT 5137 ATOM 90229 O WAT 5138 65.421 44.252 9.258 1.00 0.00 O ATOM 90230 H1 WAT 5138 65.538 44.863 8.531 1.00 0.00 H ATOM 90231 H2 WAT 5138 65.780 44.710 10.017 1.00 0.00 H TER 90233 WAT 5138 ATOM 90233 O WAT 5139 98.241 87.749 84.352 1.00 0.00 O ATOM 90234 H1 WAT 5139 97.421 87.594 83.882 1.00 0.00 H ATOM 90235 H2 WAT 5139 98.853 88.040 83.676 1.00 0.00 H TER 90237 WAT 5139 ATOM 90237 O WAT 5140 38.872 77.321 157.438 1.00 0.00 O ATOM 90238 H1 WAT 5140 38.758 78.270 157.487 1.00 0.00 H ATOM 90239 H2 WAT 5140 38.075 77.006 157.010 1.00 0.00 H TER 90241 WAT 5140 ATOM 90241 O WAT 5141 29.638 73.971 20.429 1.00 0.00 O ATOM 90242 H1 WAT 5141 29.056 73.649 21.116 1.00 0.00 H ATOM 90243 H2 WAT 5141 30.078 73.187 20.101 1.00 0.00 H TER 90245 WAT 5141 ATOM 90245 O WAT 5142 128.327 97.769 5.449 1.00 0.00 O ATOM 90246 H1 WAT 5142 127.529 98.218 5.168 1.00 0.00 H ATOM 90247 H2 WAT 5142 128.966 97.965 4.764 1.00 0.00 H TER 90249 WAT 5142 ATOM 90249 O WAT 5143 137.343 130.124 127.033 1.00 0.00 O ATOM 90250 H1 WAT 5143 137.204 130.548 127.879 1.00 0.00 H ATOM 90251 H2 WAT 5143 137.167 129.197 127.198 1.00 0.00 H TER 90253 WAT 5143 ATOM 90253 O WAT 5144 70.105 91.705 14.501 1.00 0.00 O ATOM 90254 H1 WAT 5144 70.782 91.429 13.883 1.00 0.00 H ATOM 90255 H2 WAT 5144 70.177 91.086 15.227 1.00 0.00 H TER 90257 WAT 5144 ATOM 90257 O WAT 5145 116.384 110.770 139.583 1.00 0.00 O ATOM 90258 H1 WAT 5145 117.154 110.204 139.640 1.00 0.00 H ATOM 90259 H2 WAT 5145 116.045 110.804 140.477 1.00 0.00 H TER 90261 WAT 5145 ATOM 90261 O WAT 5146 49.250 106.695 117.594 1.00 0.00 O ATOM 90262 H1 WAT 5146 50.052 107.209 117.496 1.00 0.00 H ATOM 90263 H2 WAT 5146 49.000 106.467 116.699 1.00 0.00 H TER 90265 WAT 5146 ATOM 90265 O WAT 5147 39.386 124.932 67.928 1.00 0.00 O ATOM 90266 H1 WAT 5147 38.930 125.401 68.627 1.00 0.00 H ATOM 90267 H2 WAT 5147 39.320 125.512 67.169 1.00 0.00 H TER 90269 WAT 5147 ATOM 90269 O WAT 5148 12.956 32.942 142.798 1.00 0.00 O ATOM 90270 H1 WAT 5148 12.984 32.179 142.220 1.00 0.00 H ATOM 90271 H2 WAT 5148 13.737 32.858 143.344 1.00 0.00 H TER 90273 WAT 5148 ATOM 90273 O WAT 5149 78.188 13.805 1.835 1.00 0.00 O ATOM 90274 H1 WAT 5149 78.151 14.661 2.262 1.00 0.00 H ATOM 90275 H2 WAT 5149 78.717 13.266 2.424 1.00 0.00 H TER 90277 WAT 5149 ATOM 90277 O WAT 5150 25.064 100.105 19.386 1.00 0.00 O ATOM 90278 H1 WAT 5150 25.612 99.998 20.164 1.00 0.00 H ATOM 90279 H2 WAT 5150 24.336 100.653 19.680 1.00 0.00 H TER 90281 WAT 5150 ATOM 90281 O WAT 5151 37.405 2.069 129.229 1.00 0.00 O ATOM 90282 H1 WAT 5151 36.855 1.426 128.783 1.00 0.00 H ATOM 90283 H2 WAT 5151 38.300 1.762 129.084 1.00 0.00 H TER 90285 WAT 5151 ATOM 90285 O WAT 5152 42.335 92.926 89.154 1.00 0.00 O ATOM 90286 H1 WAT 5152 42.935 92.292 88.763 1.00 0.00 H ATOM 90287 H2 WAT 5152 42.883 93.444 89.743 1.00 0.00 H TER 90289 WAT 5152 ATOM 90289 O WAT 5153 67.119 135.422 79.495 1.00 0.00 O ATOM 90290 H1 WAT 5153 67.570 134.628 79.782 1.00 0.00 H ATOM 90291 H2 WAT 5153 67.383 135.530 78.582 1.00 0.00 H TER 90293 WAT 5153 ATOM 90293 O WAT 5154 47.520 53.515 7.143 1.00 0.00 O ATOM 90294 H1 WAT 5154 47.265 54.433 7.060 1.00 0.00 H ATOM 90295 H2 WAT 5154 48.389 53.543 7.543 1.00 0.00 H TER 90297 WAT 5154 ATOM 90297 O WAT 5155 115.854 77.058 155.896 1.00 0.00 O ATOM 90298 H1 WAT 5155 115.596 77.979 155.855 1.00 0.00 H ATOM 90299 H2 WAT 5155 115.083 76.608 156.240 1.00 0.00 H TER 90301 WAT 5155 ATOM 90301 O WAT 5156 110.095 107.754 67.557 1.00 0.00 O ATOM 90302 H1 WAT 5156 109.469 108.397 67.889 1.00 0.00 H ATOM 90303 H2 WAT 5156 110.286 108.044 66.665 1.00 0.00 H TER 90305 WAT 5156 ATOM 90305 O WAT 5157 124.677 16.462 124.363 1.00 0.00 O ATOM 90306 H1 WAT 5157 125.332 17.159 124.336 1.00 0.00 H ATOM 90307 H2 WAT 5157 124.600 16.242 125.291 1.00 0.00 H TER 90309 WAT 5157 ATOM 90309 O WAT 5158 18.219 116.894 9.939 1.00 0.00 O ATOM 90310 H1 WAT 5158 18.055 117.753 9.551 1.00 0.00 H ATOM 90311 H2 WAT 5158 18.767 116.442 9.298 1.00 0.00 H TER 90313 WAT 5158 ATOM 90313 O WAT 5159 7.873 98.331 132.759 1.00 0.00 O ATOM 90314 H1 WAT 5159 7.374 98.822 133.412 1.00 0.00 H ATOM 90315 H2 WAT 5159 8.784 98.579 132.918 1.00 0.00 H TER 90317 WAT 5159 ATOM 90317 O WAT 5160 132.365 74.268 9.462 1.00 0.00 O ATOM 90318 H1 WAT 5160 132.456 74.527 10.379 1.00 0.00 H ATOM 90319 H2 WAT 5160 133.163 74.589 9.042 1.00 0.00 H TER 90321 WAT 5160 ATOM 90321 O WAT 5161 3.541 57.942 112.150 1.00 0.00 O ATOM 90322 H1 WAT 5161 4.191 58.198 112.804 1.00 0.00 H ATOM 90323 H2 WAT 5161 2.723 58.333 112.458 1.00 0.00 H TER 90325 WAT 5161 ATOM 90325 O WAT 5162 10.097 18.764 17.798 1.00 0.00 O ATOM 90326 H1 WAT 5162 9.466 18.821 18.515 1.00 0.00 H ATOM 90327 H2 WAT 5162 9.651 18.246 17.127 1.00 0.00 H TER 90329 WAT 5162 ATOM 90329 O WAT 5163 116.753 99.352 80.487 1.00 0.00 O ATOM 90330 H1 WAT 5163 116.950 98.541 80.955 1.00 0.00 H ATOM 90331 H2 WAT 5163 117.600 99.651 80.158 1.00 0.00 H TER 90333 WAT 5163 ATOM 90333 O WAT 5164 73.579 47.735 84.962 1.00 0.00 O ATOM 90334 H1 WAT 5164 73.282 47.964 84.081 1.00 0.00 H ATOM 90335 H2 WAT 5164 74.216 48.414 85.184 1.00 0.00 H TER 90337 WAT 5164 ATOM 90337 O WAT 5165 126.198 40.889 151.946 1.00 0.00 O ATOM 90338 H1 WAT 5165 125.737 41.711 151.780 1.00 0.00 H ATOM 90339 H2 WAT 5165 127.073 41.027 151.584 1.00 0.00 H TER 90341 WAT 5165 ATOM 90341 O WAT 5166 61.781 43.252 76.890 1.00 0.00 O ATOM 90342 H1 WAT 5166 60.847 43.438 76.989 1.00 0.00 H ATOM 90343 H2 WAT 5166 61.887 42.368 77.240 1.00 0.00 H TER 90345 WAT 5166 ATOM 90345 O WAT 5167 95.589 128.115 156.302 1.00 0.00 O ATOM 90346 H1 WAT 5167 95.644 127.790 155.403 1.00 0.00 H ATOM 90347 H2 WAT 5167 94.963 127.530 156.730 1.00 0.00 H TER 90349 WAT 5167 ATOM 90349 O WAT 5168 56.695 117.107 111.831 1.00 0.00 O ATOM 90350 H1 WAT 5168 57.229 117.444 112.551 1.00 0.00 H ATOM 90351 H2 WAT 5168 55.895 117.631 111.861 1.00 0.00 H TER 90353 WAT 5168 ATOM 90353 O WAT 5169 2.972 38.541 78.383 1.00 0.00 O ATOM 90354 H1 WAT 5169 2.175 38.615 78.909 1.00 0.00 H ATOM 90355 H2 WAT 5169 3.589 39.143 78.798 1.00 0.00 H TER 90357 WAT 5169 ATOM 90357 O WAT 5170 21.492 61.634 127.529 1.00 0.00 O ATOM 90358 H1 WAT 5170 20.656 62.013 127.801 1.00 0.00 H ATOM 90359 H2 WAT 5170 21.250 60.896 126.970 1.00 0.00 H TER 90361 WAT 5170 ATOM 90361 O WAT 5171 137.311 24.050 84.331 1.00 0.00 O ATOM 90362 H1 WAT 5171 137.546 23.858 85.238 1.00 0.00 H ATOM 90363 H2 WAT 5171 136.915 23.240 84.009 1.00 0.00 H TER 90365 WAT 5171 ATOM 90365 O WAT 5172 144.355 56.483 75.727 1.00 0.00 O ATOM 90366 H1 WAT 5172 144.891 57.131 75.269 1.00 0.00 H ATOM 90367 H2 WAT 5172 144.082 56.925 76.531 1.00 0.00 H TER 90369 WAT 5172 ATOM 90369 O WAT 5173 51.306 30.092 130.613 1.00 0.00 O ATOM 90370 H1 WAT 5173 51.588 29.245 130.958 1.00 0.00 H ATOM 90371 H2 WAT 5173 51.546 30.721 131.294 1.00 0.00 H TER 90373 WAT 5173 ATOM 90373 O WAT 5174 74.354 90.790 77.367 1.00 0.00 O ATOM 90374 H1 WAT 5174 74.953 90.738 76.622 1.00 0.00 H ATOM 90375 H2 WAT 5174 73.492 90.607 76.993 1.00 0.00 H TER 90377 WAT 5174 ATOM 90377 O WAT 5175 119.908 145.480 73.833 1.00 0.00 O ATOM 90378 H1 WAT 5175 119.940 144.938 74.621 1.00 0.00 H ATOM 90379 H2 WAT 5175 119.088 145.968 73.911 1.00 0.00 H TER 90381 WAT 5175 ATOM 90381 O WAT 5176 93.246 137.436 144.532 1.00 0.00 O ATOM 90382 H1 WAT 5176 94.009 137.973 144.320 1.00 0.00 H ATOM 90383 H2 WAT 5176 93.287 137.326 145.482 1.00 0.00 H TER 90385 WAT 5176 ATOM 90385 O WAT 5177 139.625 66.487 57.137 1.00 0.00 O ATOM 90386 H1 WAT 5177 140.432 66.854 57.496 1.00 0.00 H ATOM 90387 H2 WAT 5177 139.676 65.552 57.339 1.00 0.00 H TER 90389 WAT 5177 ATOM 90389 O WAT 5178 142.829 13.553 91.549 1.00 0.00 O ATOM 90390 H1 WAT 5178 143.396 12.827 91.289 1.00 0.00 H ATOM 90391 H2 WAT 5178 142.121 13.140 92.043 1.00 0.00 H TER 90393 WAT 5178 ATOM 90393 O WAT 5179 88.588 65.770 110.262 1.00 0.00 O ATOM 90394 H1 WAT 5179 88.765 64.899 110.615 1.00 0.00 H ATOM 90395 H2 WAT 5179 87.633 65.834 110.249 1.00 0.00 H TER 90397 WAT 5179 ATOM 90397 O WAT 5180 63.011 68.329 116.695 1.00 0.00 O ATOM 90398 H1 WAT 5180 62.187 68.506 117.148 1.00 0.00 H ATOM 90399 H2 WAT 5180 63.409 69.191 116.574 1.00 0.00 H TER 90401 WAT 5180 ATOM 90401 O WAT 5181 118.775 59.739 101.768 1.00 0.00 O ATOM 90402 H1 WAT 5181 118.095 59.283 101.271 1.00 0.00 H ATOM 90403 H2 WAT 5181 118.400 60.601 101.952 1.00 0.00 H TER 90405 WAT 5181 ATOM 90405 O WAT 5182 44.399 30.442 0.321 1.00 0.00 O ATOM 90406 H1 WAT 5182 44.520 30.433 1.270 1.00 0.00 H ATOM 90407 H2 WAT 5182 44.680 31.317 0.052 1.00 0.00 H TER 90409 WAT 5182 ATOM 90409 O WAT 5183 131.848 0.577 15.252 1.00 0.00 O ATOM 90410 H1 WAT 5183 131.644 -0.151 14.665 1.00 0.00 H ATOM 90411 H2 WAT 5183 131.137 1.202 15.116 1.00 0.00 H TER 90413 WAT 5183 ATOM 90413 O WAT 5184 50.448 17.248 110.836 1.00 0.00 O ATOM 90414 H1 WAT 5184 49.988 18.087 110.828 1.00 0.00 H ATOM 90415 H2 WAT 5184 50.117 16.800 111.614 1.00 0.00 H TER 90417 WAT 5184 ATOM 90417 O WAT 5185 79.895 20.407 2.255 1.00 0.00 O ATOM 90418 H1 WAT 5185 80.052 20.766 3.129 1.00 0.00 H ATOM 90419 H2 WAT 5185 78.972 20.155 2.262 1.00 0.00 H TER 90421 WAT 5185 ATOM 90421 O WAT 5186 110.157 134.289 55.463 1.00 0.00 O ATOM 90422 H1 WAT 5186 110.814 133.687 55.113 1.00 0.00 H ATOM 90423 H2 WAT 5186 109.747 134.673 54.687 1.00 0.00 H TER 90425 WAT 5186 ATOM 90425 O WAT 5187 91.914 84.173 125.871 1.00 0.00 O ATOM 90426 H1 WAT 5187 91.011 84.360 126.129 1.00 0.00 H ATOM 90427 H2 WAT 5187 92.282 85.029 125.652 1.00 0.00 H TER 90429 WAT 5187 ATOM 90429 O WAT 5188 39.621 111.184 88.844 1.00 0.00 O ATOM 90430 H1 WAT 5188 39.572 111.479 87.935 1.00 0.00 H ATOM 90431 H2 WAT 5188 40.558 111.157 89.037 1.00 0.00 H TER 90433 WAT 5188 ATOM 90433 O WAT 5189 108.930 121.384 125.349 1.00 0.00 O ATOM 90434 H1 WAT 5189 109.765 121.851 125.380 1.00 0.00 H ATOM 90435 H2 WAT 5189 108.726 121.198 126.266 1.00 0.00 H TER 90437 WAT 5189 ATOM 90437 O WAT 5190 79.786 85.215 107.098 1.00 0.00 O ATOM 90438 H1 WAT 5190 79.760 84.311 106.783 1.00 0.00 H ATOM 90439 H2 WAT 5190 80.139 85.715 106.362 1.00 0.00 H TER 90441 WAT 5190 ATOM 90441 O WAT 5191 36.303 28.925 71.430 1.00 0.00 O ATOM 90442 H1 WAT 5191 36.092 29.727 70.952 1.00 0.00 H ATOM 90443 H2 WAT 5191 37.088 29.144 71.932 1.00 0.00 H TER 90445 WAT 5191 ATOM 90445 O WAT 5192 122.897 85.552 146.614 1.00 0.00 O ATOM 90446 H1 WAT 5192 122.282 86.009 147.188 1.00 0.00 H ATOM 90447 H2 WAT 5192 123.702 85.488 147.127 1.00 0.00 H TER 90449 WAT 5192 ATOM 90449 O WAT 5193 139.408 72.969 108.321 1.00 0.00 O ATOM 90450 H1 WAT 5193 139.061 72.284 108.892 1.00 0.00 H ATOM 90451 H2 WAT 5193 140.043 72.518 107.765 1.00 0.00 H TER 90453 WAT 5193 ATOM 90453 O WAT 5194 120.577 105.977 6.508 1.00 0.00 O ATOM 90454 H1 WAT 5194 120.551 106.890 6.796 1.00 0.00 H ATOM 90455 H2 WAT 5194 121.498 105.818 6.301 1.00 0.00 H TER 90457 WAT 5194 ATOM 90457 O WAT 5195 14.198 94.919 119.164 1.00 0.00 O ATOM 90458 H1 WAT 5195 14.811 94.310 119.575 1.00 0.00 H ATOM 90459 H2 WAT 5195 14.698 95.729 119.062 1.00 0.00 H TER 90461 WAT 5195 ATOM 90461 O WAT 5196 19.614 17.824 147.051 1.00 0.00 O ATOM 90462 H1 WAT 5196 19.163 17.021 146.792 1.00 0.00 H ATOM 90463 H2 WAT 5196 20.381 17.522 147.538 1.00 0.00 H TER 90465 WAT 5196 ATOM 90465 O WAT 5197 75.271 19.454 109.813 1.00 0.00 O ATOM 90466 H1 WAT 5197 75.783 18.791 110.277 1.00 0.00 H ATOM 90467 H2 WAT 5197 74.709 19.837 110.487 1.00 0.00 H TER 90469 WAT 5197 ATOM 90469 O WAT 5198 70.742 118.265 113.506 1.00 0.00 O ATOM 90470 H1 WAT 5198 70.304 118.355 112.659 1.00 0.00 H ATOM 90471 H2 WAT 5198 71.638 118.008 113.285 1.00 0.00 H TER 90473 WAT 5198 ATOM 90473 O WAT 5199 94.856 99.699 67.252 1.00 0.00 O ATOM 90474 H1 WAT 5199 95.436 100.430 67.038 1.00 0.00 H ATOM 90475 H2 WAT 5199 94.389 99.517 66.436 1.00 0.00 H TER 90477 WAT 5199 ATOM 90477 O WAT 5200 30.666 36.866 132.908 1.00 0.00 O ATOM 90478 H1 WAT 5200 30.814 37.811 132.870 1.00 0.00 H ATOM 90479 H2 WAT 5200 30.970 36.542 132.061 1.00 0.00 H TER 90481 WAT 5200 ATOM 90481 O WAT 5201 11.216 111.312 66.205 1.00 0.00 O ATOM 90482 H1 WAT 5201 10.873 110.806 66.941 1.00 0.00 H ATOM 90483 H2 WAT 5201 11.043 112.224 66.439 1.00 0.00 H TER 90485 WAT 5201 ATOM 90485 O WAT 5202 18.694 4.435 61.021 1.00 0.00 O ATOM 90486 H1 WAT 5202 19.056 5.158 60.510 1.00 0.00 H ATOM 90487 H2 WAT 5202 18.163 4.859 61.695 1.00 0.00 H TER 90489 WAT 5202 ATOM 90489 O WAT 5203 51.029 47.415 117.553 1.00 0.00 O ATOM 90490 H1 WAT 5203 51.431 48.013 116.924 1.00 0.00 H ATOM 90491 H2 WAT 5203 51.628 47.414 118.300 1.00 0.00 H TER 90493 WAT 5203 ATOM 90493 O WAT 5204 35.106 35.321 155.540 1.00 0.00 O ATOM 90494 H1 WAT 5204 35.905 35.026 155.104 1.00 0.00 H ATOM 90495 H2 WAT 5204 35.196 35.013 156.441 1.00 0.00 H TER 90497 WAT 5204 ATOM 90497 O WAT 5205 52.720 39.651 102.552 1.00 0.00 O ATOM 90498 H1 WAT 5205 52.268 40.017 103.313 1.00 0.00 H ATOM 90499 H2 WAT 5205 53.548 39.321 102.901 1.00 0.00 H TER 90501 WAT 5205 ATOM 90501 O WAT 5206 6.180 67.475 18.263 1.00 0.00 O ATOM 90502 H1 WAT 5206 5.442 66.984 18.625 1.00 0.00 H ATOM 90503 H2 WAT 5206 6.826 67.492 18.970 1.00 0.00 H TER 90505 WAT 5206 ATOM 90505 O WAT 5207 90.992 31.594 116.005 1.00 0.00 O ATOM 90506 H1 WAT 5207 91.130 31.887 116.905 1.00 0.00 H ATOM 90507 H2 WAT 5207 90.438 32.270 115.615 1.00 0.00 H TER 90509 WAT 5207 ATOM 90509 O WAT 5208 28.932 52.874 99.416 1.00 0.00 O ATOM 90510 H1 WAT 5208 28.650 51.988 99.187 1.00 0.00 H ATOM 90511 H2 WAT 5208 28.388 53.446 98.873 1.00 0.00 H TER 90513 WAT 5208 ATOM 90513 O WAT 5209 19.755 127.280 87.418 1.00 0.00 O ATOM 90514 H1 WAT 5209 19.569 126.374 87.172 1.00 0.00 H ATOM 90515 H2 WAT 5209 18.960 127.759 87.185 1.00 0.00 H TER 90517 WAT 5209 ATOM 90517 O WAT 5210 96.139 6.905 16.626 1.00 0.00 O ATOM 90518 H1 WAT 5210 95.447 6.328 16.950 1.00 0.00 H ATOM 90519 H2 WAT 5210 96.467 6.467 15.840 1.00 0.00 H TER 90521 WAT 5210 ATOM 90521 O WAT 5211 132.851 42.981 57.891 1.00 0.00 O ATOM 90522 H1 WAT 5211 132.196 42.679 57.262 1.00 0.00 H ATOM 90523 H2 WAT 5211 132.354 43.159 58.689 1.00 0.00 H TER 90525 WAT 5211 ATOM 90525 O WAT 5212 111.399 34.190 137.156 1.00 0.00 O ATOM 90526 H1 WAT 5212 111.913 33.529 137.618 1.00 0.00 H ATOM 90527 H2 WAT 5212 111.295 34.900 137.790 1.00 0.00 H TER 90529 WAT 5212 ATOM 90529 O WAT 5213 66.113 18.641 27.025 1.00 0.00 O ATOM 90530 H1 WAT 5213 65.976 17.734 27.297 1.00 0.00 H ATOM 90531 H2 WAT 5213 67.061 18.721 26.925 1.00 0.00 H TER 90533 WAT 5213 ATOM 90533 O WAT 5214 91.426 138.964 128.527 1.00 0.00 O ATOM 90534 H1 WAT 5214 90.610 139.461 128.457 1.00 0.00 H ATOM 90535 H2 WAT 5214 91.534 138.812 129.466 1.00 0.00 H TER 90537 WAT 5214 ATOM 90537 O WAT 5215 8.675 35.694 152.231 1.00 0.00 O ATOM 90538 H1 WAT 5215 9.588 35.975 152.166 1.00 0.00 H ATOM 90539 H2 WAT 5215 8.452 35.813 153.154 1.00 0.00 H TER 90541 WAT 5215 ATOM 90541 O WAT 5216 76.011 52.177 135.143 1.00 0.00 O ATOM 90542 H1 WAT 5216 75.250 52.662 135.462 1.00 0.00 H ATOM 90543 H2 WAT 5216 76.756 52.745 135.340 1.00 0.00 H TER 90545 WAT 5216 ATOM 90545 O WAT 5217 73.143 82.828 77.769 1.00 0.00 O ATOM 90546 H1 WAT 5217 72.378 82.784 77.195 1.00 0.00 H ATOM 90547 H2 WAT 5217 73.769 83.373 77.293 1.00 0.00 H TER 90549 WAT 5217 ATOM 90549 O WAT 5218 140.369 26.853 154.696 1.00 0.00 O ATOM 90550 H1 WAT 5218 141.176 27.196 155.079 1.00 0.00 H ATOM 90551 H2 WAT 5218 140.273 27.331 153.872 1.00 0.00 H TER 90553 WAT 5218 ATOM 90553 O WAT 5219 78.852 110.469 156.616 1.00 0.00 O ATOM 90554 H1 WAT 5219 78.022 110.686 156.191 1.00 0.00 H ATOM 90555 H2 WAT 5219 78.879 109.512 156.614 1.00 0.00 H TER 90557 WAT 5219 ATOM 90557 O WAT 5220 14.847 7.314 126.953 1.00 0.00 O ATOM 90558 H1 WAT 5220 15.647 7.133 127.446 1.00 0.00 H ATOM 90559 H2 WAT 5220 14.681 8.245 127.100 1.00 0.00 H TER 90561 WAT 5220 ATOM 90561 O WAT 5221 86.458 79.435 110.263 1.00 0.00 O ATOM 90562 H1 WAT 5221 86.247 80.147 110.867 1.00 0.00 H ATOM 90563 H2 WAT 5221 86.730 79.877 109.458 1.00 0.00 H TER 90565 WAT 5221 ATOM 90565 O WAT 5222 123.026 45.900 138.076 1.00 0.00 O ATOM 90566 H1 WAT 5222 122.227 45.975 137.554 1.00 0.00 H ATOM 90567 H2 WAT 5222 123.554 46.655 137.816 1.00 0.00 H TER 90569 WAT 5222 ATOM 90569 O WAT 5223 89.705 92.951 88.488 1.00 0.00 O ATOM 90570 H1 WAT 5223 89.845 93.036 87.545 1.00 0.00 H ATOM 90571 H2 WAT 5223 89.440 93.826 88.771 1.00 0.00 H TER 90573 WAT 5223 ATOM 90573 O WAT 5224 55.619 96.545 131.903 1.00 0.00 O ATOM 90574 H1 WAT 5224 56.322 97.184 132.019 1.00 0.00 H ATOM 90575 H2 WAT 5224 55.477 96.514 130.957 1.00 0.00 H TER 90577 WAT 5224 ATOM 90577 O WAT 5225 104.480 23.849 101.582 1.00 0.00 O ATOM 90578 H1 WAT 5225 104.661 24.051 102.500 1.00 0.00 H ATOM 90579 H2 WAT 5225 105.077 24.413 101.091 1.00 0.00 H TER 90581 WAT 5225 ATOM 90581 O WAT 5226 70.570 65.065 113.008 1.00 0.00 O ATOM 90582 H1 WAT 5226 71.285 64.759 113.566 1.00 0.00 H ATOM 90583 H2 WAT 5226 69.851 64.459 113.185 1.00 0.00 H TER 90585 WAT 5226 ATOM 90585 O WAT 5227 105.167 79.137 131.758 1.00 0.00 O ATOM 90586 H1 WAT 5227 105.138 78.181 131.710 1.00 0.00 H ATOM 90587 H2 WAT 5227 104.279 79.415 131.532 1.00 0.00 H TER 90589 WAT 5227 ATOM 90589 O WAT 5228 99.762 50.160 124.402 1.00 0.00 O ATOM 90590 H1 WAT 5228 99.445 50.747 123.715 1.00 0.00 H ATOM 90591 H2 WAT 5228 99.116 50.240 125.103 1.00 0.00 H TER 90593 WAT 5228 ATOM 90593 O WAT 5229 116.384 136.239 96.424 1.00 0.00 O ATOM 90594 H1 WAT 5229 116.123 136.989 96.959 1.00 0.00 H ATOM 90595 H2 WAT 5229 115.571 135.757 96.273 1.00 0.00 H TER 90597 WAT 5229 ATOM 90597 O WAT 5230 60.842 95.453 79.838 1.00 0.00 O ATOM 90598 H1 WAT 5230 60.282 94.927 80.409 1.00 0.00 H ATOM 90599 H2 WAT 5230 60.620 95.164 78.953 1.00 0.00 H TER 90601 WAT 5230 ATOM 90601 O WAT 5231 117.150 32.785 62.371 1.00 0.00 O ATOM 90602 H1 WAT 5231 117.702 33.255 61.746 1.00 0.00 H ATOM 90603 H2 WAT 5231 117.113 31.891 62.032 1.00 0.00 H TER 90605 WAT 5231 ATOM 90605 O WAT 5232 69.331 113.822 71.837 1.00 0.00 O ATOM 90606 H1 WAT 5232 68.798 113.471 72.551 1.00 0.00 H ATOM 90607 H2 WAT 5232 69.947 114.415 72.268 1.00 0.00 H TER 90609 WAT 5232 ATOM 90609 O WAT 5233 88.300 65.636 99.079 1.00 0.00 O ATOM 90610 H1 WAT 5233 87.957 66.271 98.451 1.00 0.00 H ATOM 90611 H2 WAT 5233 89.251 65.721 99.010 1.00 0.00 H TER 90613 WAT 5233 ATOM 90613 O WAT 5234 79.420 141.443 58.791 1.00 0.00 O ATOM 90614 H1 WAT 5234 79.339 140.490 58.825 1.00 0.00 H ATOM 90615 H2 WAT 5234 80.314 141.596 58.484 1.00 0.00 H TER 90617 WAT 5234 ATOM 90617 O WAT 5235 82.026 31.016 78.170 1.00 0.00 O ATOM 90618 H1 WAT 5235 81.264 30.442 78.259 1.00 0.00 H ATOM 90619 H2 WAT 5235 82.436 31.005 79.034 1.00 0.00 H TER 90621 WAT 5235 ATOM 90621 O WAT 5236 63.972 110.699 6.375 1.00 0.00 O ATOM 90622 H1 WAT 5236 64.240 111.536 5.996 1.00 0.00 H ATOM 90623 H2 WAT 5236 63.671 110.921 7.256 1.00 0.00 H TER 90625 WAT 5236 ATOM 90625 O WAT 5237 20.115 94.676 132.714 1.00 0.00 O ATOM 90626 H1 WAT 5237 20.920 95.019 132.328 1.00 0.00 H ATOM 90627 H2 WAT 5237 19.717 94.156 132.016 1.00 0.00 H TER 90629 WAT 5237 ATOM 90629 O WAT 5238 88.574 82.264 117.897 1.00 0.00 O ATOM 90630 H1 WAT 5238 87.668 82.001 117.738 1.00 0.00 H ATOM 90631 H2 WAT 5238 88.597 82.496 118.826 1.00 0.00 H TER 90633 WAT 5238 ATOM 90633 O WAT 5239 137.912 61.559 107.397 1.00 0.00 O ATOM 90634 H1 WAT 5239 137.901 60.733 107.879 1.00 0.00 H ATOM 90635 H2 WAT 5239 138.671 61.489 106.817 1.00 0.00 H TER 90637 WAT 5239 ATOM 90637 O WAT 5240 14.742 113.464 120.337 1.00 0.00 O ATOM 90638 H1 WAT 5240 14.658 113.370 119.388 1.00 0.00 H ATOM 90639 H2 WAT 5240 15.424 114.125 120.453 1.00 0.00 H TER 90641 WAT 5240 ATOM 90641 O WAT 5241 144.375 97.302 8.706 1.00 0.00 O ATOM 90642 H1 WAT 5241 144.996 96.645 8.391 1.00 0.00 H ATOM 90643 H2 WAT 5241 144.166 97.824 7.932 1.00 0.00 H TER 90645 WAT 5241 ATOM 90645 O WAT 5242 57.304 26.199 81.466 1.00 0.00 O ATOM 90646 H1 WAT 5242 56.602 26.186 80.815 1.00 0.00 H ATOM 90647 H2 WAT 5242 57.970 25.609 81.112 1.00 0.00 H TER 90649 WAT 5242 ATOM 90649 O WAT 5243 55.001 28.796 77.533 1.00 0.00 O ATOM 90650 H1 WAT 5243 54.992 28.571 78.463 1.00 0.00 H ATOM 90651 H2 WAT 5243 55.050 27.953 77.083 1.00 0.00 H TER 90653 WAT 5243 ATOM 90653 O WAT 5244 113.776 35.044 26.263 1.00 0.00 O ATOM 90654 H1 WAT 5244 114.250 34.680 27.011 1.00 0.00 H ATOM 90655 H2 WAT 5244 114.458 35.238 25.620 1.00 0.00 H TER 90657 WAT 5244 ATOM 90657 O WAT 5245 136.109 121.040 156.011 1.00 0.00 O ATOM 90658 H1 WAT 5245 136.518 120.581 156.745 1.00 0.00 H ATOM 90659 H2 WAT 5245 136.001 121.939 156.321 1.00 0.00 H TER 90661 WAT 5245 ATOM 90661 O WAT 5246 139.830 132.643 4.478 1.00 0.00 O ATOM 90662 H1 WAT 5246 140.215 132.135 5.192 1.00 0.00 H ATOM 90663 H2 WAT 5246 139.509 131.985 3.861 1.00 0.00 H TER 90665 WAT 5246 ATOM 90665 O WAT 5247 35.978 116.403 114.836 1.00 0.00 O ATOM 90666 H1 WAT 5247 35.557 116.419 115.695 1.00 0.00 H ATOM 90667 H2 WAT 5247 35.522 117.077 114.333 1.00 0.00 H TER 90669 WAT 5247 ATOM 90669 O WAT 5248 74.079 91.565 158.302 1.00 0.00 O ATOM 90670 H1 WAT 5248 74.976 91.232 158.331 1.00 0.00 H ATOM 90671 H2 WAT 5248 73.795 91.566 159.216 1.00 0.00 H TER 90673 WAT 5248 ATOM 90673 O WAT 5249 109.266 19.796 152.052 1.00 0.00 O ATOM 90674 H1 WAT 5249 109.380 19.281 151.253 1.00 0.00 H ATOM 90675 H2 WAT 5249 108.392 20.177 151.970 1.00 0.00 H TER 90677 WAT 5249 ATOM 90677 O WAT 5250 0.882 0.955 122.490 1.00 0.00 O ATOM 90678 H1 WAT 5250 0.497 1.188 121.645 1.00 0.00 H ATOM 90679 H2 WAT 5250 1.513 0.265 122.284 1.00 0.00 H TER 90681 WAT 5250 ATOM 90681 O WAT 5251 55.932 45.923 152.914 1.00 0.00 O ATOM 90682 H1 WAT 5251 55.385 45.244 152.519 1.00 0.00 H ATOM 90683 H2 WAT 5251 55.890 46.654 152.296 1.00 0.00 H TER 90685 WAT 5251 ATOM 90685 O WAT 5252 71.148 3.577 123.946 1.00 0.00 O ATOM 90686 H1 WAT 5252 70.943 2.979 124.665 1.00 0.00 H ATOM 90687 H2 WAT 5252 71.032 3.050 123.155 1.00 0.00 H TER 90689 WAT 5252 ATOM 90689 O WAT 5253 128.881 53.193 91.241 1.00 0.00 O ATOM 90690 H1 WAT 5253 129.645 53.715 91.487 1.00 0.00 H ATOM 90691 H2 WAT 5253 128.185 53.836 91.106 1.00 0.00 H TER 90693 WAT 5253 ATOM 90693 O WAT 5254 89.727 87.234 158.952 1.00 0.00 O ATOM 90694 H1 WAT 5254 89.642 86.621 158.222 1.00 0.00 H ATOM 90695 H2 WAT 5254 89.405 88.066 158.605 1.00 0.00 H TER 90697 WAT 5254 ATOM 90697 O WAT 5255 47.369 58.183 89.806 1.00 0.00 O ATOM 90698 H1 WAT 5255 46.498 58.546 89.646 1.00 0.00 H ATOM 90699 H2 WAT 5255 47.375 57.977 90.741 1.00 0.00 H TER 90701 WAT 5255 ATOM 90701 O WAT 5256 61.882 81.971 87.751 1.00 0.00 O ATOM 90702 H1 WAT 5256 60.953 82.190 87.819 1.00 0.00 H ATOM 90703 H2 WAT 5256 61.944 81.082 88.102 1.00 0.00 H TER 90705 WAT 5256 ATOM 90705 O WAT 5257 16.720 -0.147 1.673 1.00 0.00 O ATOM 90706 H1 WAT 5257 16.442 0.082 2.560 1.00 0.00 H ATOM 90707 H2 WAT 5257 16.356 0.545 1.121 1.00 0.00 H TER 90709 WAT 5257 ATOM 90709 O WAT 5258 42.606 86.012 80.902 1.00 0.00 O ATOM 90710 H1 WAT 5258 41.937 85.554 81.411 1.00 0.00 H ATOM 90711 H2 WAT 5258 42.150 86.768 80.532 1.00 0.00 H TER 90713 WAT 5258 ATOM 90713 O WAT 5259 15.050 137.920 99.843 1.00 0.00 O ATOM 90714 H1 WAT 5259 15.986 137.728 99.798 1.00 0.00 H ATOM 90715 H2 WAT 5259 14.632 137.062 99.920 1.00 0.00 H TER 90717 WAT 5259 ATOM 90717 O WAT 5260 3.883 110.444 129.831 1.00 0.00 O ATOM 90718 H1 WAT 5260 3.527 111.304 129.611 1.00 0.00 H ATOM 90719 H2 WAT 5260 4.816 110.601 129.979 1.00 0.00 H TER 90721 WAT 5260 ATOM 90721 O WAT 5261 100.827 67.989 150.182 1.00 0.00 O ATOM 90722 H1 WAT 5261 101.306 67.972 151.011 1.00 0.00 H ATOM 90723 H2 WAT 5261 99.911 67.875 150.432 1.00 0.00 H TER 90725 WAT 5261 ATOM 90725 O WAT 5262 16.338 109.120 118.012 1.00 0.00 O ATOM 90726 H1 WAT 5262 16.663 109.787 117.407 1.00 0.00 H ATOM 90727 H2 WAT 5262 15.443 109.394 118.212 1.00 0.00 H TER 90729 WAT 5262 ATOM 90729 O WAT 5263 129.724 92.545 125.763 1.00 0.00 O ATOM 90730 H1 WAT 5263 129.681 91.604 125.933 1.00 0.00 H ATOM 90731 H2 WAT 5263 130.444 92.643 125.140 1.00 0.00 H TER 90733 WAT 5263 ATOM 90733 O WAT 5264 122.546 113.008 115.902 1.00 0.00 O ATOM 90734 H1 WAT 5264 121.975 112.376 116.339 1.00 0.00 H ATOM 90735 H2 WAT 5264 121.951 113.679 115.570 1.00 0.00 H TER 90737 WAT 5264 ATOM 90737 O WAT 5265 0.334 14.504 153.803 1.00 0.00 O ATOM 90738 H1 WAT 5265 0.506 14.689 152.880 1.00 0.00 H ATOM 90739 H2 WAT 5265 -0.480 14.971 153.993 1.00 0.00 H TER 90741 WAT 5265 ATOM 90741 O WAT 5266 112.324 48.409 93.056 1.00 0.00 O ATOM 90742 H1 WAT 5266 111.893 49.258 92.959 1.00 0.00 H ATOM 90743 H2 WAT 5266 112.649 48.407 93.957 1.00 0.00 H TER 90745 WAT 5266 ATOM 90745 O WAT 5267 52.529 122.751 54.262 1.00 0.00 O ATOM 90746 H1 WAT 5267 52.466 122.416 55.157 1.00 0.00 H ATOM 90747 H2 WAT 5267 51.681 123.164 54.101 1.00 0.00 H TER 90749 WAT 5267 ATOM 90749 O WAT 5268 26.647 40.852 134.299 1.00 0.00 O ATOM 90750 H1 WAT 5268 26.734 41.562 133.662 1.00 0.00 H ATOM 90751 H2 WAT 5268 26.460 41.295 135.127 1.00 0.00 H TER 90753 WAT 5268 ATOM 90753 O WAT 5269 80.187 36.772 71.931 1.00 0.00 O ATOM 90754 H1 WAT 5269 81.066 36.405 72.026 1.00 0.00 H ATOM 90755 H2 WAT 5269 80.099 36.942 70.993 1.00 0.00 H TER 90757 WAT 5269 ATOM 90757 O WAT 5270 63.212 137.086 5.235 1.00 0.00 O ATOM 90758 H1 WAT 5270 63.345 137.579 6.045 1.00 0.00 H ATOM 90759 H2 WAT 5270 63.411 136.180 5.471 1.00 0.00 H TER 90761 WAT 5270 ATOM 90761 O WAT 5271 114.255 46.052 134.249 1.00 0.00 O ATOM 90762 H1 WAT 5271 115.144 45.700 134.287 1.00 0.00 H ATOM 90763 H2 WAT 5271 114.148 46.336 133.341 1.00 0.00 H TER 90765 WAT 5271 ATOM 90765 O WAT 5272 4.790 17.341 109.391 1.00 0.00 O ATOM 90766 H1 WAT 5272 5.385 17.126 110.110 1.00 0.00 H ATOM 90767 H2 WAT 5272 5.187 18.105 108.973 1.00 0.00 H TER 90769 WAT 5272 ATOM 90769 O WAT 5273 37.382 116.872 127.130 1.00 0.00 O ATOM 90770 H1 WAT 5273 36.616 116.599 127.635 1.00 0.00 H ATOM 90771 H2 WAT 5273 38.027 117.125 127.790 1.00 0.00 H TER 90773 WAT 5273 ATOM 90773 O WAT 5274 113.145 68.917 156.225 1.00 0.00 O ATOM 90774 H1 WAT 5274 113.429 68.711 157.115 1.00 0.00 H ATOM 90775 H2 WAT 5274 112.600 69.698 156.322 1.00 0.00 H TER 90777 WAT 5274 ATOM 90777 O WAT 5275 20.117 132.086 155.241 1.00 0.00 O ATOM 90778 H1 WAT 5275 20.066 132.189 154.291 1.00 0.00 H ATOM 90779 H2 WAT 5275 19.254 131.756 155.493 1.00 0.00 H TER 90781 WAT 5275 ATOM 90781 O WAT 5276 95.286 126.725 9.208 1.00 0.00 O ATOM 90782 H1 WAT 5276 95.905 127.455 9.195 1.00 0.00 H ATOM 90783 H2 WAT 5276 95.807 125.965 8.946 1.00 0.00 H TER 90785 WAT 5276 ATOM 90785 O WAT 5277 101.942 141.254 110.732 1.00 0.00 O ATOM 90786 H1 WAT 5277 101.628 141.194 109.830 1.00 0.00 H ATOM 90787 H2 WAT 5277 101.337 140.707 111.232 1.00 0.00 H TER 90789 WAT 5277 ATOM 90789 O WAT 5278 121.564 125.404 148.832 1.00 0.00 O ATOM 90790 H1 WAT 5278 121.719 125.404 147.887 1.00 0.00 H ATOM 90791 H2 WAT 5278 120.941 124.692 148.973 1.00 0.00 H TER 90793 WAT 5278 ATOM 90793 O WAT 5279 6.136 103.504 72.271 1.00 0.00 O ATOM 90794 H1 WAT 5279 6.342 103.050 73.088 1.00 0.00 H ATOM 90795 H2 WAT 5279 5.337 103.994 72.463 1.00 0.00 H TER 90797 WAT 5279 ATOM 90797 O WAT 5280 90.155 37.787 71.516 1.00 0.00 O ATOM 90798 H1 WAT 5280 89.279 37.406 71.575 1.00 0.00 H ATOM 90799 H2 WAT 5280 90.657 37.155 71.002 1.00 0.00 H TER 90801 WAT 5280 ATOM 90801 O WAT 5281 9.971 74.914 148.002 1.00 0.00 O ATOM 90802 H1 WAT 5281 10.235 75.762 147.645 1.00 0.00 H ATOM 90803 H2 WAT 5281 9.676 75.110 148.891 1.00 0.00 H TER 90805 WAT 5281 ATOM 90805 O WAT 5282 5.788 15.851 91.103 1.00 0.00 O ATOM 90806 H1 WAT 5282 4.998 15.311 91.116 1.00 0.00 H ATOM 90807 H2 WAT 5282 6.438 15.313 90.651 1.00 0.00 H TER 90809 WAT 5282 ATOM 90809 O WAT 5283 65.104 5.845 114.359 1.00 0.00 O ATOM 90810 H1 WAT 5283 64.909 6.358 115.143 1.00 0.00 H ATOM 90811 H2 WAT 5283 64.520 6.200 113.689 1.00 0.00 H TER 90813 WAT 5283 ATOM 90813 O WAT 5284 14.748 19.392 78.746 1.00 0.00 O ATOM 90814 H1 WAT 5284 15.158 18.752 79.328 1.00 0.00 H ATOM 90815 H2 WAT 5284 15.431 19.612 78.112 1.00 0.00 H TER 90817 WAT 5284 ATOM 90817 O WAT 5285 90.515 72.562 140.996 1.00 0.00 O ATOM 90818 H1 WAT 5285 90.275 73.294 141.564 1.00 0.00 H ATOM 90819 H2 WAT 5285 90.498 72.929 140.113 1.00 0.00 H TER 90821 WAT 5285 ATOM 90821 O WAT 5286 34.591 51.589 6.899 1.00 0.00 O ATOM 90822 H1 WAT 5286 34.630 51.766 7.839 1.00 0.00 H ATOM 90823 H2 WAT 5286 35.470 51.793 6.580 1.00 0.00 H TER 90825 WAT 5286 ATOM 90825 O WAT 5287 126.800 37.261 3.995 1.00 0.00 O ATOM 90826 H1 WAT 5287 126.142 37.955 4.037 1.00 0.00 H ATOM 90827 H2 WAT 5287 126.532 36.722 3.250 1.00 0.00 H TER 90829 WAT 5287 ATOM 90829 O WAT 5288 119.798 78.726 121.159 1.00 0.00 O ATOM 90830 H1 WAT 5288 119.429 78.070 121.750 1.00 0.00 H ATOM 90831 H2 WAT 5288 119.045 79.244 120.876 1.00 0.00 H TER 90833 WAT 5288 ATOM 90833 O WAT 5289 24.838 98.571 148.426 1.00 0.00 O ATOM 90834 H1 WAT 5289 25.369 97.841 148.108 1.00 0.00 H ATOM 90835 H2 WAT 5289 25.077 98.656 149.349 1.00 0.00 H TER 90837 WAT 5289 ATOM 90837 O WAT 5290 92.125 64.556 22.609 1.00 0.00 O ATOM 90838 H1 WAT 5290 92.905 64.042 22.819 1.00 0.00 H ATOM 90839 H2 WAT 5290 91.665 64.035 21.950 1.00 0.00 H TER 90841 WAT 5290 ATOM 90841 O WAT 5291 50.175 39.497 66.476 1.00 0.00 O ATOM 90842 H1 WAT 5291 50.060 39.651 67.414 1.00 0.00 H ATOM 90843 H2 WAT 5291 49.685 40.204 66.055 1.00 0.00 H TER 90845 WAT 5291 ATOM 90845 O WAT 5292 133.253 79.803 158.507 1.00 0.00 O ATOM 90846 H1 WAT 5292 133.640 78.946 158.331 1.00 0.00 H ATOM 90847 H2 WAT 5292 134.000 80.366 158.711 1.00 0.00 H TER 90849 WAT 5292 ATOM 90849 O WAT 5293 128.232 45.244 116.021 1.00 0.00 O ATOM 90850 H1 WAT 5293 128.681 46.049 116.277 1.00 0.00 H ATOM 90851 H2 WAT 5293 128.742 44.910 115.283 1.00 0.00 H TER 90853 WAT 5293 ATOM 90853 O WAT 5294 68.627 46.161 152.185 1.00 0.00 O ATOM 90854 H1 WAT 5294 68.199 46.888 151.732 1.00 0.00 H ATOM 90855 H2 WAT 5294 67.907 45.596 152.465 1.00 0.00 H TER 90857 WAT 5294 ATOM 90857 O WAT 5295 15.089 134.174 132.987 1.00 0.00 O ATOM 90858 H1 WAT 5295 15.724 133.982 133.677 1.00 0.00 H ATOM 90859 H2 WAT 5295 15.235 133.493 132.331 1.00 0.00 H TER 90861 WAT 5295 ATOM 90861 O WAT 5296 46.333 67.555 132.177 1.00 0.00 O ATOM 90862 H1 WAT 5296 45.638 67.190 131.629 1.00 0.00 H ATOM 90863 H2 WAT 5296 46.475 66.894 132.855 1.00 0.00 H TER 90865 WAT 5296 ATOM 90865 O WAT 5297 8.063 70.520 108.936 1.00 0.00 O ATOM 90866 H1 WAT 5297 7.899 69.586 108.804 1.00 0.00 H ATOM 90867 H2 WAT 5297 7.196 70.924 108.891 1.00 0.00 H TER 90869 WAT 5297 ATOM 90869 O WAT 5298 109.547 50.765 154.701 1.00 0.00 O ATOM 90870 H1 WAT 5298 109.384 51.343 153.956 1.00 0.00 H ATOM 90871 H2 WAT 5298 109.597 49.889 154.319 1.00 0.00 H TER 90873 WAT 5298 ATOM 90873 O WAT 5299 136.994 15.376 152.910 1.00 0.00 O ATOM 90874 H1 WAT 5299 137.340 16.011 153.537 1.00 0.00 H ATOM 90875 H2 WAT 5299 137.657 15.333 152.221 1.00 0.00 H TER 90877 WAT 5299 ATOM 90877 O WAT 5300 13.711 12.750 153.455 1.00 0.00 O ATOM 90878 H1 WAT 5300 12.787 12.955 153.602 1.00 0.00 H ATOM 90879 H2 WAT 5300 14.186 13.435 153.925 1.00 0.00 H TER 90881 WAT 5300 ATOM 90881 O WAT 5301 52.368 110.997 89.770 1.00 0.00 O ATOM 90882 H1 WAT 5301 52.515 111.852 90.175 1.00 0.00 H ATOM 90883 H2 WAT 5301 51.418 110.882 89.792 1.00 0.00 H TER 90885 WAT 5301 ATOM 90885 O WAT 5302 7.445 128.578 13.161 1.00 0.00 O ATOM 90886 H1 WAT 5302 7.997 128.226 13.859 1.00 0.00 H ATOM 90887 H2 WAT 5302 7.791 129.456 13.001 1.00 0.00 H TER 90889 WAT 5302 ATOM 90889 O WAT 5303 102.126 33.757 80.337 1.00 0.00 O ATOM 90890 H1 WAT 5303 102.458 32.860 80.377 1.00 0.00 H ATOM 90891 H2 WAT 5303 102.670 34.185 79.677 1.00 0.00 H TER 90893 WAT 5303 ATOM 90893 O WAT 5304 138.050 99.482 93.501 1.00 0.00 O ATOM 90894 H1 WAT 5304 137.590 100.281 93.758 1.00 0.00 H ATOM 90895 H2 WAT 5304 138.976 99.724 93.517 1.00 0.00 H TER 90897 WAT 5304 ATOM 90897 O WAT 5305 62.652 28.995 3.970 1.00 0.00 O ATOM 90898 H1 WAT 5305 62.971 28.353 4.604 1.00 0.00 H ATOM 90899 H2 WAT 5305 62.738 29.837 4.417 1.00 0.00 H TER 90901 WAT 5305 ATOM 90901 O WAT 5306 29.788 134.474 139.443 1.00 0.00 O ATOM 90902 H1 WAT 5306 30.503 135.010 139.787 1.00 0.00 H ATOM 90903 H2 WAT 5306 29.602 134.848 138.582 1.00 0.00 H TER 90905 WAT 5306 ATOM 90905 O WAT 5307 49.249 39.926 108.316 1.00 0.00 O ATOM 90906 H1 WAT 5307 48.647 40.484 107.823 1.00 0.00 H ATOM 90907 H2 WAT 5307 48.848 39.848 109.181 1.00 0.00 H TER 90909 WAT 5307 ATOM 90909 O WAT 5308 60.196 125.579 137.109 1.00 0.00 O ATOM 90910 H1 WAT 5308 59.911 124.820 136.600 1.00 0.00 H ATOM 90911 H2 WAT 5308 61.126 125.669 136.904 1.00 0.00 H TER 90913 WAT 5308 ATOM 90913 O WAT 5309 64.063 135.440 147.857 1.00 0.00 O ATOM 90914 H1 WAT 5309 64.989 135.500 147.623 1.00 0.00 H ATOM 90915 H2 WAT 5309 63.675 134.905 147.165 1.00 0.00 H TER 90917 WAT 5309 ATOM 90917 O WAT 5310 119.780 129.209 61.335 1.00 0.00 O ATOM 90918 H1 WAT 5310 119.099 128.673 60.931 1.00 0.00 H ATOM 90919 H2 WAT 5310 120.601 128.787 61.080 1.00 0.00 H TER 90921 WAT 5310 ATOM 90921 O WAT 5311 24.013 114.652 4.978 1.00 0.00 O ATOM 90922 H1 WAT 5311 24.000 114.327 4.078 1.00 0.00 H ATOM 90923 H2 WAT 5311 24.936 114.834 5.153 1.00 0.00 H TER 90925 WAT 5311 ATOM 90925 O WAT 5312 68.293 133.553 83.135 1.00 0.00 O ATOM 90926 H1 WAT 5312 68.897 134.234 82.838 1.00 0.00 H ATOM 90927 H2 WAT 5312 67.740 133.989 83.782 1.00 0.00 H TER 90929 WAT 5312 ATOM 90929 O WAT 5313 54.668 102.896 123.590 1.00 0.00 O ATOM 90930 H1 WAT 5313 54.827 102.420 122.774 1.00 0.00 H ATOM 90931 H2 WAT 5313 53.929 103.471 123.392 1.00 0.00 H TER 90933 WAT 5313 ATOM 90933 O WAT 5314 12.489 102.879 133.639 1.00 0.00 O ATOM 90934 H1 WAT 5314 13.043 102.538 132.936 1.00 0.00 H ATOM 90935 H2 WAT 5314 13.092 103.360 134.206 1.00 0.00 H TER 90937 WAT 5314 ATOM 90937 O WAT 5315 62.981 46.018 102.605 1.00 0.00 O ATOM 90938 H1 WAT 5315 63.838 45.668 102.848 1.00 0.00 H ATOM 90939 H2 WAT 5315 63.126 46.958 102.500 1.00 0.00 H TER 90941 WAT 5315 ATOM 90941 O WAT 5316 34.381 8.912 3.245 1.00 0.00 O ATOM 90942 H1 WAT 5316 34.376 9.753 2.789 1.00 0.00 H ATOM 90943 H2 WAT 5316 35.188 8.923 3.759 1.00 0.00 H TER 90945 WAT 5316 ATOM 90945 O WAT 5317 12.916 115.567 94.027 1.00 0.00 O ATOM 90946 H1 WAT 5317 12.528 115.274 94.851 1.00 0.00 H ATOM 90947 H2 WAT 5317 13.168 116.476 94.190 1.00 0.00 H TER 90949 WAT 5317 ATOM 90949 O WAT 5318 143.550 53.067 65.123 1.00 0.00 O ATOM 90950 H1 WAT 5318 143.685 53.084 64.176 1.00 0.00 H ATOM 90951 H2 WAT 5318 143.631 52.143 65.361 1.00 0.00 H TER 90953 WAT 5318 ATOM 90953 O WAT 5319 132.138 67.231 5.439 1.00 0.00 O ATOM 90954 H1 WAT 5319 131.552 67.815 4.958 1.00 0.00 H ATOM 90955 H2 WAT 5319 132.274 66.490 4.848 1.00 0.00 H TER 90957 WAT 5319 ATOM 90957 O WAT 5320 105.652 101.217 79.335 1.00 0.00 O ATOM 90958 H1 WAT 5320 105.133 101.189 78.531 1.00 0.00 H ATOM 90959 H2 WAT 5320 106.045 102.090 79.336 1.00 0.00 H TER 90961 WAT 5320 ATOM 90961 O WAT 5321 71.244 77.843 19.958 1.00 0.00 O ATOM 90962 H1 WAT 5321 70.536 78.426 19.683 1.00 0.00 H ATOM 90963 H2 WAT 5321 71.288 77.950 20.908 1.00 0.00 H TER 90965 WAT 5321 ATOM 90965 O WAT 5322 76.020 92.169 62.592 1.00 0.00 O ATOM 90966 H1 WAT 5322 76.647 91.885 61.927 1.00 0.00 H ATOM 90967 H2 WAT 5322 75.168 92.108 62.160 1.00 0.00 H TER 90969 WAT 5322 ATOM 90969 O WAT 5323 101.367 15.794 130.290 1.00 0.00 O ATOM 90970 H1 WAT 5323 101.421 16.713 130.548 1.00 0.00 H ATOM 90971 H2 WAT 5323 100.428 15.606 130.268 1.00 0.00 H TER 90973 WAT 5323 ATOM 90973 O WAT 5324 84.404 72.745 112.532 1.00 0.00 O ATOM 90974 H1 WAT 5324 83.650 73.204 112.901 1.00 0.00 H ATOM 90975 H2 WAT 5324 84.619 73.236 111.739 1.00 0.00 H TER 90977 WAT 5324 ATOM 90977 O WAT 5325 129.679 114.140 118.403 1.00 0.00 O ATOM 90978 H1 WAT 5325 130.447 114.074 118.971 1.00 0.00 H ATOM 90979 H2 WAT 5325 128.995 114.502 118.967 1.00 0.00 H TER 90981 WAT 5325 ATOM 90981 O WAT 5326 43.770 126.844 6.832 1.00 0.00 O ATOM 90982 H1 WAT 5326 44.015 125.923 6.921 1.00 0.00 H ATOM 90983 H2 WAT 5326 43.038 126.957 7.439 1.00 0.00 H TER 90985 WAT 5326 ATOM 90985 O WAT 5327 56.420 13.044 141.603 1.00 0.00 O ATOM 90986 H1 WAT 5327 55.586 12.608 141.779 1.00 0.00 H ATOM 90987 H2 WAT 5327 57.020 12.685 142.256 1.00 0.00 H TER 90989 WAT 5327 ATOM 90989 O WAT 5328 130.735 75.822 79.235 1.00 0.00 O ATOM 90990 H1 WAT 5328 130.822 74.869 79.241 1.00 0.00 H ATOM 90991 H2 WAT 5328 130.451 76.031 78.345 1.00 0.00 H TER 90993 WAT 5328 ATOM 90993 O WAT 5329 85.987 135.068 66.039 1.00 0.00 O ATOM 90994 H1 WAT 5329 85.583 135.931 65.950 1.00 0.00 H ATOM 90995 H2 WAT 5329 85.293 134.453 65.801 1.00 0.00 H TER 90997 WAT 5329 ATOM 90997 O WAT 5330 52.719 41.136 12.410 1.00 0.00 O ATOM 90998 H1 WAT 5330 53.118 40.417 12.900 1.00 0.00 H ATOM 90999 H2 WAT 5330 52.668 41.855 13.040 1.00 0.00 H TER 91001 WAT 5330 ATOM 91001 O WAT 5331 20.602 104.655 61.754 1.00 0.00 O ATOM 91002 H1 WAT 5331 20.741 103.719 61.899 1.00 0.00 H ATOM 91003 H2 WAT 5331 21.143 104.861 60.991 1.00 0.00 H TER 91005 WAT 5331 ATOM 91005 O WAT 5332 29.475 84.344 156.775 1.00 0.00 O ATOM 91006 H1 WAT 5332 30.190 84.208 156.153 1.00 0.00 H ATOM 91007 H2 WAT 5332 28.738 83.861 156.402 1.00 0.00 H TER 91009 WAT 5332 ATOM 91009 O WAT 5333 141.760 84.860 70.213 1.00 0.00 O ATOM 91010 H1 WAT 5333 142.712 84.935 70.271 1.00 0.00 H ATOM 91011 H2 WAT 5333 141.484 85.653 69.752 1.00 0.00 H TER 91013 WAT 5333 ATOM 91013 O WAT 5334 41.605 20.716 152.074 1.00 0.00 O ATOM 91014 H1 WAT 5334 41.088 19.986 152.414 1.00 0.00 H ATOM 91015 H2 WAT 5334 41.556 20.622 151.123 1.00 0.00 H TER 91017 WAT 5334 ATOM 91017 O WAT 5335 105.908 130.812 70.331 1.00 0.00 O ATOM 91018 H1 WAT 5335 106.710 131.328 70.412 1.00 0.00 H ATOM 91019 H2 WAT 5335 105.208 131.418 70.573 1.00 0.00 H TER 91021 WAT 5335 ATOM 91021 O WAT 5336 66.931 36.390 131.277 1.00 0.00 O ATOM 91022 H1 WAT 5336 66.924 37.260 131.675 1.00 0.00 H ATOM 91023 H2 WAT 5336 67.083 35.792 132.009 1.00 0.00 H TER 91025 WAT 5336 ATOM 91025 O WAT 5337 42.218 89.683 126.777 1.00 0.00 O ATOM 91026 H1 WAT 5337 41.389 89.365 127.135 1.00 0.00 H ATOM 91027 H2 WAT 5337 41.989 90.501 126.335 1.00 0.00 H TER 91029 WAT 5337 ATOM 91029 O WAT 5338 48.708 37.454 123.093 1.00 0.00 O ATOM 91030 H1 WAT 5338 48.367 38.049 122.425 1.00 0.00 H ATOM 91031 H2 WAT 5338 48.056 36.755 123.145 1.00 0.00 H TER 91033 WAT 5338 ATOM 91033 O WAT 5339 108.104 110.175 147.045 1.00 0.00 O ATOM 91034 H1 WAT 5339 108.916 110.068 146.549 1.00 0.00 H ATOM 91035 H2 WAT 5339 108.275 109.740 147.881 1.00 0.00 H TER 91037 WAT 5339 ATOM 91037 O WAT 5340 32.298 43.546 20.002 1.00 0.00 O ATOM 91038 H1 WAT 5340 31.932 44.318 19.570 1.00 0.00 H ATOM 91039 H2 WAT 5340 31.661 43.329 20.683 1.00 0.00 H TER 91041 WAT 5340 ATOM 91041 O WAT 5341 99.546 96.068 97.188 1.00 0.00 O ATOM 91042 H1 WAT 5341 98.931 96.227 97.904 1.00 0.00 H ATOM 91043 H2 WAT 5341 100.359 95.811 97.624 1.00 0.00 H TER 91045 WAT 5341 ATOM 91045 O WAT 5342 68.331 108.104 92.301 1.00 0.00 O ATOM 91046 H1 WAT 5342 68.659 108.327 93.172 1.00 0.00 H ATOM 91047 H2 WAT 5342 67.431 108.432 92.292 1.00 0.00 H TER 91049 WAT 5342 ATOM 91049 O WAT 5343 107.541 141.520 102.073 1.00 0.00 O ATOM 91050 H1 WAT 5343 106.612 141.351 102.231 1.00 0.00 H ATOM 91051 H2 WAT 5343 107.844 140.754 101.586 1.00 0.00 H TER 91053 WAT 5343 ATOM 91053 O WAT 5344 90.330 82.282 3.838 1.00 0.00 O ATOM 91054 H1 WAT 5344 89.541 82.498 4.335 1.00 0.00 H ATOM 91055 H2 WAT 5344 90.873 83.069 3.897 1.00 0.00 H TER 91057 WAT 5344 ATOM 91057 O WAT 5345 135.717 21.685 85.570 1.00 0.00 O ATOM 91058 H1 WAT 5345 136.519 21.850 86.064 1.00 0.00 H ATOM 91059 H2 WAT 5345 135.213 21.087 86.122 1.00 0.00 H TER 91061 WAT 5345 ATOM 91061 O WAT 5346 29.221 48.902 84.886 1.00 0.00 O ATOM 91062 H1 WAT 5346 29.406 48.166 84.303 1.00 0.00 H ATOM 91063 H2 WAT 5346 28.847 48.500 85.670 1.00 0.00 H TER 91065 WAT 5346 ATOM 91065 O WAT 5347 74.562 30.641 100.526 1.00 0.00 O ATOM 91066 H1 WAT 5347 74.145 31.487 100.358 1.00 0.00 H ATOM 91067 H2 WAT 5347 75.480 30.855 100.689 1.00 0.00 H TER 91069 WAT 5347 ATOM 91069 O WAT 5348 73.160 13.709 62.250 1.00 0.00 O ATOM 91070 H1 WAT 5348 73.332 14.522 62.724 1.00 0.00 H ATOM 91071 H2 WAT 5348 73.885 13.636 61.629 1.00 0.00 H TER 91073 WAT 5348 ATOM 91073 O WAT 5349 66.853 105.125 82.125 1.00 0.00 O ATOM 91074 H1 WAT 5349 66.997 105.139 81.179 1.00 0.00 H ATOM 91075 H2 WAT 5349 65.962 104.790 82.227 1.00 0.00 H TER 91077 WAT 5349 ATOM 91077 O WAT 5350 34.544 36.909 120.456 1.00 0.00 O ATOM 91078 H1 WAT 5350 35.186 37.519 120.820 1.00 0.00 H ATOM 91079 H2 WAT 5350 35.037 36.394 119.818 1.00 0.00 H TER 91081 WAT 5350 ATOM 91081 O WAT 5351 97.297 0.780 77.319 1.00 0.00 O ATOM 91082 H1 WAT 5351 98.116 1.124 76.962 1.00 0.00 H ATOM 91083 H2 WAT 5351 96.682 0.817 76.586 1.00 0.00 H TER 91085 WAT 5351 ATOM 91085 O WAT 5352 60.890 41.951 92.056 1.00 0.00 O ATOM 91086 H1 WAT 5352 61.279 41.175 92.460 1.00 0.00 H ATOM 91087 H2 WAT 5352 61.124 41.881 91.130 1.00 0.00 H TER 91089 WAT 5352 ATOM 91089 O WAT 5353 41.714 54.608 87.789 1.00 0.00 O ATOM 91090 H1 WAT 5353 41.249 53.817 87.516 1.00 0.00 H ATOM 91091 H2 WAT 5353 42.587 54.301 88.031 1.00 0.00 H TER 91093 WAT 5353 ATOM 91093 O WAT 5354 3.011 140.540 116.707 1.00 0.00 O ATOM 91094 H1 WAT 5354 3.505 139.783 117.022 1.00 0.00 H ATOM 91095 H2 WAT 5354 2.994 141.142 117.451 1.00 0.00 H TER 91097 WAT 5354 ATOM 91097 O WAT 5355 94.181 56.144 109.005 1.00 0.00 O ATOM 91098 H1 WAT 5355 94.469 55.757 108.178 1.00 0.00 H ATOM 91099 H2 WAT 5355 93.318 56.510 108.810 1.00 0.00 H TER 91101 WAT 5355 ATOM 91101 O WAT 5356 48.499 116.897 129.690 1.00 0.00 O ATOM 91102 H1 WAT 5356 48.652 116.232 129.019 1.00 0.00 H ATOM 91103 H2 WAT 5356 48.569 117.729 129.222 1.00 0.00 H TER 91105 WAT 5356 ATOM 91105 O WAT 5357 20.191 106.429 7.342 1.00 0.00 O ATOM 91106 H1 WAT 5357 20.317 106.885 8.174 1.00 0.00 H ATOM 91107 H2 WAT 5357 19.269 106.570 7.128 1.00 0.00 H TER 91109 WAT 5357 ATOM 91109 O WAT 5358 58.634 84.003 142.545 1.00 0.00 O ATOM 91110 H1 WAT 5358 59.350 83.758 141.958 1.00 0.00 H ATOM 91111 H2 WAT 5358 58.761 84.940 142.700 1.00 0.00 H TER 91113 WAT 5358 ATOM 91113 O WAT 5359 45.696 88.790 63.753 1.00 0.00 O ATOM 91114 H1 WAT 5359 45.301 89.451 64.321 1.00 0.00 H ATOM 91115 H2 WAT 5359 46.600 89.082 63.637 1.00 0.00 H TER 91117 WAT 5359 ATOM 91117 O WAT 5360 76.654 34.323 0.132 1.00 0.00 O ATOM 91118 H1 WAT 5360 76.930 34.722 0.957 1.00 0.00 H ATOM 91119 H2 WAT 5360 76.854 33.393 0.237 1.00 0.00 H TER 91121 WAT 5360 ATOM 91121 O WAT 5361 111.989 69.968 127.531 1.00 0.00 O ATOM 91122 H1 WAT 5361 112.304 70.325 128.362 1.00 0.00 H ATOM 91123 H2 WAT 5361 111.537 70.700 127.112 1.00 0.00 H TER 91125 WAT 5361 ATOM 91125 O WAT 5362 11.509 22.567 155.837 1.00 0.00 O ATOM 91126 H1 WAT 5362 12.276 22.309 156.347 1.00 0.00 H ATOM 91127 H2 WAT 5362 11.380 21.849 155.218 1.00 0.00 H TER 91129 WAT 5362 ATOM 91129 O WAT 5363 103.378 74.427 137.844 1.00 0.00 O ATOM 91130 H1 WAT 5363 103.900 73.638 137.993 1.00 0.00 H ATOM 91131 H2 WAT 5363 102.472 74.118 137.844 1.00 0.00 H TER 91133 WAT 5363 ATOM 91133 O WAT 5364 142.350 36.550 2.946 1.00 0.00 O ATOM 91134 H1 WAT 5364 143.183 36.523 3.419 1.00 0.00 H ATOM 91135 H2 WAT 5364 142.441 37.288 2.343 1.00 0.00 H TER 91137 WAT 5364 ATOM 91137 O WAT 5365 32.117 125.769 89.300 1.00 0.00 O ATOM 91138 H1 WAT 5365 31.967 126.567 89.807 1.00 0.00 H ATOM 91139 H2 WAT 5365 32.972 125.902 88.891 1.00 0.00 H TER 91141 WAT 5365 ATOM 91141 O WAT 5366 1.879 24.155 14.309 1.00 0.00 O ATOM 91142 H1 WAT 5366 2.180 24.506 15.148 1.00 0.00 H ATOM 91143 H2 WAT 5366 1.029 24.572 14.167 1.00 0.00 H TER 91145 WAT 5366 ATOM 91145 O WAT 5367 122.407 10.440 88.259 1.00 0.00 O ATOM 91146 H1 WAT 5367 121.612 9.906 88.272 1.00 0.00 H ATOM 91147 H2 WAT 5367 122.382 10.885 87.412 1.00 0.00 H TER 91149 WAT 5367 ATOM 91149 O WAT 5368 22.761 101.562 142.416 1.00 0.00 O ATOM 91150 H1 WAT 5368 23.497 101.894 141.902 1.00 0.00 H ATOM 91151 H2 WAT 5368 22.030 102.137 142.186 1.00 0.00 H TER 91153 WAT 5368 ATOM 91153 O WAT 5369 31.707 38.538 68.506 1.00 0.00 O ATOM 91154 H1 WAT 5369 31.976 37.747 68.039 1.00 0.00 H ATOM 91155 H2 WAT 5369 31.169 39.017 67.876 1.00 0.00 H TER 91157 WAT 5369 ATOM 91157 O WAT 5370 25.241 98.373 74.698 1.00 0.00 O ATOM 91158 H1 WAT 5370 25.712 98.038 73.935 1.00 0.00 H ATOM 91159 H2 WAT 5370 24.632 97.672 74.930 1.00 0.00 H TER 91161 WAT 5370 ATOM 91161 O WAT 5371 115.450 129.848 91.679 1.00 0.00 O ATOM 91162 H1 WAT 5371 115.771 130.215 92.503 1.00 0.00 H ATOM 91163 H2 WAT 5371 116.169 129.980 91.062 1.00 0.00 H TER 91165 WAT 5371 ATOM 91165 O WAT 5372 72.329 47.274 143.363 1.00 0.00 O ATOM 91166 H1 WAT 5372 72.817 46.594 142.897 1.00 0.00 H ATOM 91167 H2 WAT 5372 72.931 47.578 144.042 1.00 0.00 H TER 91169 WAT 5372 ATOM 91169 O WAT 5373 89.275 97.675 116.476 1.00 0.00 O ATOM 91170 H1 WAT 5373 88.639 98.351 116.713 1.00 0.00 H ATOM 91171 H2 WAT 5373 89.466 97.839 115.553 1.00 0.00 H TER 91173 WAT 5373 ATOM 91173 O WAT 5374 139.538 22.398 156.008 1.00 0.00 O ATOM 91174 H1 WAT 5374 138.667 22.029 156.158 1.00 0.00 H ATOM 91175 H2 WAT 5374 140.008 22.242 156.827 1.00 0.00 H TER 91177 WAT 5374 ATOM 91177 O WAT 5375 100.477 120.101 12.776 1.00 0.00 O ATOM 91178 H1 WAT 5375 101.238 119.769 12.300 1.00 0.00 H ATOM 91179 H2 WAT 5375 100.517 121.050 12.659 1.00 0.00 H TER 91181 WAT 5375 ATOM 91181 O WAT 5376 35.380 140.517 1.304 1.00 0.00 O ATOM 91182 H1 WAT 5376 34.745 141.217 1.154 1.00 0.00 H ATOM 91183 H2 WAT 5376 34.861 139.713 1.278 1.00 0.00 H TER 91185 WAT 5376 ATOM 91185 O WAT 5377 115.403 134.482 14.368 1.00 0.00 O ATOM 91186 H1 WAT 5377 115.024 135.012 13.667 1.00 0.00 H ATOM 91187 H2 WAT 5377 115.389 133.588 14.026 1.00 0.00 H TER 91189 WAT 5377 ATOM 91189 O WAT 5378 15.855 118.330 82.899 1.00 0.00 O ATOM 91190 H1 WAT 5378 15.918 118.127 83.832 1.00 0.00 H ATOM 91191 H2 WAT 5378 14.917 118.436 82.740 1.00 0.00 H TER 91193 WAT 5378 ATOM 91193 O WAT 5379 95.172 128.864 91.665 1.00 0.00 O ATOM 91194 H1 WAT 5379 95.883 128.229 91.578 1.00 0.00 H ATOM 91195 H2 WAT 5379 94.674 128.778 90.853 1.00 0.00 H TER 91197 WAT 5379 ATOM 91197 O WAT 5380 112.868 137.024 67.965 1.00 0.00 O ATOM 91198 H1 WAT 5380 112.767 137.974 68.023 1.00 0.00 H ATOM 91199 H2 WAT 5380 111.992 136.679 68.140 1.00 0.00 H TER 91201 WAT 5380 ATOM 91201 O WAT 5381 119.653 52.512 19.835 1.00 0.00 O ATOM 91202 H1 WAT 5381 118.836 52.061 20.048 1.00 0.00 H ATOM 91203 H2 WAT 5381 119.494 53.424 20.078 1.00 0.00 H TER 91205 WAT 5381 ATOM 91205 O WAT 5382 18.274 106.874 113.522 1.00 0.00 O ATOM 91206 H1 WAT 5382 18.181 106.328 114.303 1.00 0.00 H ATOM 91207 H2 WAT 5382 19.187 106.759 113.256 1.00 0.00 H TER 91209 WAT 5382 ATOM 91209 O WAT 5383 128.179 67.649 110.089 1.00 0.00 O ATOM 91210 H1 WAT 5383 128.985 67.744 109.583 1.00 0.00 H ATOM 91211 H2 WAT 5383 128.393 68.006 110.951 1.00 0.00 H TER 91213 WAT 5383 ATOM 91213 O WAT 5384 102.462 15.464 95.851 1.00 0.00 O ATOM 91214 H1 WAT 5384 102.279 14.696 95.311 1.00 0.00 H ATOM 91215 H2 WAT 5384 103.220 15.874 95.434 1.00 0.00 H TER 91217 WAT 5384 ATOM 91217 O WAT 5385 87.627 28.149 80.869 1.00 0.00 O ATOM 91218 H1 WAT 5385 87.190 27.306 80.991 1.00 0.00 H ATOM 91219 H2 WAT 5385 88.380 28.116 81.459 1.00 0.00 H TER 91221 WAT 5385 ATOM 91221 O WAT 5386 120.459 5.189 18.287 1.00 0.00 O ATOM 91222 H1 WAT 5386 120.399 4.583 19.026 1.00 0.00 H ATOM 91223 H2 WAT 5386 121.352 5.531 18.329 1.00 0.00 H TER 91225 WAT 5386 ATOM 91225 O WAT 5387 102.022 55.784 15.856 1.00 0.00 O ATOM 91226 H1 WAT 5387 101.128 56.126 15.868 1.00 0.00 H ATOM 91227 H2 WAT 5387 102.096 55.278 16.665 1.00 0.00 H TER 91229 WAT 5387 ATOM 91229 O WAT 5388 2.127 127.698 73.973 1.00 0.00 O ATOM 91230 H1 WAT 5388 2.784 127.803 73.284 1.00 0.00 H ATOM 91231 H2 WAT 5388 1.832 128.589 74.161 1.00 0.00 H TER 91233 WAT 5388 ATOM 91233 O WAT 5389 129.610 114.564 93.645 1.00 0.00 O ATOM 91234 H1 WAT 5389 130.513 114.586 93.328 1.00 0.00 H ATOM 91235 H2 WAT 5389 129.081 114.769 92.874 1.00 0.00 H TER 91237 WAT 5389 ATOM 91237 O WAT 5390 29.365 16.165 151.026 1.00 0.00 O ATOM 91238 H1 WAT 5390 30.039 16.135 151.705 1.00 0.00 H ATOM 91239 H2 WAT 5390 29.492 15.357 150.527 1.00 0.00 H TER 91241 WAT 5390 ATOM 91241 O WAT 5391 1.650 71.858 122.468 1.00 0.00 O ATOM 91242 H1 WAT 5391 2.327 71.658 121.821 1.00 0.00 H ATOM 91243 H2 WAT 5391 1.818 71.248 123.186 1.00 0.00 H TER 91245 WAT 5391 ATOM 91245 O WAT 5392 9.106 32.685 20.614 1.00 0.00 O ATOM 91246 H1 WAT 5392 9.775 32.422 21.246 1.00 0.00 H ATOM 91247 H2 WAT 5392 8.727 31.860 20.310 1.00 0.00 H TER 91249 WAT 5392 ATOM 91249 O WAT 5393 42.820 62.676 65.455 1.00 0.00 O ATOM 91250 H1 WAT 5393 42.258 62.364 64.746 1.00 0.00 H ATOM 91251 H2 WAT 5393 42.244 62.715 66.219 1.00 0.00 H TER 91253 WAT 5393 ATOM 91253 O WAT 5394 133.920 41.512 157.992 1.00 0.00 O ATOM 91254 H1 WAT 5394 133.533 41.034 158.725 1.00 0.00 H ATOM 91255 H2 WAT 5394 134.438 42.204 158.404 1.00 0.00 H TER 91257 WAT 5394 ATOM 91257 O WAT 5395 142.157 50.705 78.117 1.00 0.00 O ATOM 91258 H1 WAT 5395 141.356 50.198 77.989 1.00 0.00 H ATOM 91259 H2 WAT 5395 141.981 51.542 77.687 1.00 0.00 H TER 91261 WAT 5395 ATOM 91261 O WAT 5396 91.861 34.336 27.651 1.00 0.00 O ATOM 91262 H1 WAT 5396 92.531 35.017 27.700 1.00 0.00 H ATOM 91263 H2 WAT 5396 91.923 34.002 26.756 1.00 0.00 H TER 91265 WAT 5396 ATOM 91265 O WAT 5397 124.790 28.604 67.800 1.00 0.00 O ATOM 91266 H1 WAT 5397 124.158 29.321 67.751 1.00 0.00 H ATOM 91267 H2 WAT 5397 125.626 29.005 67.564 1.00 0.00 H TER 91269 WAT 5397 ATOM 91269 O WAT 5398 9.208 123.725 71.141 1.00 0.00 O ATOM 91270 H1 WAT 5398 8.661 124.455 70.853 1.00 0.00 H ATOM 91271 H2 WAT 5398 10.089 124.095 71.199 1.00 0.00 H TER 91273 WAT 5398 ATOM 91273 O WAT 5399 128.694 20.490 136.322 1.00 0.00 O ATOM 91274 H1 WAT 5399 128.704 19.534 136.270 1.00 0.00 H ATOM 91275 H2 WAT 5399 128.480 20.776 135.434 1.00 0.00 H TER 91277 WAT 5399 ATOM 91277 O WAT 5400 37.614 99.441 104.830 1.00 0.00 O ATOM 91278 H1 WAT 5400 37.271 100.225 104.402 1.00 0.00 H ATOM 91279 H2 WAT 5400 38.033 99.767 105.627 1.00 0.00 H TER 91281 WAT 5400 ATOM 91281 O WAT 5401 124.593 76.412 124.641 1.00 0.00 O ATOM 91282 H1 WAT 5401 124.479 75.874 123.857 1.00 0.00 H ATOM 91283 H2 WAT 5401 124.336 75.840 125.364 1.00 0.00 H TER 91285 WAT 5401 ATOM 91285 O WAT 5402 84.638 101.937 156.513 1.00 0.00 O ATOM 91286 H1 WAT 5402 84.475 102.090 157.444 1.00 0.00 H ATOM 91287 H2 WAT 5402 84.442 101.009 156.385 1.00 0.00 H TER 91289 WAT 5402 ATOM 91289 O WAT 5403 0.123 15.818 4.235 1.00 0.00 O ATOM 91290 H1 WAT 5403 0.459 15.109 4.782 1.00 0.00 H ATOM 91291 H2 WAT 5403 -0.428 15.380 3.586 1.00 0.00 H TER 91293 WAT 5403 ATOM 91293 O WAT 5404 13.644 42.276 73.268 1.00 0.00 O ATOM 91294 H1 WAT 5404 14.092 43.089 73.034 1.00 0.00 H ATOM 91295 H2 WAT 5404 13.940 42.086 74.158 1.00 0.00 H TER 91297 WAT 5404 ATOM 91297 O WAT 5405 134.692 88.051 88.109 1.00 0.00 O ATOM 91298 H1 WAT 5405 134.567 88.958 88.387 1.00 0.00 H ATOM 91299 H2 WAT 5405 134.557 87.536 88.905 1.00 0.00 H TER 91301 WAT 5405 ATOM 91301 O WAT 5406 143.216 102.628 134.815 1.00 0.00 O ATOM 91302 H1 WAT 5406 142.603 102.663 134.080 1.00 0.00 H ATOM 91303 H2 WAT 5406 144.081 102.663 134.407 1.00 0.00 H TER 91305 WAT 5406 ATOM 91305 O WAT 5407 40.028 57.746 95.995 1.00 0.00 O ATOM 91306 H1 WAT 5407 39.658 56.887 96.199 1.00 0.00 H ATOM 91307 H2 WAT 5407 40.549 57.972 96.766 1.00 0.00 H TER 91309 WAT 5407 ATOM 91309 O WAT 5408 60.131 113.210 134.448 1.00 0.00 O ATOM 91310 H1 WAT 5408 60.136 113.565 133.559 1.00 0.00 H ATOM 91311 H2 WAT 5408 59.342 113.577 134.847 1.00 0.00 H TER 91313 WAT 5408 ATOM 91313 O WAT 5409 49.203 119.344 63.733 1.00 0.00 O ATOM 91314 H1 WAT 5409 48.449 119.186 64.301 1.00 0.00 H ATOM 91315 H2 WAT 5409 49.720 120.000 64.199 1.00 0.00 H TER 91317 WAT 5409 ATOM 91317 O WAT 5410 79.508 38.893 59.901 1.00 0.00 O ATOM 91318 H1 WAT 5410 80.126 39.563 59.608 1.00 0.00 H ATOM 91319 H2 WAT 5410 78.651 39.315 59.840 1.00 0.00 H TER 91321 WAT 5410 ATOM 91321 O WAT 5411 110.070 89.729 144.527 1.00 0.00 O ATOM 91322 H1 WAT 5411 110.030 89.824 143.575 1.00 0.00 H ATOM 91323 H2 WAT 5411 110.826 90.254 144.788 1.00 0.00 H TER 91325 WAT 5411 ATOM 91325 O WAT 5412 26.565 15.478 4.711 1.00 0.00 O ATOM 91326 H1 WAT 5412 25.823 15.144 4.207 1.00 0.00 H ATOM 91327 H2 WAT 5412 26.777 14.772 5.322 1.00 0.00 H TER 91329 WAT 5412 ATOM 91329 O WAT 5413 91.828 110.415 19.194 1.00 0.00 O ATOM 91330 H1 WAT 5413 92.651 110.366 19.680 1.00 0.00 H ATOM 91331 H2 WAT 5413 91.814 109.618 18.665 1.00 0.00 H TER 91333 WAT 5413 ATOM 91333 O WAT 5414 64.422 135.913 94.294 1.00 0.00 O ATOM 91334 H1 WAT 5414 63.667 135.448 94.654 1.00 0.00 H ATOM 91335 H2 WAT 5414 64.175 136.107 93.390 1.00 0.00 H TER 91337 WAT 5414 ATOM 91337 O WAT 5415 81.220 140.093 112.001 1.00 0.00 O ATOM 91338 H1 WAT 5415 80.342 140.053 112.381 1.00 0.00 H ATOM 91339 H2 WAT 5415 81.213 140.889 111.468 1.00 0.00 H TER 91341 WAT 5415 ATOM 91341 O WAT 5416 48.502 29.512 62.398 1.00 0.00 O ATOM 91342 H1 WAT 5416 49.418 29.565 62.673 1.00 0.00 H ATOM 91343 H2 WAT 5416 48.532 29.071 61.549 1.00 0.00 H TER 91345 WAT 5416 ATOM 91345 O WAT 5417 36.783 18.701 156.728 1.00 0.00 O ATOM 91346 H1 WAT 5417 36.429 18.208 157.468 1.00 0.00 H ATOM 91347 H2 WAT 5417 36.330 18.343 155.964 1.00 0.00 H TER 91349 WAT 5417 ATOM 91349 O WAT 5418 134.742 144.014 120.982 1.00 0.00 O ATOM 91350 H1 WAT 5418 134.326 143.263 121.406 1.00 0.00 H ATOM 91351 H2 WAT 5418 135.003 144.583 121.707 1.00 0.00 H TER 91353 WAT 5418 ATOM 91353 O WAT 5419 42.738 105.425 116.588 1.00 0.00 O ATOM 91354 H1 WAT 5419 43.610 105.609 116.935 1.00 0.00 H ATOM 91355 H2 WAT 5419 42.275 106.261 116.648 1.00 0.00 H TER 91357 WAT 5419 ATOM 91357 O WAT 5420 132.572 97.438 124.275 1.00 0.00 O ATOM 91358 H1 WAT 5420 132.906 97.288 123.391 1.00 0.00 H ATOM 91359 H2 WAT 5420 131.914 96.754 124.402 1.00 0.00 H TER 91361 WAT 5420 ATOM 91361 O WAT 5421 74.026 144.862 142.819 1.00 0.00 O ATOM 91362 H1 WAT 5421 74.237 145.338 143.623 1.00 0.00 H ATOM 91363 H2 WAT 5421 74.394 143.989 142.954 1.00 0.00 H TER 91365 WAT 5421 ATOM 91365 O WAT 5422 53.428 26.098 54.528 1.00 0.00 O ATOM 91366 H1 WAT 5422 54.311 25.746 54.417 1.00 0.00 H ATOM 91367 H2 WAT 5422 53.532 26.815 55.153 1.00 0.00 H TER 91369 WAT 5422 ATOM 91369 O WAT 5423 94.026 4.491 155.956 1.00 0.00 O ATOM 91370 H1 WAT 5423 93.895 5.025 155.172 1.00 0.00 H ATOM 91371 H2 WAT 5423 93.164 4.119 156.139 1.00 0.00 H TER 91373 WAT 5423 ATOM 91373 O WAT 5424 51.259 71.535 122.138 1.00 0.00 O ATOM 91374 H1 WAT 5424 51.291 72.408 121.746 1.00 0.00 H ATOM 91375 H2 WAT 5424 52.143 71.186 122.018 1.00 0.00 H TER 91377 WAT 5424 ATOM 91377 O WAT 5425 47.412 123.788 71.708 1.00 0.00 O ATOM 91378 H1 WAT 5425 47.874 122.955 71.620 1.00 0.00 H ATOM 91379 H2 WAT 5425 48.078 124.452 71.526 1.00 0.00 H TER 91381 WAT 5425 ATOM 91381 O WAT 5426 0.641 66.023 136.396 1.00 0.00 O ATOM 91382 H1 WAT 5426 0.623 65.073 136.508 1.00 0.00 H ATOM 91383 H2 WAT 5426 -0.197 66.322 136.750 1.00 0.00 H TER 91385 WAT 5426 ATOM 91385 O WAT 5427 24.055 23.746 97.342 1.00 0.00 O ATOM 91386 H1 WAT 5427 23.212 23.304 97.239 1.00 0.00 H ATOM 91387 H2 WAT 5427 24.086 24.373 96.618 1.00 0.00 H TER 91389 WAT 5427 ATOM 91389 O WAT 5428 48.655 142.847 99.218 1.00 0.00 O ATOM 91390 H1 WAT 5428 48.588 143.726 99.591 1.00 0.00 H ATOM 91391 H2 WAT 5428 48.525 142.260 99.963 1.00 0.00 H TER 91393 WAT 5428 ATOM 91393 O WAT 5429 119.611 129.730 128.698 1.00 0.00 O ATOM 91394 H1 WAT 5429 120.183 129.120 129.163 1.00 0.00 H ATOM 91395 H2 WAT 5429 118.813 129.229 128.528 1.00 0.00 H TER 91397 WAT 5429 ATOM 91397 O WAT 5430 135.140 29.136 140.230 1.00 0.00 O ATOM 91398 H1 WAT 5430 135.726 29.108 140.986 1.00 0.00 H ATOM 91399 H2 WAT 5430 135.727 29.192 139.475 1.00 0.00 H TER 91401 WAT 5430 ATOM 91401 O WAT 5431 1.350 132.821 103.523 1.00 0.00 O ATOM 91402 H1 WAT 5431 2.159 132.495 103.918 1.00 0.00 H ATOM 91403 H2 WAT 5431 1.601 133.070 102.633 1.00 0.00 H TER 91405 WAT 5431 ATOM 91405 O WAT 5432 7.963 117.437 67.374 1.00 0.00 O ATOM 91406 H1 WAT 5432 8.435 117.891 66.677 1.00 0.00 H ATOM 91407 H2 WAT 5432 8.522 117.536 68.145 1.00 0.00 H TER 91409 WAT 5432 ATOM 91409 O WAT 5433 142.498 109.893 124.299 1.00 0.00 O ATOM 91410 H1 WAT 5433 142.692 110.138 123.394 1.00 0.00 H ATOM 91411 H2 WAT 5433 142.157 110.695 124.696 1.00 0.00 H TER 91413 WAT 5433 ATOM 91413 O WAT 5434 51.832 120.432 103.336 1.00 0.00 O ATOM 91414 H1 WAT 5434 51.625 121.364 103.261 1.00 0.00 H ATOM 91415 H2 WAT 5434 52.759 120.412 103.574 1.00 0.00 H TER 91417 WAT 5434 ATOM 91417 O WAT 5435 3.391 95.086 116.261 1.00 0.00 O ATOM 91418 H1 WAT 5435 2.543 94.979 115.829 1.00 0.00 H ATOM 91419 H2 WAT 5435 3.970 94.474 115.808 1.00 0.00 H TER 91421 WAT 5435 ATOM 91421 O WAT 5436 140.580 78.715 143.401 1.00 0.00 O ATOM 91422 H1 WAT 5436 141.302 78.338 143.904 1.00 0.00 H ATOM 91423 H2 WAT 5436 140.314 79.484 143.905 1.00 0.00 H TER 91425 WAT 5436 ATOM 91425 O WAT 5437 53.520 29.018 117.555 1.00 0.00 O ATOM 91426 H1 WAT 5437 54.259 29.170 116.967 1.00 0.00 H ATOM 91427 H2 WAT 5437 52.891 29.704 117.331 1.00 0.00 H TER 91429 WAT 5437 ATOM 91429 O WAT 5438 112.349 128.543 0.047 1.00 0.00 O ATOM 91430 H1 WAT 5438 112.742 127.875 0.608 1.00 0.00 H ATOM 91431 H2 WAT 5438 111.813 129.069 0.641 1.00 0.00 H TER 91433 WAT 5438 ATOM 91433 O WAT 5439 87.700 76.777 120.359 1.00 0.00 O ATOM 91434 H1 WAT 5439 87.929 77.677 120.591 1.00 0.00 H ATOM 91435 H2 WAT 5439 87.666 76.315 121.196 1.00 0.00 H TER 91437 WAT 5439 ATOM 91437 O WAT 5440 138.492 78.170 131.202 1.00 0.00 O ATOM 91438 H1 WAT 5440 139.031 78.945 131.044 1.00 0.00 H ATOM 91439 H2 WAT 5440 138.320 77.816 130.329 1.00 0.00 H TER 91441 WAT 5440 ATOM 91441 O WAT 5441 143.197 7.358 97.289 1.00 0.00 O ATOM 91442 H1 WAT 5441 143.702 6.545 97.261 1.00 0.00 H ATOM 91443 H2 WAT 5441 143.735 7.957 97.807 1.00 0.00 H TER 91445 WAT 5441 ATOM 91445 O WAT 5442 13.091 78.039 122.938 1.00 0.00 O ATOM 91446 H1 WAT 5442 12.578 78.796 122.654 1.00 0.00 H ATOM 91447 H2 WAT 5442 13.974 78.384 123.068 1.00 0.00 H TER 91449 WAT 5442 ATOM 91449 O WAT 5443 85.595 144.572 70.290 1.00 0.00 O ATOM 91450 H1 WAT 5443 85.818 145.391 69.849 1.00 0.00 H ATOM 91451 H2 WAT 5443 84.638 144.556 70.296 1.00 0.00 H TER 91453 WAT 5443 ATOM 91453 O WAT 5444 43.935 8.516 71.544 1.00 0.00 O ATOM 91454 H1 WAT 5444 43.696 9.389 71.855 1.00 0.00 H ATOM 91455 H2 WAT 5444 44.891 8.503 71.577 1.00 0.00 H TER 91457 WAT 5444 ATOM 91457 O WAT 5445 10.639 29.455 151.944 1.00 0.00 O ATOM 91458 H1 WAT 5445 11.307 29.541 151.264 1.00 0.00 H ATOM 91459 H2 WAT 5445 11.077 29.732 152.748 1.00 0.00 H TER 91461 WAT 5445 ATOM 91461 O WAT 5446 69.414 99.685 92.389 1.00 0.00 O ATOM 91462 H1 WAT 5446 68.994 100.414 92.844 1.00 0.00 H ATOM 91463 H2 WAT 5446 70.251 99.571 92.839 1.00 0.00 H TER 91465 WAT 5446 ATOM 91465 O WAT 5447 91.156 113.934 12.481 1.00 0.00 O ATOM 91466 H1 WAT 5447 92.044 113.719 12.196 1.00 0.00 H ATOM 91467 H2 WAT 5447 90.595 113.337 11.986 1.00 0.00 H TER 91469 WAT 5447 ATOM 91469 O WAT 5448 100.892 128.653 87.773 1.00 0.00 O ATOM 91470 H1 WAT 5448 101.180 129.565 87.733 1.00 0.00 H ATOM 91471 H2 WAT 5448 100.059 128.686 88.244 1.00 0.00 H TER 91473 WAT 5448 ATOM 91473 O WAT 5449 111.270 138.384 58.560 1.00 0.00 O ATOM 91474 H1 WAT 5449 111.816 138.936 58.000 1.00 0.00 H ATOM 91475 H2 WAT 5449 111.056 137.627 58.015 1.00 0.00 H TER 91477 WAT 5449 ATOM 91477 O WAT 5450 20.901 88.772 131.652 1.00 0.00 O ATOM 91478 H1 WAT 5450 21.740 88.643 132.095 1.00 0.00 H ATOM 91479 H2 WAT 5450 20.288 88.216 132.133 1.00 0.00 H TER 91481 WAT 5450 ATOM 91481 O WAT 5451 67.374 78.685 87.771 1.00 0.00 O ATOM 91482 H1 WAT 5451 66.719 78.589 87.079 1.00 0.00 H ATOM 91483 H2 WAT 5451 67.268 79.586 88.077 1.00 0.00 H TER 91485 WAT 5451 ATOM 91485 O WAT 5452 89.701 134.361 102.440 1.00 0.00 O ATOM 91486 H1 WAT 5452 90.283 134.709 103.115 1.00 0.00 H ATOM 91487 H2 WAT 5452 88.847 134.301 102.867 1.00 0.00 H TER 91489 WAT 5452 ATOM 91489 O WAT 5453 1.234 38.661 71.454 1.00 0.00 O ATOM 91490 H1 WAT 5453 2.174 38.496 71.519 1.00 0.00 H ATOM 91491 H2 WAT 5453 1.160 39.386 70.834 1.00 0.00 H TER 91493 WAT 5453 ATOM 91493 O WAT 5454 120.156 23.546 94.867 1.00 0.00 O ATOM 91494 H1 WAT 5454 120.917 24.022 95.198 1.00 0.00 H ATOM 91495 H2 WAT 5454 120.456 23.156 94.046 1.00 0.00 H TER 91497 WAT 5454 ATOM 91497 O WAT 5455 65.983 118.377 59.790 1.00 0.00 O ATOM 91498 H1 WAT 5455 65.315 118.568 59.131 1.00 0.00 H ATOM 91499 H2 WAT 5455 66.806 118.366 59.300 1.00 0.00 H TER 91501 WAT 5455 ATOM 91501 O WAT 5456 74.720 97.196 96.079 1.00 0.00 O ATOM 91502 H1 WAT 5456 74.710 96.957 95.152 1.00 0.00 H ATOM 91503 H2 WAT 5456 75.513 97.722 96.182 1.00 0.00 H TER 91505 WAT 5456 ATOM 91505 O WAT 5457 20.040 30.347 144.586 1.00 0.00 O ATOM 91506 H1 WAT 5457 19.891 30.825 143.770 1.00 0.00 H ATOM 91507 H2 WAT 5457 20.042 29.425 144.327 1.00 0.00 H TER 91509 WAT 5457 ATOM 91509 O WAT 5458 125.614 21.571 133.696 1.00 0.00 O ATOM 91510 H1 WAT 5458 125.113 21.319 132.920 1.00 0.00 H ATOM 91511 H2 WAT 5458 125.737 22.516 133.605 1.00 0.00 H TER 91513 WAT 5458 ATOM 91513 O WAT 5459 121.381 22.442 106.241 1.00 0.00 O ATOM 91514 H1 WAT 5459 122.003 22.742 105.578 1.00 0.00 H ATOM 91515 H2 WAT 5459 120.556 22.867 106.005 1.00 0.00 H TER 91517 WAT 5459 ATOM 91517 O WAT 5460 82.614 79.663 94.735 1.00 0.00 O ATOM 91518 H1 WAT 5460 82.353 80.571 94.890 1.00 0.00 H ATOM 91519 H2 WAT 5460 83.197 79.454 95.465 1.00 0.00 H TER 91521 WAT 5460 ATOM 91521 O WAT 5461 65.806 125.662 139.469 1.00 0.00 O ATOM 91522 H1 WAT 5461 65.827 125.378 138.556 1.00 0.00 H ATOM 91523 H2 WAT 5461 66.721 125.636 139.749 1.00 0.00 H TER 91525 WAT 5461 ATOM 91525 O WAT 5462 138.542 83.123 14.305 1.00 0.00 O ATOM 91526 H1 WAT 5462 138.918 82.912 15.160 1.00 0.00 H ATOM 91527 H2 WAT 5462 139.288 83.421 13.783 1.00 0.00 H TER 91529 WAT 5462 ATOM 91529 O WAT 5463 132.486 119.476 94.085 1.00 0.00 O ATOM 91530 H1 WAT 5463 131.749 119.996 94.406 1.00 0.00 H ATOM 91531 H2 WAT 5463 132.469 118.681 94.618 1.00 0.00 H TER 91533 WAT 5463 ATOM 91533 O WAT 5464 5.769 102.852 144.165 1.00 0.00 O ATOM 91534 H1 WAT 5464 5.606 102.537 143.276 1.00 0.00 H ATOM 91535 H2 WAT 5464 5.042 102.502 144.679 1.00 0.00 H TER 91537 WAT 5464 ATOM 91537 O WAT 5465 87.235 72.003 5.606 1.00 0.00 O ATOM 91538 H1 WAT 5465 86.616 72.639 5.248 1.00 0.00 H ATOM 91539 H2 WAT 5465 86.722 71.499 6.239 1.00 0.00 H TER 91541 WAT 5465 ATOM 91541 O WAT 5466 94.090 60.795 135.825 1.00 0.00 O ATOM 91542 H1 WAT 5466 93.886 59.915 136.142 1.00 0.00 H ATOM 91543 H2 WAT 5466 93.415 61.352 136.214 1.00 0.00 H TER 91545 WAT 5466 ATOM 91545 O WAT 5467 32.417 105.008 15.147 1.00 0.00 O ATOM 91546 H1 WAT 5467 33.371 105.035 15.081 1.00 0.00 H ATOM 91547 H2 WAT 5467 32.127 105.841 14.775 1.00 0.00 H TER 91549 WAT 5467 ATOM 91549 O WAT 5468 56.672 109.595 147.031 1.00 0.00 O ATOM 91550 H1 WAT 5468 56.830 109.780 147.956 1.00 0.00 H ATOM 91551 H2 WAT 5468 56.154 110.339 146.722 1.00 0.00 H TER 91553 WAT 5468 ATOM 91553 O WAT 5469 140.408 3.972 136.322 1.00 0.00 O ATOM 91554 H1 WAT 5469 140.950 3.573 137.003 1.00 0.00 H ATOM 91555 H2 WAT 5469 139.540 4.044 136.718 1.00 0.00 H TER 91557 WAT 5469 ATOM 91557 O WAT 5470 110.632 121.204 106.478 1.00 0.00 O ATOM 91558 H1 WAT 5470 111.243 121.916 106.283 1.00 0.00 H ATOM 91559 H2 WAT 5470 111.027 120.746 107.220 1.00 0.00 H TER 91561 WAT 5470 ATOM 91561 O WAT 5471 113.890 35.455 76.891 1.00 0.00 O ATOM 91562 H1 WAT 5471 114.204 35.146 76.042 1.00 0.00 H ATOM 91563 H2 WAT 5471 113.389 36.245 76.688 1.00 0.00 H TER 91565 WAT 5471 ATOM 91565 O WAT 5472 125.846 77.194 150.401 1.00 0.00 O ATOM 91566 H1 WAT 5472 126.527 76.843 149.827 1.00 0.00 H ATOM 91567 H2 WAT 5472 125.405 76.419 150.750 1.00 0.00 H TER 91569 WAT 5472 ATOM 91569 O WAT 5473 113.313 94.103 22.997 1.00 0.00 O ATOM 91570 H1 WAT 5473 112.436 93.762 23.171 1.00 0.00 H ATOM 91571 H2 WAT 5473 113.478 94.719 23.711 1.00 0.00 H TER 91573 WAT 5473 ATOM 91573 O WAT 5474 9.962 49.544 124.248 1.00 0.00 O ATOM 91574 H1 WAT 5474 10.301 49.445 123.359 1.00 0.00 H ATOM 91575 H2 WAT 5474 9.079 49.177 124.210 1.00 0.00 H TER 91577 WAT 5474 ATOM 91577 O WAT 5475 74.705 89.161 122.461 1.00 0.00 O ATOM 91578 H1 WAT 5475 74.810 88.336 122.934 1.00 0.00 H ATOM 91579 H2 WAT 5475 73.881 89.060 121.983 1.00 0.00 H TER 91581 WAT 5475 ATOM 91581 O WAT 5476 62.032 31.697 114.007 1.00 0.00 O ATOM 91582 H1 WAT 5476 62.516 32.114 113.294 1.00 0.00 H ATOM 91583 H2 WAT 5476 61.308 32.297 114.187 1.00 0.00 H TER 91585 WAT 5476 ATOM 91585 O WAT 5477 2.719 45.943 123.130 1.00 0.00 O ATOM 91586 H1 WAT 5477 2.464 45.791 124.040 1.00 0.00 H ATOM 91587 H2 WAT 5477 3.331 46.677 123.172 1.00 0.00 H TER 91589 WAT 5477 ATOM 91589 O WAT 5478 140.230 21.176 15.831 1.00 0.00 O ATOM 91590 H1 WAT 5478 140.127 20.938 14.909 1.00 0.00 H ATOM 91591 H2 WAT 5478 140.675 22.024 15.811 1.00 0.00 H TER 91593 WAT 5478 ATOM 91593 O WAT 5479 34.585 126.147 88.337 1.00 0.00 O ATOM 91594 H1 WAT 5479 34.685 125.260 88.681 1.00 0.00 H ATOM 91595 H2 WAT 5479 35.472 126.412 88.094 1.00 0.00 H TER 91597 WAT 5479 ATOM 91597 O WAT 5480 107.970 57.156 109.792 1.00 0.00 O ATOM 91598 H1 WAT 5480 107.842 56.986 108.859 1.00 0.00 H ATOM 91599 H2 WAT 5480 108.635 56.522 110.062 1.00 0.00 H TER 91601 WAT 5480 ATOM 91601 O WAT 5481 47.082 74.699 77.333 1.00 0.00 O ATOM 91602 H1 WAT 5481 46.793 74.447 76.456 1.00 0.00 H ATOM 91603 H2 WAT 5481 47.281 75.633 77.260 1.00 0.00 H TER 91605 WAT 5481 ATOM 91605 O WAT 5482 106.236 133.058 73.595 1.00 0.00 O ATOM 91606 H1 WAT 5482 106.985 133.567 73.906 1.00 0.00 H ATOM 91607 H2 WAT 5482 105.667 132.979 74.361 1.00 0.00 H TER 91609 WAT 5482 ATOM 91609 O WAT 5483 43.732 49.110 110.343 1.00 0.00 O ATOM 91610 H1 WAT 5483 44.490 48.891 109.801 1.00 0.00 H ATOM 91611 H2 WAT 5483 43.128 49.549 109.744 1.00 0.00 H TER 91613 WAT 5483 ATOM 91613 O WAT 5484 1.852 76.657 79.359 1.00 0.00 O ATOM 91614 H1 WAT 5484 2.051 77.007 78.490 1.00 0.00 H ATOM 91615 H2 WAT 5484 1.402 77.372 79.808 1.00 0.00 H TER 91617 WAT 5484 ATOM 91617 O WAT 5485 64.042 130.277 97.881 1.00 0.00 O ATOM 91618 H1 WAT 5485 64.155 129.364 98.144 1.00 0.00 H ATOM 91619 H2 WAT 5485 64.783 130.453 97.301 1.00 0.00 H TER 91621 WAT 5485 ATOM 91621 O WAT 5486 112.178 96.266 100.447 1.00 0.00 O ATOM 91622 H1 WAT 5486 112.341 97.136 100.083 1.00 0.00 H ATOM 91623 H2 WAT 5486 112.861 96.150 101.107 1.00 0.00 H TER 91625 WAT 5486 ATOM 91625 O WAT 5487 144.701 4.999 121.573 1.00 0.00 O ATOM 91626 H1 WAT 5487 144.822 5.920 121.805 1.00 0.00 H ATOM 91627 H2 WAT 5487 145.434 4.548 121.994 1.00 0.00 H TER 91629 WAT 5487 ATOM 91629 O WAT 5488 74.665 45.127 94.893 1.00 0.00 O ATOM 91630 H1 WAT 5488 73.779 45.287 94.568 1.00 0.00 H ATOM 91631 H2 WAT 5488 74.766 45.737 95.624 1.00 0.00 H TER 91633 WAT 5488 ATOM 91633 O WAT 5489 127.401 60.478 83.011 1.00 0.00 O ATOM 91634 H1 WAT 5489 127.874 61.275 82.771 1.00 0.00 H ATOM 91635 H2 WAT 5489 128.001 59.767 82.787 1.00 0.00 H TER 91637 WAT 5489 ATOM 91637 O WAT 5490 49.873 87.400 91.487 1.00 0.00 O ATOM 91638 H1 WAT 5490 49.876 87.852 92.330 1.00 0.00 H ATOM 91639 H2 WAT 5490 50.540 87.853 90.970 1.00 0.00 H TER 91641 WAT 5490 ATOM 91641 O WAT 5491 54.805 18.614 124.157 1.00 0.00 O ATOM 91642 H1 WAT 5491 55.136 17.726 124.292 1.00 0.00 H ATOM 91643 H2 WAT 5491 53.991 18.494 123.667 1.00 0.00 H TER 91645 WAT 5491 ATOM 91645 O WAT 5492 36.394 3.706 59.848 1.00 0.00 O ATOM 91646 H1 WAT 5492 37.290 3.722 59.513 1.00 0.00 H ATOM 91647 H2 WAT 5492 35.853 3.951 59.097 1.00 0.00 H TER 91649 WAT 5492 ATOM 91649 O WAT 5493 136.791 128.162 102.034 1.00 0.00 O ATOM 91650 H1 WAT 5493 137.717 128.406 102.059 1.00 0.00 H ATOM 91651 H2 WAT 5493 136.452 128.421 102.890 1.00 0.00 H TER 91653 WAT 5493 ATOM 91653 O WAT 5494 125.417 122.478 144.166 1.00 0.00 O ATOM 91654 H1 WAT 5494 124.633 121.942 144.285 1.00 0.00 H ATOM 91655 H2 WAT 5494 125.159 123.350 144.467 1.00 0.00 H TER 91657 WAT 5494 ATOM 91657 O WAT 5495 27.905 118.875 148.672 1.00 0.00 O ATOM 91658 H1 WAT 5495 28.468 119.620 148.881 1.00 0.00 H ATOM 91659 H2 WAT 5495 27.084 119.270 148.378 1.00 0.00 H TER 91661 WAT 5495 ATOM 91661 O WAT 5496 111.268 134.037 138.791 1.00 0.00 O ATOM 91662 H1 WAT 5496 110.963 134.785 138.278 1.00 0.00 H ATOM 91663 H2 WAT 5496 111.668 134.426 139.569 1.00 0.00 H TER 91665 WAT 5496 ATOM 91665 O WAT 5497 112.293 13.178 142.452 1.00 0.00 O ATOM 91666 H1 WAT 5497 113.164 13.401 142.783 1.00 0.00 H ATOM 91667 H2 WAT 5497 112.296 12.222 142.398 1.00 0.00 H TER 91669 WAT 5497 ATOM 91669 O WAT 5498 111.186 54.226 0.712 1.00 0.00 O ATOM 91670 H1 WAT 5498 110.297 54.500 0.935 1.00 0.00 H ATOM 91671 H2 WAT 5498 111.358 54.639 -0.135 1.00 0.00 H TER 91673 WAT 5498 ATOM 91673 O WAT 5499 33.600 32.310 90.538 1.00 0.00 O ATOM 91674 H1 WAT 5499 32.942 33.005 90.497 1.00 0.00 H ATOM 91675 H2 WAT 5499 34.093 32.495 91.337 1.00 0.00 H TER 91677 WAT 5499 ATOM 91677 O WAT 5500 134.334 30.416 76.612 1.00 0.00 O ATOM 91678 H1 WAT 5500 135.203 30.244 76.249 1.00 0.00 H ATOM 91679 H2 WAT 5500 134.141 29.646 77.147 1.00 0.00 H TER 91681 WAT 5500 ATOM 91681 O WAT 5501 39.032 84.870 92.207 1.00 0.00 O ATOM 91682 H1 WAT 5501 39.437 85.284 92.970 1.00 0.00 H ATOM 91683 H2 WAT 5501 39.507 85.230 91.459 1.00 0.00 H TER 91685 WAT 5501 ATOM 91685 O WAT 5502 37.274 111.276 18.684 1.00 0.00 O ATOM 91686 H1 WAT 5502 37.364 111.528 19.603 1.00 0.00 H ATOM 91687 H2 WAT 5502 37.305 110.319 18.693 1.00 0.00 H TER 91689 WAT 5502 ATOM 91689 O WAT 5503 29.835 97.780 132.695 1.00 0.00 O ATOM 91690 H1 WAT 5503 30.674 97.718 133.151 1.00 0.00 H ATOM 91691 H2 WAT 5503 29.305 97.077 133.070 1.00 0.00 H TER 91693 WAT 5503 ATOM 91693 O WAT 5504 111.548 130.557 75.010 1.00 0.00 O ATOM 91694 H1 WAT 5504 111.055 129.744 74.903 1.00 0.00 H ATOM 91695 H2 WAT 5504 112.248 130.501 74.360 1.00 0.00 H TER 91697 WAT 5504 ATOM 91697 O WAT 5505 24.763 7.579 140.834 1.00 0.00 O ATOM 91698 H1 WAT 5505 23.821 7.743 140.794 1.00 0.00 H ATOM 91699 H2 WAT 5505 24.837 6.632 140.951 1.00 0.00 H TER 91701 WAT 5505 ATOM 91701 O WAT 5506 40.803 58.203 156.134 1.00 0.00 O ATOM 91702 H1 WAT 5506 41.685 58.426 156.433 1.00 0.00 H ATOM 91703 H2 WAT 5506 40.781 57.246 156.144 1.00 0.00 H TER 91705 WAT 5506 ATOM 91705 O WAT 5507 26.747 2.313 124.715 1.00 0.00 O ATOM 91706 H1 WAT 5507 26.098 2.691 125.309 1.00 0.00 H ATOM 91707 H2 WAT 5507 27.403 1.925 125.294 1.00 0.00 H TER 91709 WAT 5507 ATOM 91709 O WAT 5508 12.803 30.703 125.411 1.00 0.00 O ATOM 91710 H1 WAT 5508 12.309 30.845 126.219 1.00 0.00 H ATOM 91711 H2 WAT 5508 13.053 31.581 125.125 1.00 0.00 H TER 91713 WAT 5508 ATOM 91713 O WAT 5509 144.849 74.741 134.423 1.00 0.00 O ATOM 91714 H1 WAT 5509 144.192 74.054 134.538 1.00 0.00 H ATOM 91715 H2 WAT 5509 145.481 74.367 133.809 1.00 0.00 H TER 91717 WAT 5509 ATOM 91717 O WAT 5510 138.962 112.895 80.115 1.00 0.00 O ATOM 91718 H1 WAT 5510 138.513 112.051 80.068 1.00 0.00 H ATOM 91719 H2 WAT 5510 138.400 113.493 79.621 1.00 0.00 H TER 91721 WAT 5510 ATOM 91721 O WAT 5511 40.259 77.464 15.138 1.00 0.00 O ATOM 91722 H1 WAT 5511 40.934 77.451 15.817 1.00 0.00 H ATOM 91723 H2 WAT 5511 40.448 76.698 14.596 1.00 0.00 H TER 91725 WAT 5511 ATOM 91725 O WAT 5512 73.283 41.781 81.985 1.00 0.00 O ATOM 91726 H1 WAT 5512 73.622 42.638 82.244 1.00 0.00 H ATOM 91727 H2 WAT 5512 72.343 41.919 81.876 1.00 0.00 H TER 91729 WAT 5512 ATOM 91729 O WAT 5513 48.596 137.945 102.779 1.00 0.00 O ATOM 91730 H1 WAT 5513 48.104 137.605 103.526 1.00 0.00 H ATOM 91731 H2 WAT 5513 49.169 137.224 102.521 1.00 0.00 H TER 91733 WAT 5513 ATOM 91733 O WAT 5514 111.131 29.763 19.772 1.00 0.00 O ATOM 91734 H1 WAT 5514 110.212 29.495 19.800 1.00 0.00 H ATOM 91735 H2 WAT 5514 111.273 30.035 18.865 1.00 0.00 H TER 91737 WAT 5514 ATOM 91737 O WAT 5515 40.380 68.462 0.736 1.00 0.00 O ATOM 91738 H1 WAT 5515 40.907 69.213 0.464 1.00 0.00 H ATOM 91739 H2 WAT 5515 39.478 68.784 0.722 1.00 0.00 H TER 91741 WAT 5515 ATOM 91741 O WAT 5516 45.585 39.339 2.346 1.00 0.00 O ATOM 91742 H1 WAT 5516 45.970 40.143 1.997 1.00 0.00 H ATOM 91743 H2 WAT 5516 45.045 39.002 1.631 1.00 0.00 H TER 91745 WAT 5516 ATOM 91745 O WAT 5517 53.414 108.345 7.550 1.00 0.00 O ATOM 91746 H1 WAT 5517 53.821 107.938 8.315 1.00 0.00 H ATOM 91747 H2 WAT 5517 52.597 107.862 7.428 1.00 0.00 H TER 91749 WAT 5517 ATOM 91749 O WAT 5518 41.121 95.352 104.604 1.00 0.00 O ATOM 91750 H1 WAT 5518 41.604 95.543 103.801 1.00 0.00 H ATOM 91751 H2 WAT 5518 41.206 94.405 104.716 1.00 0.00 H TER 91753 WAT 5518 ATOM 91753 O WAT 5519 36.395 60.804 22.103 1.00 0.00 O ATOM 91754 H1 WAT 5519 37.052 60.924 22.788 1.00 0.00 H ATOM 91755 H2 WAT 5519 36.349 59.856 21.979 1.00 0.00 H TER 91757 WAT 5519 ATOM 91757 O WAT 5520 73.567 48.264 131.797 1.00 0.00 O ATOM 91758 H1 WAT 5520 73.627 47.376 132.150 1.00 0.00 H ATOM 91759 H2 WAT 5520 74.287 48.737 132.215 1.00 0.00 H TER 91761 WAT 5520 ATOM 91761 O WAT 5521 133.836 114.031 122.554 1.00 0.00 O ATOM 91762 H1 WAT 5521 134.720 113.868 122.881 1.00 0.00 H ATOM 91763 H2 WAT 5521 133.765 114.985 122.522 1.00 0.00 H TER 91765 WAT 5521 ATOM 91765 O WAT 5522 111.648 107.723 157.714 1.00 0.00 O ATOM 91766 H1 WAT 5522 111.340 108.413 157.127 1.00 0.00 H ATOM 91767 H2 WAT 5522 112.509 107.483 157.371 1.00 0.00 H TER 91769 WAT 5522 ATOM 91769 O WAT 5523 109.963 2.763 114.486 1.00 0.00 O ATOM 91770 H1 WAT 5523 109.200 3.220 114.838 1.00 0.00 H ATOM 91771 H2 WAT 5523 109.776 1.836 114.634 1.00 0.00 H TER 91773 WAT 5523 ATOM 91773 O WAT 5524 92.204 126.295 138.712 1.00 0.00 O ATOM 91774 H1 WAT 5524 92.518 126.963 139.321 1.00 0.00 H ATOM 91775 H2 WAT 5524 91.286 126.520 138.562 1.00 0.00 H TER 91777 WAT 5524 ATOM 91777 O WAT 5525 90.336 49.215 71.468 1.00 0.00 O ATOM 91778 H1 WAT 5525 91.017 48.640 71.118 1.00 0.00 H ATOM 91779 H2 WAT 5525 90.161 49.836 70.761 1.00 0.00 H TER 91781 WAT 5525 ATOM 91781 O WAT 5526 41.984 62.700 128.254 1.00 0.00 O ATOM 91782 H1 WAT 5526 41.624 63.558 128.029 1.00 0.00 H ATOM 91783 H2 WAT 5526 42.230 62.315 127.413 1.00 0.00 H TER 91785 WAT 5526 ATOM 91785 O WAT 5527 11.429 59.130 72.383 1.00 0.00 O ATOM 91786 H1 WAT 5527 10.910 58.738 71.681 1.00 0.00 H ATOM 91787 H2 WAT 5527 11.188 60.057 72.371 1.00 0.00 H TER 91789 WAT 5527 ATOM 91789 O WAT 5528 68.459 22.103 79.585 1.00 0.00 O ATOM 91790 H1 WAT 5528 68.246 21.970 78.662 1.00 0.00 H ATOM 91791 H2 WAT 5528 68.846 21.273 79.863 1.00 0.00 H TER 91793 WAT 5528 ATOM 91793 O WAT 5529 68.598 131.658 7.046 1.00 0.00 O ATOM 91794 H1 WAT 5529 68.348 132.197 7.797 1.00 0.00 H ATOM 91795 H2 WAT 5529 68.131 132.046 6.306 1.00 0.00 H TER 91797 WAT 5529 ATOM 91797 O WAT 5530 54.701 9.798 20.818 1.00 0.00 O ATOM 91798 H1 WAT 5530 54.068 9.944 21.522 1.00 0.00 H ATOM 91799 H2 WAT 5530 54.610 8.870 20.602 1.00 0.00 H TER 91801 WAT 5530 ATOM 91801 O WAT 5531 89.903 128.129 137.570 1.00 0.00 O ATOM 91802 H1 WAT 5531 89.567 128.074 138.465 1.00 0.00 H ATOM 91803 H2 WAT 5531 89.422 127.454 137.091 1.00 0.00 H TER 91805 WAT 5531 ATOM 91805 O WAT 5532 15.278 87.864 103.031 1.00 0.00 O ATOM 91806 H1 WAT 5532 15.699 87.356 103.724 1.00 0.00 H ATOM 91807 H2 WAT 5532 15.026 88.685 103.455 1.00 0.00 H TER 91809 WAT 5532 ATOM 91809 O WAT 5533 50.070 6.028 7.456 1.00 0.00 O ATOM 91810 H1 WAT 5533 49.773 5.775 6.582 1.00 0.00 H ATOM 91811 H2 WAT 5533 49.961 5.237 7.984 1.00 0.00 H TER 91813 WAT 5533 ATOM 91813 O WAT 5534 8.786 131.925 118.638 1.00 0.00 O ATOM 91814 H1 WAT 5534 8.324 131.658 119.433 1.00 0.00 H ATOM 91815 H2 WAT 5534 8.459 132.806 118.455 1.00 0.00 H TER 91817 WAT 5534 ATOM 91817 O WAT 5535 26.171 114.156 144.021 1.00 0.00 O ATOM 91818 H1 WAT 5535 26.042 114.092 143.075 1.00 0.00 H ATOM 91819 H2 WAT 5535 25.351 113.837 144.397 1.00 0.00 H TER 91821 WAT 5535 ATOM 91821 O WAT 5536 138.059 68.353 112.360 1.00 0.00 O ATOM 91822 H1 WAT 5536 138.905 68.792 112.446 1.00 0.00 H ATOM 91823 H2 WAT 5536 137.530 68.952 111.832 1.00 0.00 H TER 91825 WAT 5536 ATOM 91825 O WAT 5537 130.074 16.332 79.173 1.00 0.00 O ATOM 91826 H1 WAT 5537 129.819 16.801 78.378 1.00 0.00 H ATOM 91827 H2 WAT 5537 129.801 16.907 79.888 1.00 0.00 H TER 91829 WAT 5537 ATOM 91829 O WAT 5538 136.454 11.056 126.207 1.00 0.00 O ATOM 91830 H1 WAT 5538 136.144 11.152 125.307 1.00 0.00 H ATOM 91831 H2 WAT 5538 136.300 10.135 126.417 1.00 0.00 H TER 91833 WAT 5538 ATOM 91833 O WAT 5539 103.846 39.390 63.784 1.00 0.00 O ATOM 91834 H1 WAT 5539 103.608 39.487 62.862 1.00 0.00 H ATOM 91835 H2 WAT 5539 104.803 39.419 63.789 1.00 0.00 H TER 91837 WAT 5539 ATOM 91837 O WAT 5540 98.443 113.959 68.801 1.00 0.00 O ATOM 91838 H1 WAT 5540 98.531 113.973 69.754 1.00 0.00 H ATOM 91839 H2 WAT 5540 97.724 113.348 68.636 1.00 0.00 H TER 91841 WAT 5540 ATOM 91841 O WAT 5541 93.690 6.204 95.982 1.00 0.00 O ATOM 91842 H1 WAT 5541 94.273 5.641 95.472 1.00 0.00 H ATOM 91843 H2 WAT 5541 92.908 6.296 95.437 1.00 0.00 H TER 91845 WAT 5541 ATOM 91845 O WAT 5542 141.469 117.398 6.992 1.00 0.00 O ATOM 91846 H1 WAT 5542 141.426 118.010 6.256 1.00 0.00 H ATOM 91847 H2 WAT 5542 140.811 117.719 7.608 1.00 0.00 H TER 91849 WAT 5542 ATOM 91849 O WAT 5543 82.328 132.006 111.331 1.00 0.00 O ATOM 91850 H1 WAT 5543 82.231 132.832 111.805 1.00 0.00 H ATOM 91851 H2 WAT 5543 83.272 131.851 111.310 1.00 0.00 H TER 91853 WAT 5543 ATOM 91853 O WAT 5544 74.226 33.240 7.030 1.00 0.00 O ATOM 91854 H1 WAT 5544 74.491 34.074 6.643 1.00 0.00 H ATOM 91855 H2 WAT 5544 73.520 32.926 6.465 1.00 0.00 H TER 91857 WAT 5544 ATOM 91857 O WAT 5545 100.999 130.730 70.337 1.00 0.00 O ATOM 91858 H1 WAT 5545 100.478 130.668 71.137 1.00 0.00 H ATOM 91859 H2 WAT 5545 101.779 131.221 70.597 1.00 0.00 H TER 91861 WAT 5545 ATOM 91861 O WAT 5546 16.172 76.499 67.803 1.00 0.00 O ATOM 91862 H1 WAT 5546 15.428 76.671 68.380 1.00 0.00 H ATOM 91863 H2 WAT 5546 15.788 76.063 67.042 1.00 0.00 H TER 91865 WAT 5546 ATOM 91865 O WAT 5547 128.753 80.413 150.304 1.00 0.00 O ATOM 91866 H1 WAT 5547 129.199 80.144 149.501 1.00 0.00 H ATOM 91867 H2 WAT 5547 129.158 79.884 150.991 1.00 0.00 H TER 91869 WAT 5547 ATOM 91869 O WAT 5548 29.026 97.357 79.695 1.00 0.00 O ATOM 91870 H1 WAT 5548 29.125 96.920 78.849 1.00 0.00 H ATOM 91871 H2 WAT 5548 29.358 96.724 80.331 1.00 0.00 H TER 91873 WAT 5548 ATOM 91873 O WAT 5549 22.068 89.940 87.731 1.00 0.00 O ATOM 91874 H1 WAT 5549 21.244 90.324 88.030 1.00 0.00 H ATOM 91875 H2 WAT 5549 22.258 89.252 88.369 1.00 0.00 H TER 91877 WAT 5549 ATOM 91877 O WAT 5550 7.076 70.098 145.906 1.00 0.00 O ATOM 91878 H1 WAT 5550 6.839 70.264 144.994 1.00 0.00 H ATOM 91879 H2 WAT 5550 7.511 70.901 146.191 1.00 0.00 H TER 91881 WAT 5550 ATOM 91881 O WAT 5551 38.193 136.953 106.652 1.00 0.00 O ATOM 91882 H1 WAT 5551 37.398 137.090 107.167 1.00 0.00 H ATOM 91883 H2 WAT 5551 38.889 136.871 107.304 1.00 0.00 H TER 91885 WAT 5551 ATOM 91885 O WAT 5552 107.123 68.342 86.017 1.00 0.00 O ATOM 91886 H1 WAT 5552 106.660 68.046 86.801 1.00 0.00 H ATOM 91887 H2 WAT 5552 107.260 69.278 86.159 1.00 0.00 H TER 91889 WAT 5552 ATOM 91889 O WAT 5553 119.691 36.100 97.793 1.00 0.00 O ATOM 91890 H1 WAT 5553 120.017 36.035 96.895 1.00 0.00 H ATOM 91891 H2 WAT 5553 118.765 35.869 97.729 1.00 0.00 H TER 91893 WAT 5553 ATOM 91893 O WAT 5554 73.648 3.117 120.719 1.00 0.00 O ATOM 91894 H1 WAT 5554 73.635 3.788 121.401 1.00 0.00 H ATOM 91895 H2 WAT 5554 72.730 2.876 120.603 1.00 0.00 H TER 91897 WAT 5554 ATOM 91897 O WAT 5555 63.097 80.031 114.154 1.00 0.00 O ATOM 91898 H1 WAT 5555 62.236 80.375 113.915 1.00 0.00 H ATOM 91899 H2 WAT 5555 63.036 79.869 115.096 1.00 0.00 H TER 91901 WAT 5555 ATOM 91901 O WAT 5556 49.956 139.069 155.497 1.00 0.00 O ATOM 91902 H1 WAT 5556 49.710 139.196 156.413 1.00 0.00 H ATOM 91903 H2 WAT 5556 49.216 138.598 155.113 1.00 0.00 H TER 91905 WAT 5556 ATOM 91905 O WAT 5557 91.603 106.154 136.507 1.00 0.00 O ATOM 91906 H1 WAT 5557 91.956 106.848 135.950 1.00 0.00 H ATOM 91907 H2 WAT 5557 90.856 106.558 136.948 1.00 0.00 H TER 91909 WAT 5557 ATOM 91909 O WAT 5558 87.713 22.869 146.853 1.00 0.00 O ATOM 91910 H1 WAT 5558 87.910 22.516 147.721 1.00 0.00 H ATOM 91911 H2 WAT 5558 87.732 22.107 146.274 1.00 0.00 H TER 91913 WAT 5558 ATOM 91913 O WAT 5559 101.754 51.431 140.144 1.00 0.00 O ATOM 91914 H1 WAT 5559 102.339 50.988 139.530 1.00 0.00 H ATOM 91915 H2 WAT 5559 101.787 52.352 139.885 1.00 0.00 H TER 91917 WAT 5559 ATOM 91917 O WAT 5560 74.543 112.622 90.325 1.00 0.00 O ATOM 91918 H1 WAT 5560 74.135 113.173 90.992 1.00 0.00 H ATOM 91919 H2 WAT 5560 75.484 112.750 90.450 1.00 0.00 H TER 91921 WAT 5560 ATOM 91921 O WAT 5561 32.685 24.103 133.316 1.00 0.00 O ATOM 91922 H1 WAT 5561 32.112 24.301 134.057 1.00 0.00 H ATOM 91923 H2 WAT 5561 33.153 24.921 133.150 1.00 0.00 H TER 91925 WAT 5561 ATOM 91925 O WAT 5562 27.808 106.512 4.974 1.00 0.00 O ATOM 91926 H1 WAT 5562 28.477 106.462 4.291 1.00 0.00 H ATOM 91927 H2 WAT 5562 27.129 105.900 4.691 1.00 0.00 H TER 91929 WAT 5562 ATOM 91929 O WAT 5563 121.456 75.725 140.688 1.00 0.00 O ATOM 91930 H1 WAT 5563 121.629 74.870 141.082 1.00 0.00 H ATOM 91931 H2 WAT 5563 120.843 76.147 141.289 1.00 0.00 H TER 91933 WAT 5563 ATOM 91933 O WAT 5564 63.429 117.518 74.839 1.00 0.00 O ATOM 91934 H1 WAT 5564 62.484 117.363 74.842 1.00 0.00 H ATOM 91935 H2 WAT 5564 63.809 116.685 75.117 1.00 0.00 H TER 91937 WAT 5564 ATOM 91937 O WAT 5565 98.266 49.080 83.785 1.00 0.00 O ATOM 91938 H1 WAT 5565 98.069 49.140 82.850 1.00 0.00 H ATOM 91939 H2 WAT 5565 98.873 49.802 83.949 1.00 0.00 H TER 91941 WAT 5565 ATOM 91941 O WAT 5566 29.400 87.500 127.920 1.00 0.00 O ATOM 91942 H1 WAT 5566 29.188 86.699 127.441 1.00 0.00 H ATOM 91943 H2 WAT 5566 29.100 88.207 127.348 1.00 0.00 H TER 91945 WAT 5566 ATOM 91945 O WAT 5567 48.947 48.580 122.966 1.00 0.00 O ATOM 91946 H1 WAT 5567 49.745 48.387 123.458 1.00 0.00 H ATOM 91947 H2 WAT 5567 49.162 48.351 122.062 1.00 0.00 H TER 91949 WAT 5567 ATOM 91949 O WAT 5568 10.332 125.883 88.549 1.00 0.00 O ATOM 91950 H1 WAT 5568 9.509 125.414 88.687 1.00 0.00 H ATOM 91951 H2 WAT 5568 10.087 126.808 88.571 1.00 0.00 H TER 91953 WAT 5568 ATOM 91953 O WAT 5569 12.242 8.742 133.263 1.00 0.00 O ATOM 91954 H1 WAT 5569 12.409 9.518 133.798 1.00 0.00 H ATOM 91955 H2 WAT 5569 12.984 8.164 133.440 1.00 0.00 H TER 91957 WAT 5569 ATOM 91957 O WAT 5570 134.826 62.116 133.870 1.00 0.00 O ATOM 91958 H1 WAT 5570 134.124 61.943 133.242 1.00 0.00 H ATOM 91959 H2 WAT 5570 134.754 63.052 134.057 1.00 0.00 H TER 91961 WAT 5570 ATOM 91961 O WAT 5571 49.319 65.502 14.208 1.00 0.00 O ATOM 91962 H1 WAT 5571 49.243 64.880 14.931 1.00 0.00 H ATOM 91963 H2 WAT 5571 49.857 65.050 13.558 1.00 0.00 H TER 91965 WAT 5571 ATOM 91965 O WAT 5572 93.745 20.847 13.598 1.00 0.00 O ATOM 91966 H1 WAT 5572 94.170 20.288 12.947 1.00 0.00 H ATOM 91967 H2 WAT 5572 93.264 20.238 14.159 1.00 0.00 H TER 91969 WAT 5572 ATOM 91969 O WAT 5573 30.757 131.303 99.466 1.00 0.00 O ATOM 91970 H1 WAT 5573 31.402 130.813 98.957 1.00 0.00 H ATOM 91971 H2 WAT 5573 30.703 132.153 99.030 1.00 0.00 H TER 91973 WAT 5573 ATOM 91973 O WAT 5574 86.904 18.422 119.590 1.00 0.00 O ATOM 91974 H1 WAT 5574 87.282 18.299 120.461 1.00 0.00 H ATOM 91975 H2 WAT 5574 85.962 18.483 119.744 1.00 0.00 H TER 91977 WAT 5574 ATOM 91977 O WAT 5575 47.725 142.007 82.868 1.00 0.00 O ATOM 91978 H1 WAT 5575 46.960 142.172 82.316 1.00 0.00 H ATOM 91979 H2 WAT 5575 47.824 141.056 82.862 1.00 0.00 H TER 91981 WAT 5575 ATOM 91981 O WAT 5576 116.647 72.277 144.621 1.00 0.00 O ATOM 91982 H1 WAT 5576 116.284 73.149 144.774 1.00 0.00 H ATOM 91983 H2 WAT 5576 116.662 72.188 143.668 1.00 0.00 H TER 91985 WAT 5576 ATOM 91985 O WAT 5577 43.716 112.574 20.645 1.00 0.00 O ATOM 91986 H1 WAT 5577 43.767 111.642 20.435 1.00 0.00 H ATOM 91987 H2 WAT 5577 43.534 112.598 21.585 1.00 0.00 H TER 91989 WAT 5577 ATOM 91989 O WAT 5578 127.017 34.312 151.051 1.00 0.00 O ATOM 91990 H1 WAT 5578 126.753 34.583 151.931 1.00 0.00 H ATOM 91991 H2 WAT 5578 127.971 34.252 151.096 1.00 0.00 H TER 91993 WAT 5578 ATOM 91993 O WAT 5579 25.745 113.129 77.763 1.00 0.00 O ATOM 91994 H1 WAT 5579 25.883 112.526 78.493 1.00 0.00 H ATOM 91995 H2 WAT 5579 26.273 113.897 77.983 1.00 0.00 H TER 91997 WAT 5579 ATOM 91997 O WAT 5580 107.031 132.398 11.005 1.00 0.00 O ATOM 91998 H1 WAT 5580 107.083 133.080 10.336 1.00 0.00 H ATOM 91999 H2 WAT 5580 107.942 132.229 11.246 1.00 0.00 H TER 92001 WAT 5580 ATOM 92001 O WAT 5581 131.058 2.156 140.503 1.00 0.00 O ATOM 92002 H1 WAT 5581 131.328 3.064 140.366 1.00 0.00 H ATOM 92003 H2 WAT 5581 130.916 2.089 141.448 1.00 0.00 H TER 92005 WAT 5581 ATOM 92005 O WAT 5582 37.440 8.768 140.256 1.00 0.00 O ATOM 92006 H1 WAT 5582 37.399 8.140 140.977 1.00 0.00 H ATOM 92007 H2 WAT 5582 38.148 8.445 139.698 1.00 0.00 H TER 92009 WAT 5582 ATOM 92009 O WAT 5583 44.192 140.054 130.087 1.00 0.00 O ATOM 92010 H1 WAT 5583 43.929 140.204 129.179 1.00 0.00 H ATOM 92011 H2 WAT 5583 45.107 140.333 130.120 1.00 0.00 H TER 92013 WAT 5583 ATOM 92013 O WAT 5584 18.197 21.513 19.252 1.00 0.00 O ATOM 92014 H1 WAT 5584 17.442 20.926 19.204 1.00 0.00 H ATOM 92015 H2 WAT 5584 18.794 21.086 19.866 1.00 0.00 H TER 92017 WAT 5584 ATOM 92017 O WAT 5585 35.812 58.012 150.839 1.00 0.00 O ATOM 92018 H1 WAT 5585 35.556 58.494 150.052 1.00 0.00 H ATOM 92019 H2 WAT 5585 35.241 57.244 150.847 1.00 0.00 H TER 92021 WAT 5585 ATOM 92021 O WAT 5586 12.386 130.661 118.617 1.00 0.00 O ATOM 92022 H1 WAT 5586 11.864 129.902 118.356 1.00 0.00 H ATOM 92023 H2 WAT 5586 12.313 131.267 117.879 1.00 0.00 H TER 92025 WAT 5586 ATOM 92025 O WAT 5587 68.684 88.338 3.833 1.00 0.00 O ATOM 92026 H1 WAT 5587 68.016 88.238 4.512 1.00 0.00 H ATOM 92027 H2 WAT 5587 68.411 89.113 3.342 1.00 0.00 H TER 92029 WAT 5587 ATOM 92029 O WAT 5588 55.702 24.630 95.452 1.00 0.00 O ATOM 92030 H1 WAT 5588 55.003 24.900 96.047 1.00 0.00 H ATOM 92031 H2 WAT 5588 56.491 24.632 95.993 1.00 0.00 H TER 92033 WAT 5588 ATOM 92033 O WAT 5589 118.347 38.517 77.775 1.00 0.00 O ATOM 92034 H1 WAT 5589 117.768 37.786 77.560 1.00 0.00 H ATOM 92035 H2 WAT 5589 117.785 39.291 77.727 1.00 0.00 H TER 92037 WAT 5589 ATOM 92037 O WAT 5590 122.150 75.080 153.980 1.00 0.00 O ATOM 92038 H1 WAT 5590 122.899 75.671 154.040 1.00 0.00 H ATOM 92039 H2 WAT 5590 121.940 75.052 153.047 1.00 0.00 H TER 92041 WAT 5590 ATOM 92041 O WAT 5591 102.619 128.199 129.645 1.00 0.00 O ATOM 92042 H1 WAT 5591 103.104 128.327 128.830 1.00 0.00 H ATOM 92043 H2 WAT 5591 101.702 128.153 129.374 1.00 0.00 H TER 92045 WAT 5591 ATOM 92045 O WAT 5592 10.293 107.802 144.164 1.00 0.00 O ATOM 92046 H1 WAT 5592 9.635 108.279 144.669 1.00 0.00 H ATOM 92047 H2 WAT 5592 11.016 107.670 144.777 1.00 0.00 H TER 92049 WAT 5592 ATOM 92049 O WAT 5593 141.737 57.939 117.120 1.00 0.00 O ATOM 92050 H1 WAT 5593 142.043 57.498 116.327 1.00 0.00 H ATOM 92051 H2 WAT 5593 142.519 58.359 117.478 1.00 0.00 H TER 92053 WAT 5593 ATOM 92053 O WAT 5594 37.040 76.101 15.588 1.00 0.00 O ATOM 92054 H1 WAT 5594 36.999 76.968 15.990 1.00 0.00 H ATOM 92055 H2 WAT 5594 37.813 75.692 15.978 1.00 0.00 H TER 92057 WAT 5594 ATOM 92057 O WAT 5595 49.034 143.215 1.898 1.00 0.00 O ATOM 92058 H1 WAT 5595 49.273 143.010 2.802 1.00 0.00 H ATOM 92059 H2 WAT 5595 48.749 142.378 1.529 1.00 0.00 H TER 92061 WAT 5595 ATOM 92061 O WAT 5596 36.088 5.585 105.958 1.00 0.00 O ATOM 92062 H1 WAT 5596 35.187 5.899 105.893 1.00 0.00 H ATOM 92063 H2 WAT 5596 36.612 6.274 105.548 1.00 0.00 H TER 92065 WAT 5596 ATOM 92065 O WAT 5597 132.522 109.297 93.378 1.00 0.00 O ATOM 92066 H1 WAT 5597 132.255 109.300 94.297 1.00 0.00 H ATOM 92067 H2 WAT 5597 131.775 109.673 92.911 1.00 0.00 H TER 92069 WAT 5597 ATOM 92069 O WAT 5598 116.355 48.354 126.357 1.00 0.00 O ATOM 92070 H1 WAT 5598 115.404 48.438 126.294 1.00 0.00 H ATOM 92071 H2 WAT 5598 116.694 49.061 125.807 1.00 0.00 H TER 92073 WAT 5598 ATOM 92073 O WAT 5599 109.963 36.523 5.434 1.00 0.00 O ATOM 92074 H1 WAT 5599 109.374 35.913 4.990 1.00 0.00 H ATOM 92075 H2 WAT 5599 109.470 37.342 5.479 1.00 0.00 H TER 92077 WAT 5599 ATOM 92077 O WAT 5600 83.189 61.234 89.150 1.00 0.00 O ATOM 92078 H1 WAT 5600 82.859 60.371 89.402 1.00 0.00 H ATOM 92079 H2 WAT 5600 82.420 61.699 88.823 1.00 0.00 H TER 92081 WAT 5600 ATOM 92081 O WAT 5601 21.556 62.075 90.703 1.00 0.00 O ATOM 92082 H1 WAT 5601 21.566 61.332 91.306 1.00 0.00 H ATOM 92083 H2 WAT 5601 22.421 62.472 90.799 1.00 0.00 H TER 92085 WAT 5601 ATOM 92085 O WAT 5602 110.833 129.703 4.037 1.00 0.00 O ATOM 92086 H1 WAT 5602 111.596 129.876 4.590 1.00 0.00 H ATOM 92087 H2 WAT 5602 110.141 130.250 4.407 1.00 0.00 H TER 92089 WAT 5602 ATOM 92089 O WAT 5603 140.638 63.536 146.250 1.00 0.00 O ATOM 92090 H1 WAT 5603 139.988 64.157 146.577 1.00 0.00 H ATOM 92091 H2 WAT 5603 140.128 62.892 145.758 1.00 0.00 H TER 92093 WAT 5603 ATOM 92093 O WAT 5604 140.738 47.227 69.769 1.00 0.00 O ATOM 92094 H1 WAT 5604 141.430 47.388 69.128 1.00 0.00 H ATOM 92095 H2 WAT 5604 139.989 46.940 69.246 1.00 0.00 H TER 92097 WAT 5604 ATOM 92097 O WAT 5605 34.865 131.675 63.791 1.00 0.00 O ATOM 92098 H1 WAT 5605 35.624 131.444 64.326 1.00 0.00 H ATOM 92099 H2 WAT 5605 35.091 131.374 62.911 1.00 0.00 H TER 92101 WAT 5605 ATOM 92101 O WAT 5606 12.517 82.760 94.532 1.00 0.00 O ATOM 92102 H1 WAT 5606 11.612 82.526 94.322 1.00 0.00 H ATOM 92103 H2 WAT 5606 13.043 82.278 93.893 1.00 0.00 H TER 92105 WAT 5606 ATOM 92105 O WAT 5607 125.353 39.075 95.652 1.00 0.00 O ATOM 92106 H1 WAT 5607 126.241 39.256 95.345 1.00 0.00 H ATOM 92107 H2 WAT 5607 125.288 39.539 96.487 1.00 0.00 H TER 92109 WAT 5607 ATOM 92109 O WAT 5608 34.339 22.912 13.999 1.00 0.00 O ATOM 92110 H1 WAT 5608 33.589 23.360 14.390 1.00 0.00 H ATOM 92111 H2 WAT 5608 33.960 22.369 13.308 1.00 0.00 H TER 92113 WAT 5608 ATOM 92113 O WAT 5609 102.629 121.638 78.499 1.00 0.00 O ATOM 92114 H1 WAT 5609 102.489 120.742 78.192 1.00 0.00 H ATOM 92115 H2 WAT 5609 101.818 121.864 78.955 1.00 0.00 H TER 92117 WAT 5609 ATOM 92117 O WAT 5610 32.807 144.313 88.941 1.00 0.00 O ATOM 92118 H1 WAT 5610 32.167 144.987 88.715 1.00 0.00 H ATOM 92119 H2 WAT 5610 32.423 143.862 89.694 1.00 0.00 H TER 92121 WAT 5610 ATOM 92121 O WAT 5611 136.901 49.101 1.861 1.00 0.00 O ATOM 92122 H1 WAT 5611 137.382 48.532 1.260 1.00 0.00 H ATOM 92123 H2 WAT 5611 137.224 48.860 2.729 1.00 0.00 H TER 92125 WAT 5611 ATOM 92125 O WAT 5612 112.994 112.641 144.889 1.00 0.00 O ATOM 92126 H1 WAT 5612 112.429 111.887 145.060 1.00 0.00 H ATOM 92127 H2 WAT 5612 112.858 112.835 143.961 1.00 0.00 H TER 92129 WAT 5612 ATOM 92129 O WAT 5613 75.585 131.357 72.135 1.00 0.00 O ATOM 92130 H1 WAT 5613 75.617 130.413 72.288 1.00 0.00 H ATOM 92131 H2 WAT 5613 74.931 131.679 72.756 1.00 0.00 H TER 92133 WAT 5613 ATOM 92133 O WAT 5614 59.353 6.687 118.733 1.00 0.00 O ATOM 92134 H1 WAT 5614 60.220 6.807 118.346 1.00 0.00 H ATOM 92135 H2 WAT 5614 59.277 5.742 118.864 1.00 0.00 H TER 92137 WAT 5614 ATOM 92137 O WAT 5615 35.999 113.351 156.883 1.00 0.00 O ATOM 92138 H1 WAT 5615 35.691 113.896 157.607 1.00 0.00 H ATOM 92139 H2 WAT 5615 35.431 113.585 156.149 1.00 0.00 H TER 92141 WAT 5615 ATOM 92141 O WAT 5616 68.776 8.139 65.092 1.00 0.00 O ATOM 92142 H1 WAT 5616 67.829 8.041 65.188 1.00 0.00 H ATOM 92143 H2 WAT 5616 69.047 8.625 65.871 1.00 0.00 H TER 92145 WAT 5616 ATOM 92145 O WAT 5617 37.895 88.335 2.611 1.00 0.00 O ATOM 92146 H1 WAT 5617 38.749 88.295 2.181 1.00 0.00 H ATOM 92147 H2 WAT 5617 38.098 88.480 3.535 1.00 0.00 H TER 92149 WAT 5617 ATOM 92149 O WAT 5618 71.948 39.806 6.204 1.00 0.00 O ATOM 92150 H1 WAT 5618 71.678 38.939 5.902 1.00 0.00 H ATOM 92151 H2 WAT 5618 71.483 40.415 5.629 1.00 0.00 H TER 92153 WAT 5618 ATOM 92153 O WAT 5619 14.410 26.640 150.942 1.00 0.00 O ATOM 92154 H1 WAT 5619 13.988 27.111 151.661 1.00 0.00 H ATOM 92155 H2 WAT 5619 14.700 25.816 151.334 1.00 0.00 H TER 92157 WAT 5619 ATOM 92157 O WAT 5620 97.439 66.453 133.396 1.00 0.00 O ATOM 92158 H1 WAT 5620 97.204 66.735 134.280 1.00 0.00 H ATOM 92159 H2 WAT 5620 96.617 66.486 132.907 1.00 0.00 H TER 92161 WAT 5620 ATOM 92161 O WAT 5621 141.738 119.398 127.789 1.00 0.00 O ATOM 92162 H1 WAT 5621 141.431 119.149 128.661 1.00 0.00 H ATOM 92163 H2 WAT 5621 142.691 119.317 127.838 1.00 0.00 H TER 92165 WAT 5621 ATOM 92165 O WAT 5622 38.687 25.469 155.572 1.00 0.00 O ATOM 92166 H1 WAT 5622 37.783 25.178 155.691 1.00 0.00 H ATOM 92167 H2 WAT 5622 39.020 24.925 154.858 1.00 0.00 H TER 92169 WAT 5622 ATOM 92169 O WAT 5623 83.611 33.355 132.836 1.00 0.00 O ATOM 92170 H1 WAT 5623 83.856 33.059 131.959 1.00 0.00 H ATOM 92171 H2 WAT 5623 84.445 33.505 133.280 1.00 0.00 H TER 92173 WAT 5623 ATOM 92173 O WAT 5624 128.558 101.784 21.052 1.00 0.00 O ATOM 92174 H1 WAT 5624 128.305 102.612 21.460 1.00 0.00 H ATOM 92175 H2 WAT 5624 129.511 101.759 21.134 1.00 0.00 H TER 92177 WAT 5624 ATOM 92177 O WAT 5625 86.827 130.048 17.228 1.00 0.00 O ATOM 92178 H1 WAT 5625 86.300 129.444 17.750 1.00 0.00 H ATOM 92179 H2 WAT 5625 87.144 129.519 16.496 1.00 0.00 H TER 92181 WAT 5625 ATOM 92181 O WAT 5626 37.482 55.586 3.909 1.00 0.00 O ATOM 92182 H1 WAT 5626 38.422 55.736 4.014 1.00 0.00 H ATOM 92183 H2 WAT 5626 37.098 56.462 3.902 1.00 0.00 H TER 92185 WAT 5626 ATOM 92185 O WAT 5627 46.015 28.466 75.820 1.00 0.00 O ATOM 92186 H1 WAT 5627 45.894 28.546 76.767 1.00 0.00 H ATOM 92187 H2 WAT 5627 45.351 27.833 75.547 1.00 0.00 H TER 92189 WAT 5627 ATOM 92189 O WAT 5628 25.939 20.274 9.073 1.00 0.00 O ATOM 92190 H1 WAT 5628 26.449 21.055 9.288 1.00 0.00 H ATOM 92191 H2 WAT 5628 25.984 19.734 9.862 1.00 0.00 H TER 92193 WAT 5628 ATOM 92193 O WAT 5629 33.710 32.141 153.977 1.00 0.00 O ATOM 92194 H1 WAT 5629 33.508 31.223 154.159 1.00 0.00 H ATOM 92195 H2 WAT 5629 33.890 32.522 154.837 1.00 0.00 H TER 92197 WAT 5629 ATOM 92197 O WAT 5630 127.070 42.095 80.525 1.00 0.00 O ATOM 92198 H1 WAT 5630 127.930 41.869 80.172 1.00 0.00 H ATOM 92199 H2 WAT 5630 127.182 42.973 80.887 1.00 0.00 H TER 92201 WAT 5630 ATOM 92201 O WAT 5631 52.668 60.451 96.472 1.00 0.00 O ATOM 92202 H1 WAT 5631 53.251 60.351 95.720 1.00 0.00 H ATOM 92203 H2 WAT 5631 51.971 61.027 96.160 1.00 0.00 H TER 92205 WAT 5631 ATOM 92205 O WAT 5632 24.656 78.829 23.642 1.00 0.00 O ATOM 92206 H1 WAT 5632 24.871 79.265 22.818 1.00 0.00 H ATOM 92207 H2 WAT 5632 25.238 78.070 23.671 1.00 0.00 H TER 92209 WAT 5632 ATOM 92209 O WAT 5633 43.248 93.045 78.481 1.00 0.00 O ATOM 92210 H1 WAT 5633 43.298 93.501 79.321 1.00 0.00 H ATOM 92211 H2 WAT 5633 42.802 93.661 77.900 1.00 0.00 H TER 92213 WAT 5633 ATOM 92213 O WAT 5634 81.569 119.890 143.741 1.00 0.00 O ATOM 92214 H1 WAT 5634 82.088 119.257 143.246 1.00 0.00 H ATOM 92215 H2 WAT 5634 80.867 120.145 143.141 1.00 0.00 H TER 92217 WAT 5634 ATOM 92217 O WAT 5635 140.595 132.689 82.352 1.00 0.00 O ATOM 92218 H1 WAT 5635 140.784 133.569 82.679 1.00 0.00 H ATOM 92219 H2 WAT 5635 140.120 132.834 81.534 1.00 0.00 H TER 92221 WAT 5635 ATOM 92221 O WAT 5636 95.042 28.838 87.238 1.00 0.00 O ATOM 92222 H1 WAT 5636 95.631 28.398 87.851 1.00 0.00 H ATOM 92223 H2 WAT 5636 95.275 29.764 87.304 1.00 0.00 H TER 92225 WAT 5636 ATOM 92225 O WAT 5637 103.089 121.460 105.430 1.00 0.00 O ATOM 92226 H1 WAT 5637 103.144 121.103 104.543 1.00 0.00 H ATOM 92227 H2 WAT 5637 103.429 120.762 105.990 1.00 0.00 H TER 92229 WAT 5637 ATOM 92229 O WAT 5638 63.510 92.517 75.969 1.00 0.00 O ATOM 92230 H1 WAT 5638 63.785 92.510 76.886 1.00 0.00 H ATOM 92231 H2 WAT 5638 63.604 93.430 75.697 1.00 0.00 H TER 92233 WAT 5638 ATOM 92233 O WAT 5639 104.121 57.501 103.944 1.00 0.00 O ATOM 92234 H1 WAT 5639 103.733 58.370 103.839 1.00 0.00 H ATOM 92235 H2 WAT 5639 104.906 57.652 104.471 1.00 0.00 H TER 92237 WAT 5639 ATOM 92237 O WAT 5640 45.475 47.649 85.584 1.00 0.00 O ATOM 92238 H1 WAT 5640 46.023 47.914 84.846 1.00 0.00 H ATOM 92239 H2 WAT 5640 44.598 47.556 85.210 1.00 0.00 H TER 92241 WAT 5640 ATOM 92241 O WAT 5641 127.625 125.905 71.042 1.00 0.00 O ATOM 92242 H1 WAT 5641 127.506 125.070 71.495 1.00 0.00 H ATOM 92243 H2 WAT 5641 127.736 125.664 70.122 1.00 0.00 H TER 92245 WAT 5641 ATOM 92245 O WAT 5642 99.673 30.636 64.602 1.00 0.00 O ATOM 92246 H1 WAT 5642 99.974 30.485 65.498 1.00 0.00 H ATOM 92247 H2 WAT 5642 100.440 30.454 64.058 1.00 0.00 H TER 92249 WAT 5642 ATOM 92249 O WAT 5643 137.663 110.379 5.679 1.00 0.00 O ATOM 92250 H1 WAT 5643 136.774 110.734 5.672 1.00 0.00 H ATOM 92251 H2 WAT 5643 138.202 111.074 5.302 1.00 0.00 H TER 92253 WAT 5643 ATOM 92253 O WAT 5644 79.798 107.918 12.081 1.00 0.00 O ATOM 92254 H1 WAT 5644 79.911 108.414 12.893 1.00 0.00 H ATOM 92255 H2 WAT 5644 79.951 107.008 12.333 1.00 0.00 H TER 92257 WAT 5644 ATOM 92257 O WAT 5645 48.287 76.244 148.764 1.00 0.00 O ATOM 92258 H1 WAT 5645 48.060 77.071 148.338 1.00 0.00 H ATOM 92259 H2 WAT 5645 47.872 75.573 148.223 1.00 0.00 H TER 92261 WAT 5645 ATOM 92261 O WAT 5646 60.483 69.785 70.000 1.00 0.00 O ATOM 92262 H1 WAT 5646 60.390 68.912 69.620 1.00 0.00 H ATOM 92263 H2 WAT 5646 59.589 70.045 70.225 1.00 0.00 H TER 92265 WAT 5646 ATOM 92265 O WAT 5647 113.047 31.168 92.230 1.00 0.00 O ATOM 92266 H1 WAT 5647 112.711 32.055 92.100 1.00 0.00 H ATOM 92267 H2 WAT 5647 112.264 30.624 92.305 1.00 0.00 H TER 92269 WAT 5647 ATOM 92269 O WAT 5648 32.781 82.338 86.776 1.00 0.00 O ATOM 92270 H1 WAT 5648 32.365 83.042 87.274 1.00 0.00 H ATOM 92271 H2 WAT 5648 33.055 81.705 87.441 1.00 0.00 H TER 92273 WAT 5648 ATOM 92273 O WAT 5649 61.757 97.395 117.979 1.00 0.00 O ATOM 92274 H1 WAT 5649 61.492 98.151 118.504 1.00 0.00 H ATOM 92275 H2 WAT 5649 62.229 97.773 117.237 1.00 0.00 H TER 92277 WAT 5649 ATOM 92277 O WAT 5650 10.341 69.674 153.608 1.00 0.00 O ATOM 92278 H1 WAT 5650 10.544 69.601 152.676 1.00 0.00 H ATOM 92279 H2 WAT 5650 9.817 70.472 153.678 1.00 0.00 H TER 92281 WAT 5650 ATOM 92281 O WAT 5651 3.388 9.641 95.753 1.00 0.00 O ATOM 92282 H1 WAT 5651 2.827 8.927 95.449 1.00 0.00 H ATOM 92283 H2 WAT 5651 2.987 9.929 96.573 1.00 0.00 H TER 92285 WAT 5651 ATOM 92285 O WAT 5652 4.146 129.322 53.392 1.00 0.00 O ATOM 92286 H1 WAT 5652 3.194 129.218 53.396 1.00 0.00 H ATOM 92287 H2 WAT 5652 4.283 130.263 53.281 1.00 0.00 H TER 92289 WAT 5652 ATOM 92289 O WAT 5653 50.767 14.429 19.277 1.00 0.00 O ATOM 92290 H1 WAT 5653 50.363 13.679 18.841 1.00 0.00 H ATOM 92291 H2 WAT 5653 50.854 14.157 20.191 1.00 0.00 H TER 92293 WAT 5653 ATOM 92293 O WAT 5654 68.743 72.227 124.813 1.00 0.00 O ATOM 92294 H1 WAT 5654 68.105 72.306 124.103 1.00 0.00 H ATOM 92295 H2 WAT 5654 68.717 71.301 125.056 1.00 0.00 H TER 92297 WAT 5654 ATOM 92297 O WAT 5655 118.621 39.936 111.401 1.00 0.00 O ATOM 92298 H1 WAT 5655 118.868 39.631 112.274 1.00 0.00 H ATOM 92299 H2 WAT 5655 118.962 40.829 111.354 1.00 0.00 H TER 92301 WAT 5655 ATOM 92301 O WAT 5656 109.792 91.339 101.576 1.00 0.00 O ATOM 92302 H1 WAT 5656 109.148 91.789 101.029 1.00 0.00 H ATOM 92303 H2 WAT 5656 110.609 91.397 101.080 1.00 0.00 H TER 92305 WAT 5656 ATOM 92305 O WAT 5657 79.722 83.594 131.931 1.00 0.00 O ATOM 92306 H1 WAT 5657 79.648 83.158 131.082 1.00 0.00 H ATOM 92307 H2 WAT 5657 79.102 83.131 132.493 1.00 0.00 H TER 92309 WAT 5657 ATOM 92309 O WAT 5658 84.024 64.393 105.466 1.00 0.00 O ATOM 92310 H1 WAT 5658 84.361 63.540 105.193 1.00 0.00 H ATOM 92311 H2 WAT 5658 83.256 64.187 105.999 1.00 0.00 H TER 92313 WAT 5658 ATOM 92313 O WAT 5659 99.034 64.813 141.232 1.00 0.00 O ATOM 92314 H1 WAT 5659 99.438 64.672 142.088 1.00 0.00 H ATOM 92315 H2 WAT 5659 99.664 65.353 140.756 1.00 0.00 H TER 92317 WAT 5659 ATOM 92317 O WAT 5660 88.562 114.981 92.104 1.00 0.00 O ATOM 92318 H1 WAT 5660 87.700 115.083 92.507 1.00 0.00 H ATOM 92319 H2 WAT 5660 88.718 114.037 92.107 1.00 0.00 H TER 92321 WAT 5660 ATOM 92321 O WAT 5661 41.198 108.766 25.602 1.00 0.00 O ATOM 92322 H1 WAT 5661 40.477 109.246 26.011 1.00 0.00 H ATOM 92323 H2 WAT 5661 41.521 108.186 26.291 1.00 0.00 H TER 92325 WAT 5661 ATOM 92325 O WAT 5662 79.455 3.421 86.112 1.00 0.00 O ATOM 92326 H1 WAT 5662 79.252 2.570 86.500 1.00 0.00 H ATOM 92327 H2 WAT 5662 79.149 4.058 86.758 1.00 0.00 H TER 92329 WAT 5662 ATOM 92329 O WAT 5663 82.675 9.729 157.778 1.00 0.00 O ATOM 92330 H1 WAT 5663 82.914 9.903 156.868 1.00 0.00 H ATOM 92331 H2 WAT 5663 83.511 9.675 158.240 1.00 0.00 H TER 92333 WAT 5663 ATOM 92333 O WAT 5664 104.060 144.985 21.551 1.00 0.00 O ATOM 92334 H1 WAT 5664 103.646 145.554 22.200 1.00 0.00 H ATOM 92335 H2 WAT 5664 104.857 144.673 21.980 1.00 0.00 H TER 92337 WAT 5664 ATOM 92337 O WAT 5665 81.726 131.075 133.113 1.00 0.00 O ATOM 92338 H1 WAT 5665 81.431 130.172 133.228 1.00 0.00 H ATOM 92339 H2 WAT 5665 82.301 131.236 133.861 1.00 0.00 H TER 92341 WAT 5665 ATOM 92341 O WAT 5666 9.407 112.180 116.054 1.00 0.00 O ATOM 92342 H1 WAT 5666 10.024 112.483 115.388 1.00 0.00 H ATOM 92343 H2 WAT 5666 9.215 112.959 116.575 1.00 0.00 H TER 92345 WAT 5666 ATOM 92345 O WAT 5667 109.707 85.317 144.786 1.00 0.00 O ATOM 92346 H1 WAT 5667 110.441 85.826 145.128 1.00 0.00 H ATOM 92347 H2 WAT 5667 109.563 84.634 145.440 1.00 0.00 H TER 92349 WAT 5667 ATOM 92349 O WAT 5668 128.312 80.629 26.526 1.00 0.00 O ATOM 92350 H1 WAT 5668 129.121 81.016 26.191 1.00 0.00 H ATOM 92351 H2 WAT 5668 127.834 81.366 26.906 1.00 0.00 H TER 92353 WAT 5668 ATOM 92353 O WAT 5669 43.967 9.199 118.890 1.00 0.00 O ATOM 92354 H1 WAT 5669 44.386 9.586 119.659 1.00 0.00 H ATOM 92355 H2 WAT 5669 44.282 9.725 118.155 1.00 0.00 H TER 92357 WAT 5669 ATOM 92357 O WAT 5670 68.132 89.303 101.746 1.00 0.00 O ATOM 92358 H1 WAT 5670 68.396 90.060 101.223 1.00 0.00 H ATOM 92359 H2 WAT 5670 68.737 89.301 102.487 1.00 0.00 H TER 92361 WAT 5670 ATOM 92361 O WAT 5671 99.398 113.935 62.466 1.00 0.00 O ATOM 92362 H1 WAT 5671 98.672 113.353 62.243 1.00 0.00 H ATOM 92363 H2 WAT 5671 99.040 114.817 62.357 1.00 0.00 H TER 92365 WAT 5671 ATOM 92365 O WAT 5672 96.928 55.778 70.614 1.00 0.00 O ATOM 92366 H1 WAT 5672 97.587 56.273 70.128 1.00 0.00 H ATOM 92367 H2 WAT 5672 96.331 56.444 70.955 1.00 0.00 H TER 92369 WAT 5672 ATOM 92369 O WAT 5673 113.796 119.674 62.729 1.00 0.00 O ATOM 92370 H1 WAT 5673 114.177 119.411 63.566 1.00 0.00 H ATOM 92371 H2 WAT 5673 113.104 119.032 62.568 1.00 0.00 H TER 92373 WAT 5673 ATOM 92373 O WAT 5674 103.591 124.344 87.408 1.00 0.00 O ATOM 92374 H1 WAT 5674 104.476 124.638 87.621 1.00 0.00 H ATOM 92375 H2 WAT 5674 103.467 123.554 87.934 1.00 0.00 H TER 92377 WAT 5674 ATOM 92377 O WAT 5675 116.317 21.898 73.505 1.00 0.00 O ATOM 92378 H1 WAT 5675 115.549 21.593 73.021 1.00 0.00 H ATOM 92379 H2 WAT 5675 115.961 22.255 74.319 1.00 0.00 H TER 92381 WAT 5675 ATOM 92381 O WAT 5676 120.180 113.228 89.024 1.00 0.00 O ATOM 92382 H1 WAT 5676 119.345 113.663 89.198 1.00 0.00 H ATOM 92383 H2 WAT 5676 119.941 112.434 88.546 1.00 0.00 H TER 92385 WAT 5676 ATOM 92385 O WAT 5677 63.785 137.280 157.203 1.00 0.00 O ATOM 92386 H1 WAT 5677 63.063 137.191 156.582 1.00 0.00 H ATOM 92387 H2 WAT 5677 63.391 137.097 158.056 1.00 0.00 H TER 92389 WAT 5677 ATOM 92389 O WAT 5678 67.694 140.793 76.377 1.00 0.00 O ATOM 92390 H1 WAT 5678 67.917 140.267 77.145 1.00 0.00 H ATOM 92391 H2 WAT 5678 67.660 140.163 75.657 1.00 0.00 H TER 92393 WAT 5678 ATOM 92393 O WAT 5679 106.883 30.512 103.276 1.00 0.00 O ATOM 92394 H1 WAT 5679 107.497 30.946 103.869 1.00 0.00 H ATOM 92395 H2 WAT 5679 107.120 30.835 102.407 1.00 0.00 H TER 92397 WAT 5679 ATOM 92397 O WAT 5680 67.073 48.955 18.531 1.00 0.00 O ATOM 92398 H1 WAT 5680 66.608 48.825 17.705 1.00 0.00 H ATOM 92399 H2 WAT 5680 66.758 48.251 19.098 1.00 0.00 H TER 92401 WAT 5680 ATOM 92401 O WAT 5681 12.342 2.774 86.143 1.00 0.00 O ATOM 92402 H1 WAT 5681 11.446 2.515 85.928 1.00 0.00 H ATOM 92403 H2 WAT 5681 12.301 3.041 87.062 1.00 0.00 H TER 92405 WAT 5681 ATOM 92405 O WAT 5682 18.272 69.114 23.401 1.00 0.00 O ATOM 92406 H1 WAT 5682 18.199 68.626 22.580 1.00 0.00 H ATOM 92407 H2 WAT 5682 19.093 68.809 23.788 1.00 0.00 H TER 92409 WAT 5682 ATOM 92409 O WAT 5683 130.889 47.196 156.485 1.00 0.00 O ATOM 92410 H1 WAT 5683 131.446 47.820 156.951 1.00 0.00 H ATOM 92411 H2 WAT 5683 130.029 47.289 156.895 1.00 0.00 H TER 92413 WAT 5683 ATOM 92413 O WAT 5684 81.639 119.710 63.913 1.00 0.00 O ATOM 92414 H1 WAT 5684 81.915 119.060 64.559 1.00 0.00 H ATOM 92415 H2 WAT 5684 81.725 119.262 63.071 1.00 0.00 H TER 92417 WAT 5684 ATOM 92417 O WAT 5685 42.022 118.676 106.792 1.00 0.00 O ATOM 92418 H1 WAT 5685 42.301 118.174 106.026 1.00 0.00 H ATOM 92419 H2 WAT 5685 41.285 119.201 106.478 1.00 0.00 H TER 92421 WAT 5685 ATOM 92421 O WAT 5686 84.906 85.439 124.577 1.00 0.00 O ATOM 92422 H1 WAT 5686 84.050 85.860 124.494 1.00 0.00 H ATOM 92423 H2 WAT 5686 84.724 84.611 125.021 1.00 0.00 H TER 92425 WAT 5686 ATOM 92425 O WAT 5687 133.340 133.691 136.032 1.00 0.00 O ATOM 92426 H1 WAT 5687 133.616 132.961 135.478 1.00 0.00 H ATOM 92427 H2 WAT 5687 134.011 133.742 136.713 1.00 0.00 H TER 92429 WAT 5687 ATOM 92429 O WAT 5688 130.320 93.978 148.374 1.00 0.00 O ATOM 92430 H1 WAT 5688 130.573 94.711 147.812 1.00 0.00 H ATOM 92431 H2 WAT 5688 130.489 93.200 147.842 1.00 0.00 H TER 92433 WAT 5688 ATOM 92433 O WAT 5689 71.928 99.629 138.743 1.00 0.00 O ATOM 92434 H1 WAT 5689 72.061 99.401 137.823 1.00 0.00 H ATOM 92435 H2 WAT 5689 72.198 98.848 139.225 1.00 0.00 H TER 92437 WAT 5689 ATOM 92437 O WAT 5690 87.315 60.871 130.806 1.00 0.00 O ATOM 92438 H1 WAT 5690 87.763 60.043 130.977 1.00 0.00 H ATOM 92439 H2 WAT 5690 87.886 61.330 130.190 1.00 0.00 H TER 92441 WAT 5690 ATOM 92441 O WAT 5691 101.104 113.365 67.278 1.00 0.00 O ATOM 92442 H1 WAT 5691 100.563 112.998 67.978 1.00 0.00 H ATOM 92443 H2 WAT 5691 101.330 112.613 66.731 1.00 0.00 H TER 92445 WAT 5691 ATOM 92445 O WAT 5692 16.444 13.748 11.225 1.00 0.00 O ATOM 92446 H1 WAT 5692 16.179 14.637 10.988 1.00 0.00 H ATOM 92447 H2 WAT 5692 16.060 13.607 12.091 1.00 0.00 H TER 92449 WAT 5692 ATOM 92449 O WAT 5693 113.777 73.498 125.386 1.00 0.00 O ATOM 92450 H1 WAT 5693 113.809 74.192 124.729 1.00 0.00 H ATOM 92451 H2 WAT 5693 114.229 73.866 126.146 1.00 0.00 H TER 92453 WAT 5693 ATOM 92453 O WAT 5694 11.142 126.828 93.803 1.00 0.00 O ATOM 92454 H1 WAT 5694 11.696 126.495 93.097 1.00 0.00 H ATOM 92455 H2 WAT 5694 10.835 126.044 94.257 1.00 0.00 H TER 92457 WAT 5694 ATOM 92457 O WAT 5695 51.103 41.863 143.605 1.00 0.00 O ATOM 92458 H1 WAT 5695 51.742 41.808 144.316 1.00 0.00 H ATOM 92459 H2 WAT 5695 50.372 42.356 143.977 1.00 0.00 H TER 92461 WAT 5695 ATOM 92461 O WAT 5696 127.432 14.405 22.286 1.00 0.00 O ATOM 92462 H1 WAT 5696 126.935 13.867 22.902 1.00 0.00 H ATOM 92463 H2 WAT 5696 128.287 13.979 22.231 1.00 0.00 H TER 92465 WAT 5696 ATOM 92465 O WAT 5697 128.953 57.326 74.543 1.00 0.00 O ATOM 92466 H1 WAT 5697 128.656 58.223 74.698 1.00 0.00 H ATOM 92467 H2 WAT 5697 129.697 57.419 73.948 1.00 0.00 H TER 92469 WAT 5697 ATOM 92469 O WAT 5698 128.305 143.515 104.730 1.00 0.00 O ATOM 92470 H1 WAT 5698 127.647 142.849 104.535 1.00 0.00 H ATOM 92471 H2 WAT 5698 128.816 143.143 105.450 1.00 0.00 H TER 92473 WAT 5698 ATOM 92473 O WAT 5699 20.350 110.510 146.800 1.00 0.00 O ATOM 92474 H1 WAT 5699 19.995 109.654 146.561 1.00 0.00 H ATOM 92475 H2 WAT 5699 21.181 110.313 147.232 1.00 0.00 H TER 92477 WAT 5699 ATOM 92477 O WAT 5700 106.178 77.210 105.140 1.00 0.00 O ATOM 92478 H1 WAT 5700 106.902 77.504 105.693 1.00 0.00 H ATOM 92479 H2 WAT 5700 105.422 77.188 105.728 1.00 0.00 H TER 92481 WAT 5700 ATOM 92481 O WAT 5701 17.263 121.178 153.222 1.00 0.00 O ATOM 92482 H1 WAT 5701 17.141 120.288 152.892 1.00 0.00 H ATOM 92483 H2 WAT 5701 16.413 121.414 153.595 1.00 0.00 H TER 92485 WAT 5701 ATOM 92485 O WAT 5702 54.736 119.938 49.332 1.00 0.00 O ATOM 92486 H1 WAT 5702 54.505 120.011 48.406 1.00 0.00 H ATOM 92487 H2 WAT 5702 54.029 120.391 49.792 1.00 0.00 H TER 92489 WAT 5702 ATOM 92489 O WAT 5703 51.210 59.177 116.284 1.00 0.00 O ATOM 92490 H1 WAT 5703 52.062 59.612 116.291 1.00 0.00 H ATOM 92491 H2 WAT 5703 51.416 58.245 116.356 1.00 0.00 H TER 92493 WAT 5703 ATOM 92493 O WAT 5704 127.487 94.152 153.820 1.00 0.00 O ATOM 92494 H1 WAT 5704 127.737 93.275 154.112 1.00 0.00 H ATOM 92495 H2 WAT 5704 127.417 94.076 152.868 1.00 0.00 H TER 92497 WAT 5704 ATOM 92497 O WAT 5705 127.194 132.897 1.173 1.00 0.00 O ATOM 92498 H1 WAT 5705 127.078 132.641 2.088 1.00 0.00 H ATOM 92499 H2 WAT 5705 126.304 132.950 0.825 1.00 0.00 H TER 92501 WAT 5705 ATOM 92501 O WAT 5706 12.245 63.090 62.682 1.00 0.00 O ATOM 92502 H1 WAT 5706 11.322 63.118 62.934 1.00 0.00 H ATOM 92503 H2 WAT 5706 12.488 62.168 62.766 1.00 0.00 H TER 92505 WAT 5706 ATOM 92505 O WAT 5707 92.766 21.532 115.596 1.00 0.00 O ATOM 92506 H1 WAT 5707 92.047 22.092 115.889 1.00 0.00 H ATOM 92507 H2 WAT 5707 92.767 21.623 114.643 1.00 0.00 H TER 92509 WAT 5707 ATOM 92509 O WAT 5708 34.222 49.218 85.454 1.00 0.00 O ATOM 92510 H1 WAT 5708 34.776 49.322 86.227 1.00 0.00 H ATOM 92511 H2 WAT 5708 34.135 50.103 85.101 1.00 0.00 H TER 92513 WAT 5708 ATOM 92513 O WAT 5709 99.912 104.741 5.829 1.00 0.00 O ATOM 92514 H1 WAT 5709 99.660 105.194 5.024 1.00 0.00 H ATOM 92515 H2 WAT 5709 99.339 103.975 5.862 1.00 0.00 H TER 92517 WAT 5709 ATOM 92517 O WAT 5710 110.117 43.639 59.664 1.00 0.00 O ATOM 92518 H1 WAT 5710 109.779 44.168 60.387 1.00 0.00 H ATOM 92519 H2 WAT 5710 111.049 43.854 59.625 1.00 0.00 H TER 92521 WAT 5710 ATOM 92521 O WAT 5711 88.058 130.268 12.372 1.00 0.00 O ATOM 92522 H1 WAT 5711 88.066 129.508 11.791 1.00 0.00 H ATOM 92523 H2 WAT 5711 87.130 130.463 12.499 1.00 0.00 H TER 92525 WAT 5711 ATOM 92525 O WAT 5712 51.435 99.683 78.281 1.00 0.00 O ATOM 92526 H1 WAT 5712 50.781 99.682 78.980 1.00 0.00 H ATOM 92527 H2 WAT 5712 51.125 99.022 77.662 1.00 0.00 H TER 92529 WAT 5712 ATOM 92529 O WAT 5713 73.902 40.698 10.023 1.00 0.00 O ATOM 92530 H1 WAT 5713 72.973 40.512 9.890 1.00 0.00 H ATOM 92531 H2 WAT 5713 74.263 40.761 9.139 1.00 0.00 H TER 92533 WAT 5713 ATOM 92533 O WAT 5714 64.117 23.017 109.289 1.00 0.00 O ATOM 92534 H1 WAT 5714 63.808 22.879 110.184 1.00 0.00 H ATOM 92535 H2 WAT 5714 63.583 22.426 108.758 1.00 0.00 H TER 92537 WAT 5714 ATOM 92537 O WAT 5715 54.150 120.382 119.145 1.00 0.00 O ATOM 92538 H1 WAT 5715 54.074 121.336 119.130 1.00 0.00 H ATOM 92539 H2 WAT 5715 54.443 120.178 120.033 1.00 0.00 H TER 92541 WAT 5715 ATOM 92541 O WAT 5716 0.524 32.685 11.685 1.00 0.00 O ATOM 92542 H1 WAT 5716 0.759 33.409 12.266 1.00 0.00 H ATOM 92543 H2 WAT 5716 -0.426 32.755 11.589 1.00 0.00 H TER 92545 WAT 5716 ATOM 92545 O WAT 5717 91.015 45.936 139.617 1.00 0.00 O ATOM 92546 H1 WAT 5717 90.384 46.124 140.311 1.00 0.00 H ATOM 92547 H2 WAT 5717 90.651 46.363 138.841 1.00 0.00 H TER 92549 WAT 5717 ATOM 92549 O WAT 5718 7.250 128.119 150.706 1.00 0.00 O ATOM 92550 H1 WAT 5718 6.768 128.133 151.533 1.00 0.00 H ATOM 92551 H2 WAT 5718 7.958 128.751 150.831 1.00 0.00 H TER 92553 WAT 5718 ATOM 92553 O WAT 5719 114.338 97.742 9.462 1.00 0.00 O ATOM 92554 H1 WAT 5719 114.363 97.607 10.409 1.00 0.00 H ATOM 92555 H2 WAT 5719 114.527 98.674 9.348 1.00 0.00 H TER 92557 WAT 5719 ATOM 92557 O WAT 5720 60.010 -0.010 6.602 1.00 0.00 O ATOM 92558 H1 WAT 5720 60.748 0.024 5.994 1.00 0.00 H ATOM 92559 H2 WAT 5720 60.108 0.774 7.142 1.00 0.00 H TER 92561 WAT 5720 ATOM 92561 O WAT 5721 63.925 56.285 135.977 1.00 0.00 O ATOM 92562 H1 WAT 5721 64.324 56.232 135.109 1.00 0.00 H ATOM 92563 H2 WAT 5721 64.667 56.362 136.578 1.00 0.00 H TER 92565 WAT 5721 ATOM 92565 O WAT 5722 83.319 127.438 74.004 1.00 0.00 O ATOM 92566 H1 WAT 5722 83.058 128.170 74.564 1.00 0.00 H ATOM 92567 H2 WAT 5722 84.260 127.558 73.877 1.00 0.00 H TER 92569 WAT 5722 ATOM 92569 O WAT 5723 95.008 66.048 67.185 1.00 0.00 O ATOM 92570 H1 WAT 5723 95.956 66.066 67.052 1.00 0.00 H ATOM 92571 H2 WAT 5723 94.821 65.148 67.453 1.00 0.00 H TER 92573 WAT 5723 ATOM 92573 O WAT 5724 36.403 74.105 82.251 1.00 0.00 O ATOM 92574 H1 WAT 5724 36.532 74.948 82.686 1.00 0.00 H ATOM 92575 H2 WAT 5724 36.498 73.458 82.950 1.00 0.00 H TER 92577 WAT 5724 ATOM 92577 O WAT 5725 103.322 99.800 20.401 1.00 0.00 O ATOM 92578 H1 WAT 5725 103.921 99.989 21.123 1.00 0.00 H ATOM 92579 H2 WAT 5725 103.279 100.618 19.906 1.00 0.00 H TER 92581 WAT 5725 ATOM 92581 O WAT 5726 89.144 88.586 76.653 1.00 0.00 O ATOM 92582 H1 WAT 5726 89.495 88.908 75.822 1.00 0.00 H ATOM 92583 H2 WAT 5726 88.726 87.755 76.430 1.00 0.00 H TER 92585 WAT 5726 ATOM 92585 O WAT 5727 33.327 104.160 144.089 1.00 0.00 O ATOM 92586 H1 WAT 5727 33.432 104.035 143.146 1.00 0.00 H ATOM 92587 H2 WAT 5727 33.045 105.071 144.180 1.00 0.00 H TER 92589 WAT 5727 ATOM 92589 O WAT 5728 38.077 47.574 23.655 1.00 0.00 O ATOM 92590 H1 WAT 5728 38.598 47.862 24.405 1.00 0.00 H ATOM 92591 H2 WAT 5728 37.319 47.136 24.043 1.00 0.00 H TER 92593 WAT 5728 ATOM 92593 O WAT 5729 33.488 117.659 134.634 1.00 0.00 O ATOM 92594 H1 WAT 5729 32.539 117.529 134.618 1.00 0.00 H ATOM 92595 H2 WAT 5729 33.617 118.406 135.220 1.00 0.00 H TER 92597 WAT 5729 ATOM 92597 O WAT 5730 51.706 125.081 154.556 1.00 0.00 O ATOM 92598 H1 WAT 5730 50.906 124.556 154.584 1.00 0.00 H ATOM 92599 H2 WAT 5730 51.410 125.977 154.714 1.00 0.00 H TER 92601 WAT 5730 ATOM 92601 O WAT 5731 99.864 60.690 24.090 1.00 0.00 O ATOM 92602 H1 WAT 5731 100.281 60.168 23.404 1.00 0.00 H ATOM 92603 H2 WAT 5731 100.593 61.036 24.604 1.00 0.00 H TER 92605 WAT 5731 ATOM 92605 O WAT 5732 107.070 72.832 114.549 1.00 0.00 O ATOM 92606 H1 WAT 5732 106.934 73.611 114.010 1.00 0.00 H ATOM 92607 H2 WAT 5732 108.021 72.733 114.592 1.00 0.00 H TER 92609 WAT 5732 ATOM 92609 O WAT 5733 138.186 21.032 71.209 1.00 0.00 O ATOM 92610 H1 WAT 5733 138.137 20.270 71.786 1.00 0.00 H ATOM 92611 H2 WAT 5733 137.515 20.874 70.546 1.00 0.00 H TER 92613 WAT 5733 ATOM 92613 O WAT 5734 70.730 66.971 107.425 1.00 0.00 O ATOM 92614 H1 WAT 5734 69.777 67.047 107.405 1.00 0.00 H ATOM 92615 H2 WAT 5734 71.015 67.675 108.006 1.00 0.00 H TER 92617 WAT 5734 ATOM 92617 O WAT 5735 22.652 91.557 7.381 1.00 0.00 O ATOM 92618 H1 WAT 5735 23.441 91.168 7.758 1.00 0.00 H ATOM 92619 H2 WAT 5735 21.976 90.891 7.503 1.00 0.00 H TER 92621 WAT 5735 ATOM 92621 O WAT 5736 105.972 50.475 10.835 1.00 0.00 O ATOM 92622 H1 WAT 5736 106.385 50.450 11.699 1.00 0.00 H ATOM 92623 H2 WAT 5736 105.971 49.563 10.544 1.00 0.00 H TER 92625 WAT 5736 ATOM 92625 O WAT 5737 74.442 113.148 85.062 1.00 0.00 O ATOM 92626 H1 WAT 5737 74.444 112.244 85.378 1.00 0.00 H ATOM 92627 H2 WAT 5737 74.764 113.088 84.163 1.00 0.00 H TER 92629 WAT 5737 ATOM 92629 O WAT 5738 12.132 121.413 82.201 1.00 0.00 O ATOM 92630 H1 WAT 5738 11.930 121.683 81.305 1.00 0.00 H ATOM 92631 H2 WAT 5738 11.637 120.604 82.324 1.00 0.00 H TER 92633 WAT 5738 ATOM 92633 O WAT 5739 145.697 43.717 124.699 1.00 0.00 O ATOM 92634 H1 WAT 5739 145.164 44.165 124.043 1.00 0.00 H ATOM 92635 H2 WAT 5739 145.529 44.194 125.511 1.00 0.00 H TER 92637 WAT 5739 ATOM 92637 O WAT 5740 56.744 95.449 86.125 1.00 0.00 O ATOM 92638 H1 WAT 5740 57.023 96.068 86.801 1.00 0.00 H ATOM 92639 H2 WAT 5740 56.845 94.589 86.532 1.00 0.00 H TER 92641 WAT 5740 ATOM 92641 O WAT 5741 125.333 97.292 133.250 1.00 0.00 O ATOM 92642 H1 WAT 5741 125.806 98.122 133.193 1.00 0.00 H ATOM 92643 H2 WAT 5741 125.320 97.087 134.185 1.00 0.00 H TER 92645 WAT 5741 ATOM 92645 O WAT 5742 56.065 13.755 133.718 1.00 0.00 O ATOM 92646 H1 WAT 5742 56.328 13.305 134.521 1.00 0.00 H ATOM 92647 H2 WAT 5742 55.421 14.402 134.007 1.00 0.00 H TER 92649 WAT 5742 ATOM 92649 O WAT 5743 7.963 105.155 57.643 1.00 0.00 O ATOM 92650 H1 WAT 5743 7.913 106.080 57.883 1.00 0.00 H ATOM 92651 H2 WAT 5743 7.350 104.720 58.236 1.00 0.00 H TER 92653 WAT 5743 ATOM 92653 O WAT 5744 5.769 6.232 110.203 1.00 0.00 O ATOM 92654 H1 WAT 5744 6.512 6.447 110.767 1.00 0.00 H ATOM 92655 H2 WAT 5744 5.043 6.746 110.558 1.00 0.00 H TER 92657 WAT 5744 ATOM 92657 O WAT 5745 139.011 56.240 4.471 1.00 0.00 O ATOM 92658 H1 WAT 5745 138.965 57.009 5.039 1.00 0.00 H ATOM 92659 H2 WAT 5745 138.529 55.563 4.945 1.00 0.00 H TER 92661 WAT 5745 ATOM 92661 O WAT 5746 89.382 115.058 85.503 1.00 0.00 O ATOM 92662 H1 WAT 5746 90.151 114.584 85.819 1.00 0.00 H ATOM 92663 H2 WAT 5746 88.672 114.773 86.079 1.00 0.00 H TER 92665 WAT 5746 ATOM 92665 O WAT 5747 77.630 106.161 61.294 1.00 0.00 O ATOM 92666 H1 WAT 5747 78.173 105.381 61.182 1.00 0.00 H ATOM 92667 H2 WAT 5747 78.093 106.683 61.949 1.00 0.00 H TER 92669 WAT 5747 ATOM 92669 O WAT 5748 47.237 4.174 65.181 1.00 0.00 O ATOM 92670 H1 WAT 5748 46.318 4.439 65.176 1.00 0.00 H ATOM 92671 H2 WAT 5748 47.724 4.995 65.107 1.00 0.00 H TER 92673 WAT 5748 ATOM 92673 O WAT 5749 106.096 68.767 148.784 1.00 0.00 O ATOM 92674 H1 WAT 5749 106.689 68.110 148.421 1.00 0.00 H ATOM 92675 H2 WAT 5749 105.612 68.302 149.466 1.00 0.00 H TER 92677 WAT 5749 ATOM 92677 O WAT 5750 68.237 128.535 129.534 1.00 0.00 O ATOM 92678 H1 WAT 5750 69.063 128.240 129.149 1.00 0.00 H ATOM 92679 H2 WAT 5750 68.029 127.872 130.192 1.00 0.00 H TER 92681 WAT 5750 ATOM 92681 O WAT 5751 92.306 68.945 82.472 1.00 0.00 O ATOM 92682 H1 WAT 5751 92.799 69.225 81.700 1.00 0.00 H ATOM 92683 H2 WAT 5751 92.078 69.761 82.919 1.00 0.00 H TER 92685 WAT 5751 ATOM 92685 O WAT 5752 85.304 26.891 58.840 1.00 0.00 O ATOM 92686 H1 WAT 5752 84.833 27.685 58.586 1.00 0.00 H ATOM 92687 H2 WAT 5752 85.772 26.625 58.049 1.00 0.00 H TER 92689 WAT 5752 ATOM 92689 O WAT 5753 34.170 113.947 137.666 1.00 0.00 O ATOM 92690 H1 WAT 5753 33.749 113.523 138.414 1.00 0.00 H ATOM 92691 H2 WAT 5753 33.730 113.578 136.901 1.00 0.00 H TER 92693 WAT 5753 ATOM 92693 O WAT 5754 46.526 72.180 5.085 1.00 0.00 O ATOM 92694 H1 WAT 5754 46.458 73.087 4.786 1.00 0.00 H ATOM 92695 H2 WAT 5754 47.253 71.815 4.580 1.00 0.00 H TER 92697 WAT 5754 ATOM 92697 O WAT 5755 76.191 47.450 154.490 1.00 0.00 O ATOM 92698 H1 WAT 5755 76.079 48.218 155.050 1.00 0.00 H ATOM 92699 H2 WAT 5755 76.321 46.724 155.101 1.00 0.00 H TER 92701 WAT 5755 ATOM 92701 O WAT 5756 94.604 2.673 116.297 1.00 0.00 O ATOM 92702 H1 WAT 5756 94.670 2.218 117.137 1.00 0.00 H ATOM 92703 H2 WAT 5756 94.005 3.400 116.465 1.00 0.00 H TER 92705 WAT 5756 ATOM 92705 O WAT 5757 103.467 10.540 99.817 1.00 0.00 O ATOM 92706 H1 WAT 5757 104.272 11.043 99.694 1.00 0.00 H ATOM 92707 H2 WAT 5757 103.028 10.968 100.552 1.00 0.00 H TER 92709 WAT 5757 ATOM 92709 O WAT 5758 57.976 102.608 64.820 1.00 0.00 O ATOM 92710 H1 WAT 5758 58.770 103.143 64.852 1.00 0.00 H ATOM 92711 H2 WAT 5758 58.271 101.728 65.053 1.00 0.00 H TER 92713 WAT 5758 ATOM 92713 O WAT 5759 46.676 34.799 25.845 1.00 0.00 O ATOM 92714 H1 WAT 5759 45.948 34.734 26.462 1.00 0.00 H ATOM 92715 H2 WAT 5759 46.379 35.430 25.190 1.00 0.00 H TER 92717 WAT 5759 ATOM 92717 O WAT 5760 31.205 124.853 67.630 1.00 0.00 O ATOM 92718 H1 WAT 5760 31.103 124.218 68.339 1.00 0.00 H ATOM 92719 H2 WAT 5760 32.097 125.184 67.731 1.00 0.00 H TER 92721 WAT 5760 ATOM 92721 O WAT 5761 9.525 28.162 144.771 1.00 0.00 O ATOM 92722 H1 WAT 5761 8.580 28.009 144.735 1.00 0.00 H ATOM 92723 H2 WAT 5761 9.751 28.050 145.694 1.00 0.00 H TER 92725 WAT 5761 ATOM 92725 O WAT 5762 140.588 34.993 61.943 1.00 0.00 O ATOM 92726 H1 WAT 5762 141.087 35.239 61.164 1.00 0.00 H ATOM 92727 H2 WAT 5762 139.748 35.439 61.839 1.00 0.00 H TER 92729 WAT 5762 ATOM 92729 O WAT 5763 49.208 129.839 91.470 1.00 0.00 O ATOM 92730 H1 WAT 5763 50.106 130.124 91.641 1.00 0.00 H ATOM 92731 H2 WAT 5763 48.868 129.591 92.330 1.00 0.00 H TER 92733 WAT 5763 ATOM 92733 O WAT 5764 65.117 133.105 157.240 1.00 0.00 O ATOM 92734 H1 WAT 5764 64.200 133.356 157.127 1.00 0.00 H ATOM 92735 H2 WAT 5764 65.536 133.885 157.604 1.00 0.00 H TER 92737 WAT 5764 ATOM 92737 O WAT 5765 39.043 125.305 104.422 1.00 0.00 O ATOM 92738 H1 WAT 5765 39.108 124.608 105.074 1.00 0.00 H ATOM 92739 H2 WAT 5765 39.658 125.048 103.735 1.00 0.00 H TER 92741 WAT 5765 ATOM 92741 O WAT 5766 76.821 50.455 98.717 1.00 0.00 O ATOM 92742 H1 WAT 5766 76.820 49.764 98.054 1.00 0.00 H ATOM 92743 H2 WAT 5766 77.116 51.235 98.248 1.00 0.00 H TER 92745 WAT 5766 ATOM 92745 O WAT 5767 115.685 80.598 1.390 1.00 0.00 O ATOM 92746 H1 WAT 5767 115.736 81.353 1.977 1.00 0.00 H ATOM 92747 H2 WAT 5767 115.708 79.839 1.973 1.00 0.00 H TER 92749 WAT 5767 ATOM 92749 O WAT 5768 70.300 64.419 92.277 1.00 0.00 O ATOM 92750 H1 WAT 5768 70.789 64.681 93.057 1.00 0.00 H ATOM 92751 H2 WAT 5768 69.944 63.558 92.496 1.00 0.00 H TER 92753 WAT 5768 ATOM 92753 O WAT 5769 14.788 123.686 66.289 1.00 0.00 O ATOM 92754 H1 WAT 5769 14.156 123.066 65.926 1.00 0.00 H ATOM 92755 H2 WAT 5769 14.368 124.541 66.193 1.00 0.00 H TER 92757 WAT 5769 ATOM 92757 O WAT 5770 118.525 145.535 154.835 1.00 0.00 O ATOM 92758 H1 WAT 5770 119.346 146.011 154.961 1.00 0.00 H ATOM 92759 H2 WAT 5770 118.008 145.739 155.614 1.00 0.00 H TER 92761 WAT 5770 ATOM 92761 O WAT 5771 44.418 36.055 11.974 1.00 0.00 O ATOM 92762 H1 WAT 5771 44.322 36.137 11.025 1.00 0.00 H ATOM 92763 H2 WAT 5771 43.593 36.389 12.328 1.00 0.00 H TER 92765 WAT 5771 ATOM 92765 O WAT 5772 30.017 68.550 90.778 1.00 0.00 O ATOM 92766 H1 WAT 5772 30.337 68.055 91.532 1.00 0.00 H ATOM 92767 H2 WAT 5772 29.660 67.885 90.189 1.00 0.00 H TER 92769 WAT 5772 ATOM 92769 O WAT 5773 86.947 8.455 90.857 1.00 0.00 O ATOM 92770 H1 WAT 5773 87.069 7.507 90.892 1.00 0.00 H ATOM 92771 H2 WAT 5773 86.194 8.622 91.424 1.00 0.00 H TER 92773 WAT 5773 ATOM 92773 O WAT 5774 30.548 134.218 65.161 1.00 0.00 O ATOM 92774 H1 WAT 5774 29.998 133.603 65.647 1.00 0.00 H ATOM 92775 H2 WAT 5774 30.512 135.027 65.671 1.00 0.00 H TER 92777 WAT 5774 ATOM 92777 O WAT 5775 89.996 19.972 133.277 1.00 0.00 O ATOM 92778 H1 WAT 5775 89.994 20.910 133.088 1.00 0.00 H ATOM 92779 H2 WAT 5775 90.474 19.895 134.103 1.00 0.00 H TER 92781 WAT 5775 ATOM 92781 O WAT 5776 44.756 18.130 118.320 1.00 0.00 O ATOM 92782 H1 WAT 5776 44.597 18.517 119.181 1.00 0.00 H ATOM 92783 H2 WAT 5776 45.708 18.060 118.261 1.00 0.00 H TER 92785 WAT 5776 ATOM 92785 O WAT 5777 58.671 58.093 122.024 1.00 0.00 O ATOM 92786 H1 WAT 5777 58.986 57.203 122.179 1.00 0.00 H ATOM 92787 H2 WAT 5777 59.354 58.656 122.386 1.00 0.00 H TER 92789 WAT 5777 ATOM 92789 O WAT 5778 70.099 7.538 80.865 1.00 0.00 O ATOM 92790 H1 WAT 5778 69.409 7.846 80.277 1.00 0.00 H ATOM 92791 H2 WAT 5778 69.697 7.554 81.734 1.00 0.00 H TER 92793 WAT 5778 ATOM 92793 O WAT 5779 141.831 9.081 147.867 1.00 0.00 O ATOM 92794 H1 WAT 5779 141.881 9.440 148.753 1.00 0.00 H ATOM 92795 H2 WAT 5779 141.063 9.501 147.480 1.00 0.00 H TER 92797 WAT 5779 ATOM 92797 O WAT 5780 127.033 86.616 150.621 1.00 0.00 O ATOM 92798 H1 WAT 5780 127.426 85.920 150.094 1.00 0.00 H ATOM 92799 H2 WAT 5780 126.093 86.441 150.586 1.00 0.00 H TER 92801 WAT 5780 ATOM 92801 O WAT 5781 21.747 105.627 81.111 1.00 0.00 O ATOM 92802 H1 WAT 5781 21.792 106.513 81.471 1.00 0.00 H ATOM 92803 H2 WAT 5781 21.068 105.193 81.628 1.00 0.00 H TER 92805 WAT 5781 ATOM 92805 O WAT 5782 112.283 140.171 118.885 1.00 0.00 O ATOM 92806 H1 WAT 5782 112.725 139.582 118.274 1.00 0.00 H ATOM 92807 H2 WAT 5782 111.352 140.054 118.700 1.00 0.00 H TER 92809 WAT 5782 ATOM 92809 O WAT 5783 73.309 70.063 6.934 1.00 0.00 O ATOM 92810 H1 WAT 5783 73.922 70.546 6.380 1.00 0.00 H ATOM 92811 H2 WAT 5783 73.794 69.903 7.744 1.00 0.00 H TER 92813 WAT 5783 ATOM 92813 O WAT 5784 51.678 5.989 74.697 1.00 0.00 O ATOM 92814 H1 WAT 5784 52.026 6.711 75.221 1.00 0.00 H ATOM 92815 H2 WAT 5784 51.189 6.418 73.994 1.00 0.00 H TER 92817 WAT 5784 ATOM 92817 O WAT 5785 82.490 117.022 80.523 1.00 0.00 O ATOM 92818 H1 WAT 5785 83.186 116.950 79.869 1.00 0.00 H ATOM 92819 H2 WAT 5785 82.945 117.254 81.332 1.00 0.00 H TER 92821 WAT 5785 ATOM 92821 O WAT 5786 97.222 102.941 79.218 1.00 0.00 O ATOM 92822 H1 WAT 5786 97.263 103.665 79.842 1.00 0.00 H ATOM 92823 H2 WAT 5786 96.387 103.061 78.767 1.00 0.00 H TER 92825 WAT 5786 ATOM 92825 O WAT 5787 20.608 68.362 84.342 1.00 0.00 O ATOM 92826 H1 WAT 5787 19.974 68.115 83.669 1.00 0.00 H ATOM 92827 H2 WAT 5787 20.513 67.692 85.019 1.00 0.00 H TER 92829 WAT 5787 ATOM 92829 O WAT 5788 121.160 1.461 66.400 1.00 0.00 O ATOM 92830 H1 WAT 5788 120.974 0.591 66.046 1.00 0.00 H ATOM 92831 H2 WAT 5788 120.495 2.026 66.007 1.00 0.00 H TER 92833 WAT 5788 ATOM 92833 O WAT 5789 135.370 80.835 16.353 1.00 0.00 O ATOM 92834 H1 WAT 5789 135.396 80.516 17.256 1.00 0.00 H ATOM 92835 H2 WAT 5789 135.464 81.784 16.431 1.00 0.00 H TER 92837 WAT 5789 ATOM 92837 O WAT 5790 67.563 107.486 88.231 1.00 0.00 O ATOM 92838 H1 WAT 5790 67.953 108.286 87.877 1.00 0.00 H ATOM 92839 H2 WAT 5790 68.145 107.233 88.948 1.00 0.00 H TER 92841 WAT 5790 ATOM 92841 O WAT 5791 73.348 137.262 79.612 1.00 0.00 O ATOM 92842 H1 WAT 5791 73.413 137.738 80.440 1.00 0.00 H ATOM 92843 H2 WAT 5791 73.093 137.927 78.973 1.00 0.00 H TER 92845 WAT 5791 ATOM 92845 O WAT 5792 22.991 102.433 28.183 1.00 0.00 O ATOM 92846 H1 WAT 5792 22.220 102.186 27.672 1.00 0.00 H ATOM 92847 H2 WAT 5792 22.703 103.184 28.702 1.00 0.00 H TER 92849 WAT 5792 ATOM 92849 O WAT 5793 64.821 42.440 111.451 1.00 0.00 O ATOM 92850 H1 WAT 5793 64.199 43.123 111.202 1.00 0.00 H ATOM 92851 H2 WAT 5793 64.273 41.693 111.691 1.00 0.00 H TER 92853 WAT 5793 ATOM 92853 O WAT 5794 32.448 55.014 61.606 1.00 0.00 O ATOM 92854 H1 WAT 5794 33.271 55.490 61.721 1.00 0.00 H ATOM 92855 H2 WAT 5794 31.844 55.429 62.222 1.00 0.00 H TER 92857 WAT 5794 ATOM 92857 O WAT 5795 27.968 138.678 150.208 1.00 0.00 O ATOM 92858 H1 WAT 5795 28.468 139.273 149.650 1.00 0.00 H ATOM 92859 H2 WAT 5795 27.300 139.232 150.611 1.00 0.00 H TER 92861 WAT 5795 ATOM 92861 O WAT 5796 134.584 133.621 73.067 1.00 0.00 O ATOM 92862 H1 WAT 5796 134.987 132.934 73.598 1.00 0.00 H ATOM 92863 H2 WAT 5796 135.227 133.801 72.381 1.00 0.00 H TER 92865 WAT 5796 ATOM 92865 O WAT 5797 83.163 138.349 113.482 1.00 0.00 O ATOM 92866 H1 WAT 5797 82.642 139.029 113.057 1.00 0.00 H ATOM 92867 H2 WAT 5797 83.616 137.909 112.762 1.00 0.00 H TER 92869 WAT 5797 ATOM 92869 O WAT 5798 123.414 39.320 60.788 1.00 0.00 O ATOM 92870 H1 WAT 5798 123.682 39.938 60.108 1.00 0.00 H ATOM 92871 H2 WAT 5798 123.937 39.563 61.552 1.00 0.00 H TER 92873 WAT 5798 ATOM 92873 O WAT 5799 71.881 9.808 4.471 1.00 0.00 O ATOM 92874 H1 WAT 5799 72.000 10.702 4.793 1.00 0.00 H ATOM 92875 H2 WAT 5799 72.750 9.546 4.168 1.00 0.00 H TER 92877 WAT 5799 ATOM 92877 O WAT 5800 40.448 6.779 76.135 1.00 0.00 O ATOM 92878 H1 WAT 5800 40.847 5.915 76.238 1.00 0.00 H ATOM 92879 H2 WAT 5800 40.230 7.051 77.027 1.00 0.00 H TER 92881 WAT 5800 ATOM 92881 O WAT 5801 83.832 141.036 65.201 1.00 0.00 O ATOM 92882 H1 WAT 5801 84.247 140.730 66.007 1.00 0.00 H ATOM 92883 H2 WAT 5801 84.384 140.688 64.501 1.00 0.00 H TER 92885 WAT 5801 ATOM 92885 O WAT 5802 79.576 29.405 157.718 1.00 0.00 O ATOM 92886 H1 WAT 5802 79.304 28.950 156.921 1.00 0.00 H ATOM 92887 H2 WAT 5802 79.726 28.705 158.354 1.00 0.00 H TER 92889 WAT 5802 ATOM 92889 O WAT 5803 133.467 129.089 97.527 1.00 0.00 O ATOM 92890 H1 WAT 5803 132.750 128.961 98.149 1.00 0.00 H ATOM 92891 H2 WAT 5803 134.233 129.256 98.076 1.00 0.00 H TER 92893 WAT 5803 ATOM 92893 O WAT 5804 62.813 133.578 3.332 1.00 0.00 O ATOM 92894 H1 WAT 5804 63.507 133.912 2.763 1.00 0.00 H ATOM 92895 H2 WAT 5804 62.037 134.080 3.083 1.00 0.00 H TER 92897 WAT 5804 ATOM 92897 O WAT 5805 105.071 117.744 70.242 1.00 0.00 O ATOM 92898 H1 WAT 5805 105.282 117.122 69.546 1.00 0.00 H ATOM 92899 H2 WAT 5805 104.156 117.561 70.457 1.00 0.00 H TER 92901 WAT 5805 ATOM 92901 O WAT 5806 83.747 62.924 91.221 1.00 0.00 O ATOM 92902 H1 WAT 5806 84.217 62.450 91.907 1.00 0.00 H ATOM 92903 H2 WAT 5806 83.510 62.251 90.583 1.00 0.00 H TER 92905 WAT 5806 ATOM 92905 O WAT 5807 13.095 97.768 152.297 1.00 0.00 O ATOM 92906 H1 WAT 5807 13.884 98.171 151.934 1.00 0.00 H ATOM 92907 H2 WAT 5807 12.394 98.037 151.704 1.00 0.00 H TER 92909 WAT 5807 ATOM 92909 O WAT 5808 129.402 16.096 96.031 1.00 0.00 O ATOM 92910 H1 WAT 5808 128.669 16.238 95.432 1.00 0.00 H ATOM 92911 H2 WAT 5808 130.180 16.157 95.476 1.00 0.00 H TER 92913 WAT 5808 ATOM 92913 O WAT 5809 25.342 122.683 133.748 1.00 0.00 O ATOM 92914 H1 WAT 5809 24.659 122.037 133.571 1.00 0.00 H ATOM 92915 H2 WAT 5809 24.867 123.460 134.043 1.00 0.00 H TER 92917 WAT 5809 ATOM 92917 O WAT 5810 40.628 85.735 56.492 1.00 0.00 O ATOM 92918 H1 WAT 5810 40.777 86.681 56.515 1.00 0.00 H ATOM 92919 H2 WAT 5810 39.676 85.642 56.528 1.00 0.00 H TER 92921 WAT 5810 ATOM 92921 O WAT 5811 23.039 73.698 141.195 1.00 0.00 O ATOM 92922 H1 WAT 5811 23.176 73.313 142.061 1.00 0.00 H ATOM 92923 H2 WAT 5811 22.264 74.250 141.297 1.00 0.00 H TER 92925 WAT 5811 ATOM 92925 O WAT 5812 124.527 101.524 5.297 1.00 0.00 O ATOM 92926 H1 WAT 5812 125.471 101.668 5.235 1.00 0.00 H ATOM 92927 H2 WAT 5812 124.275 101.206 4.430 1.00 0.00 H TER 92929 WAT 5812 ATOM 92929 O WAT 5813 129.488 79.968 108.227 1.00 0.00 O ATOM 92930 H1 WAT 5813 129.299 79.734 109.135 1.00 0.00 H ATOM 92931 H2 WAT 5813 129.825 80.862 108.275 1.00 0.00 H TER 92933 WAT 5813 ATOM 92933 O WAT 5814 6.872 119.163 103.777 1.00 0.00 O ATOM 92934 H1 WAT 5814 6.989 120.004 104.219 1.00 0.00 H ATOM 92935 H2 WAT 5814 6.091 118.786 104.182 1.00 0.00 H TER 92937 WAT 5814 ATOM 92937 O WAT 5815 44.145 141.103 11.510 1.00 0.00 O ATOM 92938 H1 WAT 5815 43.565 141.538 12.135 1.00 0.00 H ATOM 92939 H2 WAT 5815 44.488 141.814 10.968 1.00 0.00 H TER 92941 WAT 5815 ATOM 92941 O WAT 5816 122.527 5.592 124.627 1.00 0.00 O ATOM 92942 H1 WAT 5816 123.226 6.234 124.748 1.00 0.00 H ATOM 92943 H2 WAT 5816 121.731 6.117 124.539 1.00 0.00 H TER 92945 WAT 5816 ATOM 92945 O WAT 5817 107.638 47.955 102.747 1.00 0.00 O ATOM 92946 H1 WAT 5817 106.812 47.960 103.229 1.00 0.00 H ATOM 92947 H2 WAT 5817 107.501 48.573 102.029 1.00 0.00 H TER 92949 WAT 5817 ATOM 92949 O WAT 5818 135.756 55.050 155.264 1.00 0.00 O ATOM 92950 H1 WAT 5818 135.674 55.986 155.445 1.00 0.00 H ATOM 92951 H2 WAT 5818 136.538 54.979 154.718 1.00 0.00 H TER 92953 WAT 5818 ATOM 92953 O WAT 5819 7.132 32.836 1.644 1.00 0.00 O ATOM 92954 H1 WAT 5819 6.421 32.316 1.268 1.00 0.00 H ATOM 92955 H2 WAT 5819 7.406 33.415 0.933 1.00 0.00 H TER 92957 WAT 5819 ATOM 92957 O WAT 5820 128.425 139.402 125.853 1.00 0.00 O ATOM 92958 H1 WAT 5820 129.010 139.470 125.099 1.00 0.00 H ATOM 92959 H2 WAT 5820 127.785 140.101 125.723 1.00 0.00 H TER 92961 WAT 5820 ATOM 92961 O WAT 5821 36.714 4.734 25.222 1.00 0.00 O ATOM 92962 H1 WAT 5821 36.695 5.688 25.296 1.00 0.00 H ATOM 92963 H2 WAT 5821 35.905 4.444 25.645 1.00 0.00 H TER 92965 WAT 5821 ATOM 92965 O WAT 5822 59.539 60.890 94.758 1.00 0.00 O ATOM 92966 H1 WAT 5822 59.816 60.057 94.375 1.00 0.00 H ATOM 92967 H2 WAT 5822 59.793 61.548 94.111 1.00 0.00 H TER 92969 WAT 5822 ATOM 92969 O WAT 5823 71.416 46.206 6.990 1.00 0.00 O ATOM 92970 H1 WAT 5823 71.891 45.405 7.216 1.00 0.00 H ATOM 92971 H2 WAT 5823 70.644 46.194 7.555 1.00 0.00 H TER 92973 WAT 5823 ATOM 92973 O WAT 5824 47.690 91.439 154.971 1.00 0.00 O ATOM 92974 H1 WAT 5824 47.332 90.706 155.473 1.00 0.00 H ATOM 92975 H2 WAT 5824 46.992 91.671 154.358 1.00 0.00 H TER 92977 WAT 5824 ATOM 92977 O WAT 5825 89.604 68.109 78.781 1.00 0.00 O ATOM 92978 H1 WAT 5825 89.478 67.468 79.481 1.00 0.00 H ATOM 92979 H2 WAT 5825 88.857 68.702 78.862 1.00 0.00 H TER 92981 WAT 5825 ATOM 92981 O WAT 5826 114.888 82.580 75.385 1.00 0.00 O ATOM 92982 H1 WAT 5826 114.577 83.165 74.694 1.00 0.00 H ATOM 92983 H2 WAT 5826 114.166 81.968 75.524 1.00 0.00 H TER 92985 WAT 5826 ATOM 92985 O WAT 5827 113.439 113.441 13.089 1.00 0.00 O ATOM 92986 H1 WAT 5827 113.895 113.283 13.915 1.00 0.00 H ATOM 92987 H2 WAT 5827 113.078 114.323 13.179 1.00 0.00 H TER 92989 WAT 5827 ATOM 92989 O WAT 5828 62.547 30.852 67.270 1.00 0.00 O ATOM 92990 H1 WAT 5828 62.974 30.606 68.090 1.00 0.00 H ATOM 92991 H2 WAT 5828 61.713 30.383 67.283 1.00 0.00 H TER 92993 WAT 5828 ATOM 92993 O WAT 5829 24.966 144.823 117.250 1.00 0.00 O ATOM 92994 H1 WAT 5829 24.083 144.991 117.580 1.00 0.00 H ATOM 92995 H2 WAT 5829 25.545 145.216 117.903 1.00 0.00 H TER 92997 WAT 5829 ATOM 92997 O WAT 5830 122.609 92.226 143.783 1.00 0.00 O ATOM 92998 H1 WAT 5830 121.963 92.750 144.257 1.00 0.00 H ATOM 92999 H2 WAT 5830 122.259 91.335 143.808 1.00 0.00 H TER 93001 WAT 5830 ATOM 93001 O WAT 5831 140.810 115.815 122.047 1.00 0.00 O ATOM 93002 H1 WAT 5831 141.556 116.404 122.154 1.00 0.00 H ATOM 93003 H2 WAT 5831 140.664 115.783 121.101 1.00 0.00 H TER 93005 WAT 5831 ATOM 93005 O WAT 5832 138.494 60.805 3.636 1.00 0.00 O ATOM 93006 H1 WAT 5832 138.682 60.097 3.020 1.00 0.00 H ATOM 93007 H2 WAT 5832 137.650 60.571 4.022 1.00 0.00 H TER 93009 WAT 5832 ATOM 93009 O WAT 5833 78.977 115.161 67.475 1.00 0.00 O ATOM 93010 H1 WAT 5833 79.161 114.231 67.342 1.00 0.00 H ATOM 93011 H2 WAT 5833 78.430 115.188 68.260 1.00 0.00 H TER 93013 WAT 5833 ATOM 93013 O WAT 5834 110.381 22.304 126.027 1.00 0.00 O ATOM 93014 H1 WAT 5834 110.099 23.196 125.822 1.00 0.00 H ATOM 93015 H2 WAT 5834 110.845 22.385 126.860 1.00 0.00 H TER 93017 WAT 5834 ATOM 93017 O WAT 5835 34.506 66.925 90.897 1.00 0.00 O ATOM 93018 H1 WAT 5835 34.171 66.750 90.017 1.00 0.00 H ATOM 93019 H2 WAT 5835 34.607 66.058 91.291 1.00 0.00 H TER 93021 WAT 5835 ATOM 93021 O WAT 5836 126.977 120.476 3.299 1.00 0.00 O ATOM 93022 H1 WAT 5836 127.648 120.980 2.839 1.00 0.00 H ATOM 93023 H2 WAT 5836 126.221 121.062 3.338 1.00 0.00 H TER 93025 WAT 5836 ATOM 93025 O WAT 5837 58.353 91.651 153.474 1.00 0.00 O ATOM 93026 H1 WAT 5837 57.856 91.168 152.814 1.00 0.00 H ATOM 93027 H2 WAT 5837 59.246 91.316 153.394 1.00 0.00 H TER 93029 WAT 5837 ATOM 93029 O WAT 5838 53.898 103.921 0.986 1.00 0.00 O ATOM 93030 H1 WAT 5838 54.540 103.218 1.084 1.00 0.00 H ATOM 93031 H2 WAT 5838 53.156 103.643 1.523 1.00 0.00 H TER 93033 WAT 5838 ATOM 93033 O WAT 5839 67.376 36.254 149.122 1.00 0.00 O ATOM 93034 H1 WAT 5839 67.120 35.357 149.335 1.00 0.00 H ATOM 93035 H2 WAT 5839 67.900 36.538 149.872 1.00 0.00 H TER 93037 WAT 5839 ATOM 93037 O WAT 5840 122.849 40.114 82.963 1.00 0.00 O ATOM 93038 H1 WAT 5840 122.922 39.770 83.853 1.00 0.00 H ATOM 93039 H2 WAT 5840 123.044 39.365 82.399 1.00 0.00 H TER 93041 WAT 5840 ATOM 93041 O WAT 5841 31.828 79.526 149.035 1.00 0.00 O ATOM 93042 H1 WAT 5841 32.014 80.249 149.634 1.00 0.00 H ATOM 93043 H2 WAT 5841 31.628 78.786 149.609 1.00 0.00 H TER 93045 WAT 5841 ATOM 93045 O WAT 5842 34.091 36.006 6.133 1.00 0.00 O ATOM 93046 H1 WAT 5842 34.036 35.797 7.065 1.00 0.00 H ATOM 93047 H2 WAT 5842 33.400 36.653 5.991 1.00 0.00 H TER 93049 WAT 5842 ATOM 93049 O WAT 5843 139.380 56.823 75.889 1.00 0.00 O ATOM 93050 H1 WAT 5843 140.122 56.596 75.327 1.00 0.00 H ATOM 93051 H2 WAT 5843 139.331 56.106 76.522 1.00 0.00 H TER 93053 WAT 5843 ATOM 93053 O WAT 5844 107.906 138.039 123.811 1.00 0.00 O ATOM 93054 H1 WAT 5844 107.741 137.241 124.313 1.00 0.00 H ATOM 93055 H2 WAT 5844 108.857 138.146 123.837 1.00 0.00 H TER 93057 WAT 5844 ATOM 93057 O WAT 5845 29.676 83.981 118.122 1.00 0.00 O ATOM 93058 H1 WAT 5845 30.021 83.517 118.884 1.00 0.00 H ATOM 93059 H2 WAT 5845 29.033 84.591 118.484 1.00 0.00 H TER 93061 WAT 5845 ATOM 93061 O WAT 5846 112.557 86.121 108.305 1.00 0.00 O ATOM 93062 H1 WAT 5846 112.992 85.349 108.667 1.00 0.00 H ATOM 93063 H2 WAT 5846 111.635 85.872 108.248 1.00 0.00 H TER 93065 WAT 5846 ATOM 93065 O WAT 5847 16.378 4.673 155.167 1.00 0.00 O ATOM 93066 H1 WAT 5847 16.531 3.728 155.183 1.00 0.00 H ATOM 93067 H2 WAT 5847 17.183 5.040 154.804 1.00 0.00 H TER 93069 WAT 5847 ATOM 93069 O WAT 5848 111.462 119.089 95.372 1.00 0.00 O ATOM 93070 H1 WAT 5848 112.270 119.240 94.882 1.00 0.00 H ATOM 93071 H2 WAT 5848 111.707 118.458 96.049 1.00 0.00 H TER 93073 WAT 5848 ATOM 93073 O WAT 5849 84.473 36.045 27.382 1.00 0.00 O ATOM 93074 H1 WAT 5849 84.626 36.960 27.148 1.00 0.00 H ATOM 93075 H2 WAT 5849 85.187 35.828 27.981 1.00 0.00 H TER 93077 WAT 5849 ATOM 93077 O WAT 5850 28.589 139.318 6.115 1.00 0.00 O ATOM 93078 H1 WAT 5850 29.454 139.500 6.482 1.00 0.00 H ATOM 93079 H2 WAT 5850 28.502 138.366 6.166 1.00 0.00 H TER 93081 WAT 5850 ATOM 93081 O WAT 5851 16.211 110.236 62.617 1.00 0.00 O ATOM 93082 H1 WAT 5851 17.041 109.952 62.235 1.00 0.00 H ATOM 93083 H2 WAT 5851 15.597 110.236 61.883 1.00 0.00 H TER 93085 WAT 5851 ATOM 93085 O WAT 5852 101.371 46.564 136.830 1.00 0.00 O ATOM 93086 H1 WAT 5852 101.162 46.937 137.686 1.00 0.00 H ATOM 93087 H2 WAT 5852 102.266 46.855 136.654 1.00 0.00 H TER 93089 WAT 5852 ATOM 93089 O WAT 5853 51.299 138.821 22.761 1.00 0.00 O ATOM 93090 H1 WAT 5853 51.975 138.213 23.061 1.00 0.00 H ATOM 93091 H2 WAT 5853 50.576 138.697 23.376 1.00 0.00 H TER 93093 WAT 5853 ATOM 93093 O WAT 5854 25.026 118.187 123.673 1.00 0.00 O ATOM 93094 H1 WAT 5854 25.389 117.307 123.576 1.00 0.00 H ATOM 93095 H2 WAT 5854 25.746 118.771 123.434 1.00 0.00 H TER 93097 WAT 5854 ATOM 93097 O WAT 5855 116.097 107.314 94.247 1.00 0.00 O ATOM 93098 H1 WAT 5855 116.598 107.846 93.629 1.00 0.00 H ATOM 93099 H2 WAT 5855 115.387 107.888 94.536 1.00 0.00 H TER 93101 WAT 5855 ATOM 93101 O WAT 5856 67.268 71.662 122.373 1.00 0.00 O ATOM 93102 H1 WAT 5856 67.254 72.323 121.682 1.00 0.00 H ATOM 93103 H2 WAT 5856 67.433 70.838 121.914 1.00 0.00 H TER 93105 WAT 5856 ATOM 93105 O WAT 5857 137.826 101.025 86.475 1.00 0.00 O ATOM 93106 H1 WAT 5857 138.595 101.595 86.481 1.00 0.00 H ATOM 93107 H2 WAT 5857 138.150 100.182 86.792 1.00 0.00 H TER 93109 WAT 5857 ATOM 93109 O WAT 5858 4.431 92.824 139.987 1.00 0.00 O ATOM 93110 H1 WAT 5858 3.519 93.007 139.764 1.00 0.00 H ATOM 93111 H2 WAT 5858 4.384 92.114 140.627 1.00 0.00 H TER 93113 WAT 5858 ATOM 93113 O WAT 5859 55.174 100.070 153.444 1.00 0.00 O ATOM 93114 H1 WAT 5859 55.847 100.529 153.946 1.00 0.00 H ATOM 93115 H2 WAT 5859 55.637 99.336 153.040 1.00 0.00 H TER 93117 WAT 5859 ATOM 93117 O WAT 5860 132.057 82.916 122.397 1.00 0.00 O ATOM 93118 H1 WAT 5860 132.817 82.355 122.245 1.00 0.00 H ATOM 93119 H2 WAT 5860 131.338 82.306 122.559 1.00 0.00 H TER 93121 WAT 5860 ATOM 93121 O WAT 5861 24.442 98.732 13.613 1.00 0.00 O ATOM 93122 H1 WAT 5861 24.405 99.682 13.729 1.00 0.00 H ATOM 93123 H2 WAT 5861 25.344 98.558 13.345 1.00 0.00 H TER 93125 WAT 5861 ATOM 93125 O WAT 5862 120.590 145.870 62.432 1.00 0.00 O ATOM 93126 H1 WAT 5862 120.640 144.992 62.055 1.00 0.00 H ATOM 93127 H2 WAT 5862 119.870 146.292 61.962 1.00 0.00 H TER 93129 WAT 5862 ATOM 93129 O WAT 5863 68.952 -0.091 8.684 1.00 0.00 O ATOM 93130 H1 WAT 5863 68.564 0.295 7.898 1.00 0.00 H ATOM 93131 H2 WAT 5863 69.719 0.452 8.864 1.00 0.00 H TER 93133 WAT 5863 ATOM 93133 O WAT 5864 26.708 59.016 104.922 1.00 0.00 O ATOM 93134 H1 WAT 5864 27.089 58.901 104.051 1.00 0.00 H ATOM 93135 H2 WAT 5864 25.899 59.504 104.766 1.00 0.00 H TER 93137 WAT 5864 ATOM 93137 O WAT 5865 74.149 60.058 7.478 1.00 0.00 O ATOM 93138 H1 WAT 5865 73.446 60.440 6.951 1.00 0.00 H ATOM 93139 H2 WAT 5865 74.936 60.169 6.944 1.00 0.00 H TER 93141 WAT 5865 ATOM 93141 O WAT 5866 70.724 45.622 122.902 1.00 0.00 O ATOM 93142 H1 WAT 5866 70.806 45.403 121.974 1.00 0.00 H ATOM 93143 H2 WAT 5866 70.741 46.579 122.924 1.00 0.00 H TER 93145 WAT 5866 ATOM 93145 O WAT 5867 40.584 22.381 68.855 1.00 0.00 O ATOM 93146 H1 WAT 5867 39.863 22.398 69.485 1.00 0.00 H ATOM 93147 H2 WAT 5867 40.349 21.686 68.240 1.00 0.00 H TER 93149 WAT 5867 ATOM 93149 O WAT 5868 12.729 89.575 82.001 1.00 0.00 O ATOM 93150 H1 WAT 5868 12.938 88.849 82.589 1.00 0.00 H ATOM 93151 H2 WAT 5868 13.140 89.336 81.170 1.00 0.00 H TER 93153 WAT 5868 ATOM 93153 O WAT 5869 31.782 50.841 2.794 1.00 0.00 O ATOM 93154 H1 WAT 5869 31.900 51.079 3.714 1.00 0.00 H ATOM 93155 H2 WAT 5869 32.082 49.934 2.741 1.00 0.00 H TER 93157 WAT 5869 ATOM 93157 O WAT 5870 84.082 104.829 10.885 1.00 0.00 O ATOM 93158 H1 WAT 5870 83.154 105.022 11.017 1.00 0.00 H ATOM 93159 H2 WAT 5870 84.204 103.964 11.277 1.00 0.00 H TER 93161 WAT 5870 ATOM 93161 O WAT 5871 105.472 122.987 154.381 1.00 0.00 O ATOM 93162 H1 WAT 5871 106.371 123.163 154.105 1.00 0.00 H ATOM 93163 H2 WAT 5871 105.282 123.669 155.026 1.00 0.00 H TER 93165 WAT 5871 ATOM 93165 O WAT 5872 139.424 111.250 142.885 1.00 0.00 O ATOM 93166 H1 WAT 5872 138.696 111.360 142.274 1.00 0.00 H ATOM 93167 H2 WAT 5872 139.679 110.332 142.793 1.00 0.00 H TER 93169 WAT 5872 ATOM 93169 O WAT 5873 53.655 83.435 120.444 1.00 0.00 O ATOM 93170 H1 WAT 5873 54.591 83.466 120.247 1.00 0.00 H ATOM 93171 H2 WAT 5873 53.290 84.196 119.992 1.00 0.00 H TER 93173 WAT 5873 ATOM 93173 O WAT 5874 39.293 93.394 8.691 1.00 0.00 O ATOM 93174 H1 WAT 5874 39.271 94.229 8.222 1.00 0.00 H ATOM 93175 H2 WAT 5874 39.281 93.639 9.616 1.00 0.00 H TER 93177 WAT 5874 ATOM 93177 O WAT 5875 9.328 71.469 66.464 1.00 0.00 O ATOM 93178 H1 WAT 5875 9.885 72.121 66.889 1.00 0.00 H ATOM 93179 H2 WAT 5875 8.729 71.982 65.921 1.00 0.00 H TER 93181 WAT 5875 ATOM 93181 O WAT 5876 35.227 62.149 5.499 1.00 0.00 O ATOM 93182 H1 WAT 5876 35.537 61.794 4.666 1.00 0.00 H ATOM 93183 H2 WAT 5876 35.067 61.379 6.044 1.00 0.00 H TER 93185 WAT 5876 ATOM 93185 O WAT 5877 90.055 58.315 158.311 1.00 0.00 O ATOM 93186 H1 WAT 5877 89.309 57.932 158.773 1.00 0.00 H ATOM 93187 H2 WAT 5877 90.409 58.961 158.922 1.00 0.00 H TER 93189 WAT 5877 ATOM 93189 O WAT 5878 144.153 53.701 82.417 1.00 0.00 O ATOM 93190 H1 WAT 5878 143.888 53.975 83.295 1.00 0.00 H ATOM 93191 H2 WAT 5878 143.547 52.995 82.194 1.00 0.00 H TER 93193 WAT 5878 ATOM 93193 O WAT 5879 91.901 18.159 157.150 1.00 0.00 O ATOM 93194 H1 WAT 5879 92.404 17.461 157.570 1.00 0.00 H ATOM 93195 H2 WAT 5879 91.150 17.712 156.761 1.00 0.00 H TER 93197 WAT 5879 ATOM 93197 O WAT 5880 36.749 128.685 123.136 1.00 0.00 O ATOM 93198 H1 WAT 5880 36.342 127.827 123.258 1.00 0.00 H ATOM 93199 H2 WAT 5880 36.278 129.071 122.398 1.00 0.00 H TER 93201 WAT 5880 ATOM 93201 O WAT 5881 25.772 98.565 10.646 1.00 0.00 O ATOM 93202 H1 WAT 5881 25.455 99.467 10.672 1.00 0.00 H ATOM 93203 H2 WAT 5881 24.978 98.033 10.591 1.00 0.00 H TER 93205 WAT 5881 ATOM 93205 O WAT 5882 42.597 119.880 88.520 1.00 0.00 O ATOM 93206 H1 WAT 5882 42.585 120.030 87.575 1.00 0.00 H ATOM 93207 H2 WAT 5882 41.996 120.535 88.874 1.00 0.00 H TER 93209 WAT 5882 ATOM 93209 O WAT 5883 66.082 41.872 57.743 1.00 0.00 O ATOM 93210 H1 WAT 5883 66.161 42.789 58.005 1.00 0.00 H ATOM 93211 H2 WAT 5883 65.196 41.800 57.389 1.00 0.00 H TER 93213 WAT 5883 ATOM 93213 O WAT 5884 80.199 89.283 112.207 1.00 0.00 O ATOM 93214 H1 WAT 5884 79.766 88.626 112.752 1.00 0.00 H ATOM 93215 H2 WAT 5884 80.878 89.652 112.772 1.00 0.00 H TER 93217 WAT 5884 ATOM 93217 O WAT 5885 20.175 103.357 103.422 1.00 0.00 O ATOM 93218 H1 WAT 5885 20.950 103.915 103.487 1.00 0.00 H ATOM 93219 H2 WAT 5885 20.101 103.157 102.489 1.00 0.00 H TER 93221 WAT 5885 ATOM 93221 O WAT 5886 72.543 88.355 21.660 1.00 0.00 O ATOM 93222 H1 WAT 5886 71.851 88.852 22.096 1.00 0.00 H ATOM 93223 H2 WAT 5886 73.082 88.017 22.374 1.00 0.00 H TER 93225 WAT 5886 ATOM 93225 O WAT 5887 15.444 120.076 71.366 1.00 0.00 O ATOM 93226 H1 WAT 5887 16.253 120.125 70.858 1.00 0.00 H ATOM 93227 H2 WAT 5887 14.748 120.206 70.722 1.00 0.00 H TER 93229 WAT 5887 ATOM 93229 O WAT 5888 144.043 63.016 133.904 1.00 0.00 O ATOM 93230 H1 WAT 5888 143.455 62.355 133.537 1.00 0.00 H ATOM 93231 H2 WAT 5888 143.461 63.712 134.209 1.00 0.00 H TER 93233 WAT 5888 ATOM 93233 O WAT 5889 118.523 116.126 20.397 1.00 0.00 O ATOM 93234 H1 WAT 5889 117.784 116.705 20.211 1.00 0.00 H ATOM 93235 H2 WAT 5889 118.625 115.604 19.601 1.00 0.00 H TER 93237 WAT 5889 ATOM 93237 O WAT 5890 18.608 90.218 115.534 1.00 0.00 O ATOM 93238 H1 WAT 5890 18.204 90.210 116.402 1.00 0.00 H ATOM 93239 H2 WAT 5890 19.057 89.374 115.472 1.00 0.00 H TER 93241 WAT 5890 ATOM 93241 O WAT 5891 107.982 28.492 89.806 1.00 0.00 O ATOM 93242 H1 WAT 5891 107.295 28.747 90.422 1.00 0.00 H ATOM 93243 H2 WAT 5891 108.644 29.179 89.888 1.00 0.00 H TER 93245 WAT 5891 ATOM 93245 O WAT 5892 45.022 0.757 65.883 1.00 0.00 O ATOM 93246 H1 WAT 5892 45.295 0.809 64.967 1.00 0.00 H ATOM 93247 H2 WAT 5892 44.374 0.053 65.900 1.00 0.00 H TER 93249 WAT 5892 ATOM 93249 O WAT 5893 90.174 55.471 4.303 1.00 0.00 O ATOM 93250 H1 WAT 5893 89.963 55.369 5.231 1.00 0.00 H ATOM 93251 H2 WAT 5893 90.830 54.795 4.131 1.00 0.00 H TER 93253 WAT 5893 ATOM 93253 O WAT 5894 11.697 42.858 153.739 1.00 0.00 O ATOM 93254 H1 WAT 5894 12.453 42.418 153.352 1.00 0.00 H ATOM 93255 H2 WAT 5894 11.133 42.145 154.041 1.00 0.00 H TER 93257 WAT 5894 ATOM 93257 O WAT 5895 73.168 89.435 103.632 1.00 0.00 O ATOM 93258 H1 WAT 5895 73.638 88.657 103.931 1.00 0.00 H ATOM 93259 H2 WAT 5895 73.367 90.103 104.288 1.00 0.00 H TER 93261 WAT 5895 ATOM 93261 O WAT 5896 44.425 131.063 8.358 1.00 0.00 O ATOM 93262 H1 WAT 5896 44.874 130.235 8.530 1.00 0.00 H ATOM 93263 H2 WAT 5896 45.032 131.734 8.669 1.00 0.00 H TER 93265 WAT 5896 ATOM 93265 O WAT 5897 10.044 2.678 15.256 1.00 0.00 O ATOM 93266 H1 WAT 5897 10.890 3.079 15.056 1.00 0.00 H ATOM 93267 H2 WAT 5897 10.069 2.524 16.200 1.00 0.00 H TER 93269 WAT 5897 ATOM 93269 O WAT 5898 64.203 107.089 116.353 1.00 0.00 O ATOM 93270 H1 WAT 5898 64.085 107.331 115.435 1.00 0.00 H ATOM 93271 H2 WAT 5898 63.511 106.450 116.524 1.00 0.00 H TER 93273 WAT 5898 ATOM 93273 O WAT 5899 1.493 62.975 83.714 1.00 0.00 O ATOM 93274 H1 WAT 5899 1.587 62.557 82.858 1.00 0.00 H ATOM 93275 H2 WAT 5899 1.989 62.414 84.310 1.00 0.00 H TER 93277 WAT 5899 ATOM 93277 O WAT 5900 67.658 57.641 76.367 1.00 0.00 O ATOM 93278 H1 WAT 5900 68.047 56.767 76.380 1.00 0.00 H ATOM 93279 H2 WAT 5900 68.193 58.132 75.743 1.00 0.00 H TER 93281 WAT 5900 ATOM 93281 O WAT 5901 125.155 84.251 99.886 1.00 0.00 O ATOM 93282 H1 WAT 5901 124.433 83.626 99.945 1.00 0.00 H ATOM 93283 H2 WAT 5901 125.571 84.059 99.046 1.00 0.00 H TER 93285 WAT 5901 ATOM 93285 O WAT 5902 143.544 103.791 5.312 1.00 0.00 O ATOM 93286 H1 WAT 5902 144.262 103.166 5.418 1.00 0.00 H ATOM 93287 H2 WAT 5902 142.767 103.316 5.606 1.00 0.00 H TER 93289 WAT 5902 ATOM 93289 O WAT 5903 0.699 76.807 15.346 1.00 0.00 O ATOM 93290 H1 WAT 5903 -0.080 76.836 14.790 1.00 0.00 H ATOM 93291 H2 WAT 5903 0.356 76.798 16.239 1.00 0.00 H TER 93293 WAT 5903 ATOM 93293 O WAT 5904 136.461 57.260 152.868 1.00 0.00 O ATOM 93294 H1 WAT 5904 137.050 57.770 153.424 1.00 0.00 H ATOM 93295 H2 WAT 5904 137.042 56.799 152.263 1.00 0.00 H TER 93297 WAT 5904 ATOM 93297 O WAT 5905 69.628 125.022 73.326 1.00 0.00 O ATOM 93298 H1 WAT 5905 70.427 124.629 73.676 1.00 0.00 H ATOM 93299 H2 WAT 5905 69.690 124.889 72.380 1.00 0.00 H TER 93301 WAT 5905 ATOM 93301 O WAT 5906 18.981 76.559 111.939 1.00 0.00 O ATOM 93302 H1 WAT 5906 18.631 77.331 112.384 1.00 0.00 H ATOM 93303 H2 WAT 5906 18.525 75.821 112.344 1.00 0.00 H TER 93305 WAT 5906 ATOM 93305 O WAT 5907 53.287 49.128 18.772 1.00 0.00 O ATOM 93306 H1 WAT 5907 53.995 48.824 18.203 1.00 0.00 H ATOM 93307 H2 WAT 5907 53.146 50.039 18.513 1.00 0.00 H TER 93309 WAT 5907 ATOM 93309 O WAT 5908 49.996 102.251 145.258 1.00 0.00 O ATOM 93310 H1 WAT 5908 49.156 102.655 145.476 1.00 0.00 H ATOM 93311 H2 WAT 5908 50.649 102.833 145.646 1.00 0.00 H TER 93313 WAT 5908 ATOM 93313 O WAT 5909 44.021 17.253 3.818 1.00 0.00 O ATOM 93314 H1 WAT 5909 44.937 17.428 3.602 1.00 0.00 H ATOM 93315 H2 WAT 5909 43.969 17.383 4.765 1.00 0.00 H TER 93317 WAT 5909 ATOM 93317 O WAT 5910 27.860 55.423 20.412 1.00 0.00 O ATOM 93318 H1 WAT 5910 28.406 54.740 20.803 1.00 0.00 H ATOM 93319 H2 WAT 5910 27.021 55.349 20.868 1.00 0.00 H TER 93321 WAT 5910 ATOM 93321 O WAT 5911 106.617 27.005 6.498 1.00 0.00 O ATOM 93322 H1 WAT 5911 106.208 26.705 5.685 1.00 0.00 H ATOM 93323 H2 WAT 5911 106.151 26.533 7.188 1.00 0.00 H TER 93325 WAT 5911 ATOM 93325 O WAT 5912 51.963 107.655 122.080 1.00 0.00 O ATOM 93326 H1 WAT 5912 51.573 108.249 121.439 1.00 0.00 H ATOM 93327 H2 WAT 5912 52.555 108.209 122.591 1.00 0.00 H TER 93329 WAT 5912 ATOM 93329 O WAT 5913 128.335 3.790 143.306 1.00 0.00 O ATOM 93330 H1 WAT 5913 127.501 3.376 143.529 1.00 0.00 H ATOM 93331 H2 WAT 5913 128.990 3.113 143.471 1.00 0.00 H TER 93333 WAT 5913 ATOM 93333 O WAT 5914 18.197 77.224 148.802 1.00 0.00 O ATOM 93334 H1 WAT 5914 18.361 77.715 147.997 1.00 0.00 H ATOM 93335 H2 WAT 5914 18.378 76.314 148.570 1.00 0.00 H TER 93337 WAT 5914 ATOM 93337 O WAT 5915 102.840 56.828 127.770 1.00 0.00 O ATOM 93338 H1 WAT 5915 102.955 56.374 126.935 1.00 0.00 H ATOM 93339 H2 WAT 5915 102.600 56.137 128.387 1.00 0.00 H TER 93341 WAT 5915 ATOM 93341 O WAT 5916 109.127 68.677 73.252 1.00 0.00 O ATOM 93342 H1 WAT 5916 109.952 68.968 72.864 1.00 0.00 H ATOM 93343 H2 WAT 5916 109.337 68.519 74.172 1.00 0.00 H TER 93345 WAT 5916 ATOM 93345 O WAT 5917 54.033 63.353 152.406 1.00 0.00 O ATOM 93346 H1 WAT 5917 53.368 63.757 152.963 1.00 0.00 H ATOM 93347 H2 WAT 5917 53.562 63.106 151.611 1.00 0.00 H TER 93349 WAT 5917 ATOM 93349 O WAT 5918 49.852 90.979 127.929 1.00 0.00 O ATOM 93350 H1 WAT 5918 49.356 90.299 128.383 1.00 0.00 H ATOM 93351 H2 WAT 5918 50.631 91.109 128.470 1.00 0.00 H TER 93353 WAT 5918 ATOM 93353 O WAT 5919 125.748 73.906 72.914 1.00 0.00 O ATOM 93354 H1 WAT 5919 125.187 73.803 72.145 1.00 0.00 H ATOM 93355 H2 WAT 5919 125.751 73.042 73.325 1.00 0.00 H TER 93357 WAT 5919 ATOM 93357 O WAT 5920 63.815 131.819 67.894 1.00 0.00 O ATOM 93358 H1 WAT 5920 64.038 131.739 68.822 1.00 0.00 H ATOM 93359 H2 WAT 5920 64.641 131.664 67.435 1.00 0.00 H TER 93361 WAT 5920 ATOM 93361 O WAT 5921 111.313 135.114 6.297 1.00 0.00 O ATOM 93362 H1 WAT 5921 110.485 135.570 6.143 1.00 0.00 H ATOM 93363 H2 WAT 5921 111.413 134.536 5.540 1.00 0.00 H TER 93365 WAT 5921 ATOM 93365 O WAT 5922 44.259 52.470 108.233 1.00 0.00 O ATOM 93366 H1 WAT 5922 44.396 52.263 109.157 1.00 0.00 H ATOM 93367 H2 WAT 5922 44.014 53.395 108.228 1.00 0.00 H TER 93369 WAT 5922 ATOM 93369 O WAT 5923 2.293 73.402 70.441 1.00 0.00 O ATOM 93370 H1 WAT 5923 2.857 74.062 70.038 1.00 0.00 H ATOM 93371 H2 WAT 5923 2.890 72.861 70.959 1.00 0.00 H TER 93373 WAT 5923 ATOM 93373 O WAT 5924 54.946 40.367 145.123 1.00 0.00 O ATOM 93374 H1 WAT 5924 54.809 39.596 144.571 1.00 0.00 H ATOM 93375 H2 WAT 5924 54.885 41.107 144.519 1.00 0.00 H TER 93377 WAT 5924 ATOM 93377 O WAT 5925 144.681 110.055 8.957 1.00 0.00 O ATOM 93378 H1 WAT 5925 144.816 109.325 8.352 1.00 0.00 H ATOM 93379 H2 WAT 5925 145.495 110.556 8.913 1.00 0.00 H TER 93381 WAT 5925 ATOM 93381 O WAT 5926 87.401 143.520 65.073 1.00 0.00 O ATOM 93382 H1 WAT 5926 88.116 144.151 64.996 1.00 0.00 H ATOM 93383 H2 WAT 5926 87.283 143.181 64.186 1.00 0.00 H TER 93385 WAT 5926 ATOM 93385 O WAT 5927 27.022 31.098 137.575 1.00 0.00 O ATOM 93386 H1 WAT 5927 26.540 31.393 138.348 1.00 0.00 H ATOM 93387 H2 WAT 5927 26.363 30.663 137.034 1.00 0.00 H TER 93389 WAT 5927 ATOM 93389 O WAT 5928 62.682 127.633 71.684 1.00 0.00 O ATOM 93390 H1 WAT 5928 62.181 126.877 71.988 1.00 0.00 H ATOM 93391 H2 WAT 5928 62.045 128.347 71.655 1.00 0.00 H TER 93393 WAT 5928 ATOM 93393 O WAT 5929 16.332 71.013 8.474 1.00 0.00 O ATOM 93394 H1 WAT 5929 15.575 70.523 8.796 1.00 0.00 H ATOM 93395 H2 WAT 5929 16.908 71.091 9.234 1.00 0.00 H TER 93397 WAT 5929 ATOM 93397 O WAT 5930 62.117 123.301 6.758 1.00 0.00 O ATOM 93398 H1 WAT 5930 62.556 123.643 5.979 1.00 0.00 H ATOM 93399 H2 WAT 5930 61.194 123.254 6.511 1.00 0.00 H TER 93401 WAT 5930 ATOM 93401 O WAT 5931 57.638 111.970 124.154 1.00 0.00 O ATOM 93402 H1 WAT 5931 57.163 111.562 124.878 1.00 0.00 H ATOM 93403 H2 WAT 5931 58.538 111.658 124.252 1.00 0.00 H TER 93405 WAT 5931 ATOM 93405 O WAT 5932 32.467 8.297 139.104 1.00 0.00 O ATOM 93406 H1 WAT 5932 31.560 8.600 139.151 1.00 0.00 H ATOM 93407 H2 WAT 5932 32.816 8.708 138.313 1.00 0.00 H TER 93409 WAT 5932 ATOM 93409 O WAT 5933 51.577 78.470 6.975 1.00 0.00 O ATOM 93410 H1 WAT 5933 51.979 77.633 6.742 1.00 0.00 H ATOM 93411 H2 WAT 5933 52.204 78.878 7.573 1.00 0.00 H TER 93413 WAT 5933 ATOM 93413 O WAT 5934 96.551 143.638 102.806 1.00 0.00 O ATOM 93414 H1 WAT 5934 97.483 143.855 102.823 1.00 0.00 H ATOM 93415 H2 WAT 5934 96.315 143.668 101.879 1.00 0.00 H TER 93417 WAT 5934 ATOM 93417 O WAT 5935 7.663 130.309 146.644 1.00 0.00 O ATOM 93418 H1 WAT 5935 7.322 131.181 146.844 1.00 0.00 H ATOM 93419 H2 WAT 5935 7.998 130.382 145.751 1.00 0.00 H TER 93421 WAT 5935 ATOM 93421 O WAT 5936 98.442 82.680 124.959 1.00 0.00 O ATOM 93422 H1 WAT 5936 98.493 83.611 125.179 1.00 0.00 H ATOM 93423 H2 WAT 5936 97.522 82.537 124.738 1.00 0.00 H TER 93425 WAT 5936 ATOM 93425 O WAT 5937 26.564 43.579 152.027 1.00 0.00 O ATOM 93426 H1 WAT 5937 26.955 43.017 151.358 1.00 0.00 H ATOM 93427 H2 WAT 5937 25.818 43.990 151.590 1.00 0.00 H TER 93429 WAT 5937 ATOM 93429 O WAT 5938 69.890 133.590 55.185 1.00 0.00 O ATOM 93430 H1 WAT 5938 69.254 134.181 55.586 1.00 0.00 H ATOM 93431 H2 WAT 5938 70.641 133.608 55.778 1.00 0.00 H TER 93433 WAT 5938 ATOM 93433 O WAT 5939 52.017 141.167 143.058 1.00 0.00 O ATOM 93434 H1 WAT 5939 52.791 140.803 142.626 1.00 0.00 H ATOM 93435 H2 WAT 5939 52.006 142.086 142.792 1.00 0.00 H TER 93437 WAT 5939 ATOM 93437 O WAT 5940 73.646 128.500 129.045 1.00 0.00 O ATOM 93438 H1 WAT 5940 74.393 129.040 128.786 1.00 0.00 H ATOM 93439 H2 WAT 5940 73.168 128.346 128.230 1.00 0.00 H TER 93441 WAT 5940 ATOM 93441 O WAT 5941 71.556 58.787 88.459 1.00 0.00 O ATOM 93442 H1 WAT 5941 71.022 58.850 87.667 1.00 0.00 H ATOM 93443 H2 WAT 5941 71.113 58.129 88.995 1.00 0.00 H TER 93445 WAT 5941 ATOM 93445 O WAT 5942 59.576 13.755 124.840 1.00 0.00 O ATOM 93446 H1 WAT 5942 59.018 13.841 125.613 1.00 0.00 H ATOM 93447 H2 WAT 5942 59.203 14.367 124.206 1.00 0.00 H TER 93449 WAT 5942 ATOM 93449 O WAT 5943 117.878 93.134 18.346 1.00 0.00 O ATOM 93450 H1 WAT 5943 118.729 93.570 18.383 1.00 0.00 H ATOM 93451 H2 WAT 5943 117.775 92.736 19.210 1.00 0.00 H TER 93453 WAT 5943 ATOM 93453 O WAT 5944 23.188 50.579 146.461 1.00 0.00 O ATOM 93454 H1 WAT 5944 22.330 51.002 146.488 1.00 0.00 H ATOM 93455 H2 WAT 5944 23.802 51.268 146.717 1.00 0.00 H TER 93457 WAT 5944 ATOM 93457 O WAT 5945 113.653 39.878 102.659 1.00 0.00 O ATOM 93458 H1 WAT 5945 113.419 40.679 102.188 1.00 0.00 H ATOM 93459 H2 WAT 5945 114.577 39.741 102.451 1.00 0.00 H TER 93461 WAT 5945 ATOM 93461 O WAT 5946 26.796 144.658 109.518 1.00 0.00 O ATOM 93462 H1 WAT 5946 26.403 145.010 110.317 1.00 0.00 H ATOM 93463 H2 WAT 5946 26.635 143.716 109.567 1.00 0.00 H TER 93465 WAT 5946 ATOM 93465 O WAT 5947 117.729 119.955 8.761 1.00 0.00 O ATOM 93466 H1 WAT 5947 117.106 120.641 8.523 1.00 0.00 H ATOM 93467 H2 WAT 5947 117.558 119.249 8.137 1.00 0.00 H TER 93469 WAT 5947 ATOM 93469 O WAT 5948 125.482 96.680 157.048 1.00 0.00 O ATOM 93470 H1 WAT 5948 124.604 97.051 157.145 1.00 0.00 H ATOM 93471 H2 WAT 5948 125.424 95.817 157.457 1.00 0.00 H TER 93473 WAT 5948 ATOM 93473 O WAT 5949 44.028 56.879 8.259 1.00 0.00 O ATOM 93474 H1 WAT 5949 43.685 57.416 8.973 1.00 0.00 H ATOM 93475 H2 WAT 5949 44.780 57.371 7.928 1.00 0.00 H TER 93477 WAT 5949 ATOM 93477 O WAT 5950 102.953 131.467 63.265 1.00 0.00 O ATOM 93478 H1 WAT 5950 103.830 131.540 63.643 1.00 0.00 H ATOM 93479 H2 WAT 5950 103.055 131.772 62.363 1.00 0.00 H TER 93481 WAT 5950 ATOM 93481 O WAT 5951 115.821 3.226 19.561 1.00 0.00 O ATOM 93482 H1 WAT 5951 115.020 3.750 19.548 1.00 0.00 H ATOM 93483 H2 WAT 5951 116.134 3.288 20.463 1.00 0.00 H TER 93485 WAT 5951 ATOM 93485 O WAT 5952 113.288 84.186 114.027 1.00 0.00 O ATOM 93486 H1 WAT 5952 113.612 84.658 113.260 1.00 0.00 H ATOM 93487 H2 WAT 5952 112.744 84.824 114.489 1.00 0.00 H TER 93489 WAT 5952 ATOM 93489 O WAT 5953 57.922 37.032 130.444 1.00 0.00 O ATOM 93490 H1 WAT 5953 57.390 37.692 130.888 1.00 0.00 H ATOM 93491 H2 WAT 5953 57.476 36.204 130.622 1.00 0.00 H TER 93493 WAT 5953 ATOM 93493 O WAT 5954 20.740 145.989 97.422 1.00 0.00 O ATOM 93494 H1 WAT 5954 21.575 145.764 97.832 1.00 0.00 H ATOM 93495 H2 WAT 5954 20.155 145.270 97.658 1.00 0.00 H TER 93497 WAT 5954 ATOM 93497 O WAT 5955 124.113 76.668 1.473 1.00 0.00 O ATOM 93498 H1 WAT 5955 124.398 76.508 0.574 1.00 0.00 H ATOM 93499 H2 WAT 5955 124.902 76.970 1.924 1.00 0.00 H TER 93501 WAT 5955 ATOM 93501 O WAT 5956 105.959 70.275 117.182 1.00 0.00 O ATOM 93502 H1 WAT 5956 106.551 69.945 116.507 1.00 0.00 H ATOM 93503 H2 WAT 5956 105.388 70.890 116.720 1.00 0.00 H TER 93505 WAT 5956 ATOM 93505 O WAT 5957 89.796 15.712 76.763 1.00 0.00 O ATOM 93506 H1 WAT 5957 90.460 15.750 77.451 1.00 0.00 H ATOM 93507 H2 WAT 5957 88.998 15.436 77.214 1.00 0.00 H TER 93509 WAT 5957 ATOM 93509 O WAT 5958 60.200 140.927 86.728 1.00 0.00 O ATOM 93510 H1 WAT 5958 60.327 141.618 87.379 1.00 0.00 H ATOM 93511 H2 WAT 5958 60.632 140.161 87.105 1.00 0.00 H TER 93513 WAT 5958 ATOM 93513 O WAT 5959 131.460 67.985 83.276 1.00 0.00 O ATOM 93514 H1 WAT 5959 131.572 68.878 83.601 1.00 0.00 H ATOM 93515 H2 WAT 5959 130.545 67.943 83.000 1.00 0.00 H TER 93517 WAT 5959 ATOM 93517 O WAT 5960 37.902 57.834 19.032 1.00 0.00 O ATOM 93518 H1 WAT 5960 37.347 57.057 18.964 1.00 0.00 H ATOM 93519 H2 WAT 5960 38.742 57.501 19.347 1.00 0.00 H TER 93521 WAT 5960 ATOM 93521 O WAT 5961 102.997 62.196 125.633 1.00 0.00 O ATOM 93522 H1 WAT 5961 102.160 62.541 125.324 1.00 0.00 H ATOM 93523 H2 WAT 5961 102.845 61.991 126.556 1.00 0.00 H TER 93525 WAT 5961 ATOM 93525 O WAT 5962 73.206 37.225 108.445 1.00 0.00 O ATOM 93526 H1 WAT 5962 73.466 38.050 108.036 1.00 0.00 H ATOM 93527 H2 WAT 5962 73.175 36.598 107.722 1.00 0.00 H TER 93529 WAT 5962 ATOM 93529 O WAT 5963 43.866 0.385 112.255 1.00 0.00 O ATOM 93530 H1 WAT 5963 44.134 -0.261 112.909 1.00 0.00 H ATOM 93531 H2 WAT 5963 44.643 0.510 111.710 1.00 0.00 H TER 93533 WAT 5963 ATOM 93533 O WAT 5964 138.321 71.705 98.598 1.00 0.00 O ATOM 93534 H1 WAT 5964 137.942 71.641 99.474 1.00 0.00 H ATOM 93535 H2 WAT 5964 138.843 70.909 98.503 1.00 0.00 H TER 93537 WAT 5964 ATOM 93537 O WAT 5965 101.187 113.025 158.724 1.00 0.00 O ATOM 93538 H1 WAT 5965 101.015 112.096 158.571 1.00 0.00 H ATOM 93539 H2 WAT 5965 101.605 113.327 157.918 1.00 0.00 H TER 93541 WAT 5965 ATOM 93541 O WAT 5966 31.909 55.742 149.431 1.00 0.00 O ATOM 93542 H1 WAT 5966 30.982 55.629 149.640 1.00 0.00 H ATOM 93543 H2 WAT 5966 32.017 55.316 148.581 1.00 0.00 H TER 93545 WAT 5966 ATOM 93545 O WAT 5967 87.560 5.573 124.011 1.00 0.00 O ATOM 93546 H1 WAT 5967 87.153 5.600 124.877 1.00 0.00 H ATOM 93547 H2 WAT 5967 86.829 5.667 123.401 1.00 0.00 H TER 93549 WAT 5967 ATOM 93549 O WAT 5968 142.175 1.302 118.195 1.00 0.00 O ATOM 93550 H1 WAT 5968 142.510 1.952 118.813 1.00 0.00 H ATOM 93551 H2 WAT 5968 141.540 1.782 117.663 1.00 0.00 H TER 93553 WAT 5968 ATOM 93553 O WAT 5969 32.869 95.384 72.580 1.00 0.00 O ATOM 93554 H1 WAT 5969 32.156 95.340 73.218 1.00 0.00 H ATOM 93555 H2 WAT 5969 33.657 95.197 73.090 1.00 0.00 H TER 93557 WAT 5969 ATOM 93557 O WAT 5970 23.742 14.006 137.359 1.00 0.00 O ATOM 93558 H1 WAT 5970 24.656 13.977 137.644 1.00 0.00 H ATOM 93559 H2 WAT 5970 23.327 13.272 137.812 1.00 0.00 H TER 93561 WAT 5970 ATOM 93561 O WAT 5971 67.013 27.897 117.403 1.00 0.00 O ATOM 93562 H1 WAT 5971 66.143 27.567 117.625 1.00 0.00 H ATOM 93563 H2 WAT 5971 66.847 28.628 116.807 1.00 0.00 H TER 93565 WAT 5971 ATOM 93565 O WAT 5972 46.284 58.813 137.392 1.00 0.00 O ATOM 93566 H1 WAT 5972 45.470 58.309 137.361 1.00 0.00 H ATOM 93567 H2 WAT 5972 46.681 58.574 138.230 1.00 0.00 H TER 93569 WAT 5972 ATOM 93569 O WAT 5973 58.094 99.894 106.372 1.00 0.00 O ATOM 93570 H1 WAT 5973 57.381 100.512 106.528 1.00 0.00 H ATOM 93571 H2 WAT 5973 58.771 100.146 107.001 1.00 0.00 H TER 93573 WAT 5973 ATOM 93573 O WAT 5974 140.831 74.300 115.836 1.00 0.00 O ATOM 93574 H1 WAT 5974 140.498 73.819 115.078 1.00 0.00 H ATOM 93575 H2 WAT 5974 140.782 73.673 116.558 1.00 0.00 H TER 93577 WAT 5974 ATOM 93577 O WAT 5975 34.575 6.555 134.138 1.00 0.00 O ATOM 93578 H1 WAT 5975 34.963 5.951 134.771 1.00 0.00 H ATOM 93579 H2 WAT 5975 35.216 7.261 134.056 1.00 0.00 H TER 93581 WAT 5975 ATOM 93581 O WAT 5976 15.694 35.436 80.848 1.00 0.00 O ATOM 93582 H1 WAT 5976 15.534 35.249 79.923 1.00 0.00 H ATOM 93583 H2 WAT 5976 15.777 34.574 81.256 1.00 0.00 H TER 93585 WAT 5976 ATOM 93585 O WAT 5977 1.367 139.523 19.799 1.00 0.00 O ATOM 93586 H1 WAT 5977 2.146 139.839 20.257 1.00 0.00 H ATOM 93587 H2 WAT 5977 1.031 140.293 19.340 1.00 0.00 H TER 93589 WAT 5977 ATOM 93589 O WAT 5978 112.536 48.578 13.541 1.00 0.00 O ATOM 93590 H1 WAT 5978 112.320 47.853 12.954 1.00 0.00 H ATOM 93591 H2 WAT 5978 111.848 48.559 14.207 1.00 0.00 H TER 93593 WAT 5978 ATOM 93593 O WAT 5979 135.198 72.239 20.459 1.00 0.00 O ATOM 93594 H1 WAT 5979 134.305 72.223 20.116 1.00 0.00 H ATOM 93595 H2 WAT 5979 135.533 73.102 20.214 1.00 0.00 H TER 93597 WAT 5979 ATOM 93597 O WAT 5980 81.201 143.276 75.360 1.00 0.00 O ATOM 93598 H1 WAT 5980 80.670 142.579 74.974 1.00 0.00 H ATOM 93599 H2 WAT 5980 80.574 143.973 75.555 1.00 0.00 H TER 93601 WAT 5980 ATOM 93601 O WAT 5981 142.231 120.560 104.131 1.00 0.00 O ATOM 93602 H1 WAT 5981 142.350 119.611 104.172 1.00 0.00 H ATOM 93603 H2 WAT 5981 143.066 120.893 103.801 1.00 0.00 H TER 93605 WAT 5981 ATOM 93605 O WAT 5982 25.338 82.938 143.022 1.00 0.00 O ATOM 93606 H1 WAT 5982 25.111 82.229 142.421 1.00 0.00 H ATOM 93607 H2 WAT 5982 24.774 83.665 142.759 1.00 0.00 H TER 93609 WAT 5982 ATOM 93609 O WAT 5983 118.553 98.993 103.908 1.00 0.00 O ATOM 93610 H1 WAT 5983 117.617 99.068 104.095 1.00 0.00 H ATOM 93611 H2 WAT 5983 118.788 98.116 104.210 1.00 0.00 H TER 93613 WAT 5983 ATOM 93613 O WAT 5984 108.469 59.551 7.246 1.00 0.00 O ATOM 93614 H1 WAT 5984 107.742 60.174 7.239 1.00 0.00 H ATOM 93615 H2 WAT 5984 108.206 58.883 7.879 1.00 0.00 H TER 93617 WAT 5984 ATOM 93617 O WAT 5985 111.832 145.226 14.849 1.00 0.00 O ATOM 93618 H1 WAT 5985 111.609 144.296 14.818 1.00 0.00 H ATOM 93619 H2 WAT 5985 112.615 145.267 15.398 1.00 0.00 H TER 93621 WAT 5985 ATOM 93621 O WAT 5986 30.339 118.720 1.564 1.00 0.00 O ATOM 93622 H1 WAT 5986 31.156 118.580 1.085 1.00 0.00 H ATOM 93623 H2 WAT 5986 29.669 118.304 1.022 1.00 0.00 H TER 93625 WAT 5986 ATOM 93625 O WAT 5987 1.585 57.508 135.919 1.00 0.00 O ATOM 93626 H1 WAT 5987 1.789 57.239 135.023 1.00 0.00 H ATOM 93627 H2 WAT 5987 0.629 57.535 135.950 1.00 0.00 H TER 93629 WAT 5987 ATOM 93629 O WAT 5988 97.028 63.195 133.451 1.00 0.00 O ATOM 93630 H1 WAT 5988 97.560 62.507 133.052 1.00 0.00 H ATOM 93631 H2 WAT 5988 96.193 62.770 133.645 1.00 0.00 H TER 93633 WAT 5988 ATOM 93633 O WAT 5989 63.964 103.673 24.604 1.00 0.00 O ATOM 93634 H1 WAT 5989 63.585 103.721 23.726 1.00 0.00 H ATOM 93635 H2 WAT 5989 63.234 103.416 25.167 1.00 0.00 H TER 93637 WAT 5989 ATOM 93637 O WAT 5990 128.991 72.539 123.024 1.00 0.00 O ATOM 93638 H1 WAT 5990 128.353 73.102 122.586 1.00 0.00 H ATOM 93639 H2 WAT 5990 128.521 71.720 123.179 1.00 0.00 H TER 93641 WAT 5990 ATOM 93641 O WAT 5991 139.382 141.578 5.152 1.00 0.00 O ATOM 93642 H1 WAT 5991 138.566 141.373 5.609 1.00 0.00 H ATOM 93643 H2 WAT 5991 140.027 141.685 5.851 1.00 0.00 H TER 93645 WAT 5991 ATOM 93645 O WAT 5992 46.905 119.144 18.681 1.00 0.00 O ATOM 93646 H1 WAT 5992 46.106 119.642 18.857 1.00 0.00 H ATOM 93647 H2 WAT 5992 47.578 119.810 18.545 1.00 0.00 H TER 93649 WAT 5992 ATOM 93649 O WAT 5993 114.572 75.588 119.387 1.00 0.00 O ATOM 93650 H1 WAT 5993 114.333 74.860 119.961 1.00 0.00 H ATOM 93651 H2 WAT 5993 115.165 75.201 118.743 1.00 0.00 H TER 93653 WAT 5993 ATOM 93653 O WAT 5994 98.671 67.588 80.505 1.00 0.00 O ATOM 93654 H1 WAT 5994 98.398 67.493 81.418 1.00 0.00 H ATOM 93655 H2 WAT 5994 99.304 68.306 80.518 1.00 0.00 H TER 93657 WAT 5994 ATOM 93657 O WAT 5995 138.511 17.152 93.298 1.00 0.00 O ATOM 93658 H1 WAT 5995 138.709 16.526 92.602 1.00 0.00 H ATOM 93659 H2 WAT 5995 137.555 17.174 93.335 1.00 0.00 H TER 93661 WAT 5995 ATOM 93661 O WAT 5996 61.618 102.400 151.964 1.00 0.00 O ATOM 93662 H1 WAT 5996 62.479 101.996 152.074 1.00 0.00 H ATOM 93663 H2 WAT 5996 61.808 103.289 151.665 1.00 0.00 H TER 93665 WAT 5996 ATOM 93665 O WAT 5997 67.553 10.751 113.301 1.00 0.00 O ATOM 93666 H1 WAT 5997 67.631 9.815 113.484 1.00 0.00 H ATOM 93667 H2 WAT 5997 68.434 11.019 113.041 1.00 0.00 H TER 93669 WAT 5997 ATOM 93669 O WAT 5998 40.854 17.880 9.544 1.00 0.00 O ATOM 93670 H1 WAT 5998 40.920 18.789 9.249 1.00 0.00 H ATOM 93671 H2 WAT 5998 40.277 17.918 10.307 1.00 0.00 H TER 93673 WAT 5998 ATOM 93673 O WAT 5999 39.229 13.221 121.952 1.00 0.00 O ATOM 93674 H1 WAT 5999 38.431 13.317 122.473 1.00 0.00 H ATOM 93675 H2 WAT 5999 39.936 13.462 122.551 1.00 0.00 H TER 93677 WAT 5999 ATOM 93677 O WAT 6000 18.419 98.147 99.352 1.00 0.00 O ATOM 93678 H1 WAT 6000 17.884 97.439 98.991 1.00 0.00 H ATOM 93679 H2 WAT 6000 18.323 98.863 98.724 1.00 0.00 H TER 93681 WAT 6000 ATOM 93681 O WAT 6001 17.268 118.579 22.617 1.00 0.00 O ATOM 93682 H1 WAT 6001 17.914 118.698 21.920 1.00 0.00 H ATOM 93683 H2 WAT 6001 17.719 118.864 23.412 1.00 0.00 H TER 93685 WAT 6001 ATOM 93685 O WAT 6002 81.506 37.748 78.710 1.00 0.00 O ATOM 93686 H1 WAT 6002 82.404 37.464 78.882 1.00 0.00 H ATOM 93687 H2 WAT 6002 81.002 36.936 78.665 1.00 0.00 H TER 93689 WAT 6002 ATOM 93689 O WAT 6003 75.221 23.914 114.089 1.00 0.00 O ATOM 93690 H1 WAT 6003 74.835 24.235 113.274 1.00 0.00 H ATOM 93691 H2 WAT 6003 74.678 24.296 114.778 1.00 0.00 H TER 93693 WAT 6003 ATOM 93693 O WAT 6004 89.832 143.165 138.286 1.00 0.00 O ATOM 93694 H1 WAT 6004 90.118 142.286 138.534 1.00 0.00 H ATOM 93695 H2 WAT 6004 90.582 143.726 138.483 1.00 0.00 H TER 93697 WAT 6004 ATOM 93697 O WAT 6005 54.863 36.541 99.503 1.00 0.00 O ATOM 93698 H1 WAT 6005 55.633 37.055 99.263 1.00 0.00 H ATOM 93699 H2 WAT 6005 55.206 35.838 100.054 1.00 0.00 H TER 93701 WAT 6005 ATOM 93701 O WAT 6006 4.511 36.998 6.722 1.00 0.00 O ATOM 93702 H1 WAT 6006 4.566 36.939 5.768 1.00 0.00 H ATOM 93703 H2 WAT 6006 4.891 37.851 6.931 1.00 0.00 H TER 93705 WAT 6006 ATOM 93705 O WAT 6007 61.879 132.924 75.166 1.00 0.00 O ATOM 93706 H1 WAT 6007 62.380 132.131 74.975 1.00 0.00 H ATOM 93707 H2 WAT 6007 62.539 133.615 75.230 1.00 0.00 H TER 93709 WAT 6007 ATOM 93709 O WAT 6008 54.876 77.147 97.387 1.00 0.00 O ATOM 93710 H1 WAT 6008 54.435 77.343 96.560 1.00 0.00 H ATOM 93711 H2 WAT 6008 54.191 76.768 97.939 1.00 0.00 H TER 93713 WAT 6008 ATOM 93713 O WAT 6009 125.700 60.558 153.086 1.00 0.00 O ATOM 93714 H1 WAT 6009 126.282 61.233 153.435 1.00 0.00 H ATOM 93715 H2 WAT 6009 126.086 59.733 153.380 1.00 0.00 H TER 93717 WAT 6009 ATOM 93717 O WAT 6010 117.830 51.238 130.575 1.00 0.00 O ATOM 93718 H1 WAT 6010 117.842 52.121 130.206 1.00 0.00 H ATOM 93719 H2 WAT 6010 117.039 50.838 130.213 1.00 0.00 H TER 93721 WAT 6010 ATOM 93721 O WAT 6011 113.429 45.411 114.447 1.00 0.00 O ATOM 93722 H1 WAT 6011 112.943 44.792 113.902 1.00 0.00 H ATOM 93723 H2 WAT 6011 113.727 44.890 115.193 1.00 0.00 H TER 93725 WAT 6011 ATOM 93725 O WAT 6012 82.265 67.475 151.879 1.00 0.00 O ATOM 93726 H1 WAT 6012 82.419 67.183 150.981 1.00 0.00 H ATOM 93727 H2 WAT 6012 82.844 66.929 152.411 1.00 0.00 H TER 93729 WAT 6012 ATOM 93729 O WAT 6013 24.168 60.914 95.143 1.00 0.00 O ATOM 93730 H1 WAT 6013 24.751 60.453 94.541 1.00 0.00 H ATOM 93731 H2 WAT 6013 23.947 61.727 94.688 1.00 0.00 H TER 93733 WAT 6013 ATOM 93733 O WAT 6014 55.416 126.080 64.801 1.00 0.00 O ATOM 93734 H1 WAT 6014 55.541 126.961 64.449 1.00 0.00 H ATOM 93735 H2 WAT 6014 54.537 126.095 65.178 1.00 0.00 H TER 93737 WAT 6014 ATOM 93737 O WAT 6015 43.135 86.903 145.500 1.00 0.00 O ATOM 93738 H1 WAT 6015 42.454 87.517 145.774 1.00 0.00 H ATOM 93739 H2 WAT 6015 43.441 87.245 144.660 1.00 0.00 H TER 93741 WAT 6015 ATOM 93741 O WAT 6016 80.876 93.899 111.055 1.00 0.00 O ATOM 93742 H1 WAT 6016 81.639 93.332 110.945 1.00 0.00 H ATOM 93743 H2 WAT 6016 81.115 94.711 110.610 1.00 0.00 H TER 93745 WAT 6016 ATOM 93745 O WAT 6017 133.649 1.365 2.886 1.00 0.00 O ATOM 93746 H1 WAT 6017 133.714 0.435 3.102 1.00 0.00 H ATOM 93747 H2 WAT 6017 133.005 1.711 3.504 1.00 0.00 H TER 93749 WAT 6017 ATOM 93749 O WAT 6018 67.691 32.521 60.933 1.00 0.00 O ATOM 93750 H1 WAT 6018 68.393 32.824 61.508 1.00 0.00 H ATOM 93751 H2 WAT 6018 67.010 32.210 61.529 1.00 0.00 H TER 93753 WAT 6018 ATOM 93753 O WAT 6019 89.846 92.283 104.594 1.00 0.00 O ATOM 93754 H1 WAT 6019 89.856 91.330 104.686 1.00 0.00 H ATOM 93755 H2 WAT 6019 89.445 92.598 105.404 1.00 0.00 H TER 93757 WAT 6019 ATOM 93757 O WAT 6020 99.791 17.945 10.669 1.00 0.00 O ATOM 93758 H1 WAT 6020 99.160 17.325 11.034 1.00 0.00 H ATOM 93759 H2 WAT 6020 99.558 18.785 11.063 1.00 0.00 H TER 93761 WAT 6020 ATOM 93761 O WAT 6021 81.259 70.464 19.425 1.00 0.00 O ATOM 93762 H1 WAT 6021 81.057 69.532 19.348 1.00 0.00 H ATOM 93763 H2 WAT 6021 81.211 70.795 18.528 1.00 0.00 H TER 93765 WAT 6021 ATOM 93765 O WAT 6022 102.269 101.018 79.182 1.00 0.00 O ATOM 93766 H1 WAT 6022 101.988 100.530 79.956 1.00 0.00 H ATOM 93767 H2 WAT 6022 102.049 101.929 79.380 1.00 0.00 H TER 93769 WAT 6022 ATOM 93769 O WAT 6023 88.611 131.375 120.421 1.00 0.00 O ATOM 93770 H1 WAT 6023 88.951 131.533 119.540 1.00 0.00 H ATOM 93771 H2 WAT 6023 88.521 132.247 120.804 1.00 0.00 H TER 93773 WAT 6023 ATOM 93773 O WAT 6024 16.108 134.692 89.868 1.00 0.00 O ATOM 93774 H1 WAT 6024 15.346 135.037 89.403 1.00 0.00 H ATOM 93775 H2 WAT 6024 16.836 135.239 89.573 1.00 0.00 H TER 93777 WAT 6024 ATOM 93777 O WAT 6025 2.923 115.229 100.352 1.00 0.00 O ATOM 93778 H1 WAT 6025 3.350 114.733 101.050 1.00 0.00 H ATOM 93779 H2 WAT 6025 3.421 116.045 100.300 1.00 0.00 H TER 93781 WAT 6025 ATOM 93781 O WAT 6026 95.694 35.717 76.361 1.00 0.00 O ATOM 93782 H1 WAT 6026 96.412 35.106 76.194 1.00 0.00 H ATOM 93783 H2 WAT 6026 95.640 35.769 77.315 1.00 0.00 H TER 93785 WAT 6026 ATOM 93785 O WAT 6027 105.237 99.000 64.946 1.00 0.00 O ATOM 93786 H1 WAT 6027 104.930 98.939 64.042 1.00 0.00 H ATOM 93787 H2 WAT 6027 104.437 99.014 65.471 1.00 0.00 H TER 93789 WAT 6027 ATOM 93789 O WAT 6028 121.992 61.778 82.774 1.00 0.00 O ATOM 93790 H1 WAT 6028 121.492 61.933 83.576 1.00 0.00 H ATOM 93791 H2 WAT 6028 121.377 61.332 82.192 1.00 0.00 H TER 93793 WAT 6028 ATOM 93793 O WAT 6029 7.528 26.621 56.593 1.00 0.00 O ATOM 93794 H1 WAT 6029 7.591 25.896 55.971 1.00 0.00 H ATOM 93795 H2 WAT 6029 6.595 26.833 56.619 1.00 0.00 H TER 93797 WAT 6029 ATOM 93797 O WAT 6030 72.103 112.958 88.399 1.00 0.00 O ATOM 93798 H1 WAT 6030 73.000 112.631 88.330 1.00 0.00 H ATOM 93799 H2 WAT 6030 71.927 112.974 89.340 1.00 0.00 H TER 93801 WAT 6030 ATOM 93801 O WAT 6031 98.138 127.789 130.906 1.00 0.00 O ATOM 93802 H1 WAT 6031 97.977 126.889 130.624 1.00 0.00 H ATOM 93803 H2 WAT 6031 97.283 128.103 131.202 1.00 0.00 H TER 93805 WAT 6031 ATOM 93805 O WAT 6032 129.341 105.681 137.620 1.00 0.00 O ATOM 93806 H1 WAT 6032 129.275 104.796 137.262 1.00 0.00 H ATOM 93807 H2 WAT 6032 129.312 105.559 138.569 1.00 0.00 H TER 93809 WAT 6032 ATOM 93809 O WAT 6033 110.274 57.076 151.122 1.00 0.00 O ATOM 93810 H1 WAT 6033 111.165 57.224 150.805 1.00 0.00 H ATOM 93811 H2 WAT 6033 110.335 57.191 152.071 1.00 0.00 H TER 93813 WAT 6033 ATOM 93813 O WAT 6034 47.075 83.017 82.041 1.00 0.00 O ATOM 93814 H1 WAT 6034 47.417 82.213 81.652 1.00 0.00 H ATOM 93815 H2 WAT 6034 47.158 83.673 81.348 1.00 0.00 H TER 93817 WAT 6034 ATOM 93817 O WAT 6035 65.812 44.888 100.597 1.00 0.00 O ATOM 93818 H1 WAT 6035 65.096 44.321 100.309 1.00 0.00 H ATOM 93819 H2 WAT 6035 66.605 44.438 100.307 1.00 0.00 H TER 93821 WAT 6035 ATOM 93821 O WAT 6036 54.429 60.385 94.422 1.00 0.00 O ATOM 93822 H1 WAT 6036 55.320 60.686 94.599 1.00 0.00 H ATOM 93823 H2 WAT 6036 54.497 59.430 94.408 1.00 0.00 H TER 93825 WAT 6036 ATOM 93825 O WAT 6037 25.541 63.934 131.844 1.00 0.00 O ATOM 93826 H1 WAT 6037 25.963 64.374 132.581 1.00 0.00 H ATOM 93827 H2 WAT 6037 24.624 64.202 131.898 1.00 0.00 H TER 93829 WAT 6037 ATOM 93829 O WAT 6038 130.519 131.818 135.340 1.00 0.00 O ATOM 93830 H1 WAT 6038 131.272 131.329 135.673 1.00 0.00 H ATOM 93831 H2 WAT 6038 130.435 132.563 135.936 1.00 0.00 H TER 93833 WAT 6038 ATOM 93833 O WAT 6039 124.011 40.460 63.594 1.00 0.00 O ATOM 93834 H1 WAT 6039 123.919 41.242 63.049 1.00 0.00 H ATOM 93835 H2 WAT 6039 123.113 40.160 63.735 1.00 0.00 H TER 93837 WAT 6039 ATOM 93837 O WAT 6040 22.122 22.419 110.155 1.00 0.00 O ATOM 93838 H1 WAT 6040 21.804 22.914 109.400 1.00 0.00 H ATOM 93839 H2 WAT 6040 21.353 22.315 110.715 1.00 0.00 H TER 93841 WAT 6040 ATOM 93841 O WAT 6041 70.928 121.477 142.113 1.00 0.00 O ATOM 93842 H1 WAT 6041 70.883 121.534 143.068 1.00 0.00 H ATOM 93843 H2 WAT 6041 70.033 121.275 141.842 1.00 0.00 H TER 93845 WAT 6041 ATOM 93845 O WAT 6042 36.774 26.716 99.435 1.00 0.00 O ATOM 93846 H1 WAT 6042 37.676 26.827 99.136 1.00 0.00 H ATOM 93847 H2 WAT 6042 36.839 26.698 100.390 1.00 0.00 H TER 93849 WAT 6042 ATOM 93849 O WAT 6043 141.231 49.310 105.228 1.00 0.00 O ATOM 93850 H1 WAT 6043 141.136 49.121 106.162 1.00 0.00 H ATOM 93851 H2 WAT 6043 141.604 50.190 105.199 1.00 0.00 H TER 93853 WAT 6043 ATOM 93853 O WAT 6044 50.008 90.576 82.388 1.00 0.00 O ATOM 93854 H1 WAT 6044 49.499 90.494 81.581 1.00 0.00 H ATOM 93855 H2 WAT 6044 49.363 90.476 83.089 1.00 0.00 H TER 93857 WAT 6044 ATOM 93857 O WAT 6045 127.224 132.315 18.219 1.00 0.00 O ATOM 93858 H1 WAT 6045 126.509 131.949 17.698 1.00 0.00 H ATOM 93859 H2 WAT 6045 127.122 131.912 19.081 1.00 0.00 H TER 93861 WAT 6045 ATOM 93861 O WAT 6046 109.064 130.485 107.358 1.00 0.00 O ATOM 93862 H1 WAT 6046 109.354 129.628 107.047 1.00 0.00 H ATOM 93863 H2 WAT 6046 108.773 130.940 106.568 1.00 0.00 H TER 93865 WAT 6046 ATOM 93865 O WAT 6047 35.127 100.173 25.365 1.00 0.00 O ATOM 93866 H1 WAT 6047 35.709 99.874 26.064 1.00 0.00 H ATOM 93867 H2 WAT 6047 35.358 101.094 25.238 1.00 0.00 H TER 93869 WAT 6047 ATOM 93869 O WAT 6048 54.790 130.372 10.403 1.00 0.00 O ATOM 93870 H1 WAT 6048 54.987 129.754 9.700 1.00 0.00 H ATOM 93871 H2 WAT 6048 55.633 130.777 10.609 1.00 0.00 H TER 93873 WAT 6048 ATOM 93873 O WAT 6049 132.330 38.789 67.772 1.00 0.00 O ATOM 93874 H1 WAT 6049 132.399 38.733 66.819 1.00 0.00 H ATOM 93875 H2 WAT 6049 131.873 37.987 68.027 1.00 0.00 H TER 93877 WAT 6049 ATOM 93877 O WAT 6050 93.053 13.639 61.120 1.00 0.00 O ATOM 93878 H1 WAT 6050 92.681 14.520 61.156 1.00 0.00 H ATOM 93879 H2 WAT 6050 92.533 13.187 60.455 1.00 0.00 H TER 93881 WAT 6050 ATOM 93881 O WAT 6051 123.457 79.299 63.941 1.00 0.00 O ATOM 93882 H1 WAT 6051 123.195 80.220 63.953 1.00 0.00 H ATOM 93883 H2 WAT 6051 124.410 79.323 63.854 1.00 0.00 H TER 93885 WAT 6051 ATOM 93885 O WAT 6052 95.241 24.106 98.353 1.00 0.00 O ATOM 93886 H1 WAT 6052 94.763 24.154 97.525 1.00 0.00 H ATOM 93887 H2 WAT 6052 95.580 24.991 98.486 1.00 0.00 H TER 93889 WAT 6052 ATOM 93889 O WAT 6053 136.319 96.107 12.340 1.00 0.00 O ATOM 93890 H1 WAT 6053 135.922 96.374 11.511 1.00 0.00 H ATOM 93891 H2 WAT 6053 135.580 95.823 12.878 1.00 0.00 H TER 93893 WAT 6053 ATOM 93893 O WAT 6054 125.422 63.288 154.672 1.00 0.00 O ATOM 93894 H1 WAT 6054 124.744 63.562 155.289 1.00 0.00 H ATOM 93895 H2 WAT 6054 126.180 63.088 155.222 1.00 0.00 H TER 93897 WAT 6054 ATOM 93897 O WAT 6055 112.012 121.147 138.368 1.00 0.00 O ATOM 93898 H1 WAT 6055 111.103 121.378 138.177 1.00 0.00 H ATOM 93899 H2 WAT 6055 111.960 120.274 138.758 1.00 0.00 H TER 93901 WAT 6055 ATOM 93901 O WAT 6056 116.657 18.731 88.424 1.00 0.00 O ATOM 93902 H1 WAT 6056 115.807 18.441 88.757 1.00 0.00 H ATOM 93903 H2 WAT 6056 116.897 18.072 87.774 1.00 0.00 H TER 93905 WAT 6056 ATOM 93905 O WAT 6057 135.474 68.822 68.380 1.00 0.00 O ATOM 93906 H1 WAT 6057 136.412 68.952 68.243 1.00 0.00 H ATOM 93907 H2 WAT 6057 135.147 68.522 67.531 1.00 0.00 H TER 93909 WAT 6057 ATOM 93909 O WAT 6058 144.336 121.393 24.046 1.00 0.00 O ATOM 93910 H1 WAT 6058 144.876 121.778 24.736 1.00 0.00 H ATOM 93911 H2 WAT 6058 144.029 122.143 23.536 1.00 0.00 H TER 93913 WAT 6058 ATOM 93913 O WAT 6059 117.615 123.819 1.466 1.00 0.00 O ATOM 93914 H1 WAT 6059 117.032 123.215 1.926 1.00 0.00 H ATOM 93915 H2 WAT 6059 117.929 124.414 2.146 1.00 0.00 H TER 93917 WAT 6059 ATOM 93917 O WAT 6060 107.581 60.177 77.879 1.00 0.00 O ATOM 93918 H1 WAT 6060 106.769 60.684 77.913 1.00 0.00 H ATOM 93919 H2 WAT 6060 108.182 60.721 77.370 1.00 0.00 H TER 93921 WAT 6060 ATOM 93921 O WAT 6061 135.206 3.547 -0.108 1.00 0.00 O ATOM 93922 H1 WAT 6061 134.830 3.983 0.657 1.00 0.00 H ATOM 93923 H2 WAT 6061 134.516 2.956 -0.410 1.00 0.00 H TER 93925 WAT 6061 ATOM 93925 O WAT 6062 60.472 88.769 72.632 1.00 0.00 O ATOM 93926 H1 WAT 6062 61.130 89.301 72.185 1.00 0.00 H ATOM 93927 H2 WAT 6062 59.689 88.850 72.087 1.00 0.00 H TER 93929 WAT 6062 ATOM 93929 O WAT 6063 96.009 50.211 100.985 1.00 0.00 O ATOM 93930 H1 WAT 6063 96.668 50.810 100.634 1.00 0.00 H ATOM 93931 H2 WAT 6063 96.428 49.350 100.957 1.00 0.00 H TER 93933 WAT 6063 ATOM 93933 O WAT 6064 63.481 125.422 123.650 1.00 0.00 O ATOM 93934 H1 WAT 6064 62.878 125.287 124.382 1.00 0.00 H ATOM 93935 H2 WAT 6064 62.949 125.846 122.977 1.00 0.00 H TER 93937 WAT 6064 ATOM 93937 O WAT 6065 119.669 71.729 151.934 1.00 0.00 O ATOM 93938 H1 WAT 6065 119.296 71.743 152.815 1.00 0.00 H ATOM 93939 H2 WAT 6065 118.911 71.773 151.352 1.00 0.00 H TER 93941 WAT 6065 ATOM 93941 O WAT 6066 13.008 106.180 122.498 1.00 0.00 O ATOM 93942 H1 WAT 6066 13.420 106.179 121.635 1.00 0.00 H ATOM 93943 H2 WAT 6066 13.314 105.372 122.911 1.00 0.00 H TER 93945 WAT 6066 ATOM 93945 O WAT 6067 36.807 96.900 145.822 1.00 0.00 O ATOM 93946 H1 WAT 6067 36.320 97.405 145.170 1.00 0.00 H ATOM 93947 H2 WAT 6067 37.529 97.473 146.079 1.00 0.00 H TER 93949 WAT 6067 ATOM 93949 O WAT 6068 114.018 73.075 151.259 1.00 0.00 O ATOM 93950 H1 WAT 6068 113.154 73.439 151.066 1.00 0.00 H ATOM 93951 H2 WAT 6068 114.620 73.591 150.723 1.00 0.00 H TER 93953 WAT 6068 ATOM 93953 O WAT 6069 29.602 81.385 143.867 1.00 0.00 O ATOM 93954 H1 WAT 6069 29.815 82.317 143.906 1.00 0.00 H ATOM 93955 H2 WAT 6069 29.553 81.112 144.784 1.00 0.00 H TER 93957 WAT 6069 ATOM 93957 O WAT 6070 19.376 66.016 146.216 1.00 0.00 O ATOM 93958 H1 WAT 6070 19.613 65.089 146.210 1.00 0.00 H ATOM 93959 H2 WAT 6070 20.134 66.454 146.604 1.00 0.00 H TER 93961 WAT 6070 ATOM 93961 O WAT 6071 145.134 15.466 130.505 1.00 0.00 O ATOM 93962 H1 WAT 6071 144.355 15.398 131.057 1.00 0.00 H ATOM 93963 H2 WAT 6071 145.218 16.403 130.324 1.00 0.00 H TER 93965 WAT 6071 ATOM 93965 O WAT 6072 113.568 102.506 102.825 1.00 0.00 O ATOM 93966 H1 WAT 6072 114.389 102.077 102.582 1.00 0.00 H ATOM 93967 H2 WAT 6072 113.792 103.435 102.882 1.00 0.00 H TER 93969 WAT 6072 ATOM 93969 O WAT 6073 123.731 130.946 80.549 1.00 0.00 O ATOM 93970 H1 WAT 6073 122.850 130.599 80.412 1.00 0.00 H ATOM 93971 H2 WAT 6073 123.796 131.072 81.495 1.00 0.00 H TER 93973 WAT 6073 ATOM 93973 O WAT 6074 90.554 26.824 12.423 1.00 0.00 O ATOM 93974 H1 WAT 6074 90.248 27.679 12.725 1.00 0.00 H ATOM 93975 H2 WAT 6074 90.735 26.949 11.492 1.00 0.00 H TER 93977 WAT 6074 ATOM 93977 O WAT 6075 132.630 74.598 143.908 1.00 0.00 O ATOM 93978 H1 WAT 6075 133.280 74.124 144.426 1.00 0.00 H ATOM 93979 H2 WAT 6075 131.868 74.019 143.892 1.00 0.00 H TER 93981 WAT 6075 ATOM 93981 O WAT 6076 29.642 108.822 2.793 1.00 0.00 O ATOM 93982 H1 WAT 6076 28.971 108.211 2.490 1.00 0.00 H ATOM 93983 H2 WAT 6076 29.774 109.419 2.056 1.00 0.00 H TER 93985 WAT 6076 ATOM 93985 O WAT 6077 112.548 126.650 80.121 1.00 0.00 O ATOM 93986 H1 WAT 6077 113.176 127.155 80.638 1.00 0.00 H ATOM 93987 H2 WAT 6077 112.281 127.245 79.420 1.00 0.00 H TER 93989 WAT 6077 ATOM 93989 O WAT 6078 34.538 90.719 69.349 1.00 0.00 O ATOM 93990 H1 WAT 6078 33.949 90.265 69.952 1.00 0.00 H ATOM 93991 H2 WAT 6078 33.992 91.391 68.941 1.00 0.00 H TER 93993 WAT 6078 ATOM 93993 O WAT 6079 139.285 111.933 67.618 1.00 0.00 O ATOM 93994 H1 WAT 6079 138.411 111.642 67.358 1.00 0.00 H ATOM 93995 H2 WAT 6079 139.740 112.091 66.791 1.00 0.00 H TER 93997 WAT 6079 ATOM 93997 O WAT 6080 53.966 31.748 125.663 1.00 0.00 O ATOM 93998 H1 WAT 6080 53.310 32.019 126.306 1.00 0.00 H ATOM 93999 H2 WAT 6080 54.058 30.805 125.799 1.00 0.00 H TER 94001 WAT 6080 ATOM 94001 O WAT 6081 85.744 125.534 126.276 1.00 0.00 O ATOM 94002 H1 WAT 6081 86.167 126.061 125.598 1.00 0.00 H ATOM 94003 H2 WAT 6081 84.855 125.394 125.951 1.00 0.00 H TER 94005 WAT 6081 ATOM 94005 O WAT 6082 127.437 136.186 23.799 1.00 0.00 O ATOM 94006 H1 WAT 6082 126.993 136.583 24.548 1.00 0.00 H ATOM 94007 H2 WAT 6082 127.799 135.368 24.141 1.00 0.00 H TER 94009 WAT 6082 ATOM 94009 O WAT 6083 130.117 130.365 129.725 1.00 0.00 O ATOM 94010 H1 WAT 6083 130.028 129.658 130.365 1.00 0.00 H ATOM 94011 H2 WAT 6083 130.743 130.029 129.083 1.00 0.00 H TER 94013 WAT 6083 ATOM 94013 O WAT 6084 98.242 69.727 57.566 1.00 0.00 O ATOM 94014 H1 WAT 6084 97.563 69.648 58.236 1.00 0.00 H ATOM 94015 H2 WAT 6084 97.991 70.500 57.060 1.00 0.00 H TER 94017 WAT 6084 ATOM 94017 O WAT 6085 2.003 97.676 118.812 1.00 0.00 O ATOM 94018 H1 WAT 6085 1.578 96.819 118.803 1.00 0.00 H ATOM 94019 H2 WAT 6085 2.558 97.677 118.032 1.00 0.00 H TER 94021 WAT 6085 ATOM 94021 O WAT 6086 57.956 111.100 103.731 1.00 0.00 O ATOM 94022 H1 WAT 6086 58.309 110.413 104.296 1.00 0.00 H ATOM 94023 H2 WAT 6086 57.967 110.717 102.854 1.00 0.00 H TER 94025 WAT 6086 ATOM 94025 O WAT 6087 122.324 24.141 108.254 1.00 0.00 O ATOM 94026 H1 WAT 6087 122.322 23.497 108.962 1.00 0.00 H ATOM 94027 H2 WAT 6087 122.024 23.653 107.486 1.00 0.00 H TER 94029 WAT 6087 ATOM 94029 O WAT 6088 132.706 131.219 131.565 1.00 0.00 O ATOM 94030 H1 WAT 6088 132.533 132.117 131.848 1.00 0.00 H ATOM 94031 H2 WAT 6088 131.940 130.981 131.043 1.00 0.00 H TER 94033 WAT 6088 ATOM 94033 O WAT 6089 137.564 96.569 15.675 1.00 0.00 O ATOM 94034 H1 WAT 6089 137.544 97.338 15.105 1.00 0.00 H ATOM 94035 H2 WAT 6089 137.876 96.904 16.516 1.00 0.00 H TER 94037 WAT 6089 ATOM 94037 O WAT 6090 120.350 112.722 7.225 1.00 0.00 O ATOM 94038 H1 WAT 6090 120.723 112.617 8.100 1.00 0.00 H ATOM 94039 H2 WAT 6090 119.625 112.098 7.197 1.00 0.00 H TER 94041 WAT 6090 ATOM 94041 O WAT 6091 138.406 68.355 13.112 1.00 0.00 O ATOM 94042 H1 WAT 6091 139.201 67.823 13.151 1.00 0.00 H ATOM 94043 H2 WAT 6091 138.360 68.650 12.202 1.00 0.00 H TER 94045 WAT 6091 ATOM 94045 O WAT 6092 93.321 51.915 60.169 1.00 0.00 O ATOM 94046 H1 WAT 6092 92.860 52.151 59.365 1.00 0.00 H ATOM 94047 H2 WAT 6092 93.517 50.983 60.068 1.00 0.00 H TER 94049 WAT 6092 ATOM 94049 O WAT 6093 97.341 34.778 93.936 1.00 0.00 O ATOM 94050 H1 WAT 6093 97.364 34.051 93.313 1.00 0.00 H ATOM 94051 H2 WAT 6093 98.177 35.227 93.811 1.00 0.00 H TER 94053 WAT 6093 ATOM 94053 O WAT 6094 53.274 25.039 93.639 1.00 0.00 O ATOM 94054 H1 WAT 6094 53.554 24.279 94.149 1.00 0.00 H ATOM 94055 H2 WAT 6094 54.082 25.521 93.463 1.00 0.00 H TER 94057 WAT 6094 ATOM 94057 O WAT 6095 39.389 113.520 109.051 1.00 0.00 O ATOM 94058 H1 WAT 6095 38.820 112.894 108.605 1.00 0.00 H ATOM 94059 H2 WAT 6095 40.240 113.415 108.627 1.00 0.00 H TER 94061 WAT 6095 ATOM 94061 O WAT 6096 110.529 38.068 132.205 1.00 0.00 O ATOM 94062 H1 WAT 6096 110.090 38.877 132.467 1.00 0.00 H ATOM 94063 H2 WAT 6096 110.123 37.836 131.370 1.00 0.00 H TER 94065 WAT 6096 ATOM 94065 O WAT 6097 118.278 28.696 113.445 1.00 0.00 O ATOM 94066 H1 WAT 6097 118.743 27.933 113.789 1.00 0.00 H ATOM 94067 H2 WAT 6097 118.265 28.562 112.497 1.00 0.00 H TER 94069 WAT 6097 ATOM 94069 O WAT 6098 44.491 111.673 107.735 1.00 0.00 O ATOM 94070 H1 WAT 6098 45.124 111.910 108.413 1.00 0.00 H ATOM 94071 H2 WAT 6098 43.707 112.177 107.953 1.00 0.00 H TER 94073 WAT 6098 ATOM 94073 O WAT 6099 2.640 6.320 18.872 1.00 0.00 O ATOM 94074 H1 WAT 6099 2.094 5.700 18.389 1.00 0.00 H ATOM 94075 H2 WAT 6099 2.174 7.153 18.804 1.00 0.00 H TER 94077 WAT 6099 ATOM 94077 O WAT 6100 88.316 85.518 9.507 1.00 0.00 O ATOM 94078 H1 WAT 6100 88.448 85.472 8.560 1.00 0.00 H ATOM 94079 H2 WAT 6100 88.956 84.905 9.868 1.00 0.00 H TER 94081 WAT 6100 ATOM 94081 O WAT 6101 82.786 72.269 108.470 1.00 0.00 O ATOM 94082 H1 WAT 6101 82.283 71.744 107.848 1.00 0.00 H ATOM 94083 H2 WAT 6101 83.071 71.643 109.136 1.00 0.00 H TER 94085 WAT 6101 ATOM 94085 O WAT 6102 53.771 38.463 7.737 1.00 0.00 O ATOM 94086 H1 WAT 6102 53.612 38.291 6.809 1.00 0.00 H ATOM 94087 H2 WAT 6102 53.191 37.855 8.196 1.00 0.00 H TER 94089 WAT 6102 ATOM 94089 O WAT 6103 28.932 76.347 65.851 1.00 0.00 O ATOM 94090 H1 WAT 6103 28.658 76.148 64.956 1.00 0.00 H ATOM 94091 H2 WAT 6103 28.315 75.867 66.403 1.00 0.00 H TER 94093 WAT 6103 ATOM 94093 O WAT 6104 120.527 3.167 74.995 1.00 0.00 O ATOM 94094 H1 WAT 6104 121.274 2.852 74.486 1.00 0.00 H ATOM 94095 H2 WAT 6104 120.610 4.120 74.977 1.00 0.00 H TER 94097 WAT 6104 ATOM 94097 O WAT 6105 53.140 42.050 87.594 1.00 0.00 O ATOM 94098 H1 WAT 6105 53.320 42.551 88.389 1.00 0.00 H ATOM 94099 H2 WAT 6105 53.613 41.227 87.716 1.00 0.00 H TER 94101 WAT 6105 ATOM 94101 O WAT 6106 124.531 11.219 6.281 1.00 0.00 O ATOM 94102 H1 WAT 6106 125.252 10.993 6.870 1.00 0.00 H ATOM 94103 H2 WAT 6106 124.803 10.877 5.429 1.00 0.00 H TER 94105 WAT 6106 ATOM 94105 O WAT 6107 83.975 99.317 156.133 1.00 0.00 O ATOM 94106 H1 WAT 6107 84.431 98.543 156.462 1.00 0.00 H ATOM 94107 H2 WAT 6107 83.048 99.129 156.279 1.00 0.00 H TER 94109 WAT 6107 ATOM 94109 O WAT 6108 66.376 120.895 73.733 1.00 0.00 O ATOM 94110 H1 WAT 6108 65.639 120.683 74.306 1.00 0.00 H ATOM 94111 H2 WAT 6108 66.652 120.051 73.375 1.00 0.00 H TER 94113 WAT 6108 ATOM 94113 O WAT 6109 79.115 143.435 118.205 1.00 0.00 O ATOM 94114 H1 WAT 6109 80.051 143.324 118.376 1.00 0.00 H ATOM 94115 H2 WAT 6109 79.021 144.360 117.979 1.00 0.00 H TER 94117 WAT 6109 ATOM 94117 O WAT 6110 37.033 108.985 156.276 1.00 0.00 O ATOM 94118 H1 WAT 6110 37.303 108.120 156.586 1.00 0.00 H ATOM 94119 H2 WAT 6110 37.336 109.587 156.956 1.00 0.00 H TER 94121 WAT 6110 ATOM 94121 O WAT 6111 77.268 71.260 77.355 1.00 0.00 O ATOM 94122 H1 WAT 6111 77.068 70.392 77.003 1.00 0.00 H ATOM 94123 H2 WAT 6111 77.300 71.132 78.303 1.00 0.00 H TER 94125 WAT 6111 ATOM 94125 O WAT 6112 23.090 20.144 91.982 1.00 0.00 O ATOM 94126 H1 WAT 6112 23.329 20.932 91.494 1.00 0.00 H ATOM 94127 H2 WAT 6112 22.826 20.468 92.844 1.00 0.00 H TER 94129 WAT 6112 ATOM 94129 O WAT 6113 56.264 62.839 146.596 1.00 0.00 O ATOM 94130 H1 WAT 6113 56.079 62.277 145.843 1.00 0.00 H ATOM 94131 H2 WAT 6113 56.141 63.729 146.267 1.00 0.00 H TER 94133 WAT 6113 ATOM 94133 O WAT 6114 51.600 133.940 58.966 1.00 0.00 O ATOM 94134 H1 WAT 6114 51.002 133.425 58.424 1.00 0.00 H ATOM 94135 H2 WAT 6114 52.007 134.555 58.356 1.00 0.00 H TER 94137 WAT 6114 ATOM 94137 O WAT 6115 117.326 104.573 73.417 1.00 0.00 O ATOM 94138 H1 WAT 6115 117.699 105.423 73.652 1.00 0.00 H ATOM 94139 H2 WAT 6115 117.216 104.120 74.254 1.00 0.00 H TER 94141 WAT 6115 ATOM 94141 O WAT 6116 92.041 78.179 128.584 1.00 0.00 O ATOM 94142 H1 WAT 6116 91.411 78.725 128.115 1.00 0.00 H ATOM 94143 H2 WAT 6116 92.285 77.500 127.956 1.00 0.00 H TER 94145 WAT 6116 ATOM 94145 O WAT 6117 96.382 129.016 153.452 1.00 0.00 O ATOM 94146 H1 WAT 6117 96.086 129.876 153.154 1.00 0.00 H ATOM 94147 H2 WAT 6117 95.984 128.400 152.838 1.00 0.00 H TER 94149 WAT 6117 ATOM 94149 O WAT 6118 93.373 114.481 111.163 1.00 0.00 O ATOM 94150 H1 WAT 6118 93.490 115.166 110.504 1.00 0.00 H ATOM 94151 H2 WAT 6118 92.490 114.145 111.005 1.00 0.00 H TER 94153 WAT 6118 ATOM 94153 O WAT 6119 112.655 67.644 122.796 1.00 0.00 O ATOM 94154 H1 WAT 6119 112.530 67.285 121.917 1.00 0.00 H ATOM 94155 H2 WAT 6119 111.975 67.226 123.324 1.00 0.00 H TER 94157 WAT 6119 ATOM 94157 O WAT 6120 67.740 36.482 99.633 1.00 0.00 O ATOM 94158 H1 WAT 6120 67.738 36.314 98.690 1.00 0.00 H ATOM 94159 H2 WAT 6120 67.677 35.614 100.031 1.00 0.00 H TER 94161 WAT 6120 ATOM 94161 O WAT 6121 34.520 31.521 129.302 1.00 0.00 O ATOM 94162 H1 WAT 6121 35.464 31.619 129.425 1.00 0.00 H ATOM 94163 H2 WAT 6121 34.177 31.375 130.184 1.00 0.00 H TER 94165 WAT 6121 ATOM 94165 O WAT 6122 104.698 17.079 94.919 1.00 0.00 O ATOM 94166 H1 WAT 6122 104.855 16.743 94.036 1.00 0.00 H ATOM 94167 H2 WAT 6122 105.476 17.601 95.118 1.00 0.00 H TER 94169 WAT 6122 ATOM 94169 O WAT 6123 77.484 104.689 92.408 1.00 0.00 O ATOM 94170 H1 WAT 6123 78.229 104.630 93.006 1.00 0.00 H ATOM 94171 H2 WAT 6123 77.871 104.624 91.535 1.00 0.00 H TER 94173 WAT 6123 ATOM 94173 O WAT 6124 53.097 98.650 116.773 1.00 0.00 O ATOM 94174 H1 WAT 6124 52.873 99.563 116.954 1.00 0.00 H ATOM 94175 H2 WAT 6124 53.192 98.611 115.821 1.00 0.00 H TER 94177 WAT 6124 ATOM 94177 O WAT 6125 76.497 93.169 12.257 1.00 0.00 O ATOM 94178 H1 WAT 6125 75.816 93.494 11.667 1.00 0.00 H ATOM 94179 H2 WAT 6125 76.666 92.276 11.959 1.00 0.00 H TER 94181 WAT 6125 ATOM 94181 O WAT 6126 138.144 114.974 24.699 1.00 0.00 O ATOM 94182 H1 WAT 6126 138.568 115.697 24.237 1.00 0.00 H ATOM 94183 H2 WAT 6126 137.604 115.399 25.365 1.00 0.00 H TER 94185 WAT 6126 ATOM 94185 O WAT 6127 88.207 12.601 129.634 1.00 0.00 O ATOM 94186 H1 WAT 6127 89.012 12.493 130.142 1.00 0.00 H ATOM 94187 H2 WAT 6127 87.850 13.439 129.927 1.00 0.00 H TER 94189 WAT 6127 ATOM 94189 O WAT 6128 43.863 66.321 137.958 1.00 0.00 O ATOM 94190 H1 WAT 6128 43.320 66.875 138.518 1.00 0.00 H ATOM 94191 H2 WAT 6128 44.728 66.342 138.367 1.00 0.00 H TER 94193 WAT 6128 ATOM 94193 O WAT 6129 101.857 3.258 130.282 1.00 0.00 O ATOM 94194 H1 WAT 6129 102.161 3.616 129.448 1.00 0.00 H ATOM 94195 H2 WAT 6129 101.055 3.744 130.473 1.00 0.00 H TER 94197 WAT 6129 ATOM 94197 O WAT 6130 97.012 136.763 102.127 1.00 0.00 O ATOM 94198 H1 WAT 6130 96.368 137.115 101.513 1.00 0.00 H ATOM 94199 H2 WAT 6130 97.578 137.507 102.333 1.00 0.00 H TER 94201 WAT 6130 ATOM 94201 O WAT 6131 97.223 35.192 136.194 1.00 0.00 O ATOM 94202 H1 WAT 6131 97.379 35.644 137.023 1.00 0.00 H ATOM 94203 H2 WAT 6131 96.709 34.421 136.434 1.00 0.00 H TER 94205 WAT 6131 ATOM 94205 O WAT 6132 81.636 108.077 127.905 1.00 0.00 O ATOM 94206 H1 WAT 6132 82.273 108.787 127.992 1.00 0.00 H ATOM 94207 H2 WAT 6132 82.101 107.299 128.212 1.00 0.00 H TER 94209 WAT 6132 ATOM 94209 O WAT 6133 94.913 81.019 95.311 1.00 0.00 O ATOM 94210 H1 WAT 6133 94.621 80.555 94.527 1.00 0.00 H ATOM 94211 H2 WAT 6133 95.864 81.078 95.215 1.00 0.00 H TER 94213 WAT 6133 ATOM 94213 O WAT 6134 92.920 77.682 19.202 1.00 0.00 O ATOM 94214 H1 WAT 6134 92.182 77.097 19.371 1.00 0.00 H ATOM 94215 H2 WAT 6134 92.738 78.052 18.338 1.00 0.00 H TER 94217 WAT 6134 ATOM 94217 O WAT 6135 18.230 76.114 139.698 1.00 0.00 O ATOM 94218 H1 WAT 6135 17.462 76.662 139.858 1.00 0.00 H ATOM 94219 H2 WAT 6135 18.526 76.366 138.824 1.00 0.00 H TER 94221 WAT 6135 ATOM 94221 O WAT 6136 94.482 50.213 146.083 1.00 0.00 O ATOM 94222 H1 WAT 6136 94.891 49.360 145.933 1.00 0.00 H ATOM 94223 H2 WAT 6136 93.805 50.042 146.738 1.00 0.00 H TER 94225 WAT 6136 ATOM 94225 O WAT 6137 43.660 16.981 52.222 1.00 0.00 O ATOM 94226 H1 WAT 6137 44.316 17.548 52.628 1.00 0.00 H ATOM 94227 H2 WAT 6137 43.842 16.112 52.578 1.00 0.00 H TER 94229 WAT 6137 ATOM 94229 O WAT 6138 119.341 82.312 140.333 1.00 0.00 O ATOM 94230 H1 WAT 6138 119.967 82.978 140.615 1.00 0.00 H ATOM 94231 H2 WAT 6138 118.946 82.674 139.540 1.00 0.00 H TER 94233 WAT 6138 ATOM 94233 O WAT 6139 92.798 126.472 95.961 1.00 0.00 O ATOM 94234 H1 WAT 6139 92.305 126.270 95.165 1.00 0.00 H ATOM 94235 H2 WAT 6139 93.414 127.155 95.695 1.00 0.00 H TER 94237 WAT 6139 ATOM 94237 O WAT 6140 57.090 38.921 99.025 1.00 0.00 O ATOM 94238 H1 WAT 6140 57.414 38.584 99.860 1.00 0.00 H ATOM 94239 H2 WAT 6140 57.497 38.359 98.366 1.00 0.00 H TER 94241 WAT 6140 ATOM 94241 O WAT 6141 41.670 36.701 93.638 1.00 0.00 O ATOM 94242 H1 WAT 6141 41.464 35.994 93.027 1.00 0.00 H ATOM 94243 H2 WAT 6141 42.572 36.529 93.908 1.00 0.00 H TER 94245 WAT 6141 ATOM 94245 O WAT 6142 47.868 109.615 138.777 1.00 0.00 O ATOM 94246 H1 WAT 6142 48.679 110.123 138.775 1.00 0.00 H ATOM 94247 H2 WAT 6142 48.153 108.709 138.657 1.00 0.00 H TER 94249 WAT 6142 ATOM 94249 O WAT 6143 139.284 125.653 158.129 1.00 0.00 O ATOM 94250 H1 WAT 6143 139.460 125.397 157.224 1.00 0.00 H ATOM 94251 H2 WAT 6143 139.874 126.391 158.287 1.00 0.00 H TER 94253 WAT 6143 ATOM 94253 O WAT 6144 59.651 31.519 142.864 1.00 0.00 O ATOM 94254 H1 WAT 6144 60.008 32.309 142.458 1.00 0.00 H ATOM 94255 H2 WAT 6144 60.303 30.842 142.683 1.00 0.00 H TER 94257 WAT 6144 ATOM 94257 O WAT 6145 103.990 106.058 75.605 1.00 0.00 O ATOM 94258 H1 WAT 6145 104.002 105.428 76.326 1.00 0.00 H ATOM 94259 H2 WAT 6145 104.716 106.652 75.792 1.00 0.00 H TER 94261 WAT 6145 ATOM 94261 O WAT 6146 53.134 64.403 145.337 1.00 0.00 O ATOM 94262 H1 WAT 6146 53.983 64.846 145.339 1.00 0.00 H ATOM 94263 H2 WAT 6146 53.305 63.556 145.748 1.00 0.00 H TER 94265 WAT 6146 ATOM 94265 O WAT 6147 123.458 109.349 104.639 1.00 0.00 O ATOM 94266 H1 WAT 6147 124.305 108.953 104.435 1.00 0.00 H ATOM 94267 H2 WAT 6147 123.078 108.772 105.302 1.00 0.00 H TER 94269 WAT 6147 ATOM 94269 O WAT 6148 42.633 134.766 128.194 1.00 0.00 O ATOM 94270 H1 WAT 6148 41.769 134.367 128.089 1.00 0.00 H ATOM 94271 H2 WAT 6148 42.838 134.650 129.122 1.00 0.00 H TER 94273 WAT 6148 ATOM 94273 O WAT 6149 10.881 20.805 144.213 1.00 0.00 O ATOM 94274 H1 WAT 6149 9.971 20.669 144.479 1.00 0.00 H ATOM 94275 H2 WAT 6149 11.383 20.198 144.757 1.00 0.00 H TER 94277 WAT 6149 ATOM 94277 O WAT 6150 97.289 4.539 75.599 1.00 0.00 O ATOM 94278 H1 WAT 6150 98.098 5.018 75.783 1.00 0.00 H ATOM 94279 H2 WAT 6150 97.571 3.776 75.095 1.00 0.00 H TER 94281 WAT 6150 ATOM 94281 O WAT 6151 84.329 64.661 85.565 1.00 0.00 O ATOM 94282 H1 WAT 6151 84.762 65.045 86.327 1.00 0.00 H ATOM 94283 H2 WAT 6151 84.117 63.768 85.835 1.00 0.00 H TER 94285 WAT 6151 ATOM 94285 O WAT 6152 75.595 49.015 72.695 1.00 0.00 O ATOM 94286 H1 WAT 6152 76.344 48.908 72.110 1.00 0.00 H ATOM 94287 H2 WAT 6152 74.902 49.365 72.134 1.00 0.00 H TER 94289 WAT 6152 ATOM 94289 O WAT 6153 66.460 14.718 105.805 1.00 0.00 O ATOM 94290 H1 WAT 6153 66.277 14.481 106.714 1.00 0.00 H ATOM 94291 H2 WAT 6153 66.450 13.885 105.333 1.00 0.00 H TER 94293 WAT 6153 ATOM 94293 O WAT 6154 144.215 64.433 111.778 1.00 0.00 O ATOM 94294 H1 WAT 6154 144.967 64.626 111.217 1.00 0.00 H ATOM 94295 H2 WAT 6154 144.310 65.030 112.520 1.00 0.00 H TER 94297 WAT 6154 ATOM 94297 O WAT 6155 136.114 66.265 146.951 1.00 0.00 O ATOM 94298 H1 WAT 6155 136.349 65.406 146.599 1.00 0.00 H ATOM 94299 H2 WAT 6155 135.787 66.082 147.832 1.00 0.00 H TER 94301 WAT 6155 ATOM 94301 O WAT 6156 105.455 112.959 102.761 1.00 0.00 O ATOM 94302 H1 WAT 6156 104.870 112.391 102.259 1.00 0.00 H ATOM 94303 H2 WAT 6156 104.868 113.540 103.245 1.00 0.00 H TER 94305 WAT 6156 ATOM 94305 O WAT 6157 27.107 145.145 83.051 1.00 0.00 O ATOM 94306 H1 WAT 6157 26.513 144.998 83.788 1.00 0.00 H ATOM 94307 H2 WAT 6157 27.270 146.088 83.059 1.00 0.00 H TER 94309 WAT 6157 ATOM 94309 O WAT 6158 98.235 113.437 84.063 1.00 0.00 O ATOM 94310 H1 WAT 6158 98.636 114.198 83.642 1.00 0.00 H ATOM 94311 H2 WAT 6158 98.963 112.990 84.494 1.00 0.00 H TER 94313 WAT 6158 ATOM 94313 O WAT 6159 108.466 87.031 149.058 1.00 0.00 O ATOM 94314 H1 WAT 6159 108.088 87.628 149.704 1.00 0.00 H ATOM 94315 H2 WAT 6159 109.345 87.375 148.900 1.00 0.00 H TER 94317 WAT 6159 ATOM 94317 O WAT 6160 9.106 110.063 16.311 1.00 0.00 O ATOM 94318 H1 WAT 6160 9.545 110.914 16.293 1.00 0.00 H ATOM 94319 H2 WAT 6160 9.468 109.623 17.080 1.00 0.00 H TER 94321 WAT 6160 ATOM 94321 O WAT 6161 119.946 13.760 1.418 1.00 0.00 O ATOM 94322 H1 WAT 6161 120.777 13.359 1.673 1.00 0.00 H ATOM 94323 H2 WAT 6161 119.796 13.453 0.524 1.00 0.00 H TER 94325 WAT 6161 ATOM 94325 O WAT 6162 8.939 63.978 4.814 1.00 0.00 O ATOM 94326 H1 WAT 6162 7.989 64.028 4.703 1.00 0.00 H ATOM 94327 H2 WAT 6162 9.061 63.418 5.580 1.00 0.00 H TER 94329 WAT 6162 ATOM 94329 O WAT 6163 45.098 8.292 127.145 1.00 0.00 O ATOM 94330 H1 WAT 6163 45.176 8.523 126.220 1.00 0.00 H ATOM 94331 H2 WAT 6163 44.161 8.150 127.279 1.00 0.00 H TER 94333 WAT 6163 ATOM 94333 O WAT 6164 19.320 0.781 87.150 1.00 0.00 O ATOM 94334 H1 WAT 6164 18.639 0.244 87.554 1.00 0.00 H ATOM 94335 H2 WAT 6164 19.851 1.089 87.885 1.00 0.00 H TER 94337 WAT 6164 ATOM 94337 O WAT 6165 109.197 145.269 120.858 1.00 0.00 O ATOM 94338 H1 WAT 6165 109.811 146.002 120.817 1.00 0.00 H ATOM 94339 H2 WAT 6165 109.736 144.519 121.108 1.00 0.00 H TER 94341 WAT 6165 ATOM 94341 O WAT 6166 15.109 20.229 22.703 1.00 0.00 O ATOM 94342 H1 WAT 6166 15.669 19.543 22.340 1.00 0.00 H ATOM 94343 H2 WAT 6166 15.601 21.038 22.565 1.00 0.00 H TER 94345 WAT 6166 ATOM 94345 O WAT 6167 71.936 32.090 60.699 1.00 0.00 O ATOM 94346 H1 WAT 6167 72.073 31.343 60.117 1.00 0.00 H ATOM 94347 H2 WAT 6167 72.768 32.188 61.163 1.00 0.00 H TER 94349 WAT 6167 ATOM 94349 O WAT 6168 145.132 129.111 120.062 1.00 0.00 O ATOM 94350 H1 WAT 6168 145.311 129.360 119.155 1.00 0.00 H ATOM 94351 H2 WAT 6168 145.418 128.200 120.121 1.00 0.00 H TER 94353 WAT 6168 ATOM 94353 O WAT 6169 134.263 57.586 52.949 1.00 0.00 O ATOM 94354 H1 WAT 6169 134.951 56.936 52.807 1.00 0.00 H ATOM 94355 H2 WAT 6169 133.907 57.373 53.812 1.00 0.00 H TER 94357 WAT 6169 ATOM 94357 O WAT 6170 73.107 104.113 19.221 1.00 0.00 O ATOM 94358 H1 WAT 6170 72.759 104.090 20.113 1.00 0.00 H ATOM 94359 H2 WAT 6170 72.896 104.992 18.905 1.00 0.00 H TER 94361 WAT 6170 ATOM 94361 O WAT 6171 34.771 84.222 81.930 1.00 0.00 O ATOM 94362 H1 WAT 6171 35.067 84.570 82.771 1.00 0.00 H ATOM 94363 H2 WAT 6171 33.891 83.887 82.105 1.00 0.00 H TER 94365 WAT 6171 ATOM 94365 O WAT 6172 67.328 94.347 87.346 1.00 0.00 O ATOM 94366 H1 WAT 6172 67.265 95.262 87.620 1.00 0.00 H ATOM 94367 H2 WAT 6172 68.063 93.996 87.849 1.00 0.00 H TER 94369 WAT 6172 ATOM 94369 O WAT 6173 71.737 128.879 90.562 1.00 0.00 O ATOM 94370 H1 WAT 6173 71.181 128.459 89.906 1.00 0.00 H ATOM 94371 H2 WAT 6173 71.134 129.130 91.262 1.00 0.00 H TER 94373 WAT 6173 ATOM 94373 O WAT 6174 145.224 48.605 127.430 1.00 0.00 O ATOM 94374 H1 WAT 6174 144.491 48.326 127.979 1.00 0.00 H ATOM 94375 H2 WAT 6174 145.276 49.552 127.563 1.00 0.00 H TER 94377 WAT 6174 ATOM 94377 O WAT 6175 133.231 20.693 13.495 1.00 0.00 O ATOM 94378 H1 WAT 6175 132.294 20.549 13.358 1.00 0.00 H ATOM 94379 H2 WAT 6175 133.438 20.191 14.283 1.00 0.00 H TER 94381 WAT 6175 ATOM 94381 O WAT 6176 115.327 26.463 62.274 1.00 0.00 O ATOM 94382 H1 WAT 6176 115.969 26.284 61.587 1.00 0.00 H ATOM 94383 H2 WAT 6176 115.156 25.610 62.672 1.00 0.00 H TER 94385 WAT 6176 ATOM 94385 O WAT 6177 127.807 135.492 78.573 1.00 0.00 O ATOM 94386 H1 WAT 6177 128.696 135.847 78.591 1.00 0.00 H ATOM 94387 H2 WAT 6177 127.554 135.526 77.651 1.00 0.00 H TER 94389 WAT 6177 ATOM 94389 O WAT 6178 54.167 115.035 2.157 1.00 0.00 O ATOM 94390 H1 WAT 6178 54.734 114.845 1.409 1.00 0.00 H ATOM 94391 H2 WAT 6178 53.279 114.924 1.818 1.00 0.00 H TER 94393 WAT 6178 ATOM 94393 O WAT 6179 102.740 5.437 109.390 1.00 0.00 O ATOM 94394 H1 WAT 6179 103.436 5.435 110.047 1.00 0.00 H ATOM 94395 H2 WAT 6179 103.075 5.992 108.686 1.00 0.00 H TER 94397 WAT 6179 ATOM 94397 O WAT 6180 28.803 59.095 156.919 1.00 0.00 O ATOM 94398 H1 WAT 6180 28.586 58.259 157.331 1.00 0.00 H ATOM 94399 H2 WAT 6180 29.758 59.087 156.850 1.00 0.00 H TER 94401 WAT 6180 ATOM 94401 O WAT 6181 40.372 62.251 115.700 1.00 0.00 O ATOM 94402 H1 WAT 6181 41.253 62.598 115.556 1.00 0.00 H ATOM 94403 H2 WAT 6181 40.503 61.311 115.825 1.00 0.00 H TER 94405 WAT 6181 ATOM 94405 O WAT 6182 42.772 136.703 111.505 1.00 0.00 O ATOM 94406 H1 WAT 6182 43.266 137.422 111.897 1.00 0.00 H ATOM 94407 H2 WAT 6182 43.317 136.407 110.776 1.00 0.00 H TER 94409 WAT 6182 ATOM 94409 O WAT 6183 126.038 100.328 94.608 1.00 0.00 O ATOM 94410 H1 WAT 6183 126.841 100.844 94.689 1.00 0.00 H ATOM 94411 H2 WAT 6183 125.880 100.277 93.665 1.00 0.00 H TER 94413 WAT 6183 ATOM 94413 O WAT 6184 24.730 21.745 6.384 1.00 0.00 O ATOM 94414 H1 WAT 6184 24.225 22.183 7.069 1.00 0.00 H ATOM 94415 H2 WAT 6184 24.965 20.898 6.763 1.00 0.00 H TER 94417 WAT 6184 ATOM 94417 O WAT 6185 140.924 110.734 80.826 1.00 0.00 O ATOM 94418 H1 WAT 6185 140.427 111.534 80.655 1.00 0.00 H ATOM 94419 H2 WAT 6185 141.836 110.983 80.681 1.00 0.00 H TER 94421 WAT 6185 ATOM 94421 O WAT 6186 29.555 66.730 108.985 1.00 0.00 O ATOM 94422 H1 WAT 6186 29.338 67.518 109.483 1.00 0.00 H ATOM 94423 H2 WAT 6186 29.551 66.027 109.634 1.00 0.00 H TER 94425 WAT 6186 ATOM 94425 O WAT 6187 30.669 2.340 19.318 1.00 0.00 O ATOM 94426 H1 WAT 6187 30.831 1.855 20.127 1.00 0.00 H ATOM 94427 H2 WAT 6187 31.340 3.022 19.308 1.00 0.00 H TER 94429 WAT 6187 ATOM 94429 O WAT 6188 69.926 57.405 110.298 1.00 0.00 O ATOM 94430 H1 WAT 6188 70.813 57.337 109.946 1.00 0.00 H ATOM 94431 H2 WAT 6188 69.885 56.733 110.978 1.00 0.00 H TER 94433 WAT 6188 ATOM 94433 O WAT 6189 110.278 110.547 6.518 1.00 0.00 O ATOM 94434 H1 WAT 6189 109.716 110.944 5.853 1.00 0.00 H ATOM 94435 H2 WAT 6189 110.461 111.257 7.133 1.00 0.00 H TER 94437 WAT 6189 ATOM 94437 O WAT 6190 84.194 100.444 4.897 1.00 0.00 O ATOM 94438 H1 WAT 6190 84.212 100.898 5.740 1.00 0.00 H ATOM 94439 H2 WAT 6190 84.925 100.821 4.407 1.00 0.00 H TER 94441 WAT 6190 ATOM 94441 O WAT 6191 67.725 111.342 95.560 1.00 0.00 O ATOM 94442 H1 WAT 6191 68.289 110.590 95.384 1.00 0.00 H ATOM 94443 H2 WAT 6191 68.082 111.728 96.360 1.00 0.00 H TER 94445 WAT 6191 ATOM 94445 O WAT 6192 117.761 108.121 25.216 1.00 0.00 O ATOM 94446 H1 WAT 6192 118.548 107.621 25.433 1.00 0.00 H ATOM 94447 H2 WAT 6192 117.049 107.642 25.640 1.00 0.00 H TER 94449 WAT 6192 ATOM 94449 O WAT 6193 126.150 38.576 150.553 1.00 0.00 O ATOM 94450 H1 WAT 6193 126.244 39.191 151.281 1.00 0.00 H ATOM 94451 H2 WAT 6193 126.414 39.077 149.781 1.00 0.00 H TER 94453 WAT 6193 ATOM 94453 O WAT 6194 78.236 60.758 1.840 1.00 0.00 O ATOM 94454 H1 WAT 6194 78.440 60.718 2.774 1.00 0.00 H ATOM 94455 H2 WAT 6194 78.908 61.333 1.473 1.00 0.00 H TER 94457 WAT 6194 ATOM 94457 O WAT 6195 37.217 131.576 55.185 1.00 0.00 O ATOM 94458 H1 WAT 6195 36.883 130.680 55.211 1.00 0.00 H ATOM 94459 H2 WAT 6195 37.554 131.681 54.295 1.00 0.00 H TER 94461 WAT 6195 ATOM 94461 O WAT 6196 141.377 53.130 79.734 1.00 0.00 O ATOM 94462 H1 WAT 6196 141.931 53.693 79.193 1.00 0.00 H ATOM 94463 H2 WAT 6196 141.988 52.524 80.153 1.00 0.00 H TER 94465 WAT 6196 ATOM 94465 O WAT 6197 139.146 41.255 11.012 1.00 0.00 O ATOM 94466 H1 WAT 6197 139.351 40.542 10.406 1.00 0.00 H ATOM 94467 H2 WAT 6197 138.193 41.333 10.976 1.00 0.00 H TER 94469 WAT 6197 ATOM 94469 O WAT 6198 37.913 121.183 124.504 1.00 0.00 O ATOM 94470 H1 WAT 6198 37.969 121.880 125.157 1.00 0.00 H ATOM 94471 H2 WAT 6198 38.801 121.113 124.152 1.00 0.00 H TER 94473 WAT 6198 ATOM 94473 O WAT 6199 57.366 88.455 13.892 1.00 0.00 O ATOM 94474 H1 WAT 6199 58.120 88.575 13.315 1.00 0.00 H ATOM 94475 H2 WAT 6199 56.773 89.171 13.664 1.00 0.00 H TER 94477 WAT 6199 ATOM 94477 O WAT 6200 75.790 44.978 114.906 1.00 0.00 O ATOM 94478 H1 WAT 6200 75.962 44.037 114.900 1.00 0.00 H ATOM 94479 H2 WAT 6200 75.570 45.188 113.999 1.00 0.00 H TER 94481 WAT 6200 ATOM 94481 O WAT 6201 138.988 85.906 94.641 1.00 0.00 O ATOM 94482 H1 WAT 6201 139.738 86.069 94.069 1.00 0.00 H ATOM 94483 H2 WAT 6201 138.399 86.642 94.480 1.00 0.00 H TER 94485 WAT 6201 ATOM 94485 O WAT 6202 78.477 143.582 106.798 1.00 0.00 O ATOM 94486 H1 WAT 6202 78.795 143.143 107.587 1.00 0.00 H ATOM 94487 H2 WAT 6202 79.248 143.654 106.236 1.00 0.00 H TER 94489 WAT 6202 ATOM 94489 O WAT 6203 43.612 112.247 139.883 1.00 0.00 O ATOM 94490 H1 WAT 6203 44.545 112.084 140.019 1.00 0.00 H ATOM 94491 H2 WAT 6203 43.479 113.146 140.185 1.00 0.00 H TER 94493 WAT 6203 ATOM 94493 O WAT 6204 6.626 23.763 76.818 1.00 0.00 O ATOM 94494 H1 WAT 6204 6.087 24.524 77.030 1.00 0.00 H ATOM 94495 H2 WAT 6204 6.862 23.885 75.899 1.00 0.00 H TER 94497 WAT 6204 ATOM 94497 O WAT 6205 101.252 90.472 148.804 1.00 0.00 O ATOM 94498 H1 WAT 6205 101.965 90.980 149.192 1.00 0.00 H ATOM 94499 H2 WAT 6205 101.532 90.318 147.901 1.00 0.00 H TER 94501 WAT 6205 ATOM 94501 O WAT 6206 92.488 111.145 144.080 1.00 0.00 O ATOM 94502 H1 WAT 6206 92.252 111.051 145.003 1.00 0.00 H ATOM 94503 H2 WAT 6206 92.723 112.068 143.986 1.00 0.00 H TER 94505 WAT 6206 ATOM 94505 O WAT 6207 82.101 115.532 118.867 1.00 0.00 O ATOM 94506 H1 WAT 6207 82.859 116.030 118.562 1.00 0.00 H ATOM 94507 H2 WAT 6207 81.844 115.962 119.682 1.00 0.00 H TER 94509 WAT 6207 ATOM 94509 O WAT 6208 144.090 121.721 124.882 1.00 0.00 O ATOM 94510 H1 WAT 6208 143.847 121.012 124.287 1.00 0.00 H ATOM 94511 H2 WAT 6208 144.088 122.505 124.333 1.00 0.00 H TER 94513 WAT 6208 ATOM 94513 O WAT 6209 71.076 32.366 14.943 1.00 0.00 O ATOM 94514 H1 WAT 6209 71.078 31.626 14.335 1.00 0.00 H ATOM 94515 H2 WAT 6209 71.971 32.704 14.911 1.00 0.00 H TER 94517 WAT 6209 ATOM 94517 O WAT 6210 124.684 125.188 128.346 1.00 0.00 O ATOM 94518 H1 WAT 6210 124.590 126.137 128.263 1.00 0.00 H ATOM 94519 H2 WAT 6210 125.426 125.072 128.940 1.00 0.00 H TER 94521 WAT 6210 ATOM 94521 O WAT 6211 108.226 65.267 26.344 1.00 0.00 O ATOM 94522 H1 WAT 6211 108.675 65.647 25.589 1.00 0.00 H ATOM 94523 H2 WAT 6211 107.730 64.533 25.982 1.00 0.00 H TER 94525 WAT 6211 ATOM 94525 O WAT 6212 37.176 64.875 71.530 1.00 0.00 O ATOM 94526 H1 WAT 6212 37.177 65.313 72.381 1.00 0.00 H ATOM 94527 H2 WAT 6212 37.004 65.574 70.900 1.00 0.00 H TER 94529 WAT 6212 ATOM 94529 O WAT 6213 29.096 58.080 2.984 1.00 0.00 O ATOM 94530 H1 WAT 6213 29.136 57.268 2.479 1.00 0.00 H ATOM 94531 H2 WAT 6213 28.858 58.749 2.343 1.00 0.00 H TER 94533 WAT 6213 ATOM 94533 O WAT 6214 4.937 138.114 98.944 1.00 0.00 O ATOM 94534 H1 WAT 6214 4.936 138.968 98.512 1.00 0.00 H ATOM 94535 H2 WAT 6214 4.031 137.811 98.876 1.00 0.00 H TER 94537 WAT 6214 ATOM 94537 O WAT 6215 9.957 43.647 60.287 1.00 0.00 O ATOM 94538 H1 WAT 6215 9.202 43.708 59.702 1.00 0.00 H ATOM 94539 H2 WAT 6215 10.550 43.035 59.850 1.00 0.00 H TER 94541 WAT 6215 ATOM 94541 O WAT 6216 136.595 93.018 90.093 1.00 0.00 O ATOM 94542 H1 WAT 6216 136.608 93.817 89.565 1.00 0.00 H ATOM 94543 H2 WAT 6216 135.818 92.546 89.794 1.00 0.00 H TER 94545 WAT 6216 ATOM 94545 O WAT 6217 127.264 11.837 142.425 1.00 0.00 O ATOM 94546 H1 WAT 6217 127.107 12.368 143.206 1.00 0.00 H ATOM 94547 H2 WAT 6217 126.935 12.371 141.702 1.00 0.00 H TER 94549 WAT 6217 ATOM 94549 O WAT 6218 129.965 27.962 9.998 1.00 0.00 O ATOM 94550 H1 WAT 6218 130.778 27.852 10.493 1.00 0.00 H ATOM 94551 H2 WAT 6218 129.317 27.454 10.486 1.00 0.00 H TER 94553 WAT 6218 ATOM 94553 O WAT 6219 41.761 42.640 105.424 1.00 0.00 O ATOM 94554 H1 WAT 6219 41.283 43.461 105.545 1.00 0.00 H ATOM 94555 H2 WAT 6219 42.677 42.906 105.341 1.00 0.00 H TER 94557 WAT 6219 ATOM 94557 O WAT 6220 138.999 11.140 129.255 1.00 0.00 O ATOM 94558 H1 WAT 6220 138.200 10.875 129.711 1.00 0.00 H ATOM 94559 H2 WAT 6220 138.690 11.658 128.512 1.00 0.00 H TER 94561 WAT 6220 ATOM 94561 O WAT 6221 141.767 60.924 83.889 1.00 0.00 O ATOM 94562 H1 WAT 6221 141.972 61.827 83.647 1.00 0.00 H ATOM 94563 H2 WAT 6221 142.123 60.398 83.173 1.00 0.00 H TER 94565 WAT 6221 ATOM 94565 O WAT 6222 110.792 98.643 64.482 1.00 0.00 O ATOM 94566 H1 WAT 6222 110.036 98.411 63.941 1.00 0.00 H ATOM 94567 H2 WAT 6222 110.469 98.584 65.381 1.00 0.00 H TER 94569 WAT 6222 ATOM 94569 O WAT 6223 54.408 42.129 135.422 1.00 0.00 O ATOM 94570 H1 WAT 6223 55.156 42.707 135.268 1.00 0.00 H ATOM 94571 H2 WAT 6223 53.800 42.327 134.710 1.00 0.00 H TER 94573 WAT 6223 ATOM 94573 O WAT 6224 90.169 133.108 15.607 1.00 0.00 O ATOM 94574 H1 WAT 6224 89.992 132.546 16.362 1.00 0.00 H ATOM 94575 H2 WAT 6224 89.811 133.960 15.853 1.00 0.00 H TER 94577 WAT 6224 ATOM 94577 O WAT 6225 91.780 27.025 98.667 1.00 0.00 O ATOM 94578 H1 WAT 6225 90.842 26.869 98.784 1.00 0.00 H ATOM 94579 H2 WAT 6225 91.878 27.973 98.756 1.00 0.00 H TER 94581 WAT 6225 ATOM 94581 O WAT 6226 41.982 98.432 27.800 1.00 0.00 O ATOM 94582 H1 WAT 6226 42.390 98.824 27.028 1.00 0.00 H ATOM 94583 H2 WAT 6226 41.423 99.124 28.153 1.00 0.00 H TER 94585 WAT 6226 ATOM 94585 O WAT 6227 116.767 117.828 93.983 1.00 0.00 O ATOM 94586 H1 WAT 6227 116.777 118.623 93.450 1.00 0.00 H ATOM 94587 H2 WAT 6227 117.237 117.181 93.457 1.00 0.00 H TER 94589 WAT 6227 ATOM 94589 O WAT 6228 87.396 126.131 17.046 1.00 0.00 O ATOM 94590 H1 WAT 6228 87.806 126.784 17.614 1.00 0.00 H ATOM 94591 H2 WAT 6228 87.689 125.290 17.397 1.00 0.00 H TER 94593 WAT 6228 ATOM 94593 O WAT 6229 87.097 128.456 148.439 1.00 0.00 O ATOM 94594 H1 WAT 6229 87.330 129.370 148.277 1.00 0.00 H ATOM 94595 H2 WAT 6229 87.478 127.977 147.702 1.00 0.00 H TER 94597 WAT 6229 ATOM 94597 O WAT 6230 13.588 29.608 144.897 1.00 0.00 O ATOM 94598 H1 WAT 6230 13.516 28.675 144.694 1.00 0.00 H ATOM 94599 H2 WAT 6230 13.731 29.637 145.843 1.00 0.00 H TER 94601 WAT 6230 ATOM 94601 O WAT 6231 117.209 115.602 80.743 1.00 0.00 O ATOM 94602 H1 WAT 6231 118.087 115.878 80.482 1.00 0.00 H ATOM 94603 H2 WAT 6231 116.729 115.517 79.919 1.00 0.00 H TER 94605 WAT 6231 ATOM 94605 O WAT 6232 135.411 49.289 121.780 1.00 0.00 O ATOM 94606 H1 WAT 6232 134.645 49.637 121.323 1.00 0.00 H ATOM 94607 H2 WAT 6232 135.699 48.553 121.240 1.00 0.00 H TER 94609 WAT 6232 ATOM 94609 O WAT 6233 23.888 11.389 148.297 1.00 0.00 O ATOM 94610 H1 WAT 6233 23.255 12.015 148.650 1.00 0.00 H ATOM 94611 H2 WAT 6233 24.164 11.772 147.465 1.00 0.00 H TER 94613 WAT 6233 ATOM 94613 O WAT 6234 32.223 103.677 107.954 1.00 0.00 O ATOM 94614 H1 WAT 6234 33.127 103.983 107.879 1.00 0.00 H ATOM 94615 H2 WAT 6234 31.728 104.245 107.364 1.00 0.00 H TER 94617 WAT 6234 ATOM 94617 O WAT 6235 100.087 53.550 20.045 1.00 0.00 O ATOM 94618 H1 WAT 6235 99.903 54.183 20.739 1.00 0.00 H ATOM 94619 H2 WAT 6235 99.305 53.565 19.493 1.00 0.00 H TER 94621 WAT 6235 ATOM 94621 O WAT 6236 55.898 4.983 122.491 1.00 0.00 O ATOM 94622 H1 WAT 6236 56.307 5.690 121.991 1.00 0.00 H ATOM 94623 H2 WAT 6236 56.545 4.759 123.161 1.00 0.00 H TER 94625 WAT 6236 ATOM 94625 O WAT 6237 95.567 37.601 142.504 1.00 0.00 O ATOM 94626 H1 WAT 6237 95.347 37.940 143.372 1.00 0.00 H ATOM 94627 H2 WAT 6237 95.378 36.664 142.558 1.00 0.00 H TER 94629 WAT 6237 ATOM 94629 O WAT 6238 67.718 113.795 9.219 1.00 0.00 O ATOM 94630 H1 WAT 6238 67.766 113.844 8.264 1.00 0.00 H ATOM 94631 H2 WAT 6238 67.764 112.859 9.414 1.00 0.00 H TER 94633 WAT 6238 ATOM 94633 O WAT 6239 43.541 47.951 14.926 1.00 0.00 O ATOM 94634 H1 WAT 6239 44.123 48.236 14.222 1.00 0.00 H ATOM 94635 H2 WAT 6239 42.982 48.709 15.098 1.00 0.00 H TER 94637 WAT 6239 ATOM 94637 O WAT 6240 30.289 41.314 108.946 1.00 0.00 O ATOM 94638 H1 WAT 6240 30.887 41.010 108.262 1.00 0.00 H ATOM 94639 H2 WAT 6240 29.595 40.655 108.967 1.00 0.00 H TER 94641 WAT 6240 ATOM 94641 O WAT 6241 37.860 102.847 24.776 1.00 0.00 O ATOM 94642 H1 WAT 6241 36.914 102.929 24.896 1.00 0.00 H ATOM 94643 H2 WAT 6241 38.226 103.603 25.236 1.00 0.00 H TER 94645 WAT 6241 ATOM 94645 O WAT 6242 24.808 124.798 149.936 1.00 0.00 O ATOM 94646 H1 WAT 6242 25.115 124.455 149.097 1.00 0.00 H ATOM 94647 H2 WAT 6242 24.446 124.036 150.389 1.00 0.00 H TER 94649 WAT 6242 ATOM 94649 O WAT 6243 104.136 66.696 114.939 1.00 0.00 O ATOM 94650 H1 WAT 6243 103.493 66.036 115.201 1.00 0.00 H ATOM 94651 H2 WAT 6243 104.375 67.134 115.756 1.00 0.00 H TER 94653 WAT 6243 ATOM 94653 O WAT 6244 61.554 4.827 111.822 1.00 0.00 O ATOM 94654 H1 WAT 6244 62.207 5.511 111.973 1.00 0.00 H ATOM 94655 H2 WAT 6244 61.103 5.099 111.022 1.00 0.00 H TER 94657 WAT 6244 ATOM 94657 O WAT 6245 22.692 144.368 12.720 1.00 0.00 O ATOM 94658 H1 WAT 6245 23.427 144.769 12.256 1.00 0.00 H ATOM 94659 H2 WAT 6245 22.481 143.588 12.207 1.00 0.00 H TER 94661 WAT 6245 ATOM 94661 O WAT 6246 15.710 125.865 24.994 1.00 0.00 O ATOM 94662 H1 WAT 6246 15.005 126.178 25.562 1.00 0.00 H ATOM 94663 H2 WAT 6246 15.817 124.944 25.230 1.00 0.00 H TER 94665 WAT 6246 ATOM 94665 O WAT 6247 56.672 111.106 56.866 1.00 0.00 O ATOM 94666 H1 WAT 6247 55.787 111.299 56.555 1.00 0.00 H ATOM 94667 H2 WAT 6247 57.100 111.961 56.916 1.00 0.00 H TER 94669 WAT 6247 ATOM 94669 O WAT 6248 10.539 132.263 24.303 1.00 0.00 O ATOM 94670 H1 WAT 6248 9.895 131.562 24.211 1.00 0.00 H ATOM 94671 H2 WAT 6248 10.086 132.940 24.806 1.00 0.00 H TER 94673 WAT 6248 ATOM 94673 O WAT 6249 87.892 32.492 102.556 1.00 0.00 O ATOM 94674 H1 WAT 6249 88.773 32.223 102.818 1.00 0.00 H ATOM 94675 H2 WAT 6249 87.824 32.228 101.638 1.00 0.00 H TER 94677 WAT 6249 ATOM 94677 O WAT 6250 109.067 40.472 73.001 1.00 0.00 O ATOM 94678 H1 WAT 6250 109.926 40.139 72.742 1.00 0.00 H ATOM 94679 H2 WAT 6250 108.893 41.187 72.388 1.00 0.00 H TER 94681 WAT 6250 ATOM 94681 O WAT 6251 87.906 35.476 128.960 1.00 0.00 O ATOM 94682 H1 WAT 6251 87.348 34.909 129.493 1.00 0.00 H ATOM 94683 H2 WAT 6251 88.598 35.761 129.557 1.00 0.00 H TER 94685 WAT 6251 ATOM 94685 O WAT 6252 28.986 49.514 123.103 1.00 0.00 O ATOM 94686 H1 WAT 6252 29.689 48.869 123.176 1.00 0.00 H ATOM 94687 H2 WAT 6252 29.431 50.360 123.142 1.00 0.00 H TER 94689 WAT 6252 ATOM 94689 O WAT 6253 55.809 125.035 138.974 1.00 0.00 O ATOM 94690 H1 WAT 6253 56.505 125.505 139.432 1.00 0.00 H ATOM 94691 H2 WAT 6253 55.151 125.705 138.787 1.00 0.00 H TER 94693 WAT 6253 ATOM 94693 O WAT 6254 55.576 125.317 157.483 1.00 0.00 O ATOM 94694 H1 WAT 6254 54.652 125.067 157.457 1.00 0.00 H ATOM 94695 H2 WAT 6254 55.837 125.365 156.564 1.00 0.00 H TER 94697 WAT 6254 ATOM 94697 O WAT 6255 22.440 39.932 145.904 1.00 0.00 O ATOM 94698 H1 WAT 6255 22.365 40.118 146.840 1.00 0.00 H ATOM 94699 H2 WAT 6255 22.296 40.777 145.479 1.00 0.00 H TER 94701 WAT 6255 ATOM 94701 O WAT 6256 145.553 19.543 157.357 1.00 0.00 O ATOM 94702 H1 WAT 6256 145.340 18.994 158.112 1.00 0.00 H ATOM 94703 H2 WAT 6256 144.825 20.162 157.299 1.00 0.00 H TER 94705 WAT 6256 ATOM 94705 O WAT 6257 46.771 139.146 121.420 1.00 0.00 O ATOM 94706 H1 WAT 6257 46.799 140.100 121.494 1.00 0.00 H ATOM 94707 H2 WAT 6257 46.316 138.858 122.212 1.00 0.00 H TER 94709 WAT 6257 ATOM 94709 O WAT 6258 3.490 4.925 98.770 1.00 0.00 O ATOM 94710 H1 WAT 6258 3.179 4.030 98.634 1.00 0.00 H ATOM 94711 H2 WAT 6258 2.976 5.247 99.511 1.00 0.00 H TER 94713 WAT 6258 ATOM 94713 O WAT 6259 86.708 92.039 135.104 1.00 0.00 O ATOM 94714 H1 WAT 6259 86.144 91.289 134.915 1.00 0.00 H ATOM 94715 H2 WAT 6259 86.105 92.779 135.177 1.00 0.00 H TER 94717 WAT 6259 ATOM 94717 O WAT 6260 114.802 93.126 101.281 1.00 0.00 O ATOM 94718 H1 WAT 6260 115.727 93.273 101.088 1.00 0.00 H ATOM 94719 H2 WAT 6260 114.451 93.999 101.454 1.00 0.00 H TER 94721 WAT 6260 ATOM 94721 O WAT 6261 12.456 26.913 115.012 1.00 0.00 O ATOM 94722 H1 WAT 6261 13.114 26.721 114.344 1.00 0.00 H ATOM 94723 H2 WAT 6261 11.989 27.677 114.674 1.00 0.00 H TER 94725 WAT 6261 ATOM 94725 O WAT 6262 96.911 47.376 15.514 1.00 0.00 O ATOM 94726 H1 WAT 6262 96.385 47.477 14.721 1.00 0.00 H ATOM 94727 H2 WAT 6262 97.792 47.643 15.252 1.00 0.00 H TER 94729 WAT 6262 ATOM 94729 O WAT 6263 114.637 10.634 134.901 1.00 0.00 O ATOM 94730 H1 WAT 6263 114.216 10.867 134.074 1.00 0.00 H ATOM 94731 H2 WAT 6263 115.039 9.782 134.733 1.00 0.00 H TER 94733 WAT 6263 ATOM 94733 O WAT 6264 42.628 77.631 21.311 1.00 0.00 O ATOM 94734 H1 WAT 6264 43.436 77.386 20.859 1.00 0.00 H ATOM 94735 H2 WAT 6264 42.121 78.106 20.653 1.00 0.00 H TER 94737 WAT 6264 ATOM 94737 O WAT 6265 82.739 7.941 8.079 1.00 0.00 O ATOM 94738 H1 WAT 6265 82.295 8.754 8.321 1.00 0.00 H ATOM 94739 H2 WAT 6265 82.867 7.482 8.909 1.00 0.00 H TER 94741 WAT 6265 ATOM 94741 O WAT 6266 3.265 17.678 69.166 1.00 0.00 O ATOM 94742 H1 WAT 6266 2.621 17.899 68.493 1.00 0.00 H ATOM 94743 H2 WAT 6266 2.805 17.820 69.993 1.00 0.00 H TER 94745 WAT 6266 ATOM 94745 O WAT 6267 82.125 16.091 109.922 1.00 0.00 O ATOM 94746 H1 WAT 6267 81.526 15.345 109.947 1.00 0.00 H ATOM 94747 H2 WAT 6267 81.858 16.638 110.661 1.00 0.00 H TER 94749 WAT 6267 ATOM 94749 O WAT 6268 33.884 79.789 73.673 1.00 0.00 O ATOM 94750 H1 WAT 6268 34.647 80.340 73.848 1.00 0.00 H ATOM 94751 H2 WAT 6268 33.894 79.660 72.724 1.00 0.00 H TER 94753 WAT 6268 ATOM 94753 O WAT 6269 80.767 60.765 105.535 1.00 0.00 O ATOM 94754 H1 WAT 6269 80.695 61.052 104.625 1.00 0.00 H ATOM 94755 H2 WAT 6269 81.565 60.238 105.558 1.00 0.00 H TER 94757 WAT 6269 ATOM 94757 O WAT 6270 86.014 56.377 91.803 1.00 0.00 O ATOM 94758 H1 WAT 6270 85.129 56.367 92.168 1.00 0.00 H ATOM 94759 H2 WAT 6270 86.112 57.257 91.440 1.00 0.00 H TER 94761 WAT 6270 ATOM 94761 O WAT 6271 106.171 2.785 3.910 1.00 0.00 O ATOM 94762 H1 WAT 6271 106.446 2.370 3.093 1.00 0.00 H ATOM 94763 H2 WAT 6271 106.193 3.723 3.721 1.00 0.00 H TER 94765 WAT 6271 ATOM 94765 O WAT 6272 61.016 71.388 96.979 1.00 0.00 O ATOM 94766 H1 WAT 6272 61.808 71.526 97.497 1.00 0.00 H ATOM 94767 H2 WAT 6272 60.717 72.270 96.758 1.00 0.00 H TER 94769 WAT 6272 ATOM 94769 O WAT 6273 113.352 61.090 67.042 1.00 0.00 O ATOM 94770 H1 WAT 6273 113.342 61.254 67.985 1.00 0.00 H ATOM 94771 H2 WAT 6273 113.571 61.937 66.654 1.00 0.00 H TER 94773 WAT 6273 ATOM 94773 O WAT 6274 63.306 23.099 18.674 1.00 0.00 O ATOM 94774 H1 WAT 6274 62.643 22.545 18.262 1.00 0.00 H ATOM 94775 H2 WAT 6274 62.825 23.598 19.334 1.00 0.00 H TER 94777 WAT 6274 ATOM 94777 O WAT 6275 94.900 145.382 145.996 1.00 0.00 O ATOM 94778 H1 WAT 6275 95.381 146.141 145.664 1.00 0.00 H ATOM 94779 H2 WAT 6275 94.152 145.756 146.461 1.00 0.00 H TER 94781 WAT 6275 ATOM 94781 O WAT 6276 8.306 21.424 86.978 1.00 0.00 O ATOM 94782 H1 WAT 6276 7.659 20.824 86.608 1.00 0.00 H ATOM 94783 H2 WAT 6276 7.850 21.852 87.702 1.00 0.00 H TER 94785 WAT 6276 ATOM 94785 O WAT 6277 67.344 2.957 98.575 1.00 0.00 O ATOM 94786 H1 WAT 6277 67.088 3.828 98.879 1.00 0.00 H ATOM 94787 H2 WAT 6277 67.717 2.534 99.348 1.00 0.00 H TER 94789 WAT 6277 ATOM 94789 O WAT 6278 89.645 96.943 99.665 1.00 0.00 O ATOM 94790 H1 WAT 6278 90.075 97.485 100.326 1.00 0.00 H ATOM 94791 H2 WAT 6278 90.263 96.231 99.499 1.00 0.00 H TER 94793 WAT 6278 ATOM 94793 O WAT 6279 131.259 31.954 67.894 1.00 0.00 O ATOM 94794 H1 WAT 6279 130.459 31.920 67.371 1.00 0.00 H ATOM 94795 H2 WAT 6279 131.962 31.772 67.270 1.00 0.00 H TER 94797 WAT 6279 ATOM 94797 O WAT 6280 110.559 83.903 72.175 1.00 0.00 O ATOM 94798 H1 WAT 6280 110.614 83.571 71.279 1.00 0.00 H ATOM 94799 H2 WAT 6280 109.787 84.468 72.173 1.00 0.00 H TER 94801 WAT 6280 ATOM 94801 O WAT 6281 25.328 30.507 116.304 1.00 0.00 O ATOM 94802 H1 WAT 6281 26.098 30.974 116.630 1.00 0.00 H ATOM 94803 H2 WAT 6281 25.533 30.318 115.388 1.00 0.00 H TER 94805 WAT 6281 ATOM 94805 O WAT 6282 83.296 49.438 122.433 1.00 0.00 O ATOM 94806 H1 WAT 6282 82.948 49.036 123.229 1.00 0.00 H ATOM 94807 H2 WAT 6282 83.914 48.793 122.090 1.00 0.00 H TER 94809 WAT 6282 ATOM 94809 O WAT 6283 1.061 27.215 123.685 1.00 0.00 O ATOM 94810 H1 WAT 6283 0.112 27.123 123.771 1.00 0.00 H ATOM 94811 H2 WAT 6283 1.289 26.656 122.942 1.00 0.00 H TER 94813 WAT 6283 ATOM 94813 O WAT 6284 127.793 71.888 23.879 1.00 0.00 O ATOM 94814 H1 WAT 6284 127.741 70.949 23.703 1.00 0.00 H ATOM 94815 H2 WAT 6284 128.388 71.960 24.625 1.00 0.00 H TER 94817 WAT 6284 ATOM 94817 O WAT 6285 76.998 84.170 86.904 1.00 0.00 O ATOM 94818 H1 WAT 6285 76.347 84.700 86.445 1.00 0.00 H ATOM 94819 H2 WAT 6285 76.790 84.285 87.832 1.00 0.00 H TER 94821 WAT 6285 ATOM 94821 O WAT 6286 124.812 95.670 98.843 1.00 0.00 O ATOM 94822 H1 WAT 6286 124.738 94.760 98.555 1.00 0.00 H ATOM 94823 H2 WAT 6286 124.158 95.756 99.536 1.00 0.00 H TER 94825 WAT 6286 ATOM 94825 O WAT 6287 50.093 112.744 81.576 1.00 0.00 O ATOM 94826 H1 WAT 6287 50.521 112.750 82.432 1.00 0.00 H ATOM 94827 H2 WAT 6287 49.183 112.517 81.765 1.00 0.00 H TER 94829 WAT 6287 ATOM 94829 O WAT 6288 94.374 92.369 20.789 1.00 0.00 O ATOM 94830 H1 WAT 6288 94.494 92.900 21.577 1.00 0.00 H ATOM 94831 H2 WAT 6288 93.845 92.917 20.209 1.00 0.00 H TER 94833 WAT 6288 ATOM 94833 O WAT 6289 99.357 29.585 155.097 1.00 0.00 O ATOM 94834 H1 WAT 6289 98.731 30.289 154.927 1.00 0.00 H ATOM 94835 H2 WAT 6289 99.325 29.460 156.045 1.00 0.00 H TER 94837 WAT 6289 ATOM 94837 O WAT 6290 33.608 122.624 73.702 1.00 0.00 O ATOM 94838 H1 WAT 6290 33.734 122.001 74.417 1.00 0.00 H ATOM 94839 H2 WAT 6290 34.066 123.414 73.989 1.00 0.00 H TER 94841 WAT 6290 ATOM 94841 O WAT 6291 145.179 46.089 111.846 1.00 0.00 O ATOM 94842 H1 WAT 6291 144.435 46.374 111.316 1.00 0.00 H ATOM 94843 H2 WAT 6291 145.942 46.472 111.412 1.00 0.00 H TER 94845 WAT 6291 ATOM 94845 O WAT 6292 41.848 55.055 66.521 1.00 0.00 O ATOM 94846 H1 WAT 6292 42.625 54.679 66.935 1.00 0.00 H ATOM 94847 H2 WAT 6292 41.136 54.465 66.769 1.00 0.00 H TER 94849 WAT 6292 ATOM 94849 O WAT 6293 31.445 74.902 101.701 1.00 0.00 O ATOM 94850 H1 WAT 6293 32.144 75.416 101.297 1.00 0.00 H ATOM 94851 H2 WAT 6293 31.640 74.928 102.638 1.00 0.00 H TER 94853 WAT 6293 ATOM 94853 O WAT 6294 105.507 84.064 145.907 1.00 0.00 O ATOM 94854 H1 WAT 6294 106.003 84.669 145.355 1.00 0.00 H ATOM 94855 H2 WAT 6294 104.653 83.995 145.479 1.00 0.00 H TER 94857 WAT 6294 ATOM 94857 O WAT 6295 116.713 34.643 66.430 1.00 0.00 O ATOM 94858 H1 WAT 6295 116.165 34.903 65.689 1.00 0.00 H ATOM 94859 H2 WAT 6295 117.561 35.051 66.255 1.00 0.00 H TER 94861 WAT 6295 ATOM 94861 O WAT 6296 36.523 118.794 74.808 1.00 0.00 O ATOM 94862 H1 WAT 6296 36.821 118.081 75.374 1.00 0.00 H ATOM 94863 H2 WAT 6296 37.226 118.900 74.167 1.00 0.00 H TER 94865 WAT 6296 ATOM 94865 O WAT 6297 82.278 145.717 83.342 1.00 0.00 O ATOM 94866 H1 WAT 6297 81.504 145.244 83.037 1.00 0.00 H ATOM 94867 H2 WAT 6297 82.565 145.232 84.116 1.00 0.00 H TER 94869 WAT 6297 ATOM 94869 O WAT 6298 81.199 100.637 136.405 1.00 0.00 O ATOM 94870 H1 WAT 6298 80.755 101.212 137.028 1.00 0.00 H ATOM 94871 H2 WAT 6298 82.128 100.722 136.620 1.00 0.00 H TER 94873 WAT 6298 ATOM 94873 O WAT 6299 64.250 39.832 135.900 1.00 0.00 O ATOM 94874 H1 WAT 6299 63.525 39.307 136.240 1.00 0.00 H ATOM 94875 H2 WAT 6299 64.516 39.381 135.098 1.00 0.00 H TER 94877 WAT 6299 ATOM 94877 O WAT 6300 19.078 118.769 69.136 1.00 0.00 O ATOM 94878 H1 WAT 6300 19.130 118.198 69.903 1.00 0.00 H ATOM 94879 H2 WAT 6300 18.452 118.334 68.557 1.00 0.00 H TER 94881 WAT 6300 ATOM 94881 O WAT 6301 90.041 6.396 12.750 1.00 0.00 O ATOM 94882 H1 WAT 6301 90.411 6.559 11.882 1.00 0.00 H ATOM 94883 H2 WAT 6301 90.801 6.356 13.331 1.00 0.00 H TER 94885 WAT 6301 ATOM 94885 O WAT 6302 68.446 57.350 63.853 1.00 0.00 O ATOM 94886 H1 WAT 6302 68.153 57.150 64.742 1.00 0.00 H ATOM 94887 H2 WAT 6302 67.912 56.789 63.292 1.00 0.00 H TER 94889 WAT 6302 ATOM 94889 O WAT 6303 17.506 143.160 4.160 1.00 0.00 O ATOM 94890 H1 WAT 6303 17.732 143.166 5.090 1.00 0.00 H ATOM 94891 H2 WAT 6303 17.035 143.982 4.023 1.00 0.00 H TER 94893 WAT 6303 ATOM 94893 O WAT 6304 84.734 85.769 72.497 1.00 0.00 O ATOM 94894 H1 WAT 6304 85.542 85.772 73.011 1.00 0.00 H ATOM 94895 H2 WAT 6304 84.989 86.137 71.650 1.00 0.00 H TER 94897 WAT 6304 ATOM 94897 O WAT 6305 99.899 34.351 105.308 1.00 0.00 O ATOM 94898 H1 WAT 6305 100.854 34.365 105.374 1.00 0.00 H ATOM 94899 H2 WAT 6305 99.610 33.922 106.114 1.00 0.00 H TER 94901 WAT 6305 ATOM 94901 O WAT 6306 89.834 32.578 70.123 1.00 0.00 O ATOM 94902 H1 WAT 6306 89.525 32.762 69.236 1.00 0.00 H ATOM 94903 H2 WAT 6306 89.222 33.044 70.692 1.00 0.00 H TER 94905 WAT 6306 ATOM 94905 O WAT 6307 92.219 62.583 77.089 1.00 0.00 O ATOM 94906 H1 WAT 6307 92.135 63.448 77.490 1.00 0.00 H ATOM 94907 H2 WAT 6307 93.138 62.530 76.826 1.00 0.00 H TER 94909 WAT 6307 ATOM 94909 O WAT 6308 112.478 67.210 128.312 1.00 0.00 O ATOM 94910 H1 WAT 6308 111.932 67.033 129.078 1.00 0.00 H ATOM 94911 H2 WAT 6308 112.178 68.062 127.995 1.00 0.00 H TER 94913 WAT 6308 ATOM 94913 O WAT 6309 107.175 32.506 144.819 1.00 0.00 O ATOM 94914 H1 WAT 6309 106.996 32.883 145.680 1.00 0.00 H ATOM 94915 H2 WAT 6309 108.094 32.243 144.859 1.00 0.00 H TER 94917 WAT 6309 ATOM 94917 O WAT 6310 47.752 114.383 3.436 1.00 0.00 O ATOM 94918 H1 WAT 6310 47.290 114.651 4.230 1.00 0.00 H ATOM 94919 H2 WAT 6310 48.639 114.179 3.731 1.00 0.00 H TER 94921 WAT 6310 ATOM 94921 O WAT 6311 44.933 18.640 94.250 1.00 0.00 O ATOM 94922 H1 WAT 6311 45.848 18.638 93.970 1.00 0.00 H ATOM 94923 H2 WAT 6311 44.933 19.136 95.069 1.00 0.00 H TER 94925 WAT 6311 ATOM 94925 O WAT 6312 66.858 50.591 89.031 1.00 0.00 O ATOM 94926 H1 WAT 6312 67.443 50.691 88.280 1.00 0.00 H ATOM 94927 H2 WAT 6312 67.426 50.699 89.794 1.00 0.00 H TER 94929 WAT 6312 ATOM 94929 O WAT 6313 33.223 73.865 20.788 1.00 0.00 O ATOM 94930 H1 WAT 6313 33.101 74.427 21.553 1.00 0.00 H ATOM 94931 H2 WAT 6313 34.172 73.768 20.711 1.00 0.00 H TER 94933 WAT 6313 ATOM 94933 O WAT 6314 105.237 16.147 3.274 1.00 0.00 O ATOM 94934 H1 WAT 6314 105.984 16.743 3.329 1.00 0.00 H ATOM 94935 H2 WAT 6314 104.746 16.303 4.081 1.00 0.00 H TER 94937 WAT 6314 ATOM 94937 O WAT 6315 29.593 143.737 74.187 1.00 0.00 O ATOM 94938 H1 WAT 6315 28.911 144.368 74.419 1.00 0.00 H ATOM 94939 H2 WAT 6315 29.281 142.906 74.545 1.00 0.00 H TER 94941 WAT 6315 ATOM 94941 O WAT 6316 45.552 83.653 76.812 1.00 0.00 O ATOM 94942 H1 WAT 6316 44.963 82.993 76.446 1.00 0.00 H ATOM 94943 H2 WAT 6316 46.428 83.350 76.575 1.00 0.00 H TER 94945 WAT 6316 ATOM 94945 O WAT 6317 44.111 13.872 127.975 1.00 0.00 O ATOM 94946 H1 WAT 6317 44.120 12.977 128.314 1.00 0.00 H ATOM 94947 H2 WAT 6317 43.971 13.770 127.033 1.00 0.00 H TER 94949 WAT 6317 ATOM 94949 O WAT 6318 107.228 138.174 76.947 1.00 0.00 O ATOM 94950 H1 WAT 6318 106.853 137.655 77.658 1.00 0.00 H ATOM 94951 H2 WAT 6318 107.735 138.855 77.389 1.00 0.00 H TER 94953 WAT 6318 ATOM 94953 O WAT 6319 130.113 97.868 148.200 1.00 0.00 O ATOM 94954 H1 WAT 6319 130.467 98.585 147.675 1.00 0.00 H ATOM 94955 H2 WAT 6319 129.164 97.946 148.104 1.00 0.00 H TER 94957 WAT 6319 ATOM 94957 O WAT 6320 56.987 18.401 140.764 1.00 0.00 O ATOM 94958 H1 WAT 6320 57.179 17.503 140.493 1.00 0.00 H ATOM 94959 H2 WAT 6320 57.481 18.947 140.152 1.00 0.00 H TER 94961 WAT 6320 ATOM 94961 O WAT 6321 124.071 94.535 135.275 1.00 0.00 O ATOM 94962 H1 WAT 6321 124.472 93.928 135.897 1.00 0.00 H ATOM 94963 H2 WAT 6321 123.197 94.698 135.630 1.00 0.00 H TER 94965 WAT 6321 ATOM 94965 O WAT 6322 42.876 59.992 2.664 1.00 0.00 O ATOM 94966 H1 WAT 6322 42.307 59.463 2.105 1.00 0.00 H ATOM 94967 H2 WAT 6322 42.812 59.584 3.527 1.00 0.00 H TER 94969 WAT 6322 ATOM 94969 O WAT 6323 28.178 3.462 87.260 1.00 0.00 O ATOM 94970 H1 WAT 6323 28.256 4.348 86.908 1.00 0.00 H ATOM 94971 H2 WAT 6323 28.117 3.586 88.207 1.00 0.00 H TER 94973 WAT 6323 ATOM 94973 O WAT 6324 36.401 0.516 63.723 1.00 0.00 O ATOM 94974 H1 WAT 6324 36.978 1.176 63.339 1.00 0.00 H ATOM 94975 H2 WAT 6324 36.961 -0.252 63.842 1.00 0.00 H TER 94977 WAT 6324 ATOM 94977 O WAT 6325 23.749 9.712 110.456 1.00 0.00 O ATOM 94978 H1 WAT 6325 23.470 10.590 110.198 1.00 0.00 H ATOM 94979 H2 WAT 6325 24.673 9.810 110.683 1.00 0.00 H TER 94981 WAT 6325 ATOM 94981 O WAT 6326 46.280 63.508 97.964 1.00 0.00 O ATOM 94982 H1 WAT 6326 46.967 63.385 98.620 1.00 0.00 H ATOM 94983 H2 WAT 6326 45.709 64.179 98.338 1.00 0.00 H TER 94985 WAT 6326 ATOM 94985 O WAT 6327 138.916 49.664 111.008 1.00 0.00 O ATOM 94986 H1 WAT 6327 139.449 50.113 111.664 1.00 0.00 H ATOM 94987 H2 WAT 6327 139.151 50.085 110.181 1.00 0.00 H TER 94989 WAT 6327 ATOM 94989 O WAT 6328 42.429 20.456 94.261 1.00 0.00 O ATOM 94990 H1 WAT 6328 41.865 21.207 94.444 1.00 0.00 H ATOM 94991 H2 WAT 6328 42.166 20.165 93.388 1.00 0.00 H TER 94993 WAT 6328 ATOM 94993 O WAT 6329 40.197 79.995 143.866 1.00 0.00 O ATOM 94994 H1 WAT 6329 40.748 79.238 143.670 1.00 0.00 H ATOM 94995 H2 WAT 6329 39.632 79.701 144.581 1.00 0.00 H TER 94997 WAT 6329 ATOM 94997 O WAT 6330 39.665 47.370 129.531 1.00 0.00 O ATOM 94998 H1 WAT 6330 38.725 47.250 129.394 1.00 0.00 H ATOM 94999 H2 WAT 6330 39.726 47.886 130.335 1.00 0.00 H TER 95001 WAT 6330 ATOM 95001 O WAT 6331 78.331 67.200 101.331 1.00 0.00 O ATOM 95002 H1 WAT 6331 78.172 68.072 100.971 1.00 0.00 H ATOM 95003 H2 WAT 6331 78.558 67.358 102.248 1.00 0.00 H TER 95005 WAT 6331 ATOM 95005 O WAT 6332 36.739 140.348 58.035 1.00 0.00 O ATOM 95006 H1 WAT 6332 35.810 140.572 57.981 1.00 0.00 H ATOM 95007 H2 WAT 6332 36.816 139.528 57.546 1.00 0.00 H TER 95009 WAT 6332 ATOM 95009 O WAT 6333 20.580 141.549 131.775 1.00 0.00 O ATOM 95010 H1 WAT 6333 20.860 140.672 132.037 1.00 0.00 H ATOM 95011 H2 WAT 6333 20.756 142.096 132.540 1.00 0.00 H TER 95013 WAT 6333 ATOM 95013 O WAT 6334 53.236 35.061 58.159 1.00 0.00 O ATOM 95014 H1 WAT 6334 54.148 34.883 58.386 1.00 0.00 H ATOM 95015 H2 WAT 6334 52.941 35.687 58.820 1.00 0.00 H TER 95017 WAT 6334 ATOM 95017 O WAT 6335 14.341 92.360 79.240 1.00 0.00 O ATOM 95018 H1 WAT 6335 14.539 92.419 80.174 1.00 0.00 H ATOM 95019 H2 WAT 6335 13.394 92.491 79.187 1.00 0.00 H TER 95021 WAT 6335 ATOM 95021 O WAT 6336 120.356 43.409 10.788 1.00 0.00 O ATOM 95022 H1 WAT 6336 119.466 43.537 10.460 1.00 0.00 H ATOM 95023 H2 WAT 6336 120.685 44.295 10.940 1.00 0.00 H TER 95025 WAT 6336 ATOM 95025 O WAT 6337 128.035 79.533 29.120 1.00 0.00 O ATOM 95026 H1 WAT 6337 128.476 79.946 28.377 1.00 0.00 H ATOM 95027 H2 WAT 6337 128.673 78.905 29.459 1.00 0.00 H TER 95029 WAT 6337 ATOM 95029 O WAT 6338 28.263 122.062 18.859 1.00 0.00 O ATOM 95030 H1 WAT 6338 28.234 121.817 19.783 1.00 0.00 H ATOM 95031 H2 WAT 6338 28.469 121.247 18.401 1.00 0.00 H TER 95033 WAT 6338 ATOM 95033 O WAT 6339 48.246 94.695 113.929 1.00 0.00 O ATOM 95034 H1 WAT 6339 48.561 95.486 114.367 1.00 0.00 H ATOM 95035 H2 WAT 6339 47.387 94.939 113.584 1.00 0.00 H TER 95037 WAT 6339 ATOM 95037 O WAT 6340 107.638 75.352 141.788 1.00 0.00 O ATOM 95038 H1 WAT 6340 107.386 74.699 142.441 1.00 0.00 H ATOM 95039 H2 WAT 6340 107.552 76.190 142.242 1.00 0.00 H TER 95041 WAT 6340 ATOM 95041 O WAT 6341 83.013 129.040 92.772 1.00 0.00 O ATOM 95042 H1 WAT 6341 83.394 128.426 92.144 1.00 0.00 H ATOM 95043 H2 WAT 6341 82.108 129.148 92.482 1.00 0.00 H TER 95045 WAT 6341 ATOM 95045 O WAT 6342 25.960 35.600 66.380 1.00 0.00 O ATOM 95046 H1 WAT 6342 25.445 35.639 67.187 1.00 0.00 H ATOM 95047 H2 WAT 6342 26.157 36.515 66.177 1.00 0.00 H TER 95049 WAT 6342 ATOM 95049 O WAT 6343 132.976 126.237 8.767 1.00 0.00 O ATOM 95050 H1 WAT 6343 133.316 125.428 8.384 1.00 0.00 H ATOM 95051 H2 WAT 6343 132.265 126.498 8.182 1.00 0.00 H TER 95053 WAT 6343 ATOM 95053 O WAT 6344 85.611 146.010 134.470 1.00 0.00 O ATOM 95054 H1 WAT 6344 85.252 145.885 135.349 1.00 0.00 H ATOM 95055 H2 WAT 6344 85.268 145.273 133.965 1.00 0.00 H TER 95057 WAT 6344 ATOM 95057 O WAT 6345 57.961 14.941 3.975 1.00 0.00 O ATOM 95058 H1 WAT 6345 57.405 15.346 4.640 1.00 0.00 H ATOM 95059 H2 WAT 6345 57.401 14.285 3.560 1.00 0.00 H TER 95061 WAT 6345 ATOM 95061 O WAT 6346 136.426 36.477 93.973 1.00 0.00 O ATOM 95062 H1 WAT 6346 136.243 36.937 93.154 1.00 0.00 H ATOM 95063 H2 WAT 6346 136.723 35.609 93.700 1.00 0.00 H TER 95065 WAT 6346 ATOM 95065 O WAT 6347 129.332 92.320 155.379 1.00 0.00 O ATOM 95066 H1 WAT 6347 130.004 91.885 154.855 1.00 0.00 H ATOM 95067 H2 WAT 6347 128.693 91.632 155.569 1.00 0.00 H TER 95069 WAT 6347 ATOM 95069 O WAT 6348 33.568 144.816 97.782 1.00 0.00 O ATOM 95070 H1 WAT 6348 33.518 144.725 96.830 1.00 0.00 H ATOM 95071 H2 WAT 6348 34.124 144.088 98.062 1.00 0.00 H TER 95073 WAT 6348 ATOM 95073 O WAT 6349 10.781 54.982 86.471 1.00 0.00 O ATOM 95074 H1 WAT 6349 10.883 54.175 85.965 1.00 0.00 H ATOM 95075 H2 WAT 6349 9.842 55.167 86.438 1.00 0.00 H TER 95077 WAT 6349 ATOM 95077 O WAT 6350 127.777 120.400 83.212 1.00 0.00 O ATOM 95078 H1 WAT 6350 127.570 121.331 83.130 1.00 0.00 H ATOM 95079 H2 WAT 6350 128.097 120.148 82.346 1.00 0.00 H TER 95081 WAT 6350 ATOM 95081 O WAT 6351 93.478 69.185 4.153 1.00 0.00 O ATOM 95082 H1 WAT 6351 94.122 69.413 3.482 1.00 0.00 H ATOM 95083 H2 WAT 6351 93.162 70.028 4.477 1.00 0.00 H TER 95085 WAT 6351 ATOM 95085 O WAT 6352 65.338 113.205 134.122 1.00 0.00 O ATOM 95086 H1 WAT 6352 65.888 112.504 134.473 1.00 0.00 H ATOM 95087 H2 WAT 6352 65.724 113.408 133.270 1.00 0.00 H TER 95089 WAT 6352 ATOM 95089 O WAT 6353 119.766 90.805 10.144 1.00 0.00 O ATOM 95090 H1 WAT 6353 119.730 90.078 9.522 1.00 0.00 H ATOM 95091 H2 WAT 6353 120.237 90.451 10.899 1.00 0.00 H TER 95093 WAT 6353 ATOM 95093 O WAT 6354 140.989 127.578 77.348 1.00 0.00 O ATOM 95094 H1 WAT 6354 140.542 128.312 76.927 1.00 0.00 H ATOM 95095 H2 WAT 6354 141.154 126.959 76.637 1.00 0.00 H TER 95097 WAT 6354 ATOM 95097 O WAT 6355 25.718 120.206 83.334 1.00 0.00 O ATOM 95098 H1 WAT 6355 25.462 119.438 82.822 1.00 0.00 H ATOM 95099 H2 WAT 6355 26.370 120.650 82.792 1.00 0.00 H TER 95101 WAT 6355 ATOM 95101 O WAT 6356 75.902 112.773 59.932 1.00 0.00 O ATOM 95102 H1 WAT 6356 76.637 112.465 59.401 1.00 0.00 H ATOM 95103 H2 WAT 6356 76.208 112.690 60.835 1.00 0.00 H TER 95105 WAT 6356 ATOM 95105 O WAT 6357 25.922 64.838 94.914 1.00 0.00 O ATOM 95106 H1 WAT 6357 26.067 65.771 94.755 1.00 0.00 H ATOM 95107 H2 WAT 6357 26.687 64.408 94.530 1.00 0.00 H TER 95109 WAT 6357 ATOM 95109 O WAT 6358 52.380 53.157 128.103 1.00 0.00 O ATOM 95110 H1 WAT 6358 51.430 53.269 128.141 1.00 0.00 H ATOM 95111 H2 WAT 6358 52.713 54.016 127.843 1.00 0.00 H TER 95113 WAT 6358 ATOM 95113 O WAT 6359 64.921 17.865 101.374 1.00 0.00 O ATOM 95114 H1 WAT 6359 65.396 17.038 101.297 1.00 0.00 H ATOM 95115 H2 WAT 6359 65.535 18.526 101.053 1.00 0.00 H TER 95117 WAT 6359 ATOM 95117 O WAT 6360 71.729 82.063 98.479 1.00 0.00 O ATOM 95118 H1 WAT 6360 70.927 82.569 98.610 1.00 0.00 H ATOM 95119 H2 WAT 6360 72.252 82.237 99.261 1.00 0.00 H TER 95121 WAT 6360 ATOM 95121 O WAT 6361 131.625 125.035 11.403 1.00 0.00 O ATOM 95122 H1 WAT 6361 131.705 125.984 11.302 1.00 0.00 H ATOM 95123 H2 WAT 6361 132.486 124.695 11.161 1.00 0.00 H TER 95125 WAT 6361 ATOM 95125 O WAT 6362 125.811 141.526 128.538 1.00 0.00 O ATOM 95126 H1 WAT 6362 126.426 141.911 127.915 1.00 0.00 H ATOM 95127 H2 WAT 6362 125.385 142.278 128.950 1.00 0.00 H TER 95129 WAT 6362 ATOM 95129 O WAT 6363 80.021 14.700 133.325 1.00 0.00 O ATOM 95130 H1 WAT 6363 80.417 15.418 132.832 1.00 0.00 H ATOM 95131 H2 WAT 6363 80.578 14.604 134.098 1.00 0.00 H TER 95133 WAT 6363 ATOM 95133 O WAT 6364 40.908 19.834 81.737 1.00 0.00 O ATOM 95134 H1 WAT 6364 41.175 20.753 81.705 1.00 0.00 H ATOM 95135 H2 WAT 6364 41.722 19.354 81.892 1.00 0.00 H TER 95137 WAT 6364 ATOM 95137 O WAT 6365 95.002 64.142 97.097 1.00 0.00 O ATOM 95138 H1 WAT 6365 94.240 64.719 97.048 1.00 0.00 H ATOM 95139 H2 WAT 6365 95.143 63.855 96.195 1.00 0.00 H TER 95141 WAT 6365 ATOM 95141 O WAT 6366 86.587 134.615 118.431 1.00 0.00 O ATOM 95142 H1 WAT 6366 86.669 135.432 117.939 1.00 0.00 H ATOM 95143 H2 WAT 6366 87.072 133.973 117.912 1.00 0.00 H TER 95145 WAT 6366 ATOM 95145 O WAT 6367 10.172 123.415 129.110 1.00 0.00 O ATOM 95146 H1 WAT 6367 9.751 123.942 128.431 1.00 0.00 H ATOM 95147 H2 WAT 6367 10.897 122.980 128.660 1.00 0.00 H TER 95149 WAT 6367 ATOM 95149 O WAT 6368 63.414 84.347 77.585 1.00 0.00 O ATOM 95150 H1 WAT 6368 63.582 83.421 77.757 1.00 0.00 H ATOM 95151 H2 WAT 6368 63.695 84.793 78.384 1.00 0.00 H TER 95153 WAT 6368 ATOM 95153 O WAT 6369 2.896 79.797 10.135 1.00 0.00 O ATOM 95154 H1 WAT 6369 2.540 79.113 9.568 1.00 0.00 H ATOM 95155 H2 WAT 6369 3.250 80.449 9.531 1.00 0.00 H TER 95157 WAT 6369 ATOM 95157 O WAT 6370 117.160 59.883 106.708 1.00 0.00 O ATOM 95158 H1 WAT 6370 117.517 60.232 107.524 1.00 0.00 H ATOM 95159 H2 WAT 6370 117.928 59.595 106.215 1.00 0.00 H TER 95161 WAT 6370 ATOM 95161 O WAT 6371 58.760 72.201 154.695 1.00 0.00 O ATOM 95162 H1 WAT 6371 58.573 71.336 154.331 1.00 0.00 H ATOM 95163 H2 WAT 6371 58.356 72.813 154.080 1.00 0.00 H TER 95165 WAT 6371 ATOM 95165 O WAT 6372 96.833 125.121 142.665 1.00 0.00 O ATOM 95166 H1 WAT 6372 97.592 125.611 142.981 1.00 0.00 H ATOM 95167 H2 WAT 6372 96.957 124.237 143.011 1.00 0.00 H TER 95169 WAT 6372 ATOM 95169 O WAT 6373 69.715 126.230 117.024 1.00 0.00 O ATOM 95170 H1 WAT 6373 69.870 126.204 116.080 1.00 0.00 H ATOM 95171 H2 WAT 6373 70.366 126.847 117.357 1.00 0.00 H TER 95173 WAT 6373 ATOM 95173 O WAT 6374 83.038 105.870 97.279 1.00 0.00 O ATOM 95174 H1 WAT 6374 83.925 106.184 97.104 1.00 0.00 H ATOM 95175 H2 WAT 6374 82.881 106.096 98.196 1.00 0.00 H TER 95177 WAT 6374 ATOM 95177 O WAT 6375 109.293 37.459 71.692 1.00 0.00 O ATOM 95178 H1 WAT 6375 108.822 36.902 72.313 1.00 0.00 H ATOM 95179 H2 WAT 6375 110.124 37.006 71.547 1.00 0.00 H TER 95181 WAT 6375 ATOM 95181 O WAT 6376 133.422 121.339 61.746 1.00 0.00 O ATOM 95182 H1 WAT 6376 133.690 121.665 62.605 1.00 0.00 H ATOM 95183 H2 WAT 6376 132.686 120.756 61.929 1.00 0.00 H TER 95185 WAT 6376 ATOM 95185 O WAT 6377 136.493 104.757 68.161 1.00 0.00 O ATOM 95186 H1 WAT 6377 135.750 104.795 68.763 1.00 0.00 H ATOM 95187 H2 WAT 6377 137.231 105.095 68.668 1.00 0.00 H TER 95189 WAT 6377 ATOM 95189 O WAT 6378 80.026 133.751 137.271 1.00 0.00 O ATOM 95190 H1 WAT 6378 79.999 134.081 136.373 1.00 0.00 H ATOM 95191 H2 WAT 6378 79.757 132.835 137.198 1.00 0.00 H TER 95193 WAT 6378 ATOM 95193 O WAT 6379 59.808 90.474 118.503 1.00 0.00 O ATOM 95194 H1 WAT 6379 60.706 90.583 118.815 1.00 0.00 H ATOM 95195 H2 WAT 6379 59.310 90.232 119.285 1.00 0.00 H TER 95197 WAT 6379 ATOM 95197 O WAT 6380 3.450 22.253 139.628 1.00 0.00 O ATOM 95198 H1 WAT 6380 3.148 22.210 140.535 1.00 0.00 H ATOM 95199 H2 WAT 6380 3.092 23.076 139.295 1.00 0.00 H TER 95201 WAT 6380 ATOM 95201 O WAT 6381 90.860 2.630 152.544 1.00 0.00 O ATOM 95202 H1 WAT 6381 91.096 1.714 152.692 1.00 0.00 H ATOM 95203 H2 WAT 6381 91.639 3.122 152.802 1.00 0.00 H TER 95205 WAT 6381 ATOM 95205 O WAT 6382 136.454 28.109 86.362 1.00 0.00 O ATOM 95206 H1 WAT 6382 136.404 28.776 87.046 1.00 0.00 H ATOM 95207 H2 WAT 6382 135.965 27.365 86.715 1.00 0.00 H TER 95209 WAT 6382 ATOM 95209 O WAT 6383 112.868 109.521 69.010 1.00 0.00 O ATOM 95210 H1 WAT 6383 112.211 110.173 69.253 1.00 0.00 H ATOM 95211 H2 WAT 6383 113.694 110.006 68.997 1.00 0.00 H TER 95213 WAT 6383 ATOM 95213 O WAT 6384 62.792 142.380 117.375 1.00 0.00 O ATOM 95214 H1 WAT 6384 62.165 142.204 118.076 1.00 0.00 H ATOM 95215 H2 WAT 6384 62.484 143.195 116.977 1.00 0.00 H TER 95217 WAT 6384 ATOM 95217 O WAT 6385 74.731 0.882 145.030 1.00 0.00 O ATOM 95218 H1 WAT 6385 74.514 1.794 144.838 1.00 0.00 H ATOM 95219 H2 WAT 6385 75.627 0.915 145.365 1.00 0.00 H TER 95221 WAT 6385 ATOM 95221 O WAT 6386 63.024 90.190 140.987 1.00 0.00 O ATOM 95222 H1 WAT 6386 62.697 90.064 140.097 1.00 0.00 H ATOM 95223 H2 WAT 6386 62.259 90.053 141.545 1.00 0.00 H TER 95225 WAT 6386 ATOM 95225 O WAT 6387 55.288 30.723 94.494 1.00 0.00 O ATOM 95226 H1 WAT 6387 56.038 30.673 93.901 1.00 0.00 H ATOM 95227 H2 WAT 6387 54.916 31.591 94.336 1.00 0.00 H TER 95229 WAT 6387 ATOM 95229 O WAT 6388 23.376 65.567 117.909 1.00 0.00 O ATOM 95230 H1 WAT 6388 24.213 65.401 118.344 1.00 0.00 H ATOM 95231 H2 WAT 6388 23.105 64.711 117.577 1.00 0.00 H TER 95233 WAT 6388 ATOM 95233 O WAT 6389 8.029 11.201 153.226 1.00 0.00 O ATOM 95234 H1 WAT 6389 8.796 10.705 153.512 1.00 0.00 H ATOM 95235 H2 WAT 6389 7.564 10.606 152.638 1.00 0.00 H TER 95237 WAT 6389 ATOM 95237 O WAT 6390 82.194 21.683 12.535 1.00 0.00 O ATOM 95238 H1 WAT 6390 81.250 21.838 12.554 1.00 0.00 H ATOM 95239 H2 WAT 6390 82.422 21.709 11.606 1.00 0.00 H TER 95241 WAT 6390 ATOM 95241 O WAT 6391 39.239 10.276 134.987 1.00 0.00 O ATOM 95242 H1 WAT 6391 39.593 11.133 134.747 1.00 0.00 H ATOM 95243 H2 WAT 6391 39.013 9.868 134.151 1.00 0.00 H TER 95245 WAT 6391 ATOM 95245 O WAT 6392 102.742 39.198 83.195 1.00 0.00 O ATOM 95246 H1 WAT 6392 101.909 39.636 83.371 1.00 0.00 H ATOM 95247 H2 WAT 6392 103.270 39.858 82.747 1.00 0.00 H TER 95249 WAT 6392 ATOM 95249 O WAT 6393 137.301 93.292 70.174 1.00 0.00 O ATOM 95250 H1 WAT 6393 136.587 92.750 70.510 1.00 0.00 H ATOM 95251 H2 WAT 6393 137.122 93.370 69.237 1.00 0.00 H TER 95253 WAT 6393 ATOM 95253 O WAT 6394 82.653 6.579 113.668 1.00 0.00 O ATOM 95254 H1 WAT 6394 81.983 6.922 114.260 1.00 0.00 H ATOM 95255 H2 WAT 6394 83.014 5.822 114.129 1.00 0.00 H TER 95257 WAT 6394 ATOM 95257 O WAT 6395 50.947 73.055 65.763 1.00 0.00 O ATOM 95258 H1 WAT 6395 50.897 72.835 64.833 1.00 0.00 H ATOM 95259 H2 WAT 6395 51.299 73.945 65.780 1.00 0.00 H TER 95261 WAT 6395 ATOM 95261 O WAT 6396 83.526 116.255 59.179 1.00 0.00 O ATOM 95262 H1 WAT 6396 83.776 117.173 59.078 1.00 0.00 H ATOM 95263 H2 WAT 6396 84.316 115.828 59.513 1.00 0.00 H TER 95265 WAT 6396 ATOM 95265 O WAT 6397 107.157 83.547 106.833 1.00 0.00 O ATOM 95266 H1 WAT 6397 107.872 84.184 106.820 1.00 0.00 H ATOM 95267 H2 WAT 6397 106.858 83.504 105.925 1.00 0.00 H TER 95269 WAT 6397 ATOM 95269 O WAT 6398 66.544 61.726 126.895 1.00 0.00 O ATOM 95270 H1 WAT 6398 66.582 61.291 127.747 1.00 0.00 H ATOM 95271 H2 WAT 6398 67.182 61.257 126.358 1.00 0.00 H TER 95273 WAT 6398 ATOM 95273 O WAT 6399 75.773 140.454 118.809 1.00 0.00 O ATOM 95274 H1 WAT 6399 75.241 139.864 119.344 1.00 0.00 H ATOM 95275 H2 WAT 6399 75.185 140.735 118.107 1.00 0.00 H TER 95277 WAT 6399 ATOM 95277 O WAT 6400 115.307 46.882 81.055 1.00 0.00 O ATOM 95278 H1 WAT 6400 115.766 46.415 80.357 1.00 0.00 H ATOM 95279 H2 WAT 6400 115.040 47.710 80.655 1.00 0.00 H TER 95281 WAT 6400 ATOM 95281 O WAT 6401 45.077 3.380 16.380 1.00 0.00 O ATOM 95282 H1 WAT 6401 45.406 3.697 17.221 1.00 0.00 H ATOM 95283 H2 WAT 6401 44.702 4.155 15.963 1.00 0.00 H TER 95285 WAT 6401 ATOM 95285 O WAT 6402 46.850 123.833 6.620 1.00 0.00 O ATOM 95286 H1 WAT 6402 47.571 123.259 6.879 1.00 0.00 H ATOM 95287 H2 WAT 6402 47.152 124.713 6.844 1.00 0.00 H TER 95289 WAT 6402 ATOM 95289 O WAT 6403 74.178 97.534 17.252 1.00 0.00 O ATOM 95290 H1 WAT 6403 73.839 96.903 16.617 1.00 0.00 H ATOM 95291 H2 WAT 6403 73.720 98.349 17.049 1.00 0.00 H TER 95293 WAT 6403 ATOM 95293 O WAT 6404 85.349 63.391 101.093 1.00 0.00 O ATOM 95294 H1 WAT 6404 84.841 64.173 100.874 1.00 0.00 H ATOM 95295 H2 WAT 6404 85.492 62.955 100.253 1.00 0.00 H TER 95297 WAT 6404 ATOM 95297 O WAT 6405 142.718 65.740 67.592 1.00 0.00 O ATOM 95298 H1 WAT 6405 142.322 65.983 68.429 1.00 0.00 H ATOM 95299 H2 WAT 6405 142.413 66.410 66.980 1.00 0.00 H TER 95301 WAT 6405 ATOM 95301 O WAT 6406 87.795 39.261 74.483 1.00 0.00 O ATOM 95302 H1 WAT 6406 88.076 38.581 75.095 1.00 0.00 H ATOM 95303 H2 WAT 6406 87.970 40.083 74.941 1.00 0.00 H TER 95305 WAT 6406 ATOM 95305 O WAT 6407 70.941 80.667 4.608 1.00 0.00 O ATOM 95306 H1 WAT 6407 71.514 81.406 4.813 1.00 0.00 H ATOM 95307 H2 WAT 6407 70.542 80.434 5.446 1.00 0.00 H TER 95309 WAT 6407 ATOM 95309 O WAT 6408 100.924 102.661 86.276 1.00 0.00 O ATOM 95310 H1 WAT 6408 101.406 103.481 86.167 1.00 0.00 H ATOM 95311 H2 WAT 6408 100.004 102.924 86.289 1.00 0.00 H TER 95313 WAT 6408 ATOM 95313 O WAT 6409 90.692 116.618 131.038 1.00 0.00 O ATOM 95314 H1 WAT 6409 90.909 115.907 130.436 1.00 0.00 H ATOM 95315 H2 WAT 6409 91.530 116.869 131.426 1.00 0.00 H TER 95317 WAT 6409 ATOM 95317 O WAT 6410 102.681 92.786 20.546 1.00 0.00 O ATOM 95318 H1 WAT 6410 102.635 92.750 21.501 1.00 0.00 H ATOM 95319 H2 WAT 6410 103.559 93.122 20.361 1.00 0.00 H TER 95321 WAT 6410 ATOM 95321 O WAT 6411 82.779 99.666 91.576 1.00 0.00 O ATOM 95322 H1 WAT 6411 82.482 99.029 92.225 1.00 0.00 H ATOM 95323 H2 WAT 6411 83.331 99.161 90.978 1.00 0.00 H TER 95325 WAT 6411 ATOM 95325 O WAT 6412 113.203 70.881 110.336 1.00 0.00 O ATOM 95326 H1 WAT 6412 113.561 71.188 109.503 1.00 0.00 H ATOM 95327 H2 WAT 6412 113.849 70.253 110.658 1.00 0.00 H TER 95329 WAT 6412 ATOM 95329 O WAT 6413 79.647 18.072 12.320 1.00 0.00 O ATOM 95330 H1 WAT 6413 79.234 18.851 11.948 1.00 0.00 H ATOM 95331 H2 WAT 6413 79.064 17.353 12.077 1.00 0.00 H TER 95333 WAT 6413 ATOM 95333 O WAT 6414 35.501 16.367 78.956 1.00 0.00 O ATOM 95334 H1 WAT 6414 36.373 16.220 79.323 1.00 0.00 H ATOM 95335 H2 WAT 6414 35.638 17.019 78.269 1.00 0.00 H TER 95337 WAT 6414 ATOM 95337 O WAT 6415 3.178 132.757 5.990 1.00 0.00 O ATOM 95338 H1 WAT 6415 2.874 131.881 6.225 1.00 0.00 H ATOM 95339 H2 WAT 6415 2.439 133.330 6.194 1.00 0.00 H TER 95341 WAT 6415 ATOM 95341 O WAT 6416 55.522 0.850 157.321 1.00 0.00 O ATOM 95342 H1 WAT 6416 56.018 0.036 157.416 1.00 0.00 H ATOM 95343 H2 WAT 6416 55.516 1.017 156.378 1.00 0.00 H TER 95345 WAT 6416 ATOM 95345 O WAT 6417 113.842 95.603 72.576 1.00 0.00 O ATOM 95346 H1 WAT 6417 114.186 96.349 73.066 1.00 0.00 H ATOM 95347 H2 WAT 6417 114.106 95.768 71.671 1.00 0.00 H TER 95349 WAT 6417 ATOM 95349 O WAT 6418 126.916 1.432 60.337 1.00 0.00 O ATOM 95350 H1 WAT 6418 126.173 1.989 60.107 1.00 0.00 H ATOM 95351 H2 WAT 6418 127.640 1.768 59.808 1.00 0.00 H TER 95353 WAT 6418 ATOM 95353 O WAT 6419 39.428 91.807 116.333 1.00 0.00 O ATOM 95354 H1 WAT 6419 40.053 91.126 116.580 1.00 0.00 H ATOM 95355 H2 WAT 6419 39.900 92.346 115.697 1.00 0.00 H TER 95357 WAT 6419 ATOM 95357 O WAT 6420 31.474 69.293 62.677 1.00 0.00 O ATOM 95358 H1 WAT 6420 30.876 68.642 63.044 1.00 0.00 H ATOM 95359 H2 WAT 6420 32.033 69.546 63.412 1.00 0.00 H TER 95361 WAT 6420 ATOM 95361 O WAT 6421 95.134 143.162 7.462 1.00 0.00 O ATOM 95362 H1 WAT 6421 95.099 142.502 8.155 1.00 0.00 H ATOM 95363 H2 WAT 6421 94.605 142.794 6.754 1.00 0.00 H TER 95365 WAT 6421 ATOM 95365 O WAT 6422 53.584 4.034 74.469 1.00 0.00 O ATOM 95366 H1 WAT 6422 53.046 4.804 74.649 1.00 0.00 H ATOM 95367 H2 WAT 6422 54.479 4.370 74.433 1.00 0.00 H TER 95369 WAT 6422 ATOM 95369 O WAT 6423 23.298 123.969 74.275 1.00 0.00 O ATOM 95370 H1 WAT 6423 23.035 124.881 74.149 1.00 0.00 H ATOM 95371 H2 WAT 6423 23.528 123.663 73.398 1.00 0.00 H TER 95373 WAT 6423 ATOM 95373 O WAT 6424 83.071 144.985 152.327 1.00 0.00 O ATOM 95374 H1 WAT 6424 82.468 145.214 153.034 1.00 0.00 H ATOM 95375 H2 WAT 6424 83.933 144.967 152.743 1.00 0.00 H TER 95377 WAT 6424 ATOM 95377 O WAT 6425 116.577 53.027 110.862 1.00 0.00 O ATOM 95378 H1 WAT 6425 117.046 52.982 111.695 1.00 0.00 H ATOM 95379 H2 WAT 6425 117.183 52.650 110.225 1.00 0.00 H TER 95381 WAT 6425 ATOM 95381 O WAT 6426 70.635 10.000 89.022 1.00 0.00 O ATOM 95382 H1 WAT 6426 70.700 10.833 89.489 1.00 0.00 H ATOM 95383 H2 WAT 6426 69.942 10.141 88.377 1.00 0.00 H TER 95385 WAT 6426 ATOM 95385 O WAT 6427 62.607 117.701 116.139 1.00 0.00 O ATOM 95386 H1 WAT 6427 63.094 118.263 116.742 1.00 0.00 H ATOM 95387 H2 WAT 6427 62.919 117.956 115.270 1.00 0.00 H TER 95389 WAT 6427 ATOM 95389 O WAT 6428 122.953 21.600 77.288 1.00 0.00 O ATOM 95390 H1 WAT 6428 122.369 21.206 77.935 1.00 0.00 H ATOM 95391 H2 WAT 6428 123.747 21.067 77.326 1.00 0.00 H TER 95393 WAT 6428 ATOM 95393 O WAT 6429 35.410 27.691 61.264 1.00 0.00 O ATOM 95394 H1 WAT 6429 34.600 28.195 61.335 1.00 0.00 H ATOM 95395 H2 WAT 6429 35.233 27.046 60.579 1.00 0.00 H TER 95397 WAT 6429 ATOM 95397 O WAT 6430 99.633 23.365 125.619 1.00 0.00 O ATOM 95398 H1 WAT 6430 100.218 23.163 124.889 1.00 0.00 H ATOM 95399 H2 WAT 6430 99.760 22.643 126.235 1.00 0.00 H TER 95401 WAT 6430 ATOM 95401 O WAT 6431 132.928 63.007 119.462 1.00 0.00 O ATOM 95402 H1 WAT 6431 133.563 62.766 120.137 1.00 0.00 H ATOM 95403 H2 WAT 6431 132.126 62.549 119.714 1.00 0.00 H TER 95405 WAT 6431 ATOM 95405 O WAT 6432 139.329 102.997 81.059 1.00 0.00 O ATOM 95406 H1 WAT 6432 140.187 103.420 81.061 1.00 0.00 H ATOM 95407 H2 WAT 6432 138.837 103.451 81.744 1.00 0.00 H TER 95409 WAT 6432 ATOM 95409 O WAT 6433 133.385 15.896 9.823 1.00 0.00 O ATOM 95410 H1 WAT 6433 132.740 15.631 9.168 1.00 0.00 H ATOM 95411 H2 WAT 6433 133.491 16.838 9.687 1.00 0.00 H TER 95413 WAT 6433 ATOM 95413 O WAT 6434 79.825 107.985 26.339 1.00 0.00 O ATOM 95414 H1 WAT 6434 78.919 107.797 26.583 1.00 0.00 H ATOM 95415 H2 WAT 6434 79.754 108.557 25.575 1.00 0.00 H TER 95417 WAT 6434 ATOM 95417 O WAT 6435 53.792 86.351 151.145 1.00 0.00 O ATOM 95418 H1 WAT 6435 53.258 85.596 151.394 1.00 0.00 H ATOM 95419 H2 WAT 6435 53.238 87.108 151.332 1.00 0.00 H TER 95421 WAT 6435 ATOM 95421 O WAT 6436 84.004 82.589 89.317 1.00 0.00 O ATOM 95422 H1 WAT 6436 83.476 83.336 89.599 1.00 0.00 H ATOM 95423 H2 WAT 6436 84.864 82.962 89.127 1.00 0.00 H TER 95425 WAT 6436 ATOM 95425 O WAT 6437 129.438 141.147 121.311 1.00 0.00 O ATOM 95426 H1 WAT 6437 129.119 140.630 120.571 1.00 0.00 H ATOM 95427 H2 WAT 6437 130.104 141.721 120.933 1.00 0.00 H TER 95429 WAT 6437 ATOM 95429 O WAT 6438 128.591 22.611 76.962 1.00 0.00 O ATOM 95430 H1 WAT 6438 127.814 23.062 77.291 1.00 0.00 H ATOM 95431 H2 WAT 6438 129.326 23.087 77.347 1.00 0.00 H TER 95433 WAT 6438 ATOM 95433 O WAT 6439 122.310 10.362 52.645 1.00 0.00 O ATOM 95434 H1 WAT 6439 122.897 9.949 52.012 1.00 0.00 H ATOM 95435 H2 WAT 6439 122.336 9.783 53.408 1.00 0.00 H TER 95437 WAT 6439 ATOM 95437 O WAT 6440 29.415 45.717 51.315 1.00 0.00 O ATOM 95438 H1 WAT 6440 29.326 46.525 51.819 1.00 0.00 H ATOM 95439 H2 WAT 6440 30.341 45.485 51.395 1.00 0.00 H TER 95441 WAT 6440 ATOM 95441 O WAT 6441 135.481 78.916 22.947 1.00 0.00 O ATOM 95442 H1 WAT 6441 135.626 79.631 23.567 1.00 0.00 H ATOM 95443 H2 WAT 6441 134.667 79.148 22.501 1.00 0.00 H TER 95445 WAT 6441 ATOM 95445 O WAT 6442 106.092 35.459 4.634 1.00 0.00 O ATOM 95446 H1 WAT 6442 106.480 34.702 5.074 1.00 0.00 H ATOM 95447 H2 WAT 6442 105.819 35.124 3.779 1.00 0.00 H TER 95449 WAT 6442 ATOM 95449 O WAT 6443 69.273 28.862 85.095 1.00 0.00 O ATOM 95450 H1 WAT 6443 68.505 28.483 85.522 1.00 0.00 H ATOM 95451 H2 WAT 6443 69.896 29.007 85.807 1.00 0.00 H TER 95453 WAT 6443 ATOM 95453 O WAT 6444 56.846 115.167 118.363 1.00 0.00 O ATOM 95454 H1 WAT 6444 57.214 115.221 117.481 1.00 0.00 H ATOM 95455 H2 WAT 6444 56.332 115.969 118.458 1.00 0.00 H TER 95457 WAT 6444 ATOM 95457 O WAT 6445 131.381 45.397 135.775 1.00 0.00 O ATOM 95458 H1 WAT 6445 130.655 45.828 135.325 1.00 0.00 H ATOM 95459 H2 WAT 6445 132.140 45.950 135.590 1.00 0.00 H TER 95461 WAT 6445 ATOM 95461 O WAT 6446 134.502 129.389 14.938 1.00 0.00 O ATOM 95462 H1 WAT 6446 134.685 128.958 14.103 1.00 0.00 H ATOM 95463 H2 WAT 6446 135.261 129.953 15.088 1.00 0.00 H TER 95465 WAT 6446 ATOM 95465 O WAT 6447 8.735 82.357 112.485 1.00 0.00 O ATOM 95466 H1 WAT 6447 8.119 81.863 111.943 1.00 0.00 H ATOM 95467 H2 WAT 6447 9.589 81.976 112.284 1.00 0.00 H TER 95469 WAT 6447 ATOM 95469 O WAT 6448 68.045 102.672 83.591 1.00 0.00 O ATOM 95470 H1 WAT 6448 67.137 102.389 83.698 1.00 0.00 H ATOM 95471 H2 WAT 6448 67.980 103.599 83.359 1.00 0.00 H TER 95473 WAT 6448 ATOM 95473 O WAT 6449 114.895 34.449 83.452 1.00 0.00 O ATOM 95474 H1 WAT 6449 114.265 33.755 83.256 1.00 0.00 H ATOM 95475 H2 WAT 6449 115.632 34.276 82.866 1.00 0.00 H TER 95477 WAT 6449 ATOM 95477 O WAT 6450 75.895 91.126 147.516 1.00 0.00 O ATOM 95478 H1 WAT 6450 76.122 90.274 147.888 1.00 0.00 H ATOM 95479 H2 WAT 6450 76.433 91.194 146.727 1.00 0.00 H TER 95481 WAT 6450 ATOM 95481 O WAT 6451 81.408 75.724 139.808 1.00 0.00 O ATOM 95482 H1 WAT 6451 80.947 75.698 138.969 1.00 0.00 H ATOM 95483 H2 WAT 6451 81.070 74.970 140.291 1.00 0.00 H TER 95485 WAT 6451 ATOM 95485 O WAT 6452 120.370 34.529 25.674 1.00 0.00 O ATOM 95486 H1 WAT 6452 119.471 34.282 25.456 1.00 0.00 H ATOM 95487 H2 WAT 6452 120.712 33.782 26.165 1.00 0.00 H TER 95489 WAT 6452 ATOM 95489 O WAT 6453 125.219 128.032 102.589 1.00 0.00 O ATOM 95490 H1 WAT 6453 125.601 128.361 101.775 1.00 0.00 H ATOM 95491 H2 WAT 6453 124.390 127.637 102.322 1.00 0.00 H TER 95493 WAT 6453 ATOM 95493 O WAT 6454 32.606 45.906 96.787 1.00 0.00 O ATOM 95494 H1 WAT 6454 32.862 46.554 96.130 1.00 0.00 H ATOM 95495 H2 WAT 6454 32.675 45.066 96.333 1.00 0.00 H TER 95497 WAT 6454 ATOM 95497 O WAT 6455 93.257 84.174 144.751 1.00 0.00 O ATOM 95498 H1 WAT 6455 93.275 83.448 145.376 1.00 0.00 H ATOM 95499 H2 WAT 6455 93.797 83.874 144.020 1.00 0.00 H TER 95501 WAT 6455 ATOM 95501 O WAT 6456 18.764 1.355 137.812 1.00 0.00 O ATOM 95502 H1 WAT 6456 19.126 1.954 137.159 1.00 0.00 H ATOM 95503 H2 WAT 6456 19.505 0.809 138.074 1.00 0.00 H TER 95505 WAT 6456 ATOM 95505 O WAT 6457 72.327 140.221 114.902 1.00 0.00 O ATOM 95506 H1 WAT 6457 73.095 139.806 114.510 1.00 0.00 H ATOM 95507 H2 WAT 6457 71.650 140.155 114.228 1.00 0.00 H TER 95509 WAT 6457 ATOM 95509 O WAT 6458 73.416 82.544 155.266 1.00 0.00 O ATOM 95510 H1 WAT 6458 73.297 82.702 156.203 1.00 0.00 H ATOM 95511 H2 WAT 6458 72.555 82.259 154.960 1.00 0.00 H TER 95513 WAT 6458 ATOM 95513 O WAT 6459 106.658 91.545 110.879 1.00 0.00 O ATOM 95514 H1 WAT 6459 106.525 92.301 111.451 1.00 0.00 H ATOM 95515 H2 WAT 6459 105.952 90.942 111.111 1.00 0.00 H TER 95517 WAT 6459 ATOM 95517 O WAT 6460 99.771 27.612 2.783 1.00 0.00 O ATOM 95518 H1 WAT 6460 98.979 27.736 2.261 1.00 0.00 H ATOM 95519 H2 WAT 6460 100.083 28.499 2.961 1.00 0.00 H TER 95521 WAT 6460 ATOM 95521 O WAT 6461 49.473 22.385 63.034 1.00 0.00 O ATOM 95522 H1 WAT 6461 49.207 23.289 62.870 1.00 0.00 H ATOM 95523 H2 WAT 6461 49.891 22.106 62.219 1.00 0.00 H TER 95525 WAT 6461 ATOM 95525 O WAT 6462 101.130 94.434 91.054 1.00 0.00 O ATOM 95526 H1 WAT 6462 101.385 95.352 90.965 1.00 0.00 H ATOM 95527 H2 WAT 6462 100.718 94.382 91.916 1.00 0.00 H TER 95529 WAT 6462 ATOM 95529 O WAT 6463 140.424 127.428 114.590 1.00 0.00 O ATOM 95530 H1 WAT 6463 141.279 127.848 114.684 1.00 0.00 H ATOM 95531 H2 WAT 6463 139.820 128.151 114.417 1.00 0.00 H TER 95533 WAT 6463 ATOM 95533 O WAT 6464 41.575 11.644 141.083 1.00 0.00 O ATOM 95534 H1 WAT 6464 41.665 11.801 140.143 1.00 0.00 H ATOM 95535 H2 WAT 6464 41.970 12.414 141.493 1.00 0.00 H TER 95537 WAT 6464 ATOM 95537 O WAT 6465 126.709 14.729 154.674 1.00 0.00 O ATOM 95538 H1 WAT 6465 126.981 13.902 154.277 1.00 0.00 H ATOM 95539 H2 WAT 6465 126.653 15.341 153.939 1.00 0.00 H TER 95541 WAT 6465 ATOM 95541 O WAT 6466 91.966 74.817 149.607 1.00 0.00 O ATOM 95542 H1 WAT 6466 92.384 75.475 150.163 1.00 0.00 H ATOM 95543 H2 WAT 6466 91.182 74.557 150.092 1.00 0.00 H TER 95545 WAT 6466 ATOM 95545 O WAT 6467 63.630 25.246 147.379 1.00 0.00 O ATOM 95546 H1 WAT 6467 62.779 25.388 147.794 1.00 0.00 H ATOM 95547 H2 WAT 6467 64.138 24.769 148.034 1.00 0.00 H TER 95549 WAT 6467 ATOM 95549 O WAT 6468 34.292 80.875 24.744 1.00 0.00 O ATOM 95550 H1 WAT 6468 35.145 80.456 24.630 1.00 0.00 H ATOM 95551 H2 WAT 6468 34.382 81.386 25.549 1.00 0.00 H TER 95553 WAT 6468 ATOM 95553 O WAT 6469 22.829 34.408 5.529 1.00 0.00 O ATOM 95554 H1 WAT 6469 22.001 34.600 5.970 1.00 0.00 H ATOM 95555 H2 WAT 6469 22.965 33.471 5.673 1.00 0.00 H TER 95557 WAT 6469 ATOM 95557 O WAT 6470 143.237 122.008 59.154 1.00 0.00 O ATOM 95558 H1 WAT 6470 142.795 122.794 59.476 1.00 0.00 H ATOM 95559 H2 WAT 6470 142.538 121.483 58.765 1.00 0.00 H TER 95561 WAT 6470 ATOM 95561 O WAT 6471 64.107 92.152 78.640 1.00 0.00 O ATOM 95562 H1 WAT 6471 64.945 91.852 78.993 1.00 0.00 H ATOM 95563 H2 WAT 6471 63.459 91.852 79.277 1.00 0.00 H TER 95565 WAT 6471 ATOM 95565 O WAT 6472 77.026 82.029 107.031 1.00 0.00 O ATOM 95566 H1 WAT 6472 76.087 82.207 107.090 1.00 0.00 H ATOM 95567 H2 WAT 6472 77.165 81.281 107.611 1.00 0.00 H TER 95569 WAT 6472 ATOM 95569 O WAT 6473 130.879 16.530 148.986 1.00 0.00 O ATOM 95570 H1 WAT 6473 131.128 15.665 149.313 1.00 0.00 H ATOM 95571 H2 WAT 6473 130.613 17.014 149.768 1.00 0.00 H TER 95573 WAT 6473 ATOM 95573 O WAT 6474 113.627 114.181 72.495 1.00 0.00 O ATOM 95574 H1 WAT 6474 113.144 114.214 71.669 1.00 0.00 H ATOM 95575 H2 WAT 6474 113.935 115.078 72.628 1.00 0.00 H TER 95577 WAT 6474 ATOM 95577 O WAT 6475 95.836 91.672 69.520 1.00 0.00 O ATOM 95578 H1 WAT 6475 95.286 92.340 69.112 1.00 0.00 H ATOM 95579 H2 WAT 6475 95.765 90.915 68.939 1.00 0.00 H TER 95581 WAT 6475 ATOM 95581 O WAT 6476 98.480 1.051 67.407 1.00 0.00 O ATOM 95582 H1 WAT 6476 97.552 1.278 67.343 1.00 0.00 H ATOM 95583 H2 WAT 6476 98.531 0.461 68.159 1.00 0.00 H TER 95585 WAT 6476 ATOM 95585 O WAT 6477 49.267 33.756 71.666 1.00 0.00 O ATOM 95586 H1 WAT 6477 48.486 33.554 71.151 1.00 0.00 H ATOM 95587 H2 WAT 6477 48.927 34.096 72.494 1.00 0.00 H TER 95589 WAT 6477 ATOM 95589 O WAT 6478 86.424 55.412 99.356 1.00 0.00 O ATOM 95590 H1 WAT 6478 85.616 55.370 98.844 1.00 0.00 H ATOM 95591 H2 WAT 6478 86.443 54.588 99.842 1.00 0.00 H TER 95593 WAT 6478 ATOM 95593 O WAT 6479 75.400 123.193 142.752 1.00 0.00 O ATOM 95594 H1 WAT 6479 75.578 122.253 142.731 1.00 0.00 H ATOM 95595 H2 WAT 6479 75.639 123.501 141.878 1.00 0.00 H TER 95597 WAT 6479 ATOM 95597 O WAT 6480 48.637 115.628 115.830 1.00 0.00 O ATOM 95598 H1 WAT 6480 48.419 115.473 114.911 1.00 0.00 H ATOM 95599 H2 WAT 6480 47.822 115.944 116.220 1.00 0.00 H TER 95601 WAT 6480 ATOM 95601 O WAT 6481 40.800 33.902 157.421 1.00 0.00 O ATOM 95602 H1 WAT 6481 40.200 34.451 156.916 1.00 0.00 H ATOM 95603 H2 WAT 6481 40.286 33.619 158.177 1.00 0.00 H TER 95605 WAT 6481 ATOM 95605 O WAT 6482 133.591 37.717 70.217 1.00 0.00 O ATOM 95606 H1 WAT 6482 134.037 38.386 70.737 1.00 0.00 H ATOM 95607 H2 WAT 6482 133.391 38.153 69.388 1.00 0.00 H TER 95609 WAT 6482 ATOM 95609 O WAT 6483 133.544 27.147 59.719 1.00 0.00 O ATOM 95610 H1 WAT 6483 133.380 26.207 59.645 1.00 0.00 H ATOM 95611 H2 WAT 6483 133.123 27.401 60.540 1.00 0.00 H TER 95613 WAT 6483 ATOM 95613 O WAT 6484 38.501 39.455 60.576 1.00 0.00 O ATOM 95614 H1 WAT 6484 39.252 39.205 60.038 1.00 0.00 H ATOM 95615 H2 WAT 6484 38.337 38.691 61.129 1.00 0.00 H TER 95617 WAT 6484 ATOM 95617 O WAT 6485 107.534 118.831 69.542 1.00 0.00 O ATOM 95618 H1 WAT 6485 106.710 118.538 69.930 1.00 0.00 H ATOM 95619 H2 WAT 6485 108.196 118.628 70.203 1.00 0.00 H TER 95621 WAT 6485 ATOM 95621 O WAT 6486 70.802 23.508 66.690 1.00 0.00 O ATOM 95622 H1 WAT 6486 70.719 22.567 66.536 1.00 0.00 H ATOM 95623 H2 WAT 6486 71.659 23.608 67.103 1.00 0.00 H TER 95625 WAT 6486 ATOM 95625 O WAT 6487 40.114 28.321 108.693 1.00 0.00 O ATOM 95626 H1 WAT 6487 40.025 27.429 108.358 1.00 0.00 H ATOM 95627 H2 WAT 6487 39.228 28.682 108.654 1.00 0.00 H TER 95629 WAT 6487 ATOM 95629 O WAT 6488 30.257 93.910 17.467 1.00 0.00 O ATOM 95630 H1 WAT 6488 30.815 94.593 17.097 1.00 0.00 H ATOM 95631 H2 WAT 6488 30.866 93.315 17.905 1.00 0.00 H TER 95633 WAT 6488 ATOM 95633 O WAT 6489 77.905 9.193 11.259 1.00 0.00 O ATOM 95634 H1 WAT 6489 77.443 8.404 11.544 1.00 0.00 H ATOM 95635 H2 WAT 6489 77.632 9.868 11.880 1.00 0.00 H TER 95637 WAT 6489 ATOM 95637 O WAT 6490 51.325 92.716 142.490 1.00 0.00 O ATOM 95638 H1 WAT 6490 50.614 92.524 143.102 1.00 0.00 H ATOM 95639 H2 WAT 6490 51.480 93.655 142.591 1.00 0.00 H TER 95641 WAT 6490 ATOM 95641 O WAT 6491 61.968 56.673 71.188 1.00 0.00 O ATOM 95642 H1 WAT 6491 62.587 57.380 71.004 1.00 0.00 H ATOM 95643 H2 WAT 6491 62.459 56.062 71.738 1.00 0.00 H TER 95645 WAT 6491 ATOM 95645 O WAT 6492 107.885 61.033 63.608 1.00 0.00 O ATOM 95646 H1 WAT 6492 107.523 60.279 63.142 1.00 0.00 H ATOM 95647 H2 WAT 6492 108.332 61.540 62.930 1.00 0.00 H TER 95649 WAT 6492 ATOM 95649 O WAT 6493 14.156 12.436 72.031 1.00 0.00 O ATOM 95650 H1 WAT 6493 13.231 12.197 71.969 1.00 0.00 H ATOM 95651 H2 WAT 6493 14.472 12.409 71.128 1.00 0.00 H TER 95653 WAT 6493 ATOM 95653 O WAT 6494 118.908 142.505 120.919 1.00 0.00 O ATOM 95654 H1 WAT 6494 119.681 142.644 121.465 1.00 0.00 H ATOM 95655 H2 WAT 6494 118.864 143.282 120.362 1.00 0.00 H TER 95657 WAT 6494 ATOM 95657 O WAT 6495 60.640 52.912 98.294 1.00 0.00 O ATOM 95658 H1 WAT 6495 60.636 52.233 97.619 1.00 0.00 H ATOM 95659 H2 WAT 6495 60.756 53.730 97.810 1.00 0.00 H TER 95661 WAT 6495 ATOM 95661 O WAT 6496 90.469 105.311 62.916 1.00 0.00 O ATOM 95662 H1 WAT 6496 91.350 105.646 63.084 1.00 0.00 H ATOM 95663 H2 WAT 6496 90.336 105.447 61.978 1.00 0.00 H TER 95665 WAT 6496 ATOM 95665 O WAT 6497 123.180 53.389 109.118 1.00 0.00 O ATOM 95666 H1 WAT 6497 122.349 52.967 109.335 1.00 0.00 H ATOM 95667 H2 WAT 6497 123.843 52.845 109.543 1.00 0.00 H TER 95669 WAT 6497 ATOM 95669 O WAT 6498 83.762 140.794 127.149 1.00 0.00 O ATOM 95670 H1 WAT 6498 83.450 140.466 126.306 1.00 0.00 H ATOM 95671 H2 WAT 6498 83.045 140.611 127.757 1.00 0.00 H TER 95673 WAT 6498 ATOM 95673 O WAT 6499 44.955 103.713 139.513 1.00 0.00 O ATOM 95674 H1 WAT 6499 45.141 102.915 140.007 1.00 0.00 H ATOM 95675 H2 WAT 6499 45.767 103.897 139.040 1.00 0.00 H TER 95677 WAT 6499 ATOM 95677 O WAT 6500 4.213 129.736 23.498 1.00 0.00 O ATOM 95678 H1 WAT 6500 4.000 130.609 23.169 1.00 0.00 H ATOM 95679 H2 WAT 6500 4.088 129.159 22.745 1.00 0.00 H TER 95681 WAT 6500 ATOM 95681 O WAT 6501 100.578 0.448 90.017 1.00 0.00 O ATOM 95682 H1 WAT 6501 99.731 0.847 90.215 1.00 0.00 H ATOM 95683 H2 WAT 6501 100.511 -0.442 90.364 1.00 0.00 H TER 95685 WAT 6501 ATOM 95685 O WAT 6502 109.853 88.449 90.663 1.00 0.00 O ATOM 95686 H1 WAT 6502 109.551 89.042 91.351 1.00 0.00 H ATOM 95687 H2 WAT 6502 109.160 88.474 90.003 1.00 0.00 H TER 95689 WAT 6502 ATOM 95689 O WAT 6503 68.820 130.378 109.285 1.00 0.00 O ATOM 95690 H1 WAT 6503 69.244 130.614 110.110 1.00 0.00 H ATOM 95691 H2 WAT 6503 68.870 129.423 109.255 1.00 0.00 H TER 95693 WAT 6503 ATOM 95693 O WAT 6504 44.936 137.703 149.209 1.00 0.00 O ATOM 95694 H1 WAT 6504 44.824 138.653 149.206 1.00 0.00 H ATOM 95695 H2 WAT 6504 44.886 137.453 148.286 1.00 0.00 H TER 95697 WAT 6504 ATOM 95697 O WAT 6505 22.187 117.065 69.858 1.00 0.00 O ATOM 95698 H1 WAT 6505 22.565 116.309 69.409 1.00 0.00 H ATOM 95699 H2 WAT 6505 21.261 116.843 69.960 1.00 0.00 H TER 95701 WAT 6505 ATOM 95701 O WAT 6506 92.846 68.624 132.767 1.00 0.00 O ATOM 95702 H1 WAT 6506 93.069 68.570 131.838 1.00 0.00 H ATOM 95703 H2 WAT 6506 92.496 67.759 132.980 1.00 0.00 H TER 95705 WAT 6506 ATOM 95705 O WAT 6507 42.527 30.597 124.165 1.00 0.00 O ATOM 95706 H1 WAT 6507 42.166 29.730 123.984 1.00 0.00 H ATOM 95707 H2 WAT 6507 43.072 30.794 123.404 1.00 0.00 H TER 95709 WAT 6507 ATOM 95709 O WAT 6508 94.311 104.718 57.894 1.00 0.00 O ATOM 95710 H1 WAT 6508 95.173 105.064 58.126 1.00 0.00 H ATOM 95711 H2 WAT 6508 93.762 104.917 58.653 1.00 0.00 H TER 95713 WAT 6508 ATOM 95713 O WAT 6509 114.521 31.868 61.638 1.00 0.00 O ATOM 95714 H1 WAT 6509 115.182 32.350 62.135 1.00 0.00 H ATOM 95715 H2 WAT 6509 114.171 32.509 61.020 1.00 0.00 H TER 95717 WAT 6509 ATOM 95717 O WAT 6510 87.013 134.967 125.100 1.00 0.00 O ATOM 95718 H1 WAT 6510 87.142 134.105 124.703 1.00 0.00 H ATOM 95719 H2 WAT 6510 86.921 134.788 126.036 1.00 0.00 H TER 95721 WAT 6510 ATOM 95721 O WAT 6511 23.186 53.648 56.494 1.00 0.00 O ATOM 95722 H1 WAT 6511 22.547 53.534 55.791 1.00 0.00 H ATOM 95723 H2 WAT 6511 23.993 53.265 56.150 1.00 0.00 H TER 95725 WAT 6511 ATOM 95725 O WAT 6512 51.966 47.840 133.599 1.00 0.00 O ATOM 95726 H1 WAT 6512 51.935 48.738 133.270 1.00 0.00 H ATOM 95727 H2 WAT 6512 52.219 47.315 132.840 1.00 0.00 H TER 95729 WAT 6512 ATOM 95729 O WAT 6513 143.727 134.879 158.622 1.00 0.00 O ATOM 95730 H1 WAT 6513 143.012 134.756 159.246 1.00 0.00 H ATOM 95731 H2 WAT 6513 143.487 135.667 158.134 1.00 0.00 H TER 95733 WAT 6513 ATOM 95733 O WAT 6514 41.358 90.110 119.373 1.00 0.00 O ATOM 95734 H1 WAT 6514 42.311 90.119 119.464 1.00 0.00 H ATOM 95735 H2 WAT 6514 41.069 90.917 119.799 1.00 0.00 H TER 95737 WAT 6514 ATOM 95737 O WAT 6515 145.443 103.399 110.708 1.00 0.00 O ATOM 95738 H1 WAT 6515 146.201 103.072 111.192 1.00 0.00 H ATOM 95739 H2 WAT 6515 144.688 103.019 111.158 1.00 0.00 H TER 95741 WAT 6515 ATOM 95741 O WAT 6516 95.206 117.768 133.772 1.00 0.00 O ATOM 95742 H1 WAT 6516 96.150 117.693 133.915 1.00 0.00 H ATOM 95743 H2 WAT 6516 95.065 118.697 133.587 1.00 0.00 H TER 95745 WAT 6516 ATOM 95745 O WAT 6517 138.990 20.886 66.925 1.00 0.00 O ATOM 95746 H1 WAT 6517 139.554 21.579 67.266 1.00 0.00 H ATOM 95747 H2 WAT 6517 139.390 20.640 66.091 1.00 0.00 H TER 95749 WAT 6517 ATOM 95749 O WAT 6518 44.335 35.392 124.451 1.00 0.00 O ATOM 95750 H1 WAT 6518 43.818 35.595 123.671 1.00 0.00 H ATOM 95751 H2 WAT 6518 43.827 35.755 125.176 1.00 0.00 H TER 95753 WAT 6518 ATOM 95753 O WAT 6519 115.931 33.118 119.816 1.00 0.00 O ATOM 95754 H1 WAT 6519 114.996 33.250 119.659 1.00 0.00 H ATOM 95755 H2 WAT 6519 116.061 32.175 119.711 1.00 0.00 H TER 95757 WAT 6519 ATOM 95757 O WAT 6520 79.021 89.602 98.215 1.00 0.00 O ATOM 95758 H1 WAT 6520 79.880 89.180 98.201 1.00 0.00 H ATOM 95759 H2 WAT 6520 78.572 89.258 97.443 1.00 0.00 H TER 95761 WAT 6520 ATOM 95761 O WAT 6521 62.314 135.274 62.225 1.00 0.00 O ATOM 95762 H1 WAT 6521 61.497 135.601 61.849 1.00 0.00 H ATOM 95763 H2 WAT 6521 62.037 134.635 62.881 1.00 0.00 H TER 95765 WAT 6521 ATOM 95765 O WAT 6522 42.140 108.110 89.497 1.00 0.00 O ATOM 95766 H1 WAT 6522 41.573 107.505 89.975 1.00 0.00 H ATOM 95767 H2 WAT 6522 42.425 107.615 88.729 1.00 0.00 H TER 95769 WAT 6522 ATOM 95769 O WAT 6523 92.227 3.903 5.672 1.00 0.00 O ATOM 95770 H1 WAT 6523 91.760 3.502 4.939 1.00 0.00 H ATOM 95771 H2 WAT 6523 93.044 4.223 5.288 1.00 0.00 H TER 95773 WAT 6523 ATOM 95773 O WAT 6524 3.074 27.813 96.059 1.00 0.00 O ATOM 95774 H1 WAT 6524 2.279 28.322 96.218 1.00 0.00 H ATOM 95775 H2 WAT 6524 3.166 27.804 95.106 1.00 0.00 H TER 95777 WAT 6524 ATOM 95777 O WAT 6525 31.907 88.514 111.607 1.00 0.00 O ATOM 95778 H1 WAT 6525 32.853 88.375 111.635 1.00 0.00 H ATOM 95779 H2 WAT 6525 31.533 87.661 111.828 1.00 0.00 H TER 95781 WAT 6525 ATOM 95781 O WAT 6526 51.151 1.774 72.179 1.00 0.00 O ATOM 95782 H1 WAT 6526 50.502 1.203 72.590 1.00 0.00 H ATOM 95783 H2 WAT 6526 51.827 1.177 71.859 1.00 0.00 H TER 95785 WAT 6526 ATOM 95785 O WAT 6527 144.688 32.490 146.374 1.00 0.00 O ATOM 95786 H1 WAT 6527 145.534 32.908 146.538 1.00 0.00 H ATOM 95787 H2 WAT 6527 144.469 32.059 147.200 1.00 0.00 H TER 95789 WAT 6527 ATOM 95789 O WAT 6528 77.656 104.635 144.063 1.00 0.00 O ATOM 95790 H1 WAT 6528 77.463 105.560 144.218 1.00 0.00 H ATOM 95791 H2 WAT 6528 78.144 104.628 143.240 1.00 0.00 H TER 95793 WAT 6528 ATOM 95793 O WAT 6529 98.180 122.459 126.035 1.00 0.00 O ATOM 95794 H1 WAT 6529 98.109 123.086 126.755 1.00 0.00 H ATOM 95795 H2 WAT 6529 98.756 122.886 125.401 1.00 0.00 H TER 95797 WAT 6529 ATOM 95797 O WAT 6530 66.292 11.133 107.630 1.00 0.00 O ATOM 95798 H1 WAT 6530 65.808 10.633 108.287 1.00 0.00 H ATOM 95799 H2 WAT 6530 65.614 11.564 107.110 1.00 0.00 H TER 95801 WAT 6530 ATOM 95801 O WAT 6531 110.488 87.806 130.738 1.00 0.00 O ATOM 95802 H1 WAT 6531 110.528 88.187 131.615 1.00 0.00 H ATOM 95803 H2 WAT 6531 110.299 86.880 130.887 1.00 0.00 H TER 95805 WAT 6531 ATOM 95805 O WAT 6532 59.884 28.631 3.894 1.00 0.00 O ATOM 95806 H1 WAT 6532 60.824 28.813 3.881 1.00 0.00 H ATOM 95807 H2 WAT 6532 59.692 28.431 4.810 1.00 0.00 H TER 95809 WAT 6532 ATOM 95809 O WAT 6533 88.871 2.436 92.018 1.00 0.00 O ATOM 95810 H1 WAT 6533 88.747 3.359 92.240 1.00 0.00 H ATOM 95811 H2 WAT 6533 89.787 2.259 92.232 1.00 0.00 H TER 95813 WAT 6533 ATOM 95813 O WAT 6534 48.762 27.496 75.984 1.00 0.00 O ATOM 95814 H1 WAT 6534 49.061 27.913 75.177 1.00 0.00 H ATOM 95815 H2 WAT 6534 47.814 27.626 75.984 1.00 0.00 H TER 95817 WAT 6534 ATOM 95817 O WAT 6535 20.871 109.465 135.240 1.00 0.00 O ATOM 95818 H1 WAT 6535 21.075 109.659 136.155 1.00 0.00 H ATOM 95819 H2 WAT 6535 21.268 110.184 134.749 1.00 0.00 H TER 95821 WAT 6535 ATOM 95821 O WAT 6536 99.145 132.018 141.311 1.00 0.00 O ATOM 95822 H1 WAT 6536 99.869 131.500 141.662 1.00 0.00 H ATOM 95823 H2 WAT 6536 98.951 131.617 140.464 1.00 0.00 H TER 95825 WAT 6536 ATOM 95825 O WAT 6537 139.529 106.540 84.046 1.00 0.00 O ATOM 95826 H1 WAT 6537 138.989 105.779 83.833 1.00 0.00 H ATOM 95827 H2 WAT 6537 140.298 106.454 83.482 1.00 0.00 H TER 95829 WAT 6537 ATOM 95829 O WAT 6538 140.476 20.100 121.917 1.00 0.00 O ATOM 95830 H1 WAT 6538 140.117 19.296 122.292 1.00 0.00 H ATOM 95831 H2 WAT 6538 141.300 19.830 121.513 1.00 0.00 H TER 95833 WAT 6538 ATOM 95833 O WAT 6539 120.766 144.445 102.815 1.00 0.00 O ATOM 95834 H1 WAT 6539 120.623 145.391 102.787 1.00 0.00 H ATOM 95835 H2 WAT 6539 120.528 144.193 103.707 1.00 0.00 H TER 95837 WAT 6539 ATOM 95837 O WAT 6540 31.106 123.980 81.306 1.00 0.00 O ATOM 95838 H1 WAT 6540 30.596 124.539 80.720 1.00 0.00 H ATOM 95839 H2 WAT 6540 31.108 124.449 82.141 1.00 0.00 H TER 95841 WAT 6540 ATOM 95841 O WAT 6541 14.356 55.654 139.575 1.00 0.00 O ATOM 95842 H1 WAT 6541 14.466 54.943 140.206 1.00 0.00 H ATOM 95843 H2 WAT 6541 13.547 56.090 139.845 1.00 0.00 H TER 95845 WAT 6541 ATOM 95845 O WAT 6542 8.088 28.975 6.510 1.00 0.00 O ATOM 95846 H1 WAT 6542 7.681 28.313 5.952 1.00 0.00 H ATOM 95847 H2 WAT 6542 8.528 29.566 5.900 1.00 0.00 H TER 95849 WAT 6542 ATOM 95849 O WAT 6543 124.704 75.107 151.484 1.00 0.00 O ATOM 95850 H1 WAT 6543 125.003 74.204 151.375 1.00 0.00 H ATOM 95851 H2 WAT 6543 123.752 75.056 151.406 1.00 0.00 H TER 95853 WAT 6543 ATOM 95853 O WAT 6544 29.912 28.542 14.534 1.00 0.00 O ATOM 95854 H1 WAT 6544 30.854 28.512 14.698 1.00 0.00 H ATOM 95855 H2 WAT 6544 29.815 29.150 13.801 1.00 0.00 H TER 95857 WAT 6544 ATOM 95857 O WAT 6545 138.818 131.917 98.276 1.00 0.00 O ATOM 95858 H1 WAT 6545 139.063 131.370 99.022 1.00 0.00 H ATOM 95859 H2 WAT 6545 138.924 131.345 97.515 1.00 0.00 H TER 95861 WAT 6545 ATOM 95861 O WAT 6546 83.522 115.369 20.126 1.00 0.00 O ATOM 95862 H1 WAT 6546 82.665 115.795 20.126 1.00 0.00 H ATOM 95863 H2 WAT 6546 84.070 115.934 19.581 1.00 0.00 H TER 95865 WAT 6546 ATOM 95865 O WAT 6547 133.643 25.365 90.894 1.00 0.00 O ATOM 95866 H1 WAT 6547 133.590 26.000 91.608 1.00 0.00 H ATOM 95867 H2 WAT 6547 133.346 24.542 91.283 1.00 0.00 H TER 95869 WAT 6547 ATOM 95869 O WAT 6548 135.251 143.743 144.074 1.00 0.00 O ATOM 95870 H1 WAT 6548 136.123 144.006 144.369 1.00 0.00 H ATOM 95871 H2 WAT 6548 135.281 142.786 144.063 1.00 0.00 H TER 95873 WAT 6548 ATOM 95873 O WAT 6549 3.697 79.489 90.506 1.00 0.00 O ATOM 95874 H1 WAT 6549 4.160 79.198 91.292 1.00 0.00 H ATOM 95875 H2 WAT 6549 3.055 78.799 90.337 1.00 0.00 H TER 95877 WAT 6549 ATOM 95877 O WAT 6550 65.821 126.341 130.627 1.00 0.00 O ATOM 95878 H1 WAT 6550 66.020 126.154 129.710 1.00 0.00 H ATOM 95879 H2 WAT 6550 65.931 125.501 131.073 1.00 0.00 H TER 95881 WAT 6550 ATOM 95881 O WAT 6551 140.780 75.090 127.766 1.00 0.00 O ATOM 95882 H1 WAT 6551 140.145 74.755 128.398 1.00 0.00 H ATOM 95883 H2 WAT 6551 141.433 75.544 128.299 1.00 0.00 H TER 95885 WAT 6551 ATOM 95885 O WAT 6552 86.197 14.059 146.015 1.00 0.00 O ATOM 95886 H1 WAT 6552 85.961 13.268 145.530 1.00 0.00 H ATOM 95887 H2 WAT 6552 86.260 14.741 145.346 1.00 0.00 H TER 95889 WAT 6552 ATOM 95889 O WAT 6553 41.823 0.306 150.863 1.00 0.00 O ATOM 95890 H1 WAT 6553 42.301 1.006 150.418 1.00 0.00 H ATOM 95891 H2 WAT 6553 40.924 0.391 150.547 1.00 0.00 H TER 95893 WAT 6553 ATOM 95893 O WAT 6554 125.152 91.128 144.046 1.00 0.00 O ATOM 95894 H1 WAT 6554 125.122 90.810 144.949 1.00 0.00 H ATOM 95895 H2 WAT 6554 124.453 91.780 143.999 1.00 0.00 H TER 95897 WAT 6554 ATOM 95897 O WAT 6555 88.309 29.261 115.732 1.00 0.00 O ATOM 95898 H1 WAT 6555 88.221 29.404 116.674 1.00 0.00 H ATOM 95899 H2 WAT 6555 87.858 30.005 115.334 1.00 0.00 H TER 95901 WAT 6555 ATOM 95901 O WAT 6556 70.095 35.020 145.311 1.00 0.00 O ATOM 95902 H1 WAT 6556 69.729 35.891 145.158 1.00 0.00 H ATOM 95903 H2 WAT 6556 70.439 35.058 146.204 1.00 0.00 H TER 95905 WAT 6556 ATOM 95905 O WAT 6557 135.249 132.403 93.972 1.00 0.00 O ATOM 95906 H1 WAT 6557 135.055 133.131 93.381 1.00 0.00 H ATOM 95907 H2 WAT 6557 134.419 131.933 94.053 1.00 0.00 H TER 95909 WAT 6557 ATOM 95909 O WAT 6558 85.040 12.485 144.073 1.00 0.00 O ATOM 95910 H1 WAT 6558 84.341 12.107 144.607 1.00 0.00 H ATOM 95911 H2 WAT 6558 85.657 11.765 143.941 1.00 0.00 H TER 95913 WAT 6558 ATOM 95913 O WAT 6559 138.188 23.539 123.343 1.00 0.00 O ATOM 95914 H1 WAT 6559 137.726 23.592 122.506 1.00 0.00 H ATOM 95915 H2 WAT 6559 137.524 23.241 123.964 1.00 0.00 H TER 95917 WAT 6559 ATOM 95917 O WAT 6560 18.551 143.399 6.718 1.00 0.00 O ATOM 95918 H1 WAT 6560 19.384 143.831 6.528 1.00 0.00 H ATOM 95919 H2 WAT 6560 18.359 143.636 7.625 1.00 0.00 H TER 95921 WAT 6560 ATOM 95921 O WAT 6561 57.023 93.690 96.382 1.00 0.00 O ATOM 95922 H1 WAT 6561 56.726 94.019 95.533 1.00 0.00 H ATOM 95923 H2 WAT 6561 57.905 94.049 96.483 1.00 0.00 H TER 95925 WAT 6561 ATOM 95925 O WAT 6562 11.814 21.038 104.955 1.00 0.00 O ATOM 95926 H1 WAT 6562 12.761 21.112 105.074 1.00 0.00 H ATOM 95927 H2 WAT 6562 11.489 20.742 105.805 1.00 0.00 H TER 95929 WAT 6562 ATOM 95929 O WAT 6563 69.107 104.047 113.314 1.00 0.00 O ATOM 95930 H1 WAT 6563 68.832 104.549 112.547 1.00 0.00 H ATOM 95931 H2 WAT 6563 70.055 103.958 113.214 1.00 0.00 H TER 95933 WAT 6563 ATOM 95933 O WAT 6564 80.278 59.294 17.157 1.00 0.00 O ATOM 95934 H1 WAT 6564 80.743 59.026 17.950 1.00 0.00 H ATOM 95935 H2 WAT 6564 80.662 58.760 16.462 1.00 0.00 H TER 95937 WAT 6564 ATOM 95937 O WAT 6565 132.343 67.467 75.023 1.00 0.00 O ATOM 95938 H1 WAT 6565 132.934 68.219 75.002 1.00 0.00 H ATOM 95939 H2 WAT 6565 131.632 67.703 74.427 1.00 0.00 H TER 95941 WAT 6565 ATOM 95941 O WAT 6566 25.130 81.126 128.893 1.00 0.00 O ATOM 95942 H1 WAT 6566 25.681 81.854 129.180 1.00 0.00 H ATOM 95943 H2 WAT 6566 24.236 81.462 128.960 1.00 0.00 H TER 95945 WAT 6566 ATOM 95945 O WAT 6567 58.891 40.049 75.887 1.00 0.00 O ATOM 95946 H1 WAT 6567 58.671 39.172 75.574 1.00 0.00 H ATOM 95947 H2 WAT 6567 59.684 39.926 76.409 1.00 0.00 H TER 95949 WAT 6567 ATOM 95949 O WAT 6568 80.105 42.216 136.148 1.00 0.00 O ATOM 95950 H1 WAT 6568 80.707 41.480 136.254 1.00 0.00 H ATOM 95951 H2 WAT 6568 80.389 42.644 135.340 1.00 0.00 H TER 95953 WAT 6568 ATOM 95953 O WAT 6569 50.362 33.364 125.267 1.00 0.00 O ATOM 95954 H1 WAT 6569 50.907 33.210 124.495 1.00 0.00 H ATOM 95955 H2 WAT 6569 49.464 33.276 124.947 1.00 0.00 H TER 95957 WAT 6569 ATOM 95957 O WAT 6570 93.892 79.203 78.460 1.00 0.00 O ATOM 95958 H1 WAT 6570 94.123 80.028 78.885 1.00 0.00 H ATOM 95959 H2 WAT 6570 94.731 78.773 78.297 1.00 0.00 H TER 95961 WAT 6570 ATOM 95961 O WAT 6571 33.070 52.770 104.305 1.00 0.00 O ATOM 95962 H1 WAT 6571 33.315 52.556 103.405 1.00 0.00 H ATOM 95963 H2 WAT 6571 33.799 53.296 104.633 1.00 0.00 H TER 95965 WAT 6571 ATOM 95965 O WAT 6572 81.648 69.722 112.940 1.00 0.00 O ATOM 95966 H1 WAT 6572 81.384 70.529 113.383 1.00 0.00 H ATOM 95967 H2 WAT 6572 81.450 69.028 113.568 1.00 0.00 H TER 95969 WAT 6572 ATOM 95969 O WAT 6573 57.600 47.326 82.530 1.00 0.00 O ATOM 95970 H1 WAT 6573 57.171 47.476 83.372 1.00 0.00 H ATOM 95971 H2 WAT 6573 57.524 48.162 82.070 1.00 0.00 H TER 95973 WAT 6573 ATOM 95973 O WAT 6574 138.169 30.006 71.708 1.00 0.00 O ATOM 95974 H1 WAT 6574 138.258 30.168 70.769 1.00 0.00 H ATOM 95975 H2 WAT 6574 137.273 29.685 71.812 1.00 0.00 H TER 95977 WAT 6574 ATOM 95977 O WAT 6575 103.010 123.312 103.068 1.00 0.00 O ATOM 95978 H1 WAT 6575 102.563 124.146 103.215 1.00 0.00 H ATOM 95979 H2 WAT 6575 103.024 122.893 103.929 1.00 0.00 H TER 95981 WAT 6575 ATOM 95981 O WAT 6576 62.762 14.642 88.623 1.00 0.00 O ATOM 95982 H1 WAT 6576 62.246 14.057 89.178 1.00 0.00 H ATOM 95983 H2 WAT 6576 62.110 15.145 88.135 1.00 0.00 H TER 95985 WAT 6576 ATOM 95985 O WAT 6577 2.845 17.861 96.413 1.00 0.00 O ATOM 95986 H1 WAT 6577 1.914 18.038 96.276 1.00 0.00 H ATOM 95987 H2 WAT 6577 3.154 17.539 95.566 1.00 0.00 H TER 95989 WAT 6577 ATOM 95989 O WAT 6578 17.654 54.764 156.218 1.00 0.00 O ATOM 95990 H1 WAT 6578 18.520 54.455 155.954 1.00 0.00 H ATOM 95991 H2 WAT 6578 17.444 54.253 157.000 1.00 0.00 H TER 95993 WAT 6578 ATOM 95993 O WAT 6579 33.161 0.510 109.568 1.00 0.00 O ATOM 95994 H1 WAT 6579 34.073 0.492 109.860 1.00 0.00 H ATOM 95995 H2 WAT 6579 33.147 -0.050 108.792 1.00 0.00 H TER 95997 WAT 6579 ATOM 95997 O WAT 6580 3.276 139.538 127.982 1.00 0.00 O ATOM 95998 H1 WAT 6580 3.511 140.463 128.047 1.00 0.00 H ATOM 95999 H2 WAT 6580 2.896 139.448 127.108 1.00 0.00 H TER 96001 WAT 6580 ATOM 96001 O WAT 6581 136.475 57.582 83.952 1.00 0.00 O ATOM 96002 H1 WAT 6581 135.775 57.905 84.518 1.00 0.00 H ATOM 96003 H2 WAT 6581 136.089 57.570 83.076 1.00 0.00 H TER 96005 WAT 6581 ATOM 96005 O WAT 6582 19.805 -0.101 117.368 1.00 0.00 O ATOM 96006 H1 WAT 6582 19.685 0.765 116.978 1.00 0.00 H ATOM 96007 H2 WAT 6582 20.052 0.077 118.276 1.00 0.00 H TER 96009 WAT 6582 ATOM 96009 O WAT 6583 66.174 88.555 122.564 1.00 0.00 O ATOM 96010 H1 WAT 6583 66.715 89.154 123.079 1.00 0.00 H ATOM 96011 H2 WAT 6583 66.460 88.689 121.661 1.00 0.00 H TER 96013 WAT 6583 ATOM 96013 O WAT 6584 133.128 24.349 59.515 1.00 0.00 O ATOM 96014 H1 WAT 6584 132.305 23.963 59.216 1.00 0.00 H ATOM 96015 H2 WAT 6584 133.807 23.794 59.131 1.00 0.00 H TER 96017 WAT 6584 ATOM 96017 O WAT 6585 96.566 64.620 24.414 1.00 0.00 O ATOM 96018 H1 WAT 6585 97.096 63.995 23.919 1.00 0.00 H ATOM 96019 H2 WAT 6585 96.106 65.126 23.744 1.00 0.00 H TER 96021 WAT 6585 ATOM 96021 O WAT 6586 22.624 46.089 147.698 1.00 0.00 O ATOM 96022 H1 WAT 6586 22.328 46.349 146.826 1.00 0.00 H ATOM 96023 H2 WAT 6586 23.324 46.707 147.909 1.00 0.00 H TER 96025 WAT 6586 ATOM 96025 O WAT 6587 17.482 42.725 98.071 1.00 0.00 O ATOM 96026 H1 WAT 6587 18.361 42.480 97.782 1.00 0.00 H ATOM 96027 H2 WAT 6587 17.585 42.942 98.997 1.00 0.00 H TER 96029 WAT 6587 ATOM 96029 O WAT 6588 110.229 73.477 103.013 1.00 0.00 O ATOM 96030 H1 WAT 6588 110.809 73.110 102.346 1.00 0.00 H ATOM 96031 H2 WAT 6588 110.349 72.909 103.774 1.00 0.00 H TER 96033 WAT 6588 ATOM 96033 O WAT 6589 54.433 97.486 127.238 1.00 0.00 O ATOM 96034 H1 WAT 6589 54.526 96.876 126.507 1.00 0.00 H ATOM 96035 H2 WAT 6589 53.576 97.892 127.103 1.00 0.00 H TER 96037 WAT 6589 ATOM 96037 O WAT 6590 133.640 45.912 57.190 1.00 0.00 O ATOM 96038 H1 WAT 6590 133.576 45.069 57.640 1.00 0.00 H ATOM 96039 H2 WAT 6590 133.634 45.687 56.259 1.00 0.00 H TER 96041 WAT 6590 ATOM 96041 O WAT 6591 85.482 128.453 145.487 1.00 0.00 O ATOM 96042 H1 WAT 6591 84.866 127.982 146.049 1.00 0.00 H ATOM 96043 H2 WAT 6591 85.143 128.326 144.601 1.00 0.00 H TER 96045 WAT 6591 ATOM 96045 O WAT 6592 48.536 132.875 122.626 1.00 0.00 O ATOM 96046 H1 WAT 6592 48.543 133.753 122.244 1.00 0.00 H ATOM 96047 H2 WAT 6592 49.400 132.518 122.420 1.00 0.00 H TER 96049 WAT 6592 ATOM 96049 O WAT 6593 119.486 131.090 89.955 1.00 0.00 O ATOM 96050 H1 WAT 6593 119.925 131.289 89.127 1.00 0.00 H ATOM 96051 H2 WAT 6593 118.599 130.835 89.700 1.00 0.00 H TER 96053 WAT 6593 ATOM 96053 O WAT 6594 70.419 33.735 90.474 1.00 0.00 O ATOM 96054 H1 WAT 6594 70.170 34.153 89.650 1.00 0.00 H ATOM 96055 H2 WAT 6594 69.982 32.884 90.453 1.00 0.00 H TER 96057 WAT 6594 ATOM 96057 O WAT 6595 102.296 24.240 139.954 1.00 0.00 O ATOM 96058 H1 WAT 6595 102.949 24.251 139.253 1.00 0.00 H ATOM 96059 H2 WAT 6595 102.623 23.588 140.574 1.00 0.00 H TER 96061 WAT 6595 ATOM 96061 O WAT 6596 113.743 27.272 132.316 1.00 0.00 O ATOM 96062 H1 WAT 6596 113.456 27.314 131.404 1.00 0.00 H ATOM 96063 H2 WAT 6596 112.948 27.070 132.809 1.00 0.00 H TER 96065 WAT 6596 ATOM 96065 O WAT 6597 63.582 49.045 22.615 1.00 0.00 O ATOM 96066 H1 WAT 6597 63.025 48.443 23.108 1.00 0.00 H ATOM 96067 H2 WAT 6597 64.467 48.697 22.726 1.00 0.00 H TER 96069 WAT 6597 ATOM 96069 O WAT 6598 105.422 97.207 79.319 1.00 0.00 O ATOM 96070 H1 WAT 6598 105.758 96.672 80.038 1.00 0.00 H ATOM 96071 H2 WAT 6598 106.205 97.571 78.906 1.00 0.00 H TER 96073 WAT 6598 ATOM 96073 O WAT 6599 93.177 107.152 20.844 1.00 0.00 O ATOM 96074 H1 WAT 6599 93.665 107.952 20.647 1.00 0.00 H ATOM 96075 H2 WAT 6599 92.594 107.399 21.562 1.00 0.00 H TER 96077 WAT 6599 ATOM 96077 O WAT 6600 43.234 113.074 124.511 1.00 0.00 O ATOM 96078 H1 WAT 6600 43.414 113.683 123.794 1.00 0.00 H ATOM 96079 H2 WAT 6600 42.414 113.388 124.891 1.00 0.00 H TER 96081 WAT 6600 ATOM 96081 O WAT 6601 115.947 27.791 99.743 1.00 0.00 O ATOM 96082 H1 WAT 6601 116.870 27.792 99.995 1.00 0.00 H ATOM 96083 H2 WAT 6601 115.697 28.715 99.744 1.00 0.00 H TER 96085 WAT 6601 ATOM 96085 O WAT 6602 23.075 128.167 90.374 1.00 0.00 O ATOM 96086 H1 WAT 6602 23.646 128.616 90.997 1.00 0.00 H ATOM 96087 H2 WAT 6602 22.442 127.702 90.921 1.00 0.00 H TER 96089 WAT 6602 ATOM 96089 O WAT 6603 67.060 75.235 158.807 1.00 0.00 O ATOM 96090 H1 WAT 6603 66.277 75.408 158.285 1.00 0.00 H ATOM 96091 H2 WAT 6603 67.788 75.385 158.205 1.00 0.00 H TER 96093 WAT 6603 ATOM 96093 O WAT 6604 60.764 111.927 66.907 1.00 0.00 O ATOM 96094 H1 WAT 6604 61.359 112.543 67.335 1.00 0.00 H ATOM 96095 H2 WAT 6604 60.562 111.280 67.582 1.00 0.00 H TER 96097 WAT 6604 ATOM 96097 O WAT 6605 80.008 109.293 148.647 1.00 0.00 O ATOM 96098 H1 WAT 6605 80.916 109.260 148.346 1.00 0.00 H ATOM 96099 H2 WAT 6605 79.898 108.495 149.165 1.00 0.00 H TER 96101 WAT 6605 ATOM 96101 O WAT 6606 119.432 94.592 149.306 1.00 0.00 O ATOM 96102 H1 WAT 6606 119.313 94.176 150.160 1.00 0.00 H ATOM 96103 H2 WAT 6606 119.488 93.862 148.690 1.00 0.00 H TER 96105 WAT 6606 ATOM 96105 O WAT 6607 127.244 73.545 136.112 1.00 0.00 O ATOM 96106 H1 WAT 6607 127.976 74.034 135.736 1.00 0.00 H ATOM 96107 H2 WAT 6607 126.557 74.200 136.237 1.00 0.00 H TER 96109 WAT 6607 ATOM 96109 O WAT 6608 44.422 117.675 124.147 1.00 0.00 O ATOM 96110 H1 WAT 6608 45.349 117.629 123.914 1.00 0.00 H ATOM 96111 H2 WAT 6608 44.201 118.603 124.069 1.00 0.00 H TER 96113 WAT 6608 ATOM 96113 O WAT 6609 80.688 140.769 132.978 1.00 0.00 O ATOM 96114 H1 WAT 6609 80.860 140.696 133.917 1.00 0.00 H ATOM 96115 H2 WAT 6609 81.555 140.758 132.573 1.00 0.00 H TER 96117 WAT 6609 ATOM 96117 O WAT 6610 143.735 27.978 111.362 1.00 0.00 O ATOM 96118 H1 WAT 6610 144.113 27.121 111.166 1.00 0.00 H ATOM 96119 H2 WAT 6610 142.868 27.782 111.716 1.00 0.00 H TER 96121 WAT 6610 ATOM 96121 O WAT 6611 138.779 29.846 68.886 1.00 0.00 O ATOM 96122 H1 WAT 6611 139.464 29.489 68.319 1.00 0.00 H ATOM 96123 H2 WAT 6611 138.135 30.212 68.280 1.00 0.00 H TER 96125 WAT 6611 ATOM 96125 O WAT 6612 13.734 91.469 152.007 1.00 0.00 O ATOM 96126 H1 WAT 6612 13.066 90.835 151.746 1.00 0.00 H ATOM 96127 H2 WAT 6612 14.563 91.059 151.760 1.00 0.00 H TER 96129 WAT 6612 ATOM 96129 O WAT 6613 5.050 39.104 131.398 1.00 0.00 O ATOM 96130 H1 WAT 6613 4.886 38.392 130.780 1.00 0.00 H ATOM 96131 H2 WAT 6613 4.441 38.940 132.119 1.00 0.00 H TER 96133 WAT 6613 ATOM 96133 O WAT 6614 32.821 80.053 102.907 1.00 0.00 O ATOM 96134 H1 WAT 6614 33.255 79.423 103.482 1.00 0.00 H ATOM 96135 H2 WAT 6614 31.996 79.630 102.667 1.00 0.00 H TER 96137 WAT 6614 ATOM 96137 O WAT 6615 140.670 13.141 75.090 1.00 0.00 O ATOM 96138 H1 WAT 6615 140.196 13.363 74.289 1.00 0.00 H ATOM 96139 H2 WAT 6615 141.283 12.456 74.823 1.00 0.00 H TER 96141 WAT 6615 ATOM 96141 O WAT 6616 73.864 145.902 134.655 1.00 0.00 O ATOM 96142 H1 WAT 6616 73.690 145.281 133.948 1.00 0.00 H ATOM 96143 H2 WAT 6616 73.787 145.382 135.455 1.00 0.00 H TER 96145 WAT 6616 ATOM 96145 O WAT 6617 66.857 118.006 117.441 1.00 0.00 O ATOM 96146 H1 WAT 6617 66.108 118.544 117.183 1.00 0.00 H ATOM 96147 H2 WAT 6617 67.115 118.349 118.296 1.00 0.00 H TER 96149 WAT 6617 ATOM 96149 O WAT 6618 132.484 69.907 77.786 1.00 0.00 O ATOM 96150 H1 WAT 6618 131.614 69.822 77.396 1.00 0.00 H ATOM 96151 H2 WAT 6618 132.329 69.857 78.730 1.00 0.00 H TER 96153 WAT 6618 ATOM 96153 O WAT 6619 10.616 74.401 59.936 1.00 0.00 O ATOM 96154 H1 WAT 6619 9.797 73.955 59.719 1.00 0.00 H ATOM 96155 H2 WAT 6619 10.394 75.332 59.917 1.00 0.00 H TER 96157 WAT 6619 ATOM 96157 O WAT 6620 77.427 70.538 73.722 1.00 0.00 O ATOM 96158 H1 WAT 6620 76.975 70.073 74.427 1.00 0.00 H ATOM 96159 H2 WAT 6620 77.658 69.854 73.094 1.00 0.00 H TER 96161 WAT 6620 ATOM 96161 O WAT 6621 62.541 38.994 148.281 1.00 0.00 O ATOM 96162 H1 WAT 6621 61.830 38.723 148.862 1.00 0.00 H ATOM 96163 H2 WAT 6621 62.350 38.560 147.449 1.00 0.00 H TER 96165 WAT 6621 ATOM 96165 O WAT 6622 55.550 110.327 125.303 1.00 0.00 O ATOM 96166 H1 WAT 6622 55.119 110.098 124.480 1.00 0.00 H ATOM 96167 H2 WAT 6622 54.893 110.827 125.788 1.00 0.00 H TER 96169 WAT 6622 ATOM 96169 O WAT 6623 100.723 51.217 60.376 1.00 0.00 O ATOM 96170 H1 WAT 6623 100.810 51.905 61.035 1.00 0.00 H ATOM 96171 H2 WAT 6623 101.373 50.560 60.627 1.00 0.00 H TER 96173 WAT 6623 ATOM 96173 O WAT 6624 73.808 34.629 103.357 1.00 0.00 O ATOM 96174 H1 WAT 6624 74.324 34.592 102.552 1.00 0.00 H ATOM 96175 H2 WAT 6624 73.571 33.718 103.532 1.00 0.00 H TER 96177 WAT 6624 ATOM 96177 O WAT 6625 116.577 106.101 80.372 1.00 0.00 O ATOM 96178 H1 WAT 6625 116.988 105.263 80.585 1.00 0.00 H ATOM 96179 H2 WAT 6625 116.229 105.980 79.489 1.00 0.00 H TER 96181 WAT 6625 ATOM 96181 O WAT 6626 39.125 32.389 123.415 1.00 0.00 O ATOM 96182 H1 WAT 6626 39.631 32.098 122.656 1.00 0.00 H ATOM 96183 H2 WAT 6626 38.409 31.757 123.482 1.00 0.00 H TER 96185 WAT 6626 ATOM 96185 O WAT 6627 136.319 95.203 151.527 1.00 0.00 O ATOM 96186 H1 WAT 6627 135.605 94.692 151.908 1.00 0.00 H ATOM 96187 H2 WAT 6627 136.553 95.833 152.208 1.00 0.00 H TER 96189 WAT 6627 ATOM 96189 O WAT 6628 58.031 107.514 107.743 1.00 0.00 O ATOM 96190 H1 WAT 6628 57.344 107.646 107.090 1.00 0.00 H ATOM 96191 H2 WAT 6628 58.467 106.706 107.472 1.00 0.00 H TER 96193 WAT 6628 ATOM 96193 O WAT 6629 84.164 9.838 100.838 1.00 0.00 O ATOM 96194 H1 WAT 6629 84.417 9.426 100.012 1.00 0.00 H ATOM 96195 H2 WAT 6629 84.957 9.808 101.373 1.00 0.00 H TER 96197 WAT 6629 ATOM 96197 O WAT 6630 53.133 5.304 122.024 1.00 0.00 O ATOM 96198 H1 WAT 6630 53.970 5.197 122.477 1.00 0.00 H ATOM 96199 H2 WAT 6630 52.631 5.894 122.586 1.00 0.00 H TER 96201 WAT 6630 ATOM 96201 O WAT 6631 47.620 71.866 155.158 1.00 0.00 O ATOM 96202 H1 WAT 6631 47.501 71.180 155.814 1.00 0.00 H ATOM 96203 H2 WAT 6631 47.748 72.666 155.668 1.00 0.00 H TER 96205 WAT 6631 ATOM 96205 O WAT 6632 37.077 83.577 68.060 1.00 0.00 O ATOM 96206 H1 WAT 6632 37.995 83.788 68.227 1.00 0.00 H ATOM 96207 H2 WAT 6632 36.838 82.972 68.762 1.00 0.00 H TER 96209 WAT 6632 ATOM 96209 O WAT 6633 23.968 89.672 13.829 1.00 0.00 O ATOM 96210 H1 WAT 6633 23.831 89.738 14.774 1.00 0.00 H ATOM 96211 H2 WAT 6633 24.840 89.289 13.739 1.00 0.00 H TER 96213 WAT 6633 ATOM 96213 O WAT 6634 136.930 79.924 96.851 1.00 0.00 O ATOM 96214 H1 WAT 6634 136.704 79.909 95.921 1.00 0.00 H ATOM 96215 H2 WAT 6634 137.720 79.387 96.914 1.00 0.00 H TER 96217 WAT 6634 ATOM 96217 O WAT 6635 55.400 35.637 143.835 1.00 0.00 O ATOM 96218 H1 WAT 6635 55.621 36.567 143.804 1.00 0.00 H ATOM 96219 H2 WAT 6635 56.134 35.231 144.298 1.00 0.00 H TER 96221 WAT 6635 ATOM 96221 O WAT 6636 44.986 128.883 88.166 1.00 0.00 O ATOM 96222 H1 WAT 6636 44.414 128.943 88.931 1.00 0.00 H ATOM 96223 H2 WAT 6636 45.113 127.943 88.035 1.00 0.00 H TER 96225 WAT 6636 ATOM 96225 O WAT 6637 119.998 50.012 86.983 1.00 0.00 O ATOM 96226 H1 WAT 6637 119.268 49.393 86.971 1.00 0.00 H ATOM 96227 H2 WAT 6637 120.053 50.300 87.895 1.00 0.00 H TER 96229 WAT 6637 ATOM 96229 O WAT 6638 123.908 45.048 82.687 1.00 0.00 O ATOM 96230 H1 WAT 6638 124.679 45.167 83.242 1.00 0.00 H ATOM 96231 H2 WAT 6638 123.466 44.282 83.053 1.00 0.00 H TER 96233 WAT 6638 ATOM 96233 O WAT 6639 28.483 31.459 57.526 1.00 0.00 O ATOM 96234 H1 WAT 6639 27.542 31.621 57.469 1.00 0.00 H ATOM 96235 H2 WAT 6639 28.605 30.606 57.110 1.00 0.00 H TER 96237 WAT 6639 ATOM 96237 O WAT 6640 68.854 138.754 155.624 1.00 0.00 O ATOM 96238 H1 WAT 6640 68.322 139.396 156.094 1.00 0.00 H ATOM 96239 H2 WAT 6640 69.355 138.311 156.309 1.00 0.00 H TER 96241 WAT 6640 ATOM 96241 O WAT 6641 76.724 35.782 138.458 1.00 0.00 O ATOM 96242 H1 WAT 6641 76.511 36.451 139.109 1.00 0.00 H ATOM 96243 H2 WAT 6641 75.986 35.797 137.849 1.00 0.00 H TER 96245 WAT 6641 ATOM 96245 O WAT 6642 19.742 142.628 12.265 1.00 0.00 O ATOM 96246 H1 WAT 6642 20.160 141.945 12.790 1.00 0.00 H ATOM 96247 H2 WAT 6642 20.331 142.751 11.520 1.00 0.00 H TER 96249 WAT 6642 ATOM 96249 O WAT 6643 119.520 72.097 145.642 1.00 0.00 O ATOM 96250 H1 WAT 6643 120.057 72.822 145.324 1.00 0.00 H ATOM 96251 H2 WAT 6643 118.633 72.310 145.350 1.00 0.00 H TER 96253 WAT 6643 ATOM 96253 O WAT 6644 104.011 114.252 15.940 1.00 0.00 O ATOM 96254 H1 WAT 6644 103.576 115.051 16.238 1.00 0.00 H ATOM 96255 H2 WAT 6644 104.292 113.818 16.745 1.00 0.00 H TER 96257 WAT 6644 ATOM 96257 O WAT 6645 118.379 50.450 92.316 1.00 0.00 O ATOM 96258 H1 WAT 6645 117.705 49.829 92.591 1.00 0.00 H ATOM 96259 H2 WAT 6645 119.051 49.907 91.905 1.00 0.00 H TER 96261 WAT 6645 ATOM 96261 O WAT 6646 141.438 143.131 109.896 1.00 0.00 O ATOM 96262 H1 WAT 6646 140.487 143.100 109.789 1.00 0.00 H ATOM 96263 H2 WAT 6646 141.686 144.001 109.581 1.00 0.00 H TER 96265 WAT 6646 ATOM 96265 O WAT 6647 69.340 25.640 153.958 1.00 0.00 O ATOM 96266 H1 WAT 6647 68.973 24.767 153.823 1.00 0.00 H ATOM 96267 H2 WAT 6647 68.870 26.197 153.337 1.00 0.00 H TER 96269 WAT 6647 ATOM 96269 O WAT 6648 106.010 52.462 130.496 1.00 0.00 O ATOM 96270 H1 WAT 6648 106.817 51.993 130.285 1.00 0.00 H ATOM 96271 H2 WAT 6648 105.403 51.778 130.781 1.00 0.00 H TER 96273 WAT 6648 ATOM 96273 O WAT 6649 34.015 133.944 145.264 1.00 0.00 O ATOM 96274 H1 WAT 6649 34.647 133.247 145.438 1.00 0.00 H ATOM 96275 H2 WAT 6649 34.130 134.558 145.990 1.00 0.00 H TER 96277 WAT 6649 ATOM 96277 O WAT 6650 73.003 74.223 6.345 1.00 0.00 O ATOM 96278 H1 WAT 6650 72.078 74.435 6.473 1.00 0.00 H ATOM 96279 H2 WAT 6650 73.265 73.793 7.159 1.00 0.00 H TER 96281 WAT 6650 ATOM 96281 O WAT 6651 80.808 28.265 143.264 1.00 0.00 O ATOM 96282 H1 WAT 6651 80.816 27.911 142.375 1.00 0.00 H ATOM 96283 H2 WAT 6651 79.887 28.458 143.437 1.00 0.00 H TER 96285 WAT 6651 ATOM 96285 O WAT 6652 104.819 133.724 158.823 1.00 0.00 O ATOM 96286 H1 WAT 6652 104.743 133.964 157.900 1.00 0.00 H ATOM 96287 H2 WAT 6652 104.786 134.558 159.292 1.00 0.00 H TER 96289 WAT 6652 ATOM 96289 O WAT 6653 144.474 86.052 138.956 1.00 0.00 O ATOM 96290 H1 WAT 6653 143.580 85.850 138.679 1.00 0.00 H ATOM 96291 H2 WAT 6653 144.844 86.551 138.228 1.00 0.00 H TER 96293 WAT 6653 ATOM 96293 O WAT 6654 86.658 113.434 10.311 1.00 0.00 O ATOM 96294 H1 WAT 6654 86.271 114.203 10.730 1.00 0.00 H ATOM 96295 H2 WAT 6654 86.033 113.194 9.627 1.00 0.00 H TER 96297 WAT 6654 ATOM 96297 O WAT 6655 85.977 76.386 150.706 1.00 0.00 O ATOM 96298 H1 WAT 6655 85.608 76.160 151.560 1.00 0.00 H ATOM 96299 H2 WAT 6655 85.470 75.868 150.081 1.00 0.00 H TER 96301 WAT 6655 ATOM 96301 O WAT 6656 128.589 50.988 80.768 1.00 0.00 O ATOM 96302 H1 WAT 6656 128.494 51.938 80.827 1.00 0.00 H ATOM 96303 H2 WAT 6656 129.498 50.821 81.018 1.00 0.00 H TER 96305 WAT 6656 ATOM 96305 O WAT 6657 48.867 105.404 119.997 1.00 0.00 O ATOM 96306 H1 WAT 6657 49.175 104.505 120.108 1.00 0.00 H ATOM 96307 H2 WAT 6657 48.996 105.588 119.067 1.00 0.00 H TER 96309 WAT 6657 ATOM 96309 O WAT 6658 63.116 93.879 58.805 1.00 0.00 O ATOM 96310 H1 WAT 6658 62.720 94.645 59.220 1.00 0.00 H ATOM 96311 H2 WAT 6658 63.931 94.207 58.425 1.00 0.00 H TER 96313 WAT 6658 ATOM 96313 O WAT 6659 43.332 68.757 63.792 1.00 0.00 O ATOM 96314 H1 WAT 6659 43.359 69.270 62.985 1.00 0.00 H ATOM 96315 H2 WAT 6659 43.366 69.410 64.492 1.00 0.00 H TER 96317 WAT 6659 ATOM 96317 O WAT 6660 133.563 43.110 5.669 1.00 0.00 O ATOM 96318 H1 WAT 6660 134.506 43.022 5.809 1.00 0.00 H ATOM 96319 H2 WAT 6660 133.274 43.711 6.356 1.00 0.00 H TER 96321 WAT 6660 ATOM 96321 O WAT 6661 64.149 72.042 119.179 1.00 0.00 O ATOM 96322 H1 WAT 6661 63.714 71.542 119.870 1.00 0.00 H ATOM 96323 H2 WAT 6661 63.443 72.535 118.760 1.00 0.00 H TER 96325 WAT 6661 ATOM 96325 O WAT 6662 122.750 58.206 149.253 1.00 0.00 O ATOM 96326 H1 WAT 6662 123.340 58.618 149.885 1.00 0.00 H ATOM 96327 H2 WAT 6662 121.873 58.426 149.566 1.00 0.00 H TER 96329 WAT 6662 ATOM 96329 O WAT 6663 39.889 100.435 28.322 1.00 0.00 O ATOM 96330 H1 WAT 6663 39.598 101.248 28.736 1.00 0.00 H ATOM 96331 H2 WAT 6663 39.179 99.815 28.487 1.00 0.00 H TER 96333 WAT 6663 ATOM 96333 O WAT 6664 138.842 23.906 132.120 1.00 0.00 O ATOM 96334 H1 WAT 6664 138.023 23.625 131.712 1.00 0.00 H ATOM 96335 H2 WAT 6664 139.447 23.179 131.970 1.00 0.00 H TER 96337 WAT 6664 ATOM 96337 O WAT 6665 8.209 109.911 93.791 1.00 0.00 O ATOM 96338 H1 WAT 6665 8.857 109.207 93.829 1.00 0.00 H ATOM 96339 H2 WAT 6665 7.450 109.515 93.364 1.00 0.00 H TER 96341 WAT 6665 ATOM 96341 O WAT 6666 73.459 35.642 21.999 1.00 0.00 O ATOM 96342 H1 WAT 6666 72.999 35.408 21.192 1.00 0.00 H ATOM 96343 H2 WAT 6666 73.164 36.532 22.192 1.00 0.00 H TER 96345 WAT 6666 ATOM 96345 O WAT 6667 111.900 52.354 21.072 1.00 0.00 O ATOM 96346 H1 WAT 6667 111.629 52.215 20.164 1.00 0.00 H ATOM 96347 H2 WAT 6667 111.400 51.709 21.572 1.00 0.00 H TER 96349 WAT 6667 ATOM 96349 O WAT 6668 50.693 127.763 97.895 1.00 0.00 O ATOM 96350 H1 WAT 6668 50.438 127.036 97.326 1.00 0.00 H ATOM 96351 H2 WAT 6668 50.921 127.347 98.727 1.00 0.00 H TER 96353 WAT 6668 ATOM 96353 O WAT 6669 108.446 100.708 93.577 1.00 0.00 O ATOM 96354 H1 WAT 6669 109.097 101.334 93.896 1.00 0.00 H ATOM 96355 H2 WAT 6669 107.613 101.175 93.641 1.00 0.00 H TER 96357 WAT 6669 ATOM 96357 O WAT 6670 145.923 79.408 5.871 1.00 0.00 O ATOM 96358 H1 WAT 6670 145.379 79.000 6.544 1.00 0.00 H ATOM 96359 H2 WAT 6670 145.300 79.848 5.293 1.00 0.00 H TER 96361 WAT 6670 ATOM 96361 O WAT 6671 128.225 113.062 6.823 1.00 0.00 O ATOM 96362 H1 WAT 6671 128.000 113.958 7.072 1.00 0.00 H ATOM 96363 H2 WAT 6671 128.844 112.775 7.494 1.00 0.00 H TER 96365 WAT 6671 ATOM 96365 O WAT 6672 118.237 109.750 62.552 1.00 0.00 O ATOM 96366 H1 WAT 6672 119.144 109.444 62.547 1.00 0.00 H ATOM 96367 H2 WAT 6672 117.764 109.107 62.024 1.00 0.00 H TER 96369 WAT 6672 ATOM 96369 O WAT 6673 82.423 122.269 12.696 1.00 0.00 O ATOM 96370 H1 WAT 6673 81.836 122.581 12.008 1.00 0.00 H ATOM 96371 H2 WAT 6673 83.302 122.439 12.357 1.00 0.00 H TER 96373 WAT 6673 ATOM 96373 O WAT 6674 68.014 79.606 106.834 1.00 0.00 O ATOM 96374 H1 WAT 6674 67.189 79.678 107.315 1.00 0.00 H ATOM 96375 H2 WAT 6674 67.782 79.822 105.930 1.00 0.00 H TER 96377 WAT 6674 ATOM 96377 O WAT 6675 107.790 43.005 118.228 1.00 0.00 O ATOM 96378 H1 WAT 6675 107.742 42.933 117.275 1.00 0.00 H ATOM 96379 H2 WAT 6675 108.548 42.473 118.470 1.00 0.00 H TER 96381 WAT 6675 ATOM 96381 O WAT 6676 45.942 67.931 16.760 1.00 0.00 O ATOM 96382 H1 WAT 6676 45.583 67.130 16.378 1.00 0.00 H ATOM 96383 H2 WAT 6676 45.188 68.516 16.842 1.00 0.00 H TER 96385 WAT 6676 ATOM 96385 O WAT 6677 116.937 6.682 105.320 1.00 0.00 O ATOM 96386 H1 WAT 6677 116.351 6.430 106.034 1.00 0.00 H ATOM 96387 H2 WAT 6677 116.364 6.774 104.560 1.00 0.00 H TER 96389 WAT 6677 ATOM 96389 O WAT 6678 12.625 145.122 102.139 1.00 0.00 O ATOM 96390 H1 WAT 6678 11.969 144.797 101.522 1.00 0.00 H ATOM 96391 H2 WAT 6678 12.438 146.058 102.216 1.00 0.00 H TER 96393 WAT 6678 ATOM 96393 O WAT 6679 9.026 0.602 146.052 1.00 0.00 O ATOM 96394 H1 WAT 6679 9.400 0.487 146.926 1.00 0.00 H ATOM 96395 H2 WAT 6679 9.253 -0.203 145.587 1.00 0.00 H TER 96397 WAT 6679 ATOM 96397 O WAT 6680 40.524 45.975 143.471 1.00 0.00 O ATOM 96398 H1 WAT 6680 40.455 45.474 144.283 1.00 0.00 H ATOM 96399 H2 WAT 6680 39.729 46.507 143.449 1.00 0.00 H TER 96401 WAT 6680 ATOM 96401 O WAT 6681 102.242 87.758 92.925 1.00 0.00 O ATOM 96402 H1 WAT 6681 101.870 88.206 93.684 1.00 0.00 H ATOM 96403 H2 WAT 6681 101.486 87.379 92.476 1.00 0.00 H TER 96405 WAT 6681 ATOM 96405 O WAT 6682 0.538 50.765 135.443 1.00 0.00 O ATOM 96406 H1 WAT 6682 1.461 50.995 135.337 1.00 0.00 H ATOM 96407 H2 WAT 6682 0.076 51.602 135.403 1.00 0.00 H TER 96409 WAT 6682 ATOM 96409 O WAT 6683 60.358 106.669 15.193 1.00 0.00 O ATOM 96410 H1 WAT 6683 59.800 106.355 14.482 1.00 0.00 H ATOM 96411 H2 WAT 6683 60.521 107.588 14.982 1.00 0.00 H TER 96413 WAT 6683 ATOM 96413 O WAT 6684 91.170 138.750 148.531 1.00 0.00 O ATOM 96414 H1 WAT 6684 90.784 139.140 147.748 1.00 0.00 H ATOM 96415 H2 WAT 6684 90.453 138.725 149.165 1.00 0.00 H TER 96417 WAT 6684 ATOM 96417 O WAT 6685 97.957 25.281 141.012 1.00 0.00 O ATOM 96418 H1 WAT 6685 97.674 26.135 140.685 1.00 0.00 H ATOM 96419 H2 WAT 6685 98.098 24.757 140.222 1.00 0.00 H TER 96421 WAT 6685 ATOM 96421 O WAT 6686 143.108 89.916 120.130 1.00 0.00 O ATOM 96422 H1 WAT 6686 142.465 90.557 120.435 1.00 0.00 H ATOM 96423 H2 WAT 6686 143.062 89.207 120.772 1.00 0.00 H TER 96425 WAT 6686 ATOM 96425 O WAT 6687 18.395 34.761 3.902 1.00 0.00 O ATOM 96426 H1 WAT 6687 18.910 34.060 3.502 1.00 0.00 H ATOM 96427 H2 WAT 6687 17.618 34.320 4.245 1.00 0.00 H TER 96429 WAT 6687 ATOM 96429 O WAT 6688 2.041 92.612 62.301 1.00 0.00 O ATOM 96430 H1 WAT 6688 1.267 92.051 62.341 1.00 0.00 H ATOM 96431 H2 WAT 6688 1.705 93.495 62.455 1.00 0.00 H TER 96433 WAT 6688 ATOM 96433 O WAT 6689 40.510 119.985 74.670 1.00 0.00 O ATOM 96434 H1 WAT 6689 40.416 119.529 75.507 1.00 0.00 H ATOM 96435 H2 WAT 6689 40.058 119.423 74.040 1.00 0.00 H TER 96437 WAT 6689 ATOM 96437 O WAT 6690 124.536 144.010 128.919 1.00 0.00 O ATOM 96438 H1 WAT 6690 125.252 144.272 129.498 1.00 0.00 H ATOM 96439 H2 WAT 6690 124.282 144.816 128.471 1.00 0.00 H TER 96441 WAT 6690 ATOM 96441 O WAT 6691 51.807 65.296 128.085 1.00 0.00 O ATOM 96442 H1 WAT 6691 51.597 66.105 127.620 1.00 0.00 H ATOM 96443 H2 WAT 6691 51.433 65.417 128.958 1.00 0.00 H TER 96445 WAT 6691 ATOM 96445 O WAT 6692 132.593 104.438 84.046 1.00 0.00 O ATOM 96446 H1 WAT 6692 133.241 104.131 84.680 1.00 0.00 H ATOM 96447 H2 WAT 6692 131.892 104.810 84.580 1.00 0.00 H TER 96449 WAT 6692 ATOM 96449 O WAT 6693 39.552 82.351 62.361 1.00 0.00 O ATOM 96450 H1 WAT 6693 38.614 82.397 62.178 1.00 0.00 H ATOM 96451 H2 WAT 6693 39.823 81.502 62.010 1.00 0.00 H TER 96453 WAT 6693 ATOM 96453 O WAT 6694 57.494 2.883 110.265 1.00 0.00 O ATOM 96454 H1 WAT 6694 56.951 3.489 109.761 1.00 0.00 H ATOM 96455 H2 WAT 6694 58.265 2.739 109.716 1.00 0.00 H TER 96457 WAT 6694 ATOM 96457 O WAT 6695 61.070 28.526 68.528 1.00 0.00 O ATOM 96458 H1 WAT 6695 61.553 27.920 67.967 1.00 0.00 H ATOM 96459 H2 WAT 6695 61.466 28.419 69.393 1.00 0.00 H TER 96461 WAT 6695 ATOM 96461 O WAT 6696 8.483 4.865 14.936 1.00 0.00 O ATOM 96462 H1 WAT 6696 8.124 4.793 14.052 1.00 0.00 H ATOM 96463 H2 WAT 6696 9.010 4.073 15.046 1.00 0.00 H TER 96465 WAT 6696 ATOM 96465 O WAT 6697 27.155 106.387 70.175 1.00 0.00 O ATOM 96466 H1 WAT 6697 27.848 106.849 70.646 1.00 0.00 H ATOM 96467 H2 WAT 6697 27.262 105.470 70.429 1.00 0.00 H TER 96469 WAT 6697 ATOM 96469 O WAT 6698 37.749 67.629 61.135 1.00 0.00 O ATOM 96470 H1 WAT 6698 38.577 67.172 60.990 1.00 0.00 H ATOM 96471 H2 WAT 6698 37.107 66.929 61.256 1.00 0.00 H TER 96473 WAT 6698 ATOM 96473 O WAT 6699 53.088 97.371 0.087 1.00 0.00 O ATOM 96474 H1 WAT 6699 52.985 96.628 -0.507 1.00 0.00 H ATOM 96475 H2 WAT 6699 52.620 97.110 0.880 1.00 0.00 H TER 96477 WAT 6699 ATOM 96477 O WAT 6700 85.095 136.850 80.051 1.00 0.00 O ATOM 96478 H1 WAT 6700 85.882 136.701 79.525 1.00 0.00 H ATOM 96479 H2 WAT 6700 85.106 136.148 80.702 1.00 0.00 H TER 96481 WAT 6700 ATOM 96481 O WAT 6701 90.490 60.905 118.100 1.00 0.00 O ATOM 96482 H1 WAT 6701 90.045 60.682 117.283 1.00 0.00 H ATOM 96483 H2 WAT 6701 91.366 61.180 117.829 1.00 0.00 H TER 96485 WAT 6701 ATOM 96485 O WAT 6702 37.512 28.982 79.397 1.00 0.00 O ATOM 96486 H1 WAT 6702 38.390 28.728 79.116 1.00 0.00 H ATOM 96487 H2 WAT 6702 37.658 29.570 80.138 1.00 0.00 H TER 96489 WAT 6702 ATOM 96489 O WAT 6703 122.518 103.571 129.407 1.00 0.00 O ATOM 96490 H1 WAT 6703 122.066 104.340 129.753 1.00 0.00 H ATOM 96491 H2 WAT 6703 122.231 102.851 129.968 1.00 0.00 H TER 96493 WAT 6703 ATOM 96493 O WAT 6704 76.486 24.487 70.804 1.00 0.00 O ATOM 96494 H1 WAT 6704 76.341 25.113 70.094 1.00 0.00 H ATOM 96495 H2 WAT 6704 75.667 23.996 70.863 1.00 0.00 H TER 96497 WAT 6704 ATOM 96497 O WAT 6705 84.225 42.849 28.714 1.00 0.00 O ATOM 96498 H1 WAT 6705 83.602 43.025 28.009 1.00 0.00 H ATOM 96499 H2 WAT 6705 84.683 43.679 28.841 1.00 0.00 H TER 96501 WAT 6705 ATOM 96501 O WAT 6706 134.078 28.534 156.031 1.00 0.00 O ATOM 96502 H1 WAT 6706 134.884 28.617 156.540 1.00 0.00 H ATOM 96503 H2 WAT 6706 134.310 27.951 155.308 1.00 0.00 H TER 96505 WAT 6706 ATOM 96505 O WAT 6707 58.913 87.928 141.769 1.00 0.00 O ATOM 96506 H1 WAT 6707 58.561 87.454 142.522 1.00 0.00 H ATOM 96507 H2 WAT 6707 59.279 87.245 141.206 1.00 0.00 H TER 96509 WAT 6707 ATOM 96509 O WAT 6708 85.914 89.181 21.627 1.00 0.00 O ATOM 96510 H1 WAT 6708 86.237 90.024 21.946 1.00 0.00 H ATOM 96511 H2 WAT 6708 86.642 88.576 21.768 1.00 0.00 H TER 96513 WAT 6708 ATOM 96513 O WAT 6709 46.094 135.373 114.544 1.00 0.00 O ATOM 96514 H1 WAT 6709 46.027 135.657 115.455 1.00 0.00 H ATOM 96515 H2 WAT 6709 46.491 136.117 114.090 1.00 0.00 H TER 96517 WAT 6709 ATOM 96517 O WAT 6710 36.814 79.507 154.033 1.00 0.00 O ATOM 96518 H1 WAT 6710 37.361 80.118 153.539 1.00 0.00 H ATOM 96519 H2 WAT 6710 36.394 80.048 154.702 1.00 0.00 H TER 96521 WAT 6710 ATOM 96521 O WAT 6711 65.124 17.607 96.716 1.00 0.00 O ATOM 96522 H1 WAT 6711 64.882 17.892 97.597 1.00 0.00 H ATOM 96523 H2 WAT 6711 64.448 17.980 96.150 1.00 0.00 H TER 96525 WAT 6711 ATOM 96525 O WAT 6712 105.330 23.539 125.598 1.00 0.00 O ATOM 96526 H1 WAT 6712 105.111 24.411 125.269 1.00 0.00 H ATOM 96527 H2 WAT 6712 104.521 23.227 126.004 1.00 0.00 H TER 96529 WAT 6712 ATOM 96529 O WAT 6713 124.725 21.309 122.883 1.00 0.00 O ATOM 96530 H1 WAT 6713 125.345 20.981 123.534 1.00 0.00 H ATOM 96531 H2 WAT 6713 124.182 20.551 122.665 1.00 0.00 H TER 96533 WAT 6713 ATOM 96533 O WAT 6714 65.600 59.263 105.096 1.00 0.00 O ATOM 96534 H1 WAT 6714 66.404 59.684 105.400 1.00 0.00 H ATOM 96535 H2 WAT 6714 65.376 58.644 105.791 1.00 0.00 H TER 96537 WAT 6714 ATOM 96537 O WAT 6715 86.389 116.236 81.212 1.00 0.00 O ATOM 96538 H1 WAT 6715 86.562 117.089 81.611 1.00 0.00 H ATOM 96539 H2 WAT 6715 87.256 115.882 81.016 1.00 0.00 H TER 96541 WAT 6715 ATOM 96541 O WAT 6716 6.389 21.499 112.997 1.00 0.00 O ATOM 96542 H1 WAT 6716 6.341 20.653 112.551 1.00 0.00 H ATOM 96543 H2 WAT 6716 7.093 21.394 113.636 1.00 0.00 H TER 96545 WAT 6716 ATOM 96545 O WAT 6717 109.381 95.286 108.748 1.00 0.00 O ATOM 96546 H1 WAT 6717 108.490 95.115 109.053 1.00 0.00 H ATOM 96547 H2 WAT 6717 109.620 96.117 109.159 1.00 0.00 H TER 96549 WAT 6717 ATOM 96549 O WAT 6718 109.072 46.584 124.611 1.00 0.00 O ATOM 96550 H1 WAT 6718 109.764 45.950 124.797 1.00 0.00 H ATOM 96551 H2 WAT 6718 108.555 46.178 123.915 1.00 0.00 H TER 96553 WAT 6718 ATOM 96553 O WAT 6719 28.372 68.822 82.842 1.00 0.00 O ATOM 96554 H1 WAT 6719 28.937 68.313 83.423 1.00 0.00 H ATOM 96555 H2 WAT 6719 28.539 69.733 83.085 1.00 0.00 H TER 96557 WAT 6719 ATOM 96557 O WAT 6720 109.174 31.414 104.646 1.00 0.00 O ATOM 96558 H1 WAT 6720 109.852 31.156 104.022 1.00 0.00 H ATOM 96559 H2 WAT 6720 109.468 31.054 105.483 1.00 0.00 H TER 96561 WAT 6720 ATOM 96561 O WAT 6721 112.259 134.039 66.886 1.00 0.00 O ATOM 96562 H1 WAT 6721 112.466 133.689 67.753 1.00 0.00 H ATOM 96563 H2 WAT 6721 113.057 134.490 66.613 1.00 0.00 H TER 96565 WAT 6721 ATOM 96565 O WAT 6722 12.968 45.310 11.710 1.00 0.00 O ATOM 96566 H1 WAT 6722 12.868 45.013 10.805 1.00 0.00 H ATOM 96567 H2 WAT 6722 13.799 45.785 11.716 1.00 0.00 H TER 96569 WAT 6722 ATOM 96569 O WAT 6723 123.396 15.115 105.660 1.00 0.00 O ATOM 96570 H1 WAT 6723 122.890 15.126 104.848 1.00 0.00 H ATOM 96571 H2 WAT 6723 123.811 15.976 105.696 1.00 0.00 H TER 96573 WAT 6723 ATOM 96573 O WAT 6724 11.309 127.307 75.685 1.00 0.00 O ATOM 96574 H1 WAT 6724 11.325 128.255 75.812 1.00 0.00 H ATOM 96575 H2 WAT 6724 10.828 127.183 74.866 1.00 0.00 H TER 96577 WAT 6724 ATOM 96577 O WAT 6725 6.495 78.835 67.548 1.00 0.00 O ATOM 96578 H1 WAT 6725 6.376 79.159 66.655 1.00 0.00 H ATOM 96579 H2 WAT 6725 5.959 79.417 68.087 1.00 0.00 H TER 96581 WAT 6725 ATOM 96581 O WAT 6726 69.461 12.202 124.404 1.00 0.00 O ATOM 96582 H1 WAT 6726 68.722 11.754 123.992 1.00 0.00 H ATOM 96583 H2 WAT 6726 70.039 12.431 123.677 1.00 0.00 H TER 96585 WAT 6726 ATOM 96585 O WAT 6727 115.541 41.935 97.831 1.00 0.00 O ATOM 96586 H1 WAT 6727 115.701 40.994 97.900 1.00 0.00 H ATOM 96587 H2 WAT 6727 116.376 42.300 97.539 1.00 0.00 H TER 96589 WAT 6727 ATOM 96589 O WAT 6728 50.743 84.936 101.381 1.00 0.00 O ATOM 96590 H1 WAT 6728 50.791 85.057 102.329 1.00 0.00 H ATOM 96591 H2 WAT 6728 50.195 85.659 101.075 1.00 0.00 H TER 96593 WAT 6728 ATOM 96593 O WAT 6729 1.673 38.452 12.532 1.00 0.00 O ATOM 96594 H1 WAT 6729 1.349 38.019 13.322 1.00 0.00 H ATOM 96595 H2 WAT 6729 1.004 38.275 11.871 1.00 0.00 H TER 96597 WAT 6729 ATOM 96597 O WAT 6730 109.267 121.176 9.876 1.00 0.00 O ATOM 96598 H1 WAT 6730 109.945 120.727 10.382 1.00 0.00 H ATOM 96599 H2 WAT 6730 108.748 120.470 9.492 1.00 0.00 H TER 96601 WAT 6730 ATOM 96601 O WAT 6731 65.866 51.086 99.601 1.00 0.00 O ATOM 96602 H1 WAT 6731 66.300 51.360 100.409 1.00 0.00 H ATOM 96603 H2 WAT 6731 65.326 51.836 99.353 1.00 0.00 H TER 96605 WAT 6731 ATOM 96605 O WAT 6732 103.824 84.046 16.224 1.00 0.00 O ATOM 96606 H1 WAT 6732 103.835 83.277 15.654 1.00 0.00 H ATOM 96607 H2 WAT 6732 104.522 83.885 16.858 1.00 0.00 H TER 96609 WAT 6732 ATOM 96609 O WAT 6733 88.766 131.015 75.348 1.00 0.00 O ATOM 96610 H1 WAT 6733 88.397 131.368 74.539 1.00 0.00 H ATOM 96611 H2 WAT 6733 89.667 131.337 75.361 1.00 0.00 H TER 96613 WAT 6733 ATOM 96613 O WAT 6734 130.816 25.068 153.192 1.00 0.00 O ATOM 96614 H1 WAT 6734 130.116 25.699 153.022 1.00 0.00 H ATOM 96615 H2 WAT 6734 130.366 24.228 153.281 1.00 0.00 H TER 96617 WAT 6734 ATOM 96617 O WAT 6735 27.251 137.724 115.158 1.00 0.00 O ATOM 96618 H1 WAT 6735 26.808 138.568 115.070 1.00 0.00 H ATOM 96619 H2 WAT 6735 28.129 137.945 115.469 1.00 0.00 H TER 96621 WAT 6735 ATOM 96621 O WAT 6736 96.702 17.345 109.546 1.00 0.00 O ATOM 96622 H1 WAT 6736 96.531 17.535 108.624 1.00 0.00 H ATOM 96623 H2 WAT 6736 97.638 17.512 109.656 1.00 0.00 H TER 96625 WAT 6736 ATOM 96625 O WAT 6737 135.101 86.021 140.726 1.00 0.00 O ATOM 96626 H1 WAT 6737 134.928 86.325 141.617 1.00 0.00 H ATOM 96627 H2 WAT 6737 135.887 85.480 140.807 1.00 0.00 H TER 96629 WAT 6737 ATOM 96629 O WAT 6738 16.967 91.534 70.426 1.00 0.00 O ATOM 96630 H1 WAT 6738 16.065 91.217 70.385 1.00 0.00 H ATOM 96631 H2 WAT 6738 17.152 91.845 69.540 1.00 0.00 H TER 96633 WAT 6738 ATOM 96633 O WAT 6739 43.284 84.569 138.089 1.00 0.00 O ATOM 96634 H1 WAT 6739 43.257 84.577 137.133 1.00 0.00 H ATOM 96635 H2 WAT 6739 43.882 85.281 138.318 1.00 0.00 H TER 96637 WAT 6739 ATOM 96637 O WAT 6740 29.070 96.726 147.733 1.00 0.00 O ATOM 96638 H1 WAT 6740 29.975 96.757 147.422 1.00 0.00 H ATOM 96639 H2 WAT 6740 28.747 97.620 147.621 1.00 0.00 H TER 96641 WAT 6740 ATOM 96641 O WAT 6741 107.692 33.472 5.609 1.00 0.00 O ATOM 96642 H1 WAT 6741 108.575 33.269 5.301 1.00 0.00 H ATOM 96643 H2 WAT 6741 107.689 33.200 6.526 1.00 0.00 H TER 96645 WAT 6741 ATOM 96645 O WAT 6742 100.152 86.204 134.147 1.00 0.00 O ATOM 96646 H1 WAT 6742 99.331 86.673 133.998 1.00 0.00 H ATOM 96647 H2 WAT 6742 100.417 86.458 135.031 1.00 0.00 H TER 96649 WAT 6742 ATOM 96649 O WAT 6743 105.688 101.684 59.404 1.00 0.00 O ATOM 96650 H1 WAT 6743 105.312 102.024 60.216 1.00 0.00 H ATOM 96651 H2 WAT 6743 105.941 100.786 59.615 1.00 0.00 H TER 96653 WAT 6743 ATOM 96653 O WAT 6744 47.135 105.092 157.047 1.00 0.00 O ATOM 96654 H1 WAT 6744 47.118 104.890 157.982 1.00 0.00 H ATOM 96655 H2 WAT 6744 46.705 104.344 156.632 1.00 0.00 H TER 96657 WAT 6744 ATOM 96657 O WAT 6745 124.624 20.577 117.492 1.00 0.00 O ATOM 96658 H1 WAT 6745 124.019 19.840 117.574 1.00 0.00 H ATOM 96659 H2 WAT 6745 124.952 20.717 118.380 1.00 0.00 H TER 96661 WAT 6745 ATOM 96661 O WAT 6746 79.576 125.068 2.099 1.00 0.00 O ATOM 96662 H1 WAT 6746 80.465 124.754 1.938 1.00 0.00 H ATOM 96663 H2 WAT 6746 79.522 125.892 1.614 1.00 0.00 H TER 96665 WAT 6746 ATOM 96665 O WAT 6747 116.606 57.418 130.499 1.00 0.00 O ATOM 96666 H1 WAT 6747 116.572 57.462 131.454 1.00 0.00 H ATOM 96667 H2 WAT 6747 117.507 57.163 130.302 1.00 0.00 H TER 96669 WAT 6747 ATOM 96669 O WAT 6748 28.164 20.182 118.532 1.00 0.00 O ATOM 96670 H1 WAT 6748 28.324 20.805 117.824 1.00 0.00 H ATOM 96671 H2 WAT 6748 27.773 19.423 118.099 1.00 0.00 H TER 96673 WAT 6748 ATOM 96673 O WAT 6749 54.785 141.739 107.168 1.00 0.00 O ATOM 96674 H1 WAT 6749 54.923 141.282 107.997 1.00 0.00 H ATOM 96675 H2 WAT 6749 55.368 142.497 107.212 1.00 0.00 H TER 96677 WAT 6749 ATOM 96677 O WAT 6750 60.751 55.302 66.105 1.00 0.00 O ATOM 96678 H1 WAT 6750 60.582 55.806 66.902 1.00 0.00 H ATOM 96679 H2 WAT 6750 61.667 55.035 66.180 1.00 0.00 H TER 96681 WAT 6750 ATOM 96681 O WAT 6751 116.049 84.828 108.244 1.00 0.00 O ATOM 96682 H1 WAT 6751 115.538 84.386 108.923 1.00 0.00 H ATOM 96683 H2 WAT 6751 116.722 85.309 108.726 1.00 0.00 H TER 96685 WAT 6751 ATOM 96685 O WAT 6752 28.736 13.709 75.935 1.00 0.00 O ATOM 96686 H1 WAT 6752 29.361 12.996 76.071 1.00 0.00 H ATOM 96687 H2 WAT 6752 29.096 14.441 76.436 1.00 0.00 H TER 96689 WAT 6752 ATOM 96689 O WAT 6753 52.019 110.016 77.931 1.00 0.00 O ATOM 96690 H1 WAT 6753 52.119 109.390 77.213 1.00 0.00 H ATOM 96691 H2 WAT 6753 51.273 109.687 78.432 1.00 0.00 H TER 96693 WAT 6753 ATOM 96693 O WAT 6754 9.543 139.132 130.818 1.00 0.00 O ATOM 96694 H1 WAT 6754 9.235 140.023 130.652 1.00 0.00 H ATOM 96695 H2 WAT 6754 10.496 139.213 130.859 1.00 0.00 H TER 96697 WAT 6754 ATOM 96697 O WAT 6755 87.668 98.109 154.163 1.00 0.00 O ATOM 96698 H1 WAT 6755 88.090 97.431 153.636 1.00 0.00 H ATOM 96699 H2 WAT 6755 86.750 98.087 153.892 1.00 0.00 H TER 96701 WAT 6755 ATOM 96701 O WAT 6756 74.981 44.037 11.804 1.00 0.00 O ATOM 96702 H1 WAT 6756 74.728 44.631 12.511 1.00 0.00 H ATOM 96703 H2 WAT 6756 75.564 43.403 12.221 1.00 0.00 H TER 96705 WAT 6756 ATOM 96705 O WAT 6757 23.161 32.358 1.102 1.00 0.00 O ATOM 96706 H1 WAT 6757 23.369 31.633 1.691 1.00 0.00 H ATOM 96707 H2 WAT 6757 22.798 33.034 1.674 1.00 0.00 H TER 96709 WAT 6757 ATOM 96709 O WAT 6758 137.838 117.352 146.477 1.00 0.00 O ATOM 96710 H1 WAT 6758 137.333 117.373 147.290 1.00 0.00 H ATOM 96711 H2 WAT 6758 138.178 116.458 146.430 1.00 0.00 H TER 96713 WAT 6758 ATOM 96713 O WAT 6759 40.898 20.264 14.847 1.00 0.00 O ATOM 96714 H1 WAT 6759 41.150 19.499 14.329 1.00 0.00 H ATOM 96715 H2 WAT 6759 40.166 20.648 14.365 1.00 0.00 H TER 96717 WAT 6759 ATOM 96717 O WAT 6760 16.467 143.966 120.232 1.00 0.00 O ATOM 96718 H1 WAT 6760 17.084 143.234 120.221 1.00 0.00 H ATOM 96719 H2 WAT 6760 16.971 144.699 120.586 1.00 0.00 H TER 96721 WAT 6760 ATOM 96721 O WAT 6761 55.117 19.417 145.602 1.00 0.00 O ATOM 96722 H1 WAT 6761 55.387 19.069 144.752 1.00 0.00 H ATOM 96723 H2 WAT 6761 55.106 18.655 146.181 1.00 0.00 H TER 96725 WAT 6761 ATOM 96725 O WAT 6762 3.873 102.343 75.548 1.00 0.00 O ATOM 96726 H1 WAT 6762 3.614 102.367 76.469 1.00 0.00 H ATOM 96727 H2 WAT 6762 4.723 101.903 75.549 1.00 0.00 H TER 96729 WAT 6762 ATOM 96729 O WAT 6763 94.989 68.445 102.831 1.00 0.00 O ATOM 96730 H1 WAT 6763 95.177 69.362 103.029 1.00 0.00 H ATOM 96731 H2 WAT 6763 95.620 67.952 103.355 1.00 0.00 H TER 96733 WAT 6763 ATOM 96733 O WAT 6764 68.725 126.949 142.963 1.00 0.00 O ATOM 96734 H1 WAT 6764 67.779 126.886 142.828 1.00 0.00 H ATOM 96735 H2 WAT 6764 68.959 127.810 142.616 1.00 0.00 H TER 96737 WAT 6764 ATOM 96737 O WAT 6765 33.972 141.372 57.983 1.00 0.00 O ATOM 96738 H1 WAT 6765 33.640 142.198 58.335 1.00 0.00 H ATOM 96739 H2 WAT 6765 33.607 140.702 58.561 1.00 0.00 H TER 96741 WAT 6765 ATOM 96741 O WAT 6766 63.321 6.987 144.133 1.00 0.00 O ATOM 96742 H1 WAT 6766 62.974 6.581 144.928 1.00 0.00 H ATOM 96743 H2 WAT 6766 63.629 6.252 143.604 1.00 0.00 H TER 96745 WAT 6766 ATOM 96745 O WAT 6767 66.079 98.094 98.797 1.00 0.00 O ATOM 96746 H1 WAT 6767 66.850 97.567 98.588 1.00 0.00 H ATOM 96747 H2 WAT 6767 65.387 97.736 98.239 1.00 0.00 H TER 96749 WAT 6767 ATOM 96749 O WAT 6768 35.783 22.192 106.231 1.00 0.00 O ATOM 96750 H1 WAT 6768 36.680 22.381 106.509 1.00 0.00 H ATOM 96751 H2 WAT 6768 35.235 22.681 106.845 1.00 0.00 H TER 96753 WAT 6768 ATOM 96753 O WAT 6769 141.331 13.808 106.118 1.00 0.00 O ATOM 96754 H1 WAT 6769 141.829 13.019 105.902 1.00 0.00 H ATOM 96755 H2 WAT 6769 140.576 13.486 106.611 1.00 0.00 H TER 96757 WAT 6769 ATOM 96757 O WAT 6770 59.731 78.128 101.916 1.00 0.00 O ATOM 96758 H1 WAT 6770 59.421 78.701 102.617 1.00 0.00 H ATOM 96759 H2 WAT 6770 60.445 77.629 102.312 1.00 0.00 H TER 96761 WAT 6770 ATOM 96761 O WAT 6771 50.783 63.645 22.796 1.00 0.00 O ATOM 96762 H1 WAT 6771 51.286 64.458 22.745 1.00 0.00 H ATOM 96763 H2 WAT 6771 50.718 63.461 23.733 1.00 0.00 H TER 96765 WAT 6771 ATOM 96765 O WAT 6772 123.878 122.360 127.690 1.00 0.00 O ATOM 96766 H1 WAT 6772 123.952 123.256 128.018 1.00 0.00 H ATOM 96767 H2 WAT 6772 124.404 121.839 128.296 1.00 0.00 H TER 96769 WAT 6772 ATOM 96769 O WAT 6773 140.788 80.333 9.196 1.00 0.00 O ATOM 96770 H1 WAT 6773 139.850 80.338 9.005 1.00 0.00 H ATOM 96771 H2 WAT 6773 140.840 80.453 10.144 1.00 0.00 H TER 96773 WAT 6773 ATOM 96773 O WAT 6774 105.669 35.144 81.657 1.00 0.00 O ATOM 96774 H1 WAT 6774 106.514 34.725 81.492 1.00 0.00 H ATOM 96775 H2 WAT 6774 105.460 35.591 80.837 1.00 0.00 H TER 96777 WAT 6774 ATOM 96777 O WAT 6775 136.398 111.855 145.708 1.00 0.00 O ATOM 96778 H1 WAT 6775 136.416 112.382 146.507 1.00 0.00 H ATOM 96779 H2 WAT 6775 137.317 111.655 145.532 1.00 0.00 H TER 96781 WAT 6775 ATOM 96781 O WAT 6776 22.343 111.924 115.410 1.00 0.00 O ATOM 96782 H1 WAT 6776 22.730 111.051 115.351 1.00 0.00 H ATOM 96783 H2 WAT 6776 22.888 112.385 116.049 1.00 0.00 H TER 96785 WAT 6776 ATOM 96785 O WAT 6777 72.695 125.400 61.839 1.00 0.00 O ATOM 96786 H1 WAT 6777 71.980 124.826 61.566 1.00 0.00 H ATOM 96787 H2 WAT 6777 72.873 125.146 62.745 1.00 0.00 H TER 96789 WAT 6777 ATOM 96789 O WAT 6778 28.521 113.348 141.190 1.00 0.00 O ATOM 96790 H1 WAT 6778 29.147 113.856 140.675 1.00 0.00 H ATOM 96791 H2 WAT 6778 28.848 113.404 142.088 1.00 0.00 H TER 96793 WAT 6778 ATOM 96793 O WAT 6779 19.579 120.054 110.137 1.00 0.00 O ATOM 96794 H1 WAT 6779 20.004 120.742 110.648 1.00 0.00 H ATOM 96795 H2 WAT 6779 19.248 120.503 109.359 1.00 0.00 H TER 96797 WAT 6779 ATOM 96797 O WAT 6780 98.651 132.703 153.202 1.00 0.00 O ATOM 96798 H1 WAT 6780 98.874 133.047 154.067 1.00 0.00 H ATOM 96799 H2 WAT 6780 98.411 133.476 152.691 1.00 0.00 H TER 96801 WAT 6780 ATOM 96801 O WAT 6781 2.964 48.030 108.502 1.00 0.00 O ATOM 96802 H1 WAT 6781 2.377 48.106 109.254 1.00 0.00 H ATOM 96803 H2 WAT 6781 2.455 47.552 107.848 1.00 0.00 H TER 96805 WAT 6781 ATOM 96805 O WAT 6782 66.193 75.173 131.038 1.00 0.00 O ATOM 96806 H1 WAT 6782 65.627 74.566 130.562 1.00 0.00 H ATOM 96807 H2 WAT 6782 66.803 74.608 131.514 1.00 0.00 H TER 96809 WAT 6782 ATOM 96809 O WAT 6783 108.044 94.134 21.163 1.00 0.00 O ATOM 96810 H1 WAT 6783 107.576 94.750 20.599 1.00 0.00 H ATOM 96811 H2 WAT 6783 108.966 94.253 20.936 1.00 0.00 H TER 96813 WAT 6783 ATOM 96813 O WAT 6784 99.740 15.132 63.827 1.00 0.00 O ATOM 96814 H1 WAT 6784 99.643 15.766 64.538 1.00 0.00 H ATOM 96815 H2 WAT 6784 100.569 14.690 64.012 1.00 0.00 H TER 96817 WAT 6784 ATOM 96817 O WAT 6785 17.047 89.172 66.569 1.00 0.00 O ATOM 96818 H1 WAT 6785 16.622 90.029 66.602 1.00 0.00 H ATOM 96819 H2 WAT 6785 16.361 88.555 66.822 1.00 0.00 H TER 96821 WAT 6785 ATOM 96821 O WAT 6786 118.553 63.101 87.221 1.00 0.00 O ATOM 96822 H1 WAT 6786 118.583 62.333 87.791 1.00 0.00 H ATOM 96823 H2 WAT 6786 118.498 63.844 87.823 1.00 0.00 H TER 96825 WAT 6786 ATOM 96825 O WAT 6787 77.560 76.999 129.462 1.00 0.00 O ATOM 96826 H1 WAT 6787 78.013 77.080 128.623 1.00 0.00 H ATOM 96827 H2 WAT 6787 76.873 77.665 129.429 1.00 0.00 H TER 96829 WAT 6787 ATOM 96829 O WAT 6788 126.366 0.190 53.668 1.00 0.00 O ATOM 96830 H1 WAT 6788 126.298 1.001 53.165 1.00 0.00 H ATOM 96831 H2 WAT 6788 127.146 -0.243 53.320 1.00 0.00 H TER 96833 WAT 6788 ATOM 96833 O WAT 6789 5.794 41.016 129.471 1.00 0.00 O ATOM 96834 H1 WAT 6789 5.301 40.607 130.182 1.00 0.00 H ATOM 96835 H2 WAT 6789 5.315 41.823 129.281 1.00 0.00 H TER 96837 WAT 6789 ATOM 96837 O WAT 6790 76.166 128.515 133.922 1.00 0.00 O ATOM 96838 H1 WAT 6790 75.958 129.366 134.308 1.00 0.00 H ATOM 96839 H2 WAT 6790 75.433 128.333 133.335 1.00 0.00 H TER 96841 WAT 6790 ATOM 96841 O WAT 6791 23.241 94.154 120.427 1.00 0.00 O ATOM 96842 H1 WAT 6791 23.144 93.898 119.510 1.00 0.00 H ATOM 96843 H2 WAT 6791 24.101 94.571 120.470 1.00 0.00 H TER 96845 WAT 6791 ATOM 96845 O WAT 6792 62.311 144.787 100.194 1.00 0.00 O ATOM 96846 H1 WAT 6792 61.657 144.758 100.892 1.00 0.00 H ATOM 96847 H2 WAT 6792 63.033 145.296 100.562 1.00 0.00 H TER 96849 WAT 6792 ATOM 96849 O WAT 6793 69.447 12.026 3.765 1.00 0.00 O ATOM 96850 H1 WAT 6793 69.856 12.800 3.378 1.00 0.00 H ATOM 96851 H2 WAT 6793 68.588 12.331 4.059 1.00 0.00 H TER 96853 WAT 6793 ATOM 96853 O WAT 6794 92.399 0.302 20.061 1.00 0.00 O ATOM 96854 H1 WAT 6794 92.317 1.058 19.480 1.00 0.00 H ATOM 96855 H2 WAT 6794 91.512 0.157 20.391 1.00 0.00 H TER 96857 WAT 6794 ATOM 96857 O WAT 6795 115.210 93.089 73.449 1.00 0.00 O ATOM 96858 H1 WAT 6795 114.799 93.951 73.508 1.00 0.00 H ATOM 96859 H2 WAT 6795 115.981 93.228 72.899 1.00 0.00 H TER 96861 WAT 6795 ATOM 96861 O WAT 6796 116.462 117.975 155.011 1.00 0.00 O ATOM 96862 H1 WAT 6796 117.209 118.199 154.457 1.00 0.00 H ATOM 96863 H2 WAT 6796 115.813 118.653 154.824 1.00 0.00 H TER 96865 WAT 6796 ATOM 96865 O WAT 6797 13.674 42.672 1.524 1.00 0.00 O ATOM 96866 H1 WAT 6797 14.205 43.436 1.749 1.00 0.00 H ATOM 96867 H2 WAT 6797 12.781 43.011 1.457 1.00 0.00 H TER 96869 WAT 6797 ATOM 96869 O WAT 6798 71.992 38.353 124.529 1.00 0.00 O ATOM 96870 H1 WAT 6798 71.897 37.516 124.983 1.00 0.00 H ATOM 96871 H2 WAT 6798 71.566 38.216 123.682 1.00 0.00 H TER 96873 WAT 6798 ATOM 96873 O WAT 6799 121.410 8.786 149.369 1.00 0.00 O ATOM 96874 H1 WAT 6799 120.550 8.712 149.781 1.00 0.00 H ATOM 96875 H2 WAT 6799 121.254 9.306 148.580 1.00 0.00 H TER 96877 WAT 6799 ATOM 96877 O WAT 6800 113.026 33.725 125.018 1.00 0.00 O ATOM 96878 H1 WAT 6800 113.751 33.694 125.643 1.00 0.00 H ATOM 96879 H2 WAT 6800 113.113 32.918 124.511 1.00 0.00 H TER 96881 WAT 6800 ATOM 96881 O WAT 6801 73.968 80.909 128.458 1.00 0.00 O ATOM 96882 H1 WAT 6801 73.923 81.029 127.509 1.00 0.00 H ATOM 96883 H2 WAT 6801 73.099 81.158 128.772 1.00 0.00 H TER 96885 WAT 6801 ATOM 96885 O WAT 6802 89.366 18.118 155.050 1.00 0.00 O ATOM 96886 H1 WAT 6802 88.499 17.991 154.666 1.00 0.00 H ATOM 96887 H2 WAT 6802 89.699 17.232 155.190 1.00 0.00 H TER 96889 WAT 6802 ATOM 96889 O WAT 6803 90.149 9.042 106.549 1.00 0.00 O ATOM 96890 H1 WAT 6803 90.741 8.574 107.138 1.00 0.00 H ATOM 96891 H2 WAT 6803 89.276 8.875 106.904 1.00 0.00 H TER 96893 WAT 6803 ATOM 96893 O WAT 6804 85.635 66.617 105.140 1.00 0.00 O ATOM 96894 H1 WAT 6804 85.154 67.392 105.432 1.00 0.00 H ATOM 96895 H2 WAT 6804 85.050 65.885 105.336 1.00 0.00 H TER 96897 WAT 6804 ATOM 96897 O WAT 6805 20.013 110.639 123.021 1.00 0.00 O ATOM 96898 H1 WAT 6805 20.255 110.674 122.095 1.00 0.00 H ATOM 96899 H2 WAT 6805 19.389 111.356 123.133 1.00 0.00 H TER 96901 WAT 6805 ATOM 96901 O WAT 6806 91.583 9.817 149.289 1.00 0.00 O ATOM 96902 H1 WAT 6806 90.674 9.767 149.584 1.00 0.00 H ATOM 96903 H2 WAT 6806 91.726 10.746 149.108 1.00 0.00 H TER 96905 WAT 6806 ATOM 96905 O WAT 6807 44.241 83.293 10.542 1.00 0.00 O ATOM 96906 H1 WAT 6807 44.902 83.940 10.297 1.00 0.00 H ATOM 96907 H2 WAT 6807 44.744 82.548 10.871 1.00 0.00 H TER 96909 WAT 6807 ATOM 96909 O WAT 6808 56.076 91.574 141.803 1.00 0.00 O ATOM 96910 H1 WAT 6808 56.829 91.131 141.411 1.00 0.00 H ATOM 96911 H2 WAT 6808 56.059 92.434 141.384 1.00 0.00 H TER 96913 WAT 6808 ATOM 96913 O WAT 6809 131.195 80.516 154.244 1.00 0.00 O ATOM 96914 H1 WAT 6809 132.127 80.334 154.125 1.00 0.00 H ATOM 96915 H2 WAT 6809 131.096 81.434 153.989 1.00 0.00 H TER 96917 WAT 6809 ATOM 96917 O WAT 6810 127.267 8.500 137.818 1.00 0.00 O ATOM 96918 H1 WAT 6810 126.720 8.206 138.546 1.00 0.00 H ATOM 96919 H2 WAT 6810 128.112 8.701 138.219 1.00 0.00 H TER 96921 WAT 6810 ATOM 96921 O WAT 6811 4.400 36.424 124.639 1.00 0.00 O ATOM 96922 H1 WAT 6811 5.339 36.239 124.623 1.00 0.00 H ATOM 96923 H2 WAT 6811 4.327 37.318 124.305 1.00 0.00 H TER 96925 WAT 6811 ATOM 96925 O WAT 6812 35.221 7.479 94.072 1.00 0.00 O ATOM 96926 H1 WAT 6812 36.037 7.870 93.759 1.00 0.00 H ATOM 96927 H2 WAT 6812 34.593 7.640 93.368 1.00 0.00 H TER 96929 WAT 6812 ATOM 96929 O WAT 6813 92.053 38.792 14.027 1.00 0.00 O ATOM 96930 H1 WAT 6813 91.260 38.277 13.880 1.00 0.00 H ATOM 96931 H2 WAT 6813 92.277 39.139 13.163 1.00 0.00 H TER 96933 WAT 6813 ATOM 96933 O WAT 6814 99.867 26.130 85.384 1.00 0.00 O ATOM 96934 H1 WAT 6814 100.478 26.848 85.212 1.00 0.00 H ATOM 96935 H2 WAT 6814 99.049 26.409 84.972 1.00 0.00 H TER 96937 WAT 6814 ATOM 96937 O WAT 6815 106.275 16.607 66.816 1.00 0.00 O ATOM 96938 H1 WAT 6815 105.437 16.607 66.353 1.00 0.00 H ATOM 96939 H2 WAT 6815 106.863 16.112 66.246 1.00 0.00 H TER 96941 WAT 6815 ATOM 96941 O WAT 6816 66.154 84.744 85.379 1.00 0.00 O ATOM 96942 H1 WAT 6816 67.031 85.100 85.238 1.00 0.00 H ATOM 96943 H2 WAT 6816 66.298 83.951 85.897 1.00 0.00 H TER 96945 WAT 6816 ATOM 96945 O WAT 6817 80.246 105.882 3.538 1.00 0.00 O ATOM 96946 H1 WAT 6817 79.441 105.615 3.983 1.00 0.00 H ATOM 96947 H2 WAT 6817 80.006 106.681 3.067 1.00 0.00 H TER 96949 WAT 6817 ATOM 96949 O WAT 6818 81.291 97.963 80.281 1.00 0.00 O ATOM 96950 H1 WAT 6818 80.617 97.779 80.936 1.00 0.00 H ATOM 96951 H2 WAT 6818 81.272 98.914 80.178 1.00 0.00 H TER 96953 WAT 6818 ATOM 96953 O WAT 6819 119.832 141.434 144.615 1.00 0.00 O ATOM 96954 H1 WAT 6819 119.097 140.849 144.798 1.00 0.00 H ATOM 96955 H2 WAT 6819 119.915 141.424 143.662 1.00 0.00 H TER 96957 WAT 6819 ATOM 96957 O WAT 6820 139.615 49.729 154.954 1.00 0.00 O ATOM 96958 H1 WAT 6820 138.839 50.074 154.514 1.00 0.00 H ATOM 96959 H2 WAT 6820 139.561 50.077 155.844 1.00 0.00 H TER 96961 WAT 6820 ATOM 96961 O WAT 6821 26.162 52.223 4.885 1.00 0.00 O ATOM 96962 H1 WAT 6821 25.684 51.567 5.392 1.00 0.00 H ATOM 96963 H2 WAT 6821 26.055 51.947 3.974 1.00 0.00 H TER 96965 WAT 6821 ATOM 96965 O WAT 6822 41.857 92.391 125.878 1.00 0.00 O ATOM 96966 H1 WAT 6822 40.959 92.700 125.758 1.00 0.00 H ATOM 96967 H2 WAT 6822 42.172 92.866 126.647 1.00 0.00 H TER 96969 WAT 6822 ATOM 96969 O WAT 6823 99.841 63.849 127.486 1.00 0.00 O ATOM 96970 H1 WAT 6823 100.092 64.759 127.648 1.00 0.00 H ATOM 96971 H2 WAT 6823 99.458 63.555 128.312 1.00 0.00 H TER 96973 WAT 6823 ATOM 96973 O WAT 6824 0.004 110.082 13.281 1.00 0.00 O ATOM 96974 H1 WAT 6824 -0.064 110.375 14.190 1.00 0.00 H ATOM 96975 H2 WAT 6824 0.535 110.753 12.852 1.00 0.00 H TER 96977 WAT 6824 ATOM 96977 O WAT 6825 139.733 87.724 26.293 1.00 0.00 O ATOM 96978 H1 WAT 6825 139.226 88.535 26.264 1.00 0.00 H ATOM 96979 H2 WAT 6825 140.622 88.005 26.512 1.00 0.00 H TER 96981 WAT 6825 ATOM 96981 O WAT 6826 119.856 139.423 108.713 1.00 0.00 O ATOM 96982 H1 WAT 6826 119.875 138.895 109.512 1.00 0.00 H ATOM 96983 H2 WAT 6826 119.164 139.031 108.182 1.00 0.00 H TER 96985 WAT 6826 ATOM 96985 O WAT 6827 130.187 108.352 16.517 1.00 0.00 O ATOM 96986 H1 WAT 6827 130.821 108.093 17.185 1.00 0.00 H ATOM 96987 H2 WAT 6827 129.458 107.741 16.628 1.00 0.00 H TER 96989 WAT 6827 ATOM 96989 O WAT 6828 37.309 31.708 116.734 1.00 0.00 O ATOM 96990 H1 WAT 6828 36.710 32.424 116.524 1.00 0.00 H ATOM 96991 H2 WAT 6828 38.176 32.114 116.738 1.00 0.00 H TER 96993 WAT 6828 ATOM 96993 O WAT 6829 30.964 131.734 73.020 1.00 0.00 O ATOM 96994 H1 WAT 6829 30.649 131.254 72.254 1.00 0.00 H ATOM 96995 H2 WAT 6829 30.445 131.391 73.748 1.00 0.00 H TER 96997 WAT 6829 ATOM 96997 O WAT 6830 23.871 135.451 125.197 1.00 0.00 O ATOM 96998 H1 WAT 6830 23.494 136.317 125.352 1.00 0.00 H ATOM 96999 H2 WAT 6830 23.475 135.161 124.375 1.00 0.00 H TER 97001 WAT 6830 ATOM 97001 O WAT 6831 79.740 105.783 98.151 1.00 0.00 O ATOM 97002 H1 WAT 6831 80.139 106.598 98.455 1.00 0.00 H ATOM 97003 H2 WAT 6831 78.946 106.061 97.693 1.00 0.00 H TER 97005 WAT 6831 ATOM 97005 O WAT 6832 24.667 139.085 72.925 1.00 0.00 O ATOM 97006 H1 WAT 6832 25.617 139.184 72.988 1.00 0.00 H ATOM 97007 H2 WAT 6832 24.317 139.902 73.280 1.00 0.00 H TER 97009 WAT 6832 ATOM 97009 O WAT 6833 44.267 6.068 115.799 1.00 0.00 O ATOM 97010 H1 WAT 6833 44.985 5.944 115.178 1.00 0.00 H ATOM 97011 H2 WAT 6833 43.932 6.943 115.605 1.00 0.00 H TER 97013 WAT 6833 ATOM 97013 O WAT 6834 54.333 67.506 77.063 1.00 0.00 O ATOM 97014 H1 WAT 6834 54.300 67.327 78.002 1.00 0.00 H ATOM 97015 H2 WAT 6834 53.507 67.159 76.724 1.00 0.00 H TER 97017 WAT 6834 ATOM 97017 O WAT 6835 72.319 134.835 113.333 1.00 0.00 O ATOM 97018 H1 WAT 6835 71.908 135.184 114.124 1.00 0.00 H ATOM 97019 H2 WAT 6835 71.691 135.020 112.635 1.00 0.00 H TER 97021 WAT 6835 ATOM 97021 O WAT 6836 31.290 45.862 18.842 1.00 0.00 O ATOM 97022 H1 WAT 6836 30.714 46.348 19.432 1.00 0.00 H ATOM 97023 H2 WAT 6836 30.795 45.794 18.026 1.00 0.00 H TER 97025 WAT 6836 ATOM 97025 O WAT 6837 130.973 134.442 114.663 1.00 0.00 O ATOM 97026 H1 WAT 6837 131.396 135.148 114.175 1.00 0.00 H ATOM 97027 H2 WAT 6837 130.890 134.783 115.553 1.00 0.00 H TER 97029 WAT 6837 ATOM 97029 O WAT 6838 101.364 2.211 57.998 1.00 0.00 O ATOM 97030 H1 WAT 6838 101.189 2.938 57.400 1.00 0.00 H ATOM 97031 H2 WAT 6838 102.123 1.767 57.619 1.00 0.00 H TER 97033 WAT 6838 ATOM 97033 O WAT 6839 144.536 6.194 130.421 1.00 0.00 O ATOM 97034 H1 WAT 6839 144.098 5.405 130.739 1.00 0.00 H ATOM 97035 H2 WAT 6839 144.010 6.916 130.766 1.00 0.00 H TER 97037 WAT 6839 ATOM 97037 O WAT 6840 23.883 61.560 134.253 1.00 0.00 O ATOM 97038 H1 WAT 6840 24.732 61.715 133.838 1.00 0.00 H ATOM 97039 H2 WAT 6840 23.440 60.946 133.668 1.00 0.00 H TER 97041 WAT 6840 ATOM 97041 O WAT 6841 88.952 109.318 69.215 1.00 0.00 O ATOM 97042 H1 WAT 6841 88.795 109.627 70.107 1.00 0.00 H ATOM 97043 H2 WAT 6841 89.903 109.227 69.157 1.00 0.00 H TER 97045 WAT 6841 ATOM 97045 O WAT 6842 28.505 126.668 105.708 1.00 0.00 O ATOM 97046 H1 WAT 6842 28.894 127.533 105.583 1.00 0.00 H ATOM 97047 H2 WAT 6842 28.184 126.422 104.840 1.00 0.00 H TER 97049 WAT 6842 ATOM 97049 O WAT 6843 132.290 75.151 85.983 1.00 0.00 O ATOM 97050 H1 WAT 6843 131.709 75.873 85.743 1.00 0.00 H ATOM 97051 H2 WAT 6843 131.701 74.454 86.270 1.00 0.00 H TER 97053 WAT 6843 ATOM 97053 O WAT 6844 107.350 1.098 155.762 1.00 0.00 O ATOM 97054 H1 WAT 6844 106.791 1.322 155.018 1.00 0.00 H ATOM 97055 H2 WAT 6844 106.944 0.317 156.139 1.00 0.00 H TER 97057 WAT 6844 ATOM 97057 O WAT 6845 43.606 40.084 107.506 1.00 0.00 O ATOM 97058 H1 WAT 6845 42.889 40.616 107.851 1.00 0.00 H ATOM 97059 H2 WAT 6845 43.341 39.878 106.609 1.00 0.00 H TER 97061 WAT 6845 ATOM 97061 O WAT 6846 51.003 116.490 151.030 1.00 0.00 O ATOM 97062 H1 WAT 6846 51.401 116.207 150.207 1.00 0.00 H ATOM 97063 H2 WAT 6846 50.192 115.984 151.090 1.00 0.00 H TER 97065 WAT 6846 ATOM 97065 O WAT 6847 48.979 16.871 141.817 1.00 0.00 O ATOM 97066 H1 WAT 6847 48.568 16.212 142.377 1.00 0.00 H ATOM 97067 H2 WAT 6847 49.245 17.565 142.420 1.00 0.00 H TER 97069 WAT 6847 ATOM 97069 O WAT 6848 18.848 19.892 148.864 1.00 0.00 O ATOM 97070 H1 WAT 6848 18.766 19.271 148.140 1.00 0.00 H ATOM 97071 H2 WAT 6848 19.779 20.115 148.885 1.00 0.00 H TER 97073 WAT 6848 ATOM 97073 O WAT 6849 85.996 115.008 151.058 1.00 0.00 O ATOM 97074 H1 WAT 6849 86.377 115.660 151.646 1.00 0.00 H ATOM 97075 H2 WAT 6849 85.567 115.523 150.375 1.00 0.00 H TER 97077 WAT 6849 ATOM 97077 O WAT 6850 52.794 22.381 91.030 1.00 0.00 O ATOM 97078 H1 WAT 6850 53.122 23.230 90.737 1.00 0.00 H ATOM 97079 H2 WAT 6850 53.496 21.766 90.816 1.00 0.00 H TER 97081 WAT 6850 ATOM 97081 O WAT 6851 106.133 29.655 91.605 1.00 0.00 O ATOM 97082 H1 WAT 6851 106.066 30.608 91.544 1.00 0.00 H ATOM 97083 H2 WAT 6851 105.984 29.463 92.531 1.00 0.00 H TER 97085 WAT 6851 ATOM 97085 O WAT 6852 18.765 108.908 132.056 1.00 0.00 O ATOM 97086 H1 WAT 6852 18.205 108.702 131.307 1.00 0.00 H ATOM 97087 H2 WAT 6852 18.161 108.971 132.795 1.00 0.00 H TER 97089 WAT 6852 ATOM 97089 O WAT 6853 33.528 26.923 67.238 1.00 0.00 O ATOM 97090 H1 WAT 6853 33.014 26.190 66.900 1.00 0.00 H ATOM 97091 H2 WAT 6853 34.290 26.512 67.647 1.00 0.00 H TER 97093 WAT 6853 ATOM 97093 O WAT 6854 49.503 55.820 103.431 1.00 0.00 O ATOM 97094 H1 WAT 6854 50.105 55.358 104.014 1.00 0.00 H ATOM 97095 H2 WAT 6854 50.029 56.523 103.050 1.00 0.00 H TER 97097 WAT 6854 ATOM 97097 O WAT 6855 5.748 135.363 93.773 1.00 0.00 O ATOM 97098 H1 WAT 6855 6.674 135.373 93.532 1.00 0.00 H ATOM 97099 H2 WAT 6855 5.610 136.196 94.225 1.00 0.00 H TER 97101 WAT 6855 ATOM 97101 O WAT 6856 92.119 83.366 18.945 1.00 0.00 O ATOM 97102 H1 WAT 6856 91.201 83.333 19.211 1.00 0.00 H ATOM 97103 H2 WAT 6856 92.512 82.590 19.344 1.00 0.00 H TER 97105 WAT 6856 ATOM 97105 O WAT 6857 27.240 20.687 15.185 1.00 0.00 O ATOM 97106 H1 WAT 6857 27.233 20.002 14.518 1.00 0.00 H ATOM 97107 H2 WAT 6857 27.245 20.212 16.016 1.00 0.00 H TER 97109 WAT 6857 ATOM 97109 O WAT 6858 13.964 42.657 120.158 1.00 0.00 O ATOM 97110 H1 WAT 6858 13.127 42.942 120.523 1.00 0.00 H ATOM 97111 H2 WAT 6858 14.536 43.420 120.247 1.00 0.00 H TER 97113 WAT 6858 ATOM 97113 O WAT 6859 103.387 16.607 5.558 1.00 0.00 O ATOM 97114 H1 WAT 6859 103.026 17.483 5.693 1.00 0.00 H ATOM 97115 H2 WAT 6859 104.112 16.548 6.181 1.00 0.00 H TER 97117 WAT 6859 ATOM 97117 O WAT 6860 134.266 48.209 1.425 1.00 0.00 O ATOM 97118 H1 WAT 6860 135.185 48.429 1.580 1.00 0.00 H ATOM 97119 H2 WAT 6860 133.793 48.650 2.131 1.00 0.00 H TER 97121 WAT 6860 ATOM 97121 O WAT 6861 22.638 21.495 122.236 1.00 0.00 O ATOM 97122 H1 WAT 6861 23.221 20.741 122.326 1.00 0.00 H ATOM 97123 H2 WAT 6861 21.764 21.114 122.157 1.00 0.00 H TER 97125 WAT 6861 ATOM 97125 O WAT 6862 79.230 142.125 121.883 1.00 0.00 O ATOM 97126 H1 WAT 6862 78.584 142.301 121.199 1.00 0.00 H ATOM 97127 H2 WAT 6862 78.714 141.805 122.623 1.00 0.00 H TER 97129 WAT 6862 ATOM 97129 O WAT 6863 116.785 98.204 97.774 1.00 0.00 O ATOM 97130 H1 WAT 6863 116.099 98.742 97.379 1.00 0.00 H ATOM 97131 H2 WAT 6863 117.181 98.770 98.437 1.00 0.00 H TER 97133 WAT 6863 ATOM 97133 O WAT 6864 131.980 145.281 77.540 1.00 0.00 O ATOM 97134 H1 WAT 6864 132.129 145.360 78.482 1.00 0.00 H ATOM 97135 H2 WAT 6864 132.069 146.175 77.207 1.00 0.00 H TER 97137 WAT 6864 ATOM 97137 O WAT 6865 106.151 49.410 86.145 1.00 0.00 O ATOM 97138 H1 WAT 6865 105.727 49.788 86.915 1.00 0.00 H ATOM 97139 H2 WAT 6865 106.475 48.560 86.443 1.00 0.00 H TER 97141 WAT 6865 ATOM 97141 O WAT 6866 0.989 110.978 58.962 1.00 0.00 O ATOM 97142 H1 WAT 6866 0.698 110.066 58.968 1.00 0.00 H ATOM 97143 H2 WAT 6866 0.424 111.414 59.599 1.00 0.00 H TER 97145 WAT 6866 ATOM 97145 O WAT 6867 104.589 113.581 81.075 1.00 0.00 O ATOM 97146 H1 WAT 6867 104.269 113.091 80.317 1.00 0.00 H ATOM 97147 H2 WAT 6867 103.909 114.233 81.243 1.00 0.00 H TER 97149 WAT 6867 ATOM 97149 O WAT 6868 135.721 66.455 136.406 1.00 0.00 O ATOM 97150 H1 WAT 6868 136.640 66.269 136.212 1.00 0.00 H ATOM 97151 H2 WAT 6868 135.741 67.279 136.892 1.00 0.00 H TER 97153 WAT 6868 ATOM 97153 O WAT 6869 109.784 108.217 21.683 1.00 0.00 O ATOM 97154 H1 WAT 6869 110.312 108.459 22.444 1.00 0.00 H ATOM 97155 H2 WAT 6869 110.255 108.589 20.937 1.00 0.00 H TER 97157 WAT 6869 ATOM 97157 O WAT 6870 69.099 64.967 5.684 1.00 0.00 O ATOM 97158 H1 WAT 6870 69.569 64.684 6.468 1.00 0.00 H ATOM 97159 H2 WAT 6870 68.732 64.161 5.321 1.00 0.00 H TER 97161 WAT 6870 ATOM 97161 O WAT 6871 18.792 69.199 138.672 1.00 0.00 O ATOM 97162 H1 WAT 6871 19.403 69.764 138.198 1.00 0.00 H ATOM 97163 H2 WAT 6871 18.021 69.152 138.107 1.00 0.00 H TER 97165 WAT 6871 ATOM 97165 O WAT 6872 25.345 115.875 147.067 1.00 0.00 O ATOM 97166 H1 WAT 6872 25.971 115.255 147.442 1.00 0.00 H ATOM 97167 H2 WAT 6872 24.851 115.359 146.430 1.00 0.00 H TER 97169 WAT 6872 ATOM 97169 O WAT 6873 3.498 11.188 108.059 1.00 0.00 O ATOM 97170 H1 WAT 6873 3.478 12.092 107.745 1.00 0.00 H ATOM 97171 H2 WAT 6873 3.313 11.256 108.996 1.00 0.00 H TER 97173 WAT 6873 ATOM 97173 O WAT 6874 120.129 51.376 117.220 1.00 0.00 O ATOM 97174 H1 WAT 6874 119.484 51.966 117.609 1.00 0.00 H ATOM 97175 H2 WAT 6874 120.972 51.702 117.535 1.00 0.00 H TER 97177 WAT 6874 ATOM 97177 O WAT 6875 123.129 65.134 58.725 1.00 0.00 O ATOM 97178 H1 WAT 6875 122.974 64.580 59.490 1.00 0.00 H ATOM 97179 H2 WAT 6875 122.459 64.866 58.096 1.00 0.00 H TER 97181 WAT 6875 ATOM 97181 O WAT 6876 26.474 18.244 11.226 1.00 0.00 O ATOM 97182 H1 WAT 6876 27.204 17.658 11.027 1.00 0.00 H ATOM 97183 H2 WAT 6876 25.706 17.673 11.246 1.00 0.00 H TER 97185 WAT 6876 ATOM 97185 O WAT 6877 129.192 40.638 68.497 1.00 0.00 O ATOM 97186 H1 WAT 6877 129.091 41.323 69.158 1.00 0.00 H ATOM 97187 H2 WAT 6877 129.847 40.045 68.864 1.00 0.00 H TER 97189 WAT 6877 ATOM 97189 O WAT 6878 135.552 34.676 147.494 1.00 0.00 O ATOM 97190 H1 WAT 6878 134.628 34.590 147.729 1.00 0.00 H ATOM 97191 H2 WAT 6878 135.796 35.551 147.794 1.00 0.00 H TER 97193 WAT 6878 ATOM 97193 O WAT 6879 79.246 108.250 2.262 1.00 0.00 O ATOM 97194 H1 WAT 6879 79.126 108.813 3.027 1.00 0.00 H ATOM 97195 H2 WAT 6879 78.360 108.108 1.928 1.00 0.00 H TER 97197 WAT 6879 ATOM 97197 O WAT 6880 73.508 106.571 58.112 1.00 0.00 O ATOM 97198 H1 WAT 6880 72.818 107.235 58.125 1.00 0.00 H ATOM 97199 H2 WAT 6880 74.177 106.909 58.707 1.00 0.00 H TER 97201 WAT 6880 ATOM 97201 O WAT 6881 112.555 77.437 110.870 1.00 0.00 O ATOM 97202 H1 WAT 6881 111.848 77.685 110.275 1.00 0.00 H ATOM 97203 H2 WAT 6881 113.045 78.248 111.009 1.00 0.00 H TER 97205 WAT 6881 ATOM 97205 O WAT 6882 84.560 60.303 82.979 1.00 0.00 O ATOM 97206 H1 WAT 6882 85.404 60.302 83.430 1.00 0.00 H ATOM 97207 H2 WAT 6882 84.391 61.226 82.789 1.00 0.00 H TER 97209 WAT 6882 ATOM 97209 O WAT 6883 48.702 92.040 9.774 1.00 0.00 O ATOM 97210 H1 WAT 6883 48.872 92.691 10.455 1.00 0.00 H ATOM 97211 H2 WAT 6883 49.480 92.066 9.218 1.00 0.00 H TER 97213 WAT 6883 ATOM 97213 O WAT 6884 28.365 84.426 105.574 1.00 0.00 O ATOM 97214 H1 WAT 6884 27.856 83.616 105.603 1.00 0.00 H ATOM 97215 H2 WAT 6884 28.759 84.492 106.444 1.00 0.00 H TER 97217 WAT 6884 ATOM 97217 O WAT 6885 128.351 68.200 148.361 1.00 0.00 O ATOM 97218 H1 WAT 6885 128.857 68.388 149.152 1.00 0.00 H ATOM 97219 H2 WAT 6885 128.077 69.060 148.042 1.00 0.00 H TER 97221 WAT 6885 ATOM 97221 O WAT 6886 101.121 143.640 111.635 1.00 0.00 O ATOM 97222 H1 WAT 6886 101.022 144.068 110.785 1.00 0.00 H ATOM 97223 H2 WAT 6886 101.373 142.741 111.424 1.00 0.00 H TER 97225 WAT 6886 ATOM 97225 O WAT 6887 46.890 115.202 9.988 1.00 0.00 O ATOM 97226 H1 WAT 6887 47.420 114.417 10.121 1.00 0.00 H ATOM 97227 H2 WAT 6887 46.028 114.971 10.333 1.00 0.00 H TER 97229 WAT 6887 ATOM 97229 O WAT 6888 86.461 52.821 152.158 1.00 0.00 O ATOM 97230 H1 WAT 6888 86.776 51.999 151.783 1.00 0.00 H ATOM 97231 H2 WAT 6888 86.333 52.627 153.087 1.00 0.00 H TER 97233 WAT 6888 ATOM 97233 O WAT 6889 31.705 29.233 76.415 1.00 0.00 O ATOM 97234 H1 WAT 6889 32.217 29.366 77.213 1.00 0.00 H ATOM 97235 H2 WAT 6889 31.784 28.297 76.233 1.00 0.00 H TER 97237 WAT 6889 ATOM 97237 O WAT 6890 145.347 110.520 69.626 1.00 0.00 O ATOM 97238 H1 WAT 6890 145.344 111.108 68.870 1.00 0.00 H ATOM 97239 H2 WAT 6890 144.746 109.815 69.383 1.00 0.00 H TER 97241 WAT 6890 ATOM 97241 O WAT 6891 73.497 34.892 71.675 1.00 0.00 O ATOM 97242 H1 WAT 6891 73.210 35.251 72.514 1.00 0.00 H ATOM 97243 H2 WAT 6891 74.350 35.297 71.520 1.00 0.00 H TER 97245 WAT 6891 ATOM 97245 O WAT 6892 43.619 123.450 91.361 1.00 0.00 O ATOM 97246 H1 WAT 6892 43.943 122.549 91.380 1.00 0.00 H ATOM 97247 H2 WAT 6892 44.275 123.950 91.847 1.00 0.00 H TER 97249 WAT 6892 ATOM 97249 O WAT 6893 44.949 115.597 16.833 1.00 0.00 O ATOM 97250 H1 WAT 6893 45.394 116.306 17.296 1.00 0.00 H ATOM 97251 H2 WAT 6893 45.094 115.788 15.906 1.00 0.00 H TER 97253 WAT 6893 ATOM 97253 O WAT 6894 42.194 104.886 130.540 1.00 0.00 O ATOM 97254 H1 WAT 6894 42.657 105.356 129.846 1.00 0.00 H ATOM 97255 H2 WAT 6894 42.821 104.231 130.846 1.00 0.00 H TER 97257 WAT 6894 ATOM 97257 O WAT 6895 76.441 109.763 99.694 1.00 0.00 O ATOM 97258 H1 WAT 6895 76.880 110.531 100.059 1.00 0.00 H ATOM 97259 H2 WAT 6895 76.099 110.062 98.851 1.00 0.00 H TER 97261 WAT 6895 ATOM 97261 O WAT 6896 4.256 80.513 143.945 1.00 0.00 O ATOM 97262 H1 WAT 6896 4.370 79.594 143.701 1.00 0.00 H ATOM 97263 H2 WAT 6896 5.124 80.792 144.238 1.00 0.00 H TER 97265 WAT 6896 ATOM 97265 O WAT 6897 112.377 121.513 80.678 1.00 0.00 O ATOM 97266 H1 WAT 6897 113.259 121.140 80.709 1.00 0.00 H ATOM 97267 H2 WAT 6897 112.299 121.869 79.793 1.00 0.00 H TER 97269 WAT 6897 ATOM 97269 O WAT 6898 56.109 38.534 9.377 1.00 0.00 O ATOM 97270 H1 WAT 6898 55.370 38.362 8.793 1.00 0.00 H ATOM 97271 H2 WAT 6898 56.641 39.175 8.906 1.00 0.00 H TER 97273 WAT 6898 ATOM 97273 O WAT 6899 10.722 125.090 150.347 1.00 0.00 O ATOM 97274 H1 WAT 6899 11.115 125.432 151.151 1.00 0.00 H ATOM 97275 H2 WAT 6899 10.812 124.140 150.422 1.00 0.00 H TER 97277 WAT 6899 ATOM 97277 O WAT 6900 102.114 96.426 11.278 1.00 0.00 O ATOM 97278 H1 WAT 6900 102.428 95.732 10.698 1.00 0.00 H ATOM 97279 H2 WAT 6900 101.778 95.963 12.045 1.00 0.00 H TER 97281 WAT 6900 ATOM 97281 O WAT 6901 102.037 138.823 104.568 1.00 0.00 O ATOM 97282 H1 WAT 6901 101.229 138.318 104.660 1.00 0.00 H ATOM 97283 H2 WAT 6901 101.876 139.624 105.066 1.00 0.00 H TER 97285 WAT 6901 ATOM 97285 O WAT 6902 33.888 61.123 132.020 1.00 0.00 O ATOM 97286 H1 WAT 6902 34.595 61.267 131.391 1.00 0.00 H ATOM 97287 H2 WAT 6902 33.870 61.923 132.546 1.00 0.00 H TER 97289 WAT 6902 ATOM 97289 O WAT 6903 100.378 69.654 101.674 1.00 0.00 O ATOM 97290 H1 WAT 6903 100.281 69.009 100.973 1.00 0.00 H ATOM 97291 H2 WAT 6903 101.234 69.465 102.057 1.00 0.00 H TER 97293 WAT 6903 ATOM 97293 O WAT 6904 144.721 49.970 131.569 1.00 0.00 O ATOM 97294 H1 WAT 6904 145.477 50.552 131.491 1.00 0.00 H ATOM 97295 H2 WAT 6904 143.974 50.511 131.311 1.00 0.00 H TER 97297 WAT 6904 ATOM 97297 O WAT 6905 124.568 82.182 60.683 1.00 0.00 O ATOM 97298 H1 WAT 6905 124.032 81.494 60.288 1.00 0.00 H ATOM 97299 H2 WAT 6905 124.935 81.778 61.469 1.00 0.00 H TER 97301 WAT 6905 ATOM 97301 O WAT 6906 42.379 73.609 150.775 1.00 0.00 O ATOM 97302 H1 WAT 6906 41.932 73.354 151.582 1.00 0.00 H ATOM 97303 H2 WAT 6906 43.124 73.011 150.714 1.00 0.00 H TER 97305 WAT 6906 ATOM 97305 O WAT 6907 70.356 61.257 65.068 1.00 0.00 O ATOM 97306 H1 WAT 6907 70.498 60.920 65.952 1.00 0.00 H ATOM 97307 H2 WAT 6907 70.022 62.144 65.201 1.00 0.00 H TER 97309 WAT 6907 ATOM 97309 O WAT 6908 38.153 11.280 9.508 1.00 0.00 O ATOM 97310 H1 WAT 6908 39.058 11.030 9.693 1.00 0.00 H ATOM 97311 H2 WAT 6908 37.654 10.939 10.251 1.00 0.00 H TER 97313 WAT 6908 ATOM 97313 O WAT 6909 139.257 10.265 118.019 1.00 0.00 O ATOM 97314 H1 WAT 6909 138.852 9.491 117.629 1.00 0.00 H ATOM 97315 H2 WAT 6909 139.376 10.869 117.286 1.00 0.00 H TER 97317 WAT 6909 ATOM 97317 O WAT 6910 129.106 99.771 57.996 1.00 0.00 O ATOM 97318 H1 WAT 6910 128.786 100.319 57.280 1.00 0.00 H ATOM 97319 H2 WAT 6910 128.323 99.340 58.337 1.00 0.00 H TER 97321 WAT 6910 ATOM 97321 O WAT 6911 61.505 69.024 72.398 1.00 0.00 O ATOM 97322 H1 WAT 6911 61.137 68.146 72.505 1.00 0.00 H ATOM 97323 H2 WAT 6911 61.299 69.262 71.494 1.00 0.00 H TER 97325 WAT 6911 ATOM 97325 O WAT 6912 88.561 107.376 116.240 1.00 0.00 O ATOM 97326 H1 WAT 6912 87.965 107.622 116.947 1.00 0.00 H ATOM 97327 H2 WAT 6912 89.397 107.774 116.481 1.00 0.00 H TER 97329 WAT 6912 ATOM 97329 O WAT 6913 38.284 44.655 22.524 1.00 0.00 O ATOM 97330 H1 WAT 6913 38.139 45.490 22.969 1.00 0.00 H ATOM 97331 H2 WAT 6913 37.806 44.738 21.698 1.00 0.00 H TER 97333 WAT 6913 ATOM 97333 O WAT 6914 97.524 19.508 79.279 1.00 0.00 O ATOM 97334 H1 WAT 6914 97.820 19.237 80.148 1.00 0.00 H ATOM 97335 H2 WAT 6914 98.297 19.417 78.723 1.00 0.00 H TER 97337 WAT 6914 ATOM 97337 O WAT 6915 52.440 87.911 157.602 1.00 0.00 O ATOM 97338 H1 WAT 6915 53.193 87.679 158.145 1.00 0.00 H ATOM 97339 H2 WAT 6915 52.772 88.584 157.008 1.00 0.00 H TER 97341 WAT 6915 ATOM 97341 O WAT 6916 78.440 118.814 15.378 1.00 0.00 O ATOM 97342 H1 WAT 6916 78.388 119.559 14.779 1.00 0.00 H ATOM 97343 H2 WAT 6916 79.364 118.564 15.368 1.00 0.00 H TER 97345 WAT 6916 ATOM 97345 O WAT 6917 50.743 55.334 97.014 1.00 0.00 O ATOM 97346 H1 WAT 6917 51.025 55.256 97.925 1.00 0.00 H ATOM 97347 H2 WAT 6917 50.505 54.443 96.759 1.00 0.00 H TER 97349 WAT 6917 ATOM 97349 O WAT 6918 37.662 46.779 152.049 1.00 0.00 O ATOM 97350 H1 WAT 6918 37.283 47.383 151.411 1.00 0.00 H ATOM 97351 H2 WAT 6918 38.573 47.062 152.135 1.00 0.00 H TER 97353 WAT 6918 ATOM 97353 O WAT 6919 76.206 91.391 2.450 1.00 0.00 O ATOM 97354 H1 WAT 6919 76.246 92.170 1.896 1.00 0.00 H ATOM 97355 H2 WAT 6919 75.297 91.096 2.384 1.00 0.00 H TER 97357 WAT 6919 ATOM 97357 O WAT 6920 145.391 110.642 96.909 1.00 0.00 O ATOM 97358 H1 WAT 6920 144.972 111.492 97.045 1.00 0.00 H ATOM 97359 H2 WAT 6920 145.935 110.765 96.131 1.00 0.00 H TER 97361 WAT 6920 ATOM 97361 O WAT 6921 67.053 74.353 4.443 1.00 0.00 O ATOM 97362 H1 WAT 6921 66.607 75.055 4.917 1.00 0.00 H ATOM 97363 H2 WAT 6921 67.485 73.840 5.125 1.00 0.00 H TER 97365 WAT 6921 ATOM 97365 O WAT 6922 61.975 83.457 147.937 1.00 0.00 O ATOM 97366 H1 WAT 6922 62.543 82.707 147.762 1.00 0.00 H ATOM 97367 H2 WAT 6922 61.537 83.239 148.760 1.00 0.00 H TER 97369 WAT 6922 ATOM 97369 O WAT 6923 97.465 24.305 107.741 1.00 0.00 O ATOM 97370 H1 WAT 6923 96.549 24.168 107.985 1.00 0.00 H ATOM 97371 H2 WAT 6923 97.663 23.586 107.141 1.00 0.00 H TER 97373 WAT 6923 ATOM 97373 O WAT 6924 88.925 119.159 93.848 1.00 0.00 O ATOM 97374 H1 WAT 6924 88.576 118.547 94.495 1.00 0.00 H ATOM 97375 H2 WAT 6924 89.486 118.622 93.288 1.00 0.00 H TER 97377 WAT 6924 ATOM 97377 O WAT 6925 40.612 128.319 96.621 1.00 0.00 O ATOM 97378 H1 WAT 6925 41.315 127.835 97.055 1.00 0.00 H ATOM 97379 H2 WAT 6925 40.986 128.581 95.780 1.00 0.00 H TER 97381 WAT 6925 ATOM 97381 O WAT 6926 56.528 141.540 94.752 1.00 0.00 O ATOM 97382 H1 WAT 6926 56.177 141.977 93.976 1.00 0.00 H ATOM 97383 H2 WAT 6926 55.878 141.705 95.435 1.00 0.00 H TER 97385 WAT 6926 ATOM 97385 O WAT 6927 131.779 23.527 133.596 1.00 0.00 O ATOM 97386 H1 WAT 6927 132.231 22.837 134.081 1.00 0.00 H ATOM 97387 H2 WAT 6927 132.196 23.527 132.735 1.00 0.00 H TER 97389 WAT 6927 ATOM 97389 O WAT 6928 18.860 25.966 14.423 1.00 0.00 O ATOM 97390 H1 WAT 6928 18.963 25.136 14.888 1.00 0.00 H ATOM 97391 H2 WAT 6928 18.135 25.813 13.817 1.00 0.00 H TER 97393 WAT 6928 ATOM 97393 O WAT 6929 30.418 88.399 6.571 1.00 0.00 O ATOM 97394 H1 WAT 6929 30.072 89.130 7.083 1.00 0.00 H ATOM 97395 H2 WAT 6929 30.509 87.686 7.203 1.00 0.00 H TER 97397 WAT 6929 ATOM 97397 O WAT 6930 3.477 24.719 9.903 1.00 0.00 O ATOM 97398 H1 WAT 6930 2.967 23.913 9.819 1.00 0.00 H ATOM 97399 H2 WAT 6930 3.029 25.347 9.337 1.00 0.00 H TER 97401 WAT 6930 ATOM 97401 O WAT 6931 113.897 93.900 136.639 1.00 0.00 O ATOM 97402 H1 WAT 6931 114.346 93.320 136.024 1.00 0.00 H ATOM 97403 H2 WAT 6931 113.444 94.534 136.084 1.00 0.00 H TER 97405 WAT 6931 ATOM 97405 O WAT 6932 65.512 71.937 72.198 1.00 0.00 O ATOM 97406 H1 WAT 6932 66.268 71.357 72.293 1.00 0.00 H ATOM 97407 H2 WAT 6932 64.768 71.409 72.489 1.00 0.00 H TER 97409 WAT 6932 ATOM 97409 O WAT 6933 131.165 7.942 154.815 1.00 0.00 O ATOM 97410 H1 WAT 6933 131.126 7.316 155.538 1.00 0.00 H ATOM 97411 H2 WAT 6933 130.446 7.685 154.238 1.00 0.00 H TER 97413 WAT 6933 ATOM 97413 O WAT 6934 78.044 139.620 8.820 1.00 0.00 O ATOM 97414 H1 WAT 6934 77.667 140.214 9.470 1.00 0.00 H ATOM 97415 H2 WAT 6934 78.911 139.983 8.639 1.00 0.00 H TER 97417 WAT 6934 ATOM 97417 O WAT 6935 97.693 81.772 95.496 1.00 0.00 O ATOM 97418 H1 WAT 6935 97.639 82.670 95.823 1.00 0.00 H ATOM 97419 H2 WAT 6935 98.200 81.842 94.687 1.00 0.00 H TER 97421 WAT 6935 ATOM 97421 O WAT 6936 131.295 108.010 140.049 1.00 0.00 O ATOM 97422 H1 WAT 6936 130.560 108.596 140.229 1.00 0.00 H ATOM 97423 H2 WAT 6936 130.914 107.133 140.076 1.00 0.00 H TER 97425 WAT 6936 ATOM 97425 O WAT 6937 112.553 105.129 134.348 1.00 0.00 O ATOM 97426 H1 WAT 6937 112.613 106.053 134.592 1.00 0.00 H ATOM 97427 H2 WAT 6937 113.239 104.702 134.862 1.00 0.00 H TER 97429 WAT 6937 ATOM 97429 O WAT 6938 106.299 8.164 16.197 1.00 0.00 O ATOM 97430 H1 WAT 6938 106.772 7.821 16.955 1.00 0.00 H ATOM 97431 H2 WAT 6938 105.943 7.388 15.764 1.00 0.00 H TER 97433 WAT 6938 ATOM 97433 O WAT 6939 84.317 51.060 67.875 1.00 0.00 O ATOM 97434 H1 WAT 6939 85.147 51.211 68.328 1.00 0.00 H ATOM 97435 H2 WAT 6939 84.214 50.109 67.877 1.00 0.00 H TER 97437 WAT 6939 ATOM 97437 O WAT 6940 26.947 93.519 155.446 1.00 0.00 O ATOM 97438 H1 WAT 6940 26.436 92.948 154.872 1.00 0.00 H ATOM 97439 H2 WAT 6940 27.119 92.986 156.222 1.00 0.00 H TER 97441 WAT 6940 ATOM 97441 O WAT 6941 97.925 81.103 117.355 1.00 0.00 O ATOM 97442 H1 WAT 6941 97.331 81.007 118.100 1.00 0.00 H ATOM 97443 H2 WAT 6941 98.415 80.281 117.333 1.00 0.00 H TER 97445 WAT 6941 ATOM 97445 O WAT 6942 108.373 85.286 72.277 1.00 0.00 O ATOM 97446 H1 WAT 6942 107.631 85.062 72.840 1.00 0.00 H ATOM 97447 H2 WAT 6942 108.593 86.186 72.517 1.00 0.00 H TER 97449 WAT 6942 ATOM 97449 O WAT 6943 64.483 130.233 138.339 1.00 0.00 O ATOM 97450 H1 WAT 6943 64.043 131.043 138.596 1.00 0.00 H ATOM 97451 H2 WAT 6943 65.101 130.502 137.659 1.00 0.00 H TER 97453 WAT 6943 ATOM 97453 O WAT 6944 132.288 65.363 83.208 1.00 0.00 O ATOM 97454 H1 WAT 6944 131.890 66.226 83.317 1.00 0.00 H ATOM 97455 H2 WAT 6944 133.187 65.547 82.936 1.00 0.00 H TER 97457 WAT 6944 ATOM 97457 O WAT 6945 109.029 19.785 68.281 1.00 0.00 O ATOM 97458 H1 WAT 6945 109.183 20.488 67.650 1.00 0.00 H ATOM 97459 H2 WAT 6945 108.089 19.614 68.223 1.00 0.00 H TER 97461 WAT 6945 ATOM 97461 O WAT 6946 104.189 86.503 97.917 1.00 0.00 O ATOM 97462 H1 WAT 6946 103.987 85.781 98.512 1.00 0.00 H ATOM 97463 H2 WAT 6946 103.430 87.083 97.978 1.00 0.00 H TER 97465 WAT 6946 ATOM 97465 O WAT 6947 119.724 12.908 102.053 1.00 0.00 O ATOM 97466 H1 WAT 6947 120.443 13.507 102.252 1.00 0.00 H ATOM 97467 H2 WAT 6947 119.707 12.300 102.792 1.00 0.00 H TER 97469 WAT 6947 ATOM 97469 O WAT 6948 82.794 56.036 88.532 1.00 0.00 O ATOM 97470 H1 WAT 6948 82.646 56.184 87.598 1.00 0.00 H ATOM 97471 H2 WAT 6948 83.683 55.685 88.580 1.00 0.00 H TER 97473 WAT 6948 ATOM 97473 O WAT 6949 7.635 70.548 87.326 1.00 0.00 O ATOM 97474 H1 WAT 6949 6.698 70.656 87.162 1.00 0.00 H ATOM 97475 H2 WAT 6949 8.025 71.373 87.039 1.00 0.00 H TER 97477 WAT 6949 ATOM 97477 O WAT 6950 18.611 137.556 113.287 1.00 0.00 O ATOM 97478 H1 WAT 6950 19.556 137.700 113.337 1.00 0.00 H ATOM 97479 H2 WAT 6950 18.335 138.044 112.511 1.00 0.00 H TER 97481 WAT 6950 ATOM 97481 O WAT 6951 71.178 34.031 77.580 1.00 0.00 O ATOM 97482 H1 WAT 6951 72.087 34.315 77.677 1.00 0.00 H ATOM 97483 H2 WAT 6951 71.183 33.473 76.802 1.00 0.00 H TER 97485 WAT 6951 ATOM 97485 O WAT 6952 121.805 47.292 155.330 1.00 0.00 O ATOM 97486 H1 WAT 6952 122.056 46.370 155.275 1.00 0.00 H ATOM 97487 H2 WAT 6952 120.925 47.325 154.955 1.00 0.00 H TER 97489 WAT 6952 ATOM 97489 O WAT 6953 65.890 69.857 15.983 1.00 0.00 O ATOM 97490 H1 WAT 6953 65.436 70.613 16.355 1.00 0.00 H ATOM 97491 H2 WAT 6953 66.675 69.761 16.522 1.00 0.00 H TER 97493 WAT 6953 ATOM 97493 O WAT 6954 1.241 120.790 153.429 1.00 0.00 O ATOM 97494 H1 WAT 6954 1.931 121.427 153.243 1.00 0.00 H ATOM 97495 H2 WAT 6954 1.700 119.953 153.494 1.00 0.00 H TER 97497 WAT 6954 ATOM 97497 O WAT 6955 70.928 140.303 90.367 1.00 0.00 O ATOM 97498 H1 WAT 6955 70.104 140.783 90.292 1.00 0.00 H ATOM 97499 H2 WAT 6955 71.598 140.985 90.426 1.00 0.00 H TER 97501 WAT 6955 ATOM 97501 O WAT 6956 25.799 12.172 105.290 1.00 0.00 O ATOM 97502 H1 WAT 6956 25.616 11.838 106.169 1.00 0.00 H ATOM 97503 H2 WAT 6956 25.662 13.117 105.360 1.00 0.00 H TER 97505 WAT 6956 ATOM 97505 O WAT 6957 93.838 122.134 94.202 1.00 0.00 O ATOM 97506 H1 WAT 6957 92.919 121.867 94.212 1.00 0.00 H ATOM 97507 H2 WAT 6957 94.157 121.926 95.080 1.00 0.00 H TER 97509 WAT 6957 ATOM 97509 O WAT 6958 81.942 127.285 154.678 1.00 0.00 O ATOM 97510 H1 WAT 6958 81.138 127.719 154.964 1.00 0.00 H ATOM 97511 H2 WAT 6958 81.662 126.700 153.974 1.00 0.00 H TER 97513 WAT 6958 ATOM 97513 O WAT 6959 121.970 122.538 154.551 1.00 0.00 O ATOM 97514 H1 WAT 6959 122.844 122.636 154.175 1.00 0.00 H ATOM 97515 H2 WAT 6959 122.006 123.028 155.373 1.00 0.00 H TER 97517 WAT 6959 ATOM 97517 O WAT 6960 76.455 102.222 100.101 1.00 0.00 O ATOM 97518 H1 WAT 6960 77.372 101.950 100.149 1.00 0.00 H ATOM 97519 H2 WAT 6960 76.037 101.788 100.845 1.00 0.00 H TER 97521 WAT 6960 ATOM 97521 O WAT 6961 85.869 47.140 101.110 1.00 0.00 O ATOM 97522 H1 WAT 6961 86.191 46.349 101.542 1.00 0.00 H ATOM 97523 H2 WAT 6961 85.105 47.399 101.626 1.00 0.00 H TER 97525 WAT 6961 ATOM 97525 O WAT 6962 142.897 116.007 18.248 1.00 0.00 O ATOM 97526 H1 WAT 6962 142.407 115.188 18.181 1.00 0.00 H ATOM 97527 H2 WAT 6962 142.918 116.198 19.186 1.00 0.00 H TER 97529 WAT 6962 ATOM 97529 O WAT 6963 106.348 15.022 136.778 1.00 0.00 O ATOM 97530 H1 WAT 6963 106.396 15.877 136.352 1.00 0.00 H ATOM 97531 H2 WAT 6963 106.102 14.418 136.077 1.00 0.00 H TER 97533 WAT 6963 ATOM 97533 O WAT 6964 103.032 54.590 119.310 1.00 0.00 O ATOM 97534 H1 WAT 6964 103.171 53.758 118.859 1.00 0.00 H ATOM 97535 H2 WAT 6964 103.547 55.223 118.810 1.00 0.00 H TER 97537 WAT 6964 ATOM 97537 O WAT 6965 50.930 63.400 107.581 1.00 0.00 O ATOM 97538 H1 WAT 6965 50.911 64.106 106.935 1.00 0.00 H ATOM 97539 H2 WAT 6965 51.438 62.706 107.161 1.00 0.00 H TER 97541 WAT 6965 ATOM 97541 O WAT 6966 58.875 130.781 73.316 1.00 0.00 O ATOM 97542 H1 WAT 6966 58.311 131.356 72.799 1.00 0.00 H ATOM 97543 H2 WAT 6966 59.098 131.298 74.091 1.00 0.00 H TER 97545 WAT 6966 ATOM 97545 O WAT 6967 105.735 20.312 64.626 1.00 0.00 O ATOM 97546 H1 WAT 6967 106.084 19.668 64.009 1.00 0.00 H ATOM 97547 H2 WAT 6967 104.947 20.650 64.200 1.00 0.00 H TER 97549 WAT 6967 ATOM 97549 O WAT 6968 77.082 115.274 123.146 1.00 0.00 O ATOM 97550 H1 WAT 6968 76.852 116.175 122.921 1.00 0.00 H ATOM 97551 H2 WAT 6968 78.035 115.243 123.069 1.00 0.00 H TER 97553 WAT 6968 ATOM 97553 O WAT 6969 70.918 141.076 2.568 1.00 0.00 O ATOM 97554 H1 WAT 6969 71.100 141.282 3.485 1.00 0.00 H ATOM 97555 H2 WAT 6969 71.774 141.115 2.140 1.00 0.00 H TER 97557 WAT 6969 ATOM 97557 O WAT 6970 123.724 9.177 145.675 1.00 0.00 O ATOM 97558 H1 WAT 6970 123.730 9.551 146.556 1.00 0.00 H ATOM 97559 H2 WAT 6970 124.198 8.350 145.762 1.00 0.00 H TER 97561 WAT 6970 ATOM 97561 O WAT 6971 104.127 71.303 79.355 1.00 0.00 O ATOM 97562 H1 WAT 6971 104.774 70.823 79.873 1.00 0.00 H ATOM 97563 H2 WAT 6971 103.513 71.650 80.002 1.00 0.00 H TER 97565 WAT 6971 ATOM 97565 O WAT 6972 39.338 103.082 29.150 1.00 0.00 O ATOM 97566 H1 WAT 6972 38.655 102.973 29.812 1.00 0.00 H ATOM 97567 H2 WAT 6972 39.610 103.996 29.235 1.00 0.00 H TER 97569 WAT 6972 ATOM 97569 O WAT 6973 28.061 63.712 146.024 1.00 0.00 O ATOM 97570 H1 WAT 6973 27.706 64.386 146.603 1.00 0.00 H ATOM 97571 H2 WAT 6973 28.795 63.339 146.512 1.00 0.00 H TER 97573 WAT 6973 ATOM 97573 O WAT 6974 111.963 32.225 108.505 1.00 0.00 O ATOM 97574 H1 WAT 6974 112.198 31.645 109.230 1.00 0.00 H ATOM 97575 H2 WAT 6974 111.027 32.387 108.622 1.00 0.00 H TER 97577 WAT 6974 ATOM 97577 O WAT 6975 126.022 138.182 79.349 1.00 0.00 O ATOM 97578 H1 WAT 6975 125.914 138.948 79.913 1.00 0.00 H ATOM 97579 H2 WAT 6975 126.610 137.606 79.837 1.00 0.00 H TER 97581 WAT 6975 ATOM 97581 O WAT 6976 137.159 82.558 138.876 1.00 0.00 O ATOM 97582 H1 WAT 6976 136.513 82.485 138.174 1.00 0.00 H ATOM 97583 H2 WAT 6976 137.869 81.974 138.609 1.00 0.00 H TER 97585 WAT 6976 ATOM 97585 O WAT 6977 121.673 19.886 120.445 1.00 0.00 O ATOM 97586 H1 WAT 6977 122.227 19.443 119.801 1.00 0.00 H ATOM 97587 H2 WAT 6977 120.927 19.298 120.563 1.00 0.00 H TER 97589 WAT 6977 ATOM 97589 O WAT 6978 110.419 52.381 120.124 1.00 0.00 O ATOM 97590 H1 WAT 6978 109.519 52.069 120.027 1.00 0.00 H ATOM 97591 H2 WAT 6978 110.583 52.347 121.066 1.00 0.00 H TER 97593 WAT 6978 ATOM 97593 O WAT 6979 31.559 20.160 135.486 1.00 0.00 O ATOM 97594 H1 WAT 6979 31.895 20.900 134.981 1.00 0.00 H ATOM 97595 H2 WAT 6979 32.092 19.416 135.205 1.00 0.00 H TER 97597 WAT 6979 ATOM 97597 O WAT 6980 113.789 32.294 58.628 1.00 0.00 O ATOM 97598 H1 WAT 6980 113.485 32.972 58.025 1.00 0.00 H ATOM 97599 H2 WAT 6980 114.376 31.750 58.102 1.00 0.00 H TER 97601 WAT 6980 ATOM 97601 O WAT 6981 95.398 114.277 156.096 1.00 0.00 O ATOM 97602 H1 WAT 6981 95.805 113.547 156.562 1.00 0.00 H ATOM 97603 H2 WAT 6981 95.499 115.024 156.686 1.00 0.00 H TER 97605 WAT 6981 ATOM 97605 O WAT 6982 24.633 138.661 19.645 1.00 0.00 O ATOM 97606 H1 WAT 6982 24.642 137.844 20.144 1.00 0.00 H ATOM 97607 H2 WAT 6982 25.519 138.736 19.291 1.00 0.00 H TER 97609 WAT 6982 ATOM 97609 O WAT 6983 111.418 75.216 154.956 1.00 0.00 O ATOM 97610 H1 WAT 6983 111.739 74.317 154.873 1.00 0.00 H ATOM 97611 H2 WAT 6983 110.466 75.128 154.988 1.00 0.00 H TER 97613 WAT 6983 ATOM 97613 O WAT 6984 119.520 119.197 80.792 1.00 0.00 O ATOM 97614 H1 WAT 6984 119.060 119.119 81.628 1.00 0.00 H ATOM 97615 H2 WAT 6984 118.823 119.314 80.146 1.00 0.00 H TER 97617 WAT 6984 ATOM 97617 O WAT 6985 25.864 113.415 141.221 1.00 0.00 O ATOM 97618 H1 WAT 6985 26.817 113.320 141.194 1.00 0.00 H ATOM 97619 H2 WAT 6985 25.690 114.218 140.730 1.00 0.00 H TER 97621 WAT 6985 ATOM 97621 O WAT 6986 103.195 81.700 100.182 1.00 0.00 O ATOM 97622 H1 WAT 6986 102.545 81.285 100.750 1.00 0.00 H ATOM 97623 H2 WAT 6986 104.000 81.700 100.701 1.00 0.00 H TER 97625 WAT 6986 ATOM 97625 O WAT 6987 84.987 70.801 153.382 1.00 0.00 O ATOM 97626 H1 WAT 6987 84.120 71.102 153.109 1.00 0.00 H ATOM 97627 H2 WAT 6987 85.103 69.964 152.931 1.00 0.00 H TER 97629 WAT 6987 ATOM 97629 O WAT 6988 110.039 134.122 134.156 1.00 0.00 O ATOM 97630 H1 WAT 6988 110.466 134.021 133.305 1.00 0.00 H ATOM 97631 H2 WAT 6988 109.499 133.337 134.247 1.00 0.00 H TER 97633 WAT 6988 ATOM 97633 O WAT 6989 120.734 78.899 85.389 1.00 0.00 O ATOM 97634 H1 WAT 6989 119.998 79.112 85.962 1.00 0.00 H ATOM 97635 H2 WAT 6989 121.461 78.725 85.988 1.00 0.00 H TER 97637 WAT 6989 ATOM 97637 O WAT 6990 111.806 31.357 158.786 1.00 0.00 O ATOM 97638 H1 WAT 6990 112.630 31.424 158.302 1.00 0.00 H ATOM 97639 H2 WAT 6990 111.223 31.979 158.352 1.00 0.00 H TER 97641 WAT 6990 ATOM 97641 O WAT 6991 31.023 114.648 150.973 1.00 0.00 O ATOM 97642 H1 WAT 6991 30.071 114.728 151.031 1.00 0.00 H ATOM 97643 H2 WAT 6991 31.270 114.150 151.752 1.00 0.00 H TER 97645 WAT 6991 ATOM 97645 O WAT 6992 140.812 44.703 73.972 1.00 0.00 O ATOM 97646 H1 WAT 6992 141.438 44.050 74.286 1.00 0.00 H ATOM 97647 H2 WAT 6992 141.258 45.129 73.240 1.00 0.00 H TER 97649 WAT 6992 ATOM 97649 O WAT 6993 11.210 134.720 147.791 1.00 0.00 O ATOM 97650 H1 WAT 6993 11.711 134.396 148.539 1.00 0.00 H ATOM 97651 H2 WAT 6993 11.331 134.054 147.114 1.00 0.00 H TER 97653 WAT 6993 ATOM 97653 O WAT 6994 41.612 129.993 138.018 1.00 0.00 O ATOM 97654 H1 WAT 6994 42.514 129.951 137.699 1.00 0.00 H ATOM 97655 H2 WAT 6994 41.244 130.768 137.593 1.00 0.00 H TER 97657 WAT 6994 ATOM 97657 O WAT 6995 33.742 5.933 86.036 1.00 0.00 O ATOM 97658 H1 WAT 6995 34.681 6.092 85.943 1.00 0.00 H ATOM 97659 H2 WAT 6995 33.542 5.280 85.365 1.00 0.00 H TER 97661 WAT 6995 ATOM 97661 O WAT 6996 120.004 125.841 11.744 1.00 0.00 O ATOM 97662 H1 WAT 6996 120.951 125.733 11.825 1.00 0.00 H ATOM 97663 H2 WAT 6996 119.690 125.883 12.647 1.00 0.00 H TER 97665 WAT 6996 ATOM 97665 O WAT 6997 118.421 28.941 68.569 1.00 0.00 O ATOM 97666 H1 WAT 6997 118.965 28.378 69.119 1.00 0.00 H ATOM 97667 H2 WAT 6997 118.826 29.806 68.637 1.00 0.00 H TER 97669 WAT 6997 ATOM 97669 O WAT 6998 50.862 2.515 151.291 1.00 0.00 O ATOM 97670 H1 WAT 6998 50.861 3.090 150.525 1.00 0.00 H ATOM 97671 H2 WAT 6998 51.598 1.921 151.143 1.00 0.00 H TER 97673 WAT 6998 ATOM 97673 O WAT 6999 130.884 47.687 102.973 1.00 0.00 O ATOM 97674 H1 WAT 6999 131.387 46.931 102.672 1.00 0.00 H ATOM 97675 H2 WAT 6999 131.098 48.381 102.350 1.00 0.00 H TER 97677 WAT 6999 ATOM 97677 O WAT 7000 2.080 100.184 77.181 1.00 0.00 O ATOM 97678 H1 WAT 7000 2.416 99.288 77.175 1.00 0.00 H ATOM 97679 H2 WAT 7000 1.528 100.227 77.962 1.00 0.00 H TER 97681 WAT 7000 ATOM 97681 O WAT 7001 8.935 26.203 93.646 1.00 0.00 O ATOM 97682 H1 WAT 7001 8.372 25.488 93.348 1.00 0.00 H ATOM 97683 H2 WAT 7001 8.958 26.108 94.598 1.00 0.00 H TER 97685 WAT 7001 ATOM 97685 O WAT 7002 101.240 46.641 21.025 1.00 0.00 O ATOM 97686 H1 WAT 7002 100.764 46.771 21.845 1.00 0.00 H ATOM 97687 H2 WAT 7002 100.766 47.174 20.386 1.00 0.00 H TER 97689 WAT 7002 ATOM 97689 O WAT 7003 54.941 95.882 16.950 1.00 0.00 O ATOM 97690 H1 WAT 7003 54.563 95.066 16.623 1.00 0.00 H ATOM 97691 H2 WAT 7003 55.783 95.953 16.500 1.00 0.00 H TER 97693 WAT 7003 ATOM 97693 O WAT 7004 129.017 69.299 120.949 1.00 0.00 O ATOM 97694 H1 WAT 7004 128.573 69.652 121.720 1.00 0.00 H ATOM 97695 H2 WAT 7004 128.794 69.908 120.245 1.00 0.00 H TER 97697 WAT 7004 ATOM 97697 O WAT 7005 41.233 80.389 0.653 1.00 0.00 O ATOM 97698 H1 WAT 7005 40.504 80.396 0.032 1.00 0.00 H ATOM 97699 H2 WAT 7005 41.217 81.258 1.052 1.00 0.00 H TER 97701 WAT 7005 ATOM 97701 O WAT 7006 107.170 56.152 26.015 1.00 0.00 O ATOM 97702 H1 WAT 7006 106.223 56.019 26.056 1.00 0.00 H ATOM 97703 H2 WAT 7006 107.289 56.814 25.333 1.00 0.00 H TER 97705 WAT 7006 ATOM 97705 O WAT 7007 127.471 141.070 87.748 1.00 0.00 O ATOM 97706 H1 WAT 7007 128.110 140.474 87.358 1.00 0.00 H ATOM 97707 H2 WAT 7007 127.950 141.889 87.869 1.00 0.00 H TER 97709 WAT 7007 ATOM 97709 O WAT 7008 40.884 77.607 7.424 1.00 0.00 O ATOM 97710 H1 WAT 7008 40.444 78.385 7.083 1.00 0.00 H ATOM 97711 H2 WAT 7008 40.170 77.027 7.693 1.00 0.00 H TER 97713 WAT 7008 ATOM 97713 O WAT 7009 59.279 50.084 66.713 1.00 0.00 O ATOM 97714 H1 WAT 7009 59.845 50.774 66.368 1.00 0.00 H ATOM 97715 H2 WAT 7009 58.533 50.064 66.113 1.00 0.00 H TER 97717 WAT 7009 ATOM 97717 O WAT 7010 71.287 143.975 157.498 1.00 0.00 O ATOM 97718 H1 WAT 7010 71.559 144.575 156.803 1.00 0.00 H ATOM 97719 H2 WAT 7010 71.921 143.259 157.459 1.00 0.00 H TER 97721 WAT 7010 ATOM 97721 O WAT 7011 26.906 51.250 145.932 1.00 0.00 O ATOM 97722 H1 WAT 7011 26.565 50.924 145.099 1.00 0.00 H ATOM 97723 H2 WAT 7011 26.193 51.775 146.295 1.00 0.00 H TER 97725 WAT 7011 ATOM 97725 O WAT 7012 114.538 26.348 136.805 1.00 0.00 O ATOM 97726 H1 WAT 7012 113.624 26.066 136.851 1.00 0.00 H ATOM 97727 H2 WAT 7012 114.534 27.235 137.165 1.00 0.00 H TER 97729 WAT 7012 ATOM 97729 O WAT 7013 30.820 8.158 116.449 1.00 0.00 O ATOM 97730 H1 WAT 7013 30.542 8.817 115.814 1.00 0.00 H ATOM 97731 H2 WAT 7013 31.511 7.670 116.001 1.00 0.00 H TER 97733 WAT 7013 ATOM 97733 O WAT 7014 7.496 97.748 91.188 1.00 0.00 O ATOM 97734 H1 WAT 7014 7.220 98.048 90.322 1.00 0.00 H ATOM 97735 H2 WAT 7014 8.408 98.030 91.260 1.00 0.00 H TER 97737 WAT 7014 ATOM 97737 O WAT 7015 129.302 106.786 108.710 1.00 0.00 O ATOM 97738 H1 WAT 7015 129.486 105.847 108.735 1.00 0.00 H ATOM 97739 H2 WAT 7015 128.550 106.868 108.125 1.00 0.00 H TER 97741 WAT 7015 ATOM 97741 O WAT 7016 103.550 25.631 128.391 1.00 0.00 O ATOM 97742 H1 WAT 7016 102.857 25.381 127.780 1.00 0.00 H ATOM 97743 H2 WAT 7016 103.741 26.544 128.176 1.00 0.00 H TER 97745 WAT 7016 ATOM 97745 O WAT 7017 9.194 105.556 137.030 1.00 0.00 O ATOM 97746 H1 WAT 7017 10.005 105.856 136.619 1.00 0.00 H ATOM 97747 H2 WAT 7017 8.503 105.842 136.433 1.00 0.00 H TER 97749 WAT 7017 ATOM 97749 O WAT 7018 18.560 143.367 89.320 1.00 0.00 O ATOM 97750 H1 WAT 7018 18.400 142.506 89.707 1.00 0.00 H ATOM 97751 H2 WAT 7018 19.513 143.439 89.280 1.00 0.00 H TER 97753 WAT 7018 ATOM 97753 O WAT 7019 64.402 61.434 89.477 1.00 0.00 O ATOM 97754 H1 WAT 7019 63.790 61.587 90.197 1.00 0.00 H ATOM 97755 H2 WAT 7019 65.240 61.763 89.801 1.00 0.00 H TER 97757 WAT 7019 ATOM 97757 O WAT 7020 126.980 109.324 137.814 1.00 0.00 O ATOM 97758 H1 WAT 7020 127.007 108.910 136.952 1.00 0.00 H ATOM 97759 H2 WAT 7020 126.099 109.693 137.875 1.00 0.00 H TER 97761 WAT 7020 ATOM 97761 O WAT 7021 108.986 126.786 61.678 1.00 0.00 O ATOM 97762 H1 WAT 7021 109.049 127.322 62.468 1.00 0.00 H ATOM 97763 H2 WAT 7021 109.593 127.196 61.062 1.00 0.00 H TER 97765 WAT 7021 ATOM 97765 O WAT 7022 32.993 139.418 75.070 1.00 0.00 O ATOM 97766 H1 WAT 7022 33.251 139.707 75.945 1.00 0.00 H ATOM 97767 H2 WAT 7022 32.221 138.870 75.217 1.00 0.00 H TER 97769 WAT 7022 ATOM 97769 O WAT 7023 11.940 116.246 20.278 1.00 0.00 O ATOM 97770 H1 WAT 7023 11.049 116.067 20.579 1.00 0.00 H ATOM 97771 H2 WAT 7023 11.906 117.145 19.950 1.00 0.00 H TER 97773 WAT 7023 ATOM 97773 O WAT 7024 56.834 80.267 126.371 1.00 0.00 O ATOM 97774 H1 WAT 7024 57.515 80.784 126.800 1.00 0.00 H ATOM 97775 H2 WAT 7024 57.305 79.743 125.723 1.00 0.00 H TER 97777 WAT 7024 ATOM 97777 O WAT 7025 36.870 58.242 136.411 1.00 0.00 O ATOM 97778 H1 WAT 7025 36.500 59.005 135.969 1.00 0.00 H ATOM 97779 H2 WAT 7025 36.335 58.139 137.199 1.00 0.00 H TER 97781 WAT 7025 ATOM 97781 O WAT 7026 36.159 88.793 29.114 1.00 0.00 O ATOM 97782 H1 WAT 7026 36.818 89.287 28.625 1.00 0.00 H ATOM 97783 H2 WAT 7026 36.312 87.881 28.866 1.00 0.00 H TER 97785 WAT 7026 ATOM 97785 O WAT 7027 144.635 26.168 158.175 1.00 0.00 O ATOM 97786 H1 WAT 7027 145.469 25.757 157.950 1.00 0.00 H ATOM 97787 H2 WAT 7027 144.854 27.087 158.327 1.00 0.00 H TER 97789 WAT 7027 ATOM 97789 O WAT 7028 30.293 79.055 102.117 1.00 0.00 O ATOM 97790 H1 WAT 7028 30.226 79.257 101.184 1.00 0.00 H ATOM 97791 H2 WAT 7028 29.874 78.199 102.207 1.00 0.00 H TER 97793 WAT 7028 ATOM 97793 O WAT 7029 8.721 47.810 126.274 1.00 0.00 O ATOM 97794 H1 WAT 7029 8.465 47.102 126.865 1.00 0.00 H ATOM 97795 H2 WAT 7029 8.334 48.596 126.659 1.00 0.00 H TER 97797 WAT 7029 ATOM 97797 O WAT 7030 127.211 48.835 137.710 1.00 0.00 O ATOM 97798 H1 WAT 7030 127.222 49.751 137.989 1.00 0.00 H ATOM 97799 H2 WAT 7030 127.416 48.867 136.776 1.00 0.00 H TER 97801 WAT 7030 ATOM 97801 O WAT 7031 123.010 110.872 80.927 1.00 0.00 O ATOM 97802 H1 WAT 7031 122.958 111.785 80.647 1.00 0.00 H ATOM 97803 H2 WAT 7031 122.537 110.848 81.759 1.00 0.00 H TER 97805 WAT 7031 ATOM 97805 O WAT 7032 104.515 120.321 20.599 1.00 0.00 O ATOM 97806 H1 WAT 7032 105.074 120.862 21.157 1.00 0.00 H ATOM 97807 H2 WAT 7032 104.131 119.679 21.196 1.00 0.00 H TER 97809 WAT 7032 ATOM 97809 O WAT 7033 53.660 103.378 73.162 1.00 0.00 O ATOM 97810 H1 WAT 7033 53.323 102.632 72.666 1.00 0.00 H ATOM 97811 H2 WAT 7033 53.864 103.018 74.026 1.00 0.00 H TER 97813 WAT 7033 ATOM 97813 O WAT 7034 70.029 139.414 12.943 1.00 0.00 O ATOM 97814 H1 WAT 7034 70.073 138.611 13.462 1.00 0.00 H ATOM 97815 H2 WAT 7034 70.604 139.249 12.196 1.00 0.00 H TER 97817 WAT 7034 ATOM 97817 O WAT 7035 120.759 110.202 128.181 1.00 0.00 O ATOM 97818 H1 WAT 7035 120.458 109.533 128.795 1.00 0.00 H ATOM 97819 H2 WAT 7035 120.484 111.030 128.576 1.00 0.00 H TER 97821 WAT 7035 ATOM 97821 O WAT 7036 80.891 28.989 138.869 1.00 0.00 O ATOM 97822 H1 WAT 7036 80.282 29.287 138.194 1.00 0.00 H ATOM 97823 H2 WAT 7036 81.693 29.484 138.703 1.00 0.00 H TER 97825 WAT 7036 ATOM 97825 O WAT 7037 91.708 14.858 87.542 1.00 0.00 O ATOM 97826 H1 WAT 7037 92.600 15.029 87.842 1.00 0.00 H ATOM 97827 H2 WAT 7037 91.596 13.914 87.648 1.00 0.00 H TER 97829 WAT 7037 ATOM 97829 O WAT 7038 65.756 54.746 77.270 1.00 0.00 O ATOM 97830 H1 WAT 7038 65.852 53.812 77.081 1.00 0.00 H ATOM 97831 H2 WAT 7038 66.650 55.086 77.260 1.00 0.00 H TER 97833 WAT 7038 ATOM 97833 O WAT 7039 65.208 55.145 107.091 1.00 0.00 O ATOM 97834 H1 WAT 7039 65.063 54.812 106.205 1.00 0.00 H ATOM 97835 H2 WAT 7039 66.160 55.170 107.185 1.00 0.00 H TER 97837 WAT 7039 ATOM 97837 O WAT 7040 22.199 83.376 99.920 1.00 0.00 O ATOM 97838 H1 WAT 7040 22.822 82.663 99.780 1.00 0.00 H ATOM 97839 H2 WAT 7040 21.614 83.051 100.605 1.00 0.00 H TER 97841 WAT 7040 ATOM 97841 O WAT 7041 117.405 74.271 91.727 1.00 0.00 O ATOM 97842 H1 WAT 7041 116.582 74.577 91.346 1.00 0.00 H ATOM 97843 H2 WAT 7041 117.289 73.326 91.820 1.00 0.00 H TER 97845 WAT 7041 ATOM 97845 O WAT 7042 40.637 60.923 134.414 1.00 0.00 O ATOM 97846 H1 WAT 7042 39.869 61.460 134.219 1.00 0.00 H ATOM 97847 H2 WAT 7042 41.110 60.870 133.583 1.00 0.00 H TER 97849 WAT 7042 ATOM 97849 O WAT 7043 16.918 76.354 59.361 1.00 0.00 O ATOM 97850 H1 WAT 7043 17.117 77.094 58.787 1.00 0.00 H ATOM 97851 H2 WAT 7043 17.753 76.144 59.780 1.00 0.00 H TER 97853 WAT 7043 ATOM 97853 O WAT 7044 9.538 114.443 69.463 1.00 0.00 O ATOM 97854 H1 WAT 7044 9.997 114.103 68.695 1.00 0.00 H ATOM 97855 H2 WAT 7044 9.241 113.662 69.930 1.00 0.00 H TER 97857 WAT 7044 ATOM 97857 O WAT 7045 118.501 36.243 141.773 1.00 0.00 O ATOM 97858 H1 WAT 7045 119.093 35.878 142.431 1.00 0.00 H ATOM 97859 H2 WAT 7045 118.873 37.100 141.565 1.00 0.00 H TER 97861 WAT 7045 ATOM 97861 O WAT 7046 79.258 31.246 17.181 1.00 0.00 O ATOM 97862 H1 WAT 7046 79.927 31.341 17.859 1.00 0.00 H ATOM 97863 H2 WAT 7046 79.163 32.125 16.814 1.00 0.00 H TER 97865 WAT 7046 ATOM 97865 O WAT 7047 112.448 82.851 12.067 1.00 0.00 O ATOM 97866 H1 WAT 7047 112.480 83.464 11.333 1.00 0.00 H ATOM 97867 H2 WAT 7047 113.278 82.982 12.526 1.00 0.00 H TER 97869 WAT 7047 ATOM 97869 O WAT 7048 123.745 73.527 157.807 1.00 0.00 O ATOM 97870 H1 WAT 7048 124.185 72.818 157.338 1.00 0.00 H ATOM 97871 H2 WAT 7048 123.228 73.084 158.480 1.00 0.00 H TER 97873 WAT 7048 ATOM 97873 O WAT 7049 96.673 106.960 64.355 1.00 0.00 O ATOM 97874 H1 WAT 7049 96.469 107.858 64.615 1.00 0.00 H ATOM 97875 H2 WAT 7049 96.011 106.745 63.698 1.00 0.00 H TER 97877 WAT 7049 ATOM 97877 O WAT 7050 15.076 136.479 8.116 1.00 0.00 O ATOM 97878 H1 WAT 7050 14.516 135.813 7.717 1.00 0.00 H ATOM 97879 H2 WAT 7050 15.654 136.762 7.407 1.00 0.00 H TER 97881 WAT 7050 ATOM 97881 O WAT 7051 54.936 17.105 147.008 1.00 0.00 O ATOM 97882 H1 WAT 7051 54.175 16.599 146.723 1.00 0.00 H ATOM 97883 H2 WAT 7051 54.754 17.317 147.923 1.00 0.00 H TER 97885 WAT 7051 ATOM 97885 O WAT 7052 66.266 96.748 74.968 1.00 0.00 O ATOM 97886 H1 WAT 7052 66.618 95.922 75.301 1.00 0.00 H ATOM 97887 H2 WAT 7052 66.031 96.559 74.060 1.00 0.00 H TER 97889 WAT 7052 ATOM 97889 O WAT 7053 0.257 21.603 148.409 1.00 0.00 O ATOM 97890 H1 WAT 7053 -0.445 21.766 147.779 1.00 0.00 H ATOM 97891 H2 WAT 7053 1.006 21.345 147.872 1.00 0.00 H TER 97893 WAT 7053 ATOM 97893 O WAT 7054 82.285 28.865 96.150 1.00 0.00 O ATOM 97894 H1 WAT 7054 81.450 28.782 96.610 1.00 0.00 H ATOM 97895 H2 WAT 7054 82.648 27.979 96.152 1.00 0.00 H TER 97897 WAT 7054 ATOM 97897 O WAT 7055 138.948 98.044 142.529 1.00 0.00 O ATOM 97898 H1 WAT 7055 138.436 97.246 142.400 1.00 0.00 H ATOM 97899 H2 WAT 7055 138.304 98.751 142.491 1.00 0.00 H TER 97901 WAT 7055 ATOM 97901 O WAT 7056 47.688 59.282 21.275 1.00 0.00 O ATOM 97902 H1 WAT 7056 48.214 60.080 21.330 1.00 0.00 H ATOM 97903 H2 WAT 7056 48.124 58.667 21.865 1.00 0.00 H TER 97905 WAT 7056 ATOM 97905 O WAT 7057 105.314 135.504 117.930 1.00 0.00 O ATOM 97906 H1 WAT 7057 105.687 135.552 117.050 1.00 0.00 H ATOM 97907 H2 WAT 7057 105.982 135.896 118.494 1.00 0.00 H TER 97909 WAT 7057 ATOM 97909 O WAT 7058 123.797 66.141 122.826 1.00 0.00 O ATOM 97910 H1 WAT 7058 124.415 65.413 122.768 1.00 0.00 H ATOM 97911 H2 WAT 7058 124.224 66.856 122.352 1.00 0.00 H TER 97913 WAT 7058 ATOM 97913 O WAT 7059 82.318 83.178 61.903 1.00 0.00 O ATOM 97914 H1 WAT 7059 81.440 83.324 62.257 1.00 0.00 H ATOM 97915 H2 WAT 7059 82.178 82.616 61.140 1.00 0.00 H TER 97917 WAT 7059 ATOM 97917 O WAT 7060 62.327 83.528 8.148 1.00 0.00 O ATOM 97918 H1 WAT 7060 62.883 84.205 7.761 1.00 0.00 H ATOM 97919 H2 WAT 7060 61.985 83.042 7.399 1.00 0.00 H TER 97921 WAT 7060 ATOM 97921 O WAT 7061 49.272 50.628 127.506 1.00 0.00 O ATOM 97922 H1 WAT 7061 48.782 50.394 128.294 1.00 0.00 H ATOM 97923 H2 WAT 7061 50.004 50.011 127.487 1.00 0.00 H TER 97925 WAT 7061 ATOM 97925 O WAT 7062 125.529 5.585 21.066 1.00 0.00 O ATOM 97926 H1 WAT 7062 126.124 5.559 21.815 1.00 0.00 H ATOM 97927 H2 WAT 7062 125.739 4.797 20.565 1.00 0.00 H TER 97929 WAT 7062 ATOM 97929 O WAT 7063 40.229 136.965 65.438 1.00 0.00 O ATOM 97930 H1 WAT 7063 39.664 137.738 65.430 1.00 0.00 H ATOM 97931 H2 WAT 7063 40.930 137.174 64.820 1.00 0.00 H TER 97933 WAT 7063 ATOM 97933 O WAT 7064 59.444 34.933 0.067 1.00 0.00 O ATOM 97934 H1 WAT 7064 60.163 34.553 0.572 1.00 0.00 H ATOM 97935 H2 WAT 7064 59.084 35.613 0.636 1.00 0.00 H TER 97937 WAT 7064 ATOM 97937 O WAT 7065 111.194 143.820 70.334 1.00 0.00 O ATOM 97938 H1 WAT 7065 111.424 143.219 71.043 1.00 0.00 H ATOM 97939 H2 WAT 7065 110.589 143.322 69.784 1.00 0.00 H TER 97941 WAT 7065 ATOM 97941 O WAT 7066 43.404 56.748 123.056 1.00 0.00 O ATOM 97942 H1 WAT 7066 43.404 56.754 124.014 1.00 0.00 H ATOM 97943 H2 WAT 7066 43.205 55.841 122.823 1.00 0.00 H TER 97945 WAT 7066 ATOM 97945 O WAT 7067 59.508 94.426 60.312 1.00 0.00 O ATOM 97946 H1 WAT 7067 59.493 93.970 61.153 1.00 0.00 H ATOM 97947 H2 WAT 7067 59.640 95.346 60.540 1.00 0.00 H TER 97949 WAT 7067 ATOM 97949 O WAT 7068 39.477 28.158 155.301 1.00 0.00 O ATOM 97950 H1 WAT 7068 40.401 28.076 155.534 1.00 0.00 H ATOM 97951 H2 WAT 7068 39.134 27.267 155.361 1.00 0.00 H TER 97953 WAT 7068 ATOM 97953 O WAT 7069 74.898 18.571 0.885 1.00 0.00 O ATOM 97954 H1 WAT 7069 74.781 17.788 1.423 1.00 0.00 H ATOM 97955 H2 WAT 7069 74.374 19.242 1.323 1.00 0.00 H TER 97957 WAT 7069 ATOM 97957 O WAT 7070 8.095 19.934 81.551 1.00 0.00 O ATOM 97958 H1 WAT 7070 8.506 20.768 81.774 1.00 0.00 H ATOM 97959 H2 WAT 7070 7.157 20.126 81.534 1.00 0.00 H TER 97961 WAT 7070 ATOM 97961 O WAT 7071 78.315 102.576 124.700 1.00 0.00 O ATOM 97962 H1 WAT 7071 78.425 102.430 125.639 1.00 0.00 H ATOM 97963 H2 WAT 7071 78.957 101.996 124.290 1.00 0.00 H TER 97965 WAT 7071 ATOM 97965 O WAT 7072 131.893 103.226 90.593 1.00 0.00 O ATOM 97966 H1 WAT 7072 131.938 102.622 89.852 1.00 0.00 H ATOM 97967 H2 WAT 7072 131.842 104.093 90.192 1.00 0.00 H TER 97969 WAT 7072 ATOM 97969 O WAT 7073 35.316 90.314 99.116 1.00 0.00 O ATOM 97970 H1 WAT 7073 35.297 91.071 98.530 1.00 0.00 H ATOM 97971 H2 WAT 7073 34.684 90.526 99.802 1.00 0.00 H TER 97973 WAT 7073 ATOM 97973 O WAT 7074 88.398 15.943 15.051 1.00 0.00 O ATOM 97974 H1 WAT 7074 87.542 16.108 15.447 1.00 0.00 H ATOM 97975 H2 WAT 7074 88.906 15.521 15.743 1.00 0.00 H TER 97977 WAT 7074 ATOM 97977 O WAT 7075 107.107 35.706 123.593 1.00 0.00 O ATOM 97978 H1 WAT 7075 106.760 36.081 122.783 1.00 0.00 H ATOM 97979 H2 WAT 7075 107.307 36.464 124.141 1.00 0.00 H TER 97981 WAT 7075 ATOM 97981 O WAT 7076 17.070 23.110 77.857 1.00 0.00 O ATOM 97982 H1 WAT 7076 17.905 23.243 77.409 1.00 0.00 H ATOM 97983 H2 WAT 7076 17.311 22.903 78.759 1.00 0.00 H TER 97985 WAT 7076 ATOM 97985 O WAT 7077 80.566 125.927 84.633 1.00 0.00 O ATOM 97986 H1 WAT 7077 80.530 126.522 85.382 1.00 0.00 H ATOM 97987 H2 WAT 7077 80.713 125.064 85.019 1.00 0.00 H TER 97989 WAT 7077 ATOM 97989 O WAT 7078 67.754 63.062 102.712 1.00 0.00 O ATOM 97990 H1 WAT 7078 67.772 63.162 101.760 1.00 0.00 H ATOM 97991 H2 WAT 7078 67.402 62.184 102.854 1.00 0.00 H TER 97993 WAT 7078 ATOM 97993 O WAT 7079 14.979 137.508 73.165 1.00 0.00 O ATOM 97994 H1 WAT 7079 14.267 138.133 73.304 1.00 0.00 H ATOM 97995 H2 WAT 7079 14.579 136.652 73.317 1.00 0.00 H TER 97997 WAT 7079 ATOM 97997 O WAT 7080 0.708 144.598 78.957 1.00 0.00 O ATOM 97998 H1 WAT 7080 0.672 145.064 78.122 1.00 0.00 H ATOM 97999 H2 WAT 7080 1.122 145.217 79.559 1.00 0.00 H TER 98001 WAT 7080 ATOM 98001 O WAT 7081 143.803 27.205 7.813 1.00 0.00 O ATOM 98002 H1 WAT 7081 143.870 26.251 7.829 1.00 0.00 H ATOM 98003 H2 WAT 7081 143.405 27.404 6.966 1.00 0.00 H TER 98005 WAT 7081 ATOM 98005 O WAT 7082 12.707 34.364 138.941 1.00 0.00 O ATOM 98006 H1 WAT 7082 12.142 35.133 139.022 1.00 0.00 H ATOM 98007 H2 WAT 7082 13.184 34.329 139.769 1.00 0.00 H TER 98009 WAT 7082 ATOM 98009 O WAT 7083 88.363 25.515 145.857 1.00 0.00 O ATOM 98010 H1 WAT 7083 88.372 24.631 146.225 1.00 0.00 H ATOM 98011 H2 WAT 7083 88.255 25.381 144.916 1.00 0.00 H TER 98013 WAT 7083 ATOM 98013 O WAT 7084 68.718 92.751 6.049 1.00 0.00 O ATOM 98014 H1 WAT 7084 69.192 93.576 6.157 1.00 0.00 H ATOM 98015 H2 WAT 7084 69.224 92.116 6.557 1.00 0.00 H TER 98017 WAT 7084 ATOM 98017 O WAT 7085 74.975 16.833 150.373 1.00 0.00 O ATOM 98018 H1 WAT 7085 74.909 17.657 150.856 1.00 0.00 H ATOM 98019 H2 WAT 7085 75.904 16.758 150.155 1.00 0.00 H TER 98021 WAT 7085 ATOM 98021 O WAT 7086 9.767 5.985 134.597 1.00 0.00 O ATOM 98022 H1 WAT 7086 10.096 6.202 133.725 1.00 0.00 H ATOM 98023 H2 WAT 7086 8.910 5.589 134.437 1.00 0.00 H TER 98025 WAT 7086 ATOM 98025 O WAT 7087 9.585 63.860 133.425 1.00 0.00 O ATOM 98026 H1 WAT 7087 10.537 63.782 133.376 1.00 0.00 H ATOM 98027 H2 WAT 7087 9.338 64.301 132.612 1.00 0.00 H TER 98029 WAT 7087 ATOM 98029 O WAT 7088 32.493 121.761 121.040 1.00 0.00 O ATOM 98030 H1 WAT 7088 32.641 122.559 121.547 1.00 0.00 H ATOM 98031 H2 WAT 7088 32.952 121.078 121.529 1.00 0.00 H TER 98033 WAT 7088 ATOM 98033 O WAT 7089 55.764 124.045 100.892 1.00 0.00 O ATOM 98034 H1 WAT 7089 56.413 124.502 100.358 1.00 0.00 H ATOM 98035 H2 WAT 7089 55.196 124.739 101.226 1.00 0.00 H TER 98037 WAT 7089 ATOM 98037 O WAT 7090 105.033 49.675 90.888 1.00 0.00 O ATOM 98038 H1 WAT 7090 104.232 49.158 90.803 1.00 0.00 H ATOM 98039 H2 WAT 7090 105.437 49.359 91.696 1.00 0.00 H TER 98041 WAT 7090 ATOM 98041 O WAT 7091 128.844 59.939 109.098 1.00 0.00 O ATOM 98042 H1 WAT 7091 129.432 59.384 108.586 1.00 0.00 H ATOM 98043 H2 WAT 7091 129.139 60.831 108.917 1.00 0.00 H TER 98045 WAT 7091 ATOM 98045 O WAT 7092 107.103 136.237 158.311 1.00 0.00 O ATOM 98046 H1 WAT 7092 107.367 136.728 157.533 1.00 0.00 H ATOM 98047 H2 WAT 7092 107.884 136.226 158.864 1.00 0.00 H TER 98049 WAT 7092 ATOM 98049 O WAT 7093 12.972 141.497 140.259 1.00 0.00 O ATOM 98050 H1 WAT 7093 13.524 141.077 139.598 1.00 0.00 H ATOM 98051 H2 WAT 7093 12.230 140.902 140.365 1.00 0.00 H TER 98053 WAT 7093 ATOM 98053 O WAT 7094 65.863 120.192 106.821 1.00 0.00 O ATOM 98054 H1 WAT 7094 66.097 119.268 106.916 1.00 0.00 H ATOM 98055 H2 WAT 7094 66.229 120.446 105.974 1.00 0.00 H TER 98057 WAT 7094 ATOM 98057 O WAT 7095 26.264 67.067 105.268 1.00 0.00 O ATOM 98058 H1 WAT 7095 25.845 66.432 105.850 1.00 0.00 H ATOM 98059 H2 WAT 7095 27.202 66.913 105.381 1.00 0.00 H TER 98061 WAT 7095 ATOM 98061 O WAT 7096 38.173 129.856 149.545 1.00 0.00 O ATOM 98062 H1 WAT 7096 38.750 130.443 150.033 1.00 0.00 H ATOM 98063 H2 WAT 7096 38.765 129.336 149.002 1.00 0.00 H TER 98065 WAT 7096 ATOM 98065 O WAT 7097 16.443 110.792 148.761 1.00 0.00 O ATOM 98066 H1 WAT 7097 16.023 111.410 148.163 1.00 0.00 H ATOM 98067 H2 WAT 7097 15.795 110.650 149.452 1.00 0.00 H TER 98069 WAT 7097 ATOM 98069 O WAT 7098 100.032 13.846 112.808 1.00 0.00 O ATOM 98070 H1 WAT 7098 99.742 13.460 113.634 1.00 0.00 H ATOM 98071 H2 WAT 7098 99.803 14.773 112.883 1.00 0.00 H TER 98073 WAT 7098 ATOM 98073 O WAT 7099 34.006 53.783 110.885 1.00 0.00 O ATOM 98074 H1 WAT 7099 33.338 54.238 110.371 1.00 0.00 H ATOM 98075 H2 WAT 7099 34.822 54.235 110.671 1.00 0.00 H TER 98077 WAT 7099 ATOM 98077 O WAT 7100 127.000 65.824 5.195 1.00 0.00 O ATOM 98078 H1 WAT 7100 126.379 66.442 4.810 1.00 0.00 H ATOM 98079 H2 WAT 7100 127.433 66.321 5.889 1.00 0.00 H TER 98081 WAT 7100 ATOM 98081 O WAT 7101 55.805 22.179 139.441 1.00 0.00 O ATOM 98082 H1 WAT 7101 55.423 22.988 139.781 1.00 0.00 H ATOM 98083 H2 WAT 7101 56.176 21.748 140.210 1.00 0.00 H TER 98085 WAT 7101 ATOM 98085 O WAT 7102 68.040 55.989 19.917 1.00 0.00 O ATOM 98086 H1 WAT 7102 68.405 56.505 20.635 1.00 0.00 H ATOM 98087 H2 WAT 7102 67.921 55.114 20.286 1.00 0.00 H TER 98089 WAT 7102 ATOM 98089 O WAT 7103 118.922 88.137 71.926 1.00 0.00 O ATOM 98090 H1 WAT 7103 119.023 88.328 72.859 1.00 0.00 H ATOM 98091 H2 WAT 7103 118.230 87.476 71.892 1.00 0.00 H TER 98093 WAT 7103 ATOM 98093 O WAT 7104 110.526 94.652 117.225 1.00 0.00 O ATOM 98094 H1 WAT 7104 111.102 95.415 117.256 1.00 0.00 H ATOM 98095 H2 WAT 7104 110.074 94.658 118.069 1.00 0.00 H TER 98097 WAT 7104 ATOM 98097 O WAT 7105 23.234 144.953 15.478 1.00 0.00 O ATOM 98098 H1 WAT 7105 23.232 144.748 14.543 1.00 0.00 H ATOM 98099 H2 WAT 7105 22.310 144.945 15.727 1.00 0.00 H TER 98101 WAT 7105 ATOM 98101 O WAT 7106 132.369 63.629 115.026 1.00 0.00 O ATOM 98102 H1 WAT 7106 132.907 64.331 115.393 1.00 0.00 H ATOM 98103 H2 WAT 7106 131.676 64.084 114.548 1.00 0.00 H TER 98105 WAT 7106 ATOM 98105 O WAT 7107 66.510 117.550 1.685 1.00 0.00 O ATOM 98106 H1 WAT 7107 67.017 118.357 1.777 1.00 0.00 H ATOM 98107 H2 WAT 7107 66.660 117.275 0.780 1.00 0.00 H TER 98109 WAT 7107 ATOM 98109 O WAT 7108 90.118 111.844 142.809 1.00 0.00 O ATOM 98110 H1 WAT 7108 89.578 111.066 142.666 1.00 0.00 H ATOM 98111 H2 WAT 7108 90.875 111.523 143.299 1.00 0.00 H TER 98113 WAT 7108 ATOM 98113 O WAT 7109 16.040 3.403 58.949 1.00 0.00 O ATOM 98114 H1 WAT 7109 16.682 3.933 58.477 1.00 0.00 H ATOM 98115 H2 WAT 7109 15.329 3.273 58.321 1.00 0.00 H TER 98117 WAT 7109 ATOM 98117 O WAT 7110 89.500 61.404 145.198 1.00 0.00 O ATOM 98118 H1 WAT 7110 88.857 61.776 145.801 1.00 0.00 H ATOM 98119 H2 WAT 7110 90.334 61.784 145.473 1.00 0.00 H TER 98121 WAT 7110 ATOM 98121 O WAT 7111 48.132 51.728 149.170 1.00 0.00 O ATOM 98122 H1 WAT 7111 47.879 52.371 149.832 1.00 0.00 H ATOM 98123 H2 WAT 7111 47.355 51.634 148.618 1.00 0.00 H TER 98125 WAT 7111 ATOM 98125 O WAT 7112 30.635 59.735 108.606 1.00 0.00 O ATOM 98126 H1 WAT 7112 31.126 59.165 108.014 1.00 0.00 H ATOM 98127 H2 WAT 7112 30.403 60.493 108.070 1.00 0.00 H TER 98129 WAT 7112 ATOM 98129 O WAT 7113 67.709 29.580 143.593 1.00 0.00 O ATOM 98130 H1 WAT 7113 68.569 29.994 143.532 1.00 0.00 H ATOM 98131 H2 WAT 7113 67.117 30.293 143.834 1.00 0.00 H TER 98133 WAT 7113 ATOM 98133 O WAT 7114 25.203 114.881 107.417 1.00 0.00 O ATOM 98134 H1 WAT 7114 25.357 114.519 106.544 1.00 0.00 H ATOM 98135 H2 WAT 7114 24.628 115.632 107.266 1.00 0.00 H TER 98137 WAT 7114 ATOM 98137 O WAT 7115 106.887 5.422 62.948 1.00 0.00 O ATOM 98138 H1 WAT 7115 106.450 6.083 63.484 1.00 0.00 H ATOM 98139 H2 WAT 7115 106.729 5.702 62.047 1.00 0.00 H TER 98141 WAT 7115 ATOM 98141 O WAT 7116 141.764 16.747 81.310 1.00 0.00 O ATOM 98142 H1 WAT 7116 140.918 16.355 81.095 1.00 0.00 H ATOM 98143 H2 WAT 7116 141.906 16.522 82.230 1.00 0.00 H TER 98145 WAT 7116 ATOM 98145 O WAT 7117 100.960 145.156 15.378 1.00 0.00 O ATOM 98146 H1 WAT 7117 100.406 144.724 14.729 1.00 0.00 H ATOM 98147 H2 WAT 7117 101.845 145.092 15.019 1.00 0.00 H TER 98149 WAT 7117 ATOM 98149 O WAT 7118 103.991 122.348 125.238 1.00 0.00 O ATOM 98150 H1 WAT 7118 104.772 121.854 125.490 1.00 0.00 H ATOM 98151 H2 WAT 7118 103.487 121.740 124.698 1.00 0.00 H TER 98153 WAT 7118 ATOM 98153 O WAT 7119 38.811 140.152 108.865 1.00 0.00 O ATOM 98154 H1 WAT 7119 39.406 140.327 109.593 1.00 0.00 H ATOM 98155 H2 WAT 7119 39.255 140.517 108.099 1.00 0.00 H TER 98157 WAT 7119 ATOM 98157 O WAT 7120 41.357 20.716 149.236 1.00 0.00 O ATOM 98158 H1 WAT 7120 41.173 21.649 149.127 1.00 0.00 H ATOM 98159 H2 WAT 7120 41.305 20.356 148.351 1.00 0.00 H TER 98161 WAT 7120 ATOM 98161 O WAT 7121 65.712 79.721 108.597 1.00 0.00 O ATOM 98162 H1 WAT 7121 65.454 80.622 108.404 1.00 0.00 H ATOM 98163 H2 WAT 7121 65.032 79.185 108.189 1.00 0.00 H TER 98165 WAT 7121 ATOM 98165 O WAT 7122 139.636 82.504 16.806 1.00 0.00 O ATOM 98166 H1 WAT 7122 139.685 81.633 16.412 1.00 0.00 H ATOM 98167 H2 WAT 7122 140.514 82.869 16.692 1.00 0.00 H TER 98169 WAT 7122 ATOM 98169 O WAT 7123 27.324 57.859 128.002 1.00 0.00 O ATOM 98170 H1 WAT 7123 26.503 58.053 127.549 1.00 0.00 H ATOM 98171 H2 WAT 7123 27.964 57.745 127.299 1.00 0.00 H TER 98173 WAT 7123 ATOM 98173 O WAT 7124 42.677 25.915 144.038 1.00 0.00 O ATOM 98174 H1 WAT 7124 42.850 26.199 143.141 1.00 0.00 H ATOM 98175 H2 WAT 7124 43.369 26.324 144.557 1.00 0.00 H TER 98177 WAT 7124 ATOM 98177 O WAT 7125 61.857 91.357 9.220 1.00 0.00 O ATOM 98178 H1 WAT 7125 61.642 91.283 8.290 1.00 0.00 H ATOM 98179 H2 WAT 7125 61.836 90.457 9.543 1.00 0.00 H TER 98181 WAT 7125 ATOM 98181 O WAT 7126 81.478 137.482 115.381 1.00 0.00 O ATOM 98182 H1 WAT 7126 82.138 137.631 114.703 1.00 0.00 H ATOM 98183 H2 WAT 7126 81.162 136.594 115.216 1.00 0.00 H TER 98185 WAT 7126 ATOM 98185 O WAT 7127 30.544 115.134 91.597 1.00 0.00 O ATOM 98186 H1 WAT 7127 30.064 114.947 90.790 1.00 0.00 H ATOM 98187 H2 WAT 7127 29.927 114.923 92.297 1.00 0.00 H TER 98189 WAT 7127 ATOM 98189 O WAT 7128 91.827 100.259 71.884 1.00 0.00 O ATOM 98190 H1 WAT 7128 91.041 99.998 71.404 1.00 0.00 H ATOM 98191 H2 WAT 7128 92.530 100.214 71.236 1.00 0.00 H TER 98193 WAT 7128 ATOM 98193 O WAT 7129 99.885 22.088 17.199 1.00 0.00 O ATOM 98194 H1 WAT 7129 100.709 22.504 17.453 1.00 0.00 H ATOM 98195 H2 WAT 7129 99.728 22.394 16.305 1.00 0.00 H TER 98197 WAT 7129 ATOM 98197 O WAT 7130 102.167 54.979 148.198 1.00 0.00 O ATOM 98198 H1 WAT 7130 101.634 55.537 147.631 1.00 0.00 H ATOM 98199 H2 WAT 7130 102.578 54.354 147.602 1.00 0.00 H TER 98201 WAT 7130 ATOM 98201 O WAT 7131 116.714 97.178 136.600 1.00 0.00 O ATOM 98202 H1 WAT 7131 117.459 97.763 136.459 1.00 0.00 H ATOM 98203 H2 WAT 7131 116.554 97.215 137.543 1.00 0.00 H TER 98205 WAT 7131 ATOM 98205 O WAT 7132 84.679 136.189 13.103 1.00 0.00 O ATOM 98206 H1 WAT 7132 84.031 135.698 12.597 1.00 0.00 H ATOM 98207 H2 WAT 7132 85.523 135.912 12.744 1.00 0.00 H TER 98209 WAT 7132 ATOM 98209 O WAT 7133 131.669 42.516 54.913 1.00 0.00 O ATOM 98210 H1 WAT 7133 132.242 41.877 55.337 1.00 0.00 H ATOM 98211 H2 WAT 7133 130.799 42.327 55.265 1.00 0.00 H TER 98213 WAT 7133 ATOM 98213 O WAT 7134 3.509 69.131 113.830 1.00 0.00 O ATOM 98214 H1 WAT 7134 4.060 69.447 113.114 1.00 0.00 H ATOM 98215 H2 WAT 7134 3.985 69.374 114.624 1.00 0.00 H TER 98217 WAT 7134 ATOM 98217 O WAT 7135 77.638 98.230 88.580 1.00 0.00 O ATOM 98218 H1 WAT 7135 78.190 98.339 87.806 1.00 0.00 H ATOM 98219 H2 WAT 7135 77.423 97.298 88.592 1.00 0.00 H TER 98221 WAT 7135 ATOM 98221 O WAT 7136 118.929 71.073 117.167 1.00 0.00 O ATOM 98222 H1 WAT 7136 119.463 71.785 117.519 1.00 0.00 H ATOM 98223 H2 WAT 7136 118.183 71.015 117.764 1.00 0.00 H TER 98225 WAT 7136 ATOM 98225 O WAT 7137 109.358 117.999 11.889 1.00 0.00 O ATOM 98226 H1 WAT 7137 108.792 117.920 12.657 1.00 0.00 H ATOM 98227 H2 WAT 7137 109.550 117.095 11.639 1.00 0.00 H TER 98229 WAT 7137 ATOM 98229 O WAT 7138 7.840 33.393 84.371 1.00 0.00 O ATOM 98230 H1 WAT 7138 7.626 32.603 83.876 1.00 0.00 H ATOM 98231 H2 WAT 7138 8.534 33.119 84.971 1.00 0.00 H TER 98233 WAT 7138 ATOM 98233 O WAT 7139 32.414 34.577 81.540 1.00 0.00 O ATOM 98234 H1 WAT 7139 31.686 34.431 82.144 1.00 0.00 H ATOM 98235 H2 WAT 7139 31.998 34.875 80.731 1.00 0.00 H TER 98237 WAT 7139 ATOM 98237 O WAT 7140 13.770 53.331 119.596 1.00 0.00 O ATOM 98238 H1 WAT 7140 13.053 53.418 118.968 1.00 0.00 H ATOM 98239 H2 WAT 7140 13.576 53.980 120.272 1.00 0.00 H TER 98241 WAT 7140 ATOM 98241 O WAT 7141 29.098 91.766 1.443 1.00 0.00 O ATOM 98242 H1 WAT 7141 29.610 92.512 1.755 1.00 0.00 H ATOM 98243 H2 WAT 7141 28.188 92.015 1.605 1.00 0.00 H TER 98245 WAT 7141 ATOM 98245 O WAT 7142 11.099 57.263 117.830 1.00 0.00 O ATOM 98246 H1 WAT 7142 10.388 56.895 117.306 1.00 0.00 H ATOM 98247 H2 WAT 7142 11.223 58.145 117.480 1.00 0.00 H TER 98249 WAT 7142 ATOM 98249 O WAT 7143 30.803 31.019 92.663 1.00 0.00 O ATOM 98250 H1 WAT 7143 30.551 30.796 91.767 1.00 0.00 H ATOM 98251 H2 WAT 7143 31.407 30.322 92.922 1.00 0.00 H TER 98253 WAT 7143 ATOM 98253 O WAT 7144 25.748 40.110 150.145 1.00 0.00 O ATOM 98254 H1 WAT 7144 25.491 40.338 149.252 1.00 0.00 H ATOM 98255 H2 WAT 7144 26.303 39.337 150.044 1.00 0.00 H TER 98257 WAT 7144 ATOM 98257 O WAT 7145 133.355 10.441 143.018 1.00 0.00 O ATOM 98258 H1 WAT 7145 134.230 10.143 142.768 1.00 0.00 H ATOM 98259 H2 WAT 7145 132.868 10.471 142.195 1.00 0.00 H TER 98261 WAT 7145 ATOM 98261 O WAT 7146 42.762 145.808 70.900 1.00 0.00 O ATOM 98262 H1 WAT 7146 42.110 145.661 70.215 1.00 0.00 H ATOM 98263 H2 WAT 7146 43.582 145.488 70.523 1.00 0.00 H TER 98265 WAT 7146 ATOM 98265 O WAT 7147 77.135 84.718 17.945 1.00 0.00 O ATOM 98266 H1 WAT 7147 76.464 84.557 18.608 1.00 0.00 H ATOM 98267 H2 WAT 7147 77.324 85.653 18.017 1.00 0.00 H TER 98269 WAT 7147 ATOM 98269 O WAT 7148 58.093 41.317 158.938 1.00 0.00 O ATOM 98270 H1 WAT 7148 58.577 41.323 158.112 1.00 0.00 H ATOM 98271 H2 WAT 7148 57.244 41.703 158.721 1.00 0.00 H TER 98273 WAT 7148 ATOM 98273 O WAT 7149 33.590 144.460 10.391 1.00 0.00 O ATOM 98274 H1 WAT 7149 34.311 143.876 10.629 1.00 0.00 H ATOM 98275 H2 WAT 7149 33.287 144.132 9.544 1.00 0.00 H TER 98277 WAT 7149 ATOM 98277 O WAT 7150 87.494 54.533 156.761 1.00 0.00 O ATOM 98278 H1 WAT 7150 87.706 55.433 156.514 1.00 0.00 H ATOM 98279 H2 WAT 7150 86.654 54.600 157.214 1.00 0.00 H TER 98281 WAT 7150 ATOM 98281 O WAT 7151 141.889 20.659 114.439 1.00 0.00 O ATOM 98282 H1 WAT 7151 142.579 21.009 115.004 1.00 0.00 H ATOM 98283 H2 WAT 7151 141.494 19.955 114.952 1.00 0.00 H TER 98285 WAT 7151 ATOM 98285 O WAT 7152 141.096 0.755 21.292 1.00 0.00 O ATOM 98286 H1 WAT 7152 140.209 0.806 20.937 1.00 0.00 H ATOM 98287 H2 WAT 7152 141.512 1.571 21.016 1.00 0.00 H TER 98289 WAT 7152 ATOM 98289 O WAT 7153 117.017 117.042 65.187 1.00 0.00 O ATOM 98290 H1 WAT 7153 117.144 116.371 64.516 1.00 0.00 H ATOM 98291 H2 WAT 7153 117.902 117.255 65.484 1.00 0.00 H TER 98293 WAT 7153 ATOM 98293 O WAT 7154 57.071 76.676 123.194 1.00 0.00 O ATOM 98294 H1 WAT 7154 57.761 76.284 122.658 1.00 0.00 H ATOM 98295 H2 WAT 7154 57.054 76.143 123.989 1.00 0.00 H TER 98297 WAT 7154 ATOM 98297 O WAT 7155 127.112 126.793 158.725 1.00 0.00 O ATOM 98298 H1 WAT 7155 126.335 127.352 158.734 1.00 0.00 H ATOM 98299 H2 WAT 7155 127.685 127.190 158.070 1.00 0.00 H TER 98301 WAT 7155 ATOM 98301 O WAT 7156 144.724 92.710 120.961 1.00 0.00 O ATOM 98302 H1 WAT 7156 145.200 92.101 121.526 1.00 0.00 H ATOM 98303 H2 WAT 7156 144.641 92.247 120.127 1.00 0.00 H TER 98305 WAT 7156 ATOM 98305 O WAT 7157 62.413 62.775 1.728 1.00 0.00 O ATOM 98306 H1 WAT 7157 62.763 63.189 0.939 1.00 0.00 H ATOM 98307 H2 WAT 7157 62.426 61.838 1.533 1.00 0.00 H TER 98309 WAT 7157 ATOM 98309 O WAT 7158 17.090 47.093 91.854 1.00 0.00 O ATOM 98310 H1 WAT 7158 17.411 46.283 91.458 1.00 0.00 H ATOM 98311 H2 WAT 7158 16.974 47.691 91.115 1.00 0.00 H TER 98313 WAT 7158 ATOM 98313 O WAT 7159 82.664 115.913 88.905 1.00 0.00 O ATOM 98314 H1 WAT 7159 82.618 116.760 88.461 1.00 0.00 H ATOM 98315 H2 WAT 7159 81.769 115.578 88.875 1.00 0.00 H TER 98317 WAT 7159 ATOM 98317 O WAT 7160 70.973 2.150 121.538 1.00 0.00 O ATOM 98318 H1 WAT 7160 70.451 2.752 121.007 1.00 0.00 H ATOM 98319 H2 WAT 7160 71.007 1.344 121.024 1.00 0.00 H TER 98321 WAT 7160 ATOM 98321 O WAT 7161 11.802 137.924 0.343 1.00 0.00 O ATOM 98322 H1 WAT 7161 11.902 137.342 -0.411 1.00 0.00 H ATOM 98323 H2 WAT 7161 10.906 137.774 0.644 1.00 0.00 H TER 98325 WAT 7161 ATOM 98325 O WAT 7162 3.381 36.264 98.801 1.00 0.00 O ATOM 98326 H1 WAT 7162 3.912 35.668 99.330 1.00 0.00 H ATOM 98327 H2 WAT 7162 2.906 36.793 99.442 1.00 0.00 H TER 98329 WAT 7162 ATOM 98329 O WAT 7163 34.646 100.012 111.395 1.00 0.00 O ATOM 98330 H1 WAT 7163 34.776 99.190 111.868 1.00 0.00 H ATOM 98331 H2 WAT 7163 33.739 100.254 111.581 1.00 0.00 H TER 98333 WAT 7163 ATOM 98333 O WAT 7164 79.025 3.588 56.004 1.00 0.00 O ATOM 98334 H1 WAT 7164 78.266 4.103 56.278 1.00 0.00 H ATOM 98335 H2 WAT 7164 78.935 3.515 55.054 1.00 0.00 H TER 98337 WAT 7164 ATOM 98337 O WAT 7165 99.353 132.269 83.011 1.00 0.00 O ATOM 98338 H1 WAT 7165 99.189 131.415 82.611 1.00 0.00 H ATOM 98339 H2 WAT 7165 98.661 132.832 82.664 1.00 0.00 H TER 98341 WAT 7165 ATOM 98341 O WAT 7166 97.967 4.173 61.151 1.00 0.00 O ATOM 98342 H1 WAT 7166 97.566 3.394 60.764 1.00 0.00 H ATOM 98343 H2 WAT 7166 97.949 4.825 60.450 1.00 0.00 H TER 98345 WAT 7166 ATOM 98345 O WAT 7167 49.014 94.317 111.272 1.00 0.00 O ATOM 98346 H1 WAT 7167 49.205 94.289 112.210 1.00 0.00 H ATOM 98347 H2 WAT 7167 48.692 95.205 111.119 1.00 0.00 H TER 98349 WAT 7167 ATOM 98349 O WAT 7168 53.778 127.375 84.052 1.00 0.00 O ATOM 98350 H1 WAT 7168 54.494 127.443 83.421 1.00 0.00 H ATOM 98351 H2 WAT 7168 52.984 127.443 83.521 1.00 0.00 H TER 98353 WAT 7168 ATOM 98353 O WAT 7169 133.262 12.093 145.451 1.00 0.00 O ATOM 98354 H1 WAT 7169 133.565 11.433 146.074 1.00 0.00 H ATOM 98355 H2 WAT 7169 133.181 11.620 144.622 1.00 0.00 H TER 98357 WAT 7169 ATOM 98357 O WAT 7170 125.746 110.761 100.652 1.00 0.00 O ATOM 98358 H1 WAT 7170 125.904 110.798 99.709 1.00 0.00 H ATOM 98359 H2 WAT 7170 125.393 109.884 100.802 1.00 0.00 H TER 98361 WAT 7170 ATOM 98361 O WAT 7171 42.507 79.340 14.475 1.00 0.00 O ATOM 98362 H1 WAT 7171 42.839 78.446 14.556 1.00 0.00 H ATOM 98363 H2 WAT 7171 41.579 79.233 14.267 1.00 0.00 H TER 98365 WAT 7171 ATOM 98365 O WAT 7172 88.992 68.370 0.516 1.00 0.00 O ATOM 98366 H1 WAT 7172 89.091 68.403 -0.435 1.00 0.00 H ATOM 98367 H2 WAT 7172 88.051 68.262 0.656 1.00 0.00 H TER 98369 WAT 7172 ATOM 98369 O WAT 7173 24.205 84.834 131.135 1.00 0.00 O ATOM 98370 H1 WAT 7173 24.413 85.744 130.926 1.00 0.00 H ATOM 98371 H2 WAT 7173 23.356 84.681 130.721 1.00 0.00 H TER 98373 WAT 7173 ATOM 98373 O WAT 7174 11.767 99.224 144.118 1.00 0.00 O ATOM 98374 H1 WAT 7174 10.862 99.007 144.342 1.00 0.00 H ATOM 98375 H2 WAT 7174 11.759 100.170 143.975 1.00 0.00 H TER 98377 WAT 7174 ATOM 98377 O WAT 7175 17.944 79.838 84.364 1.00 0.00 O ATOM 98378 H1 WAT 7175 18.495 80.620 84.346 1.00 0.00 H ATOM 98379 H2 WAT 7175 18.360 79.238 83.744 1.00 0.00 H TER 98381 WAT 7175 ATOM 98381 O WAT 7176 102.406 72.344 93.738 1.00 0.00 O ATOM 98382 H1 WAT 7176 102.309 73.115 93.180 1.00 0.00 H ATOM 98383 H2 WAT 7176 103.315 72.071 93.614 1.00 0.00 H TER 98385 WAT 7176 ATOM 98385 O WAT 7177 82.794 31.802 16.013 1.00 0.00 O ATOM 98386 H1 WAT 7177 83.168 31.683 16.886 1.00 0.00 H ATOM 98387 H2 WAT 7177 82.454 30.938 15.778 1.00 0.00 H TER 98389 WAT 7177 ATOM 98389 O WAT 7178 51.599 61.369 0.455 1.00 0.00 O ATOM 98390 H1 WAT 7178 50.806 61.469 -0.071 1.00 0.00 H ATOM 98391 H2 WAT 7178 51.362 60.729 1.126 1.00 0.00 H TER 98393 WAT 7178 ATOM 98393 O WAT 7179 127.496 93.310 24.674 1.00 0.00 O ATOM 98394 H1 WAT 7179 127.528 93.590 25.589 1.00 0.00 H ATOM 98395 H2 WAT 7179 127.981 93.985 24.199 1.00 0.00 H TER 98397 WAT 7179 ATOM 98397 O WAT 7180 95.903 96.900 105.317 1.00 0.00 O ATOM 98398 H1 WAT 7180 96.752 97.326 105.198 1.00 0.00 H ATOM 98399 H2 WAT 7180 95.421 97.099 104.514 1.00 0.00 H TER 98401 WAT 7180 ATOM 98401 O WAT 7181 64.004 78.989 11.398 1.00 0.00 O ATOM 98402 H1 WAT 7181 63.592 78.951 10.535 1.00 0.00 H ATOM 98403 H2 WAT 7181 64.161 78.074 11.629 1.00 0.00 H TER 98405 WAT 7181 ATOM 98405 O WAT 7182 122.811 101.035 73.403 1.00 0.00 O ATOM 98406 H1 WAT 7182 123.672 101.345 73.682 1.00 0.00 H ATOM 98407 H2 WAT 7182 122.347 101.827 73.133 1.00 0.00 H TER 98409 WAT 7182 ATOM 98409 O WAT 7183 138.567 59.064 153.945 1.00 0.00 O ATOM 98410 H1 WAT 7183 139.192 58.378 154.179 1.00 0.00 H ATOM 98411 H2 WAT 7183 138.888 59.406 153.111 1.00 0.00 H TER 98413 WAT 7183 ATOM 98413 O WAT 7184 62.509 112.345 89.976 1.00 0.00 O ATOM 98414 H1 WAT 7184 63.463 112.279 90.023 1.00 0.00 H ATOM 98415 H2 WAT 7184 62.204 111.438 90.003 1.00 0.00 H TER 98417 WAT 7184 ATOM 98417 O WAT 7185 105.560 32.430 91.477 1.00 0.00 O ATOM 98418 H1 WAT 7185 105.713 32.607 92.405 1.00 0.00 H ATOM 98419 H2 WAT 7185 105.822 33.236 91.033 1.00 0.00 H TER 98421 WAT 7185 ATOM 98421 O WAT 7186 19.988 84.555 74.087 1.00 0.00 O ATOM 98422 H1 WAT 7186 19.998 83.633 73.830 1.00 0.00 H ATOM 98423 H2 WAT 7186 19.675 85.017 73.310 1.00 0.00 H TER 98425 WAT 7186 ATOM 98425 O WAT 7187 97.454 135.524 157.695 1.00 0.00 O ATOM 98426 H1 WAT 7187 98.223 135.137 157.276 1.00 0.00 H ATOM 98427 H2 WAT 7187 97.541 135.287 158.618 1.00 0.00 H TER 98429 WAT 7187 ATOM 98429 O WAT 7188 139.776 91.366 70.221 1.00 0.00 O ATOM 98430 H1 WAT 7188 139.320 92.173 70.458 1.00 0.00 H ATOM 98431 H2 WAT 7188 140.439 91.256 70.902 1.00 0.00 H TER 98433 WAT 7188 ATOM 98433 O WAT 7189 25.914 87.384 143.676 1.00 0.00 O ATOM 98434 H1 WAT 7189 25.094 87.452 143.187 1.00 0.00 H ATOM 98435 H2 WAT 7189 26.358 88.216 143.514 1.00 0.00 H TER 98437 WAT 7189 ATOM 98437 O WAT 7190 71.690 116.478 70.869 1.00 0.00 O ATOM 98438 H1 WAT 7190 72.115 116.877 70.110 1.00 0.00 H ATOM 98439 H2 WAT 7190 72.209 115.695 71.051 1.00 0.00 H TER 98441 WAT 7190 ATOM 98441 O WAT 7191 70.511 120.211 150.696 1.00 0.00 O ATOM 98442 H1 WAT 7191 69.970 120.009 151.460 1.00 0.00 H ATOM 98443 H2 WAT 7191 70.584 121.165 150.700 1.00 0.00 H TER 98445 WAT 7191 ATOM 98445 O WAT 7192 132.854 138.718 144.964 1.00 0.00 O ATOM 98446 H1 WAT 7192 131.945 138.891 144.721 1.00 0.00 H ATOM 98447 H2 WAT 7192 132.794 138.101 145.694 1.00 0.00 H TER 98449 WAT 7192 ATOM 98449 O WAT 7193 81.265 133.696 145.957 1.00 0.00 O ATOM 98450 H1 WAT 7193 81.624 133.103 146.616 1.00 0.00 H ATOM 98451 H2 WAT 7193 81.438 133.261 145.122 1.00 0.00 H TER 98453 WAT 7193 ATOM 98453 O WAT 7194 65.477 111.268 111.027 1.00 0.00 O ATOM 98454 H1 WAT 7194 66.387 111.301 111.321 1.00 0.00 H ATOM 98455 H2 WAT 7194 65.528 111.374 110.077 1.00 0.00 H TER 98457 WAT 7194 ATOM 98457 O WAT 7195 37.211 6.093 10.004 1.00 0.00 O ATOM 98458 H1 WAT 7195 36.972 6.945 9.638 1.00 0.00 H ATOM 98459 H2 WAT 7195 38.153 6.024 9.855 1.00 0.00 H TER 98461 WAT 7195 ATOM 98461 O WAT 7196 145.345 129.532 145.391 1.00 0.00 O ATOM 98462 H1 WAT 7196 145.209 129.181 144.511 1.00 0.00 H ATOM 98463 H2 WAT 7196 144.743 129.033 145.944 1.00 0.00 H TER 98465 WAT 7196 ATOM 98465 O WAT 7197 86.442 5.377 115.371 1.00 0.00 O ATOM 98466 H1 WAT 7197 86.684 5.135 116.265 1.00 0.00 H ATOM 98467 H2 WAT 7197 86.400 6.333 115.385 1.00 0.00 H TER 98469 WAT 7197 ATOM 98469 O WAT 7198 139.419 10.208 125.290 1.00 0.00 O ATOM 98470 H1 WAT 7198 138.617 10.398 125.777 1.00 0.00 H ATOM 98471 H2 WAT 7198 139.685 11.053 124.928 1.00 0.00 H TER 98473 WAT 7198 ATOM 98473 O WAT 7199 68.750 90.274 86.245 1.00 0.00 O ATOM 98474 H1 WAT 7199 68.316 89.793 85.540 1.00 0.00 H ATOM 98475 H2 WAT 7199 69.300 89.620 86.677 1.00 0.00 H TER 98477 WAT 7199 ATOM 98477 O WAT 7200 16.467 103.674 125.381 1.00 0.00 O ATOM 98478 H1 WAT 7200 17.269 103.486 124.894 1.00 0.00 H ATOM 98479 H2 WAT 7200 16.685 104.437 125.916 1.00 0.00 H TER 98481 WAT 7200 ATOM 98481 O WAT 7201 111.985 66.826 8.265 1.00 0.00 O ATOM 98482 H1 WAT 7201 111.058 66.767 8.034 1.00 0.00 H ATOM 98483 H2 WAT 7201 112.447 66.712 7.434 1.00 0.00 H TER 98485 WAT 7201 ATOM 98485 O WAT 7202 21.631 80.564 105.938 1.00 0.00 O ATOM 98486 H1 WAT 7202 21.555 80.741 105.001 1.00 0.00 H ATOM 98487 H2 WAT 7202 22.289 79.871 105.999 1.00 0.00 H TER 98489 WAT 7202 ATOM 98489 O WAT 7203 68.008 65.963 92.043 1.00 0.00 O ATOM 98490 H1 WAT 7203 68.837 65.523 92.230 1.00 0.00 H ATOM 98491 H2 WAT 7203 68.098 66.271 91.141 1.00 0.00 H TER 98493 WAT 7203 ATOM 98493 O WAT 7204 37.072 111.667 114.285 1.00 0.00 O ATOM 98494 H1 WAT 7204 37.257 112.606 114.309 1.00 0.00 H ATOM 98495 H2 WAT 7204 37.287 111.403 113.390 1.00 0.00 H TER 98497 WAT 7204 ATOM 98497 O WAT 7205 87.908 24.644 60.843 1.00 0.00 O ATOM 98498 H1 WAT 7205 88.651 24.183 60.454 1.00 0.00 H ATOM 98499 H2 WAT 7205 88.111 24.680 61.778 1.00 0.00 H TER 98501 WAT 7205 ATOM 98501 O WAT 7206 108.864 93.505 4.151 1.00 0.00 O ATOM 98502 H1 WAT 7206 109.495 92.788 4.096 1.00 0.00 H ATOM 98503 H2 WAT 7206 108.074 93.102 4.511 1.00 0.00 H TER 98505 WAT 7206 ATOM 98505 O WAT 7207 53.764 135.206 10.077 1.00 0.00 O ATOM 98506 H1 WAT 7207 53.635 135.477 9.168 1.00 0.00 H ATOM 98507 H2 WAT 7207 53.157 134.475 10.197 1.00 0.00 H TER 98509 WAT 7207 ATOM 98509 O WAT 7208 143.297 22.896 123.346 1.00 0.00 O ATOM 98510 H1 WAT 7208 142.893 22.602 124.162 1.00 0.00 H ATOM 98511 H2 WAT 7208 143.918 22.203 123.122 1.00 0.00 H TER 98513 WAT 7208 ATOM 98513 O WAT 7209 59.628 116.494 83.514 1.00 0.00 O ATOM 98514 H1 WAT 7209 59.866 117.392 83.283 1.00 0.00 H ATOM 98515 H2 WAT 7209 59.780 116.441 84.457 1.00 0.00 H TER 98517 WAT 7209 ATOM 98517 O WAT 7210 19.416 123.301 106.020 1.00 0.00 O ATOM 98518 H1 WAT 7210 19.951 123.292 105.226 1.00 0.00 H ATOM 98519 H2 WAT 7210 18.535 123.516 105.713 1.00 0.00 H TER 98521 WAT 7210 ATOM 98521 O WAT 7211 46.664 26.660 72.001 1.00 0.00 O ATOM 98522 H1 WAT 7211 46.323 27.550 71.910 1.00 0.00 H ATOM 98523 H2 WAT 7211 45.954 26.174 72.422 1.00 0.00 H TER 98525 WAT 7211 ATOM 98525 O WAT 7212 63.294 130.397 9.935 1.00 0.00 O ATOM 98526 H1 WAT 7212 62.898 131.254 10.095 1.00 0.00 H ATOM 98527 H2 WAT 7212 64.187 130.594 9.654 1.00 0.00 H TER 98529 WAT 7212 ATOM 98529 O WAT 7213 31.091 18.761 102.633 1.00 0.00 O ATOM 98530 H1 WAT 7213 31.583 19.389 102.103 1.00 0.00 H ATOM 98531 H2 WAT 7213 31.262 17.914 102.221 1.00 0.00 H TER 98533 WAT 7213 ATOM 98533 O WAT 7214 135.521 78.245 74.672 1.00 0.00 O ATOM 98534 H1 WAT 7214 135.408 78.913 73.996 1.00 0.00 H ATOM 98535 H2 WAT 7214 136.439 77.985 74.601 1.00 0.00 H TER 98537 WAT 7214 ATOM 98537 O WAT 7215 55.330 117.866 137.096 1.00 0.00 O ATOM 98538 H1 WAT 7215 55.738 117.123 137.541 1.00 0.00 H ATOM 98539 H2 WAT 7215 56.060 118.443 136.874 1.00 0.00 H TER 98541 WAT 7215 ATOM 98541 O WAT 7216 23.568 132.910 100.958 1.00 0.00 O ATOM 98542 H1 WAT 7216 24.130 133.416 100.371 1.00 0.00 H ATOM 98543 H2 WAT 7216 22.941 133.548 101.298 1.00 0.00 H TER 98545 WAT 7216 ATOM 98545 O WAT 7217 29.384 37.405 21.559 1.00 0.00 O ATOM 98546 H1 WAT 7217 28.721 36.723 21.456 1.00 0.00 H ATOM 98547 H2 WAT 7217 30.135 36.952 21.944 1.00 0.00 H TER 98549 WAT 7217 ATOM 98549 O WAT 7218 21.572 15.635 90.157 1.00 0.00 O ATOM 98550 H1 WAT 7218 21.494 15.668 91.111 1.00 0.00 H ATOM 98551 H2 WAT 7218 21.251 14.764 89.921 1.00 0.00 H TER 98553 WAT 7218 ATOM 98553 O WAT 7219 113.992 131.802 124.425 1.00 0.00 O ATOM 98554 H1 WAT 7219 114.101 131.271 123.636 1.00 0.00 H ATOM 98555 H2 WAT 7219 113.446 132.537 124.145 1.00 0.00 H TER 98557 WAT 7219 ATOM 98557 O WAT 7220 31.502 0.389 151.010 1.00 0.00 O ATOM 98558 H1 WAT 7220 32.044 -0.250 150.547 1.00 0.00 H ATOM 98559 H2 WAT 7220 30.615 0.034 150.956 1.00 0.00 H TER 98561 WAT 7220 ATOM 98561 O WAT 7221 3.539 129.681 126.649 1.00 0.00 O ATOM 98562 H1 WAT 7221 3.819 130.409 127.204 1.00 0.00 H ATOM 98563 H2 WAT 7221 3.118 130.100 125.899 1.00 0.00 H TER 98565 WAT 7221 ATOM 98565 O WAT 7222 10.664 17.380 109.800 1.00 0.00 O ATOM 98566 H1 WAT 7222 11.106 17.605 110.618 1.00 0.00 H ATOM 98567 H2 WAT 7222 10.989 18.021 109.168 1.00 0.00 H TER 98569 WAT 7222 ATOM 98569 O WAT 7223 15.642 87.000 0.596 1.00 0.00 O ATOM 98570 H1 WAT 7223 15.637 86.976 1.552 1.00 0.00 H ATOM 98571 H2 WAT 7223 16.409 87.528 0.373 1.00 0.00 H TER 98573 WAT 7223 ATOM 98573 O WAT 7224 23.779 115.684 126.936 1.00 0.00 O ATOM 98574 H1 WAT 7224 22.927 115.754 127.367 1.00 0.00 H ATOM 98575 H2 WAT 7224 24.213 116.516 127.127 1.00 0.00 H TER 98577 WAT 7224 ATOM 98577 O WAT 7225 94.442 0.719 136.996 1.00 0.00 O ATOM 98578 H1 WAT 7225 94.257 -0.187 136.748 1.00 0.00 H ATOM 98579 H2 WAT 7225 93.833 1.240 136.472 1.00 0.00 H TER 98581 WAT 7225 ATOM 98581 O WAT 7226 25.400 75.723 149.954 1.00 0.00 O ATOM 98582 H1 WAT 7226 26.084 76.233 149.521 1.00 0.00 H ATOM 98583 H2 WAT 7226 24.635 76.299 149.953 1.00 0.00 H TER 98585 WAT 7226 ATOM 98585 O WAT 7227 116.224 142.692 101.245 1.00 0.00 O ATOM 98586 H1 WAT 7227 115.520 142.344 100.697 1.00 0.00 H ATOM 98587 H2 WAT 7227 115.827 142.791 102.110 1.00 0.00 H TER 98589 WAT 7227 ATOM 98589 O WAT 7228 9.278 75.170 153.329 1.00 0.00 O ATOM 98590 H1 WAT 7228 9.384 76.104 153.507 1.00 0.00 H ATOM 98591 H2 WAT 7228 8.475 74.928 153.790 1.00 0.00 H TER 98593 WAT 7228 ATOM 98593 O WAT 7229 67.798 19.887 123.593 1.00 0.00 O ATOM 98594 H1 WAT 7229 67.540 19.433 122.791 1.00 0.00 H ATOM 98595 H2 WAT 7229 67.004 20.339 123.878 1.00 0.00 H TER 98597 WAT 7229 ATOM 98597 O WAT 7230 3.775 0.550 13.680 1.00 0.00 O ATOM 98598 H1 WAT 7230 4.449 0.673 14.348 1.00 0.00 H ATOM 98599 H2 WAT 7230 4.161 0.908 12.881 1.00 0.00 H TER 98601 WAT 7230 ATOM 98601 O WAT 7231 65.294 99.571 155.950 1.00 0.00 O ATOM 98602 H1 WAT 7231 65.159 100.199 156.659 1.00 0.00 H ATOM 98603 H2 WAT 7231 64.460 99.108 155.878 1.00 0.00 H TER 98605 WAT 7231 ATOM 98605 O WAT 7232 90.820 40.626 124.755 1.00 0.00 O ATOM 98606 H1 WAT 7232 90.958 40.033 125.494 1.00 0.00 H ATOM 98607 H2 WAT 7232 91.230 41.447 125.028 1.00 0.00 H TER 98609 WAT 7232 ATOM 98609 O WAT 7233 34.879 124.066 130.999 1.00 0.00 O ATOM 98610 H1 WAT 7233 35.639 124.042 131.581 1.00 0.00 H ATOM 98611 H2 WAT 7233 35.239 124.302 130.144 1.00 0.00 H TER 98613 WAT 7233 ATOM 98613 O WAT 7234 138.764 133.876 156.917 1.00 0.00 O ATOM 98614 H1 WAT 7234 137.947 134.172 156.516 1.00 0.00 H ATOM 98615 H2 WAT 7234 139.004 133.094 156.421 1.00 0.00 H TER 98617 WAT 7234 ATOM 98617 O WAT 7235 59.427 80.373 14.487 1.00 0.00 O ATOM 98618 H1 WAT 7235 60.058 79.697 14.240 1.00 0.00 H ATOM 98619 H2 WAT 7235 58.654 80.186 13.954 1.00 0.00 H TER 98621 WAT 7235 ATOM 98621 O WAT 7236 -0.194 93.574 87.844 1.00 0.00 O ATOM 98622 H1 WAT 7236 0.696 93.552 87.491 1.00 0.00 H ATOM 98623 H2 WAT 7236 -0.214 94.357 88.394 1.00 0.00 H TER 98625 WAT 7236 ATOM 98625 O WAT 7237 37.893 33.123 126.728 1.00 0.00 O ATOM 98626 H1 WAT 7237 38.525 32.488 126.391 1.00 0.00 H ATOM 98627 H2 WAT 7237 38.360 33.958 126.709 1.00 0.00 H TER 98629 WAT 7237 ATOM 98629 O WAT 7238 107.160 41.144 23.192 1.00 0.00 O ATOM 98630 H1 WAT 7238 106.445 40.942 23.796 1.00 0.00 H ATOM 98631 H2 WAT 7238 107.154 42.099 23.124 1.00 0.00 H TER 98633 WAT 7238 ATOM 98633 O WAT 7239 88.519 144.059 134.232 1.00 0.00 O ATOM 98634 H1 WAT 7239 88.268 143.260 134.695 1.00 0.00 H ATOM 98635 H2 WAT 7239 87.999 144.749 134.646 1.00 0.00 H TER 98637 WAT 7239 ATOM 98637 O WAT 7240 40.666 27.686 103.553 1.00 0.00 O ATOM 98638 H1 WAT 7240 40.747 27.960 102.639 1.00 0.00 H ATOM 98639 H2 WAT 7240 40.027 28.291 103.929 1.00 0.00 H TER 98641 WAT 7240 ATOM 98641 O WAT 7241 47.137 65.636 147.753 1.00 0.00 O ATOM 98642 H1 WAT 7241 47.765 65.055 148.182 1.00 0.00 H ATOM 98643 H2 WAT 7241 47.661 66.138 147.130 1.00 0.00 H TER 98645 WAT 7241 ATOM 98645 O WAT 7242 79.868 11.502 107.512 1.00 0.00 O ATOM 98646 H1 WAT 7242 79.685 10.591 107.742 1.00 0.00 H ATOM 98647 H2 WAT 7242 79.069 11.806 107.081 1.00 0.00 H TER 98649 WAT 7242 ATOM 98649 O WAT 7243 33.498 62.753 75.025 1.00 0.00 O ATOM 98650 H1 WAT 7243 32.771 62.725 74.404 1.00 0.00 H ATOM 98651 H2 WAT 7243 33.608 63.683 75.224 1.00 0.00 H TER 98653 WAT 7243 ATOM 98653 O WAT 7244 25.265 122.110 94.424 1.00 0.00 O ATOM 98654 H1 WAT 7244 25.687 121.254 94.487 1.00 0.00 H ATOM 98655 H2 WAT 7244 25.198 122.411 95.331 1.00 0.00 H TER 98657 WAT 7244 ATOM 98657 O WAT 7245 4.177 75.172 69.408 1.00 0.00 O ATOM 98658 H1 WAT 7245 4.215 75.586 68.546 1.00 0.00 H ATOM 98659 H2 WAT 7245 4.591 75.804 69.996 1.00 0.00 H TER 98661 WAT 7245 ATOM 98661 O WAT 7246 18.684 53.838 72.075 1.00 0.00 O ATOM 98662 H1 WAT 7246 17.956 53.309 72.401 1.00 0.00 H ATOM 98663 H2 WAT 7246 18.264 54.571 71.624 1.00 0.00 H TER 98665 WAT 7246 ATOM 98665 O WAT 7247 79.740 112.153 23.253 1.00 0.00 O ATOM 98666 H1 WAT 7247 79.662 111.288 23.654 1.00 0.00 H ATOM 98667 H2 WAT 7247 80.167 112.689 23.921 1.00 0.00 H TER 98669 WAT 7247 ATOM 98669 O WAT 7248 45.566 77.360 10.291 1.00 0.00 O ATOM 98670 H1 WAT 7248 45.739 76.796 9.537 1.00 0.00 H ATOM 98671 H2 WAT 7248 44.615 77.327 10.401 1.00 0.00 H TER 98673 WAT 7248 ATOM 98673 O WAT 7249 68.570 64.646 84.866 1.00 0.00 O ATOM 98674 H1 WAT 7249 68.481 65.573 84.643 1.00 0.00 H ATOM 98675 H2 WAT 7249 69.428 64.582 85.285 1.00 0.00 H TER 98677 WAT 7249 ATOM 98677 O WAT 7250 71.162 145.755 54.445 1.00 0.00 O ATOM 98678 H1 WAT 7250 70.495 145.198 54.845 1.00 0.00 H ATOM 98679 H2 WAT 7250 71.850 145.147 54.173 1.00 0.00 H TER 98681 WAT 7250 ATOM 98681 O WAT 7251 108.511 42.427 76.710 1.00 0.00 O ATOM 98682 H1 WAT 7251 108.335 43.107 77.361 1.00 0.00 H ATOM 98683 H2 WAT 7251 107.988 42.682 75.950 1.00 0.00 H TER 98685 WAT 7251 ATOM 98685 O WAT 7252 20.974 77.653 73.761 1.00 0.00 O ATOM 98686 H1 WAT 7252 20.955 76.721 73.978 1.00 0.00 H ATOM 98687 H2 WAT 7252 20.535 77.710 72.912 1.00 0.00 H TER 98689 WAT 7252 ATOM 98689 O WAT 7253 44.541 120.273 5.027 1.00 0.00 O ATOM 98690 H1 WAT 7253 44.479 119.319 4.978 1.00 0.00 H ATOM 98691 H2 WAT 7253 45.426 120.471 4.719 1.00 0.00 H TER 98693 WAT 7253 ATOM 98693 O WAT 7254 6.114 101.523 148.193 1.00 0.00 O ATOM 98694 H1 WAT 7254 5.233 101.832 148.402 1.00 0.00 H ATOM 98695 H2 WAT 7254 6.651 102.315 148.183 1.00 0.00 H TER 98697 WAT 7254 ATOM 98697 O WAT 7255 3.238 112.795 93.186 1.00 0.00 O ATOM 98698 H1 WAT 7255 3.452 112.475 92.309 1.00 0.00 H ATOM 98699 H2 WAT 7255 4.086 112.886 93.621 1.00 0.00 H TER 98701 WAT 7255 ATOM 98701 O WAT 7256 24.549 17.737 18.083 1.00 0.00 O ATOM 98702 H1 WAT 7256 25.256 17.656 18.723 1.00 0.00 H ATOM 98703 H2 WAT 7256 23.767 17.902 18.610 1.00 0.00 H TER 98705 WAT 7256 ATOM 98705 O WAT 7257 30.030 70.822 117.010 1.00 0.00 O ATOM 98706 H1 WAT 7257 29.685 71.652 117.338 1.00 0.00 H ATOM 98707 H2 WAT 7257 30.763 71.072 116.448 1.00 0.00 H TER 98709 WAT 7257 ATOM 98709 O WAT 7258 104.043 108.175 114.952 1.00 0.00 O ATOM 98710 H1 WAT 7258 103.797 107.680 115.734 1.00 0.00 H ATOM 98711 H2 WAT 7258 104.101 107.516 114.260 1.00 0.00 H TER 98713 WAT 7258 ATOM 98713 O WAT 7259 71.060 116.432 115.547 1.00 0.00 O ATOM 98714 H1 WAT 7259 70.261 115.914 115.647 1.00 0.00 H ATOM 98715 H2 WAT 7259 70.907 116.958 114.762 1.00 0.00 H TER 98717 WAT 7259 ATOM 98717 O WAT 7260 72.246 22.685 152.897 1.00 0.00 O ATOM 98718 H1 WAT 7260 71.810 22.801 153.741 1.00 0.00 H ATOM 98719 H2 WAT 7260 72.655 23.533 152.720 1.00 0.00 H TER 98721 WAT 7260 ATOM 98721 O WAT 7261 97.880 115.780 93.638 1.00 0.00 O ATOM 98722 H1 WAT 7261 98.097 115.926 92.717 1.00 0.00 H ATOM 98723 H2 WAT 7261 98.433 115.043 93.900 1.00 0.00 H TER 98725 WAT 7261 ATOM 98725 O WAT 7262 106.488 71.027 155.335 1.00 0.00 O ATOM 98726 H1 WAT 7262 106.338 70.763 154.427 1.00 0.00 H ATOM 98727 H2 WAT 7262 107.440 71.084 155.415 1.00 0.00 H TER 98729 WAT 7262 ATOM 98729 O WAT 7263 68.101 25.352 84.225 1.00 0.00 O ATOM 98730 H1 WAT 7263 68.727 25.733 84.841 1.00 0.00 H ATOM 98731 H2 WAT 7263 68.528 24.554 83.913 1.00 0.00 H TER 98733 WAT 7263 ATOM 98733 O WAT 7264 94.719 117.774 94.811 1.00 0.00 O ATOM 98734 H1 WAT 7264 95.301 117.693 95.566 1.00 0.00 H ATOM 98735 H2 WAT 7264 95.095 118.486 94.293 1.00 0.00 H TER 98737 WAT 7264 ATOM 98737 O WAT 7265 111.640 100.148 152.226 1.00 0.00 O ATOM 98738 H1 WAT 7265 112.093 100.804 152.757 1.00 0.00 H ATOM 98739 H2 WAT 7265 110.712 100.283 152.419 1.00 0.00 H TER 98741 WAT 7265 ATOM 98741 O WAT 7266 43.842 53.076 66.930 1.00 0.00 O ATOM 98742 H1 WAT 7266 43.174 52.397 67.022 1.00 0.00 H ATOM 98743 H2 WAT 7266 44.425 52.941 67.677 1.00 0.00 H TER 98745 WAT 7266 ATOM 98745 O WAT 7267 42.561 10.993 72.593 1.00 0.00 O ATOM 98746 H1 WAT 7267 42.763 11.563 71.851 1.00 0.00 H ATOM 98747 H2 WAT 7267 42.801 11.508 73.364 1.00 0.00 H TER 98749 WAT 7267 ATOM 98749 O WAT 7268 5.614 87.952 72.927 1.00 0.00 O ATOM 98750 H1 WAT 7268 6.407 87.453 73.123 1.00 0.00 H ATOM 98751 H2 WAT 7268 5.592 88.001 71.972 1.00 0.00 H TER 98753 WAT 7268 ATOM 98753 O WAT 7269 120.059 144.516 133.182 1.00 0.00 O ATOM 98754 H1 WAT 7269 120.763 143.950 133.499 1.00 0.00 H ATOM 98755 H2 WAT 7269 119.264 143.996 133.297 1.00 0.00 H TER 98757 WAT 7269 ATOM 98757 O WAT 7270 140.727 144.492 152.476 1.00 0.00 O ATOM 98758 H1 WAT 7270 140.448 144.300 151.580 1.00 0.00 H ATOM 98759 H2 WAT 7270 140.763 145.448 152.515 1.00 0.00 H TER 98761 WAT 7270 ATOM 98761 O WAT 7271 16.221 25.355 157.245 1.00 0.00 O ATOM 98762 H1 WAT 7271 16.850 25.676 156.600 1.00 0.00 H ATOM 98763 H2 WAT 7271 15.422 25.852 157.069 1.00 0.00 H TER 98765 WAT 7271 ATOM 98765 O WAT 7272 35.619 72.687 84.649 1.00 0.00 O ATOM 98766 H1 WAT 7272 35.408 71.858 84.219 1.00 0.00 H ATOM 98767 H2 WAT 7272 34.826 73.214 84.554 1.00 0.00 H TER 98769 WAT 7272 ATOM 98769 O WAT 7273 4.110 97.258 67.300 1.00 0.00 O ATOM 98770 H1 WAT 7273 3.677 96.434 67.076 1.00 0.00 H ATOM 98771 H2 WAT 7273 4.646 97.462 66.535 1.00 0.00 H TER 98773 WAT 7273 ATOM 98773 O WAT 7274 92.678 68.608 72.121 1.00 0.00 O ATOM 98774 H1 WAT 7274 92.362 68.451 73.011 1.00 0.00 H ATOM 98775 H2 WAT 7274 92.975 67.751 71.818 1.00 0.00 H TER 98777 WAT 7274 ATOM 98777 O WAT 7275 106.079 123.456 18.254 1.00 0.00 O ATOM 98778 H1 WAT 7275 106.143 123.063 19.125 1.00 0.00 H ATOM 98779 H2 WAT 7275 105.476 124.191 18.367 1.00 0.00 H TER 98781 WAT 7275 ATOM 98781 O WAT 7276 2.606 39.593 9.361 1.00 0.00 O ATOM 98782 H1 WAT 7276 3.169 38.828 9.246 1.00 0.00 H ATOM 98783 H2 WAT 7276 1.769 39.335 8.974 1.00 0.00 H TER 98785 WAT 7276 ATOM 98785 O WAT 7277 106.968 103.235 7.094 1.00 0.00 O ATOM 98786 H1 WAT 7277 106.144 103.530 6.706 1.00 0.00 H ATOM 98787 H2 WAT 7277 106.906 102.280 7.091 1.00 0.00 H TER 98789 WAT 7277 ATOM 98789 O WAT 7278 54.412 101.510 98.178 1.00 0.00 O ATOM 98790 H1 WAT 7278 53.989 101.086 97.432 1.00 0.00 H ATOM 98791 H2 WAT 7278 54.102 101.020 98.940 1.00 0.00 H TER 98793 WAT 7278 ATOM 98793 O WAT 7279 71.553 125.115 86.095 1.00 0.00 O ATOM 98794 H1 WAT 7279 71.685 125.998 85.749 1.00 0.00 H ATOM 98795 H2 WAT 7279 71.235 124.610 85.347 1.00 0.00 H TER 98797 WAT 7279 ATOM 98797 O WAT 7280 113.474 31.273 123.646 1.00 0.00 O ATOM 98798 H1 WAT 7280 113.825 30.788 124.393 1.00 0.00 H ATOM 98799 H2 WAT 7280 114.224 31.390 123.063 1.00 0.00 H TER 98801 WAT 7280 ATOM 98801 O WAT 7281 136.799 82.238 23.243 1.00 0.00 O ATOM 98802 H1 WAT 7281 137.686 82.102 23.578 1.00 0.00 H ATOM 98803 H2 WAT 7281 136.240 81.732 23.833 1.00 0.00 H TER 98805 WAT 7281 ATOM 98805 O WAT 7282 130.803 129.429 122.443 1.00 0.00 O ATOM 98806 H1 WAT 7282 130.662 130.041 123.166 1.00 0.00 H ATOM 98807 H2 WAT 7282 129.954 129.007 122.318 1.00 0.00 H TER 98809 WAT 7282 ATOM 98809 O WAT 7283 87.556 144.195 96.042 1.00 0.00 O ATOM 98810 H1 WAT 7283 87.338 144.899 95.432 1.00 0.00 H ATOM 98811 H2 WAT 7283 88.490 144.038 95.902 1.00 0.00 H TER 98813 WAT 7283 ATOM 98813 O WAT 7284 137.118 133.597 71.384 1.00 0.00 O ATOM 98814 H1 WAT 7284 137.421 132.894 71.959 1.00 0.00 H ATOM 98815 H2 WAT 7284 137.523 133.407 70.538 1.00 0.00 H TER 98817 WAT 7284 ATOM 98817 O WAT 7285 96.933 86.898 120.343 1.00 0.00 O ATOM 98818 H1 WAT 7285 97.194 87.379 119.558 1.00 0.00 H ATOM 98819 H2 WAT 7285 96.035 87.183 120.511 1.00 0.00 H TER 98821 WAT 7285 ATOM 98821 O WAT 7286 68.338 74.580 69.995 1.00 0.00 O ATOM 98822 H1 WAT 7286 67.437 74.283 70.127 1.00 0.00 H ATOM 98823 H2 WAT 7286 68.833 73.777 69.835 1.00 0.00 H TER 98825 WAT 7286 ATOM 98825 O WAT 7287 12.582 121.073 17.983 1.00 0.00 O ATOM 98826 H1 WAT 7287 13.426 121.184 18.420 1.00 0.00 H ATOM 98827 H2 WAT 7287 12.805 120.764 17.105 1.00 0.00 H TER 98829 WAT 7287 ATOM 98829 O WAT 7288 39.347 107.892 95.836 1.00 0.00 O ATOM 98830 H1 WAT 7288 39.779 108.662 95.466 1.00 0.00 H ATOM 98831 H2 WAT 7288 38.530 108.230 96.203 1.00 0.00 H TER 98833 WAT 7288 ATOM 98833 O WAT 7289 69.850 128.901 71.699 1.00 0.00 O ATOM 98834 H1 WAT 7289 70.760 129.094 71.923 1.00 0.00 H ATOM 98835 H2 WAT 7289 69.669 129.452 70.937 1.00 0.00 H TER 98837 WAT 7289 ATOM 98837 O WAT 7290 23.387 97.132 95.325 1.00 0.00 O ATOM 98838 H1 WAT 7290 22.866 97.824 94.917 1.00 0.00 H ATOM 98839 H2 WAT 7290 24.294 97.418 95.212 1.00 0.00 H TER 98841 WAT 7290 ATOM 98841 O WAT 7291 52.143 105.298 65.890 1.00 0.00 O ATOM 98842 H1 WAT 7291 51.356 105.096 65.384 1.00 0.00 H ATOM 98843 H2 WAT 7291 51.869 105.216 66.803 1.00 0.00 H TER 98845 WAT 7291 ATOM 98845 O WAT 7292 53.665 123.920 74.368 1.00 0.00 O ATOM 98846 H1 WAT 7292 53.353 123.126 74.802 1.00 0.00 H ATOM 98847 H2 WAT 7292 54.596 123.759 74.215 1.00 0.00 H TER 98849 WAT 7292 ATOM 98849 O WAT 7293 10.980 144.221 18.686 1.00 0.00 O ATOM 98850 H1 WAT 7293 11.197 144.607 19.535 1.00 0.00 H ATOM 98851 H2 WAT 7293 11.149 143.285 18.799 1.00 0.00 H TER 98853 WAT 7293 ATOM 98853 O WAT 7294 111.126 9.276 122.828 1.00 0.00 O ATOM 98854 H1 WAT 7294 110.377 9.762 123.174 1.00 0.00 H ATOM 98855 H2 WAT 7294 110.738 8.521 122.385 1.00 0.00 H TER 98857 WAT 7294 ATOM 98857 O WAT 7295 119.692 121.821 124.532 1.00 0.00 O ATOM 98858 H1 WAT 7295 119.915 121.558 125.425 1.00 0.00 H ATOM 98859 H2 WAT 7295 119.215 121.072 124.174 1.00 0.00 H TER 98861 WAT 7295 ATOM 98861 O WAT 7296 30.946 143.854 108.579 1.00 0.00 O ATOM 98862 H1 WAT 7296 30.404 143.068 108.648 1.00 0.00 H ATOM 98863 H2 WAT 7296 30.358 144.572 108.815 1.00 0.00 H TER 98865 WAT 7296 ATOM 98865 O WAT 7297 141.696 127.051 5.700 1.00 0.00 O ATOM 98866 H1 WAT 7297 141.393 127.087 6.608 1.00 0.00 H ATOM 98867 H2 WAT 7297 142.649 127.123 5.763 1.00 0.00 H TER 98869 WAT 7297 ATOM 98869 O WAT 7298 137.751 76.074 77.775 1.00 0.00 O ATOM 98870 H1 WAT 7298 137.722 75.669 78.642 1.00 0.00 H ATOM 98871 H2 WAT 7298 138.054 76.967 77.937 1.00 0.00 H TER 98873 WAT 7298 ATOM 98873 O WAT 7299 67.280 12.603 157.150 1.00 0.00 O ATOM 98874 H1 WAT 7299 68.235 12.555 157.107 1.00 0.00 H ATOM 98875 H2 WAT 7299 67.021 12.988 156.314 1.00 0.00 H TER 98877 WAT 7299 ATOM 98877 O WAT 7300 28.542 103.225 125.276 1.00 0.00 O ATOM 98878 H1 WAT 7300 28.689 103.135 126.218 1.00 0.00 H ATOM 98879 H2 WAT 7300 27.636 103.526 125.203 1.00 0.00 H TER 98881 WAT 7300 ATOM 98881 O WAT 7301 66.342 135.407 157.614 1.00 0.00 O ATOM 98882 H1 WAT 7301 66.644 136.007 158.295 1.00 0.00 H ATOM 98883 H2 WAT 7301 67.068 135.366 156.991 1.00 0.00 H TER 98885 WAT 7301 ATOM 98885 O WAT 7302 50.993 119.078 120.873 1.00 0.00 O ATOM 98886 H1 WAT 7302 51.349 119.467 121.671 1.00 0.00 H ATOM 98887 H2 WAT 7302 50.120 118.775 121.123 1.00 0.00 H TER 98889 WAT 7302 ATOM 98889 O WAT 7303 66.947 96.703 133.569 1.00 0.00 O ATOM 98890 H1 WAT 7303 66.722 95.982 134.158 1.00 0.00 H ATOM 98891 H2 WAT 7303 66.148 97.227 133.516 1.00 0.00 H TER 98893 WAT 7303 ATOM 98893 O WAT 7304 26.888 95.476 69.381 1.00 0.00 O ATOM 98894 H1 WAT 7304 27.265 96.335 69.190 1.00 0.00 H ATOM 98895 H2 WAT 7304 27.328 94.881 68.774 1.00 0.00 H TER 98897 WAT 7304 ATOM 98897 O WAT 7305 14.546 10.828 155.136 1.00 0.00 O ATOM 98898 H1 WAT 7305 14.185 11.383 154.444 1.00 0.00 H ATOM 98899 H2 WAT 7305 14.489 11.364 155.927 1.00 0.00 H TER 98901 WAT 7305 ATOM 98901 O WAT 7306 60.105 131.510 53.235 1.00 0.00 O ATOM 98902 H1 WAT 7306 60.293 130.601 53.002 1.00 0.00 H ATOM 98903 H2 WAT 7306 60.966 131.908 53.364 1.00 0.00 H TER 98905 WAT 7306 ATOM 98905 O WAT 7307 99.764 14.671 137.931 1.00 0.00 O ATOM 98906 H1 WAT 7307 99.366 14.115 138.601 1.00 0.00 H ATOM 98907 H2 WAT 7307 99.384 15.536 138.080 1.00 0.00 H TER 98909 WAT 7307 ATOM 98909 O WAT 7308 96.098 80.205 14.803 1.00 0.00 O ATOM 98910 H1 WAT 7308 95.332 79.777 15.186 1.00 0.00 H ATOM 98911 H2 WAT 7308 95.745 80.977 14.362 1.00 0.00 H TER 98913 WAT 7308 ATOM 98913 O WAT 7309 95.723 21.287 151.283 1.00 0.00 O ATOM 98914 H1 WAT 7309 95.155 21.145 152.041 1.00 0.00 H ATOM 98915 H2 WAT 7309 95.637 20.486 150.766 1.00 0.00 H TER 98917 WAT 7309 ATOM 98917 O WAT 7310 109.446 100.738 22.641 1.00 0.00 O ATOM 98918 H1 WAT 7310 109.800 101.400 22.047 1.00 0.00 H ATOM 98919 H2 WAT 7310 110.181 100.509 23.209 1.00 0.00 H TER 98921 WAT 7310 ATOM 98921 O WAT 7311 13.435 67.031 148.615 1.00 0.00 O ATOM 98922 H1 WAT 7311 13.953 67.580 149.203 1.00 0.00 H ATOM 98923 H2 WAT 7311 14.078 66.469 148.182 1.00 0.00 H TER 98925 WAT 7311 ATOM 98925 O WAT 7312 133.797 145.417 84.419 1.00 0.00 O ATOM 98926 H1 WAT 7312 132.976 145.496 84.904 1.00 0.00 H ATOM 98927 H2 WAT 7312 134.185 146.291 84.461 1.00 0.00 H TER 98929 WAT 7312 ATOM 98929 O WAT 7313 117.943 100.126 9.261 1.00 0.00 O ATOM 98930 H1 WAT 7313 118.667 99.725 8.781 1.00 0.00 H ATOM 98931 H2 WAT 7313 118.341 100.864 9.722 1.00 0.00 H TER 98933 WAT 7313 ATOM 98933 O WAT 7314 32.093 107.149 93.039 1.00 0.00 O ATOM 98934 H1 WAT 7314 31.736 108.035 93.097 1.00 0.00 H ATOM 98935 H2 WAT 7314 32.921 107.193 93.518 1.00 0.00 H TER 98937 WAT 7314 ATOM 98937 O WAT 7315 107.229 138.250 108.737 1.00 0.00 O ATOM 98938 H1 WAT 7315 108.052 138.718 108.598 1.00 0.00 H ATOM 98939 H2 WAT 7315 106.715 138.830 109.298 1.00 0.00 H TER 98941 WAT 7315 ATOM 98941 O WAT 7316 82.708 111.285 78.354 1.00 0.00 O ATOM 98942 H1 WAT 7316 82.310 110.705 79.004 1.00 0.00 H ATOM 98943 H2 WAT 7316 83.575 110.909 78.197 1.00 0.00 H TER 98945 WAT 7316 ATOM 98945 O WAT 7317 27.356 46.781 78.941 1.00 0.00 O ATOM 98946 H1 WAT 7317 27.033 46.219 79.646 1.00 0.00 H ATOM 98947 H2 WAT 7317 28.057 47.292 79.345 1.00 0.00 H TER 98949 WAT 7317 ATOM 98949 O WAT 7318 133.751 54.467 0.707 1.00 0.00 O ATOM 98950 H1 WAT 7318 134.550 53.975 0.893 1.00 0.00 H ATOM 98951 H2 WAT 7318 133.141 54.202 1.395 1.00 0.00 H TER 98953 WAT 7318 ATOM 98953 O WAT 7319 43.093 15.103 71.847 1.00 0.00 O ATOM 98954 H1 WAT 7319 43.489 15.636 71.158 1.00 0.00 H ATOM 98955 H2 WAT 7319 42.383 15.645 72.191 1.00 0.00 H TER 98957 WAT 7319 ATOM 98957 O WAT 7320 15.729 113.456 60.165 1.00 0.00 O ATOM 98958 H1 WAT 7320 15.509 114.255 59.684 1.00 0.00 H ATOM 98959 H2 WAT 7320 15.058 112.826 59.901 1.00 0.00 H TER 98961 WAT 7320 ATOM 98961 O WAT 7321 3.879 124.122 3.529 1.00 0.00 O ATOM 98962 H1 WAT 7321 4.321 124.288 2.697 1.00 0.00 H ATOM 98963 H2 WAT 7321 4.578 123.849 4.122 1.00 0.00 H TER 98965 WAT 7321 ATOM 98965 O WAT 7322 10.440 109.257 77.727 1.00 0.00 O ATOM 98966 H1 WAT 7322 9.819 109.602 78.368 1.00 0.00 H ATOM 98967 H2 WAT 7322 10.158 108.354 77.580 1.00 0.00 H TER 98969 WAT 7322 ATOM 98969 O WAT 7323 17.738 125.259 14.597 1.00 0.00 O ATOM 98970 H1 WAT 7323 17.568 124.938 13.712 1.00 0.00 H ATOM 98971 H2 WAT 7323 16.913 125.124 15.063 1.00 0.00 H TER 98973 WAT 7323 ATOM 98973 O WAT 7324 120.677 7.408 95.414 1.00 0.00 O ATOM 98974 H1 WAT 7324 121.032 7.644 96.271 1.00 0.00 H ATOM 98975 H2 WAT 7324 121.394 6.950 94.975 1.00 0.00 H TER 98977 WAT 7324 ATOM 98977 O WAT 7325 139.834 137.789 107.428 1.00 0.00 O ATOM 98978 H1 WAT 7325 139.411 137.563 108.257 1.00 0.00 H ATOM 98979 H2 WAT 7325 140.768 137.654 107.591 1.00 0.00 H TER 98981 WAT 7325 ATOM 98981 O WAT 7326 70.964 108.207 146.457 1.00 0.00 O ATOM 98982 H1 WAT 7326 71.246 109.078 146.737 1.00 0.00 H ATOM 98983 H2 WAT 7326 71.496 107.604 146.976 1.00 0.00 H TER 98985 WAT 7326 ATOM 98985 O WAT 7327 122.325 143.121 65.833 1.00 0.00 O ATOM 98986 H1 WAT 7327 122.612 143.866 66.360 1.00 0.00 H ATOM 98987 H2 WAT 7327 122.956 143.078 65.115 1.00 0.00 H TER 98989 WAT 7327 ATOM 98989 O WAT 7328 140.606 120.567 86.004 1.00 0.00 O ATOM 98990 H1 WAT 7328 140.238 119.695 85.861 1.00 0.00 H ATOM 98991 H2 WAT 7328 140.804 120.891 85.126 1.00 0.00 H TER 98993 WAT 7328 ATOM 98993 O WAT 7329 15.486 52.814 89.854 1.00 0.00 O ATOM 98994 H1 WAT 7329 14.926 53.353 89.295 1.00 0.00 H ATOM 98995 H2 WAT 7329 14.916 52.542 90.573 1.00 0.00 H TER 98997 WAT 7329 ATOM 98997 O WAT 7330 110.370 77.158 18.629 1.00 0.00 O ATOM 98998 H1 WAT 7330 110.302 77.766 17.892 1.00 0.00 H ATOM 98999 H2 WAT 7330 110.336 77.718 19.405 1.00 0.00 H TER 99001 WAT 7330 ATOM 99001 O WAT 7331 99.805 15.028 97.748 1.00 0.00 O ATOM 99002 H1 WAT 7331 99.369 15.674 98.304 1.00 0.00 H ATOM 99003 H2 WAT 7331 100.319 14.497 98.357 1.00 0.00 H TER 99005 WAT 7331 ATOM 99005 O WAT 7332 32.150 11.570 124.910 1.00 0.00 O ATOM 99006 H1 WAT 7332 32.983 11.181 124.643 1.00 0.00 H ATOM 99007 H2 WAT 7332 31.757 10.919 125.491 1.00 0.00 H TER 99009 WAT 7332 ATOM 99009 O WAT 7333 93.806 50.766 157.438 1.00 0.00 O ATOM 99010 H1 WAT 7333 93.801 49.865 157.115 1.00 0.00 H ATOM 99011 H2 WAT 7333 92.917 51.083 157.279 1.00 0.00 H TER 99013 WAT 7333 ATOM 99013 O WAT 7334 66.013 108.750 56.063 1.00 0.00 O ATOM 99014 H1 WAT 7334 66.325 108.738 55.158 1.00 0.00 H ATOM 99015 H2 WAT 7334 65.093 108.489 56.002 1.00 0.00 H TER 99017 WAT 7334 ATOM 99017 O WAT 7335 144.001 49.228 93.225 1.00 0.00 O ATOM 99018 H1 WAT 7335 143.079 49.481 93.253 1.00 0.00 H ATOM 99019 H2 WAT 7335 144.002 48.299 93.455 1.00 0.00 H TER 99021 WAT 7335 ATOM 99021 O WAT 7336 5.215 128.436 124.466 1.00 0.00 O ATOM 99022 H1 WAT 7336 5.755 127.778 124.904 1.00 0.00 H ATOM 99023 H2 WAT 7336 4.882 128.983 125.177 1.00 0.00 H TER 99025 WAT 7336 ATOM 99025 O WAT 7337 51.154 106.152 14.860 1.00 0.00 O ATOM 99026 H1 WAT 7337 52.019 106.462 15.126 1.00 0.00 H ATOM 99027 H2 WAT 7337 50.962 105.432 15.461 1.00 0.00 H TER 99029 WAT 7337 ATOM 99029 O WAT 7338 84.802 113.353 78.999 1.00 0.00 O ATOM 99030 H1 WAT 7338 84.694 112.528 79.472 1.00 0.00 H ATOM 99031 H2 WAT 7338 85.613 113.241 78.504 1.00 0.00 H TER 99033 WAT 7338 ATOM 99033 O WAT 7339 56.336 128.004 20.286 1.00 0.00 O ATOM 99034 H1 WAT 7339 56.957 128.613 20.685 1.00 0.00 H ATOM 99035 H2 WAT 7339 56.037 127.457 21.011 1.00 0.00 H TER 99037 WAT 7339 ATOM 99037 O WAT 7340 134.460 127.440 143.352 1.00 0.00 O ATOM 99038 H1 WAT 7340 133.529 127.652 143.283 1.00 0.00 H ATOM 99039 H2 WAT 7340 134.524 126.892 144.134 1.00 0.00 H TER 99041 WAT 7340 ATOM 99041 O WAT 7341 66.006 40.461 67.192 1.00 0.00 O ATOM 99042 H1 WAT 7341 65.237 40.963 67.462 1.00 0.00 H ATOM 99043 H2 WAT 7341 66.505 41.064 66.642 1.00 0.00 H TER 99045 WAT 7341 ATOM 99045 O WAT 7342 75.902 102.779 142.623 1.00 0.00 O ATOM 99046 H1 WAT 7342 76.210 103.005 141.745 1.00 0.00 H ATOM 99047 H2 WAT 7342 76.103 103.550 143.153 1.00 0.00 H TER 99049 WAT 7342 ATOM 99049 O WAT 7343 8.988 63.451 9.313 1.00 0.00 O ATOM 99050 H1 WAT 7343 9.008 62.813 8.600 1.00 0.00 H ATOM 99051 H2 WAT 7343 8.621 62.971 10.054 1.00 0.00 H TER 99053 WAT 7343 ATOM 99053 O WAT 7344 5.285 104.239 23.851 1.00 0.00 O ATOM 99054 H1 WAT 7344 6.124 103.783 23.789 1.00 0.00 H ATOM 99055 H2 WAT 7344 4.947 104.241 22.956 1.00 0.00 H TER 99057 WAT 7344 ATOM 99057 O WAT 7345 132.755 15.126 144.704 1.00 0.00 O ATOM 99058 H1 WAT 7345 132.682 14.904 143.776 1.00 0.00 H ATOM 99059 H2 WAT 7345 132.925 14.290 145.138 1.00 0.00 H TER 99061 WAT 7345 ATOM 99061 O WAT 7346 115.560 49.792 150.524 1.00 0.00 O ATOM 99062 H1 WAT 7346 114.899 49.421 151.109 1.00 0.00 H ATOM 99063 H2 WAT 7346 115.302 49.495 149.652 1.00 0.00 H TER 99065 WAT 7346 ATOM 99065 O WAT 7347 110.377 95.072 15.386 1.00 0.00 O ATOM 99066 H1 WAT 7347 110.009 94.573 16.115 1.00 0.00 H ATOM 99067 H2 WAT 7347 111.001 94.473 14.976 1.00 0.00 H TER 99069 WAT 7347 ATOM 99069 O WAT 7348 59.720 92.460 70.957 1.00 0.00 O ATOM 99070 H1 WAT 7348 59.182 92.757 71.691 1.00 0.00 H ATOM 99071 H2 WAT 7348 59.120 91.954 70.409 1.00 0.00 H TER 99073 WAT 7348 ATOM 99073 O WAT 7349 9.265 141.878 87.647 1.00 0.00 O ATOM 99074 H1 WAT 7349 9.197 142.801 87.891 1.00 0.00 H ATOM 99075 H2 WAT 7349 8.591 141.442 88.168 1.00 0.00 H TER 99077 WAT 7349 ATOM 99077 O WAT 7350 21.450 119.809 9.734 1.00 0.00 O ATOM 99078 H1 WAT 7350 21.179 119.225 10.442 1.00 0.00 H ATOM 99079 H2 WAT 7350 21.346 120.689 10.096 1.00 0.00 H TER 99081 WAT 7350 ATOM 99081 O WAT 7351 129.637 80.199 127.164 1.00 0.00 O ATOM 99082 H1 WAT 7351 130.056 80.881 127.688 1.00 0.00 H ATOM 99083 H2 WAT 7351 128.708 80.430 127.169 1.00 0.00 H TER 99085 WAT 7351 ATOM 99085 O WAT 7352 66.275 68.042 152.949 1.00 0.00 O ATOM 99086 H1 WAT 7352 65.391 68.040 153.316 1.00 0.00 H ATOM 99087 H2 WAT 7352 66.628 68.902 153.178 1.00 0.00 H TER 99089 WAT 7352 ATOM 99089 O WAT 7353 56.021 12.743 128.604 1.00 0.00 O ATOM 99090 H1 WAT 7353 56.163 12.670 129.548 1.00 0.00 H ATOM 99091 H2 WAT 7353 56.165 11.857 128.271 1.00 0.00 H TER 99093 WAT 7353 ATOM 99093 O WAT 7354 28.506 93.023 4.441 1.00 0.00 O ATOM 99094 H1 WAT 7354 29.425 92.928 4.690 1.00 0.00 H ATOM 99095 H2 WAT 7354 28.142 93.624 5.091 1.00 0.00 H TER 99097 WAT 7354 ATOM 99097 O WAT 7355 81.019 34.261 138.773 1.00 0.00 O ATOM 99098 H1 WAT 7355 80.436 34.553 138.073 1.00 0.00 H ATOM 99099 H2 WAT 7355 81.185 33.338 138.577 1.00 0.00 H TER 99101 WAT 7355 ATOM 99101 O WAT 7356 3.030 1.388 107.932 1.00 0.00 O ATOM 99102 H1 WAT 7356 2.507 2.189 107.921 1.00 0.00 H ATOM 99103 H2 WAT 7356 3.655 1.520 108.645 1.00 0.00 H TER 99105 WAT 7356 ATOM 99105 O WAT 7357 66.094 102.355 11.720 1.00 0.00 O ATOM 99106 H1 WAT 7357 65.814 103.165 11.294 1.00 0.00 H ATOM 99107 H2 WAT 7357 65.533 101.678 11.341 1.00 0.00 H TER 99109 WAT 7357 ATOM 99109 O WAT 7358 100.728 2.952 101.433 1.00 0.00 O ATOM 99110 H1 WAT 7358 101.457 3.456 101.071 1.00 0.00 H ATOM 99111 H2 WAT 7358 100.102 2.885 100.712 1.00 0.00 H TER 99113 WAT 7358 ATOM 99113 O WAT 7359 114.777 48.779 109.986 1.00 0.00 O ATOM 99114 H1 WAT 7359 115.156 49.336 110.666 1.00 0.00 H ATOM 99115 H2 WAT 7359 114.776 47.901 110.369 1.00 0.00 H TER 99117 WAT 7359 ATOM 99117 O WAT 7360 27.471 12.664 108.249 1.00 0.00 O ATOM 99118 H1 WAT 7360 27.038 13.359 107.754 1.00 0.00 H ATOM 99119 H2 WAT 7360 27.912 13.120 108.966 1.00 0.00 H TER 99121 WAT 7360 ATOM 99121 O WAT 7361 13.049 115.641 154.441 1.00 0.00 O ATOM 99122 H1 WAT 7361 13.571 114.872 154.210 1.00 0.00 H ATOM 99123 H2 WAT 7361 12.297 115.607 153.850 1.00 0.00 H TER 99125 WAT 7361 ATOM 99125 O WAT 7362 125.656 141.567 83.702 1.00 0.00 O ATOM 99126 H1 WAT 7362 124.907 141.070 84.034 1.00 0.00 H ATOM 99127 H2 WAT 7362 125.743 141.287 82.790 1.00 0.00 H TER 99129 WAT 7362 ATOM 99129 O WAT 7363 94.367 114.982 118.172 1.00 0.00 O ATOM 99130 H1 WAT 7363 95.009 114.654 118.802 1.00 0.00 H ATOM 99131 H2 WAT 7363 93.529 114.919 118.630 1.00 0.00 H TER 99133 WAT 7363 ATOM 99133 O WAT 7364 134.090 50.648 131.547 1.00 0.00 O ATOM 99134 H1 WAT 7364 134.518 49.792 131.534 1.00 0.00 H ATOM 99135 H2 WAT 7364 134.146 50.958 130.643 1.00 0.00 H TER 99137 WAT 7364 ATOM 99137 O WAT 7365 7.493 68.404 69.267 1.00 0.00 O ATOM 99138 H1 WAT 7365 7.149 68.363 70.160 1.00 0.00 H ATOM 99139 H2 WAT 7365 6.787 68.056 68.723 1.00 0.00 H TER 99141 WAT 7365 ATOM 99141 O WAT 7366 23.188 113.585 117.412 1.00 0.00 O ATOM 99142 H1 WAT 7366 23.620 114.371 117.080 1.00 0.00 H ATOM 99143 H2 WAT 7366 22.273 113.842 117.522 1.00 0.00 H TER 99145 WAT 7366 ATOM 99145 O WAT 7367 63.087 96.467 72.266 1.00 0.00 O ATOM 99146 H1 WAT 7367 62.681 95.991 71.542 1.00 0.00 H ATOM 99147 H2 WAT 7367 63.919 96.780 71.910 1.00 0.00 H TER 99149 WAT 7367 ATOM 99149 O WAT 7368 47.749 30.881 111.057 1.00 0.00 O ATOM 99150 H1 WAT 7368 48.351 30.419 111.641 1.00 0.00 H ATOM 99151 H2 WAT 7368 47.400 30.199 110.484 1.00 0.00 H TER 99153 WAT 7368 ATOM 99153 O WAT 7369 102.754 106.778 83.748 1.00 0.00 O ATOM 99154 H1 WAT 7369 103.061 107.650 83.998 1.00 0.00 H ATOM 99155 H2 WAT 7369 103.517 106.362 83.346 1.00 0.00 H TER 99157 WAT 7369 ATOM 99157 O WAT 7370 38.843 33.538 73.952 1.00 0.00 O ATOM 99158 H1 WAT 7370 38.136 33.761 73.348 1.00 0.00 H ATOM 99159 H2 WAT 7370 39.605 34.009 73.613 1.00 0.00 H TER 99161 WAT 7370 ATOM 99161 O WAT 7371 42.956 50.537 125.880 1.00 0.00 O ATOM 99162 H1 WAT 7371 42.874 50.279 126.798 1.00 0.00 H ATOM 99163 H2 WAT 7371 42.842 49.721 125.392 1.00 0.00 H TER 99165 WAT 7371 ATOM 99165 O WAT 7372 50.004 36.143 10.869 1.00 0.00 O ATOM 99166 H1 WAT 7372 49.122 35.822 10.683 1.00 0.00 H ATOM 99167 H2 WAT 7372 50.533 35.351 10.965 1.00 0.00 H TER 99169 WAT 7372 ATOM 99169 O WAT 7373 71.771 120.610 67.534 1.00 0.00 O ATOM 99170 H1 WAT 7373 71.947 121.149 66.763 1.00 0.00 H ATOM 99171 H2 WAT 7373 71.083 121.081 68.004 1.00 0.00 H TER 99173 WAT 7373 ATOM 99173 O WAT 7374 142.083 106.960 67.323 1.00 0.00 O ATOM 99174 H1 WAT 7374 142.746 107.472 66.858 1.00 0.00 H ATOM 99175 H2 WAT 7374 141.271 107.451 67.198 1.00 0.00 H TER 99177 WAT 7374 ATOM 99177 O WAT 7375 66.679 60.530 83.852 1.00 0.00 O ATOM 99178 H1 WAT 7375 65.731 60.618 83.754 1.00 0.00 H ATOM 99179 H2 WAT 7375 66.899 61.112 84.579 1.00 0.00 H TER 99181 WAT 7375 ATOM 99181 O WAT 7376 107.633 67.219 70.070 1.00 0.00 O ATOM 99182 H1 WAT 7376 108.443 67.711 70.199 1.00 0.00 H ATOM 99183 H2 WAT 7376 106.983 67.883 69.842 1.00 0.00 H TER 99185 WAT 7376 ATOM 99185 O WAT 7377 1.173 39.523 65.232 1.00 0.00 O ATOM 99186 H1 WAT 7377 0.220 39.499 65.143 1.00 0.00 H ATOM 99187 H2 WAT 7377 1.418 40.406 64.956 1.00 0.00 H TER 99189 WAT 7377 ATOM 99189 O WAT 7378 132.121 57.163 78.049 1.00 0.00 O ATOM 99190 H1 WAT 7378 131.625 57.507 78.792 1.00 0.00 H ATOM 99191 H2 WAT 7378 131.457 56.776 77.478 1.00 0.00 H TER 99193 WAT 7378 ATOM 99193 O WAT 7379 20.450 32.069 66.446 1.00 0.00 O ATOM 99194 H1 WAT 7379 19.566 32.199 66.790 1.00 0.00 H ATOM 99195 H2 WAT 7379 20.364 31.340 65.832 1.00 0.00 H TER 99197 WAT 7379 ATOM 99197 O WAT 7380 79.552 136.974 83.380 1.00 0.00 O ATOM 99198 H1 WAT 7380 79.831 136.187 83.848 1.00 0.00 H ATOM 99199 H2 WAT 7380 79.473 137.642 84.060 1.00 0.00 H TER 99201 WAT 7380 ATOM 99201 O WAT 7381 17.852 125.469 139.173 1.00 0.00 O ATOM 99202 H1 WAT 7381 17.978 125.044 138.325 1.00 0.00 H ATOM 99203 H2 WAT 7381 17.660 124.751 139.775 1.00 0.00 H TER 99205 WAT 7381 ATOM 99205 O WAT 7382 25.298 122.046 57.937 1.00 0.00 O ATOM 99206 H1 WAT 7382 26.061 122.623 57.959 1.00 0.00 H ATOM 99207 H2 WAT 7382 24.712 122.448 57.296 1.00 0.00 H TER 99209 WAT 7382 ATOM 99209 O WAT 7383 51.191 6.734 61.415 1.00 0.00 O ATOM 99210 H1 WAT 7383 50.382 7.076 61.795 1.00 0.00 H ATOM 99211 H2 WAT 7383 50.899 6.103 60.757 1.00 0.00 H TER 99213 WAT 7383 ATOM 99213 O WAT 7384 111.806 42.172 129.441 1.00 0.00 O ATOM 99214 H1 WAT 7384 111.414 42.661 128.717 1.00 0.00 H ATOM 99215 H2 WAT 7384 111.555 42.662 130.224 1.00 0.00 H TER 99217 WAT 7384 ATOM 99217 O WAT 7385 112.573 53.113 134.924 1.00 0.00 O ATOM 99218 H1 WAT 7385 112.024 52.431 134.538 1.00 0.00 H ATOM 99219 H2 WAT 7385 112.349 53.905 134.436 1.00 0.00 H TER 99221 WAT 7385 ATOM 99221 O WAT 7386 73.613 82.101 16.866 1.00 0.00 O ATOM 99222 H1 WAT 7386 73.153 81.556 17.504 1.00 0.00 H ATOM 99223 H2 WAT 7386 73.611 81.582 16.062 1.00 0.00 H TER 99225 WAT 7386 ATOM 99225 O WAT 7387 30.958 105.860 114.943 1.00 0.00 O ATOM 99226 H1 WAT 7387 31.073 106.774 114.685 1.00 0.00 H ATOM 99227 H2 WAT 7387 30.666 105.903 115.854 1.00 0.00 H TER 99229 WAT 7387 ATOM 99229 O WAT 7388 50.547 121.641 119.664 1.00 0.00 O ATOM 99230 H1 WAT 7388 51.048 121.868 118.881 1.00 0.00 H ATOM 99231 H2 WAT 7388 50.682 120.699 119.770 1.00 0.00 H TER 99233 WAT 7388 ATOM 99233 O WAT 7389 94.089 35.372 24.116 1.00 0.00 O ATOM 99234 H1 WAT 7389 94.290 35.958 24.846 1.00 0.00 H ATOM 99235 H2 WAT 7389 93.220 35.646 23.823 1.00 0.00 H TER 99237 WAT 7389 ATOM 99237 O WAT 7390 115.092 69.003 110.466 1.00 0.00 O ATOM 99238 H1 WAT 7390 115.781 68.897 111.121 1.00 0.00 H ATOM 99239 H2 WAT 7390 115.542 69.357 109.699 1.00 0.00 H TER 99241 WAT 7390 ATOM 99241 O WAT 7391 86.534 27.246 70.834 1.00 0.00 O ATOM 99242 H1 WAT 7391 86.854 28.044 70.413 1.00 0.00 H ATOM 99243 H2 WAT 7391 86.311 27.518 71.725 1.00 0.00 H TER 99245 WAT 7391 ATOM 99245 O WAT 7392 139.426 116.204 72.567 1.00 0.00 O ATOM 99246 H1 WAT 7392 139.780 116.752 73.267 1.00 0.00 H ATOM 99247 H2 WAT 7392 140.134 115.593 72.360 1.00 0.00 H TER 99249 WAT 7392 ATOM 99249 O WAT 7393 89.263 128.579 111.032 1.00 0.00 O ATOM 99250 H1 WAT 7393 89.958 129.232 111.123 1.00 0.00 H ATOM 99251 H2 WAT 7393 89.554 127.843 111.571 1.00 0.00 H TER 99253 WAT 7393 ATOM 99253 O WAT 7394 84.753 33.833 95.561 1.00 0.00 O ATOM 99254 H1 WAT 7394 83.988 34.376 95.751 1.00 0.00 H ATOM 99255 H2 WAT 7394 84.388 32.985 95.306 1.00 0.00 H TER 99257 WAT 7394 ATOM 99257 O WAT 7395 17.334 130.636 134.114 1.00 0.00 O ATOM 99258 H1 WAT 7395 17.843 130.740 133.310 1.00 0.00 H ATOM 99259 H2 WAT 7395 17.263 131.522 134.469 1.00 0.00 H TER 99261 WAT 7395 ATOM 99261 O WAT 7396 78.700 117.305 94.649 1.00 0.00 O ATOM 99262 H1 WAT 7396 78.550 117.973 93.981 1.00 0.00 H ATOM 99263 H2 WAT 7396 79.597 117.008 94.495 1.00 0.00 H TER 99265 WAT 7396 ATOM 99265 O WAT 7397 100.752 39.117 149.863 1.00 0.00 O ATOM 99266 H1 WAT 7397 100.395 38.406 149.331 1.00 0.00 H ATOM 99267 H2 WAT 7397 101.456 39.486 149.329 1.00 0.00 H TER 99269 WAT 7397 ATOM 99269 O WAT 7398 108.815 18.752 55.062 1.00 0.00 O ATOM 99270 H1 WAT 7398 109.733 18.744 55.335 1.00 0.00 H ATOM 99271 H2 WAT 7398 108.850 18.850 54.110 1.00 0.00 H TER 99273 WAT 7398 ATOM 99273 O WAT 7399 15.933 30.133 142.948 1.00 0.00 O ATOM 99274 H1 WAT 7399 15.158 29.657 143.244 1.00 0.00 H ATOM 99275 H2 WAT 7399 15.754 31.046 143.174 1.00 0.00 H TER 99277 WAT 7399 ATOM 99277 O WAT 7400 143.385 47.654 83.163 1.00 0.00 O ATOM 99278 H1 WAT 7400 142.708 47.258 82.614 1.00 0.00 H ATOM 99279 H2 WAT 7400 143.726 48.378 82.638 1.00 0.00 H TER 99281 WAT 7400 ATOM 99281 O WAT 7401 36.360 137.465 118.593 1.00 0.00 O ATOM 99282 H1 WAT 7401 36.629 138.147 119.208 1.00 0.00 H ATOM 99283 H2 WAT 7401 36.705 136.654 118.967 1.00 0.00 H TER 99285 WAT 7401 ATOM 99285 O WAT 7402 30.819 136.283 86.049 1.00 0.00 O ATOM 99286 H1 WAT 7402 31.276 135.702 86.657 1.00 0.00 H ATOM 99287 H2 WAT 7402 31.438 136.996 85.889 1.00 0.00 H TER 99289 WAT 7402 ATOM 99289 O WAT 7403 48.318 85.869 4.073 1.00 0.00 O ATOM 99290 H1 WAT 7403 48.336 86.825 4.060 1.00 0.00 H ATOM 99291 H2 WAT 7403 49.218 85.609 3.876 1.00 0.00 H TER 99293 WAT 7403 ATOM 99293 O WAT 7404 69.104 21.637 93.115 1.00 0.00 O ATOM 99294 H1 WAT 7404 69.569 20.815 92.959 1.00 0.00 H ATOM 99295 H2 WAT 7404 69.196 21.789 94.056 1.00 0.00 H TER 99297 WAT 7404 ATOM 99297 O WAT 7405 30.249 145.222 4.798 1.00 0.00 O ATOM 99298 H1 WAT 7405 30.858 145.470 4.103 1.00 0.00 H ATOM 99299 H2 WAT 7405 29.394 145.517 4.484 1.00 0.00 H TER 99301 WAT 7405 ATOM 99301 O WAT 7406 16.910 44.672 96.106 1.00 0.00 O ATOM 99302 H1 WAT 7406 16.929 43.990 96.778 1.00 0.00 H ATOM 99303 H2 WAT 7406 15.992 44.939 96.062 1.00 0.00 H TER 99305 WAT 7406 ATOM 99305 O WAT 7407 70.849 66.780 3.128 1.00 0.00 O ATOM 99306 H1 WAT 7407 71.552 67.370 2.857 1.00 0.00 H ATOM 99307 H2 WAT 7407 70.647 67.045 4.025 1.00 0.00 H TER 99309 WAT 7407 ATOM 99309 O WAT 7408 42.723 139.713 110.034 1.00 0.00 O ATOM 99310 H1 WAT 7408 42.483 139.615 109.113 1.00 0.00 H ATOM 99311 H2 WAT 7408 43.514 139.183 110.133 1.00 0.00 H TER 99313 WAT 7408 ATOM 99313 O WAT 7409 38.963 88.142 119.653 1.00 0.00 O ATOM 99314 H1 WAT 7409 39.748 88.532 120.036 1.00 0.00 H ATOM 99315 H2 WAT 7409 39.294 87.469 119.059 1.00 0.00 H TER 99317 WAT 7409 ATOM 99317 O WAT 7410 13.532 44.252 142.124 1.00 0.00 O ATOM 99318 H1 WAT 7410 14.141 43.766 142.680 1.00 0.00 H ATOM 99319 H2 WAT 7410 13.092 43.578 141.605 1.00 0.00 H TER 99321 WAT 7410 ATOM 99321 O WAT 7411 50.715 95.818 120.752 1.00 0.00 O ATOM 99322 H1 WAT 7411 50.228 96.639 120.691 1.00 0.00 H ATOM 99323 H2 WAT 7411 51.595 96.080 121.021 1.00 0.00 H TER 99325 WAT 7411 ATOM 99325 O WAT 7412 101.511 65.046 90.331 1.00 0.00 O ATOM 99326 H1 WAT 7412 102.285 65.594 90.198 1.00 0.00 H ATOM 99327 H2 WAT 7412 101.832 64.299 90.836 1.00 0.00 H TER 99329 WAT 7412 ATOM 99329 O WAT 7413 99.140 97.948 140.966 1.00 0.00 O ATOM 99330 H1 WAT 7413 98.441 98.599 140.910 1.00 0.00 H ATOM 99331 H2 WAT 7413 99.490 97.895 140.076 1.00 0.00 H TER 99333 WAT 7413 ATOM 99333 O WAT 7414 130.408 10.251 111.615 1.00 0.00 O ATOM 99334 H1 WAT 7414 130.909 10.029 110.830 1.00 0.00 H ATOM 99335 H2 WAT 7414 131.073 10.457 112.273 1.00 0.00 H TER 99337 WAT 7414 ATOM 99337 O WAT 7415 101.323 73.965 135.248 1.00 0.00 O ATOM 99338 H1 WAT 7415 101.410 74.269 134.345 1.00 0.00 H ATOM 99339 H2 WAT 7415 100.427 74.198 135.494 1.00 0.00 H TER 99341 WAT 7415 ATOM 99341 O WAT 7416 123.122 36.831 129.481 1.00 0.00 O ATOM 99342 H1 WAT 7416 122.454 36.715 128.806 1.00 0.00 H ATOM 99343 H2 WAT 7416 123.583 35.992 129.507 1.00 0.00 H TER 99345 WAT 7416 ATOM 99345 O WAT 7417 77.651 67.465 111.500 1.00 0.00 O ATOM 99346 H1 WAT 7417 77.336 67.998 112.230 1.00 0.00 H ATOM 99347 H2 WAT 7417 77.984 68.100 110.866 1.00 0.00 H TER 99349 WAT 7417 ATOM 99349 O WAT 7418 13.474 20.855 20.391 1.00 0.00 O ATOM 99350 H1 WAT 7418 13.937 20.967 21.221 1.00 0.00 H ATOM 99351 H2 WAT 7418 13.508 19.913 20.223 1.00 0.00 H TER 99353 WAT 7418 ATOM 99353 O WAT 7419 1.108 127.124 87.927 1.00 0.00 O ATOM 99354 H1 WAT 7419 1.520 127.358 88.758 1.00 0.00 H ATOM 99355 H2 WAT 7419 1.291 126.190 87.823 1.00 0.00 H TER 99357 WAT 7419 ATOM 99357 O WAT 7420 143.522 144.574 64.424 1.00 0.00 O ATOM 99358 H1 WAT 7420 143.560 143.669 64.115 1.00 0.00 H ATOM 99359 H2 WAT 7420 143.582 145.101 63.627 1.00 0.00 H TER 99361 WAT 7420 ATOM 99361 O WAT 7421 93.645 89.899 117.743 1.00 0.00 O ATOM 99362 H1 WAT 7421 92.886 90.274 117.296 1.00 0.00 H ATOM 99363 H2 WAT 7421 93.666 88.986 117.455 1.00 0.00 H TER 99365 WAT 7421 ATOM 99365 O WAT 7422 77.832 35.519 81.620 1.00 0.00 O ATOM 99366 H1 WAT 7422 77.252 35.392 82.370 1.00 0.00 H ATOM 99367 H2 WAT 7422 77.305 36.008 80.989 1.00 0.00 H TER 99369 WAT 7422 ATOM 99369 O WAT 7423 145.099 41.857 104.049 1.00 0.00 O ATOM 99370 H1 WAT 7423 145.588 41.316 103.429 1.00 0.00 H ATOM 99371 H2 WAT 7423 145.603 42.668 104.108 1.00 0.00 H TER 99373 WAT 7423 ATOM 99373 O WAT 7424 74.464 115.659 156.786 1.00 0.00 O ATOM 99374 H1 WAT 7424 75.196 115.370 156.241 1.00 0.00 H ATOM 99375 H2 WAT 7424 73.787 114.997 156.649 1.00 0.00 H TER 99377 WAT 7424 ATOM 99377 O WAT 7425 35.706 24.689 113.152 1.00 0.00 O ATOM 99378 H1 WAT 7425 35.913 23.863 113.589 1.00 0.00 H ATOM 99379 H2 WAT 7425 36.507 24.916 112.679 1.00 0.00 H TER 99381 WAT 7425 ATOM 99381 O WAT 7426 10.771 100.860 68.980 1.00 0.00 O ATOM 99382 H1 WAT 7426 11.176 101.081 68.141 1.00 0.00 H ATOM 99383 H2 WAT 7426 11.419 100.310 69.421 1.00 0.00 H TER 99385 WAT 7426 ATOM 99385 O WAT 7427 129.736 0.093 1.653 1.00 0.00 O ATOM 99386 H1 WAT 7427 129.872 -0.190 2.557 1.00 0.00 H ATOM 99387 H2 WAT 7427 129.755 1.049 1.695 1.00 0.00 H TER 99389 WAT 7427 ATOM 99389 O WAT 7428 68.118 107.586 143.202 1.00 0.00 O ATOM 99390 H1 WAT 7428 68.922 107.318 143.646 1.00 0.00 H ATOM 99391 H2 WAT 7428 67.988 108.496 143.468 1.00 0.00 H TER 99393 WAT 7428 ATOM 99393 O WAT 7429 42.800 62.349 78.240 1.00 0.00 O ATOM 99394 H1 WAT 7429 42.488 62.197 79.132 1.00 0.00 H ATOM 99395 H2 WAT 7429 42.542 63.250 78.045 1.00 0.00 H TER 99397 WAT 7429 ATOM 99397 O WAT 7430 122.092 127.073 138.740 1.00 0.00 O ATOM 99398 H1 WAT 7430 122.093 126.278 138.206 1.00 0.00 H ATOM 99399 H2 WAT 7430 122.963 127.448 138.614 1.00 0.00 H TER 99401 WAT 7430 ATOM 99401 O WAT 7431 22.984 126.801 150.575 1.00 0.00 O ATOM 99402 H1 WAT 7431 23.684 126.174 150.393 1.00 0.00 H ATOM 99403 H2 WAT 7431 23.194 127.149 151.441 1.00 0.00 H TER 99405 WAT 7431 ATOM 99405 O WAT 7432 116.423 57.871 121.802 1.00 0.00 O ATOM 99406 H1 WAT 7432 117.162 58.479 121.834 1.00 0.00 H ATOM 99407 H2 WAT 7432 116.775 57.048 122.140 1.00 0.00 H TER 99409 WAT 7432 ATOM 99409 O WAT 7433 36.294 107.420 146.643 1.00 0.00 O ATOM 99410 H1 WAT 7433 36.355 106.517 146.954 1.00 0.00 H ATOM 99411 H2 WAT 7433 36.846 107.919 147.245 1.00 0.00 H TER 99413 WAT 7433 ATOM 99413 O WAT 7434 9.687 78.412 125.281 1.00 0.00 O ATOM 99414 H1 WAT 7434 10.192 77.718 124.857 1.00 0.00 H ATOM 99415 H2 WAT 7434 10.309 79.132 125.384 1.00 0.00 H TER 99417 WAT 7434 ATOM 99417 O WAT 7435 21.002 40.751 129.844 1.00 0.00 O ATOM 99418 H1 WAT 7435 21.234 40.101 129.181 1.00 0.00 H ATOM 99419 H2 WAT 7435 21.583 41.491 129.668 1.00 0.00 H TER 99421 WAT 7435 ATOM 99421 O WAT 7436 101.940 109.592 102.735 1.00 0.00 O ATOM 99422 H1 WAT 7436 101.950 108.957 103.452 1.00 0.00 H ATOM 99423 H2 WAT 7436 102.763 109.442 102.270 1.00 0.00 H TER 99425 WAT 7436 ATOM 99425 O WAT 7437 72.739 141.893 122.554 1.00 0.00 O ATOM 99426 H1 WAT 7437 73.626 142.140 122.293 1.00 0.00 H ATOM 99427 H2 WAT 7437 72.750 140.935 122.563 1.00 0.00 H TER 99429 WAT 7437 ATOM 99429 O WAT 7438 113.764 1.818 7.620 1.00 0.00 O ATOM 99430 H1 WAT 7438 113.947 1.064 8.181 1.00 0.00 H ATOM 99431 H2 WAT 7438 113.255 1.457 6.894 1.00 0.00 H TER 99433 WAT 7438 ATOM 99433 O WAT 7439 108.883 80.653 6.558 1.00 0.00 O ATOM 99434 H1 WAT 7439 109.781 80.894 6.330 1.00 0.00 H ATOM 99435 H2 WAT 7439 108.878 79.697 6.530 1.00 0.00 H TER 99437 WAT 7439 ATOM 99437 O WAT 7440 60.749 58.527 93.484 1.00 0.00 O ATOM 99438 H1 WAT 7440 60.748 57.645 93.856 1.00 0.00 H ATOM 99439 H2 WAT 7440 61.515 58.544 92.910 1.00 0.00 H TER 99441 WAT 7440 ATOM 99441 O WAT 7441 113.035 26.102 129.626 1.00 0.00 O ATOM 99442 H1 WAT 7441 112.092 25.938 129.615 1.00 0.00 H ATOM 99443 H2 WAT 7441 113.332 25.851 128.752 1.00 0.00 H TER 99445 WAT 7441 ATOM 99445 O WAT 7442 65.087 29.213 15.080 1.00 0.00 O ATOM 99446 H1 WAT 7442 65.542 28.416 14.809 1.00 0.00 H ATOM 99447 H2 WAT 7442 65.535 29.917 14.611 1.00 0.00 H TER 99449 WAT 7442 ATOM 99449 O WAT 7443 131.810 45.065 115.845 1.00 0.00 O ATOM 99450 H1 WAT 7443 131.207 45.792 116.000 1.00 0.00 H ATOM 99451 H2 WAT 7443 131.989 45.097 114.905 1.00 0.00 H TER 99453 WAT 7443 ATOM 99453 O WAT 7444 33.637 133.748 148.782 1.00 0.00 O ATOM 99454 H1 WAT 7444 33.021 133.015 148.799 1.00 0.00 H ATOM 99455 H2 WAT 7444 34.359 133.467 149.345 1.00 0.00 H TER 99457 WAT 7444 ATOM 99457 O WAT 7445 79.733 57.220 107.558 1.00 0.00 O ATOM 99458 H1 WAT 7445 80.491 57.471 108.086 1.00 0.00 H ATOM 99459 H2 WAT 7445 79.799 57.762 106.771 1.00 0.00 H TER 99461 WAT 7445 ATOM 99461 O WAT 7446 92.909 63.970 116.066 1.00 0.00 O ATOM 99462 H1 WAT 7446 92.751 64.507 116.842 1.00 0.00 H ATOM 99463 H2 WAT 7446 92.972 63.076 116.403 1.00 0.00 H TER 99465 WAT 7446 ATOM 99465 O WAT 7447 25.982 15.997 130.436 1.00 0.00 O ATOM 99466 H1 WAT 7447 26.809 15.772 130.862 1.00 0.00 H ATOM 99467 H2 WAT 7447 25.970 15.466 129.639 1.00 0.00 H TER 99469 WAT 7447 ATOM 99469 O WAT 7448 12.781 21.255 78.764 1.00 0.00 O ATOM 99470 H1 WAT 7448 12.280 21.247 79.580 1.00 0.00 H ATOM 99471 H2 WAT 7448 13.415 20.545 78.866 1.00 0.00 H TER 99473 WAT 7448 ATOM 99473 O WAT 7449 136.701 144.790 3.437 1.00 0.00 O ATOM 99474 H1 WAT 7449 137.654 144.861 3.486 1.00 0.00 H ATOM 99475 H2 WAT 7449 136.438 145.498 2.848 1.00 0.00 H TER 99477 WAT 7449 ATOM 99477 O WAT 7450 52.036 143.184 8.463 1.00 0.00 O ATOM 99478 H1 WAT 7450 52.014 142.451 7.848 1.00 0.00 H ATOM 99479 H2 WAT 7450 51.596 142.853 9.247 1.00 0.00 H TER 99481 WAT 7450 ATOM 99481 O WAT 7451 0.302 30.020 89.697 1.00 0.00 O ATOM 99482 H1 WAT 7451 -0.005 29.116 89.773 1.00 0.00 H ATOM 99483 H2 WAT 7451 1.151 29.949 89.262 1.00 0.00 H TER 99485 WAT 7451 ATOM 99485 O WAT 7452 126.743 53.987 112.293 1.00 0.00 O ATOM 99486 H1 WAT 7452 127.227 53.755 113.085 1.00 0.00 H ATOM 99487 H2 WAT 7452 127.422 54.208 111.655 1.00 0.00 H TER 99489 WAT 7452 ATOM 99489 O WAT 7453 58.749 8.344 4.753 1.00 0.00 O ATOM 99490 H1 WAT 7453 58.848 7.876 5.582 1.00 0.00 H ATOM 99491 H2 WAT 7453 59.645 8.472 4.442 1.00 0.00 H TER 99493 WAT 7453 ATOM 99493 O WAT 7454 137.047 67.559 102.554 1.00 0.00 O ATOM 99494 H1 WAT 7454 136.187 67.422 102.952 1.00 0.00 H ATOM 99495 H2 WAT 7454 137.579 66.832 102.879 1.00 0.00 H TER 99497 WAT 7454 ATOM 99497 O WAT 7455 63.719 61.620 27.506 1.00 0.00 O ATOM 99498 H1 WAT 7455 63.446 62.287 26.876 1.00 0.00 H ATOM 99499 H2 WAT 7455 64.666 61.550 27.386 1.00 0.00 H TER 99501 WAT 7455 ATOM 99501 O WAT 7456 89.808 108.960 10.648 1.00 0.00 O ATOM 99502 H1 WAT 7456 90.546 109.342 10.172 1.00 0.00 H ATOM 99503 H2 WAT 7456 90.022 109.097 11.571 1.00 0.00 H TER 99505 WAT 7456 ATOM 99505 O WAT 7457 73.238 74.577 98.092 1.00 0.00 O ATOM 99506 H1 WAT 7457 73.078 75.342 97.539 1.00 0.00 H ATOM 99507 H2 WAT 7457 74.191 74.526 98.160 1.00 0.00 H TER 99509 WAT 7457 ATOM 99509 O WAT 7458 136.641 130.234 92.970 1.00 0.00 O ATOM 99510 H1 WAT 7458 136.216 131.051 93.232 1.00 0.00 H ATOM 99511 H2 WAT 7458 135.995 129.794 92.417 1.00 0.00 H TER 99513 WAT 7458 ATOM 99513 O WAT 7459 88.164 66.233 112.903 1.00 0.00 O ATOM 99514 H1 WAT 7459 87.450 66.871 112.917 1.00 0.00 H ATOM 99515 H2 WAT 7459 88.497 66.267 112.006 1.00 0.00 H TER 99517 WAT 7459 ATOM 99517 O WAT 7460 5.619 130.707 103.254 1.00 0.00 O ATOM 99518 H1 WAT 7460 5.884 131.072 102.409 1.00 0.00 H ATOM 99519 H2 WAT 7460 6.420 130.711 103.778 1.00 0.00 H TER 99521 WAT 7460 ATOM 99521 O WAT 7461 44.745 32.023 84.551 1.00 0.00 O ATOM 99522 H1 WAT 7461 44.835 31.275 83.960 1.00 0.00 H ATOM 99523 H2 WAT 7461 44.713 32.784 83.972 1.00 0.00 H TER 99525 WAT 7461 ATOM 99525 O WAT 7462 62.267 79.673 153.744 1.00 0.00 O ATOM 99526 H1 WAT 7462 61.948 80.493 154.120 1.00 0.00 H ATOM 99527 H2 WAT 7462 61.614 79.022 154.000 1.00 0.00 H TER 99529 WAT 7462 ATOM 99529 O WAT 7463 102.184 114.887 26.823 1.00 0.00 O ATOM 99530 H1 WAT 7463 101.532 114.193 26.727 1.00 0.00 H ATOM 99531 H2 WAT 7463 101.702 115.616 27.214 1.00 0.00 H TER 99533 WAT 7463 ATOM 99533 O WAT 7464 139.920 64.042 62.899 1.00 0.00 O ATOM 99534 H1 WAT 7464 140.537 64.700 63.219 1.00 0.00 H ATOM 99535 H2 WAT 7464 139.650 64.364 62.039 1.00 0.00 H TER 99537 WAT 7464 ATOM 99537 O WAT 7465 144.324 57.666 83.730 1.00 0.00 O ATOM 99538 H1 WAT 7465 143.796 57.805 82.944 1.00 0.00 H ATOM 99539 H2 WAT 7465 145.099 58.212 83.598 1.00 0.00 H TER 99541 WAT 7465 ATOM 99541 O WAT 7466 64.430 70.541 116.762 1.00 0.00 O ATOM 99542 H1 WAT 7466 64.376 70.669 117.709 1.00 0.00 H ATOM 99543 H2 WAT 7466 64.428 71.427 116.401 1.00 0.00 H TER 99545 WAT 7466 ATOM 99545 O WAT 7467 116.821 81.238 24.282 1.00 0.00 O ATOM 99546 H1 WAT 7467 116.795 81.204 23.326 1.00 0.00 H ATOM 99547 H2 WAT 7467 117.178 82.104 24.481 1.00 0.00 H TER 99549 WAT 7467 ATOM 99549 O WAT 7468 1.066 37.699 125.168 1.00 0.00 O ATOM 99550 H1 WAT 7468 0.983 36.761 125.338 1.00 0.00 H ATOM 99551 H2 WAT 7468 0.765 38.116 125.976 1.00 0.00 H TER 99553 WAT 7468 ATOM 99553 O WAT 7469 90.924 25.496 87.536 1.00 0.00 O ATOM 99554 H1 WAT 7469 90.775 26.095 88.268 1.00 0.00 H ATOM 99555 H2 WAT 7469 91.282 26.050 86.842 1.00 0.00 H TER 99557 WAT 7469 ATOM 99557 O WAT 7470 5.842 7.685 129.393 1.00 0.00 O ATOM 99558 H1 WAT 7470 4.887 7.717 129.456 1.00 0.00 H ATOM 99559 H2 WAT 7470 6.025 6.864 128.936 1.00 0.00 H TER 99561 WAT 7470 ATOM 99561 O WAT 7471 88.376 111.668 21.082 1.00 0.00 O ATOM 99562 H1 WAT 7471 88.943 110.917 21.259 1.00 0.00 H ATOM 99563 H2 WAT 7471 87.586 111.497 21.596 1.00 0.00 H TER 99565 WAT 7471 ATOM 99565 O WAT 7472 67.270 119.266 97.965 1.00 0.00 O ATOM 99566 H1 WAT 7472 66.859 118.508 97.551 1.00 0.00 H ATOM 99567 H2 WAT 7472 68.101 118.933 98.303 1.00 0.00 H TER 99569 WAT 7472 ATOM 99569 O WAT 7473 97.964 116.012 82.551 1.00 0.00 O ATOM 99570 H1 WAT 7473 98.619 116.691 82.713 1.00 0.00 H ATOM 99571 H2 WAT 7473 98.271 115.567 81.761 1.00 0.00 H TER 99573 WAT 7473 ATOM 99573 O WAT 7474 31.221 99.552 14.147 1.00 0.00 O ATOM 99574 H1 WAT 7474 31.742 100.343 14.286 1.00 0.00 H ATOM 99575 H2 WAT 7474 31.410 99.003 14.908 1.00 0.00 H TER 99577 WAT 7474 ATOM 99577 O WAT 7475 64.058 55.157 114.688 1.00 0.00 O ATOM 99578 H1 WAT 7475 63.950 54.565 115.432 1.00 0.00 H ATOM 99579 H2 WAT 7475 64.101 54.579 113.926 1.00 0.00 H TER 99581 WAT 7475 ATOM 99581 O WAT 7476 11.658 69.274 97.152 1.00 0.00 O ATOM 99582 H1 WAT 7476 11.679 68.348 96.911 1.00 0.00 H ATOM 99583 H2 WAT 7476 11.389 69.276 98.071 1.00 0.00 H TER 99585 WAT 7476 ATOM 99585 O WAT 7477 131.402 32.808 140.001 1.00 0.00 O ATOM 99586 H1 WAT 7477 131.782 33.608 139.637 1.00 0.00 H ATOM 99587 H2 WAT 7477 130.559 32.721 139.555 1.00 0.00 H TER 99589 WAT 7477 ATOM 99589 O WAT 7478 63.645 114.596 14.425 1.00 0.00 O ATOM 99590 H1 WAT 7478 64.406 114.899 13.929 1.00 0.00 H ATOM 99591 H2 WAT 7478 62.899 115.023 14.004 1.00 0.00 H TER 99593 WAT 7478 ATOM 99593 O WAT 7479 59.862 43.245 134.904 1.00 0.00 O ATOM 99594 H1 WAT 7479 59.308 42.995 135.643 1.00 0.00 H ATOM 99595 H2 WAT 7479 60.748 43.010 135.180 1.00 0.00 H TER 99597 WAT 7479 ATOM 99597 O WAT 7480 55.153 36.549 65.021 1.00 0.00 O ATOM 99598 H1 WAT 7480 54.952 36.588 64.086 1.00 0.00 H ATOM 99599 H2 WAT 7480 55.954 36.027 65.073 1.00 0.00 H TER 99601 WAT 7480 ATOM 99601 O WAT 7481 135.540 51.770 146.903 1.00 0.00 O ATOM 99602 H1 WAT 7481 135.410 52.716 146.967 1.00 0.00 H ATOM 99603 H2 WAT 7481 135.550 51.593 145.962 1.00 0.00 H TER 99605 WAT 7481 ATOM 99605 O WAT 7482 45.687 118.974 67.373 1.00 0.00 O ATOM 99606 H1 WAT 7482 44.977 119.535 67.686 1.00 0.00 H ATOM 99607 H2 WAT 7482 46.138 118.691 68.168 1.00 0.00 H TER 99609 WAT 7482 ATOM 99609 O WAT 7483 142.193 98.580 98.503 1.00 0.00 O ATOM 99610 H1 WAT 7483 142.067 98.575 99.452 1.00 0.00 H ATOM 99611 H2 WAT 7483 143.138 98.687 98.388 1.00 0.00 H TER 99613 WAT 7483 ATOM 99613 O WAT 7484 31.476 131.314 108.054 1.00 0.00 O ATOM 99614 H1 WAT 7484 32.015 131.368 107.265 1.00 0.00 H ATOM 99615 H2 WAT 7484 31.784 130.526 108.501 1.00 0.00 H TER 99617 WAT 7484 ATOM 99617 O WAT 7485 53.148 142.434 134.145 1.00 0.00 O ATOM 99618 H1 WAT 7485 53.735 142.574 134.888 1.00 0.00 H ATOM 99619 H2 WAT 7485 52.801 141.552 134.276 1.00 0.00 H TER 99621 WAT 7485 ATOM 99621 O WAT 7486 18.267 60.767 4.759 1.00 0.00 O ATOM 99622 H1 WAT 7486 18.397 61.353 5.504 1.00 0.00 H ATOM 99623 H2 WAT 7486 17.330 60.572 4.768 1.00 0.00 H TER 99625 WAT 7486 ATOM 99625 O WAT 7487 123.089 35.427 137.683 1.00 0.00 O ATOM 99626 H1 WAT 7487 122.743 35.589 138.560 1.00 0.00 H ATOM 99627 H2 WAT 7487 123.599 36.211 137.478 1.00 0.00 H TER 99629 WAT 7487 ATOM 99629 O WAT 7488 85.639 78.436 0.356 1.00 0.00 O ATOM 99630 H1 WAT 7488 85.814 78.129 -0.534 1.00 0.00 H ATOM 99631 H2 WAT 7488 85.444 79.368 0.254 1.00 0.00 H TER 99633 WAT 7488 ATOM 99633 O WAT 7489 99.021 98.423 147.697 1.00 0.00 O ATOM 99634 H1 WAT 7489 98.120 98.492 147.383 1.00 0.00 H ATOM 99635 H2 WAT 7489 99.144 97.489 147.868 1.00 0.00 H TER 99637 WAT 7489 ATOM 99637 O WAT 7490 48.379 63.811 8.083 1.00 0.00 O ATOM 99638 H1 WAT 7490 47.471 63.649 8.339 1.00 0.00 H ATOM 99639 H2 WAT 7490 48.330 64.567 7.498 1.00 0.00 H TER 99641 WAT 7490 ATOM 99641 O WAT 7491 20.143 75.118 103.566 1.00 0.00 O ATOM 99642 H1 WAT 7491 20.143 74.398 104.197 1.00 0.00 H ATOM 99643 H2 WAT 7491 19.557 74.825 102.868 1.00 0.00 H TER 99645 WAT 7491 ATOM 99645 O WAT 7492 49.438 108.096 83.212 1.00 0.00 O ATOM 99646 H1 WAT 7492 49.222 108.400 84.093 1.00 0.00 H ATOM 99647 H2 WAT 7492 50.308 108.456 83.041 1.00 0.00 H TER 99649 WAT 7492 ATOM 99649 O WAT 7493 30.303 140.260 144.715 1.00 0.00 O ATOM 99650 H1 WAT 7493 30.987 139.643 144.454 1.00 0.00 H ATOM 99651 H2 WAT 7493 29.717 139.746 145.270 1.00 0.00 H TER 99653 WAT 7493 ATOM 99653 O WAT 7494 145.320 101.290 53.661 1.00 0.00 O ATOM 99654 H1 WAT 7494 146.127 101.110 53.179 1.00 0.00 H ATOM 99655 H2 WAT 7494 145.392 100.764 54.457 1.00 0.00 H TER 99657 WAT 7494 ATOM 99657 O WAT 7495 109.176 145.091 154.148 1.00 0.00 O ATOM 99658 H1 WAT 7495 108.427 144.496 154.175 1.00 0.00 H ATOM 99659 H2 WAT 7495 109.102 145.605 154.952 1.00 0.00 H TER 99661 WAT 7495 ATOM 99661 O WAT 7496 23.566 142.443 111.142 1.00 0.00 O ATOM 99662 H1 WAT 7496 23.051 142.881 111.820 1.00 0.00 H ATOM 99663 H2 WAT 7496 24.417 142.285 111.552 1.00 0.00 H TER 99665 WAT 7496 ATOM 99665 O WAT 7497 30.737 90.596 145.726 1.00 0.00 O ATOM 99666 H1 WAT 7497 30.445 91.489 145.908 1.00 0.00 H ATOM 99667 H2 WAT 7497 30.990 90.609 144.803 1.00 0.00 H TER 99669 WAT 7497 ATOM 99669 O WAT 7498 31.847 118.571 64.799 1.00 0.00 O ATOM 99670 H1 WAT 7498 31.182 118.272 64.178 1.00 0.00 H ATOM 99671 H2 WAT 7498 32.483 117.857 64.831 1.00 0.00 H TER 99673 WAT 7498 ATOM 99673 O WAT 7499 36.315 52.563 125.896 1.00 0.00 O ATOM 99674 H1 WAT 7499 36.127 53.390 125.451 1.00 0.00 H ATOM 99675 H2 WAT 7499 35.459 52.148 126.001 1.00 0.00 H TER 99677 WAT 7499 ATOM 99677 O WAT 7500 35.484 19.189 89.688 1.00 0.00 O ATOM 99678 H1 WAT 7500 36.087 18.697 89.130 1.00 0.00 H ATOM 99679 H2 WAT 7500 34.628 18.797 89.519 1.00 0.00 H TER 99681 WAT 7500 ATOM 99681 O WAT 7501 87.330 137.463 16.392 1.00 0.00 O ATOM 99682 H1 WAT 7501 86.445 137.320 16.055 1.00 0.00 H ATOM 99683 H2 WAT 7501 87.526 136.672 16.894 1.00 0.00 H TER 99685 WAT 7501 ATOM 99685 O WAT 7502 141.962 135.251 148.300 1.00 0.00 O ATOM 99686 H1 WAT 7502 142.538 134.487 148.321 1.00 0.00 H ATOM 99687 H2 WAT 7502 141.251 134.998 147.711 1.00 0.00 H TER 99689 WAT 7502 ATOM 99689 O WAT 7503 93.528 50.798 119.989 1.00 0.00 O ATOM 99690 H1 WAT 7503 93.916 51.127 120.800 1.00 0.00 H ATOM 99691 H2 WAT 7503 92.623 50.595 120.222 1.00 0.00 H TER 99693 WAT 7503 ATOM 99693 O WAT 7504 131.467 44.971 102.600 1.00 0.00 O ATOM 99694 H1 WAT 7504 132.253 44.636 102.170 1.00 0.00 H ATOM 99695 H2 WAT 7504 131.611 44.800 103.530 1.00 0.00 H TER 99697 WAT 7504 ATOM 99697 O WAT 7505 74.671 144.303 62.595 1.00 0.00 O ATOM 99698 H1 WAT 7505 74.176 145.019 62.993 1.00 0.00 H ATOM 99699 H2 WAT 7505 74.062 143.909 61.970 1.00 0.00 H TER 99701 WAT 7505 ATOM 99701 O WAT 7506 76.297 107.174 10.751 1.00 0.00 O ATOM 99702 H1 WAT 7506 75.539 107.669 11.062 1.00 0.00 H ATOM 99703 H2 WAT 7506 76.940 107.843 10.515 1.00 0.00 H TER 99705 WAT 7506 ATOM 99705 O WAT 7507 37.850 110.511 129.401 1.00 0.00 O ATOM 99706 H1 WAT 7507 38.654 111.029 129.433 1.00 0.00 H ATOM 99707 H2 WAT 7507 37.554 110.470 130.310 1.00 0.00 H TER 99709 WAT 7507 ATOM 99709 O WAT 7508 97.755 110.467 156.349 1.00 0.00 O ATOM 99710 H1 WAT 7508 97.274 110.251 155.550 1.00 0.00 H ATOM 99711 H2 WAT 7508 98.628 110.102 156.209 1.00 0.00 H TER 99713 WAT 7508 ATOM 99713 O WAT 7509 25.273 55.266 21.669 1.00 0.00 O ATOM 99714 H1 WAT 7509 25.654 54.610 22.252 1.00 0.00 H ATOM 99715 H2 WAT 7509 24.800 55.859 22.253 1.00 0.00 H TER 99717 WAT 7509 ATOM 99717 O WAT 7510 18.656 134.712 88.891 1.00 0.00 O ATOM 99718 H1 WAT 7510 19.263 134.004 89.108 1.00 0.00 H ATOM 99719 H2 WAT 7510 19.119 135.231 88.233 1.00 0.00 H TER 99721 WAT 7510 ATOM 99721 O WAT 7511 76.925 145.190 102.449 1.00 0.00 O ATOM 99722 H1 WAT 7511 77.224 146.063 102.706 1.00 0.00 H ATOM 99723 H2 WAT 7511 77.706 144.641 102.517 1.00 0.00 H TER 99725 WAT 7511 ATOM 99725 O WAT 7512 17.348 129.990 80.226 1.00 0.00 O ATOM 99726 H1 WAT 7512 16.879 129.165 80.101 1.00 0.00 H ATOM 99727 H2 WAT 7512 16.697 130.580 80.607 1.00 0.00 H TER 99729 WAT 7512 ATOM 99729 O WAT 7513 115.595 134.870 130.901 1.00 0.00 O ATOM 99730 H1 WAT 7513 115.952 135.619 130.423 1.00 0.00 H ATOM 99731 H2 WAT 7513 115.927 134.976 131.793 1.00 0.00 H TER 99733 WAT 7513 ATOM 99733 O WAT 7514 45.831 116.175 85.249 1.00 0.00 O ATOM 99734 H1 WAT 7514 46.126 116.335 86.145 1.00 0.00 H ATOM 99735 H2 WAT 7514 44.933 116.505 85.229 1.00 0.00 H TER 99737 WAT 7514 ATOM 99737 O WAT 7515 31.247 107.939 83.334 1.00 0.00 O ATOM 99738 H1 WAT 7515 31.389 108.370 82.491 1.00 0.00 H ATOM 99739 H2 WAT 7515 30.356 107.593 83.279 1.00 0.00 H TER 99741 WAT 7515 ATOM 99741 O WAT 7516 66.181 129.285 118.018 1.00 0.00 O ATOM 99742 H1 WAT 7516 66.604 128.711 118.657 1.00 0.00 H ATOM 99743 H2 WAT 7516 65.664 129.892 118.548 1.00 0.00 H TER 99745 WAT 7516 ATOM 99745 O WAT 7517 134.852 119.280 1.055 1.00 0.00 O ATOM 99746 H1 WAT 7517 135.276 118.528 1.469 1.00 0.00 H ATOM 99747 H2 WAT 7517 134.566 119.826 1.787 1.00 0.00 H TER 99749 WAT 7517 ATOM 99749 O WAT 7518 89.757 71.304 73.069 1.00 0.00 O ATOM 99750 H1 WAT 7518 89.001 71.745 72.681 1.00 0.00 H ATOM 99751 H2 WAT 7518 89.427 70.442 73.324 1.00 0.00 H TER 99753 WAT 7518 ATOM 99753 O WAT 7519 119.743 65.673 13.962 1.00 0.00 O ATOM 99754 H1 WAT 7519 119.863 66.473 13.449 1.00 0.00 H ATOM 99755 H2 WAT 7519 119.695 64.975 13.309 1.00 0.00 H TER 99757 WAT 7519 ATOM 99757 O WAT 7520 126.174 46.485 93.500 1.00 0.00 O ATOM 99758 H1 WAT 7520 125.329 46.839 93.779 1.00 0.00 H ATOM 99759 H2 WAT 7520 126.171 45.582 93.816 1.00 0.00 H TER 99761 WAT 7520 ATOM 99761 O WAT 7521 6.702 53.521 134.433 1.00 0.00 O ATOM 99762 H1 WAT 7521 7.378 52.999 134.001 1.00 0.00 H ATOM 99763 H2 WAT 7521 7.035 54.418 134.402 1.00 0.00 H TER 99765 WAT 7521 ATOM 99765 O WAT 7522 110.071 33.840 67.645 1.00 0.00 O ATOM 99766 H1 WAT 7522 110.696 34.485 67.315 1.00 0.00 H ATOM 99767 H2 WAT 7522 109.898 34.112 68.546 1.00 0.00 H TER 99769 WAT 7522 ATOM 99769 O WAT 7523 139.402 24.276 119.941 1.00 0.00 O ATOM 99770 H1 WAT 7523 138.691 23.963 120.500 1.00 0.00 H ATOM 99771 H2 WAT 7523 140.138 24.406 120.539 1.00 0.00 H TER 99773 WAT 7523 ATOM 99773 O WAT 7524 135.446 87.621 19.374 1.00 0.00 O ATOM 99774 H1 WAT 7524 135.230 88.381 19.915 1.00 0.00 H ATOM 99775 H2 WAT 7524 136.249 87.272 19.761 1.00 0.00 H TER 99777 WAT 7524 ATOM 99777 O WAT 7525 58.127 85.083 131.249 1.00 0.00 O ATOM 99778 H1 WAT 7525 58.933 84.989 130.742 1.00 0.00 H ATOM 99779 H2 WAT 7525 57.430 85.089 130.594 1.00 0.00 H TER 99781 WAT 7525 ATOM 99781 O WAT 7526 46.455 38.433 21.802 1.00 0.00 O ATOM 99782 H1 WAT 7526 46.953 39.241 21.678 1.00 0.00 H ATOM 99783 H2 WAT 7526 47.088 37.734 21.639 1.00 0.00 H TER 99785 WAT 7526 ATOM 99785 O WAT 7527 122.948 70.361 100.813 1.00 0.00 O ATOM 99786 H1 WAT 7527 123.793 70.763 101.017 1.00 0.00 H ATOM 99787 H2 WAT 7527 123.150 69.711 100.140 1.00 0.00 H TER 99789 WAT 7527 ATOM 99789 O WAT 7528 50.097 15.754 156.929 1.00 0.00 O ATOM 99790 H1 WAT 7528 49.747 16.286 157.644 1.00 0.00 H ATOM 99791 H2 WAT 7528 49.399 15.745 156.274 1.00 0.00 H TER 99793 WAT 7528 ATOM 99793 O WAT 7529 16.375 95.599 73.969 1.00 0.00 O ATOM 99794 H1 WAT 7529 16.070 95.520 74.873 1.00 0.00 H ATOM 99795 H2 WAT 7529 17.325 95.686 74.043 1.00 0.00 H TER 99797 WAT 7529 ATOM 99797 O WAT 7530 104.197 72.282 125.909 1.00 0.00 O ATOM 99798 H1 WAT 7530 104.164 71.974 125.003 1.00 0.00 H ATOM 99799 H2 WAT 7530 104.902 72.929 125.917 1.00 0.00 H TER 99801 WAT 7530 ATOM 99801 O WAT 7531 27.977 65.104 85.857 1.00 0.00 O ATOM 99802 H1 WAT 7531 28.912 65.006 86.038 1.00 0.00 H ATOM 99803 H2 WAT 7531 27.724 65.899 86.327 1.00 0.00 H TER 99805 WAT 7531 ATOM 99805 O WAT 7532 76.310 48.559 96.794 1.00 0.00 O ATOM 99806 H1 WAT 7532 77.147 48.681 96.345 1.00 0.00 H ATOM 99807 H2 WAT 7532 75.657 48.583 96.095 1.00 0.00 H TER 99809 WAT 7532 ATOM 99809 O WAT 7533 136.004 25.314 131.332 1.00 0.00 O ATOM 99810 H1 WAT 7533 136.693 25.951 131.144 1.00 0.00 H ATOM 99811 H2 WAT 7533 135.189 25.801 131.218 1.00 0.00 H TER 99813 WAT 7533 ATOM 99813 O WAT 7534 56.612 70.458 65.099 1.00 0.00 O ATOM 99814 H1 WAT 7534 56.469 70.327 64.162 1.00 0.00 H ATOM 99815 H2 WAT 7534 57.521 70.750 65.165 1.00 0.00 H TER 99817 WAT 7534 ATOM 99817 O WAT 7535 112.580 137.584 156.640 1.00 0.00 O ATOM 99818 H1 WAT 7535 113.333 137.002 156.745 1.00 0.00 H ATOM 99819 H2 WAT 7535 112.918 138.324 156.136 1.00 0.00 H TER 99821 WAT 7535 ATOM 99821 O WAT 7536 135.340 29.322 72.139 1.00 0.00 O ATOM 99822 H1 WAT 7536 134.596 29.594 72.676 1.00 0.00 H ATOM 99823 H2 WAT 7536 135.149 29.672 71.269 1.00 0.00 H TER 99825 WAT 7536 ATOM 99825 O WAT 7537 71.100 119.388 21.145 1.00 0.00 O ATOM 99826 H1 WAT 7537 71.856 119.166 21.689 1.00 0.00 H ATOM 99827 H2 WAT 7537 70.777 118.545 20.828 1.00 0.00 H TER 99829 WAT 7537 ATOM 99829 O WAT 7538 40.284 108.314 138.399 1.00 0.00 O ATOM 99830 H1 WAT 7538 40.089 109.162 138.796 1.00 0.00 H ATOM 99831 H2 WAT 7538 41.153 108.424 138.013 1.00 0.00 H TER 99833 WAT 7538 ATOM 99833 O WAT 7539 120.364 80.553 11.603 1.00 0.00 O ATOM 99834 H1 WAT 7539 120.508 79.633 11.824 1.00 0.00 H ATOM 99835 H2 WAT 7539 120.469 80.591 10.652 1.00 0.00 H TER 99837 WAT 7539 ATOM 99837 O WAT 7540 30.514 139.008 127.220 1.00 0.00 O ATOM 99838 H1 WAT 7540 30.365 139.952 127.167 1.00 0.00 H ATOM 99839 H2 WAT 7540 29.659 138.643 127.449 1.00 0.00 H TER 99841 WAT 7540 ATOM 99841 O WAT 7541 114.211 7.415 9.496 1.00 0.00 O ATOM 99842 H1 WAT 7541 113.296 7.354 9.772 1.00 0.00 H ATOM 99843 H2 WAT 7541 114.394 6.571 9.083 1.00 0.00 H TER 99845 WAT 7541 ATOM 99845 O WAT 7542 85.198 127.582 138.894 1.00 0.00 O ATOM 99846 H1 WAT 7542 85.452 127.834 138.007 1.00 0.00 H ATOM 99847 H2 WAT 7542 84.289 127.294 138.810 1.00 0.00 H TER 99849 WAT 7542 ATOM 99849 O WAT 7543 129.282 67.458 134.361 1.00 0.00 O ATOM 99850 H1 WAT 7543 129.967 67.843 133.815 1.00 0.00 H ATOM 99851 H2 WAT 7543 128.523 68.026 134.229 1.00 0.00 H TER 99853 WAT 7543 ATOM 99853 O WAT 7544 24.363 141.876 20.492 1.00 0.00 O ATOM 99854 H1 WAT 7544 23.988 142.721 20.246 1.00 0.00 H ATOM 99855 H2 WAT 7544 24.093 141.749 21.401 1.00 0.00 H TER 99857 WAT 7544 ATOM 99857 O WAT 7545 117.928 7.291 117.907 1.00 0.00 O ATOM 99858 H1 WAT 7545 117.028 7.312 118.232 1.00 0.00 H ATOM 99859 H2 WAT 7545 117.841 7.091 116.975 1.00 0.00 H TER 99861 WAT 7545 ATOM 99861 O WAT 7546 47.767 71.667 16.498 1.00 0.00 O ATOM 99862 H1 WAT 7546 48.108 71.051 17.147 1.00 0.00 H ATOM 99863 H2 WAT 7546 47.752 71.170 15.680 1.00 0.00 H TER 99865 WAT 7546 ATOM 99865 O WAT 7547 137.311 43.356 104.573 1.00 0.00 O ATOM 99866 H1 WAT 7547 137.395 42.411 104.704 1.00 0.00 H ATOM 99867 H2 WAT 7547 137.680 43.510 103.704 1.00 0.00 H TER 99869 WAT 7547 ATOM 99869 O WAT 7548 107.141 88.165 102.429 1.00 0.00 O ATOM 99870 H1 WAT 7548 108.060 88.310 102.206 1.00 0.00 H ATOM 99871 H2 WAT 7548 107.047 88.531 103.308 1.00 0.00 H TER 99873 WAT 7548 ATOM 99873 O WAT 7549 103.836 11.855 66.626 1.00 0.00 O ATOM 99874 H1 WAT 7549 103.185 11.175 66.455 1.00 0.00 H ATOM 99875 H2 WAT 7549 103.329 12.590 66.971 1.00 0.00 H TER 99877 WAT 7549 ATOM 99877 O WAT 7550 77.781 32.114 138.088 1.00 0.00 O ATOM 99878 H1 WAT 7550 78.181 31.616 137.375 1.00 0.00 H ATOM 99879 H2 WAT 7550 77.895 31.560 138.860 1.00 0.00 H TER 99881 WAT 7550 ATOM 99881 O WAT 7551 126.405 54.091 78.687 1.00 0.00 O ATOM 99882 H1 WAT 7551 126.527 55.039 78.648 1.00 0.00 H ATOM 99883 H2 WAT 7551 125.847 53.890 77.935 1.00 0.00 H TER 99885 WAT 7551 ATOM 99885 O WAT 7552 52.828 62.966 2.694 1.00 0.00 O ATOM 99886 H1 WAT 7552 52.515 62.321 2.060 1.00 0.00 H ATOM 99887 H2 WAT 7552 52.156 62.978 3.375 1.00 0.00 H TER 99889 WAT 7552 ATOM 99889 O WAT 7553 69.926 22.852 50.639 1.00 0.00 O ATOM 99890 H1 WAT 7553 70.117 23.787 50.566 1.00 0.00 H ATOM 99891 H2 WAT 7553 70.781 22.427 50.570 1.00 0.00 H TER 99893 WAT 7553 ATOM 99893 O WAT 7554 118.884 135.142 152.304 1.00 0.00 O ATOM 99894 H1 WAT 7554 119.037 134.639 151.505 1.00 0.00 H ATOM 99895 H2 WAT 7554 119.222 134.587 153.006 1.00 0.00 H TER 99897 WAT 7554 ATOM 99897 O WAT 7555 64.710 36.234 2.866 1.00 0.00 O ATOM 99898 H1 WAT 7555 65.210 36.926 3.299 1.00 0.00 H ATOM 99899 H2 WAT 7555 65.339 35.818 2.276 1.00 0.00 H TER 99901 WAT 7555 ATOM 99901 O WAT 7556 58.417 58.594 133.868 1.00 0.00 O ATOM 99902 H1 WAT 7556 58.895 59.349 133.524 1.00 0.00 H ATOM 99903 H2 WAT 7556 57.640 58.971 134.282 1.00 0.00 H TER 99905 WAT 7556 ATOM 99905 O WAT 7557 86.853 17.820 136.716 1.00 0.00 O ATOM 99906 H1 WAT 7557 85.927 18.059 136.762 1.00 0.00 H ATOM 99907 H2 WAT 7557 86.911 16.993 137.194 1.00 0.00 H TER 99909 WAT 7557 ATOM 99909 O WAT 7558 22.383 85.540 14.601 1.00 0.00 O ATOM 99910 H1 WAT 7558 22.748 84.965 13.929 1.00 0.00 H ATOM 99911 H2 WAT 7558 22.153 86.342 14.131 1.00 0.00 H TER 99913 WAT 7558 ATOM 99913 O WAT 7559 129.769 118.735 150.243 1.00 0.00 O ATOM 99914 H1 WAT 7559 130.065 119.616 150.473 1.00 0.00 H ATOM 99915 H2 WAT 7559 130.507 118.168 150.467 1.00 0.00 H TER 99917 WAT 7559 ATOM 99917 O WAT 7560 53.742 119.782 53.456 1.00 0.00 O ATOM 99918 H1 WAT 7560 53.632 120.594 52.962 1.00 0.00 H ATOM 99919 H2 WAT 7560 53.443 119.997 54.340 1.00 0.00 H TER 99921 WAT 7560 ATOM 99921 O WAT 7561 34.165 56.822 107.920 1.00 0.00 O ATOM 99922 H1 WAT 7561 34.634 57.499 108.406 1.00 0.00 H ATOM 99923 H2 WAT 7561 34.820 56.141 107.764 1.00 0.00 H TER 99925 WAT 7561 ATOM 99925 O WAT 7562 3.940 79.607 71.824 1.00 0.00 O ATOM 99926 H1 WAT 7562 3.022 79.511 71.573 1.00 0.00 H ATOM 99927 H2 WAT 7562 4.263 78.709 71.899 1.00 0.00 H TER 99929 WAT 7562 ATOM 99929 O WAT 7563 105.278 16.311 7.747 1.00 0.00 O ATOM 99930 H1 WAT 7563 105.823 17.013 8.104 1.00 0.00 H ATOM 99931 H2 WAT 7563 104.610 16.162 8.417 1.00 0.00 H TER 99933 WAT 7563 ATOM 99933 O WAT 7564 82.864 123.735 84.932 1.00 0.00 O ATOM 99934 H1 WAT 7564 82.756 122.785 84.978 1.00 0.00 H ATOM 99935 H2 WAT 7564 82.997 123.915 84.001 1.00 0.00 H TER 99937 WAT 7564 ATOM 99937 O WAT 7565 131.476 59.377 117.345 1.00 0.00 O ATOM 99938 H1 WAT 7565 131.369 60.316 117.498 1.00 0.00 H ATOM 99939 H2 WAT 7565 131.450 59.285 116.393 1.00 0.00 H TER 99941 WAT 7565 ATOM 99941 O WAT 7566 77.173 56.356 119.633 1.00 0.00 O ATOM 99942 H1 WAT 7566 77.528 56.070 118.791 1.00 0.00 H ATOM 99943 H2 WAT 7566 77.443 57.271 119.708 1.00 0.00 H TER 99945 WAT 7566 ATOM 99945 O WAT 7567 55.932 47.116 155.653 1.00 0.00 O ATOM 99946 H1 WAT 7567 55.997 46.429 154.990 1.00 0.00 H ATOM 99947 H2 WAT 7567 55.025 47.417 155.600 1.00 0.00 H TER 99949 WAT 7567 ATOM 99949 O WAT 7568 1.286 112.983 3.674 1.00 0.00 O ATOM 99950 H1 WAT 7568 0.825 112.622 4.431 1.00 0.00 H ATOM 99951 H2 WAT 7568 1.865 113.651 4.042 1.00 0.00 H TER 99953 WAT 7568 ATOM 99953 O WAT 7569 96.779 112.602 157.764 1.00 0.00 O ATOM 99954 H1 WAT 7569 96.249 112.201 158.453 1.00 0.00 H ATOM 99955 H2 WAT 7569 97.199 111.863 157.324 1.00 0.00 H TER 99957 WAT 7569 ATOM 99957 O WAT 7570 110.579 93.353 103.342 1.00 0.00 O ATOM 99958 H1 WAT 7570 111.521 93.180 103.365 1.00 0.00 H ATOM 99959 H2 WAT 7570 110.206 92.591 102.900 1.00 0.00 H TER 99961 WAT 7570 ATOM 99961 O WAT 7571 8.283 56.018 81.069 1.00 0.00 O ATOM 99962 H1 WAT 7571 8.912 56.739 81.050 1.00 0.00 H ATOM 99963 H2 WAT 7571 8.027 55.948 81.989 1.00 0.00 H TER 99965 WAT 7571 ATOM 99965 O WAT 7572 141.771 128.164 107.977 1.00 0.00 O ATOM 99966 H1 WAT 7572 141.328 128.083 107.133 1.00 0.00 H ATOM 99967 H2 WAT 7572 142.322 128.942 107.886 1.00 0.00 H TER 99969 WAT 7572 ATOM 99969 O WAT 7573 22.356 46.907 104.059 1.00 0.00 O ATOM 99970 H1 WAT 7573 22.787 47.415 103.372 1.00 0.00 H ATOM 99971 H2 WAT 7573 22.661 46.010 103.921 1.00 0.00 H TER 99973 WAT 7573 ATOM 99973 O WAT 7574 114.560 0.229 151.033 1.00 0.00 O ATOM 99974 H1 WAT 7574 113.655 0.167 151.338 1.00 0.00 H ATOM 99975 H2 WAT 7574 115.088 0.053 151.812 1.00 0.00 H TER 99977 WAT 7574 ATOM 99977 O WAT 7575 105.246 48.121 104.300 1.00 0.00 O ATOM 99978 H1 WAT 7575 105.072 47.315 104.786 1.00 0.00 H ATOM 99979 H2 WAT 7575 105.404 48.779 104.977 1.00 0.00 H TER 99981 WAT 7575 ATOM 99981 O WAT 7576 120.746 60.984 0.170 1.00 0.00 O ATOM 99982 H1 WAT 7576 120.498 60.796 1.075 1.00 0.00 H ATOM 99983 H2 WAT 7576 121.640 60.650 0.092 1.00 0.00 H TER 99985 WAT 7576 ATOM 99985 O WAT 7577 12.975 65.434 81.673 1.00 0.00 O ATOM 99986 H1 WAT 7577 12.464 65.759 80.931 1.00 0.00 H ATOM 99987 H2 WAT 7577 13.886 65.512 81.390 1.00 0.00 H TER 99989 WAT 7577 ATOM 99989 O WAT 7578 107.290 48.026 126.257 1.00 0.00 O ATOM 99990 H1 WAT 7578 107.981 47.496 125.858 1.00 0.00 H ATOM 99991 H2 WAT 7578 107.759 48.704 126.743 1.00 0.00 H TER 99993 WAT 7578 ATOM 99993 O WAT 7579 17.049 20.914 65.451 1.00 0.00 O ATOM 99994 H1 WAT 7579 17.447 20.336 64.800 1.00 0.00 H ATOM 99995 H2 WAT 7579 16.686 21.637 64.940 1.00 0.00 H TER 99997 WAT 7579 ATOM 99997 O WAT 7580 113.204 48.468 107.605 1.00 0.00 O ATOM 99998 H1 WAT 7580 113.591 48.647 108.462 1.00 0.00 H ATOM 99999 H2 WAT 7580 112.962 49.330 107.266 1.00 0.00 H TER 1 WAT 7580 ATOM 1 O WAT 7581 136.706 108.034 115.656 1.00 0.00 O ATOM 2 H1 WAT 7581 137.273 108.789 115.498 1.00 0.00 H ATOM 3 H2 WAT 7581 135.919 108.213 115.143 1.00 0.00 H TER 5 WAT 7581 ATOM 5 O WAT 7582 58.285 126.196 72.216 1.00 0.00 O ATOM 6 H1 WAT 7582 58.982 125.633 71.880 1.00 0.00 H ATOM 7 H2 WAT 7582 57.654 125.589 72.603 1.00 0.00 H TER 9 WAT 7582 ATOM 9 O WAT 7583 7.822 39.802 158.666 1.00 0.00 O ATOM 10 H1 WAT 7583 7.055 39.518 159.164 1.00 0.00 H ATOM 11 H2 WAT 7583 7.749 39.341 157.831 1.00 0.00 H TER 13 WAT 7583 ATOM 13 O WAT 7584 87.709 31.140 150.241 1.00 0.00 O ATOM 14 H1 WAT 7584 86.995 30.568 150.520 1.00 0.00 H ATOM 15 H2 WAT 7584 87.567 31.954 150.724 1.00 0.00 H TER 17 WAT 7584 ATOM 17 O WAT 7585 136.853 119.665 142.342 1.00 0.00 O ATOM 18 H1 WAT 7585 137.397 119.540 143.119 1.00 0.00 H ATOM 19 H2 WAT 7585 135.991 119.898 142.688 1.00 0.00 H TER 21 WAT 7585 ATOM 21 O WAT 7586 131.752 127.465 142.772 1.00 0.00 O ATOM 22 H1 WAT 7586 131.556 127.729 143.671 1.00 0.00 H ATOM 23 H2 WAT 7586 131.085 126.811 142.563 1.00 0.00 H TER 25 WAT 7586 ATOM 25 O WAT 7587 46.397 112.393 109.423 1.00 0.00 O ATOM 26 H1 WAT 7587 46.766 111.961 110.193 1.00 0.00 H ATOM 27 H2 WAT 7587 45.938 113.156 109.773 1.00 0.00 H TER 29 WAT 7587 ATOM 29 O WAT 7588 125.345 116.897 85.594 1.00 0.00 O ATOM 30 H1 WAT 7588 126.153 117.016 86.092 1.00 0.00 H ATOM 31 H2 WAT 7588 124.685 117.382 86.089 1.00 0.00 H TER 33 WAT 7588 ATOM 33 O WAT 7589 35.541 1.929 136.977 1.00 0.00 O ATOM 34 H1 WAT 7589 35.672 2.828 136.676 1.00 0.00 H ATOM 35 H2 WAT 7589 36.426 1.591 137.115 1.00 0.00 H TER 37 WAT 7589 ATOM 37 O WAT 7590 4.791 30.561 153.763 1.00 0.00 O ATOM 38 H1 WAT 7590 5.274 30.515 154.588 1.00 0.00 H ATOM 39 H2 WAT 7590 5.183 31.299 153.296 1.00 0.00 H TER 41 WAT 7590 ATOM 41 O WAT 7591 29.769 103.277 152.676 1.00 0.00 O ATOM 42 H1 WAT 7591 30.117 103.244 151.785 1.00 0.00 H ATOM 43 H2 WAT 7591 29.664 102.359 152.926 1.00 0.00 H TER 45 WAT 7591 ATOM 45 O WAT 7592 70.167 19.562 77.518 1.00 0.00 O ATOM 46 H1 WAT 7592 70.200 19.552 78.474 1.00 0.00 H ATOM 47 H2 WAT 7592 70.221 20.489 77.286 1.00 0.00 H TER 49 WAT 7592 ATOM 49 O WAT 7593 58.089 82.494 9.278 1.00 0.00 O ATOM 50 H1 WAT 7593 58.624 81.842 9.731 1.00 0.00 H ATOM 51 H2 WAT 7593 58.269 82.347 8.349 1.00 0.00 H TER 53 WAT 7593 ATOM 53 O WAT 7594 102.852 45.368 72.821 1.00 0.00 O ATOM 54 H1 WAT 7594 102.364 44.580 72.581 1.00 0.00 H ATOM 55 H2 WAT 7594 103.560 45.415 72.179 1.00 0.00 H TER 57 WAT 7594 ATOM 57 O WAT 7595 10.016 81.186 7.478 1.00 0.00 O ATOM 58 H1 WAT 7595 10.440 80.560 8.065 1.00 0.00 H ATOM 59 H2 WAT 7595 10.702 81.819 7.267 1.00 0.00 H TER 61 WAT 7595 ATOM 61 O WAT 7596 21.003 70.303 150.355 1.00 0.00 O ATOM 62 H1 WAT 7596 20.092 70.594 150.328 1.00 0.00 H ATOM 63 H2 WAT 7596 20.962 69.369 150.149 1.00 0.00 H TER 65 WAT 7596 ATOM 65 O WAT 7597 66.164 58.837 9.221 1.00 0.00 O ATOM 66 H1 WAT 7597 66.031 59.455 8.502 1.00 0.00 H ATOM 67 H2 WAT 7597 65.505 59.081 9.871 1.00 0.00 H TER 69 WAT 7597 ATOM 69 O WAT 7598 122.609 49.047 76.455 1.00 0.00 O ATOM 70 H1 WAT 7598 122.629 50.004 76.493 1.00 0.00 H ATOM 71 H2 WAT 7598 123.525 48.793 76.341 1.00 0.00 H TER 73 WAT 7598 ATOM 73 O WAT 7599 27.509 58.804 94.890 1.00 0.00 O ATOM 74 H1 WAT 7599 28.283 58.389 95.271 1.00 0.00 H ATOM 75 H2 WAT 7599 27.828 59.639 94.550 1.00 0.00 H TER 77 WAT 7599 ATOM 77 O WAT 7600 110.932 115.214 25.761 1.00 0.00 O ATOM 78 H1 WAT 7600 111.565 114.497 25.737 1.00 0.00 H ATOM 79 H2 WAT 7600 110.109 114.799 26.019 1.00 0.00 H TER 81 WAT 7600 ATOM 81 O WAT 7601 105.575 112.396 116.605 1.00 0.00 O ATOM 82 H1 WAT 7601 105.160 111.830 115.954 1.00 0.00 H ATOM 83 H2 WAT 7601 106.402 112.659 116.201 1.00 0.00 H TER 85 WAT 7601 ATOM 85 O WAT 7602 119.684 50.956 74.514 1.00 0.00 O ATOM 86 H1 WAT 7602 119.430 51.389 75.330 1.00 0.00 H ATOM 87 H2 WAT 7602 119.408 51.562 73.826 1.00 0.00 H TER 89 WAT 7602 ATOM 89 O WAT 7603 28.269 105.926 77.004 1.00 0.00 O ATOM 90 H1 WAT 7603 28.234 105.008 76.733 1.00 0.00 H ATOM 91 H2 WAT 7603 29.086 106.000 77.496 1.00 0.00 H TER 93 WAT 7603 ATOM 93 O WAT 7604 123.790 140.363 139.233 1.00 0.00 O ATOM 94 H1 WAT 7604 122.847 140.404 139.072 1.00 0.00 H ATOM 95 H2 WAT 7604 124.122 139.770 138.560 1.00 0.00 H TER 97 WAT 7604 ATOM 97 O WAT 7605 10.815 54.873 134.001 1.00 0.00 O ATOM 98 H1 WAT 7605 10.702 55.168 134.904 1.00 0.00 H ATOM 99 H2 WAT 7605 11.635 54.380 134.010 1.00 0.00 H TER 101 WAT 7605 ATOM 101 O WAT 7606 83.603 22.417 95.360 1.00 0.00 O ATOM 102 H1 WAT 7606 83.869 22.903 96.141 1.00 0.00 H ATOM 103 H2 WAT 7606 83.234 23.081 94.778 1.00 0.00 H TER 105 WAT 7606 ATOM 105 O WAT 7607 27.814 76.447 139.109 1.00 0.00 O ATOM 106 H1 WAT 7607 28.750 76.594 139.246 1.00 0.00 H ATOM 107 H2 WAT 7607 27.563 77.098 138.455 1.00 0.00 H TER 109 WAT 7607 ATOM 109 O WAT 7608 29.739 57.131 7.883 1.00 0.00 O ATOM 110 H1 WAT 7608 29.070 56.760 8.458 1.00 0.00 H ATOM 111 H2 WAT 7608 30.040 57.916 8.340 1.00 0.00 H TER 113 WAT 7608 ATOM 113 O WAT 7609 27.142 93.546 2.080 1.00 0.00 O ATOM 114 H1 WAT 7609 27.650 93.402 2.879 1.00 0.00 H ATOM 115 H2 WAT 7609 27.702 94.101 1.537 1.00 0.00 H TER 117 WAT 7609 ATOM 117 O WAT 7610 22.708 114.687 103.519 1.00 0.00 O ATOM 118 H1 WAT 7610 23.548 114.394 103.165 1.00 0.00 H ATOM 119 H2 WAT 7610 22.716 114.393 104.430 1.00 0.00 H TER 121 WAT 7610 ATOM 121 O WAT 7611 55.332 141.231 119.824 1.00 0.00 O ATOM 122 H1 WAT 7611 55.648 141.840 119.157 1.00 0.00 H ATOM 123 H2 WAT 7611 54.913 141.789 120.479 1.00 0.00 H TER 125 WAT 7611 ATOM 125 O WAT 7612 91.198 144.532 67.689 1.00 0.00 O ATOM 126 H1 WAT 7612 90.904 144.311 68.573 1.00 0.00 H ATOM 127 H2 WAT 7612 91.360 145.475 67.719 1.00 0.00 H TER 129 WAT 7612 ATOM 129 O WAT 7613 100.505 50.526 68.493 1.00 0.00 O ATOM 130 H1 WAT 7613 100.010 49.748 68.234 1.00 0.00 H ATOM 131 H2 WAT 7613 99.837 51.159 68.754 1.00 0.00 H TER 133 WAT 7613 ATOM 133 O WAT 7614 74.118 51.792 10.875 1.00 0.00 O ATOM 134 H1 WAT 7614 74.430 52.661 10.623 1.00 0.00 H ATOM 135 H2 WAT 7614 74.911 51.260 10.929 1.00 0.00 H TER 137 WAT 7614 ATOM 137 O WAT 7615 126.612 100.832 23.062 1.00 0.00 O ATOM 138 H1 WAT 7615 126.509 101.494 23.746 1.00 0.00 H ATOM 139 H2 WAT 7615 127.350 101.142 22.538 1.00 0.00 H TER 141 WAT 7615 ATOM 141 O WAT 7616 76.036 83.908 94.372 1.00 0.00 O ATOM 142 H1 WAT 7616 76.221 82.994 94.590 1.00 0.00 H ATOM 143 H2 WAT 7616 76.090 84.370 95.208 1.00 0.00 H TER 145 WAT 7616 ATOM 145 O WAT 7617 91.676 71.009 76.388 1.00 0.00 O ATOM 146 H1 WAT 7617 92.493 71.508 76.376 1.00 0.00 H ATOM 147 H2 WAT 7617 91.464 70.919 77.317 1.00 0.00 H TER 149 WAT 7617 ATOM 149 O WAT 7618 97.544 132.212 156.657 1.00 0.00 O ATOM 150 H1 WAT 7618 96.596 132.210 156.791 1.00 0.00 H ATOM 151 H2 WAT 7618 97.816 131.317 156.859 1.00 0.00 H TER 153 WAT 7618 ATOM 153 O WAT 7619 7.870 68.781 132.194 1.00 0.00 O ATOM 154 H1 WAT 7619 7.349 68.043 131.878 1.00 0.00 H ATOM 155 H2 WAT 7619 8.501 68.946 131.494 1.00 0.00 H TER 157 WAT 7619 ATOM 157 O WAT 7620 107.582 16.748 13.908 1.00 0.00 O ATOM 158 H1 WAT 7620 108.250 16.398 14.496 1.00 0.00 H ATOM 159 H2 WAT 7620 107.458 16.063 13.251 1.00 0.00 H TER 161 WAT 7620 ATOM 161 O WAT 7621 109.680 136.530 88.197 1.00 0.00 O ATOM 162 H1 WAT 7621 109.780 137.482 88.220 1.00 0.00 H ATOM 163 H2 WAT 7621 110.559 136.202 88.004 1.00 0.00 H TER 165 WAT 7621 ATOM 165 O WAT 7622 96.951 51.102 23.143 1.00 0.00 O ATOM 166 H1 WAT 7622 97.314 50.220 23.064 1.00 0.00 H ATOM 167 H2 WAT 7622 96.131 50.982 23.621 1.00 0.00 H TER 169 WAT 7622 ATOM 169 O WAT 7623 50.147 111.650 138.813 1.00 0.00 O ATOM 170 H1 WAT 7623 50.245 112.497 139.249 1.00 0.00 H ATOM 171 H2 WAT 7623 50.160 111.858 137.879 1.00 0.00 H TER 173 WAT 7623 ATOM 173 O WAT 7624 32.703 46.016 155.753 1.00 0.00 O ATOM 174 H1 WAT 7624 32.944 46.889 156.063 1.00 0.00 H ATOM 175 H2 WAT 7624 33.467 45.473 155.947 1.00 0.00 H TER 177 WAT 7624 ATOM 177 O WAT 7625 57.205 111.925 64.730 1.00 0.00 O ATOM 178 H1 WAT 7625 57.442 111.852 63.805 1.00 0.00 H ATOM 179 H2 WAT 7625 57.043 111.023 65.007 1.00 0.00 H TER 181 WAT 7625 ATOM 181 O WAT 7626 17.603 122.462 109.328 1.00 0.00 O ATOM 182 H1 WAT 7626 17.333 123.216 108.803 1.00 0.00 H ATOM 183 H2 WAT 7626 17.931 121.830 108.689 1.00 0.00 H TER 185 WAT 7626 ATOM 185 O WAT 7627 134.255 137.130 77.159 1.00 0.00 O ATOM 186 H1 WAT 7627 133.556 136.550 77.459 1.00 0.00 H ATOM 187 H2 WAT 7627 135.016 136.558 77.060 1.00 0.00 H TER 189 WAT 7627 ATOM 189 O WAT 7628 59.001 64.164 154.788 1.00 0.00 O ATOM 190 H1 WAT 7628 59.654 63.473 154.897 1.00 0.00 H ATOM 191 H2 WAT 7628 59.140 64.487 153.898 1.00 0.00 H TER 193 WAT 7628 ATOM 193 O WAT 7629 42.370 112.464 119.581 1.00 0.00 O ATOM 194 H1 WAT 7629 41.940 112.454 120.436 1.00 0.00 H ATOM 195 H2 WAT 7629 41.649 112.440 118.951 1.00 0.00 H TER 197 WAT 7629 ATOM 197 O WAT 7630 9.581 26.363 85.464 1.00 0.00 O ATOM 198 H1 WAT 7630 10.151 26.834 84.856 1.00 0.00 H ATOM 199 H2 WAT 7630 8.917 27.004 85.715 1.00 0.00 H TER 201 WAT 7630 ATOM 201 O WAT 7631 11.731 89.823 57.900 1.00 0.00 O ATOM 202 H1 WAT 7631 10.815 89.557 57.820 1.00 0.00 H ATOM 203 H2 WAT 7631 11.934 90.239 57.062 1.00 0.00 H TER 205 WAT 7631 ATOM 205 O WAT 7632 105.194 112.131 17.913 1.00 0.00 O ATOM 206 H1 WAT 7632 105.469 111.499 17.249 1.00 0.00 H ATOM 207 H2 WAT 7632 105.904 112.128 18.555 1.00 0.00 H TER 209 WAT 7632 ATOM 209 O WAT 7633 74.477 124.814 133.612 1.00 0.00 O ATOM 210 H1 WAT 7633 74.131 123.968 133.897 1.00 0.00 H ATOM 211 H2 WAT 7633 75.426 124.692 133.597 1.00 0.00 H TER 213 WAT 7633 ATOM 213 O WAT 7634 61.938 36.141 87.719 1.00 0.00 O ATOM 214 H1 WAT 7634 62.144 35.616 88.493 1.00 0.00 H ATOM 215 H2 WAT 7634 61.740 35.497 87.039 1.00 0.00 H TER 217 WAT 7634 ATOM 217 O WAT 7635 66.713 80.213 119.934 1.00 0.00 O ATOM 218 H1 WAT 7635 66.760 79.330 120.301 1.00 0.00 H ATOM 219 H2 WAT 7635 66.415 80.758 120.662 1.00 0.00 H TER 221 WAT 7635 ATOM 221 O WAT 7636 45.091 83.641 155.032 1.00 0.00 O ATOM 222 H1 WAT 7636 45.558 82.998 154.500 1.00 0.00 H ATOM 223 H2 WAT 7636 44.896 84.357 154.427 1.00 0.00 H TER 225 WAT 7636 ATOM 225 O WAT 7637 131.883 85.207 83.790 1.00 0.00 O ATOM 226 H1 WAT 7637 131.715 85.079 82.856 1.00 0.00 H ATOM 227 H2 WAT 7637 131.406 86.007 84.011 1.00 0.00 H TER 229 WAT 7637 ATOM 229 O WAT 7638 37.021 65.676 81.788 1.00 0.00 O ATOM 230 H1 WAT 7638 37.330 65.588 80.886 1.00 0.00 H ATOM 231 H2 WAT 7638 36.078 65.525 81.733 1.00 0.00 H TER 233 WAT 7638 ATOM 233 O WAT 7639 38.402 45.600 149.061 1.00 0.00 O ATOM 234 H1 WAT 7639 38.309 44.792 148.555 1.00 0.00 H ATOM 235 H2 WAT 7639 38.995 45.367 149.776 1.00 0.00 H TER 237 WAT 7639 ATOM 237 O WAT 7640 68.845 92.952 18.932 1.00 0.00 O ATOM 238 H1 WAT 7640 67.971 92.619 18.730 1.00 0.00 H ATOM 239 H2 WAT 7640 68.699 93.619 19.603 1.00 0.00 H TER 241 WAT 7640 ATOM 241 O WAT 7641 132.650 7.165 57.236 1.00 0.00 O ATOM 242 H1 WAT 7641 132.334 7.806 57.872 1.00 0.00 H ATOM 243 H2 WAT 7641 131.861 6.870 56.781 1.00 0.00 H TER 245 WAT 7641 ATOM 245 O WAT 7642 144.802 111.110 21.329 1.00 0.00 O ATOM 246 H1 WAT 7642 145.564 111.107 21.909 1.00 0.00 H ATOM 247 H2 WAT 7642 144.781 110.228 20.958 1.00 0.00 H TER 249 WAT 7642 ATOM 249 O WAT 7643 62.701 78.358 143.041 1.00 0.00 O ATOM 250 H1 WAT 7643 62.307 77.774 143.690 1.00 0.00 H ATOM 251 H2 WAT 7643 63.024 79.100 143.551 1.00 0.00 H TER 253 WAT 7643 ATOM 253 O WAT 7644 127.314 11.819 157.120 1.00 0.00 O ATOM 254 H1 WAT 7644 126.906 12.675 157.257 1.00 0.00 H ATOM 255 H2 WAT 7644 126.813 11.224 157.677 1.00 0.00 H TER 257 WAT 7644 ATOM 257 O WAT 7645 127.943 120.247 7.529 1.00 0.00 O ATOM 258 H1 WAT 7645 127.434 120.851 6.989 1.00 0.00 H ATOM 259 H2 WAT 7645 128.717 120.049 7.001 1.00 0.00 H TER 261 WAT 7645 ATOM 261 O WAT 7646 52.877 50.988 29.327 1.00 0.00 O ATOM 262 H1 WAT 7646 52.541 51.513 30.053 1.00 0.00 H ATOM 263 H2 WAT 7646 52.106 50.796 28.793 1.00 0.00 H TER 265 WAT 7646 ATOM 265 O WAT 7647 137.228 93.460 76.672 1.00 0.00 O ATOM 266 H1 WAT 7647 136.970 92.554 76.505 1.00 0.00 H ATOM 267 H2 WAT 7647 137.185 93.884 75.815 1.00 0.00 H TER 269 WAT 7647 ATOM 269 O WAT 7648 101.377 141.298 2.587 1.00 0.00 O ATOM 270 H1 WAT 7648 101.250 140.406 2.911 1.00 0.00 H ATOM 271 H2 WAT 7648 101.374 141.842 3.374 1.00 0.00 H TER 273 WAT 7648 ATOM 273 O WAT 7649 20.950 96.743 112.128 1.00 0.00 O ATOM 274 H1 WAT 7649 20.362 97.456 111.879 1.00 0.00 H ATOM 275 H2 WAT 7649 20.925 96.736 113.085 1.00 0.00 H TER 277 WAT 7649 ATOM 277 O WAT 7650 24.831 52.638 66.157 1.00 0.00 O ATOM 278 H1 WAT 7650 24.119 53.209 66.443 1.00 0.00 H ATOM 279 H2 WAT 7650 25.084 52.981 65.300 1.00 0.00 H TER 281 WAT 7650 ATOM 281 O WAT 7651 134.160 48.427 23.503 1.00 0.00 O ATOM 282 H1 WAT 7651 133.392 48.991 23.589 1.00 0.00 H ATOM 283 H2 WAT 7651 134.136 47.869 24.280 1.00 0.00 H TER 285 WAT 7651 ATOM 285 O WAT 7652 91.431 0.626 121.755 1.00 0.00 O ATOM 286 H1 WAT 7652 91.317 1.576 121.761 1.00 0.00 H ATOM 287 H2 WAT 7652 92.112 0.462 122.408 1.00 0.00 H TER 289 WAT 7652 ATOM 289 O WAT 7653 84.234 99.386 116.560 1.00 0.00 O ATOM 290 H1 WAT 7653 83.278 99.415 116.608 1.00 0.00 H ATOM 291 H2 WAT 7653 84.509 99.097 117.430 1.00 0.00 H TER 293 WAT 7653 ATOM 293 O WAT 7654 94.189 105.318 134.086 1.00 0.00 O ATOM 294 H1 WAT 7654 94.986 104.891 134.398 1.00 0.00 H ATOM 295 H2 WAT 7654 93.525 104.629 134.102 1.00 0.00 H TER 297 WAT 7654 ATOM 297 O WAT 7655 22.698 10.206 142.056 1.00 0.00 O ATOM 298 H1 WAT 7655 23.163 10.964 141.704 1.00 0.00 H ATOM 299 H2 WAT 7655 21.867 10.193 141.581 1.00 0.00 H TER 301 WAT 7655 ATOM 301 O WAT 7656 18.646 40.975 137.857 1.00 0.00 O ATOM 302 H1 WAT 7656 18.483 40.032 137.875 1.00 0.00 H ATOM 303 H2 WAT 7656 18.694 41.192 136.926 1.00 0.00 H TER 305 WAT 7656 ATOM 305 O WAT 7657 98.005 33.393 145.542 1.00 0.00 O ATOM 306 H1 WAT 7657 98.679 32.908 146.018 1.00 0.00 H ATOM 307 H2 WAT 7657 98.293 33.369 144.630 1.00 0.00 H TER 309 WAT 7657 ATOM 309 O WAT 7658 69.380 104.939 97.889 1.00 0.00 O ATOM 310 H1 WAT 7658 68.993 105.498 97.216 1.00 0.00 H ATOM 311 H2 WAT 7658 69.212 105.402 98.710 1.00 0.00 H TER 313 WAT 7658 ATOM 313 O WAT 7659 17.571 98.121 60.819 1.00 0.00 O ATOM 314 H1 WAT 7659 16.979 98.144 61.571 1.00 0.00 H ATOM 315 H2 WAT 7659 17.004 97.925 60.073 1.00 0.00 H TER 317 WAT 7659 ATOM 317 O WAT 7660 134.089 88.574 15.246 1.00 0.00 O ATOM 318 H1 WAT 7660 134.788 88.592 15.901 1.00 0.00 H ATOM 319 H2 WAT 7660 133.593 87.780 15.447 1.00 0.00 H TER 321 WAT 7660 ATOM 321 O WAT 7661 83.754 51.198 131.458 1.00 0.00 O ATOM 322 H1 WAT 7661 84.487 51.668 131.855 1.00 0.00 H ATOM 323 H2 WAT 7661 83.888 50.286 131.713 1.00 0.00 H TER 325 WAT 7661 ATOM 325 O WAT 7662 143.056 31.232 82.976 1.00 0.00 O ATOM 326 H1 WAT 7662 143.655 31.613 83.618 1.00 0.00 H ATOM 327 H2 WAT 7662 143.607 30.657 82.446 1.00 0.00 H TER 329 WAT 7662 ATOM 329 O WAT 7663 15.645 76.346 147.638 1.00 0.00 O ATOM 330 H1 WAT 7663 15.417 75.615 148.212 1.00 0.00 H ATOM 331 H2 WAT 7663 16.352 76.800 148.097 1.00 0.00 H TER 333 WAT 7663 ATOM 333 O WAT 7664 7.558 69.381 0.645 1.00 0.00 O ATOM 334 H1 WAT 7664 7.172 68.512 0.535 1.00 0.00 H ATOM 335 H2 WAT 7664 8.501 69.236 0.568 1.00 0.00 H TER 337 WAT 7664 ATOM 337 O WAT 7665 0.447 140.559 115.129 1.00 0.00 O ATOM 338 H1 WAT 7665 1.371 140.444 115.351 1.00 0.00 H ATOM 339 H2 WAT 7665 0.438 141.294 114.516 1.00 0.00 H TER 341 WAT 7665 ATOM 341 O WAT 7666 126.944 36.546 70.056 1.00 0.00 O ATOM 342 H1 WAT 7666 127.147 35.700 70.456 1.00 0.00 H ATOM 343 H2 WAT 7666 127.370 37.187 70.624 1.00 0.00 H TER 345 WAT 7666 ATOM 345 O WAT 7667 111.566 113.810 149.684 1.00 0.00 O ATOM 346 H1 WAT 7667 110.680 113.812 150.048 1.00 0.00 H ATOM 347 H2 WAT 7667 111.911 114.679 149.889 1.00 0.00 H TER 349 WAT 7667 ATOM 349 O WAT 7668 38.425 74.039 84.767 1.00 0.00 O ATOM 350 H1 WAT 7668 38.656 73.269 85.288 1.00 0.00 H ATOM 351 H2 WAT 7668 39.264 74.456 84.571 1.00 0.00 H TER 353 WAT 7668 ATOM 353 O WAT 7669 133.299 54.870 6.119 1.00 0.00 O ATOM 354 H1 WAT 7669 133.994 54.235 6.296 1.00 0.00 H ATOM 355 H2 WAT 7669 133.650 55.703 6.433 1.00 0.00 H TER 357 WAT 7669 ATOM 357 O WAT 7670 144.612 62.268 106.202 1.00 0.00 O ATOM 358 H1 WAT 7670 145.133 62.812 106.794 1.00 0.00 H ATOM 359 H2 WAT 7670 144.828 62.591 105.327 1.00 0.00 H TER 361 WAT 7670 ATOM 361 O WAT 7671 71.713 11.505 126.272 1.00 0.00 O ATOM 362 H1 WAT 7671 71.510 10.727 126.791 1.00 0.00 H ATOM 363 H2 WAT 7671 70.930 11.648 125.739 1.00 0.00 H TER 365 WAT 7671 ATOM 365 O WAT 7672 51.617 116.186 19.290 1.00 0.00 O ATOM 366 H1 WAT 7672 52.122 116.220 20.103 1.00 0.00 H ATOM 367 H2 WAT 7672 50.719 116.381 19.558 1.00 0.00 H TER 369 WAT 7672 ATOM 369 O WAT 7673 97.238 17.056 14.705 1.00 0.00 O ATOM 370 H1 WAT 7673 97.428 17.994 14.698 1.00 0.00 H ATOM 371 H2 WAT 7673 97.828 16.697 15.367 1.00 0.00 H TER 373 WAT 7673 ATOM 373 O WAT 7674 52.867 33.219 109.442 1.00 0.00 O ATOM 374 H1 WAT 7674 52.496 32.720 110.169 1.00 0.00 H ATOM 375 H2 WAT 7674 52.204 33.881 109.242 1.00 0.00 H TER 377 WAT 7674 ATOM 377 O WAT 7675 71.648 87.330 146.646 1.00 0.00 O ATOM 378 H1 WAT 7675 70.702 87.221 146.745 1.00 0.00 H ATOM 379 H2 WAT 7675 72.014 87.004 147.468 1.00 0.00 H TER 381 WAT 7675 ATOM 381 O WAT 7676 116.497 8.305 100.602 1.00 0.00 O ATOM 382 H1 WAT 7676 117.408 8.515 100.805 1.00 0.00 H ATOM 383 H2 WAT 7676 116.275 8.882 99.870 1.00 0.00 H TER 385 WAT 7676 ATOM 385 O WAT 7677 111.865 19.282 11.435 1.00 0.00 O ATOM 386 H1 WAT 7677 112.144 19.109 10.536 1.00 0.00 H ATOM 387 H2 WAT 7677 110.914 19.373 11.377 1.00 0.00 H TER 389 WAT 7677 ATOM 389 O WAT 7678 106.920 109.270 149.676 1.00 0.00 O ATOM 390 H1 WAT 7678 106.628 108.576 149.086 1.00 0.00 H ATOM 391 H2 WAT 7678 107.803 109.007 149.936 1.00 0.00 H TER 393 WAT 7678 ATOM 393 O WAT 7679 35.263 97.527 112.789 1.00 0.00 O ATOM 394 H1 WAT 7679 35.736 98.278 113.147 1.00 0.00 H ATOM 395 H2 WAT 7679 34.517 97.411 113.377 1.00 0.00 H TER 397 WAT 7679 ATOM 397 O WAT 7680 138.427 95.243 149.571 1.00 0.00 O ATOM 398 H1 WAT 7680 138.370 94.431 149.068 1.00 0.00 H ATOM 399 H2 WAT 7680 137.613 95.270 150.075 1.00 0.00 H TER 401 WAT 7680 ATOM 401 O WAT 7681 114.686 138.163 100.797 1.00 0.00 O ATOM 402 H1 WAT 7681 114.201 138.659 101.456 1.00 0.00 H ATOM 403 H2 WAT 7681 114.505 137.246 101.005 1.00 0.00 H TER 405 WAT 7681 ATOM 405 O WAT 7682 88.347 136.470 142.428 1.00 0.00 O ATOM 406 H1 WAT 7682 88.837 136.052 141.720 1.00 0.00 H ATOM 407 H2 WAT 7682 88.977 137.062 142.839 1.00 0.00 H TER 409 WAT 7682 ATOM 409 O WAT 7683 32.247 54.752 146.781 1.00 0.00 O ATOM 410 H1 WAT 7683 31.331 54.717 146.505 1.00 0.00 H ATOM 411 H2 WAT 7683 32.682 55.267 146.101 1.00 0.00 H TER 413 WAT 7683 ATOM 413 O WAT 7684 110.789 96.134 54.055 1.00 0.00 O ATOM 414 H1 WAT 7684 111.684 95.847 53.876 1.00 0.00 H ATOM 415 H2 WAT 7684 110.656 95.943 54.983 1.00 0.00 H TER 417 WAT 7684 ATOM 417 O WAT 7685 31.777 108.271 113.204 1.00 0.00 O ATOM 418 H1 WAT 7685 31.395 108.484 112.352 1.00 0.00 H ATOM 419 H2 WAT 7685 32.584 107.800 112.993 1.00 0.00 H TER 421 WAT 7685 ATOM 421 O WAT 7686 111.737 6.021 151.985 1.00 0.00 O ATOM 422 H1 WAT 7686 111.927 5.085 151.913 1.00 0.00 H ATOM 423 H2 WAT 7686 110.830 6.058 152.289 1.00 0.00 H TER 425 WAT 7686 ATOM 425 O WAT 7687 49.741 71.691 0.413 1.00 0.00 O ATOM 426 H1 WAT 7687 50.087 71.728 -0.478 1.00 0.00 H ATOM 427 H2 WAT 7687 49.849 70.777 0.675 1.00 0.00 H TER 429 WAT 7687 ATOM 429 O WAT 7688 44.204 103.428 65.749 1.00 0.00 O ATOM 430 H1 WAT 7688 44.636 103.582 64.910 1.00 0.00 H ATOM 431 H2 WAT 7688 43.358 103.044 65.517 1.00 0.00 H TER 433 WAT 7688 ATOM 433 O WAT 7689 25.036 104.889 135.387 1.00 0.00 O ATOM 434 H1 WAT 7689 24.636 104.455 134.633 1.00 0.00 H ATOM 435 H2 WAT 7689 24.312 105.022 135.999 1.00 0.00 H TER 437 WAT 7689 ATOM 437 O WAT 7690 38.907 24.610 18.048 1.00 0.00 O ATOM 438 H1 WAT 7690 38.290 25.022 17.443 1.00 0.00 H ATOM 439 H2 WAT 7690 39.306 25.343 18.518 1.00 0.00 H TER 441 WAT 7690 ATOM 441 O WAT 7691 121.907 26.285 117.891 1.00 0.00 O ATOM 442 H1 WAT 7691 121.691 26.533 118.790 1.00 0.00 H ATOM 443 H2 WAT 7691 122.557 25.589 117.984 1.00 0.00 H TER 445 WAT 7691 ATOM 445 O WAT 7692 19.108 122.162 12.698 1.00 0.00 O ATOM 446 H1 WAT 7692 19.649 122.332 11.927 1.00 0.00 H ATOM 447 H2 WAT 7692 19.461 122.744 13.371 1.00 0.00 H TER 449 WAT 7692 ATOM 449 O WAT 7693 145.487 53.389 135.097 1.00 0.00 O ATOM 450 H1 WAT 7693 146.100 53.871 134.542 1.00 0.00 H ATOM 451 H2 WAT 7693 144.634 53.522 134.684 1.00 0.00 H TER 453 WAT 7693 ATOM 453 O WAT 7694 87.058 61.921 135.994 1.00 0.00 O ATOM 454 H1 WAT 7694 87.073 61.833 136.947 1.00 0.00 H ATOM 455 H2 WAT 7694 86.197 61.593 135.737 1.00 0.00 H TER 457 WAT 7694 ATOM 457 O WAT 7695 29.175 47.630 19.743 1.00 0.00 O ATOM 458 H1 WAT 7695 29.203 47.625 20.700 1.00 0.00 H ATOM 459 H2 WAT 7695 28.341 47.214 19.526 1.00 0.00 H TER 461 WAT 7695 ATOM 461 O WAT 7696 140.827 39.964 151.978 1.00 0.00 O ATOM 462 H1 WAT 7696 141.422 40.040 151.231 1.00 0.00 H ATOM 463 H2 WAT 7696 140.252 39.233 151.752 1.00 0.00 H TER 465 WAT 7696 ATOM 465 O WAT 7697 119.527 85.055 111.579 1.00 0.00 O ATOM 466 H1 WAT 7697 118.729 84.884 112.080 1.00 0.00 H ATOM 467 H2 WAT 7697 120.108 85.499 112.198 1.00 0.00 H TER 469 WAT 7697 ATOM 469 O WAT 7698 44.905 20.272 21.413 1.00 0.00 O ATOM 470 H1 WAT 7698 44.575 19.876 20.606 1.00 0.00 H ATOM 471 H2 WAT 7698 45.230 21.131 21.144 1.00 0.00 H TER 473 WAT 7698 ATOM 473 O WAT 7699 88.496 42.798 151.171 1.00 0.00 O ATOM 474 H1 WAT 7699 87.752 42.232 151.375 1.00 0.00 H ATOM 475 H2 WAT 7699 88.350 43.585 151.696 1.00 0.00 H TER 477 WAT 7699 ATOM 477 O WAT 7700 118.111 9.733 95.119 1.00 0.00 O ATOM 478 H1 WAT 7700 117.390 9.275 94.686 1.00 0.00 H ATOM 479 H2 WAT 7700 118.286 9.215 95.905 1.00 0.00 H TER 481 WAT 7700 ATOM 481 O WAT 7701 82.612 67.153 99.181 1.00 0.00 O ATOM 482 H1 WAT 7701 83.311 67.008 99.819 1.00 0.00 H ATOM 483 H2 WAT 7701 81.889 67.511 99.696 1.00 0.00 H TER 485 WAT 7701 ATOM 485 O WAT 7702 16.030 1.260 90.487 1.00 0.00 O ATOM 486 H1 WAT 7702 16.351 2.158 90.573 1.00 0.00 H ATOM 487 H2 WAT 7702 16.567 0.754 91.097 1.00 0.00 H TER 489 WAT 7702 ATOM 489 O WAT 7703 69.568 38.889 128.203 1.00 0.00 O ATOM 490 H1 WAT 7703 70.214 38.218 128.422 1.00 0.00 H ATOM 491 H2 WAT 7703 68.730 38.514 128.476 1.00 0.00 H TER 493 WAT 7703 ATOM 493 O WAT 7704 34.851 24.307 147.000 1.00 0.00 O ATOM 494 H1 WAT 7704 34.573 24.684 146.165 1.00 0.00 H ATOM 495 H2 WAT 7704 34.126 24.486 147.597 1.00 0.00 H TER 497 WAT 7704 ATOM 497 O WAT 7705 64.415 46.365 69.998 1.00 0.00 O ATOM 498 H1 WAT 7705 64.551 45.690 70.663 1.00 0.00 H ATOM 499 H2 WAT 7705 65.153 46.964 70.110 1.00 0.00 H TER 501 WAT 7705 ATOM 501 O WAT 7706 102.040 73.698 126.891 1.00 0.00 O ATOM 502 H1 WAT 7706 101.228 73.473 126.437 1.00 0.00 H ATOM 503 H2 WAT 7706 102.651 73.003 126.647 1.00 0.00 H TER 505 WAT 7706 ATOM 505 O WAT 7707 126.759 28.552 9.669 1.00 0.00 O ATOM 506 H1 WAT 7707 127.114 29.271 10.193 1.00 0.00 H ATOM 507 H2 WAT 7707 125.827 28.535 9.886 1.00 0.00 H TER 509 WAT 7707 ATOM 509 O WAT 7708 75.087 140.400 99.102 1.00 0.00 O ATOM 510 H1 WAT 7708 75.729 140.773 99.706 1.00 0.00 H ATOM 511 H2 WAT 7708 74.535 141.141 98.853 1.00 0.00 H TER 513 WAT 7708 ATOM 513 O WAT 7709 74.737 40.250 63.476 1.00 0.00 O ATOM 514 H1 WAT 7709 74.750 40.870 62.747 1.00 0.00 H ATOM 515 H2 WAT 7709 75.380 40.595 64.095 1.00 0.00 H TER 517 WAT 7709 ATOM 517 O WAT 7710 90.969 22.827 123.415 1.00 0.00 O ATOM 518 H1 WAT 7710 90.173 23.276 123.130 1.00 0.00 H ATOM 519 H2 WAT 7710 90.834 21.914 123.161 1.00 0.00 H TER 521 WAT 7710 ATOM 521 O WAT 7711 85.779 53.470 8.177 1.00 0.00 O ATOM 522 H1 WAT 7711 86.725 53.358 8.085 1.00 0.00 H ATOM 523 H2 WAT 7711 85.659 53.757 9.083 1.00 0.00 H TER 525 WAT 7711 ATOM 525 O WAT 7712 68.288 138.868 15.944 1.00 0.00 O ATOM 526 H1 WAT 7712 67.443 138.568 16.279 1.00 0.00 H ATOM 527 H2 WAT 7712 68.925 138.554 16.585 1.00 0.00 H TER 529 WAT 7712 ATOM 529 O WAT 7713 77.433 116.689 65.848 1.00 0.00 O ATOM 530 H1 WAT 7713 77.807 115.962 66.346 1.00 0.00 H ATOM 531 H2 WAT 7713 76.925 116.268 65.154 1.00 0.00 H TER 533 WAT 7713 ATOM 533 O WAT 7714 35.584 64.613 1.959 1.00 0.00 O ATOM 534 H1 WAT 7714 35.636 63.730 1.592 1.00 0.00 H ATOM 535 H2 WAT 7714 36.447 64.763 2.346 1.00 0.00 H TER 537 WAT 7714 ATOM 537 O WAT 7715 142.333 111.179 121.162 1.00 0.00 O ATOM 538 H1 WAT 7715 141.819 111.934 121.448 1.00 0.00 H ATOM 539 H2 WAT 7715 142.570 111.380 120.256 1.00 0.00 H TER 541 WAT 7715 ATOM 541 O WAT 7716 90.903 80.056 17.619 1.00 0.00 O ATOM 542 H1 WAT 7716 91.857 80.001 17.659 1.00 0.00 H ATOM 543 H2 WAT 7716 90.719 80.402 16.746 1.00 0.00 H TER 545 WAT 7716 ATOM 545 O WAT 7717 1.201 122.755 85.013 1.00 0.00 O ATOM 546 H1 WAT 7717 0.882 123.298 84.292 1.00 0.00 H ATOM 547 H2 WAT 7717 1.940 122.273 84.640 1.00 0.00 H TER 549 WAT 7717 ATOM 549 O WAT 7718 70.694 47.742 156.179 1.00 0.00 O ATOM 550 H1 WAT 7718 71.079 47.121 155.561 1.00 0.00 H ATOM 551 H2 WAT 7718 70.645 47.260 157.004 1.00 0.00 H TER 553 WAT 7718 ATOM 553 O WAT 7719 3.458 15.743 66.020 1.00 0.00 O ATOM 554 H1 WAT 7719 3.122 16.634 66.121 1.00 0.00 H ATOM 555 H2 WAT 7719 4.372 15.799 66.299 1.00 0.00 H TER 557 WAT 7719 ATOM 557 O WAT 7720 25.935 4.685 78.823 1.00 0.00 O ATOM 558 H1 WAT 7720 26.278 3.901 78.392 1.00 0.00 H ATOM 559 H2 WAT 7720 25.011 4.489 78.975 1.00 0.00 H TER 561 WAT 7720 ATOM 561 O WAT 7721 132.766 23.884 76.063 1.00 0.00 O ATOM 562 H1 WAT 7721 133.721 23.941 76.029 1.00 0.00 H ATOM 563 H2 WAT 7721 132.540 23.231 75.400 1.00 0.00 H TER 565 WAT 7721 ATOM 565 O WAT 7722 45.413 13.788 116.470 1.00 0.00 O ATOM 566 H1 WAT 7722 44.645 14.332 116.297 1.00 0.00 H ATOM 567 H2 WAT 7722 45.852 14.220 117.203 1.00 0.00 H TER 569 WAT 7722 ATOM 569 O WAT 7723 47.931 99.089 3.136 1.00 0.00 O ATOM 570 H1 WAT 7723 48.487 99.568 2.522 1.00 0.00 H ATOM 571 H2 WAT 7723 47.221 98.741 2.595 1.00 0.00 H TER 573 WAT 7723 ATOM 573 O WAT 7724 145.599 132.265 145.675 1.00 0.00 O ATOM 574 H1 WAT 7724 146.405 132.165 146.182 1.00 0.00 H ATOM 575 H2 WAT 7724 145.482 131.418 145.244 1.00 0.00 H TER 577 WAT 7724 ATOM 577 O WAT 7725 54.549 20.442 113.260 1.00 0.00 O ATOM 578 H1 WAT 7725 54.330 20.173 114.153 1.00 0.00 H ATOM 579 H2 WAT 7725 55.174 19.784 112.958 1.00 0.00 H TER 581 WAT 7725 ATOM 581 O WAT 7726 41.793 139.893 123.820 1.00 0.00 O ATOM 582 H1 WAT 7726 42.171 139.753 122.951 1.00 0.00 H ATOM 583 H2 WAT 7726 42.550 139.968 124.401 1.00 0.00 H TER 585 WAT 7726 ATOM 585 O WAT 7727 110.388 67.293 86.518 1.00 0.00 O ATOM 586 H1 WAT 7727 109.510 67.209 86.892 1.00 0.00 H ATOM 587 H2 WAT 7727 110.809 67.971 87.046 1.00 0.00 H TER 589 WAT 7727 ATOM 589 O WAT 7728 60.253 12.289 6.350 1.00 0.00 O ATOM 590 H1 WAT 7728 60.469 11.528 6.889 1.00 0.00 H ATOM 591 H2 WAT 7728 59.306 12.234 6.225 1.00 0.00 H TER 593 WAT 7728 ATOM 593 O WAT 7729 130.964 22.159 146.518 1.00 0.00 O ATOM 594 H1 WAT 7729 130.175 21.746 146.167 1.00 0.00 H ATOM 595 H2 WAT 7729 130.641 22.777 147.173 1.00 0.00 H TER 597 WAT 7729 ATOM 597 O WAT 7730 89.807 35.921 118.464 1.00 0.00 O ATOM 598 H1 WAT 7730 90.181 36.593 119.035 1.00 0.00 H ATOM 599 H2 WAT 7730 89.194 35.445 119.025 1.00 0.00 H TER 601 WAT 7730 ATOM 601 O WAT 7731 26.078 38.728 14.652 1.00 0.00 O ATOM 602 H1 WAT 7731 26.414 38.724 13.755 1.00 0.00 H ATOM 603 H2 WAT 7731 25.694 39.599 14.759 1.00 0.00 H TER 605 WAT 7731 ATOM 605 O WAT 7732 90.145 36.661 13.772 1.00 0.00 O ATOM 606 H1 WAT 7732 90.419 36.535 14.681 1.00 0.00 H ATOM 607 H2 WAT 7732 90.735 36.104 13.264 1.00 0.00 H TER 609 WAT 7732 ATOM 609 O WAT 7733 71.056 113.815 90.719 1.00 0.00 O ATOM 610 H1 WAT 7733 70.584 114.298 90.041 1.00 0.00 H ATOM 611 H2 WAT 7733 70.450 113.126 90.988 1.00 0.00 H TER 613 WAT 7733 ATOM 613 O WAT 7734 136.695 110.892 66.860 1.00 0.00 O ATOM 614 H1 WAT 7734 136.537 110.578 65.970 1.00 0.00 H ATOM 615 H2 WAT 7734 136.151 110.331 67.413 1.00 0.00 H TER 617 WAT 7734 ATOM 617 O WAT 7735 48.203 103.151 16.816 1.00 0.00 O ATOM 618 H1 WAT 7735 49.015 103.435 17.237 1.00 0.00 H ATOM 619 H2 WAT 7735 48.375 102.247 16.552 1.00 0.00 H TER 621 WAT 7735 ATOM 621 O WAT 7736 28.747 42.238 15.513 1.00 0.00 O ATOM 622 H1 WAT 7736 28.713 42.609 16.395 1.00 0.00 H ATOM 623 H2 WAT 7736 28.567 41.306 15.638 1.00 0.00 H TER 625 WAT 7736 ATOM 625 O WAT 7737 103.623 30.786 27.633 1.00 0.00 O ATOM 626 H1 WAT 7737 104.211 31.535 27.729 1.00 0.00 H ATOM 627 H2 WAT 7737 102.747 31.153 27.755 1.00 0.00 H TER 629 WAT 7737 ATOM 629 O WAT 7738 3.213 87.394 126.120 1.00 0.00 O ATOM 630 H1 WAT 7738 3.239 86.643 125.527 1.00 0.00 H ATOM 631 H2 WAT 7738 3.275 87.011 126.995 1.00 0.00 H TER 633 WAT 7738 ATOM 633 O WAT 7739 35.268 78.671 141.516 1.00 0.00 O ATOM 634 H1 WAT 7739 34.938 79.312 142.145 1.00 0.00 H ATOM 635 H2 WAT 7739 35.726 79.194 140.858 1.00 0.00 H TER 637 WAT 7739 ATOM 637 O WAT 7740 33.069 62.648 0.911 1.00 0.00 O ATOM 638 H1 WAT 7740 33.608 61.948 1.279 1.00 0.00 H ATOM 639 H2 WAT 7740 32.613 63.021 1.666 1.00 0.00 H TER 641 WAT 7740 ATOM 641 O WAT 7741 47.634 84.044 102.731 1.00 0.00 O ATOM 642 H1 WAT 7741 48.518 83.927 102.384 1.00 0.00 H ATOM 643 H2 WAT 7741 47.104 83.400 102.260 1.00 0.00 H TER 645 WAT 7741 ATOM 645 O WAT 7742 18.413 73.960 121.902 1.00 0.00 O ATOM 646 H1 WAT 7742 18.510 73.924 120.950 1.00 0.00 H ATOM 647 H2 WAT 7742 18.246 73.053 122.160 1.00 0.00 H TER 649 WAT 7742 ATOM 649 O WAT 7743 66.044 5.336 80.359 1.00 0.00 O ATOM 650 H1 WAT 7743 65.284 5.403 79.780 1.00 0.00 H ATOM 651 H2 WAT 7743 65.675 5.101 81.211 1.00 0.00 H TER 653 WAT 7743 ATOM 653 O WAT 7744 137.833 143.181 82.009 1.00 0.00 O ATOM 654 H1 WAT 7744 138.059 142.783 82.850 1.00 0.00 H ATOM 655 H2 WAT 7744 138.475 142.824 81.395 1.00 0.00 H TER 657 WAT 7744 ATOM 657 O WAT 7745 102.289 2.757 76.694 1.00 0.00 O ATOM 658 H1 WAT 7745 102.759 2.744 75.860 1.00 0.00 H ATOM 659 H2 WAT 7745 102.824 2.219 77.278 1.00 0.00 H TER 661 WAT 7745 ATOM 661 O WAT 7746 4.748 43.316 128.577 1.00 0.00 O ATOM 662 H1 WAT 7746 3.887 43.703 128.733 1.00 0.00 H ATOM 663 H2 WAT 7746 4.857 43.349 127.627 1.00 0.00 H TER 665 WAT 7746 ATOM 665 O WAT 7747 137.129 127.850 128.584 1.00 0.00 O ATOM 666 H1 WAT 7747 136.773 127.370 127.836 1.00 0.00 H ATOM 667 H2 WAT 7747 137.507 127.172 129.145 1.00 0.00 H TER 669 WAT 7747 ATOM 669 O WAT 7748 55.360 29.799 127.938 1.00 0.00 O ATOM 670 H1 WAT 7748 54.485 29.585 127.613 1.00 0.00 H ATOM 671 H2 WAT 7748 55.244 29.910 128.882 1.00 0.00 H TER 673 WAT 7748 ATOM 673 O WAT 7749 96.512 98.535 7.463 1.00 0.00 O ATOM 674 H1 WAT 7749 95.958 98.388 8.230 1.00 0.00 H ATOM 675 H2 WAT 7749 97.182 97.854 7.517 1.00 0.00 H TER 677 WAT 7749 ATOM 677 O WAT 7750 88.593 128.844 129.110 1.00 0.00 O ATOM 678 H1 WAT 7750 89.331 129.395 128.851 1.00 0.00 H ATOM 679 H2 WAT 7750 88.989 127.999 129.326 1.00 0.00 H TER 681 WAT 7750 ATOM 681 O WAT 7751 65.243 43.083 123.819 1.00 0.00 O ATOM 682 H1 WAT 7751 64.434 42.682 124.138 1.00 0.00 H ATOM 683 H2 WAT 7751 65.900 42.854 124.477 1.00 0.00 H TER 685 WAT 7751 ATOM 685 O WAT 7752 8.605 80.762 97.083 1.00 0.00 O ATOM 686 H1 WAT 7752 9.018 81.451 96.563 1.00 0.00 H ATOM 687 H2 WAT 7752 9.054 79.959 96.818 1.00 0.00 H TER 689 WAT 7752 ATOM 689 O WAT 7753 135.611 26.546 154.375 1.00 0.00 O ATOM 690 H1 WAT 7753 135.980 26.041 153.650 1.00 0.00 H ATOM 691 H2 WAT 7753 134.665 26.508 154.235 1.00 0.00 H TER 693 WAT 7753 ATOM 693 O WAT 7754 67.565 89.245 119.811 1.00 0.00 O ATOM 694 H1 WAT 7754 66.701 89.383 119.423 1.00 0.00 H ATOM 695 H2 WAT 7754 67.754 90.063 120.272 1.00 0.00 H TER 697 WAT 7754 ATOM 697 O WAT 7755 108.703 13.794 11.437 1.00 0.00 O ATOM 698 H1 WAT 7755 108.631 13.565 12.364 1.00 0.00 H ATOM 699 H2 WAT 7755 109.536 14.260 11.369 1.00 0.00 H TER 701 WAT 7755 ATOM 701 O WAT 7756 127.055 99.066 130.365 1.00 0.00 O ATOM 702 H1 WAT 7756 126.267 98.771 129.908 1.00 0.00 H ATOM 703 H2 WAT 7756 127.706 98.389 130.180 1.00 0.00 H TER 705 WAT 7756 ATOM 705 O WAT 7757 44.157 76.656 103.614 1.00 0.00 O ATOM 706 H1 WAT 7757 44.793 77.180 103.127 1.00 0.00 H ATOM 707 H2 WAT 7757 43.410 76.572 103.022 1.00 0.00 H TER 709 WAT 7757 ATOM 709 O WAT 7758 130.911 53.559 20.611 1.00 0.00 O ATOM 710 H1 WAT 7758 131.346 53.249 21.405 1.00 0.00 H ATOM 711 H2 WAT 7758 130.088 53.072 20.583 1.00 0.00 H TER 713 WAT 7758 ATOM 713 O WAT 7759 52.015 103.777 146.579 1.00 0.00 O ATOM 714 H1 WAT 7759 52.306 103.291 147.351 1.00 0.00 H ATOM 715 H2 WAT 7759 51.239 104.253 146.874 1.00 0.00 H TER 717 WAT 7759 ATOM 717 O WAT 7760 75.623 51.002 20.243 1.00 0.00 O ATOM 718 H1 WAT 7760 74.741 50.695 20.451 1.00 0.00 H ATOM 719 H2 WAT 7760 76.020 51.185 21.095 1.00 0.00 H TER 721 WAT 7760 ATOM 721 O WAT 7761 51.104 7.055 95.749 1.00 0.00 O ATOM 722 H1 WAT 7761 51.068 6.138 96.022 1.00 0.00 H ATOM 723 H2 WAT 7761 51.878 7.108 95.188 1.00 0.00 H TER 725 WAT 7761 ATOM 725 O WAT 7762 6.670 106.652 60.593 1.00 0.00 O ATOM 726 H1 WAT 7762 6.868 107.050 59.745 1.00 0.00 H ATOM 727 H2 WAT 7762 5.816 106.237 60.468 1.00 0.00 H TER 729 WAT 7762 ATOM 729 O WAT 7763 141.672 114.010 151.732 1.00 0.00 O ATOM 730 H1 WAT 7763 142.297 114.665 152.044 1.00 0.00 H ATOM 731 H2 WAT 7763 141.215 113.720 152.521 1.00 0.00 H TER 733 WAT 7763 ATOM 733 O WAT 7764 59.312 129.419 157.435 1.00 0.00 O ATOM 734 H1 WAT 7764 59.253 128.719 156.785 1.00 0.00 H ATOM 735 H2 WAT 7764 58.931 129.042 158.228 1.00 0.00 H TER 737 WAT 7764 ATOM 737 O WAT 7765 131.881 109.796 87.577 1.00 0.00 O ATOM 738 H1 WAT 7765 130.983 109.488 87.454 1.00 0.00 H ATOM 739 H2 WAT 7765 132.422 109.018 87.444 1.00 0.00 H TER 741 WAT 7765 ATOM 741 O WAT 7766 45.046 116.067 13.920 1.00 0.00 O ATOM 742 H1 WAT 7766 45.950 116.226 13.650 1.00 0.00 H ATOM 743 H2 WAT 7766 44.653 116.938 13.966 1.00 0.00 H TER 745 WAT 7766 ATOM 745 O WAT 7767 27.062 105.108 61.399 1.00 0.00 O ATOM 746 H1 WAT 7767 27.216 104.387 60.788 1.00 0.00 H ATOM 747 H2 WAT 7767 26.110 105.151 61.483 1.00 0.00 H TER 749 WAT 7767 ATOM 749 O WAT 7768 135.512 84.548 9.646 1.00 0.00 O ATOM 750 H1 WAT 7768 135.068 85.195 10.194 1.00 0.00 H ATOM 751 H2 WAT 7768 135.872 85.056 8.919 1.00 0.00 H TER 753 WAT 7768 ATOM 753 O WAT 7769 109.912 6.753 1.568 1.00 0.00 O ATOM 754 H1 WAT 7769 109.109 6.763 1.047 1.00 0.00 H ATOM 755 H2 WAT 7769 110.071 7.672 1.781 1.00 0.00 H TER 757 WAT 7769 ATOM 757 O WAT 7770 102.628 111.742 104.284 1.00 0.00 O ATOM 758 H1 WAT 7770 102.201 111.263 103.573 1.00 0.00 H ATOM 759 H2 WAT 7770 101.942 111.858 104.941 1.00 0.00 H TER 761 WAT 7770 ATOM 761 O WAT 7771 74.404 65.001 92.023 1.00 0.00 O ATOM 762 H1 WAT 7771 73.720 65.300 91.424 1.00 0.00 H ATOM 763 H2 WAT 7771 74.284 64.052 92.070 1.00 0.00 H TER 765 WAT 7771 ATOM 765 O WAT 7772 76.203 16.310 66.655 1.00 0.00 O ATOM 766 H1 WAT 7772 75.313 16.119 66.951 1.00 0.00 H ATOM 767 H2 WAT 7772 76.720 16.346 67.460 1.00 0.00 H TER 769 WAT 7772 ATOM 769 O WAT 7773 26.715 96.782 114.552 1.00 0.00 O ATOM 770 H1 WAT 7773 27.158 96.878 113.709 1.00 0.00 H ATOM 771 H2 WAT 7773 27.410 96.533 115.161 1.00 0.00 H TER 773 WAT 7773 ATOM 773 O WAT 7774 72.788 50.431 25.853 1.00 0.00 O ATOM 774 H1 WAT 7774 72.394 49.937 26.572 1.00 0.00 H ATOM 775 H2 WAT 7774 72.813 49.813 25.123 1.00 0.00 H TER 777 WAT 7774 ATOM 777 O WAT 7775 124.970 125.968 135.214 1.00 0.00 O ATOM 778 H1 WAT 7775 125.307 125.509 134.445 1.00 0.00 H ATOM 779 H2 WAT 7775 124.022 125.842 135.173 1.00 0.00 H TER 781 WAT 7775 ATOM 781 O WAT 7776 43.542 29.005 130.046 1.00 0.00 O ATOM 782 H1 WAT 7776 44.101 29.050 130.822 1.00 0.00 H ATOM 783 H2 WAT 7776 43.959 29.592 129.416 1.00 0.00 H TER 785 WAT 7776 ATOM 785 O WAT 7777 95.811 129.058 149.512 1.00 0.00 O ATOM 786 H1 WAT 7777 95.317 128.629 148.813 1.00 0.00 H ATOM 787 H2 WAT 7777 95.897 128.389 150.191 1.00 0.00 H TER 789 WAT 7777 ATOM 789 O WAT 7778 79.412 66.000 131.748 1.00 0.00 O ATOM 790 H1 WAT 7778 80.360 65.873 131.773 1.00 0.00 H ATOM 791 H2 WAT 7778 79.260 66.514 130.955 1.00 0.00 H TER 793 WAT 7778 ATOM 793 O WAT 7779 71.558 43.885 79.209 1.00 0.00 O ATOM 794 H1 WAT 7779 71.811 44.472 78.497 1.00 0.00 H ATOM 795 H2 WAT 7779 71.810 44.352 80.006 1.00 0.00 H TER 797 WAT 7779 ATOM 797 O WAT 7780 111.684 20.729 4.624 1.00 0.00 O ATOM 798 H1 WAT 7780 111.415 21.469 4.078 1.00 0.00 H ATOM 799 H2 WAT 7780 111.345 19.959 4.167 1.00 0.00 H TER 801 WAT 7780 ATOM 801 O WAT 7781 89.204 118.088 18.681 1.00 0.00 O ATOM 802 H1 WAT 7781 89.198 117.691 19.552 1.00 0.00 H ATOM 803 H2 WAT 7781 88.280 118.247 18.484 1.00 0.00 H TER 805 WAT 7781 ATOM 805 O WAT 7782 10.437 93.938 152.653 1.00 0.00 O ATOM 806 H1 WAT 7782 11.382 94.040 152.532 1.00 0.00 H ATOM 807 H2 WAT 7782 10.274 93.009 152.495 1.00 0.00 H TER 809 WAT 7782 ATOM 809 O WAT 7783 78.223 7.308 76.916 1.00 0.00 O ATOM 810 H1 WAT 7783 77.658 8.041 77.159 1.00 0.00 H ATOM 811 H2 WAT 7783 78.883 7.274 77.608 1.00 0.00 H TER 813 WAT 7783 ATOM 813 O WAT 7784 33.442 3.453 150.806 1.00 0.00 O ATOM 814 H1 WAT 7784 34.012 2.715 150.586 1.00 0.00 H ATOM 815 H2 WAT 7784 33.439 3.476 151.763 1.00 0.00 H TER 817 WAT 7784 ATOM 817 O WAT 7785 28.368 1.605 135.511 1.00 0.00 O ATOM 818 H1 WAT 7785 28.897 1.065 134.924 1.00 0.00 H ATOM 819 H2 WAT 7785 27.464 1.365 135.307 1.00 0.00 H TER 821 WAT 7785 ATOM 821 O WAT 7786 138.326 67.593 108.698 1.00 0.00 O ATOM 822 H1 WAT 7786 138.208 68.521 108.493 1.00 0.00 H ATOM 823 H2 WAT 7786 138.754 67.590 109.554 1.00 0.00 H TER 825 WAT 7786 ATOM 825 O WAT 7787 94.590 2.348 11.473 1.00 0.00 O ATOM 826 H1 WAT 7787 94.880 2.162 10.580 1.00 0.00 H ATOM 827 H2 WAT 7787 94.694 1.517 11.936 1.00 0.00 H TER 829 WAT 7787 ATOM 829 O WAT 7788 136.847 102.927 108.863 1.00 0.00 O ATOM 830 H1 WAT 7788 136.386 103.647 109.293 1.00 0.00 H ATOM 831 H2 WAT 7788 136.296 102.160 109.023 1.00 0.00 H TER 833 WAT 7788 ATOM 833 O WAT 7789 4.165 24.603 61.818 1.00 0.00 O ATOM 834 H1 WAT 7789 4.751 25.309 61.546 1.00 0.00 H ATOM 835 H2 WAT 7789 4.031 24.084 61.026 1.00 0.00 H TER 837 WAT 7789 ATOM 837 O WAT 7790 47.777 43.462 119.077 1.00 0.00 O ATOM 838 H1 WAT 7790 47.543 44.068 118.375 1.00 0.00 H ATOM 839 H2 WAT 7790 48.731 43.393 119.027 1.00 0.00 H TER 841 WAT 7790 ATOM 841 O WAT 7791 137.002 85.659 77.345 1.00 0.00 O ATOM 842 H1 WAT 7791 136.622 86.086 78.113 1.00 0.00 H ATOM 843 H2 WAT 7791 137.893 86.003 77.295 1.00 0.00 H TER 845 WAT 7791 ATOM 845 O WAT 7792 81.899 6.655 13.660 1.00 0.00 O ATOM 846 H1 WAT 7792 81.981 7.150 14.475 1.00 0.00 H ATOM 847 H2 WAT 7792 82.802 6.479 13.396 1.00 0.00 H TER 849 WAT 7792 ATOM 849 O WAT 7793 138.336 16.961 75.211 1.00 0.00 O ATOM 850 H1 WAT 7793 138.189 17.501 75.988 1.00 0.00 H ATOM 851 H2 WAT 7793 139.247 17.131 74.970 1.00 0.00 H TER 853 WAT 7793 ATOM 853 O WAT 7794 104.332 51.666 64.019 1.00 0.00 O ATOM 854 H1 WAT 7794 104.697 51.980 64.846 1.00 0.00 H ATOM 855 H2 WAT 7794 103.392 51.600 64.181 1.00 0.00 H TER 857 WAT 7794 ATOM 857 O WAT 7795 107.228 23.429 148.001 1.00 0.00 O ATOM 858 H1 WAT 7795 106.349 23.219 148.318 1.00 0.00 H ATOM 859 H2 WAT 7795 107.741 22.640 148.178 1.00 0.00 H TER 861 WAT 7795 ATOM 861 O WAT 7796 139.915 44.640 60.801 1.00 0.00 O ATOM 862 H1 WAT 7796 139.202 45.278 60.796 1.00 0.00 H ATOM 863 H2 WAT 7796 140.671 45.128 61.128 1.00 0.00 H TER 865 WAT 7796 ATOM 865 O WAT 7797 95.500 85.694 116.811 1.00 0.00 O ATOM 866 H1 WAT 7797 95.584 85.609 117.761 1.00 0.00 H ATOM 867 H2 WAT 7797 96.399 85.796 116.499 1.00 0.00 H TER 869 WAT 7797 ATOM 869 O WAT 7798 11.755 48.066 1.488 1.00 0.00 O ATOM 870 H1 WAT 7798 11.005 47.793 0.961 1.00 0.00 H ATOM 871 H2 WAT 7798 11.378 48.621 2.171 1.00 0.00 H TER 873 WAT 7798 ATOM 873 O WAT 7799 104.219 122.364 138.517 1.00 0.00 O ATOM 874 H1 WAT 7799 105.004 122.771 138.884 1.00 0.00 H ATOM 875 H2 WAT 7799 103.860 123.026 137.926 1.00 0.00 H TER 877 WAT 7799 ATOM 877 O WAT 7800 77.742 54.115 11.063 1.00 0.00 O ATOM 878 H1 WAT 7800 76.843 54.171 11.387 1.00 0.00 H ATOM 879 H2 WAT 7800 77.718 53.412 10.413 1.00 0.00 H TER 881 WAT 7800 ATOM 881 O WAT 7801 51.532 21.121 102.564 1.00 0.00 O ATOM 882 H1 WAT 7801 52.217 20.453 102.549 1.00 0.00 H ATOM 883 H2 WAT 7801 51.820 21.774 101.926 1.00 0.00 H TER 885 WAT 7801 ATOM 885 O WAT 7802 33.946 36.222 138.043 1.00 0.00 O ATOM 886 H1 WAT 7802 33.829 36.579 138.924 1.00 0.00 H ATOM 887 H2 WAT 7802 33.092 36.332 137.624 1.00 0.00 H TER 889 WAT 7802 ATOM 889 O WAT 7803 23.344 50.326 65.599 1.00 0.00 O ATOM 890 H1 WAT 7803 23.946 49.582 65.585 1.00 0.00 H ATOM 891 H2 WAT 7803 23.901 51.081 65.790 1.00 0.00 H TER 893 WAT 7803 ATOM 893 O WAT 7804 128.894 23.439 2.624 1.00 0.00 O ATOM 894 H1 WAT 7804 128.695 24.227 3.130 1.00 0.00 H ATOM 895 H2 WAT 7804 128.147 23.338 2.034 1.00 0.00 H TER 897 WAT 7804 ATOM 897 O WAT 7805 20.876 54.057 98.973 1.00 0.00 O ATOM 898 H1 WAT 7805 21.645 53.487 98.979 1.00 0.00 H ATOM 899 H2 WAT 7805 20.194 53.533 98.553 1.00 0.00 H TER 901 WAT 7805 ATOM 901 O WAT 7806 80.794 33.229 125.397 1.00 0.00 O ATOM 902 H1 WAT 7806 79.887 32.934 125.309 1.00 0.00 H ATOM 903 H2 WAT 7806 80.743 33.987 125.981 1.00 0.00 H TER 905 WAT 7806 ATOM 905 O WAT 7807 63.096 10.141 140.730 1.00 0.00 O ATOM 906 H1 WAT 7807 63.503 10.349 139.889 1.00 0.00 H ATOM 907 H2 WAT 7807 63.665 10.554 141.379 1.00 0.00 H TER 909 WAT 7807 ATOM 909 O WAT 7808 39.196 66.388 126.274 1.00 0.00 O ATOM 910 H1 WAT 7808 38.923 67.305 126.244 1.00 0.00 H ATOM 911 H2 WAT 7808 38.691 65.965 125.579 1.00 0.00 H TER 913 WAT 7808 ATOM 913 O WAT 7809 115.925 96.092 7.855 1.00 0.00 O ATOM 914 H1 WAT 7809 115.303 95.673 7.259 1.00 0.00 H ATOM 915 H2 WAT 7809 115.421 96.791 8.273 1.00 0.00 H TER 917 WAT 7809 ATOM 917 O WAT 7810 73.614 60.555 139.086 1.00 0.00 O ATOM 918 H1 WAT 7810 74.050 61.352 139.389 1.00 0.00 H ATOM 919 H2 WAT 7810 72.680 60.743 139.179 1.00 0.00 H TER 921 WAT 7810 ATOM 921 O WAT 7811 90.957 116.823 121.351 1.00 0.00 O ATOM 922 H1 WAT 7811 90.629 116.479 122.182 1.00 0.00 H ATOM 923 H2 WAT 7811 90.170 117.083 120.872 1.00 0.00 H TER 925 WAT 7811 ATOM 925 O WAT 7812 93.092 122.377 144.724 1.00 0.00 O ATOM 926 H1 WAT 7812 92.990 122.104 145.635 1.00 0.00 H ATOM 927 H2 WAT 7812 94.036 122.486 144.611 1.00 0.00 H TER 929 WAT 7812 ATOM 929 O WAT 7813 139.414 14.928 9.799 1.00 0.00 O ATOM 930 H1 WAT 7813 139.620 15.514 10.527 1.00 0.00 H ATOM 931 H2 WAT 7813 139.606 14.052 10.134 1.00 0.00 H TER 933 WAT 7813 ATOM 933 O WAT 7814 144.307 136.764 152.890 1.00 0.00 O ATOM 934 H1 WAT 7814 144.786 137.301 152.259 1.00 0.00 H ATOM 935 H2 WAT 7814 143.795 136.161 152.351 1.00 0.00 H TER 937 WAT 7814 ATOM 937 O WAT 7815 82.172 137.836 13.172 1.00 0.00 O ATOM 938 H1 WAT 7815 82.905 138.333 12.809 1.00 0.00 H ATOM 939 H2 WAT 7815 82.585 137.129 13.668 1.00 0.00 H TER 941 WAT 7815 ATOM 941 O WAT 7816 21.355 57.927 77.187 1.00 0.00 O ATOM 942 H1 WAT 7816 21.323 58.030 76.236 1.00 0.00 H ATOM 943 H2 WAT 7816 20.906 57.098 77.353 1.00 0.00 H TER 945 WAT 7816 ATOM 945 O WAT 7817 90.561 126.849 112.928 1.00 0.00 O ATOM 946 H1 WAT 7817 90.898 127.215 113.746 1.00 0.00 H ATOM 947 H2 WAT 7817 91.232 127.058 112.279 1.00 0.00 H TER 949 WAT 7817 ATOM 949 O WAT 7818 65.214 142.302 137.871 1.00 0.00 O ATOM 950 H1 WAT 7818 65.722 142.853 138.466 1.00 0.00 H ATOM 951 H2 WAT 7818 64.393 142.778 137.745 1.00 0.00 H TER 953 WAT 7818 ATOM 953 O WAT 7819 55.561 22.027 64.352 1.00 0.00 O ATOM 954 H1 WAT 7819 56.111 22.692 63.937 1.00 0.00 H ATOM 955 H2 WAT 7819 55.450 21.355 63.680 1.00 0.00 H TER 957 WAT 7819 ATOM 957 O WAT 7820 96.376 126.301 94.087 1.00 0.00 O ATOM 958 H1 WAT 7820 97.188 126.725 93.809 1.00 0.00 H ATOM 959 H2 WAT 7820 96.067 125.842 93.306 1.00 0.00 H TER 961 WAT 7820 ATOM 961 O WAT 7821 111.311 71.252 13.397 1.00 0.00 O ATOM 962 H1 WAT 7821 111.654 72.143 13.458 1.00 0.00 H ATOM 963 H2 WAT 7821 112.026 70.745 13.012 1.00 0.00 H TER 965 WAT 7821 ATOM 965 O WAT 7822 21.022 135.610 130.018 1.00 0.00 O ATOM 966 H1 WAT 7822 20.692 135.859 129.155 1.00 0.00 H ATOM 967 H2 WAT 7822 21.972 135.701 129.947 1.00 0.00 H TER 969 WAT 7822 ATOM 969 O WAT 7823 78.397 74.029 96.286 1.00 0.00 O ATOM 970 H1 WAT 7823 79.268 74.383 96.462 1.00 0.00 H ATOM 971 H2 WAT 7823 78.394 73.856 95.345 1.00 0.00 H TER 973 WAT 7823 ATOM 973 O WAT 7824 111.285 0.923 121.509 1.00 0.00 O ATOM 974 H1 WAT 7824 111.984 0.796 120.868 1.00 0.00 H ATOM 975 H2 WAT 7824 110.920 1.783 121.299 1.00 0.00 H TER 977 WAT 7824 ATOM 977 O WAT 7825 65.870 126.501 142.948 1.00 0.00 O ATOM 978 H1 WAT 7825 65.046 126.907 142.679 1.00 0.00 H ATOM 979 H2 WAT 7825 65.956 125.734 142.382 1.00 0.00 H TER 981 WAT 7825 ATOM 981 O WAT 7826 126.091 25.000 98.029 1.00 0.00 O ATOM 982 H1 WAT 7826 126.424 25.886 97.890 1.00 0.00 H ATOM 983 H2 WAT 7826 126.801 24.546 98.484 1.00 0.00 H TER 985 WAT 7826 ATOM 985 O WAT 7827 108.849 15.171 99.451 1.00 0.00 O ATOM 986 H1 WAT 7827 108.315 14.638 98.862 1.00 0.00 H ATOM 987 H2 WAT 7827 108.781 14.733 100.299 1.00 0.00 H TER 989 WAT 7827 ATOM 989 O WAT 7828 24.490 89.753 67.384 1.00 0.00 O ATOM 990 H1 WAT 7828 24.998 90.440 67.816 1.00 0.00 H ATOM 991 H2 WAT 7828 23.659 90.173 67.162 1.00 0.00 H TER 993 WAT 7828 ATOM 993 O WAT 7829 37.134 67.851 83.578 1.00 0.00 O ATOM 994 H1 WAT 7829 37.121 66.938 83.291 1.00 0.00 H ATOM 995 H2 WAT 7829 38.047 68.120 83.478 1.00 0.00 H TER 997 WAT 7829 ATOM 997 O WAT 7830 4.139 79.010 82.933 1.00 0.00 O ATOM 998 H1 WAT 7830 3.565 79.035 83.698 1.00 0.00 H ATOM 999 H2 WAT 7830 3.654 79.480 82.254 1.00 0.00 H TER 1001 WAT 7830 ATOM 1001 O WAT 7831 29.402 145.512 63.816 1.00 0.00 O ATOM 1002 H1 WAT 7831 29.519 146.411 63.508 1.00 0.00 H ATOM 1003 H2 WAT 7831 28.504 145.290 63.571 1.00 0.00 H TER 1005 WAT 7831 ATOM 1005 O WAT 7832 111.478 25.678 106.746 1.00 0.00 O ATOM 1006 H1 WAT 7832 112.153 26.247 106.376 1.00 0.00 H ATOM 1007 H2 WAT 7832 110.901 25.479 106.008 1.00 0.00 H TER 1009 WAT 7832 ATOM 1009 O WAT 7833 51.074 78.391 123.404 1.00 0.00 O ATOM 1010 H1 WAT 7833 51.395 77.922 124.175 1.00 0.00 H ATOM 1011 H2 WAT 7833 51.758 79.032 123.212 1.00 0.00 H TER 1013 WAT 7833 ATOM 1013 O WAT 7834 101.445 35.973 152.245 1.00 0.00 O ATOM 1014 H1 WAT 7834 101.914 35.843 151.420 1.00 0.00 H ATOM 1015 H2 WAT 7834 101.405 35.100 152.637 1.00 0.00 H TER 1017 WAT 7834 ATOM 1017 O WAT 7835 68.235 29.710 148.038 1.00 0.00 O ATOM 1018 H1 WAT 7835 68.851 30.415 147.837 1.00 0.00 H ATOM 1019 H2 WAT 7835 68.782 28.927 148.102 1.00 0.00 H TER 1021 WAT 7835 ATOM 1021 O WAT 7836 134.566 128.671 -0.203 1.00 0.00 O ATOM 1022 H1 WAT 7836 134.820 129.499 0.203 1.00 0.00 H ATOM 1023 H2 WAT 7836 135.138 128.020 0.203 1.00 0.00 H TER 1025 WAT 7836 ATOM 1025 O WAT 7837 109.183 46.755 134.660 1.00 0.00 O ATOM 1026 H1 WAT 7837 110.031 46.787 135.103 1.00 0.00 H ATOM 1027 H2 WAT 7837 108.556 47.048 135.322 1.00 0.00 H TER 1029 WAT 7837 ATOM 1029 O WAT 7838 27.824 100.629 150.192 1.00 0.00 O ATOM 1030 H1 WAT 7838 27.139 99.964 150.124 1.00 0.00 H ATOM 1031 H2 WAT 7838 28.525 100.309 149.625 1.00 0.00 H TER 1033 WAT 7838 ATOM 1033 O WAT 7839 5.856 126.769 11.723 1.00 0.00 O ATOM 1034 H1 WAT 7839 6.428 127.384 12.183 1.00 0.00 H ATOM 1035 H2 WAT 7839 5.095 127.293 11.473 1.00 0.00 H TER 1037 WAT 7839 ATOM 1037 O WAT 7840 140.264 24.186 89.786 1.00 0.00 O ATOM 1038 H1 WAT 7840 139.683 23.670 90.346 1.00 0.00 H ATOM 1039 H2 WAT 7840 140.613 23.555 89.157 1.00 0.00 H TER 1041 WAT 7840 ATOM 1041 O WAT 7841 125.978 80.963 147.957 1.00 0.00 O ATOM 1042 H1 WAT 7841 125.364 80.337 148.340 1.00 0.00 H ATOM 1043 H2 WAT 7841 126.743 80.437 147.726 1.00 0.00 H TER 1045 WAT 7841 ATOM 1045 O WAT 7842 51.118 27.374 60.207 1.00 0.00 O ATOM 1046 H1 WAT 7842 51.658 26.833 59.630 1.00 0.00 H ATOM 1047 H2 WAT 7842 50.282 27.453 59.748 1.00 0.00 H TER 1049 WAT 7842 ATOM 1049 O WAT 7843 129.354 75.089 20.706 1.00 0.00 O ATOM 1050 H1 WAT 7843 130.305 75.050 20.805 1.00 0.00 H ATOM 1051 H2 WAT 7843 129.181 74.641 19.878 1.00 0.00 H TER 1053 WAT 7843 ATOM 1053 O WAT 7844 71.103 79.815 127.619 1.00 0.00 O ATOM 1054 H1 WAT 7844 71.464 80.162 126.802 1.00 0.00 H ATOM 1055 H2 WAT 7844 70.521 79.107 127.342 1.00 0.00 H TER 1057 WAT 7844 ATOM 1057 O WAT 7845 1.060 114.572 128.227 1.00 0.00 O ATOM 1058 H1 WAT 7845 0.521 114.259 128.954 1.00 0.00 H ATOM 1059 H2 WAT 7845 0.942 115.522 128.234 1.00 0.00 H TER 1061 WAT 7845 ATOM 1061 O WAT 7846 67.643 8.765 49.873 1.00 0.00 O ATOM 1062 H1 WAT 7846 67.234 9.541 50.257 1.00 0.00 H ATOM 1063 H2 WAT 7846 67.335 8.756 48.967 1.00 0.00 H TER 1065 WAT 7846 ATOM 1065 O WAT 7847 113.360 15.815 9.847 1.00 0.00 O ATOM 1066 H1 WAT 7847 113.492 16.756 9.738 1.00 0.00 H ATOM 1067 H2 WAT 7847 113.038 15.518 8.995 1.00 0.00 H TER 1069 WAT 7847 ATOM 1069 O WAT 7848 29.229 49.785 141.852 1.00 0.00 O ATOM 1070 H1 WAT 7848 29.526 50.689 141.743 1.00 0.00 H ATOM 1071 H2 WAT 7848 28.784 49.578 141.030 1.00 0.00 H TER 1073 WAT 7848 ATOM 1073 O WAT 7849 52.754 83.520 86.196 1.00 0.00 O ATOM 1074 H1 WAT 7849 52.891 82.791 85.590 1.00 0.00 H ATOM 1075 H2 WAT 7849 52.131 84.091 85.747 1.00 0.00 H TER 1077 WAT 7849 ATOM 1077 O WAT 7850 133.057 35.103 88.915 1.00 0.00 O ATOM 1078 H1 WAT 7850 133.794 35.134 89.525 1.00 0.00 H ATOM 1079 H2 WAT 7850 133.303 35.703 88.211 1.00 0.00 H TER 1081 WAT 7850 ATOM 1081 O WAT 7851 76.903 17.834 128.067 1.00 0.00 O ATOM 1082 H1 WAT 7851 76.612 18.592 127.559 1.00 0.00 H ATOM 1083 H2 WAT 7851 77.338 18.212 128.831 1.00 0.00 H TER 1085 WAT 7851 ATOM 1085 O WAT 7852 93.018 29.058 83.668 1.00 0.00 O ATOM 1086 H1 WAT 7852 92.533 29.873 83.802 1.00 0.00 H ATOM 1087 H2 WAT 7852 93.932 29.334 83.595 1.00 0.00 H TER 1089 WAT 7852 ATOM 1089 O WAT 7853 74.133 128.026 131.934 1.00 0.00 O ATOM 1090 H1 WAT 7853 73.819 128.564 131.208 1.00 0.00 H ATOM 1091 H2 WAT 7853 73.387 127.969 132.531 1.00 0.00 H TER 1093 WAT 7853 ATOM 1093 O WAT 7854 123.667 93.803 112.092 1.00 0.00 O ATOM 1094 H1 WAT 7854 124.382 94.138 111.550 1.00 0.00 H ATOM 1095 H2 WAT 7854 124.091 93.196 112.699 1.00 0.00 H TER 1097 WAT 7854 ATOM 1097 O WAT 7855 97.769 50.639 14.479 1.00 0.00 O ATOM 1098 H1 WAT 7855 98.549 50.492 15.014 1.00 0.00 H ATOM 1099 H2 WAT 7855 97.189 51.155 15.039 1.00 0.00 H TER 1101 WAT 7855 ATOM 1101 O WAT 7856 47.296 95.416 97.295 1.00 0.00 O ATOM 1102 H1 WAT 7856 46.579 95.676 96.716 1.00 0.00 H ATOM 1103 H2 WAT 7856 47.647 96.242 97.627 1.00 0.00 H TER 1105 WAT 7856 ATOM 1105 O WAT 7857 85.544 7.774 107.265 1.00 0.00 O ATOM 1106 H1 WAT 7857 84.761 8.311 107.140 1.00 0.00 H ATOM 1107 H2 WAT 7857 85.211 6.939 107.593 1.00 0.00 H TER 1109 WAT 7857 ATOM 1109 O WAT 7858 55.865 112.630 117.600 1.00 0.00 O ATOM 1110 H1 WAT 7858 56.568 112.437 116.979 1.00 0.00 H ATOM 1111 H2 WAT 7858 56.042 113.525 117.891 1.00 0.00 H TER 1113 WAT 7858 ATOM 1113 O WAT 7859 27.968 4.106 108.420 1.00 0.00 O ATOM 1114 H1 WAT 7859 27.503 4.930 108.274 1.00 0.00 H ATOM 1115 H2 WAT 7859 28.845 4.371 108.695 1.00 0.00 H TER 1117 WAT 7859 ATOM 1117 O WAT 7860 85.173 132.182 110.688 1.00 0.00 O ATOM 1118 H1 WAT 7860 85.641 132.374 109.876 1.00 0.00 H ATOM 1119 H2 WAT 7860 85.609 131.405 111.038 1.00 0.00 H TER 1121 WAT 7860 ATOM 1121 O WAT 7861 25.851 125.970 109.072 1.00 0.00 O ATOM 1122 H1 WAT 7861 26.505 126.435 108.550 1.00 0.00 H ATOM 1123 H2 WAT 7861 25.619 125.207 108.543 1.00 0.00 H TER 1125 WAT 7861 ATOM 1125 O WAT 7862 22.973 10.772 1.270 1.00 0.00 O ATOM 1126 H1 WAT 7862 22.086 10.826 1.628 1.00 0.00 H ATOM 1127 H2 WAT 7862 22.844 10.611 0.335 1.00 0.00 H TER 1129 WAT 7862 ATOM 1129 O WAT 7863 97.868 25.773 120.355 1.00 0.00 O ATOM 1130 H1 WAT 7863 98.152 26.306 121.097 1.00 0.00 H ATOM 1131 H2 WAT 7863 98.631 25.235 120.141 1.00 0.00 H TER 1133 WAT 7863 ATOM 1133 O WAT 7864 7.812 33.404 103.028 1.00 0.00 O ATOM 1134 H1 WAT 7864 7.780 34.069 103.716 1.00 0.00 H ATOM 1135 H2 WAT 7864 7.688 33.895 102.215 1.00 0.00 H TER 1137 WAT 7864 ATOM 1137 O WAT 7865 28.670 52.867 2.259 1.00 0.00 O ATOM 1138 H1 WAT 7865 29.140 53.050 3.073 1.00 0.00 H ATOM 1139 H2 WAT 7865 28.808 51.932 2.107 1.00 0.00 H TER 1141 WAT 7865 ATOM 1141 O WAT 7866 132.140 16.263 7.388 1.00 0.00 O ATOM 1142 H1 WAT 7866 132.915 16.645 6.977 1.00 0.00 H ATOM 1143 H2 WAT 7866 131.558 17.008 7.540 1.00 0.00 H TER 1145 WAT 7866 ATOM 1145 O WAT 7867 124.747 123.928 67.040 1.00 0.00 O ATOM 1146 H1 WAT 7867 125.604 123.510 66.964 1.00 0.00 H ATOM 1147 H2 WAT 7867 124.331 123.488 67.782 1.00 0.00 H TER 1149 WAT 7867 ATOM 1149 O WAT 7868 123.205 80.691 69.188 1.00 0.00 O ATOM 1150 H1 WAT 7868 122.315 80.449 68.932 1.00 0.00 H ATOM 1151 H2 WAT 7868 123.748 80.426 68.446 1.00 0.00 H TER 1153 WAT 7868 ATOM 1153 O WAT 7869 81.668 10.600 125.907 1.00 0.00 O ATOM 1154 H1 WAT 7869 81.972 11.321 125.355 1.00 0.00 H ATOM 1155 H2 WAT 7869 80.811 10.885 126.223 1.00 0.00 H TER 1157 WAT 7869 ATOM 1157 O WAT 7870 49.877 108.625 79.474 1.00 0.00 O ATOM 1158 H1 WAT 7870 50.437 108.604 80.251 1.00 0.00 H ATOM 1159 H2 WAT 7870 50.131 107.849 78.975 1.00 0.00 H TER 1161 WAT 7870 ATOM 1161 O WAT 7871 33.517 17.645 86.527 1.00 0.00 O ATOM 1162 H1 WAT 7871 33.544 17.410 85.599 1.00 0.00 H ATOM 1163 H2 WAT 7871 32.921 18.393 86.568 1.00 0.00 H TER 1165 WAT 7871 ATOM 1165 O WAT 7872 66.339 114.742 109.340 1.00 0.00 O ATOM 1166 H1 WAT 7872 65.923 114.803 110.200 1.00 0.00 H ATOM 1167 H2 WAT 7872 65.668 115.048 108.729 1.00 0.00 H TER 1169 WAT 7872 ATOM 1169 O WAT 7873 111.943 6.448 87.915 1.00 0.00 O ATOM 1170 H1 WAT 7873 112.588 7.127 88.110 1.00 0.00 H ATOM 1171 H2 WAT 7873 111.987 5.853 88.664 1.00 0.00 H TER 1173 WAT 7873 ATOM 1173 O WAT 7874 31.185 77.838 151.394 1.00 0.00 O ATOM 1174 H1 WAT 7874 31.667 78.279 152.094 1.00 0.00 H ATOM 1175 H2 WAT 7874 31.373 76.908 151.522 1.00 0.00 H TER 1177 WAT 7874 ATOM 1177 O WAT 7875 42.779 100.746 57.798 1.00 0.00 O ATOM 1178 H1 WAT 7875 42.118 101.291 58.224 1.00 0.00 H ATOM 1179 H2 WAT 7875 42.295 100.255 57.135 1.00 0.00 H TER 1181 WAT 7875 ATOM 1181 O WAT 7876 8.235 26.733 117.763 1.00 0.00 O ATOM 1182 H1 WAT 7876 9.113 27.081 117.916 1.00 0.00 H ATOM 1183 H2 WAT 7876 8.383 25.858 117.404 1.00 0.00 H TER 1185 WAT 7876 ATOM 1185 O WAT 7877 97.003 69.644 74.863 1.00 0.00 O ATOM 1186 H1 WAT 7877 97.427 69.495 74.018 1.00 0.00 H ATOM 1187 H2 WAT 7877 96.906 70.595 74.918 1.00 0.00 H TER 1189 WAT 7877 ATOM 1189 O WAT 7878 124.169 81.901 14.589 1.00 0.00 O ATOM 1190 H1 WAT 7878 124.140 81.986 15.542 1.00 0.00 H ATOM 1191 H2 WAT 7878 124.891 82.468 14.320 1.00 0.00 H TER 1193 WAT 7878 ATOM 1193 O WAT 7879 62.453 90.613 56.484 1.00 0.00 O ATOM 1194 H1 WAT 7879 61.995 91.439 56.637 1.00 0.00 H ATOM 1195 H2 WAT 7879 62.291 90.099 57.276 1.00 0.00 H TER 1197 WAT 7879 ATOM 1197 O WAT 7880 107.474 136.876 17.784 1.00 0.00 O ATOM 1198 H1 WAT 7880 107.911 137.144 18.592 1.00 0.00 H ATOM 1199 H2 WAT 7880 107.806 135.995 17.612 1.00 0.00 H TER 1201 WAT 7880 ATOM 1201 O WAT 7881 133.273 60.692 20.092 1.00 0.00 O ATOM 1202 H1 WAT 7881 133.113 60.527 21.021 1.00 0.00 H ATOM 1203 H2 WAT 7881 132.501 61.175 19.798 1.00 0.00 H TER 1205 WAT 7881 ATOM 1205 O WAT 7882 0.865 50.120 64.150 1.00 0.00 O ATOM 1206 H1 WAT 7882 1.080 49.269 64.532 1.00 0.00 H ATOM 1207 H2 WAT 7882 0.360 49.909 63.365 1.00 0.00 H TER 1209 WAT 7882 ATOM 1209 O WAT 7883 52.957 81.322 62.424 1.00 0.00 O ATOM 1210 H1 WAT 7883 52.784 82.107 61.904 1.00 0.00 H ATOM 1211 H2 WAT 7883 53.556 81.617 63.110 1.00 0.00 H TER 1213 WAT 7883 ATOM 1213 O WAT 7884 127.952 133.496 116.723 1.00 0.00 O ATOM 1214 H1 WAT 7884 128.682 134.109 116.807 1.00 0.00 H ATOM 1215 H2 WAT 7884 127.541 133.726 115.890 1.00 0.00 H TER 1217 WAT 7884 ATOM 1217 O WAT 7885 106.149 110.582 15.630 1.00 0.00 O ATOM 1218 H1 WAT 7885 105.288 110.165 15.621 1.00 0.00 H ATOM 1219 H2 WAT 7885 106.567 110.287 14.821 1.00 0.00 H TER 1221 WAT 7885 ATOM 1221 O WAT 7886 24.264 72.885 143.888 1.00 0.00 O ATOM 1222 H1 WAT 7886 24.860 72.920 144.636 1.00 0.00 H ATOM 1223 H2 WAT 7886 23.519 73.426 144.150 1.00 0.00 H TER 1225 WAT 7886 ATOM 1225 O WAT 7887 57.516 139.129 9.147 1.00 0.00 O ATOM 1226 H1 WAT 7887 57.983 139.952 9.004 1.00 0.00 H ATOM 1227 H2 WAT 7887 57.120 139.225 10.013 1.00 0.00 H TER 1229 WAT 7887 ATOM 1229 O WAT 7888 49.593 28.983 73.577 1.00 0.00 O ATOM 1230 H1 WAT 7888 50.223 29.650 73.850 1.00 0.00 H ATOM 1231 H2 WAT 7888 48.738 29.387 73.724 1.00 0.00 H TER 1233 WAT 7888 ATOM 1233 O WAT 7889 114.113 8.480 121.588 1.00 0.00 O ATOM 1234 H1 WAT 7889 113.223 8.430 121.935 1.00 0.00 H ATOM 1235 H2 WAT 7889 114.489 9.257 122.001 1.00 0.00 H TER 1237 WAT 7889 ATOM 1237 O WAT 7890 98.566 76.459 65.949 1.00 0.00 O ATOM 1238 H1 WAT 7890 98.295 77.171 66.527 1.00 0.00 H ATOM 1239 H2 WAT 7890 98.644 75.699 66.525 1.00 0.00 H TER 1241 WAT 7890 ATOM 1241 O WAT 7891 140.666 140.647 74.635 1.00 0.00 O ATOM 1242 H1 WAT 7891 140.242 139.844 74.938 1.00 0.00 H ATOM 1243 H2 WAT 7891 140.714 140.548 73.684 1.00 0.00 H TER 1245 WAT 7891 ATOM 1245 O WAT 7892 6.710 112.945 129.163 1.00 0.00 O ATOM 1246 H1 WAT 7892 7.588 113.302 129.299 1.00 0.00 H ATOM 1247 H2 WAT 7892 6.560 113.029 128.221 1.00 0.00 H TER 1249 WAT 7892 ATOM 1249 O WAT 7893 90.348 132.115 95.143 1.00 0.00 O ATOM 1250 H1 WAT 7893 89.602 131.616 95.476 1.00 0.00 H ATOM 1251 H2 WAT 7893 90.243 132.987 95.524 1.00 0.00 H TER 1253 WAT 7893 ATOM 1253 O WAT 7894 5.466 30.855 129.262 1.00 0.00 O ATOM 1254 H1 WAT 7894 4.946 31.413 128.684 1.00 0.00 H ATOM 1255 H2 WAT 7894 5.522 31.345 130.082 1.00 0.00 H TER 1257 WAT 7894 ATOM 1257 O WAT 7895 29.364 134.619 69.767 1.00 0.00 O ATOM 1258 H1 WAT 7895 28.479 134.330 69.541 1.00 0.00 H ATOM 1259 H2 WAT 7895 29.398 134.561 70.722 1.00 0.00 H TER 1261 WAT 7895 ATOM 1261 O WAT 7896 136.905 99.039 113.824 1.00 0.00 O ATOM 1262 H1 WAT 7896 136.105 98.821 114.303 1.00 0.00 H ATOM 1263 H2 WAT 7896 137.178 99.882 114.185 1.00 0.00 H TER 1265 WAT 7896 ATOM 1265 O WAT 7897 97.665 68.207 123.474 1.00 0.00 O ATOM 1266 H1 WAT 7897 98.076 69.067 123.394 1.00 0.00 H ATOM 1267 H2 WAT 7897 96.742 68.363 123.277 1.00 0.00 H TER 1269 WAT 7897 ATOM 1269 O WAT 7898 30.989 144.047 98.612 1.00 0.00 O ATOM 1270 H1 WAT 7898 31.909 144.266 98.465 1.00 0.00 H ATOM 1271 H2 WAT 7898 31.010 143.355 99.273 1.00 0.00 H TER 1273 WAT 7898 ATOM 1273 O WAT 7899 23.003 3.757 57.711 1.00 0.00 O ATOM 1274 H1 WAT 7899 22.500 4.393 58.218 1.00 0.00 H ATOM 1275 H2 WAT 7899 23.916 3.952 57.920 1.00 0.00 H TER 1277 WAT 7899 ATOM 1277 O WAT 7900 54.148 33.357 118.282 1.00 0.00 O ATOM 1278 H1 WAT 7900 54.782 32.836 118.773 1.00 0.00 H ATOM 1279 H2 WAT 7900 53.304 33.149 118.683 1.00 0.00 H TER 1281 WAT 7900 ATOM 1281 O WAT 7901 25.190 42.132 78.476 1.00 0.00 O ATOM 1282 H1 WAT 7901 25.808 42.816 78.220 1.00 0.00 H ATOM 1283 H2 WAT 7901 25.510 41.343 78.039 1.00 0.00 H TER 1285 WAT 7901 ATOM 1285 O WAT 7902 68.441 97.074 6.370 1.00 0.00 O ATOM 1286 H1 WAT 7902 68.547 97.438 5.491 1.00 0.00 H ATOM 1287 H2 WAT 7902 68.332 97.838 6.935 1.00 0.00 H TER 1289 WAT 7902 ATOM 1289 O WAT 7903 72.486 120.062 64.112 1.00 0.00 O ATOM 1290 H1 WAT 7903 72.508 120.909 64.558 1.00 0.00 H ATOM 1291 H2 WAT 7903 71.905 120.200 63.364 1.00 0.00 H TER 1293 WAT 7903 ATOM 1293 O WAT 7904 103.584 52.805 87.813 1.00 0.00 O ATOM 1294 H1 WAT 7904 102.979 53.476 88.130 1.00 0.00 H ATOM 1295 H2 WAT 7904 104.146 53.265 87.190 1.00 0.00 H TER 1297 WAT 7904 ATOM 1297 O WAT 7905 99.272 104.494 101.931 1.00 0.00 O ATOM 1298 H1 WAT 7905 100.215 104.657 101.955 1.00 0.00 H ATOM 1299 H2 WAT 7905 98.884 105.356 101.775 1.00 0.00 H TER 1301 WAT 7905 ATOM 1301 O WAT 7906 77.555 97.906 75.352 1.00 0.00 O ATOM 1302 H1 WAT 7906 77.884 98.070 74.469 1.00 0.00 H ATOM 1303 H2 WAT 7906 76.736 98.400 75.398 1.00 0.00 H TER 1305 WAT 7906 ATOM 1305 O WAT 7907 66.159 71.533 81.661 1.00 0.00 O ATOM 1306 H1 WAT 7907 66.712 72.161 81.197 1.00 0.00 H ATOM 1307 H2 WAT 7907 65.638 71.118 80.973 1.00 0.00 H TER 1309 WAT 7907 ATOM 1309 O WAT 7908 139.243 22.514 7.246 1.00 0.00 O ATOM 1310 H1 WAT 7908 138.469 23.070 7.335 1.00 0.00 H ATOM 1311 H2 WAT 7908 139.964 23.127 7.104 1.00 0.00 H TER 1313 WAT 7908 ATOM 1313 O WAT 7909 1.328 22.633 121.878 1.00 0.00 O ATOM 1314 H1 WAT 7909 1.150 22.992 122.747 1.00 0.00 H ATOM 1315 H2 WAT 7909 1.901 21.884 122.040 1.00 0.00 H TER 1317 WAT 7909 ATOM 1317 O WAT 7910 32.388 87.423 68.726 1.00 0.00 O ATOM 1318 H1 WAT 7910 31.662 87.175 69.299 1.00 0.00 H ATOM 1319 H2 WAT 7910 31.968 87.831 67.969 1.00 0.00 H TER 1321 WAT 7910 ATOM 1321 O WAT 7911 19.626 18.999 103.293 1.00 0.00 O ATOM 1322 H1 WAT 7911 19.527 19.247 102.374 1.00 0.00 H ATOM 1323 H2 WAT 7911 20.518 19.264 103.518 1.00 0.00 H TER 1325 WAT 7911 ATOM 1325 O WAT 7912 81.058 57.040 155.274 1.00 0.00 O ATOM 1326 H1 WAT 7912 80.693 56.167 155.416 1.00 0.00 H ATOM 1327 H2 WAT 7912 80.299 57.623 155.296 1.00 0.00 H TER 1329 WAT 7912 ATOM 1329 O WAT 7913 130.898 109.796 137.264 1.00 0.00 O ATOM 1330 H1 WAT 7913 130.229 110.069 136.637 1.00 0.00 H ATOM 1331 H2 WAT 7913 130.421 109.671 138.085 1.00 0.00 H TER 1333 WAT 7913 ATOM 1333 O WAT 7914 137.048 140.690 66.685 1.00 0.00 O ATOM 1334 H1 WAT 7914 136.163 140.857 66.362 1.00 0.00 H ATOM 1335 H2 WAT 7914 137.582 141.376 66.284 1.00 0.00 H TER 1337 WAT 7914 ATOM 1337 O WAT 7915 132.379 48.549 77.706 1.00 0.00 O ATOM 1338 H1 WAT 7915 131.802 48.124 77.072 1.00 0.00 H ATOM 1339 H2 WAT 7915 133.256 48.454 77.334 1.00 0.00 H TER 1341 WAT 7915 ATOM 1341 O WAT 7916 107.593 117.438 17.624 1.00 0.00 O ATOM 1342 H1 WAT 7916 107.551 116.524 17.903 1.00 0.00 H ATOM 1343 H2 WAT 7916 107.265 117.933 18.375 1.00 0.00 H TER 1345 WAT 7916 ATOM 1345 O WAT 7917 98.414 108.566 93.368 1.00 0.00 O ATOM 1346 H1 WAT 7917 97.593 109.013 93.164 1.00 0.00 H ATOM 1347 H2 WAT 7917 98.194 107.635 93.340 1.00 0.00 H TER 1349 WAT 7917 ATOM 1349 O WAT 7918 22.393 41.758 114.062 1.00 0.00 O ATOM 1350 H1 WAT 7918 21.935 41.343 113.330 1.00 0.00 H ATOM 1351 H2 WAT 7918 22.899 41.050 114.460 1.00 0.00 H TER 1353 WAT 7918 ATOM 1353 O WAT 7919 106.224 88.185 62.187 1.00 0.00 O ATOM 1354 H1 WAT 7919 105.573 88.765 61.792 1.00 0.00 H ATOM 1355 H2 WAT 7919 106.998 88.279 61.631 1.00 0.00 H TER 1357 WAT 7919 ATOM 1357 O WAT 7920 141.332 13.973 124.645 1.00 0.00 O ATOM 1358 H1 WAT 7920 141.525 13.701 123.748 1.00 0.00 H ATOM 1359 H2 WAT 7920 142.183 14.218 125.009 1.00 0.00 H TER 1361 WAT 7920 ATOM 1361 O WAT 7921 41.641 55.889 75.049 1.00 0.00 O ATOM 1362 H1 WAT 7921 41.017 55.871 75.774 1.00 0.00 H ATOM 1363 H2 WAT 7921 41.555 56.768 74.680 1.00 0.00 H TER 1365 WAT 7921 ATOM 1365 O WAT 7922 59.548 47.102 4.496 1.00 0.00 O ATOM 1366 H1 WAT 7922 58.941 46.626 5.064 1.00 0.00 H ATOM 1367 H2 WAT 7922 58.989 47.689 3.988 1.00 0.00 H TER 1369 WAT 7922 ATOM 1369 O WAT 7923 37.661 64.870 98.289 1.00 0.00 O ATOM 1370 H1 WAT 7923 37.871 65.000 99.214 1.00 0.00 H ATOM 1371 H2 WAT 7923 38.338 64.273 97.971 1.00 0.00 H TER 1373 WAT 7923 ATOM 1373 O WAT 7924 59.331 15.966 103.659 1.00 0.00 O ATOM 1374 H1 WAT 7924 59.859 16.763 103.628 1.00 0.00 H ATOM 1375 H2 WAT 7924 58.448 16.272 103.870 1.00 0.00 H TER 1377 WAT 7924 ATOM 1377 O WAT 7925 118.807 145.551 1.809 1.00 0.00 O ATOM 1378 H1 WAT 7925 118.423 144.849 1.284 1.00 0.00 H ATOM 1379 H2 WAT 7925 119.323 146.062 1.185 1.00 0.00 H TER 1381 WAT 7925 ATOM 1381 O WAT 7926 78.863 34.994 151.839 1.00 0.00 O ATOM 1382 H1 WAT 7926 78.004 35.103 151.430 1.00 0.00 H ATOM 1383 H2 WAT 7926 78.670 34.650 152.711 1.00 0.00 H TER 1385 WAT 7926 ATOM 1385 O WAT 7927 19.267 56.962 72.130 1.00 0.00 O ATOM 1386 H1 WAT 7927 18.436 57.129 72.573 1.00 0.00 H ATOM 1387 H2 WAT 7927 19.600 56.163 72.538 1.00 0.00 H TER 1389 WAT 7927 ATOM 1389 O WAT 7928 134.535 140.234 136.891 1.00 0.00 O ATOM 1390 H1 WAT 7928 135.481 140.333 136.785 1.00 0.00 H ATOM 1391 H2 WAT 7928 134.204 140.122 136.000 1.00 0.00 H TER 1393 WAT 7928 ATOM 1393 O WAT 7929 57.864 115.829 1.858 1.00 0.00 O ATOM 1394 H1 WAT 7929 58.090 116.000 0.944 1.00 0.00 H ATOM 1395 H2 WAT 7929 58.665 116.026 2.344 1.00 0.00 H TER 1397 WAT 7929 ATOM 1397 O WAT 7930 15.368 82.889 16.685 1.00 0.00 O ATOM 1398 H1 WAT 7930 15.881 83.480 16.134 1.00 0.00 H ATOM 1399 H2 WAT 7930 15.829 82.052 16.634 1.00 0.00 H TER 1401 WAT 7930 ATOM 1401 O WAT 7931 48.349 17.276 0.219 1.00 0.00 O ATOM 1402 H1 WAT 7931 47.546 17.715 -0.061 1.00 0.00 H ATOM 1403 H2 WAT 7931 48.267 17.211 1.171 1.00 0.00 H TER 1405 WAT 7931 ATOM 1405 O WAT 7932 126.818 109.073 145.674 1.00 0.00 O ATOM 1406 H1 WAT 7932 127.462 109.726 145.946 1.00 0.00 H ATOM 1407 H2 WAT 7932 127.304 108.248 145.658 1.00 0.00 H TER 1409 WAT 7932 ATOM 1409 O WAT 7933 121.517 118.771 113.171 1.00 0.00 O ATOM 1410 H1 WAT 7933 122.332 119.017 112.733 1.00 0.00 H ATOM 1411 H2 WAT 7933 121.764 118.655 114.088 1.00 0.00 H TER 1413 WAT 7933 ATOM 1413 O WAT 7934 32.393 54.805 108.925 1.00 0.00 O ATOM 1414 H1 WAT 7934 32.875 55.527 108.520 1.00 0.00 H ATOM 1415 H2 WAT 7934 32.345 54.137 108.241 1.00 0.00 H TER 1417 WAT 7934 ATOM 1417 O WAT 7935 133.030 8.387 72.839 1.00 0.00 O ATOM 1418 H1 WAT 7935 132.187 8.201 72.427 1.00 0.00 H ATOM 1419 H2 WAT 7935 133.028 9.335 72.972 1.00 0.00 H TER 1421 WAT 7935 ATOM 1421 O WAT 7936 24.346 123.190 9.370 1.00 0.00 O ATOM 1422 H1 WAT 7936 24.427 122.645 8.588 1.00 0.00 H ATOM 1423 H2 WAT 7936 23.432 123.093 9.637 1.00 0.00 H TER 1425 WAT 7936 ATOM 1425 O WAT 7937 19.926 18.231 141.311 1.00 0.00 O ATOM 1426 H1 WAT 7937 19.103 17.744 141.275 1.00 0.00 H ATOM 1427 H2 WAT 7937 19.755 18.945 141.925 1.00 0.00 H TER 1429 WAT 7937 ATOM 1429 O WAT 7938 127.931 130.842 158.249 1.00 0.00 O ATOM 1430 H1 WAT 7938 127.840 131.574 158.860 1.00 0.00 H ATOM 1431 H2 WAT 7938 128.022 131.257 157.391 1.00 0.00 H TER 1433 WAT 7938 ATOM 1433 O WAT 7939 82.024 122.848 120.566 1.00 0.00 O ATOM 1434 H1 WAT 7939 82.459 123.082 121.386 1.00 0.00 H ATOM 1435 H2 WAT 7939 82.172 121.906 120.477 1.00 0.00 H TER 1437 WAT 7939 ATOM 1437 O WAT 7940 39.818 26.531 14.926 1.00 0.00 O ATOM 1438 H1 WAT 7940 40.066 25.607 14.963 1.00 0.00 H ATOM 1439 H2 WAT 7940 40.475 26.977 15.461 1.00 0.00 H TER 1441 WAT 7940 ATOM 1441 O WAT 7941 127.320 130.672 117.276 1.00 0.00 O ATOM 1442 H1 WAT 7941 127.680 130.188 116.533 1.00 0.00 H ATOM 1443 H2 WAT 7941 127.498 131.590 117.072 1.00 0.00 H TER 1445 WAT 7941 ATOM 1445 O WAT 7942 14.967 55.064 74.012 1.00 0.00 O ATOM 1446 H1 WAT 7942 14.229 55.374 73.486 1.00 0.00 H ATOM 1447 H2 WAT 7942 15.250 54.260 73.576 1.00 0.00 H TER 1449 WAT 7942 ATOM 1449 O WAT 7943 124.302 79.496 112.160 1.00 0.00 O ATOM 1450 H1 WAT 7943 123.388 79.362 112.411 1.00 0.00 H ATOM 1451 H2 WAT 7943 124.256 79.964 111.327 1.00 0.00 H TER 1453 WAT 7943 ATOM 1453 O WAT 7944 53.133 25.029 126.727 1.00 0.00 O ATOM 1454 H1 WAT 7944 53.155 24.201 127.207 1.00 0.00 H ATOM 1455 H2 WAT 7944 52.563 24.856 125.978 1.00 0.00 H TER 1457 WAT 7944 ATOM 1457 O WAT 7945 107.852 82.082 151.994 1.00 0.00 O ATOM 1458 H1 WAT 7945 107.604 82.343 152.881 1.00 0.00 H ATOM 1459 H2 WAT 7945 107.096 82.316 151.455 1.00 0.00 H TER 1461 WAT 7945 ATOM 1461 O WAT 7946 96.320 73.651 106.506 1.00 0.00 O ATOM 1462 H1 WAT 7946 96.453 74.191 107.285 1.00 0.00 H ATOM 1463 H2 WAT 7946 95.393 73.762 106.294 1.00 0.00 H TER 1465 WAT 7946 ATOM 1465 O WAT 7947 135.993 139.117 132.933 1.00 0.00 O ATOM 1466 H1 WAT 7947 136.468 138.463 133.447 1.00 0.00 H ATOM 1467 H2 WAT 7947 136.315 138.999 132.040 1.00 0.00 H TER 1469 WAT 7947 ATOM 1469 O WAT 7948 43.517 74.686 16.162 1.00 0.00 O ATOM 1470 H1 WAT 7948 44.195 74.139 15.766 1.00 0.00 H ATOM 1471 H2 WAT 7948 43.968 75.155 16.864 1.00 0.00 H TER 1473 WAT 7948 ATOM 1473 O WAT 7949 136.341 22.816 65.786 1.00 0.00 O ATOM 1474 H1 WAT 7949 136.682 22.992 66.663 1.00 0.00 H ATOM 1475 H2 WAT 7949 137.112 22.843 65.220 1.00 0.00 H TER 1477 WAT 7949 ATOM 1477 O WAT 7950 36.609 49.588 13.753 1.00 0.00 O ATOM 1478 H1 WAT 7950 35.716 49.783 14.039 1.00 0.00 H ATOM 1479 H2 WAT 7950 36.514 48.837 13.167 1.00 0.00 H TER 1481 WAT 7950 ATOM 1481 O WAT 7951 30.884 93.084 83.800 1.00 0.00 O ATOM 1482 H1 WAT 7951 31.494 93.760 83.507 1.00 0.00 H ATOM 1483 H2 WAT 7951 31.353 92.261 83.662 1.00 0.00 H TER 1485 WAT 7951 ATOM 1485 O WAT 7952 53.531 119.197 14.885 1.00 0.00 O ATOM 1486 H1 WAT 7952 52.752 119.595 14.497 1.00 0.00 H ATOM 1487 H2 WAT 7952 53.243 118.327 15.162 1.00 0.00 H TER 1489 WAT 7952 ATOM 1489 O WAT 7953 121.583 119.050 85.464 1.00 0.00 O ATOM 1490 H1 WAT 7953 120.685 119.088 85.793 1.00 0.00 H ATOM 1491 H2 WAT 7953 121.721 119.900 85.047 1.00 0.00 H TER 1493 WAT 7953 ATOM 1493 O WAT 7954 22.183 23.692 148.796 1.00 0.00 O ATOM 1494 H1 WAT 7954 22.187 23.844 149.741 1.00 0.00 H ATOM 1495 H2 WAT 7954 21.997 22.758 148.704 1.00 0.00 H TER 1497 WAT 7954 ATOM 1497 O WAT 7955 106.137 74.576 15.185 1.00 0.00 O ATOM 1498 H1 WAT 7955 106.999 74.346 14.838 1.00 0.00 H ATOM 1499 H2 WAT 7955 105.525 74.315 14.497 1.00 0.00 H TER 1501 WAT 7955 ATOM 1501 O WAT 7956 21.950 8.803 21.609 1.00 0.00 O ATOM 1502 H1 WAT 7956 22.391 8.114 21.112 1.00 0.00 H ATOM 1503 H2 WAT 7956 21.377 9.229 20.972 1.00 0.00 H TER 1505 WAT 7956 ATOM 1505 O WAT 7957 129.009 81.132 100.003 1.00 0.00 O ATOM 1506 H1 WAT 7957 128.242 81.307 100.547 1.00 0.00 H ATOM 1507 H2 WAT 7957 128.799 80.317 99.547 1.00 0.00 H TER 1509 WAT 7957 ATOM 1509 O WAT 7958 68.093 36.672 28.370 1.00 0.00 O ATOM 1510 H1 WAT 7958 67.536 36.208 27.746 1.00 0.00 H ATOM 1511 H2 WAT 7958 67.480 37.082 28.980 1.00 0.00 H TER 1513 WAT 7958 ATOM 1513 O WAT 7959 118.465 61.938 79.557 1.00 0.00 O ATOM 1514 H1 WAT 7959 117.710 61.361 79.443 1.00 0.00 H ATOM 1515 H2 WAT 7959 118.324 62.644 78.925 1.00 0.00 H TER 1517 WAT 7959 ATOM 1517 O WAT 7960 5.010 127.395 60.044 1.00 0.00 O ATOM 1518 H1 WAT 7960 5.227 128.327 60.059 1.00 0.00 H ATOM 1519 H2 WAT 7960 5.858 126.951 60.067 1.00 0.00 H TER 1521 WAT 7960 ATOM 1521 O WAT 7961 33.050 73.551 94.219 1.00 0.00 O ATOM 1522 H1 WAT 7961 33.928 73.630 93.847 1.00 0.00 H ATOM 1523 H2 WAT 7961 33.074 72.735 94.718 1.00 0.00 H TER 1525 WAT 7961 ATOM 1525 O WAT 7962 92.771 70.460 121.272 1.00 0.00 O ATOM 1526 H1 WAT 7962 93.443 70.073 121.833 1.00 0.00 H ATOM 1527 H2 WAT 7962 91.957 70.042 121.551 1.00 0.00 H TER 1529 WAT 7962 ATOM 1529 O WAT 7963 27.256 94.063 99.496 1.00 0.00 O ATOM 1530 H1 WAT 7963 28.145 94.193 99.167 1.00 0.00 H ATOM 1531 H2 WAT 7963 26.703 94.559 98.892 1.00 0.00 H TER 1533 WAT 7963 ATOM 1533 O WAT 7964 87.312 46.201 87.665 1.00 0.00 O ATOM 1534 H1 WAT 7964 87.470 46.969 88.214 1.00 0.00 H ATOM 1535 H2 WAT 7964 88.039 46.197 87.043 1.00 0.00 H TER 1537 WAT 7964 ATOM 1537 O WAT 7965 129.192 76.841 154.460 1.00 0.00 O ATOM 1538 H1 WAT 7965 129.522 76.640 155.336 1.00 0.00 H ATOM 1539 H2 WAT 7965 129.515 76.126 153.912 1.00 0.00 H TER 1541 WAT 7965 ATOM 1541 O WAT 7966 103.155 99.820 66.670 1.00 0.00 O ATOM 1542 H1 WAT 7966 103.538 100.680 66.845 1.00 0.00 H ATOM 1543 H2 WAT 7966 102.230 100.000 66.503 1.00 0.00 H TER 1545 WAT 7966 ATOM 1545 O WAT 7967 143.297 31.763 78.680 1.00 0.00 O ATOM 1546 H1 WAT 7967 142.697 31.283 78.109 1.00 0.00 H ATOM 1547 H2 WAT 7967 142.761 32.458 79.061 1.00 0.00 H TER 1549 WAT 7967 ATOM 1549 O WAT 7968 9.001 115.526 73.659 1.00 0.00 O ATOM 1550 H1 WAT 7968 8.214 114.988 73.577 1.00 0.00 H ATOM 1551 H2 WAT 7968 9.623 115.135 73.045 1.00 0.00 H TER 1553 WAT 7968 ATOM 1553 O WAT 7969 53.333 23.977 116.843 1.00 0.00 O ATOM 1554 H1 WAT 7969 53.501 24.773 117.348 1.00 0.00 H ATOM 1555 H2 WAT 7969 54.197 23.699 116.539 1.00 0.00 H TER 1557 WAT 7969 ATOM 1557 O WAT 7970 123.240 3.540 77.173 1.00 0.00 O ATOM 1558 H1 WAT 7970 123.952 4.168 77.047 1.00 0.00 H ATOM 1559 H2 WAT 7970 122.965 3.310 76.286 1.00 0.00 H TER 1561 WAT 7970 ATOM 1561 O WAT 7971 21.156 81.820 153.619 1.00 0.00 O ATOM 1562 H1 WAT 7971 21.562 81.570 152.789 1.00 0.00 H ATOM 1563 H2 WAT 7971 21.590 82.638 153.862 1.00 0.00 H TER 1565 WAT 7971 ATOM 1565 O WAT 7972 22.923 42.576 66.865 1.00 0.00 O ATOM 1566 H1 WAT 7972 22.781 42.342 67.782 1.00 0.00 H ATOM 1567 H2 WAT 7972 22.070 42.450 66.450 1.00 0.00 H TER 1569 WAT 7972 ATOM 1569 O WAT 7973 46.007 97.966 61.578 1.00 0.00 O ATOM 1570 H1 WAT 7973 46.077 97.027 61.406 1.00 0.00 H ATOM 1571 H2 WAT 7973 46.827 98.190 62.018 1.00 0.00 H TER 1573 WAT 7973 ATOM 1573 O WAT 7974 23.105 54.758 20.195 1.00 0.00 O ATOM 1574 H1 WAT 7974 22.839 53.864 20.411 1.00 0.00 H ATOM 1575 H2 WAT 7974 23.932 54.880 20.660 1.00 0.00 H TER 1577 WAT 7974 ATOM 1577 O WAT 7975 131.393 54.628 103.620 1.00 0.00 O ATOM 1578 H1 WAT 7975 131.080 53.772 103.328 1.00 0.00 H ATOM 1579 H2 WAT 7975 130.778 55.252 103.233 1.00 0.00 H TER 1581 WAT 7975 ATOM 1581 O WAT 7976 52.458 104.299 122.945 1.00 0.00 O ATOM 1582 H1 WAT 7976 52.209 104.368 122.024 1.00 0.00 H ATOM 1583 H2 WAT 7976 52.465 105.203 123.259 1.00 0.00 H TER 1585 WAT 7976 ATOM 1585 O WAT 7977 28.678 71.572 83.476 1.00 0.00 O ATOM 1586 H1 WAT 7977 28.487 72.096 82.698 1.00 0.00 H ATOM 1587 H2 WAT 7977 29.570 71.821 83.719 1.00 0.00 H TER 1589 WAT 7977 ATOM 1589 O WAT 7978 77.735 87.317 146.906 1.00 0.00 O ATOM 1590 H1 WAT 7978 77.287 87.533 147.724 1.00 0.00 H ATOM 1591 H2 WAT 7978 77.030 87.092 146.299 1.00 0.00 H TER 1593 WAT 7978 ATOM 1593 O WAT 7979 76.209 36.455 130.085 1.00 0.00 O ATOM 1594 H1 WAT 7979 75.832 37.184 130.577 1.00 0.00 H ATOM 1595 H2 WAT 7979 75.627 36.348 129.332 1.00 0.00 H TER 1597 WAT 7979 ATOM 1597 O WAT 7980 132.527 120.131 132.901 1.00 0.00 O ATOM 1598 H1 WAT 7980 133.196 120.307 133.563 1.00 0.00 H ATOM 1599 H2 WAT 7980 132.068 120.965 132.797 1.00 0.00 H TER 1601 WAT 7980 ATOM 1601 O WAT 7981 40.783 140.516 84.816 1.00 0.00 O ATOM 1602 H1 WAT 7981 41.608 140.994 84.730 1.00 0.00 H ATOM 1603 H2 WAT 7981 40.767 139.929 84.060 1.00 0.00 H TER 1605 WAT 7981 ATOM 1605 O WAT 7982 11.018 80.905 135.964 1.00 0.00 O ATOM 1606 H1 WAT 7982 11.970 80.862 135.879 1.00 0.00 H ATOM 1607 H2 WAT 7982 10.687 80.505 135.160 1.00 0.00 H TER 1609 WAT 7982 ATOM 1609 O WAT 7983 10.202 29.662 111.907 1.00 0.00 O ATOM 1610 H1 WAT 7983 9.831 30.331 111.332 1.00 0.00 H ATOM 1611 H2 WAT 7983 9.545 28.966 111.921 1.00 0.00 H TER 1613 WAT 7983 ATOM 1613 O WAT 7984 119.134 32.224 92.761 1.00 0.00 O ATOM 1614 H1 WAT 7984 118.342 32.147 92.229 1.00 0.00 H ATOM 1615 H2 WAT 7984 119.432 31.323 92.879 1.00 0.00 H TER 1617 WAT 7984 ATOM 1617 O WAT 7985 69.117 106.794 118.849 1.00 0.00 O ATOM 1618 H1 WAT 7985 69.826 106.437 118.315 1.00 0.00 H ATOM 1619 H2 WAT 7985 68.405 106.950 118.228 1.00 0.00 H TER 1621 WAT 7985 ATOM 1621 O WAT 7986 133.174 99.650 132.856 1.00 0.00 O ATOM 1622 H1 WAT 7986 133.636 99.217 132.139 1.00 0.00 H ATOM 1623 H2 WAT 7986 132.796 100.435 132.458 1.00 0.00 H TER 1625 WAT 7986 ATOM 1625 O WAT 7987 47.353 22.676 127.196 1.00 0.00 O ATOM 1626 H1 WAT 7987 47.762 21.812 127.247 1.00 0.00 H ATOM 1627 H2 WAT 7987 46.785 22.718 127.965 1.00 0.00 H TER 1629 WAT 7987 ATOM 1629 O WAT 7988 1.121 113.680 158.182 1.00 0.00 O ATOM 1630 H1 WAT 7988 0.494 113.756 158.901 1.00 0.00 H ATOM 1631 H2 WAT 7988 0.682 113.125 157.538 1.00 0.00 H TER 1633 WAT 7988 ATOM 1633 O WAT 7989 70.876 57.334 149.500 1.00 0.00 O ATOM 1634 H1 WAT 7989 70.396 56.524 149.673 1.00 0.00 H ATOM 1635 H2 WAT 7989 71.764 57.047 149.288 1.00 0.00 H TER 1637 WAT 7989 ATOM 1637 O WAT 7990 71.513 52.428 80.346 1.00 0.00 O ATOM 1638 H1 WAT 7990 71.635 52.878 79.510 1.00 0.00 H ATOM 1639 H2 WAT 7990 72.378 52.078 80.558 1.00 0.00 H TER 1641 WAT 7990 ATOM 1641 O WAT 7991 9.759 10.235 111.643 1.00 0.00 O ATOM 1642 H1 WAT 7991 10.067 9.362 111.890 1.00 0.00 H ATOM 1643 H2 WAT 7991 10.209 10.423 110.820 1.00 0.00 H TER 1645 WAT 7991 ATOM 1645 O WAT 7992 128.429 109.330 127.451 1.00 0.00 O ATOM 1646 H1 WAT 7992 128.228 109.487 128.374 1.00 0.00 H ATOM 1647 H2 WAT 7992 128.317 108.386 127.339 1.00 0.00 H TER 1649 WAT 7992 ATOM 1649 O WAT 7993 99.544 61.828 136.572 1.00 0.00 O ATOM 1650 H1 WAT 7993 100.151 62.565 136.630 1.00 0.00 H ATOM 1651 H2 WAT 7993 99.906 61.273 135.880 1.00 0.00 H TER 1653 WAT 7993 ATOM 1653 O WAT 7994 70.020 52.898 7.785 1.00 0.00 O ATOM 1654 H1 WAT 7994 69.866 52.029 8.156 1.00 0.00 H ATOM 1655 H2 WAT 7994 70.897 52.844 7.406 1.00 0.00 H TER 1657 WAT 7994 ATOM 1657 O WAT 7995 75.847 49.578 68.744 1.00 0.00 O ATOM 1658 H1 WAT 7995 76.783 49.383 68.699 1.00 0.00 H ATOM 1659 H2 WAT 7995 75.457 49.046 68.051 1.00 0.00 H TER 1661 WAT 7995 ATOM 1661 O WAT 7996 68.810 52.674 156.441 1.00 0.00 O ATOM 1662 H1 WAT 7996 69.404 53.424 156.422 1.00 0.00 H ATOM 1663 H2 WAT 7996 68.948 52.237 155.601 1.00 0.00 H TER 1665 WAT 7996 ATOM 1665 O WAT 7997 139.689 58.019 105.706 1.00 0.00 O ATOM 1666 H1 WAT 7997 140.287 57.606 106.329 1.00 0.00 H ATOM 1667 H2 WAT 7997 139.121 57.307 105.412 1.00 0.00 H TER 1669 WAT 7997 ATOM 1669 O WAT 7998 27.641 87.678 138.770 1.00 0.00 O ATOM 1670 H1 WAT 7998 27.756 87.509 139.706 1.00 0.00 H ATOM 1671 H2 WAT 7998 28.532 87.765 138.431 1.00 0.00 H TER 1673 WAT 7998 ATOM 1673 O WAT 7999 23.930 91.057 130.339 1.00 0.00 O ATOM 1674 H1 WAT 7999 23.620 91.718 130.957 1.00 0.00 H ATOM 1675 H2 WAT 7999 23.132 90.642 130.011 1.00 0.00 H TER 1677 WAT 7999 ATOM 1677 O WAT 8000 18.229 51.162 131.567 1.00 0.00 O ATOM 1678 H1 WAT 8000 18.587 51.155 132.455 1.00 0.00 H ATOM 1679 H2 WAT 8000 18.009 52.079 131.404 1.00 0.00 H TER 1681 WAT 8000 ATOM 1681 O WAT 8001 90.294 22.869 132.910 1.00 0.00 O ATOM 1682 H1 WAT 8001 89.642 23.033 132.229 1.00 0.00 H ATOM 1683 H2 WAT 8001 90.966 23.535 132.763 1.00 0.00 H TER 1685 WAT 8001 ATOM 1685 O WAT 8002 7.667 124.503 130.609 1.00 0.00 O ATOM 1686 H1 WAT 8002 7.652 125.035 129.813 1.00 0.00 H ATOM 1687 H2 WAT 8002 8.345 123.847 130.446 1.00 0.00 H TER 1689 WAT 8002 ATOM 1689 O WAT 8003 91.728 106.919 114.819 1.00 0.00 O ATOM 1690 H1 WAT 8003 92.591 107.323 114.728 1.00 0.00 H ATOM 1691 H2 WAT 8003 91.739 106.188 114.202 1.00 0.00 H TER 1693 WAT 8003 ATOM 1693 O WAT 8004 44.537 118.740 78.314 1.00 0.00 O ATOM 1694 H1 WAT 8004 45.197 118.876 78.994 1.00 0.00 H ATOM 1695 H2 WAT 8004 43.807 118.322 78.770 1.00 0.00 H TER 1697 WAT 8004 ATOM 1697 O WAT 8005 75.230 56.066 5.534 1.00 0.00 O ATOM 1698 H1 WAT 8005 75.084 56.587 6.323 1.00 0.00 H ATOM 1699 H2 WAT 8005 74.352 55.820 5.243 1.00 0.00 H TER 1701 WAT 8005 ATOM 1701 O WAT 8006 5.005 74.037 80.486 1.00 0.00 O ATOM 1702 H1 WAT 8006 4.601 73.938 79.623 1.00 0.00 H ATOM 1703 H2 WAT 8006 4.944 74.974 80.672 1.00 0.00 H TER 1705 WAT 8006 ATOM 1705 O WAT 8007 43.846 47.462 129.057 1.00 0.00 O ATOM 1706 H1 WAT 8007 43.343 46.753 128.655 1.00 0.00 H ATOM 1707 H2 WAT 8007 43.401 48.261 128.774 1.00 0.00 H TER 1709 WAT 8007 ATOM 1709 O WAT 8008 94.861 80.749 1.113 1.00 0.00 O ATOM 1710 H1 WAT 8008 94.996 80.915 2.046 1.00 0.00 H ATOM 1711 H2 WAT 8008 94.509 79.860 1.076 1.00 0.00 H TER 1713 WAT 8008 ATOM 1713 O WAT 8009 111.685 66.637 67.142 1.00 0.00 O ATOM 1714 H1 WAT 8009 111.857 67.549 66.907 1.00 0.00 H ATOM 1715 H2 WAT 8009 112.541 66.288 67.389 1.00 0.00 H TER 1717 WAT 8009 ATOM 1717 O WAT 8010 9.287 132.103 134.784 1.00 0.00 O ATOM 1718 H1 WAT 8010 9.104 132.616 135.571 1.00 0.00 H ATOM 1719 H2 WAT 8010 8.605 132.364 134.165 1.00 0.00 H TER 1721 WAT 8010 ATOM 1721 O WAT 8011 92.155 20.227 108.860 1.00 0.00 O ATOM 1722 H1 WAT 8011 91.860 21.104 108.616 1.00 0.00 H ATOM 1723 H2 WAT 8011 92.983 20.372 109.318 1.00 0.00 H TER 1725 WAT 8011 ATOM 1725 O WAT 8012 135.728 5.034 81.603 1.00 0.00 O ATOM 1726 H1 WAT 8012 135.300 5.850 81.345 1.00 0.00 H ATOM 1727 H2 WAT 8012 136.089 5.216 82.470 1.00 0.00 H TER 1729 WAT 8012 ATOM 1729 O WAT 8013 68.452 6.267 120.224 1.00 0.00 O ATOM 1730 H1 WAT 8013 68.539 6.487 121.151 1.00 0.00 H ATOM 1731 H2 WAT 8013 67.780 6.866 119.897 1.00 0.00 H TER 1733 WAT 8013 ATOM 1733 O WAT 8014 44.569 137.015 156.787 1.00 0.00 O ATOM 1734 H1 WAT 8014 44.099 136.498 157.441 1.00 0.00 H ATOM 1735 H2 WAT 8014 44.883 136.371 156.153 1.00 0.00 H TER 1737 WAT 8014 ATOM 1737 O WAT 8015 45.602 66.695 149.865 1.00 0.00 O ATOM 1738 H1 WAT 8015 45.331 65.921 150.357 1.00 0.00 H ATOM 1739 H2 WAT 8015 46.159 66.352 149.166 1.00 0.00 H TER 1741 WAT 8015 ATOM 1741 O WAT 8016 29.383 7.638 119.171 1.00 0.00 O ATOM 1742 H1 WAT 8016 29.014 7.484 118.301 1.00 0.00 H ATOM 1743 H2 WAT 8016 28.657 7.472 119.772 1.00 0.00 H TER 1745 WAT 8016 ATOM 1745 O WAT 8017 126.572 76.233 140.392 1.00 0.00 O ATOM 1746 H1 WAT 8017 126.328 76.794 141.128 1.00 0.00 H ATOM 1747 H2 WAT 8017 125.767 76.144 139.881 1.00 0.00 H TER 1749 WAT 8017 ATOM 1749 O WAT 8018 83.247 83.315 71.768 1.00 0.00 O ATOM 1750 H1 WAT 8018 83.822 83.931 72.224 1.00 0.00 H ATOM 1751 H2 WAT 8018 83.598 83.273 70.879 1.00 0.00 H TER 1753 WAT 8018 ATOM 1753 O WAT 8019 68.354 10.021 116.561 1.00 0.00 O ATOM 1754 H1 WAT 8019 68.106 10.843 116.138 1.00 0.00 H ATOM 1755 H2 WAT 8019 68.975 9.618 115.955 1.00 0.00 H TER 1757 WAT 8019 ATOM 1757 O WAT 8020 68.100 101.681 111.765 1.00 0.00 O ATOM 1758 H1 WAT 8020 68.513 101.385 110.953 1.00 0.00 H ATOM 1759 H2 WAT 8020 67.874 102.596 111.599 1.00 0.00 H TER 1761 WAT 8020 ATOM 1761 O WAT 8021 106.493 58.647 13.398 1.00 0.00 O ATOM 1762 H1 WAT 8021 107.391 58.474 13.117 1.00 0.00 H ATOM 1763 H2 WAT 8021 106.498 58.474 14.339 1.00 0.00 H TER 1765 WAT 8021 ATOM 1765 O WAT 8022 33.815 4.407 108.635 1.00 0.00 O ATOM 1766 H1 WAT 8022 34.540 4.399 109.259 1.00 0.00 H ATOM 1767 H2 WAT 8022 33.049 4.637 109.161 1.00 0.00 H TER 1769 WAT 8022 ATOM 1769 O WAT 8023 71.429 65.036 85.626 1.00 0.00 O ATOM 1770 H1 WAT 8023 71.663 64.161 85.933 1.00 0.00 H ATOM 1771 H2 WAT 8023 71.717 65.621 86.327 1.00 0.00 H TER 1773 WAT 8023 ATOM 1773 O WAT 8024 19.730 60.402 113.070 1.00 0.00 O ATOM 1774 H1 WAT 8024 20.085 61.261 112.837 1.00 0.00 H ATOM 1775 H2 WAT 8024 19.710 60.404 114.027 1.00 0.00 H TER 1777 WAT 8024 ATOM 1777 O WAT 8025 56.715 44.185 107.641 1.00 0.00 O ATOM 1778 H1 WAT 8025 57.660 44.093 107.518 1.00 0.00 H ATOM 1779 H2 WAT 8025 56.539 43.753 108.477 1.00 0.00 H TER 1781 WAT 8025 ATOM 1781 O WAT 8026 80.224 62.443 111.145 1.00 0.00 O ATOM 1782 H1 WAT 8026 80.914 63.097 111.251 1.00 0.00 H ATOM 1783 H2 WAT 8026 79.633 62.820 110.493 1.00 0.00 H TER 1785 WAT 8026 ATOM 1785 O WAT 8027 74.637 34.691 115.631 1.00 0.00 O ATOM 1786 H1 WAT 8027 73.719 34.775 115.888 1.00 0.00 H ATOM 1787 H2 WAT 8027 74.906 35.582 115.409 1.00 0.00 H TER 1789 WAT 8027 ATOM 1789 O WAT 8028 105.212 66.687 150.676 1.00 0.00 O ATOM 1790 H1 WAT 8028 105.348 65.778 150.406 1.00 0.00 H ATOM 1791 H2 WAT 8028 105.081 66.639 151.623 1.00 0.00 H TER 1793 WAT 8028 ATOM 1793 O WAT 8029 85.307 114.315 66.671 1.00 0.00 O ATOM 1794 H1 WAT 8029 85.293 113.779 67.464 1.00 0.00 H ATOM 1795 H2 WAT 8029 85.750 115.121 66.936 1.00 0.00 H TER 1797 WAT 8029 ATOM 1797 O WAT 8030 24.173 109.245 110.672 1.00 0.00 O ATOM 1798 H1 WAT 8030 24.791 109.976 110.664 1.00 0.00 H ATOM 1799 H2 WAT 8030 24.254 108.873 111.550 1.00 0.00 H TER 1801 WAT 8030 ATOM 1801 O WAT 8031 88.311 118.619 134.786 1.00 0.00 O ATOM 1802 H1 WAT 8031 88.200 119.195 134.029 1.00 0.00 H ATOM 1803 H2 WAT 8031 89.136 118.901 135.182 1.00 0.00 H TER 1805 WAT 8031 ATOM 1805 O WAT 8032 39.794 87.613 15.763 1.00 0.00 O ATOM 1806 H1 WAT 8032 40.339 88.044 16.421 1.00 0.00 H ATOM 1807 H2 WAT 8032 40.142 86.723 15.710 1.00 0.00 H TER 1809 WAT 8032 ATOM 1809 O WAT 8033 34.852 131.110 87.781 1.00 0.00 O ATOM 1810 H1 WAT 8033 34.060 130.856 88.254 1.00 0.00 H ATOM 1811 H2 WAT 8033 35.527 130.513 88.106 1.00 0.00 H TER 1813 WAT 8033 ATOM 1813 O WAT 8034 20.599 111.791 13.092 1.00 0.00 O ATOM 1814 H1 WAT 8034 19.879 112.320 13.435 1.00 0.00 H ATOM 1815 H2 WAT 8034 21.232 111.754 13.809 1.00 0.00 H TER 1817 WAT 8034 ATOM 1817 O WAT 8035 25.723 87.034 90.577 1.00 0.00 O ATOM 1818 H1 WAT 8035 25.935 86.880 91.497 1.00 0.00 H ATOM 1819 H2 WAT 8035 25.008 86.425 90.390 1.00 0.00 H TER 1821 WAT 8035 ATOM 1821 O WAT 8036 134.780 34.189 11.140 1.00 0.00 O ATOM 1822 H1 WAT 8036 134.930 34.994 10.645 1.00 0.00 H ATOM 1823 H2 WAT 8036 135.109 34.383 12.018 1.00 0.00 H TER 1825 WAT 8036 ATOM 1825 O WAT 8037 45.268 14.578 65.189 1.00 0.00 O ATOM 1826 H1 WAT 8037 44.529 14.925 65.688 1.00 0.00 H ATOM 1827 H2 WAT 8037 45.888 15.305 65.143 1.00 0.00 H TER 1829 WAT 8037 ATOM 1829 O WAT 8038 105.764 77.014 145.644 1.00 0.00 O ATOM 1830 H1 WAT 8038 104.942 76.524 145.614 1.00 0.00 H ATOM 1831 H2 WAT 8038 105.964 77.200 144.726 1.00 0.00 H TER 1833 WAT 8038 ATOM 1833 O WAT 8039 88.186 94.572 0.199 1.00 0.00 O ATOM 1834 H1 WAT 8039 87.914 95.463 0.418 1.00 0.00 H ATOM 1835 H2 WAT 8039 88.364 94.161 1.045 1.00 0.00 H TER 1837 WAT 8039 ATOM 1837 O WAT 8040 32.365 110.488 77.899 1.00 0.00 O ATOM 1838 H1 WAT 8040 32.253 111.066 78.654 1.00 0.00 H ATOM 1839 H2 WAT 8040 31.529 110.028 77.823 1.00 0.00 H TER 1841 WAT 8040 ATOM 1841 O WAT 8041 6.920 53.538 87.431 1.00 0.00 O ATOM 1842 H1 WAT 8041 7.492 52.803 87.209 1.00 0.00 H ATOM 1843 H2 WAT 8041 7.394 54.311 87.125 1.00 0.00 H TER 1845 WAT 8041 ATOM 1845 O WAT 8042 89.152 47.071 94.808 1.00 0.00 O ATOM 1846 H1 WAT 8042 88.887 47.608 94.062 1.00 0.00 H ATOM 1847 H2 WAT 8042 89.345 47.702 95.501 1.00 0.00 H TER 1849 WAT 8042 ATOM 1849 O WAT 8043 102.653 69.025 78.582 1.00 0.00 O ATOM 1850 H1 WAT 8043 102.825 68.219 79.069 1.00 0.00 H ATOM 1851 H2 WAT 8043 103.346 69.624 78.859 1.00 0.00 H TER 1853 WAT 8043 ATOM 1853 O WAT 8044 15.220 29.466 147.113 1.00 0.00 O ATOM 1854 H1 WAT 8044 15.967 29.438 146.516 1.00 0.00 H ATOM 1855 H2 WAT 8044 15.337 30.279 147.604 1.00 0.00 H TER 1857 WAT 8044 ATOM 1857 O WAT 8045 110.935 25.152 155.809 1.00 0.00 O ATOM 1858 H1 WAT 8045 111.130 25.255 156.740 1.00 0.00 H ATOM 1859 H2 WAT 8045 110.155 25.687 155.666 1.00 0.00 H TER 1861 WAT 8045 ATOM 1861 O WAT 8046 136.309 47.954 111.986 1.00 0.00 O ATOM 1862 H1 WAT 8046 136.166 47.319 112.688 1.00 0.00 H ATOM 1863 H2 WAT 8046 137.114 48.408 112.234 1.00 0.00 H TER 1865 WAT 8046 ATOM 1865 O WAT 8047 94.408 101.204 1.586 1.00 0.00 O ATOM 1866 H1 WAT 8047 94.511 100.499 2.227 1.00 0.00 H ATOM 1867 H2 WAT 8047 94.124 101.958 2.104 1.00 0.00 H TER 1869 WAT 8047 ATOM 1869 O WAT 8048 113.723 22.049 133.063 1.00 0.00 O ATOM 1870 H1 WAT 8048 114.267 21.421 132.587 1.00 0.00 H ATOM 1871 H2 WAT 8048 113.643 22.795 132.469 1.00 0.00 H TER 1873 WAT 8048 ATOM 1873 O WAT 8049 90.929 15.856 111.697 1.00 0.00 O ATOM 1874 H1 WAT 8049 91.283 16.735 111.829 1.00 0.00 H ATOM 1875 H2 WAT 8049 89.997 15.939 111.901 1.00 0.00 H TER 1877 WAT 8049 ATOM 1877 O WAT 8050 88.021 8.047 101.336 1.00 0.00 O ATOM 1878 H1 WAT 8050 88.396 7.577 100.591 1.00 0.00 H ATOM 1879 H2 WAT 8050 87.957 7.387 102.027 1.00 0.00 H TER 1881 WAT 8050 ATOM 1881 O WAT 8051 116.960 130.132 89.419 1.00 0.00 O ATOM 1882 H1 WAT 8051 116.989 129.382 88.825 1.00 0.00 H ATOM 1883 H2 WAT 8051 116.174 130.613 89.159 1.00 0.00 H TER 1885 WAT 8051 ATOM 1885 O WAT 8052 15.721 131.352 123.941 1.00 0.00 O ATOM 1886 H1 WAT 8052 15.574 130.469 124.280 1.00 0.00 H ATOM 1887 H2 WAT 8052 16.097 131.215 123.072 1.00 0.00 H TER 1889 WAT 8052 ATOM 1889 O WAT 8053 32.538 93.125 110.259 1.00 0.00 O ATOM 1890 H1 WAT 8053 32.031 92.417 109.862 1.00 0.00 H ATOM 1891 H2 WAT 8053 33.084 92.691 110.915 1.00 0.00 H TER 1893 WAT 8053 ATOM 1893 O WAT 8054 129.135 74.848 131.630 1.00 0.00 O ATOM 1894 H1 WAT 8054 128.630 75.635 131.831 1.00 0.00 H ATOM 1895 H2 WAT 8054 130.003 75.021 131.995 1.00 0.00 H TER 1897 WAT 8054 ATOM 1897 O WAT 8055 94.937 53.227 80.462 1.00 0.00 O ATOM 1898 H1 WAT 8055 95.834 53.242 80.129 1.00 0.00 H ATOM 1899 H2 WAT 8055 94.557 52.430 80.091 1.00 0.00 H TER 1901 WAT 8055 ATOM 1901 O WAT 8056 132.551 81.855 81.776 1.00 0.00 O ATOM 1902 H1 WAT 8056 132.240 82.758 81.725 1.00 0.00 H ATOM 1903 H2 WAT 8056 132.514 81.537 80.874 1.00 0.00 H TER 1905 WAT 8056 ATOM 1905 O WAT 8057 33.714 106.679 149.786 1.00 0.00 O ATOM 1906 H1 WAT 8057 33.463 105.981 149.182 1.00 0.00 H ATOM 1907 H2 WAT 8057 33.221 107.443 149.488 1.00 0.00 H TER 1909 WAT 8057 ATOM 1909 O WAT 8058 95.829 13.283 1.381 1.00 0.00 O ATOM 1910 H1 WAT 8058 95.312 13.393 2.179 1.00 0.00 H ATOM 1911 H2 WAT 8058 95.244 12.826 0.777 1.00 0.00 H TER 1913 WAT 8058 ATOM 1913 O WAT 8059 12.943 48.676 10.965 1.00 0.00 O ATOM 1914 H1 WAT 8059 13.149 48.341 10.093 1.00 0.00 H ATOM 1915 H2 WAT 8059 13.466 49.473 11.046 1.00 0.00 H TER 1917 WAT 8059 ATOM 1917 O WAT 8060 10.493 97.095 89.332 1.00 0.00 O ATOM 1918 H1 WAT 8060 11.023 97.755 89.779 1.00 0.00 H ATOM 1919 H2 WAT 8060 11.125 96.584 88.825 1.00 0.00 H TER 1921 WAT 8060 ATOM 1921 O WAT 8061 74.249 47.791 11.894 1.00 0.00 O ATOM 1922 H1 WAT 8061 73.460 48.332 11.923 1.00 0.00 H ATOM 1923 H2 WAT 8061 74.524 47.818 10.977 1.00 0.00 H TER 1925 WAT 8061 ATOM 1925 O WAT 8062 87.906 8.544 85.926 1.00 0.00 O ATOM 1926 H1 WAT 8062 88.216 9.290 85.413 1.00 0.00 H ATOM 1927 H2 WAT 8062 88.467 7.817 85.655 1.00 0.00 H TER 1929 WAT 8062 ATOM 1929 O WAT 8063 4.276 108.873 103.702 1.00 0.00 O ATOM 1930 H1 WAT 8063 3.829 108.947 102.858 1.00 0.00 H ATOM 1931 H2 WAT 8063 3.742 109.395 104.301 1.00 0.00 H TER 1933 WAT 8063 ATOM 1933 O WAT 8064 48.889 120.921 100.765 1.00 0.00 O ATOM 1934 H1 WAT 8064 49.810 121.032 100.530 1.00 0.00 H ATOM 1935 H2 WAT 8064 48.848 120.058 101.177 1.00 0.00 H TER 1937 WAT 8064 ATOM 1937 O WAT 8065 80.704 16.792 141.395 1.00 0.00 O ATOM 1938 H1 WAT 8065 81.436 16.176 141.363 1.00 0.00 H ATOM 1939 H2 WAT 8065 79.926 16.247 141.279 1.00 0.00 H TER 1941 WAT 8065 ATOM 1941 O WAT 8066 7.202 76.968 147.001 1.00 0.00 O ATOM 1942 H1 WAT 8066 8.142 76.833 147.117 1.00 0.00 H ATOM 1943 H2 WAT 8066 6.807 76.602 147.792 1.00 0.00 H TER 1945 WAT 8066 ATOM 1945 O WAT 8067 70.885 131.557 150.778 1.00 0.00 O ATOM 1946 H1 WAT 8067 69.968 131.326 150.628 1.00 0.00 H ATOM 1947 H2 WAT 8067 71.049 131.307 151.688 1.00 0.00 H TER 1949 WAT 8067 ATOM 1949 O WAT 8068 30.421 5.095 70.013 1.00 0.00 O ATOM 1950 H1 WAT 8068 31.011 4.576 70.561 1.00 0.00 H ATOM 1951 H2 WAT 8068 30.149 5.821 70.574 1.00 0.00 H TER 1953 WAT 8068 ATOM 1953 O WAT 8069 63.135 31.444 24.999 1.00 0.00 O ATOM 1954 H1 WAT 8069 62.583 31.647 24.243 1.00 0.00 H ATOM 1955 H2 WAT 8069 63.027 32.195 25.582 1.00 0.00 H TER 1957 WAT 8069 ATOM 1957 O WAT 8070 80.664 53.235 24.149 1.00 0.00 O ATOM 1958 H1 WAT 8070 81.440 53.669 24.502 1.00 0.00 H ATOM 1959 H2 WAT 8070 80.078 53.952 23.907 1.00 0.00 H TER 1961 WAT 8070 ATOM 1961 O WAT 8071 29.015 27.124 64.891 1.00 0.00 O ATOM 1962 H1 WAT 8071 29.378 26.317 64.526 1.00 0.00 H ATOM 1963 H2 WAT 8071 29.535 27.823 64.493 1.00 0.00 H TER 1965 WAT 8071 ATOM 1965 O WAT 8072 25.814 24.676 99.104 1.00 0.00 O ATOM 1966 H1 WAT 8072 25.241 24.122 98.574 1.00 0.00 H ATOM 1967 H2 WAT 8072 26.670 24.608 98.682 1.00 0.00 H TER 1969 WAT 8072 ATOM 1969 O WAT 8073 41.874 91.844 8.929 1.00 0.00 O ATOM 1970 H1 WAT 8073 41.786 90.997 9.365 1.00 0.00 H ATOM 1971 H2 WAT 8073 40.988 92.207 8.929 1.00 0.00 H TER 1973 WAT 8073 ATOM 1973 O WAT 8074 121.633 43.193 5.932 1.00 0.00 O ATOM 1974 H1 WAT 8074 121.338 43.542 5.091 1.00 0.00 H ATOM 1975 H2 WAT 8074 120.986 42.522 6.153 1.00 0.00 H TER 1977 WAT 8074 ATOM 1977 O WAT 8075 97.271 140.945 150.170 1.00 0.00 O ATOM 1978 H1 WAT 8075 96.634 140.272 150.408 1.00 0.00 H ATOM 1979 H2 WAT 8075 96.757 141.750 150.108 1.00 0.00 H TER 1981 WAT 8075 ATOM 1981 O WAT 8076 1.037 29.035 71.189 1.00 0.00 O ATOM 1982 H1 WAT 8076 1.179 28.204 70.735 1.00 0.00 H ATOM 1983 H2 WAT 8076 1.668 29.025 71.909 1.00 0.00 H TER 1985 WAT 8076 ATOM 1985 O WAT 8077 113.853 69.020 125.662 1.00 0.00 O ATOM 1986 H1 WAT 8077 113.289 69.381 126.346 1.00 0.00 H ATOM 1987 H2 WAT 8077 113.763 69.631 124.931 1.00 0.00 H TER 1989 WAT 8077 ATOM 1989 O WAT 8078 63.211 51.352 16.216 1.00 0.00 O ATOM 1990 H1 WAT 8078 64.034 50.904 16.020 1.00 0.00 H ATOM 1991 H2 WAT 8078 63.261 52.170 15.722 1.00 0.00 H TER 1993 WAT 8078 ATOM 1993 O WAT 8079 115.759 42.927 149.549 1.00 0.00 O ATOM 1994 H1 WAT 8079 114.948 43.065 150.039 1.00 0.00 H ATOM 1995 H2 WAT 8079 116.099 43.808 149.396 1.00 0.00 H TER 1997 WAT 8079 ATOM 1997 O WAT 8080 127.464 123.287 76.590 1.00 0.00 O ATOM 1998 H1 WAT 8080 127.651 122.812 77.400 1.00 0.00 H ATOM 1999 H2 WAT 8080 126.987 124.067 76.874 1.00 0.00 H TER 2001 WAT 8080 ATOM 2001 O WAT 8081 31.952 135.322 96.726 1.00 0.00 O ATOM 2002 H1 WAT 8081 32.508 134.678 96.286 1.00 0.00 H ATOM 2003 H2 WAT 8081 31.409 135.687 96.027 1.00 0.00 H TER 2005 WAT 8081 ATOM 2005 O WAT 8082 111.543 3.174 123.977 1.00 0.00 O ATOM 2006 H1 WAT 8082 111.218 3.465 124.830 1.00 0.00 H ATOM 2007 H2 WAT 8082 112.391 3.607 123.883 1.00 0.00 H TER 2009 WAT 8082 ATOM 2009 O WAT 8083 24.831 83.201 91.342 1.00 0.00 O ATOM 2010 H1 WAT 8083 24.247 83.911 91.076 1.00 0.00 H ATOM 2011 H2 WAT 8083 25.521 83.634 91.845 1.00 0.00 H TER 2013 WAT 8083 ATOM 2013 O WAT 8084 111.325 118.246 14.622 1.00 0.00 O ATOM 2014 H1 WAT 8084 110.489 118.211 14.157 1.00 0.00 H ATOM 2015 H2 WAT 8084 111.837 117.528 14.249 1.00 0.00 H TER 2017 WAT 8084 ATOM 2017 O WAT 8085 24.530 12.170 85.567 1.00 0.00 O ATOM 2018 H1 WAT 8085 24.564 12.720 84.784 1.00 0.00 H ATOM 2019 H2 WAT 8085 25.383 12.295 85.984 1.00 0.00 H TER 2021 WAT 8085 ATOM 2021 O WAT 8086 52.560 6.350 153.786 1.00 0.00 O ATOM 2022 H1 WAT 8086 52.165 6.667 152.973 1.00 0.00 H ATOM 2023 H2 WAT 8086 52.215 6.931 154.463 1.00 0.00 H TER 2025 WAT 8086 ATOM 2025 O WAT 8087 55.395 95.518 19.684 1.00 0.00 O ATOM 2026 H1 WAT 8087 55.879 94.693 19.633 1.00 0.00 H ATOM 2027 H2 WAT 8087 55.057 95.652 18.799 1.00 0.00 H TER 2029 WAT 8087 ATOM 2029 O WAT 8088 8.486 17.636 59.684 1.00 0.00 O ATOM 2030 H1 WAT 8088 7.782 16.996 59.792 1.00 0.00 H ATOM 2031 H2 WAT 8088 8.949 17.352 58.896 1.00 0.00 H TER 2033 WAT 8088 ATOM 2033 O WAT 8089 86.533 139.102 150.620 1.00 0.00 O ATOM 2034 H1 WAT 8089 86.219 138.208 150.484 1.00 0.00 H ATOM 2035 H2 WAT 8089 85.757 139.649 150.500 1.00 0.00 H TER 2037 WAT 8089 ATOM 2037 O WAT 8090 59.195 129.077 147.938 1.00 0.00 O ATOM 2038 H1 WAT 8090 59.816 129.758 147.679 1.00 0.00 H ATOM 2039 H2 WAT 8090 58.341 129.507 147.907 1.00 0.00 H TER 2041 WAT 8090 ATOM 2041 O WAT 8091 10.221 96.026 106.311 1.00 0.00 O ATOM 2042 H1 WAT 8091 10.066 95.970 107.254 1.00 0.00 H ATOM 2043 H2 WAT 8091 11.158 95.858 106.212 1.00 0.00 H TER 2045 WAT 8091 ATOM 2045 O WAT 8092 98.021 67.573 150.576 1.00 0.00 O ATOM 2046 H1 WAT 8092 97.374 68.236 150.338 1.00 0.00 H ATOM 2047 H2 WAT 8092 97.646 67.135 151.340 1.00 0.00 H TER 2049 WAT 8092 ATOM 2049 O WAT 8093 61.196 121.965 147.193 1.00 0.00 O ATOM 2050 H1 WAT 8093 61.990 122.397 147.509 1.00 0.00 H ATOM 2051 H2 WAT 8093 60.682 122.669 146.795 1.00 0.00 H TER 2053 WAT 8093 ATOM 2053 O WAT 8094 99.607 128.427 13.640 1.00 0.00 O ATOM 2054 H1 WAT 8094 98.761 128.225 13.241 1.00 0.00 H ATOM 2055 H2 WAT 8094 99.540 129.349 13.889 1.00 0.00 H TER 2057 WAT 8094 ATOM 2057 O WAT 8095 101.549 96.972 145.631 1.00 0.00 O ATOM 2058 H1 WAT 8095 101.435 97.278 144.732 1.00 0.00 H ATOM 2059 H2 WAT 8095 102.320 96.406 145.595 1.00 0.00 H TER 2061 WAT 8095 ATOM 2061 O WAT 8096 89.460 100.069 2.293 1.00 0.00 O ATOM 2062 H1 WAT 8096 90.011 99.287 2.256 1.00 0.00 H ATOM 2063 H2 WAT 8096 89.002 100.000 3.130 1.00 0.00 H TER 2065 WAT 8096 ATOM 2065 O WAT 8097 10.963 6.135 69.303 1.00 0.00 O ATOM 2066 H1 WAT 8097 11.809 6.163 68.857 1.00 0.00 H ATOM 2067 H2 WAT 8097 10.414 6.747 68.812 1.00 0.00 H TER 2069 WAT 8097 ATOM 2069 O WAT 8098 136.569 113.449 94.899 1.00 0.00 O ATOM 2070 H1 WAT 8098 136.164 113.258 94.053 1.00 0.00 H ATOM 2071 H2 WAT 8098 137.422 113.016 94.859 1.00 0.00 H TER 2073 WAT 8098 ATOM 2073 O WAT 8099 65.581 79.368 146.139 1.00 0.00 O ATOM 2074 H1 WAT 8099 64.895 80.036 146.158 1.00 0.00 H ATOM 2075 H2 WAT 8099 65.374 78.834 145.373 1.00 0.00 H TER 2077 WAT 8099 ATOM 2077 O WAT 8100 36.118 30.473 134.769 1.00 0.00 O ATOM 2078 H1 WAT 8100 35.709 31.198 135.242 1.00 0.00 H ATOM 2079 H2 WAT 8100 36.661 30.035 135.424 1.00 0.00 H TER 2081 WAT 8100 ATOM 2081 O WAT 8101 65.264 8.654 11.347 1.00 0.00 O ATOM 2082 H1 WAT 8101 66.057 8.147 11.175 1.00 0.00 H ATOM 2083 H2 WAT 8101 64.570 8.175 10.894 1.00 0.00 H TER 2085 WAT 8101 ATOM 2085 O WAT 8102 52.277 22.118 22.702 1.00 0.00 O ATOM 2086 H1 WAT 8102 52.164 21.378 23.299 1.00 0.00 H ATOM 2087 H2 WAT 8102 51.385 22.416 22.520 1.00 0.00 H TER 2089 WAT 8102 ATOM 2089 O WAT 8103 23.783 90.453 150.144 1.00 0.00 O ATOM 2090 H1 WAT 8103 24.475 90.279 150.781 1.00 0.00 H ATOM 2091 H2 WAT 8103 24.073 90.010 149.347 1.00 0.00 H TER 2093 WAT 8103 ATOM 2093 O WAT 8104 19.995 15.355 136.216 1.00 0.00 O ATOM 2094 H1 WAT 8104 19.369 15.696 136.855 1.00 0.00 H ATOM 2095 H2 WAT 8104 20.852 15.597 136.566 1.00 0.00 H TER 2097 WAT 8104 ATOM 2097 O WAT 8105 120.720 101.632 65.149 1.00 0.00 O ATOM 2098 H1 WAT 8105 120.398 101.836 64.270 1.00 0.00 H ATOM 2099 H2 WAT 8105 120.119 102.092 65.736 1.00 0.00 H TER 2101 WAT 8105 ATOM 2101 O WAT 8106 145.312 135.605 16.797 1.00 0.00 O ATOM 2102 H1 WAT 8106 145.251 134.862 17.397 1.00 0.00 H ATOM 2103 H2 WAT 8106 144.704 136.253 17.155 1.00 0.00 H TER 2105 WAT 8106 ATOM 2105 O WAT 8107 69.794 62.470 6.958 1.00 0.00 O ATOM 2106 H1 WAT 8107 70.504 63.098 7.089 1.00 0.00 H ATOM 2107 H2 WAT 8107 70.217 61.712 6.553 1.00 0.00 H TER 2109 WAT 8107 ATOM 2109 O WAT 8108 129.365 40.203 96.983 1.00 0.00 O ATOM 2110 H1 WAT 8108 128.980 39.972 96.137 1.00 0.00 H ATOM 2111 H2 WAT 8108 129.994 40.895 96.779 1.00 0.00 H TER 2113 WAT 8108 ATOM 2113 O WAT 8109 60.799 59.346 123.362 1.00 0.00 O ATOM 2114 H1 WAT 8109 61.399 58.608 123.465 1.00 0.00 H ATOM 2115 H2 WAT 8109 61.368 60.114 123.320 1.00 0.00 H TER 2117 WAT 8109 ATOM 2117 O WAT 8110 143.475 126.184 74.021 1.00 0.00 O ATOM 2118 H1 WAT 8110 142.525 126.247 74.121 1.00 0.00 H ATOM 2119 H2 WAT 8110 143.827 126.602 74.807 1.00 0.00 H TER 2121 WAT 8110 ATOM 2121 O WAT 8111 7.419 119.113 147.544 1.00 0.00 O ATOM 2122 H1 WAT 8111 7.741 118.237 147.753 1.00 0.00 H ATOM 2123 H2 WAT 8111 7.413 119.573 148.383 1.00 0.00 H TER 2125 WAT 8111 ATOM 2125 O WAT 8112 115.353 93.963 124.904 1.00 0.00 O ATOM 2126 H1 WAT 8112 115.013 93.929 125.798 1.00 0.00 H ATOM 2127 H2 WAT 8112 115.750 93.103 124.765 1.00 0.00 H TER 2129 WAT 8112 ATOM 2129 O WAT 8113 55.968 1.234 105.694 1.00 0.00 O ATOM 2130 H1 WAT 8113 56.001 1.480 106.619 1.00 0.00 H ATOM 2131 H2 WAT 8113 55.556 1.982 105.262 1.00 0.00 H TER 2133 WAT 8113 ATOM 2133 O WAT 8114 18.923 39.436 66.655 1.00 0.00 O ATOM 2134 H1 WAT 8114 18.788 38.597 66.216 1.00 0.00 H ATOM 2135 H2 WAT 8114 19.309 39.205 67.500 1.00 0.00 H TER 2137 WAT 8114 ATOM 2137 O WAT 8115 38.146 132.173 146.442 1.00 0.00 O ATOM 2138 H1 WAT 8115 37.223 132.021 146.237 1.00 0.00 H ATOM 2139 H2 WAT 8115 38.154 132.366 147.379 1.00 0.00 H TER 2141 WAT 8115 ATOM 2141 O WAT 8116 137.388 87.229 137.515 1.00 0.00 O ATOM 2142 H1 WAT 8116 137.323 86.408 137.027 1.00 0.00 H ATOM 2143 H2 WAT 8116 136.615 87.727 137.248 1.00 0.00 H TER 2145 WAT 8116 ATOM 2145 O WAT 8117 2.740 33.656 110.264 1.00 0.00 O ATOM 2146 H1 WAT 8117 2.299 32.987 110.787 1.00 0.00 H ATOM 2147 H2 WAT 8117 3.647 33.355 110.206 1.00 0.00 H TER 2149 WAT 8117 ATOM 2149 O WAT 8118 64.537 85.535 140.462 1.00 0.00 O ATOM 2150 H1 WAT 8118 64.699 85.711 141.389 1.00 0.00 H ATOM 2151 H2 WAT 8118 64.751 86.358 140.021 1.00 0.00 H TER 2153 WAT 8118 ATOM 2153 O WAT 8119 143.395 75.494 143.090 1.00 0.00 O ATOM 2154 H1 WAT 8119 142.688 75.834 142.542 1.00 0.00 H ATOM 2155 H2 WAT 8119 143.430 76.095 143.835 1.00 0.00 H TER 2157 WAT 8119 ATOM 2157 O WAT 8120 35.881 105.890 92.676 1.00 0.00 O ATOM 2158 H1 WAT 8120 35.957 105.583 93.579 1.00 0.00 H ATOM 2159 H2 WAT 8120 35.640 106.813 92.756 1.00 0.00 H TER 2161 WAT 8120 ATOM 2161 O WAT 8121 29.423 38.511 64.284 1.00 0.00 O ATOM 2162 H1 WAT 8121 30.178 37.925 64.353 1.00 0.00 H ATOM 2163 H2 WAT 8121 29.579 39.008 63.481 1.00 0.00 H TER 2165 WAT 8121 ATOM 2165 O WAT 8122 42.360 120.490 130.641 1.00 0.00 O ATOM 2166 H1 WAT 8122 42.211 119.864 131.350 1.00 0.00 H ATOM 2167 H2 WAT 8122 43.093 120.123 130.148 1.00 0.00 H TER 2169 WAT 8122 ATOM 2169 O WAT 8123 130.549 72.015 57.409 1.00 0.00 O ATOM 2170 H1 WAT 8123 130.102 72.758 57.814 1.00 0.00 H ATOM 2171 H2 WAT 8123 131.295 72.404 56.952 1.00 0.00 H TER 2173 WAT 8123 ATOM 2173 O WAT 8124 21.233 63.094 70.600 1.00 0.00 O ATOM 2174 H1 WAT 8124 21.769 62.834 69.851 1.00 0.00 H ATOM 2175 H2 WAT 8124 20.912 63.967 70.373 1.00 0.00 H TER 2177 WAT 8124 ATOM 2177 O WAT 8125 40.808 8.811 147.292 1.00 0.00 O ATOM 2178 H1 WAT 8125 40.798 9.650 147.753 1.00 0.00 H ATOM 2179 H2 WAT 8125 39.988 8.389 147.547 1.00 0.00 H TER 2181 WAT 8125 ATOM 2181 O WAT 8126 33.109 8.664 112.533 1.00 0.00 O ATOM 2182 H1 WAT 8126 32.908 8.084 113.268 1.00 0.00 H ATOM 2183 H2 WAT 8126 32.955 9.545 112.874 1.00 0.00 H TER 2185 WAT 8126 ATOM 2185 O WAT 8127 1.149 111.716 8.578 1.00 0.00 O ATOM 2186 H1 WAT 8127 2.001 111.300 8.445 1.00 0.00 H ATOM 2187 H2 WAT 8127 0.746 111.718 7.710 1.00 0.00 H TER 2189 WAT 8127 ATOM 2189 O WAT 8128 143.621 1.364 70.842 1.00 0.00 O ATOM 2190 H1 WAT 8128 143.703 0.669 71.496 1.00 0.00 H ATOM 2191 H2 WAT 8128 143.922 0.963 70.027 1.00 0.00 H TER 2193 WAT 8128 ATOM 2193 O WAT 8129 70.097 102.387 105.587 1.00 0.00 O ATOM 2194 H1 WAT 8129 69.381 102.476 106.217 1.00 0.00 H ATOM 2195 H2 WAT 8129 69.981 103.123 104.987 1.00 0.00 H TER 2197 WAT 8129 ATOM 2197 O WAT 8130 39.517 26.830 98.813 1.00 0.00 O ATOM 2198 H1 WAT 8130 39.894 27.119 97.982 1.00 0.00 H ATOM 2199 H2 WAT 8130 40.135 26.177 99.142 1.00 0.00 H TER 2201 WAT 8130 ATOM 2201 O WAT 8131 112.423 79.929 136.261 1.00 0.00 O ATOM 2202 H1 WAT 8131 112.369 80.871 136.102 1.00 0.00 H ATOM 2203 H2 WAT 8131 111.663 79.565 135.808 1.00 0.00 H TER 2205 WAT 8131 ATOM 2205 O WAT 8132 74.167 121.206 84.966 1.00 0.00 O ATOM 2206 H1 WAT 8132 73.217 121.311 85.013 1.00 0.00 H ATOM 2207 H2 WAT 8132 74.468 121.971 84.475 1.00 0.00 H TER 2209 WAT 8132 ATOM 2209 O WAT 8133 27.230 133.163 93.853 1.00 0.00 O ATOM 2210 H1 WAT 8133 27.882 132.462 93.831 1.00 0.00 H ATOM 2211 H2 WAT 8133 26.643 132.967 93.123 1.00 0.00 H TER 2213 WAT 8133 ATOM 2213 O WAT 8134 84.167 124.603 113.075 1.00 0.00 O ATOM 2214 H1 WAT 8134 83.588 123.881 113.318 1.00 0.00 H ATOM 2215 H2 WAT 8134 83.767 124.977 112.291 1.00 0.00 H TER 2217 WAT 8134 ATOM 2217 O WAT 8135 17.137 32.086 110.994 1.00 0.00 O ATOM 2218 H1 WAT 8135 17.448 32.693 110.323 1.00 0.00 H ATOM 2219 H2 WAT 8135 17.642 31.286 110.846 1.00 0.00 H TER 2221 WAT 8135 ATOM 2221 O WAT 8136 77.580 78.074 56.546 1.00 0.00 O ATOM 2222 H1 WAT 8136 77.879 77.165 56.502 1.00 0.00 H ATOM 2223 H2 WAT 8136 76.737 78.027 56.998 1.00 0.00 H TER 2225 WAT 8136 ATOM 2225 O WAT 8137 69.712 30.081 87.640 1.00 0.00 O ATOM 2226 H1 WAT 8137 69.595 29.236 88.073 1.00 0.00 H ATOM 2227 H2 WAT 8137 70.587 30.367 87.904 1.00 0.00 H TER 2229 WAT 8137 ATOM 2229 O WAT 8138 137.404 125.777 115.341 1.00 0.00 O ATOM 2230 H1 WAT 8138 137.443 125.301 116.170 1.00 0.00 H ATOM 2231 H2 WAT 8138 136.568 125.515 114.954 1.00 0.00 H TER 2233 WAT 8138 ATOM 2233 O WAT 8139 23.868 132.235 111.347 1.00 0.00 O ATOM 2234 H1 WAT 8139 23.935 131.416 111.837 1.00 0.00 H ATOM 2235 H2 WAT 8139 23.447 131.988 110.524 1.00 0.00 H TER 2237 WAT 8139 ATOM 2237 O WAT 8140 83.460 44.162 2.776 1.00 0.00 O ATOM 2238 H1 WAT 8140 83.127 44.217 3.671 1.00 0.00 H ATOM 2239 H2 WAT 8140 83.980 44.959 2.665 1.00 0.00 H TER 2241 WAT 8140 ATOM 2241 O WAT 8141 143.451 5.743 113.809 1.00 0.00 O ATOM 2242 H1 WAT 8141 143.943 5.441 113.045 1.00 0.00 H ATOM 2243 H2 WAT 8141 142.933 4.983 114.075 1.00 0.00 H TER 2245 WAT 8141 ATOM 2245 O WAT 8142 70.367 127.280 128.046 1.00 0.00 O ATOM 2246 H1 WAT 8142 70.970 127.153 127.314 1.00 0.00 H ATOM 2247 H2 WAT 8142 70.675 126.671 128.718 1.00 0.00 H TER 2249 WAT 8142 ATOM 2249 O WAT 8143 10.626 13.021 10.304 1.00 0.00 O ATOM 2250 H1 WAT 8143 10.961 13.917 10.352 1.00 0.00 H ATOM 2251 H2 WAT 8143 10.299 12.840 11.185 1.00 0.00 H TER 2253 WAT 8143 ATOM 2253 O WAT 8144 130.984 52.117 6.418 1.00 0.00 O ATOM 2254 H1 WAT 8144 130.732 51.328 5.938 1.00 0.00 H ATOM 2255 H2 WAT 8144 130.965 52.813 5.762 1.00 0.00 H TER 2257 WAT 8144 ATOM 2257 O WAT 8145 116.886 83.774 82.209 1.00 0.00 O ATOM 2258 H1 WAT 8145 116.949 83.342 81.357 1.00 0.00 H ATOM 2259 H2 WAT 8145 116.916 84.709 82.007 1.00 0.00 H TER 2261 WAT 8145 ATOM 2261 O WAT 8146 132.762 35.006 8.229 1.00 0.00 O ATOM 2262 H1 WAT 8146 132.528 34.078 8.194 1.00 0.00 H ATOM 2263 H2 WAT 8146 131.968 35.442 8.536 1.00 0.00 H TER 2265 WAT 8146 ATOM 2265 O WAT 8147 70.286 60.474 153.431 1.00 0.00 O ATOM 2266 H1 WAT 8147 69.799 60.968 154.091 1.00 0.00 H ATOM 2267 H2 WAT 8147 71.198 60.737 153.561 1.00 0.00 H TER 2269 WAT 8147 ATOM 2269 O WAT 8148 133.708 8.566 131.476 1.00 0.00 O ATOM 2270 H1 WAT 8148 132.895 8.325 131.031 1.00 0.00 H ATOM 2271 H2 WAT 8148 134.148 9.159 130.866 1.00 0.00 H TER 2273 WAT 8148 ATOM 2273 O WAT 8149 128.368 46.941 1.685 1.00 0.00 O ATOM 2274 H1 WAT 8149 128.294 46.046 2.017 1.00 0.00 H ATOM 2275 H2 WAT 8149 128.206 46.861 0.745 1.00 0.00 H TER 2277 WAT 8149 ATOM 2277 O WAT 8150 99.044 112.619 96.836 1.00 0.00 O ATOM 2278 H1 WAT 8150 98.524 113.371 97.120 1.00 0.00 H ATOM 2279 H2 WAT 8150 99.648 112.458 97.561 1.00 0.00 H TER 2281 WAT 8150 ATOM 2281 O WAT 8151 113.525 2.811 57.463 1.00 0.00 O ATOM 2282 H1 WAT 8151 113.429 2.362 56.624 1.00 0.00 H ATOM 2283 H2 WAT 8151 113.484 3.742 57.243 1.00 0.00 H TER 2285 WAT 8151 ATOM 2285 O WAT 8152 10.160 37.102 15.375 1.00 0.00 O ATOM 2286 H1 WAT 8152 9.820 36.509 14.705 1.00 0.00 H ATOM 2287 H2 WAT 8152 9.381 37.433 15.821 1.00 0.00 H TER 2289 WAT 8152 ATOM 2289 O WAT 8153 20.200 99.635 102.903 1.00 0.00 O ATOM 2290 H1 WAT 8153 20.444 98.981 103.558 1.00 0.00 H ATOM 2291 H2 WAT 8153 19.378 100.003 103.228 1.00 0.00 H TER 2293 WAT 8153 ATOM 2293 O WAT 8154 62.145 29.381 157.162 1.00 0.00 O ATOM 2294 H1 WAT 8154 62.948 29.182 156.681 1.00 0.00 H ATOM 2295 H2 WAT 8154 61.681 30.007 156.605 1.00 0.00 H TER 2297 WAT 8154 ATOM 2297 O WAT 8155 32.281 52.905 122.696 1.00 0.00 O ATOM 2298 H1 WAT 8155 31.856 52.555 121.913 1.00 0.00 H ATOM 2299 H2 WAT 8155 32.600 53.768 122.430 1.00 0.00 H TER 2301 WAT 8155 ATOM 2301 O WAT 8156 6.514 122.263 107.485 1.00 0.00 O ATOM 2302 H1 WAT 8156 6.667 123.208 107.446 1.00 0.00 H ATOM 2303 H2 WAT 8156 7.252 121.922 107.991 1.00 0.00 H TER 2305 WAT 8156 ATOM 2305 O WAT 8157 142.204 110.770 136.973 1.00 0.00 O ATOM 2306 H1 WAT 8157 142.568 111.621 136.726 1.00 0.00 H ATOM 2307 H2 WAT 8157 141.635 110.960 137.719 1.00 0.00 H TER 2309 WAT 8157 ATOM 2309 O WAT 8158 56.018 62.386 70.991 1.00 0.00 O ATOM 2310 H1 WAT 8158 56.650 61.849 71.468 1.00 0.00 H ATOM 2311 H2 WAT 8158 55.214 61.866 70.990 1.00 0.00 H TER 2313 WAT 8158 ATOM 2313 O WAT 8159 15.666 31.459 57.978 1.00 0.00 O ATOM 2314 H1 WAT 8159 15.847 30.865 58.707 1.00 0.00 H ATOM 2315 H2 WAT 8159 16.424 31.369 57.401 1.00 0.00 H TER 2317 WAT 8159 ATOM 2317 O WAT 8160 127.072 18.830 128.613 1.00 0.00 O ATOM 2318 H1 WAT 8160 127.452 19.462 129.224 1.00 0.00 H ATOM 2319 H2 WAT 8160 127.467 19.046 127.768 1.00 0.00 H TER 2321 WAT 8160 ATOM 2321 O WAT 8161 65.666 109.136 92.137 1.00 0.00 O ATOM 2322 H1 WAT 8161 65.094 108.592 91.597 1.00 0.00 H ATOM 2323 H2 WAT 8161 65.521 108.824 93.030 1.00 0.00 H TER 2325 WAT 8161 ATOM 2325 O WAT 8162 102.436 27.518 121.411 1.00 0.00 O ATOM 2326 H1 WAT 8162 102.032 28.330 121.716 1.00 0.00 H ATOM 2327 H2 WAT 8162 102.241 27.491 120.474 1.00 0.00 H TER 2329 WAT 8162 ATOM 2329 O WAT 8163 115.829 128.618 132.029 1.00 0.00 O ATOM 2330 H1 WAT 8163 115.393 129.178 132.671 1.00 0.00 H ATOM 2331 H2 WAT 8163 116.762 128.720 132.218 1.00 0.00 H TER 2333 WAT 8163 ATOM 2333 O WAT 8164 45.081 81.383 107.073 1.00 0.00 O ATOM 2334 H1 WAT 8164 45.154 81.998 107.803 1.00 0.00 H ATOM 2335 H2 WAT 8164 44.385 80.781 107.336 1.00 0.00 H TER 2337 WAT 8164 ATOM 2337 O WAT 8165 131.171 89.459 94.490 1.00 0.00 O ATOM 2338 H1 WAT 8165 130.544 89.869 95.086 1.00 0.00 H ATOM 2339 H2 WAT 8165 131.905 90.073 94.454 1.00 0.00 H TER 2341 WAT 8165 ATOM 2341 O WAT 8166 20.835 144.815 6.492 1.00 0.00 O ATOM 2342 H1 WAT 8166 20.759 145.295 7.317 1.00 0.00 H ATOM 2343 H2 WAT 8166 20.527 145.432 5.827 1.00 0.00 H TER 2345 WAT 8166 ATOM 2345 O WAT 8167 40.259 136.097 110.798 1.00 0.00 O ATOM 2346 H1 WAT 8167 39.736 136.491 111.497 1.00 0.00 H ATOM 2347 H2 WAT 8167 41.164 136.304 111.030 1.00 0.00 H TER 2349 WAT 8167 ATOM 2349 O WAT 8168 58.782 31.944 154.086 1.00 0.00 O ATOM 2350 H1 WAT 8168 58.904 32.878 153.916 1.00 0.00 H ATOM 2351 H2 WAT 8168 57.847 31.853 154.268 1.00 0.00 H TER 2353 WAT 8168 ATOM 2353 O WAT 8169 106.758 30.187 116.861 1.00 0.00 O ATOM 2354 H1 WAT 8169 106.806 31.132 116.719 1.00 0.00 H ATOM 2355 H2 WAT 8169 106.983 29.806 116.012 1.00 0.00 H TER 2357 WAT 8169 ATOM 2357 O WAT 8170 0.320 1.345 150.670 1.00 0.00 O ATOM 2358 H1 WAT 8170 1.121 1.630 150.230 1.00 0.00 H ATOM 2359 H2 WAT 8170 0.592 1.163 151.569 1.00 0.00 H TER 2361 WAT 8170 ATOM 2361 O WAT 8171 132.615 18.813 80.895 1.00 0.00 O ATOM 2362 H1 WAT 8171 132.269 19.284 81.654 1.00 0.00 H ATOM 2363 H2 WAT 8171 131.840 18.585 80.382 1.00 0.00 H TER 2365 WAT 8171 ATOM 2365 O WAT 8172 103.723 2.413 132.322 1.00 0.00 O ATOM 2366 H1 WAT 8172 103.236 1.890 132.959 1.00 0.00 H ATOM 2367 H2 WAT 8172 103.055 2.941 131.885 1.00 0.00 H TER 2369 WAT 8172 ATOM 2369 O WAT 8173 14.322 103.722 147.678 1.00 0.00 O ATOM 2370 H1 WAT 8173 14.717 103.400 148.488 1.00 0.00 H ATOM 2371 H2 WAT 8173 14.913 104.415 147.382 1.00 0.00 H TER 2373 WAT 8173 ATOM 2373 O WAT 8174 108.939 58.293 130.066 1.00 0.00 O ATOM 2374 H1 WAT 8174 108.402 59.062 130.259 1.00 0.00 H ATOM 2375 H2 WAT 8174 109.801 58.650 129.853 1.00 0.00 H TER 2377 WAT 8174 ATOM 2377 O WAT 8175 64.146 104.593 77.043 1.00 0.00 O ATOM 2378 H1 WAT 8175 63.473 104.548 76.364 1.00 0.00 H ATOM 2379 H2 WAT 8175 64.343 105.527 77.123 1.00 0.00 H TER 2381 WAT 8175 ATOM 2381 O WAT 8176 44.424 63.455 114.429 1.00 0.00 O ATOM 2382 H1 WAT 8176 43.932 63.598 115.237 1.00 0.00 H ATOM 2383 H2 WAT 8176 44.617 64.336 114.107 1.00 0.00 H TER 2385 WAT 8176 ATOM 2385 O WAT 8177 67.166 30.130 115.187 1.00 0.00 O ATOM 2386 H1 WAT 8177 67.951 30.458 114.748 1.00 0.00 H ATOM 2387 H2 WAT 8177 66.856 29.421 114.624 1.00 0.00 H TER 2389 WAT 8177 ATOM 2389 O WAT 8178 15.005 109.248 21.730 1.00 0.00 O ATOM 2390 H1 WAT 8178 15.393 108.538 22.240 1.00 0.00 H ATOM 2391 H2 WAT 8178 15.361 109.133 20.849 1.00 0.00 H TER 2393 WAT 8178 ATOM 2393 O WAT 8179 49.218 113.080 7.176 1.00 0.00 O ATOM 2394 H1 WAT 8179 48.444 113.554 6.871 1.00 0.00 H ATOM 2395 H2 WAT 8179 49.128 112.206 6.796 1.00 0.00 H TER 2397 WAT 8179 ATOM 2397 O WAT 8180 99.910 46.739 78.345 1.00 0.00 O ATOM 2398 H1 WAT 8180 99.858 45.845 78.682 1.00 0.00 H ATOM 2399 H2 WAT 8180 99.585 47.284 79.062 1.00 0.00 H TER 2401 WAT 8180 ATOM 2401 O WAT 8181 1.585 54.338 153.438 1.00 0.00 O ATOM 2402 H1 WAT 8181 2.349 54.861 153.681 1.00 0.00 H ATOM 2403 H2 WAT 8181 0.963 54.476 154.153 1.00 0.00 H TER 2405 WAT 8181 ATOM 2405 O WAT 8182 125.694 16.657 157.369 1.00 0.00 O ATOM 2406 H1 WAT 8182 126.329 16.699 156.654 1.00 0.00 H ATOM 2407 H2 WAT 8182 125.038 17.317 157.146 1.00 0.00 H TER 2409 WAT 8182 ATOM 2409 O WAT 8183 59.896 67.971 106.229 1.00 0.00 O ATOM 2410 H1 WAT 8183 60.475 68.008 105.467 1.00 0.00 H ATOM 2411 H2 WAT 8183 60.276 67.292 106.786 1.00 0.00 H TER 2413 WAT 8183 ATOM 2413 O WAT 8184 115.189 7.997 113.291 1.00 0.00 O ATOM 2414 H1 WAT 8184 115.234 7.091 113.597 1.00 0.00 H ATOM 2415 H2 WAT 8184 115.988 8.116 112.777 1.00 0.00 H TER 2417 WAT 8184 ATOM 2417 O WAT 8185 98.995 112.386 144.250 1.00 0.00 O ATOM 2418 H1 WAT 8185 99.382 112.712 143.437 1.00 0.00 H ATOM 2419 H2 WAT 8185 98.476 113.119 144.579 1.00 0.00 H TER 2421 WAT 8185 ATOM 2421 O WAT 8186 140.553 53.924 115.106 1.00 0.00 O ATOM 2422 H1 WAT 8186 140.187 54.808 115.125 1.00 0.00 H ATOM 2423 H2 WAT 8186 141.284 53.981 114.491 1.00 0.00 H TER 2425 WAT 8186 ATOM 2425 O WAT 8187 11.468 15.561 158.488 1.00 0.00 O ATOM 2426 H1 WAT 8187 12.184 16.057 158.884 1.00 0.00 H ATOM 2427 H2 WAT 8187 10.687 15.846 158.963 1.00 0.00 H TER 2429 WAT 8187 ATOM 2429 O WAT 8188 59.223 133.709 137.012 1.00 0.00 O ATOM 2430 H1 WAT 8188 59.336 132.797 137.280 1.00 0.00 H ATOM 2431 H2 WAT 8188 60.099 134.088 137.074 1.00 0.00 H TER 2433 WAT 8188 ATOM 2433 O WAT 8189 66.952 27.431 124.385 1.00 0.00 O ATOM 2434 H1 WAT 8189 67.333 28.085 124.972 1.00 0.00 H ATOM 2435 H2 WAT 8189 66.108 27.215 124.783 1.00 0.00 H TER 2437 WAT 8189 ATOM 2437 O WAT 8190 35.376 71.035 99.346 1.00 0.00 O ATOM 2438 H1 WAT 8190 36.023 71.740 99.319 1.00 0.00 H ATOM 2439 H2 WAT 8190 35.583 70.490 98.587 1.00 0.00 H TER 2441 WAT 8190 ATOM 2441 O WAT 8191 113.911 97.956 152.701 1.00 0.00 O ATOM 2442 H1 WAT 8191 114.205 98.863 152.775 1.00 0.00 H ATOM 2443 H2 WAT 8191 114.718 97.442 152.680 1.00 0.00 H TER 2445 WAT 8191 ATOM 2445 O WAT 8192 18.355 39.207 99.423 1.00 0.00 O ATOM 2446 H1 WAT 8192 17.982 38.399 99.776 1.00 0.00 H ATOM 2447 H2 WAT 8192 19.296 39.040 99.385 1.00 0.00 H TER 2449 WAT 8192 ATOM 2449 O WAT 8193 69.692 83.915 90.807 1.00 0.00 O ATOM 2450 H1 WAT 8193 69.185 84.582 91.269 1.00 0.00 H ATOM 2451 H2 WAT 8193 70.190 83.473 91.495 1.00 0.00 H TER 2453 WAT 8193 ATOM 2453 O WAT 8194 31.067 29.899 23.218 1.00 0.00 O ATOM 2454 H1 WAT 8194 30.459 30.026 23.946 1.00 0.00 H ATOM 2455 H2 WAT 8194 30.938 30.666 22.661 1.00 0.00 H TER 2457 WAT 8194 ATOM 2457 O WAT 8195 14.005 79.772 100.981 1.00 0.00 O ATOM 2458 H1 WAT 8195 14.673 80.246 101.476 1.00 0.00 H ATOM 2459 H2 WAT 8195 13.393 80.449 100.695 1.00 0.00 H TER 2461 WAT 8195 ATOM 2461 O WAT 8196 139.026 2.565 89.132 1.00 0.00 O ATOM 2462 H1 WAT 8196 139.142 3.134 89.893 1.00 0.00 H ATOM 2463 H2 WAT 8196 138.105 2.306 89.165 1.00 0.00 H TER 2465 WAT 8196 ATOM 2465 O WAT 8197 41.220 139.711 149.097 1.00 0.00 O ATOM 2466 H1 WAT 8197 41.528 139.422 148.238 1.00 0.00 H ATOM 2467 H2 WAT 8197 40.266 139.657 149.040 1.00 0.00 H TER 2469 WAT 8197 ATOM 2469 O WAT 8198 69.954 7.039 103.812 1.00 0.00 O ATOM 2470 H1 WAT 8198 69.512 6.505 103.151 1.00 0.00 H ATOM 2471 H2 WAT 8198 69.440 6.908 104.609 1.00 0.00 H TER 2473 WAT 8198 ATOM 2473 O WAT 8199 111.394 115.694 64.351 1.00 0.00 O ATOM 2474 H1 WAT 8199 112.162 115.810 63.791 1.00 0.00 H ATOM 2475 H2 WAT 8199 111.463 114.792 64.666 1.00 0.00 H TER 2477 WAT 8199 ATOM 2477 O WAT 8200 34.761 79.116 4.825 1.00 0.00 O ATOM 2478 H1 WAT 8200 34.344 78.308 5.123 1.00 0.00 H ATOM 2479 H2 WAT 8200 35.411 78.829 4.184 1.00 0.00 H TER 2481 WAT 8200 ATOM 2481 O WAT 8201 93.725 59.701 71.052 1.00 0.00 O ATOM 2482 H1 WAT 8201 92.805 59.810 71.293 1.00 0.00 H ATOM 2483 H2 WAT 8201 93.978 60.546 70.681 1.00 0.00 H TER 2485 WAT 8201 ATOM 2485 O WAT 8202 88.631 1.102 16.542 1.00 0.00 O ATOM 2486 H1 WAT 8202 89.470 0.902 16.126 1.00 0.00 H ATOM 2487 H2 WAT 8202 88.856 1.690 17.263 1.00 0.00 H TER 2489 WAT 8202 ATOM 2489 O WAT 8203 99.061 36.387 82.323 1.00 0.00 O ATOM 2490 H1 WAT 8203 99.925 36.038 82.542 1.00 0.00 H ATOM 2491 H2 WAT 8203 98.903 36.091 81.427 1.00 0.00 H TER 2493 WAT 8203 ATOM 2493 O WAT 8204 122.063 25.896 2.444 1.00 0.00 O ATOM 2494 H1 WAT 8204 122.293 25.712 3.355 1.00 0.00 H ATOM 2495 H2 WAT 8204 122.881 26.191 2.045 1.00 0.00 H TER 2497 WAT 8204 ATOM 2497 O WAT 8205 11.031 10.022 148.064 1.00 0.00 O ATOM 2498 H1 WAT 8205 10.604 10.452 147.323 1.00 0.00 H ATOM 2499 H2 WAT 8205 10.386 9.389 148.378 1.00 0.00 H TER 2501 WAT 8205 ATOM 2501 O WAT 8206 45.837 132.652 16.820 1.00 0.00 O ATOM 2502 H1 WAT 8206 46.656 132.596 17.311 1.00 0.00 H ATOM 2503 H2 WAT 8206 45.186 132.918 17.470 1.00 0.00 H TER 2505 WAT 8206 ATOM 2505 O WAT 8207 72.584 41.422 133.078 1.00 0.00 O ATOM 2506 H1 WAT 8207 73.205 41.737 132.422 1.00 0.00 H ATOM 2507 H2 WAT 8207 72.363 40.535 132.792 1.00 0.00 H TER 2509 WAT 8207 ATOM 2509 O WAT 8208 56.770 28.625 158.900 1.00 0.00 O ATOM 2510 H1 WAT 8208 56.843 27.695 159.114 1.00 0.00 H ATOM 2511 H2 WAT 8208 57.374 28.751 158.169 1.00 0.00 H TER 2513 WAT 8208 ATOM 2513 O WAT 8209 144.061 70.647 139.755 1.00 0.00 O ATOM 2514 H1 WAT 8209 143.581 69.904 139.390 1.00 0.00 H ATOM 2515 H2 WAT 8209 143.409 71.127 140.264 1.00 0.00 H TER 2517 WAT 8209 ATOM 2517 O WAT 8210 7.973 114.648 117.348 1.00 0.00 O ATOM 2518 H1 WAT 8210 8.237 115.567 117.381 1.00 0.00 H ATOM 2519 H2 WAT 8210 7.738 114.433 118.250 1.00 0.00 H TER 2521 WAT 8210 ATOM 2521 O WAT 8211 138.607 48.849 97.288 1.00 0.00 O ATOM 2522 H1 WAT 8211 138.927 48.930 98.186 1.00 0.00 H ATOM 2523 H2 WAT 8211 139.144 48.156 96.904 1.00 0.00 H TER 2525 WAT 8211 ATOM 2525 O WAT 8212 77.065 123.764 153.226 1.00 0.00 O ATOM 2526 H1 WAT 8212 77.019 124.036 152.309 1.00 0.00 H ATOM 2527 H2 WAT 8212 76.974 124.577 153.723 1.00 0.00 H TER 2529 WAT 8212 ATOM 2529 O WAT 8213 83.799 19.338 52.165 1.00 0.00 O ATOM 2530 H1 WAT 8213 82.966 18.910 51.967 1.00 0.00 H ATOM 2531 H2 WAT 8213 84.390 18.620 52.392 1.00 0.00 H TER 2533 WAT 8213 ATOM 2533 O WAT 8214 80.242 9.321 68.286 1.00 0.00 O ATOM 2534 H1 WAT 8214 80.043 8.453 68.638 1.00 0.00 H ATOM 2535 H2 WAT 8214 80.848 9.704 68.921 1.00 0.00 H TER 2537 WAT 8214 ATOM 2537 O WAT 8215 81.306 87.880 93.865 1.00 0.00 O ATOM 2538 H1 WAT 8215 81.170 88.825 93.799 1.00 0.00 H ATOM 2539 H2 WAT 8215 80.611 87.578 94.450 1.00 0.00 H TER 2541 WAT 8215 ATOM 2541 O WAT 8216 13.048 20.943 125.184 1.00 0.00 O ATOM 2542 H1 WAT 8216 13.869 20.627 125.562 1.00 0.00 H ATOM 2543 H2 WAT 8216 12.716 21.573 125.823 1.00 0.00 H TER 2545 WAT 8216 ATOM 2545 O WAT 8217 14.479 122.564 126.584 1.00 0.00 O ATOM 2546 H1 WAT 8217 13.575 122.269 126.698 1.00 0.00 H ATOM 2547 H2 WAT 8217 14.497 122.947 125.707 1.00 0.00 H TER 2549 WAT 8217 ATOM 2549 O WAT 8218 39.612 58.698 146.333 1.00 0.00 O ATOM 2550 H1 WAT 8218 39.280 57.804 146.251 1.00 0.00 H ATOM 2551 H2 WAT 8218 39.820 58.959 145.436 1.00 0.00 H TER 2553 WAT 8218 ATOM 2553 O WAT 8219 68.570 131.362 143.520 1.00 0.00 O ATOM 2554 H1 WAT 8219 68.009 131.839 142.909 1.00 0.00 H ATOM 2555 H2 WAT 8219 67.959 130.890 144.087 1.00 0.00 H TER 2557 WAT 8219 ATOM 2557 O WAT 8220 69.710 75.670 133.433 1.00 0.00 O ATOM 2558 H1 WAT 8220 70.270 75.149 134.009 1.00 0.00 H ATOM 2559 H2 WAT 8220 70.187 75.706 132.603 1.00 0.00 H TER 2561 WAT 8220 ATOM 2561 O WAT 8221 22.065 118.774 92.447 1.00 0.00 O ATOM 2562 H1 WAT 8221 21.226 118.497 92.815 1.00 0.00 H ATOM 2563 H2 WAT 8221 22.358 119.481 93.021 1.00 0.00 H TER 2565 WAT 8221 ATOM 2565 O WAT 8222 83.719 90.220 139.268 1.00 0.00 O ATOM 2566 H1 WAT 8222 84.636 89.987 139.412 1.00 0.00 H ATOM 2567 H2 WAT 8222 83.225 89.492 139.646 1.00 0.00 H TER 2569 WAT 8222 ATOM 2569 O WAT 8223 113.528 111.166 121.452 1.00 0.00 O ATOM 2570 H1 WAT 8223 113.569 110.407 120.871 1.00 0.00 H ATOM 2571 H2 WAT 8223 112.715 111.048 121.942 1.00 0.00 H TER 2573 WAT 8223 ATOM 2573 O WAT 8224 16.717 16.145 129.388 1.00 0.00 O ATOM 2574 H1 WAT 8224 16.180 15.920 130.148 1.00 0.00 H ATOM 2575 H2 WAT 8224 17.010 17.040 129.558 1.00 0.00 H TER 2577 WAT 8224 ATOM 2577 O WAT 8225 65.801 130.861 3.292 1.00 0.00 O ATOM 2578 H1 WAT 8225 65.937 129.995 3.676 1.00 0.00 H ATOM 2579 H2 WAT 8225 64.862 131.022 3.389 1.00 0.00 H TER 2581 WAT 8225 ATOM 2581 O WAT 8226 120.879 21.534 97.998 1.00 0.00 O ATOM 2582 H1 WAT 8226 120.993 20.804 97.390 1.00 0.00 H ATOM 2583 H2 WAT 8226 121.712 21.587 98.467 1.00 0.00 H TER 2585 WAT 8226 ATOM 2585 O WAT 8227 30.090 99.483 101.549 1.00 0.00 O ATOM 2586 H1 WAT 8227 30.346 99.371 102.464 1.00 0.00 H ATOM 2587 H2 WAT 8227 29.237 99.054 101.485 1.00 0.00 H TER 2589 WAT 8227 ATOM 2589 O WAT 8228 96.166 61.710 66.611 1.00 0.00 O ATOM 2590 H1 WAT 8228 96.512 61.113 67.274 1.00 0.00 H ATOM 2591 H2 WAT 8228 96.868 61.782 65.964 1.00 0.00 H TER 2593 WAT 8228 ATOM 2593 O WAT 8229 136.491 60.290 155.553 1.00 0.00 O ATOM 2594 H1 WAT 8229 136.030 60.735 154.842 1.00 0.00 H ATOM 2595 H2 WAT 8229 137.077 59.676 155.111 1.00 0.00 H TER 2597 WAT 8229 ATOM 2597 O WAT 8230 101.857 55.844 133.560 1.00 0.00 O ATOM 2598 H1 WAT 8230 102.102 56.643 134.028 1.00 0.00 H ATOM 2599 H2 WAT 8230 100.963 55.662 133.848 1.00 0.00 H TER 2601 WAT 8230 ATOM 2601 O WAT 8231 38.387 0.533 104.255 1.00 0.00 O ATOM 2602 H1 WAT 8231 37.526 0.355 104.636 1.00 0.00 H ATOM 2603 H2 WAT 8231 38.969 -0.101 104.673 1.00 0.00 H TER 2605 WAT 8231 ATOM 2605 O WAT 8232 68.668 77.158 120.659 1.00 0.00 O ATOM 2606 H1 WAT 8232 68.339 77.806 121.282 1.00 0.00 H ATOM 2607 H2 WAT 8232 67.881 76.740 120.310 1.00 0.00 H TER 2609 WAT 8232 ATOM 2609 O WAT 8233 137.395 102.073 64.369 1.00 0.00 O ATOM 2610 H1 WAT 8233 137.039 102.044 63.481 1.00 0.00 H ATOM 2611 H2 WAT 8233 137.555 103.003 64.532 1.00 0.00 H TER 2613 WAT 8233 ATOM 2613 O WAT 8234 49.223 60.606 2.969 1.00 0.00 O ATOM 2614 H1 WAT 8234 49.459 59.989 3.663 1.00 0.00 H ATOM 2615 H2 WAT 8234 48.873 60.056 2.268 1.00 0.00 H TER 2617 WAT 8234 ATOM 2617 O WAT 8235 56.134 145.720 113.918 1.00 0.00 O ATOM 2618 H1 WAT 8235 56.929 145.187 113.935 1.00 0.00 H ATOM 2619 H2 WAT 8235 56.417 146.562 113.562 1.00 0.00 H TER 2621 WAT 8235 ATOM 2621 O WAT 8236 5.843 77.234 24.007 1.00 0.00 O ATOM 2622 H1 WAT 8236 6.361 76.766 23.352 1.00 0.00 H ATOM 2623 H2 WAT 8236 5.299 77.835 23.497 1.00 0.00 H TER 2625 WAT 8236 ATOM 2625 O WAT 8237 26.383 138.390 118.827 1.00 0.00 O ATOM 2626 H1 WAT 8237 27.154 138.948 118.720 1.00 0.00 H ATOM 2627 H2 WAT 8237 25.715 138.797 118.275 1.00 0.00 H TER 2629 WAT 8237 ATOM 2629 O WAT 8238 129.322 91.831 152.375 1.00 0.00 O ATOM 2630 H1 WAT 8238 128.926 92.351 151.675 1.00 0.00 H ATOM 2631 H2 WAT 8238 128.670 91.158 152.571 1.00 0.00 H TER 2633 WAT 8238 ATOM 2633 O WAT 8239 131.558 47.773 26.235 1.00 0.00 O ATOM 2634 H1 WAT 8239 131.209 48.217 27.008 1.00 0.00 H ATOM 2635 H2 WAT 8239 130.927 47.077 26.053 1.00 0.00 H TER 2637 WAT 8239 ATOM 2637 O WAT 8240 102.848 78.643 103.383 1.00 0.00 O ATOM 2638 H1 WAT 8240 102.333 77.853 103.218 1.00 0.00 H ATOM 2639 H2 WAT 8240 102.634 78.885 104.284 1.00 0.00 H TER 2641 WAT 8240 ATOM 2641 O WAT 8241 131.650 77.058 143.642 1.00 0.00 O ATOM 2642 H1 WAT 8241 132.390 77.570 143.317 1.00 0.00 H ATOM 2643 H2 WAT 8241 132.017 76.193 143.823 1.00 0.00 H TER 2645 WAT 8241 ATOM 2645 O WAT 8242 79.853 122.914 154.214 1.00 0.00 O ATOM 2646 H1 WAT 8242 79.630 122.054 154.570 1.00 0.00 H ATOM 2647 H2 WAT 8242 79.070 123.185 153.735 1.00 0.00 H TER 2649 WAT 8242 ATOM 2649 O WAT 8243 116.546 46.077 141.588 1.00 0.00 O ATOM 2650 H1 WAT 8243 117.267 45.679 141.100 1.00 0.00 H ATOM 2651 H2 WAT 8243 116.963 46.755 142.120 1.00 0.00 H TER 2653 WAT 8243 ATOM 2653 O WAT 8244 127.726 63.801 145.842 1.00 0.00 O ATOM 2654 H1 WAT 8244 127.959 63.481 146.713 1.00 0.00 H ATOM 2655 H2 WAT 8244 128.108 63.161 145.241 1.00 0.00 H TER 2657 WAT 8244 ATOM 2657 O WAT 8245 82.841 133.623 141.328 1.00 0.00 O ATOM 2658 H1 WAT 8245 83.664 134.113 141.334 1.00 0.00 H ATOM 2659 H2 WAT 8245 82.319 134.040 140.643 1.00 0.00 H TER 2661 WAT 8245 ATOM 2661 O WAT 8246 23.614 48.262 111.148 1.00 0.00 O ATOM 2662 H1 WAT 8246 24.180 47.775 110.549 1.00 0.00 H ATOM 2663 H2 WAT 8246 23.252 47.594 111.731 1.00 0.00 H TER 2665 WAT 8246 ATOM 2665 O WAT 8247 118.869 86.070 26.251 1.00 0.00 O ATOM 2666 H1 WAT 8247 118.937 86.459 25.379 1.00 0.00 H ATOM 2667 H2 WAT 8247 119.529 86.529 26.771 1.00 0.00 H TER 2669 WAT 8247 ATOM 2669 O WAT 8248 42.385 6.938 0.830 1.00 0.00 O ATOM 2670 H1 WAT 8248 41.643 6.339 0.909 1.00 0.00 H ATOM 2671 H2 WAT 8248 42.016 7.724 0.426 1.00 0.00 H TER 2673 WAT 8248 ATOM 2673 O WAT 8249 99.925 91.757 135.372 1.00 0.00 O ATOM 2674 H1 WAT 8249 99.395 92.242 134.739 1.00 0.00 H ATOM 2675 H2 WAT 8249 99.370 91.692 136.150 1.00 0.00 H TER 2677 WAT 8249 ATOM 2677 O WAT 8250 89.456 57.792 149.975 1.00 0.00 O ATOM 2678 H1 WAT 8250 89.228 58.721 149.957 1.00 0.00 H ATOM 2679 H2 WAT 8250 89.530 57.545 149.053 1.00 0.00 H TER 2681 WAT 8250 ATOM 2681 O WAT 8251 114.485 4.902 13.240 1.00 0.00 O ATOM 2682 H1 WAT 8251 113.832 5.471 12.832 1.00 0.00 H ATOM 2683 H2 WAT 8251 114.236 4.875 14.163 1.00 0.00 H TER 2685 WAT 8251 ATOM 2685 O WAT 8252 29.167 101.901 64.726 1.00 0.00 O ATOM 2686 H1 WAT 8252 29.114 102.772 65.118 1.00 0.00 H ATOM 2687 H2 WAT 8252 29.580 101.359 65.398 1.00 0.00 H TER 2689 WAT 8252 ATOM 2689 O WAT 8253 95.237 69.332 115.437 1.00 0.00 O ATOM 2690 H1 WAT 8253 94.743 69.719 114.714 1.00 0.00 H ATOM 2691 H2 WAT 8253 95.399 70.063 116.034 1.00 0.00 H TER 2693 WAT 8253 ATOM 2693 O WAT 8254 136.500 81.676 129.814 1.00 0.00 O ATOM 2694 H1 WAT 8254 135.792 82.248 129.518 1.00 0.00 H ATOM 2695 H2 WAT 8254 137.050 82.238 130.360 1.00 0.00 H TER 2697 WAT 8254 ATOM 2697 O WAT 8255 99.751 77.682 105.119 1.00 0.00 O ATOM 2698 H1 WAT 8255 99.290 77.581 105.952 1.00 0.00 H ATOM 2699 H2 WAT 8255 99.486 78.546 104.802 1.00 0.00 H TER 2701 WAT 8255 ATOM 2701 O WAT 8256 59.388 38.328 68.839 1.00 0.00 O ATOM 2702 H1 WAT 8256 60.128 38.614 68.304 1.00 0.00 H ATOM 2703 H2 WAT 8256 58.827 37.843 68.234 1.00 0.00 H TER 2705 WAT 8256 ATOM 2705 O WAT 8257 65.858 130.707 88.384 1.00 0.00 O ATOM 2706 H1 WAT 8257 66.381 130.615 89.180 1.00 0.00 H ATOM 2707 H2 WAT 8257 66.497 130.680 87.672 1.00 0.00 H TER 2709 WAT 8257 ATOM 2709 O WAT 8258 132.784 7.407 140.344 1.00 0.00 O ATOM 2710 H1 WAT 8258 132.730 6.493 140.065 1.00 0.00 H ATOM 2711 H2 WAT 8258 132.344 7.896 139.649 1.00 0.00 H TER 2713 WAT 8258 ATOM 2713 O WAT 8259 74.473 65.234 78.576 1.00 0.00 O ATOM 2714 H1 WAT 8259 74.884 65.396 77.727 1.00 0.00 H ATOM 2715 H2 WAT 8259 73.691 65.786 78.572 1.00 0.00 H TER 2717 WAT 8259 ATOM 2717 O WAT 8260 85.193 113.696 14.801 1.00 0.00 O ATOM 2718 H1 WAT 8260 84.670 114.051 15.520 1.00 0.00 H ATOM 2719 H2 WAT 8260 84.798 114.067 14.012 1.00 0.00 H TER 2721 WAT 8260 ATOM 2721 O WAT 8261 108.687 59.824 66.177 1.00 0.00 O ATOM 2722 H1 WAT 8261 108.360 58.963 65.913 1.00 0.00 H ATOM 2723 H2 WAT 8261 108.674 60.341 65.372 1.00 0.00 H TER 2725 WAT 8261 ATOM 2725 O WAT 8262 61.768 66.908 153.123 1.00 0.00 O ATOM 2726 H1 WAT 8262 62.130 67.793 153.076 1.00 0.00 H ATOM 2727 H2 WAT 8262 62.504 66.336 152.903 1.00 0.00 H TER 2729 WAT 8262 ATOM 2729 O WAT 8263 138.898 91.103 58.431 1.00 0.00 O ATOM 2730 H1 WAT 8263 138.108 90.939 58.945 1.00 0.00 H ATOM 2731 H2 WAT 8263 138.596 91.114 57.523 1.00 0.00 H TER 2733 WAT 8263 ATOM 2733 O WAT 8264 12.422 8.783 17.487 1.00 0.00 O ATOM 2734 H1 WAT 8264 11.808 9.164 18.114 1.00 0.00 H ATOM 2735 H2 WAT 8264 12.104 7.891 17.352 1.00 0.00 H TER 2737 WAT 8264 ATOM 2737 O WAT 8265 18.033 82.616 71.606 1.00 0.00 O ATOM 2738 H1 WAT 8265 18.141 83.352 71.003 1.00 0.00 H ATOM 2739 H2 WAT 8265 17.286 82.861 72.152 1.00 0.00 H TER 2741 WAT 8265 ATOM 2741 O WAT 8266 40.081 1.006 140.095 1.00 0.00 O ATOM 2742 H1 WAT 8266 39.524 0.258 139.879 1.00 0.00 H ATOM 2743 H2 WAT 8266 40.227 0.931 141.038 1.00 0.00 H TER 2745 WAT 8266 ATOM 2745 O WAT 8267 93.683 70.740 17.250 1.00 0.00 O ATOM 2746 H1 WAT 8267 93.577 70.329 18.108 1.00 0.00 H ATOM 2747 H2 WAT 8267 92.790 70.929 16.963 1.00 0.00 H TER 2749 WAT 8267 ATOM 2749 O WAT 8268 102.294 28.027 94.030 1.00 0.00 O ATOM 2750 H1 WAT 8268 102.583 27.126 94.177 1.00 0.00 H ATOM 2751 H2 WAT 8268 101.345 27.960 93.925 1.00 0.00 H TER 2753 WAT 8268 ATOM 2753 O WAT 8269 7.040 103.252 77.214 1.00 0.00 O ATOM 2754 H1 WAT 8269 6.245 102.967 77.664 1.00 0.00 H ATOM 2755 H2 WAT 8269 6.840 104.138 76.912 1.00 0.00 H TER 2757 WAT 8269 ATOM 2757 O WAT 8270 27.910 53.087 94.269 1.00 0.00 O ATOM 2758 H1 WAT 8270 27.506 52.511 94.918 1.00 0.00 H ATOM 2759 H2 WAT 8270 28.767 53.300 94.639 1.00 0.00 H TER 2761 WAT 8270 ATOM 2761 O WAT 8271 6.702 34.939 3.810 1.00 0.00 O ATOM 2762 H1 WAT 8271 6.057 35.535 3.430 1.00 0.00 H ATOM 2763 H2 WAT 8271 7.035 34.440 3.064 1.00 0.00 H TER 2765 WAT 8271 ATOM 2765 O WAT 8272 44.201 66.575 55.328 1.00 0.00 O ATOM 2766 H1 WAT 8272 43.721 66.183 56.058 1.00 0.00 H ATOM 2767 H2 WAT 8272 44.822 67.173 55.744 1.00 0.00 H TER 2769 WAT 8272 ATOM 2769 O WAT 8273 86.533 88.951 143.610 1.00 0.00 O ATOM 2770 H1 WAT 8273 86.128 88.343 142.992 1.00 0.00 H ATOM 2771 H2 WAT 8273 86.343 89.818 143.252 1.00 0.00 H TER 2773 WAT 8273 ATOM 2773 O WAT 8274 89.789 63.027 105.336 1.00 0.00 O ATOM 2774 H1 WAT 8274 90.733 63.166 105.414 1.00 0.00 H ATOM 2775 H2 WAT 8274 89.401 63.858 105.610 1.00 0.00 H TER 2777 WAT 8274 ATOM 2777 O WAT 8275 93.020 42.661 66.075 1.00 0.00 O ATOM 2778 H1 WAT 8275 93.125 42.529 65.133 1.00 0.00 H ATOM 2779 H2 WAT 8275 92.073 42.639 66.215 1.00 0.00 H TER 2781 WAT 8275 ATOM 2781 O WAT 8276 19.841 122.635 78.652 1.00 0.00 O ATOM 2782 H1 WAT 8276 19.493 122.851 77.787 1.00 0.00 H ATOM 2783 H2 WAT 8276 20.759 122.902 78.614 1.00 0.00 H TER 2785 WAT 8276 ATOM 2785 O WAT 8277 126.011 135.391 126.031 1.00 0.00 O ATOM 2786 H1 WAT 8277 126.673 135.558 126.701 1.00 0.00 H ATOM 2787 H2 WAT 8277 126.026 134.441 125.911 1.00 0.00 H TER 2789 WAT 8277 ATOM 2789 O WAT 8278 64.155 144.593 103.183 1.00 0.00 O ATOM 2790 H1 WAT 8278 64.415 143.875 102.606 1.00 0.00 H ATOM 2791 H2 WAT 8278 64.489 145.379 102.751 1.00 0.00 H TER 2793 WAT 8278 ATOM 2793 O WAT 8279 138.567 138.977 82.180 1.00 0.00 O ATOM 2794 H1 WAT 8279 138.747 139.715 81.597 1.00 0.00 H ATOM 2795 H2 WAT 8279 137.678 139.135 82.498 1.00 0.00 H TER 2797 WAT 8279 ATOM 2797 O WAT 8280 30.124 50.079 154.822 1.00 0.00 O ATOM 2798 H1 WAT 8280 30.223 51.024 154.935 1.00 0.00 H ATOM 2799 H2 WAT 8280 29.428 49.987 154.172 1.00 0.00 H TER 2801 WAT 8280 ATOM 2801 O WAT 8281 110.044 82.302 118.566 1.00 0.00 O ATOM 2802 H1 WAT 8281 110.724 82.888 118.899 1.00 0.00 H ATOM 2803 H2 WAT 8281 109.960 82.534 117.641 1.00 0.00 H TER 2805 WAT 8281 ATOM 2805 O WAT 8282 131.120 144.519 10.549 1.00 0.00 O ATOM 2806 H1 WAT 8282 130.856 145.364 10.912 1.00 0.00 H ATOM 2807 H2 WAT 8282 130.776 144.524 9.656 1.00 0.00 H TER 2809 WAT 8282 ATOM 2809 O WAT 8283 49.918 92.269 67.215 1.00 0.00 O ATOM 2810 H1 WAT 8283 50.072 91.407 66.829 1.00 0.00 H ATOM 2811 H2 WAT 8283 48.997 92.254 67.477 1.00 0.00 H TER 2813 WAT 8283 ATOM 2813 O WAT 8284 46.753 6.339 105.669 1.00 0.00 O ATOM 2814 H1 WAT 8284 45.856 6.035 105.811 1.00 0.00 H ATOM 2815 H2 WAT 8284 46.947 6.878 106.436 1.00 0.00 H TER 2817 WAT 8284 ATOM 2817 O WAT 8285 141.604 107.603 114.841 1.00 0.00 O ATOM 2818 H1 WAT 8285 141.277 108.498 114.936 1.00 0.00 H ATOM 2819 H2 WAT 8285 141.017 107.075 115.381 1.00 0.00 H TER 2821 WAT 8285 ATOM 2821 O WAT 8286 139.419 103.729 149.917 1.00 0.00 O ATOM 2822 H1 WAT 8286 139.931 102.944 150.111 1.00 0.00 H ATOM 2823 H2 WAT 8286 139.350 104.183 150.757 1.00 0.00 H TER 2825 WAT 8286 ATOM 2825 O WAT 8287 103.899 49.372 58.045 1.00 0.00 O ATOM 2826 H1 WAT 8287 103.270 50.092 58.080 1.00 0.00 H ATOM 2827 H2 WAT 8287 104.747 49.800 57.924 1.00 0.00 H TER 2829 WAT 8287 ATOM 2829 O WAT 8288 6.471 93.137 68.901 1.00 0.00 O ATOM 2830 H1 WAT 8288 5.786 92.827 68.310 1.00 0.00 H ATOM 2831 H2 WAT 8288 5.998 93.580 69.606 1.00 0.00 H TER 2833 WAT 8288 ATOM 2833 O WAT 8289 100.484 79.660 0.514 1.00 0.00 O ATOM 2834 H1 WAT 8289 99.954 79.453 -0.255 1.00 0.00 H ATOM 2835 H2 WAT 8289 101.124 78.950 0.563 1.00 0.00 H TER 2837 WAT 8289 ATOM 2837 O WAT 8290 58.240 140.178 102.341 1.00 0.00 O ATOM 2838 H1 WAT 8290 57.642 140.817 102.728 1.00 0.00 H ATOM 2839 H2 WAT 8290 58.790 139.893 103.070 1.00 0.00 H TER 2841 WAT 8290 ATOM 2841 O WAT 8291 60.068 13.597 48.977 1.00 0.00 O ATOM 2842 H1 WAT 8291 60.335 12.689 48.836 1.00 0.00 H ATOM 2843 H2 WAT 8291 60.284 13.771 49.893 1.00 0.00 H TER 2845 WAT 8291 ATOM 2845 O WAT 8292 52.825 46.779 155.162 1.00 0.00 O ATOM 2846 H1 WAT 8292 52.355 47.600 155.309 1.00 0.00 H ATOM 2847 H2 WAT 8292 52.787 46.327 156.005 1.00 0.00 H TER 2849 WAT 8292 ATOM 2849 O WAT 8293 135.307 136.323 117.669 1.00 0.00 O ATOM 2850 H1 WAT 8293 134.533 135.821 117.923 1.00 0.00 H ATOM 2851 H2 WAT 8293 136.007 135.981 118.225 1.00 0.00 H TER 2853 WAT 8293 ATOM 2853 O WAT 8294 88.281 7.042 62.075 1.00 0.00 O ATOM 2854 H1 WAT 8294 88.384 6.847 61.144 1.00 0.00 H ATOM 2855 H2 WAT 8294 87.859 7.901 62.095 1.00 0.00 H TER 2857 WAT 8294 ATOM 2857 O WAT 8295 114.898 76.703 6.086 1.00 0.00 O ATOM 2858 H1 WAT 8295 114.325 76.649 6.852 1.00 0.00 H ATOM 2859 H2 WAT 8295 115.577 76.049 6.248 1.00 0.00 H TER 2861 WAT 8295 ATOM 2861 O WAT 8296 111.315 123.439 69.933 1.00 0.00 O ATOM 2862 H1 WAT 8296 111.189 124.206 70.492 1.00 0.00 H ATOM 2863 H2 WAT 8296 112.263 123.382 69.815 1.00 0.00 H TER 2865 WAT 8296 ATOM 2865 O WAT 8297 118.520 53.834 82.150 1.00 0.00 O ATOM 2866 H1 WAT 8297 118.180 53.373 81.383 1.00 0.00 H ATOM 2867 H2 WAT 8297 118.978 53.159 82.651 1.00 0.00 H TER 2869 WAT 8297 ATOM 2869 O WAT 8298 55.742 108.368 19.464 1.00 0.00 O ATOM 2870 H1 WAT 8298 54.892 108.614 19.830 1.00 0.00 H ATOM 2871 H2 WAT 8298 55.630 107.458 19.188 1.00 0.00 H TER 2873 WAT 8298 ATOM 2873 O WAT 8299 20.935 39.361 78.297 1.00 0.00 O ATOM 2874 H1 WAT 8299 20.697 38.447 78.141 1.00 0.00 H ATOM 2875 H2 WAT 8299 21.503 39.590 77.561 1.00 0.00 H TER 2877 WAT 8299 ATOM 2877 O WAT 8300 34.871 100.299 150.792 1.00 0.00 O ATOM 2878 H1 WAT 8300 34.266 101.022 150.956 1.00 0.00 H ATOM 2879 H2 WAT 8300 34.321 99.603 150.434 1.00 0.00 H TER 2881 WAT 8300 ATOM 2881 O WAT 8301 105.499 28.563 77.547 1.00 0.00 O ATOM 2882 H1 WAT 8301 105.650 27.969 76.811 1.00 0.00 H ATOM 2883 H2 WAT 8301 105.657 28.026 78.323 1.00 0.00 H TER 2885 WAT 8301 ATOM 2885 O WAT 8302 53.842 109.547 123.295 1.00 0.00 O ATOM 2886 H1 WAT 8302 53.257 110.287 123.131 1.00 0.00 H ATOM 2887 H2 WAT 8302 53.547 109.189 124.133 1.00 0.00 H TER 2889 WAT 8302 ATOM 2889 O WAT 8303 103.323 127.278 85.118 1.00 0.00 O ATOM 2890 H1 WAT 8303 103.727 127.590 85.927 1.00 0.00 H ATOM 2891 H2 WAT 8303 103.238 128.061 84.574 1.00 0.00 H TER 2893 WAT 8303 ATOM 2893 O WAT 8304 89.120 106.302 94.764 1.00 0.00 O ATOM 2894 H1 WAT 8304 89.385 105.799 95.534 1.00 0.00 H ATOM 2895 H2 WAT 8304 89.330 107.209 94.986 1.00 0.00 H TER 2897 WAT 8304 ATOM 2897 O WAT 8305 88.086 130.265 5.934 1.00 0.00 O ATOM 2898 H1 WAT 8305 88.756 130.932 5.780 1.00 0.00 H ATOM 2899 H2 WAT 8305 87.526 130.305 5.159 1.00 0.00 H TER 2901 WAT 8305 ATOM 2901 O WAT 8306 86.551 4.679 106.835 1.00 0.00 O ATOM 2902 H1 WAT 8306 87.091 5.433 107.072 1.00 0.00 H ATOM 2903 H2 WAT 8306 85.654 4.960 107.017 1.00 0.00 H TER 2905 WAT 8306 ATOM 2905 O WAT 8307 129.089 1.389 129.456 1.00 0.00 O ATOM 2906 H1 WAT 8307 129.791 0.788 129.208 1.00 0.00 H ATOM 2907 H2 WAT 8307 129.541 2.188 129.726 1.00 0.00 H TER 2909 WAT 8307 ATOM 2909 O WAT 8308 104.828 132.846 76.203 1.00 0.00 O ATOM 2910 H1 WAT 8308 104.980 132.003 76.629 1.00 0.00 H ATOM 2911 H2 WAT 8308 103.878 132.962 76.235 1.00 0.00 H TER 2913 WAT 8308 ATOM 2913 O WAT 8309 41.290 132.058 66.360 1.00 0.00 O ATOM 2914 H1 WAT 8309 40.772 131.349 66.741 1.00 0.00 H ATOM 2915 H2 WAT 8309 41.215 131.928 65.415 1.00 0.00 H TER 2917 WAT 8309 ATOM 2917 O WAT 8310 8.849 139.794 9.814 1.00 0.00 O ATOM 2918 H1 WAT 8310 8.156 139.217 9.493 1.00 0.00 H ATOM 2919 H2 WAT 8310 9.036 140.377 9.078 1.00 0.00 H TER 2921 WAT 8310 ATOM 2921 O WAT 8311 37.236 7.482 61.652 1.00 0.00 O ATOM 2922 H1 WAT 8311 37.781 8.082 61.143 1.00 0.00 H ATOM 2923 H2 WAT 8311 36.539 7.221 61.050 1.00 0.00 H TER 2925 WAT 8311 ATOM 2925 O WAT 8312 90.631 32.092 12.839 1.00 0.00 O ATOM 2926 H1 WAT 8312 89.989 32.148 12.131 1.00 0.00 H ATOM 2927 H2 WAT 8312 90.104 32.011 13.634 1.00 0.00 H TER 2929 WAT 8312 ATOM 2929 O WAT 8313 30.862 95.811 151.726 1.00 0.00 O ATOM 2930 H1 WAT 8313 30.787 95.291 152.525 1.00 0.00 H ATOM 2931 H2 WAT 8313 31.744 96.180 151.761 1.00 0.00 H TER 2933 WAT 8313 ATOM 2933 O WAT 8314 88.170 94.607 11.368 1.00 0.00 O ATOM 2934 H1 WAT 8314 88.986 95.097 11.264 1.00 0.00 H ATOM 2935 H2 WAT 8314 87.490 95.206 11.059 1.00 0.00 H TER 2937 WAT 8314 ATOM 2937 O WAT 8315 4.612 12.772 132.057 1.00 0.00 O ATOM 2938 H1 WAT 8315 3.970 12.445 131.428 1.00 0.00 H ATOM 2939 H2 WAT 8315 4.263 13.617 132.340 1.00 0.00 H TER 2941 WAT 8315 ATOM 2941 O WAT 8316 70.270 95.931 103.221 1.00 0.00 O ATOM 2942 H1 WAT 8316 70.392 95.791 104.160 1.00 0.00 H ATOM 2943 H2 WAT 8316 69.348 95.727 103.066 1.00 0.00 H TER 2945 WAT 8316 ATOM 2945 O WAT 8317 133.775 108.504 143.820 1.00 0.00 O ATOM 2946 H1 WAT 8317 133.938 109.115 144.538 1.00 0.00 H ATOM 2947 H2 WAT 8317 134.117 107.667 144.136 1.00 0.00 H TER 2949 WAT 8317 ATOM 2949 O WAT 8318 49.960 39.178 2.218 1.00 0.00 O ATOM 2950 H1 WAT 8318 49.738 39.706 2.985 1.00 0.00 H ATOM 2951 H2 WAT 8318 49.788 39.753 1.473 1.00 0.00 H TER 2953 WAT 8318 ATOM 2953 O WAT 8319 142.670 63.728 150.141 1.00 0.00 O ATOM 2954 H1 WAT 8319 143.187 63.697 149.336 1.00 0.00 H ATOM 2955 H2 WAT 8319 142.159 64.534 150.067 1.00 0.00 H TER 2957 WAT 8319 ATOM 2957 O WAT 8320 41.250 111.633 78.287 1.00 0.00 O ATOM 2958 H1 WAT 8320 41.719 112.383 78.653 1.00 0.00 H ATOM 2959 H2 WAT 8320 40.627 112.017 77.672 1.00 0.00 H TER 2961 WAT 8320 ATOM 2961 O WAT 8321 52.966 0.665 150.506 1.00 0.00 O ATOM 2962 H1 WAT 8321 53.451 1.399 150.127 1.00 0.00 H ATOM 2963 H2 WAT 8321 52.226 0.536 149.912 1.00 0.00 H TER 2965 WAT 8321 ATOM 2965 O WAT 8322 87.175 132.617 153.651 1.00 0.00 O ATOM 2966 H1 WAT 8322 86.952 133.542 153.549 1.00 0.00 H ATOM 2967 H2 WAT 8322 88.132 132.604 153.685 1.00 0.00 H TER 2969 WAT 8322 ATOM 2969 O WAT 8323 23.569 130.734 152.611 1.00 0.00 O ATOM 2970 H1 WAT 8323 22.779 130.579 152.093 1.00 0.00 H ATOM 2971 H2 WAT 8323 24.076 131.359 152.094 1.00 0.00 H TER 2973 WAT 8323 ATOM 2973 O WAT 8324 129.124 121.507 73.919 1.00 0.00 O ATOM 2974 H1 WAT 8324 130.079 121.457 73.958 1.00 0.00 H ATOM 2975 H2 WAT 8324 128.940 122.419 73.694 1.00 0.00 H TER 2977 WAT 8324 ATOM 2977 O WAT 8325 112.299 130.401 115.152 1.00 0.00 O ATOM 2978 H1 WAT 8325 111.509 129.892 114.972 1.00 0.00 H ATOM 2979 H2 WAT 8325 112.551 130.146 116.040 1.00 0.00 H TER 2981 WAT 8325 ATOM 2981 O WAT 8326 12.963 126.490 21.681 1.00 0.00 O ATOM 2982 H1 WAT 8326 12.318 126.661 22.367 1.00 0.00 H ATOM 2983 H2 WAT 8326 12.615 126.936 20.909 1.00 0.00 H TER 2985 WAT 8326 ATOM 2985 O WAT 8327 40.326 94.641 2.621 1.00 0.00 O ATOM 2986 H1 WAT 8327 40.945 95.120 3.172 1.00 0.00 H ATOM 2987 H2 WAT 8327 40.867 94.249 1.936 1.00 0.00 H TER 2989 WAT 8327 ATOM 2989 O WAT 8328 9.107 139.619 19.516 1.00 0.00 O ATOM 2990 H1 WAT 8328 9.792 139.260 20.081 1.00 0.00 H ATOM 2991 H2 WAT 8328 8.305 139.184 19.805 1.00 0.00 H TER 2993 WAT 8328 ATOM 2993 O WAT 8329 58.315 51.174 9.721 1.00 0.00 O ATOM 2994 H1 WAT 8329 58.973 51.722 10.148 1.00 0.00 H ATOM 2995 H2 WAT 8329 57.527 51.288 10.252 1.00 0.00 H TER 2997 WAT 8329 ATOM 2997 O WAT 8330 95.710 131.206 129.281 1.00 0.00 O ATOM 2998 H1 WAT 8330 95.708 131.621 128.418 1.00 0.00 H ATOM 2999 H2 WAT 8330 94.841 131.391 129.636 1.00 0.00 H TER 3001 WAT 8330 ATOM 3001 O WAT 8331 13.366 28.128 100.642 1.00 0.00 O ATOM 3002 H1 WAT 8331 13.549 28.903 100.110 1.00 0.00 H ATOM 3003 H2 WAT 8331 12.985 28.476 101.448 1.00 0.00 H TER 3005 WAT 8331 ATOM 3005 O WAT 8332 100.440 37.982 78.284 1.00 0.00 O ATOM 3006 H1 WAT 8332 99.706 38.196 77.709 1.00 0.00 H ATOM 3007 H2 WAT 8332 100.288 37.072 78.539 1.00 0.00 H TER 3009 WAT 8332 ATOM 3009 O WAT 8333 4.994 22.973 117.563 1.00 0.00 O ATOM 3010 H1 WAT 8333 4.625 23.756 117.156 1.00 0.00 H ATOM 3011 H2 WAT 8333 5.457 23.300 118.335 1.00 0.00 H TER 3013 WAT 8333 ATOM 3013 O WAT 8334 44.029 43.177 97.947 1.00 0.00 O ATOM 3014 H1 WAT 8334 44.052 43.694 97.142 1.00 0.00 H ATOM 3015 H2 WAT 8334 44.052 43.827 98.649 1.00 0.00 H TER 3017 WAT 8334 ATOM 3017 O WAT 8335 26.935 96.579 16.054 1.00 0.00 O ATOM 3018 H1 WAT 8335 26.105 97.000 16.277 1.00 0.00 H ATOM 3019 H2 WAT 8335 26.735 95.643 16.049 1.00 0.00 H TER 3021 WAT 8335 ATOM 3021 O WAT 8336 5.654 59.815 92.587 1.00 0.00 O ATOM 3022 H1 WAT 8336 6.240 59.606 93.314 1.00 0.00 H ATOM 3023 H2 WAT 8336 4.919 59.210 92.689 1.00 0.00 H TER 3025 WAT 8336 ATOM 3025 O WAT 8337 142.830 48.009 128.478 1.00 0.00 O ATOM 3026 H1 WAT 8337 142.967 47.280 127.873 1.00 0.00 H ATOM 3027 H2 WAT 8337 142.675 47.592 129.325 1.00 0.00 H TER 3029 WAT 8337 ATOM 3029 O WAT 8338 32.444 22.392 106.584 1.00 0.00 O ATOM 3030 H1 WAT 8338 33.142 22.915 106.978 1.00 0.00 H ATOM 3031 H2 WAT 8338 31.946 23.016 106.057 1.00 0.00 H TER 3033 WAT 8338 ATOM 3033 O WAT 8339 9.843 43.080 115.777 1.00 0.00 O ATOM 3034 H1 WAT 8339 9.734 43.086 114.826 1.00 0.00 H ATOM 3035 H2 WAT 8339 9.212 42.430 116.086 1.00 0.00 H TER 3037 WAT 8339 ATOM 3037 O WAT 8340 90.577 11.224 127.323 1.00 0.00 O ATOM 3038 H1 WAT 8340 91.470 11.219 127.668 1.00 0.00 H ATOM 3039 H2 WAT 8340 90.633 10.730 126.506 1.00 0.00 H TER 3041 WAT 8340 ATOM 3041 O WAT 8341 65.762 76.822 93.909 1.00 0.00 O ATOM 3042 H1 WAT 8341 65.183 77.215 93.255 1.00 0.00 H ATOM 3043 H2 WAT 8341 65.348 77.025 94.748 1.00 0.00 H TER 3045 WAT 8341 ATOM 3045 O WAT 8342 87.084 132.445 148.868 1.00 0.00 O ATOM 3046 H1 WAT 8342 86.361 132.666 148.280 1.00 0.00 H ATOM 3047 H2 WAT 8342 86.664 132.283 149.713 1.00 0.00 H TER 3049 WAT 8342 ATOM 3049 O WAT 8343 73.443 18.444 153.602 1.00 0.00 O ATOM 3050 H1 WAT 8343 74.048 17.808 153.983 1.00 0.00 H ATOM 3051 H2 WAT 8343 72.676 17.927 153.354 1.00 0.00 H TER 3053 WAT 8343 ATOM 3053 O WAT 8344 16.823 50.471 109.705 1.00 0.00 O ATOM 3054 H1 WAT 8344 16.053 50.659 110.241 1.00 0.00 H ATOM 3055 H2 WAT 8344 17.502 50.234 110.336 1.00 0.00 H TER 3057 WAT 8344 ATOM 3057 O WAT 8345 65.510 88.224 12.386 1.00 0.00 O ATOM 3058 H1 WAT 8345 66.373 88.629 12.304 1.00 0.00 H ATOM 3059 H2 WAT 8345 64.972 88.890 12.812 1.00 0.00 H TER 3061 WAT 8345 ATOM 3061 O WAT 8346 88.210 38.602 139.054 1.00 0.00 O ATOM 3062 H1 WAT 8346 87.900 37.698 138.995 1.00 0.00 H ATOM 3063 H2 WAT 8346 87.760 38.959 139.820 1.00 0.00 H TER 3065 WAT 8346 ATOM 3065 O WAT 8347 141.693 104.129 120.930 1.00 0.00 O ATOM 3066 H1 WAT 8347 141.595 103.187 121.062 1.00 0.00 H ATOM 3067 H2 WAT 8347 140.796 104.457 120.864 1.00 0.00 H TER 3069 WAT 8347 ATOM 3069 O WAT 8348 79.768 42.785 69.695 1.00 0.00 O ATOM 3070 H1 WAT 8348 80.525 42.562 70.238 1.00 0.00 H ATOM 3071 H2 WAT 8348 79.136 43.159 70.309 1.00 0.00 H TER 3073 WAT 8348 ATOM 3073 O WAT 8349 44.020 66.580 130.838 1.00 0.00 O ATOM 3074 H1 WAT 8349 43.617 65.959 131.444 1.00 0.00 H ATOM 3075 H2 WAT 8349 44.020 66.127 129.995 1.00 0.00 H TER 3077 WAT 8349 ATOM 3077 O WAT 8350 11.653 108.603 110.853 1.00 0.00 O ATOM 3078 H1 WAT 8350 12.114 108.013 111.450 1.00 0.00 H ATOM 3079 H2 WAT 8350 11.263 108.024 110.198 1.00 0.00 H TER 3081 WAT 8350 ATOM 3081 O WAT 8351 101.947 15.868 139.120 1.00 0.00 O ATOM 3082 H1 WAT 8351 101.608 15.913 140.014 1.00 0.00 H ATOM 3083 H2 WAT 8351 101.283 15.378 138.636 1.00 0.00 H TER 3085 WAT 8351 ATOM 3085 O WAT 8352 129.284 115.982 86.451 1.00 0.00 O ATOM 3086 H1 WAT 8352 129.755 115.231 86.088 1.00 0.00 H ATOM 3087 H2 WAT 8352 128.643 115.597 87.048 1.00 0.00 H TER 3089 WAT 8352 ATOM 3089 O WAT 8353 82.414 40.758 15.365 1.00 0.00 O ATOM 3090 H1 WAT 8353 82.274 39.992 15.921 1.00 0.00 H ATOM 3091 H2 WAT 8353 83.043 40.463 14.706 1.00 0.00 H TER 3093 WAT 8353 ATOM 3093 O WAT 8354 25.125 87.600 130.337 1.00 0.00 O ATOM 3094 H1 WAT 8354 24.684 88.221 129.757 1.00 0.00 H ATOM 3095 H2 WAT 8354 26.057 87.783 130.220 1.00 0.00 H TER 3097 WAT 8354 ATOM 3097 O WAT 8355 34.598 52.314 9.699 1.00 0.00 O ATOM 3098 H1 WAT 8355 34.295 51.976 10.541 1.00 0.00 H ATOM 3099 H2 WAT 8355 35.494 52.608 9.867 1.00 0.00 H TER 3101 WAT 8355 ATOM 3101 O WAT 8356 140.782 28.450 143.125 1.00 0.00 O ATOM 3102 H1 WAT 8356 140.549 28.603 142.209 1.00 0.00 H ATOM 3103 H2 WAT 8356 140.635 29.293 143.554 1.00 0.00 H TER 3105 WAT 8356 ATOM 3105 O WAT 8357 51.361 15.907 69.926 1.00 0.00 O ATOM 3106 H1 WAT 8357 50.447 16.188 69.883 1.00 0.00 H ATOM 3107 H2 WAT 8357 51.615 16.055 70.837 1.00 0.00 H TER 3109 WAT 8357 ATOM 3109 O WAT 8358 91.559 132.642 67.324 1.00 0.00 O ATOM 3110 H1 WAT 8358 91.501 133.191 66.542 1.00 0.00 H ATOM 3111 H2 WAT 8358 92.089 131.893 67.052 1.00 0.00 H TER 3113 WAT 8358 ATOM 3113 O WAT 8359 88.602 14.952 83.637 1.00 0.00 O ATOM 3114 H1 WAT 8359 87.754 15.394 83.579 1.00 0.00 H ATOM 3115 H2 WAT 8359 89.175 15.589 84.064 1.00 0.00 H TER 3117 WAT 8359 ATOM 3117 O WAT 8360 104.097 135.804 16.163 1.00 0.00 O ATOM 3118 H1 WAT 8360 104.338 135.627 17.072 1.00 0.00 H ATOM 3119 H2 WAT 8360 103.297 135.297 16.024 1.00 0.00 H TER 3121 WAT 8360 ATOM 3121 O WAT 8361 133.418 40.158 12.680 1.00 0.00 O ATOM 3122 H1 WAT 8361 134.325 40.445 12.786 1.00 0.00 H ATOM 3123 H2 WAT 8361 133.433 39.599 11.903 1.00 0.00 H TER 3125 WAT 8361 ATOM 3125 O WAT 8362 95.077 136.811 116.215 1.00 0.00 O ATOM 3126 H1 WAT 8362 95.632 136.032 116.218 1.00 0.00 H ATOM 3127 H2 WAT 8362 94.515 136.709 116.983 1.00 0.00 H TER 3129 WAT 8362 ATOM 3129 O WAT 8363 97.262 119.740 82.473 1.00 0.00 O ATOM 3130 H1 WAT 8363 97.578 119.529 83.352 1.00 0.00 H ATOM 3131 H2 WAT 8363 96.829 118.940 82.176 1.00 0.00 H TER 3133 WAT 8363 ATOM 3133 O WAT 8364 45.068 36.566 15.379 1.00 0.00 O ATOM 3134 H1 WAT 8364 45.703 36.246 14.738 1.00 0.00 H ATOM 3135 H2 WAT 8364 44.323 35.971 15.296 1.00 0.00 H TER 3137 WAT 8364 ATOM 3137 O WAT 8365 3.013 79.303 25.539 1.00 0.00 O ATOM 3138 H1 WAT 8365 3.046 78.370 25.749 1.00 0.00 H ATOM 3139 H2 WAT 8365 2.869 79.733 26.382 1.00 0.00 H TER 3141 WAT 8365 ATOM 3141 O WAT 8366 73.815 128.024 8.892 1.00 0.00 O ATOM 3142 H1 WAT 8366 73.363 128.864 8.813 1.00 0.00 H ATOM 3143 H2 WAT 8366 73.119 127.394 9.079 1.00 0.00 H TER 3145 WAT 8366 ATOM 3145 O WAT 8367 89.517 3.011 131.767 1.00 0.00 O ATOM 3146 H1 WAT 8367 90.039 3.727 131.404 1.00 0.00 H ATOM 3147 H2 WAT 8367 89.949 2.217 131.452 1.00 0.00 H TER 3149 WAT 8367 ATOM 3149 O WAT 8368 80.709 67.743 15.426 1.00 0.00 O ATOM 3150 H1 WAT 8368 80.913 67.222 16.203 1.00 0.00 H ATOM 3151 H2 WAT 8368 81.458 68.331 15.329 1.00 0.00 H TER 3153 WAT 8368 ATOM 3153 O WAT 8369 36.382 69.890 157.067 1.00 0.00 O ATOM 3154 H1 WAT 8369 35.593 69.993 157.598 1.00 0.00 H ATOM 3155 H2 WAT 8369 36.299 70.554 156.383 1.00 0.00 H TER 3157 WAT 8369 ATOM 3157 O WAT 8370 59.857 31.266 126.329 1.00 0.00 O ATOM 3158 H1 WAT 8370 60.751 31.606 126.340 1.00 0.00 H ATOM 3159 H2 WAT 8370 59.306 32.034 126.482 1.00 0.00 H TER 3161 WAT 8370 ATOM 3161 O WAT 8371 66.450 144.280 99.454 1.00 0.00 O ATOM 3162 H1 WAT 8371 65.884 143.981 98.743 1.00 0.00 H ATOM 3163 H2 WAT 8371 67.214 143.705 99.410 1.00 0.00 H TER 3165 WAT 8371 ATOM 3165 O WAT 8372 82.835 13.546 64.033 1.00 0.00 O ATOM 3166 H1 WAT 8372 82.744 12.962 63.280 1.00 0.00 H ATOM 3167 H2 WAT 8372 82.148 14.202 63.912 1.00 0.00 H TER 3169 WAT 8372 ATOM 3169 O WAT 8373 45.795 104.443 63.610 1.00 0.00 O ATOM 3170 H1 WAT 8373 46.090 105.185 64.138 1.00 0.00 H ATOM 3171 H2 WAT 8373 45.267 104.837 62.916 1.00 0.00 H TER 3173 WAT 8373 ATOM 3173 O WAT 8374 7.694 143.951 84.020 1.00 0.00 O ATOM 3174 H1 WAT 8374 7.375 144.234 83.164 1.00 0.00 H ATOM 3175 H2 WAT 8374 8.648 143.948 83.932 1.00 0.00 H TER 3177 WAT 8374 ATOM 3177 O WAT 8375 23.087 71.657 108.659 1.00 0.00 O ATOM 3178 H1 WAT 8375 23.848 71.376 109.167 1.00 0.00 H ATOM 3179 H2 WAT 8375 22.432 70.975 108.811 1.00 0.00 H TER 3181 WAT 8375 ATOM 3181 O WAT 8376 7.091 138.257 8.528 1.00 0.00 O ATOM 3182 H1 WAT 8376 7.190 137.445 9.025 1.00 0.00 H ATOM 3183 H2 WAT 8376 6.144 138.373 8.446 1.00 0.00 H TER 3185 WAT 8376 ATOM 3185 O WAT 8377 74.343 42.670 106.847 1.00 0.00 O ATOM 3186 H1 WAT 8377 73.925 43.511 106.661 1.00 0.00 H ATOM 3187 H2 WAT 8377 75.138 42.899 107.329 1.00 0.00 H TER 3189 WAT 8377 ATOM 3189 O WAT 8378 77.855 98.199 101.219 1.00 0.00 O ATOM 3190 H1 WAT 8378 78.320 98.852 101.742 1.00 0.00 H ATOM 3191 H2 WAT 8378 78.136 98.368 100.319 1.00 0.00 H TER 3193 WAT 8378 ATOM 3193 O WAT 8379 27.187 13.878 152.064 1.00 0.00 O ATOM 3194 H1 WAT 8379 27.305 14.735 152.472 1.00 0.00 H ATOM 3195 H2 WAT 8379 26.241 13.733 152.080 1.00 0.00 H TER 3197 WAT 8379 ATOM 3197 O WAT 8380 5.067 69.649 17.164 1.00 0.00 O ATOM 3198 H1 WAT 8380 5.280 68.757 17.438 1.00 0.00 H ATOM 3199 H2 WAT 8380 4.728 69.551 16.274 1.00 0.00 H TER 3201 WAT 8380 ATOM 3201 O WAT 8381 125.826 11.294 151.335 1.00 0.00 O ATOM 3202 H1 WAT 8381 124.951 10.987 151.098 1.00 0.00 H ATOM 3203 H2 WAT 8381 126.185 11.645 150.521 1.00 0.00 H TER 3205 WAT 8381 ATOM 3205 O WAT 8382 79.496 79.745 152.116 1.00 0.00 O ATOM 3206 H1 WAT 8382 79.256 78.900 152.497 1.00 0.00 H ATOM 3207 H2 WAT 8382 78.803 79.926 151.481 1.00 0.00 H TER 3209 WAT 8382 ATOM 3209 O WAT 8383 42.181 43.488 110.354 1.00 0.00 O ATOM 3210 H1 WAT 8383 41.654 44.062 109.798 1.00 0.00 H ATOM 3211 H2 WAT 8383 41.729 43.488 111.197 1.00 0.00 H TER 3213 WAT 8383 ATOM 3213 O WAT 8384 117.966 145.526 83.776 1.00 0.00 O ATOM 3214 H1 WAT 8384 117.844 146.434 84.052 1.00 0.00 H ATOM 3215 H2 WAT 8384 118.845 145.299 84.080 1.00 0.00 H TER 3217 WAT 8384 ATOM 3217 O WAT 8385 126.711 40.086 67.090 1.00 0.00 O ATOM 3218 H1 WAT 8385 127.448 40.167 67.695 1.00 0.00 H ATOM 3219 H2 WAT 8385 126.850 39.246 66.654 1.00 0.00 H TER 3221 WAT 8385 ATOM 3221 O WAT 8386 41.672 93.726 97.707 1.00 0.00 O ATOM 3222 H1 WAT 8386 42.044 93.462 96.865 1.00 0.00 H ATOM 3223 H2 WAT 8386 41.697 92.931 98.239 1.00 0.00 H TER 3225 WAT 8386 ATOM 3225 O WAT 8387 140.294 110.619 26.406 1.00 0.00 O ATOM 3226 H1 WAT 8387 139.673 111.249 26.040 1.00 0.00 H ATOM 3227 H2 WAT 8387 141.050 110.661 25.821 1.00 0.00 H TER 3229 WAT 8387 ATOM 3229 O WAT 8388 41.367 31.038 130.127 1.00 0.00 O ATOM 3230 H1 WAT 8388 42.048 30.371 130.215 1.00 0.00 H ATOM 3231 H2 WAT 8388 40.909 31.024 130.968 1.00 0.00 H TER 3233 WAT 8388 ATOM 3233 O WAT 8389 139.050 79.969 154.373 1.00 0.00 O ATOM 3234 H1 WAT 8389 139.257 79.046 154.519 1.00 0.00 H ATOM 3235 H2 WAT 8389 138.113 80.037 154.557 1.00 0.00 H TER 3237 WAT 8389 ATOM 3237 O WAT 8390 87.310 10.209 77.728 1.00 0.00 O ATOM 3238 H1 WAT 8390 88.004 10.657 78.211 1.00 0.00 H ATOM 3239 H2 WAT 8390 87.592 9.295 77.697 1.00 0.00 H TER 3241 WAT 8390 ATOM 3241 O WAT 8391 128.563 140.689 148.387 1.00 0.00 O ATOM 3242 H1 WAT 8391 129.012 140.699 149.232 1.00 0.00 H ATOM 3243 H2 WAT 8391 128.502 139.761 148.159 1.00 0.00 H TER 3245 WAT 8391 ATOM 3245 O WAT 8392 144.529 71.442 55.298 1.00 0.00 O ATOM 3246 H1 WAT 8392 145.261 72.051 55.206 1.00 0.00 H ATOM 3247 H2 WAT 8392 144.097 71.707 56.111 1.00 0.00 H TER 3249 WAT 8392 ATOM 3249 O WAT 8393 33.628 112.766 83.964 1.00 0.00 O ATOM 3250 H1 WAT 8393 34.468 112.428 84.276 1.00 0.00 H ATOM 3251 H2 WAT 8393 33.786 112.990 83.047 1.00 0.00 H TER 3253 WAT 8393 ATOM 3253 O WAT 8394 113.917 86.083 100.086 1.00 0.00 O ATOM 3254 H1 WAT 8394 113.083 86.532 100.225 1.00 0.00 H ATOM 3255 H2 WAT 8394 114.255 85.927 100.967 1.00 0.00 H TER 3257 WAT 8394 ATOM 3257 O WAT 8395 131.291 11.500 70.329 1.00 0.00 O ATOM 3258 H1 WAT 8395 131.869 12.258 70.243 1.00 0.00 H ATOM 3259 H2 WAT 8395 130.488 11.758 69.876 1.00 0.00 H TER 3261 WAT 8395 ATOM 3261 O WAT 8396 81.454 111.306 100.070 1.00 0.00 O ATOM 3262 H1 WAT 8396 81.449 111.193 101.021 1.00 0.00 H ATOM 3263 H2 WAT 8396 82.178 110.758 99.768 1.00 0.00 H TER 3265 WAT 8396 ATOM 3265 O WAT 8397 137.160 123.963 158.380 1.00 0.00 O ATOM 3266 H1 WAT 8397 137.552 124.831 158.476 1.00 0.00 H ATOM 3267 H2 WAT 8397 136.748 123.980 157.516 1.00 0.00 H TER 3269 WAT 8397 ATOM 3269 O WAT 8398 65.197 56.565 65.715 1.00 0.00 O ATOM 3270 H1 WAT 8398 66.037 56.137 65.877 1.00 0.00 H ATOM 3271 H2 WAT 8398 65.171 56.692 64.767 1.00 0.00 H TER 3273 WAT 8398 ATOM 3273 O WAT 8399 107.466 78.617 107.327 1.00 0.00 O ATOM 3274 H1 WAT 8399 106.763 78.622 107.977 1.00 0.00 H ATOM 3275 H2 WAT 8399 107.623 79.541 107.136 1.00 0.00 H TER 3277 WAT 8399 ATOM 3277 O WAT 8400 134.326 75.666 98.873 1.00 0.00 O ATOM 3278 H1 WAT 8400 135.051 75.508 99.479 1.00 0.00 H ATOM 3279 H2 WAT 8400 134.556 76.485 98.434 1.00 0.00 H TER 3281 WAT 8400 ATOM 3281 O WAT 8401 47.696 36.903 97.944 1.00 0.00 O ATOM 3282 H1 WAT 8401 47.314 37.776 97.860 1.00 0.00 H ATOM 3283 H2 WAT 8401 47.052 36.407 98.449 1.00 0.00 H TER 3285 WAT 8401 ATOM 3285 O WAT 8402 8.547 57.154 77.378 1.00 0.00 O ATOM 3286 H1 WAT 8402 7.743 57.043 77.885 1.00 0.00 H ATOM 3287 H2 WAT 8402 9.024 56.333 77.502 1.00 0.00 H TER 3289 WAT 8402 ATOM 3289 O WAT 8403 30.540 138.355 76.774 1.00 0.00 O ATOM 3290 H1 WAT 8403 30.639 137.507 77.208 1.00 0.00 H ATOM 3291 H2 WAT 8403 30.296 138.136 75.874 1.00 0.00 H TER 3293 WAT 8403 ATOM 3293 O WAT 8404 109.476 91.522 95.465 1.00 0.00 O ATOM 3294 H1 WAT 8404 109.828 91.254 94.616 1.00 0.00 H ATOM 3295 H2 WAT 8404 109.631 92.466 95.501 1.00 0.00 H TER 3297 WAT 8404 ATOM 3297 O WAT 8405 114.013 82.763 156.100 1.00 0.00 O ATOM 3298 H1 WAT 8405 113.854 82.992 155.184 1.00 0.00 H ATOM 3299 H2 WAT 8405 114.583 83.459 156.426 1.00 0.00 H TER 3301 WAT 8405 ATOM 3301 O WAT 8406 34.071 102.824 155.730 1.00 0.00 O ATOM 3302 H1 WAT 8406 34.986 102.642 155.943 1.00 0.00 H ATOM 3303 H2 WAT 8406 33.614 102.765 156.569 1.00 0.00 H TER 3305 WAT 8406 ATOM 3305 O WAT 8407 65.088 92.656 13.059 1.00 0.00 O ATOM 3306 H1 WAT 8407 65.931 92.808 13.485 1.00 0.00 H ATOM 3307 H2 WAT 8407 64.442 92.999 13.676 1.00 0.00 H TER 3309 WAT 8407 ATOM 3309 O WAT 8408 93.646 0.394 128.413 1.00 0.00 O ATOM 3310 H1 WAT 8408 94.254 0.459 127.677 1.00 0.00 H ATOM 3311 H2 WAT 8408 93.248 -0.471 128.319 1.00 0.00 H TER 3313 WAT 8408 ATOM 3313 O WAT 8409 69.894 48.535 95.247 1.00 0.00 O ATOM 3314 H1 WAT 8409 70.796 48.218 95.204 1.00 0.00 H ATOM 3315 H2 WAT 8409 69.932 49.418 94.879 1.00 0.00 H TER 3317 WAT 8409 ATOM 3317 O WAT 8410 38.421 112.749 54.620 1.00 0.00 O ATOM 3318 H1 WAT 8410 37.902 113.524 54.404 1.00 0.00 H ATOM 3319 H2 WAT 8410 39.318 113.075 54.695 1.00 0.00 H TER 3321 WAT 8410 ATOM 3321 O WAT 8411 129.008 54.593 8.659 1.00 0.00 O ATOM 3322 H1 WAT 8411 128.126 54.641 9.028 1.00 0.00 H ATOM 3323 H2 WAT 8411 129.170 53.656 8.548 1.00 0.00 H TER 3325 WAT 8411 ATOM 3325 O WAT 8412 8.853 44.123 152.748 1.00 0.00 O ATOM 3326 H1 WAT 8412 8.123 43.610 152.403 1.00 0.00 H ATOM 3327 H2 WAT 8412 9.512 43.471 152.987 1.00 0.00 H TER 3329 WAT 8412 ATOM 3329 O WAT 8413 36.928 65.088 102.966 1.00 0.00 O ATOM 3330 H1 WAT 8413 37.010 64.159 103.179 1.00 0.00 H ATOM 3331 H2 WAT 8413 36.020 65.188 102.678 1.00 0.00 H TER 3333 WAT 8413 ATOM 3333 O WAT 8414 115.679 12.616 105.224 1.00 0.00 O ATOM 3334 H1 WAT 8414 116.438 13.143 104.974 1.00 0.00 H ATOM 3335 H2 WAT 8414 115.040 13.254 105.543 1.00 0.00 H TER 3337 WAT 8414 ATOM 3337 O WAT 8415 132.679 97.068 121.503 1.00 0.00 O ATOM 3338 H1 WAT 8415 132.711 96.133 121.303 1.00 0.00 H ATOM 3339 H2 WAT 8415 131.794 97.336 121.254 1.00 0.00 H TER 3341 WAT 8415 ATOM 3341 O WAT 8416 142.590 9.874 156.412 1.00 0.00 O ATOM 3342 H1 WAT 8416 141.981 9.819 155.676 1.00 0.00 H ATOM 3343 H2 WAT 8416 142.069 9.623 157.174 1.00 0.00 H TER 3345 WAT 8416 ATOM 3345 O WAT 8417 140.834 9.554 6.224 1.00 0.00 O ATOM 3346 H1 WAT 8417 141.630 9.778 5.743 1.00 0.00 H ATOM 3347 H2 WAT 8417 141.131 8.967 6.920 1.00 0.00 H TER 3349 WAT 8417 ATOM 3349 O WAT 8418 70.858 30.212 104.085 1.00 0.00 O ATOM 3350 H1 WAT 8418 70.558 29.827 104.908 1.00 0.00 H ATOM 3351 H2 WAT 8418 70.284 30.966 103.950 1.00 0.00 H TER 3353 WAT 8418 ATOM 3353 O WAT 8419 7.411 0.962 23.811 1.00 0.00 O ATOM 3354 H1 WAT 8419 7.185 0.094 24.147 1.00 0.00 H ATOM 3355 H2 WAT 8419 8.368 0.972 23.797 1.00 0.00 H TER 3357 WAT 8419 ATOM 3357 O WAT 8420 17.910 92.159 96.976 1.00 0.00 O ATOM 3358 H1 WAT 8420 17.586 91.271 97.127 1.00 0.00 H ATOM 3359 H2 WAT 8420 17.425 92.464 96.209 1.00 0.00 H TER 3361 WAT 8420 ATOM 3361 O WAT 8421 144.800 92.593 111.047 1.00 0.00 O ATOM 3362 H1 WAT 8421 144.557 93.484 110.794 1.00 0.00 H ATOM 3363 H2 WAT 8421 145.613 92.423 110.573 1.00 0.00 H TER 3365 WAT 8421 ATOM 3365 O WAT 8422 61.241 12.733 90.072 1.00 0.00 O ATOM 3366 H1 WAT 8422 61.853 12.780 90.806 1.00 0.00 H ATOM 3367 H2 WAT 8422 61.455 11.909 89.635 1.00 0.00 H TER 3369 WAT 8422 ATOM 3369 O WAT 8423 23.391 32.500 94.956 1.00 0.00 O ATOM 3370 H1 WAT 8423 24.007 31.770 95.022 1.00 0.00 H ATOM 3371 H2 WAT 8423 23.630 32.942 94.141 1.00 0.00 H TER 3373 WAT 8423 ATOM 3373 O WAT 8424 95.499 30.937 19.286 1.00 0.00 O ATOM 3374 H1 WAT 8424 95.719 31.664 19.868 1.00 0.00 H ATOM 3375 H2 WAT 8424 96.211 30.917 18.647 1.00 0.00 H TER 3377 WAT 8424 ATOM 3377 O WAT 8425 19.757 73.514 127.842 1.00 0.00 O ATOM 3378 H1 WAT 8425 20.514 73.962 127.463 1.00 0.00 H ATOM 3379 H2 WAT 8425 19.041 73.697 127.234 1.00 0.00 H TER 3381 WAT 8425 ATOM 3381 O WAT 8426 133.683 67.959 111.031 1.00 0.00 O ATOM 3382 H1 WAT 8426 133.862 67.930 111.971 1.00 0.00 H ATOM 3383 H2 WAT 8426 133.707 68.890 110.811 1.00 0.00 H TER 3385 WAT 8426 ATOM 3385 O WAT 8427 73.006 36.298 119.210 1.00 0.00 O ATOM 3386 H1 WAT 8427 73.095 35.350 119.315 1.00 0.00 H ATOM 3387 H2 WAT 8427 72.131 36.416 118.841 1.00 0.00 H TER 3389 WAT 8427 ATOM 3389 O WAT 8428 88.310 68.287 144.364 1.00 0.00 O ATOM 3390 H1 WAT 8428 88.889 67.767 143.808 1.00 0.00 H ATOM 3391 H2 WAT 8428 87.511 68.391 143.848 1.00 0.00 H TER 3393 WAT 8428 ATOM 3393 O WAT 8429 31.197 36.795 147.553 1.00 0.00 O ATOM 3394 H1 WAT 8429 30.504 36.577 148.176 1.00 0.00 H ATOM 3395 H2 WAT 8429 31.842 37.275 148.072 1.00 0.00 H TER 3397 WAT 8429 ATOM 3397 O WAT 8430 52.172 37.494 99.608 1.00 0.00 O ATOM 3398 H1 WAT 8430 51.611 37.216 98.884 1.00 0.00 H ATOM 3399 H2 WAT 8430 53.031 37.129 99.399 1.00 0.00 H TER 3401 WAT 8430 ATOM 3401 O WAT 8431 98.598 93.706 123.393 1.00 0.00 O ATOM 3402 H1 WAT 8431 98.324 92.811 123.193 1.00 0.00 H ATOM 3403 H2 WAT 8431 99.473 93.610 123.770 1.00 0.00 H TER 3405 WAT 8431 ATOM 3405 O WAT 8432 87.092 100.321 113.595 1.00 0.00 O ATOM 3406 H1 WAT 8432 86.442 100.393 112.896 1.00 0.00 H ATOM 3407 H2 WAT 8432 87.223 101.222 113.893 1.00 0.00 H TER 3409 WAT 8432 ATOM 3409 O WAT 8433 118.985 7.603 145.681 1.00 0.00 O ATOM 3410 H1 WAT 8433 119.414 8.364 146.072 1.00 0.00 H ATOM 3411 H2 WAT 8433 118.995 6.942 146.373 1.00 0.00 H TER 3413 WAT 8433 ATOM 3413 O WAT 8434 132.086 32.916 107.429 1.00 0.00 O ATOM 3414 H1 WAT 8434 132.160 32.231 106.765 1.00 0.00 H ATOM 3415 H2 WAT 8434 131.381 32.618 108.003 1.00 0.00 H TER 3417 WAT 8434 ATOM 3417 O WAT 8435 111.514 22.344 118.011 1.00 0.00 O ATOM 3418 H1 WAT 8435 112.280 21.816 117.785 1.00 0.00 H ATOM 3419 H2 WAT 8435 110.856 21.706 118.285 1.00 0.00 H TER 3421 WAT 8435 ATOM 3421 O WAT 8436 12.815 134.482 140.893 1.00 0.00 O ATOM 3422 H1 WAT 8436 12.584 134.827 141.756 1.00 0.00 H ATOM 3423 H2 WAT 8436 13.568 133.915 141.056 1.00 0.00 H TER 3425 WAT 8436 ATOM 3425 O WAT 8437 69.452 30.791 113.906 1.00 0.00 O ATOM 3426 H1 WAT 8437 69.987 31.507 114.249 1.00 0.00 H ATOM 3427 H2 WAT 8437 69.397 30.962 112.966 1.00 0.00 H TER 3429 WAT 8437 ATOM 3429 O WAT 8438 19.721 119.728 131.658 1.00 0.00 O ATOM 3430 H1 WAT 8438 19.345 118.928 131.290 1.00 0.00 H ATOM 3431 H2 WAT 8438 19.255 120.437 131.216 1.00 0.00 H TER 3433 WAT 8438 ATOM 3433 O WAT 8439 127.830 32.055 132.292 1.00 0.00 O ATOM 3434 H1 WAT 8439 128.047 31.125 132.350 1.00 0.00 H ATOM 3435 H2 WAT 8439 128.586 32.503 132.672 1.00 0.00 H TER 3437 WAT 8439 ATOM 3437 O WAT 8440 51.534 42.310 79.828 1.00 0.00 O ATOM 3438 H1 WAT 8440 51.339 42.513 78.914 1.00 0.00 H ATOM 3439 H2 WAT 8440 52.460 42.531 79.931 1.00 0.00 H TER 3441 WAT 8440 ATOM 3441 O WAT 8441 44.879 72.823 126.349 1.00 0.00 O ATOM 3442 H1 WAT 8441 45.651 72.485 125.895 1.00 0.00 H ATOM 3443 H2 WAT 8441 44.882 72.371 127.193 1.00 0.00 H TER 3445 WAT 8441 ATOM 3445 O WAT 8442 35.454 84.915 84.419 1.00 0.00 O ATOM 3446 H1 WAT 8442 35.382 84.006 84.712 1.00 0.00 H ATOM 3447 H2 WAT 8442 34.738 85.368 84.865 1.00 0.00 H TER 3449 WAT 8442 ATOM 3449 O WAT 8443 84.145 100.014 143.338 1.00 0.00 O ATOM 3450 H1 WAT 8443 83.959 99.459 142.580 1.00 0.00 H ATOM 3451 H2 WAT 8443 83.553 100.759 143.240 1.00 0.00 H TER 3453 WAT 8443 ATOM 3453 O WAT 8444 22.521 12.653 156.370 1.00 0.00 O ATOM 3454 H1 WAT 8444 22.679 11.746 156.630 1.00 0.00 H ATOM 3455 H2 WAT 8444 23.231 12.855 155.761 1.00 0.00 H TER 3457 WAT 8444 ATOM 3457 O WAT 8445 36.768 123.807 140.806 1.00 0.00 O ATOM 3458 H1 WAT 8445 37.095 123.261 140.091 1.00 0.00 H ATOM 3459 H2 WAT 8445 35.988 124.229 140.448 1.00 0.00 H TER 3461 WAT 8445 ATOM 3461 O WAT 8446 62.083 53.763 141.321 1.00 0.00 O ATOM 3462 H1 WAT 8446 61.324 54.333 141.447 1.00 0.00 H ATOM 3463 H2 WAT 8446 61.867 52.966 141.805 1.00 0.00 H TER 3465 WAT 8446 ATOM 3465 O WAT 8447 138.200 112.414 84.230 1.00 0.00 O ATOM 3466 H1 WAT 8447 138.749 112.800 83.549 1.00 0.00 H ATOM 3467 H2 WAT 8447 137.320 112.739 84.042 1.00 0.00 H TER 3469 WAT 8447 ATOM 3469 O WAT 8448 29.211 45.085 121.824 1.00 0.00 O ATOM 3470 H1 WAT 8448 29.939 45.668 122.040 1.00 0.00 H ATOM 3471 H2 WAT 8448 28.769 45.515 121.091 1.00 0.00 H TER 3473 WAT 8448 ATOM 3473 O WAT 8449 109.313 108.575 138.144 1.00 0.00 O ATOM 3474 H1 WAT 8449 109.706 109.426 137.951 1.00 0.00 H ATOM 3475 H2 WAT 8449 109.120 108.606 139.081 1.00 0.00 H TER 3477 WAT 8449 ATOM 3477 O WAT 8450 119.181 110.621 142.638 1.00 0.00 O ATOM 3478 H1 WAT 8450 119.052 111.553 142.463 1.00 0.00 H ATOM 3479 H2 WAT 8450 120.096 110.553 142.910 1.00 0.00 H TER 3481 WAT 8450 ATOM 3481 O WAT 8451 24.760 60.762 72.167 1.00 0.00 O ATOM 3482 H1 WAT 8451 24.177 61.472 72.437 1.00 0.00 H ATOM 3483 H2 WAT 8451 24.504 60.020 72.715 1.00 0.00 H TER 3485 WAT 8451 ATOM 3485 O WAT 8452 14.957 122.295 98.248 1.00 0.00 O ATOM 3486 H1 WAT 8452 14.091 121.892 98.318 1.00 0.00 H ATOM 3487 H2 WAT 8452 15.024 122.562 97.331 1.00 0.00 H TER 3489 WAT 8452 ATOM 3489 O WAT 8453 125.493 42.480 11.887 1.00 0.00 O ATOM 3490 H1 WAT 8453 125.595 43.383 12.188 1.00 0.00 H ATOM 3491 H2 WAT 8453 124.552 42.313 11.944 1.00 0.00 H TER 3493 WAT 8453 ATOM 3493 O WAT 8454 33.809 92.924 1.478 1.00 0.00 O ATOM 3494 H1 WAT 8454 34.676 92.998 1.079 1.00 0.00 H ATOM 3495 H2 WAT 8454 33.404 92.180 1.033 1.00 0.00 H TER 3497 WAT 8454 ATOM 3497 O WAT 8455 63.771 10.432 78.072 1.00 0.00 O ATOM 3498 H1 WAT 8455 64.199 11.285 78.148 1.00 0.00 H ATOM 3499 H2 WAT 8455 63.695 10.121 78.974 1.00 0.00 H TER 3501 WAT 8455 ATOM 3501 O WAT 8456 6.454 1.728 61.377 1.00 0.00 O ATOM 3502 H1 WAT 8456 5.529 1.780 61.136 1.00 0.00 H ATOM 3503 H2 WAT 8456 6.615 0.794 61.509 1.00 0.00 H TER 3505 WAT 8456 ATOM 3505 O WAT 8457 41.411 67.116 130.463 1.00 0.00 O ATOM 3506 H1 WAT 8457 42.363 67.019 130.437 1.00 0.00 H ATOM 3507 H2 WAT 8457 41.154 66.725 131.299 1.00 0.00 H TER 3509 WAT 8457 ATOM 3509 O WAT 8458 66.186 122.155 126.283 1.00 0.00 O ATOM 3510 H1 WAT 8458 66.918 121.990 125.689 1.00 0.00 H ATOM 3511 H2 WAT 8458 65.750 122.925 125.918 1.00 0.00 H TER 3513 WAT 8458 ATOM 3513 O WAT 8459 42.510 110.881 88.945 1.00 0.00 O ATOM 3514 H1 WAT 8459 42.342 111.257 89.809 1.00 0.00 H ATOM 3515 H2 WAT 8459 42.336 109.946 89.052 1.00 0.00 H TER 3517 WAT 8459 ATOM 3517 O WAT 8460 72.704 39.529 69.859 1.00 0.00 O ATOM 3518 H1 WAT 8460 72.438 40.441 69.978 1.00 0.00 H ATOM 3519 H2 WAT 8460 72.178 39.041 70.492 1.00 0.00 H TER 3521 WAT 8460 ATOM 3521 O WAT 8461 100.601 99.929 5.422 1.00 0.00 O ATOM 3522 H1 WAT 8461 100.672 98.974 5.398 1.00 0.00 H ATOM 3523 H2 WAT 8461 101.506 100.237 5.395 1.00 0.00 H TER 3525 WAT 8461 ATOM 3525 O WAT 8462 79.093 48.858 112.590 1.00 0.00 O ATOM 3526 H1 WAT 8462 78.317 48.667 112.064 1.00 0.00 H ATOM 3527 H2 WAT 8462 79.013 49.786 112.808 1.00 0.00 H TER 3529 WAT 8462 ATOM 3529 O WAT 8463 91.714 27.940 81.315 1.00 0.00 O ATOM 3530 H1 WAT 8463 92.340 28.375 81.894 1.00 0.00 H ATOM 3531 H2 WAT 8463 91.444 28.620 80.698 1.00 0.00 H TER 3533 WAT 8463 ATOM 3533 O WAT 8464 143.960 134.233 124.867 1.00 0.00 O ATOM 3534 H1 WAT 8464 144.637 133.890 124.284 1.00 0.00 H ATOM 3535 H2 WAT 8464 144.165 133.854 125.722 1.00 0.00 H TER 3537 WAT 8464 ATOM 3537 O WAT 8465 11.426 22.544 127.329 1.00 0.00 O ATOM 3538 H1 WAT 8465 11.339 22.494 128.281 1.00 0.00 H ATOM 3539 H2 WAT 8465 10.695 23.097 127.051 1.00 0.00 H TER 3541 WAT 8465 ATOM 3541 O WAT 8466 25.127 17.698 72.649 1.00 0.00 O ATOM 3542 H1 WAT 8466 25.411 18.303 71.964 1.00 0.00 H ATOM 3543 H2 WAT 8466 24.858 18.265 73.372 1.00 0.00 H TER 3545 WAT 8466 ATOM 3545 O WAT 8467 20.926 79.964 10.598 1.00 0.00 O ATOM 3546 H1 WAT 8467 20.606 79.717 11.466 1.00 0.00 H ATOM 3547 H2 WAT 8467 21.638 80.580 10.771 1.00 0.00 H TER 3549 WAT 8467 ATOM 3549 O WAT 8468 37.421 0.316 15.147 1.00 0.00 O ATOM 3550 H1 WAT 8468 36.924 -0.254 15.733 1.00 0.00 H ATOM 3551 H2 WAT 8468 38.330 0.037 15.254 1.00 0.00 H TER 3553 WAT 8468 ATOM 3553 O WAT 8469 70.518 125.324 90.055 1.00 0.00 O ATOM 3554 H1 WAT 8469 70.279 125.373 90.981 1.00 0.00 H ATOM 3555 H2 WAT 8469 71.419 125.001 90.058 1.00 0.00 H TER 3557 WAT 8469 ATOM 3557 O WAT 8470 8.826 113.746 104.898 1.00 0.00 O ATOM 3558 H1 WAT 8470 9.501 113.843 105.569 1.00 0.00 H ATOM 3559 H2 WAT 8470 8.718 114.627 104.538 1.00 0.00 H TER 3561 WAT 8470 ATOM 3561 O WAT 8471 26.763 12.417 3.786 1.00 0.00 O ATOM 3562 H1 WAT 8471 26.077 11.917 4.228 1.00 0.00 H ATOM 3563 H2 WAT 8471 26.470 12.473 2.877 1.00 0.00 H TER 3565 WAT 8471 ATOM 3565 O WAT 8472 59.853 121.265 60.910 1.00 0.00 O ATOM 3566 H1 WAT 8472 60.773 121.432 60.708 1.00 0.00 H ATOM 3567 H2 WAT 8472 59.863 120.456 61.422 1.00 0.00 H TER 3569 WAT 8472 ATOM 3569 O WAT 8473 118.524 139.892 80.675 1.00 0.00 O ATOM 3570 H1 WAT 8473 119.403 139.577 80.466 1.00 0.00 H ATOM 3571 H2 WAT 8473 117.956 139.458 80.038 1.00 0.00 H TER 3573 WAT 8473 ATOM 3573 O WAT 8474 99.535 136.240 88.959 1.00 0.00 O ATOM 3574 H1 WAT 8474 98.646 135.886 88.971 1.00 0.00 H ATOM 3575 H2 WAT 8474 99.507 136.936 88.303 1.00 0.00 H TER 3577 WAT 8474 ATOM 3577 O WAT 8475 114.254 130.891 136.668 1.00 0.00 O ATOM 3578 H1 WAT 8475 114.948 131.212 137.245 1.00 0.00 H ATOM 3579 H2 WAT 8475 113.454 130.972 137.187 1.00 0.00 H TER 3581 WAT 8475 ATOM 3581 O WAT 8476 22.872 84.472 11.956 1.00 0.00 O ATOM 3582 H1 WAT 8476 22.855 83.539 11.745 1.00 0.00 H ATOM 3583 H2 WAT 8476 22.296 84.875 11.305 1.00 0.00 H TER 3585 WAT 8476 ATOM 3585 O WAT 8477 65.014 43.395 83.997 1.00 0.00 O ATOM 3586 H1 WAT 8477 64.775 43.912 83.227 1.00 0.00 H ATOM 3587 H2 WAT 8477 65.811 42.933 83.738 1.00 0.00 H TER 3589 WAT 8477 ATOM 3589 O WAT 8478 92.588 77.700 8.839 1.00 0.00 O ATOM 3590 H1 WAT 8478 92.115 77.609 9.667 1.00 0.00 H ATOM 3591 H2 WAT 8478 92.000 77.321 8.185 1.00 0.00 H TER 3593 WAT 8478 ATOM 3593 O WAT 8479 112.989 33.902 99.031 1.00 0.00 O ATOM 3594 H1 WAT 8479 113.378 34.747 98.807 1.00 0.00 H ATOM 3595 H2 WAT 8479 113.682 33.265 98.855 1.00 0.00 H TER 3597 WAT 8479 ATOM 3597 O WAT 8480 15.895 39.942 149.138 1.00 0.00 O ATOM 3598 H1 WAT 8480 15.725 39.294 148.454 1.00 0.00 H ATOM 3599 H2 WAT 8480 15.030 40.151 149.490 1.00 0.00 H TER 3601 WAT 8480 ATOM 3601 O WAT 8481 73.146 27.043 122.191 1.00 0.00 O ATOM 3602 H1 WAT 8481 72.943 26.234 121.720 1.00 0.00 H ATOM 3603 H2 WAT 8481 73.507 27.625 121.523 1.00 0.00 H TER 3605 WAT 8481 ATOM 3605 O WAT 8482 68.955 51.782 91.268 1.00 0.00 O ATOM 3606 H1 WAT 8482 69.852 51.452 91.226 1.00 0.00 H ATOM 3607 H2 WAT 8482 68.503 51.173 91.852 1.00 0.00 H TER 3609 WAT 8482 ATOM 3609 O WAT 8483 84.389 38.318 114.440 1.00 0.00 O ATOM 3610 H1 WAT 8483 85.007 38.263 115.169 1.00 0.00 H ATOM 3611 H2 WAT 8483 84.170 39.248 114.381 1.00 0.00 H TER 3613 WAT 8483 ATOM 3613 O WAT 8484 22.342 143.565 -0.098 1.00 0.00 O ATOM 3614 H1 WAT 8484 23.038 143.099 -0.563 1.00 0.00 H ATOM 3615 H2 WAT 8484 22.721 143.770 0.756 1.00 0.00 H TER 3617 WAT 8484 ATOM 3617 O WAT 8485 21.798 16.169 80.788 1.00 0.00 O ATOM 3618 H1 WAT 8485 22.511 16.724 80.472 1.00 0.00 H ATOM 3619 H2 WAT 8485 21.324 15.914 79.997 1.00 0.00 H TER 3621 WAT 8485 ATOM 3621 O WAT 8486 79.901 95.077 114.945 1.00 0.00 O ATOM 3622 H1 WAT 8486 80.283 94.263 115.272 1.00 0.00 H ATOM 3623 H2 WAT 8486 79.306 95.360 115.639 1.00 0.00 H TER 3625 WAT 8486 ATOM 3625 O WAT 8487 69.955 31.874 155.799 1.00 0.00 O ATOM 3626 H1 WAT 8487 69.504 31.973 156.637 1.00 0.00 H ATOM 3627 H2 WAT 8487 70.881 31.806 156.033 1.00 0.00 H TER 3629 WAT 8487 ATOM 3629 O WAT 8488 32.368 26.177 137.011 1.00 0.00 O ATOM 3630 H1 WAT 8488 31.896 25.584 136.427 1.00 0.00 H ATOM 3631 H2 WAT 8488 32.463 25.685 137.826 1.00 0.00 H TER 3633 WAT 8488 ATOM 3633 O WAT 8489 97.360 83.196 13.662 1.00 0.00 O ATOM 3634 H1 WAT 8489 96.599 82.833 13.210 1.00 0.00 H ATOM 3635 H2 WAT 8489 97.087 83.261 14.577 1.00 0.00 H TER 3637 WAT 8489 ATOM 3637 O WAT 8490 133.950 70.932 69.486 1.00 0.00 O ATOM 3638 H1 WAT 8490 134.621 71.253 68.884 1.00 0.00 H ATOM 3639 H2 WAT 8490 134.234 70.046 69.711 1.00 0.00 H TER 3641 WAT 8490 ATOM 3641 O WAT 8491 74.440 68.565 157.408 1.00 0.00 O ATOM 3642 H1 WAT 8491 73.949 67.744 157.416 1.00 0.00 H ATOM 3643 H2 WAT 8491 74.473 68.815 156.484 1.00 0.00 H TER 3645 WAT 8491 ATOM 3645 O WAT 8492 88.231 38.661 147.799 1.00 0.00 O ATOM 3646 H1 WAT 8492 89.012 38.999 148.236 1.00 0.00 H ATOM 3647 H2 WAT 8492 88.437 38.713 146.866 1.00 0.00 H TER 3649 WAT 8492 ATOM 3649 O WAT 8493 44.786 80.289 2.537 1.00 0.00 O ATOM 3650 H1 WAT 8493 45.471 80.892 2.827 1.00 0.00 H ATOM 3651 H2 WAT 8493 44.410 80.709 1.763 1.00 0.00 H TER 3653 WAT 8493 ATOM 3653 O WAT 8494 0.273 71.576 91.129 1.00 0.00 O ATOM 3654 H1 WAT 8494 0.522 71.317 92.016 1.00 0.00 H ATOM 3655 H2 WAT 8494 0.137 70.748 90.667 1.00 0.00 H TER 3657 WAT 8494 ATOM 3657 O WAT 8495 62.341 137.248 111.863 1.00 0.00 O ATOM 3658 H1 WAT 8495 62.017 136.607 112.496 1.00 0.00 H ATOM 3659 H2 WAT 8495 63.263 137.365 112.091 1.00 0.00 H TER 3661 WAT 8495 ATOM 3661 O WAT 8496 91.328 9.607 85.554 1.00 0.00 O ATOM 3662 H1 WAT 8496 91.714 9.209 86.334 1.00 0.00 H ATOM 3663 H2 WAT 8496 91.985 10.236 85.256 1.00 0.00 H TER 3665 WAT 8496 ATOM 3665 O WAT 8497 17.254 9.145 137.984 1.00 0.00 O ATOM 3666 H1 WAT 8497 16.315 9.020 137.840 1.00 0.00 H ATOM 3667 H2 WAT 8497 17.335 9.279 138.928 1.00 0.00 H TER 3669 WAT 8497 ATOM 3669 O WAT 8498 17.078 103.611 11.770 1.00 0.00 O ATOM 3670 H1 WAT 8498 17.706 104.058 12.336 1.00 0.00 H ATOM 3671 H2 WAT 8498 16.268 104.112 11.867 1.00 0.00 H TER 3673 WAT 8498 ATOM 3673 O WAT 8499 122.231 6.420 154.285 1.00 0.00 O ATOM 3674 H1 WAT 8499 122.945 5.899 153.917 1.00 0.00 H ATOM 3675 H2 WAT 8499 122.191 6.156 155.204 1.00 0.00 H TER 3677 WAT 8499 ATOM 3677 O WAT 8500 132.492 13.088 8.390 1.00 0.00 O ATOM 3678 H1 WAT 8500 133.085 12.380 8.643 1.00 0.00 H ATOM 3679 H2 WAT 8500 131.618 12.701 8.449 1.00 0.00 H TER 3681 WAT 8500 ATOM 3681 O WAT 8501 78.656 47.810 9.275 1.00 0.00 O ATOM 3682 H1 WAT 8501 79.292 48.486 9.042 1.00 0.00 H ATOM 3683 H2 WAT 8501 78.635 47.821 10.232 1.00 0.00 H TER 3685 WAT 8501 ATOM 3685 O WAT 8502 16.173 28.141 106.235 1.00 0.00 O ATOM 3686 H1 WAT 8502 15.330 28.407 106.604 1.00 0.00 H ATOM 3687 H2 WAT 8502 16.438 28.880 105.688 1.00 0.00 H TER 3689 WAT 8502 ATOM 3689 O WAT 8503 46.120 84.708 95.000 1.00 0.00 O ATOM 3690 H1 WAT 8503 45.627 83.934 94.727 1.00 0.00 H ATOM 3691 H2 WAT 8503 45.656 85.028 95.773 1.00 0.00 H TER 3693 WAT 8503 ATOM 3693 O WAT 8504 31.246 143.154 138.587 1.00 0.00 O ATOM 3694 H1 WAT 8504 31.047 143.994 139.000 1.00 0.00 H ATOM 3695 H2 WAT 8504 31.132 142.510 139.286 1.00 0.00 H TER 3697 WAT 8504 ATOM 3697 O WAT 8505 120.450 82.930 126.836 1.00 0.00 O ATOM 3698 H1 WAT 8505 120.262 82.086 127.248 1.00 0.00 H ATOM 3699 H2 WAT 8505 121.331 82.829 126.476 1.00 0.00 H TER 3701 WAT 8505 ATOM 3701 O WAT 8506 11.190 125.589 66.537 1.00 0.00 O ATOM 3702 H1 WAT 8506 12.096 125.670 66.237 1.00 0.00 H ATOM 3703 H2 WAT 8506 10.881 126.492 66.612 1.00 0.00 H TER 3705 WAT 8506 ATOM 3705 O WAT 8507 83.360 8.109 22.890 1.00 0.00 O ATOM 3706 H1 WAT 8507 84.282 8.279 23.084 1.00 0.00 H ATOM 3707 H2 WAT 8507 83.362 7.268 22.435 1.00 0.00 H TER 3709 WAT 8507 ATOM 3709 O WAT 8508 88.522 8.618 123.533 1.00 0.00 O ATOM 3710 H1 WAT 8508 88.573 8.105 122.727 1.00 0.00 H ATOM 3711 H2 WAT 8508 88.584 7.969 124.234 1.00 0.00 H TER 3713 WAT 8508 ATOM 3713 O WAT 8509 125.697 123.415 18.264 1.00 0.00 O ATOM 3714 H1 WAT 8509 126.491 123.368 18.796 1.00 0.00 H ATOM 3715 H2 WAT 8509 125.541 122.512 17.986 1.00 0.00 H TER 3717 WAT 8509 ATOM 3717 O WAT 8510 108.503 140.081 129.371 1.00 0.00 O ATOM 3718 H1 WAT 8510 109.321 139.868 129.822 1.00 0.00 H ATOM 3719 H2 WAT 8510 108.743 140.774 128.755 1.00 0.00 H TER 3721 WAT 8510 ATOM 3721 O WAT 8511 73.020 3.920 83.836 1.00 0.00 O ATOM 3722 H1 WAT 8511 73.581 4.656 83.592 1.00 0.00 H ATOM 3723 H2 WAT 8511 73.616 3.172 83.888 1.00 0.00 H TER 3725 WAT 8511 ATOM 3725 O WAT 8512 82.811 48.752 78.352 1.00 0.00 O ATOM 3726 H1 WAT 8512 82.152 49.436 78.475 1.00 0.00 H ATOM 3727 H2 WAT 8512 82.429 47.976 78.762 1.00 0.00 H TER 3729 WAT 8512 ATOM 3729 O WAT 8513 134.108 96.243 126.192 1.00 0.00 O ATOM 3730 H1 WAT 8513 134.306 95.397 125.789 1.00 0.00 H ATOM 3731 H2 WAT 8513 133.525 96.675 125.568 1.00 0.00 H TER 3733 WAT 8513 ATOM 3733 O WAT 8514 58.280 82.772 71.814 1.00 0.00 O ATOM 3734 H1 WAT 8514 57.676 83.222 71.223 1.00 0.00 H ATOM 3735 H2 WAT 8514 59.086 83.287 71.770 1.00 0.00 H TER 3737 WAT 8514 ATOM 3737 O WAT 8515 138.493 64.359 11.513 1.00 0.00 O ATOM 3738 H1 WAT 8515 138.777 65.213 11.840 1.00 0.00 H ATOM 3739 H2 WAT 8515 139.089 63.735 11.927 1.00 0.00 H TER 3741 WAT 8515 ATOM 3741 O WAT 8516 91.350 48.788 62.022 1.00 0.00 O ATOM 3742 H1 WAT 8516 92.166 48.979 61.559 1.00 0.00 H ATOM 3743 H2 WAT 8516 90.756 49.491 61.761 1.00 0.00 H TER 3745 WAT 8516 ATOM 3745 O WAT 8517 59.369 18.366 112.341 1.00 0.00 O ATOM 3746 H1 WAT 8517 58.529 18.524 112.772 1.00 0.00 H ATOM 3747 H2 WAT 8517 59.995 18.281 113.060 1.00 0.00 H TER 3749 WAT 8517 ATOM 3749 O WAT 8518 95.698 122.169 25.182 1.00 0.00 O ATOM 3750 H1 WAT 8518 95.288 123.021 25.030 1.00 0.00 H ATOM 3751 H2 WAT 8518 96.617 122.374 25.352 1.00 0.00 H TER 3753 WAT 8518 ATOM 3753 O WAT 8519 60.009 48.200 59.598 1.00 0.00 O ATOM 3754 H1 WAT 8519 60.343 47.506 59.031 1.00 0.00 H ATOM 3755 H2 WAT 8519 60.780 48.722 59.818 1.00 0.00 H TER 3757 WAT 8519 ATOM 3757 O WAT 8520 20.754 137.873 70.468 1.00 0.00 O ATOM 3758 H1 WAT 8520 20.581 138.270 71.321 1.00 0.00 H ATOM 3759 H2 WAT 8520 21.698 137.711 70.467 1.00 0.00 H TER 3761 WAT 8520 ATOM 3761 O WAT 8521 126.704 116.229 110.386 1.00 0.00 O ATOM 3762 H1 WAT 8521 126.375 116.686 109.612 1.00 0.00 H ATOM 3763 H2 WAT 8521 126.508 115.306 110.221 1.00 0.00 H TER 3765 WAT 8521 ATOM 3765 O WAT 8522 98.237 71.616 9.492 1.00 0.00 O ATOM 3766 H1 WAT 8522 98.334 72.074 8.657 1.00 0.00 H ATOM 3767 H2 WAT 8522 98.848 70.882 9.435 1.00 0.00 H TER 3769 WAT 8522 ATOM 3769 O WAT 8523 110.152 33.479 1.457 1.00 0.00 O ATOM 3770 H1 WAT 8523 110.227 33.754 2.370 1.00 0.00 H ATOM 3771 H2 WAT 8523 111.036 33.577 1.103 1.00 0.00 H TER 3773 WAT 8523 ATOM 3773 O WAT 8524 145.220 133.367 22.657 1.00 0.00 O ATOM 3774 H1 WAT 8524 144.708 132.594 22.894 1.00 0.00 H ATOM 3775 H2 WAT 8524 146.123 133.053 22.614 1.00 0.00 H TER 3777 WAT 8524 ATOM 3777 O WAT 8525 106.902 22.505 119.030 1.00 0.00 O ATOM 3778 H1 WAT 8525 107.063 21.625 119.371 1.00 0.00 H ATOM 3779 H2 WAT 8525 107.565 23.050 119.453 1.00 0.00 H TER 3781 WAT 8525 ATOM 3781 O WAT 8526 27.268 47.321 97.370 1.00 0.00 O ATOM 3782 H1 WAT 8526 26.323 47.218 97.260 1.00 0.00 H ATOM 3783 H2 WAT 8526 27.492 46.724 98.084 1.00 0.00 H TER 3785 WAT 8526 ATOM 3785 O WAT 8527 113.149 5.890 115.174 1.00 0.00 O ATOM 3786 H1 WAT 8527 112.874 6.455 115.896 1.00 0.00 H ATOM 3787 H2 WAT 8527 112.491 6.031 114.494 1.00 0.00 H TER 3789 WAT 8527 ATOM 3789 O WAT 8528 93.342 5.190 132.543 1.00 0.00 O ATOM 3790 H1 WAT 8528 93.482 4.390 133.051 1.00 0.00 H ATOM 3791 H2 WAT 8528 92.464 5.089 132.174 1.00 0.00 H TER 3793 WAT 8528 ATOM 3793 O WAT 8529 128.113 18.948 9.507 1.00 0.00 O ATOM 3794 H1 WAT 8529 127.357 19.128 10.065 1.00 0.00 H ATOM 3795 H2 WAT 8529 128.041 19.582 8.794 1.00 0.00 H TER 3797 WAT 8529 ATOM 3797 O WAT 8530 54.382 51.983 4.435 1.00 0.00 O ATOM 3798 H1 WAT 8530 54.004 51.176 4.787 1.00 0.00 H ATOM 3799 H2 WAT 8530 54.577 52.513 5.207 1.00 0.00 H TER 3801 WAT 8530 ATOM 3801 O WAT 8531 33.385 33.153 105.220 1.00 0.00 O ATOM 3802 H1 WAT 8531 32.781 33.074 104.482 1.00 0.00 H ATOM 3803 H2 WAT 8531 33.480 32.259 105.549 1.00 0.00 H TER 3805 WAT 8531 ATOM 3805 O WAT 8532 91.964 121.649 3.981 1.00 0.00 O ATOM 3806 H1 WAT 8532 91.482 121.205 4.679 1.00 0.00 H ATOM 3807 H2 WAT 8532 91.299 121.854 3.324 1.00 0.00 H TER 3809 WAT 8532 ATOM 3809 O WAT 8533 128.279 47.367 103.475 1.00 0.00 O ATOM 3810 H1 WAT 8533 129.208 47.251 103.274 1.00 0.00 H ATOM 3811 H2 WAT 8533 128.083 48.261 103.197 1.00 0.00 H TER 3813 WAT 8533 ATOM 3813 O WAT 8534 40.330 27.164 7.082 1.00 0.00 O ATOM 3814 H1 WAT 8534 40.405 26.390 7.640 1.00 0.00 H ATOM 3815 H2 WAT 8534 40.390 27.903 7.689 1.00 0.00 H TER 3817 WAT 8534 ATOM 3817 O WAT 8535 138.017 107.839 124.630 1.00 0.00 O ATOM 3818 H1 WAT 8535 137.842 107.374 123.811 1.00 0.00 H ATOM 3819 H2 WAT 8535 137.889 107.179 125.312 1.00 0.00 H TER 3821 WAT 8535 ATOM 3821 O WAT 8536 112.402 139.707 104.513 1.00 0.00 O ATOM 3822 H1 WAT 8536 112.640 139.896 103.605 1.00 0.00 H ATOM 3823 H2 WAT 8536 111.974 138.852 104.475 1.00 0.00 H TER 3825 WAT 8536 ATOM 3825 O WAT 8537 119.614 112.552 146.030 1.00 0.00 O ATOM 3826 H1 WAT 8537 120.159 112.137 145.362 1.00 0.00 H ATOM 3827 H2 WAT 8537 120.161 112.560 146.816 1.00 0.00 H TER 3829 WAT 8537 ATOM 3829 O WAT 8538 50.011 64.425 135.234 1.00 0.00 O ATOM 3830 H1 WAT 8538 49.880 63.940 134.420 1.00 0.00 H ATOM 3831 H2 WAT 8538 49.126 64.587 135.561 1.00 0.00 H TER 3833 WAT 8538 ATOM 3833 O WAT 8539 102.739 48.214 95.840 1.00 0.00 O ATOM 3834 H1 WAT 8539 102.580 47.419 95.332 1.00 0.00 H ATOM 3835 H2 WAT 8539 102.949 48.880 95.185 1.00 0.00 H TER 3837 WAT 8539 ATOM 3837 O WAT 8540 75.888 128.581 6.874 1.00 0.00 O ATOM 3838 H1 WAT 8540 75.710 128.730 5.945 1.00 0.00 H ATOM 3839 H2 WAT 8540 75.051 128.287 7.234 1.00 0.00 H TER 3841 WAT 8540 ATOM 3841 O WAT 8541 93.582 107.911 149.035 1.00 0.00 O ATOM 3842 H1 WAT 8541 94.497 108.103 148.830 1.00 0.00 H ATOM 3843 H2 WAT 8541 93.495 106.970 148.881 1.00 0.00 H TER 3845 WAT 8541 ATOM 3845 O WAT 8542 23.329 39.321 70.930 1.00 0.00 O ATOM 3846 H1 WAT 8542 24.192 39.303 71.343 1.00 0.00 H ATOM 3847 H2 WAT 8542 22.968 38.449 71.090 1.00 0.00 H TER 3849 WAT 8542 ATOM 3849 O WAT 8543 37.037 59.476 93.767 1.00 0.00 O ATOM 3850 H1 WAT 8543 37.173 59.474 92.819 1.00 0.00 H ATOM 3851 H2 WAT 8543 36.214 59.003 93.891 1.00 0.00 H TER 3853 WAT 8543 ATOM 3853 O WAT 8544 110.018 120.718 93.485 1.00 0.00 O ATOM 3854 H1 WAT 8544 109.127 121.060 93.557 1.00 0.00 H ATOM 3855 H2 WAT 8544 110.166 120.260 94.311 1.00 0.00 H TER 3857 WAT 8544 ATOM 3857 O WAT 8545 17.999 108.889 102.404 1.00 0.00 O ATOM 3858 H1 WAT 8545 18.708 109.256 102.931 1.00 0.00 H ATOM 3859 H2 WAT 8545 17.240 109.435 102.610 1.00 0.00 H TER 3861 WAT 8545 ATOM 3861 O WAT 8546 62.880 82.566 23.823 1.00 0.00 O ATOM 3862 H1 WAT 8546 63.670 83.053 23.588 1.00 0.00 H ATOM 3863 H2 WAT 8546 62.203 82.914 23.244 1.00 0.00 H TER 3865 WAT 8546 ATOM 3865 O WAT 8547 80.669 21.013 4.954 1.00 0.00 O ATOM 3866 H1 WAT 8547 81.610 20.859 4.879 1.00 0.00 H ATOM 3867 H2 WAT 8547 80.420 20.582 5.772 1.00 0.00 H TER 3869 WAT 8547 ATOM 3869 O WAT 8548 98.950 77.419 77.595 1.00 0.00 O ATOM 3870 H1 WAT 8548 99.167 78.118 78.212 1.00 0.00 H ATOM 3871 H2 WAT 8548 99.368 76.640 77.959 1.00 0.00 H TER 3873 WAT 8548 ATOM 3873 O WAT 8549 26.079 58.363 150.224 1.00 0.00 O ATOM 3874 H1 WAT 8549 26.325 57.465 150.004 1.00 0.00 H ATOM 3875 H2 WAT 8549 25.181 58.450 149.905 1.00 0.00 H TER 3877 WAT 8549 ATOM 3877 O WAT 8550 75.609 67.559 123.413 1.00 0.00 O ATOM 3878 H1 WAT 8550 75.588 67.571 122.456 1.00 0.00 H ATOM 3879 H2 WAT 8550 74.967 68.218 123.676 1.00 0.00 H TER 3881 WAT 8550 ATOM 3881 O WAT 8551 2.284 37.587 83.743 1.00 0.00 O ATOM 3882 H1 WAT 8551 2.112 38.375 84.259 1.00 0.00 H ATOM 3883 H2 WAT 8551 1.622 36.961 84.036 1.00 0.00 H TER 3885 WAT 8551 ATOM 3885 O WAT 8552 98.568 27.691 21.544 1.00 0.00 O ATOM 3886 H1 WAT 8552 99.422 27.274 21.435 1.00 0.00 H ATOM 3887 H2 WAT 8552 98.764 28.626 21.602 1.00 0.00 H TER 3889 WAT 8552 ATOM 3889 O WAT 8553 118.344 121.582 89.028 1.00 0.00 O ATOM 3890 H1 WAT 8553 118.828 120.778 89.217 1.00 0.00 H ATOM 3891 H2 WAT 8553 118.048 121.890 89.884 1.00 0.00 H TER 3893 WAT 8553 ATOM 3893 O WAT 8554 45.152 136.685 69.550 1.00 0.00 O ATOM 3894 H1 WAT 8554 44.616 137.166 68.920 1.00 0.00 H ATOM 3895 H2 WAT 8554 45.259 137.289 70.284 1.00 0.00 H TER 3897 WAT 8554 ATOM 3897 O WAT 8555 17.223 101.549 77.239 1.00 0.00 O ATOM 3898 H1 WAT 8555 16.430 101.060 77.020 1.00 0.00 H ATOM 3899 H2 WAT 8555 16.989 102.046 78.023 1.00 0.00 H TER 3901 WAT 8555 ATOM 3901 O WAT 8556 113.655 82.993 7.394 1.00 0.00 O ATOM 3902 H1 WAT 8556 113.136 83.562 7.963 1.00 0.00 H ATOM 3903 H2 WAT 8556 113.007 82.497 6.895 1.00 0.00 H TER 3905 WAT 8556 ATOM 3905 O WAT 8557 21.895 18.347 88.700 1.00 0.00 O ATOM 3906 H1 WAT 8557 21.679 17.756 89.421 1.00 0.00 H ATOM 3907 H2 WAT 8557 21.356 18.042 87.970 1.00 0.00 H TER 3909 WAT 8557 ATOM 3909 O WAT 8558 113.050 121.339 126.122 1.00 0.00 O ATOM 3910 H1 WAT 8558 113.123 121.183 127.063 1.00 0.00 H ATOM 3911 H2 WAT 8558 112.342 121.978 126.039 1.00 0.00 H TER 3913 WAT 8558 ATOM 3913 O WAT 8559 144.168 17.345 112.593 1.00 0.00 O ATOM 3914 H1 WAT 8559 143.426 17.948 112.541 1.00 0.00 H ATOM 3915 H2 WAT 8559 144.356 17.118 111.682 1.00 0.00 H TER 3917 WAT 8559 ATOM 3917 O WAT 8560 104.815 102.962 155.475 1.00 0.00 O ATOM 3918 H1 WAT 8560 104.628 102.657 156.363 1.00 0.00 H ATOM 3919 H2 WAT 8560 104.548 103.881 155.477 1.00 0.00 H TER 3921 WAT 8560 ATOM 3921 O WAT 8561 95.526 127.854 101.859 1.00 0.00 O ATOM 3922 H1 WAT 8561 94.996 127.076 101.683 1.00 0.00 H ATOM 3923 H2 WAT 8561 95.326 128.080 102.767 1.00 0.00 H TER 3925 WAT 8561 ATOM 3925 O WAT 8562 11.719 45.610 143.606 1.00 0.00 O ATOM 3926 H1 WAT 8562 12.035 45.541 144.508 1.00 0.00 H ATOM 3927 H2 WAT 8562 12.435 45.263 143.075 1.00 0.00 H TER 3929 WAT 8562 ATOM 3929 O WAT 8563 84.374 68.173 86.810 1.00 0.00 O ATOM 3930 H1 WAT 8563 83.921 68.904 86.388 1.00 0.00 H ATOM 3931 H2 WAT 8563 83.773 67.433 86.715 1.00 0.00 H TER 3933 WAT 8563 ATOM 3933 O WAT 8564 80.828 37.964 5.156 1.00 0.00 O ATOM 3934 H1 WAT 8564 80.048 37.686 5.636 1.00 0.00 H ATOM 3935 H2 WAT 8564 81.539 37.893 5.792 1.00 0.00 H TER 3937 WAT 8564 ATOM 3937 O WAT 8565 5.150 20.653 3.305 1.00 0.00 O ATOM 3938 H1 WAT 8565 5.633 19.838 3.443 1.00 0.00 H ATOM 3939 H2 WAT 8565 5.249 21.131 4.128 1.00 0.00 H TER 3941 WAT 8565 ATOM 3941 O WAT 8566 15.787 81.987 105.466 1.00 0.00 O ATOM 3942 H1 WAT 8566 14.930 81.699 105.153 1.00 0.00 H ATOM 3943 H2 WAT 8566 16.083 82.617 104.808 1.00 0.00 H TER 3945 WAT 8566 ATOM 3945 O WAT 8567 108.016 33.495 62.950 1.00 0.00 O ATOM 3946 H1 WAT 8567 108.669 33.989 63.446 1.00 0.00 H ATOM 3947 H2 WAT 8567 108.371 33.452 62.062 1.00 0.00 H TER 3949 WAT 8567 ATOM 3949 O WAT 8568 111.287 138.113 147.875 1.00 0.00 O ATOM 3950 H1 WAT 8568 110.832 138.929 148.085 1.00 0.00 H ATOM 3951 H2 WAT 8568 111.895 137.984 148.602 1.00 0.00 H TER 3953 WAT 8568 ATOM 3953 O WAT 8569 69.802 2.895 87.836 1.00 0.00 O ATOM 3954 H1 WAT 8569 68.849 2.950 87.902 1.00 0.00 H ATOM 3955 H2 WAT 8569 70.123 3.393 88.588 1.00 0.00 H TER 3957 WAT 8569 ATOM 3957 O WAT 8570 40.763 20.082 0.093 1.00 0.00 O ATOM 3958 H1 WAT 8570 41.377 20.147 0.824 1.00 0.00 H ATOM 3959 H2 WAT 8570 40.212 20.861 0.172 1.00 0.00 H TER 3961 WAT 8570 ATOM 3961 O WAT 8571 92.034 15.680 2.790 1.00 0.00 O ATOM 3962 H1 WAT 8571 91.321 15.041 2.775 1.00 0.00 H ATOM 3963 H2 WAT 8571 91.647 16.460 3.189 1.00 0.00 H TER 3965 WAT 8571 ATOM 3965 O WAT 8572 17.427 124.106 124.930 1.00 0.00 O ATOM 3966 H1 WAT 8572 17.613 124.868 124.382 1.00 0.00 H ATOM 3967 H2 WAT 8572 17.380 124.456 125.820 1.00 0.00 H TER 3969 WAT 8572 ATOM 3969 O WAT 8573 47.760 141.877 56.471 1.00 0.00 O ATOM 3970 H1 WAT 8573 47.146 141.446 55.876 1.00 0.00 H ATOM 3971 H2 WAT 8573 48.489 142.144 55.910 1.00 0.00 H TER 3973 WAT 8573 ATOM 3973 O WAT 8574 40.712 59.466 115.923 1.00 0.00 O ATOM 3974 H1 WAT 8574 41.649 59.385 116.105 1.00 0.00 H ATOM 3975 H2 WAT 8574 40.286 59.094 116.695 1.00 0.00 H TER 3977 WAT 8574 ATOM 3977 O WAT 8575 3.157 65.736 126.725 1.00 0.00 O ATOM 3978 H1 WAT 8575 3.024 65.470 127.634 1.00 0.00 H ATOM 3979 H2 WAT 8575 2.386 66.263 126.514 1.00 0.00 H TER 3981 WAT 8575 ATOM 3981 O WAT 8576 24.973 80.866 94.201 1.00 0.00 O ATOM 3982 H1 WAT 8576 24.213 80.707 93.642 1.00 0.00 H ATOM 3983 H2 WAT 8576 25.355 79.999 94.338 1.00 0.00 H TER 3985 WAT 8576 ATOM 3985 O WAT 8577 112.913 136.245 3.298 1.00 0.00 O ATOM 3986 H1 WAT 8577 113.767 136.179 3.726 1.00 0.00 H ATOM 3987 H2 WAT 8577 112.445 136.912 3.800 1.00 0.00 H TER 3989 WAT 8577 ATOM 3989 O WAT 8578 29.190 47.990 156.838 1.00 0.00 O ATOM 3990 H1 WAT 8578 29.915 47.818 157.439 1.00 0.00 H ATOM 3991 H2 WAT 8578 29.528 48.655 156.238 1.00 0.00 H TER 3993 WAT 8578 ATOM 3993 O WAT 8579 18.511 40.988 101.596 1.00 0.00 O ATOM 3994 H1 WAT 8579 18.610 40.209 101.049 1.00 0.00 H ATOM 3995 H2 WAT 8579 18.040 40.678 102.370 1.00 0.00 H TER 3997 WAT 8579 ATOM 3997 O WAT 8580 108.970 81.946 73.823 1.00 0.00 O ATOM 3998 H1 WAT 8580 108.028 81.883 73.667 1.00 0.00 H ATOM 3999 H2 WAT 8580 109.283 82.557 73.156 1.00 0.00 H TER 4001 WAT 8580 ATOM 4001 O WAT 8581 118.524 113.171 136.531 1.00 0.00 O ATOM 4002 H1 WAT 8581 118.202 114.021 136.231 1.00 0.00 H ATOM 4003 H2 WAT 8581 118.247 113.120 137.446 1.00 0.00 H TER 4005 WAT 8581 ATOM 4005 O WAT 8582 92.054 10.883 70.161 1.00 0.00 O ATOM 4006 H1 WAT 8582 91.433 11.497 70.552 1.00 0.00 H ATOM 4007 H2 WAT 8582 92.914 11.223 70.409 1.00 0.00 H TER 4009 WAT 8582 ATOM 4009 O WAT 8583 113.652 24.003 154.975 1.00 0.00 O ATOM 4010 H1 WAT 8583 114.278 23.973 155.699 1.00 0.00 H ATOM 4011 H2 WAT 8583 112.794 23.985 155.400 1.00 0.00 H TER 4013 WAT 8583 ATOM 4013 O WAT 8584 103.304 47.380 7.705 1.00 0.00 O ATOM 4014 H1 WAT 8584 102.750 46.609 7.830 1.00 0.00 H ATOM 4015 H2 WAT 8584 103.662 47.278 6.824 1.00 0.00 H TER 4017 WAT 8584 ATOM 4017 O WAT 8585 30.358 41.976 136.742 1.00 0.00 O ATOM 4018 H1 WAT 8585 29.988 42.298 137.564 1.00 0.00 H ATOM 4019 H2 WAT 8585 29.918 41.138 136.594 1.00 0.00 H TER 4021 WAT 8585 ATOM 4021 O WAT 8586 119.063 96.355 104.553 1.00 0.00 O ATOM 4022 H1 WAT 8586 119.470 95.788 105.208 1.00 0.00 H ATOM 4023 H2 WAT 8586 118.916 95.783 103.800 1.00 0.00 H TER 4025 WAT 8586 ATOM 4025 O WAT 8587 24.960 139.901 104.561 1.00 0.00 O ATOM 4026 H1 WAT 8587 25.750 139.978 105.097 1.00 0.00 H ATOM 4027 H2 WAT 8587 24.511 139.130 104.907 1.00 0.00 H TER 4029 WAT 8587 ATOM 4029 O WAT 8588 115.456 88.680 118.459 1.00 0.00 O ATOM 4030 H1 WAT 8588 114.958 89.473 118.263 1.00 0.00 H ATOM 4031 H2 WAT 8588 116.083 88.950 119.130 1.00 0.00 H TER 4033 WAT 8588 ATOM 4033 O WAT 8589 68.147 104.244 70.884 1.00 0.00 O ATOM 4034 H1 WAT 8589 68.774 104.108 70.174 1.00 0.00 H ATOM 4035 H2 WAT 8589 68.031 103.376 71.271 1.00 0.00 H TER 4037 WAT 8589 ATOM 4037 O WAT 8590 2.960 74.636 138.599 1.00 0.00 O ATOM 4038 H1 WAT 8590 2.701 73.914 139.172 1.00 0.00 H ATOM 4039 H2 WAT 8590 3.146 74.219 137.758 1.00 0.00 H TER 4041 WAT 8590 ATOM 4041 O WAT 8591 103.736 91.378 143.070 1.00 0.00 O ATOM 4042 H1 WAT 8591 104.242 91.266 143.875 1.00 0.00 H ATOM 4043 H2 WAT 8591 102.927 90.890 143.226 1.00 0.00 H TER 4045 WAT 8591 ATOM 4045 O WAT 8592 124.651 85.236 150.152 1.00 0.00 O ATOM 4046 H1 WAT 8592 124.775 84.324 150.416 1.00 0.00 H ATOM 4047 H2 WAT 8592 123.852 85.510 150.602 1.00 0.00 H TER 4049 WAT 8592 ATOM 4049 O WAT 8593 142.347 57.428 64.246 1.00 0.00 O ATOM 4050 H1 WAT 8593 142.348 56.589 63.784 1.00 0.00 H ATOM 4051 H2 WAT 8593 142.669 58.057 63.600 1.00 0.00 H TER 4053 WAT 8593 ATOM 4053 O WAT 8594 115.434 65.389 8.917 1.00 0.00 O ATOM 4054 H1 WAT 8594 114.732 65.328 9.565 1.00 0.00 H ATOM 4055 H2 WAT 8594 115.784 64.500 8.859 1.00 0.00 H TER 4057 WAT 8594 ATOM 4057 O WAT 8595 51.029 10.130 146.638 1.00 0.00 O ATOM 4058 H1 WAT 8595 51.252 9.800 147.508 1.00 0.00 H ATOM 4059 H2 WAT 8595 51.275 9.423 146.042 1.00 0.00 H TER 4061 WAT 8595 ATOM 4061 O WAT 8596 75.437 38.010 139.647 1.00 0.00 O ATOM 4062 H1 WAT 8596 74.775 38.308 139.023 1.00 0.00 H ATOM 4063 H2 WAT 8596 75.459 38.694 140.317 1.00 0.00 H TER 4065 WAT 8596 ATOM 4065 O WAT 8597 118.745 100.427 17.020 1.00 0.00 O ATOM 4066 H1 WAT 8597 119.526 100.865 17.357 1.00 0.00 H ATOM 4067 H2 WAT 8597 118.268 100.153 17.804 1.00 0.00 H TER 4069 WAT 8597 ATOM 4069 O WAT 8598 122.909 102.391 103.977 1.00 0.00 O ATOM 4070 H1 WAT 8598 123.034 101.618 103.426 1.00 0.00 H ATOM 4071 H2 WAT 8598 122.069 102.752 103.696 1.00 0.00 H TER 4073 WAT 8598 ATOM 4073 O WAT 8599 74.009 9.013 147.927 1.00 0.00 O ATOM 4074 H1 WAT 8599 73.080 8.793 147.996 1.00 0.00 H ATOM 4075 H2 WAT 8599 74.019 9.902 147.572 1.00 0.00 H TER 4077 WAT 8599 ATOM 4077 O WAT 8600 15.903 83.282 27.306 1.00 0.00 O ATOM 4078 H1 WAT 8600 14.947 83.288 27.261 1.00 0.00 H ATOM 4079 H2 WAT 8600 16.110 83.820 28.071 1.00 0.00 H TER 4081 WAT 8600 ATOM 4081 O WAT 8601 33.623 104.442 113.623 1.00 0.00 O ATOM 4082 H1 WAT 8601 32.822 104.035 113.953 1.00 0.00 H ATOM 4083 H2 WAT 8601 34.331 103.928 114.012 1.00 0.00 H TER 4085 WAT 8601 ATOM 4085 O WAT 8602 137.763 59.659 136.925 1.00 0.00 O ATOM 4086 H1 WAT 8602 137.573 60.194 136.155 1.00 0.00 H ATOM 4087 H2 WAT 8602 137.680 58.757 136.616 1.00 0.00 H TER 4089 WAT 8602 ATOM 4089 O WAT 8603 65.598 26.117 3.367 1.00 0.00 O ATOM 4090 H1 WAT 8603 65.798 25.894 2.458 1.00 0.00 H ATOM 4091 H2 WAT 8603 66.039 25.442 3.883 1.00 0.00 H TER 4093 WAT 8603 ATOM 4093 O WAT 8604 82.781 139.846 9.889 1.00 0.00 O ATOM 4094 H1 WAT 8604 82.433 139.135 9.350 1.00 0.00 H ATOM 4095 H2 WAT 8604 83.217 139.404 10.617 1.00 0.00 H TER 4097 WAT 8604 ATOM 4097 O WAT 8605 86.740 50.429 87.596 1.00 0.00 O ATOM 4098 H1 WAT 8605 87.657 50.345 87.333 1.00 0.00 H ATOM 4099 H2 WAT 8605 86.355 51.008 86.939 1.00 0.00 H TER 4101 WAT 8605 ATOM 4101 O WAT 8606 47.483 101.803 103.581 1.00 0.00 O ATOM 4102 H1 WAT 8606 46.653 101.435 103.279 1.00 0.00 H ATOM 4103 H2 WAT 8606 48.128 101.120 103.401 1.00 0.00 H TER 4105 WAT 8606 ATOM 4105 O WAT 8607 19.392 59.783 12.439 1.00 0.00 O ATOM 4106 H1 WAT 8607 18.694 59.145 12.294 1.00 0.00 H ATOM 4107 H2 WAT 8607 20.178 59.363 12.088 1.00 0.00 H TER 4109 WAT 8607 ATOM 4109 O WAT 8608 13.755 17.147 0.223 1.00 0.00 O ATOM 4110 H1 WAT 8608 14.668 16.961 0.445 1.00 0.00 H ATOM 4111 H2 WAT 8608 13.400 17.568 1.006 1.00 0.00 H TER 4113 WAT 8608 ATOM 4113 O WAT 8609 86.163 88.938 115.736 1.00 0.00 O ATOM 4114 H1 WAT 8609 85.431 89.459 115.406 1.00 0.00 H ATOM 4115 H2 WAT 8609 85.953 88.786 116.658 1.00 0.00 H TER 4117 WAT 8609 ATOM 4117 O WAT 8610 143.066 1.410 11.000 1.00 0.00 O ATOM 4118 H1 WAT 8610 142.711 0.583 11.327 1.00 0.00 H ATOM 4119 H2 WAT 8610 143.996 1.377 11.224 1.00 0.00 H TER 4121 WAT 8610 ATOM 4121 O WAT 8611 129.295 85.583 12.545 1.00 0.00 O ATOM 4122 H1 WAT 8611 129.708 85.780 13.386 1.00 0.00 H ATOM 4123 H2 WAT 8611 129.610 84.706 12.324 1.00 0.00 H TER 4125 WAT 8611 ATOM 4125 O WAT 8612 30.498 8.603 111.696 1.00 0.00 O ATOM 4126 H1 WAT 8612 30.446 8.962 110.810 1.00 0.00 H ATOM 4127 H2 WAT 8612 31.431 8.618 111.907 1.00 0.00 H TER 4129 WAT 8612 ATOM 4129 O WAT 8613 41.932 121.321 154.767 1.00 0.00 O ATOM 4130 H1 WAT 8613 41.062 121.718 154.731 1.00 0.00 H ATOM 4131 H2 WAT 8613 41.770 120.410 155.013 1.00 0.00 H TER 4133 WAT 8613 ATOM 4133 O WAT 8614 87.451 57.574 84.041 1.00 0.00 O ATOM 4134 H1 WAT 8614 87.645 58.231 84.710 1.00 0.00 H ATOM 4135 H2 WAT 8614 86.911 56.925 84.492 1.00 0.00 H TER 4137 WAT 8614 ATOM 4137 O WAT 8615 16.001 121.707 100.820 1.00 0.00 O ATOM 4138 H1 WAT 8615 15.708 122.311 101.503 1.00 0.00 H ATOM 4139 H2 WAT 8615 15.747 122.131 100.000 1.00 0.00 H TER 4141 WAT 8615 ATOM 4141 O WAT 8616 107.192 17.130 140.543 1.00 0.00 O ATOM 4142 H1 WAT 8616 107.790 16.392 140.661 1.00 0.00 H ATOM 4143 H2 WAT 8616 106.542 16.814 139.916 1.00 0.00 H TER 4145 WAT 8616 ATOM 4145 O WAT 8617 39.306 97.197 105.785 1.00 0.00 O ATOM 4146 H1 WAT 8617 39.409 97.446 106.704 1.00 0.00 H ATOM 4147 H2 WAT 8617 40.098 96.700 105.581 1.00 0.00 H TER 4149 WAT 8617 ATOM 4149 O WAT 8618 114.060 5.209 117.866 1.00 0.00 O ATOM 4150 H1 WAT 8618 113.297 5.723 118.126 1.00 0.00 H ATOM 4151 H2 WAT 8618 113.786 4.761 117.066 1.00 0.00 H TER 4153 WAT 8618 ATOM 4153 O WAT 8619 125.208 58.786 150.753 1.00 0.00 O ATOM 4154 H1 WAT 8619 124.945 59.285 151.527 1.00 0.00 H ATOM 4155 H2 WAT 8619 125.260 59.438 150.054 1.00 0.00 H TER 4157 WAT 8619 ATOM 4157 O WAT 8620 86.838 20.697 87.447 1.00 0.00 O ATOM 4158 H1 WAT 8620 85.933 21.001 87.385 1.00 0.00 H ATOM 4159 H2 WAT 8620 87.344 21.488 87.633 1.00 0.00 H TER 4161 WAT 8620 ATOM 4161 O WAT 8621 52.816 17.141 24.712 1.00 0.00 O ATOM 4162 H1 WAT 8621 52.766 18.078 24.527 1.00 0.00 H ATOM 4163 H2 WAT 8621 52.098 16.758 24.208 1.00 0.00 H TER 4165 WAT 8621 ATOM 4165 O WAT 8622 122.507 142.559 152.549 1.00 0.00 O ATOM 4166 H1 WAT 8622 123.401 142.566 152.206 1.00 0.00 H ATOM 4167 H2 WAT 8622 122.032 141.966 151.967 1.00 0.00 H TER 4169 WAT 8622 ATOM 4169 O WAT 8623 14.672 84.221 97.824 1.00 0.00 O ATOM 4170 H1 WAT 8623 15.554 84.344 98.175 1.00 0.00 H ATOM 4171 H2 WAT 8623 14.599 83.277 97.684 1.00 0.00 H TER 4173 WAT 8623 ATOM 4173 O WAT 8624 141.354 43.217 102.401 1.00 0.00 O ATOM 4174 H1 WAT 8624 141.370 44.155 102.591 1.00 0.00 H ATOM 4175 H2 WAT 8624 141.932 42.829 103.057 1.00 0.00 H TER 4177 WAT 8624 ATOM 4177 O WAT 8625 98.328 95.854 135.010 1.00 0.00 O ATOM 4178 H1 WAT 8625 97.481 96.299 135.055 1.00 0.00 H ATOM 4179 H2 WAT 8625 98.867 96.298 135.664 1.00 0.00 H TER 4181 WAT 8625 ATOM 4181 O WAT 8626 52.005 76.088 137.179 1.00 0.00 O ATOM 4182 H1 WAT 8626 51.609 75.232 137.016 1.00 0.00 H ATOM 4183 H2 WAT 8626 51.313 76.594 137.606 1.00 0.00 H TER 4185 WAT 8626 ATOM 4185 O WAT 8627 136.537 16.367 130.697 1.00 0.00 O ATOM 4186 H1 WAT 8627 136.278 17.260 130.925 1.00 0.00 H ATOM 4187 H2 WAT 8627 135.797 16.025 130.195 1.00 0.00 H TER 4189 WAT 8627 ATOM 4189 O WAT 8628 66.918 37.545 20.698 1.00 0.00 O ATOM 4190 H1 WAT 8628 66.459 37.793 21.500 1.00 0.00 H ATOM 4191 H2 WAT 8628 66.983 36.591 20.744 1.00 0.00 H TER 4193 WAT 8628 ATOM 4193 O WAT 8629 86.742 136.414 155.863 1.00 0.00 O ATOM 4194 H1 WAT 8629 87.000 135.498 155.964 1.00 0.00 H ATOM 4195 H2 WAT 8629 86.513 136.497 154.937 1.00 0.00 H TER 4197 WAT 8629 ATOM 4197 O WAT 8630 100.510 29.230 90.872 1.00 0.00 O ATOM 4198 H1 WAT 8630 101.184 29.902 90.975 1.00 0.00 H ATOM 4199 H2 WAT 8630 100.706 28.822 90.029 1.00 0.00 H TER 4201 WAT 8630 ATOM 4201 O WAT 8631 5.088 4.604 124.460 1.00 0.00 O ATOM 4202 H1 WAT 8631 5.461 4.392 123.604 1.00 0.00 H ATOM 4203 H2 WAT 8631 4.423 3.931 124.605 1.00 0.00 H TER 4205 WAT 8631 ATOM 4205 O WAT 8632 113.050 27.701 158.042 1.00 0.00 O ATOM 4206 H1 WAT 8632 112.121 27.931 158.007 1.00 0.00 H ATOM 4207 H2 WAT 8632 113.066 26.832 158.443 1.00 0.00 H TER 4209 WAT 8632 ATOM 4209 O WAT 8633 88.148 139.109 100.109 1.00 0.00 O ATOM 4210 H1 WAT 8633 88.965 139.532 100.374 1.00 0.00 H ATOM 4211 H2 WAT 8633 87.460 139.673 100.463 1.00 0.00 H TER 4213 WAT 8633 ATOM 4213 O WAT 8634 20.117 93.489 78.932 1.00 0.00 O ATOM 4214 H1 WAT 8634 20.687 93.934 78.305 1.00 0.00 H ATOM 4215 H2 WAT 8634 19.489 93.013 78.390 1.00 0.00 H TER 4217 WAT 8634 ATOM 4217 O WAT 8635 45.889 52.267 93.813 1.00 0.00 O ATOM 4218 H1 WAT 8635 46.780 51.971 93.625 1.00 0.00 H ATOM 4219 H2 WAT 8635 45.340 51.504 93.634 1.00 0.00 H TER 4221 WAT 8635 ATOM 4221 O WAT 8636 23.758 56.767 23.341 1.00 0.00 O ATOM 4222 H1 WAT 8636 23.303 56.769 24.184 1.00 0.00 H ATOM 4223 H2 WAT 8636 24.376 57.495 23.401 1.00 0.00 H TER 4225 WAT 8636 ATOM 4225 O WAT 8637 28.763 124.547 101.819 1.00 0.00 O ATOM 4226 H1 WAT 8637 28.069 124.162 101.284 1.00 0.00 H ATOM 4227 H2 WAT 8637 29.358 123.819 101.998 1.00 0.00 H TER 4229 WAT 8637 ATOM 4229 O WAT 8638 21.924 76.025 118.551 1.00 0.00 O ATOM 4230 H1 WAT 8638 21.705 76.804 119.062 1.00 0.00 H ATOM 4231 H2 WAT 8638 21.237 75.974 117.887 1.00 0.00 H TER 4233 WAT 8638 ATOM 4233 O WAT 8639 141.501 95.799 11.824 1.00 0.00 O ATOM 4234 H1 WAT 8639 141.226 95.419 12.658 1.00 0.00 H ATOM 4235 H2 WAT 8639 142.029 95.116 11.411 1.00 0.00 H TER 4237 WAT 8639 ATOM 4237 O WAT 8640 21.705 62.335 100.833 1.00 0.00 O ATOM 4238 H1 WAT 8640 21.240 63.148 101.033 1.00 0.00 H ATOM 4239 H2 WAT 8640 21.777 62.329 99.878 1.00 0.00 H TER 4241 WAT 8640 ATOM 4241 O WAT 8641 28.423 106.395 126.345 1.00 0.00 O ATOM 4242 H1 WAT 8641 27.888 106.264 127.127 1.00 0.00 H ATOM 4243 H2 WAT 8641 29.323 106.267 126.646 1.00 0.00 H TER 4245 WAT 8641 ATOM 4245 O WAT 8642 114.715 76.286 68.450 1.00 0.00 O ATOM 4246 H1 WAT 8642 115.359 75.581 68.516 1.00 0.00 H ATOM 4247 H2 WAT 8642 113.869 75.848 68.547 1.00 0.00 H TER 4249 WAT 8642 ATOM 4249 O WAT 8643 85.261 126.198 82.897 1.00 0.00 O ATOM 4250 H1 WAT 8643 85.475 126.503 82.015 1.00 0.00 H ATOM 4251 H2 WAT 8643 84.874 125.333 82.765 1.00 0.00 H TER 4253 WAT 8643 ATOM 4253 O WAT 8644 136.628 27.734 16.591 1.00 0.00 O ATOM 4254 H1 WAT 8644 136.242 28.158 17.357 1.00 0.00 H ATOM 4255 H2 WAT 8644 137.151 28.421 16.175 1.00 0.00 H TER 4257 WAT 8644 ATOM 4257 O WAT 8645 79.566 100.462 60.091 1.00 0.00 O ATOM 4258 H1 WAT 8645 79.362 99.595 59.739 1.00 0.00 H ATOM 4259 H2 WAT 8645 78.712 100.855 60.268 1.00 0.00 H TER 4261 WAT 8645 ATOM 4261 O WAT 8646 60.976 130.575 70.628 1.00 0.00 O ATOM 4262 H1 WAT 8646 60.661 130.590 69.724 1.00 0.00 H ATOM 4263 H2 WAT 8646 60.622 131.374 71.017 1.00 0.00 H TER 4265 WAT 8646 ATOM 4265 O WAT 8647 135.663 113.261 143.269 1.00 0.00 O ATOM 4266 H1 WAT 8647 134.731 113.190 143.059 1.00 0.00 H ATOM 4267 H2 WAT 8647 135.779 112.701 144.036 1.00 0.00 H TER 4269 WAT 8647 ATOM 4269 O WAT 8648 130.331 144.931 133.446 1.00 0.00 O ATOM 4270 H1 WAT 8648 129.954 145.799 133.588 1.00 0.00 H ATOM 4271 H2 WAT 8648 131.276 145.081 133.423 1.00 0.00 H TER 4273 WAT 8648 ATOM 4273 O WAT 8649 92.758 84.377 66.234 1.00 0.00 O ATOM 4274 H1 WAT 8649 92.192 84.486 65.470 1.00 0.00 H ATOM 4275 H2 WAT 8649 92.578 85.144 66.777 1.00 0.00 H TER 4277 WAT 8649 ATOM 4277 O WAT 8650 95.920 81.048 71.303 1.00 0.00 O ATOM 4278 H1 WAT 8650 95.693 81.444 72.145 1.00 0.00 H ATOM 4279 H2 WAT 8650 96.671 81.555 70.996 1.00 0.00 H TER 4281 WAT 8650 ATOM 4281 O WAT 8651 145.433 91.596 101.592 1.00 0.00 O ATOM 4282 H1 WAT 8651 145.292 92.442 102.017 1.00 0.00 H ATOM 4283 H2 WAT 8651 145.286 91.767 100.662 1.00 0.00 H TER 4285 WAT 8651 ATOM 4285 O WAT 8652 92.156 28.681 70.120 1.00 0.00 O ATOM 4286 H1 WAT 8652 91.311 28.928 70.497 1.00 0.00 H ATOM 4287 H2 WAT 8652 91.960 28.472 69.207 1.00 0.00 H TER 4289 WAT 8652 ATOM 4289 O WAT 8653 0.746 128.826 101.033 1.00 0.00 O ATOM 4290 H1 WAT 8653 0.535 128.145 101.671 1.00 0.00 H ATOM 4291 H2 WAT 8653 -0.048 128.915 100.506 1.00 0.00 H TER 4293 WAT 8653 ATOM 4293 O WAT 8654 74.192 22.862 93.810 1.00 0.00 O ATOM 4294 H1 WAT 8654 75.108 23.136 93.861 1.00 0.00 H ATOM 4295 H2 WAT 8654 73.731 23.631 93.476 1.00 0.00 H TER 4297 WAT 8654 ATOM 4297 O WAT 8655 70.529 79.935 81.571 1.00 0.00 O ATOM 4298 H1 WAT 8655 70.203 80.687 82.065 1.00 0.00 H ATOM 4299 H2 WAT 8655 71.069 79.453 82.197 1.00 0.00 H TER 4301 WAT 8655 ATOM 4301 O WAT 8656 140.982 21.938 103.580 1.00 0.00 O ATOM 4302 H1 WAT 8656 140.285 21.985 102.925 1.00 0.00 H ATOM 4303 H2 WAT 8656 141.739 21.603 103.099 1.00 0.00 H TER 4305 WAT 8656 ATOM 4305 O WAT 8657 50.257 11.716 134.497 1.00 0.00 O ATOM 4306 H1 WAT 8657 50.645 10.882 134.232 1.00 0.00 H ATOM 4307 H2 WAT 8657 50.693 11.931 135.322 1.00 0.00 H TER 4309 WAT 8657 ATOM 4309 O WAT 8658 145.090 126.736 134.923 1.00 0.00 O ATOM 4310 H1 WAT 8658 144.323 126.721 134.350 1.00 0.00 H ATOM 4311 H2 WAT 8658 145.369 125.822 134.974 1.00 0.00 H TER 4313 WAT 8658 ATOM 4313 O WAT 8659 43.699 109.158 93.665 1.00 0.00 O ATOM 4314 H1 WAT 8659 43.716 109.569 94.529 1.00 0.00 H ATOM 4315 H2 WAT 8659 42.768 109.079 93.455 1.00 0.00 H TER 4317 WAT 8659 ATOM 4317 O WAT 8660 41.800 142.729 145.658 1.00 0.00 O ATOM 4318 H1 WAT 8660 42.222 142.030 146.157 1.00 0.00 H ATOM 4319 H2 WAT 8660 42.483 143.391 145.549 1.00 0.00 H TER 4321 WAT 8660 ATOM 4321 O WAT 8661 42.532 53.492 9.150 1.00 0.00 O ATOM 4322 H1 WAT 8661 42.558 53.909 10.011 1.00 0.00 H ATOM 4323 H2 WAT 8661 43.443 53.259 8.970 1.00 0.00 H TER 4325 WAT 8661 ATOM 4325 O WAT 8662 59.918 23.449 118.603 1.00 0.00 O ATOM 4326 H1 WAT 8662 59.087 23.361 119.070 1.00 0.00 H ATOM 4327 H2 WAT 8662 60.233 24.322 118.839 1.00 0.00 H TER 4329 WAT 8662 ATOM 4329 O WAT 8663 47.905 19.972 127.039 1.00 0.00 O ATOM 4330 H1 WAT 8663 48.693 20.122 127.561 1.00 0.00 H ATOM 4331 H2 WAT 8663 48.226 19.867 126.144 1.00 0.00 H TER 4333 WAT 8663 ATOM 4333 O WAT 8664 50.084 16.782 81.165 1.00 0.00 O ATOM 4334 H1 WAT 8664 49.261 16.586 81.613 1.00 0.00 H ATOM 4335 H2 WAT 8664 50.082 16.209 80.398 1.00 0.00 H TER 4337 WAT 8664 ATOM 4337 O WAT 8665 97.736 55.204 63.721 1.00 0.00 O ATOM 4338 H1 WAT 8665 96.905 54.847 63.406 1.00 0.00 H ATOM 4339 H2 WAT 8665 98.376 54.940 63.061 1.00 0.00 H TER 4341 WAT 8665 ATOM 4341 O WAT 8666 45.146 29.997 88.901 1.00 0.00 O ATOM 4342 H1 WAT 8666 45.004 30.847 88.484 1.00 0.00 H ATOM 4343 H2 WAT 8666 44.779 29.364 88.285 1.00 0.00 H TER 4345 WAT 8666 ATOM 4345 O WAT 8667 115.597 46.512 11.452 1.00 0.00 O ATOM 4346 H1 WAT 8667 115.716 45.941 12.211 1.00 0.00 H ATOM 4347 H2 WAT 8667 115.410 45.914 10.729 1.00 0.00 H TER 4349 WAT 8667 ATOM 4349 O WAT 8668 8.033 135.550 64.311 1.00 0.00 O ATOM 4350 H1 WAT 8668 8.844 135.574 63.803 1.00 0.00 H ATOM 4351 H2 WAT 8668 8.319 135.426 65.215 1.00 0.00 H TER 4353 WAT 8668 ATOM 4353 O WAT 8669 95.484 2.900 17.850 1.00 0.00 O ATOM 4354 H1 WAT 8669 95.112 3.774 17.732 1.00 0.00 H ATOM 4355 H2 WAT 8669 96.221 2.870 17.239 1.00 0.00 H TER 4357 WAT 8669 ATOM 4357 O WAT 8670 59.491 108.020 1.256 1.00 0.00 O ATOM 4358 H1 WAT 8670 58.995 107.399 0.723 1.00 0.00 H ATOM 4359 H2 WAT 8670 60.342 107.601 1.383 1.00 0.00 H TER 4361 WAT 8670 ATOM 4361 O WAT 8671 28.352 123.762 131.643 1.00 0.00 O ATOM 4362 H1 WAT 8671 28.388 123.617 132.588 1.00 0.00 H ATOM 4363 H2 WAT 8671 29.052 123.213 131.289 1.00 0.00 H TER 4365 WAT 8671 ATOM 4365 O WAT 8672 134.883 39.758 71.793 1.00 0.00 O ATOM 4366 H1 WAT 8672 135.342 40.598 71.802 1.00 0.00 H ATOM 4367 H2 WAT 8672 135.357 39.220 72.428 1.00 0.00 H TER 4369 WAT 8672 ATOM 4369 O WAT 8673 55.421 11.993 157.058 1.00 0.00 O ATOM 4370 H1 WAT 8673 55.393 11.224 156.490 1.00 0.00 H ATOM 4371 H2 WAT 8673 54.714 11.853 157.688 1.00 0.00 H TER 4373 WAT 8673 ATOM 4373 O WAT 8674 89.740 113.618 56.338 1.00 0.00 O ATOM 4374 H1 WAT 8674 89.469 113.053 55.615 1.00 0.00 H ATOM 4375 H2 WAT 8674 89.877 113.019 57.072 1.00 0.00 H TER 4377 WAT 8674 ATOM 4377 O WAT 8675 12.856 3.525 104.327 1.00 0.00 O ATOM 4378 H1 WAT 8675 12.161 3.456 104.981 1.00 0.00 H ATOM 4379 H2 WAT 8675 12.665 4.338 103.859 1.00 0.00 H TER 4381 WAT 8675 ATOM 4381 O WAT 8676 52.463 46.177 62.855 1.00 0.00 O ATOM 4382 H1 WAT 8676 52.898 46.381 62.027 1.00 0.00 H ATOM 4383 H2 WAT 8676 51.704 45.652 62.604 1.00 0.00 H TER 4385 WAT 8676 ATOM 4385 O WAT 8677 85.660 108.893 21.101 1.00 0.00 O ATOM 4386 H1 WAT 8677 86.137 108.386 21.758 1.00 0.00 H ATOM 4387 H2 WAT 8677 85.017 108.280 20.745 1.00 0.00 H TER 4389 WAT 8677 ATOM 4389 O WAT 8678 135.353 104.947 88.446 1.00 0.00 O ATOM 4390 H1 WAT 8678 136.210 104.570 88.248 1.00 0.00 H ATOM 4391 H2 WAT 8678 135.442 105.874 88.226 1.00 0.00 H TER 4393 WAT 8678 ATOM 4393 O WAT 8679 112.938 58.510 122.519 1.00 0.00 O ATOM 4394 H1 WAT 8679 113.136 57.738 121.989 1.00 0.00 H ATOM 4395 H2 WAT 8679 112.105 58.303 122.942 1.00 0.00 H TER 4397 WAT 8679 ATOM 4397 O WAT 8680 125.994 79.095 109.339 1.00 0.00 O ATOM 4398 H1 WAT 8680 125.887 78.715 108.466 1.00 0.00 H ATOM 4399 H2 WAT 8680 125.352 79.803 109.372 1.00 0.00 H TER 4401 WAT 8680 ATOM 4401 O WAT 8681 0.305 126.522 120.483 1.00 0.00 O ATOM 4402 H1 WAT 8681 1.240 126.717 120.418 1.00 0.00 H ATOM 4403 H2 WAT 8681 0.189 125.728 119.961 1.00 0.00 H TER 4405 WAT 8681 ATOM 4405 O WAT 8682 87.970 58.486 138.520 1.00 0.00 O ATOM 4406 H1 WAT 8682 88.231 57.915 139.243 1.00 0.00 H ATOM 4407 H2 WAT 8682 87.487 59.198 138.940 1.00 0.00 H TER 4409 WAT 8682 ATOM 4409 O WAT 8683 106.129 67.384 22.770 1.00 0.00 O ATOM 4410 H1 WAT 8683 106.225 67.620 23.693 1.00 0.00 H ATOM 4411 H2 WAT 8683 106.743 66.661 22.643 1.00 0.00 H TER 4413 WAT 8683 ATOM 4413 O WAT 8684 17.243 144.711 104.624 1.00 0.00 O ATOM 4414 H1 WAT 8684 17.671 144.945 105.448 1.00 0.00 H ATOM 4415 H2 WAT 8684 17.466 143.790 104.491 1.00 0.00 H TER 4417 WAT 8684 ATOM 4417 O WAT 8685 103.997 108.057 153.793 1.00 0.00 O ATOM 4418 H1 WAT 8685 104.512 108.129 154.596 1.00 0.00 H ATOM 4419 H2 WAT 8685 103.932 108.955 153.468 1.00 0.00 H TER 4421 WAT 8685 ATOM 4421 O WAT 8686 130.612 144.097 14.106 1.00 0.00 O ATOM 4422 H1 WAT 8686 129.937 144.100 13.428 1.00 0.00 H ATOM 4423 H2 WAT 8686 130.615 143.199 14.437 1.00 0.00 H TER 4425 WAT 8686 ATOM 4425 O WAT 8687 63.460 116.836 146.697 1.00 0.00 O ATOM 4426 H1 WAT 8687 63.875 116.253 147.333 1.00 0.00 H ATOM 4427 H2 WAT 8687 62.881 117.389 147.221 1.00 0.00 H TER 4429 WAT 8687 ATOM 4429 O WAT 8688 83.463 64.637 155.417 1.00 0.00 O ATOM 4430 H1 WAT 8688 83.378 63.742 155.089 1.00 0.00 H ATOM 4431 H2 WAT 8688 83.749 64.533 156.324 1.00 0.00 H TER 4433 WAT 8688 ATOM 4433 O WAT 8689 68.313 7.727 95.406 1.00 0.00 O ATOM 4434 H1 WAT 8689 68.945 7.072 95.110 1.00 0.00 H ATOM 4435 H2 WAT 8689 67.538 7.575 94.866 1.00 0.00 H TER 4437 WAT 8689 ATOM 4437 O WAT 8690 108.888 77.957 2.698 1.00 0.00 O ATOM 4438 H1 WAT 8690 108.241 77.252 2.692 1.00 0.00 H ATOM 4439 H2 WAT 8690 108.367 78.760 2.715 1.00 0.00 H TER 4441 WAT 8690 ATOM 4441 O WAT 8691 57.343 69.751 134.323 1.00 0.00 O ATOM 4442 H1 WAT 8691 57.650 70.535 133.867 1.00 0.00 H ATOM 4443 H2 WAT 8691 56.403 69.724 134.147 1.00 0.00 H TER 4445 WAT 8691 ATOM 4445 O WAT 8692 84.071 30.728 18.672 1.00 0.00 O ATOM 4446 H1 WAT 8692 84.867 30.269 18.943 1.00 0.00 H ATOM 4447 H2 WAT 8692 83.824 31.250 19.435 1.00 0.00 H TER 4449 WAT 8692 ATOM 4449 O WAT 8693 48.112 109.497 70.722 1.00 0.00 O ATOM 4450 H1 WAT 8693 47.324 109.945 70.414 1.00 0.00 H ATOM 4451 H2 WAT 8693 48.607 110.174 71.184 1.00 0.00 H TER 4453 WAT 8693 ATOM 4453 O WAT 8694 35.637 48.307 68.323 1.00 0.00 O ATOM 4454 H1 WAT 8694 35.952 48.656 67.489 1.00 0.00 H ATOM 4455 H2 WAT 8694 36.140 48.780 68.986 1.00 0.00 H TER 4457 WAT 8694 ATOM 4457 O WAT 8695 126.732 84.894 19.715 1.00 0.00 O ATOM 4458 H1 WAT 8695 127.472 85.325 20.143 1.00 0.00 H ATOM 4459 H2 WAT 8695 126.068 84.821 20.400 1.00 0.00 H TER 4461 WAT 8695 ATOM 4461 O WAT 8696 46.339 140.417 54.478 1.00 0.00 O ATOM 4462 H1 WAT 8696 45.586 140.941 54.206 1.00 0.00 H ATOM 4463 H2 WAT 8696 45.965 139.571 54.726 1.00 0.00 H TER 4465 WAT 8696 ATOM 4465 O WAT 8697 108.505 74.085 13.780 1.00 0.00 O ATOM 4466 H1 WAT 8697 108.774 74.422 12.925 1.00 0.00 H ATOM 4467 H2 WAT 8697 109.145 74.446 14.392 1.00 0.00 H TER 4469 WAT 8697 ATOM 4469 O WAT 8698 28.935 110.744 98.717 1.00 0.00 O ATOM 4470 H1 WAT 8698 28.627 110.987 97.844 1.00 0.00 H ATOM 4471 H2 WAT 8698 28.592 109.861 98.854 1.00 0.00 H TER 4473 WAT 8698 ATOM 4473 O WAT 8699 50.756 31.833 67.458 1.00 0.00 O ATOM 4474 H1 WAT 8699 51.440 31.789 68.126 1.00 0.00 H ATOM 4475 H2 WAT 8699 50.027 31.336 67.828 1.00 0.00 H TER 4477 WAT 8699 ATOM 4477 O WAT 8700 63.460 40.327 7.310 1.00 0.00 O ATOM 4478 H1 WAT 8700 64.407 40.267 7.183 1.00 0.00 H ATOM 4479 H2 WAT 8700 63.351 41.003 7.980 1.00 0.00 H TER 4481 WAT 8700 ATOM 4481 O WAT 8701 7.817 84.996 72.497 1.00 0.00 O ATOM 4482 H1 WAT 8701 7.655 85.058 71.556 1.00 0.00 H ATOM 4483 H2 WAT 8701 8.769 85.047 72.580 1.00 0.00 H TER 4485 WAT 8701 ATOM 4485 O WAT 8702 104.516 115.959 27.661 1.00 0.00 O ATOM 4486 H1 WAT 8702 103.714 115.566 27.316 1.00 0.00 H ATOM 4487 H2 WAT 8702 104.219 116.746 28.118 1.00 0.00 H TER 4489 WAT 8702 ATOM 4489 O WAT 8703 48.820 105.270 22.412 1.00 0.00 O ATOM 4490 H1 WAT 8703 49.116 104.434 22.052 1.00 0.00 H ATOM 4491 H2 WAT 8703 49.207 105.929 21.835 1.00 0.00 H TER 4493 WAT 8703 ATOM 4493 O WAT 8704 91.342 64.798 71.120 1.00 0.00 O ATOM 4494 H1 WAT 8704 90.884 64.064 70.711 1.00 0.00 H ATOM 4495 H2 WAT 8704 90.710 65.157 71.743 1.00 0.00 H TER 4497 WAT 8704 ATOM 4497 O WAT 8705 60.492 58.094 119.758 1.00 0.00 O ATOM 4498 H1 WAT 8705 59.721 58.222 120.310 1.00 0.00 H ATOM 4499 H2 WAT 8705 60.297 57.305 119.252 1.00 0.00 H TER 4501 WAT 8705 ATOM 4501 O WAT 8706 84.313 18.843 112.644 1.00 0.00 O ATOM 4502 H1 WAT 8706 83.568 19.294 113.041 1.00 0.00 H ATOM 4503 H2 WAT 8706 84.213 18.996 111.705 1.00 0.00 H TER 4505 WAT 8706 ATOM 4505 O WAT 8707 136.578 97.398 70.379 1.00 0.00 O ATOM 4506 H1 WAT 8707 136.922 97.349 69.487 1.00 0.00 H ATOM 4507 H2 WAT 8707 135.780 96.870 70.356 1.00 0.00 H TER 4509 WAT 8707 ATOM 4509 O WAT 8708 62.083 15.497 141.373 1.00 0.00 O ATOM 4510 H1 WAT 8708 61.971 14.703 140.851 1.00 0.00 H ATOM 4511 H2 WAT 8708 63.016 15.701 141.303 1.00 0.00 H TER 4513 WAT 8708 ATOM 4513 O WAT 8709 61.951 25.041 20.034 1.00 0.00 O ATOM 4514 H1 WAT 8709 61.421 24.520 20.638 1.00 0.00 H ATOM 4515 H2 WAT 8709 62.588 25.483 20.595 1.00 0.00 H TER 4517 WAT 8709 ATOM 4517 O WAT 8710 133.262 138.881 153.336 1.00 0.00 O ATOM 4518 H1 WAT 8710 133.412 139.752 152.970 1.00 0.00 H ATOM 4519 H2 WAT 8710 132.955 138.359 152.594 1.00 0.00 H TER 4521 WAT 8710 ATOM 4521 O WAT 8711 90.687 119.744 80.685 1.00 0.00 O ATOM 4522 H1 WAT 8711 90.423 120.421 81.308 1.00 0.00 H ATOM 4523 H2 WAT 8711 89.877 119.503 80.235 1.00 0.00 H TER 4525 WAT 8711 ATOM 4525 O WAT 8712 73.355 17.240 81.119 1.00 0.00 O ATOM 4526 H1 WAT 8712 73.815 17.442 80.305 1.00 0.00 H ATOM 4527 H2 WAT 8712 73.936 16.634 81.579 1.00 0.00 H TER 4529 WAT 8712 ATOM 4529 O WAT 8713 108.938 55.507 123.938 1.00 0.00 O ATOM 4530 H1 WAT 8713 109.062 55.733 124.860 1.00 0.00 H ATOM 4531 H2 WAT 8713 108.784 54.562 123.943 1.00 0.00 H TER 4533 WAT 8713 ATOM 4533 O WAT 8714 25.925 12.997 99.462 1.00 0.00 O ATOM 4534 H1 WAT 8714 26.729 12.730 99.908 1.00 0.00 H ATOM 4535 H2 WAT 8714 26.226 13.486 98.697 1.00 0.00 H TER 4537 WAT 8714 ATOM 4537 O WAT 8715 75.922 108.559 85.149 1.00 0.00 O ATOM 4538 H1 WAT 8715 76.445 109.292 84.824 1.00 0.00 H ATOM 4539 H2 WAT 8715 75.106 108.607 84.650 1.00 0.00 H TER 4541 WAT 8715 ATOM 4541 O WAT 8716 132.329 0.269 143.859 1.00 0.00 O ATOM 4542 H1 WAT 8716 132.683 -0.288 144.551 1.00 0.00 H ATOM 4543 H2 WAT 8716 132.692 1.136 144.040 1.00 0.00 H TER 4545 WAT 8716 ATOM 4545 O WAT 8717 124.030 129.594 124.972 1.00 0.00 O ATOM 4546 H1 WAT 8717 124.973 129.756 124.930 1.00 0.00 H ATOM 4547 H2 WAT 8717 123.646 130.272 124.417 1.00 0.00 H TER 4549 WAT 8717 ATOM 4549 O WAT 8718 87.386 23.703 81.922 1.00 0.00 O ATOM 4550 H1 WAT 8718 88.250 23.822 82.317 1.00 0.00 H ATOM 4551 H2 WAT 8718 86.907 23.165 82.553 1.00 0.00 H TER 4553 WAT 8718 ATOM 4553 O WAT 8719 138.435 56.794 53.463 1.00 0.00 O ATOM 4554 H1 WAT 8719 138.615 57.230 52.631 1.00 0.00 H ATOM 4555 H2 WAT 8719 139.111 56.120 53.532 1.00 0.00 H TER 4557 WAT 8719 ATOM 4557 O WAT 8720 114.389 30.181 129.495 1.00 0.00 O ATOM 4558 H1 WAT 8720 113.814 30.782 129.021 1.00 0.00 H ATOM 4559 H2 WAT 8720 115.026 30.750 129.926 1.00 0.00 H TER 4561 WAT 8720 ATOM 4561 O WAT 8721 15.111 138.281 140.291 1.00 0.00 O ATOM 4562 H1 WAT 8721 14.882 137.784 141.075 1.00 0.00 H ATOM 4563 H2 WAT 8721 16.051 138.444 140.377 1.00 0.00 H TER 4565 WAT 8721 ATOM 4565 O WAT 8722 81.616 61.291 7.451 1.00 0.00 O ATOM 4566 H1 WAT 8722 80.764 61.237 7.882 1.00 0.00 H ATOM 4567 H2 WAT 8722 81.425 61.659 6.588 1.00 0.00 H TER 4569 WAT 8722 ATOM 4569 O WAT 8723 125.628 40.649 83.238 1.00 0.00 O ATOM 4570 H1 WAT 8723 124.713 40.441 83.049 1.00 0.00 H ATOM 4571 H2 WAT 8723 125.992 40.918 82.395 1.00 0.00 H TER 4573 WAT 8723 ATOM 4573 O WAT 8724 21.446 21.715 155.088 1.00 0.00 O ATOM 4574 H1 WAT 8724 20.929 22.389 154.646 1.00 0.00 H ATOM 4575 H2 WAT 8724 22.078 22.204 155.614 1.00 0.00 H TER 4577 WAT 8724 ATOM 4577 O WAT 8725 99.225 53.436 2.723 1.00 0.00 O ATOM 4578 H1 WAT 8725 98.755 52.622 2.540 1.00 0.00 H ATOM 4579 H2 WAT 8725 99.495 53.356 3.638 1.00 0.00 H TER 4581 WAT 8725 ATOM 4581 O WAT 8726 144.755 95.015 25.857 1.00 0.00 O ATOM 4582 H1 WAT 8726 144.684 95.817 26.374 1.00 0.00 H ATOM 4583 H2 WAT 8726 144.737 94.310 26.504 1.00 0.00 H TER 4585 WAT 8726 ATOM 4585 O WAT 8727 77.452 90.747 134.941 1.00 0.00 O ATOM 4586 H1 WAT 8727 77.274 89.807 134.903 1.00 0.00 H ATOM 4587 H2 WAT 8727 77.807 90.888 135.818 1.00 0.00 H TER 4589 WAT 8727 ATOM 4589 O WAT 8728 8.358 130.956 18.882 1.00 0.00 O ATOM 4590 H1 WAT 8728 7.552 130.759 19.360 1.00 0.00 H ATOM 4591 H2 WAT 8728 9.059 130.661 19.464 1.00 0.00 H TER 4593 WAT 8728 ATOM 4593 O WAT 8729 122.038 125.581 141.180 1.00 0.00 O ATOM 4594 H1 WAT 8729 121.829 124.713 140.834 1.00 0.00 H ATOM 4595 H2 WAT 8729 122.294 126.090 140.411 1.00 0.00 H TER 4597 WAT 8729 ATOM 4597 O WAT 8730 98.031 84.022 80.995 1.00 0.00 O ATOM 4598 H1 WAT 8730 98.349 83.652 80.172 1.00 0.00 H ATOM 4599 H2 WAT 8730 98.426 84.894 81.035 1.00 0.00 H TER 4601 WAT 8730 ATOM 4601 O WAT 8731 57.204 135.356 5.925 1.00 0.00 O ATOM 4602 H1 WAT 8731 57.420 136.287 5.975 1.00 0.00 H ATOM 4603 H2 WAT 8731 57.341 135.030 6.815 1.00 0.00 H TER 4605 WAT 8731 ATOM 4605 O WAT 8732 65.551 97.397 15.477 1.00 0.00 O ATOM 4606 H1 WAT 8732 66.329 97.906 15.249 1.00 0.00 H ATOM 4607 H2 WAT 8732 64.936 98.042 15.825 1.00 0.00 H TER 4609 WAT 8732 ATOM 4609 O WAT 8733 96.475 94.975 153.856 1.00 0.00 O ATOM 4610 H1 WAT 8733 96.643 94.167 154.342 1.00 0.00 H ATOM 4611 H2 WAT 8733 95.706 95.355 154.280 1.00 0.00 H TER 4613 WAT 8733 ATOM 4613 O WAT 8734 105.732 21.049 89.269 1.00 0.00 O ATOM 4614 H1 WAT 8734 105.602 20.637 90.123 1.00 0.00 H ATOM 4615 H2 WAT 8734 106.665 21.262 89.245 1.00 0.00 H TER 4617 WAT 8734 ATOM 4617 O WAT 8735 7.239 4.820 12.197 1.00 0.00 O ATOM 4618 H1 WAT 8735 6.712 4.091 11.871 1.00 0.00 H ATOM 4619 H2 WAT 8735 6.713 5.598 12.011 1.00 0.00 H TER 4621 WAT 8735 ATOM 4621 O WAT 8736 32.814 14.405 6.785 1.00 0.00 O ATOM 4622 H1 WAT 8736 33.649 14.104 7.142 1.00 0.00 H ATOM 4623 H2 WAT 8736 32.723 13.934 5.956 1.00 0.00 H TER 4625 WAT 8736 ATOM 4625 O WAT 8737 41.324 106.468 140.290 1.00 0.00 O ATOM 4626 H1 WAT 8737 40.956 105.737 139.795 1.00 0.00 H ATOM 4627 H2 WAT 8737 40.905 107.245 139.918 1.00 0.00 H TER 4629 WAT 8737 ATOM 4629 O WAT 8738 0.072 25.478 10.072 1.00 0.00 O ATOM 4630 H1 WAT 8738 -0.488 25.392 10.843 1.00 0.00 H ATOM 4631 H2 WAT 8738 0.856 25.923 10.393 1.00 0.00 H TER 4633 WAT 8738 ATOM 4633 O WAT 8739 31.544 104.986 74.216 1.00 0.00 O ATOM 4634 H1 WAT 8739 31.997 104.147 74.304 1.00 0.00 H ATOM 4635 H2 WAT 8739 30.792 104.795 73.656 1.00 0.00 H TER 4637 WAT 8739 ATOM 4637 O WAT 8740 119.923 72.074 76.630 1.00 0.00 O ATOM 4638 H1 WAT 8740 120.750 72.381 76.261 1.00 0.00 H ATOM 4639 H2 WAT 8740 120.180 71.509 77.359 1.00 0.00 H TER 4641 WAT 8740 ATOM 4641 O WAT 8741 138.780 7.806 85.470 1.00 0.00 O ATOM 4642 H1 WAT 8741 138.675 6.946 85.876 1.00 0.00 H ATOM 4643 H2 WAT 8741 139.266 8.319 86.116 1.00 0.00 H TER 4645 WAT 8741 ATOM 4645 O WAT 8742 102.243 38.372 23.356 1.00 0.00 O ATOM 4646 H1 WAT 8742 102.966 38.429 22.731 1.00 0.00 H ATOM 4647 H2 WAT 8742 102.647 38.047 24.161 1.00 0.00 H TER 4649 WAT 8742 ATOM 4649 O WAT 8743 44.385 52.388 100.349 1.00 0.00 O ATOM 4650 H1 WAT 8743 44.510 52.240 99.412 1.00 0.00 H ATOM 4651 H2 WAT 8743 45.120 52.947 100.603 1.00 0.00 H TER 4653 WAT 8743 ATOM 4653 O WAT 8744 38.995 9.798 123.681 1.00 0.00 O ATOM 4654 H1 WAT 8744 39.109 8.931 124.070 1.00 0.00 H ATOM 4655 H2 WAT 8744 38.395 10.249 124.274 1.00 0.00 H TER 4657 WAT 8744 ATOM 4657 O WAT 8745 100.875 77.586 75.047 1.00 0.00 O ATOM 4658 H1 WAT 8745 100.985 77.350 74.126 1.00 0.00 H ATOM 4659 H2 WAT 8745 101.287 78.446 75.126 1.00 0.00 H TER 4661 WAT 8745 ATOM 4661 O WAT 8746 102.359 50.295 152.342 1.00 0.00 O ATOM 4662 H1 WAT 8746 103.086 50.879 152.126 1.00 0.00 H ATOM 4663 H2 WAT 8746 101.937 50.708 153.096 1.00 0.00 H TER 4665 WAT 8746 ATOM 4665 O WAT 8747 72.975 69.712 93.113 1.00 0.00 O ATOM 4666 H1 WAT 8747 72.108 69.508 92.764 1.00 0.00 H ATOM 4667 H2 WAT 8747 73.507 68.946 92.897 1.00 0.00 H TER 4669 WAT 8747 ATOM 4669 O WAT 8748 39.768 137.452 1.152 1.00 0.00 O ATOM 4670 H1 WAT 8748 39.647 137.285 0.217 1.00 0.00 H ATOM 4671 H2 WAT 8748 38.894 137.350 1.528 1.00 0.00 H TER 4673 WAT 8748 ATOM 4673 O WAT 8749 82.653 4.654 84.788 1.00 0.00 O ATOM 4674 H1 WAT 8749 82.840 3.877 85.315 1.00 0.00 H ATOM 4675 H2 WAT 8749 81.745 4.540 84.507 1.00 0.00 H TER 4677 WAT 8749 ATOM 4677 O WAT 8750 92.405 129.546 62.389 1.00 0.00 O ATOM 4678 H1 WAT 8750 91.469 129.622 62.571 1.00 0.00 H ATOM 4679 H2 WAT 8750 92.489 129.776 61.464 1.00 0.00 H TER 4681 WAT 8750 ATOM 4681 O WAT 8751 55.666 40.449 102.250 1.00 0.00 O ATOM 4682 H1 WAT 8751 55.103 40.942 102.847 1.00 0.00 H ATOM 4683 H2 WAT 8751 56.434 41.007 102.130 1.00 0.00 H TER 4685 WAT 8751 ATOM 4685 O WAT 8752 134.140 16.356 86.734 1.00 0.00 O ATOM 4686 H1 WAT 8752 134.659 17.121 86.983 1.00 0.00 H ATOM 4687 H2 WAT 8752 134.392 15.680 87.363 1.00 0.00 H TER 4689 WAT 8752 ATOM 4689 O WAT 8753 137.759 131.284 129.572 1.00 0.00 O ATOM 4690 H1 WAT 8753 138.602 131.293 130.025 1.00 0.00 H ATOM 4691 H2 WAT 8753 137.233 130.649 130.058 1.00 0.00 H TER 4693 WAT 8753 ATOM 4693 O WAT 8754 56.252 64.410 153.923 1.00 0.00 O ATOM 4694 H1 WAT 8754 57.202 64.289 153.919 1.00 0.00 H ATOM 4695 H2 WAT 8754 55.928 63.786 153.274 1.00 0.00 H TER 4697 WAT 8754 ATOM 4697 O WAT 8755 79.092 21.397 92.030 1.00 0.00 O ATOM 4698 H1 WAT 8755 79.813 21.166 92.615 1.00 0.00 H ATOM 4699 H2 WAT 8755 79.074 20.693 91.382 1.00 0.00 H TER 4701 WAT 8755 ATOM 4701 O WAT 8756 6.476 128.007 91.668 1.00 0.00 O ATOM 4702 H1 WAT 8756 5.995 127.192 91.807 1.00 0.00 H ATOM 4703 H2 WAT 8756 7.184 127.981 92.312 1.00 0.00 H TER 4705 WAT 8756 ATOM 4705 O WAT 8757 29.022 76.281 130.763 1.00 0.00 O ATOM 4706 H1 WAT 8757 29.633 76.314 131.499 1.00 0.00 H ATOM 4707 H2 WAT 8757 28.311 76.869 131.016 1.00 0.00 H TER 4709 WAT 8757 ATOM 4709 O WAT 8758 62.928 104.081 22.136 1.00 0.00 O ATOM 4710 H1 WAT 8758 62.083 104.007 21.692 1.00 0.00 H ATOM 4711 H2 WAT 8758 63.558 103.717 21.515 1.00 0.00 H TER 4713 WAT 8758 ATOM 4713 O WAT 8759 48.806 31.727 19.135 1.00 0.00 O ATOM 4714 H1 WAT 8759 48.474 31.202 19.862 1.00 0.00 H ATOM 4715 H2 WAT 8759 48.794 32.626 19.463 1.00 0.00 H TER 4717 WAT 8759 ATOM 4717 O WAT 8760 105.345 68.272 95.535 1.00 0.00 O ATOM 4718 H1 WAT 8760 105.349 69.165 95.880 1.00 0.00 H ATOM 4719 H2 WAT 8760 106.073 67.840 95.982 1.00 0.00 H TER 4721 WAT 8760 ATOM 4721 O WAT 8761 25.525 37.440 5.970 1.00 0.00 O ATOM 4722 H1 WAT 8761 25.040 38.264 5.920 1.00 0.00 H ATOM 4723 H2 WAT 8761 26.374 37.684 6.337 1.00 0.00 H TER 4725 WAT 8761 ATOM 4725 O WAT 8762 104.150 97.112 13.320 1.00 0.00 O ATOM 4726 H1 WAT 8762 104.514 96.415 13.866 1.00 0.00 H ATOM 4727 H2 WAT 8762 103.550 96.661 12.725 1.00 0.00 H TER 4729 WAT 8762 ATOM 4729 O WAT 8763 113.741 31.385 95.154 1.00 0.00 O ATOM 4730 H1 WAT 8763 113.593 31.452 94.210 1.00 0.00 H ATOM 4731 H2 WAT 8763 113.505 32.247 95.495 1.00 0.00 H TER 4733 WAT 8763 ATOM 4733 O WAT 8764 42.349 121.914 100.134 1.00 0.00 O ATOM 4734 H1 WAT 8764 42.328 121.466 100.980 1.00 0.00 H ATOM 4735 H2 WAT 8764 42.811 122.734 100.309 1.00 0.00 H TER 4737 WAT 8764 ATOM 4737 O WAT 8765 27.298 37.212 63.088 1.00 0.00 O ATOM 4738 H1 WAT 8765 27.778 37.714 63.747 1.00 0.00 H ATOM 4739 H2 WAT 8765 27.222 37.808 62.342 1.00 0.00 H TER 4741 WAT 8765 ATOM 4741 O WAT 8766 12.941 23.771 22.985 1.00 0.00 O ATOM 4742 H1 WAT 8766 12.580 23.404 23.792 1.00 0.00 H ATOM 4743 H2 WAT 8766 12.432 24.568 22.835 1.00 0.00 H TER 4745 WAT 8766 ATOM 4745 O WAT 8767 53.195 76.185 11.821 1.00 0.00 O ATOM 4746 H1 WAT 8767 52.814 75.814 12.617 1.00 0.00 H ATOM 4747 H2 WAT 8767 53.666 75.455 11.419 1.00 0.00 H TER 4749 WAT 8767 ATOM 4749 O WAT 8768 135.485 138.746 78.735 1.00 0.00 O ATOM 4750 H1 WAT 8768 136.307 138.287 78.905 1.00 0.00 H ATOM 4751 H2 WAT 8768 135.025 138.191 78.105 1.00 0.00 H TER 4753 WAT 8768 ATOM 4753 O WAT 8769 55.989 52.540 26.275 1.00 0.00 O ATOM 4754 H1 WAT 8769 56.177 53.479 26.299 1.00 0.00 H ATOM 4755 H2 WAT 8769 55.686 52.334 27.159 1.00 0.00 H TER 4757 WAT 8769 ATOM 4757 O WAT 8770 30.884 69.234 119.224 1.00 0.00 O ATOM 4758 H1 WAT 8770 30.153 69.467 119.796 1.00 0.00 H ATOM 4759 H2 WAT 8770 30.758 69.773 118.443 1.00 0.00 H TER 4761 WAT 8770 ATOM 4761 O WAT 8771 133.973 2.835 76.503 1.00 0.00 O ATOM 4762 H1 WAT 8771 134.232 1.970 76.820 1.00 0.00 H ATOM 4763 H2 WAT 8771 133.885 3.364 77.296 1.00 0.00 H TER 4765 WAT 8771 ATOM 4765 O WAT 8772 3.856 11.518 102.709 1.00 0.00 O ATOM 4766 H1 WAT 8772 4.539 11.242 102.097 1.00 0.00 H ATOM 4767 H2 WAT 8772 4.096 11.104 103.538 1.00 0.00 H TER 4769 WAT 8772 ATOM 4769 O WAT 8773 102.371 109.293 77.906 1.00 0.00 O ATOM 4770 H1 WAT 8773 103.036 109.497 77.249 1.00 0.00 H ATOM 4771 H2 WAT 8773 101.601 109.791 77.631 1.00 0.00 H TER 4773 WAT 8773 ATOM 4773 O WAT 8774 112.743 118.200 87.575 1.00 0.00 O ATOM 4774 H1 WAT 8774 111.926 117.799 87.871 1.00 0.00 H ATOM 4775 H2 WAT 8774 113.349 117.465 87.477 1.00 0.00 H TER 4777 WAT 8774 ATOM 4777 O WAT 8775 75.961 86.788 71.097 1.00 0.00 O ATOM 4778 H1 WAT 8775 76.749 86.457 70.667 1.00 0.00 H ATOM 4779 H2 WAT 8775 75.897 87.700 70.811 1.00 0.00 H TER 4781 WAT 8775 ATOM 4781 O WAT 8776 85.607 94.846 155.529 1.00 0.00 O ATOM 4782 H1 WAT 8776 86.189 94.371 156.122 1.00 0.00 H ATOM 4783 H2 WAT 8776 84.786 94.354 155.556 1.00 0.00 H TER 4785 WAT 8776 ATOM 4785 O WAT 8777 28.241 62.185 120.595 1.00 0.00 O ATOM 4786 H1 WAT 8777 28.666 63.042 120.609 1.00 0.00 H ATOM 4787 H2 WAT 8777 27.607 62.244 119.880 1.00 0.00 H TER 4789 WAT 8777 ATOM 4789 O WAT 8778 90.518 101.808 78.422 1.00 0.00 O ATOM 4790 H1 WAT 8778 90.390 102.538 79.028 1.00 0.00 H ATOM 4791 H2 WAT 8778 89.738 101.819 77.867 1.00 0.00 H TER 4793 WAT 8778 ATOM 4793 O WAT 8779 106.226 49.983 113.821 1.00 0.00 O ATOM 4794 H1 WAT 8779 106.246 50.769 113.275 1.00 0.00 H ATOM 4795 H2 WAT 8779 107.148 49.771 113.970 1.00 0.00 H TER 4797 WAT 8779 ATOM 4797 O WAT 8780 126.241 86.117 95.359 1.00 0.00 O ATOM 4798 H1 WAT 8780 126.619 85.310 95.709 1.00 0.00 H ATOM 4799 H2 WAT 8780 125.500 85.823 94.828 1.00 0.00 H TER 4801 WAT 8780 ATOM 4801 O WAT 8781 47.254 40.541 16.295 1.00 0.00 O ATOM 4802 H1 WAT 8781 47.114 40.966 17.142 1.00 0.00 H ATOM 4803 H2 WAT 8781 48.171 40.266 16.315 1.00 0.00 H TER 4805 WAT 8781 ATOM 4805 O WAT 8782 137.543 93.143 12.106 1.00 0.00 O ATOM 4806 H1 WAT 8782 138.193 93.079 11.407 1.00 0.00 H ATOM 4807 H2 WAT 8782 137.339 94.077 12.160 1.00 0.00 H TER 4809 WAT 8782 ATOM 4809 O WAT 8783 125.733 48.210 105.796 1.00 0.00 O ATOM 4810 H1 WAT 8783 125.408 48.427 106.669 1.00 0.00 H ATOM 4811 H2 WAT 8783 126.663 48.024 105.926 1.00 0.00 H TER 4813 WAT 8783 ATOM 4813 O WAT 8784 133.972 19.280 15.808 1.00 0.00 O ATOM 4814 H1 WAT 8784 134.499 19.847 16.370 1.00 0.00 H ATOM 4815 H2 WAT 8784 133.391 18.816 16.412 1.00 0.00 H TER 4817 WAT 8784 ATOM 4817 O WAT 8785 18.602 115.388 116.447 1.00 0.00 O ATOM 4818 H1 WAT 8785 19.444 115.816 116.293 1.00 0.00 H ATOM 4819 H2 WAT 8785 18.680 115.016 117.325 1.00 0.00 H TER 4821 WAT 8785 ATOM 4821 O WAT 8786 23.624 1.567 5.689 1.00 0.00 O ATOM 4822 H1 WAT 8786 24.202 2.315 5.845 1.00 0.00 H ATOM 4823 H2 WAT 8786 23.604 1.102 6.526 1.00 0.00 H TER 4825 WAT 8786 ATOM 4825 O WAT 8787 132.330 106.097 126.247 1.00 0.00 O ATOM 4826 H1 WAT 8787 131.926 105.935 125.394 1.00 0.00 H ATOM 4827 H2 WAT 8787 132.099 107.002 126.454 1.00 0.00 H TER 4829 WAT 8787 ATOM 4829 O WAT 8788 49.043 61.540 82.718 1.00 0.00 O ATOM 4830 H1 WAT 8788 49.001 62.482 82.881 1.00 0.00 H ATOM 4831 H2 WAT 8788 48.284 61.358 82.164 1.00 0.00 H TER 4833 WAT 8788 ATOM 4833 O WAT 8789 55.908 68.730 102.179 1.00 0.00 O ATOM 4834 H1 WAT 8789 56.000 69.455 101.562 1.00 0.00 H ATOM 4835 H2 WAT 8789 54.978 68.503 102.145 1.00 0.00 H TER 4837 WAT 8789 ATOM 4837 O WAT 8790 88.281 21.793 121.976 1.00 0.00 O ATOM 4838 H1 WAT 8790 88.947 21.156 122.234 1.00 0.00 H ATOM 4839 H2 WAT 8790 88.155 21.642 121.039 1.00 0.00 H TER 4841 WAT 8790 ATOM 4841 O WAT 8791 130.590 91.617 6.259 1.00 0.00 O ATOM 4842 H1 WAT 8791 129.995 91.076 5.739 1.00 0.00 H ATOM 4843 H2 WAT 8791 130.103 92.427 6.415 1.00 0.00 H TER 4845 WAT 8791 ATOM 4845 O WAT 8792 52.581 63.798 110.310 1.00 0.00 O ATOM 4846 H1 WAT 8792 52.466 64.660 109.910 1.00 0.00 H ATOM 4847 H2 WAT 8792 51.692 63.511 110.519 1.00 0.00 H TER 4849 WAT 8792 ATOM 4849 O WAT 8793 47.839 60.552 128.394 1.00 0.00 O ATOM 4850 H1 WAT 8793 48.663 60.715 128.853 1.00 0.00 H ATOM 4851 H2 WAT 8793 47.200 61.103 128.846 1.00 0.00 H TER 4853 WAT 8793 ATOM 4853 O WAT 8794 144.217 40.687 158.005 1.00 0.00 O ATOM 4854 H1 WAT 8794 144.548 40.173 158.742 1.00 0.00 H ATOM 4855 H2 WAT 8794 144.334 40.118 157.244 1.00 0.00 H TER 4857 WAT 8794 ATOM 4857 O WAT 8795 8.469 32.335 15.757 1.00 0.00 O ATOM 4858 H1 WAT 8795 8.003 32.779 16.466 1.00 0.00 H ATOM 4859 H2 WAT 8795 7.798 31.812 15.319 1.00 0.00 H TER 4861 WAT 8795 ATOM 4861 O WAT 8796 47.142 50.864 113.808 1.00 0.00 O ATOM 4862 H1 WAT 8796 46.316 50.515 114.141 1.00 0.00 H ATOM 4863 H2 WAT 8796 47.511 50.151 113.286 1.00 0.00 H TER 4865 WAT 8796 ATOM 4865 O WAT 8797 66.722 110.913 158.020 1.00 0.00 O ATOM 4866 H1 WAT 8797 65.876 111.115 157.622 1.00 0.00 H ATOM 4867 H2 WAT 8797 67.359 111.378 157.477 1.00 0.00 H TER 4869 WAT 8797 ATOM 4869 O WAT 8798 122.341 34.250 62.667 1.00 0.00 O ATOM 4870 H1 WAT 8798 122.167 34.289 63.607 1.00 0.00 H ATOM 4871 H2 WAT 8798 122.199 35.145 62.360 1.00 0.00 H TER 4873 WAT 8798 ATOM 4873 O WAT 8799 76.511 65.636 13.132 1.00 0.00 O ATOM 4874 H1 WAT 8799 76.244 64.894 13.674 1.00 0.00 H ATOM 4875 H2 WAT 8799 77.319 65.951 13.539 1.00 0.00 H TER 4877 WAT 8799 ATOM 4877 O WAT 8800 12.714 31.509 107.031 1.00 0.00 O ATOM 4878 H1 WAT 8800 12.976 31.811 107.901 1.00 0.00 H ATOM 4879 H2 WAT 8800 13.433 31.774 106.458 1.00 0.00 H TER 4881 WAT 8800 ATOM 4881 O WAT 8801 123.403 133.912 85.943 1.00 0.00 O ATOM 4882 H1 WAT 8801 124.332 133.830 86.157 1.00 0.00 H ATOM 4883 H2 WAT 8801 123.007 134.280 86.732 1.00 0.00 H TER 4885 WAT 8801 ATOM 4885 O WAT 8802 19.396 22.737 4.293 1.00 0.00 O ATOM 4886 H1 WAT 8802 19.251 23.644 4.561 1.00 0.00 H ATOM 4887 H2 WAT 8802 19.258 22.226 5.091 1.00 0.00 H TER 4889 WAT 8802 ATOM 4889 O WAT 8803 47.527 16.951 58.801 1.00 0.00 O ATOM 4890 H1 WAT 8803 46.611 16.839 58.549 1.00 0.00 H ATOM 4891 H2 WAT 8803 47.777 17.796 58.428 1.00 0.00 H TER 4893 WAT 8803 ATOM 4893 O WAT 8804 86.806 63.523 138.414 1.00 0.00 O ATOM 4894 H1 WAT 8804 87.586 63.210 138.872 1.00 0.00 H ATOM 4895 H2 WAT 8804 87.134 64.186 137.807 1.00 0.00 H TER 4897 WAT 8804 ATOM 4897 O WAT 8805 28.892 130.253 88.636 1.00 0.00 O ATOM 4898 H1 WAT 8805 28.381 130.593 87.901 1.00 0.00 H ATOM 4899 H2 WAT 8805 28.330 129.586 89.030 1.00 0.00 H TER 4901 WAT 8805 ATOM 4901 O WAT 8806 107.955 100.051 140.312 1.00 0.00 O ATOM 4902 H1 WAT 8806 107.477 100.200 139.496 1.00 0.00 H ATOM 4903 H2 WAT 8806 107.305 100.195 141.000 1.00 0.00 H TER 4905 WAT 8806 ATOM 4905 O WAT 8807 51.965 122.596 66.631 1.00 0.00 O ATOM 4906 H1 WAT 8807 52.664 121.943 66.605 1.00 0.00 H ATOM 4907 H2 WAT 8807 52.315 123.299 67.179 1.00 0.00 H TER 4909 WAT 8807 ATOM 4909 O WAT 8808 110.158 16.410 118.303 1.00 0.00 O ATOM 4910 H1 WAT 8808 110.565 17.276 118.312 1.00 0.00 H ATOM 4911 H2 WAT 8808 110.893 15.799 118.257 1.00 0.00 H TER 4913 WAT 8808 ATOM 4913 O WAT 8809 39.460 106.733 87.931 1.00 0.00 O ATOM 4914 H1 WAT 8809 39.251 107.495 88.471 1.00 0.00 H ATOM 4915 H2 WAT 8809 38.608 106.359 87.705 1.00 0.00 H TER 4917 WAT 8809 ATOM 4917 O WAT 8810 125.753 116.631 16.750 1.00 0.00 O ATOM 4918 H1 WAT 8810 125.037 116.341 17.315 1.00 0.00 H ATOM 4919 H2 WAT 8810 126.472 116.823 17.352 1.00 0.00 H TER 4921 WAT 8810 ATOM 4921 O WAT 8811 139.802 77.453 123.291 1.00 0.00 O ATOM 4922 H1 WAT 8811 139.085 76.845 123.476 1.00 0.00 H ATOM 4923 H2 WAT 8811 139.844 78.015 124.065 1.00 0.00 H TER 4925 WAT 8811 ATOM 4925 O WAT 8812 124.472 10.887 111.348 1.00 0.00 O ATOM 4926 H1 WAT 8812 124.532 10.104 110.801 1.00 0.00 H ATOM 4927 H2 WAT 8812 124.483 11.615 110.725 1.00 0.00 H TER 4929 WAT 8812 ATOM 4929 O WAT 8813 143.675 36.471 87.515 1.00 0.00 O ATOM 4930 H1 WAT 8813 143.853 35.819 86.837 1.00 0.00 H ATOM 4931 H2 WAT 8813 144.023 36.083 88.318 1.00 0.00 H TER 4933 WAT 8813 ATOM 4933 O WAT 8814 109.596 23.274 13.043 1.00 0.00 O ATOM 4934 H1 WAT 8814 110.539 23.287 12.879 1.00 0.00 H ATOM 4935 H2 WAT 8814 109.520 23.222 13.996 1.00 0.00 H TER 4937 WAT 8814 ATOM 4937 O WAT 8815 5.058 70.522 120.909 1.00 0.00 O ATOM 4938 H1 WAT 8815 4.490 70.158 120.230 1.00 0.00 H ATOM 4939 H2 WAT 8815 5.048 69.868 121.607 1.00 0.00 H TER 4941 WAT 8815 ATOM 4941 O WAT 8816 18.999 94.547 12.354 1.00 0.00 O ATOM 4942 H1 WAT 8816 18.084 94.801 12.233 1.00 0.00 H ATOM 4943 H2 WAT 8816 18.955 93.697 12.793 1.00 0.00 H TER 4945 WAT 8816 ATOM 4945 O WAT 8817 7.712 84.278 110.329 1.00 0.00 O ATOM 4946 H1 WAT 8817 8.059 84.274 111.221 1.00 0.00 H ATOM 4947 H2 WAT 8817 7.367 83.394 110.201 1.00 0.00 H TER 4949 WAT 8817 ATOM 4949 O WAT 8818 130.517 36.936 107.317 1.00 0.00 O ATOM 4950 H1 WAT 8818 130.129 36.484 108.067 1.00 0.00 H ATOM 4951 H2 WAT 8818 129.902 36.783 106.600 1.00 0.00 H TER 4953 WAT 8818 ATOM 4953 O WAT 8819 111.854 115.630 111.141 1.00 0.00 O ATOM 4954 H1 WAT 8819 111.954 115.971 110.252 1.00 0.00 H ATOM 4955 H2 WAT 8819 110.987 115.929 111.416 1.00 0.00 H TER 4957 WAT 8819 ATOM 4957 O WAT 8820 17.313 41.819 71.014 1.00 0.00 O ATOM 4958 H1 WAT 8820 17.004 40.987 71.374 1.00 0.00 H ATOM 4959 H2 WAT 8820 17.316 42.417 71.762 1.00 0.00 H TER 4961 WAT 8820 ATOM 4961 O WAT 8821 31.213 28.943 95.402 1.00 0.00 O ATOM 4962 H1 WAT 8821 31.507 28.288 96.035 1.00 0.00 H ATOM 4963 H2 WAT 8821 30.367 29.238 95.739 1.00 0.00 H TER 4965 WAT 8821 ATOM 4965 O WAT 8822 116.184 78.180 70.048 1.00 0.00 O ATOM 4966 H1 WAT 8822 115.565 78.880 70.256 1.00 0.00 H ATOM 4967 H2 WAT 8822 115.688 77.580 69.490 1.00 0.00 H TER 4969 WAT 8822 ATOM 4969 O WAT 8823 29.925 120.032 17.856 1.00 0.00 O ATOM 4970 H1 WAT 8823 29.924 119.924 18.807 1.00 0.00 H ATOM 4971 H2 WAT 8823 29.907 119.139 17.513 1.00 0.00 H TER 4973 WAT 8823 ATOM 4973 O WAT 8824 137.009 41.158 113.311 1.00 0.00 O ATOM 4974 H1 WAT 8824 136.201 41.670 113.272 1.00 0.00 H ATOM 4975 H2 WAT 8824 136.999 40.632 112.512 1.00 0.00 H TER 4977 WAT 8824 ATOM 4977 O WAT 8825 16.365 66.409 83.210 1.00 0.00 O ATOM 4978 H1 WAT 8825 17.181 66.825 82.932 1.00 0.00 H ATOM 4979 H2 WAT 8825 15.779 67.140 83.406 1.00 0.00 H TER 4981 WAT 8825 ATOM 4981 O WAT 8826 66.551 98.289 125.629 1.00 0.00 O ATOM 4982 H1 WAT 8826 67.266 97.653 125.659 1.00 0.00 H ATOM 4983 H2 WAT 8826 65.865 97.905 126.174 1.00 0.00 H TER 4985 WAT 8826 ATOM 4985 O WAT 8827 142.151 35.747 59.501 1.00 0.00 O ATOM 4986 H1 WAT 8827 141.887 35.182 58.775 1.00 0.00 H ATOM 4987 H2 WAT 8827 142.703 36.416 59.095 1.00 0.00 H TER 4989 WAT 8827 ATOM 4989 O WAT 8828 22.901 141.401 115.107 1.00 0.00 O ATOM 4990 H1 WAT 8828 22.903 140.789 114.370 1.00 0.00 H ATOM 4991 H2 WAT 8828 22.831 140.843 115.881 1.00 0.00 H TER 4993 WAT 8828 ATOM 4993 O WAT 8829 90.915 77.527 67.614 1.00 0.00 O ATOM 4994 H1 WAT 8829 89.974 77.565 67.446 1.00 0.00 H ATOM 4995 H2 WAT 8829 91.064 78.188 68.290 1.00 0.00 H TER 4997 WAT 8829 ATOM 4997 O WAT 8830 54.472 64.323 100.633 1.00 0.00 O ATOM 4998 H1 WAT 8830 53.578 64.527 100.357 1.00 0.00 H ATOM 4999 H2 WAT 8830 54.466 64.463 101.580 1.00 0.00 H TER 5001 WAT 8830 ATOM 5001 O WAT 8831 59.703 115.330 113.299 1.00 0.00 O ATOM 5002 H1 WAT 8831 60.378 114.741 113.636 1.00 0.00 H ATOM 5003 H2 WAT 8831 59.004 114.747 113.001 1.00 0.00 H TER 5005 WAT 8831 ATOM 5005 O WAT 8832 32.508 34.704 142.860 1.00 0.00 O ATOM 5006 H1 WAT 8832 32.263 35.606 142.651 1.00 0.00 H ATOM 5007 H2 WAT 8832 32.796 34.335 142.026 1.00 0.00 H TER 5009 WAT 8832 ATOM 5009 O WAT 8833 111.798 61.561 130.859 1.00 0.00 O ATOM 5010 H1 WAT 8833 112.317 62.243 130.433 1.00 0.00 H ATOM 5011 H2 WAT 8833 111.489 61.965 131.670 1.00 0.00 H TER 5013 WAT 8833 ATOM 5013 O WAT 8834 14.006 136.809 117.644 1.00 0.00 O ATOM 5014 H1 WAT 8834 14.801 137.247 117.948 1.00 0.00 H ATOM 5015 H2 WAT 8834 13.774 137.267 116.836 1.00 0.00 H TER 5017 WAT 8834 ATOM 5017 O WAT 8835 75.251 47.851 60.439 1.00 0.00 O ATOM 5018 H1 WAT 8835 75.522 48.382 61.188 1.00 0.00 H ATOM 5019 H2 WAT 8835 76.012 47.302 60.247 1.00 0.00 H TER 5021 WAT 8835 ATOM 5021 O WAT 8836 26.799 143.002 8.441 1.00 0.00 O ATOM 5022 H1 WAT 8836 27.398 143.554 8.944 1.00 0.00 H ATOM 5023 H2 WAT 8836 26.733 143.434 7.590 1.00 0.00 H TER 5025 WAT 8836 ATOM 5025 O WAT 8837 62.076 26.744 66.869 1.00 0.00 O ATOM 5026 H1 WAT 8837 62.517 27.245 66.183 1.00 0.00 H ATOM 5027 H2 WAT 8837 62.787 26.342 67.368 1.00 0.00 H TER 5029 WAT 8837 ATOM 5029 O WAT 8838 105.938 84.725 73.555 1.00 0.00 O ATOM 5030 H1 WAT 8838 105.448 85.538 73.435 1.00 0.00 H ATOM 5031 H2 WAT 8838 105.913 84.567 74.499 1.00 0.00 H TER 5033 WAT 8838 ATOM 5033 O WAT 8839 111.437 37.656 135.894 1.00 0.00 O ATOM 5034 H1 WAT 8839 111.922 37.549 136.713 1.00 0.00 H ATOM 5035 H2 WAT 8839 110.560 37.327 136.091 1.00 0.00 H TER 5037 WAT 8839 ATOM 5037 O WAT 8840 67.426 99.664 73.643 1.00 0.00 O ATOM 5038 H1 WAT 8840 68.128 99.626 74.292 1.00 0.00 H ATOM 5039 H2 WAT 8840 66.622 99.688 74.161 1.00 0.00 H TER 5041 WAT 8840 ATOM 5041 O WAT 8841 115.408 22.841 54.391 1.00 0.00 O ATOM 5042 H1 WAT 8841 115.685 22.044 53.940 1.00 0.00 H ATOM 5043 H2 WAT 8841 115.841 23.549 53.913 1.00 0.00 H TER 5045 WAT 8841 ATOM 5045 O WAT 8842 49.172 75.013 139.697 1.00 0.00 O ATOM 5046 H1 WAT 8842 48.538 74.296 139.733 1.00 0.00 H ATOM 5047 H2 WAT 8842 49.839 74.774 140.341 1.00 0.00 H TER 5049 WAT 8842 ATOM 5049 O WAT 8843 53.560 138.924 75.732 1.00 0.00 O ATOM 5050 H1 WAT 8843 52.714 138.483 75.644 1.00 0.00 H ATOM 5051 H2 WAT 8843 53.538 139.616 75.072 1.00 0.00 H TER 5053 WAT 8843 ATOM 5053 O WAT 8844 101.147 132.433 80.864 1.00 0.00 O ATOM 5054 H1 WAT 8844 100.412 132.781 81.369 1.00 0.00 H ATOM 5055 H2 WAT 8844 101.199 133.000 80.094 1.00 0.00 H TER 5057 WAT 8844 ATOM 5057 O WAT 8845 41.923 99.078 98.243 1.00 0.00 O ATOM 5058 H1 WAT 8845 41.894 99.384 97.337 1.00 0.00 H ATOM 5059 H2 WAT 8845 42.709 98.534 98.287 1.00 0.00 H TER 5061 WAT 8845 ATOM 5061 O WAT 8846 21.648 59.893 106.870 1.00 0.00 O ATOM 5062 H1 WAT 8846 21.541 58.970 106.640 1.00 0.00 H ATOM 5063 H2 WAT 8846 22.515 60.123 106.536 1.00 0.00 H TER 5065 WAT 8846 ATOM 5065 O WAT 8847 38.980 56.987 106.732 1.00 0.00 O ATOM 5066 H1 WAT 8847 39.289 57.891 106.778 1.00 0.00 H ATOM 5067 H2 WAT 8847 38.099 57.053 106.362 1.00 0.00 H TER 5069 WAT 8847 ATOM 5069 O WAT 8848 95.398 86.797 2.675 1.00 0.00 O ATOM 5070 H1 WAT 8848 95.964 87.057 3.402 1.00 0.00 H ATOM 5071 H2 WAT 8848 94.538 87.150 2.904 1.00 0.00 H TER 5073 WAT 8848 ATOM 5073 O WAT 8849 124.689 141.087 123.118 1.00 0.00 O ATOM 5074 H1 WAT 8849 124.428 140.315 122.615 1.00 0.00 H ATOM 5075 H2 WAT 8849 125.341 140.759 123.738 1.00 0.00 H TER 5077 WAT 8849 ATOM 5077 O WAT 8850 95.742 81.849 136.814 1.00 0.00 O ATOM 5078 H1 WAT 8850 94.948 82.256 136.468 1.00 0.00 H ATOM 5079 H2 WAT 8850 96.451 82.226 136.292 1.00 0.00 H TER 5081 WAT 8850 ATOM 5081 O WAT 8851 113.635 116.272 147.345 1.00 0.00 O ATOM 5082 H1 WAT 8851 114.224 116.653 147.996 1.00 0.00 H ATOM 5083 H2 WAT 8851 114.168 115.618 146.894 1.00 0.00 H TER 5085 WAT 8851 ATOM 5085 O WAT 8852 90.091 63.453 84.080 1.00 0.00 O ATOM 5086 H1 WAT 8852 89.621 62.930 83.431 1.00 0.00 H ATOM 5087 H2 WAT 8852 90.145 62.887 84.850 1.00 0.00 H TER 5089 WAT 8852 ATOM 5089 O WAT 8853 72.751 102.265 91.592 1.00 0.00 O ATOM 5090 H1 WAT 8853 71.848 102.350 91.287 1.00 0.00 H ATOM 5091 H2 WAT 8853 72.741 101.494 92.159 1.00 0.00 H TER 5093 WAT 8853 ATOM 5093 O WAT 8854 126.719 68.336 91.430 1.00 0.00 O ATOM 5094 H1 WAT 8854 127.512 68.299 90.894 1.00 0.00 H ATOM 5095 H2 WAT 8854 127.041 68.406 92.329 1.00 0.00 H TER 5097 WAT 8854 ATOM 5097 O WAT 8855 20.560 115.701 20.435 1.00 0.00 O ATOM 5098 H1 WAT 8855 19.925 115.757 19.721 1.00 0.00 H ATOM 5099 H2 WAT 8855 20.945 114.830 20.346 1.00 0.00 H TER 5101 WAT 8855 ATOM 5101 O WAT 8856 55.156 77.288 69.946 1.00 0.00 O ATOM 5102 H1 WAT 8856 54.417 77.698 70.396 1.00 0.00 H ATOM 5103 H2 WAT 8856 54.933 77.344 69.017 1.00 0.00 H TER 5105 WAT 8856 ATOM 5105 O WAT 8857 20.041 9.648 28.764 1.00 0.00 O ATOM 5106 H1 WAT 8857 19.658 9.710 29.639 1.00 0.00 H ATOM 5107 H2 WAT 8857 19.402 10.075 28.193 1.00 0.00 H TER 5109 WAT 8857 ATOM 5109 O WAT 8858 112.346 93.668 139.101 1.00 0.00 O ATOM 5110 H1 WAT 8858 113.093 93.097 139.281 1.00 0.00 H ATOM 5111 H2 WAT 8858 112.415 93.865 138.167 1.00 0.00 H TER 5113 WAT 8858 ATOM 5113 O WAT 8859 46.831 11.063 93.360 1.00 0.00 O ATOM 5114 H1 WAT 8859 46.152 11.445 93.918 1.00 0.00 H ATOM 5115 H2 WAT 8859 46.579 10.144 93.272 1.00 0.00 H TER 5117 WAT 8859 ATOM 5117 O WAT 8860 50.249 105.774 4.843 1.00 0.00 O ATOM 5118 H1 WAT 8860 49.563 105.751 4.176 1.00 0.00 H ATOM 5119 H2 WAT 8860 50.257 104.889 5.209 1.00 0.00 H TER 5121 WAT 8860 ATOM 5121 O WAT 8861 76.860 84.285 72.148 1.00 0.00 O ATOM 5122 H1 WAT 8861 77.669 84.607 72.546 1.00 0.00 H ATOM 5123 H2 WAT 8861 76.163 84.671 72.678 1.00 0.00 H TER 5125 WAT 8861 ATOM 5125 O WAT 8862 39.560 116.248 58.886 1.00 0.00 O ATOM 5126 H1 WAT 8862 39.362 116.736 58.086 1.00 0.00 H ATOM 5127 H2 WAT 8862 40.493 116.399 59.034 1.00 0.00 H TER 5129 WAT 8862 ATOM 5129 O WAT 8863 32.916 73.513 97.593 1.00 0.00 O ATOM 5130 H1 WAT 8863 32.924 72.956 98.371 1.00 0.00 H ATOM 5131 H2 WAT 8863 33.838 73.597 97.350 1.00 0.00 H TER 5133 WAT 8863 ATOM 5133 O WAT 8864 10.026 100.687 92.370 1.00 0.00 O ATOM 5134 H1 WAT 8864 10.473 101.436 92.764 1.00 0.00 H ATOM 5135 H2 WAT 8864 9.181 101.036 92.085 1.00 0.00 H TER 5137 WAT 8864 ATOM 5137 O WAT 8865 13.992 141.889 100.781 1.00 0.00 O ATOM 5138 H1 WAT 8865 14.307 142.267 101.602 1.00 0.00 H ATOM 5139 H2 WAT 8865 13.670 141.021 101.025 1.00 0.00 H TER 5141 WAT 8865 ATOM 5141 O WAT 8866 126.696 142.588 74.003 1.00 0.00 O ATOM 5142 H1 WAT 8866 127.362 142.583 73.316 1.00 0.00 H ATOM 5143 H2 WAT 8866 126.145 141.830 73.808 1.00 0.00 H TER 5145 WAT 8866 ATOM 5145 O WAT 8867 64.074 20.639 146.559 1.00 0.00 O ATOM 5146 H1 WAT 8867 63.307 20.291 146.105 1.00 0.00 H ATOM 5147 H2 WAT 8867 64.110 21.559 146.299 1.00 0.00 H TER 5149 WAT 8867 ATOM 5149 O WAT 8868 137.034 14.401 75.338 1.00 0.00 O ATOM 5150 H1 WAT 8868 137.398 15.277 75.208 1.00 0.00 H ATOM 5151 H2 WAT 8868 137.424 14.099 76.159 1.00 0.00 H TER 5153 WAT 8868 ATOM 5153 O WAT 8869 114.667 64.888 70.547 1.00 0.00 O ATOM 5154 H1 WAT 8869 113.889 65.321 70.898 1.00 0.00 H ATOM 5155 H2 WAT 8869 114.689 65.145 69.626 1.00 0.00 H TER 5157 WAT 8869 ATOM 5157 O WAT 8870 29.284 45.671 93.442 1.00 0.00 O ATOM 5158 H1 WAT 8870 30.000 46.268 93.225 1.00 0.00 H ATOM 5159 H2 WAT 8870 29.226 45.704 94.397 1.00 0.00 H TER 5161 WAT 8870 ATOM 5161 O WAT 8871 104.355 112.712 6.337 1.00 0.00 O ATOM 5162 H1 WAT 8871 103.583 113.204 6.057 1.00 0.00 H ATOM 5163 H2 WAT 8871 104.583 113.088 7.187 1.00 0.00 H TER 5165 WAT 8871 ATOM 5165 O WAT 8872 79.556 142.351 13.428 1.00 0.00 O ATOM 5166 H1 WAT 8872 79.312 142.676 12.561 1.00 0.00 H ATOM 5167 H2 WAT 8872 79.356 143.076 14.020 1.00 0.00 H TER 5169 WAT 8872 ATOM 5169 O WAT 8873 2.367 87.883 156.159 1.00 0.00 O ATOM 5170 H1 WAT 8873 1.881 88.654 155.866 1.00 0.00 H ATOM 5171 H2 WAT 8873 1.950 87.150 155.706 1.00 0.00 H TER 5173 WAT 8873 ATOM 5173 O WAT 8874 129.815 90.765 66.610 1.00 0.00 O ATOM 5174 H1 WAT 8874 130.307 90.312 67.294 1.00 0.00 H ATOM 5175 H2 WAT 8874 129.058 90.202 66.447 1.00 0.00 H TER 5177 WAT 8874 ATOM 5177 O WAT 8875 66.518 65.299 116.662 1.00 0.00 O ATOM 5178 H1 WAT 8875 65.629 65.645 116.582 1.00 0.00 H ATOM 5179 H2 WAT 8875 66.435 64.563 117.267 1.00 0.00 H TER 5181 WAT 8875 ATOM 5181 O WAT 8876 120.331 27.362 145.748 1.00 0.00 O ATOM 5182 H1 WAT 8876 120.722 26.597 145.326 1.00 0.00 H ATOM 5183 H2 WAT 8876 120.496 27.231 146.682 1.00 0.00 H TER 5185 WAT 8876 ATOM 5185 O WAT 8877 83.817 6.787 96.015 1.00 0.00 O ATOM 5186 H1 WAT 8877 83.779 6.201 95.258 1.00 0.00 H ATOM 5187 H2 WAT 8877 83.314 7.556 95.747 1.00 0.00 H TER 5189 WAT 8877 ATOM 5189 O WAT 8878 5.758 65.739 146.118 1.00 0.00 O ATOM 5190 H1 WAT 8878 4.868 66.091 146.111 1.00 0.00 H ATOM 5191 H2 WAT 8878 5.861 65.366 146.994 1.00 0.00 H TER 5193 WAT 8878 ATOM 5193 O WAT 8879 125.845 33.032 156.739 1.00 0.00 O ATOM 5194 H1 WAT 8879 126.369 33.768 156.424 1.00 0.00 H ATOM 5195 H2 WAT 8879 126.247 32.262 156.337 1.00 0.00 H TER 5197 WAT 8879 ATOM 5197 O WAT 8880 2.596 64.314 141.336 1.00 0.00 O ATOM 5198 H1 WAT 8880 1.845 63.980 140.845 1.00 0.00 H ATOM 5199 H2 WAT 8880 3.049 63.530 141.644 1.00 0.00 H TER 5201 WAT 8880 ATOM 5201 O WAT 8881 112.337 43.001 132.133 1.00 0.00 O ATOM 5202 H1 WAT 8881 111.768 43.201 132.877 1.00 0.00 H ATOM 5203 H2 WAT 8881 113.221 43.010 132.499 1.00 0.00 H TER 5205 WAT 8881 ATOM 5205 O WAT 8882 29.214 111.651 78.025 1.00 0.00 O ATOM 5206 H1 WAT 8882 29.521 112.518 78.288 1.00 0.00 H ATOM 5207 H2 WAT 8882 28.926 111.763 77.119 1.00 0.00 H TER 5209 WAT 8882 ATOM 5209 O WAT 8883 77.375 98.455 104.806 1.00 0.00 O ATOM 5210 H1 WAT 8883 77.841 97.620 104.780 1.00 0.00 H ATOM 5211 H2 WAT 8883 77.854 99.017 104.197 1.00 0.00 H TER 5213 WAT 8883 ATOM 5213 O WAT 8884 2.215 34.436 6.945 1.00 0.00 O ATOM 5214 H1 WAT 8884 1.963 33.892 7.691 1.00 0.00 H ATOM 5215 H2 WAT 8884 3.129 34.204 6.778 1.00 0.00 H TER 5217 WAT 8884 ATOM 5217 O WAT 8885 22.427 11.918 103.004 1.00 0.00 O ATOM 5218 H1 WAT 8885 22.350 12.528 103.737 1.00 0.00 H ATOM 5219 H2 WAT 8885 22.946 12.390 102.353 1.00 0.00 H TER 5221 WAT 8885 ATOM 5221 O WAT 8886 65.175 46.575 79.354 1.00 0.00 O ATOM 5222 H1 WAT 8886 64.389 46.535 78.809 1.00 0.00 H ATOM 5223 H2 WAT 8886 64.903 46.208 80.194 1.00 0.00 H TER 5225 WAT 8886 ATOM 5225 O WAT 8887 87.213 141.436 95.355 1.00 0.00 O ATOM 5226 H1 WAT 8887 87.281 142.390 95.378 1.00 0.00 H ATOM 5227 H2 WAT 8887 86.879 141.198 96.220 1.00 0.00 H TER 5229 WAT 8887 ATOM 5229 O WAT 8888 37.955 120.877 120.924 1.00 0.00 O ATOM 5230 H1 WAT 8888 38.182 120.143 121.496 1.00 0.00 H ATOM 5231 H2 WAT 8888 37.264 121.342 121.395 1.00 0.00 H TER 5233 WAT 8888 ATOM 5233 O WAT 8889 32.640 8.028 108.226 1.00 0.00 O ATOM 5234 H1 WAT 8889 31.845 7.509 108.348 1.00 0.00 H ATOM 5235 H2 WAT 8889 32.385 8.918 108.472 1.00 0.00 H TER 5237 WAT 8889 ATOM 5237 O WAT 8890 16.917 62.194 152.305 1.00 0.00 O ATOM 5238 H1 WAT 8890 16.837 61.656 153.092 1.00 0.00 H ATOM 5239 H2 WAT 8890 17.554 62.869 152.540 1.00 0.00 H TER 5241 WAT 8890 ATOM 5241 O WAT 8891 140.407 66.727 64.130 1.00 0.00 O ATOM 5242 H1 WAT 8891 140.521 66.751 63.179 1.00 0.00 H ATOM 5243 H2 WAT 8891 139.587 67.196 64.285 1.00 0.00 H TER 5245 WAT 8891 ATOM 5245 O WAT 8892 27.466 133.495 152.478 1.00 0.00 O ATOM 5246 H1 WAT 8892 27.890 133.577 153.333 1.00 0.00 H ATOM 5247 H2 WAT 8892 27.644 134.327 152.041 1.00 0.00 H TER 5249 WAT 8892 ATOM 5249 O WAT 8893 108.041 85.342 128.807 1.00 0.00 O ATOM 5250 H1 WAT 8893 108.883 85.264 128.358 1.00 0.00 H ATOM 5251 H2 WAT 8893 107.685 86.178 128.506 1.00 0.00 H TER 5253 WAT 8893 ATOM 5253 O WAT 8894 131.915 79.871 111.137 1.00 0.00 O ATOM 5254 H1 WAT 8894 131.767 80.481 111.860 1.00 0.00 H ATOM 5255 H2 WAT 8894 132.653 80.245 110.656 1.00 0.00 H TER 5257 WAT 8894 ATOM 5257 O WAT 8895 143.666 62.883 140.059 1.00 0.00 O ATOM 5258 H1 WAT 8895 143.218 63.551 139.539 1.00 0.00 H ATOM 5259 H2 WAT 8895 143.486 63.126 140.968 1.00 0.00 H TER 5261 WAT 8895 ATOM 5261 O WAT 8896 119.088 59.802 157.197 1.00 0.00 O ATOM 5262 H1 WAT 8896 119.828 59.994 157.771 1.00 0.00 H ATOM 5263 H2 WAT 8896 118.393 59.515 157.789 1.00 0.00 H TER 5265 WAT 8896 ATOM 5265 O WAT 8897 123.968 61.160 139.037 1.00 0.00 O ATOM 5266 H1 WAT 8897 124.873 61.398 138.835 1.00 0.00 H ATOM 5267 H2 WAT 8897 123.759 61.663 139.824 1.00 0.00 H TER 5269 WAT 8897 ATOM 5269 O WAT 8898 22.663 129.380 122.777 1.00 0.00 O ATOM 5270 H1 WAT 8898 23.235 128.621 122.658 1.00 0.00 H ATOM 5271 H2 WAT 8898 21.915 129.207 122.205 1.00 0.00 H TER 5273 WAT 8898 ATOM 5273 O WAT 8899 17.210 86.749 124.494 1.00 0.00 O ATOM 5274 H1 WAT 8899 16.265 86.863 124.394 1.00 0.00 H ATOM 5275 H2 WAT 8899 17.487 86.318 123.686 1.00 0.00 H TER 5277 WAT 8899 ATOM 5277 O WAT 8900 77.655 86.545 98.587 1.00 0.00 O ATOM 5278 H1 WAT 8900 77.794 87.307 98.025 1.00 0.00 H ATOM 5279 H2 WAT 8900 77.049 86.852 99.262 1.00 0.00 H TER 5281 WAT 8900 ATOM 5281 O WAT 8901 140.403 74.568 15.559 1.00 0.00 O ATOM 5282 H1 WAT 8901 140.171 74.060 16.336 1.00 0.00 H ATOM 5283 H2 WAT 8901 139.671 74.433 14.957 1.00 0.00 H TER 5285 WAT 8901 ATOM 5285 O WAT 8902 90.638 39.442 149.410 1.00 0.00 O ATOM 5286 H1 WAT 8902 91.162 40.225 149.578 1.00 0.00 H ATOM 5287 H2 WAT 8902 90.423 39.107 150.280 1.00 0.00 H TER 5289 WAT 8902 ATOM 5289 O WAT 8903 3.723 112.342 22.526 1.00 0.00 O ATOM 5290 H1 WAT 8903 3.987 112.264 23.443 1.00 0.00 H ATOM 5291 H2 WAT 8903 3.088 113.058 22.520 1.00 0.00 H TER 5293 WAT 8903 ATOM 5293 O WAT 8904 44.536 73.392 9.783 1.00 0.00 O ATOM 5294 H1 WAT 8904 45.458 73.309 9.538 1.00 0.00 H ATOM 5295 H2 WAT 8904 44.186 72.505 9.700 1.00 0.00 H TER 5297 WAT 8904 ATOM 5297 O WAT 8905 132.382 87.028 151.981 1.00 0.00 O ATOM 5298 H1 WAT 8905 132.344 86.659 152.863 1.00 0.00 H ATOM 5299 H2 WAT 8905 132.595 87.951 152.116 1.00 0.00 H TER 5301 WAT 8905 ATOM 5301 O WAT 8906 104.398 145.000 122.951 1.00 0.00 O ATOM 5302 H1 WAT 8906 103.652 145.056 122.354 1.00 0.00 H ATOM 5303 H2 WAT 8906 104.011 144.780 123.798 1.00 0.00 H TER 5305 WAT 8906 ATOM 5305 O WAT 8907 41.003 16.031 26.061 1.00 0.00 O ATOM 5306 H1 WAT 8907 40.532 16.793 26.400 1.00 0.00 H ATOM 5307 H2 WAT 8907 40.337 15.525 25.596 1.00 0.00 H TER 5309 WAT 8907 ATOM 5309 O WAT 8908 34.788 144.488 107.642 1.00 0.00 O ATOM 5310 H1 WAT 8908 34.005 144.446 107.094 1.00 0.00 H ATOM 5311 H2 WAT 8908 35.119 143.590 107.657 1.00 0.00 H TER 5313 WAT 8908 ATOM 5313 O WAT 8909 66.155 22.145 64.939 1.00 0.00 O ATOM 5314 H1 WAT 8909 65.762 22.640 64.220 1.00 0.00 H ATOM 5315 H2 WAT 8909 65.448 21.587 65.262 1.00 0.00 H TER 5317 WAT 8909 ATOM 5317 O WAT 8910 67.729 113.856 143.934 1.00 0.00 O ATOM 5318 H1 WAT 8910 68.085 113.161 144.487 1.00 0.00 H ATOM 5319 H2 WAT 8910 66.973 114.185 144.419 1.00 0.00 H TER 5321 WAT 8910 ATOM 5321 O WAT 8911 63.243 0.778 18.447 1.00 0.00 O ATOM 5322 H1 WAT 8911 62.759 1.603 18.419 1.00 0.00 H ATOM 5323 H2 WAT 8911 63.027 0.403 19.301 1.00 0.00 H TER 5325 WAT 8911 ATOM 5325 O WAT 8912 115.366 94.450 20.267 1.00 0.00 O ATOM 5326 H1 WAT 8912 115.853 93.662 20.028 1.00 0.00 H ATOM 5327 H2 WAT 8912 115.792 94.763 21.065 1.00 0.00 H TER 5329 WAT 8912 ATOM 5329 O WAT 8913 102.585 93.344 70.352 1.00 0.00 O ATOM 5330 H1 WAT 8913 103.280 92.867 69.898 1.00 0.00 H ATOM 5331 H2 WAT 8913 102.364 94.065 69.763 1.00 0.00 H TER 5333 WAT 8913 ATOM 5333 O WAT 8914 129.028 103.223 99.386 1.00 0.00 O ATOM 5334 H1 WAT 8914 128.075 103.219 99.479 1.00 0.00 H ATOM 5335 H2 WAT 8914 129.328 102.518 99.959 1.00 0.00 H TER 5337 WAT 8914 ATOM 5337 O WAT 8915 22.308 47.233 2.204 1.00 0.00 O ATOM 5338 H1 WAT 8915 23.002 46.593 2.049 1.00 0.00 H ATOM 5339 H2 WAT 8915 21.863 47.313 1.360 1.00 0.00 H TER 5341 WAT 8915 ATOM 5341 O WAT 8916 17.678 96.096 89.946 1.00 0.00 O ATOM 5342 H1 WAT 8916 16.892 96.331 89.453 1.00 0.00 H ATOM 5343 H2 WAT 8916 18.388 96.152 89.306 1.00 0.00 H TER 5345 WAT 8916 ATOM 5345 O WAT 8917 94.304 7.410 141.617 1.00 0.00 O ATOM 5346 H1 WAT 8917 94.672 7.334 140.737 1.00 0.00 H ATOM 5347 H2 WAT 8917 94.816 6.798 142.145 1.00 0.00 H TER 5349 WAT 8917 ATOM 5349 O WAT 8918 33.688 131.313 130.009 1.00 0.00 O ATOM 5350 H1 WAT 8918 33.371 130.717 130.686 1.00 0.00 H ATOM 5351 H2 WAT 8918 32.897 131.601 129.553 1.00 0.00 H TER 5353 WAT 8918 ATOM 5353 O WAT 8919 25.056 22.610 112.219 1.00 0.00 O ATOM 5354 H1 WAT 8919 25.078 21.752 111.795 1.00 0.00 H ATOM 5355 H2 WAT 8919 25.836 22.624 112.773 1.00 0.00 H TER 5357 WAT 8919 ATOM 5357 O WAT 8920 136.650 7.764 111.486 1.00 0.00 O ATOM 5358 H1 WAT 8920 137.092 7.973 110.663 1.00 0.00 H ATOM 5359 H2 WAT 8920 135.938 7.176 111.233 1.00 0.00 H TER 5361 WAT 8920 ATOM 5361 O WAT 8921 127.275 35.904 120.435 1.00 0.00 O ATOM 5362 H1 WAT 8921 126.896 36.731 120.139 1.00 0.00 H ATOM 5363 H2 WAT 8921 127.776 35.587 119.683 1.00 0.00 H TER 5365 WAT 8921 ATOM 5365 O WAT 8922 114.914 40.359 21.873 1.00 0.00 O ATOM 5366 H1 WAT 8922 114.106 40.119 22.327 1.00 0.00 H ATOM 5367 H2 WAT 8922 115.613 40.041 22.443 1.00 0.00 H TER 5369 WAT 8922 ATOM 5369 O WAT 8923 73.411 136.367 10.962 1.00 0.00 O ATOM 5370 H1 WAT 8923 73.062 137.224 11.206 1.00 0.00 H ATOM 5371 H2 WAT 8923 72.866 135.742 11.441 1.00 0.00 H TER 5373 WAT 8923 ATOM 5373 O WAT 8924 109.307 50.364 107.322 1.00 0.00 O ATOM 5374 H1 WAT 8924 108.928 51.067 107.850 1.00 0.00 H ATOM 5375 H2 WAT 8924 109.563 50.790 106.505 1.00 0.00 H TER 5377 WAT 8924 ATOM 5377 O WAT 8925 24.273 126.069 133.356 1.00 0.00 O ATOM 5378 H1 WAT 8925 23.399 126.419 133.184 1.00 0.00 H ATOM 5379 H2 WAT 8925 24.394 126.179 134.299 1.00 0.00 H TER 5381 WAT 8925 ATOM 5381 O WAT 8926 129.477 3.320 66.810 1.00 0.00 O ATOM 5382 H1 WAT 8926 129.052 3.807 66.104 1.00 0.00 H ATOM 5383 H2 WAT 8926 128.787 3.194 67.462 1.00 0.00 H TER 5385 WAT 8926 ATOM 5385 O WAT 8927 128.245 50.317 67.777 1.00 0.00 O ATOM 5386 H1 WAT 8927 127.521 49.724 67.978 1.00 0.00 H ATOM 5387 H2 WAT 8927 128.694 50.439 68.613 1.00 0.00 H TER 5389 WAT 8927 ATOM 5389 O WAT 8928 71.741 18.066 61.191 1.00 0.00 O ATOM 5390 H1 WAT 8928 72.181 18.678 61.781 1.00 0.00 H ATOM 5391 H2 WAT 8928 72.395 17.388 61.020 1.00 0.00 H TER 5393 WAT 8928 ATOM 5393 O WAT 8929 41.822 139.684 92.472 1.00 0.00 O ATOM 5394 H1 WAT 8929 41.531 140.549 92.183 1.00 0.00 H ATOM 5395 H2 WAT 8929 41.097 139.353 93.002 1.00 0.00 H TER 5397 WAT 8929 ATOM 5397 O WAT 8930 142.602 9.121 59.122 1.00 0.00 O ATOM 5398 H1 WAT 8930 143.454 9.436 58.821 1.00 0.00 H ATOM 5399 H2 WAT 8930 142.187 8.765 58.336 1.00 0.00 H TER 5401 WAT 8930 ATOM 5401 O WAT 8931 61.092 2.320 19.208 1.00 0.00 O ATOM 5402 H1 WAT 8931 60.643 1.514 19.461 1.00 0.00 H ATOM 5403 H2 WAT 8931 61.621 2.549 19.973 1.00 0.00 H TER 5405 WAT 8931 ATOM 5405 O WAT 8932 101.287 68.880 126.621 1.00 0.00 O ATOM 5406 H1 WAT 8932 101.110 68.822 125.682 1.00 0.00 H ATOM 5407 H2 WAT 8932 102.160 68.499 126.723 1.00 0.00 H TER 5409 WAT 8932 ATOM 5409 O WAT 8933 101.940 48.094 27.144 1.00 0.00 O ATOM 5410 H1 WAT 8933 101.395 47.428 26.724 1.00 0.00 H ATOM 5411 H2 WAT 8933 101.974 47.831 28.064 1.00 0.00 H TER 5413 WAT 8933 ATOM 5413 O WAT 8934 23.365 14.472 19.473 1.00 0.00 O ATOM 5414 H1 WAT 8934 24.087 15.059 19.697 1.00 0.00 H ATOM 5415 H2 WAT 8934 22.629 14.784 20.001 1.00 0.00 H TER 5417 WAT 8934 ATOM 5417 O WAT 8935 20.325 65.642 113.419 1.00 0.00 O ATOM 5418 H1 WAT 8935 20.662 65.900 114.277 1.00 0.00 H ATOM 5419 H2 WAT 8935 19.447 65.305 113.597 1.00 0.00 H TER 5421 WAT 8935 ATOM 5421 O WAT 8936 139.549 60.118 147.545 1.00 0.00 O ATOM 5422 H1 WAT 8936 138.812 60.713 147.683 1.00 0.00 H ATOM 5423 H2 WAT 8936 139.933 60.400 146.715 1.00 0.00 H TER 5425 WAT 8936 ATOM 5425 O WAT 8937 16.337 15.739 151.061 1.00 0.00 O ATOM 5426 H1 WAT 8937 15.782 16.517 151.008 1.00 0.00 H ATOM 5427 H2 WAT 8937 17.175 16.016 150.691 1.00 0.00 H TER 5429 WAT 8937 ATOM 5429 O WAT 8938 65.944 129.923 83.721 1.00 0.00 O ATOM 5430 H1 WAT 8938 65.466 130.524 83.149 1.00 0.00 H ATOM 5431 H2 WAT 8938 65.429 129.899 84.527 1.00 0.00 H TER 5433 WAT 8938 ATOM 5433 O WAT 8939 123.086 69.848 94.046 1.00 0.00 O ATOM 5434 H1 WAT 8939 122.822 69.415 93.234 1.00 0.00 H ATOM 5435 H2 WAT 8939 122.623 70.686 94.031 1.00 0.00 H TER 5437 WAT 8939 ATOM 5437 O WAT 8940 56.921 93.260 130.504 1.00 0.00 O ATOM 5438 H1 WAT 8940 56.054 92.859 130.447 1.00 0.00 H ATOM 5439 H2 WAT 8940 57.530 92.525 130.437 1.00 0.00 H TER 5441 WAT 8940 ATOM 5441 O WAT 8941 133.351 121.535 104.871 1.00 0.00 O ATOM 5442 H1 WAT 8941 133.035 120.642 104.734 1.00 0.00 H ATOM 5443 H2 WAT 8941 133.088 121.747 105.767 1.00 0.00 H TER 5445 WAT 8941 ATOM 5445 O WAT 8942 110.327 28.710 139.370 1.00 0.00 O ATOM 5446 H1 WAT 8942 110.425 27.909 138.855 1.00 0.00 H ATOM 5447 H2 WAT 8942 109.968 28.414 140.207 1.00 0.00 H TER 5449 WAT 8942 ATOM 5449 O WAT 8943 51.875 67.107 3.308 1.00 0.00 O ATOM 5450 H1 WAT 8943 52.176 68.001 3.472 1.00 0.00 H ATOM 5451 H2 WAT 8943 52.671 66.621 3.093 1.00 0.00 H TER 5453 WAT 8943 ATOM 5453 O WAT 8944 34.738 94.037 133.722 1.00 0.00 O ATOM 5454 H1 WAT 8944 35.308 93.312 133.466 1.00 0.00 H ATOM 5455 H2 WAT 8944 34.479 93.832 134.621 1.00 0.00 H TER 5457 WAT 8944 ATOM 5457 O WAT 8945 91.216 122.345 122.258 1.00 0.00 O ATOM 5458 H1 WAT 8945 91.922 122.963 122.073 1.00 0.00 H ATOM 5459 H2 WAT 8945 91.622 121.674 122.808 1.00 0.00 H TER 5461 WAT 8945 ATOM 5461 O WAT 8946 83.480 36.513 22.968 1.00 0.00 O ATOM 5462 H1 WAT 8946 83.452 35.638 22.580 1.00 0.00 H ATOM 5463 H2 WAT 8946 82.664 36.927 22.685 1.00 0.00 H TER 5465 WAT 8946 ATOM 5465 O WAT 8947 84.278 127.104 90.808 1.00 0.00 O ATOM 5466 H1 WAT 8947 83.549 126.568 90.494 1.00 0.00 H ATOM 5467 H2 WAT 8947 84.408 127.758 90.121 1.00 0.00 H TER 5469 WAT 8947 ATOM 5469 O WAT 8948 111.884 111.150 125.061 1.00 0.00 O ATOM 5470 H1 WAT 8948 111.035 111.000 124.645 1.00 0.00 H ATOM 5471 H2 WAT 8948 111.671 111.387 125.963 1.00 0.00 H TER 5473 WAT 8948 ATOM 5473 O WAT 8949 119.298 65.995 16.662 1.00 0.00 O ATOM 5474 H1 WAT 8949 120.111 65.891 17.157 1.00 0.00 H ATOM 5475 H2 WAT 8949 119.538 65.786 15.760 1.00 0.00 H TER 5477 WAT 8949 ATOM 5477 O WAT 8950 12.584 20.459 15.024 1.00 0.00 O ATOM 5478 H1 WAT 8950 12.132 20.180 14.228 1.00 0.00 H ATOM 5479 H2 WAT 8950 11.908 20.899 15.541 1.00 0.00 H TER 5481 WAT 8950 ATOM 5481 O WAT 8951 84.158 105.023 118.581 1.00 0.00 O ATOM 5482 H1 WAT 8951 83.785 104.181 118.323 1.00 0.00 H ATOM 5483 H2 WAT 8951 83.923 105.618 117.869 1.00 0.00 H TER 5485 WAT 8951 ATOM 5485 O WAT 8952 49.094 19.379 148.374 1.00 0.00 O ATOM 5486 H1 WAT 8952 48.665 20.147 147.996 1.00 0.00 H ATOM 5487 H2 WAT 8952 49.908 19.292 147.879 1.00 0.00 H TER 5489 WAT 8952 ATOM 5489 O WAT 8953 85.095 100.881 105.055 1.00 0.00 O ATOM 5490 H1 WAT 8953 85.803 101.017 105.684 1.00 0.00 H ATOM 5491 H2 WAT 8953 85.128 99.945 104.855 1.00 0.00 H TER 5493 WAT 8953 ATOM 5493 O WAT 8954 8.005 38.758 4.296 1.00 0.00 O ATOM 5494 H1 WAT 8954 7.530 38.807 5.125 1.00 0.00 H ATOM 5495 H2 WAT 8954 8.925 38.684 4.551 1.00 0.00 H TER 5497 WAT 8954 ATOM 5497 O WAT 8955 92.320 0.133 146.991 1.00 0.00 O ATOM 5498 H1 WAT 8955 91.919 0.929 147.339 1.00 0.00 H ATOM 5499 H2 WAT 8955 92.021 0.092 146.082 1.00 0.00 H TER 5501 WAT 8955 ATOM 5501 O WAT 8956 103.944 130.247 143.786 1.00 0.00 O ATOM 5502 H1 WAT 8956 104.447 129.755 143.137 1.00 0.00 H ATOM 5503 H2 WAT 8956 104.154 129.827 144.620 1.00 0.00 H TER 5505 WAT 8956 ATOM 5505 O WAT 8957 132.433 93.631 82.527 1.00 0.00 O ATOM 5506 H1 WAT 8957 131.737 93.723 81.877 1.00 0.00 H ATOM 5507 H2 WAT 8957 132.758 92.739 82.406 1.00 0.00 H TER 5509 WAT 8957 ATOM 5509 O WAT 8958 36.144 7.501 24.703 1.00 0.00 O ATOM 5510 H1 WAT 8958 36.854 8.136 24.607 1.00 0.00 H ATOM 5511 H2 WAT 8958 35.401 8.018 25.013 1.00 0.00 H TER 5513 WAT 8958 ATOM 5513 O WAT 8959 118.775 116.760 95.794 1.00 0.00 O ATOM 5514 H1 WAT 8959 119.366 116.346 95.166 1.00 0.00 H ATOM 5515 H2 WAT 8959 118.228 117.339 95.264 1.00 0.00 H TER 5517 WAT 8959 ATOM 5517 O WAT 8960 136.292 59.797 5.486 1.00 0.00 O ATOM 5518 H1 WAT 8960 135.874 60.419 6.081 1.00 0.00 H ATOM 5519 H2 WAT 8960 137.058 59.482 5.967 1.00 0.00 H TER 5521 WAT 8960 ATOM 5521 O WAT 8961 69.010 21.576 59.423 1.00 0.00 O ATOM 5522 H1 WAT 8961 69.123 22.190 58.697 1.00 0.00 H ATOM 5523 H2 WAT 8961 68.479 20.868 59.057 1.00 0.00 H TER 5525 WAT 8961 ATOM 5525 O WAT 8962 55.431 49.064 104.201 1.00 0.00 O ATOM 5526 H1 WAT 8962 54.821 48.885 103.485 1.00 0.00 H ATOM 5527 H2 WAT 8962 55.543 48.219 104.636 1.00 0.00 H TER 5529 WAT 8962 ATOM 5529 O WAT 8963 116.449 46.624 153.251 1.00 0.00 O ATOM 5530 H1 WAT 8963 116.942 46.764 152.443 1.00 0.00 H ATOM 5531 H2 WAT 8963 117.119 46.558 153.932 1.00 0.00 H TER 5533 WAT 8963 ATOM 5533 O WAT 8964 144.075 40.097 111.246 1.00 0.00 O ATOM 5534 H1 WAT 8964 144.489 39.405 111.763 1.00 0.00 H ATOM 5535 H2 WAT 8964 144.789 40.470 110.729 1.00 0.00 H TER 5537 WAT 8964 ATOM 5537 O WAT 8965 111.776 130.045 22.201 1.00 0.00 O ATOM 5538 H1 WAT 8965 111.902 129.229 22.685 1.00 0.00 H ATOM 5539 H2 WAT 8965 112.350 130.674 22.639 1.00 0.00 H TER 5541 WAT 8965 ATOM 5541 O WAT 8966 18.798 88.648 68.964 1.00 0.00 O ATOM 5542 H1 WAT 8966 18.113 89.002 68.397 1.00 0.00 H ATOM 5543 H2 WAT 8966 19.426 88.251 68.361 1.00 0.00 H TER 5545 WAT 8966 ATOM 5545 O WAT 8967 135.308 84.151 20.854 1.00 0.00 O ATOM 5546 H1 WAT 8967 135.893 84.855 20.572 1.00 0.00 H ATOM 5547 H2 WAT 8967 135.232 84.269 21.801 1.00 0.00 H TER 5549 WAT 8967 ATOM 5549 O WAT 8968 95.989 55.489 96.253 1.00 0.00 O ATOM 5550 H1 WAT 8968 95.237 56.080 96.215 1.00 0.00 H ATOM 5551 H2 WAT 8968 96.106 55.192 95.350 1.00 0.00 H TER 5553 WAT 8968 ATOM 5553 O WAT 8969 138.508 113.684 15.441 1.00 0.00 O ATOM 5554 H1 WAT 8969 139.240 113.145 15.741 1.00 0.00 H ATOM 5555 H2 WAT 8969 138.922 114.405 14.965 1.00 0.00 H TER 5557 WAT 8969 ATOM 5557 O WAT 8970 3.389 13.138 95.822 1.00 0.00 O ATOM 5558 H1 WAT 8970 2.930 13.978 95.817 1.00 0.00 H ATOM 5559 H2 WAT 8970 2.943 12.617 95.155 1.00 0.00 H TER 5561 WAT 8970 ATOM 5561 O WAT 8971 47.400 120.710 4.555 1.00 0.00 O ATOM 5562 H1 WAT 8971 47.437 121.367 3.860 1.00 0.00 H ATOM 5563 H2 WAT 8971 48.108 120.101 4.347 1.00 0.00 H TER 5565 WAT 8971 ATOM 5565 O WAT 8972 119.875 126.295 89.716 1.00 0.00 O ATOM 5566 H1 WAT 8972 119.975 125.346 89.794 1.00 0.00 H ATOM 5567 H2 WAT 8972 120.117 126.487 88.810 1.00 0.00 H TER 5569 WAT 8972 ATOM 5569 O WAT 8973 76.419 53.496 131.010 1.00 0.00 O ATOM 5570 H1 WAT 8973 76.715 53.590 130.104 1.00 0.00 H ATOM 5571 H2 WAT 8973 76.336 52.551 131.138 1.00 0.00 H TER 5573 WAT 8973 ATOM 5573 O WAT 8974 139.327 38.472 123.093 1.00 0.00 O ATOM 5574 H1 WAT 8974 139.461 39.244 122.543 1.00 0.00 H ATOM 5575 H2 WAT 8974 138.438 38.572 123.433 1.00 0.00 H TER 5577 WAT 8974 ATOM 5577 O WAT 8975 134.964 63.551 157.030 1.00 0.00 O ATOM 5578 H1 WAT 8975 135.492 62.972 157.580 1.00 0.00 H ATOM 5579 H2 WAT 8975 135.406 63.542 156.180 1.00 0.00 H TER 5581 WAT 8975 ATOM 5581 O WAT 8976 61.980 51.690 77.863 1.00 0.00 O ATOM 5582 H1 WAT 8976 61.856 51.372 76.968 1.00 0.00 H ATOM 5583 H2 WAT 8976 62.903 51.521 78.051 1.00 0.00 H TER 5585 WAT 8976 ATOM 5585 O WAT 8977 58.011 68.117 132.109 1.00 0.00 O ATOM 5586 H1 WAT 8977 57.467 68.572 132.752 1.00 0.00 H ATOM 5587 H2 WAT 8977 57.608 68.321 131.266 1.00 0.00 H TER 5589 WAT 8977 ATOM 5589 O WAT 8978 53.297 29.115 88.014 1.00 0.00 O ATOM 5590 H1 WAT 8978 52.485 29.356 87.568 1.00 0.00 H ATOM 5591 H2 WAT 8978 53.023 28.879 88.900 1.00 0.00 H TER 5593 WAT 8978 ATOM 5593 O WAT 8979 49.090 60.430 157.708 1.00 0.00 O ATOM 5594 H1 WAT 8979 48.777 59.787 158.345 1.00 0.00 H ATOM 5595 H2 WAT 8979 48.312 60.942 157.484 1.00 0.00 H TER 5597 WAT 8979 ATOM 5597 O WAT 8980 108.307 10.214 120.176 1.00 0.00 O ATOM 5598 H1 WAT 8980 107.926 9.740 119.437 1.00 0.00 H ATOM 5599 H2 WAT 8980 109.252 10.166 120.030 1.00 0.00 H TER 5601 WAT 8980 ATOM 5601 O WAT 8981 9.924 58.458 10.279 1.00 0.00 O ATOM 5602 H1 WAT 8981 9.913 58.939 9.451 1.00 0.00 H ATOM 5603 H2 WAT 8981 10.602 58.890 10.798 1.00 0.00 H TER 5605 WAT 8981 ATOM 5605 O WAT 8982 126.719 112.151 157.230 1.00 0.00 O ATOM 5606 H1 WAT 8982 127.535 112.346 156.769 1.00 0.00 H ATOM 5607 H2 WAT 8982 126.960 112.157 158.156 1.00 0.00 H TER 5609 WAT 8982 ATOM 5609 O WAT 8983 125.163 143.275 106.630 1.00 0.00 O ATOM 5610 H1 WAT 8983 125.449 144.167 106.432 1.00 0.00 H ATOM 5611 H2 WAT 8983 124.346 143.171 106.141 1.00 0.00 H TER 5613 WAT 8983 ATOM 5613 O WAT 8984 128.409 71.996 20.078 1.00 0.00 O ATOM 5614 H1 WAT 8984 127.476 72.160 19.941 1.00 0.00 H ATOM 5615 H2 WAT 8984 128.436 71.221 20.639 1.00 0.00 H TER 5617 WAT 8984 ATOM 5617 O WAT 8985 35.629 139.463 64.515 1.00 0.00 O ATOM 5618 H1 WAT 8985 36.146 139.432 63.710 1.00 0.00 H ATOM 5619 H2 WAT 8985 35.157 138.630 64.529 1.00 0.00 H TER 5621 WAT 8985 ATOM 5621 O WAT 8986 34.250 134.630 85.304 1.00 0.00 O ATOM 5622 H1 WAT 8986 35.155 134.391 85.504 1.00 0.00 H ATOM 5623 H2 WAT 8986 33.987 135.198 86.028 1.00 0.00 H TER 5625 WAT 8986 ATOM 5625 O WAT 8987 137.896 93.818 125.971 1.00 0.00 O ATOM 5626 H1 WAT 8987 138.061 94.319 126.769 1.00 0.00 H ATOM 5627 H2 WAT 8987 137.943 92.903 126.249 1.00 0.00 H TER 5629 WAT 8987 ATOM 5629 O WAT 8988 75.271 73.113 81.086 1.00 0.00 O ATOM 5630 H1 WAT 8988 75.349 73.327 80.156 1.00 0.00 H ATOM 5631 H2 WAT 8988 76.133 73.313 81.451 1.00 0.00 H TER 5633 WAT 8988 ATOM 5633 O WAT 8989 108.066 108.102 100.637 1.00 0.00 O ATOM 5634 H1 WAT 8989 107.694 108.174 101.516 1.00 0.00 H ATOM 5635 H2 WAT 8989 107.758 108.886 100.182 1.00 0.00 H TER 5637 WAT 8989 ATOM 5637 O WAT 8990 5.652 67.637 11.839 1.00 0.00 O ATOM 5638 H1 WAT 8990 5.786 67.237 12.698 1.00 0.00 H ATOM 5639 H2 WAT 8990 5.658 68.579 12.010 1.00 0.00 H TER 5641 WAT 8990 ATOM 5641 O WAT 8991 101.999 24.280 97.085 1.00 0.00 O ATOM 5642 H1 WAT 8991 102.612 23.546 97.145 1.00 0.00 H ATOM 5643 H2 WAT 8991 101.157 23.872 96.881 1.00 0.00 H TER 5645 WAT 8991 ATOM 5645 O WAT 8992 108.712 130.488 87.519 1.00 0.00 O ATOM 5646 H1 WAT 8992 108.837 130.861 86.647 1.00 0.00 H ATOM 5647 H2 WAT 8992 108.867 129.550 87.403 1.00 0.00 H TER 5649 WAT 8992 ATOM 5649 O WAT 8993 35.575 71.157 127.112 1.00 0.00 O ATOM 5650 H1 WAT 8993 35.201 70.315 127.371 1.00 0.00 H ATOM 5651 H2 WAT 8993 35.777 71.594 127.939 1.00 0.00 H TER 5653 WAT 8993 ATOM 5653 O WAT 8994 35.268 28.751 128.628 1.00 0.00 O ATOM 5654 H1 WAT 8994 35.064 29.686 128.621 1.00 0.00 H ATOM 5655 H2 WAT 8994 35.900 28.639 127.919 1.00 0.00 H TER 5657 WAT 8994 ATOM 5657 O WAT 8995 75.481 41.202 100.793 1.00 0.00 O ATOM 5658 H1 WAT 8995 75.908 41.928 100.338 1.00 0.00 H ATOM 5659 H2 WAT 8995 74.936 41.623 101.458 1.00 0.00 H TER 5661 WAT 8995 ATOM 5661 O WAT 8996 108.773 111.175 144.027 1.00 0.00 O ATOM 5662 H1 WAT 8996 108.540 110.646 143.264 1.00 0.00 H ATOM 5663 H2 WAT 8996 108.673 112.080 143.732 1.00 0.00 H TER 5665 WAT 8996 ATOM 5665 O WAT 8997 73.012 129.006 125.974 1.00 0.00 O ATOM 5666 H1 WAT 8997 73.866 129.083 126.400 1.00 0.00 H ATOM 5667 H2 WAT 8997 72.993 128.111 125.635 1.00 0.00 H TER 5669 WAT 8997 ATOM 5669 O WAT 8998 75.249 105.909 96.604 1.00 0.00 O ATOM 5670 H1 WAT 8998 74.756 105.147 96.300 1.00 0.00 H ATOM 5671 H2 WAT 8998 74.915 106.636 96.079 1.00 0.00 H TER 5673 WAT 8998 ATOM 5673 O WAT 8999 64.026 115.778 108.188 1.00 0.00 O ATOM 5674 H1 WAT 8999 63.601 115.629 107.343 1.00 0.00 H ATOM 5675 H2 WAT 8999 63.346 116.176 108.731 1.00 0.00 H TER 5677 WAT 8999 ATOM 5677 O WAT 9000 36.338 70.776 93.818 1.00 0.00 O ATOM 5678 H1 WAT 9000 36.211 71.721 93.727 1.00 0.00 H ATOM 5679 H2 WAT 9000 35.561 70.390 93.414 1.00 0.00 H TER 5681 WAT 9000 ATOM 5681 O WAT 9001 25.790 11.599 60.213 1.00 0.00 O ATOM 5682 H1 WAT 9001 25.169 10.973 60.585 1.00 0.00 H ATOM 5683 H2 WAT 9001 25.251 12.179 59.674 1.00 0.00 H TER 5685 WAT 9001 ATOM 5685 O WAT 9002 120.657 54.820 88.492 1.00 0.00 O ATOM 5686 H1 WAT 9002 119.842 54.332 88.376 1.00 0.00 H ATOM 5687 H2 WAT 9002 120.600 55.535 87.858 1.00 0.00 H TER 5689 WAT 9002 ATOM 5689 O WAT 9003 60.289 134.277 7.651 1.00 0.00 O ATOM 5690 H1 WAT 9003 60.149 134.978 7.014 1.00 0.00 H ATOM 5691 H2 WAT 9003 59.442 134.175 8.085 1.00 0.00 H TER 5693 WAT 9003 ATOM 5693 O WAT 9004 67.974 25.726 114.511 1.00 0.00 O ATOM 5694 H1 WAT 9004 68.587 25.985 115.199 1.00 0.00 H ATOM 5695 H2 WAT 9004 67.396 25.091 114.934 1.00 0.00 H TER 5697 WAT 9004 ATOM 5697 O WAT 9005 91.008 14.290 81.699 1.00 0.00 O ATOM 5698 H1 WAT 9005 90.195 14.563 82.125 1.00 0.00 H ATOM 5699 H2 WAT 9005 91.130 13.383 81.977 1.00 0.00 H TER 5701 WAT 9005 ATOM 5701 O WAT 9006 116.316 111.523 113.288 1.00 0.00 O ATOM 5702 H1 WAT 9006 117.034 111.989 113.717 1.00 0.00 H ATOM 5703 H2 WAT 9006 115.534 111.787 113.774 1.00 0.00 H TER 5705 WAT 9006 ATOM 5705 O WAT 9007 70.898 112.672 76.523 1.00 0.00 O ATOM 5706 H1 WAT 9007 70.389 113.259 77.082 1.00 0.00 H ATOM 5707 H2 WAT 9007 71.634 113.205 76.223 1.00 0.00 H TER 5709 WAT 9007 ATOM 5709 O WAT 9008 143.198 70.580 135.898 1.00 0.00 O ATOM 5710 H1 WAT 9008 142.515 70.915 136.478 1.00 0.00 H ATOM 5711 H2 WAT 9008 143.332 71.279 135.257 1.00 0.00 H TER 5713 WAT 9008 ATOM 5713 O WAT 9009 22.711 134.982 111.882 1.00 0.00 O ATOM 5714 H1 WAT 9009 21.965 134.891 111.289 1.00 0.00 H ATOM 5715 H2 WAT 9009 23.169 134.143 111.821 1.00 0.00 H TER 5717 WAT 9009 ATOM 5717 O WAT 9010 110.502 129.982 64.607 1.00 0.00 O ATOM 5718 H1 WAT 9010 111.395 129.680 64.440 1.00 0.00 H ATOM 5719 H2 WAT 9010 110.576 130.936 64.648 1.00 0.00 H TER 5721 WAT 9010 ATOM 5721 O WAT 9011 16.537 20.274 76.830 1.00 0.00 O ATOM 5722 H1 WAT 9011 16.882 21.123 77.107 1.00 0.00 H ATOM 5723 H2 WAT 9011 16.179 20.436 75.957 1.00 0.00 H TER 5725 WAT 9011 ATOM 5725 O WAT 9012 6.153 61.938 124.208 1.00 0.00 O ATOM 5726 H1 WAT 9012 6.641 61.117 124.279 1.00 0.00 H ATOM 5727 H2 WAT 9012 6.658 62.562 124.729 1.00 0.00 H TER 5729 WAT 9012 ATOM 5729 O WAT 9013 20.144 78.036 102.875 1.00 0.00 O ATOM 5730 H1 WAT 9013 21.080 77.833 102.846 1.00 0.00 H ATOM 5731 H2 WAT 9013 19.755 77.303 103.352 1.00 0.00 H TER 5733 WAT 9013 ATOM 5733 O WAT 9014 91.278 45.217 93.959 1.00 0.00 O ATOM 5734 H1 WAT 9014 90.644 45.864 94.269 1.00 0.00 H ATOM 5735 H2 WAT 9014 90.872 44.838 93.179 1.00 0.00 H TER 5737 WAT 9014 ATOM 5737 O WAT 9015 2.692 64.716 66.454 1.00 0.00 O ATOM 5738 H1 WAT 9015 2.103 65.268 65.939 1.00 0.00 H ATOM 5739 H2 WAT 9015 2.110 64.208 67.019 1.00 0.00 H TER 5741 WAT 9015 ATOM 5741 O WAT 9016 139.492 91.213 117.833 1.00 0.00 O ATOM 5742 H1 WAT 9016 138.856 90.537 117.599 1.00 0.00 H ATOM 5743 H2 WAT 9016 139.519 91.791 117.071 1.00 0.00 H TER 5745 WAT 9016 ATOM 5745 O WAT 9017 107.962 92.766 151.293 1.00 0.00 O ATOM 5746 H1 WAT 9017 108.154 92.326 152.121 1.00 0.00 H ATOM 5747 H2 WAT 9017 107.031 92.982 151.348 1.00 0.00 H TER 5749 WAT 9017 ATOM 5749 O WAT 9018 145.594 68.208 122.919 1.00 0.00 O ATOM 5750 H1 WAT 9018 145.262 68.196 122.022 1.00 0.00 H ATOM 5751 H2 WAT 9018 145.069 67.553 123.378 1.00 0.00 H TER 5753 WAT 9018 ATOM 5753 O WAT 9019 42.160 75.289 89.560 1.00 0.00 O ATOM 5754 H1 WAT 9019 42.940 75.128 89.029 1.00 0.00 H ATOM 5755 H2 WAT 9019 41.825 74.415 89.763 1.00 0.00 H TER 5757 WAT 9019 ATOM 5757 O WAT 9020 113.466 23.694 149.994 1.00 0.00 O ATOM 5758 H1 WAT 9020 113.549 23.799 149.046 1.00 0.00 H ATOM 5759 H2 WAT 9020 112.889 22.938 150.102 1.00 0.00 H TER 5761 WAT 9020 ATOM 5761 O WAT 9021 78.386 52.564 151.766 1.00 0.00 O ATOM 5762 H1 WAT 9021 77.626 53.095 151.527 1.00 0.00 H ATOM 5763 H2 WAT 9021 78.961 53.166 152.238 1.00 0.00 H TER 5765 WAT 9021 ATOM 5765 O WAT 9022 53.151 75.327 81.508 1.00 0.00 O ATOM 5766 H1 WAT 9022 52.691 75.204 80.677 1.00 0.00 H ATOM 5767 H2 WAT 9022 52.492 75.143 82.177 1.00 0.00 H TER 5769 WAT 9022 ATOM 5769 O WAT 9023 117.067 73.134 11.576 1.00 0.00 O ATOM 5770 H1 WAT 9023 116.617 72.321 11.805 1.00 0.00 H ATOM 5771 H2 WAT 9023 116.882 73.255 10.644 1.00 0.00 H TER 5773 WAT 9023 ATOM 5773 O WAT 9024 76.807 10.019 135.010 1.00 0.00 O ATOM 5774 H1 WAT 9024 75.907 9.696 134.970 1.00 0.00 H ATOM 5775 H2 WAT 9024 77.338 9.233 135.138 1.00 0.00 H TER 5777 WAT 9024 ATOM 5777 O WAT 9025 61.948 30.697 9.282 1.00 0.00 O ATOM 5778 H1 WAT 9025 62.492 31.477 9.175 1.00 0.00 H ATOM 5779 H2 WAT 9025 61.573 30.546 8.414 1.00 0.00 H TER 5781 WAT 9025 ATOM 5781 O WAT 9026 138.572 131.076 21.446 1.00 0.00 O ATOM 5782 H1 WAT 9026 138.774 131.410 22.320 1.00 0.00 H ATOM 5783 H2 WAT 9026 139.075 130.265 21.377 1.00 0.00 H TER 5785 WAT 9026 ATOM 5785 O WAT 9027 53.956 68.401 120.060 1.00 0.00 O ATOM 5786 H1 WAT 9027 53.546 69.189 119.704 1.00 0.00 H ATOM 5787 H2 WAT 9027 54.355 68.688 120.881 1.00 0.00 H TER 5789 WAT 9027 ATOM 5789 O WAT 9028 105.402 126.320 129.142 1.00 0.00 O ATOM 5790 H1 WAT 9028 104.751 126.143 129.821 1.00 0.00 H ATOM 5791 H2 WAT 9028 104.898 126.345 128.328 1.00 0.00 H TER 5793 WAT 9028 ATOM 5793 O WAT 9029 26.839 100.953 76.826 1.00 0.00 O ATOM 5794 H1 WAT 9029 26.347 101.549 76.261 1.00 0.00 H ATOM 5795 H2 WAT 9029 26.195 100.636 77.459 1.00 0.00 H TER 5797 WAT 9029 ATOM 5797 O WAT 9030 24.082 117.833 81.910 1.00 0.00 O ATOM 5798 H1 WAT 9030 23.203 117.873 81.535 1.00 0.00 H ATOM 5799 H2 WAT 9030 24.433 116.994 81.610 1.00 0.00 H TER 5801 WAT 9030 ATOM 5801 O WAT 9031 126.139 41.856 4.693 1.00 0.00 O ATOM 5802 H1 WAT 9031 127.028 42.105 4.947 1.00 0.00 H ATOM 5803 H2 WAT 9031 126.212 40.938 4.433 1.00 0.00 H TER 5805 WAT 9031 ATOM 5805 O WAT 9032 141.675 138.921 81.846 1.00 0.00 O ATOM 5806 H1 WAT 9032 140.749 138.886 82.089 1.00 0.00 H ATOM 5807 H2 WAT 9032 141.677 138.808 80.895 1.00 0.00 H TER 5809 WAT 9032 ATOM 5809 O WAT 9033 5.110 9.013 156.582 1.00 0.00 O ATOM 5810 H1 WAT 9033 5.162 9.871 156.161 1.00 0.00 H ATOM 5811 H2 WAT 9033 6.009 8.820 156.846 1.00 0.00 H TER 5813 WAT 9033 ATOM 5813 O WAT 9034 47.398 27.957 103.352 1.00 0.00 O ATOM 5814 H1 WAT 9034 48.109 27.375 103.618 1.00 0.00 H ATOM 5815 H2 WAT 9034 46.601 27.503 103.627 1.00 0.00 H TER 5817 WAT 9034 ATOM 5817 O WAT 9035 1.877 93.979 147.413 1.00 0.00 O ATOM 5818 H1 WAT 9035 1.191 94.235 148.029 1.00 0.00 H ATOM 5819 H2 WAT 9035 2.328 93.253 147.845 1.00 0.00 H TER 5821 WAT 9035 ATOM 5821 O WAT 9036 128.298 119.285 113.355 1.00 0.00 O ATOM 5822 H1 WAT 9036 128.250 120.028 112.753 1.00 0.00 H ATOM 5823 H2 WAT 9036 129.111 119.422 113.841 1.00 0.00 H TER 5825 WAT 9036 ATOM 5825 O WAT 9037 143.470 79.001 136.370 1.00 0.00 O ATOM 5826 H1 WAT 9037 143.361 78.057 136.256 1.00 0.00 H ATOM 5827 H2 WAT 9037 144.114 79.250 135.706 1.00 0.00 H TER 5829 WAT 9037 ATOM 5829 O WAT 9038 23.615 138.086 6.357 1.00 0.00 O ATOM 5830 H1 WAT 9038 24.019 137.552 5.673 1.00 0.00 H ATOM 5831 H2 WAT 9038 23.950 138.969 6.201 1.00 0.00 H TER 5833 WAT 9038 ATOM 5833 O WAT 9039 69.625 50.344 143.991 1.00 0.00 O ATOM 5834 H1 WAT 9039 68.810 50.216 143.505 1.00 0.00 H ATOM 5835 H2 WAT 9039 69.743 49.530 144.479 1.00 0.00 H TER 5837 WAT 9039 ATOM 5837 O WAT 9040 101.149 97.523 111.591 1.00 0.00 O ATOM 5838 H1 WAT 9040 100.633 97.530 112.397 1.00 0.00 H ATOM 5839 H2 WAT 9040 101.850 96.893 111.760 1.00 0.00 H TER 5841 WAT 9040 ATOM 5841 O WAT 9041 89.558 138.977 86.459 1.00 0.00 O ATOM 5842 H1 WAT 9041 90.109 138.593 87.141 1.00 0.00 H ATOM 5843 H2 WAT 9041 88.699 139.074 86.871 1.00 0.00 H TER 5845 WAT 9041 ATOM 5845 O WAT 9042 29.373 133.249 110.581 1.00 0.00 O ATOM 5846 H1 WAT 9042 29.954 132.878 111.246 1.00 0.00 H ATOM 5847 H2 WAT 9042 28.950 132.489 110.182 1.00 0.00 H TER 5849 WAT 9042 ATOM 5849 O WAT 9043 17.300 145.575 88.535 1.00 0.00 O ATOM 5850 H1 WAT 9043 17.072 146.132 89.279 1.00 0.00 H ATOM 5851 H2 WAT 9043 17.758 144.830 88.924 1.00 0.00 H TER 5853 WAT 9043 ATOM 5853 O WAT 9044 44.183 79.305 129.807 1.00 0.00 O ATOM 5854 H1 WAT 9044 44.052 80.225 129.576 1.00 0.00 H ATOM 5855 H2 WAT 9044 44.440 79.324 130.729 1.00 0.00 H TER 5857 WAT 9044 ATOM 5857 O WAT 9045 110.668 23.015 112.090 1.00 0.00 O ATOM 5858 H1 WAT 9045 110.693 23.734 112.722 1.00 0.00 H ATOM 5859 H2 WAT 9045 111.362 22.422 112.375 1.00 0.00 H TER 5861 WAT 9045 ATOM 5861 O WAT 9046 95.220 89.580 72.273 1.00 0.00 O ATOM 5862 H1 WAT 9046 95.511 90.469 72.073 1.00 0.00 H ATOM 5863 H2 WAT 9046 96.026 89.102 72.468 1.00 0.00 H TER 5865 WAT 9046 ATOM 5865 O WAT 9047 127.606 57.247 123.771 1.00 0.00 O ATOM 5866 H1 WAT 9047 127.340 56.330 123.833 1.00 0.00 H ATOM 5867 H2 WAT 9047 126.868 57.682 123.343 1.00 0.00 H TER 5869 WAT 9047 ATOM 5869 O WAT 9048 121.177 6.609 147.539 1.00 0.00 O ATOM 5870 H1 WAT 9048 121.381 5.887 148.132 1.00 0.00 H ATOM 5871 H2 WAT 9048 121.383 7.397 148.042 1.00 0.00 H TER 5873 WAT 9048 ATOM 5873 O WAT 9049 5.254 70.244 12.945 1.00 0.00 O ATOM 5874 H1 WAT 9049 6.190 70.421 13.041 1.00 0.00 H ATOM 5875 H2 WAT 9049 4.997 70.732 12.163 1.00 0.00 H TER 5877 WAT 9049 ATOM 5877 O WAT 9050 36.328 58.998 155.945 1.00 0.00 O ATOM 5878 H1 WAT 9050 36.730 58.696 155.131 1.00 0.00 H ATOM 5879 H2 WAT 9050 36.320 58.224 156.509 1.00 0.00 H TER 5881 WAT 9050 ATOM 5881 O WAT 9051 62.455 128.405 145.139 1.00 0.00 O ATOM 5882 H1 WAT 9051 62.411 127.670 145.751 1.00 0.00 H ATOM 5883 H2 WAT 9051 61.725 128.260 144.537 1.00 0.00 H TER 5885 WAT 9051 ATOM 5885 O WAT 9052 42.223 46.200 103.688 1.00 0.00 O ATOM 5886 H1 WAT 9052 42.380 47.084 103.356 1.00 0.00 H ATOM 5887 H2 WAT 9052 43.080 45.775 103.652 1.00 0.00 H TER 5889 WAT 9052 ATOM 5889 O WAT 9053 103.025 28.040 9.818 1.00 0.00 O ATOM 5890 H1 WAT 9053 103.763 28.639 9.926 1.00 0.00 H ATOM 5891 H2 WAT 9053 102.529 28.401 9.083 1.00 0.00 H TER 5893 WAT 9053 ATOM 5893 O WAT 9054 106.329 25.733 155.634 1.00 0.00 O ATOM 5894 H1 WAT 9054 106.013 25.995 156.498 1.00 0.00 H ATOM 5895 H2 WAT 9054 106.350 24.776 155.666 1.00 0.00 H TER 5897 WAT 9054 ATOM 5897 O WAT 9055 60.999 99.211 90.431 1.00 0.00 O ATOM 5898 H1 WAT 9055 61.322 100.084 90.209 1.00 0.00 H ATOM 5899 H2 WAT 9055 60.338 99.364 91.106 1.00 0.00 H TER 5901 WAT 9055 ATOM 5901 O WAT 9056 137.317 37.688 78.959 1.00 0.00 O ATOM 5902 H1 WAT 9056 138.189 37.823 78.588 1.00 0.00 H ATOM 5903 H2 WAT 9056 137.475 37.225 79.781 1.00 0.00 H TER 5905 WAT 9056 ATOM 5905 O WAT 9057 58.503 17.780 5.063 1.00 0.00 O ATOM 5906 H1 WAT 9057 58.620 17.661 4.120 1.00 0.00 H ATOM 5907 H2 WAT 9057 57.666 18.237 5.145 1.00 0.00 H TER 5909 WAT 9057 ATOM 5909 O WAT 9058 33.240 73.948 71.827 1.00 0.00 O ATOM 5910 H1 WAT 9058 33.019 73.694 70.930 1.00 0.00 H ATOM 5911 H2 WAT 9058 32.437 73.794 72.324 1.00 0.00 H TER 5913 WAT 9058 ATOM 5913 O WAT 9059 15.881 73.703 1.949 1.00 0.00 O ATOM 5914 H1 WAT 9059 15.511 73.071 1.332 1.00 0.00 H ATOM 5915 H2 WAT 9059 16.412 73.173 2.544 1.00 0.00 H TER 5917 WAT 9059 ATOM 5917 O WAT 9060 43.425 56.140 145.647 1.00 0.00 O ATOM 5918 H1 WAT 9060 43.605 55.649 146.449 1.00 0.00 H ATOM 5919 H2 WAT 9060 43.587 57.053 145.884 1.00 0.00 H TER 5921 WAT 9060 ATOM 5921 O WAT 9061 36.601 138.245 140.817 1.00 0.00 O ATOM 5922 H1 WAT 9061 36.645 137.345 140.494 1.00 0.00 H ATOM 5923 H2 WAT 9061 37.320 138.694 140.373 1.00 0.00 H TER 5925 WAT 9061 ATOM 5925 O WAT 9062 32.840 45.666 123.176 1.00 0.00 O ATOM 5926 H1 WAT 9062 33.577 45.547 122.578 1.00 0.00 H ATOM 5927 H2 WAT 9062 32.495 44.783 123.311 1.00 0.00 H TER 5929 WAT 9062 ATOM 5929 O WAT 9063 4.979 23.952 58.973 1.00 0.00 O ATOM 5930 H1 WAT 9063 5.868 24.101 58.651 1.00 0.00 H ATOM 5931 H2 WAT 9063 4.576 23.389 58.311 1.00 0.00 H TER 5933 WAT 9063 ATOM 5933 O WAT 9064 31.157 77.558 147.269 1.00 0.00 O ATOM 5934 H1 WAT 9064 31.803 77.493 146.566 1.00 0.00 H ATOM 5935 H2 WAT 9064 31.412 78.342 147.757 1.00 0.00 H TER 5937 WAT 9064 ATOM 5937 O WAT 9065 14.230 139.919 92.796 1.00 0.00 O ATOM 5938 H1 WAT 9065 14.741 140.723 92.703 1.00 0.00 H ATOM 5939 H2 WAT 9065 14.322 139.681 93.718 1.00 0.00 H TER 5941 WAT 9065 ATOM 5941 O WAT 9066 74.981 121.449 72.262 1.00 0.00 O ATOM 5942 H1 WAT 9066 74.800 121.753 71.373 1.00 0.00 H ATOM 5943 H2 WAT 9066 75.848 121.048 72.207 1.00 0.00 H TER 5945 WAT 9066 ATOM 5945 O WAT 9067 13.447 21.723 101.005 1.00 0.00 O ATOM 5946 H1 WAT 9067 13.690 22.601 100.711 1.00 0.00 H ATOM 5947 H2 WAT 9067 13.780 21.141 100.322 1.00 0.00 H TER 5949 WAT 9067 ATOM 5949 O WAT 9068 108.762 19.176 116.386 1.00 0.00 O ATOM 5950 H1 WAT 9068 108.148 19.578 115.771 1.00 0.00 H ATOM 5951 H2 WAT 9068 108.866 19.826 117.081 1.00 0.00 H TER 5953 WAT 9068 ATOM 5953 O WAT 9069 110.389 141.613 86.859 1.00 0.00 O ATOM 5954 H1 WAT 9069 110.582 140.763 86.463 1.00 0.00 H ATOM 5955 H2 WAT 9069 109.451 141.582 87.048 1.00 0.00 H TER 5957 WAT 9069 ATOM 5957 O WAT 9070 16.799 97.441 121.264 1.00 0.00 O ATOM 5958 H1 WAT 9070 16.845 97.291 122.208 1.00 0.00 H ATOM 5959 H2 WAT 9070 17.658 97.796 121.036 1.00 0.00 H TER 5961 WAT 9070 ATOM 5961 O WAT 9071 125.145 84.767 73.800 1.00 0.00 O ATOM 5962 H1 WAT 9071 124.615 85.441 73.374 1.00 0.00 H ATOM 5963 H2 WAT 9071 125.866 84.609 73.191 1.00 0.00 H TER 5965 WAT 9071 ATOM 5965 O WAT 9072 56.783 49.786 141.165 1.00 0.00 O ATOM 5966 H1 WAT 9072 56.962 50.618 140.727 1.00 0.00 H ATOM 5967 H2 WAT 9072 57.178 49.126 140.596 1.00 0.00 H TER 5969 WAT 9072 ATOM 5969 O WAT 9073 54.661 66.504 136.347 1.00 0.00 O ATOM 5970 H1 WAT 9073 54.183 67.322 136.484 1.00 0.00 H ATOM 5971 H2 WAT 9073 55.556 66.700 136.625 1.00 0.00 H TER 5973 WAT 9073 ATOM 5973 O WAT 9074 138.352 16.755 96.050 1.00 0.00 O ATOM 5974 H1 WAT 9074 137.825 15.972 96.212 1.00 0.00 H ATOM 5975 H2 WAT 9074 138.433 16.795 95.097 1.00 0.00 H TER 5977 WAT 9074 ATOM 5977 O WAT 9075 48.392 5.795 156.514 1.00 0.00 O ATOM 5978 H1 WAT 9075 48.219 4.949 156.926 1.00 0.00 H ATOM 5979 H2 WAT 9075 48.331 6.427 157.230 1.00 0.00 H TER 5981 WAT 9075 ATOM 5981 O WAT 9076 16.167 99.439 124.970 1.00 0.00 O ATOM 5982 H1 WAT 9076 17.029 99.503 124.560 1.00 0.00 H ATOM 5983 H2 WAT 9076 16.322 98.946 125.776 1.00 0.00 H TER 5985 WAT 9076 ATOM 5985 O WAT 9077 56.892 70.820 122.993 1.00 0.00 O ATOM 5986 H1 WAT 9077 56.958 70.996 122.055 1.00 0.00 H ATOM 5987 H2 WAT 9077 57.367 69.998 123.117 1.00 0.00 H TER 5989 WAT 9077 ATOM 5989 O WAT 9078 117.171 7.252 71.497 1.00 0.00 O ATOM 5990 H1 WAT 9078 117.525 6.844 72.288 1.00 0.00 H ATOM 5991 H2 WAT 9078 117.766 7.980 71.317 1.00 0.00 H TER 5993 WAT 9078 ATOM 5993 O WAT 9079 78.453 133.270 9.219 1.00 0.00 O ATOM 5994 H1 WAT 9079 78.991 133.971 9.587 1.00 0.00 H ATOM 5995 H2 WAT 9079 77.694 133.220 9.801 1.00 0.00 H TER 5997 WAT 9079 ATOM 5997 O WAT 9080 95.284 29.383 90.758 1.00 0.00 O ATOM 5998 H1 WAT 9080 95.898 29.014 90.123 1.00 0.00 H ATOM 5999 H2 WAT 9080 95.496 30.316 90.782 1.00 0.00 H TER 6001 WAT 9080 ATOM 6001 O WAT 9081 108.928 86.581 119.661 1.00 0.00 O ATOM 6002 H1 WAT 9081 108.747 85.700 119.334 1.00 0.00 H ATOM 6003 H2 WAT 9081 108.110 87.059 119.526 1.00 0.00 H TER 6005 WAT 9081 ATOM 6005 O WAT 9082 2.817 32.691 115.982 1.00 0.00 O ATOM 6006 H1 WAT 9082 2.202 33.212 115.465 1.00 0.00 H ATOM 6007 H2 WAT 9082 2.611 32.910 116.891 1.00 0.00 H TER 6009 WAT 9082 ATOM 6009 O WAT 9083 35.816 50.973 17.367 1.00 0.00 O ATOM 6010 H1 WAT 9083 36.191 50.116 17.568 1.00 0.00 H ATOM 6011 H2 WAT 9083 35.282 51.186 18.133 1.00 0.00 H TER 6013 WAT 9083 ATOM 6013 O WAT 9084 9.680 132.618 90.395 1.00 0.00 O ATOM 6014 H1 WAT 9084 9.702 133.313 91.053 1.00 0.00 H ATOM 6015 H2 WAT 9084 8.747 132.454 90.253 1.00 0.00 H TER 6017 WAT 9084 ATOM 6017 O WAT 9085 77.890 16.705 117.123 1.00 0.00 O ATOM 6018 H1 WAT 9085 78.386 17.229 117.751 1.00 0.00 H ATOM 6019 H2 WAT 9085 77.942 17.200 116.305 1.00 0.00 H TER 6021 WAT 9085 ATOM 6021 O WAT 9086 79.194 91.977 116.901 1.00 0.00 O ATOM 6022 H1 WAT 9086 78.971 91.047 116.871 1.00 0.00 H ATOM 6023 H2 WAT 9086 79.357 92.214 115.988 1.00 0.00 H TER 6025 WAT 9086 ATOM 6025 O WAT 9087 102.451 134.701 65.716 1.00 0.00 O ATOM 6026 H1 WAT 9087 102.720 134.076 66.389 1.00 0.00 H ATOM 6027 H2 WAT 9087 101.654 134.323 65.343 1.00 0.00 H TER 6029 WAT 9087 ATOM 6029 O WAT 9088 50.240 73.653 105.329 1.00 0.00 O ATOM 6030 H1 WAT 9088 50.350 73.928 106.240 1.00 0.00 H ATOM 6031 H2 WAT 9088 51.133 73.519 105.010 1.00 0.00 H TER 6033 WAT 9088 ATOM 6033 O WAT 9089 4.790 15.229 126.453 1.00 0.00 O ATOM 6034 H1 WAT 9089 4.086 15.165 125.807 1.00 0.00 H ATOM 6035 H2 WAT 9089 5.253 14.395 126.386 1.00 0.00 H TER 6037 WAT 9089 ATOM 6037 O WAT 9090 7.407 95.836 95.025 1.00 0.00 O ATOM 6038 H1 WAT 9090 6.785 95.682 95.737 1.00 0.00 H ATOM 6039 H2 WAT 9090 8.252 95.937 95.463 1.00 0.00 H TER 6041 WAT 9090 ATOM 6041 O WAT 9091 144.739 109.946 99.771 1.00 0.00 O ATOM 6042 H1 WAT 9091 143.822 109.758 99.574 1.00 0.00 H ATOM 6043 H2 WAT 9091 145.125 110.172 98.924 1.00 0.00 H TER 6045 WAT 9091 ATOM 6045 O WAT 9092 0.263 53.870 75.036 1.00 0.00 O ATOM 6046 H1 WAT 9092 -0.113 54.629 74.589 1.00 0.00 H ATOM 6047 H2 WAT 9092 0.358 54.151 75.946 1.00 0.00 H TER 6049 WAT 9092 ATOM 6049 O WAT 9093 1.434 41.455 151.290 1.00 0.00 O ATOM 6050 H1 WAT 9093 0.519 41.244 151.474 1.00 0.00 H ATOM 6051 H2 WAT 9093 1.644 42.165 151.896 1.00 0.00 H TER 6053 WAT 9093 ATOM 6053 O WAT 9094 44.758 18.119 155.162 1.00 0.00 O ATOM 6054 H1 WAT 9094 44.598 17.176 155.155 1.00 0.00 H ATOM 6055 H2 WAT 9094 44.443 18.421 154.310 1.00 0.00 H TER 6057 WAT 9094 ATOM 6057 O WAT 9095 114.419 119.381 146.748 1.00 0.00 O ATOM 6058 H1 WAT 9095 113.647 119.540 146.206 1.00 0.00 H ATOM 6059 H2 WAT 9095 114.708 118.502 146.502 1.00 0.00 H TER 6061 WAT 9095 ATOM 6061 O WAT 9096 57.941 115.293 134.689 1.00 0.00 O ATOM 6062 H1 WAT 9096 57.119 114.803 134.725 1.00 0.00 H ATOM 6063 H2 WAT 9096 57.727 116.083 134.194 1.00 0.00 H TER 6065 WAT 9096 ATOM 6065 O WAT 9097 40.529 119.821 8.952 1.00 0.00 O ATOM 6066 H1 WAT 9097 40.924 119.610 9.798 1.00 0.00 H ATOM 6067 H2 WAT 9097 39.586 119.775 9.109 1.00 0.00 H TER 6069 WAT 9097 ATOM 6069 O WAT 9098 33.112 108.620 126.117 1.00 0.00 O ATOM 6070 H1 WAT 9098 33.991 108.258 126.003 1.00 0.00 H ATOM 6071 H2 WAT 9098 33.171 109.507 125.762 1.00 0.00 H TER 6073 WAT 9098 ATOM 6073 O WAT 9099 37.821 125.296 119.280 1.00 0.00 O ATOM 6074 H1 WAT 9099 37.076 125.717 119.708 1.00 0.00 H ATOM 6075 H2 WAT 9099 38.124 125.938 118.639 1.00 0.00 H TER 6077 WAT 9099 ATOM 6077 O WAT 9100 140.214 89.254 60.112 1.00 0.00 O ATOM 6078 H1 WAT 9100 139.980 89.938 59.485 1.00 0.00 H ATOM 6079 H2 WAT 9100 139.408 89.092 60.603 1.00 0.00 H TER 6081 WAT 9100 ATOM 6081 O WAT 9101 85.324 68.776 108.152 1.00 0.00 O ATOM 6082 H1 WAT 9101 84.488 68.383 107.899 1.00 0.00 H ATOM 6083 H2 WAT 9101 85.756 68.103 108.677 1.00 0.00 H TER 6085 WAT 9101 ATOM 6085 O WAT 9102 125.829 69.763 143.428 1.00 0.00 O ATOM 6086 H1 WAT 9102 125.717 70.558 143.950 1.00 0.00 H ATOM 6087 H2 WAT 9102 125.438 69.976 142.581 1.00 0.00 H TER 6089 WAT 9102 ATOM 6089 O WAT 9103 58.129 118.190 116.877 1.00 0.00 O ATOM 6090 H1 WAT 9103 58.896 118.619 116.500 1.00 0.00 H ATOM 6091 H2 WAT 9103 58.480 117.654 117.589 1.00 0.00 H TER 6093 WAT 9103 ATOM 6093 O WAT 9104 111.751 4.674 6.941 1.00 0.00 O ATOM 6094 H1 WAT 9104 112.328 4.599 7.701 1.00 0.00 H ATOM 6095 H2 WAT 9104 111.459 5.585 6.950 1.00 0.00 H TER 6097 WAT 9104 ATOM 6097 O WAT 9105 81.150 13.322 129.010 1.00 0.00 O ATOM 6098 H1 WAT 9105 81.959 13.418 128.508 1.00 0.00 H ATOM 6099 H2 WAT 9105 80.815 14.215 129.098 1.00 0.00 H TER 6101 WAT 9105 ATOM 6101 O WAT 9106 42.465 92.264 95.133 1.00 0.00 O ATOM 6102 H1 WAT 9106 41.829 92.557 94.480 1.00 0.00 H ATOM 6103 H2 WAT 9106 43.199 91.927 94.618 1.00 0.00 H TER 6105 WAT 9106 ATOM 6105 O WAT 9107 56.132 116.954 76.095 1.00 0.00 O ATOM 6106 H1 WAT 9107 56.431 116.861 76.999 1.00 0.00 H ATOM 6107 H2 WAT 9107 55.339 117.488 76.158 1.00 0.00 H TER 6109 WAT 9107 ATOM 6109 O WAT 9108 6.817 82.111 5.315 1.00 0.00 O ATOM 6110 H1 WAT 9108 6.918 81.565 6.095 1.00 0.00 H ATOM 6111 H2 WAT 9108 6.107 81.696 4.824 1.00 0.00 H TER 6113 WAT 9108 ATOM 6113 O WAT 9109 41.460 80.141 127.661 1.00 0.00 O ATOM 6114 H1 WAT 9109 41.293 80.619 126.849 1.00 0.00 H ATOM 6115 H2 WAT 9109 40.716 80.355 128.223 1.00 0.00 H TER 6117 WAT 9109 ATOM 6117 O WAT 9110 26.466 88.446 146.868 1.00 0.00 O ATOM 6118 H1 WAT 9110 26.029 87.630 146.623 1.00 0.00 H ATOM 6119 H2 WAT 9110 27.215 88.504 146.275 1.00 0.00 H TER 6121 WAT 9110 ATOM 6121 O WAT 9111 67.287 118.487 65.520 1.00 0.00 O ATOM 6122 H1 WAT 9111 67.500 117.985 64.733 1.00 0.00 H ATOM 6123 H2 WAT 9111 68.080 118.442 66.054 1.00 0.00 H TER 6125 WAT 9111 ATOM 6125 O WAT 9112 121.837 11.383 107.562 1.00 0.00 O ATOM 6126 H1 WAT 9112 121.305 11.655 108.310 1.00 0.00 H ATOM 6127 H2 WAT 9112 121.353 10.654 107.176 1.00 0.00 H TER 6129 WAT 9112 ATOM 6129 O WAT 9113 85.353 44.496 138.504 1.00 0.00 O ATOM 6130 H1 WAT 9113 84.936 45.355 138.570 1.00 0.00 H ATOM 6131 H2 WAT 9113 84.649 43.908 138.231 1.00 0.00 H TER 6133 WAT 9113 ATOM 6133 O WAT 9114 34.215 8.113 129.271 1.00 0.00 O ATOM 6134 H1 WAT 9114 34.420 7.502 129.979 1.00 0.00 H ATOM 6135 H2 WAT 9114 35.023 8.166 128.759 1.00 0.00 H TER 6137 WAT 9114 ATOM 6137 O WAT 9115 111.770 94.515 98.141 1.00 0.00 O ATOM 6138 H1 WAT 9115 112.004 95.091 98.869 1.00 0.00 H ATOM 6139 H2 WAT 9115 110.942 94.116 98.408 1.00 0.00 H TER 6141 WAT 9115 ATOM 6141 O WAT 9116 40.370 13.961 1.856 1.00 0.00 O ATOM 6142 H1 WAT 9116 40.363 13.046 1.575 1.00 0.00 H ATOM 6143 H2 WAT 9116 39.573 14.058 2.376 1.00 0.00 H TER 6145 WAT 9116 ATOM 6145 O WAT 9117 84.265 84.789 93.518 1.00 0.00 O ATOM 6146 H1 WAT 9117 84.579 84.594 92.635 1.00 0.00 H ATOM 6147 H2 WAT 9117 83.661 84.075 93.721 1.00 0.00 H TER 6149 WAT 9117 ATOM 6149 O WAT 9118 19.113 10.635 89.093 1.00 0.00 O ATOM 6150 H1 WAT 9118 19.527 10.671 88.231 1.00 0.00 H ATOM 6151 H2 WAT 9118 18.745 9.753 89.146 1.00 0.00 H TER 6153 WAT 9118 ATOM 6153 O WAT 9119 11.031 140.946 114.617 1.00 0.00 O ATOM 6154 H1 WAT 9119 11.924 141.137 114.330 1.00 0.00 H ATOM 6155 H2 WAT 9119 10.737 140.246 114.033 1.00 0.00 H TER 6157 WAT 9119 ATOM 6157 O WAT 9120 25.614 22.850 70.082 1.00 0.00 O ATOM 6158 H1 WAT 9120 26.064 23.361 70.755 1.00 0.00 H ATOM 6159 H2 WAT 9120 25.558 23.440 69.331 1.00 0.00 H TER 6161 WAT 9120 ATOM 6161 O WAT 9121 66.369 4.748 26.380 1.00 0.00 O ATOM 6162 H1 WAT 9121 65.471 4.432 26.279 1.00 0.00 H ATOM 6163 H2 WAT 9121 66.324 5.676 26.148 1.00 0.00 H TER 6165 WAT 9121 ATOM 6165 O WAT 9122 46.815 24.763 84.290 1.00 0.00 O ATOM 6166 H1 WAT 9122 47.529 25.021 83.708 1.00 0.00 H ATOM 6167 H2 WAT 9122 47.095 23.923 84.656 1.00 0.00 H TER 6169 WAT 9122 ATOM 6169 O WAT 9123 28.781 2.558 2.484 1.00 0.00 O ATOM 6170 H1 WAT 9123 29.212 1.704 2.525 1.00 0.00 H ATOM 6171 H2 WAT 9123 29.153 2.977 1.708 1.00 0.00 H TER 6173 WAT 9123 ATOM 6173 O WAT 9124 80.671 6.250 139.025 1.00 0.00 O ATOM 6174 H1 WAT 9124 80.941 6.748 138.253 1.00 0.00 H ATOM 6175 H2 WAT 9124 79.736 6.095 138.894 1.00 0.00 H TER 6177 WAT 9124 ATOM 6177 O WAT 9125 13.255 135.335 73.273 1.00 0.00 O ATOM 6178 H1 WAT 9125 13.080 135.550 74.189 1.00 0.00 H ATOM 6179 H2 WAT 9125 13.230 134.379 73.242 1.00 0.00 H TER 6181 WAT 9125 ATOM 6181 O WAT 9126 31.456 9.245 148.981 1.00 0.00 O ATOM 6182 H1 WAT 9126 31.546 9.127 148.035 1.00 0.00 H ATOM 6183 H2 WAT 9126 30.515 9.347 149.121 1.00 0.00 H TER 6185 WAT 9126 ATOM 6185 O WAT 9127 104.223 87.243 1.917 1.00 0.00 O ATOM 6186 H1 WAT 9127 104.499 87.837 1.220 1.00 0.00 H ATOM 6187 H2 WAT 9127 104.595 86.396 1.671 1.00 0.00 H TER 6189 WAT 9127 ATOM 6189 O WAT 9128 120.905 60.571 138.589 1.00 0.00 O ATOM 6190 H1 WAT 9128 121.370 60.641 137.755 1.00 0.00 H ATOM 6191 H2 WAT 9128 121.345 61.199 139.162 1.00 0.00 H TER 6193 WAT 9128 ATOM 6193 O WAT 9129 142.930 81.913 66.154 1.00 0.00 O ATOM 6194 H1 WAT 9129 142.561 81.956 65.272 1.00 0.00 H ATOM 6195 H2 WAT 9129 142.187 82.084 66.733 1.00 0.00 H TER 6197 WAT 9129 ATOM 6197 O WAT 9130 69.734 68.697 85.860 1.00 0.00 O ATOM 6198 H1 WAT 9130 69.331 69.447 86.296 1.00 0.00 H ATOM 6199 H2 WAT 9130 70.172 69.071 85.095 1.00 0.00 H TER 6201 WAT 9130 ATOM 6201 O WAT 9131 113.346 91.466 109.410 1.00 0.00 O ATOM 6202 H1 WAT 9131 112.717 91.105 110.035 1.00 0.00 H ATOM 6203 H2 WAT 9131 113.036 91.163 108.557 1.00 0.00 H TER 6205 WAT 9131 ATOM 6205 O WAT 9132 10.572 67.044 151.644 1.00 0.00 O ATOM 6206 H1 WAT 9132 10.949 67.880 151.369 1.00 0.00 H ATOM 6207 H2 WAT 9132 9.626 67.193 151.633 1.00 0.00 H TER 6209 WAT 9132 ATOM 6209 O WAT 9133 26.348 119.042 80.335 1.00 0.00 O ATOM 6210 H1 WAT 9133 26.304 119.075 79.379 1.00 0.00 H ATOM 6211 H2 WAT 9133 25.617 118.478 80.589 1.00 0.00 H TER 6213 WAT 9133 ATOM 6213 O WAT 9134 135.877 92.691 148.391 1.00 0.00 O ATOM 6214 H1 WAT 9134 135.247 93.392 148.225 1.00 0.00 H ATOM 6215 H2 WAT 9134 135.646 92.008 147.762 1.00 0.00 H TER 6217 WAT 9134 ATOM 6217 O WAT 9135 119.032 71.175 24.128 1.00 0.00 O ATOM 6218 H1 WAT 9135 118.090 71.026 24.203 1.00 0.00 H ATOM 6219 H2 WAT 9135 119.426 70.497 24.675 1.00 0.00 H TER 6221 WAT 9135 ATOM 6221 O WAT 9136 86.243 107.387 53.584 1.00 0.00 O ATOM 6222 H1 WAT 9136 85.365 107.753 53.476 1.00 0.00 H ATOM 6223 H2 WAT 9136 86.101 106.446 53.681 1.00 0.00 H TER 6225 WAT 9136 ATOM 6225 O WAT 9137 117.521 131.248 74.282 1.00 0.00 O ATOM 6226 H1 WAT 9137 116.623 131.327 74.606 1.00 0.00 H ATOM 6227 H2 WAT 9137 117.634 130.311 74.120 1.00 0.00 H TER 6229 WAT 9137 ATOM 6229 O WAT 9138 46.563 69.236 147.083 1.00 0.00 O ATOM 6230 H1 WAT 9138 47.157 68.583 146.713 1.00 0.00 H ATOM 6231 H2 WAT 9138 46.508 69.917 146.412 1.00 0.00 H TER 6233 WAT 9138 ATOM 6233 O WAT 9139 20.144 65.643 116.278 1.00 0.00 O ATOM 6234 H1 WAT 9139 19.358 65.274 116.681 1.00 0.00 H ATOM 6235 H2 WAT 9139 20.174 66.546 116.594 1.00 0.00 H TER 6237 WAT 9139 ATOM 6237 O WAT 9140 86.098 14.970 86.132 1.00 0.00 O ATOM 6238 H1 WAT 9140 86.712 15.096 86.856 1.00 0.00 H ATOM 6239 H2 WAT 9140 86.595 14.477 85.479 1.00 0.00 H TER 6241 WAT 9140 ATOM 6241 O WAT 9141 76.306 121.421 138.219 1.00 0.00 O ATOM 6242 H1 WAT 9141 75.673 120.846 138.649 1.00 0.00 H ATOM 6243 H2 WAT 9141 77.157 121.117 138.534 1.00 0.00 H TER 6245 WAT 9141 ATOM 6245 O WAT 9142 8.235 23.471 2.736 1.00 0.00 O ATOM 6246 H1 WAT 9142 7.297 23.660 2.720 1.00 0.00 H ATOM 6247 H2 WAT 9142 8.574 23.999 3.459 1.00 0.00 H TER 6249 WAT 9142 ATOM 6249 O WAT 9143 52.857 104.744 144.214 1.00 0.00 O ATOM 6250 H1 WAT 9143 52.475 104.233 144.927 1.00 0.00 H ATOM 6251 H2 WAT 9143 53.086 104.094 143.549 1.00 0.00 H TER 6253 WAT 9143 ATOM 6253 O WAT 9144 112.851 82.101 116.989 1.00 0.00 O ATOM 6254 H1 WAT 9144 112.999 81.779 116.100 1.00 0.00 H ATOM 6255 H2 WAT 9144 112.004 82.546 116.945 1.00 0.00 H TER 6257 WAT 9144 ATOM 6257 O WAT 9145 138.407 133.485 112.419 1.00 0.00 O ATOM 6258 H1 WAT 9145 138.988 132.801 112.087 1.00 0.00 H ATOM 6259 H2 WAT 9145 138.190 133.205 113.308 1.00 0.00 H TER 6261 WAT 9145 ATOM 6261 O WAT 9146 86.497 47.380 74.240 1.00 0.00 O ATOM 6262 H1 WAT 9146 86.522 47.009 73.358 1.00 0.00 H ATOM 6263 H2 WAT 9146 87.409 47.371 74.530 1.00 0.00 H TER 6265 WAT 9146 ATOM 6265 O WAT 9147 37.724 104.076 62.905 1.00 0.00 O ATOM 6266 H1 WAT 9147 38.031 104.360 62.045 1.00 0.00 H ATOM 6267 H2 WAT 9147 38.525 103.934 63.410 1.00 0.00 H TER 6269 WAT 9147 ATOM 6269 O WAT 9148 39.621 131.837 81.758 1.00 0.00 O ATOM 6270 H1 WAT 9148 39.640 132.071 80.830 1.00 0.00 H ATOM 6271 H2 WAT 9148 38.843 131.286 81.850 1.00 0.00 H TER 6273 WAT 9148 ATOM 6273 O WAT 9149 138.428 106.714 94.086 1.00 0.00 O ATOM 6274 H1 WAT 9149 137.844 106.502 93.359 1.00 0.00 H ATOM 6275 H2 WAT 9149 139.305 106.698 93.701 1.00 0.00 H TER 6277 WAT 9149 ATOM 6277 O WAT 9150 68.019 26.958 22.254 1.00 0.00 O ATOM 6278 H1 WAT 9150 68.398 26.684 23.089 1.00 0.00 H ATOM 6279 H2 WAT 9150 68.506 26.461 21.596 1.00 0.00 H TER 6281 WAT 9150 ATOM 6281 O WAT 9151 16.961 142.336 25.360 1.00 0.00 O ATOM 6282 H1 WAT 9151 17.562 141.846 24.800 1.00 0.00 H ATOM 6283 H2 WAT 9151 16.092 142.013 25.120 1.00 0.00 H TER 6285 WAT 9151 ATOM 6285 O WAT 9152 89.065 22.555 70.808 1.00 0.00 O ATOM 6286 H1 WAT 9152 89.297 23.139 71.530 1.00 0.00 H ATOM 6287 H2 WAT 9152 89.899 22.363 70.379 1.00 0.00 H TER 6289 WAT 9152 ATOM 6289 O WAT 9153 139.793 93.106 76.279 1.00 0.00 O ATOM 6290 H1 WAT 9153 138.868 93.304 76.422 1.00 0.00 H ATOM 6291 H2 WAT 9153 140.238 93.483 77.038 1.00 0.00 H TER 6293 WAT 9153 ATOM 6293 O WAT 9154 80.450 85.567 120.765 1.00 0.00 O ATOM 6294 H1 WAT 9154 80.286 84.928 120.071 1.00 0.00 H ATOM 6295 H2 WAT 9154 81.379 85.461 120.973 1.00 0.00 H TER 6297 WAT 9154 ATOM 6297 O WAT 9155 99.004 98.747 87.275 1.00 0.00 O ATOM 6298 H1 WAT 9155 99.598 99.218 87.859 1.00 0.00 H ATOM 6299 H2 WAT 9155 98.587 98.092 87.835 1.00 0.00 H TER 6301 WAT 9155 ATOM 6301 O WAT 9156 31.517 102.717 113.613 1.00 0.00 O ATOM 6302 H1 WAT 9156 31.827 102.061 112.988 1.00 0.00 H ATOM 6303 H2 WAT 9156 30.845 103.203 113.136 1.00 0.00 H TER 6305 WAT 9156 ATOM 6305 O WAT 9157 85.022 47.610 89.453 1.00 0.00 O ATOM 6306 H1 WAT 9157 85.615 47.618 90.204 1.00 0.00 H ATOM 6307 H2 WAT 9157 85.332 46.885 88.910 1.00 0.00 H TER 6309 WAT 9157 ATOM 6309 O WAT 9158 21.774 120.051 83.500 1.00 0.00 O ATOM 6310 H1 WAT 9158 22.229 120.827 83.173 1.00 0.00 H ATOM 6311 H2 WAT 9158 21.399 120.328 84.336 1.00 0.00 H TER 6313 WAT 9158 ATOM 6313 O WAT 9159 70.976 104.625 108.847 1.00 0.00 O ATOM 6314 H1 WAT 9159 71.685 105.113 109.266 1.00 0.00 H ATOM 6315 H2 WAT 9159 71.146 103.711 109.075 1.00 0.00 H TER 6317 WAT 9159 ATOM 6317 O WAT 9160 78.831 13.560 155.269 1.00 0.00 O ATOM 6318 H1 WAT 9160 79.516 13.043 154.845 1.00 0.00 H ATOM 6319 H2 WAT 9160 79.171 13.735 156.147 1.00 0.00 H TER 6321 WAT 9160 ATOM 6321 O WAT 9161 144.172 139.182 90.259 1.00 0.00 O ATOM 6322 H1 WAT 9161 144.922 139.037 89.682 1.00 0.00 H ATOM 6323 H2 WAT 9161 143.599 138.432 90.100 1.00 0.00 H TER 6325 WAT 9161 ATOM 6325 O WAT 9162 59.803 130.444 97.532 1.00 0.00 O ATOM 6326 H1 WAT 9162 59.737 131.350 97.231 1.00 0.00 H ATOM 6327 H2 WAT 9162 59.145 129.974 97.022 1.00 0.00 H TER 6329 WAT 9162 ATOM 6329 O WAT 9163 46.655 72.318 150.833 1.00 0.00 O ATOM 6330 H1 WAT 9163 47.505 71.996 150.534 1.00 0.00 H ATOM 6331 H2 WAT 9163 46.700 73.266 150.708 1.00 0.00 H TER 6333 WAT 9163 ATOM 6333 O WAT 9164 102.376 130.069 2.680 1.00 0.00 O ATOM 6334 H1 WAT 9164 102.828 129.244 2.501 1.00 0.00 H ATOM 6335 H2 WAT 9164 102.692 130.667 2.003 1.00 0.00 H TER 6337 WAT 9164 ATOM 6337 O WAT 9165 21.797 61.839 131.272 1.00 0.00 O ATOM 6338 H1 WAT 9165 21.712 61.130 131.909 1.00 0.00 H ATOM 6339 H2 WAT 9165 20.896 62.044 131.020 1.00 0.00 H TER 6341 WAT 9165 ATOM 6341 O WAT 9166 23.920 99.723 28.278 1.00 0.00 O ATOM 6342 H1 WAT 9166 23.674 100.646 28.211 1.00 0.00 H ATOM 6343 H2 WAT 9166 24.759 99.732 28.739 1.00 0.00 H TER 6345 WAT 9166 ATOM 6345 O WAT 9167 104.624 80.417 68.498 1.00 0.00 O ATOM 6346 H1 WAT 9167 103.931 81.064 68.368 1.00 0.00 H ATOM 6347 H2 WAT 9167 105.132 80.444 67.688 1.00 0.00 H TER 6349 WAT 9167 ATOM 6349 O WAT 9168 81.012 84.958 19.470 1.00 0.00 O ATOM 6350 H1 WAT 9168 81.355 84.289 18.878 1.00 0.00 H ATOM 6351 H2 WAT 9168 81.666 85.020 20.166 1.00 0.00 H TER 6353 WAT 9168 ATOM 6353 O WAT 9169 93.924 50.366 110.972 1.00 0.00 O ATOM 6354 H1 WAT 9169 92.974 50.311 110.867 1.00 0.00 H ATOM 6355 H2 WAT 9169 94.255 49.561 110.574 1.00 0.00 H TER 6357 WAT 9169 ATOM 6357 O WAT 9170 2.216 58.893 89.584 1.00 0.00 O ATOM 6358 H1 WAT 9170 2.711 58.108 89.348 1.00 0.00 H ATOM 6359 H2 WAT 9170 2.861 59.600 89.555 1.00 0.00 H TER 6361 WAT 9170 ATOM 6361 O WAT 9171 36.496 51.070 -0.227 1.00 0.00 O ATOM 6362 H1 WAT 9171 37.164 50.851 0.423 1.00 0.00 H ATOM 6363 H2 WAT 9171 35.696 51.191 0.284 1.00 0.00 H TER 6365 WAT 9171 ATOM 6365 O WAT 9172 82.979 57.721 121.737 1.00 0.00 O ATOM 6366 H1 WAT 9172 82.233 58.130 121.299 1.00 0.00 H ATOM 6367 H2 WAT 9172 83.739 58.213 121.425 1.00 0.00 H TER 6369 WAT 9172 ATOM 6369 O WAT 9173 100.263 131.965 67.920 1.00 0.00 O ATOM 6370 H1 WAT 9173 100.315 131.307 68.614 1.00 0.00 H ATOM 6371 H2 WAT 9173 101.154 132.309 67.849 1.00 0.00 H TER 6373 WAT 9173 ATOM 6373 O WAT 9174 145.641 43.628 133.027 1.00 0.00 O ATOM 6374 H1 WAT 9174 145.125 44.378 133.325 1.00 0.00 H ATOM 6375 H2 WAT 9174 145.473 42.948 133.678 1.00 0.00 H TER 6377 WAT 9174 ATOM 6377 O WAT 9175 145.353 74.952 61.178 1.00 0.00 O ATOM 6378 H1 WAT 9175 146.040 75.516 60.823 1.00 0.00 H ATOM 6379 H2 WAT 9175 145.359 74.181 60.612 1.00 0.00 H TER 6381 WAT 9175 ATOM 6381 O WAT 9176 31.170 111.385 133.439 1.00 0.00 O ATOM 6382 H1 WAT 9176 30.486 111.853 133.918 1.00 0.00 H ATOM 6383 H2 WAT 9176 31.310 111.908 132.649 1.00 0.00 H TER 6385 WAT 9176 ATOM 6385 O WAT 9177 100.631 134.524 112.811 1.00 0.00 O ATOM 6386 H1 WAT 9177 100.309 135.357 112.465 1.00 0.00 H ATOM 6387 H2 WAT 9177 99.839 134.016 112.987 1.00 0.00 H TER 6389 WAT 9177 ATOM 6389 O WAT 9178 139.673 102.293 14.875 1.00 0.00 O ATOM 6390 H1 WAT 9178 139.501 102.611 15.761 1.00 0.00 H ATOM 6391 H2 WAT 9178 138.820 102.324 14.440 1.00 0.00 H TER 6393 WAT 9178 ATOM 6393 O WAT 9179 57.164 131.840 7.332 1.00 0.00 O ATOM 6394 H1 WAT 9179 57.131 131.811 6.375 1.00 0.00 H ATOM 6395 H2 WAT 9179 57.396 130.949 7.591 1.00 0.00 H TER 6397 WAT 9179 ATOM 6397 O WAT 9180 88.049 141.958 111.295 1.00 0.00 O ATOM 6398 H1 WAT 9180 87.640 141.212 111.732 1.00 0.00 H ATOM 6399 H2 WAT 9180 88.989 141.787 111.359 1.00 0.00 H TER 6401 WAT 9180 ATOM 6401 O WAT 9181 63.975 31.184 73.530 1.00 0.00 O ATOM 6402 H1 WAT 9181 64.773 31.584 73.875 1.00 0.00 H ATOM 6403 H2 WAT 9181 64.091 31.200 72.580 1.00 0.00 H TER 6405 WAT 9181 ATOM 6405 O WAT 9182 104.164 6.303 56.331 1.00 0.00 O ATOM 6406 H1 WAT 9182 103.502 5.859 55.801 1.00 0.00 H ATOM 6407 H2 WAT 9182 104.170 5.823 57.159 1.00 0.00 H TER 6409 WAT 9182 ATOM 6409 O WAT 9183 118.431 85.912 75.576 1.00 0.00 O ATOM 6410 H1 WAT 9183 118.641 85.151 76.117 1.00 0.00 H ATOM 6411 H2 WAT 9183 118.995 85.824 74.808 1.00 0.00 H TER 6413 WAT 9183 ATOM 6413 O WAT 9184 29.811 107.411 120.285 1.00 0.00 O ATOM 6414 H1 WAT 9184 30.043 108.302 120.548 1.00 0.00 H ATOM 6415 H2 WAT 9184 29.554 106.980 121.101 1.00 0.00 H TER 6417 WAT 9184 ATOM 6417 O WAT 9185 70.395 49.682 76.849 1.00 0.00 O ATOM 6418 H1 WAT 9185 69.930 49.309 76.100 1.00 0.00 H ATOM 6419 H2 WAT 9185 69.712 50.113 77.363 1.00 0.00 H TER 6421 WAT 9185 ATOM 6421 O WAT 9186 101.039 45.870 10.187 1.00 0.00 O ATOM 6422 H1 WAT 9186 100.551 45.249 10.727 1.00 0.00 H ATOM 6423 H2 WAT 9186 101.073 46.669 10.713 1.00 0.00 H TER 6425 WAT 9186 ATOM 6425 O WAT 9187 91.542 74.925 74.907 1.00 0.00 O ATOM 6426 H1 WAT 9187 91.126 75.447 74.222 1.00 0.00 H ATOM 6427 H2 WAT 9187 91.148 74.057 74.818 1.00 0.00 H TER 6429 WAT 9187 ATOM 6429 O WAT 9188 33.478 85.728 7.624 1.00 0.00 O ATOM 6430 H1 WAT 9188 32.578 86.006 7.795 1.00 0.00 H ATOM 6431 H2 WAT 9188 33.560 84.890 8.080 1.00 0.00 H TER 6433 WAT 9188 ATOM 6433 O WAT 9189 37.854 122.563 138.490 1.00 0.00 O ATOM 6434 H1 WAT 9189 37.642 121.870 137.865 1.00 0.00 H ATOM 6435 H2 WAT 9189 38.605 123.013 138.103 1.00 0.00 H TER 6437 WAT 9189 ATOM 6437 O WAT 9190 32.670 58.563 136.055 1.00 0.00 O ATOM 6438 H1 WAT 9190 32.896 59.470 136.263 1.00 0.00 H ATOM 6439 H2 WAT 9190 32.889 58.073 136.848 1.00 0.00 H TER 6441 WAT 9190 ATOM 6441 O WAT 9191 30.761 133.934 142.421 1.00 0.00 O ATOM 6442 H1 WAT 9191 29.874 133.946 142.783 1.00 0.00 H ATOM 6443 H2 WAT 9191 31.142 133.120 142.748 1.00 0.00 H TER 6445 WAT 9191 ATOM 6445 O WAT 9192 87.237 80.384 115.372 1.00 0.00 O ATOM 6446 H1 WAT 9192 87.187 79.737 116.076 1.00 0.00 H ATOM 6447 H2 WAT 9192 86.362 80.771 115.341 1.00 0.00 H TER 6449 WAT 9192 ATOM 6449 O WAT 9193 68.172 78.150 150.718 1.00 0.00 O ATOM 6450 H1 WAT 9193 68.830 78.229 151.409 1.00 0.00 H ATOM 6451 H2 WAT 9193 67.454 77.666 151.125 1.00 0.00 H TER 6453 WAT 9193 ATOM 6453 O WAT 9194 42.155 107.640 75.245 1.00 0.00 O ATOM 6454 H1 WAT 9194 41.371 107.461 74.725 1.00 0.00 H ATOM 6455 H2 WAT 9194 42.716 106.877 75.103 1.00 0.00 H TER 6457 WAT 9194 ATOM 6457 O WAT 9195 77.597 78.676 138.401 1.00 0.00 O ATOM 6458 H1 WAT 9195 77.860 79.549 138.110 1.00 0.00 H ATOM 6459 H2 WAT 9195 76.826 78.470 137.873 1.00 0.00 H TER 6461 WAT 9195 ATOM 6461 O WAT 9196 3.699 41.497 110.954 1.00 0.00 O ATOM 6462 H1 WAT 9196 3.477 41.139 111.813 1.00 0.00 H ATOM 6463 H2 WAT 9196 4.199 40.801 110.526 1.00 0.00 H TER 6465 WAT 9196 ATOM 6465 O WAT 9197 17.829 141.364 155.234 1.00 0.00 O ATOM 6466 H1 WAT 9197 17.927 141.474 156.180 1.00 0.00 H ATOM 6467 H2 WAT 9197 18.723 141.405 154.894 1.00 0.00 H TER 6469 WAT 9197 ATOM 6469 O WAT 9198 96.170 105.866 115.104 1.00 0.00 O ATOM 6470 H1 WAT 9198 95.855 105.101 115.585 1.00 0.00 H ATOM 6471 H2 WAT 9198 95.422 106.463 115.088 1.00 0.00 H TER 6473 WAT 9198 ATOM 6473 O WAT 9199 88.177 44.159 12.956 1.00 0.00 O ATOM 6474 H1 WAT 9199 88.114 43.474 13.622 1.00 0.00 H ATOM 6475 H2 WAT 9199 88.308 44.966 13.454 1.00 0.00 H TER 6477 WAT 9199 ATOM 6477 O WAT 9200 7.196 86.162 147.396 1.00 0.00 O ATOM 6478 H1 WAT 9200 6.321 86.219 147.012 1.00 0.00 H ATOM 6479 H2 WAT 9200 7.777 86.021 146.648 1.00 0.00 H TER 6481 WAT 9200 ATOM 6481 O WAT 9201 104.666 56.775 101.424 1.00 0.00 O ATOM 6482 H1 WAT 9201 104.110 57.062 100.700 1.00 0.00 H ATOM 6483 H2 WAT 9201 104.287 57.194 102.197 1.00 0.00 H TER 6485 WAT 9201 ATOM 6485 O WAT 9202 108.712 88.591 60.689 1.00 0.00 O ATOM 6486 H1 WAT 9202 109.479 88.032 60.564 1.00 0.00 H ATOM 6487 H2 WAT 9202 108.407 88.780 59.802 1.00 0.00 H TER 6489 WAT 9202 ATOM 6489 O WAT 9203 125.859 141.575 70.427 1.00 0.00 O ATOM 6490 H1 WAT 9203 125.054 141.886 70.841 1.00 0.00 H ATOM 6491 H2 WAT 9203 125.990 140.697 70.787 1.00 0.00 H TER 6493 WAT 9203 ATOM 6493 O WAT 9204 81.656 54.915 16.578 1.00 0.00 O ATOM 6494 H1 WAT 9204 82.471 54.895 16.075 1.00 0.00 H ATOM 6495 H2 WAT 9204 81.912 55.258 17.434 1.00 0.00 H TER 6497 WAT 9204 ATOM 6497 O WAT 9205 116.287 20.261 52.963 1.00 0.00 O ATOM 6498 H1 WAT 9205 116.831 19.667 53.480 1.00 0.00 H ATOM 6499 H2 WAT 9205 115.590 19.705 52.613 1.00 0.00 H TER 6501 WAT 9205 ATOM 6501 O WAT 9206 103.933 100.608 84.680 1.00 0.00 O ATOM 6502 H1 WAT 9206 104.852 100.340 84.694 1.00 0.00 H ATOM 6503 H2 WAT 9206 103.458 99.852 85.026 1.00 0.00 H TER 6505 WAT 9206 ATOM 6505 O WAT 9207 17.248 41.383 132.459 1.00 0.00 O ATOM 6506 H1 WAT 9207 18.201 41.348 132.377 1.00 0.00 H ATOM 6507 H2 WAT 9207 16.938 41.563 131.571 1.00 0.00 H TER 6509 WAT 9207 ATOM 6509 O WAT 9208 66.617 49.379 113.083 1.00 0.00 O ATOM 6510 H1 WAT 9208 65.812 49.691 113.494 1.00 0.00 H ATOM 6511 H2 WAT 9208 66.396 49.297 112.155 1.00 0.00 H TER 6513 WAT 9208 ATOM 6513 O WAT 9209 7.597 28.796 76.546 1.00 0.00 O ATOM 6514 H1 WAT 9209 7.542 29.716 76.804 1.00 0.00 H ATOM 6515 H2 WAT 9209 8.424 28.731 76.068 1.00 0.00 H TER 6517 WAT 9209 ATOM 6517 O WAT 9210 33.729 62.137 12.470 1.00 0.00 O ATOM 6518 H1 WAT 9210 32.775 62.122 12.543 1.00 0.00 H ATOM 6519 H2 WAT 9210 34.026 62.530 13.290 1.00 0.00 H TER 6521 WAT 9210 ATOM 6521 O WAT 9211 28.931 101.321 23.368 1.00 0.00 O ATOM 6522 H1 WAT 9211 29.652 101.745 23.833 1.00 0.00 H ATOM 6523 H2 WAT 9211 29.353 100.649 22.834 1.00 0.00 H TER 6525 WAT 9211 ATOM 6525 O WAT 9212 59.120 100.938 79.773 1.00 0.00 O ATOM 6526 H1 WAT 9212 59.984 101.319 79.930 1.00 0.00 H ATOM 6527 H2 WAT 9212 58.746 101.472 79.072 1.00 0.00 H TER 6529 WAT 9212 ATOM 6529 O WAT 9213 11.611 25.821 87.250 1.00 0.00 O ATOM 6530 H1 WAT 9213 11.435 26.274 88.075 1.00 0.00 H ATOM 6531 H2 WAT 9213 10.915 26.115 86.662 1.00 0.00 H TER 6533 WAT 9213 ATOM 6533 O WAT 9214 54.043 3.865 96.045 1.00 0.00 O ATOM 6534 H1 WAT 9214 54.815 3.985 95.493 1.00 0.00 H ATOM 6535 H2 WAT 9214 53.598 3.103 95.674 1.00 0.00 H TER 6537 WAT 9214 ATOM 6537 O WAT 9215 64.601 52.858 133.717 1.00 0.00 O ATOM 6538 H1 WAT 9215 63.775 52.490 134.031 1.00 0.00 H ATOM 6539 H2 WAT 9215 65.163 52.881 134.491 1.00 0.00 H TER 6541 WAT 9215 ATOM 6541 O WAT 9216 58.963 74.026 144.539 1.00 0.00 O ATOM 6542 H1 WAT 9216 58.399 74.797 144.596 1.00 0.00 H ATOM 6543 H2 WAT 9216 58.443 73.384 144.056 1.00 0.00 H TER 6545 WAT 9216 ATOM 6545 O WAT 9217 11.192 20.539 80.785 1.00 0.00 O ATOM 6546 H1 WAT 9217 10.535 20.102 80.244 1.00 0.00 H ATOM 6547 H2 WAT 9217 10.691 21.155 81.319 1.00 0.00 H TER 6549 WAT 9217 ATOM 6549 O WAT 9218 79.397 103.433 129.984 1.00 0.00 O ATOM 6550 H1 WAT 9218 78.864 103.417 130.779 1.00 0.00 H ATOM 6551 H2 WAT 9218 80.220 103.016 130.238 1.00 0.00 H TER 6553 WAT 9218 ATOM 6553 O WAT 9219 113.075 129.033 63.995 1.00 0.00 O ATOM 6554 H1 WAT 9219 113.361 129.859 63.606 1.00 0.00 H ATOM 6555 H2 WAT 9219 112.936 128.452 63.246 1.00 0.00 H TER 6557 WAT 9219 ATOM 6557 O WAT 9220 72.306 130.619 107.064 1.00 0.00 O ATOM 6558 H1 WAT 9220 72.573 130.829 106.169 1.00 0.00 H ATOM 6559 H2 WAT 9220 71.595 131.232 107.251 1.00 0.00 H TER 6561 WAT 9220 ATOM 6561 O WAT 9221 24.706 33.403 92.400 1.00 0.00 O ATOM 6562 H1 WAT 9221 24.563 33.823 91.552 1.00 0.00 H ATOM 6563 H2 WAT 9221 25.400 32.765 92.237 1.00 0.00 H TER 6565 WAT 9221 ATOM 6565 O WAT 9222 18.639 1.201 125.390 1.00 0.00 O ATOM 6566 H1 WAT 9222 19.113 0.377 125.280 1.00 0.00 H ATOM 6567 H2 WAT 9222 19.062 1.804 124.779 1.00 0.00 H TER 6569 WAT 9222 ATOM 6569 O WAT 9223 120.000 39.900 86.295 1.00 0.00 O ATOM 6570 H1 WAT 9223 119.351 40.596 86.395 1.00 0.00 H ATOM 6571 H2 WAT 9223 120.128 39.825 85.349 1.00 0.00 H TER 6573 WAT 9223 ATOM 6573 O WAT 9224 134.502 61.532 116.290 1.00 0.00 O ATOM 6574 H1 WAT 9224 135.137 62.245 116.219 1.00 0.00 H ATOM 6575 H2 WAT 9224 134.193 61.397 115.395 1.00 0.00 H TER 6577 WAT 9224 ATOM 6577 O WAT 9225 102.565 80.256 65.574 1.00 0.00 O ATOM 6578 H1 WAT 9225 102.103 79.640 66.143 1.00 0.00 H ATOM 6579 H2 WAT 9225 101.961 80.411 64.848 1.00 0.00 H TER 6581 WAT 9225 ATOM 6581 O WAT 9226 13.703 108.220 74.241 1.00 0.00 O ATOM 6582 H1 WAT 9226 14.607 108.431 74.476 1.00 0.00 H ATOM 6583 H2 WAT 9226 13.631 107.277 74.387 1.00 0.00 H TER 6585 WAT 9226 ATOM 6585 O WAT 9227 38.617 54.842 64.723 1.00 0.00 O ATOM 6586 H1 WAT 9227 38.034 55.062 63.996 1.00 0.00 H ATOM 6587 H2 WAT 9227 39.371 54.425 64.307 1.00 0.00 H TER 6589 WAT 9227 ATOM 6589 O WAT 9228 65.970 7.155 121.708 1.00 0.00 O ATOM 6590 H1 WAT 9228 65.698 7.966 121.280 1.00 0.00 H ATOM 6591 H2 WAT 9228 65.690 6.462 121.110 1.00 0.00 H TER 6593 WAT 9228 ATOM 6593 O WAT 9229 109.951 136.855 79.671 1.00 0.00 O ATOM 6594 H1 WAT 9229 109.384 137.167 80.376 1.00 0.00 H ATOM 6595 H2 WAT 9229 110.190 137.646 79.188 1.00 0.00 H TER 6597 WAT 9229 ATOM 6597 O WAT 9230 23.064 74.926 157.779 1.00 0.00 O ATOM 6598 H1 WAT 9230 23.982 75.075 157.552 1.00 0.00 H ATOM 6599 H2 WAT 9230 23.098 74.415 158.588 1.00 0.00 H TER 6601 WAT 9230 ATOM 6601 O WAT 9231 133.316 31.371 103.143 1.00 0.00 O ATOM 6602 H1 WAT 9231 133.169 32.002 102.438 1.00 0.00 H ATOM 6603 H2 WAT 9231 132.831 31.727 103.888 1.00 0.00 H TER 6605 WAT 9231 ATOM 6605 O WAT 9232 51.038 126.740 113.255 1.00 0.00 O ATOM 6606 H1 WAT 9232 50.747 127.061 112.402 1.00 0.00 H ATOM 6607 H2 WAT 9232 50.239 126.432 113.681 1.00 0.00 H TER 6609 WAT 9232 ATOM 6609 O WAT 9233 35.207 109.209 120.551 1.00 0.00 O ATOM 6610 H1 WAT 9233 34.473 109.586 121.037 1.00 0.00 H ATOM 6611 H2 WAT 9233 34.806 108.548 119.987 1.00 0.00 H TER 6613 WAT 9233 ATOM 6613 O WAT 9234 31.166 120.475 144.823 1.00 0.00 O ATOM 6614 H1 WAT 9234 30.242 120.406 145.066 1.00 0.00 H ATOM 6615 H2 WAT 9234 31.641 120.266 145.627 1.00 0.00 H TER 6617 WAT 9234 ATOM 6617 O WAT 9235 80.758 64.033 72.519 1.00 0.00 O ATOM 6618 H1 WAT 9235 80.105 63.741 71.883 1.00 0.00 H ATOM 6619 H2 WAT 9235 81.311 64.644 72.033 1.00 0.00 H TER 6621 WAT 9235 ATOM 6621 O WAT 9236 140.010 59.731 114.680 1.00 0.00 O ATOM 6622 H1 WAT 9236 140.428 60.281 115.343 1.00 0.00 H ATOM 6623 H2 WAT 9236 139.777 58.929 115.147 1.00 0.00 H TER 6625 WAT 9236 ATOM 6625 O WAT 9237 15.563 112.786 137.659 1.00 0.00 O ATOM 6626 H1 WAT 9237 14.811 113.060 137.134 1.00 0.00 H ATOM 6627 H2 WAT 9237 15.322 113.012 138.558 1.00 0.00 H TER 6629 WAT 9237 ATOM 6629 O WAT 9238 136.679 63.806 154.940 1.00 0.00 O ATOM 6630 H1 WAT 9238 137.104 63.265 154.274 1.00 0.00 H ATOM 6631 H2 WAT 9238 137.401 64.142 155.472 1.00 0.00 H TER 6633 WAT 9238 ATOM 6633 O WAT 9239 101.473 83.332 148.161 1.00 0.00 O ATOM 6634 H1 WAT 9239 100.614 83.683 148.398 1.00 0.00 H ATOM 6635 H2 WAT 9239 102.079 84.055 148.321 1.00 0.00 H TER 6637 WAT 9239 ATOM 6637 O WAT 9240 44.258 46.465 121.363 1.00 0.00 O ATOM 6638 H1 WAT 9240 44.496 47.061 122.073 1.00 0.00 H ATOM 6639 H2 WAT 9240 44.920 46.620 120.688 1.00 0.00 H TER 6641 WAT 9240 ATOM 6641 O WAT 9241 82.149 74.212 17.756 1.00 0.00 O ATOM 6642 H1 WAT 9241 82.938 74.315 17.223 1.00 0.00 H ATOM 6643 H2 WAT 9241 82.356 74.657 18.578 1.00 0.00 H TER 6645 WAT 9241 ATOM 6645 O WAT 9242 6.990 61.943 138.692 1.00 0.00 O ATOM 6646 H1 WAT 9242 6.955 62.458 137.886 1.00 0.00 H ATOM 6647 H2 WAT 9242 6.808 62.574 139.388 1.00 0.00 H TER 6649 WAT 9242 ATOM 6649 O WAT 9243 98.491 74.195 95.086 1.00 0.00 O ATOM 6650 H1 WAT 9243 99.312 74.651 95.269 1.00 0.00 H ATOM 6651 H2 WAT 9243 97.991 74.809 94.548 1.00 0.00 H TER 6653 WAT 9243 ATOM 6653 O WAT 9244 47.689 137.013 126.727 1.00 0.00 O ATOM 6654 H1 WAT 9244 47.207 136.193 126.625 1.00 0.00 H ATOM 6655 H2 WAT 9244 47.912 137.273 125.833 1.00 0.00 H TER 6657 WAT 9244 ATOM 6657 O WAT 9245 94.897 18.199 78.665 1.00 0.00 O ATOM 6658 H1 WAT 9245 94.621 18.745 77.929 1.00 0.00 H ATOM 6659 H2 WAT 9245 95.846 18.321 78.710 1.00 0.00 H TER 6661 WAT 9245 ATOM 6661 O WAT 9246 3.215 30.133 10.292 1.00 0.00 O ATOM 6662 H1 WAT 9246 2.811 30.938 9.966 1.00 0.00 H ATOM 6663 H2 WAT 9246 3.536 29.691 9.506 1.00 0.00 H TER 6665 WAT 9246 ATOM 6665 O WAT 9247 143.609 67.230 4.806 1.00 0.00 O ATOM 6666 H1 WAT 9247 143.599 68.164 5.017 1.00 0.00 H ATOM 6667 H2 WAT 9247 144.067 67.179 3.967 1.00 0.00 H TER 6669 WAT 9247 ATOM 6669 O WAT 9248 5.494 97.294 129.811 1.00 0.00 O ATOM 6670 H1 WAT 9248 5.200 97.439 128.911 1.00 0.00 H ATOM 6671 H2 WAT 9248 5.589 98.174 130.176 1.00 0.00 H TER 6673 WAT 9248 ATOM 6673 O WAT 9249 67.982 27.476 76.842 1.00 0.00 O ATOM 6674 H1 WAT 9249 67.730 27.297 77.748 1.00 0.00 H ATOM 6675 H2 WAT 9249 68.671 26.839 76.654 1.00 0.00 H TER 6677 WAT 9249 ATOM 6677 O WAT 9250 78.613 122.212 91.096 1.00 0.00 O ATOM 6678 H1 WAT 9250 77.673 122.246 91.272 1.00 0.00 H ATOM 6679 H2 WAT 9250 78.680 122.259 90.143 1.00 0.00 H TER 6681 WAT 9250 ATOM 6681 O WAT 9251 66.516 22.470 15.873 1.00 0.00 O ATOM 6682 H1 WAT 9251 66.174 22.971 16.613 1.00 0.00 H ATOM 6683 H2 WAT 9251 67.402 22.223 16.140 1.00 0.00 H TER 6685 WAT 9251 ATOM 6685 O WAT 9252 17.517 31.531 102.292 1.00 0.00 O ATOM 6686 H1 WAT 9252 17.114 32.254 101.811 1.00 0.00 H ATOM 6687 H2 WAT 9252 18.098 31.115 101.655 1.00 0.00 H TER 6689 WAT 9252 ATOM 6689 O WAT 9253 66.919 135.093 109.629 1.00 0.00 O ATOM 6690 H1 WAT 9253 66.500 134.254 109.440 1.00 0.00 H ATOM 6691 H2 WAT 9253 66.617 135.319 110.508 1.00 0.00 H TER 6693 WAT 9253 ATOM 6693 O WAT 9254 10.040 32.483 1.495 1.00 0.00 O ATOM 6694 H1 WAT 9254 9.094 32.339 1.534 1.00 0.00 H ATOM 6695 H2 WAT 9254 10.247 32.935 2.313 1.00 0.00 H TER 6697 WAT 9254 ATOM 6697 O WAT 9255 29.781 142.391 81.298 1.00 0.00 O ATOM 6698 H1 WAT 9255 28.952 142.037 80.975 1.00 0.00 H ATOM 6699 H2 WAT 9255 30.412 141.685 81.160 1.00 0.00 H TER 6701 WAT 9255 ATOM 6701 O WAT 9256 128.770 14.394 119.317 1.00 0.00 O ATOM 6702 H1 WAT 9256 128.940 15.107 118.701 1.00 0.00 H ATOM 6703 H2 WAT 9256 128.126 14.754 119.927 1.00 0.00 H TER 6705 WAT 9256 ATOM 6705 O WAT 9257 83.433 106.068 128.625 1.00 0.00 O ATOM 6706 H1 WAT 9257 83.636 105.682 127.773 1.00 0.00 H ATOM 6707 H2 WAT 9257 84.066 106.779 128.722 1.00 0.00 H TER 6709 WAT 9257 ATOM 6709 O WAT 9258 108.337 20.897 81.232 1.00 0.00 O ATOM 6710 H1 WAT 9258 107.385 20.950 81.319 1.00 0.00 H ATOM 6711 H2 WAT 9258 108.595 20.202 81.837 1.00 0.00 H TER 6713 WAT 9258 ATOM 6713 O WAT 9259 -0.187 83.258 89.191 1.00 0.00 O ATOM 6714 H1 WAT 9259 0.583 83.827 89.209 1.00 0.00 H ATOM 6715 H2 WAT 9259 0.054 82.510 89.738 1.00 0.00 H TER 6717 WAT 9259 ATOM 6717 O WAT 9260 99.281 93.795 101.631 1.00 0.00 O ATOM 6718 H1 WAT 9260 99.621 94.688 101.674 1.00 0.00 H ATOM 6719 H2 WAT 9260 98.459 93.827 102.121 1.00 0.00 H TER 6721 WAT 9260 ATOM 6721 O WAT 9261 102.178 35.130 68.724 1.00 0.00 O ATOM 6722 H1 WAT 9261 102.614 35.979 68.796 1.00 0.00 H ATOM 6723 H2 WAT 9261 101.377 35.313 68.233 1.00 0.00 H TER 6725 WAT 9261 ATOM 6725 O WAT 9262 2.085 84.375 78.343 1.00 0.00 O ATOM 6726 H1 WAT 9262 2.724 84.346 79.055 1.00 0.00 H ATOM 6727 H2 WAT 9262 2.069 83.482 77.999 1.00 0.00 H TER 6729 WAT 9262 ATOM 6729 O WAT 9263 52.433 19.887 118.032 1.00 0.00 O ATOM 6730 H1 WAT 9263 52.120 20.791 118.017 1.00 0.00 H ATOM 6731 H2 WAT 9263 51.721 19.394 118.439 1.00 0.00 H TER 6733 WAT 9263 ATOM 6733 O WAT 9264 127.592 37.276 18.133 1.00 0.00 O ATOM 6734 H1 WAT 9264 126.688 37.583 18.191 1.00 0.00 H ATOM 6735 H2 WAT 9264 127.918 37.645 17.311 1.00 0.00 H TER 6737 WAT 9264 ATOM 6737 O WAT 9265 9.042 81.862 125.641 1.00 0.00 O ATOM 6738 H1 WAT 9265 9.927 81.580 125.409 1.00 0.00 H ATOM 6739 H2 WAT 9265 8.789 82.460 124.938 1.00 0.00 H TER 6741 WAT 9265 ATOM 6741 O WAT 9266 125.047 79.719 157.708 1.00 0.00 O ATOM 6742 H1 WAT 9266 124.971 80.568 157.273 1.00 0.00 H ATOM 6743 H2 WAT 9266 124.430 79.768 158.438 1.00 0.00 H TER 6745 WAT 9266 ATOM 6745 O WAT 9267 127.372 134.292 8.565 1.00 0.00 O ATOM 6746 H1 WAT 9267 127.891 134.492 9.344 1.00 0.00 H ATOM 6747 H2 WAT 9267 126.861 135.087 8.408 1.00 0.00 H TER 6749 WAT 9267 ATOM 6749 O WAT 9268 52.558 83.007 69.366 1.00 0.00 O ATOM 6750 H1 WAT 9268 52.892 83.323 68.526 1.00 0.00 H ATOM 6751 H2 WAT 9268 53.342 82.817 69.880 1.00 0.00 H TER 6753 WAT 9268 ATOM 6753 O WAT 9269 13.572 28.881 107.373 1.00 0.00 O ATOM 6754 H1 WAT 9269 13.198 28.440 108.136 1.00 0.00 H ATOM 6755 H2 WAT 9269 13.078 29.698 107.302 1.00 0.00 H TER 6757 WAT 9269 ATOM 6757 O WAT 9270 124.421 44.830 18.718 1.00 0.00 O ATOM 6758 H1 WAT 9270 124.007 45.628 18.390 1.00 0.00 H ATOM 6759 H2 WAT 9270 123.721 44.369 19.180 1.00 0.00 H TER 6761 WAT 9270 ATOM 6761 O WAT 9271 107.811 26.663 136.019 1.00 0.00 O ATOM 6762 H1 WAT 9271 108.114 26.705 135.112 1.00 0.00 H ATOM 6763 H2 WAT 9271 107.209 27.402 136.105 1.00 0.00 H TER 6765 WAT 9271 ATOM 6765 O WAT 9272 11.403 17.318 26.943 1.00 0.00 O ATOM 6766 H1 WAT 9272 12.259 17.062 27.286 1.00 0.00 H ATOM 6767 H2 WAT 9272 10.996 16.494 26.675 1.00 0.00 H TER 6769 WAT 9272 ATOM 6769 O WAT 9273 123.163 130.199 138.366 1.00 0.00 O ATOM 6770 H1 WAT 9273 122.656 129.950 137.593 1.00 0.00 H ATOM 6771 H2 WAT 9273 124.043 130.368 138.030 1.00 0.00 H TER 6773 WAT 9273 ATOM 6773 O WAT 9274 141.840 15.826 95.212 1.00 0.00 O ATOM 6774 H1 WAT 9274 142.269 15.677 96.054 1.00 0.00 H ATOM 6775 H2 WAT 9274 141.040 16.303 95.432 1.00 0.00 H TER 6777 WAT 9274 ATOM 6777 O WAT 9275 53.090 72.760 85.516 1.00 0.00 O ATOM 6778 H1 WAT 9275 53.642 73.345 86.036 1.00 0.00 H ATOM 6779 H2 WAT 9275 52.795 73.299 84.782 1.00 0.00 H TER 6781 WAT 9275 ATOM 6781 O WAT 9276 20.838 21.126 88.127 1.00 0.00 O ATOM 6782 H1 WAT 9276 21.164 20.226 88.150 1.00 0.00 H ATOM 6783 H2 WAT 9276 20.834 21.355 87.198 1.00 0.00 H TER 6785 WAT 9276 ATOM 6785 O WAT 9277 52.596 85.066 66.398 1.00 0.00 O ATOM 6786 H1 WAT 9277 52.545 85.757 67.059 1.00 0.00 H ATOM 6787 H2 WAT 9277 53.534 84.913 66.284 1.00 0.00 H TER 6789 WAT 9277 ATOM 6789 O WAT 9278 111.149 16.904 134.184 1.00 0.00 O ATOM 6790 H1 WAT 9278 111.300 16.013 133.867 1.00 0.00 H ATOM 6791 H2 WAT 9278 110.350 16.839 134.707 1.00 0.00 H TER 6793 WAT 9278 ATOM 6793 O WAT 9279 138.471 42.007 142.068 1.00 0.00 O ATOM 6794 H1 WAT 9279 138.458 42.656 142.772 1.00 0.00 H ATOM 6795 H2 WAT 9279 138.233 41.185 142.496 1.00 0.00 H TER 6797 WAT 9279 ATOM 6797 O WAT 9280 15.055 144.349 63.988 1.00 0.00 O ATOM 6798 H1 WAT 9280 14.528 144.750 63.297 1.00 0.00 H ATOM 6799 H2 WAT 9280 15.939 144.683 63.840 1.00 0.00 H TER 6801 WAT 9280 ATOM 6801 O WAT 9281 44.925 105.358 72.144 1.00 0.00 O ATOM 6802 H1 WAT 9281 43.992 105.180 72.025 1.00 0.00 H ATOM 6803 H2 WAT 9281 44.952 106.187 72.622 1.00 0.00 H TER 6805 WAT 9281 ATOM 6805 O WAT 9282 54.846 43.255 122.899 1.00 0.00 O ATOM 6806 H1 WAT 9282 54.280 42.616 123.331 1.00 0.00 H ATOM 6807 H2 WAT 9282 54.720 43.093 121.964 1.00 0.00 H TER 6809 WAT 9282 ATOM 6809 O WAT 9283 50.798 89.909 109.830 1.00 0.00 O ATOM 6810 H1 WAT 9283 51.362 90.399 110.429 1.00 0.00 H ATOM 6811 H2 WAT 9283 51.295 89.116 109.628 1.00 0.00 H TER 6813 WAT 9283 ATOM 6813 O WAT 9284 106.171 57.639 147.064 1.00 0.00 O ATOM 6814 H1 WAT 9284 106.675 57.224 146.364 1.00 0.00 H ATOM 6815 H2 WAT 9284 106.827 57.895 147.713 1.00 0.00 H TER 6817 WAT 9284 ATOM 6817 O WAT 9285 125.427 71.859 145.285 1.00 0.00 O ATOM 6818 H1 WAT 9285 126.033 72.372 145.819 1.00 0.00 H ATOM 6819 H2 WAT 9285 124.907 71.367 145.921 1.00 0.00 H TER 6821 WAT 9285 ATOM 6821 O WAT 9286 37.856 135.630 91.718 1.00 0.00 O ATOM 6822 H1 WAT 9286 38.441 136.273 91.317 1.00 0.00 H ATOM 6823 H2 WAT 9286 37.254 135.384 91.015 1.00 0.00 H TER 6825 WAT 9286 ATOM 6825 O WAT 9287 61.676 69.521 16.592 1.00 0.00 O ATOM 6826 H1 WAT 9287 61.819 70.465 16.528 1.00 0.00 H ATOM 6827 H2 WAT 9287 61.302 69.394 17.465 1.00 0.00 H TER 6829 WAT 9287 ATOM 6829 O WAT 9288 82.216 126.660 7.409 1.00 0.00 O ATOM 6830 H1 WAT 9288 82.139 125.762 7.732 1.00 0.00 H ATOM 6831 H2 WAT 9288 83.148 126.766 7.216 1.00 0.00 H TER 6833 WAT 9288 ATOM 6833 O WAT 9289 122.126 6.200 93.317 1.00 0.00 O ATOM 6834 H1 WAT 9289 122.902 6.240 92.758 1.00 0.00 H ATOM 6835 H2 WAT 9289 121.871 5.277 93.306 1.00 0.00 H TER 6837 WAT 9289 ATOM 6837 O WAT 9290 26.450 134.870 87.500 1.00 0.00 O ATOM 6838 H1 WAT 9290 26.817 135.647 87.079 1.00 0.00 H ATOM 6839 H2 WAT 9290 26.746 134.927 88.408 1.00 0.00 H TER 6841 WAT 9290 ATOM 6841 O WAT 9291 84.958 20.386 65.432 1.00 0.00 O ATOM 6842 H1 WAT 9291 84.081 20.013 65.337 1.00 0.00 H ATOM 6843 H2 WAT 9291 85.271 20.052 66.272 1.00 0.00 H TER 6845 WAT 9291 ATOM 6845 O WAT 9292 122.278 134.854 150.878 1.00 0.00 O ATOM 6846 H1 WAT 9292 122.131 134.071 151.408 1.00 0.00 H ATOM 6847 H2 WAT 9292 122.757 135.448 151.456 1.00 0.00 H TER 6849 WAT 9292 ATOM 6849 O WAT 9293 53.577 52.073 75.714 1.00 0.00 O ATOM 6850 H1 WAT 9293 53.152 52.107 74.856 1.00 0.00 H ATOM 6851 H2 WAT 9293 53.287 51.243 76.092 1.00 0.00 H TER 6853 WAT 9293 ATOM 6853 O WAT 9294 97.273 69.504 93.807 1.00 0.00 O ATOM 6854 H1 WAT 9294 97.998 69.003 94.179 1.00 0.00 H ATOM 6855 H2 WAT 9294 97.250 70.311 94.322 1.00 0.00 H TER 6857 WAT 9294 ATOM 6857 O WAT 9295 140.638 64.465 113.402 1.00 0.00 O ATOM 6858 H1 WAT 9295 141.066 63.705 113.006 1.00 0.00 H ATOM 6859 H2 WAT 9295 140.637 65.126 112.710 1.00 0.00 H TER 6861 WAT 9295 ATOM 6861 O WAT 9296 87.323 75.205 90.135 1.00 0.00 O ATOM 6862 H1 WAT 9296 86.980 74.963 90.996 1.00 0.00 H ATOM 6863 H2 WAT 9296 86.575 75.110 89.544 1.00 0.00 H TER 6865 WAT 9296 ATOM 6865 O WAT 9297 79.568 24.119 10.198 1.00 0.00 O ATOM 6866 H1 WAT 9297 79.133 23.266 10.191 1.00 0.00 H ATOM 6867 H2 WAT 9297 80.335 24.001 9.637 1.00 0.00 H TER 6869 WAT 9297 ATOM 6869 O WAT 9298 132.366 65.179 20.623 1.00 0.00 O ATOM 6870 H1 WAT 9298 132.639 64.464 20.048 1.00 0.00 H ATOM 6871 H2 WAT 9298 131.770 65.703 20.087 1.00 0.00 H TER 6873 WAT 9298 ATOM 6873 O WAT 9299 15.626 28.407 71.870 1.00 0.00 O ATOM 6874 H1 WAT 9299 15.954 28.451 72.768 1.00 0.00 H ATOM 6875 H2 WAT 9299 16.415 28.396 71.327 1.00 0.00 H TER 6877 WAT 9299 ATOM 6877 O WAT 9300 127.025 86.725 0.525 1.00 0.00 O ATOM 6878 H1 WAT 9300 127.371 86.406 -0.309 1.00 0.00 H ATOM 6879 H2 WAT 9300 127.799 87.000 1.016 1.00 0.00 H TER 6881 WAT 9300 ATOM 6881 O WAT 9301 69.790 114.772 77.945 1.00 0.00 O ATOM 6882 H1 WAT 9301 70.506 115.296 77.586 1.00 0.00 H ATOM 6883 H2 WAT 9301 69.160 115.416 78.268 1.00 0.00 H TER 6885 WAT 9301 ATOM 6885 O WAT 9302 62.646 31.764 4.968 1.00 0.00 O ATOM 6886 H1 WAT 9302 63.592 31.757 4.823 1.00 0.00 H ATOM 6887 H2 WAT 9302 62.382 32.665 4.779 1.00 0.00 H TER 6889 WAT 9302 ATOM 6889 O WAT 9303 139.528 64.630 15.215 1.00 0.00 O ATOM 6890 H1 WAT 9303 138.605 64.377 15.209 1.00 0.00 H ATOM 6891 H2 WAT 9303 139.751 64.700 16.143 1.00 0.00 H TER 6893 WAT 9303 ATOM 6893 O WAT 9304 37.613 2.158 24.070 1.00 0.00 O ATOM 6894 H1 WAT 9304 37.393 3.057 24.313 1.00 0.00 H ATOM 6895 H2 WAT 9304 37.464 2.122 23.125 1.00 0.00 H TER 6897 WAT 9304 ATOM 6897 O WAT 9305 144.893 30.268 59.639 1.00 0.00 O ATOM 6898 H1 WAT 9305 144.785 29.339 59.845 1.00 0.00 H ATOM 6899 H2 WAT 9305 144.237 30.441 58.965 1.00 0.00 H TER 6901 WAT 9305 ATOM 6901 O WAT 9306 73.382 133.187 73.187 1.00 0.00 O ATOM 6902 H1 WAT 9306 74.150 133.701 73.435 1.00 0.00 H ATOM 6903 H2 WAT 9306 72.766 133.312 73.909 1.00 0.00 H TER 6905 WAT 9306 ATOM 6905 O WAT 9307 106.653 104.008 26.791 1.00 0.00 O ATOM 6906 H1 WAT 9307 107.213 104.202 26.040 1.00 0.00 H ATOM 6907 H2 WAT 9307 106.232 103.177 26.568 1.00 0.00 H TER 6909 WAT 9307 ATOM 6909 O WAT 9308 140.021 105.472 64.013 1.00 0.00 O ATOM 6910 H1 WAT 9308 140.390 105.386 63.134 1.00 0.00 H ATOM 6911 H2 WAT 9308 140.300 106.339 64.307 1.00 0.00 H TER 6913 WAT 9308 ATOM 6913 O WAT 9309 2.424 88.382 142.779 1.00 0.00 O ATOM 6914 H1 WAT 9309 2.617 87.472 143.003 1.00 0.00 H ATOM 6915 H2 WAT 9309 1.488 88.386 142.578 1.00 0.00 H TER 6917 WAT 9309 ATOM 6917 O WAT 9310 126.544 86.007 139.384 1.00 0.00 O ATOM 6918 H1 WAT 9310 126.129 86.618 138.775 1.00 0.00 H ATOM 6919 H2 WAT 9310 126.056 85.192 139.276 1.00 0.00 H TER 6921 WAT 9310 ATOM 6921 O WAT 9311 107.178 31.339 100.089 1.00 0.00 O ATOM 6922 H1 WAT 9311 106.501 31.609 99.469 1.00 0.00 H ATOM 6923 H2 WAT 9311 107.875 31.986 99.978 1.00 0.00 H TER 6925 WAT 9311 ATOM 6925 O WAT 9312 13.104 131.526 17.164 1.00 0.00 O ATOM 6926 H1 WAT 9312 12.997 130.583 17.040 1.00 0.00 H ATOM 6927 H2 WAT 9312 14.051 131.656 17.208 1.00 0.00 H TER 6929 WAT 9312 ATOM 6929 O WAT 9313 64.899 134.726 119.882 1.00 0.00 O ATOM 6930 H1 WAT 9313 64.006 134.491 120.135 1.00 0.00 H ATOM 6931 H2 WAT 9313 65.046 135.580 120.290 1.00 0.00 H TER 6933 WAT 9313 ATOM 6933 O WAT 9314 36.293 127.997 68.565 1.00 0.00 O ATOM 6934 H1 WAT 9314 36.741 127.156 68.648 1.00 0.00 H ATOM 6935 H2 WAT 9314 35.964 128.006 67.666 1.00 0.00 H TER 6937 WAT 9314 ATOM 6937 O WAT 9315 112.343 117.928 129.711 1.00 0.00 O ATOM 6938 H1 WAT 9315 112.605 117.203 129.143 1.00 0.00 H ATOM 6939 H2 WAT 9315 111.724 117.538 130.328 1.00 0.00 H TER 6941 WAT 9315 ATOM 6941 O WAT 9316 78.623 6.241 147.439 1.00 0.00 O ATOM 6942 H1 WAT 9316 79.354 5.956 147.987 1.00 0.00 H ATOM 6943 H2 WAT 9316 78.052 5.475 147.384 1.00 0.00 H TER 6945 WAT 9316 ATOM 6945 O WAT 9317 92.077 52.424 118.188 1.00 0.00 O ATOM 6946 H1 WAT 9317 92.742 51.957 118.694 1.00 0.00 H ATOM 6947 H2 WAT 9317 91.257 52.245 118.648 1.00 0.00 H TER 6949 WAT 9317 ATOM 6949 O WAT 9318 59.526 73.099 147.119 1.00 0.00 O ATOM 6950 H1 WAT 9318 59.430 72.160 146.959 1.00 0.00 H ATOM 6951 H2 WAT 9318 59.157 73.514 146.340 1.00 0.00 H TER 6953 WAT 9318 ATOM 6953 O WAT 9319 139.320 47.672 72.426 1.00 0.00 O ATOM 6954 H1 WAT 9319 139.933 47.469 71.720 1.00 0.00 H ATOM 6955 H2 WAT 9319 138.744 48.342 72.058 1.00 0.00 H TER 6957 WAT 9319 ATOM 6957 O WAT 9320 77.916 87.288 10.140 1.00 0.00 O ATOM 6958 H1 WAT 9320 78.549 87.347 10.855 1.00 0.00 H ATOM 6959 H2 WAT 9320 77.217 87.893 10.388 1.00 0.00 H TER 6961 WAT 9320 ATOM 6961 O WAT 9321 81.305 104.596 10.608 1.00 0.00 O ATOM 6962 H1 WAT 9321 80.855 105.109 9.937 1.00 0.00 H ATOM 6963 H2 WAT 9321 80.824 104.783 11.415 1.00 0.00 H TER 6965 WAT 9321 ATOM 6965 O WAT 9322 133.375 94.555 20.255 1.00 0.00 O ATOM 6966 H1 WAT 9322 134.312 94.434 20.409 1.00 0.00 H ATOM 6967 H2 WAT 9322 133.168 95.387 20.680 1.00 0.00 H TER 6969 WAT 9322 ATOM 6969 O WAT 9323 24.828 37.608 118.607 1.00 0.00 O ATOM 6970 H1 WAT 9323 24.836 38.543 118.809 1.00 0.00 H ATOM 6971 H2 WAT 9323 24.987 37.565 117.664 1.00 0.00 H TER 6973 WAT 9323 ATOM 6973 O WAT 9324 128.825 125.483 90.231 1.00 0.00 O ATOM 6974 H1 WAT 9324 127.889 125.445 90.035 1.00 0.00 H ATOM 6975 H2 WAT 9324 128.923 126.259 90.782 1.00 0.00 H TER 6977 WAT 9324 ATOM 6977 O WAT 9325 54.458 55.679 8.239 1.00 0.00 O ATOM 6978 H1 WAT 9325 53.928 54.884 8.186 1.00 0.00 H ATOM 6979 H2 WAT 9325 54.909 55.723 7.396 1.00 0.00 H TER 6981 WAT 9325 ATOM 6981 O WAT 9326 131.383 13.245 77.422 1.00 0.00 O ATOM 6982 H1 WAT 9326 131.144 12.974 76.535 1.00 0.00 H ATOM 6983 H2 WAT 9326 130.637 12.983 77.961 1.00 0.00 H TER 6985 WAT 9326 ATOM 6985 O WAT 9327 141.522 25.483 116.601 1.00 0.00 O ATOM 6986 H1 WAT 9327 140.646 25.612 116.963 1.00 0.00 H ATOM 6987 H2 WAT 9327 141.401 24.835 115.906 1.00 0.00 H TER 6989 WAT 9327 ATOM 6989 O WAT 9328 47.020 92.975 116.863 1.00 0.00 O ATOM 6990 H1 WAT 9328 47.235 93.081 117.790 1.00 0.00 H ATOM 6991 H2 WAT 9328 47.846 93.135 116.406 1.00 0.00 H TER 6993 WAT 9328 ATOM 6993 O WAT 9329 35.807 38.966 62.827 1.00 0.00 O ATOM 6994 H1 WAT 9329 35.043 38.865 62.259 1.00 0.00 H ATOM 6995 H2 WAT 9329 36.457 38.366 62.463 1.00 0.00 H TER 6997 WAT 9329 ATOM 6997 O WAT 9330 138.691 11.441 111.061 1.00 0.00 O ATOM 6998 H1 WAT 9330 137.938 11.171 110.535 1.00 0.00 H ATOM 6999 H2 WAT 9330 138.376 12.195 111.561 1.00 0.00 H TER 7001 WAT 9330 ATOM 7001 O WAT 9331 72.205 1.523 16.775 1.00 0.00 O ATOM 7002 H1 WAT 9331 71.794 0.770 16.349 1.00 0.00 H ATOM 7003 H2 WAT 9331 71.542 1.845 17.385 1.00 0.00 H TER 7005 WAT 9331 ATOM 7005 O WAT 9332 32.680 32.731 114.888 1.00 0.00 O ATOM 7006 H1 WAT 9332 32.260 33.590 114.837 1.00 0.00 H ATOM 7007 H2 WAT 9332 32.630 32.386 113.997 1.00 0.00 H TER 7009 WAT 9332 ATOM 7009 O WAT 9333 14.714 64.183 2.437 1.00 0.00 O ATOM 7010 H1 WAT 9333 15.497 64.302 2.974 1.00 0.00 H ATOM 7011 H2 WAT 9333 14.278 65.035 2.457 1.00 0.00 H TER 7013 WAT 9333 ATOM 7013 O WAT 9334 64.242 117.568 4.864 1.00 0.00 O ATOM 7014 H1 WAT 9334 64.046 117.297 3.967 1.00 0.00 H ATOM 7015 H2 WAT 9334 65.031 117.077 5.096 1.00 0.00 H TER 7017 WAT 9334 ATOM 7017 O WAT 9335 115.044 117.059 72.377 1.00 0.00 O ATOM 7018 H1 WAT 9335 115.077 117.083 73.334 1.00 0.00 H ATOM 7019 H2 WAT 9335 114.157 117.344 72.161 1.00 0.00 H TER 7021 WAT 9335 ATOM 7021 O WAT 9336 134.769 35.769 116.626 1.00 0.00 O ATOM 7022 H1 WAT 9336 134.439 36.264 117.375 1.00 0.00 H ATOM 7023 H2 WAT 9336 135.721 35.848 116.687 1.00 0.00 H TER 7025 WAT 9336 ATOM 7025 O WAT 9337 26.027 15.853 74.489 1.00 0.00 O ATOM 7026 H1 WAT 9337 25.732 16.407 73.767 1.00 0.00 H ATOM 7027 H2 WAT 9337 26.756 15.352 74.125 1.00 0.00 H TER 7029 WAT 9337 ATOM 7029 O WAT 9338 89.269 39.292 129.197 1.00 0.00 O ATOM 7030 H1 WAT 9338 89.185 40.217 128.964 1.00 0.00 H ATOM 7031 H2 WAT 9338 89.149 39.273 130.147 1.00 0.00 H TER 7033 WAT 9338 ATOM 7033 O WAT 9339 105.564 13.653 2.168 1.00 0.00 O ATOM 7034 H1 WAT 9339 105.142 13.757 1.315 1.00 0.00 H ATOM 7035 H2 WAT 9339 105.719 14.548 2.469 1.00 0.00 H TER 7037 WAT 9339 ATOM 7037 O WAT 9340 15.253 38.269 69.513 1.00 0.00 O ATOM 7038 H1 WAT 9340 15.927 37.657 69.216 1.00 0.00 H ATOM 7039 H2 WAT 9340 14.611 38.280 68.803 1.00 0.00 H TER 7041 WAT 9340 ATOM 7041 O WAT 9341 62.874 37.869 103.227 1.00 0.00 O ATOM 7042 H1 WAT 9341 62.594 37.122 103.755 1.00 0.00 H ATOM 7043 H2 WAT 9341 63.826 37.782 103.175 1.00 0.00 H TER 7045 WAT 9341 ATOM 7045 O WAT 9342 7.237 15.594 71.396 1.00 0.00 O ATOM 7046 H1 WAT 9342 6.767 14.919 70.905 1.00 0.00 H ATOM 7047 H2 WAT 9342 6.684 15.766 72.157 1.00 0.00 H TER 7049 WAT 9342 ATOM 7049 O WAT 9343 80.861 45.746 111.431 1.00 0.00 O ATOM 7050 H1 WAT 9343 79.952 45.465 111.327 1.00 0.00 H ATOM 7051 H2 WAT 9343 81.144 45.344 112.252 1.00 0.00 H TER 7053 WAT 9343 ATOM 7053 O WAT 9344 55.949 11.260 123.212 1.00 0.00 O ATOM 7054 H1 WAT 9344 55.077 11.572 123.455 1.00 0.00 H ATOM 7055 H2 WAT 9344 55.807 10.365 122.904 1.00 0.00 H TER 7057 WAT 9344 ATOM 7057 O WAT 9345 142.236 21.571 144.289 1.00 0.00 O ATOM 7058 H1 WAT 9345 143.155 21.569 144.018 1.00 0.00 H ATOM 7059 H2 WAT 9345 142.022 22.497 144.401 1.00 0.00 H TER 7061 WAT 9345 ATOM 7061 O WAT 9346 95.116 24.334 124.185 1.00 0.00 O ATOM 7062 H1 WAT 9346 95.797 24.736 124.724 1.00 0.00 H ATOM 7063 H2 WAT 9346 95.597 23.795 123.555 1.00 0.00 H TER 7065 WAT 9346 ATOM 7065 O WAT 9347 34.642 19.298 17.037 1.00 0.00 O ATOM 7066 H1 WAT 9347 35.398 18.917 16.590 1.00 0.00 H ATOM 7067 H2 WAT 9347 34.599 20.197 16.712 1.00 0.00 H TER 7069 WAT 9347 ATOM 7069 O WAT 9348 56.638 15.459 85.497 1.00 0.00 O ATOM 7070 H1 WAT 9348 56.893 15.226 84.605 1.00 0.00 H ATOM 7071 H2 WAT 9348 56.412 16.388 85.446 1.00 0.00 H TER 7073 WAT 9348 ATOM 7073 O WAT 9349 130.199 26.111 130.624 1.00 0.00 O ATOM 7074 H1 WAT 9349 130.355 26.109 129.679 1.00 0.00 H ATOM 7075 H2 WAT 9349 130.762 26.809 130.958 1.00 0.00 H TER 7077 WAT 9349 ATOM 7077 O WAT 9350 85.242 68.234 21.541 1.00 0.00 O ATOM 7078 H1 WAT 9350 86.099 67.809 21.533 1.00 0.00 H ATOM 7079 H2 WAT 9350 84.615 67.510 21.536 1.00 0.00 H TER 7081 WAT 9350 ATOM 7081 O WAT 9351 29.294 6.782 15.526 1.00 0.00 O ATOM 7082 H1 WAT 9351 30.125 7.239 15.655 1.00 0.00 H ATOM 7083 H2 WAT 9351 28.698 7.454 15.197 1.00 0.00 H TER 7085 WAT 9351 ATOM 7085 O WAT 9352 71.855 26.772 152.907 1.00 0.00 O ATOM 7086 H1 WAT 9352 71.701 26.607 151.976 1.00 0.00 H ATOM 7087 H2 WAT 9352 71.104 26.375 153.348 1.00 0.00 H TER 7089 WAT 9352 ATOM 7089 O WAT 9353 49.405 68.516 127.894 1.00 0.00 O ATOM 7090 H1 WAT 9353 48.489 68.315 127.703 1.00 0.00 H ATOM 7091 H2 WAT 9353 49.556 68.145 128.763 1.00 0.00 H TER 7093 WAT 9353 ATOM 7093 O WAT 9354 10.415 116.993 96.212 1.00 0.00 O ATOM 7094 H1 WAT 9354 11.224 117.488 96.078 1.00 0.00 H ATOM 7095 H2 WAT 9354 10.012 116.955 95.345 1.00 0.00 H TER 7097 WAT 9354 ATOM 7097 O WAT 9355 31.539 119.520 24.633 1.00 0.00 O ATOM 7098 H1 WAT 9355 31.407 120.297 24.089 1.00 0.00 H ATOM 7099 H2 WAT 9355 31.100 118.816 24.156 1.00 0.00 H TER 7101 WAT 9355 ATOM 7101 O WAT 9356 103.706 110.977 149.343 1.00 0.00 O ATOM 7102 H1 WAT 9356 102.852 111.243 149.683 1.00 0.00 H ATOM 7103 H2 WAT 9356 103.558 110.104 148.979 1.00 0.00 H TER 7105 WAT 9356 ATOM 7105 O WAT 9357 120.091 57.657 113.368 1.00 0.00 O ATOM 7106 H1 WAT 9357 120.752 58.349 113.387 1.00 0.00 H ATOM 7107 H2 WAT 9357 120.238 57.164 114.176 1.00 0.00 H TER 7109 WAT 9357 ATOM 7109 O WAT 9358 6.725 42.543 101.743 1.00 0.00 O ATOM 7110 H1 WAT 9358 6.229 42.367 100.943 1.00 0.00 H ATOM 7111 H2 WAT 9358 6.463 43.428 101.997 1.00 0.00 H TER 7113 WAT 9358 ATOM 7113 O WAT 9359 64.583 86.383 143.058 1.00 0.00 O ATOM 7114 H1 WAT 9359 64.796 87.311 142.961 1.00 0.00 H ATOM 7115 H2 WAT 9359 63.995 86.350 143.814 1.00 0.00 H TER 7117 WAT 9359 ATOM 7117 O WAT 9360 99.810 101.375 148.242 1.00 0.00 O ATOM 7118 H1 WAT 9360 98.927 101.745 148.252 1.00 0.00 H ATOM 7119 H2 WAT 9360 99.673 100.430 148.301 1.00 0.00 H TER 7121 WAT 9360 ATOM 7121 O WAT 9361 47.072 57.133 103.606 1.00 0.00 O ATOM 7122 H1 WAT 9361 46.728 56.680 104.377 1.00 0.00 H ATOM 7123 H2 WAT 9361 47.954 56.779 103.495 1.00 0.00 H TER 7125 WAT 9361 ATOM 7125 O WAT 9362 129.447 6.274 69.779 1.00 0.00 O ATOM 7126 H1 WAT 9362 128.770 5.657 70.055 1.00 0.00 H ATOM 7127 H2 WAT 9362 129.303 6.383 68.839 1.00 0.00 H TER 7129 WAT 9362 ATOM 7129 O WAT 9363 51.600 50.384 102.384 1.00 0.00 O ATOM 7130 H1 WAT 9363 51.172 50.095 103.190 1.00 0.00 H ATOM 7131 H2 WAT 9363 51.925 51.261 102.587 1.00 0.00 H TER 7133 WAT 9363 ATOM 7133 O WAT 9364 59.416 88.569 21.862 1.00 0.00 O ATOM 7134 H1 WAT 9364 59.497 88.368 22.794 1.00 0.00 H ATOM 7135 H2 WAT 9364 59.651 89.495 21.795 1.00 0.00 H TER 7137 WAT 9364 ATOM 7137 O WAT 9365 16.041 48.951 114.477 1.00 0.00 O ATOM 7138 H1 WAT 9365 15.710 48.053 114.497 1.00 0.00 H ATOM 7139 H2 WAT 9365 15.335 49.457 114.074 1.00 0.00 H TER 7141 WAT 9365 ATOM 7141 O WAT 9366 52.488 15.892 66.177 1.00 0.00 O ATOM 7142 H1 WAT 9366 52.358 16.011 65.236 1.00 0.00 H ATOM 7143 H2 WAT 9366 51.612 15.707 66.518 1.00 0.00 H TER 7145 WAT 9366 ATOM 7145 O WAT 9367 98.113 71.514 127.456 1.00 0.00 O ATOM 7146 H1 WAT 9367 98.485 70.672 127.721 1.00 0.00 H ATOM 7147 H2 WAT 9367 98.390 72.124 128.140 1.00 0.00 H TER 7149 WAT 9367 ATOM 7149 O WAT 9368 35.900 27.446 13.967 1.00 0.00 O ATOM 7150 H1 WAT 9368 34.962 27.330 13.813 1.00 0.00 H ATOM 7151 H2 WAT 9368 35.953 27.840 14.838 1.00 0.00 H TER 7153 WAT 9368 ATOM 7153 O WAT 9369 52.339 84.358 132.419 1.00 0.00 O ATOM 7154 H1 WAT 9369 52.808 84.472 131.592 1.00 0.00 H ATOM 7155 H2 WAT 9369 51.444 84.639 132.228 1.00 0.00 H TER 7157 WAT 9369 ATOM 7157 O WAT 9370 9.035 8.569 0.799 1.00 0.00 O ATOM 7158 H1 WAT 9370 9.101 7.694 1.182 1.00 0.00 H ATOM 7159 H2 WAT 9370 9.392 9.151 1.470 1.00 0.00 H TER 7161 WAT 9370 ATOM 7161 O WAT 9371 49.806 81.912 101.072 1.00 0.00 O ATOM 7162 H1 WAT 9371 50.355 81.134 101.175 1.00 0.00 H ATOM 7163 H2 WAT 9371 50.429 82.631 100.961 1.00 0.00 H TER 7165 WAT 9371 ATOM 7165 O WAT 9372 84.928 1.843 89.211 1.00 0.00 O ATOM 7166 H1 WAT 9372 84.515 1.663 90.055 1.00 0.00 H ATOM 7167 H2 WAT 9372 84.201 1.877 88.590 1.00 0.00 H TER 7169 WAT 9372 ATOM 7169 O WAT 9373 71.063 100.965 64.064 1.00 0.00 O ATOM 7170 H1 WAT 9373 71.464 100.198 64.473 1.00 0.00 H ATOM 7171 H2 WAT 9373 71.771 101.606 64.011 1.00 0.00 H TER 7173 WAT 9373 ATOM 7173 O WAT 9374 133.606 44.690 76.854 1.00 0.00 O ATOM 7174 H1 WAT 9374 133.845 44.164 76.091 1.00 0.00 H ATOM 7175 H2 WAT 9374 134.192 45.445 76.819 1.00 0.00 H TER 7177 WAT 9374 ATOM 7177 O WAT 9375 95.592 133.359 132.801 1.00 0.00 O ATOM 7178 H1 WAT 9375 96.203 132.662 132.561 1.00 0.00 H ATOM 7179 H2 WAT 9375 95.931 134.137 132.358 1.00 0.00 H TER 7181 WAT 9375 ATOM 7181 O WAT 9376 31.937 81.683 72.531 1.00 0.00 O ATOM 7182 H1 WAT 9376 31.888 82.394 73.169 1.00 0.00 H ATOM 7183 H2 WAT 9376 32.173 80.913 73.049 1.00 0.00 H TER 7185 WAT 9376 ATOM 7185 O WAT 9377 99.401 51.909 81.842 1.00 0.00 O ATOM 7186 H1 WAT 9377 98.936 52.074 82.662 1.00 0.00 H ATOM 7187 H2 WAT 9377 100.232 52.373 81.940 1.00 0.00 H TER 7189 WAT 9377 ATOM 7189 O WAT 9378 53.563 124.229 125.371 1.00 0.00 O ATOM 7190 H1 WAT 9378 53.325 125.104 125.677 1.00 0.00 H ATOM 7191 H2 WAT 9378 54.391 124.038 125.811 1.00 0.00 H TER 7193 WAT 9378 ATOM 7193 O WAT 9379 5.046 78.548 0.982 1.00 0.00 O ATOM 7194 H1 WAT 9379 5.767 79.139 0.766 1.00 0.00 H ATOM 7195 H2 WAT 9379 4.405 78.686 0.285 1.00 0.00 H TER 7197 WAT 9379 ATOM 7197 O WAT 9380 88.223 92.552 137.444 1.00 0.00 O ATOM 7198 H1 WAT 9380 88.134 91.697 137.866 1.00 0.00 H ATOM 7199 H2 WAT 9380 87.697 92.482 136.648 1.00 0.00 H TER 7201 WAT 9380 ATOM 7201 O WAT 9381 26.725 33.029 148.007 1.00 0.00 O ATOM 7202 H1 WAT 9381 26.475 33.912 147.736 1.00 0.00 H ATOM 7203 H2 WAT 9381 26.179 32.848 148.772 1.00 0.00 H TER 7205 WAT 9381 ATOM 7205 O WAT 9382 102.380 134.128 146.199 1.00 0.00 O ATOM 7206 H1 WAT 9382 102.874 133.764 146.934 1.00 0.00 H ATOM 7207 H2 WAT 9382 101.518 133.717 146.263 1.00 0.00 H TER 7209 WAT 9382 ATOM 7209 O WAT 9383 145.069 88.059 157.902 1.00 0.00 O ATOM 7210 H1 WAT 9383 145.509 87.644 157.160 1.00 0.00 H ATOM 7211 H2 WAT 9383 144.348 88.551 157.508 1.00 0.00 H TER 7213 WAT 9383 ATOM 7213 O WAT 9384 7.715 89.845 2.958 1.00 0.00 O ATOM 7214 H1 WAT 9384 7.435 90.622 2.474 1.00 0.00 H ATOM 7215 H2 WAT 9384 7.155 89.143 2.628 1.00 0.00 H TER 7217 WAT 9384 ATOM 7217 O WAT 9385 135.802 133.176 130.458 1.00 0.00 O ATOM 7218 H1 WAT 9385 136.548 132.643 130.184 1.00 0.00 H ATOM 7219 H2 WAT 9385 136.050 134.071 130.226 1.00 0.00 H TER 7221 WAT 9385 ATOM 7221 O WAT 9386 4.251 134.897 141.534 1.00 0.00 O ATOM 7222 H1 WAT 9386 3.724 135.605 141.905 1.00 0.00 H ATOM 7223 H2 WAT 9386 4.348 134.269 142.250 1.00 0.00 H TER 7225 WAT 9386 ATOM 7225 O WAT 9387 103.075 50.498 26.764 1.00 0.00 O ATOM 7226 H1 WAT 9387 102.558 49.694 26.814 1.00 0.00 H ATOM 7227 H2 WAT 9387 102.438 51.180 26.550 1.00 0.00 H TER 7229 WAT 9387 ATOM 7229 O WAT 9388 36.768 13.215 156.344 1.00 0.00 O ATOM 7230 H1 WAT 9388 36.758 13.957 155.740 1.00 0.00 H ATOM 7231 H2 WAT 9388 36.521 12.464 155.804 1.00 0.00 H TER 7233 WAT 9388 ATOM 7233 O WAT 9389 0.046 96.557 67.827 1.00 0.00 O ATOM 7234 H1 WAT 9389 0.628 95.847 68.097 1.00 0.00 H ATOM 7235 H2 WAT 9389 -0.590 96.139 67.247 1.00 0.00 H TER 7237 WAT 9389 ATOM 7237 O WAT 9390 16.768 9.130 129.207 1.00 0.00 O ATOM 7238 H1 WAT 9390 16.595 9.493 130.076 1.00 0.00 H ATOM 7239 H2 WAT 9390 16.094 9.516 128.647 1.00 0.00 H TER 7241 WAT 9390 ATOM 7241 O WAT 9391 111.492 120.518 11.873 1.00 0.00 O ATOM 7242 H1 WAT 9391 110.593 120.432 12.192 1.00 0.00 H ATOM 7243 H2 WAT 9391 111.915 119.698 12.126 1.00 0.00 H TER 7245 WAT 9391 ATOM 7245 O WAT 9392 91.973 34.611 104.421 1.00 0.00 O ATOM 7246 H1 WAT 9392 92.755 34.848 104.921 1.00 0.00 H ATOM 7247 H2 WAT 9392 91.281 34.540 105.079 1.00 0.00 H TER 7249 WAT 9392 ATOM 7249 O WAT 9393 80.352 55.002 12.227 1.00 0.00 O ATOM 7250 H1 WAT 9393 79.615 54.526 11.844 1.00 0.00 H ATOM 7251 H2 WAT 9393 81.069 54.873 11.606 1.00 0.00 H TER 7253 WAT 9393 ATOM 7253 O WAT 9394 60.604 121.290 100.601 1.00 0.00 O ATOM 7254 H1 WAT 9394 60.381 122.113 101.036 1.00 0.00 H ATOM 7255 H2 WAT 9394 59.778 120.808 100.563 1.00 0.00 H TER 7257 WAT 9394 ATOM 7257 O WAT 9395 95.238 137.598 72.059 1.00 0.00 O ATOM 7258 H1 WAT 9395 95.039 136.938 71.395 1.00 0.00 H ATOM 7259 H2 WAT 9395 96.090 137.338 72.407 1.00 0.00 H TER 7261 WAT 9395 ATOM 7261 O WAT 9396 114.124 95.733 102.442 1.00 0.00 O ATOM 7262 H1 WAT 9396 114.955 96.128 102.177 1.00 0.00 H ATOM 7263 H2 WAT 9396 114.261 95.478 103.354 1.00 0.00 H TER 7265 WAT 9396 ATOM 7265 O WAT 9397 146.147 69.197 118.862 1.00 0.00 O ATOM 7266 H1 WAT 9397 145.492 68.758 119.404 1.00 0.00 H ATOM 7267 H2 WAT 9397 145.842 70.102 118.804 1.00 0.00 H TER 7269 WAT 9397 ATOM 7269 O WAT 9398 120.004 126.705 108.794 1.00 0.00 O ATOM 7270 H1 WAT 9398 119.753 127.598 109.030 1.00 0.00 H ATOM 7271 H2 WAT 9398 120.741 126.503 109.370 1.00 0.00 H TER 7273 WAT 9398 ATOM 7273 O WAT 9399 47.643 142.274 154.989 1.00 0.00 O ATOM 7274 H1 WAT 9399 47.072 141.672 155.466 1.00 0.00 H ATOM 7275 H2 WAT 9399 48.135 142.729 155.672 1.00 0.00 H TER 7277 WAT 9399 ATOM 7277 O WAT 9400 68.399 124.647 126.010 1.00 0.00 O ATOM 7278 H1 WAT 9400 69.183 125.067 125.656 1.00 0.00 H ATOM 7279 H2 WAT 9400 67.721 124.817 125.357 1.00 0.00 H TER 7281 WAT 9400 ATOM 7281 O WAT 9401 32.764 91.223 132.900 1.00 0.00 O ATOM 7282 H1 WAT 9401 33.572 91.647 133.187 1.00 0.00 H ATOM 7283 H2 WAT 9401 32.974 90.289 132.889 1.00 0.00 H TER 7285 WAT 9401 ATOM 7285 O WAT 9402 99.133 95.380 146.103 1.00 0.00 O ATOM 7286 H1 WAT 9402 99.899 95.954 146.082 1.00 0.00 H ATOM 7287 H2 WAT 9402 98.461 95.859 145.618 1.00 0.00 H TER 7289 WAT 9402 ATOM 7289 O WAT 9403 95.235 41.912 9.035 1.00 0.00 O ATOM 7290 H1 WAT 9403 95.106 41.699 9.959 1.00 0.00 H ATOM 7291 H2 WAT 9403 94.371 42.189 8.730 1.00 0.00 H TER 7293 WAT 9403 ATOM 7293 O WAT 9404 67.336 7.119 90.358 1.00 0.00 O ATOM 7294 H1 WAT 9404 66.563 6.993 89.808 1.00 0.00 H ATOM 7295 H2 WAT 9404 67.124 6.671 91.176 1.00 0.00 H TER 7297 WAT 9404 ATOM 7297 O WAT 9405 5.395 63.695 84.417 1.00 0.00 O ATOM 7298 H1 WAT 9405 5.049 64.322 85.051 1.00 0.00 H ATOM 7299 H2 WAT 9405 5.007 63.958 83.583 1.00 0.00 H TER 7301 WAT 9405 ATOM 7301 O WAT 9406 73.256 101.082 21.946 1.00 0.00 O ATOM 7302 H1 WAT 9406 72.455 100.962 22.456 1.00 0.00 H ATOM 7303 H2 WAT 9406 73.519 101.985 22.121 1.00 0.00 H TER 7305 WAT 9406 ATOM 7305 O WAT 9407 67.642 20.234 91.102 1.00 0.00 O ATOM 7306 H1 WAT 9407 68.027 20.946 91.613 1.00 0.00 H ATOM 7307 H2 WAT 9407 66.704 20.422 91.098 1.00 0.00 H TER 7309 WAT 9407 ATOM 7309 O WAT 9408 132.768 134.115 142.214 1.00 0.00 O ATOM 7310 H1 WAT 9408 132.955 134.959 142.623 1.00 0.00 H ATOM 7311 H2 WAT 9408 131.856 134.183 141.929 1.00 0.00 H TER 7313 WAT 9408 ATOM 7313 O WAT 9409 129.717 29.856 144.603 1.00 0.00 O ATOM 7314 H1 WAT 9409 130.064 30.110 143.747 1.00 0.00 H ATOM 7315 H2 WAT 9409 129.515 30.687 145.034 1.00 0.00 H TER 7317 WAT 9409 ATOM 7317 O WAT 9410 75.753 66.086 116.721 1.00 0.00 O ATOM 7318 H1 WAT 9410 74.893 66.347 116.393 1.00 0.00 H ATOM 7319 H2 WAT 9410 75.576 65.329 117.280 1.00 0.00 H TER 7321 WAT 9410 ATOM 7321 O WAT 9411 130.319 135.287 54.817 1.00 0.00 O ATOM 7322 H1 WAT 9411 129.857 134.530 55.178 1.00 0.00 H ATOM 7323 H2 WAT 9411 129.853 135.487 54.005 1.00 0.00 H TER 7325 WAT 9411 ATOM 7325 O WAT 9412 47.157 131.828 13.916 1.00 0.00 O ATOM 7326 H1 WAT 9412 48.004 132.215 14.134 1.00 0.00 H ATOM 7327 H2 WAT 9412 47.294 131.417 13.062 1.00 0.00 H TER 7329 WAT 9412 ATOM 7329 O WAT 9413 39.611 75.821 109.096 1.00 0.00 O ATOM 7330 H1 WAT 9413 39.886 74.916 109.244 1.00 0.00 H ATOM 7331 H2 WAT 9413 39.449 76.168 109.973 1.00 0.00 H TER 7333 WAT 9413 ATOM 7333 O WAT 9414 21.646 9.245 147.428 1.00 0.00 O ATOM 7334 H1 WAT 9414 21.697 8.690 146.650 1.00 0.00 H ATOM 7335 H2 WAT 9414 22.417 9.809 147.372 1.00 0.00 H TER 7337 WAT 9414 ATOM 7337 O WAT 9415 109.430 34.721 12.831 1.00 0.00 O ATOM 7338 H1 WAT 9415 108.522 34.976 12.665 1.00 0.00 H ATOM 7339 H2 WAT 9415 109.396 33.771 12.942 1.00 0.00 H TER 7341 WAT 9415 ATOM 7341 O WAT 9416 124.070 115.251 116.713 1.00 0.00 O ATOM 7342 H1 WAT 9416 123.818 114.357 116.482 1.00 0.00 H ATOM 7343 H2 WAT 9416 124.100 115.715 115.876 1.00 0.00 H TER 7345 WAT 9416 ATOM 7345 O WAT 9417 42.956 134.580 11.289 1.00 0.00 O ATOM 7346 H1 WAT 9417 42.653 135.226 10.650 1.00 0.00 H ATOM 7347 H2 WAT 9417 42.516 133.769 11.036 1.00 0.00 H TER 7349 WAT 9417 ATOM 7349 O WAT 9418 55.988 113.788 102.360 1.00 0.00 O ATOM 7350 H1 WAT 9418 55.661 112.918 102.587 1.00 0.00 H ATOM 7351 H2 WAT 9418 56.928 113.744 102.533 1.00 0.00 H TER 7353 WAT 9418 ATOM 7353 O WAT 9419 67.307 85.294 66.879 1.00 0.00 O ATOM 7354 H1 WAT 9419 67.605 86.014 67.435 1.00 0.00 H ATOM 7355 H2 WAT 9419 66.980 85.721 66.088 1.00 0.00 H TER 7357 WAT 9419 ATOM 7357 O WAT 9420 109.776 120.672 117.531 1.00 0.00 O ATOM 7358 H1 WAT 9420 110.233 120.341 116.758 1.00 0.00 H ATOM 7359 H2 WAT 9420 110.384 121.303 117.917 1.00 0.00 H TER 7361 WAT 9420 ATOM 7361 O WAT 9421 104.062 90.036 61.074 1.00 0.00 O ATOM 7362 H1 WAT 9421 104.666 90.251 60.363 1.00 0.00 H ATOM 7363 H2 WAT 9421 103.413 89.460 60.671 1.00 0.00 H TER 7365 WAT 9421 ATOM 7365 O WAT 9422 77.190 68.838 1.893 1.00 0.00 O ATOM 7366 H1 WAT 9422 77.262 67.883 1.899 1.00 0.00 H ATOM 7367 H2 WAT 9422 76.305 69.014 2.212 1.00 0.00 H TER 7369 WAT 9422 ATOM 7369 O WAT 9423 30.684 12.467 10.198 1.00 0.00 O ATOM 7370 H1 WAT 9423 31.593 12.191 10.315 1.00 0.00 H ATOM 7371 H2 WAT 9423 30.743 13.268 9.676 1.00 0.00 H TER 7373 WAT 9423 ATOM 7373 O WAT 9424 41.876 42.394 136.205 1.00 0.00 O ATOM 7374 H1 WAT 9424 41.473 41.570 135.933 1.00 0.00 H ATOM 7375 H2 WAT 9424 42.001 42.299 137.150 1.00 0.00 H TER 7377 WAT 9424 ATOM 7377 O WAT 9425 50.715 63.104 25.578 1.00 0.00 O ATOM 7378 H1 WAT 9425 50.732 63.952 26.023 1.00 0.00 H ATOM 7379 H2 WAT 9425 51.624 62.804 25.599 1.00 0.00 H TER 7381 WAT 9425 ATOM 7381 O WAT 9426 63.179 10.312 67.563 1.00 0.00 O ATOM 7382 H1 WAT 9426 64.005 9.836 67.472 1.00 0.00 H ATOM 7383 H2 WAT 9426 62.551 9.649 67.848 1.00 0.00 H TER 7385 WAT 9426 ATOM 7385 O WAT 9427 108.473 68.366 5.060 1.00 0.00 O ATOM 7386 H1 WAT 9427 107.841 68.334 5.777 1.00 0.00 H ATOM 7387 H2 WAT 9427 109.262 68.739 5.452 1.00 0.00 H TER 7389 WAT 9427 ATOM 7389 O WAT 9428 132.467 144.186 16.873 1.00 0.00 O ATOM 7390 H1 WAT 9428 133.192 144.565 17.370 1.00 0.00 H ATOM 7391 H2 WAT 9428 132.136 144.911 16.343 1.00 0.00 H TER 7393 WAT 9428 ATOM 7393 O WAT 9429 60.263 88.871 157.915 1.00 0.00 O ATOM 7394 H1 WAT 9429 60.426 89.792 158.120 1.00 0.00 H ATOM 7395 H2 WAT 9429 61.007 88.405 158.296 1.00 0.00 H TER 7397 WAT 9429 ATOM 7397 O WAT 9430 76.902 44.074 127.477 1.00 0.00 O ATOM 7398 H1 WAT 9430 76.271 44.196 128.185 1.00 0.00 H ATOM 7399 H2 WAT 9430 76.370 44.062 126.681 1.00 0.00 H TER 7401 WAT 9430 ATOM 7401 O WAT 9431 50.268 62.288 155.189 1.00 0.00 O ATOM 7402 H1 WAT 9431 50.038 62.783 155.975 1.00 0.00 H ATOM 7403 H2 WAT 9431 50.915 62.835 154.743 1.00 0.00 H TER 7405 WAT 9431 ATOM 7405 O WAT 9432 1.460 115.429 55.378 1.00 0.00 O ATOM 7406 H1 WAT 9432 1.136 116.105 54.783 1.00 0.00 H ATOM 7407 H2 WAT 9432 2.119 115.875 55.911 1.00 0.00 H TER 7409 WAT 9432 ATOM 7409 O WAT 9433 47.592 35.630 95.522 1.00 0.00 O ATOM 7410 H1 WAT 9433 47.481 36.134 96.328 1.00 0.00 H ATOM 7411 H2 WAT 9433 48.267 34.985 95.732 1.00 0.00 H TER 7413 WAT 9433 ATOM 7413 O WAT 9434 8.830 79.229 14.737 1.00 0.00 O ATOM 7414 H1 WAT 9434 8.880 80.156 14.973 1.00 0.00 H ATOM 7415 H2 WAT 9434 9.064 78.764 15.540 1.00 0.00 H TER 7417 WAT 9434 ATOM 7417 O WAT 9435 38.827 59.926 99.377 1.00 0.00 O ATOM 7418 H1 WAT 9435 38.699 59.901 98.429 1.00 0.00 H ATOM 7419 H2 WAT 9435 38.168 59.324 99.724 1.00 0.00 H TER 7421 WAT 9435 ATOM 7421 O WAT 9436 111.996 78.633 157.241 1.00 0.00 O ATOM 7422 H1 WAT 9436 111.790 78.534 156.311 1.00 0.00 H ATOM 7423 H2 WAT 9436 112.528 79.428 157.285 1.00 0.00 H TER 7425 WAT 9436 ATOM 7425 O WAT 9437 77.709 96.146 77.892 1.00 0.00 O ATOM 7426 H1 WAT 9437 78.454 96.610 77.509 1.00 0.00 H ATOM 7427 H2 WAT 9437 78.035 95.822 78.732 1.00 0.00 H TER 7429 WAT 9437 ATOM 7429 O WAT 9438 99.966 22.549 53.229 1.00 0.00 O ATOM 7430 H1 WAT 9438 99.643 22.737 54.110 1.00 0.00 H ATOM 7431 H2 WAT 9438 100.919 22.536 53.322 1.00 0.00 H TER 7433 WAT 9438 ATOM 7433 O WAT 9439 57.579 100.819 154.634 1.00 0.00 O ATOM 7434 H1 WAT 9439 57.520 100.087 155.248 1.00 0.00 H ATOM 7435 H2 WAT 9439 58.455 100.744 154.256 1.00 0.00 H TER 7437 WAT 9439 ATOM 7437 O WAT 9440 126.995 10.983 21.533 1.00 0.00 O ATOM 7438 H1 WAT 9440 126.349 11.633 21.808 1.00 0.00 H ATOM 7439 H2 WAT 9440 127.814 11.473 21.463 1.00 0.00 H TER 7441 WAT 9440 ATOM 7441 O WAT 9441 52.697 85.246 83.304 1.00 0.00 O ATOM 7442 H1 WAT 9441 52.083 85.444 84.011 1.00 0.00 H ATOM 7443 H2 WAT 9441 53.335 84.652 83.701 1.00 0.00 H TER 7445 WAT 9441 ATOM 7445 O WAT 9442 77.727 126.547 5.138 1.00 0.00 O ATOM 7446 H1 WAT 9442 77.992 125.644 5.317 1.00 0.00 H ATOM 7447 H2 WAT 9442 77.076 126.742 5.812 1.00 0.00 H TER 7449 WAT 9442 ATOM 7449 O WAT 9443 46.860 86.260 60.648 1.00 0.00 O ATOM 7450 H1 WAT 9443 47.269 85.664 60.020 1.00 0.00 H ATOM 7451 H2 WAT 9443 47.596 86.687 61.087 1.00 0.00 H TER 7453 WAT 9443 ATOM 7453 O WAT 9444 47.710 103.053 96.311 1.00 0.00 O ATOM 7454 H1 WAT 9444 48.110 102.233 96.601 1.00 0.00 H ATOM 7455 H2 WAT 9444 47.385 103.457 97.115 1.00 0.00 H TER 7457 WAT 9444 ATOM 7457 O WAT 9445 40.173 4.122 65.543 1.00 0.00 O ATOM 7458 H1 WAT 9445 40.696 3.322 65.594 1.00 0.00 H ATOM 7459 H2 WAT 9445 40.587 4.719 66.165 1.00 0.00 H TER 7461 WAT 9445 ATOM 7461 O WAT 9446 130.442 120.929 95.084 1.00 0.00 O ATOM 7462 H1 WAT 9446 130.335 121.149 96.010 1.00 0.00 H ATOM 7463 H2 WAT 9446 129.557 120.720 94.784 1.00 0.00 H TER 7465 WAT 9446 ATOM 7465 O WAT 9447 55.190 24.624 5.380 1.00 0.00 O ATOM 7466 H1 WAT 9447 55.374 23.737 5.688 1.00 0.00 H ATOM 7467 H2 WAT 9447 54.846 24.504 4.495 1.00 0.00 H TER 7469 WAT 9447 ATOM 7469 O WAT 9448 68.052 104.784 59.686 1.00 0.00 O ATOM 7470 H1 WAT 9448 68.549 105.289 59.043 1.00 0.00 H ATOM 7471 H2 WAT 9448 67.228 104.578 59.245 1.00 0.00 H TER 7473 WAT 9448 ATOM 7473 O WAT 9449 88.638 31.365 112.334 1.00 0.00 O ATOM 7474 H1 WAT 9449 88.413 31.493 111.413 1.00 0.00 H ATOM 7475 H2 WAT 9449 89.580 31.195 112.330 1.00 0.00 H TER 7477 WAT 9449 ATOM 7477 O WAT 9450 90.186 129.498 104.057 1.00 0.00 O ATOM 7478 H1 WAT 9450 90.006 129.763 103.155 1.00 0.00 H ATOM 7479 H2 WAT 9450 89.570 128.786 104.225 1.00 0.00 H TER 7481 WAT 9450 ATOM 7481 O WAT 9451 75.981 4.452 118.222 1.00 0.00 O ATOM 7482 H1 WAT 9451 76.449 4.796 118.982 1.00 0.00 H ATOM 7483 H2 WAT 9451 76.082 5.127 117.551 1.00 0.00 H TER 7485 WAT 9451 ATOM 7485 O WAT 9452 139.934 73.976 82.196 1.00 0.00 O ATOM 7486 H1 WAT 9452 139.378 74.322 81.499 1.00 0.00 H ATOM 7487 H2 WAT 9452 140.819 74.253 81.957 1.00 0.00 H TER 7489 WAT 9452 ATOM 7489 O WAT 9453 25.144 24.873 129.458 1.00 0.00 O ATOM 7490 H1 WAT 9453 25.477 24.752 130.347 1.00 0.00 H ATOM 7491 H2 WAT 9453 25.591 24.202 128.942 1.00 0.00 H TER 7493 WAT 9453 ATOM 7493 O WAT 9454 66.979 10.956 130.900 1.00 0.00 O ATOM 7494 H1 WAT 9454 67.136 11.012 131.843 1.00 0.00 H ATOM 7495 H2 WAT 9454 67.845 11.056 130.507 1.00 0.00 H TER 7497 WAT 9454 ATOM 7497 O WAT 9455 99.188 9.179 149.524 1.00 0.00 O ATOM 7498 H1 WAT 9455 100.000 8.694 149.375 1.00 0.00 H ATOM 7499 H2 WAT 9455 99.399 10.080 149.279 1.00 0.00 H TER 7501 WAT 9455 ATOM 7501 O WAT 9456 94.258 29.210 110.857 1.00 0.00 O ATOM 7502 H1 WAT 9456 93.469 29.651 110.541 1.00 0.00 H ATOM 7503 H2 WAT 9456 94.954 29.522 110.279 1.00 0.00 H TER 7505 WAT 9456 ATOM 7505 O WAT 9457 15.508 122.738 143.757 1.00 0.00 O ATOM 7506 H1 WAT 9457 15.643 123.638 143.459 1.00 0.00 H ATOM 7507 H2 WAT 9457 16.376 122.336 143.704 1.00 0.00 H TER 7509 WAT 9457 ATOM 7509 O WAT 9458 40.697 13.857 101.088 1.00 0.00 O ATOM 7510 H1 WAT 9458 40.367 14.349 100.336 1.00 0.00 H ATOM 7511 H2 WAT 9458 41.558 13.544 100.810 1.00 0.00 H TER 7513 WAT 9458 ATOM 7513 O WAT 9459 50.614 3.570 153.766 1.00 0.00 O ATOM 7514 H1 WAT 9459 50.822 3.190 152.912 1.00 0.00 H ATOM 7515 H2 WAT 9459 51.424 3.485 154.269 1.00 0.00 H TER 7517 WAT 9459 ATOM 7517 O WAT 9460 57.581 120.536 75.712 1.00 0.00 O ATOM 7518 H1 WAT 9460 57.912 119.688 75.418 1.00 0.00 H ATOM 7519 H2 WAT 9460 57.456 120.430 76.655 1.00 0.00 H TER 7521 WAT 9460 ATOM 7521 O WAT 9461 124.643 145.482 12.064 1.00 0.00 O ATOM 7522 H1 WAT 9461 124.716 145.909 12.917 1.00 0.00 H ATOM 7523 H2 WAT 9461 123.751 145.675 11.775 1.00 0.00 H TER 7525 WAT 9461 ATOM 7525 O WAT 9462 124.962 63.965 5.811 1.00 0.00 O ATOM 7526 H1 WAT 9462 125.502 63.475 6.431 1.00 0.00 H ATOM 7527 H2 WAT 9462 125.560 64.607 5.428 1.00 0.00 H TER 7529 WAT 9462 ATOM 7529 O WAT 9463 133.976 111.771 95.198 1.00 0.00 O ATOM 7530 H1 WAT 9463 134.439 112.234 95.896 1.00 0.00 H ATOM 7531 H2 WAT 9463 134.631 111.178 94.828 1.00 0.00 H TER 7533 WAT 9463 ATOM 7533 O WAT 9464 58.929 28.939 140.730 1.00 0.00 O ATOM 7534 H1 WAT 9464 58.833 27.989 140.662 1.00 0.00 H ATOM 7535 H2 WAT 9464 59.595 29.065 141.405 1.00 0.00 H TER 7537 WAT 9464 ATOM 7537 O WAT 9465 30.728 72.108 145.662 1.00 0.00 O ATOM 7538 H1 WAT 9465 29.918 71.626 145.826 1.00 0.00 H ATOM 7539 H2 WAT 9465 31.227 72.023 146.475 1.00 0.00 H TER 7541 WAT 9465 ATOM 7541 O WAT 9466 49.894 33.203 136.369 1.00 0.00 O ATOM 7542 H1 WAT 9466 49.071 32.745 136.200 1.00 0.00 H ATOM 7543 H2 WAT 9466 49.955 33.853 135.670 1.00 0.00 H TER 7545 WAT 9466 ATOM 7545 O WAT 9467 141.672 122.740 106.972 1.00 0.00 O ATOM 7546 H1 WAT 9467 142.499 123.096 106.650 1.00 0.00 H ATOM 7547 H2 WAT 9467 141.071 123.485 106.965 1.00 0.00 H TER 7549 WAT 9467 ATOM 7549 O WAT 9468 27.369 122.095 114.554 1.00 0.00 O ATOM 7550 H1 WAT 9468 27.651 123.010 114.545 1.00 0.00 H ATOM 7551 H2 WAT 9468 26.561 122.099 115.068 1.00 0.00 H TER 7553 WAT 9468 ATOM 7553 O WAT 9469 121.930 115.400 119.133 1.00 0.00 O ATOM 7554 H1 WAT 9469 122.438 116.174 118.888 1.00 0.00 H ATOM 7555 H2 WAT 9469 121.779 115.499 120.072 1.00 0.00 H TER 7557 WAT 9469 ATOM 7557 O WAT 9470 125.781 72.248 19.169 1.00 0.00 O ATOM 7558 H1 WAT 9470 125.428 72.645 18.372 1.00 0.00 H ATOM 7559 H2 WAT 9470 125.220 71.489 19.327 1.00 0.00 H TER 7561 WAT 9470 ATOM 7561 O WAT 9471 33.873 16.393 81.131 1.00 0.00 O ATOM 7562 H1 WAT 9471 33.011 16.012 80.962 1.00 0.00 H ATOM 7563 H2 WAT 9471 34.257 16.511 80.262 1.00 0.00 H TER 7565 WAT 9471 ATOM 7565 O WAT 9472 13.454 27.426 153.725 1.00 0.00 O ATOM 7566 H1 WAT 9472 12.596 27.815 153.898 1.00 0.00 H ATOM 7567 H2 WAT 9472 13.401 26.550 154.108 1.00 0.00 H TER 7569 WAT 9472 ATOM 7569 O WAT 9473 112.014 75.855 138.856 1.00 0.00 O ATOM 7570 H1 WAT 9473 112.739 76.214 139.367 1.00 0.00 H ATOM 7571 H2 WAT 9473 111.430 76.600 138.714 1.00 0.00 H TER 7573 WAT 9473 ATOM 7573 O WAT 9474 9.528 132.534 68.624 1.00 0.00 O ATOM 7574 H1 WAT 9474 9.041 131.996 68.000 1.00 0.00 H ATOM 7575 H2 WAT 9474 9.963 131.902 69.197 1.00 0.00 H TER 7577 WAT 9474 ATOM 7577 O WAT 9475 17.383 135.075 138.687 1.00 0.00 O ATOM 7578 H1 WAT 9475 18.010 134.415 138.389 1.00 0.00 H ATOM 7579 H2 WAT 9475 17.568 135.843 138.146 1.00 0.00 H TER 7581 WAT 9475 ATOM 7581 O WAT 9476 129.870 45.124 85.181 1.00 0.00 O ATOM 7582 H1 WAT 9476 130.813 45.263 85.098 1.00 0.00 H ATOM 7583 H2 WAT 9476 129.752 44.818 86.080 1.00 0.00 H TER 7585 WAT 9476 ATOM 7585 O WAT 9477 50.916 19.013 19.128 1.00 0.00 O ATOM 7586 H1 WAT 9477 51.472 19.561 19.682 1.00 0.00 H ATOM 7587 H2 WAT 9477 51.277 18.131 19.226 1.00 0.00 H TER 7589 WAT 9477 ATOM 7589 O WAT 9478 79.710 109.098 119.444 1.00 0.00 O ATOM 7590 H1 WAT 9478 80.435 108.485 119.321 1.00 0.00 H ATOM 7591 H2 WAT 9478 79.383 108.908 120.323 1.00 0.00 H TER 7593 WAT 9478 ATOM 7593 O WAT 9479 57.391 72.902 24.603 1.00 0.00 O ATOM 7594 H1 WAT 9479 57.999 72.275 24.996 1.00 0.00 H ATOM 7595 H2 WAT 9479 57.923 73.387 23.972 1.00 0.00 H TER 7597 WAT 9479 ATOM 7597 O WAT 9480 107.882 112.505 139.948 1.00 0.00 O ATOM 7598 H1 WAT 9480 108.650 111.962 140.125 1.00 0.00 H ATOM 7599 H2 WAT 9480 107.507 112.137 139.148 1.00 0.00 H TER 7601 WAT 9480 ATOM 7601 O WAT 9481 2.142 47.418 64.349 1.00 0.00 O ATOM 7602 H1 WAT 9481 1.936 46.755 65.008 1.00 0.00 H ATOM 7603 H2 WAT 9481 1.569 47.208 63.611 1.00 0.00 H TER 7605 WAT 9481 ATOM 7605 O WAT 9482 83.036 22.628 131.246 1.00 0.00 O ATOM 7606 H1 WAT 9482 82.671 23.443 131.590 1.00 0.00 H ATOM 7607 H2 WAT 9482 82.881 21.985 131.939 1.00 0.00 H TER 7609 WAT 9482 ATOM 7609 O WAT 9483 134.897 26.807 143.804 1.00 0.00 O ATOM 7610 H1 WAT 9483 135.286 26.139 144.370 1.00 0.00 H ATOM 7611 H2 WAT 9483 134.914 26.419 142.929 1.00 0.00 H TER 7613 WAT 9483 ATOM 7613 O WAT 9484 87.277 121.095 153.910 1.00 0.00 O ATOM 7614 H1 WAT 9484 87.996 120.919 153.303 1.00 0.00 H ATOM 7615 H2 WAT 9484 87.549 121.882 154.382 1.00 0.00 H TER 7617 WAT 9484 ATOM 7617 O WAT 9485 105.979 11.619 145.414 1.00 0.00 O ATOM 7618 H1 WAT 9485 105.147 11.334 145.037 1.00 0.00 H ATOM 7619 H2 WAT 9485 105.732 12.116 146.193 1.00 0.00 H TER 7621 WAT 9485 ATOM 7621 O WAT 9486 95.246 79.666 108.490 1.00 0.00 O ATOM 7622 H1 WAT 9486 94.734 79.830 109.282 1.00 0.00 H ATOM 7623 H2 WAT 9486 94.603 79.372 107.846 1.00 0.00 H TER 7625 WAT 9486 ATOM 7625 O WAT 9487 122.437 130.100 142.962 1.00 0.00 O ATOM 7626 H1 WAT 9487 122.821 129.362 143.434 1.00 0.00 H ATOM 7627 H2 WAT 9487 123.043 130.263 142.239 1.00 0.00 H TER 7629 WAT 9487 ATOM 7629 O WAT 9488 92.647 134.409 88.406 1.00 0.00 O ATOM 7630 H1 WAT 9488 91.734 134.644 88.245 1.00 0.00 H ATOM 7631 H2 WAT 9488 92.726 134.394 89.360 1.00 0.00 H TER 7633 WAT 9488 ATOM 7633 O WAT 9489 112.681 43.910 145.601 1.00 0.00 O ATOM 7634 H1 WAT 9489 113.631 43.947 145.489 1.00 0.00 H ATOM 7635 H2 WAT 9489 112.373 43.387 144.861 1.00 0.00 H TER 7637 WAT 9489 ATOM 7637 O WAT 9490 46.338 101.052 147.237 1.00 0.00 O ATOM 7638 H1 WAT 9490 45.973 101.057 148.122 1.00 0.00 H ATOM 7639 H2 WAT 9490 45.579 101.170 146.665 1.00 0.00 H TER 7641 WAT 9490 ATOM 7641 O WAT 9491 77.235 19.973 131.827 1.00 0.00 O ATOM 7642 H1 WAT 9491 77.009 20.337 132.683 1.00 0.00 H ATOM 7643 H2 WAT 9491 77.383 19.043 131.994 1.00 0.00 H TER 7645 WAT 9491 ATOM 7645 O WAT 9492 128.434 35.281 117.952 1.00 0.00 O ATOM 7646 H1 WAT 9492 127.863 34.975 117.247 1.00 0.00 H ATOM 7647 H2 WAT 9492 128.935 35.997 117.561 1.00 0.00 H TER 7649 WAT 9492 ATOM 7649 O WAT 9493 45.098 142.926 68.782 1.00 0.00 O ATOM 7650 H1 WAT 9493 45.079 142.051 69.171 1.00 0.00 H ATOM 7651 H2 WAT 9493 44.488 142.874 68.046 1.00 0.00 H TER 7653 WAT 9493 ATOM 7653 O WAT 9494 24.831 87.706 105.923 1.00 0.00 O ATOM 7654 H1 WAT 9494 25.700 87.585 105.541 1.00 0.00 H ATOM 7655 H2 WAT 9494 24.233 87.315 105.286 1.00 0.00 H TER 7657 WAT 9494 ATOM 7657 O WAT 9495 39.510 56.326 61.365 1.00 0.00 O ATOM 7658 H1 WAT 9495 39.710 55.392 61.303 1.00 0.00 H ATOM 7659 H2 WAT 9495 39.153 56.552 60.507 1.00 0.00 H TER 7661 WAT 9495 ATOM 7661 O WAT 9496 105.636 98.506 121.566 1.00 0.00 O ATOM 7662 H1 WAT 9496 104.844 98.530 121.029 1.00 0.00 H ATOM 7663 H2 WAT 9496 105.988 97.625 121.435 1.00 0.00 H TER 7665 WAT 9496 ATOM 7665 O WAT 9497 25.301 78.747 84.708 1.00 0.00 O ATOM 7666 H1 WAT 9497 25.070 79.659 84.533 1.00 0.00 H ATOM 7667 H2 WAT 9497 24.657 78.238 84.215 1.00 0.00 H TER 7669 WAT 9497 ATOM 7669 O WAT 9498 34.104 37.601 154.472 1.00 0.00 O ATOM 7670 H1 WAT 9498 34.610 38.272 154.931 1.00 0.00 H ATOM 7671 H2 WAT 9498 34.377 36.777 154.877 1.00 0.00 H TER 7673 WAT 9498 ATOM 7673 O WAT 9499 64.251 4.742 157.427 1.00 0.00 O ATOM 7674 H1 WAT 9499 64.790 4.036 157.072 1.00 0.00 H ATOM 7675 H2 WAT 9499 64.757 5.537 157.257 1.00 0.00 H TER 7677 WAT 9499 ATOM 7677 O WAT 9500 24.424 67.636 62.725 1.00 0.00 O ATOM 7678 H1 WAT 9500 23.913 67.227 63.423 1.00 0.00 H ATOM 7679 H2 WAT 9500 25.260 67.855 63.136 1.00 0.00 H TER 7681 WAT 9500 ATOM 7681 O WAT 9501 29.469 142.031 105.384 1.00 0.00 O ATOM 7682 H1 WAT 9501 29.648 142.033 106.324 1.00 0.00 H ATOM 7683 H2 WAT 9501 30.189 141.527 105.005 1.00 0.00 H TER 7685 WAT 9501 ATOM 7685 O WAT 9502 31.119 30.312 107.880 1.00 0.00 O ATOM 7686 H1 WAT 9502 31.515 31.177 107.982 1.00 0.00 H ATOM 7687 H2 WAT 9502 31.715 29.720 108.339 1.00 0.00 H TER 7689 WAT 9502 ATOM 7689 O WAT 9503 115.895 34.574 19.485 1.00 0.00 O ATOM 7690 H1 WAT 9503 115.650 34.427 18.571 1.00 0.00 H ATOM 7691 H2 WAT 9503 116.536 33.888 19.674 1.00 0.00 H TER 7693 WAT 9503 ATOM 7693 O WAT 9504 145.208 40.935 73.786 1.00 0.00 O ATOM 7694 H1 WAT 9504 144.638 40.627 74.491 1.00 0.00 H ATOM 7695 H2 WAT 9504 145.568 40.136 73.402 1.00 0.00 H TER 7697 WAT 9504 ATOM 7697 O WAT 9505 24.616 30.594 127.669 1.00 0.00 O ATOM 7698 H1 WAT 9505 24.929 31.498 127.639 1.00 0.00 H ATOM 7699 H2 WAT 9505 25.085 30.203 128.406 1.00 0.00 H TER 7701 WAT 9505 ATOM 7701 O WAT 9506 82.621 105.097 94.434 1.00 0.00 O ATOM 7702 H1 WAT 9506 81.770 104.661 94.383 1.00 0.00 H ATOM 7703 H2 WAT 9506 82.662 105.439 95.327 1.00 0.00 H TER 7705 WAT 9506 ATOM 7705 O WAT 9507 15.086 105.410 8.931 1.00 0.00 O ATOM 7706 H1 WAT 9507 14.760 104.995 9.729 1.00 0.00 H ATOM 7707 H2 WAT 9507 15.688 104.766 8.556 1.00 0.00 H TER 7709 WAT 9507 ATOM 7709 O WAT 9508 134.777 12.541 0.911 1.00 0.00 O ATOM 7710 H1 WAT 9508 134.245 13.331 0.817 1.00 0.00 H ATOM 7711 H2 WAT 9508 134.161 11.871 1.208 1.00 0.00 H TER 7713 WAT 9508 ATOM 7713 O WAT 9509 101.534 7.655 149.884 1.00 0.00 O ATOM 7714 H1 WAT 9509 102.460 7.464 150.029 1.00 0.00 H ATOM 7715 H2 WAT 9509 101.137 6.802 149.709 1.00 0.00 H TER 7717 WAT 9509 ATOM 7717 O WAT 9510 98.466 134.766 145.488 1.00 0.00 O ATOM 7718 H1 WAT 9510 98.185 134.002 144.985 1.00 0.00 H ATOM 7719 H2 WAT 9510 97.921 134.747 146.276 1.00 0.00 H TER 7721 WAT 9510 ATOM 7721 O WAT 9511 3.418 2.220 9.656 1.00 0.00 O ATOM 7722 H1 WAT 9511 4.064 2.524 10.293 1.00 0.00 H ATOM 7723 H2 WAT 9511 3.396 1.270 9.772 1.00 0.00 H TER 7725 WAT 9511 ATOM 7725 O WAT 9512 22.731 25.257 1.858 1.00 0.00 O ATOM 7726 H1 WAT 9512 22.253 26.055 2.083 1.00 0.00 H ATOM 7727 H2 WAT 9512 22.571 24.666 2.594 1.00 0.00 H TER 7729 WAT 9512 ATOM 7729 O WAT 9513 122.003 89.794 139.750 1.00 0.00 O ATOM 7730 H1 WAT 9513 121.417 90.525 139.949 1.00 0.00 H ATOM 7731 H2 WAT 9513 122.752 89.923 140.332 1.00 0.00 H TER 7733 WAT 9513 ATOM 7733 O WAT 9514 61.610 68.953 108.248 1.00 0.00 O ATOM 7734 H1 WAT 9514 60.897 68.879 107.614 1.00 0.00 H ATOM 7735 H2 WAT 9514 61.864 69.876 108.216 1.00 0.00 H TER 7737 WAT 9514 ATOM 7737 O WAT 9515 50.834 35.078 108.990 1.00 0.00 O ATOM 7738 H1 WAT 9515 50.123 34.594 109.410 1.00 0.00 H ATOM 7739 H2 WAT 9515 51.161 35.663 109.673 1.00 0.00 H TER 7741 WAT 9515 ATOM 7741 O WAT 9516 105.049 108.796 31.590 1.00 0.00 O ATOM 7742 H1 WAT 9516 104.798 107.873 31.568 1.00 0.00 H ATOM 7743 H2 WAT 9516 104.229 109.263 31.753 1.00 0.00 H TER 7745 WAT 9516 ATOM 7745 O WAT 9517 86.376 133.200 133.144 1.00 0.00 O ATOM 7746 H1 WAT 9517 87.266 133.549 133.182 1.00 0.00 H ATOM 7747 H2 WAT 9517 85.813 133.964 133.272 1.00 0.00 H TER 7749 WAT 9517 ATOM 7749 O WAT 9518 80.239 60.739 80.364 1.00 0.00 O ATOM 7750 H1 WAT 9518 79.672 60.106 79.925 1.00 0.00 H ATOM 7751 H2 WAT 9518 81.124 60.399 80.234 1.00 0.00 H TER 7753 WAT 9518 ATOM 7753 O WAT 9519 4.847 33.556 10.278 1.00 0.00 O ATOM 7754 H1 WAT 9519 4.972 34.028 11.102 1.00 0.00 H ATOM 7755 H2 WAT 9519 5.368 34.045 9.641 1.00 0.00 H TER 7757 WAT 9519 ATOM 7757 O WAT 9520 116.927 111.507 73.268 1.00 0.00 O ATOM 7758 H1 WAT 9520 117.379 110.920 73.874 1.00 0.00 H ATOM 7759 H2 WAT 9520 116.089 111.692 73.694 1.00 0.00 H TER 7761 WAT 9520 ATOM 7761 O WAT 9521 116.765 30.174 93.632 1.00 0.00 O ATOM 7762 H1 WAT 9521 116.851 29.935 92.709 1.00 0.00 H ATOM 7763 H2 WAT 9521 116.218 29.484 94.008 1.00 0.00 H TER 7765 WAT 9521 ATOM 7765 O WAT 9522 67.158 125.911 1.572 1.00 0.00 O ATOM 7766 H1 WAT 9522 67.949 125.377 1.508 1.00 0.00 H ATOM 7767 H2 WAT 9522 66.557 125.527 0.933 1.00 0.00 H TER 7769 WAT 9522 ATOM 7769 O WAT 9523 119.481 93.017 61.115 1.00 0.00 O ATOM 7770 H1 WAT 9523 118.760 92.960 60.488 1.00 0.00 H ATOM 7771 H2 WAT 9523 119.959 93.806 60.859 1.00 0.00 H TER 7773 WAT 9523 ATOM 7773 O WAT 9524 21.484 100.437 16.464 1.00 0.00 O ATOM 7774 H1 WAT 9524 22.160 99.773 16.603 1.00 0.00 H ATOM 7775 H2 WAT 9524 20.796 99.980 15.980 1.00 0.00 H TER 7777 WAT 9524 ATOM 7777 O WAT 9525 145.466 92.664 24.031 1.00 0.00 O ATOM 7778 H1 WAT 9525 145.790 92.223 23.246 1.00 0.00 H ATOM 7779 H2 WAT 9525 145.517 91.999 24.717 1.00 0.00 H TER 7781 WAT 9525 ATOM 7781 O WAT 9526 68.073 18.612 126.624 1.00 0.00 O ATOM 7782 H1 WAT 9526 68.040 19.531 126.356 1.00 0.00 H ATOM 7783 H2 WAT 9526 68.257 18.134 125.816 1.00 0.00 H TER 7785 WAT 9526 ATOM 7785 O WAT 9527 6.696 11.697 76.819 1.00 0.00 O ATOM 7786 H1 WAT 9527 6.349 12.564 77.030 1.00 0.00 H ATOM 7787 H2 WAT 9527 7.156 11.818 75.989 1.00 0.00 H TER 7789 WAT 9527 ATOM 7789 O WAT 9528 30.139 123.990 76.886 1.00 0.00 O ATOM 7790 H1 WAT 9528 30.790 124.653 77.113 1.00 0.00 H ATOM 7791 H2 WAT 9528 29.342 124.274 77.334 1.00 0.00 H TER 7793 WAT 9528 ATOM 7793 O WAT 9529 80.726 34.575 116.156 1.00 0.00 O ATOM 7794 H1 WAT 9529 80.313 33.956 115.554 1.00 0.00 H ATOM 7795 H2 WAT 9529 80.019 34.848 116.742 1.00 0.00 H TER 7797 WAT 9529 ATOM 7797 O WAT 9530 59.772 104.965 137.911 1.00 0.00 O ATOM 7798 H1 WAT 9530 60.167 105.364 138.686 1.00 0.00 H ATOM 7799 H2 WAT 9530 60.508 104.574 137.441 1.00 0.00 H TER 7801 WAT 9530 ATOM 7801 O WAT 9531 107.600 83.813 102.245 1.00 0.00 O ATOM 7802 H1 WAT 9531 107.049 84.434 101.770 1.00 0.00 H ATOM 7803 H2 WAT 9531 108.493 84.033 101.980 1.00 0.00 H TER 7805 WAT 9531 ATOM 7805 O WAT 9532 94.739 99.570 144.316 1.00 0.00 O ATOM 7806 H1 WAT 9532 95.621 99.200 144.357 1.00 0.00 H ATOM 7807 H2 WAT 9532 94.762 100.161 143.564 1.00 0.00 H TER 7809 WAT 9532 ATOM 7809 O WAT 9533 65.715 70.315 150.739 1.00 0.00 O ATOM 7810 H1 WAT 9533 65.252 71.142 150.870 1.00 0.00 H ATOM 7811 H2 WAT 9533 66.507 70.397 151.271 1.00 0.00 H TER 7813 WAT 9533 ATOM 7813 O WAT 9534 66.507 27.081 150.018 1.00 0.00 O ATOM 7814 H1 WAT 9534 65.661 27.490 149.838 1.00 0.00 H ATOM 7815 H2 WAT 9534 66.888 26.929 149.153 1.00 0.00 H TER 7817 WAT 9534 ATOM 7817 O WAT 9535 5.680 30.280 143.547 1.00 0.00 O ATOM 7818 H1 WAT 9535 5.102 30.869 143.062 1.00 0.00 H ATOM 7819 H2 WAT 9535 6.278 30.862 144.014 1.00 0.00 H TER 7821 WAT 9535 ATOM 7821 O WAT 9536 94.545 117.288 129.370 1.00 0.00 O ATOM 7822 H1 WAT 9536 94.571 116.366 129.626 1.00 0.00 H ATOM 7823 H2 WAT 9536 93.757 117.364 128.831 1.00 0.00 H TER 7825 WAT 9536 ATOM 7825 O WAT 9537 132.131 71.889 24.840 1.00 0.00 O ATOM 7826 H1 WAT 9537 132.459 72.755 25.084 1.00 0.00 H ATOM 7827 H2 WAT 9537 132.746 71.579 24.175 1.00 0.00 H TER 7829 WAT 9537 ATOM 7829 O WAT 9538 81.895 118.694 114.903 1.00 0.00 O ATOM 7830 H1 WAT 9538 81.201 119.110 114.391 1.00 0.00 H ATOM 7831 H2 WAT 9538 81.579 118.728 115.806 1.00 0.00 H TER 7833 WAT 9538 ATOM 7833 O WAT 9539 129.401 101.702 16.074 1.00 0.00 O ATOM 7834 H1 WAT 9539 130.309 101.430 16.213 1.00 0.00 H ATOM 7835 H2 WAT 9539 128.972 101.546 16.915 1.00 0.00 H TER 7837 WAT 9539 ATOM 7837 O WAT 9540 37.632 99.383 121.204 1.00 0.00 O ATOM 7838 H1 WAT 9540 36.954 100.056 121.137 1.00 0.00 H ATOM 7839 H2 WAT 9540 37.633 98.957 120.347 1.00 0.00 H TER 7841 WAT 9540 ATOM 7841 O WAT 9541 44.687 3.185 108.830 1.00 0.00 O ATOM 7842 H1 WAT 9541 43.798 2.831 108.851 1.00 0.00 H ATOM 7843 H2 WAT 9541 44.755 3.708 109.629 1.00 0.00 H TER 7845 WAT 9541 ATOM 7845 O WAT 9542 116.405 144.886 10.496 1.00 0.00 O ATOM 7846 H1 WAT 9542 116.696 144.851 9.585 1.00 0.00 H ATOM 7847 H2 WAT 9542 115.463 145.047 10.441 1.00 0.00 H TER 7849 WAT 9542 ATOM 7849 O WAT 9543 69.655 116.347 7.211 1.00 0.00 O ATOM 7850 H1 WAT 9543 69.437 117.270 7.081 1.00 0.00 H ATOM 7851 H2 WAT 9543 70.203 116.122 6.458 1.00 0.00 H TER 7853 WAT 9543 ATOM 7853 O WAT 9544 38.109 121.474 21.063 1.00 0.00 O ATOM 7854 H1 WAT 9544 39.039 121.619 20.885 1.00 0.00 H ATOM 7855 H2 WAT 9544 37.915 122.047 21.804 1.00 0.00 H TER 7857 WAT 9544 ATOM 7857 O WAT 9545 104.105 84.333 82.955 1.00 0.00 O ATOM 7858 H1 WAT 9545 104.501 83.498 83.204 1.00 0.00 H ATOM 7859 H2 WAT 9545 103.165 84.153 82.925 1.00 0.00 H TER 7861 WAT 9545 ATOM 7861 O WAT 9546 40.278 77.227 114.112 1.00 0.00 O ATOM 7862 H1 WAT 9546 41.117 77.683 114.182 1.00 0.00 H ATOM 7863 H2 WAT 9546 40.402 76.419 114.611 1.00 0.00 H TER 7865 WAT 9546 ATOM 7865 O WAT 9547 110.898 40.489 134.695 1.00 0.00 O ATOM 7866 H1 WAT 9547 110.543 39.627 134.914 1.00 0.00 H ATOM 7867 H2 WAT 9547 110.812 40.994 135.503 1.00 0.00 H TER 7869 WAT 9547 ATOM 7869 O WAT 9548 130.207 142.903 102.640 1.00 0.00 O ATOM 7870 H1 WAT 9548 129.778 142.380 101.963 1.00 0.00 H ATOM 7871 H2 WAT 9548 129.550 142.988 103.330 1.00 0.00 H TER 7873 WAT 9548 ATOM 7873 O WAT 9549 1.315 97.098 64.707 1.00 0.00 O ATOM 7874 H1 WAT 9549 1.303 96.464 63.991 1.00 0.00 H ATOM 7875 H2 WAT 9549 1.748 96.639 65.427 1.00 0.00 H TER 7877 WAT 9549 ATOM 7877 O WAT 9550 122.042 119.467 9.270 1.00 0.00 O ATOM 7878 H1 WAT 9550 122.623 120.159 8.953 1.00 0.00 H ATOM 7879 H2 WAT 9550 121.439 119.310 8.543 1.00 0.00 H TER 7881 WAT 9550 ATOM 7881 O WAT 9551 102.937 54.889 1.172 1.00 0.00 O ATOM 7882 H1 WAT 9551 103.548 55.039 0.450 1.00 0.00 H ATOM 7883 H2 WAT 9551 102.945 55.708 1.667 1.00 0.00 H TER 7885 WAT 9551 ATOM 7885 O WAT 9552 15.902 50.295 0.630 1.00 0.00 O ATOM 7886 H1 WAT 9552 16.493 50.747 1.232 1.00 0.00 H ATOM 7887 H2 WAT 9552 16.169 50.596 -0.238 1.00 0.00 H TER 7889 WAT 9552 ATOM 7889 O WAT 9553 113.516 119.860 141.840 1.00 0.00 O ATOM 7890 H1 WAT 9553 114.202 120.528 141.867 1.00 0.00 H ATOM 7891 H2 WAT 9553 113.473 119.525 142.735 1.00 0.00 H TER 7893 WAT 9553 ATOM 7893 O WAT 9554 59.918 120.728 0.226 1.00 0.00 O ATOM 7894 H1 WAT 9554 59.176 120.340 -0.237 1.00 0.00 H ATOM 7895 H2 WAT 9554 60.080 120.134 0.959 1.00 0.00 H TER 7897 WAT 9554 ATOM 7897 O WAT 9555 23.234 29.604 88.054 1.00 0.00 O ATOM 7898 H1 WAT 9555 24.125 29.534 88.395 1.00 0.00 H ATOM 7899 H2 WAT 9555 23.348 29.728 87.111 1.00 0.00 H TER 7901 WAT 9555 ATOM 7901 O WAT 9556 47.514 131.975 140.810 1.00 0.00 O ATOM 7902 H1 WAT 9556 47.619 132.311 141.700 1.00 0.00 H ATOM 7903 H2 WAT 9556 47.691 132.729 140.247 1.00 0.00 H TER 7905 WAT 9556 ATOM 7905 O WAT 9557 122.753 82.870 67.640 1.00 0.00 O ATOM 7906 H1 WAT 9557 122.979 82.119 68.189 1.00 0.00 H ATOM 7907 H2 WAT 9557 123.469 83.490 67.776 1.00 0.00 H TER 7909 WAT 9557 ATOM 7909 O WAT 9558 38.699 61.448 68.513 1.00 0.00 O ATOM 7910 H1 WAT 9558 38.051 62.003 68.946 1.00 0.00 H ATOM 7911 H2 WAT 9558 38.885 60.756 69.148 1.00 0.00 H TER 7913 WAT 9558 ATOM 7913 O WAT 9559 46.633 16.326 152.418 1.00 0.00 O ATOM 7914 H1 WAT 9559 46.748 15.684 151.718 1.00 0.00 H ATOM 7915 H2 WAT 9559 47.128 17.091 152.125 1.00 0.00 H TER 7917 WAT 9559 ATOM 7917 O WAT 9560 105.248 76.387 131.314 1.00 0.00 O ATOM 7918 H1 WAT 9560 104.876 76.201 130.451 1.00 0.00 H ATOM 7919 H2 WAT 9560 105.293 75.534 131.745 1.00 0.00 H TER 7921 WAT 9560 ATOM 7921 O WAT 9561 13.875 50.259 6.388 1.00 0.00 O ATOM 7922 H1 WAT 9561 13.917 50.246 5.432 1.00 0.00 H ATOM 7923 H2 WAT 9561 14.439 50.989 6.643 1.00 0.00 H TER 7925 WAT 9561 ATOM 7925 O WAT 9562 121.398 142.295 98.510 1.00 0.00 O ATOM 7926 H1 WAT 9562 121.302 142.821 97.716 1.00 0.00 H ATOM 7927 H2 WAT 9562 121.072 141.429 98.264 1.00 0.00 H TER 7929 WAT 9562 ATOM 7929 O WAT 9563 88.016 97.507 70.949 1.00 0.00 O ATOM 7930 H1 WAT 9563 87.469 97.724 71.704 1.00 0.00 H ATOM 7931 H2 WAT 9563 87.391 97.289 70.256 1.00 0.00 H TER 7933 WAT 9563 ATOM 7933 O WAT 9564 57.488 79.764 112.139 1.00 0.00 O ATOM 7934 H1 WAT 9564 58.343 79.334 112.125 1.00 0.00 H ATOM 7935 H2 WAT 9564 57.071 79.442 112.938 1.00 0.00 H TER 7937 WAT 9564 ATOM 7937 O WAT 9565 132.736 137.727 106.792 1.00 0.00 O ATOM 7938 H1 WAT 9565 132.840 137.373 107.676 1.00 0.00 H ATOM 7939 H2 WAT 9565 132.016 137.220 106.415 1.00 0.00 H TER 7941 WAT 9565 ATOM 7941 O WAT 9566 57.519 112.443 10.459 1.00 0.00 O ATOM 7942 H1 WAT 9566 57.105 113.162 10.935 1.00 0.00 H ATOM 7943 H2 WAT 9566 56.828 111.786 10.369 1.00 0.00 H TER 7945 WAT 9566 ATOM 7945 O WAT 9567 4.509 134.301 131.791 1.00 0.00 O ATOM 7946 H1 WAT 9567 4.353 135.234 131.939 1.00 0.00 H ATOM 7947 H2 WAT 9567 4.317 133.890 132.634 1.00 0.00 H TER 7949 WAT 9567 ATOM 7949 O WAT 9568 99.685 76.214 117.767 1.00 0.00 O ATOM 7950 H1 WAT 9568 99.514 76.556 116.890 1.00 0.00 H ATOM 7951 H2 WAT 9568 99.950 75.306 117.622 1.00 0.00 H TER 7953 WAT 9568 ATOM 7953 O WAT 9569 3.632 61.857 122.171 1.00 0.00 O ATOM 7954 H1 WAT 9569 3.885 62.554 122.776 1.00 0.00 H ATOM 7955 H2 WAT 9569 2.907 62.228 121.669 1.00 0.00 H TER 7957 WAT 9569 ATOM 7957 O WAT 9570 110.030 142.947 4.757 1.00 0.00 O ATOM 7958 H1 WAT 9570 109.993 142.871 5.711 1.00 0.00 H ATOM 7959 H2 WAT 9570 110.755 143.551 4.593 1.00 0.00 H TER 7961 WAT 9570 ATOM 7961 O WAT 9571 1.305 144.498 115.873 1.00 0.00 O ATOM 7962 H1 WAT 9571 1.666 143.839 116.465 1.00 0.00 H ATOM 7963 H2 WAT 9571 1.110 144.017 115.069 1.00 0.00 H TER 7965 WAT 9571 ATOM 7965 O WAT 9572 117.038 33.577 81.615 1.00 0.00 O ATOM 7966 H1 WAT 9572 117.790 33.554 82.207 1.00 0.00 H ATOM 7967 H2 WAT 9572 117.141 34.394 81.127 1.00 0.00 H TER 7969 WAT 9572 ATOM 7969 O WAT 9573 80.844 1.913 134.810 1.00 0.00 O ATOM 7970 H1 WAT 9573 81.440 2.569 135.173 1.00 0.00 H ATOM 7971 H2 WAT 9573 80.187 1.783 135.493 1.00 0.00 H TER 7973 WAT 9573 ATOM 7973 O WAT 9574 102.270 141.102 93.114 1.00 0.00 O ATOM 7974 H1 WAT 9574 102.100 140.276 92.661 1.00 0.00 H ATOM 7975 H2 WAT 9574 101.531 141.203 93.714 1.00 0.00 H TER 7977 WAT 9574 ATOM 7977 O WAT 9575 66.382 51.724 120.169 1.00 0.00 O ATOM 7978 H1 WAT 9575 67.017 52.303 120.591 1.00 0.00 H ATOM 7979 H2 WAT 9575 66.367 52.010 119.256 1.00 0.00 H TER 7981 WAT 9575 ATOM 7981 O WAT 9576 123.998 13.774 155.482 1.00 0.00 O ATOM 7982 H1 WAT 9576 124.398 13.877 156.345 1.00 0.00 H ATOM 7983 H2 WAT 9576 124.569 14.268 154.893 1.00 0.00 H TER 7985 WAT 9576 ATOM 7985 O WAT 9577 12.851 99.601 157.025 1.00 0.00 O ATOM 7986 H1 WAT 9577 11.940 99.526 157.310 1.00 0.00 H ATOM 7987 H2 WAT 9577 13.042 100.537 157.077 1.00 0.00 H TER 7989 WAT 9577 ATOM 7989 O WAT 9578 36.294 48.334 105.523 1.00 0.00 O ATOM 7990 H1 WAT 9578 35.544 48.859 105.243 1.00 0.00 H ATOM 7991 H2 WAT 9578 36.172 47.491 105.086 1.00 0.00 H TER 7993 WAT 9578 ATOM 7993 O WAT 9579 38.135 133.494 74.330 1.00 0.00 O ATOM 7994 H1 WAT 9579 38.951 133.806 74.722 1.00 0.00 H ATOM 7995 H2 WAT 9579 37.955 132.668 74.778 1.00 0.00 H TER 7997 WAT 9579 ATOM 7997 O WAT 9580 122.685 99.106 60.134 1.00 0.00 O ATOM 7998 H1 WAT 9580 122.186 99.115 60.951 1.00 0.00 H ATOM 7999 H2 WAT 9580 122.706 98.184 59.877 1.00 0.00 H TER 8001 WAT 9580 ATOM 8001 O WAT 9581 112.435 113.494 70.150 1.00 0.00 O ATOM 8002 H1 WAT 9581 112.133 112.625 69.889 1.00 0.00 H ATOM 8003 H2 WAT 9581 111.645 114.033 70.150 1.00 0.00 H TER 8005 WAT 9581 ATOM 8005 O WAT 9582 87.521 95.448 100.508 1.00 0.00 O ATOM 8006 H1 WAT 9582 88.183 96.021 100.122 1.00 0.00 H ATOM 8007 H2 WAT 9582 88.008 94.896 101.120 1.00 0.00 H TER 8009 WAT 9582 ATOM 8009 O WAT 9583 68.093 92.877 11.281 1.00 0.00 O ATOM 8010 H1 WAT 9583 68.950 93.286 11.162 1.00 0.00 H ATOM 8011 H2 WAT 9583 67.638 93.031 10.452 1.00 0.00 H TER 8013 WAT 9583 ATOM 8013 O WAT 9584 50.058 40.061 16.798 1.00 0.00 O ATOM 8014 H1 WAT 9584 50.989 40.008 16.582 1.00 0.00 H ATOM 8015 H2 WAT 9584 49.985 39.630 17.649 1.00 0.00 H TER 8017 WAT 9584 ATOM 8017 O WAT 9585 92.043 63.670 148.345 1.00 0.00 O ATOM 8018 H1 WAT 9585 92.643 63.859 147.624 1.00 0.00 H ATOM 8019 H2 WAT 9585 91.282 64.225 148.175 1.00 0.00 H TER 8021 WAT 9585 ATOM 8021 O WAT 9586 30.334 38.173 100.001 1.00 0.00 O ATOM 8022 H1 WAT 9586 31.175 37.747 100.171 1.00 0.00 H ATOM 8023 H2 WAT 9586 29.898 38.191 100.853 1.00 0.00 H TER 8025 WAT 9586 ATOM 8025 O WAT 9587 65.573 127.104 134.497 1.00 0.00 O ATOM 8026 H1 WAT 9587 65.220 126.267 134.197 1.00 0.00 H ATOM 8027 H2 WAT 9587 66.461 126.898 134.789 1.00 0.00 H TER 8029 WAT 9587 ATOM 8029 O WAT 9588 136.915 24.168 7.221 1.00 0.00 O ATOM 8030 H1 WAT 9588 136.121 23.647 7.336 1.00 0.00 H ATOM 8031 H2 WAT 9588 137.215 24.347 8.112 1.00 0.00 H TER 8033 WAT 9588 ATOM 8033 O WAT 9589 126.929 88.928 134.230 1.00 0.00 O ATOM 8034 H1 WAT 9589 126.445 88.701 133.435 1.00 0.00 H ATOM 8035 H2 WAT 9589 126.611 89.800 134.463 1.00 0.00 H TER 8037 WAT 9589 ATOM 8037 O WAT 9590 105.648 84.847 87.780 1.00 0.00 O ATOM 8038 H1 WAT 9590 105.497 84.414 86.940 1.00 0.00 H ATOM 8039 H2 WAT 9590 104.788 85.181 88.035 1.00 0.00 H TER 8041 WAT 9590 ATOM 8041 O WAT 9591 102.768 41.440 135.564 1.00 0.00 O ATOM 8042 H1 WAT 9591 103.015 42.336 135.793 1.00 0.00 H ATOM 8043 H2 WAT 9591 102.251 41.136 136.311 1.00 0.00 H TER 8045 WAT 9591 ATOM 8045 O WAT 9592 118.668 121.213 21.389 1.00 0.00 O ATOM 8046 H1 WAT 9592 117.946 121.835 21.483 1.00 0.00 H ATOM 8047 H2 WAT 9592 118.925 121.007 22.288 1.00 0.00 H TER 8049 WAT 9592 ATOM 8049 O WAT 9593 52.738 123.305 144.740 1.00 0.00 O ATOM 8050 H1 WAT 9593 51.946 123.544 144.258 1.00 0.00 H ATOM 8051 H2 WAT 9593 53.417 123.879 144.386 1.00 0.00 H TER 8053 WAT 9593 ATOM 8053 O WAT 9594 87.199 85.718 74.223 1.00 0.00 O ATOM 8054 H1 WAT 9594 87.115 84.984 74.831 1.00 0.00 H ATOM 8055 H2 WAT 9594 86.983 86.489 74.747 1.00 0.00 H TER 8057 WAT 9594 ATOM 8057 O WAT 9595 108.536 24.361 79.399 1.00 0.00 O ATOM 8058 H1 WAT 9595 107.804 23.813 79.117 1.00 0.00 H ATOM 8059 H2 WAT 9595 109.222 23.739 79.640 1.00 0.00 H TER 8061 WAT 9595 ATOM 8061 O WAT 9596 0.166 68.877 59.646 1.00 0.00 O ATOM 8062 H1 WAT 9596 -0.393 69.181 58.932 1.00 0.00 H ATOM 8063 H2 WAT 9596 0.429 67.994 59.386 1.00 0.00 H TER 8065 WAT 9596 ATOM 8065 O WAT 9597 37.877 21.905 78.597 1.00 0.00 O ATOM 8066 H1 WAT 9597 37.973 22.397 79.413 1.00 0.00 H ATOM 8067 H2 WAT 9597 37.125 21.332 78.751 1.00 0.00 H TER 8069 WAT 9597 ATOM 8069 O WAT 9598 15.885 124.666 53.928 1.00 0.00 O ATOM 8070 H1 WAT 9598 15.403 125.493 53.942 1.00 0.00 H ATOM 8071 H2 WAT 9598 15.824 124.339 54.826 1.00 0.00 H TER 8073 WAT 9598 ATOM 8073 O WAT 9599 67.822 76.705 107.080 1.00 0.00 O ATOM 8074 H1 WAT 9599 67.894 77.658 107.030 1.00 0.00 H ATOM 8075 H2 WAT 9599 67.133 76.484 106.453 1.00 0.00 H TER 8077 WAT 9599 ATOM 8077 O WAT 9600 41.398 20.863 121.590 1.00 0.00 O ATOM 8078 H1 WAT 9600 40.747 20.161 121.618 1.00 0.00 H ATOM 8079 H2 WAT 9600 41.483 21.073 120.660 1.00 0.00 H TER 8081 WAT 9600 ATOM 8081 O WAT 9601 78.295 65.021 86.417 1.00 0.00 O ATOM 8082 H1 WAT 9601 77.924 65.902 86.356 1.00 0.00 H ATOM 8083 H2 WAT 9601 78.146 64.638 85.552 1.00 0.00 H TER 8085 WAT 9601 ATOM 8085 O WAT 9602 112.443 24.005 87.884 1.00 0.00 O ATOM 8086 H1 WAT 9602 112.764 24.740 87.361 1.00 0.00 H ATOM 8087 H2 WAT 9602 111.829 23.550 87.306 1.00 0.00 H TER 8089 WAT 9602 ATOM 8089 O WAT 9603 65.654 31.270 83.689 1.00 0.00 O ATOM 8090 H1 WAT 9603 65.654 31.071 84.626 1.00 0.00 H ATOM 8091 H2 WAT 9603 64.928 31.884 83.575 1.00 0.00 H TER 8093 WAT 9603 ATOM 8093 O WAT 9604 82.485 9.628 154.999 1.00 0.00 O ATOM 8094 H1 WAT 9604 81.955 8.845 155.147 1.00 0.00 H ATOM 8095 H2 WAT 9604 83.057 9.395 154.268 1.00 0.00 H TER 8097 WAT 9604 ATOM 8097 O WAT 9605 126.216 134.824 114.925 1.00 0.00 O ATOM 8098 H1 WAT 9605 126.180 135.479 115.622 1.00 0.00 H ATOM 8099 H2 WAT 9605 126.791 135.210 114.264 1.00 0.00 H TER 8101 WAT 9605 ATOM 8101 O WAT 9606 38.226 93.843 152.675 1.00 0.00 O ATOM 8102 H1 WAT 9606 37.352 94.200 152.831 1.00 0.00 H ATOM 8103 H2 WAT 9606 38.351 93.922 151.729 1.00 0.00 H TER 8105 WAT 9606 ATOM 8105 O WAT 9607 68.589 104.247 1.121 1.00 0.00 O ATOM 8106 H1 WAT 9607 68.802 104.423 2.037 1.00 0.00 H ATOM 8107 H2 WAT 9607 67.923 104.898 0.900 1.00 0.00 H TER 8109 WAT 9607 ATOM 8109 O WAT 9608 2.861 89.763 97.192 1.00 0.00 O ATOM 8110 H1 WAT 9608 2.469 89.263 96.476 1.00 0.00 H ATOM 8111 H2 WAT 9608 2.246 89.662 97.919 1.00 0.00 H TER 8113 WAT 9608 ATOM 8113 O WAT 9609 136.503 10.154 147.670 1.00 0.00 O ATOM 8114 H1 WAT 9609 137.381 9.850 147.442 1.00 0.00 H ATOM 8115 H2 WAT 9609 136.489 11.073 147.402 1.00 0.00 H TER 8117 WAT 9609 ATOM 8117 O WAT 9610 69.304 56.162 80.217 1.00 0.00 O ATOM 8118 H1 WAT 9610 68.599 56.810 80.212 1.00 0.00 H ATOM 8119 H2 WAT 9610 69.048 55.523 79.552 1.00 0.00 H TER 8121 WAT 9610 ATOM 8121 O WAT 9611 106.287 137.648 88.008 1.00 0.00 O ATOM 8122 H1 WAT 9611 106.807 137.327 88.745 1.00 0.00 H ATOM 8123 H2 WAT 9611 105.993 138.517 88.283 1.00 0.00 H TER 8125 WAT 9611 ATOM 8125 O WAT 9612 112.830 24.972 93.358 1.00 0.00 O ATOM 8126 H1 WAT 9612 113.727 25.079 93.675 1.00 0.00 H ATOM 8127 H2 WAT 9612 112.929 24.659 92.459 1.00 0.00 H TER 8129 WAT 9612 ATOM 8129 O WAT 9613 100.891 133.569 120.476 1.00 0.00 O ATOM 8130 H1 WAT 9613 101.710 133.852 120.070 1.00 0.00 H ATOM 8131 H2 WAT 9613 100.652 132.773 120.001 1.00 0.00 H TER 8133 WAT 9613 ATOM 8133 O WAT 9614 110.444 118.953 63.886 1.00 0.00 O ATOM 8134 H1 WAT 9614 111.033 118.573 63.234 1.00 0.00 H ATOM 8135 H2 WAT 9614 110.472 119.894 63.713 1.00 0.00 H TER 8137 WAT 9614 ATOM 8137 O WAT 9615 107.500 86.286 152.167 1.00 0.00 O ATOM 8138 H1 WAT 9615 106.863 85.976 151.523 1.00 0.00 H ATOM 8139 H2 WAT 9615 108.281 85.758 152.004 1.00 0.00 H TER 8141 WAT 9615 ATOM 8141 O WAT 9616 127.546 60.662 70.554 1.00 0.00 O ATOM 8142 H1 WAT 9616 128.288 60.193 70.172 1.00 0.00 H ATOM 8143 H2 WAT 9616 126.930 59.972 70.802 1.00 0.00 H TER 8145 WAT 9616 ATOM 8145 O WAT 9617 37.039 5.886 151.980 1.00 0.00 O ATOM 8146 H1 WAT 9617 37.814 5.643 151.474 1.00 0.00 H ATOM 8147 H2 WAT 9617 36.832 5.104 152.491 1.00 0.00 H TER 8149 WAT 9617 ATOM 8149 O WAT 9618 8.283 28.881 108.984 1.00 0.00 O ATOM 8150 H1 WAT 9618 7.450 29.322 109.154 1.00 0.00 H ATOM 8151 H2 WAT 9618 8.114 28.340 108.213 1.00 0.00 H TER 8153 WAT 9618 ATOM 8153 O WAT 9619 1.946 123.350 108.665 1.00 0.00 O ATOM 8154 H1 WAT 9619 1.122 123.062 109.058 1.00 0.00 H ATOM 8155 H2 WAT 9619 2.619 122.848 109.124 1.00 0.00 H TER 8157 WAT 9619 ATOM 8157 O WAT 9620 40.428 16.871 108.209 1.00 0.00 O ATOM 8158 H1 WAT 9620 41.342 16.588 108.210 1.00 0.00 H ATOM 8159 H2 WAT 9620 40.090 16.590 109.060 1.00 0.00 H TER 8161 WAT 9620 ATOM 8161 O WAT 9621 51.390 107.127 154.778 1.00 0.00 O ATOM 8162 H1 WAT 9621 50.799 107.303 155.510 1.00 0.00 H ATOM 8163 H2 WAT 9621 51.886 106.355 155.051 1.00 0.00 H TER 8165 WAT 9621 ATOM 8165 O WAT 9622 58.000 4.411 124.286 1.00 0.00 O ATOM 8166 H1 WAT 9622 57.889 5.231 124.767 1.00 0.00 H ATOM 8167 H2 WAT 9622 57.997 3.734 124.963 1.00 0.00 H TER 8169 WAT 9622 ATOM 8169 O WAT 9623 112.443 4.263 102.277 1.00 0.00 O ATOM 8170 H1 WAT 9623 112.166 4.042 103.167 1.00 0.00 H ATOM 8171 H2 WAT 9623 113.399 4.231 102.308 1.00 0.00 H TER 8173 WAT 9623 ATOM 8173 O WAT 9624 87.773 133.781 156.284 1.00 0.00 O ATOM 8174 H1 WAT 9624 87.168 133.615 157.007 1.00 0.00 H ATOM 8175 H2 WAT 9624 87.407 133.292 155.548 1.00 0.00 H TER 8177 WAT 9624 ATOM 8177 O WAT 9625 17.810 140.085 151.454 1.00 0.00 O ATOM 8178 H1 WAT 9625 18.376 139.334 151.634 1.00 0.00 H ATOM 8179 H2 WAT 9625 18.375 140.847 151.581 1.00 0.00 H TER 8181 WAT 9625 ATOM 8181 O WAT 9626 143.269 66.400 117.981 1.00 0.00 O ATOM 8182 H1 WAT 9626 143.552 65.490 118.074 1.00 0.00 H ATOM 8183 H2 WAT 9626 142.367 66.338 117.665 1.00 0.00 H TER 8185 WAT 9626 ATOM 8185 O WAT 9627 49.220 129.637 145.345 1.00 0.00 O ATOM 8186 H1 WAT 9627 48.444 129.671 144.785 1.00 0.00 H ATOM 8187 H2 WAT 9627 49.381 130.550 145.586 1.00 0.00 H TER 8189 WAT 9627 ATOM 8189 O WAT 9628 63.302 120.519 105.554 1.00 0.00 O ATOM 8190 H1 WAT 9628 64.014 120.310 106.159 1.00 0.00 H ATOM 8191 H2 WAT 9628 62.887 119.675 105.373 1.00 0.00 H TER 8193 WAT 9628 ATOM 8193 O WAT 9629 64.992 114.036 111.685 1.00 0.00 O ATOM 8194 H1 WAT 9629 65.080 113.117 111.431 1.00 0.00 H ATOM 8195 H2 WAT 9629 65.508 114.113 112.487 1.00 0.00 H TER 8197 WAT 9629 ATOM 8197 O WAT 9630 57.886 109.583 101.371 1.00 0.00 O ATOM 8198 H1 WAT 9630 57.312 110.217 100.942 1.00 0.00 H ATOM 8199 H2 WAT 9630 58.536 109.360 100.705 1.00 0.00 H TER 8201 WAT 9630 ATOM 8201 O WAT 9631 4.785 70.498 86.320 1.00 0.00 O ATOM 8202 H1 WAT 9631 4.297 70.907 85.606 1.00 0.00 H ATOM 8203 H2 WAT 9631 4.120 70.037 86.831 1.00 0.00 H TER 8205 WAT 9631 ATOM 8205 O WAT 9632 111.773 36.680 12.390 1.00 0.00 O ATOM 8206 H1 WAT 9632 110.893 36.306 12.428 1.00 0.00 H ATOM 8207 H2 WAT 9632 112.131 36.366 11.559 1.00 0.00 H TER 8209 WAT 9632 ATOM 8209 O WAT 9633 51.790 114.633 148.837 1.00 0.00 O ATOM 8210 H1 WAT 9633 51.043 114.158 149.202 1.00 0.00 H ATOM 8211 H2 WAT 9633 52.551 114.103 149.075 1.00 0.00 H TER 8213 WAT 9633 ATOM 8213 O WAT 9634 128.577 99.290 81.782 1.00 0.00 O ATOM 8214 H1 WAT 9634 128.260 99.724 80.990 1.00 0.00 H ATOM 8215 H2 WAT 9634 129.471 99.024 81.567 1.00 0.00 H TER 8217 WAT 9634 ATOM 8217 O WAT 9635 126.932 83.395 97.757 1.00 0.00 O ATOM 8218 H1 WAT 9635 127.789 83.799 97.623 1.00 0.00 H ATOM 8219 H2 WAT 9635 126.530 83.392 96.888 1.00 0.00 H TER 8221 WAT 9635 ATOM 8221 O WAT 9636 13.966 27.236 117.570 1.00 0.00 O ATOM 8222 H1 WAT 9636 13.524 26.919 116.783 1.00 0.00 H ATOM 8223 H2 WAT 9636 13.758 28.170 117.602 1.00 0.00 H TER 8225 WAT 9636 ATOM 8225 O WAT 9637 7.839 119.798 101.324 1.00 0.00 O ATOM 8226 H1 WAT 9637 8.678 120.203 101.545 1.00 0.00 H ATOM 8227 H2 WAT 9637 7.479 119.518 102.165 1.00 0.00 H TER 8229 WAT 9637 ATOM 8229 O WAT 9638 35.329 69.741 147.237 1.00 0.00 O ATOM 8230 H1 WAT 9638 35.557 70.061 148.110 1.00 0.00 H ATOM 8231 H2 WAT 9638 35.789 68.905 147.160 1.00 0.00 H TER 8233 WAT 9638 ATOM 8233 O WAT 9639 4.065 105.005 18.268 1.00 0.00 O ATOM 8234 H1 WAT 9639 3.193 105.390 18.182 1.00 0.00 H ATOM 8235 H2 WAT 9639 4.665 105.731 18.098 1.00 0.00 H TER 8237 WAT 9639 ATOM 8237 O WAT 9640 95.546 101.168 15.601 1.00 0.00 O ATOM 8238 H1 WAT 9640 94.987 100.831 14.902 1.00 0.00 H ATOM 8239 H2 WAT 9640 95.901 101.985 15.251 1.00 0.00 H TER 8241 WAT 9640 ATOM 8241 O WAT 9641 77.779 130.844 92.630 1.00 0.00 O ATOM 8242 H1 WAT 9641 77.809 131.123 91.715 1.00 0.00 H ATOM 8243 H2 WAT 9641 76.845 130.764 92.825 1.00 0.00 H TER 8245 WAT 9641 ATOM 8245 O WAT 9642 61.846 14.447 21.408 1.00 0.00 O ATOM 8246 H1 WAT 9642 62.691 14.137 21.733 1.00 0.00 H ATOM 8247 H2 WAT 9642 61.854 15.389 21.580 1.00 0.00 H TER 8249 WAT 9642 ATOM 8249 O WAT 9643 116.790 61.367 115.948 1.00 0.00 O ATOM 8250 H1 WAT 9643 116.004 60.828 115.854 1.00 0.00 H ATOM 8251 H2 WAT 9643 116.482 62.164 116.380 1.00 0.00 H TER 8253 WAT 9643 ATOM 8253 O WAT 9644 105.806 88.676 23.744 1.00 0.00 O ATOM 8254 H1 WAT 9644 104.910 88.451 23.996 1.00 0.00 H ATOM 8255 H2 WAT 9644 105.849 88.474 22.809 1.00 0.00 H TER 8257 WAT 9644 ATOM 8257 O WAT 9645 112.524 64.890 81.843 1.00 0.00 O ATOM 8258 H1 WAT 9645 113.480 64.918 81.890 1.00 0.00 H ATOM 8259 H2 WAT 9645 112.266 64.323 82.570 1.00 0.00 H TER 8261 WAT 9645 ATOM 8261 O WAT 9646 60.738 103.717 17.864 1.00 0.00 O ATOM 8262 H1 WAT 9646 61.202 103.195 17.209 1.00 0.00 H ATOM 8263 H2 WAT 9646 59.862 103.838 17.497 1.00 0.00 H TER 8265 WAT 9646 ATOM 8265 O WAT 9647 21.522 66.440 111.071 1.00 0.00 O ATOM 8266 H1 WAT 9647 22.437 66.498 111.346 1.00 0.00 H ATOM 8267 H2 WAT 9647 21.044 66.230 111.873 1.00 0.00 H TER 8269 WAT 9647 ATOM 8269 O WAT 9648 106.233 83.598 95.863 1.00 0.00 O ATOM 8270 H1 WAT 9648 106.688 83.234 95.103 1.00 0.00 H ATOM 8271 H2 WAT 9648 106.573 84.489 95.941 1.00 0.00 H TER 8273 WAT 9648 ATOM 8273 O WAT 9649 41.376 84.109 75.536 1.00 0.00 O ATOM 8274 H1 WAT 9649 40.805 84.214 76.297 1.00 0.00 H ATOM 8275 H2 WAT 9649 41.878 84.924 75.500 1.00 0.00 H TER 8277 WAT 9649 ATOM 8277 O WAT 9650 30.746 46.464 107.242 1.00 0.00 O ATOM 8278 H1 WAT 9650 31.542 46.815 106.844 1.00 0.00 H ATOM 8279 H2 WAT 9650 30.739 45.541 106.990 1.00 0.00 H TER 8281 WAT 9650 ATOM 8281 O WAT 9651 99.223 44.817 19.139 1.00 0.00 O ATOM 8282 H1 WAT 9651 98.813 43.995 18.868 1.00 0.00 H ATOM 8283 H2 WAT 9651 98.533 45.286 19.608 1.00 0.00 H TER 8285 WAT 9651 ATOM 8285 O WAT 9652 76.019 111.307 118.611 1.00 0.00 O ATOM 8286 H1 WAT 9652 76.043 112.006 117.958 1.00 0.00 H ATOM 8287 H2 WAT 9652 76.129 111.757 119.448 1.00 0.00 H TER 8289 WAT 9652 ATOM 8289 O WAT 9653 94.959 107.272 143.154 1.00 0.00 O ATOM 8290 H1 WAT 9653 94.651 106.457 142.758 1.00 0.00 H ATOM 8291 H2 WAT 9653 94.356 107.940 142.829 1.00 0.00 H TER 8293 WAT 9653 ATOM 8293 O WAT 9654 94.666 46.142 97.845 1.00 0.00 O ATOM 8294 H1 WAT 9654 94.012 46.837 97.774 1.00 0.00 H ATOM 8295 H2 WAT 9654 95.382 46.428 97.278 1.00 0.00 H TER 8297 WAT 9654 ATOM 8297 O WAT 9655 41.450 137.120 105.264 1.00 0.00 O ATOM 8298 H1 WAT 9655 41.217 137.578 104.457 1.00 0.00 H ATOM 8299 H2 WAT 9655 40.667 136.618 105.490 1.00 0.00 H TER 8301 WAT 9655 ATOM 8301 O WAT 9656 19.348 42.262 144.365 1.00 0.00 O ATOM 8302 H1 WAT 9656 19.021 41.778 145.123 1.00 0.00 H ATOM 8303 H2 WAT 9656 19.358 41.619 143.656 1.00 0.00 H TER 8305 WAT 9656 ATOM 8305 O WAT 9657 47.862 144.530 62.964 1.00 0.00 O ATOM 8306 H1 WAT 9657 47.413 143.730 62.688 1.00 0.00 H ATOM 8307 H2 WAT 9657 48.767 144.408 62.677 1.00 0.00 H TER 8309 WAT 9657 ATOM 8309 O WAT 9658 4.478 129.922 98.081 1.00 0.00 O ATOM 8310 H1 WAT 9658 4.713 129.754 97.169 1.00 0.00 H ATOM 8311 H2 WAT 9658 3.869 129.219 98.305 1.00 0.00 H TER 8313 WAT 9658 ATOM 8313 O WAT 9659 87.736 15.052 70.196 1.00 0.00 O ATOM 8314 H1 WAT 9659 86.975 15.615 70.333 1.00 0.00 H ATOM 8315 H2 WAT 9659 88.338 15.584 69.675 1.00 0.00 H TER 8317 WAT 9659 ATOM 8317 O WAT 9660 69.851 64.625 135.151 1.00 0.00 O ATOM 8318 H1 WAT 9660 69.872 63.774 134.714 1.00 0.00 H ATOM 8319 H2 WAT 9660 69.118 64.562 135.763 1.00 0.00 H TER 8321 WAT 9660 ATOM 8321 O WAT 9661 52.203 65.364 99.446 1.00 0.00 O ATOM 8322 H1 WAT 9661 51.637 65.353 100.218 1.00 0.00 H ATOM 8323 H2 WAT 9661 51.617 65.163 98.717 1.00 0.00 H TER 8325 WAT 9661 ATOM 8325 O WAT 9662 61.273 116.457 89.960 1.00 0.00 O ATOM 8326 H1 WAT 9662 62.074 116.657 90.445 1.00 0.00 H ATOM 8327 H2 WAT 9662 60.915 115.685 90.398 1.00 0.00 H TER 8329 WAT 9662 ATOM 8329 O WAT 9663 105.282 51.907 104.758 1.00 0.00 O ATOM 8330 H1 WAT 9663 105.706 51.122 105.103 1.00 0.00 H ATOM 8331 H2 WAT 9663 105.369 51.829 103.808 1.00 0.00 H TER 8333 WAT 9663 ATOM 8333 O WAT 9664 23.668 77.402 13.057 1.00 0.00 O ATOM 8334 H1 WAT 9664 23.166 76.653 13.378 1.00 0.00 H ATOM 8335 H2 WAT 9664 24.491 77.024 12.749 1.00 0.00 H TER 8337 WAT 9664 ATOM 8337 O WAT 9665 105.871 128.902 76.816 1.00 0.00 O ATOM 8338 H1 WAT 9665 105.476 129.173 75.987 1.00 0.00 H ATOM 8339 H2 WAT 9665 105.771 129.662 77.388 1.00 0.00 H TER 8341 WAT 9665 ATOM 8341 O WAT 9666 134.755 140.993 144.468 1.00 0.00 O ATOM 8342 H1 WAT 9666 133.957 140.567 144.781 1.00 0.00 H ATOM 8343 H2 WAT 9666 135.434 140.712 145.081 1.00 0.00 H TER 8345 WAT 9666 ATOM 8345 O WAT 9667 74.317 85.824 5.922 1.00 0.00 O ATOM 8346 H1 WAT 9667 75.230 86.069 6.073 1.00 0.00 H ATOM 8347 H2 WAT 9667 73.968 85.650 6.797 1.00 0.00 H TER 8349 WAT 9667 ATOM 8349 O WAT 9668 26.638 15.175 137.965 1.00 0.00 O ATOM 8350 H1 WAT 9668 27.075 15.651 138.671 1.00 0.00 H ATOM 8351 H2 WAT 9668 26.727 14.253 138.206 1.00 0.00 H TER 8353 WAT 9668 ATOM 8353 O WAT 9669 0.261 87.748 126.953 1.00 0.00 O ATOM 8354 H1 WAT 9669 0.530 87.392 127.800 1.00 0.00 H ATOM 8355 H2 WAT 9669 1.039 87.667 126.401 1.00 0.00 H TER 8357 WAT 9669 ATOM 8357 O WAT 9670 132.373 132.366 8.157 1.00 0.00 O ATOM 8358 H1 WAT 9670 132.873 132.655 7.394 1.00 0.00 H ATOM 8359 H2 WAT 9670 131.470 132.618 7.961 1.00 0.00 H TER 8361 WAT 9670 ATOM 8361 O WAT 9671 126.497 91.859 133.581 1.00 0.00 O ATOM 8362 H1 WAT 9671 126.782 92.127 132.707 1.00 0.00 H ATOM 8363 H2 WAT 9671 125.564 91.669 133.481 1.00 0.00 H TER 8365 WAT 9671 ATOM 8365 O WAT 9672 117.641 27.711 88.708 1.00 0.00 O ATOM 8366 H1 WAT 9672 118.498 27.337 88.914 1.00 0.00 H ATOM 8367 H2 WAT 9672 117.055 27.349 89.372 1.00 0.00 H TER 8369 WAT 9672 ATOM 8369 O WAT 9673 126.096 122.909 91.584 1.00 0.00 O ATOM 8370 H1 WAT 9673 125.575 123.044 92.376 1.00 0.00 H ATOM 8371 H2 WAT 9673 126.987 123.143 91.841 1.00 0.00 H TER 8373 WAT 9673 ATOM 8373 O WAT 9674 82.923 17.689 83.458 1.00 0.00 O ATOM 8374 H1 WAT 9674 82.954 18.580 83.108 1.00 0.00 H ATOM 8375 H2 WAT 9674 83.501 17.711 84.221 1.00 0.00 H TER 8377 WAT 9674 ATOM 8377 O WAT 9675 138.948 2.773 4.597 1.00 0.00 O ATOM 8378 H1 WAT 9675 139.233 2.272 3.833 1.00 0.00 H ATOM 8379 H2 WAT 9675 138.493 3.531 4.231 1.00 0.00 H TER 8381 WAT 9675 ATOM 8381 O WAT 9676 51.370 42.000 100.625 1.00 0.00 O ATOM 8382 H1 WAT 9676 50.724 41.718 101.272 1.00 0.00 H ATOM 8383 H2 WAT 9676 50.874 42.543 100.012 1.00 0.00 H TER 8385 WAT 9676 ATOM 8385 O WAT 9677 4.479 142.125 73.509 1.00 0.00 O ATOM 8386 H1 WAT 9677 3.948 141.351 73.321 1.00 0.00 H ATOM 8387 H2 WAT 9677 4.618 142.533 72.654 1.00 0.00 H TER 8389 WAT 9677 ATOM 8389 O WAT 9678 138.888 136.084 125.248 1.00 0.00 O ATOM 8390 H1 WAT 9678 138.912 135.542 126.037 1.00 0.00 H ATOM 8391 H2 WAT 9678 138.759 135.460 124.533 1.00 0.00 H TER 8393 WAT 9678 ATOM 8393 O WAT 9679 3.171 109.526 101.046 1.00 0.00 O ATOM 8394 H1 WAT 9679 3.039 108.889 100.344 1.00 0.00 H ATOM 8395 H2 WAT 9679 4.038 109.895 100.875 1.00 0.00 H TER 8397 WAT 9679 ATOM 8397 O WAT 9680 31.507 9.871 127.204 1.00 0.00 O ATOM 8398 H1 WAT 9680 32.411 10.067 127.452 1.00 0.00 H ATOM 8399 H2 WAT 9680 31.031 10.684 127.375 1.00 0.00 H TER 8401 WAT 9680 ATOM 8401 O WAT 9681 20.157 30.743 73.787 1.00 0.00 O ATOM 8402 H1 WAT 9681 20.530 29.887 73.576 1.00 0.00 H ATOM 8403 H2 WAT 9681 19.777 31.049 72.963 1.00 0.00 H TER 8405 WAT 9681 ATOM 8405 O WAT 9682 10.998 129.232 124.205 1.00 0.00 O ATOM 8406 H1 WAT 9682 10.492 128.425 124.116 1.00 0.00 H ATOM 8407 H2 WAT 9682 10.984 129.421 125.143 1.00 0.00 H TER 8409 WAT 9682 ATOM 8409 O WAT 9683 91.976 19.580 0.916 1.00 0.00 O ATOM 8410 H1 WAT 9683 92.027 19.273 0.010 1.00 0.00 H ATOM 8411 H2 WAT 9683 91.501 18.889 1.377 1.00 0.00 H TER 8413 WAT 9683 ATOM 8413 O WAT 9684 105.459 128.810 146.278 1.00 0.00 O ATOM 8414 H1 WAT 9684 105.966 128.484 147.022 1.00 0.00 H ATOM 8415 H2 WAT 9684 104.607 128.381 146.362 1.00 0.00 H TER 8417 WAT 9684 ATOM 8417 O WAT 9685 94.180 13.352 137.803 1.00 0.00 O ATOM 8418 H1 WAT 9685 94.917 13.018 137.292 1.00 0.00 H ATOM 8419 H2 WAT 9685 94.403 14.267 137.975 1.00 0.00 H TER 8421 WAT 9685 ATOM 8421 O WAT 9686 89.931 60.378 11.896 1.00 0.00 O ATOM 8422 H1 WAT 9686 89.028 60.222 11.618 1.00 0.00 H ATOM 8423 H2 WAT 9686 89.867 60.536 12.838 1.00 0.00 H TER 8425 WAT 9686 ATOM 8425 O WAT 9687 118.155 120.886 104.175 1.00 0.00 O ATOM 8426 H1 WAT 9687 118.471 120.534 105.007 1.00 0.00 H ATOM 8427 H2 WAT 9687 118.934 120.923 103.620 1.00 0.00 H TER 8429 WAT 9687 ATOM 8429 O WAT 9688 56.948 80.139 145.798 1.00 0.00 O ATOM 8430 H1 WAT 9688 56.471 79.759 145.061 1.00 0.00 H ATOM 8431 H2 WAT 9688 57.492 80.822 145.406 1.00 0.00 H TER 8433 WAT 9688 ATOM 8433 O WAT 9689 122.938 48.870 67.407 1.00 0.00 O ATOM 8434 H1 WAT 9689 122.120 49.242 67.075 1.00 0.00 H ATOM 8435 H2 WAT 9689 122.873 47.935 67.209 1.00 0.00 H TER 8437 WAT 9689 ATOM 8437 O WAT 9690 87.049 10.235 130.840 1.00 0.00 O ATOM 8438 H1 WAT 9690 87.144 11.187 130.845 1.00 0.00 H ATOM 8439 H2 WAT 9690 86.221 10.079 130.387 1.00 0.00 H TER 8441 WAT 9690 ATOM 8441 O WAT 9691 23.556 34.149 137.266 1.00 0.00 O ATOM 8442 H1 WAT 9691 22.856 33.526 137.074 1.00 0.00 H ATOM 8443 H2 WAT 9691 23.489 34.302 138.209 1.00 0.00 H TER 8445 WAT 9691 ATOM 8445 O WAT 9692 18.999 84.446 69.630 1.00 0.00 O ATOM 8446 H1 WAT 9692 18.666 84.784 68.798 1.00 0.00 H ATOM 8447 H2 WAT 9692 19.470 83.648 69.392 1.00 0.00 H TER 8449 WAT 9692 ATOM 8449 O WAT 9693 123.253 146.090 133.481 1.00 0.00 O ATOM 8450 H1 WAT 9693 122.700 145.851 132.737 1.00 0.00 H ATOM 8451 H2 WAT 9693 123.573 145.254 133.820 1.00 0.00 H TER 8453 WAT 9693 ATOM 8453 O WAT 9694 31.219 117.313 62.134 1.00 0.00 O ATOM 8454 H1 WAT 9694 30.402 116.872 61.902 1.00 0.00 H ATOM 8455 H2 WAT 9694 31.870 116.612 62.160 1.00 0.00 H TER 8457 WAT 9694 ATOM 8457 O WAT 9695 16.852 105.041 106.230 1.00 0.00 O ATOM 8458 H1 WAT 9695 16.682 105.556 107.019 1.00 0.00 H ATOM 8459 H2 WAT 9695 16.734 105.660 105.510 1.00 0.00 H TER 8461 WAT 9695 ATOM 8461 O WAT 9696 10.473 68.853 134.101 1.00 0.00 O ATOM 8462 H1 WAT 9696 9.811 69.413 133.694 1.00 0.00 H ATOM 8463 H2 WAT 9696 11.292 69.337 133.999 1.00 0.00 H TER 8465 WAT 9696 ATOM 8465 O WAT 9697 90.855 63.211 114.455 1.00 0.00 O ATOM 8466 H1 WAT 9697 91.576 63.464 115.031 1.00 0.00 H ATOM 8467 H2 WAT 9697 91.265 62.673 113.779 1.00 0.00 H TER 8469 WAT 9697 ATOM 8469 O WAT 9698 19.807 33.365 143.195 1.00 0.00 O ATOM 8470 H1 WAT 9698 19.347 33.376 144.034 1.00 0.00 H ATOM 8471 H2 WAT 9698 19.143 33.620 142.554 1.00 0.00 H TER 8473 WAT 9698 ATOM 8473 O WAT 9699 10.342 121.903 158.387 1.00 0.00 O ATOM 8474 H1 WAT 9699 10.901 121.685 159.133 1.00 0.00 H ATOM 8475 H2 WAT 9699 10.509 122.832 158.227 1.00 0.00 H TER 8477 WAT 9699 ATOM 8477 O WAT 9700 116.431 84.228 20.376 1.00 0.00 O ATOM 8478 H1 WAT 9700 116.524 84.631 21.240 1.00 0.00 H ATOM 8479 H2 WAT 9700 117.153 84.592 19.863 1.00 0.00 H TER 8481 WAT 9700 ATOM 8481 O WAT 9701 1.782 29.663 133.678 1.00 0.00 O ATOM 8482 H1 WAT 9701 0.842 29.768 133.822 1.00 0.00 H ATOM 8483 H2 WAT 9701 1.881 29.667 132.726 1.00 0.00 H TER 8485 WAT 9701 ATOM 8485 O WAT 9702 60.756 129.388 59.548 1.00 0.00 O ATOM 8486 H1 WAT 9702 59.905 129.505 59.126 1.00 0.00 H ATOM 8487 H2 WAT 9702 61.363 129.232 58.825 1.00 0.00 H TER 8489 WAT 9702 ATOM 8489 O WAT 9703 47.314 55.417 149.053 1.00 0.00 O ATOM 8490 H1 WAT 9703 46.913 54.803 148.438 1.00 0.00 H ATOM 8491 H2 WAT 9703 47.770 54.860 149.685 1.00 0.00 H TER 8493 WAT 9703 ATOM 8493 O WAT 9704 84.418 64.489 147.456 1.00 0.00 O ATOM 8494 H1 WAT 9704 83.831 64.877 146.807 1.00 0.00 H ATOM 8495 H2 WAT 9704 84.918 65.229 147.800 1.00 0.00 H TER 8497 WAT 9704 ATOM 8497 O WAT 9705 32.794 62.495 93.117 1.00 0.00 O ATOM 8498 H1 WAT 9705 33.472 63.028 92.701 1.00 0.00 H ATOM 8499 H2 WAT 9705 33.231 62.096 93.869 1.00 0.00 H TER 8501 WAT 9705 ATOM 8501 O WAT 9706 121.986 99.885 8.411 1.00 0.00 O ATOM 8502 H1 WAT 9706 121.838 99.497 9.273 1.00 0.00 H ATOM 8503 H2 WAT 9706 122.362 100.745 8.596 1.00 0.00 H TER 8505 WAT 9706 ATOM 8505 O WAT 9707 32.673 88.492 93.102 1.00 0.00 O ATOM 8506 H1 WAT 9707 33.600 88.599 93.318 1.00 0.00 H ATOM 8507 H2 WAT 9707 32.525 87.547 93.141 1.00 0.00 H TER 8509 WAT 9707 ATOM 8509 O WAT 9708 13.127 16.805 141.639 1.00 0.00 O ATOM 8510 H1 WAT 9708 12.208 16.548 141.568 1.00 0.00 H ATOM 8511 H2 WAT 9708 13.395 16.986 140.738 1.00 0.00 H TER 8513 WAT 9708 ATOM 8513 O WAT 9709 100.988 54.010 68.999 1.00 0.00 O ATOM 8514 H1 WAT 9709 101.491 54.312 69.755 1.00 0.00 H ATOM 8515 H2 WAT 9709 100.306 53.452 69.372 1.00 0.00 H TER 8517 WAT 9709 ATOM 8517 O WAT 9710 97.462 6.078 82.166 1.00 0.00 O ATOM 8518 H1 WAT 9710 97.594 7.024 82.234 1.00 0.00 H ATOM 8519 H2 WAT 9710 97.320 5.791 83.068 1.00 0.00 H TER 8521 WAT 9710 ATOM 8521 O WAT 9711 86.411 73.495 147.368 1.00 0.00 O ATOM 8522 H1 WAT 9711 87.124 74.133 147.370 1.00 0.00 H ATOM 8523 H2 WAT 9711 86.002 73.595 146.509 1.00 0.00 H TER 8525 WAT 9711 ATOM 8525 O WAT 9712 37.125 138.100 109.123 1.00 0.00 O ATOM 8526 H1 WAT 9712 37.605 137.507 109.702 1.00 0.00 H ATOM 8527 H2 WAT 9712 37.771 138.758 108.865 1.00 0.00 H TER 8529 WAT 9712 ATOM 8529 O WAT 9713 66.742 1.953 103.117 1.00 0.00 O ATOM 8530 H1 WAT 9713 67.243 2.731 103.364 1.00 0.00 H ATOM 8531 H2 WAT 9713 66.738 1.411 103.906 1.00 0.00 H TER 8533 WAT 9713 ATOM 8533 O WAT 9714 0.407 110.225 104.188 1.00 0.00 O ATOM 8534 H1 WAT 9714 0.303 110.531 103.287 1.00 0.00 H ATOM 8535 H2 WAT 9714 1.203 110.657 104.498 1.00 0.00 H TER 8537 WAT 9714 ATOM 8537 O WAT 9715 106.035 121.845 90.137 1.00 0.00 O ATOM 8538 H1 WAT 9715 106.301 121.185 90.778 1.00 0.00 H ATOM 8539 H2 WAT 9715 105.446 122.424 90.621 1.00 0.00 H TER 8541 WAT 9715 ATOM 8541 O WAT 9716 41.502 20.754 144.404 1.00 0.00 O ATOM 8542 H1 WAT 9716 41.499 20.412 143.510 1.00 0.00 H ATOM 8543 H2 WAT 9716 42.268 21.327 144.438 1.00 0.00 H TER 8545 WAT 9716 ATOM 8545 O WAT 9717 12.802 99.629 146.836 1.00 0.00 O ATOM 8546 H1 WAT 9717 12.855 99.764 145.890 1.00 0.00 H ATOM 8547 H2 WAT 9717 12.627 98.693 146.935 1.00 0.00 H TER 8549 WAT 9717 ATOM 8549 O WAT 9718 1.695 77.454 117.340 1.00 0.00 O ATOM 8550 H1 WAT 9718 2.005 78.346 117.499 1.00 0.00 H ATOM 8551 H2 WAT 9718 0.998 77.555 116.692 1.00 0.00 H TER 8553 WAT 9718 ATOM 8553 O WAT 9719 29.683 143.503 92.320 1.00 0.00 O ATOM 8554 H1 WAT 9719 29.475 144.433 92.230 1.00 0.00 H ATOM 8555 H2 WAT 9719 30.441 143.371 91.749 1.00 0.00 H TER 8557 WAT 9719 ATOM 8557 O WAT 9720 2.069 71.894 15.589 1.00 0.00 O ATOM 8558 H1 WAT 9720 2.349 71.785 16.498 1.00 0.00 H ATOM 8559 H2 WAT 9720 2.061 72.842 15.453 1.00 0.00 H TER 8561 WAT 9720 ATOM 8561 O WAT 9721 131.357 89.488 12.004 1.00 0.00 O ATOM 8562 H1 WAT 9721 130.438 89.377 11.760 1.00 0.00 H ATOM 8563 H2 WAT 9721 131.361 90.247 12.587 1.00 0.00 H TER 8565 WAT 9721 ATOM 8565 O WAT 9722 22.767 12.838 129.200 1.00 0.00 O ATOM 8566 H1 WAT 9722 22.809 11.917 129.455 1.00 0.00 H ATOM 8567 H2 WAT 9722 22.160 13.233 129.826 1.00 0.00 H TER 8569 WAT 9722 ATOM 8569 O WAT 9723 111.607 133.646 76.020 1.00 0.00 O ATOM 8570 H1 WAT 9723 112.420 133.418 76.469 1.00 0.00 H ATOM 8571 H2 WAT 9723 111.737 133.345 75.120 1.00 0.00 H TER 8573 WAT 9723 ATOM 8573 O WAT 9724 42.504 71.085 3.924 1.00 0.00 O ATOM 8574 H1 WAT 9724 43.111 71.013 4.660 1.00 0.00 H ATOM 8575 H2 WAT 9724 42.669 70.302 3.399 1.00 0.00 H TER 8577 WAT 9724 ATOM 8577 O WAT 9725 90.477 53.338 123.235 1.00 0.00 O ATOM 8578 H1 WAT 9725 90.071 54.143 122.915 1.00 0.00 H ATOM 8579 H2 WAT 9725 90.234 53.298 124.160 1.00 0.00 H TER 8581 WAT 9725 ATOM 8581 O WAT 9726 109.722 85.051 96.929 1.00 0.00 O ATOM 8582 H1 WAT 9726 109.073 85.004 97.630 1.00 0.00 H ATOM 8583 H2 WAT 9726 110.391 84.413 97.179 1.00 0.00 H TER 8585 WAT 9726 ATOM 8585 O WAT 9727 22.346 62.810 119.332 1.00 0.00 O ATOM 8586 H1 WAT 9727 22.154 62.410 118.485 1.00 0.00 H ATOM 8587 H2 WAT 9727 22.336 62.079 119.950 1.00 0.00 H TER 8589 WAT 9727 ATOM 8589 O WAT 9728 131.666 111.158 77.422 1.00 0.00 O ATOM 8590 H1 WAT 9728 131.581 110.705 78.261 1.00 0.00 H ATOM 8591 H2 WAT 9728 130.896 111.726 77.378 1.00 0.00 H TER 8593 WAT 9728 ATOM 8593 O WAT 9729 114.999 79.790 122.572 1.00 0.00 O ATOM 8594 H1 WAT 9729 114.202 79.415 122.196 1.00 0.00 H ATOM 8595 H2 WAT 9729 114.688 80.505 123.128 1.00 0.00 H TER 8597 WAT 9729 ATOM 8597 O WAT 9730 36.126 124.215 122.321 1.00 0.00 O ATOM 8598 H1 WAT 9730 37.042 124.146 122.053 1.00 0.00 H ATOM 8599 H2 WAT 9730 35.883 123.324 122.574 1.00 0.00 H TER 8601 WAT 9730 ATOM 8601 O WAT 9731 139.473 75.615 112.790 1.00 0.00 O ATOM 8602 H1 WAT 9731 140.144 76.019 113.340 1.00 0.00 H ATOM 8603 H2 WAT 9731 139.349 74.743 113.164 1.00 0.00 H TER 8605 WAT 9731 ATOM 8605 O WAT 9732 3.960 145.427 91.340 1.00 0.00 O ATOM 8606 H1 WAT 9732 4.137 146.229 91.831 1.00 0.00 H ATOM 8607 H2 WAT 9732 4.779 145.242 90.880 1.00 0.00 H TER 8609 WAT 9732 ATOM 8609 O WAT 9733 141.713 106.757 82.349 1.00 0.00 O ATOM 8610 H1 WAT 9733 142.096 105.899 82.532 1.00 0.00 H ATOM 8611 H2 WAT 9733 141.133 106.606 81.603 1.00 0.00 H TER 8613 WAT 9733 ATOM 8613 O WAT 9734 53.744 36.098 117.915 1.00 0.00 O ATOM 8614 H1 WAT 9734 53.924 35.163 118.012 1.00 0.00 H ATOM 8615 H2 WAT 9734 54.603 36.494 117.767 1.00 0.00 H TER 8617 WAT 9734 ATOM 8617 O WAT 9735 67.014 96.199 144.968 1.00 0.00 O ATOM 8618 H1 WAT 9735 67.282 97.118 144.945 1.00 0.00 H ATOM 8619 H2 WAT 9735 67.806 95.725 145.222 1.00 0.00 H TER 8621 WAT 9735 ATOM 8621 O WAT 9736 141.785 76.072 132.645 1.00 0.00 O ATOM 8622 H1 WAT 9736 141.273 76.555 133.293 1.00 0.00 H ATOM 8623 H2 WAT 9736 141.130 75.683 132.064 1.00 0.00 H TER 8625 WAT 9736 ATOM 8625 O WAT 9737 14.888 7.482 81.409 1.00 0.00 O ATOM 8626 H1 WAT 9737 15.391 7.845 80.681 1.00 0.00 H ATOM 8627 H2 WAT 9737 13.978 7.697 81.203 1.00 0.00 H TER 8629 WAT 9737 ATOM 8629 O WAT 9738 126.057 21.340 120.012 1.00 0.00 O ATOM 8630 H1 WAT 9738 126.639 22.097 120.075 1.00 0.00 H ATOM 8631 H2 WAT 9738 125.743 21.204 120.906 1.00 0.00 H TER 8633 WAT 9738 ATOM 8633 O WAT 9739 82.722 132.711 3.517 1.00 0.00 O ATOM 8634 H1 WAT 9739 83.126 132.723 4.385 1.00 0.00 H ATOM 8635 H2 WAT 9739 81.930 132.184 3.629 1.00 0.00 H TER 8637 WAT 9739 ATOM 8637 O WAT 9740 86.233 136.922 108.821 1.00 0.00 O ATOM 8638 H1 WAT 9740 85.395 136.537 109.076 1.00 0.00 H ATOM 8639 H2 WAT 9740 86.140 137.853 109.021 1.00 0.00 H TER 8641 WAT 9740 ATOM 8641 O WAT 9741 7.924 94.482 134.407 1.00 0.00 O ATOM 8642 H1 WAT 9741 7.177 94.049 133.994 1.00 0.00 H ATOM 8643 H2 WAT 9741 8.639 94.375 133.780 1.00 0.00 H TER 8645 WAT 9741 ATOM 8645 O WAT 9742 34.016 41.752 102.763 1.00 0.00 O ATOM 8646 H1 WAT 9742 34.904 41.407 102.860 1.00 0.00 H ATOM 8647 H2 WAT 9742 33.840 41.700 101.823 1.00 0.00 H TER 8649 WAT 9742 ATOM 8649 O WAT 9743 114.597 82.607 151.347 1.00 0.00 O ATOM 8650 H1 WAT 9743 114.507 83.266 152.035 1.00 0.00 H ATOM 8651 H2 WAT 9743 115.531 82.603 151.139 1.00 0.00 H TER 8653 WAT 9743 ATOM 8653 O WAT 9744 -0.158 62.552 115.549 1.00 0.00 O ATOM 8654 H1 WAT 9744 0.438 61.899 115.915 1.00 0.00 H ATOM 8655 H2 WAT 9744 0.109 62.633 114.633 1.00 0.00 H TER 8657 WAT 9744 ATOM 8657 O WAT 9745 35.336 74.635 132.306 1.00 0.00 O ATOM 8658 H1 WAT 9745 35.143 75.543 132.075 1.00 0.00 H ATOM 8659 H2 WAT 9745 35.226 74.600 133.256 1.00 0.00 H TER 8661 WAT 9745 ATOM 8661 O WAT 9746 94.769 48.923 127.306 1.00 0.00 O ATOM 8662 H1 WAT 9746 95.006 48.044 127.012 1.00 0.00 H ATOM 8663 H2 WAT 9746 93.906 49.080 126.922 1.00 0.00 H TER 8665 WAT 9746 ATOM 8665 O WAT 9747 66.965 94.896 16.356 1.00 0.00 O ATOM 8666 H1 WAT 9747 66.503 95.648 15.986 1.00 0.00 H ATOM 8667 H2 WAT 9747 67.272 94.405 15.594 1.00 0.00 H TER 8669 WAT 9747 ATOM 8669 O WAT 9748 132.236 10.199 122.936 1.00 0.00 O ATOM 8670 H1 WAT 9748 132.405 11.133 123.057 1.00 0.00 H ATOM 8671 H2 WAT 9748 131.887 10.131 122.048 1.00 0.00 H TER 8673 WAT 9748 ATOM 8673 O WAT 9749 109.069 95.307 6.238 1.00 0.00 O ATOM 8674 H1 WAT 9749 108.633 94.730 6.864 1.00 0.00 H ATOM 8675 H2 WAT 9749 108.947 94.879 5.391 1.00 0.00 H TER 8677 WAT 9749 ATOM 8677 O WAT 9750 129.110 69.823 80.387 1.00 0.00 O ATOM 8678 H1 WAT 9750 130.027 70.073 80.499 1.00 0.00 H ATOM 8679 H2 WAT 9750 128.960 69.156 81.057 1.00 0.00 H TER 8681 WAT 9750 ATOM 8681 O WAT 9751 32.946 123.997 103.798 1.00 0.00 O ATOM 8682 H1 WAT 9751 32.390 123.897 104.571 1.00 0.00 H ATOM 8683 H2 WAT 9751 33.151 124.931 103.769 1.00 0.00 H TER 8685 WAT 9751 ATOM 8685 O WAT 9752 97.023 30.382 77.515 1.00 0.00 O ATOM 8686 H1 WAT 9752 97.042 29.546 77.050 1.00 0.00 H ATOM 8687 H2 WAT 9752 97.455 30.202 78.350 1.00 0.00 H TER 8689 WAT 9752 ATOM 8689 O WAT 9753 89.006 110.821 8.106 1.00 0.00 O ATOM 8690 H1 WAT 9753 88.058 110.771 7.980 1.00 0.00 H ATOM 8691 H2 WAT 9753 89.330 111.257 7.318 1.00 0.00 H TER 8693 WAT 9753 ATOM 8693 O WAT 9754 13.924 91.582 96.602 1.00 0.00 O ATOM 8694 H1 WAT 9754 14.680 91.230 97.071 1.00 0.00 H ATOM 8695 H2 WAT 9754 13.207 91.538 97.235 1.00 0.00 H TER 8697 WAT 9754 ATOM 8697 O WAT 9755 81.334 128.005 76.542 1.00 0.00 O ATOM 8698 H1 WAT 9755 81.223 128.706 75.899 1.00 0.00 H ATOM 8699 H2 WAT 9755 80.531 128.031 77.064 1.00 0.00 H TER 8701 WAT 9755 ATOM 8701 O WAT 9756 41.391 89.760 116.608 1.00 0.00 O ATOM 8702 H1 WAT 9756 41.287 89.752 117.559 1.00 0.00 H ATOM 8703 H2 WAT 9756 42.081 90.405 116.448 1.00 0.00 H TER 8705 WAT 9756 ATOM 8705 O WAT 9757 70.825 20.025 123.246 1.00 0.00 O ATOM 8706 H1 WAT 9757 70.872 20.350 124.146 1.00 0.00 H ATOM 8707 H2 WAT 9757 69.917 19.743 123.141 1.00 0.00 H TER 8709 WAT 9757 ATOM 8709 O WAT 9758 82.185 122.819 144.497 1.00 0.00 O ATOM 8710 H1 WAT 9758 82.227 121.896 144.247 1.00 0.00 H ATOM 8711 H2 WAT 9758 82.653 122.863 145.331 1.00 0.00 H TER 8713 WAT 9758 ATOM 8713 O WAT 9759 131.559 28.953 116.167 1.00 0.00 O ATOM 8714 H1 WAT 9759 131.819 28.509 116.974 1.00 0.00 H ATOM 8715 H2 WAT 9759 132.299 29.525 115.959 1.00 0.00 H TER 8717 WAT 9759 ATOM 8717 O WAT 9760 61.701 79.022 74.763 1.00 0.00 O ATOM 8718 H1 WAT 9760 61.124 78.583 74.138 1.00 0.00 H ATOM 8719 H2 WAT 9760 61.796 79.910 74.419 1.00 0.00 H TER 8721 WAT 9760 ATOM 8721 O WAT 9761 127.162 98.833 28.377 1.00 0.00 O ATOM 8722 H1 WAT 9761 126.811 99.283 27.608 1.00 0.00 H ATOM 8723 H2 WAT 9761 127.775 98.190 28.018 1.00 0.00 H TER 8725 WAT 9761 ATOM 8725 O WAT 9762 9.561 60.553 145.153 1.00 0.00 O ATOM 8726 H1 WAT 9762 9.933 61.261 145.679 1.00 0.00 H ATOM 8727 H2 WAT 9762 10.124 59.800 145.333 1.00 0.00 H TER 8729 WAT 9762 ATOM 8729 O WAT 9763 12.505 3.386 19.555 1.00 0.00 O ATOM 8730 H1 WAT 9763 12.440 3.615 20.482 1.00 0.00 H ATOM 8731 H2 WAT 9763 13.307 3.815 19.257 1.00 0.00 H TER 8733 WAT 9763 ATOM 8733 O WAT 9764 143.195 120.026 15.672 1.00 0.00 O ATOM 8734 H1 WAT 9764 143.342 119.081 15.717 1.00 0.00 H ATOM 8735 H2 WAT 9764 142.364 120.161 16.127 1.00 0.00 H TER 8737 WAT 9764 ATOM 8737 O WAT 9765 11.607 29.816 18.810 1.00 0.00 O ATOM 8738 H1 WAT 9765 11.952 30.685 19.014 1.00 0.00 H ATOM 8739 H2 WAT 9765 12.314 29.216 19.049 1.00 0.00 H TER 8741 WAT 9765 ATOM 8741 O WAT 9766 135.442 39.643 3.738 1.00 0.00 O ATOM 8742 H1 WAT 9766 136.367 39.526 3.520 1.00 0.00 H ATOM 8743 H2 WAT 9766 135.081 38.756 3.730 1.00 0.00 H TER 8745 WAT 9766 ATOM 8745 O WAT 9767 19.841 21.283 127.695 1.00 0.00 O ATOM 8746 H1 WAT 9767 20.289 20.925 126.928 1.00 0.00 H ATOM 8747 H2 WAT 9767 19.238 20.591 127.965 1.00 0.00 H TER 8749 WAT 9767 ATOM 8749 O WAT 9768 103.700 123.578 127.833 1.00 0.00 O ATOM 8750 H1 WAT 9768 103.810 123.584 126.882 1.00 0.00 H ATOM 8751 H2 WAT 9768 104.483 123.137 128.162 1.00 0.00 H TER 8753 WAT 9768 ATOM 8753 O WAT 9769 27.621 127.010 64.062 1.00 0.00 O ATOM 8754 H1 WAT 9769 27.696 127.719 64.700 1.00 0.00 H ATOM 8755 H2 WAT 9769 27.057 126.364 64.486 1.00 0.00 H TER 8757 WAT 9769 ATOM 8757 O WAT 9770 17.370 14.425 16.635 1.00 0.00 O ATOM 8758 H1 WAT 9770 17.467 14.979 15.861 1.00 0.00 H ATOM 8759 H2 WAT 9770 18.199 14.522 17.104 1.00 0.00 H TER 8761 WAT 9770 ATOM 8761 O WAT 9771 83.883 93.096 16.726 1.00 0.00 O ATOM 8762 H1 WAT 9771 84.547 93.776 16.609 1.00 0.00 H ATOM 8763 H2 WAT 9771 83.555 92.927 15.843 1.00 0.00 H TER 8765 WAT 9771 ATOM 8765 O WAT 9772 65.145 5.318 74.665 1.00 0.00 O ATOM 8766 H1 WAT 9772 64.790 4.434 74.758 1.00 0.00 H ATOM 8767 H2 WAT 9772 65.460 5.355 73.762 1.00 0.00 H TER 8769 WAT 9772 ATOM 8769 O WAT 9773 129.363 105.820 140.304 1.00 0.00 O ATOM 8770 H1 WAT 9773 128.485 106.158 140.126 1.00 0.00 H ATOM 8771 H2 WAT 9773 129.234 105.173 140.997 1.00 0.00 H TER 8773 WAT 9773 ATOM 8773 O WAT 9774 17.756 83.352 82.118 1.00 0.00 O ATOM 8774 H1 WAT 9774 16.824 83.132 82.138 1.00 0.00 H ATOM 8775 H2 WAT 9774 17.841 83.963 81.386 1.00 0.00 H TER 8777 WAT 9774 ATOM 8777 O WAT 9775 45.730 94.017 10.552 1.00 0.00 O ATOM 8778 H1 WAT 9775 46.049 93.241 10.092 1.00 0.00 H ATOM 8779 H2 WAT 9775 44.797 94.053 10.342 1.00 0.00 H TER 8781 WAT 9775 ATOM 8781 O WAT 9776 96.439 37.635 91.167 1.00 0.00 O ATOM 8782 H1 WAT 9776 96.454 38.524 91.523 1.00 0.00 H ATOM 8783 H2 WAT 9776 95.570 37.549 90.775 1.00 0.00 H TER 8785 WAT 9776 ATOM 8785 O WAT 9777 0.270 13.607 17.519 1.00 0.00 O ATOM 8786 H1 WAT 9777 0.878 14.101 16.970 1.00 0.00 H ATOM 8787 H2 WAT 9777 0.057 12.830 17.002 1.00 0.00 H TER 8789 WAT 9777 ATOM 8789 O WAT 9778 93.727 111.731 76.275 1.00 0.00 O ATOM 8790 H1 WAT 9778 93.696 111.706 77.232 1.00 0.00 H ATOM 8791 H2 WAT 9778 93.659 112.661 76.058 1.00 0.00 H TER 8793 WAT 9778 ATOM 8793 O WAT 9779 79.786 16.383 122.037 1.00 0.00 O ATOM 8794 H1 WAT 9779 80.161 15.754 121.421 1.00 0.00 H ATOM 8795 H2 WAT 9779 78.980 15.968 122.343 1.00 0.00 H TER 8797 WAT 9779 ATOM 8797 O WAT 9780 89.413 5.759 76.899 1.00 0.00 O ATOM 8798 H1 WAT 9780 89.648 6.081 76.029 1.00 0.00 H ATOM 8799 H2 WAT 9780 89.051 4.887 76.742 1.00 0.00 H TER 8801 WAT 9780 ATOM 8801 O WAT 9781 126.381 5.358 60.363 1.00 0.00 O ATOM 8802 H1 WAT 9781 127.132 5.226 59.785 1.00 0.00 H ATOM 8803 H2 WAT 9781 125.833 4.585 60.224 1.00 0.00 H TER 8805 WAT 9781 ATOM 8805 O WAT 9782 11.707 115.829 88.403 1.00 0.00 O ATOM 8806 H1 WAT 9782 11.726 115.221 87.664 1.00 0.00 H ATOM 8807 H2 WAT 9782 11.411 116.657 88.024 1.00 0.00 H TER 8809 WAT 9782 ATOM 8809 O WAT 9783 134.494 119.924 146.322 1.00 0.00 O ATOM 8810 H1 WAT 9783 134.863 120.139 145.465 1.00 0.00 H ATOM 8811 H2 WAT 9783 134.479 118.967 146.344 1.00 0.00 H TER 8813 WAT 9783 ATOM 8813 O WAT 9784 0.054 128.569 11.700 1.00 0.00 O ATOM 8814 H1 WAT 9784 0.996 128.631 11.861 1.00 0.00 H ATOM 8815 H2 WAT 9784 -0.178 127.682 11.974 1.00 0.00 H TER 8817 WAT 9784 ATOM 8817 O WAT 9785 9.940 106.743 8.255 1.00 0.00 O ATOM 8818 H1 WAT 9785 9.452 106.369 7.521 1.00 0.00 H ATOM 8819 H2 WAT 9785 10.461 106.015 8.593 1.00 0.00 H TER 8821 WAT 9785 ATOM 8821 O WAT 9786 110.427 70.335 110.085 1.00 0.00 O ATOM 8822 H1 WAT 9786 111.371 70.407 109.943 1.00 0.00 H ATOM 8823 H2 WAT 9786 110.173 71.185 110.445 1.00 0.00 H TER 8825 WAT 9786 ATOM 8825 O WAT 9787 111.758 29.600 126.116 1.00 0.00 O ATOM 8826 H1 WAT 9787 111.187 29.902 125.409 1.00 0.00 H ATOM 8827 H2 WAT 9787 112.194 28.827 125.758 1.00 0.00 H TER 8829 WAT 9787 ATOM 8829 O WAT 9788 56.065 12.752 115.092 1.00 0.00 O ATOM 8830 H1 WAT 9788 55.322 12.213 115.364 1.00 0.00 H ATOM 8831 H2 WAT 9788 56.695 12.128 114.732 1.00 0.00 H TER 8833 WAT 9788 ATOM 8833 O WAT 9789 90.356 6.703 74.501 1.00 0.00 O ATOM 8834 H1 WAT 9789 90.561 7.460 75.049 1.00 0.00 H ATOM 8835 H2 WAT 9789 91.210 6.344 74.261 1.00 0.00 H TER 8837 WAT 9789 ATOM 8837 O WAT 9790 46.542 95.759 109.346 1.00 0.00 O ATOM 8838 H1 WAT 9790 45.729 96.252 109.454 1.00 0.00 H ATOM 8839 H2 WAT 9790 47.089 96.036 110.081 1.00 0.00 H TER 8841 WAT 9790 ATOM 8841 O WAT 9791 9.654 38.218 93.073 1.00 0.00 O ATOM 8842 H1 WAT 9791 10.457 38.177 92.554 1.00 0.00 H ATOM 8843 H2 WAT 9791 8.962 37.953 92.467 1.00 0.00 H TER 8845 WAT 9791 ATOM 8845 O WAT 9792 118.752 55.628 105.740 1.00 0.00 O ATOM 8846 H1 WAT 9792 118.769 55.995 106.624 1.00 0.00 H ATOM 8847 H2 WAT 9792 119.581 55.907 105.350 1.00 0.00 H TER 8849 WAT 9792 ATOM 8849 O WAT 9793 23.527 44.548 95.386 1.00 0.00 O ATOM 8850 H1 WAT 9793 23.685 45.066 94.597 1.00 0.00 H ATOM 8851 H2 WAT 9793 22.644 44.197 95.269 1.00 0.00 H TER 8853 WAT 9793 ATOM 8853 O WAT 9794 140.689 58.043 69.063 1.00 0.00 O ATOM 8854 H1 WAT 9794 141.021 58.215 68.182 1.00 0.00 H ATOM 8855 H2 WAT 9794 141.205 57.298 69.372 1.00 0.00 H TER 8857 WAT 9794 ATOM 8857 O WAT 9795 17.799 50.880 147.465 1.00 0.00 O ATOM 8858 H1 WAT 9795 17.266 51.658 147.627 1.00 0.00 H ATOM 8859 H2 WAT 9795 17.429 50.498 146.669 1.00 0.00 H TER 8861 WAT 9795 ATOM 8861 O WAT 9796 128.482 98.041 139.983 1.00 0.00 O ATOM 8862 H1 WAT 9796 127.891 98.467 140.604 1.00 0.00 H ATOM 8863 H2 WAT 9796 128.970 97.410 140.511 1.00 0.00 H TER 8865 WAT 9796 ATOM 8865 O WAT 9797 90.554 95.817 70.748 1.00 0.00 O ATOM 8866 H1 WAT 9797 89.668 96.134 70.573 1.00 0.00 H ATOM 8867 H2 WAT 9797 91.084 96.611 70.811 1.00 0.00 H TER 8869 WAT 9797 ATOM 8869 O WAT 9798 72.412 9.548 111.205 1.00 0.00 O ATOM 8870 H1 WAT 9798 72.458 10.362 110.703 1.00 0.00 H ATOM 8871 H2 WAT 9798 73.048 8.971 110.783 1.00 0.00 H TER 8873 WAT 9798 ATOM 8873 O WAT 9799 42.724 61.885 125.845 1.00 0.00 O ATOM 8874 H1 WAT 9799 42.379 62.528 125.226 1.00 0.00 H ATOM 8875 H2 WAT 9799 43.644 61.786 125.602 1.00 0.00 H TER 8877 WAT 9799 ATOM 8877 O WAT 9800 26.887 20.416 151.559 1.00 0.00 O ATOM 8878 H1 WAT 9800 27.570 20.005 151.029 1.00 0.00 H ATOM 8879 H2 WAT 9800 27.356 21.049 152.103 1.00 0.00 H TER 8881 WAT 9800 ATOM 8881 O WAT 9801 70.596 115.621 80.644 1.00 0.00 O ATOM 8882 H1 WAT 9801 70.247 115.334 79.799 1.00 0.00 H ATOM 8883 H2 WAT 9801 71.545 115.545 80.549 1.00 0.00 H TER 8885 WAT 9801 ATOM 8885 O WAT 9802 23.012 14.781 127.256 1.00 0.00 O ATOM 8886 H1 WAT 9802 22.126 15.039 127.005 1.00 0.00 H ATOM 8887 H2 WAT 9802 22.886 14.143 127.958 1.00 0.00 H TER 8889 WAT 9802 ATOM 8889 O WAT 9803 109.942 119.508 73.793 1.00 0.00 O ATOM 8890 H1 WAT 9803 109.223 119.453 74.423 1.00 0.00 H ATOM 8891 H2 WAT 9803 109.912 118.674 73.324 1.00 0.00 H TER 8893 WAT 9803 ATOM 8893 O WAT 9804 46.606 140.789 23.266 1.00 0.00 O ATOM 8894 H1 WAT 9804 46.305 140.180 22.591 1.00 0.00 H ATOM 8895 H2 WAT 9804 45.916 140.771 23.929 1.00 0.00 H TER 8897 WAT 9804 ATOM 8897 O WAT 9805 90.508 38.793 103.695 1.00 0.00 O ATOM 8898 H1 WAT 9805 90.815 37.998 103.257 1.00 0.00 H ATOM 8899 H2 WAT 9805 90.029 38.475 104.460 1.00 0.00 H TER 8901 WAT 9805 ATOM 8901 O WAT 9806 129.144 142.772 80.672 1.00 0.00 O ATOM 8902 H1 WAT 9806 129.255 143.300 79.881 1.00 0.00 H ATOM 8903 H2 WAT 9806 129.718 142.018 80.539 1.00 0.00 H TER 8905 WAT 9806 ATOM 8905 O WAT 9807 89.428 96.864 120.498 1.00 0.00 O ATOM 8906 H1 WAT 9807 88.832 97.474 120.064 1.00 0.00 H ATOM 8907 H2 WAT 9807 89.033 96.711 121.356 1.00 0.00 H TER 8909 WAT 9807 ATOM 8909 O WAT 9808 111.557 10.686 100.268 1.00 0.00 O ATOM 8910 H1 WAT 9808 111.360 10.551 99.341 1.00 0.00 H ATOM 8911 H2 WAT 9808 111.942 11.562 100.305 1.00 0.00 H TER 8913 WAT 9808 ATOM 8913 O WAT 9809 82.520 120.436 135.585 1.00 0.00 O ATOM 8914 H1 WAT 9809 81.762 120.083 135.120 1.00 0.00 H ATOM 8915 H2 WAT 9809 82.940 119.670 135.975 1.00 0.00 H TER 8917 WAT 9809 ATOM 8917 O WAT 9810 93.625 89.327 135.959 1.00 0.00 O ATOM 8918 H1 WAT 9810 93.184 89.854 135.293 1.00 0.00 H ATOM 8919 H2 WAT 9810 94.089 88.652 135.463 1.00 0.00 H TER 8921 WAT 9810 ATOM 8921 O WAT 9811 15.708 103.821 20.856 1.00 0.00 O ATOM 8922 H1 WAT 9811 15.345 104.501 21.423 1.00 0.00 H ATOM 8923 H2 WAT 9811 15.148 103.060 21.004 1.00 0.00 H TER 8925 WAT 9811 ATOM 8925 O WAT 9812 122.405 81.687 64.440 1.00 0.00 O ATOM 8926 H1 WAT 9812 122.631 81.990 65.320 1.00 0.00 H ATOM 8927 H2 WAT 9812 121.465 81.855 64.364 1.00 0.00 H TER 8929 WAT 9812 ATOM 8929 O WAT 9813 66.852 45.014 108.803 1.00 0.00 O ATOM 8930 H1 WAT 9813 67.052 45.230 107.892 1.00 0.00 H ATOM 8931 H2 WAT 9813 66.568 44.100 108.775 1.00 0.00 H TER 8933 WAT 9813 ATOM 8933 O WAT 9814 115.460 14.496 146.171 1.00 0.00 O ATOM 8934 H1 WAT 9814 116.339 14.857 146.289 1.00 0.00 H ATOM 8935 H2 WAT 9814 115.352 14.433 145.222 1.00 0.00 H TER 8937 WAT 9814 ATOM 8937 O WAT 9815 90.619 59.053 125.493 1.00 0.00 O ATOM 8938 H1 WAT 9815 90.728 58.121 125.299 1.00 0.00 H ATOM 8939 H2 WAT 9815 91.023 59.500 124.749 1.00 0.00 H TER 8941 WAT 9815 ATOM 8941 O WAT 9816 94.326 145.544 157.540 1.00 0.00 O ATOM 8942 H1 WAT 9816 94.211 145.683 156.600 1.00 0.00 H ATOM 8943 H2 WAT 9816 93.488 145.799 157.924 1.00 0.00 H TER 8945 WAT 9816 ATOM 8945 O WAT 9817 3.519 21.867 10.123 1.00 0.00 O ATOM 8946 H1 WAT 9817 3.666 21.760 9.183 1.00 0.00 H ATOM 8947 H2 WAT 9817 2.607 21.607 10.254 1.00 0.00 H TER 8949 WAT 9817 ATOM 8949 O WAT 9818 59.466 98.774 67.563 1.00 0.00 O ATOM 8950 H1 WAT 9818 58.554 98.779 67.857 1.00 0.00 H ATOM 8951 H2 WAT 9818 59.919 98.218 68.198 1.00 0.00 H TER 8953 WAT 9818 ATOM 8953 O WAT 9819 91.793 45.751 12.504 1.00 0.00 O ATOM 8954 H1 WAT 9819 92.592 46.143 12.151 1.00 0.00 H ATOM 8955 H2 WAT 9819 91.970 44.811 12.510 1.00 0.00 H TER 8957 WAT 9819 ATOM 8957 O WAT 9820 138.625 3.884 71.412 1.00 0.00 O ATOM 8958 H1 WAT 9820 138.147 4.712 71.468 1.00 0.00 H ATOM 8959 H2 WAT 9820 138.815 3.780 70.480 1.00 0.00 H TER 8961 WAT 9820 ATOM 8961 O WAT 9821 23.417 117.041 106.621 1.00 0.00 O ATOM 8962 H1 WAT 9821 23.013 117.406 105.834 1.00 0.00 H ATOM 8963 H2 WAT 9821 24.018 117.724 106.920 1.00 0.00 H TER 8965 WAT 9821 ATOM 8965 O WAT 9822 138.149 91.243 88.590 1.00 0.00 O ATOM 8966 H1 WAT 9822 137.917 90.513 89.165 1.00 0.00 H ATOM 8967 H2 WAT 9822 137.483 91.908 88.766 1.00 0.00 H TER 8969 WAT 9822 ATOM 8969 O WAT 9823 111.602 10.061 97.358 1.00 0.00 O ATOM 8970 H1 WAT 9823 111.704 9.127 97.176 1.00 0.00 H ATOM 8971 H2 WAT 9823 111.000 10.372 96.681 1.00 0.00 H TER 8973 WAT 9823 ATOM 8973 O WAT 9824 50.599 139.093 94.873 1.00 0.00 O ATOM 8974 H1 WAT 9824 50.628 138.140 94.958 1.00 0.00 H ATOM 8975 H2 WAT 9824 51.518 139.361 94.863 1.00 0.00 H TER 8977 WAT 9824 ATOM 8977 O WAT 9825 96.216 145.504 15.690 1.00 0.00 O ATOM 8978 H1 WAT 9825 96.526 145.476 16.595 1.00 0.00 H ATOM 8979 H2 WAT 9825 96.854 146.054 15.235 1.00 0.00 H TER 8981 WAT 9825 ATOM 8981 O WAT 9826 48.948 15.802 116.782 1.00 0.00 O ATOM 8982 H1 WAT 9826 48.555 15.253 116.103 1.00 0.00 H ATOM 8983 H2 WAT 9826 49.318 15.179 117.409 1.00 0.00 H TER 8985 WAT 9826 ATOM 8985 O WAT 9827 31.651 99.059 126.571 1.00 0.00 O ATOM 8986 H1 WAT 9827 30.870 99.043 126.018 1.00 0.00 H ATOM 8987 H2 WAT 9827 32.053 99.910 126.394 1.00 0.00 H TER 8989 WAT 9827 ATOM 8989 O WAT 9828 87.542 74.374 97.018 1.00 0.00 O ATOM 8990 H1 WAT 9828 87.295 74.314 97.941 1.00 0.00 H ATOM 8991 H2 WAT 9828 86.770 74.065 96.543 1.00 0.00 H TER 8993 WAT 9828 ATOM 8993 O WAT 9829 35.337 132.767 131.994 1.00 0.00 O ATOM 8994 H1 WAT 9829 35.863 133.129 131.281 1.00 0.00 H ATOM 8995 H2 WAT 9829 34.563 132.406 131.562 1.00 0.00 H TER 8997 WAT 9829 ATOM 8997 O WAT 9830 42.925 66.633 75.296 1.00 0.00 O ATOM 8998 H1 WAT 9830 42.343 66.501 76.044 1.00 0.00 H ATOM 8999 H2 WAT 9830 43.419 65.816 75.231 1.00 0.00 H TER 9001 WAT 9830 ATOM 9001 O WAT 9831 25.268 92.095 153.881 1.00 0.00 O ATOM 9002 H1 WAT 9831 25.017 92.760 153.239 1.00 0.00 H ATOM 9003 H2 WAT 9831 24.570 92.119 154.536 1.00 0.00 H TER 9005 WAT 9831 ATOM 9005 O WAT 9832 23.572 98.501 154.013 1.00 0.00 O ATOM 9006 H1 WAT 9832 22.925 98.077 154.577 1.00 0.00 H ATOM 9007 H2 WAT 9832 23.588 99.411 154.309 1.00 0.00 H TER 9009 WAT 9832 ATOM 9009 O WAT 9833 100.338 87.522 16.900 1.00 0.00 O ATOM 9010 H1 WAT 9833 100.522 86.613 16.665 1.00 0.00 H ATOM 9011 H2 WAT 9833 101.144 87.831 17.312 1.00 0.00 H TER 9013 WAT 9833 ATOM 9013 O WAT 9834 122.851 81.178 142.220 1.00 0.00 O ATOM 9014 H1 WAT 9834 123.174 80.626 141.508 1.00 0.00 H ATOM 9015 H2 WAT 9834 121.902 81.200 142.095 1.00 0.00 H TER 9017 WAT 9834 ATOM 9017 O WAT 9835 1.411 108.894 72.175 1.00 0.00 O ATOM 9018 H1 WAT 9835 2.001 109.209 71.491 1.00 0.00 H ATOM 9019 H2 WAT 9835 1.390 109.603 72.818 1.00 0.00 H TER 9021 WAT 9835 ATOM 9021 O WAT 9836 97.163 3.165 109.674 1.00 0.00 O ATOM 9022 H1 WAT 9836 96.206 3.202 109.688 1.00 0.00 H ATOM 9023 H2 WAT 9836 97.364 2.239 109.535 1.00 0.00 H TER 9025 WAT 9836 ATOM 9025 O WAT 9837 40.728 36.172 80.237 1.00 0.00 O ATOM 9026 H1 WAT 9837 41.133 35.956 79.397 1.00 0.00 H ATOM 9027 H2 WAT 9837 40.919 35.419 80.796 1.00 0.00 H TER 9029 WAT 9837 ATOM 9029 O WAT 9838 78.734 47.681 115.102 1.00 0.00 O ATOM 9030 H1 WAT 9838 78.731 48.237 114.323 1.00 0.00 H ATOM 9031 H2 WAT 9838 79.655 47.628 115.356 1.00 0.00 H TER 9033 WAT 9838 ATOM 9033 O WAT 9839 47.679 135.374 69.675 1.00 0.00 O ATOM 9034 H1 WAT 9839 46.803 135.740 69.799 1.00 0.00 H ATOM 9035 H2 WAT 9839 47.608 134.472 69.989 1.00 0.00 H TER 9037 WAT 9839 ATOM 9037 O WAT 9840 113.697 104.678 147.997 1.00 0.00 O ATOM 9038 H1 WAT 9840 113.180 104.225 148.662 1.00 0.00 H ATOM 9039 H2 WAT 9840 114.434 104.092 147.826 1.00 0.00 H TER 9041 WAT 9840 ATOM 9041 O WAT 9841 76.884 79.325 2.628 1.00 0.00 O ATOM 9042 H1 WAT 9841 77.455 79.910 2.131 1.00 0.00 H ATOM 9043 H2 WAT 9841 77.226 78.448 2.451 1.00 0.00 H TER 9045 WAT 9841 ATOM 9045 O WAT 9842 115.528 110.441 130.667 1.00 0.00 O ATOM 9046 H1 WAT 9842 115.890 110.922 129.923 1.00 0.00 H ATOM 9047 H2 WAT 9842 116.253 109.896 130.974 1.00 0.00 H TER 9049 WAT 9842 ATOM 9049 O WAT 9843 134.216 126.669 13.279 1.00 0.00 O ATOM 9050 H1 WAT 9843 133.674 127.308 12.816 1.00 0.00 H ATOM 9051 H2 WAT 9843 133.795 126.571 14.132 1.00 0.00 H TER 9053 WAT 9843 ATOM 9053 O WAT 9844 8.553 105.124 156.272 1.00 0.00 O ATOM 9054 H1 WAT 9844 8.267 105.988 155.975 1.00 0.00 H ATOM 9055 H2 WAT 9844 9.382 104.977 155.816 1.00 0.00 H TER 9057 WAT 9844 ATOM 9057 O WAT 9845 44.617 80.014 62.997 1.00 0.00 O ATOM 9058 H1 WAT 9845 45.382 79.657 62.546 1.00 0.00 H ATOM 9059 H2 WAT 9845 43.887 79.839 62.403 1.00 0.00 H TER 9061 WAT 9845 ATOM 9061 O WAT 9846 117.485 44.020 15.817 1.00 0.00 O ATOM 9062 H1 WAT 9846 118.139 43.362 15.581 1.00 0.00 H ATOM 9063 H2 WAT 9846 117.017 43.637 16.559 1.00 0.00 H TER 9065 WAT 9846 ATOM 9065 O WAT 9847 129.536 82.262 131.009 1.00 0.00 O ATOM 9066 H1 WAT 9847 129.542 83.187 131.254 1.00 0.00 H ATOM 9067 H2 WAT 9847 130.169 81.853 131.600 1.00 0.00 H TER 9069 WAT 9847 ATOM 9069 O WAT 9848 120.423 67.331 10.803 1.00 0.00 O ATOM 9070 H1 WAT 9848 120.589 66.409 10.997 1.00 0.00 H ATOM 9071 H2 WAT 9848 119.983 67.665 11.584 1.00 0.00 H TER 9073 WAT 9848 ATOM 9073 O WAT 9849 99.219 52.198 105.515 1.00 0.00 O ATOM 9074 H1 WAT 9849 98.453 51.628 105.583 1.00 0.00 H ATOM 9075 H2 WAT 9849 99.743 51.989 106.288 1.00 0.00 H TER 9077 WAT 9849 ATOM 9077 O WAT 9850 88.111 87.257 148.812 1.00 0.00 O ATOM 9078 H1 WAT 9850 87.577 86.719 148.228 1.00 0.00 H ATOM 9079 H2 WAT 9850 88.524 87.900 148.234 1.00 0.00 H TER 9081 WAT 9850 ATOM 9081 O WAT 9851 137.568 65.888 62.284 1.00 0.00 O ATOM 9082 H1 WAT 9851 137.766 65.812 63.218 1.00 0.00 H ATOM 9083 H2 WAT 9851 136.839 66.508 62.243 1.00 0.00 H TER 9085 WAT 9851 ATOM 9085 O WAT 9852 76.917 40.336 59.452 1.00 0.00 O ATOM 9086 H1 WAT 9852 77.145 39.967 58.599 1.00 0.00 H ATOM 9087 H2 WAT 9852 76.318 41.054 59.251 1.00 0.00 H TER 9089 WAT 9852 ATOM 9089 O WAT 9853 78.804 133.985 100.664 1.00 0.00 O ATOM 9090 H1 WAT 9853 79.047 133.615 101.513 1.00 0.00 H ATOM 9091 H2 WAT 9853 78.110 133.411 100.342 1.00 0.00 H TER 9093 WAT 9853 ATOM 9093 O WAT 9854 80.804 77.452 120.017 1.00 0.00 O ATOM 9094 H1 WAT 9854 80.922 76.961 119.204 1.00 0.00 H ATOM 9095 H2 WAT 9854 81.317 78.250 119.892 1.00 0.00 H TER 9097 WAT 9854 ATOM 9097 O WAT 9855 100.485 23.213 62.300 1.00 0.00 O ATOM 9098 H1 WAT 9855 100.996 22.710 61.665 1.00 0.00 H ATOM 9099 H2 WAT 9855 99.576 23.094 62.023 1.00 0.00 H TER 9101 WAT 9855 ATOM 9101 O WAT 9856 13.001 90.261 68.375 1.00 0.00 O ATOM 9102 H1 WAT 9856 12.124 90.630 68.480 1.00 0.00 H ATOM 9103 H2 WAT 9856 13.275 90.539 67.501 1.00 0.00 H TER 9105 WAT 9856 ATOM 9105 O WAT 9857 40.615 135.831 69.505 1.00 0.00 O ATOM 9106 H1 WAT 9857 39.783 135.745 69.040 1.00 0.00 H ATOM 9107 H2 WAT 9857 40.657 135.057 70.067 1.00 0.00 H TER 9109 WAT 9857 ATOM 9109 O WAT 9858 43.606 14.575 3.718 1.00 0.00 O ATOM 9110 H1 WAT 9858 43.560 15.531 3.704 1.00 0.00 H ATOM 9111 H2 WAT 9858 44.298 14.378 4.349 1.00 0.00 H TER 9113 WAT 9858 ATOM 9113 O WAT 9859 62.454 144.580 60.924 1.00 0.00 O ATOM 9114 H1 WAT 9859 61.762 143.919 60.924 1.00 0.00 H ATOM 9115 H2 WAT 9859 62.026 145.376 61.240 1.00 0.00 H TER 9117 WAT 9859 ATOM 9117 O WAT 9860 75.276 48.573 63.307 1.00 0.00 O ATOM 9118 H1 WAT 9860 75.286 49.200 64.030 1.00 0.00 H ATOM 9119 H2 WAT 9860 76.200 48.405 63.123 1.00 0.00 H TER 9121 WAT 9860 ATOM 9121 O WAT 9861 27.112 124.187 77.191 1.00 0.00 O ATOM 9122 H1 WAT 9861 26.363 123.690 76.863 1.00 0.00 H ATOM 9123 H2 WAT 9861 26.795 125.089 77.248 1.00 0.00 H TER 9125 WAT 9861 ATOM 9125 O WAT 9862 83.840 128.337 78.868 1.00 0.00 O ATOM 9126 H1 WAT 9862 84.463 128.991 78.553 1.00 0.00 H ATOM 9127 H2 WAT 9862 83.715 127.748 78.124 1.00 0.00 H TER 9129 WAT 9862 ATOM 9129 O WAT 9863 121.861 140.537 79.187 1.00 0.00 O ATOM 9130 H1 WAT 9863 121.863 141.178 79.899 1.00 0.00 H ATOM 9131 H2 WAT 9863 122.286 139.765 79.559 1.00 0.00 H TER 9133 WAT 9863 ATOM 9133 O WAT 9864 57.044 135.152 70.317 1.00 0.00 O ATOM 9134 H1 WAT 9864 56.288 134.821 69.833 1.00 0.00 H ATOM 9135 H2 WAT 9864 57.558 135.626 69.663 1.00 0.00 H TER 9137 WAT 9864 ATOM 9137 O WAT 9865 103.739 99.836 144.712 1.00 0.00 O ATOM 9138 H1 WAT 9865 104.556 100.314 144.849 1.00 0.00 H ATOM 9139 H2 WAT 9865 103.454 100.095 143.835 1.00 0.00 H TER 9141 WAT 9865 ATOM 9141 O WAT 9866 26.770 38.018 156.882 1.00 0.00 O ATOM 9142 H1 WAT 9866 26.165 37.277 156.833 1.00 0.00 H ATOM 9143 H2 WAT 9866 26.810 38.354 155.987 1.00 0.00 H TER 9145 WAT 9866 ATOM 9145 O WAT 9867 105.435 83.808 67.639 1.00 0.00 O ATOM 9146 H1 WAT 9867 105.695 84.452 66.981 1.00 0.00 H ATOM 9147 H2 WAT 9867 105.898 84.075 68.433 1.00 0.00 H TER 9149 WAT 9867 ATOM 9149 O WAT 9868 116.078 65.724 158.425 1.00 0.00 O ATOM 9150 H1 WAT 9868 115.670 65.671 159.289 1.00 0.00 H ATOM 9151 H2 WAT 9868 115.521 65.182 157.865 1.00 0.00 H TER 9153 WAT 9868 ATOM 9153 O WAT 9869 119.188 12.233 140.650 1.00 0.00 O ATOM 9154 H1 WAT 9869 119.703 12.154 139.848 1.00 0.00 H ATOM 9155 H2 WAT 9869 119.225 13.165 140.868 1.00 0.00 H TER 9157 WAT 9869 ATOM 9157 O WAT 9870 99.827 129.470 150.256 1.00 0.00 O ATOM 9158 H1 WAT 9870 99.212 128.857 149.854 1.00 0.00 H ATOM 9159 H2 WAT 9870 99.282 130.199 150.552 1.00 0.00 H TER 9161 WAT 9870 ATOM 9161 O WAT 9871 18.044 144.668 139.890 1.00 0.00 O ATOM 9162 H1 WAT 9871 18.443 145.472 140.222 1.00 0.00 H ATOM 9163 H2 WAT 9871 17.112 144.766 140.083 1.00 0.00 H TER 9165 WAT 9871 ATOM 9165 O WAT 9872 58.370 40.824 139.086 1.00 0.00 O ATOM 9166 H1 WAT 9872 57.460 40.674 138.828 1.00 0.00 H ATOM 9167 H2 WAT 9872 58.670 39.975 139.410 1.00 0.00 H TER 9169 WAT 9872 ATOM 9169 O WAT 9873 85.546 76.057 55.881 1.00 0.00 O ATOM 9170 H1 WAT 9873 86.494 76.186 55.890 1.00 0.00 H ATOM 9171 H2 WAT 9873 85.183 76.943 55.874 1.00 0.00 H TER 9173 WAT 9873 ATOM 9173 O WAT 9874 -0.222 11.587 132.539 1.00 0.00 O ATOM 9174 H1 WAT 9874 0.497 11.158 133.001 1.00 0.00 H ATOM 9175 H2 WAT 9874 -0.010 11.479 131.612 1.00 0.00 H TER 9177 WAT 9874 ATOM 9177 O WAT 9875 76.413 52.763 84.521 1.00 0.00 O ATOM 9178 H1 WAT 9875 76.398 52.745 83.564 1.00 0.00 H ATOM 9179 H2 WAT 9875 75.510 52.578 84.779 1.00 0.00 H TER 9181 WAT 9875 ATOM 9181 O WAT 9876 80.048 45.710 8.230 1.00 0.00 O ATOM 9182 H1 WAT 9876 79.709 44.972 8.737 1.00 0.00 H ATOM 9183 H2 WAT 9876 79.477 46.442 8.462 1.00 0.00 H TER 9185 WAT 9876 ATOM 9185 O WAT 9877 128.880 57.798 14.907 1.00 0.00 O ATOM 9186 H1 WAT 9877 129.624 57.206 15.013 1.00 0.00 H ATOM 9187 H2 WAT 9877 129.138 58.594 15.372 1.00 0.00 H TER 9189 WAT 9877 ATOM 9189 O WAT 9878 128.968 91.582 140.535 1.00 0.00 O ATOM 9190 H1 WAT 9878 129.128 90.674 140.793 1.00 0.00 H ATOM 9191 H2 WAT 9878 128.200 91.538 139.966 1.00 0.00 H TER 9193 WAT 9878 ATOM 9193 O WAT 9879 140.726 78.418 79.755 1.00 0.00 O ATOM 9194 H1 WAT 9879 141.504 78.421 80.314 1.00 0.00 H ATOM 9195 H2 WAT 9879 140.911 79.075 79.084 1.00 0.00 H TER 9197 WAT 9879 ATOM 9197 O WAT 9880 27.480 38.235 103.451 1.00 0.00 O ATOM 9198 H1 WAT 9880 27.661 37.470 102.904 1.00 0.00 H ATOM 9199 H2 WAT 9880 27.108 38.878 102.847 1.00 0.00 H TER 9201 WAT 9880 ATOM 9201 O WAT 9881 81.611 0.124 78.417 1.00 0.00 O ATOM 9202 H1 WAT 9881 82.403 0.139 77.880 1.00 0.00 H ATOM 9203 H2 WAT 9881 80.897 0.022 77.788 1.00 0.00 H TER 9205 WAT 9881 ATOM 9205 O WAT 9882 125.870 46.149 84.496 1.00 0.00 O ATOM 9206 H1 WAT 9882 126.207 45.428 85.027 1.00 0.00 H ATOM 9207 H2 WAT 9882 126.650 46.636 84.230 1.00 0.00 H TER 9209 WAT 9882 ATOM 9209 O WAT 9883 74.887 15.712 134.428 1.00 0.00 O ATOM 9210 H1 WAT 9883 74.146 15.109 134.483 1.00 0.00 H ATOM 9211 H2 WAT 9883 74.533 16.554 134.712 1.00 0.00 H TER 9213 WAT 9883 ATOM 9213 O WAT 9884 88.064 54.102 79.418 1.00 0.00 O ATOM 9214 H1 WAT 9884 88.165 55.028 79.641 1.00 0.00 H ATOM 9215 H2 WAT 9884 87.312 54.080 78.826 1.00 0.00 H TER 9217 WAT 9884 ATOM 9217 O WAT 9885 55.368 128.693 15.523 1.00 0.00 O ATOM 9218 H1 WAT 9885 54.810 127.924 15.411 1.00 0.00 H ATOM 9219 H2 WAT 9885 55.323 128.889 16.458 1.00 0.00 H TER 9221 WAT 9885 ATOM 9221 O WAT 9886 19.243 19.728 17.017 1.00 0.00 O ATOM 9222 H1 WAT 9886 19.027 18.903 17.452 1.00 0.00 H ATOM 9223 H2 WAT 9886 18.771 20.393 17.519 1.00 0.00 H TER 9225 WAT 9886 ATOM 9225 O WAT 9887 31.190 92.376 62.808 1.00 0.00 O ATOM 9226 H1 WAT 9887 31.022 91.610 63.356 1.00 0.00 H ATOM 9227 H2 WAT 9887 31.856 92.871 63.286 1.00 0.00 H TER 9229 WAT 9887 ATOM 9229 O WAT 9888 124.359 35.058 71.558 1.00 0.00 O ATOM 9230 H1 WAT 9888 124.128 34.381 72.194 1.00 0.00 H ATOM 9231 H2 WAT 9888 125.048 35.565 71.987 1.00 0.00 H TER 9233 WAT 9888 ATOM 9233 O WAT 9889 104.977 42.973 78.030 1.00 0.00 O ATOM 9234 H1 WAT 9889 104.260 42.739 78.619 1.00 0.00 H ATOM 9235 H2 WAT 9889 105.637 42.295 78.174 1.00 0.00 H TER 9237 WAT 9889 ATOM 9237 O WAT 9890 20.100 105.564 15.510 1.00 0.00 O ATOM 9238 H1 WAT 9890 20.889 105.101 15.789 1.00 0.00 H ATOM 9239 H2 WAT 9890 19.379 105.049 15.873 1.00 0.00 H TER 9241 WAT 9890 ATOM 9241 O WAT 9891 43.190 2.812 104.899 1.00 0.00 O ATOM 9242 H1 WAT 9891 43.665 2.536 104.115 1.00 0.00 H ATOM 9243 H2 WAT 9891 43.234 2.056 105.484 1.00 0.00 H TER 9245 WAT 9891 ATOM 9245 O WAT 9892 103.900 7.401 93.416 1.00 0.00 O ATOM 9246 H1 WAT 9892 103.775 6.736 92.739 1.00 0.00 H ATOM 9247 H2 WAT 9892 104.810 7.679 93.313 1.00 0.00 H TER 9249 WAT 9892 ATOM 9249 O WAT 9893 59.720 125.818 157.688 1.00 0.00 O ATOM 9250 H1 WAT 9893 59.034 126.305 157.232 1.00 0.00 H ATOM 9251 H2 WAT 9893 59.673 124.935 157.320 1.00 0.00 H TER 9253 WAT 9893 ATOM 9253 O WAT 9894 30.208 37.065 123.872 1.00 0.00 O ATOM 9254 H1 WAT 9894 30.306 36.369 123.222 1.00 0.00 H ATOM 9255 H2 WAT 9894 29.271 37.083 124.065 1.00 0.00 H TER 9257 WAT 9894 ATOM 9257 O WAT 9895 36.051 109.634 80.673 1.00 0.00 O ATOM 9258 H1 WAT 9895 36.304 110.542 80.509 1.00 0.00 H ATOM 9259 H2 WAT 9895 36.869 109.196 80.908 1.00 0.00 H TER 9261 WAT 9895 ATOM 9261 O WAT 9896 111.919 75.718 126.921 1.00 0.00 O ATOM 9262 H1 WAT 9896 111.700 75.291 127.749 1.00 0.00 H ATOM 9263 H2 WAT 9896 111.267 75.389 126.302 1.00 0.00 H TER 9265 WAT 9896 ATOM 9265 O WAT 9897 54.758 32.526 158.259 1.00 0.00 O ATOM 9266 H1 WAT 9897 54.208 33.294 158.104 1.00 0.00 H ATOM 9267 H2 WAT 9897 55.572 32.717 157.793 1.00 0.00 H TER 9269 WAT 9897 ATOM 9269 O WAT 9898 108.800 61.710 15.240 1.00 0.00 O ATOM 9270 H1 WAT 9898 108.111 62.374 15.264 1.00 0.00 H ATOM 9271 H2 WAT 9898 109.571 62.177 14.917 1.00 0.00 H TER 9273 WAT 9898 ATOM 9273 O WAT 9899 138.224 78.595 141.954 1.00 0.00 O ATOM 9274 H1 WAT 9899 137.647 77.832 141.920 1.00 0.00 H ATOM 9275 H2 WAT 9899 138.807 78.421 142.693 1.00 0.00 H TER 9277 WAT 9899 ATOM 9277 O WAT 9900 9.399 36.974 72.071 1.00 0.00 O ATOM 9278 H1 WAT 9900 9.505 37.925 72.040 1.00 0.00 H ATOM 9279 H2 WAT 9900 9.085 36.740 71.198 1.00 0.00 H TER 9281 WAT 9900 ATOM 9281 O WAT 9901 74.430 37.652 158.215 1.00 0.00 O ATOM 9282 H1 WAT 9901 73.870 38.180 158.784 1.00 0.00 H ATOM 9283 H2 WAT 9901 74.546 38.187 157.430 1.00 0.00 H TER 9285 WAT 9901 ATOM 9285 O WAT 9902 87.748 50.623 8.753 1.00 0.00 O ATOM 9286 H1 WAT 9902 87.872 50.251 9.626 1.00 0.00 H ATOM 9287 H2 WAT 9902 88.266 51.428 8.759 1.00 0.00 H TER 9289 WAT 9902 ATOM 9289 O WAT 9903 144.996 41.762 127.722 1.00 0.00 O ATOM 9290 H1 WAT 9903 144.919 41.956 128.657 1.00 0.00 H ATOM 9291 H2 WAT 9903 145.802 42.202 127.452 1.00 0.00 H TER 9293 WAT 9903 ATOM 9293 O WAT 9904 39.023 60.879 80.157 1.00 0.00 O ATOM 9294 H1 WAT 9904 39.487 61.162 79.368 1.00 0.00 H ATOM 9295 H2 WAT 9904 39.448 61.358 80.869 1.00 0.00 H TER 9297 WAT 9904 ATOM 9297 O WAT 9905 16.437 17.518 1.800 1.00 0.00 O ATOM 9298 H1 WAT 9905 16.395 17.162 2.687 1.00 0.00 H ATOM 9299 H2 WAT 9905 17.356 17.429 1.548 1.00 0.00 H TER 9301 WAT 9905 ATOM 9301 O WAT 9906 19.791 3.495 65.452 1.00 0.00 O ATOM 9302 H1 WAT 9906 18.928 3.493 65.864 1.00 0.00 H ATOM 9303 H2 WAT 9906 20.397 3.697 66.165 1.00 0.00 H TER 9305 WAT 9906 ATOM 9305 O WAT 9907 82.211 141.136 135.604 1.00 0.00 O ATOM 9306 H1 WAT 9907 81.995 140.540 136.322 1.00 0.00 H ATOM 9307 H2 WAT 9907 83.093 141.446 135.808 1.00 0.00 H TER 9309 WAT 9907 ATOM 9309 O WAT 9908 3.960 13.836 107.086 1.00 0.00 O ATOM 9310 H1 WAT 9908 3.325 14.014 106.391 1.00 0.00 H ATOM 9311 H2 WAT 9908 4.444 14.656 107.184 1.00 0.00 H TER 9313 WAT 9908 ATOM 9313 O WAT 9909 100.704 44.918 157.375 1.00 0.00 O ATOM 9314 H1 WAT 9909 100.774 44.578 158.267 1.00 0.00 H ATOM 9315 H2 WAT 9909 100.069 45.632 157.440 1.00 0.00 H TER 9317 WAT 9909 ATOM 9317 O WAT 9910 108.135 66.887 114.097 1.00 0.00 O ATOM 9318 H1 WAT 9910 109.054 66.797 114.349 1.00 0.00 H ATOM 9319 H2 WAT 9910 107.696 66.153 114.526 1.00 0.00 H TER 9321 WAT 9910 ATOM 9321 O WAT 9911 86.989 25.096 129.651 1.00 0.00 O ATOM 9322 H1 WAT 9911 87.418 24.472 130.237 1.00 0.00 H ATOM 9323 H2 WAT 9911 87.247 24.816 128.773 1.00 0.00 H TER 9325 WAT 9911 ATOM 9325 O WAT 9912 118.470 138.310 113.198 1.00 0.00 O ATOM 9326 H1 WAT 9912 117.556 138.382 113.473 1.00 0.00 H ATOM 9327 H2 WAT 9912 118.869 137.726 113.844 1.00 0.00 H TER 9329 WAT 9912 ATOM 9329 O WAT 9913 99.561 71.846 16.245 1.00 0.00 O ATOM 9330 H1 WAT 9913 99.434 72.301 15.412 1.00 0.00 H ATOM 9331 H2 WAT 9913 100.458 71.515 16.202 1.00 0.00 H TER 9333 WAT 9913 ATOM 9333 O WAT 9914 18.970 19.036 80.784 1.00 0.00 O ATOM 9334 H1 WAT 9914 19.032 19.223 81.721 1.00 0.00 H ATOM 9335 H2 WAT 9914 19.049 18.084 80.725 1.00 0.00 H TER 9337 WAT 9914 ATOM 9337 O WAT 9915 66.903 86.702 79.618 1.00 0.00 O ATOM 9338 H1 WAT 9915 67.023 86.216 78.802 1.00 0.00 H ATOM 9339 H2 WAT 9915 66.032 86.447 79.922 1.00 0.00 H TER 9341 WAT 9915 ATOM 9341 O WAT 9916 44.575 64.772 87.171 1.00 0.00 O ATOM 9342 H1 WAT 9916 43.864 65.148 86.652 1.00 0.00 H ATOM 9343 H2 WAT 9916 44.133 64.241 87.833 1.00 0.00 H TER 9345 WAT 9916 ATOM 9345 O WAT 9917 130.318 80.383 137.086 1.00 0.00 O ATOM 9346 H1 WAT 9917 130.028 81.291 136.993 1.00 0.00 H ATOM 9347 H2 WAT 9917 129.567 79.861 136.803 1.00 0.00 H TER 9349 WAT 9917 ATOM 9349 O WAT 9918 56.238 15.799 136.120 1.00 0.00 O ATOM 9350 H1 WAT 9918 56.209 15.335 136.957 1.00 0.00 H ATOM 9351 H2 WAT 9918 57.091 16.234 136.117 1.00 0.00 H TER 9353 WAT 9918 ATOM 9353 O WAT 9919 41.569 89.627 73.013 1.00 0.00 O ATOM 9354 H1 WAT 9919 42.411 89.618 72.557 1.00 0.00 H ATOM 9355 H2 WAT 9919 41.776 89.340 73.902 1.00 0.00 H TER 9357 WAT 9919 ATOM 9357 O WAT 9920 32.692 43.219 82.612 1.00 0.00 O ATOM 9358 H1 WAT 9920 32.171 43.891 82.172 1.00 0.00 H ATOM 9359 H2 WAT 9920 33.553 43.274 82.198 1.00 0.00 H TER 9361 WAT 9920 ATOM 9361 O WAT 9921 146.072 76.256 74.756 1.00 0.00 O ATOM 9362 H1 WAT 9921 145.852 75.988 75.648 1.00 0.00 H ATOM 9363 H2 WAT 9921 145.287 76.703 74.439 1.00 0.00 H TER 9365 WAT 9921 ATOM 9365 O WAT 9922 50.649 144.425 6.271 1.00 0.00 O ATOM 9366 H1 WAT 9922 51.376 144.865 5.830 1.00 0.00 H ATOM 9367 H2 WAT 9922 51.055 143.974 7.011 1.00 0.00 H TER 9369 WAT 9922 ATOM 9369 O WAT 9923 70.978 112.337 114.372 1.00 0.00 O ATOM 9370 H1 WAT 9923 71.911 112.125 114.356 1.00 0.00 H ATOM 9371 H2 WAT 9923 70.674 112.013 115.220 1.00 0.00 H TER 9373 WAT 9923 ATOM 9373 O WAT 9924 139.293 3.829 83.790 1.00 0.00 O ATOM 9374 H1 WAT 9924 139.562 4.736 83.648 1.00 0.00 H ATOM 9375 H2 WAT 9924 138.853 3.580 82.977 1.00 0.00 H TER 9377 WAT 9924 ATOM 9377 O WAT 9925 29.916 38.019 18.051 1.00 0.00 O ATOM 9378 H1 WAT 9925 30.245 37.120 18.047 1.00 0.00 H ATOM 9379 H2 WAT 9925 30.389 38.450 17.340 1.00 0.00 H TER 9381 WAT 9925 ATOM 9381 O WAT 9926 66.516 82.793 90.663 1.00 0.00 O ATOM 9382 H1 WAT 9926 66.850 82.857 91.557 1.00 0.00 H ATOM 9383 H2 WAT 9926 66.088 81.938 90.627 1.00 0.00 H TER 9385 WAT 9926 ATOM 9385 O WAT 9927 29.435 90.796 136.631 1.00 0.00 O ATOM 9386 H1 WAT 9927 30.317 90.942 136.289 1.00 0.00 H ATOM 9387 H2 WAT 9927 28.866 91.304 136.052 1.00 0.00 H TER 9389 WAT 9927 ATOM 9389 O WAT 9928 141.835 125.648 19.914 1.00 0.00 O ATOM 9390 H1 WAT 9928 141.333 125.138 20.550 1.00 0.00 H ATOM 9391 H2 WAT 9928 142.127 126.419 20.402 1.00 0.00 H TER 9393 WAT 9928 ATOM 9393 O WAT 9929 24.055 100.624 155.581 1.00 0.00 O ATOM 9394 H1 WAT 9929 23.656 101.242 156.194 1.00 0.00 H ATOM 9395 H2 WAT 9929 24.986 100.847 155.587 1.00 0.00 H TER 9397 WAT 9929 ATOM 9397 O WAT 9930 66.603 143.707 140.101 1.00 0.00 O ATOM 9398 H1 WAT 9930 66.439 144.570 140.480 1.00 0.00 H ATOM 9399 H2 WAT 9930 67.487 143.769 139.739 1.00 0.00 H TER 9401 WAT 9930 ATOM 9401 O WAT 9931 64.676 37.135 75.399 1.00 0.00 O ATOM 9402 H1 WAT 9931 65.303 37.313 74.698 1.00 0.00 H ATOM 9403 H2 WAT 9931 63.996 36.605 74.983 1.00 0.00 H TER 9405 WAT 9931 ATOM 9405 O WAT 9932 41.781 27.835 3.318 1.00 0.00 O ATOM 9406 H1 WAT 9932 42.257 27.469 4.063 1.00 0.00 H ATOM 9407 H2 WAT 9932 41.330 28.600 3.675 1.00 0.00 H TER 9409 WAT 9932 ATOM 9409 O WAT 9933 49.063 48.483 61.780 1.00 0.00 O ATOM 9410 H1 WAT 9933 49.701 48.763 61.123 1.00 0.00 H ATOM 9411 H2 WAT 9933 48.272 48.980 61.574 1.00 0.00 H TER 9413 WAT 9933 ATOM 9413 O WAT 9934 25.744 37.297 10.941 1.00 0.00 O ATOM 9414 H1 WAT 9934 26.434 36.655 10.771 1.00 0.00 H ATOM 9415 H2 WAT 9934 25.210 37.289 10.146 1.00 0.00 H TER 9417 WAT 9934 ATOM 9417 O WAT 9935 67.798 83.670 95.946 1.00 0.00 O ATOM 9418 H1 WAT 9935 66.985 84.086 96.234 1.00 0.00 H ATOM 9419 H2 WAT 9935 67.561 83.214 95.139 1.00 0.00 H TER 9421 WAT 9935 ATOM 9421 O WAT 9936 108.174 142.264 63.529 1.00 0.00 O ATOM 9422 H1 WAT 9936 108.709 142.348 64.318 1.00 0.00 H ATOM 9423 H2 WAT 9936 108.487 142.960 62.951 1.00 0.00 H TER 9425 WAT 9936 ATOM 9425 O WAT 9937 15.971 9.261 108.533 1.00 0.00 O ATOM 9426 H1 WAT 9937 16.627 8.567 108.597 1.00 0.00 H ATOM 9427 H2 WAT 9937 16.343 9.886 107.910 1.00 0.00 H TER 9429 WAT 9937 ATOM 9429 O WAT 9938 102.692 55.216 13.330 1.00 0.00 O ATOM 9430 H1 WAT 9938 102.620 55.626 14.192 1.00 0.00 H ATOM 9431 H2 WAT 9938 101.799 55.228 12.984 1.00 0.00 H TER 9433 WAT 9938 ATOM 9433 O WAT 9939 82.164 107.977 110.788 1.00 0.00 O ATOM 9434 H1 WAT 9939 82.649 108.388 110.073 1.00 0.00 H ATOM 9435 H2 WAT 9939 82.793 107.930 111.508 1.00 0.00 H TER 9437 WAT 9939 ATOM 9437 O WAT 9940 134.980 8.705 86.112 1.00 0.00 O ATOM 9438 H1 WAT 9940 134.462 9.227 85.499 1.00 0.00 H ATOM 9439 H2 WAT 9940 135.626 9.319 86.462 1.00 0.00 H TER 9441 WAT 9940 ATOM 9441 O WAT 9941 74.694 54.191 20.261 1.00 0.00 O ATOM 9442 H1 WAT 9941 75.529 54.644 20.145 1.00 0.00 H ATOM 9443 H2 WAT 9941 74.728 53.851 21.155 1.00 0.00 H TER 9445 WAT 9941 ATOM 9445 O WAT 9942 41.098 79.483 77.509 1.00 0.00 O ATOM 9446 H1 WAT 9942 42.029 79.371 77.317 1.00 0.00 H ATOM 9447 H2 WAT 9942 40.692 78.670 77.208 1.00 0.00 H TER 9449 WAT 9942 ATOM 9449 O WAT 9943 35.639 2.897 100.207 1.00 0.00 O ATOM 9450 H1 WAT 9943 36.577 2.933 100.391 1.00 0.00 H ATOM 9451 H2 WAT 9943 35.259 2.480 100.980 1.00 0.00 H TER 9453 WAT 9943 ATOM 9453 O WAT 9944 1.794 49.794 1.462 1.00 0.00 O ATOM 9454 H1 WAT 9944 1.635 50.622 1.008 1.00 0.00 H ATOM 9455 H2 WAT 9944 1.123 49.203 1.120 1.00 0.00 H TER 9457 WAT 9944 ATOM 9457 O WAT 9945 5.096 24.461 79.794 1.00 0.00 O ATOM 9458 H1 WAT 9945 4.479 23.732 79.856 1.00 0.00 H ATOM 9459 H2 WAT 9945 4.804 25.081 80.462 1.00 0.00 H TER 9461 WAT 9945 ATOM 9461 O WAT 9946 0.768 23.900 71.793 1.00 0.00 O ATOM 9462 H1 WAT 9946 1.283 24.040 72.587 1.00 0.00 H ATOM 9463 H2 WAT 9946 0.515 24.780 71.513 1.00 0.00 H TER 9465 WAT 9946 ATOM 9465 O WAT 9947 26.357 50.302 86.739 1.00 0.00 O ATOM 9466 H1 WAT 9947 26.422 50.625 85.840 1.00 0.00 H ATOM 9467 H2 WAT 9947 26.460 51.083 87.282 1.00 0.00 H TER 9469 WAT 9947 ATOM 9469 O WAT 9948 79.877 28.101 113.936 1.00 0.00 O ATOM 9470 H1 WAT 9948 79.862 27.545 114.715 1.00 0.00 H ATOM 9471 H2 WAT 9948 79.648 28.972 114.259 1.00 0.00 H TER 9473 WAT 9948 ATOM 9473 O WAT 9949 56.528 82.932 156.974 1.00 0.00 O ATOM 9474 H1 WAT 9949 56.070 82.104 156.825 1.00 0.00 H ATOM 9475 H2 WAT 9949 55.924 83.601 156.652 1.00 0.00 H TER 9477 WAT 9949 ATOM 9477 O WAT 9950 20.429 125.341 68.272 1.00 0.00 O ATOM 9478 H1 WAT 9950 19.601 124.876 68.391 1.00 0.00 H ATOM 9479 H2 WAT 9950 20.200 126.104 67.742 1.00 0.00 H TER 9481 WAT 9950 ATOM 9481 O WAT 9951 142.042 49.505 70.715 1.00 0.00 O ATOM 9482 H1 WAT 9951 141.502 48.884 70.227 1.00 0.00 H ATOM 9483 H2 WAT 9951 142.936 49.179 70.611 1.00 0.00 H TER 9485 WAT 9951 ATOM 9485 O WAT 9952 47.061 98.410 83.714 1.00 0.00 O ATOM 9486 H1 WAT 9952 46.592 97.790 83.156 1.00 0.00 H ATOM 9487 H2 WAT 9952 47.974 98.128 83.672 1.00 0.00 H TER 9489 WAT 9952 ATOM 9489 O WAT 9953 41.738 19.653 125.411 1.00 0.00 O ATOM 9490 H1 WAT 9953 42.574 19.198 125.305 1.00 0.00 H ATOM 9491 H2 WAT 9953 41.929 20.562 125.181 1.00 0.00 H TER 9493 WAT 9953 ATOM 9493 O WAT 9954 116.506 77.887 81.547 1.00 0.00 O ATOM 9494 H1 WAT 9954 117.104 78.214 80.875 1.00 0.00 H ATOM 9495 H2 WAT 9954 117.079 77.594 82.256 1.00 0.00 H TER 9497 WAT 9954 ATOM 9497 O WAT 9955 68.232 116.808 104.177 1.00 0.00 O ATOM 9498 H1 WAT 9955 68.790 116.534 103.450 1.00 0.00 H ATOM 9499 H2 WAT 9955 67.662 117.479 103.800 1.00 0.00 H TER 9501 WAT 9955 ATOM 9501 O WAT 9956 76.560 111.671 156.084 1.00 0.00 O ATOM 9502 H1 WAT 9956 76.143 112.311 155.508 1.00 0.00 H ATOM 9503 H2 WAT 9956 75.927 111.534 156.789 1.00 0.00 H TER 9505 WAT 9956 ATOM 9505 O WAT 9957 8.324 128.126 71.478 1.00 0.00 O ATOM 9506 H1 WAT 9957 9.032 128.423 70.907 1.00 0.00 H ATOM 9507 H2 WAT 9957 7.733 128.876 71.537 1.00 0.00 H TER 9509 WAT 9957 ATOM 9509 O WAT 9958 35.457 0.667 156.778 1.00 0.00 O ATOM 9510 H1 WAT 9958 36.064 1.268 156.346 1.00 0.00 H ATOM 9511 H2 WAT 9958 34.874 1.235 157.281 1.00 0.00 H TER 9513 WAT 9958 ATOM 9513 O WAT 9959 101.660 142.204 136.671 1.00 0.00 O ATOM 9514 H1 WAT 9959 101.651 141.670 135.877 1.00 0.00 H ATOM 9515 H2 WAT 9959 101.697 143.106 136.353 1.00 0.00 H TER 9517 WAT 9959 ATOM 9517 O WAT 9960 118.577 48.380 21.438 1.00 0.00 O ATOM 9518 H1 WAT 9960 118.582 49.076 22.095 1.00 0.00 H ATOM 9519 H2 WAT 9960 119.454 48.001 21.483 1.00 0.00 H TER 9521 WAT 9960 ATOM 9521 O WAT 9961 57.746 42.928 150.665 1.00 0.00 O ATOM 9522 H1 WAT 9961 58.688 43.032 150.801 1.00 0.00 H ATOM 9523 H2 WAT 9961 57.580 42.001 150.836 1.00 0.00 H TER 9525 WAT 9961 ATOM 9525 O WAT 9962 21.513 82.269 82.875 1.00 0.00 O ATOM 9526 H1 WAT 9962 21.546 81.940 81.976 1.00 0.00 H ATOM 9527 H2 WAT 9962 21.440 83.218 82.780 1.00 0.00 H TER 9529 WAT 9962 ATOM 9529 O WAT 9963 64.079 62.277 134.599 1.00 0.00 O ATOM 9530 H1 WAT 9963 63.968 62.010 135.512 1.00 0.00 H ATOM 9531 H2 WAT 9963 63.264 62.014 134.172 1.00 0.00 H TER 9533 WAT 9963 ATOM 9533 O WAT 9964 31.282 109.097 22.132 1.00 0.00 O ATOM 9534 H1 WAT 9964 32.002 109.435 21.600 1.00 0.00 H ATOM 9535 H2 WAT 9964 31.611 109.131 23.030 1.00 0.00 H TER 9537 WAT 9964 ATOM 9537 O WAT 9965 88.630 87.324 124.846 1.00 0.00 O ATOM 9538 H1 WAT 9965 88.596 86.596 125.467 1.00 0.00 H ATOM 9539 H2 WAT 9965 88.688 88.105 125.395 1.00 0.00 H TER 9541 WAT 9965 ATOM 9541 O WAT 9966 62.170 134.528 145.970 1.00 0.00 O ATOM 9542 H1 WAT 9966 62.717 133.815 145.640 1.00 0.00 H ATOM 9543 H2 WAT 9966 61.753 134.891 145.189 1.00 0.00 H TER 9545 WAT 9966 ATOM 9545 O WAT 9967 123.323 64.801 7.867 1.00 0.00 O ATOM 9546 H1 WAT 9967 123.753 65.637 8.047 1.00 0.00 H ATOM 9547 H2 WAT 9967 123.596 64.577 6.977 1.00 0.00 H TER 9549 WAT 9967 ATOM 9549 O WAT 9968 89.483 60.609 73.322 1.00 0.00 O ATOM 9550 H1 WAT 9968 88.810 61.050 72.803 1.00 0.00 H ATOM 9551 H2 WAT 9968 89.949 61.319 73.763 1.00 0.00 H TER 9553 WAT 9968 ATOM 9553 O WAT 9969 90.605 18.669 77.205 1.00 0.00 O ATOM 9554 H1 WAT 9969 90.317 17.790 76.957 1.00 0.00 H ATOM 9555 H2 WAT 9969 90.682 18.636 78.158 1.00 0.00 H TER 9557 WAT 9969 ATOM 9557 O WAT 9970 23.965 130.848 142.372 1.00 0.00 O ATOM 9558 H1 WAT 9970 23.682 130.193 141.734 1.00 0.00 H ATOM 9559 H2 WAT 9970 23.315 131.547 142.302 1.00 0.00 H TER 9561 WAT 9970 ATOM 9561 O WAT 9971 69.867 66.704 152.301 1.00 0.00 O ATOM 9562 H1 WAT 9971 69.118 66.313 151.851 1.00 0.00 H ATOM 9563 H2 WAT 9971 70.437 67.009 151.595 1.00 0.00 H TER 9565 WAT 9971 ATOM 9565 O WAT 9972 70.879 144.836 122.823 1.00 0.00 O ATOM 9566 H1 WAT 9972 71.280 145.583 123.267 1.00 0.00 H ATOM 9567 H2 WAT 9972 70.368 145.225 122.113 1.00 0.00 H TER 9569 WAT 9972 ATOM 9569 O WAT 9973 95.715 73.413 116.936 1.00 0.00 O ATOM 9570 H1 WAT 9973 94.976 73.915 116.592 1.00 0.00 H ATOM 9571 H2 WAT 9973 96.063 73.953 117.645 1.00 0.00 H TER 9573 WAT 9973 ATOM 9573 O WAT 9974 40.244 105.241 6.055 1.00 0.00 O ATOM 9574 H1 WAT 9974 40.290 105.996 6.641 1.00 0.00 H ATOM 9575 H2 WAT 9974 40.729 104.553 6.511 1.00 0.00 H TER 9577 WAT 9974 ATOM 9577 O WAT 9975 135.084 114.272 106.759 1.00 0.00 O ATOM 9578 H1 WAT 9975 135.913 114.343 107.231 1.00 0.00 H ATOM 9579 H2 WAT 9975 134.561 113.665 107.283 1.00 0.00 H TER 9581 WAT 9975 ATOM 9581 O WAT 9976 67.810 125.279 149.176 1.00 0.00 O ATOM 9582 H1 WAT 9976 68.712 125.324 148.860 1.00 0.00 H ATOM 9583 H2 WAT 9976 67.883 125.381 150.125 1.00 0.00 H TER 9585 WAT 9976 ATOM 9585 O WAT 9977 81.182 35.680 98.228 1.00 0.00 O ATOM 9586 H1 WAT 9977 80.967 35.728 99.160 1.00 0.00 H ATOM 9587 H2 WAT 9977 81.430 34.767 98.086 1.00 0.00 H TER 9589 WAT 9977 ATOM 9589 O WAT 9978 4.046 134.897 69.060 1.00 0.00 O ATOM 9590 H1 WAT 9978 4.335 135.768 69.335 1.00 0.00 H ATOM 9591 H2 WAT 9978 4.773 134.557 68.539 1.00 0.00 H TER 9593 WAT 9978 ATOM 9593 O WAT 9979 125.486 28.943 90.397 1.00 0.00 O ATOM 9594 H1 WAT 9979 125.845 28.887 89.512 1.00 0.00 H ATOM 9595 H2 WAT 9979 124.670 29.433 90.294 1.00 0.00 H TER 9597 WAT 9979 ATOM 9597 O WAT 9980 56.661 56.595 65.029 1.00 0.00 O ATOM 9598 H1 WAT 9980 56.947 56.863 65.903 1.00 0.00 H ATOM 9599 H2 WAT 9980 57.258 55.886 64.790 1.00 0.00 H TER 9601 WAT 9980 ATOM 9601 O WAT 9981 87.896 17.238 54.970 1.00 0.00 O ATOM 9602 H1 WAT 9981 88.269 17.983 55.442 1.00 0.00 H ATOM 9603 H2 WAT 9981 87.204 16.912 55.545 1.00 0.00 H TER 9605 WAT 9981 ATOM 9605 O WAT 9982 144.271 93.228 126.935 1.00 0.00 O ATOM 9606 H1 WAT 9982 145.124 93.236 126.500 1.00 0.00 H ATOM 9607 H2 WAT 9982 144.295 92.452 127.495 1.00 0.00 H TER 9609 WAT 9982 ATOM 9609 O WAT 9983 33.033 119.248 110.750 1.00 0.00 O ATOM 9610 H1 WAT 9983 32.785 120.165 110.866 1.00 0.00 H ATOM 9611 H2 WAT 9983 33.720 119.267 110.084 1.00 0.00 H TER 9613 WAT 9983 ATOM 9613 O WAT 9984 27.714 40.618 8.677 1.00 0.00 O ATOM 9614 H1 WAT 9984 26.920 40.693 9.206 1.00 0.00 H ATOM 9615 H2 WAT 9984 27.904 41.515 8.402 1.00 0.00 H TER 9617 WAT 9984 ATOM 9617 O WAT 9985 98.348 23.505 114.229 1.00 0.00 O ATOM 9618 H1 WAT 9985 99.022 22.825 114.215 1.00 0.00 H ATOM 9619 H2 WAT 9985 97.588 23.099 113.812 1.00 0.00 H TER 9621 WAT 9985 ATOM 9621 O WAT 9986 140.419 26.152 82.688 1.00 0.00 O ATOM 9622 H1 WAT 9986 140.853 26.847 82.192 1.00 0.00 H ATOM 9623 H2 WAT 9986 139.641 26.571 83.056 1.00 0.00 H TER 9625 WAT 9986 ATOM 9625 O WAT 9987 11.298 95.156 67.976 1.00 0.00 O ATOM 9626 H1 WAT 9987 10.388 94.975 67.742 1.00 0.00 H ATOM 9627 H2 WAT 9987 11.807 94.810 67.244 1.00 0.00 H TER 9629 WAT 9987 ATOM 9629 O WAT 9988 132.756 136.110 121.848 1.00 0.00 O ATOM 9630 H1 WAT 9988 133.311 136.051 122.626 1.00 0.00 H ATOM 9631 H2 WAT 9988 132.995 136.944 121.445 1.00 0.00 H TER 9633 WAT 9988 ATOM 9633 O WAT 9989 63.962 22.253 120.632 1.00 0.00 O ATOM 9634 H1 WAT 9989 63.235 21.722 120.308 1.00 0.00 H ATOM 9635 H2 WAT 9989 64.726 21.680 120.563 1.00 0.00 H TER 9637 WAT 9989 ATOM 9637 O WAT 9990 97.744 26.961 116.384 1.00 0.00 O ATOM 9638 H1 WAT 9990 98.178 26.887 115.535 1.00 0.00 H ATOM 9639 H2 WAT 9990 96.810 26.991 116.175 1.00 0.00 H TER 9641 WAT 9990 ATOM 9641 O WAT 9991 4.156 113.078 106.122 1.00 0.00 O ATOM 9642 H1 WAT 9991 4.566 113.601 105.434 1.00 0.00 H ATOM 9643 H2 WAT 9991 3.548 113.680 106.551 1.00 0.00 H TER 9645 WAT 9991 ATOM 9645 O WAT 9992 112.971 95.539 79.560 1.00 0.00 O ATOM 9646 H1 WAT 9992 112.993 95.667 80.509 1.00 0.00 H ATOM 9647 H2 WAT 9992 113.856 95.253 79.336 1.00 0.00 H TER 9649 WAT 9992 ATOM 9649 O WAT 9993 95.281 100.595 114.081 1.00 0.00 O ATOM 9650 H1 WAT 9993 95.210 99.763 113.614 1.00 0.00 H ATOM 9651 H2 WAT 9993 94.821 100.447 114.907 1.00 0.00 H TER 9653 WAT 9993 ATOM 9653 O WAT 9994 53.603 23.357 149.452 1.00 0.00 O ATOM 9654 H1 WAT 9994 53.338 24.123 148.943 1.00 0.00 H ATOM 9655 H2 WAT 9994 53.240 22.613 148.973 1.00 0.00 H TER 9657 WAT 9994 ATOM 9657 O WAT 9995 134.922 135.158 153.603 1.00 0.00 O ATOM 9658 H1 WAT 9995 135.299 136.037 153.634 1.00 0.00 H ATOM 9659 H2 WAT 9995 134.634 135.052 152.697 1.00 0.00 H TER 9661 WAT 9995 ATOM 9661 O WAT 9996 135.843 63.234 127.764 1.00 0.00 O ATOM 9662 H1 WAT 9996 136.479 63.358 128.469 1.00 0.00 H ATOM 9663 H2 WAT 9996 135.878 62.297 127.572 1.00 0.00 H TER 9665 WAT 9996 ATOM 9665 O WAT 9997 57.830 126.774 124.381 1.00 0.00 O ATOM 9666 H1 WAT 9997 57.012 126.426 124.027 1.00 0.00 H ATOM 9667 H2 WAT 9997 57.670 127.713 124.475 1.00 0.00 H TER 9669 WAT 9997 ATOM 9669 O WAT 9998 131.145 84.189 86.123 1.00 0.00 O ATOM 9670 H1 WAT 9998 131.852 84.424 86.724 1.00 0.00 H ATOM 9671 H2 WAT 9998 131.449 84.487 85.266 1.00 0.00 H TER 9673 WAT 9998 ATOM 9673 O WAT 9999 128.618 83.986 62.942 1.00 0.00 O ATOM 9674 H1 WAT 9999 128.803 83.171 62.475 1.00 0.00 H ATOM 9675 H2 WAT 9999 129.409 84.513 62.825 1.00 0.00 H TER 9677 WAT 9999 ATOM 9677 O WAT 0 82.858 19.498 61.179 1.00 0.00 O ATOM 9678 H1 WAT 0 82.387 19.597 60.351 1.00 0.00 H ATOM 9679 H2 WAT 0 82.491 18.704 61.569 1.00 0.00 H TER 9681 WAT 0 ATOM 9681 O WAT 1 94.383 89.034 9.452 1.00 0.00 O ATOM 9682 H1 WAT 1 93.631 89.561 9.181 1.00 0.00 H ATOM 9683 H2 WAT 1 94.075 88.555 10.221 1.00 0.00 H TER 9685 WAT 1 ATOM 9685 O WAT 2 10.713 144.827 74.133 1.00 0.00 O ATOM 9686 H1 WAT 2 11.553 144.998 73.707 1.00 0.00 H ATOM 9687 H2 WAT 2 10.781 145.264 74.982 1.00 0.00 H TER 9689 WAT 2 ATOM 9689 O WAT 3 80.395 106.230 78.274 1.00 0.00 O ATOM 9690 H1 WAT 3 80.212 105.753 77.464 1.00 0.00 H ATOM 9691 H2 WAT 3 81.350 106.249 78.330 1.00 0.00 H TER 9693 WAT 3 ATOM 9693 O WAT 4 24.893 106.965 74.863 1.00 0.00 O ATOM 9694 H1 WAT 4 24.265 107.397 74.285 1.00 0.00 H ATOM 9695 H2 WAT 4 24.488 107.004 75.730 1.00 0.00 H TER 9697 WAT 4 ATOM 9697 O WAT 5 41.818 61.182 8.908 1.00 0.00 O ATOM 9698 H1 WAT 5 42.051 62.057 9.218 1.00 0.00 H ATOM 9699 H2 WAT 5 41.135 61.333 8.255 1.00 0.00 H TER 9701 WAT 5 ATOM 9701 O WAT 6 109.805 73.313 80.021 1.00 0.00 O ATOM 9702 H1 WAT 6 110.654 73.542 80.399 1.00 0.00 H ATOM 9703 H2 WAT 6 109.167 73.600 80.675 1.00 0.00 H TER 9705 WAT 6 ATOM 9705 O WAT 7 25.843 72.177 146.182 1.00 0.00 O ATOM 9706 H1 WAT 7 25.489 72.592 146.969 1.00 0.00 H ATOM 9707 H2 WAT 7 26.251 71.371 146.499 1.00 0.00 H TER 9709 WAT 7 ATOM 9709 O WAT 8 106.059 108.037 78.780 1.00 0.00 O ATOM 9710 H1 WAT 8 106.651 108.750 79.020 1.00 0.00 H ATOM 9711 H2 WAT 8 105.225 108.271 79.187 1.00 0.00 H TER 9713 WAT 8 ATOM 9713 O WAT 9 103.265 140.651 97.804 1.00 0.00 O ATOM 9714 H1 WAT 9 103.735 141.478 97.696 1.00 0.00 H ATOM 9715 H2 WAT 9 103.636 140.267 98.598 1.00 0.00 H TER 9717 WAT 9 ATOM 9717 O WAT 10 87.096 134.817 97.975 1.00 0.00 O ATOM 9718 H1 WAT 10 87.509 134.615 98.814 1.00 0.00 H ATOM 9719 H2 WAT 10 86.161 134.675 98.127 1.00 0.00 H TER 9721 WAT 10 ATOM 9721 O WAT 11 60.689 10.237 151.056 1.00 0.00 O ATOM 9722 H1 WAT 11 60.992 9.954 151.919 1.00 0.00 H ATOM 9723 H2 WAT 11 59.965 9.647 150.850 1.00 0.00 H TER 9725 WAT 11 ATOM 9725 O WAT 12 58.976 37.818 96.380 1.00 0.00 O ATOM 9726 H1 WAT 12 58.349 37.987 95.676 1.00 0.00 H ATOM 9727 H2 WAT 12 59.084 36.866 96.381 1.00 0.00 H TER 9729 WAT 12 ATOM 9729 O WAT 13 143.884 114.039 20.757 1.00 0.00 O ATOM 9730 H1 WAT 13 144.310 113.228 21.036 1.00 0.00 H ATOM 9731 H2 WAT 13 144.286 114.719 21.297 1.00 0.00 H TER 9733 WAT 13 ATOM 9733 O WAT 14 104.823 59.902 18.264 1.00 0.00 O ATOM 9734 H1 WAT 14 104.944 59.305 19.002 1.00 0.00 H ATOM 9735 H2 WAT 14 104.025 59.594 17.834 1.00 0.00 H TER 9737 WAT 14 ATOM 9737 O WAT 15 45.851 133.435 9.340 1.00 0.00 O ATOM 9738 H1 WAT 15 46.759 133.580 9.072 1.00 0.00 H ATOM 9739 H2 WAT 15 45.720 134.036 10.074 1.00 0.00 H TER 9741 WAT 15 ATOM 9741 O WAT 16 5.471 91.930 153.009 1.00 0.00 O ATOM 9742 H1 WAT 16 4.954 92.580 152.533 1.00 0.00 H ATOM 9743 H2 WAT 16 6.151 91.665 152.389 1.00 0.00 H TER 9745 WAT 16 ATOM 9745 O WAT 17 106.482 43.771 108.697 1.00 0.00 O ATOM 9746 H1 WAT 17 106.020 43.561 109.508 1.00 0.00 H ATOM 9747 H2 WAT 17 106.929 44.597 108.882 1.00 0.00 H TER 9749 WAT 17 ATOM 9749 O WAT 18 1.007 77.270 12.135 1.00 0.00 O ATOM 9750 H1 WAT 18 0.947 78.180 12.426 1.00 0.00 H ATOM 9751 H2 WAT 18 0.803 77.305 11.200 1.00 0.00 H TER 9753 WAT 18 ATOM 9753 O WAT 19 31.396 72.160 12.711 1.00 0.00 O ATOM 9754 H1 WAT 19 31.303 71.438 12.090 1.00 0.00 H ATOM 9755 H2 WAT 19 30.970 71.846 13.509 1.00 0.00 H TER 9757 WAT 19 ATOM 9757 O WAT 20 78.787 45.551 12.265 1.00 0.00 O ATOM 9758 H1 WAT 20 78.570 46.482 12.204 1.00 0.00 H ATOM 9759 H2 WAT 20 79.596 45.526 12.775 1.00 0.00 H TER 9761 WAT 20 ATOM 9761 O WAT 21 76.841 12.303 109.946 1.00 0.00 O ATOM 9762 H1 WAT 21 76.507 11.406 109.980 1.00 0.00 H ATOM 9763 H2 WAT 21 76.116 12.840 110.266 1.00 0.00 H TER 9765 WAT 21 ATOM 9765 O WAT 22 101.641 14.756 15.999 1.00 0.00 O ATOM 9766 H1 WAT 22 101.393 14.383 15.153 1.00 0.00 H ATOM 9767 H2 WAT 22 100.809 14.900 16.450 1.00 0.00 H TER 9769 WAT 22 ATOM 9769 O WAT 23 114.092 109.405 83.341 1.00 0.00 O ATOM 9770 H1 WAT 23 114.751 108.811 82.980 1.00 0.00 H ATOM 9771 H2 WAT 23 113.338 108.844 83.522 1.00 0.00 H TER 9773 WAT 23 ATOM 9773 O WAT 24 47.880 128.752 59.272 1.00 0.00 O ATOM 9774 H1 WAT 24 48.673 129.035 59.727 1.00 0.00 H ATOM 9775 H2 WAT 24 47.917 127.796 59.295 1.00 0.00 H TER 9777 WAT 24 ATOM 9777 O WAT 25 45.394 47.144 65.534 1.00 0.00 O ATOM 9778 H1 WAT 25 46.287 46.837 65.690 1.00 0.00 H ATOM 9779 H2 WAT 25 45.326 47.208 64.582 1.00 0.00 H TER 9781 WAT 25 ATOM 9781 O WAT 26 29.649 44.521 24.330 1.00 0.00 O ATOM 9782 H1 WAT 26 29.585 44.150 25.210 1.00 0.00 H ATOM 9783 H2 WAT 26 29.252 45.389 24.407 1.00 0.00 H TER 9785 WAT 26 ATOM 9785 O WAT 27 43.646 96.879 18.597 1.00 0.00 O ATOM 9786 H1 WAT 27 43.194 97.680 18.863 1.00 0.00 H ATOM 9787 H2 WAT 27 43.254 96.651 17.754 1.00 0.00 H TER 9789 WAT 27 ATOM 9789 O WAT 28 122.115 54.180 153.601 1.00 0.00 O ATOM 9790 H1 WAT 28 122.364 53.491 152.985 1.00 0.00 H ATOM 9791 H2 WAT 28 122.682 54.918 153.378 1.00 0.00 H TER 9793 WAT 28 ATOM 9793 O WAT 29 69.964 126.875 114.228 1.00 0.00 O ATOM 9794 H1 WAT 29 70.732 127.436 114.332 1.00 0.00 H ATOM 9795 H2 WAT 29 69.219 127.461 114.360 1.00 0.00 H TER 9797 WAT 29 ATOM 9797 O WAT 30 29.897 64.230 102.095 1.00 0.00 O ATOM 9798 H1 WAT 30 29.460 63.398 102.277 1.00 0.00 H ATOM 9799 H2 WAT 30 29.366 64.635 101.410 1.00 0.00 H TER 9801 WAT 30 ATOM 9801 O WAT 31 86.075 31.375 59.147 1.00 0.00 O ATOM 9802 H1 WAT 31 85.969 31.483 60.092 1.00 0.00 H ATOM 9803 H2 WAT 31 85.594 32.110 58.767 1.00 0.00 H TER 9805 WAT 31 ATOM 9805 O WAT 32 15.536 22.150 88.561 1.00 0.00 O ATOM 9806 H1 WAT 32 14.940 22.582 87.949 1.00 0.00 H ATOM 9807 H2 WAT 32 16.241 21.810 88.008 1.00 0.00 H TER 9809 WAT 32 ATOM 9809 O WAT 33 43.968 140.360 15.341 1.00 0.00 O ATOM 9810 H1 WAT 33 43.854 139.633 15.953 1.00 0.00 H ATOM 9811 H2 WAT 33 43.155 140.377 14.836 1.00 0.00 H TER 9813 WAT 33 ATOM 9813 O WAT 34 45.230 46.628 106.451 1.00 0.00 O ATOM 9814 H1 WAT 34 44.633 47.325 106.722 1.00 0.00 H ATOM 9815 H2 WAT 34 46.072 47.066 106.330 1.00 0.00 H TER 9817 WAT 34 ATOM 9817 O WAT 35 22.602 60.649 121.280 1.00 0.00 O ATOM 9818 H1 WAT 35 23.548 60.792 121.249 1.00 0.00 H ATOM 9819 H2 WAT 35 22.474 59.801 120.854 1.00 0.00 H TER 9821 WAT 35 ATOM 9821 O WAT 36 23.510 129.715 144.962 1.00 0.00 O ATOM 9822 H1 WAT 36 23.930 130.263 144.299 1.00 0.00 H ATOM 9823 H2 WAT 36 24.210 129.144 145.279 1.00 0.00 H TER 9825 WAT 36 ATOM 9825 O WAT 37 123.964 51.755 137.059 1.00 0.00 O ATOM 9826 H1 WAT 37 123.379 51.277 136.471 1.00 0.00 H ATOM 9827 H2 WAT 37 124.679 52.051 136.496 1.00 0.00 H TER 9829 WAT 37 ATOM 9829 O WAT 38 69.515 14.239 65.437 1.00 0.00 O ATOM 9830 H1 WAT 38 69.573 14.946 64.794 1.00 0.00 H ATOM 9831 H2 WAT 38 69.594 14.677 66.284 1.00 0.00 H TER 9833 WAT 38 ATOM 9833 O WAT 39 92.046 106.622 145.476 1.00 0.00 O ATOM 9834 H1 WAT 39 91.908 106.303 144.584 1.00 0.00 H ATOM 9835 H2 WAT 39 92.435 105.880 145.938 1.00 0.00 H TER 9837 WAT 39 ATOM 9837 O WAT 40 112.480 52.389 2.157 1.00 0.00 O ATOM 9838 H1 WAT 40 111.757 52.083 2.704 1.00 0.00 H ATOM 9839 H2 WAT 40 112.092 53.067 1.605 1.00 0.00 H TER 9841 WAT 40 ATOM 9841 O WAT 41 124.082 92.059 72.818 1.00 0.00 O ATOM 9842 H1 WAT 41 124.569 92.505 73.511 1.00 0.00 H ATOM 9843 H2 WAT 41 124.596 91.274 72.630 1.00 0.00 H TER 9845 WAT 41 ATOM 9845 O WAT 42 22.508 38.004 93.969 1.00 0.00 O ATOM 9846 H1 WAT 42 23.463 38.035 94.031 1.00 0.00 H ATOM 9847 H2 WAT 42 22.232 38.917 94.052 1.00 0.00 H TER 9849 WAT 42 ATOM 9849 O WAT 43 39.745 15.006 141.811 1.00 0.00 O ATOM 9850 H1 WAT 43 39.504 14.935 140.888 1.00 0.00 H ATOM 9851 H2 WAT 43 39.780 15.948 141.978 1.00 0.00 H TER 9853 WAT 43 ATOM 9853 O WAT 44 89.951 138.818 83.652 1.00 0.00 O ATOM 9854 H1 WAT 44 89.915 138.829 84.609 1.00 0.00 H ATOM 9855 H2 WAT 44 90.885 138.862 83.447 1.00 0.00 H TER 9857 WAT 44 ATOM 9857 O WAT 45 11.749 80.398 122.568 1.00 0.00 O ATOM 9858 H1 WAT 45 12.073 81.241 122.250 1.00 0.00 H ATOM 9859 H2 WAT 45 10.798 80.503 122.596 1.00 0.00 H TER 9861 WAT 45 ATOM 9861 O WAT 46 108.619 132.712 95.338 1.00 0.00 O ATOM 9862 H1 WAT 46 108.086 133.104 96.030 1.00 0.00 H ATOM 9863 H2 WAT 46 109.513 132.742 95.679 1.00 0.00 H TER 9865 WAT 46 ATOM 9865 O WAT 47 56.195 126.017 82.728 1.00 0.00 O ATOM 9866 H1 WAT 47 56.816 126.640 83.104 1.00 0.00 H ATOM 9867 H2 WAT 47 56.727 125.463 82.157 1.00 0.00 H TER 9869 WAT 47 ATOM 9869 O WAT 48 127.162 124.750 10.568 1.00 0.00 O ATOM 9870 H1 WAT 48 128.048 124.568 10.256 1.00 0.00 H ATOM 9871 H2 WAT 48 127.220 124.660 11.520 1.00 0.00 H TER 9873 WAT 48 ATOM 9873 O WAT 49 91.814 48.799 94.728 1.00 0.00 O ATOM 9874 H1 WAT 49 92.355 48.493 95.456 1.00 0.00 H ATOM 9875 H2 WAT 49 92.286 48.515 93.944 1.00 0.00 H TER 9877 WAT 49 ATOM 9877 O WAT 50 25.992 40.494 141.422 1.00 0.00 O ATOM 9878 H1 WAT 50 26.719 40.575 142.040 1.00 0.00 H ATOM 9879 H2 WAT 50 25.264 40.947 141.847 1.00 0.00 H TER 9881 WAT 50 ATOM 9881 O WAT 51 6.733 35.358 77.529 1.00 0.00 O ATOM 9882 H1 WAT 51 7.426 34.697 77.522 1.00 0.00 H ATOM 9883 H2 WAT 51 6.981 35.956 78.233 1.00 0.00 H TER 9885 WAT 51 ATOM 9885 O WAT 52 59.045 131.927 99.797 1.00 0.00 O ATOM 9886 H1 WAT 52 58.164 132.194 99.536 1.00 0.00 H ATOM 9887 H2 WAT 52 59.221 131.142 99.277 1.00 0.00 H TER 9889 WAT 52 ATOM 9889 O WAT 53 51.367 48.597 127.589 1.00 0.00 O ATOM 9890 H1 WAT 53 51.270 48.215 128.461 1.00 0.00 H ATOM 9891 H2 WAT 53 50.842 48.034 127.021 1.00 0.00 H TER 9893 WAT 53 ATOM 9893 O WAT 54 92.942 23.829 88.326 1.00 0.00 O ATOM 9894 H1 WAT 54 92.626 23.010 87.946 1.00 0.00 H ATOM 9895 H2 WAT 54 92.320 24.490 88.023 1.00 0.00 H TER 9897 WAT 54 ATOM 9897 O WAT 55 70.738 81.849 0.977 1.00 0.00 O ATOM 9898 H1 WAT 55 69.786 81.776 1.049 1.00 0.00 H ATOM 9899 H2 WAT 55 71.069 81.016 1.312 1.00 0.00 H TER 9901 WAT 55 ATOM 9901 O WAT 56 69.677 117.508 83.515 1.00 0.00 O ATOM 9902 H1 WAT 56 69.960 118.423 83.517 1.00 0.00 H ATOM 9903 H2 WAT 56 68.891 117.499 84.060 1.00 0.00 H TER 9905 WAT 56 ATOM 9905 O WAT 57 52.148 99.483 14.713 1.00 0.00 O ATOM 9906 H1 WAT 57 52.095 99.689 15.646 1.00 0.00 H ATOM 9907 H2 WAT 57 51.909 98.558 14.657 1.00 0.00 H TER 9909 WAT 57 ATOM 9909 O WAT 58 27.541 7.659 70.475 1.00 0.00 O ATOM 9910 H1 WAT 58 27.158 7.374 69.645 1.00 0.00 H ATOM 9911 H2 WAT 58 27.124 8.502 70.654 1.00 0.00 H TER 9913 WAT 58 ATOM 9913 O WAT 59 123.951 99.679 115.961 1.00 0.00 O ATOM 9914 H1 WAT 59 124.392 100.183 115.277 1.00 0.00 H ATOM 9915 H2 WAT 59 123.018 99.802 115.785 1.00 0.00 H TER 9917 WAT 59 ATOM 9917 O WAT 60 75.131 115.027 73.596 1.00 0.00 O ATOM 9918 H1 WAT 60 75.136 115.983 73.637 1.00 0.00 H ATOM 9919 H2 WAT 60 76.028 114.773 73.811 1.00 0.00 H TER 9921 WAT 60 ATOM 9921 O WAT 61 92.250 136.165 112.268 1.00 0.00 O ATOM 9922 H1 WAT 61 92.314 135.425 111.664 1.00 0.00 H ATOM 9923 H2 WAT 61 91.569 136.723 111.892 1.00 0.00 H TER 9925 WAT 61 ATOM 9925 O WAT 62 90.595 99.934 140.219 1.00 0.00 O ATOM 9926 H1 WAT 62 90.594 100.231 139.309 1.00 0.00 H ATOM 9927 H2 WAT 62 89.673 99.954 140.478 1.00 0.00 H TER 9929 WAT 62 ATOM 9929 O WAT 63 69.446 105.074 54.187 1.00 0.00 O ATOM 9930 H1 WAT 63 69.132 104.227 54.502 1.00 0.00 H ATOM 9931 H2 WAT 63 68.656 105.610 54.112 1.00 0.00 H TER 9933 WAT 63 ATOM 9933 O WAT 64 127.885 92.863 122.500 1.00 0.00 O ATOM 9934 H1 WAT 64 127.748 93.640 121.958 1.00 0.00 H ATOM 9935 H2 WAT 64 127.632 93.138 123.381 1.00 0.00 H TER 9937 WAT 64 ATOM 9937 O WAT 65 20.114 137.636 138.098 1.00 0.00 O ATOM 9938 H1 WAT 65 19.433 137.569 137.428 1.00 0.00 H ATOM 9939 H2 WAT 65 20.686 138.338 137.788 1.00 0.00 H TER 9941 WAT 65 ATOM 9941 O WAT 66 53.830 55.521 149.353 1.00 0.00 O ATOM 9942 H1 WAT 66 53.845 55.209 150.258 1.00 0.00 H ATOM 9943 H2 WAT 66 53.657 54.737 148.832 1.00 0.00 H TER 9945 WAT 66 ATOM 9945 O WAT 67 84.171 107.410 63.264 1.00 0.00 O ATOM 9946 H1 WAT 67 83.265 107.115 63.364 1.00 0.00 H ATOM 9947 H2 WAT 67 84.425 107.704 64.139 1.00 0.00 H TER 9949 WAT 67 ATOM 9949 O WAT 68 65.996 116.208 16.488 1.00 0.00 O ATOM 9950 H1 WAT 68 65.169 116.521 16.122 1.00 0.00 H ATOM 9951 H2 WAT 68 65.798 116.026 17.407 1.00 0.00 H TER 9953 WAT 68 ATOM 9953 O WAT 69 82.077 0.929 105.640 1.00 0.00 O ATOM 9954 H1 WAT 69 82.884 1.440 105.592 1.00 0.00 H ATOM 9955 H2 WAT 69 82.233 0.301 106.346 1.00 0.00 H TER 9957 WAT 69 ATOM 9957 O WAT 70 113.721 39.670 134.503 1.00 0.00 O ATOM 9958 H1 WAT 70 112.863 39.977 134.797 1.00 0.00 H ATOM 9959 H2 WAT 70 113.556 38.789 134.164 1.00 0.00 H TER 9961 WAT 70 ATOM 9961 O WAT 71 132.252 126.052 115.444 1.00 0.00 O ATOM 9962 H1 WAT 71 132.228 126.283 114.515 1.00 0.00 H ATOM 9963 H2 WAT 71 131.945 126.838 115.895 1.00 0.00 H TER 9965 WAT 71 ATOM 9965 O WAT 72 71.234 130.718 137.769 1.00 0.00 O ATOM 9966 H1 WAT 72 71.742 131.031 137.020 1.00 0.00 H ATOM 9967 H2 WAT 72 71.586 129.846 137.949 1.00 0.00 H TER 9969 WAT 72 ATOM 9969 O WAT 73 22.108 30.120 132.498 1.00 0.00 O ATOM 9970 H1 WAT 73 22.061 29.387 131.883 1.00 0.00 H ATOM 9971 H2 WAT 73 21.210 30.449 132.546 1.00 0.00 H TER 9973 WAT 73 ATOM 9973 O WAT 74 5.593 14.463 140.825 1.00 0.00 O ATOM 9974 H1 WAT 74 5.079 13.715 140.520 1.00 0.00 H ATOM 9975 H2 WAT 74 4.940 15.128 141.044 1.00 0.00 H TER 9977 WAT 74 ATOM 9977 O WAT 75 63.404 17.921 54.027 1.00 0.00 O ATOM 9978 H1 WAT 75 62.952 18.745 53.844 1.00 0.00 H ATOM 9979 H2 WAT 75 63.518 17.514 53.168 1.00 0.00 H TER 9981 WAT 75 ATOM 9981 O WAT 76 6.082 124.437 148.520 1.00 0.00 O ATOM 9982 H1 WAT 76 6.772 125.101 148.542 1.00 0.00 H ATOM 9983 H2 WAT 76 5.576 124.591 149.318 1.00 0.00 H TER 9985 WAT 76 ATOM 9985 O WAT 77 76.102 68.204 131.981 1.00 0.00 O ATOM 9986 H1 WAT 77 75.414 68.763 131.619 1.00 0.00 H ATOM 9987 H2 WAT 77 76.919 68.622 131.709 1.00 0.00 H TER 9989 WAT 77 ATOM 9989 O WAT 78 75.965 45.400 106.317 1.00 0.00 O ATOM 9990 H1 WAT 78 75.785 46.251 105.918 1.00 0.00 H ATOM 9991 H2 WAT 78 76.866 45.202 106.063 1.00 0.00 H TER 9993 WAT 78 ATOM 9993 O WAT 79 35.767 4.612 136.068 1.00 0.00 O ATOM 9994 H1 WAT 79 36.246 4.151 135.380 1.00 0.00 H ATOM 9995 H2 WAT 79 36.427 4.797 136.736 1.00 0.00 H TER 9997 WAT 79 ATOM 9997 O WAT 80 51.792 114.772 88.537 1.00 0.00 O ATOM 9998 H1 WAT 80 51.099 114.492 87.940 1.00 0.00 H ATOM 9999 H2 WAT 80 51.632 114.275 89.340 1.00 0.00 H TER 10001 WAT 80 ATOM 10001 O WAT 81 106.055 113.299 65.977 1.00 0.00 O ATOM 10002 H1 WAT 81 105.688 112.420 66.066 1.00 0.00 H ATOM 10003 H2 WAT 81 106.991 113.187 66.144 1.00 0.00 H TER 10005 WAT 81 ATOM 10005 O WAT 82 105.820 25.742 69.605 1.00 0.00 O ATOM 10006 H1 WAT 82 106.646 25.391 69.271 1.00 0.00 H ATOM 10007 H2 WAT 82 105.977 26.682 69.691 1.00 0.00 H TER 10009 WAT 82 ATOM 10009 O WAT 83 45.627 137.448 146.166 1.00 0.00 O ATOM 10010 H1 WAT 83 45.113 137.755 145.419 1.00 0.00 H ATOM 10011 H2 WAT 83 46.509 137.781 146.004 1.00 0.00 H TER 10013 WAT 83 ATOM 10013 O WAT 84 134.516 45.633 116.466 1.00 0.00 O ATOM 10014 H1 WAT 84 134.882 45.029 117.112 1.00 0.00 H ATOM 10015 H2 WAT 84 133.589 45.400 116.419 1.00 0.00 H TER 10017 WAT 84 ATOM 10017 O WAT 85 69.102 61.369 112.219 1.00 0.00 O ATOM 10018 H1 WAT 85 69.918 60.899 112.050 1.00 0.00 H ATOM 10019 H2 WAT 85 69.292 61.909 112.987 1.00 0.00 H TER 10021 WAT 85 ATOM 10021 O WAT 86 9.541 116.034 14.339 1.00 0.00 O ATOM 10022 H1 WAT 86 8.812 115.485 14.626 1.00 0.00 H ATOM 10023 H2 WAT 86 9.472 116.046 13.384 1.00 0.00 H TER 10025 WAT 86 ATOM 10025 O WAT 87 56.136 8.667 69.565 1.00 0.00 O ATOM 10026 H1 WAT 87 56.182 9.432 70.138 1.00 0.00 H ATOM 10027 H2 WAT 87 56.866 8.114 69.845 1.00 0.00 H TER 10029 WAT 87 ATOM 10029 O WAT 88 96.610 48.895 135.571 1.00 0.00 O ATOM 10030 H1 WAT 88 96.715 49.089 134.640 1.00 0.00 H ATOM 10031 H2 WAT 88 95.713 48.571 135.649 1.00 0.00 H TER 10033 WAT 88 ATOM 10033 O WAT 89 13.965 76.586 69.609 1.00 0.00 O ATOM 10034 H1 WAT 89 13.450 77.215 70.113 1.00 0.00 H ATOM 10035 H2 WAT 89 14.327 75.991 70.266 1.00 0.00 H TER 10037 WAT 89 ATOM 10037 O WAT 90 104.974 139.875 133.541 1.00 0.00 O ATOM 10038 H1 WAT 90 104.353 140.585 133.702 1.00 0.00 H ATOM 10039 H2 WAT 90 104.988 139.378 134.359 1.00 0.00 H TER 10041 WAT 90 ATOM 10041 O WAT 91 64.864 35.787 134.879 1.00 0.00 O ATOM 10042 H1 WAT 91 64.991 36.632 134.448 1.00 0.00 H ATOM 10043 H2 WAT 91 63.924 35.620 134.805 1.00 0.00 H TER 10045 WAT 91 ATOM 10045 O WAT 92 141.700 68.388 15.100 1.00 0.00 O ATOM 10046 H1 WAT 92 141.248 67.928 14.393 1.00 0.00 H ATOM 10047 H2 WAT 92 141.003 68.637 15.708 1.00 0.00 H TER 10049 WAT 92 ATOM 10049 O WAT 93 52.949 101.075 127.152 1.00 0.00 O ATOM 10050 H1 WAT 93 53.831 101.042 126.783 1.00 0.00 H ATOM 10051 H2 WAT 93 53.081 101.337 128.063 1.00 0.00 H TER 10053 WAT 93 ATOM 10053 O WAT 94 84.852 66.027 25.712 1.00 0.00 O ATOM 10054 H1 WAT 94 85.395 66.672 26.164 1.00 0.00 H ATOM 10055 H2 WAT 94 85.419 65.674 25.027 1.00 0.00 H TER 10057 WAT 94 ATOM 10057 O WAT 95 135.275 6.737 150.484 1.00 0.00 O ATOM 10058 H1 WAT 95 135.348 6.497 149.561 1.00 0.00 H ATOM 10059 H2 WAT 95 134.334 6.802 150.642 1.00 0.00 H TER 10061 WAT 95 ATOM 10061 O WAT 96 134.568 26.594 3.703 1.00 0.00 O ATOM 10062 H1 WAT 96 134.239 25.705 3.573 1.00 0.00 H ATOM 10063 H2 WAT 96 135.440 26.475 4.078 1.00 0.00 H TER 10065 WAT 96 ATOM 10065 O WAT 97 89.111 49.141 27.283 1.00 0.00 O ATOM 10066 H1 WAT 97 89.162 50.096 27.329 1.00 0.00 H ATOM 10067 H2 WAT 97 88.342 48.968 26.740 1.00 0.00 H TER 10069 WAT 97 ATOM 10069 O WAT 98 32.955 99.030 5.695 1.00 0.00 O ATOM 10070 H1 WAT 98 32.626 99.159 6.585 1.00 0.00 H ATOM 10071 H2 WAT 98 33.777 98.554 5.810 1.00 0.00 H TER 10073 WAT 98 ATOM 10073 O WAT 99 7.206 40.189 147.869 1.00 0.00 O ATOM 10074 H1 WAT 99 7.579 39.530 147.283 1.00 0.00 H ATOM 10075 H2 WAT 99 6.345 39.842 148.101 1.00 0.00 H TER 10077 WAT 99 ATOM 10077 O WAT 100 11.726 108.358 156.440 1.00 0.00 O ATOM 10078 H1 WAT 100 12.018 108.461 155.534 1.00 0.00 H ATOM 10079 H2 WAT 100 11.725 109.247 156.794 1.00 0.00 H TER 10081 WAT 100 ATOM 10081 O WAT 101 37.222 52.632 10.335 1.00 0.00 O ATOM 10082 H1 WAT 101 37.755 52.156 10.972 1.00 0.00 H ATOM 10083 H2 WAT 101 37.817 52.803 9.605 1.00 0.00 H TER 10085 WAT 101 ATOM 10085 O WAT 102 131.997 44.659 3.773 1.00 0.00 O ATOM 10086 H1 WAT 102 132.472 44.426 2.976 1.00 0.00 H ATOM 10087 H2 WAT 102 132.312 44.037 4.430 1.00 0.00 H TER 10089 WAT 102 ATOM 10089 O WAT 103 71.991 88.024 78.999 1.00 0.00 O ATOM 10090 H1 WAT 103 71.126 87.674 79.213 1.00 0.00 H ATOM 10091 H2 WAT 103 71.817 88.733 78.381 1.00 0.00 H TER 10093 WAT 103 ATOM 10093 O WAT 104 3.503 107.058 7.607 1.00 0.00 O ATOM 10094 H1 WAT 104 2.786 106.738 7.060 1.00 0.00 H ATOM 10095 H2 WAT 104 3.322 107.991 7.718 1.00 0.00 H TER 10097 WAT 104 ATOM 10097 O WAT 105 79.174 136.342 92.165 1.00 0.00 O ATOM 10098 H1 WAT 105 78.756 136.251 93.021 1.00 0.00 H ATOM 10099 H2 WAT 105 79.422 135.449 91.923 1.00 0.00 H TER 10101 WAT 105 ATOM 10101 O WAT 106 37.872 128.316 17.897 1.00 0.00 O ATOM 10102 H1 WAT 106 38.361 129.098 17.641 1.00 0.00 H ATOM 10103 H2 WAT 106 36.990 128.464 17.556 1.00 0.00 H TER 10105 WAT 106 ATOM 10105 O WAT 107 67.230 39.193 131.978 1.00 0.00 O ATOM 10106 H1 WAT 107 67.798 39.723 131.419 1.00 0.00 H ATOM 10107 H2 WAT 107 67.767 38.996 132.746 1.00 0.00 H TER 10109 WAT 107 ATOM 10109 O WAT 108 22.515 93.590 29.110 1.00 0.00 O ATOM 10110 H1 WAT 108 23.000 92.788 29.304 1.00 0.00 H ATOM 10111 H2 WAT 108 21.882 93.332 28.440 1.00 0.00 H TER 10113 WAT 108 ATOM 10113 O WAT 109 124.816 123.511 115.441 1.00 0.00 O ATOM 10114 H1 WAT 109 124.789 123.348 116.383 1.00 0.00 H ATOM 10115 H2 WAT 109 124.200 124.230 115.304 1.00 0.00 H TER 10117 WAT 109 ATOM 10117 O WAT 110 32.358 7.975 60.992 1.00 0.00 O ATOM 10118 H1 WAT 110 31.552 8.037 60.479 1.00 0.00 H ATOM 10119 H2 WAT 110 33.010 8.444 60.471 1.00 0.00 H TER 10121 WAT 110 ATOM 10121 O WAT 111 91.400 18.683 3.844 1.00 0.00 O ATOM 10122 H1 WAT 111 91.775 18.775 4.719 1.00 0.00 H ATOM 10123 H2 WAT 111 90.508 18.369 3.997 1.00 0.00 H TER 10125 WAT 111 ATOM 10125 O WAT 112 127.779 50.219 108.634 1.00 0.00 O ATOM 10126 H1 WAT 112 128.324 50.647 109.295 1.00 0.00 H ATOM 10127 H2 WAT 112 127.791 50.819 107.889 1.00 0.00 H TER 10129 WAT 112 ATOM 10129 O WAT 113 93.231 61.113 90.269 1.00 0.00 O ATOM 10130 H1 WAT 113 92.769 60.277 90.327 1.00 0.00 H ATOM 10131 H2 WAT 113 93.863 60.989 89.560 1.00 0.00 H TER 10133 WAT 113 ATOM 10133 O WAT 114 136.004 80.104 94.075 1.00 0.00 O ATOM 10134 H1 WAT 114 136.752 79.820 93.550 1.00 0.00 H ATOM 10135 H2 WAT 114 135.336 80.343 93.432 1.00 0.00 H TER 10137 WAT 114 ATOM 10137 O WAT 115 28.176 101.650 110.229 1.00 0.00 O ATOM 10138 H1 WAT 115 29.081 101.787 109.950 1.00 0.00 H ATOM 10139 H2 WAT 115 28.125 102.065 111.090 1.00 0.00 H TER 10141 WAT 115 ATOM 10141 O WAT 116 80.687 22.371 0.172 1.00 0.00 O ATOM 10142 H1 WAT 116 79.825 22.763 0.309 1.00 0.00 H ATOM 10143 H2 WAT 116 80.620 21.500 0.563 1.00 0.00 H TER 10145 WAT 116 ATOM 10145 O WAT 117 135.182 112.617 87.546 1.00 0.00 O ATOM 10146 H1 WAT 117 135.803 111.892 87.625 1.00 0.00 H ATOM 10147 H2 WAT 117 135.732 113.394 87.452 1.00 0.00 H TER 10149 WAT 117 ATOM 10149 O WAT 118 132.803 72.287 119.749 1.00 0.00 O ATOM 10150 H1 WAT 118 133.604 72.787 119.590 1.00 0.00 H ATOM 10151 H2 WAT 118 132.497 72.590 120.604 1.00 0.00 H TER 10153 WAT 118 ATOM 10153 O WAT 119 91.508 96.213 5.523 1.00 0.00 O ATOM 10154 H1 WAT 119 92.432 95.969 5.582 1.00 0.00 H ATOM 10155 H2 WAT 119 91.221 95.864 4.679 1.00 0.00 H TER 10157 WAT 119 ATOM 10157 O WAT 120 67.500 43.532 60.899 1.00 0.00 O ATOM 10158 H1 WAT 120 66.867 43.915 61.507 1.00 0.00 H ATOM 10159 H2 WAT 120 67.224 43.843 60.037 1.00 0.00 H TER 10161 WAT 120 ATOM 10161 O WAT 121 10.564 108.050 12.029 1.00 0.00 O ATOM 10162 H1 WAT 121 10.925 107.166 11.955 1.00 0.00 H ATOM 10163 H2 WAT 121 11.305 108.627 11.843 1.00 0.00 H TER 10165 WAT 121 ATOM 10165 O WAT 122 21.214 25.192 145.394 1.00 0.00 O ATOM 10166 H1 WAT 122 21.203 24.625 144.623 1.00 0.00 H ATOM 10167 H2 WAT 122 20.755 24.690 146.067 1.00 0.00 H TER 10169 WAT 122 ATOM 10169 O WAT 123 27.768 56.963 72.689 1.00 0.00 O ATOM 10170 H1 WAT 123 28.425 56.323 72.416 1.00 0.00 H ATOM 10171 H2 WAT 123 27.099 56.444 73.136 1.00 0.00 H TER 10173 WAT 123 ATOM 10173 O WAT 124 33.353 8.163 123.305 1.00 0.00 O ATOM 10174 H1 WAT 124 33.193 8.278 122.369 1.00 0.00 H ATOM 10175 H2 WAT 124 32.480 8.060 123.686 1.00 0.00 H TER 10177 WAT 124 ATOM 10177 O WAT 125 133.403 57.870 27.967 1.00 0.00 O ATOM 10178 H1 WAT 125 134.282 57.872 28.348 1.00 0.00 H ATOM 10179 H2 WAT 125 133.283 56.976 27.646 1.00 0.00 H TER 10181 WAT 125 ATOM 10181 O WAT 126 72.449 2.938 142.331 1.00 0.00 O ATOM 10182 H1 WAT 126 72.150 3.822 142.116 1.00 0.00 H ATOM 10183 H2 WAT 126 72.317 2.864 143.276 1.00 0.00 H TER 10185 WAT 126 ATOM 10185 O WAT 127 0.422 130.845 81.628 1.00 0.00 O ATOM 10186 H1 WAT 127 -0.421 131.137 81.281 1.00 0.00 H ATOM 10187 H2 WAT 127 0.328 130.918 82.578 1.00 0.00 H TER 10189 WAT 127 ATOM 10189 O WAT 128 63.747 12.036 14.297 1.00 0.00 O ATOM 10190 H1 WAT 128 64.290 12.809 14.450 1.00 0.00 H ATOM 10191 H2 WAT 128 63.194 12.275 13.554 1.00 0.00 H TER 10193 WAT 128 ATOM 10193 O WAT 129 82.707 97.406 6.873 1.00 0.00 O ATOM 10194 H1 WAT 129 83.405 97.295 6.228 1.00 0.00 H ATOM 10195 H2 WAT 129 81.965 96.923 6.508 1.00 0.00 H TER 10197 WAT 129 ATOM 10197 O WAT 130 110.033 144.183 11.586 1.00 0.00 O ATOM 10198 H1 WAT 130 109.846 145.013 11.148 1.00 0.00 H ATOM 10199 H2 WAT 130 109.533 144.224 12.401 1.00 0.00 H TER 10201 WAT 130 ATOM 10201 O WAT 131 57.312 124.615 94.812 1.00 0.00 O ATOM 10202 H1 WAT 131 58.192 124.943 94.997 1.00 0.00 H ATOM 10203 H2 WAT 131 57.372 124.254 93.928 1.00 0.00 H TER 10205 WAT 131 ATOM 10205 O WAT 132 51.144 68.668 85.939 1.00 0.00 O ATOM 10206 H1 WAT 132 51.993 69.056 86.148 1.00 0.00 H ATOM 10207 H2 WAT 132 50.967 68.949 85.042 1.00 0.00 H TER 10209 WAT 132 ATOM 10209 O WAT 133 66.753 92.459 141.458 1.00 0.00 O ATOM 10210 H1 WAT 133 66.324 92.651 140.624 1.00 0.00 H ATOM 10211 H2 WAT 133 66.749 93.294 141.926 1.00 0.00 H TER 10213 WAT 133 ATOM 10213 O WAT 134 61.360 92.903 56.829 1.00 0.00 O ATOM 10214 H1 WAT 134 61.930 93.224 57.528 1.00 0.00 H ATOM 10215 H2 WAT 134 61.687 93.332 56.038 1.00 0.00 H TER 10217 WAT 134 ATOM 10217 O WAT 135 76.046 16.852 77.027 1.00 0.00 O ATOM 10218 H1 WAT 135 75.896 16.142 76.403 1.00 0.00 H ATOM 10219 H2 WAT 135 75.210 16.952 77.481 1.00 0.00 H TER 10221 WAT 135 ATOM 10221 O WAT 136 83.350 17.206 17.896 1.00 0.00 O ATOM 10222 H1 WAT 136 83.187 16.851 18.770 1.00 0.00 H ATOM 10223 H2 WAT 136 84.077 17.817 18.017 1.00 0.00 H TER 10225 WAT 136 ATOM 10225 O WAT 137 98.525 94.535 148.948 1.00 0.00 O ATOM 10226 H1 WAT 137 98.596 94.924 148.076 1.00 0.00 H ATOM 10227 H2 WAT 137 98.377 93.604 148.783 1.00 0.00 H TER 10229 WAT 137 ATOM 10229 O WAT 138 109.084 141.597 135.570 1.00 0.00 O ATOM 10230 H1 WAT 138 108.634 140.915 135.072 1.00 0.00 H ATOM 10231 H2 WAT 138 109.174 141.231 136.450 1.00 0.00 H TER 10233 WAT 138 ATOM 10233 O WAT 139 143.436 113.967 132.432 1.00 0.00 O ATOM 10234 H1 WAT 139 143.471 114.908 132.607 1.00 0.00 H ATOM 10235 H2 WAT 139 142.575 113.828 132.039 1.00 0.00 H TER 10237 WAT 139 ATOM 10237 O WAT 140 10.398 66.560 114.098 1.00 0.00 O ATOM 10238 H1 WAT 140 10.057 67.168 114.754 1.00 0.00 H ATOM 10239 H2 WAT 140 9.936 66.794 113.293 1.00 0.00 H TER 10241 WAT 140 ATOM 10241 O WAT 141 22.504 100.358 3.310 1.00 0.00 O ATOM 10242 H1 WAT 141 22.423 99.407 3.385 1.00 0.00 H ATOM 10243 H2 WAT 141 22.751 100.506 2.397 1.00 0.00 H TER 10245 WAT 141 ATOM 10245 O WAT 142 85.317 107.151 96.346 1.00 0.00 O ATOM 10246 H1 WAT 142 86.248 106.932 96.378 1.00 0.00 H ATOM 10247 H2 WAT 142 85.103 107.155 95.413 1.00 0.00 H TER 10249 WAT 142 ATOM 10249 O WAT 143 106.263 13.512 5.692 1.00 0.00 O ATOM 10250 H1 WAT 143 106.363 13.679 6.629 1.00 0.00 H ATOM 10251 H2 WAT 143 105.325 13.361 5.574 1.00 0.00 H TER 10253 WAT 143 ATOM 10253 O WAT 144 104.958 26.445 158.211 1.00 0.00 O ATOM 10254 H1 WAT 144 104.270 26.222 158.838 1.00 0.00 H ATOM 10255 H2 WAT 144 105.717 26.659 158.754 1.00 0.00 H TER 10257 WAT 144 ATOM 10257 O WAT 145 121.353 99.168 66.454 1.00 0.00 O ATOM 10258 H1 WAT 145 122.046 98.690 65.998 1.00 0.00 H ATOM 10259 H2 WAT 145 121.108 99.868 65.849 1.00 0.00 H TER 10261 WAT 145 ATOM 10261 O WAT 146 142.454 69.250 146.285 1.00 0.00 O ATOM 10262 H1 WAT 146 141.606 69.324 145.848 1.00 0.00 H ATOM 10263 H2 WAT 146 142.799 70.143 146.292 1.00 0.00 H TER 10265 WAT 146 ATOM 10265 O WAT 147 12.676 135.137 134.538 1.00 0.00 O ATOM 10266 H1 WAT 147 12.116 135.182 133.764 1.00 0.00 H ATOM 10267 H2 WAT 147 13.560 135.022 134.189 1.00 0.00 H TER 10269 WAT 147 ATOM 10269 O WAT 148 96.955 72.023 88.364 1.00 0.00 O ATOM 10270 H1 WAT 148 97.367 71.356 88.913 1.00 0.00 H ATOM 10271 H2 WAT 148 96.483 72.582 88.981 1.00 0.00 H TER 10273 WAT 148 ATOM 10273 O WAT 149 91.304 120.050 148.943 1.00 0.00 O ATOM 10274 H1 WAT 149 91.250 119.102 149.065 1.00 0.00 H ATOM 10275 H2 WAT 149 90.479 120.284 148.519 1.00 0.00 H TER 10277 WAT 149 ATOM 10277 O WAT 150 106.202 69.765 69.557 1.00 0.00 O ATOM 10278 H1 WAT 150 105.339 70.160 69.675 1.00 0.00 H ATOM 10279 H2 WAT 150 106.410 69.914 68.635 1.00 0.00 H TER 10281 WAT 150 ATOM 10281 O WAT 151 140.335 115.367 21.703 1.00 0.00 O ATOM 10282 H1 WAT 151 139.996 114.474 21.762 1.00 0.00 H ATOM 10283 H2 WAT 151 139.811 115.864 22.331 1.00 0.00 H TER 10285 WAT 151 ATOM 10285 O WAT 152 29.395 111.131 21.776 1.00 0.00 O ATOM 10286 H1 WAT 152 29.985 110.437 22.068 1.00 0.00 H ATOM 10287 H2 WAT 152 29.889 111.939 21.915 1.00 0.00 H TER 10289 WAT 152 ATOM 10289 O WAT 153 79.801 38.702 0.678 1.00 0.00 O ATOM 10290 H1 WAT 153 80.477 39.337 0.442 1.00 0.00 H ATOM 10291 H2 WAT 153 80.169 38.226 1.423 1.00 0.00 H TER 10293 WAT 153 ATOM 10293 O WAT 154 51.367 144.404 12.102 1.00 0.00 O ATOM 10294 H1 WAT 154 51.608 145.045 11.433 1.00 0.00 H ATOM 10295 H2 WAT 154 51.054 144.932 12.837 1.00 0.00 H TER 10297 WAT 154 ATOM 10297 O WAT 155 135.848 61.778 7.389 1.00 0.00 O ATOM 10298 H1 WAT 155 135.206 62.441 7.641 1.00 0.00 H ATOM 10299 H2 WAT 155 136.661 62.267 7.264 1.00 0.00 H TER 10301 WAT 155 ATOM 10301 O WAT 156 124.012 36.642 77.883 1.00 0.00 O ATOM 10302 H1 WAT 156 124.872 36.273 77.684 1.00 0.00 H ATOM 10303 H2 WAT 156 123.665 36.912 77.033 1.00 0.00 H TER 10305 WAT 156 ATOM 10305 O WAT 157 120.135 86.639 104.235 1.00 0.00 O ATOM 10306 H1 WAT 157 119.883 86.905 103.351 1.00 0.00 H ATOM 10307 H2 WAT 157 121.092 86.627 104.218 1.00 0.00 H TER 10309 WAT 157 ATOM 10309 O WAT 158 67.088 48.473 79.854 1.00 0.00 O ATOM 10310 H1 WAT 158 66.394 47.825 79.730 1.00 0.00 H ATOM 10311 H2 WAT 158 67.131 48.599 80.802 1.00 0.00 H TER 10313 WAT 158 ATOM 10313 O WAT 159 62.861 58.417 99.716 1.00 0.00 O ATOM 10314 H1 WAT 159 63.044 59.009 98.986 1.00 0.00 H ATOM 10315 H2 WAT 159 62.207 58.878 100.240 1.00 0.00 H TER 10317 WAT 159 ATOM 10317 O WAT 160 92.452 21.537 4.512 1.00 0.00 O ATOM 10318 H1 WAT 160 92.763 21.001 3.783 1.00 0.00 H ATOM 10319 H2 WAT 160 91.986 20.923 5.080 1.00 0.00 H TER 10321 WAT 160 ATOM 10321 O WAT 161 68.279 134.092 153.447 1.00 0.00 O ATOM 10322 H1 WAT 161 67.380 133.837 153.241 1.00 0.00 H ATOM 10323 H2 WAT 161 68.323 135.020 153.219 1.00 0.00 H TER 10325 WAT 161 ATOM 10325 O WAT 162 26.541 132.132 150.004 1.00 0.00 O ATOM 10326 H1 WAT 162 26.819 131.397 150.551 1.00 0.00 H ATOM 10327 H2 WAT 162 25.745 132.457 150.426 1.00 0.00 H TER 10329 WAT 162 ATOM 10329 O WAT 163 102.437 48.384 15.037 1.00 0.00 O ATOM 10330 H1 WAT 163 102.688 48.205 15.943 1.00 0.00 H ATOM 10331 H2 WAT 163 103.018 49.093 14.763 1.00 0.00 H TER 10333 WAT 163 ATOM 10333 O WAT 164 5.237 70.593 64.344 1.00 0.00 O ATOM 10334 H1 WAT 164 4.662 69.880 64.623 1.00 0.00 H ATOM 10335 H2 WAT 164 5.046 70.704 63.412 1.00 0.00 H TER 10337 WAT 164 ATOM 10337 O WAT 165 19.635 87.893 11.595 1.00 0.00 O ATOM 10338 H1 WAT 165 19.735 88.764 11.210 1.00 0.00 H ATOM 10339 H2 WAT 165 20.329 87.841 12.252 1.00 0.00 H TER 10341 WAT 165 ATOM 10341 O WAT 166 21.410 83.694 65.298 1.00 0.00 O ATOM 10342 H1 WAT 166 21.603 83.582 64.367 1.00 0.00 H ATOM 10343 H2 WAT 166 21.731 82.891 65.708 1.00 0.00 H TER 10345 WAT 166 ATOM 10345 O WAT 167 125.167 24.634 145.430 1.00 0.00 O ATOM 10346 H1 WAT 167 126.096 24.405 145.456 1.00 0.00 H ATOM 10347 H2 WAT 167 124.712 23.793 145.486 1.00 0.00 H TER 10349 WAT 167 ATOM 10349 O WAT 168 81.910 26.102 126.355 1.00 0.00 O ATOM 10350 H1 WAT 168 81.956 25.834 125.437 1.00 0.00 H ATOM 10351 H2 WAT 168 82.278 25.363 126.839 1.00 0.00 H TER 10353 WAT 168 ATOM 10353 O WAT 169 86.749 117.003 116.696 1.00 0.00 O ATOM 10354 H1 WAT 169 87.198 117.683 116.193 1.00 0.00 H ATOM 10355 H2 WAT 169 86.490 116.354 116.042 1.00 0.00 H TER 10357 WAT 169 ATOM 10357 O WAT 170 135.605 49.718 81.231 1.00 0.00 O ATOM 10358 H1 WAT 170 135.104 49.081 81.741 1.00 0.00 H ATOM 10359 H2 WAT 170 135.667 49.331 80.358 1.00 0.00 H TER 10361 WAT 170 ATOM 10361 O WAT 171 125.798 25.489 93.013 1.00 0.00 O ATOM 10362 H1 WAT 171 124.993 25.788 93.437 1.00 0.00 H ATOM 10363 H2 WAT 171 125.666 25.683 92.085 1.00 0.00 H TER 10365 WAT 171 ATOM 10365 O WAT 172 15.346 78.343 72.193 1.00 0.00 O ATOM 10366 H1 WAT 172 16.098 78.664 71.695 1.00 0.00 H ATOM 10367 H2 WAT 172 15.732 77.900 72.949 1.00 0.00 H TER 10369 WAT 172 ATOM 10369 O WAT 173 107.649 3.485 125.947 1.00 0.00 O ATOM 10370 H1 WAT 173 108.216 2.769 125.661 1.00 0.00 H ATOM 10371 H2 WAT 173 107.810 4.185 125.315 1.00 0.00 H TER 10373 WAT 173 ATOM 10373 O WAT 174 57.032 23.049 119.626 1.00 0.00 O ATOM 10374 H1 WAT 174 56.076 23.032 119.576 1.00 0.00 H ATOM 10375 H2 WAT 174 57.221 23.177 120.555 1.00 0.00 H TER 10377 WAT 174 ATOM 10377 O WAT 175 68.739 142.710 130.523 1.00 0.00 O ATOM 10378 H1 WAT 175 68.068 143.321 130.218 1.00 0.00 H ATOM 10379 H2 WAT 175 69.212 142.459 129.730 1.00 0.00 H TER 10381 WAT 175 ATOM 10381 O WAT 176 122.266 30.182 68.289 1.00 0.00 O ATOM 10382 H1 WAT 176 122.375 31.090 68.571 1.00 0.00 H ATOM 10383 H2 WAT 176 121.920 29.732 69.060 1.00 0.00 H TER 10385 WAT 176 ATOM 10385 O WAT 177 70.030 34.079 18.578 1.00 0.00 O ATOM 10386 H1 WAT 177 70.327 33.364 18.015 1.00 0.00 H ATOM 10387 H2 WAT 177 70.825 34.573 18.777 1.00 0.00 H TER 10389 WAT 177 ATOM 10389 O WAT 178 81.721 3.326 8.756 1.00 0.00 O ATOM 10390 H1 WAT 178 81.095 3.887 9.214 1.00 0.00 H ATOM 10391 H2 WAT 178 82.364 3.934 8.392 1.00 0.00 H TER 10393 WAT 178 ATOM 10393 O WAT 179 29.189 94.930 156.198 1.00 0.00 O ATOM 10394 H1 WAT 179 28.270 94.721 156.031 1.00 0.00 H ATOM 10395 H2 WAT 179 29.669 94.462 155.515 1.00 0.00 H TER 10397 WAT 179 ATOM 10397 O WAT 180 110.585 73.231 5.969 1.00 0.00 O ATOM 10398 H1 WAT 180 110.420 74.105 6.323 1.00 0.00 H ATOM 10399 H2 WAT 180 109.773 72.998 5.519 1.00 0.00 H TER 10401 WAT 180 ATOM 10401 O WAT 181 89.545 135.824 125.361 1.00 0.00 O ATOM 10402 H1 WAT 181 89.724 136.583 124.806 1.00 0.00 H ATOM 10403 H2 WAT 181 88.638 135.592 125.164 1.00 0.00 H TER 10405 WAT 181 ATOM 10405 O WAT 182 77.759 89.440 117.323 1.00 0.00 O ATOM 10406 H1 WAT 182 77.380 89.233 116.468 1.00 0.00 H ATOM 10407 H2 WAT 182 77.009 89.467 117.917 1.00 0.00 H TER 10409 WAT 182 ATOM 10409 O WAT 183 5.777 8.294 146.576 1.00 0.00 O ATOM 10410 H1 WAT 183 5.749 8.875 147.337 1.00 0.00 H ATOM 10411 H2 WAT 183 5.266 7.529 146.841 1.00 0.00 H TER 10413 WAT 183 ATOM 10413 O WAT 184 71.944 22.850 110.179 1.00 0.00 O ATOM 10414 H1 WAT 184 71.920 23.745 110.519 1.00 0.00 H ATOM 10415 H2 WAT 184 71.028 22.574 110.165 1.00 0.00 H TER 10417 WAT 184 ATOM 10417 O WAT 185 108.750 116.551 98.111 1.00 0.00 O ATOM 10418 H1 WAT 185 109.296 115.924 98.585 1.00 0.00 H ATOM 10419 H2 WAT 185 108.470 116.079 97.326 1.00 0.00 H TER 10421 WAT 185 ATOM 10421 O WAT 186 111.093 69.835 144.894 1.00 0.00 O ATOM 10422 H1 WAT 186 111.213 68.887 144.946 1.00 0.00 H ATOM 10423 H2 WAT 186 111.921 70.162 144.544 1.00 0.00 H TER 10425 WAT 186 ATOM 10425 O WAT 187 145.176 91.123 117.947 1.00 0.00 O ATOM 10426 H1 WAT 187 145.577 91.914 117.587 1.00 0.00 H ATOM 10427 H2 WAT 187 144.237 91.308 117.944 1.00 0.00 H TER 10429 WAT 187 ATOM 10429 O WAT 188 135.380 92.771 129.296 1.00 0.00 O ATOM 10430 H1 WAT 188 136.161 92.496 128.816 1.00 0.00 H ATOM 10431 H2 WAT 188 135.586 93.654 129.603 1.00 0.00 H TER 10433 WAT 188 ATOM 10433 O WAT 189 45.948 118.487 53.970 1.00 0.00 O ATOM 10434 H1 WAT 189 46.878 118.669 53.834 1.00 0.00 H ATOM 10435 H2 WAT 189 45.819 117.613 53.601 1.00 0.00 H TER 10437 WAT 189 ATOM 10437 O WAT 190 42.674 127.049 107.572 1.00 0.00 O ATOM 10438 H1 WAT 190 42.666 128.004 107.501 1.00 0.00 H ATOM 10439 H2 WAT 190 42.735 126.880 108.512 1.00 0.00 H TER 10441 WAT 190 ATOM 10441 O WAT 191 118.767 117.557 132.095 1.00 0.00 O ATOM 10442 H1 WAT 191 118.827 117.915 132.981 1.00 0.00 H ATOM 10443 H2 WAT 191 117.971 117.024 132.106 1.00 0.00 H TER 10445 WAT 191 ATOM 10445 O WAT 192 121.871 73.499 142.543 1.00 0.00 O ATOM 10446 H1 WAT 192 121.334 73.900 143.226 1.00 0.00 H ATOM 10447 H2 WAT 192 122.754 73.482 142.911 1.00 0.00 H TER 10449 WAT 192 ATOM 10449 O WAT 193 24.422 28.908 72.551 1.00 0.00 O ATOM 10450 H1 WAT 193 24.467 29.342 71.699 1.00 0.00 H ATOM 10451 H2 WAT 193 24.216 29.611 73.167 1.00 0.00 H TER 10453 WAT 193 ATOM 10453 O WAT 194 121.827 124.517 120.749 1.00 0.00 O ATOM 10454 H1 WAT 194 122.378 125.235 120.437 1.00 0.00 H ATOM 10455 H2 WAT 194 121.897 124.558 121.702 1.00 0.00 H TER 10457 WAT 194 ATOM 10457 O WAT 195 17.296 90.695 117.779 1.00 0.00 O ATOM 10458 H1 WAT 195 16.423 91.084 117.837 1.00 0.00 H ATOM 10459 H2 WAT 195 17.868 91.325 118.217 1.00 0.00 H TER 10461 WAT 195 ATOM 10461 O WAT 196 134.054 82.503 4.621 1.00 0.00 O ATOM 10462 H1 WAT 196 133.882 82.177 5.505 1.00 0.00 H ATOM 10463 H2 WAT 196 134.105 81.715 4.080 1.00 0.00 H TER 10465 WAT 196 ATOM 10465 O WAT 197 65.787 102.096 153.446 1.00 0.00 O ATOM 10466 H1 WAT 197 65.924 102.806 152.820 1.00 0.00 H ATOM 10467 H2 WAT 197 65.840 102.518 154.303 1.00 0.00 H TER 10469 WAT 197 ATOM 10469 O WAT 198 141.867 143.349 73.595 1.00 0.00 O ATOM 10470 H1 WAT 198 142.699 142.908 73.421 1.00 0.00 H ATOM 10471 H2 WAT 198 141.344 142.698 74.063 1.00 0.00 H TER 10473 WAT 198 ATOM 10473 O WAT 199 25.295 50.570 100.425 1.00 0.00 O ATOM 10474 H1 WAT 199 24.790 49.783 100.222 1.00 0.00 H ATOM 10475 H2 WAT 199 24.792 51.007 101.111 1.00 0.00 H TER 10477 WAT 199 ATOM 10477 O WAT 200 49.977 66.976 112.949 1.00 0.00 O ATOM 10478 H1 WAT 200 50.507 66.827 113.732 1.00 0.00 H ATOM 10479 H2 WAT 200 49.837 67.923 112.931 1.00 0.00 H TER 10481 WAT 200 ATOM 10481 O WAT 201 87.155 7.740 137.781 1.00 0.00 O ATOM 10482 H1 WAT 201 87.667 7.159 137.218 1.00 0.00 H ATOM 10483 H2 WAT 201 87.593 7.700 138.630 1.00 0.00 H TER 10485 WAT 201 ATOM 10485 O WAT 202 130.155 64.063 71.560 1.00 0.00 O ATOM 10486 H1 WAT 202 129.391 63.619 71.192 1.00 0.00 H ATOM 10487 H2 WAT 202 130.503 64.581 70.835 1.00 0.00 H TER 10489 WAT 202 ATOM 10489 O WAT 203 28.839 25.893 137.415 1.00 0.00 O ATOM 10490 H1 WAT 203 28.070 25.637 137.924 1.00 0.00 H ATOM 10491 H2 WAT 203 29.434 26.280 138.057 1.00 0.00 H TER 10493 WAT 203 ATOM 10493 O WAT 204 16.162 101.785 127.337 1.00 0.00 O ATOM 10494 H1 WAT 204 16.419 102.572 126.856 1.00 0.00 H ATOM 10495 H2 WAT 204 16.805 101.125 127.077 1.00 0.00 H TER 10497 WAT 204 ATOM 10497 O WAT 205 142.920 62.200 89.917 1.00 0.00 O ATOM 10498 H1 WAT 205 143.230 62.378 90.805 1.00 0.00 H ATOM 10499 H2 WAT 205 142.110 61.706 90.041 1.00 0.00 H TER 10501 WAT 205 ATOM 10501 O WAT 206 43.243 16.620 98.987 1.00 0.00 O ATOM 10502 H1 WAT 206 44.029 16.413 98.481 1.00 0.00 H ATOM 10503 H2 WAT 206 43.369 17.528 99.262 1.00 0.00 H TER 10505 WAT 206 ATOM 10505 O WAT 207 34.216 49.336 151.412 1.00 0.00 O ATOM 10506 H1 WAT 207 33.459 49.119 150.867 1.00 0.00 H ATOM 10507 H2 WAT 207 34.096 50.259 151.633 1.00 0.00 H TER 10509 WAT 207 ATOM 10509 O WAT 208 121.970 78.665 92.008 1.00 0.00 O ATOM 10510 H1 WAT 208 121.390 78.275 91.354 1.00 0.00 H ATOM 10511 H2 WAT 208 121.387 78.912 92.727 1.00 0.00 H TER 10513 WAT 208 ATOM 10513 O WAT 209 90.617 63.888 141.890 1.00 0.00 O ATOM 10514 H1 WAT 209 90.885 62.972 141.814 1.00 0.00 H ATOM 10515 H2 WAT 209 91.314 64.378 141.454 1.00 0.00 H TER 10517 WAT 209 ATOM 10517 O WAT 210 60.038 74.959 137.826 1.00 0.00 O ATOM 10518 H1 WAT 210 60.660 74.839 138.543 1.00 0.00 H ATOM 10519 H2 WAT 210 59.975 75.908 137.718 1.00 0.00 H TER 10521 WAT 210 ATOM 10521 O WAT 211 109.485 83.306 76.225 1.00 0.00 O ATOM 10522 H1 WAT 211 109.177 82.855 75.439 1.00 0.00 H ATOM 10523 H2 WAT 211 109.449 84.235 75.998 1.00 0.00 H TER 10525 WAT 211 ATOM 10525 O WAT 212 96.951 113.952 105.339 1.00 0.00 O ATOM 10526 H1 WAT 212 96.911 113.079 104.950 1.00 0.00 H ATOM 10527 H2 WAT 212 96.271 113.945 106.013 1.00 0.00 H TER 10529 WAT 212 ATOM 10529 O WAT 213 114.707 108.310 90.816 1.00 0.00 O ATOM 10530 H1 WAT 213 114.944 109.144 90.411 1.00 0.00 H ATOM 10531 H2 WAT 213 114.444 108.542 91.706 1.00 0.00 H TER 10533 WAT 213 ATOM 10533 O WAT 214 101.472 104.944 104.079 1.00 0.00 O ATOM 10534 H1 WAT 214 102.012 104.514 104.742 1.00 0.00 H ATOM 10535 H2 WAT 214 102.019 104.953 103.293 1.00 0.00 H TER 10537 WAT 214 ATOM 10537 O WAT 215 69.613 0.099 108.306 1.00 0.00 O ATOM 10538 H1 WAT 215 68.760 -0.013 108.726 1.00 0.00 H ATOM 10539 H2 WAT 215 70.192 0.384 109.012 1.00 0.00 H TER 10541 WAT 215 ATOM 10541 O WAT 216 130.929 54.429 64.426 1.00 0.00 O ATOM 10542 H1 WAT 216 131.254 55.191 64.906 1.00 0.00 H ATOM 10543 H2 WAT 216 130.014 54.347 64.696 1.00 0.00 H TER 10545 WAT 216 ATOM 10545 O WAT 217 86.118 116.169 76.534 1.00 0.00 O ATOM 10546 H1 WAT 217 87.009 116.464 76.720 1.00 0.00 H ATOM 10547 H2 WAT 217 85.661 116.244 77.372 1.00 0.00 H TER 10549 WAT 217 ATOM 10549 O WAT 218 77.253 142.127 116.267 1.00 0.00 O ATOM 10550 H1 WAT 218 76.582 142.809 116.291 1.00 0.00 H ATOM 10551 H2 WAT 218 77.839 142.341 116.993 1.00 0.00 H TER 10553 WAT 218 ATOM 10553 O WAT 219 102.993 37.673 80.627 1.00 0.00 O ATOM 10554 H1 WAT 219 103.285 38.545 80.891 1.00 0.00 H ATOM 10555 H2 WAT 219 102.387 37.832 79.903 1.00 0.00 H TER 10557 WAT 219 ATOM 10557 O WAT 220 15.365 17.010 13.307 1.00 0.00 O ATOM 10558 H1 WAT 220 14.639 17.070 13.929 1.00 0.00 H ATOM 10559 H2 WAT 220 14.942 16.925 12.453 1.00 0.00 H TER 10561 WAT 220 ATOM 10561 O WAT 221 59.635 96.236 130.336 1.00 0.00 O ATOM 10562 H1 WAT 221 60.519 96.262 129.971 1.00 0.00 H ATOM 10563 H2 WAT 221 59.483 95.312 130.531 1.00 0.00 H TER 10565 WAT 221 ATOM 10565 O WAT 222 21.903 25.071 115.539 1.00 0.00 O ATOM 10566 H1 WAT 222 22.291 24.640 114.777 1.00 0.00 H ATOM 10567 H2 WAT 222 22.638 25.512 115.965 1.00 0.00 H TER 10569 WAT 222 ATOM 10569 O WAT 223 65.198 60.630 96.022 1.00 0.00 O ATOM 10570 H1 WAT 223 65.146 59.826 96.538 1.00 0.00 H ATOM 10571 H2 WAT 223 66.090 60.948 96.164 1.00 0.00 H TER 10573 WAT 223 ATOM 10573 O WAT 224 56.596 141.619 73.153 1.00 0.00 O ATOM 10574 H1 WAT 224 56.637 142.069 72.308 1.00 0.00 H ATOM 10575 H2 WAT 224 57.499 141.621 73.469 1.00 0.00 H TER 10577 WAT 224 ATOM 10577 O WAT 225 72.677 55.703 124.999 1.00 0.00 O ATOM 10578 H1 WAT 225 71.985 55.849 124.353 1.00 0.00 H ATOM 10579 H2 WAT 225 72.889 54.773 124.917 1.00 0.00 H TER 10581 WAT 225 ATOM 10581 O WAT 226 77.223 10.211 143.553 1.00 0.00 O ATOM 10582 H1 WAT 226 76.364 10.090 143.959 1.00 0.00 H ATOM 10583 H2 WAT 226 77.840 10.184 144.285 1.00 0.00 H TER 10585 WAT 226 ATOM 10585 O WAT 227 140.062 66.613 99.320 1.00 0.00 O ATOM 10586 H1 WAT 227 139.470 66.141 98.735 1.00 0.00 H ATOM 10587 H2 WAT 227 140.907 66.596 98.871 1.00 0.00 H TER 10589 WAT 227 ATOM 10589 O WAT 228 112.926 35.399 15.671 1.00 0.00 O ATOM 10590 H1 WAT 228 112.516 36.235 15.891 1.00 0.00 H ATOM 10591 H2 WAT 228 113.640 35.630 15.077 1.00 0.00 H TER 10593 WAT 228 ATOM 10593 O WAT 229 98.760 14.896 115.740 1.00 0.00 O ATOM 10594 H1 WAT 229 99.644 15.083 116.056 1.00 0.00 H ATOM 10595 H2 WAT 229 98.578 15.594 115.111 1.00 0.00 H TER 10597 WAT 229 ATOM 10597 O WAT 230 141.349 37.776 87.530 1.00 0.00 O ATOM 10598 H1 WAT 230 142.242 37.432 87.533 1.00 0.00 H ATOM 10599 H2 WAT 230 141.009 37.568 88.400 1.00 0.00 H TER 10601 WAT 230 ATOM 10601 O WAT 231 45.575 88.399 67.119 1.00 0.00 O ATOM 10602 H1 WAT 231 46.036 89.131 67.529 1.00 0.00 H ATOM 10603 H2 WAT 231 44.801 88.265 67.667 1.00 0.00 H TER 10605 WAT 231 ATOM 10605 O WAT 232 41.737 9.227 151.849 1.00 0.00 O ATOM 10606 H1 WAT 232 42.090 9.853 151.217 1.00 0.00 H ATOM 10607 H2 WAT 232 41.020 8.796 151.385 1.00 0.00 H TER 10609 WAT 232 ATOM 10609 O WAT 233 100.435 1.265 132.723 1.00 0.00 O ATOM 10610 H1 WAT 233 100.307 1.319 131.776 1.00 0.00 H ATOM 10611 H2 WAT 233 99.689 0.753 133.036 1.00 0.00 H TER 10613 WAT 233 ATOM 10613 O WAT 234 133.355 101.293 59.479 1.00 0.00 O ATOM 10614 H1 WAT 234 132.785 100.596 59.154 1.00 0.00 H ATOM 10615 H2 WAT 234 134.055 100.833 59.943 1.00 0.00 H TER 10617 WAT 234 ATOM 10617 O WAT 235 125.722 26.139 90.499 1.00 0.00 O ATOM 10618 H1 WAT 235 125.575 27.076 90.367 1.00 0.00 H ATOM 10619 H2 WAT 235 125.909 25.801 89.623 1.00 0.00 H TER 10621 WAT 235 ATOM 10621 O WAT 236 95.357 94.610 141.065 1.00 0.00 O ATOM 10622 H1 WAT 236 94.784 93.845 141.119 1.00 0.00 H ATOM 10623 H2 WAT 236 94.864 95.241 140.539 1.00 0.00 H TER 10625 WAT 236 ATOM 10625 O WAT 237 44.700 52.637 136.655 1.00 0.00 O ATOM 10626 H1 WAT 237 45.418 52.883 136.071 1.00 0.00 H ATOM 10627 H2 WAT 237 45.088 52.653 137.530 1.00 0.00 H TER 10629 WAT 237 ATOM 10629 O WAT 238 93.152 107.847 134.573 1.00 0.00 O ATOM 10630 H1 WAT 238 92.415 108.059 134.001 1.00 0.00 H ATOM 10631 H2 WAT 238 93.463 106.999 134.259 1.00 0.00 H TER 10633 WAT 238 ATOM 10633 O WAT 239 41.425 88.714 75.612 1.00 0.00 O ATOM 10634 H1 WAT 239 41.826 88.681 76.480 1.00 0.00 H ATOM 10635 H2 WAT 239 40.484 88.659 75.780 1.00 0.00 H TER 10637 WAT 239 ATOM 10637 O WAT 240 28.483 24.356 130.150 1.00 0.00 O ATOM 10638 H1 WAT 240 29.070 23.624 130.342 1.00 0.00 H ATOM 10639 H2 WAT 240 27.610 23.965 130.139 1.00 0.00 H TER 10641 WAT 240 ATOM 10641 O WAT 241 3.281 141.034 149.855 1.00 0.00 O ATOM 10642 H1 WAT 241 2.732 140.776 149.114 1.00 0.00 H ATOM 10643 H2 WAT 241 2.944 140.524 150.591 1.00 0.00 H TER 10645 WAT 241 ATOM 10645 O WAT 242 62.820 32.447 134.945 1.00 0.00 O ATOM 10646 H1 WAT 242 62.292 32.904 135.600 1.00 0.00 H ATOM 10647 H2 WAT 242 62.668 32.933 134.134 1.00 0.00 H TER 10649 WAT 242 ATOM 10649 O WAT 243 97.573 70.142 90.754 1.00 0.00 O ATOM 10650 H1 WAT 243 97.615 70.198 91.709 1.00 0.00 H ATOM 10651 H2 WAT 243 98.217 69.472 90.524 1.00 0.00 H TER 10653 WAT 243 ATOM 10653 O WAT 244 78.511 3.342 107.560 1.00 0.00 O ATOM 10654 H1 WAT 244 78.784 4.124 107.082 1.00 0.00 H ATOM 10655 H2 WAT 244 79.238 3.158 108.155 1.00 0.00 H TER 10657 WAT 244 ATOM 10657 O WAT 245 18.188 141.435 120.222 1.00 0.00 O ATOM 10658 H1 WAT 245 19.145 141.415 120.228 1.00 0.00 H ATOM 10659 H2 WAT 245 17.929 140.620 120.652 1.00 0.00 H TER 10661 WAT 245 ATOM 10661 O WAT 246 1.532 100.377 153.052 1.00 0.00 O ATOM 10662 H1 WAT 246 2.283 100.741 153.519 1.00 0.00 H ATOM 10663 H2 WAT 246 1.745 100.494 152.126 1.00 0.00 H TER 10665 WAT 246 ATOM 10665 O WAT 247 12.913 79.764 56.851 1.00 0.00 O ATOM 10666 H1 WAT 247 12.940 79.202 56.076 1.00 0.00 H ATOM 10667 H2 WAT 247 13.709 80.292 56.792 1.00 0.00 H TER 10669 WAT 247 ATOM 10669 O WAT 248 121.175 15.803 85.497 1.00 0.00 O ATOM 10670 H1 WAT 248 120.619 15.928 86.267 1.00 0.00 H ATOM 10671 H2 WAT 248 122.069 15.875 85.833 1.00 0.00 H TER 10673 WAT 248 ATOM 10673 O WAT 249 98.306 18.205 141.426 1.00 0.00 O ATOM 10674 H1 WAT 249 98.590 17.825 142.257 1.00 0.00 H ATOM 10675 H2 WAT 249 98.967 18.869 141.229 1.00 0.00 H TER 10677 WAT 249 ATOM 10677 O WAT 250 45.283 63.618 72.480 1.00 0.00 O ATOM 10678 H1 WAT 250 45.046 64.114 73.264 1.00 0.00 H ATOM 10679 H2 WAT 250 44.819 64.059 71.768 1.00 0.00 H TER 10681 WAT 250 ATOM 10681 O WAT 251 135.384 1.553 137.679 1.00 0.00 O ATOM 10682 H1 WAT 251 135.021 2.246 138.230 1.00 0.00 H ATOM 10683 H2 WAT 251 136.277 1.841 137.490 1.00 0.00 H TER 10685 WAT 251 ATOM 10685 O WAT 252 87.596 143.043 20.648 1.00 0.00 O ATOM 10686 H1 WAT 252 87.569 143.393 21.538 1.00 0.00 H ATOM 10687 H2 WAT 252 87.682 142.097 20.765 1.00 0.00 H TER 10689 WAT 252 ATOM 10689 O WAT 253 19.595 22.700 153.093 1.00 0.00 O ATOM 10690 H1 WAT 253 18.960 22.368 153.726 1.00 0.00 H ATOM 10691 H2 WAT 253 19.069 23.186 152.457 1.00 0.00 H TER 10693 WAT 253 ATOM 10693 O WAT 254 9.119 73.936 89.860 1.00 0.00 O ATOM 10694 H1 WAT 254 9.670 74.689 90.074 1.00 0.00 H ATOM 10695 H2 WAT 254 8.484 74.276 89.230 1.00 0.00 H TER 10697 WAT 254 ATOM 10697 O WAT 255 2.876 32.386 78.790 1.00 0.00 O ATOM 10698 H1 WAT 255 2.157 32.970 79.030 1.00 0.00 H ATOM 10699 H2 WAT 255 3.666 32.864 79.043 1.00 0.00 H TER 10701 WAT 255 ATOM 10701 O WAT 256 104.470 51.874 151.138 1.00 0.00 O ATOM 10702 H1 WAT 256 104.181 52.784 151.206 1.00 0.00 H ATOM 10703 H2 WAT 256 104.049 51.548 150.342 1.00 0.00 H TER 10705 WAT 256 ATOM 10705 O WAT 257 59.933 133.197 62.732 1.00 0.00 O ATOM 10706 H1 WAT 257 59.573 133.696 63.465 1.00 0.00 H ATOM 10707 H2 WAT 257 60.692 132.745 63.100 1.00 0.00 H TER 10709 WAT 257 ATOM 10709 O WAT 258 65.511 55.433 130.502 1.00 0.00 O ATOM 10710 H1 WAT 258 65.785 54.741 129.900 1.00 0.00 H ATOM 10711 H2 WAT 258 65.988 56.209 130.209 1.00 0.00 H TER 10713 WAT 258 ATOM 10713 O WAT 259 101.575 18.510 64.918 1.00 0.00 O ATOM 10714 H1 WAT 259 101.955 18.026 64.184 1.00 0.00 H ATOM 10715 H2 WAT 259 101.045 17.863 65.383 1.00 0.00 H TER 10717 WAT 259 ATOM 10717 O WAT 260 25.089 117.913 145.015 1.00 0.00 O ATOM 10718 H1 WAT 260 24.984 117.372 145.798 1.00 0.00 H ATOM 10719 H2 WAT 260 25.702 118.599 145.278 1.00 0.00 H TER 10721 WAT 260 ATOM 10721 O WAT 261 22.457 43.590 124.163 1.00 0.00 O ATOM 10722 H1 WAT 261 22.890 42.762 124.372 1.00 0.00 H ATOM 10723 H2 WAT 261 21.717 43.633 124.769 1.00 0.00 H TER 10725 WAT 261 ATOM 10725 O WAT 262 26.737 91.709 157.552 1.00 0.00 O ATOM 10726 H1 WAT 262 26.095 91.982 158.207 1.00 0.00 H ATOM 10727 H2 WAT 262 26.591 90.769 157.450 1.00 0.00 H TER 10729 WAT 262 ATOM 10729 O WAT 263 95.458 8.391 63.294 1.00 0.00 O ATOM 10730 H1 WAT 263 96.109 9.091 63.239 1.00 0.00 H ATOM 10731 H2 WAT 263 95.525 7.935 62.456 1.00 0.00 H TER 10733 WAT 263 ATOM 10733 O WAT 264 59.453 131.298 133.216 1.00 0.00 O ATOM 10734 H1 WAT 264 59.430 131.832 132.422 1.00 0.00 H ATOM 10735 H2 WAT 264 60.367 131.332 133.501 1.00 0.00 H TER 10737 WAT 264 ATOM 10737 O WAT 265 13.501 130.217 85.107 1.00 0.00 O ATOM 10738 H1 WAT 265 12.973 131.012 85.172 1.00 0.00 H ATOM 10739 H2 WAT 265 13.947 130.155 85.951 1.00 0.00 H TER 10741 WAT 265 ATOM 10741 O WAT 266 44.989 72.836 29.936 1.00 0.00 O ATOM 10742 H1 WAT 266 45.565 73.590 29.807 1.00 0.00 H ATOM 10743 H2 WAT 266 45.555 72.165 30.318 1.00 0.00 H TER 10745 WAT 266 ATOM 10745 O WAT 267 55.122 136.438 82.969 1.00 0.00 O ATOM 10746 H1 WAT 267 55.655 137.223 83.091 1.00 0.00 H ATOM 10747 H2 WAT 267 55.685 135.840 82.477 1.00 0.00 H TER 10749 WAT 267 ATOM 10749 O WAT 268 135.558 69.599 85.670 1.00 0.00 O ATOM 10750 H1 WAT 268 135.238 69.234 84.845 1.00 0.00 H ATOM 10751 H2 WAT 268 136.252 70.205 85.410 1.00 0.00 H TER 10753 WAT 268 ATOM 10753 O WAT 269 60.554 44.157 67.062 1.00 0.00 O ATOM 10754 H1 WAT 269 61.428 44.256 66.683 1.00 0.00 H ATOM 10755 H2 WAT 269 60.402 44.977 67.531 1.00 0.00 H TER 10757 WAT 269 ATOM 10757 O WAT 270 108.019 128.773 127.058 1.00 0.00 O ATOM 10758 H1 WAT 270 108.806 128.292 127.313 1.00 0.00 H ATOM 10759 H2 WAT 270 107.681 129.132 127.878 1.00 0.00 H TER 10761 WAT 270 ATOM 10761 O WAT 271 33.981 3.939 13.516 1.00 0.00 O ATOM 10762 H1 WAT 271 34.924 3.778 13.534 1.00 0.00 H ATOM 10763 H2 WAT 271 33.687 3.546 12.694 1.00 0.00 H TER 10765 WAT 271 ATOM 10765 O WAT 272 135.233 80.127 117.431 1.00 0.00 O ATOM 10766 H1 WAT 272 135.071 79.342 116.909 1.00 0.00 H ATOM 10767 H2 WAT 272 134.696 80.009 118.215 1.00 0.00 H TER 10769 WAT 272 ATOM 10769 O WAT 273 17.113 116.361 125.695 1.00 0.00 O ATOM 10770 H1 WAT 273 17.614 115.548 125.631 1.00 0.00 H ATOM 10771 H2 WAT 273 16.482 116.311 124.976 1.00 0.00 H TER 10773 WAT 273 ATOM 10773 O WAT 274 26.614 23.596 140.497 1.00 0.00 O ATOM 10774 H1 WAT 274 26.249 22.817 140.076 1.00 0.00 H ATOM 10775 H2 WAT 274 27.394 23.279 140.952 1.00 0.00 H TER 10777 WAT 274 ATOM 10777 O WAT 275 62.975 3.418 105.533 1.00 0.00 O ATOM 10778 H1 WAT 275 62.342 2.704 105.603 1.00 0.00 H ATOM 10779 H2 WAT 275 63.090 3.546 104.592 1.00 0.00 H TER 10781 WAT 275 ATOM 10781 O WAT 276 140.665 8.841 129.076 1.00 0.00 O ATOM 10782 H1 WAT 276 140.214 9.680 128.986 1.00 0.00 H ATOM 10783 H2 WAT 276 141.197 8.768 128.284 1.00 0.00 H TER 10785 WAT 276 ATOM 10785 O WAT 277 123.963 126.336 1.097 1.00 0.00 O ATOM 10786 H1 WAT 277 123.734 127.190 1.464 1.00 0.00 H ATOM 10787 H2 WAT 277 124.627 125.989 1.694 1.00 0.00 H TER 10789 WAT 277 ATOM 10789 O WAT 278 68.412 44.868 82.583 1.00 0.00 O ATOM 10790 H1 WAT 278 68.537 44.916 81.635 1.00 0.00 H ATOM 10791 H2 WAT 278 67.626 45.389 82.748 1.00 0.00 H TER 10793 WAT 278 ATOM 10793 O WAT 279 129.180 107.957 133.629 1.00 0.00 O ATOM 10794 H1 WAT 279 129.982 107.683 133.183 1.00 0.00 H ATOM 10795 H2 WAT 279 129.382 108.830 133.967 1.00 0.00 H TER 10797 WAT 279 ATOM 10797 O WAT 280 13.726 131.020 27.983 1.00 0.00 O ATOM 10798 H1 WAT 280 12.911 130.555 27.794 1.00 0.00 H ATOM 10799 H2 WAT 280 13.921 131.497 27.176 1.00 0.00 H TER 10801 WAT 280 ATOM 10801 O WAT 281 50.204 51.643 152.491 1.00 0.00 O ATOM 10802 H1 WAT 281 49.874 50.990 151.874 1.00 0.00 H ATOM 10803 H2 WAT 281 50.490 52.371 151.939 1.00 0.00 H TER 10805 WAT 281 ATOM 10805 O WAT 282 12.458 14.873 96.460 1.00 0.00 O ATOM 10806 H1 WAT 282 12.512 15.817 96.612 1.00 0.00 H ATOM 10807 H2 WAT 282 12.160 14.513 97.295 1.00 0.00 H TER 10809 WAT 282 ATOM 10809 O WAT 283 18.183 144.252 9.434 1.00 0.00 O ATOM 10810 H1 WAT 283 17.611 143.485 9.431 1.00 0.00 H ATOM 10811 H2 WAT 283 19.052 143.902 9.628 1.00 0.00 H TER 10813 WAT 283 ATOM 10813 O WAT 284 112.577 97.957 147.744 1.00 0.00 O ATOM 10814 H1 WAT 284 112.124 98.778 147.935 1.00 0.00 H ATOM 10815 H2 WAT 284 113.290 98.208 147.156 1.00 0.00 H TER 10817 WAT 284 ATOM 10817 O WAT 285 61.366 130.851 125.886 1.00 0.00 O ATOM 10818 H1 WAT 285 62.022 131.237 126.466 1.00 0.00 H ATOM 10819 H2 WAT 285 61.855 130.219 125.358 1.00 0.00 H TER 10821 WAT 285 ATOM 10821 O WAT 286 93.587 39.011 75.046 1.00 0.00 O ATOM 10822 H1 WAT 286 92.937 38.420 74.664 1.00 0.00 H ATOM 10823 H2 WAT 286 94.236 39.133 74.353 1.00 0.00 H TER 10825 WAT 286 ATOM 10825 O WAT 287 79.361 111.929 158.940 1.00 0.00 O ATOM 10826 H1 WAT 287 79.572 112.767 158.529 1.00 0.00 H ATOM 10827 H2 WAT 287 79.048 111.381 158.221 1.00 0.00 H TER 10829 WAT 287 ATOM 10829 O WAT 288 35.523 31.935 13.470 1.00 0.00 O ATOM 10830 H1 WAT 288 36.097 32.699 13.416 1.00 0.00 H ATOM 10831 H2 WAT 288 35.222 31.927 14.379 1.00 0.00 H TER 10833 WAT 288 ATOM 10833 O WAT 289 23.532 4.267 121.305 1.00 0.00 O ATOM 10834 H1 WAT 289 24.423 4.032 121.046 1.00 0.00 H ATOM 10835 H2 WAT 289 23.219 4.833 120.600 1.00 0.00 H TER 10837 WAT 289 ATOM 10837 O WAT 290 110.327 105.417 68.992 1.00 0.00 O ATOM 10838 H1 WAT 290 110.371 105.688 69.909 1.00 0.00 H ATOM 10839 H2 WAT 290 110.326 106.238 68.499 1.00 0.00 H TER 10841 WAT 290 ATOM 10841 O WAT 291 42.679 63.338 20.083 1.00 0.00 O ATOM 10842 H1 WAT 291 42.235 63.439 20.925 1.00 0.00 H ATOM 10843 H2 WAT 291 43.283 64.079 20.040 1.00 0.00 H TER 10845 WAT 291 ATOM 10845 O WAT 292 8.348 140.240 53.705 1.00 0.00 O ATOM 10846 H1 WAT 292 8.714 141.122 53.639 1.00 0.00 H ATOM 10847 H2 WAT 292 9.014 139.738 54.173 1.00 0.00 H TER 10849 WAT 292 ATOM 10849 O WAT 293 49.069 132.527 106.581 1.00 0.00 O ATOM 10850 H1 WAT 293 49.638 132.918 107.244 1.00 0.00 H ATOM 10851 H2 WAT 293 49.607 132.500 105.790 1.00 0.00 H TER 10853 WAT 293 ATOM 10853 O WAT 294 60.328 16.486 110.140 1.00 0.00 O ATOM 10854 H1 WAT 294 59.784 17.231 110.397 1.00 0.00 H ATOM 10855 H2 WAT 294 61.226 16.787 110.276 1.00 0.00 H TER 10857 WAT 294 ATOM 10857 O WAT 295 54.431 110.614 139.444 1.00 0.00 O ATOM 10858 H1 WAT 295 54.203 111.052 138.624 1.00 0.00 H ATOM 10859 H2 WAT 295 53.852 111.010 140.095 1.00 0.00 H TER 10861 WAT 295 ATOM 10861 O WAT 296 6.826 53.459 105.611 1.00 0.00 O ATOM 10862 H1 WAT 296 6.650 52.842 104.902 1.00 0.00 H ATOM 10863 H2 WAT 296 6.977 54.295 105.170 1.00 0.00 H TER 10865 WAT 296 ATOM 10865 O WAT 297 32.857 64.154 128.091 1.00 0.00 O ATOM 10866 H1 WAT 297 33.172 63.266 128.258 1.00 0.00 H ATOM 10867 H2 WAT 297 32.275 64.063 127.336 1.00 0.00 H TER 10869 WAT 297 ATOM 10869 O WAT 298 94.233 23.556 75.177 1.00 0.00 O ATOM 10870 H1 WAT 298 95.135 23.843 75.035 1.00 0.00 H ATOM 10871 H2 WAT 298 93.841 23.557 74.304 1.00 0.00 H TER 10873 WAT 298 ATOM 10873 O WAT 299 70.270 11.057 102.718 1.00 0.00 O ATOM 10874 H1 WAT 299 70.025 11.721 102.073 1.00 0.00 H ATOM 10875 H2 WAT 299 70.931 10.525 102.275 1.00 0.00 H TER 10877 WAT 299 ATOM 10877 O WAT 300 96.204 31.335 154.658 1.00 0.00 O ATOM 10878 H1 WAT 300 96.937 31.483 154.060 1.00 0.00 H ATOM 10879 H2 WAT 300 95.441 31.675 154.191 1.00 0.00 H TER 10881 WAT 300 ATOM 10881 O WAT 301 26.080 3.903 114.469 1.00 0.00 O ATOM 10882 H1 WAT 301 26.800 3.747 113.857 1.00 0.00 H ATOM 10883 H2 WAT 301 25.420 4.362 113.950 1.00 0.00 H TER 10885 WAT 301 ATOM 10885 O WAT 302 130.905 13.861 100.991 1.00 0.00 O ATOM 10886 H1 WAT 302 131.069 13.970 100.055 1.00 0.00 H ATOM 10887 H2 WAT 302 130.701 14.743 101.303 1.00 0.00 H TER 10889 WAT 302 ATOM 10889 O WAT 303 2.903 35.992 137.444 1.00 0.00 O ATOM 10890 H1 WAT 303 2.540 35.157 137.739 1.00 0.00 H ATOM 10891 H2 WAT 303 3.668 35.750 136.921 1.00 0.00 H TER 10893 WAT 303 ATOM 10893 O WAT 304 85.247 16.856 156.289 1.00 0.00 O ATOM 10894 H1 WAT 304 84.898 16.810 155.398 1.00 0.00 H ATOM 10895 H2 WAT 304 84.664 16.298 156.803 1.00 0.00 H TER 10897 WAT 304 ATOM 10897 O WAT 305 109.493 16.663 86.294 1.00 0.00 O ATOM 10898 H1 WAT 305 108.597 16.986 86.396 1.00 0.00 H ATOM 10899 H2 WAT 305 109.631 16.635 85.348 1.00 0.00 H TER 10901 WAT 305 ATOM 10901 O WAT 306 64.490 103.919 79.864 1.00 0.00 O ATOM 10902 H1 WAT 306 63.953 103.759 79.088 1.00 0.00 H ATOM 10903 H2 WAT 306 64.913 103.079 80.041 1.00 0.00 H TER 10905 WAT 306 ATOM 10905 O WAT 307 121.416 5.529 103.050 1.00 0.00 O ATOM 10906 H1 WAT 307 122.021 4.893 103.432 1.00 0.00 H ATOM 10907 H2 WAT 307 120.814 5.744 103.762 1.00 0.00 H TER 10909 WAT 307 ATOM 10909 O WAT 308 132.426 118.829 148.499 1.00 0.00 O ATOM 10910 H1 WAT 308 133.191 118.501 148.025 1.00 0.00 H ATOM 10911 H2 WAT 308 132.030 118.047 148.884 1.00 0.00 H TER 10913 WAT 308 ATOM 10913 O WAT 309 58.100 7.845 133.638 1.00 0.00 O ATOM 10914 H1 WAT 309 57.278 7.381 133.800 1.00 0.00 H ATOM 10915 H2 WAT 309 57.930 8.366 132.853 1.00 0.00 H TER 10917 WAT 309 ATOM 10917 O WAT 310 68.278 89.838 150.834 1.00 0.00 O ATOM 10918 H1 WAT 310 67.364 90.004 151.066 1.00 0.00 H ATOM 10919 H2 WAT 310 68.766 90.539 151.267 1.00 0.00 H TER 10921 WAT 310 ATOM 10921 O WAT 311 145.143 60.405 10.688 1.00 0.00 O ATOM 10922 H1 WAT 311 144.957 60.816 11.532 1.00 0.00 H ATOM 10923 H2 WAT 311 145.576 61.089 10.178 1.00 0.00 H TER 10925 WAT 311 ATOM 10925 O WAT 312 14.314 33.711 67.612 1.00 0.00 O ATOM 10926 H1 WAT 312 14.073 32.926 67.119 1.00 0.00 H ATOM 10927 H2 WAT 312 13.797 33.659 68.415 1.00 0.00 H TER 10929 WAT 312 ATOM 10929 O WAT 313 99.916 139.907 112.010 1.00 0.00 O ATOM 10930 H1 WAT 313 99.067 140.318 111.852 1.00 0.00 H ATOM 10931 H2 WAT 313 99.806 139.005 111.709 1.00 0.00 H TER 10933 WAT 313 ATOM 10933 O WAT 314 53.882 41.545 109.995 1.00 0.00 O ATOM 10934 H1 WAT 314 53.502 42.365 109.681 1.00 0.00 H ATOM 10935 H2 WAT 314 53.725 40.921 109.286 1.00 0.00 H TER 10937 WAT 314 ATOM 10937 O WAT 315 41.668 126.184 100.770 1.00 0.00 O ATOM 10938 H1 WAT 315 41.021 126.873 100.919 1.00 0.00 H ATOM 10939 H2 WAT 315 42.500 126.649 100.693 1.00 0.00 H TER 10941 WAT 315 ATOM 10941 O WAT 316 128.403 20.260 84.041 1.00 0.00 O ATOM 10942 H1 WAT 316 128.367 21.051 84.578 1.00 0.00 H ATOM 10943 H2 WAT 316 129.041 19.699 84.483 1.00 0.00 H TER 10945 WAT 316 ATOM 10945 O WAT 317 48.929 116.381 83.762 1.00 0.00 O ATOM 10946 H1 WAT 317 49.655 116.897 83.410 1.00 0.00 H ATOM 10947 H2 WAT 317 48.172 116.964 83.707 1.00 0.00 H TER 10949 WAT 317 ATOM 10949 O WAT 318 127.970 113.844 154.270 1.00 0.00 O ATOM 10950 H1 WAT 318 127.054 114.105 154.368 1.00 0.00 H ATOM 10951 H2 WAT 318 127.945 113.106 153.662 1.00 0.00 H TER 10953 WAT 318 ATOM 10953 O WAT 319 34.169 28.004 93.238 1.00 0.00 O ATOM 10954 H1 WAT 319 34.210 27.431 92.473 1.00 0.00 H ATOM 10955 H2 WAT 319 34.760 27.599 93.872 1.00 0.00 H TER 10957 WAT 319 ATOM 10957 O WAT 320 100.080 124.381 143.897 1.00 0.00 O ATOM 10958 H1 WAT 320 99.857 125.292 144.086 1.00 0.00 H ATOM 10959 H2 WAT 320 100.656 124.429 143.134 1.00 0.00 H TER 10961 WAT 320 ATOM 10961 O WAT 321 109.515 127.495 83.359 1.00 0.00 O ATOM 10962 H1 WAT 321 109.977 128.259 83.013 1.00 0.00 H ATOM 10963 H2 WAT 321 109.718 126.792 82.743 1.00 0.00 H TER 10965 WAT 321 ATOM 10965 O WAT 322 48.007 3.473 103.497 1.00 0.00 O ATOM 10966 H1 WAT 322 48.244 3.577 104.418 1.00 0.00 H ATOM 10967 H2 WAT 322 47.545 4.282 103.275 1.00 0.00 H TER 10969 WAT 322 ATOM 10969 O WAT 323 56.151 19.481 67.350 1.00 0.00 O ATOM 10970 H1 WAT 323 56.565 18.897 67.985 1.00 0.00 H ATOM 10971 H2 WAT 323 56.114 18.968 66.542 1.00 0.00 H TER 10973 WAT 323 ATOM 10973 O WAT 324 133.305 49.030 99.060 1.00 0.00 O ATOM 10974 H1 WAT 324 133.061 49.182 98.147 1.00 0.00 H ATOM 10975 H2 WAT 324 134.210 49.335 99.121 1.00 0.00 H TER 10977 WAT 324 ATOM 10977 O WAT 325 138.490 11.338 138.672 1.00 0.00 O ATOM 10978 H1 WAT 325 139.195 11.849 138.275 1.00 0.00 H ATOM 10979 H2 WAT 325 138.538 11.547 139.605 1.00 0.00 H TER 10981 WAT 325 ATOM 10981 O WAT 326 55.492 98.146 74.330 1.00 0.00 O ATOM 10982 H1 WAT 326 54.575 97.977 74.113 1.00 0.00 H ATOM 10983 H2 WAT 326 55.815 97.312 74.672 1.00 0.00 H TER 10985 WAT 326 ATOM 10985 O WAT 327 102.967 72.525 21.564 1.00 0.00 O ATOM 10986 H1 WAT 327 103.514 73.103 22.096 1.00 0.00 H ATOM 10987 H2 WAT 327 102.829 71.754 22.113 1.00 0.00 H TER 10989 WAT 327 ATOM 10989 O WAT 328 23.688 18.424 114.934 1.00 0.00 O ATOM 10990 H1 WAT 328 23.883 19.344 115.111 1.00 0.00 H ATOM 10991 H2 WAT 328 23.043 18.183 115.599 1.00 0.00 H TER 10993 WAT 328 ATOM 10993 O WAT 329 48.085 30.501 83.151 1.00 0.00 O ATOM 10994 H1 WAT 329 47.145 30.326 83.189 1.00 0.00 H ATOM 10995 H2 WAT 329 48.197 31.043 82.370 1.00 0.00 H TER 10997 WAT 329 ATOM 10997 O WAT 330 145.297 35.306 97.972 1.00 0.00 O ATOM 10998 H1 WAT 330 144.959 36.113 97.583 1.00 0.00 H ATOM 10999 H2 WAT 330 146.153 35.182 97.562 1.00 0.00 H TER 11001 WAT 330 ATOM 11001 O WAT 331 139.612 87.968 63.288 1.00 0.00 O ATOM 11002 H1 WAT 331 139.193 88.217 64.111 1.00 0.00 H ATOM 11003 H2 WAT 331 138.978 88.210 62.613 1.00 0.00 H TER 11005 WAT 331 ATOM 11005 O WAT 332 94.675 96.773 91.890 1.00 0.00 O ATOM 11006 H1 WAT 332 94.529 95.869 92.168 1.00 0.00 H ATOM 11007 H2 WAT 332 94.370 96.798 90.983 1.00 0.00 H TER 11009 WAT 332 ATOM 11009 O WAT 333 143.684 76.817 11.015 1.00 0.00 O ATOM 11010 H1 WAT 333 143.693 75.865 11.110 1.00 0.00 H ATOM 11011 H2 WAT 333 143.928 77.146 11.880 1.00 0.00 H TER 11013 WAT 333 ATOM 11013 O WAT 334 1.574 63.124 68.758 1.00 0.00 O ATOM 11014 H1 WAT 334 2.278 62.766 69.298 1.00 0.00 H ATOM 11015 H2 WAT 334 1.421 64.000 69.115 1.00 0.00 H TER 11017 WAT 334 ATOM 11017 O WAT 335 43.529 84.136 22.246 1.00 0.00 O ATOM 11018 H1 WAT 335 44.179 84.393 21.592 1.00 0.00 H ATOM 11019 H2 WAT 335 44.007 83.566 22.848 1.00 0.00 H TER 11021 WAT 335 ATOM 11021 O WAT 336 14.676 52.736 144.282 1.00 0.00 O ATOM 11022 H1 WAT 336 14.589 53.445 144.918 1.00 0.00 H ATOM 11023 H2 WAT 336 15.194 53.114 143.571 1.00 0.00 H TER 11025 WAT 336 ATOM 11025 O WAT 337 130.075 72.229 131.199 1.00 0.00 O ATOM 11026 H1 WAT 337 129.579 73.047 131.185 1.00 0.00 H ATOM 11027 H2 WAT 337 129.797 71.795 132.006 1.00 0.00 H TER 11029 WAT 337 ATOM 11029 O WAT 338 128.358 41.365 111.337 1.00 0.00 O ATOM 11030 H1 WAT 338 127.701 41.719 111.936 1.00 0.00 H ATOM 11031 H2 WAT 338 127.892 41.259 110.507 1.00 0.00 H TER 11033 WAT 338 ATOM 11033 O WAT 339 55.416 71.796 137.145 1.00 0.00 O ATOM 11034 H1 WAT 339 56.313 71.488 137.021 1.00 0.00 H ATOM 11035 H2 WAT 339 55.213 72.272 136.339 1.00 0.00 H TER 11037 WAT 339 ATOM 11037 O WAT 340 145.245 130.707 140.704 1.00 0.00 O ATOM 11038 H1 WAT 340 144.906 129.817 140.617 1.00 0.00 H ATOM 11039 H2 WAT 340 144.688 131.234 140.131 1.00 0.00 H TER 11041 WAT 340 ATOM 11041 O WAT 341 107.239 119.698 78.885 1.00 0.00 O ATOM 11042 H1 WAT 341 106.347 120.014 79.029 1.00 0.00 H ATOM 11043 H2 WAT 341 107.265 118.846 79.320 1.00 0.00 H TER 11045 WAT 341 ATOM 11045 O WAT 342 127.697 66.514 65.860 1.00 0.00 O ATOM 11046 H1 WAT 342 127.190 65.714 65.999 1.00 0.00 H ATOM 11047 H2 WAT 342 127.103 67.221 66.114 1.00 0.00 H TER 11049 WAT 342 ATOM 11049 O WAT 343 55.144 91.799 148.472 1.00 0.00 O ATOM 11050 H1 WAT 343 55.671 91.001 148.466 1.00 0.00 H ATOM 11051 H2 WAT 343 54.726 91.818 147.611 1.00 0.00 H TER 11053 WAT 343 ATOM 11053 O WAT 344 75.439 93.161 153.985 1.00 0.00 O ATOM 11054 H1 WAT 344 75.432 93.195 153.028 1.00 0.00 H ATOM 11055 H2 WAT 344 76.367 93.132 154.217 1.00 0.00 H TER 11057 WAT 344 ATOM 11057 O WAT 345 59.357 12.571 86.560 1.00 0.00 O ATOM 11058 H1 WAT 345 59.273 11.649 86.803 1.00 0.00 H ATOM 11059 H2 WAT 345 59.805 12.556 85.714 1.00 0.00 H TER 11061 WAT 345 ATOM 11061 O WAT 346 13.088 142.878 71.815 1.00 0.00 O ATOM 11062 H1 WAT 346 12.280 142.498 72.160 1.00 0.00 H ATOM 11063 H2 WAT 346 13.283 143.604 72.408 1.00 0.00 H TER 11065 WAT 346 ATOM 11065 O WAT 347 34.167 52.876 144.661 1.00 0.00 O ATOM 11066 H1 WAT 347 35.062 52.718 144.363 1.00 0.00 H ATOM 11067 H2 WAT 347 34.085 53.829 144.680 1.00 0.00 H TER 11069 WAT 347 ATOM 11069 O WAT 348 113.264 79.623 117.955 1.00 0.00 O ATOM 11070 H1 WAT 348 113.119 80.519 117.652 1.00 0.00 H ATOM 11071 H2 WAT 348 114.200 79.584 118.151 1.00 0.00 H TER 11073 WAT 348 ATOM 11073 O WAT 349 22.570 5.870 105.795 1.00 0.00 O ATOM 11074 H1 WAT 349 22.789 5.925 104.865 1.00 0.00 H ATOM 11075 H2 WAT 349 23.070 5.119 106.115 1.00 0.00 H TER 11077 WAT 349 ATOM 11077 O WAT 350 1.711 53.193 103.778 1.00 0.00 O ATOM 11078 H1 WAT 350 1.450 53.238 104.697 1.00 0.00 H ATOM 11079 H2 WAT 350 1.562 52.280 103.531 1.00 0.00 H TER 11081 WAT 350 ATOM 11081 O WAT 351 52.021 94.548 80.667 1.00 0.00 O ATOM 11082 H1 WAT 351 52.952 94.541 80.446 1.00 0.00 H ATOM 11083 H2 WAT 351 51.874 93.714 81.114 1.00 0.00 H TER 11085 WAT 351 ATOM 11085 O WAT 352 37.721 42.823 66.818 1.00 0.00 O ATOM 11086 H1 WAT 352 38.009 43.707 67.042 1.00 0.00 H ATOM 11087 H2 WAT 352 37.157 42.562 67.546 1.00 0.00 H TER 11089 WAT 352 ATOM 11089 O WAT 353 128.529 79.593 113.526 1.00 0.00 O ATOM 11090 H1 WAT 353 129.093 79.039 114.066 1.00 0.00 H ATOM 11091 H2 WAT 353 128.357 80.362 114.070 1.00 0.00 H TER 11093 WAT 353 ATOM 11093 O WAT 354 97.395 84.439 72.919 1.00 0.00 O ATOM 11094 H1 WAT 354 97.482 83.561 72.549 1.00 0.00 H ATOM 11095 H2 WAT 354 96.465 84.517 73.134 1.00 0.00 H TER 11097 WAT 354 ATOM 11097 O WAT 355 25.105 53.236 133.532 1.00 0.00 O ATOM 11098 H1 WAT 355 24.369 53.641 133.072 1.00 0.00 H ATOM 11099 H2 WAT 355 25.673 52.910 132.834 1.00 0.00 H TER 11101 WAT 355 ATOM 11101 O WAT 356 3.814 128.029 4.810 1.00 0.00 O ATOM 11102 H1 WAT 356 3.368 128.834 4.548 1.00 0.00 H ATOM 11103 H2 WAT 356 4.134 127.654 3.989 1.00 0.00 H TER 11105 WAT 356 ATOM 11105 O WAT 357 19.908 18.384 137.623 1.00 0.00 O ATOM 11106 H1 WAT 357 20.597 18.846 138.100 1.00 0.00 H ATOM 11107 H2 WAT 357 20.359 17.977 136.883 1.00 0.00 H TER 11109 WAT 357 ATOM 11109 O WAT 358 25.860 58.907 114.855 1.00 0.00 O ATOM 11110 H1 WAT 358 26.445 59.470 114.348 1.00 0.00 H ATOM 11111 H2 WAT 358 25.994 58.032 114.491 1.00 0.00 H TER 11113 WAT 358 ATOM 11113 O WAT 359 70.184 40.825 99.834 1.00 0.00 O ATOM 11114 H1 WAT 359 69.769 41.296 99.111 1.00 0.00 H ATOM 11115 H2 WAT 359 70.271 41.479 100.527 1.00 0.00 H TER 11117 WAT 359 ATOM 11117 O WAT 360 126.909 95.559 66.709 1.00 0.00 O ATOM 11118 H1 WAT 360 127.407 95.303 67.484 1.00 0.00 H ATOM 11119 H2 WAT 360 127.432 96.252 66.305 1.00 0.00 H TER 11121 WAT 360 ATOM 11121 O WAT 361 60.135 46.474 8.795 1.00 0.00 O ATOM 11122 H1 WAT 361 60.220 45.770 8.153 1.00 0.00 H ATOM 11123 H2 WAT 361 59.508 46.140 9.436 1.00 0.00 H TER 11125 WAT 361 ATOM 11125 O WAT 362 118.701 108.678 100.156 1.00 0.00 O ATOM 11126 H1 WAT 362 117.897 109.196 100.191 1.00 0.00 H ATOM 11127 H2 WAT 362 118.402 107.769 100.183 1.00 0.00 H TER 11129 WAT 362 ATOM 11129 O WAT 363 94.431 115.147 151.587 1.00 0.00 O ATOM 11130 H1 WAT 363 93.956 115.546 150.858 1.00 0.00 H ATOM 11131 H2 WAT 363 93.874 114.421 151.867 1.00 0.00 H TER 11133 WAT 363 ATOM 11133 O WAT 364 136.622 28.931 81.704 1.00 0.00 O ATOM 11134 H1 WAT 364 136.096 28.449 81.066 1.00 0.00 H ATOM 11135 H2 WAT 364 135.997 29.509 82.142 1.00 0.00 H TER 11137 WAT 364 ATOM 11137 O WAT 365 30.444 82.193 119.928 1.00 0.00 O ATOM 11138 H1 WAT 365 31.332 82.057 119.600 1.00 0.00 H ATOM 11139 H2 WAT 365 29.919 81.527 119.484 1.00 0.00 H TER 11141 WAT 365 ATOM 11141 O WAT 366 65.642 98.962 121.054 1.00 0.00 O ATOM 11142 H1 WAT 366 65.659 99.790 120.573 1.00 0.00 H ATOM 11143 H2 WAT 366 65.815 98.296 120.390 1.00 0.00 H TER 11145 WAT 366 ATOM 11145 O WAT 367 110.652 143.878 114.943 1.00 0.00 O ATOM 11146 H1 WAT 367 110.280 143.150 115.441 1.00 0.00 H ATOM 11147 H2 WAT 367 109.959 144.538 114.929 1.00 0.00 H TER 11149 WAT 367 ATOM 11149 O WAT 368 58.036 14.033 127.172 1.00 0.00 O ATOM 11150 H1 WAT 368 58.556 13.621 127.862 1.00 0.00 H ATOM 11151 H2 WAT 368 57.130 13.812 127.390 1.00 0.00 H TER 11153 WAT 368 ATOM 11153 O WAT 369 9.783 143.440 127.914 1.00 0.00 O ATOM 11154 H1 WAT 369 10.459 142.766 127.846 1.00 0.00 H ATOM 11155 H2 WAT 369 10.262 144.237 128.140 1.00 0.00 H TER 11157 WAT 369 ATOM 11157 O WAT 370 87.421 132.318 100.039 1.00 0.00 O ATOM 11158 H1 WAT 370 87.433 131.606 99.400 1.00 0.00 H ATOM 11159 H2 WAT 370 88.338 132.578 100.125 1.00 0.00 H TER 11161 WAT 370 ATOM 11161 O WAT 371 105.684 84.635 109.095 1.00 0.00 O ATOM 11162 H1 WAT 371 106.009 84.114 108.361 1.00 0.00 H ATOM 11163 H2 WAT 371 105.560 85.512 108.731 1.00 0.00 H TER 11165 WAT 371 ATOM 11165 O WAT 372 133.586 146.131 117.275 1.00 0.00 O ATOM 11166 H1 WAT 372 132.723 146.072 116.864 1.00 0.00 H ATOM 11167 H2 WAT 372 134.019 145.310 117.040 1.00 0.00 H TER 11169 WAT 372 ATOM 11169 O WAT 373 11.364 31.111 78.054 1.00 0.00 O ATOM 11170 H1 WAT 373 12.140 31.575 77.740 1.00 0.00 H ATOM 11171 H2 WAT 373 10.948 31.722 78.661 1.00 0.00 H TER 11173 WAT 373 ATOM 11173 O WAT 374 23.843 133.854 55.642 1.00 0.00 O ATOM 11174 H1 WAT 374 23.132 134.403 55.312 1.00 0.00 H ATOM 11175 H2 WAT 374 24.230 134.366 56.352 1.00 0.00 H TER 11177 WAT 374 ATOM 11177 O WAT 375 141.911 35.394 101.635 1.00 0.00 O ATOM 11178 H1 WAT 375 141.774 36.318 101.428 1.00 0.00 H ATOM 11179 H2 WAT 375 142.858 35.313 101.753 1.00 0.00 H TER 11181 WAT 375 ATOM 11181 O WAT 376 118.692 83.678 77.194 1.00 0.00 O ATOM 11182 H1 WAT 376 119.097 83.871 78.040 1.00 0.00 H ATOM 11183 H2 WAT 376 118.856 82.745 77.057 1.00 0.00 H TER 11185 WAT 376 ATOM 11185 O WAT 377 134.383 62.213 124.617 1.00 0.00 O ATOM 11186 H1 WAT 377 135.178 61.915 125.060 1.00 0.00 H ATOM 11187 H2 WAT 377 134.182 61.515 123.993 1.00 0.00 H TER 11189 WAT 377 ATOM 11189 O WAT 378 95.101 42.354 24.656 1.00 0.00 O ATOM 11190 H1 WAT 378 95.132 41.448 24.963 1.00 0.00 H ATOM 11191 H2 WAT 378 95.935 42.483 24.204 1.00 0.00 H TER 11193 WAT 378 ATOM 11193 O WAT 379 71.785 16.035 20.855 1.00 0.00 O ATOM 11194 H1 WAT 379 71.771 15.084 20.964 1.00 0.00 H ATOM 11195 H2 WAT 379 71.640 16.379 21.737 1.00 0.00 H TER 11197 WAT 379 ATOM 11197 O WAT 380 7.438 116.769 5.020 1.00 0.00 O ATOM 11198 H1 WAT 380 7.748 117.504 4.490 1.00 0.00 H ATOM 11199 H2 WAT 380 6.585 117.052 5.347 1.00 0.00 H TER 11201 WAT 380 ATOM 11201 O WAT 381 9.840 98.081 85.039 1.00 0.00 O ATOM 11202 H1 WAT 381 9.363 97.659 85.754 1.00 0.00 H ATOM 11203 H2 WAT 381 9.160 98.496 84.509 1.00 0.00 H TER 11205 WAT 381 ATOM 11205 O WAT 382 99.757 29.341 157.831 1.00 0.00 O ATOM 11206 H1 WAT 382 100.075 28.446 157.954 1.00 0.00 H ATOM 11207 H2 WAT 382 99.298 29.546 158.645 1.00 0.00 H TER 11209 WAT 382 ATOM 11209 O WAT 383 128.566 101.063 7.803 1.00 0.00 O ATOM 11210 H1 WAT 383 129.223 101.696 8.092 1.00 0.00 H ATOM 11211 H2 WAT 383 128.362 101.322 6.905 1.00 0.00 H TER 11213 WAT 383 ATOM 11213 O WAT 384 116.528 101.138 107.087 1.00 0.00 O ATOM 11214 H1 WAT 384 117.458 101.105 106.861 1.00 0.00 H ATOM 11215 H2 WAT 384 116.143 101.717 106.429 1.00 0.00 H TER 11217 WAT 384 ATOM 11217 O WAT 385 76.128 57.271 106.706 1.00 0.00 O ATOM 11218 H1 WAT 385 76.067 56.449 107.191 1.00 0.00 H ATOM 11219 H2 WAT 385 77.069 57.416 106.598 1.00 0.00 H TER 11221 WAT 385 ATOM 11221 O WAT 386 12.310 31.614 115.696 1.00 0.00 O ATOM 11222 H1 WAT 386 11.565 31.433 115.124 1.00 0.00 H ATOM 11223 H2 WAT 386 13.064 31.256 115.229 1.00 0.00 H TER 11225 WAT 386 ATOM 11225 O WAT 387 23.458 124.217 127.222 1.00 0.00 O ATOM 11226 H1 WAT 387 23.001 124.692 127.916 1.00 0.00 H ATOM 11227 H2 WAT 387 23.037 124.509 126.414 1.00 0.00 H TER 11229 WAT 387 ATOM 11229 O WAT 388 144.427 55.177 18.282 1.00 0.00 O ATOM 11230 H1 WAT 388 144.418 54.494 17.612 1.00 0.00 H ATOM 11231 H2 WAT 388 144.062 54.754 19.060 1.00 0.00 H TER 11233 WAT 388 ATOM 11233 O WAT 389 134.864 34.564 13.989 1.00 0.00 O ATOM 11234 H1 WAT 389 135.028 35.477 14.228 1.00 0.00 H ATOM 11235 H2 WAT 389 134.315 34.227 14.696 1.00 0.00 H TER 11237 WAT 389 ATOM 11237 O WAT 390 46.339 103.612 105.209 1.00 0.00 O ATOM 11238 H1 WAT 390 46.012 102.996 105.864 1.00 0.00 H ATOM 11239 H2 WAT 390 46.911 103.087 104.650 1.00 0.00 H TER 11241 WAT 390 ATOM 11241 O WAT 391 29.935 51.439 80.906 1.00 0.00 O ATOM 11242 H1 WAT 391 30.080 51.951 80.111 1.00 0.00 H ATOM 11243 H2 WAT 391 30.532 51.820 81.549 1.00 0.00 H TER 11245 WAT 391 ATOM 11245 O WAT 392 4.111 121.891 139.960 1.00 0.00 O ATOM 11246 H1 WAT 392 4.440 122.413 140.692 1.00 0.00 H ATOM 11247 H2 WAT 392 3.506 122.475 139.502 1.00 0.00 H TER 11249 WAT 392 ATOM 11249 O WAT 393 -0.202 28.319 84.181 1.00 0.00 O ATOM 11250 H1 WAT 393 0.447 28.930 84.531 1.00 0.00 H ATOM 11251 H2 WAT 393 0.163 27.453 84.363 1.00 0.00 H TER 11253 WAT 393 ATOM 11253 O WAT 394 115.601 46.291 137.597 1.00 0.00 O ATOM 11254 H1 WAT 394 115.009 45.802 137.025 1.00 0.00 H ATOM 11255 H2 WAT 394 115.151 46.318 138.441 1.00 0.00 H TER 11257 WAT 394 ATOM 11257 O WAT 395 89.936 42.505 22.751 1.00 0.00 O ATOM 11258 H1 WAT 395 90.717 42.177 23.197 1.00 0.00 H ATOM 11259 H2 WAT 395 89.579 43.164 23.347 1.00 0.00 H TER 11261 WAT 395 ATOM 11261 O WAT 396 31.436 125.642 9.968 1.00 0.00 O ATOM 11262 H1 WAT 396 32.200 125.960 9.487 1.00 0.00 H ATOM 11263 H2 WAT 396 31.611 125.877 10.879 1.00 0.00 H TER 11265 WAT 396 ATOM 11265 O WAT 397 67.724 12.258 91.041 1.00 0.00 O ATOM 11266 H1 WAT 397 67.901 13.172 90.817 1.00 0.00 H ATOM 11267 H2 WAT 397 67.525 12.275 91.977 1.00 0.00 H TER 11269 WAT 397 ATOM 11269 O WAT 398 138.409 21.325 56.505 1.00 0.00 O ATOM 11270 H1 WAT 398 139.302 21.434 56.178 1.00 0.00 H ATOM 11271 H2 WAT 398 138.075 20.559 56.039 1.00 0.00 H TER 11273 WAT 398 ATOM 11273 O WAT 399 108.541 43.468 103.278 1.00 0.00 O ATOM 11274 H1 WAT 399 109.449 43.165 103.273 1.00 0.00 H ATOM 11275 H2 WAT 399 108.436 43.896 104.128 1.00 0.00 H TER 11277 WAT 399 ATOM 11277 O WAT 400 82.663 117.510 65.538 1.00 0.00 O ATOM 11278 H1 WAT 400 82.342 117.103 66.343 1.00 0.00 H ATOM 11279 H2 WAT 400 82.870 116.773 64.963 1.00 0.00 H TER 11281 WAT 400 ATOM 11281 O WAT 401 23.356 39.726 151.614 1.00 0.00 O ATOM 11282 H1 WAT 401 24.222 40.100 151.450 1.00 0.00 H ATOM 11283 H2 WAT 401 23.507 39.056 152.281 1.00 0.00 H TER 11285 WAT 401 ATOM 11285 O WAT 402 97.603 45.647 114.923 1.00 0.00 O ATOM 11286 H1 WAT 402 97.415 45.632 115.862 1.00 0.00 H ATOM 11287 H2 WAT 402 97.942 46.527 114.761 1.00 0.00 H TER 11289 WAT 402 ATOM 11289 O WAT 403 101.332 27.121 118.890 1.00 0.00 O ATOM 11290 H1 WAT 403 100.910 26.279 119.060 1.00 0.00 H ATOM 11291 H2 WAT 403 101.512 27.114 117.950 1.00 0.00 H TER 11293 WAT 403 ATOM 11293 O WAT 404 28.670 27.016 146.053 1.00 0.00 O ATOM 11294 H1 WAT 404 28.945 27.853 145.680 1.00 0.00 H ATOM 11295 H2 WAT 404 28.452 27.218 146.963 1.00 0.00 H TER 11297 WAT 404 ATOM 11297 O WAT 405 119.681 59.127 85.181 1.00 0.00 O ATOM 11298 H1 WAT 405 120.115 59.965 85.341 1.00 0.00 H ATOM 11299 H2 WAT 405 118.747 59.324 85.255 1.00 0.00 H TER 11301 WAT 405 ATOM 11301 O WAT 406 138.363 144.956 129.753 1.00 0.00 O ATOM 11302 H1 WAT 406 138.184 144.489 128.938 1.00 0.00 H ATOM 11303 H2 WAT 406 137.588 145.501 129.892 1.00 0.00 H TER 11305 WAT 406 ATOM 11305 O WAT 407 139.977 10.834 58.440 1.00 0.00 O ATOM 11306 H1 WAT 407 139.461 10.494 57.709 1.00 0.00 H ATOM 11307 H2 WAT 407 139.674 11.735 58.548 1.00 0.00 H TER 11309 WAT 407 ATOM 11309 O WAT 408 51.861 29.901 122.658 1.00 0.00 O ATOM 11310 H1 WAT 408 52.363 29.616 121.894 1.00 0.00 H ATOM 11311 H2 WAT 408 51.981 29.199 123.298 1.00 0.00 H TER 11313 WAT 408 ATOM 11313 O WAT 409 97.093 68.326 147.719 1.00 0.00 O ATOM 11314 H1 WAT 409 96.732 68.944 148.355 1.00 0.00 H ATOM 11315 H2 WAT 409 96.458 68.321 147.003 1.00 0.00 H TER 11317 WAT 409 ATOM 11317 O WAT 410 110.323 59.316 15.067 1.00 0.00 O ATOM 11318 H1 WAT 410 109.665 58.630 15.179 1.00 0.00 H ATOM 11319 H2 WAT 410 109.829 60.134 15.127 1.00 0.00 H TER 11321 WAT 410 ATOM 11321 O WAT 411 37.259 36.798 66.721 1.00 0.00 O ATOM 11322 H1 WAT 411 37.304 36.705 65.769 1.00 0.00 H ATOM 11323 H2 WAT 411 37.439 37.725 66.879 1.00 0.00 H TER 11325 WAT 411 ATOM 11325 O WAT 412 51.222 116.720 137.436 1.00 0.00 O ATOM 11326 H1 WAT 412 51.767 116.924 136.676 1.00 0.00 H ATOM 11327 H2 WAT 412 50.873 117.566 137.714 1.00 0.00 H TER 11329 WAT 412 ATOM 11329 O WAT 413 112.710 144.896 87.726 1.00 0.00 O ATOM 11330 H1 WAT 413 112.496 145.643 88.285 1.00 0.00 H ATOM 11331 H2 WAT 413 112.436 144.131 88.233 1.00 0.00 H TER 11333 WAT 413 ATOM 11333 O WAT 414 31.553 120.279 87.527 1.00 0.00 O ATOM 11334 H1 WAT 414 31.301 120.877 88.231 1.00 0.00 H ATOM 11335 H2 WAT 414 31.638 119.427 87.954 1.00 0.00 H TER 11337 WAT 414 ATOM 11337 O WAT 415 82.743 138.784 90.758 1.00 0.00 O ATOM 11338 H1 WAT 415 82.637 139.394 91.488 1.00 0.00 H ATOM 11339 H2 WAT 415 82.985 139.338 90.016 1.00 0.00 H TER 11341 WAT 415 ATOM 11341 O WAT 416 76.754 114.658 24.125 1.00 0.00 O ATOM 11342 H1 WAT 416 76.922 115.592 24.005 1.00 0.00 H ATOM 11343 H2 WAT 416 77.289 114.230 23.456 1.00 0.00 H TER 11345 WAT 416 ATOM 11345 O WAT 417 41.765 24.838 90.384 1.00 0.00 O ATOM 11346 H1 WAT 417 40.858 24.641 90.616 1.00 0.00 H ATOM 11347 H2 WAT 417 42.009 25.561 90.961 1.00 0.00 H TER 11349 WAT 417 ATOM 11349 O WAT 418 26.065 134.224 145.737 1.00 0.00 O ATOM 11350 H1 WAT 418 26.114 135.159 145.538 1.00 0.00 H ATOM 11351 H2 WAT 418 26.495 134.137 146.588 1.00 0.00 H TER 11353 WAT 418 ATOM 11353 O WAT 419 21.615 128.754 55.324 1.00 0.00 O ATOM 11354 H1 WAT 419 20.717 128.955 55.061 1.00 0.00 H ATOM 11355 H2 WAT 419 22.055 129.604 55.341 1.00 0.00 H TER 11357 WAT 419 ATOM 11357 O WAT 420 65.117 141.398 68.581 1.00 0.00 O ATOM 11358 H1 WAT 420 65.127 141.842 67.733 1.00 0.00 H ATOM 11359 H2 WAT 420 64.993 142.101 69.218 1.00 0.00 H TER 11361 WAT 420 ATOM 11361 O WAT 421 140.366 31.128 143.873 1.00 0.00 O ATOM 11362 H1 WAT 421 140.121 31.423 142.996 1.00 0.00 H ATOM 11363 H2 WAT 421 141.321 31.192 143.889 1.00 0.00 H TER 11365 WAT 421 ATOM 11365 O WAT 422 13.276 81.443 63.917 1.00 0.00 O ATOM 11366 H1 WAT 422 13.781 81.018 64.610 1.00 0.00 H ATOM 11367 H2 WAT 422 13.717 82.281 63.778 1.00 0.00 H TER 11369 WAT 422 ATOM 11369 O WAT 423 85.355 1.497 79.514 1.00 0.00 O ATOM 11370 H1 WAT 423 84.665 2.155 79.594 1.00 0.00 H ATOM 11371 H2 WAT 423 86.167 2.004 79.490 1.00 0.00 H TER 11373 WAT 423 ATOM 11373 O WAT 424 143.802 11.820 63.063 1.00 0.00 O ATOM 11374 H1 WAT 424 143.905 11.065 63.642 1.00 0.00 H ATOM 11375 H2 WAT 424 143.159 11.537 62.412 1.00 0.00 H TER 11377 WAT 424 ATOM 11377 O WAT 425 83.297 125.442 104.491 1.00 0.00 O ATOM 11378 H1 WAT 425 83.332 126.301 104.070 1.00 0.00 H ATOM 11379 H2 WAT 425 82.371 125.313 104.697 1.00 0.00 H TER 11381 WAT 425 ATOM 11381 O WAT 426 114.310 135.284 82.718 1.00 0.00 O ATOM 11382 H1 WAT 426 114.746 136.095 82.977 1.00 0.00 H ATOM 11383 H2 WAT 426 113.911 135.486 81.871 1.00 0.00 H TER 11385 WAT 426 ATOM 11385 O WAT 427 95.157 108.446 93.131 1.00 0.00 O ATOM 11386 H1 WAT 427 94.975 109.315 92.775 1.00 0.00 H ATOM 11387 H2 WAT 427 95.603 107.985 92.421 1.00 0.00 H TER 11389 WAT 427 ATOM 11389 O WAT 428 32.357 62.229 8.616 1.00 0.00 O ATOM 11390 H1 WAT 428 33.180 62.563 8.974 1.00 0.00 H ATOM 11391 H2 WAT 428 31.678 62.695 9.104 1.00 0.00 H TER 11393 WAT 428 ATOM 11393 O WAT 429 11.154 66.734 96.492 1.00 0.00 O ATOM 11394 H1 WAT 429 11.704 66.135 96.997 1.00 0.00 H ATOM 11395 H2 WAT 429 10.884 66.224 95.728 1.00 0.00 H TER 11397 WAT 429 ATOM 11397 O WAT 430 72.603 10.207 122.099 1.00 0.00 O ATOM 11398 H1 WAT 430 72.874 9.552 122.741 1.00 0.00 H ATOM 11399 H2 WAT 430 72.949 9.883 121.267 1.00 0.00 H TER 11401 WAT 430 ATOM 11401 O WAT 431 61.530 33.251 66.184 1.00 0.00 O ATOM 11402 H1 WAT 431 61.535 33.215 65.227 1.00 0.00 H ATOM 11403 H2 WAT 431 61.817 32.380 66.458 1.00 0.00 H TER 11405 WAT 431 ATOM 11405 O WAT 432 7.284 98.223 98.671 1.00 0.00 O ATOM 11406 H1 WAT 432 8.049 98.616 98.250 1.00 0.00 H ATOM 11407 H2 WAT 432 7.009 97.531 98.069 1.00 0.00 H TER 11409 WAT 432 ATOM 11409 O WAT 433 122.347 132.170 109.714 1.00 0.00 O ATOM 11410 H1 WAT 433 122.062 132.918 110.239 1.00 0.00 H ATOM 11411 H2 WAT 433 122.851 132.558 108.999 1.00 0.00 H TER 11413 WAT 433 ATOM 11413 O WAT 434 81.317 40.277 77.018 1.00 0.00 O ATOM 11414 H1 WAT 434 81.185 39.483 77.537 1.00 0.00 H ATOM 11415 H2 WAT 434 81.236 40.992 77.650 1.00 0.00 H TER 11417 WAT 434 ATOM 11417 O WAT 435 29.024 21.317 76.192 1.00 0.00 O ATOM 11418 H1 WAT 435 29.284 21.808 75.413 1.00 0.00 H ATOM 11419 H2 WAT 435 28.071 21.255 76.129 1.00 0.00 H TER 11421 WAT 435 ATOM 11421 O WAT 436 10.747 23.226 119.828 1.00 0.00 O ATOM 11422 H1 WAT 436 10.688 22.848 120.705 1.00 0.00 H ATOM 11423 H2 WAT 436 11.493 23.824 119.874 1.00 0.00 H TER 11425 WAT 436 ATOM 11425 O WAT 437 85.505 144.834 110.483 1.00 0.00 O ATOM 11426 H1 WAT 437 86.397 144.906 110.824 1.00 0.00 H ATOM 11427 H2 WAT 437 85.088 145.660 110.726 1.00 0.00 H TER 11429 WAT 437 ATOM 11429 O WAT 438 79.280 35.539 61.946 1.00 0.00 O ATOM 11430 H1 WAT 438 78.460 35.328 62.392 1.00 0.00 H ATOM 11431 H2 WAT 438 79.478 36.434 62.219 1.00 0.00 H TER 11433 WAT 438 ATOM 11433 O WAT 439 34.243 134.013 76.956 1.00 0.00 O ATOM 11434 H1 WAT 439 33.740 134.282 77.724 1.00 0.00 H ATOM 11435 H2 WAT 439 34.827 133.328 77.280 1.00 0.00 H TER 11437 WAT 439 ATOM 11437 O WAT 440 1.593 75.298 119.244 1.00 0.00 O ATOM 11438 H1 WAT 440 1.790 76.064 118.706 1.00 0.00 H ATOM 11439 H2 WAT 440 0.640 75.305 119.333 1.00 0.00 H TER 11441 WAT 440 ATOM 11441 O WAT 441 102.535 90.046 20.390 1.00 0.00 O ATOM 11442 H1 WAT 441 102.722 89.880 21.314 1.00 0.00 H ATOM 11443 H2 WAT 441 102.508 91.001 20.320 1.00 0.00 H TER 11445 WAT 441 ATOM 11445 O WAT 442 71.019 43.362 76.272 1.00 0.00 O ATOM 11446 H1 WAT 442 71.966 43.304 76.394 1.00 0.00 H ATOM 11447 H2 WAT 442 70.858 42.926 75.435 1.00 0.00 H TER 11449 WAT 442 ATOM 11449 O WAT 443 30.712 26.890 79.947 1.00 0.00 O ATOM 11450 H1 WAT 443 31.151 27.647 79.559 1.00 0.00 H ATOM 11451 H2 WAT 443 30.155 26.552 79.246 1.00 0.00 H TER 11453 WAT 443 ATOM 11453 O WAT 444 77.816 135.360 143.799 1.00 0.00 O ATOM 11454 H1 WAT 444 78.329 134.871 144.443 1.00 0.00 H ATOM 11455 H2 WAT 444 77.208 134.716 143.437 1.00 0.00 H TER 11457 WAT 444 ATOM 11457 O WAT 445 128.788 92.812 29.263 1.00 0.00 O ATOM 11458 H1 WAT 445 129.537 93.050 29.809 1.00 0.00 H ATOM 11459 H2 WAT 445 128.762 91.856 29.295 1.00 0.00 H TER 11461 WAT 445 ATOM 11461 O WAT 446 39.910 3.320 0.795 1.00 0.00 O ATOM 11462 H1 WAT 446 40.339 3.328 1.651 1.00 0.00 H ATOM 11463 H2 WAT 446 39.854 4.243 0.547 1.00 0.00 H TER 11465 WAT 446 ATOM 11465 O WAT 447 57.486 17.224 81.639 1.00 0.00 O ATOM 11466 H1 WAT 447 58.403 17.238 81.914 1.00 0.00 H ATOM 11467 H2 WAT 447 56.991 17.299 82.455 1.00 0.00 H TER 11469 WAT 447 ATOM 11469 O WAT 448 106.781 89.646 140.898 1.00 0.00 O ATOM 11470 H1 WAT 448 107.172 90.497 141.093 1.00 0.00 H ATOM 11471 H2 WAT 448 106.826 89.166 141.724 1.00 0.00 H TER 11473 WAT 448 ATOM 11473 O WAT 449 135.672 132.539 88.548 1.00 0.00 O ATOM 11474 H1 WAT 449 136.411 132.174 88.062 1.00 0.00 H ATOM 11475 H2 WAT 449 135.629 133.453 88.266 1.00 0.00 H TER 11477 WAT 449 ATOM 11477 O WAT 450 128.664 81.043 103.456 1.00 0.00 O ATOM 11478 H1 WAT 450 127.777 80.706 103.579 1.00 0.00 H ATOM 11479 H2 WAT 450 128.548 81.843 102.944 1.00 0.00 H TER 11481 WAT 450 ATOM 11481 O WAT 451 80.434 108.964 70.438 1.00 0.00 O ATOM 11482 H1 WAT 451 80.062 109.758 70.055 1.00 0.00 H ATOM 11483 H2 WAT 451 80.354 108.304 69.749 1.00 0.00 H TER 11485 WAT 451 ATOM 11485 O WAT 452 116.917 69.957 86.872 1.00 0.00 O ATOM 11486 H1 WAT 452 117.745 69.536 86.642 1.00 0.00 H ATOM 11487 H2 WAT 452 117.173 70.802 87.243 1.00 0.00 H TER 11489 WAT 452 ATOM 11489 O WAT 453 87.577 78.737 138.450 1.00 0.00 O ATOM 11490 H1 WAT 453 87.299 77.836 138.616 1.00 0.00 H ATOM 11491 H2 WAT 453 87.272 78.923 137.562 1.00 0.00 H TER 11493 WAT 453 ATOM 11493 O WAT 454 72.629 93.064 9.548 1.00 0.00 O ATOM 11494 H1 WAT 454 72.938 92.218 9.871 1.00 0.00 H ATOM 11495 H2 WAT 454 73.407 93.622 9.555 1.00 0.00 H TER 11497 WAT 454 ATOM 11497 O WAT 455 22.056 138.788 152.302 1.00 0.00 O ATOM 11498 H1 WAT 455 22.613 138.416 152.986 1.00 0.00 H ATOM 11499 H2 WAT 455 22.562 138.681 151.497 1.00 0.00 H TER 11501 WAT 455 ATOM 11501 O WAT 456 20.764 47.263 77.496 1.00 0.00 O ATOM 11502 H1 WAT 456 21.013 47.851 78.209 1.00 0.00 H ATOM 11503 H2 WAT 456 21.584 47.083 77.037 1.00 0.00 H TER 11505 WAT 456 ATOM 11505 O WAT 457 124.342 130.849 150.166 1.00 0.00 O ATOM 11506 H1 WAT 457 124.071 130.678 149.264 1.00 0.00 H ATOM 11507 H2 WAT 457 123.629 130.501 150.701 1.00 0.00 H TER 11509 WAT 457 ATOM 11509 O WAT 458 128.263 99.155 116.848 1.00 0.00 O ATOM 11510 H1 WAT 458 127.837 99.481 117.641 1.00 0.00 H ATOM 11511 H2 WAT 458 129.004 99.745 116.714 1.00 0.00 H TER 11513 WAT 458 ATOM 11513 O WAT 459 89.140 35.088 140.738 1.00 0.00 O ATOM 11514 H1 WAT 459 88.428 35.298 141.341 1.00 0.00 H ATOM 11515 H2 WAT 459 89.812 34.688 141.290 1.00 0.00 H TER 11517 WAT 459 ATOM 11517 O WAT 460 67.488 18.843 22.211 1.00 0.00 O ATOM 11518 H1 WAT 460 66.734 19.123 22.730 1.00 0.00 H ATOM 11519 H2 WAT 460 68.247 19.156 22.704 1.00 0.00 H TER 11521 WAT 460 ATOM 11521 O WAT 461 128.159 104.410 118.218 1.00 0.00 O ATOM 11522 H1 WAT 461 128.014 105.266 117.815 1.00 0.00 H ATOM 11523 H2 WAT 461 128.222 104.594 119.155 1.00 0.00 H TER 11525 WAT 461 ATOM 11525 O WAT 462 92.651 55.336 69.733 1.00 0.00 O ATOM 11526 H1 WAT 462 93.347 54.764 69.406 1.00 0.00 H ATOM 11527 H2 WAT 462 92.987 56.222 69.599 1.00 0.00 H TER 11529 WAT 462 ATOM 11529 O WAT 463 100.634 98.033 99.969 1.00 0.00 O ATOM 11530 H1 WAT 463 100.771 98.014 99.022 1.00 0.00 H ATOM 11531 H2 WAT 463 100.209 98.874 100.133 1.00 0.00 H TER 11533 WAT 463 ATOM 11533 O WAT 464 14.864 28.709 128.033 1.00 0.00 O ATOM 11534 H1 WAT 464 15.154 28.677 127.121 1.00 0.00 H ATOM 11535 H2 WAT 464 15.550 28.252 128.519 1.00 0.00 H TER 11537 WAT 464 ATOM 11537 O WAT 465 47.810 62.434 106.057 1.00 0.00 O ATOM 11538 H1 WAT 465 47.890 61.639 106.584 1.00 0.00 H ATOM 11539 H2 WAT 465 48.036 63.144 106.658 1.00 0.00 H TER 11541 WAT 465 ATOM 11541 O WAT 466 120.417 14.683 107.294 1.00 0.00 O ATOM 11542 H1 WAT 466 119.917 13.889 107.104 1.00 0.00 H ATOM 11543 H2 WAT 466 120.903 14.474 108.092 1.00 0.00 H TER 11545 WAT 466 ATOM 11545 O WAT 467 57.958 118.387 151.107 1.00 0.00 O ATOM 11546 H1 WAT 467 58.742 118.461 150.563 1.00 0.00 H ATOM 11547 H2 WAT 467 57.447 117.688 150.697 1.00 0.00 H TER 11549 WAT 467 ATOM 11549 O WAT 468 29.580 48.151 118.451 1.00 0.00 O ATOM 11550 H1 WAT 468 29.419 48.977 118.907 1.00 0.00 H ATOM 11551 H2 WAT 468 29.266 47.479 119.056 1.00 0.00 H TER 11553 WAT 468 ATOM 11553 O WAT 469 28.645 123.077 87.353 1.00 0.00 O ATOM 11554 H1 WAT 469 28.724 122.147 87.567 1.00 0.00 H ATOM 11555 H2 WAT 469 29.516 123.437 87.520 1.00 0.00 H TER 11557 WAT 469 ATOM 11557 O WAT 470 142.881 81.864 2.898 1.00 0.00 O ATOM 11558 H1 WAT 470 143.157 81.418 3.699 1.00 0.00 H ATOM 11559 H2 WAT 470 142.767 82.777 3.161 1.00 0.00 H TER 11561 WAT 470 ATOM 11561 O WAT 471 32.883 96.527 126.147 1.00 0.00 O ATOM 11562 H1 WAT 471 32.357 95.933 126.683 1.00 0.00 H ATOM 11563 H2 WAT 471 32.494 97.389 126.294 1.00 0.00 H TER 11565 WAT 471 ATOM 11565 O WAT 472 129.168 73.131 155.794 1.00 0.00 O ATOM 11566 H1 WAT 472 130.100 73.336 155.723 1.00 0.00 H ATOM 11567 H2 WAT 472 128.852 73.696 156.499 1.00 0.00 H TER 11569 WAT 472 ATOM 11569 O WAT 473 91.202 12.163 130.712 1.00 0.00 O ATOM 11570 H1 WAT 473 90.945 12.850 131.327 1.00 0.00 H ATOM 11571 H2 WAT 473 91.421 11.415 131.266 1.00 0.00 H TER 11573 WAT 473 ATOM 11573 O WAT 474 67.826 54.681 102.851 1.00 0.00 O ATOM 11574 H1 WAT 474 68.762 54.602 102.668 1.00 0.00 H ATOM 11575 H2 WAT 474 67.646 55.618 102.776 1.00 0.00 H TER 11577 WAT 474 ATOM 11577 O WAT 475 108.813 131.117 67.453 1.00 0.00 O ATOM 11578 H1 WAT 475 108.275 131.553 66.792 1.00 0.00 H ATOM 11579 H2 WAT 475 109.326 130.477 66.960 1.00 0.00 H TER 11581 WAT 475 ATOM 11581 O WAT 476 98.445 99.937 154.501 1.00 0.00 O ATOM 11582 H1 WAT 476 98.843 99.455 155.226 1.00 0.00 H ATOM 11583 H2 WAT 476 97.762 99.354 154.172 1.00 0.00 H TER 11585 WAT 476 ATOM 11585 O WAT 477 22.282 38.005 107.495 1.00 0.00 O ATOM 11586 H1 WAT 477 21.433 38.428 107.366 1.00 0.00 H ATOM 11587 H2 WAT 477 22.480 37.602 106.650 1.00 0.00 H TER 11589 WAT 477 ATOM 11589 O WAT 478 119.285 52.121 124.656 1.00 0.00 O ATOM 11590 H1 WAT 478 118.396 52.149 124.302 1.00 0.00 H ATOM 11591 H2 WAT 478 119.184 51.739 125.528 1.00 0.00 H TER 11593 WAT 478 ATOM 11593 O WAT 479 49.120 84.939 117.020 1.00 0.00 O ATOM 11594 H1 WAT 479 48.308 85.135 116.552 1.00 0.00 H ATOM 11595 H2 WAT 479 48.903 85.075 117.943 1.00 0.00 H TER 11597 WAT 479 ATOM 11597 O WAT 480 70.189 16.912 98.791 1.00 0.00 O ATOM 11598 H1 WAT 480 70.623 16.131 98.447 1.00 0.00 H ATOM 11599 H2 WAT 480 69.263 16.780 98.587 1.00 0.00 H TER 11601 WAT 480 ATOM 11601 O WAT 481 2.784 115.643 134.238 1.00 0.00 O ATOM 11602 H1 WAT 481 2.431 116.423 134.666 1.00 0.00 H ATOM 11603 H2 WAT 481 3.524 115.967 133.724 1.00 0.00 H TER 11605 WAT 481 ATOM 11605 O WAT 482 87.649 56.832 18.023 1.00 0.00 O ATOM 11606 H1 WAT 482 86.715 56.623 18.039 1.00 0.00 H ATOM 11607 H2 WAT 482 87.700 57.665 17.554 1.00 0.00 H TER 11609 WAT 482 ATOM 11609 O WAT 483 67.028 105.789 107.610 1.00 0.00 O ATOM 11610 H1 WAT 483 66.445 105.033 107.544 1.00 0.00 H ATOM 11611 H2 WAT 483 66.459 106.507 107.889 1.00 0.00 H TER 11613 WAT 483 ATOM 11613 O WAT 484 125.657 47.899 134.758 1.00 0.00 O ATOM 11614 H1 WAT 484 126.505 48.240 134.473 1.00 0.00 H ATOM 11615 H2 WAT 484 125.019 48.517 134.402 1.00 0.00 H TER 11617 WAT 484 ATOM 11617 O WAT 485 100.517 77.740 89.050 1.00 0.00 O ATOM 11618 H1 WAT 485 100.661 76.885 88.644 1.00 0.00 H ATOM 11619 H2 WAT 485 99.949 78.204 88.435 1.00 0.00 H TER 11621 WAT 485 ATOM 11621 O WAT 486 102.605 80.383 131.542 1.00 0.00 O ATOM 11622 H1 WAT 486 102.935 81.281 131.575 1.00 0.00 H ATOM 11623 H2 WAT 486 102.102 80.343 130.729 1.00 0.00 H TER 11625 WAT 486 ATOM 11625 O WAT 487 3.470 3.408 142.726 1.00 0.00 O ATOM 11626 H1 WAT 487 2.915 3.966 143.270 1.00 0.00 H ATOM 11627 H2 WAT 487 4.267 3.921 142.592 1.00 0.00 H TER 11629 WAT 487 ATOM 11629 O WAT 488 46.120 38.208 125.171 1.00 0.00 O ATOM 11630 H1 WAT 488 46.238 38.998 124.644 1.00 0.00 H ATOM 11631 H2 WAT 488 45.696 37.587 124.580 1.00 0.00 H TER 11633 WAT 488 ATOM 11633 O WAT 489 128.396 69.157 63.085 1.00 0.00 O ATOM 11634 H1 WAT 489 128.184 68.237 62.927 1.00 0.00 H ATOM 11635 H2 WAT 489 129.092 69.354 62.458 1.00 0.00 H TER 11637 WAT 489 ATOM 11637 O WAT 490 98.436 124.922 100.713 1.00 0.00 O ATOM 11638 H1 WAT 490 98.615 125.861 100.760 1.00 0.00 H ATOM 11639 H2 WAT 490 98.290 124.660 101.623 1.00 0.00 H TER 11641 WAT 490 ATOM 11641 O WAT 491 98.304 134.036 85.715 1.00 0.00 O ATOM 11642 H1 WAT 491 97.875 133.738 86.517 1.00 0.00 H ATOM 11643 H2 WAT 491 97.823 133.601 85.011 1.00 0.00 H TER 11645 WAT 491 ATOM 11645 O WAT 492 132.831 77.542 61.050 1.00 0.00 O ATOM 11646 H1 WAT 492 132.902 77.632 62.000 1.00 0.00 H ATOM 11647 H2 WAT 492 131.906 77.347 60.897 1.00 0.00 H TER 11649 WAT 492 ATOM 11649 O WAT 493 64.002 60.247 86.588 1.00 0.00 O ATOM 11650 H1 WAT 493 64.121 60.627 87.459 1.00 0.00 H ATOM 11651 H2 WAT 493 64.364 59.364 86.660 1.00 0.00 H TER 11653 WAT 493 ATOM 11653 O WAT 494 67.193 31.291 53.970 1.00 0.00 O ATOM 11654 H1 WAT 494 67.206 32.248 53.943 1.00 0.00 H ATOM 11655 H2 WAT 494 66.547 31.042 53.309 1.00 0.00 H TER 11657 WAT 494 ATOM 11657 O WAT 495 40.130 117.073 113.125 1.00 0.00 O ATOM 11658 H1 WAT 495 40.289 116.592 112.312 1.00 0.00 H ATOM 11659 H2 WAT 495 39.180 117.179 113.158 1.00 0.00 H TER 11661 WAT 495 ATOM 11661 O WAT 496 63.809 18.376 103.921 1.00 0.00 O ATOM 11662 H1 WAT 496 64.406 17.817 104.418 1.00 0.00 H ATOM 11663 H2 WAT 496 64.148 18.350 103.026 1.00 0.00 H TER 11665 WAT 496 ATOM 11665 O WAT 497 38.691 109.929 21.037 1.00 0.00 O ATOM 11666 H1 WAT 497 39.506 110.155 20.589 1.00 0.00 H ATOM 11667 H2 WAT 497 38.560 110.637 21.667 1.00 0.00 H TER 11669 WAT 497 ATOM 11669 O WAT 498 113.060 15.639 5.322 1.00 0.00 O ATOM 11670 H1 WAT 498 113.163 14.689 5.264 1.00 0.00 H ATOM 11671 H2 WAT 498 112.580 15.778 6.138 1.00 0.00 H TER 11673 WAT 498 ATOM 11673 O WAT 499 106.063 11.682 68.361 1.00 0.00 O ATOM 11674 H1 WAT 499 106.768 11.104 68.070 1.00 0.00 H ATOM 11675 H2 WAT 499 105.431 11.670 67.642 1.00 0.00 H TER 11677 WAT 499 ATOM 11677 O WAT 500 71.303 128.057 106.763 1.00 0.00 O ATOM 11678 H1 WAT 500 70.857 127.801 107.571 1.00 0.00 H ATOM 11679 H2 WAT 500 71.518 128.981 106.890 1.00 0.00 H TER 11681 WAT 500 ATOM 11681 O WAT 501 109.149 18.340 64.176 1.00 0.00 O ATOM 11682 H1 WAT 501 109.700 18.907 64.714 1.00 0.00 H ATOM 11683 H2 WAT 501 109.060 18.809 63.346 1.00 0.00 H TER 11685 WAT 501 ATOM 11685 O WAT 502 94.313 61.591 139.208 1.00 0.00 O ATOM 11686 H1 WAT 502 94.715 61.048 138.530 1.00 0.00 H ATOM 11687 H2 WAT 502 93.386 61.622 138.971 1.00 0.00 H TER 11689 WAT 502 ATOM 11689 O WAT 503 114.778 92.449 89.418 1.00 0.00 O ATOM 11690 H1 WAT 503 114.292 92.748 88.650 1.00 0.00 H ATOM 11691 H2 WAT 503 115.681 92.361 89.111 1.00 0.00 H TER 11693 WAT 503 ATOM 11693 O WAT 504 106.430 18.413 10.248 1.00 0.00 O ATOM 11694 H1 WAT 504 105.552 18.653 9.953 1.00 0.00 H ATOM 11695 H2 WAT 504 106.325 18.223 11.180 1.00 0.00 H TER 11697 WAT 504 ATOM 11697 O WAT 505 49.050 101.804 151.917 1.00 0.00 O ATOM 11698 H1 WAT 505 49.498 102.198 152.665 1.00 0.00 H ATOM 11699 H2 WAT 505 49.175 100.862 152.032 1.00 0.00 H TER 11701 WAT 505 ATOM 11701 O WAT 506 106.215 58.188 105.542 1.00 0.00 O ATOM 11702 H1 WAT 506 105.823 58.699 106.250 1.00 0.00 H ATOM 11703 H2 WAT 506 106.870 58.772 105.160 1.00 0.00 H TER 11705 WAT 506 ATOM 11705 O WAT 507 56.456 96.237 71.003 1.00 0.00 O ATOM 11706 H1 WAT 507 56.812 95.883 70.188 1.00 0.00 H ATOM 11707 H2 WAT 507 55.704 95.678 71.199 1.00 0.00 H TER 11709 WAT 507 ATOM 11709 O WAT 508 56.829 6.075 55.327 1.00 0.00 O ATOM 11710 H1 WAT 508 56.374 5.800 54.531 1.00 0.00 H ATOM 11711 H2 WAT 508 57.148 5.260 55.714 1.00 0.00 H TER 11713 WAT 508 ATOM 11713 O WAT 509 22.226 50.196 55.637 1.00 0.00 O ATOM 11714 H1 WAT 509 21.949 50.937 56.177 1.00 0.00 H ATOM 11715 H2 WAT 509 22.324 50.563 54.759 1.00 0.00 H TER 11717 WAT 509 ATOM 11717 O WAT 510 14.422 42.828 116.253 1.00 0.00 O ATOM 11718 H1 WAT 510 15.192 42.707 116.808 1.00 0.00 H ATOM 11719 H2 WAT 510 13.998 41.970 116.240 1.00 0.00 H TER 11721 WAT 510 ATOM 11721 O WAT 511 142.603 127.737 136.581 1.00 0.00 O ATOM 11722 H1 WAT 511 142.682 127.950 137.511 1.00 0.00 H ATOM 11723 H2 WAT 511 143.114 128.412 136.136 1.00 0.00 H TER 11725 WAT 511 ATOM 11725 O WAT 512 106.792 131.424 155.617 1.00 0.00 O ATOM 11726 H1 WAT 512 106.812 131.009 156.480 1.00 0.00 H ATOM 11727 H2 WAT 512 107.237 132.262 155.745 1.00 0.00 H TER 11729 WAT 512 ATOM 11729 O WAT 513 0.132 14.176 61.353 1.00 0.00 O ATOM 11730 H1 WAT 513 0.738 14.646 60.780 1.00 0.00 H ATOM 11731 H2 WAT 513 -0.640 14.020 60.809 1.00 0.00 H TER 11733 WAT 513 ATOM 11733 O WAT 514 80.874 99.342 -0.029 1.00 0.00 O ATOM 11734 H1 WAT 514 81.262 99.799 0.717 1.00 0.00 H ATOM 11735 H2 WAT 514 80.469 98.563 0.351 1.00 0.00 H TER 11737 WAT 514 ATOM 11737 O WAT 515 135.452 4.518 129.257 1.00 0.00 O ATOM 11738 H1 WAT 515 135.960 5.260 128.930 1.00 0.00 H ATOM 11739 H2 WAT 515 134.563 4.678 128.939 1.00 0.00 H TER 11741 WAT 515 ATOM 11741 O WAT 516 79.430 114.375 89.168 1.00 0.00 O ATOM 11742 H1 WAT 516 79.100 115.128 88.676 1.00 0.00 H ATOM 11743 H2 WAT 516 78.648 113.862 89.372 1.00 0.00 H TER 11745 WAT 516 ATOM 11745 O WAT 517 101.703 5.356 91.002 1.00 0.00 O ATOM 11746 H1 WAT 517 101.403 5.881 91.745 1.00 0.00 H ATOM 11747 H2 WAT 517 102.634 5.215 91.170 1.00 0.00 H TER 11749 WAT 517 ATOM 11749 O WAT 518 11.289 15.147 106.970 1.00 0.00 O ATOM 11750 H1 WAT 518 11.598 14.989 107.862 1.00 0.00 H ATOM 11751 H2 WAT 518 10.439 14.709 106.930 1.00 0.00 H TER 11753 WAT 518 ATOM 11753 O WAT 519 26.187 93.721 101.999 1.00 0.00 O ATOM 11754 H1 WAT 519 26.479 93.989 101.128 1.00 0.00 H ATOM 11755 H2 WAT 519 26.856 93.106 102.298 1.00 0.00 H TER 11757 WAT 519 ATOM 11757 O WAT 520 7.848 35.521 82.585 1.00 0.00 O ATOM 11758 H1 WAT 520 8.779 35.726 82.498 1.00 0.00 H ATOM 11759 H2 WAT 520 7.821 34.789 83.201 1.00 0.00 H TER 11761 WAT 520 ATOM 11761 O WAT 521 140.163 35.540 67.445 1.00 0.00 O ATOM 11762 H1 WAT 521 140.435 36.270 68.002 1.00 0.00 H ATOM 11763 H2 WAT 521 140.078 35.923 66.572 1.00 0.00 H TER 11765 WAT 521 ATOM 11765 O WAT 522 103.778 93.638 148.734 1.00 0.00 O ATOM 11766 H1 WAT 522 104.733 93.697 148.700 1.00 0.00 H ATOM 11767 H2 WAT 522 103.519 94.304 149.370 1.00 0.00 H TER 11769 WAT 522 ATOM 11769 O WAT 523 114.226 128.217 75.536 1.00 0.00 O ATOM 11770 H1 WAT 523 114.588 127.665 76.229 1.00 0.00 H ATOM 11771 H2 WAT 523 114.735 129.026 75.582 1.00 0.00 H TER 11773 WAT 523 ATOM 11773 O WAT 524 31.216 51.292 144.342 1.00 0.00 O ATOM 11774 H1 WAT 524 31.260 51.499 145.276 1.00 0.00 H ATOM 11775 H2 WAT 524 31.849 51.883 143.936 1.00 0.00 H TER 11777 WAT 524 ATOM 11777 O WAT 525 97.151 75.136 118.612 1.00 0.00 O ATOM 11778 H1 WAT 525 97.994 75.509 118.354 1.00 0.00 H ATOM 11779 H2 WAT 525 97.326 74.706 119.449 1.00 0.00 H TER 11781 WAT 525 ATOM 11781 O WAT 526 122.763 49.077 21.723 1.00 0.00 O ATOM 11782 H1 WAT 526 122.057 48.431 21.713 1.00 0.00 H ATOM 11783 H2 WAT 526 123.169 48.975 22.584 1.00 0.00 H TER 11785 WAT 526 ATOM 11785 O WAT 527 67.610 80.526 61.332 1.00 0.00 O ATOM 11786 H1 WAT 527 67.734 81.473 61.385 1.00 0.00 H ATOM 11787 H2 WAT 527 68.458 80.188 61.044 1.00 0.00 H TER 11789 WAT 527 ATOM 11789 O WAT 528 131.745 71.384 93.559 1.00 0.00 O ATOM 11790 H1 WAT 528 131.234 71.338 94.367 1.00 0.00 H ATOM 11791 H2 WAT 528 131.554 72.252 93.203 1.00 0.00 H TER 11793 WAT 528 ATOM 11793 O WAT 529 88.907 15.410 134.492 1.00 0.00 O ATOM 11794 H1 WAT 529 88.791 16.354 134.390 1.00 0.00 H ATOM 11795 H2 WAT 529 88.051 15.039 134.277 1.00 0.00 H TER 11797 WAT 529 ATOM 11797 O WAT 530 133.707 136.728 64.129 1.00 0.00 O ATOM 11798 H1 WAT 530 134.618 136.598 63.866 1.00 0.00 H ATOM 11799 H2 WAT 530 133.713 136.607 65.079 1.00 0.00 H TER 11801 WAT 530 ATOM 11801 O WAT 531 69.082 10.119 93.090 1.00 0.00 O ATOM 11802 H1 WAT 531 69.000 9.298 92.605 1.00 0.00 H ATOM 11803 H2 WAT 531 70.019 10.196 93.274 1.00 0.00 H TER 11805 WAT 531 ATOM 11805 O WAT 532 69.022 27.726 10.253 1.00 0.00 O ATOM 11806 H1 WAT 532 69.072 27.666 11.207 1.00 0.00 H ATOM 11807 H2 WAT 532 68.275 28.300 10.088 1.00 0.00 H TER 11809 WAT 532 ATOM 11809 O WAT 533 125.456 111.153 7.330 1.00 0.00 O ATOM 11810 H1 WAT 533 126.228 110.926 6.812 1.00 0.00 H ATOM 11811 H2 WAT 533 124.724 111.064 6.720 1.00 0.00 H TER 11813 WAT 533 ATOM 11813 O WAT 534 59.365 42.122 79.237 1.00 0.00 O ATOM 11814 H1 WAT 534 60.238 41.892 79.556 1.00 0.00 H ATOM 11815 H2 WAT 534 58.970 41.284 78.996 1.00 0.00 H TER 11817 WAT 534 ATOM 11817 O WAT 535 17.626 34.706 147.280 1.00 0.00 O ATOM 11818 H1 WAT 535 18.479 34.308 147.103 1.00 0.00 H ATOM 11819 H2 WAT 535 17.829 35.486 147.795 1.00 0.00 H TER 11821 WAT 535 ATOM 11821 O WAT 536 65.249 70.584 125.088 1.00 0.00 O ATOM 11822 H1 WAT 536 65.174 71.284 125.737 1.00 0.00 H ATOM 11823 H2 WAT 536 66.174 70.581 124.844 1.00 0.00 H TER 11825 WAT 536 ATOM 11825 O WAT 537 19.151 75.328 19.694 1.00 0.00 O ATOM 11826 H1 WAT 537 18.989 74.921 18.843 1.00 0.00 H ATOM 11827 H2 WAT 537 19.753 74.728 20.135 1.00 0.00 H TER 11829 WAT 537 ATOM 11829 O WAT 538 59.522 127.551 127.399 1.00 0.00 O ATOM 11830 H1 WAT 538 58.705 127.062 127.306 1.00 0.00 H ATOM 11831 H2 WAT 538 59.432 128.285 126.790 1.00 0.00 H TER 11833 WAT 538 ATOM 11833 O WAT 539 62.316 69.957 131.562 1.00 0.00 O ATOM 11834 H1 WAT 539 62.849 69.634 130.836 1.00 0.00 H ATOM 11835 H2 WAT 539 62.330 69.247 132.204 1.00 0.00 H TER 11837 WAT 539 ATOM 11837 O WAT 540 22.318 119.160 117.272 1.00 0.00 O ATOM 11838 H1 WAT 540 21.692 119.872 117.399 1.00 0.00 H ATOM 11839 H2 WAT 540 22.357 118.721 118.122 1.00 0.00 H TER 11841 WAT 540 ATOM 11841 O WAT 541 18.102 121.893 116.011 1.00 0.00 O ATOM 11842 H1 WAT 541 17.315 121.604 116.473 1.00 0.00 H ATOM 11843 H2 WAT 541 18.072 121.429 115.175 1.00 0.00 H TER 11845 WAT 541 ATOM 11845 O WAT 542 37.524 13.332 136.010 1.00 0.00 O ATOM 11846 H1 WAT 542 37.215 12.462 135.760 1.00 0.00 H ATOM 11847 H2 WAT 542 37.236 13.437 136.917 1.00 0.00 H TER 11849 WAT 542 ATOM 11849 O WAT 543 92.838 7.541 71.867 1.00 0.00 O ATOM 11850 H1 WAT 543 91.993 7.982 71.951 1.00 0.00 H ATOM 11851 H2 WAT 543 93.067 7.636 70.942 1.00 0.00 H TER 11853 WAT 543 ATOM 11853 O WAT 544 48.124 29.752 65.182 1.00 0.00 O ATOM 11854 H1 WAT 544 47.980 29.461 64.281 1.00 0.00 H ATOM 11855 H2 WAT 544 47.640 30.575 65.248 1.00 0.00 H TER 11857 WAT 544 ATOM 11857 O WAT 545 102.127 139.043 58.824 1.00 0.00 O ATOM 11858 H1 WAT 545 102.912 139.365 58.381 1.00 0.00 H ATOM 11859 H2 WAT 545 101.873 138.265 58.328 1.00 0.00 H TER 11861 WAT 545 ATOM 11861 O WAT 546 90.386 44.333 91.514 1.00 0.00 O ATOM 11862 H1 WAT 546 89.837 44.638 90.792 1.00 0.00 H ATOM 11863 H2 WAT 546 91.069 43.811 91.093 1.00 0.00 H TER 11865 WAT 546 ATOM 11865 O WAT 547 106.693 102.555 111.049 1.00 0.00 O ATOM 11866 H1 WAT 547 106.100 101.866 110.748 1.00 0.00 H ATOM 11867 H2 WAT 547 106.666 102.495 112.003 1.00 0.00 H TER 11869 WAT 547 ATOM 11869 O WAT 548 104.138 130.242 92.652 1.00 0.00 O ATOM 11870 H1 WAT 548 103.413 130.329 92.034 1.00 0.00 H ATOM 11871 H2 WAT 548 103.821 129.620 93.307 1.00 0.00 H TER 11873 WAT 548 ATOM 11873 O WAT 549 106.915 142.399 106.923 1.00 0.00 O ATOM 11874 H1 WAT 549 107.758 141.946 106.918 1.00 0.00 H ATOM 11875 H2 WAT 549 106.305 141.774 106.532 1.00 0.00 H TER 11877 WAT 549 ATOM 11877 O WAT 550 15.134 18.029 136.854 1.00 0.00 O ATOM 11878 H1 WAT 550 15.892 18.230 137.403 1.00 0.00 H ATOM 11879 H2 WAT 550 15.449 17.357 136.249 1.00 0.00 H TER 11881 WAT 550 ATOM 11881 O WAT 551 127.030 79.822 143.176 1.00 0.00 O ATOM 11882 H1 WAT 551 127.760 79.413 143.642 1.00 0.00 H ATOM 11883 H2 WAT 551 127.400 80.080 142.332 1.00 0.00 H TER 11885 WAT 551 ATOM 11885 O WAT 552 87.869 3.765 12.596 1.00 0.00 O ATOM 11886 H1 WAT 552 87.918 3.677 11.644 1.00 0.00 H ATOM 11887 H2 WAT 552 88.700 4.169 12.843 1.00 0.00 H TER 11889 WAT 552 ATOM 11889 O WAT 553 140.990 135.712 90.958 1.00 0.00 O ATOM 11890 H1 WAT 553 140.239 135.197 90.662 1.00 0.00 H ATOM 11891 H2 WAT 553 140.634 136.286 91.636 1.00 0.00 H TER 11893 WAT 553 ATOM 11893 O WAT 554 35.625 36.546 20.029 1.00 0.00 O ATOM 11894 H1 WAT 554 34.975 36.270 19.382 1.00 0.00 H ATOM 11895 H2 WAT 554 35.140 37.113 20.628 1.00 0.00 H TER 11897 WAT 554 ATOM 11897 O WAT 555 59.625 23.416 87.690 1.00 0.00 O ATOM 11898 H1 WAT 555 58.931 24.072 87.622 1.00 0.00 H ATOM 11899 H2 WAT 555 59.188 22.585 87.504 1.00 0.00 H TER 11901 WAT 555 ATOM 11901 O WAT 556 39.794 107.370 19.131 1.00 0.00 O ATOM 11902 H1 WAT 556 40.489 107.676 18.549 1.00 0.00 H ATOM 11903 H2 WAT 556 39.639 106.464 18.863 1.00 0.00 H TER 11905 WAT 556 ATOM 11905 O WAT 557 117.042 145.958 157.091 1.00 0.00 O ATOM 11906 H1 WAT 557 117.070 145.277 157.763 1.00 0.00 H ATOM 11907 H2 WAT 557 116.147 146.294 157.127 1.00 0.00 H TER 11909 WAT 557 ATOM 11909 O WAT 558 33.762 23.866 111.577 1.00 0.00 O ATOM 11910 H1 WAT 558 34.478 24.108 112.164 1.00 0.00 H ATOM 11911 H2 WAT 558 33.157 23.370 112.129 1.00 0.00 H TER 11913 WAT 558 ATOM 11913 O WAT 559 119.491 55.592 135.072 1.00 0.00 O ATOM 11914 H1 WAT 559 119.619 56.506 135.325 1.00 0.00 H ATOM 11915 H2 WAT 559 118.730 55.308 135.579 1.00 0.00 H TER 11917 WAT 559 ATOM 11917 O WAT 560 53.572 7.305 94.450 1.00 0.00 O ATOM 11918 H1 WAT 560 53.281 8.094 93.992 1.00 0.00 H ATOM 11919 H2 WAT 560 54.471 7.171 94.148 1.00 0.00 H TER 11921 WAT 560 ATOM 11921 O WAT 561 1.270 28.444 99.414 1.00 0.00 O ATOM 11922 H1 WAT 561 1.879 29.075 99.799 1.00 0.00 H ATOM 11923 H2 WAT 561 1.291 27.697 100.012 1.00 0.00 H TER 11925 WAT 561 ATOM 11925 O WAT 562 110.469 93.166 150.222 1.00 0.00 O ATOM 11926 H1 WAT 562 110.489 92.750 149.360 1.00 0.00 H ATOM 11927 H2 WAT 562 109.637 92.887 150.604 1.00 0.00 H TER 11929 WAT 562 ATOM 11929 O WAT 563 110.323 18.481 131.656 1.00 0.00 O ATOM 11930 H1 WAT 563 110.571 18.040 132.468 1.00 0.00 H ATOM 11931 H2 WAT 563 111.054 18.315 131.060 1.00 0.00 H TER 11933 WAT 563 ATOM 11933 O WAT 564 49.671 132.811 90.568 1.00 0.00 O ATOM 11934 H1 WAT 564 49.406 132.630 89.666 1.00 0.00 H ATOM 11935 H2 WAT 564 50.456 132.279 90.699 1.00 0.00 H TER 11937 WAT 564 ATOM 11937 O WAT 565 70.355 52.179 88.409 1.00 0.00 O ATOM 11938 H1 WAT 565 70.796 51.957 87.589 1.00 0.00 H ATOM 11939 H2 WAT 565 70.947 51.865 89.093 1.00 0.00 H TER 11941 WAT 565 ATOM 11941 O WAT 566 129.566 44.936 64.267 1.00 0.00 O ATOM 11942 H1 WAT 566 129.862 44.925 63.357 1.00 0.00 H ATOM 11943 H2 WAT 566 129.335 45.850 64.433 1.00 0.00 H TER 11945 WAT 566 ATOM 11945 O WAT 567 115.239 130.812 75.859 1.00 0.00 O ATOM 11946 H1 WAT 567 115.780 130.468 76.571 1.00 0.00 H ATOM 11947 H2 WAT 567 114.816 131.585 76.232 1.00 0.00 H TER 11949 WAT 567 ATOM 11949 O WAT 568 79.790 135.027 103.721 1.00 0.00 O ATOM 11950 H1 WAT 568 79.864 135.531 102.910 1.00 0.00 H ATOM 11951 H2 WAT 568 80.695 134.889 104.001 1.00 0.00 H TER 11953 WAT 568 ATOM 11953 O WAT 569 91.912 0.739 12.610 1.00 0.00 O ATOM 11954 H1 WAT 569 91.655 0.706 13.532 1.00 0.00 H ATOM 11955 H2 WAT 569 91.952 1.674 12.407 1.00 0.00 H TER 11957 WAT 569 ATOM 11957 O WAT 570 50.684 121.407 73.300 1.00 0.00 O ATOM 11958 H1 WAT 570 50.339 122.104 73.858 1.00 0.00 H ATOM 11959 H2 WAT 570 50.380 120.598 73.712 1.00 0.00 H TER 11961 WAT 570 ATOM 11961 O WAT 571 94.987 88.096 122.129 1.00 0.00 O ATOM 11962 H1 WAT 571 94.172 88.254 121.652 1.00 0.00 H ATOM 11963 H2 WAT 571 95.019 88.793 122.785 1.00 0.00 H TER 11965 WAT 571 ATOM 11965 O WAT 572 57.822 25.855 64.627 1.00 0.00 O ATOM 11966 H1 WAT 572 58.736 25.572 64.660 1.00 0.00 H ATOM 11967 H2 WAT 572 57.869 26.809 64.565 1.00 0.00 H TER 11969 WAT 572 ATOM 11969 O WAT 573 68.441 16.396 64.109 1.00 0.00 O ATOM 11970 H1 WAT 573 68.256 16.576 63.187 1.00 0.00 H ATOM 11971 H2 WAT 573 68.450 17.258 64.524 1.00 0.00 H TER 11973 WAT 573 ATOM 11973 O WAT 574 33.335 71.658 134.571 1.00 0.00 O ATOM 11974 H1 WAT 574 32.816 71.241 135.259 1.00 0.00 H ATOM 11975 H2 WAT 574 33.553 70.945 133.971 1.00 0.00 H TER 11977 WAT 574 ATOM 11977 O WAT 575 51.086 115.465 72.800 1.00 0.00 O ATOM 11978 H1 WAT 575 52.008 115.412 73.051 1.00 0.00 H ATOM 11979 H2 WAT 575 50.983 116.351 72.453 1.00 0.00 H TER 11981 WAT 575 ATOM 11981 O WAT 576 121.565 67.606 106.660 1.00 0.00 O ATOM 11982 H1 WAT 576 122.308 67.624 106.057 1.00 0.00 H ATOM 11983 H2 WAT 576 121.802 68.224 107.351 1.00 0.00 H TER 11985 WAT 576 ATOM 11985 O WAT 577 18.201 43.920 72.865 1.00 0.00 O ATOM 11986 H1 WAT 577 18.846 43.336 73.265 1.00 0.00 H ATOM 11987 H2 WAT 577 17.533 44.036 73.541 1.00 0.00 H TER 11989 WAT 577 ATOM 11989 O WAT 578 93.622 55.001 119.934 1.00 0.00 O ATOM 11990 H1 WAT 578 93.787 54.711 119.037 1.00 0.00 H ATOM 11991 H2 WAT 578 92.695 54.814 120.080 1.00 0.00 H TER 11993 WAT 578 ATOM 11993 O WAT 579 43.645 75.619 95.507 1.00 0.00 O ATOM 11994 H1 WAT 579 42.881 76.144 95.269 1.00 0.00 H ATOM 11995 H2 WAT 579 43.624 74.877 94.902 1.00 0.00 H TER 11997 WAT 579 ATOM 11997 O WAT 580 51.082 84.882 3.878 1.00 0.00 O ATOM 11998 H1 WAT 580 51.786 85.531 3.890 1.00 0.00 H ATOM 11999 H2 WAT 580 50.884 84.728 4.802 1.00 0.00 H TER 12001 WAT 580 ATOM 12001 O WAT 581 125.610 123.148 8.831 1.00 0.00 O ATOM 12002 H1 WAT 581 126.069 123.851 9.290 1.00 0.00 H ATOM 12003 H2 WAT 581 126.094 123.040 8.012 1.00 0.00 H TER 12005 WAT 581 ATOM 12005 O WAT 582 112.670 72.499 115.414 1.00 0.00 O ATOM 12006 H1 WAT 582 112.616 72.577 114.461 1.00 0.00 H ATOM 12007 H2 WAT 582 112.999 73.349 115.705 1.00 0.00 H TER 12009 WAT 582 ATOM 12009 O WAT 583 54.760 44.541 73.444 1.00 0.00 O ATOM 12010 H1 WAT 583 55.282 43.767 73.656 1.00 0.00 H ATOM 12011 H2 WAT 583 55.074 44.812 72.581 1.00 0.00 H TER 12013 WAT 583 ATOM 12013 O WAT 584 136.317 71.889 104.742 1.00 0.00 O ATOM 12014 H1 WAT 584 136.654 71.377 104.007 1.00 0.00 H ATOM 12015 H2 WAT 584 136.854 72.681 104.749 1.00 0.00 H TER 12017 WAT 584 ATOM 12017 O WAT 585 131.271 7.672 8.208 1.00 0.00 O ATOM 12018 H1 WAT 585 132.044 7.679 7.643 1.00 0.00 H ATOM 12019 H2 WAT 585 131.033 8.595 8.298 1.00 0.00 H TER 12021 WAT 585 ATOM 12021 O WAT 586 100.754 145.304 109.249 1.00 0.00 O ATOM 12022 H1 WAT 586 101.632 145.567 109.528 1.00 0.00 H ATOM 12023 H2 WAT 586 100.165 145.863 109.755 1.00 0.00 H TER 12025 WAT 586 ATOM 12025 O WAT 587 135.220 71.911 149.167 1.00 0.00 O ATOM 12026 H1 WAT 587 134.666 71.803 149.940 1.00 0.00 H ATOM 12027 H2 WAT 587 135.764 72.672 149.368 1.00 0.00 H TER 12029 WAT 587 ATOM 12029 O WAT 588 43.800 103.709 82.957 1.00 0.00 O ATOM 12030 H1 WAT 588 43.187 104.340 82.581 1.00 0.00 H ATOM 12031 H2 WAT 588 44.646 103.940 82.573 1.00 0.00 H TER 12033 WAT 588 ATOM 12033 O WAT 589 8.765 121.048 89.397 1.00 0.00 O ATOM 12034 H1 WAT 589 8.467 120.389 90.023 1.00 0.00 H ATOM 12035 H2 WAT 589 9.684 120.831 89.240 1.00 0.00 H TER 12037 WAT 589 ATOM 12037 O WAT 590 128.531 44.064 150.494 1.00 0.00 O ATOM 12038 H1 WAT 590 128.782 43.141 150.523 1.00 0.00 H ATOM 12039 H2 WAT 590 128.994 44.462 151.231 1.00 0.00 H TER 12041 WAT 590 ATOM 12041 O WAT 591 124.896 10.572 61.377 1.00 0.00 O ATOM 12042 H1 WAT 591 124.172 10.567 62.004 1.00 0.00 H ATOM 12043 H2 WAT 591 124.887 9.695 60.994 1.00 0.00 H TER 12045 WAT 591 ATOM 12045 O WAT 592 64.770 52.804 124.057 1.00 0.00 O ATOM 12046 H1 WAT 592 65.556 52.397 124.423 1.00 0.00 H ATOM 12047 H2 WAT 592 64.065 52.538 124.647 1.00 0.00 H TER 12049 WAT 592 ATOM 12049 O WAT 593 78.998 94.961 19.766 1.00 0.00 O ATOM 12050 H1 WAT 593 79.017 94.658 18.858 1.00 0.00 H ATOM 12051 H2 WAT 593 79.233 94.189 20.281 1.00 0.00 H TER 12053 WAT 593 ATOM 12053 O WAT 594 73.899 99.303 7.447 1.00 0.00 O ATOM 12054 H1 WAT 594 74.114 99.470 8.365 1.00 0.00 H ATOM 12055 H2 WAT 594 74.270 100.049 6.975 1.00 0.00 H TER 12057 WAT 594 ATOM 12057 O WAT 595 31.811 60.886 111.022 1.00 0.00 O ATOM 12058 H1 WAT 595 31.465 60.588 110.181 1.00 0.00 H ATOM 12059 H2 WAT 595 31.234 61.605 111.278 1.00 0.00 H TER 12061 WAT 595 ATOM 12061 O WAT 596 129.416 100.964 106.661 1.00 0.00 O ATOM 12062 H1 WAT 596 129.748 100.939 105.764 1.00 0.00 H ATOM 12063 H2 WAT 596 130.175 100.747 107.203 1.00 0.00 H TER 12065 WAT 596 ATOM 12065 O WAT 597 52.346 2.258 128.661 1.00 0.00 O ATOM 12066 H1 WAT 597 51.695 2.957 128.601 1.00 0.00 H ATOM 12067 H2 WAT 597 51.865 1.513 129.023 1.00 0.00 H TER 12069 WAT 597 ATOM 12069 O WAT 598 72.316 73.242 68.036 1.00 0.00 O ATOM 12070 H1 WAT 598 73.156 73.690 67.941 1.00 0.00 H ATOM 12071 H2 WAT 598 71.743 73.668 67.398 1.00 0.00 H TER 12073 WAT 598 ATOM 12073 O WAT 599 59.607 136.394 116.509 1.00 0.00 O ATOM 12074 H1 WAT 599 58.882 135.784 116.371 1.00 0.00 H ATOM 12075 H2 WAT 599 59.193 137.257 116.524 1.00 0.00 H TER 12077 WAT 599 ATOM 12077 O WAT 600 141.182 121.156 131.535 1.00 0.00 O ATOM 12078 H1 WAT 600 141.199 120.256 131.209 1.00 0.00 H ATOM 12079 H2 WAT 600 140.298 121.466 131.338 1.00 0.00 H TER 12081 WAT 600 ATOM 12081 O WAT 601 85.189 105.698 114.413 1.00 0.00 O ATOM 12082 H1 WAT 601 85.460 105.061 115.074 1.00 0.00 H ATOM 12083 H2 WAT 601 86.010 106.075 114.094 1.00 0.00 H TER 12085 WAT 601 ATOM 12085 O WAT 602 89.618 26.410 131.745 1.00 0.00 O ATOM 12086 H1 WAT 602 88.916 25.851 132.079 1.00 0.00 H ATOM 12087 H2 WAT 602 89.560 26.325 130.794 1.00 0.00 H TER 12089 WAT 602 ATOM 12089 O WAT 603 80.091 5.680 106.586 1.00 0.00 O ATOM 12090 H1 WAT 603 79.643 5.855 105.759 1.00 0.00 H ATOM 12091 H2 WAT 603 80.918 5.271 106.329 1.00 0.00 H TER 12093 WAT 603 ATOM 12093 O WAT 604 1.501 83.916 28.756 1.00 0.00 O ATOM 12094 H1 WAT 604 0.661 84.220 29.100 1.00 0.00 H ATOM 12095 H2 WAT 604 2.155 84.399 29.260 1.00 0.00 H TER 12097 WAT 604 ATOM 12097 O WAT 605 8.940 92.719 107.132 1.00 0.00 O ATOM 12098 H1 WAT 605 9.738 92.889 107.632 1.00 0.00 H ATOM 12099 H2 WAT 605 8.730 93.558 106.723 1.00 0.00 H TER 12101 WAT 605 ATOM 12101 O WAT 606 53.754 125.875 93.711 1.00 0.00 O ATOM 12102 H1 WAT 606 53.500 124.960 93.593 1.00 0.00 H ATOM 12103 H2 WAT 606 53.060 126.248 94.255 1.00 0.00 H TER 12105 WAT 606 ATOM 12105 O WAT 607 30.003 50.367 149.742 1.00 0.00 O ATOM 12106 H1 WAT 607 29.111 50.055 149.892 1.00 0.00 H ATOM 12107 H2 WAT 607 30.226 50.847 150.540 1.00 0.00 H TER 12109 WAT 607 ATOM 12109 O WAT 608 61.468 34.015 137.124 1.00 0.00 O ATOM 12110 H1 WAT 608 62.109 34.361 137.745 1.00 0.00 H ATOM 12111 H2 WAT 608 60.746 33.707 137.672 1.00 0.00 H TER 12113 WAT 608 ATOM 12113 O WAT 609 79.026 42.273 155.339 1.00 0.00 O ATOM 12114 H1 WAT 609 78.104 42.406 155.563 1.00 0.00 H ATOM 12115 H2 WAT 609 79.318 41.577 155.927 1.00 0.00 H TER 12117 WAT 609 ATOM 12117 O WAT 610 75.558 75.998 123.847 1.00 0.00 O ATOM 12118 H1 WAT 610 74.737 75.508 123.796 1.00 0.00 H ATOM 12119 H2 WAT 610 75.698 76.325 122.958 1.00 0.00 H TER 12121 WAT 610 ATOM 12121 O WAT 611 109.916 2.774 136.232 1.00 0.00 O ATOM 12122 H1 WAT 611 110.300 1.992 135.835 1.00 0.00 H ATOM 12123 H2 WAT 611 109.033 2.505 136.485 1.00 0.00 H TER 12125 WAT 611 ATOM 12125 O WAT 612 95.788 39.523 157.906 1.00 0.00 O ATOM 12126 H1 WAT 612 96.174 39.337 157.050 1.00 0.00 H ATOM 12127 H2 WAT 612 95.260 40.309 157.766 1.00 0.00 H TER 12129 WAT 612 ATOM 12129 O WAT 613 104.764 62.977 2.057 1.00 0.00 O ATOM 12130 H1 WAT 613 105.623 63.372 1.908 1.00 0.00 H ATOM 12131 H2 WAT 613 104.761 62.753 2.988 1.00 0.00 H TER 12133 WAT 613 ATOM 12133 O WAT 614 127.065 49.924 102.565 1.00 0.00 O ATOM 12134 H1 WAT 614 127.805 50.317 102.101 1.00 0.00 H ATOM 12135 H2 WAT 614 126.585 50.670 102.925 1.00 0.00 H TER 12137 WAT 614 ATOM 12137 O WAT 615 53.336 98.591 155.109 1.00 0.00 O ATOM 12138 H1 WAT 615 53.759 99.216 154.520 1.00 0.00 H ATOM 12139 H2 WAT 615 53.834 98.655 155.924 1.00 0.00 H TER 12141 WAT 615 ATOM 12141 O WAT 616 50.881 39.545 83.992 1.00 0.00 O ATOM 12142 H1 WAT 616 51.242 39.800 84.841 1.00 0.00 H ATOM 12143 H2 WAT 616 50.648 40.374 83.573 1.00 0.00 H TER 12145 WAT 616 ATOM 12145 O WAT 617 37.824 109.005 107.909 1.00 0.00 O ATOM 12146 H1 WAT 617 37.345 108.618 108.642 1.00 0.00 H ATOM 12147 H2 WAT 617 37.421 109.864 107.786 1.00 0.00 H TER 12149 WAT 617 ATOM 12149 O WAT 618 14.983 98.184 158.443 1.00 0.00 O ATOM 12150 H1 WAT 618 14.383 98.656 157.866 1.00 0.00 H ATOM 12151 H2 WAT 618 14.839 97.261 158.235 1.00 0.00 H TER 12153 WAT 618 ATOM 12153 O WAT 619 54.329 78.076 81.295 1.00 0.00 O ATOM 12154 H1 WAT 619 54.121 77.180 81.560 1.00 0.00 H ATOM 12155 H2 WAT 619 54.166 78.601 82.079 1.00 0.00 H TER 12157 WAT 619 ATOM 12157 O WAT 620 33.469 45.121 14.153 1.00 0.00 O ATOM 12158 H1 WAT 620 33.197 45.762 14.810 1.00 0.00 H ATOM 12159 H2 WAT 620 33.534 45.623 13.341 1.00 0.00 H TER 12161 WAT 620 ATOM 12161 O WAT 621 127.046 119.956 150.026 1.00 0.00 O ATOM 12162 H1 WAT 621 127.269 120.139 149.113 1.00 0.00 H ATOM 12163 H2 WAT 621 127.817 119.509 150.375 1.00 0.00 H TER 12165 WAT 621 ATOM 12165 O WAT 622 96.417 43.655 28.602 1.00 0.00 O ATOM 12166 H1 WAT 622 96.032 44.023 27.807 1.00 0.00 H ATOM 12167 H2 WAT 622 95.721 43.116 28.978 1.00 0.00 H TER 12169 WAT 622 ATOM 12169 O WAT 623 140.894 42.417 59.604 1.00 0.00 O ATOM 12170 H1 WAT 623 140.272 41.754 59.904 1.00 0.00 H ATOM 12171 H2 WAT 623 140.571 43.236 59.981 1.00 0.00 H TER 12173 WAT 623 ATOM 12173 O WAT 624 13.671 88.792 98.032 1.00 0.00 O ATOM 12174 H1 WAT 624 13.953 89.405 98.710 1.00 0.00 H ATOM 12175 H2 WAT 624 14.385 88.158 97.969 1.00 0.00 H TER 12177 WAT 624 ATOM 12177 O WAT 625 145.082 8.774 1.521 1.00 0.00 O ATOM 12178 H1 WAT 625 145.410 8.191 2.206 1.00 0.00 H ATOM 12179 H2 WAT 625 145.775 9.425 1.410 1.00 0.00 H TER 12181 WAT 625 ATOM 12181 O WAT 626 60.890 107.999 137.123 1.00 0.00 O ATOM 12182 H1 WAT 626 60.159 108.596 137.282 1.00 0.00 H ATOM 12183 H2 WAT 626 60.591 107.442 136.404 1.00 0.00 H TER 12185 WAT 626 ATOM 12185 O WAT 627 144.066 127.730 156.257 1.00 0.00 O ATOM 12186 H1 WAT 627 144.382 126.966 155.774 1.00 0.00 H ATOM 12187 H2 WAT 627 144.811 127.998 156.794 1.00 0.00 H TER 12189 WAT 627 ATOM 12189 O WAT 628 30.615 37.498 93.007 1.00 0.00 O ATOM 12190 H1 WAT 628 30.052 36.837 92.603 1.00 0.00 H ATOM 12191 H2 WAT 628 30.950 38.009 92.271 1.00 0.00 H TER 12193 WAT 628 ATOM 12193 O WAT 629 67.229 13.443 111.090 1.00 0.00 O ATOM 12194 H1 WAT 629 67.046 14.226 111.610 1.00 0.00 H ATOM 12195 H2 WAT 629 67.232 13.753 110.184 1.00 0.00 H TER 12197 WAT 629 ATOM 12197 O WAT 630 1.531 93.101 133.547 1.00 0.00 O ATOM 12198 H1 WAT 630 0.640 93.380 133.334 1.00 0.00 H ATOM 12199 H2 WAT 630 1.836 93.745 134.187 1.00 0.00 H TER 12201 WAT 630 ATOM 12201 O WAT 631 9.512 63.981 55.401 1.00 0.00 O ATOM 12202 H1 WAT 631 9.944 64.489 56.086 1.00 0.00 H ATOM 12203 H2 WAT 631 8.675 64.425 55.264 1.00 0.00 H TER 12205 WAT 631 ATOM 12205 O WAT 632 93.194 74.154 21.677 1.00 0.00 O ATOM 12206 H1 WAT 632 93.326 75.018 22.068 1.00 0.00 H ATOM 12207 H2 WAT 632 93.133 74.324 20.737 1.00 0.00 H TER 12209 WAT 632 ATOM 12209 O WAT 633 144.235 58.451 114.744 1.00 0.00 O ATOM 12210 H1 WAT 633 144.717 58.414 113.917 1.00 0.00 H ATOM 12211 H2 WAT 633 144.042 59.381 114.867 1.00 0.00 H TER 12213 WAT 633 ATOM 12213 O WAT 634 102.943 34.698 105.368 1.00 0.00 O ATOM 12214 H1 WAT 634 103.838 34.492 105.097 1.00 0.00 H ATOM 12215 H2 WAT 634 103.024 35.518 105.855 1.00 0.00 H TER 12217 WAT 634 ATOM 12217 O WAT 635 11.568 101.762 114.851 1.00 0.00 O ATOM 12218 H1 WAT 635 11.409 101.184 115.597 1.00 0.00 H ATOM 12219 H2 WAT 635 12.435 101.510 114.534 1.00 0.00 H TER 12221 WAT 635 ATOM 12221 O WAT 636 107.922 4.599 155.033 1.00 0.00 O ATOM 12222 H1 WAT 636 108.417 4.548 155.851 1.00 0.00 H ATOM 12223 H2 WAT 636 107.085 4.180 155.232 1.00 0.00 H TER 12225 WAT 636 ATOM 12225 O WAT 637 52.886 93.439 13.487 1.00 0.00 O ATOM 12226 H1 WAT 637 53.209 93.231 14.364 1.00 0.00 H ATOM 12227 H2 WAT 637 51.935 93.355 13.556 1.00 0.00 H TER 12229 WAT 637 ATOM 12229 O WAT 638 7.280 128.517 66.391 1.00 0.00 O ATOM 12230 H1 WAT 638 7.438 129.438 66.600 1.00 0.00 H ATOM 12231 H2 WAT 638 6.717 128.541 65.617 1.00 0.00 H TER 12233 WAT 638 ATOM 12233 O WAT 639 95.211 69.590 105.830 1.00 0.00 O ATOM 12234 H1 WAT 639 94.520 68.936 105.934 1.00 0.00 H ATOM 12235 H2 WAT 639 94.793 70.307 105.353 1.00 0.00 H TER 12237 WAT 639 ATOM 12237 O WAT 640 66.208 86.367 14.504 1.00 0.00 O ATOM 12238 H1 WAT 640 65.685 85.593 14.713 1.00 0.00 H ATOM 12239 H2 WAT 640 65.888 86.648 13.647 1.00 0.00 H TER 12241 WAT 640 ATOM 12241 O WAT 641 58.129 68.475 156.140 1.00 0.00 O ATOM 12242 H1 WAT 641 57.986 69.110 155.439 1.00 0.00 H ATOM 12243 H2 WAT 641 57.979 68.970 156.946 1.00 0.00 H TER 12245 WAT 641 ATOM 12245 O WAT 642 68.986 59.438 121.969 1.00 0.00 O ATOM 12246 H1 WAT 642 69.687 59.673 121.361 1.00 0.00 H ATOM 12247 H2 WAT 642 69.423 58.932 122.655 1.00 0.00 H TER 12249 WAT 642 ATOM 12249 O WAT 643 122.057 105.400 84.109 1.00 0.00 O ATOM 12250 H1 WAT 643 122.056 106.150 83.514 1.00 0.00 H ATOM 12251 H2 WAT 643 122.637 105.663 84.824 1.00 0.00 H TER 12253 WAT 643 ATOM 12253 O WAT 644 53.099 58.992 119.837 1.00 0.00 O ATOM 12254 H1 WAT 644 52.254 58.605 120.067 1.00 0.00 H ATOM 12255 H2 WAT 644 53.444 58.424 119.149 1.00 0.00 H TER 12257 WAT 644 ATOM 12257 O WAT 645 0.703 30.859 94.987 1.00 0.00 O ATOM 12258 H1 WAT 645 1.141 30.477 94.226 1.00 0.00 H ATOM 12259 H2 WAT 645 0.649 30.141 95.617 1.00 0.00 H TER 12261 WAT 645 ATOM 12261 O WAT 646 85.878 38.898 61.536 1.00 0.00 O ATOM 12262 H1 WAT 646 86.707 39.183 61.153 1.00 0.00 H ATOM 12263 H2 WAT 646 85.210 39.367 61.036 1.00 0.00 H TER 12265 WAT 646 ATOM 12265 O WAT 647 119.134 28.835 9.002 1.00 0.00 O ATOM 12266 H1 WAT 647 119.321 28.831 9.941 1.00 0.00 H ATOM 12267 H2 WAT 647 118.181 28.903 8.948 1.00 0.00 H TER 12269 WAT 647 ATOM 12269 O WAT 648 128.317 57.672 8.101 1.00 0.00 O ATOM 12270 H1 WAT 648 127.590 57.919 8.672 1.00 0.00 H ATOM 12271 H2 WAT 648 128.962 57.281 8.691 1.00 0.00 H TER 12273 WAT 648 ATOM 12273 O WAT 649 140.810 12.713 109.875 1.00 0.00 O ATOM 12274 H1 WAT 649 141.098 13.195 110.650 1.00 0.00 H ATOM 12275 H2 WAT 649 140.125 12.128 110.199 1.00 0.00 H TER 12277 WAT 649 ATOM 12277 O WAT 650 94.066 12.150 11.915 1.00 0.00 O ATOM 12278 H1 WAT 650 93.246 12.596 12.129 1.00 0.00 H ATOM 12279 H2 WAT 650 94.743 12.676 12.341 1.00 0.00 H TER 12281 WAT 650 ATOM 12281 O WAT 651 40.140 71.368 147.160 1.00 0.00 O ATOM 12282 H1 WAT 651 40.383 70.867 147.938 1.00 0.00 H ATOM 12283 H2 WAT 651 39.185 71.414 147.193 1.00 0.00 H TER 12285 WAT 651 ATOM 12285 O WAT 652 87.167 119.776 157.504 1.00 0.00 O ATOM 12286 H1 WAT 652 87.253 120.715 157.341 1.00 0.00 H ATOM 12287 H2 WAT 652 88.053 119.489 157.726 1.00 0.00 H TER 12289 WAT 652 ATOM 12289 O WAT 653 143.636 5.116 153.254 1.00 0.00 O ATOM 12290 H1 WAT 653 143.978 4.653 152.489 1.00 0.00 H ATOM 12291 H2 WAT 653 143.927 4.593 154.001 1.00 0.00 H TER 12293 WAT 653 ATOM 12293 O WAT 654 56.381 89.247 127.540 1.00 0.00 O ATOM 12294 H1 WAT 654 56.870 88.947 128.307 1.00 0.00 H ATOM 12295 H2 WAT 654 55.492 89.390 127.864 1.00 0.00 H TER 12297 WAT 654 ATOM 12297 O WAT 655 3.072 49.193 87.265 1.00 0.00 O ATOM 12298 H1 WAT 655 3.877 48.681 87.184 1.00 0.00 H ATOM 12299 H2 WAT 655 2.642 48.841 88.044 1.00 0.00 H TER 12301 WAT 655 ATOM 12301 O WAT 656 83.349 75.341 79.780 1.00 0.00 O ATOM 12302 H1 WAT 656 83.828 75.888 80.402 1.00 0.00 H ATOM 12303 H2 WAT 656 83.191 74.523 80.252 1.00 0.00 H TER 12305 WAT 656 ATOM 12305 O WAT 657 51.005 83.800 24.135 1.00 0.00 O ATOM 12306 H1 WAT 657 50.748 83.729 25.054 1.00 0.00 H ATOM 12307 H2 WAT 657 51.347 84.690 24.050 1.00 0.00 H TER 12309 WAT 657 ATOM 12309 O WAT 658 118.967 123.971 8.185 1.00 0.00 O ATOM 12310 H1 WAT 658 119.634 124.606 8.446 1.00 0.00 H ATOM 12311 H2 WAT 658 118.951 123.334 8.900 1.00 0.00 H TER 12313 WAT 658 ATOM 12313 O WAT 659 8.368 118.510 1.168 1.00 0.00 O ATOM 12314 H1 WAT 659 8.013 118.814 2.003 1.00 0.00 H ATOM 12315 H2 WAT 659 9.275 118.274 1.365 1.00 0.00 H TER 12317 WAT 659 ATOM 12317 O WAT 660 57.175 32.104 13.447 1.00 0.00 O ATOM 12318 H1 WAT 660 56.342 31.722 13.171 1.00 0.00 H ATOM 12319 H2 WAT 660 57.834 31.644 12.928 1.00 0.00 H TER 12321 WAT 660 ATOM 12321 O WAT 661 70.542 62.232 28.508 1.00 0.00 O ATOM 12322 H1 WAT 661 70.033 62.437 27.724 1.00 0.00 H ATOM 12323 H2 WAT 661 69.900 62.230 29.218 1.00 0.00 H TER 12325 WAT 661 ATOM 12325 O WAT 662 78.032 97.477 72.359 1.00 0.00 O ATOM 12326 H1 WAT 662 77.395 96.777 72.500 1.00 0.00 H ATOM 12327 H2 WAT 662 78.872 97.089 72.603 1.00 0.00 H TER 12329 WAT 662 ATOM 12329 O WAT 663 19.833 84.233 14.901 1.00 0.00 O ATOM 12330 H1 WAT 663 20.541 84.846 14.704 1.00 0.00 H ATOM 12331 H2 WAT 663 19.678 84.338 15.839 1.00 0.00 H TER 12333 WAT 663 ATOM 12333 O WAT 664 42.582 74.821 72.268 1.00 0.00 O ATOM 12334 H1 WAT 664 42.701 74.550 73.178 1.00 0.00 H ATOM 12335 H2 WAT 664 41.731 75.258 72.258 1.00 0.00 H TER 12337 WAT 664 ATOM 12337 O WAT 665 121.866 60.486 147.585 1.00 0.00 O ATOM 12338 H1 WAT 665 122.315 61.298 147.350 1.00 0.00 H ATOM 12339 H2 WAT 665 122.470 60.043 148.181 1.00 0.00 H TER 12341 WAT 665 ATOM 12341 O WAT 666 72.144 138.986 58.950 1.00 0.00 O ATOM 12342 H1 WAT 666 73.064 138.844 58.730 1.00 0.00 H ATOM 12343 H2 WAT 666 71.703 139.056 58.104 1.00 0.00 H TER 12345 WAT 666 ATOM 12345 O WAT 667 58.175 48.861 97.784 1.00 0.00 O ATOM 12346 H1 WAT 667 57.554 48.197 98.083 1.00 0.00 H ATOM 12347 H2 WAT 667 58.061 49.588 98.395 1.00 0.00 H TER 12349 WAT 667 ATOM 12349 O WAT 668 130.909 0.774 84.849 1.00 0.00 O ATOM 12350 H1 WAT 668 130.530 0.205 84.179 1.00 0.00 H ATOM 12351 H2 WAT 668 130.948 0.226 85.634 1.00 0.00 H TER 12353 WAT 668 ATOM 12353 O WAT 669 86.821 28.763 136.225 1.00 0.00 O ATOM 12354 H1 WAT 669 87.092 27.964 135.773 1.00 0.00 H ATOM 12355 H2 WAT 669 85.990 28.534 136.640 1.00 0.00 H TER 12357 WAT 669 ATOM 12357 O WAT 670 64.097 41.006 147.122 1.00 0.00 O ATOM 12358 H1 WAT 670 63.599 40.299 147.533 1.00 0.00 H ATOM 12359 H2 WAT 670 65.013 40.752 147.238 1.00 0.00 H TER 12361 WAT 670 ATOM 12361 O WAT 671 119.543 70.402 65.305 1.00 0.00 O ATOM 12362 H1 WAT 671 118.826 70.836 65.766 1.00 0.00 H ATOM 12363 H2 WAT 671 119.502 70.752 64.415 1.00 0.00 H TER 12365 WAT 671 ATOM 12365 O WAT 672 93.375 56.330 129.726 1.00 0.00 O ATOM 12366 H1 WAT 672 93.889 57.099 129.970 1.00 0.00 H ATOM 12367 H2 WAT 672 92.490 56.668 129.585 1.00 0.00 H TER 12369 WAT 672 ATOM 12369 O WAT 673 34.997 72.932 113.140 1.00 0.00 O ATOM 12370 H1 WAT 673 35.781 72.589 112.711 1.00 0.00 H ATOM 12371 H2 WAT 673 35.169 72.821 114.075 1.00 0.00 H TER 12373 WAT 673 ATOM 12373 O WAT 674 145.312 12.673 80.223 1.00 0.00 O ATOM 12374 H1 WAT 674 145.992 13.165 80.682 1.00 0.00 H ATOM 12375 H2 WAT 674 145.654 12.563 79.335 1.00 0.00 H TER 12377 WAT 674 ATOM 12377 O WAT 675 44.923 33.116 158.142 1.00 0.00 O ATOM 12378 H1 WAT 675 44.422 33.857 158.482 1.00 0.00 H ATOM 12379 H2 WAT 675 45.667 33.516 157.693 1.00 0.00 H TER 12381 WAT 675 ATOM 12381 O WAT 676 18.156 11.868 151.974 1.00 0.00 O ATOM 12382 H1 WAT 676 17.697 12.657 152.265 1.00 0.00 H ATOM 12383 H2 WAT 676 18.243 11.337 152.766 1.00 0.00 H TER 12385 WAT 676 ATOM 12385 O WAT 677 65.277 1.626 94.447 1.00 0.00 O ATOM 12386 H1 WAT 677 65.155 2.213 93.701 1.00 0.00 H ATOM 12387 H2 WAT 677 66.020 1.997 94.924 1.00 0.00 H TER 12389 WAT 677 ATOM 12389 O WAT 678 58.613 136.846 87.031 1.00 0.00 O ATOM 12390 H1 WAT 678 57.726 136.572 86.797 1.00 0.00 H ATOM 12391 H2 WAT 678 58.516 137.757 87.311 1.00 0.00 H TER 12393 WAT 678 ATOM 12393 O WAT 679 57.060 114.556 121.030 1.00 0.00 O ATOM 12394 H1 WAT 679 57.847 114.119 121.356 1.00 0.00 H ATOM 12395 H2 WAT 679 57.175 114.578 120.080 1.00 0.00 H TER 12397 WAT 679 ATOM 12397 O WAT 680 110.813 18.828 145.333 1.00 0.00 O ATOM 12398 H1 WAT 680 110.755 17.947 145.702 1.00 0.00 H ATOM 12399 H2 WAT 680 110.853 18.689 144.387 1.00 0.00 H TER 12401 WAT 680 ATOM 12401 O WAT 681 118.106 144.835 130.144 1.00 0.00 O ATOM 12402 H1 WAT 681 118.504 143.980 129.981 1.00 0.00 H ATOM 12403 H2 WAT 681 118.331 145.356 129.374 1.00 0.00 H TER 12405 WAT 681 ATOM 12405 O WAT 682 79.745 108.174 73.234 1.00 0.00 O ATOM 12406 H1 WAT 682 78.893 108.589 73.367 1.00 0.00 H ATOM 12407 H2 WAT 682 79.855 108.152 72.284 1.00 0.00 H TER 12409 WAT 682 ATOM 12409 O WAT 683 33.982 84.010 157.665 1.00 0.00 O ATOM 12410 H1 WAT 683 34.106 84.805 158.184 1.00 0.00 H ATOM 12411 H2 WAT 683 34.869 83.711 157.468 1.00 0.00 H TER 12413 WAT 683 ATOM 12413 O WAT 684 121.960 41.330 134.409 1.00 0.00 O ATOM 12414 H1 WAT 684 121.687 40.583 133.877 1.00 0.00 H ATOM 12415 H2 WAT 684 122.914 41.261 134.446 1.00 0.00 H TER 12417 WAT 684 ATOM 12417 O WAT 685 106.426 131.224 108.590 1.00 0.00 O ATOM 12418 H1 WAT 685 106.311 132.099 108.960 1.00 0.00 H ATOM 12419 H2 WAT 685 107.334 131.210 108.288 1.00 0.00 H TER 12421 WAT 685 ATOM 12421 O WAT 686 66.688 29.980 152.188 1.00 0.00 O ATOM 12422 H1 WAT 686 66.822 30.741 152.753 1.00 0.00 H ATOM 12423 H2 WAT 686 66.568 30.350 151.313 1.00 0.00 H TER 12425 WAT 686 ATOM 12425 O WAT 687 12.270 130.433 89.089 1.00 0.00 O ATOM 12426 H1 WAT 687 11.464 130.737 88.673 1.00 0.00 H ATOM 12427 H2 WAT 687 12.964 130.682 88.478 1.00 0.00 H TER 12429 WAT 687 ATOM 12429 O WAT 688 43.327 31.739 4.967 1.00 0.00 O ATOM 12430 H1 WAT 688 42.825 32.370 4.452 1.00 0.00 H ATOM 12431 H2 WAT 688 42.669 31.135 5.314 1.00 0.00 H TER 12433 WAT 688 ATOM 12433 O WAT 689 137.093 111.857 141.495 1.00 0.00 O ATOM 12434 H1 WAT 689 136.738 112.622 141.948 1.00 0.00 H ATOM 12435 H2 WAT 689 136.791 111.951 140.592 1.00 0.00 H TER 12437 WAT 689 ATOM 12437 O WAT 690 16.534 74.766 107.828 1.00 0.00 O ATOM 12438 H1 WAT 690 16.796 75.250 107.045 1.00 0.00 H ATOM 12439 H2 WAT 690 16.117 75.422 108.387 1.00 0.00 H TER 12441 WAT 690 ATOM 12441 O WAT 691 144.076 51.714 75.106 1.00 0.00 O ATOM 12442 H1 WAT 691 144.163 50.813 74.797 1.00 0.00 H ATOM 12443 H2 WAT 691 144.824 52.172 74.722 1.00 0.00 H TER 12445 WAT 691 ATOM 12445 O WAT 692 108.107 105.528 156.914 1.00 0.00 O ATOM 12446 H1 WAT 692 107.376 105.040 157.293 1.00 0.00 H ATOM 12447 H2 WAT 692 108.530 105.946 157.664 1.00 0.00 H TER 12449 WAT 692 ATOM 12449 O WAT 693 114.510 71.750 66.937 1.00 0.00 O ATOM 12450 H1 WAT 693 114.573 72.163 67.798 1.00 0.00 H ATOM 12451 H2 WAT 693 113.732 71.195 66.994 1.00 0.00 H TER 12453 WAT 693 ATOM 12453 O WAT 694 81.128 15.727 82.681 1.00 0.00 O ATOM 12454 H1 WAT 694 81.615 16.391 83.169 1.00 0.00 H ATOM 12455 H2 WAT 694 80.673 16.219 81.997 1.00 0.00 H TER 12457 WAT 694 ATOM 12457 O WAT 695 109.968 24.788 76.806 1.00 0.00 O ATOM 12458 H1 WAT 695 109.653 24.046 76.288 1.00 0.00 H ATOM 12459 H2 WAT 695 109.349 24.852 77.533 1.00 0.00 H TER 12461 WAT 695 ATOM 12461 O WAT 696 31.281 29.554 137.554 1.00 0.00 O ATOM 12462 H1 WAT 696 30.400 29.191 137.465 1.00 0.00 H ATOM 12463 H2 WAT 696 31.766 29.192 136.812 1.00 0.00 H TER 12465 WAT 696 ATOM 12465 O WAT 697 28.296 93.400 122.431 1.00 0.00 O ATOM 12466 H1 WAT 697 28.029 93.958 123.161 1.00 0.00 H ATOM 12467 H2 WAT 697 27.562 93.440 121.817 1.00 0.00 H TER 12469 WAT 697 ATOM 12469 O WAT 698 71.405 113.702 67.684 1.00 0.00 O ATOM 12470 H1 WAT 698 71.624 112.881 67.243 1.00 0.00 H ATOM 12471 H2 WAT 698 71.486 113.501 68.617 1.00 0.00 H TER 12473 WAT 698 ATOM 12473 O WAT 699 108.068 85.943 131.604 1.00 0.00 O ATOM 12474 H1 WAT 699 107.204 86.352 131.653 1.00 0.00 H ATOM 12475 H2 WAT 699 108.147 85.656 130.695 1.00 0.00 H TER 12477 WAT 699 ATOM 12477 O WAT 700 4.031 17.078 80.458 1.00 0.00 O ATOM 12478 H1 WAT 700 4.430 17.233 79.601 1.00 0.00 H ATOM 12479 H2 WAT 700 4.768 16.864 81.030 1.00 0.00 H TER 12481 WAT 700 ATOM 12481 O WAT 701 111.178 44.805 124.708 1.00 0.00 O ATOM 12482 H1 WAT 701 112.094 44.818 124.430 1.00 0.00 H ATOM 12483 H2 WAT 701 111.184 44.314 125.529 1.00 0.00 H TER 12485 WAT 701 ATOM 12485 O WAT 702 123.377 35.863 145.985 1.00 0.00 O ATOM 12486 H1 WAT 702 124.152 35.325 146.150 1.00 0.00 H ATOM 12487 H2 WAT 702 122.786 35.660 146.710 1.00 0.00 H TER 12489 WAT 702 ATOM 12489 O WAT 703 65.131 59.544 80.045 1.00 0.00 O ATOM 12490 H1 WAT 703 65.230 60.288 80.639 1.00 0.00 H ATOM 12491 H2 WAT 703 65.523 59.840 79.223 1.00 0.00 H TER 12493 WAT 703 ATOM 12493 O WAT 704 49.531 99.920 102.157 1.00 0.00 O ATOM 12494 H1 WAT 704 50.009 100.369 102.855 1.00 0.00 H ATOM 12495 H2 WAT 704 49.311 100.612 101.534 1.00 0.00 H TER 12497 WAT 704 ATOM 12497 O WAT 705 64.809 44.191 116.255 1.00 0.00 O ATOM 12498 H1 WAT 705 64.866 43.310 115.885 1.00 0.00 H ATOM 12499 H2 WAT 705 63.891 44.438 116.143 1.00 0.00 H TER 12501 WAT 705 ATOM 12501 O WAT 706 23.441 121.492 24.971 1.00 0.00 O ATOM 12502 H1 WAT 706 23.072 120.797 25.516 1.00 0.00 H ATOM 12503 H2 WAT 706 23.594 122.217 25.576 1.00 0.00 H TER 12505 WAT 706 ATOM 12505 O WAT 707 71.733 103.125 125.841 1.00 0.00 O ATOM 12506 H1 WAT 707 72.226 102.547 125.259 1.00 0.00 H ATOM 12507 H2 WAT 707 71.136 102.541 126.309 1.00 0.00 H TER 12509 WAT 707 ATOM 12509 O WAT 708 83.846 102.646 128.367 1.00 0.00 O ATOM 12510 H1 WAT 708 84.794 102.563 128.269 1.00 0.00 H ATOM 12511 H2 WAT 708 83.484 102.095 127.674 1.00 0.00 H TER 12513 WAT 708 ATOM 12513 O WAT 709 119.417 42.052 115.053 1.00 0.00 O ATOM 12514 H1 WAT 709 119.247 41.216 114.620 1.00 0.00 H ATOM 12515 H2 WAT 709 118.936 41.997 115.879 1.00 0.00 H TER 12517 WAT 709 ATOM 12517 O WAT 710 133.427 114.707 67.406 1.00 0.00 O ATOM 12518 H1 WAT 710 132.691 114.500 66.830 1.00 0.00 H ATOM 12519 H2 WAT 710 134.184 114.301 66.984 1.00 0.00 H TER 12521 WAT 710 ATOM 12521 O WAT 711 137.888 130.954 143.626 1.00 0.00 O ATOM 12522 H1 WAT 711 137.177 131.593 143.584 1.00 0.00 H ATOM 12523 H2 WAT 711 137.603 130.240 143.056 1.00 0.00 H TER 12525 WAT 711 ATOM 12525 O WAT 712 83.540 120.554 120.341 1.00 0.00 O ATOM 12526 H1 WAT 712 84.175 121.259 120.211 1.00 0.00 H ATOM 12527 H2 WAT 712 83.227 120.348 119.460 1.00 0.00 H TER 12529 WAT 712 ATOM 12529 O WAT 713 135.387 53.995 135.002 1.00 0.00 O ATOM 12530 H1 WAT 713 135.139 54.705 134.410 1.00 0.00 H ATOM 12531 H2 WAT 713 135.609 53.266 134.422 1.00 0.00 H TER 12533 WAT 713 ATOM 12533 O WAT 714 89.117 22.670 85.529 1.00 0.00 O ATOM 12534 H1 WAT 714 89.284 22.505 86.456 1.00 0.00 H ATOM 12535 H2 WAT 714 88.429 23.336 85.524 1.00 0.00 H TER 12537 WAT 714 ATOM 12537 O WAT 715 121.641 15.260 15.291 1.00 0.00 O ATOM 12538 H1 WAT 715 121.047 14.515 15.384 1.00 0.00 H ATOM 12539 H2 WAT 715 121.570 15.728 16.123 1.00 0.00 H TER 12541 WAT 715 ATOM 12541 O WAT 716 142.125 120.614 123.334 1.00 0.00 O ATOM 12542 H1 WAT 716 141.746 121.480 123.484 1.00 0.00 H ATOM 12543 H2 WAT 716 141.405 120.006 123.502 1.00 0.00 H TER 12545 WAT 716 ATOM 12545 O WAT 717 96.365 84.996 111.618 1.00 0.00 O ATOM 12546 H1 WAT 717 96.724 85.729 112.120 1.00 0.00 H ATOM 12547 H2 WAT 717 96.194 85.362 110.750 1.00 0.00 H TER 12549 WAT 717 ATOM 12549 O WAT 718 88.143 115.797 5.010 1.00 0.00 O ATOM 12550 H1 WAT 718 87.870 115.057 4.467 1.00 0.00 H ATOM 12551 H2 WAT 718 88.072 116.557 4.432 1.00 0.00 H TER 12553 WAT 718 ATOM 12553 O WAT 719 100.628 74.108 22.210 1.00 0.00 O ATOM 12554 H1 WAT 719 100.090 73.557 22.778 1.00 0.00 H ATOM 12555 H2 WAT 719 101.467 73.651 22.158 1.00 0.00 H TER 12557 WAT 719 ATOM 12557 O WAT 720 80.563 13.683 80.818 1.00 0.00 O ATOM 12558 H1 WAT 720 79.876 13.558 81.472 1.00 0.00 H ATOM 12559 H2 WAT 720 81.159 14.318 81.215 1.00 0.00 H TER 12561 WAT 720 ATOM 12561 O WAT 721 -0.075 103.819 60.519 1.00 0.00 O ATOM 12562 H1 WAT 721 0.696 103.845 59.951 1.00 0.00 H ATOM 12563 H2 WAT 721 0.196 104.279 61.313 1.00 0.00 H TER 12565 WAT 721 ATOM 12565 O WAT 722 116.612 44.776 133.712 1.00 0.00 O ATOM 12566 H1 WAT 722 117.386 45.226 133.373 1.00 0.00 H ATOM 12567 H2 WAT 722 116.956 43.978 134.114 1.00 0.00 H TER 12569 WAT 722 ATOM 12569 O WAT 723 88.315 93.131 140.978 1.00 0.00 O ATOM 12570 H1 WAT 723 88.420 93.775 141.679 1.00 0.00 H ATOM 12571 H2 WAT 723 89.056 92.535 141.087 1.00 0.00 H TER 12573 WAT 723 ATOM 12573 O WAT 724 77.083 138.654 0.085 1.00 0.00 O ATOM 12574 H1 WAT 724 77.534 138.287 -0.676 1.00 0.00 H ATOM 12575 H2 WAT 724 77.414 138.148 0.826 1.00 0.00 H TER 12577 WAT 724 ATOM 12577 O WAT 725 21.574 74.445 144.075 1.00 0.00 O ATOM 12578 H1 WAT 725 21.344 75.024 144.802 1.00 0.00 H ATOM 12579 H2 WAT 725 21.067 74.777 143.334 1.00 0.00 H TER 12581 WAT 725 ATOM 12581 O WAT 726 114.031 94.814 6.369 1.00 0.00 O ATOM 12582 H1 WAT 726 113.532 95.145 5.622 1.00 0.00 H ATOM 12583 H2 WAT 726 113.406 94.817 7.094 1.00 0.00 H TER 12585 WAT 726 ATOM 12585 O WAT 727 129.657 67.638 59.046 1.00 0.00 O ATOM 12586 H1 WAT 727 129.056 67.173 58.463 1.00 0.00 H ATOM 12587 H2 WAT 727 130.146 68.223 58.468 1.00 0.00 H TER 12589 WAT 727 ATOM 12589 O WAT 728 77.952 124.138 71.192 1.00 0.00 O ATOM 12590 H1 WAT 728 78.661 123.496 71.242 1.00 0.00 H ATOM 12591 H2 WAT 728 77.567 124.001 70.326 1.00 0.00 H TER 12593 WAT 728 ATOM 12593 O WAT 729 83.782 0.678 144.272 1.00 0.00 O ATOM 12594 H1 WAT 729 83.086 1.148 144.730 1.00 0.00 H ATOM 12595 H2 WAT 729 84.007 1.243 143.533 1.00 0.00 H TER 12597 WAT 729 ATOM 12597 O WAT 730 20.654 107.298 72.370 1.00 0.00 O ATOM 12598 H1 WAT 730 21.397 107.517 72.933 1.00 0.00 H ATOM 12599 H2 WAT 730 21.035 106.774 71.665 1.00 0.00 H TER 12601 WAT 730 ATOM 12601 O WAT 731 45.375 132.451 20.361 1.00 0.00 O ATOM 12602 H1 WAT 731 44.866 132.624 19.569 1.00 0.00 H ATOM 12603 H2 WAT 731 44.755 132.586 21.078 1.00 0.00 H TER 12605 WAT 731 ATOM 12605 O WAT 732 93.032 111.534 61.774 1.00 0.00 O ATOM 12606 H1 WAT 732 93.239 112.184 61.104 1.00 0.00 H ATOM 12607 H2 WAT 732 92.603 112.033 62.468 1.00 0.00 H TER 12609 WAT 732 ATOM 12609 O WAT 733 26.719 52.034 142.296 1.00 0.00 O ATOM 12610 H1 WAT 733 27.524 52.162 142.798 1.00 0.00 H ATOM 12611 H2 WAT 733 26.251 51.344 142.766 1.00 0.00 H TER 12613 WAT 733 ATOM 12613 O WAT 734 9.575 135.172 69.712 1.00 0.00 O ATOM 12614 H1 WAT 734 9.627 134.236 69.517 1.00 0.00 H ATOM 12615 H2 WAT 734 10.316 135.336 70.296 1.00 0.00 H TER 12617 WAT 734 ATOM 12617 O WAT 735 76.776 50.621 137.117 1.00 0.00 O ATOM 12618 H1 WAT 735 76.387 51.184 136.447 1.00 0.00 H ATOM 12619 H2 WAT 735 76.839 51.179 137.892 1.00 0.00 H TER 12621 WAT 735 ATOM 12621 O WAT 736 144.281 69.467 142.414 1.00 0.00 O ATOM 12622 H1 WAT 736 144.375 69.858 141.545 1.00 0.00 H ATOM 12623 H2 WAT 736 143.335 69.376 142.534 1.00 0.00 H TER 12625 WAT 736 ATOM 12625 O WAT 737 54.217 0.546 84.272 1.00 0.00 O ATOM 12626 H1 WAT 737 54.616 0.451 85.137 1.00 0.00 H ATOM 12627 H2 WAT 737 53.504 -0.093 84.265 1.00 0.00 H TER 12629 WAT 737 ATOM 12629 O WAT 738 38.927 63.767 21.113 1.00 0.00 O ATOM 12630 H1 WAT 738 38.970 63.058 20.471 1.00 0.00 H ATOM 12631 H2 WAT 738 38.928 63.322 21.961 1.00 0.00 H TER 12633 WAT 738 ATOM 12633 O WAT 739 19.745 122.691 125.299 1.00 0.00 O ATOM 12634 H1 WAT 739 19.766 122.624 126.253 1.00 0.00 H ATOM 12635 H2 WAT 739 19.034 123.305 125.117 1.00 0.00 H TER 12637 WAT 739 ATOM 12637 O WAT 740 104.788 28.465 102.140 1.00 0.00 O ATOM 12638 H1 WAT 740 104.828 29.392 102.375 1.00 0.00 H ATOM 12639 H2 WAT 740 103.928 28.177 102.446 1.00 0.00 H TER 12641 WAT 740 ATOM 12641 O WAT 741 88.591 111.996 95.262 1.00 0.00 O ATOM 12642 H1 WAT 741 87.851 111.577 94.823 1.00 0.00 H ATOM 12643 H2 WAT 741 89.345 111.793 94.708 1.00 0.00 H TER 12645 WAT 741 ATOM 12645 O WAT 742 12.535 38.777 68.129 1.00 0.00 O ATOM 12646 H1 WAT 742 11.607 38.683 67.915 1.00 0.00 H ATOM 12647 H2 WAT 742 12.628 39.692 68.393 1.00 0.00 H TER 12649 WAT 742 ATOM 12649 O WAT 743 113.402 18.633 9.055 1.00 0.00 O ATOM 12650 H1 WAT 743 113.046 18.597 8.167 1.00 0.00 H ATOM 12651 H2 WAT 743 113.873 19.465 9.090 1.00 0.00 H TER 12653 WAT 743 ATOM 12653 O WAT 744 116.526 32.455 77.162 1.00 0.00 O ATOM 12654 H1 WAT 744 115.868 32.285 77.836 1.00 0.00 H ATOM 12655 H2 WAT 744 117.235 31.843 77.361 1.00 0.00 H TER 12657 WAT 744 ATOM 12657 O WAT 745 109.335 41.983 139.958 1.00 0.00 O ATOM 12658 H1 WAT 745 109.651 41.779 140.838 1.00 0.00 H ATOM 12659 H2 WAT 745 108.408 41.745 139.976 1.00 0.00 H TER 12661 WAT 745 ATOM 12661 O WAT 746 139.253 18.655 112.535 1.00 0.00 O ATOM 12662 H1 WAT 746 139.368 19.513 112.945 1.00 0.00 H ATOM 12663 H2 WAT 746 138.663 18.819 111.799 1.00 0.00 H TER 12665 WAT 746 ATOM 12665 O WAT 747 2.842 28.066 1.379 1.00 0.00 O ATOM 12666 H1 WAT 747 2.523 27.165 1.422 1.00 0.00 H ATOM 12667 H2 WAT 747 2.049 28.602 1.401 1.00 0.00 H TER 12669 WAT 747 ATOM 12669 O WAT 748 113.385 58.555 59.504 1.00 0.00 O ATOM 12670 H1 WAT 748 113.814 57.808 59.921 1.00 0.00 H ATOM 12671 H2 WAT 748 112.979 58.190 58.718 1.00 0.00 H TER 12673 WAT 748 ATOM 12673 O WAT 749 102.837 138.450 77.483 1.00 0.00 O ATOM 12674 H1 WAT 749 102.631 139.159 78.092 1.00 0.00 H ATOM 12675 H2 WAT 749 102.870 138.873 76.625 1.00 0.00 H TER 12677 WAT 749 ATOM 12677 O WAT 750 119.597 135.508 106.450 1.00 0.00 O ATOM 12678 H1 WAT 750 120.199 135.907 105.822 1.00 0.00 H ATOM 12679 H2 WAT 750 120.159 135.216 107.168 1.00 0.00 H TER 12681 WAT 750 ATOM 12681 O WAT 751 120.200 53.167 68.403 1.00 0.00 O ATOM 12682 H1 WAT 751 121.029 53.377 68.833 1.00 0.00 H ATOM 12683 H2 WAT 751 119.820 52.473 68.941 1.00 0.00 H TER 12685 WAT 751 ATOM 12685 O WAT 752 103.894 59.911 152.082 1.00 0.00 O ATOM 12686 H1 WAT 752 104.633 59.484 152.514 1.00 0.00 H ATOM 12687 H2 WAT 752 104.292 60.426 151.379 1.00 0.00 H TER 12689 WAT 752 ATOM 12689 O WAT 753 71.861 18.509 119.160 1.00 0.00 O ATOM 12690 H1 WAT 753 72.434 19.049 118.615 1.00 0.00 H ATOM 12691 H2 WAT 753 72.023 17.614 118.865 1.00 0.00 H TER 12693 WAT 753 ATOM 12693 O WAT 754 36.171 119.865 94.180 1.00 0.00 O ATOM 12694 H1 WAT 754 36.703 119.833 94.975 1.00 0.00 H ATOM 12695 H2 WAT 754 36.796 119.730 93.468 1.00 0.00 H TER 12697 WAT 754 ATOM 12697 O WAT 755 96.083 113.666 120.414 1.00 0.00 O ATOM 12698 H1 WAT 755 97.040 113.668 120.438 1.00 0.00 H ATOM 12699 H2 WAT 755 95.829 114.419 120.947 1.00 0.00 H TER 12701 WAT 755 ATOM 12701 O WAT 756 37.796 8.150 93.092 1.00 0.00 O ATOM 12702 H1 WAT 756 38.586 8.639 93.320 1.00 0.00 H ATOM 12703 H2 WAT 756 38.113 7.411 92.574 1.00 0.00 H TER 12705 WAT 756 ATOM 12705 O WAT 757 35.223 92.145 155.974 1.00 0.00 O ATOM 12706 H1 WAT 757 35.487 91.888 155.091 1.00 0.00 H ATOM 12707 H2 WAT 757 35.909 92.746 156.264 1.00 0.00 H TER 12709 WAT 757 ATOM 12709 O WAT 758 25.819 142.995 86.788 1.00 0.00 O ATOM 12710 H1 WAT 758 26.546 143.210 87.372 1.00 0.00 H ATOM 12711 H2 WAT 758 25.332 142.315 87.253 1.00 0.00 H TER 12713 WAT 758 ATOM 12713 O WAT 759 33.431 95.235 4.486 1.00 0.00 O ATOM 12714 H1 WAT 759 33.783 95.809 5.167 1.00 0.00 H ATOM 12715 H2 WAT 759 33.041 95.831 3.848 1.00 0.00 H TER 12717 WAT 759 ATOM 12717 O WAT 760 112.779 88.395 75.923 1.00 0.00 O ATOM 12718 H1 WAT 760 113.135 88.932 75.216 1.00 0.00 H ATOM 12719 H2 WAT 760 111.839 88.578 75.914 1.00 0.00 H TER 12721 WAT 760 ATOM 12721 O WAT 761 145.265 23.367 78.512 1.00 0.00 O ATOM 12722 H1 WAT 761 145.355 23.496 79.456 1.00 0.00 H ATOM 12723 H2 WAT 761 144.323 23.271 78.372 1.00 0.00 H TER 12725 WAT 761 ATOM 12725 O WAT 762 42.312 87.277 9.508 1.00 0.00 O ATOM 12726 H1 WAT 762 42.647 87.215 8.614 1.00 0.00 H ATOM 12727 H2 WAT 762 41.504 86.762 9.498 1.00 0.00 H TER 12729 WAT 762 ATOM 12729 O WAT 763 105.680 45.852 149.644 1.00 0.00 O ATOM 12730 H1 WAT 763 105.288 46.268 150.412 1.00 0.00 H ATOM 12731 H2 WAT 763 105.134 45.082 149.485 1.00 0.00 H TER 12733 WAT 763 ATOM 12733 O WAT 764 102.145 79.973 105.921 1.00 0.00 O ATOM 12734 H1 WAT 764 102.634 80.592 106.465 1.00 0.00 H ATOM 12735 H2 WAT 764 101.981 79.226 106.497 1.00 0.00 H TER 12737 WAT 764 ATOM 12737 O WAT 765 100.453 47.215 139.179 1.00 0.00 O ATOM 12738 H1 WAT 765 100.392 46.454 139.756 1.00 0.00 H ATOM 12739 H2 WAT 765 99.550 47.520 139.089 1.00 0.00 H TER 12741 WAT 765 ATOM 12741 O WAT 766 106.538 121.416 98.278 1.00 0.00 O ATOM 12742 H1 WAT 766 107.268 121.085 98.800 1.00 0.00 H ATOM 12743 H2 WAT 766 105.821 121.514 98.904 1.00 0.00 H TER 12745 WAT 766 ATOM 12745 O WAT 767 144.018 16.210 154.224 1.00 0.00 O ATOM 12746 H1 WAT 767 143.121 16.418 153.962 1.00 0.00 H ATOM 12747 H2 WAT 767 143.939 15.914 155.131 1.00 0.00 H TER 12749 WAT 767 ATOM 12749 O WAT 768 143.850 68.818 97.298 1.00 0.00 O ATOM 12750 H1 WAT 768 144.055 69.330 98.080 1.00 0.00 H ATOM 12751 H2 WAT 768 143.177 69.329 96.848 1.00 0.00 H TER 12753 WAT 768 ATOM 12753 O WAT 769 87.297 144.768 117.294 1.00 0.00 O ATOM 12754 H1 WAT 769 87.765 144.844 118.126 1.00 0.00 H ATOM 12755 H2 WAT 769 86.376 144.888 117.526 1.00 0.00 H TER 12757 WAT 769 ATOM 12757 O WAT 770 30.728 75.909 120.167 1.00 0.00 O ATOM 12758 H1 WAT 770 29.927 76.410 120.013 1.00 0.00 H ATOM 12759 H2 WAT 770 31.219 76.431 120.801 1.00 0.00 H TER 12761 WAT 770 ATOM 12761 O WAT 771 104.024 106.142 96.862 1.00 0.00 O ATOM 12762 H1 WAT 771 104.353 105.349 96.438 1.00 0.00 H ATOM 12763 H2 WAT 771 104.095 106.820 96.190 1.00 0.00 H TER 12765 WAT 771 ATOM 12765 O WAT 772 92.053 117.223 143.025 1.00 0.00 O ATOM 12766 H1 WAT 772 92.815 116.764 142.672 1.00 0.00 H ATOM 12767 H2 WAT 772 92.421 117.963 143.507 1.00 0.00 H TER 12769 WAT 772 ATOM 12769 O WAT 773 19.573 34.126 79.783 1.00 0.00 O ATOM 12770 H1 WAT 773 19.290 33.515 79.102 1.00 0.00 H ATOM 12771 H2 WAT 773 20.420 33.786 80.071 1.00 0.00 H TER 12773 WAT 773 ATOM 12773 O WAT 774 135.706 73.791 62.193 1.00 0.00 O ATOM 12774 H1 WAT 774 136.174 74.623 62.265 1.00 0.00 H ATOM 12775 H2 WAT 774 136.131 73.339 61.465 1.00 0.00 H TER 12777 WAT 774 ATOM 12777 O WAT 775 126.705 10.035 123.325 1.00 0.00 O ATOM 12778 H1 WAT 775 126.684 10.983 123.192 1.00 0.00 H ATOM 12779 H2 WAT 775 126.570 9.923 124.266 1.00 0.00 H TER 12781 WAT 775 ATOM 12781 O WAT 776 143.256 7.978 115.264 1.00 0.00 O ATOM 12782 H1 WAT 776 142.330 8.214 115.204 1.00 0.00 H ATOM 12783 H2 WAT 776 143.344 7.213 114.695 1.00 0.00 H TER 12785 WAT 776 ATOM 12785 O WAT 777 116.266 41.860 10.549 1.00 0.00 O ATOM 12786 H1 WAT 777 115.761 41.137 10.178 1.00 0.00 H ATOM 12787 H2 WAT 777 115.946 41.939 11.448 1.00 0.00 H TER 12789 WAT 777 ATOM 12789 O WAT 778 16.956 74.777 75.396 1.00 0.00 O ATOM 12790 H1 WAT 778 16.228 74.504 74.837 1.00 0.00 H ATOM 12791 H2 WAT 778 16.556 74.931 76.251 1.00 0.00 H TER 12793 WAT 778 ATOM 12793 O WAT 779 139.758 104.190 68.029 1.00 0.00 O ATOM 12794 H1 WAT 779 139.235 104.651 67.373 1.00 0.00 H ATOM 12795 H2 WAT 779 139.339 103.333 68.109 1.00 0.00 H TER 12797 WAT 779 ATOM 12797 O WAT 780 19.928 61.525 75.707 1.00 0.00 O ATOM 12798 H1 WAT 780 19.296 60.822 75.859 1.00 0.00 H ATOM 12799 H2 WAT 780 19.872 62.071 76.492 1.00 0.00 H TER 12801 WAT 780 ATOM 12801 O WAT 781 54.889 3.530 53.764 1.00 0.00 O ATOM 12802 H1 WAT 781 55.706 3.036 53.703 1.00 0.00 H ATOM 12803 H2 WAT 781 55.116 4.408 53.458 1.00 0.00 H TER 12805 WAT 781 ATOM 12805 O WAT 782 87.602 142.753 98.734 1.00 0.00 O ATOM 12806 H1 WAT 782 88.503 142.511 98.520 1.00 0.00 H ATOM 12807 H2 WAT 782 87.520 143.658 98.432 1.00 0.00 H TER 12809 WAT 782 ATOM 12809 O WAT 783 125.882 22.038 137.172 1.00 0.00 O ATOM 12810 H1 WAT 783 126.283 21.306 136.704 1.00 0.00 H ATOM 12811 H2 WAT 783 126.358 22.081 138.002 1.00 0.00 H TER 12813 WAT 783 ATOM 12813 O WAT 784 16.895 138.747 85.807 1.00 0.00 O ATOM 12814 H1 WAT 784 16.974 138.004 85.209 1.00 0.00 H ATOM 12815 H2 WAT 784 17.793 139.055 85.927 1.00 0.00 H TER 12817 WAT 784 ATOM 12817 O WAT 785 18.665 99.871 146.338 1.00 0.00 O ATOM 12818 H1 WAT 785 18.847 98.937 146.447 1.00 0.00 H ATOM 12819 H2 WAT 785 19.503 100.249 146.072 1.00 0.00 H TER 12821 WAT 785 ATOM 12821 O WAT 786 40.393 46.586 112.944 1.00 0.00 O ATOM 12822 H1 WAT 786 41.053 46.703 112.261 1.00 0.00 H ATOM 12823 H2 WAT 786 39.574 46.455 112.465 1.00 0.00 H TER 12825 WAT 786 ATOM 12825 O WAT 787 112.410 144.043 137.597 1.00 0.00 O ATOM 12826 H1 WAT 787 112.167 144.923 137.885 1.00 0.00 H ATOM 12827 H2 WAT 787 112.254 144.049 136.653 1.00 0.00 H TER 12829 WAT 787 ATOM 12829 O WAT 788 132.914 129.131 107.692 1.00 0.00 O ATOM 12830 H1 WAT 788 133.586 129.749 107.980 1.00 0.00 H ATOM 12831 H2 WAT 788 133.407 128.382 107.357 1.00 0.00 H TER 12833 WAT 788 ATOM 12833 O WAT 789 43.770 76.799 14.526 1.00 0.00 O ATOM 12834 H1 WAT 789 43.497 76.115 15.138 1.00 0.00 H ATOM 12835 H2 WAT 789 44.048 76.322 13.744 1.00 0.00 H TER 12837 WAT 789 ATOM 12837 O WAT 790 35.550 74.773 88.138 1.00 0.00 O ATOM 12838 H1 WAT 790 35.612 74.586 89.075 1.00 0.00 H ATOM 12839 H2 WAT 790 35.490 73.911 87.726 1.00 0.00 H TER 12841 WAT 790 ATOM 12841 O WAT 791 110.130 39.967 97.684 1.00 0.00 O ATOM 12842 H1 WAT 791 110.880 39.967 98.279 1.00 0.00 H ATOM 12843 H2 WAT 791 109.445 39.500 98.162 1.00 0.00 H TER 12845 WAT 791 ATOM 12845 O WAT 792 124.116 45.879 102.122 1.00 0.00 O ATOM 12846 H1 WAT 792 124.619 45.216 101.649 1.00 0.00 H ATOM 12847 H2 WAT 792 124.648 46.078 102.893 1.00 0.00 H TER 12849 WAT 792 ATOM 12849 O WAT 793 23.127 1.951 118.153 1.00 0.00 O ATOM 12850 H1 WAT 793 22.458 2.494 118.570 1.00 0.00 H ATOM 12851 H2 WAT 793 23.948 2.416 118.315 1.00 0.00 H TER 12853 WAT 793 ATOM 12853 O WAT 794 108.171 84.094 118.691 1.00 0.00 O ATOM 12854 H1 WAT 794 108.857 83.436 118.802 1.00 0.00 H ATOM 12855 H2 WAT 794 107.378 83.673 119.022 1.00 0.00 H TER 12857 WAT 794 ATOM 12857 O WAT 795 31.267 4.849 133.589 1.00 0.00 O ATOM 12858 H1 WAT 795 31.847 4.639 134.321 1.00 0.00 H ATOM 12859 H2 WAT 795 31.618 5.665 133.232 1.00 0.00 H TER 12861 WAT 795 ATOM 12861 O WAT 796 128.700 126.739 129.118 1.00 0.00 O ATOM 12862 H1 WAT 796 128.296 127.395 128.551 1.00 0.00 H ATOM 12863 H2 WAT 796 129.591 126.646 128.780 1.00 0.00 H TER 12865 WAT 796 ATOM 12865 O WAT 797 125.465 84.415 0.432 1.00 0.00 O ATOM 12866 H1 WAT 797 126.170 83.819 0.685 1.00 0.00 H ATOM 12867 H2 WAT 797 125.766 85.277 0.719 1.00 0.00 H TER 12869 WAT 797 ATOM 12869 O WAT 798 104.285 80.953 8.765 1.00 0.00 O ATOM 12870 H1 WAT 798 103.903 80.256 8.231 1.00 0.00 H ATOM 12871 H2 WAT 798 105.159 80.632 8.987 1.00 0.00 H TER 12873 WAT 798 ATOM 12873 O WAT 799 76.149 133.311 142.774 1.00 0.00 O ATOM 12874 H1 WAT 799 75.200 133.220 142.695 1.00 0.00 H ATOM 12875 H2 WAT 799 76.484 133.096 141.904 1.00 0.00 H TER 12877 WAT 799 ATOM 12877 O WAT 800 109.905 14.245 67.684 1.00 0.00 O ATOM 12878 H1 WAT 800 109.977 13.843 66.819 1.00 0.00 H ATOM 12879 H2 WAT 800 109.912 15.187 67.512 1.00 0.00 H TER 12881 WAT 800 ATOM 12881 O WAT 801 100.522 101.517 23.204 1.00 0.00 O ATOM 12882 H1 WAT 801 101.119 102.014 22.645 1.00 0.00 H ATOM 12883 H2 WAT 801 99.791 102.113 23.364 1.00 0.00 H TER 12885 WAT 801 ATOM 12885 O WAT 802 81.341 71.121 130.511 1.00 0.00 O ATOM 12886 H1 WAT 802 80.570 71.564 130.866 1.00 0.00 H ATOM 12887 H2 WAT 802 81.671 71.716 129.839 1.00 0.00 H TER 12889 WAT 802 ATOM 12889 O WAT 803 43.168 87.018 98.833 1.00 0.00 O ATOM 12890 H1 WAT 803 43.486 87.909 98.682 1.00 0.00 H ATOM 12891 H2 WAT 803 42.728 87.062 99.682 1.00 0.00 H TER 12893 WAT 803 ATOM 12893 O WAT 804 118.032 73.014 154.477 1.00 0.00 O ATOM 12894 H1 WAT 804 118.662 73.582 154.922 1.00 0.00 H ATOM 12895 H2 WAT 804 117.196 73.203 154.904 1.00 0.00 H TER 12897 WAT 804 ATOM 12897 O WAT 805 89.579 59.281 75.876 1.00 0.00 O ATOM 12898 H1 WAT 805 89.501 59.678 75.009 1.00 0.00 H ATOM 12899 H2 WAT 805 89.860 58.382 75.703 1.00 0.00 H TER 12901 WAT 805 ATOM 12901 O WAT 806 95.786 61.958 104.264 1.00 0.00 O ATOM 12902 H1 WAT 806 96.691 61.800 104.534 1.00 0.00 H ATOM 12903 H2 WAT 806 95.834 62.055 103.313 1.00 0.00 H TER 12905 WAT 806 ATOM 12905 O WAT 807 95.264 51.835 1.440 1.00 0.00 O ATOM 12906 H1 WAT 807 95.782 51.951 2.236 1.00 0.00 H ATOM 12907 H2 WAT 807 95.692 52.395 0.792 1.00 0.00 H TER 12909 WAT 807 ATOM 12909 O WAT 808 40.384 69.896 140.247 1.00 0.00 O ATOM 12910 H1 WAT 808 40.598 69.169 140.832 1.00 0.00 H ATOM 12911 H2 WAT 808 41.067 69.873 139.577 1.00 0.00 H TER 12913 WAT 808 ATOM 12913 O WAT 809 40.723 68.507 81.061 1.00 0.00 O ATOM 12914 H1 WAT 809 41.096 69.389 81.063 1.00 0.00 H ATOM 12915 H2 WAT 809 39.783 68.645 80.943 1.00 0.00 H TER 12917 WAT 809 ATOM 12917 O WAT 810 45.048 105.773 117.950 1.00 0.00 O ATOM 12918 H1 WAT 810 45.669 105.080 118.173 1.00 0.00 H ATOM 12919 H2 WAT 810 44.967 106.290 118.751 1.00 0.00 H TER 12921 WAT 810 ATOM 12921 O WAT 811 100.624 136.930 95.852 1.00 0.00 O ATOM 12922 H1 WAT 811 101.190 136.447 95.249 1.00 0.00 H ATOM 12923 H2 WAT 811 101.040 137.787 95.937 1.00 0.00 H TER 12925 WAT 811 ATOM 12925 O WAT 812 91.211 72.140 81.352 1.00 0.00 O ATOM 12926 H1 WAT 812 90.965 71.717 80.529 1.00 0.00 H ATOM 12927 H2 WAT 812 92.152 72.296 81.270 1.00 0.00 H TER 12929 WAT 812 ATOM 12929 O WAT 813 22.236 32.210 142.824 1.00 0.00 O ATOM 12930 H1 WAT 813 22.136 31.273 142.655 1.00 0.00 H ATOM 12931 H2 WAT 813 21.342 32.528 142.947 1.00 0.00 H TER 12933 WAT 813 ATOM 12933 O WAT 814 10.745 128.332 127.365 1.00 0.00 O ATOM 12934 H1 WAT 814 11.427 129.002 127.407 1.00 0.00 H ATOM 12935 H2 WAT 814 10.301 128.388 128.211 1.00 0.00 H TER 12937 WAT 814 ATOM 12937 O WAT 815 33.459 139.331 157.801 1.00 0.00 O ATOM 12938 H1 WAT 815 34.021 138.594 158.041 1.00 0.00 H ATOM 12939 H2 WAT 815 34.064 139.993 157.466 1.00 0.00 H TER 12941 WAT 815 ATOM 12941 O WAT 816 104.049 99.251 127.611 1.00 0.00 O ATOM 12942 H1 WAT 816 104.809 98.737 127.883 1.00 0.00 H ATOM 12943 H2 WAT 816 104.397 99.880 126.980 1.00 0.00 H TER 12945 WAT 816 ATOM 12945 O WAT 817 99.232 14.136 90.525 1.00 0.00 O ATOM 12946 H1 WAT 817 99.284 13.323 90.022 1.00 0.00 H ATOM 12947 H2 WAT 817 98.295 14.324 90.580 1.00 0.00 H TER 12949 WAT 817 ATOM 12949 O WAT 818 41.734 73.403 158.518 1.00 0.00 O ATOM 12950 H1 WAT 818 41.196 73.645 159.272 1.00 0.00 H ATOM 12951 H2 WAT 818 42.316 74.152 158.389 1.00 0.00 H TER 12953 WAT 818 ATOM 12953 O WAT 819 106.437 143.145 123.989 1.00 0.00 O ATOM 12954 H1 WAT 819 105.744 143.710 123.648 1.00 0.00 H ATOM 12955 H2 WAT 819 107.220 143.695 123.979 1.00 0.00 H TER 12957 WAT 819 ATOM 12957 O WAT 820 77.691 64.294 78.051 1.00 0.00 O ATOM 12958 H1 WAT 820 77.244 64.652 78.817 1.00 0.00 H ATOM 12959 H2 WAT 820 77.204 64.644 77.304 1.00 0.00 H TER 12961 WAT 820 ATOM 12961 O WAT 821 4.364 66.279 63.243 1.00 0.00 O ATOM 12962 H1 WAT 821 3.958 66.213 62.378 1.00 0.00 H ATOM 12963 H2 WAT 821 5.126 66.842 63.107 1.00 0.00 H TER 12965 WAT 821 ATOM 12965 O WAT 822 83.692 26.251 20.854 1.00 0.00 O ATOM 12966 H1 WAT 822 84.069 27.086 21.132 1.00 0.00 H ATOM 12967 H2 WAT 822 83.685 26.298 19.898 1.00 0.00 H TER 12969 WAT 822 ATOM 12969 O WAT 823 72.351 112.115 55.511 1.00 0.00 O ATOM 12970 H1 WAT 823 72.126 111.372 56.071 1.00 0.00 H ATOM 12971 H2 WAT 823 71.605 112.710 55.591 1.00 0.00 H TER 12973 WAT 823 ATOM 12973 O WAT 824 5.017 132.483 127.856 1.00 0.00 O ATOM 12974 H1 WAT 824 4.980 132.462 126.899 1.00 0.00 H ATOM 12975 H2 WAT 824 5.843 132.925 128.053 1.00 0.00 H TER 12977 WAT 824 ATOM 12977 O WAT 825 140.523 98.858 73.380 1.00 0.00 O ATOM 12978 H1 WAT 825 140.195 99.063 72.504 1.00 0.00 H ATOM 12979 H2 WAT 825 139.771 98.480 73.836 1.00 0.00 H TER 12981 WAT 825 ATOM 12981 O WAT 826 94.274 86.179 134.857 1.00 0.00 O ATOM 12982 H1 WAT 826 94.434 85.248 134.705 1.00 0.00 H ATOM 12983 H2 WAT 826 94.752 86.622 134.156 1.00 0.00 H TER 12985 WAT 826 ATOM 12985 O WAT 827 70.568 120.891 104.749 1.00 0.00 O ATOM 12986 H1 WAT 827 70.998 120.083 105.030 1.00 0.00 H ATOM 12987 H2 WAT 827 70.068 121.175 105.514 1.00 0.00 H TER 12989 WAT 827 ATOM 12989 O WAT 828 43.044 95.721 60.849 1.00 0.00 O ATOM 12990 H1 WAT 828 42.974 96.416 61.504 1.00 0.00 H ATOM 12991 H2 WAT 828 43.984 95.637 60.689 1.00 0.00 H TER 12993 WAT 828 ATOM 12993 O WAT 829 46.957 11.313 76.569 1.00 0.00 O ATOM 12994 H1 WAT 829 47.614 11.834 77.030 1.00 0.00 H ATOM 12995 H2 WAT 829 46.120 11.626 76.911 1.00 0.00 H TER 12997 WAT 829 ATOM 12997 O WAT 830 134.443 135.145 105.438 1.00 0.00 O ATOM 12998 H1 WAT 830 133.666 134.589 105.370 1.00 0.00 H ATOM 12999 H2 WAT 830 134.736 135.259 104.534 1.00 0.00 H TER 13001 WAT 830 ATOM 13001 O WAT 831 71.684 4.172 61.077 1.00 0.00 O ATOM 13002 H1 WAT 831 71.026 4.474 60.451 1.00 0.00 H ATOM 13003 H2 WAT 831 72.264 3.611 60.562 1.00 0.00 H TER 13005 WAT 831 ATOM 13005 O WAT 832 131.806 20.938 154.622 1.00 0.00 O ATOM 13006 H1 WAT 832 130.976 21.367 154.412 1.00 0.00 H ATOM 13007 H2 WAT 832 131.597 20.361 155.357 1.00 0.00 H TER 13009 WAT 832 ATOM 13009 O WAT 833 94.441 137.576 65.057 1.00 0.00 O ATOM 13010 H1 WAT 833 94.690 137.103 64.263 1.00 0.00 H ATOM 13011 H2 WAT 833 93.772 138.196 64.766 1.00 0.00 H TER 13013 WAT 833 ATOM 13013 O WAT 834 125.958 58.907 122.632 1.00 0.00 O ATOM 13014 H1 WAT 834 125.330 59.601 122.832 1.00 0.00 H ATOM 13015 H2 WAT 834 126.203 59.063 121.720 1.00 0.00 H TER 13017 WAT 834 ATOM 13017 O WAT 835 12.723 36.830 128.299 1.00 0.00 O ATOM 13018 H1 WAT 835 12.396 36.810 127.399 1.00 0.00 H ATOM 13019 H2 WAT 835 12.970 37.743 128.444 1.00 0.00 H TER 13021 WAT 835 ATOM 13021 O WAT 836 8.620 39.768 113.901 1.00 0.00 O ATOM 13022 H1 WAT 836 9.003 40.602 113.632 1.00 0.00 H ATOM 13023 H2 WAT 836 7.716 39.807 113.587 1.00 0.00 H TER 13025 WAT 836 ATOM 13025 O WAT 837 70.583 44.095 151.741 1.00 0.00 O ATOM 13026 H1 WAT 837 69.928 44.793 151.765 1.00 0.00 H ATOM 13027 H2 WAT 837 71.399 44.523 151.998 1.00 0.00 H TER 13029 WAT 837 ATOM 13029 O WAT 838 63.658 137.288 144.380 1.00 0.00 O ATOM 13030 H1 WAT 838 63.911 138.121 144.777 1.00 0.00 H ATOM 13031 H2 WAT 838 63.535 136.697 145.122 1.00 0.00 H TER 13033 WAT 838 ATOM 13033 O WAT 839 59.768 66.389 75.311 1.00 0.00 O ATOM 13034 H1 WAT 839 59.298 67.131 75.692 1.00 0.00 H ATOM 13035 H2 WAT 839 60.064 66.706 74.458 1.00 0.00 H TER 13037 WAT 839 ATOM 13037 O WAT 840 72.116 74.754 158.540 1.00 0.00 O ATOM 13038 H1 WAT 840 72.751 74.834 157.828 1.00 0.00 H ATOM 13039 H2 WAT 840 71.264 74.772 158.104 1.00 0.00 H TER 13041 WAT 840 ATOM 13041 O WAT 841 13.926 137.743 86.478 1.00 0.00 O ATOM 13042 H1 WAT 841 14.441 137.552 85.694 1.00 0.00 H ATOM 13043 H2 WAT 841 14.267 137.142 87.140 1.00 0.00 H TER 13045 WAT 841 ATOM 13045 O WAT 842 122.348 120.632 123.277 1.00 0.00 O ATOM 13046 H1 WAT 842 122.761 120.969 124.072 1.00 0.00 H ATOM 13047 H2 WAT 842 121.496 121.067 123.246 1.00 0.00 H TER 13049 WAT 842 ATOM 13049 O WAT 843 104.043 73.520 77.997 1.00 0.00 O ATOM 13050 H1 WAT 843 104.945 73.835 77.953 1.00 0.00 H ATOM 13051 H2 WAT 843 104.093 72.722 78.524 1.00 0.00 H TER 13053 WAT 843 ATOM 13053 O WAT 844 85.588 56.206 135.535 1.00 0.00 O ATOM 13054 H1 WAT 844 85.983 55.367 135.297 1.00 0.00 H ATOM 13055 H2 WAT 844 86.193 56.862 135.190 1.00 0.00 H TER 13057 WAT 844 ATOM 13057 O WAT 845 113.615 3.056 111.853 1.00 0.00 O ATOM 13058 H1 WAT 845 113.046 2.296 111.730 1.00 0.00 H ATOM 13059 H2 WAT 845 113.054 3.710 112.270 1.00 0.00 H TER 13061 WAT 845 ATOM 13061 O WAT 846 90.565 42.590 18.964 1.00 0.00 O ATOM 13062 H1 WAT 846 89.912 42.843 18.311 1.00 0.00 H ATOM 13063 H2 WAT 846 90.173 41.844 19.418 1.00 0.00 H TER 13065 WAT 846 ATOM 13065 O WAT 847 73.256 40.399 24.151 1.00 0.00 O ATOM 13066 H1 WAT 847 73.685 41.151 23.743 1.00 0.00 H ATOM 13067 H2 WAT 847 73.977 39.870 24.493 1.00 0.00 H TER 13069 WAT 847 ATOM 13069 O WAT 848 54.663 60.523 74.772 1.00 0.00 O ATOM 13070 H1 WAT 848 54.194 61.189 74.270 1.00 0.00 H ATOM 13071 H2 WAT 848 54.368 60.650 75.674 1.00 0.00 H TER 13073 WAT 848 ATOM 13073 O WAT 849 29.100 34.683 157.717 1.00 0.00 O ATOM 13074 H1 WAT 849 28.988 34.573 156.773 1.00 0.00 H ATOM 13075 H2 WAT 849 30.016 34.456 157.877 1.00 0.00 H TER 13077 WAT 849 ATOM 13077 O WAT 850 67.562 20.308 62.350 1.00 0.00 O ATOM 13078 H1 WAT 850 68.279 19.693 62.193 1.00 0.00 H ATOM 13079 H2 WAT 850 67.782 20.724 63.184 1.00 0.00 H TER 13081 WAT 850 ATOM 13081 O WAT 851 63.641 72.179 0.051 1.00 0.00 O ATOM 13082 H1 WAT 851 64.323 72.463 0.659 1.00 0.00 H ATOM 13083 H2 WAT 851 63.619 71.227 0.143 1.00 0.00 H TER 13085 WAT 851 ATOM 13085 O WAT 852 85.228 17.220 53.657 1.00 0.00 O ATOM 13086 H1 WAT 852 86.151 16.978 53.736 1.00 0.00 H ATOM 13087 H2 WAT 852 84.847 16.989 54.505 1.00 0.00 H TER 13089 WAT 852 ATOM 13089 O WAT 853 1.122 18.655 146.588 1.00 0.00 O ATOM 13090 H1 WAT 853 1.550 19.506 146.675 1.00 0.00 H ATOM 13091 H2 WAT 853 1.775 18.099 146.163 1.00 0.00 H TER 13093 WAT 853 ATOM 13093 O WAT 854 49.512 89.439 112.548 1.00 0.00 O ATOM 13094 H1 WAT 854 50.255 89.504 111.949 1.00 0.00 H ATOM 13095 H2 WAT 854 49.626 88.593 112.981 1.00 0.00 H TER 13097 WAT 854 ATOM 13097 O WAT 855 41.298 120.154 15.812 1.00 0.00 O ATOM 13098 H1 WAT 855 42.115 120.603 16.030 1.00 0.00 H ATOM 13099 H2 WAT 855 40.831 120.090 16.645 1.00 0.00 H TER 13101 WAT 855 ATOM 13101 O WAT 856 122.029 57.418 106.964 1.00 0.00 O ATOM 13102 H1 WAT 856 122.676 58.123 106.953 1.00 0.00 H ATOM 13103 H2 WAT 856 121.725 57.358 106.059 1.00 0.00 H TER 13105 WAT 856 ATOM 13105 O WAT 857 43.817 15.370 155.368 1.00 0.00 O ATOM 13106 H1 WAT 857 42.961 15.473 154.953 1.00 0.00 H ATOM 13107 H2 WAT 857 44.076 14.472 155.163 1.00 0.00 H TER 13109 WAT 857 ATOM 13109 O WAT 858 129.226 114.456 138.659 1.00 0.00 O ATOM 13110 H1 WAT 858 128.862 114.665 137.800 1.00 0.00 H ATOM 13111 H2 WAT 858 129.906 113.806 138.480 1.00 0.00 H TER 13113 WAT 858 ATOM 13113 O WAT 859 70.886 94.637 72.694 1.00 0.00 O ATOM 13114 H1 WAT 859 71.403 95.316 73.127 1.00 0.00 H ATOM 13115 H2 WAT 859 70.073 94.598 73.196 1.00 0.00 H TER 13117 WAT 859 ATOM 13117 O WAT 860 112.990 8.121 111.680 1.00 0.00 O ATOM 13118 H1 WAT 860 112.919 9.017 111.351 1.00 0.00 H ATOM 13119 H2 WAT 860 113.654 8.169 112.367 1.00 0.00 H TER 13121 WAT 860 ATOM 13121 O WAT 861 60.970 75.903 123.876 1.00 0.00 O ATOM 13122 H1 WAT 861 60.414 75.394 124.465 1.00 0.00 H ATOM 13123 H2 WAT 861 61.581 76.357 124.456 1.00 0.00 H TER 13125 WAT 861 ATOM 13125 O WAT 862 48.978 62.524 133.269 1.00 0.00 O ATOM 13126 H1 WAT 862 48.367 62.458 134.003 1.00 0.00 H ATOM 13127 H2 WAT 862 48.557 63.133 132.662 1.00 0.00 H TER 13129 WAT 862 ATOM 13129 O WAT 863 131.458 11.666 154.072 1.00 0.00 O ATOM 13130 H1 WAT 863 131.351 10.752 153.808 1.00 0.00 H ATOM 13131 H2 WAT 863 131.060 11.713 154.941 1.00 0.00 H TER 13133 WAT 863 ATOM 13133 O WAT 864 131.743 71.282 80.626 1.00 0.00 O ATOM 13134 H1 WAT 864 131.541 71.194 81.557 1.00 0.00 H ATOM 13135 H2 WAT 864 132.644 70.971 80.545 1.00 0.00 H TER 13137 WAT 864 ATOM 13137 O WAT 865 58.966 26.526 68.860 1.00 0.00 O ATOM 13138 H1 WAT 865 59.522 27.140 68.380 1.00 0.00 H ATOM 13139 H2 WAT 865 58.106 26.609 68.448 1.00 0.00 H TER 13141 WAT 865 ATOM 13141 O WAT 866 6.922 95.758 59.272 1.00 0.00 O ATOM 13142 H1 WAT 866 6.267 96.321 59.685 1.00 0.00 H ATOM 13143 H2 WAT 866 7.704 96.307 59.212 1.00 0.00 H TER 13145 WAT 866 ATOM 13145 O WAT 867 25.755 13.724 8.823 1.00 0.00 O ATOM 13146 H1 WAT 867 25.914 13.960 9.737 1.00 0.00 H ATOM 13147 H2 WAT 867 26.580 13.919 8.379 1.00 0.00 H TER 13149 WAT 867 ATOM 13149 O WAT 868 88.140 21.110 59.557 1.00 0.00 O ATOM 13150 H1 WAT 868 88.443 21.262 58.662 1.00 0.00 H ATOM 13151 H2 WAT 868 87.308 21.580 59.611 1.00 0.00 H TER 13153 WAT 868 ATOM 13153 O WAT 869 55.838 70.434 129.727 1.00 0.00 O ATOM 13154 H1 WAT 869 56.166 69.538 129.656 1.00 0.00 H ATOM 13155 H2 WAT 869 55.758 70.732 128.821 1.00 0.00 H TER 13157 WAT 869 ATOM 13157 O WAT 870 71.287 105.544 7.983 1.00 0.00 O ATOM 13158 H1 WAT 870 70.669 106.118 7.530 1.00 0.00 H ATOM 13159 H2 WAT 870 71.209 104.704 7.531 1.00 0.00 H TER 13161 WAT 870 ATOM 13161 O WAT 871 90.143 47.479 129.725 1.00 0.00 O ATOM 13162 H1 WAT 871 89.858 46.566 129.735 1.00 0.00 H ATOM 13163 H2 WAT 871 89.630 47.884 129.026 1.00 0.00 H TER 13165 WAT 871 ATOM 13165 O WAT 872 59.988 17.875 152.865 1.00 0.00 O ATOM 13166 H1 WAT 872 59.891 17.390 152.046 1.00 0.00 H ATOM 13167 H2 WAT 872 60.260 17.216 153.504 1.00 0.00 H TER 13169 WAT 872 ATOM 13169 O WAT 873 57.852 137.063 146.680 1.00 0.00 O ATOM 13170 H1 WAT 873 58.808 137.107 146.704 1.00 0.00 H ATOM 13171 H2 WAT 873 57.573 137.475 147.498 1.00 0.00 H TER 13173 WAT 873 ATOM 13173 O WAT 874 90.457 12.188 72.149 1.00 0.00 O ATOM 13174 H1 WAT 874 89.763 11.539 72.266 1.00 0.00 H ATOM 13175 H2 WAT 874 91.010 12.088 72.924 1.00 0.00 H TER 13177 WAT 874 ATOM 13177 O WAT 875 19.052 50.255 111.414 1.00 0.00 O ATOM 13178 H1 WAT 875 19.130 49.430 111.893 1.00 0.00 H ATOM 13179 H2 WAT 875 19.731 50.207 110.741 1.00 0.00 H TER 13181 WAT 875 ATOM 13181 O WAT 876 67.734 99.310 137.792 1.00 0.00 O ATOM 13182 H1 WAT 876 68.153 98.970 137.001 1.00 0.00 H ATOM 13183 H2 WAT 876 68.135 100.169 137.925 1.00 0.00 H TER 13185 WAT 876 ATOM 13185 O WAT 877 35.322 98.803 77.972 1.00 0.00 O ATOM 13186 H1 WAT 877 35.444 99.119 77.077 1.00 0.00 H ATOM 13187 H2 WAT 877 34.403 98.536 78.009 1.00 0.00 H TER 13189 WAT 877 ATOM 13189 O WAT 878 39.948 15.598 110.757 1.00 0.00 O ATOM 13190 H1 WAT 878 40.834 15.289 110.948 1.00 0.00 H ATOM 13191 H2 WAT 878 39.749 16.210 111.465 1.00 0.00 H TER 13193 WAT 878 ATOM 13193 O WAT 879 61.021 94.767 110.732 1.00 0.00 O ATOM 13194 H1 WAT 879 60.811 94.081 111.365 1.00 0.00 H ATOM 13195 H2 WAT 879 60.334 95.423 110.852 1.00 0.00 H TER 13197 WAT 879 ATOM 13197 O WAT 880 40.508 97.287 116.540 1.00 0.00 O ATOM 13198 H1 WAT 880 40.738 97.181 117.463 1.00 0.00 H ATOM 13199 H2 WAT 880 41.350 97.330 116.086 1.00 0.00 H TER 13201 WAT 880 ATOM 13201 O WAT 881 13.259 86.657 132.790 1.00 0.00 O ATOM 13202 H1 WAT 881 13.490 85.845 133.242 1.00 0.00 H ATOM 13203 H2 WAT 881 12.792 87.173 133.448 1.00 0.00 H TER 13205 WAT 881 ATOM 13205 O WAT 882 31.965 145.112 75.198 1.00 0.00 O ATOM 13206 H1 WAT 882 31.124 144.759 74.908 1.00 0.00 H ATOM 13207 H2 WAT 882 32.618 144.570 74.756 1.00 0.00 H TER 13209 WAT 882 ATOM 13209 O WAT 883 104.962 33.200 28.354 1.00 0.00 O ATOM 13210 H1 WAT 883 104.886 34.090 28.012 1.00 0.00 H ATOM 13211 H2 WAT 883 105.668 33.250 28.998 1.00 0.00 H TER 13213 WAT 883 ATOM 13213 O WAT 884 59.930 95.421 139.267 1.00 0.00 O ATOM 13214 H1 WAT 884 59.542 95.342 140.138 1.00 0.00 H ATOM 13215 H2 WAT 884 59.337 96.006 138.794 1.00 0.00 H TER 13217 WAT 884 ATOM 13217 O WAT 885 26.175 103.739 157.833 1.00 0.00 O ATOM 13218 H1 WAT 885 26.773 104.399 157.484 1.00 0.00 H ATOM 13219 H2 WAT 885 26.363 103.717 158.771 1.00 0.00 H TER 13221 WAT 885 ATOM 13221 O WAT 886 76.331 142.734 132.652 1.00 0.00 O ATOM 13222 H1 WAT 886 76.521 141.936 132.158 1.00 0.00 H ATOM 13223 H2 WAT 886 76.914 143.393 132.275 1.00 0.00 H TER 13225 WAT 886 ATOM 13225 O WAT 887 46.899 3.838 139.368 1.00 0.00 O ATOM 13226 H1 WAT 887 46.074 3.396 139.567 1.00 0.00 H ATOM 13227 H2 WAT 887 47.311 3.972 140.222 1.00 0.00 H TER 13229 WAT 887 ATOM 13229 O WAT 888 28.476 4.815 92.765 1.00 0.00 O ATOM 13230 H1 WAT 888 27.687 4.275 92.814 1.00 0.00 H ATOM 13231 H2 WAT 888 28.186 5.687 93.031 1.00 0.00 H TER 13233 WAT 888 ATOM 13233 O WAT 889 16.044 96.729 132.572 1.00 0.00 O ATOM 13234 H1 WAT 889 15.363 96.993 131.955 1.00 0.00 H ATOM 13235 H2 WAT 889 16.050 95.773 132.528 1.00 0.00 H TER 13237 WAT 889 ATOM 13237 O WAT 890 82.303 69.407 23.320 1.00 0.00 O ATOM 13238 H1 WAT 890 81.692 69.995 23.763 1.00 0.00 H ATOM 13239 H2 WAT 890 81.858 68.560 23.313 1.00 0.00 H TER 13241 WAT 890 ATOM 13241 O WAT 891 101.870 99.245 131.605 1.00 0.00 O ATOM 13242 H1 WAT 891 102.745 98.896 131.772 1.00 0.00 H ATOM 13243 H2 WAT 891 101.965 99.754 130.799 1.00 0.00 H TER 13245 WAT 891 ATOM 13245 O WAT 892 143.693 0.424 151.416 1.00 0.00 O ATOM 13246 H1 WAT 892 143.938 0.629 152.318 1.00 0.00 H ATOM 13247 H2 WAT 892 144.446 0.701 150.894 1.00 0.00 H TER 13249 WAT 892 ATOM 13249 O WAT 893 15.751 122.044 23.507 1.00 0.00 O ATOM 13250 H1 WAT 893 15.126 122.046 24.232 1.00 0.00 H ATOM 13251 H2 WAT 893 15.585 121.219 23.050 1.00 0.00 H TER 13253 WAT 893 ATOM 13253 O WAT 894 1.886 11.402 152.022 1.00 0.00 O ATOM 13254 H1 WAT 894 1.518 11.095 151.193 1.00 0.00 H ATOM 13255 H2 WAT 894 2.340 10.639 152.380 1.00 0.00 H TER 13257 WAT 894 ATOM 13257 O WAT 895 36.966 96.987 103.498 1.00 0.00 O ATOM 13258 H1 WAT 895 37.572 97.473 104.057 1.00 0.00 H ATOM 13259 H2 WAT 895 36.887 97.522 102.708 1.00 0.00 H TER 13261 WAT 895 ATOM 13261 O WAT 896 141.429 101.504 157.762 1.00 0.00 O ATOM 13262 H1 WAT 896 141.059 101.545 156.880 1.00 0.00 H ATOM 13263 H2 WAT 896 141.548 100.568 157.928 1.00 0.00 H TER 13265 WAT 896 ATOM 13265 O WAT 897 143.634 111.550 143.979 1.00 0.00 O ATOM 13266 H1 WAT 897 142.928 110.913 144.091 1.00 0.00 H ATOM 13267 H2 WAT 897 143.186 112.386 143.854 1.00 0.00 H TER 13269 WAT 897 ATOM 13269 O WAT 898 90.789 144.888 99.057 1.00 0.00 O ATOM 13270 H1 WAT 898 91.412 144.679 99.752 1.00 0.00 H ATOM 13271 H2 WAT 898 90.693 144.071 98.568 1.00 0.00 H TER 13273 WAT 898 ATOM 13273 O WAT 899 35.922 18.775 134.598 1.00 0.00 O ATOM 13274 H1 WAT 899 36.512 18.910 133.856 1.00 0.00 H ATOM 13275 H2 WAT 899 35.045 18.792 134.213 1.00 0.00 H TER 13277 WAT 899 ATOM 13277 O WAT 900 63.529 3.953 25.732 1.00 0.00 O ATOM 13278 H1 WAT 900 62.773 3.367 25.762 1.00 0.00 H ATOM 13279 H2 WAT 900 63.390 4.485 24.949 1.00 0.00 H TER 13281 WAT 900 ATOM 13281 O WAT 901 66.555 51.522 152.800 1.00 0.00 O ATOM 13282 H1 WAT 901 66.736 52.461 152.836 1.00 0.00 H ATOM 13283 H2 WAT 901 66.887 51.247 151.945 1.00 0.00 H TER 13285 WAT 901 ATOM 13285 O WAT 902 74.572 120.453 124.769 1.00 0.00 O ATOM 13286 H1 WAT 902 74.476 121.352 124.455 1.00 0.00 H ATOM 13287 H2 WAT 902 74.188 119.915 124.077 1.00 0.00 H TER 13289 WAT 902 ATOM 13289 O WAT 903 77.291 127.684 127.859 1.00 0.00 O ATOM 13290 H1 WAT 903 76.730 127.037 128.286 1.00 0.00 H ATOM 13291 H2 WAT 903 78.046 127.181 127.552 1.00 0.00 H TER 13293 WAT 903 ATOM 13293 O WAT 904 58.787 13.036 111.691 1.00 0.00 O ATOM 13294 H1 WAT 904 58.454 12.643 112.498 1.00 0.00 H ATOM 13295 H2 WAT 904 59.395 13.713 111.988 1.00 0.00 H TER 13297 WAT 904 ATOM 13297 O WAT 905 124.173 94.779 78.894 1.00 0.00 O ATOM 13298 H1 WAT 905 124.597 95.437 78.343 1.00 0.00 H ATOM 13299 H2 WAT 905 123.972 95.241 79.708 1.00 0.00 H TER 13301 WAT 905 ATOM 13301 O WAT 906 113.509 10.791 110.658 1.00 0.00 O ATOM 13302 H1 WAT 906 113.596 11.309 111.459 1.00 0.00 H ATOM 13303 H2 WAT 906 112.618 10.967 110.356 1.00 0.00 H TER 13305 WAT 906 ATOM 13305 O WAT 907 74.359 111.106 123.907 1.00 0.00 O ATOM 13306 H1 WAT 907 74.814 110.800 123.122 1.00 0.00 H ATOM 13307 H2 WAT 907 74.561 110.449 124.572 1.00 0.00 H TER 13309 WAT 907 ATOM 13309 O WAT 908 122.400 63.503 131.735 1.00 0.00 O ATOM 13310 H1 WAT 908 123.170 64.040 131.926 1.00 0.00 H ATOM 13311 H2 WAT 908 122.110 63.799 130.872 1.00 0.00 H TER 13313 WAT 908 ATOM 13313 O WAT 909 29.902 131.505 54.849 1.00 0.00 O ATOM 13314 H1 WAT 909 30.612 131.555 54.208 1.00 0.00 H ATOM 13315 H2 WAT 909 29.638 130.585 54.843 1.00 0.00 H TER 13317 WAT 909 ATOM 13317 O WAT 910 15.782 8.294 9.585 1.00 0.00 O ATOM 13318 H1 WAT 910 16.637 8.146 9.989 1.00 0.00 H ATOM 13319 H2 WAT 910 15.219 8.566 10.309 1.00 0.00 H TER 13321 WAT 910 ATOM 13321 O WAT 911 32.159 127.981 57.298 1.00 0.00 O ATOM 13322 H1 WAT 911 32.721 128.242 56.569 1.00 0.00 H ATOM 13323 H2 WAT 911 31.348 127.689 56.882 1.00 0.00 H TER 13325 WAT 911 ATOM 13325 O WAT 912 108.880 145.714 72.528 1.00 0.00 O ATOM 13326 H1 WAT 912 108.520 144.950 72.079 1.00 0.00 H ATOM 13327 H2 WAT 912 108.496 146.463 72.071 1.00 0.00 H TER 13329 WAT 912 ATOM 13329 O WAT 913 104.019 143.031 4.735 1.00 0.00 O ATOM 13330 H1 WAT 913 104.508 142.439 4.164 1.00 0.00 H ATOM 13331 H2 WAT 913 104.600 143.180 5.481 1.00 0.00 H TER 13333 WAT 913 ATOM 13333 O WAT 914 117.503 85.881 152.258 1.00 0.00 O ATOM 13334 H1 WAT 914 117.347 86.593 151.637 1.00 0.00 H ATOM 13335 H2 WAT 914 118.442 85.710 152.194 1.00 0.00 H TER 13337 WAT 914 ATOM 13337 O WAT 915 14.524 14.926 155.267 1.00 0.00 O ATOM 13338 H1 WAT 915 14.327 15.840 155.061 1.00 0.00 H ATOM 13339 H2 WAT 915 13.738 14.605 155.709 1.00 0.00 H TER 13341 WAT 915 ATOM 13341 O WAT 916 83.792 118.155 13.312 1.00 0.00 O ATOM 13342 H1 WAT 916 83.245 118.226 12.530 1.00 0.00 H ATOM 13343 H2 WAT 916 83.441 118.814 13.910 1.00 0.00 H TER 13345 WAT 916 ATOM 13345 O WAT 917 113.606 60.692 132.705 1.00 0.00 O ATOM 13346 H1 WAT 917 113.034 60.778 131.942 1.00 0.00 H ATOM 13347 H2 WAT 917 113.788 59.754 132.764 1.00 0.00 H TER 13349 WAT 917 ATOM 13349 O WAT 918 74.633 91.788 135.210 1.00 0.00 O ATOM 13350 H1 WAT 918 75.557 91.557 135.115 1.00 0.00 H ATOM 13351 H2 WAT 918 74.442 91.639 136.136 1.00 0.00 H TER 13353 WAT 918 ATOM 13353 O WAT 919 144.816 13.709 137.426 1.00 0.00 O ATOM 13354 H1 WAT 919 144.000 13.286 137.156 1.00 0.00 H ATOM 13355 H2 WAT 919 145.442 13.482 136.739 1.00 0.00 H TER 13357 WAT 919 ATOM 13357 O WAT 920 145.200 75.989 77.464 1.00 0.00 O ATOM 13358 H1 WAT 920 144.563 75.312 77.691 1.00 0.00 H ATOM 13359 H2 WAT 920 145.961 75.794 78.010 1.00 0.00 H TER 13361 WAT 920 ATOM 13361 O WAT 921 2.670 22.952 79.021 1.00 0.00 O ATOM 13362 H1 WAT 921 2.584 23.886 78.832 1.00 0.00 H ATOM 13363 H2 WAT 921 2.410 22.518 78.209 1.00 0.00 H TER 13365 WAT 921 ATOM 13365 O WAT 922 4.633 3.956 63.534 1.00 0.00 O ATOM 13366 H1 WAT 922 5.385 3.375 63.647 1.00 0.00 H ATOM 13367 H2 WAT 922 4.506 4.002 62.587 1.00 0.00 H TER 13369 WAT 922 ATOM 13369 O WAT 923 113.353 11.386 113.624 1.00 0.00 O ATOM 13370 H1 WAT 923 113.623 12.271 113.867 1.00 0.00 H ATOM 13371 H2 WAT 923 113.044 10.997 114.442 1.00 0.00 H TER 13373 WAT 923 ATOM 13373 O WAT 924 134.337 53.911 61.470 1.00 0.00 O ATOM 13374 H1 WAT 924 133.583 53.509 61.900 1.00 0.00 H ATOM 13375 H2 WAT 924 135.029 53.253 61.534 1.00 0.00 H TER 13377 WAT 924 ATOM 13377 O WAT 925 7.993 117.325 132.718 1.00 0.00 O ATOM 13378 H1 WAT 925 7.786 117.698 133.575 1.00 0.00 H ATOM 13379 H2 WAT 925 8.174 116.402 132.896 1.00 0.00 H TER 13381 WAT 925 ATOM 13381 O WAT 926 78.224 96.476 146.352 1.00 0.00 O ATOM 13382 H1 WAT 926 78.662 96.524 145.502 1.00 0.00 H ATOM 13383 H2 WAT 926 77.452 97.033 146.255 1.00 0.00 H TER 13385 WAT 926 ATOM 13385 O WAT 927 56.628 90.602 80.914 1.00 0.00 O ATOM 13386 H1 WAT 927 56.325 91.101 81.672 1.00 0.00 H ATOM 13387 H2 WAT 927 57.564 90.795 80.859 1.00 0.00 H TER 13389 WAT 927 ATOM 13389 O WAT 928 112.224 108.215 145.302 1.00 0.00 O ATOM 13390 H1 WAT 928 111.922 109.068 145.614 1.00 0.00 H ATOM 13391 H2 WAT 928 113.144 108.175 145.564 1.00 0.00 H TER 13393 WAT 928 ATOM 13393 O WAT 929 90.969 22.802 81.283 1.00 0.00 O ATOM 13394 H1 WAT 929 91.165 22.519 80.389 1.00 0.00 H ATOM 13395 H2 WAT 929 90.834 21.988 81.767 1.00 0.00 H TER 13397 WAT 929 ATOM 13397 O WAT 930 42.695 128.783 121.610 1.00 0.00 O ATOM 13398 H1 WAT 930 43.226 129.187 120.924 1.00 0.00 H ATOM 13399 H2 WAT 930 43.140 127.957 121.801 1.00 0.00 H TER 13401 WAT 930 ATOM 13401 O WAT 931 130.068 58.629 124.148 1.00 0.00 O ATOM 13402 H1 WAT 931 129.244 58.228 123.871 1.00 0.00 H ATOM 13403 H2 WAT 931 129.969 59.556 123.930 1.00 0.00 H TER 13405 WAT 931 ATOM 13405 O WAT 932 77.306 16.804 104.285 1.00 0.00 O ATOM 13406 H1 WAT 932 77.985 16.840 104.959 1.00 0.00 H ATOM 13407 H2 WAT 932 77.597 16.112 103.690 1.00 0.00 H TER 13409 WAT 932 ATOM 13409 O WAT 933 53.281 113.429 146.269 1.00 0.00 O ATOM 13410 H1 WAT 933 52.334 113.314 146.347 1.00 0.00 H ATOM 13411 H2 WAT 933 53.587 113.510 147.173 1.00 0.00 H TER 13413 WAT 933 ATOM 13413 O WAT 934 129.343 102.265 78.437 1.00 0.00 O ATOM 13414 H1 WAT 934 130.021 102.884 78.706 1.00 0.00 H ATOM 13415 H2 WAT 934 129.825 101.478 78.181 1.00 0.00 H TER 13417 WAT 934 ATOM 13417 O WAT 935 45.511 0.445 151.823 1.00 0.00 O ATOM 13418 H1 WAT 935 45.654 -0.379 152.289 1.00 0.00 H ATOM 13419 H2 WAT 935 45.915 0.308 150.965 1.00 0.00 H TER 13421 WAT 935 ATOM 13421 O WAT 936 24.106 52.621 108.986 1.00 0.00 O ATOM 13422 H1 WAT 936 23.684 52.639 109.845 1.00 0.00 H ATOM 13423 H2 WAT 936 24.618 51.812 108.988 1.00 0.00 H TER 13425 WAT 936 ATOM 13425 O WAT 937 25.630 122.762 154.887 1.00 0.00 O ATOM 13426 H1 WAT 937 26.564 122.636 154.716 1.00 0.00 H ATOM 13427 H2 WAT 937 25.556 122.739 155.841 1.00 0.00 H TER 13429 WAT 937 ATOM 13429 O WAT 938 2.085 69.064 62.023 1.00 0.00 O ATOM 13430 H1 WAT 938 2.994 68.844 62.228 1.00 0.00 H ATOM 13431 H2 WAT 938 1.686 68.228 61.779 1.00 0.00 H TER 13433 WAT 938 ATOM 13433 O WAT 939 101.553 43.384 66.996 1.00 0.00 O ATOM 13434 H1 WAT 939 102.029 42.639 66.629 1.00 0.00 H ATOM 13435 H2 WAT 939 100.639 43.225 66.759 1.00 0.00 H TER 13437 WAT 939 ATOM 13437 O WAT 940 88.648 72.801 108.757 1.00 0.00 O ATOM 13438 H1 WAT 940 89.104 72.607 109.576 1.00 0.00 H ATOM 13439 H2 WAT 940 87.868 72.246 108.779 1.00 0.00 H TER 13441 WAT 940 ATOM 13441 O WAT 941 91.284 48.407 119.966 1.00 0.00 O ATOM 13442 H1 WAT 941 91.475 48.750 119.093 1.00 0.00 H ATOM 13443 H2 WAT 941 91.369 47.458 119.875 1.00 0.00 H TER 13445 WAT 941 ATOM 13445 O WAT 942 7.595 89.402 24.340 1.00 0.00 O ATOM 13446 H1 WAT 942 7.935 88.562 24.651 1.00 0.00 H ATOM 13447 H2 WAT 942 8.376 89.909 24.118 1.00 0.00 H TER 13449 WAT 942 ATOM 13449 O WAT 943 14.810 114.984 90.035 1.00 0.00 O ATOM 13450 H1 WAT 943 15.526 115.447 90.470 1.00 0.00 H ATOM 13451 H2 WAT 943 14.823 115.313 89.136 1.00 0.00 H TER 13453 WAT 943 ATOM 13453 O WAT 944 32.801 73.657 126.577 1.00 0.00 O ATOM 13454 H1 WAT 944 33.632 73.677 127.052 1.00 0.00 H ATOM 13455 H2 WAT 944 32.133 73.652 127.262 1.00 0.00 H TER 13457 WAT 944 ATOM 13457 O WAT 945 100.716 108.701 88.227 1.00 0.00 O ATOM 13458 H1 WAT 945 99.863 109.046 87.961 1.00 0.00 H ATOM 13459 H2 WAT 945 100.539 108.224 89.038 1.00 0.00 H TER 13461 WAT 945 ATOM 13461 O WAT 946 144.484 64.251 147.983 1.00 0.00 O ATOM 13462 H1 WAT 946 145.364 64.099 147.638 1.00 0.00 H ATOM 13463 H2 WAT 946 144.211 65.079 147.587 1.00 0.00 H TER 13465 WAT 946 ATOM 13465 O WAT 947 96.058 97.779 135.469 1.00 0.00 O ATOM 13466 H1 WAT 947 96.856 98.027 135.002 1.00 0.00 H ATOM 13467 H2 WAT 947 96.279 97.883 136.394 1.00 0.00 H TER 13469 WAT 947 ATOM 13469 O WAT 948 57.990 32.469 62.018 1.00 0.00 O ATOM 13470 H1 WAT 948 57.595 32.072 62.794 1.00 0.00 H ATOM 13471 H2 WAT 948 57.464 33.252 61.856 1.00 0.00 H TER 13473 WAT 948 ATOM 13473 O WAT 949 36.602 57.883 21.742 1.00 0.00 O ATOM 13474 H1 WAT 949 35.656 57.899 21.601 1.00 0.00 H ATOM 13475 H2 WAT 949 36.974 57.809 20.863 1.00 0.00 H TER 13477 WAT 949 ATOM 13477 O WAT 950 56.564 44.904 92.379 1.00 0.00 O ATOM 13478 H1 WAT 950 55.952 45.330 91.779 1.00 0.00 H ATOM 13479 H2 WAT 950 56.081 44.832 93.202 1.00 0.00 H TER 13481 WAT 950 ATOM 13481 O WAT 951 16.700 27.627 149.699 1.00 0.00 O ATOM 13482 H1 WAT 951 16.869 27.008 148.989 1.00 0.00 H ATOM 13483 H2 WAT 951 15.921 27.283 150.136 1.00 0.00 H TER 13485 WAT 951 ATOM 13485 O WAT 952 21.602 8.941 95.236 1.00 0.00 O ATOM 13486 H1 WAT 952 21.642 9.897 95.246 1.00 0.00 H ATOM 13487 H2 WAT 952 22.425 8.662 95.637 1.00 0.00 H TER 13489 WAT 952 ATOM 13489 O WAT 953 57.814 24.717 133.599 1.00 0.00 O ATOM 13490 H1 WAT 953 57.362 25.560 133.573 1.00 0.00 H ATOM 13491 H2 WAT 953 58.551 24.859 134.194 1.00 0.00 H TER 13493 WAT 953 ATOM 13493 O WAT 954 31.969 50.942 100.296 1.00 0.00 O ATOM 13494 H1 WAT 954 32.129 50.264 99.639 1.00 0.00 H ATOM 13495 H2 WAT 954 31.296 50.569 100.866 1.00 0.00 H TER 13497 WAT 954 ATOM 13497 O WAT 955 95.865 4.832 142.070 1.00 0.00 O ATOM 13498 H1 WAT 955 96.671 4.903 141.560 1.00 0.00 H ATOM 13499 H2 WAT 955 95.273 4.325 141.514 1.00 0.00 H TER 13501 WAT 955 ATOM 13501 O WAT 956 138.813 101.464 76.102 1.00 0.00 O ATOM 13502 H1 WAT 956 139.613 101.148 75.682 1.00 0.00 H ATOM 13503 H2 WAT 956 138.184 101.551 75.385 1.00 0.00 H TER 13505 WAT 956 ATOM 13505 O WAT 957 59.381 142.572 10.551 1.00 0.00 O ATOM 13506 H1 WAT 957 58.768 142.424 11.272 1.00 0.00 H ATOM 13507 H2 WAT 957 60.173 142.101 10.809 1.00 0.00 H TER 13509 WAT 957 ATOM 13509 O WAT 958 141.268 19.438 68.708 1.00 0.00 O ATOM 13510 H1 WAT 958 141.380 20.258 68.227 1.00 0.00 H ATOM 13511 H2 WAT 958 140.357 19.190 68.549 1.00 0.00 H TER 13513 WAT 958 ATOM 13513 O WAT 959 50.853 51.162 23.525 1.00 0.00 O ATOM 13514 H1 WAT 959 50.252 51.841 23.219 1.00 0.00 H ATOM 13515 H2 WAT 959 51.126 51.457 24.393 1.00 0.00 H TER 13517 WAT 959 ATOM 13517 O WAT 960 26.799 121.943 119.023 1.00 0.00 O ATOM 13518 H1 WAT 960 26.891 121.056 119.372 1.00 0.00 H ATOM 13519 H2 WAT 960 26.313 122.417 119.698 1.00 0.00 H TER 13521 WAT 960 ATOM 13521 O WAT 961 59.136 20.229 158.466 1.00 0.00 O ATOM 13522 H1 WAT 961 58.292 20.045 158.879 1.00 0.00 H ATOM 13523 H2 WAT 961 59.460 21.007 158.920 1.00 0.00 H TER 13525 WAT 961 ATOM 13525 O WAT 962 137.393 94.203 118.296 1.00 0.00 O ATOM 13526 H1 WAT 962 137.627 93.426 118.803 1.00 0.00 H ATOM 13527 H2 WAT 962 137.470 93.926 117.383 1.00 0.00 H TER 13529 WAT 962 ATOM 13529 O WAT 963 139.279 74.800 8.470 1.00 0.00 O ATOM 13530 H1 WAT 963 138.479 75.257 8.728 1.00 0.00 H ATOM 13531 H2 WAT 963 139.987 75.340 8.822 1.00 0.00 H TER 13533 WAT 963 ATOM 13533 O WAT 964 119.982 3.683 69.134 1.00 0.00 O ATOM 13534 H1 WAT 964 119.535 3.363 68.350 1.00 0.00 H ATOM 13535 H2 WAT 964 119.543 4.509 69.339 1.00 0.00 H TER 13537 WAT 964 ATOM 13537 O WAT 965 88.775 101.459 91.956 1.00 0.00 O ATOM 13538 H1 WAT 965 88.827 102.180 91.328 1.00 0.00 H ATOM 13539 H2 WAT 965 89.656 101.085 91.963 1.00 0.00 H TER 13541 WAT 965 ATOM 13541 O WAT 966 134.224 118.813 9.937 1.00 0.00 O ATOM 13542 H1 WAT 966 133.814 119.671 9.828 1.00 0.00 H ATOM 13543 H2 WAT 966 135.145 118.959 9.721 1.00 0.00 H TER 13545 WAT 966 ATOM 13545 O WAT 967 26.411 61.573 132.599 1.00 0.00 O ATOM 13546 H1 WAT 967 27.256 61.892 132.918 1.00 0.00 H ATOM 13547 H2 WAT 967 26.044 62.313 132.114 1.00 0.00 H TER 13549 WAT 967 ATOM 13549 O WAT 968 90.472 94.236 139.129 1.00 0.00 O ATOM 13550 H1 WAT 968 89.730 93.631 139.137 1.00 0.00 H ATOM 13551 H2 WAT 968 90.246 94.902 139.777 1.00 0.00 H TER 13553 WAT 968 ATOM 13553 O WAT 969 132.432 136.806 69.581 1.00 0.00 O ATOM 13554 H1 WAT 969 132.837 136.438 70.366 1.00 0.00 H ATOM 13555 H2 WAT 969 131.541 136.457 69.584 1.00 0.00 H TER 13557 WAT 969 ATOM 13557 O WAT 970 95.429 91.330 65.662 1.00 0.00 O ATOM 13558 H1 WAT 970 95.929 90.653 65.206 1.00 0.00 H ATOM 13559 H2 WAT 970 96.094 91.910 66.033 1.00 0.00 H TER 13561 WAT 970 ATOM 13561 O WAT 971 68.282 98.440 67.718 1.00 0.00 O ATOM 13562 H1 WAT 971 68.218 98.944 66.907 1.00 0.00 H ATOM 13563 H2 WAT 971 68.664 99.050 68.349 1.00 0.00 H TER 13565 WAT 971 ATOM 13565 O WAT 972 63.004 38.769 116.423 1.00 0.00 O ATOM 13566 H1 WAT 972 63.738 39.230 116.016 1.00 0.00 H ATOM 13567 H2 WAT 972 62.321 38.768 115.753 1.00 0.00 H TER 13569 WAT 972 ATOM 13569 O WAT 973 78.211 127.241 142.592 1.00 0.00 O ATOM 13570 H1 WAT 973 79.110 127.060 142.319 1.00 0.00 H ATOM 13571 H2 WAT 973 77.885 126.402 142.917 1.00 0.00 H TER 13573 WAT 973 ATOM 13573 O WAT 974 94.443 111.570 87.043 1.00 0.00 O ATOM 13574 H1 WAT 974 94.146 111.807 87.921 1.00 0.00 H ATOM 13575 H2 WAT 974 95.079 112.248 86.814 1.00 0.00 H TER 13577 WAT 974 ATOM 13577 O WAT 975 62.138 4.979 58.101 1.00 0.00 O ATOM 13578 H1 WAT 975 61.212 5.079 58.325 1.00 0.00 H ATOM 13579 H2 WAT 975 62.338 4.067 58.314 1.00 0.00 H TER 13581 WAT 975 ATOM 13581 O WAT 976 52.575 115.388 121.846 1.00 0.00 O ATOM 13582 H1 WAT 976 53.018 114.672 121.392 1.00 0.00 H ATOM 13583 H2 WAT 976 52.437 116.052 121.171 1.00 0.00 H TER 13585 WAT 976 ATOM 13585 O WAT 977 74.345 81.305 134.261 1.00 0.00 O ATOM 13586 H1 WAT 977 74.638 81.248 133.351 1.00 0.00 H ATOM 13587 H2 WAT 977 73.525 80.812 134.279 1.00 0.00 H TER 13589 WAT 977 ATOM 13589 O WAT 978 27.821 16.121 1.711 1.00 0.00 O ATOM 13590 H1 WAT 978 27.852 15.761 2.598 1.00 0.00 H ATOM 13591 H2 WAT 978 27.282 16.907 1.790 1.00 0.00 H TER 13593 WAT 978 ATOM 13593 O WAT 979 52.743 81.652 107.185 1.00 0.00 O ATOM 13594 H1 WAT 979 52.340 82.470 107.475 1.00 0.00 H ATOM 13595 H2 WAT 979 53.313 81.395 107.910 1.00 0.00 H TER 13597 WAT 979 ATOM 13597 O WAT 980 59.632 128.767 115.586 1.00 0.00 O ATOM 13598 H1 WAT 980 59.322 128.094 116.192 1.00 0.00 H ATOM 13599 H2 WAT 980 60.284 129.258 116.086 1.00 0.00 H TER 13601 WAT 980 ATOM 13601 O WAT 981 20.305 10.114 140.649 1.00 0.00 O ATOM 13602 H1 WAT 981 19.827 10.662 141.271 1.00 0.00 H ATOM 13603 H2 WAT 981 20.447 10.680 139.891 1.00 0.00 H TER 13605 WAT 981 ATOM 13605 O WAT 982 8.270 73.345 58.562 1.00 0.00 O ATOM 13606 H1 WAT 982 7.822 72.913 59.289 1.00 0.00 H ATOM 13607 H2 WAT 982 7.736 74.117 58.376 1.00 0.00 H TER 13609 WAT 982 ATOM 13609 O WAT 983 7.068 75.086 18.821 1.00 0.00 O ATOM 13610 H1 WAT 983 6.869 76.000 19.024 1.00 0.00 H ATOM 13611 H2 WAT 983 6.868 74.999 17.889 1.00 0.00 H TER 13613 WAT 983 ATOM 13613 O WAT 984 10.645 38.482 154.552 1.00 0.00 O ATOM 13614 H1 WAT 984 10.980 38.555 155.445 1.00 0.00 H ATOM 13615 H2 WAT 984 9.875 37.919 154.630 1.00 0.00 H TER 13617 WAT 984 ATOM 13617 O WAT 985 38.851 47.168 138.106 1.00 0.00 O ATOM 13618 H1 WAT 985 38.184 46.988 138.768 1.00 0.00 H ATOM 13619 H2 WAT 985 39.163 46.303 137.840 1.00 0.00 H TER 13621 WAT 985 ATOM 13621 O WAT 986 69.880 42.759 23.941 1.00 0.00 O ATOM 13622 H1 WAT 986 68.936 42.904 23.996 1.00 0.00 H ATOM 13623 H2 WAT 986 70.044 42.023 24.531 1.00 0.00 H TER 13625 WAT 986 ATOM 13625 O WAT 987 4.976 92.255 133.917 1.00 0.00 O ATOM 13626 H1 WAT 987 4.415 92.222 134.692 1.00 0.00 H ATOM 13627 H2 WAT 987 5.357 91.378 133.859 1.00 0.00 H TER 13629 WAT 987 ATOM 13629 O WAT 988 18.934 116.418 4.047 1.00 0.00 O ATOM 13630 H1 WAT 988 19.609 116.161 4.675 1.00 0.00 H ATOM 13631 H2 WAT 988 19.396 116.959 3.407 1.00 0.00 H TER 13633 WAT 988 ATOM 13633 O WAT 989 31.533 131.464 52.710 1.00 0.00 O ATOM 13634 H1 WAT 989 31.727 130.559 52.952 1.00 0.00 H ATOM 13635 H2 WAT 989 32.291 131.962 53.016 1.00 0.00 H TER 13637 WAT 989 ATOM 13637 O WAT 990 54.619 141.794 4.943 1.00 0.00 O ATOM 13638 H1 WAT 990 54.452 141.773 4.001 1.00 0.00 H ATOM 13639 H2 WAT 990 55.397 142.344 5.036 1.00 0.00 H TER 13641 WAT 990 ATOM 13641 O WAT 991 123.378 136.788 67.960 1.00 0.00 O ATOM 13642 H1 WAT 991 122.470 136.747 68.260 1.00 0.00 H ATOM 13643 H2 WAT 991 123.536 135.933 67.559 1.00 0.00 H TER 13645 WAT 991 ATOM 13645 O WAT 992 16.029 134.963 57.566 1.00 0.00 O ATOM 13646 H1 WAT 992 16.936 134.672 57.663 1.00 0.00 H ATOM 13647 H2 WAT 992 15.552 134.176 57.301 1.00 0.00 H TER 13649 WAT 992 ATOM 13649 O WAT 993 89.140 109.995 153.751 1.00 0.00 O ATOM 13650 H1 WAT 993 89.094 109.422 154.517 1.00 0.00 H ATOM 13651 H2 WAT 993 88.572 109.576 153.104 1.00 0.00 H TER 13653 WAT 993 ATOM 13653 O WAT 994 84.844 106.645 90.195 1.00 0.00 O ATOM 13654 H1 WAT 994 85.779 106.468 90.088 1.00 0.00 H ATOM 13655 H2 WAT 994 84.461 105.793 90.401 1.00 0.00 H TER 13657 WAT 994 ATOM 13657 O WAT 995 93.175 101.455 97.011 1.00 0.00 O ATOM 13658 H1 WAT 995 93.500 100.733 96.473 1.00 0.00 H ATOM 13659 H2 WAT 995 93.077 101.076 97.885 1.00 0.00 H TER 13661 WAT 995 ATOM 13661 O WAT 996 33.420 51.442 155.395 1.00 0.00 O ATOM 13662 H1 WAT 996 32.824 51.698 156.099 1.00 0.00 H ATOM 13663 H2 WAT 996 33.332 52.136 154.742 1.00 0.00 H TER 13665 WAT 996 ATOM 13665 O WAT 997 77.832 116.281 62.275 1.00 0.00 O ATOM 13666 H1 WAT 997 78.358 116.137 61.489 1.00 0.00 H ATOM 13667 H2 WAT 997 78.474 116.411 62.973 1.00 0.00 H TER 13669 WAT 997 ATOM 13669 O WAT 998 119.116 55.408 118.189 1.00 0.00 O ATOM 13670 H1 WAT 998 119.478 55.852 117.422 1.00 0.00 H ATOM 13671 H2 WAT 998 118.360 55.939 118.439 1.00 0.00 H TER 13673 WAT 998 ATOM 13673 O WAT 999 78.147 49.473 139.698 1.00 0.00 O ATOM 13674 H1 WAT 999 78.581 50.302 139.897 1.00 0.00 H ATOM 13675 H2 WAT 999 77.503 49.696 139.025 1.00 0.00 H TER 13677 WAT 999 ATOM 13677 O WAT 1000 64.743 92.942 64.682 1.00 0.00 O ATOM 13678 H1 WAT 1000 64.554 92.466 65.490 1.00 0.00 H ATOM 13679 H2 WAT 1000 64.006 92.739 64.106 1.00 0.00 H TER 13681 WAT 1000 ATOM 13681 O WAT 1001 131.488 122.799 2.057 1.00 0.00 O ATOM 13682 H1 WAT 1001 132.068 122.498 1.357 1.00 0.00 H ATOM 13683 H2 WAT 1001 131.189 123.661 1.767 1.00 0.00 H TER 13685 WAT 1001 ATOM 13685 O WAT 1002 134.444 121.116 134.971 1.00 0.00 O ATOM 13686 H1 WAT 1002 133.960 121.075 135.795 1.00 0.00 H ATOM 13687 H2 WAT 1002 135.364 121.119 135.233 1.00 0.00 H TER 13689 WAT 1002 ATOM 13689 O WAT 1003 86.597 52.402 92.419 1.00 0.00 O ATOM 13690 H1 WAT 1003 85.674 52.628 92.306 1.00 0.00 H ATOM 13691 H2 WAT 1003 86.942 53.086 92.992 1.00 0.00 H TER 13693 WAT 1003 ATOM 13693 O WAT 1004 106.613 0.997 150.925 1.00 0.00 O ATOM 13694 H1 WAT 1004 106.808 1.902 150.680 1.00 0.00 H ATOM 13695 H2 WAT 1004 106.321 1.053 151.834 1.00 0.00 H TER 13697 WAT 1004 ATOM 13697 O WAT 1005 54.080 65.291 72.637 1.00 0.00 O ATOM 13698 H1 WAT 1005 54.594 65.010 73.394 1.00 0.00 H ATOM 13699 H2 WAT 1005 54.721 65.385 71.933 1.00 0.00 H TER 13701 WAT 1005 ATOM 13701 O WAT 1006 19.960 140.356 5.193 1.00 0.00 O ATOM 13702 H1 WAT 1006 19.099 140.471 5.594 1.00 0.00 H ATOM 13703 H2 WAT 1006 20.550 140.201 5.931 1.00 0.00 H TER 13705 WAT 1006 ATOM 13705 O WAT 1007 65.509 45.164 138.405 1.00 0.00 O ATOM 13706 H1 WAT 1007 64.740 44.856 137.926 1.00 0.00 H ATOM 13707 H2 WAT 1007 65.236 46.000 138.784 1.00 0.00 H TER 13709 WAT 1007 ATOM 13709 O WAT 1008 117.379 63.804 71.399 1.00 0.00 O ATOM 13710 H1 WAT 1008 116.564 63.834 71.900 1.00 0.00 H ATOM 13711 H2 WAT 1008 117.941 63.205 71.891 1.00 0.00 H TER 13713 WAT 1008 ATOM 13713 O WAT 1009 8.603 84.636 90.354 1.00 0.00 O ATOM 13714 H1 WAT 1009 8.118 85.272 90.881 1.00 0.00 H ATOM 13715 H2 WAT 1009 8.700 85.058 89.500 1.00 0.00 H TER 13717 WAT 1009 ATOM 13717 O WAT 1010 101.434 25.551 71.140 1.00 0.00 O ATOM 13718 H1 WAT 1010 101.739 25.303 72.013 1.00 0.00 H ATOM 13719 H2 WAT 1010 102.151 25.302 70.556 1.00 0.00 H TER 13721 WAT 1010 ATOM 13721 O WAT 1011 85.379 70.093 156.357 1.00 0.00 O ATOM 13722 H1 WAT 1011 85.302 70.670 155.597 1.00 0.00 H ATOM 13723 H2 WAT 1011 85.946 69.381 156.061 1.00 0.00 H TER 13725 WAT 1011 ATOM 13725 O WAT 1012 11.616 45.547 91.414 1.00 0.00 O ATOM 13726 H1 WAT 1012 12.126 45.474 92.220 1.00 0.00 H ATOM 13727 H2 WAT 1012 10.873 46.102 91.651 1.00 0.00 H TER 13729 WAT 1012 ATOM 13729 O WAT 1013 59.381 78.741 68.328 1.00 0.00 O ATOM 13730 H1 WAT 1013 59.243 78.118 69.041 1.00 0.00 H ATOM 13731 H2 WAT 1013 60.201 78.460 67.921 1.00 0.00 H TER 13733 WAT 1013 ATOM 13733 O WAT 1014 100.422 116.112 2.270 1.00 0.00 O ATOM 13734 H1 WAT 1014 99.806 115.737 1.641 1.00 0.00 H ATOM 13735 H2 WAT 1014 101.284 115.956 1.884 1.00 0.00 H TER 13737 WAT 1014 ATOM 13737 O WAT 1015 133.392 99.191 2.268 1.00 0.00 O ATOM 13738 H1 WAT 1015 132.674 99.293 1.643 1.00 0.00 H ATOM 13739 H2 WAT 1015 134.151 99.571 1.826 1.00 0.00 H TER 13741 WAT 1015 ATOM 13741 O WAT 1016 114.119 101.084 13.388 1.00 0.00 O ATOM 13742 H1 WAT 1016 114.990 100.710 13.520 1.00 0.00 H ATOM 13743 H2 WAT 1016 113.536 100.325 13.344 1.00 0.00 H TER 13745 WAT 1016 ATOM 13745 O WAT 1017 83.421 59.635 66.872 1.00 0.00 O ATOM 13746 H1 WAT 1017 83.957 60.237 67.389 1.00 0.00 H ATOM 13747 H2 WAT 1017 83.030 60.185 66.193 1.00 0.00 H TER 13749 WAT 1017 ATOM 13749 O WAT 1018 18.348 43.355 121.459 1.00 0.00 O ATOM 13750 H1 WAT 1018 18.809 42.906 120.750 1.00 0.00 H ATOM 13751 H2 WAT 1018 19.043 43.751 121.985 1.00 0.00 H TER 13753 WAT 1018 ATOM 13753 O WAT 1019 126.121 42.051 71.847 1.00 0.00 O ATOM 13754 H1 WAT 1019 125.168 42.139 71.857 1.00 0.00 H ATOM 13755 H2 WAT 1019 126.281 41.148 72.120 1.00 0.00 H TER 13757 WAT 1019 ATOM 13757 O WAT 1020 113.684 33.104 65.512 1.00 0.00 O ATOM 13758 H1 WAT 1020 114.247 33.866 65.374 1.00 0.00 H ATOM 13759 H2 WAT 1020 114.101 32.404 65.009 1.00 0.00 H TER 13761 WAT 1020 ATOM 13761 O WAT 1021 15.775 46.178 157.478 1.00 0.00 O ATOM 13762 H1 WAT 1021 16.475 46.499 156.910 1.00 0.00 H ATOM 13763 H2 WAT 1021 16.047 45.292 157.717 1.00 0.00 H TER 13765 WAT 1021 ATOM 13765 O WAT 1022 96.419 74.405 70.549 1.00 0.00 O ATOM 13766 H1 WAT 1022 96.448 73.639 71.122 1.00 0.00 H ATOM 13767 H2 WAT 1022 97.221 74.346 70.030 1.00 0.00 H TER 13769 WAT 1022 ATOM 13769 O WAT 1023 120.952 67.678 81.606 1.00 0.00 O ATOM 13770 H1 WAT 1023 121.683 67.573 80.997 1.00 0.00 H ATOM 13771 H2 WAT 1023 121.311 68.200 82.323 1.00 0.00 H TER 13773 WAT 1023 ATOM 13773 O WAT 1024 43.716 120.075 71.049 1.00 0.00 O ATOM 13774 H1 WAT 1024 43.050 120.693 70.745 1.00 0.00 H ATOM 13775 H2 WAT 1024 43.644 119.332 70.449 1.00 0.00 H TER 13777 WAT 1024 ATOM 13777 O WAT 1025 4.634 12.333 16.093 1.00 0.00 O ATOM 13778 H1 WAT 1025 4.869 11.433 16.320 1.00 0.00 H ATOM 13779 H2 WAT 1025 4.328 12.716 16.915 1.00 0.00 H TER 13781 WAT 1025 ATOM 13781 O WAT 1026 32.564 87.164 19.625 1.00 0.00 O ATOM 13782 H1 WAT 1026 33.466 87.195 19.308 1.00 0.00 H ATOM 13783 H2 WAT 1026 32.249 88.064 19.541 1.00 0.00 H TER 13785 WAT 1026 ATOM 13785 O WAT 1027 60.146 121.155 113.202 1.00 0.00 O ATOM 13786 H1 WAT 1027 60.845 121.756 112.945 1.00 0.00 H ATOM 13787 H2 WAT 1027 59.441 121.326 112.577 1.00 0.00 H TER 13789 WAT 1027 ATOM 13789 O WAT 1028 87.347 59.088 142.948 1.00 0.00 O ATOM 13790 H1 WAT 1028 86.716 58.872 142.262 1.00 0.00 H ATOM 13791 H2 WAT 1028 87.272 60.037 143.053 1.00 0.00 H TER 13793 WAT 1028 ATOM 13793 O WAT 1029 102.512 127.635 7.733 1.00 0.00 O ATOM 13794 H1 WAT 1029 102.033 127.197 7.030 1.00 0.00 H ATOM 13795 H2 WAT 1029 103.196 128.132 7.284 1.00 0.00 H TER 13797 WAT 1029 ATOM 13797 O WAT 1030 131.192 20.110 132.125 1.00 0.00 O ATOM 13798 H1 WAT 1030 130.761 20.648 132.789 1.00 0.00 H ATOM 13799 H2 WAT 1030 130.913 19.216 132.323 1.00 0.00 H TER 13801 WAT 1030 ATOM 13801 O WAT 1031 10.262 77.475 110.032 1.00 0.00 O ATOM 13802 H1 WAT 1031 10.757 77.727 110.811 1.00 0.00 H ATOM 13803 H2 WAT 1031 9.497 77.012 110.373 1.00 0.00 H TER 13805 WAT 1031 ATOM 13805 O WAT 1032 121.166 77.969 118.733 1.00 0.00 O ATOM 13806 H1 WAT 1032 120.569 77.993 119.481 1.00 0.00 H ATOM 13807 H2 WAT 1032 122.001 77.681 119.101 1.00 0.00 H TER 13809 WAT 1032 ATOM 13809 O WAT 1033 100.146 37.198 73.297 1.00 0.00 O ATOM 13810 H1 WAT 1033 99.379 36.946 72.783 1.00 0.00 H ATOM 13811 H2 WAT 1033 100.868 36.703 72.909 1.00 0.00 H TER 13813 WAT 1033 ATOM 13813 O WAT 1034 34.953 78.004 76.871 1.00 0.00 O ATOM 13814 H1 WAT 1034 35.325 78.854 76.635 1.00 0.00 H ATOM 13815 H2 WAT 1034 35.232 77.417 76.168 1.00 0.00 H TER 13817 WAT 1034 ATOM 13817 O WAT 1035 54.305 55.824 158.131 1.00 0.00 O ATOM 13818 H1 WAT 1035 53.768 55.040 158.015 1.00 0.00 H ATOM 13819 H2 WAT 1035 53.968 56.442 157.482 1.00 0.00 H TER 13821 WAT 1035 ATOM 13821 O WAT 1036 76.465 64.910 123.262 1.00 0.00 O ATOM 13822 H1 WAT 1036 76.054 65.769 123.364 1.00 0.00 H ATOM 13823 H2 WAT 1036 77.013 64.813 124.041 1.00 0.00 H TER 13825 WAT 1036 ATOM 13825 O WAT 1037 86.096 110.027 106.046 1.00 0.00 O ATOM 13826 H1 WAT 1037 86.158 109.460 106.815 1.00 0.00 H ATOM 13827 H2 WAT 1037 85.750 109.459 105.357 1.00 0.00 H TER 13829 WAT 1037 ATOM 13829 O WAT 1038 15.737 18.682 146.171 1.00 0.00 O ATOM 13830 H1 WAT 1038 15.274 18.107 146.780 1.00 0.00 H ATOM 13831 H2 WAT 1038 15.463 18.384 145.304 1.00 0.00 H TER 13833 WAT 1038 ATOM 13833 O WAT 1039 34.060 30.643 73.549 1.00 0.00 O ATOM 13834 H1 WAT 1039 34.396 30.761 74.437 1.00 0.00 H ATOM 13835 H2 WAT 1039 34.278 29.737 73.329 1.00 0.00 H TER 13837 WAT 1039 ATOM 13837 O WAT 1040 25.094 36.630 16.395 1.00 0.00 O ATOM 13838 H1 WAT 1040 25.736 36.312 17.030 1.00 0.00 H ATOM 13839 H2 WAT 1040 25.536 37.354 15.950 1.00 0.00 H TER 13841 WAT 1040 ATOM 13841 O WAT 1041 126.565 49.175 131.598 1.00 0.00 O ATOM 13842 H1 WAT 1041 127.412 48.730 131.583 1.00 0.00 H ATOM 13843 H2 WAT 1041 126.700 49.964 131.072 1.00 0.00 H TER 13845 WAT 1041 ATOM 13845 O WAT 1042 2.757 74.639 18.396 1.00 0.00 O ATOM 13846 H1 WAT 1042 2.906 75.572 18.547 1.00 0.00 H ATOM 13847 H2 WAT 1042 3.508 74.207 18.804 1.00 0.00 H TER 13849 WAT 1042 ATOM 13849 O WAT 1043 130.672 24.466 77.857 1.00 0.00 O ATOM 13850 H1 WAT 1043 130.993 24.968 78.606 1.00 0.00 H ATOM 13851 H2 WAT 1043 131.435 24.370 77.288 1.00 0.00 H TER 13853 WAT 1043 ATOM 13853 O WAT 1044 130.231 90.580 63.774 1.00 0.00 O ATOM 13854 H1 WAT 1044 130.137 90.593 64.726 1.00 0.00 H ATOM 13855 H2 WAT 1044 129.349 90.400 63.448 1.00 0.00 H TER 13857 WAT 1044 ATOM 13857 O WAT 1045 41.574 83.568 107.103 1.00 0.00 O ATOM 13858 H1 WAT 1045 42.231 83.253 106.482 1.00 0.00 H ATOM 13859 H2 WAT 1045 41.520 82.879 107.765 1.00 0.00 H TER 13861 WAT 1045 ATOM 13861 O WAT 1046 116.258 23.692 4.753 1.00 0.00 O ATOM 13862 H1 WAT 1046 116.186 22.738 4.777 1.00 0.00 H ATOM 13863 H2 WAT 1046 115.697 23.957 4.024 1.00 0.00 H TER 13865 WAT 1046 ATOM 13865 O WAT 1047 23.154 4.968 71.411 1.00 0.00 O ATOM 13866 H1 WAT 1047 23.364 5.580 70.706 1.00 0.00 H ATOM 13867 H2 WAT 1047 22.552 5.451 71.977 1.00 0.00 H TER 13869 WAT 1047 ATOM 13869 O WAT 1048 15.063 55.300 55.634 1.00 0.00 O ATOM 13870 H1 WAT 1048 15.265 56.113 55.170 1.00 0.00 H ATOM 13871 H2 WAT 1048 15.917 54.903 55.804 1.00 0.00 H TER 13873 WAT 1048 ATOM 13873 O WAT 1049 46.018 100.312 7.680 1.00 0.00 O ATOM 13874 H1 WAT 1049 46.758 100.395 7.079 1.00 0.00 H ATOM 13875 H2 WAT 1049 45.256 100.209 7.110 1.00 0.00 H TER 13877 WAT 1049 ATOM 13877 O WAT 1050 24.932 75.021 77.074 1.00 0.00 O ATOM 13878 H1 WAT 1050 24.606 74.725 76.224 1.00 0.00 H ATOM 13879 H2 WAT 1050 24.726 75.956 77.097 1.00 0.00 H TER 13881 WAT 1050 ATOM 13881 O WAT 1051 82.126 78.224 154.520 1.00 0.00 O ATOM 13882 H1 WAT 1051 82.539 79.076 154.380 1.00 0.00 H ATOM 13883 H2 WAT 1051 81.186 78.409 154.506 1.00 0.00 H TER 13885 WAT 1051 ATOM 13885 O WAT 1052 143.643 80.708 109.822 1.00 0.00 O ATOM 13886 H1 WAT 1052 144.200 80.682 110.600 1.00 0.00 H ATOM 13887 H2 WAT 1052 142.777 80.452 110.139 1.00 0.00 H TER 13889 WAT 1052 ATOM 13889 O WAT 1053 17.756 15.093 8.458 1.00 0.00 O ATOM 13890 H1 WAT 1053 17.928 14.912 7.534 1.00 0.00 H ATOM 13891 H2 WAT 1053 16.801 15.092 8.529 1.00 0.00 H TER 13893 WAT 1053 ATOM 13893 O WAT 1054 52.246 33.041 138.329 1.00 0.00 O ATOM 13894 H1 WAT 1054 51.660 33.230 137.596 1.00 0.00 H ATOM 13895 H2 WAT 1054 52.109 32.111 138.511 1.00 0.00 H TER 13897 WAT 1054 ATOM 13897 O WAT 1055 8.366 117.009 128.839 1.00 0.00 O ATOM 13898 H1 WAT 1055 7.728 117.455 129.396 1.00 0.00 H ATOM 13899 H2 WAT 1055 9.120 117.597 128.821 1.00 0.00 H TER 13901 WAT 1055 ATOM 13901 O WAT 1056 38.583 142.094 14.749 1.00 0.00 O ATOM 13902 H1 WAT 1056 38.448 142.213 13.809 1.00 0.00 H ATOM 13903 H2 WAT 1056 37.765 142.391 15.148 1.00 0.00 H TER 13905 WAT 1056 ATOM 13905 O WAT 1057 136.929 99.370 139.499 1.00 0.00 O ATOM 13906 H1 WAT 1057 136.689 98.452 139.378 1.00 0.00 H ATOM 13907 H2 WAT 1057 136.093 99.836 139.517 1.00 0.00 H TER 13909 WAT 1057 ATOM 13909 O WAT 1058 83.869 117.924 4.346 1.00 0.00 O ATOM 13910 H1 WAT 1058 84.652 118.375 4.660 1.00 0.00 H ATOM 13911 H2 WAT 1058 83.653 118.362 3.523 1.00 0.00 H TER 13913 WAT 1058 ATOM 13913 O WAT 1059 44.948 142.569 82.211 1.00 0.00 O ATOM 13914 H1 WAT 1059 44.906 142.022 81.427 1.00 0.00 H ATOM 13915 H2 WAT 1059 44.775 143.456 81.894 1.00 0.00 H TER 13917 WAT 1059 ATOM 13917 O WAT 1060 139.879 82.102 19.693 1.00 0.00 O ATOM 13918 H1 WAT 1060 139.923 82.113 18.737 1.00 0.00 H ATOM 13919 H2 WAT 1060 139.226 81.430 19.895 1.00 0.00 H TER 13921 WAT 1060 ATOM 13921 O WAT 1061 116.487 130.639 64.422 1.00 0.00 O ATOM 13922 H1 WAT 1061 116.288 130.650 63.486 1.00 0.00 H ATOM 13923 H2 WAT 1061 115.796 131.168 64.820 1.00 0.00 H TER 13925 WAT 1061 ATOM 13925 O WAT 1062 132.414 30.336 111.751 1.00 0.00 O ATOM 13926 H1 WAT 1062 131.800 30.452 112.476 1.00 0.00 H ATOM 13927 H2 WAT 1062 133.261 30.193 112.175 1.00 0.00 H TER 13929 WAT 1062 ATOM 13929 O WAT 1063 123.327 94.634 122.087 1.00 0.00 O ATOM 13930 H1 WAT 1063 123.391 95.107 121.257 1.00 0.00 H ATOM 13931 H2 WAT 1063 124.157 94.812 122.528 1.00 0.00 H TER 13933 WAT 1063 ATOM 13933 O WAT 1064 22.644 4.586 155.649 1.00 0.00 O ATOM 13934 H1 WAT 1064 23.137 4.423 156.453 1.00 0.00 H ATOM 13935 H2 WAT 1064 21.904 3.981 155.694 1.00 0.00 H TER 13937 WAT 1064 ATOM 13937 O WAT 1065 72.038 9.827 93.473 1.00 0.00 O ATOM 13938 H1 WAT 1065 72.451 9.492 92.677 1.00 0.00 H ATOM 13939 H2 WAT 1065 72.014 10.776 93.350 1.00 0.00 H TER 13941 WAT 1065 ATOM 13941 O WAT 1066 113.194 131.282 2.644 1.00 0.00 O ATOM 13942 H1 WAT 1066 112.328 130.875 2.613 1.00 0.00 H ATOM 13943 H2 WAT 1066 113.376 131.527 1.737 1.00 0.00 H TER 13945 WAT 1066 ATOM 13945 O WAT 1067 107.398 22.074 8.156 1.00 0.00 O ATOM 13946 H1 WAT 1067 106.660 22.538 7.760 1.00 0.00 H ATOM 13947 H2 WAT 1067 108.024 22.764 8.378 1.00 0.00 H TER 13949 WAT 1067 ATOM 13949 O WAT 1068 73.604 5.094 152.366 1.00 0.00 O ATOM 13950 H1 WAT 1068 74.302 5.660 152.037 1.00 0.00 H ATOM 13951 H2 WAT 1068 73.017 4.978 151.619 1.00 0.00 H TER 13953 WAT 1068 ATOM 13953 O WAT 1069 47.654 23.910 104.456 1.00 0.00 O ATOM 13954 H1 WAT 1069 48.054 23.509 103.684 1.00 0.00 H ATOM 13955 H2 WAT 1069 47.778 23.265 105.152 1.00 0.00 H TER 13957 WAT 1069 ATOM 13957 O WAT 1070 67.994 8.022 77.056 1.00 0.00 O ATOM 13958 H1 WAT 1070 67.774 7.897 77.979 1.00 0.00 H ATOM 13959 H2 WAT 1070 67.743 7.199 76.636 1.00 0.00 H TER 13961 WAT 1070 ATOM 13961 O WAT 1071 76.360 111.543 55.781 1.00 0.00 O ATOM 13962 H1 WAT 1071 76.854 110.734 55.909 1.00 0.00 H ATOM 13963 H2 WAT 1071 76.333 111.660 54.831 1.00 0.00 H TER 13965 WAT 1071 ATOM 13965 O WAT 1072 93.213 51.106 57.000 1.00 0.00 O ATOM 13966 H1 WAT 1072 93.133 52.050 57.136 1.00 0.00 H ATOM 13967 H2 WAT 1072 92.496 50.888 56.404 1.00 0.00 H TER 13969 WAT 1072 ATOM 13969 O WAT 1073 84.562 106.900 80.234 1.00 0.00 O ATOM 13970 H1 WAT 1073 84.886 106.418 80.995 1.00 0.00 H ATOM 13971 H2 WAT 1073 84.188 106.226 79.666 1.00 0.00 H TER 13973 WAT 1073 ATOM 13973 O WAT 1074 133.198 43.627 91.375 1.00 0.00 O ATOM 13974 H1 WAT 1074 134.047 43.986 91.632 1.00 0.00 H ATOM 13975 H2 WAT 1074 132.981 43.005 92.069 1.00 0.00 H TER 13977 WAT 1074 ATOM 13977 O WAT 1075 104.193 97.861 91.204 1.00 0.00 O ATOM 13978 H1 WAT 1075 104.843 98.555 91.312 1.00 0.00 H ATOM 13979 H2 WAT 1075 104.475 97.172 91.805 1.00 0.00 H TER 13981 WAT 1075 ATOM 13981 O WAT 1076 23.505 82.200 114.166 1.00 0.00 O ATOM 13982 H1 WAT 1076 22.686 82.353 113.695 1.00 0.00 H ATOM 13983 H2 WAT 1076 24.158 82.073 113.478 1.00 0.00 H TER 13985 WAT 1076 ATOM 13985 O WAT 1077 13.092 101.429 59.166 1.00 0.00 O ATOM 13986 H1 WAT 1077 12.762 100.720 58.615 1.00 0.00 H ATOM 13987 H2 WAT 1077 12.519 102.171 58.971 1.00 0.00 H TER 13989 WAT 1077 ATOM 13989 O WAT 1078 26.593 13.997 11.493 1.00 0.00 O ATOM 13990 H1 WAT 1078 27.321 14.563 11.238 1.00 0.00 H ATOM 13991 H2 WAT 1078 26.910 13.109 11.328 1.00 0.00 H TER 13993 WAT 1078 ATOM 13993 O WAT 1079 5.278 118.739 121.298 1.00 0.00 O ATOM 13994 H1 WAT 1079 5.462 118.385 120.428 1.00 0.00 H ATOM 13995 H2 WAT 1079 5.186 117.967 121.856 1.00 0.00 H TER 13997 WAT 1079 ATOM 13997 O WAT 1080 84.991 82.288 153.542 1.00 0.00 O ATOM 13998 H1 WAT 1080 84.551 83.106 153.311 1.00 0.00 H ATOM 13999 H2 WAT 1080 84.646 82.066 154.406 1.00 0.00 H TER 14001 WAT 1080 ATOM 14001 O WAT 1081 44.750 7.339 156.036 1.00 0.00 O ATOM 14002 H1 WAT 1081 44.244 7.125 155.252 1.00 0.00 H ATOM 14003 H2 WAT 1081 45.663 7.264 155.759 1.00 0.00 H TER 14005 WAT 1081 ATOM 14005 O WAT 1082 103.943 91.202 12.222 1.00 0.00 O ATOM 14006 H1 WAT 1082 103.374 91.169 12.991 1.00 0.00 H ATOM 14007 H2 WAT 1082 104.773 90.832 12.522 1.00 0.00 H TER 14009 WAT 1082 ATOM 14009 O WAT 1083 122.056 86.629 139.473 1.00 0.00 O ATOM 14010 H1 WAT 1083 121.796 87.482 139.820 1.00 0.00 H ATOM 14011 H2 WAT 1083 122.551 86.221 140.184 1.00 0.00 H TER 14013 WAT 1083 ATOM 14013 O WAT 1084 22.234 37.584 131.073 1.00 0.00 O ATOM 14014 H1 WAT 1084 22.827 36.844 131.206 1.00 0.00 H ATOM 14015 H2 WAT 1084 22.665 38.119 130.406 1.00 0.00 H TER 14017 WAT 1084 ATOM 14017 O WAT 1085 101.430 52.686 108.342 1.00 0.00 O ATOM 14018 H1 WAT 1085 101.092 53.571 108.206 1.00 0.00 H ATOM 14019 H2 WAT 1085 102.010 52.533 107.596 1.00 0.00 H TER 14021 WAT 1085 ATOM 14021 O WAT 1086 139.037 40.578 76.700 1.00 0.00 O ATOM 14022 H1 WAT 1086 139.281 39.872 77.299 1.00 0.00 H ATOM 14023 H2 WAT 1086 139.506 41.345 77.030 1.00 0.00 H TER 14025 WAT 1086 ATOM 14025 O WAT 1087 130.777 110.499 73.187 1.00 0.00 O ATOM 14026 H1 WAT 1087 131.209 109.647 73.116 1.00 0.00 H ATOM 14027 H2 WAT 1087 131.431 111.125 72.877 1.00 0.00 H TER 14029 WAT 1087 ATOM 14029 O WAT 1088 8.440 33.919 98.111 1.00 0.00 O ATOM 14030 H1 WAT 1088 9.092 33.269 97.851 1.00 0.00 H ATOM 14031 H2 WAT 1088 7.613 33.437 98.124 1.00 0.00 H TER 14033 WAT 1088 ATOM 14033 O WAT 1089 47.332 92.005 103.070 1.00 0.00 O ATOM 14034 H1 WAT 1089 46.984 92.405 102.274 1.00 0.00 H ATOM 14035 H2 WAT 1089 46.605 91.489 103.417 1.00 0.00 H TER 14037 WAT 1089 ATOM 14037 O WAT 1090 135.510 8.521 117.798 1.00 0.00 O ATOM 14038 H1 WAT 1090 135.270 8.928 118.631 1.00 0.00 H ATOM 14039 H2 WAT 1090 134.955 8.955 117.150 1.00 0.00 H TER 14041 WAT 1090 ATOM 14041 O WAT 1091 30.458 115.061 140.486 1.00 0.00 O ATOM 14042 H1 WAT 1091 31.292 114.770 140.115 1.00 0.00 H ATOM 14043 H2 WAT 1091 30.103 115.663 139.833 1.00 0.00 H TER 14045 WAT 1091 ATOM 14045 O WAT 1092 46.056 9.064 129.580 1.00 0.00 O ATOM 14046 H1 WAT 1092 45.421 9.661 129.976 1.00 0.00 H ATOM 14047 H2 WAT 1092 45.628 8.755 128.781 1.00 0.00 H TER 14049 WAT 1092 ATOM 14049 O WAT 1093 98.409 4.849 107.569 1.00 0.00 O ATOM 14050 H1 WAT 1093 98.938 4.285 107.004 1.00 0.00 H ATOM 14051 H2 WAT 1093 98.069 4.262 108.244 1.00 0.00 H TER 14053 WAT 1093 ATOM 14053 O WAT 1094 88.174 145.048 110.502 1.00 0.00 O ATOM 14054 H1 WAT 1094 88.992 144.560 110.407 1.00 0.00 H ATOM 14055 H2 WAT 1094 87.859 145.166 109.606 1.00 0.00 H TER 14057 WAT 1094 ATOM 14057 O WAT 1095 65.923 52.859 114.749 1.00 0.00 O ATOM 14058 H1 WAT 1095 66.542 52.681 114.041 1.00 0.00 H ATOM 14059 H2 WAT 1095 65.252 52.182 114.657 1.00 0.00 H TER 14061 WAT 1095 ATOM 14061 O WAT 1096 52.343 50.040 65.178 1.00 0.00 O ATOM 14062 H1 WAT 1096 51.944 50.636 64.544 1.00 0.00 H ATOM 14063 H2 WAT 1096 52.954 50.589 65.669 1.00 0.00 H TER 14065 WAT 1096 ATOM 14065 O WAT 1097 136.321 57.999 120.258 1.00 0.00 O ATOM 14066 H1 WAT 1097 135.452 57.614 120.374 1.00 0.00 H ATOM 14067 H2 WAT 1097 136.901 57.248 120.137 1.00 0.00 H TER 14069 WAT 1097 ATOM 14069 O WAT 1098 31.682 119.640 81.557 1.00 0.00 O ATOM 14070 H1 WAT 1098 31.760 119.093 82.339 1.00 0.00 H ATOM 14071 H2 WAT 1098 31.015 120.288 81.784 1.00 0.00 H TER 14073 WAT 1098 ATOM 14073 O WAT 1099 85.932 13.156 116.268 1.00 0.00 O ATOM 14074 H1 WAT 1099 85.587 14.000 115.978 1.00 0.00 H ATOM 14075 H2 WAT 1099 85.998 13.238 117.219 1.00 0.00 H TER 14077 WAT 1099 ATOM 14077 O WAT 1100 142.388 62.529 112.023 1.00 0.00 O ATOM 14078 H1 WAT 1100 142.887 63.320 111.819 1.00 0.00 H ATOM 14079 H2 WAT 1100 141.802 62.417 111.274 1.00 0.00 H TER 14081 WAT 1100 ATOM 14081 O WAT 1101 2.794 70.546 124.623 1.00 0.00 O ATOM 14082 H1 WAT 1101 3.508 69.977 124.335 1.00 0.00 H ATOM 14083 H2 WAT 1101 3.204 71.402 124.746 1.00 0.00 H TER 14085 WAT 1101 ATOM 14085 O WAT 1102 95.300 19.078 140.690 1.00 0.00 O ATOM 14086 H1 WAT 1102 96.046 18.553 140.983 1.00 0.00 H ATOM 14087 H2 WAT 1102 95.379 19.898 141.176 1.00 0.00 H TER 14089 WAT 1102 ATOM 14089 O WAT 1103 74.492 5.194 15.497 1.00 0.00 O ATOM 14090 H1 WAT 1103 74.801 4.347 15.817 1.00 0.00 H ATOM 14091 H2 WAT 1103 74.929 5.835 16.057 1.00 0.00 H TER 14093 WAT 1103 ATOM 14093 O WAT 1104 84.754 104.442 130.717 1.00 0.00 O ATOM 14094 H1 WAT 1104 84.264 104.902 130.035 1.00 0.00 H ATOM 14095 H2 WAT 1104 85.337 105.107 131.082 1.00 0.00 H TER 14097 WAT 1104 ATOM 14097 O WAT 1105 30.702 67.294 133.087 1.00 0.00 O ATOM 14098 H1 WAT 1105 31.068 67.069 133.942 1.00 0.00 H ATOM 14099 H2 WAT 1105 31.291 66.877 132.457 1.00 0.00 H TER 14101 WAT 1105 ATOM 14101 O WAT 1106 13.597 106.046 14.224 1.00 0.00 O ATOM 14102 H1 WAT 1106 13.111 106.461 14.937 1.00 0.00 H ATOM 14103 H2 WAT 1106 14.374 106.594 14.112 1.00 0.00 H TER 14105 WAT 1106 ATOM 14105 O WAT 1107 103.041 64.896 103.692 1.00 0.00 O ATOM 14106 H1 WAT 1107 102.913 65.607 104.320 1.00 0.00 H ATOM 14107 H2 WAT 1107 102.310 64.983 103.080 1.00 0.00 H TER 14109 WAT 1107 ATOM 14109 O WAT 1108 102.253 130.190 90.612 1.00 0.00 O ATOM 14110 H1 WAT 1108 102.204 130.314 89.665 1.00 0.00 H ATOM 14111 H2 WAT 1108 102.499 129.271 90.722 1.00 0.00 H TER 14113 WAT 1108 ATOM 14113 O WAT 1109 2.926 32.384 145.495 1.00 0.00 O ATOM 14114 H1 WAT 1109 3.162 33.092 146.095 1.00 0.00 H ATOM 14115 H2 WAT 1109 2.950 32.788 144.628 1.00 0.00 H TER 14117 WAT 1109 ATOM 14117 O WAT 1110 107.109 79.515 101.859 1.00 0.00 O ATOM 14118 H1 WAT 1110 107.795 80.014 102.304 1.00 0.00 H ATOM 14119 H2 WAT 1110 106.392 79.477 102.493 1.00 0.00 H TER 14121 WAT 1110 ATOM 14121 O WAT 1111 23.026 145.550 87.301 1.00 0.00 O ATOM 14122 H1 WAT 1111 23.080 145.525 86.346 1.00 0.00 H ATOM 14123 H2 WAT 1111 23.900 145.819 87.583 1.00 0.00 H TER 14125 WAT 1111 ATOM 14125 O WAT 1112 110.673 46.134 92.594 1.00 0.00 O ATOM 14126 H1 WAT 1112 109.757 46.358 92.431 1.00 0.00 H ATOM 14127 H2 WAT 1112 111.104 46.977 92.737 1.00 0.00 H TER 14129 WAT 1112 ATOM 14129 O WAT 1113 76.998 29.632 118.821 1.00 0.00 O ATOM 14130 H1 WAT 1113 77.074 29.720 117.871 1.00 0.00 H ATOM 14131 H2 WAT 1113 76.523 30.416 119.097 1.00 0.00 H TER 14133 WAT 1113 ATOM 14133 O WAT 1114 132.742 110.083 157.378 1.00 0.00 O ATOM 14134 H1 WAT 1114 132.399 110.658 156.694 1.00 0.00 H ATOM 14135 H2 WAT 1114 132.186 110.256 158.138 1.00 0.00 H TER 14137 WAT 1114 ATOM 14137 O WAT 1115 104.274 75.452 147.914 1.00 0.00 O ATOM 14138 H1 WAT 1115 103.755 75.883 148.593 1.00 0.00 H ATOM 14139 H2 WAT 1115 103.675 75.367 147.172 1.00 0.00 H TER 14141 WAT 1115 ATOM 14141 O WAT 1116 65.282 50.452 83.768 1.00 0.00 O ATOM 14142 H1 WAT 1116 64.487 50.777 83.346 1.00 0.00 H ATOM 14143 H2 WAT 1116 65.029 50.311 84.680 1.00 0.00 H TER 14145 WAT 1116 ATOM 14145 O WAT 1117 55.627 122.762 131.959 1.00 0.00 O ATOM 14146 H1 WAT 1117 54.860 123.326 132.059 1.00 0.00 H ATOM 14147 H2 WAT 1117 56.251 123.293 131.465 1.00 0.00 H TER 14149 WAT 1117 ATOM 14149 O WAT 1118 7.136 53.441 80.734 1.00 0.00 O ATOM 14150 H1 WAT 1118 7.700 53.186 80.003 1.00 0.00 H ATOM 14151 H2 WAT 1118 7.361 54.356 80.902 1.00 0.00 H TER 14153 WAT 1118 ATOM 14153 O WAT 1119 44.673 100.751 74.101 1.00 0.00 O ATOM 14154 H1 WAT 1119 44.449 100.929 73.188 1.00 0.00 H ATOM 14155 H2 WAT 1119 45.274 100.008 74.060 1.00 0.00 H TER 14157 WAT 1119 ATOM 14157 O WAT 1120 65.929 29.365 24.716 1.00 0.00 O ATOM 14158 H1 WAT 1120 66.573 28.745 25.057 1.00 0.00 H ATOM 14159 H2 WAT 1120 66.373 29.795 23.985 1.00 0.00 H TER 14161 WAT 1120 ATOM 14161 O WAT 1121 50.845 116.401 146.814 1.00 0.00 O ATOM 14162 H1 WAT 1121 50.898 116.119 145.901 1.00 0.00 H ATOM 14163 H2 WAT 1121 51.159 115.648 147.315 1.00 0.00 H TER 14165 WAT 1121 ATOM 14165 O WAT 1122 114.301 13.746 125.196 1.00 0.00 O ATOM 14166 H1 WAT 1122 113.450 14.143 125.010 1.00 0.00 H ATOM 14167 H2 WAT 1122 114.114 13.073 125.850 1.00 0.00 H TER 14169 WAT 1122 ATOM 14169 O WAT 1123 33.269 30.871 95.141 1.00 0.00 O ATOM 14170 H1 WAT 1123 32.790 30.045 95.078 1.00 0.00 H ATOM 14171 H2 WAT 1123 32.813 31.360 95.826 1.00 0.00 H TER 14173 WAT 1123 ATOM 14173 O WAT 1124 15.141 38.343 4.566 1.00 0.00 O ATOM 14174 H1 WAT 1124 14.831 37.443 4.464 1.00 0.00 H ATOM 14175 H2 WAT 1124 14.973 38.551 5.485 1.00 0.00 H TER 14177 WAT 1124 ATOM 14177 O WAT 1125 141.111 9.082 12.214 1.00 0.00 O ATOM 14178 H1 WAT 1125 140.616 8.408 11.748 1.00 0.00 H ATOM 14179 H2 WAT 1125 140.482 9.791 12.347 1.00 0.00 H TER 14181 WAT 1125 ATOM 14181 O WAT 1126 16.751 7.746 133.124 1.00 0.00 O ATOM 14182 H1 WAT 1126 16.470 8.530 132.653 1.00 0.00 H ATOM 14183 H2 WAT 1126 16.325 7.813 133.978 1.00 0.00 H TER 14185 WAT 1126 ATOM 14185 O WAT 1127 108.366 20.055 129.888 1.00 0.00 O ATOM 14186 H1 WAT 1127 108.620 20.973 129.800 1.00 0.00 H ATOM 14187 H2 WAT 1127 109.085 19.653 130.375 1.00 0.00 H TER 14189 WAT 1127 ATOM 14189 O WAT 1128 20.506 139.493 117.359 1.00 0.00 O ATOM 14190 H1 WAT 1128 20.954 138.651 117.278 1.00 0.00 H ATOM 14191 H2 WAT 1128 20.327 139.757 116.457 1.00 0.00 H TER 14193 WAT 1128 ATOM 14193 O WAT 1129 85.042 132.757 8.929 1.00 0.00 O ATOM 14194 H1 WAT 1129 85.320 131.870 8.700 1.00 0.00 H ATOM 14195 H2 WAT 1129 85.851 133.268 8.934 1.00 0.00 H TER 14197 WAT 1129 ATOM 14197 O WAT 1130 40.232 118.990 82.763 1.00 0.00 O ATOM 14198 H1 WAT 1130 40.674 118.144 82.828 1.00 0.00 H ATOM 14199 H2 WAT 1130 39.482 118.914 83.352 1.00 0.00 H TER 14201 WAT 1130 ATOM 14201 O WAT 1131 143.236 117.053 68.599 1.00 0.00 O ATOM 14202 H1 WAT 1131 143.233 117.227 67.657 1.00 0.00 H ATOM 14203 H2 WAT 1131 142.526 116.425 68.729 1.00 0.00 H TER 14205 WAT 1131 ATOM 14205 O WAT 1132 38.600 13.883 62.395 1.00 0.00 O ATOM 14206 H1 WAT 1132 39.074 14.212 61.631 1.00 0.00 H ATOM 14207 H2 WAT 1132 37.922 14.538 62.557 1.00 0.00 H TER 14209 WAT 1132 ATOM 14209 O WAT 1133 64.750 83.472 144.955 1.00 0.00 O ATOM 14210 H1 WAT 1133 65.465 83.896 144.480 1.00 0.00 H ATOM 14211 H2 WAT 1133 65.016 83.512 145.874 1.00 0.00 H TER 14213 WAT 1133 ATOM 14213 O WAT 1134 84.419 116.992 118.002 1.00 0.00 O ATOM 14214 H1 WAT 1134 83.964 117.795 117.752 1.00 0.00 H ATOM 14215 H2 WAT 1134 84.980 116.791 117.252 1.00 0.00 H TER 14217 WAT 1134 ATOM 14217 O WAT 1135 87.703 46.725 136.512 1.00 0.00 O ATOM 14218 H1 WAT 1135 88.638 46.721 136.716 1.00 0.00 H ATOM 14219 H2 WAT 1135 87.360 47.488 136.977 1.00 0.00 H TER 14221 WAT 1135 ATOM 14221 O WAT 1136 46.073 99.402 144.583 1.00 0.00 O ATOM 14222 H1 WAT 1136 45.447 98.749 144.271 1.00 0.00 H ATOM 14223 H2 WAT 1136 45.532 100.069 145.006 1.00 0.00 H TER 14225 WAT 1136 ATOM 14225 O WAT 1137 126.494 5.060 83.509 1.00 0.00 O ATOM 14226 H1 WAT 1137 127.042 5.378 82.792 1.00 0.00 H ATOM 14227 H2 WAT 1137 125.597 5.201 83.206 1.00 0.00 H TER 14229 WAT 1137 ATOM 14229 O WAT 1138 26.932 78.426 87.266 1.00 0.00 O ATOM 14230 H1 WAT 1138 26.349 78.612 86.530 1.00 0.00 H ATOM 14231 H2 WAT 1138 27.362 77.605 87.028 1.00 0.00 H TER 14233 WAT 1138 ATOM 14233 O WAT 1139 137.653 106.748 113.214 1.00 0.00 O ATOM 14234 H1 WAT 1139 138.237 107.383 112.799 1.00 0.00 H ATOM 14235 H2 WAT 1139 137.405 107.157 114.043 1.00 0.00 H TER 14237 WAT 1139 ATOM 14237 O WAT 1140 144.023 18.697 126.663 1.00 0.00 O ATOM 14238 H1 WAT 1140 143.186 19.049 126.968 1.00 0.00 H ATOM 14239 H2 WAT 1140 144.448 18.370 127.456 1.00 0.00 H TER 14241 WAT 1140 ATOM 14241 O WAT 1141 136.881 132.415 82.976 1.00 0.00 O ATOM 14242 H1 WAT 1141 136.830 131.491 82.729 1.00 0.00 H ATOM 14243 H2 WAT 1141 137.555 132.779 82.402 1.00 0.00 H TER 14245 WAT 1141 ATOM 14245 O WAT 1142 54.491 128.918 104.864 1.00 0.00 O ATOM 14246 H1 WAT 1142 54.506 129.670 105.457 1.00 0.00 H ATOM 14247 H2 WAT 1142 55.305 128.450 105.049 1.00 0.00 H TER 14249 WAT 1142 ATOM 14249 O WAT 1143 9.177 94.985 150.414 1.00 0.00 O ATOM 14250 H1 WAT 1143 9.454 94.716 151.291 1.00 0.00 H ATOM 14251 H2 WAT 1143 8.271 95.272 150.527 1.00 0.00 H TER 14253 WAT 1143 ATOM 14253 O WAT 1144 114.485 37.920 145.533 1.00 0.00 O ATOM 14254 H1 WAT 1144 114.398 38.570 146.231 1.00 0.00 H ATOM 14255 H2 WAT 1144 114.589 38.438 144.735 1.00 0.00 H TER 14257 WAT 1144 ATOM 14257 O WAT 1145 80.527 5.114 62.088 1.00 0.00 O ATOM 14258 H1 WAT 1145 81.407 4.811 61.862 1.00 0.00 H ATOM 14259 H2 WAT 1145 80.024 4.311 62.221 1.00 0.00 H TER 14261 WAT 1145 ATOM 14261 O WAT 1146 74.847 37.381 125.202 1.00 0.00 O ATOM 14262 H1 WAT 1146 74.159 37.775 124.666 1.00 0.00 H ATOM 14263 H2 WAT 1146 74.815 36.449 124.985 1.00 0.00 H TER 14265 WAT 1146 ATOM 14265 O WAT 1147 21.258 89.545 56.134 1.00 0.00 O ATOM 14266 H1 WAT 1147 21.908 89.293 56.791 1.00 0.00 H ATOM 14267 H2 WAT 1147 20.881 90.358 56.470 1.00 0.00 H TER 14269 WAT 1147 ATOM 14269 O WAT 1148 87.331 20.556 9.470 1.00 0.00 O ATOM 14270 H1 WAT 1148 86.888 19.866 8.975 1.00 0.00 H ATOM 14271 H2 WAT 1148 86.673 20.861 10.096 1.00 0.00 H TER 14273 WAT 1148 ATOM 14273 O WAT 1149 132.429 52.990 70.036 1.00 0.00 O ATOM 14274 H1 WAT 1149 132.395 52.806 70.974 1.00 0.00 H ATOM 14275 H2 WAT 1149 133.232 53.499 69.920 1.00 0.00 H TER 14277 WAT 1149 ATOM 14277 O WAT 1150 8.292 117.617 89.129 1.00 0.00 O ATOM 14278 H1 WAT 1150 8.764 117.653 88.297 1.00 0.00 H ATOM 14279 H2 WAT 1150 8.977 117.523 89.790 1.00 0.00 H TER 14281 WAT 1150 ATOM 14281 O WAT 1151 27.396 95.057 75.590 1.00 0.00 O ATOM 14282 H1 WAT 1151 26.581 95.329 75.169 1.00 0.00 H ATOM 14283 H2 WAT 1151 27.189 95.043 76.525 1.00 0.00 H TER 14285 WAT 1151 ATOM 14285 O WAT 1152 23.106 102.342 72.089 1.00 0.00 O ATOM 14286 H1 WAT 1152 23.729 101.846 72.620 1.00 0.00 H ATOM 14287 H2 WAT 1152 22.897 103.110 72.622 1.00 0.00 H TER 14289 WAT 1152 ATOM 14289 O WAT 1153 87.980 101.050 131.386 1.00 0.00 O ATOM 14290 H1 WAT 1153 88.221 101.147 132.307 1.00 0.00 H ATOM 14291 H2 WAT 1153 88.813 100.919 130.932 1.00 0.00 H TER 14293 WAT 1153 ATOM 14293 O WAT 1154 113.368 45.287 128.405 1.00 0.00 O ATOM 14294 H1 WAT 1154 113.638 44.686 127.711 1.00 0.00 H ATOM 14295 H2 WAT 1154 113.039 44.717 129.100 1.00 0.00 H TER 14297 WAT 1154 ATOM 14297 O WAT 1155 52.323 53.129 31.243 1.00 0.00 O ATOM 14298 H1 WAT 1155 52.011 54.025 31.118 1.00 0.00 H ATOM 14299 H2 WAT 1155 51.743 52.764 31.911 1.00 0.00 H TER 14301 WAT 1155 ATOM 14301 O WAT 1156 29.291 42.024 11.735 1.00 0.00 O ATOM 14302 H1 WAT 1156 29.417 42.358 12.623 1.00 0.00 H ATOM 14303 H2 WAT 1156 28.387 42.252 11.519 1.00 0.00 H TER 14305 WAT 1156 ATOM 14305 O WAT 1157 120.170 65.462 144.574 1.00 0.00 O ATOM 14306 H1 WAT 1157 119.646 64.910 145.155 1.00 0.00 H ATOM 14307 H2 WAT 1157 119.731 66.312 144.592 1.00 0.00 H TER 14309 WAT 1157 ATOM 14309 O WAT 1158 25.165 43.058 21.429 1.00 0.00 O ATOM 14310 H1 WAT 1158 25.293 43.683 22.143 1.00 0.00 H ATOM 14311 H2 WAT 1158 26.033 42.964 21.036 1.00 0.00 H TER 14313 WAT 1158 ATOM 14313 O WAT 1159 106.406 105.194 138.383 1.00 0.00 O ATOM 14314 H1 WAT 1159 105.685 105.558 138.898 1.00 0.00 H ATOM 14315 H2 WAT 1159 107.180 105.319 138.932 1.00 0.00 H TER 14317 WAT 1159 ATOM 14317 O WAT 1160 27.971 5.482 58.786 1.00 0.00 O ATOM 14318 H1 WAT 1160 28.750 4.942 58.916 1.00 0.00 H ATOM 14319 H2 WAT 1160 28.307 6.311 58.447 1.00 0.00 H TER 14321 WAT 1160 ATOM 14321 O WAT 1161 18.441 6.207 72.406 1.00 0.00 O ATOM 14322 H1 WAT 1161 17.639 5.742 72.646 1.00 0.00 H ATOM 14323 H2 WAT 1161 18.347 7.069 72.811 1.00 0.00 H TER 14325 WAT 1161 ATOM 14325 O WAT 1162 41.267 118.038 21.209 1.00 0.00 O ATOM 14326 H1 WAT 1162 41.826 117.342 21.553 1.00 0.00 H ATOM 14327 H2 WAT 1162 41.858 118.781 21.084 1.00 0.00 H TER 14329 WAT 1162 ATOM 14329 O WAT 1163 45.814 22.716 100.191 1.00 0.00 O ATOM 14330 H1 WAT 1163 46.302 23.522 100.354 1.00 0.00 H ATOM 14331 H2 WAT 1163 44.955 22.872 100.584 1.00 0.00 H TER 14333 WAT 1163 ATOM 14333 O WAT 1164 81.066 84.852 6.368 1.00 0.00 O ATOM 14334 H1 WAT 1164 80.685 85.724 6.266 1.00 0.00 H ATOM 14335 H2 WAT 1164 80.599 84.310 5.733 1.00 0.00 H TER 14337 WAT 1164 ATOM 14337 O WAT 1165 34.174 72.410 13.082 1.00 0.00 O ATOM 14338 H1 WAT 1165 33.230 72.249 13.082 1.00 0.00 H ATOM 14339 H2 WAT 1165 34.349 72.807 13.936 1.00 0.00 H TER 14341 WAT 1165 ATOM 14341 O WAT 1166 128.616 25.511 75.853 1.00 0.00 O ATOM 14342 H1 WAT 1166 128.110 24.792 75.475 1.00 0.00 H ATOM 14343 H2 WAT 1166 128.978 25.150 76.662 1.00 0.00 H TER 14345 WAT 1166 ATOM 14345 O WAT 1167 72.169 19.397 7.690 1.00 0.00 O ATOM 14346 H1 WAT 1167 71.352 19.751 8.041 1.00 0.00 H ATOM 14347 H2 WAT 1167 72.090 18.450 7.809 1.00 0.00 H TER 14349 WAT 1167 ATOM 14349 O WAT 1168 120.922 64.823 86.833 1.00 0.00 O ATOM 14350 H1 WAT 1168 120.461 64.003 87.011 1.00 0.00 H ATOM 14351 H2 WAT 1168 121.054 64.822 85.885 1.00 0.00 H TER 14353 WAT 1168 ATOM 14353 O WAT 1169 66.464 18.691 153.426 1.00 0.00 O ATOM 14354 H1 WAT 1169 67.119 18.029 153.648 1.00 0.00 H ATOM 14355 H2 WAT 1169 65.777 18.578 154.084 1.00 0.00 H TER 14357 WAT 1169 ATOM 14357 O WAT 1170 63.002 28.053 121.582 1.00 0.00 O ATOM 14358 H1 WAT 1170 62.743 27.328 121.014 1.00 0.00 H ATOM 14359 H2 WAT 1170 63.958 28.004 121.612 1.00 0.00 H TER 14361 WAT 1170 ATOM 14361 O WAT 1171 127.768 18.577 151.514 1.00 0.00 O ATOM 14362 H1 WAT 1171 127.728 17.644 151.726 1.00 0.00 H ATOM 14363 H2 WAT 1171 127.624 18.615 150.569 1.00 0.00 H TER 14365 WAT 1171 ATOM 14365 O WAT 1172 124.124 74.124 129.444 1.00 0.00 O ATOM 14366 H1 WAT 1172 124.786 74.513 130.015 1.00 0.00 H ATOM 14367 H2 WAT 1172 123.371 73.977 130.015 1.00 0.00 H TER 14369 WAT 1172 ATOM 14369 O WAT 1173 51.254 19.745 72.272 1.00 0.00 O ATOM 14370 H1 WAT 1173 51.216 19.706 71.316 1.00 0.00 H ATOM 14371 H2 WAT 1173 50.366 19.531 72.556 1.00 0.00 H TER 14373 WAT 1173 ATOM 14373 O WAT 1174 50.100 144.696 80.837 1.00 0.00 O ATOM 14374 H1 WAT 1174 49.519 145.299 81.302 1.00 0.00 H ATOM 14375 H2 WAT 1174 49.812 143.826 81.113 1.00 0.00 H TER 14377 WAT 1174 ATOM 14377 O WAT 1175 98.235 26.864 99.093 1.00 0.00 O ATOM 14378 H1 WAT 1175 98.416 27.788 98.921 1.00 0.00 H ATOM 14379 H2 WAT 1175 98.343 26.437 98.244 1.00 0.00 H TER 14381 WAT 1175 ATOM 14381 O WAT 1176 53.523 93.798 92.506 1.00 0.00 O ATOM 14382 H1 WAT 1176 54.293 93.401 92.101 1.00 0.00 H ATOM 14383 H2 WAT 1176 53.453 93.370 93.360 1.00 0.00 H TER 14385 WAT 1176 ATOM 14385 O WAT 1177 1.311 114.893 58.262 1.00 0.00 O ATOM 14386 H1 WAT 1177 0.889 114.631 57.444 1.00 0.00 H ATOM 14387 H2 WAT 1177 1.920 115.586 58.006 1.00 0.00 H TER 14389 WAT 1177 ATOM 14389 O WAT 1178 82.337 4.897 4.732 1.00 0.00 O ATOM 14390 H1 WAT 1178 82.032 4.088 5.142 1.00 0.00 H ATOM 14391 H2 WAT 1178 82.190 4.762 3.796 1.00 0.00 H TER 14393 WAT 1178 ATOM 14393 O WAT 1179 23.216 110.984 76.768 1.00 0.00 O ATOM 14394 H1 WAT 1179 23.850 110.536 77.327 1.00 0.00 H ATOM 14395 H2 WAT 1179 22.933 111.740 77.283 1.00 0.00 H TER 14397 WAT 1179 ATOM 14397 O WAT 1180 139.376 52.551 65.871 1.00 0.00 O ATOM 14398 H1 WAT 1180 138.644 52.574 65.254 1.00 0.00 H ATOM 14399 H2 WAT 1180 139.388 51.650 66.194 1.00 0.00 H TER 14401 WAT 1180 ATOM 14401 O WAT 1181 48.801 86.832 153.182 1.00 0.00 O ATOM 14402 H1 WAT 1181 49.392 86.080 153.158 1.00 0.00 H ATOM 14403 H2 WAT 1181 49.113 87.404 152.480 1.00 0.00 H TER 14405 WAT 1181 ATOM 14405 O WAT 1182 5.432 5.886 75.772 1.00 0.00 O ATOM 14406 H1 WAT 1182 6.273 5.796 76.220 1.00 0.00 H ATOM 14407 H2 WAT 1182 5.110 6.747 76.040 1.00 0.00 H TER 14409 WAT 1182 ATOM 14409 O WAT 1183 57.863 34.563 74.859 1.00 0.00 O ATOM 14410 H1 WAT 1183 57.766 34.319 73.939 1.00 0.00 H ATOM 14411 H2 WAT 1183 58.440 33.892 75.225 1.00 0.00 H TER 14413 WAT 1183 ATOM 14413 O WAT 1184 99.766 103.196 82.552 1.00 0.00 O ATOM 14414 H1 WAT 1184 99.807 102.322 82.165 1.00 0.00 H ATOM 14415 H2 WAT 1184 100.652 103.358 82.874 1.00 0.00 H TER 14417 WAT 1184 ATOM 14417 O WAT 1185 136.346 134.055 107.167 1.00 0.00 O ATOM 14418 H1 WAT 1185 135.974 134.260 108.025 1.00 0.00 H ATOM 14419 H2 WAT 1185 135.746 134.462 106.542 1.00 0.00 H TER 14421 WAT 1185 ATOM 14421 O WAT 1186 88.002 121.970 130.008 1.00 0.00 O ATOM 14422 H1 WAT 1186 87.258 122.558 129.880 1.00 0.00 H ATOM 14423 H2 WAT 1186 87.894 121.298 129.335 1.00 0.00 H TER 14425 WAT 1186 ATOM 14425 O WAT 1187 61.524 26.387 128.348 1.00 0.00 O ATOM 14426 H1 WAT 1187 61.967 27.089 127.872 1.00 0.00 H ATOM 14427 H2 WAT 1187 61.794 25.586 127.900 1.00 0.00 H TER 14429 WAT 1187 ATOM 14429 O WAT 1188 73.578 79.123 119.146 1.00 0.00 O ATOM 14430 H1 WAT 1188 74.483 79.436 119.140 1.00 0.00 H ATOM 14431 H2 WAT 1188 73.651 78.178 119.277 1.00 0.00 H TER 14433 WAT 1188 ATOM 14433 O WAT 1189 3.118 91.072 87.383 1.00 0.00 O ATOM 14434 H1 WAT 1189 2.785 90.315 86.902 1.00 0.00 H ATOM 14435 H2 WAT 1189 4.039 90.867 87.545 1.00 0.00 H TER 14437 WAT 1189 ATOM 14437 O WAT 1190 31.127 134.021 146.183 1.00 0.00 O ATOM 14438 H1 WAT 1190 30.502 133.300 146.107 1.00 0.00 H ATOM 14439 H2 WAT 1190 31.938 133.674 145.812 1.00 0.00 H TER 14441 WAT 1190 ATOM 14441 O WAT 1191 13.781 43.319 100.597 1.00 0.00 O ATOM 14442 H1 WAT 1191 14.655 43.123 100.937 1.00 0.00 H ATOM 14443 H2 WAT 1191 13.787 42.968 99.706 1.00 0.00 H TER 14445 WAT 1191 ATOM 14445 O WAT 1192 5.836 126.264 136.257 1.00 0.00 O ATOM 14446 H1 WAT 1192 6.742 126.451 136.011 1.00 0.00 H ATOM 14447 H2 WAT 1192 5.331 126.444 135.464 1.00 0.00 H TER 14449 WAT 1192 ATOM 14449 O WAT 1193 92.829 11.324 4.113 1.00 0.00 O ATOM 14450 H1 WAT 1193 92.819 12.278 4.038 1.00 0.00 H ATOM 14451 H2 WAT 1193 93.609 11.133 4.635 1.00 0.00 H TER 14453 WAT 1193 ATOM 14453 O WAT 1194 77.573 16.496 0.281 1.00 0.00 O ATOM 14454 H1 WAT 1194 77.126 15.670 0.098 1.00 0.00 H ATOM 14455 H2 WAT 1194 77.140 17.134 -0.286 1.00 0.00 H TER 14457 WAT 1194 ATOM 14457 O WAT 1195 3.574 95.794 5.752 1.00 0.00 O ATOM 14458 H1 WAT 1195 4.063 95.519 4.977 1.00 0.00 H ATOM 14459 H2 WAT 1195 4.249 96.006 6.398 1.00 0.00 H TER 14461 WAT 1195 ATOM 14461 O WAT 1196 74.494 78.250 138.954 1.00 0.00 O ATOM 14462 H1 WAT 1196 73.650 77.802 138.994 1.00 0.00 H ATOM 14463 H2 WAT 1196 74.341 78.999 138.378 1.00 0.00 H TER 14465 WAT 1196 ATOM 14465 O WAT 1197 121.817 23.597 147.394 1.00 0.00 O ATOM 14466 H1 WAT 1197 122.148 24.489 147.292 1.00 0.00 H ATOM 14467 H2 WAT 1197 120.891 23.709 147.610 1.00 0.00 H TER 14469 WAT 1197 ATOM 14469 O WAT 1198 51.821 109.076 131.054 1.00 0.00 O ATOM 14470 H1 WAT 1198 52.592 109.015 130.491 1.00 0.00 H ATOM 14471 H2 WAT 1198 52.159 109.398 131.890 1.00 0.00 H TER 14473 WAT 1198 ATOM 14473 O WAT 1199 37.438 111.588 103.571 1.00 0.00 O ATOM 14474 H1 WAT 1199 37.452 110.633 103.635 1.00 0.00 H ATOM 14475 H2 WAT 1199 36.632 111.785 103.093 1.00 0.00 H TER 14477 WAT 1199 ATOM 14477 O WAT 1200 120.222 128.154 147.078 1.00 0.00 O ATOM 14478 H1 WAT 1200 120.815 127.434 146.861 1.00 0.00 H ATOM 14479 H2 WAT 1200 119.505 127.738 147.557 1.00 0.00 H TER 14481 WAT 1200 ATOM 14481 O WAT 1201 44.010 44.510 95.394 1.00 0.00 O ATOM 14482 H1 WAT 1201 43.486 44.380 94.603 1.00 0.00 H ATOM 14483 H2 WAT 1201 43.589 45.244 95.841 1.00 0.00 H TER 14485 WAT 1201 ATOM 14485 O WAT 1202 125.554 49.481 68.414 1.00 0.00 O ATOM 14486 H1 WAT 1202 124.878 48.814 68.538 1.00 0.00 H ATOM 14487 H2 WAT 1202 125.733 49.808 69.295 1.00 0.00 H TER 14489 WAT 1202 ATOM 14489 O WAT 1203 135.826 100.570 10.753 1.00 0.00 O ATOM 14490 H1 WAT 1203 135.426 99.702 10.797 1.00 0.00 H ATOM 14491 H2 WAT 1203 136.764 100.398 10.681 1.00 0.00 H TER 14493 WAT 1203 ATOM 14493 O WAT 1204 65.268 62.238 23.815 1.00 0.00 O ATOM 14494 H1 WAT 1204 65.486 61.332 24.035 1.00 0.00 H ATOM 14495 H2 WAT 1204 65.649 62.755 24.525 1.00 0.00 H TER 14497 WAT 1204 ATOM 14497 O WAT 1205 137.580 59.821 143.413 1.00 0.00 O ATOM 14498 H1 WAT 1205 137.715 58.882 143.290 1.00 0.00 H ATOM 14499 H2 WAT 1205 137.609 60.185 142.528 1.00 0.00 H TER 14501 WAT 1205 ATOM 14501 O WAT 1206 82.729 41.114 93.334 1.00 0.00 O ATOM 14502 H1 WAT 1206 82.951 42.045 93.324 1.00 0.00 H ATOM 14503 H2 WAT 1206 82.156 40.997 92.577 1.00 0.00 H TER 14505 WAT 1206 ATOM 14505 O WAT 1207 77.820 102.683 127.682 1.00 0.00 O ATOM 14506 H1 WAT 1207 76.978 102.730 128.134 1.00 0.00 H ATOM 14507 H2 WAT 1207 78.470 102.696 128.385 1.00 0.00 H TER 14509 WAT 1207 ATOM 14509 O WAT 1208 85.794 43.140 55.872 1.00 0.00 O ATOM 14510 H1 WAT 1208 85.729 42.757 56.746 1.00 0.00 H ATOM 14511 H2 WAT 1208 86.502 42.653 55.450 1.00 0.00 H TER 14513 WAT 1208 ATOM 14513 O WAT 1209 36.635 50.263 70.073 1.00 0.00 O ATOM 14514 H1 WAT 1209 37.402 50.087 70.618 1.00 0.00 H ATOM 14515 H2 WAT 1209 36.176 50.970 70.527 1.00 0.00 H TER 14517 WAT 1209 ATOM 14517 O WAT 1210 110.596 91.734 147.675 1.00 0.00 O ATOM 14518 H1 WAT 1210 110.867 90.977 148.195 1.00 0.00 H ATOM 14519 H2 WAT 1210 111.143 91.692 146.890 1.00 0.00 H TER 14521 WAT 1210 ATOM 14521 O WAT 1211 86.286 127.901 133.491 1.00 0.00 O ATOM 14522 H1 WAT 1211 86.082 126.987 133.295 1.00 0.00 H ATOM 14523 H2 WAT 1211 87.095 127.863 134.000 1.00 0.00 H TER 14525 WAT 1211 ATOM 14525 O WAT 1212 125.801 101.149 87.775 1.00 0.00 O ATOM 14526 H1 WAT 1212 125.961 101.754 88.499 1.00 0.00 H ATOM 14527 H2 WAT 1212 124.914 100.825 87.925 1.00 0.00 H TER 14529 WAT 1212 ATOM 14529 O WAT 1213 16.916 67.129 95.145 1.00 0.00 O ATOM 14530 H1 WAT 1213 16.983 67.868 95.750 1.00 0.00 H ATOM 14531 H2 WAT 1213 16.975 67.525 94.276 1.00 0.00 H TER 14533 WAT 1213 ATOM 14533 O WAT 1214 78.743 7.917 154.299 1.00 0.00 O ATOM 14534 H1 WAT 1214 77.942 7.612 154.727 1.00 0.00 H ATOM 14535 H2 WAT 1214 78.482 8.718 153.846 1.00 0.00 H TER 14537 WAT 1214 ATOM 14537 O WAT 1215 61.735 82.226 20.077 1.00 0.00 O ATOM 14538 H1 WAT 1215 62.662 82.043 20.227 1.00 0.00 H ATOM 14539 H2 WAT 1215 61.278 81.710 20.741 1.00 0.00 H TER 14541 WAT 1215 ATOM 14541 O WAT 1216 131.539 65.762 77.080 1.00 0.00 O ATOM 14542 H1 WAT 1216 131.125 64.974 76.728 1.00 0.00 H ATOM 14543 H2 WAT 1216 131.959 66.170 76.323 1.00 0.00 H TER 14545 WAT 1216 ATOM 14545 O WAT 1217 15.269 123.785 69.084 1.00 0.00 O ATOM 14546 H1 WAT 1217 15.017 124.526 69.636 1.00 0.00 H ATOM 14547 H2 WAT 1217 14.894 123.987 68.227 1.00 0.00 H TER 14549 WAT 1217 ATOM 14549 O WAT 1218 41.910 117.554 143.844 1.00 0.00 O ATOM 14550 H1 WAT 1218 41.209 118.117 144.171 1.00 0.00 H ATOM 14551 H2 WAT 1218 41.598 116.664 144.007 1.00 0.00 H TER 14553 WAT 1218 ATOM 14553 O WAT 1219 4.051 96.755 19.080 1.00 0.00 O ATOM 14554 H1 WAT 1219 3.722 97.569 19.460 1.00 0.00 H ATOM 14555 H2 WAT 1219 4.585 96.366 19.772 1.00 0.00 H TER 14557 WAT 1219 ATOM 14557 O WAT 1220 42.877 6.812 69.530 1.00 0.00 O ATOM 14558 H1 WAT 1220 42.007 7.014 69.185 1.00 0.00 H ATOM 14559 H2 WAT 1220 43.157 7.619 69.962 1.00 0.00 H TER 14561 WAT 1220 ATOM 14561 O WAT 1221 63.005 27.727 99.665 1.00 0.00 O ATOM 14562 H1 WAT 1221 62.290 27.914 100.272 1.00 0.00 H ATOM 14563 H2 WAT 1221 63.484 27.006 100.073 1.00 0.00 H TER 14565 WAT 1221 ATOM 14565 O WAT 1222 31.464 33.750 14.132 1.00 0.00 O ATOM 14566 H1 WAT 1222 31.475 33.727 13.176 1.00 0.00 H ATOM 14567 H2 WAT 1222 32.151 33.137 14.394 1.00 0.00 H TER 14569 WAT 1222 ATOM 14569 O WAT 1223 133.930 81.309 97.487 1.00 0.00 O ATOM 14570 H1 WAT 1223 134.421 80.845 98.165 1.00 0.00 H ATOM 14571 H2 WAT 1223 133.069 81.462 97.878 1.00 0.00 H TER 14573 WAT 1223 ATOM 14573 O WAT 1224 81.722 108.274 104.422 1.00 0.00 O ATOM 14574 H1 WAT 1224 81.106 108.640 103.787 1.00 0.00 H ATOM 14575 H2 WAT 1224 81.412 107.380 104.569 1.00 0.00 H TER 14577 WAT 1224 ATOM 14577 O WAT 1225 27.369 66.263 5.649 1.00 0.00 O ATOM 14578 H1 WAT 1225 26.640 65.659 5.787 1.00 0.00 H ATOM 14579 H2 WAT 1225 28.111 65.847 6.088 1.00 0.00 H TER 14581 WAT 1225 ATOM 14581 O WAT 1226 124.017 58.773 127.250 1.00 0.00 O ATOM 14582 H1 WAT 1226 123.311 59.191 126.757 1.00 0.00 H ATOM 14583 H2 WAT 1226 124.353 59.465 127.820 1.00 0.00 H TER 14585 WAT 1226 ATOM 14585 O WAT 1227 131.219 21.100 103.756 1.00 0.00 O ATOM 14586 H1 WAT 1227 130.914 21.955 104.058 1.00 0.00 H ATOM 14587 H2 WAT 1227 132.151 21.226 103.580 1.00 0.00 H TER 14589 WAT 1227 ATOM 14589 O WAT 1228 22.127 126.509 73.621 1.00 0.00 O ATOM 14590 H1 WAT 1228 21.377 126.578 74.212 1.00 0.00 H ATOM 14591 H2 WAT 1228 21.767 126.129 72.820 1.00 0.00 H TER 14593 WAT 1228 ATOM 14593 O WAT 1229 96.996 92.783 145.775 1.00 0.00 O ATOM 14594 H1 WAT 1229 97.756 92.525 146.297 1.00 0.00 H ATOM 14595 H2 WAT 1229 97.194 92.470 144.892 1.00 0.00 H TER 14597 WAT 1229 ATOM 14597 O WAT 1230 56.181 36.608 16.645 1.00 0.00 O ATOM 14598 H1 WAT 1230 57.054 36.861 16.344 1.00 0.00 H ATOM 14599 H2 WAT 1230 56.328 36.215 17.505 1.00 0.00 H TER 14601 WAT 1230 ATOM 14601 O WAT 1231 93.764 19.332 145.360 1.00 0.00 O ATOM 14602 H1 WAT 1231 94.485 19.290 144.732 1.00 0.00 H ATOM 14603 H2 WAT 1231 93.166 19.985 144.995 1.00 0.00 H TER 14605 WAT 1231 ATOM 14605 O WAT 1232 128.419 52.347 157.302 1.00 0.00 O ATOM 14606 H1 WAT 1232 127.578 52.580 157.694 1.00 0.00 H ATOM 14607 H2 WAT 1232 128.274 51.483 156.916 1.00 0.00 H TER 14609 WAT 1232 ATOM 14609 O WAT 1233 72.894 115.349 22.678 1.00 0.00 O ATOM 14610 H1 WAT 1233 73.426 115.940 22.145 1.00 0.00 H ATOM 14611 H2 WAT 1233 73.357 115.300 23.514 1.00 0.00 H TER 14613 WAT 1233 ATOM 14613 O WAT 1234 76.396 0.704 133.716 1.00 0.00 O ATOM 14614 H1 WAT 1234 75.652 0.421 134.247 1.00 0.00 H ATOM 14615 H2 WAT 1234 77.004 -0.034 133.743 1.00 0.00 H TER 14617 WAT 1234 ATOM 14617 O WAT 1235 110.798 32.788 91.895 1.00 0.00 O ATOM 14618 H1 WAT 1235 110.474 32.387 92.702 1.00 0.00 H ATOM 14619 H2 WAT 1235 110.029 32.841 91.328 1.00 0.00 H TER 14621 WAT 1235 ATOM 14621 O WAT 1236 30.708 73.708 73.865 1.00 0.00 O ATOM 14622 H1 WAT 1236 31.037 74.444 74.380 1.00 0.00 H ATOM 14623 H2 WAT 1236 30.063 73.287 74.434 1.00 0.00 H TER 14625 WAT 1236 ATOM 14625 O WAT 1237 95.880 24.940 144.468 1.00 0.00 O ATOM 14626 H1 WAT 1237 96.804 25.147 144.325 1.00 0.00 H ATOM 14627 H2 WAT 1237 95.533 24.774 143.591 1.00 0.00 H TER 14629 WAT 1237 ATOM 14629 O WAT 1238 144.113 27.553 145.777 1.00 0.00 O ATOM 14630 H1 WAT 1238 143.747 27.221 146.597 1.00 0.00 H ATOM 14631 H2 WAT 1238 144.657 28.295 146.039 1.00 0.00 H TER 14633 WAT 1238 ATOM 14633 O WAT 1239 60.950 129.695 14.805 1.00 0.00 O ATOM 14634 H1 WAT 1239 61.142 128.877 14.346 1.00 0.00 H ATOM 14635 H2 WAT 1239 61.657 129.783 15.444 1.00 0.00 H TER 14637 WAT 1239 ATOM 14637 O WAT 1240 54.909 82.820 21.617 1.00 0.00 O ATOM 14638 H1 WAT 1240 54.578 82.073 22.114 1.00 0.00 H ATOM 14639 H2 WAT 1240 55.846 82.648 21.520 1.00 0.00 H TER 14641 WAT 1240 ATOM 14641 O WAT 1241 7.618 54.321 76.613 1.00 0.00 O ATOM 14642 H1 WAT 1241 6.841 54.667 77.053 1.00 0.00 H ATOM 14643 H2 WAT 1241 7.313 54.087 75.737 1.00 0.00 H TER 14645 WAT 1241 ATOM 14645 O WAT 1242 61.578 83.413 68.624 1.00 0.00 O ATOM 14646 H1 WAT 1242 61.767 82.561 69.018 1.00 0.00 H ATOM 14647 H2 WAT 1242 62.343 83.948 68.831 1.00 0.00 H TER 14649 WAT 1242 ATOM 14649 O WAT 1243 1.426 84.526 95.221 1.00 0.00 O ATOM 14650 H1 WAT 1243 1.755 84.831 94.376 1.00 0.00 H ATOM 14651 H2 WAT 1243 0.584 84.119 95.018 1.00 0.00 H TER 14653 WAT 1243 ATOM 14653 O WAT 1244 118.014 122.994 115.779 1.00 0.00 O ATOM 14654 H1 WAT 1244 117.686 123.325 114.943 1.00 0.00 H ATOM 14655 H2 WAT 1244 117.550 123.508 116.439 1.00 0.00 H TER 14657 WAT 1244 ATOM 14657 O WAT 1245 110.938 101.773 154.753 1.00 0.00 O ATOM 14658 H1 WAT 1245 110.195 101.544 155.313 1.00 0.00 H ATOM 14659 H2 WAT 1245 110.839 102.712 154.597 1.00 0.00 H TER 14661 WAT 1245 ATOM 14661 O WAT 1246 4.219 75.487 59.364 1.00 0.00 O ATOM 14662 H1 WAT 1246 4.301 74.933 60.140 1.00 0.00 H ATOM 14663 H2 WAT 1246 3.912 74.894 58.678 1.00 0.00 H TER 14665 WAT 1246 ATOM 14665 O WAT 1247 62.678 128.106 85.846 1.00 0.00 O ATOM 14666 H1 WAT 1247 63.206 128.903 85.886 1.00 0.00 H ATOM 14667 H2 WAT 1247 62.018 128.222 86.530 1.00 0.00 H TER 14669 WAT 1247 ATOM 14669 O WAT 1248 126.327 58.929 55.361 1.00 0.00 O ATOM 14670 H1 WAT 1248 126.359 58.983 54.405 1.00 0.00 H ATOM 14671 H2 WAT 1248 125.719 59.622 55.620 1.00 0.00 H TER 14673 WAT 1248 ATOM 14673 O WAT 1249 63.675 87.267 67.913 1.00 0.00 O ATOM 14674 H1 WAT 1249 63.604 87.950 67.246 1.00 0.00 H ATOM 14675 H2 WAT 1249 64.585 87.313 68.208 1.00 0.00 H TER 14677 WAT 1249 ATOM 14677 O WAT 1250 95.926 3.836 112.736 1.00 0.00 O ATOM 14678 H1 WAT 1250 95.489 2.992 112.621 1.00 0.00 H ATOM 14679 H2 WAT 1250 96.329 4.015 111.886 1.00 0.00 H TER 14681 WAT 1250 ATOM 14681 O WAT 1251 43.800 131.467 55.847 1.00 0.00 O ATOM 14682 H1 WAT 1251 44.354 131.555 56.623 1.00 0.00 H ATOM 14683 H2 WAT 1251 43.357 130.627 55.963 1.00 0.00 H TER 14685 WAT 1251 ATOM 14685 O WAT 1252 141.019 30.551 14.269 1.00 0.00 O ATOM 14686 H1 WAT 1252 140.969 31.210 13.577 1.00 0.00 H ATOM 14687 H2 WAT 1252 141.956 30.405 14.394 1.00 0.00 H TER 14689 WAT 1252 ATOM 14689 O WAT 1253 7.880 117.810 84.934 1.00 0.00 O ATOM 14690 H1 WAT 1253 7.620 118.311 84.161 1.00 0.00 H ATOM 14691 H2 WAT 1253 7.056 117.596 85.370 1.00 0.00 H TER 14693 WAT 1253 ATOM 14693 O WAT 1254 122.832 33.426 123.814 1.00 0.00 O ATOM 14694 H1 WAT 1254 122.404 34.195 124.190 1.00 0.00 H ATOM 14695 H2 WAT 1254 122.217 32.709 123.969 1.00 0.00 H TER 14697 WAT 1254 ATOM 14697 O WAT 1255 115.313 107.132 145.732 1.00 0.00 O ATOM 14698 H1 WAT 1255 115.989 106.454 145.709 1.00 0.00 H ATOM 14699 H2 WAT 1255 115.314 107.502 144.849 1.00 0.00 H TER 14701 WAT 1255 ATOM 14701 O WAT 1256 35.931 109.583 70.389 1.00 0.00 O ATOM 14702 H1 WAT 1256 35.937 109.527 71.344 1.00 0.00 H ATOM 14703 H2 WAT 1256 35.065 109.265 70.135 1.00 0.00 H TER 14705 WAT 1256 ATOM 14705 O WAT 1257 124.020 30.045 157.322 1.00 0.00 O ATOM 14706 H1 WAT 1257 123.164 29.669 157.118 1.00 0.00 H ATOM 14707 H2 WAT 1257 123.964 30.949 157.013 1.00 0.00 H TER 14709 WAT 1257 ATOM 14709 O WAT 1258 63.727 86.082 153.684 1.00 0.00 O ATOM 14710 H1 WAT 1258 64.559 86.553 153.741 1.00 0.00 H ATOM 14711 H2 WAT 1258 63.759 85.453 154.405 1.00 0.00 H TER 14713 WAT 1258 ATOM 14713 O WAT 1259 84.878 84.994 156.002 1.00 0.00 O ATOM 14714 H1 WAT 1259 85.447 84.262 156.240 1.00 0.00 H ATOM 14715 H2 WAT 1259 85.063 85.151 155.076 1.00 0.00 H TER 14717 WAT 1259 ATOM 14717 O WAT 1260 86.420 50.137 6.411 1.00 0.00 O ATOM 14718 H1 WAT 1260 86.932 50.284 7.206 1.00 0.00 H ATOM 14719 H2 WAT 1260 85.510 50.143 6.708 1.00 0.00 H TER 14721 WAT 1260 ATOM 14721 O WAT 1261 15.000 143.857 28.992 1.00 0.00 O ATOM 14722 H1 WAT 1261 14.628 143.570 29.825 1.00 0.00 H ATOM 14723 H2 WAT 1261 15.509 143.107 28.685 1.00 0.00 H TER 14725 WAT 1261 ATOM 14725 O WAT 1262 118.646 117.156 15.262 1.00 0.00 O ATOM 14726 H1 WAT 1262 118.043 117.267 15.997 1.00 0.00 H ATOM 14727 H2 WAT 1262 118.144 116.665 14.611 1.00 0.00 H TER 14729 WAT 1262 ATOM 14729 O WAT 1263 137.619 21.460 151.599 1.00 0.00 O ATOM 14730 H1 WAT 1263 137.985 22.317 151.819 1.00 0.00 H ATOM 14731 H2 WAT 1263 136.672 21.579 151.669 1.00 0.00 H TER 14733 WAT 1263 ATOM 14733 O WAT 1264 40.358 38.005 77.479 1.00 0.00 O ATOM 14734 H1 WAT 1264 40.686 38.659 78.097 1.00 0.00 H ATOM 14735 H2 WAT 1264 39.687 38.466 76.976 1.00 0.00 H TER 14737 WAT 1264 ATOM 14737 O WAT 1265 128.350 20.894 146.578 1.00 0.00 O ATOM 14738 H1 WAT 1265 127.820 21.655 146.340 1.00 0.00 H ATOM 14739 H2 WAT 1265 128.654 21.083 147.466 1.00 0.00 H TER 14741 WAT 1265 ATOM 14741 O WAT 1266 32.469 136.086 121.052 1.00 0.00 O ATOM 14742 H1 WAT 1266 33.102 136.182 121.764 1.00 0.00 H ATOM 14743 H2 WAT 1266 32.976 136.250 120.257 1.00 0.00 H TER 14745 WAT 1266 ATOM 14745 O WAT 1267 6.579 98.696 104.865 1.00 0.00 O ATOM 14746 H1 WAT 1267 7.504 98.710 105.114 1.00 0.00 H ATOM 14747 H2 WAT 1267 6.134 98.312 105.620 1.00 0.00 H TER 14749 WAT 1267 ATOM 14749 O WAT 1268 114.548 107.319 87.981 1.00 0.00 O ATOM 14750 H1 WAT 1268 114.465 107.729 88.842 1.00 0.00 H ATOM 14751 H2 WAT 1268 114.521 108.051 87.364 1.00 0.00 H TER 14753 WAT 1268 ATOM 14753 O WAT 1269 55.974 130.159 145.189 1.00 0.00 O ATOM 14754 H1 WAT 1269 55.451 130.294 144.399 1.00 0.00 H ATOM 14755 H2 WAT 1269 55.668 129.321 145.537 1.00 0.00 H TER 14757 WAT 1269 ATOM 14757 O WAT 1270 144.954 142.869 142.894 1.00 0.00 O ATOM 14758 H1 WAT 1270 144.479 143.631 142.562 1.00 0.00 H ATOM 14759 H2 WAT 1270 144.361 142.480 143.538 1.00 0.00 H TER 14761 WAT 1270 ATOM 14761 O WAT 1271 97.221 110.274 21.456 1.00 0.00 O ATOM 14762 H1 WAT 1271 97.723 109.459 21.477 1.00 0.00 H ATOM 14763 H2 WAT 1271 97.802 110.902 21.027 1.00 0.00 H TER 14765 WAT 1271 ATOM 14765 O WAT 1272 19.173 40.733 123.275 1.00 0.00 O ATOM 14766 H1 WAT 1272 18.648 41.531 123.209 1.00 0.00 H ATOM 14767 H2 WAT 1272 18.675 40.166 123.863 1.00 0.00 H TER 14769 WAT 1272 ATOM 14769 O WAT 1273 57.498 31.096 69.079 1.00 0.00 O ATOM 14770 H1 WAT 1273 57.119 30.406 69.624 1.00 0.00 H ATOM 14771 H2 WAT 1273 58.143 31.521 69.645 1.00 0.00 H TER 14773 WAT 1273 ATOM 14773 O WAT 1274 119.827 54.995 146.929 1.00 0.00 O ATOM 14774 H1 WAT 1274 119.128 54.833 146.295 1.00 0.00 H ATOM 14775 H2 WAT 1274 119.484 54.659 147.756 1.00 0.00 H TER 14777 WAT 1274 ATOM 14777 O WAT 1275 95.829 116.041 113.272 1.00 0.00 O ATOM 14778 H1 WAT 1275 95.225 116.490 112.679 1.00 0.00 H ATOM 14779 H2 WAT 1275 96.636 115.947 112.766 1.00 0.00 H TER 14781 WAT 1275 ATOM 14781 O WAT 1276 73.721 3.581 145.446 1.00 0.00 O ATOM 14782 H1 WAT 1276 73.588 4.500 145.214 1.00 0.00 H ATOM 14783 H2 WAT 1276 72.837 3.231 145.554 1.00 0.00 H TER 14785 WAT 1276 ATOM 14785 O WAT 1277 125.790 72.965 115.487 1.00 0.00 O ATOM 14786 H1 WAT 1277 125.970 72.257 116.105 1.00 0.00 H ATOM 14787 H2 WAT 1277 124.908 72.781 115.162 1.00 0.00 H TER 14789 WAT 1277 ATOM 14789 O WAT 1278 99.982 70.255 21.092 1.00 0.00 O ATOM 14790 H1 WAT 1278 100.405 70.499 21.914 1.00 0.00 H ATOM 14791 H2 WAT 1278 100.285 69.362 20.922 1.00 0.00 H TER 14793 WAT 1278 ATOM 14793 O WAT 1279 80.869 6.415 6.649 1.00 0.00 O ATOM 14794 H1 WAT 1279 81.412 7.092 7.053 1.00 0.00 H ATOM 14795 H2 WAT 1279 81.385 6.109 5.902 1.00 0.00 H TER 14797 WAT 1279 ATOM 14797 O WAT 1280 140.807 19.084 87.292 1.00 0.00 O ATOM 14798 H1 WAT 1280 140.062 18.580 86.966 1.00 0.00 H ATOM 14799 H2 WAT 1280 141.110 19.582 86.533 1.00 0.00 H TER 14801 WAT 1280 ATOM 14801 O WAT 1281 142.632 51.081 117.823 1.00 0.00 O ATOM 14802 H1 WAT 1281 142.429 52.005 117.677 1.00 0.00 H ATOM 14803 H2 WAT 1281 142.287 50.635 117.050 1.00 0.00 H TER 14805 WAT 1281 ATOM 14805 O WAT 1282 34.570 138.765 121.888 1.00 0.00 O ATOM 14806 H1 WAT 1282 35.398 139.046 121.499 1.00 0.00 H ATOM 14807 H2 WAT 1282 33.900 139.243 121.399 1.00 0.00 H TER 14809 WAT 1282 ATOM 14809 O WAT 1283 7.337 27.418 89.517 1.00 0.00 O ATOM 14810 H1 WAT 1283 6.547 27.853 89.839 1.00 0.00 H ATOM 14811 H2 WAT 1283 7.162 26.485 89.636 1.00 0.00 H TER 14813 WAT 1283 ATOM 14813 O WAT 1284 75.427 71.189 111.989 1.00 0.00 O ATOM 14814 H1 WAT 1284 74.856 71.907 112.264 1.00 0.00 H ATOM 14815 H2 WAT 1284 75.910 70.951 112.781 1.00 0.00 H TER 14817 WAT 1284 ATOM 14817 O WAT 1285 78.506 90.386 153.279 1.00 0.00 O ATOM 14818 H1 WAT 1285 78.379 91.033 152.585 1.00 0.00 H ATOM 14819 H2 WAT 1285 77.670 89.921 153.328 1.00 0.00 H TER 14821 WAT 1285 ATOM 14821 O WAT 1286 87.781 11.474 112.764 1.00 0.00 O ATOM 14822 H1 WAT 1286 87.348 12.327 112.739 1.00 0.00 H ATOM 14823 H2 WAT 1286 88.716 11.680 112.795 1.00 0.00 H TER 14825 WAT 1286 ATOM 14825 O WAT 1287 30.850 5.928 143.121 1.00 0.00 O ATOM 14826 H1 WAT 1287 30.126 6.389 142.697 1.00 0.00 H ATOM 14827 H2 WAT 1287 30.491 5.639 143.960 1.00 0.00 H TER 14829 WAT 1287 ATOM 14829 O WAT 1288 21.466 115.183 96.611 1.00 0.00 O ATOM 14830 H1 WAT 1288 22.190 115.515 96.080 1.00 0.00 H ATOM 14831 H2 WAT 1288 20.727 115.137 96.005 1.00 0.00 H TER 14833 WAT 1288 ATOM 14833 O WAT 1289 113.144 46.244 63.188 1.00 0.00 O ATOM 14834 H1 WAT 1289 112.572 46.699 63.807 1.00 0.00 H ATOM 14835 H2 WAT 1289 113.183 46.824 62.427 1.00 0.00 H TER 14837 WAT 1289 ATOM 14837 O WAT 1290 27.643 105.910 156.527 1.00 0.00 O ATOM 14838 H1 WAT 1290 27.321 106.759 156.223 1.00 0.00 H ATOM 14839 H2 WAT 1290 27.677 105.370 155.738 1.00 0.00 H TER 14841 WAT 1290 ATOM 14841 O WAT 1291 144.661 3.909 155.482 1.00 0.00 O ATOM 14842 H1 WAT 1291 145.605 4.072 155.494 1.00 0.00 H ATOM 14843 H2 WAT 1291 144.564 3.038 155.865 1.00 0.00 H TER 14845 WAT 1291 ATOM 14845 O WAT 1292 43.567 48.913 6.795 1.00 0.00 O ATOM 14846 H1 WAT 1292 43.579 49.556 6.087 1.00 0.00 H ATOM 14847 H2 WAT 1292 43.874 48.103 6.388 1.00 0.00 H TER 14849 WAT 1292 ATOM 14849 O WAT 1293 125.742 55.182 105.920 1.00 0.00 O ATOM 14850 H1 WAT 1293 126.100 54.875 106.753 1.00 0.00 H ATOM 14851 H2 WAT 1293 124.843 54.853 105.910 1.00 0.00 H TER 14853 WAT 1293 ATOM 14853 O WAT 1294 8.517 103.298 85.675 1.00 0.00 O ATOM 14854 H1 WAT 1294 8.921 103.022 84.852 1.00 0.00 H ATOM 14855 H2 WAT 1294 7.771 103.834 85.407 1.00 0.00 H TER 14857 WAT 1294 ATOM 14857 O WAT 1295 36.816 79.631 65.777 1.00 0.00 O ATOM 14858 H1 WAT 1295 36.336 79.240 66.506 1.00 0.00 H ATOM 14859 H2 WAT 1295 37.023 80.517 66.074 1.00 0.00 H TER 14861 WAT 1295 ATOM 14861 O WAT 1296 136.994 70.308 92.168 1.00 0.00 O ATOM 14862 H1 WAT 1296 137.433 70.691 92.928 1.00 0.00 H ATOM 14863 H2 WAT 1296 136.063 70.334 92.391 1.00 0.00 H TER 14865 WAT 1296 ATOM 14865 O WAT 1297 13.293 25.238 15.997 1.00 0.00 O ATOM 14866 H1 WAT 1297 13.309 25.055 16.936 1.00 0.00 H ATOM 14867 H2 WAT 1297 13.089 24.395 15.592 1.00 0.00 H TER 14869 WAT 1297 ATOM 14869 O WAT 1298 126.205 20.413 82.163 1.00 0.00 O ATOM 14870 H1 WAT 1298 126.826 20.233 82.869 1.00 0.00 H ATOM 14871 H2 WAT 1298 126.431 21.294 81.864 1.00 0.00 H TER 14873 WAT 1298 ATOM 14873 O WAT 1299 138.472 2.734 121.309 1.00 0.00 O ATOM 14874 H1 WAT 1299 139.227 2.896 121.875 1.00 0.00 H ATOM 14875 H2 WAT 1299 138.139 1.882 121.592 1.00 0.00 H TER 14877 WAT 1299 ATOM 14877 O WAT 1300 94.546 32.552 67.856 1.00 0.00 O ATOM 14878 H1 WAT 1300 94.656 33.485 68.041 1.00 0.00 H ATOM 14879 H2 WAT 1300 94.294 32.169 68.696 1.00 0.00 H TER 14881 WAT 1300 ATOM 14881 O WAT 1301 103.751 130.568 9.421 1.00 0.00 O ATOM 14882 H1 WAT 1301 103.061 130.354 10.050 1.00 0.00 H ATOM 14883 H2 WAT 1301 104.543 130.181 9.794 1.00 0.00 H TER 14885 WAT 1301 ATOM 14885 O WAT 1302 30.723 63.031 99.520 1.00 0.00 O ATOM 14886 H1 WAT 1302 30.105 63.390 98.883 1.00 0.00 H ATOM 14887 H2 WAT 1302 30.516 63.485 100.337 1.00 0.00 H TER 14889 WAT 1302 ATOM 14889 O WAT 1303 109.186 19.269 140.148 1.00 0.00 O ATOM 14890 H1 WAT 1303 108.513 18.615 140.339 1.00 0.00 H ATOM 14891 H2 WAT 1303 109.972 18.938 140.581 1.00 0.00 H TER 14893 WAT 1303 ATOM 14893 O WAT 1304 107.452 45.087 65.623 1.00 0.00 O ATOM 14894 H1 WAT 1304 107.339 44.511 64.867 1.00 0.00 H ATOM 14895 H2 WAT 1304 106.570 45.406 65.815 1.00 0.00 H TER 14897 WAT 1304 ATOM 14897 O WAT 1305 35.868 36.034 123.614 1.00 0.00 O ATOM 14898 H1 WAT 1305 36.686 35.541 123.549 1.00 0.00 H ATOM 14899 H2 WAT 1305 35.258 35.561 123.048 1.00 0.00 H TER 14901 WAT 1305 ATOM 14901 O WAT 1306 64.024 19.937 65.564 1.00 0.00 O ATOM 14902 H1 WAT 1306 63.227 19.870 66.089 1.00 0.00 H ATOM 14903 H2 WAT 1306 63.747 19.705 64.678 1.00 0.00 H TER 14905 WAT 1306 ATOM 14905 O WAT 1307 36.829 58.378 85.506 1.00 0.00 O ATOM 14906 H1 WAT 1307 37.075 58.238 86.420 1.00 0.00 H ATOM 14907 H2 WAT 1307 36.930 57.519 85.096 1.00 0.00 H TER 14909 WAT 1307 ATOM 14909 O WAT 1308 28.657 118.586 117.805 1.00 0.00 O ATOM 14910 H1 WAT 1308 28.316 118.907 118.640 1.00 0.00 H ATOM 14911 H2 WAT 1308 28.830 119.378 117.297 1.00 0.00 H TER 14913 WAT 1308 ATOM 14913 O WAT 1309 62.464 139.257 149.224 1.00 0.00 O ATOM 14914 H1 WAT 1309 63.126 139.127 149.903 1.00 0.00 H ATOM 14915 H2 WAT 1309 62.944 139.641 148.490 1.00 0.00 H TER 14917 WAT 1309 ATOM 14917 O WAT 1310 90.301 58.251 93.425 1.00 0.00 O ATOM 14918 H1 WAT 1310 90.745 58.557 94.217 1.00 0.00 H ATOM 14919 H2 WAT 1310 89.432 57.986 93.726 1.00 0.00 H TER 14921 WAT 1310 ATOM 14921 O WAT 1311 19.931 102.479 68.355 1.00 0.00 O ATOM 14922 H1 WAT 1311 19.167 102.202 68.860 1.00 0.00 H ATOM 14923 H2 WAT 1311 20.596 101.817 68.544 1.00 0.00 H TER 14925 WAT 1311 ATOM 14925 O WAT 1312 82.811 35.892 85.269 1.00 0.00 O ATOM 14926 H1 WAT 1312 82.204 35.498 85.895 1.00 0.00 H ATOM 14927 H2 WAT 1312 83.027 35.182 84.665 1.00 0.00 H TER 14929 WAT 1312 ATOM 14929 O WAT 1313 41.809 43.093 116.861 1.00 0.00 O ATOM 14930 H1 WAT 1313 42.051 43.948 117.215 1.00 0.00 H ATOM 14931 H2 WAT 1313 42.547 42.848 116.302 1.00 0.00 H TER 14933 WAT 1313 ATOM 14933 O WAT 1314 44.636 21.198 111.537 1.00 0.00 O ATOM 14934 H1 WAT 1314 45.186 20.427 111.392 1.00 0.00 H ATOM 14935 H2 WAT 1314 43.758 20.843 111.673 1.00 0.00 H TER 14937 WAT 1314 ATOM 14937 O WAT 1315 145.039 9.176 82.364 1.00 0.00 O ATOM 14938 H1 WAT 1315 144.934 9.514 83.253 1.00 0.00 H ATOM 14939 H2 WAT 1315 145.039 8.225 82.468 1.00 0.00 H TER 14941 WAT 1315 ATOM 14941 O WAT 1316 83.831 0.892 111.106 1.00 0.00 O ATOM 14942 H1 WAT 1316 83.763 1.082 112.042 1.00 0.00 H ATOM 14943 H2 WAT 1316 83.294 0.110 110.981 1.00 0.00 H TER 14945 WAT 1316 ATOM 14945 O WAT 1317 77.361 57.673 144.593 1.00 0.00 O ATOM 14946 H1 WAT 1317 77.022 58.532 144.340 1.00 0.00 H ATOM 14947 H2 WAT 1317 78.196 57.862 145.021 1.00 0.00 H TER 14949 WAT 1317 ATOM 14949 O WAT 1318 45.062 89.830 83.383 1.00 0.00 O ATOM 14950 H1 WAT 1318 44.843 89.071 82.842 1.00 0.00 H ATOM 14951 H2 WAT 1318 44.924 90.582 82.807 1.00 0.00 H TER 14953 WAT 1318 ATOM 14953 O WAT 1319 99.570 46.987 73.401 1.00 0.00 O ATOM 14954 H1 WAT 1319 100.404 47.351 73.105 1.00 0.00 H ATOM 14955 H2 WAT 1319 99.707 46.040 73.397 1.00 0.00 H TER 14957 WAT 1319 ATOM 14957 O WAT 1320 83.956 9.676 115.607 1.00 0.00 O ATOM 14958 H1 WAT 1320 84.016 9.608 114.654 1.00 0.00 H ATOM 14959 H2 WAT 1320 83.671 8.807 115.892 1.00 0.00 H TER 14961 WAT 1320 ATOM 14961 O WAT 1321 41.266 63.984 69.655 1.00 0.00 O ATOM 14962 H1 WAT 1321 42.127 64.325 69.898 1.00 0.00 H ATOM 14963 H2 WAT 1321 40.736 64.765 69.495 1.00 0.00 H TER 14965 WAT 1321 ATOM 14965 O WAT 1322 91.657 125.737 147.457 1.00 0.00 O ATOM 14966 H1 WAT 1322 91.819 125.555 146.531 1.00 0.00 H ATOM 14967 H2 WAT 1322 91.359 126.647 147.474 1.00 0.00 H TER 14969 WAT 1322 ATOM 14969 O WAT 1323 79.782 111.899 76.818 1.00 0.00 O ATOM 14970 H1 WAT 1323 80.050 111.013 77.063 1.00 0.00 H ATOM 14971 H2 WAT 1323 80.507 112.230 76.288 1.00 0.00 H TER 14973 WAT 1323 ATOM 14973 O WAT 1324 10.666 39.669 96.964 1.00 0.00 O ATOM 14974 H1 WAT 1324 10.360 40.388 96.411 1.00 0.00 H ATOM 14975 H2 WAT 1324 11.205 40.092 97.631 1.00 0.00 H TER 14977 WAT 1324 ATOM 14977 O WAT 1325 15.448 129.856 121.508 1.00 0.00 O ATOM 14978 H1 WAT 1325 14.522 129.647 121.633 1.00 0.00 H ATOM 14979 H2 WAT 1325 15.787 129.133 120.980 1.00 0.00 H TER 14981 WAT 1325 ATOM 14981 O WAT 1326 22.092 97.926 12.348 1.00 0.00 O ATOM 14982 H1 WAT 1326 21.474 98.597 12.059 1.00 0.00 H ATOM 14983 H2 WAT 1326 22.607 98.354 13.032 1.00 0.00 H TER 14985 WAT 1326 ATOM 14985 O WAT 1327 132.797 17.073 76.516 1.00 0.00 O ATOM 14986 H1 WAT 1327 133.269 16.615 77.211 1.00 0.00 H ATOM 14987 H2 WAT 1327 132.755 16.441 75.798 1.00 0.00 H TER 14989 WAT 1327 ATOM 14989 O WAT 1328 141.483 84.859 141.251 1.00 0.00 O ATOM 14990 H1 WAT 1328 142.329 85.303 141.308 1.00 0.00 H ATOM 14991 H2 WAT 1328 141.329 84.756 140.312 1.00 0.00 H TER 14993 WAT 1328 ATOM 14993 O WAT 1329 64.632 17.429 146.478 1.00 0.00 O ATOM 14994 H1 WAT 1329 65.089 17.764 145.706 1.00 0.00 H ATOM 14995 H2 WAT 1329 64.051 16.749 146.136 1.00 0.00 H TER 14997 WAT 1329 ATOM 14997 O WAT 1330 144.502 130.012 67.549 1.00 0.00 O ATOM 14998 H1 WAT 1330 143.940 129.867 66.788 1.00 0.00 H ATOM 14999 H2 WAT 1330 144.458 129.191 68.039 1.00 0.00 H TER 15001 WAT 1330 ATOM 15001 O WAT 1331 46.665 41.592 1.306 1.00 0.00 O ATOM 15002 H1 WAT 1331 47.481 41.325 0.884 1.00 0.00 H ATOM 15003 H2 WAT 1331 46.940 42.177 2.012 1.00 0.00 H TER 15005 WAT 1331 ATOM 15005 O WAT 1332 40.827 14.068 60.723 1.00 0.00 O ATOM 15006 H1 WAT 1332 40.309 14.504 60.047 1.00 0.00 H ATOM 15007 H2 WAT 1332 41.729 14.120 60.405 1.00 0.00 H TER 15009 WAT 1332 ATOM 15009 O WAT 1333 47.482 49.321 152.421 1.00 0.00 O ATOM 15010 H1 WAT 1333 48.211 49.426 151.809 1.00 0.00 H ATOM 15011 H2 WAT 1333 47.872 49.458 153.284 1.00 0.00 H TER 15013 WAT 1333 ATOM 15013 O WAT 1334 94.100 79.902 92.878 1.00 0.00 O ATOM 15014 H1 WAT 1334 94.411 79.911 91.972 1.00 0.00 H ATOM 15015 H2 WAT 1334 93.157 80.053 92.809 1.00 0.00 H TER 15017 WAT 1334 ATOM 15017 O WAT 1335 73.754 112.836 136.196 1.00 0.00 O ATOM 15018 H1 WAT 1335 73.056 113.066 135.583 1.00 0.00 H ATOM 15019 H2 WAT 1335 74.563 113.031 135.722 1.00 0.00 H TER 15021 WAT 1335 ATOM 15021 O WAT 1336 9.472 21.007 154.197 1.00 0.00 O ATOM 15022 H1 WAT 1336 9.581 20.059 154.119 1.00 0.00 H ATOM 15023 H2 WAT 1336 8.658 21.115 154.689 1.00 0.00 H TER 15025 WAT 1336 ATOM 15025 O WAT 1337 79.413 18.379 84.616 1.00 0.00 O ATOM 15026 H1 WAT 1337 79.570 18.750 83.748 1.00 0.00 H ATOM 15027 H2 WAT 1337 78.599 18.789 84.908 1.00 0.00 H TER 15029 WAT 1337 ATOM 15029 O WAT 1338 140.879 106.161 96.385 1.00 0.00 O ATOM 15030 H1 WAT 1338 140.167 106.316 95.764 1.00 0.00 H ATOM 15031 H2 WAT 1338 140.555 105.461 96.951 1.00 0.00 H TER 15033 WAT 1338 ATOM 15033 O WAT 1339 64.785 27.676 146.766 1.00 0.00 O ATOM 15034 H1 WAT 1339 64.287 26.859 146.757 1.00 0.00 H ATOM 15035 H2 WAT 1339 65.639 27.440 146.402 1.00 0.00 H TER 15037 WAT 1339 ATOM 15037 O WAT 1340 88.451 51.810 1.232 1.00 0.00 O ATOM 15038 H1 WAT 1340 88.653 52.666 0.854 1.00 0.00 H ATOM 15039 H2 WAT 1340 89.304 51.397 1.361 1.00 0.00 H TER 15041 WAT 1340 ATOM 15041 O WAT 1341 69.661 92.303 102.772 1.00 0.00 O ATOM 15042 H1 WAT 1341 69.329 91.648 103.385 1.00 0.00 H ATOM 15043 H2 WAT 1341 70.499 92.578 103.145 1.00 0.00 H TER 15045 WAT 1341 ATOM 15045 O WAT 1342 76.761 133.281 107.427 1.00 0.00 O ATOM 15046 H1 WAT 1342 77.148 133.462 106.570 1.00 0.00 H ATOM 15047 H2 WAT 1342 77.509 133.223 108.021 1.00 0.00 H TER 15049 WAT 1342 ATOM 15049 O WAT 1343 43.203 67.748 99.898 1.00 0.00 O ATOM 15050 H1 WAT 1343 43.146 67.401 100.789 1.00 0.00 H ATOM 15051 H2 WAT 1343 42.577 68.472 99.883 1.00 0.00 H TER 15053 WAT 1343 ATOM 15053 O WAT 1344 55.743 14.478 16.152 1.00 0.00 O ATOM 15054 H1 WAT 1344 55.256 13.830 16.662 1.00 0.00 H ATOM 15055 H2 WAT 1344 56.414 14.801 16.753 1.00 0.00 H TER 15057 WAT 1344 ATOM 15057 O WAT 1345 72.645 138.360 97.466 1.00 0.00 O ATOM 15058 H1 WAT 1345 72.495 138.849 98.275 1.00 0.00 H ATOM 15059 H2 WAT 1345 71.942 138.642 96.882 1.00 0.00 H TER 15061 WAT 1345 ATOM 15061 O WAT 1346 99.829 118.516 90.421 1.00 0.00 O ATOM 15062 H1 WAT 1346 100.491 118.900 90.995 1.00 0.00 H ATOM 15063 H2 WAT 1346 100.331 118.098 89.722 1.00 0.00 H TER 15065 WAT 1346 ATOM 15065 O WAT 1347 8.380 76.605 62.450 1.00 0.00 O ATOM 15066 H1 WAT 1347 8.853 76.858 61.656 1.00 0.00 H ATOM 15067 H2 WAT 1347 7.626 76.109 62.131 1.00 0.00 H TER 15069 WAT 1347 ATOM 15069 O WAT 1348 68.180 1.088 15.907 1.00 0.00 O ATOM 15070 H1 WAT 1348 68.351 0.928 14.978 1.00 0.00 H ATOM 15071 H2 WAT 1348 67.346 1.556 15.919 1.00 0.00 H TER 15073 WAT 1348 ATOM 15073 O WAT 1349 87.186 3.224 103.256 1.00 0.00 O ATOM 15074 H1 WAT 1349 87.597 4.075 103.104 1.00 0.00 H ATOM 15075 H2 WAT 1349 87.914 2.602 103.255 1.00 0.00 H TER 15077 WAT 1349 ATOM 15077 O WAT 1350 100.056 105.107 94.628 1.00 0.00 O ATOM 15078 H1 WAT 1350 99.175 105.384 94.377 1.00 0.00 H ATOM 15079 H2 WAT 1350 99.915 104.425 95.285 1.00 0.00 H TER 15081 WAT 1350 ATOM 15081 O WAT 1351 43.251 136.124 134.885 1.00 0.00 O ATOM 15082 H1 WAT 1351 43.179 135.291 135.351 1.00 0.00 H ATOM 15083 H2 WAT 1351 42.362 136.480 134.891 1.00 0.00 H TER 15085 WAT 1351 ATOM 15085 O WAT 1352 92.442 93.798 8.087 1.00 0.00 O ATOM 15086 H1 WAT 1352 91.671 94.269 7.770 1.00 0.00 H ATOM 15087 H2 WAT 1352 92.570 94.121 8.979 1.00 0.00 H TER 15089 WAT 1352 ATOM 15089 O WAT 1353 37.387 112.353 7.450 1.00 0.00 O ATOM 15090 H1 WAT 1353 37.234 113.220 7.824 1.00 0.00 H ATOM 15091 H2 WAT 1353 38.250 112.417 7.041 1.00 0.00 H TER 15093 WAT 1353 ATOM 15093 O WAT 1354 20.564 114.707 136.457 1.00 0.00 O ATOM 15094 H1 WAT 1354 20.279 114.437 135.584 1.00 0.00 H ATOM 15095 H2 WAT 1354 19.856 115.265 136.778 1.00 0.00 H TER 15097 WAT 1354 ATOM 15097 O WAT 1355 33.831 73.604 81.528 1.00 0.00 O ATOM 15098 H1 WAT 1355 33.518 74.260 80.905 1.00 0.00 H ATOM 15099 H2 WAT 1355 34.738 73.853 81.703 1.00 0.00 H TER 15101 WAT 1355 ATOM 15101 O WAT 1356 143.579 73.344 153.931 1.00 0.00 O ATOM 15102 H1 WAT 1356 143.051 73.650 154.669 1.00 0.00 H ATOM 15103 H2 WAT 1356 142.958 72.879 153.370 1.00 0.00 H TER 15105 WAT 1356 ATOM 15105 O WAT 1357 39.014 105.176 127.495 1.00 0.00 O ATOM 15106 H1 WAT 1357 39.317 106.057 127.275 1.00 0.00 H ATOM 15107 H2 WAT 1357 39.366 105.013 128.370 1.00 0.00 H TER 15109 WAT 1357 ATOM 15109 O WAT 1358 97.332 91.183 19.324 1.00 0.00 O ATOM 15110 H1 WAT 1358 97.914 91.353 20.065 1.00 0.00 H ATOM 15111 H2 WAT 1358 97.916 91.135 18.567 1.00 0.00 H TER 15113 WAT 1358 ATOM 15113 O WAT 1359 61.531 64.380 137.874 1.00 0.00 O ATOM 15114 H1 WAT 1359 61.475 65.006 137.152 1.00 0.00 H ATOM 15115 H2 WAT 1359 62.002 63.632 137.506 1.00 0.00 H TER 15117 WAT 1359 ATOM 15117 O WAT 1360 53.180 104.324 10.321 1.00 0.00 O ATOM 15118 H1 WAT 1360 52.736 104.133 9.495 1.00 0.00 H ATOM 15119 H2 WAT 1360 52.486 104.288 10.980 1.00 0.00 H TER 15121 WAT 1360 ATOM 15121 O WAT 1361 97.274 57.801 17.015 1.00 0.00 O ATOM 15122 H1 WAT 1361 96.501 57.244 16.923 1.00 0.00 H ATOM 15123 H2 WAT 1361 97.014 58.468 17.650 1.00 0.00 H TER 15125 WAT 1361 ATOM 15125 O WAT 1362 2.047 26.370 8.118 1.00 0.00 O ATOM 15126 H1 WAT 1362 2.361 26.506 7.224 1.00 0.00 H ATOM 15127 H2 WAT 1362 1.467 27.113 8.284 1.00 0.00 H TER 15129 WAT 1362 ATOM 15129 O WAT 1363 29.592 110.168 72.880 1.00 0.00 O ATOM 15130 H1 WAT 1363 29.359 109.405 72.351 1.00 0.00 H ATOM 15131 H2 WAT 1363 29.803 109.807 73.741 1.00 0.00 H TER 15133 WAT 1363 ATOM 15133 O WAT 1364 50.475 64.973 97.145 1.00 0.00 O ATOM 15134 H1 WAT 1364 50.741 64.551 96.328 1.00 0.00 H ATOM 15135 H2 WAT 1364 50.030 64.284 97.637 1.00 0.00 H TER 15137 WAT 1364 ATOM 15137 O WAT 1365 26.381 69.077 111.194 1.00 0.00 O ATOM 15138 H1 WAT 1365 27.249 69.124 110.795 1.00 0.00 H ATOM 15139 H2 WAT 1365 26.445 69.630 111.973 1.00 0.00 H TER 15141 WAT 1365 ATOM 15141 O WAT 1366 75.313 60.218 23.067 1.00 0.00 O ATOM 15142 H1 WAT 1366 75.686 59.921 23.897 1.00 0.00 H ATOM 15143 H2 WAT 1366 75.090 59.411 22.603 1.00 0.00 H TER 15145 WAT 1366 ATOM 15145 O WAT 1367 77.555 131.505 124.171 1.00 0.00 O ATOM 15146 H1 WAT 1367 78.143 132.230 123.960 1.00 0.00 H ATOM 15147 H2 WAT 1367 78.134 130.811 124.485 1.00 0.00 H TER 15149 WAT 1367 ATOM 15149 O WAT 1368 140.862 99.588 117.491 1.00 0.00 O ATOM 15150 H1 WAT 1368 140.992 100.466 117.850 1.00 0.00 H ATOM 15151 H2 WAT 1368 140.972 99.697 116.546 1.00 0.00 H TER 15153 WAT 1368 ATOM 15153 O WAT 1369 15.271 117.254 131.474 1.00 0.00 O ATOM 15154 H1 WAT 1369 15.855 117.758 130.906 1.00 0.00 H ATOM 15155 H2 WAT 1369 14.974 116.527 130.926 1.00 0.00 H TER 15157 WAT 1369 ATOM 15157 O WAT 1370 80.168 24.415 71.165 1.00 0.00 O ATOM 15158 H1 WAT 1370 79.417 23.828 71.255 1.00 0.00 H ATOM 15159 H2 WAT 1370 80.187 24.907 71.986 1.00 0.00 H TER 15161 WAT 1370 ATOM 15161 O WAT 1371 111.554 83.857 82.087 1.00 0.00 O ATOM 15162 H1 WAT 1371 111.159 83.942 82.954 1.00 0.00 H ATOM 15163 H2 WAT 1371 111.943 84.714 81.914 1.00 0.00 H TER 15165 WAT 1371 ATOM 15165 O WAT 1372 116.186 71.889 124.639 1.00 0.00 O ATOM 15166 H1 WAT 1372 115.979 71.557 123.765 1.00 0.00 H ATOM 15167 H2 WAT 1372 115.404 72.373 124.904 1.00 0.00 H TER 15169 WAT 1372 ATOM 15169 O WAT 1373 37.239 61.383 65.054 1.00 0.00 O ATOM 15170 H1 WAT 1373 37.303 61.941 65.830 1.00 0.00 H ATOM 15171 H2 WAT 1373 37.342 61.984 64.317 1.00 0.00 H TER 15173 WAT 1373 ATOM 15173 O WAT 1374 0.413 102.743 75.734 1.00 0.00 O ATOM 15174 H1 WAT 1374 0.810 101.998 76.186 1.00 0.00 H ATOM 15175 H2 WAT 1374 -0.512 102.510 75.657 1.00 0.00 H TER 15177 WAT 1374 ATOM 15177 O WAT 1375 23.903 99.695 84.064 1.00 0.00 O ATOM 15178 H1 WAT 1375 24.217 100.547 83.761 1.00 0.00 H ATOM 15179 H2 WAT 1375 22.952 99.792 84.110 1.00 0.00 H TER 15181 WAT 1375 ATOM 15181 O WAT 1376 49.224 106.476 150.829 1.00 0.00 O ATOM 15182 H1 WAT 1376 49.073 106.017 150.002 1.00 0.00 H ATOM 15183 H2 WAT 1376 49.053 105.818 151.502 1.00 0.00 H TER 15185 WAT 1376 ATOM 15185 O WAT 1377 76.253 97.855 116.648 1.00 0.00 O ATOM 15186 H1 WAT 1377 75.376 97.733 116.285 1.00 0.00 H ATOM 15187 H2 WAT 1377 76.104 98.276 117.496 1.00 0.00 H TER 15189 WAT 1377 ATOM 15189 O WAT 1378 46.960 6.729 139.282 1.00 0.00 O ATOM 15190 H1 WAT 1378 47.039 5.788 139.126 1.00 0.00 H ATOM 15191 H2 WAT 1378 47.470 6.883 140.077 1.00 0.00 H TER 15193 WAT 1378 ATOM 15193 O WAT 1379 52.265 1.786 56.904 1.00 0.00 O ATOM 15194 H1 WAT 1379 52.957 2.446 56.848 1.00 0.00 H ATOM 15195 H2 WAT 1379 52.724 0.950 56.824 1.00 0.00 H TER 15197 WAT 1379 ATOM 15197 O WAT 1380 39.391 124.734 87.327 1.00 0.00 O ATOM 15198 H1 WAT 1380 38.812 123.974 87.273 1.00 0.00 H ATOM 15199 H2 WAT 1380 38.799 125.485 87.365 1.00 0.00 H TER 15201 WAT 1380 ATOM 15201 O WAT 1381 63.205 3.529 70.688 1.00 0.00 O ATOM 15202 H1 WAT 1381 62.381 3.350 70.236 1.00 0.00 H ATOM 15203 H2 WAT 1381 63.276 2.834 71.342 1.00 0.00 H TER 15205 WAT 1381 ATOM 15205 O WAT 1382 107.564 137.956 81.786 1.00 0.00 O ATOM 15206 H1 WAT 1382 107.941 137.160 82.161 1.00 0.00 H ATOM 15207 H2 WAT 1382 106.624 137.874 81.948 1.00 0.00 H TER 15209 WAT 1382 ATOM 15209 O WAT 1383 48.207 99.283 118.324 1.00 0.00 O ATOM 15210 H1 WAT 1383 48.422 99.106 119.240 1.00 0.00 H ATOM 15211 H2 WAT 1383 47.423 99.830 118.364 1.00 0.00 H TER 15213 WAT 1383 ATOM 15213 O WAT 1384 72.331 57.753 114.268 1.00 0.00 O ATOM 15214 H1 WAT 1384 72.153 57.786 115.208 1.00 0.00 H ATOM 15215 H2 WAT 1384 72.823 58.554 114.089 1.00 0.00 H TER 15217 WAT 1384 ATOM 15217 O WAT 1385 19.059 51.234 153.322 1.00 0.00 O ATOM 15218 H1 WAT 1385 19.366 51.101 152.426 1.00 0.00 H ATOM 15219 H2 WAT 1385 18.105 51.187 153.258 1.00 0.00 H TER 15221 WAT 1385 ATOM 15221 O WAT 1386 124.839 1.932 78.946 1.00 0.00 O ATOM 15222 H1 WAT 1386 124.130 2.128 78.334 1.00 0.00 H ATOM 15223 H2 WAT 1386 125.504 1.499 78.410 1.00 0.00 H TER 15225 WAT 1386 ATOM 15225 O WAT 1387 32.119 22.677 146.205 1.00 0.00 O ATOM 15226 H1 WAT 1387 32.509 23.315 145.608 1.00 0.00 H ATOM 15227 H2 WAT 1387 31.183 22.702 146.004 1.00 0.00 H TER 15229 WAT 1387 ATOM 15229 O WAT 1388 144.009 88.291 2.250 1.00 0.00 O ATOM 15230 H1 WAT 1388 144.778 87.751 2.070 1.00 0.00 H ATOM 15231 H2 WAT 1388 144.056 88.471 3.189 1.00 0.00 H TER 15233 WAT 1388 ATOM 15233 O WAT 1389 128.087 80.694 73.954 1.00 0.00 O ATOM 15234 H1 WAT 1389 127.699 79.890 73.609 1.00 0.00 H ATOM 15235 H2 WAT 1389 128.080 80.576 74.904 1.00 0.00 H TER 15237 WAT 1389 ATOM 15237 O WAT 1390 11.882 59.064 103.053 1.00 0.00 O ATOM 15238 H1 WAT 1390 12.679 58.715 102.653 1.00 0.00 H ATOM 15239 H2 WAT 1390 12.197 59.692 103.704 1.00 0.00 H TER 15241 WAT 1390 ATOM 15241 O WAT 1391 10.192 29.627 75.893 1.00 0.00 O ATOM 15242 H1 WAT 1391 10.950 29.071 75.712 1.00 0.00 H ATOM 15243 H2 WAT 1391 10.460 30.161 76.640 1.00 0.00 H TER 15245 WAT 1391 ATOM 15245 O WAT 1392 106.187 119.143 132.312 1.00 0.00 O ATOM 15246 H1 WAT 1392 105.277 119.388 132.480 1.00 0.00 H ATOM 15247 H2 WAT 1392 106.216 118.201 132.478 1.00 0.00 H TER 15249 WAT 1392 ATOM 15249 O WAT 1393 143.618 125.097 117.102 1.00 0.00 O ATOM 15250 H1 WAT 1393 143.716 125.045 118.053 1.00 0.00 H ATOM 15251 H2 WAT 1393 142.693 125.301 116.967 1.00 0.00 H TER 15253 WAT 1393 ATOM 15253 O WAT 1394 143.349 127.146 10.284 1.00 0.00 O ATOM 15254 H1 WAT 1394 142.449 127.176 9.959 1.00 0.00 H ATOM 15255 H2 WAT 1394 143.719 127.994 10.041 1.00 0.00 H TER 15257 WAT 1394 ATOM 15257 O WAT 1395 123.555 33.238 120.751 1.00 0.00 O ATOM 15258 H1 WAT 1395 123.404 33.118 121.689 1.00 0.00 H ATOM 15259 H2 WAT 1395 123.112 32.495 120.341 1.00 0.00 H TER 15261 WAT 1395 ATOM 15261 O WAT 1396 62.399 89.466 124.305 1.00 0.00 O ATOM 15262 H1 WAT 1396 62.810 90.254 123.951 1.00 0.00 H ATOM 15263 H2 WAT 1396 61.950 89.765 125.096 1.00 0.00 H TER 15265 WAT 1396 ATOM 15265 O WAT 1397 6.243 53.539 4.085 1.00 0.00 O ATOM 15266 H1 WAT 1397 6.479 53.857 4.956 1.00 0.00 H ATOM 15267 H2 WAT 1397 5.566 54.145 3.784 1.00 0.00 H TER 15269 WAT 1397 ATOM 15269 O WAT 1398 63.818 36.206 110.907 1.00 0.00 O ATOM 15270 H1 WAT 1398 63.917 36.124 109.958 1.00 0.00 H ATOM 15271 H2 WAT 1398 63.027 36.732 111.020 1.00 0.00 H TER 15273 WAT 1398 ATOM 15273 O WAT 1399 125.887 63.941 16.735 1.00 0.00 O ATOM 15274 H1 WAT 1399 125.892 64.557 16.002 1.00 0.00 H ATOM 15275 H2 WAT 1399 125.075 63.446 16.627 1.00 0.00 H TER 15277 WAT 1399 ATOM 15277 O WAT 1400 9.206 7.954 123.544 1.00 0.00 O ATOM 15278 H1 WAT 1400 9.206 8.880 123.787 1.00 0.00 H ATOM 15279 H2 WAT 1400 8.632 7.538 124.187 1.00 0.00 H TER 15281 WAT 1400 ATOM 15281 O WAT 1401 32.022 11.587 87.960 1.00 0.00 O ATOM 15282 H1 WAT 1401 32.014 11.953 87.075 1.00 0.00 H ATOM 15283 H2 WAT 1401 31.572 12.242 88.494 1.00 0.00 H TER 15285 WAT 1401 ATOM 15285 O WAT 1402 95.415 123.252 15.977 1.00 0.00 O ATOM 15286 H1 WAT 1402 94.725 122.718 16.369 1.00 0.00 H ATOM 15287 H2 WAT 1402 96.132 123.219 16.611 1.00 0.00 H TER 15289 WAT 1402 ATOM 15289 O WAT 1403 91.286 39.153 63.309 1.00 0.00 O ATOM 15290 H1 WAT 1403 90.545 39.531 63.781 1.00 0.00 H ATOM 15291 H2 WAT 1403 91.362 39.684 62.516 1.00 0.00 H TER 15293 WAT 1403 ATOM 15293 O WAT 1404 66.710 20.789 145.695 1.00 0.00 O ATOM 15294 H1 WAT 1404 65.791 20.570 145.849 1.00 0.00 H ATOM 15295 H2 WAT 1404 66.782 21.710 145.944 1.00 0.00 H TER 15297 WAT 1404 ATOM 15297 O WAT 1405 124.087 60.642 86.235 1.00 0.00 O ATOM 15298 H1 WAT 1405 124.670 61.392 86.120 1.00 0.00 H ATOM 15299 H2 WAT 1405 123.268 61.021 86.555 1.00 0.00 H TER 15301 WAT 1405 ATOM 15301 O WAT 1406 42.296 29.667 109.912 1.00 0.00 O ATOM 15302 H1 WAT 1406 41.459 29.263 109.686 1.00 0.00 H ATOM 15303 H2 WAT 1406 42.906 29.340 109.251 1.00 0.00 H TER 15305 WAT 1406 ATOM 15305 O WAT 1407 11.485 110.732 158.528 1.00 0.00 O ATOM 15306 H1 WAT 1407 11.661 111.568 158.097 1.00 0.00 H ATOM 15307 H2 WAT 1407 12.011 110.759 159.327 1.00 0.00 H TER 15309 WAT 1407 ATOM 15309 O WAT 1408 101.770 5.606 105.512 1.00 0.00 O ATOM 15310 H1 WAT 1408 101.103 6.209 105.838 1.00 0.00 H ATOM 15311 H2 WAT 1408 101.416 4.735 105.693 1.00 0.00 H TER 15313 WAT 1408 ATOM 15313 O WAT 1409 104.572 49.217 75.489 1.00 0.00 O ATOM 15314 H1 WAT 1409 103.737 48.825 75.235 1.00 0.00 H ATOM 15315 H2 WAT 1409 104.571 50.077 75.068 1.00 0.00 H TER 15317 WAT 1409 ATOM 15317 O WAT 1410 57.509 8.130 154.101 1.00 0.00 O ATOM 15318 H1 WAT 1410 58.405 8.382 153.879 1.00 0.00 H ATOM 15319 H2 WAT 1410 57.019 8.244 153.287 1.00 0.00 H TER 15321 WAT 1410 ATOM 15321 O WAT 1411 111.844 93.141 133.156 1.00 0.00 O ATOM 15322 H1 WAT 1411 110.982 92.753 133.304 1.00 0.00 H ATOM 15323 H2 WAT 1411 112.046 93.594 133.974 1.00 0.00 H TER 15325 WAT 1411 ATOM 15325 O WAT 1412 71.499 106.061 115.996 1.00 0.00 O ATOM 15326 H1 WAT 1412 72.076 105.858 115.259 1.00 0.00 H ATOM 15327 H2 WAT 1412 70.810 105.398 115.950 1.00 0.00 H TER 15329 WAT 1412 ATOM 15329 O WAT 1413 107.320 20.150 62.082 1.00 0.00 O ATOM 15330 H1 WAT 1413 107.455 20.991 62.519 1.00 0.00 H ATOM 15331 H2 WAT 1413 107.901 20.179 61.322 1.00 0.00 H TER 15333 WAT 1413 ATOM 15333 O WAT 1414 60.991 6.161 121.347 1.00 0.00 O ATOM 15334 H1 WAT 1414 61.343 5.396 120.892 1.00 0.00 H ATOM 15335 H2 WAT 1414 60.723 5.828 122.203 1.00 0.00 H TER 15337 WAT 1414 ATOM 15337 O WAT 1415 40.523 69.134 118.380 1.00 0.00 O ATOM 15338 H1 WAT 1415 39.777 68.579 118.154 1.00 0.00 H ATOM 15339 H2 WAT 1415 40.476 69.221 119.332 1.00 0.00 H TER 15341 WAT 1415 ATOM 15341 O WAT 1416 34.496 4.695 94.261 1.00 0.00 O ATOM 15342 H1 WAT 1416 34.757 5.603 94.418 1.00 0.00 H ATOM 15343 H2 WAT 1416 35.166 4.173 94.703 1.00 0.00 H TER 15345 WAT 1416 ATOM 15345 O WAT 1417 76.003 90.550 111.636 1.00 0.00 O ATOM 15346 H1 WAT 1417 76.134 90.298 112.550 1.00 0.00 H ATOM 15347 H2 WAT 1417 76.496 89.899 111.135 1.00 0.00 H TER 15349 WAT 1417 ATOM 15349 O WAT 1418 97.943 43.641 126.982 1.00 0.00 O ATOM 15350 H1 WAT 1418 97.607 43.945 126.139 1.00 0.00 H ATOM 15351 H2 WAT 1418 98.421 42.839 126.775 1.00 0.00 H TER 15353 WAT 1418 ATOM 15353 O WAT 1419 73.291 80.155 97.106 1.00 0.00 O ATOM 15354 H1 WAT 1419 74.186 80.416 97.323 1.00 0.00 H ATOM 15355 H2 WAT 1419 72.751 80.893 97.390 1.00 0.00 H TER 15357 WAT 1419 ATOM 15357 O WAT 1420 112.935 90.223 82.875 1.00 0.00 O ATOM 15358 H1 WAT 1420 113.858 89.973 82.831 1.00 0.00 H ATOM 15359 H2 WAT 1420 112.464 89.390 82.916 1.00 0.00 H TER 15361 WAT 1420 ATOM 15361 O WAT 1421 117.755 66.361 141.335 1.00 0.00 O ATOM 15362 H1 WAT 1421 117.434 66.183 140.451 1.00 0.00 H ATOM 15363 H2 WAT 1421 118.213 67.198 141.260 1.00 0.00 H TER 15365 WAT 1421 ATOM 15365 O WAT 1422 74.930 117.320 133.348 1.00 0.00 O ATOM 15366 H1 WAT 1422 74.476 118.144 133.172 1.00 0.00 H ATOM 15367 H2 WAT 1422 74.252 116.744 133.702 1.00 0.00 H TER 15369 WAT 1422 ATOM 15369 O WAT 1423 76.886 98.296 138.878 1.00 0.00 O ATOM 15370 H1 WAT 1423 76.390 98.257 139.696 1.00 0.00 H ATOM 15371 H2 WAT 1423 77.504 97.568 138.938 1.00 0.00 H TER 15373 WAT 1423 ATOM 15373 O WAT 1424 135.051 72.880 113.969 1.00 0.00 O ATOM 15374 H1 WAT 1424 135.071 73.830 113.854 1.00 0.00 H ATOM 15375 H2 WAT 1424 134.552 72.746 114.775 1.00 0.00 H TER 15377 WAT 1424 ATOM 15377 O WAT 1425 130.052 81.130 122.800 1.00 0.00 O ATOM 15378 H1 WAT 1425 130.038 80.551 122.038 1.00 0.00 H ATOM 15379 H2 WAT 1425 129.427 81.823 122.586 1.00 0.00 H TER 15381 WAT 1425 ATOM 15381 O WAT 1426 21.550 92.665 14.407 1.00 0.00 O ATOM 15382 H1 WAT 1426 21.482 93.479 13.908 1.00 0.00 H ATOM 15383 H2 WAT 1426 22.422 92.328 14.199 1.00 0.00 H TER 15385 WAT 1426 ATOM 15385 O WAT 1427 111.899 13.902 75.710 1.00 0.00 O ATOM 15386 H1 WAT 1427 112.342 14.446 75.058 1.00 0.00 H ATOM 15387 H2 WAT 1427 111.803 13.050 75.284 1.00 0.00 H TER 15389 WAT 1427 ATOM 15389 O WAT 1428 102.084 103.093 97.790 1.00 0.00 O ATOM 15390 H1 WAT 1428 102.981 103.240 97.489 1.00 0.00 H ATOM 15391 H2 WAT 1428 102.181 102.556 98.576 1.00 0.00 H TER 15393 WAT 1428 ATOM 15393 O WAT 1429 130.855 102.773 82.426 1.00 0.00 O ATOM 15394 H1 WAT 1429 131.415 103.319 82.978 1.00 0.00 H ATOM 15395 H2 WAT 1429 131.155 101.879 82.590 1.00 0.00 H TER 15397 WAT 1429 ATOM 15397 O WAT 1430 112.540 119.192 117.857 1.00 0.00 O ATOM 15398 H1 WAT 1430 112.101 118.690 117.171 1.00 0.00 H ATOM 15399 H2 WAT 1430 113.444 119.276 117.552 1.00 0.00 H TER 15401 WAT 1430 ATOM 15401 O WAT 1431 63.408 22.833 111.872 1.00 0.00 O ATOM 15402 H1 WAT 1431 64.085 22.287 112.272 1.00 0.00 H ATOM 15403 H2 WAT 1431 62.599 22.574 112.313 1.00 0.00 H TER 15405 WAT 1431 ATOM 15405 O WAT 1432 32.322 83.942 62.902 1.00 0.00 O ATOM 15406 H1 WAT 1432 32.470 84.151 61.980 1.00 0.00 H ATOM 15407 H2 WAT 1432 33.147 84.163 63.333 1.00 0.00 H TER 15409 WAT 1432 ATOM 15409 O WAT 1433 110.704 126.181 115.519 1.00 0.00 O ATOM 15410 H1 WAT 1433 110.517 125.809 114.657 1.00 0.00 H ATOM 15411 H2 WAT 1433 110.156 125.678 116.122 1.00 0.00 H TER 15413 WAT 1433 ATOM 15413 O WAT 1434 111.411 136.890 22.723 1.00 0.00 O ATOM 15414 H1 WAT 1434 112.277 137.037 22.342 1.00 0.00 H ATOM 15415 H2 WAT 1434 110.800 137.080 22.011 1.00 0.00 H TER 15417 WAT 1434 ATOM 15417 O WAT 1435 60.738 58.944 114.428 1.00 0.00 O ATOM 15418 H1 WAT 1435 60.573 59.457 113.637 1.00 0.00 H ATOM 15419 H2 WAT 1435 61.602 58.557 114.287 1.00 0.00 H TER 15421 WAT 1435 ATOM 15421 O WAT 1436 139.958 114.383 149.527 1.00 0.00 O ATOM 15422 H1 WAT 1436 140.568 114.245 150.251 1.00 0.00 H ATOM 15423 H2 WAT 1436 139.111 114.525 149.951 1.00 0.00 H TER 15425 WAT 1436 ATOM 15425 O WAT 1437 134.173 32.891 5.986 1.00 0.00 O ATOM 15426 H1 WAT 1437 133.688 32.847 6.810 1.00 0.00 H ATOM 15427 H2 WAT 1437 135.054 32.593 6.210 1.00 0.00 H TER 15429 WAT 1437 ATOM 15429 O WAT 1438 31.704 58.424 148.703 1.00 0.00 O ATOM 15430 H1 WAT 1438 32.593 58.547 148.368 1.00 0.00 H ATOM 15431 H2 WAT 1438 31.700 57.531 149.049 1.00 0.00 H TER 15433 WAT 1438 ATOM 15433 O WAT 1439 132.835 51.678 150.466 1.00 0.00 O ATOM 15434 H1 WAT 1439 133.243 50.822 150.600 1.00 0.00 H ATOM 15435 H2 WAT 1439 132.007 51.482 150.028 1.00 0.00 H TER 15437 WAT 1439 ATOM 15437 O WAT 1440 120.204 70.122 143.914 1.00 0.00 O ATOM 15438 H1 WAT 1440 119.436 69.557 143.823 1.00 0.00 H ATOM 15439 H2 WAT 1440 119.887 70.880 144.405 1.00 0.00 H TER 15441 WAT 1440 ATOM 15441 O WAT 1441 109.438 72.604 111.184 1.00 0.00 O ATOM 15442 H1 WAT 1441 109.973 73.325 110.851 1.00 0.00 H ATOM 15443 H2 WAT 1441 109.839 72.377 112.023 1.00 0.00 H TER 15445 WAT 1441 ATOM 15445 O WAT 1442 111.538 103.085 121.752 1.00 0.00 O ATOM 15446 H1 WAT 1442 111.774 102.292 122.232 1.00 0.00 H ATOM 15447 H2 WAT 1442 111.401 102.789 120.852 1.00 0.00 H TER 15449 WAT 1442 ATOM 15449 O WAT 1443 141.023 139.399 155.298 1.00 0.00 O ATOM 15450 H1 WAT 1443 140.098 139.643 155.324 1.00 0.00 H ATOM 15451 H2 WAT 1443 141.068 138.697 154.649 1.00 0.00 H TER 15453 WAT 1443 ATOM 15453 O WAT 1444 4.357 129.383 144.586 1.00 0.00 O ATOM 15454 H1 WAT 1444 3.527 129.499 145.049 1.00 0.00 H ATOM 15455 H2 WAT 1444 4.959 129.052 145.252 1.00 0.00 H TER 15457 WAT 1444 ATOM 15457 O WAT 1445 144.008 112.388 147.368 1.00 0.00 O ATOM 15458 H1 WAT 1445 143.215 112.190 147.867 1.00 0.00 H ATOM 15459 H2 WAT 1445 144.269 113.259 147.668 1.00 0.00 H TER 15461 WAT 1445 ATOM 15461 O WAT 1446 140.520 70.689 122.954 1.00 0.00 O ATOM 15462 H1 WAT 1446 141.054 70.120 123.509 1.00 0.00 H ATOM 15463 H2 WAT 1446 141.156 71.193 122.447 1.00 0.00 H TER 15465 WAT 1446 ATOM 15465 O WAT 1447 138.535 52.682 8.119 1.00 0.00 O ATOM 15466 H1 WAT 1447 138.286 52.790 9.037 1.00 0.00 H ATOM 15467 H2 WAT 1447 138.384 51.754 7.937 1.00 0.00 H TER 15469 WAT 1447 ATOM 15469 O WAT 1448 22.938 103.717 65.346 1.00 0.00 O ATOM 15470 H1 WAT 1448 22.036 103.406 65.418 1.00 0.00 H ATOM 15471 H2 WAT 1448 23.276 103.290 64.558 1.00 0.00 H TER 15473 WAT 1448 ATOM 15473 O WAT 1449 110.986 63.159 74.533 1.00 0.00 O ATOM 15474 H1 WAT 1449 111.441 63.956 74.803 1.00 0.00 H ATOM 15475 H2 WAT 1449 110.539 63.401 73.722 1.00 0.00 H TER 15477 WAT 1449 ATOM 15477 O WAT 1450 82.900 57.768 112.357 1.00 0.00 O ATOM 15478 H1 WAT 1450 82.371 57.517 113.115 1.00 0.00 H ATOM 15479 H2 WAT 1450 83.776 57.439 112.556 1.00 0.00 H TER 15481 WAT 1450 ATOM 15481 O WAT 1451 53.169 120.845 146.309 1.00 0.00 O ATOM 15482 H1 WAT 1451 52.951 121.611 145.779 1.00 0.00 H ATOM 15483 H2 WAT 1451 54.116 120.748 146.212 1.00 0.00 H TER 15485 WAT 1451 ATOM 15485 O WAT 1452 16.076 81.458 152.061 1.00 0.00 O ATOM 15486 H1 WAT 1452 15.630 81.954 152.747 1.00 0.00 H ATOM 15487 H2 WAT 1452 16.675 80.880 152.533 1.00 0.00 H TER 15489 WAT 1452 ATOM 15489 O WAT 1453 64.473 6.869 134.567 1.00 0.00 O ATOM 15490 H1 WAT 1453 64.010 7.695 134.707 1.00 0.00 H ATOM 15491 H2 WAT 1453 64.193 6.311 135.293 1.00 0.00 H TER 15493 WAT 1453 ATOM 15493 O WAT 1454 127.702 93.802 0.964 1.00 0.00 O ATOM 15494 H1 WAT 1454 127.996 94.103 0.104 1.00 0.00 H ATOM 15495 H2 WAT 1454 128.312 94.206 1.581 1.00 0.00 H TER 15497 WAT 1454 ATOM 15497 O WAT 1455 3.192 44.685 117.055 1.00 0.00 O ATOM 15498 H1 WAT 1455 3.856 45.235 116.639 1.00 0.00 H ATOM 15499 H2 WAT 1455 2.549 45.304 117.399 1.00 0.00 H TER 15501 WAT 1455 ATOM 15501 O WAT 1456 3.349 78.884 132.162 1.00 0.00 O ATOM 15502 H1 WAT 1456 4.008 78.191 132.209 1.00 0.00 H ATOM 15503 H2 WAT 1456 2.579 78.510 132.591 1.00 0.00 H TER 15505 WAT 1456 ATOM 15505 O WAT 1457 100.236 30.268 111.159 1.00 0.00 O ATOM 15506 H1 WAT 1457 100.615 30.372 112.032 1.00 0.00 H ATOM 15507 H2 WAT 1457 99.374 30.681 111.221 1.00 0.00 H TER 15509 WAT 1457 ATOM 15509 O WAT 1458 78.397 47.620 126.068 1.00 0.00 O ATOM 15510 H1 WAT 1458 78.538 48.193 126.821 1.00 0.00 H ATOM 15511 H2 WAT 1458 78.992 47.955 125.397 1.00 0.00 H TER 15513 WAT 1458 ATOM 15513 O WAT 1459 123.565 17.049 25.392 1.00 0.00 O ATOM 15514 H1 WAT 1459 123.883 17.846 24.967 1.00 0.00 H ATOM 15515 H2 WAT 1459 122.758 16.834 24.924 1.00 0.00 H TER 15517 WAT 1459 ATOM 15517 O WAT 1460 80.471 20.900 109.155 1.00 0.00 O ATOM 15518 H1 WAT 1460 81.007 20.149 108.901 1.00 0.00 H ATOM 15519 H2 WAT 1460 80.172 21.272 108.325 1.00 0.00 H TER 15521 WAT 1460 ATOM 15521 O WAT 1461 79.439 22.444 133.031 1.00 0.00 O ATOM 15522 H1 WAT 1461 79.348 22.608 132.093 1.00 0.00 H ATOM 15523 H2 WAT 1461 79.322 23.303 133.438 1.00 0.00 H TER 15525 WAT 1461 ATOM 15525 O WAT 1462 100.754 124.488 120.495 1.00 0.00 O ATOM 15526 H1 WAT 1462 100.276 123.660 120.541 1.00 0.00 H ATOM 15527 H2 WAT 1462 100.664 124.865 121.370 1.00 0.00 H TER 15529 WAT 1462 ATOM 15529 O WAT 1463 20.753 17.592 86.259 1.00 0.00 O ATOM 15530 H1 WAT 1463 21.637 17.742 85.924 1.00 0.00 H ATOM 15531 H2 WAT 1463 20.537 16.703 85.977 1.00 0.00 H TER 15533 WAT 1463 ATOM 15533 O WAT 1464 103.730 14.694 152.228 1.00 0.00 O ATOM 15534 H1 WAT 1464 103.195 15.193 152.844 1.00 0.00 H ATOM 15535 H2 WAT 1464 104.235 15.357 151.756 1.00 0.00 H TER 15537 WAT 1464 ATOM 15537 O WAT 1465 14.326 64.861 141.389 1.00 0.00 O ATOM 15538 H1 WAT 1465 13.644 64.465 140.847 1.00 0.00 H ATOM 15539 H2 WAT 1465 14.712 65.537 140.832 1.00 0.00 H TER 15541 WAT 1465 ATOM 15541 O WAT 1466 143.386 99.324 6.999 1.00 0.00 O ATOM 15542 H1 WAT 1466 143.177 99.654 7.873 1.00 0.00 H ATOM 15543 H2 WAT 1466 142.580 98.901 6.703 1.00 0.00 H TER 15545 WAT 1466 ATOM 15545 O WAT 1467 133.336 101.606 147.451 1.00 0.00 O ATOM 15546 H1 WAT 1467 133.767 101.072 146.784 1.00 0.00 H ATOM 15547 H2 WAT 1467 132.928 102.319 146.961 1.00 0.00 H TER 15549 WAT 1467 ATOM 15549 O WAT 1468 10.991 91.883 82.063 1.00 0.00 O ATOM 15550 H1 WAT 1468 10.082 91.838 82.360 1.00 0.00 H ATOM 15551 H2 WAT 1468 11.296 90.976 82.087 1.00 0.00 H TER 15553 WAT 1468 ATOM 15553 O WAT 1469 76.217 67.568 143.883 1.00 0.00 O ATOM 15554 H1 WAT 1469 76.742 68.365 143.970 1.00 0.00 H ATOM 15555 H2 WAT 1469 75.678 67.721 143.107 1.00 0.00 H TER 15557 WAT 1469 ATOM 15557 O WAT 1470 83.690 13.495 150.589 1.00 0.00 O ATOM 15558 H1 WAT 1470 83.080 14.049 151.078 1.00 0.00 H ATOM 15559 H2 WAT 1470 83.982 14.045 149.862 1.00 0.00 H TER 15561 WAT 1470 ATOM 15561 O WAT 1471 142.466 137.913 135.012 1.00 0.00 O ATOM 15562 H1 WAT 1471 143.254 137.808 135.544 1.00 0.00 H ATOM 15563 H2 WAT 1471 142.537 137.232 134.342 1.00 0.00 H TER 15565 WAT 1471 ATOM 15565 O WAT 1472 105.118 70.908 96.522 1.00 0.00 O ATOM 15566 H1 WAT 1472 105.665 71.629 96.210 1.00 0.00 H ATOM 15567 H2 WAT 1472 104.282 71.319 96.741 1.00 0.00 H TER 15569 WAT 1472 ATOM 15569 O WAT 1473 4.572 97.223 127.118 1.00 0.00 O ATOM 15570 H1 WAT 1473 4.163 98.085 127.041 1.00 0.00 H ATOM 15571 H2 WAT 1473 3.890 96.609 126.846 1.00 0.00 H TER 15573 WAT 1473 ATOM 15573 O WAT 1474 145.179 14.308 108.309 1.00 0.00 O ATOM 15574 H1 WAT 1474 145.821 14.730 108.880 1.00 0.00 H ATOM 15575 H2 WAT 1474 144.689 13.726 108.890 1.00 0.00 H TER 15577 WAT 1474 ATOM 15577 O WAT 1475 68.139 115.497 116.412 1.00 0.00 O ATOM 15578 H1 WAT 1475 67.938 116.295 116.900 1.00 0.00 H ATOM 15579 H2 WAT 1475 68.014 114.790 117.046 1.00 0.00 H TER 15581 WAT 1475 ATOM 15581 O WAT 1476 53.667 137.582 80.843 1.00 0.00 O ATOM 15582 H1 WAT 1476 52.853 137.649 81.342 1.00 0.00 H ATOM 15583 H2 WAT 1476 54.130 136.843 81.239 1.00 0.00 H TER 15585 WAT 1476 ATOM 15585 O WAT 1477 11.625 12.817 124.226 1.00 0.00 O ATOM 15586 H1 WAT 1477 11.888 12.695 125.138 1.00 0.00 H ATOM 15587 H2 WAT 1477 11.638 13.765 124.097 1.00 0.00 H TER 15589 WAT 1477 ATOM 15589 O WAT 1478 38.210 65.050 79.399 1.00 0.00 O ATOM 15590 H1 WAT 1478 38.557 65.660 78.749 1.00 0.00 H ATOM 15591 H2 WAT 1478 37.720 64.407 78.886 1.00 0.00 H TER 15593 WAT 1478 ATOM 15593 O WAT 1479 100.742 69.656 76.654 1.00 0.00 O ATOM 15594 H1 WAT 1479 100.391 70.420 77.112 1.00 0.00 H ATOM 15595 H2 WAT 1479 101.508 69.400 77.169 1.00 0.00 H TER 15597 WAT 1479 ATOM 15597 O WAT 1480 21.636 51.760 141.985 1.00 0.00 O ATOM 15598 H1 WAT 1480 22.207 52.527 141.965 1.00 0.00 H ATOM 15599 H2 WAT 1480 21.147 51.846 142.804 1.00 0.00 H TER 15601 WAT 1480 ATOM 15601 O WAT 1481 73.485 93.319 97.327 1.00 0.00 O ATOM 15602 H1 WAT 1481 73.402 92.389 97.117 1.00 0.00 H ATOM 15603 H2 WAT 1481 72.902 93.448 98.075 1.00 0.00 H TER 15605 WAT 1481 ATOM 15605 O WAT 1482 118.168 94.100 96.260 1.00 0.00 O ATOM 15606 H1 WAT 1482 118.479 94.728 96.912 1.00 0.00 H ATOM 15607 H2 WAT 1482 117.588 93.516 96.748 1.00 0.00 H TER 15609 WAT 1482 ATOM 15609 O WAT 1483 68.622 105.360 156.544 1.00 0.00 O ATOM 15610 H1 WAT 1483 67.833 105.183 157.056 1.00 0.00 H ATOM 15611 H2 WAT 1483 69.330 105.366 157.188 1.00 0.00 H TER 15613 WAT 1483 ATOM 15613 O WAT 1484 54.338 40.036 99.821 1.00 0.00 O ATOM 15614 H1 WAT 1484 55.131 39.804 99.338 1.00 0.00 H ATOM 15615 H2 WAT 1484 54.597 39.995 100.741 1.00 0.00 H TER 15617 WAT 1484 ATOM 15617 O WAT 1485 140.235 79.524 63.243 1.00 0.00 O ATOM 15618 H1 WAT 1485 139.390 79.752 62.855 1.00 0.00 H ATOM 15619 H2 WAT 1485 140.604 78.873 62.647 1.00 0.00 H TER 15621 WAT 1485 ATOM 15621 O WAT 1486 36.693 94.171 80.210 1.00 0.00 O ATOM 15622 H1 WAT 1486 36.960 95.090 80.200 1.00 0.00 H ATOM 15623 H2 WAT 1486 36.288 94.048 81.068 1.00 0.00 H TER 15625 WAT 1486 ATOM 15625 O WAT 1487 18.226 124.646 101.035 1.00 0.00 O ATOM 15626 H1 WAT 1487 18.581 123.765 101.155 1.00 0.00 H ATOM 15627 H2 WAT 1487 18.465 124.881 100.138 1.00 0.00 H TER 15629 WAT 1487 ATOM 15629 O WAT 1488 45.260 39.502 80.606 1.00 0.00 O ATOM 15630 H1 WAT 1488 45.561 39.271 81.484 1.00 0.00 H ATOM 15631 H2 WAT 1488 45.895 40.149 80.298 1.00 0.00 H TER 15633 WAT 1488 ATOM 15633 O WAT 1489 37.586 33.311 138.488 1.00 0.00 O ATOM 15634 H1 WAT 1489 37.877 32.401 138.542 1.00 0.00 H ATOM 15635 H2 WAT 1489 36.632 33.260 138.539 1.00 0.00 H TER 15637 WAT 1489 ATOM 15637 O WAT 1490 141.980 86.359 5.408 1.00 0.00 O ATOM 15638 H1 WAT 1490 141.166 86.672 5.013 1.00 0.00 H ATOM 15639 H2 WAT 1490 142.578 87.104 5.347 1.00 0.00 H TER 15641 WAT 1490 ATOM 15641 O WAT 1491 132.687 105.741 103.380 1.00 0.00 O ATOM 15642 H1 WAT 1491 132.957 105.839 104.293 1.00 0.00 H ATOM 15643 H2 WAT 1491 133.509 105.653 102.896 1.00 0.00 H TER 15645 WAT 1491 ATOM 15645 O WAT 1492 106.745 69.602 72.374 1.00 0.00 O ATOM 15646 H1 WAT 1492 107.641 69.372 72.620 1.00 0.00 H ATOM 15647 H2 WAT 1492 106.681 69.361 71.449 1.00 0.00 H TER 15649 WAT 1492 ATOM 15649 O WAT 1493 125.906 136.693 156.390 1.00 0.00 O ATOM 15650 H1 WAT 1493 126.023 137.470 155.844 1.00 0.00 H ATOM 15651 H2 WAT 1493 126.773 136.287 156.417 1.00 0.00 H TER 15653 WAT 1493 ATOM 15653 O WAT 1494 137.469 47.676 13.539 1.00 0.00 O ATOM 15654 H1 WAT 1494 137.441 46.917 14.121 1.00 0.00 H ATOM 15655 H2 WAT 1494 136.595 47.713 13.151 1.00 0.00 H TER 15657 WAT 1494 ATOM 15657 O WAT 1495 93.182 55.323 78.890 1.00 0.00 O ATOM 15658 H1 WAT 1495 92.390 55.674 79.297 1.00 0.00 H ATOM 15659 H2 WAT 1495 93.395 54.547 79.408 1.00 0.00 H TER 15661 WAT 1495 ATOM 15661 O WAT 1496 121.362 144.418 2.282 1.00 0.00 O ATOM 15662 H1 WAT 1496 121.440 144.665 3.204 1.00 0.00 H ATOM 15663 H2 WAT 1496 120.419 144.373 2.126 1.00 0.00 H TER 15665 WAT 1496 ATOM 15665 O WAT 1497 106.019 5.800 60.267 1.00 0.00 O ATOM 15666 H1 WAT 1497 106.338 6.543 59.754 1.00 0.00 H ATOM 15667 H2 WAT 1497 105.125 6.041 60.507 1.00 0.00 H TER 15669 WAT 1497 ATOM 15669 O WAT 1498 97.186 110.225 87.610 1.00 0.00 O ATOM 15670 H1 WAT 1498 96.305 110.476 87.332 1.00 0.00 H ATOM 15671 H2 WAT 1498 97.706 110.248 86.807 1.00 0.00 H TER 15673 WAT 1498 ATOM 15673 O WAT 1499 2.197 100.649 14.575 1.00 0.00 O ATOM 15674 H1 WAT 1499 1.793 101.517 14.577 1.00 0.00 H ATOM 15675 H2 WAT 1499 2.975 100.749 14.026 1.00 0.00 H TER 15677 WAT 1499 ATOM 15677 O WAT 1500 1.763 28.812 111.824 1.00 0.00 O ATOM 15678 H1 WAT 1500 1.801 28.195 112.555 1.00 0.00 H ATOM 15679 H2 WAT 1500 1.651 28.260 111.050 1.00 0.00 H TER 15681 WAT 1500 ATOM 15681 O WAT 1501 45.322 129.195 153.123 1.00 0.00 O ATOM 15682 H1 WAT 1501 45.656 128.735 152.353 1.00 0.00 H ATOM 15683 H2 WAT 1501 45.264 128.520 153.799 1.00 0.00 H TER 15685 WAT 1501 ATOM 15685 O WAT 1502 29.676 33.641 100.076 1.00 0.00 O ATOM 15686 H1 WAT 1502 29.032 32.947 100.220 1.00 0.00 H ATOM 15687 H2 WAT 1502 30.506 33.178 99.964 1.00 0.00 H TER 15689 WAT 1502 ATOM 15689 O WAT 1503 38.635 122.470 82.049 1.00 0.00 O ATOM 15690 H1 WAT 1503 38.548 121.894 81.289 1.00 0.00 H ATOM 15691 H2 WAT 1503 39.393 122.129 82.522 1.00 0.00 H TER 15693 WAT 1503 ATOM 15693 O WAT 1504 36.350 69.406 113.804 1.00 0.00 O ATOM 15694 H1 WAT 1504 36.259 69.379 114.757 1.00 0.00 H ATOM 15695 H2 WAT 1504 36.926 68.670 113.597 1.00 0.00 H TER 15697 WAT 1504 ATOM 15697 O WAT 1505 114.861 31.513 151.353 1.00 0.00 O ATOM 15698 H1 WAT 1505 114.793 32.264 151.943 1.00 0.00 H ATOM 15699 H2 WAT 1505 115.667 31.071 151.621 1.00 0.00 H TER 15701 WAT 1505 ATOM 15701 O WAT 1506 120.111 71.555 72.902 1.00 0.00 O ATOM 15702 H1 WAT 1506 119.373 71.126 72.469 1.00 0.00 H ATOM 15703 H2 WAT 1506 120.655 71.879 72.185 1.00 0.00 H TER 15705 WAT 1506 ATOM 15705 O WAT 1507 13.120 109.964 88.060 1.00 0.00 O ATOM 15706 H1 WAT 1507 13.271 110.900 87.930 1.00 0.00 H ATOM 15707 H2 WAT 1507 12.534 109.918 88.816 1.00 0.00 H TER 15709 WAT 1507 ATOM 15709 O WAT 1508 130.905 20.072 114.499 1.00 0.00 O ATOM 15710 H1 WAT 1508 130.589 20.251 115.385 1.00 0.00 H ATOM 15711 H2 WAT 1508 130.250 19.482 114.126 1.00 0.00 H TER 15713 WAT 1508 ATOM 15713 O WAT 1509 90.008 49.549 143.853 1.00 0.00 O ATOM 15714 H1 WAT 1509 90.668 48.858 143.792 1.00 0.00 H ATOM 15715 H2 WAT 1509 89.190 49.084 144.032 1.00 0.00 H TER 15717 WAT 1509 ATOM 15717 O WAT 1510 74.053 80.192 91.021 1.00 0.00 O ATOM 15718 H1 WAT 1510 74.943 80.543 91.016 1.00 0.00 H ATOM 15719 H2 WAT 1510 74.171 79.242 91.045 1.00 0.00 H TER 15721 WAT 1510 ATOM 15721 O WAT 1511 105.294 65.086 112.937 1.00 0.00 O ATOM 15722 H1 WAT 1511 104.923 65.846 113.385 1.00 0.00 H ATOM 15723 H2 WAT 1511 105.046 65.204 112.020 1.00 0.00 H TER 15725 WAT 1511 ATOM 15725 O WAT 1512 6.191 77.813 14.351 1.00 0.00 O ATOM 15726 H1 WAT 1512 7.015 78.295 14.413 1.00 0.00 H ATOM 15727 H2 WAT 1512 5.881 77.751 15.254 1.00 0.00 H TER 15729 WAT 1512 ATOM 15729 O WAT 1513 28.883 143.355 136.942 1.00 0.00 O ATOM 15730 H1 WAT 1513 29.689 143.396 137.455 1.00 0.00 H ATOM 15731 H2 WAT 1513 28.338 144.059 137.294 1.00 0.00 H TER 15733 WAT 1513 ATOM 15733 O WAT 1514 113.424 81.354 132.626 1.00 0.00 O ATOM 15734 H1 WAT 1514 113.860 81.040 131.833 1.00 0.00 H ATOM 15735 H2 WAT 1514 112.685 81.871 132.304 1.00 0.00 H TER 15737 WAT 1514 ATOM 15737 O WAT 1515 96.295 5.661 151.156 1.00 0.00 O ATOM 15738 H1 WAT 1515 96.304 5.740 152.110 1.00 0.00 H ATOM 15739 H2 WAT 1515 97.034 5.085 150.958 1.00 0.00 H TER 15741 WAT 1515 ATOM 15741 O WAT 1516 61.825 113.770 113.878 1.00 0.00 O ATOM 15742 H1 WAT 1516 62.469 114.282 114.366 1.00 0.00 H ATOM 15743 H2 WAT 1516 62.074 113.883 112.960 1.00 0.00 H TER 15745 WAT 1516 ATOM 15745 O WAT 1517 76.622 16.246 100.099 1.00 0.00 O ATOM 15746 H1 WAT 1517 75.671 16.255 100.202 1.00 0.00 H ATOM 15747 H2 WAT 1517 76.914 17.063 100.503 1.00 0.00 H TER 15749 WAT 1517 ATOM 15749 O WAT 1518 136.600 69.127 116.361 1.00 0.00 O ATOM 15750 H1 WAT 1518 136.030 68.769 117.042 1.00 0.00 H ATOM 15751 H2 WAT 1518 136.944 68.357 115.908 1.00 0.00 H TER 15753 WAT 1518 ATOM 15753 O WAT 1519 144.635 114.607 149.481 1.00 0.00 O ATOM 15754 H1 WAT 1519 143.808 114.964 149.157 1.00 0.00 H ATOM 15755 H2 WAT 1519 144.376 113.886 150.055 1.00 0.00 H TER 15757 WAT 1519 ATOM 15757 O WAT 1520 40.382 2.741 24.275 1.00 0.00 O ATOM 15758 H1 WAT 1520 40.678 2.564 25.168 1.00 0.00 H ATOM 15759 H2 WAT 1520 39.452 2.517 24.281 1.00 0.00 H TER 15761 WAT 1520 ATOM 15761 O WAT 1521 81.205 25.937 138.117 1.00 0.00 O ATOM 15762 H1 WAT 1521 81.218 26.859 138.375 1.00 0.00 H ATOM 15763 H2 WAT 1521 80.280 25.741 137.973 1.00 0.00 H TER 15765 WAT 1521 ATOM 15765 O WAT 1522 61.774 64.272 9.525 1.00 0.00 O ATOM 15766 H1 WAT 1522 62.641 64.669 9.607 1.00 0.00 H ATOM 15767 H2 WAT 1522 61.332 64.796 8.857 1.00 0.00 H TER 15769 WAT 1522 ATOM 15769 O WAT 1523 82.882 55.501 151.980 1.00 0.00 O ATOM 15770 H1 WAT 1523 82.776 55.135 151.102 1.00 0.00 H ATOM 15771 H2 WAT 1523 82.078 55.258 152.440 1.00 0.00 H TER 15773 WAT 1523 ATOM 15773 O WAT 1524 115.421 135.216 88.562 1.00 0.00 O ATOM 15774 H1 WAT 1524 116.198 135.197 88.003 1.00 0.00 H ATOM 15775 H2 WAT 1524 115.708 135.668 89.355 1.00 0.00 H TER 15777 WAT 1524 ATOM 15777 O WAT 1525 101.751 131.702 148.006 1.00 0.00 O ATOM 15778 H1 WAT 1525 101.018 131.522 147.418 1.00 0.00 H ATOM 15779 H2 WAT 1525 101.341 131.876 148.853 1.00 0.00 H TER 15781 WAT 1525 ATOM 15781 O WAT 1526 31.519 115.015 148.263 1.00 0.00 O ATOM 15782 H1 WAT 1526 31.107 115.830 147.977 1.00 0.00 H ATOM 15783 H2 WAT 1526 31.333 114.969 149.201 1.00 0.00 H TER 15785 WAT 1526 ATOM 15785 O WAT 1527 118.481 63.570 84.072 1.00 0.00 O ATOM 15786 H1 WAT 1527 118.265 63.707 83.149 1.00 0.00 H ATOM 15787 H2 WAT 1527 117.903 64.170 84.544 1.00 0.00 H TER 15789 WAT 1527 ATOM 15789 O WAT 1528 126.418 53.948 82.338 1.00 0.00 O ATOM 15790 H1 WAT 1528 126.122 54.855 82.409 1.00 0.00 H ATOM 15791 H2 WAT 1528 126.355 53.605 83.230 1.00 0.00 H TER 15793 WAT 1528 ATOM 15793 O WAT 1529 51.817 136.834 155.209 1.00 0.00 O ATOM 15794 H1 WAT 1529 52.335 137.152 154.469 1.00 0.00 H ATOM 15795 H2 WAT 1529 51.211 137.549 155.402 1.00 0.00 H TER 15797 WAT 1529 ATOM 15797 O WAT 1530 64.781 122.087 59.457 1.00 0.00 O ATOM 15798 H1 WAT 1530 65.164 121.619 60.199 1.00 0.00 H ATOM 15799 H2 WAT 1530 65.423 121.988 58.753 1.00 0.00 H TER 15801 WAT 1530 ATOM 15801 O WAT 1531 61.204 72.047 142.987 1.00 0.00 O ATOM 15802 H1 WAT 1531 60.586 72.373 142.333 1.00 0.00 H ATOM 15803 H2 WAT 1531 62.065 72.180 142.591 1.00 0.00 H TER 15805 WAT 1531 ATOM 15805 O WAT 1532 70.639 124.249 101.781 1.00 0.00 O ATOM 15806 H1 WAT 1532 69.935 123.725 102.162 1.00 0.00 H ATOM 15807 H2 WAT 1532 70.256 124.625 100.988 1.00 0.00 H TER 15809 WAT 1532 ATOM 15809 O WAT 1533 52.394 37.574 82.770 1.00 0.00 O ATOM 15810 H1 WAT 1533 52.873 37.876 81.997 1.00 0.00 H ATOM 15811 H2 WAT 1533 51.960 38.359 83.104 1.00 0.00 H TER 15813 WAT 1533 ATOM 15813 O WAT 1534 130.986 22.107 25.057 1.00 0.00 O ATOM 15814 H1 WAT 1534 130.658 21.650 24.282 1.00 0.00 H ATOM 15815 H2 WAT 1534 131.509 21.451 25.518 1.00 0.00 H TER 15817 WAT 1534 ATOM 15817 O WAT 1535 0.083 15.345 127.296 1.00 0.00 O ATOM 15818 H1 WAT 1535 0.519 16.099 127.692 1.00 0.00 H ATOM 15819 H2 WAT 1535 -0.160 14.791 128.039 1.00 0.00 H TER 15821 WAT 1535 ATOM 15821 O WAT 1536 90.043 15.123 0.255 1.00 0.00 O ATOM 15822 H1 WAT 1536 89.928 15.055 -0.693 1.00 0.00 H ATOM 15823 H2 WAT 1536 90.110 16.063 0.421 1.00 0.00 H TER 15825 WAT 1536 ATOM 15825 O WAT 1537 46.611 112.551 118.683 1.00 0.00 O ATOM 15826 H1 WAT 1537 47.288 112.785 118.049 1.00 0.00 H ATOM 15827 H2 WAT 1537 46.777 113.124 119.432 1.00 0.00 H TER 15829 WAT 1537 ATOM 15829 O WAT 1538 64.017 72.110 142.358 1.00 0.00 O ATOM 15830 H1 WAT 1538 64.444 72.941 142.566 1.00 0.00 H ATOM 15831 H2 WAT 1538 64.225 71.541 143.099 1.00 0.00 H TER 15833 WAT 1538 ATOM 15833 O WAT 1539 144.912 9.869 71.193 1.00 0.00 O ATOM 15834 H1 WAT 1539 145.331 9.029 71.009 1.00 0.00 H ATOM 15835 H2 WAT 1539 145.248 10.122 72.052 1.00 0.00 H TER 15837 WAT 1539 ATOM 15837 O WAT 1540 31.981 61.126 140.514 1.00 0.00 O ATOM 15838 H1 WAT 1540 31.373 60.405 140.348 1.00 0.00 H ATOM 15839 H2 WAT 1540 31.625 61.859 140.012 1.00 0.00 H TER 15841 WAT 1540 ATOM 15841 O WAT 1541 0.965 85.311 16.200 1.00 0.00 O ATOM 15842 H1 WAT 1541 1.234 84.432 16.469 1.00 0.00 H ATOM 15843 H2 WAT 1541 0.012 85.259 16.131 1.00 0.00 H TER 15845 WAT 1541 ATOM 15845 O WAT 1542 103.293 130.327 79.924 1.00 0.00 O ATOM 15846 H1 WAT 1542 103.530 129.703 80.609 1.00 0.00 H ATOM 15847 H2 WAT 1542 103.215 131.165 80.379 1.00 0.00 H TER 15849 WAT 1542 ATOM 15849 O WAT 1543 75.688 66.655 126.454 1.00 0.00 O ATOM 15850 H1 WAT 1543 75.283 66.210 125.710 1.00 0.00 H ATOM 15851 H2 WAT 1543 76.578 66.852 126.160 1.00 0.00 H TER 15853 WAT 1543 ATOM 15853 O WAT 1544 29.838 42.960 55.689 1.00 0.00 O ATOM 15854 H1 WAT 1544 29.407 43.738 56.042 1.00 0.00 H ATOM 15855 H2 WAT 1544 29.688 43.010 54.745 1.00 0.00 H TER 15857 WAT 1544 ATOM 15857 O WAT 1545 47.156 134.953 15.542 1.00 0.00 O ATOM 15858 H1 WAT 1545 47.226 134.724 16.469 1.00 0.00 H ATOM 15859 H2 WAT 1545 47.911 134.530 15.133 1.00 0.00 H TER 15861 WAT 1545 ATOM 15861 O WAT 1546 122.292 118.105 126.465 1.00 0.00 O ATOM 15862 H1 WAT 1546 121.521 117.699 126.862 1.00 0.00 H ATOM 15863 H2 WAT 1546 121.995 118.976 126.202 1.00 0.00 H TER 15865 WAT 1546 ATOM 15865 O WAT 1547 25.097 17.472 140.730 1.00 0.00 O ATOM 15866 H1 WAT 1547 25.638 17.138 141.446 1.00 0.00 H ATOM 15867 H2 WAT 1547 24.199 17.395 141.053 1.00 0.00 H TER 15869 WAT 1547 ATOM 15869 O WAT 1548 113.540 142.122 143.237 1.00 0.00 O ATOM 15870 H1 WAT 1548 114.353 141.884 143.682 1.00 0.00 H ATOM 15871 H2 WAT 1548 113.617 143.063 143.085 1.00 0.00 H TER 15873 WAT 1548 ATOM 15873 O WAT 1549 87.963 61.791 142.427 1.00 0.00 O ATOM 15874 H1 WAT 1549 88.385 61.906 143.279 1.00 0.00 H ATOM 15875 H2 WAT 1549 87.281 62.463 142.405 1.00 0.00 H TER 15877 WAT 1549 ATOM 15877 O WAT 1550 5.498 19.116 112.321 1.00 0.00 O ATOM 15878 H1 WAT 1550 5.134 18.603 113.043 1.00 0.00 H ATOM 15879 H2 WAT 1550 6.199 18.569 111.967 1.00 0.00 H TER 15881 WAT 1550 ATOM 15881 O WAT 1551 27.430 25.090 154.685 1.00 0.00 O ATOM 15882 H1 WAT 1551 27.841 24.321 154.291 1.00 0.00 H ATOM 15883 H2 WAT 1551 28.095 25.440 155.279 1.00 0.00 H TER 15885 WAT 1551 ATOM 15885 O WAT 1552 97.226 142.140 85.677 1.00 0.00 O ATOM 15886 H1 WAT 1552 97.449 142.748 86.382 1.00 0.00 H ATOM 15887 H2 WAT 1552 96.399 142.471 85.328 1.00 0.00 H TER 15889 WAT 1552 ATOM 15889 O WAT 1553 5.547 134.159 77.394 1.00 0.00 O ATOM 15890 H1 WAT 1553 5.470 133.286 77.777 1.00 0.00 H ATOM 15891 H2 WAT 1553 6.295 134.096 76.800 1.00 0.00 H TER 15893 WAT 1553 ATOM 15893 O WAT 1554 55.678 121.506 83.080 1.00 0.00 O ATOM 15894 H1 WAT 1554 55.614 121.552 84.034 1.00 0.00 H ATOM 15895 H2 WAT 1554 56.515 121.073 82.916 1.00 0.00 H TER 15897 WAT 1554 ATOM 15897 O WAT 1555 110.858 140.038 153.501 1.00 0.00 O ATOM 15898 H1 WAT 1555 111.071 140.364 152.626 1.00 0.00 H ATOM 15899 H2 WAT 1555 110.352 140.743 153.903 1.00 0.00 H TER 15901 WAT 1555 ATOM 15901 O WAT 1556 76.162 47.325 13.879 1.00 0.00 O ATOM 15902 H1 WAT 1556 76.029 46.492 14.332 1.00 0.00 H ATOM 15903 H2 WAT 1556 75.402 47.408 13.303 1.00 0.00 H TER 15905 WAT 1556 ATOM 15905 O WAT 1557 94.606 62.206 128.639 1.00 0.00 O ATOM 15906 H1 WAT 1557 94.257 61.332 128.463 1.00 0.00 H ATOM 15907 H2 WAT 1557 95.420 62.244 128.136 1.00 0.00 H TER 15909 WAT 1557 ATOM 15909 O WAT 1558 9.419 88.487 148.500 1.00 0.00 O ATOM 15910 H1 WAT 1558 9.609 89.417 148.380 1.00 0.00 H ATOM 15911 H2 WAT 1558 9.200 88.172 147.623 1.00 0.00 H TER 15913 WAT 1558 ATOM 15913 O WAT 1559 145.625 30.569 79.452 1.00 0.00 O ATOM 15914 H1 WAT 1559 145.136 31.294 79.063 1.00 0.00 H ATOM 15915 H2 WAT 1559 146.544 30.800 79.316 1.00 0.00 H TER 15917 WAT 1559 ATOM 15917 O WAT 1560 91.252 67.311 112.080 1.00 0.00 O ATOM 15918 H1 WAT 1560 92.111 66.984 111.814 1.00 0.00 H ATOM 15919 H2 WAT 1560 91.042 66.816 112.872 1.00 0.00 H TER 15921 WAT 1560 ATOM 15921 O WAT 1561 134.225 32.447 134.664 1.00 0.00 O ATOM 15922 H1 WAT 1561 134.839 33.134 134.406 1.00 0.00 H ATOM 15923 H2 WAT 1561 134.341 31.763 134.004 1.00 0.00 H TER 15925 WAT 1561 ATOM 15925 O WAT 1562 26.322 7.844 103.750 1.00 0.00 O ATOM 15926 H1 WAT 1562 26.873 7.578 103.014 1.00 0.00 H ATOM 15927 H2 WAT 1562 25.429 7.662 103.458 1.00 0.00 H TER 15929 WAT 1562 ATOM 15929 O WAT 1563 124.036 125.450 142.980 1.00 0.00 O ATOM 15930 H1 WAT 1563 123.308 125.740 142.431 1.00 0.00 H ATOM 15931 H2 WAT 1563 123.926 125.933 143.799 1.00 0.00 H TER 15933 WAT 1563 ATOM 15933 O WAT 1564 49.352 117.262 16.675 1.00 0.00 O ATOM 15934 H1 WAT 1564 49.330 118.204 16.505 1.00 0.00 H ATOM 15935 H2 WAT 1564 48.856 117.154 17.487 1.00 0.00 H TER 15937 WAT 1564 ATOM 15937 O WAT 1565 98.725 138.238 91.715 1.00 0.00 O ATOM 15938 H1 WAT 1565 98.319 138.733 92.426 1.00 0.00 H ATOM 15939 H2 WAT 1565 98.223 138.480 90.937 1.00 0.00 H TER 15941 WAT 1565 ATOM 15941 O WAT 1566 46.658 16.705 71.346 1.00 0.00 O ATOM 15942 H1 WAT 1566 45.912 17.080 71.815 1.00 0.00 H ATOM 15943 H2 WAT 1566 47.117 16.183 72.004 1.00 0.00 H TER 15945 WAT 1566 ATOM 15945 O WAT 1567 119.123 61.190 145.300 1.00 0.00 O ATOM 15946 H1 WAT 1567 120.036 61.471 145.239 1.00 0.00 H ATOM 15947 H2 WAT 1567 119.041 60.830 146.183 1.00 0.00 H TER 15949 WAT 1567 ATOM 15949 O WAT 1568 28.173 77.376 150.986 1.00 0.00 O ATOM 15950 H1 WAT 1568 29.130 77.343 150.960 1.00 0.00 H ATOM 15951 H2 WAT 1568 27.971 77.848 151.793 1.00 0.00 H TER 15953 WAT 1568 ATOM 15953 O WAT 1569 60.802 143.216 4.576 1.00 0.00 O ATOM 15954 H1 WAT 1569 60.185 142.768 5.155 1.00 0.00 H ATOM 15955 H2 WAT 1569 61.464 143.576 5.166 1.00 0.00 H TER 15957 WAT 1569 ATOM 15957 O WAT 1570 102.510 26.473 98.626 1.00 0.00 O ATOM 15958 H1 WAT 1570 102.633 25.637 98.176 1.00 0.00 H ATOM 15959 H2 WAT 1570 102.306 27.093 97.926 1.00 0.00 H TER 15961 WAT 1570 ATOM 15961 O WAT 1571 12.902 138.711 144.261 1.00 0.00 O ATOM 15962 H1 WAT 1571 12.532 138.319 143.470 1.00 0.00 H ATOM 15963 H2 WAT 1571 12.268 139.381 144.516 1.00 0.00 H TER 15965 WAT 1571 ATOM 15965 O WAT 1572 50.995 24.391 114.130 1.00 0.00 O ATOM 15966 H1 WAT 1572 51.784 24.336 114.669 1.00 0.00 H ATOM 15967 H2 WAT 1572 50.806 23.484 113.888 1.00 0.00 H TER 15969 WAT 1572 ATOM 15969 O WAT 1573 75.770 67.919 108.221 1.00 0.00 O ATOM 15970 H1 WAT 1573 74.983 67.516 108.588 1.00 0.00 H ATOM 15971 H2 WAT 1573 75.830 68.769 108.658 1.00 0.00 H TER 15973 WAT 1573 ATOM 15973 O WAT 1574 10.348 123.355 121.672 1.00 0.00 O ATOM 15974 H1 WAT 1574 10.508 124.238 121.339 1.00 0.00 H ATOM 15975 H2 WAT 1574 10.768 122.779 121.034 1.00 0.00 H TER 15977 WAT 1574 ATOM 15977 O WAT 1575 63.474 14.547 51.074 1.00 0.00 O ATOM 15978 H1 WAT 1575 62.547 14.321 51.150 1.00 0.00 H ATOM 15979 H2 WAT 1575 63.478 15.490 50.912 1.00 0.00 H TER 15981 WAT 1575 ATOM 15981 O WAT 1576 144.525 16.002 136.160 1.00 0.00 O ATOM 15982 H1 WAT 1576 145.413 16.268 135.923 1.00 0.00 H ATOM 15983 H2 WAT 1576 144.637 15.159 136.601 1.00 0.00 H TER 15985 WAT 1576 ATOM 15985 O WAT 1577 44.159 128.166 110.795 1.00 0.00 O ATOM 15986 H1 WAT 1577 44.285 128.068 111.738 1.00 0.00 H ATOM 15987 H2 WAT 1577 43.373 127.655 110.603 1.00 0.00 H TER 15989 WAT 1577 ATOM 15989 O WAT 1578 119.610 2.821 96.164 1.00 0.00 O ATOM 15990 H1 WAT 1578 119.785 2.877 97.104 1.00 0.00 H ATOM 15991 H2 WAT 1578 120.361 2.346 95.808 1.00 0.00 H TER 15993 WAT 1578 ATOM 15993 O WAT 1579 120.598 60.225 80.841 1.00 0.00 O ATOM 15994 H1 WAT 1579 119.988 60.877 80.496 1.00 0.00 H ATOM 15995 H2 WAT 1579 121.359 60.280 80.264 1.00 0.00 H TER 15997 WAT 1579 ATOM 15997 O WAT 1580 8.140 16.218 24.745 1.00 0.00 O ATOM 15998 H1 WAT 1580 7.415 16.674 25.174 1.00 0.00 H ATOM 15999 H2 WAT 1580 7.726 15.488 24.286 1.00 0.00 H TER 16001 WAT 1580 ATOM 16001 O WAT 1581 49.052 100.189 147.444 1.00 0.00 O ATOM 16002 H1 WAT 1581 48.103 100.313 147.438 1.00 0.00 H ATOM 16003 H2 WAT 1581 49.370 100.739 146.728 1.00 0.00 H TER 16005 WAT 1581 ATOM 16005 O WAT 1582 40.163 21.780 95.270 1.00 0.00 O ATOM 16006 H1 WAT 1582 40.361 22.615 94.847 1.00 0.00 H ATOM 16007 H2 WAT 1582 40.650 21.807 96.093 1.00 0.00 H TER 16009 WAT 1582 ATOM 16009 O WAT 1583 76.916 22.212 140.504 1.00 0.00 O ATOM 16010 H1 WAT 1583 76.616 23.073 140.210 1.00 0.00 H ATOM 16011 H2 WAT 1583 76.807 22.233 141.455 1.00 0.00 H TER 16013 WAT 1583 ATOM 16013 O WAT 1584 106.600 109.446 6.956 1.00 0.00 O ATOM 16014 H1 WAT 1584 106.301 109.903 6.169 1.00 0.00 H ATOM 16015 H2 WAT 1584 107.197 108.773 6.630 1.00 0.00 H TER 16017 WAT 1584 ATOM 16017 O WAT 1585 109.971 128.859 114.936 1.00 0.00 O ATOM 16018 H1 WAT 1585 109.970 129.176 115.840 1.00 0.00 H ATOM 16019 H2 WAT 1585 110.308 127.965 114.996 1.00 0.00 H TER 16021 WAT 1585 ATOM 16021 O WAT 1586 102.245 32.060 128.998 1.00 0.00 O ATOM 16022 H1 WAT 1586 101.647 32.539 129.570 1.00 0.00 H ATOM 16023 H2 WAT 1586 101.852 31.191 128.913 1.00 0.00 H TER 16025 WAT 1586 ATOM 16025 O WAT 1587 12.734 31.697 0.735 1.00 0.00 O ATOM 16026 H1 WAT 1587 11.949 32.218 0.902 1.00 0.00 H ATOM 16027 H2 WAT 1587 13.274 32.251 0.171 1.00 0.00 H TER 16029 WAT 1587 ATOM 16029 O WAT 1588 87.520 12.824 9.563 1.00 0.00 O ATOM 16030 H1 WAT 1588 87.161 12.683 10.439 1.00 0.00 H ATOM 16031 H2 WAT 1588 87.722 11.945 9.242 1.00 0.00 H TER 16033 WAT 1588 ATOM 16033 O WAT 1589 131.993 130.794 100.546 1.00 0.00 O ATOM 16034 H1 WAT 1589 132.014 129.886 100.243 1.00 0.00 H ATOM 16035 H2 WAT 1589 132.902 131.088 100.483 1.00 0.00 H TER 16037 WAT 1589 ATOM 16037 O WAT 1590 12.047 137.825 18.740 1.00 0.00 O ATOM 16038 H1 WAT 1590 12.716 138.493 18.588 1.00 0.00 H ATOM 16039 H2 WAT 1590 11.617 138.096 19.551 1.00 0.00 H TER 16041 WAT 1590 ATOM 16041 O WAT 1591 133.486 91.879 116.041 1.00 0.00 O ATOM 16042 H1 WAT 1591 132.916 91.981 116.803 1.00 0.00 H ATOM 16043 H2 WAT 1591 133.643 92.774 115.738 1.00 0.00 H TER 16045 WAT 1591 ATOM 16045 O WAT 1592 50.486 128.755 134.436 1.00 0.00 O ATOM 16046 H1 WAT 1592 51.177 129.339 134.750 1.00 0.00 H ATOM 16047 H2 WAT 1592 49.903 129.323 133.933 1.00 0.00 H TER 16049 WAT 1592 ATOM 16049 O WAT 1593 16.600 30.278 123.582 1.00 0.00 O ATOM 16050 H1 WAT 1593 17.339 29.669 123.567 1.00 0.00 H ATOM 16051 H2 WAT 1593 16.214 30.209 122.709 1.00 0.00 H TER 16053 WAT 1593 ATOM 16053 O WAT 1594 22.000 32.429 102.382 1.00 0.00 O ATOM 16054 H1 WAT 1594 22.546 31.886 101.814 1.00 0.00 H ATOM 16055 H2 WAT 1594 21.933 31.932 103.197 1.00 0.00 H TER 16057 WAT 1594 ATOM 16057 O WAT 1595 119.362 101.130 132.930 1.00 0.00 O ATOM 16058 H1 WAT 1595 119.751 100.256 132.966 1.00 0.00 H ATOM 16059 H2 WAT 1595 118.532 101.042 133.399 1.00 0.00 H TER 16061 WAT 1595 ATOM 16061 O WAT 1596 4.544 113.230 109.718 1.00 0.00 O ATOM 16062 H1 WAT 1596 4.949 114.075 109.522 1.00 0.00 H ATOM 16063 H2 WAT 1596 5.077 112.593 109.241 1.00 0.00 H TER 16065 WAT 1596 ATOM 16065 O WAT 1597 99.510 57.717 121.624 1.00 0.00 O ATOM 16066 H1 WAT 1597 98.594 57.929 121.447 1.00 0.00 H ATOM 16067 H2 WAT 1597 99.605 56.808 121.339 1.00 0.00 H TER 16069 WAT 1597 ATOM 16069 O WAT 1598 114.028 36.915 80.759 1.00 0.00 O ATOM 16070 H1 WAT 1598 114.633 37.379 81.338 1.00 0.00 H ATOM 16071 H2 WAT 1598 114.096 37.377 79.923 1.00 0.00 H TER 16073 WAT 1598 ATOM 16073 O WAT 1599 69.141 129.236 141.751 1.00 0.00 O ATOM 16074 H1 WAT 1599 68.818 129.901 142.359 1.00 0.00 H ATOM 16075 H2 WAT 1599 70.052 129.482 141.589 1.00 0.00 H TER 16077 WAT 1599 ATOM 16077 O WAT 1600 122.128 75.803 151.187 1.00 0.00 O ATOM 16078 H1 WAT 1600 122.320 76.711 150.951 1.00 0.00 H ATOM 16079 H2 WAT 1600 121.846 75.397 150.367 1.00 0.00 H TER 16081 WAT 1600 ATOM 16081 O WAT 1601 80.458 77.783 10.771 1.00 0.00 O ATOM 16082 H1 WAT 1601 80.195 78.542 11.292 1.00 0.00 H ATOM 16083 H2 WAT 1601 81.388 77.924 10.595 1.00 0.00 H TER 16085 WAT 1601 ATOM 16085 O WAT 1602 39.417 96.909 1.273 1.00 0.00 O ATOM 16086 H1 WAT 1602 39.747 96.196 1.820 1.00 0.00 H ATOM 16087 H2 WAT 1602 39.255 97.626 1.886 1.00 0.00 H TER 16089 WAT 1602 ATOM 16089 O WAT 1603 45.740 42.092 71.291 1.00 0.00 O ATOM 16090 H1 WAT 1603 46.083 42.122 72.184 1.00 0.00 H ATOM 16091 H2 WAT 1603 44.796 42.210 71.393 1.00 0.00 H TER 16093 WAT 1603 ATOM 16093 O WAT 1604 15.550 145.524 9.036 1.00 0.00 O ATOM 16094 H1 WAT 1604 15.170 144.848 8.476 1.00 0.00 H ATOM 16095 H2 WAT 1604 16.495 145.438 8.909 1.00 0.00 H TER 16097 WAT 1604 ATOM 16097 O WAT 1605 58.480 143.606 53.690 1.00 0.00 O ATOM 16098 H1 WAT 1605 57.672 143.312 53.271 1.00 0.00 H ATOM 16099 H2 WAT 1605 59.003 142.810 53.787 1.00 0.00 H TER 16101 WAT 1605 ATOM 16101 O WAT 1606 20.242 90.503 11.260 1.00 0.00 O ATOM 16102 H1 WAT 1606 21.189 90.368 11.219 1.00 0.00 H ATOM 16103 H2 WAT 1606 20.114 91.074 12.018 1.00 0.00 H TER 16105 WAT 1606 ATOM 16105 O WAT 1607 42.892 36.514 126.573 1.00 0.00 O ATOM 16106 H1 WAT 1607 42.601 36.420 127.480 1.00 0.00 H ATOM 16107 H2 WAT 1607 43.374 37.341 126.561 1.00 0.00 H TER 16109 WAT 1607 ATOM 16109 O WAT 1608 82.690 75.807 133.677 1.00 0.00 O ATOM 16110 H1 WAT 1608 81.862 75.423 133.387 1.00 0.00 H ATOM 16111 H2 WAT 1608 83.303 75.072 133.689 1.00 0.00 H TER 16113 WAT 1608 ATOM 16113 O WAT 1609 47.757 19.894 155.126 1.00 0.00 O ATOM 16114 H1 WAT 1609 46.921 20.346 155.019 1.00 0.00 H ATOM 16115 H2 WAT 1609 47.942 19.950 156.064 1.00 0.00 H TER 16117 WAT 1609 ATOM 16117 O WAT 1610 58.780 126.812 132.988 1.00 0.00 O ATOM 16118 H1 WAT 1610 59.576 126.679 133.504 1.00 0.00 H ATOM 16119 H2 WAT 1610 59.098 127.038 132.113 1.00 0.00 H TER 16121 WAT 1610 ATOM 16121 O WAT 1611 37.676 126.222 148.269 1.00 0.00 O ATOM 16122 H1 WAT 1611 38.012 126.540 149.107 1.00 0.00 H ATOM 16123 H2 WAT 1611 36.918 126.779 148.089 1.00 0.00 H TER 16125 WAT 1611 ATOM 16125 O WAT 1612 128.151 40.719 139.596 1.00 0.00 O ATOM 16126 H1 WAT 1612 128.851 40.149 139.277 1.00 0.00 H ATOM 16127 H2 WAT 1612 127.561 40.133 140.069 1.00 0.00 H TER 16129 WAT 1612 ATOM 16129 O WAT 1613 26.988 74.312 7.982 1.00 0.00 O ATOM 16130 H1 WAT 1613 27.518 75.042 7.661 1.00 0.00 H ATOM 16131 H2 WAT 1613 27.595 73.573 8.015 1.00 0.00 H TER 16133 WAT 1613 ATOM 16133 O WAT 1614 24.144 136.541 101.107 1.00 0.00 O ATOM 16134 H1 WAT 1614 24.706 137.316 101.092 1.00 0.00 H ATOM 16135 H2 WAT 1614 24.582 135.917 100.528 1.00 0.00 H TER 16137 WAT 1614 ATOM 16137 O WAT 1615 120.772 100.842 149.615 1.00 0.00 O ATOM 16138 H1 WAT 1615 120.359 101.670 149.860 1.00 0.00 H ATOM 16139 H2 WAT 1615 121.627 101.095 149.268 1.00 0.00 H TER 16141 WAT 1615 ATOM 16141 O WAT 1616 6.632 67.217 77.838 1.00 0.00 O ATOM 16142 H1 WAT 1616 6.999 66.837 78.636 1.00 0.00 H ATOM 16143 H2 WAT 1616 7.383 67.317 77.253 1.00 0.00 H TER 16145 WAT 1616 ATOM 16145 O WAT 1617 143.329 67.756 87.085 1.00 0.00 O ATOM 16146 H1 WAT 1617 142.522 68.251 87.226 1.00 0.00 H ATOM 16147 H2 WAT 1617 143.247 67.415 86.194 1.00 0.00 H TER 16149 WAT 1617 ATOM 16149 O WAT 1618 112.978 77.171 8.191 1.00 0.00 O ATOM 16150 H1 WAT 1618 112.146 76.737 8.008 1.00 0.00 H ATOM 16151 H2 WAT 1618 112.901 78.027 7.769 1.00 0.00 H TER 16153 WAT 1618 ATOM 16153 O WAT 1619 113.343 115.207 76.173 1.00 0.00 O ATOM 16154 H1 WAT 1619 114.272 115.094 75.974 1.00 0.00 H ATOM 16155 H2 WAT 1619 113.085 115.986 75.679 1.00 0.00 H TER 16157 WAT 1619 ATOM 16157 O WAT 1620 52.228 102.308 77.594 1.00 0.00 O ATOM 16158 H1 WAT 1620 52.859 102.362 76.876 1.00 0.00 H ATOM 16159 H2 WAT 1620 52.065 101.370 77.699 1.00 0.00 H TER 16161 WAT 1620 ATOM 16161 O WAT 1621 70.271 41.873 74.119 1.00 0.00 O ATOM 16162 H1 WAT 1621 69.997 42.467 73.420 1.00 0.00 H ATOM 16163 H2 WAT 1621 71.145 41.584 73.859 1.00 0.00 H TER 16165 WAT 1621 ATOM 16165 O WAT 1622 17.703 131.023 155.853 1.00 0.00 O ATOM 16166 H1 WAT 1622 16.885 131.518 155.879 1.00 0.00 H ATOM 16167 H2 WAT 1622 17.513 130.275 155.286 1.00 0.00 H TER 16169 WAT 1622 ATOM 16169 O WAT 1623 37.335 99.393 98.577 1.00 0.00 O ATOM 16170 H1 WAT 1623 37.147 100.318 98.738 1.00 0.00 H ATOM 16171 H2 WAT 1623 37.262 98.980 99.437 1.00 0.00 H TER 16173 WAT 1623 ATOM 16173 O WAT 1624 47.178 50.110 88.107 1.00 0.00 O ATOM 16174 H1 WAT 1624 47.793 49.971 87.386 1.00 0.00 H ATOM 16175 H2 WAT 1624 47.736 50.254 88.872 1.00 0.00 H TER 16177 WAT 1624 ATOM 16177 O WAT 1625 58.866 113.683 102.953 1.00 0.00 O ATOM 16178 H1 WAT 1625 58.721 112.770 103.202 1.00 0.00 H ATOM 16179 H2 WAT 1625 59.499 113.638 102.237 1.00 0.00 H TER 16181 WAT 1625 ATOM 16181 O WAT 1626 119.662 47.482 68.055 1.00 0.00 O ATOM 16182 H1 WAT 1626 119.559 47.927 67.214 1.00 0.00 H ATOM 16183 H2 WAT 1626 120.498 47.021 67.981 1.00 0.00 H TER 16185 WAT 1626 ATOM 16185 O WAT 1627 47.043 128.095 148.059 1.00 0.00 O ATOM 16186 H1 WAT 1627 47.603 127.331 148.197 1.00 0.00 H ATOM 16187 H2 WAT 1627 46.164 127.733 147.952 1.00 0.00 H TER 16189 WAT 1627 ATOM 16189 O WAT 1628 110.108 99.935 99.791 1.00 0.00 O ATOM 16190 H1 WAT 1628 109.933 100.723 99.278 1.00 0.00 H ATOM 16191 H2 WAT 1628 109.367 99.358 99.606 1.00 0.00 H TER 16193 WAT 1628 ATOM 16193 O WAT 1629 57.003 19.142 133.709 1.00 0.00 O ATOM 16194 H1 WAT 1629 56.736 19.506 134.552 1.00 0.00 H ATOM 16195 H2 WAT 1629 57.313 19.897 133.209 1.00 0.00 H TER 16197 WAT 1629 ATOM 16197 O WAT 1630 17.619 30.671 88.841 1.00 0.00 O ATOM 16198 H1 WAT 1630 18.191 30.981 89.544 1.00 0.00 H ATOM 16199 H2 WAT 1630 16.813 31.176 88.949 1.00 0.00 H TER 16201 WAT 1630 ATOM 16201 O WAT 1631 42.632 46.790 95.920 1.00 0.00 O ATOM 16202 H1 WAT 1631 42.844 46.979 95.006 1.00 0.00 H ATOM 16203 H2 WAT 1631 41.683 46.905 95.973 1.00 0.00 H TER 16205 WAT 1631 ATOM 16205 O WAT 1632 29.009 42.558 138.968 1.00 0.00 O ATOM 16206 H1 WAT 1632 29.207 41.712 139.370 1.00 0.00 H ATOM 16207 H2 WAT 1632 29.557 43.183 139.443 1.00 0.00 H TER 16209 WAT 1632 ATOM 16209 O WAT 1633 90.085 91.968 67.523 1.00 0.00 O ATOM 16210 H1 WAT 1633 90.534 92.811 67.473 1.00 0.00 H ATOM 16211 H2 WAT 1633 90.365 91.597 68.360 1.00 0.00 H TER 16213 WAT 1633 ATOM 16213 O WAT 1634 24.987 103.096 26.248 1.00 0.00 O ATOM 16214 H1 WAT 1634 24.363 102.894 26.946 1.00 0.00 H ATOM 16215 H2 WAT 1634 25.824 103.205 26.699 1.00 0.00 H TER 16217 WAT 1634 ATOM 16217 O WAT 1635 68.950 15.471 129.958 1.00 0.00 O ATOM 16218 H1 WAT 1635 68.497 16.279 130.200 1.00 0.00 H ATOM 16219 H2 WAT 1635 69.277 15.122 130.787 1.00 0.00 H TER 16221 WAT 1635 ATOM 16221 O WAT 1636 35.201 6.937 125.265 1.00 0.00 O ATOM 16222 H1 WAT 1636 34.632 7.326 124.601 1.00 0.00 H ATOM 16223 H2 WAT 1636 35.781 6.356 124.773 1.00 0.00 H TER 16225 WAT 1636 ATOM 16225 O WAT 1637 0.013 123.361 61.280 1.00 0.00 O ATOM 16226 H1 WAT 1637 -0.209 124.271 61.086 1.00 0.00 H ATOM 16227 H2 WAT 1637 0.262 123.367 62.204 1.00 0.00 H TER 16229 WAT 1637 ATOM 16229 O WAT 1638 85.716 1.299 146.369 1.00 0.00 O ATOM 16230 H1 WAT 1638 85.250 1.365 145.536 1.00 0.00 H ATOM 16231 H2 WAT 1638 85.673 2.181 146.738 1.00 0.00 H TER 16233 WAT 1638 ATOM 16233 O WAT 1639 51.382 31.121 144.508 1.00 0.00 O ATOM 16234 H1 WAT 1639 51.677 30.499 143.843 1.00 0.00 H ATOM 16235 H2 WAT 1639 51.214 30.583 145.282 1.00 0.00 H TER 16237 WAT 1639 ATOM 16237 O WAT 1640 108.141 69.137 115.712 1.00 0.00 O ATOM 16238 H1 WAT 1640 108.006 68.393 115.125 1.00 0.00 H ATOM 16239 H2 WAT 1640 108.576 68.761 116.478 1.00 0.00 H TER 16241 WAT 1640 ATOM 16241 O WAT 1641 106.910 102.718 107.090 1.00 0.00 O ATOM 16242 H1 WAT 1641 106.845 102.800 106.139 1.00 0.00 H ATOM 16243 H2 WAT 1641 106.641 101.818 107.273 1.00 0.00 H TER 16245 WAT 1641 ATOM 16245 O WAT 1642 138.652 66.894 4.967 1.00 0.00 O ATOM 16246 H1 WAT 1642 138.217 67.578 4.458 1.00 0.00 H ATOM 16247 H2 WAT 1642 138.598 67.199 5.873 1.00 0.00 H TER 16249 WAT 1642 ATOM 16249 O WAT 1643 29.262 51.422 115.787 1.00 0.00 O ATOM 16250 H1 WAT 1643 29.531 52.324 115.614 1.00 0.00 H ATOM 16251 H2 WAT 1643 28.872 51.452 116.661 1.00 0.00 H TER 16253 WAT 1643 ATOM 16253 O WAT 1644 12.171 41.804 102.815 1.00 0.00 O ATOM 16254 H1 WAT 1644 12.766 41.926 102.074 1.00 0.00 H ATOM 16255 H2 WAT 1644 11.545 42.523 102.740 1.00 0.00 H TER 16257 WAT 1644 ATOM 16257 O WAT 1645 111.645 11.456 74.704 1.00 0.00 O ATOM 16258 H1 WAT 1645 112.495 11.226 74.329 1.00 0.00 H ATOM 16259 H2 WAT 1645 111.329 10.642 75.096 1.00 0.00 H TER 16261 WAT 1645 ATOM 16261 O WAT 1646 132.642 58.152 84.125 1.00 0.00 O ATOM 16262 H1 WAT 1646 131.797 57.990 83.707 1.00 0.00 H ATOM 16263 H2 WAT 1646 132.728 57.451 84.772 1.00 0.00 H TER 16265 WAT 1646 ATOM 16265 O WAT 1647 61.095 13.903 156.732 1.00 0.00 O ATOM 16266 H1 WAT 1647 60.775 14.285 155.914 1.00 0.00 H ATOM 16267 H2 WAT 1647 62.049 13.934 156.653 1.00 0.00 H TER 16269 WAT 1647 ATOM 16269 O WAT 1648 51.018 25.209 141.678 1.00 0.00 O ATOM 16270 H1 WAT 1648 50.127 25.332 142.007 1.00 0.00 H ATOM 16271 H2 WAT 1648 51.570 25.678 142.303 1.00 0.00 H TER 16273 WAT 1648 ATOM 16273 O WAT 1649 19.427 85.548 116.930 1.00 0.00 O ATOM 16274 H1 WAT 1649 18.634 85.095 116.642 1.00 0.00 H ATOM 16275 H2 WAT 1649 19.140 86.090 117.665 1.00 0.00 H TER 16277 WAT 1649 ATOM 16277 O WAT 1650 3.873 98.000 135.286 1.00 0.00 O ATOM 16278 H1 WAT 1650 4.630 97.416 135.333 1.00 0.00 H ATOM 16279 H2 WAT 1650 3.179 97.462 134.904 1.00 0.00 H TER 16281 WAT 1650 ATOM 16281 O WAT 1651 3.100 35.186 16.382 1.00 0.00 O ATOM 16282 H1 WAT 1651 4.038 35.000 16.333 1.00 0.00 H ATOM 16283 H2 WAT 1651 2.953 35.436 17.294 1.00 0.00 H TER 16285 WAT 1651 ATOM 16285 O WAT 1652 48.038 123.326 108.680 1.00 0.00 O ATOM 16286 H1 WAT 1652 47.119 123.324 108.411 1.00 0.00 H ATOM 16287 H2 WAT 1652 48.309 124.241 108.599 1.00 0.00 H TER 16289 WAT 1652 ATOM 16289 O WAT 1653 144.800 55.855 108.136 1.00 0.00 O ATOM 16290 H1 WAT 1653 144.770 55.161 107.478 1.00 0.00 H ATOM 16291 H2 WAT 1653 145.520 55.604 108.716 1.00 0.00 H TER 16293 WAT 1653 ATOM 16293 O WAT 1654 143.403 134.204 75.591 1.00 0.00 O ATOM 16294 H1 WAT 1654 143.909 134.845 75.092 1.00 0.00 H ATOM 16295 H2 WAT 1654 142.505 134.535 75.565 1.00 0.00 H TER 16297 WAT 1654 ATOM 16297 O WAT 1655 53.711 145.607 89.152 1.00 0.00 O ATOM 16298 H1 WAT 1655 53.654 144.663 89.297 1.00 0.00 H ATOM 16299 H2 WAT 1655 52.945 145.813 88.615 1.00 0.00 H TER 16301 WAT 1655 ATOM 16301 O WAT 1656 75.320 48.068 126.121 1.00 0.00 O ATOM 16302 H1 WAT 1656 75.190 47.845 127.042 1.00 0.00 H ATOM 16303 H2 WAT 1656 76.187 47.721 125.910 1.00 0.00 H TER 16305 WAT 1656 ATOM 16305 O WAT 1657 64.903 26.385 132.752 1.00 0.00 O ATOM 16306 H1 WAT 1657 65.469 26.590 133.496 1.00 0.00 H ATOM 16307 H2 WAT 1657 65.159 27.012 132.076 1.00 0.00 H TER 16309 WAT 1657 ATOM 16309 O WAT 1658 70.991 11.881 97.354 1.00 0.00 O ATOM 16310 H1 WAT 1658 71.750 11.692 96.802 1.00 0.00 H ATOM 16311 H2 WAT 1658 70.534 11.043 97.428 1.00 0.00 H TER 16313 WAT 1658 ATOM 16313 O WAT 1659 110.017 77.441 -0.018 1.00 0.00 O ATOM 16314 H1 WAT 1659 110.810 77.863 -0.348 1.00 0.00 H ATOM 16315 H2 WAT 1659 109.872 77.841 0.840 1.00 0.00 H TER 16317 WAT 1659 ATOM 16317 O WAT 1660 68.488 67.350 118.485 1.00 0.00 O ATOM 16318 H1 WAT 1660 69.225 66.866 118.111 1.00 0.00 H ATOM 16319 H2 WAT 1660 67.915 66.672 118.844 1.00 0.00 H TER 16321 WAT 1660 ATOM 16321 O WAT 1661 2.948 107.613 99.062 1.00 0.00 O ATOM 16322 H1 WAT 1661 3.431 107.878 98.279 1.00 0.00 H ATOM 16323 H2 WAT 1661 3.593 107.145 99.593 1.00 0.00 H TER 16325 WAT 1661 ATOM 16325 O WAT 1662 22.702 81.982 80.129 1.00 0.00 O ATOM 16326 H1 WAT 1662 23.458 82.193 80.676 1.00 0.00 H ATOM 16327 H2 WAT 1662 22.256 82.819 80.002 1.00 0.00 H TER 16329 WAT 1662 ATOM 16329 O WAT 1663 131.110 76.144 117.984 1.00 0.00 O ATOM 16330 H1 WAT 1663 130.355 76.583 117.593 1.00 0.00 H ATOM 16331 H2 WAT 1663 131.565 75.744 117.243 1.00 0.00 H TER 16333 WAT 1663 ATOM 16333 O WAT 1664 8.059 46.213 76.499 1.00 0.00 O ATOM 16334 H1 WAT 1664 8.645 46.883 76.147 1.00 0.00 H ATOM 16335 H2 WAT 1664 7.661 45.813 75.726 1.00 0.00 H TER 16337 WAT 1664 ATOM 16337 O WAT 1665 145.924 140.510 157.301 1.00 0.00 O ATOM 16338 H1 WAT 1665 145.306 139.965 156.813 1.00 0.00 H ATOM 16339 H2 WAT 1665 145.855 141.373 156.893 1.00 0.00 H TER 16341 WAT 1665 ATOM 16341 O WAT 1666 135.697 5.933 131.677 1.00 0.00 O ATOM 16342 H1 WAT 1666 135.167 6.728 131.631 1.00 0.00 H ATOM 16343 H2 WAT 1666 135.589 5.523 130.819 1.00 0.00 H TER 16345 WAT 1666 ATOM 16345 O WAT 1667 124.903 88.485 101.478 1.00 0.00 O ATOM 16346 H1 WAT 1667 125.444 89.088 101.988 1.00 0.00 H ATOM 16347 H2 WAT 1667 125.000 87.642 101.922 1.00 0.00 H TER 16349 WAT 1667 ATOM 16349 O WAT 1668 66.189 104.006 6.232 1.00 0.00 O ATOM 16350 H1 WAT 1668 66.928 104.293 6.768 1.00 0.00 H ATOM 16351 H2 WAT 1668 66.188 103.053 6.317 1.00 0.00 H TER 16353 WAT 1668 ATOM 16353 O WAT 1669 144.569 5.935 73.396 1.00 0.00 O ATOM 16354 H1 WAT 1669 145.126 6.711 73.332 1.00 0.00 H ATOM 16355 H2 WAT 1669 143.684 6.283 73.504 1.00 0.00 H TER 16357 WAT 1669 ATOM 16357 O WAT 1670 10.457 72.141 120.413 1.00 0.00 O ATOM 16358 H1 WAT 1670 10.806 71.637 119.677 1.00 0.00 H ATOM 16359 H2 WAT 1670 9.921 71.514 120.899 1.00 0.00 H TER 16361 WAT 1670 ATOM 16361 O WAT 1671 141.187 122.949 10.282 1.00 0.00 O ATOM 16362 H1 WAT 1671 141.341 122.947 11.226 1.00 0.00 H ATOM 16363 H2 WAT 1671 141.995 123.303 9.909 1.00 0.00 H TER 16365 WAT 1671 ATOM 16365 O WAT 1672 111.600 96.107 137.212 1.00 0.00 O ATOM 16366 H1 WAT 1672 110.791 96.477 137.565 1.00 0.00 H ATOM 16367 H2 WAT 1672 112.286 96.430 137.796 1.00 0.00 H TER 16369 WAT 1672 ATOM 16369 O WAT 1673 23.374 11.420 94.327 1.00 0.00 O ATOM 16370 H1 WAT 1673 23.137 11.196 93.427 1.00 0.00 H ATOM 16371 H2 WAT 1673 24.139 10.875 94.515 1.00 0.00 H TER 16373 WAT 1673 ATOM 16373 O WAT 1674 40.390 134.183 53.661 1.00 0.00 O ATOM 16374 H1 WAT 1674 41.183 133.963 53.173 1.00 0.00 H ATOM 16375 H2 WAT 1674 39.848 133.396 53.604 1.00 0.00 H TER 16377 WAT 1674 ATOM 16377 O WAT 1675 112.527 7.445 131.167 1.00 0.00 O ATOM 16378 H1 WAT 1675 111.814 7.613 130.550 1.00 0.00 H ATOM 16379 H2 WAT 1675 112.196 7.765 132.006 1.00 0.00 H TER 16381 WAT 1675 ATOM 16381 O WAT 1676 122.302 1.726 8.761 1.00 0.00 O ATOM 16382 H1 WAT 1676 122.050 2.561 8.365 1.00 0.00 H ATOM 16383 H2 WAT 1676 122.957 1.366 8.163 1.00 0.00 H TER 16385 WAT 1676 ATOM 16385 O WAT 1677 119.478 13.349 157.012 1.00 0.00 O ATOM 16386 H1 WAT 1677 119.429 14.214 156.603 1.00 0.00 H ATOM 16387 H2 WAT 1677 119.491 12.737 156.276 1.00 0.00 H TER 16389 WAT 1677 ATOM 16389 O WAT 1678 82.882 52.552 81.072 1.00 0.00 O ATOM 16390 H1 WAT 1678 83.798 52.745 80.872 1.00 0.00 H ATOM 16391 H2 WAT 1678 82.413 53.354 80.845 1.00 0.00 H TER 16393 WAT 1678 ATOM 16393 O WAT 1679 130.485 22.880 55.458 1.00 0.00 O ATOM 16394 H1 WAT 1679 130.367 22.336 56.236 1.00 0.00 H ATOM 16395 H2 WAT 1679 129.605 22.965 55.090 1.00 0.00 H TER 16397 WAT 1679 ATOM 16397 O WAT 1680 61.681 81.788 74.160 1.00 0.00 O ATOM 16398 H1 WAT 1680 60.974 81.854 73.517 1.00 0.00 H ATOM 16399 H2 WAT 1680 61.899 82.695 74.370 1.00 0.00 H TER 16401 WAT 1680 ATOM 16401 O WAT 1681 3.754 109.348 108.511 1.00 0.00 O ATOM 16402 H1 WAT 1681 4.332 110.096 108.365 1.00 0.00 H ATOM 16403 H2 WAT 1681 2.904 109.633 108.176 1.00 0.00 H TER 16405 WAT 1681 ATOM 16405 O WAT 1682 117.321 15.358 5.170 1.00 0.00 O ATOM 16406 H1 WAT 1682 117.223 16.300 5.311 1.00 0.00 H ATOM 16407 H2 WAT 1682 116.861 14.956 5.906 1.00 0.00 H TER 16409 WAT 1682 ATOM 16409 O WAT 1683 36.892 134.803 69.166 1.00 0.00 O ATOM 16410 H1 WAT 1683 37.379 134.511 69.937 1.00 0.00 H ATOM 16411 H2 WAT 1683 37.563 135.138 68.572 1.00 0.00 H TER 16413 WAT 1683 ATOM 16413 O WAT 1684 74.206 82.495 60.038 1.00 0.00 O ATOM 16414 H1 WAT 1684 74.589 83.300 59.691 1.00 0.00 H ATOM 16415 H2 WAT 1684 74.294 81.861 59.325 1.00 0.00 H TER 16417 WAT 1684 ATOM 16417 O WAT 1685 90.996 133.720 124.232 1.00 0.00 O ATOM 16418 H1 WAT 1685 90.769 132.948 124.751 1.00 0.00 H ATOM 16419 H2 WAT 1685 90.465 134.424 124.605 1.00 0.00 H TER 16421 WAT 1685 ATOM 16421 O WAT 1686 140.011 26.290 15.484 1.00 0.00 O ATOM 16422 H1 WAT 1686 139.677 26.406 16.373 1.00 0.00 H ATOM 16423 H2 WAT 1686 140.944 26.494 15.550 1.00 0.00 H TER 16425 WAT 1686 ATOM 16425 O WAT 1687 123.794 133.704 137.621 1.00 0.00 O ATOM 16426 H1 WAT 1687 123.841 134.036 136.724 1.00 0.00 H ATOM 16427 H2 WAT 1687 122.858 133.599 137.789 1.00 0.00 H TER 16429 WAT 1687 ATOM 16429 O WAT 1688 17.791 131.791 120.844 1.00 0.00 O ATOM 16430 H1 WAT 1688 18.533 132.158 120.363 1.00 0.00 H ATOM 16431 H2 WAT 1688 18.066 131.810 121.761 1.00 0.00 H TER 16433 WAT 1688 ATOM 16433 O WAT 1689 67.977 100.723 79.417 1.00 0.00 O ATOM 16434 H1 WAT 1689 68.188 101.442 78.821 1.00 0.00 H ATOM 16435 H2 WAT 1689 68.616 100.804 80.125 1.00 0.00 H TER 16437 WAT 1689 ATOM 16437 O WAT 1690 109.605 131.796 11.710 1.00 0.00 O ATOM 16438 H1 WAT 1690 110.492 131.453 11.602 1.00 0.00 H ATOM 16439 H2 WAT 1690 109.529 131.975 12.647 1.00 0.00 H TER 16441 WAT 1690 ATOM 16441 O WAT 1691 122.499 18.366 118.315 1.00 0.00 O ATOM 16442 H1 WAT 1691 122.693 17.439 118.457 1.00 0.00 H ATOM 16443 H2 WAT 1691 121.675 18.366 117.828 1.00 0.00 H TER 16445 WAT 1691 ATOM 16445 O WAT 1692 28.708 43.796 114.833 1.00 0.00 O ATOM 16446 H1 WAT 1692 28.632 42.842 114.800 1.00 0.00 H ATOM 16447 H2 WAT 1692 29.273 44.017 114.093 1.00 0.00 H TER 16449 WAT 1692 ATOM 16449 O WAT 1693 2.162 135.628 115.383 1.00 0.00 O ATOM 16450 H1 WAT 1693 1.427 135.370 114.827 1.00 0.00 H ATOM 16451 H2 WAT 1693 2.806 135.990 114.775 1.00 0.00 H TER 16453 WAT 1693 ATOM 16453 O WAT 1694 61.020 137.449 76.732 1.00 0.00 O ATOM 16454 H1 WAT 1694 60.247 137.185 77.231 1.00 0.00 H ATOM 16455 H2 WAT 1694 61.760 137.193 77.283 1.00 0.00 H TER 16457 WAT 1694 ATOM 16457 O WAT 1695 64.199 21.098 99.148 1.00 0.00 O ATOM 16458 H1 WAT 1695 65.142 20.993 99.022 1.00 0.00 H ATOM 16459 H2 WAT 1695 64.039 22.030 99.001 1.00 0.00 H TER 16461 WAT 1695 ATOM 16461 O WAT 1696 92.246 107.582 104.023 1.00 0.00 O ATOM 16462 H1 WAT 1696 91.911 107.308 103.170 1.00 0.00 H ATOM 16463 H2 WAT 1696 93.139 107.238 104.051 1.00 0.00 H TER 16465 WAT 1696 ATOM 16465 O WAT 1697 50.412 37.664 131.742 1.00 0.00 O ATOM 16466 H1 WAT 1697 51.058 37.502 132.429 1.00 0.00 H ATOM 16467 H2 WAT 1697 50.635 37.041 131.050 1.00 0.00 H TER 16469 WAT 1697 ATOM 16469 O WAT 1698 54.368 24.095 144.767 1.00 0.00 O ATOM 16470 H1 WAT 1698 54.530 24.352 145.675 1.00 0.00 H ATOM 16471 H2 WAT 1698 54.056 23.192 144.826 1.00 0.00 H TER 16473 WAT 1698 ATOM 16473 O WAT 1699 91.707 54.132 149.863 1.00 0.00 O ATOM 16474 H1 WAT 1699 91.798 53.180 149.832 1.00 0.00 H ATOM 16475 H2 WAT 1699 91.458 54.320 150.768 1.00 0.00 H TER 16477 WAT 1699 ATOM 16477 O WAT 1700 26.418 113.992 104.726 1.00 0.00 O ATOM 16478 H1 WAT 1700 26.790 114.863 104.585 1.00 0.00 H ATOM 16479 H2 WAT 1700 25.981 113.782 103.900 1.00 0.00 H TER 16481 WAT 1700 ATOM 16481 O WAT 1701 56.815 27.261 133.315 1.00 0.00 O ATOM 16482 H1 WAT 1701 57.707 27.547 133.115 1.00 0.00 H ATOM 16483 H2 WAT 1701 56.344 27.349 132.487 1.00 0.00 H TER 16485 WAT 1701 ATOM 16485 O WAT 1702 3.742 11.946 7.372 1.00 0.00 O ATOM 16486 H1 WAT 1702 3.887 11.342 8.100 1.00 0.00 H ATOM 16487 H2 WAT 1702 3.641 12.802 7.788 1.00 0.00 H TER 16489 WAT 1702 ATOM 16489 O WAT 1703 42.576 35.397 151.521 1.00 0.00 O ATOM 16490 H1 WAT 1703 42.052 34.599 151.600 1.00 0.00 H ATOM 16491 H2 WAT 1703 43.337 35.239 152.080 1.00 0.00 H TER 16493 WAT 1703 ATOM 16493 O WAT 1704 57.155 42.314 8.815 1.00 0.00 O ATOM 16494 H1 WAT 1704 56.319 42.407 9.274 1.00 0.00 H ATOM 16495 H2 WAT 1704 57.727 41.877 9.447 1.00 0.00 H TER 16497 WAT 1704 ATOM 16497 O WAT 1705 136.069 53.599 13.348 1.00 0.00 O ATOM 16498 H1 WAT 1705 135.131 53.490 13.188 1.00 0.00 H ATOM 16499 H2 WAT 1705 136.157 53.553 14.300 1.00 0.00 H TER 16501 WAT 1705 ATOM 16501 O WAT 1706 36.291 98.688 94.592 1.00 0.00 O ATOM 16502 H1 WAT 1706 36.991 98.744 95.243 1.00 0.00 H ATOM 16503 H2 WAT 1706 36.449 97.859 94.141 1.00 0.00 H TER 16505 WAT 1706 ATOM 16505 O WAT 1707 21.189 61.510 98.196 1.00 0.00 O ATOM 16506 H1 WAT 1707 20.736 61.502 97.353 1.00 0.00 H ATOM 16507 H2 WAT 1707 21.045 60.634 98.554 1.00 0.00 H TER 16509 WAT 1707 ATOM 16509 O WAT 1708 119.454 58.660 2.880 1.00 0.00 O ATOM 16510 H1 WAT 1708 120.077 59.386 2.910 1.00 0.00 H ATOM 16511 H2 WAT 1708 119.292 58.445 3.799 1.00 0.00 H TER 16513 WAT 1708 ATOM 16513 O WAT 1709 104.488 91.049 145.809 1.00 0.00 O ATOM 16514 H1 WAT 1709 104.819 90.181 146.040 1.00 0.00 H ATOM 16515 H2 WAT 1709 105.257 91.617 145.853 1.00 0.00 H TER 16517 WAT 1709 ATOM 16517 O WAT 1710 48.911 53.054 23.437 1.00 0.00 O ATOM 16518 H1 WAT 1710 49.066 53.416 24.310 1.00 0.00 H ATOM 16519 H2 WAT 1710 48.008 52.739 23.465 1.00 0.00 H TER 16521 WAT 1710 ATOM 16521 O WAT 1711 61.009 129.834 119.741 1.00 0.00 O ATOM 16522 H1 WAT 1711 61.896 129.546 119.956 1.00 0.00 H ATOM 16523 H2 WAT 1711 60.900 130.654 120.223 1.00 0.00 H TER 16525 WAT 1711 ATOM 16525 O WAT 1712 13.016 86.709 130.127 1.00 0.00 O ATOM 16526 H1 WAT 1712 13.236 86.720 131.058 1.00 0.00 H ATOM 16527 H2 WAT 1712 12.064 86.618 130.106 1.00 0.00 H TER 16529 WAT 1712 ATOM 16529 O WAT 1713 32.885 105.485 83.506 1.00 0.00 O ATOM 16530 H1 WAT 1713 32.365 106.257 83.728 1.00 0.00 H ATOM 16531 H2 WAT 1713 33.761 105.828 83.330 1.00 0.00 H TER 16533 WAT 1713 ATOM 16533 O WAT 1714 98.756 69.217 104.093 1.00 0.00 O ATOM 16534 H1 WAT 1714 99.132 69.418 103.237 1.00 0.00 H ATOM 16535 H2 WAT 1714 98.965 69.979 104.632 1.00 0.00 H TER 16537 WAT 1714 ATOM 16537 O WAT 1715 21.185 22.679 143.689 1.00 0.00 O ATOM 16538 H1 WAT 1715 20.305 22.520 144.030 1.00 0.00 H ATOM 16539 H2 WAT 1715 21.083 22.647 142.738 1.00 0.00 H TER 16541 WAT 1715 ATOM 16541 O WAT 1716 26.005 98.024 24.578 1.00 0.00 O ATOM 16542 H1 WAT 1716 26.564 98.633 25.061 1.00 0.00 H ATOM 16543 H2 WAT 1716 25.432 98.586 24.057 1.00 0.00 H TER 16545 WAT 1716 ATOM 16545 O WAT 1717 71.218 124.054 141.300 1.00 0.00 O ATOM 16546 H1 WAT 1717 71.138 123.130 141.537 1.00 0.00 H ATOM 16547 H2 WAT 1717 71.237 124.515 142.139 1.00 0.00 H TER 16549 WAT 1717 ATOM 16549 O WAT 1718 113.832 59.370 113.425 1.00 0.00 O ATOM 16550 H1 WAT 1718 112.984 59.724 113.156 1.00 0.00 H ATOM 16551 H2 WAT 1718 114.464 60.041 113.166 1.00 0.00 H TER 16553 WAT 1718 ATOM 16553 O WAT 1719 128.278 95.354 115.178 1.00 0.00 O ATOM 16554 H1 WAT 1719 127.474 95.784 115.469 1.00 0.00 H ATOM 16555 H2 WAT 1719 128.493 94.745 115.884 1.00 0.00 H TER 16557 WAT 1719 ATOM 16557 O WAT 1720 104.298 38.095 135.779 1.00 0.00 O ATOM 16558 H1 WAT 1720 103.856 37.363 136.208 1.00 0.00 H ATOM 16559 H2 WAT 1720 105.224 37.852 135.785 1.00 0.00 H TER 16561 WAT 1720 ATOM 16561 O WAT 1721 92.051 34.938 12.901 1.00 0.00 O ATOM 16562 H1 WAT 1721 91.532 34.134 12.899 1.00 0.00 H ATOM 16563 H2 WAT 1721 92.066 35.217 11.986 1.00 0.00 H TER 16565 WAT 1721 ATOM 16565 O WAT 1722 13.027 128.651 0.676 1.00 0.00 O ATOM 16566 H1 WAT 1722 12.226 128.248 0.341 1.00 0.00 H ATOM 16567 H2 WAT 1722 13.515 127.926 1.066 1.00 0.00 H TER 16569 WAT 1722 ATOM 16569 O WAT 1723 17.459 94.404 157.353 1.00 0.00 O ATOM 16570 H1 WAT 1723 18.265 94.150 156.904 1.00 0.00 H ATOM 16571 H2 WAT 1723 17.119 93.587 157.717 1.00 0.00 H TER 16573 WAT 1723 ATOM 16573 O WAT 1724 8.228 134.329 81.660 1.00 0.00 O ATOM 16574 H1 WAT 1724 7.271 134.316 81.641 1.00 0.00 H ATOM 16575 H2 WAT 1724 8.481 134.562 80.767 1.00 0.00 H TER 16577 WAT 1724 ATOM 16577 O WAT 1725 127.584 23.731 130.092 1.00 0.00 O ATOM 16578 H1 WAT 1725 127.516 24.601 130.485 1.00 0.00 H ATOM 16579 H2 WAT 1725 127.450 23.881 129.156 1.00 0.00 H TER 16581 WAT 1725 ATOM 16581 O WAT 1726 129.772 13.586 141.040 1.00 0.00 O ATOM 16582 H1 WAT 1726 129.395 13.570 141.919 1.00 0.00 H ATOM 16583 H2 WAT 1726 129.156 13.085 140.505 1.00 0.00 H TER 16585 WAT 1726 ATOM 16585 O WAT 1727 113.841 103.384 68.325 1.00 0.00 O ATOM 16586 H1 WAT 1727 113.971 103.840 69.157 1.00 0.00 H ATOM 16587 H2 WAT 1727 112.903 103.195 68.300 1.00 0.00 H TER 16589 WAT 1727 ATOM 16589 O WAT 1728 24.221 108.466 125.795 1.00 0.00 O ATOM 16590 H1 WAT 1728 23.446 109.025 125.851 1.00 0.00 H ATOM 16591 H2 WAT 1728 24.734 108.839 125.078 1.00 0.00 H TER 16593 WAT 1728 ATOM 16593 O WAT 1729 104.192 37.316 74.619 1.00 0.00 O ATOM 16594 H1 WAT 1729 104.470 36.400 74.600 1.00 0.00 H ATOM 16595 H2 WAT 1729 103.408 37.317 75.168 1.00 0.00 H TER 16597 WAT 1729 ATOM 16597 O WAT 1730 72.244 98.906 76.571 1.00 0.00 O ATOM 16598 H1 WAT 1730 72.362 98.719 77.502 1.00 0.00 H ATOM 16599 H2 WAT 1730 71.304 99.058 76.475 1.00 0.00 H TER 16601 WAT 1730 ATOM 16601 O WAT 1731 143.930 114.017 120.491 1.00 0.00 O ATOM 16602 H1 WAT 1731 143.410 113.529 119.852 1.00 0.00 H ATOM 16603 H2 WAT 1731 143.996 114.898 120.124 1.00 0.00 H TER 16605 WAT 1731 ATOM 16605 O WAT 1732 124.788 48.958 116.629 1.00 0.00 O ATOM 16606 H1 WAT 1732 123.861 48.729 116.566 1.00 0.00 H ATOM 16607 H2 WAT 1732 125.103 48.475 117.393 1.00 0.00 H TER 16609 WAT 1732 ATOM 16609 O WAT 1733 96.197 58.463 13.736 1.00 0.00 O ATOM 16610 H1 WAT 1733 95.940 59.000 14.485 1.00 0.00 H ATOM 16611 H2 WAT 1733 95.909 57.579 13.965 1.00 0.00 H TER 16613 WAT 1733 ATOM 16613 O WAT 1734 107.671 124.886 156.147 1.00 0.00 O ATOM 16614 H1 WAT 1734 108.120 125.701 156.370 1.00 0.00 H ATOM 16615 H2 WAT 1734 107.321 124.569 156.980 1.00 0.00 H TER 16617 WAT 1734 ATOM 16617 O WAT 1735 42.526 99.553 25.207 1.00 0.00 O ATOM 16618 H1 WAT 1735 42.730 99.106 24.386 1.00 0.00 H ATOM 16619 H2 WAT 1735 42.497 100.481 24.975 1.00 0.00 H TER 16621 WAT 1735 ATOM 16621 O WAT 1736 60.064 36.977 107.348 1.00 0.00 O ATOM 16622 H1 WAT 1736 59.635 36.684 106.543 1.00 0.00 H ATOM 16623 H2 WAT 1736 59.879 37.915 107.389 1.00 0.00 H TER 16625 WAT 1736 ATOM 16625 O WAT 1737 48.678 3.930 141.735 1.00 0.00 O ATOM 16626 H1 WAT 1737 48.433 3.013 141.854 1.00 0.00 H ATOM 16627 H2 WAT 1737 49.429 3.903 141.141 1.00 0.00 H TER 16629 WAT 1737 ATOM 16629 O WAT 1738 13.093 11.728 122.071 1.00 0.00 O ATOM 16630 H1 WAT 1738 12.562 12.053 122.797 1.00 0.00 H ATOM 16631 H2 WAT 1738 13.252 12.500 121.526 1.00 0.00 H TER 16633 WAT 1738 ATOM 16633 O WAT 1739 47.526 -0.088 116.425 1.00 0.00 O ATOM 16634 H1 WAT 1739 48.145 -0.114 117.155 1.00 0.00 H ATOM 16635 H2 WAT 1739 46.719 0.257 116.807 1.00 0.00 H TER 16637 WAT 1739 ATOM 16637 O WAT 1740 21.298 125.107 82.399 1.00 0.00 O ATOM 16638 H1 WAT 1740 21.844 125.339 81.649 1.00 0.00 H ATOM 16639 H2 WAT 1740 21.840 124.510 82.915 1.00 0.00 H TER 16641 WAT 1740 ATOM 16641 O WAT 1741 32.297 108.898 149.365 1.00 0.00 O ATOM 16642 H1 WAT 1741 32.237 109.287 148.493 1.00 0.00 H ATOM 16643 H2 WAT 1741 32.717 109.572 149.900 1.00 0.00 H TER 16645 WAT 1741 ATOM 16645 O WAT 1742 107.030 116.367 108.122 1.00 0.00 O ATOM 16646 H1 WAT 1742 106.145 116.363 108.488 1.00 0.00 H ATOM 16647 H2 WAT 1742 107.560 115.903 108.771 1.00 0.00 H TER 16649 WAT 1742 ATOM 16649 O WAT 1743 59.881 75.982 110.257 1.00 0.00 O ATOM 16650 H1 WAT 1743 60.567 76.125 109.604 1.00 0.00 H ATOM 16651 H2 WAT 1743 59.198 75.504 109.786 1.00 0.00 H TER 16653 WAT 1743 ATOM 16653 O WAT 1744 117.836 92.306 140.550 1.00 0.00 O ATOM 16654 H1 WAT 1744 117.725 92.548 139.631 1.00 0.00 H ATOM 16655 H2 WAT 1744 117.573 93.087 141.037 1.00 0.00 H TER 16657 WAT 1744 ATOM 16657 O WAT 1745 112.923 13.886 67.474 1.00 0.00 O ATOM 16658 H1 WAT 1745 112.235 14.497 67.210 1.00 0.00 H ATOM 16659 H2 WAT 1745 113.648 14.447 67.750 1.00 0.00 H TER 16661 WAT 1745 ATOM 16661 O WAT 1746 36.124 77.486 128.468 1.00 0.00 O ATOM 16662 H1 WAT 1746 35.554 77.225 127.745 1.00 0.00 H ATOM 16663 H2 WAT 1746 37.010 77.404 128.117 1.00 0.00 H TER 16665 WAT 1746 ATOM 16665 O WAT 1747 102.342 40.548 55.734 1.00 0.00 O ATOM 16666 H1 WAT 1747 102.887 40.359 54.970 1.00 0.00 H ATOM 16667 H2 WAT 1747 102.120 41.475 55.646 1.00 0.00 H TER 16669 WAT 1747 ATOM 16669 O WAT 1748 101.654 68.052 152.986 1.00 0.00 O ATOM 16670 H1 WAT 1748 102.548 67.723 153.083 1.00 0.00 H ATOM 16671 H2 WAT 1748 101.737 69.001 153.075 1.00 0.00 H TER 16673 WAT 1748 ATOM 16673 O WAT 1749 10.453 109.795 63.986 1.00 0.00 O ATOM 16674 H1 WAT 1749 10.813 110.276 63.241 1.00 0.00 H ATOM 16675 H2 WAT 1749 10.714 110.308 64.751 1.00 0.00 H TER 16677 WAT 1749 ATOM 16677 O WAT 1750 108.097 19.823 126.883 1.00 0.00 O ATOM 16678 H1 WAT 1750 108.417 19.672 127.772 1.00 0.00 H ATOM 16679 H2 WAT 1750 107.888 20.757 126.859 1.00 0.00 H TER 16681 WAT 1750 ATOM 16681 O WAT 1751 103.348 101.082 122.179 1.00 0.00 O ATOM 16682 H1 WAT 1751 102.516 100.762 121.829 1.00 0.00 H ATOM 16683 H2 WAT 1751 103.700 101.640 121.486 1.00 0.00 H TER 16685 WAT 1751 ATOM 16685 O WAT 1752 63.217 145.338 68.617 1.00 0.00 O ATOM 16686 H1 WAT 1752 63.157 144.974 67.733 1.00 0.00 H ATOM 16687 H2 WAT 1752 63.390 146.269 68.481 1.00 0.00 H TER 16689 WAT 1752 ATOM 16689 O WAT 1753 83.524 27.506 156.893 1.00 0.00 O ATOM 16690 H1 WAT 1753 83.705 27.790 155.997 1.00 0.00 H ATOM 16691 H2 WAT 1753 84.331 27.077 157.176 1.00 0.00 H TER 16693 WAT 1753 ATOM 16693 O WAT 1754 92.923 113.553 136.836 1.00 0.00 O ATOM 16694 H1 WAT 1754 93.528 112.852 137.077 1.00 0.00 H ATOM 16695 H2 WAT 1754 93.429 114.357 136.953 1.00 0.00 H TER 16697 WAT 1754 ATOM 16697 O WAT 1755 84.589 97.681 90.215 1.00 0.00 O ATOM 16698 H1 WAT 1755 85.372 98.230 90.257 1.00 0.00 H ATOM 16699 H2 WAT 1755 84.042 98.094 89.547 1.00 0.00 H TER 16701 WAT 1755 ATOM 16701 O WAT 1756 44.779 33.572 6.314 1.00 0.00 O ATOM 16702 H1 WAT 1756 44.231 32.814 6.113 1.00 0.00 H ATOM 16703 H2 WAT 1756 44.385 33.951 7.100 1.00 0.00 H TER 16705 WAT 1756 ATOM 16705 O WAT 1757 32.110 111.464 108.050 1.00 0.00 O ATOM 16706 H1 WAT 1757 32.601 112.193 108.430 1.00 0.00 H ATOM 16707 H2 WAT 1757 31.590 111.863 107.353 1.00 0.00 H TER 16709 WAT 1757 ATOM 16709 O WAT 1758 128.453 113.328 126.971 1.00 0.00 O ATOM 16710 H1 WAT 1758 128.839 112.551 126.566 1.00 0.00 H ATOM 16711 H2 WAT 1758 128.142 113.852 126.233 1.00 0.00 H TER 16713 WAT 1758 ATOM 16713 O WAT 1759 122.773 80.914 133.945 1.00 0.00 O ATOM 16714 H1 WAT 1759 122.436 81.742 134.288 1.00 0.00 H ATOM 16715 H2 WAT 1759 123.332 80.575 134.645 1.00 0.00 H TER 16717 WAT 1759 ATOM 16717 O WAT 1760 99.025 92.475 0.381 1.00 0.00 O ATOM 16718 H1 WAT 1760 99.282 91.955 1.142 1.00 0.00 H ATOM 16719 H2 WAT 1760 98.104 92.253 0.239 1.00 0.00 H TER 16721 WAT 1760 ATOM 16721 O WAT 1761 128.736 104.355 85.435 1.00 0.00 O ATOM 16722 H1 WAT 1761 129.194 103.523 85.553 1.00 0.00 H ATOM 16723 H2 WAT 1761 127.981 104.297 86.021 1.00 0.00 H TER 16725 WAT 1761 ATOM 16725 O WAT 1762 145.148 95.590 0.281 1.00 0.00 O ATOM 16726 H1 WAT 1762 144.827 95.242 -0.551 1.00 0.00 H ATOM 16727 H2 WAT 1762 144.458 95.379 0.911 1.00 0.00 H TER 16729 WAT 1762 ATOM 16729 O WAT 1763 27.837 82.261 85.363 1.00 0.00 O ATOM 16730 H1 WAT 1763 28.740 81.963 85.477 1.00 0.00 H ATOM 16731 H2 WAT 1763 27.700 82.255 84.416 1.00 0.00 H TER 16733 WAT 1763 ATOM 16733 O WAT 1764 137.604 45.973 125.222 1.00 0.00 O ATOM 16734 H1 WAT 1764 137.978 46.152 126.085 1.00 0.00 H ATOM 16735 H2 WAT 1764 137.376 45.044 125.248 1.00 0.00 H TER 16737 WAT 1764 ATOM 16737 O WAT 1765 65.477 94.596 79.211 1.00 0.00 O ATOM 16738 H1 WAT 1765 64.910 95.122 79.774 1.00 0.00 H ATOM 16739 H2 WAT 1765 64.927 93.862 78.937 1.00 0.00 H TER 16741 WAT 1765 ATOM 16741 O WAT 1766 67.398 137.266 24.512 1.00 0.00 O ATOM 16742 H1 WAT 1766 67.449 138.206 24.682 1.00 0.00 H ATOM 16743 H2 WAT 1766 66.461 137.085 24.441 1.00 0.00 H TER 16745 WAT 1766 ATOM 16745 O WAT 1767 135.708 27.518 79.540 1.00 0.00 O ATOM 16746 H1 WAT 1767 136.574 27.543 79.134 1.00 0.00 H ATOM 16747 H2 WAT 1767 135.649 26.643 79.924 1.00 0.00 H TER 16749 WAT 1767 ATOM 16749 O WAT 1768 83.842 65.491 142.848 1.00 0.00 O ATOM 16750 H1 WAT 1768 84.569 65.249 142.273 1.00 0.00 H ATOM 16751 H2 WAT 1768 83.594 64.672 143.278 1.00 0.00 H TER 16753 WAT 1768 ATOM 16753 O WAT 1769 67.545 41.743 80.315 1.00 0.00 O ATOM 16754 H1 WAT 1769 67.314 42.551 79.856 1.00 0.00 H ATOM 16755 H2 WAT 1769 67.454 41.058 79.653 1.00 0.00 H TER 16757 WAT 1769 ATOM 16757 O WAT 1770 11.323 17.929 92.264 1.00 0.00 O ATOM 16758 H1 WAT 1770 11.351 18.652 91.638 1.00 0.00 H ATOM 16759 H2 WAT 1770 10.901 18.299 93.039 1.00 0.00 H TER 16761 WAT 1770 ATOM 16761 O WAT 1771 11.120 31.192 127.692 1.00 0.00 O ATOM 16762 H1 WAT 1771 11.527 32.058 127.733 1.00 0.00 H ATOM 16763 H2 WAT 1771 10.405 31.294 127.064 1.00 0.00 H TER 16765 WAT 1771 ATOM 16765 O WAT 1772 124.072 144.565 157.723 1.00 0.00 O ATOM 16766 H1 WAT 1772 124.096 145.458 157.379 1.00 0.00 H ATOM 16767 H2 WAT 1772 124.271 144.662 158.654 1.00 0.00 H TER 16769 WAT 1772 ATOM 16769 O WAT 1773 138.380 128.786 124.369 1.00 0.00 O ATOM 16770 H1 WAT 1773 137.916 128.351 125.084 1.00 0.00 H ATOM 16771 H2 WAT 1773 138.281 129.720 124.552 1.00 0.00 H TER 16773 WAT 1773 ATOM 16773 O WAT 1774 72.498 41.774 3.134 1.00 0.00 O ATOM 16774 H1 WAT 1774 72.444 41.065 2.494 1.00 0.00 H ATOM 16775 H2 WAT 1774 71.631 41.797 3.540 1.00 0.00 H TER 16777 WAT 1774 ATOM 16777 O WAT 1775 132.182 54.584 8.886 1.00 0.00 O ATOM 16778 H1 WAT 1775 131.740 53.773 9.136 1.00 0.00 H ATOM 16779 H2 WAT 1775 133.000 54.574 9.383 1.00 0.00 H TER 16781 WAT 1775 ATOM 16781 O WAT 1776 96.252 77.883 129.353 1.00 0.00 O ATOM 16782 H1 WAT 1776 95.416 78.011 129.801 1.00 0.00 H ATOM 16783 H2 WAT 1776 96.449 76.954 129.474 1.00 0.00 H TER 16785 WAT 1776 ATOM 16785 O WAT 1777 32.559 26.122 10.820 1.00 0.00 O ATOM 16786 H1 WAT 1777 32.939 26.929 10.473 1.00 0.00 H ATOM 16787 H2 WAT 1777 33.218 25.451 10.640 1.00 0.00 H TER 16789 WAT 1777 ATOM 16789 O WAT 1778 55.486 84.000 85.946 1.00 0.00 O ATOM 16790 H1 WAT 1778 55.933 83.156 86.006 1.00 0.00 H ATOM 16791 H2 WAT 1778 54.562 83.791 86.089 1.00 0.00 H TER 16793 WAT 1778 ATOM 16793 O WAT 1779 66.904 132.548 90.512 1.00 0.00 O ATOM 16794 H1 WAT 1779 67.456 133.279 90.234 1.00 0.00 H ATOM 16795 H2 WAT 1779 66.380 132.904 91.229 1.00 0.00 H TER 16797 WAT 1779 ATOM 16797 O WAT 1780 8.959 85.813 87.868 1.00 0.00 O ATOM 16798 H1 WAT 1780 8.012 85.950 87.843 1.00 0.00 H ATOM 16799 H2 WAT 1780 9.154 85.341 87.059 1.00 0.00 H TER 16801 WAT 1780 ATOM 16801 O WAT 1781 94.552 101.195 146.529 1.00 0.00 O ATOM 16802 H1 WAT 1781 95.321 101.372 147.070 1.00 0.00 H ATOM 16803 H2 WAT 1781 94.863 100.580 145.864 1.00 0.00 H TER 16805 WAT 1781 ATOM 16805 O WAT 1782 129.602 33.104 149.754 1.00 0.00 O ATOM 16806 H1 WAT 1782 129.678 33.530 148.900 1.00 0.00 H ATOM 16807 H2 WAT 1782 130.428 33.303 150.195 1.00 0.00 H TER 16809 WAT 1782 ATOM 16809 O WAT 1783 47.815 81.839 94.448 1.00 0.00 O ATOM 16810 H1 WAT 1783 47.486 82.009 95.330 1.00 0.00 H ATOM 16811 H2 WAT 1783 47.034 81.856 93.894 1.00 0.00 H TER 16813 WAT 1783 ATOM 16813 O WAT 1784 16.740 108.124 94.180 1.00 0.00 O ATOM 16814 H1 WAT 1784 17.639 108.174 93.854 1.00 0.00 H ATOM 16815 H2 WAT 1784 16.804 107.607 94.983 1.00 0.00 H TER 16817 WAT 1784 ATOM 16817 O WAT 1785 135.325 123.850 156.069 1.00 0.00 O ATOM 16818 H1 WAT 1785 135.508 123.930 155.133 1.00 0.00 H ATOM 16819 H2 WAT 1785 134.496 124.313 156.191 1.00 0.00 H TER 16821 WAT 1785 ATOM 16821 O WAT 1786 50.095 29.672 4.360 1.00 0.00 O ATOM 16822 H1 WAT 1786 49.349 30.228 4.586 1.00 0.00 H ATOM 16823 H2 WAT 1786 50.811 30.286 4.199 1.00 0.00 H TER 16825 WAT 1786 ATOM 16825 O WAT 1787 116.533 79.010 8.653 1.00 0.00 O ATOM 16826 H1 WAT 1787 115.851 78.344 8.739 1.00 0.00 H ATOM 16827 H2 WAT 1787 116.130 79.699 8.125 1.00 0.00 H TER 16829 WAT 1787 ATOM 16829 O WAT 1788 123.186 54.171 134.078 1.00 0.00 O ATOM 16830 H1 WAT 1788 122.839 53.977 133.207 1.00 0.00 H ATOM 16831 H2 WAT 1788 123.041 55.110 134.190 1.00 0.00 H TER 16833 WAT 1788 ATOM 16833 O WAT 1789 115.587 14.060 51.226 1.00 0.00 O ATOM 16834 H1 WAT 1789 115.493 14.426 52.105 1.00 0.00 H ATOM 16835 H2 WAT 1789 116.377 13.521 51.274 1.00 0.00 H TER 16837 WAT 1789 ATOM 16837 O WAT 1790 8.173 45.993 150.603 1.00 0.00 O ATOM 16838 H1 WAT 1790 8.508 45.663 151.437 1.00 0.00 H ATOM 16839 H2 WAT 1790 8.030 46.927 150.754 1.00 0.00 H TER 16841 WAT 1790 ATOM 16841 O WAT 1791 37.987 87.092 6.451 1.00 0.00 O ATOM 16842 H1 WAT 1791 38.137 87.461 7.322 1.00 0.00 H ATOM 16843 H2 WAT 1791 38.856 86.826 6.151 1.00 0.00 H TER 16845 WAT 1791 ATOM 16845 O WAT 1792 103.147 115.831 137.257 1.00 0.00 O ATOM 16846 H1 WAT 1792 102.366 115.279 137.254 1.00 0.00 H ATOM 16847 H2 WAT 1792 103.519 115.716 138.132 1.00 0.00 H TER 16849 WAT 1792 ATOM 16849 O WAT 1793 7.547 139.018 73.362 1.00 0.00 O ATOM 16850 H1 WAT 1793 7.692 139.846 73.821 1.00 0.00 H ATOM 16851 H2 WAT 1793 8.425 138.658 73.235 1.00 0.00 H TER 16853 WAT 1793 ATOM 16853 O WAT 1794 133.706 75.553 156.235 1.00 0.00 O ATOM 16854 H1 WAT 1794 132.904 75.053 156.081 1.00 0.00 H ATOM 16855 H2 WAT 1794 133.668 76.268 155.600 1.00 0.00 H TER 16857 WAT 1794 ATOM 16857 O WAT 1795 53.343 92.401 140.415 1.00 0.00 O ATOM 16858 H1 WAT 1795 54.162 91.929 140.567 1.00 0.00 H ATOM 16859 H2 WAT 1795 52.758 92.096 141.108 1.00 0.00 H TER 16861 WAT 1795 ATOM 16861 O WAT 1796 28.446 88.756 75.788 1.00 0.00 O ATOM 16862 H1 WAT 1796 28.848 87.938 76.080 1.00 0.00 H ATOM 16863 H2 WAT 1796 29.031 89.440 76.112 1.00 0.00 H TER 16865 WAT 1796 ATOM 16865 O WAT 1797 25.975 75.685 144.341 1.00 0.00 O ATOM 16866 H1 WAT 1797 25.945 76.410 143.717 1.00 0.00 H ATOM 16867 H2 WAT 1797 25.360 75.936 145.030 1.00 0.00 H TER 16869 WAT 1797 ATOM 16869 O WAT 1798 20.744 107.637 67.697 1.00 0.00 O ATOM 16870 H1 WAT 1798 20.452 106.851 68.158 1.00 0.00 H ATOM 16871 H2 WAT 1798 21.545 107.367 67.248 1.00 0.00 H TER 16873 WAT 1798 ATOM 16873 O WAT 1799 42.630 6.128 86.540 1.00 0.00 O ATOM 16874 H1 WAT 1799 41.877 6.057 85.954 1.00 0.00 H ATOM 16875 H2 WAT 1799 42.863 7.056 86.520 1.00 0.00 H TER 16877 WAT 1799 ATOM 16877 O WAT 1800 63.850 50.304 26.729 1.00 0.00 O ATOM 16878 H1 WAT 1800 62.939 50.405 27.005 1.00 0.00 H ATOM 16879 H2 WAT 1800 64.360 50.709 27.432 1.00 0.00 H TER 16881 WAT 1800 ATOM 16881 O WAT 1801 123.297 128.104 75.796 1.00 0.00 O ATOM 16882 H1 WAT 1801 122.386 127.839 75.670 1.00 0.00 H ATOM 16883 H2 WAT 1801 123.806 127.320 75.586 1.00 0.00 H TER 16885 WAT 1801 ATOM 16885 O WAT 1802 41.541 126.526 118.964 1.00 0.00 O ATOM 16886 H1 WAT 1802 42.103 127.240 118.665 1.00 0.00 H ATOM 16887 H2 WAT 1802 41.175 126.839 119.791 1.00 0.00 H TER 16889 WAT 1802 ATOM 16889 O WAT 1803 105.207 82.548 61.253 1.00 0.00 O ATOM 16890 H1 WAT 1803 105.624 82.401 60.404 1.00 0.00 H ATOM 16891 H2 WAT 1803 104.782 83.402 61.167 1.00 0.00 H TER 16893 WAT 1803 ATOM 16893 O WAT 1804 7.058 70.613 157.044 1.00 0.00 O ATOM 16894 H1 WAT 1804 7.202 70.037 157.795 1.00 0.00 H ATOM 16895 H2 WAT 1804 6.281 71.121 157.279 1.00 0.00 H TER 16897 WAT 1804 ATOM 16897 O WAT 1805 125.553 59.340 101.891 1.00 0.00 O ATOM 16898 H1 WAT 1805 125.663 60.101 102.462 1.00 0.00 H ATOM 16899 H2 WAT 1805 124.890 59.612 101.255 1.00 0.00 H TER 16901 WAT 1805 ATOM 16901 O WAT 1806 60.091 103.641 68.629 1.00 0.00 O ATOM 16902 H1 WAT 1806 60.720 103.475 67.927 1.00 0.00 H ATOM 16903 H2 WAT 1806 60.515 104.299 69.180 1.00 0.00 H TER 16905 WAT 1806 ATOM 16905 O WAT 1807 62.741 39.458 68.292 1.00 0.00 O ATOM 16906 H1 WAT 1807 62.986 39.914 69.097 1.00 0.00 H ATOM 16907 H2 WAT 1807 63.077 38.569 68.409 1.00 0.00 H TER 16909 WAT 1807 ATOM 16909 O WAT 1808 116.992 45.217 147.731 1.00 0.00 O ATOM 16910 H1 WAT 1808 117.837 45.656 147.632 1.00 0.00 H ATOM 16911 H2 WAT 1808 117.104 44.378 147.284 1.00 0.00 H TER 16913 WAT 1808 ATOM 16913 O WAT 1809 93.993 140.393 92.789 1.00 0.00 O ATOM 16914 H1 WAT 1809 93.443 140.208 92.027 1.00 0.00 H ATOM 16915 H2 WAT 1809 93.998 139.574 93.284 1.00 0.00 H TER 16917 WAT 1809 ATOM 16917 O WAT 1810 10.707 61.576 155.714 1.00 0.00 O ATOM 16918 H1 WAT 1810 10.528 62.124 154.950 1.00 0.00 H ATOM 16919 H2 WAT 1810 9.897 61.601 156.222 1.00 0.00 H TER 16921 WAT 1810 ATOM 16921 O WAT 1811 35.482 31.493 71.109 1.00 0.00 O ATOM 16922 H1 WAT 1811 34.987 31.431 71.925 1.00 0.00 H ATOM 16923 H2 WAT 1811 34.875 31.186 70.436 1.00 0.00 H TER 16925 WAT 1811 ATOM 16925 O WAT 1812 58.218 133.520 94.670 1.00 0.00 O ATOM 16926 H1 WAT 1812 58.586 132.831 94.117 1.00 0.00 H ATOM 16927 H2 WAT 1812 58.067 134.252 94.072 1.00 0.00 H TER 16929 WAT 1812 ATOM 16929 O WAT 1813 32.216 20.415 69.619 1.00 0.00 O ATOM 16930 H1 WAT 1813 32.552 20.985 68.927 1.00 0.00 H ATOM 16931 H2 WAT 1813 31.309 20.695 69.741 1.00 0.00 H TER 16933 WAT 1813 ATOM 16933 O WAT 1814 75.733 14.428 90.094 1.00 0.00 O ATOM 16934 H1 WAT 1814 75.324 13.599 90.339 1.00 0.00 H ATOM 16935 H2 WAT 1814 75.202 15.095 90.530 1.00 0.00 H TER 16937 WAT 1814 ATOM 16937 O WAT 1815 64.286 19.467 0.111 1.00 0.00 O ATOM 16938 H1 WAT 1815 64.242 19.546 1.064 1.00 0.00 H ATOM 16939 H2 WAT 1815 63.428 19.125 -0.140 1.00 0.00 H TER 16941 WAT 1815 ATOM 16941 O WAT 1816 48.177 139.881 66.334 1.00 0.00 O ATOM 16942 H1 WAT 1816 47.951 140.736 66.700 1.00 0.00 H ATOM 16943 H2 WAT 1816 48.258 139.308 67.097 1.00 0.00 H TER 16945 WAT 1816 ATOM 16945 O WAT 1817 80.600 119.989 51.017 1.00 0.00 O ATOM 16946 H1 WAT 1817 79.868 119.784 51.598 1.00 0.00 H ATOM 16947 H2 WAT 1817 80.482 119.403 50.268 1.00 0.00 H TER 16949 WAT 1817 ATOM 16949 O WAT 1818 124.591 110.212 12.004 1.00 0.00 O ATOM 16950 H1 WAT 1818 124.768 109.899 11.117 1.00 0.00 H ATOM 16951 H2 WAT 1818 125.420 110.594 12.293 1.00 0.00 H TER 16953 WAT 1818 ATOM 16953 O WAT 1819 108.275 17.187 59.810 1.00 0.00 O ATOM 16954 H1 WAT 1819 108.849 16.893 59.102 1.00 0.00 H ATOM 16955 H2 WAT 1819 108.800 17.825 60.294 1.00 0.00 H TER 16957 WAT 1819 ATOM 16957 O WAT 1820 51.703 102.811 3.399 1.00 0.00 O ATOM 16958 H1 WAT 1820 52.303 102.127 3.697 1.00 0.00 H ATOM 16959 H2 WAT 1820 51.236 103.080 4.190 1.00 0.00 H TER 16961 WAT 1820 ATOM 16961 O WAT 1821 38.614 107.176 145.057 1.00 0.00 O ATOM 16962 H1 WAT 1821 38.719 108.127 145.039 1.00 0.00 H ATOM 16963 H2 WAT 1821 37.719 107.039 145.367 1.00 0.00 H TER 16965 WAT 1821 ATOM 16965 O WAT 1822 130.737 113.279 8.356 1.00 0.00 O ATOM 16966 H1 WAT 1822 130.787 113.305 9.312 1.00 0.00 H ATOM 16967 H2 WAT 1822 131.603 112.980 8.079 1.00 0.00 H TER 16969 WAT 1822 ATOM 16969 O WAT 1823 22.131 18.050 108.396 1.00 0.00 O ATOM 16970 H1 WAT 1823 21.282 18.240 107.997 1.00 0.00 H ATOM 16971 H2 WAT 1823 22.235 18.722 109.070 1.00 0.00 H TER 16973 WAT 1823 ATOM 16973 O WAT 1824 39.717 129.939 140.234 1.00 0.00 O ATOM 16974 H1 WAT 1824 40.410 129.962 139.574 1.00 0.00 H ATOM 16975 H2 WAT 1824 38.926 129.717 139.742 1.00 0.00 H TER 16977 WAT 1824 ATOM 16977 O WAT 1825 55.139 57.484 15.212 1.00 0.00 O ATOM 16978 H1 WAT 1825 55.050 58.243 15.788 1.00 0.00 H ATOM 16979 H2 WAT 1825 55.232 57.858 14.336 1.00 0.00 H TER 16981 WAT 1825 ATOM 16981 O WAT 1826 49.176 121.535 71.100 1.00 0.00 O ATOM 16982 H1 WAT 1826 49.723 121.554 71.885 1.00 0.00 H ATOM 16983 H2 WAT 1826 49.781 121.309 70.393 1.00 0.00 H TER 16985 WAT 1826 ATOM 16985 O WAT 1827 109.739 9.881 106.227 1.00 0.00 O ATOM 16986 H1 WAT 1827 109.477 10.222 105.372 1.00 0.00 H ATOM 16987 H2 WAT 1827 110.476 9.300 106.037 1.00 0.00 H TER 16989 WAT 1827 ATOM 16989 O WAT 1828 7.567 142.184 71.295 1.00 0.00 O ATOM 16990 H1 WAT 1828 6.778 142.706 71.146 1.00 0.00 H ATOM 16991 H2 WAT 1828 7.256 141.279 71.305 1.00 0.00 H TER 16993 WAT 1828 ATOM 16993 O WAT 1829 105.226 138.778 143.316 1.00 0.00 O ATOM 16994 H1 WAT 1829 105.915 138.731 143.979 1.00 0.00 H ATOM 16995 H2 WAT 1829 104.789 137.928 143.364 1.00 0.00 H TER 16997 WAT 1829 ATOM 16997 O WAT 1830 21.499 133.602 126.590 1.00 0.00 O ATOM 16998 H1 WAT 1830 22.362 133.685 126.996 1.00 0.00 H ATOM 16999 H2 WAT 1830 20.972 134.285 127.004 1.00 0.00 H TER 17001 WAT 1830 ATOM 17001 O WAT 1831 138.176 69.734 10.283 1.00 0.00 O ATOM 17002 H1 WAT 1831 137.557 70.070 10.931 1.00 0.00 H ATOM 17003 H2 WAT 1831 139.004 70.163 10.498 1.00 0.00 H TER 17005 WAT 1831 ATOM 17005 O WAT 1832 134.266 83.960 1.593 1.00 0.00 O ATOM 17006 H1 WAT 1832 133.549 84.196 2.181 1.00 0.00 H ATOM 17007 H2 WAT 1832 134.853 84.716 1.615 1.00 0.00 H TER 17009 WAT 1832 ATOM 17009 O WAT 1833 123.326 26.507 66.307 1.00 0.00 O ATOM 17010 H1 WAT 1833 123.213 25.926 67.060 1.00 0.00 H ATOM 17011 H2 WAT 1833 123.826 27.248 66.649 1.00 0.00 H TER 17013 WAT 1833 ATOM 17013 O WAT 1834 76.527 76.390 81.009 1.00 0.00 O ATOM 17014 H1 WAT 1834 75.723 76.828 80.731 1.00 0.00 H ATOM 17015 H2 WAT 1834 77.043 76.306 80.207 1.00 0.00 H TER 17017 WAT 1834 ATOM 17017 O WAT 1835 135.633 135.524 144.981 1.00 0.00 O ATOM 17018 H1 WAT 1835 136.389 136.067 144.757 1.00 0.00 H ATOM 17019 H2 WAT 1835 134.939 135.827 144.396 1.00 0.00 H TER 17021 WAT 1835 ATOM 17021 O WAT 1836 69.082 21.960 16.963 1.00 0.00 O ATOM 17022 H1 WAT 1836 69.817 22.355 16.493 1.00 0.00 H ATOM 17023 H2 WAT 1836 69.473 21.600 17.759 1.00 0.00 H TER 17025 WAT 1836 ATOM 17025 O WAT 1837 50.328 25.032 65.353 1.00 0.00 O ATOM 17026 H1 WAT 1837 49.504 25.366 65.711 1.00 0.00 H ATOM 17027 H2 WAT 1837 50.426 25.486 64.516 1.00 0.00 H TER 17029 WAT 1837 ATOM 17029 O WAT 1838 119.692 102.061 146.811 1.00 0.00 O ATOM 17030 H1 WAT 1838 119.298 101.263 146.460 1.00 0.00 H ATOM 17031 H2 WAT 1838 120.456 101.755 147.300 1.00 0.00 H TER 17033 WAT 1838 ATOM 17033 O WAT 1839 34.110 44.115 7.515 1.00 0.00 O ATOM 17034 H1 WAT 1839 33.517 44.361 6.805 1.00 0.00 H ATOM 17035 H2 WAT 1839 33.596 43.518 8.059 1.00 0.00 H TER 17037 WAT 1839 ATOM 17037 O WAT 1840 43.014 67.735 140.387 1.00 0.00 O ATOM 17038 H1 WAT 1840 42.566 67.975 141.198 1.00 0.00 H ATOM 17039 H2 WAT 1840 43.425 68.547 140.091 1.00 0.00 H TER 17041 WAT 1840 ATOM 17041 O WAT 1841 24.158 82.806 75.486 1.00 0.00 O ATOM 17042 H1 WAT 1841 23.469 82.251 75.120 1.00 0.00 H ATOM 17043 H2 WAT 1841 24.716 83.021 74.738 1.00 0.00 H TER 17045 WAT 1841 ATOM 17045 O WAT 1842 125.906 45.210 150.489 1.00 0.00 O ATOM 17046 H1 WAT 1842 125.604 44.418 150.934 1.00 0.00 H ATOM 17047 H2 WAT 1842 126.835 45.050 150.322 1.00 0.00 H TER 17049 WAT 1842 ATOM 17049 O WAT 1843 7.315 19.303 66.632 1.00 0.00 O ATOM 17050 H1 WAT 1843 7.783 19.988 67.109 1.00 0.00 H ATOM 17051 H2 WAT 1843 7.937 19.007 65.967 1.00 0.00 H TER 17053 WAT 1843 ATOM 17053 O WAT 1844 108.086 144.866 0.240 1.00 0.00 O ATOM 17054 H1 WAT 1844 109.025 145.047 0.207 1.00 0.00 H ATOM 17055 H2 WAT 1844 108.020 144.022 0.688 1.00 0.00 H TER 17057 WAT 1844 ATOM 17057 O WAT 1845 7.552 132.799 70.615 1.00 0.00 O ATOM 17058 H1 WAT 1845 8.216 132.662 69.940 1.00 0.00 H ATOM 17059 H2 WAT 1845 7.881 133.537 71.128 1.00 0.00 H TER 17061 WAT 1845 ATOM 17061 O WAT 1846 45.628 114.230 76.589 1.00 0.00 O ATOM 17062 H1 WAT 1846 45.906 115.092 76.898 1.00 0.00 H ATOM 17063 H2 WAT 1846 46.355 113.649 76.815 1.00 0.00 H TER 17065 WAT 1846 ATOM 17065 O WAT 1847 65.211 114.226 10.623 1.00 0.00 O ATOM 17066 H1 WAT 1847 65.014 113.299 10.753 1.00 0.00 H ATOM 17067 H2 WAT 1847 66.004 114.230 10.086 1.00 0.00 H TER 17069 WAT 1847 ATOM 17069 O WAT 1848 9.532 106.734 80.859 1.00 0.00 O ATOM 17070 H1 WAT 1848 9.067 106.537 81.672 1.00 0.00 H ATOM 17071 H2 WAT 1848 9.534 107.690 80.809 1.00 0.00 H TER 17073 WAT 1848 ATOM 17073 O WAT 1849 79.867 130.029 142.877 1.00 0.00 O ATOM 17074 H1 WAT 1849 79.670 129.168 142.506 1.00 0.00 H ATOM 17075 H2 WAT 1849 79.030 130.336 143.226 1.00 0.00 H TER 17077 WAT 1849 ATOM 17077 O WAT 1850 42.593 62.069 73.850 1.00 0.00 O ATOM 17078 H1 WAT 1850 42.007 62.824 73.799 1.00 0.00 H ATOM 17079 H2 WAT 1850 42.010 61.324 73.999 1.00 0.00 H TER 17081 WAT 1850 ATOM 17081 O WAT 1851 91.582 22.397 141.204 1.00 0.00 O ATOM 17082 H1 WAT 1851 91.503 22.862 142.037 1.00 0.00 H ATOM 17083 H2 WAT 1851 91.499 21.473 141.436 1.00 0.00 H TER 17085 WAT 1851 ATOM 17085 O WAT 1852 100.452 32.940 97.611 1.00 0.00 O ATOM 17086 H1 WAT 1852 100.405 32.905 98.567 1.00 0.00 H ATOM 17087 H2 WAT 1852 101.271 32.494 97.395 1.00 0.00 H TER 17089 WAT 1852 ATOM 17089 O WAT 1853 117.263 28.038 85.153 1.00 0.00 O ATOM 17090 H1 WAT 1853 117.941 27.587 85.657 1.00 0.00 H ATOM 17091 H2 WAT 1853 116.526 27.428 85.144 1.00 0.00 H TER 17093 WAT 1853 ATOM 17093 O WAT 1854 144.287 90.458 124.735 1.00 0.00 O ATOM 17094 H1 WAT 1854 143.579 89.938 125.116 1.00 0.00 H ATOM 17095 H2 WAT 1854 143.862 90.977 124.053 1.00 0.00 H TER 17097 WAT 1854 ATOM 17097 O WAT 1855 9.573 66.385 6.462 1.00 0.00 O ATOM 17098 H1 WAT 1855 10.262 66.159 7.088 1.00 0.00 H ATOM 17099 H2 WAT 1855 9.466 65.597 5.930 1.00 0.00 H TER 17101 WAT 1855 ATOM 17101 O WAT 1856 2.777 48.934 80.115 1.00 0.00 O ATOM 17102 H1 WAT 1856 3.577 48.410 80.133 1.00 0.00 H ATOM 17103 H2 WAT 1856 2.879 49.501 79.350 1.00 0.00 H TER 17105 WAT 1856 ATOM 17105 O WAT 1857 125.425 93.601 105.299 1.00 0.00 O ATOM 17106 H1 WAT 1857 125.552 92.659 105.413 1.00 0.00 H ATOM 17107 H2 WAT 1857 124.479 93.703 105.189 1.00 0.00 H TER 17109 WAT 1857 ATOM 17109 O WAT 1858 118.752 33.205 5.235 1.00 0.00 O ATOM 17110 H1 WAT 1858 118.161 32.495 5.484 1.00 0.00 H ATOM 17111 H2 WAT 1858 118.271 33.695 4.568 1.00 0.00 H TER 17113 WAT 1858 ATOM 17113 O WAT 1859 46.929 29.117 6.392 1.00 0.00 O ATOM 17114 H1 WAT 1859 47.513 29.726 5.939 1.00 0.00 H ATOM 17115 H2 WAT 1859 47.489 28.681 7.035 1.00 0.00 H TER 17117 WAT 1859 ATOM 17117 O WAT 1860 7.620 78.378 71.261 1.00 0.00 O ATOM 17118 H1 WAT 1860 7.891 78.501 72.171 1.00 0.00 H ATOM 17119 H2 WAT 1860 8.107 77.607 70.968 1.00 0.00 H TER 17121 WAT 1860 ATOM 17121 O WAT 1861 142.782 20.363 78.453 1.00 0.00 O ATOM 17122 H1 WAT 1861 143.115 19.657 77.900 1.00 0.00 H ATOM 17123 H2 WAT 1861 141.994 19.999 78.857 1.00 0.00 H TER 17125 WAT 1861 ATOM 17125 O WAT 1862 69.002 105.169 27.820 1.00 0.00 O ATOM 17126 H1 WAT 1862 68.247 104.635 28.070 1.00 0.00 H ATOM 17127 H2 WAT 1862 68.635 106.036 27.647 1.00 0.00 H TER 17129 WAT 1862 ATOM 17129 O WAT 1863 32.788 11.341 2.840 1.00 0.00 O ATOM 17130 H1 WAT 1863 32.176 10.750 3.279 1.00 0.00 H ATOM 17131 H2 WAT 1863 32.306 11.663 2.078 1.00 0.00 H TER 17133 WAT 1863 ATOM 17133 O WAT 1864 36.952 123.734 67.493 1.00 0.00 O ATOM 17134 H1 WAT 1864 37.842 124.039 67.670 1.00 0.00 H ATOM 17135 H2 WAT 1864 36.656 124.272 66.759 1.00 0.00 H TER 17137 WAT 1864 ATOM 17137 O WAT 1865 56.551 95.440 94.218 1.00 0.00 O ATOM 17138 H1 WAT 1865 55.929 96.166 94.264 1.00 0.00 H ATOM 17139 H2 WAT 1865 56.811 95.406 93.297 1.00 0.00 H TER 17141 WAT 1865 ATOM 17141 O WAT 1866 119.662 4.463 92.164 1.00 0.00 O ATOM 17142 H1 WAT 1866 119.348 4.799 93.004 1.00 0.00 H ATOM 17143 H2 WAT 1866 118.938 4.620 91.558 1.00 0.00 H TER 17145 WAT 1866 ATOM 17145 O WAT 1867 70.660 3.547 6.588 1.00 0.00 O ATOM 17146 H1 WAT 1867 71.470 4.050 6.501 1.00 0.00 H ATOM 17147 H2 WAT 1867 70.766 2.816 5.979 1.00 0.00 H TER 17149 WAT 1867 ATOM 17149 O WAT 1868 78.593 14.663 9.203 1.00 0.00 O ATOM 17150 H1 WAT 1868 78.453 15.305 9.899 1.00 0.00 H ATOM 17151 H2 WAT 1868 78.549 15.173 8.394 1.00 0.00 H TER 17153 WAT 1868 ATOM 17153 O WAT 1869 62.709 127.085 107.182 1.00 0.00 O ATOM 17154 H1 WAT 1869 62.848 126.685 106.323 1.00 0.00 H ATOM 17155 H2 WAT 1869 61.881 126.715 107.487 1.00 0.00 H TER 17157 WAT 1869 ATOM 17157 O WAT 1870 26.814 29.826 8.715 1.00 0.00 O ATOM 17158 H1 WAT 1870 27.221 30.662 8.490 1.00 0.00 H ATOM 17159 H2 WAT 1870 26.548 29.927 9.629 1.00 0.00 H TER 17161 WAT 1870 ATOM 17161 O WAT 1871 100.512 80.725 94.622 1.00 0.00 O ATOM 17162 H1 WAT 1871 101.398 80.403 94.459 1.00 0.00 H ATOM 17163 H2 WAT 1871 99.954 79.955 94.518 1.00 0.00 H TER 17165 WAT 1871 ATOM 17165 O WAT 1872 127.000 15.592 14.470 1.00 0.00 O ATOM 17166 H1 WAT 1872 126.147 15.779 14.862 1.00 0.00 H ATOM 17167 H2 WAT 1872 127.211 14.706 14.768 1.00 0.00 H TER 17169 WAT 1872 ATOM 17169 O WAT 1873 111.043 38.452 95.465 1.00 0.00 O ATOM 17170 H1 WAT 1873 111.228 39.057 94.747 1.00 0.00 H ATOM 17171 H2 WAT 1873 110.889 39.018 96.221 1.00 0.00 H TER 17173 WAT 1873 ATOM 17173 O WAT 1874 70.855 0.462 103.433 1.00 0.00 O ATOM 17174 H1 WAT 1874 69.989 0.350 103.040 1.00 0.00 H ATOM 17175 H2 WAT 1874 71.399 -0.200 103.007 1.00 0.00 H TER 17177 WAT 1874 ATOM 17177 O WAT 1875 81.434 -0.055 89.441 1.00 0.00 O ATOM 17178 H1 WAT 1875 81.500 0.181 88.515 1.00 0.00 H ATOM 17179 H2 WAT 1875 80.526 0.141 89.674 1.00 0.00 H TER 17181 WAT 1875 ATOM 17181 O WAT 1876 44.605 60.952 128.287 1.00 0.00 O ATOM 17182 H1 WAT 1876 44.841 60.168 128.783 1.00 0.00 H ATOM 17183 H2 WAT 1876 44.210 61.536 128.934 1.00 0.00 H TER 17185 WAT 1876 ATOM 17185 O WAT 1877 104.687 129.728 96.800 1.00 0.00 O ATOM 17186 H1 WAT 1877 104.567 130.557 96.335 1.00 0.00 H ATOM 17187 H2 WAT 1877 103.810 129.347 96.841 1.00 0.00 H TER 17189 WAT 1877 ATOM 17189 O WAT 1878 76.944 44.618 152.178 1.00 0.00 O ATOM 17190 H1 WAT 1878 76.587 44.526 153.062 1.00 0.00 H ATOM 17191 H2 WAT 1878 77.438 45.438 152.204 1.00 0.00 H TER 17193 WAT 1878 ATOM 17193 O WAT 1879 97.607 54.678 130.488 1.00 0.00 O ATOM 17194 H1 WAT 1879 96.845 54.504 131.041 1.00 0.00 H ATOM 17195 H2 WAT 1879 98.287 54.096 130.827 1.00 0.00 H TER 17197 WAT 1879 ATOM 17197 O WAT 1880 70.412 103.809 138.774 1.00 0.00 O ATOM 17198 H1 WAT 1880 70.635 104.438 139.460 1.00 0.00 H ATOM 17199 H2 WAT 1880 70.923 104.091 138.015 1.00 0.00 H TER 17201 WAT 1880 ATOM 17201 O WAT 1881 89.581 71.609 13.396 1.00 0.00 O ATOM 17202 H1 WAT 1881 88.970 70.923 13.128 1.00 0.00 H ATOM 17203 H2 WAT 1881 90.112 71.203 14.081 1.00 0.00 H TER 17205 WAT 1881 ATOM 17205 O WAT 1882 133.017 117.605 17.005 1.00 0.00 O ATOM 17206 H1 WAT 1882 133.837 117.112 17.037 1.00 0.00 H ATOM 17207 H2 WAT 1882 132.360 116.961 16.741 1.00 0.00 H TER 17209 WAT 1882 ATOM 17209 O WAT 1883 87.306 143.809 105.641 1.00 0.00 O ATOM 17210 H1 WAT 1883 86.574 144.070 105.082 1.00 0.00 H ATOM 17211 H2 WAT 1883 88.086 144.032 105.135 1.00 0.00 H TER 17213 WAT 1883 ATOM 17213 O WAT 1884 24.463 130.586 63.618 1.00 0.00 O ATOM 17214 H1 WAT 1884 23.957 131.398 63.591 1.00 0.00 H ATOM 17215 H2 WAT 1884 23.994 130.031 64.241 1.00 0.00 H TER 17217 WAT 1884 ATOM 17217 O WAT 1885 87.206 6.306 145.530 1.00 0.00 O ATOM 17218 H1 WAT 1885 86.517 5.730 145.859 1.00 0.00 H ATOM 17219 H2 WAT 1885 87.813 6.398 146.264 1.00 0.00 H TER 17221 WAT 1885 ATOM 17221 O WAT 1886 134.438 117.744 12.806 1.00 0.00 O ATOM 17222 H1 WAT 1886 133.952 118.213 13.484 1.00 0.00 H ATOM 17223 H2 WAT 1886 134.068 118.063 11.982 1.00 0.00 H TER 17225 WAT 1886 ATOM 17225 O WAT 1887 89.994 104.068 22.605 1.00 0.00 O ATOM 17226 H1 WAT 1887 89.845 103.262 23.099 1.00 0.00 H ATOM 17227 H2 WAT 1887 90.605 103.815 21.913 1.00 0.00 H TER 17229 WAT 1887 ATOM 17229 O WAT 1888 88.980 0.752 97.715 1.00 0.00 O ATOM 17230 H1 WAT 1888 89.012 1.538 98.260 1.00 0.00 H ATOM 17231 H2 WAT 1888 89.710 0.216 98.024 1.00 0.00 H TER 17233 WAT 1888 ATOM 17233 O WAT 1889 87.175 84.999 65.481 1.00 0.00 O ATOM 17234 H1 WAT 1889 86.396 85.135 64.941 1.00 0.00 H ATOM 17235 H2 WAT 1889 86.832 84.832 66.359 1.00 0.00 H TER 17237 WAT 1889 ATOM 17237 O WAT 1890 55.641 114.035 134.319 1.00 0.00 O ATOM 17238 H1 WAT 1890 55.164 114.767 133.928 1.00 0.00 H ATOM 17239 H2 WAT 1890 55.813 113.443 133.586 1.00 0.00 H TER 17241 WAT 1890 ATOM 17241 O WAT 1891 105.761 95.238 123.871 1.00 0.00 O ATOM 17242 H1 WAT 1891 105.559 94.745 124.667 1.00 0.00 H ATOM 17243 H2 WAT 1891 106.263 94.627 123.332 1.00 0.00 H TER 17245 WAT 1891 ATOM 17245 O WAT 1892 4.721 68.754 79.004 1.00 0.00 O ATOM 17246 H1 WAT 1892 5.359 68.366 78.406 1.00 0.00 H ATOM 17247 H2 WAT 1892 3.903 68.765 78.508 1.00 0.00 H TER 17249 WAT 1892 ATOM 17249 O WAT 1893 142.287 63.718 107.553 1.00 0.00 O ATOM 17250 H1 WAT 1893 141.963 63.214 108.299 1.00 0.00 H ATOM 17251 H2 WAT 1893 143.120 63.305 107.329 1.00 0.00 H TER 17253 WAT 1893 ATOM 17253 O WAT 1894 9.566 19.304 84.271 1.00 0.00 O ATOM 17254 H1 WAT 1894 10.373 19.813 84.205 1.00 0.00 H ATOM 17255 H2 WAT 1894 9.103 19.481 83.452 1.00 0.00 H TER 17257 WAT 1894 ATOM 17257 O WAT 1895 75.644 50.110 56.420 1.00 0.00 O ATOM 17258 H1 WAT 1895 74.824 50.419 56.034 1.00 0.00 H ATOM 17259 H2 WAT 1895 75.417 49.897 57.325 1.00 0.00 H TER 17261 WAT 1895 ATOM 17261 O WAT 1896 60.540 97.038 69.646 1.00 0.00 O ATOM 17262 H1 WAT 1896 61.125 96.348 69.331 1.00 0.00 H ATOM 17263 H2 WAT 1896 60.073 96.639 70.379 1.00 0.00 H TER 17265 WAT 1896 ATOM 17265 O WAT 1897 54.923 58.137 63.583 1.00 0.00 O ATOM 17266 H1 WAT 1897 55.265 57.314 63.931 1.00 0.00 H ATOM 17267 H2 WAT 1897 55.702 58.634 63.333 1.00 0.00 H TER 17269 WAT 1897 ATOM 17269 O WAT 1898 44.697 74.649 141.658 1.00 0.00 O ATOM 17270 H1 WAT 1898 44.899 73.716 141.738 1.00 0.00 H ATOM 17271 H2 WAT 1898 45.359 75.084 142.196 1.00 0.00 H TER 17273 WAT 1898 ATOM 17273 O WAT 1899 42.942 91.974 99.514 1.00 0.00 O ATOM 17274 H1 WAT 1899 42.444 91.691 100.281 1.00 0.00 H ATOM 17275 H2 WAT 1899 43.726 92.386 99.876 1.00 0.00 H TER 17277 WAT 1899 ATOM 17277 O WAT 1900 43.495 85.622 121.268 1.00 0.00 O ATOM 17278 H1 WAT 1900 43.947 84.905 121.714 1.00 0.00 H ATOM 17279 H2 WAT 1900 43.064 86.108 121.970 1.00 0.00 H TER 17281 WAT 1900 ATOM 17281 O WAT 1901 109.415 70.114 83.809 1.00 0.00 O ATOM 17282 H1 WAT 1901 108.754 69.431 83.928 1.00 0.00 H ATOM 17283 H2 WAT 1901 109.168 70.546 82.991 1.00 0.00 H TER 17285 WAT 1901 ATOM 17285 O WAT 1902 135.628 15.225 8.140 1.00 0.00 O ATOM 17286 H1 WAT 1902 136.136 16.020 8.305 1.00 0.00 H ATOM 17287 H2 WAT 1902 134.912 15.262 8.774 1.00 0.00 H TER 17289 WAT 1902 ATOM 17289 O WAT 1903 44.154 19.833 152.800 1.00 0.00 O ATOM 17290 H1 WAT 1903 43.326 20.211 152.503 1.00 0.00 H ATOM 17291 H2 WAT 1903 44.810 20.190 152.201 1.00 0.00 H TER 17293 WAT 1903 ATOM 17293 O WAT 1904 122.138 59.934 113.649 1.00 0.00 O ATOM 17294 H1 WAT 1904 121.565 60.625 113.317 1.00 0.00 H ATOM 17295 H2 WAT 1904 122.995 60.352 113.732 1.00 0.00 H TER 17297 WAT 1904 ATOM 17297 O WAT 1905 4.146 4.879 113.511 1.00 0.00 O ATOM 17298 H1 WAT 1905 3.602 4.446 114.168 1.00 0.00 H ATOM 17299 H2 WAT 1905 4.316 5.748 113.875 1.00 0.00 H TER 17301 WAT 1905 ATOM 17301 O WAT 1906 12.852 76.578 11.669 1.00 0.00 O ATOM 17302 H1 WAT 1906 12.660 76.993 12.510 1.00 0.00 H ATOM 17303 H2 WAT 1906 13.264 77.268 11.150 1.00 0.00 H TER 17305 WAT 1906 ATOM 17305 O WAT 1907 53.946 13.597 64.308 1.00 0.00 O ATOM 17306 H1 WAT 1907 53.010 13.428 64.411 1.00 0.00 H ATOM 17307 H2 WAT 1907 54.326 12.738 64.121 1.00 0.00 H TER 17309 WAT 1907 ATOM 17309 O WAT 1908 128.335 106.992 124.525 1.00 0.00 O ATOM 17310 H1 WAT 1908 128.283 106.737 125.447 1.00 0.00 H ATOM 17311 H2 WAT 1908 127.786 107.774 124.462 1.00 0.00 H TER 17313 WAT 1908 ATOM 17313 O WAT 1909 89.182 81.746 106.335 1.00 0.00 O ATOM 17314 H1 WAT 1909 90.103 81.491 106.400 1.00 0.00 H ATOM 17315 H2 WAT 1909 89.084 82.057 105.435 1.00 0.00 H TER 17317 WAT 1909 ATOM 17317 O WAT 1910 117.359 88.691 8.111 1.00 0.00 O ATOM 17318 H1 WAT 1910 117.848 87.869 8.085 1.00 0.00 H ATOM 17319 H2 WAT 1910 117.561 89.116 7.277 1.00 0.00 H TER 17321 WAT 1910 ATOM 17321 O WAT 1911 58.856 10.556 68.016 1.00 0.00 O ATOM 17322 H1 WAT 1911 59.343 11.169 67.465 1.00 0.00 H ATOM 17323 H2 WAT 1911 58.165 10.218 67.446 1.00 0.00 H TER 17325 WAT 1911 ATOM 17325 O WAT 1912 35.756 7.324 137.580 1.00 0.00 O ATOM 17326 H1 WAT 1912 35.781 7.308 138.536 1.00 0.00 H ATOM 17327 H2 WAT 1912 36.521 7.843 137.329 1.00 0.00 H TER 17329 WAT 1912 ATOM 17329 O WAT 1913 109.969 126.144 16.444 1.00 0.00 O ATOM 17330 H1 WAT 1913 109.737 126.481 17.309 1.00 0.00 H ATOM 17331 H2 WAT 1913 109.770 125.208 16.491 1.00 0.00 H TER 17333 WAT 1913 ATOM 17333 O WAT 1914 43.247 7.795 100.304 1.00 0.00 O ATOM 17334 H1 WAT 1914 43.160 7.974 99.368 1.00 0.00 H ATOM 17335 H2 WAT 1914 42.350 7.818 100.637 1.00 0.00 H TER 17337 WAT 1914 ATOM 17337 O WAT 1915 91.519 37.911 59.830 1.00 0.00 O ATOM 17338 H1 WAT 1915 91.795 37.517 59.002 1.00 0.00 H ATOM 17339 H2 WAT 1915 92.062 38.695 59.916 1.00 0.00 H TER 17341 WAT 1915 ATOM 17341 O WAT 1916 6.522 64.123 94.773 1.00 0.00 O ATOM 17342 H1 WAT 1916 5.625 63.911 94.517 1.00 0.00 H ATOM 17343 H2 WAT 1916 6.472 65.019 95.105 1.00 0.00 H TER 17345 WAT 1916 ATOM 17345 O WAT 1917 79.535 40.673 64.244 1.00 0.00 O ATOM 17346 H1 WAT 1917 78.746 40.875 64.748 1.00 0.00 H ATOM 17347 H2 WAT 1917 80.012 41.502 64.204 1.00 0.00 H TER 17349 WAT 1917 ATOM 17349 O WAT 1918 98.464 39.188 127.657 1.00 0.00 O ATOM 17350 H1 WAT 1918 98.931 39.895 127.212 1.00 0.00 H ATOM 17351 H2 WAT 1918 98.348 39.504 128.553 1.00 0.00 H TER 17353 WAT 1918 ATOM 17353 O WAT 1919 100.384 97.145 125.803 1.00 0.00 O ATOM 17354 H1 WAT 1919 100.013 97.863 126.316 1.00 0.00 H ATOM 17355 H2 WAT 1919 101.216 96.948 126.235 1.00 0.00 H TER 17357 WAT 1919 ATOM 17357 O WAT 1920 139.124 13.685 81.955 1.00 0.00 O ATOM 17358 H1 WAT 1920 138.510 13.195 82.503 1.00 0.00 H ATOM 17359 H2 WAT 1920 139.969 13.586 82.394 1.00 0.00 H TER 17361 WAT 1920 ATOM 17361 O WAT 1921 33.404 55.651 12.304 1.00 0.00 O ATOM 17362 H1 WAT 1921 32.598 55.136 12.259 1.00 0.00 H ATOM 17363 H2 WAT 1921 34.021 55.090 12.773 1.00 0.00 H TER 17365 WAT 1921 ATOM 17365 O WAT 1922 137.907 142.546 59.471 1.00 0.00 O ATOM 17366 H1 WAT 1922 138.121 142.335 58.562 1.00 0.00 H ATOM 17367 H2 WAT 1922 137.022 142.204 59.594 1.00 0.00 H TER 17369 WAT 1922 ATOM 17369 O WAT 1923 103.182 106.226 71.312 1.00 0.00 O ATOM 17370 H1 WAT 1923 103.276 107.175 71.392 1.00 0.00 H ATOM 17371 H2 WAT 1923 103.467 105.884 72.160 1.00 0.00 H TER 17373 WAT 1923 ATOM 17373 O WAT 1924 50.578 10.750 97.983 1.00 0.00 O ATOM 17374 H1 WAT 1924 51.498 10.996 97.889 1.00 0.00 H ATOM 17375 H2 WAT 1924 50.464 10.014 97.382 1.00 0.00 H TER 17377 WAT 1924 ATOM 17377 O WAT 1925 75.383 24.605 139.257 1.00 0.00 O ATOM 17378 H1 WAT 1925 75.500 25.364 139.829 1.00 0.00 H ATOM 17379 H2 WAT 1925 74.645 24.129 139.637 1.00 0.00 H TER 17381 WAT 1925 ATOM 17381 O WAT 1926 57.404 109.052 58.555 1.00 0.00 O ATOM 17382 H1 WAT 1926 57.633 109.494 59.373 1.00 0.00 H ATOM 17383 H2 WAT 1926 57.230 108.147 58.813 1.00 0.00 H TER 17385 WAT 1926 ATOM 17385 O WAT 1927 143.888 127.616 1.826 1.00 0.00 O ATOM 17386 H1 WAT 1927 144.250 128.406 2.227 1.00 0.00 H ATOM 17387 H2 WAT 1927 144.240 126.898 2.352 1.00 0.00 H TER 17389 WAT 1927 ATOM 17389 O WAT 1928 119.542 0.038 136.156 1.00 0.00 O ATOM 17390 H1 WAT 1928 120.358 0.180 136.635 1.00 0.00 H ATOM 17391 H2 WAT 1928 119.665 0.505 135.330 1.00 0.00 H TER 17393 WAT 1928 ATOM 17393 O WAT 1929 102.977 114.208 122.449 1.00 0.00 O ATOM 17394 H1 WAT 1929 103.107 113.747 123.278 1.00 0.00 H ATOM 17395 H2 WAT 1929 102.507 113.583 121.898 1.00 0.00 H TER 17397 WAT 1929 ATOM 17397 O WAT 1930 26.041 86.766 16.379 1.00 0.00 O ATOM 17398 H1 WAT 1930 26.258 86.158 15.673 1.00 0.00 H ATOM 17399 H2 WAT 1930 25.160 86.511 16.653 1.00 0.00 H TER 17401 WAT 1930 ATOM 17401 O WAT 1931 3.048 23.379 3.796 1.00 0.00 O ATOM 17402 H1 WAT 1931 2.657 22.512 3.690 1.00 0.00 H ATOM 17403 H2 WAT 1931 3.021 23.540 4.740 1.00 0.00 H TER 17405 WAT 1931 ATOM 17405 O WAT 1932 113.074 117.275 154.265 1.00 0.00 O ATOM 17406 H1 WAT 1932 112.157 117.013 154.181 1.00 0.00 H ATOM 17407 H2 WAT 1932 113.552 116.651 153.719 1.00 0.00 H TER 17409 WAT 1932 ATOM 17409 O WAT 1933 106.478 81.019 63.090 1.00 0.00 O ATOM 17410 H1 WAT 1933 106.476 81.526 63.902 1.00 0.00 H ATOM 17411 H2 WAT 1933 106.131 81.619 62.431 1.00 0.00 H TER 17413 WAT 1933 ATOM 17413 O WAT 1934 56.674 90.336 151.638 1.00 0.00 O ATOM 17414 H1 WAT 1934 55.851 90.821 151.580 1.00 0.00 H ATOM 17415 H2 WAT 1934 56.408 89.427 151.773 1.00 0.00 H TER 17417 WAT 1934 ATOM 17417 O WAT 1935 37.259 51.698 6.050 1.00 0.00 O ATOM 17418 H1 WAT 1935 37.125 51.962 5.140 1.00 0.00 H ATOM 17419 H2 WAT 1935 38.141 52.004 6.261 1.00 0.00 H TER 17421 WAT 1935 ATOM 17421 O WAT 1936 37.409 139.047 102.637 1.00 0.00 O ATOM 17422 H1 WAT 1936 37.757 139.832 102.214 1.00 0.00 H ATOM 17423 H2 WAT 1936 37.794 138.320 102.147 1.00 0.00 H TER 17425 WAT 1936 ATOM 17425 O WAT 1937 125.516 27.733 17.078 1.00 0.00 O ATOM 17426 H1 WAT 1937 125.761 28.459 16.505 1.00 0.00 H ATOM 17427 H2 WAT 1937 125.658 28.067 17.963 1.00 0.00 H TER 17429 WAT 1937 ATOM 17429 O WAT 1938 46.123 51.907 79.656 1.00 0.00 O ATOM 17430 H1 WAT 1938 45.265 52.236 79.924 1.00 0.00 H ATOM 17431 H2 WAT 1938 46.746 52.529 80.031 1.00 0.00 H TER 17433 WAT 1938 ATOM 17433 O WAT 1939 87.475 90.541 1.645 1.00 0.00 O ATOM 17434 H1 WAT 1939 87.517 91.041 2.460 1.00 0.00 H ATOM 17435 H2 WAT 1939 87.167 89.675 1.910 1.00 0.00 H TER 17437 WAT 1939 ATOM 17437 O WAT 1940 42.244 18.786 70.605 1.00 0.00 O ATOM 17438 H1 WAT 1940 42.689 19.537 70.214 1.00 0.00 H ATOM 17439 H2 WAT 1940 41.853 18.325 69.863 1.00 0.00 H TER 17441 WAT 1940 ATOM 17441 O WAT 1941 63.984 68.003 150.970 1.00 0.00 O ATOM 17442 H1 WAT 1941 64.785 68.521 150.900 1.00 0.00 H ATOM 17443 H2 WAT 1941 63.284 68.608 150.723 1.00 0.00 H TER 17445 WAT 1941 ATOM 17445 O WAT 1942 0.845 37.157 122.292 1.00 0.00 O ATOM 17446 H1 WAT 1942 -0.016 37.462 122.006 1.00 0.00 H ATOM 17447 H2 WAT 1942 0.955 37.535 123.164 1.00 0.00 H TER 17449 WAT 1942 ATOM 17449 O WAT 1943 21.439 10.308 75.701 1.00 0.00 O ATOM 17450 H1 WAT 1943 21.938 10.383 74.888 1.00 0.00 H ATOM 17451 H2 WAT 1943 21.922 10.844 76.330 1.00 0.00 H TER 17453 WAT 1943 ATOM 17453 O WAT 1944 8.171 72.156 114.698 1.00 0.00 O ATOM 17454 H1 WAT 1944 7.968 71.984 115.618 1.00 0.00 H ATOM 17455 H2 WAT 1944 9.110 72.343 114.691 1.00 0.00 H TER 17457 WAT 1944 ATOM 17457 O WAT 1945 37.254 131.138 119.891 1.00 0.00 O ATOM 17458 H1 WAT 1945 37.763 131.668 120.505 1.00 0.00 H ATOM 17459 H2 WAT 1945 36.389 131.068 120.295 1.00 0.00 H TER 17461 WAT 1945 ATOM 17461 O WAT 1946 90.536 14.191 65.426 1.00 0.00 O ATOM 17462 H1 WAT 1946 90.239 13.284 65.495 1.00 0.00 H ATOM 17463 H2 WAT 1946 91.229 14.267 66.082 1.00 0.00 H TER 17465 WAT 1946 ATOM 17465 O WAT 1947 82.057 49.241 98.582 1.00 0.00 O ATOM 17466 H1 WAT 1947 82.956 49.565 98.529 1.00 0.00 H ATOM 17467 H2 WAT 1947 81.599 49.892 99.113 1.00 0.00 H TER 17469 WAT 1947 ATOM 17469 O WAT 1948 72.048 34.112 116.607 1.00 0.00 O ATOM 17470 H1 WAT 1948 71.702 34.968 116.860 1.00 0.00 H ATOM 17471 H2 WAT 1948 72.299 33.701 117.435 1.00 0.00 H TER 17473 WAT 1948 ATOM 17473 O WAT 1949 26.452 91.768 64.720 1.00 0.00 O ATOM 17474 H1 WAT 1949 26.927 91.363 65.445 1.00 0.00 H ATOM 17475 H2 WAT 1949 26.131 91.030 64.201 1.00 0.00 H TER 17477 WAT 1949 ATOM 17477 O WAT 1950 92.848 32.019 103.615 1.00 0.00 O ATOM 17478 H1 WAT 1950 92.617 32.915 103.861 1.00 0.00 H ATOM 17479 H2 WAT 1950 93.790 31.963 103.771 1.00 0.00 H TER 17481 WAT 1950 ATOM 17481 O WAT 1951 0.047 137.002 116.973 1.00 0.00 O ATOM 17482 H1 WAT 1951 0.746 136.632 116.433 1.00 0.00 H ATOM 17483 H2 WAT 1951 -0.726 136.985 116.410 1.00 0.00 H TER 17485 WAT 1951 ATOM 17485 O WAT 1952 9.370 67.087 100.240 1.00 0.00 O ATOM 17486 H1 WAT 1952 9.219 66.599 99.431 1.00 0.00 H ATOM 17487 H2 WAT 1952 8.494 67.305 100.556 1.00 0.00 H TER 17489 WAT 1952 ATOM 17489 O WAT 1953 78.813 101.622 153.811 1.00 0.00 O ATOM 17490 H1 WAT 1953 78.564 102.232 154.505 1.00 0.00 H ATOM 17491 H2 WAT 1953 78.595 102.081 152.999 1.00 0.00 H TER 17493 WAT 1953 ATOM 17493 O WAT 1954 134.360 141.742 75.379 1.00 0.00 O ATOM 17494 H1 WAT 1954 133.871 142.231 76.041 1.00 0.00 H ATOM 17495 H2 WAT 1954 134.512 142.374 74.677 1.00 0.00 H TER 17497 WAT 1954 ATOM 17497 O WAT 1955 99.019 129.836 156.745 1.00 0.00 O ATOM 17498 H1 WAT 1955 99.837 129.799 156.248 1.00 0.00 H ATOM 17499 H2 WAT 1955 98.956 128.979 157.166 1.00 0.00 H TER 17501 WAT 1955 ATOM 17501 O WAT 1956 139.544 20.409 64.313 1.00 0.00 O ATOM 17502 H1 WAT 1956 139.414 20.947 63.532 1.00 0.00 H ATOM 17503 H2 WAT 1956 139.389 19.512 64.015 1.00 0.00 H TER 17505 WAT 1956 ATOM 17505 O WAT 1957 73.278 76.449 22.369 1.00 0.00 O ATOM 17506 H1 WAT 1957 73.375 76.053 23.235 1.00 0.00 H ATOM 17507 H2 WAT 1957 72.593 77.108 22.482 1.00 0.00 H TER 17509 WAT 1957 ATOM 17509 O WAT 1958 33.301 85.522 78.522 1.00 0.00 O ATOM 17510 H1 WAT 1958 33.561 85.780 77.637 1.00 0.00 H ATOM 17511 H2 WAT 1958 32.673 84.812 78.389 1.00 0.00 H TER 17513 WAT 1958 ATOM 17513 O WAT 1959 123.827 81.979 153.424 1.00 0.00 O ATOM 17514 H1 WAT 1959 124.164 82.259 152.573 1.00 0.00 H ATOM 17515 H2 WAT 1959 123.397 81.142 153.248 1.00 0.00 H TER 17517 WAT 1959 ATOM 17517 O WAT 1960 9.035 47.964 68.693 1.00 0.00 O ATOM 17518 H1 WAT 1960 8.510 48.253 67.947 1.00 0.00 H ATOM 17519 H2 WAT 1960 9.626 48.696 68.868 1.00 0.00 H TER 17521 WAT 1960 ATOM 17521 O WAT 1961 100.090 90.930 125.674 1.00 0.00 O ATOM 17522 H1 WAT 1961 100.819 90.313 125.741 1.00 0.00 H ATOM 17523 H2 WAT 1961 99.322 90.378 125.529 1.00 0.00 H TER 17525 WAT 1961 ATOM 17525 O WAT 1962 62.515 134.386 110.400 1.00 0.00 O ATOM 17526 H1 WAT 1962 62.246 135.218 110.010 1.00 0.00 H ATOM 17527 H2 WAT 1962 63.030 134.636 111.167 1.00 0.00 H TER 17529 WAT 1962 ATOM 17529 O WAT 1963 50.379 136.159 101.433 1.00 0.00 O ATOM 17530 H1 WAT 1963 50.211 135.273 101.754 1.00 0.00 H ATOM 17531 H2 WAT 1963 49.765 136.272 100.707 1.00 0.00 H TER 17533 WAT 1963 ATOM 17533 O WAT 1964 142.432 123.427 146.817 1.00 0.00 O ATOM 17534 H1 WAT 1964 143.226 123.283 147.332 1.00 0.00 H ATOM 17535 H2 WAT 1964 142.716 123.332 145.908 1.00 0.00 H TER 17537 WAT 1964 ATOM 17537 O WAT 1965 23.641 102.721 62.730 1.00 0.00 O ATOM 17538 H1 WAT 1965 23.753 103.518 62.212 1.00 0.00 H ATOM 17539 H2 WAT 1965 22.751 102.430 62.532 1.00 0.00 H TER 17541 WAT 1965 ATOM 17541 O WAT 1966 101.427 8.255 155.043 1.00 0.00 O ATOM 17542 H1 WAT 1966 100.794 7.773 154.512 1.00 0.00 H ATOM 17543 H2 WAT 1966 100.897 8.872 155.547 1.00 0.00 H TER 17545 WAT 1966 ATOM 17545 O WAT 1967 67.165 12.922 20.411 1.00 0.00 O ATOM 17546 H1 WAT 1967 66.741 12.085 20.219 1.00 0.00 H ATOM 17547 H2 WAT 1967 67.805 12.716 21.092 1.00 0.00 H TER 17549 WAT 1967 ATOM 17549 O WAT 1968 142.819 1.132 147.068 1.00 0.00 O ATOM 17550 H1 WAT 1968 142.184 0.834 146.416 1.00 0.00 H ATOM 17551 H2 WAT 1968 143.094 1.994 146.757 1.00 0.00 H TER 17553 WAT 1968 ATOM 17553 O WAT 1969 105.947 24.592 110.992 1.00 0.00 O ATOM 17554 H1 WAT 1969 105.393 24.524 111.770 1.00 0.00 H ATOM 17555 H2 WAT 1969 106.220 25.509 110.971 1.00 0.00 H TER 17557 WAT 1969 ATOM 17557 O WAT 1970 112.870 119.613 114.093 1.00 0.00 O ATOM 17558 H1 WAT 1970 112.771 120.222 113.362 1.00 0.00 H ATOM 17559 H2 WAT 1970 112.161 119.843 114.694 1.00 0.00 H TER 17561 WAT 1970 ATOM 17561 O WAT 1971 130.859 100.139 146.576 1.00 0.00 O ATOM 17562 H1 WAT 1971 131.587 100.757 146.639 1.00 0.00 H ATOM 17563 H2 WAT 1971 130.980 99.712 145.728 1.00 0.00 H TER 17565 WAT 1971 ATOM 17565 O WAT 1972 135.758 141.426 153.336 1.00 0.00 O ATOM 17566 H1 WAT 1972 136.584 141.570 152.874 1.00 0.00 H ATOM 17567 H2 WAT 1972 135.092 141.447 152.650 1.00 0.00 H TER 17569 WAT 1972 ATOM 17569 O WAT 1973 99.322 31.450 147.167 1.00 0.00 O ATOM 17570 H1 WAT 1973 98.593 31.363 147.782 1.00 0.00 H ATOM 17571 H2 WAT 1973 99.946 32.021 147.615 1.00 0.00 H TER 17573 WAT 1973 ATOM 17573 O WAT 1974 101.777 9.384 152.062 1.00 0.00 O ATOM 17574 H1 WAT 1974 101.481 9.036 152.903 1.00 0.00 H ATOM 17575 H2 WAT 1974 101.748 8.633 151.469 1.00 0.00 H TER 17577 WAT 1974 ATOM 17577 O WAT 1975 90.525 78.226 105.972 1.00 0.00 O ATOM 17578 H1 WAT 1975 89.867 78.542 105.353 1.00 0.00 H ATOM 17579 H2 WAT 1975 90.050 78.128 106.797 1.00 0.00 H TER 17581 WAT 1975 ATOM 17581 O WAT 1976 88.330 36.292 94.779 1.00 0.00 O ATOM 17582 H1 WAT 1976 87.591 36.782 95.139 1.00 0.00 H ATOM 17583 H2 WAT 1976 87.926 35.585 94.276 1.00 0.00 H TER 17585 WAT 1976 ATOM 17585 O WAT 1977 87.192 132.424 21.285 1.00 0.00 O ATOM 17586 H1 WAT 1977 87.088 132.577 22.224 1.00 0.00 H ATOM 17587 H2 WAT 1977 88.138 132.348 21.158 1.00 0.00 H TER 17589 WAT 1977 ATOM 17589 O WAT 1978 41.990 131.881 9.679 1.00 0.00 O ATOM 17590 H1 WAT 1978 42.822 131.586 9.310 1.00 0.00 H ATOM 17591 H2 WAT 1978 41.702 131.154 10.231 1.00 0.00 H TER 17593 WAT 1978 ATOM 17593 O WAT 1979 14.741 141.670 20.124 1.00 0.00 O ATOM 17594 H1 WAT 1979 13.834 141.430 20.314 1.00 0.00 H ATOM 17595 H2 WAT 1979 15.181 140.836 19.963 1.00 0.00 H TER 17597 WAT 1979 ATOM 17597 O WAT 1980 144.094 118.024 125.860 1.00 0.00 O ATOM 17598 H1 WAT 1980 144.985 118.001 125.509 1.00 0.00 H ATOM 17599 H2 WAT 1980 143.936 117.133 126.170 1.00 0.00 H TER 17601 WAT 1980 ATOM 17601 O WAT 1981 138.163 63.697 81.732 1.00 0.00 O ATOM 17602 H1 WAT 1981 137.923 63.934 82.628 1.00 0.00 H ATOM 17603 H2 WAT 1981 138.742 64.403 81.444 1.00 0.00 H TER 17605 WAT 1981 ATOM 17605 O WAT 1982 32.364 59.697 115.575 1.00 0.00 O ATOM 17606 H1 WAT 1982 32.082 59.130 116.293 1.00 0.00 H ATOM 17607 H2 WAT 1982 32.989 59.166 115.081 1.00 0.00 H TER 17609 WAT 1982 ATOM 17609 O WAT 1983 54.039 94.734 135.792 1.00 0.00 O ATOM 17610 H1 WAT 1983 54.036 94.927 136.729 1.00 0.00 H ATOM 17611 H2 WAT 1983 53.123 94.549 135.583 1.00 0.00 H TER 17613 WAT 1983 ATOM 17613 O WAT 1984 46.645 136.943 72.071 1.00 0.00 O ATOM 17614 H1 WAT 1984 47.580 136.742 72.082 1.00 0.00 H ATOM 17615 H2 WAT 1984 46.557 137.704 72.645 1.00 0.00 H TER 17617 WAT 1984 ATOM 17617 O WAT 1985 73.805 62.664 79.097 1.00 0.00 O ATOM 17618 H1 WAT 1985 73.694 62.142 78.303 1.00 0.00 H ATOM 17619 H2 WAT 1985 73.977 63.550 78.778 1.00 0.00 H TER 17621 WAT 1985 ATOM 17621 O WAT 1986 83.138 68.267 156.128 1.00 0.00 O ATOM 17622 H1 WAT 1986 83.772 68.903 156.461 1.00 0.00 H ATOM 17623 H2 WAT 1986 82.343 68.777 155.977 1.00 0.00 H TER 17625 WAT 1986 ATOM 17625 O WAT 1987 114.148 134.769 103.782 1.00 0.00 O ATOM 17626 H1 WAT 1987 114.837 134.270 104.220 1.00 0.00 H ATOM 17627 H2 WAT 1987 113.465 134.868 104.445 1.00 0.00 H TER 17629 WAT 1987 ATOM 17629 O WAT 1988 82.823 121.492 73.430 1.00 0.00 O ATOM 17630 H1 WAT 1988 82.497 120.929 72.728 1.00 0.00 H ATOM 17631 H2 WAT 1988 83.759 121.582 73.250 1.00 0.00 H TER 17633 WAT 1988 ATOM 17633 O WAT 1989 13.143 4.647 91.509 1.00 0.00 O ATOM 17634 H1 WAT 1989 12.681 4.371 90.717 1.00 0.00 H ATOM 17635 H2 WAT 1989 12.464 5.039 92.058 1.00 0.00 H TER 17637 WAT 1989 ATOM 17637 O WAT 1990 126.677 90.368 102.651 1.00 0.00 O ATOM 17638 H1 WAT 1990 127.482 90.348 103.169 1.00 0.00 H ATOM 17639 H2 WAT 1990 126.580 91.286 102.396 1.00 0.00 H TER 17641 WAT 1990 ATOM 17641 O WAT 1991 127.648 131.733 82.685 1.00 0.00 O ATOM 17642 H1 WAT 1991 127.219 132.450 82.218 1.00 0.00 H ATOM 17643 H2 WAT 1991 127.854 131.093 82.005 1.00 0.00 H TER 17645 WAT 1991 ATOM 17645 O WAT 1992 99.833 122.347 95.536 1.00 0.00 O ATOM 17646 H1 WAT 1992 99.436 121.529 95.835 1.00 0.00 H ATOM 17647 H2 WAT 1992 99.101 122.960 95.474 1.00 0.00 H TER 17649 WAT 1992 ATOM 17649 O WAT 1993 50.065 92.698 23.153 1.00 0.00 O ATOM 17650 H1 WAT 1993 49.637 92.854 23.995 1.00 0.00 H ATOM 17651 H2 WAT 1993 50.731 92.036 23.343 1.00 0.00 H TER 17653 WAT 1993 ATOM 17653 O WAT 1994 125.032 94.126 89.834 1.00 0.00 O ATOM 17654 H1 WAT 1994 125.629 94.850 89.643 1.00 0.00 H ATOM 17655 H2 WAT 1994 125.003 94.086 90.790 1.00 0.00 H TER 17657 WAT 1994 ATOM 17657 O WAT 1995 89.974 15.614 155.949 1.00 0.00 O ATOM 17658 H1 WAT 1995 90.381 14.816 155.611 1.00 0.00 H ATOM 17659 H2 WAT 1995 89.035 15.429 155.931 1.00 0.00 H TER 17661 WAT 1995 ATOM 17661 O WAT 1996 28.743 93.577 110.293 1.00 0.00 O ATOM 17662 H1 WAT 1996 27.866 93.951 110.210 1.00 0.00 H ATOM 17663 H2 WAT 1996 29.049 93.872 111.151 1.00 0.00 H TER 17665 WAT 1996 ATOM 17665 O WAT 1997 36.079 35.811 109.836 1.00 0.00 O ATOM 17666 H1 WAT 1997 36.836 35.235 109.728 1.00 0.00 H ATOM 17667 H2 WAT 1997 35.563 35.680 109.040 1.00 0.00 H TER 17669 WAT 1997 ATOM 17669 O WAT 1998 50.491 133.358 120.291 1.00 0.00 O ATOM 17670 H1 WAT 1998 51.224 133.616 119.732 1.00 0.00 H ATOM 17671 H2 WAT 1998 49.732 133.803 119.912 1.00 0.00 H TER 17673 WAT 1998 ATOM 17673 O WAT 1999 79.728 45.922 90.107 1.00 0.00 O ATOM 17674 H1 WAT 1999 80.109 46.748 89.807 1.00 0.00 H ATOM 17675 H2 WAT 1999 78.838 45.928 89.755 1.00 0.00 H TER 17677 WAT 1999 ATOM 17677 O WAT 2000 55.886 114.060 125.097 1.00 0.00 O ATOM 17678 H1 WAT 2000 55.091 113.594 125.356 1.00 0.00 H ATOM 17679 H2 WAT 2000 56.390 113.416 124.599 1.00 0.00 H TER 17681 WAT 2000 ATOM 17681 O WAT 2001 126.468 17.012 61.839 1.00 0.00 O ATOM 17682 H1 WAT 2001 127.034 17.779 61.752 1.00 0.00 H ATOM 17683 H2 WAT 2001 126.966 16.300 61.438 1.00 0.00 H TER 17685 WAT 2001 ATOM 17685 O WAT 2002 5.318 122.922 95.660 1.00 0.00 O ATOM 17686 H1 WAT 2002 4.867 122.639 94.864 1.00 0.00 H ATOM 17687 H2 WAT 2002 5.739 122.129 95.991 1.00 0.00 H TER 17689 WAT 2002 ATOM 17689 O WAT 2003 78.076 37.748 6.097 1.00 0.00 O ATOM 17690 H1 WAT 2003 78.124 38.661 6.381 1.00 0.00 H ATOM 17691 H2 WAT 2003 77.514 37.324 6.746 1.00 0.00 H TER 17693 WAT 2003 ATOM 17693 O WAT 2004 71.994 112.899 21.241 1.00 0.00 O ATOM 17694 H1 WAT 2004 72.053 112.161 21.848 1.00 0.00 H ATOM 17695 H2 WAT 2004 72.214 113.664 21.773 1.00 0.00 H TER 17697 WAT 2004 ATOM 17697 O WAT 2005 112.672 0.709 156.780 1.00 0.00 O ATOM 17698 H1 WAT 2005 113.404 0.882 156.188 1.00 0.00 H ATOM 17699 H2 WAT 2005 112.002 1.342 156.524 1.00 0.00 H TER 17701 WAT 2005 ATOM 17701 O WAT 2006 21.421 115.639 63.101 1.00 0.00 O ATOM 17702 H1 WAT 2006 21.245 116.486 63.510 1.00 0.00 H ATOM 17703 H2 WAT 2006 20.593 115.164 63.168 1.00 0.00 H TER 17705 WAT 2006 ATOM 17705 O WAT 2007 31.489 115.529 65.786 1.00 0.00 O ATOM 17706 H1 WAT 2007 30.734 116.102 65.917 1.00 0.00 H ATOM 17707 H2 WAT 2007 31.238 114.964 65.056 1.00 0.00 H TER 17709 WAT 2007 ATOM 17709 O WAT 2008 103.421 35.365 60.026 1.00 0.00 O ATOM 17710 H1 WAT 2008 102.549 35.294 59.639 1.00 0.00 H ATOM 17711 H2 WAT 2008 104.020 35.284 59.284 1.00 0.00 H TER 17713 WAT 2008 ATOM 17713 O WAT 2009 62.894 16.923 81.734 1.00 0.00 O ATOM 17714 H1 WAT 2009 63.053 17.865 81.678 1.00 0.00 H ATOM 17715 H2 WAT 2009 63.397 16.552 81.008 1.00 0.00 H TER 17717 WAT 2009 ATOM 17717 O WAT 2010 18.118 86.969 109.173 1.00 0.00 O ATOM 17718 H1 WAT 2010 18.880 87.313 108.707 1.00 0.00 H ATOM 17719 H2 WAT 2010 18.488 86.471 109.902 1.00 0.00 H TER 17721 WAT 2010 ATOM 17721 O WAT 2011 43.253 42.322 141.346 1.00 0.00 O ATOM 17722 H1 WAT 2011 42.637 41.966 141.987 1.00 0.00 H ATOM 17723 H2 WAT 2011 43.148 43.271 141.415 1.00 0.00 H TER 17725 WAT 2011 ATOM 17725 O WAT 2012 38.058 5.982 80.701 1.00 0.00 O ATOM 17726 H1 WAT 2012 38.235 5.057 80.530 1.00 0.00 H ATOM 17727 H2 WAT 2012 38.581 6.451 80.051 1.00 0.00 H TER 17729 WAT 2012 ATOM 17729 O WAT 2013 76.665 130.622 135.929 1.00 0.00 O ATOM 17730 H1 WAT 2013 76.169 131.441 135.897 1.00 0.00 H ATOM 17731 H2 WAT 2013 77.524 130.876 136.266 1.00 0.00 H TER 17733 WAT 2013 ATOM 17733 O WAT 2014 14.459 136.313 124.254 1.00 0.00 O ATOM 17734 H1 WAT 2014 14.527 136.138 123.316 1.00 0.00 H ATOM 17735 H2 WAT 2014 14.724 137.228 124.347 1.00 0.00 H TER 17737 WAT 2014 ATOM 17737 O WAT 2015 1.572 53.745 61.865 1.00 0.00 O ATOM 17738 H1 WAT 2015 1.856 53.652 60.956 1.00 0.00 H ATOM 17739 H2 WAT 2015 0.977 54.495 61.855 1.00 0.00 H TER 17741 WAT 2015 ATOM 17741 O WAT 2016 85.306 46.074 117.208 1.00 0.00 O ATOM 17742 H1 WAT 2016 85.460 45.989 116.267 1.00 0.00 H ATOM 17743 H2 WAT 2016 85.123 47.005 117.337 1.00 0.00 H TER 17745 WAT 2016 ATOM 17745 O WAT 2017 35.872 97.968 106.621 1.00 0.00 O ATOM 17746 H1 WAT 2017 36.190 97.068 106.541 1.00 0.00 H ATOM 17747 H2 WAT 2017 36.207 98.410 105.841 1.00 0.00 H TER 17749 WAT 2017 ATOM 17749 O WAT 2018 132.689 139.488 138.999 1.00 0.00 O ATOM 17750 H1 WAT 2018 132.955 138.819 139.630 1.00 0.00 H ATOM 17751 H2 WAT 2018 133.511 139.812 138.631 1.00 0.00 H TER 17753 WAT 2018 ATOM 17753 O WAT 2019 33.957 121.762 86.802 1.00 0.00 O ATOM 17754 H1 WAT 2019 34.092 122.016 87.715 1.00 0.00 H ATOM 17755 H2 WAT 2019 33.455 120.949 86.851 1.00 0.00 H TER 17757 WAT 2019 ATOM 17757 O WAT 2020 61.076 138.572 107.097 1.00 0.00 O ATOM 17758 H1 WAT 2020 60.773 138.452 106.197 1.00 0.00 H ATOM 17759 H2 WAT 2020 60.583 139.328 107.417 1.00 0.00 H TER 17761 WAT 2020 ATOM 17761 O WAT 2021 129.286 68.982 73.928 1.00 0.00 O ATOM 17762 H1 WAT 2021 128.421 69.143 74.307 1.00 0.00 H ATOM 17763 H2 WAT 2021 129.143 68.277 73.297 1.00 0.00 H TER 17765 WAT 2021 ATOM 17765 O WAT 2022 110.581 133.537 117.666 1.00 0.00 O ATOM 17766 H1 WAT 2022 110.245 134.375 117.986 1.00 0.00 H ATOM 17767 H2 WAT 2022 109.830 133.126 117.238 1.00 0.00 H TER 17769 WAT 2022 ATOM 17769 O WAT 2023 60.862 56.272 128.334 1.00 0.00 O ATOM 17770 H1 WAT 2023 61.368 56.030 129.110 1.00 0.00 H ATOM 17771 H2 WAT 2023 61.360 56.986 127.937 1.00 0.00 H TER 17773 WAT 2023 ATOM 17773 O WAT 2024 123.826 97.458 85.300 1.00 0.00 O ATOM 17774 H1 WAT 2024 124.594 97.997 85.113 1.00 0.00 H ATOM 17775 H2 WAT 2024 123.838 96.780 84.624 1.00 0.00 H TER 17777 WAT 2024 ATOM 17777 O WAT 2025 27.232 8.324 19.566 1.00 0.00 O ATOM 17778 H1 WAT 2025 27.759 8.941 19.058 1.00 0.00 H ATOM 17779 H2 WAT 2025 27.190 7.539 19.019 1.00 0.00 H TER 17781 WAT 2025 ATOM 17781 O WAT 2026 69.168 55.190 0.081 1.00 0.00 O ATOM 17782 H1 WAT 2026 68.549 55.867 0.354 1.00 0.00 H ATOM 17783 H2 WAT 2026 69.807 55.148 0.792 1.00 0.00 H TER 17785 WAT 2026 ATOM 17785 O WAT 2027 55.677 80.956 2.427 1.00 0.00 O ATOM 17786 H1 WAT 2027 55.364 80.275 3.022 1.00 0.00 H ATOM 17787 H2 WAT 2027 55.068 81.683 2.553 1.00 0.00 H TER 17789 WAT 2027 ATOM 17789 O WAT 2028 97.874 139.390 99.166 1.00 0.00 O ATOM 17790 H1 WAT 2028 98.561 140.042 99.025 1.00 0.00 H ATOM 17791 H2 WAT 2028 98.273 138.561 98.901 1.00 0.00 H TER 17793 WAT 2028 ATOM 17793 O WAT 2029 123.413 95.429 151.135 1.00 0.00 O ATOM 17794 H1 WAT 2029 123.695 95.679 152.015 1.00 0.00 H ATOM 17795 H2 WAT 2029 123.514 94.478 151.112 1.00 0.00 H TER 17797 WAT 2029 ATOM 17797 O WAT 2030 145.729 107.811 142.533 1.00 0.00 O ATOM 17798 H1 WAT 2030 145.283 107.275 141.878 1.00 0.00 H ATOM 17799 H2 WAT 2030 146.660 107.645 142.386 1.00 0.00 H TER 17801 WAT 2030 ATOM 17801 O WAT 2031 30.172 108.940 132.366 1.00 0.00 O ATOM 17802 H1 WAT 2031 30.447 108.239 132.956 1.00 0.00 H ATOM 17803 H2 WAT 2031 30.594 109.726 132.715 1.00 0.00 H TER 17805 WAT 2031 ATOM 17805 O WAT 2032 29.358 61.173 102.056 1.00 0.00 O ATOM 17806 H1 WAT 2032 30.047 60.890 101.454 1.00 0.00 H ATOM 17807 H2 WAT 2032 28.677 61.534 101.488 1.00 0.00 H TER 17809 WAT 2032 ATOM 17809 O WAT 2033 65.755 68.830 65.358 1.00 0.00 O ATOM 17810 H1 WAT 2033 65.706 68.736 64.406 1.00 0.00 H ATOM 17811 H2 WAT 2033 66.019 69.739 65.496 1.00 0.00 H TER 17813 WAT 2033 ATOM 17813 O WAT 2034 125.975 82.266 123.271 1.00 0.00 O ATOM 17814 H1 WAT 2034 125.599 83.122 123.477 1.00 0.00 H ATOM 17815 H2 WAT 2034 126.865 82.459 122.977 1.00 0.00 H TER 17817 WAT 2034 ATOM 17817 O WAT 2035 113.080 29.431 150.222 1.00 0.00 O ATOM 17818 H1 WAT 2035 113.277 28.522 150.449 1.00 0.00 H ATOM 17819 H2 WAT 2035 113.613 29.950 150.824 1.00 0.00 H TER 17821 WAT 2035 ATOM 17821 O WAT 2036 91.319 14.889 70.815 1.00 0.00 O ATOM 17822 H1 WAT 2036 90.939 14.179 70.298 1.00 0.00 H ATOM 17823 H2 WAT 2036 90.706 15.617 70.712 1.00 0.00 H TER 17825 WAT 2036 ATOM 17825 O WAT 2037 59.209 55.713 153.451 1.00 0.00 O ATOM 17826 H1 WAT 2037 58.513 56.100 153.981 1.00 0.00 H ATOM 17827 H2 WAT 2037 60.000 55.821 153.979 1.00 0.00 H TER 17829 WAT 2037 ATOM 17829 O WAT 2038 16.533 143.550 81.762 1.00 0.00 O ATOM 17830 H1 WAT 2038 16.556 144.181 81.042 1.00 0.00 H ATOM 17831 H2 WAT 2038 15.735 143.044 81.612 1.00 0.00 H TER 17833 WAT 2038 ATOM 17833 O WAT 2039 102.842 0.629 143.492 1.00 0.00 O ATOM 17834 H1 WAT 2039 103.402 0.094 144.055 1.00 0.00 H ATOM 17835 H2 WAT 2039 102.902 0.215 142.631 1.00 0.00 H TER 17837 WAT 2039 ATOM 17837 O WAT 2040 28.904 46.406 125.815 1.00 0.00 O ATOM 17838 H1 WAT 2040 28.192 47.034 125.939 1.00 0.00 H ATOM 17839 H2 WAT 2040 28.530 45.727 125.254 1.00 0.00 H TER 17841 WAT 2040 ATOM 17841 O WAT 2041 107.645 26.122 147.580 1.00 0.00 O ATOM 17842 H1 WAT 2041 107.709 26.203 146.628 1.00 0.00 H ATOM 17843 H2 WAT 2041 107.532 25.184 147.733 1.00 0.00 H TER 17845 WAT 2041 ATOM 17845 O WAT 2042 12.096 130.125 79.100 1.00 0.00 O ATOM 17846 H1 WAT 2042 12.603 130.929 78.986 1.00 0.00 H ATOM 17847 H2 WAT 2042 11.183 130.413 79.076 1.00 0.00 H TER 17849 WAT 2042 ATOM 17849 O WAT 2043 86.805 81.110 87.451 1.00 0.00 O ATOM 17850 H1 WAT 2043 86.855 81.978 87.852 1.00 0.00 H ATOM 17851 H2 WAT 2043 85.876 80.884 87.484 1.00 0.00 H TER 17853 WAT 2043 ATOM 17853 O WAT 2044 136.934 140.611 119.938 1.00 0.00 O ATOM 17854 H1 WAT 2044 137.195 140.789 120.841 1.00 0.00 H ATOM 17855 H2 WAT 2044 136.981 141.463 119.503 1.00 0.00 H TER 17857 WAT 2044 ATOM 17857 O WAT 2045 122.483 143.672 136.279 1.00 0.00 O ATOM 17858 H1 WAT 2045 122.247 143.283 135.437 1.00 0.00 H ATOM 17859 H2 WAT 2045 122.926 142.968 136.752 1.00 0.00 H TER 17861 WAT 2045 ATOM 17861 O WAT 2046 144.787 40.723 63.018 1.00 0.00 O ATOM 17862 H1 WAT 2046 144.488 40.045 63.623 1.00 0.00 H ATOM 17863 H2 WAT 2046 144.872 41.507 63.560 1.00 0.00 H TER 17865 WAT 2046 ATOM 17865 O WAT 2047 79.558 62.213 85.708 1.00 0.00 O ATOM 17866 H1 WAT 2047 80.198 62.797 85.302 1.00 0.00 H ATOM 17867 H2 WAT 2047 79.803 61.340 85.403 1.00 0.00 H TER 17869 WAT 2047 ATOM 17869 O WAT 2048 77.171 74.989 8.050 1.00 0.00 O ATOM 17870 H1 WAT 2048 76.338 75.360 8.342 1.00 0.00 H ATOM 17871 H2 WAT 2048 77.767 75.130 8.785 1.00 0.00 H TER 17873 WAT 2048 ATOM 17873 O WAT 2049 1.936 35.286 2.882 1.00 0.00 O ATOM 17874 H1 WAT 2049 1.604 34.600 2.303 1.00 0.00 H ATOM 17875 H2 WAT 2049 1.475 35.146 3.709 1.00 0.00 H TER 17877 WAT 2049 ATOM 17877 O WAT 2050 36.825 21.303 156.902 1.00 0.00 O ATOM 17878 H1 WAT 2050 36.801 20.349 156.831 1.00 0.00 H ATOM 17879 H2 WAT 2050 36.883 21.609 155.997 1.00 0.00 H TER 17881 WAT 2050 ATOM 17881 O WAT 2051 60.224 5.514 109.607 1.00 0.00 O ATOM 17882 H1 WAT 2051 59.473 5.636 110.188 1.00 0.00 H ATOM 17883 H2 WAT 2051 59.840 5.260 108.768 1.00 0.00 H TER 17885 WAT 2051 ATOM 17885 O WAT 2052 10.287 11.582 12.888 1.00 0.00 O ATOM 17886 H1 WAT 2052 10.823 10.789 12.906 1.00 0.00 H ATOM 17887 H2 WAT 2052 9.470 11.309 12.471 1.00 0.00 H TER 17889 WAT 2052 ATOM 17889 O WAT 2053 11.601 103.998 148.049 1.00 0.00 O ATOM 17890 H1 WAT 2053 12.532 104.018 147.830 1.00 0.00 H ATOM 17891 H2 WAT 2053 11.244 103.288 147.516 1.00 0.00 H TER 17893 WAT 2053 ATOM 17893 O WAT 2054 108.182 75.719 17.587 1.00 0.00 O ATOM 17894 H1 WAT 2054 108.515 74.856 17.339 1.00 0.00 H ATOM 17895 H2 WAT 2054 108.941 76.172 17.954 1.00 0.00 H TER 17897 WAT 2054 ATOM 17897 O WAT 2055 69.759 24.895 54.588 1.00 0.00 O ATOM 17898 H1 WAT 2055 68.985 25.301 54.980 1.00 0.00 H ATOM 17899 H2 WAT 2055 69.740 23.992 54.903 1.00 0.00 H TER 17901 WAT 2055 ATOM 17901 O WAT 2056 7.443 91.571 115.581 1.00 0.00 O ATOM 17902 H1 WAT 2056 6.687 91.598 114.995 1.00 0.00 H ATOM 17903 H2 WAT 2056 7.076 91.342 116.435 1.00 0.00 H TER 17905 WAT 2056 ATOM 17905 O WAT 2057 5.572 88.115 115.543 1.00 0.00 O ATOM 17906 H1 WAT 2057 5.793 87.826 114.657 1.00 0.00 H ATOM 17907 H2 WAT 2057 5.934 87.438 116.113 1.00 0.00 H TER 17909 WAT 2057 ATOM 17909 O WAT 2058 54.010 130.742 76.248 1.00 0.00 O ATOM 17910 H1 WAT 2058 53.932 129.846 75.919 1.00 0.00 H ATOM 17911 H2 WAT 2058 54.933 130.963 76.124 1.00 0.00 H TER 17913 WAT 2058 ATOM 17913 O WAT 2059 26.972 111.431 158.766 1.00 0.00 O ATOM 17914 H1 WAT 2059 27.024 112.010 158.004 1.00 0.00 H ATOM 17915 H2 WAT 2059 26.785 110.568 158.398 1.00 0.00 H TER 17917 WAT 2059 ATOM 17917 O WAT 2060 135.521 109.623 2.601 1.00 0.00 O ATOM 17918 H1 WAT 2060 134.906 109.004 2.993 1.00 0.00 H ATOM 17919 H2 WAT 2060 135.176 109.780 1.722 1.00 0.00 H TER 17921 WAT 2060 ATOM 17921 O WAT 2061 68.526 41.336 12.347 1.00 0.00 O ATOM 17922 H1 WAT 2061 67.958 41.108 13.083 1.00 0.00 H ATOM 17923 H2 WAT 2061 67.932 41.413 11.600 1.00 0.00 H TER 17925 WAT 2061 ATOM 17925 O WAT 2062 91.627 135.233 12.276 1.00 0.00 O ATOM 17926 H1 WAT 2062 91.853 135.643 11.441 1.00 0.00 H ATOM 17927 H2 WAT 2062 90.771 134.835 12.123 1.00 0.00 H TER 17929 WAT 2062 ATOM 17929 O WAT 2063 7.562 34.748 110.948 1.00 0.00 O ATOM 17930 H1 WAT 2063 7.978 34.982 111.778 1.00 0.00 H ATOM 17931 H2 WAT 2063 8.292 34.638 110.338 1.00 0.00 H TER 17933 WAT 2063 ATOM 17933 O WAT 2064 28.007 142.503 149.286 1.00 0.00 O ATOM 17934 H1 WAT 2064 28.224 143.273 148.761 1.00 0.00 H ATOM 17935 H2 WAT 2064 28.104 142.796 150.192 1.00 0.00 H TER 17937 WAT 2064 ATOM 17937 O WAT 2065 40.435 43.304 90.044 1.00 0.00 O ATOM 17938 H1 WAT 2065 40.875 44.037 90.473 1.00 0.00 H ATOM 17939 H2 WAT 2065 40.825 43.268 89.170 1.00 0.00 H TER 17941 WAT 2065 ATOM 17941 O WAT 2066 38.479 8.301 1.107 1.00 0.00 O ATOM 17942 H1 WAT 2066 37.527 8.393 1.067 1.00 0.00 H ATOM 17943 H2 WAT 2066 38.806 8.910 0.445 1.00 0.00 H TER 17945 WAT 2066 ATOM 17945 O WAT 2067 114.327 24.096 130.981 1.00 0.00 O ATOM 17946 H1 WAT 2067 113.753 24.833 130.771 1.00 0.00 H ATOM 17947 H2 WAT 2067 115.092 24.498 131.392 1.00 0.00 H TER 17949 WAT 2067 ATOM 17949 O WAT 2068 22.591 135.665 107.167 1.00 0.00 O ATOM 17950 H1 WAT 2068 21.690 135.593 107.482 1.00 0.00 H ATOM 17951 H2 WAT 2068 22.685 134.944 106.544 1.00 0.00 H TER 17953 WAT 2068 ATOM 17953 O WAT 2069 38.997 99.613 79.898 1.00 0.00 O ATOM 17954 H1 WAT 2069 38.658 99.215 80.700 1.00 0.00 H ATOM 17955 H2 WAT 2069 39.903 99.839 80.108 1.00 0.00 H TER 17957 WAT 2069 ATOM 17957 O WAT 2070 133.273 32.485 129.392 1.00 0.00 O ATOM 17958 H1 WAT 2070 132.701 33.134 129.800 1.00 0.00 H ATOM 17959 H2 WAT 2070 133.884 33.001 128.865 1.00 0.00 H TER 17961 WAT 2070 ATOM 17961 O WAT 2071 85.260 130.530 93.849 1.00 0.00 O ATOM 17962 H1 WAT 2071 85.663 129.673 93.987 1.00 0.00 H ATOM 17963 H2 WAT 2071 84.400 130.333 93.479 1.00 0.00 H TER 17965 WAT 2071 ATOM 17965 O WAT 2072 97.713 3.738 140.187 1.00 0.00 O ATOM 17966 H1 WAT 2072 98.589 3.696 140.569 1.00 0.00 H ATOM 17967 H2 WAT 2072 97.864 3.915 139.259 1.00 0.00 H TER 17969 WAT 2072 ATOM 17969 O WAT 2073 122.784 140.483 127.088 1.00 0.00 O ATOM 17970 H1 WAT 2073 121.846 140.652 127.180 1.00 0.00 H ATOM 17971 H2 WAT 2073 122.833 139.608 126.703 1.00 0.00 H TER 17973 WAT 2073 ATOM 17973 O WAT 2074 35.002 82.942 91.300 1.00 0.00 O ATOM 17974 H1 WAT 2074 34.268 82.331 91.369 1.00 0.00 H ATOM 17975 H2 WAT 2074 34.924 83.312 90.421 1.00 0.00 H TER 17977 WAT 2074 ATOM 17977 O WAT 2075 31.082 123.125 69.817 1.00 0.00 O ATOM 17978 H1 WAT 2075 31.313 123.507 70.663 1.00 0.00 H ATOM 17979 H2 WAT 2075 30.196 122.785 69.941 1.00 0.00 H TER 17981 WAT 2075 ATOM 17981 O WAT 2076 69.915 130.988 130.949 1.00 0.00 O ATOM 17982 H1 WAT 2076 69.095 131.171 131.408 1.00 0.00 H ATOM 17983 H2 WAT 2076 70.037 130.044 131.044 1.00 0.00 H TER 17985 WAT 2076 ATOM 17985 O WAT 2077 114.884 117.251 149.733 1.00 0.00 O ATOM 17986 H1 WAT 2077 114.336 116.853 150.409 1.00 0.00 H ATOM 17987 H2 WAT 2077 114.653 118.180 149.753 1.00 0.00 H TER 17989 WAT 2077 ATOM 17989 O WAT 2078 115.917 141.409 12.005 1.00 0.00 O ATOM 17990 H1 WAT 2078 116.746 141.799 12.280 1.00 0.00 H ATOM 17991 H2 WAT 2078 116.157 140.541 11.680 1.00 0.00 H TER 17993 WAT 2078 ATOM 17993 O WAT 2079 31.413 42.664 87.891 1.00 0.00 O ATOM 17994 H1 WAT 2079 30.561 43.087 87.783 1.00 0.00 H ATOM 17995 H2 WAT 2079 31.249 41.741 87.699 1.00 0.00 H TER 17997 WAT 2079 ATOM 17997 O WAT 2080 74.141 93.006 23.804 1.00 0.00 O ATOM 17998 H1 WAT 2080 74.103 93.446 24.654 1.00 0.00 H ATOM 17999 H2 WAT 2080 74.053 92.076 24.012 1.00 0.00 H TER 18001 WAT 2080 ATOM 18001 O WAT 2081 114.122 110.378 10.868 1.00 0.00 O ATOM 18002 H1 WAT 2081 114.159 110.850 10.036 1.00 0.00 H ATOM 18003 H2 WAT 2081 113.243 110.553 11.205 1.00 0.00 H TER 18005 WAT 2081 ATOM 18005 O WAT 2082 86.166 72.635 17.087 1.00 0.00 O ATOM 18006 H1 WAT 2082 85.725 71.817 16.859 1.00 0.00 H ATOM 18007 H2 WAT 2082 85.905 72.803 17.992 1.00 0.00 H TER 18009 WAT 2082 ATOM 18009 O WAT 2083 5.084 120.426 19.276 1.00 0.00 O ATOM 18010 H1 WAT 2083 4.653 120.249 20.112 1.00 0.00 H ATOM 18011 H2 WAT 2083 5.955 120.041 19.369 1.00 0.00 H TER 18013 WAT 2083 ATOM 18013 O WAT 2084 40.703 134.260 157.175 1.00 0.00 O ATOM 18014 H1 WAT 2084 40.755 134.119 156.230 1.00 0.00 H ATOM 18015 H2 WAT 2084 40.052 134.954 157.278 1.00 0.00 H TER 18017 WAT 2084 ATOM 18017 O WAT 2085 79.593 14.931 93.029 1.00 0.00 O ATOM 18018 H1 WAT 2085 79.606 15.812 92.655 1.00 0.00 H ATOM 18019 H2 WAT 2085 78.698 14.624 92.890 1.00 0.00 H TER 18021 WAT 2085 ATOM 18021 O WAT 2086 94.741 114.436 9.402 1.00 0.00 O ATOM 18022 H1 WAT 2086 95.182 115.265 9.215 1.00 0.00 H ATOM 18023 H2 WAT 2086 94.454 114.517 10.311 1.00 0.00 H TER 18025 WAT 2086 ATOM 18025 O WAT 2087 100.013 97.574 15.280 1.00 0.00 O ATOM 18026 H1 WAT 2087 100.461 98.153 15.897 1.00 0.00 H ATOM 18027 H2 WAT 2087 99.082 97.696 15.470 1.00 0.00 H TER 18029 WAT 2087 ATOM 18029 O WAT 2088 20.739 107.586 76.285 1.00 0.00 O ATOM 18030 H1 WAT 2088 20.617 108.501 76.538 1.00 0.00 H ATOM 18031 H2 WAT 2088 21.073 107.161 77.075 1.00 0.00 H TER 18033 WAT 2088 ATOM 18033 O WAT 2089 61.868 103.473 96.612 1.00 0.00 O ATOM 18034 H1 WAT 2089 62.457 103.325 97.352 1.00 0.00 H ATOM 18035 H2 WAT 2089 62.193 104.275 96.204 1.00 0.00 H TER 18037 WAT 2089 ATOM 18037 O WAT 2090 62.114 42.071 136.070 1.00 0.00 O ATOM 18038 H1 WAT 2090 61.560 41.467 136.565 1.00 0.00 H ATOM 18039 H2 WAT 2090 62.943 41.604 135.965 1.00 0.00 H TER 18041 WAT 2090 ATOM 18041 O WAT 2091 7.963 29.927 142.163 1.00 0.00 O ATOM 18042 H1 WAT 2091 7.034 30.007 142.378 1.00 0.00 H ATOM 18043 H2 WAT 2091 8.415 30.358 142.888 1.00 0.00 H TER 18045 WAT 2091 ATOM 18045 O WAT 2092 128.104 28.317 2.891 1.00 0.00 O ATOM 18046 H1 WAT 2092 127.464 28.944 3.227 1.00 0.00 H ATOM 18047 H2 WAT 2092 127.930 28.278 1.951 1.00 0.00 H TER 18049 WAT 2092 ATOM 18049 O WAT 2093 35.653 104.383 130.103 1.00 0.00 O ATOM 18050 H1 WAT 2093 36.011 103.752 130.727 1.00 0.00 H ATOM 18051 H2 WAT 2093 35.981 104.091 129.252 1.00 0.00 H TER 18053 WAT 2093 ATOM 18053 O WAT 2094 38.653 116.779 92.683 1.00 0.00 O ATOM 18054 H1 WAT 2094 38.735 116.827 93.635 1.00 0.00 H ATOM 18055 H2 WAT 2094 39.368 116.205 92.409 1.00 0.00 H TER 18057 WAT 2094 ATOM 18057 O WAT 2095 43.454 120.068 74.787 1.00 0.00 O ATOM 18058 H1 WAT 2095 43.506 120.576 75.596 1.00 0.00 H ATOM 18059 H2 WAT 2095 42.551 120.181 74.490 1.00 0.00 H TER 18061 WAT 2095 ATOM 18061 O WAT 2096 7.655 22.976 143.845 1.00 0.00 O ATOM 18062 H1 WAT 2096 8.446 23.002 144.383 1.00 0.00 H ATOM 18063 H2 WAT 2096 7.479 23.892 143.633 1.00 0.00 H TER 18065 WAT 2096 ATOM 18065 O WAT 2097 132.757 22.575 16.902 1.00 0.00 O ATOM 18066 H1 WAT 2097 132.624 22.452 17.842 1.00 0.00 H ATOM 18067 H2 WAT 2097 132.162 21.948 16.492 1.00 0.00 H TER 18069 WAT 2097 ATOM 18069 O WAT 2098 49.542 95.510 80.198 1.00 0.00 O ATOM 18070 H1 WAT 2098 49.396 96.024 79.404 1.00 0.00 H ATOM 18071 H2 WAT 2098 50.448 95.210 80.126 1.00 0.00 H TER 18073 WAT 2098 ATOM 18073 O WAT 2099 144.243 31.624 103.335 1.00 0.00 O ATOM 18074 H1 WAT 2099 143.613 31.871 104.012 1.00 0.00 H ATOM 18075 H2 WAT 2099 144.690 32.441 103.113 1.00 0.00 H TER 18077 WAT 2099 ATOM 18077 O WAT 2100 55.821 142.239 141.476 1.00 0.00 O ATOM 18078 H1 WAT 2100 56.658 142.704 141.468 1.00 0.00 H ATOM 18079 H2 WAT 2100 55.244 142.775 140.932 1.00 0.00 H TER 18081 WAT 2100 ATOM 18081 O WAT 2101 64.487 66.121 105.766 1.00 0.00 O ATOM 18082 H1 WAT 2101 64.579 65.180 105.919 1.00 0.00 H ATOM 18083 H2 WAT 2101 64.078 66.455 106.564 1.00 0.00 H TER 18085 WAT 2101 ATOM 18085 O WAT 2102 88.557 145.308 119.593 1.00 0.00 O ATOM 18086 H1 WAT 2102 89.303 144.743 119.793 1.00 0.00 H ATOM 18087 H2 WAT 2102 88.942 146.174 119.458 1.00 0.00 H TER 18089 WAT 2102 ATOM 18089 O WAT 2103 63.269 80.058 103.003 1.00 0.00 O ATOM 18090 H1 WAT 2103 63.472 79.306 102.448 1.00 0.00 H ATOM 18091 H2 WAT 2103 64.123 80.436 103.217 1.00 0.00 H TER 18093 WAT 2103 ATOM 18093 O WAT 2104 7.222 136.038 143.575 1.00 0.00 O ATOM 18094 H1 WAT 2104 7.747 136.459 142.893 1.00 0.00 H ATOM 18095 H2 WAT 2104 6.879 136.764 144.095 1.00 0.00 H TER 18097 WAT 2104 ATOM 18097 O WAT 2105 72.672 39.477 101.804 1.00 0.00 O ATOM 18098 H1 WAT 2105 71.938 39.134 101.295 1.00 0.00 H ATOM 18099 H2 WAT 2105 72.490 40.414 101.885 1.00 0.00 H TER 18101 WAT 2105 ATOM 18101 O WAT 2106 47.803 32.564 124.406 1.00 0.00 O ATOM 18102 H1 WAT 2106 47.904 31.975 123.658 1.00 0.00 H ATOM 18103 H2 WAT 2106 46.904 32.423 124.702 1.00 0.00 H TER 18105 WAT 2106 ATOM 18105 O WAT 2107 132.643 130.265 73.225 1.00 0.00 O ATOM 18106 H1 WAT 2107 133.096 129.422 73.204 1.00 0.00 H ATOM 18107 H2 WAT 2107 131.844 130.094 73.724 1.00 0.00 H TER 18109 WAT 2107 ATOM 18109 O WAT 2108 131.146 143.415 122.782 1.00 0.00 O ATOM 18110 H1 WAT 2108 131.460 144.311 122.663 1.00 0.00 H ATOM 18111 H2 WAT 2108 131.874 142.865 122.492 1.00 0.00 H TER 18113 WAT 2108 ATOM 18113 O WAT 2109 69.124 57.941 147.576 1.00 0.00 O ATOM 18114 H1 WAT 2109 69.849 57.698 148.151 1.00 0.00 H ATOM 18115 H2 WAT 2109 68.364 57.990 148.157 1.00 0.00 H TER 18117 WAT 2109 ATOM 18117 O WAT 2110 44.504 79.106 132.562 1.00 0.00 O ATOM 18118 H1 WAT 2110 44.574 78.209 132.888 1.00 0.00 H ATOM 18119 H2 WAT 2110 45.030 79.624 133.173 1.00 0.00 H TER 18121 WAT 2110 ATOM 18121 O WAT 2111 52.313 142.358 138.118 1.00 0.00 O ATOM 18122 H1 WAT 2111 52.321 141.427 137.896 1.00 0.00 H ATOM 18123 H2 WAT 2111 53.002 142.740 137.574 1.00 0.00 H TER 18125 WAT 2111 ATOM 18125 O WAT 2112 68.057 23.354 111.885 1.00 0.00 O ATOM 18126 H1 WAT 2112 68.676 23.467 112.607 1.00 0.00 H ATOM 18127 H2 WAT 2112 67.284 22.963 112.292 1.00 0.00 H TER 18129 WAT 2112 ATOM 18129 O WAT 2113 71.521 56.906 140.266 1.00 0.00 O ATOM 18130 H1 WAT 2113 71.158 56.152 140.730 1.00 0.00 H ATOM 18131 H2 WAT 2113 71.502 57.616 140.908 1.00 0.00 H TER 18133 WAT 2113 ATOM 18133 O WAT 2114 94.286 54.875 158.286 1.00 0.00 O ATOM 18134 H1 WAT 2114 95.218 54.707 158.427 1.00 0.00 H ATOM 18135 H2 WAT 2114 94.225 55.825 158.190 1.00 0.00 H TER 18137 WAT 2114 ATOM 18137 O WAT 2115 55.704 4.404 84.270 1.00 0.00 O ATOM 18138 H1 WAT 2115 55.979 4.012 83.441 1.00 0.00 H ATOM 18139 H2 WAT 2115 56.412 4.197 84.880 1.00 0.00 H TER 18141 WAT 2115 ATOM 18141 O WAT 2116 107.670 78.986 71.095 1.00 0.00 O ATOM 18142 H1 WAT 2116 107.001 78.863 71.769 1.00 0.00 H ATOM 18143 H2 WAT 2116 107.604 79.911 70.858 1.00 0.00 H TER 18145 WAT 2116 ATOM 18145 O WAT 2117 76.285 135.883 123.303 1.00 0.00 O ATOM 18146 H1 WAT 2117 76.936 136.566 123.463 1.00 0.00 H ATOM 18147 H2 WAT 2117 76.394 135.273 124.033 1.00 0.00 H TER 18149 WAT 2117 ATOM 18149 O WAT 2118 78.247 139.713 64.668 1.00 0.00 O ATOM 18150 H1 WAT 2118 78.908 140.239 65.119 1.00 0.00 H ATOM 18151 H2 WAT 2118 78.632 138.838 64.616 1.00 0.00 H TER 18153 WAT 2118 ATOM 18153 O WAT 2119 7.102 76.067 108.835 1.00 0.00 O ATOM 18154 H1 WAT 2119 6.634 76.382 109.608 1.00 0.00 H ATOM 18155 H2 WAT 2119 6.418 75.707 108.271 1.00 0.00 H TER 18157 WAT 2119 ATOM 18157 O WAT 2120 74.208 110.627 53.859 1.00 0.00 O ATOM 18158 H1 WAT 2120 74.044 110.940 52.970 1.00 0.00 H ATOM 18159 H2 WAT 2120 73.612 111.138 54.407 1.00 0.00 H TER 18161 WAT 2120 ATOM 18161 O WAT 2121 0.777 116.992 143.022 1.00 0.00 O ATOM 18162 H1 WAT 2121 0.921 116.186 143.517 1.00 0.00 H ATOM 18163 H2 WAT 2121 1.585 117.116 142.524 1.00 0.00 H TER 18165 WAT 2121 ATOM 18165 O WAT 2122 88.806 83.975 120.144 1.00 0.00 O ATOM 18166 H1 WAT 2122 89.361 84.685 119.821 1.00 0.00 H ATOM 18167 H2 WAT 2122 87.948 84.380 120.271 1.00 0.00 H TER 18169 WAT 2122 ATOM 18169 O WAT 2123 94.414 23.190 129.183 1.00 0.00 O ATOM 18170 H1 WAT 2123 94.358 22.844 130.073 1.00 0.00 H ATOM 18171 H2 WAT 2123 95.085 23.871 129.232 1.00 0.00 H TER 18173 WAT 2123 ATOM 18173 O WAT 2124 131.105 115.322 130.059 1.00 0.00 O ATOM 18174 H1 WAT 2124 130.323 115.862 130.177 1.00 0.00 H ATOM 18175 H2 WAT 2124 131.765 115.927 129.720 1.00 0.00 H TER 18177 WAT 2124 ATOM 18177 O WAT 2125 64.859 15.929 15.109 1.00 0.00 O ATOM 18178 H1 WAT 2125 64.614 15.698 14.213 1.00 0.00 H ATOM 18179 H2 WAT 2125 64.050 15.829 15.612 1.00 0.00 H TER 18181 WAT 2125 ATOM 18181 O WAT 2126 16.845 83.088 156.547 1.00 0.00 O ATOM 18182 H1 WAT 2126 17.526 82.738 155.973 1.00 0.00 H ATOM 18183 H2 WAT 2126 17.273 83.180 157.398 1.00 0.00 H TER 18185 WAT 2126 ATOM 18185 O WAT 2127 93.824 116.709 149.254 1.00 0.00 O ATOM 18186 H1 WAT 2127 94.166 117.580 149.457 1.00 0.00 H ATOM 18187 H2 WAT 2127 94.508 116.300 148.724 1.00 0.00 H TER 18189 WAT 2127 ATOM 18189 O WAT 2128 61.070 96.587 66.464 1.00 0.00 O ATOM 18190 H1 WAT 2128 61.875 96.738 65.969 1.00 0.00 H ATOM 18191 H2 WAT 2128 60.670 97.453 66.541 1.00 0.00 H TER 18193 WAT 2128 ATOM 18193 O WAT 2129 123.279 118.337 66.867 1.00 0.00 O ATOM 18194 H1 WAT 2129 122.899 117.604 67.351 1.00 0.00 H ATOM 18195 H2 WAT 2129 122.585 118.614 66.267 1.00 0.00 H TER 18197 WAT 2129 ATOM 18197 O WAT 2130 127.116 111.215 104.465 1.00 0.00 O ATOM 18198 H1 WAT 2130 127.268 112.158 104.528 1.00 0.00 H ATOM 18199 H2 WAT 2130 127.589 110.948 103.676 1.00 0.00 H TER 18201 WAT 2130 ATOM 18201 O WAT 2131 41.392 8.293 118.257 1.00 0.00 O ATOM 18202 H1 WAT 2131 40.926 9.041 117.882 1.00 0.00 H ATOM 18203 H2 WAT 2131 42.274 8.622 118.427 1.00 0.00 H TER 18205 WAT 2131 ATOM 18205 O WAT 2132 134.910 42.638 139.553 1.00 0.00 O ATOM 18206 H1 WAT 2132 135.693 43.158 139.732 1.00 0.00 H ATOM 18207 H2 WAT 2132 134.197 43.128 139.963 1.00 0.00 H TER 18209 WAT 2132 ATOM 18209 O WAT 2133 49.651 99.556 141.395 1.00 0.00 O ATOM 18210 H1 WAT 2133 49.625 100.350 141.929 1.00 0.00 H ATOM 18211 H2 WAT 2133 48.832 99.573 140.900 1.00 0.00 H TER 18213 WAT 2133 ATOM 18213 O WAT 2134 99.647 75.015 63.734 1.00 0.00 O ATOM 18214 H1 WAT 2134 99.667 74.083 63.951 1.00 0.00 H ATOM 18215 H2 WAT 2134 99.290 75.435 64.516 1.00 0.00 H TER 18217 WAT 2134 ATOM 18217 O WAT 2135 7.863 29.184 128.872 1.00 0.00 O ATOM 18218 H1 WAT 2135 7.799 29.248 127.919 1.00 0.00 H ATOM 18219 H2 WAT 2135 7.136 29.715 129.197 1.00 0.00 H TER 18221 WAT 2135 ATOM 18221 O WAT 2136 144.660 98.131 135.452 1.00 0.00 O ATOM 18222 H1 WAT 2136 144.774 97.680 134.616 1.00 0.00 H ATOM 18223 H2 WAT 2136 143.991 98.793 135.278 1.00 0.00 H TER 18225 WAT 2136 ATOM 18225 O WAT 2137 128.709 96.504 151.374 1.00 0.00 O ATOM 18226 H1 WAT 2137 128.650 97.442 151.192 1.00 0.00 H ATOM 18227 H2 WAT 2137 128.417 96.084 150.565 1.00 0.00 H TER 18229 WAT 2137 ATOM 18229 O WAT 2138 108.795 39.198 90.521 1.00 0.00 O ATOM 18230 H1 WAT 2138 109.118 40.042 90.835 1.00 0.00 H ATOM 18231 H2 WAT 2138 107.896 39.374 90.244 1.00 0.00 H TER 18233 WAT 2138 ATOM 18233 O WAT 2139 19.982 132.139 103.733 1.00 0.00 O ATOM 18234 H1 WAT 2139 20.158 132.427 104.629 1.00 0.00 H ATOM 18235 H2 WAT 2139 19.817 131.200 103.811 1.00 0.00 H TER 18237 WAT 2139 ATOM 18237 O WAT 2140 132.557 78.042 98.684 1.00 0.00 O ATOM 18238 H1 WAT 2140 132.696 78.404 99.559 1.00 0.00 H ATOM 18239 H2 WAT 2140 132.676 77.099 98.793 1.00 0.00 H TER 18241 WAT 2140 ATOM 18241 O WAT 2141 63.796 117.126 67.942 1.00 0.00 O ATOM 18242 H1 WAT 2141 64.507 116.674 67.488 1.00 0.00 H ATOM 18243 H2 WAT 2141 63.981 118.056 67.811 1.00 0.00 H TER 18245 WAT 2141 ATOM 18245 O WAT 2142 28.479 60.300 122.736 1.00 0.00 O ATOM 18246 H1 WAT 2142 28.528 61.045 122.138 1.00 0.00 H ATOM 18247 H2 WAT 2142 28.051 60.648 123.518 1.00 0.00 H TER 18249 WAT 2142 ATOM 18249 O WAT 2143 129.999 69.033 24.873 1.00 0.00 O ATOM 18250 H1 WAT 2143 130.117 68.146 25.213 1.00 0.00 H ATOM 18251 H2 WAT 2143 129.107 69.041 24.528 1.00 0.00 H TER 18253 WAT 2143 ATOM 18253 O WAT 2144 133.885 6.823 26.059 1.00 0.00 O ATOM 18254 H1 WAT 2144 134.653 6.262 25.952 1.00 0.00 H ATOM 18255 H2 WAT 2144 134.228 7.627 26.449 1.00 0.00 H TER 18257 WAT 2144 ATOM 18257 O WAT 2145 128.660 28.806 114.052 1.00 0.00 O ATOM 18258 H1 WAT 2145 128.713 28.545 114.971 1.00 0.00 H ATOM 18259 H2 WAT 2145 128.604 27.980 113.571 1.00 0.00 H TER 18261 WAT 2145 ATOM 18261 O WAT 2146 56.136 124.320 88.815 1.00 0.00 O ATOM 18262 H1 WAT 2146 55.340 124.494 88.313 1.00 0.00 H ATOM 18263 H2 WAT 2146 56.130 124.980 89.509 1.00 0.00 H TER 18265 WAT 2146 ATOM 18265 O WAT 2147 140.181 80.447 130.792 1.00 0.00 O ATOM 18266 H1 WAT 2147 140.355 81.201 131.355 1.00 0.00 H ATOM 18267 H2 WAT 2147 140.988 79.932 130.826 1.00 0.00 H TER 18269 WAT 2147 ATOM 18269 O WAT 2148 121.963 134.191 133.652 1.00 0.00 O ATOM 18270 H1 WAT 2148 122.340 134.112 132.776 1.00 0.00 H ATOM 18271 H2 WAT 2148 122.676 134.533 134.191 1.00 0.00 H TER 18273 WAT 2148 ATOM 18273 O WAT 2149 80.644 7.375 82.534 1.00 0.00 O ATOM 18274 H1 WAT 2149 80.784 6.612 81.973 1.00 0.00 H ATOM 18275 H2 WAT 2149 81.392 7.375 83.130 1.00 0.00 H TER 18277 WAT 2149 ATOM 18277 O WAT 2150 144.042 93.519 136.113 1.00 0.00 O ATOM 18278 H1 WAT 2150 144.818 93.947 136.474 1.00 0.00 H ATOM 18279 H2 WAT 2150 144.293 92.599 136.030 1.00 0.00 H TER 18281 WAT 2150 ATOM 18281 O WAT 2151 111.191 102.191 129.408 1.00 0.00 O ATOM 18282 H1 WAT 2151 110.356 102.466 129.787 1.00 0.00 H ATOM 18283 H2 WAT 2151 110.968 101.443 128.854 1.00 0.00 H TER 18285 WAT 2151 ATOM 18285 O WAT 2152 33.564 42.313 12.366 1.00 0.00 O ATOM 18286 H1 WAT 2152 32.834 42.555 11.797 1.00 0.00 H ATOM 18287 H2 WAT 2152 33.537 42.954 13.076 1.00 0.00 H TER 18289 WAT 2152 ATOM 18289 O WAT 2153 52.639 141.749 114.019 1.00 0.00 O ATOM 18290 H1 WAT 2153 53.276 141.964 113.338 1.00 0.00 H ATOM 18291 H2 WAT 2153 52.741 142.443 114.670 1.00 0.00 H TER 18293 WAT 2153 ATOM 18293 O WAT 2154 63.108 24.126 127.554 1.00 0.00 O ATOM 18294 H1 WAT 2154 63.437 24.452 128.392 1.00 0.00 H ATOM 18295 H2 WAT 2154 63.698 23.406 127.330 1.00 0.00 H TER 18297 WAT 2154 ATOM 18297 O WAT 2155 83.502 121.252 89.617 1.00 0.00 O ATOM 18298 H1 WAT 2155 84.295 121.728 89.863 1.00 0.00 H ATOM 18299 H2 WAT 2155 83.525 120.458 90.151 1.00 0.00 H TER 18301 WAT 2155 ATOM 18301 O WAT 2156 105.527 28.366 138.742 1.00 0.00 O ATOM 18302 H1 WAT 2156 106.013 27.569 138.955 1.00 0.00 H ATOM 18303 H2 WAT 2156 105.741 28.538 137.825 1.00 0.00 H TER 18305 WAT 2156 ATOM 18305 O WAT 2157 19.083 35.898 107.520 1.00 0.00 O ATOM 18306 H1 WAT 2157 18.516 36.117 106.781 1.00 0.00 H ATOM 18307 H2 WAT 2157 19.866 35.520 107.118 1.00 0.00 H TER 18309 WAT 2157 ATOM 18309 O WAT 2158 52.323 84.767 11.969 1.00 0.00 O ATOM 18310 H1 WAT 2158 52.138 84.072 11.337 1.00 0.00 H ATOM 18311 H2 WAT 2158 52.640 85.496 11.437 1.00 0.00 H TER 18313 WAT 2158 ATOM 18313 O WAT 2159 57.595 8.560 110.112 1.00 0.00 O ATOM 18314 H1 WAT 2159 56.947 8.537 109.408 1.00 0.00 H ATOM 18315 H2 WAT 2159 57.741 7.640 110.334 1.00 0.00 H TER 18317 WAT 2159 ATOM 18317 O WAT 2160 18.429 115.909 102.031 1.00 0.00 O ATOM 18318 H1 WAT 2160 19.044 115.217 101.788 1.00 0.00 H ATOM 18319 H2 WAT 2160 18.101 116.242 101.196 1.00 0.00 H TER 18321 WAT 2160 ATOM 18321 O WAT 2161 62.844 102.114 82.340 1.00 0.00 O ATOM 18322 H1 WAT 2161 63.788 102.175 82.488 1.00 0.00 H ATOM 18323 H2 WAT 2161 62.470 102.806 82.885 1.00 0.00 H TER 18325 WAT 2161 ATOM 18325 O WAT 2162 127.855 121.106 125.381 1.00 0.00 O ATOM 18326 H1 WAT 2162 128.346 121.039 124.562 1.00 0.00 H ATOM 18327 H2 WAT 2162 128.016 122.000 125.684 1.00 0.00 H TER 18329 WAT 2162 ATOM 18329 O WAT 2163 34.507 141.456 156.471 1.00 0.00 O ATOM 18330 H1 WAT 2163 34.115 142.215 156.903 1.00 0.00 H ATOM 18331 H2 WAT 2163 35.438 141.670 156.411 1.00 0.00 H TER 18333 WAT 2163 ATOM 18333 O WAT 2164 41.813 62.180 96.192 1.00 0.00 O ATOM 18334 H1 WAT 2164 41.918 63.100 95.951 1.00 0.00 H ATOM 18335 H2 WAT 2164 42.471 62.035 96.872 1.00 0.00 H TER 18337 WAT 2164 ATOM 18337 O WAT 2165 85.660 61.999 98.780 1.00 0.00 O ATOM 18338 H1 WAT 2165 85.694 62.656 98.085 1.00 0.00 H ATOM 18339 H2 WAT 2165 86.370 61.392 98.570 1.00 0.00 H TER 18341 WAT 2165 ATOM 18341 O WAT 2166 45.527 59.576 57.805 1.00 0.00 O ATOM 18342 H1 WAT 2166 46.282 60.164 57.805 1.00 0.00 H ATOM 18343 H2 WAT 2166 45.602 59.088 56.985 1.00 0.00 H TER 18345 WAT 2166 ATOM 18345 O WAT 2167 8.139 48.068 111.431 1.00 0.00 O ATOM 18346 H1 WAT 2167 7.969 47.384 112.079 1.00 0.00 H ATOM 18347 H2 WAT 2167 7.788 48.866 111.826 1.00 0.00 H TER 18349 WAT 2167 ATOM 18349 O WAT 2168 122.743 107.909 75.241 1.00 0.00 O ATOM 18350 H1 WAT 2168 122.271 108.678 74.919 1.00 0.00 H ATOM 18351 H2 WAT 2168 123.404 107.736 74.571 1.00 0.00 H TER 18353 WAT 2168 ATOM 18353 O WAT 2169 144.374 54.897 141.801 1.00 0.00 O ATOM 18354 H1 WAT 2169 144.149 55.690 141.316 1.00 0.00 H ATOM 18355 H2 WAT 2169 145.134 55.145 142.327 1.00 0.00 H TER 18357 WAT 2169 ATOM 18357 O WAT 2170 68.550 138.773 115.231 1.00 0.00 O ATOM 18358 H1 WAT 2170 67.882 138.854 114.551 1.00 0.00 H ATOM 18359 H2 WAT 2170 68.842 139.671 115.387 1.00 0.00 H TER 18361 WAT 2170 ATOM 18361 O WAT 2171 24.430 19.305 118.448 1.00 0.00 O ATOM 18362 H1 WAT 2171 25.177 18.861 118.047 1.00 0.00 H ATOM 18363 H2 WAT 2171 24.203 18.759 119.201 1.00 0.00 H TER 18365 WAT 2171 ATOM 18365 O WAT 2172 142.697 75.139 81.561 1.00 0.00 O ATOM 18366 H1 WAT 2172 143.410 74.919 82.161 1.00 0.00 H ATOM 18367 H2 WAT 2172 142.905 76.023 81.258 1.00 0.00 H TER 18369 WAT 2172 ATOM 18369 O WAT 2173 14.165 107.263 93.473 1.00 0.00 O ATOM 18370 H1 WAT 2173 15.088 107.495 93.576 1.00 0.00 H ATOM 18371 H2 WAT 2173 13.707 108.103 93.467 1.00 0.00 H TER 18373 WAT 2173 ATOM 18373 O WAT 2174 136.990 19.999 92.152 1.00 0.00 O ATOM 18374 H1 WAT 2174 136.725 20.522 92.909 1.00 0.00 H ATOM 18375 H2 WAT 2174 137.945 20.057 92.144 1.00 0.00 H TER 18377 WAT 2174 ATOM 18377 O WAT 2175 45.961 78.834 17.478 1.00 0.00 O ATOM 18378 H1 WAT 2175 46.454 79.039 16.684 1.00 0.00 H ATOM 18379 H2 WAT 2175 45.894 79.669 17.941 1.00 0.00 H TER 18381 WAT 2175 ATOM 18381 O WAT 2176 124.994 92.027 78.542 1.00 0.00 O ATOM 18382 H1 WAT 2176 125.005 91.835 77.604 1.00 0.00 H ATOM 18383 H2 WAT 2176 124.586 92.891 78.605 1.00 0.00 H TER 18385 WAT 2176 ATOM 18385 O WAT 2177 141.413 108.917 97.232 1.00 0.00 O ATOM 18386 H1 WAT 2177 141.311 107.998 96.983 1.00 0.00 H ATOM 18387 H2 WAT 2177 141.752 109.342 96.444 1.00 0.00 H TER 18389 WAT 2177 ATOM 18389 O WAT 2178 14.424 77.072 81.008 1.00 0.00 O ATOM 18390 H1 WAT 2178 13.680 76.993 81.605 1.00 0.00 H ATOM 18391 H2 WAT 2178 15.174 77.234 81.581 1.00 0.00 H TER 18393 WAT 2178 ATOM 18393 O WAT 2179 4.706 55.007 128.573 1.00 0.00 O ATOM 18394 H1 WAT 2179 4.102 54.317 128.847 1.00 0.00 H ATOM 18395 H2 WAT 2179 4.345 55.808 128.953 1.00 0.00 H TER 18397 WAT 2179 ATOM 18397 O WAT 2180 124.020 31.731 26.639 1.00 0.00 O ATOM 18398 H1 WAT 2180 123.988 32.087 25.751 1.00 0.00 H ATOM 18399 H2 WAT 2180 124.771 32.165 27.044 1.00 0.00 H TER 18401 WAT 2180 ATOM 18401 O WAT 2181 45.291 50.718 141.582 1.00 0.00 O ATOM 18402 H1 WAT 2181 46.146 50.850 141.173 1.00 0.00 H ATOM 18403 H2 WAT 2181 44.667 51.085 140.956 1.00 0.00 H TER 18405 WAT 2181 ATOM 18405 O WAT 2182 105.512 119.853 138.360 1.00 0.00 O ATOM 18406 H1 WAT 2182 105.107 119.533 139.166 1.00 0.00 H ATOM 18407 H2 WAT 2182 105.084 120.693 138.194 1.00 0.00 H TER 18409 WAT 2182 ATOM 18409 O WAT 2183 10.545 135.021 116.882 1.00 0.00 O ATOM 18410 H1 WAT 2183 10.079 135.810 116.607 1.00 0.00 H ATOM 18411 H2 WAT 2183 11.369 135.048 116.395 1.00 0.00 H TER 18413 WAT 2183 ATOM 18413 O WAT 2184 48.055 97.098 86.743 1.00 0.00 O ATOM 18414 H1 WAT 2184 47.642 97.936 86.952 1.00 0.00 H ATOM 18415 H2 WAT 2184 47.325 96.523 86.512 1.00 0.00 H TER 18417 WAT 2184 ATOM 18417 O WAT 2185 13.318 46.127 109.938 1.00 0.00 O ATOM 18418 H1 WAT 2185 13.517 45.362 109.398 1.00 0.00 H ATOM 18419 H2 WAT 2185 12.424 45.977 110.245 1.00 0.00 H TER 18421 WAT 2185 ATOM 18421 O WAT 2186 126.780 88.725 99.330 1.00 0.00 O ATOM 18422 H1 WAT 2186 126.831 89.650 99.089 1.00 0.00 H ATOM 18423 H2 WAT 2186 126.260 88.716 100.134 1.00 0.00 H TER 18425 WAT 2186 ATOM 18425 O WAT 2187 138.084 116.988 158.468 1.00 0.00 O ATOM 18426 H1 WAT 2187 137.358 116.539 158.900 1.00 0.00 H ATOM 18427 H2 WAT 2187 138.857 116.735 158.973 1.00 0.00 H TER 18429 WAT 2187 ATOM 18429 O WAT 2188 73.334 121.607 93.524 1.00 0.00 O ATOM 18430 H1 WAT 2188 73.321 122.545 93.338 1.00 0.00 H ATOM 18431 H2 WAT 2188 74.084 121.489 94.107 1.00 0.00 H TER 18433 WAT 2188 ATOM 18433 O WAT 2189 14.051 16.181 72.904 1.00 0.00 O ATOM 18434 H1 WAT 2189 13.662 15.748 73.664 1.00 0.00 H ATOM 18435 H2 WAT 2189 14.703 15.558 72.582 1.00 0.00 H TER 18437 WAT 2189 ATOM 18437 O WAT 2190 62.550 83.708 116.406 1.00 0.00 O ATOM 18438 H1 WAT 2190 63.155 83.125 115.948 1.00 0.00 H ATOM 18439 H2 WAT 2190 61.918 83.121 116.819 1.00 0.00 H TER 18441 WAT 2190 ATOM 18441 O WAT 2191 36.563 59.005 59.817 1.00 0.00 O ATOM 18442 H1 WAT 2191 36.844 59.535 60.563 1.00 0.00 H ATOM 18443 H2 WAT 2191 37.310 58.436 59.632 1.00 0.00 H TER 18445 WAT 2191 ATOM 18445 O WAT 2192 89.673 44.569 71.688 1.00 0.00 O ATOM 18446 H1 WAT 2192 89.947 44.778 72.581 1.00 0.00 H ATOM 18447 H2 WAT 2192 88.753 44.830 71.653 1.00 0.00 H TER 18449 WAT 2192 ATOM 18449 O WAT 2193 41.174 31.831 99.370 1.00 0.00 O ATOM 18450 H1 WAT 2193 40.414 31.307 99.625 1.00 0.00 H ATOM 18451 H2 WAT 2193 41.664 31.953 100.183 1.00 0.00 H TER 18453 WAT 2193 ATOM 18453 O WAT 2194 66.460 71.452 91.561 1.00 0.00 O ATOM 18454 H1 WAT 2194 66.258 72.369 91.379 1.00 0.00 H ATOM 18455 H2 WAT 2194 65.605 71.040 91.687 1.00 0.00 H TER 18457 WAT 2194 ATOM 18457 O WAT 2195 5.721 108.317 157.632 1.00 0.00 O ATOM 18458 H1 WAT 2195 5.013 108.379 156.990 1.00 0.00 H ATOM 18459 H2 WAT 2195 5.535 107.512 158.115 1.00 0.00 H TER 18461 WAT 2195 ATOM 18461 O WAT 2196 109.802 44.380 62.464 1.00 0.00 O ATOM 18462 H1 WAT 2196 110.607 44.112 62.907 1.00 0.00 H ATOM 18463 H2 WAT 2196 109.909 45.320 62.319 1.00 0.00 H TER 18465 WAT 2196 ATOM 18465 O WAT 2197 114.626 21.243 155.009 1.00 0.00 O ATOM 18466 H1 WAT 2197 115.404 21.078 155.541 1.00 0.00 H ATOM 18467 H2 WAT 2197 114.609 22.193 154.897 1.00 0.00 H TER 18469 WAT 2197 ATOM 18469 O WAT 2198 58.685 108.683 145.112 1.00 0.00 O ATOM 18470 H1 WAT 2198 58.349 108.494 144.236 1.00 0.00 H ATOM 18471 H2 WAT 2198 57.910 108.926 145.618 1.00 0.00 H TER 18473 WAT 2198 ATOM 18473 O WAT 2199 34.458 80.554 129.267 1.00 0.00 O ATOM 18474 H1 WAT 2199 33.688 80.005 129.118 1.00 0.00 H ATOM 18475 H2 WAT 2199 34.100 81.399 129.538 1.00 0.00 H TER 18477 WAT 2199 ATOM 18477 O WAT 2200 92.828 12.744 147.142 1.00 0.00 O ATOM 18478 H1 WAT 2200 92.141 12.367 146.591 1.00 0.00 H ATOM 18479 H2 WAT 2200 92.517 12.610 148.037 1.00 0.00 H TER 18481 WAT 2200 ATOM 18481 O WAT 2201 84.652 52.455 109.232 1.00 0.00 O ATOM 18482 H1 WAT 2201 84.956 53.046 108.544 1.00 0.00 H ATOM 18483 H2 WAT 2201 85.442 51.999 109.523 1.00 0.00 H TER 18485 WAT 2201 ATOM 18485 O WAT 2202 84.960 100.946 88.453 1.00 0.00 O ATOM 18486 H1 WAT 2202 85.801 100.903 88.910 1.00 0.00 H ATOM 18487 H2 WAT 2202 85.046 100.319 87.735 1.00 0.00 H TER 18489 WAT 2202 ATOM 18489 O WAT 2203 69.445 109.437 7.784 1.00 0.00 O ATOM 18490 H1 WAT 2203 69.930 110.151 7.369 1.00 0.00 H ATOM 18491 H2 WAT 2203 69.539 108.701 7.181 1.00 0.00 H TER 18493 WAT 2203 ATOM 18493 O WAT 2204 50.763 101.665 65.791 1.00 0.00 O ATOM 18494 H1 WAT 2204 51.476 102.039 66.308 1.00 0.00 H ATOM 18495 H2 WAT 2204 50.053 102.303 65.863 1.00 0.00 H TER 18497 WAT 2204 ATOM 18497 O WAT 2205 1.393 88.571 93.876 1.00 0.00 O ATOM 18498 H1 WAT 2205 2.266 88.943 93.750 1.00 0.00 H ATOM 18499 H2 WAT 2205 0.874 88.928 93.155 1.00 0.00 H TER 18501 WAT 2205 ATOM 18501 O WAT 2206 112.677 27.459 143.110 1.00 0.00 O ATOM 18502 H1 WAT 2206 112.712 26.505 143.038 1.00 0.00 H ATOM 18503 H2 WAT 2206 113.390 27.767 142.550 1.00 0.00 H TER 18505 WAT 2206 ATOM 18505 O WAT 2207 121.230 33.583 89.224 1.00 0.00 O ATOM 18506 H1 WAT 2207 120.769 33.845 88.427 1.00 0.00 H ATOM 18507 H2 WAT 2207 122.002 34.148 89.251 1.00 0.00 H TER 18509 WAT 2207 ATOM 18509 O WAT 2208 135.774 11.757 156.690 1.00 0.00 O ATOM 18510 H1 WAT 2208 135.409 12.179 155.912 1.00 0.00 H ATOM 18511 H2 WAT 2208 135.435 12.271 157.422 1.00 0.00 H TER 18513 WAT 2208 ATOM 18513 O WAT 2209 133.391 127.379 73.950 1.00 0.00 O ATOM 18514 H1 WAT 2209 133.807 126.527 73.812 1.00 0.00 H ATOM 18515 H2 WAT 2209 133.676 127.645 74.824 1.00 0.00 H TER 18517 WAT 2209 ATOM 18517 O WAT 2210 88.131 123.914 105.856 1.00 0.00 O ATOM 18518 H1 WAT 2210 88.799 124.177 106.490 1.00 0.00 H ATOM 18519 H2 WAT 2210 88.605 123.379 105.219 1.00 0.00 H TER 18521 WAT 2210 ATOM 18521 O WAT 2211 79.317 97.906 98.233 1.00 0.00 O ATOM 18522 H1 WAT 2211 79.983 98.572 98.404 1.00 0.00 H ATOM 18523 H2 WAT 2211 79.664 97.405 97.495 1.00 0.00 H TER 18525 WAT 2211 ATOM 18525 O WAT 2212 123.824 119.957 111.731 1.00 0.00 O ATOM 18526 H1 WAT 2212 124.247 120.384 112.476 1.00 0.00 H ATOM 18527 H2 WAT 2212 124.270 119.113 111.654 1.00 0.00 H TER 18529 WAT 2212 ATOM 18529 O WAT 2213 75.261 42.125 61.536 1.00 0.00 O ATOM 18530 H1 WAT 2213 75.789 42.922 61.498 1.00 0.00 H ATOM 18531 H2 WAT 2213 75.061 41.927 60.621 1.00 0.00 H TER 18533 WAT 2213 ATOM 18533 O WAT 2214 84.025 25.123 129.852 1.00 0.00 O ATOM 18534 H1 WAT 2214 84.978 25.059 129.790 1.00 0.00 H ATOM 18535 H2 WAT 2214 83.828 26.025 129.599 1.00 0.00 H TER 18537 WAT 2214 ATOM 18537 O WAT 2215 68.779 2.931 10.411 1.00 0.00 O ATOM 18538 H1 WAT 2215 69.019 3.843 10.576 1.00 0.00 H ATOM 18539 H2 WAT 2215 68.060 2.983 9.781 1.00 0.00 H TER 18541 WAT 2215 ATOM 18541 O WAT 2216 66.912 46.654 84.399 1.00 0.00 O ATOM 18542 H1 WAT 2216 65.967 46.765 84.499 1.00 0.00 H ATOM 18543 H2 WAT 2216 67.293 47.353 84.930 1.00 0.00 H TER 18545 WAT 2216 ATOM 18545 O WAT 2217 83.967 88.269 117.768 1.00 0.00 O ATOM 18546 H1 WAT 2217 83.499 87.444 117.895 1.00 0.00 H ATOM 18547 H2 WAT 2217 84.496 88.368 118.560 1.00 0.00 H TER 18549 WAT 2217 ATOM 18549 O WAT 2218 70.045 107.280 5.932 1.00 0.00 O ATOM 18550 H1 WAT 2218 70.759 107.438 5.315 1.00 0.00 H ATOM 18551 H2 WAT 2218 69.308 107.013 5.383 1.00 0.00 H TER 18553 WAT 2218 ATOM 18553 O WAT 2219 122.735 59.679 15.820 1.00 0.00 O ATOM 18554 H1 WAT 2219 123.098 59.334 15.004 1.00 0.00 H ATOM 18555 H2 WAT 2219 122.071 59.039 16.076 1.00 0.00 H TER 18557 WAT 2219 ATOM 18557 O WAT 2220 56.019 67.053 87.901 1.00 0.00 O ATOM 18558 H1 WAT 2220 55.427 66.433 87.474 1.00 0.00 H ATOM 18559 H2 WAT 2220 56.311 67.630 87.196 1.00 0.00 H TER 18561 WAT 2220 ATOM 18561 O WAT 2221 91.251 0.036 150.241 1.00 0.00 O ATOM 18562 H1 WAT 2221 91.447 -0.095 151.168 1.00 0.00 H ATOM 18563 H2 WAT 2221 91.991 0.544 149.909 1.00 0.00 H TER 18565 WAT 2221 ATOM 18565 O WAT 2222 16.696 130.323 137.229 1.00 0.00 O ATOM 18566 H1 WAT 2222 17.167 129.800 136.580 1.00 0.00 H ATOM 18567 H2 WAT 2222 15.780 130.274 136.957 1.00 0.00 H TER 18569 WAT 2222 ATOM 18569 O WAT 2223 57.213 36.490 19.324 1.00 0.00 O ATOM 18570 H1 WAT 2223 57.768 35.714 19.405 1.00 0.00 H ATOM 18571 H2 WAT 2223 56.494 36.334 19.935 1.00 0.00 H TER 18573 WAT 2223 ATOM 18573 O WAT 2224 10.283 23.979 108.458 1.00 0.00 O ATOM 18574 H1 WAT 2224 11.188 24.003 108.768 1.00 0.00 H ATOM 18575 H2 WAT 2224 9.756 23.979 109.257 1.00 0.00 H TER 18577 WAT 2224 ATOM 18577 O WAT 2225 76.895 4.495 59.014 1.00 0.00 O ATOM 18578 H1 WAT 2225 76.909 4.534 58.058 1.00 0.00 H ATOM 18579 H2 WAT 2225 76.942 3.560 59.216 1.00 0.00 H TER 18581 WAT 2225 ATOM 18581 O WAT 2226 110.712 56.234 13.579 1.00 0.00 O ATOM 18582 H1 WAT 2226 110.453 55.722 14.345 1.00 0.00 H ATOM 18583 H2 WAT 2226 111.657 56.352 13.678 1.00 0.00 H TER 18585 WAT 2226 ATOM 18585 O WAT 2227 124.494 19.103 0.943 1.00 0.00 O ATOM 18586 H1 WAT 2227 124.831 18.772 1.776 1.00 0.00 H ATOM 18587 H2 WAT 2227 123.923 19.831 1.188 1.00 0.00 H TER 18589 WAT 2227 ATOM 18589 O WAT 2228 137.448 110.795 138.796 1.00 0.00 O ATOM 18590 H1 WAT 2228 138.022 110.045 138.642 1.00 0.00 H ATOM 18591 H2 WAT 2228 136.573 110.474 138.579 1.00 0.00 H TER 18593 WAT 2228 ATOM 18593 O WAT 2229 21.783 141.426 150.645 1.00 0.00 O ATOM 18594 H1 WAT 2229 21.383 141.857 151.400 1.00 0.00 H ATOM 18595 H2 WAT 2229 22.048 140.566 150.973 1.00 0.00 H TER 18597 WAT 2229 ATOM 18597 O WAT 2230 122.110 8.039 22.282 1.00 0.00 O ATOM 18598 H1 WAT 2230 121.325 8.526 22.534 1.00 0.00 H ATOM 18599 H2 WAT 2230 121.798 7.149 22.121 1.00 0.00 H TER 18601 WAT 2230 ATOM 18601 O WAT 2231 10.841 145.736 115.293 1.00 0.00 O ATOM 18602 H1 WAT 2231 10.740 146.642 115.001 1.00 0.00 H ATOM 18603 H2 WAT 2231 11.450 145.348 114.665 1.00 0.00 H TER 18605 WAT 2231 ATOM 18605 O WAT 2232 79.716 95.939 86.062 1.00 0.00 O ATOM 18606 H1 WAT 2232 80.176 96.678 85.663 1.00 0.00 H ATOM 18607 H2 WAT 2232 78.807 96.044 85.782 1.00 0.00 H TER 18609 WAT 2232 ATOM 18609 O WAT 2233 145.083 101.672 149.780 1.00 0.00 O ATOM 18610 H1 WAT 2233 144.942 102.135 148.954 1.00 0.00 H ATOM 18611 H2 WAT 2233 144.317 101.105 149.870 1.00 0.00 H TER 18613 WAT 2233 ATOM 18613 O WAT 2234 122.937 85.250 128.075 1.00 0.00 O ATOM 18614 H1 WAT 2234 122.328 85.965 128.258 1.00 0.00 H ATOM 18615 H2 WAT 2234 123.745 85.687 127.807 1.00 0.00 H TER 18617 WAT 2234 ATOM 18617 O WAT 2235 105.923 129.783 4.597 1.00 0.00 O ATOM 18618 H1 WAT 2235 105.863 130.618 4.132 1.00 0.00 H ATOM 18619 H2 WAT 2235 105.988 129.128 3.902 1.00 0.00 H TER 18621 WAT 2235 ATOM 18621 O WAT 2236 14.098 145.110 59.107 1.00 0.00 O ATOM 18622 H1 WAT 2236 13.564 144.418 58.717 1.00 0.00 H ATOM 18623 H2 WAT 2236 13.519 145.872 59.136 1.00 0.00 H TER 18625 WAT 2236 ATOM 18625 O WAT 2237 58.199 63.818 25.370 1.00 0.00 O ATOM 18626 H1 WAT 2237 58.876 64.158 24.785 1.00 0.00 H ATOM 18627 H2 WAT 2237 58.396 64.214 26.219 1.00 0.00 H TER 18629 WAT 2237 ATOM 18629 O WAT 2238 24.950 101.186 4.936 1.00 0.00 O ATOM 18630 H1 WAT 2238 24.133 101.028 4.464 1.00 0.00 H ATOM 18631 H2 WAT 2238 24.905 102.107 5.193 1.00 0.00 H TER 18633 WAT 2238 ATOM 18633 O WAT 2239 141.242 96.421 8.312 1.00 0.00 O ATOM 18634 H1 WAT 2239 140.749 96.501 9.128 1.00 0.00 H ATOM 18635 H2 WAT 2239 142.141 96.644 8.551 1.00 0.00 H TER 18637 WAT 2239 ATOM 18637 O WAT 2240 19.825 139.406 110.215 1.00 0.00 O ATOM 18638 H1 WAT 2240 19.515 139.173 109.340 1.00 0.00 H ATOM 18639 H2 WAT 2240 20.780 139.380 110.146 1.00 0.00 H TER 18641 WAT 2240 ATOM 18641 O WAT 2241 89.715 133.854 87.774 1.00 0.00 O ATOM 18642 H1 WAT 2241 89.846 133.539 88.669 1.00 0.00 H ATOM 18643 H2 WAT 2241 90.025 133.138 87.220 1.00 0.00 H TER 18645 WAT 2241 ATOM 18645 O WAT 2242 143.892 6.348 79.799 1.00 0.00 O ATOM 18646 H1 WAT 2242 144.730 6.810 79.783 1.00 0.00 H ATOM 18647 H2 WAT 2242 143.344 6.825 79.176 1.00 0.00 H TER 18649 WAT 2242 ATOM 18649 O WAT 2243 117.999 60.376 138.084 1.00 0.00 O ATOM 18650 H1 WAT 2243 118.837 59.915 138.043 1.00 0.00 H ATOM 18651 H2 WAT 2243 117.480 59.993 137.377 1.00 0.00 H TER 18653 WAT 2243 ATOM 18653 O WAT 2244 10.288 124.343 94.865 1.00 0.00 O ATOM 18654 H1 WAT 2244 10.450 123.967 95.731 1.00 0.00 H ATOM 18655 H2 WAT 2244 9.384 124.655 94.905 1.00 0.00 H TER 18657 WAT 2244 ATOM 18657 O WAT 2245 97.541 49.386 153.995 1.00 0.00 O ATOM 18658 H1 WAT 2245 97.665 49.326 153.048 1.00 0.00 H ATOM 18659 H2 WAT 2245 97.248 50.286 154.141 1.00 0.00 H TER 18661 WAT 2245 ATOM 18661 O WAT 2246 133.597 27.212 93.292 1.00 0.00 O ATOM 18662 H1 WAT 2246 133.380 27.940 92.709 1.00 0.00 H ATOM 18663 H2 WAT 2246 133.279 27.490 94.151 1.00 0.00 H TER 18665 WAT 2246 ATOM 18665 O WAT 2247 32.711 38.652 134.881 1.00 0.00 O ATOM 18666 H1 WAT 2247 32.155 37.922 135.153 1.00 0.00 H ATOM 18667 H2 WAT 2247 33.604 38.321 134.972 1.00 0.00 H TER 18669 WAT 2247 ATOM 18669 O WAT 2248 104.714 87.258 64.317 1.00 0.00 O ATOM 18670 H1 WAT 2248 105.390 86.711 64.717 1.00 0.00 H ATOM 18671 H2 WAT 2248 105.137 87.641 63.549 1.00 0.00 H TER 18673 WAT 2248 ATOM 18673 O WAT 2249 23.837 134.711 116.192 1.00 0.00 O ATOM 18674 H1 WAT 2249 23.340 134.291 115.490 1.00 0.00 H ATOM 18675 H2 WAT 2249 23.586 134.233 116.983 1.00 0.00 H TER 18677 WAT 2249 ATOM 18677 O WAT 2250 67.725 135.971 50.837 1.00 0.00 O ATOM 18678 H1 WAT 2250 68.623 136.299 50.889 1.00 0.00 H ATOM 18679 H2 WAT 2250 67.766 135.097 51.223 1.00 0.00 H TER 18681 WAT 2250 ATOM 18681 O WAT 2251 121.921 141.415 9.378 1.00 0.00 O ATOM 18682 H1 WAT 2251 121.487 142.197 9.720 1.00 0.00 H ATOM 18683 H2 WAT 2251 121.484 141.245 8.543 1.00 0.00 H TER 18685 WAT 2251 ATOM 18685 O WAT 2252 61.353 138.619 88.126 1.00 0.00 O ATOM 18686 H1 WAT 2252 62.190 139.081 88.166 1.00 0.00 H ATOM 18687 H2 WAT 2252 61.567 137.770 87.740 1.00 0.00 H TER 18689 WAT 2252 ATOM 18689 O WAT 2253 57.772 16.385 71.228 1.00 0.00 O ATOM 18690 H1 WAT 2253 57.724 16.889 70.415 1.00 0.00 H ATOM 18691 H2 WAT 2253 58.699 16.160 71.315 1.00 0.00 H TER 18693 WAT 2253 ATOM 18693 O WAT 2254 70.602 95.868 100.226 1.00 0.00 O ATOM 18694 H1 WAT 2254 70.668 95.781 101.177 1.00 0.00 H ATOM 18695 H2 WAT 2254 70.950 95.044 99.885 1.00 0.00 H TER 18697 WAT 2254 ATOM 18697 O WAT 2255 81.715 10.764 83.650 1.00 0.00 O ATOM 18698 H1 WAT 2255 82.220 11.577 83.662 1.00 0.00 H ATOM 18699 H2 WAT 2255 80.827 11.030 83.889 1.00 0.00 H TER 18701 WAT 2255 ATOM 18701 O WAT 2256 21.781 114.896 143.490 1.00 0.00 O ATOM 18702 H1 WAT 2256 21.721 114.063 143.022 1.00 0.00 H ATOM 18703 H2 WAT 2256 21.993 115.537 142.812 1.00 0.00 H TER 18705 WAT 2256 ATOM 18705 O WAT 2257 23.658 51.902 93.603 1.00 0.00 O ATOM 18706 H1 WAT 2257 24.118 51.081 93.778 1.00 0.00 H ATOM 18707 H2 WAT 2257 22.787 51.632 93.314 1.00 0.00 H TER 18709 WAT 2257 ATOM 18709 O WAT 2258 97.517 47.791 101.233 1.00 0.00 O ATOM 18710 H1 WAT 2258 97.799 47.944 102.135 1.00 0.00 H ATOM 18711 H2 WAT 2258 98.332 47.739 100.733 1.00 0.00 H TER 18713 WAT 2258 ATOM 18713 O WAT 2259 7.352 28.709 96.944 1.00 0.00 O ATOM 18714 H1 WAT 2259 8.020 29.284 96.570 1.00 0.00 H ATOM 18715 H2 WAT 2259 7.821 28.192 97.599 1.00 0.00 H TER 18717 WAT 2259 ATOM 18717 O WAT 2260 55.100 14.811 120.153 1.00 0.00 O ATOM 18718 H1 WAT 2260 55.698 14.121 120.438 1.00 0.00 H ATOM 18719 H2 WAT 2260 55.459 15.613 120.534 1.00 0.00 H TER 18721 WAT 2260 ATOM 18721 O WAT 2261 53.386 35.240 153.386 1.00 0.00 O ATOM 18722 H1 WAT 2261 53.499 34.487 152.806 1.00 0.00 H ATOM 18723 H2 WAT 2261 53.956 35.055 154.132 1.00 0.00 H TER 18725 WAT 2261 ATOM 18725 O WAT 2262 115.670 59.441 7.783 1.00 0.00 O ATOM 18726 H1 WAT 2262 115.191 58.999 7.083 1.00 0.00 H ATOM 18727 H2 WAT 2262 115.793 58.767 8.452 1.00 0.00 H TER 18729 WAT 2262 ATOM 18729 O WAT 2263 12.237 36.630 84.100 1.00 0.00 O ATOM 18730 H1 WAT 2263 12.821 36.066 83.593 1.00 0.00 H ATOM 18731 H2 WAT 2263 12.367 37.503 83.730 1.00 0.00 H TER 18733 WAT 2263 ATOM 18733 O WAT 2264 4.364 51.296 141.121 1.00 0.00 O ATOM 18734 H1 WAT 2264 3.705 51.987 141.194 1.00 0.00 H ATOM 18735 H2 WAT 2264 5.189 51.727 141.346 1.00 0.00 H TER 18737 WAT 2264 ATOM 18737 O WAT 2265 123.567 69.269 118.766 1.00 0.00 O ATOM 18738 H1 WAT 2265 122.735 69.739 118.705 1.00 0.00 H ATOM 18739 H2 WAT 2265 123.638 68.800 117.934 1.00 0.00 H TER 18741 WAT 2265 ATOM 18741 O WAT 2266 51.009 69.460 115.753 1.00 0.00 O ATOM 18742 H1 WAT 2266 50.074 69.392 115.557 1.00 0.00 H ATOM 18743 H2 WAT 2266 51.424 68.835 115.159 1.00 0.00 H TER 18745 WAT 2266 ATOM 18745 O WAT 2267 61.224 43.256 74.017 1.00 0.00 O ATOM 18746 H1 WAT 2267 61.212 42.708 74.802 1.00 0.00 H ATOM 18747 H2 WAT 2267 60.301 43.427 73.831 1.00 0.00 H TER 18749 WAT 2267 ATOM 18749 O WAT 2268 65.088 117.660 126.391 1.00 0.00 O ATOM 18750 H1 WAT 2268 65.220 116.970 125.741 1.00 0.00 H ATOM 18751 H2 WAT 2268 64.877 118.438 125.875 1.00 0.00 H TER 18753 WAT 2268 ATOM 18753 O WAT 2269 112.393 86.435 115.763 1.00 0.00 O ATOM 18754 H1 WAT 2269 111.875 86.719 116.516 1.00 0.00 H ATOM 18755 H2 WAT 2269 113.295 86.652 115.998 1.00 0.00 H TER 18757 WAT 2269 ATOM 18757 O WAT 2270 9.679 71.002 18.286 1.00 0.00 O ATOM 18758 H1 WAT 2270 8.795 71.278 18.527 1.00 0.00 H ATOM 18759 H2 WAT 2270 10.162 71.820 18.171 1.00 0.00 H TER 18761 WAT 2270 ATOM 18761 O WAT 2271 132.505 125.269 68.075 1.00 0.00 O ATOM 18762 H1 WAT 2271 131.732 125.833 68.059 1.00 0.00 H ATOM 18763 H2 WAT 2271 132.393 124.732 68.860 1.00 0.00 H TER 18765 WAT 2271 ATOM 18765 O WAT 2272 110.158 113.350 137.656 1.00 0.00 O ATOM 18766 H1 WAT 2272 109.377 113.815 137.356 1.00 0.00 H ATOM 18767 H2 WAT 2272 110.524 113.911 138.339 1.00 0.00 H TER 18769 WAT 2272 ATOM 18769 O WAT 2273 22.485 82.342 129.516 1.00 0.00 O ATOM 18770 H1 WAT 2273 22.394 81.825 130.316 1.00 0.00 H ATOM 18771 H2 WAT 2273 22.043 83.168 129.713 1.00 0.00 H TER 18773 WAT 2273 ATOM 18773 O WAT 2274 31.135 110.006 147.061 1.00 0.00 O ATOM 18774 H1 WAT 2274 31.782 110.155 146.372 1.00 0.00 H ATOM 18775 H2 WAT 2274 30.715 110.858 147.184 1.00 0.00 H TER 18777 WAT 2274 ATOM 18777 O WAT 2275 120.819 15.356 92.134 1.00 0.00 O ATOM 18778 H1 WAT 2275 121.477 16.033 91.975 1.00 0.00 H ATOM 18779 H2 WAT 2275 120.492 15.542 93.014 1.00 0.00 H TER 18781 WAT 2275 ATOM 18781 O WAT 2276 34.386 141.865 72.183 1.00 0.00 O ATOM 18782 H1 WAT 2276 35.206 141.989 71.704 1.00 0.00 H ATOM 18783 H2 WAT 2276 34.466 140.996 72.575 1.00 0.00 H TER 18785 WAT 2276 ATOM 18785 O WAT 2277 122.643 32.327 86.201 1.00 0.00 O ATOM 18786 H1 WAT 2277 123.065 33.179 86.305 1.00 0.00 H ATOM 18787 H2 WAT 2277 122.939 31.819 86.957 1.00 0.00 H TER 18789 WAT 2277 ATOM 18789 O WAT 2278 124.491 109.054 9.238 1.00 0.00 O ATOM 18790 H1 WAT 2278 123.543 109.178 9.191 1.00 0.00 H ATOM 18791 H2 WAT 2278 124.854 109.786 8.741 1.00 0.00 H TER 18793 WAT 2278 ATOM 18793 O WAT 2279 133.311 22.584 123.589 1.00 0.00 O ATOM 18794 H1 WAT 2279 132.593 22.034 123.902 1.00 0.00 H ATOM 18795 H2 WAT 2279 133.239 22.552 122.635 1.00 0.00 H TER 18797 WAT 2279 ATOM 18797 O WAT 2280 31.186 90.656 58.998 1.00 0.00 O ATOM 18798 H1 WAT 2280 31.399 91.513 58.629 1.00 0.00 H ATOM 18799 H2 WAT 2280 30.257 90.536 58.803 1.00 0.00 H TER 18801 WAT 2280 ATOM 18801 O WAT 2281 128.613 62.148 115.572 1.00 0.00 O ATOM 18802 H1 WAT 2281 127.847 61.589 115.443 1.00 0.00 H ATOM 18803 H2 WAT 2281 129.294 61.750 115.029 1.00 0.00 H TER 18805 WAT 2281 ATOM 18805 O WAT 2282 40.596 106.665 109.212 1.00 0.00 O ATOM 18806 H1 WAT 2282 40.226 107.243 109.879 1.00 0.00 H ATOM 18807 H2 WAT 2282 40.601 107.192 108.413 1.00 0.00 H TER 18809 WAT 2282 ATOM 18809 O WAT 2283 45.014 85.993 96.941 1.00 0.00 O ATOM 18810 H1 WAT 2283 44.415 86.154 97.670 1.00 0.00 H ATOM 18811 H2 WAT 2283 45.035 86.822 96.462 1.00 0.00 H TER 18813 WAT 2283 ATOM 18813 O WAT 2284 33.745 92.566 112.818 1.00 0.00 O ATOM 18814 H1 WAT 2284 34.283 93.356 112.760 1.00 0.00 H ATOM 18815 H2 WAT 2284 33.431 92.556 113.722 1.00 0.00 H TER 18817 WAT 2284 ATOM 18817 O WAT 2285 21.011 11.208 17.579 1.00 0.00 O ATOM 18818 H1 WAT 2285 20.544 10.520 17.105 1.00 0.00 H ATOM 18819 H2 WAT 2285 20.504 11.335 18.381 1.00 0.00 H TER 18821 WAT 2285 ATOM 18821 O WAT 2286 45.710 75.259 79.882 1.00 0.00 O ATOM 18822 H1 WAT 2286 45.839 75.278 78.933 1.00 0.00 H ATOM 18823 H2 WAT 2286 46.181 74.478 80.172 1.00 0.00 H TER 18825 WAT 2286 ATOM 18825 O WAT 2287 6.707 25.664 134.175 1.00 0.00 O ATOM 18826 H1 WAT 2287 7.107 24.831 133.924 1.00 0.00 H ATOM 18827 H2 WAT 2287 5.807 25.602 133.855 1.00 0.00 H TER 18829 WAT 2287 ATOM 18829 O WAT 2288 135.856 19.828 98.027 1.00 0.00 O ATOM 18830 H1 WAT 2288 135.308 19.311 98.618 1.00 0.00 H ATOM 18831 H2 WAT 2288 136.749 19.539 98.216 1.00 0.00 H TER 18833 WAT 2288 ATOM 18833 O WAT 2289 130.749 9.960 100.353 1.00 0.00 O ATOM 18834 H1 WAT 2289 130.008 10.387 99.923 1.00 0.00 H ATOM 18835 H2 WAT 2289 131.266 9.595 99.634 1.00 0.00 H TER 18837 WAT 2289 ATOM 18837 O WAT 2290 7.431 54.661 110.034 1.00 0.00 O ATOM 18838 H1 WAT 2290 7.945 53.975 110.460 1.00 0.00 H ATOM 18839 H2 WAT 2290 7.096 55.192 110.757 1.00 0.00 H TER 18841 WAT 2290 ATOM 18841 O WAT 2291 125.072 47.787 108.850 1.00 0.00 O ATOM 18842 H1 WAT 2291 124.985 48.725 109.018 1.00 0.00 H ATOM 18843 H2 WAT 2291 124.289 47.400 109.241 1.00 0.00 H TER 18845 WAT 2291 ATOM 18845 O WAT 2292 41.131 91.974 21.349 1.00 0.00 O ATOM 18846 H1 WAT 2292 41.697 92.680 21.661 1.00 0.00 H ATOM 18847 H2 WAT 2292 41.647 91.178 21.475 1.00 0.00 H TER 18849 WAT 2292 ATOM 18849 O WAT 2293 70.842 60.787 103.949 1.00 0.00 O ATOM 18850 H1 WAT 2293 71.736 60.508 103.753 1.00 0.00 H ATOM 18851 H2 WAT 2293 70.413 60.836 103.095 1.00 0.00 H TER 18853 WAT 2293 ATOM 18853 O WAT 2294 62.532 23.274 67.143 1.00 0.00 O ATOM 18854 H1 WAT 2294 61.686 23.666 67.359 1.00 0.00 H ATOM 18855 H2 WAT 2294 62.515 23.179 66.191 1.00 0.00 H TER 18857 WAT 2294 ATOM 18857 O WAT 2295 101.807 84.496 106.761 1.00 0.00 O ATOM 18858 H1 WAT 2295 100.987 84.381 107.242 1.00 0.00 H ATOM 18859 H2 WAT 2295 101.875 85.441 106.626 1.00 0.00 H TER 18861 WAT 2295 ATOM 18861 O WAT 2296 127.405 40.850 8.049 1.00 0.00 O ATOM 18862 H1 WAT 2296 126.851 41.321 7.427 1.00 0.00 H ATOM 18863 H2 WAT 2296 127.804 40.150 7.532 1.00 0.00 H TER 18865 WAT 2296 ATOM 18865 O WAT 2297 77.550 126.952 11.239 1.00 0.00 O ATOM 18866 H1 WAT 2297 76.915 126.469 10.711 1.00 0.00 H ATOM 18867 H2 WAT 2297 77.441 126.604 12.123 1.00 0.00 H TER 18869 WAT 2297 ATOM 18869 O WAT 2298 17.007 112.919 66.220 1.00 0.00 O ATOM 18870 H1 WAT 2298 17.329 112.040 66.020 1.00 0.00 H ATOM 18871 H2 WAT 2298 17.205 113.041 67.149 1.00 0.00 H TER 18873 WAT 2298 ATOM 18873 O WAT 2299 105.764 32.322 56.541 1.00 0.00 O ATOM 18874 H1 WAT 2299 105.566 33.212 56.832 1.00 0.00 H ATOM 18875 H2 WAT 2299 106.648 32.154 56.870 1.00 0.00 H TER 18877 WAT 2299 ATOM 18877 O WAT 2300 85.538 110.093 112.095 1.00 0.00 O ATOM 18878 H1 WAT 2300 85.278 109.274 112.516 1.00 0.00 H ATOM 18879 H2 WAT 2300 86.064 110.545 112.755 1.00 0.00 H TER 18881 WAT 2300 ATOM 18881 O WAT 2301 73.031 128.478 154.777 1.00 0.00 O ATOM 18882 H1 WAT 2301 72.740 128.207 155.648 1.00 0.00 H ATOM 18883 H2 WAT 2301 72.853 127.721 154.219 1.00 0.00 H TER 18885 WAT 2301 ATOM 18885 O WAT 2302 133.901 74.655 14.671 1.00 0.00 O ATOM 18886 H1 WAT 2302 134.734 75.117 14.573 1.00 0.00 H ATOM 18887 H2 WAT 2302 133.460 75.107 15.390 1.00 0.00 H TER 18889 WAT 2302 ATOM 18889 O WAT 2303 109.386 96.225 75.320 1.00 0.00 O ATOM 18890 H1 WAT 2303 109.453 95.968 76.240 1.00 0.00 H ATOM 18891 H2 WAT 2303 110.233 95.985 74.943 1.00 0.00 H TER 18893 WAT 2303 ATOM 18893 O WAT 2304 34.470 138.323 16.536 1.00 0.00 O ATOM 18894 H1 WAT 2304 35.428 138.320 16.535 1.00 0.00 H ATOM 18895 H2 WAT 2304 34.229 137.761 15.800 1.00 0.00 H TER 18897 WAT 2304 ATOM 18897 O WAT 2305 75.533 121.926 15.308 1.00 0.00 O ATOM 18898 H1 WAT 2305 74.971 122.689 15.438 1.00 0.00 H ATOM 18899 H2 WAT 2305 76.190 121.991 16.002 1.00 0.00 H TER 18901 WAT 2305 ATOM 18901 O WAT 2306 80.258 117.538 117.515 1.00 0.00 O ATOM 18902 H1 WAT 2306 80.539 116.632 117.643 1.00 0.00 H ATOM 18903 H2 WAT 2306 79.667 117.502 116.763 1.00 0.00 H TER 18905 WAT 2306 ATOM 18905 O WAT 2307 9.330 101.078 73.976 1.00 0.00 O ATOM 18906 H1 WAT 2307 9.682 101.602 73.258 1.00 0.00 H ATOM 18907 H2 WAT 2307 9.497 101.602 74.760 1.00 0.00 H TER 18909 WAT 2307 ATOM 18909 O WAT 2308 100.589 32.359 123.890 1.00 0.00 O ATOM 18910 H1 WAT 2308 100.334 32.534 124.796 1.00 0.00 H ATOM 18911 H2 WAT 2308 99.788 32.495 123.385 1.00 0.00 H TER 18913 WAT 2308 ATOM 18913 O WAT 2309 127.179 110.668 131.691 1.00 0.00 O ATOM 18914 H1 WAT 2309 127.730 111.450 131.710 1.00 0.00 H ATOM 18915 H2 WAT 2309 126.430 110.916 131.150 1.00 0.00 H TER 18917 WAT 2309 ATOM 18917 O WAT 2310 45.318 121.965 133.998 1.00 0.00 O ATOM 18918 H1 WAT 2310 45.264 122.830 133.591 1.00 0.00 H ATOM 18919 H2 WAT 2310 46.164 121.965 134.448 1.00 0.00 H TER 18921 WAT 2310 ATOM 18921 O WAT 2311 99.743 135.595 92.337 1.00 0.00 O ATOM 18922 H1 WAT 2311 100.364 135.794 93.038 1.00 0.00 H ATOM 18923 H2 WAT 2311 99.456 136.452 92.021 1.00 0.00 H TER 18925 WAT 2311 ATOM 18925 O WAT 2312 129.845 90.576 108.268 1.00 0.00 O ATOM 18926 H1 WAT 2312 129.944 89.758 107.782 1.00 0.00 H ATOM 18927 H2 WAT 2312 129.013 90.937 107.963 1.00 0.00 H TER 18929 WAT 2312 ATOM 18929 O WAT 2313 30.389 117.415 107.786 1.00 0.00 O ATOM 18930 H1 WAT 2313 30.459 117.939 108.584 1.00 0.00 H ATOM 18931 H2 WAT 2313 30.348 116.510 108.096 1.00 0.00 H TER 18933 WAT 2313 ATOM 18933 O WAT 2314 120.948 88.271 131.645 1.00 0.00 O ATOM 18934 H1 WAT 2314 121.015 88.307 130.691 1.00 0.00 H ATOM 18935 H2 WAT 2314 120.838 89.183 131.913 1.00 0.00 H TER 18937 WAT 2314 ATOM 18937 O WAT 2315 103.474 54.759 151.072 1.00 0.00 O ATOM 18938 H1 WAT 2315 102.930 55.460 150.713 1.00 0.00 H ATOM 18939 H2 WAT 2315 104.372 55.049 150.916 1.00 0.00 H TER 18941 WAT 2315 ATOM 18941 O WAT 2316 113.198 44.357 79.792 1.00 0.00 O ATOM 18942 H1 WAT 2316 113.334 44.314 78.846 1.00 0.00 H ATOM 18943 H2 WAT 2316 112.498 43.726 79.962 1.00 0.00 H TER 18945 WAT 2316 ATOM 18945 O WAT 2317 66.906 7.514 118.005 1.00 0.00 O ATOM 18946 H1 WAT 2317 67.524 7.207 117.341 1.00 0.00 H ATOM 18947 H2 WAT 2317 67.252 8.364 118.279 1.00 0.00 H TER 18949 WAT 2317 ATOM 18949 O WAT 2318 16.950 51.816 135.114 1.00 0.00 O ATOM 18950 H1 WAT 2318 17.386 51.113 134.633 1.00 0.00 H ATOM 18951 H2 WAT 2318 16.918 51.504 136.018 1.00 0.00 H TER 18953 WAT 2318 ATOM 18953 O WAT 2319 33.392 30.649 69.445 1.00 0.00 O ATOM 18954 H1 WAT 2319 33.563 30.808 68.517 1.00 0.00 H ATOM 18955 H2 WAT 2319 32.726 31.296 69.680 1.00 0.00 H TER 18957 WAT 2319 ATOM 18957 O WAT 2320 38.403 138.054 59.699 1.00 0.00 O ATOM 18958 H1 WAT 2320 38.857 138.538 59.009 1.00 0.00 H ATOM 18959 H2 WAT 2320 37.494 138.346 59.636 1.00 0.00 H TER 18961 WAT 2320 ATOM 18961 O WAT 2321 55.985 7.459 8.162 1.00 0.00 O ATOM 18962 H1 WAT 2321 55.621 6.712 7.686 1.00 0.00 H ATOM 18963 H2 WAT 2321 55.224 7.996 8.383 1.00 0.00 H TER 18965 WAT 2321 ATOM 18965 O WAT 2322 33.390 56.535 58.346 1.00 0.00 O ATOM 18966 H1 WAT 2322 33.076 57.437 58.413 1.00 0.00 H ATOM 18967 H2 WAT 2322 34.090 56.476 58.997 1.00 0.00 H TER 18969 WAT 2322 ATOM 18969 O WAT 2323 90.237 1.181 95.333 1.00 0.00 O ATOM 18970 H1 WAT 2323 89.816 0.846 96.125 1.00 0.00 H ATOM 18971 H2 WAT 2323 90.472 2.083 95.550 1.00 0.00 H TER 18973 WAT 2323 ATOM 18973 O WAT 2324 78.882 39.575 92.148 1.00 0.00 O ATOM 18974 H1 WAT 2324 79.373 40.388 92.032 1.00 0.00 H ATOM 18975 H2 WAT 2324 79.549 38.920 92.353 1.00 0.00 H TER 18977 WAT 2324 ATOM 18977 O WAT 2325 117.447 49.514 145.636 1.00 0.00 O ATOM 18978 H1 WAT 2325 116.931 49.610 146.437 1.00 0.00 H ATOM 18979 H2 WAT 2325 117.938 50.333 145.568 1.00 0.00 H TER 18981 WAT 2325 ATOM 18981 O WAT 2326 1.190 21.137 102.664 1.00 0.00 O ATOM 18982 H1 WAT 2326 2.055 21.252 103.059 1.00 0.00 H ATOM 18983 H2 WAT 2326 1.205 21.697 101.888 1.00 0.00 H TER 18985 WAT 2326 ATOM 18985 O WAT 2327 7.217 18.004 2.975 1.00 0.00 O ATOM 18986 H1 WAT 2327 8.124 18.258 2.808 1.00 0.00 H ATOM 18987 H2 WAT 2327 7.273 17.381 3.700 1.00 0.00 H TER 18989 WAT 2327 ATOM 18989 O WAT 2328 72.714 52.640 132.636 1.00 0.00 O ATOM 18990 H1 WAT 2328 72.904 52.194 131.811 1.00 0.00 H ATOM 18991 H2 WAT 2328 71.795 52.898 132.564 1.00 0.00 H TER 18993 WAT 2328 ATOM 18993 O WAT 2329 18.592 43.334 110.538 1.00 0.00 O ATOM 18994 H1 WAT 2329 19.224 43.730 111.139 1.00 0.00 H ATOM 18995 H2 WAT 2329 17.740 43.513 110.934 1.00 0.00 H TER 18997 WAT 2329 ATOM 18997 O WAT 2330 55.967 122.174 85.877 1.00 0.00 O ATOM 18998 H1 WAT 2330 56.303 121.508 86.476 1.00 0.00 H ATOM 18999 H2 WAT 2330 55.035 122.235 86.086 1.00 0.00 H TER 19001 WAT 2330 ATOM 19001 O WAT 2331 47.240 106.905 10.925 1.00 0.00 O ATOM 19002 H1 WAT 2331 46.605 107.576 11.176 1.00 0.00 H ATOM 19003 H2 WAT 2331 47.108 106.790 9.984 1.00 0.00 H TER 19005 WAT 2331 ATOM 19005 O WAT 2332 18.756 76.149 78.389 1.00 0.00 O ATOM 19006 H1 WAT 2332 19.499 75.603 78.134 1.00 0.00 H ATOM 19007 H2 WAT 2332 18.028 75.827 77.856 1.00 0.00 H TER 19009 WAT 2332 ATOM 19009 O WAT 2333 77.306 38.323 151.452 1.00 0.00 O ATOM 19010 H1 WAT 2333 77.706 39.080 151.022 1.00 0.00 H ATOM 19011 H2 WAT 2333 77.979 38.008 152.056 1.00 0.00 H TER 19013 WAT 2333 ATOM 19013 O WAT 2334 31.240 6.597 65.224 1.00 0.00 O ATOM 19014 H1 WAT 2334 30.526 7.199 65.015 1.00 0.00 H ATOM 19015 H2 WAT 2334 31.988 6.932 64.728 1.00 0.00 H TER 19017 WAT 2334 ATOM 19017 O WAT 2335 132.575 79.367 21.800 1.00 0.00 O ATOM 19018 H1 WAT 2335 132.695 80.230 21.404 1.00 0.00 H ATOM 19019 H2 WAT 2335 131.888 79.497 22.454 1.00 0.00 H TER 19021 WAT 2335 ATOM 19021 O WAT 2336 128.151 67.740 106.617 1.00 0.00 O ATOM 19022 H1 WAT 2336 128.634 67.751 107.443 1.00 0.00 H ATOM 19023 H2 WAT 2336 128.614 67.100 106.076 1.00 0.00 H TER 19025 WAT 2336 ATOM 19025 O WAT 2337 114.675 70.463 150.770 1.00 0.00 O ATOM 19026 H1 WAT 2337 114.241 70.507 149.918 1.00 0.00 H ATOM 19027 H2 WAT 2337 114.553 71.334 151.147 1.00 0.00 H TER 19029 WAT 2337 ATOM 19029 O WAT 2338 7.372 144.028 24.665 1.00 0.00 O ATOM 19030 H1 WAT 2338 7.971 143.712 25.341 1.00 0.00 H ATOM 19031 H2 WAT 2338 6.503 143.786 24.984 1.00 0.00 H TER 19033 WAT 2338 ATOM 19033 O WAT 2339 97.929 25.666 80.899 1.00 0.00 O ATOM 19034 H1 WAT 2339 97.345 24.924 81.056 1.00 0.00 H ATOM 19035 H2 WAT 2339 97.963 25.747 79.946 1.00 0.00 H TER 19037 WAT 2339 ATOM 19037 O WAT 2340 91.380 2.854 148.014 1.00 0.00 O ATOM 19038 H1 WAT 2340 92.272 3.195 147.949 1.00 0.00 H ATOM 19039 H2 WAT 2340 90.986 3.350 148.731 1.00 0.00 H TER 19041 WAT 2340 ATOM 19041 O WAT 2341 100.081 136.158 85.365 1.00 0.00 O ATOM 19042 H1 WAT 2341 99.706 136.826 84.791 1.00 0.00 H ATOM 19043 H2 WAT 2341 99.424 135.463 85.385 1.00 0.00 H TER 19045 WAT 2341 ATOM 19045 O WAT 2342 20.464 72.162 83.063 1.00 0.00 O ATOM 19046 H1 WAT 2342 19.933 71.376 83.194 1.00 0.00 H ATOM 19047 H2 WAT 2342 20.604 72.506 83.945 1.00 0.00 H TER 19049 WAT 2342 ATOM 19049 O WAT 2343 112.998 56.371 99.408 1.00 0.00 O ATOM 19050 H1 WAT 2343 112.828 56.780 98.560 1.00 0.00 H ATOM 19051 H2 WAT 2343 113.437 55.548 99.194 1.00 0.00 H TER 19053 WAT 2343 ATOM 19053 O WAT 2344 8.191 19.718 144.637 1.00 0.00 O ATOM 19054 H1 WAT 2344 8.800 18.994 144.490 1.00 0.00 H ATOM 19055 H2 WAT 2344 7.858 19.575 145.522 1.00 0.00 H TER 19057 WAT 2344 ATOM 19057 O WAT 2345 16.484 119.326 63.767 1.00 0.00 O ATOM 19058 H1 WAT 2345 16.700 118.620 64.376 1.00 0.00 H ATOM 19059 H2 WAT 2345 15.984 118.898 63.072 1.00 0.00 H TER 19061 WAT 2345 ATOM 19061 O WAT 2346 116.454 44.829 87.171 1.00 0.00 O ATOM 19062 H1 WAT 2346 115.576 45.118 87.418 1.00 0.00 H ATOM 19063 H2 WAT 2346 117.041 45.448 87.606 1.00 0.00 H TER 19065 WAT 2346 ATOM 19065 O WAT 2347 45.705 143.481 157.399 1.00 0.00 O ATOM 19066 H1 WAT 2347 44.951 143.141 157.881 1.00 0.00 H ATOM 19067 H2 WAT 2347 46.320 143.757 158.079 1.00 0.00 H TER 19069 WAT 2347 ATOM 19069 O WAT 2348 36.347 109.162 4.695 1.00 0.00 O ATOM 19070 H1 WAT 2348 36.823 108.957 5.500 1.00 0.00 H ATOM 19071 H2 WAT 2348 36.829 108.701 4.008 1.00 0.00 H TER 19073 WAT 2348 ATOM 19073 O WAT 2349 131.586 78.732 28.122 1.00 0.00 O ATOM 19074 H1 WAT 2349 131.026 78.147 27.612 1.00 0.00 H ATOM 19075 H2 WAT 2349 131.810 78.228 28.904 1.00 0.00 H TER 19077 WAT 2349 ATOM 19077 O WAT 2350 127.991 116.351 119.823 1.00 0.00 O ATOM 19078 H1 WAT 2350 127.432 116.591 119.084 1.00 0.00 H ATOM 19079 H2 WAT 2350 127.407 116.365 120.580 1.00 0.00 H TER 19081 WAT 2350 ATOM 19081 O WAT 2351 74.433 135.202 69.150 1.00 0.00 O ATOM 19082 H1 WAT 2351 75.071 134.844 69.767 1.00 0.00 H ATOM 19083 H2 WAT 2351 73.749 134.535 69.098 1.00 0.00 H TER 19085 WAT 2351 ATOM 19085 O WAT 2352 108.175 20.888 71.894 1.00 0.00 O ATOM 19086 H1 WAT 2352 107.496 21.481 72.215 1.00 0.00 H ATOM 19087 H2 WAT 2352 107.691 20.156 71.510 1.00 0.00 H TER 19089 WAT 2352 ATOM 19089 O WAT 2353 115.098 23.227 96.292 1.00 0.00 O ATOM 19090 H1 WAT 2353 115.276 23.643 97.135 1.00 0.00 H ATOM 19091 H2 WAT 2353 115.961 22.981 95.959 1.00 0.00 H TER 19093 WAT 2353 ATOM 19093 O WAT 2354 2.611 55.808 73.819 1.00 0.00 O ATOM 19094 H1 WAT 2354 1.676 56.001 73.880 1.00 0.00 H ATOM 19095 H2 WAT 2354 2.650 54.927 73.446 1.00 0.00 H TER 19097 WAT 2354 ATOM 19097 O WAT 2355 91.650 66.142 85.689 1.00 0.00 O ATOM 19098 H1 WAT 2355 91.041 66.775 86.069 1.00 0.00 H ATOM 19099 H2 WAT 2355 91.898 65.579 86.423 1.00 0.00 H TER 19101 WAT 2355 ATOM 19101 O WAT 2356 70.813 135.113 70.558 1.00 0.00 O ATOM 19102 H1 WAT 2356 71.606 135.434 70.988 1.00 0.00 H ATOM 19103 H2 WAT 2356 70.940 134.166 70.499 1.00 0.00 H TER 19105 WAT 2356 ATOM 19105 O WAT 2357 93.905 117.864 55.554 1.00 0.00 O ATOM 19106 H1 WAT 2357 93.908 118.708 55.103 1.00 0.00 H ATOM 19107 H2 WAT 2357 94.827 117.694 55.749 1.00 0.00 H TER 19109 WAT 2357 ATOM 19109 O WAT 2358 138.522 109.701 90.418 1.00 0.00 O ATOM 19110 H1 WAT 2358 139.214 110.348 90.279 1.00 0.00 H ATOM 19111 H2 WAT 2358 138.827 108.921 89.954 1.00 0.00 H TER 19113 WAT 2358 ATOM 19113 O WAT 2359 90.316 117.601 113.381 1.00 0.00 O ATOM 19114 H1 WAT 2359 90.514 118.534 113.466 1.00 0.00 H ATOM 19115 H2 WAT 2359 90.383 117.259 114.272 1.00 0.00 H TER 19117 WAT 2359 ATOM 19117 O WAT 2360 96.549 11.355 137.120 1.00 0.00 O ATOM 19118 H1 WAT 2360 96.430 10.688 136.444 1.00 0.00 H ATOM 19119 H2 WAT 2360 97.408 11.735 136.933 1.00 0.00 H TER 19121 WAT 2360 ATOM 19121 O WAT 2361 12.221 26.256 6.774 1.00 0.00 O ATOM 19122 H1 WAT 2361 12.535 26.053 5.893 1.00 0.00 H ATOM 19123 H2 WAT 2361 12.988 26.137 7.335 1.00 0.00 H TER 19125 WAT 2361 ATOM 19125 O WAT 2362 69.374 116.176 151.769 1.00 0.00 O ATOM 19126 H1 WAT 2362 70.083 116.618 151.301 1.00 0.00 H ATOM 19127 H2 WAT 2362 68.581 116.429 151.296 1.00 0.00 H TER 19129 WAT 2362 ATOM 19129 O WAT 2363 24.358 30.336 21.704 1.00 0.00 O ATOM 19130 H1 WAT 2363 24.938 30.949 22.156 1.00 0.00 H ATOM 19131 H2 WAT 2363 24.942 29.656 21.369 1.00 0.00 H TER 19133 WAT 2363 ATOM 19133 O WAT 2364 92.283 136.397 99.483 1.00 0.00 O ATOM 19134 H1 WAT 2364 92.333 135.442 99.457 1.00 0.00 H ATOM 19135 H2 WAT 2364 93.118 136.670 99.863 1.00 0.00 H TER 19137 WAT 2364 ATOM 19137 O WAT 2365 114.671 46.623 144.115 1.00 0.00 O ATOM 19138 H1 WAT 2365 114.992 47.474 143.819 1.00 0.00 H ATOM 19139 H2 WAT 2365 114.719 46.667 145.070 1.00 0.00 H TER 19141 WAT 2365 ATOM 19141 O WAT 2366 100.420 73.253 157.108 1.00 0.00 O ATOM 19142 H1 WAT 2366 101.166 73.692 157.517 1.00 0.00 H ATOM 19143 H2 WAT 2366 100.557 73.375 156.168 1.00 0.00 H TER 19145 WAT 2366 ATOM 19145 O WAT 2367 141.788 146.058 73.035 1.00 0.00 O ATOM 19146 H1 WAT 2367 141.741 145.150 73.333 1.00 0.00 H ATOM 19147 H2 WAT 2367 141.503 146.026 72.122 1.00 0.00 H TER 19149 WAT 2367 ATOM 19149 O WAT 2368 90.047 90.061 109.002 1.00 0.00 O ATOM 19150 H1 WAT 2368 89.977 89.143 109.264 1.00 0.00 H ATOM 19151 H2 WAT 2368 89.141 90.342 108.873 1.00 0.00 H TER 19153 WAT 2368 ATOM 19153 O WAT 2369 71.193 142.900 120.242 1.00 0.00 O ATOM 19154 H1 WAT 2369 71.804 142.219 119.960 1.00 0.00 H ATOM 19155 H2 WAT 2369 71.641 143.340 120.964 1.00 0.00 H TER 19157 WAT 2369 ATOM 19157 O WAT 2370 112.579 96.978 150.373 1.00 0.00 O ATOM 19158 H1 WAT 2370 113.063 97.383 151.093 1.00 0.00 H ATOM 19159 H2 WAT 2370 112.849 97.469 149.597 1.00 0.00 H TER 19161 WAT 2370 ATOM 19161 O WAT 2371 135.421 127.977 64.128 1.00 0.00 O ATOM 19162 H1 WAT 2371 134.532 127.948 64.481 1.00 0.00 H ATOM 19163 H2 WAT 2371 135.948 127.496 64.767 1.00 0.00 H TER 19165 WAT 2371 ATOM 19165 O WAT 2372 83.639 2.753 86.453 1.00 0.00 O ATOM 19166 H1 WAT 2372 82.911 2.134 86.390 1.00 0.00 H ATOM 19167 H2 WAT 2372 84.383 2.287 86.072 1.00 0.00 H TER 19169 WAT 2372 ATOM 19169 O WAT 2373 16.036 38.578 128.244 1.00 0.00 O ATOM 19170 H1 WAT 2373 16.905 38.618 127.843 1.00 0.00 H ATOM 19171 H2 WAT 2373 15.890 37.646 128.406 1.00 0.00 H TER 19173 WAT 2373 ATOM 19173 O WAT 2374 83.262 32.403 1.968 1.00 0.00 O ATOM 19174 H1 WAT 2374 82.874 33.087 2.515 1.00 0.00 H ATOM 19175 H2 WAT 2374 82.513 31.915 1.627 1.00 0.00 H TER 19177 WAT 2374 ATOM 19177 O WAT 2375 50.215 103.688 1.092 1.00 0.00 O ATOM 19178 H1 WAT 2375 50.482 103.133 0.360 1.00 0.00 H ATOM 19179 H2 WAT 2375 50.664 103.316 1.851 1.00 0.00 H TER 19181 WAT 2375 ATOM 19181 O WAT 2376 41.545 19.944 129.999 1.00 0.00 O ATOM 19182 H1 WAT 2376 40.733 20.028 130.499 1.00 0.00 H ATOM 19183 H2 WAT 2376 42.092 19.362 130.527 1.00 0.00 H TER 19185 WAT 2376 ATOM 19185 O WAT 2377 26.759 107.157 124.047 1.00 0.00 O ATOM 19186 H1 WAT 2377 26.979 106.899 124.942 1.00 0.00 H ATOM 19187 H2 WAT 2377 27.082 108.055 123.970 1.00 0.00 H TER 19189 WAT 2377 ATOM 19189 O WAT 2378 104.859 125.957 18.935 1.00 0.00 O ATOM 19190 H1 WAT 2378 105.298 126.287 18.151 1.00 0.00 H ATOM 19191 H2 WAT 2378 104.043 126.455 18.981 1.00 0.00 H TER 19193 WAT 2378 ATOM 19193 O WAT 2379 74.409 51.503 3.832 1.00 0.00 O ATOM 19194 H1 WAT 2379 73.814 51.627 3.093 1.00 0.00 H ATOM 19195 H2 WAT 2379 74.262 52.268 4.388 1.00 0.00 H TER 19197 WAT 2379 ATOM 19197 O WAT 2380 82.036 28.422 18.236 1.00 0.00 O ATOM 19198 H1 WAT 2380 82.729 27.823 17.958 1.00 0.00 H ATOM 19199 H2 WAT 2380 82.493 29.107 18.723 1.00 0.00 H TER 19201 WAT 2380 ATOM 19201 O WAT 2381 48.832 71.427 136.748 1.00 0.00 O ATOM 19202 H1 WAT 2381 48.476 70.864 136.061 1.00 0.00 H ATOM 19203 H2 WAT 2381 48.508 72.302 136.531 1.00 0.00 H TER 19205 WAT 2381 ATOM 19205 O WAT 2382 111.423 16.563 101.432 1.00 0.00 O ATOM 19206 H1 WAT 2382 110.835 17.169 101.882 1.00 0.00 H ATOM 19207 H2 WAT 2382 112.251 16.635 101.908 1.00 0.00 H TER 19209 WAT 2382 ATOM 19209 O WAT 2383 55.995 52.590 151.367 1.00 0.00 O ATOM 19210 H1 WAT 2383 56.770 53.071 151.658 1.00 0.00 H ATOM 19211 H2 WAT 2383 55.885 51.897 152.017 1.00 0.00 H TER 19213 WAT 2383 ATOM 19213 O WAT 2384 133.356 117.295 71.311 1.00 0.00 O ATOM 19214 H1 WAT 2384 132.541 117.188 70.820 1.00 0.00 H ATOM 19215 H2 WAT 2384 134.034 116.957 70.726 1.00 0.00 H TER 19217 WAT 2384 ATOM 19217 O WAT 2385 86.060 42.524 117.621 1.00 0.00 O ATOM 19218 H1 WAT 2385 85.295 42.938 118.020 1.00 0.00 H ATOM 19219 H2 WAT 2385 86.809 42.944 118.045 1.00 0.00 H TER 19221 WAT 2385 ATOM 19221 O WAT 2386 70.926 144.679 86.237 1.00 0.00 O ATOM 19222 H1 WAT 2386 70.260 144.373 86.852 1.00 0.00 H ATOM 19223 H2 WAT 2386 70.428 145.079 85.524 1.00 0.00 H TER 19225 WAT 2386 ATOM 19225 O WAT 2387 14.634 82.858 133.309 1.00 0.00 O ATOM 19226 H1 WAT 2387 14.854 83.423 132.568 1.00 0.00 H ATOM 19227 H2 WAT 2387 14.045 83.387 133.847 1.00 0.00 H TER 19229 WAT 2387 ATOM 19229 O WAT 2388 7.961 82.137 132.329 1.00 0.00 O ATOM 19230 H1 WAT 2388 8.855 81.802 132.262 1.00 0.00 H ATOM 19231 H2 WAT 2388 7.894 82.784 131.627 1.00 0.00 H TER 19233 WAT 2388 ATOM 19233 O WAT 2389 34.504 24.107 10.501 1.00 0.00 O ATOM 19234 H1 WAT 2389 35.261 24.564 10.132 1.00 0.00 H ATOM 19235 H2 WAT 2389 34.375 23.354 9.924 1.00 0.00 H TER 19237 WAT 2389 ATOM 19237 O WAT 2390 18.886 58.246 128.315 1.00 0.00 O ATOM 19238 H1 WAT 2390 19.788 58.261 128.634 1.00 0.00 H ATOM 19239 H2 WAT 2390 18.383 58.693 128.997 1.00 0.00 H TER 19241 WAT 2390 ATOM 19241 O WAT 2391 5.394 22.972 136.555 1.00 0.00 O ATOM 19242 H1 WAT 2391 5.175 23.902 136.496 1.00 0.00 H ATOM 19243 H2 WAT 2391 4.934 22.571 135.818 1.00 0.00 H TER 19245 WAT 2391 ATOM 19245 O WAT 2392 132.478 114.970 73.016 1.00 0.00 O ATOM 19246 H1 WAT 2392 132.836 115.005 72.129 1.00 0.00 H ATOM 19247 H2 WAT 2392 133.005 115.597 73.512 1.00 0.00 H TER 19249 WAT 2392 ATOM 19249 O WAT 2393 29.887 84.742 20.706 1.00 0.00 O ATOM 19250 H1 WAT 2393 29.946 85.280 21.496 1.00 0.00 H ATOM 19251 H2 WAT 2393 30.772 84.399 20.584 1.00 0.00 H TER 19253 WAT 2393 ATOM 19253 O WAT 2394 114.902 130.651 113.636 1.00 0.00 O ATOM 19254 H1 WAT 2394 114.045 130.482 114.028 1.00 0.00 H ATOM 19255 H2 WAT 2394 114.703 131.052 112.790 1.00 0.00 H TER 19257 WAT 2394 ATOM 19257 O WAT 2395 69.753 5.763 3.633 1.00 0.00 O ATOM 19258 H1 WAT 2395 69.370 5.194 4.300 1.00 0.00 H ATOM 19259 H2 WAT 2395 70.184 5.163 3.025 1.00 0.00 H TER 19261 WAT 2395 ATOM 19261 O WAT 2396 80.784 93.746 126.508 1.00 0.00 O ATOM 19262 H1 WAT 2396 80.344 94.049 127.302 1.00 0.00 H ATOM 19263 H2 WAT 2396 81.611 94.228 126.493 1.00 0.00 H TER 19265 WAT 2396 ATOM 19265 O WAT 2397 78.076 58.606 133.301 1.00 0.00 O ATOM 19266 H1 WAT 2397 77.974 57.830 133.852 1.00 0.00 H ATOM 19267 H2 WAT 2397 77.213 58.734 132.906 1.00 0.00 H TER 19269 WAT 2397 ATOM 19269 O WAT 2398 63.134 44.760 137.007 1.00 0.00 O ATOM 19270 H1 WAT 2398 62.735 43.891 137.042 1.00 0.00 H ATOM 19271 H2 WAT 2398 63.500 44.821 136.125 1.00 0.00 H TER 19273 WAT 2398 ATOM 19273 O WAT 2399 70.587 48.287 9.354 1.00 0.00 O ATOM 19274 H1 WAT 2399 70.009 47.711 9.855 1.00 0.00 H ATOM 19275 H2 WAT 2399 71.070 48.778 10.019 1.00 0.00 H TER 19277 WAT 2399 ATOM 19277 O WAT 2400 32.772 22.013 66.620 1.00 0.00 O ATOM 19278 H1 WAT 2400 33.246 21.183 66.572 1.00 0.00 H ATOM 19279 H2 WAT 2400 31.848 21.765 66.574 1.00 0.00 H TER 19281 WAT 2400 ATOM 19281 O WAT 2401 19.250 92.131 6.542 1.00 0.00 O ATOM 19282 H1 WAT 2401 19.133 92.001 7.483 1.00 0.00 H ATOM 19283 H2 WAT 2401 18.420 91.851 6.156 1.00 0.00 H TER 19285 WAT 2401 ATOM 19285 O WAT 2402 124.399 44.317 4.806 1.00 0.00 O ATOM 19286 H1 WAT 2402 123.765 44.718 5.401 1.00 0.00 H ATOM 19287 H2 WAT 2402 124.931 45.049 4.494 1.00 0.00 H TER 19289 WAT 2402 ATOM 19289 O WAT 2403 56.016 81.467 132.927 1.00 0.00 O ATOM 19290 H1 WAT 2403 55.953 80.642 133.409 1.00 0.00 H ATOM 19291 H2 WAT 2403 55.758 81.242 132.033 1.00 0.00 H TER 19293 WAT 2403 ATOM 19293 O WAT 2404 73.705 10.287 61.456 1.00 0.00 O ATOM 19294 H1 WAT 2404 73.149 10.246 62.234 1.00 0.00 H ATOM 19295 H2 WAT 2404 73.090 10.378 60.727 1.00 0.00 H TER 19297 WAT 2404 ATOM 19297 O WAT 2405 117.756 75.727 125.363 1.00 0.00 O ATOM 19298 H1 WAT 2405 118.321 75.082 125.787 1.00 0.00 H ATOM 19299 H2 WAT 2405 117.676 75.419 124.460 1.00 0.00 H TER 19301 WAT 2405 ATOM 19301 O WAT 2406 42.952 79.422 107.575 1.00 0.00 O ATOM 19302 H1 WAT 2406 43.341 78.819 108.209 1.00 0.00 H ATOM 19303 H2 WAT 2406 42.831 78.894 106.786 1.00 0.00 H TER 19305 WAT 2406 ATOM 19305 O WAT 2407 75.433 136.321 98.959 1.00 0.00 O ATOM 19306 H1 WAT 2407 74.825 136.836 99.488 1.00 0.00 H ATOM 19307 H2 WAT 2407 75.977 136.973 98.516 1.00 0.00 H TER 19309 WAT 2407 ATOM 19309 O WAT 2408 139.662 114.250 135.863 1.00 0.00 O ATOM 19310 H1 WAT 2408 140.378 114.867 136.014 1.00 0.00 H ATOM 19311 H2 WAT 2408 139.207 114.201 136.704 1.00 0.00 H TER 19313 WAT 2408 ATOM 19313 O WAT 2409 131.397 133.098 107.444 1.00 0.00 O ATOM 19314 H1 WAT 2409 130.879 132.300 107.552 1.00 0.00 H ATOM 19315 H2 WAT 2409 131.962 132.917 106.693 1.00 0.00 H TER 19317 WAT 2409 ATOM 19317 O WAT 2410 13.734 19.973 98.941 1.00 0.00 O ATOM 19318 H1 WAT 2410 13.300 20.586 98.347 1.00 0.00 H ATOM 19319 H2 WAT 2410 14.438 19.590 98.418 1.00 0.00 H TER 19321 WAT 2410 ATOM 19321 O WAT 2411 135.421 83.639 16.736 1.00 0.00 O ATOM 19322 H1 WAT 2411 135.850 84.461 16.975 1.00 0.00 H ATOM 19323 H2 WAT 2411 135.179 83.754 15.817 1.00 0.00 H TER 19325 WAT 2411 ATOM 19325 O WAT 2412 103.707 84.317 64.475 1.00 0.00 O ATOM 19326 H1 WAT 2412 103.698 85.131 63.972 1.00 0.00 H ATOM 19327 H2 WAT 2412 103.572 83.630 63.822 1.00 0.00 H TER 19329 WAT 2412 ATOM 19329 O WAT 2413 107.956 113.566 129.409 1.00 0.00 O ATOM 19330 H1 WAT 2413 107.684 113.937 128.570 1.00 0.00 H ATOM 19331 H2 WAT 2413 107.359 112.832 129.552 1.00 0.00 H TER 19333 WAT 2413 ATOM 19333 O WAT 2414 36.082 145.797 17.883 1.00 0.00 O ATOM 19334 H1 WAT 2414 35.795 144.964 18.257 1.00 0.00 H ATOM 19335 H2 WAT 2414 35.396 146.419 18.126 1.00 0.00 H TER 19337 WAT 2414 ATOM 19337 O WAT 2415 19.975 15.056 85.895 1.00 0.00 O ATOM 19338 H1 WAT 2415 20.702 14.506 86.188 1.00 0.00 H ATOM 19339 H2 WAT 2415 19.679 14.648 85.081 1.00 0.00 H TER 19341 WAT 2415 ATOM 19341 O WAT 2416 26.893 110.834 146.987 1.00 0.00 O ATOM 19342 H1 WAT 2416 25.979 110.993 146.752 1.00 0.00 H ATOM 19343 H2 WAT 2416 26.849 110.214 147.715 1.00 0.00 H TER 19345 WAT 2416 ATOM 19345 O WAT 2417 140.809 58.441 78.463 1.00 0.00 O ATOM 19346 H1 WAT 2417 140.626 59.380 78.419 1.00 0.00 H ATOM 19347 H2 WAT 2417 139.952 58.036 78.590 1.00 0.00 H TER 19349 WAT 2417 ATOM 19349 O WAT 2418 112.025 104.585 10.008 1.00 0.00 O ATOM 19350 H1 WAT 2418 111.707 104.217 9.184 1.00 0.00 H ATOM 19351 H2 WAT 2418 112.898 104.207 10.119 1.00 0.00 H TER 19353 WAT 2418 ATOM 19353 O WAT 2419 4.977 32.949 133.932 1.00 0.00 O ATOM 19354 H1 WAT 2419 4.049 32.796 133.752 1.00 0.00 H ATOM 19355 H2 WAT 2419 5.094 33.890 133.803 1.00 0.00 H TER 19357 WAT 2419 ATOM 19357 O WAT 2420 72.211 104.391 155.160 1.00 0.00 O ATOM 19358 H1 WAT 2420 72.067 103.734 154.480 1.00 0.00 H ATOM 19359 H2 WAT 2420 71.462 104.982 155.084 1.00 0.00 H TER 19361 WAT 2420 ATOM 19361 O WAT 2421 118.331 104.568 94.254 1.00 0.00 O ATOM 19362 H1 WAT 2421 117.403 104.802 94.287 1.00 0.00 H ATOM 19363 H2 WAT 2421 118.333 103.624 94.092 1.00 0.00 H TER 19365 WAT 2421 ATOM 19365 O WAT 2422 41.301 108.727 134.769 1.00 0.00 O ATOM 19366 H1 WAT 2422 41.618 108.805 133.869 1.00 0.00 H ATOM 19367 H2 WAT 2422 41.794 109.387 135.256 1.00 0.00 H TER 19369 WAT 2422 ATOM 19369 O WAT 2423 78.067 41.657 77.534 1.00 0.00 O ATOM 19370 H1 WAT 2423 77.403 41.058 77.191 1.00 0.00 H ATOM 19371 H2 WAT 2423 77.989 41.581 78.485 1.00 0.00 H TER 19373 WAT 2423 ATOM 19373 O WAT 2424 81.384 59.277 74.546 1.00 0.00 O ATOM 19374 H1 WAT 2424 81.461 59.562 75.456 1.00 0.00 H ATOM 19375 H2 WAT 2424 80.737 59.870 74.163 1.00 0.00 H TER 19377 WAT 2424 ATOM 19377 O WAT 2425 96.557 129.404 107.551 1.00 0.00 O ATOM 19378 H1 WAT 2425 97.273 129.249 108.166 1.00 0.00 H ATOM 19379 H2 WAT 2425 95.789 129.020 107.975 1.00 0.00 H TER 19381 WAT 2425 ATOM 19381 O WAT 2426 40.371 97.676 6.190 1.00 0.00 O ATOM 19382 H1 WAT 2426 40.293 98.630 6.177 1.00 0.00 H ATOM 19383 H2 WAT 2426 41.124 97.505 6.756 1.00 0.00 H TER 19385 WAT 2426 ATOM 19385 O WAT 2427 83.581 56.668 104.466 1.00 0.00 O ATOM 19386 H1 WAT 2427 84.268 56.359 105.057 1.00 0.00 H ATOM 19387 H2 WAT 2427 83.458 57.587 104.702 1.00 0.00 H TER 19389 WAT 2427 ATOM 19389 O WAT 2428 81.937 18.544 108.252 1.00 0.00 O ATOM 19390 H1 WAT 2428 81.910 17.698 108.701 1.00 0.00 H ATOM 19391 H2 WAT 2428 82.321 18.349 107.397 1.00 0.00 H TER 19393 WAT 2428 ATOM 19393 O WAT 2429 73.392 40.470 114.460 1.00 0.00 O ATOM 19394 H1 WAT 2429 73.172 40.018 113.645 1.00 0.00 H ATOM 19395 H2 WAT 2429 73.005 39.927 115.147 1.00 0.00 H TER 19397 WAT 2429 ATOM 19397 O WAT 2430 74.726 25.770 84.703 1.00 0.00 O ATOM 19398 H1 WAT 2430 74.537 25.982 85.617 1.00 0.00 H ATOM 19399 H2 WAT 2430 75.680 25.815 84.640 1.00 0.00 H TER 19401 WAT 2430 ATOM 19401 O WAT 2431 83.695 4.555 101.946 1.00 0.00 O ATOM 19402 H1 WAT 2431 83.070 3.929 102.310 1.00 0.00 H ATOM 19403 H2 WAT 2431 83.328 4.793 101.095 1.00 0.00 H TER 19405 WAT 2431 ATOM 19405 O WAT 2432 -0.055 134.532 131.254 1.00 0.00 O ATOM 19406 H1 WAT 2432 0.739 134.035 131.055 1.00 0.00 H ATOM 19407 H2 WAT 2432 -0.161 134.445 132.202 1.00 0.00 H TER 19409 WAT 2432 ATOM 19409 O WAT 2433 99.349 105.766 76.052 1.00 0.00 O ATOM 19410 H1 WAT 2433 100.012 106.427 76.250 1.00 0.00 H ATOM 19411 H2 WAT 2433 99.618 104.999 76.558 1.00 0.00 H TER 19413 WAT 2433 ATOM 19413 O WAT 2434 115.002 38.944 149.912 1.00 0.00 O ATOM 19414 H1 WAT 2434 115.291 39.546 150.597 1.00 0.00 H ATOM 19415 H2 WAT 2434 115.783 38.435 149.694 1.00 0.00 H TER 19417 WAT 2434 ATOM 19417 O WAT 2435 142.986 138.456 128.580 1.00 0.00 O ATOM 19418 H1 WAT 2435 142.305 138.439 127.909 1.00 0.00 H ATOM 19419 H2 WAT 2435 143.696 137.927 128.216 1.00 0.00 H TER 19421 WAT 2435 ATOM 19421 O WAT 2436 105.886 30.816 64.268 1.00 0.00 O ATOM 19422 H1 WAT 2436 104.940 30.932 64.182 1.00 0.00 H ATOM 19423 H2 WAT 2436 106.181 30.593 63.385 1.00 0.00 H TER 19425 WAT 2436 ATOM 19425 O WAT 2437 77.174 134.350 125.671 1.00 0.00 O ATOM 19426 H1 WAT 2437 77.023 134.952 126.399 1.00 0.00 H ATOM 19427 H2 WAT 2437 78.076 134.523 125.401 1.00 0.00 H TER 19429 WAT 2437 ATOM 19429 O WAT 2438 68.692 107.058 62.388 1.00 0.00 O ATOM 19430 H1 WAT 2438 69.245 106.877 61.628 1.00 0.00 H ATOM 19431 H2 WAT 2438 68.005 107.634 62.052 1.00 0.00 H TER 19433 WAT 2438 ATOM 19433 O WAT 2439 66.462 28.057 105.210 1.00 0.00 O ATOM 19434 H1 WAT 2439 67.115 27.420 105.500 1.00 0.00 H ATOM 19435 H2 WAT 2439 66.616 28.145 104.269 1.00 0.00 H TER 19437 WAT 2439 ATOM 19437 O WAT 2440 74.538 13.808 110.434 1.00 0.00 O ATOM 19438 H1 WAT 2440 74.790 14.445 111.103 1.00 0.00 H ATOM 19439 H2 WAT 2440 73.744 13.400 110.780 1.00 0.00 H TER 19441 WAT 2440 ATOM 19441 O WAT 2441 16.624 140.778 65.899 1.00 0.00 O ATOM 19442 H1 WAT 2441 16.435 139.860 66.090 1.00 0.00 H ATOM 19443 H2 WAT 2441 16.241 140.926 65.034 1.00 0.00 H TER 19445 WAT 2441 ATOM 19445 O WAT 2442 14.749 93.802 17.859 1.00 0.00 O ATOM 19446 H1 WAT 2442 15.169 93.803 16.999 1.00 0.00 H ATOM 19447 H2 WAT 2442 13.856 94.101 17.690 1.00 0.00 H TER 19449 WAT 2442 ATOM 19449 O WAT 2443 39.652 119.118 128.155 1.00 0.00 O ATOM 19450 H1 WAT 2443 38.834 119.037 128.644 1.00 0.00 H ATOM 19451 H2 WAT 2443 39.872 120.048 128.208 1.00 0.00 H TER 19453 WAT 2443 ATOM 19453 O WAT 2444 67.110 53.589 20.947 1.00 0.00 O ATOM 19454 H1 WAT 2444 67.272 53.683 21.886 1.00 0.00 H ATOM 19455 H2 WAT 2444 67.432 52.713 20.735 1.00 0.00 H TER 19457 WAT 2444 ATOM 19457 O WAT 2445 56.826 42.928 22.527 1.00 0.00 O ATOM 19458 H1 WAT 2445 57.388 43.702 22.492 1.00 0.00 H ATOM 19459 H2 WAT 2445 56.094 43.187 23.086 1.00 0.00 H TER 19461 WAT 2445 ATOM 19461 O WAT 2446 80.696 45.599 55.691 1.00 0.00 O ATOM 19462 H1 WAT 2446 80.499 45.515 56.624 1.00 0.00 H ATOM 19463 H2 WAT 2446 81.513 45.113 55.575 1.00 0.00 H TER 19465 WAT 2446 ATOM 19465 O WAT 2447 101.998 31.855 16.466 1.00 0.00 O ATOM 19466 H1 WAT 2447 101.208 31.347 16.282 1.00 0.00 H ATOM 19467 H2 WAT 2447 101.873 32.674 15.988 1.00 0.00 H TER 19469 WAT 2447 ATOM 19469 O WAT 2448 92.833 55.244 90.968 1.00 0.00 O ATOM 19470 H1 WAT 2448 92.890 55.555 91.871 1.00 0.00 H ATOM 19471 H2 WAT 2448 91.955 55.498 90.682 1.00 0.00 H TER 19473 WAT 2448 ATOM 19473 O WAT 2449 7.791 78.499 85.534 1.00 0.00 O ATOM 19474 H1 WAT 2449 8.252 79.076 84.926 1.00 0.00 H ATOM 19475 H2 WAT 2449 7.406 77.823 84.977 1.00 0.00 H TER 19477 WAT 2449 ATOM 19477 O WAT 2450 110.051 128.295 74.363 1.00 0.00 O ATOM 19478 H1 WAT 2450 109.151 128.215 74.681 1.00 0.00 H ATOM 19479 H2 WAT 2450 109.958 128.515 73.436 1.00 0.00 H TER 19481 WAT 2450 ATOM 19481 O WAT 2451 130.028 112.380 148.557 1.00 0.00 O ATOM 19482 H1 WAT 2451 130.657 113.074 148.360 1.00 0.00 H ATOM 19483 H2 WAT 2451 130.484 111.812 149.177 1.00 0.00 H TER 19485 WAT 2451 ATOM 19485 O WAT 2452 28.826 27.140 150.773 1.00 0.00 O ATOM 19486 H1 WAT 2452 28.154 27.191 151.452 1.00 0.00 H ATOM 19487 H2 WAT 2452 28.367 27.366 149.964 1.00 0.00 H TER 19489 WAT 2452 ATOM 19489 O WAT 2453 30.219 62.182 63.319 1.00 0.00 O ATOM 19490 H1 WAT 2453 30.156 62.958 63.876 1.00 0.00 H ATOM 19491 H2 WAT 2453 30.206 62.527 62.426 1.00 0.00 H TER 19493 WAT 2453 ATOM 19493 O WAT 2454 96.823 97.481 12.655 1.00 0.00 O ATOM 19494 H1 WAT 2454 96.488 98.308 12.310 1.00 0.00 H ATOM 19495 H2 WAT 2454 96.052 97.042 13.015 1.00 0.00 H TER 19497 WAT 2454 ATOM 19497 O WAT 2455 17.700 140.105 6.967 1.00 0.00 O ATOM 19498 H1 WAT 2455 17.666 139.409 7.624 1.00 0.00 H ATOM 19499 H2 WAT 2455 17.278 140.853 7.389 1.00 0.00 H TER 19501 WAT 2455 ATOM 19501 O WAT 2456 45.951 79.610 92.390 1.00 0.00 O ATOM 19502 H1 WAT 2456 45.989 78.883 93.010 1.00 0.00 H ATOM 19503 H2 WAT 2456 45.187 79.420 91.845 1.00 0.00 H TER 19505 WAT 2456 ATOM 19505 O WAT 2457 98.311 71.262 79.423 1.00 0.00 O ATOM 19506 H1 WAT 2457 97.492 70.965 79.025 1.00 0.00 H ATOM 19507 H2 WAT 2457 98.036 71.858 80.120 1.00 0.00 H TER 19509 WAT 2457 ATOM 19509 O WAT 2458 40.132 10.646 105.924 1.00 0.00 O ATOM 19510 H1 WAT 2458 40.502 10.379 105.082 1.00 0.00 H ATOM 19511 H2 WAT 2458 40.520 10.043 106.558 1.00 0.00 H TER 19513 WAT 2458 ATOM 19513 O WAT 2459 142.851 72.620 72.369 1.00 0.00 O ATOM 19514 H1 WAT 2459 143.352 73.413 72.559 1.00 0.00 H ATOM 19515 H2 WAT 2459 142.371 72.827 71.567 1.00 0.00 H TER 19517 WAT 2459 ATOM 19517 O WAT 2460 -0.073 125.340 124.815 1.00 0.00 O ATOM 19518 H1 WAT 2460 0.407 126.168 124.818 1.00 0.00 H ATOM 19519 H2 WAT 2460 0.451 124.761 124.261 1.00 0.00 H TER 19521 WAT 2460 ATOM 19521 O WAT 2461 80.973 0.576 142.141 1.00 0.00 O ATOM 19522 H1 WAT 2461 81.389 -0.147 142.610 1.00 0.00 H ATOM 19523 H2 WAT 2461 81.626 1.276 142.153 1.00 0.00 H TER 19525 WAT 2461 ATOM 19525 O WAT 2462 136.395 92.356 138.261 1.00 0.00 O ATOM 19526 H1 WAT 2462 136.777 91.724 137.652 1.00 0.00 H ATOM 19527 H2 WAT 2462 137.149 92.754 138.697 1.00 0.00 H TER 19529 WAT 2462 ATOM 19529 O WAT 2463 108.307 66.535 67.296 1.00 0.00 O ATOM 19530 H1 WAT 2463 107.550 66.343 66.742 1.00 0.00 H ATOM 19531 H2 WAT 2463 108.038 66.257 68.172 1.00 0.00 H TER 19533 WAT 2463 ATOM 19533 O WAT 2464 35.575 12.359 92.576 1.00 0.00 O ATOM 19534 H1 WAT 2464 36.271 12.110 91.967 1.00 0.00 H ATOM 19535 H2 WAT 2464 35.922 12.136 93.440 1.00 0.00 H TER 19537 WAT 2464 ATOM 19537 O WAT 2465 40.648 127.930 114.434 1.00 0.00 O ATOM 19538 H1 WAT 2465 41.477 128.300 114.737 1.00 0.00 H ATOM 19539 H2 WAT 2465 40.895 127.345 113.718 1.00 0.00 H TER 19541 WAT 2465 ATOM 19541 O WAT 2466 18.995 31.596 10.470 1.00 0.00 O ATOM 19542 H1 WAT 2466 18.733 31.279 11.334 1.00 0.00 H ATOM 19543 H2 WAT 2466 18.173 31.693 9.990 1.00 0.00 H TER 19545 WAT 2466 ATOM 19545 O WAT 2467 130.632 82.315 112.816 1.00 0.00 O ATOM 19546 H1 WAT 2467 130.728 82.926 112.085 1.00 0.00 H ATOM 19547 H2 WAT 2467 129.752 82.483 113.154 1.00 0.00 H TER 19549 WAT 2467 ATOM 19549 O WAT 2468 143.521 95.228 5.022 1.00 0.00 O ATOM 19550 H1 WAT 2468 143.874 94.340 5.076 1.00 0.00 H ATOM 19551 H2 WAT 2468 144.268 95.795 5.212 1.00 0.00 H TER 19553 WAT 2468 ATOM 19553 O WAT 2469 45.386 140.128 104.825 1.00 0.00 O ATOM 19554 H1 WAT 2469 44.665 140.264 104.210 1.00 0.00 H ATOM 19555 H2 WAT 2469 45.912 140.924 104.758 1.00 0.00 H TER 19557 WAT 2469 ATOM 19557 O WAT 2470 105.465 86.477 14.929 1.00 0.00 O ATOM 19558 H1 WAT 2470 104.945 85.957 15.541 1.00 0.00 H ATOM 19559 H2 WAT 2470 104.822 86.859 14.332 1.00 0.00 H TER 19561 WAT 2470 ATOM 19561 O WAT 2471 30.539 11.981 110.886 1.00 0.00 O ATOM 19562 H1 WAT 2471 29.870 12.271 111.506 1.00 0.00 H ATOM 19563 H2 WAT 2471 30.123 11.270 110.399 1.00 0.00 H TER 19565 WAT 2471 ATOM 19565 O WAT 2472 11.558 15.464 124.443 1.00 0.00 O ATOM 19566 H1 WAT 2472 10.715 15.239 124.838 1.00 0.00 H ATOM 19567 H2 WAT 2472 11.329 15.872 123.608 1.00 0.00 H TER 19569 WAT 2472 ATOM 19569 O WAT 2473 1.962 24.427 112.534 1.00 0.00 O ATOM 19570 H1 WAT 2473 1.463 23.838 113.100 1.00 0.00 H ATOM 19571 H2 WAT 2473 2.026 25.241 113.032 1.00 0.00 H TER 19573 WAT 2473 ATOM 19573 O WAT 2474 90.580 33.787 6.042 1.00 0.00 O ATOM 19574 H1 WAT 2474 89.908 33.432 5.460 1.00 0.00 H ATOM 19575 H2 WAT 2474 90.810 34.632 5.656 1.00 0.00 H TER 19577 WAT 2474 ATOM 19577 O WAT 2475 52.496 107.661 103.596 1.00 0.00 O ATOM 19578 H1 WAT 2475 52.153 107.493 104.474 1.00 0.00 H ATOM 19579 H2 WAT 2475 51.786 108.116 103.144 1.00 0.00 H TER 19581 WAT 2475 ATOM 19581 O WAT 2476 10.797 86.105 58.929 1.00 0.00 O ATOM 19582 H1 WAT 2476 11.161 86.653 59.625 1.00 0.00 H ATOM 19583 H2 WAT 2476 10.339 86.719 58.356 1.00 0.00 H TER 19585 WAT 2476 ATOM 19585 O WAT 2477 116.485 112.363 132.643 1.00 0.00 O ATOM 19586 H1 WAT 2477 115.945 111.801 132.087 1.00 0.00 H ATOM 19587 H2 WAT 2477 116.200 112.164 133.535 1.00 0.00 H TER 19589 WAT 2477 ATOM 19589 O WAT 2478 42.138 16.975 60.259 1.00 0.00 O ATOM 19590 H1 WAT 2478 42.408 16.081 60.049 1.00 0.00 H ATOM 19591 H2 WAT 2478 41.829 17.333 59.427 1.00 0.00 H TER 19593 WAT 2478 ATOM 19593 O WAT 2479 30.132 18.322 110.578 1.00 0.00 O ATOM 19594 H1 WAT 2479 29.229 18.075 110.777 1.00 0.00 H ATOM 19595 H2 WAT 2479 30.249 18.082 109.658 1.00 0.00 H TER 19597 WAT 2479 ATOM 19597 O WAT 2480 53.002 45.092 16.630 1.00 0.00 O ATOM 19598 H1 WAT 2480 53.950 45.221 16.610 1.00 0.00 H ATOM 19599 H2 WAT 2480 52.684 45.750 17.249 1.00 0.00 H TER 19601 WAT 2480 ATOM 19601 O WAT 2481 116.611 57.190 57.595 1.00 0.00 O ATOM 19602 H1 WAT 2481 117.108 56.721 56.926 1.00 0.00 H ATOM 19603 H2 WAT 2481 116.107 57.841 57.107 1.00 0.00 H TER 19605 WAT 2481 ATOM 19605 O WAT 2482 64.328 44.172 77.155 1.00 0.00 O ATOM 19606 H1 WAT 2482 64.691 44.727 76.465 1.00 0.00 H ATOM 19607 H2 WAT 2482 63.446 43.958 76.851 1.00 0.00 H TER 19609 WAT 2482 ATOM 19609 O WAT 2483 96.883 131.166 131.785 1.00 0.00 O ATOM 19610 H1 WAT 2483 97.831 131.095 131.670 1.00 0.00 H ATOM 19611 H2 WAT 2483 96.534 131.166 130.894 1.00 0.00 H TER 19613 WAT 2483 ATOM 19613 O WAT 2484 77.631 0.958 13.820 1.00 0.00 O ATOM 19614 H1 WAT 2484 77.322 1.445 13.056 1.00 0.00 H ATOM 19615 H2 WAT 2484 76.831 0.702 14.280 1.00 0.00 H TER 19617 WAT 2484 ATOM 19617 O WAT 2485 51.487 42.293 95.316 1.00 0.00 O ATOM 19618 H1 WAT 2485 51.567 43.097 94.804 1.00 0.00 H ATOM 19619 H2 WAT 2485 52.245 42.304 95.901 1.00 0.00 H TER 19621 WAT 2485 ATOM 19621 O WAT 2486 115.127 100.107 109.942 1.00 0.00 O ATOM 19622 H1 WAT 2486 115.910 100.656 109.985 1.00 0.00 H ATOM 19623 H2 WAT 2486 114.783 100.110 110.835 1.00 0.00 H TER 19625 WAT 2486 ATOM 19625 O WAT 2487 13.266 11.031 131.483 1.00 0.00 O ATOM 19626 H1 WAT 2487 12.562 11.428 131.997 1.00 0.00 H ATOM 19627 H2 WAT 2487 12.816 10.587 130.764 1.00 0.00 H TER 19629 WAT 2487 ATOM 19629 O WAT 2488 0.053 38.401 112.139 1.00 0.00 O ATOM 19630 H1 WAT 2488 -0.206 37.483 112.058 1.00 0.00 H ATOM 19631 H2 WAT 2488 0.453 38.463 113.006 1.00 0.00 H TER 19633 WAT 2488 ATOM 19633 O WAT 2489 12.951 112.417 81.655 1.00 0.00 O ATOM 19634 H1 WAT 2489 12.132 112.195 81.214 1.00 0.00 H ATOM 19635 H2 WAT 2489 13.165 111.639 82.171 1.00 0.00 H TER 19637 WAT 2489 ATOM 19637 O WAT 2490 115.451 8.611 127.516 1.00 0.00 O ATOM 19638 H1 WAT 2490 116.327 8.427 127.855 1.00 0.00 H ATOM 19639 H2 WAT 2490 115.494 8.360 126.593 1.00 0.00 H TER 19641 WAT 2490 ATOM 19641 O WAT 2491 145.906 111.570 6.040 1.00 0.00 O ATOM 19642 H1 WAT 2491 145.503 110.703 6.017 1.00 0.00 H ATOM 19643 H2 WAT 2491 145.178 112.169 6.209 1.00 0.00 H TER 19645 WAT 2491 ATOM 19645 O WAT 2492 9.552 45.430 134.932 1.00 0.00 O ATOM 19646 H1 WAT 2492 9.975 45.272 134.089 1.00 0.00 H ATOM 19647 H2 WAT 2492 8.969 46.173 134.773 1.00 0.00 H TER 19649 WAT 2492 ATOM 19649 O WAT 2493 3.572 99.708 127.068 1.00 0.00 O ATOM 19650 H1 WAT 2493 4.336 100.221 127.332 1.00 0.00 H ATOM 19651 H2 WAT 2493 3.616 99.688 126.112 1.00 0.00 H TER 19653 WAT 2493 ATOM 19653 O WAT 2494 45.052 37.025 82.221 1.00 0.00 O ATOM 19654 H1 WAT 2494 45.993 36.891 82.328 1.00 0.00 H ATOM 19655 H2 WAT 2494 44.840 37.735 82.828 1.00 0.00 H TER 19657 WAT 2494 ATOM 19657 O WAT 2495 139.373 18.442 157.366 1.00 0.00 O ATOM 19658 H1 WAT 2495 138.920 18.042 156.624 1.00 0.00 H ATOM 19659 H2 WAT 2495 138.727 18.437 158.072 1.00 0.00 H TER 19661 WAT 2495 ATOM 19661 O WAT 2496 122.981 81.387 131.047 1.00 0.00 O ATOM 19662 H1 WAT 2496 123.744 80.942 130.678 1.00 0.00 H ATOM 19663 H2 WAT 2496 122.950 81.095 131.958 1.00 0.00 H TER 19665 WAT 2496 ATOM 19665 O WAT 2497 121.237 130.796 1.207 1.00 0.00 O ATOM 19666 H1 WAT 2497 121.050 131.421 1.907 1.00 0.00 H ATOM 19667 H2 WAT 2497 120.623 131.028 0.509 1.00 0.00 H TER 19669 WAT 2497 ATOM 19669 O WAT 2498 103.902 125.846 152.749 1.00 0.00 O ATOM 19670 H1 WAT 2498 103.122 125.494 152.320 1.00 0.00 H ATOM 19671 H2 WAT 2498 104.575 125.837 152.068 1.00 0.00 H TER 19673 WAT 2498 ATOM 19673 O WAT 2499 93.570 116.912 7.128 1.00 0.00 O ATOM 19674 H1 WAT 2499 92.947 116.317 7.546 1.00 0.00 H ATOM 19675 H2 WAT 2499 93.722 116.531 6.264 1.00 0.00 H TER 19677 WAT 2499 ATOM 19677 O WAT 2500 67.574 111.025 3.931 1.00 0.00 O ATOM 19678 H1 WAT 2500 67.214 111.744 3.411 1.00 0.00 H ATOM 19679 H2 WAT 2500 67.655 110.299 3.313 1.00 0.00 H TER 19681 WAT 2500 ATOM 19681 O WAT 2501 108.153 8.365 156.439 1.00 0.00 O ATOM 19682 H1 WAT 2501 108.320 9.307 156.443 1.00 0.00 H ATOM 19683 H2 WAT 2501 107.564 8.229 155.696 1.00 0.00 H TER 19685 WAT 2501 ATOM 19685 O WAT 2502 114.690 102.823 86.596 1.00 0.00 O ATOM 19686 H1 WAT 2502 115.523 102.939 87.053 1.00 0.00 H ATOM 19687 H2 WAT 2502 114.316 103.703 86.552 1.00 0.00 H TER 19689 WAT 2502 ATOM 19689 O WAT 2503 110.909 46.092 101.192 1.00 0.00 O ATOM 19690 H1 WAT 2503 111.324 45.357 100.740 1.00 0.00 H ATOM 19691 H2 WAT 2503 110.004 45.812 101.325 1.00 0.00 H TER 19693 WAT 2503 ATOM 19693 O WAT 2504 67.090 45.569 115.335 1.00 0.00 O ATOM 19694 H1 WAT 2504 66.341 45.134 115.743 1.00 0.00 H ATOM 19695 H2 WAT 2504 67.838 45.314 115.875 1.00 0.00 H TER 19697 WAT 2504 ATOM 19697 O WAT 2505 20.387 76.673 8.345 1.00 0.00 O ATOM 19698 H1 WAT 2505 20.508 75.803 8.724 1.00 0.00 H ATOM 19699 H2 WAT 2505 19.442 76.746 8.211 1.00 0.00 H TER 19701 WAT 2505 ATOM 19701 O WAT 2506 116.294 111.159 23.610 1.00 0.00 O ATOM 19702 H1 WAT 2506 117.093 110.633 23.571 1.00 0.00 H ATOM 19703 H2 WAT 2506 115.644 110.645 23.131 1.00 0.00 H TER 19705 WAT 2506 ATOM 19705 O WAT 2507 77.132 6.268 96.469 1.00 0.00 O ATOM 19706 H1 WAT 2507 77.189 5.319 96.581 1.00 0.00 H ATOM 19707 H2 WAT 2507 76.231 6.484 96.709 1.00 0.00 H TER 19709 WAT 2507 ATOM 19709 O WAT 2508 20.894 133.608 140.151 1.00 0.00 O ATOM 19710 H1 WAT 2508 21.422 134.398 140.034 1.00 0.00 H ATOM 19711 H2 WAT 2508 20.139 133.737 139.577 1.00 0.00 H TER 19713 WAT 2508 ATOM 19713 O WAT 2509 140.605 84.569 12.530 1.00 0.00 O ATOM 19714 H1 WAT 2509 140.488 84.861 11.626 1.00 0.00 H ATOM 19715 H2 WAT 2509 141.427 84.078 12.519 1.00 0.00 H TER 19717 WAT 2509 ATOM 19717 O WAT 2510 36.740 81.087 127.384 1.00 0.00 O ATOM 19718 H1 WAT 2510 36.809 80.474 126.651 1.00 0.00 H ATOM 19719 H2 WAT 2510 36.127 80.668 127.988 1.00 0.00 H TER 19721 WAT 2510 ATOM 19721 O WAT 2511 79.816 20.911 55.243 1.00 0.00 O ATOM 19722 H1 WAT 2511 79.022 20.464 55.536 1.00 0.00 H ATOM 19723 H2 WAT 2511 79.530 21.803 55.047 1.00 0.00 H TER 19725 WAT 2511 ATOM 19725 O WAT 2512 29.678 3.658 137.024 1.00 0.00 O ATOM 19726 H1 WAT 2512 29.880 3.252 137.867 1.00 0.00 H ATOM 19727 H2 WAT 2512 29.417 2.928 136.462 1.00 0.00 H TER 19729 WAT 2512 ATOM 19729 O WAT 2513 47.543 84.831 58.192 1.00 0.00 O ATOM 19730 H1 WAT 2513 47.205 85.653 57.837 1.00 0.00 H ATOM 19731 H2 WAT 2513 47.011 84.154 57.774 1.00 0.00 H TER 19733 WAT 2513 ATOM 19733 O WAT 2514 122.189 29.760 24.451 1.00 0.00 O ATOM 19734 H1 WAT 2514 121.741 29.031 24.023 1.00 0.00 H ATOM 19735 H2 WAT 2514 122.749 29.345 25.108 1.00 0.00 H TER 19737 WAT 2514 ATOM 19737 O WAT 2515 57.947 131.330 102.274 1.00 0.00 O ATOM 19738 H1 WAT 2515 58.180 131.377 101.347 1.00 0.00 H ATOM 19739 H2 WAT 2515 58.646 130.811 102.671 1.00 0.00 H TER 19741 WAT 2515 ATOM 19741 O WAT 2516 12.426 61.914 141.892 1.00 0.00 O ATOM 19742 H1 WAT 2516 12.273 62.414 141.091 1.00 0.00 H ATOM 19743 H2 WAT 2516 12.195 61.014 141.661 1.00 0.00 H TER 19745 WAT 2516 ATOM 19745 O WAT 2517 98.644 139.055 103.049 1.00 0.00 O ATOM 19746 H1 WAT 2517 99.389 139.552 102.712 1.00 0.00 H ATOM 19747 H2 WAT 2517 98.015 139.722 103.324 1.00 0.00 H TER 19749 WAT 2517 ATOM 19749 O WAT 2518 68.785 56.749 116.680 1.00 0.00 O ATOM 19750 H1 WAT 2518 68.450 56.359 115.873 1.00 0.00 H ATOM 19751 H2 WAT 2518 69.163 57.584 116.402 1.00 0.00 H TER 19753 WAT 2518 ATOM 19753 O WAT 2519 20.029 117.574 77.833 1.00 0.00 O ATOM 19754 H1 WAT 2519 20.368 118.451 77.653 1.00 0.00 H ATOM 19755 H2 WAT 2519 19.162 117.564 77.429 1.00 0.00 H TER 19757 WAT 2519 ATOM 19757 O WAT 2520 74.457 144.857 14.123 1.00 0.00 O ATOM 19758 H1 WAT 2520 75.009 145.253 14.798 1.00 0.00 H ATOM 19759 H2 WAT 2520 74.430 143.928 14.350 1.00 0.00 H TER 19761 WAT 2520 ATOM 19761 O WAT 2521 102.653 47.871 154.259 1.00 0.00 O ATOM 19762 H1 WAT 2521 103.229 47.804 155.020 1.00 0.00 H ATOM 19763 H2 WAT 2521 102.763 48.771 153.953 1.00 0.00 H TER 19765 WAT 2521 ATOM 19765 O WAT 2522 112.186 93.762 112.987 1.00 0.00 O ATOM 19766 H1 WAT 2522 112.594 93.367 113.757 1.00 0.00 H ATOM 19767 H2 WAT 2522 112.873 93.753 112.321 1.00 0.00 H TER 19769 WAT 2522 ATOM 19769 O WAT 2523 54.668 114.446 136.947 1.00 0.00 O ATOM 19770 H1 WAT 2523 54.166 113.652 137.130 1.00 0.00 H ATOM 19771 H2 WAT 2523 54.986 114.328 136.052 1.00 0.00 H TER 19773 WAT 2523 ATOM 19773 O WAT 2524 2.131 40.870 144.172 1.00 0.00 O ATOM 19774 H1 WAT 2524 2.643 41.294 143.483 1.00 0.00 H ATOM 19775 H2 WAT 2524 1.222 40.964 143.888 1.00 0.00 H TER 19777 WAT 2524 ATOM 19777 O WAT 2525 22.383 62.856 2.559 1.00 0.00 O ATOM 19778 H1 WAT 2525 23.270 62.584 2.791 1.00 0.00 H ATOM 19779 H2 WAT 2525 22.403 62.949 1.606 1.00 0.00 H TER 19781 WAT 2525 ATOM 19781 O WAT 2526 102.709 6.359 113.328 1.00 0.00 O ATOM 19782 H1 WAT 2526 103.332 6.166 112.628 1.00 0.00 H ATOM 19783 H2 WAT 2526 101.862 6.421 112.885 1.00 0.00 H TER 19785 WAT 2526 ATOM 19785 O WAT 2527 98.791 32.697 52.730 1.00 0.00 O ATOM 19786 H1 WAT 2527 97.871 32.600 52.482 1.00 0.00 H ATOM 19787 H2 WAT 2527 98.815 32.463 53.658 1.00 0.00 H TER 19789 WAT 2527 ATOM 19789 O WAT 2528 126.566 84.382 76.219 1.00 0.00 O ATOM 19790 H1 WAT 2528 126.167 84.530 75.362 1.00 0.00 H ATOM 19791 H2 WAT 2528 125.973 84.809 76.837 1.00 0.00 H TER 19793 WAT 2528 ATOM 19793 O WAT 2529 45.501 131.234 86.178 1.00 0.00 O ATOM 19794 H1 WAT 2529 45.755 130.472 86.699 1.00 0.00 H ATOM 19795 H2 WAT 2529 44.741 130.939 85.676 1.00 0.00 H TER 19797 WAT 2529 ATOM 19797 O WAT 2530 108.601 62.817 4.067 1.00 0.00 O ATOM 19798 H1 WAT 2530 109.242 63.504 4.250 1.00 0.00 H ATOM 19799 H2 WAT 2530 108.258 62.574 4.927 1.00 0.00 H TER 19801 WAT 2530 ATOM 19801 O WAT 2531 24.005 95.762 29.835 1.00 0.00 O ATOM 19802 H1 WAT 2531 23.359 95.059 29.762 1.00 0.00 H ATOM 19803 H2 WAT 2531 23.866 96.296 29.052 1.00 0.00 H TER 19805 WAT 2531 ATOM 19805 O WAT 2532 3.216 103.547 99.441 1.00 0.00 O ATOM 19806 H1 WAT 2532 3.334 102.824 100.056 1.00 0.00 H ATOM 19807 H2 WAT 2532 2.409 103.976 99.728 1.00 0.00 H TER 19809 WAT 2532 ATOM 19809 O WAT 2533 130.232 1.403 88.629 1.00 0.00 O ATOM 19810 H1 WAT 2533 130.667 1.480 89.478 1.00 0.00 H ATOM 19811 H2 WAT 2533 130.808 1.867 88.022 1.00 0.00 H TER 19813 WAT 2533 ATOM 19813 O WAT 2534 91.786 132.654 77.799 1.00 0.00 O ATOM 19814 H1 WAT 2534 91.014 132.722 78.360 1.00 0.00 H ATOM 19815 H2 WAT 2534 92.113 133.551 77.730 1.00 0.00 H TER 19817 WAT 2534 ATOM 19817 O WAT 2535 140.246 70.403 153.107 1.00 0.00 O ATOM 19818 H1 WAT 2535 140.192 69.557 153.551 1.00 0.00 H ATOM 19819 H2 WAT 2535 141.151 70.453 152.797 1.00 0.00 H TER 19821 WAT 2535 ATOM 19821 O WAT 2536 142.891 17.674 67.082 1.00 0.00 O ATOM 19822 H1 WAT 2536 143.158 16.909 67.593 1.00 0.00 H ATOM 19823 H2 WAT 2536 142.511 18.271 67.726 1.00 0.00 H TER 19825 WAT 2536 ATOM 19825 O WAT 2537 139.334 126.702 130.814 1.00 0.00 O ATOM 19826 H1 WAT 2537 139.826 127.454 130.484 1.00 0.00 H ATOM 19827 H2 WAT 2537 139.955 126.238 131.376 1.00 0.00 H TER 19829 WAT 2537 ATOM 19829 O WAT 2538 78.576 83.608 26.610 1.00 0.00 O ATOM 19830 H1 WAT 2538 78.387 83.846 27.517 1.00 0.00 H ATOM 19831 H2 WAT 2538 77.719 83.585 26.185 1.00 0.00 H TER 19833 WAT 2538 ATOM 19833 O WAT 2539 41.126 106.085 91.295 1.00 0.00 O ATOM 19834 H1 WAT 2539 40.228 106.160 91.618 1.00 0.00 H ATOM 19835 H2 WAT 2539 41.138 105.261 90.809 1.00 0.00 H TER 19837 WAT 2539 ATOM 19837 O WAT 2540 110.445 6.431 102.458 1.00 0.00 O ATOM 19838 H1 WAT 2540 110.648 7.355 102.606 1.00 0.00 H ATOM 19839 H2 WAT 2540 111.156 6.116 101.899 1.00 0.00 H TER 19841 WAT 2540 ATOM 19841 O WAT 2541 31.156 116.511 126.361 1.00 0.00 O ATOM 19842 H1 WAT 2541 30.826 117.290 126.809 1.00 0.00 H ATOM 19843 H2 WAT 2541 31.822 116.844 125.759 1.00 0.00 H TER 19845 WAT 2541 ATOM 19845 O WAT 2542 91.981 89.441 89.383 1.00 0.00 O ATOM 19846 H1 WAT 2542 91.810 89.328 88.448 1.00 0.00 H ATOM 19847 H2 WAT 2542 91.797 90.365 89.551 1.00 0.00 H TER 19849 WAT 2542 ATOM 19849 O WAT 2543 120.135 135.392 4.763 1.00 0.00 O ATOM 19850 H1 WAT 2543 120.151 134.667 5.389 1.00 0.00 H ATOM 19851 H2 WAT 2543 119.241 135.394 4.422 1.00 0.00 H TER 19853 WAT 2543 ATOM 19853 O WAT 2544 126.242 103.030 154.633 1.00 0.00 O ATOM 19854 H1 WAT 2544 126.451 102.119 154.836 1.00 0.00 H ATOM 19855 H2 WAT 2544 126.000 103.019 153.707 1.00 0.00 H TER 19857 WAT 2544 ATOM 19857 O WAT 2545 45.387 105.716 96.022 1.00 0.00 O ATOM 19858 H1 WAT 2545 44.992 106.570 96.199 1.00 0.00 H ATOM 19859 H2 WAT 2545 45.961 105.868 95.272 1.00 0.00 H TER 19861 WAT 2545 ATOM 19861 O WAT 2546 23.337 119.711 21.885 1.00 0.00 O ATOM 19862 H1 WAT 2546 24.195 119.975 21.552 1.00 0.00 H ATOM 19863 H2 WAT 2546 23.182 118.852 21.491 1.00 0.00 H TER 19865 WAT 2546 ATOM 19865 O WAT 2547 144.051 145.871 68.503 1.00 0.00 O ATOM 19866 H1 WAT 2547 144.832 145.318 68.531 1.00 0.00 H ATOM 19867 H2 WAT 2547 143.371 145.308 68.134 1.00 0.00 H TER 19869 WAT 2547 ATOM 19869 O WAT 2548 142.465 28.357 156.548 1.00 0.00 O ATOM 19870 H1 WAT 2548 143.294 28.306 157.024 1.00 0.00 H ATOM 19871 H2 WAT 2548 141.795 28.327 157.231 1.00 0.00 H TER 19873 WAT 2548 ATOM 19873 O WAT 2549 114.082 18.795 144.752 1.00 0.00 O ATOM 19874 H1 WAT 2549 113.196 19.009 144.460 1.00 0.00 H ATOM 19875 H2 WAT 2549 114.424 19.617 145.102 1.00 0.00 H TER 19877 WAT 2549 ATOM 19877 O WAT 2550 129.371 135.077 90.908 1.00 0.00 O ATOM 19878 H1 WAT 2550 129.189 134.659 91.750 1.00 0.00 H ATOM 19879 H2 WAT 2550 129.437 134.350 90.289 1.00 0.00 H TER 19881 WAT 2550 ATOM 19881 O WAT 2551 78.148 76.803 146.168 1.00 0.00 O ATOM 19882 H1 WAT 2551 78.277 77.334 146.954 1.00 0.00 H ATOM 19883 H2 WAT 2551 79.033 76.625 145.852 1.00 0.00 H TER 19885 WAT 2551 ATOM 19885 O WAT 2552 7.433 125.555 70.549 1.00 0.00 O ATOM 19886 H1 WAT 2552 7.850 126.393 70.753 1.00 0.00 H ATOM 19887 H2 WAT 2552 7.154 125.642 69.638 1.00 0.00 H TER 19889 WAT 2552 ATOM 19889 O WAT 2553 20.629 109.817 113.644 1.00 0.00 O ATOM 19890 H1 WAT 2553 19.728 109.890 113.330 1.00 0.00 H ATOM 19891 H2 WAT 2553 21.157 110.216 112.952 1.00 0.00 H TER 19893 WAT 2553 ATOM 19893 O WAT 2554 133.984 2.710 101.318 1.00 0.00 O ATOM 19894 H1 WAT 2554 133.127 2.286 101.357 1.00 0.00 H ATOM 19895 H2 WAT 2554 133.896 3.482 101.877 1.00 0.00 H TER 19897 WAT 2554 ATOM 19897 O WAT 2555 12.112 141.927 118.259 1.00 0.00 O ATOM 19898 H1 WAT 2555 11.669 141.169 117.879 1.00 0.00 H ATOM 19899 H2 WAT 2555 11.755 142.677 117.783 1.00 0.00 H TER 19901 WAT 2555 ATOM 19901 O WAT 2556 46.226 132.630 129.093 1.00 0.00 O ATOM 19902 H1 WAT 2556 46.889 132.133 128.613 1.00 0.00 H ATOM 19903 H2 WAT 2556 45.391 132.290 128.770 1.00 0.00 H TER 19905 WAT 2556 ATOM 19905 O WAT 2557 39.760 123.546 117.420 1.00 0.00 O ATOM 19906 H1 WAT 2557 39.093 123.785 118.063 1.00 0.00 H ATOM 19907 H2 WAT 2557 39.371 123.773 116.576 1.00 0.00 H TER 19909 WAT 2557 ATOM 19909 O WAT 2558 94.022 78.698 137.754 1.00 0.00 O ATOM 19910 H1 WAT 2558 93.559 78.202 138.430 1.00 0.00 H ATOM 19911 H2 WAT 2558 93.452 79.446 137.574 1.00 0.00 H TER 19913 WAT 2558 ATOM 19913 O WAT 2559 45.426 70.133 20.404 1.00 0.00 O ATOM 19914 H1 WAT 2559 44.904 69.619 21.020 1.00 0.00 H ATOM 19915 H2 WAT 2559 46.027 69.499 20.012 1.00 0.00 H TER 19917 WAT 2559 ATOM 19917 O WAT 2560 139.025 27.115 90.745 1.00 0.00 O ATOM 19918 H1 WAT 2560 138.735 27.038 91.654 1.00 0.00 H ATOM 19919 H2 WAT 2560 139.624 26.379 90.622 1.00 0.00 H TER 19921 WAT 2560 ATOM 19921 O WAT 2561 141.967 45.912 100.743 1.00 0.00 O ATOM 19922 H1 WAT 2561 141.675 45.431 99.969 1.00 0.00 H ATOM 19923 H2 WAT 2561 142.771 45.467 101.012 1.00 0.00 H TER 19925 WAT 2561 ATOM 19925 O WAT 2562 11.357 114.028 72.819 1.00 0.00 O ATOM 19926 H1 WAT 2562 11.646 113.987 71.908 1.00 0.00 H ATOM 19927 H2 WAT 2562 10.769 113.278 72.918 1.00 0.00 H TER 19929 WAT 2562 ATOM 19929 O WAT 2563 19.576 59.480 153.137 1.00 0.00 O ATOM 19930 H1 WAT 2563 19.574 58.724 152.550 1.00 0.00 H ATOM 19931 H2 WAT 2563 20.496 59.598 153.373 1.00 0.00 H TER 19933 WAT 2563 ATOM 19933 O WAT 2564 28.671 139.700 12.756 1.00 0.00 O ATOM 19934 H1 WAT 2564 28.093 140.021 13.448 1.00 0.00 H ATOM 19935 H2 WAT 2564 29.465 139.425 13.215 1.00 0.00 H TER 19937 WAT 2564 ATOM 19937 O WAT 2565 136.178 109.653 134.086 1.00 0.00 O ATOM 19938 H1 WAT 2565 135.393 109.899 134.575 1.00 0.00 H ATOM 19939 H2 WAT 2565 135.851 109.119 133.362 1.00 0.00 H TER 19941 WAT 2565 ATOM 19941 O WAT 2566 13.060 17.996 17.722 1.00 0.00 O ATOM 19942 H1 WAT 2566 12.125 18.163 17.605 1.00 0.00 H ATOM 19943 H2 WAT 2566 13.315 17.504 16.942 1.00 0.00 H TER 19945 WAT 2566 ATOM 19945 O WAT 2567 53.178 89.242 8.153 1.00 0.00 O ATOM 19946 H1 WAT 2567 53.979 89.712 7.920 1.00 0.00 H ATOM 19947 H2 WAT 2567 53.006 88.676 7.402 1.00 0.00 H TER 19949 WAT 2567 ATOM 19949 O WAT 2568 102.233 84.800 117.709 1.00 0.00 O ATOM 19950 H1 WAT 2568 102.495 85.011 118.605 1.00 0.00 H ATOM 19951 H2 WAT 2568 101.463 84.240 117.811 1.00 0.00 H TER 19953 WAT 2568 ATOM 19953 O WAT 2569 142.952 79.490 93.405 1.00 0.00 O ATOM 19954 H1 WAT 2569 143.824 79.778 93.135 1.00 0.00 H ATOM 19955 H2 WAT 2569 142.433 80.294 93.435 1.00 0.00 H TER 19957 WAT 2569 ATOM 19957 O WAT 2570 48.928 19.660 17.213 1.00 0.00 O ATOM 19958 H1 WAT 2570 49.509 19.524 17.961 1.00 0.00 H ATOM 19959 H2 WAT 2570 49.518 19.773 16.468 1.00 0.00 H TER 19961 WAT 2570 ATOM 19961 O WAT 2571 43.770 124.919 0.247 1.00 0.00 O ATOM 19962 H1 WAT 2571 44.239 124.085 0.208 1.00 0.00 H ATOM 19963 H2 WAT 2571 42.872 124.678 0.477 1.00 0.00 H TER 19965 WAT 2571 ATOM 19965 O WAT 2572 132.406 55.028 18.964 1.00 0.00 O ATOM 19966 H1 WAT 2572 131.898 54.751 19.727 1.00 0.00 H ATOM 19967 H2 WAT 2572 132.910 55.781 19.273 1.00 0.00 H TER 19969 WAT 2572 ATOM 19969 O WAT 2573 96.636 129.283 10.115 1.00 0.00 O ATOM 19970 H1 WAT 2573 97.240 129.556 9.425 1.00 0.00 H ATOM 19971 H2 WAT 2573 96.934 129.751 10.894 1.00 0.00 H TER 19973 WAT 2573 ATOM 19973 O WAT 2574 21.610 84.468 107.233 1.00 0.00 O ATOM 19974 H1 WAT 2574 20.889 84.885 106.762 1.00 0.00 H ATOM 19975 H2 WAT 2574 22.183 84.129 106.545 1.00 0.00 H TER 19977 WAT 2574 ATOM 19977 O WAT 2575 136.620 25.314 22.492 1.00 0.00 O ATOM 19978 H1 WAT 2575 136.641 24.622 21.831 1.00 0.00 H ATOM 19979 H2 WAT 2575 135.741 25.687 22.420 1.00 0.00 H TER 19981 WAT 2575 ATOM 19981 O WAT 2576 36.618 133.830 9.288 1.00 0.00 O ATOM 19982 H1 WAT 2576 37.285 133.173 9.089 1.00 0.00 H ATOM 19983 H2 WAT 2576 36.757 134.518 8.638 1.00 0.00 H TER 19985 WAT 2576 ATOM 19985 O WAT 2577 102.672 58.065 145.921 1.00 0.00 O ATOM 19986 H1 WAT 2577 103.021 57.948 146.804 1.00 0.00 H ATOM 19987 H2 WAT 2577 102.806 57.218 145.496 1.00 0.00 H TER 19989 WAT 2577 ATOM 19989 O WAT 2578 8.921 134.881 8.220 1.00 0.00 O ATOM 19990 H1 WAT 2578 8.361 135.349 7.601 1.00 0.00 H ATOM 19991 H2 WAT 2578 8.604 135.152 9.082 1.00 0.00 H TER 19993 WAT 2578 ATOM 19993 O WAT 2579 113.492 18.580 85.879 1.00 0.00 O ATOM 19994 H1 WAT 2579 114.269 18.704 85.335 1.00 0.00 H ATOM 19995 H2 WAT 2579 113.390 17.630 85.939 1.00 0.00 H TER 19997 WAT 2579 ATOM 19997 O WAT 2580 12.754 54.946 121.973 1.00 0.00 O ATOM 19998 H1 WAT 2580 12.422 55.131 122.852 1.00 0.00 H ATOM 19999 H2 WAT 2580 12.032 55.181 121.390 1.00 0.00 H TER 20001 WAT 2580 ATOM 20001 O WAT 2581 5.189 75.829 106.438 1.00 0.00 O ATOM 20002 H1 WAT 2581 4.377 76.019 106.909 1.00 0.00 H ATOM 20003 H2 WAT 2581 5.147 76.380 105.656 1.00 0.00 H TER 20005 WAT 2581 ATOM 20005 O WAT 2582 1.583 66.189 61.433 1.00 0.00 O ATOM 20006 H1 WAT 2582 0.683 66.361 61.709 1.00 0.00 H ATOM 20007 H2 WAT 2582 1.644 65.235 61.396 1.00 0.00 H TER 20009 WAT 2582 ATOM 20009 O WAT 2583 15.203 106.052 82.978 1.00 0.00 O ATOM 20010 H1 WAT 2583 14.470 106.620 82.740 1.00 0.00 H ATOM 20011 H2 WAT 2583 14.819 105.396 83.559 1.00 0.00 H TER 20013 WAT 2583 ATOM 20013 O WAT 2584 117.353 45.350 99.467 1.00 0.00 O ATOM 20014 H1 WAT 2584 117.389 44.479 99.862 1.00 0.00 H ATOM 20015 H2 WAT 2584 117.774 45.922 100.108 1.00 0.00 H TER 20017 WAT 2584 ATOM 20017 O WAT 2585 90.707 124.086 112.035 1.00 0.00 O ATOM 20018 H1 WAT 2585 90.503 124.943 112.410 1.00 0.00 H ATOM 20019 H2 WAT 2585 91.061 124.282 111.168 1.00 0.00 H TER 20021 WAT 2585 ATOM 20021 O WAT 2586 54.703 46.154 90.684 1.00 0.00 O ATOM 20022 H1 WAT 2586 54.350 46.961 91.059 1.00 0.00 H ATOM 20023 H2 WAT 2586 55.251 46.449 89.957 1.00 0.00 H TER 20025 WAT 2586 ATOM 20025 O WAT 2587 139.261 96.934 120.090 1.00 0.00 O ATOM 20026 H1 WAT 2587 138.389 96.612 120.317 1.00 0.00 H ATOM 20027 H2 WAT 2587 139.861 96.332 120.530 1.00 0.00 H TER 20029 WAT 2587 ATOM 20029 O WAT 2588 55.444 52.569 123.961 1.00 0.00 O ATOM 20030 H1 WAT 2588 55.593 51.878 124.607 1.00 0.00 H ATOM 20031 H2 WAT 2588 54.997 53.261 124.449 1.00 0.00 H TER 20033 WAT 2588 ATOM 20033 O WAT 2589 78.281 65.739 121.531 1.00 0.00 O ATOM 20034 H1 WAT 2589 77.577 65.505 122.135 1.00 0.00 H ATOM 20035 H2 WAT 2589 79.084 65.512 122.000 1.00 0.00 H TER 20037 WAT 2589 ATOM 20037 O WAT 2590 56.084 116.949 64.628 1.00 0.00 O ATOM 20038 H1 WAT 2590 55.536 117.092 63.856 1.00 0.00 H ATOM 20039 H2 WAT 2590 55.771 116.121 64.993 1.00 0.00 H TER 20041 WAT 2590 ATOM 20041 O WAT 2591 25.048 130.640 84.898 1.00 0.00 O ATOM 20042 H1 WAT 2591 24.320 130.473 84.300 1.00 0.00 H ATOM 20043 H2 WAT 2591 25.785 130.160 84.518 1.00 0.00 H TER 20045 WAT 2591 ATOM 20045 O WAT 2592 104.003 38.287 21.344 1.00 0.00 O ATOM 20046 H1 WAT 2592 104.580 39.047 21.279 1.00 0.00 H ATOM 20047 H2 WAT 2592 104.535 37.617 21.772 1.00 0.00 H TER 20049 WAT 2592 ATOM 20049 O WAT 2593 66.686 54.020 86.003 1.00 0.00 O ATOM 20050 H1 WAT 2593 66.746 54.215 85.068 1.00 0.00 H ATOM 20051 H2 WAT 2593 67.325 54.604 86.411 1.00 0.00 H TER 20053 WAT 2593 ATOM 20053 O WAT 2594 10.983 67.471 61.310 1.00 0.00 O ATOM 20054 H1 WAT 2594 11.748 66.976 61.603 1.00 0.00 H ATOM 20055 H2 WAT 2594 11.048 67.469 60.355 1.00 0.00 H TER 20057 WAT 2594 ATOM 20057 O WAT 2595 68.069 77.073 116.731 1.00 0.00 O ATOM 20058 H1 WAT 2595 67.504 77.651 116.219 1.00 0.00 H ATOM 20059 H2 WAT 2595 68.033 76.234 116.272 1.00 0.00 H TER 20061 WAT 2595 ATOM 20061 O WAT 2596 70.635 44.267 93.724 1.00 0.00 O ATOM 20062 H1 WAT 2596 70.018 44.976 93.903 1.00 0.00 H ATOM 20063 H2 WAT 2596 70.384 43.571 94.332 1.00 0.00 H TER 20065 WAT 2596 ATOM 20065 O WAT 2597 21.119 79.909 139.270 1.00 0.00 O ATOM 20066 H1 WAT 2597 20.378 80.247 139.773 1.00 0.00 H ATOM 20067 H2 WAT 2597 21.359 79.096 139.714 1.00 0.00 H TER 20069 WAT 2597 ATOM 20069 O WAT 2598 61.413 68.601 113.607 1.00 0.00 O ATOM 20070 H1 WAT 2598 61.791 68.763 112.743 1.00 0.00 H ATOM 20071 H2 WAT 2598 60.997 69.429 113.845 1.00 0.00 H TER 20073 WAT 2598 ATOM 20073 O WAT 2599 136.507 122.473 139.934 1.00 0.00 O ATOM 20074 H1 WAT 2599 136.284 123.275 139.461 1.00 0.00 H ATOM 20075 H2 WAT 2599 135.828 122.393 140.603 1.00 0.00 H TER 20077 WAT 2599 ATOM 20077 O WAT 2600 25.950 94.136 106.027 1.00 0.00 O ATOM 20078 H1 WAT 2600 25.092 93.763 105.825 1.00 0.00 H ATOM 20079 H2 WAT 2600 25.833 94.563 106.876 1.00 0.00 H TER 20081 WAT 2600 ATOM 20081 O WAT 2601 54.906 114.896 66.312 1.00 0.00 O ATOM 20082 H1 WAT 2601 55.514 115.141 67.010 1.00 0.00 H ATOM 20083 H2 WAT 2601 54.864 113.941 66.355 1.00 0.00 H TER 20085 WAT 2601 ATOM 20085 O WAT 2602 80.089 134.985 78.364 1.00 0.00 O ATOM 20086 H1 WAT 2602 80.978 135.295 78.188 1.00 0.00 H ATOM 20087 H2 WAT 2602 79.543 135.448 77.730 1.00 0.00 H TER 20089 WAT 2602 ATOM 20089 O WAT 2603 35.198 44.182 88.486 1.00 0.00 O ATOM 20090 H1 WAT 2603 36.042 43.905 88.130 1.00 0.00 H ATOM 20091 H2 WAT 2603 35.420 44.650 89.291 1.00 0.00 H TER 20093 WAT 2603 ATOM 20093 O WAT 2604 101.824 60.038 85.264 1.00 0.00 O ATOM 20094 H1 WAT 2604 102.489 60.206 85.932 1.00 0.00 H ATOM 20095 H2 WAT 2604 101.324 59.297 85.605 1.00 0.00 H TER 20097 WAT 2604 ATOM 20097 O WAT 2605 93.478 73.101 75.778 1.00 0.00 O ATOM 20098 H1 WAT 2605 92.870 73.840 75.779 1.00 0.00 H ATOM 20099 H2 WAT 2605 93.717 72.990 74.857 1.00 0.00 H TER 20101 WAT 2605 ATOM 20101 O WAT 2606 10.843 -0.005 128.837 1.00 0.00 O ATOM 20102 H1 WAT 2606 11.483 -0.307 129.482 1.00 0.00 H ATOM 20103 H2 WAT 2606 10.771 0.937 128.993 1.00 0.00 H TER 20105 WAT 2606 ATOM 20105 O WAT 2607 15.627 60.807 5.567 1.00 0.00 O ATOM 20106 H1 WAT 2607 15.265 60.039 6.009 1.00 0.00 H ATOM 20107 H2 WAT 2607 14.908 61.439 5.557 1.00 0.00 H TER 20109 WAT 2607 ATOM 20109 O WAT 2608 62.910 14.060 111.309 1.00 0.00 O ATOM 20110 H1 WAT 2608 63.319 13.264 111.647 1.00 0.00 H ATOM 20111 H2 WAT 2608 62.025 14.048 111.674 1.00 0.00 H TER 20113 WAT 2608 ATOM 20113 O WAT 2609 84.306 82.583 10.871 1.00 0.00 O ATOM 20114 H1 WAT 2609 83.494 82.581 11.378 1.00 0.00 H ATOM 20115 H2 WAT 2609 84.934 83.046 11.425 1.00 0.00 H TER 20117 WAT 2609 ATOM 20117 O WAT 2610 35.211 82.121 5.774 1.00 0.00 O ATOM 20118 H1 WAT 2610 35.641 81.391 6.220 1.00 0.00 H ATOM 20119 H2 WAT 2610 35.737 82.886 6.005 1.00 0.00 H TER 20121 WAT 2610 ATOM 20121 O WAT 2611 83.595 92.504 14.119 1.00 0.00 O ATOM 20122 H1 WAT 2611 83.732 91.618 13.782 1.00 0.00 H ATOM 20123 H2 WAT 2611 83.946 93.077 13.437 1.00 0.00 H TER 20125 WAT 2611 ATOM 20125 O WAT 2612 35.730 16.156 74.050 1.00 0.00 O ATOM 20126 H1 WAT 2612 35.045 16.779 74.294 1.00 0.00 H ATOM 20127 H2 WAT 2612 36.438 16.321 74.673 1.00 0.00 H TER 20129 WAT 2612 ATOM 20129 O WAT 2613 102.931 74.330 117.396 1.00 0.00 O ATOM 20130 H1 WAT 2613 103.575 73.680 117.117 1.00 0.00 H ATOM 20131 H2 WAT 2613 103.100 74.448 118.331 1.00 0.00 H TER 20133 WAT 2613 ATOM 20133 O WAT 2614 18.420 70.478 83.154 1.00 0.00 O ATOM 20134 H1 WAT 2614 18.159 70.937 83.953 1.00 0.00 H ATOM 20135 H2 WAT 2614 17.808 69.745 83.088 1.00 0.00 H TER 20137 WAT 2614 ATOM 20137 O WAT 2615 135.457 109.476 64.645 1.00 0.00 O ATOM 20138 H1 WAT 2615 136.253 108.963 64.508 1.00 0.00 H ATOM 20139 H2 WAT 2615 135.562 110.237 64.074 1.00 0.00 H TER 20141 WAT 2615 ATOM 20141 O WAT 2616 104.364 30.596 0.071 1.00 0.00 O ATOM 20142 H1 WAT 2616 104.509 30.136 0.898 1.00 0.00 H ATOM 20143 H2 WAT 2616 104.405 29.909 -0.595 1.00 0.00 H TER 20145 WAT 2616 ATOM 20145 O WAT 2617 98.658 22.600 11.296 1.00 0.00 O ATOM 20146 H1 WAT 2617 98.499 22.747 10.364 1.00 0.00 H ATOM 20147 H2 WAT 2617 98.567 21.654 11.409 1.00 0.00 H TER 20149 WAT 2617 ATOM 20149 O WAT 2618 51.403 142.461 60.301 1.00 0.00 O ATOM 20150 H1 WAT 2618 50.649 142.115 59.823 1.00 0.00 H ATOM 20151 H2 WAT 2618 51.776 141.700 60.744 1.00 0.00 H TER 20153 WAT 2618 ATOM 20153 O WAT 2619 10.270 103.816 68.350 1.00 0.00 O ATOM 20154 H1 WAT 2619 9.662 104.465 68.704 1.00 0.00 H ATOM 20155 H2 WAT 2619 10.103 103.026 68.864 1.00 0.00 H TER 20157 WAT 2619 ATOM 20157 O WAT 2620 33.296 26.886 13.453 1.00 0.00 O ATOM 20158 H1 WAT 2620 32.920 26.635 12.609 1.00 0.00 H ATOM 20159 H2 WAT 2620 32.909 26.274 14.078 1.00 0.00 H TER 20161 WAT 2620 ATOM 20161 O WAT 2621 13.556 31.710 95.481 1.00 0.00 O ATOM 20162 H1 WAT 2621 14.189 31.034 95.723 1.00 0.00 H ATOM 20163 H2 WAT 2621 12.776 31.502 95.995 1.00 0.00 H TER 20165 WAT 2621 ATOM 20165 O WAT 2622 30.743 83.859 144.461 1.00 0.00 O ATOM 20166 H1 WAT 2622 31.458 83.556 143.901 1.00 0.00 H ATOM 20167 H2 WAT 2622 30.999 84.745 144.718 1.00 0.00 H TER 20169 WAT 2622 ATOM 20169 O WAT 2623 7.165 13.284 143.080 1.00 0.00 O ATOM 20170 H1 WAT 2623 6.565 13.298 143.825 1.00 0.00 H ATOM 20171 H2 WAT 2623 6.751 13.851 142.429 1.00 0.00 H TER 20173 WAT 2623 ATOM 20173 O WAT 2624 87.327 83.869 149.176 1.00 0.00 O ATOM 20174 H1 WAT 2624 88.283 83.907 149.148 1.00 0.00 H ATOM 20175 H2 WAT 2624 87.131 82.973 149.452 1.00 0.00 H TER 20177 WAT 2624 ATOM 20177 O WAT 2625 10.404 134.840 83.204 1.00 0.00 O ATOM 20178 H1 WAT 2625 9.692 134.412 82.727 1.00 0.00 H ATOM 20179 H2 WAT 2625 9.962 135.416 83.827 1.00 0.00 H TER 20181 WAT 2625 ATOM 20181 O WAT 2626 79.404 32.158 121.978 1.00 0.00 O ATOM 20182 H1 WAT 2626 79.911 31.670 122.627 1.00 0.00 H ATOM 20183 H2 WAT 2626 79.331 31.560 121.234 1.00 0.00 H TER 20185 WAT 2626 ATOM 20185 O WAT 2627 96.289 92.358 0.026 1.00 0.00 O ATOM 20186 H1 WAT 2627 96.001 92.192 0.924 1.00 0.00 H ATOM 20187 H2 WAT 2627 95.643 91.911 -0.520 1.00 0.00 H TER 20189 WAT 2627 ATOM 20189 O WAT 2628 84.256 111.074 147.185 1.00 0.00 O ATOM 20190 H1 WAT 2628 83.533 110.450 147.123 1.00 0.00 H ATOM 20191 H2 WAT 2628 84.849 110.825 146.475 1.00 0.00 H TER 20193 WAT 2628 ATOM 20193 O WAT 2629 41.464 27.010 133.489 1.00 0.00 O ATOM 20194 H1 WAT 2629 42.044 27.745 133.689 1.00 0.00 H ATOM 20195 H2 WAT 2629 41.432 26.984 132.533 1.00 0.00 H TER 20197 WAT 2629 ATOM 20197 O WAT 2630 65.253 89.243 71.999 1.00 0.00 O ATOM 20198 H1 WAT 2630 65.149 89.841 71.258 1.00 0.00 H ATOM 20199 H2 WAT 2630 65.492 88.407 71.599 1.00 0.00 H TER 20201 WAT 2630 ATOM 20201 O WAT 2631 23.023 138.431 2.069 1.00 0.00 O ATOM 20202 H1 WAT 2631 22.673 137.708 2.590 1.00 0.00 H ATOM 20203 H2 WAT 2631 22.446 139.169 2.265 1.00 0.00 H TER 20205 WAT 2631 ATOM 20205 O WAT 2632 120.521 113.172 78.665 1.00 0.00 O ATOM 20206 H1 WAT 2632 120.330 113.263 79.599 1.00 0.00 H ATOM 20207 H2 WAT 2632 121.448 113.398 78.587 1.00 0.00 H TER 20209 WAT 2632 ATOM 20209 O WAT 2633 4.253 50.086 153.047 1.00 0.00 O ATOM 20210 H1 WAT 2633 5.077 50.123 153.534 1.00 0.00 H ATOM 20211 H2 WAT 2633 4.486 50.369 152.163 1.00 0.00 H TER 20213 WAT 2633 ATOM 20213 O WAT 2634 53.973 33.006 93.511 1.00 0.00 O ATOM 20214 H1 WAT 2634 53.341 32.494 93.005 1.00 0.00 H ATOM 20215 H2 WAT 2634 54.372 33.594 92.870 1.00 0.00 H TER 20217 WAT 2634 ATOM 20217 O WAT 2635 145.219 30.727 53.686 1.00 0.00 O ATOM 20218 H1 WAT 2635 145.427 31.473 54.249 1.00 0.00 H ATOM 20219 H2 WAT 2635 144.286 30.569 53.833 1.00 0.00 H TER 20221 WAT 2635 ATOM 20221 O WAT 2636 26.086 83.351 130.080 1.00 0.00 O ATOM 20222 H1 WAT 2636 26.618 83.228 130.866 1.00 0.00 H ATOM 20223 H2 WAT 2636 25.419 83.987 130.339 1.00 0.00 H TER 20225 WAT 2636 ATOM 20225 O WAT 2637 108.813 1.696 15.070 1.00 0.00 O ATOM 20226 H1 WAT 2637 108.453 1.258 15.842 1.00 0.00 H ATOM 20227 H2 WAT 2637 109.399 2.364 15.426 1.00 0.00 H TER 20229 WAT 2637 ATOM 20229 O WAT 2638 2.222 26.387 155.250 1.00 0.00 O ATOM 20230 H1 WAT 2638 1.594 25.704 155.484 1.00 0.00 H ATOM 20231 H2 WAT 2638 2.024 27.109 155.847 1.00 0.00 H TER 20233 WAT 2638 ATOM 20233 O WAT 2639 83.428 5.423 149.825 1.00 0.00 O ATOM 20234 H1 WAT 2639 83.776 4.534 149.892 1.00 0.00 H ATOM 20235 H2 WAT 2639 83.972 5.843 149.158 1.00 0.00 H TER 20237 WAT 2639 ATOM 20237 O WAT 2640 90.877 71.351 10.597 1.00 0.00 O ATOM 20238 H1 WAT 2640 91.735 71.730 10.402 1.00 0.00 H ATOM 20239 H2 WAT 2640 90.779 71.456 11.543 1.00 0.00 H TER 20241 WAT 2640 ATOM 20241 O WAT 2641 31.740 40.036 13.707 1.00 0.00 O ATOM 20242 H1 WAT 2641 32.641 39.908 13.410 1.00 0.00 H ATOM 20243 H2 WAT 2641 31.646 40.986 13.782 1.00 0.00 H TER 20245 WAT 2641 ATOM 20245 O WAT 2642 113.514 53.193 144.112 1.00 0.00 O ATOM 20246 H1 WAT 2642 113.343 52.478 143.498 1.00 0.00 H ATOM 20247 H2 WAT 2642 114.006 53.835 143.600 1.00 0.00 H TER 20249 WAT 2642 ATOM 20249 O WAT 2643 97.758 26.975 106.417 1.00 0.00 O ATOM 20250 H1 WAT 2643 97.556 26.109 106.772 1.00 0.00 H ATOM 20251 H2 WAT 2643 98.209 27.426 107.130 1.00 0.00 H TER 20253 WAT 2643 ATOM 20253 O WAT 2644 134.408 52.209 102.544 1.00 0.00 O ATOM 20254 H1 WAT 2644 134.160 51.960 103.434 1.00 0.00 H ATOM 20255 H2 WAT 2644 135.363 52.143 102.534 1.00 0.00 H TER 20257 WAT 2644 ATOM 20257 O WAT 2645 46.730 56.471 81.619 1.00 0.00 O ATOM 20258 H1 WAT 2645 46.095 57.134 81.346 1.00 0.00 H ATOM 20259 H2 WAT 2645 46.793 55.878 80.870 1.00 0.00 H TER 20261 WAT 2645 ATOM 20261 O WAT 2646 78.381 107.318 150.103 1.00 0.00 O ATOM 20262 H1 WAT 2646 78.356 106.361 150.077 1.00 0.00 H ATOM 20263 H2 WAT 2646 78.459 107.530 151.033 1.00 0.00 H TER 20265 WAT 2646 ATOM 20265 O WAT 2647 3.306 9.276 92.167 1.00 0.00 O ATOM 20266 H1 WAT 2647 4.096 8.986 92.623 1.00 0.00 H ATOM 20267 H2 WAT 2647 3.191 8.641 91.460 1.00 0.00 H TER 20269 WAT 2647 ATOM 20269 O WAT 2648 19.052 62.162 130.675 1.00 0.00 O ATOM 20270 H1 WAT 2648 19.100 62.283 129.727 1.00 0.00 H ATOM 20271 H2 WAT 2648 18.316 62.709 130.950 1.00 0.00 H TER 20273 WAT 2648 ATOM 20273 O WAT 2649 114.702 62.388 61.818 1.00 0.00 O ATOM 20274 H1 WAT 2649 113.875 62.129 61.411 1.00 0.00 H ATOM 20275 H2 WAT 2649 115.356 61.818 61.414 1.00 0.00 H TER 20277 WAT 2649 ATOM 20277 O WAT 2650 47.821 135.197 87.785 1.00 0.00 O ATOM 20278 H1 WAT 2650 46.882 135.376 87.733 1.00 0.00 H ATOM 20279 H2 WAT 2650 47.884 134.242 87.778 1.00 0.00 H TER 20281 WAT 2650 ATOM 20281 O WAT 2651 145.526 33.676 111.720 1.00 0.00 O ATOM 20282 H1 WAT 2651 145.782 32.755 111.743 1.00 0.00 H ATOM 20283 H2 WAT 2651 145.596 33.922 110.798 1.00 0.00 H TER 20285 WAT 2651 ATOM 20285 O WAT 2652 40.816 41.393 121.524 1.00 0.00 O ATOM 20286 H1 WAT 2652 41.470 42.089 121.589 1.00 0.00 H ATOM 20287 H2 WAT 2652 40.476 41.302 122.414 1.00 0.00 H TER 20289 WAT 2652 ATOM 20289 O WAT 2653 130.814 134.261 66.744 1.00 0.00 O ATOM 20290 H1 WAT 2653 130.761 133.769 67.564 1.00 0.00 H ATOM 20291 H2 WAT 2653 131.234 133.658 66.130 1.00 0.00 H TER 20293 WAT 2653 ATOM 20293 O WAT 2654 1.327 15.576 137.980 1.00 0.00 O ATOM 20294 H1 WAT 2654 1.257 14.682 138.314 1.00 0.00 H ATOM 20295 H2 WAT 2654 0.551 16.021 138.321 1.00 0.00 H TER 20297 WAT 2654 ATOM 20297 O WAT 2655 114.165 132.163 0.141 1.00 0.00 O ATOM 20298 H1 WAT 2655 114.645 132.908 0.502 1.00 0.00 H ATOM 20299 H2 WAT 2655 114.835 131.629 -0.286 1.00 0.00 H TER 20301 WAT 2655 ATOM 20301 O WAT 2656 69.144 65.207 78.862 1.00 0.00 O ATOM 20302 H1 WAT 2656 68.277 65.610 78.913 1.00 0.00 H ATOM 20303 H2 WAT 2656 69.360 64.986 79.768 1.00 0.00 H TER 20305 WAT 2656 ATOM 20305 O WAT 2657 8.650 107.118 148.223 1.00 0.00 O ATOM 20306 H1 WAT 2657 9.506 107.003 147.812 1.00 0.00 H ATOM 20307 H2 WAT 2657 8.271 107.877 147.779 1.00 0.00 H TER 20309 WAT 2657 ATOM 20309 O WAT 2658 23.264 67.501 59.773 1.00 0.00 O ATOM 20310 H1 WAT 2658 23.805 68.061 59.216 1.00 0.00 H ATOM 20311 H2 WAT 2658 22.875 66.868 59.170 1.00 0.00 H TER 20313 WAT 2658 ATOM 20313 O WAT 2659 117.693 15.245 1.943 1.00 0.00 O ATOM 20314 H1 WAT 2659 117.890 16.094 2.341 1.00 0.00 H ATOM 20315 H2 WAT 2659 118.521 14.766 1.979 1.00 0.00 H TER 20317 WAT 2659 ATOM 20317 O WAT 2660 33.356 132.270 122.147 1.00 0.00 O ATOM 20318 H1 WAT 2660 32.989 132.713 122.912 1.00 0.00 H ATOM 20319 H2 WAT 2660 33.975 132.901 121.779 1.00 0.00 H TER 20321 WAT 2660 ATOM 20321 O WAT 2661 80.060 92.382 1.381 1.00 0.00 O ATOM 20322 H1 WAT 2661 80.364 93.263 1.600 1.00 0.00 H ATOM 20323 H2 WAT 2661 79.832 91.991 2.224 1.00 0.00 H TER 20325 WAT 2661 ATOM 20325 O WAT 2662 127.132 24.020 74.042 1.00 0.00 O ATOM 20326 H1 WAT 2662 126.509 24.721 73.846 1.00 0.00 H ATOM 20327 H2 WAT 2662 126.608 23.350 74.481 1.00 0.00 H TER 20329 WAT 2662 ATOM 20329 O WAT 2663 26.665 79.450 102.028 1.00 0.00 O ATOM 20330 H1 WAT 2663 26.953 80.345 102.211 1.00 0.00 H ATOM 20331 H2 WAT 2663 26.656 79.391 101.073 1.00 0.00 H TER 20333 WAT 2663 ATOM 20333 O WAT 2664 109.179 132.457 137.235 1.00 0.00 O ATOM 20334 H1 WAT 2664 110.110 132.671 137.290 1.00 0.00 H ATOM 20335 H2 WAT 2664 109.094 131.962 136.420 1.00 0.00 H TER 20337 WAT 2664 ATOM 20337 O WAT 2665 88.804 10.250 140.824 1.00 0.00 O ATOM 20338 H1 WAT 2665 89.726 10.258 141.082 1.00 0.00 H ATOM 20339 H2 WAT 2665 88.573 9.322 140.788 1.00 0.00 H TER 20341 WAT 2665 ATOM 20341 O WAT 2666 2.423 35.823 111.962 1.00 0.00 O ATOM 20342 H1 WAT 2666 2.815 36.597 111.559 1.00 0.00 H ATOM 20343 H2 WAT 2666 2.206 35.252 111.225 1.00 0.00 H TER 20345 WAT 2666 ATOM 20345 O WAT 2667 17.794 42.117 91.012 1.00 0.00 O ATOM 20346 H1 WAT 2667 16.986 41.908 90.543 1.00 0.00 H ATOM 20347 H2 WAT 2667 18.423 41.463 90.708 1.00 0.00 H TER 20349 WAT 2667 ATOM 20349 O WAT 2668 8.308 55.666 86.052 1.00 0.00 O ATOM 20350 H1 WAT 2668 7.944 56.405 86.540 1.00 0.00 H ATOM 20351 H2 WAT 2668 7.751 55.593 85.278 1.00 0.00 H TER 20353 WAT 2668 ATOM 20353 O WAT 2669 59.120 95.984 71.735 1.00 0.00 O ATOM 20354 H1 WAT 2669 59.215 96.687 72.378 1.00 0.00 H ATOM 20355 H2 WAT 2669 58.209 96.045 71.447 1.00 0.00 H TER 20357 WAT 2669 ATOM 20357 O WAT 2670 49.133 79.260 77.420 1.00 0.00 O ATOM 20358 H1 WAT 2670 49.189 78.765 78.237 1.00 0.00 H ATOM 20359 H2 WAT 2670 49.438 80.137 77.649 1.00 0.00 H TER 20361 WAT 2670 ATOM 20361 O WAT 2671 128.330 51.224 115.673 1.00 0.00 O ATOM 20362 H1 WAT 2671 127.802 51.996 115.471 1.00 0.00 H ATOM 20363 H2 WAT 2671 127.760 50.483 115.469 1.00 0.00 H TER 20365 WAT 2671 ATOM 20365 O WAT 2672 47.176 134.568 157.404 1.00 0.00 O ATOM 20366 H1 WAT 2672 46.435 134.384 157.981 1.00 0.00 H ATOM 20367 H2 WAT 2672 47.248 133.791 156.850 1.00 0.00 H TER 20369 WAT 2672 ATOM 20369 O WAT 2673 114.055 30.344 14.595 1.00 0.00 O ATOM 20370 H1 WAT 2673 114.283 29.414 14.592 1.00 0.00 H ATOM 20371 H2 WAT 2673 114.514 30.700 15.356 1.00 0.00 H TER 20373 WAT 2673 ATOM 20373 O WAT 2674 48.981 61.586 70.768 1.00 0.00 O ATOM 20374 H1 WAT 2674 49.674 60.959 70.977 1.00 0.00 H ATOM 20375 H2 WAT 2674 48.510 61.187 70.037 1.00 0.00 H TER 20377 WAT 2674 ATOM 20377 O WAT 2675 132.922 74.630 147.960 1.00 0.00 O ATOM 20378 H1 WAT 2675 132.722 74.047 148.691 1.00 0.00 H ATOM 20379 H2 WAT 2675 133.337 75.391 148.367 1.00 0.00 H TER 20381 WAT 2675 ATOM 20381 O WAT 2676 33.658 140.837 129.162 1.00 0.00 O ATOM 20382 H1 WAT 2676 33.630 139.922 129.439 1.00 0.00 H ATOM 20383 H2 WAT 2676 33.658 140.799 128.206 1.00 0.00 H TER 20385 WAT 2676 ATOM 20385 O WAT 2677 98.766 69.836 146.557 1.00 0.00 O ATOM 20386 H1 WAT 2677 98.201 69.249 147.060 1.00 0.00 H ATOM 20387 H2 WAT 2677 99.509 70.007 147.135 1.00 0.00 H TER 20389 WAT 2677 ATOM 20389 O WAT 2678 108.431 133.476 106.727 1.00 0.00 O ATOM 20390 H1 WAT 2678 108.485 134.139 106.039 1.00 0.00 H ATOM 20391 H2 WAT 2678 109.212 133.622 107.261 1.00 0.00 H TER 20393 WAT 2678 ATOM 20393 O WAT 2679 88.100 24.931 69.364 1.00 0.00 O ATOM 20394 H1 WAT 2679 87.429 25.410 69.850 1.00 0.00 H ATOM 20395 H2 WAT 2679 88.167 24.089 69.814 1.00 0.00 H TER 20397 WAT 2679 ATOM 20397 O WAT 2680 3.870 139.915 63.743 1.00 0.00 O ATOM 20398 H1 WAT 2680 4.142 139.133 64.224 1.00 0.00 H ATOM 20399 H2 WAT 2680 4.550 140.561 63.932 1.00 0.00 H TER 20401 WAT 2680 ATOM 20401 O WAT 2681 30.715 44.111 65.528 1.00 0.00 O ATOM 20402 H1 WAT 2681 30.322 44.612 64.813 1.00 0.00 H ATOM 20403 H2 WAT 2681 31.209 43.417 65.091 1.00 0.00 H TER 20405 WAT 2681 ATOM 20405 O WAT 2682 52.711 15.427 125.660 1.00 0.00 O ATOM 20406 H1 WAT 2682 52.187 16.219 125.777 1.00 0.00 H ATOM 20407 H2 WAT 2682 52.366 14.813 126.309 1.00 0.00 H TER 20409 WAT 2682 ATOM 20409 O WAT 2683 42.055 10.011 102.179 1.00 0.00 O ATOM 20410 H1 WAT 2683 42.961 9.986 102.485 1.00 0.00 H ATOM 20411 H2 WAT 2683 42.125 10.166 101.237 1.00 0.00 H TER 20413 WAT 2683 ATOM 20413 O WAT 2684 114.200 55.370 104.304 1.00 0.00 O ATOM 20414 H1 WAT 2684 115.047 55.654 103.960 1.00 0.00 H ATOM 20415 H2 WAT 2684 113.559 55.890 103.821 1.00 0.00 H TER 20417 WAT 2684 ATOM 20417 O WAT 2685 5.710 88.522 125.728 1.00 0.00 O ATOM 20418 H1 WAT 2685 4.795 88.281 125.876 1.00 0.00 H ATOM 20419 H2 WAT 2685 6.001 87.940 125.026 1.00 0.00 H TER 20421 WAT 2685 ATOM 20421 O WAT 2686 46.785 144.922 146.758 1.00 0.00 O ATOM 20422 H1 WAT 2686 46.704 145.258 147.650 1.00 0.00 H ATOM 20423 H2 WAT 2686 47.613 144.442 146.758 1.00 0.00 H TER 20425 WAT 2686 ATOM 20425 O WAT 2687 36.499 132.468 101.034 1.00 0.00 O ATOM 20426 H1 WAT 2687 36.823 133.265 100.616 1.00 0.00 H ATOM 20427 H2 WAT 2687 36.658 132.606 101.968 1.00 0.00 H TER 20429 WAT 2687 ATOM 20429 O WAT 2688 75.933 14.283 16.677 1.00 0.00 O ATOM 20430 H1 WAT 2688 76.501 13.529 16.838 1.00 0.00 H ATOM 20431 H2 WAT 2688 76.295 14.977 17.227 1.00 0.00 H TER 20433 WAT 2688 ATOM 20433 O WAT 2689 10.100 62.759 153.340 1.00 0.00 O ATOM 20434 H1 WAT 2689 9.822 62.184 152.626 1.00 0.00 H ATOM 20435 H2 WAT 2689 9.511 63.511 153.284 1.00 0.00 H TER 20437 WAT 2689 ATOM 20437 O WAT 2690 72.353 91.777 68.729 1.00 0.00 O ATOM 20438 H1 WAT 2690 71.642 91.904 68.101 1.00 0.00 H ATOM 20439 H2 WAT 2690 71.994 92.084 69.562 1.00 0.00 H TER 20441 WAT 2690 ATOM 20441 O WAT 2691 27.567 56.537 80.906 1.00 0.00 O ATOM 20442 H1 WAT 2691 27.866 55.889 80.268 1.00 0.00 H ATOM 20443 H2 WAT 2691 26.617 56.428 80.932 1.00 0.00 H TER 20445 WAT 2691 ATOM 20445 O WAT 2692 48.389 105.028 152.852 1.00 0.00 O ATOM 20446 H1 WAT 2692 47.733 104.363 153.058 1.00 0.00 H ATOM 20447 H2 WAT 2692 48.882 105.138 153.665 1.00 0.00 H TER 20449 WAT 2692 ATOM 20449 O WAT 2693 20.865 122.704 87.812 1.00 0.00 O ATOM 20450 H1 WAT 2693 21.559 122.845 88.456 1.00 0.00 H ATOM 20451 H2 WAT 2693 20.832 123.520 87.312 1.00 0.00 H TER 20453 WAT 2693 ATOM 20453 O WAT 2694 72.904 52.266 22.914 1.00 0.00 O ATOM 20454 H1 WAT 2694 73.796 52.614 22.922 1.00 0.00 H ATOM 20455 H2 WAT 2694 72.818 51.849 22.057 1.00 0.00 H TER 20457 WAT 2694 ATOM 20457 O WAT 2695 70.610 55.697 18.432 1.00 0.00 O ATOM 20458 H1 WAT 2695 70.144 55.323 19.180 1.00 0.00 H ATOM 20459 H2 WAT 2695 70.036 56.396 18.118 1.00 0.00 H TER 20461 WAT 2695 ATOM 20461 O WAT 2696 17.692 66.540 102.807 1.00 0.00 O ATOM 20462 H1 WAT 2696 18.639 66.657 102.735 1.00 0.00 H ATOM 20463 H2 WAT 2696 17.458 66.982 103.624 1.00 0.00 H TER 20465 WAT 2696 ATOM 20465 O WAT 2697 43.460 91.180 27.357 1.00 0.00 O ATOM 20466 H1 WAT 2697 42.912 91.917 27.627 1.00 0.00 H ATOM 20467 H2 WAT 2697 42.857 90.583 26.914 1.00 0.00 H TER 20469 WAT 2697 ATOM 20469 O WAT 2698 9.412 36.675 85.899 1.00 0.00 O ATOM 20470 H1 WAT 2698 8.933 37.277 85.329 1.00 0.00 H ATOM 20471 H2 WAT 2698 10.054 36.259 85.324 1.00 0.00 H TER 20473 WAT 2698 ATOM 20473 O WAT 2699 26.384 35.858 138.951 1.00 0.00 O ATOM 20474 H1 WAT 2699 25.597 35.449 139.312 1.00 0.00 H ATOM 20475 H2 WAT 2699 26.863 35.136 138.544 1.00 0.00 H TER 20477 WAT 2699 ATOM 20477 O WAT 2700 40.747 73.966 148.497 1.00 0.00 O ATOM 20478 H1 WAT 2700 40.650 73.118 148.064 1.00 0.00 H ATOM 20479 H2 WAT 2700 41.446 73.829 149.137 1.00 0.00 H TER 20481 WAT 2700 ATOM 20481 O WAT 2701 39.041 49.710 83.175 1.00 0.00 O ATOM 20482 H1 WAT 2701 38.996 49.598 84.125 1.00 0.00 H ATOM 20483 H2 WAT 2701 38.199 49.386 82.856 1.00 0.00 H TER 20485 WAT 2701 ATOM 20485 O WAT 2702 30.224 84.322 135.806 1.00 0.00 O ATOM 20486 H1 WAT 2702 31.063 84.771 135.698 1.00 0.00 H ATOM 20487 H2 WAT 2702 30.449 83.392 135.811 1.00 0.00 H TER 20489 WAT 2702 ATOM 20489 O WAT 2703 35.498 0.626 89.051 1.00 0.00 O ATOM 20490 H1 WAT 2703 35.309 0.057 89.798 1.00 0.00 H ATOM 20491 H2 WAT 2703 34.720 1.176 88.966 1.00 0.00 H TER 20493 WAT 2703 ATOM 20493 O WAT 2704 119.435 49.442 123.796 1.00 0.00 O ATOM 20494 H1 WAT 2704 119.349 49.012 124.647 1.00 0.00 H ATOM 20495 H2 WAT 2704 119.510 50.373 124.005 1.00 0.00 H TER 20497 WAT 2704 ATOM 20497 O WAT 2705 102.928 92.970 87.792 1.00 0.00 O ATOM 20498 H1 WAT 2705 103.031 92.226 88.385 1.00 0.00 H ATOM 20499 H2 WAT 2705 101.988 93.149 87.794 1.00 0.00 H TER 20501 WAT 2705 ATOM 20501 O WAT 2706 95.879 141.424 145.646 1.00 0.00 O ATOM 20502 H1 WAT 2706 95.730 141.991 144.890 1.00 0.00 H ATOM 20503 H2 WAT 2706 96.831 141.410 145.751 1.00 0.00 H TER 20505 WAT 2706 ATOM 20505 O WAT 2707 82.242 132.556 124.706 1.00 0.00 O ATOM 20506 H1 WAT 2707 82.275 132.727 125.647 1.00 0.00 H ATOM 20507 H2 WAT 2707 82.582 133.356 124.305 1.00 0.00 H TER 20509 WAT 2707 ATOM 20509 O WAT 2708 16.017 135.100 116.893 1.00 0.00 O ATOM 20510 H1 WAT 2708 15.250 135.546 117.253 1.00 0.00 H ATOM 20511 H2 WAT 2708 16.545 134.876 117.659 1.00 0.00 H TER 20513 WAT 2708 ATOM 20513 O WAT 2709 73.517 23.432 108.080 1.00 0.00 O ATOM 20514 H1 WAT 2709 73.386 22.753 107.418 1.00 0.00 H ATOM 20515 H2 WAT 2709 72.787 23.318 108.688 1.00 0.00 H TER 20517 WAT 2709 ATOM 20517 O WAT 2710 143.629 30.370 109.868 1.00 0.00 O ATOM 20518 H1 WAT 2710 144.408 30.305 109.315 1.00 0.00 H ATOM 20519 H2 WAT 2710 143.578 29.523 110.311 1.00 0.00 H TER 20521 WAT 2710 ATOM 20521 O WAT 2711 27.875 44.657 118.177 1.00 0.00 O ATOM 20522 H1 WAT 2711 27.224 45.056 117.599 1.00 0.00 H ATOM 20523 H2 WAT 2711 28.710 44.797 117.730 1.00 0.00 H TER 20525 WAT 2711 ATOM 20525 O WAT 2712 133.144 68.483 80.855 1.00 0.00 O ATOM 20526 H1 WAT 2712 133.300 67.892 80.118 1.00 0.00 H ATOM 20527 H2 WAT 2712 132.856 67.909 81.565 1.00 0.00 H TER 20529 WAT 2712 ATOM 20529 O WAT 2713 78.195 97.998 26.361 1.00 0.00 O ATOM 20530 H1 WAT 2713 77.629 98.395 27.024 1.00 0.00 H ATOM 20531 H2 WAT 2713 77.951 97.072 26.362 1.00 0.00 H TER 20533 WAT 2713 ATOM 20533 O WAT 2714 12.958 90.269 90.941 1.00 0.00 O ATOM 20534 H1 WAT 2714 12.183 90.827 91.001 1.00 0.00 H ATOM 20535 H2 WAT 2714 12.618 89.414 90.675 1.00 0.00 H TER 20537 WAT 2714 ATOM 20537 O WAT 2715 133.488 0.462 135.939 1.00 0.00 O ATOM 20538 H1 WAT 2715 132.878 1.154 135.684 1.00 0.00 H ATOM 20539 H2 WAT 2715 134.098 0.891 136.539 1.00 0.00 H TER 20541 WAT 2715 ATOM 20541 O WAT 2716 84.227 101.374 122.988 1.00 0.00 O ATOM 20542 H1 WAT 2716 83.359 101.043 122.761 1.00 0.00 H ATOM 20543 H2 WAT 2716 84.151 101.637 123.905 1.00 0.00 H TER 20545 WAT 2716 ATOM 20545 O WAT 2717 1.626 16.245 11.374 1.00 0.00 O ATOM 20546 H1 WAT 2717 1.643 15.289 11.334 1.00 0.00 H ATOM 20547 H2 WAT 2717 2.027 16.457 12.217 1.00 0.00 H TER 20549 WAT 2717 ATOM 20549 O WAT 2718 48.464 52.617 123.122 1.00 0.00 O ATOM 20550 H1 WAT 2718 47.995 53.267 123.647 1.00 0.00 H ATOM 20551 H2 WAT 2718 48.903 52.061 123.766 1.00 0.00 H TER 20553 WAT 2718 ATOM 20553 O WAT 2719 82.031 118.686 6.689 1.00 0.00 O ATOM 20554 H1 WAT 2719 82.405 118.609 5.812 1.00 0.00 H ATOM 20555 H2 WAT 2719 81.142 118.342 6.601 1.00 0.00 H TER 20557 WAT 2719 ATOM 20557 O WAT 2720 83.856 28.517 9.721 1.00 0.00 O ATOM 20558 H1 WAT 2720 84.434 28.218 10.423 1.00 0.00 H ATOM 20559 H2 WAT 2720 83.534 29.367 10.021 1.00 0.00 H TER 20561 WAT 2720 ATOM 20561 O WAT 2721 14.572 46.179 87.851 1.00 0.00 O ATOM 20562 H1 WAT 2721 13.726 46.422 88.227 1.00 0.00 H ATOM 20563 H2 WAT 2721 15.120 46.954 87.973 1.00 0.00 H TER 20565 WAT 2721 ATOM 20565 O WAT 2722 8.806 124.587 109.888 1.00 0.00 O ATOM 20566 H1 WAT 2722 9.738 124.468 110.068 1.00 0.00 H ATOM 20567 H2 WAT 2722 8.459 123.697 109.823 1.00 0.00 H TER 20569 WAT 2722 ATOM 20569 O WAT 2723 124.284 144.688 109.020 1.00 0.00 O ATOM 20570 H1 WAT 2723 124.522 145.548 108.674 1.00 0.00 H ATOM 20571 H2 WAT 2723 124.435 144.086 108.291 1.00 0.00 H TER 20573 WAT 2723 ATOM 20573 O WAT 2724 55.108 92.513 155.063 1.00 0.00 O ATOM 20574 H1 WAT 2724 55.141 92.300 154.131 1.00 0.00 H ATOM 20575 H2 WAT 2724 54.977 93.461 155.088 1.00 0.00 H TER 20577 WAT 2724 ATOM 20577 O WAT 2725 41.020 79.672 71.321 1.00 0.00 O ATOM 20578 H1 WAT 2725 40.259 79.602 71.897 1.00 0.00 H ATOM 20579 H2 WAT 2725 40.649 79.762 70.443 1.00 0.00 H TER 20581 WAT 2725 ATOM 20581 O WAT 2726 22.514 40.792 73.249 1.00 0.00 O ATOM 20582 H1 WAT 2726 22.980 41.605 73.055 1.00 0.00 H ATOM 20583 H2 WAT 2726 22.770 40.195 72.546 1.00 0.00 H TER 20585 WAT 2726 ATOM 20585 O WAT 2727 25.304 47.900 73.189 1.00 0.00 O ATOM 20586 H1 WAT 2727 25.386 48.434 73.979 1.00 0.00 H ATOM 20587 H2 WAT 2727 24.383 47.978 72.941 1.00 0.00 H TER 20589 WAT 2727 ATOM 20589 O WAT 2728 115.601 143.777 140.309 1.00 0.00 O ATOM 20590 H1 WAT 2728 115.989 143.078 140.835 1.00 0.00 H ATOM 20591 H2 WAT 2728 116.155 143.825 139.529 1.00 0.00 H TER 20593 WAT 2728 ATOM 20593 O WAT 2729 92.319 39.082 17.522 1.00 0.00 O ATOM 20594 H1 WAT 2729 92.194 40.025 17.422 1.00 0.00 H ATOM 20595 H2 WAT 2729 92.654 38.978 18.413 1.00 0.00 H TER 20597 WAT 2729 ATOM 20597 O WAT 2730 22.598 81.399 119.651 1.00 0.00 O ATOM 20598 H1 WAT 2730 22.857 82.026 118.977 1.00 0.00 H ATOM 20599 H2 WAT 2730 22.490 81.927 120.442 1.00 0.00 H TER 20601 WAT 2730 ATOM 20601 O WAT 2731 104.492 103.908 21.587 1.00 0.00 O ATOM 20602 H1 WAT 2731 104.766 104.808 21.760 1.00 0.00 H ATOM 20603 H2 WAT 2731 105.087 103.603 20.902 1.00 0.00 H TER 20605 WAT 2731 ATOM 20605 O WAT 2732 22.131 131.762 146.430 1.00 0.00 O ATOM 20606 H1 WAT 2732 21.201 131.620 146.605 1.00 0.00 H ATOM 20607 H2 WAT 2732 22.432 130.938 146.047 1.00 0.00 H TER 20609 WAT 2732 ATOM 20609 O WAT 2733 67.900 125.920 154.892 1.00 0.00 O ATOM 20610 H1 WAT 2733 68.416 126.481 155.472 1.00 0.00 H ATOM 20611 H2 WAT 2733 67.757 125.120 155.398 1.00 0.00 H TER 20613 WAT 2733 ATOM 20613 O WAT 2734 12.445 21.730 97.165 1.00 0.00 O ATOM 20614 H1 WAT 2734 11.935 22.434 97.568 1.00 0.00 H ATOM 20615 H2 WAT 2734 12.961 22.166 96.488 1.00 0.00 H TER 20617 WAT 2734 ATOM 20617 O WAT 2735 144.327 8.161 76.327 1.00 0.00 O ATOM 20618 H1 WAT 2735 144.943 8.883 76.457 1.00 0.00 H ATOM 20619 H2 WAT 2735 144.346 7.997 75.384 1.00 0.00 H TER 20621 WAT 2735 ATOM 20621 O WAT 2736 89.042 36.248 59.502 1.00 0.00 O ATOM 20622 H1 WAT 2736 89.068 35.750 58.684 1.00 0.00 H ATOM 20623 H2 WAT 2736 89.836 36.782 59.482 1.00 0.00 H TER 20625 WAT 2736 ATOM 20625 O WAT 2737 25.421 31.380 62.108 1.00 0.00 O ATOM 20626 H1 WAT 2737 26.017 30.812 62.595 1.00 0.00 H ATOM 20627 H2 WAT 2737 24.572 30.941 62.161 1.00 0.00 H TER 20629 WAT 2737 ATOM 20629 O WAT 2738 5.640 19.619 154.250 1.00 0.00 O ATOM 20630 H1 WAT 2738 5.035 19.093 154.773 1.00 0.00 H ATOM 20631 H2 WAT 2738 6.422 19.073 154.167 1.00 0.00 H TER 20633 WAT 2738 ATOM 20633 O WAT 2739 56.203 59.183 151.756 1.00 0.00 O ATOM 20634 H1 WAT 2739 56.596 59.880 152.281 1.00 0.00 H ATOM 20635 H2 WAT 2739 55.720 58.650 152.389 1.00 0.00 H TER 20637 WAT 2739 ATOM 20637 O WAT 2740 73.407 115.116 80.296 1.00 0.00 O ATOM 20638 H1 WAT 2740 73.464 114.434 79.627 1.00 0.00 H ATOM 20639 H2 WAT 2740 74.151 115.690 80.116 1.00 0.00 H TER 20641 WAT 2740 ATOM 20641 O WAT 2741 33.643 133.936 95.006 1.00 0.00 O ATOM 20642 H1 WAT 2741 33.793 133.258 94.348 1.00 0.00 H ATOM 20643 H2 WAT 2741 34.173 133.662 95.756 1.00 0.00 H TER 20645 WAT 2741 ATOM 20645 O WAT 2742 66.809 101.921 2.247 1.00 0.00 O ATOM 20646 H1 WAT 2742 66.593 102.810 2.529 1.00 0.00 H ATOM 20647 H2 WAT 2742 67.125 101.489 3.040 1.00 0.00 H TER 20649 WAT 2742 ATOM 20649 O WAT 2743 10.987 119.894 21.238 1.00 0.00 O ATOM 20650 H1 WAT 2743 11.150 119.388 20.443 1.00 0.00 H ATOM 20651 H2 WAT 2743 10.056 119.761 21.420 1.00 0.00 H TER 20653 WAT 2743 ATOM 20653 O WAT 2744 105.063 13.378 147.273 1.00 0.00 O ATOM 20654 H1 WAT 2744 105.204 14.226 147.695 1.00 0.00 H ATOM 20655 H2 WAT 2744 105.049 12.751 147.996 1.00 0.00 H TER 20657 WAT 2744 ATOM 20657 O WAT 2745 34.013 13.363 99.499 1.00 0.00 O ATOM 20658 H1 WAT 2745 34.043 13.666 100.407 1.00 0.00 H ATOM 20659 H2 WAT 2745 33.424 13.977 99.061 1.00 0.00 H TER 20661 WAT 2745 ATOM 20661 O WAT 2746 51.165 99.064 110.401 1.00 0.00 O ATOM 20662 H1 WAT 2746 51.505 98.478 109.725 1.00 0.00 H ATOM 20663 H2 WAT 2746 51.046 99.902 109.954 1.00 0.00 H TER 20665 WAT 2746 ATOM 20665 O WAT 2747 111.570 100.313 149.418 1.00 0.00 O ATOM 20666 H1 WAT 2747 111.663 101.241 149.634 1.00 0.00 H ATOM 20667 H2 WAT 2747 111.586 99.868 150.266 1.00 0.00 H TER 20669 WAT 2747 ATOM 20669 O WAT 2748 123.566 120.748 78.211 1.00 0.00 O ATOM 20670 H1 WAT 2748 123.706 120.185 78.973 1.00 0.00 H ATOM 20671 H2 WAT 2748 122.793 120.382 77.783 1.00 0.00 H TER 20673 WAT 2748 ATOM 20673 O WAT 2749 97.525 136.168 134.994 1.00 0.00 O ATOM 20674 H1 WAT 2749 97.317 135.845 135.870 1.00 0.00 H ATOM 20675 H2 WAT 2749 96.810 136.769 134.784 1.00 0.00 H TER 20677 WAT 2749 ATOM 20677 O WAT 2750 32.267 47.727 102.690 1.00 0.00 O ATOM 20678 H1 WAT 2750 31.451 47.239 102.803 1.00 0.00 H ATOM 20679 H2 WAT 2750 32.043 48.626 102.930 1.00 0.00 H TER 20681 WAT 2750 ATOM 20681 O WAT 2751 126.069 128.630 19.277 1.00 0.00 O ATOM 20682 H1 WAT 2751 126.833 128.079 19.448 1.00 0.00 H ATOM 20683 H2 WAT 2751 126.303 129.483 19.643 1.00 0.00 H TER 20685 WAT 2751 ATOM 20685 O WAT 2752 40.983 144.968 2.320 1.00 0.00 O ATOM 20686 H1 WAT 2752 40.441 144.263 1.966 1.00 0.00 H ATOM 20687 H2 WAT 2752 41.681 145.080 1.676 1.00 0.00 H TER 20689 WAT 2752 ATOM 20689 O WAT 2753 15.097 0.617 105.509 1.00 0.00 O ATOM 20690 H1 WAT 2753 15.513 -0.162 105.141 1.00 0.00 H ATOM 20691 H2 WAT 2753 15.686 1.335 105.277 1.00 0.00 H TER 20693 WAT 2753 ATOM 20693 O WAT 2754 41.406 135.269 74.013 1.00 0.00 O ATOM 20694 H1 WAT 2754 41.891 135.031 74.803 1.00 0.00 H ATOM 20695 H2 WAT 2754 41.853 136.049 73.684 1.00 0.00 H TER 20697 WAT 2754 ATOM 20697 O WAT 2755 65.445 137.453 51.762 1.00 0.00 O ATOM 20698 H1 WAT 2755 65.041 137.988 51.078 1.00 0.00 H ATOM 20699 H2 WAT 2755 66.245 137.115 51.360 1.00 0.00 H TER 20701 WAT 2755 ATOM 20701 O WAT 2756 63.128 47.985 146.173 1.00 0.00 O ATOM 20702 H1 WAT 2756 62.342 48.508 146.011 1.00 0.00 H ATOM 20703 H2 WAT 2756 63.101 47.798 147.111 1.00 0.00 H TER 20705 WAT 2756 ATOM 20705 O WAT 2757 6.312 57.932 19.285 1.00 0.00 O ATOM 20706 H1 WAT 2757 6.489 57.941 20.226 1.00 0.00 H ATOM 20707 H2 WAT 2757 5.440 58.317 19.202 1.00 0.00 H TER 20709 WAT 2757 ATOM 20709 O WAT 2758 111.213 103.767 132.182 1.00 0.00 O ATOM 20710 H1 WAT 2758 110.301 103.912 132.432 1.00 0.00 H ATOM 20711 H2 WAT 2758 111.711 104.375 132.728 1.00 0.00 H TER 20713 WAT 2758 ATOM 20713 O WAT 2759 14.384 17.053 148.117 1.00 0.00 O ATOM 20714 H1 WAT 2759 13.550 16.649 147.880 1.00 0.00 H ATOM 20715 H2 WAT 2759 14.284 17.287 149.039 1.00 0.00 H TER 20717 WAT 2759 ATOM 20717 O WAT 2760 96.311 34.864 7.036 1.00 0.00 O ATOM 20718 H1 WAT 2760 97.102 34.324 7.015 1.00 0.00 H ATOM 20719 H2 WAT 2760 96.411 35.463 6.296 1.00 0.00 H TER 20721 WAT 2760 ATOM 20721 O WAT 2761 1.756 10.687 97.705 1.00 0.00 O ATOM 20722 H1 WAT 2761 2.133 11.498 98.046 1.00 0.00 H ATOM 20723 H2 WAT 2761 1.915 10.041 98.393 1.00 0.00 H TER 20725 WAT 2761 ATOM 20725 O WAT 2762 49.376 12.222 18.154 1.00 0.00 O ATOM 20726 H1 WAT 2762 50.251 11.968 17.862 1.00 0.00 H ATOM 20727 H2 WAT 2762 48.823 12.110 17.382 1.00 0.00 H TER 20729 WAT 2762 ATOM 20729 O WAT 2763 84.358 88.868 27.412 1.00 0.00 O ATOM 20730 H1 WAT 2763 84.609 89.657 27.893 1.00 0.00 H ATOM 20731 H2 WAT 2763 84.767 88.971 26.553 1.00 0.00 H TER 20733 WAT 2763 ATOM 20733 O WAT 2764 107.990 78.755 148.532 1.00 0.00 O ATOM 20734 H1 WAT 2764 107.426 79.245 147.933 1.00 0.00 H ATOM 20735 H2 WAT 2764 108.880 78.976 148.259 1.00 0.00 H TER 20737 WAT 2764 ATOM 20737 O WAT 2765 122.357 57.861 122.454 1.00 0.00 O ATOM 20738 H1 WAT 2765 121.477 57.588 122.713 1.00 0.00 H ATOM 20739 H2 WAT 2765 122.789 58.088 123.278 1.00 0.00 H TER 20741 WAT 2765 ATOM 20741 O WAT 2766 77.804 4.050 121.107 1.00 0.00 O ATOM 20742 H1 WAT 2766 78.194 3.244 121.447 1.00 0.00 H ATOM 20743 H2 WAT 2766 77.511 4.521 121.887 1.00 0.00 H TER 20745 WAT 2766 ATOM 20745 O WAT 2767 24.214 133.370 3.172 1.00 0.00 O ATOM 20746 H1 WAT 2767 23.776 132.522 3.104 1.00 0.00 H ATOM 20747 H2 WAT 2767 24.942 133.216 3.774 1.00 0.00 H TER 20749 WAT 2767 ATOM 20749 O WAT 2768 118.607 79.979 91.473 1.00 0.00 O ATOM 20750 H1 WAT 2768 119.053 80.786 91.730 1.00 0.00 H ATOM 20751 H2 WAT 2768 117.728 80.261 91.221 1.00 0.00 H TER 20753 WAT 2768 ATOM 20753 O WAT 2769 110.485 48.340 15.726 1.00 0.00 O ATOM 20754 H1 WAT 2769 109.557 48.431 15.946 1.00 0.00 H ATOM 20755 H2 WAT 2769 110.911 49.068 16.177 1.00 0.00 H TER 20757 WAT 2769 ATOM 20757 O WAT 2770 20.090 72.027 158.378 1.00 0.00 O ATOM 20758 H1 WAT 2770 20.363 72.428 157.553 1.00 0.00 H ATOM 20759 H2 WAT 2770 20.649 72.435 159.040 1.00 0.00 H TER 20761 WAT 2770 ATOM 20761 O WAT 2771 114.993 77.905 150.183 1.00 0.00 O ATOM 20762 H1 WAT 2771 114.891 77.985 151.132 1.00 0.00 H ATOM 20763 H2 WAT 2771 114.291 78.445 149.820 1.00 0.00 H TER 20765 WAT 2771 ATOM 20765 O WAT 2772 34.629 121.040 69.651 1.00 0.00 O ATOM 20766 H1 WAT 2772 34.574 121.817 69.095 1.00 0.00 H ATOM 20767 H2 WAT 2772 33.742 120.925 69.990 1.00 0.00 H TER 20769 WAT 2772 ATOM 20769 O WAT 2773 102.129 96.409 156.280 1.00 0.00 O ATOM 20770 H1 WAT 2773 103.062 96.470 156.075 1.00 0.00 H ATOM 20771 H2 WAT 2773 102.098 96.340 157.234 1.00 0.00 H TER 20773 WAT 2773 ATOM 20773 O WAT 2774 86.209 8.740 119.334 1.00 0.00 O ATOM 20774 H1 WAT 2774 86.414 7.942 118.846 1.00 0.00 H ATOM 20775 H2 WAT 2774 85.265 8.852 119.222 1.00 0.00 H TER 20777 WAT 2774 ATOM 20777 O WAT 2775 0.006 17.204 23.045 1.00 0.00 O ATOM 20778 H1 WAT 2775 0.962 17.225 23.098 1.00 0.00 H ATOM 20779 H2 WAT 2775 -0.270 16.791 23.863 1.00 0.00 H TER 20781 WAT 2775 ATOM 20781 O WAT 2776 28.313 67.721 21.227 1.00 0.00 O ATOM 20782 H1 WAT 2776 29.039 67.640 21.847 1.00 0.00 H ATOM 20783 H2 WAT 2776 28.023 68.629 21.316 1.00 0.00 H TER 20785 WAT 2776 ATOM 20785 O WAT 2777 129.505 137.707 116.057 1.00 0.00 O ATOM 20786 H1 WAT 2777 130.450 137.774 116.190 1.00 0.00 H ATOM 20787 H2 WAT 2777 129.353 138.114 115.204 1.00 0.00 H TER 20789 WAT 2777 ATOM 20789 O WAT 2778 38.684 10.459 150.461 1.00 0.00 O ATOM 20790 H1 WAT 2778 37.735 10.342 150.426 1.00 0.00 H ATOM 20791 H2 WAT 2778 38.909 10.851 149.618 1.00 0.00 H TER 20793 WAT 2778 ATOM 20793 O WAT 2779 142.399 12.246 57.953 1.00 0.00 O ATOM 20794 H1 WAT 2779 141.618 11.718 58.121 1.00 0.00 H ATOM 20795 H2 WAT 2779 142.095 13.151 58.019 1.00 0.00 H TER 20797 WAT 2779 ATOM 20797 O WAT 2780 64.585 132.592 146.210 1.00 0.00 O ATOM 20798 H1 WAT 2780 63.878 132.040 145.877 1.00 0.00 H ATOM 20799 H2 WAT 2780 64.601 132.419 147.151 1.00 0.00 H TER 20801 WAT 2780 ATOM 20801 O WAT 2781 10.989 106.888 63.796 1.00 0.00 O ATOM 20802 H1 WAT 2781 11.048 107.827 63.620 1.00 0.00 H ATOM 20803 H2 WAT 2781 10.251 106.591 63.263 1.00 0.00 H TER 20805 WAT 2781 ATOM 20805 O WAT 2782 109.759 66.914 10.845 1.00 0.00 O ATOM 20806 H1 WAT 2782 108.910 66.477 10.920 1.00 0.00 H ATOM 20807 H2 WAT 2782 109.615 67.610 10.204 1.00 0.00 H TER 20809 WAT 2782 ATOM 20809 O WAT 2783 39.152 117.299 19.278 1.00 0.00 O ATOM 20810 H1 WAT 2783 38.440 116.704 19.044 1.00 0.00 H ATOM 20811 H2 WAT 2783 38.854 117.723 20.083 1.00 0.00 H TER 20813 WAT 2783 ATOM 20813 O WAT 2784 127.922 47.204 142.819 1.00 0.00 O ATOM 20814 H1 WAT 2784 127.189 46.611 142.985 1.00 0.00 H ATOM 20815 H2 WAT 2784 128.640 46.629 142.556 1.00 0.00 H TER 20817 WAT 2784 ATOM 20817 O WAT 2785 95.845 92.853 7.828 1.00 0.00 O ATOM 20818 H1 WAT 2785 96.434 92.134 8.055 1.00 0.00 H ATOM 20819 H2 WAT 2785 95.858 93.425 8.596 1.00 0.00 H TER 20821 WAT 2785 ATOM 20821 O WAT 2786 81.137 47.106 116.164 1.00 0.00 O ATOM 20822 H1 WAT 2786 81.392 46.261 115.793 1.00 0.00 H ATOM 20823 H2 WAT 2786 81.931 47.638 116.116 1.00 0.00 H TER 20825 WAT 2786 ATOM 20825 O WAT 2787 123.090 40.112 138.581 1.00 0.00 O ATOM 20826 H1 WAT 2787 123.540 40.955 138.527 1.00 0.00 H ATOM 20827 H2 WAT 2787 122.386 40.174 137.936 1.00 0.00 H TER 20829 WAT 2787 ATOM 20829 O WAT 2788 135.510 25.033 151.752 1.00 0.00 O ATOM 20830 H1 WAT 2788 134.879 24.599 152.325 1.00 0.00 H ATOM 20831 H2 WAT 2788 136.346 24.612 151.952 1.00 0.00 H TER 20833 WAT 2788 ATOM 20833 O WAT 2789 39.531 127.390 106.321 1.00 0.00 O ATOM 20834 H1 WAT 2789 40.470 127.469 106.489 1.00 0.00 H ATOM 20835 H2 WAT 2789 39.471 126.799 105.571 1.00 0.00 H TER 20837 WAT 2789 ATOM 20837 O WAT 2790 25.742 31.014 119.601 1.00 0.00 O ATOM 20838 H1 WAT 2790 26.030 30.994 118.688 1.00 0.00 H ATOM 20839 H2 WAT 2790 26.525 30.791 120.104 1.00 0.00 H TER 20841 WAT 2790 ATOM 20841 O WAT 2791 111.254 1.291 132.200 1.00 0.00 O ATOM 20842 H1 WAT 2791 111.594 0.409 132.052 1.00 0.00 H ATOM 20843 H2 WAT 2791 112.033 1.846 132.237 1.00 0.00 H TER 20845 WAT 2791 ATOM 20845 O WAT 2792 86.640 90.238 131.725 1.00 0.00 O ATOM 20846 H1 WAT 2792 87.374 90.774 131.425 1.00 0.00 H ATOM 20847 H2 WAT 2792 86.950 89.841 132.539 1.00 0.00 H TER 20849 WAT 2792 ATOM 20849 O WAT 2793 16.821 56.358 114.661 1.00 0.00 O ATOM 20850 H1 WAT 2793 17.724 56.669 114.600 1.00 0.00 H ATOM 20851 H2 WAT 2793 16.900 55.408 114.742 1.00 0.00 H TER 20853 WAT 2793 ATOM 20853 O WAT 2794 117.171 125.760 130.480 1.00 0.00 O ATOM 20854 H1 WAT 2794 117.612 125.712 131.328 1.00 0.00 H ATOM 20855 H2 WAT 2794 116.239 125.716 130.692 1.00 0.00 H TER 20857 WAT 2794 ATOM 20857 O WAT 2795 121.072 128.764 112.656 1.00 0.00 O ATOM 20858 H1 WAT 2795 121.270 129.567 113.138 1.00 0.00 H ATOM 20859 H2 WAT 2795 121.731 128.137 112.954 1.00 0.00 H TER 20861 WAT 2795 ATOM 20861 O WAT 2796 106.701 65.679 121.521 1.00 0.00 O ATOM 20862 H1 WAT 2796 106.318 66.227 122.206 1.00 0.00 H ATOM 20863 H2 WAT 2796 106.332 66.021 120.707 1.00 0.00 H TER 20865 WAT 2796 ATOM 20865 O WAT 2797 79.054 4.885 18.417 1.00 0.00 O ATOM 20866 H1 WAT 2797 78.898 5.805 18.206 1.00 0.00 H ATOM 20867 H2 WAT 2797 79.336 4.894 19.331 1.00 0.00 H TER 20869 WAT 2797 ATOM 20869 O WAT 2798 116.415 123.928 6.977 1.00 0.00 O ATOM 20870 H1 WAT 2798 116.053 124.761 7.281 1.00 0.00 H ATOM 20871 H2 WAT 2798 117.315 123.926 7.303 1.00 0.00 H TER 20873 WAT 2798 ATOM 20873 O WAT 2799 87.876 32.258 92.505 1.00 0.00 O ATOM 20874 H1 WAT 2799 87.820 31.921 93.399 1.00 0.00 H ATOM 20875 H2 WAT 2799 87.587 33.168 92.573 1.00 0.00 H TER 20877 WAT 2799 ATOM 20877 O WAT 2800 5.035 85.969 54.851 1.00 0.00 O ATOM 20878 H1 WAT 2800 4.778 85.056 54.978 1.00 0.00 H ATOM 20879 H2 WAT 2800 5.857 86.056 55.334 1.00 0.00 H TER 20881 WAT 2800 ATOM 20881 O WAT 2801 25.815 82.721 112.354 1.00 0.00 O ATOM 20882 H1 WAT 2801 26.694 82.916 112.678 1.00 0.00 H ATOM 20883 H2 WAT 2801 25.277 83.448 112.668 1.00 0.00 H TER 20885 WAT 2801 ATOM 20885 O WAT 2802 27.608 60.940 127.784 1.00 0.00 O ATOM 20886 H1 WAT 2802 27.743 60.010 127.963 1.00 0.00 H ATOM 20887 H2 WAT 2802 28.449 61.349 127.989 1.00 0.00 H TER 20889 WAT 2802 ATOM 20889 O WAT 2803 29.502 21.137 111.835 1.00 0.00 O ATOM 20890 H1 WAT 2803 29.550 20.378 111.255 1.00 0.00 H ATOM 20891 H2 WAT 2803 29.193 21.849 111.274 1.00 0.00 H TER 20893 WAT 2803 ATOM 20893 O WAT 2804 13.861 98.856 114.743 1.00 0.00 O ATOM 20894 H1 WAT 2804 13.657 99.699 114.337 1.00 0.00 H ATOM 20895 H2 WAT 2804 14.666 98.571 114.311 1.00 0.00 H TER 20897 WAT 2804 ATOM 20897 O WAT 2805 142.746 22.339 151.027 1.00 0.00 O ATOM 20898 H1 WAT 2805 143.144 22.800 150.288 1.00 0.00 H ATOM 20899 H2 WAT 2805 142.392 23.035 151.580 1.00 0.00 H TER 20901 WAT 2805 ATOM 20901 O WAT 2806 123.430 101.197 2.515 1.00 0.00 O ATOM 20902 H1 WAT 2806 123.796 101.068 1.640 1.00 0.00 H ATOM 20903 H2 WAT 2806 123.023 100.358 2.730 1.00 0.00 H TER 20905 WAT 2806 ATOM 20905 O WAT 2807 64.099 123.378 0.511 1.00 0.00 O ATOM 20906 H1 WAT 2807 64.469 124.053 -0.059 1.00 0.00 H ATOM 20907 H2 WAT 2807 63.171 123.603 0.577 1.00 0.00 H TER 20909 WAT 2807 ATOM 20909 O WAT 2808 135.733 86.897 120.659 1.00 0.00 O ATOM 20910 H1 WAT 2808 135.171 86.570 121.361 1.00 0.00 H ATOM 20911 H2 WAT 2808 135.217 86.777 119.862 1.00 0.00 H TER 20913 WAT 2808 ATOM 20913 O WAT 2809 46.187 41.727 5.537 1.00 0.00 O ATOM 20914 H1 WAT 2809 46.192 40.803 5.787 1.00 0.00 H ATOM 20915 H2 WAT 2809 46.417 42.193 6.341 1.00 0.00 H TER 20917 WAT 2809 ATOM 20917 O WAT 2810 32.961 86.325 72.255 1.00 0.00 O ATOM 20918 H1 WAT 2810 33.743 86.575 72.747 1.00 0.00 H ATOM 20919 H2 WAT 2810 33.280 85.708 71.596 1.00 0.00 H TER 20921 WAT 2810 ATOM 20921 O WAT 2811 96.777 110.523 77.612 1.00 0.00 O ATOM 20922 H1 WAT 2811 97.226 109.770 77.994 1.00 0.00 H ATOM 20923 H2 WAT 2811 96.499 110.223 76.747 1.00 0.00 H TER 20925 WAT 2811 ATOM 20925 O WAT 2812 35.266 113.318 17.476 1.00 0.00 O ATOM 20926 H1 WAT 2812 34.314 113.332 17.373 1.00 0.00 H ATOM 20927 H2 WAT 2812 35.452 112.465 17.870 1.00 0.00 H TER 20929 WAT 2812 ATOM 20929 O WAT 2813 28.167 143.225 112.752 1.00 0.00 O ATOM 20930 H1 WAT 2813 27.218 143.349 112.759 1.00 0.00 H ATOM 20931 H2 WAT 2813 28.290 142.303 112.978 1.00 0.00 H TER 20933 WAT 2813 ATOM 20933 O WAT 2814 128.547 67.045 71.747 1.00 0.00 O ATOM 20934 H1 WAT 2814 128.751 66.183 72.109 1.00 0.00 H ATOM 20935 H2 WAT 2814 128.606 66.927 70.799 1.00 0.00 H TER 20937 WAT 2814 ATOM 20937 O WAT 2815 53.349 118.336 59.695 1.00 0.00 O ATOM 20938 H1 WAT 2815 52.812 117.695 60.160 1.00 0.00 H ATOM 20939 H2 WAT 2815 52.719 118.874 59.216 1.00 0.00 H TER 20941 WAT 2815 ATOM 20941 O WAT 2816 102.663 12.746 124.943 1.00 0.00 O ATOM 20942 H1 WAT 2816 103.535 12.358 124.874 1.00 0.00 H ATOM 20943 H2 WAT 2816 102.823 13.646 125.228 1.00 0.00 H TER 20945 WAT 2816 ATOM 20945 O WAT 2817 88.693 87.671 100.655 1.00 0.00 O ATOM 20946 H1 WAT 2817 88.104 88.416 100.535 1.00 0.00 H ATOM 20947 H2 WAT 2817 89.476 88.047 101.057 1.00 0.00 H TER 20949 WAT 2817 ATOM 20949 O WAT 2818 103.649 56.634 139.060 1.00 0.00 O ATOM 20950 H1 WAT 2818 102.973 57.276 139.278 1.00 0.00 H ATOM 20951 H2 WAT 2818 103.255 55.788 139.276 1.00 0.00 H TER 20953 WAT 2818 ATOM 20953 O WAT 2819 13.127 141.621 86.369 1.00 0.00 O ATOM 20954 H1 WAT 2819 13.445 142.196 87.065 1.00 0.00 H ATOM 20955 H2 WAT 2819 13.915 141.194 86.032 1.00 0.00 H TER 20957 WAT 2819 ATOM 20957 O WAT 2820 90.334 120.347 74.679 1.00 0.00 O ATOM 20958 H1 WAT 2820 89.852 119.521 74.678 1.00 0.00 H ATOM 20959 H2 WAT 2820 90.205 120.702 73.799 1.00 0.00 H TER 20961 WAT 2820 ATOM 20961 O WAT 2821 94.876 144.386 88.319 1.00 0.00 O ATOM 20962 H1 WAT 2821 95.587 144.256 88.946 1.00 0.00 H ATOM 20963 H2 WAT 2821 94.379 145.125 88.669 1.00 0.00 H TER 20965 WAT 2821 ATOM 20965 O WAT 2822 145.280 137.386 103.874 1.00 0.00 O ATOM 20966 H1 WAT 2822 145.234 137.365 102.918 1.00 0.00 H ATOM 20967 H2 WAT 2822 144.395 137.624 104.151 1.00 0.00 H TER 20969 WAT 2822 ATOM 20969 O WAT 2823 5.339 141.895 153.870 1.00 0.00 O ATOM 20970 H1 WAT 2823 4.406 141.820 153.670 1.00 0.00 H ATOM 20971 H2 WAT 2823 5.673 142.518 153.225 1.00 0.00 H TER 20973 WAT 2823 ATOM 20973 O WAT 2824 20.992 60.983 83.194 1.00 0.00 O ATOM 20974 H1 WAT 2824 20.822 60.172 83.674 1.00 0.00 H ATOM 20975 H2 WAT 2824 21.917 60.931 82.956 1.00 0.00 H TER 20977 WAT 2824 ATOM 20977 O WAT 2825 141.914 128.233 139.248 1.00 0.00 O ATOM 20978 H1 WAT 2825 141.481 129.005 139.612 1.00 0.00 H ATOM 20979 H2 WAT 2825 141.210 127.595 139.132 1.00 0.00 H TER 20981 WAT 2825 ATOM 20981 O WAT 2826 91.947 113.282 5.615 1.00 0.00 O ATOM 20982 H1 WAT 2826 91.673 114.152 5.325 1.00 0.00 H ATOM 20983 H2 WAT 2826 92.326 113.426 6.482 1.00 0.00 H TER 20985 WAT 2826 ATOM 20985 O WAT 2827 135.817 118.519 97.928 1.00 0.00 O ATOM 20986 H1 WAT 2827 136.157 117.691 98.269 1.00 0.00 H ATOM 20987 H2 WAT 2827 134.876 118.478 98.095 1.00 0.00 H TER 20989 WAT 2827 ATOM 20989 O WAT 2828 40.992 45.502 108.717 1.00 0.00 O ATOM 20990 H1 WAT 2828 40.117 45.557 109.103 1.00 0.00 H ATOM 20991 H2 WAT 2828 40.834 45.443 107.775 1.00 0.00 H TER 20993 WAT 2828 ATOM 20993 O WAT 2829 113.513 18.645 16.098 1.00 0.00 O ATOM 20994 H1 WAT 2829 113.268 18.597 17.022 1.00 0.00 H ATOM 20995 H2 WAT 2829 112.733 18.991 15.662 1.00 0.00 H TER 20997 WAT 2829 ATOM 20997 O WAT 2830 122.111 18.403 114.417 1.00 0.00 O ATOM 20998 H1 WAT 2830 121.287 18.881 114.327 1.00 0.00 H ATOM 20999 H2 WAT 2830 121.875 17.607 114.893 1.00 0.00 H TER 21001 WAT 2830 ATOM 21001 O WAT 2831 78.036 136.168 77.104 1.00 0.00 O ATOM 21002 H1 WAT 2831 77.448 135.479 77.414 1.00 0.00 H ATOM 21003 H2 WAT 2831 78.252 136.670 77.889 1.00 0.00 H TER 21005 WAT 2831 ATOM 21005 O WAT 2832 51.138 60.081 71.500 1.00 0.00 O ATOM 21006 H1 WAT 2832 51.671 59.613 70.857 1.00 0.00 H ATOM 21007 H2 WAT 2832 50.754 59.390 72.041 1.00 0.00 H TER 21009 WAT 2832 ATOM 21009 O WAT 2833 92.891 115.662 91.011 1.00 0.00 O ATOM 21010 H1 WAT 2833 93.510 115.417 91.700 1.00 0.00 H ATOM 21011 H2 WAT 2833 93.234 115.243 90.222 1.00 0.00 H TER 21013 WAT 2833 ATOM 21013 O WAT 2834 78.151 35.189 9.060 1.00 0.00 O ATOM 21014 H1 WAT 2834 77.789 34.825 9.867 1.00 0.00 H ATOM 21015 H2 WAT 2834 77.438 35.709 8.690 1.00 0.00 H TER 21017 WAT 2834 ATOM 21017 O WAT 2835 127.852 58.849 77.617 1.00 0.00 O ATOM 21018 H1 WAT 2835 127.281 58.102 77.795 1.00 0.00 H ATOM 21019 H2 WAT 2835 127.310 59.447 77.102 1.00 0.00 H TER 21021 WAT 2835 ATOM 21021 O WAT 2836 128.427 33.342 107.588 1.00 0.00 O ATOM 21022 H1 WAT 2836 128.958 32.558 107.447 1.00 0.00 H ATOM 21023 H2 WAT 2836 127.538 33.010 107.712 1.00 0.00 H TER 21025 WAT 2836 ATOM 21025 O WAT 2837 14.199 23.300 75.297 1.00 0.00 O ATOM 21026 H1 WAT 2837 14.276 23.241 76.249 1.00 0.00 H ATOM 21027 H2 WAT 2837 13.464 22.727 75.080 1.00 0.00 H TER 21029 WAT 2837 ATOM 21029 O WAT 2838 27.894 106.866 57.905 1.00 0.00 O ATOM 21030 H1 WAT 2838 28.292 107.590 57.421 1.00 0.00 H ATOM 21031 H2 WAT 2838 27.438 107.288 58.634 1.00 0.00 H TER 21033 WAT 2838 ATOM 21033 O WAT 2839 24.652 44.094 15.877 1.00 0.00 O ATOM 21034 H1 WAT 2839 24.684 44.200 14.926 1.00 0.00 H ATOM 21035 H2 WAT 2839 23.747 44.299 16.111 1.00 0.00 H TER 21037 WAT 2839 ATOM 21037 O WAT 2840 27.550 128.626 5.889 1.00 0.00 O ATOM 21038 H1 WAT 2840 27.123 128.184 5.155 1.00 0.00 H ATOM 21039 H2 WAT 2840 28.471 128.376 5.816 1.00 0.00 H TER 21041 WAT 2840 ATOM 21041 O WAT 2841 98.051 127.134 11.374 1.00 0.00 O ATOM 21042 H1 WAT 2841 97.184 126.874 11.683 1.00 0.00 H ATOM 21043 H2 WAT 2841 97.883 127.609 10.560 1.00 0.00 H TER 21045 WAT 2841 ATOM 21045 O WAT 2842 29.543 58.980 58.354 1.00 0.00 O ATOM 21046 H1 WAT 2842 30.372 58.976 57.874 1.00 0.00 H ATOM 21047 H2 WAT 2842 29.632 59.698 58.980 1.00 0.00 H TER 21049 WAT 2842 ATOM 21049 O WAT 2843 15.120 61.459 129.901 1.00 0.00 O ATOM 21050 H1 WAT 2843 15.464 61.953 130.645 1.00 0.00 H ATOM 21051 H2 WAT 2843 14.551 60.797 130.296 1.00 0.00 H TER 21053 WAT 2843 ATOM 21053 O WAT 2844 43.861 3.376 113.232 1.00 0.00 O ATOM 21054 H1 WAT 2844 44.450 3.947 112.739 1.00 0.00 H ATOM 21055 H2 WAT 2844 43.995 2.507 112.852 1.00 0.00 H TER 21057 WAT 2844 ATOM 21057 O WAT 2845 126.876 107.488 97.818 1.00 0.00 O ATOM 21058 H1 WAT 2845 127.292 106.934 98.478 1.00 0.00 H ATOM 21059 H2 WAT 2845 127.084 107.065 96.984 1.00 0.00 H TER 21061 WAT 2845 ATOM 21061 O WAT 2846 47.099 93.839 144.415 1.00 0.00 O ATOM 21062 H1 WAT 2846 47.574 94.373 145.050 1.00 0.00 H ATOM 21063 H2 WAT 2846 46.749 94.469 143.785 1.00 0.00 H TER 21065 WAT 2846 ATOM 21065 O WAT 2847 109.790 35.576 85.167 1.00 0.00 O ATOM 21066 H1 WAT 2847 110.076 36.392 85.578 1.00 0.00 H ATOM 21067 H2 WAT 2847 110.158 35.611 84.284 1.00 0.00 H TER 21069 WAT 2847 ATOM 21069 O WAT 2848 0.064 136.740 107.373 1.00 0.00 O ATOM 21070 H1 WAT 2848 0.093 135.886 106.943 1.00 0.00 H ATOM 21071 H2 WAT 2848 0.974 136.919 107.612 1.00 0.00 H TER 21073 WAT 2848 ATOM 21073 O WAT 2849 28.796 19.988 157.257 1.00 0.00 O ATOM 21074 H1 WAT 2849 27.870 20.203 157.145 1.00 0.00 H ATOM 21075 H2 WAT 2849 29.242 20.482 156.569 1.00 0.00 H TER 21077 WAT 2849 ATOM 21077 O WAT 2850 111.224 9.306 147.993 1.00 0.00 O ATOM 21078 H1 WAT 2850 111.510 9.199 148.900 1.00 0.00 H ATOM 21079 H2 WAT 2850 111.770 8.696 147.496 1.00 0.00 H TER 21081 WAT 2850 ATOM 21081 O WAT 2851 62.777 22.685 25.919 1.00 0.00 O ATOM 21082 H1 WAT 2851 62.109 22.318 25.341 1.00 0.00 H ATOM 21083 H2 WAT 2851 62.713 22.165 26.720 1.00 0.00 H TER 21085 WAT 2851 ATOM 21085 O WAT 2852 129.495 104.434 147.080 1.00 0.00 O ATOM 21086 H1 WAT 2852 129.111 104.322 147.949 1.00 0.00 H ATOM 21087 H2 WAT 2852 129.712 105.365 147.032 1.00 0.00 H TER 21089 WAT 2852 ATOM 21089 O WAT 2853 16.416 61.564 13.529 1.00 0.00 O ATOM 21090 H1 WAT 2853 16.699 62.479 13.533 1.00 0.00 H ATOM 21091 H2 WAT 2853 16.598 61.261 12.640 1.00 0.00 H TER 21093 WAT 2853 ATOM 21093 O WAT 2854 104.651 19.742 124.814 1.00 0.00 O ATOM 21094 H1 WAT 2854 105.428 19.463 124.330 1.00 0.00 H ATOM 21095 H2 WAT 2854 104.861 19.560 125.730 1.00 0.00 H TER 21097 WAT 2854 ATOM 21097 O WAT 2855 118.004 117.855 1.325 1.00 0.00 O ATOM 21098 H1 WAT 2855 117.404 118.108 0.623 1.00 0.00 H ATOM 21099 H2 WAT 2855 117.662 117.019 1.643 1.00 0.00 H TER 21101 WAT 2855 ATOM 21101 O WAT 2856 67.229 31.484 88.236 1.00 0.00 O ATOM 21102 H1 WAT 2856 67.224 32.432 88.107 1.00 0.00 H ATOM 21103 H2 WAT 2856 68.054 31.194 87.848 1.00 0.00 H TER 21105 WAT 2856 ATOM 21105 O WAT 2857 17.080 129.445 102.925 1.00 0.00 O ATOM 21106 H1 WAT 2857 16.521 130.220 102.890 1.00 0.00 H ATOM 21107 H2 WAT 2857 16.510 128.725 102.654 1.00 0.00 H TER 21109 WAT 2857 ATOM 21109 O WAT 2858 11.074 69.753 156.223 1.00 0.00 O ATOM 21110 H1 WAT 2858 10.867 69.378 155.367 1.00 0.00 H ATOM 21111 H2 WAT 2858 12.005 69.568 156.347 1.00 0.00 H TER 21113 WAT 2858 ATOM 21113 O WAT 2859 107.989 13.695 133.604 1.00 0.00 O ATOM 21114 H1 WAT 2859 108.373 14.400 133.083 1.00 0.00 H ATOM 21115 H2 WAT 2859 108.741 13.251 133.998 1.00 0.00 H TER 21117 WAT 2859 ATOM 21117 O WAT 2860 41.710 45.677 79.008 1.00 0.00 O ATOM 21118 H1 WAT 2860 42.454 45.098 79.176 1.00 0.00 H ATOM 21119 H2 WAT 2860 41.513 45.549 78.080 1.00 0.00 H TER 21121 WAT 2860 ATOM 21121 O WAT 2861 124.735 118.460 14.649 1.00 0.00 O ATOM 21122 H1 WAT 2861 125.295 119.187 14.920 1.00 0.00 H ATOM 21123 H2 WAT 2861 124.966 117.745 15.241 1.00 0.00 H TER 21125 WAT 2861 ATOM 21125 O WAT 2862 72.608 39.822 86.554 1.00 0.00 O ATOM 21126 H1 WAT 2862 72.804 40.502 85.908 1.00 0.00 H ATOM 21127 H2 WAT 2862 73.414 39.737 87.063 1.00 0.00 H TER 21129 WAT 2862 ATOM 21129 O WAT 2863 110.297 48.387 9.813 1.00 0.00 O ATOM 21130 H1 WAT 2863 109.660 48.767 9.207 1.00 0.00 H ATOM 21131 H2 WAT 2863 110.994 49.040 9.869 1.00 0.00 H TER 21133 WAT 2863 ATOM 21133 O WAT 2864 143.016 144.114 120.304 1.00 0.00 O ATOM 21134 H1 WAT 2864 142.625 144.933 120.607 1.00 0.00 H ATOM 21135 H2 WAT 2864 143.903 144.124 120.664 1.00 0.00 H TER 21137 WAT 2864 ATOM 21137 O WAT 2865 84.062 18.421 119.720 1.00 0.00 O ATOM 21138 H1 WAT 2865 83.542 18.470 120.523 1.00 0.00 H ATOM 21139 H2 WAT 2865 84.038 17.496 119.476 1.00 0.00 H TER 21141 WAT 2865 ATOM 21141 O WAT 2866 22.487 46.983 153.177 1.00 0.00 O ATOM 21142 H1 WAT 2866 22.078 47.737 153.602 1.00 0.00 H ATOM 21143 H2 WAT 2866 21.905 46.776 152.445 1.00 0.00 H TER 21145 WAT 2866 ATOM 21145 O WAT 2867 135.804 105.512 128.291 1.00 0.00 O ATOM 21146 H1 WAT 2867 135.842 106.450 128.479 1.00 0.00 H ATOM 21147 H2 WAT 2867 136.145 105.095 129.082 1.00 0.00 H TER 21149 WAT 2867 ATOM 21149 O WAT 2868 114.074 132.771 5.651 1.00 0.00 O ATOM 21150 H1 WAT 2868 114.400 132.092 5.060 1.00 0.00 H ATOM 21151 H2 WAT 2868 114.443 132.543 6.504 1.00 0.00 H TER 21153 WAT 2868 ATOM 21153 O WAT 2869 139.948 65.646 80.765 1.00 0.00 O ATOM 21154 H1 WAT 2869 140.782 65.800 81.210 1.00 0.00 H ATOM 21155 H2 WAT 2869 140.192 65.428 79.866 1.00 0.00 H TER 21157 WAT 2869 ATOM 21157 O WAT 2870 117.137 50.762 135.559 1.00 0.00 O ATOM 21158 H1 WAT 2870 117.026 51.279 136.357 1.00 0.00 H ATOM 21159 H2 WAT 2870 117.422 51.396 134.901 1.00 0.00 H TER 21161 WAT 2870 ATOM 21161 O WAT 2871 83.773 79.247 117.720 1.00 0.00 O ATOM 21162 H1 WAT 2871 84.196 78.475 118.096 1.00 0.00 H ATOM 21163 H2 WAT 2871 83.121 79.504 118.372 1.00 0.00 H TER 21165 WAT 2871 ATOM 21165 O WAT 2872 121.998 53.165 70.988 1.00 0.00 O ATOM 21166 H1 WAT 2872 122.113 53.054 71.932 1.00 0.00 H ATOM 21167 H2 WAT 2872 122.088 52.281 70.631 1.00 0.00 H TER 21169 WAT 2872 ATOM 21169 O WAT 2873 114.171 57.503 157.862 1.00 0.00 O ATOM 21170 H1 WAT 2873 113.472 57.663 157.228 1.00 0.00 H ATOM 21171 H2 WAT 2873 114.150 58.267 158.438 1.00 0.00 H TER 21173 WAT 2873 ATOM 21173 O WAT 2874 56.412 82.284 107.941 1.00 0.00 O ATOM 21174 H1 WAT 2874 55.552 82.041 107.596 1.00 0.00 H ATOM 21175 H2 WAT 2874 56.308 83.191 108.227 1.00 0.00 H TER 21177 WAT 2874 ATOM 21177 O WAT 2875 118.571 17.900 124.903 1.00 0.00 O ATOM 21178 H1 WAT 2875 118.690 17.284 124.180 1.00 0.00 H ATOM 21179 H2 WAT 2875 118.350 18.729 124.479 1.00 0.00 H TER 21181 WAT 2875 ATOM 21181 O WAT 2876 66.555 144.874 147.566 1.00 0.00 O ATOM 21182 H1 WAT 2876 66.204 144.173 148.115 1.00 0.00 H ATOM 21183 H2 WAT 2876 66.065 144.806 146.747 1.00 0.00 H TER 21185 WAT 2876 ATOM 21185 O WAT 2877 50.228 43.106 16.798 1.00 0.00 O ATOM 21186 H1 WAT 2877 50.015 42.175 16.742 1.00 0.00 H ATOM 21187 H2 WAT 2877 49.889 43.478 15.984 1.00 0.00 H TER 21189 WAT 2877 ATOM 21189 O WAT 2878 132.366 55.060 67.174 1.00 0.00 O ATOM 21190 H1 WAT 2878 132.110 54.300 67.697 1.00 0.00 H ATOM 21191 H2 WAT 2878 133.307 54.952 67.039 1.00 0.00 H TER 21193 WAT 2878 ATOM 21193 O WAT 2879 15.638 110.044 138.069 1.00 0.00 O ATOM 21194 H1 WAT 2879 14.748 109.868 138.376 1.00 0.00 H ATOM 21195 H2 WAT 2879 15.682 110.998 138.001 1.00 0.00 H TER 21197 WAT 2879 ATOM 21197 O WAT 2880 82.640 73.615 4.478 1.00 0.00 O ATOM 21198 H1 WAT 2880 82.251 74.472 4.649 1.00 0.00 H ATOM 21199 H2 WAT 2880 83.567 73.727 4.685 1.00 0.00 H TER 21201 WAT 2880 ATOM 21201 O WAT 2881 132.211 41.609 67.720 1.00 0.00 O ATOM 21202 H1 WAT 2881 132.143 40.662 67.844 1.00 0.00 H ATOM 21203 H2 WAT 2881 131.948 41.980 68.562 1.00 0.00 H TER 21205 WAT 2881 ATOM 21205 O WAT 2882 37.088 109.937 77.163 1.00 0.00 O ATOM 21206 H1 WAT 2882 36.944 110.763 76.700 1.00 0.00 H ATOM 21207 H2 WAT 2882 36.208 109.597 77.325 1.00 0.00 H TER 21209 WAT 2882 ATOM 21209 O WAT 2883 104.042 44.839 102.166 1.00 0.00 O ATOM 21210 H1 WAT 2883 103.437 44.126 102.369 1.00 0.00 H ATOM 21211 H2 WAT 2883 103.819 45.096 101.271 1.00 0.00 H TER 21213 WAT 2883 ATOM 21213 O WAT 2884 35.465 16.319 9.558 1.00 0.00 O ATOM 21214 H1 WAT 2884 35.742 16.600 10.430 1.00 0.00 H ATOM 21215 H2 WAT 2884 35.602 17.087 9.004 1.00 0.00 H TER 21217 WAT 2884 ATOM 21217 O WAT 2885 74.817 38.546 154.702 1.00 0.00 O ATOM 21218 H1 WAT 2885 74.875 38.689 153.757 1.00 0.00 H ATOM 21219 H2 WAT 2885 75.317 37.745 154.855 1.00 0.00 H TER 21221 WAT 2885 ATOM 21221 O WAT 2886 145.558 80.348 12.201 1.00 0.00 O ATOM 21222 H1 WAT 2886 144.684 80.453 12.578 1.00 0.00 H ATOM 21223 H2 WAT 2886 145.401 80.195 11.270 1.00 0.00 H TER 21225 WAT 2886 ATOM 21225 O WAT 2887 36.544 72.041 120.905 1.00 0.00 O ATOM 21226 H1 WAT 2887 35.721 72.519 121.011 1.00 0.00 H ATOM 21227 H2 WAT 2887 36.468 71.619 120.050 1.00 0.00 H TER 21229 WAT 2887 ATOM 21229 O WAT 2888 106.168 19.407 67.323 1.00 0.00 O ATOM 21230 H1 WAT 2888 106.055 18.470 67.164 1.00 0.00 H ATOM 21231 H2 WAT 2888 106.180 19.799 66.450 1.00 0.00 H TER 21233 WAT 2888 ATOM 21233 O WAT 2889 56.360 14.385 72.403 1.00 0.00 O ATOM 21234 H1 WAT 2889 57.097 13.787 72.526 1.00 0.00 H ATOM 21235 H2 WAT 2889 56.731 15.127 71.926 1.00 0.00 H TER 21237 WAT 2889 ATOM 21237 O WAT 2890 10.952 9.806 19.718 1.00 0.00 O ATOM 21238 H1 WAT 2890 11.520 10.294 20.314 1.00 0.00 H ATOM 21239 H2 WAT 2890 10.986 8.905 20.040 1.00 0.00 H TER 21241 WAT 2890 ATOM 21241 O WAT 2891 127.926 20.103 107.055 1.00 0.00 O ATOM 21242 H1 WAT 2891 127.772 21.012 106.796 1.00 0.00 H ATOM 21243 H2 WAT 2891 128.750 19.870 106.628 1.00 0.00 H TER 21245 WAT 2891 ATOM 21245 O WAT 2892 121.702 83.026 154.772 1.00 0.00 O ATOM 21246 H1 WAT 2892 122.415 82.562 154.332 1.00 0.00 H ATOM 21247 H2 WAT 2892 121.816 82.816 155.698 1.00 0.00 H TER 21249 WAT 2892 ATOM 21249 O WAT 2893 88.876 96.247 152.481 1.00 0.00 O ATOM 21250 H1 WAT 2893 88.180 95.590 152.510 1.00 0.00 H ATOM 21251 H2 WAT 2893 89.140 96.276 151.561 1.00 0.00 H TER 21253 WAT 2893 ATOM 21253 O WAT 2894 130.331 127.337 82.636 1.00 0.00 O ATOM 21254 H1 WAT 2894 130.335 128.196 83.058 1.00 0.00 H ATOM 21255 H2 WAT 2894 130.747 126.755 83.272 1.00 0.00 H TER 21257 WAT 2894 ATOM 21257 O WAT 2895 139.009 96.540 139.573 1.00 0.00 O ATOM 21258 H1 WAT 2895 139.033 96.865 140.473 1.00 0.00 H ATOM 21259 H2 WAT 2895 138.091 96.621 139.314 1.00 0.00 H TER 21261 WAT 2895 ATOM 21261 O WAT 2896 137.969 135.254 11.320 1.00 0.00 O ATOM 21262 H1 WAT 2896 137.166 135.201 11.839 1.00 0.00 H ATOM 21263 H2 WAT 2896 137.664 135.368 10.419 1.00 0.00 H TER 21265 WAT 2896 ATOM 21265 O WAT 2897 40.905 9.149 108.632 1.00 0.00 O ATOM 21266 H1 WAT 2897 41.567 8.553 108.283 1.00 0.00 H ATOM 21267 H2 WAT 2897 40.070 8.733 108.417 1.00 0.00 H TER 21269 WAT 2897 ATOM 21269 O WAT 2898 33.290 9.676 67.046 1.00 0.00 O ATOM 21270 H1 WAT 2898 34.064 9.385 66.562 1.00 0.00 H ATOM 21271 H2 WAT 2898 32.583 9.656 66.401 1.00 0.00 H TER 21273 WAT 2898 ATOM 21273 O WAT 2899 83.069 36.026 17.190 1.00 0.00 O ATOM 21274 H1 WAT 2899 83.916 36.470 17.157 1.00 0.00 H ATOM 21275 H2 WAT 2899 82.990 35.729 18.097 1.00 0.00 H TER 21277 WAT 2899 ATOM 21277 O WAT 2900 85.960 77.346 156.548 1.00 0.00 O ATOM 21278 H1 WAT 2900 85.073 76.990 156.492 1.00 0.00 H ATOM 21279 H2 WAT 2900 86.193 77.552 155.643 1.00 0.00 H TER 21281 WAT 2900 ATOM 21281 O WAT 2901 39.962 18.545 122.327 1.00 0.00 O ATOM 21282 H1 WAT 2901 40.210 18.529 123.252 1.00 0.00 H ATOM 21283 H2 WAT 2901 39.041 18.806 122.330 1.00 0.00 H TER 21285 WAT 2901 ATOM 21285 O WAT 2902 127.428 66.401 87.580 1.00 0.00 O ATOM 21286 H1 WAT 2902 126.683 66.917 87.271 1.00 0.00 H ATOM 21287 H2 WAT 2902 128.082 67.053 87.835 1.00 0.00 H TER 21289 WAT 2902 ATOM 21289 O WAT 2903 15.013 20.895 105.346 1.00 0.00 O ATOM 21290 H1 WAT 2903 15.951 21.073 105.423 1.00 0.00 H ATOM 21291 H2 WAT 2903 14.956 19.942 105.270 1.00 0.00 H TER 21293 WAT 2903 ATOM 21293 O WAT 2904 48.613 72.691 111.766 1.00 0.00 O ATOM 21294 H1 WAT 2904 47.916 72.222 112.224 1.00 0.00 H ATOM 21295 H2 WAT 2904 49.221 72.952 112.458 1.00 0.00 H TER 21297 WAT 2904 ATOM 21297 O WAT 2905 54.647 135.125 137.521 1.00 0.00 O ATOM 21298 H1 WAT 2905 53.898 134.609 137.820 1.00 0.00 H ATOM 21299 H2 WAT 2905 54.987 134.640 136.769 1.00 0.00 H TER 21301 WAT 2905 ATOM 21301 O WAT 2906 49.458 4.422 9.701 1.00 0.00 O ATOM 21302 H1 WAT 2906 48.549 4.228 9.473 1.00 0.00 H ATOM 21303 H2 WAT 2906 49.402 5.177 10.288 1.00 0.00 H TER 21305 WAT 2906 ATOM 21305 O WAT 2907 27.998 47.062 59.798 1.00 0.00 O ATOM 21306 H1 WAT 2907 27.587 46.484 59.155 1.00 0.00 H ATOM 21307 H2 WAT 2907 28.701 46.535 60.178 1.00 0.00 H TER 21309 WAT 2907 ATOM 21309 O WAT 2908 111.935 10.523 156.652 1.00 0.00 O ATOM 21310 H1 WAT 2908 112.520 11.170 157.044 1.00 0.00 H ATOM 21311 H2 WAT 2908 112.453 9.719 156.621 1.00 0.00 H TER 21313 WAT 2908 ATOM 21313 O WAT 2909 73.221 43.601 149.850 1.00 0.00 O ATOM 21314 H1 WAT 2909 72.471 43.082 150.142 1.00 0.00 H ATOM 21315 H2 WAT 2909 73.984 43.074 150.088 1.00 0.00 H TER 21317 WAT 2909 ATOM 21317 O WAT 2910 36.444 3.310 95.823 1.00 0.00 O ATOM 21318 H1 WAT 2910 37.255 3.101 95.359 1.00 0.00 H ATOM 21319 H2 WAT 2910 36.664 4.073 96.357 1.00 0.00 H TER 21321 WAT 2910 ATOM 21321 O WAT 2911 121.472 111.069 152.009 1.00 0.00 O ATOM 21322 H1 WAT 2911 122.182 111.701 152.123 1.00 0.00 H ATOM 21323 H2 WAT 2911 121.537 110.495 152.772 1.00 0.00 H TER 21325 WAT 2911 ATOM 21325 O WAT 2912 125.523 128.913 16.410 1.00 0.00 O ATOM 21326 H1 WAT 2912 125.834 128.734 17.298 1.00 0.00 H ATOM 21327 H2 WAT 2912 126.264 128.689 15.847 1.00 0.00 H TER 21329 WAT 2912 ATOM 21329 O WAT 2913 82.446 76.949 137.149 1.00 0.00 O ATOM 21330 H1 WAT 2913 82.664 76.079 136.813 1.00 0.00 H ATOM 21331 H2 WAT 2913 81.682 77.218 136.638 1.00 0.00 H TER 21333 WAT 2913 ATOM 21333 O WAT 2914 136.656 87.274 109.079 1.00 0.00 O ATOM 21334 H1 WAT 2914 137.540 87.291 109.446 1.00 0.00 H ATOM 21335 H2 WAT 2914 136.762 87.597 108.184 1.00 0.00 H TER 21337 WAT 2914 ATOM 21337 O WAT 2915 68.963 25.646 103.001 1.00 0.00 O ATOM 21338 H1 WAT 2915 69.382 24.811 103.208 1.00 0.00 H ATOM 21339 H2 WAT 2915 69.491 26.299 103.462 1.00 0.00 H TER 21341 WAT 2915 ATOM 21341 O WAT 2916 15.652 105.886 59.150 1.00 0.00 O ATOM 21342 H1 WAT 2916 16.066 106.227 59.942 1.00 0.00 H ATOM 21343 H2 WAT 2916 15.960 106.463 58.451 1.00 0.00 H TER 21345 WAT 2916 ATOM 21345 O WAT 2917 0.326 55.033 126.076 1.00 0.00 O ATOM 21346 H1 WAT 2917 -0.095 55.226 126.913 1.00 0.00 H ATOM 21347 H2 WAT 2917 1.264 55.102 126.258 1.00 0.00 H TER 21349 WAT 2917 ATOM 21349 O WAT 2918 15.131 56.187 128.247 1.00 0.00 O ATOM 21350 H1 WAT 2918 14.679 56.282 129.085 1.00 0.00 H ATOM 21351 H2 WAT 2918 14.567 55.607 127.735 1.00 0.00 H TER 21353 WAT 2918 ATOM 21353 O WAT 2919 4.905 125.686 150.913 1.00 0.00 O ATOM 21354 H1 WAT 2919 4.946 126.418 151.529 1.00 0.00 H ATOM 21355 H2 WAT 2919 3.973 125.590 150.717 1.00 0.00 H TER 21357 WAT 2919 ATOM 21357 O WAT 2920 53.562 139.683 115.760 1.00 0.00 O ATOM 21358 H1 WAT 2920 52.981 140.391 115.483 1.00 0.00 H ATOM 21359 H2 WAT 2920 53.512 139.692 116.716 1.00 0.00 H TER 21361 WAT 2920 ATOM 21361 O WAT 2921 84.818 7.086 148.165 1.00 0.00 O ATOM 21362 H1 WAT 2921 85.509 7.717 148.364 1.00 0.00 H ATOM 21363 H2 WAT 2921 84.056 7.624 147.953 1.00 0.00 H TER 21365 WAT 2921 ATOM 21365 O WAT 2922 30.076 42.340 95.044 1.00 0.00 O ATOM 21366 H1 WAT 2922 30.706 43.027 95.262 1.00 0.00 H ATOM 21367 H2 WAT 2922 29.934 42.436 94.102 1.00 0.00 H TER 21369 WAT 2922 ATOM 21369 O WAT 2923 138.253 76.395 149.898 1.00 0.00 O ATOM 21370 H1 WAT 2923 138.726 76.781 149.160 1.00 0.00 H ATOM 21371 H2 WAT 2923 138.565 76.881 150.662 1.00 0.00 H TER 21373 WAT 2923 ATOM 21373 O WAT 2924 0.718 81.978 7.466 1.00 0.00 O ATOM 21374 H1 WAT 2924 1.494 82.537 7.511 1.00 0.00 H ATOM 21375 H2 WAT 2924 0.767 81.570 6.602 1.00 0.00 H TER 21377 WAT 2924 ATOM 21377 O WAT 2925 3.941 48.580 95.668 1.00 0.00 O ATOM 21378 H1 WAT 2925 4.153 48.559 96.601 1.00 0.00 H ATOM 21379 H2 WAT 2925 4.354 49.381 95.346 1.00 0.00 H TER 21381 WAT 2925 ATOM 21381 O WAT 2926 35.999 44.862 73.609 1.00 0.00 O ATOM 21382 H1 WAT 2926 35.271 44.380 73.216 1.00 0.00 H ATOM 21383 H2 WAT 2926 36.213 44.369 74.401 1.00 0.00 H TER 21385 WAT 2926 ATOM 21385 O WAT 2927 37.314 2.529 155.899 1.00 0.00 O ATOM 21386 H1 WAT 2927 37.240 3.422 156.234 1.00 0.00 H ATOM 21387 H2 WAT 2927 38.230 2.293 156.043 1.00 0.00 H TER 21389 WAT 2927 ATOM 21389 O WAT 2928 144.507 38.218 121.214 1.00 0.00 O ATOM 21390 H1 WAT 2928 144.766 38.675 120.414 1.00 0.00 H ATOM 21391 H2 WAT 2928 143.573 38.404 121.304 1.00 0.00 H TER 21393 WAT 2928 ATOM 21393 O WAT 2929 142.998 11.679 74.752 1.00 0.00 O ATOM 21394 H1 WAT 2929 143.594 12.391 74.986 1.00 0.00 H ATOM 21395 H2 WAT 2929 142.817 11.237 75.582 1.00 0.00 H TER 21397 WAT 2929 ATOM 21397 O WAT 2930 32.214 69.707 110.966 1.00 0.00 O ATOM 21398 H1 WAT 2930 31.848 69.910 110.105 1.00 0.00 H ATOM 21399 H2 WAT 2930 32.270 68.751 110.983 1.00 0.00 H TER 21401 WAT 2930 ATOM 21401 O WAT 2931 8.980 34.171 87.314 1.00 0.00 O ATOM 21402 H1 WAT 2931 8.089 33.899 87.538 1.00 0.00 H ATOM 21403 H2 WAT 2931 8.884 35.070 87.001 1.00 0.00 H TER 21405 WAT 2931 ATOM 21405 O WAT 2932 89.779 85.405 138.793 1.00 0.00 O ATOM 21406 H1 WAT 2932 89.570 84.577 139.225 1.00 0.00 H ATOM 21407 H2 WAT 2932 89.614 85.240 137.865 1.00 0.00 H TER 21409 WAT 2932 ATOM 21409 O WAT 2933 44.186 64.018 122.645 1.00 0.00 O ATOM 21410 H1 WAT 2933 44.392 64.044 121.710 1.00 0.00 H ATOM 21411 H2 WAT 2933 44.360 63.113 122.903 1.00 0.00 H TER 21413 WAT 2933 ATOM 21413 O WAT 2934 145.709 111.326 15.721 1.00 0.00 O ATOM 21414 H1 WAT 2934 145.087 110.932 16.333 1.00 0.00 H ATOM 21415 H2 WAT 2934 146.501 110.796 15.811 1.00 0.00 H TER 21417 WAT 2934 ATOM 21417 O WAT 2935 36.168 103.822 11.160 1.00 0.00 O ATOM 21418 H1 WAT 2935 36.728 103.392 11.807 1.00 0.00 H ATOM 21419 H2 WAT 2935 36.119 103.199 10.435 1.00 0.00 H TER 21421 WAT 2935 ATOM 21421 O WAT 2936 126.473 64.069 100.177 1.00 0.00 O ATOM 21422 H1 WAT 2936 127.028 63.602 100.802 1.00 0.00 H ATOM 21423 H2 WAT 2936 127.086 64.579 99.648 1.00 0.00 H TER 21425 WAT 2936 ATOM 21425 O WAT 2937 3.457 135.667 80.091 1.00 0.00 O ATOM 21426 H1 WAT 2937 2.746 136.286 79.923 1.00 0.00 H ATOM 21427 H2 WAT 2937 3.364 135.004 79.407 1.00 0.00 H TER 21429 WAT 2937 ATOM 21429 O WAT 2938 100.916 33.250 153.556 1.00 0.00 O ATOM 21430 H1 WAT 2938 101.313 32.640 154.177 1.00 0.00 H ATOM 21431 H2 WAT 2938 100.648 32.702 152.819 1.00 0.00 H TER 21433 WAT 2938 ATOM 21433 O WAT 2939 69.991 79.135 60.835 1.00 0.00 O ATOM 21434 H1 WAT 2939 69.954 78.377 61.419 1.00 0.00 H ATOM 21435 H2 WAT 2939 70.807 79.577 61.069 1.00 0.00 H TER 21437 WAT 2939 ATOM 21437 O WAT 2940 86.202 96.732 10.302 1.00 0.00 O ATOM 21438 H1 WAT 2940 85.382 96.651 9.814 1.00 0.00 H ATOM 21439 H2 WAT 2940 86.044 97.447 10.919 1.00 0.00 H TER 21441 WAT 2940 ATOM 21441 O WAT 2941 60.385 0.401 83.249 1.00 0.00 O ATOM 21442 H1 WAT 2941 59.661 -0.033 82.799 1.00 0.00 H ATOM 21443 H2 WAT 2941 60.237 0.214 84.176 1.00 0.00 H TER 21445 WAT 2941 ATOM 21445 O WAT 2942 143.767 37.672 58.190 1.00 0.00 O ATOM 21446 H1 WAT 2942 143.103 38.348 58.325 1.00 0.00 H ATOM 21447 H2 WAT 2942 143.964 37.715 57.254 1.00 0.00 H TER 21449 WAT 2942 ATOM 21449 O WAT 2943 20.212 132.142 93.460 1.00 0.00 O ATOM 21450 H1 WAT 2943 19.729 131.316 93.451 1.00 0.00 H ATOM 21451 H2 WAT 2943 19.617 132.772 93.054 1.00 0.00 H TER 21453 WAT 2943 ATOM 21453 O WAT 2944 62.568 144.999 124.868 1.00 0.00 O ATOM 21454 H1 WAT 2944 61.967 144.798 124.150 1.00 0.00 H ATOM 21455 H2 WAT 2944 62.036 144.907 125.658 1.00 0.00 H TER 21457 WAT 2944 ATOM 21457 O WAT 2945 25.596 140.741 140.402 1.00 0.00 O ATOM 21458 H1 WAT 2945 25.517 140.579 139.462 1.00 0.00 H ATOM 21459 H2 WAT 2945 25.336 139.914 140.810 1.00 0.00 H TER 21461 WAT 2945 ATOM 21461 O WAT 2946 51.296 96.290 145.703 1.00 0.00 O ATOM 21462 H1 WAT 2946 50.968 97.189 145.720 1.00 0.00 H ATOM 21463 H2 WAT 2946 50.570 95.765 146.042 1.00 0.00 H TER 21465 WAT 2946 ATOM 21465 O WAT 2947 39.648 3.456 91.168 1.00 0.00 O ATOM 21466 H1 WAT 2947 39.072 3.023 90.538 1.00 0.00 H ATOM 21467 H2 WAT 2947 40.010 2.741 91.692 1.00 0.00 H TER 21469 WAT 2947 ATOM 21469 O WAT 2948 122.217 43.818 129.299 1.00 0.00 O ATOM 21470 H1 WAT 2948 122.112 43.428 130.166 1.00 0.00 H ATOM 21471 H2 WAT 2948 122.744 43.185 128.813 1.00 0.00 H TER 21473 WAT 2948 ATOM 21473 O WAT 2949 117.534 80.658 121.332 1.00 0.00 O ATOM 21474 H1 WAT 2949 116.741 80.168 121.548 1.00 0.00 H ATOM 21475 H2 WAT 2949 117.219 81.426 120.855 1.00 0.00 H TER 21477 WAT 2949 ATOM 21477 O WAT 2950 58.285 60.140 144.425 1.00 0.00 O ATOM 21478 H1 WAT 2950 58.697 60.876 143.973 1.00 0.00 H ATOM 21479 H2 WAT 2950 58.202 59.463 143.753 1.00 0.00 H TER 21481 WAT 2950 ATOM 21481 O WAT 2951 24.758 6.684 1.529 1.00 0.00 O ATOM 21482 H1 WAT 2951 24.475 6.805 0.622 1.00 0.00 H ATOM 21483 H2 WAT 2951 24.547 7.512 1.958 1.00 0.00 H TER 21485 WAT 2951 ATOM 21485 O WAT 2952 110.030 87.942 54.330 1.00 0.00 O ATOM 21486 H1 WAT 2952 109.462 87.947 55.100 1.00 0.00 H ATOM 21487 H2 WAT 2952 110.873 88.264 54.651 1.00 0.00 H TER 21489 WAT 2952 ATOM 21489 O WAT 2953 6.348 10.177 101.716 1.00 0.00 O ATOM 21490 H1 WAT 2953 6.985 10.076 101.008 1.00 0.00 H ATOM 21491 H2 WAT 2953 6.682 9.621 102.420 1.00 0.00 H TER 21493 WAT 2953 ATOM 21493 O WAT 2954 51.419 114.341 97.806 1.00 0.00 O ATOM 21494 H1 WAT 2954 52.376 114.313 97.795 1.00 0.00 H ATOM 21495 H2 WAT 2954 51.161 113.535 98.254 1.00 0.00 H TER 21497 WAT 2954 ATOM 21497 O WAT 2955 105.700 37.638 132.692 1.00 0.00 O ATOM 21498 H1 WAT 2955 106.307 38.200 132.210 1.00 0.00 H ATOM 21499 H2 WAT 2955 106.192 36.832 132.848 1.00 0.00 H TER 21501 WAT 2955 ATOM 21501 O WAT 2956 74.537 121.731 69.169 1.00 0.00 O ATOM 21502 H1 WAT 2956 74.519 122.652 68.907 1.00 0.00 H ATOM 21503 H2 WAT 2956 74.050 121.277 68.481 1.00 0.00 H TER 21505 WAT 2956 ATOM 21505 O WAT 2957 44.910 88.585 111.130 1.00 0.00 O ATOM 21506 H1 WAT 2957 45.025 89.060 111.953 1.00 0.00 H ATOM 21507 H2 WAT 2957 45.450 89.062 110.500 1.00 0.00 H TER 21509 WAT 2957 ATOM 21509 O WAT 2958 57.864 87.702 132.286 1.00 0.00 O ATOM 21510 H1 WAT 2958 58.807 87.868 132.276 1.00 0.00 H ATOM 21511 H2 WAT 2958 57.787 86.755 132.166 1.00 0.00 H TER 21513 WAT 2958 ATOM 21513 O WAT 2959 134.991 19.367 72.612 1.00 0.00 O ATOM 21514 H1 WAT 2959 134.081 19.080 72.681 1.00 0.00 H ATOM 21515 H2 WAT 2959 135.390 18.753 71.996 1.00 0.00 H TER 21517 WAT 2959 ATOM 21517 O WAT 2960 144.908 65.364 87.275 1.00 0.00 O ATOM 21518 H1 WAT 2960 144.202 66.003 87.372 1.00 0.00 H ATOM 21519 H2 WAT 2960 144.486 64.598 86.886 1.00 0.00 H TER 21521 WAT 2960 ATOM 21521 O WAT 2961 67.583 29.263 65.849 1.00 0.00 O ATOM 21522 H1 WAT 2961 68.225 28.994 66.506 1.00 0.00 H ATOM 21523 H2 WAT 2961 67.498 28.504 65.272 1.00 0.00 H TER 21525 WAT 2961 ATOM 21525 O WAT 2962 80.261 79.662 141.700 1.00 0.00 O ATOM 21526 H1 WAT 2962 80.073 80.470 141.222 1.00 0.00 H ATOM 21527 H2 WAT 2962 80.931 79.224 141.176 1.00 0.00 H TER 21529 WAT 2962 ATOM 21529 O WAT 2963 94.358 13.836 3.585 1.00 0.00 O ATOM 21530 H1 WAT 2963 93.935 14.694 3.617 1.00 0.00 H ATOM 21531 H2 WAT 2963 94.576 13.642 4.497 1.00 0.00 H TER 21533 WAT 2963 ATOM 21533 O WAT 2964 87.523 119.857 24.949 1.00 0.00 O ATOM 21534 H1 WAT 2964 87.766 118.978 25.240 1.00 0.00 H ATOM 21535 H2 WAT 2964 88.358 120.283 24.753 1.00 0.00 H TER 21537 WAT 2964 ATOM 21537 O WAT 2965 116.642 141.042 126.799 1.00 0.00 O ATOM 21538 H1 WAT 2965 116.810 140.114 126.964 1.00 0.00 H ATOM 21539 H2 WAT 2965 117.055 141.214 125.953 1.00 0.00 H TER 21541 WAT 2965 ATOM 21541 O WAT 2966 106.923 97.116 118.217 1.00 0.00 O ATOM 21542 H1 WAT 2966 106.396 97.711 117.684 1.00 0.00 H ATOM 21543 H2 WAT 2966 106.828 96.264 117.791 1.00 0.00 H TER 21545 WAT 2966 ATOM 21545 O WAT 2967 103.619 2.120 146.407 1.00 0.00 O ATOM 21546 H1 WAT 2967 104.431 2.499 146.744 1.00 0.00 H ATOM 21547 H2 WAT 2967 103.502 2.530 145.550 1.00 0.00 H TER 21549 WAT 2967 ATOM 21549 O WAT 2968 95.990 36.194 1.655 1.00 0.00 O ATOM 21550 H1 WAT 2968 95.195 36.516 1.230 1.00 0.00 H ATOM 21551 H2 WAT 2968 95.834 36.332 2.590 1.00 0.00 H TER 21553 WAT 2968 ATOM 21553 O WAT 2969 56.150 26.441 109.075 1.00 0.00 O ATOM 21554 H1 WAT 2969 56.402 25.942 108.298 1.00 0.00 H ATOM 21555 H2 WAT 2969 56.050 25.781 109.761 1.00 0.00 H TER 21557 WAT 2969 ATOM 21557 O WAT 2970 39.020 72.335 127.193 1.00 0.00 O ATOM 21558 H1 WAT 2970 39.628 72.488 126.470 1.00 0.00 H ATOM 21559 H2 WAT 2970 38.862 71.391 127.177 1.00 0.00 H TER 21561 WAT 2970 ATOM 21561 O WAT 2971 37.063 23.991 125.594 1.00 0.00 O ATOM 21562 H1 WAT 2971 37.598 24.756 125.802 1.00 0.00 H ATOM 21563 H2 WAT 2971 37.668 23.252 125.654 1.00 0.00 H TER 21565 WAT 2971 ATOM 21565 O WAT 2972 99.224 106.299 105.243 1.00 0.00 O ATOM 21566 H1 WAT 2972 99.956 105.864 104.805 1.00 0.00 H ATOM 21567 H2 WAT 2972 98.818 106.831 104.559 1.00 0.00 H TER 21569 WAT 2972 ATOM 21569 O WAT 2973 71.631 135.736 97.591 1.00 0.00 O ATOM 21570 H1 WAT 2973 72.355 135.199 97.912 1.00 0.00 H ATOM 21571 H2 WAT 2973 72.052 136.511 97.220 1.00 0.00 H TER 21573 WAT 2973 ATOM 21573 O WAT 2974 82.594 111.264 144.494 1.00 0.00 O ATOM 21574 H1 WAT 2974 81.749 110.850 144.316 1.00 0.00 H ATOM 21575 H2 WAT 2974 82.374 112.163 144.738 1.00 0.00 H TER 21577 WAT 2974 ATOM 21577 O WAT 2975 142.707 64.577 144.895 1.00 0.00 O ATOM 21578 H1 WAT 2975 142.146 64.008 145.423 1.00 0.00 H ATOM 21579 H2 WAT 2975 142.846 65.350 145.442 1.00 0.00 H TER 21581 WAT 2975 ATOM 21581 O WAT 2976 94.732 58.279 2.994 1.00 0.00 O ATOM 21582 H1 WAT 2976 94.566 59.208 3.153 1.00 0.00 H ATOM 21583 H2 WAT 2976 95.526 58.265 2.459 1.00 0.00 H TER 21585 WAT 2976 ATOM 21585 O WAT 2977 120.126 55.816 8.785 1.00 0.00 O ATOM 21586 H1 WAT 2977 120.970 56.118 8.449 1.00 0.00 H ATOM 21587 H2 WAT 2977 119.682 56.615 9.068 1.00 0.00 H TER 21589 WAT 2977 ATOM 21589 O WAT 2978 134.619 130.775 84.571 1.00 0.00 O ATOM 21590 H1 WAT 2978 134.972 130.469 85.406 1.00 0.00 H ATOM 21591 H2 WAT 2978 135.232 130.442 83.915 1.00 0.00 H TER 21593 WAT 2978 ATOM 21593 O WAT 2979 142.735 83.379 6.491 1.00 0.00 O ATOM 21594 H1 WAT 2979 143.544 83.676 6.908 1.00 0.00 H ATOM 21595 H2 WAT 2979 142.376 84.165 6.080 1.00 0.00 H TER 21597 WAT 2979 ATOM 21597 O WAT 2980 1.476 95.829 18.221 1.00 0.00 O ATOM 21598 H1 WAT 2980 2.323 96.146 18.533 1.00 0.00 H ATOM 21599 H2 WAT 2980 0.847 96.482 18.530 1.00 0.00 H TER 21601 WAT 2980 ATOM 21601 O WAT 2981 61.356 30.756 60.167 1.00 0.00 O ATOM 21602 H1 WAT 2981 60.595 30.385 59.720 1.00 0.00 H ATOM 21603 H2 WAT 2981 61.889 31.127 59.465 1.00 0.00 H TER 21605 WAT 2981 ATOM 21605 O WAT 2982 51.937 127.716 105.007 1.00 0.00 O ATOM 21606 H1 WAT 2982 52.660 128.126 104.532 1.00 0.00 H ATOM 21607 H2 WAT 2982 51.960 128.119 105.875 1.00 0.00 H TER 21609 WAT 2982 ATOM 21609 O WAT 2983 132.929 122.227 107.755 1.00 0.00 O ATOM 21610 H1 WAT 2983 132.491 123.078 107.728 1.00 0.00 H ATOM 21611 H2 WAT 2983 133.604 122.326 108.426 1.00 0.00 H TER 21613 WAT 2983 ATOM 21613 O WAT 2984 74.214 46.780 97.032 1.00 0.00 O ATOM 21614 H1 WAT 2984 73.944 46.224 97.763 1.00 0.00 H ATOM 21615 H2 WAT 2984 75.097 47.068 97.264 1.00 0.00 H TER 21617 WAT 2984 ATOM 21617 O WAT 2985 101.499 112.570 83.197 1.00 0.00 O ATOM 21618 H1 WAT 2985 101.728 111.843 83.776 1.00 0.00 H ATOM 21619 H2 WAT 2985 101.101 112.151 82.433 1.00 0.00 H TER 21621 WAT 2985 ATOM 21621 O WAT 2986 51.912 32.727 123.027 1.00 0.00 O ATOM 21622 H1 WAT 2986 52.794 32.964 123.317 1.00 0.00 H ATOM 21623 H2 WAT 2986 51.916 31.770 123.006 1.00 0.00 H TER 21625 WAT 2986 ATOM 21625 O WAT 2987 34.002 46.817 139.845 1.00 0.00 O ATOM 21626 H1 WAT 2987 34.315 47.000 138.959 1.00 0.00 H ATOM 21627 H2 WAT 2987 34.751 46.417 140.286 1.00 0.00 H TER 21629 WAT 2987 ATOM 21629 O WAT 2988 100.319 81.466 122.248 1.00 0.00 O ATOM 21630 H1 WAT 2988 99.721 80.835 122.650 1.00 0.00 H ATOM 21631 H2 WAT 2988 100.281 82.231 122.822 1.00 0.00 H TER 21633 WAT 2988 ATOM 21633 O WAT 2989 55.302 132.784 0.206 1.00 0.00 O ATOM 21634 H1 WAT 2989 54.519 132.585 -0.307 1.00 0.00 H ATOM 21635 H2 WAT 2989 55.089 132.490 1.092 1.00 0.00 H TER 21637 WAT 2989 ATOM 21637 O WAT 2990 122.727 8.530 134.958 1.00 0.00 O ATOM 21638 H1 WAT 2990 123.136 9.094 135.614 1.00 0.00 H ATOM 21639 H2 WAT 2990 123.449 8.010 134.605 1.00 0.00 H TER 21641 WAT 2990 ATOM 21641 O WAT 2991 142.992 97.922 22.473 1.00 0.00 O ATOM 21642 H1 WAT 2991 142.373 98.492 22.929 1.00 0.00 H ATOM 21643 H2 WAT 2991 143.751 97.877 23.055 1.00 0.00 H TER 21645 WAT 2991 ATOM 21645 O WAT 2992 145.508 58.563 106.201 1.00 0.00 O ATOM 21646 H1 WAT 2992 145.567 57.875 106.865 1.00 0.00 H ATOM 21647 H2 WAT 2992 146.153 59.215 106.475 1.00 0.00 H TER 21649 WAT 2992 ATOM 21649 O WAT 2993 113.127 127.972 137.658 1.00 0.00 O ATOM 21650 H1 WAT 2993 113.489 128.755 137.242 1.00 0.00 H ATOM 21651 H2 WAT 2993 113.663 127.253 137.322 1.00 0.00 H TER 21653 WAT 2993 ATOM 21653 O WAT 2994 72.910 100.560 145.903 1.00 0.00 O ATOM 21654 H1 WAT 2994 72.723 100.015 146.667 1.00 0.00 H ATOM 21655 H2 WAT 2994 72.274 101.274 145.956 1.00 0.00 H TER 21657 WAT 2994 ATOM 21657 O WAT 2995 74.294 86.693 61.890 1.00 0.00 O ATOM 21658 H1 WAT 2995 75.103 86.225 62.094 1.00 0.00 H ATOM 21659 H2 WAT 2995 74.537 87.619 61.931 1.00 0.00 H TER 21661 WAT 2995 ATOM 21661 O WAT 2996 105.455 134.525 107.283 1.00 0.00 O ATOM 21662 H1 WAT 2996 105.257 134.477 108.218 1.00 0.00 H ATOM 21663 H2 WAT 2996 106.403 134.408 107.233 1.00 0.00 H TER 21665 WAT 2996 ATOM 21665 O WAT 2997 59.027 50.732 83.996 1.00 0.00 O ATOM 21666 H1 WAT 2997 59.708 51.383 84.169 1.00 0.00 H ATOM 21667 H2 WAT 2997 59.454 49.891 84.157 1.00 0.00 H TER 21669 WAT 2997 ATOM 21669 O WAT 2998 142.612 130.919 122.003 1.00 0.00 O ATOM 21670 H1 WAT 2998 142.293 130.017 122.046 1.00 0.00 H ATOM 21671 H2 WAT 2998 142.046 131.401 122.606 1.00 0.00 H TER 21673 WAT 2998 ATOM 21673 O WAT 2999 70.436 119.972 59.421 1.00 0.00 O ATOM 21674 H1 WAT 2999 70.139 119.166 58.998 1.00 0.00 H ATOM 21675 H2 WAT 2999 71.331 120.092 59.105 1.00 0.00 H TER 21677 WAT 2999 ATOM 21677 O WAT 3000 19.965 39.026 75.085 1.00 0.00 O ATOM 21678 H1 WAT 3000 20.162 39.506 74.281 1.00 0.00 H ATOM 21679 H2 WAT 3000 19.051 39.241 75.273 1.00 0.00 H TER 21681 WAT 3000 ATOM 21681 O WAT 3001 85.306 59.206 61.779 1.00 0.00 O ATOM 21682 H1 WAT 3001 84.892 60.022 61.499 1.00 0.00 H ATOM 21683 H2 WAT 3001 85.111 58.585 61.078 1.00 0.00 H TER 21685 WAT 3001 ATOM 21685 O WAT 3002 36.580 79.311 124.897 1.00 0.00 O ATOM 21686 H1 WAT 3002 37.017 78.525 125.224 1.00 0.00 H ATOM 21687 H2 WAT 3002 35.777 79.373 125.414 1.00 0.00 H TER 21689 WAT 3002 ATOM 21689 O WAT 3003 61.308 115.548 55.205 1.00 0.00 O ATOM 21690 H1 WAT 3003 61.055 116.293 54.660 1.00 0.00 H ATOM 21691 H2 WAT 3003 60.623 115.495 55.871 1.00 0.00 H TER 21693 WAT 3003 ATOM 21693 O WAT 3004 114.085 100.265 79.930 1.00 0.00 O ATOM 21694 H1 WAT 3004 113.423 99.670 79.576 1.00 0.00 H ATOM 21695 H2 WAT 3004 114.895 99.756 79.916 1.00 0.00 H TER 21697 WAT 3004 ATOM 21697 O WAT 3005 83.684 14.485 82.104 1.00 0.00 O ATOM 21698 H1 WAT 3005 83.519 13.707 82.637 1.00 0.00 H ATOM 21699 H2 WAT 3005 82.903 15.026 82.221 1.00 0.00 H TER 21701 WAT 3005 ATOM 21701 O WAT 3006 104.641 134.193 156.126 1.00 0.00 O ATOM 21702 H1 WAT 3006 105.387 134.035 155.548 1.00 0.00 H ATOM 21703 H2 WAT 3006 103.927 134.436 155.536 1.00 0.00 H TER 21705 WAT 3006 ATOM 21705 O WAT 3007 110.214 22.919 64.575 1.00 0.00 O ATOM 21706 H1 WAT 3007 110.574 22.478 63.805 1.00 0.00 H ATOM 21707 H2 WAT 3007 109.340 23.199 64.304 1.00 0.00 H TER 21709 WAT 3007 ATOM 21709 O WAT 3008 42.133 73.022 6.843 1.00 0.00 O ATOM 21710 H1 WAT 3008 42.286 73.797 6.302 1.00 0.00 H ATOM 21711 H2 WAT 3008 41.950 73.371 7.715 1.00 0.00 H TER 21713 WAT 3008 ATOM 21713 O WAT 3009 34.057 119.921 136.547 1.00 0.00 O ATOM 21714 H1 WAT 3009 34.868 119.763 137.029 1.00 0.00 H ATOM 21715 H2 WAT 3009 33.938 120.871 136.582 1.00 0.00 H TER 21717 WAT 3009 ATOM 21717 O WAT 3010 132.906 107.903 117.774 1.00 0.00 O ATOM 21718 H1 WAT 3010 133.040 108.766 117.382 1.00 0.00 H ATOM 21719 H2 WAT 3010 133.767 107.487 117.738 1.00 0.00 H TER 21721 WAT 3010 ATOM 21721 O WAT 3011 53.886 59.321 122.638 1.00 0.00 O ATOM 21722 H1 WAT 3011 54.739 58.886 122.657 1.00 0.00 H ATOM 21723 H2 WAT 3011 53.490 59.035 121.814 1.00 0.00 H TER 21725 WAT 3011 ATOM 21725 O WAT 3012 33.757 26.131 77.562 1.00 0.00 O ATOM 21726 H1 WAT 3012 34.023 25.867 76.681 1.00 0.00 H ATOM 21727 H2 WAT 3012 34.109 27.016 77.663 1.00 0.00 H TER 21729 WAT 3012 ATOM 21729 O WAT 3013 50.182 123.654 95.124 1.00 0.00 O ATOM 21730 H1 WAT 3013 49.434 124.086 94.711 1.00 0.00 H ATOM 21731 H2 WAT 3013 49.828 122.829 95.456 1.00 0.00 H TER 21733 WAT 3013 ATOM 21733 O WAT 3014 79.388 26.969 88.706 1.00 0.00 O ATOM 21734 H1 WAT 3014 79.661 27.745 88.218 1.00 0.00 H ATOM 21735 H2 WAT 3014 79.521 26.243 88.096 1.00 0.00 H TER 21737 WAT 3014 ATOM 21737 O WAT 3015 8.670 134.511 72.837 1.00 0.00 O ATOM 21738 H1 WAT 3015 7.870 134.853 73.235 1.00 0.00 H ATOM 21739 H2 WAT 3015 9.146 134.108 73.563 1.00 0.00 H TER 21741 WAT 3015 ATOM 21741 O WAT 3016 58.330 136.072 138.225 1.00 0.00 O ATOM 21742 H1 WAT 3016 58.568 136.121 139.151 1.00 0.00 H ATOM 21743 H2 WAT 3016 58.689 135.234 137.930 1.00 0.00 H TER 21745 WAT 3016 ATOM 21745 O WAT 3017 32.874 52.570 149.173 1.00 0.00 O ATOM 21746 H1 WAT 3017 33.439 52.776 148.428 1.00 0.00 H ATOM 21747 H2 WAT 3017 32.214 53.264 149.172 1.00 0.00 H TER 21749 WAT 3017 ATOM 21749 O WAT 3018 14.858 130.148 105.988 1.00 0.00 O ATOM 21750 H1 WAT 3018 14.289 130.889 105.778 1.00 0.00 H ATOM 21751 H2 WAT 3018 15.659 130.549 106.324 1.00 0.00 H TER 21753 WAT 3018 ATOM 21753 O WAT 3019 129.248 60.070 4.050 1.00 0.00 O ATOM 21754 H1 WAT 3019 128.587 60.745 3.898 1.00 0.00 H ATOM 21755 H2 WAT 3019 129.471 60.157 4.977 1.00 0.00 H TER 21757 WAT 3019 ATOM 21757 O WAT 3020 9.897 11.195 77.177 1.00 0.00 O ATOM 21758 H1 WAT 3020 10.043 12.084 76.853 1.00 0.00 H ATOM 21759 H2 WAT 3020 9.000 11.206 77.509 1.00 0.00 H TER 21761 WAT 3020 ATOM 21761 O WAT 3021 108.821 75.568 120.444 1.00 0.00 O ATOM 21762 H1 WAT 3021 109.634 75.533 119.940 1.00 0.00 H ATOM 21763 H2 WAT 3021 108.142 75.747 119.793 1.00 0.00 H TER 21765 WAT 3021 ATOM 21765 O WAT 3022 15.866 109.169 88.601 1.00 0.00 O ATOM 21766 H1 WAT 3022 15.838 108.232 88.794 1.00 0.00 H ATOM 21767 H2 WAT 3022 15.017 109.357 88.202 1.00 0.00 H TER 21769 WAT 3022 ATOM 21769 O WAT 3023 97.931 112.020 89.589 1.00 0.00 O ATOM 21770 H1 WAT 3023 98.847 111.930 89.854 1.00 0.00 H ATOM 21771 H2 WAT 3023 97.828 111.396 88.870 1.00 0.00 H TER 21773 WAT 3023 ATOM 21773 O WAT 3024 127.145 141.664 101.091 1.00 0.00 O ATOM 21774 H1 WAT 3024 127.868 141.067 101.282 1.00 0.00 H ATOM 21775 H2 WAT 3024 126.371 141.102 101.065 1.00 0.00 H TER 21777 WAT 3024 ATOM 21777 O WAT 3025 69.933 140.052 152.151 1.00 0.00 O ATOM 21778 H1 WAT 3025 70.713 140.059 151.597 1.00 0.00 H ATOM 21779 H2 WAT 3025 70.096 140.734 152.803 1.00 0.00 H TER 21781 WAT 3025 ATOM 21781 O WAT 3026 31.526 137.553 147.341 1.00 0.00 O ATOM 21782 H1 WAT 3026 31.558 137.459 148.293 1.00 0.00 H ATOM 21783 H2 WAT 3026 30.930 136.861 147.052 1.00 0.00 H TER 21785 WAT 3026 ATOM 21785 O WAT 3027 77.240 7.729 93.911 1.00 0.00 O ATOM 21786 H1 WAT 3027 77.040 7.258 93.101 1.00 0.00 H ATOM 21787 H2 WAT 3027 77.288 7.046 94.580 1.00 0.00 H TER 21789 WAT 3027 ATOM 21789 O WAT 3028 25.445 9.698 132.994 1.00 0.00 O ATOM 21790 H1 WAT 3028 25.394 10.631 132.786 1.00 0.00 H ATOM 21791 H2 WAT 3028 25.315 9.258 132.154 1.00 0.00 H TER 21793 WAT 3028 ATOM 21793 O WAT 3029 99.224 104.256 30.615 1.00 0.00 O ATOM 21794 H1 WAT 3029 99.834 104.642 31.243 1.00 0.00 H ATOM 21795 H2 WAT 3029 99.784 103.832 29.966 1.00 0.00 H TER 21797 WAT 3029 ATOM 21797 O WAT 3030 70.260 84.765 74.488 1.00 0.00 O ATOM 21798 H1 WAT 3030 70.190 83.919 74.930 1.00 0.00 H ATOM 21799 H2 WAT 3030 69.681 84.689 73.730 1.00 0.00 H TER 21801 WAT 3030 ATOM 21801 O WAT 3031 18.530 72.081 133.932 1.00 0.00 O ATOM 21802 H1 WAT 3031 18.238 72.457 134.763 1.00 0.00 H ATOM 21803 H2 WAT 3031 17.736 72.033 133.400 1.00 0.00 H TER 21805 WAT 3031 ATOM 21805 O WAT 3032 136.159 89.139 124.237 1.00 0.00 O ATOM 21806 H1 WAT 3032 135.257 88.949 124.497 1.00 0.00 H ATOM 21807 H2 WAT 3032 136.635 88.328 124.412 1.00 0.00 H TER 21809 WAT 3032 ATOM 21809 O WAT 3033 6.557 1.830 143.273 1.00 0.00 O ATOM 21810 H1 WAT 3033 6.864 1.309 142.531 1.00 0.00 H ATOM 21811 H2 WAT 3033 7.317 2.353 143.529 1.00 0.00 H TER 21813 WAT 3033 ATOM 21813 O WAT 3034 130.222 50.460 74.219 1.00 0.00 O ATOM 21814 H1 WAT 3034 130.369 50.514 75.163 1.00 0.00 H ATOM 21815 H2 WAT 3034 131.028 50.078 73.872 1.00 0.00 H TER 21817 WAT 3034 ATOM 21817 O WAT 3035 16.797 6.822 151.218 1.00 0.00 O ATOM 21818 H1 WAT 3035 17.287 7.643 151.178 1.00 0.00 H ATOM 21819 H2 WAT 3035 17.279 6.287 151.849 1.00 0.00 H TER 21821 WAT 3035 ATOM 21821 O WAT 3036 26.697 15.512 98.407 1.00 0.00 O ATOM 21822 H1 WAT 3036 27.015 15.840 99.249 1.00 0.00 H ATOM 21823 H2 WAT 3036 27.478 15.165 97.975 1.00 0.00 H TER 21825 WAT 3036 ATOM 21825 O WAT 3037 7.920 127.793 105.504 1.00 0.00 O ATOM 21826 H1 WAT 3037 7.479 127.874 106.350 1.00 0.00 H ATOM 21827 H2 WAT 3037 8.716 127.298 105.696 1.00 0.00 H TER 21829 WAT 3037 ATOM 21829 O WAT 3038 20.405 94.098 94.731 1.00 0.00 O ATOM 21830 H1 WAT 3038 21.324 93.851 94.629 1.00 0.00 H ATOM 21831 H2 WAT 3038 20.421 94.832 95.345 1.00 0.00 H TER 21833 WAT 3038 ATOM 21833 O WAT 3039 89.427 88.268 3.351 1.00 0.00 O ATOM 21834 H1 WAT 3039 89.355 88.213 4.304 1.00 0.00 H ATOM 21835 H2 WAT 3039 89.840 89.116 3.190 1.00 0.00 H TER 21837 WAT 3039 ATOM 21837 O WAT 3040 33.423 96.977 93.488 1.00 0.00 O ATOM 21838 H1 WAT 3040 32.490 96.920 93.692 1.00 0.00 H ATOM 21839 H2 WAT 3040 33.531 97.846 93.100 1.00 0.00 H TER 21841 WAT 3040 ATOM 21841 O WAT 3041 24.037 125.983 88.841 1.00 0.00 O ATOM 21842 H1 WAT 3041 23.637 126.739 89.271 1.00 0.00 H ATOM 21843 H2 WAT 3041 23.300 125.410 88.632 1.00 0.00 H TER 21845 WAT 3041 ATOM 21845 O WAT 3042 25.749 131.218 116.841 1.00 0.00 O ATOM 21846 H1 WAT 3042 26.295 131.512 116.112 1.00 0.00 H ATOM 21847 H2 WAT 3042 25.951 131.825 117.552 1.00 0.00 H TER 21849 WAT 3042 ATOM 21849 O WAT 3043 71.507 91.551 89.541 1.00 0.00 O ATOM 21850 H1 WAT 3043 72.329 91.917 89.216 1.00 0.00 H ATOM 21851 H2 WAT 3043 70.918 91.577 88.787 1.00 0.00 H TER 21853 WAT 3043 ATOM 21853 O WAT 3044 134.547 144.960 94.556 1.00 0.00 O ATOM 21854 H1 WAT 3044 134.687 145.272 95.450 1.00 0.00 H ATOM 21855 H2 WAT 3044 135.346 145.204 94.089 1.00 0.00 H TER 21857 WAT 3044 ATOM 21857 O WAT 3045 26.060 45.849 103.360 1.00 0.00 O ATOM 21858 H1 WAT 3045 26.175 46.355 102.556 1.00 0.00 H ATOM 21859 H2 WAT 3045 26.181 46.487 104.064 1.00 0.00 H TER 21861 WAT 3045 ATOM 21861 O WAT 3046 103.601 52.610 155.426 1.00 0.00 O ATOM 21862 H1 WAT 3046 103.796 52.264 156.297 1.00 0.00 H ATOM 21863 H2 WAT 3046 103.609 51.841 154.856 1.00 0.00 H TER 21865 WAT 3046 ATOM 21865 O WAT 3047 74.932 50.532 17.269 1.00 0.00 O ATOM 21866 H1 WAT 3047 75.319 50.566 16.394 1.00 0.00 H ATOM 21867 H2 WAT 3047 75.359 49.788 17.692 1.00 0.00 H TER 21869 WAT 3047 ATOM 21869 O WAT 3048 80.120 24.703 129.131 1.00 0.00 O ATOM 21870 H1 WAT 3048 80.694 24.378 128.437 1.00 0.00 H ATOM 21871 H2 WAT 3048 79.647 23.927 129.433 1.00 0.00 H TER 21873 WAT 3048 ATOM 21873 O WAT 3049 97.422 124.248 95.745 1.00 0.00 O ATOM 21874 H1 WAT 3049 98.063 124.695 96.298 1.00 0.00 H ATOM 21875 H2 WAT 3049 96.992 124.952 95.260 1.00 0.00 H TER 21877 WAT 3049 ATOM 21877 O WAT 3050 78.860 76.172 108.036 1.00 0.00 O ATOM 21878 H1 WAT 3050 78.519 76.600 108.821 1.00 0.00 H ATOM 21879 H2 WAT 3050 78.090 75.780 107.623 1.00 0.00 H TER 21881 WAT 3050 ATOM 21881 O WAT 3051 16.088 91.981 13.368 1.00 0.00 O ATOM 21882 H1 WAT 3051 15.833 92.044 14.288 1.00 0.00 H ATOM 21883 H2 WAT 3051 15.665 91.181 13.057 1.00 0.00 H TER 21885 WAT 3051 ATOM 21885 O WAT 3052 104.128 60.074 138.221 1.00 0.00 O ATOM 21886 H1 WAT 3052 103.285 59.778 138.566 1.00 0.00 H ATOM 21887 H2 WAT 3052 104.285 60.910 138.661 1.00 0.00 H TER 21889 WAT 3052 ATOM 21889 O WAT 3053 59.845 141.470 153.076 1.00 0.00 O ATOM 21890 H1 WAT 3053 60.250 141.406 152.211 1.00 0.00 H ATOM 21891 H2 WAT 3053 60.267 140.781 153.590 1.00 0.00 H TER 21893 WAT 3053 ATOM 21893 O WAT 3054 117.170 49.698 9.898 1.00 0.00 O ATOM 21894 H1 WAT 3054 117.218 49.065 10.614 1.00 0.00 H ATOM 21895 H2 WAT 3054 116.759 50.470 10.287 1.00 0.00 H TER 21897 WAT 3054 ATOM 21897 O WAT 3055 33.648 113.947 13.830 1.00 0.00 O ATOM 21898 H1 WAT 3055 34.007 113.315 14.453 1.00 0.00 H ATOM 21899 H2 WAT 3055 32.775 114.148 14.170 1.00 0.00 H TER 21901 WAT 3055 ATOM 21901 O WAT 3056 14.626 74.335 73.918 1.00 0.00 O ATOM 21902 H1 WAT 3056 14.001 73.688 74.242 1.00 0.00 H ATOM 21903 H2 WAT 3056 14.420 74.423 72.988 1.00 0.00 H TER 21905 WAT 3056 ATOM 21905 O WAT 3057 113.147 101.491 76.235 1.00 0.00 O ATOM 21906 H1 WAT 3057 113.304 101.943 75.406 1.00 0.00 H ATOM 21907 H2 WAT 3057 114.011 101.434 76.644 1.00 0.00 H TER 21909 WAT 3057 ATOM 21909 O WAT 3058 141.261 136.500 98.436 1.00 0.00 O ATOM 21910 H1 WAT 3058 141.387 137.425 98.645 1.00 0.00 H ATOM 21911 H2 WAT 3058 141.574 136.035 99.212 1.00 0.00 H TER 21913 WAT 3058 ATOM 21913 O WAT 3059 126.095 32.216 88.320 1.00 0.00 O ATOM 21914 H1 WAT 3059 125.894 33.149 88.398 1.00 0.00 H ATOM 21915 H2 WAT 3059 125.273 31.775 88.533 1.00 0.00 H TER 21917 WAT 3059 ATOM 21917 O WAT 3060 57.246 43.602 56.615 1.00 0.00 O ATOM 21918 H1 WAT 3060 56.515 43.103 56.979 1.00 0.00 H ATOM 21919 H2 WAT 3060 57.853 43.706 57.348 1.00 0.00 H TER 21921 WAT 3060 ATOM 21921 O WAT 3061 65.315 129.343 74.699 1.00 0.00 O ATOM 21922 H1 WAT 3061 66.131 129.241 75.188 1.00 0.00 H ATOM 21923 H2 WAT 3061 64.840 128.526 74.853 1.00 0.00 H TER 21925 WAT 3061 ATOM 21925 O WAT 3062 97.357 105.560 86.603 1.00 0.00 O ATOM 21926 H1 WAT 3062 96.432 105.461 86.828 1.00 0.00 H ATOM 21927 H2 WAT 3062 97.676 104.664 86.501 1.00 0.00 H TER 21929 WAT 3062 ATOM 21929 O WAT 3063 48.884 100.364 26.897 1.00 0.00 O ATOM 21930 H1 WAT 3063 47.935 100.331 26.775 1.00 0.00 H ATOM 21931 H2 WAT 3063 49.193 100.954 26.210 1.00 0.00 H TER 21933 WAT 3063 ATOM 21933 O WAT 3064 39.259 8.200 88.674 1.00 0.00 O ATOM 21934 H1 WAT 3064 38.928 8.234 87.777 1.00 0.00 H ATOM 21935 H2 WAT 3064 39.828 7.431 88.691 1.00 0.00 H TER 21937 WAT 3064 ATOM 21937 O WAT 3065 92.778 143.265 149.425 1.00 0.00 O ATOM 21938 H1 WAT 3065 93.006 143.382 148.502 1.00 0.00 H ATOM 21939 H2 WAT 3065 92.308 144.066 149.659 1.00 0.00 H TER 21941 WAT 3065 ATOM 21941 O WAT 3066 86.658 8.349 115.370 1.00 0.00 O ATOM 21942 H1 WAT 3066 87.399 8.740 115.833 1.00 0.00 H ATOM 21943 H2 WAT 3066 85.906 8.880 115.632 1.00 0.00 H TER 21945 WAT 3066 ATOM 21945 O WAT 3067 77.173 27.540 62.977 1.00 0.00 O ATOM 21946 H1 WAT 3067 76.424 27.712 63.548 1.00 0.00 H ATOM 21947 H2 WAT 3067 77.670 28.358 62.983 1.00 0.00 H TER 21949 WAT 3067 ATOM 21949 O WAT 3068 96.721 126.655 89.379 1.00 0.00 O ATOM 21950 H1 WAT 3068 97.139 127.510 89.276 1.00 0.00 H ATOM 21951 H2 WAT 3068 97.431 126.025 89.259 1.00 0.00 H TER 21953 WAT 3068 ATOM 21953 O WAT 3069 41.245 45.647 99.778 1.00 0.00 O ATOM 21954 H1 WAT 3069 41.984 45.308 100.283 1.00 0.00 H ATOM 21955 H2 WAT 3069 41.316 45.213 98.928 1.00 0.00 H TER 21957 WAT 3069 ATOM 21957 O WAT 3070 9.001 37.589 99.237 1.00 0.00 O ATOM 21958 H1 WAT 3070 9.337 37.194 98.432 1.00 0.00 H ATOM 21959 H2 WAT 3070 8.176 37.999 98.977 1.00 0.00 H TER 21961 WAT 3070 ATOM 21961 O WAT 3071 65.942 26.945 139.022 1.00 0.00 O ATOM 21962 H1 WAT 3071 65.064 27.294 139.179 1.00 0.00 H ATOM 21963 H2 WAT 3071 65.858 26.006 139.186 1.00 0.00 H TER 21965 WAT 3071 ATOM 21965 O WAT 3072 22.912 0.792 111.749 1.00 0.00 O ATOM 21966 H1 WAT 3072 22.464 0.369 112.481 1.00 0.00 H ATOM 21967 H2 WAT 3072 22.568 1.685 111.741 1.00 0.00 H TER 21969 WAT 3072 ATOM 21969 O WAT 3073 49.284 8.975 96.302 1.00 0.00 O ATOM 21970 H1 WAT 3073 49.925 8.285 96.131 1.00 0.00 H ATOM 21971 H2 WAT 3073 49.235 9.466 95.482 1.00 0.00 H TER 21973 WAT 3073 ATOM 21973 O WAT 3074 58.864 21.900 113.839 1.00 0.00 O ATOM 21974 H1 WAT 3074 59.061 22.551 114.512 1.00 0.00 H ATOM 21975 H2 WAT 3074 58.098 22.249 113.384 1.00 0.00 H TER 21977 WAT 3074 ATOM 21977 O WAT 3075 94.738 1.266 112.791 1.00 0.00 O ATOM 21978 H1 WAT 3075 93.937 1.590 112.379 1.00 0.00 H ATOM 21979 H2 WAT 3075 94.468 1.014 113.674 1.00 0.00 H TER 21981 WAT 3075 ATOM 21981 O WAT 3076 83.194 38.019 61.783 1.00 0.00 O ATOM 21982 H1 WAT 3076 82.264 38.164 61.959 1.00 0.00 H ATOM 21983 H2 WAT 3076 83.644 38.437 62.518 1.00 0.00 H TER 21985 WAT 3076 ATOM 21985 O WAT 3077 90.889 45.546 114.357 1.00 0.00 O ATOM 21986 H1 WAT 3077 90.650 44.619 114.378 1.00 0.00 H ATOM 21987 H2 WAT 3077 90.794 45.797 113.438 1.00 0.00 H TER 21989 WAT 3077 ATOM 21989 O WAT 3078 97.982 6.320 97.870 1.00 0.00 O ATOM 21990 H1 WAT 3078 97.532 6.223 98.709 1.00 0.00 H ATOM 21991 H2 WAT 3078 98.893 6.493 98.105 1.00 0.00 H TER 21993 WAT 3078 ATOM 21993 O WAT 3079 25.299 30.764 142.181 1.00 0.00 O ATOM 21994 H1 WAT 3079 26.140 30.409 142.471 1.00 0.00 H ATOM 21995 H2 WAT 3079 24.650 30.317 142.725 1.00 0.00 H TER 21997 WAT 3079 ATOM 21997 O WAT 3080 54.619 138.906 106.069 1.00 0.00 O ATOM 21998 H1 WAT 3080 54.026 139.493 106.538 1.00 0.00 H ATOM 21999 H2 WAT 3080 54.417 138.036 106.414 1.00 0.00 H TER 22001 WAT 3080 ATOM 22001 O WAT 3081 125.529 21.611 84.666 1.00 0.00 O ATOM 22002 H1 WAT 3081 124.953 20.849 84.612 1.00 0.00 H ATOM 22003 H2 WAT 3081 125.092 22.280 84.140 1.00 0.00 H TER 22005 WAT 3081 ATOM 22005 O WAT 3082 141.266 40.461 145.940 1.00 0.00 O ATOM 22006 H1 WAT 3082 141.238 39.634 145.458 1.00 0.00 H ATOM 22007 H2 WAT 3082 140.348 40.713 146.037 1.00 0.00 H TER 22009 WAT 3082 ATOM 22009 O WAT 3083 83.267 47.880 94.993 1.00 0.00 O ATOM 22010 H1 WAT 3083 84.090 48.197 95.365 1.00 0.00 H ATOM 22011 H2 WAT 3083 83.209 48.308 94.139 1.00 0.00 H TER 22013 WAT 3083 ATOM 22013 O WAT 3084 3.554 115.095 4.308 1.00 0.00 O ATOM 22014 H1 WAT 3084 4.222 114.516 3.941 1.00 0.00 H ATOM 22015 H2 WAT 3084 3.825 115.228 5.217 1.00 0.00 H TER 22017 WAT 3084 ATOM 22017 O WAT 3085 48.637 34.642 102.912 1.00 0.00 O ATOM 22018 H1 WAT 3085 48.839 35.208 102.166 1.00 0.00 H ATOM 22019 H2 WAT 3085 49.493 34.362 103.238 1.00 0.00 H TER 22021 WAT 3085 ATOM 22021 O WAT 3086 6.462 9.601 117.345 1.00 0.00 O ATOM 22022 H1 WAT 3086 6.255 8.958 118.022 1.00 0.00 H ATOM 22023 H2 WAT 3086 6.234 9.166 116.523 1.00 0.00 H TER 22025 WAT 3086 ATOM 22025 O WAT 3087 125.939 96.001 58.965 1.00 0.00 O ATOM 22026 H1 WAT 3087 126.068 96.442 59.804 1.00 0.00 H ATOM 22027 H2 WAT 3087 126.716 96.229 58.453 1.00 0.00 H TER 22029 WAT 3087 ATOM 22029 O WAT 3088 142.462 137.171 75.054 1.00 0.00 O ATOM 22030 H1 WAT 3088 142.667 137.386 74.144 1.00 0.00 H ATOM 22031 H2 WAT 3088 141.867 136.424 74.995 1.00 0.00 H TER 22033 WAT 3088 ATOM 22033 O WAT 3089 39.976 7.028 150.753 1.00 0.00 O ATOM 22034 H1 WAT 3089 39.462 7.370 150.022 1.00 0.00 H ATOM 22035 H2 WAT 3089 40.461 6.291 150.381 1.00 0.00 H TER 22037 WAT 3089 ATOM 22037 O WAT 3090 127.491 70.822 140.583 1.00 0.00 O ATOM 22038 H1 WAT 3090 126.893 71.500 140.896 1.00 0.00 H ATOM 22039 H2 WAT 3090 127.559 70.979 139.641 1.00 0.00 H TER 22041 WAT 3090 ATOM 22041 O WAT 3091 50.867 27.150 156.012 1.00 0.00 O ATOM 22042 H1 WAT 3091 50.333 27.498 155.298 1.00 0.00 H ATOM 22043 H2 WAT 3091 50.960 27.883 156.620 1.00 0.00 H TER 22045 WAT 3091 ATOM 22045 O WAT 3092 50.165 141.446 80.002 1.00 0.00 O ATOM 22046 H1 WAT 3092 50.900 141.405 79.390 1.00 0.00 H ATOM 22047 H2 WAT 3092 49.798 140.562 79.995 1.00 0.00 H TER 22049 WAT 3092 ATOM 22049 O WAT 3093 102.523 6.613 83.645 1.00 0.00 O ATOM 22050 H1 WAT 3093 101.697 6.149 83.503 1.00 0.00 H ATOM 22051 H2 WAT 3093 103.098 5.960 84.045 1.00 0.00 H TER 22053 WAT 3093 ATOM 22053 O WAT 3094 87.890 71.391 156.610 1.00 0.00 O ATOM 22054 H1 WAT 3094 87.008 71.019 156.606 1.00 0.00 H ATOM 22055 H2 WAT 3094 88.073 71.586 155.691 1.00 0.00 H TER 22057 WAT 3094 ATOM 22057 O WAT 3095 121.958 59.706 120.119 1.00 0.00 O ATOM 22058 H1 WAT 3095 121.248 59.180 119.751 1.00 0.00 H ATOM 22059 H2 WAT 3095 122.227 59.230 120.904 1.00 0.00 H TER 22061 WAT 3095 ATOM 22061 O WAT 3096 135.056 36.390 105.186 1.00 0.00 O ATOM 22062 H1 WAT 3096 134.148 36.292 105.472 1.00 0.00 H ATOM 22063 H2 WAT 3096 135.554 36.489 105.997 1.00 0.00 H TER 22065 WAT 3096 ATOM 22065 O WAT 3097 102.388 119.782 98.819 1.00 0.00 O ATOM 22066 H1 WAT 3097 103.136 119.418 98.344 1.00 0.00 H ATOM 22067 H2 WAT 3097 102.778 120.389 99.448 1.00 0.00 H TER 22069 WAT 3097 ATOM 22069 O WAT 3098 30.836 4.833 125.171 1.00 0.00 O ATOM 22070 H1 WAT 3098 30.973 5.742 125.439 1.00 0.00 H ATOM 22071 H2 WAT 3098 30.563 4.892 124.255 1.00 0.00 H TER 22073 WAT 3098 ATOM 22073 O WAT 3099 61.730 135.593 152.645 1.00 0.00 O ATOM 22074 H1 WAT 3099 61.525 135.335 151.746 1.00 0.00 H ATOM 22075 H2 WAT 3099 60.877 135.662 153.075 1.00 0.00 H TER 22077 WAT 3099 ATOM 22077 O WAT 3100 89.731 57.352 14.376 1.00 0.00 O ATOM 22078 H1 WAT 3100 89.164 57.042 13.670 1.00 0.00 H ATOM 22079 H2 WAT 3100 89.788 56.612 14.981 1.00 0.00 H TER 22081 WAT 3100 ATOM 22081 O WAT 3101 132.942 79.564 128.087 1.00 0.00 O ATOM 22082 H1 WAT 3101 132.971 80.309 127.486 1.00 0.00 H ATOM 22083 H2 WAT 3101 133.825 79.515 128.452 1.00 0.00 H TER 22085 WAT 3101 ATOM 22085 O WAT 3102 46.856 64.200 57.568 1.00 0.00 O ATOM 22086 H1 WAT 3102 47.511 63.923 58.208 1.00 0.00 H ATOM 22087 H2 WAT 3102 46.577 63.389 57.144 1.00 0.00 H TER 22089 WAT 3102 ATOM 22089 O WAT 3103 96.430 129.616 63.593 1.00 0.00 O ATOM 22090 H1 WAT 3103 95.991 129.850 62.776 1.00 0.00 H ATOM 22091 H2 WAT 3103 96.374 130.406 64.131 1.00 0.00 H TER 22093 WAT 3103 ATOM 22093 O WAT 3104 43.689 15.726 130.121 1.00 0.00 O ATOM 22094 H1 WAT 3104 43.819 14.974 129.543 1.00 0.00 H ATOM 22095 H2 WAT 3104 43.093 15.407 130.799 1.00 0.00 H TER 22097 WAT 3104 ATOM 22097 O WAT 3105 130.325 109.108 105.566 1.00 0.00 O ATOM 22098 H1 WAT 3105 130.444 109.551 104.726 1.00 0.00 H ATOM 22099 H2 WAT 3105 129.751 108.368 105.368 1.00 0.00 H TER 22101 WAT 3105 ATOM 22101 O WAT 3106 13.704 45.132 132.021 1.00 0.00 O ATOM 22102 H1 WAT 3106 13.542 44.283 131.610 1.00 0.00 H ATOM 22103 H2 WAT 3106 14.469 45.479 131.563 1.00 0.00 H TER 22105 WAT 3106 ATOM 22105 O WAT 3107 40.774 73.893 9.231 1.00 0.00 O ATOM 22106 H1 WAT 3107 40.119 74.563 9.036 1.00 0.00 H ATOM 22107 H2 WAT 3107 41.206 74.205 10.026 1.00 0.00 H TER 22109 WAT 3107 ATOM 22109 O WAT 3108 19.354 120.123 91.162 1.00 0.00 O ATOM 22110 H1 WAT 3108 19.788 119.574 90.510 1.00 0.00 H ATOM 22111 H2 WAT 3108 20.054 120.672 91.517 1.00 0.00 H TER 22113 WAT 3108 ATOM 22113 O WAT 3109 110.837 96.678 104.854 1.00 0.00 O ATOM 22114 H1 WAT 3109 111.508 97.318 104.617 1.00 0.00 H ATOM 22115 H2 WAT 3109 110.610 96.252 104.027 1.00 0.00 H TER 22117 WAT 3109 ATOM 22117 O WAT 3110 87.982 32.693 84.109 1.00 0.00 O ATOM 22118 H1 WAT 3110 88.549 32.562 84.869 1.00 0.00 H ATOM 22119 H2 WAT 3110 87.118 32.404 84.402 1.00 0.00 H TER 22121 WAT 3110 ATOM 22121 O WAT 3111 141.914 72.856 97.193 1.00 0.00 O ATOM 22122 H1 WAT 3111 141.541 72.224 97.807 1.00 0.00 H ATOM 22123 H2 WAT 3111 142.042 72.359 96.385 1.00 0.00 H TER 22125 WAT 3111 ATOM 22125 O WAT 3112 67.215 64.166 143.167 1.00 0.00 O ATOM 22126 H1 WAT 3112 67.728 63.543 143.681 1.00 0.00 H ATOM 22127 H2 WAT 3112 66.759 64.697 143.819 1.00 0.00 H TER 22129 WAT 3112 ATOM 22129 O WAT 3113 88.031 29.880 72.577 1.00 0.00 O ATOM 22130 H1 WAT 3113 87.784 30.006 71.661 1.00 0.00 H ATOM 22131 H2 WAT 3113 88.820 29.338 72.540 1.00 0.00 H TER 22133 WAT 3113 ATOM 22133 O WAT 3114 6.645 132.253 90.096 1.00 0.00 O ATOM 22134 H1 WAT 3114 6.060 131.564 90.412 1.00 0.00 H ATOM 22135 H2 WAT 3114 6.083 132.822 89.570 1.00 0.00 H TER 22137 WAT 3114 ATOM 22137 O WAT 3115 14.874 108.166 101.247 1.00 0.00 O ATOM 22138 H1 WAT 3115 14.962 107.246 100.998 1.00 0.00 H ATOM 22139 H2 WAT 3115 14.513 108.141 102.133 1.00 0.00 H TER 22141 WAT 3115 ATOM 22141 O WAT 3116 135.381 39.437 87.880 1.00 0.00 O ATOM 22142 H1 WAT 3116 134.816 39.824 87.211 1.00 0.00 H ATOM 22143 H2 WAT 3116 136.147 39.128 87.397 1.00 0.00 H TER 22145 WAT 3116 ATOM 22145 O WAT 3117 60.223 25.834 104.843 1.00 0.00 O ATOM 22146 H1 WAT 3117 60.753 25.750 105.635 1.00 0.00 H ATOM 22147 H2 WAT 3117 60.061 26.774 104.762 1.00 0.00 H TER 22149 WAT 3117 ATOM 22149 O WAT 3118 145.746 19.845 76.118 1.00 0.00 O ATOM 22150 H1 WAT 3118 145.953 19.292 76.871 1.00 0.00 H ATOM 22151 H2 WAT 3118 144.861 19.583 75.864 1.00 0.00 H TER 22153 WAT 3118 ATOM 22153 O WAT 3119 47.394 91.858 148.480 1.00 0.00 O ATOM 22154 H1 WAT 3119 46.511 91.576 148.240 1.00 0.00 H ATOM 22155 H2 WAT 3119 47.687 91.210 149.121 1.00 0.00 H TER 22157 WAT 3119 ATOM 22157 O WAT 3120 12.555 127.333 141.466 1.00 0.00 O ATOM 22158 H1 WAT 3120 13.367 127.815 141.622 1.00 0.00 H ATOM 22159 H2 WAT 3120 12.185 127.198 142.338 1.00 0.00 H TER 22161 WAT 3120 ATOM 22161 O WAT 3121 49.430 130.846 4.362 1.00 0.00 O ATOM 22162 H1 WAT 3121 49.034 131.225 3.578 1.00 0.00 H ATOM 22163 H2 WAT 3121 50.110 130.260 4.028 1.00 0.00 H TER 22165 WAT 3121 ATOM 22165 O WAT 3122 100.007 54.859 66.646 1.00 0.00 O ATOM 22166 H1 WAT 3122 100.415 54.487 67.428 1.00 0.00 H ATOM 22167 H2 WAT 3122 99.315 55.427 66.985 1.00 0.00 H TER 22169 WAT 3122 ATOM 22169 O WAT 3123 88.345 92.922 126.777 1.00 0.00 O ATOM 22170 H1 WAT 3123 88.176 91.988 126.652 1.00 0.00 H ATOM 22171 H2 WAT 3123 89.299 92.990 126.818 1.00 0.00 H TER 22173 WAT 3123 ATOM 22173 O WAT 3124 142.575 73.567 118.411 1.00 0.00 O ATOM 22174 H1 WAT 3124 142.465 72.915 117.719 1.00 0.00 H ATOM 22175 H2 WAT 3124 141.852 73.400 119.015 1.00 0.00 H TER 22177 WAT 3124 ATOM 22177 O WAT 3125 30.698 108.130 87.734 1.00 0.00 O ATOM 22178 H1 WAT 3125 30.535 108.672 88.506 1.00 0.00 H ATOM 22179 H2 WAT 3125 31.323 107.470 88.032 1.00 0.00 H TER 22181 WAT 3125 ATOM 22181 O WAT 3126 55.198 47.934 138.207 1.00 0.00 O ATOM 22182 H1 WAT 3126 55.571 47.591 139.019 1.00 0.00 H ATOM 22183 H2 WAT 3126 54.540 48.567 138.493 1.00 0.00 H TER 22185 WAT 3126 ATOM 22185 O WAT 3127 18.104 69.632 67.432 1.00 0.00 O ATOM 22186 H1 WAT 3127 18.658 70.300 67.026 1.00 0.00 H ATOM 22187 H2 WAT 3127 18.456 69.534 68.317 1.00 0.00 H TER 22189 WAT 3127 ATOM 22189 O WAT 3128 134.657 97.246 96.195 1.00 0.00 O ATOM 22190 H1 WAT 3128 135.488 97.511 95.800 1.00 0.00 H ATOM 22191 H2 WAT 3128 134.616 97.736 97.016 1.00 0.00 H TER 22193 WAT 3128 ATOM 22193 O WAT 3129 141.387 40.010 134.889 1.00 0.00 O ATOM 22194 H1 WAT 3129 142.014 39.962 134.167 1.00 0.00 H ATOM 22195 H2 WAT 3129 141.921 40.205 135.658 1.00 0.00 H TER 22197 WAT 3129 ATOM 22197 O WAT 3130 57.988 57.490 92.625 1.00 0.00 O ATOM 22198 H1 WAT 3130 58.061 57.223 93.541 1.00 0.00 H ATOM 22199 H2 WAT 3130 57.364 58.216 92.636 1.00 0.00 H TER 22201 WAT 3130 ATOM 22201 O WAT 3131 3.111 93.780 86.092 1.00 0.00 O ATOM 22202 H1 WAT 3131 2.883 92.918 86.440 1.00 0.00 H ATOM 22203 H2 WAT 3131 2.876 93.733 85.165 1.00 0.00 H TER 22205 WAT 3131 ATOM 22205 O WAT 3132 82.301 137.553 151.150 1.00 0.00 O ATOM 22206 H1 WAT 3132 82.269 138.509 151.178 1.00 0.00 H ATOM 22207 H2 WAT 3132 81.384 137.283 151.112 1.00 0.00 H TER 22209 WAT 3132 ATOM 22209 O WAT 3133 10.855 90.214 141.654 1.00 0.00 O ATOM 22210 H1 WAT 3133 10.430 90.917 141.162 1.00 0.00 H ATOM 22211 H2 WAT 3133 10.438 90.238 142.515 1.00 0.00 H TER 22213 WAT 3133 ATOM 22213 O WAT 3134 18.571 95.290 22.939 1.00 0.00 O ATOM 22214 H1 WAT 3134 18.790 95.311 23.870 1.00 0.00 H ATOM 22215 H2 WAT 3134 19.371 94.982 22.512 1.00 0.00 H TER 22217 WAT 3134 ATOM 22217 O WAT 3135 93.865 87.375 11.842 1.00 0.00 O ATOM 22218 H1 WAT 3135 93.165 87.138 12.449 1.00 0.00 H ATOM 22219 H2 WAT 3135 94.660 87.026 12.245 1.00 0.00 H TER 22221 WAT 3135 ATOM 22221 O WAT 3136 97.298 34.727 154.120 1.00 0.00 O ATOM 22222 H1 WAT 3136 97.837 34.286 154.777 1.00 0.00 H ATOM 22223 H2 WAT 3136 97.786 35.522 153.905 1.00 0.00 H TER 22225 WAT 3136 ATOM 22225 O WAT 3137 114.005 100.690 10.625 1.00 0.00 O ATOM 22226 H1 WAT 3137 114.080 100.741 11.578 1.00 0.00 H ATOM 22227 H2 WAT 3137 113.077 100.522 10.466 1.00 0.00 H TER 22229 WAT 3137 ATOM 22229 O WAT 3138 105.932 101.450 145.448 1.00 0.00 O ATOM 22230 H1 WAT 3138 106.718 101.616 144.927 1.00 0.00 H ATOM 22231 H2 WAT 3138 106.253 101.370 146.346 1.00 0.00 H TER 22233 WAT 3138 ATOM 22233 O WAT 3139 57.452 58.724 117.754 1.00 0.00 O ATOM 22234 H1 WAT 3139 57.881 59.123 118.511 1.00 0.00 H ATOM 22235 H2 WAT 3139 58.055 58.035 117.472 1.00 0.00 H TER 22237 WAT 3139 ATOM 22237 O WAT 3140 37.389 53.507 128.592 1.00 0.00 O ATOM 22238 H1 WAT 3140 37.028 53.171 127.772 1.00 0.00 H ATOM 22239 H2 WAT 3140 38.335 53.396 128.501 1.00 0.00 H TER 22241 WAT 3140 ATOM 22241 O WAT 3141 139.706 31.688 155.977 1.00 0.00 O ATOM 22242 H1 WAT 3141 139.549 30.766 156.184 1.00 0.00 H ATOM 22243 H2 WAT 3141 138.870 32.001 155.633 1.00 0.00 H TER 22245 WAT 3141 ATOM 22245 O WAT 3142 107.634 49.398 82.084 1.00 0.00 O ATOM 22246 H1 WAT 3142 108.125 49.396 81.262 1.00 0.00 H ATOM 22247 H2 WAT 3142 106.791 49.792 81.859 1.00 0.00 H TER 22249 WAT 3142 ATOM 22249 O WAT 3143 20.098 131.331 79.931 1.00 0.00 O ATOM 22250 H1 WAT 3143 19.147 131.433 79.950 1.00 0.00 H ATOM 22251 H2 WAT 3143 20.436 132.226 79.935 1.00 0.00 H TER 22253 WAT 3143 ATOM 22253 O WAT 3144 75.080 40.798 130.084 1.00 0.00 O ATOM 22254 H1 WAT 3144 76.029 40.925 130.057 1.00 0.00 H ATOM 22255 H2 WAT 3144 74.745 41.586 130.512 1.00 0.00 H TER 22257 WAT 3144 ATOM 22257 O WAT 3145 129.542 119.656 90.372 1.00 0.00 O ATOM 22258 H1 WAT 3145 128.883 118.995 90.160 1.00 0.00 H ATOM 22259 H2 WAT 3145 129.808 119.450 91.268 1.00 0.00 H TER 22261 WAT 3145 ATOM 22261 O WAT 3146 8.432 6.682 139.472 1.00 0.00 O ATOM 22262 H1 WAT 3146 8.852 6.918 140.300 1.00 0.00 H ATOM 22263 H2 WAT 3146 9.159 6.529 138.869 1.00 0.00 H TER 22265 WAT 3146 ATOM 22265 O WAT 3147 56.085 139.331 11.624 1.00 0.00 O ATOM 22266 H1 WAT 3147 55.707 140.208 11.682 1.00 0.00 H ATOM 22267 H2 WAT 3147 55.335 138.756 11.472 1.00 0.00 H TER 22269 WAT 3147 ATOM 22269 O WAT 3148 93.045 131.420 106.328 1.00 0.00 O ATOM 22270 H1 WAT 3148 93.901 131.848 106.316 1.00 0.00 H ATOM 22271 H2 WAT 3148 92.919 131.110 105.432 1.00 0.00 H TER 22273 WAT 3148 ATOM 22273 O WAT 3149 82.552 48.895 92.089 1.00 0.00 O ATOM 22274 H1 WAT 3149 83.375 49.264 91.770 1.00 0.00 H ATOM 22275 H2 WAT 3149 82.604 47.965 91.866 1.00 0.00 H TER 22277 WAT 3149 ATOM 22277 O WAT 3150 63.073 134.457 67.009 1.00 0.00 O ATOM 22278 H1 WAT 3150 63.653 134.685 66.282 1.00 0.00 H ATOM 22279 H2 WAT 3150 63.376 133.595 67.295 1.00 0.00 H TER 22281 WAT 3150 ATOM 22281 O WAT 3151 132.168 10.517 133.088 1.00 0.00 O ATOM 22282 H1 WAT 3151 131.501 10.188 133.691 1.00 0.00 H ATOM 22283 H2 WAT 3151 132.421 9.752 132.571 1.00 0.00 H TER 22285 WAT 3151 ATOM 22285 O WAT 3152 115.847 2.054 99.124 1.00 0.00 O ATOM 22286 H1 WAT 3152 116.208 2.883 99.439 1.00 0.00 H ATOM 22287 H2 WAT 3152 116.257 1.925 98.268 1.00 0.00 H TER 22289 WAT 3152 ATOM 22289 O WAT 3153 82.049 11.431 97.927 1.00 0.00 O ATOM 22290 H1 WAT 3153 82.714 11.580 98.598 1.00 0.00 H ATOM 22291 H2 WAT 3153 81.624 10.614 98.189 1.00 0.00 H TER 22293 WAT 3153 ATOM 22293 O WAT 3154 4.657 105.968 100.534 1.00 0.00 O ATOM 22294 H1 WAT 3154 5.602 106.096 100.619 1.00 0.00 H ATOM 22295 H2 WAT 3154 4.569 105.200 99.970 1.00 0.00 H TER 22297 WAT 3154 ATOM 22297 O WAT 3155 27.130 118.431 154.456 1.00 0.00 O ATOM 22298 H1 WAT 3155 27.754 118.849 153.862 1.00 0.00 H ATOM 22299 H2 WAT 3155 26.271 118.666 154.105 1.00 0.00 H TER 22301 WAT 3155 ATOM 22301 O WAT 3156 114.767 74.252 78.332 1.00 0.00 O ATOM 22302 H1 WAT 3156 115.328 73.597 78.746 1.00 0.00 H ATOM 22303 H2 WAT 3156 114.772 74.991 78.941 1.00 0.00 H TER 22305 WAT 3156 ATOM 22305 O WAT 3157 31.688 57.788 133.447 1.00 0.00 O ATOM 22306 H1 WAT 3157 31.304 58.579 133.068 1.00 0.00 H ATOM 22307 H2 WAT 3157 32.088 58.084 134.264 1.00 0.00 H TER 22309 WAT 3157 ATOM 22309 O WAT 3158 100.571 89.930 145.962 1.00 0.00 O ATOM 22310 H1 WAT 3158 99.946 89.361 146.411 1.00 0.00 H ATOM 22311 H2 WAT 3158 100.125 90.775 145.903 1.00 0.00 H TER 22313 WAT 3158 ATOM 22313 O WAT 3159 16.573 28.689 130.469 1.00 0.00 O ATOM 22314 H1 WAT 3159 17.419 28.272 130.630 1.00 0.00 H ATOM 22315 H2 WAT 3159 16.102 28.603 131.298 1.00 0.00 H TER 22317 WAT 3159 ATOM 22317 O WAT 3160 82.663 14.576 11.855 1.00 0.00 O ATOM 22318 H1 WAT 3160 81.908 14.243 11.370 1.00 0.00 H ATOM 22319 H2 WAT 3160 82.729 14.002 12.618 1.00 0.00 H TER 22321 WAT 3160 ATOM 22321 O WAT 3161 37.415 32.190 132.892 1.00 0.00 O ATOM 22322 H1 WAT 3161 37.644 32.600 133.726 1.00 0.00 H ATOM 22323 H2 WAT 3161 36.837 31.465 133.132 1.00 0.00 H TER 22325 WAT 3161 ATOM 22325 O WAT 3162 40.945 60.590 82.441 1.00 0.00 O ATOM 22326 H1 WAT 3162 40.268 60.247 83.024 1.00 0.00 H ATOM 22327 H2 WAT 3162 41.720 60.065 82.639 1.00 0.00 H TER 22329 WAT 3162 ATOM 22329 O WAT 3163 58.419 70.555 5.910 1.00 0.00 O ATOM 22330 H1 WAT 3163 58.424 71.437 6.281 1.00 0.00 H ATOM 22331 H2 WAT 3163 59.011 70.609 5.159 1.00 0.00 H TER 22333 WAT 3163 ATOM 22333 O WAT 3164 127.206 101.171 80.073 1.00 0.00 O ATOM 22334 H1 WAT 3164 127.805 101.819 79.703 1.00 0.00 H ATOM 22335 H2 WAT 3164 126.595 101.683 80.601 1.00 0.00 H TER 22337 WAT 3164 ATOM 22337 O WAT 3165 142.829 59.570 135.564 1.00 0.00 O ATOM 22338 H1 WAT 3165 142.964 60.168 134.829 1.00 0.00 H ATOM 22339 H2 WAT 3165 141.974 59.814 135.919 1.00 0.00 H TER 22341 WAT 3165 ATOM 22341 O WAT 3166 25.849 119.995 147.199 1.00 0.00 O ATOM 22342 H1 WAT 3166 24.972 119.658 147.381 1.00 0.00 H ATOM 22343 H2 WAT 3166 25.728 120.939 147.104 1.00 0.00 H TER 22345 WAT 3166 ATOM 22345 O WAT 3167 6.260 144.122 104.365 1.00 0.00 O ATOM 22346 H1 WAT 3167 5.986 143.660 105.158 1.00 0.00 H ATOM 22347 H2 WAT 3167 7.198 143.947 104.297 1.00 0.00 H TER 22349 WAT 3167 ATOM 22349 O WAT 3168 82.988 12.312 131.172 1.00 0.00 O ATOM 22350 H1 WAT 3168 82.179 11.819 131.036 1.00 0.00 H ATOM 22351 H2 WAT 3168 82.783 13.197 130.871 1.00 0.00 H TER 22353 WAT 3168 ATOM 22353 O WAT 3169 110.466 116.925 17.023 1.00 0.00 O ATOM 22354 H1 WAT 3169 110.833 117.267 16.208 1.00 0.00 H ATOM 22355 H2 WAT 3169 109.547 117.190 17.002 1.00 0.00 H TER 22357 WAT 3169 ATOM 22357 O WAT 3170 5.345 56.551 99.330 1.00 0.00 O ATOM 22358 H1 WAT 3170 5.565 57.479 99.245 1.00 0.00 H ATOM 22359 H2 WAT 3170 6.190 56.102 99.307 1.00 0.00 H TER 22361 WAT 3170 ATOM 22361 O WAT 3171 127.489 136.812 103.973 1.00 0.00 O ATOM 22362 H1 WAT 3171 128.312 136.470 104.324 1.00 0.00 H ATOM 22363 H2 WAT 3171 126.814 136.443 104.542 1.00 0.00 H TER 22365 WAT 3171 ATOM 22365 O WAT 3172 140.367 12.732 151.935 1.00 0.00 O ATOM 22366 H1 WAT 3172 140.460 12.580 152.875 1.00 0.00 H ATOM 22367 H2 WAT 3172 139.421 12.753 151.788 1.00 0.00 H TER 22369 WAT 3172 ATOM 22369 O WAT 3173 118.008 102.434 103.326 1.00 0.00 O ATOM 22370 H1 WAT 3173 117.716 103.043 104.005 1.00 0.00 H ATOM 22371 H2 WAT 3173 118.887 102.735 103.096 1.00 0.00 H TER 22373 WAT 3173 ATOM 22373 O WAT 3174 137.413 139.389 115.651 1.00 0.00 O ATOM 22374 H1 WAT 3174 137.907 139.957 116.242 1.00 0.00 H ATOM 22375 H2 WAT 3174 136.536 139.773 115.628 1.00 0.00 H TER 22377 WAT 3174 ATOM 22377 O WAT 3175 84.768 13.105 79.460 1.00 0.00 O ATOM 22378 H1 WAT 3175 84.764 13.266 78.517 1.00 0.00 H ATOM 22379 H2 WAT 3175 84.065 13.658 79.801 1.00 0.00 H TER 22381 WAT 3175 ATOM 22381 O WAT 3176 6.345 24.132 156.093 1.00 0.00 O ATOM 22382 H1 WAT 3176 6.158 24.884 155.531 1.00 0.00 H ATOM 22383 H2 WAT 3176 6.468 24.507 156.964 1.00 0.00 H TER 22385 WAT 3176 ATOM 22385 O WAT 3177 139.268 145.118 75.340 1.00 0.00 O ATOM 22386 H1 WAT 3177 140.140 144.835 75.616 1.00 0.00 H ATOM 22387 H2 WAT 3177 138.680 144.768 76.009 1.00 0.00 H TER 22389 WAT 3177 ATOM 22389 O WAT 3178 124.048 67.299 125.566 1.00 0.00 O ATOM 22390 H1 WAT 3178 123.818 66.916 124.719 1.00 0.00 H ATOM 22391 H2 WAT 3178 124.721 66.716 125.917 1.00 0.00 H TER 22393 WAT 3178 ATOM 22393 O WAT 3179 82.220 73.909 113.740 1.00 0.00 O ATOM 22394 H1 WAT 3179 81.575 74.616 113.734 1.00 0.00 H ATOM 22395 H2 WAT 3179 81.729 73.139 114.024 1.00 0.00 H TER 22397 WAT 3179 ATOM 22397 O WAT 3180 111.845 24.066 103.017 1.00 0.00 O ATOM 22398 H1 WAT 3180 112.562 23.439 102.925 1.00 0.00 H ATOM 22399 H2 WAT 3180 111.086 23.619 102.641 1.00 0.00 H TER 22401 WAT 3180 ATOM 22401 O WAT 3181 61.241 135.705 119.176 1.00 0.00 O ATOM 22402 H1 WAT 3181 60.449 135.483 118.687 1.00 0.00 H ATOM 22403 H2 WAT 3181 61.827 136.087 118.522 1.00 0.00 H TER 22405 WAT 3181 ATOM 22405 O WAT 3182 81.788 21.802 151.745 1.00 0.00 O ATOM 22406 H1 WAT 3182 81.656 22.353 150.973 1.00 0.00 H ATOM 22407 H2 WAT 3182 82.711 21.920 151.968 1.00 0.00 H TER 22409 WAT 3182 ATOM 22409 O WAT 3183 39.481 40.832 10.326 1.00 0.00 O ATOM 22410 H1 WAT 3183 40.231 40.710 9.743 1.00 0.00 H ATOM 22411 H2 WAT 3183 39.540 41.746 10.604 1.00 0.00 H TER 22413 WAT 3183 ATOM 22413 O WAT 3184 95.494 76.955 147.862 1.00 0.00 O ATOM 22414 H1 WAT 3184 96.183 76.312 148.030 1.00 0.00 H ATOM 22415 H2 WAT 3184 94.801 76.457 147.429 1.00 0.00 H TER 22417 WAT 3184 ATOM 22417 O WAT 3185 28.642 76.370 7.095 1.00 0.00 O ATOM 22418 H1 WAT 3185 28.871 77.180 7.551 1.00 0.00 H ATOM 22419 H2 WAT 3185 28.519 76.635 6.183 1.00 0.00 H TER 22421 WAT 3185 ATOM 22421 O WAT 3186 50.661 82.972 9.983 1.00 0.00 O ATOM 22422 H1 WAT 3186 50.591 82.828 9.039 1.00 0.00 H ATOM 22423 H2 WAT 3186 50.077 83.709 10.157 1.00 0.00 H TER 22425 WAT 3186 ATOM 22425 O WAT 3187 31.981 79.421 13.190 1.00 0.00 O ATOM 22426 H1 WAT 3187 31.650 80.261 12.874 1.00 0.00 H ATOM 22427 H2 WAT 3187 31.611 78.775 12.587 1.00 0.00 H TER 22429 WAT 3187 ATOM 22429 O WAT 3188 64.104 103.737 69.644 1.00 0.00 O ATOM 22430 H1 WAT 3188 64.572 102.910 69.527 1.00 0.00 H ATOM 22431 H2 WAT 3188 63.693 103.901 68.796 1.00 0.00 H TER 22433 WAT 3188 ATOM 22433 O WAT 3189 37.953 42.146 152.884 1.00 0.00 O ATOM 22434 H1 WAT 3189 37.023 42.210 153.103 1.00 0.00 H ATOM 22435 H2 WAT 3189 38.337 42.950 153.235 1.00 0.00 H TER 22437 WAT 3189 ATOM 22437 O WAT 3190 120.552 142.670 114.608 1.00 0.00 O ATOM 22438 H1 WAT 3190 120.063 141.932 114.244 1.00 0.00 H ATOM 22439 H2 WAT 3190 120.757 143.219 113.851 1.00 0.00 H TER 22441 WAT 3190 ATOM 22441 O WAT 3191 132.052 55.475 23.599 1.00 0.00 O ATOM 22442 H1 WAT 3191 132.021 54.531 23.443 1.00 0.00 H ATOM 22443 H2 WAT 3191 131.263 55.814 23.178 1.00 0.00 H TER 22445 WAT 3191 ATOM 22445 O WAT 3192 43.804 82.084 60.898 1.00 0.00 O ATOM 22446 H1 WAT 3192 44.701 81.751 60.873 1.00 0.00 H ATOM 22447 H2 WAT 3192 43.272 81.321 61.124 1.00 0.00 H TER 22449 WAT 3192 ATOM 22449 O WAT 3193 56.660 87.807 119.611 1.00 0.00 O ATOM 22450 H1 WAT 3193 57.495 87.340 119.604 1.00 0.00 H ATOM 22451 H2 WAT 3193 56.307 87.681 118.731 1.00 0.00 H TER 22453 WAT 3193 ATOM 22453 O WAT 3194 21.238 89.759 142.132 1.00 0.00 O ATOM 22454 H1 WAT 3194 20.369 90.031 141.839 1.00 0.00 H ATOM 22455 H2 WAT 3194 21.164 89.705 143.085 1.00 0.00 H TER 22457 WAT 3194 ATOM 22457 O WAT 3195 11.164 71.308 95.579 1.00 0.00 O ATOM 22458 H1 WAT 3195 11.304 70.578 96.182 1.00 0.00 H ATOM 22459 H2 WAT 3195 10.261 71.583 95.741 1.00 0.00 H TER 22461 WAT 3195 ATOM 22461 O WAT 3196 33.252 108.134 29.302 1.00 0.00 O ATOM 22462 H1 WAT 3196 32.556 107.739 28.777 1.00 0.00 H ATOM 22463 H2 WAT 3196 32.840 108.894 29.714 1.00 0.00 H TER 22465 WAT 3196 ATOM 22465 O WAT 3197 108.846 138.745 135.074 1.00 0.00 O ATOM 22466 H1 WAT 3197 109.048 139.164 135.911 1.00 0.00 H ATOM 22467 H2 WAT 3197 109.629 138.883 134.542 1.00 0.00 H TER 22469 WAT 3197 ATOM 22469 O WAT 3198 4.943 19.329 148.187 1.00 0.00 O ATOM 22470 H1 WAT 3198 4.392 19.391 148.967 1.00 0.00 H ATOM 22471 H2 WAT 3198 5.453 20.139 148.188 1.00 0.00 H TER 22473 WAT 3198 ATOM 22473 O WAT 3199 46.730 61.420 81.280 1.00 0.00 O ATOM 22474 H1 WAT 3199 47.111 61.102 80.461 1.00 0.00 H ATOM 22475 H2 WAT 3199 46.034 62.016 81.004 1.00 0.00 H TER 22477 WAT 3199 ATOM 22477 O WAT 3200 125.094 87.691 97.330 1.00 0.00 O ATOM 22478 H1 WAT 3200 125.734 87.879 98.016 1.00 0.00 H ATOM 22479 H2 WAT 3200 125.555 87.111 96.725 1.00 0.00 H TER 22481 WAT 3200 ATOM 22481 O WAT 3201 16.153 98.583 128.168 1.00 0.00 O ATOM 22482 H1 WAT 3201 16.767 98.188 128.787 1.00 0.00 H ATOM 22483 H2 WAT 3201 15.362 98.049 128.241 1.00 0.00 H TER 22485 WAT 3201 ATOM 22485 O WAT 3202 132.501 130.448 116.868 1.00 0.00 O ATOM 22486 H1 WAT 3202 132.417 130.928 116.044 1.00 0.00 H ATOM 22487 H2 WAT 3202 133.143 129.762 116.681 1.00 0.00 H TER 22489 WAT 3202 ATOM 22489 O WAT 3203 132.332 14.865 82.375 1.00 0.00 O ATOM 22490 H1 WAT 3203 131.820 14.056 82.379 1.00 0.00 H ATOM 22491 H2 WAT 3203 132.316 15.155 81.463 1.00 0.00 H TER 22493 WAT 3203 ATOM 22493 O WAT 3204 131.685 87.263 103.046 1.00 0.00 O ATOM 22494 H1 WAT 3204 131.633 88.198 102.851 1.00 0.00 H ATOM 22495 H2 WAT 3204 132.516 86.984 102.662 1.00 0.00 H TER 22497 WAT 3204 ATOM 22497 O WAT 3205 29.750 100.075 134.240 1.00 0.00 O ATOM 22498 H1 WAT 3205 29.859 99.355 133.619 1.00 0.00 H ATOM 22499 H2 WAT 3205 30.559 100.075 134.752 1.00 0.00 H TER 22501 WAT 3205 ATOM 22501 O WAT 3206 65.998 94.914 84.190 1.00 0.00 O ATOM 22502 H1 WAT 3206 65.313 94.434 83.723 1.00 0.00 H ATOM 22503 H2 WAT 3206 66.749 94.322 84.188 1.00 0.00 H TER 22505 WAT 3206 ATOM 22505 O WAT 3207 54.615 137.361 147.447 1.00 0.00 O ATOM 22506 H1 WAT 3207 55.229 137.890 147.957 1.00 0.00 H ATOM 22507 H2 WAT 3207 54.904 136.459 147.586 1.00 0.00 H TER 22509 WAT 3207 ATOM 22509 O WAT 3208 13.768 11.057 105.650 1.00 0.00 O ATOM 22510 H1 WAT 3208 13.729 11.102 106.606 1.00 0.00 H ATOM 22511 H2 WAT 3208 13.758 11.971 105.367 1.00 0.00 H TER 22513 WAT 3208 ATOM 22513 O WAT 3209 0.105 78.477 83.591 1.00 0.00 O ATOM 22514 H1 WAT 3209 0.958 78.442 84.023 1.00 0.00 H ATOM 22515 H2 WAT 3209 -0.435 77.853 84.076 1.00 0.00 H TER 22517 WAT 3209 ATOM 22517 O WAT 3210 25.025 89.578 97.831 1.00 0.00 O ATOM 22518 H1 WAT 3210 25.306 88.667 97.742 1.00 0.00 H ATOM 22519 H2 WAT 3210 24.763 89.660 98.748 1.00 0.00 H TER 22521 WAT 3210 ATOM 22521 O WAT 3211 14.468 141.703 120.064 1.00 0.00 O ATOM 22522 H1 WAT 3211 13.729 141.645 119.458 1.00 0.00 H ATOM 22523 H2 WAT 3211 14.835 142.573 119.910 1.00 0.00 H TER 22525 WAT 3211 ATOM 22525 O WAT 3212 133.370 60.122 17.218 1.00 0.00 O ATOM 22526 H1 WAT 3212 133.286 60.311 18.152 1.00 0.00 H ATOM 22527 H2 WAT 3212 132.471 59.986 16.919 1.00 0.00 H TER 22529 WAT 3212 ATOM 22529 O WAT 3213 71.367 107.268 126.819 1.00 0.00 O ATOM 22530 H1 WAT 3213 72.026 106.816 126.292 1.00 0.00 H ATOM 22531 H2 WAT 3213 71.107 108.019 126.285 1.00 0.00 H TER 22533 WAT 3213 ATOM 22533 O WAT 3214 119.455 67.490 62.928 1.00 0.00 O ATOM 22534 H1 WAT 3214 118.672 67.142 62.501 1.00 0.00 H ATOM 22535 H2 WAT 3214 119.520 68.391 62.611 1.00 0.00 H TER 22537 WAT 3214 ATOM 22537 O WAT 3215 122.818 104.832 99.613 1.00 0.00 O ATOM 22538 H1 WAT 3215 123.039 105.601 99.087 1.00 0.00 H ATOM 22539 H2 WAT 3215 123.493 104.805 100.291 1.00 0.00 H TER 22541 WAT 3215 ATOM 22541 O WAT 3216 73.187 42.250 14.051 1.00 0.00 O ATOM 22542 H1 WAT 3216 73.369 42.259 14.991 1.00 0.00 H ATOM 22543 H2 WAT 3216 72.534 41.560 13.940 1.00 0.00 H TER 22545 WAT 3216 ATOM 22545 O WAT 3217 58.493 16.882 2.148 1.00 0.00 O ATOM 22546 H1 WAT 3217 58.303 16.088 2.648 1.00 0.00 H ATOM 22547 H2 WAT 3217 58.912 16.565 1.348 1.00 0.00 H TER 22549 WAT 3217 ATOM 22549 O WAT 3218 142.614 15.290 97.924 1.00 0.00 O ATOM 22550 H1 WAT 3218 142.750 16.187 98.228 1.00 0.00 H ATOM 22551 H2 WAT 3218 143.446 14.850 98.096 1.00 0.00 H TER 22553 WAT 3218 ATOM 22553 O WAT 3219 53.125 134.485 97.281 1.00 0.00 O ATOM 22554 H1 WAT 3219 53.138 135.441 97.229 1.00 0.00 H ATOM 22555 H2 WAT 3219 53.715 134.277 98.006 1.00 0.00 H TER 22557 WAT 3219 ATOM 22557 O WAT 3220 78.482 50.182 55.783 1.00 0.00 O ATOM 22558 H1 WAT 3220 78.319 49.778 54.931 1.00 0.00 H ATOM 22559 H2 WAT 3220 77.612 50.409 56.111 1.00 0.00 H TER 22561 WAT 3220 ATOM 22561 O WAT 3221 78.923 75.524 9.959 1.00 0.00 O ATOM 22562 H1 WAT 3221 79.275 76.384 10.185 1.00 0.00 H ATOM 22563 H2 WAT 3221 79.693 74.960 9.891 1.00 0.00 H TER 22565 WAT 3221 ATOM 22565 O WAT 3222 126.418 27.925 76.160 1.00 0.00 O ATOM 22566 H1 WAT 3222 127.137 28.487 76.451 1.00 0.00 H ATOM 22567 H2 WAT 3222 125.748 28.535 75.850 1.00 0.00 H TER 22569 WAT 3222 ATOM 22569 O WAT 3223 55.988 111.921 6.493 1.00 0.00 O ATOM 22570 H1 WAT 3223 55.509 112.437 5.845 1.00 0.00 H ATOM 22571 H2 WAT 3223 55.945 111.023 6.164 1.00 0.00 H TER 22573 WAT 3223 ATOM 22573 O WAT 3224 65.261 16.342 92.793 1.00 0.00 O ATOM 22574 H1 WAT 3224 64.324 16.531 92.833 1.00 0.00 H ATOM 22575 H2 WAT 3224 65.328 15.415 93.024 1.00 0.00 H TER 22577 WAT 3224 ATOM 22577 O WAT 3225 28.578 125.863 155.009 1.00 0.00 O ATOM 22578 H1 WAT 3225 27.965 125.789 154.278 1.00 0.00 H ATOM 22579 H2 WAT 3225 29.325 126.340 154.649 1.00 0.00 H TER 22581 WAT 3225 ATOM 22581 O WAT 3226 60.461 57.198 31.652 1.00 0.00 O ATOM 22582 H1 WAT 3226 59.514 57.086 31.731 1.00 0.00 H ATOM 22583 H2 WAT 3226 60.759 56.406 31.204 1.00 0.00 H TER 22585 WAT 3226 ATOM 22585 O WAT 3227 33.351 48.434 147.353 1.00 0.00 O ATOM 22586 H1 WAT 3227 33.644 49.340 147.454 1.00 0.00 H ATOM 22587 H2 WAT 3227 32.530 48.500 146.865 1.00 0.00 H TER 22589 WAT 3227 ATOM 22589 O WAT 3228 9.683 32.776 113.517 1.00 0.00 O ATOM 22590 H1 WAT 3228 9.073 32.352 112.913 1.00 0.00 H ATOM 22591 H2 WAT 3228 10.407 33.066 112.962 1.00 0.00 H TER 22593 WAT 3228 ATOM 22593 O WAT 3229 52.294 79.148 104.371 1.00 0.00 O ATOM 22594 H1 WAT 3229 53.132 79.612 104.351 1.00 0.00 H ATOM 22595 H2 WAT 3229 52.488 78.322 104.815 1.00 0.00 H TER 22597 WAT 3229 ATOM 22597 O WAT 3230 17.185 23.649 140.137 1.00 0.00 O ATOM 22598 H1 WAT 3230 16.635 24.207 139.587 1.00 0.00 H ATOM 22599 H2 WAT 3230 17.755 23.191 139.519 1.00 0.00 H TER 22601 WAT 3230 ATOM 22601 O WAT 3231 34.249 50.401 14.922 1.00 0.00 O ATOM 22602 H1 WAT 3231 33.862 51.223 14.620 1.00 0.00 H ATOM 22603 H2 WAT 3231 34.594 50.605 15.792 1.00 0.00 H TER 22605 WAT 3231 ATOM 22605 O WAT 3232 131.419 39.396 59.542 1.00 0.00 O ATOM 22606 H1 WAT 3232 130.849 40.150 59.691 1.00 0.00 H ATOM 22607 H2 WAT 3232 130.861 38.637 59.713 1.00 0.00 H TER 22609 WAT 3232 ATOM 22609 O WAT 3233 137.707 61.177 75.340 1.00 0.00 O ATOM 22610 H1 WAT 3233 138.252 61.252 74.557 1.00 0.00 H ATOM 22611 H2 WAT 3233 138.214 61.610 76.027 1.00 0.00 H TER 22613 WAT 3233 ATOM 22613 O WAT 3234 5.174 47.573 80.574 1.00 0.00 O ATOM 22614 H1 WAT 3234 5.453 47.200 79.738 1.00 0.00 H ATOM 22615 H2 WAT 3234 5.976 47.622 81.094 1.00 0.00 H TER 22617 WAT 3234 ATOM 22617 O WAT 3235 120.572 64.228 114.031 1.00 0.00 O ATOM 22618 H1 WAT 3235 120.815 63.958 114.916 1.00 0.00 H ATOM 22619 H2 WAT 3235 121.402 64.452 113.612 1.00 0.00 H TER 22621 WAT 3235 ATOM 22621 O WAT 3236 46.394 10.621 84.779 1.00 0.00 O ATOM 22622 H1 WAT 3236 47.327 10.651 84.564 1.00 0.00 H ATOM 22623 H2 WAT 3236 46.230 11.439 85.248 1.00 0.00 H TER 22625 WAT 3236 ATOM 22625 O WAT 3237 95.281 93.168 77.793 1.00 0.00 O ATOM 22626 H1 WAT 3237 96.152 93.555 77.713 1.00 0.00 H ATOM 22627 H2 WAT 3237 95.020 93.348 78.697 1.00 0.00 H TER 22629 WAT 3237 ATOM 22629 O WAT 3238 45.257 4.406 73.444 1.00 0.00 O ATOM 22630 H1 WAT 3238 44.766 3.599 73.289 1.00 0.00 H ATOM 22631 H2 WAT 3238 46.153 4.197 73.179 1.00 0.00 H TER 22633 WAT 3238 ATOM 22633 O WAT 3239 113.048 16.776 107.113 1.00 0.00 O ATOM 22634 H1 WAT 3239 112.872 16.785 108.054 1.00 0.00 H ATOM 22635 H2 WAT 3239 112.757 17.635 106.806 1.00 0.00 H TER 22637 WAT 3239 ATOM 22637 O WAT 3240 85.482 4.531 146.764 1.00 0.00 O ATOM 22638 H1 WAT 3240 84.875 4.332 146.051 1.00 0.00 H ATOM 22639 H2 WAT 3240 85.077 5.266 147.224 1.00 0.00 H TER 22641 WAT 3240 ATOM 22641 O WAT 3241 36.744 122.318 107.027 1.00 0.00 O ATOM 22642 H1 WAT 3241 37.445 122.850 106.651 1.00 0.00 H ATOM 22643 H2 WAT 3241 36.150 122.152 106.294 1.00 0.00 H TER 22645 WAT 3241 ATOM 22645 O WAT 3242 46.720 129.916 57.051 1.00 0.00 O ATOM 22646 H1 WAT 3242 46.084 129.221 56.881 1.00 0.00 H ATOM 22647 H2 WAT 3242 47.214 129.608 57.811 1.00 0.00 H TER 22649 WAT 3242 ATOM 22649 O WAT 3243 91.372 8.764 0.783 1.00 0.00 O ATOM 22650 H1 WAT 3243 92.186 9.097 1.159 1.00 0.00 H ATOM 22651 H2 WAT 3243 90.934 9.540 0.433 1.00 0.00 H TER 22653 WAT 3243 ATOM 22653 O WAT 3244 132.445 85.309 74.670 1.00 0.00 O ATOM 22654 H1 WAT 3244 133.377 85.526 74.633 1.00 0.00 H ATOM 22655 H2 WAT 3244 132.142 85.404 73.767 1.00 0.00 H TER 22657 WAT 3244 ATOM 22657 O WAT 3245 23.460 142.402 118.520 1.00 0.00 O ATOM 22658 H1 WAT 3245 24.326 142.738 118.750 1.00 0.00 H ATOM 22659 H2 WAT 3245 22.885 143.166 118.572 1.00 0.00 H TER 22661 WAT 3245 ATOM 22661 O WAT 3246 47.136 17.740 132.831 1.00 0.00 O ATOM 22662 H1 WAT 3246 47.424 18.652 132.797 1.00 0.00 H ATOM 22663 H2 WAT 3246 47.684 17.292 132.187 1.00 0.00 H TER 22665 WAT 3246 ATOM 22665 O WAT 3247 113.551 4.479 122.095 1.00 0.00 O ATOM 22666 H1 WAT 3247 114.167 4.541 122.826 1.00 0.00 H ATOM 22667 H2 WAT 3247 112.932 5.195 122.243 1.00 0.00 H TER 22669 WAT 3247 ATOM 22669 O WAT 3248 63.158 89.187 17.448 1.00 0.00 O ATOM 22670 H1 WAT 3248 63.108 89.562 18.327 1.00 0.00 H ATOM 22671 H2 WAT 3248 63.623 89.847 16.932 1.00 0.00 H TER 22673 WAT 3248 ATOM 22673 O WAT 3249 90.877 120.385 6.180 1.00 0.00 O ATOM 22674 H1 WAT 3249 90.485 121.238 6.366 1.00 0.00 H ATOM 22675 H2 WAT 3249 91.638 120.340 6.760 1.00 0.00 H TER 22677 WAT 3249 ATOM 22677 O WAT 3250 133.829 74.452 103.428 1.00 0.00 O ATOM 22678 H1 WAT 3250 134.548 74.808 103.951 1.00 0.00 H ATOM 22679 H2 WAT 3250 133.767 73.536 103.698 1.00 0.00 H TER 22681 WAT 3250 ATOM 22681 O WAT 3251 9.075 55.225 74.179 1.00 0.00 O ATOM 22682 H1 WAT 3251 8.397 55.464 74.811 1.00 0.00 H ATOM 22683 H2 WAT 3251 9.755 55.889 74.295 1.00 0.00 H TER 22685 WAT 3251 ATOM 22685 O WAT 3252 145.310 5.262 8.986 1.00 0.00 O ATOM 22686 H1 WAT 3252 145.867 4.503 9.155 1.00 0.00 H ATOM 22687 H2 WAT 3252 145.726 5.706 8.247 1.00 0.00 H TER 22689 WAT 3252 ATOM 22689 O WAT 3253 7.231 104.902 115.283 1.00 0.00 O ATOM 22690 H1 WAT 3253 6.494 104.411 115.646 1.00 0.00 H ATOM 22691 H2 WAT 3253 7.992 104.343 115.443 1.00 0.00 H TER 22693 WAT 3253 ATOM 22693 O WAT 3254 4.305 129.320 72.504 1.00 0.00 O ATOM 22694 H1 WAT 3254 4.165 129.857 73.284 1.00 0.00 H ATOM 22695 H2 WAT 3254 5.088 129.690 72.096 1.00 0.00 H TER 22697 WAT 3254 ATOM 22697 O WAT 3255 49.783 128.977 15.145 1.00 0.00 O ATOM 22698 H1 WAT 3255 48.840 129.037 15.299 1.00 0.00 H ATOM 22699 H2 WAT 3255 49.892 128.170 14.642 1.00 0.00 H TER 22701 WAT 3255 ATOM 22701 O WAT 3256 94.433 55.107 149.135 1.00 0.00 O ATOM 22702 H1 WAT 3256 94.440 56.048 148.956 1.00 0.00 H ATOM 22703 H2 WAT 3256 93.505 54.874 149.150 1.00 0.00 H TER 22705 WAT 3256 ATOM 22705 O WAT 3257 100.168 142.585 22.708 1.00 0.00 O ATOM 22706 H1 WAT 3257 99.589 142.736 23.455 1.00 0.00 H ATOM 22707 H2 WAT 3257 100.307 141.638 22.700 1.00 0.00 H TER 22709 WAT 3257 ATOM 22709 O WAT 3258 136.668 29.367 4.097 1.00 0.00 O ATOM 22710 H1 WAT 3258 136.241 28.743 4.684 1.00 0.00 H ATOM 22711 H2 WAT 3258 137.600 29.288 4.301 1.00 0.00 H TER 22713 WAT 3258 ATOM 22713 O WAT 3259 130.568 93.104 62.733 1.00 0.00 O ATOM 22714 H1 WAT 3259 130.976 93.716 63.346 1.00 0.00 H ATOM 22715 H2 WAT 3259 130.496 92.285 63.225 1.00 0.00 H TER 22717 WAT 3259 ATOM 22717 O WAT 3260 4.445 140.230 120.692 1.00 0.00 O ATOM 22718 H1 WAT 3260 3.495 140.115 120.680 1.00 0.00 H ATOM 22719 H2 WAT 3260 4.714 139.914 121.554 1.00 0.00 H TER 22721 WAT 3260 ATOM 22721 O WAT 3261 43.558 2.181 153.502 1.00 0.00 O ATOM 22722 H1 WAT 3261 43.892 1.580 152.836 1.00 0.00 H ATOM 22723 H2 WAT 3261 44.259 2.821 153.621 1.00 0.00 H TER 22725 WAT 3261 ATOM 22725 O WAT 3262 135.277 76.178 81.153 1.00 0.00 O ATOM 22726 H1 WAT 3262 134.510 75.609 81.093 1.00 0.00 H ATOM 22727 H2 WAT 3262 135.178 76.790 80.424 1.00 0.00 H TER 22729 WAT 3262 ATOM 22729 O WAT 3263 108.672 50.437 73.289 1.00 0.00 O ATOM 22730 H1 WAT 3263 109.328 49.807 73.588 1.00 0.00 H ATOM 22731 H2 WAT 3263 109.175 51.223 73.076 1.00 0.00 H TER 22733 WAT 3263 ATOM 22733 O WAT 3264 3.188 21.425 70.877 1.00 0.00 O ATOM 22734 H1 WAT 3264 3.611 20.566 70.883 1.00 0.00 H ATOM 22735 H2 WAT 3264 2.412 21.306 70.329 1.00 0.00 H TER 22737 WAT 3264 ATOM 22737 O WAT 3265 141.867 5.952 65.144 1.00 0.00 O ATOM 22738 H1 WAT 3265 142.669 6.139 64.658 1.00 0.00 H ATOM 22739 H2 WAT 3265 141.195 5.854 64.470 1.00 0.00 H TER 22741 WAT 3265 ATOM 22741 O WAT 3266 60.257 48.103 123.716 1.00 0.00 O ATOM 22742 H1 WAT 3266 59.512 48.362 124.258 1.00 0.00 H ATOM 22743 H2 WAT 3266 60.607 47.323 124.147 1.00 0.00 H TER 22745 WAT 3266 ATOM 22745 O WAT 3267 14.776 97.672 134.829 1.00 0.00 O ATOM 22746 H1 WAT 3267 14.730 98.605 134.617 1.00 0.00 H ATOM 22747 H2 WAT 3267 15.330 97.298 134.143 1.00 0.00 H TER 22749 WAT 3267 ATOM 22749 O WAT 3268 135.802 113.570 66.260 1.00 0.00 O ATOM 22750 H1 WAT 3268 136.251 112.798 66.603 1.00 0.00 H ATOM 22751 H2 WAT 3268 135.584 113.338 65.357 1.00 0.00 H TER 22753 WAT 3268 ATOM 22753 O WAT 3269 105.625 1.419 124.180 1.00 0.00 O ATOM 22754 H1 WAT 3269 106.026 1.160 125.010 1.00 0.00 H ATOM 22755 H2 WAT 3269 105.014 0.710 123.978 1.00 0.00 H TER 22757 WAT 3269 ATOM 22757 O WAT 3270 77.286 108.968 90.808 1.00 0.00 O ATOM 22758 H1 WAT 3270 77.220 108.186 90.259 1.00 0.00 H ATOM 22759 H2 WAT 3270 76.390 109.299 90.861 1.00 0.00 H TER 22761 WAT 3270 ATOM 22761 O WAT 3271 0.521 38.180 133.442 1.00 0.00 O ATOM 22762 H1 WAT 3271 0.723 37.260 133.272 1.00 0.00 H ATOM 22763 H2 WAT 3271 -0.101 38.158 134.170 1.00 0.00 H TER 22765 WAT 3271 ATOM 22765 O WAT 3272 18.632 135.962 69.656 1.00 0.00 O ATOM 22766 H1 WAT 3272 18.819 135.750 68.742 1.00 0.00 H ATOM 22767 H2 WAT 3272 19.296 136.609 69.893 1.00 0.00 H TER 22769 WAT 3272 ATOM 22769 O WAT 3273 29.024 140.197 53.706 1.00 0.00 O ATOM 22770 H1 WAT 3273 29.810 140.731 53.590 1.00 0.00 H ATOM 22771 H2 WAT 3273 29.315 139.301 53.535 1.00 0.00 H TER 22773 WAT 3273 ATOM 22773 O WAT 3274 11.213 99.837 127.283 1.00 0.00 O ATOM 22774 H1 WAT 3274 11.716 100.564 127.650 1.00 0.00 H ATOM 22775 H2 WAT 3274 11.818 99.096 127.298 1.00 0.00 H TER 22777 WAT 3274 ATOM 22777 O WAT 3275 39.135 140.730 74.387 1.00 0.00 O ATOM 22778 H1 WAT 3275 38.606 140.079 73.926 1.00 0.00 H ATOM 22779 H2 WAT 3275 39.821 140.966 73.764 1.00 0.00 H TER 22781 WAT 3275 ATOM 22781 O WAT 3276 17.027 53.663 147.615 1.00 0.00 O ATOM 22782 H1 WAT 3276 17.578 54.251 147.098 1.00 0.00 H ATOM 22783 H2 WAT 3276 16.132 53.933 147.411 1.00 0.00 H TER 22785 WAT 3276 ATOM 22785 O WAT 3277 1.214 43.080 73.713 1.00 0.00 O ATOM 22786 H1 WAT 3277 1.363 43.673 74.449 1.00 0.00 H ATOM 22787 H2 WAT 3277 0.660 42.387 74.072 1.00 0.00 H TER 22789 WAT 3277 ATOM 22789 O WAT 3278 7.820 137.371 96.363 1.00 0.00 O ATOM 22790 H1 WAT 3278 8.355 137.921 96.936 1.00 0.00 H ATOM 22791 H2 WAT 3278 7.378 136.765 96.958 1.00 0.00 H TER 22793 WAT 3278 ATOM 22793 O WAT 3279 112.547 19.266 105.722 1.00 0.00 O ATOM 22794 H1 WAT 3279 111.890 19.945 105.568 1.00 0.00 H ATOM 22795 H2 WAT 3279 112.959 19.133 104.868 1.00 0.00 H TER 22797 WAT 3279 ATOM 22797 O WAT 3280 7.666 133.999 75.735 1.00 0.00 O ATOM 22798 H1 WAT 3280 7.595 133.120 75.361 1.00 0.00 H ATOM 22799 H2 WAT 3280 8.499 133.993 76.206 1.00 0.00 H TER 22801 WAT 3280 ATOM 22801 O WAT 3281 135.999 27.651 116.334 1.00 0.00 O ATOM 22802 H1 WAT 3281 136.806 27.381 116.772 1.00 0.00 H ATOM 22803 H2 WAT 3281 135.538 28.179 116.985 1.00 0.00 H TER 22805 WAT 3281 ATOM 22805 O WAT 3282 113.463 77.492 95.756 1.00 0.00 O ATOM 22806 H1 WAT 3282 113.780 77.484 94.853 1.00 0.00 H ATOM 22807 H2 WAT 3282 113.181 78.395 95.902 1.00 0.00 H TER 22809 WAT 3282 ATOM 22809 O WAT 3283 9.730 137.110 138.162 1.00 0.00 O ATOM 22810 H1 WAT 3283 8.908 137.447 137.804 1.00 0.00 H ATOM 22811 H2 WAT 3283 10.296 136.997 137.398 1.00 0.00 H TER 22813 WAT 3283 ATOM 22813 O WAT 3284 100.430 4.768 85.993 1.00 0.00 O ATOM 22814 H1 WAT 3284 99.609 4.585 86.451 1.00 0.00 H ATOM 22815 H2 WAT 3284 100.212 4.678 85.066 1.00 0.00 H TER 22817 WAT 3284 ATOM 22817 O WAT 3285 14.312 70.341 4.624 1.00 0.00 O ATOM 22818 H1 WAT 3285 13.638 70.556 5.270 1.00 0.00 H ATOM 22819 H2 WAT 3285 14.573 69.446 4.839 1.00 0.00 H TER 22821 WAT 3285 ATOM 22821 O WAT 3286 32.845 43.127 95.169 1.00 0.00 O ATOM 22822 H1 WAT 3286 33.065 42.223 94.945 1.00 0.00 H ATOM 22823 H2 WAT 3286 32.916 43.603 94.342 1.00 0.00 H TER 22825 WAT 3286 ATOM 22825 O WAT 3287 44.780 30.722 128.347 1.00 0.00 O ATOM 22826 H1 WAT 3287 45.698 30.895 128.140 1.00 0.00 H ATOM 22827 H2 WAT 3287 44.292 31.141 127.638 1.00 0.00 H TER 22829 WAT 3287 ATOM 22829 O WAT 3288 36.914 99.307 86.677 1.00 0.00 O ATOM 22830 H1 WAT 3288 36.916 99.814 87.489 1.00 0.00 H ATOM 22831 H2 WAT 3288 36.989 98.397 86.962 1.00 0.00 H TER 22833 WAT 3288 ATOM 22833 O WAT 3289 108.954 122.911 20.465 1.00 0.00 O ATOM 22834 H1 WAT 3289 108.776 122.116 20.967 1.00 0.00 H ATOM 22835 H2 WAT 3289 109.860 122.813 20.175 1.00 0.00 H TER 22837 WAT 3289 ATOM 22837 O WAT 3290 71.170 128.627 60.550 1.00 0.00 O ATOM 22838 H1 WAT 3290 71.024 129.550 60.756 1.00 0.00 H ATOM 22839 H2 WAT 3290 70.984 128.167 61.369 1.00 0.00 H TER 22841 WAT 3290 ATOM 22841 O WAT 3291 110.538 95.077 20.694 1.00 0.00 O ATOM 22842 H1 WAT 3291 111.270 95.050 20.078 1.00 0.00 H ATOM 22843 H2 WAT 3291 110.664 95.891 21.181 1.00 0.00 H TER 22845 WAT 3291 ATOM 22845 O WAT 3292 20.799 80.676 90.408 1.00 0.00 O ATOM 22846 H1 WAT 3292 19.881 80.404 90.417 1.00 0.00 H ATOM 22847 H2 WAT 3292 21.263 79.966 90.852 1.00 0.00 H TER 22849 WAT 3292 ATOM 22849 O WAT 3293 44.609 12.787 9.086 1.00 0.00 O ATOM 22850 H1 WAT 3293 44.251 12.022 9.538 1.00 0.00 H ATOM 22851 H2 WAT 3293 45.488 12.518 8.820 1.00 0.00 H TER 22853 WAT 3293 ATOM 22853 O WAT 3294 129.731 84.933 4.248 1.00 0.00 O ATOM 22854 H1 WAT 3294 129.792 84.981 3.294 1.00 0.00 H ATOM 22855 H2 WAT 3294 129.353 85.773 4.507 1.00 0.00 H TER 22857 WAT 3294 ATOM 22857 O WAT 3295 7.245 70.325 73.677 1.00 0.00 O ATOM 22858 H1 WAT 3295 7.841 70.369 72.930 1.00 0.00 H ATOM 22859 H2 WAT 3295 7.819 70.329 74.443 1.00 0.00 H TER 22861 WAT 3295 ATOM 22861 O WAT 3296 42.141 56.635 94.402 1.00 0.00 O ATOM 22862 H1 WAT 3296 41.629 57.186 94.995 1.00 0.00 H ATOM 22863 H2 WAT 3296 41.940 55.740 94.674 1.00 0.00 H TER 22865 WAT 3296 ATOM 22865 O WAT 3297 66.275 86.655 74.910 1.00 0.00 O ATOM 22866 H1 WAT 3297 66.840 87.390 74.670 1.00 0.00 H ATOM 22867 H2 WAT 3297 66.746 86.212 75.616 1.00 0.00 H TER 22869 WAT 3297 ATOM 22869 O WAT 3298 129.615 109.742 109.687 1.00 0.00 O ATOM 22870 H1 WAT 3298 128.898 110.264 110.048 1.00 0.00 H ATOM 22871 H2 WAT 3298 129.343 108.834 109.825 1.00 0.00 H TER 22873 WAT 3298 ATOM 22873 O WAT 3299 106.767 36.516 135.891 1.00 0.00 O ATOM 22874 H1 WAT 3299 106.879 35.756 136.462 1.00 0.00 H ATOM 22875 H2 WAT 3299 106.641 36.143 135.019 1.00 0.00 H TER 22877 WAT 3299 ATOM 22877 O WAT 3300 136.202 43.974 6.659 1.00 0.00 O ATOM 22878 H1 WAT 3300 136.740 44.392 5.987 1.00 0.00 H ATOM 22879 H2 WAT 3300 136.231 44.579 7.400 1.00 0.00 H TER 22881 WAT 3300 ATOM 22881 O WAT 3301 42.805 59.418 123.084 1.00 0.00 O ATOM 22882 H1 WAT 3301 42.830 58.481 122.890 1.00 0.00 H ATOM 22883 H2 WAT 3301 43.725 59.674 123.150 1.00 0.00 H TER 22885 WAT 3301 ATOM 22885 O WAT 3302 45.401 93.091 134.582 1.00 0.00 O ATOM 22886 H1 WAT 3302 45.296 92.359 133.974 1.00 0.00 H ATOM 22887 H2 WAT 3302 44.645 93.654 134.413 1.00 0.00 H TER 22889 WAT 3302 ATOM 22889 O WAT 3303 131.358 123.515 126.279 1.00 0.00 O ATOM 22890 H1 WAT 3303 131.044 123.158 127.110 1.00 0.00 H ATOM 22891 H2 WAT 3303 132.029 124.150 126.530 1.00 0.00 H TER 22893 WAT 3303 ATOM 22893 O WAT 3304 80.266 116.884 152.816 1.00 0.00 O ATOM 22894 H1 WAT 3304 80.906 116.616 152.157 1.00 0.00 H ATOM 22895 H2 WAT 3304 80.227 116.147 153.426 1.00 0.00 H TER 22897 WAT 3304 ATOM 22897 O WAT 3305 99.694 111.623 104.686 1.00 0.00 O ATOM 22898 H1 WAT 3305 99.446 110.898 105.260 1.00 0.00 H ATOM 22899 H2 WAT 3305 99.677 112.394 105.254 1.00 0.00 H TER 22901 WAT 3305 ATOM 22901 O WAT 3306 105.389 141.273 141.664 1.00 0.00 O ATOM 22902 H1 WAT 3306 105.508 140.478 142.184 1.00 0.00 H ATOM 22903 H2 WAT 3306 104.682 141.058 141.055 1.00 0.00 H TER 22905 WAT 3306 ATOM 22905 O WAT 3307 130.302 135.603 120.898 1.00 0.00 O ATOM 22906 H1 WAT 3307 131.189 135.683 121.247 1.00 0.00 H ATOM 22907 H2 WAT 3307 130.250 134.701 120.580 1.00 0.00 H TER 22909 WAT 3307 ATOM 22909 O WAT 3308 21.877 117.860 154.317 1.00 0.00 O ATOM 22910 H1 WAT 3308 21.457 118.406 154.981 1.00 0.00 H ATOM 22911 H2 WAT 3308 22.780 118.176 154.283 1.00 0.00 H TER 22913 WAT 3308 ATOM 22913 O WAT 3309 11.329 113.674 13.641 1.00 0.00 O ATOM 22914 H1 WAT 3309 11.742 113.351 14.442 1.00 0.00 H ATOM 22915 H2 WAT 3309 10.949 114.516 13.890 1.00 0.00 H TER 22917 WAT 3309 ATOM 22917 O WAT 3310 140.226 61.721 91.115 1.00 0.00 O ATOM 22918 H1 WAT 3310 140.796 61.420 91.823 1.00 0.00 H ATOM 22919 H2 WAT 3310 140.140 62.663 91.261 1.00 0.00 H TER 22921 WAT 3310 ATOM 22921 O WAT 3311 36.574 87.013 107.440 1.00 0.00 O ATOM 22922 H1 WAT 3311 36.772 86.452 106.690 1.00 0.00 H ATOM 22923 H2 WAT 3311 36.468 86.406 108.172 1.00 0.00 H TER 22925 WAT 3311 ATOM 22925 O WAT 3312 40.590 5.170 124.738 1.00 0.00 O ATOM 22926 H1 WAT 3312 40.539 4.712 125.577 1.00 0.00 H ATOM 22927 H2 WAT 3312 40.074 4.630 124.139 1.00 0.00 H TER 22929 WAT 3312 ATOM 22929 O WAT 3313 45.445 38.086 121.922 1.00 0.00 O ATOM 22930 H1 WAT 3313 44.619 38.560 121.816 1.00 0.00 H ATOM 22931 H2 WAT 3313 45.402 37.384 121.273 1.00 0.00 H TER 22933 WAT 3313 ATOM 22933 O WAT 3314 73.601 21.795 8.811 1.00 0.00 O ATOM 22934 H1 WAT 3314 74.536 21.919 8.646 1.00 0.00 H ATOM 22935 H2 WAT 3314 73.334 21.123 8.183 1.00 0.00 H TER 22937 WAT 3314 ATOM 22937 O WAT 3315 10.426 124.643 157.671 1.00 0.00 O ATOM 22938 H1 WAT 3315 11.048 124.544 156.950 1.00 0.00 H ATOM 22939 H2 WAT 3315 9.567 124.623 157.250 1.00 0.00 H TER 22941 WAT 3315 ATOM 22941 O WAT 3316 8.522 120.995 60.923 1.00 0.00 O ATOM 22942 H1 WAT 3316 9.077 121.741 61.152 1.00 0.00 H ATOM 22943 H2 WAT 3316 7.630 121.337 60.972 1.00 0.00 H TER 22945 WAT 3316 ATOM 22945 O WAT 3317 37.346 122.991 12.351 1.00 0.00 O ATOM 22946 H1 WAT 3317 37.000 123.805 11.984 1.00 0.00 H ATOM 22947 H2 WAT 3317 36.877 122.300 11.884 1.00 0.00 H TER 22949 WAT 3317 ATOM 22949 O WAT 3318 45.059 109.406 133.841 1.00 0.00 O ATOM 22950 H1 WAT 3318 45.900 109.232 134.263 1.00 0.00 H ATOM 22951 H2 WAT 3318 45.279 109.938 133.077 1.00 0.00 H TER 22953 WAT 3318 ATOM 22953 O WAT 3319 17.897 121.495 143.974 1.00 0.00 O ATOM 22954 H1 WAT 3319 17.645 120.661 143.577 1.00 0.00 H ATOM 22955 H2 WAT 3319 18.657 121.781 143.468 1.00 0.00 H TER 22957 WAT 3319 ATOM 22957 O WAT 3320 135.771 129.597 130.598 1.00 0.00 O ATOM 22958 H1 WAT 3320 136.155 128.776 130.290 1.00 0.00 H ATOM 22959 H2 WAT 3320 134.910 129.630 130.181 1.00 0.00 H TER 22961 WAT 3320 ATOM 22961 O WAT 3321 115.933 9.595 64.099 1.00 0.00 O ATOM 22962 H1 WAT 3321 116.030 8.666 63.890 1.00 0.00 H ATOM 22963 H2 WAT 3321 115.476 9.605 64.940 1.00 0.00 H TER 22965 WAT 3321 ATOM 22965 O WAT 3322 23.601 145.804 99.615 1.00 0.00 O ATOM 22966 H1 WAT 3322 24.033 144.955 99.706 1.00 0.00 H ATOM 22967 H2 WAT 3322 24.319 146.431 99.528 1.00 0.00 H TER 22969 WAT 3322 ATOM 22969 O WAT 3323 138.306 97.338 155.324 1.00 0.00 O ATOM 22970 H1 WAT 3323 137.709 97.305 154.577 1.00 0.00 H ATOM 22971 H2 WAT 3323 137.741 97.217 156.088 1.00 0.00 H TER 22973 WAT 3323 ATOM 22973 O WAT 3324 61.253 17.244 6.185 1.00 0.00 O ATOM 22974 H1 WAT 3324 60.374 17.623 6.188 1.00 0.00 H ATOM 22975 H2 WAT 3324 61.124 16.338 6.466 1.00 0.00 H TER 22977 WAT 3324 ATOM 22977 O WAT 3325 19.435 68.422 73.384 1.00 0.00 O ATOM 22978 H1 WAT 3325 19.536 69.374 73.393 1.00 0.00 H ATOM 22979 H2 WAT 3325 18.515 68.277 73.605 1.00 0.00 H TER 22981 WAT 3325 ATOM 22981 O WAT 3326 24.001 98.442 127.374 1.00 0.00 O ATOM 22982 H1 WAT 3326 23.997 99.311 126.971 1.00 0.00 H ATOM 22983 H2 WAT 3326 23.374 97.936 126.858 1.00 0.00 H TER 22985 WAT 3326 ATOM 22985 O WAT 3327 10.463 111.173 111.471 1.00 0.00 O ATOM 22986 H1 WAT 3327 9.739 111.179 112.097 1.00 0.00 H ATOM 22987 H2 WAT 3327 10.856 110.306 111.568 1.00 0.00 H TER 22989 WAT 3327 ATOM 22989 O WAT 3328 7.458 117.027 101.048 1.00 0.00 O ATOM 22990 H1 WAT 3328 8.324 116.718 101.315 1.00 0.00 H ATOM 22991 H2 WAT 3328 7.531 117.981 101.057 1.00 0.00 H TER 22993 WAT 3328 ATOM 22993 O WAT 3329 100.623 118.905 157.233 1.00 0.00 O ATOM 22994 H1 WAT 3329 100.068 118.126 157.280 1.00 0.00 H ATOM 22995 H2 WAT 3329 100.242 119.427 156.527 1.00 0.00 H TER 22997 WAT 3329 ATOM 22997 O WAT 3330 0.129 54.748 155.891 1.00 0.00 O ATOM 22998 H1 WAT 3330 0.437 55.226 156.661 1.00 0.00 H ATOM 22999 H2 WAT 3330 -0.492 54.109 156.239 1.00 0.00 H TER 23001 WAT 3330 ATOM 23001 O WAT 3331 113.029 107.914 141.409 1.00 0.00 O ATOM 23002 H1 WAT 3331 113.754 108.014 142.025 1.00 0.00 H ATOM 23003 H2 WAT 3331 113.374 108.242 140.578 1.00 0.00 H TER 23005 WAT 3331 ATOM 23005 O WAT 3332 126.316 88.177 141.189 1.00 0.00 O ATOM 23006 H1 WAT 3332 126.371 87.437 140.585 1.00 0.00 H ATOM 23007 H2 WAT 3332 126.075 87.785 142.028 1.00 0.00 H TER 23009 WAT 3332 ATOM 23009 O WAT 3333 143.650 14.689 113.362 1.00 0.00 O ATOM 23010 H1 WAT 3333 143.801 15.624 113.228 1.00 0.00 H ATOM 23011 H2 WAT 3333 144.358 14.412 113.943 1.00 0.00 H TER 23013 WAT 3333 ATOM 23013 O WAT 3334 124.202 19.244 69.401 1.00 0.00 O ATOM 23014 H1 WAT 3334 124.154 19.288 68.446 1.00 0.00 H ATOM 23015 H2 WAT 3334 123.381 18.826 69.662 1.00 0.00 H TER 23017 WAT 3334 ATOM 23017 O WAT 3335 139.070 54.550 22.165 1.00 0.00 O ATOM 23018 H1 WAT 3335 138.810 55.443 22.391 1.00 0.00 H ATOM 23019 H2 WAT 3335 139.299 54.148 23.004 1.00 0.00 H TER 23021 WAT 3335 ATOM 23021 O WAT 3336 104.966 86.137 28.489 1.00 0.00 O ATOM 23022 H1 WAT 3336 105.498 86.042 27.699 1.00 0.00 H ATOM 23023 H2 WAT 3336 104.860 87.082 28.595 1.00 0.00 H TER 23025 WAT 3336 ATOM 23025 O WAT 3337 133.876 142.806 106.151 1.00 0.00 O ATOM 23026 H1 WAT 3337 134.511 142.102 106.281 1.00 0.00 H ATOM 23027 H2 WAT 3337 133.259 142.456 105.508 1.00 0.00 H TER 23029 WAT 3337 ATOM 23029 O WAT 3338 27.236 130.456 152.337 1.00 0.00 O ATOM 23030 H1 WAT 3338 26.535 130.403 152.986 1.00 0.00 H ATOM 23031 H2 WAT 3338 27.243 129.594 151.921 1.00 0.00 H TER 23033 WAT 3338 ATOM 23033 O WAT 3339 50.085 7.545 72.828 1.00 0.00 O ATOM 23034 H1 WAT 3339 49.796 8.272 73.380 1.00 0.00 H ATOM 23035 H2 WAT 3339 50.681 7.947 72.196 1.00 0.00 H TER 23037 WAT 3339 ATOM 23037 O WAT 3340 10.323 54.861 5.131 1.00 0.00 O ATOM 23038 H1 WAT 3340 10.907 55.409 4.607 1.00 0.00 H ATOM 23039 H2 WAT 3340 10.068 54.151 4.542 1.00 0.00 H TER 23041 WAT 3340 ATOM 23041 O WAT 3341 90.640 7.132 10.257 1.00 0.00 O ATOM 23042 H1 WAT 3341 89.817 7.475 9.910 1.00 0.00 H ATOM 23043 H2 WAT 3341 90.874 6.421 9.661 1.00 0.00 H TER 23045 WAT 3341 ATOM 23045 O WAT 3342 39.719 100.429 131.137 1.00 0.00 O ATOM 23046 H1 WAT 3342 39.234 100.227 130.336 1.00 0.00 H ATOM 23047 H2 WAT 3342 40.629 100.510 130.852 1.00 0.00 H TER 23049 WAT 3342 ATOM 23049 O WAT 3343 5.766 137.101 110.803 1.00 0.00 O ATOM 23050 H1 WAT 3343 6.503 137.284 110.220 1.00 0.00 H ATOM 23051 H2 WAT 3343 6.082 137.350 111.672 1.00 0.00 H TER 23053 WAT 3343 ATOM 23053 O WAT 3344 107.478 32.790 69.439 1.00 0.00 O ATOM 23054 H1 WAT 3344 106.626 33.071 69.773 1.00 0.00 H ATOM 23055 H2 WAT 3344 108.068 33.514 69.650 1.00 0.00 H TER 23057 WAT 3344 ATOM 23057 O WAT 3345 87.946 48.477 107.833 1.00 0.00 O ATOM 23058 H1 WAT 3345 87.352 49.119 108.221 1.00 0.00 H ATOM 23059 H2 WAT 3345 87.374 47.769 107.537 1.00 0.00 H TER 23061 WAT 3345 ATOM 23061 O WAT 3346 63.198 119.232 143.344 1.00 0.00 O ATOM 23062 H1 WAT 3346 62.722 119.221 144.174 1.00 0.00 H ATOM 23063 H2 WAT 3346 63.837 118.524 143.424 1.00 0.00 H TER 23065 WAT 3346 ATOM 23065 O WAT 3347 119.660 107.286 66.095 1.00 0.00 O ATOM 23066 H1 WAT 3347 119.767 108.236 66.041 1.00 0.00 H ATOM 23067 H2 WAT 3347 120.439 106.933 65.664 1.00 0.00 H TER 23069 WAT 3347 ATOM 23069 O WAT 3348 37.146 20.168 136.907 1.00 0.00 O ATOM 23070 H1 WAT 3348 37.564 19.430 137.351 1.00 0.00 H ATOM 23071 H2 WAT 3348 36.577 19.763 136.252 1.00 0.00 H TER 23073 WAT 3348 ATOM 23073 O WAT 3349 116.442 91.221 94.536 1.00 0.00 O ATOM 23074 H1 WAT 3349 116.579 90.571 93.846 1.00 0.00 H ATOM 23075 H2 WAT 3349 115.555 91.548 94.384 1.00 0.00 H TER 23077 WAT 3349 ATOM 23077 O WAT 3350 83.460 11.648 1.431 1.00 0.00 O ATOM 23078 H1 WAT 3350 83.349 10.778 1.815 1.00 0.00 H ATOM 23079 H2 WAT 3350 83.077 12.245 2.073 1.00 0.00 H TER 23081 WAT 3350 ATOM 23081 O WAT 3351 39.563 81.815 11.115 1.00 0.00 O ATOM 23082 H1 WAT 3351 40.184 82.543 11.092 1.00 0.00 H ATOM 23083 H2 WAT 3351 38.928 82.063 11.786 1.00 0.00 H TER 23085 WAT 3351 ATOM 23085 O WAT 3352 87.355 142.014 153.150 1.00 0.00 O ATOM 23086 H1 WAT 3352 86.575 142.007 152.596 1.00 0.00 H ATOM 23087 H2 WAT 3352 87.087 141.554 153.946 1.00 0.00 H TER 23089 WAT 3352 ATOM 23089 O WAT 3353 131.764 85.612 71.784 1.00 0.00 O ATOM 23090 H1 WAT 3353 131.437 86.475 71.532 1.00 0.00 H ATOM 23091 H2 WAT 3353 132.701 85.742 71.925 1.00 0.00 H TER 23093 WAT 3353 ATOM 23093 O WAT 3354 25.185 81.038 9.615 1.00 0.00 O ATOM 23094 H1 WAT 3354 25.878 80.550 9.170 1.00 0.00 H ATOM 23095 H2 WAT 3354 24.497 81.132 8.956 1.00 0.00 H TER 23097 WAT 3354 ATOM 23097 O WAT 3355 69.365 67.389 114.344 1.00 0.00 O ATOM 23098 H1 WAT 3355 68.426 67.454 114.519 1.00 0.00 H ATOM 23099 H2 WAT 3355 69.438 66.699 113.684 1.00 0.00 H TER 23101 WAT 3355 ATOM 23101 O WAT 3356 118.775 109.649 139.965 1.00 0.00 O ATOM 23102 H1 WAT 3356 119.490 109.018 140.043 1.00 0.00 H ATOM 23103 H2 WAT 3356 118.600 109.926 140.864 1.00 0.00 H TER 23105 WAT 3356 ATOM 23105 O WAT 3357 121.515 45.348 121.586 1.00 0.00 O ATOM 23106 H1 WAT 3357 120.627 45.680 121.716 1.00 0.00 H ATOM 23107 H2 WAT 3357 121.393 44.482 121.197 1.00 0.00 H TER 23109 WAT 3357 ATOM 23109 O WAT 3358 99.460 52.801 13.843 1.00 0.00 O ATOM 23110 H1 WAT 3358 99.302 53.685 13.513 1.00 0.00 H ATOM 23111 H2 WAT 3358 98.649 52.328 13.659 1.00 0.00 H TER 23113 WAT 3358 ATOM 23113 O WAT 3359 90.978 128.723 14.896 1.00 0.00 O ATOM 23114 H1 WAT 3359 91.722 128.160 14.684 1.00 0.00 H ATOM 23115 H2 WAT 3359 91.330 129.612 14.850 1.00 0.00 H TER 23117 WAT 3359 ATOM 23117 O WAT 3360 48.228 20.262 6.530 1.00 0.00 O ATOM 23118 H1 WAT 3360 48.777 20.612 5.829 1.00 0.00 H ATOM 23119 H2 WAT 3360 48.824 20.157 7.272 1.00 0.00 H TER 23121 WAT 3360 ATOM 23121 O WAT 3361 141.829 2.251 143.380 1.00 0.00 O ATOM 23122 H1 WAT 3361 141.402 2.559 142.580 1.00 0.00 H ATOM 23123 H2 WAT 3361 142.589 1.759 143.071 1.00 0.00 H TER 23125 WAT 3361 ATOM 23125 O WAT 3362 1.968 58.250 6.963 1.00 0.00 O ATOM 23126 H1 WAT 3362 1.874 58.511 7.879 1.00 0.00 H ATOM 23127 H2 WAT 3362 1.678 59.014 6.465 1.00 0.00 H TER 23129 WAT 3362 ATOM 23129 O WAT 3363 75.831 86.966 21.520 1.00 0.00 O ATOM 23130 H1 WAT 3363 75.379 87.445 22.214 1.00 0.00 H ATOM 23131 H2 WAT 3363 76.459 86.411 21.982 1.00 0.00 H TER 23133 WAT 3363 ATOM 23133 O WAT 3364 37.296 32.514 157.027 1.00 0.00 O ATOM 23134 H1 WAT 3364 37.212 32.795 157.938 1.00 0.00 H ATOM 23135 H2 WAT 3364 37.443 31.570 157.080 1.00 0.00 H TER 23137 WAT 3364 ATOM 23137 O WAT 3365 80.113 137.285 144.747 1.00 0.00 O ATOM 23138 H1 WAT 3365 80.616 136.835 144.068 1.00 0.00 H ATOM 23139 H2 WAT 3365 79.856 136.591 145.354 1.00 0.00 H TER 23141 WAT 3365 ATOM 23141 O WAT 3366 19.951 144.255 74.428 1.00 0.00 O ATOM 23142 H1 WAT 3366 19.562 144.320 75.300 1.00 0.00 H ATOM 23143 H2 WAT 3366 20.619 144.941 74.411 1.00 0.00 H TER 23145 WAT 3366 ATOM 23145 O WAT 3367 67.631 3.282 147.600 1.00 0.00 O ATOM 23146 H1 WAT 3367 67.039 3.140 148.339 1.00 0.00 H ATOM 23147 H2 WAT 3367 68.467 2.917 147.888 1.00 0.00 H TER 23149 WAT 3367 ATOM 23149 O WAT 3368 98.175 99.075 134.400 1.00 0.00 O ATOM 23150 H1 WAT 3368 99.059 98.802 134.646 1.00 0.00 H ATOM 23151 H2 WAT 3368 98.254 99.350 133.487 1.00 0.00 H TER 23153 WAT 3368 ATOM 23153 O WAT 3369 -0.038 117.934 6.160 1.00 0.00 O ATOM 23154 H1 WAT 3369 0.780 118.299 6.499 1.00 0.00 H ATOM 23155 H2 WAT 3369 0.188 117.613 5.286 1.00 0.00 H TER 23157 WAT 3369 ATOM 23157 O WAT 3370 139.722 84.686 74.591 1.00 0.00 O ATOM 23158 H1 WAT 3370 140.558 85.111 74.781 1.00 0.00 H ATOM 23159 H2 WAT 3370 139.701 83.927 75.174 1.00 0.00 H TER 23161 WAT 3370 ATOM 23161 O WAT 3371 8.449 17.057 11.201 1.00 0.00 O ATOM 23162 H1 WAT 3371 7.880 17.761 11.512 1.00 0.00 H ATOM 23163 H2 WAT 3371 8.551 16.479 11.958 1.00 0.00 H TER 23165 WAT 3371 ATOM 23165 O WAT 3372 107.351 49.160 71.023 1.00 0.00 O ATOM 23166 H1 WAT 3372 106.405 49.136 70.881 1.00 0.00 H ATOM 23167 H2 WAT 3372 107.470 49.779 71.743 1.00 0.00 H TER 23169 WAT 3372 ATOM 23169 O WAT 3373 115.388 62.593 153.185 1.00 0.00 O ATOM 23170 H1 WAT 3373 115.440 63.504 152.896 1.00 0.00 H ATOM 23171 H2 WAT 3373 116.297 62.343 153.354 1.00 0.00 H TER 23173 WAT 3373 ATOM 23173 O WAT 3374 65.047 10.474 75.556 1.00 0.00 O ATOM 23174 H1 WAT 3374 64.831 10.263 76.464 1.00 0.00 H ATOM 23175 H2 WAT 3374 64.220 10.767 75.174 1.00 0.00 H TER 23177 WAT 3374 ATOM 23177 O WAT 3375 69.528 123.297 146.693 1.00 0.00 O ATOM 23178 H1 WAT 3375 70.073 122.956 145.984 1.00 0.00 H ATOM 23179 H2 WAT 3375 68.643 123.313 146.329 1.00 0.00 H TER 23181 WAT 3375 ATOM 23181 O WAT 3376 130.547 61.532 85.521 1.00 0.00 O ATOM 23182 H1 WAT 3376 131.107 61.140 86.191 1.00 0.00 H ATOM 23183 H2 WAT 3376 129.746 61.009 85.541 1.00 0.00 H TER 23185 WAT 3376 ATOM 23185 O WAT 3377 120.275 76.271 129.527 1.00 0.00 O ATOM 23186 H1 WAT 3377 119.958 75.368 129.561 1.00 0.00 H ATOM 23187 H2 WAT 3377 120.874 76.287 128.781 1.00 0.00 H TER 23189 WAT 3377 ATOM 23189 O WAT 3378 39.583 30.586 126.015 1.00 0.00 O ATOM 23190 H1 WAT 3378 40.320 31.043 125.611 1.00 0.00 H ATOM 23191 H2 WAT 3378 39.298 29.958 125.352 1.00 0.00 H TER 23193 WAT 3378 ATOM 23193 O WAT 3379 121.933 134.036 82.835 1.00 0.00 O ATOM 23194 H1 WAT 3379 122.177 133.925 81.916 1.00 0.00 H ATOM 23195 H2 WAT 3379 122.767 134.050 83.305 1.00 0.00 H TER 23197 WAT 3379 ATOM 23197 O WAT 3380 135.063 89.409 70.284 1.00 0.00 O ATOM 23198 H1 WAT 3380 136.019 89.353 70.303 1.00 0.00 H ATOM 23199 H2 WAT 3380 134.787 88.620 69.817 1.00 0.00 H TER 23201 WAT 3380 ATOM 23201 O WAT 3381 84.165 22.147 52.485 1.00 0.00 O ATOM 23202 H1 WAT 3381 83.943 21.315 52.068 1.00 0.00 H ATOM 23203 H2 WAT 3381 85.081 22.297 52.248 1.00 0.00 H TER 23205 WAT 3381 ATOM 23205 O WAT 3382 143.114 36.025 148.177 1.00 0.00 O ATOM 23206 H1 WAT 3382 142.512 35.294 148.315 1.00 0.00 H ATOM 23207 H2 WAT 3382 143.281 36.023 147.234 1.00 0.00 H TER 23209 WAT 3382 ATOM 23209 O WAT 3383 4.600 121.331 150.770 1.00 0.00 O ATOM 23210 H1 WAT 3383 5.064 121.567 149.967 1.00 0.00 H ATOM 23211 H2 WAT 3383 4.125 120.531 150.547 1.00 0.00 H TER 23213 WAT 3383 ATOM 23213 O WAT 3384 59.644 10.705 24.179 1.00 0.00 O ATOM 23214 H1 WAT 3384 60.413 10.168 23.985 1.00 0.00 H ATOM 23215 H2 WAT 3384 58.918 10.082 24.211 1.00 0.00 H TER 23217 WAT 3384 ATOM 23217 O WAT 3385 79.361 100.248 11.843 1.00 0.00 O ATOM 23218 H1 WAT 3385 80.004 100.519 11.188 1.00 0.00 H ATOM 23219 H2 WAT 3385 78.518 100.319 11.394 1.00 0.00 H TER 23221 WAT 3385 ATOM 23221 O WAT 3386 116.793 29.468 4.576 1.00 0.00 O ATOM 23222 H1 WAT 3386 117.047 29.500 3.653 1.00 0.00 H ATOM 23223 H2 WAT 3386 116.536 30.367 4.784 1.00 0.00 H TER 23225 WAT 3386 ATOM 23225 O WAT 3387 146.080 42.012 138.555 1.00 0.00 O ATOM 23226 H1 WAT 3387 145.591 42.043 139.378 1.00 0.00 H ATOM 23227 H2 WAT 3387 145.880 41.150 138.191 1.00 0.00 H TER 23229 WAT 3387 ATOM 23229 O WAT 3388 61.134 28.642 101.386 1.00 0.00 O ATOM 23230 H1 WAT 3388 60.406 28.310 101.912 1.00 0.00 H ATOM 23231 H2 WAT 3388 60.714 29.145 100.688 1.00 0.00 H TER 23233 WAT 3388 ATOM 23233 O WAT 3389 67.362 62.647 8.400 1.00 0.00 O ATOM 23234 H1 WAT 3389 66.938 63.444 8.082 1.00 0.00 H ATOM 23235 H2 WAT 3389 68.296 62.801 8.259 1.00 0.00 H TER 23237 WAT 3389 ATOM 23237 O WAT 3390 53.471 98.187 106.981 1.00 0.00 O ATOM 23238 H1 WAT 3390 53.386 97.443 107.578 1.00 0.00 H ATOM 23239 H2 WAT 3390 54.034 98.805 107.447 1.00 0.00 H TER 23241 WAT 3390 ATOM 23241 O WAT 3391 7.514 84.856 155.479 1.00 0.00 O ATOM 23242 H1 WAT 3391 8.358 84.771 155.922 1.00 0.00 H ATOM 23243 H2 WAT 3391 7.602 85.645 154.944 1.00 0.00 H TER 23245 WAT 3391 ATOM 23245 O WAT 3392 11.270 76.794 1.813 1.00 0.00 O ATOM 23246 H1 WAT 3392 10.632 76.446 2.437 1.00 0.00 H ATOM 23247 H2 WAT 3392 11.324 76.127 1.129 1.00 0.00 H TER 23249 WAT 3392 ATOM 23249 O WAT 3393 1.843 90.719 155.131 1.00 0.00 O ATOM 23250 H1 WAT 3393 2.333 90.582 154.320 1.00 0.00 H ATOM 23251 H2 WAT 3393 1.732 91.669 155.187 1.00 0.00 H TER 23253 WAT 3393 ATOM 23253 O WAT 3394 140.163 24.229 56.166 1.00 0.00 O ATOM 23254 H1 WAT 3394 139.501 24.693 55.654 1.00 0.00 H ATOM 23255 H2 WAT 3394 140.864 24.869 56.289 1.00 0.00 H TER 23257 WAT 3394 ATOM 23257 O WAT 3395 115.138 13.402 58.345 1.00 0.00 O ATOM 23258 H1 WAT 3395 115.110 13.289 57.395 1.00 0.00 H ATOM 23259 H2 WAT 3395 115.842 14.034 58.491 1.00 0.00 H TER 23261 WAT 3395 ATOM 23261 O WAT 3396 100.589 74.104 138.050 1.00 0.00 O ATOM 23262 H1 WAT 3396 100.718 73.303 137.542 1.00 0.00 H ATOM 23263 H2 WAT 3396 99.897 74.574 137.585 1.00 0.00 H TER 23265 WAT 3396 ATOM 23265 O WAT 3397 86.581 140.340 85.406 1.00 0.00 O ATOM 23266 H1 WAT 3397 86.758 140.285 86.345 1.00 0.00 H ATOM 23267 H2 WAT 3397 86.602 139.432 85.104 1.00 0.00 H TER 23269 WAT 3397 ATOM 23269 O WAT 3398 97.732 112.001 81.322 1.00 0.00 O ATOM 23270 H1 WAT 3398 97.727 112.511 82.132 1.00 0.00 H ATOM 23271 H2 WAT 3398 96.960 111.439 81.388 1.00 0.00 H TER 23273 WAT 3398 ATOM 23273 O WAT 3399 53.935 67.037 129.277 1.00 0.00 O ATOM 23274 H1 WAT 3399 53.410 66.257 129.098 1.00 0.00 H ATOM 23275 H2 WAT 3399 53.757 67.620 128.539 1.00 0.00 H TER 23277 WAT 3399 ATOM 23277 O WAT 3400 144.508 90.170 66.443 1.00 0.00 O ATOM 23278 H1 WAT 3400 144.022 89.627 65.822 1.00 0.00 H ATOM 23279 H2 WAT 3400 144.860 89.549 67.080 1.00 0.00 H TER 23281 WAT 3400 ATOM 23281 O WAT 3401 79.905 31.948 3.220 1.00 0.00 O ATOM 23282 H1 WAT 3401 80.001 32.028 2.271 1.00 0.00 H ATOM 23283 H2 WAT 3401 80.314 32.740 3.570 1.00 0.00 H TER 23285 WAT 3401 ATOM 23285 O WAT 3402 119.287 54.987 85.043 1.00 0.00 O ATOM 23286 H1 WAT 3402 118.822 55.326 84.278 1.00 0.00 H ATOM 23287 H2 WAT 3402 119.530 55.768 85.541 1.00 0.00 H TER 23289 WAT 3402 ATOM 23289 O WAT 3403 28.164 0.107 92.483 1.00 0.00 O ATOM 23290 H1 WAT 3403 27.345 -0.278 92.794 1.00 0.00 H ATOM 23291 H2 WAT 3403 28.644 0.326 93.281 1.00 0.00 H TER 23293 WAT 3403 ATOM 23293 O WAT 3404 28.651 28.677 96.548 1.00 0.00 O ATOM 23294 H1 WAT 3404 28.051 28.539 97.281 1.00 0.00 H ATOM 23295 H2 WAT 3404 28.110 28.549 95.768 1.00 0.00 H TER 23297 WAT 3404 ATOM 23297 O WAT 3405 66.638 56.867 158.167 1.00 0.00 O ATOM 23298 H1 WAT 3405 66.042 56.844 158.915 1.00 0.00 H ATOM 23299 H2 WAT 3405 66.096 56.607 157.422 1.00 0.00 H TER 23301 WAT 3405 ATOM 23301 O WAT 3406 40.478 41.722 83.642 1.00 0.00 O ATOM 23302 H1 WAT 3406 41.376 41.781 83.968 1.00 0.00 H ATOM 23303 H2 WAT 3406 40.336 42.548 83.179 1.00 0.00 H TER 23305 WAT 3406 ATOM 23305 O WAT 3407 11.023 2.521 64.667 1.00 0.00 O ATOM 23306 H1 WAT 3407 10.619 2.242 65.489 1.00 0.00 H ATOM 23307 H2 WAT 3407 11.599 1.796 64.425 1.00 0.00 H TER 23309 WAT 3407 ATOM 23309 O WAT 3408 24.007 88.153 4.629 1.00 0.00 O ATOM 23310 H1 WAT 3408 23.433 88.078 5.392 1.00 0.00 H ATOM 23311 H2 WAT 3408 23.813 89.017 4.268 1.00 0.00 H TER 23313 WAT 3408 ATOM 23313 O WAT 3409 107.967 3.364 111.310 1.00 0.00 O ATOM 23314 H1 WAT 3409 108.772 2.846 111.342 1.00 0.00 H ATOM 23315 H2 WAT 3409 107.627 3.223 110.426 1.00 0.00 H TER 23317 WAT 3409 ATOM 23317 O WAT 3410 63.140 31.572 29.056 1.00 0.00 O ATOM 23318 H1 WAT 3410 63.813 32.050 29.538 1.00 0.00 H ATOM 23319 H2 WAT 3410 63.629 31.007 28.457 1.00 0.00 H TER 23321 WAT 3410 ATOM 23321 O WAT 3411 102.760 32.730 120.500 1.00 0.00 O ATOM 23322 H1 WAT 3411 103.582 32.243 120.566 1.00 0.00 H ATOM 23323 H2 WAT 3411 103.006 33.559 120.091 1.00 0.00 H TER 23325 WAT 3411 ATOM 23325 O WAT 3412 45.082 100.184 112.633 1.00 0.00 O ATOM 23326 H1 WAT 3412 44.348 100.334 112.037 1.00 0.00 H ATOM 23327 H2 WAT 3412 45.043 100.915 113.251 1.00 0.00 H TER 23329 WAT 3412 ATOM 23329 O WAT 3413 7.306 36.731 118.060 1.00 0.00 O ATOM 23330 H1 WAT 3413 6.869 36.017 118.524 1.00 0.00 H ATOM 23331 H2 WAT 3413 7.961 36.297 117.514 1.00 0.00 H TER 23333 WAT 3413 ATOM 23333 O WAT 3414 12.665 113.324 157.954 1.00 0.00 O ATOM 23334 H1 WAT 3414 12.328 113.791 157.190 1.00 0.00 H ATOM 23335 H2 WAT 3414 12.281 113.781 158.702 1.00 0.00 H TER 23337 WAT 3414 ATOM 23337 O WAT 3415 50.160 21.090 91.612 1.00 0.00 O ATOM 23338 H1 WAT 3415 50.966 21.522 91.329 1.00 0.00 H ATOM 23339 H2 WAT 3415 50.390 20.162 91.661 1.00 0.00 H TER 23341 WAT 3415 ATOM 23341 O WAT 3416 68.307 93.353 73.362 1.00 0.00 O ATOM 23342 H1 WAT 3416 67.586 93.536 73.965 1.00 0.00 H ATOM 23343 H2 WAT 3416 68.931 92.846 73.882 1.00 0.00 H TER 23345 WAT 3416 ATOM 23345 O WAT 3417 49.626 48.097 2.422 1.00 0.00 O ATOM 23346 H1 WAT 3417 49.693 48.111 1.467 1.00 0.00 H ATOM 23347 H2 WAT 3417 50.523 48.232 2.727 1.00 0.00 H TER 23349 WAT 3417 ATOM 23349 O WAT 3418 26.785 109.834 112.176 1.00 0.00 O ATOM 23350 H1 WAT 3418 26.358 110.670 111.989 1.00 0.00 H ATOM 23351 H2 WAT 3418 27.284 109.638 111.383 1.00 0.00 H TER 23353 WAT 3418 ATOM 23353 O WAT 3419 142.021 19.578 139.931 1.00 0.00 O ATOM 23354 H1 WAT 3419 142.638 19.155 140.529 1.00 0.00 H ATOM 23355 H2 WAT 3419 142.551 20.214 139.451 1.00 0.00 H TER 23357 WAT 3419 ATOM 23357 O WAT 3420 6.153 41.377 9.068 1.00 0.00 O ATOM 23358 H1 WAT 3420 5.267 41.569 8.763 1.00 0.00 H ATOM 23359 H2 WAT 3420 6.436 42.180 9.505 1.00 0.00 H TER 23361 WAT 3420 ATOM 23361 O WAT 3421 10.673 66.963 77.748 1.00 0.00 O ATOM 23362 H1 WAT 3421 11.349 66.664 77.140 1.00 0.00 H ATOM 23363 H2 WAT 3421 10.498 66.204 78.305 1.00 0.00 H TER 23365 WAT 3421 ATOM 23365 O WAT 3422 86.090 46.366 153.750 1.00 0.00 O ATOM 23366 H1 WAT 3422 85.938 47.301 153.881 1.00 0.00 H ATOM 23367 H2 WAT 3422 86.980 46.314 153.402 1.00 0.00 H TER 23369 WAT 3422 ATOM 23369 O WAT 3423 14.974 95.622 69.792 1.00 0.00 O ATOM 23370 H1 WAT 3423 14.089 95.986 69.834 1.00 0.00 H ATOM 23371 H2 WAT 3423 15.032 95.047 70.555 1.00 0.00 H TER 23373 WAT 3423 ATOM 23373 O WAT 3424 94.141 71.211 22.854 1.00 0.00 O ATOM 23374 H1 WAT 3424 94.817 70.581 23.101 1.00 0.00 H ATOM 23375 H2 WAT 3424 93.790 71.526 23.687 1.00 0.00 H TER 23377 WAT 3424 ATOM 23377 O WAT 3425 3.190 80.055 139.146 1.00 0.00 O ATOM 23378 H1 WAT 3425 2.301 79.858 139.439 1.00 0.00 H ATOM 23379 H2 WAT 3425 3.170 79.904 138.201 1.00 0.00 H TER 23381 WAT 3425 ATOM 23381 O WAT 3426 39.985 94.739 60.252 1.00 0.00 O ATOM 23382 H1 WAT 3426 39.268 94.924 59.645 1.00 0.00 H ATOM 23383 H2 WAT 3426 39.972 95.472 60.867 1.00 0.00 H TER 23385 WAT 3426 ATOM 23385 O WAT 3427 75.799 94.725 105.501 1.00 0.00 O ATOM 23386 H1 WAT 3427 75.329 95.058 106.266 1.00 0.00 H ATOM 23387 H2 WAT 3427 76.153 93.883 105.786 1.00 0.00 H TER 23389 WAT 3427 ATOM 23389 O WAT 3428 9.561 36.423 96.572 1.00 0.00 O ATOM 23390 H1 WAT 3428 10.295 36.666 96.008 1.00 0.00 H ATOM 23391 H2 WAT 3428 9.602 35.467 96.619 1.00 0.00 H TER 23393 WAT 3428 ATOM 23393 O WAT 3429 17.116 54.040 0.042 1.00 0.00 O ATOM 23394 H1 WAT 3429 17.977 53.892 0.433 1.00 0.00 H ATOM 23395 H2 WAT 3429 17.091 54.981 -0.133 1.00 0.00 H TER 23397 WAT 3429 ATOM 23397 O WAT 3430 78.686 100.222 103.092 1.00 0.00 O ATOM 23398 H1 WAT 3430 79.483 100.408 103.589 1.00 0.00 H ATOM 23399 H2 WAT 3430 78.112 100.967 103.273 1.00 0.00 H TER 23401 WAT 3430 ATOM 23401 O WAT 3431 61.783 94.358 120.191 1.00 0.00 O ATOM 23402 H1 WAT 3431 61.636 94.831 121.011 1.00 0.00 H ATOM 23403 H2 WAT 3431 61.140 94.725 119.585 1.00 0.00 H TER 23405 WAT 3431 ATOM 23405 O WAT 3432 7.305 90.712 151.285 1.00 0.00 O ATOM 23406 H1 WAT 3432 7.197 89.763 151.216 1.00 0.00 H ATOM 23407 H2 WAT 3432 8.217 90.829 151.553 1.00 0.00 H TER 23409 WAT 3432 ATOM 23409 O WAT 3433 129.246 110.175 139.433 1.00 0.00 O ATOM 23410 H1 WAT 3433 128.974 110.848 140.057 1.00 0.00 H ATOM 23411 H2 WAT 3433 128.439 109.922 138.986 1.00 0.00 H TER 23413 WAT 3433 ATOM 23413 O WAT 3434 99.961 55.203 12.410 1.00 0.00 O ATOM 23414 H1 WAT 3434 99.882 54.623 11.652 1.00 0.00 H ATOM 23415 H2 WAT 3434 99.732 56.069 12.073 1.00 0.00 H TER 23417 WAT 3434 ATOM 23417 O WAT 3435 127.416 27.005 94.514 1.00 0.00 O ATOM 23418 H1 WAT 3435 126.779 26.467 94.044 1.00 0.00 H ATOM 23419 H2 WAT 3435 128.246 26.839 94.067 1.00 0.00 H TER 23421 WAT 3435 ATOM 23421 O WAT 3436 4.958 111.106 66.398 1.00 0.00 O ATOM 23422 H1 WAT 3436 4.786 111.676 65.648 1.00 0.00 H ATOM 23423 H2 WAT 3436 5.121 111.708 67.124 1.00 0.00 H TER 23425 WAT 3436 ATOM 23425 O WAT 3437 144.714 122.482 90.635 1.00 0.00 O ATOM 23426 H1 WAT 3437 145.040 122.069 91.435 1.00 0.00 H ATOM 23427 H2 WAT 3437 144.856 121.827 89.952 1.00 0.00 H TER 23429 WAT 3437 ATOM 23429 O WAT 3438 93.298 4.702 118.040 1.00 0.00 O ATOM 23430 H1 WAT 3438 93.678 5.467 117.608 1.00 0.00 H ATOM 23431 H2 WAT 3438 93.083 5.008 118.921 1.00 0.00 H TER 23433 WAT 3438 ATOM 23433 O WAT 3439 17.727 37.844 8.513 1.00 0.00 O ATOM 23434 H1 WAT 3439 18.631 37.925 8.209 1.00 0.00 H ATOM 23435 H2 WAT 3439 17.745 37.106 9.122 1.00 0.00 H TER 23437 WAT 3439 ATOM 23437 O WAT 3440 54.257 9.231 24.834 1.00 0.00 O ATOM 23438 H1 WAT 3440 53.934 8.340 24.966 1.00 0.00 H ATOM 23439 H2 WAT 3440 53.630 9.784 25.302 1.00 0.00 H TER 23441 WAT 3440 ATOM 23441 O WAT 3441 136.794 138.125 130.309 1.00 0.00 O ATOM 23442 H1 WAT 3441 136.049 138.661 130.037 1.00 0.00 H ATOM 23443 H2 WAT 3441 136.496 137.223 130.194 1.00 0.00 H TER 23445 WAT 3441 ATOM 23445 O WAT 3442 74.124 37.917 127.870 1.00 0.00 O ATOM 23446 H1 WAT 3442 74.251 37.516 127.010 1.00 0.00 H ATOM 23447 H2 WAT 3442 74.204 38.857 127.710 1.00 0.00 H TER 23449 WAT 3442 ATOM 23449 O WAT 3443 80.965 143.276 105.333 1.00 0.00 O ATOM 23450 H1 WAT 3443 80.919 142.357 105.598 1.00 0.00 H ATOM 23451 H2 WAT 3443 81.401 143.715 106.063 1.00 0.00 H TER 23453 WAT 3443 ATOM 23453 O WAT 3444 76.265 77.889 153.815 1.00 0.00 O ATOM 23454 H1 WAT 3444 76.253 77.757 152.867 1.00 0.00 H ATOM 23455 H2 WAT 3444 75.583 78.542 153.974 1.00 0.00 H TER 23457 WAT 3444 ATOM 23457 O WAT 3445 11.169 15.773 9.082 1.00 0.00 O ATOM 23458 H1 WAT 3445 10.376 16.261 8.858 1.00 0.00 H ATOM 23459 H2 WAT 3445 11.594 15.606 8.241 1.00 0.00 H TER 23461 WAT 3445 ATOM 23461 O WAT 3446 41.415 28.125 90.272 1.00 0.00 O ATOM 23462 H1 WAT 3446 41.271 28.418 89.372 1.00 0.00 H ATOM 23463 H2 WAT 3446 40.560 28.215 90.693 1.00 0.00 H TER 23465 WAT 3446 ATOM 23465 O WAT 3447 80.824 65.109 98.219 1.00 0.00 O ATOM 23466 H1 WAT 3447 81.559 64.642 97.821 1.00 0.00 H ATOM 23467 H2 WAT 3447 81.232 65.821 98.712 1.00 0.00 H TER 23469 WAT 3447 ATOM 23469 O WAT 3448 16.055 94.092 132.776 1.00 0.00 O ATOM 23470 H1 WAT 3448 15.648 93.871 133.614 1.00 0.00 H ATOM 23471 H2 WAT 3448 16.711 93.409 132.642 1.00 0.00 H TER 23473 WAT 3448 ATOM 23473 O WAT 3449 34.588 10.459 124.018 1.00 0.00 O ATOM 23474 H1 WAT 3449 34.763 10.938 123.208 1.00 0.00 H ATOM 23475 H2 WAT 3449 34.147 9.659 123.732 1.00 0.00 H TER 23477 WAT 3449 ATOM 23477 O WAT 3450 34.225 33.014 93.268 1.00 0.00 O ATOM 23478 H1 WAT 3450 33.297 33.246 93.228 1.00 0.00 H ATOM 23479 H2 WAT 3450 34.250 32.222 93.805 1.00 0.00 H TER 23481 WAT 3450 ATOM 23481 O WAT 3451 10.708 27.935 117.606 1.00 0.00 O ATOM 23482 H1 WAT 3451 11.032 27.601 116.770 1.00 0.00 H ATOM 23483 H2 WAT 3451 10.195 28.709 117.374 1.00 0.00 H TER 23485 WAT 3451 ATOM 23485 O WAT 3452 46.471 68.521 71.078 1.00 0.00 O ATOM 23486 H1 WAT 3452 46.430 69.208 70.412 1.00 0.00 H ATOM 23487 H2 WAT 3452 46.035 67.770 70.675 1.00 0.00 H TER 23489 WAT 3452 ATOM 23489 O WAT 3453 88.541 111.296 106.115 1.00 0.00 O ATOM 23490 H1 WAT 3453 87.817 110.713 105.884 1.00 0.00 H ATOM 23491 H2 WAT 3453 88.245 112.164 105.843 1.00 0.00 H TER 23493 WAT 3453 ATOM 23493 O WAT 3454 52.937 103.645 91.240 1.00 0.00 O ATOM 23494 H1 WAT 3454 53.451 104.421 91.018 1.00 0.00 H ATOM 23495 H2 WAT 3454 52.316 103.554 90.517 1.00 0.00 H TER 23497 WAT 3454 ATOM 23497 O WAT 3455 76.531 61.867 85.619 1.00 0.00 O ATOM 23498 H1 WAT 3455 75.992 62.657 85.571 1.00 0.00 H ATOM 23499 H2 WAT 3455 77.429 62.183 85.516 1.00 0.00 H TER 23501 WAT 3455 ATOM 23501 O WAT 3456 111.487 84.964 124.935 1.00 0.00 O ATOM 23502 H1 WAT 3456 110.796 85.607 125.095 1.00 0.00 H ATOM 23503 H2 WAT 3456 111.345 84.680 124.032 1.00 0.00 H TER 23505 WAT 3456 ATOM 23505 O WAT 3457 84.631 33.674 107.154 1.00 0.00 O ATOM 23506 H1 WAT 3457 85.030 34.337 107.717 1.00 0.00 H ATOM 23507 H2 WAT 3457 85.256 32.949 107.158 1.00 0.00 H TER 23509 WAT 3457 ATOM 23509 O WAT 3458 74.686 71.883 101.977 1.00 0.00 O ATOM 23510 H1 WAT 3458 74.838 71.933 101.033 1.00 0.00 H ATOM 23511 H2 WAT 3458 73.825 71.472 102.059 1.00 0.00 H TER 23513 WAT 3458 ATOM 23513 O WAT 3459 142.618 107.763 21.920 1.00 0.00 O ATOM 23514 H1 WAT 3459 142.291 106.870 22.031 1.00 0.00 H ATOM 23515 H2 WAT 3459 142.878 108.034 22.800 1.00 0.00 H TER 23517 WAT 3459 ATOM 23517 O WAT 3460 57.269 86.906 69.478 1.00 0.00 O ATOM 23518 H1 WAT 3460 56.694 87.284 68.813 1.00 0.00 H ATOM 23519 H2 WAT 3460 58.151 87.160 69.205 1.00 0.00 H TER 23521 WAT 3460 ATOM 23521 O WAT 3461 85.441 44.161 141.256 1.00 0.00 O ATOM 23522 H1 WAT 3461 85.360 44.503 140.366 1.00 0.00 H ATOM 23523 H2 WAT 3461 85.060 44.842 141.810 1.00 0.00 H TER 23525 WAT 3461 ATOM 23525 O WAT 3462 142.446 137.516 104.972 1.00 0.00 O ATOM 23526 H1 WAT 3462 142.269 136.585 105.111 1.00 0.00 H ATOM 23527 H2 WAT 3462 141.711 137.822 104.440 1.00 0.00 H TER 23529 WAT 3462 ATOM 23529 O WAT 3463 70.682 108.055 122.753 1.00 0.00 O ATOM 23530 H1 WAT 3463 70.410 108.424 121.913 1.00 0.00 H ATOM 23531 H2 WAT 3463 70.778 107.118 122.584 1.00 0.00 H TER 23533 WAT 3463 ATOM 23533 O WAT 3464 35.142 92.297 19.688 1.00 0.00 O ATOM 23534 H1 WAT 3464 35.256 92.801 20.493 1.00 0.00 H ATOM 23535 H2 WAT 3464 35.956 92.430 19.203 1.00 0.00 H TER 23537 WAT 3464 ATOM 23537 O WAT 3465 110.076 20.646 157.022 1.00 0.00 O ATOM 23538 H1 WAT 3465 109.518 19.900 156.801 1.00 0.00 H ATOM 23539 H2 WAT 3465 110.219 20.566 157.965 1.00 0.00 H TER 23541 WAT 3465 ATOM 23541 O WAT 3466 34.077 88.365 152.261 1.00 0.00 O ATOM 23542 H1 WAT 3466 33.659 88.301 151.402 1.00 0.00 H ATOM 23543 H2 WAT 3466 33.445 88.842 152.799 1.00 0.00 H TER 23545 WAT 3466 ATOM 23545 O WAT 3467 135.246 137.157 137.011 1.00 0.00 O ATOM 23546 H1 WAT 3467 135.161 137.914 137.591 1.00 0.00 H ATOM 23547 H2 WAT 3467 134.459 137.183 136.466 1.00 0.00 H TER 23549 WAT 3467 ATOM 23549 O WAT 3468 119.788 36.500 149.092 1.00 0.00 O ATOM 23550 H1 WAT 3468 119.479 35.864 148.447 1.00 0.00 H ATOM 23551 H2 WAT 3468 118.994 36.941 149.393 1.00 0.00 H TER 23553 WAT 3468 ATOM 23553 O WAT 3469 2.723 122.735 69.886 1.00 0.00 O ATOM 23554 H1 WAT 3469 3.500 123.276 70.029 1.00 0.00 H ATOM 23555 H2 WAT 3469 2.924 121.907 70.321 1.00 0.00 H TER 23557 WAT 3469 ATOM 23557 O WAT 3470 64.008 37.069 123.219 1.00 0.00 O ATOM 23558 H1 WAT 3470 64.875 36.950 122.832 1.00 0.00 H ATOM 23559 H2 WAT 3470 63.948 38.009 123.388 1.00 0.00 H TER 23561 WAT 3470 ATOM 23561 O WAT 3471 61.558 140.455 146.483 1.00 0.00 O ATOM 23562 H1 WAT 3471 62.271 140.934 146.907 1.00 0.00 H ATOM 23563 H2 WAT 3471 61.649 140.666 145.553 1.00 0.00 H TER 23565 WAT 3471 ATOM 23565 O WAT 3472 137.609 89.321 115.031 1.00 0.00 O ATOM 23566 H1 WAT 3472 138.539 89.104 115.092 1.00 0.00 H ATOM 23567 H2 WAT 3472 137.218 88.574 114.577 1.00 0.00 H TER 23569 WAT 3472 ATOM 23569 O WAT 3473 24.453 66.776 56.453 1.00 0.00 O ATOM 23570 H1 WAT 3473 24.487 67.598 56.943 1.00 0.00 H ATOM 23571 H2 WAT 3473 23.544 66.710 56.161 1.00 0.00 H TER 23573 WAT 3473 ATOM 23573 O WAT 3474 100.055 6.630 112.345 1.00 0.00 O ATOM 23574 H1 WAT 3474 100.581 7.334 111.964 1.00 0.00 H ATOM 23575 H2 WAT 3474 99.799 6.091 111.597 1.00 0.00 H TER 23577 WAT 3474 ATOM 23577 O WAT 3475 20.810 59.232 99.883 1.00 0.00 O ATOM 23578 H1 WAT 3475 21.760 59.111 99.887 1.00 0.00 H ATOM 23579 H2 WAT 3475 20.471 58.460 99.430 1.00 0.00 H TER 23581 WAT 3475 ATOM 23581 O WAT 3476 78.679 41.293 3.683 1.00 0.00 O ATOM 23582 H1 WAT 3476 77.778 40.975 3.732 1.00 0.00 H ATOM 23583 H2 WAT 3476 78.607 42.158 3.280 1.00 0.00 H TER 23585 WAT 3476 ATOM 23585 O WAT 3477 27.094 118.562 73.707 1.00 0.00 O ATOM 23586 H1 WAT 3477 26.468 118.995 74.286 1.00 0.00 H ATOM 23587 H2 WAT 3477 27.591 119.279 73.313 1.00 0.00 H TER 23589 WAT 3477 ATOM 23589 O WAT 3478 5.136 47.543 149.308 1.00 0.00 O ATOM 23590 H1 WAT 3478 5.136 47.482 150.263 1.00 0.00 H ATOM 23591 H2 WAT 3478 4.342 47.081 149.039 1.00 0.00 H TER 23593 WAT 3478 ATOM 23593 O WAT 3479 34.174 31.335 156.613 1.00 0.00 O ATOM 23594 H1 WAT 3479 34.708 30.737 156.091 1.00 0.00 H ATOM 23595 H2 WAT 3479 34.705 31.515 157.389 1.00 0.00 H TER 23597 WAT 3479 ATOM 23597 O WAT 3480 17.589 126.613 72.371 1.00 0.00 O ATOM 23598 H1 WAT 3480 16.817 126.615 71.805 1.00 0.00 H ATOM 23599 H2 WAT 3480 17.393 127.262 73.046 1.00 0.00 H TER 23601 WAT 3480 ATOM 23601 O WAT 3481 12.087 121.024 1.770 1.00 0.00 O ATOM 23602 H1 WAT 3481 12.555 121.839 1.955 1.00 0.00 H ATOM 23603 H2 WAT 3481 11.605 120.838 2.576 1.00 0.00 H TER 23605 WAT 3481 ATOM 23605 O WAT 3482 125.077 115.084 102.245 1.00 0.00 O ATOM 23606 H1 WAT 3482 125.956 114.786 102.011 1.00 0.00 H ATOM 23607 H2 WAT 3482 124.922 114.712 103.114 1.00 0.00 H TER 23609 WAT 3482 ATOM 23609 O WAT 3483 5.587 18.345 83.484 1.00 0.00 O ATOM 23610 H1 WAT 3483 5.458 18.749 82.626 1.00 0.00 H ATOM 23611 H2 WAT 3483 5.826 17.438 83.289 1.00 0.00 H TER 23613 WAT 3483 ATOM 23613 O WAT 3484 97.172 64.263 14.126 1.00 0.00 O ATOM 23614 H1 WAT 3484 96.535 63.758 13.619 1.00 0.00 H ATOM 23615 H2 WAT 3484 97.728 63.603 14.539 1.00 0.00 H TER 23617 WAT 3484 ATOM 23617 O WAT 3485 110.398 102.010 88.651 1.00 0.00 O ATOM 23618 H1 WAT 3485 110.954 101.506 88.058 1.00 0.00 H ATOM 23619 H2 WAT 3485 109.961 101.350 89.190 1.00 0.00 H TER 23621 WAT 3485 ATOM 23621 O WAT 3486 145.709 47.587 124.856 1.00 0.00 O ATOM 23622 H1 WAT 3486 146.448 47.009 125.047 1.00 0.00 H ATOM 23623 H2 WAT 3486 145.476 47.966 125.704 1.00 0.00 H TER 23625 WAT 3486 ATOM 23625 O WAT 3487 53.464 53.683 151.591 1.00 0.00 O ATOM 23626 H1 WAT 3487 54.333 53.323 151.411 1.00 0.00 H ATOM 23627 H2 WAT 3487 53.196 53.265 152.409 1.00 0.00 H TER 23629 WAT 3487 ATOM 23629 O WAT 3488 111.531 81.255 102.691 1.00 0.00 O ATOM 23630 H1 WAT 3488 111.339 81.432 101.770 1.00 0.00 H ATOM 23631 H2 WAT 3488 111.989 82.038 102.996 1.00 0.00 H TER 23633 WAT 3488 ATOM 23633 O WAT 3489 60.248 133.091 71.192 1.00 0.00 O ATOM 23634 H1 WAT 3489 59.970 133.445 72.036 1.00 0.00 H ATOM 23635 H2 WAT 3489 60.807 133.773 70.819 1.00 0.00 H TER 23637 WAT 3489 ATOM 23637 O WAT 3490 82.234 118.265 106.328 1.00 0.00 O ATOM 23638 H1 WAT 3490 82.466 118.629 105.474 1.00 0.00 H ATOM 23639 H2 WAT 3490 82.439 118.962 106.950 1.00 0.00 H TER 23641 WAT 3490 ATOM 23641 O WAT 3491 106.849 37.729 87.164 1.00 0.00 O ATOM 23642 H1 WAT 3491 106.275 37.230 86.583 1.00 0.00 H ATOM 23643 H2 WAT 3491 107.530 37.107 87.421 1.00 0.00 H TER 23645 WAT 3491 ATOM 23645 O WAT 3492 91.626 35.904 22.500 1.00 0.00 O ATOM 23646 H1 WAT 3492 91.456 36.595 21.859 1.00 0.00 H ATOM 23647 H2 WAT 3492 92.031 35.201 21.992 1.00 0.00 H TER 23649 WAT 3492 ATOM 23649 O WAT 3493 72.631 109.085 149.175 1.00 0.00 O ATOM 23650 H1 WAT 3493 73.320 109.332 149.793 1.00 0.00 H ATOM 23651 H2 WAT 3493 73.004 108.356 148.680 1.00 0.00 H TER 23653 WAT 3493 ATOM 23653 O WAT 3494 140.970 124.696 151.354 1.00 0.00 O ATOM 23654 H1 WAT 3494 140.793 125.573 151.694 1.00 0.00 H ATOM 23655 H2 WAT 3494 140.105 124.301 151.246 1.00 0.00 H TER 23657 WAT 3494 ATOM 23657 O WAT 3495 93.161 136.636 157.158 1.00 0.00 O ATOM 23658 H1 WAT 3495 93.666 135.856 157.389 1.00 0.00 H ATOM 23659 H2 WAT 3495 93.073 137.117 157.981 1.00 0.00 H TER 23661 WAT 3495 ATOM 23661 O WAT 3496 53.611 14.245 143.188 1.00 0.00 O ATOM 23662 H1 WAT 3496 53.796 15.153 142.948 1.00 0.00 H ATOM 23663 H2 WAT 3496 52.671 14.145 143.039 1.00 0.00 H TER 23665 WAT 3496 ATOM 23665 O WAT 3497 54.672 94.280 79.800 1.00 0.00 O ATOM 23666 H1 WAT 3497 55.556 94.593 79.613 1.00 0.00 H ATOM 23667 H2 WAT 3497 54.689 93.355 79.554 1.00 0.00 H TER 23669 WAT 3497 ATOM 23669 O WAT 3498 119.616 13.415 15.079 1.00 0.00 O ATOM 23670 H1 WAT 3498 119.795 13.103 14.192 1.00 0.00 H ATOM 23671 H2 WAT 3498 119.004 14.141 14.959 1.00 0.00 H TER 23673 WAT 3498 ATOM 23673 O WAT 3499 68.213 81.965 70.363 1.00 0.00 O ATOM 23674 H1 WAT 3499 68.546 82.197 69.496 1.00 0.00 H ATOM 23675 H2 WAT 3499 67.929 81.055 70.274 1.00 0.00 H TER 23677 WAT 3499 ATOM 23677 O WAT 3500 116.909 56.711 118.942 1.00 0.00 O ATOM 23678 H1 WAT 3500 116.915 56.788 119.896 1.00 0.00 H ATOM 23679 H2 WAT 3500 116.118 56.209 118.746 1.00 0.00 H TER 23681 WAT 3500 ATOM 23681 O WAT 3501 121.037 118.765 6.816 1.00 0.00 O ATOM 23682 H1 WAT 3501 121.010 117.911 7.249 1.00 0.00 H ATOM 23683 H2 WAT 3501 120.388 118.699 6.116 1.00 0.00 H TER 23685 WAT 3501 ATOM 23685 O WAT 3502 143.073 39.892 150.388 1.00 0.00 O ATOM 23686 H1 WAT 3502 143.396 39.078 150.775 1.00 0.00 H ATOM 23687 H2 WAT 3502 142.476 39.608 149.696 1.00 0.00 H TER 23689 WAT 3502 ATOM 23689 O WAT 3503 100.773 137.368 100.562 1.00 0.00 O ATOM 23690 H1 WAT 3503 100.179 137.302 99.815 1.00 0.00 H ATOM 23691 H2 WAT 3503 100.754 138.295 100.802 1.00 0.00 H TER 23693 WAT 3503 ATOM 23693 O WAT 3504 100.348 110.991 141.303 1.00 0.00 O ATOM 23694 H1 WAT 3504 101.072 111.316 141.838 1.00 0.00 H ATOM 23695 H2 WAT 3504 99.980 111.775 140.896 1.00 0.00 H TER 23697 WAT 3504 ATOM 23697 O WAT 3505 91.790 7.854 108.661 1.00 0.00 O ATOM 23698 H1 WAT 3505 92.693 7.605 108.464 1.00 0.00 H ATOM 23699 H2 WAT 3505 91.714 7.749 109.609 1.00 0.00 H TER 23701 WAT 3505 ATOM 23701 O WAT 3506 43.984 1.838 89.037 1.00 0.00 O ATOM 23702 H1 WAT 3506 43.463 2.387 88.451 1.00 0.00 H ATOM 23703 H2 WAT 3506 43.350 1.485 89.661 1.00 0.00 H TER 23705 WAT 3506 ATOM 23705 O WAT 3507 63.672 14.725 102.294 1.00 0.00 O ATOM 23706 H1 WAT 3507 63.752 13.773 102.230 1.00 0.00 H ATOM 23707 H2 WAT 3507 62.754 14.903 102.089 1.00 0.00 H TER 23709 WAT 3507 ATOM 23709 O WAT 3508 18.159 124.078 73.129 1.00 0.00 O ATOM 23710 H1 WAT 3508 18.452 123.526 72.404 1.00 0.00 H ATOM 23711 H2 WAT 3508 18.060 124.948 72.743 1.00 0.00 H TER 23713 WAT 3508 ATOM 23713 O WAT 3509 83.000 27.471 64.465 1.00 0.00 O ATOM 23714 H1 WAT 3509 82.666 28.107 65.098 1.00 0.00 H ATOM 23715 H2 WAT 3509 82.254 26.902 64.281 1.00 0.00 H TER 23717 WAT 3509 ATOM 23717 O WAT 3510 13.486 84.297 69.916 1.00 0.00 O ATOM 23718 H1 WAT 3510 13.578 83.936 69.035 1.00 0.00 H ATOM 23719 H2 WAT 3510 12.600 84.660 69.935 1.00 0.00 H TER 23721 WAT 3510 ATOM 23721 O WAT 3511 136.894 17.315 135.048 1.00 0.00 O ATOM 23722 H1 WAT 3511 136.120 17.001 134.582 1.00 0.00 H ATOM 23723 H2 WAT 3511 137.364 16.519 135.295 1.00 0.00 H TER 23725 WAT 3511 ATOM 23725 O WAT 3512 74.961 64.175 86.467 1.00 0.00 O ATOM 23726 H1 WAT 3512 75.652 64.343 87.107 1.00 0.00 H ATOM 23727 H2 WAT 3512 74.149 64.379 86.932 1.00 0.00 H TER 23729 WAT 3512 ATOM 23729 O WAT 3513 143.777 6.184 135.666 1.00 0.00 O ATOM 23730 H1 WAT 3513 143.731 5.963 136.596 1.00 0.00 H ATOM 23731 H2 WAT 3513 144.700 6.382 135.512 1.00 0.00 H TER 23733 WAT 3513 ATOM 23733 O WAT 3514 70.933 133.332 153.675 1.00 0.00 O ATOM 23734 H1 WAT 3514 70.065 133.730 153.743 1.00 0.00 H ATOM 23735 H2 WAT 3514 70.778 132.396 153.799 1.00 0.00 H TER 23737 WAT 3514 ATOM 23737 O WAT 3515 45.745 63.496 9.048 1.00 0.00 O ATOM 23738 H1 WAT 3515 45.935 62.675 9.502 1.00 0.00 H ATOM 23739 H2 WAT 3515 45.143 63.247 8.346 1.00 0.00 H TER 23741 WAT 3515 ATOM 23741 O WAT 3516 68.273 28.228 73.502 1.00 0.00 O ATOM 23742 H1 WAT 3516 67.348 28.015 73.620 1.00 0.00 H ATOM 23743 H2 WAT 3516 68.713 27.799 74.235 1.00 0.00 H TER 23745 WAT 3516 ATOM 23745 O WAT 3517 0.571 134.818 81.014 1.00 0.00 O ATOM 23746 H1 WAT 3517 -0.285 134.678 81.417 1.00 0.00 H ATOM 23747 H2 WAT 3517 0.542 134.307 80.205 1.00 0.00 H TER 23749 WAT 3517 ATOM 23749 O WAT 3518 6.225 64.074 132.646 1.00 0.00 O ATOM 23750 H1 WAT 3518 6.821 63.373 132.383 1.00 0.00 H ATOM 23751 H2 WAT 3518 5.363 63.659 132.669 1.00 0.00 H TER 23753 WAT 3518 ATOM 23753 O WAT 3519 55.074 20.714 72.935 1.00 0.00 O ATOM 23754 H1 WAT 3519 55.101 20.921 72.001 1.00 0.00 H ATOM 23755 H2 WAT 3519 54.193 20.966 73.211 1.00 0.00 H TER 23757 WAT 3519 ATOM 23757 O WAT 3520 31.446 128.540 128.377 1.00 0.00 O ATOM 23758 H1 WAT 3520 32.037 128.101 128.989 1.00 0.00 H ATOM 23759 H2 WAT 3520 31.346 129.423 128.733 1.00 0.00 H TER 23761 WAT 3520 ATOM 23761 O WAT 3521 28.464 25.750 95.198 1.00 0.00 O ATOM 23762 H1 WAT 3521 29.028 26.450 95.527 1.00 0.00 H ATOM 23763 H2 WAT 3521 28.274 26.001 94.294 1.00 0.00 H TER 23765 WAT 3521 ATOM 23765 O WAT 3522 58.022 145.763 0.998 1.00 0.00 O ATOM 23766 H1 WAT 3522 58.759 145.210 1.257 1.00 0.00 H ATOM 23767 H2 WAT 3522 57.309 145.501 1.581 1.00 0.00 H TER 23769 WAT 3522 ATOM 23769 O WAT 3523 90.945 93.413 109.777 1.00 0.00 O ATOM 23770 H1 WAT 3523 90.073 93.150 110.072 1.00 0.00 H ATOM 23771 H2 WAT 3523 90.804 94.249 109.332 1.00 0.00 H TER 23773 WAT 3523 ATOM 23773 O WAT 3524 26.337 113.263 72.458 1.00 0.00 O ATOM 23774 H1 WAT 3524 27.221 113.343 72.101 1.00 0.00 H ATOM 23775 H2 WAT 3524 26.292 112.365 72.788 1.00 0.00 H TER 23777 WAT 3524 ATOM 23777 O WAT 3525 90.397 66.311 107.980 1.00 0.00 O ATOM 23778 H1 WAT 3525 89.746 66.030 107.337 1.00 0.00 H ATOM 23779 H2 WAT 3525 89.987 66.135 108.827 1.00 0.00 H TER 23781 WAT 3525 ATOM 23781 O WAT 3526 87.087 90.192 125.786 1.00 0.00 O ATOM 23782 H1 WAT 3526 86.515 90.270 125.023 1.00 0.00 H ATOM 23783 H2 WAT 3526 86.707 89.478 126.298 1.00 0.00 H TER 23785 WAT 3526 ATOM 23785 O WAT 3527 58.441 25.324 72.991 1.00 0.00 O ATOM 23786 H1 WAT 3527 58.643 24.530 72.496 1.00 0.00 H ATOM 23787 H2 WAT 3527 57.673 25.092 73.513 1.00 0.00 H TER 23789 WAT 3527 ATOM 23789 O WAT 3528 111.091 99.069 118.653 1.00 0.00 O ATOM 23790 H1 WAT 3528 110.328 99.112 118.077 1.00 0.00 H ATOM 23791 H2 WAT 3528 111.289 99.982 118.858 1.00 0.00 H TER 23793 WAT 3528 ATOM 23793 O WAT 3529 70.724 142.268 58.959 1.00 0.00 O ATOM 23794 H1 WAT 3529 70.181 143.021 59.192 1.00 0.00 H ATOM 23795 H2 WAT 3529 70.799 142.313 58.006 1.00 0.00 H TER 23797 WAT 3529 ATOM 23797 O WAT 3530 31.423 123.890 51.101 1.00 0.00 O ATOM 23798 H1 WAT 3530 30.991 123.064 51.321 1.00 0.00 H ATOM 23799 H2 WAT 3530 32.291 123.819 51.499 1.00 0.00 H TER 23801 WAT 3530 ATOM 23801 O WAT 3531 45.407 22.141 147.477 1.00 0.00 O ATOM 23802 H1 WAT 3531 46.189 22.417 147.954 1.00 0.00 H ATOM 23803 H2 WAT 3531 45.038 21.436 148.009 1.00 0.00 H TER 23805 WAT 3531 ATOM 23805 O WAT 3532 110.613 108.127 101.798 1.00 0.00 O ATOM 23806 H1 WAT 3532 109.771 108.234 101.357 1.00 0.00 H ATOM 23807 H2 WAT 3532 110.494 107.360 102.359 1.00 0.00 H TER 23809 WAT 3532 ATOM 23809 O WAT 3533 54.763 96.944 140.963 1.00 0.00 O ATOM 23810 H1 WAT 3533 54.790 96.017 140.724 1.00 0.00 H ATOM 23811 H2 WAT 3533 53.842 97.187 140.875 1.00 0.00 H TER 23813 WAT 3533 ATOM 23813 O WAT 3534 19.476 115.740 91.619 1.00 0.00 O ATOM 23814 H1 WAT 3534 19.451 115.777 92.575 1.00 0.00 H ATOM 23815 H2 WAT 3534 19.711 114.833 91.420 1.00 0.00 H TER 23817 WAT 3534 ATOM 23817 O WAT 3535 107.049 109.208 117.988 1.00 0.00 O ATOM 23818 H1 WAT 3535 106.172 109.504 118.232 1.00 0.00 H ATOM 23819 H2 WAT 3535 106.977 108.984 117.060 1.00 0.00 H TER 23821 WAT 3535 ATOM 23821 O WAT 3536 28.381 48.101 89.914 1.00 0.00 O ATOM 23822 H1 WAT 3536 27.970 47.906 89.072 1.00 0.00 H ATOM 23823 H2 WAT 3536 29.086 48.713 89.700 1.00 0.00 H TER 23825 WAT 3536 ATOM 23825 O WAT 3537 63.824 68.094 67.651 1.00 0.00 O ATOM 23826 H1 WAT 3537 64.460 68.314 66.970 1.00 0.00 H ATOM 23827 H2 WAT 3537 63.810 68.862 68.222 1.00 0.00 H TER 23829 WAT 3537 ATOM 23829 O WAT 3538 115.051 28.092 94.289 1.00 0.00 O ATOM 23830 H1 WAT 3538 115.246 27.169 94.450 1.00 0.00 H ATOM 23831 H2 WAT 3538 114.214 28.240 94.731 1.00 0.00 H TER 23833 WAT 3538 ATOM 23833 O WAT 3539 1.165 16.923 17.517 1.00 0.00 O ATOM 23834 H1 WAT 3539 2.073 17.224 17.527 1.00 0.00 H ATOM 23835 H2 WAT 3539 0.738 17.426 18.210 1.00 0.00 H TER 23837 WAT 3539 ATOM 23837 O WAT 3540 137.248 132.900 75.160 1.00 0.00 O ATOM 23838 H1 WAT 3540 138.055 133.243 74.776 1.00 0.00 H ATOM 23839 H2 WAT 3540 137.015 132.158 74.602 1.00 0.00 H TER 23841 WAT 3540 ATOM 23841 O WAT 3541 47.968 103.538 146.296 1.00 0.00 O ATOM 23842 H1 WAT 3541 47.729 104.301 145.769 1.00 0.00 H ATOM 23843 H2 WAT 3541 47.374 103.568 147.045 1.00 0.00 H TER 23845 WAT 3541 ATOM 23845 O WAT 3542 70.117 124.181 65.895 1.00 0.00 O ATOM 23846 H1 WAT 3542 70.024 123.796 66.767 1.00 0.00 H ATOM 23847 H2 WAT 3542 70.728 124.908 66.018 1.00 0.00 H TER 23849 WAT 3542 ATOM 23849 O WAT 3543 98.339 29.039 123.345 1.00 0.00 O ATOM 23850 H1 WAT 3543 97.827 29.020 124.154 1.00 0.00 H ATOM 23851 H2 WAT 3543 97.774 29.484 122.714 1.00 0.00 H TER 23853 WAT 3543 ATOM 23853 O WAT 3544 14.460 125.986 10.870 1.00 0.00 O ATOM 23854 H1 WAT 3544 14.712 126.855 11.183 1.00 0.00 H ATOM 23855 H2 WAT 3544 15.254 125.460 10.958 1.00 0.00 H TER 23857 WAT 3544 ATOM 23857 O WAT 3545 20.533 2.861 108.544 1.00 0.00 O ATOM 23858 H1 WAT 3545 21.461 2.745 108.748 1.00 0.00 H ATOM 23859 H2 WAT 3545 20.523 3.496 107.827 1.00 0.00 H TER 23861 WAT 3545 ATOM 23861 O WAT 3546 22.940 44.752 136.418 1.00 0.00 O ATOM 23862 H1 WAT 3546 22.026 44.503 136.283 1.00 0.00 H ATOM 23863 H2 WAT 3546 23.254 44.992 135.546 1.00 0.00 H TER 23865 WAT 3546 ATOM 23865 O WAT 3547 130.352 144.236 7.709 1.00 0.00 O ATOM 23866 H1 WAT 3547 129.574 144.781 7.830 1.00 0.00 H ATOM 23867 H2 WAT 3547 131.061 144.861 7.559 1.00 0.00 H TER 23869 WAT 3547 ATOM 23869 O WAT 3548 64.105 100.346 10.952 1.00 0.00 O ATOM 23870 H1 WAT 3548 63.268 100.707 10.661 1.00 0.00 H ATOM 23871 H2 WAT 3548 64.189 99.520 10.476 1.00 0.00 H TER 23873 WAT 3548 ATOM 23873 O WAT 3549 22.246 144.997 154.430 1.00 0.00 O ATOM 23874 H1 WAT 3549 22.737 145.387 153.707 1.00 0.00 H ATOM 23875 H2 WAT 3549 22.674 144.155 154.585 1.00 0.00 H TER 23877 WAT 3549 ATOM 23877 O WAT 3550 121.865 132.012 104.925 1.00 0.00 O ATOM 23878 H1 WAT 3550 121.286 132.332 104.234 1.00 0.00 H ATOM 23879 H2 WAT 3550 122.261 132.802 105.292 1.00 0.00 H TER 23881 WAT 3550 ATOM 23881 O WAT 3551 124.071 141.591 101.452 1.00 0.00 O ATOM 23882 H1 WAT 3551 123.217 141.190 101.611 1.00 0.00 H ATOM 23883 H2 WAT 3551 123.933 142.154 100.690 1.00 0.00 H TER 23885 WAT 3551 ATOM 23885 O WAT 3552 59.953 143.724 87.772 1.00 0.00 O ATOM 23886 H1 WAT 3552 59.063 143.805 88.115 1.00 0.00 H ATOM 23887 H2 WAT 3552 60.510 143.719 88.550 1.00 0.00 H TER 23889 WAT 3552 ATOM 23889 O WAT 3553 34.333 134.408 103.005 1.00 0.00 O ATOM 23890 H1 WAT 3553 34.256 134.487 103.956 1.00 0.00 H ATOM 23891 H2 WAT 3553 33.468 134.114 102.719 1.00 0.00 H TER 23893 WAT 3553 ATOM 23893 O WAT 3554 9.909 48.156 145.362 1.00 0.00 O ATOM 23894 H1 WAT 3554 10.508 48.701 145.872 1.00 0.00 H ATOM 23895 H2 WAT 3554 10.221 48.236 144.461 1.00 0.00 H TER 23897 WAT 3554 ATOM 23897 O WAT 3555 64.006 12.920 18.799 1.00 0.00 O ATOM 23898 H1 WAT 3555 63.106 13.183 18.607 1.00 0.00 H ATOM 23899 H2 WAT 3555 63.921 12.262 19.488 1.00 0.00 H TER 23901 WAT 3555 ATOM 23901 O WAT 3556 4.291 -0.147 117.074 1.00 0.00 O ATOM 23902 H1 WAT 3556 3.995 0.245 116.253 1.00 0.00 H ATOM 23903 H2 WAT 3556 4.266 0.572 117.706 1.00 0.00 H TER 23905 WAT 3556 ATOM 23905 O WAT 3557 36.540 26.133 80.090 1.00 0.00 O ATOM 23906 H1 WAT 3557 35.610 26.232 80.293 1.00 0.00 H ATOM 23907 H2 WAT 3557 36.836 27.019 79.883 1.00 0.00 H TER 23909 WAT 3557 ATOM 23909 O WAT 3558 69.951 44.760 9.473 1.00 0.00 O ATOM 23910 H1 WAT 3558 70.170 43.878 9.171 1.00 0.00 H ATOM 23911 H2 WAT 3558 70.786 45.127 9.765 1.00 0.00 H TER 23913 WAT 3558 ATOM 23913 O WAT 3559 45.782 101.216 12.955 1.00 0.00 O ATOM 23914 H1 WAT 3559 45.292 100.394 12.949 1.00 0.00 H ATOM 23915 H2 WAT 3559 46.315 101.183 12.161 1.00 0.00 H TER 23917 WAT 3559 ATOM 23917 O WAT 3560 123.826 35.938 120.995 1.00 0.00 O ATOM 23918 H1 WAT 3560 124.500 35.928 121.675 1.00 0.00 H ATOM 23919 H2 WAT 3560 123.732 35.020 120.739 1.00 0.00 H TER 23921 WAT 3560 ATOM 23921 O WAT 3561 73.171 44.988 142.068 1.00 0.00 O ATOM 23922 H1 WAT 3561 74.064 45.085 142.400 1.00 0.00 H ATOM 23923 H2 WAT 3561 73.210 45.324 141.173 1.00 0.00 H TER 23925 WAT 3561 ATOM 23925 O WAT 3562 78.297 103.797 77.771 1.00 0.00 O ATOM 23926 H1 WAT 3562 78.017 104.296 77.003 1.00 0.00 H ATOM 23927 H2 WAT 3562 77.482 103.475 78.156 1.00 0.00 H TER 23929 WAT 3562 ATOM 23929 O WAT 3563 70.435 115.865 157.144 1.00 0.00 O ATOM 23930 H1 WAT 3563 70.293 116.281 156.293 1.00 0.00 H ATOM 23931 H2 WAT 3563 70.807 116.557 157.690 1.00 0.00 H TER 23933 WAT 3563 ATOM 23933 O WAT 3564 105.147 134.421 22.700 1.00 0.00 O ATOM 23934 H1 WAT 3564 105.448 135.135 23.262 1.00 0.00 H ATOM 23935 H2 WAT 3564 105.607 133.649 23.028 1.00 0.00 H TER 23937 WAT 3564 ATOM 23937 O WAT 3565 145.071 132.239 57.447 1.00 0.00 O ATOM 23938 H1 WAT 3565 144.560 131.635 56.907 1.00 0.00 H ATOM 23939 H2 WAT 3565 144.423 132.661 58.011 1.00 0.00 H TER 23941 WAT 3565 ATOM 23941 O WAT 3566 73.942 113.041 94.634 1.00 0.00 O ATOM 23942 H1 WAT 3566 74.810 113.072 95.037 1.00 0.00 H ATOM 23943 H2 WAT 3566 73.720 112.110 94.612 1.00 0.00 H TER 23945 WAT 3566 ATOM 23945 O WAT 3567 42.923 142.487 113.002 1.00 0.00 O ATOM 23946 H1 WAT 3567 43.075 141.598 113.322 1.00 0.00 H ATOM 23947 H2 WAT 3567 43.306 142.495 112.125 1.00 0.00 H TER 23949 WAT 3567 ATOM 23949 O WAT 3568 101.454 129.859 155.729 1.00 0.00 O ATOM 23950 H1 WAT 3568 102.077 129.597 155.051 1.00 0.00 H ATOM 23951 H2 WAT 3568 101.547 130.810 155.786 1.00 0.00 H TER 23953 WAT 3568 ATOM 23953 O WAT 3569 91.655 52.806 80.710 1.00 0.00 O ATOM 23954 H1 WAT 3569 90.832 52.550 80.292 1.00 0.00 H ATOM 23955 H2 WAT 3569 92.238 52.061 80.566 1.00 0.00 H TER 23957 WAT 3569 ATOM 23957 O WAT 3570 138.813 127.313 79.194 1.00 0.00 O ATOM 23958 H1 WAT 3570 139.510 127.498 78.564 1.00 0.00 H ATOM 23959 H2 WAT 3570 139.254 127.305 80.043 1.00 0.00 H TER 23961 WAT 3570 ATOM 23961 O WAT 3571 35.671 144.974 91.478 1.00 0.00 O ATOM 23962 H1 WAT 3571 36.616 144.969 91.626 1.00 0.00 H ATOM 23963 H2 WAT 3571 35.386 144.091 91.717 1.00 0.00 H TER 23965 WAT 3571 ATOM 23965 O WAT 3572 80.266 140.129 87.503 1.00 0.00 O ATOM 23966 H1 WAT 3572 79.538 140.739 87.625 1.00 0.00 H ATOM 23967 H2 WAT 3572 79.894 139.411 86.990 1.00 0.00 H TER 23969 WAT 3572 ATOM 23969 O WAT 3573 36.776 60.449 82.481 1.00 0.00 O ATOM 23970 H1 WAT 3573 36.659 59.736 83.109 1.00 0.00 H ATOM 23971 H2 WAT 3573 36.859 60.011 81.634 1.00 0.00 H TER 23973 WAT 3573 ATOM 23973 O WAT 3574 116.496 106.737 141.416 1.00 0.00 O ATOM 23974 H1 WAT 3574 115.881 106.051 141.676 1.00 0.00 H ATOM 23975 H2 WAT 3574 116.363 106.833 140.473 1.00 0.00 H TER 23977 WAT 3574 ATOM 23977 O WAT 3575 34.667 65.932 67.522 1.00 0.00 O ATOM 23978 H1 WAT 3575 34.445 66.317 66.675 1.00 0.00 H ATOM 23979 H2 WAT 3575 34.990 65.056 67.310 1.00 0.00 H TER 23981 WAT 3575 ATOM 23981 O WAT 3576 12.256 13.874 156.488 1.00 0.00 O ATOM 23982 H1 WAT 3576 11.970 14.429 157.214 1.00 0.00 H ATOM 23983 H2 WAT 3576 11.592 14.002 155.812 1.00 0.00 H TER 23985 WAT 3576 ATOM 23985 O WAT 3577 95.152 76.831 91.302 1.00 0.00 O ATOM 23986 H1 WAT 3577 94.287 76.740 91.703 1.00 0.00 H ATOM 23987 H2 WAT 3577 95.756 76.475 91.953 1.00 0.00 H TER 23989 WAT 3577 ATOM 23989 O WAT 3578 135.574 43.048 2.073 1.00 0.00 O ATOM 23990 H1 WAT 3578 136.240 42.383 2.245 1.00 0.00 H ATOM 23991 H2 WAT 3578 135.824 43.426 1.230 1.00 0.00 H TER 23993 WAT 3578 ATOM 23993 O WAT 3579 46.812 15.446 88.104 1.00 0.00 O ATOM 23994 H1 WAT 3579 47.220 14.580 88.139 1.00 0.00 H ATOM 23995 H2 WAT 3579 45.881 15.278 88.254 1.00 0.00 H TER 23997 WAT 3579 ATOM 23997 O WAT 3580 45.482 141.693 139.121 1.00 0.00 O ATOM 23998 H1 WAT 3580 45.057 142.544 139.227 1.00 0.00 H ATOM 23999 H2 WAT 3580 46.054 141.803 138.362 1.00 0.00 H TER 24001 WAT 3580 ATOM 24001 O WAT 3581 85.698 89.352 68.835 1.00 0.00 O ATOM 24002 H1 WAT 3581 86.507 89.573 68.373 1.00 0.00 H ATOM 24003 H2 WAT 3581 85.616 90.024 69.511 1.00 0.00 H TER 24005 WAT 3581 ATOM 24005 O WAT 3582 109.009 42.742 99.140 1.00 0.00 O ATOM 24006 H1 WAT 3582 108.959 43.633 99.485 1.00 0.00 H ATOM 24007 H2 WAT 3582 109.803 42.736 98.605 1.00 0.00 H TER 24009 WAT 3582 ATOM 24009 O WAT 3583 56.985 51.287 135.206 1.00 0.00 O ATOM 24010 H1 WAT 3583 57.300 50.665 134.549 1.00 0.00 H ATOM 24011 H2 WAT 3583 57.775 51.732 135.512 1.00 0.00 H TER 24013 WAT 3583 ATOM 24013 O WAT 3584 124.384 145.208 140.038 1.00 0.00 O ATOM 24014 H1 WAT 3584 123.458 145.145 140.273 1.00 0.00 H ATOM 24015 H2 WAT 3584 124.729 144.327 140.188 1.00 0.00 H TER 24017 WAT 3584 ATOM 24017 O WAT 3585 111.677 136.419 90.932 1.00 0.00 O ATOM 24018 H1 WAT 3585 111.775 136.214 90.003 1.00 0.00 H ATOM 24019 H2 WAT 3585 111.216 135.664 91.297 1.00 0.00 H TER 24021 WAT 3585 ATOM 24021 O WAT 3586 103.242 139.316 118.525 1.00 0.00 O ATOM 24022 H1 WAT 3586 102.962 138.532 118.998 1.00 0.00 H ATOM 24023 H2 WAT 3586 102.492 139.546 117.977 1.00 0.00 H TER 24025 WAT 3586 ATOM 24025 O WAT 3587 48.711 85.683 147.458 1.00 0.00 O ATOM 24026 H1 WAT 3587 48.913 85.256 148.290 1.00 0.00 H ATOM 24027 H2 WAT 3587 49.109 85.118 146.796 1.00 0.00 H TER 24029 WAT 3587 ATOM 24029 O WAT 3588 107.790 62.204 114.977 1.00 0.00 O ATOM 24030 H1 WAT 3588 108.465 61.950 115.607 1.00 0.00 H ATOM 24031 H2 WAT 3588 107.180 61.467 114.969 1.00 0.00 H TER 24033 WAT 3588 ATOM 24033 O WAT 3589 37.473 83.489 81.184 1.00 0.00 O ATOM 24034 H1 WAT 3589 37.784 83.353 82.079 1.00 0.00 H ATOM 24035 H2 WAT 3589 36.554 83.738 81.285 1.00 0.00 H TER 24037 WAT 3589 ATOM 24037 O WAT 3590 132.848 5.977 70.410 1.00 0.00 O ATOM 24038 H1 WAT 3590 132.875 6.919 70.243 1.00 0.00 H ATOM 24039 H2 WAT 3590 132.355 5.618 69.672 1.00 0.00 H TER 24041 WAT 3590 ATOM 24041 O WAT 3591 140.377 145.424 105.909 1.00 0.00 O ATOM 24042 H1 WAT 3591 139.448 145.520 105.698 1.00 0.00 H ATOM 24043 H2 WAT 3591 140.562 144.497 105.756 1.00 0.00 H TER 24045 WAT 3591 ATOM 24045 O WAT 3592 71.223 64.130 148.881 1.00 0.00 O ATOM 24046 H1 WAT 3592 70.383 63.691 148.752 1.00 0.00 H ATOM 24047 H2 WAT 3592 71.835 63.422 149.083 1.00 0.00 H TER 24049 WAT 3592 ATOM 24049 O WAT 3593 56.841 106.092 91.412 1.00 0.00 O ATOM 24050 H1 WAT 3593 56.804 105.147 91.263 1.00 0.00 H ATOM 24051 H2 WAT 3593 56.900 106.182 92.363 1.00 0.00 H TER 24053 WAT 3593 ATOM 24053 O WAT 3594 122.045 20.262 125.370 1.00 0.00 O ATOM 24054 H1 WAT 3594 122.382 19.790 124.608 1.00 0.00 H ATOM 24055 H2 WAT 3594 122.739 20.186 126.025 1.00 0.00 H TER 24057 WAT 3594 ATOM 24057 O WAT 3595 114.862 127.629 126.436 1.00 0.00 O ATOM 24058 H1 WAT 3595 114.592 128.026 127.264 1.00 0.00 H ATOM 24059 H2 WAT 3595 115.754 127.321 126.597 1.00 0.00 H TER 24061 WAT 3595 ATOM 24061 O WAT 3596 65.692 34.764 95.061 1.00 0.00 O ATOM 24062 H1 WAT 3596 66.642 34.661 95.118 1.00 0.00 H ATOM 24063 H2 WAT 3596 65.545 35.701 95.184 1.00 0.00 H TER 24065 WAT 3596 ATOM 24065 O WAT 3597 95.382 11.898 146.545 1.00 0.00 O ATOM 24066 H1 WAT 3597 95.607 11.205 147.166 1.00 0.00 H ATOM 24067 H2 WAT 3597 94.461 12.090 146.724 1.00 0.00 H TER 24069 WAT 3597 ATOM 24069 O WAT 3598 134.404 8.677 109.343 1.00 0.00 O ATOM 24070 H1 WAT 3598 133.467 8.664 109.150 1.00 0.00 H ATOM 24071 H2 WAT 3598 134.795 8.120 108.669 1.00 0.00 H TER 24073 WAT 3598 ATOM 24073 O WAT 3599 69.493 137.840 125.877 1.00 0.00 O ATOM 24074 H1 WAT 3599 69.946 137.008 125.743 1.00 0.00 H ATOM 24075 H2 WAT 3599 70.164 138.423 126.233 1.00 0.00 H TER 24077 WAT 3599 ATOM 24077 O WAT 3600 12.883 48.675 153.928 1.00 0.00 O ATOM 24078 H1 WAT 3600 12.100 48.572 154.469 1.00 0.00 H ATOM 24079 H2 WAT 3600 12.590 48.468 153.041 1.00 0.00 H TER 24081 WAT 3600 ATOM 24081 O WAT 3601 95.962 21.959 104.778 1.00 0.00 O ATOM 24082 H1 WAT 3601 95.955 22.436 103.949 1.00 0.00 H ATOM 24083 H2 WAT 3601 95.076 22.068 105.125 1.00 0.00 H TER 24085 WAT 3601 ATOM 24085 O WAT 3602 6.147 99.098 115.099 1.00 0.00 O ATOM 24086 H1 WAT 3602 6.741 99.832 114.942 1.00 0.00 H ATOM 24087 H2 WAT 3602 6.660 98.322 114.876 1.00 0.00 H TER 24089 WAT 3602 ATOM 24089 O WAT 3603 145.460 58.875 110.734 1.00 0.00 O ATOM 24090 H1 WAT 3603 145.859 59.744 110.704 1.00 0.00 H ATOM 24091 H2 WAT 3603 145.970 58.356 110.111 1.00 0.00 H TER 24093 WAT 3603 ATOM 24093 O WAT 3604 45.752 142.382 18.869 1.00 0.00 O ATOM 24094 H1 WAT 3604 45.912 142.656 19.772 1.00 0.00 H ATOM 24095 H2 WAT 3604 44.872 142.007 18.884 1.00 0.00 H TER 24097 WAT 3604 ATOM 24097 O WAT 3605 106.663 95.449 143.962 1.00 0.00 O ATOM 24098 H1 WAT 3605 106.593 96.364 144.233 1.00 0.00 H ATOM 24099 H2 WAT 3605 106.630 95.478 143.006 1.00 0.00 H TER 24101 WAT 3605 ATOM 24101 O WAT 3606 41.564 103.881 89.673 1.00 0.00 O ATOM 24102 H1 WAT 3606 40.698 103.531 89.463 1.00 0.00 H ATOM 24103 H2 WAT 3606 41.957 104.074 88.822 1.00 0.00 H TER 24105 WAT 3606 ATOM 24105 O WAT 3607 79.215 83.139 103.213 1.00 0.00 O ATOM 24106 H1 WAT 3607 80.086 83.219 102.823 1.00 0.00 H ATOM 24107 H2 WAT 3607 78.802 83.988 103.052 1.00 0.00 H TER 24109 WAT 3607 ATOM 24109 O WAT 3608 3.112 28.154 84.365 1.00 0.00 O ATOM 24110 H1 WAT 3608 3.308 27.250 84.611 1.00 0.00 H ATOM 24111 H2 WAT 3608 2.670 28.081 83.519 1.00 0.00 H TER 24113 WAT 3608 ATOM 24113 O WAT 3609 3.573 37.634 91.672 1.00 0.00 O ATOM 24114 H1 WAT 3609 3.579 38.422 92.216 1.00 0.00 H ATOM 24115 H2 WAT 3609 3.780 37.949 90.792 1.00 0.00 H TER 24117 WAT 3609 ATOM 24117 O WAT 3610 128.620 84.223 6.739 1.00 0.00 O ATOM 24118 H1 WAT 3610 127.755 84.624 6.659 1.00 0.00 H ATOM 24119 H2 WAT 3610 129.010 84.321 5.870 1.00 0.00 H TER 24121 WAT 3610 ATOM 24121 O WAT 3611 52.217 31.012 92.672 1.00 0.00 O ATOM 24122 H1 WAT 3611 51.569 30.827 91.992 1.00 0.00 H ATOM 24123 H2 WAT 3611 51.923 30.501 93.427 1.00 0.00 H TER 24125 WAT 3611 ATOM 24125 O WAT 3612 47.932 41.813 128.115 1.00 0.00 O ATOM 24126 H1 WAT 3612 47.593 42.358 127.405 1.00 0.00 H ATOM 24127 H2 WAT 3612 48.235 41.015 127.682 1.00 0.00 H TER 24129 WAT 3612 ATOM 24129 O WAT 3613 122.824 48.860 124.241 1.00 0.00 O ATOM 24130 H1 WAT 3613 122.786 49.763 123.927 1.00 0.00 H ATOM 24131 H2 WAT 3613 123.543 48.465 123.747 1.00 0.00 H TER 24133 WAT 3613 ATOM 24133 O WAT 3614 14.338 85.018 147.048 1.00 0.00 O ATOM 24134 H1 WAT 3614 14.768 85.444 147.789 1.00 0.00 H ATOM 24135 H2 WAT 3614 14.537 84.088 147.157 1.00 0.00 H TER 24137 WAT 3614 ATOM 24137 O WAT 3615 78.223 88.695 76.190 1.00 0.00 O ATOM 24138 H1 WAT 3615 78.297 87.925 76.754 1.00 0.00 H ATOM 24139 H2 WAT 3615 77.772 89.345 76.729 1.00 0.00 H TER 24141 WAT 3615 ATOM 24141 O WAT 3616 4.202 72.388 66.138 1.00 0.00 O ATOM 24142 H1 WAT 3616 4.644 71.698 65.644 1.00 0.00 H ATOM 24143 H2 WAT 3616 3.270 72.188 66.048 1.00 0.00 H TER 24145 WAT 3616 ATOM 24145 O WAT 3617 110.773 5.777 60.327 1.00 0.00 O ATOM 24146 H1 WAT 3617 110.546 5.675 59.403 1.00 0.00 H ATOM 24147 H2 WAT 3617 110.492 4.958 60.734 1.00 0.00 H TER 24149 WAT 3617 ATOM 24149 O WAT 3618 41.823 73.480 79.225 1.00 0.00 O ATOM 24150 H1 WAT 3618 41.929 73.194 80.132 1.00 0.00 H ATOM 24151 H2 WAT 3618 41.435 74.353 79.292 1.00 0.00 H TER 24153 WAT 3618 ATOM 24153 O WAT 3619 108.050 6.541 7.531 1.00 0.00 O ATOM 24154 H1 WAT 3619 107.371 6.868 6.941 1.00 0.00 H ATOM 24155 H2 WAT 3619 107.682 6.656 8.407 1.00 0.00 H TER 24157 WAT 3619 ATOM 24157 O WAT 3620 76.797 124.894 109.728 1.00 0.00 O ATOM 24158 H1 WAT 3620 75.995 124.502 110.074 1.00 0.00 H ATOM 24159 H2 WAT 3620 76.547 125.791 109.504 1.00 0.00 H TER 24161 WAT 3620 ATOM 24161 O WAT 3621 97.731 140.786 56.650 1.00 0.00 O ATOM 24162 H1 WAT 3621 98.221 140.047 56.290 1.00 0.00 H ATOM 24163 H2 WAT 3621 98.172 140.987 57.476 1.00 0.00 H TER 24165 WAT 3621 ATOM 24165 O WAT 3622 144.626 72.599 86.943 1.00 0.00 O ATOM 24166 H1 WAT 3622 144.203 73.376 86.577 1.00 0.00 H ATOM 24167 H2 WAT 3622 143.909 72.093 87.325 1.00 0.00 H TER 24169 WAT 3622 ATOM 24169 O WAT 3623 74.543 118.432 156.766 1.00 0.00 O ATOM 24170 H1 WAT 3623 74.411 117.501 156.587 1.00 0.00 H ATOM 24171 H2 WAT 3623 74.829 118.799 155.930 1.00 0.00 H TER 24173 WAT 3623 ATOM 24173 O WAT 3624 23.810 90.614 100.253 1.00 0.00 O ATOM 24174 H1 WAT 3624 22.909 90.705 99.941 1.00 0.00 H ATOM 24175 H2 WAT 3624 23.820 91.076 101.092 1.00 0.00 H TER 24177 WAT 3624 ATOM 24177 O WAT 3625 15.416 121.443 157.354 1.00 0.00 O ATOM 24178 H1 WAT 3625 15.294 122.062 158.074 1.00 0.00 H ATOM 24179 H2 WAT 3625 14.565 121.015 157.260 1.00 0.00 H TER 24181 WAT 3625 ATOM 24181 O WAT 3626 132.710 69.466 107.025 1.00 0.00 O ATOM 24182 H1 WAT 3626 133.513 68.961 106.900 1.00 0.00 H ATOM 24183 H2 WAT 3626 132.869 70.288 106.562 1.00 0.00 H TER 24185 WAT 3626 ATOM 24185 O WAT 3627 74.724 25.391 148.228 1.00 0.00 O ATOM 24186 H1 WAT 3627 74.392 26.288 148.256 1.00 0.00 H ATOM 24187 H2 WAT 3627 74.034 24.893 147.790 1.00 0.00 H TER 24189 WAT 3627 ATOM 24189 O WAT 3628 115.236 105.736 18.054 1.00 0.00 O ATOM 24190 H1 WAT 3628 115.903 105.677 18.739 1.00 0.00 H ATOM 24191 H2 WAT 3628 114.626 105.025 18.252 1.00 0.00 H TER 24193 WAT 3628 ATOM 24193 O WAT 3629 134.829 49.458 139.848 1.00 0.00 O ATOM 24194 H1 WAT 3629 135.549 48.833 139.764 1.00 0.00 H ATOM 24195 H2 WAT 3629 134.609 49.447 140.780 1.00 0.00 H TER 24197 WAT 3629 ATOM 24197 O WAT 3630 95.063 81.914 74.099 1.00 0.00 O ATOM 24198 H1 WAT 3630 95.343 81.809 75.008 1.00 0.00 H ATOM 24199 H2 WAT 3630 94.793 82.831 74.036 1.00 0.00 H TER 24201 WAT 3630 ATOM 24201 O WAT 3631 116.047 64.333 112.907 1.00 0.00 O ATOM 24202 H1 WAT 3631 115.772 64.255 111.994 1.00 0.00 H ATOM 24203 H2 WAT 3631 115.450 64.979 113.283 1.00 0.00 H TER 24205 WAT 3631 ATOM 24205 O WAT 3632 41.739 129.549 141.953 1.00 0.00 O ATOM 24206 H1 WAT 3632 40.980 129.694 141.388 1.00 0.00 H ATOM 24207 H2 WAT 3632 41.371 129.207 142.767 1.00 0.00 H TER 24209 WAT 3632 ATOM 24209 O WAT 3633 35.898 144.825 146.420 1.00 0.00 O ATOM 24210 H1 WAT 3633 36.157 143.971 146.764 1.00 0.00 H ATOM 24211 H2 WAT 3633 36.431 145.452 146.909 1.00 0.00 H TER 24213 WAT 3633 ATOM 24213 O WAT 3634 138.465 119.005 113.679 1.00 0.00 O ATOM 24214 H1 WAT 3634 137.964 118.210 113.863 1.00 0.00 H ATOM 24215 H2 WAT 3634 137.864 119.720 113.888 1.00 0.00 H TER 24217 WAT 3634 ATOM 24217 O WAT 3635 21.020 75.281 131.177 1.00 0.00 O ATOM 24218 H1 WAT 3635 21.373 75.894 130.533 1.00 0.00 H ATOM 24219 H2 WAT 3635 21.577 75.395 131.947 1.00 0.00 H TER 24221 WAT 3635 ATOM 24221 O WAT 3636 34.417 41.236 86.555 1.00 0.00 O ATOM 24222 H1 WAT 3636 33.713 41.516 85.970 1.00 0.00 H ATOM 24223 H2 WAT 3636 34.081 41.409 87.434 1.00 0.00 H TER 24225 WAT 3636 ATOM 24225 O WAT 3637 131.236 26.704 121.867 1.00 0.00 O ATOM 24226 H1 WAT 3637 130.677 26.172 122.434 1.00 0.00 H ATOM 24227 H2 WAT 3637 131.184 26.278 121.012 1.00 0.00 H TER 24229 WAT 3637 ATOM 24229 O WAT 3638 128.456 113.272 101.501 1.00 0.00 O ATOM 24230 H1 WAT 3638 128.492 112.845 100.645 1.00 0.00 H ATOM 24231 H2 WAT 3638 128.270 114.190 101.302 1.00 0.00 H TER 24233 WAT 3638 ATOM 24233 O WAT 3639 142.514 95.965 149.418 1.00 0.00 O ATOM 24234 H1 WAT 3639 143.104 96.361 150.059 1.00 0.00 H ATOM 24235 H2 WAT 3639 143.088 95.687 148.704 1.00 0.00 H TER 24237 WAT 3639 ATOM 24237 O WAT 3640 60.763 38.618 131.116 1.00 0.00 O ATOM 24238 H1 WAT 3640 61.511 38.060 131.330 1.00 0.00 H ATOM 24239 H2 WAT 3640 60.032 38.233 131.599 1.00 0.00 H TER 24241 WAT 3640 ATOM 24241 O WAT 3641 133.278 46.056 87.519 1.00 0.00 O ATOM 24242 H1 WAT 3641 132.996 46.238 86.623 1.00 0.00 H ATOM 24243 H2 WAT 3641 132.938 46.790 88.031 1.00 0.00 H TER 24245 WAT 3641 ATOM 24245 O WAT 3642 101.141 114.343 143.672 1.00 0.00 O ATOM 24246 H1 WAT 3642 101.007 114.356 144.619 1.00 0.00 H ATOM 24247 H2 WAT 3642 100.442 114.895 143.323 1.00 0.00 H TER 24249 WAT 3642 ATOM 24249 O WAT 3643 36.456 21.732 11.698 1.00 0.00 O ATOM 24250 H1 WAT 3643 36.938 22.189 12.387 1.00 0.00 H ATOM 24251 H2 WAT 3643 36.775 22.121 10.884 1.00 0.00 H TER 24253 WAT 3643 ATOM 24253 O WAT 3644 128.475 0.663 56.475 1.00 0.00 O ATOM 24254 H1 WAT 3644 128.740 -0.222 56.725 1.00 0.00 H ATOM 24255 H2 WAT 3644 128.373 1.126 57.307 1.00 0.00 H TER 24257 WAT 3644 ATOM 24257 O WAT 3645 139.089 60.474 8.274 1.00 0.00 O ATOM 24258 H1 WAT 3645 138.985 61.348 7.898 1.00 0.00 H ATOM 24259 H2 WAT 3645 139.986 60.462 8.608 1.00 0.00 H TER 24261 WAT 3645 ATOM 24261 O WAT 3646 76.498 48.492 2.747 1.00 0.00 O ATOM 24262 H1 WAT 3646 76.815 49.309 3.131 1.00 0.00 H ATOM 24263 H2 WAT 3646 77.260 48.124 2.301 1.00 0.00 H TER 24265 WAT 3646 ATOM 24265 O WAT 3647 26.422 83.752 97.021 1.00 0.00 O ATOM 24266 H1 WAT 3647 25.578 83.344 96.826 1.00 0.00 H ATOM 24267 H2 WAT 3647 27.069 83.145 96.662 1.00 0.00 H TER 24269 WAT 3647 ATOM 24269 O WAT 3648 44.457 61.087 104.456 1.00 0.00 O ATOM 24270 H1 WAT 3648 44.523 62.018 104.241 1.00 0.00 H ATOM 24271 H2 WAT 3648 45.226 60.692 104.045 1.00 0.00 H TER 24273 WAT 3648 ATOM 24273 O WAT 3649 23.118 90.597 26.740 1.00 0.00 O ATOM 24274 H1 WAT 3649 23.450 90.756 27.624 1.00 0.00 H ATOM 24275 H2 WAT 3649 22.928 89.659 26.721 1.00 0.00 H TER 24277 WAT 3649 ATOM 24277 O WAT 3650 63.608 98.701 67.669 1.00 0.00 O ATOM 24278 H1 WAT 3650 62.972 98.995 68.321 1.00 0.00 H ATOM 24279 H2 WAT 3650 64.084 97.992 68.101 1.00 0.00 H TER 24281 WAT 3650 ATOM 24281 O WAT 3651 34.570 26.037 154.009 1.00 0.00 O ATOM 24282 H1 WAT 3651 34.185 25.516 153.304 1.00 0.00 H ATOM 24283 H2 WAT 3651 33.818 26.421 154.461 1.00 0.00 H TER 24285 WAT 3651 ATOM 24285 O WAT 3652 57.541 89.957 145.997 1.00 0.00 O ATOM 24286 H1 WAT 3652 58.070 90.711 146.258 1.00 0.00 H ATOM 24287 H2 WAT 3652 57.106 89.680 146.804 1.00 0.00 H TER 24289 WAT 3652 ATOM 24289 O WAT 3653 14.199 125.025 137.879 1.00 0.00 O ATOM 24290 H1 WAT 3653 14.705 125.797 137.624 1.00 0.00 H ATOM 24291 H2 WAT 3653 14.105 125.104 138.828 1.00 0.00 H TER 24293 WAT 3653 ATOM 24293 O WAT 3654 51.132 114.284 140.479 1.00 0.00 O ATOM 24294 H1 WAT 3654 51.828 114.893 140.231 1.00 0.00 H ATOM 24295 H2 WAT 3654 50.323 114.782 140.359 1.00 0.00 H TER 24297 WAT 3654 ATOM 24297 O WAT 3655 51.999 18.153 128.488 1.00 0.00 O ATOM 24298 H1 WAT 3655 52.250 18.129 127.565 1.00 0.00 H ATOM 24299 H2 WAT 3655 52.794 18.427 128.945 1.00 0.00 H TER 24301 WAT 3655 ATOM 24301 O WAT 3656 89.706 126.249 67.322 1.00 0.00 O ATOM 24302 H1 WAT 3656 90.623 126.515 67.260 1.00 0.00 H ATOM 24303 H2 WAT 3656 89.353 126.774 68.041 1.00 0.00 H TER 24305 WAT 3656 ATOM 24305 O WAT 3657 30.546 66.349 96.549 1.00 0.00 O ATOM 24306 H1 WAT 3657 30.761 65.914 95.724 1.00 0.00 H ATOM 24307 H2 WAT 3657 30.010 67.099 96.292 1.00 0.00 H TER 24309 WAT 3657 ATOM 24309 O WAT 3658 32.912 137.403 150.419 1.00 0.00 O ATOM 24310 H1 WAT 3658 32.549 136.683 150.936 1.00 0.00 H ATOM 24311 H2 WAT 3658 32.473 138.184 150.755 1.00 0.00 H TER 24313 WAT 3658 ATOM 24313 O WAT 3659 123.209 112.862 145.717 1.00 0.00 O ATOM 24314 H1 WAT 3659 123.544 112.106 146.199 1.00 0.00 H ATOM 24315 H2 WAT 3659 122.450 112.525 145.241 1.00 0.00 H TER 24317 WAT 3659 ATOM 24317 O WAT 3660 30.962 8.763 135.621 1.00 0.00 O ATOM 24318 H1 WAT 3660 31.005 8.007 136.207 1.00 0.00 H ATOM 24319 H2 WAT 3660 30.025 8.930 135.514 1.00 0.00 H TER 24321 WAT 3660 ATOM 24321 O WAT 3661 10.633 77.030 127.782 1.00 0.00 O ATOM 24322 H1 WAT 3661 9.960 77.148 128.453 1.00 0.00 H ATOM 24323 H2 WAT 3661 10.242 77.388 126.985 1.00 0.00 H TER 24325 WAT 3661 ATOM 24325 O WAT 3662 100.535 79.529 98.619 1.00 0.00 O ATOM 24326 H1 WAT 3662 100.481 78.765 99.192 1.00 0.00 H ATOM 24327 H2 WAT 3662 99.633 79.681 98.336 1.00 0.00 H TER 24329 WAT 3662 ATOM 24329 O WAT 3663 138.188 143.748 156.940 1.00 0.00 O ATOM 24330 H1 WAT 3663 138.821 143.264 156.409 1.00 0.00 H ATOM 24331 H2 WAT 3663 137.378 143.720 156.431 1.00 0.00 H TER 24333 WAT 3663 ATOM 24333 O WAT 3664 46.951 129.612 114.472 1.00 0.00 O ATOM 24334 H1 WAT 3664 46.351 130.247 114.863 1.00 0.00 H ATOM 24335 H2 WAT 3664 47.547 129.376 115.183 1.00 0.00 H TER 24337 WAT 3664 ATOM 24337 O WAT 3665 41.603 108.660 78.003 1.00 0.00 O ATOM 24338 H1 WAT 3665 41.692 108.494 77.065 1.00 0.00 H ATOM 24339 H2 WAT 3665 41.251 109.548 78.057 1.00 0.00 H TER 24341 WAT 3665 ATOM 24341 O WAT 3666 121.760 142.081 91.062 1.00 0.00 O ATOM 24342 H1 WAT 3666 122.493 142.131 90.448 1.00 0.00 H ATOM 24343 H2 WAT 3666 121.019 142.448 90.580 1.00 0.00 H TER 24345 WAT 3666 ATOM 24345 O WAT 3667 106.940 70.028 11.540 1.00 0.00 O ATOM 24346 H1 WAT 3667 107.340 70.093 12.407 1.00 0.00 H ATOM 24347 H2 WAT 3667 106.873 70.935 11.239 1.00 0.00 H TER 24349 WAT 3667 ATOM 24349 O WAT 3668 38.615 110.708 79.352 1.00 0.00 O ATOM 24350 H1 WAT 3668 38.194 110.663 78.494 1.00 0.00 H ATOM 24351 H2 WAT 3668 39.452 111.141 79.185 1.00 0.00 H TER 24353 WAT 3668 ATOM 24353 O WAT 3669 100.241 59.401 114.915 1.00 0.00 O ATOM 24354 H1 WAT 3669 100.486 58.678 114.337 1.00 0.00 H ATOM 24355 H2 WAT 3669 99.331 59.590 114.689 1.00 0.00 H TER 24357 WAT 3669 ATOM 24357 O WAT 3670 88.000 144.286 2.698 1.00 0.00 O ATOM 24358 H1 WAT 3670 88.104 145.039 3.280 1.00 0.00 H ATOM 24359 H2 WAT 3670 87.077 144.304 2.447 1.00 0.00 H TER 24361 WAT 3670 ATOM 24361 O WAT 3671 34.173 115.736 148.029 1.00 0.00 O ATOM 24362 H1 WAT 3671 34.034 116.309 148.783 1.00 0.00 H ATOM 24363 H2 WAT 3671 33.425 115.140 148.039 1.00 0.00 H TER 24365 WAT 3671 ATOM 24365 O WAT 3672 142.539 62.069 11.729 1.00 0.00 O ATOM 24366 H1 WAT 3672 141.713 62.186 12.198 1.00 0.00 H ATOM 24367 H2 WAT 3672 142.934 61.293 12.129 1.00 0.00 H TER 24369 WAT 3672 ATOM 24369 O WAT 3673 72.402 40.765 138.695 1.00 0.00 O ATOM 24370 H1 WAT 3673 72.771 40.026 138.212 1.00 0.00 H ATOM 24371 H2 WAT 3673 71.863 41.226 138.053 1.00 0.00 H TER 24373 WAT 3673 ATOM 24373 O WAT 3674 68.436 117.919 139.150 1.00 0.00 O ATOM 24374 H1 WAT 3674 68.985 118.550 138.683 1.00 0.00 H ATOM 24375 H2 WAT 3674 69.056 117.295 139.526 1.00 0.00 H TER 24377 WAT 3674 ATOM 24377 O WAT 3675 76.362 82.151 0.246 1.00 0.00 O ATOM 24378 H1 WAT 3675 76.765 82.466 1.055 1.00 0.00 H ATOM 24379 H2 WAT 3675 76.867 82.569 -0.452 1.00 0.00 H TER 24381 WAT 3675 ATOM 24381 O WAT 3676 145.326 125.792 142.607 1.00 0.00 O ATOM 24382 H1 WAT 3676 145.390 126.043 143.528 1.00 0.00 H ATOM 24383 H2 WAT 3676 144.607 126.322 142.264 1.00 0.00 H TER 24385 WAT 3676 ATOM 24385 O WAT 3677 21.820 62.456 19.679 1.00 0.00 O ATOM 24386 H1 WAT 3677 21.168 61.814 19.399 1.00 0.00 H ATOM 24387 H2 WAT 3677 22.215 62.070 20.461 1.00 0.00 H TER 24389 WAT 3677 ATOM 24389 O WAT 3678 101.740 40.789 101.270 1.00 0.00 O ATOM 24390 H1 WAT 3678 102.419 41.301 101.710 1.00 0.00 H ATOM 24391 H2 WAT 3678 101.465 41.336 100.535 1.00 0.00 H TER 24393 WAT 3678 ATOM 24393 O WAT 3679 3.727 80.654 111.158 1.00 0.00 O ATOM 24394 H1 WAT 3679 3.386 81.377 110.632 1.00 0.00 H ATOM 24395 H2 WAT 3679 3.151 79.917 110.956 1.00 0.00 H TER 24397 WAT 3679 ATOM 24397 O WAT 3680 132.691 48.913 12.855 1.00 0.00 O ATOM 24398 H1 WAT 3680 132.669 48.905 13.812 1.00 0.00 H ATOM 24399 H2 WAT 3680 131.774 48.837 12.594 1.00 0.00 H TER 24401 WAT 3680 ATOM 24401 O WAT 3681 17.144 53.378 63.371 1.00 0.00 O ATOM 24402 H1 WAT 3681 17.979 53.497 63.823 1.00 0.00 H ATOM 24403 H2 WAT 3681 16.624 54.141 63.624 1.00 0.00 H TER 24405 WAT 3681 ATOM 24405 O WAT 3682 101.105 26.859 157.588 1.00 0.00 O ATOM 24406 H1 WAT 3682 101.391 26.405 156.796 1.00 0.00 H ATOM 24407 H2 WAT 3682 101.643 26.485 158.286 1.00 0.00 H TER 24409 WAT 3682 ATOM 24409 O WAT 3683 8.156 123.547 99.897 1.00 0.00 O ATOM 24410 H1 WAT 3683 8.991 123.784 100.301 1.00 0.00 H ATOM 24411 H2 WAT 3683 7.494 123.908 100.487 1.00 0.00 H TER 24413 WAT 3683 ATOM 24413 O WAT 3684 75.016 1.797 112.414 1.00 0.00 O ATOM 24414 H1 WAT 3684 75.869 2.230 112.375 1.00 0.00 H ATOM 24415 H2 WAT 3684 75.168 1.016 112.945 1.00 0.00 H TER 24417 WAT 3684 ATOM 24417 O WAT 3685 141.510 15.708 88.870 1.00 0.00 O ATOM 24418 H1 WAT 3685 140.746 15.631 89.442 1.00 0.00 H ATOM 24419 H2 WAT 3685 142.069 14.971 89.117 1.00 0.00 H TER 24421 WAT 3685 ATOM 24421 O WAT 3686 36.083 42.201 77.938 1.00 0.00 O ATOM 24422 H1 WAT 3686 35.710 41.360 77.676 1.00 0.00 H ATOM 24423 H2 WAT 3686 36.117 42.711 77.129 1.00 0.00 H TER 24425 WAT 3686 ATOM 24425 O WAT 3687 109.066 140.391 94.547 1.00 0.00 O ATOM 24426 H1 WAT 3687 109.431 140.580 95.411 1.00 0.00 H ATOM 24427 H2 WAT 3687 109.779 139.961 94.075 1.00 0.00 H TER 24429 WAT 3687 ATOM 24429 O WAT 3688 14.174 102.930 67.262 1.00 0.00 O ATOM 24430 H1 WAT 3688 14.690 102.854 68.065 1.00 0.00 H ATOM 24431 H2 WAT 3688 13.679 103.742 67.371 1.00 0.00 H TER 24433 WAT 3688 ATOM 24433 O WAT 3689 48.777 135.328 77.520 1.00 0.00 O ATOM 24434 H1 WAT 3689 49.026 136.239 77.676 1.00 0.00 H ATOM 24435 H2 WAT 3689 48.531 135.302 76.596 1.00 0.00 H TER 24437 WAT 3689 ATOM 24437 O WAT 3690 93.213 57.036 145.580 1.00 0.00 O ATOM 24438 H1 WAT 3690 92.832 56.590 146.335 1.00 0.00 H ATOM 24439 H2 WAT 3690 94.141 56.805 145.608 1.00 0.00 H TER 24441 WAT 3690 ATOM 24441 O WAT 3691 19.898 22.477 103.604 1.00 0.00 O ATOM 24442 H1 WAT 3691 19.925 21.884 102.853 1.00 0.00 H ATOM 24443 H2 WAT 3691 19.426 23.247 103.285 1.00 0.00 H TER 24445 WAT 3691 ATOM 24445 O WAT 3692 10.466 59.676 127.216 1.00 0.00 O ATOM 24446 H1 WAT 3692 11.014 60.078 126.542 1.00 0.00 H ATOM 24447 H2 WAT 3692 10.886 58.836 127.397 1.00 0.00 H TER 24449 WAT 3692 ATOM 24449 O WAT 3693 137.715 34.269 15.951 1.00 0.00 O ATOM 24450 H1 WAT 3693 137.833 34.924 16.638 1.00 0.00 H ATOM 24451 H2 WAT 3693 137.850 33.431 16.393 1.00 0.00 H TER 24453 WAT 3693 ATOM 24453 O WAT 3694 79.727 89.077 156.969 1.00 0.00 O ATOM 24454 H1 WAT 3694 80.333 88.771 156.294 1.00 0.00 H ATOM 24455 H2 WAT 3694 79.357 88.276 157.339 1.00 0.00 H TER 24457 WAT 3694 ATOM 24457 O WAT 3695 8.691 110.718 6.498 1.00 0.00 O ATOM 24458 H1 WAT 3695 8.815 110.343 7.370 1.00 0.00 H ATOM 24459 H2 WAT 3695 8.206 111.529 6.653 1.00 0.00 H TER 24461 WAT 3695 ATOM 24461 O WAT 3696 52.248 78.400 148.159 1.00 0.00 O ATOM 24462 H1 WAT 3696 51.646 77.688 148.375 1.00 0.00 H ATOM 24463 H2 WAT 3696 52.141 79.029 148.872 1.00 0.00 H TER 24465 WAT 3696 ATOM 24465 O WAT 3697 93.329 132.911 148.929 1.00 0.00 O ATOM 24466 H1 WAT 3697 93.595 133.786 149.212 1.00 0.00 H ATOM 24467 H2 WAT 3697 93.957 132.679 148.246 1.00 0.00 H TER 24469 WAT 3697 ATOM 24469 O WAT 3698 1.930 47.582 143.006 1.00 0.00 O ATOM 24470 H1 WAT 3698 2.716 48.127 143.009 1.00 0.00 H ATOM 24471 H2 WAT 3698 1.804 47.337 143.923 1.00 0.00 H TER 24473 WAT 3698 ATOM 24473 O WAT 3699 60.479 42.818 151.348 1.00 0.00 O ATOM 24474 H1 WAT 3699 61.105 43.114 150.687 1.00 0.00 H ATOM 24475 H2 WAT 3699 60.871 42.024 151.711 1.00 0.00 H TER 24477 WAT 3699 ATOM 24477 O WAT 3700 47.050 92.980 98.588 1.00 0.00 O ATOM 24478 H1 WAT 3700 47.886 92.652 98.919 1.00 0.00 H ATOM 24479 H2 WAT 3700 47.289 93.709 98.015 1.00 0.00 H TER 24481 WAT 3700 ATOM 24481 O WAT 3701 87.894 127.009 157.351 1.00 0.00 O ATOM 24482 H1 WAT 3701 87.546 127.701 157.913 1.00 0.00 H ATOM 24483 H2 WAT 3701 87.924 126.235 157.913 1.00 0.00 H TER 24485 WAT 3701 ATOM 24485 O WAT 3702 119.707 16.251 66.777 1.00 0.00 O ATOM 24486 H1 WAT 3702 119.028 15.666 66.440 1.00 0.00 H ATOM 24487 H2 WAT 3702 120.530 15.836 66.520 1.00 0.00 H TER 24489 WAT 3702 ATOM 24489 O WAT 3703 68.618 5.491 65.901 1.00 0.00 O ATOM 24490 H1 WAT 3703 67.954 5.617 66.579 1.00 0.00 H ATOM 24491 H2 WAT 3703 68.798 6.373 65.575 1.00 0.00 H TER 24493 WAT 3703 ATOM 24493 O WAT 3704 26.209 126.203 74.491 1.00 0.00 O ATOM 24494 H1 WAT 3704 26.462 127.115 74.631 1.00 0.00 H ATOM 24495 H2 WAT 3704 25.923 126.171 73.578 1.00 0.00 H TER 24497 WAT 3704 ATOM 24497 O WAT 3705 42.346 130.746 92.258 1.00 0.00 O ATOM 24498 H1 WAT 3705 42.898 130.269 91.638 1.00 0.00 H ATOM 24499 H2 WAT 3705 41.459 130.652 91.911 1.00 0.00 H TER 24501 WAT 3705 ATOM 24501 O WAT 3706 65.850 56.309 155.018 1.00 0.00 O ATOM 24502 H1 WAT 3706 65.531 55.431 154.809 1.00 0.00 H ATOM 24503 H2 WAT 3706 66.790 56.271 154.842 1.00 0.00 H TER 24505 WAT 3706 ATOM 24505 O WAT 3707 128.181 120.031 19.382 1.00 0.00 O ATOM 24506 H1 WAT 3707 128.046 120.792 19.947 1.00 0.00 H ATOM 24507 H2 WAT 3707 127.399 119.494 19.512 1.00 0.00 H TER 24509 WAT 3707 ATOM 24509 O WAT 3708 126.605 55.388 62.965 1.00 0.00 O ATOM 24510 H1 WAT 3708 125.891 55.088 62.402 1.00 0.00 H ATOM 24511 H2 WAT 3708 126.920 56.189 62.546 1.00 0.00 H TER 24513 WAT 3708 ATOM 24513 O WAT 3709 107.615 129.285 8.395 1.00 0.00 O ATOM 24514 H1 WAT 3709 108.053 129.921 7.829 1.00 0.00 H ATOM 24515 H2 WAT 3709 108.329 128.842 8.854 1.00 0.00 H TER 24517 WAT 3709 ATOM 24517 O WAT 3710 26.310 68.339 64.774 1.00 0.00 O ATOM 24518 H1 WAT 3710 26.688 67.514 65.077 1.00 0.00 H ATOM 24519 H2 WAT 3710 25.763 68.634 65.502 1.00 0.00 H TER 24521 WAT 3710 ATOM 24521 O WAT 3711 137.905 5.044 139.140 1.00 0.00 O ATOM 24522 H1 WAT 3711 137.501 5.419 139.923 1.00 0.00 H ATOM 24523 H2 WAT 3711 138.802 5.376 139.151 1.00 0.00 H TER 24525 WAT 3711 ATOM 24525 O WAT 3712 65.113 14.181 115.860 1.00 0.00 O ATOM 24526 H1 WAT 3712 64.335 13.740 115.519 1.00 0.00 H ATOM 24527 H2 WAT 3712 65.189 13.869 116.762 1.00 0.00 H TER 24529 WAT 3712 ATOM 24529 O WAT 3713 52.981 132.606 94.588 1.00 0.00 O ATOM 24530 H1 WAT 3713 53.027 132.966 95.473 1.00 0.00 H ATOM 24531 H2 WAT 3713 53.408 131.752 94.654 1.00 0.00 H TER 24533 WAT 3713 ATOM 24533 O WAT 3714 93.768 138.285 80.002 1.00 0.00 O ATOM 24534 H1 WAT 3714 94.541 138.601 79.534 1.00 0.00 H ATOM 24535 H2 WAT 3714 93.101 138.953 79.841 1.00 0.00 H TER 24537 WAT 3714 ATOM 24537 O WAT 3715 90.779 7.161 16.384 1.00 0.00 O ATOM 24538 H1 WAT 3715 90.066 7.282 17.011 1.00 0.00 H ATOM 24539 H2 WAT 3715 90.518 7.678 15.622 1.00 0.00 H TER 24541 WAT 3715 ATOM 24541 O WAT 3716 40.457 99.466 104.044 1.00 0.00 O ATOM 24542 H1 WAT 3716 40.747 100.326 104.348 1.00 0.00 H ATOM 24543 H2 WAT 3716 39.694 99.266 104.586 1.00 0.00 H TER 24545 WAT 3716 ATOM 24545 O WAT 3717 80.289 54.274 92.664 1.00 0.00 O ATOM 24546 H1 WAT 3717 80.661 53.397 92.755 1.00 0.00 H ATOM 24547 H2 WAT 3717 81.050 54.849 92.584 1.00 0.00 H TER 24549 WAT 3717 ATOM 24549 O WAT 3718 22.267 68.214 128.829 1.00 0.00 O ATOM 24550 H1 WAT 3718 22.844 68.970 128.721 1.00 0.00 H ATOM 24551 H2 WAT 3718 22.456 67.892 129.710 1.00 0.00 H TER 24553 WAT 3718 ATOM 24553 O WAT 3719 126.366 78.249 73.305 1.00 0.00 O ATOM 24554 H1 WAT 3719 125.470 78.191 73.636 1.00 0.00 H ATOM 24555 H2 WAT 3719 126.568 77.363 73.004 1.00 0.00 H TER 24557 WAT 3719 ATOM 24557 O WAT 3720 110.708 57.808 113.616 1.00 0.00 O ATOM 24558 H1 WAT 3720 110.975 58.472 112.981 1.00 0.00 H ATOM 24559 H2 WAT 3720 111.495 57.284 113.760 1.00 0.00 H TER 24561 WAT 3720 ATOM 24561 O WAT 3721 29.620 98.992 118.281 1.00 0.00 O ATOM 24562 H1 WAT 3721 30.432 99.397 117.976 1.00 0.00 H ATOM 24563 H2 WAT 3721 29.020 99.727 118.409 1.00 0.00 H TER 24565 WAT 3721 ATOM 24565 O WAT 3722 1.269 46.775 78.711 1.00 0.00 O ATOM 24566 H1 WAT 3722 1.843 47.518 78.900 1.00 0.00 H ATOM 24567 H2 WAT 3722 1.865 46.076 78.440 1.00 0.00 H TER 24569 WAT 3722 ATOM 24569 O WAT 3723 89.872 74.239 151.199 1.00 0.00 O ATOM 24570 H1 WAT 3723 89.162 74.790 150.870 1.00 0.00 H ATOM 24571 H2 WAT 3723 89.721 73.386 150.792 1.00 0.00 H TER 24573 WAT 3723 ATOM 24573 O WAT 3724 140.156 112.158 153.750 1.00 0.00 O ATOM 24574 H1 WAT 3724 139.434 112.091 154.375 1.00 0.00 H ATOM 24575 H2 WAT 3724 140.933 112.287 154.295 1.00 0.00 H TER 24577 WAT 3724 ATOM 24577 O WAT 3725 114.110 83.549 138.602 1.00 0.00 O ATOM 24578 H1 WAT 3725 114.673 83.751 139.350 1.00 0.00 H ATOM 24579 H2 WAT 3725 114.698 83.574 137.847 1.00 0.00 H TER 24581 WAT 3725 ATOM 24581 O WAT 3726 39.358 35.631 155.863 1.00 0.00 O ATOM 24582 H1 WAT 3726 39.958 35.931 155.179 1.00 0.00 H ATOM 24583 H2 WAT 3726 39.025 36.437 156.258 1.00 0.00 H TER 24585 WAT 3726 ATOM 24585 O WAT 3727 105.322 68.705 104.322 1.00 0.00 O ATOM 24586 H1 WAT 3727 104.880 68.003 104.799 1.00 0.00 H ATOM 24587 H2 WAT 3727 105.737 69.234 105.003 1.00 0.00 H TER 24589 WAT 3727 ATOM 24589 O WAT 3728 93.685 54.067 76.577 1.00 0.00 O ATOM 24590 H1 WAT 3728 92.983 53.444 76.385 1.00 0.00 H ATOM 24591 H2 WAT 3728 93.372 54.553 77.340 1.00 0.00 H TER 24593 WAT 3728 ATOM 24593 O WAT 3729 115.236 1.018 71.155 1.00 0.00 O ATOM 24594 H1 WAT 3729 115.903 0.420 71.492 1.00 0.00 H ATOM 24595 H2 WAT 3729 114.458 0.830 71.680 1.00 0.00 H TER 24597 WAT 3729 ATOM 24597 O WAT 3730 124.108 78.962 102.583 1.00 0.00 O ATOM 24598 H1 WAT 3730 124.670 79.148 101.831 1.00 0.00 H ATOM 24599 H2 WAT 3730 124.099 78.007 102.645 1.00 0.00 H TER 24601 WAT 3730 ATOM 24601 O WAT 3731 19.123 143.153 149.027 1.00 0.00 O ATOM 24602 H1 WAT 3731 18.370 142.569 148.935 1.00 0.00 H ATOM 24603 H2 WAT 3731 19.620 142.790 149.760 1.00 0.00 H TER 24605 WAT 3731 ATOM 24605 O WAT 3732 73.979 131.814 130.839 1.00 0.00 O ATOM 24606 H1 WAT 3732 74.460 132.376 131.446 1.00 0.00 H ATOM 24607 H2 WAT 3732 73.469 132.421 130.302 1.00 0.00 H TER 24609 WAT 3732 ATOM 24609 O WAT 3733 101.690 32.833 60.550 1.00 0.00 O ATOM 24610 H1 WAT 3733 101.282 31.973 60.652 1.00 0.00 H ATOM 24611 H2 WAT 3733 102.324 32.714 59.843 1.00 0.00 H TER 24613 WAT 3733 ATOM 24613 O WAT 3734 98.861 114.407 0.542 1.00 0.00 O ATOM 24614 H1 WAT 3734 99.607 113.893 0.233 1.00 0.00 H ATOM 24615 H2 WAT 3734 98.112 114.058 0.059 1.00 0.00 H TER 24617 WAT 3734 ATOM 24617 O WAT 3735 5.208 46.205 7.209 1.00 0.00 O ATOM 24618 H1 WAT 3735 5.157 47.141 7.405 1.00 0.00 H ATOM 24619 H2 WAT 3735 4.393 45.843 7.556 1.00 0.00 H TER 24621 WAT 3735 ATOM 24621 O WAT 3736 77.814 10.924 19.488 1.00 0.00 O ATOM 24622 H1 WAT 3736 77.455 11.258 18.666 1.00 0.00 H ATOM 24623 H2 WAT 3736 77.864 11.692 20.057 1.00 0.00 H TER 24625 WAT 3736 ATOM 24625 O WAT 3737 86.604 104.179 84.896 1.00 0.00 O ATOM 24626 H1 WAT 3737 87.319 104.223 85.531 1.00 0.00 H ATOM 24627 H2 WAT 3737 85.823 104.413 85.398 1.00 0.00 H TER 24629 WAT 3737 ATOM 24629 O WAT 3738 46.128 3.747 22.958 1.00 0.00 O ATOM 24630 H1 WAT 3738 46.111 4.451 23.607 1.00 0.00 H ATOM 24631 H2 WAT 3738 45.558 4.056 22.254 1.00 0.00 H TER 24633 WAT 3738 ATOM 24633 O WAT 3739 135.057 113.092 97.225 1.00 0.00 O ATOM 24634 H1 WAT 3739 135.652 113.401 96.542 1.00 0.00 H ATOM 24635 H2 WAT 3739 134.317 113.697 97.190 1.00 0.00 H TER 24637 WAT 3739 ATOM 24637 O WAT 3740 57.961 127.599 51.192 1.00 0.00 O ATOM 24638 H1 WAT 3740 57.190 127.681 51.753 1.00 0.00 H ATOM 24639 H2 WAT 3740 58.553 127.027 51.681 1.00 0.00 H TER 24641 WAT 3740 ATOM 24641 O WAT 3741 30.576 103.425 61.322 1.00 0.00 O ATOM 24642 H1 WAT 3741 29.913 102.821 61.657 1.00 0.00 H ATOM 24643 H2 WAT 3741 30.780 103.992 62.066 1.00 0.00 H TER 24645 WAT 3741 ATOM 24645 O WAT 3742 62.425 92.797 11.570 1.00 0.00 O ATOM 24646 H1 WAT 3742 62.347 92.303 10.753 1.00 0.00 H ATOM 24647 H2 WAT 3742 62.954 92.237 12.139 1.00 0.00 H TER 24649 WAT 3742 ATOM 24649 O WAT 3743 26.083 114.130 18.537 1.00 0.00 O ATOM 24650 H1 WAT 3743 26.534 113.529 19.130 1.00 0.00 H ATOM 24651 H2 WAT 3743 25.191 113.787 18.481 1.00 0.00 H TER 24653 WAT 3743 ATOM 24653 O WAT 3744 132.176 79.421 107.821 1.00 0.00 O ATOM 24654 H1 WAT 3744 131.266 79.484 108.112 1.00 0.00 H ATOM 24655 H2 WAT 3744 132.251 80.078 107.128 1.00 0.00 H TER 24657 WAT 3744 ATOM 24657 O WAT 3745 96.728 104.986 119.991 1.00 0.00 O ATOM 24658 H1 WAT 3745 96.581 105.638 120.677 1.00 0.00 H ATOM 24659 H2 WAT 3745 96.443 105.417 119.186 1.00 0.00 H TER 24661 WAT 3745 ATOM 24661 O WAT 3746 132.934 106.188 59.457 1.00 0.00 O ATOM 24662 H1 WAT 3746 132.209 106.712 59.114 1.00 0.00 H ATOM 24663 H2 WAT 3746 133.503 106.044 58.701 1.00 0.00 H TER 24665 WAT 3746 ATOM 24665 O WAT 3747 85.932 69.329 118.438 1.00 0.00 O ATOM 24666 H1 WAT 3747 86.840 69.210 118.159 1.00 0.00 H ATOM 24667 H2 WAT 3747 85.983 69.967 119.150 1.00 0.00 H TER 24669 WAT 3747 ATOM 24669 O WAT 3748 128.323 139.547 4.510 1.00 0.00 O ATOM 24670 H1 WAT 3748 127.598 140.081 4.833 1.00 0.00 H ATOM 24671 H2 WAT 3748 128.531 139.919 3.653 1.00 0.00 H TER 24673 WAT 3748 ATOM 24673 O WAT 3749 60.552 65.645 150.009 1.00 0.00 O ATOM 24674 H1 WAT 3749 59.890 65.222 149.463 1.00 0.00 H ATOM 24675 H2 WAT 3749 60.690 66.500 149.601 1.00 0.00 H TER 24677 WAT 3749 ATOM 24677 O WAT 3750 10.621 129.783 17.142 1.00 0.00 O ATOM 24678 H1 WAT 3750 10.372 130.121 16.282 1.00 0.00 H ATOM 24679 H2 WAT 3750 10.653 130.557 17.703 1.00 0.00 H TER 24681 WAT 3750 ATOM 24681 O WAT 3751 85.594 94.065 132.472 1.00 0.00 O ATOM 24682 H1 WAT 3751 84.940 94.649 132.089 1.00 0.00 H ATOM 24683 H2 WAT 3751 85.133 93.234 132.591 1.00 0.00 H TER 24685 WAT 3751 ATOM 24685 O WAT 3752 66.762 139.959 99.486 1.00 0.00 O ATOM 24686 H1 WAT 3752 67.362 140.703 99.536 1.00 0.00 H ATOM 24687 H2 WAT 3752 66.263 139.998 100.302 1.00 0.00 H TER 24689 WAT 3752 ATOM 24689 O WAT 3753 86.783 70.882 9.201 1.00 0.00 O ATOM 24690 H1 WAT 3753 86.200 71.417 9.740 1.00 0.00 H ATOM 24691 H2 WAT 3753 86.860 70.056 9.679 1.00 0.00 H TER 24693 WAT 3753 ATOM 24693 O WAT 3754 47.191 131.975 149.778 1.00 0.00 O ATOM 24694 H1 WAT 3754 46.314 132.150 150.119 1.00 0.00 H ATOM 24695 H2 WAT 3754 47.536 131.287 150.347 1.00 0.00 H TER 24697 WAT 3754 ATOM 24697 O WAT 3755 35.501 106.758 18.602 1.00 0.00 O ATOM 24698 H1 WAT 3755 35.301 105.824 18.662 1.00 0.00 H ATOM 24699 H2 WAT 3755 35.249 107.112 19.455 1.00 0.00 H TER 24701 WAT 3755 ATOM 24701 O WAT 3756 26.863 111.299 84.174 1.00 0.00 O ATOM 24702 H1 WAT 3756 27.212 112.179 84.321 1.00 0.00 H ATOM 24703 H2 WAT 3756 26.101 111.245 84.751 1.00 0.00 H TER 24705 WAT 3756 ATOM 24705 O WAT 3757 29.347 135.058 112.759 1.00 0.00 O ATOM 24706 H1 WAT 3757 28.423 135.145 112.993 1.00 0.00 H ATOM 24707 H2 WAT 3757 29.369 134.334 112.134 1.00 0.00 H TER 24709 WAT 3757 ATOM 24709 O WAT 3758 4.173 6.706 126.612 1.00 0.00 O ATOM 24710 H1 WAT 3758 3.759 6.159 125.945 1.00 0.00 H ATOM 24711 H2 WAT 3758 3.791 6.407 127.437 1.00 0.00 H TER 24713 WAT 3758 ATOM 24713 O WAT 3759 73.443 3.179 87.397 1.00 0.00 O ATOM 24714 H1 WAT 3759 73.051 2.457 87.888 1.00 0.00 H ATOM 24715 H2 WAT 3759 74.345 2.900 87.239 1.00 0.00 H TER 24717 WAT 3759 ATOM 24717 O WAT 3760 54.908 108.911 117.773 1.00 0.00 O ATOM 24718 H1 WAT 3760 54.149 109.492 117.832 1.00 0.00 H ATOM 24719 H2 WAT 3760 54.538 108.029 117.807 1.00 0.00 H TER 24721 WAT 3760 ATOM 24721 O WAT 3761 118.720 42.923 143.098 1.00 0.00 O ATOM 24722 H1 WAT 3761 118.105 43.490 143.563 1.00 0.00 H ATOM 24723 H2 WAT 3761 119.577 43.318 143.255 1.00 0.00 H TER 24725 WAT 3761 ATOM 24725 O WAT 3762 59.254 119.713 51.821 1.00 0.00 O ATOM 24726 H1 WAT 3762 59.287 120.555 51.366 1.00 0.00 H ATOM 24727 H2 WAT 3762 58.392 119.358 51.605 1.00 0.00 H TER 24729 WAT 3762 ATOM 24729 O WAT 3763 35.656 134.090 127.835 1.00 0.00 O ATOM 24730 H1 WAT 3763 34.744 134.322 127.657 1.00 0.00 H ATOM 24731 H2 WAT 3763 35.899 133.506 127.117 1.00 0.00 H TER 24733 WAT 3763 ATOM 24733 O WAT 3764 46.011 131.477 67.824 1.00 0.00 O ATOM 24734 H1 WAT 3764 45.752 132.373 68.038 1.00 0.00 H ATOM 24735 H2 WAT 3764 46.912 131.556 67.512 1.00 0.00 H TER 24737 WAT 3764 ATOM 24737 O WAT 3765 67.211 48.799 82.566 1.00 0.00 O ATOM 24738 H1 WAT 3765 66.596 48.205 82.998 1.00 0.00 H ATOM 24739 H2 WAT 3765 66.957 49.670 82.871 1.00 0.00 H TER 24741 WAT 3765 ATOM 24741 O WAT 3766 47.984 86.800 69.005 1.00 0.00 O ATOM 24742 H1 WAT 3766 47.317 86.904 68.326 1.00 0.00 H ATOM 24743 H2 WAT 3766 48.687 86.311 68.577 1.00 0.00 H TER 24745 WAT 3766 ATOM 24745 O WAT 3767 139.667 76.751 69.367 1.00 0.00 O ATOM 24746 H1 WAT 3767 139.577 75.803 69.464 1.00 0.00 H ATOM 24747 H2 WAT 3767 138.835 77.104 69.682 1.00 0.00 H TER 24749 WAT 3767 ATOM 24749 O WAT 3768 29.477 140.996 153.230 1.00 0.00 O ATOM 24750 H1 WAT 3768 29.809 141.535 153.948 1.00 0.00 H ATOM 24751 H2 WAT 3768 28.729 140.531 153.606 1.00 0.00 H TER 24753 WAT 3768 ATOM 24753 O WAT 3769 12.851 39.544 128.734 1.00 0.00 O ATOM 24754 H1 WAT 3769 13.591 39.672 128.141 1.00 0.00 H ATOM 24755 H2 WAT 3769 13.202 39.748 129.601 1.00 0.00 H TER 24757 WAT 3769 ATOM 24757 O WAT 3770 33.062 30.289 58.881 1.00 0.00 O ATOM 24758 H1 WAT 3770 33.575 31.074 59.071 1.00 0.00 H ATOM 24759 H2 WAT 3770 33.004 29.831 59.720 1.00 0.00 H TER 24761 WAT 3770 ATOM 24761 O WAT 3771 107.737 111.743 83.980 1.00 0.00 O ATOM 24762 H1 WAT 3771 107.838 112.692 84.064 1.00 0.00 H ATOM 24763 H2 WAT 3771 106.946 111.542 84.481 1.00 0.00 H TER 24765 WAT 3771 ATOM 24765 O WAT 3772 121.542 99.370 153.092 1.00 0.00 O ATOM 24766 H1 WAT 3772 120.925 99.096 152.413 1.00 0.00 H ATOM 24767 H2 WAT 3772 121.184 100.194 153.423 1.00 0.00 H TER 24769 WAT 3772 ATOM 24769 O WAT 3773 113.988 118.714 156.586 1.00 0.00 O ATOM 24770 H1 WAT 3773 113.157 118.714 157.060 1.00 0.00 H ATOM 24771 H2 WAT 3773 113.801 118.239 155.776 1.00 0.00 H TER 24773 WAT 3773 ATOM 24773 O WAT 3774 145.741 28.554 2.354 1.00 0.00 O ATOM 24774 H1 WAT 3774 145.541 27.659 2.629 1.00 0.00 H ATOM 24775 H2 WAT 3774 145.390 29.104 3.055 1.00 0.00 H TER 24777 WAT 3774 ATOM 24777 O WAT 3775 43.875 67.357 153.722 1.00 0.00 O ATOM 24778 H1 WAT 3775 43.752 68.306 153.714 1.00 0.00 H ATOM 24779 H2 WAT 3775 43.267 67.031 153.059 1.00 0.00 H TER 24781 WAT 3775 ATOM 24781 O WAT 3776 20.891 50.891 137.955 1.00 0.00 O ATOM 24782 H1 WAT 3776 20.455 50.827 138.805 1.00 0.00 H ATOM 24783 H2 WAT 3776 21.824 50.919 138.166 1.00 0.00 H TER 24785 WAT 3776 ATOM 24785 O WAT 3777 0.556 76.901 138.925 1.00 0.00 O ATOM 24786 H1 WAT 3777 -0.230 76.864 138.380 1.00 0.00 H ATOM 24787 H2 WAT 3777 1.220 76.433 138.420 1.00 0.00 H TER 24789 WAT 3777 ATOM 24789 O WAT 3778 102.054 98.210 97.670 1.00 0.00 O ATOM 24790 H1 WAT 3778 102.501 97.402 97.418 1.00 0.00 H ATOM 24791 H2 WAT 3778 102.734 98.882 97.631 1.00 0.00 H TER 24793 WAT 3778 ATOM 24793 O WAT 3779 34.366 102.497 6.890 1.00 0.00 O ATOM 24794 H1 WAT 3779 34.262 103.375 7.256 1.00 0.00 H ATOM 24795 H2 WAT 3779 34.287 101.912 7.643 1.00 0.00 H TER 24797 WAT 3779 ATOM 24797 O WAT 3780 105.699 11.230 15.214 1.00 0.00 O ATOM 24798 H1 WAT 3780 105.898 10.475 15.769 1.00 0.00 H ATOM 24799 H2 WAT 3780 106.164 11.958 15.625 1.00 0.00 H TER 24801 WAT 3780 ATOM 24801 O WAT 3781 66.496 139.418 106.914 1.00 0.00 O ATOM 24802 H1 WAT 3781 65.651 139.045 107.166 1.00 0.00 H ATOM 24803 H2 WAT 3781 67.117 139.047 107.540 1.00 0.00 H TER 24805 WAT 3781 ATOM 24805 O WAT 3782 114.737 130.506 102.591 1.00 0.00 O ATOM 24806 H1 WAT 3782 114.879 130.534 101.645 1.00 0.00 H ATOM 24807 H2 WAT 3782 115.618 130.469 102.964 1.00 0.00 H TER 24809 WAT 3782 ATOM 24809 O WAT 3783 11.523 60.216 60.263 1.00 0.00 O ATOM 24810 H1 WAT 3783 11.838 60.576 61.092 1.00 0.00 H ATOM 24811 H2 WAT 3783 11.651 59.271 60.349 1.00 0.00 H TER 24813 WAT 3783 ATOM 24813 O WAT 3784 89.178 91.077 119.597 1.00 0.00 O ATOM 24814 H1 WAT 3784 88.589 90.625 120.201 1.00 0.00 H ATOM 24815 H2 WAT 3784 88.616 91.345 118.871 1.00 0.00 H TER 24817 WAT 3784 ATOM 24817 O WAT 3785 145.588 35.193 94.428 1.00 0.00 O ATOM 24818 H1 WAT 3785 145.305 34.279 94.415 1.00 0.00 H ATOM 24819 H2 WAT 3785 146.496 35.158 94.727 1.00 0.00 H TER 24821 WAT 3785 ATOM 24821 O WAT 3786 126.266 13.413 140.283 1.00 0.00 O ATOM 24822 H1 WAT 3786 125.359 13.197 140.499 1.00 0.00 H ATOM 24823 H2 WAT 3786 126.206 14.229 139.785 1.00 0.00 H TER 24825 WAT 3786 ATOM 24825 O WAT 3787 17.654 128.818 86.912 1.00 0.00 O ATOM 24826 H1 WAT 3787 16.738 128.904 87.176 1.00 0.00 H ATOM 24827 H2 WAT 3787 18.104 129.525 87.374 1.00 0.00 H TER 24829 WAT 3787 ATOM 24829 O WAT 3788 47.320 58.058 12.930 1.00 0.00 O ATOM 24830 H1 WAT 3788 46.785 57.685 13.631 1.00 0.00 H ATOM 24831 H2 WAT 3788 47.673 58.866 13.303 1.00 0.00 H TER 24833 WAT 3788 ATOM 24833 O WAT 3789 54.872 56.896 136.742 1.00 0.00 O ATOM 24834 H1 WAT 3789 55.474 57.638 136.680 1.00 0.00 H ATOM 24835 H2 WAT 3789 54.003 57.294 136.774 1.00 0.00 H TER 24837 WAT 3789 ATOM 24837 O WAT 3790 118.501 47.353 127.614 1.00 0.00 O ATOM 24838 H1 WAT 3790 117.741 47.864 127.338 1.00 0.00 H ATOM 24839 H2 WAT 3790 119.240 47.757 127.158 1.00 0.00 H TER 24841 WAT 3790 ATOM 24841 O WAT 3791 27.356 36.200 121.177 1.00 0.00 O ATOM 24842 H1 WAT 3791 27.173 36.298 120.243 1.00 0.00 H ATOM 24843 H2 WAT 3791 26.500 36.040 121.574 1.00 0.00 H TER 24845 WAT 3791 ATOM 24845 O WAT 3792 76.341 58.923 25.370 1.00 0.00 O ATOM 24846 H1 WAT 3792 77.083 58.443 25.005 1.00 0.00 H ATOM 24847 H2 WAT 3792 76.726 59.723 25.728 1.00 0.00 H TER 24849 WAT 3792 ATOM 24849 O WAT 3793 45.155 24.072 116.883 1.00 0.00 O ATOM 24850 H1 WAT 3793 45.184 24.984 116.594 1.00 0.00 H ATOM 24851 H2 WAT 3793 46.039 23.894 117.202 1.00 0.00 H TER 24853 WAT 3793 ATOM 24853 O WAT 3794 132.511 123.866 143.156 1.00 0.00 O ATOM 24854 H1 WAT 3794 132.719 123.843 144.090 1.00 0.00 H ATOM 24855 H2 WAT 3794 131.661 124.304 143.111 1.00 0.00 H TER 24857 WAT 3794 ATOM 24857 O WAT 3795 108.972 13.296 14.243 1.00 0.00 O ATOM 24858 H1 WAT 3795 109.419 14.075 14.574 1.00 0.00 H ATOM 24859 H2 WAT 3795 109.632 12.604 14.288 1.00 0.00 H TER 24861 WAT 3795 ATOM 24861 O WAT 3796 63.671 52.405 90.019 1.00 0.00 O ATOM 24862 H1 WAT 3796 64.399 53.018 90.117 1.00 0.00 H ATOM 24863 H2 WAT 3796 63.895 51.673 90.593 1.00 0.00 H TER 24865 WAT 3796 ATOM 24865 O WAT 3797 110.842 25.612 122.741 1.00 0.00 O ATOM 24866 H1 WAT 3797 111.502 25.892 123.376 1.00 0.00 H ATOM 24867 H2 WAT 3797 111.148 24.756 122.441 1.00 0.00 H TER 24869 WAT 3797 ATOM 24869 O WAT 3798 0.218 19.155 2.822 1.00 0.00 O ATOM 24870 H1 WAT 3798 0.206 18.536 2.092 1.00 0.00 H ATOM 24871 H2 WAT 3798 1.056 19.610 2.737 1.00 0.00 H TER 24873 WAT 3798 ATOM 24873 O WAT 3799 10.630 73.738 93.131 1.00 0.00 O ATOM 24874 H1 WAT 3799 11.180 73.488 93.873 1.00 0.00 H ATOM 24875 H2 WAT 3799 10.671 72.987 92.539 1.00 0.00 H TER 24877 WAT 3799 ATOM 24877 O WAT 3800 64.067 103.456 119.605 1.00 0.00 O ATOM 24878 H1 WAT 3800 64.447 104.043 120.259 1.00 0.00 H ATOM 24879 H2 WAT 3800 63.229 103.188 119.983 1.00 0.00 H TER 24881 WAT 3800 ATOM 24881 O WAT 3801 3.815 37.954 110.960 1.00 0.00 O ATOM 24882 H1 WAT 3801 3.693 38.638 111.618 1.00 0.00 H ATOM 24883 H2 WAT 3801 3.209 38.186 110.257 1.00 0.00 H TER 24885 WAT 3801 ATOM 24885 O WAT 3802 59.808 98.233 140.207 1.00 0.00 O ATOM 24886 H1 WAT 3802 59.964 98.709 141.023 1.00 0.00 H ATOM 24887 H2 WAT 3802 60.575 97.670 140.107 1.00 0.00 H TER 24889 WAT 3802 ATOM 24889 O WAT 3803 87.749 79.956 107.827 1.00 0.00 O ATOM 24890 H1 WAT 3803 88.170 80.742 107.478 1.00 0.00 H ATOM 24891 H2 WAT 3803 87.110 79.710 107.158 1.00 0.00 H TER 24893 WAT 3803 ATOM 24893 O WAT 3804 102.976 96.865 126.830 1.00 0.00 O ATOM 24894 H1 WAT 3804 103.480 97.652 127.037 1.00 0.00 H ATOM 24895 H2 WAT 3804 103.477 96.436 126.137 1.00 0.00 H TER 24897 WAT 3804 ATOM 24897 O WAT 3805 97.567 102.062 83.830 1.00 0.00 O ATOM 24898 H1 WAT 3805 97.565 101.140 83.572 1.00 0.00 H ATOM 24899 H2 WAT 3805 98.307 102.442 83.357 1.00 0.00 H TER 24901 WAT 3805 ATOM 24901 O WAT 3806 125.451 20.909 66.602 1.00 0.00 O ATOM 24902 H1 WAT 3806 124.709 21.121 66.035 1.00 0.00 H ATOM 24903 H2 WAT 3806 125.636 21.723 67.069 1.00 0.00 H TER 24905 WAT 3806 ATOM 24905 O WAT 3807 37.630 35.254 69.971 1.00 0.00 O ATOM 24906 H1 WAT 3807 37.375 35.169 69.052 1.00 0.00 H ATOM 24907 H2 WAT 3807 37.172 36.038 70.275 1.00 0.00 H TER 24909 WAT 3807 ATOM 24909 O WAT 3808 122.960 131.651 66.739 1.00 0.00 O ATOM 24910 H1 WAT 3808 122.189 131.552 67.297 1.00 0.00 H ATOM 24911 H2 WAT 3808 123.644 131.151 67.185 1.00 0.00 H TER 24913 WAT 3808 ATOM 24913 O WAT 3809 7.750 134.407 117.486 1.00 0.00 O ATOM 24914 H1 WAT 3809 8.657 134.540 117.208 1.00 0.00 H ATOM 24915 H2 WAT 3809 7.513 135.221 117.929 1.00 0.00 H TER 24917 WAT 3809 ATOM 24917 O WAT 3810 44.282 6.361 75.651 1.00 0.00 O ATOM 24918 H1 WAT 3810 44.986 6.394 75.003 1.00 0.00 H ATOM 24919 H2 WAT 3810 43.478 6.369 75.132 1.00 0.00 H TER 24921 WAT 3810 ATOM 24921 O WAT 3811 65.638 18.122 62.861 1.00 0.00 O ATOM 24922 H1 WAT 3811 66.281 18.830 62.818 1.00 0.00 H ATOM 24923 H2 WAT 3811 64.796 18.568 62.946 1.00 0.00 H TER 24925 WAT 3811 ATOM 24925 O WAT 3812 102.260 130.947 150.665 1.00 0.00 O ATOM 24926 H1 WAT 3812 102.827 131.059 149.903 1.00 0.00 H ATOM 24927 H2 WAT 3812 101.560 130.370 150.361 1.00 0.00 H TER 24929 WAT 3812 ATOM 24929 O WAT 3813 30.897 50.431 92.117 1.00 0.00 O ATOM 24930 H1 WAT 3813 31.142 50.659 91.220 1.00 0.00 H ATOM 24931 H2 WAT 3813 29.944 50.522 92.135 1.00 0.00 H TER 24933 WAT 3813 ATOM 24933 O WAT 3814 65.520 13.232 27.532 1.00 0.00 O ATOM 24934 H1 WAT 3814 64.592 13.013 27.625 1.00 0.00 H ATOM 24935 H2 WAT 3814 65.912 12.453 27.139 1.00 0.00 H TER 24937 WAT 3814 ATOM 24937 O WAT 3815 71.484 35.576 125.359 1.00 0.00 O ATOM 24938 H1 WAT 3815 71.279 35.344 124.453 1.00 0.00 H ATOM 24939 H2 WAT 3815 72.263 35.062 125.568 1.00 0.00 H TER 24941 WAT 3815 ATOM 24941 O WAT 3816 103.288 95.773 111.520 1.00 0.00 O ATOM 24942 H1 WAT 3816 102.879 94.910 111.456 1.00 0.00 H ATOM 24943 H2 WAT 3816 103.862 95.710 112.283 1.00 0.00 H TER 24945 WAT 3816 ATOM 24945 O WAT 3817 53.614 97.703 64.050 1.00 0.00 O ATOM 24946 H1 WAT 3817 52.793 98.055 64.393 1.00 0.00 H ATOM 24947 H2 WAT 3817 53.699 98.097 63.181 1.00 0.00 H TER 24949 WAT 3817 ATOM 24949 O WAT 3818 112.743 15.985 54.547 1.00 0.00 O ATOM 24950 H1 WAT 3818 112.859 16.756 53.991 1.00 0.00 H ATOM 24951 H2 WAT 3818 112.078 15.464 54.097 1.00 0.00 H TER 24953 WAT 3818 ATOM 24953 O WAT 3819 99.446 108.336 18.932 1.00 0.00 O ATOM 24954 H1 WAT 3819 100.370 108.372 19.182 1.00 0.00 H ATOM 24955 H2 WAT 3819 99.301 109.142 18.436 1.00 0.00 H TER 24957 WAT 3819 ATOM 24957 O WAT 3820 104.915 126.855 126.315 1.00 0.00 O ATOM 24958 H1 WAT 3820 104.242 126.506 125.731 1.00 0.00 H ATOM 24959 H2 WAT 3820 105.741 126.550 125.939 1.00 0.00 H TER 24961 WAT 3820 ATOM 24961 O WAT 3821 67.071 57.795 144.094 1.00 0.00 O ATOM 24962 H1 WAT 3821 66.198 58.179 144.180 1.00 0.00 H ATOM 24963 H2 WAT 3821 67.344 58.017 143.204 1.00 0.00 H TER 24965 WAT 3821 ATOM 24965 O WAT 3822 1.842 64.724 131.393 1.00 0.00 O ATOM 24966 H1 WAT 3822 2.517 65.155 131.917 1.00 0.00 H ATOM 24967 H2 WAT 3822 1.021 64.943 131.833 1.00 0.00 H TER 24969 WAT 3822 ATOM 24969 O WAT 3823 136.552 34.967 157.005 1.00 0.00 O ATOM 24970 H1 WAT 3823 136.898 34.074 157.000 1.00 0.00 H ATOM 24971 H2 WAT 3823 136.112 35.048 157.851 1.00 0.00 H TER 24973 WAT 3823 ATOM 24973 O WAT 3824 17.114 140.239 137.912 1.00 0.00 O ATOM 24974 H1 WAT 3824 16.185 140.401 138.075 1.00 0.00 H ATOM 24975 H2 WAT 3824 17.392 139.683 138.640 1.00 0.00 H TER 24977 WAT 3824 ATOM 24977 O WAT 3825 99.706 72.119 105.291 1.00 0.00 O ATOM 24978 H1 WAT 3825 99.535 72.263 106.222 1.00 0.00 H ATOM 24979 H2 WAT 3825 100.573 72.498 105.146 1.00 0.00 H TER 24981 WAT 3825 ATOM 24981 O WAT 3826 105.545 121.586 103.293 1.00 0.00 O ATOM 24982 H1 WAT 3826 106.415 121.312 103.001 1.00 0.00 H ATOM 24983 H2 WAT 3826 105.694 121.976 104.155 1.00 0.00 H TER 24985 WAT 3826 ATOM 24985 O WAT 3827 40.346 115.553 155.930 1.00 0.00 O ATOM 24986 H1 WAT 3827 40.102 114.864 156.548 1.00 0.00 H ATOM 24987 H2 WAT 3827 39.558 115.696 155.407 1.00 0.00 H TER 24989 WAT 3827 ATOM 24989 O WAT 3828 20.956 138.244 83.798 1.00 0.00 O ATOM 24990 H1 WAT 3828 20.520 137.412 83.980 1.00 0.00 H ATOM 24991 H2 WAT 3828 21.890 138.039 83.835 1.00 0.00 H TER 24993 WAT 3828 ATOM 24993 O WAT 3829 21.636 88.515 105.864 1.00 0.00 O ATOM 24994 H1 WAT 3829 22.036 87.911 105.238 1.00 0.00 H ATOM 24995 H2 WAT 3829 20.844 88.824 105.424 1.00 0.00 H TER 24997 WAT 3829 ATOM 24997 O WAT 3830 126.093 99.364 85.161 1.00 0.00 O ATOM 24998 H1 WAT 3830 126.280 100.120 85.717 1.00 0.00 H ATOM 24999 H2 WAT 3830 126.891 99.242 84.646 1.00 0.00 H TER 25001 WAT 3830 ATOM 25001 O WAT 3831 97.790 88.604 71.104 1.00 0.00 O ATOM 25002 H1 WAT 3831 97.841 87.650 71.163 1.00 0.00 H ATOM 25003 H2 WAT 3831 97.356 88.769 70.267 1.00 0.00 H TER 25005 WAT 3831 ATOM 25005 O WAT 3832 8.768 121.844 7.176 1.00 0.00 O ATOM 25006 H1 WAT 3832 8.214 122.617 7.066 1.00 0.00 H ATOM 25007 H2 WAT 3832 8.211 121.111 6.914 1.00 0.00 H TER 25009 WAT 3832 ATOM 25009 O WAT 3833 62.492 114.735 98.190 1.00 0.00 O ATOM 25010 H1 WAT 3833 61.944 113.987 98.429 1.00 0.00 H ATOM 25011 H2 WAT 3833 61.962 115.501 98.412 1.00 0.00 H TER 25013 WAT 3833 ATOM 25013 O WAT 3834 79.789 41.539 72.858 1.00 0.00 O ATOM 25014 H1 WAT 3834 80.182 40.698 73.091 1.00 0.00 H ATOM 25015 H2 WAT 3834 80.428 41.949 72.276 1.00 0.00 H TER 25017 WAT 3834 ATOM 25017 O WAT 3835 118.045 137.686 94.651 1.00 0.00 O ATOM 25018 H1 WAT 3835 117.407 137.244 95.212 1.00 0.00 H ATOM 25019 H2 WAT 3835 118.568 138.214 95.254 1.00 0.00 H TER 25021 WAT 3835 ATOM 25021 O WAT 3836 80.467 83.297 71.540 1.00 0.00 O ATOM 25022 H1 WAT 3836 80.668 83.710 70.700 1.00 0.00 H ATOM 25023 H2 WAT 3836 81.263 83.408 72.059 1.00 0.00 H TER 25025 WAT 3836 ATOM 25025 O WAT 3837 42.678 96.109 154.771 1.00 0.00 O ATOM 25026 H1 WAT 3837 43.124 96.511 155.517 1.00 0.00 H ATOM 25027 H2 WAT 3837 43.226 95.358 154.541 1.00 0.00 H TER 25029 WAT 3837 ATOM 25029 O WAT 3838 95.529 123.773 87.693 1.00 0.00 O ATOM 25030 H1 WAT 3838 94.810 124.193 88.166 1.00 0.00 H ATOM 25031 H2 WAT 3838 95.300 123.876 86.769 1.00 0.00 H TER 25033 WAT 3838 ATOM 25033 O WAT 3839 86.174 19.547 5.041 1.00 0.00 O ATOM 25034 H1 WAT 3839 86.505 20.028 4.282 1.00 0.00 H ATOM 25035 H2 WAT 3839 86.167 18.632 4.759 1.00 0.00 H TER 25037 WAT 3839 ATOM 25037 O WAT 3840 42.959 37.754 4.068 1.00 0.00 O ATOM 25038 H1 WAT 3840 42.134 37.578 4.519 1.00 0.00 H ATOM 25039 H2 WAT 3840 43.015 38.710 4.037 1.00 0.00 H TER 25041 WAT 3840 ATOM 25041 O WAT 3841 36.399 111.411 99.806 1.00 0.00 O ATOM 25042 H1 WAT 3841 36.106 111.572 98.909 1.00 0.00 H ATOM 25043 H2 WAT 3841 36.729 110.513 99.792 1.00 0.00 H TER 25045 WAT 3841 ATOM 25045 O WAT 3842 142.988 6.940 82.825 1.00 0.00 O ATOM 25046 H1 WAT 3842 143.277 6.876 81.915 1.00 0.00 H ATOM 25047 H2 WAT 3842 142.112 6.554 82.827 1.00 0.00 H TER 25049 WAT 3842 ATOM 25049 O WAT 3843 132.798 87.958 109.971 1.00 0.00 O ATOM 25050 H1 WAT 3843 132.685 88.523 109.207 1.00 0.00 H ATOM 25051 H2 WAT 3843 133.696 88.123 110.261 1.00 0.00 H TER 25053 WAT 3843 ATOM 25053 O WAT 3844 31.783 18.790 79.367 1.00 0.00 O ATOM 25054 H1 WAT 3844 32.486 18.728 80.013 1.00 0.00 H ATOM 25055 H2 WAT 3844 31.882 19.664 78.989 1.00 0.00 H TER 25057 WAT 3844 ATOM 25057 O WAT 3845 1.417 92.332 109.817 1.00 0.00 O ATOM 25058 H1 WAT 3845 1.618 93.266 109.863 1.00 0.00 H ATOM 25059 H2 WAT 3845 1.431 92.129 108.882 1.00 0.00 H TER 25061 WAT 3845 ATOM 25061 O WAT 3846 40.560 46.562 58.053 1.00 0.00 O ATOM 25062 H1 WAT 3846 39.809 46.018 58.288 1.00 0.00 H ATOM 25063 H2 WAT 3846 41.314 45.977 58.131 1.00 0.00 H TER 25065 WAT 3846 ATOM 25065 O WAT 3847 31.465 104.692 9.820 1.00 0.00 O ATOM 25066 H1 WAT 3847 31.014 105.518 9.994 1.00 0.00 H ATOM 25067 H2 WAT 3847 32.175 104.668 10.462 1.00 0.00 H TER 25069 WAT 3847 ATOM 25069 O WAT 3848 64.689 7.065 89.252 1.00 0.00 O ATOM 25070 H1 WAT 3848 64.676 7.384 88.350 1.00 0.00 H ATOM 25071 H2 WAT 3848 64.316 6.185 89.201 1.00 0.00 H TER 25073 WAT 3848 ATOM 25073 O WAT 3849 55.153 110.225 78.293 1.00 0.00 O ATOM 25074 H1 WAT 3849 55.119 111.128 78.607 1.00 0.00 H ATOM 25075 H2 WAT 3849 54.250 110.021 78.049 1.00 0.00 H TER 25077 WAT 3849 ATOM 25077 O WAT 3850 54.008 119.692 138.827 1.00 0.00 O ATOM 25078 H1 WAT 3850 53.472 119.053 139.297 1.00 0.00 H ATOM 25079 H2 WAT 3850 54.459 119.180 138.156 1.00 0.00 H TER 25081 WAT 3850 ATOM 25081 O WAT 3851 84.244 72.482 91.325 1.00 0.00 O ATOM 25082 H1 WAT 3851 84.077 73.078 90.594 1.00 0.00 H ATOM 25083 H2 WAT 3851 83.394 72.382 91.752 1.00 0.00 H TER 25085 WAT 3851 ATOM 25085 O WAT 3852 44.032 5.399 101.982 1.00 0.00 O ATOM 25086 H1 WAT 3852 44.793 5.654 102.503 1.00 0.00 H ATOM 25087 H2 WAT 3852 44.015 6.027 101.260 1.00 0.00 H TER 25089 WAT 3852 ATOM 25089 O WAT 3853 79.210 131.492 70.093 1.00 0.00 O ATOM 25090 H1 WAT 3853 79.964 131.502 69.503 1.00 0.00 H ATOM 25091 H2 WAT 3853 79.125 132.398 70.390 1.00 0.00 H TER 25093 WAT 3853 ATOM 25093 O WAT 3854 55.438 58.111 19.874 1.00 0.00 O ATOM 25094 H1 WAT 3854 56.024 57.602 19.314 1.00 0.00 H ATOM 25095 H2 WAT 3854 54.559 57.843 19.608 1.00 0.00 H TER 25097 WAT 3854 ATOM 25097 O WAT 3855 32.279 40.696 23.084 1.00 0.00 O ATOM 25098 H1 WAT 3855 31.775 40.298 22.374 1.00 0.00 H ATOM 25099 H2 WAT 3855 33.192 40.512 22.861 1.00 0.00 H TER 25101 WAT 3855 ATOM 25101 O WAT 3856 55.550 37.336 86.978 1.00 0.00 O ATOM 25102 H1 WAT 3856 55.196 37.591 86.126 1.00 0.00 H ATOM 25103 H2 WAT 3856 55.695 36.393 86.903 1.00 0.00 H TER 25105 WAT 3856 ATOM 25105 O WAT 3857 30.668 20.613 121.085 1.00 0.00 O ATOM 25106 H1 WAT 3857 31.497 21.088 121.031 1.00 0.00 H ATOM 25107 H2 WAT 3857 30.357 20.570 120.181 1.00 0.00 H TER 25109 WAT 3857 ATOM 25109 O WAT 3858 62.149 121.237 59.054 1.00 0.00 O ATOM 25110 H1 WAT 3858 62.996 121.507 59.407 1.00 0.00 H ATOM 25111 H2 WAT 3858 62.192 121.464 58.126 1.00 0.00 H TER 25113 WAT 3858 ATOM 25113 O WAT 3859 113.878 74.132 147.869 1.00 0.00 O ATOM 25114 H1 WAT 3859 113.010 74.535 147.886 1.00 0.00 H ATOM 25115 H2 WAT 3859 114.338 74.526 148.611 1.00 0.00 H TER 25117 WAT 3859 ATOM 25117 O WAT 3860 72.276 98.247 82.902 1.00 0.00 O ATOM 25118 H1 WAT 3860 72.601 98.600 82.073 1.00 0.00 H ATOM 25119 H2 WAT 3860 72.839 97.493 83.078 1.00 0.00 H TER 25121 WAT 3860 ATOM 25121 O WAT 3861 113.316 79.703 148.509 1.00 0.00 O ATOM 25122 H1 WAT 3861 113.841 79.859 147.723 1.00 0.00 H ATOM 25123 H2 WAT 3861 113.146 80.577 148.860 1.00 0.00 H TER 25125 WAT 3861 ATOM 25125 O WAT 3862 9.327 68.920 67.322 1.00 0.00 O ATOM 25126 H1 WAT 3862 9.345 69.867 67.186 1.00 0.00 H ATOM 25127 H2 WAT 3862 8.677 68.789 68.012 1.00 0.00 H TER 25129 WAT 3862 ATOM 25129 O WAT 3863 67.967 67.389 107.834 1.00 0.00 O ATOM 25130 H1 WAT 3863 67.330 66.677 107.899 1.00 0.00 H ATOM 25131 H2 WAT 3863 67.434 68.183 107.798 1.00 0.00 H TER 25133 WAT 3863 ATOM 25133 O WAT 3864 96.412 127.597 145.182 1.00 0.00 O ATOM 25134 H1 WAT 3864 97.324 127.310 145.228 1.00 0.00 H ATOM 25135 H2 WAT 3864 96.408 128.278 144.509 1.00 0.00 H TER 25137 WAT 3864 ATOM 25137 O WAT 3865 144.920 51.301 147.724 1.00 0.00 O ATOM 25138 H1 WAT 3865 144.649 50.490 147.293 1.00 0.00 H ATOM 25139 H2 WAT 3865 144.134 51.606 148.176 1.00 0.00 H TER 25141 WAT 3865 ATOM 25141 O WAT 3866 47.288 69.691 14.276 1.00 0.00 O ATOM 25142 H1 WAT 3866 46.615 69.127 14.657 1.00 0.00 H ATOM 25143 H2 WAT 3866 48.091 69.172 14.325 1.00 0.00 H TER 25145 WAT 3866 ATOM 25145 O WAT 3867 48.667 138.315 20.030 1.00 0.00 O ATOM 25146 H1 WAT 3867 49.583 138.576 20.130 1.00 0.00 H ATOM 25147 H2 WAT 3867 48.271 139.021 19.519 1.00 0.00 H TER 25149 WAT 3867 ATOM 25149 O WAT 3868 10.344 138.152 79.869 1.00 0.00 O ATOM 25150 H1 WAT 3868 10.836 137.337 79.768 1.00 0.00 H ATOM 25151 H2 WAT 3868 9.971 138.098 80.749 1.00 0.00 H TER 25153 WAT 3868 ATOM 25153 O WAT 3869 0.620 105.792 115.801 1.00 0.00 O ATOM 25154 H1 WAT 3869 0.247 105.199 116.452 1.00 0.00 H ATOM 25155 H2 WAT 3869 -0.123 106.045 115.253 1.00 0.00 H TER 25157 WAT 3869 ATOM 25157 O WAT 3870 78.001 111.738 58.462 1.00 0.00 O ATOM 25158 H1 WAT 3870 78.770 112.283 58.296 1.00 0.00 H ATOM 25159 H2 WAT 3870 77.991 111.110 57.739 1.00 0.00 H TER 25161 WAT 3870 ATOM 25161 O WAT 3871 8.612 111.069 113.496 1.00 0.00 O ATOM 25162 H1 WAT 3871 8.453 110.127 113.439 1.00 0.00 H ATOM 25163 H2 WAT 3871 8.484 111.278 114.421 1.00 0.00 H TER 25165 WAT 3871 ATOM 25165 O WAT 3872 129.338 28.216 80.658 1.00 0.00 O ATOM 25166 H1 WAT 3872 129.907 28.499 79.942 1.00 0.00 H ATOM 25167 H2 WAT 3872 129.412 27.261 80.660 1.00 0.00 H TER 25169 WAT 3872 ATOM 25169 O WAT 3873 45.260 114.145 80.704 1.00 0.00 O ATOM 25170 H1 WAT 3873 44.594 114.116 80.017 1.00 0.00 H ATOM 25171 H2 WAT 3873 45.528 115.064 80.739 1.00 0.00 H TER 25173 WAT 3873 ATOM 25173 O WAT 3874 97.689 65.867 67.034 1.00 0.00 O ATOM 25174 H1 WAT 3874 98.477 65.478 66.654 1.00 0.00 H ATOM 25175 H2 WAT 3874 97.986 66.251 67.860 1.00 0.00 H TER 25177 WAT 3874 ATOM 25177 O WAT 3875 54.813 2.515 61.241 1.00 0.00 O ATOM 25178 H1 WAT 3875 55.050 3.308 60.760 1.00 0.00 H ATOM 25179 H2 WAT 3875 53.910 2.337 60.980 1.00 0.00 H TER 25181 WAT 3875 ATOM 25181 O WAT 3876 1.210 110.350 107.670 1.00 0.00 O ATOM 25182 H1 WAT 3876 0.770 111.174 107.463 1.00 0.00 H ATOM 25183 H2 WAT 3876 0.606 109.897 108.259 1.00 0.00 H TER 25185 WAT 3876 ATOM 25185 O WAT 3877 12.377 25.041 110.260 1.00 0.00 O ATOM 25186 H1 WAT 3877 11.775 25.313 110.953 1.00 0.00 H ATOM 25187 H2 WAT 3877 13.151 24.724 110.726 1.00 0.00 H TER 25189 WAT 3877 ATOM 25189 O WAT 3878 24.425 124.968 2.575 1.00 0.00 O ATOM 25190 H1 WAT 3878 24.093 125.127 3.458 1.00 0.00 H ATOM 25191 H2 WAT 3878 24.340 124.023 2.453 1.00 0.00 H TER 25193 WAT 3878 ATOM 25193 O WAT 3879 140.315 140.358 142.656 1.00 0.00 O ATOM 25194 H1 WAT 3879 141.051 139.826 142.352 1.00 0.00 H ATOM 25195 H2 WAT 3879 139.832 140.576 141.859 1.00 0.00 H TER 25197 WAT 3879 ATOM 25197 O WAT 3880 135.226 29.988 112.444 1.00 0.00 O ATOM 25198 H1 WAT 3880 135.773 30.773 112.468 1.00 0.00 H ATOM 25199 H2 WAT 3880 135.339 29.591 113.308 1.00 0.00 H TER 25201 WAT 3880 ATOM 25201 O WAT 3881 29.496 115.673 119.426 1.00 0.00 O ATOM 25202 H1 WAT 3881 30.128 116.380 119.293 1.00 0.00 H ATOM 25203 H2 WAT 3881 29.980 115.007 119.913 1.00 0.00 H TER 25205 WAT 3881 ATOM 25205 O WAT 3882 16.756 6.210 93.139 1.00 0.00 O ATOM 25206 H1 WAT 3882 17.577 6.553 93.492 1.00 0.00 H ATOM 25207 H2 WAT 3882 16.622 6.697 92.326 1.00 0.00 H TER 25209 WAT 3882 ATOM 25209 O WAT 3883 97.389 89.606 2.281 1.00 0.00 O ATOM 25210 H1 WAT 3883 97.260 89.132 1.460 1.00 0.00 H ATOM 25211 H2 WAT 3883 96.601 90.140 2.377 1.00 0.00 H TER 25213 WAT 3883 ATOM 25213 O WAT 3884 115.472 64.081 137.188 1.00 0.00 O ATOM 25214 H1 WAT 3884 116.349 63.698 137.179 1.00 0.00 H ATOM 25215 H2 WAT 3884 115.433 64.608 136.390 1.00 0.00 H TER 25217 WAT 3884 ATOM 25217 O WAT 3885 121.755 121.031 81.555 1.00 0.00 O ATOM 25218 H1 WAT 3885 121.663 121.246 82.484 1.00 0.00 H ATOM 25219 H2 WAT 3885 120.885 120.733 81.291 1.00 0.00 H TER 25221 WAT 3885 ATOM 25221 O WAT 3886 66.874 108.015 110.945 1.00 0.00 O ATOM 25222 H1 WAT 3886 67.652 108.392 111.355 1.00 0.00 H ATOM 25223 H2 WAT 3886 66.445 107.527 111.648 1.00 0.00 H TER 25225 WAT 3886 ATOM 25225 O WAT 3887 15.559 144.176 95.872 1.00 0.00 O ATOM 25226 H1 WAT 3887 15.119 144.363 95.043 1.00 0.00 H ATOM 25227 H2 WAT 3887 15.906 145.022 96.155 1.00 0.00 H TER 25229 WAT 3887 ATOM 25229 O WAT 3888 61.856 60.241 144.169 1.00 0.00 O ATOM 25230 H1 WAT 3888 61.985 60.335 145.113 1.00 0.00 H ATOM 25231 H2 WAT 3888 61.068 60.752 143.983 1.00 0.00 H TER 25233 WAT 3888 ATOM 25233 O WAT 3889 114.901 140.330 151.212 1.00 0.00 O ATOM 25234 H1 WAT 3889 114.108 139.984 150.803 1.00 0.00 H ATOM 25235 H2 WAT 3889 114.892 141.263 151.000 1.00 0.00 H TER 25237 WAT 3889 ATOM 25237 O WAT 3890 71.774 124.722 108.862 1.00 0.00 O ATOM 25238 H1 WAT 3890 71.120 125.004 108.223 1.00 0.00 H ATOM 25239 H2 WAT 3890 72.601 124.739 108.381 1.00 0.00 H TER 25241 WAT 3890 ATOM 25241 O WAT 3891 43.124 141.751 120.074 1.00 0.00 O ATOM 25242 H1 WAT 3891 43.600 141.702 119.245 1.00 0.00 H ATOM 25243 H2 WAT 3891 43.369 142.602 120.440 1.00 0.00 H TER 25245 WAT 3891 ATOM 25245 O WAT 3892 7.821 22.289 128.485 1.00 0.00 O ATOM 25246 H1 WAT 3892 7.837 21.458 128.961 1.00 0.00 H ATOM 25247 H2 WAT 3892 6.906 22.567 128.519 1.00 0.00 H TER 25249 WAT 3892 ATOM 25249 O WAT 3893 76.869 98.993 96.525 1.00 0.00 O ATOM 25250 H1 WAT 3893 77.564 98.767 97.142 1.00 0.00 H ATOM 25251 H2 WAT 3893 76.353 99.660 96.979 1.00 0.00 H TER 25253 WAT 3893 ATOM 25253 O WAT 3894 32.185 59.141 88.515 1.00 0.00 O ATOM 25254 H1 WAT 3894 33.067 59.483 88.661 1.00 0.00 H ATOM 25255 H2 WAT 3894 32.214 58.771 87.633 1.00 0.00 H TER 25257 WAT 3894 ATOM 25257 O WAT 3895 5.441 44.602 103.771 1.00 0.00 O ATOM 25258 H1 WAT 3895 4.764 45.210 103.473 1.00 0.00 H ATOM 25259 H2 WAT 3895 6.266 45.030 103.540 1.00 0.00 H TER 25261 WAT 3895 ATOM 25261 O WAT 3896 46.331 97.121 138.805 1.00 0.00 O ATOM 25262 H1 WAT 3896 45.974 97.410 137.965 1.00 0.00 H ATOM 25263 H2 WAT 3896 47.255 96.947 138.625 1.00 0.00 H TER 25265 WAT 3896 ATOM 25265 O WAT 3897 73.870 123.634 16.601 1.00 0.00 O ATOM 25266 H1 WAT 3897 74.142 123.660 17.518 1.00 0.00 H ATOM 25267 H2 WAT 3897 73.068 124.157 16.574 1.00 0.00 H TER 25269 WAT 3897 ATOM 25269 O WAT 3898 77.964 15.880 11.787 1.00 0.00 O ATOM 25270 H1 WAT 3898 78.297 15.220 12.395 1.00 0.00 H ATOM 25271 H2 WAT 3898 77.014 15.856 11.905 1.00 0.00 H TER 25273 WAT 3898 ATOM 25273 O WAT 3899 63.212 2.306 8.085 1.00 0.00 O ATOM 25274 H1 WAT 3899 62.601 1.682 8.477 1.00 0.00 H ATOM 25275 H2 WAT 3899 63.990 1.785 7.885 1.00 0.00 H TER 25277 WAT 3899 ATOM 25277 O WAT 3900 100.964 97.024 5.859 1.00 0.00 O ATOM 25278 H1 WAT 3900 100.924 96.469 5.080 1.00 0.00 H ATOM 25279 H2 WAT 3900 100.216 96.747 6.389 1.00 0.00 H TER 25281 WAT 3900 ATOM 25281 O WAT 3901 113.826 139.780 65.165 1.00 0.00 O ATOM 25282 H1 WAT 3901 113.592 140.578 64.692 1.00 0.00 H ATOM 25283 H2 WAT 3901 114.722 139.590 64.885 1.00 0.00 H TER 25285 WAT 3901 ATOM 25285 O WAT 3902 127.645 143.323 84.763 1.00 0.00 O ATOM 25286 H1 WAT 3902 127.306 144.137 85.134 1.00 0.00 H ATOM 25287 H2 WAT 3902 126.866 142.849 84.471 1.00 0.00 H TER 25289 WAT 3902 ATOM 25289 O WAT 3903 48.102 18.189 93.839 1.00 0.00 O ATOM 25290 H1 WAT 3903 48.603 17.569 94.368 1.00 0.00 H ATOM 25291 H2 WAT 3903 48.380 19.050 94.152 1.00 0.00 H TER 25293 WAT 3903 ATOM 25293 O WAT 3904 9.176 93.856 128.469 1.00 0.00 O ATOM 25294 H1 WAT 3904 8.495 93.906 129.140 1.00 0.00 H ATOM 25295 H2 WAT 3904 9.985 93.709 128.959 1.00 0.00 H TER 25297 WAT 3904 ATOM 25297 O WAT 3905 69.263 142.522 109.986 1.00 0.00 O ATOM 25298 H1 WAT 3905 68.719 142.354 109.217 1.00 0.00 H ATOM 25299 H2 WAT 3905 69.921 141.827 109.972 1.00 0.00 H TER 25301 WAT 3905 ATOM 25301 O WAT 3906 130.215 131.765 10.876 1.00 0.00 O ATOM 25302 H1 WAT 3906 130.764 131.241 10.293 1.00 0.00 H ATOM 25303 H2 WAT 3906 130.689 131.774 11.708 1.00 0.00 H TER 25305 WAT 3906 ATOM 25305 O WAT 3907 3.747 43.597 84.771 1.00 0.00 O ATOM 25306 H1 WAT 3907 4.097 43.895 83.931 1.00 0.00 H ATOM 25307 H2 WAT 3907 3.376 44.385 85.169 1.00 0.00 H TER 25309 WAT 3907 ATOM 25309 O WAT 3908 129.649 80.215 95.577 1.00 0.00 O ATOM 25310 H1 WAT 3908 129.852 81.147 95.661 1.00 0.00 H ATOM 25311 H2 WAT 3908 129.383 80.110 94.663 1.00 0.00 H TER 25313 WAT 3908 ATOM 25313 O WAT 3909 1.477 0.758 20.858 1.00 0.00 O ATOM 25314 H1 WAT 3909 1.999 1.264 21.480 1.00 0.00 H ATOM 25315 H2 WAT 3909 1.738 1.091 19.999 1.00 0.00 H TER 25317 WAT 3909 ATOM 25317 O WAT 3910 8.112 130.283 104.221 1.00 0.00 O ATOM 25318 H1 WAT 3910 9.059 130.372 104.112 1.00 0.00 H ATOM 25319 H2 WAT 3910 7.995 129.405 104.585 1.00 0.00 H TER 25321 WAT 3910 ATOM 25321 O WAT 3911 69.955 123.250 157.126 1.00 0.00 O ATOM 25322 H1 WAT 3911 70.595 123.296 157.836 1.00 0.00 H ATOM 25323 H2 WAT 3911 70.301 123.837 156.454 1.00 0.00 H TER 25325 WAT 3911 ATOM 25325 O WAT 3912 22.115 96.953 100.109 1.00 0.00 O ATOM 25326 H1 WAT 3912 22.396 96.161 99.650 1.00 0.00 H ATOM 25327 H2 WAT 3912 21.276 96.715 100.505 1.00 0.00 H TER 25329 WAT 3912 ATOM 25329 O WAT 3913 118.596 144.917 8.842 1.00 0.00 O ATOM 25330 H1 WAT 3913 118.824 145.675 9.380 1.00 0.00 H ATOM 25331 H2 WAT 3913 119.418 144.665 8.422 1.00 0.00 H TER 25333 WAT 3913 ATOM 25333 O WAT 3914 62.497 118.967 121.595 1.00 0.00 O ATOM 25334 H1 WAT 3914 62.168 119.756 122.025 1.00 0.00 H ATOM 25335 H2 WAT 3914 62.075 118.246 122.062 1.00 0.00 H TER 25337 WAT 3914 ATOM 25337 O WAT 3915 115.342 119.258 117.420 1.00 0.00 O ATOM 25338 H1 WAT 3915 116.156 119.396 117.904 1.00 0.00 H ATOM 25339 H2 WAT 3915 115.445 119.782 116.625 1.00 0.00 H TER 25341 WAT 3915 ATOM 25341 O WAT 3916 141.012 70.332 98.546 1.00 0.00 O ATOM 25342 H1 WAT 3916 141.569 70.013 99.257 1.00 0.00 H ATOM 25343 H2 WAT 3916 140.945 69.590 97.945 1.00 0.00 H TER 25345 WAT 3916 ATOM 25345 O WAT 3917 67.367 106.707 149.409 1.00 0.00 O ATOM 25346 H1 WAT 3917 67.861 107.110 150.123 1.00 0.00 H ATOM 25347 H2 WAT 3917 67.764 107.062 148.613 1.00 0.00 H TER 25349 WAT 3917 ATOM 25349 O WAT 3918 48.193 78.572 128.069 1.00 0.00 O ATOM 25350 H1 WAT 3918 47.324 78.908 127.849 1.00 0.00 H ATOM 25351 H2 WAT 3918 48.402 77.967 127.358 1.00 0.00 H TER 25353 WAT 3918 ATOM 25353 O WAT 3919 104.532 13.197 118.342 1.00 0.00 O ATOM 25354 H1 WAT 3919 105.470 13.286 118.172 1.00 0.00 H ATOM 25355 H2 WAT 3919 104.125 13.256 117.478 1.00 0.00 H TER 25357 WAT 3919 ATOM 25357 O WAT 3920 81.718 15.258 15.916 1.00 0.00 O ATOM 25358 H1 WAT 3920 81.251 14.613 16.446 1.00 0.00 H ATOM 25359 H2 WAT 3920 81.473 15.050 15.014 1.00 0.00 H TER 25361 WAT 3920 ATOM 25361 O WAT 3921 129.857 140.857 135.744 1.00 0.00 O ATOM 25362 H1 WAT 3921 130.445 140.128 135.941 1.00 0.00 H ATOM 25363 H2 WAT 3921 130.057 141.513 136.412 1.00 0.00 H TER 25365 WAT 3921 ATOM 25365 O WAT 3922 74.814 12.373 98.522 1.00 0.00 O ATOM 25366 H1 WAT 3922 74.343 12.150 97.720 1.00 0.00 H ATOM 25367 H2 WAT 3922 75.404 13.082 98.264 1.00 0.00 H TER 25369 WAT 3922 ATOM 25369 O WAT 3923 72.049 104.577 79.587 1.00 0.00 O ATOM 25370 H1 WAT 3923 71.910 105.321 80.174 1.00 0.00 H ATOM 25371 H2 WAT 3923 72.975 104.629 79.351 1.00 0.00 H TER 25373 WAT 3923 ATOM 25373 O WAT 3924 111.237 145.181 79.921 1.00 0.00 O ATOM 25374 H1 WAT 3924 110.295 145.059 80.039 1.00 0.00 H ATOM 25375 H2 WAT 3924 111.633 144.717 80.659 1.00 0.00 H TER 25377 WAT 3924 ATOM 25377 O WAT 3925 68.303 134.661 89.413 1.00 0.00 O ATOM 25378 H1 WAT 3925 69.231 134.667 89.648 1.00 0.00 H ATOM 25379 H2 WAT 3925 67.889 135.235 90.058 1.00 0.00 H TER 25381 WAT 3925 ATOM 25381 O WAT 3926 121.401 110.910 144.288 1.00 0.00 O ATOM 25382 H1 WAT 3926 121.188 110.303 144.996 1.00 0.00 H ATOM 25383 H2 WAT 3926 122.326 110.747 144.103 1.00 0.00 H TER 25385 WAT 3926 ATOM 25385 O WAT 3927 82.782 105.255 139.034 1.00 0.00 O ATOM 25386 H1 WAT 3927 81.950 104.990 139.427 1.00 0.00 H ATOM 25387 H2 WAT 3927 82.555 105.990 138.465 1.00 0.00 H TER 25389 WAT 3927 ATOM 25389 O WAT 3928 110.185 50.048 92.614 1.00 0.00 O ATOM 25390 H1 WAT 3928 110.274 50.951 92.920 1.00 0.00 H ATOM 25391 H2 WAT 3928 109.781 49.585 93.347 1.00 0.00 H TER 25393 WAT 3928 ATOM 25393 O WAT 3929 107.656 116.781 116.096 1.00 0.00 O ATOM 25394 H1 WAT 3929 107.694 117.702 115.841 1.00 0.00 H ATOM 25395 H2 WAT 3929 107.992 116.766 116.992 1.00 0.00 H TER 25397 WAT 3929 ATOM 25397 O WAT 3930 28.125 126.364 112.850 1.00 0.00 O ATOM 25398 H1 WAT 3930 28.336 127.085 112.257 1.00 0.00 H ATOM 25399 H2 WAT 3930 27.363 126.673 113.341 1.00 0.00 H TER 25401 WAT 3930 ATOM 25401 O WAT 3931 103.986 86.286 128.987 1.00 0.00 O ATOM 25402 H1 WAT 3931 103.286 86.888 128.733 1.00 0.00 H ATOM 25403 H2 WAT 3931 104.685 86.451 128.355 1.00 0.00 H TER 25405 WAT 3931 ATOM 25405 O WAT 3932 61.803 16.677 60.626 1.00 0.00 O ATOM 25406 H1 WAT 3932 62.655 16.369 60.934 1.00 0.00 H ATOM 25407 H2 WAT 3932 61.577 17.393 61.220 1.00 0.00 H TER 25409 WAT 3932 ATOM 25409 O WAT 3933 73.514 123.196 5.783 1.00 0.00 O ATOM 25410 H1 WAT 3933 74.237 123.361 5.178 1.00 0.00 H ATOM 25411 H2 WAT 3933 73.930 123.133 6.643 1.00 0.00 H TER 25413 WAT 3933 ATOM 25413 O WAT 3934 11.760 63.078 118.358 1.00 0.00 O ATOM 25414 H1 WAT 3934 10.911 63.120 118.799 1.00 0.00 H ATOM 25415 H2 WAT 3934 11.904 63.966 118.031 1.00 0.00 H TER 25417 WAT 3934 ATOM 25417 O WAT 3935 0.225 14.329 67.682 1.00 0.00 O ATOM 25418 H1 WAT 3935 0.968 13.812 67.371 1.00 0.00 H ATOM 25419 H2 WAT 3935 -0.516 14.020 67.160 1.00 0.00 H TER 25421 WAT 3935 ATOM 25421 O WAT 3936 128.948 94.174 107.221 1.00 0.00 O ATOM 25422 H1 WAT 3936 128.287 93.505 107.398 1.00 0.00 H ATOM 25423 H2 WAT 3936 129.081 94.607 108.065 1.00 0.00 H TER 25425 WAT 3936 ATOM 25425 O WAT 3937 145.835 142.196 24.208 1.00 0.00 O ATOM 25426 H1 WAT 3937 145.732 143.147 24.248 1.00 0.00 H ATOM 25427 H2 WAT 3937 144.959 141.853 24.378 1.00 0.00 H TER 25429 WAT 3937 ATOM 25429 O WAT 3938 7.597 105.610 126.765 1.00 0.00 O ATOM 25430 H1 WAT 3938 8.121 106.339 126.431 1.00 0.00 H ATOM 25431 H2 WAT 3938 6.692 105.861 126.581 1.00 0.00 H TER 25433 WAT 3938 ATOM 25433 O WAT 3939 66.020 141.789 151.597 1.00 0.00 O ATOM 25434 H1 WAT 3939 66.364 140.913 151.423 1.00 0.00 H ATOM 25435 H2 WAT 3939 66.489 142.080 152.379 1.00 0.00 H TER 25437 WAT 3939 ATOM 25437 O WAT 3940 95.734 61.987 145.316 1.00 0.00 O ATOM 25438 H1 WAT 3940 96.196 61.650 146.083 1.00 0.00 H ATOM 25439 H2 WAT 3940 96.372 62.555 144.882 1.00 0.00 H TER 25441 WAT 3940 ATOM 25441 O WAT 3941 67.288 78.726 154.029 1.00 0.00 O ATOM 25442 H1 WAT 3941 67.595 77.915 153.624 1.00 0.00 H ATOM 25443 H2 WAT 3941 67.878 79.400 153.692 1.00 0.00 H TER 25445 WAT 3941 ATOM 25445 O WAT 3942 22.725 84.679 0.344 1.00 0.00 O ATOM 25446 H1 WAT 3942 23.422 85.295 0.116 1.00 0.00 H ATOM 25447 H2 WAT 3942 22.658 84.736 1.297 1.00 0.00 H TER 25449 WAT 3942 ATOM 25449 O WAT 3943 17.934 60.843 141.180 1.00 0.00 O ATOM 25450 H1 WAT 3943 17.980 59.887 141.153 1.00 0.00 H ATOM 25451 H2 WAT 3943 17.001 61.035 141.271 1.00 0.00 H TER 25453 WAT 3943 ATOM 25453 O WAT 3944 140.868 104.010 12.999 1.00 0.00 O ATOM 25454 H1 WAT 3944 140.480 103.405 13.631 1.00 0.00 H ATOM 25455 H2 WAT 3944 141.224 103.445 12.314 1.00 0.00 H TER 25457 WAT 3944 ATOM 25457 O WAT 3945 70.546 8.235 54.827 1.00 0.00 O ATOM 25458 H1 WAT 3945 70.440 8.981 54.236 1.00 0.00 H ATOM 25459 H2 WAT 3945 71.465 7.984 54.734 1.00 0.00 H TER 25461 WAT 3945 ATOM 25461 O WAT 3946 38.004 71.408 7.986 1.00 0.00 O ATOM 25462 H1 WAT 3946 38.420 70.637 8.371 1.00 0.00 H ATOM 25463 H2 WAT 3946 37.162 71.090 7.661 1.00 0.00 H TER 25465 WAT 3946 ATOM 25465 O WAT 3947 105.190 84.559 4.529 1.00 0.00 O ATOM 25466 H1 WAT 3947 104.591 84.114 5.129 1.00 0.00 H ATOM 25467 H2 WAT 3947 105.194 85.469 4.825 1.00 0.00 H TER 25469 WAT 3947 ATOM 25469 O WAT 3948 10.177 60.237 87.133 1.00 0.00 O ATOM 25470 H1 WAT 3948 10.320 60.513 88.039 1.00 0.00 H ATOM 25471 H2 WAT 3948 9.264 60.463 86.955 1.00 0.00 H TER 25473 WAT 3948 ATOM 25473 O WAT 3949 70.561 36.838 137.257 1.00 0.00 O ATOM 25474 H1 WAT 3949 69.847 36.367 136.829 1.00 0.00 H ATOM 25475 H2 WAT 3949 70.140 37.598 137.659 1.00 0.00 H TER 25477 WAT 3949 ATOM 25477 O WAT 3950 55.722 27.133 23.970 1.00 0.00 O ATOM 25478 H1 WAT 3950 56.429 26.964 23.347 1.00 0.00 H ATOM 25479 H2 WAT 3950 56.156 27.543 24.718 1.00 0.00 H TER 25481 WAT 3950 ATOM 25481 O WAT 3951 93.961 17.334 133.543 1.00 0.00 O ATOM 25482 H1 WAT 3951 93.737 17.705 132.689 1.00 0.00 H ATOM 25483 H2 WAT 3951 93.540 16.474 133.547 1.00 0.00 H TER 25485 WAT 3951 ATOM 25485 O WAT 3952 71.654 66.915 150.284 1.00 0.00 O ATOM 25486 H1 WAT 3952 71.840 66.023 149.992 1.00 0.00 H ATOM 25487 H2 WAT 3952 71.304 67.353 149.508 1.00 0.00 H TER 25489 WAT 3952 ATOM 25489 O WAT 3953 116.678 133.070 101.136 1.00 0.00 O ATOM 25490 H1 WAT 3953 117.547 133.421 100.942 1.00 0.00 H ATOM 25491 H2 WAT 3953 116.848 132.231 101.565 1.00 0.00 H TER 25493 WAT 3953 ATOM 25493 O WAT 3954 108.195 77.868 10.561 1.00 0.00 O ATOM 25494 H1 WAT 3954 109.078 77.701 10.231 1.00 0.00 H ATOM 25495 H2 WAT 3954 108.279 77.799 11.512 1.00 0.00 H TER 25497 WAT 3954 ATOM 25497 O WAT 3955 33.683 2.649 133.194 1.00 0.00 O ATOM 25498 H1 WAT 3955 33.124 1.881 133.078 1.00 0.00 H ATOM 25499 H2 WAT 3955 33.449 2.988 134.058 1.00 0.00 H TER 25501 WAT 3955 ATOM 25501 O WAT 3956 69.414 14.610 132.864 1.00 0.00 O ATOM 25502 H1 WAT 3956 69.559 13.711 133.159 1.00 0.00 H ATOM 25503 H2 WAT 3956 70.294 14.976 132.771 1.00 0.00 H TER 25505 WAT 3956 ATOM 25505 O WAT 3957 77.740 76.845 59.975 1.00 0.00 O ATOM 25506 H1 WAT 3957 77.393 77.336 60.720 1.00 0.00 H ATOM 25507 H2 WAT 3957 77.160 77.072 59.248 1.00 0.00 H TER 25509 WAT 3957 ATOM 25509 O WAT 3958 108.854 141.590 71.953 1.00 0.00 O ATOM 25510 H1 WAT 3958 108.996 140.932 71.273 1.00 0.00 H ATOM 25511 H2 WAT 3958 108.267 142.230 71.550 1.00 0.00 H TER 25513 WAT 3958 ATOM 25513 O WAT 3959 63.042 106.068 134.366 1.00 0.00 O ATOM 25514 H1 WAT 3959 63.563 106.148 135.165 1.00 0.00 H ATOM 25515 H2 WAT 3959 63.460 105.359 133.877 1.00 0.00 H TER 25517 WAT 3959 ATOM 25517 O WAT 3960 25.166 58.889 93.462 1.00 0.00 O ATOM 25518 H1 WAT 3960 26.086 58.739 93.679 1.00 0.00 H ATOM 25519 H2 WAT 3960 24.692 58.208 93.939 1.00 0.00 H TER 25521 WAT 3960 ATOM 25521 O WAT 3961 0.188 115.640 100.267 1.00 0.00 O ATOM 25522 H1 WAT 3961 1.141 115.595 100.343 1.00 0.00 H ATOM 25523 H2 WAT 3961 -0.105 114.736 100.387 1.00 0.00 H TER 25525 WAT 3961 ATOM 25525 O WAT 3962 41.489 144.600 24.876 1.00 0.00 O ATOM 25526 H1 WAT 3962 41.062 144.990 25.639 1.00 0.00 H ATOM 25527 H2 WAT 3962 42.058 145.293 24.540 1.00 0.00 H TER 25529 WAT 3962 ATOM 25529 O WAT 3963 46.316 122.807 154.073 1.00 0.00 O ATOM 25530 H1 WAT 3963 45.526 123.318 154.248 1.00 0.00 H ATOM 25531 H2 WAT 3963 46.267 122.073 154.685 1.00 0.00 H TER 25533 WAT 3963 ATOM 25533 O WAT 3964 114.153 58.416 66.997 1.00 0.00 O ATOM 25534 H1 WAT 3964 113.673 58.000 67.713 1.00 0.00 H ATOM 25535 H2 WAT 3964 113.996 59.353 67.116 1.00 0.00 H TER 25537 WAT 3964 ATOM 25537 O WAT 3965 97.323 109.492 69.098 1.00 0.00 O ATOM 25538 H1 WAT 3965 98.115 110.030 69.108 1.00 0.00 H ATOM 25539 H2 WAT 3965 97.578 108.699 68.627 1.00 0.00 H TER 25541 WAT 3965 ATOM 25541 O WAT 3966 43.857 39.331 21.749 1.00 0.00 O ATOM 25542 H1 WAT 3966 43.507 39.231 22.634 1.00 0.00 H ATOM 25543 H2 WAT 3966 44.708 38.894 21.777 1.00 0.00 H TER 25545 WAT 3966 ATOM 25545 O WAT 3967 91.712 74.895 132.314 1.00 0.00 O ATOM 25546 H1 WAT 3967 90.805 75.082 132.074 1.00 0.00 H ATOM 25547 H2 WAT 3967 91.706 73.975 132.578 1.00 0.00 H TER 25549 WAT 3967 ATOM 25549 O WAT 3968 91.247 46.988 79.982 1.00 0.00 O ATOM 25550 H1 WAT 3968 91.439 46.401 80.713 1.00 0.00 H ATOM 25551 H2 WAT 3968 90.299 47.118 80.023 1.00 0.00 H TER 25553 WAT 3968 ATOM 25553 O WAT 3969 90.772 110.781 25.431 1.00 0.00 O ATOM 25554 H1 WAT 3969 91.243 110.184 26.012 1.00 0.00 H ATOM 25555 H2 WAT 3969 89.852 110.539 25.533 1.00 0.00 H TER 25557 WAT 3969 ATOM 25557 O WAT 3970 105.091 63.925 94.696 1.00 0.00 O ATOM 25558 H1 WAT 3970 104.571 63.640 95.449 1.00 0.00 H ATOM 25559 H2 WAT 3970 105.999 63.796 94.970 1.00 0.00 H TER 25561 WAT 3970 ATOM 25561 O WAT 3971 58.886 22.891 110.820 1.00 0.00 O ATOM 25562 H1 WAT 3971 58.958 21.949 110.669 1.00 0.00 H ATOM 25563 H2 WAT 3971 59.183 23.012 111.722 1.00 0.00 H TER 25565 WAT 3971 ATOM 25565 O WAT 3972 15.987 4.919 89.865 1.00 0.00 O ATOM 25566 H1 WAT 3972 15.431 4.720 89.112 1.00 0.00 H ATOM 25567 H2 WAT 3972 16.837 4.540 89.642 1.00 0.00 H TER 25569 WAT 3972 ATOM 25569 O WAT 3973 121.550 79.395 82.628 1.00 0.00 O ATOM 25570 H1 WAT 3973 121.146 79.185 83.470 1.00 0.00 H ATOM 25571 H2 WAT 3973 120.891 79.915 82.169 1.00 0.00 H TER 25573 WAT 3973 ATOM 25573 O WAT 3974 46.056 15.090 118.885 1.00 0.00 O ATOM 25574 H1 WAT 3974 46.018 16.047 118.899 1.00 0.00 H ATOM 25575 H2 WAT 3974 45.574 14.819 119.666 1.00 0.00 H TER 25577 WAT 3974 ATOM 25577 O WAT 3975 129.611 15.538 70.883 1.00 0.00 O ATOM 25578 H1 WAT 3975 129.484 15.153 71.751 1.00 0.00 H ATOM 25579 H2 WAT 3975 128.933 15.135 70.341 1.00 0.00 H TER 25581 WAT 3975 ATOM 25581 O WAT 3976 57.431 142.663 4.751 1.00 0.00 O ATOM 25582 H1 WAT 3976 57.560 143.559 5.061 1.00 0.00 H ATOM 25583 H2 WAT 3976 58.095 142.152 5.214 1.00 0.00 H TER 25585 WAT 3976 ATOM 25585 O WAT 3977 102.929 122.450 83.337 1.00 0.00 O ATOM 25586 H1 WAT 3977 103.097 122.218 84.251 1.00 0.00 H ATOM 25587 H2 WAT 3977 103.784 122.380 82.911 1.00 0.00 H TER 25589 WAT 3977 ATOM 25589 O WAT 3978 124.302 53.835 126.089 1.00 0.00 O ATOM 25590 H1 WAT 3978 124.003 53.113 126.642 1.00 0.00 H ATOM 25591 H2 WAT 3978 124.387 54.576 126.689 1.00 0.00 H TER 25593 WAT 3978 ATOM 25593 O WAT 3979 124.741 58.362 5.761 1.00 0.00 O ATOM 25594 H1 WAT 3979 124.584 58.592 4.845 1.00 0.00 H ATOM 25595 H2 WAT 3979 125.066 57.462 5.729 1.00 0.00 H TER 25597 WAT 3979 ATOM 25597 O WAT 3980 10.008 2.973 18.096 1.00 0.00 O ATOM 25598 H1 WAT 3980 9.556 3.797 18.273 1.00 0.00 H ATOM 25599 H2 WAT 3980 10.904 3.122 18.398 1.00 0.00 H TER 25601 WAT 3980 ATOM 25601 O WAT 3981 105.316 121.837 82.139 1.00 0.00 O ATOM 25602 H1 WAT 3981 105.058 121.352 81.356 1.00 0.00 H ATOM 25603 H2 WAT 3981 106.217 121.559 82.308 1.00 0.00 H TER 25605 WAT 3981 ATOM 25605 O WAT 3982 72.836 122.870 2.922 1.00 0.00 O ATOM 25606 H1 WAT 3982 72.868 122.921 3.877 1.00 0.00 H ATOM 25607 H2 WAT 3982 72.586 121.964 2.739 1.00 0.00 H TER 25609 WAT 3982 ATOM 25609 O WAT 3983 94.031 65.605 84.020 1.00 0.00 O ATOM 25610 H1 WAT 3983 93.295 65.899 84.558 1.00 0.00 H ATOM 25611 H2 WAT 3983 94.150 64.686 84.260 1.00 0.00 H TER 25613 WAT 3983 ATOM 25613 O WAT 3984 46.803 107.334 119.651 1.00 0.00 O ATOM 25614 H1 WAT 3984 47.269 108.170 119.655 1.00 0.00 H ATOM 25615 H2 WAT 3984 47.491 106.676 119.551 1.00 0.00 H TER 25617 WAT 3984 ATOM 25617 O WAT 3985 31.202 139.873 6.634 1.00 0.00 O ATOM 25618 H1 WAT 3985 31.625 139.999 7.483 1.00 0.00 H ATOM 25619 H2 WAT 3985 31.087 140.759 6.290 1.00 0.00 H TER 25621 WAT 3985 ATOM 25621 O WAT 3986 44.125 30.649 12.474 1.00 0.00 O ATOM 25622 H1 WAT 3986 43.302 30.689 11.987 1.00 0.00 H ATOM 25623 H2 WAT 3986 44.490 31.531 12.401 1.00 0.00 H TER 25625 WAT 3986 ATOM 25625 O WAT 3987 33.061 14.772 97.186 1.00 0.00 O ATOM 25626 H1 WAT 3987 32.154 15.000 96.981 1.00 0.00 H ATOM 25627 H2 WAT 3987 33.544 14.962 96.381 1.00 0.00 H TER 25629 WAT 3987 ATOM 25629 O WAT 3988 3.711 35.598 127.213 1.00 0.00 O ATOM 25630 H1 WAT 3988 3.620 35.716 126.268 1.00 0.00 H ATOM 25631 H2 WAT 3988 3.406 34.705 127.373 1.00 0.00 H TER 25633 WAT 3988 ATOM 25633 O WAT 3989 87.810 48.726 70.287 1.00 0.00 O ATOM 25634 H1 WAT 3989 88.690 48.707 70.663 1.00 0.00 H ATOM 25635 H2 WAT 3989 87.872 48.176 69.505 1.00 0.00 H TER 25637 WAT 3989 ATOM 25637 O WAT 3990 62.650 49.967 124.044 1.00 0.00 O ATOM 25638 H1 WAT 3990 63.422 49.789 123.507 1.00 0.00 H ATOM 25639 H2 WAT 3990 62.028 49.280 123.805 1.00 0.00 H TER 25641 WAT 3990 ATOM 25641 O WAT 3991 65.641 44.934 90.135 1.00 0.00 O ATOM 25642 H1 WAT 3991 66.284 45.459 90.612 1.00 0.00 H ATOM 25643 H2 WAT 3991 65.125 44.509 90.820 1.00 0.00 H TER 25645 WAT 3991 ATOM 25645 O WAT 3992 71.943 85.450 63.380 1.00 0.00 O ATOM 25646 H1 WAT 3992 72.370 84.729 63.841 1.00 0.00 H ATOM 25647 H2 WAT 3992 72.623 85.806 62.808 1.00 0.00 H TER 25649 WAT 3992 ATOM 25649 O WAT 3993 47.737 70.476 142.369 1.00 0.00 O ATOM 25650 H1 WAT 3993 48.651 70.341 142.120 1.00 0.00 H ATOM 25651 H2 WAT 3993 47.749 71.272 142.900 1.00 0.00 H TER 25653 WAT 3993 ATOM 25653 O WAT 3994 143.839 120.034 119.765 1.00 0.00 O ATOM 25654 H1 WAT 3994 144.422 119.983 119.008 1.00 0.00 H ATOM 25655 H2 WAT 3994 142.965 120.131 119.387 1.00 0.00 H TER 25657 WAT 3994 ATOM 25657 O WAT 3995 94.290 22.007 140.555 1.00 0.00 O ATOM 25658 H1 WAT 3995 94.735 21.830 141.383 1.00 0.00 H ATOM 25659 H2 WAT 3995 93.412 22.291 140.810 1.00 0.00 H TER 25661 WAT 3995 ATOM 25661 O WAT 3996 8.469 140.501 128.108 1.00 0.00 O ATOM 25662 H1 WAT 3996 8.033 141.111 127.514 1.00 0.00 H ATOM 25663 H2 WAT 3996 9.370 140.820 128.161 1.00 0.00 H TER 25665 WAT 3996 ATOM 25665 O WAT 3997 123.476 20.485 128.076 1.00 0.00 O ATOM 25666 H1 WAT 3997 123.660 19.681 128.561 1.00 0.00 H ATOM 25667 H2 WAT 3997 123.223 21.118 128.748 1.00 0.00 H TER 25669 WAT 3997 ATOM 25669 O WAT 3998 113.899 118.020 17.263 1.00 0.00 O ATOM 25670 H1 WAT 3998 114.077 118.174 16.335 1.00 0.00 H ATOM 25671 H2 WAT 3998 113.613 118.871 17.596 1.00 0.00 H TER 25673 WAT 3998 ATOM 25673 O WAT 3999 106.524 23.025 155.187 1.00 0.00 O ATOM 25674 H1 WAT 3999 106.404 23.037 154.237 1.00 0.00 H ATOM 25675 H2 WAT 3999 107.470 22.940 155.308 1.00 0.00 H TER 25677 WAT 3999 ATOM 25677 O WAT 4000 112.376 122.176 93.083 1.00 0.00 O ATOM 25678 H1 WAT 4000 112.225 122.913 93.675 1.00 0.00 H ATOM 25679 H2 WAT 4000 111.527 121.736 93.028 1.00 0.00 H TER 25681 WAT 4000 ATOM 25681 O WAT 4001 7.366 28.554 123.870 1.00 0.00 O ATOM 25682 H1 WAT 4001 7.819 27.791 124.229 1.00 0.00 H ATOM 25683 H2 WAT 4001 6.903 28.932 124.618 1.00 0.00 H TER 25685 WAT 4001 ATOM 25685 O WAT 4002 21.330 10.485 69.842 1.00 0.00 O ATOM 25686 H1 WAT 4002 20.897 10.835 70.620 1.00 0.00 H ATOM 25687 H2 WAT 4002 21.980 11.149 69.610 1.00 0.00 H TER 25689 WAT 4002 ATOM 25689 O WAT 4003 53.801 26.816 81.733 1.00 0.00 O ATOM 25690 H1 WAT 4003 54.340 26.646 82.505 1.00 0.00 H ATOM 25691 H2 WAT 4003 54.260 27.518 81.271 1.00 0.00 H TER 25693 WAT 4003 ATOM 25693 O WAT 4004 122.345 96.865 128.196 1.00 0.00 O ATOM 25694 H1 WAT 4004 122.870 96.330 127.602 1.00 0.00 H ATOM 25695 H2 WAT 4004 121.765 97.364 127.621 1.00 0.00 H TER 25697 WAT 4004 ATOM 25697 O WAT 4005 66.528 137.970 143.747 1.00 0.00 O ATOM 25698 H1 WAT 4005 66.258 137.183 143.275 1.00 0.00 H ATOM 25699 H2 WAT 4005 67.480 137.994 143.647 1.00 0.00 H TER 25701 WAT 4005 ATOM 25701 O WAT 4006 29.531 34.474 135.301 1.00 0.00 O ATOM 25702 H1 WAT 4006 29.641 34.290 134.368 1.00 0.00 H ATOM 25703 H2 WAT 4006 29.169 35.360 135.330 1.00 0.00 H TER 25705 WAT 4006 ATOM 25705 O WAT 4007 39.458 91.098 144.600 1.00 0.00 O ATOM 25706 H1 WAT 4007 38.812 91.270 143.915 1.00 0.00 H ATOM 25707 H2 WAT 4007 40.288 91.017 144.131 1.00 0.00 H TER 25709 WAT 4007 ATOM 25709 O WAT 4008 10.196 111.589 76.169 1.00 0.00 O ATOM 25710 H1 WAT 4008 10.251 110.681 76.465 1.00 0.00 H ATOM 25711 H2 WAT 4008 10.123 112.100 76.976 1.00 0.00 H TER 25713 WAT 4008 ATOM 25713 O WAT 4009 16.110 31.911 78.755 1.00 0.00 O ATOM 25714 H1 WAT 4009 16.999 32.098 78.452 1.00 0.00 H ATOM 25715 H2 WAT 4009 15.917 31.040 78.410 1.00 0.00 H TER 25717 WAT 4009 ATOM 25717 O WAT 4010 13.108 107.671 148.050 1.00 0.00 O ATOM 25718 H1 WAT 4010 12.781 107.304 148.871 1.00 0.00 H ATOM 25719 H2 WAT 4010 12.755 108.560 148.027 1.00 0.00 H TER 25721 WAT 4010 ATOM 25721 O WAT 4011 74.407 133.548 1.779 1.00 0.00 O ATOM 25722 H1 WAT 4011 73.807 133.147 2.407 1.00 0.00 H ATOM 25723 H2 WAT 4011 75.011 134.059 2.317 1.00 0.00 H TER 25725 WAT 4011 ATOM 25725 O WAT 4012 70.091 42.787 139.789 1.00 0.00 O ATOM 25726 H1 WAT 4012 69.192 42.477 139.895 1.00 0.00 H ATOM 25727 H2 WAT 4012 70.044 43.420 139.073 1.00 0.00 H TER 25729 WAT 4012 ATOM 25729 O WAT 4013 25.692 82.012 58.545 1.00 0.00 O ATOM 25730 H1 WAT 4013 25.830 82.950 58.413 1.00 0.00 H ATOM 25731 H2 WAT 4013 25.461 81.680 57.677 1.00 0.00 H TER 25733 WAT 4013 ATOM 25733 O WAT 4014 80.972 126.924 142.267 1.00 0.00 O ATOM 25734 H1 WAT 4014 81.328 127.623 141.718 1.00 0.00 H ATOM 25735 H2 WAT 4014 81.729 126.584 142.743 1.00 0.00 H TER 25737 WAT 4014 ATOM 25737 O WAT 4015 144.418 87.957 62.027 1.00 0.00 O ATOM 25738 H1 WAT 4015 143.621 87.608 61.629 1.00 0.00 H ATOM 25739 H2 WAT 4015 144.731 88.612 61.404 1.00 0.00 H TER 25741 WAT 4015 ATOM 25741 O WAT 4016 38.314 80.337 94.534 1.00 0.00 O ATOM 25742 H1 WAT 4016 38.587 80.042 93.665 1.00 0.00 H ATOM 25743 H2 WAT 4016 37.647 81.001 94.363 1.00 0.00 H TER 25745 WAT 4016 ATOM 25745 O WAT 4017 52.284 101.274 117.437 1.00 0.00 O ATOM 25746 H1 WAT 4017 51.379 101.387 117.147 1.00 0.00 H ATOM 25747 H2 WAT 4017 52.686 102.133 117.309 1.00 0.00 H TER 25749 WAT 4017 ATOM 25749 O WAT 4018 21.509 19.357 73.263 1.00 0.00 O ATOM 25750 H1 WAT 4018 22.175 19.275 72.580 1.00 0.00 H ATOM 25751 H2 WAT 4018 21.328 18.456 73.531 1.00 0.00 H TER 25753 WAT 4018 ATOM 25753 O WAT 4019 112.400 53.381 95.930 1.00 0.00 O ATOM 25754 H1 WAT 4019 112.032 53.399 96.813 1.00 0.00 H ATOM 25755 H2 WAT 4019 113.207 53.891 95.996 1.00 0.00 H TER 25757 WAT 4019 ATOM 25757 O WAT 4020 32.071 94.345 145.280 1.00 0.00 O ATOM 25758 H1 WAT 4020 32.276 94.473 144.354 1.00 0.00 H ATOM 25759 H2 WAT 4020 32.864 93.957 145.650 1.00 0.00 H TER 25761 WAT 4020 ATOM 25761 O WAT 4021 141.848 10.711 106.163 1.00 0.00 O ATOM 25762 H1 WAT 4021 141.176 10.194 105.720 1.00 0.00 H ATOM 25763 H2 WAT 4021 142.676 10.377 105.816 1.00 0.00 H TER 25765 WAT 4021 ATOM 25765 O WAT 4022 67.515 101.289 90.334 1.00 0.00 O ATOM 25766 H1 WAT 4022 67.111 100.580 90.834 1.00 0.00 H ATOM 25767 H2 WAT 4022 68.185 100.858 89.804 1.00 0.00 H TER 25769 WAT 4022 ATOM 25769 O WAT 4023 49.576 76.107 84.812 1.00 0.00 O ATOM 25770 H1 WAT 4023 48.993 75.489 85.252 1.00 0.00 H ATOM 25771 H2 WAT 4023 49.007 76.836 84.562 1.00 0.00 H TER 25773 WAT 4023 ATOM 25773 O WAT 4024 121.554 45.442 63.965 1.00 0.00 O ATOM 25774 H1 WAT 4024 120.607 45.568 64.035 1.00 0.00 H ATOM 25775 H2 WAT 4024 121.687 45.124 63.072 1.00 0.00 H TER 25777 WAT 4024 ATOM 25777 O WAT 4025 129.057 31.629 127.608 1.00 0.00 O ATOM 25778 H1 WAT 4025 128.858 32.525 127.881 1.00 0.00 H ATOM 25779 H2 WAT 4025 128.522 31.080 128.181 1.00 0.00 H TER 25781 WAT 4025 ATOM 25781 O WAT 4026 47.905 97.789 100.772 1.00 0.00 O ATOM 25782 H1 WAT 4026 47.104 98.293 100.629 1.00 0.00 H ATOM 25783 H2 WAT 4026 48.315 98.200 101.533 1.00 0.00 H TER 25785 WAT 4026 ATOM 25785 O WAT 4027 16.615 3.304 128.486 1.00 0.00 O ATOM 25786 H1 WAT 4027 16.389 2.727 127.757 1.00 0.00 H ATOM 25787 H2 WAT 4027 16.760 4.159 128.080 1.00 0.00 H TER 25789 WAT 4027 ATOM 25789 O WAT 4028 59.186 139.066 66.798 1.00 0.00 O ATOM 25790 H1 WAT 4028 58.831 138.515 66.100 1.00 0.00 H ATOM 25791 H2 WAT 4028 59.015 139.962 66.507 1.00 0.00 H TER 25793 WAT 4028 ATOM 25793 O WAT 4029 127.460 79.447 0.316 1.00 0.00 O ATOM 25794 H1 WAT 4029 127.570 79.927 1.137 1.00 0.00 H ATOM 25795 H2 WAT 4029 126.599 79.715 -0.005 1.00 0.00 H TER 25797 WAT 4029 ATOM 25797 O WAT 4030 71.235 76.544 122.040 1.00 0.00 O ATOM 25798 H1 WAT 4030 71.341 77.462 122.289 1.00 0.00 H ATOM 25799 H2 WAT 4030 70.380 76.510 121.610 1.00 0.00 H TER 25801 WAT 4030 ATOM 25801 O WAT 4031 60.844 82.527 141.413 1.00 0.00 O ATOM 25802 H1 WAT 4031 61.294 82.823 140.621 1.00 0.00 H ATOM 25803 H2 WAT 4031 61.239 83.039 142.118 1.00 0.00 H TER 25805 WAT 4031 ATOM 25805 O WAT 4032 18.732 80.697 158.285 1.00 0.00 O ATOM 25806 H1 WAT 4032 18.050 80.236 157.798 1.00 0.00 H ATOM 25807 H2 WAT 4032 19.326 81.028 157.611 1.00 0.00 H TER 25809 WAT 4032 ATOM 25809 O WAT 4033 28.868 123.380 63.049 1.00 0.00 O ATOM 25810 H1 WAT 4033 29.231 124.266 63.053 1.00 0.00 H ATOM 25811 H2 WAT 4033 28.587 123.240 62.145 1.00 0.00 H TER 25813 WAT 4033 ATOM 25813 O WAT 4034 111.382 51.354 151.346 1.00 0.00 O ATOM 25814 H1 WAT 4034 110.580 51.714 151.725 1.00 0.00 H ATOM 25815 H2 WAT 4034 111.455 51.781 150.492 1.00 0.00 H TER 25817 WAT 4034 ATOM 25817 O WAT 4035 27.119 86.891 149.239 1.00 0.00 O ATOM 25818 H1 WAT 4035 27.414 86.080 148.825 1.00 0.00 H ATOM 25819 H2 WAT 4035 26.832 87.441 148.511 1.00 0.00 H TER 25821 WAT 4035 ATOM 25821 O WAT 4036 94.679 123.126 85.176 1.00 0.00 O ATOM 25822 H1 WAT 4036 94.457 123.701 84.443 1.00 0.00 H ATOM 25823 H2 WAT 4036 93.987 122.465 85.180 1.00 0.00 H TER 25825 WAT 4036 ATOM 25825 O WAT 4037 62.357 67.288 12.678 1.00 0.00 O ATOM 25826 H1 WAT 4037 62.225 66.454 13.129 1.00 0.00 H ATOM 25827 H2 WAT 4037 63.237 67.223 12.308 1.00 0.00 H TER 25829 WAT 4037 ATOM 25829 O WAT 4038 109.242 122.728 17.640 1.00 0.00 O ATOM 25830 H1 WAT 4038 108.659 122.143 17.157 1.00 0.00 H ATOM 25831 H2 WAT 4038 108.799 122.871 18.477 1.00 0.00 H TER 25833 WAT 4038 ATOM 25833 O WAT 4039 127.251 12.567 122.414 1.00 0.00 O ATOM 25834 H1 WAT 4039 126.778 13.086 123.065 1.00 0.00 H ATOM 25835 H2 WAT 4039 128.155 12.875 122.473 1.00 0.00 H TER 25837 WAT 4039 ATOM 25837 O WAT 4040 50.428 81.592 137.463 1.00 0.00 O ATOM 25838 H1 WAT 4040 49.578 81.288 137.144 1.00 0.00 H ATOM 25839 H2 WAT 4040 50.467 82.512 137.200 1.00 0.00 H TER 25841 WAT 4040 ATOM 25841 O WAT 4041 44.206 65.706 20.400 1.00 0.00 O ATOM 25842 H1 WAT 4041 44.896 65.695 21.064 1.00 0.00 H ATOM 25843 H2 WAT 4041 44.341 66.528 19.928 1.00 0.00 H TER 25845 WAT 4041 ATOM 25845 O WAT 4042 123.819 135.012 124.588 1.00 0.00 O ATOM 25846 H1 WAT 4042 123.461 134.204 124.957 1.00 0.00 H ATOM 25847 H2 WAT 4042 124.565 135.222 125.150 1.00 0.00 H TER 25849 WAT 4042 ATOM 25849 O WAT 4043 126.897 131.173 142.270 1.00 0.00 O ATOM 25850 H1 WAT 4043 125.946 131.262 142.217 1.00 0.00 H ATOM 25851 H2 WAT 4043 127.044 130.621 143.038 1.00 0.00 H TER 25853 WAT 4043 ATOM 25853 O WAT 4044 72.727 52.731 19.171 1.00 0.00 O ATOM 25854 H1 WAT 4044 72.199 52.272 19.824 1.00 0.00 H ATOM 25855 H2 WAT 4044 73.239 53.362 19.678 1.00 0.00 H TER 25857 WAT 4044 ATOM 25857 O WAT 4045 99.280 19.108 113.965 1.00 0.00 O ATOM 25858 H1 WAT 4045 99.873 19.856 114.038 1.00 0.00 H ATOM 25859 H2 WAT 4045 99.040 18.903 114.869 1.00 0.00 H TER 25861 WAT 4045 ATOM 25861 O WAT 4046 54.182 80.624 118.381 1.00 0.00 O ATOM 25862 H1 WAT 4046 54.766 81.296 118.031 1.00 0.00 H ATOM 25863 H2 WAT 4046 54.071 80.004 117.660 1.00 0.00 H TER 25865 WAT 4046 ATOM 25865 O WAT 4047 108.412 34.529 53.182 1.00 0.00 O ATOM 25866 H1 WAT 4047 108.283 35.248 52.564 1.00 0.00 H ATOM 25867 H2 WAT 4047 109.048 33.956 52.754 1.00 0.00 H TER 25869 WAT 4047 ATOM 25869 O WAT 4048 21.120 6.214 0.200 1.00 0.00 O ATOM 25870 H1 WAT 4048 20.522 5.979 -0.509 1.00 0.00 H ATOM 25871 H2 WAT 4048 21.354 5.379 0.603 1.00 0.00 H TER 25873 WAT 4048 ATOM 25873 O WAT 4049 73.224 116.143 117.219 1.00 0.00 O ATOM 25874 H1 WAT 4049 72.666 116.681 116.658 1.00 0.00 H ATOM 25875 H2 WAT 4049 73.996 116.686 117.379 1.00 0.00 H TER 25877 WAT 4049 ATOM 25877 O WAT 4050 20.937 66.279 142.661 1.00 0.00 O ATOM 25878 H1 WAT 4050 20.278 66.805 142.207 1.00 0.00 H ATOM 25879 H2 WAT 4050 21.667 66.882 142.805 1.00 0.00 H TER 25881 WAT 4050 ATOM 25881 O WAT 4051 137.876 34.665 102.194 1.00 0.00 O ATOM 25882 H1 WAT 4051 137.937 35.072 103.058 1.00 0.00 H ATOM 25883 H2 WAT 4051 138.416 35.219 101.630 1.00 0.00 H TER 25885 WAT 4051 ATOM 25885 O WAT 4052 90.609 134.337 155.524 1.00 0.00 O ATOM 25886 H1 WAT 4052 91.128 134.435 156.323 1.00 0.00 H ATOM 25887 H2 WAT 4052 89.701 134.331 155.828 1.00 0.00 H TER 25889 WAT 4052 ATOM 25889 O WAT 4053 38.792 114.876 77.698 1.00 0.00 O ATOM 25890 H1 WAT 4053 39.083 114.014 77.400 1.00 0.00 H ATOM 25891 H2 WAT 4053 39.369 115.082 78.434 1.00 0.00 H TER 25893 WAT 4053 ATOM 25893 O WAT 4054 57.783 81.685 149.174 1.00 0.00 O ATOM 25894 H1 WAT 4054 57.485 81.009 149.783 1.00 0.00 H ATOM 25895 H2 WAT 4054 58.414 81.239 148.609 1.00 0.00 H TER 25897 WAT 4054 ATOM 25897 O WAT 4055 56.793 36.859 135.538 1.00 0.00 O ATOM 25898 H1 WAT 4055 56.350 36.175 135.036 1.00 0.00 H ATOM 25899 H2 WAT 4055 56.209 37.615 135.481 1.00 0.00 H TER 25901 WAT 4055 ATOM 25901 O WAT 4056 24.051 132.912 8.118 1.00 0.00 O ATOM 25902 H1 WAT 4056 24.148 131.982 8.321 1.00 0.00 H ATOM 25903 H2 WAT 4056 23.437 133.238 8.776 1.00 0.00 H TER 25905 WAT 4056 ATOM 25905 O WAT 4057 111.628 108.797 1.548 1.00 0.00 O ATOM 25906 H1 WAT 4057 112.116 108.008 1.785 1.00 0.00 H ATOM 25907 H2 WAT 4057 111.657 108.819 0.592 1.00 0.00 H TER 25909 WAT 4057 ATOM 25909 O WAT 4058 87.284 3.056 62.436 1.00 0.00 O ATOM 25910 H1 WAT 4058 88.105 2.601 62.622 1.00 0.00 H ATOM 25911 H2 WAT 4058 86.998 2.701 61.594 1.00 0.00 H TER 25913 WAT 4058 ATOM 25913 O WAT 4059 2.334 52.523 138.941 1.00 0.00 O ATOM 25914 H1 WAT 4059 2.074 51.602 138.972 1.00 0.00 H ATOM 25915 H2 WAT 4059 2.311 52.747 138.011 1.00 0.00 H TER 25917 WAT 4059 ATOM 25917 O WAT 4060 38.815 15.207 139.044 1.00 0.00 O ATOM 25918 H1 WAT 4060 39.485 14.762 138.525 1.00 0.00 H ATOM 25919 H2 WAT 4060 38.075 14.600 139.051 1.00 0.00 H TER 25921 WAT 4060 ATOM 25921 O WAT 4061 141.751 142.357 137.020 1.00 0.00 O ATOM 25922 H1 WAT 4061 141.365 141.919 136.261 1.00 0.00 H ATOM 25923 H2 WAT 4061 141.701 143.289 136.809 1.00 0.00 H TER 25925 WAT 4061 ATOM 25925 O WAT 4062 92.743 37.111 148.133 1.00 0.00 O ATOM 25926 H1 WAT 4062 92.253 37.930 148.208 1.00 0.00 H ATOM 25927 H2 WAT 4062 92.443 36.584 148.873 1.00 0.00 H TER 25929 WAT 4062 ATOM 25929 O WAT 4063 95.673 123.413 130.629 1.00 0.00 O ATOM 25930 H1 WAT 4063 96.081 123.103 131.437 1.00 0.00 H ATOM 25931 H2 WAT 4063 95.783 122.689 130.012 1.00 0.00 H TER 25933 WAT 4063 ATOM 25933 O WAT 4064 37.438 110.641 25.055 1.00 0.00 O ATOM 25934 H1 WAT 4064 37.608 111.150 24.263 1.00 0.00 H ATOM 25935 H2 WAT 4064 36.492 110.494 25.047 1.00 0.00 H TER 25937 WAT 4064 ATOM 25937 O WAT 4065 27.611 12.527 91.063 1.00 0.00 O ATOM 25938 H1 WAT 4065 27.661 11.919 90.326 1.00 0.00 H ATOM 25939 H2 WAT 4065 28.320 12.255 91.646 1.00 0.00 H TER 25941 WAT 4065 ATOM 25941 O WAT 4066 44.649 9.241 145.678 1.00 0.00 O ATOM 25942 H1 WAT 4066 44.365 9.819 146.386 1.00 0.00 H ATOM 25943 H2 WAT 4066 43.865 9.109 145.146 1.00 0.00 H TER 25945 WAT 4066 ATOM 25945 O WAT 4067 144.379 108.216 72.070 1.00 0.00 O ATOM 25946 H1 WAT 4067 145.266 108.572 72.109 1.00 0.00 H ATOM 25947 H2 WAT 4067 144.129 108.296 71.149 1.00 0.00 H TER 25949 WAT 4067 ATOM 25949 O WAT 4068 66.556 71.368 66.438 1.00 0.00 O ATOM 25950 H1 WAT 4068 67.226 71.806 65.915 1.00 0.00 H ATOM 25951 H2 WAT 4068 66.142 72.073 66.936 1.00 0.00 H TER 25953 WAT 4068 ATOM 25953 O WAT 4069 141.505 29.040 1.999 1.00 0.00 O ATOM 25954 H1 WAT 4069 141.999 28.220 2.025 1.00 0.00 H ATOM 25955 H2 WAT 4069 142.041 29.626 1.465 1.00 0.00 H TER 25957 WAT 4069 ATOM 25957 O WAT 4070 7.615 126.283 123.208 1.00 0.00 O ATOM 25958 H1 WAT 4070 7.459 125.609 122.547 1.00 0.00 H ATOM 25959 H2 WAT 4070 7.421 125.851 124.040 1.00 0.00 H TER 25961 WAT 4070 ATOM 25961 O WAT 4071 6.007 91.196 26.196 1.00 0.00 O ATOM 25962 H1 WAT 4071 6.472 90.509 25.720 1.00 0.00 H ATOM 25963 H2 WAT 4071 5.088 91.070 25.960 1.00 0.00 H TER 25965 WAT 4071 ATOM 25965 O WAT 4072 2.992 64.099 112.662 1.00 0.00 O ATOM 25966 H1 WAT 4072 3.747 63.768 112.176 1.00 0.00 H ATOM 25967 H2 WAT 4072 3.368 64.483 113.454 1.00 0.00 H TER 25969 WAT 4072 ATOM 25969 O WAT 4073 10.444 87.229 140.658 1.00 0.00 O ATOM 25970 H1 WAT 4073 10.680 88.147 140.791 1.00 0.00 H ATOM 25971 H2 WAT 4073 10.919 86.758 141.343 1.00 0.00 H TER 25973 WAT 4073 ATOM 25973 O WAT 4074 23.495 70.608 128.064 1.00 0.00 O ATOM 25974 H1 WAT 4074 23.509 70.749 127.117 1.00 0.00 H ATOM 25975 H2 WAT 4074 22.666 70.992 128.350 1.00 0.00 H TER 25977 WAT 4074 ATOM 25977 O WAT 4075 83.233 78.107 105.521 1.00 0.00 O ATOM 25978 H1 WAT 4075 83.361 77.159 105.472 1.00 0.00 H ATOM 25979 H2 WAT 4075 83.017 78.272 106.439 1.00 0.00 H TER 25981 WAT 4075 ATOM 25981 O WAT 4076 3.397 48.820 13.081 1.00 0.00 O ATOM 25982 H1 WAT 4076 3.896 48.045 13.341 1.00 0.00 H ATOM 25983 H2 WAT 4076 4.062 49.490 12.923 1.00 0.00 H TER 25985 WAT 4076 ATOM 25985 O WAT 4077 120.336 68.893 110.594 1.00 0.00 O ATOM 25986 H1 WAT 4077 120.241 69.580 111.254 1.00 0.00 H ATOM 25987 H2 WAT 4077 120.942 69.261 109.951 1.00 0.00 H TER 25989 WAT 4077 ATOM 25989 O WAT 4078 9.473 6.091 142.065 1.00 0.00 O ATOM 25990 H1 WAT 4078 10.120 5.623 142.592 1.00 0.00 H ATOM 25991 H2 WAT 4078 9.017 6.655 142.689 1.00 0.00 H TER 25993 WAT 4078 ATOM 25993 O WAT 4079 9.313 97.981 144.818 1.00 0.00 O ATOM 25994 H1 WAT 4079 9.863 97.263 144.506 1.00 0.00 H ATOM 25995 H2 WAT 4079 8.635 98.071 144.150 1.00 0.00 H TER 25997 WAT 4079 ATOM 25997 O WAT 4080 126.429 58.481 10.118 1.00 0.00 O ATOM 25998 H1 WAT 4080 125.486 58.322 10.174 1.00 0.00 H ATOM 25999 H2 WAT 4080 126.775 58.163 10.952 1.00 0.00 H TER 26001 WAT 4080 ATOM 26001 O WAT 4081 7.021 133.228 133.571 1.00 0.00 O ATOM 26002 H1 WAT 4081 6.825 133.781 132.815 1.00 0.00 H ATOM 26003 H2 WAT 4081 6.163 132.960 133.900 1.00 0.00 H TER 26005 WAT 4081 ATOM 26005 O WAT 4082 12.192 129.358 150.142 1.00 0.00 O ATOM 26006 H1 WAT 4082 12.673 129.763 150.864 1.00 0.00 H ATOM 26007 H2 WAT 4082 12.212 130.013 149.444 1.00 0.00 H TER 26009 WAT 4082 ATOM 26009 O WAT 4083 94.189 84.503 119.299 1.00 0.00 O ATOM 26010 H1 WAT 4083 95.116 84.428 119.526 1.00 0.00 H ATOM 26011 H2 WAT 4083 94.077 83.918 118.550 1.00 0.00 H TER 26013 WAT 4083 ATOM 26013 O WAT 4084 21.528 43.201 70.045 1.00 0.00 O ATOM 26014 H1 WAT 4084 22.481 43.283 69.996 1.00 0.00 H ATOM 26015 H2 WAT 4084 21.220 44.092 70.208 1.00 0.00 H TER 26017 WAT 4084 ATOM 26017 O WAT 4085 80.511 62.663 1.332 1.00 0.00 O ATOM 26018 H1 WAT 4085 80.894 63.132 2.073 1.00 0.00 H ATOM 26019 H2 WAT 4085 80.626 63.254 0.588 1.00 0.00 H TER 26021 WAT 4085 ATOM 26021 O WAT 4086 12.587 139.363 64.272 1.00 0.00 O ATOM 26022 H1 WAT 4086 11.817 139.230 64.825 1.00 0.00 H ATOM 26023 H2 WAT 4086 13.145 138.607 64.452 1.00 0.00 H TER 26025 WAT 4086 ATOM 26025 O WAT 4087 14.584 121.388 63.597 1.00 0.00 O ATOM 26026 H1 WAT 4087 15.169 120.632 63.647 1.00 0.00 H ATOM 26027 H2 WAT 4087 14.464 121.537 62.659 1.00 0.00 H TER 26029 WAT 4087 ATOM 26029 O WAT 4088 54.319 6.352 108.242 1.00 0.00 O ATOM 26030 H1 WAT 4088 54.627 7.241 108.067 1.00 0.00 H ATOM 26031 H2 WAT 4088 53.628 6.206 107.595 1.00 0.00 H TER 26033 WAT 4088 ATOM 26033 O WAT 4089 42.206 1.754 8.321 1.00 0.00 O ATOM 26034 H1 WAT 4089 42.956 1.405 8.804 1.00 0.00 H ATOM 26035 H2 WAT 4089 41.853 2.438 8.890 1.00 0.00 H TER 26037 WAT 4089 ATOM 26037 O WAT 4090 135.093 90.581 131.296 1.00 0.00 O ATOM 26038 H1 WAT 4090 134.165 90.349 131.314 1.00 0.00 H ATOM 26039 H2 WAT 4090 135.169 91.209 130.577 1.00 0.00 H TER 26041 WAT 4090 ATOM 26041 O WAT 4091 67.002 86.658 144.522 1.00 0.00 O ATOM 26042 H1 WAT 4091 66.306 86.908 145.129 1.00 0.00 H ATOM 26043 H2 WAT 4091 66.766 85.775 144.238 1.00 0.00 H TER 26045 WAT 4091 ATOM 26045 O WAT 4092 23.022 85.333 90.078 1.00 0.00 O ATOM 26046 H1 WAT 4092 22.336 84.763 90.425 1.00 0.00 H ATOM 26047 H2 WAT 4092 23.182 85.004 89.193 1.00 0.00 H TER 26049 WAT 4092 ATOM 26049 O WAT 4093 63.091 7.913 84.932 1.00 0.00 O ATOM 26050 H1 WAT 4093 62.608 7.523 84.204 1.00 0.00 H ATOM 26051 H2 WAT 4093 62.588 8.696 85.161 1.00 0.00 H TER 26053 WAT 4093 ATOM 26053 O WAT 4094 7.333 136.672 118.994 1.00 0.00 O ATOM 26054 H1 WAT 4094 7.962 137.297 119.355 1.00 0.00 H ATOM 26055 H2 WAT 4094 6.478 137.075 119.152 1.00 0.00 H TER 26057 WAT 4094 ATOM 26057 O WAT 4095 50.301 65.232 27.065 1.00 0.00 O ATOM 26058 H1 WAT 4095 50.434 65.766 26.282 1.00 0.00 H ATOM 26059 H2 WAT 4095 49.350 65.174 27.157 1.00 0.00 H TER 26061 WAT 4095 ATOM 26061 O WAT 4096 111.721 123.380 148.837 1.00 0.00 O ATOM 26062 H1 WAT 4096 111.782 123.261 147.890 1.00 0.00 H ATOM 26063 H2 WAT 4096 112.616 123.581 149.112 1.00 0.00 H TER 26065 WAT 4096 ATOM 26065 O WAT 4097 33.901 121.473 98.544 1.00 0.00 O ATOM 26066 H1 WAT 4097 33.158 121.177 98.019 1.00 0.00 H ATOM 26067 H2 WAT 4097 33.503 121.887 99.310 1.00 0.00 H TER 26069 WAT 4097 ATOM 26069 O WAT 4098 56.758 119.915 148.074 1.00 0.00 O ATOM 26070 H1 WAT 4098 57.581 120.297 148.378 1.00 0.00 H ATOM 26071 H2 WAT 4098 56.559 120.388 147.265 1.00 0.00 H TER 26073 WAT 4098 ATOM 26073 O WAT 4099 59.623 92.114 106.233 1.00 0.00 O ATOM 26074 H1 WAT 4099 60.286 91.539 105.850 1.00 0.00 H ATOM 26075 H2 WAT 4099 59.395 92.720 105.528 1.00 0.00 H TER 26077 WAT 4099 ATOM 26077 O WAT 4100 137.800 123.330 90.926 1.00 0.00 O ATOM 26078 H1 WAT 4100 136.906 123.380 91.262 1.00 0.00 H ATOM 26079 H2 WAT 4100 137.848 122.474 90.498 1.00 0.00 H TER 26081 WAT 4100 ATOM 26081 O WAT 4101 110.212 61.929 147.229 1.00 0.00 O ATOM 26082 H1 WAT 4101 110.999 61.531 146.856 1.00 0.00 H ATOM 26083 H2 WAT 4101 110.483 62.815 147.470 1.00 0.00 H TER 26085 WAT 4101 ATOM 26085 O WAT 4102 121.382 126.778 60.305 1.00 0.00 O ATOM 26086 H1 WAT 4102 121.437 126.175 61.046 1.00 0.00 H ATOM 26087 H2 WAT 4102 122.266 127.136 60.222 1.00 0.00 H TER 26089 WAT 4102 ATOM 26089 O WAT 4103 50.316 8.014 120.410 1.00 0.00 O ATOM 26090 H1 WAT 4103 50.258 7.534 119.584 1.00 0.00 H ATOM 26091 H2 WAT 4103 50.728 8.846 120.175 1.00 0.00 H TER 26093 WAT 4103 ATOM 26093 O WAT 4104 47.381 81.536 9.323 1.00 0.00 O ATOM 26094 H1 WAT 4104 47.237 81.682 10.258 1.00 0.00 H ATOM 26095 H2 WAT 4104 47.179 82.379 8.915 1.00 0.00 H TER 26097 WAT 4104 ATOM 26097 O WAT 4105 65.417 144.031 69.788 1.00 0.00 O ATOM 26098 H1 WAT 4105 64.598 144.415 69.477 1.00 0.00 H ATOM 26099 H2 WAT 4105 66.056 144.246 69.109 1.00 0.00 H TER 26101 WAT 4105 ATOM 26101 O WAT 4106 89.390 140.709 90.182 1.00 0.00 O ATOM 26102 H1 WAT 4106 89.777 139.953 90.623 1.00 0.00 H ATOM 26103 H2 WAT 4106 89.711 141.464 90.675 1.00 0.00 H TER 26105 WAT 4106 ATOM 26105 O WAT 4107 21.164 106.061 78.418 1.00 0.00 O ATOM 26106 H1 WAT 4107 21.249 106.169 79.366 1.00 0.00 H ATOM 26107 H2 WAT 4107 20.326 105.613 78.302 1.00 0.00 H TER 26109 WAT 4107 ATOM 26109 O WAT 4108 108.827 81.350 103.623 1.00 0.00 O ATOM 26110 H1 WAT 4108 109.672 81.245 103.186 1.00 0.00 H ATOM 26111 H2 WAT 4108 108.527 82.220 103.358 1.00 0.00 H TER 26113 WAT 4108 ATOM 26113 O WAT 4109 89.410 121.781 72.169 1.00 0.00 O ATOM 26114 H1 WAT 4109 90.309 122.104 72.234 1.00 0.00 H ATOM 26115 H2 WAT 4109 89.488 120.949 71.702 1.00 0.00 H TER 26117 WAT 4109 ATOM 26117 O WAT 4110 138.178 64.916 86.815 1.00 0.00 O ATOM 26118 H1 WAT 4110 138.036 64.520 87.675 1.00 0.00 H ATOM 26119 H2 WAT 4110 137.699 64.350 86.209 1.00 0.00 H TER 26121 WAT 4110 ATOM 26121 O WAT 4111 76.178 10.327 62.871 1.00 0.00 O ATOM 26122 H1 WAT 4111 76.913 10.102 62.301 1.00 0.00 H ATOM 26123 H2 WAT 4111 75.436 10.431 62.276 1.00 0.00 H TER 26125 WAT 4111 ATOM 26125 O WAT 4112 106.347 130.556 133.063 1.00 0.00 O ATOM 26126 H1 WAT 4112 106.452 129.758 132.545 1.00 0.00 H ATOM 26127 H2 WAT 4112 106.690 131.253 132.504 1.00 0.00 H TER 26129 WAT 4112 ATOM 26129 O WAT 4113 131.752 117.601 91.882 1.00 0.00 O ATOM 26130 H1 WAT 4113 132.018 118.194 92.584 1.00 0.00 H ATOM 26131 H2 WAT 4113 132.541 117.485 91.354 1.00 0.00 H TER 26133 WAT 4113 ATOM 26133 O WAT 4114 113.307 47.831 118.561 1.00 0.00 O ATOM 26134 H1 WAT 4114 112.481 48.220 118.273 1.00 0.00 H ATOM 26135 H2 WAT 4114 113.045 47.097 119.117 1.00 0.00 H TER 26137 WAT 4114 ATOM 26137 O WAT 4115 34.748 129.250 137.342 1.00 0.00 O ATOM 26138 H1 WAT 4115 35.061 128.938 136.493 1.00 0.00 H ATOM 26139 H2 WAT 4115 34.400 128.467 137.770 1.00 0.00 H TER 26141 WAT 4115 ATOM 26141 O WAT 4116 12.740 47.279 126.938 1.00 0.00 O ATOM 26142 H1 WAT 4116 12.313 46.644 126.363 1.00 0.00 H ATOM 26143 H2 WAT 4116 12.405 48.128 126.648 1.00 0.00 H TER 26145 WAT 4116 ATOM 26145 O WAT 4117 10.999 59.469 149.550 1.00 0.00 O ATOM 26146 H1 WAT 4117 10.420 59.687 150.280 1.00 0.00 H ATOM 26147 H2 WAT 4117 11.805 59.954 149.730 1.00 0.00 H TER 26149 WAT 4117 ATOM 26149 O WAT 4118 39.683 57.304 28.594 1.00 0.00 O ATOM 26150 H1 WAT 4118 39.591 56.804 27.783 1.00 0.00 H ATOM 26151 H2 WAT 4118 39.673 56.643 29.286 1.00 0.00 H TER 26153 WAT 4118 ATOM 26153 O WAT 4119 69.886 57.900 144.813 1.00 0.00 O ATOM 26154 H1 WAT 4119 68.953 57.866 144.603 1.00 0.00 H ATOM 26155 H2 WAT 4119 69.915 58.158 145.734 1.00 0.00 H TER 26157 WAT 4119 ATOM 26157 O WAT 4120 16.332 43.935 111.723 1.00 0.00 O ATOM 26158 H1 WAT 4120 16.551 43.914 112.655 1.00 0.00 H ATOM 26159 H2 WAT 4120 16.266 44.867 111.514 1.00 0.00 H TER 26161 WAT 4120 ATOM 26161 O WAT 4121 104.446 60.266 124.102 1.00 0.00 O ATOM 26162 H1 WAT 4121 103.808 59.626 123.787 1.00 0.00 H ATOM 26163 H2 WAT 4121 103.916 60.964 124.487 1.00 0.00 H TER 26165 WAT 4121 ATOM 26165 O WAT 4122 78.949 36.380 157.991 1.00 0.00 O ATOM 26166 H1 WAT 4122 79.312 37.052 158.568 1.00 0.00 H ATOM 26167 H2 WAT 4122 78.276 35.950 158.518 1.00 0.00 H TER 26169 WAT 4122 ATOM 26169 O WAT 4123 25.264 21.355 130.076 1.00 0.00 O ATOM 26170 H1 WAT 4123 25.543 21.363 130.992 1.00 0.00 H ATOM 26171 H2 WAT 4123 24.456 20.842 130.077 1.00 0.00 H TER 26173 WAT 4123 ATOM 26173 O WAT 4124 31.755 64.838 145.102 1.00 0.00 O ATOM 26174 H1 WAT 4124 31.283 65.648 145.296 1.00 0.00 H ATOM 26175 H2 WAT 4124 32.635 65.127 144.858 1.00 0.00 H TER 26177 WAT 4124 ATOM 26177 O WAT 4125 62.295 134.575 95.377 1.00 0.00 O ATOM 26178 H1 WAT 4125 61.696 133.848 95.544 1.00 0.00 H ATOM 26179 H2 WAT 4125 61.868 135.334 95.774 1.00 0.00 H TER 26181 WAT 4125 ATOM 26181 O WAT 4126 36.578 117.668 64.496 1.00 0.00 O ATOM 26182 H1 WAT 4126 36.220 118.554 64.436 1.00 0.00 H ATOM 26183 H2 WAT 4126 37.076 117.556 63.686 1.00 0.00 H TER 26185 WAT 4126 ATOM 26185 O WAT 4127 19.861 56.763 152.698 1.00 0.00 O ATOM 26186 H1 WAT 4127 19.993 56.466 151.798 1.00 0.00 H ATOM 26187 H2 WAT 4127 20.743 56.799 153.070 1.00 0.00 H TER 26189 WAT 4127 ATOM 26189 O WAT 4128 35.353 77.746 8.449 1.00 0.00 O ATOM 26190 H1 WAT 4128 35.631 77.144 7.759 1.00 0.00 H ATOM 26191 H2 WAT 4128 36.052 77.704 9.101 1.00 0.00 H TER 26193 WAT 4128 ATOM 26193 O WAT 4129 139.158 126.555 146.939 1.00 0.00 O ATOM 26194 H1 WAT 4129 139.283 127.380 147.407 1.00 0.00 H ATOM 26195 H2 WAT 4129 138.623 126.789 146.180 1.00 0.00 H TER 26197 WAT 4129 ATOM 26197 O WAT 4130 0.381 91.144 131.127 1.00 0.00 O ATOM 26198 H1 WAT 4130 1.305 91.053 131.360 1.00 0.00 H ATOM 26199 H2 WAT 4130 -0.090 90.734 131.853 1.00 0.00 H TER 26201 WAT 4130 ATOM 26201 O WAT 4131 79.063 9.438 109.536 1.00 0.00 O ATOM 26202 H1 WAT 4131 79.951 9.507 109.888 1.00 0.00 H ATOM 26203 H2 WAT 4131 78.497 9.456 110.307 1.00 0.00 H TER 26205 WAT 4131 ATOM 26205 O WAT 4132 58.763 130.228 144.814 1.00 0.00 O ATOM 26206 H1 WAT 4132 57.908 130.315 145.236 1.00 0.00 H ATOM 26207 H2 WAT 4132 59.249 131.004 145.094 1.00 0.00 H TER 26209 WAT 4132 ATOM 26209 O WAT 4133 49.270 11.039 154.387 1.00 0.00 O ATOM 26210 H1 WAT 4133 49.205 11.976 154.204 1.00 0.00 H ATOM 26211 H2 WAT 4133 49.083 10.964 155.322 1.00 0.00 H TER 26213 WAT 4133 ATOM 26213 O WAT 4134 5.004 15.517 69.165 1.00 0.00 O ATOM 26214 H1 WAT 4134 4.586 16.365 69.312 1.00 0.00 H ATOM 26215 H2 WAT 4134 5.510 15.635 68.361 1.00 0.00 H TER 26217 WAT 4134 ATOM 26217 O WAT 4135 88.146 118.456 99.970 1.00 0.00 O ATOM 26218 H1 WAT 4135 88.889 117.854 99.929 1.00 0.00 H ATOM 26219 H2 WAT 4135 87.378 117.886 100.012 1.00 0.00 H TER 26221 WAT 4135 ATOM 26221 O WAT 4136 106.643 54.443 142.106 1.00 0.00 O ATOM 26222 H1 WAT 4136 105.766 54.061 142.134 1.00 0.00 H ATOM 26223 H2 WAT 4136 107.225 53.726 142.359 1.00 0.00 H TER 26225 WAT 4136 ATOM 26225 O WAT 4137 132.424 61.874 157.179 1.00 0.00 O ATOM 26226 H1 WAT 4137 133.129 62.477 156.946 1.00 0.00 H ATOM 26227 H2 WAT 4137 132.416 61.872 158.136 1.00 0.00 H TER 26229 WAT 4137 ATOM 26229 O WAT 4138 28.811 60.919 93.849 1.00 0.00 O ATOM 26230 H1 WAT 4138 29.522 60.841 93.213 1.00 0.00 H ATOM 26231 H2 WAT 4138 28.479 61.809 93.729 1.00 0.00 H TER 26233 WAT 4138 ATOM 26233 O WAT 4139 35.356 94.388 121.096 1.00 0.00 O ATOM 26234 H1 WAT 4139 34.863 95.154 120.802 1.00 0.00 H ATOM 26235 H2 WAT 4139 34.708 93.844 121.544 1.00 0.00 H TER 26237 WAT 4139 ATOM 26237 O WAT 4140 64.307 6.176 131.793 1.00 0.00 O ATOM 26238 H1 WAT 4140 64.273 6.413 132.720 1.00 0.00 H ATOM 26239 H2 WAT 4140 63.725 5.420 131.718 1.00 0.00 H TER 26241 WAT 4140 ATOM 26241 O WAT 4141 15.185 63.824 143.801 1.00 0.00 O ATOM 26242 H1 WAT 4141 14.588 64.364 144.320 1.00 0.00 H ATOM 26243 H2 WAT 4141 14.889 63.940 142.898 1.00 0.00 H TER 26245 WAT 4141 ATOM 26245 O WAT 4142 66.546 132.942 121.593 1.00 0.00 O ATOM 26246 H1 WAT 4142 65.637 133.159 121.800 1.00 0.00 H ATOM 26247 H2 WAT 4142 66.774 132.249 122.212 1.00 0.00 H TER 26249 WAT 4142 ATOM 26249 O WAT 4143 57.320 132.004 156.895 1.00 0.00 O ATOM 26250 H1 WAT 4143 56.808 132.230 157.672 1.00 0.00 H ATOM 26251 H2 WAT 4143 57.970 131.376 157.210 1.00 0.00 H TER 26253 WAT 4143 ATOM 26253 O WAT 4144 131.080 69.354 57.679 1.00 0.00 O ATOM 26254 H1 WAT 4144 131.980 69.324 58.003 1.00 0.00 H ATOM 26255 H2 WAT 4144 130.814 70.267 57.792 1.00 0.00 H TER 26257 WAT 4144 ATOM 26257 O WAT 4145 23.980 1.814 137.467 1.00 0.00 O ATOM 26258 H1 WAT 4145 23.827 2.056 138.380 1.00 0.00 H ATOM 26259 H2 WAT 4145 24.185 0.880 137.497 1.00 0.00 H TER 26261 WAT 4145 ATOM 26261 O WAT 4146 97.608 10.178 14.677 1.00 0.00 O ATOM 26262 H1 WAT 4146 98.124 10.848 15.126 1.00 0.00 H ATOM 26263 H2 WAT 4146 96.757 10.590 14.530 1.00 0.00 H TER 26265 WAT 4146 ATOM 26265 O WAT 4147 91.219 102.306 90.132 1.00 0.00 O ATOM 26266 H1 WAT 4147 90.352 102.697 90.026 1.00 0.00 H ATOM 26267 H2 WAT 4147 91.287 101.675 89.415 1.00 0.00 H TER 26269 WAT 4147 ATOM 26269 O WAT 4148 105.135 9.943 113.304 1.00 0.00 O ATOM 26270 H1 WAT 4148 105.044 9.652 112.397 1.00 0.00 H ATOM 26271 H2 WAT 4148 104.904 9.175 113.826 1.00 0.00 H TER 26273 WAT 4148 ATOM 26273 O WAT 4149 127.676 59.489 132.565 1.00 0.00 O ATOM 26274 H1 WAT 4149 127.376 58.732 133.068 1.00 0.00 H ATOM 26275 H2 WAT 4149 128.570 59.264 132.305 1.00 0.00 H TER 26277 WAT 4149 ATOM 26277 O WAT 4150 95.263 108.869 137.289 1.00 0.00 O ATOM 26278 H1 WAT 4150 94.517 108.279 137.179 1.00 0.00 H ATOM 26279 H2 WAT 4150 95.971 108.454 136.796 1.00 0.00 H TER 26281 WAT 4150 ATOM 26281 O WAT 4151 101.846 48.349 75.135 1.00 0.00 O ATOM 26282 H1 WAT 4151 102.141 47.465 74.914 1.00 0.00 H ATOM 26283 H2 WAT 4151 101.815 48.359 76.091 1.00 0.00 H TER 26285 WAT 4151 ATOM 26285 O WAT 4152 107.537 27.805 64.543 1.00 0.00 O ATOM 26286 H1 WAT 4152 108.044 27.344 63.875 1.00 0.00 H ATOM 26287 H2 WAT 4152 106.669 27.402 64.507 1.00 0.00 H TER 26289 WAT 4152 ATOM 26289 O WAT 4153 137.425 33.205 72.058 1.00 0.00 O ATOM 26290 H1 WAT 4153 136.833 32.900 72.746 1.00 0.00 H ATOM 26291 H2 WAT 4153 137.350 32.547 71.368 1.00 0.00 H TER 26293 WAT 4153 ATOM 26293 O WAT 4154 126.840 139.458 76.896 1.00 0.00 O ATOM 26294 H1 WAT 4154 125.942 139.734 76.717 1.00 0.00 H ATOM 26295 H2 WAT 4154 126.783 138.978 77.723 1.00 0.00 H TER 26297 WAT 4154 ATOM 26297 O WAT 4155 67.015 104.597 111.297 1.00 0.00 O ATOM 26298 H1 WAT 4155 67.568 105.266 110.895 1.00 0.00 H ATOM 26299 H2 WAT 4155 66.495 105.073 111.944 1.00 0.00 H TER 26301 WAT 4155 ATOM 26301 O WAT 4156 50.057 112.454 121.294 1.00 0.00 O ATOM 26302 H1 WAT 4156 49.495 113.173 121.583 1.00 0.00 H ATOM 26303 H2 WAT 4156 50.195 112.618 120.361 1.00 0.00 H TER 26305 WAT 4156 ATOM 26305 O WAT 4157 20.995 74.797 77.595 1.00 0.00 O ATOM 26306 H1 WAT 4157 21.660 74.990 78.256 1.00 0.00 H ATOM 26307 H2 WAT 4157 20.715 73.902 77.791 1.00 0.00 H TER 26309 WAT 4157 ATOM 26309 O WAT 4158 135.157 23.079 62.131 1.00 0.00 O ATOM 26310 H1 WAT 4158 135.789 23.374 61.476 1.00 0.00 H ATOM 26311 H2 WAT 4158 135.265 23.689 62.861 1.00 0.00 H TER 26313 WAT 4158 ATOM 26313 O WAT 4159 9.330 52.553 133.265 1.00 0.00 O ATOM 26314 H1 WAT 4159 9.571 51.874 133.895 1.00 0.00 H ATOM 26315 H2 WAT 4159 9.832 53.321 133.538 1.00 0.00 H TER 26317 WAT 4159 ATOM 26317 O WAT 4160 123.581 121.170 68.014 1.00 0.00 O ATOM 26318 H1 WAT 4160 123.541 120.223 68.149 1.00 0.00 H ATOM 26319 H2 WAT 4160 123.259 121.299 67.122 1.00 0.00 H TER 26321 WAT 4160 ATOM 26321 O WAT 4161 119.191 17.391 69.288 1.00 0.00 O ATOM 26322 H1 WAT 4161 118.263 17.261 69.486 1.00 0.00 H ATOM 26323 H2 WAT 4161 119.289 17.082 68.388 1.00 0.00 H TER 26325 WAT 4161 ATOM 26325 O WAT 4162 133.503 50.967 5.943 1.00 0.00 O ATOM 26326 H1 WAT 4162 134.060 51.733 6.081 1.00 0.00 H ATOM 26327 H2 WAT 4162 132.637 51.244 6.239 1.00 0.00 H TER 26329 WAT 4162 ATOM 26329 O WAT 4163 82.160 70.625 153.355 1.00 0.00 O ATOM 26330 H1 WAT 4163 81.834 69.784 153.677 1.00 0.00 H ATOM 26331 H2 WAT 4163 81.615 71.277 153.796 1.00 0.00 H TER 26333 WAT 4163 ATOM 26333 O WAT 4164 36.708 102.695 0.341 1.00 0.00 O ATOM 26334 H1 WAT 4164 36.092 103.421 0.247 1.00 0.00 H ATOM 26335 H2 WAT 4164 36.871 102.401 -0.556 1.00 0.00 H TER 26337 WAT 4164 ATOM 26337 O WAT 4165 84.921 131.694 128.157 1.00 0.00 O ATOM 26338 H1 WAT 4165 85.276 131.499 129.025 1.00 0.00 H ATOM 26339 H2 WAT 4165 84.124 132.194 128.331 1.00 0.00 H TER 26341 WAT 4165 ATOM 26341 O WAT 4166 20.370 13.908 147.833 1.00 0.00 O ATOM 26342 H1 WAT 4166 19.491 14.235 148.024 1.00 0.00 H ATOM 26343 H2 WAT 4166 20.223 13.094 147.352 1.00 0.00 H TER 26345 WAT 4166 ATOM 26345 O WAT 4167 130.183 125.695 135.764 1.00 0.00 O ATOM 26346 H1 WAT 4167 130.268 124.747 135.863 1.00 0.00 H ATOM 26347 H2 WAT 4167 130.238 125.844 134.820 1.00 0.00 H TER 26349 WAT 4167 ATOM 26349 O WAT 4168 123.430 14.255 63.975 1.00 0.00 O ATOM 26350 H1 WAT 4168 124.236 14.767 64.034 1.00 0.00 H ATOM 26351 H2 WAT 4168 123.066 14.479 63.118 1.00 0.00 H TER 26353 WAT 4168 ATOM 26353 O WAT 4169 138.351 30.157 84.979 1.00 0.00 O ATOM 26354 H1 WAT 4169 139.045 30.814 85.033 1.00 0.00 H ATOM 26355 H2 WAT 4169 137.587 30.641 84.666 1.00 0.00 H TER 26357 WAT 4169 ATOM 26357 O WAT 4170 117.980 47.749 72.303 1.00 0.00 O ATOM 26358 H1 WAT 4170 118.547 47.050 72.628 1.00 0.00 H ATOM 26359 H2 WAT 4170 117.578 48.116 73.090 1.00 0.00 H TER 26361 WAT 4170 ATOM 26361 O WAT 4171 49.718 20.911 115.665 1.00 0.00 O ATOM 26362 H1 WAT 4171 49.781 21.178 114.748 1.00 0.00 H ATOM 26363 H2 WAT 4171 50.171 20.069 115.701 1.00 0.00 H TER 26365 WAT 4171 ATOM 26365 O WAT 4172 56.413 12.199 136.031 1.00 0.00 O ATOM 26366 H1 WAT 4172 56.015 12.686 136.752 1.00 0.00 H ATOM 26367 H2 WAT 4172 57.249 11.892 136.382 1.00 0.00 H TER 26369 WAT 4172 ATOM 26369 O WAT 4173 53.156 12.796 134.051 1.00 0.00 O ATOM 26370 H1 WAT 4173 52.533 13.302 133.529 1.00 0.00 H ATOM 26371 H2 WAT 4173 53.650 12.288 133.408 1.00 0.00 H TER 26373 WAT 4173 ATOM 26373 O WAT 4174 10.110 145.246 132.679 1.00 0.00 O ATOM 26374 H1 WAT 4174 10.757 145.911 132.442 1.00 0.00 H ATOM 26375 H2 WAT 4174 9.449 145.299 131.989 1.00 0.00 H TER 26377 WAT 4174 ATOM 26377 O WAT 4175 137.617 98.303 74.268 1.00 0.00 O ATOM 26378 H1 WAT 4175 137.776 98.367 75.210 1.00 0.00 H ATOM 26379 H2 WAT 4175 137.315 99.176 74.016 1.00 0.00 H TER 26381 WAT 4175 ATOM 26381 O WAT 4176 100.610 103.143 65.341 1.00 0.00 O ATOM 26382 H1 WAT 4176 101.018 102.765 64.562 1.00 0.00 H ATOM 26383 H2 WAT 4176 101.269 103.745 65.687 1.00 0.00 H TER 26385 WAT 4176 ATOM 26385 O WAT 4177 78.301 42.580 146.465 1.00 0.00 O ATOM 26386 H1 WAT 4177 79.239 42.628 146.278 1.00 0.00 H ATOM 26387 H2 WAT 4177 78.170 41.696 146.809 1.00 0.00 H TER 26389 WAT 4177 ATOM 26389 O WAT 4178 132.958 35.910 148.767 1.00 0.00 O ATOM 26390 H1 WAT 4178 132.175 35.406 148.988 1.00 0.00 H ATOM 26391 H2 WAT 4178 133.455 35.951 149.584 1.00 0.00 H TER 26393 WAT 4178 ATOM 26393 O WAT 4179 89.654 52.970 72.325 1.00 0.00 O ATOM 26394 H1 WAT 4179 89.851 53.783 72.792 1.00 0.00 H ATOM 26395 H2 WAT 4179 89.291 53.258 71.488 1.00 0.00 H TER 26397 WAT 4179 ATOM 26397 O WAT 4180 111.481 60.022 152.566 1.00 0.00 O ATOM 26398 H1 WAT 4180 112.281 59.497 152.576 1.00 0.00 H ATOM 26399 H2 WAT 4180 111.192 60.002 151.654 1.00 0.00 H TER 26401 WAT 4180 ATOM 26401 O WAT 4181 60.494 70.580 63.235 1.00 0.00 O ATOM 26402 H1 WAT 4181 61.438 70.561 63.079 1.00 0.00 H ATOM 26403 H2 WAT 4181 60.158 69.814 62.770 1.00 0.00 H TER 26405 WAT 4181 ATOM 26405 O WAT 4182 68.931 96.823 138.572 1.00 0.00 O ATOM 26406 H1 WAT 4182 68.480 96.742 139.412 1.00 0.00 H ATOM 26407 H2 WAT 4182 68.610 97.646 138.205 1.00 0.00 H TER 26409 WAT 4182 ATOM 26409 O WAT 4183 88.092 41.195 123.660 1.00 0.00 O ATOM 26410 H1 WAT 4183 88.954 40.997 124.025 1.00 0.00 H ATOM 26411 H2 WAT 4183 87.500 41.163 124.412 1.00 0.00 H TER 26413 WAT 4183 ATOM 26413 O WAT 4184 15.122 56.618 3.315 1.00 0.00 O ATOM 26414 H1 WAT 4184 14.219 56.830 3.553 1.00 0.00 H ATOM 26415 H2 WAT 4184 15.387 55.953 3.950 1.00 0.00 H TER 26417 WAT 4184 ATOM 26417 O WAT 4185 82.366 14.684 87.815 1.00 0.00 O ATOM 26418 H1 WAT 4185 82.592 15.071 86.969 1.00 0.00 H ATOM 26419 H2 WAT 4185 81.997 15.409 88.319 1.00 0.00 H TER 26421 WAT 4185 ATOM 26421 O WAT 4186 76.357 48.568 141.617 1.00 0.00 O ATOM 26422 H1 WAT 4186 77.065 48.807 141.020 1.00 0.00 H ATOM 26423 H2 WAT 4186 76.376 49.244 142.294 1.00 0.00 H TER 26425 WAT 4186 ATOM 26425 O WAT 4187 53.008 110.812 10.094 1.00 0.00 O ATOM 26426 H1 WAT 4187 52.749 110.155 10.740 1.00 0.00 H ATOM 26427 H2 WAT 4187 52.994 111.640 10.575 1.00 0.00 H TER 26429 WAT 4187 ATOM 26429 O WAT 4188 144.433 51.758 154.278 1.00 0.00 O ATOM 26430 H1 WAT 4188 144.997 51.808 155.050 1.00 0.00 H ATOM 26431 H2 WAT 4188 143.745 51.140 154.524 1.00 0.00 H TER 26433 WAT 4188 ATOM 26433 O WAT 4189 107.661 118.236 9.311 1.00 0.00 O ATOM 26434 H1 WAT 4189 108.191 117.628 8.795 1.00 0.00 H ATOM 26435 H2 WAT 4189 108.209 118.449 10.067 1.00 0.00 H TER 26437 WAT 4189 ATOM 26437 O WAT 4190 91.126 25.130 119.452 1.00 0.00 O ATOM 26438 H1 WAT 4190 90.198 25.074 119.226 1.00 0.00 H ATOM 26439 H2 WAT 4190 91.339 26.059 119.362 1.00 0.00 H TER 26441 WAT 4190 ATOM 26441 O WAT 4191 62.185 96.106 60.416 1.00 0.00 O ATOM 26442 H1 WAT 4191 61.736 95.957 61.248 1.00 0.00 H ATOM 26443 H2 WAT 4191 63.052 96.425 60.665 1.00 0.00 H TER 26445 WAT 4191 ATOM 26445 O WAT 4192 33.853 98.032 65.756 1.00 0.00 O ATOM 26446 H1 WAT 4192 34.208 97.637 64.960 1.00 0.00 H ATOM 26447 H2 WAT 4192 33.107 98.550 65.454 1.00 0.00 H TER 26449 WAT 4192 ATOM 26449 O WAT 4193 7.798 119.360 18.779 1.00 0.00 O ATOM 26450 H1 WAT 4193 8.417 119.861 18.247 1.00 0.00 H ATOM 26451 H2 WAT 4193 8.204 119.321 19.645 1.00 0.00 H TER 26453 WAT 4193 ATOM 26453 O WAT 4194 140.739 135.168 154.740 1.00 0.00 O ATOM 26454 H1 WAT 4194 141.145 135.697 154.053 1.00 0.00 H ATOM 26455 H2 WAT 4194 140.037 135.721 155.085 1.00 0.00 H TER 26457 WAT 4194 ATOM 26457 O WAT 4195 56.330 144.983 152.191 1.00 0.00 O ATOM 26458 H1 WAT 4195 56.838 145.330 152.924 1.00 0.00 H ATOM 26459 H2 WAT 4195 56.655 145.461 151.427 1.00 0.00 H TER 26461 WAT 4195 ATOM 26461 O WAT 4196 12.852 66.468 113.128 1.00 0.00 O ATOM 26462 H1 WAT 4196 13.292 65.665 113.408 1.00 0.00 H ATOM 26463 H2 WAT 4196 11.976 66.406 113.509 1.00 0.00 H TER 26465 WAT 4196 ATOM 26465 O WAT 4197 23.869 78.627 131.492 1.00 0.00 O ATOM 26466 H1 WAT 4197 24.659 78.184 131.802 1.00 0.00 H ATOM 26467 H2 WAT 4197 23.542 78.069 130.787 1.00 0.00 H TER 26469 WAT 4197 ATOM 26469 O WAT 4198 19.412 61.154 19.462 1.00 0.00 O ATOM 26470 H1 WAT 4198 18.542 60.764 19.377 1.00 0.00 H ATOM 26471 H2 WAT 4198 19.855 60.611 20.114 1.00 0.00 H TER 26473 WAT 4198 ATOM 26473 O WAT 4199 101.736 107.324 76.247 1.00 0.00 O ATOM 26474 H1 WAT 4199 102.486 106.736 76.154 1.00 0.00 H ATOM 26475 H2 WAT 4199 102.002 107.945 76.925 1.00 0.00 H TER 26477 WAT 4199 ATOM 26477 O WAT 4200 76.316 127.145 79.795 1.00 0.00 O ATOM 26478 H1 WAT 4200 75.829 127.057 78.975 1.00 0.00 H ATOM 26479 H2 WAT 4200 76.165 126.318 80.253 1.00 0.00 H TER 26481 WAT 4200 ATOM 26481 O WAT 4201 2.952 88.727 115.016 1.00 0.00 O ATOM 26482 H1 WAT 4201 3.865 88.486 115.168 1.00 0.00 H ATOM 26483 H2 WAT 4201 2.695 88.222 114.245 1.00 0.00 H TER 26485 WAT 4201 ATOM 26485 O WAT 4202 129.007 15.962 84.774 1.00 0.00 O ATOM 26486 H1 WAT 4202 129.852 16.333 85.031 1.00 0.00 H ATOM 26487 H2 WAT 4202 128.817 16.365 83.927 1.00 0.00 H TER 26489 WAT 4202 ATOM 26489 O WAT 4203 6.259 132.614 146.944 1.00 0.00 O ATOM 26490 H1 WAT 4203 6.053 133.141 146.172 1.00 0.00 H ATOM 26491 H2 WAT 4203 6.845 133.167 147.461 1.00 0.00 H TER 26493 WAT 4203 ATOM 26493 O WAT 4204 122.264 31.095 98.956 1.00 0.00 O ATOM 26494 H1 WAT 4204 123.054 31.418 98.523 1.00 0.00 H ATOM 26495 H2 WAT 4204 122.237 31.568 99.788 1.00 0.00 H TER 26497 WAT 4204 ATOM 26497 O WAT 4205 41.354 93.025 145.746 1.00 0.00 O ATOM 26498 H1 WAT 4205 41.372 92.658 146.630 1.00 0.00 H ATOM 26499 H2 WAT 4205 40.510 92.751 145.389 1.00 0.00 H TER 26501 WAT 4205 ATOM 26501 O WAT 4206 96.810 128.359 72.078 1.00 0.00 O ATOM 26502 H1 WAT 4206 96.862 129.197 71.618 1.00 0.00 H ATOM 26503 H2 WAT 4206 97.338 127.762 71.548 1.00 0.00 H TER 26505 WAT 4206 ATOM 26505 O WAT 4207 99.171 126.407 110.345 1.00 0.00 O ATOM 26506 H1 WAT 4207 100.068 126.385 110.011 1.00 0.00 H ATOM 26507 H2 WAT 4207 98.848 127.277 110.109 1.00 0.00 H TER 26509 WAT 4207 ATOM 26509 O WAT 4208 59.407 37.817 156.344 1.00 0.00 O ATOM 26510 H1 WAT 4208 59.309 38.000 157.278 1.00 0.00 H ATOM 26511 H2 WAT 4208 59.906 38.561 156.006 1.00 0.00 H TER 26513 WAT 4208 ATOM 26513 O WAT 4209 48.103 80.369 103.157 1.00 0.00 O ATOM 26514 H1 WAT 4209 48.175 80.771 102.291 1.00 0.00 H ATOM 26515 H2 WAT 4209 47.294 80.728 103.521 1.00 0.00 H TER 26517 WAT 4209 ATOM 26517 O WAT 4210 86.211 14.029 112.266 1.00 0.00 O ATOM 26518 H1 WAT 4210 85.805 13.219 112.572 1.00 0.00 H ATOM 26519 H2 WAT 4210 85.486 14.651 112.201 1.00 0.00 H TER 26521 WAT 4210 ATOM 26521 O WAT 4211 35.162 65.599 108.894 1.00 0.00 O ATOM 26522 H1 WAT 4211 34.567 66.236 109.291 1.00 0.00 H ATOM 26523 H2 WAT 4211 34.664 65.228 108.166 1.00 0.00 H TER 26525 WAT 4211 ATOM 26525 O WAT 4212 89.919 49.530 86.885 1.00 0.00 O ATOM 26526 H1 WAT 4212 90.753 49.418 86.428 1.00 0.00 H ATOM 26527 H2 WAT 4212 89.816 50.478 86.966 1.00 0.00 H TER 26529 WAT 4212 ATOM 26529 O WAT 4213 91.217 95.082 94.116 1.00 0.00 O ATOM 26530 H1 WAT 4213 91.364 95.028 93.172 1.00 0.00 H ATOM 26531 H2 WAT 4213 90.397 94.610 94.259 1.00 0.00 H TER 26533 WAT 4213 ATOM 26533 O WAT 4214 85.974 65.841 61.020 1.00 0.00 O ATOM 26534 H1 WAT 4214 85.699 65.074 61.523 1.00 0.00 H ATOM 26535 H2 WAT 4214 86.355 65.479 60.220 1.00 0.00 H TER 26537 WAT 4214 ATOM 26537 O WAT 4215 138.462 77.778 81.389 1.00 0.00 O ATOM 26538 H1 WAT 4215 139.270 77.977 80.915 1.00 0.00 H ATOM 26539 H2 WAT 4215 137.908 78.545 81.248 1.00 0.00 H TER 26541 WAT 4215 ATOM 26541 O WAT 4216 119.281 31.260 25.192 1.00 0.00 O ATOM 26542 H1 WAT 4216 120.096 31.393 25.676 1.00 0.00 H ATOM 26543 H2 WAT 4216 119.014 32.140 24.925 1.00 0.00 H TER 26545 WAT 4216 ATOM 26545 O WAT 4217 36.060 61.818 107.928 1.00 0.00 O ATOM 26546 H1 WAT 4217 36.220 61.720 108.866 1.00 0.00 H ATOM 26547 H2 WAT 4217 36.449 62.664 107.706 1.00 0.00 H TER 26549 WAT 4217 ATOM 26549 O WAT 4218 129.066 89.464 144.573 1.00 0.00 O ATOM 26550 H1 WAT 4218 128.553 90.241 144.798 1.00 0.00 H ATOM 26551 H2 WAT 4218 129.087 89.459 143.616 1.00 0.00 H TER 26553 WAT 4218 ATOM 26553 O WAT 4219 4.422 5.876 96.377 1.00 0.00 O ATOM 26554 H1 WAT 4219 4.059 5.609 97.221 1.00 0.00 H ATOM 26555 H2 WAT 4219 5.108 6.505 96.599 1.00 0.00 H TER 26557 WAT 4219 ATOM 26557 O WAT 4220 77.237 73.903 85.937 1.00 0.00 O ATOM 26558 H1 WAT 4220 77.808 73.593 86.640 1.00 0.00 H ATOM 26559 H2 WAT 4220 76.386 74.027 86.356 1.00 0.00 H TER 26561 WAT 4220 ATOM 26561 O WAT 4221 32.849 119.826 154.767 1.00 0.00 O ATOM 26562 H1 WAT 4221 32.779 120.738 154.484 1.00 0.00 H ATOM 26563 H2 WAT 4221 32.542 119.319 154.016 1.00 0.00 H TER 26565 WAT 4221 ATOM 26565 O WAT 4222 106.194 58.197 152.904 1.00 0.00 O ATOM 26566 H1 WAT 4222 106.576 58.723 153.606 1.00 0.00 H ATOM 26567 H2 WAT 4222 105.598 57.597 153.351 1.00 0.00 H TER 26569 WAT 4222 ATOM 26569 O WAT 4223 40.759 19.136 20.692 1.00 0.00 O ATOM 26570 H1 WAT 4223 40.245 18.369 20.946 1.00 0.00 H ATOM 26571 H2 WAT 4223 40.897 19.613 21.511 1.00 0.00 H TER 26573 WAT 4223 ATOM 26573 O WAT 4224 52.340 131.615 142.688 1.00 0.00 O ATOM 26574 H1 WAT 4224 53.013 130.978 142.930 1.00 0.00 H ATOM 26575 H2 WAT 4224 51.738 131.126 142.127 1.00 0.00 H TER 26577 WAT 4224 ATOM 26577 O WAT 4225 24.389 105.825 140.824 1.00 0.00 O ATOM 26578 H1 WAT 4225 24.333 106.459 140.108 1.00 0.00 H ATOM 26579 H2 WAT 4225 24.638 106.347 141.586 1.00 0.00 H TER 26581 WAT 4225 ATOM 26581 O WAT 4226 31.301 106.619 125.235 1.00 0.00 O ATOM 26582 H1 WAT 4226 30.569 107.077 124.822 1.00 0.00 H ATOM 26583 H2 WAT 4226 31.803 107.310 125.667 1.00 0.00 H TER 26585 WAT 4226 ATOM 26585 O WAT 4227 131.455 34.602 126.361 1.00 0.00 O ATOM 26586 H1 WAT 4227 131.468 33.652 126.248 1.00 0.00 H ATOM 26587 H2 WAT 4227 130.754 34.759 126.994 1.00 0.00 H TER 26589 WAT 4227 ATOM 26589 O WAT 4228 42.977 92.057 70.088 1.00 0.00 O ATOM 26590 H1 WAT 4228 42.647 92.788 69.566 1.00 0.00 H ATOM 26591 H2 WAT 4228 42.756 91.279 69.578 1.00 0.00 H TER 26593 WAT 4228 ATOM 26593 O WAT 4229 83.745 56.925 66.048 1.00 0.00 O ATOM 26594 H1 WAT 4229 83.435 57.774 66.362 1.00 0.00 H ATOM 26595 H2 WAT 4229 83.693 56.988 65.095 1.00 0.00 H TER 26597 WAT 4229 ATOM 26597 O WAT 4230 139.917 11.886 65.224 1.00 0.00 O ATOM 26598 H1 WAT 4230 140.454 11.187 65.597 1.00 0.00 H ATOM 26599 H2 WAT 4230 140.496 12.648 65.206 1.00 0.00 H TER 26601 WAT 4230 ATOM 26601 O WAT 4231 139.426 98.237 3.131 1.00 0.00 O ATOM 26602 H1 WAT 4231 139.905 98.675 2.428 1.00 0.00 H ATOM 26603 H2 WAT 4231 139.960 98.384 3.912 1.00 0.00 H TER 26605 WAT 4231 ATOM 26605 O WAT 4232 73.495 64.080 9.037 1.00 0.00 O ATOM 26606 H1 WAT 4232 73.746 64.758 9.664 1.00 0.00 H ATOM 26607 H2 WAT 4232 73.525 63.266 9.540 1.00 0.00 H TER 26609 WAT 4232 ATOM 26609 O WAT 4233 120.651 40.189 121.845 1.00 0.00 O ATOM 26610 H1 WAT 4233 119.810 39.762 121.684 1.00 0.00 H ATOM 26611 H2 WAT 4233 121.248 39.788 121.212 1.00 0.00 H TER 26613 WAT 4233 ATOM 26613 O WAT 4234 128.125 50.739 92.560 1.00 0.00 O ATOM 26614 H1 WAT 4234 128.826 50.355 92.033 1.00 0.00 H ATOM 26615 H2 WAT 4234 128.065 51.644 92.256 1.00 0.00 H TER 26617 WAT 4234 ATOM 26617 O WAT 4235 69.112 142.989 83.435 1.00 0.00 O ATOM 26618 H1 WAT 4235 69.077 142.045 83.584 1.00 0.00 H ATOM 26619 H2 WAT 4235 68.885 143.094 82.511 1.00 0.00 H TER 26621 WAT 4235 ATOM 26621 O WAT 4236 131.597 26.167 127.854 1.00 0.00 O ATOM 26622 H1 WAT 4236 131.367 27.060 127.597 1.00 0.00 H ATOM 26623 H2 WAT 4236 132.136 25.842 127.133 1.00 0.00 H TER 26625 WAT 4236 ATOM 26625 O WAT 4237 61.466 35.910 123.178 1.00 0.00 O ATOM 26626 H1 WAT 4237 62.302 36.352 123.330 1.00 0.00 H ATOM 26627 H2 WAT 4237 61.674 34.978 123.234 1.00 0.00 H TER 26629 WAT 4237 ATOM 26629 O WAT 4238 118.253 33.052 123.176 1.00 0.00 O ATOM 26630 H1 WAT 4238 119.039 32.584 123.455 1.00 0.00 H ATOM 26631 H2 WAT 4238 118.524 33.530 122.392 1.00 0.00 H TER 26633 WAT 4238 ATOM 26633 O WAT 4239 59.401 64.311 115.890 1.00 0.00 O ATOM 26634 H1 WAT 4239 59.944 63.614 116.258 1.00 0.00 H ATOM 26635 H2 WAT 4239 58.748 63.851 115.361 1.00 0.00 H TER 26637 WAT 4239 ATOM 26637 O WAT 4240 86.371 56.986 67.424 1.00 0.00 O ATOM 26638 H1 WAT 4240 86.314 56.538 68.268 1.00 0.00 H ATOM 26639 H2 WAT 4240 85.521 56.831 67.013 1.00 0.00 H TER 26641 WAT 4240 ATOM 26641 O WAT 4241 3.575 38.105 66.008 1.00 0.00 O ATOM 26642 H1 WAT 4241 2.969 38.779 65.701 1.00 0.00 H ATOM 26643 H2 WAT 4241 3.100 37.655 66.706 1.00 0.00 H TER 26645 WAT 4241 ATOM 26645 O WAT 4242 62.181 28.341 126.156 1.00 0.00 O ATOM 26646 H1 WAT 4242 61.401 28.593 125.662 1.00 0.00 H ATOM 26647 H2 WAT 4242 62.740 27.902 125.514 1.00 0.00 H TER 26649 WAT 4242 ATOM 26649 O WAT 4243 130.025 39.107 111.504 1.00 0.00 O ATOM 26650 H1 WAT 4243 129.612 39.970 111.483 1.00 0.00 H ATOM 26651 H2 WAT 4243 130.787 39.219 112.071 1.00 0.00 H TER 26653 WAT 4243 ATOM 26653 O WAT 4244 144.695 33.706 100.216 1.00 0.00 O ATOM 26654 H1 WAT 4244 144.917 33.714 101.147 1.00 0.00 H ATOM 26655 H2 WAT 4244 145.380 34.229 99.801 1.00 0.00 H TER 26657 WAT 4244 ATOM 26657 O WAT 4245 7.368 59.360 64.502 1.00 0.00 O ATOM 26658 H1 WAT 4245 6.495 58.979 64.411 1.00 0.00 H ATOM 26659 H2 WAT 4245 7.207 60.281 64.709 1.00 0.00 H TER 26661 WAT 4245 ATOM 26661 O WAT 4246 76.908 3.686 147.947 1.00 0.00 O ATOM 26662 H1 WAT 4246 77.366 3.603 148.784 1.00 0.00 H ATOM 26663 H2 WAT 4246 75.980 3.691 148.182 1.00 0.00 H TER 26665 WAT 4246 ATOM 26665 O WAT 4247 66.603 66.525 2.579 1.00 0.00 O ATOM 26666 H1 WAT 4247 66.582 67.459 2.786 1.00 0.00 H ATOM 26667 H2 WAT 4247 65.910 66.408 1.930 1.00 0.00 H TER 26669 WAT 4247 ATOM 26669 O WAT 4248 0.499 82.342 121.546 1.00 0.00 O ATOM 26670 H1 WAT 4248 1.248 82.935 121.603 1.00 0.00 H ATOM 26671 H2 WAT 4248 -0.227 82.837 121.927 1.00 0.00 H TER 26673 WAT 4248 ATOM 26673 O WAT 4249 75.194 41.038 12.578 1.00 0.00 O ATOM 26674 H1 WAT 4249 74.483 41.372 13.126 1.00 0.00 H ATOM 26675 H2 WAT 4249 74.753 40.665 11.815 1.00 0.00 H TER 26677 WAT 4249 ATOM 26677 O WAT 4250 13.185 46.391 79.389 1.00 0.00 O ATOM 26678 H1 WAT 4250 13.541 46.257 78.511 1.00 0.00 H ATOM 26679 H2 WAT 4250 12.810 45.543 79.628 1.00 0.00 H TER 26681 WAT 4250 ATOM 26681 O WAT 4251 33.003 137.543 78.076 1.00 0.00 O ATOM 26682 H1 WAT 4251 32.258 137.955 77.638 1.00 0.00 H ATOM 26683 H2 WAT 4251 33.486 137.110 77.372 1.00 0.00 H TER 26685 WAT 4251 ATOM 26685 O WAT 4252 87.310 118.485 82.623 1.00 0.00 O ATOM 26686 H1 WAT 4252 86.829 118.159 83.384 1.00 0.00 H ATOM 26687 H2 WAT 4252 88.199 118.152 82.741 1.00 0.00 H TER 26689 WAT 4252 ATOM 26689 O WAT 4253 57.717 19.304 153.516 1.00 0.00 O ATOM 26690 H1 WAT 4253 57.468 19.748 152.705 1.00 0.00 H ATOM 26691 H2 WAT 4253 58.313 18.609 153.234 1.00 0.00 H TER 26693 WAT 4253 ATOM 26693 O WAT 4254 6.559 30.039 126.117 1.00 0.00 O ATOM 26694 H1 WAT 4254 5.778 30.414 125.710 1.00 0.00 H ATOM 26695 H2 WAT 4254 7.243 30.691 125.968 1.00 0.00 H TER 26697 WAT 4254 ATOM 26697 O WAT 4255 30.575 144.280 153.654 1.00 0.00 O ATOM 26698 H1 WAT 4255 29.909 143.986 153.032 1.00 0.00 H ATOM 26699 H2 WAT 4255 30.443 143.727 154.424 1.00 0.00 H TER 26701 WAT 4255 ATOM 26701 O WAT 4256 69.811 112.066 136.097 1.00 0.00 O ATOM 26702 H1 WAT 4256 68.901 111.788 135.991 1.00 0.00 H ATOM 26703 H2 WAT 4256 70.291 111.256 136.267 1.00 0.00 H TER 26705 WAT 4256 ATOM 26705 O WAT 4257 94.304 125.288 100.925 1.00 0.00 O ATOM 26706 H1 WAT 4257 93.534 124.906 100.506 1.00 0.00 H ATOM 26707 H2 WAT 4257 95.030 125.064 100.343 1.00 0.00 H TER 26709 WAT 4257 ATOM 26709 O WAT 4258 59.100 108.668 61.989 1.00 0.00 O ATOM 26710 H1 WAT 4258 58.852 109.593 61.980 1.00 0.00 H ATOM 26711 H2 WAT 4258 59.964 108.648 61.578 1.00 0.00 H TER 26713 WAT 4258 ATOM 26713 O WAT 4259 26.865 4.765 11.862 1.00 0.00 O ATOM 26714 H1 WAT 4259 26.844 5.719 11.787 1.00 0.00 H ATOM 26715 H2 WAT 4259 26.471 4.583 12.715 1.00 0.00 H TER 26717 WAT 4259 ATOM 26717 O WAT 4260 28.797 9.461 67.838 1.00 0.00 O ATOM 26718 H1 WAT 4260 28.758 10.336 68.225 1.00 0.00 H ATOM 26719 H2 WAT 4260 29.448 8.996 68.364 1.00 0.00 H TER 26721 WAT 4260 ATOM 26721 O WAT 4261 90.866 110.415 137.509 1.00 0.00 O ATOM 26722 H1 WAT 4261 90.187 111.014 137.817 1.00 0.00 H ATOM 26723 H2 WAT 4261 90.384 109.695 137.101 1.00 0.00 H TER 26725 WAT 4261 ATOM 26725 O WAT 4262 9.062 116.291 145.073 1.00 0.00 O ATOM 26726 H1 WAT 4262 8.628 116.388 145.921 1.00 0.00 H ATOM 26727 H2 WAT 4262 8.946 117.140 144.647 1.00 0.00 H TER 26729 WAT 4262 ATOM 26729 O WAT 4263 77.841 84.409 138.488 1.00 0.00 O ATOM 26730 H1 WAT 4263 77.478 84.002 137.702 1.00 0.00 H ATOM 26731 H2 WAT 4263 77.075 84.676 138.997 1.00 0.00 H TER 26733 WAT 4263 ATOM 26733 O WAT 4264 116.910 119.989 92.275 1.00 0.00 O ATOM 26734 H1 WAT 4264 116.194 120.616 92.371 1.00 0.00 H ATOM 26735 H2 WAT 4264 117.622 120.357 92.798 1.00 0.00 H TER 26737 WAT 4264 ATOM 26737 O WAT 4265 126.399 55.419 100.673 1.00 0.00 O ATOM 26738 H1 WAT 4265 126.155 55.905 99.885 1.00 0.00 H ATOM 26739 H2 WAT 4265 125.712 55.630 101.306 1.00 0.00 H TER 26741 WAT 4265 ATOM 26741 O WAT 4266 12.607 98.562 86.306 1.00 0.00 O ATOM 26742 H1 WAT 4266 12.750 97.732 86.761 1.00 0.00 H ATOM 26743 H2 WAT 4266 11.713 98.500 85.971 1.00 0.00 H TER 26745 WAT 4266 ATOM 26745 O WAT 4267 66.430 0.281 97.340 1.00 0.00 O ATOM 26746 H1 WAT 4267 66.702 1.135 97.675 1.00 0.00 H ATOM 26747 H2 WAT 4267 66.266 -0.242 98.125 1.00 0.00 H TER 26749 WAT 4267 ATOM 26749 O WAT 4268 50.345 130.277 10.572 1.00 0.00 O ATOM 26750 H1 WAT 4268 50.361 130.524 11.496 1.00 0.00 H ATOM 26751 H2 WAT 4268 50.582 129.350 10.567 1.00 0.00 H TER 26753 WAT 4268 ATOM 26753 O WAT 4269 54.708 66.102 106.341 1.00 0.00 O ATOM 26754 H1 WAT 4269 54.922 67.035 106.367 1.00 0.00 H ATOM 26755 H2 WAT 4269 54.225 65.990 105.523 1.00 0.00 H TER 26757 WAT 4269 ATOM 26757 O WAT 4270 72.618 33.390 131.394 1.00 0.00 O ATOM 26758 H1 WAT 4270 73.484 33.703 131.654 1.00 0.00 H ATOM 26759 H2 WAT 4270 72.751 32.468 131.178 1.00 0.00 H TER 26761 WAT 4270 ATOM 26761 O WAT 4271 7.530 11.360 146.045 1.00 0.00 O ATOM 26762 H1 WAT 4271 7.727 10.435 145.894 1.00 0.00 H ATOM 26763 H2 WAT 4271 8.341 11.722 146.401 1.00 0.00 H TER 26765 WAT 4271 ATOM 26765 O WAT 4272 56.996 24.434 17.680 1.00 0.00 O ATOM 26766 H1 WAT 4272 57.171 23.753 18.329 1.00 0.00 H ATOM 26767 H2 WAT 4272 56.816 25.218 18.198 1.00 0.00 H TER 26769 WAT 4272 ATOM 26769 O WAT 4273 46.743 102.133 18.836 1.00 0.00 O ATOM 26770 H1 WAT 4273 47.455 102.194 18.199 1.00 0.00 H ATOM 26771 H2 WAT 4273 47.141 101.717 19.600 1.00 0.00 H TER 26773 WAT 4273 ATOM 26773 O WAT 4274 39.102 6.740 58.562 1.00 0.00 O ATOM 26774 H1 WAT 4274 39.950 6.856 58.135 1.00 0.00 H ATOM 26775 H2 WAT 4274 39.033 5.797 58.707 1.00 0.00 H TER 26777 WAT 4274 ATOM 26777 O WAT 4275 68.543 20.562 54.812 1.00 0.00 O ATOM 26778 H1 WAT 4275 67.705 20.739 54.386 1.00 0.00 H ATOM 26779 H2 WAT 4275 69.192 20.989 54.252 1.00 0.00 H TER 26781 WAT 4275 ATOM 26781 O WAT 4276 56.548 81.135 141.541 1.00 0.00 O ATOM 26782 H1 WAT 4276 56.958 81.851 142.027 1.00 0.00 H ATOM 26783 H2 WAT 4276 55.608 81.293 141.631 1.00 0.00 H TER 26785 WAT 4276 ATOM 26785 O WAT 4277 100.160 86.908 104.870 1.00 0.00 O ATOM 26786 H1 WAT 4277 100.525 87.150 105.721 1.00 0.00 H ATOM 26787 H2 WAT 4277 99.442 87.526 104.732 1.00 0.00 H TER 26789 WAT 4277 ATOM 26789 O WAT 4278 110.893 28.595 81.209 1.00 0.00 O ATOM 26790 H1 WAT 4278 110.379 28.230 80.489 1.00 0.00 H ATOM 26791 H2 WAT 4278 111.642 28.004 81.293 1.00 0.00 H TER 26793 WAT 4278 ATOM 26793 O WAT 4279 134.760 48.579 128.153 1.00 0.00 O ATOM 26794 H1 WAT 4279 135.048 48.442 129.055 1.00 0.00 H ATOM 26795 H2 WAT 4279 133.862 48.248 128.135 1.00 0.00 H TER 26797 WAT 4279 ATOM 26797 O WAT 4280 80.678 123.312 74.349 1.00 0.00 O ATOM 26798 H1 WAT 4280 80.582 124.075 73.778 1.00 0.00 H ATOM 26799 H2 WAT 4280 81.574 123.010 74.195 1.00 0.00 H TER 26801 WAT 4280 ATOM 26801 O WAT 4281 96.854 53.677 117.800 1.00 0.00 O ATOM 26802 H1 WAT 4281 96.070 54.173 117.566 1.00 0.00 H ATOM 26803 H2 WAT 4281 97.378 53.666 116.999 1.00 0.00 H TER 26805 WAT 4281 ATOM 26805 O WAT 4282 68.823 58.240 83.005 1.00 0.00 O ATOM 26806 H1 WAT 4282 69.331 59.034 83.175 1.00 0.00 H ATOM 26807 H2 WAT 4282 68.431 58.387 82.145 1.00 0.00 H TER 26809 WAT 4282 ATOM 26809 O WAT 4283 12.678 82.485 15.335 1.00 0.00 O ATOM 26810 H1 WAT 4283 12.000 82.283 14.690 1.00 0.00 H ATOM 26811 H2 WAT 4283 13.395 82.854 14.821 1.00 0.00 H TER 26813 WAT 4283 ATOM 26813 O WAT 4284 3.397 120.156 73.498 1.00 0.00 O ATOM 26814 H1 WAT 4284 3.953 120.854 73.151 1.00 0.00 H ATOM 26815 H2 WAT 4284 3.098 119.680 72.724 1.00 0.00 H TER 26817 WAT 4284 ATOM 26817 O WAT 4285 61.642 86.578 141.638 1.00 0.00 O ATOM 26818 H1 WAT 4285 62.461 86.100 141.509 1.00 0.00 H ATOM 26819 H2 WAT 4285 61.537 86.624 142.588 1.00 0.00 H TER 26821 WAT 4285 ATOM 26821 O WAT 4286 41.118 109.849 123.293 1.00 0.00 O ATOM 26822 H1 WAT 4286 40.956 110.050 122.372 1.00 0.00 H ATOM 26823 H2 WAT 4286 40.555 110.456 123.773 1.00 0.00 H TER 26825 WAT 4286 ATOM 26825 O WAT 4287 81.625 52.080 133.328 1.00 0.00 O ATOM 26826 H1 WAT 4287 81.330 51.211 133.598 1.00 0.00 H ATOM 26827 H2 WAT 4287 82.405 51.915 132.798 1.00 0.00 H TER 26829 WAT 4287 ATOM 26829 O WAT 4288 93.668 86.553 16.533 1.00 0.00 O ATOM 26830 H1 WAT 4288 93.715 86.342 17.465 1.00 0.00 H ATOM 26831 H2 WAT 4288 93.567 87.504 16.506 1.00 0.00 H TER 26833 WAT 4288 ATOM 26833 O WAT 4289 97.640 127.823 83.542 1.00 0.00 O ATOM 26834 H1 WAT 4289 98.303 127.138 83.457 1.00 0.00 H ATOM 26835 H2 WAT 4289 97.936 128.517 82.954 1.00 0.00 H TER 26837 WAT 4289 ATOM 26837 O WAT 4290 64.412 80.330 62.770 1.00 0.00 O ATOM 26838 H1 WAT 4290 64.285 79.822 63.571 1.00 0.00 H ATOM 26839 H2 WAT 4290 64.901 79.746 62.191 1.00 0.00 H TER 26841 WAT 4290 ATOM 26841 O WAT 4291 42.028 145.764 87.255 1.00 0.00 O ATOM 26842 H1 WAT 4291 42.349 145.844 88.153 1.00 0.00 H ATOM 26843 H2 WAT 4291 42.108 144.831 87.055 1.00 0.00 H TER 26845 WAT 4291 ATOM 26845 O WAT 4292 131.296 59.538 103.525 1.00 0.00 O ATOM 26846 H1 WAT 4292 131.467 59.666 102.592 1.00 0.00 H ATOM 26847 H2 WAT 4292 132.091 59.849 103.959 1.00 0.00 H TER 26849 WAT 4292 ATOM 26849 O WAT 4293 25.945 122.817 64.964 1.00 0.00 O ATOM 26850 H1 WAT 4293 25.174 122.287 64.761 1.00 0.00 H ATOM 26851 H2 WAT 4293 26.225 123.166 64.118 1.00 0.00 H TER 26853 WAT 4293 ATOM 26853 O WAT 4294 101.099 95.308 130.928 1.00 0.00 O ATOM 26854 H1 WAT 4294 100.497 94.569 130.843 1.00 0.00 H ATOM 26855 H2 WAT 4294 100.543 96.081 130.832 1.00 0.00 H TER 26857 WAT 4294 ATOM 26857 O WAT 4295 66.102 143.750 53.463 1.00 0.00 O ATOM 26858 H1 WAT 4295 65.689 143.256 54.172 1.00 0.00 H ATOM 26859 H2 WAT 4295 65.435 144.378 53.189 1.00 0.00 H TER 26861 WAT 4295 ATOM 26861 O WAT 4296 107.219 143.168 154.372 1.00 0.00 O ATOM 26862 H1 WAT 4296 107.563 142.286 154.509 1.00 0.00 H ATOM 26863 H2 WAT 4296 106.408 143.036 153.880 1.00 0.00 H TER 26865 WAT 4296 ATOM 26865 O WAT 4297 2.690 11.142 138.710 1.00 0.00 O ATOM 26866 H1 WAT 4297 3.361 11.329 139.366 1.00 0.00 H ATOM 26867 H2 WAT 4297 2.101 10.521 139.139 1.00 0.00 H TER 26869 WAT 4297 ATOM 26869 O WAT 4298 80.923 131.995 120.352 1.00 0.00 O ATOM 26870 H1 WAT 4298 81.779 132.127 120.760 1.00 0.00 H ATOM 26871 H2 WAT 4298 81.111 131.494 119.559 1.00 0.00 H TER 26873 WAT 4298 ATOM 26873 O WAT 4299 30.659 67.720 100.656 1.00 0.00 O ATOM 26874 H1 WAT 4299 31.323 67.529 99.993 1.00 0.00 H ATOM 26875 H2 WAT 4299 30.225 66.880 100.808 1.00 0.00 H TER 26877 WAT 4299 ATOM 26877 O WAT 4300 129.007 143.933 110.109 1.00 0.00 O ATOM 26878 H1 WAT 4300 129.807 144.189 109.652 1.00 0.00 H ATOM 26879 H2 WAT 4300 128.503 143.447 109.456 1.00 0.00 H TER 26881 WAT 4300 ATOM 26881 O WAT 4301 79.704 21.537 78.507 1.00 0.00 O ATOM 26882 H1 WAT 4301 78.894 21.213 78.901 1.00 0.00 H ATOM 26883 H2 WAT 4301 79.618 21.327 77.576 1.00 0.00 H TER 26885 WAT 4301 ATOM 26885 O WAT 4302 20.380 14.780 76.856 1.00 0.00 O ATOM 26886 H1 WAT 4302 19.684 15.312 77.243 1.00 0.00 H ATOM 26887 H2 WAT 4302 20.742 14.288 77.593 1.00 0.00 H TER 26889 WAT 4302 ATOM 26889 O WAT 4303 126.510 113.937 85.038 1.00 0.00 O ATOM 26890 H1 WAT 4303 127.030 113.141 85.148 1.00 0.00 H ATOM 26891 H2 WAT 4303 125.974 113.768 84.263 1.00 0.00 H TER 26893 WAT 4303 ATOM 26893 O WAT 4304 83.300 8.881 119.086 1.00 0.00 O ATOM 26894 H1 WAT 4304 82.884 9.742 119.134 1.00 0.00 H ATOM 26895 H2 WAT 4304 83.107 8.474 119.931 1.00 0.00 H TER 26897 WAT 4304 ATOM 26897 O WAT 4305 145.418 124.920 0.144 1.00 0.00 O ATOM 26898 H1 WAT 4305 145.709 125.281 0.981 1.00 0.00 H ATOM 26899 H2 WAT 4305 145.320 123.982 0.308 1.00 0.00 H TER 26901 WAT 4305 ATOM 26901 O WAT 4306 25.864 26.744 24.943 1.00 0.00 O ATOM 26902 H1 WAT 4306 25.471 26.849 25.810 1.00 0.00 H ATOM 26903 H2 WAT 4306 26.718 27.172 25.014 1.00 0.00 H TER 26905 WAT 4306 ATOM 26905 O WAT 4307 109.038 32.705 8.363 1.00 0.00 O ATOM 26906 H1 WAT 4307 108.355 33.262 8.738 1.00 0.00 H ATOM 26907 H2 WAT 4307 108.583 31.897 8.126 1.00 0.00 H TER 26909 WAT 4307 ATOM 26909 O WAT 4308 19.448 83.435 23.928 1.00 0.00 O ATOM 26910 H1 WAT 4308 19.930 83.558 23.110 1.00 0.00 H ATOM 26911 H2 WAT 4308 19.099 84.303 24.132 1.00 0.00 H TER 26913 WAT 4308 ATOM 26913 O WAT 4309 109.989 121.011 70.653 1.00 0.00 O ATOM 26914 H1 WAT 4309 109.665 120.796 71.527 1.00 0.00 H ATOM 26915 H2 WAT 4309 110.386 121.876 70.750 1.00 0.00 H TER 26917 WAT 4309 ATOM 26917 O WAT 4310 27.595 105.225 9.326 1.00 0.00 O ATOM 26918 H1 WAT 4310 28.142 105.937 9.658 1.00 0.00 H ATOM 26919 H2 WAT 4310 26.757 105.642 9.123 1.00 0.00 H TER 26921 WAT 4310 ATOM 26921 O WAT 4311 135.723 126.872 149.227 1.00 0.00 O ATOM 26922 H1 WAT 4311 135.075 126.990 148.533 1.00 0.00 H ATOM 26923 H2 WAT 4311 136.102 127.742 149.352 1.00 0.00 H TER 26925 WAT 4311 ATOM 26925 O WAT 4312 91.884 118.216 4.160 1.00 0.00 O ATOM 26926 H1 WAT 4312 92.703 118.120 3.675 1.00 0.00 H ATOM 26927 H2 WAT 4312 92.060 118.913 4.792 1.00 0.00 H TER 26929 WAT 4312 ATOM 26929 O WAT 4313 32.097 144.850 18.682 1.00 0.00 O ATOM 26930 H1 WAT 4313 32.379 143.936 18.648 1.00 0.00 H ATOM 26931 H2 WAT 4313 31.217 144.816 19.059 1.00 0.00 H TER 26933 WAT 4313 ATOM 26933 O WAT 4314 17.105 137.047 147.367 1.00 0.00 O ATOM 26934 H1 WAT 4314 16.694 137.051 148.232 1.00 0.00 H ATOM 26935 H2 WAT 4314 17.952 137.471 147.503 1.00 0.00 H TER 26937 WAT 4314 ATOM 26937 O WAT 4315 89.644 81.875 147.111 1.00 0.00 O ATOM 26938 H1 WAT 4315 89.766 82.495 147.830 1.00 0.00 H ATOM 26939 H2 WAT 4315 89.229 81.115 147.519 1.00 0.00 H TER 26941 WAT 4315 ATOM 26941 O WAT 4316 45.294 54.200 91.399 1.00 0.00 O ATOM 26942 H1 WAT 4316 45.005 53.628 90.688 1.00 0.00 H ATOM 26943 H2 WAT 4316 45.246 53.652 92.182 1.00 0.00 H TER 26945 WAT 4316 ATOM 26945 O WAT 4317 144.715 40.447 106.557 1.00 0.00 O ATOM 26946 H1 WAT 4317 144.931 40.873 107.386 1.00 0.00 H ATOM 26947 H2 WAT 4317 144.948 41.092 105.889 1.00 0.00 H TER 26949 WAT 4317 ATOM 26949 O WAT 4318 115.946 141.547 61.977 1.00 0.00 O ATOM 26950 H1 WAT 4318 116.786 141.968 62.160 1.00 0.00 H ATOM 26951 H2 WAT 4318 116.179 140.675 61.660 1.00 0.00 H TER 26953 WAT 4318 ATOM 26953 O WAT 4319 105.864 62.007 126.529 1.00 0.00 O ATOM 26954 H1 WAT 4319 105.167 61.417 126.241 1.00 0.00 H ATOM 26955 H2 WAT 4319 106.008 61.776 127.447 1.00 0.00 H TER 26957 WAT 4319 ATOM 26957 O WAT 4320 137.535 35.696 116.494 1.00 0.00 O ATOM 26958 H1 WAT 4320 137.746 36.565 116.152 1.00 0.00 H ATOM 26959 H2 WAT 4320 137.671 35.107 115.751 1.00 0.00 H TER 26961 WAT 4320 ATOM 26961 O WAT 4321 130.185 8.814 91.849 1.00 0.00 O ATOM 26962 H1 WAT 4321 129.451 9.403 92.029 1.00 0.00 H ATOM 26963 H2 WAT 4321 129.808 8.122 91.307 1.00 0.00 H TER 26965 WAT 4321 ATOM 26965 O WAT 4322 58.637 10.013 57.369 1.00 0.00 O ATOM 26966 H1 WAT 4322 57.820 9.515 57.351 1.00 0.00 H ATOM 26967 H2 WAT 4322 58.493 10.687 58.033 1.00 0.00 H TER 26969 WAT 4322 ATOM 26969 O WAT 4323 76.150 142.432 95.398 1.00 0.00 O ATOM 26970 H1 WAT 4323 75.474 141.799 95.154 1.00 0.00 H ATOM 26971 H2 WAT 4323 76.554 142.059 96.181 1.00 0.00 H TER 26973 WAT 4323 ATOM 26973 O WAT 4324 77.895 88.889 122.107 1.00 0.00 O ATOM 26974 H1 WAT 4324 77.924 89.831 121.937 1.00 0.00 H ATOM 26975 H2 WAT 4324 78.202 88.490 121.293 1.00 0.00 H TER 26977 WAT 4324 ATOM 26977 O WAT 4325 48.726 9.222 122.783 1.00 0.00 O ATOM 26978 H1 WAT 4325 48.058 8.600 123.070 1.00 0.00 H ATOM 26979 H2 WAT 4325 49.416 8.675 122.408 1.00 0.00 H TER 26981 WAT 4325 ATOM 26981 O WAT 4326 114.068 120.189 150.021 1.00 0.00 O ATOM 26982 H1 WAT 4326 114.370 121.077 150.210 1.00 0.00 H ATOM 26983 H2 WAT 4326 113.304 120.311 149.457 1.00 0.00 H TER 26985 WAT 4326 ATOM 26985 O WAT 4327 65.175 0.860 2.375 1.00 0.00 O ATOM 26986 H1 WAT 4327 64.692 0.052 2.206 1.00 0.00 H ATOM 26987 H2 WAT 4327 65.240 0.905 3.329 1.00 0.00 H TER 26989 WAT 4327 ATOM 26989 O WAT 4328 5.266 17.533 144.189 1.00 0.00 O ATOM 26990 H1 WAT 4328 4.862 18.296 144.603 1.00 0.00 H ATOM 26991 H2 WAT 4328 5.979 17.895 143.663 1.00 0.00 H TER 26993 WAT 4328 ATOM 26993 O WAT 4329 32.733 23.151 19.942 1.00 0.00 O ATOM 26994 H1 WAT 4329 33.190 22.970 20.764 1.00 0.00 H ATOM 26995 H2 WAT 4329 32.673 22.299 19.509 1.00 0.00 H TER 26997 WAT 4329 ATOM 26997 O WAT 4330 99.163 37.052 152.854 1.00 0.00 O ATOM 26998 H1 WAT 4330 100.008 36.703 152.571 1.00 0.00 H ATOM 26999 H2 WAT 4330 99.385 37.825 153.374 1.00 0.00 H TER 27001 WAT 4330 ATOM 27001 O WAT 4331 80.416 67.867 19.828 1.00 0.00 O ATOM 27002 H1 WAT 4331 80.839 67.122 19.400 1.00 0.00 H ATOM 27003 H2 WAT 4331 79.936 67.481 20.561 1.00 0.00 H TER 27005 WAT 4331 ATOM 27005 O WAT 4332 7.617 105.765 12.987 1.00 0.00 O ATOM 27006 H1 WAT 4332 7.565 105.511 12.066 1.00 0.00 H ATOM 27007 H2 WAT 4332 8.413 105.341 13.307 1.00 0.00 H TER 27009 WAT 4332 ATOM 27009 O WAT 4333 77.528 16.555 149.534 1.00 0.00 O ATOM 27010 H1 WAT 4333 77.358 16.086 148.717 1.00 0.00 H ATOM 27011 H2 WAT 4333 78.360 16.200 149.846 1.00 0.00 H TER 27013 WAT 4333 ATOM 27013 O WAT 4334 102.289 52.258 82.465 1.00 0.00 O ATOM 27014 H1 WAT 4334 102.259 53.120 82.049 1.00 0.00 H ATOM 27015 H2 WAT 4334 103.219 52.030 82.476 1.00 0.00 H TER 27017 WAT 4334 ATOM 27017 O WAT 4335 53.871 122.115 100.244 1.00 0.00 O ATOM 27018 H1 WAT 4335 53.844 121.895 99.313 1.00 0.00 H ATOM 27019 H2 WAT 4335 54.424 122.895 100.290 1.00 0.00 H TER 27021 WAT 4335 ATOM 27021 O WAT 4336 104.993 83.151 21.094 1.00 0.00 O ATOM 27022 H1 WAT 4336 105.916 83.044 21.322 1.00 0.00 H ATOM 27023 H2 WAT 4336 104.678 83.835 21.685 1.00 0.00 H TER 27025 WAT 4336 ATOM 27025 O WAT 4337 15.043 102.226 155.236 1.00 0.00 O ATOM 27026 H1 WAT 4337 15.174 101.997 156.156 1.00 0.00 H ATOM 27027 H2 WAT 4337 14.825 101.396 154.811 1.00 0.00 H TER 27029 WAT 4337 ATOM 27029 O WAT 4338 86.698 139.523 112.664 1.00 0.00 O ATOM 27030 H1 WAT 4338 86.223 139.758 113.461 1.00 0.00 H ATOM 27031 H2 WAT 4338 87.541 139.194 112.976 1.00 0.00 H TER 27033 WAT 4338 ATOM 27033 O WAT 4339 145.923 136.088 68.852 1.00 0.00 O ATOM 27034 H1 WAT 4339 145.382 135.497 68.329 1.00 0.00 H ATOM 27035 H2 WAT 4339 145.422 136.903 68.889 1.00 0.00 H TER 27037 WAT 4339 ATOM 27037 O WAT 4340 6.748 95.250 92.172 1.00 0.00 O ATOM 27038 H1 WAT 4340 7.131 95.426 93.032 1.00 0.00 H ATOM 27039 H2 WAT 4340 6.929 96.040 91.663 1.00 0.00 H TER 27041 WAT 4340 ATOM 27041 O WAT 4341 35.395 143.168 103.656 1.00 0.00 O ATOM 27042 H1 WAT 4341 35.130 143.055 102.744 1.00 0.00 H ATOM 27043 H2 WAT 4341 36.250 142.741 103.712 1.00 0.00 H TER 27045 WAT 4341 ATOM 27045 O WAT 4342 53.368 137.025 87.139 1.00 0.00 O ATOM 27046 H1 WAT 4342 52.578 137.541 87.296 1.00 0.00 H ATOM 27047 H2 WAT 4342 53.194 136.564 86.318 1.00 0.00 H TER 27049 WAT 4342 ATOM 27049 O WAT 4343 82.743 16.419 127.467 1.00 0.00 O ATOM 27050 H1 WAT 4343 83.021 17.216 127.015 1.00 0.00 H ATOM 27051 H2 WAT 4343 82.404 15.855 126.772 1.00 0.00 H TER 27053 WAT 4343 ATOM 27053 O WAT 4344 51.636 82.416 76.725 1.00 0.00 O ATOM 27054 H1 WAT 4344 52.348 83.037 76.568 1.00 0.00 H ATOM 27055 H2 WAT 4344 51.237 82.287 75.865 1.00 0.00 H TER 27057 WAT 4344 ATOM 27057 O WAT 4345 16.913 123.165 0.527 1.00 0.00 O ATOM 27058 H1 WAT 4345 17.300 122.731 1.287 1.00 0.00 H ATOM 27059 H2 WAT 4345 17.609 123.165 -0.129 1.00 0.00 H TER 27061 WAT 4345 ATOM 27061 O WAT 4346 123.794 7.433 4.048 1.00 0.00 O ATOM 27062 H1 WAT 4346 123.619 6.929 3.253 1.00 0.00 H ATOM 27063 H2 WAT 4346 124.527 8.003 3.814 1.00 0.00 H TER 27065 WAT 4346 ATOM 27065 O WAT 4347 135.511 41.275 102.770 1.00 0.00 O ATOM 27066 H1 WAT 4347 135.926 40.931 103.560 1.00 0.00 H ATOM 27067 H2 WAT 4347 135.544 40.550 102.146 1.00 0.00 H TER 27069 WAT 4347 ATOM 27069 O WAT 4348 54.131 3.260 50.465 1.00 0.00 O ATOM 27070 H1 WAT 4348 54.775 2.586 50.250 1.00 0.00 H ATOM 27071 H2 WAT 4348 54.630 4.077 50.469 1.00 0.00 H TER 27073 WAT 4348 ATOM 27073 O WAT 4349 80.640 65.409 76.470 1.00 0.00 O ATOM 27074 H1 WAT 4349 79.993 65.203 75.795 1.00 0.00 H ATOM 27075 H2 WAT 4349 80.563 66.355 76.594 1.00 0.00 H TER 27077 WAT 4349 ATOM 27077 O WAT 4350 63.592 68.046 6.150 1.00 0.00 O ATOM 27078 H1 WAT 4350 64.484 68.243 5.863 1.00 0.00 H ATOM 27079 H2 WAT 4350 63.109 67.891 5.338 1.00 0.00 H TER 27081 WAT 4350 ATOM 27081 O WAT 4351 86.960 37.072 102.855 1.00 0.00 O ATOM 27082 H1 WAT 4351 86.150 36.656 102.561 1.00 0.00 H ATOM 27083 H2 WAT 4351 87.654 36.487 102.552 1.00 0.00 H TER 27085 WAT 4351 ATOM 27085 O WAT 4352 144.649 72.013 131.507 1.00 0.00 O ATOM 27086 H1 WAT 4352 144.665 72.075 130.552 1.00 0.00 H ATOM 27087 H2 WAT 4352 144.980 71.135 131.696 1.00 0.00 H TER 27089 WAT 4352 ATOM 27089 O WAT 4353 127.049 144.169 99.600 1.00 0.00 O ATOM 27090 H1 WAT 4353 126.871 143.281 99.912 1.00 0.00 H ATOM 27091 H2 WAT 4353 126.562 144.236 98.779 1.00 0.00 H TER 27093 WAT 4353 ATOM 27093 O WAT 4354 78.718 12.098 25.369 1.00 0.00 O ATOM 27094 H1 WAT 4354 78.151 11.714 26.037 1.00 0.00 H ATOM 27095 H2 WAT 4354 78.114 12.480 24.732 1.00 0.00 H TER 27097 WAT 4354 ATOM 27097 O WAT 4355 78.406 118.075 115.463 1.00 0.00 O ATOM 27098 H1 WAT 4355 77.750 117.746 116.076 1.00 0.00 H ATOM 27099 H2 WAT 4355 78.150 118.983 115.302 1.00 0.00 H TER 27101 WAT 4355 ATOM 27101 O WAT 4356 14.794 50.330 146.157 1.00 0.00 O ATOM 27102 H1 WAT 4356 14.576 50.683 147.019 1.00 0.00 H ATOM 27103 H2 WAT 4356 15.015 51.099 145.632 1.00 0.00 H TER 27105 WAT 4356 ATOM 27105 O WAT 4357 101.203 65.835 13.205 1.00 0.00 O ATOM 27106 H1 WAT 4357 100.538 66.073 12.559 1.00 0.00 H ATOM 27107 H2 WAT 4357 101.009 64.923 13.423 1.00 0.00 H TER 27109 WAT 4357 ATOM 27109 O WAT 4358 121.171 62.452 144.078 1.00 0.00 O ATOM 27110 H1 WAT 4358 120.678 63.220 143.787 1.00 0.00 H ATOM 27111 H2 WAT 4358 121.134 61.849 143.335 1.00 0.00 H TER 27113 WAT 4358 ATOM 27113 O WAT 4359 6.967 102.071 113.133 1.00 0.00 O ATOM 27114 H1 WAT 4359 7.816 102.447 112.897 1.00 0.00 H ATOM 27115 H2 WAT 4359 6.327 102.705 112.811 1.00 0.00 H TER 27117 WAT 4359 ATOM 27117 O WAT 4360 2.291 141.567 137.234 1.00 0.00 O ATOM 27118 H1 WAT 4360 1.780 141.790 138.012 1.00 0.00 H ATOM 27119 H2 WAT 4360 3.172 141.396 137.567 1.00 0.00 H TER 27121 WAT 4360 ATOM 27121 O WAT 4361 1.145 67.759 134.091 1.00 0.00 O ATOM 27122 H1 WAT 4361 0.970 68.689 134.233 1.00 0.00 H ATOM 27123 H2 WAT 4361 0.840 67.332 134.891 1.00 0.00 H TER 27125 WAT 4361 ATOM 27125 O WAT 4362 32.555 33.078 99.205 1.00 0.00 O ATOM 27126 H1 WAT 4362 33.255 32.525 98.858 1.00 0.00 H ATOM 27127 H2 WAT 4362 32.737 33.947 98.847 1.00 0.00 H TER 27129 WAT 4362 ATOM 27129 O WAT 4363 115.647 73.343 155.767 1.00 0.00 O ATOM 27130 H1 WAT 4363 115.774 73.904 156.532 1.00 0.00 H ATOM 27131 H2 WAT 4363 115.252 72.545 156.119 1.00 0.00 H TER 27133 WAT 4363 ATOM 27133 O WAT 4364 26.655 84.400 14.946 1.00 0.00 O ATOM 27134 H1 WAT 4364 26.119 83.709 14.556 1.00 0.00 H ATOM 27135 H2 WAT 4364 27.464 84.394 14.434 1.00 0.00 H TER 27137 WAT 4364 ATOM 27137 O WAT 4365 85.024 40.098 28.853 1.00 0.00 O ATOM 27138 H1 WAT 4365 85.949 40.039 29.090 1.00 0.00 H ATOM 27139 H2 WAT 4365 84.847 41.038 28.812 1.00 0.00 H TER 27141 WAT 4365 ATOM 27141 O WAT 4366 89.562 55.278 6.929 1.00 0.00 O ATOM 27142 H1 WAT 4366 90.171 55.971 7.186 1.00 0.00 H ATOM 27143 H2 WAT 4366 88.729 55.730 6.792 1.00 0.00 H TER 27145 WAT 4366 ATOM 27145 O WAT 4367 90.224 122.956 125.524 1.00 0.00 O ATOM 27146 H1 WAT 4367 89.320 123.248 125.640 1.00 0.00 H ATOM 27147 H2 WAT 4367 90.604 122.996 126.401 1.00 0.00 H TER 27149 WAT 4367 ATOM 27149 O WAT 4368 125.641 32.937 123.694 1.00 0.00 O ATOM 27150 H1 WAT 4368 125.781 32.548 124.557 1.00 0.00 H ATOM 27151 H2 WAT 4368 124.728 33.225 123.706 1.00 0.00 H TER 27153 WAT 4368 ATOM 27153 O WAT 4369 42.009 139.053 78.561 1.00 0.00 O ATOM 27154 H1 WAT 4369 41.708 138.370 79.161 1.00 0.00 H ATOM 27155 H2 WAT 4369 41.396 139.013 77.827 1.00 0.00 H TER 27157 WAT 4369 ATOM 27157 O WAT 4370 7.467 94.634 1.253 1.00 0.00 O ATOM 27158 H1 WAT 4370 7.357 93.686 1.190 1.00 0.00 H ATOM 27159 H2 WAT 4370 8.166 94.836 0.631 1.00 0.00 H TER 27161 WAT 4370 ATOM 27161 O WAT 4371 50.557 145.043 56.580 1.00 0.00 O ATOM 27162 H1 WAT 4371 50.642 145.190 55.638 1.00 0.00 H ATOM 27163 H2 WAT 4371 51.416 144.720 56.851 1.00 0.00 H TER 27165 WAT 4371 ATOM 27165 O WAT 4372 66.658 17.928 11.759 1.00 0.00 O ATOM 27166 H1 WAT 4372 67.093 17.489 11.027 1.00 0.00 H ATOM 27167 H2 WAT 4372 65.724 17.841 11.569 1.00 0.00 H TER 27169 WAT 4372 ATOM 27169 O WAT 4373 8.367 61.428 100.911 1.00 0.00 O ATOM 27170 H1 WAT 4373 8.643 61.978 101.644 1.00 0.00 H ATOM 27171 H2 WAT 4373 8.362 62.018 100.157 1.00 0.00 H TER 27173 WAT 4373 ATOM 27173 O WAT 4374 62.935 55.666 99.008 1.00 0.00 O ATOM 27174 H1 WAT 4374 62.879 56.483 99.504 1.00 0.00 H ATOM 27175 H2 WAT 4374 62.290 55.765 98.309 1.00 0.00 H TER 27177 WAT 4374 ATOM 27177 O WAT 4375 145.473 39.548 19.536 1.00 0.00 O ATOM 27178 H1 WAT 4375 146.020 39.238 18.815 1.00 0.00 H ATOM 27179 H2 WAT 4375 146.096 39.825 20.208 1.00 0.00 H TER 27181 WAT 4375 ATOM 27181 O WAT 4376 107.151 0.612 147.259 1.00 0.00 O ATOM 27182 H1 WAT 4376 106.635 0.213 147.960 1.00 0.00 H ATOM 27183 H2 WAT 4376 107.184 -0.057 146.575 1.00 0.00 H TER 27185 WAT 4376 ATOM 27185 O WAT 4377 136.138 77.992 149.014 1.00 0.00 O ATOM 27186 H1 WAT 4377 136.835 77.447 149.379 1.00 0.00 H ATOM 27187 H2 WAT 4377 135.349 77.716 149.478 1.00 0.00 H TER 27189 WAT 4377 ATOM 27189 O WAT 4378 19.700 142.848 127.456 1.00 0.00 O ATOM 27190 H1 WAT 4378 19.555 142.794 128.401 1.00 0.00 H ATOM 27191 H2 WAT 4378 19.004 142.312 127.076 1.00 0.00 H TER 27193 WAT 4378 ATOM 27193 O WAT 4379 111.370 40.655 20.850 1.00 0.00 O ATOM 27194 H1 WAT 4379 110.444 40.435 20.946 1.00 0.00 H ATOM 27195 H2 WAT 4379 111.748 40.483 21.712 1.00 0.00 H TER 27197 WAT 4379 ATOM 27197 O WAT 4380 31.575 70.182 143.649 1.00 0.00 O ATOM 27198 H1 WAT 4380 31.359 70.783 144.363 1.00 0.00 H ATOM 27199 H2 WAT 4380 32.355 70.561 143.244 1.00 0.00 H TER 27201 WAT 4380 ATOM 27201 O WAT 4381 141.055 105.431 72.093 1.00 0.00 O ATOM 27202 H1 WAT 4381 140.238 105.899 71.921 1.00 0.00 H ATOM 27203 H2 WAT 4381 140.781 104.614 72.508 1.00 0.00 H TER 27205 WAT 4381 ATOM 27205 O WAT 4382 85.430 99.370 86.141 1.00 0.00 O ATOM 27206 H1 WAT 4382 85.225 98.438 86.223 1.00 0.00 H ATOM 27207 H2 WAT 4382 86.311 99.389 85.767 1.00 0.00 H TER 27209 WAT 4382 ATOM 27209 O WAT 4383 98.007 48.299 71.346 1.00 0.00 O ATOM 27210 H1 WAT 4383 98.577 47.718 71.849 1.00 0.00 H ATOM 27211 H2 WAT 4383 97.431 48.694 72.000 1.00 0.00 H TER 27213 WAT 4383 ATOM 27213 O WAT 4384 88.988 98.849 74.563 1.00 0.00 O ATOM 27214 H1 WAT 4384 89.286 97.953 74.406 1.00 0.00 H ATOM 27215 H2 WAT 4384 89.002 98.943 75.515 1.00 0.00 H TER 27217 WAT 4384 ATOM 27217 O WAT 4385 145.279 113.809 130.092 1.00 0.00 O ATOM 27218 H1 WAT 4385 145.434 112.889 129.874 1.00 0.00 H ATOM 27219 H2 WAT 4385 145.132 113.809 131.037 1.00 0.00 H TER 27221 WAT 4385 ATOM 27221 O WAT 4386 131.165 92.242 0.448 1.00 0.00 O ATOM 27222 H1 WAT 4386 131.375 92.025 1.357 1.00 0.00 H ATOM 27223 H2 WAT 4386 130.967 93.178 0.466 1.00 0.00 H TER 27225 WAT 4386 ATOM 27225 O WAT 4387 52.314 34.434 140.848 1.00 0.00 O ATOM 27226 H1 WAT 4387 53.159 34.254 141.260 1.00 0.00 H ATOM 27227 H2 WAT 4387 52.353 33.973 140.010 1.00 0.00 H TER 27229 WAT 4387 ATOM 27229 O WAT 4388 128.464 123.484 54.072 1.00 0.00 O ATOM 27230 H1 WAT 4388 129.334 123.789 54.330 1.00 0.00 H ATOM 27231 H2 WAT 4388 128.002 123.350 54.899 1.00 0.00 H TER 27233 WAT 4388 ATOM 27233 O WAT 4389 128.770 3.652 152.543 1.00 0.00 O ATOM 27234 H1 WAT 4389 129.560 3.789 153.066 1.00 0.00 H ATOM 27235 H2 WAT 4389 128.333 2.910 152.959 1.00 0.00 H TER 27237 WAT 4389 ATOM 27237 O WAT 4390 127.061 51.034 129.273 1.00 0.00 O ATOM 27238 H1 WAT 4390 126.647 51.896 129.293 1.00 0.00 H ATOM 27239 H2 WAT 4390 127.089 50.803 128.345 1.00 0.00 H TER 27241 WAT 4390 ATOM 27241 O WAT 4391 13.574 113.465 136.019 1.00 0.00 O ATOM 27242 H1 WAT 4391 12.966 113.746 136.702 1.00 0.00 H ATOM 27243 H2 WAT 4391 13.867 114.279 135.609 1.00 0.00 H TER 27245 WAT 4391 ATOM 27245 O WAT 4392 32.918 117.845 131.449 1.00 0.00 O ATOM 27246 H1 WAT 4392 32.727 117.973 130.520 1.00 0.00 H ATOM 27247 H2 WAT 4392 32.487 118.580 131.885 1.00 0.00 H TER 27249 WAT 4392 ATOM 27249 O WAT 4393 10.372 98.817 133.405 1.00 0.00 O ATOM 27250 H1 WAT 4393 10.429 99.500 134.073 1.00 0.00 H ATOM 27251 H2 WAT 4393 10.926 98.110 133.736 1.00 0.00 H TER 27253 WAT 4393 ATOM 27253 O WAT 4394 57.329 45.433 10.062 1.00 0.00 O ATOM 27254 H1 WAT 4394 57.477 44.524 9.802 1.00 0.00 H ATOM 27255 H2 WAT 4394 56.865 45.371 10.897 1.00 0.00 H TER 27257 WAT 4394 ATOM 27257 O WAT 4395 27.835 29.513 154.056 1.00 0.00 O ATOM 27258 H1 WAT 4395 26.992 29.877 154.327 1.00 0.00 H ATOM 27259 H2 WAT 4395 27.616 28.668 153.662 1.00 0.00 H TER 27261 WAT 4395 ATOM 27261 O WAT 4396 119.223 119.728 96.050 1.00 0.00 O ATOM 27262 H1 WAT 4396 119.856 119.025 95.907 1.00 0.00 H ATOM 27263 H2 WAT 4396 119.684 120.357 96.605 1.00 0.00 H TER 27265 WAT 4396 ATOM 27265 O WAT 4397 134.165 139.963 88.583 1.00 0.00 O ATOM 27266 H1 WAT 4397 134.039 140.514 87.811 1.00 0.00 H ATOM 27267 H2 WAT 4397 135.069 140.127 88.850 1.00 0.00 H TER 27269 WAT 4397 ATOM 27269 O WAT 4398 73.013 96.402 148.369 1.00 0.00 O ATOM 27270 H1 WAT 4398 73.886 96.107 148.629 1.00 0.00 H ATOM 27271 H2 WAT 4398 72.446 95.651 148.543 1.00 0.00 H TER 27273 WAT 4398 ATOM 27273 O WAT 4399 17.173 65.631 148.150 1.00 0.00 O ATOM 27274 H1 WAT 4399 16.416 65.118 147.870 1.00 0.00 H ATOM 27275 H2 WAT 4399 17.761 65.623 147.395 1.00 0.00 H TER 27277 WAT 4399 ATOM 27277 O WAT 4400 14.516 112.096 76.466 1.00 0.00 O ATOM 27278 H1 WAT 4400 14.125 111.293 76.810 1.00 0.00 H ATOM 27279 H2 WAT 4400 15.350 111.815 76.090 1.00 0.00 H TER 27281 WAT 4400 ATOM 27281 O WAT 4401 135.810 135.384 88.418 1.00 0.00 O ATOM 27282 H1 WAT 4401 136.703 135.720 88.489 1.00 0.00 H ATOM 27283 H2 WAT 4401 135.283 136.149 88.190 1.00 0.00 H TER 27285 WAT 4401 ATOM 27285 O WAT 4402 17.781 94.021 128.293 1.00 0.00 O ATOM 27286 H1 WAT 4402 16.840 94.022 128.472 1.00 0.00 H ATOM 27287 H2 WAT 4402 18.009 94.946 128.203 1.00 0.00 H TER 27289 WAT 4402 ATOM 27289 O WAT 4403 102.897 88.404 18.134 1.00 0.00 O ATOM 27290 H1 WAT 4403 102.890 87.764 18.845 1.00 0.00 H ATOM 27291 H2 WAT 4403 102.781 89.248 18.571 1.00 0.00 H TER 27293 WAT 4403 ATOM 27293 O WAT 4404 0.759 133.923 91.663 1.00 0.00 O ATOM 27294 H1 WAT 4404 0.505 134.603 92.288 1.00 0.00 H ATOM 27295 H2 WAT 4404 0.036 133.296 91.684 1.00 0.00 H TER 27297 WAT 4404 ATOM 27297 O WAT 4405 143.139 29.983 10.791 1.00 0.00 O ATOM 27298 H1 WAT 4405 142.474 29.295 10.822 1.00 0.00 H ATOM 27299 H2 WAT 4405 143.483 29.944 9.899 1.00 0.00 H TER 27301 WAT 4405 ATOM 27301 O WAT 4406 74.216 23.022 71.209 1.00 0.00 O ATOM 27302 H1 WAT 4406 73.750 23.183 72.030 1.00 0.00 H ATOM 27303 H2 WAT 4406 73.539 22.712 70.607 1.00 0.00 H TER 27305 WAT 4406 ATOM 27305 O WAT 4407 90.387 54.874 108.536 1.00 0.00 O ATOM 27306 H1 WAT 4407 90.958 54.218 108.935 1.00 0.00 H ATOM 27307 H2 WAT 4407 89.523 54.700 108.911 1.00 0.00 H TER 27309 WAT 4407 ATOM 27309 O WAT 4408 62.389 16.656 114.485 1.00 0.00 O ATOM 27310 H1 WAT 4408 62.188 15.787 114.833 1.00 0.00 H ATOM 27311 H2 WAT 4408 62.606 16.502 113.566 1.00 0.00 H TER 27313 WAT 4408 ATOM 27313 O WAT 4409 142.563 123.836 133.893 1.00 0.00 O ATOM 27314 H1 WAT 4409 142.130 122.983 133.862 1.00 0.00 H ATOM 27315 H2 WAT 4409 142.387 124.162 134.776 1.00 0.00 H TER 27317 WAT 4409 ATOM 27317 O WAT 4410 2.453 100.037 6.141 1.00 0.00 O ATOM 27318 H1 WAT 4410 2.230 100.685 6.808 1.00 0.00 H ATOM 27319 H2 WAT 4410 3.386 99.868 6.274 1.00 0.00 H TER 27321 WAT 4410 ATOM 27321 O WAT 4411 86.054 65.167 20.768 1.00 0.00 O ATOM 27322 H1 WAT 4411 85.230 65.272 21.243 1.00 0.00 H ATOM 27323 H2 WAT 4411 86.676 65.718 21.243 1.00 0.00 H TER 27325 WAT 4411 ATOM 27325 O WAT 4412 19.013 108.054 145.568 1.00 0.00 O ATOM 27326 H1 WAT 4412 18.071 108.193 145.665 1.00 0.00 H ATOM 27327 H2 WAT 4412 19.318 107.853 146.453 1.00 0.00 H TER 27329 WAT 4412 ATOM 27329 O WAT 4413 117.925 70.892 75.249 1.00 0.00 O ATOM 27330 H1 WAT 4413 118.721 71.356 75.508 1.00 0.00 H ATOM 27331 H2 WAT 4413 117.327 71.012 75.988 1.00 0.00 H TER 27333 WAT 4413 ATOM 27333 O WAT 4414 125.907 8.761 149.850 1.00 0.00 O ATOM 27334 H1 WAT 4414 126.040 9.281 150.642 1.00 0.00 H ATOM 27335 H2 WAT 4414 126.783 8.666 149.476 1.00 0.00 H TER 27337 WAT 4414 ATOM 27337 O WAT 4415 17.436 78.992 135.370 1.00 0.00 O ATOM 27338 H1 WAT 4415 16.838 79.490 134.812 1.00 0.00 H ATOM 27339 H2 WAT 4415 17.491 78.131 134.954 1.00 0.00 H TER 27341 WAT 4415 ATOM 27341 O WAT 4416 121.269 121.001 61.214 1.00 0.00 O ATOM 27342 H1 WAT 4416 121.534 121.763 60.699 1.00 0.00 H ATOM 27343 H2 WAT 4416 121.895 120.319 60.973 1.00 0.00 H TER 27345 WAT 4416 ATOM 27345 O WAT 4417 76.040 71.859 120.129 1.00 0.00 O ATOM 27346 H1 WAT 4417 76.974 71.764 120.317 1.00 0.00 H ATOM 27347 H2 WAT 4417 75.994 72.588 119.510 1.00 0.00 H TER 27349 WAT 4417 ATOM 27349 O WAT 4418 7.200 83.574 82.509 1.00 0.00 O ATOM 27350 H1 WAT 4418 8.118 83.409 82.724 1.00 0.00 H ATOM 27351 H2 WAT 4418 6.765 82.735 82.659 1.00 0.00 H TER 27353 WAT 4418 ATOM 27353 O WAT 4419 69.476 99.001 115.654 1.00 0.00 O ATOM 27354 H1 WAT 4419 69.384 99.440 116.500 1.00 0.00 H ATOM 27355 H2 WAT 4419 70.129 98.318 115.809 1.00 0.00 H TER 27357 WAT 4419 ATOM 27357 O WAT 4420 80.573 19.407 99.333 1.00 0.00 O ATOM 27358 H1 WAT 4420 79.789 19.926 99.513 1.00 0.00 H ATOM 27359 H2 WAT 4420 80.938 19.217 100.197 1.00 0.00 H TER 27361 WAT 4420 ATOM 27361 O WAT 4421 104.641 10.641 108.356 1.00 0.00 O ATOM 27362 H1 WAT 4421 104.469 11.566 108.533 1.00 0.00 H ATOM 27363 H2 WAT 4421 105.568 10.525 108.565 1.00 0.00 H TER 27365 WAT 4421 ATOM 27365 O WAT 4422 70.491 110.024 132.771 1.00 0.00 O ATOM 27366 H1 WAT 4422 70.156 109.518 132.031 1.00 0.00 H ATOM 27367 H2 WAT 4422 70.539 110.922 132.445 1.00 0.00 H TER 27369 WAT 4422 ATOM 27369 O WAT 4423 72.252 41.089 91.602 1.00 0.00 O ATOM 27370 H1 WAT 4423 72.432 41.890 92.095 1.00 0.00 H ATOM 27371 H2 WAT 4423 72.464 41.312 90.696 1.00 0.00 H TER 27373 WAT 4423 ATOM 27373 O WAT 4424 56.563 86.171 112.492 1.00 0.00 O ATOM 27374 H1 WAT 4424 56.329 86.862 113.112 1.00 0.00 H ATOM 27375 H2 WAT 4424 56.991 85.503 113.028 1.00 0.00 H TER 27377 WAT 4424 ATOM 27377 O WAT 4425 30.635 45.774 76.946 1.00 0.00 O ATOM 27378 H1 WAT 4425 31.546 45.482 76.915 1.00 0.00 H ATOM 27379 H2 WAT 4425 30.169 45.057 77.375 1.00 0.00 H TER 27381 WAT 4425 ATOM 27381 O WAT 4426 130.018 6.821 10.559 1.00 0.00 O ATOM 27382 H1 WAT 4426 129.163 7.227 10.699 1.00 0.00 H ATOM 27383 H2 WAT 4426 130.287 7.121 9.691 1.00 0.00 H TER 27385 WAT 4426 ATOM 27385 O WAT 4427 135.593 137.929 85.594 1.00 0.00 O ATOM 27386 H1 WAT 4427 135.025 137.905 86.364 1.00 0.00 H ATOM 27387 H2 WAT 4427 136.303 138.522 85.838 1.00 0.00 H TER 27389 WAT 4427 ATOM 27389 O WAT 4428 91.847 39.976 87.897 1.00 0.00 O ATOM 27390 H1 WAT 4428 91.860 40.825 87.455 1.00 0.00 H ATOM 27391 H2 WAT 4428 92.434 40.087 88.645 1.00 0.00 H TER 27393 WAT 4428 ATOM 27393 O WAT 4429 79.280 87.025 6.164 1.00 0.00 O ATOM 27394 H1 WAT 4429 79.131 87.332 5.270 1.00 0.00 H ATOM 27395 H2 WAT 4429 79.379 87.825 6.679 1.00 0.00 H TER 27397 WAT 4429 ATOM 27397 O WAT 4430 139.277 0.454 99.473 1.00 0.00 O ATOM 27398 H1 WAT 4430 139.324 0.743 100.384 1.00 0.00 H ATOM 27399 H2 WAT 4430 140.103 -0.005 99.324 1.00 0.00 H TER 27401 WAT 4430 ATOM 27401 O WAT 4431 90.190 39.413 2.823 1.00 0.00 O ATOM 27402 H1 WAT 4431 89.982 38.872 2.061 1.00 0.00 H ATOM 27403 H2 WAT 4431 89.516 39.190 3.466 1.00 0.00 H TER 27405 WAT 4431 ATOM 27405 O WAT 4432 18.542 100.393 83.100 1.00 0.00 O ATOM 27406 H1 WAT 4432 18.944 99.531 83.208 1.00 0.00 H ATOM 27407 H2 WAT 4432 18.254 100.410 82.187 1.00 0.00 H TER 27409 WAT 4432 ATOM 27409 O WAT 4433 10.182 123.317 82.586 1.00 0.00 O ATOM 27410 H1 WAT 4433 10.871 122.677 82.407 1.00 0.00 H ATOM 27411 H2 WAT 4433 9.638 122.903 83.256 1.00 0.00 H TER 27413 WAT 4433 ATOM 27413 O WAT 4434 70.891 143.417 52.543 1.00 0.00 O ATOM 27414 H1 WAT 4434 70.968 142.474 52.687 1.00 0.00 H ATOM 27415 H2 WAT 4434 71.783 143.749 52.649 1.00 0.00 H TER 27417 WAT 4434 ATOM 27417 O WAT 4435 49.714 14.472 65.943 1.00 0.00 O ATOM 27418 H1 WAT 4435 49.562 14.973 65.142 1.00 0.00 H ATOM 27419 H2 WAT 4435 50.474 13.926 65.744 1.00 0.00 H TER 27421 WAT 4435 ATOM 27421 O WAT 4436 71.618 25.817 90.784 1.00 0.00 O ATOM 27422 H1 WAT 4436 71.520 26.009 89.851 1.00 0.00 H ATOM 27423 H2 WAT 4436 71.846 24.888 90.815 1.00 0.00 H TER 27425 WAT 4436 ATOM 27425 O WAT 4437 40.024 107.234 123.351 1.00 0.00 O ATOM 27426 H1 WAT 4437 40.300 108.139 123.206 1.00 0.00 H ATOM 27427 H2 WAT 4437 39.481 107.272 124.138 1.00 0.00 H TER 27429 WAT 4437 ATOM 27429 O WAT 4438 35.229 96.722 63.625 1.00 0.00 O ATOM 27430 H1 WAT 4438 35.357 97.655 63.456 1.00 0.00 H ATOM 27431 H2 WAT 4438 36.098 96.337 63.517 1.00 0.00 H TER 27433 WAT 4438 ATOM 27433 O WAT 4439 126.446 91.296 93.371 1.00 0.00 O ATOM 27434 H1 WAT 4439 125.736 91.849 93.046 1.00 0.00 H ATOM 27435 H2 WAT 4439 127.140 91.390 92.719 1.00 0.00 H TER 27437 WAT 4439 ATOM 27437 O WAT 4440 48.377 42.892 105.390 1.00 0.00 O ATOM 27438 H1 WAT 4440 47.929 42.130 105.756 1.00 0.00 H ATOM 27439 H2 WAT 4440 47.706 43.575 105.363 1.00 0.00 H TER 27441 WAT 4440 ATOM 27441 O WAT 4441 81.588 11.721 74.803 1.00 0.00 O ATOM 27442 H1 WAT 4441 81.918 12.611 74.678 1.00 0.00 H ATOM 27443 H2 WAT 4441 81.342 11.431 73.925 1.00 0.00 H TER 27445 WAT 4441 ATOM 27445 O WAT 4442 141.480 41.526 56.567 1.00 0.00 O ATOM 27446 H1 WAT 4442 141.407 42.057 57.360 1.00 0.00 H ATOM 27447 H2 WAT 4442 140.754 40.906 56.626 1.00 0.00 H TER 27449 WAT 4442 ATOM 27449 O WAT 4443 63.812 122.200 145.116 1.00 0.00 O ATOM 27450 H1 WAT 4443 63.021 121.715 145.349 1.00 0.00 H ATOM 27451 H2 WAT 4443 63.518 123.107 145.024 1.00 0.00 H TER 27453 WAT 4443 ATOM 27453 O WAT 4444 135.788 124.330 128.463 1.00 0.00 O ATOM 27454 H1 WAT 4444 136.287 124.803 129.130 1.00 0.00 H ATOM 27455 H2 WAT 4444 136.428 124.137 127.778 1.00 0.00 H TER 27457 WAT 4444 ATOM 27457 O WAT 4445 140.618 118.376 115.308 1.00 0.00 O ATOM 27458 H1 WAT 4445 140.413 118.493 116.236 1.00 0.00 H ATOM 27459 H2 WAT 4445 139.874 118.764 114.848 1.00 0.00 H TER 27461 WAT 4445 ATOM 27461 O WAT 4446 19.978 45.035 98.974 1.00 0.00 O ATOM 27462 H1 WAT 4446 20.716 45.305 99.521 1.00 0.00 H ATOM 27463 H2 WAT 4446 19.239 44.982 99.580 1.00 0.00 H TER 27465 WAT 4446 ATOM 27465 O WAT 4447 111.752 115.590 13.778 1.00 0.00 O ATOM 27466 H1 WAT 4447 110.946 115.292 13.357 1.00 0.00 H ATOM 27467 H2 WAT 4447 111.730 115.192 14.648 1.00 0.00 H TER 27469 WAT 4447 ATOM 27469 O WAT 4448 24.873 4.349 3.516 1.00 0.00 O ATOM 27470 H1 WAT 4448 24.778 5.005 2.826 1.00 0.00 H ATOM 27471 H2 WAT 4448 23.977 4.164 3.796 1.00 0.00 H TER 27473 WAT 4448 ATOM 27473 O WAT 4449 15.482 65.136 54.096 1.00 0.00 O ATOM 27474 H1 WAT 4449 16.316 65.045 53.634 1.00 0.00 H ATOM 27475 H2 WAT 4449 15.017 65.821 53.617 1.00 0.00 H TER 27477 WAT 4449 ATOM 27477 O WAT 4450 71.275 100.628 4.211 1.00 0.00 O ATOM 27478 H1 WAT 4450 71.597 101.433 3.807 1.00 0.00 H ATOM 27479 H2 WAT 4450 71.442 100.746 5.146 1.00 0.00 H TER 27481 WAT 4450 ATOM 27481 O WAT 4451 32.850 107.467 13.805 1.00 0.00 O ATOM 27482 H1 WAT 4451 32.171 108.064 14.120 1.00 0.00 H ATOM 27483 H2 WAT 4451 32.970 107.704 12.886 1.00 0.00 H TER 27485 WAT 4451 ATOM 27485 O WAT 4452 25.928 136.863 142.618 1.00 0.00 O ATOM 27486 H1 WAT 4452 25.291 137.452 142.213 1.00 0.00 H ATOM 27487 H2 WAT 4452 25.781 136.020 142.189 1.00 0.00 H TER 27489 WAT 4452 ATOM 27489 O WAT 4453 20.487 34.461 17.362 1.00 0.00 O ATOM 27490 H1 WAT 4453 20.773 35.319 17.673 1.00 0.00 H ATOM 27491 H2 WAT 4453 19.587 34.601 17.066 1.00 0.00 H TER 27493 WAT 4453 ATOM 27493 O WAT 4454 34.211 119.995 106.270 1.00 0.00 O ATOM 27494 H1 WAT 4454 34.718 120.489 105.626 1.00 0.00 H ATOM 27495 H2 WAT 4454 33.801 119.293 105.763 1.00 0.00 H TER 27497 WAT 4454 ATOM 27497 O WAT 4455 128.716 130.708 119.883 1.00 0.00 O ATOM 27498 H1 WAT 4455 129.193 131.518 119.704 1.00 0.00 H ATOM 27499 H2 WAT 4455 128.200 130.553 119.092 1.00 0.00 H TER 27501 WAT 4455 ATOM 27501 O WAT 4456 3.688 87.870 158.648 1.00 0.00 O ATOM 27502 H1 WAT 4456 3.360 88.552 159.234 1.00 0.00 H ATOM 27503 H2 WAT 4456 2.963 87.702 158.046 1.00 0.00 H TER 27505 WAT 4456 ATOM 27505 O WAT 4457 62.713 130.537 113.306 1.00 0.00 O ATOM 27506 H1 WAT 4457 63.483 130.963 113.683 1.00 0.00 H ATOM 27507 H2 WAT 4457 62.976 130.313 112.413 1.00 0.00 H TER 27509 WAT 4457 ATOM 27509 O WAT 4458 142.916 76.512 128.466 1.00 0.00 O ATOM 27510 H1 WAT 4458 142.637 77.426 128.407 1.00 0.00 H ATOM 27511 H2 WAT 4458 143.830 76.559 128.746 1.00 0.00 H TER 27513 WAT 4458 ATOM 27513 O WAT 4459 111.359 54.340 107.223 1.00 0.00 O ATOM 27514 H1 WAT 4459 110.712 54.450 107.920 1.00 0.00 H ATOM 27515 H2 WAT 4459 112.083 53.874 107.641 1.00 0.00 H TER 27517 WAT 4459 ATOM 27517 O WAT 4460 23.933 39.860 114.912 1.00 0.00 O ATOM 27518 H1 WAT 4460 23.858 39.680 115.849 1.00 0.00 H ATOM 27519 H2 WAT 4460 24.872 39.963 114.762 1.00 0.00 H TER 27521 WAT 4460 ATOM 27521 O WAT 4461 120.028 134.043 118.338 1.00 0.00 O ATOM 27522 H1 WAT 4461 119.509 134.063 119.143 1.00 0.00 H ATOM 27523 H2 WAT 4461 120.928 134.188 118.629 1.00 0.00 H TER 27525 WAT 4461 ATOM 27525 O WAT 4462 34.327 88.863 96.177 1.00 0.00 O ATOM 27526 H1 WAT 4462 33.748 89.114 96.896 1.00 0.00 H ATOM 27527 H2 WAT 4462 35.116 88.534 96.607 1.00 0.00 H TER 27529 WAT 4462 ATOM 27529 O WAT 4463 83.502 78.586 10.652 1.00 0.00 O ATOM 27530 H1 WAT 4463 84.342 78.925 10.344 1.00 0.00 H ATOM 27531 H2 WAT 4463 83.577 78.592 11.606 1.00 0.00 H TER 27533 WAT 4463 ATOM 27533 O WAT 4464 13.823 60.789 15.820 1.00 0.00 O ATOM 27534 H1 WAT 4464 13.231 60.038 15.782 1.00 0.00 H ATOM 27535 H2 WAT 4464 13.267 61.542 15.621 1.00 0.00 H TER 27537 WAT 4464 ATOM 27537 O WAT 4465 91.067 77.611 79.881 1.00 0.00 O ATOM 27538 H1 WAT 4465 90.895 78.181 80.630 1.00 0.00 H ATOM 27539 H2 WAT 4465 91.904 77.193 80.084 1.00 0.00 H TER 27541 WAT 4465 ATOM 27541 O WAT 4466 122.745 85.808 90.298 1.00 0.00 O ATOM 27542 H1 WAT 4466 123.588 86.248 90.412 1.00 0.00 H ATOM 27543 H2 WAT 4466 122.098 86.455 90.577 1.00 0.00 H TER 27545 WAT 4466 ATOM 27545 O WAT 4467 138.867 88.487 154.318 1.00 0.00 O ATOM 27546 H1 WAT 4467 138.119 89.077 154.228 1.00 0.00 H ATOM 27547 H2 WAT 4467 139.101 88.538 155.245 1.00 0.00 H TER 27549 WAT 4467 ATOM 27549 O WAT 4468 78.677 65.179 74.224 1.00 0.00 O ATOM 27550 H1 WAT 4468 79.393 65.032 73.606 1.00 0.00 H ATOM 27551 H2 WAT 4468 78.294 66.013 73.953 1.00 0.00 H TER 27553 WAT 4468 ATOM 27553 O WAT 4469 142.662 5.439 140.915 1.00 0.00 O ATOM 27554 H1 WAT 4469 141.760 5.738 140.801 1.00 0.00 H ATOM 27555 H2 WAT 4469 142.681 4.574 140.504 1.00 0.00 H TER 27557 WAT 4469 ATOM 27557 O WAT 4470 41.858 72.726 138.885 1.00 0.00 O ATOM 27558 H1 WAT 4470 42.450 73.044 138.203 1.00 0.00 H ATOM 27559 H2 WAT 4470 41.236 73.442 139.014 1.00 0.00 H TER 27561 WAT 4470 ATOM 27561 O WAT 4471 42.804 102.792 69.080 1.00 0.00 O ATOM 27562 H1 WAT 4471 43.575 103.299 69.333 1.00 0.00 H ATOM 27563 H2 WAT 4471 42.079 103.415 69.133 1.00 0.00 H TER 27565 WAT 4471 ATOM 27565 O WAT 4472 123.325 37.967 75.113 1.00 0.00 O ATOM 27566 H1 WAT 4472 123.109 37.069 74.862 1.00 0.00 H ATOM 27567 H2 WAT 4472 122.505 38.324 75.455 1.00 0.00 H TER 27569 WAT 4472 ATOM 27569 O WAT 4473 56.845 93.566 7.455 1.00 0.00 O ATOM 27570 H1 WAT 4473 57.258 94.427 7.387 1.00 0.00 H ATOM 27571 H2 WAT 4473 57.536 92.949 7.213 1.00 0.00 H TER 27573 WAT 4473 ATOM 27573 O WAT 4474 2.803 17.365 21.823 1.00 0.00 O ATOM 27574 H1 WAT 4474 2.440 16.708 21.229 1.00 0.00 H ATOM 27575 H2 WAT 4474 3.670 17.030 22.049 1.00 0.00 H TER 27577 WAT 4474 ATOM 27577 O WAT 4475 24.676 97.879 59.574 1.00 0.00 O ATOM 27578 H1 WAT 4475 24.139 98.203 58.851 1.00 0.00 H ATOM 27579 H2 WAT 4475 24.705 96.931 59.444 1.00 0.00 H TER 27581 WAT 4475 ATOM 27581 O WAT 4476 13.630 112.157 105.536 1.00 0.00 O ATOM 27582 H1 WAT 4476 13.428 112.499 104.665 1.00 0.00 H ATOM 27583 H2 WAT 4476 14.568 112.316 105.644 1.00 0.00 H TER 27585 WAT 4476 ATOM 27585 O WAT 4477 139.076 136.621 156.456 1.00 0.00 O ATOM 27586 H1 WAT 4477 138.965 135.688 156.637 1.00 0.00 H ATOM 27587 H2 WAT 4477 138.293 137.031 156.822 1.00 0.00 H TER 27589 WAT 4477 ATOM 27589 O WAT 4478 73.447 107.253 93.080 1.00 0.00 O ATOM 27590 H1 WAT 4478 73.240 106.364 92.793 1.00 0.00 H ATOM 27591 H2 WAT 4478 74.379 107.356 92.891 1.00 0.00 H TER 27593 WAT 4478 ATOM 27593 O WAT 4479 143.875 1.615 14.601 1.00 0.00 O ATOM 27594 H1 WAT 4479 143.303 2.150 15.150 1.00 0.00 H ATOM 27595 H2 WAT 4479 144.519 1.250 15.208 1.00 0.00 H TER 27597 WAT 4479 ATOM 27597 O WAT 4480 95.620 0.359 61.217 1.00 0.00 O ATOM 27598 H1 WAT 4480 95.895 0.810 62.016 1.00 0.00 H ATOM 27599 H2 WAT 4480 95.985 0.885 60.507 1.00 0.00 H TER 27601 WAT 4480 ATOM 27601 O WAT 4481 15.109 17.420 80.977 1.00 0.00 O ATOM 27602 H1 WAT 4481 15.182 16.477 81.125 1.00 0.00 H ATOM 27603 H2 WAT 4481 14.167 17.579 80.908 1.00 0.00 H TER 27605 WAT 4481 ATOM 27605 O WAT 4482 58.519 122.687 107.099 1.00 0.00 O ATOM 27606 H1 WAT 4482 59.330 122.664 106.593 1.00 0.00 H ATOM 27607 H2 WAT 4482 57.902 123.162 106.543 1.00 0.00 H TER 27609 WAT 4482 ATOM 27609 O WAT 4483 89.538 72.561 75.516 1.00 0.00 O ATOM 27610 H1 WAT 4483 89.380 72.273 74.616 1.00 0.00 H ATOM 27611 H2 WAT 4483 90.238 71.990 75.830 1.00 0.00 H TER 27613 WAT 4483 ATOM 27613 O WAT 4484 115.153 87.369 116.026 1.00 0.00 O ATOM 27614 H1 WAT 4484 115.968 87.331 115.526 1.00 0.00 H ATOM 27615 H2 WAT 4484 115.387 87.829 116.832 1.00 0.00 H TER 27617 WAT 4484 ATOM 27617 O WAT 4485 33.345 65.461 75.128 1.00 0.00 O ATOM 27618 H1 WAT 4485 33.064 65.938 75.908 1.00 0.00 H ATOM 27619 H2 WAT 4485 33.480 66.140 74.467 1.00 0.00 H TER 27621 WAT 4485 ATOM 27621 O WAT 4486 35.947 135.494 152.269 1.00 0.00 O ATOM 27622 H1 WAT 4486 35.945 136.224 151.649 1.00 0.00 H ATOM 27623 H2 WAT 4486 36.860 135.418 152.546 1.00 0.00 H TER 27625 WAT 4486 ATOM 27625 O WAT 4487 49.315 27.931 140.802 1.00 0.00 O ATOM 27626 H1 WAT 4487 49.532 28.150 141.708 1.00 0.00 H ATOM 27627 H2 WAT 4487 49.761 27.098 140.644 1.00 0.00 H TER 27629 WAT 4487 ATOM 27629 O WAT 4488 71.752 86.901 75.393 1.00 0.00 O ATOM 27630 H1 WAT 4488 72.300 86.600 76.118 1.00 0.00 H ATOM 27631 H2 WAT 4488 71.243 86.131 75.141 1.00 0.00 H TER 27633 WAT 4488 ATOM 27633 O WAT 4489 8.225 20.385 56.460 1.00 0.00 O ATOM 27634 H1 WAT 4489 8.293 19.454 56.251 1.00 0.00 H ATOM 27635 H2 WAT 4489 7.593 20.423 57.178 1.00 0.00 H TER 27637 WAT 4489 ATOM 27637 O WAT 4490 124.894 67.733 83.525 1.00 0.00 O ATOM 27638 H1 WAT 4490 125.286 68.378 84.113 1.00 0.00 H ATOM 27639 H2 WAT 4490 123.974 67.990 83.466 1.00 0.00 H TER 27641 WAT 4490 ATOM 27641 O WAT 4491 69.008 24.693 98.764 1.00 0.00 O ATOM 27642 H1 WAT 4491 69.612 24.626 98.024 1.00 0.00 H ATOM 27643 H2 WAT 4491 68.183 24.983 98.375 1.00 0.00 H TER 27645 WAT 4491 ATOM 27645 O WAT 4492 102.133 25.297 10.927 1.00 0.00 O ATOM 27646 H1 WAT 4492 101.559 25.516 10.193 1.00 0.00 H ATOM 27647 H2 WAT 4492 102.719 26.049 11.007 1.00 0.00 H TER 27649 WAT 4492 ATOM 27649 O WAT 4493 77.770 36.233 141.639 1.00 0.00 O ATOM 27650 H1 WAT 4493 76.876 35.899 141.558 1.00 0.00 H ATOM 27651 H2 WAT 4493 78.251 35.529 142.074 1.00 0.00 H TER 27653 WAT 4493 ATOM 27653 O WAT 4494 128.011 71.377 119.370 1.00 0.00 O ATOM 27654 H1 WAT 4494 128.778 71.756 118.940 1.00 0.00 H ATOM 27655 H2 WAT 4494 127.774 72.015 120.042 1.00 0.00 H TER 27657 WAT 4494 ATOM 27657 O WAT 4495 97.310 89.481 58.573 1.00 0.00 O ATOM 27658 H1 WAT 4495 96.482 89.782 58.198 1.00 0.00 H ATOM 27659 H2 WAT 4495 97.522 88.689 58.079 1.00 0.00 H TER 27661 WAT 4495 ATOM 27661 O WAT 4496 142.277 17.891 142.936 1.00 0.00 O ATOM 27662 H1 WAT 4496 141.903 18.204 143.760 1.00 0.00 H ATOM 27663 H2 WAT 4496 142.750 17.094 143.176 1.00 0.00 H TER 27665 WAT 4496 ATOM 27665 O WAT 4497 62.341 127.587 114.373 1.00 0.00 O ATOM 27666 H1 WAT 4497 63.066 127.957 114.878 1.00 0.00 H ATOM 27667 H2 WAT 4497 61.576 128.092 114.647 1.00 0.00 H TER 27669 WAT 4497 ATOM 27669 O WAT 4498 122.091 106.427 153.512 1.00 0.00 O ATOM 27670 H1 WAT 4498 122.770 106.059 154.077 1.00 0.00 H ATOM 27671 H2 WAT 4498 121.268 106.142 153.909 1.00 0.00 H TER 27673 WAT 4498 ATOM 27673 O WAT 4499 54.912 64.237 96.519 1.00 0.00 O ATOM 27674 H1 WAT 4499 55.207 63.711 97.262 1.00 0.00 H ATOM 27675 H2 WAT 4499 54.621 65.061 96.909 1.00 0.00 H TER 27677 WAT 4499 ATOM 27677 O WAT 4500 18.224 37.214 143.906 1.00 0.00 O ATOM 27678 H1 WAT 4500 18.427 37.473 144.805 1.00 0.00 H ATOM 27679 H2 WAT 4500 17.408 37.673 143.703 1.00 0.00 H TER 27681 WAT 4500 ATOM 27681 O WAT 4501 137.919 76.113 143.202 1.00 0.00 O ATOM 27682 H1 WAT 4501 137.926 75.667 142.355 1.00 0.00 H ATOM 27683 H2 WAT 4501 138.776 75.921 143.581 1.00 0.00 H TER 27685 WAT 4501 ATOM 27685 O WAT 4502 70.135 86.919 131.582 1.00 0.00 O ATOM 27686 H1 WAT 4502 71.062 86.950 131.347 1.00 0.00 H ATOM 27687 H2 WAT 4502 69.862 87.837 131.600 1.00 0.00 H TER 27689 WAT 4502 ATOM 27689 O WAT 4503 54.769 112.943 76.176 1.00 0.00 O ATOM 27690 H1 WAT 4503 55.413 113.341 75.590 1.00 0.00 H ATOM 27691 H2 WAT 4503 54.260 112.360 75.613 1.00 0.00 H TER 27693 WAT 4503 ATOM 27693 O WAT 4504 117.985 56.363 138.049 1.00 0.00 O ATOM 27694 H1 WAT 4504 118.751 56.490 138.609 1.00 0.00 H ATOM 27695 H2 WAT 4504 117.286 56.852 138.485 1.00 0.00 H TER 27697 WAT 4504 ATOM 27697 O WAT 4505 104.450 95.762 114.069 1.00 0.00 O ATOM 27698 H1 WAT 4505 104.879 96.112 114.849 1.00 0.00 H ATOM 27699 H2 WAT 4505 104.390 94.820 114.230 1.00 0.00 H TER 27701 WAT 4505 ATOM 27701 O WAT 4506 95.345 83.709 81.222 1.00 0.00 O ATOM 27702 H1 WAT 4506 95.111 83.334 82.071 1.00 0.00 H ATOM 27703 H2 WAT 4506 96.302 83.681 81.203 1.00 0.00 H TER 27705 WAT 4506 ATOM 27705 O WAT 4507 0.210 0.701 97.581 1.00 0.00 O ATOM 27706 H1 WAT 4507 -0.108 -0.191 97.717 1.00 0.00 H ATOM 27707 H2 WAT 4507 0.019 0.887 96.662 1.00 0.00 H TER 27709 WAT 4507 ATOM 27709 O WAT 4508 86.151 94.090 85.953 1.00 0.00 O ATOM 27710 H1 WAT 4508 86.618 94.135 85.118 1.00 0.00 H ATOM 27711 H2 WAT 4508 85.973 93.158 86.078 1.00 0.00 H TER 27713 WAT 4508 ATOM 27713 O WAT 4509 93.815 80.400 100.434 1.00 0.00 O ATOM 27714 H1 WAT 4509 94.279 80.216 99.617 1.00 0.00 H ATOM 27715 H2 WAT 4509 94.185 81.228 100.739 1.00 0.00 H TER 27717 WAT 4509 ATOM 27717 O WAT 4510 71.850 24.733 64.149 1.00 0.00 O ATOM 27718 H1 WAT 4510 72.643 25.205 64.403 1.00 0.00 H ATOM 27719 H2 WAT 4510 71.593 24.256 64.938 1.00 0.00 H TER 27721 WAT 4510 ATOM 27721 O WAT 4511 122.189 36.592 71.091 1.00 0.00 O ATOM 27722 H1 WAT 4511 122.916 36.061 71.416 1.00 0.00 H ATOM 27723 H2 WAT 4511 122.499 37.494 71.166 1.00 0.00 H TER 27725 WAT 4511 ATOM 27725 O WAT 4512 105.529 44.049 27.028 1.00 0.00 O ATOM 27726 H1 WAT 4512 105.409 44.611 26.263 1.00 0.00 H ATOM 27727 H2 WAT 4512 105.782 43.201 26.664 1.00 0.00 H TER 27729 WAT 4512 ATOM 27729 O WAT 4513 106.318 135.652 115.396 1.00 0.00 O ATOM 27730 H1 WAT 4513 106.188 134.884 114.840 1.00 0.00 H ATOM 27731 H2 WAT 4513 105.565 136.213 115.210 1.00 0.00 H TER 27733 WAT 4513 ATOM 27733 O WAT 4514 14.039 24.231 112.770 1.00 0.00 O ATOM 27734 H1 WAT 4514 14.690 23.571 112.529 1.00 0.00 H ATOM 27735 H2 WAT 4514 13.257 23.726 112.993 1.00 0.00 H TER 27737 WAT 4514 ATOM 27737 O WAT 4515 20.543 7.193 14.044 1.00 0.00 O ATOM 27738 H1 WAT 4515 21.336 7.719 13.938 1.00 0.00 H ATOM 27739 H2 WAT 4515 20.780 6.331 13.701 1.00 0.00 H TER 27741 WAT 4515 ATOM 27741 O WAT 4516 98.843 91.186 153.728 1.00 0.00 O ATOM 27742 H1 WAT 4516 99.203 91.835 153.123 1.00 0.00 H ATOM 27743 H2 WAT 4516 99.576 90.961 154.301 1.00 0.00 H TER 27745 WAT 4516 ATOM 27745 O WAT 4517 106.609 86.202 124.618 1.00 0.00 O ATOM 27746 H1 WAT 4517 106.443 86.518 125.506 1.00 0.00 H ATOM 27747 H2 WAT 4517 106.288 86.904 124.051 1.00 0.00 H TER 27749 WAT 4517 ATOM 27749 O WAT 4518 136.380 139.833 69.403 1.00 0.00 O ATOM 27750 H1 WAT 4518 135.576 139.480 69.021 1.00 0.00 H ATOM 27751 H2 WAT 4518 136.907 140.099 68.649 1.00 0.00 H TER 27753 WAT 4518 ATOM 27753 O WAT 4519 83.023 29.036 126.596 1.00 0.00 O ATOM 27754 H1 WAT 4519 83.301 29.109 125.683 1.00 0.00 H ATOM 27755 H2 WAT 4519 82.645 28.160 126.662 1.00 0.00 H TER 27757 WAT 4519 ATOM 27757 O WAT 4520 37.595 130.848 69.285 1.00 0.00 O ATOM 27758 H1 WAT 4520 37.374 129.991 69.649 1.00 0.00 H ATOM 27759 H2 WAT 4520 36.764 131.189 68.954 1.00 0.00 H TER 27761 WAT 4520 ATOM 27761 O WAT 4521 106.281 70.059 80.571 1.00 0.00 O ATOM 27762 H1 WAT 4521 106.438 69.339 79.961 1.00 0.00 H ATOM 27763 H2 WAT 4521 107.155 70.380 80.793 1.00 0.00 H TER 27765 WAT 4521 ATOM 27765 O WAT 4522 67.771 120.552 62.983 1.00 0.00 O ATOM 27766 H1 WAT 4522 67.842 120.816 63.901 1.00 0.00 H ATOM 27767 H2 WAT 4522 68.494 121.003 62.548 1.00 0.00 H TER 27769 WAT 4522 ATOM 27769 O WAT 4523 7.094 38.022 156.286 1.00 0.00 O ATOM 27770 H1 WAT 4523 6.356 38.233 155.715 1.00 0.00 H ATOM 27771 H2 WAT 4523 6.702 37.549 157.020 1.00 0.00 H TER 27773 WAT 4523 ATOM 27773 O WAT 4524 5.221 75.581 145.635 1.00 0.00 O ATOM 27774 H1 WAT 4524 5.824 76.098 146.169 1.00 0.00 H ATOM 27775 H2 WAT 4524 4.708 76.232 145.156 1.00 0.00 H TER 27777 WAT 4524 ATOM 27777 O WAT 4525 48.121 24.523 125.205 1.00 0.00 O ATOM 27778 H1 WAT 4525 48.104 24.017 124.393 1.00 0.00 H ATOM 27779 H2 WAT 4525 47.874 23.895 125.884 1.00 0.00 H TER 27781 WAT 4525 ATOM 27781 O WAT 4526 143.153 134.632 151.666 1.00 0.00 O ATOM 27782 H1 WAT 4526 143.963 134.362 151.235 1.00 0.00 H ATOM 27783 H2 WAT 4526 142.889 133.869 152.180 1.00 0.00 H TER 27785 WAT 4526 ATOM 27785 O WAT 4527 13.605 122.429 56.909 1.00 0.00 O ATOM 27786 H1 WAT 4527 13.179 122.938 57.599 1.00 0.00 H ATOM 27787 H2 WAT 4527 14.432 122.144 57.298 1.00 0.00 H TER 27789 WAT 4527 ATOM 27789 O WAT 4528 18.618 55.709 141.569 1.00 0.00 O ATOM 27790 H1 WAT 4528 19.573 55.757 141.519 1.00 0.00 H ATOM 27791 H2 WAT 4528 18.441 55.364 142.444 1.00 0.00 H TER 27793 WAT 4528 ATOM 27793 O WAT 4529 116.352 42.009 108.017 1.00 0.00 O ATOM 27794 H1 WAT 4529 116.132 41.400 108.722 1.00 0.00 H ATOM 27795 H2 WAT 4529 116.183 41.516 107.214 1.00 0.00 H TER 27797 WAT 4529 ATOM 27797 O WAT 4530 40.251 112.306 6.619 1.00 0.00 O ATOM 27798 H1 WAT 4530 40.492 112.943 7.291 1.00 0.00 H ATOM 27799 H2 WAT 4530 40.893 112.438 5.922 1.00 0.00 H TER 27801 WAT 4530 ATOM 27801 O WAT 4531 21.796 88.998 144.888 1.00 0.00 O ATOM 27802 H1 WAT 4531 20.980 89.202 145.345 1.00 0.00 H ATOM 27803 H2 WAT 4531 22.265 89.831 144.851 1.00 0.00 H TER 27805 WAT 4531 ATOM 27805 O WAT 4532 23.650 35.048 131.674 1.00 0.00 O ATOM 27806 H1 WAT 4532 23.490 34.104 131.688 1.00 0.00 H ATOM 27807 H2 WAT 4532 23.517 35.327 132.580 1.00 0.00 H TER 27809 WAT 4532 ATOM 27809 O WAT 4533 12.487 58.259 76.582 1.00 0.00 O ATOM 27810 H1 WAT 4533 13.292 58.058 77.060 1.00 0.00 H ATOM 27811 H2 WAT 4533 11.850 58.468 77.265 1.00 0.00 H TER 27813 WAT 4533 ATOM 27813 O WAT 4534 144.369 32.626 131.177 1.00 0.00 O ATOM 27814 H1 WAT 4534 144.893 33.368 130.877 1.00 0.00 H ATOM 27815 H2 WAT 4534 144.839 32.295 131.942 1.00 0.00 H TER 27817 WAT 4534 ATOM 27817 O WAT 4535 38.262 92.401 21.015 1.00 0.00 O ATOM 27818 H1 WAT 4535 37.623 92.368 21.727 1.00 0.00 H ATOM 27819 H2 WAT 4535 38.626 91.517 20.978 1.00 0.00 H TER 27821 WAT 4535 ATOM 27821 O WAT 4536 84.426 23.421 97.813 1.00 0.00 O ATOM 27822 H1 WAT 4536 83.865 24.067 98.243 1.00 0.00 H ATOM 27823 H2 WAT 4536 84.453 22.684 98.422 1.00 0.00 H TER 27825 WAT 4536 ATOM 27825 O WAT 4537 30.423 34.747 155.074 1.00 0.00 O ATOM 27826 H1 WAT 4537 30.505 35.700 155.101 1.00 0.00 H ATOM 27827 H2 WAT 4537 30.662 34.511 154.178 1.00 0.00 H TER 27829 WAT 4537 ATOM 27829 O WAT 4538 44.115 10.921 128.243 1.00 0.00 O ATOM 27830 H1 WAT 4538 43.215 10.845 127.927 1.00 0.00 H ATOM 27831 H2 WAT 4538 44.647 10.536 127.547 1.00 0.00 H TER 27833 WAT 4538 ATOM 27833 O WAT 4539 49.859 131.974 95.361 1.00 0.00 O ATOM 27834 H1 WAT 4539 50.729 132.231 95.055 1.00 0.00 H ATOM 27835 H2 WAT 4539 49.572 132.705 95.908 1.00 0.00 H TER 27837 WAT 4539 ATOM 27837 O WAT 4540 89.192 117.822 125.641 1.00 0.00 O ATOM 27838 H1 WAT 4540 89.474 117.212 124.958 1.00 0.00 H ATOM 27839 H2 WAT 4540 89.851 118.515 125.630 1.00 0.00 H TER 27841 WAT 4540 ATOM 27841 O WAT 4541 137.046 32.780 81.448 1.00 0.00 O ATOM 27842 H1 WAT 4541 137.924 32.486 81.204 1.00 0.00 H ATOM 27843 H2 WAT 4541 136.796 32.212 82.176 1.00 0.00 H TER 27845 WAT 4541 ATOM 27845 O WAT 4542 84.902 64.946 8.551 1.00 0.00 O ATOM 27846 H1 WAT 4542 84.850 65.714 9.120 1.00 0.00 H ATOM 27847 H2 WAT 4542 84.491 65.226 7.733 1.00 0.00 H TER 27849 WAT 4542 ATOM 27849 O WAT 4543 37.334 145.240 132.359 1.00 0.00 O ATOM 27850 H1 WAT 4543 37.067 145.158 133.275 1.00 0.00 H ATOM 27851 H2 WAT 4543 37.854 146.043 132.332 1.00 0.00 H TER 27853 WAT 4543 ATOM 27853 O WAT 4544 16.656 39.648 87.048 1.00 0.00 O ATOM 27854 H1 WAT 4544 15.950 40.039 86.535 1.00 0.00 H ATOM 27855 H2 WAT 4544 16.433 39.851 87.957 1.00 0.00 H TER 27857 WAT 4544 ATOM 27857 O WAT 4545 77.765 143.468 77.849 1.00 0.00 O ATOM 27858 H1 WAT 4545 77.063 143.638 78.477 1.00 0.00 H ATOM 27859 H2 WAT 4545 77.364 142.903 77.189 1.00 0.00 H TER 27861 WAT 4545 ATOM 27861 O WAT 4546 93.429 21.793 97.468 1.00 0.00 O ATOM 27862 H1 WAT 4546 93.437 22.537 96.866 1.00 0.00 H ATOM 27863 H2 WAT 4546 92.698 21.973 98.060 1.00 0.00 H TER 27865 WAT 4546 ATOM 27865 O WAT 4547 55.640 40.767 137.981 1.00 0.00 O ATOM 27866 H1 WAT 4547 55.680 40.003 137.405 1.00 0.00 H ATOM 27867 H2 WAT 4547 54.704 40.939 138.086 1.00 0.00 H TER 27869 WAT 4547 ATOM 27869 O WAT 4548 144.611 82.022 139.243 1.00 0.00 O ATOM 27870 H1 WAT 4548 145.108 82.689 139.716 1.00 0.00 H ATOM 27871 H2 WAT 4548 145.069 81.203 139.431 1.00 0.00 H TER 27873 WAT 4548 ATOM 27873 O WAT 4549 38.791 1.345 73.394 1.00 0.00 O ATOM 27874 H1 WAT 4549 39.065 0.651 73.994 1.00 0.00 H ATOM 27875 H2 WAT 4549 39.144 2.147 73.778 1.00 0.00 H TER 27877 WAT 4549 ATOM 27877 O WAT 4550 132.555 48.076 105.311 1.00 0.00 O ATOM 27878 H1 WAT 4550 131.940 48.249 104.599 1.00 0.00 H ATOM 27879 H2 WAT 4550 132.640 48.915 105.763 1.00 0.00 H TER 27881 WAT 4550 ATOM 27881 O WAT 4551 119.999 96.461 8.768 1.00 0.00 O ATOM 27882 H1 WAT 4551 120.478 95.756 8.332 1.00 0.00 H ATOM 27883 H2 WAT 4551 119.248 96.027 9.173 1.00 0.00 H TER 27885 WAT 4551 ATOM 27885 O WAT 4552 125.360 100.480 91.939 1.00 0.00 O ATOM 27886 H1 WAT 4552 125.476 100.982 91.132 1.00 0.00 H ATOM 27887 H2 WAT 4552 125.567 99.578 91.692 1.00 0.00 H TER 27889 WAT 4552 ATOM 27889 O WAT 4553 55.559 67.062 157.060 1.00 0.00 O ATOM 27890 H1 WAT 4553 56.409 67.216 156.648 1.00 0.00 H ATOM 27891 H2 WAT 4553 55.681 66.259 157.568 1.00 0.00 H TER 27893 WAT 4553 ATOM 27893 O WAT 4554 38.855 59.392 129.640 1.00 0.00 O ATOM 27894 H1 WAT 4554 39.581 58.964 130.093 1.00 0.00 H ATOM 27895 H2 WAT 4554 38.264 59.666 130.341 1.00 0.00 H TER 27897 WAT 4554 ATOM 27897 O WAT 4555 43.680 24.408 114.160 1.00 0.00 O ATOM 27898 H1 WAT 4555 44.016 25.112 114.714 1.00 0.00 H ATOM 27899 H2 WAT 4555 44.461 24.012 113.774 1.00 0.00 H TER 27901 WAT 4555 ATOM 27901 O WAT 4556 130.727 56.759 113.488 1.00 0.00 O ATOM 27902 H1 WAT 4556 130.105 56.886 112.772 1.00 0.00 H ATOM 27903 H2 WAT 4556 130.797 55.808 113.577 1.00 0.00 H TER 27905 WAT 4556 ATOM 27905 O WAT 4557 104.386 33.339 18.661 1.00 0.00 O ATOM 27906 H1 WAT 4557 104.487 33.105 19.583 1.00 0.00 H ATOM 27907 H2 WAT 4557 103.440 33.415 18.535 1.00 0.00 H TER 27909 WAT 4557 ATOM 27909 O WAT 4558 36.311 39.292 155.376 1.00 0.00 O ATOM 27910 H1 WAT 4558 36.956 38.730 155.805 1.00 0.00 H ATOM 27911 H2 WAT 4558 36.654 39.417 154.491 1.00 0.00 H TER 27913 WAT 4558 ATOM 27913 O WAT 4559 10.241 95.999 92.986 1.00 0.00 O ATOM 27914 H1 WAT 4559 11.127 96.300 92.781 1.00 0.00 H ATOM 27915 H2 WAT 4559 10.351 95.081 93.233 1.00 0.00 H TER 27917 WAT 4559 ATOM 27917 O WAT 4560 110.070 60.901 2.429 1.00 0.00 O ATOM 27918 H1 WAT 4560 109.693 61.508 3.066 1.00 0.00 H ATOM 27919 H2 WAT 4560 110.816 60.510 2.883 1.00 0.00 H TER 27921 WAT 4560 ATOM 27921 O WAT 4561 95.309 2.945 0.908 1.00 0.00 O ATOM 27922 H1 WAT 4561 94.394 2.666 0.875 1.00 0.00 H ATOM 27923 H2 WAT 4561 95.809 2.149 0.727 1.00 0.00 H TER 27925 WAT 4561 ATOM 27925 O WAT 4562 122.361 117.713 132.445 1.00 0.00 O ATOM 27926 H1 WAT 4562 123.264 117.606 132.147 1.00 0.00 H ATOM 27927 H2 WAT 4562 121.834 117.268 131.781 1.00 0.00 H TER 27929 WAT 4562 ATOM 27929 O WAT 4563 127.748 107.041 135.903 1.00 0.00 O ATOM 27930 H1 WAT 4563 128.328 107.352 135.208 1.00 0.00 H ATOM 27931 H2 WAT 4563 128.333 106.620 136.532 1.00 0.00 H TER 27933 WAT 4563 ATOM 27933 O WAT 4564 126.427 93.122 83.973 1.00 0.00 O ATOM 27934 H1 WAT 4564 125.937 92.991 83.162 1.00 0.00 H ATOM 27935 H2 WAT 4564 127.319 92.846 83.762 1.00 0.00 H TER 27937 WAT 4564 ATOM 27937 O WAT 4565 129.186 111.179 107.462 1.00 0.00 O ATOM 27938 H1 WAT 4565 129.287 110.682 108.273 1.00 0.00 H ATOM 27939 H2 WAT 4565 129.661 110.667 106.807 1.00 0.00 H TER 27941 WAT 4565 ATOM 27941 O WAT 4566 97.293 88.123 17.070 1.00 0.00 O ATOM 27942 H1 WAT 4566 98.248 88.074 17.029 1.00 0.00 H ATOM 27943 H2 WAT 4566 96.993 87.373 16.557 1.00 0.00 H TER 27945 WAT 4566 ATOM 27945 O WAT 4567 135.174 113.936 137.397 1.00 0.00 O ATOM 27946 H1 WAT 4567 135.752 113.278 137.010 1.00 0.00 H ATOM 27947 H2 WAT 4567 135.146 113.713 138.327 1.00 0.00 H TER 27949 WAT 4567 ATOM 27949 O WAT 4568 94.838 0.076 71.057 1.00 0.00 O ATOM 27950 H1 WAT 4568 94.343 -0.664 70.706 1.00 0.00 H ATOM 27951 H2 WAT 4568 94.233 0.816 71.004 1.00 0.00 H TER 27953 WAT 4568 ATOM 27953 O WAT 4569 131.403 101.355 5.170 1.00 0.00 O ATOM 27954 H1 WAT 4569 132.316 101.163 4.957 1.00 0.00 H ATOM 27955 H2 WAT 4569 131.024 101.659 4.346 1.00 0.00 H TER 27957 WAT 4569 ATOM 27957 O WAT 4570 16.613 68.199 123.549 1.00 0.00 O ATOM 27958 H1 WAT 4570 16.998 67.496 123.026 1.00 0.00 H ATOM 27959 H2 WAT 4570 15.697 67.943 123.656 1.00 0.00 H TER 27961 WAT 4570 ATOM 27961 O WAT 4571 101.868 13.497 64.408 1.00 0.00 O ATOM 27962 H1 WAT 4571 102.652 13.709 63.900 1.00 0.00 H ATOM 27963 H2 WAT 4571 102.081 13.767 65.301 1.00 0.00 H TER 27965 WAT 4571 ATOM 27965 O WAT 4572 59.507 72.794 141.181 1.00 0.00 O ATOM 27966 H1 WAT 4572 58.846 72.464 141.790 1.00 0.00 H ATOM 27967 H2 WAT 4572 59.443 72.215 140.422 1.00 0.00 H TER 27969 WAT 4572 ATOM 27969 O WAT 4573 87.602 101.828 156.338 1.00 0.00 O ATOM 27970 H1 WAT 4573 87.429 101.795 157.279 1.00 0.00 H ATOM 27971 H2 WAT 4573 86.738 101.765 155.933 1.00 0.00 H TER 27973 WAT 4573 ATOM 27973 O WAT 4574 2.536 33.659 84.013 1.00 0.00 O ATOM 27974 H1 WAT 4574 1.686 33.283 83.785 1.00 0.00 H ATOM 27975 H2 WAT 4574 3.174 33.055 83.631 1.00 0.00 H TER 27977 WAT 4574 ATOM 27977 O WAT 4575 55.171 41.925 94.084 1.00 0.00 O ATOM 27978 H1 WAT 4575 56.103 41.719 94.156 1.00 0.00 H ATOM 27979 H2 WAT 4575 55.095 42.816 94.425 1.00 0.00 H TER 27981 WAT 4575 ATOM 27981 O WAT 4576 136.599 60.694 96.456 1.00 0.00 O ATOM 27982 H1 WAT 4576 136.414 61.450 97.014 1.00 0.00 H ATOM 27983 H2 WAT 4576 135.803 60.579 95.937 1.00 0.00 H TER 27985 WAT 4576 ATOM 27985 O WAT 4577 49.867 16.404 87.021 1.00 0.00 O ATOM 27986 H1 WAT 4577 49.293 17.164 86.923 1.00 0.00 H ATOM 27987 H2 WAT 4577 50.097 16.161 86.124 1.00 0.00 H TER 27989 WAT 4577 ATOM 27989 O WAT 4578 6.405 53.831 137.212 1.00 0.00 O ATOM 27990 H1 WAT 4578 6.465 53.830 136.256 1.00 0.00 H ATOM 27991 H2 WAT 4578 7.260 53.517 137.506 1.00 0.00 H TER 27993 WAT 4578 ATOM 27993 O WAT 4579 84.281 72.180 139.591 1.00 0.00 O ATOM 27994 H1 WAT 4579 84.369 72.054 140.536 1.00 0.00 H ATOM 27995 H2 WAT 4579 84.353 71.299 139.224 1.00 0.00 H TER 27997 WAT 4579 ATOM 27997 O WAT 4580 143.931 99.616 76.420 1.00 0.00 O ATOM 27998 H1 WAT 4580 144.833 99.498 76.123 1.00 0.00 H ATOM 27999 H2 WAT 4580 143.409 99.586 75.618 1.00 0.00 H TER 28001 WAT 4580 ATOM 28001 O WAT 4581 63.609 124.579 155.669 1.00 0.00 O ATOM 28002 H1 WAT 4581 63.021 125.313 155.848 1.00 0.00 H ATOM 28003 H2 WAT 4581 64.180 124.538 156.437 1.00 0.00 H TER 28005 WAT 4581 ATOM 28005 O WAT 4582 37.828 133.180 118.091 1.00 0.00 O ATOM 28006 H1 WAT 4582 37.687 132.382 118.600 1.00 0.00 H ATOM 28007 H2 WAT 4582 37.506 132.967 117.215 1.00 0.00 H TER 28009 WAT 4582 ATOM 28009 O WAT 4583 70.520 58.150 124.043 1.00 0.00 O ATOM 28010 H1 WAT 4583 71.084 58.918 123.949 1.00 0.00 H ATOM 28011 H2 WAT 4583 70.161 58.224 124.928 1.00 0.00 H TER 28013 WAT 4583 ATOM 28013 O WAT 4584 132.585 84.799 3.757 1.00 0.00 O ATOM 28014 H1 WAT 4584 132.854 84.032 4.262 1.00 0.00 H ATOM 28015 H2 WAT 4584 131.706 85.001 4.078 1.00 0.00 H TER 28017 WAT 4584 ATOM 28017 O WAT 4585 116.672 49.860 107.964 1.00 0.00 O ATOM 28018 H1 WAT 4585 116.112 49.738 107.197 1.00 0.00 H ATOM 28019 H2 WAT 4585 116.173 49.481 108.687 1.00 0.00 H TER 28021 WAT 4585 ATOM 28021 O WAT 4586 49.389 141.245 144.056 1.00 0.00 O ATOM 28022 H1 WAT 4586 50.259 140.999 143.743 1.00 0.00 H ATOM 28023 H2 WAT 4586 48.977 141.675 143.306 1.00 0.00 H TER 28025 WAT 4586 ATOM 28025 O WAT 4587 11.779 110.213 96.090 1.00 0.00 O ATOM 28026 H1 WAT 4587 12.442 110.903 96.052 1.00 0.00 H ATOM 28027 H2 WAT 4587 11.998 109.715 96.878 1.00 0.00 H TER 28029 WAT 4587 ATOM 28029 O WAT 4588 143.202 38.019 79.702 1.00 0.00 O ATOM 28030 H1 WAT 4588 143.063 37.497 78.912 1.00 0.00 H ATOM 28031 H2 WAT 4588 144.048 38.445 79.562 1.00 0.00 H TER 28033 WAT 4588 ATOM 28033 O WAT 4589 25.174 81.460 87.000 1.00 0.00 O ATOM 28034 H1 WAT 4589 25.990 81.666 86.544 1.00 0.00 H ATOM 28035 H2 WAT 4589 24.724 82.302 87.075 1.00 0.00 H TER 28037 WAT 4589 ATOM 28037 O WAT 4590 75.628 94.854 61.307 1.00 0.00 O ATOM 28038 H1 WAT 4590 75.899 93.998 61.640 1.00 0.00 H ATOM 28039 H2 WAT 4590 75.097 94.655 60.536 1.00 0.00 H TER 28041 WAT 4590 ATOM 28041 O WAT 4591 101.224 45.938 82.733 1.00 0.00 O ATOM 28042 H1 WAT 4591 100.864 45.924 83.620 1.00 0.00 H ATOM 28043 H2 WAT 4591 101.799 46.703 82.721 1.00 0.00 H TER 28045 WAT 4591 ATOM 28045 O WAT 4592 8.455 36.223 121.241 1.00 0.00 O ATOM 28046 H1 WAT 4592 9.084 36.939 121.325 1.00 0.00 H ATOM 28047 H2 WAT 4592 7.634 36.651 120.999 1.00 0.00 H TER 28049 WAT 4592 ATOM 28049 O WAT 4593 118.101 89.739 19.527 1.00 0.00 O ATOM 28050 H1 WAT 4593 117.629 89.938 18.719 1.00 0.00 H ATOM 28051 H2 WAT 4593 118.005 90.528 20.061 1.00 0.00 H TER 28053 WAT 4593 ATOM 28053 O WAT 4594 17.816 127.644 136.278 1.00 0.00 O ATOM 28054 H1 WAT 4594 16.909 127.418 136.075 1.00 0.00 H ATOM 28055 H2 WAT 4594 18.242 126.803 136.442 1.00 0.00 H TER 28057 WAT 4594 ATOM 28057 O WAT 4595 18.442 11.446 115.953 1.00 0.00 O ATOM 28058 H1 WAT 4595 17.488 11.386 115.993 1.00 0.00 H ATOM 28059 H2 WAT 4595 18.726 11.366 116.863 1.00 0.00 H TER 28061 WAT 4595 ATOM 28061 O WAT 4596 94.089 23.102 158.505 1.00 0.00 O ATOM 28062 H1 WAT 4596 93.182 23.151 158.205 1.00 0.00 H ATOM 28063 H2 WAT 4596 94.405 22.260 158.177 1.00 0.00 H TER 28065 WAT 4596 ATOM 28065 O WAT 4597 98.364 39.435 51.716 1.00 0.00 O ATOM 28066 H1 WAT 4597 97.697 38.754 51.810 1.00 0.00 H ATOM 28067 H2 WAT 4597 97.894 40.180 51.342 1.00 0.00 H TER 28069 WAT 4597 ATOM 28069 O WAT 4598 61.607 24.954 102.746 1.00 0.00 O ATOM 28070 H1 WAT 4598 60.988 25.073 102.026 1.00 0.00 H ATOM 28071 H2 WAT 4598 61.163 25.327 103.508 1.00 0.00 H TER 28073 WAT 4598 ATOM 28073 O WAT 4599 138.730 94.915 107.357 1.00 0.00 O ATOM 28074 H1 WAT 4599 138.522 94.792 106.431 1.00 0.00 H ATOM 28075 H2 WAT 4599 138.717 95.864 107.482 1.00 0.00 H TER 28077 WAT 4599 ATOM 28077 O WAT 4600 117.714 46.320 150.441 1.00 0.00 O ATOM 28078 H1 WAT 4600 118.421 46.757 149.966 1.00 0.00 H ATOM 28079 H2 WAT 4600 116.987 46.294 149.818 1.00 0.00 H TER 28081 WAT 4600 ATOM 28081 O WAT 4601 29.098 14.199 97.666 1.00 0.00 O ATOM 28082 H1 WAT 4601 29.563 14.550 96.906 1.00 0.00 H ATOM 28083 H2 WAT 4601 29.476 13.330 97.798 1.00 0.00 H TER 28085 WAT 4601 ATOM 28085 O WAT 4602 58.460 74.843 1.298 1.00 0.00 O ATOM 28086 H1 WAT 4602 59.288 75.299 1.446 1.00 0.00 H ATOM 28087 H2 WAT 4602 57.997 75.387 0.661 1.00 0.00 H TER 28089 WAT 4602 ATOM 28089 O WAT 4603 75.870 36.280 16.369 1.00 0.00 O ATOM 28090 H1 WAT 4603 76.315 36.540 17.176 1.00 0.00 H ATOM 28091 H2 WAT 4603 76.561 35.901 15.826 1.00 0.00 H TER 28093 WAT 4603 ATOM 28093 O WAT 4604 68.663 86.090 2.274 1.00 0.00 O ATOM 28094 H1 WAT 4604 67.786 86.052 1.892 1.00 0.00 H ATOM 28095 H2 WAT 4604 68.665 86.898 2.787 1.00 0.00 H TER 28097 WAT 4604 ATOM 28097 O WAT 4605 37.754 100.148 110.259 1.00 0.00 O ATOM 28098 H1 WAT 4605 37.024 100.165 109.640 1.00 0.00 H ATOM 28099 H2 WAT 4605 38.105 101.038 110.240 1.00 0.00 H TER 28101 WAT 4605 ATOM 28101 O WAT 4606 114.249 64.908 122.566 1.00 0.00 O ATOM 28102 H1 WAT 4606 114.463 65.454 121.809 1.00 0.00 H ATOM 28103 H2 WAT 4606 114.132 65.529 123.284 1.00 0.00 H TER 28105 WAT 4606 ATOM 28105 O WAT 4607 42.065 76.916 147.233 1.00 0.00 O ATOM 28106 H1 WAT 4607 42.384 77.735 146.853 1.00 0.00 H ATOM 28107 H2 WAT 4607 41.709 76.430 146.490 1.00 0.00 H TER 28109 WAT 4607 ATOM 28109 O WAT 4608 2.488 64.200 89.880 1.00 0.00 O ATOM 28110 H1 WAT 4608 2.289 64.029 88.959 1.00 0.00 H ATOM 28111 H2 WAT 4608 3.443 64.178 89.927 1.00 0.00 H TER 28113 WAT 4608 ATOM 28113 O WAT 4609 30.841 73.769 114.337 1.00 0.00 O ATOM 28114 H1 WAT 4609 30.787 73.635 115.283 1.00 0.00 H ATOM 28115 H2 WAT 4609 31.563 74.387 114.223 1.00 0.00 H TER 28117 WAT 4609 ATOM 28117 O WAT 4610 19.682 7.533 112.336 1.00 0.00 O ATOM 28118 H1 WAT 4610 20.181 7.568 111.520 1.00 0.00 H ATOM 28119 H2 WAT 4610 20.145 8.129 112.925 1.00 0.00 H TER 28121 WAT 4610 ATOM 28121 O WAT 4611 145.435 113.308 101.929 1.00 0.00 O ATOM 28122 H1 WAT 4611 145.793 112.467 101.643 1.00 0.00 H ATOM 28123 H2 WAT 4611 144.546 113.103 102.219 1.00 0.00 H TER 28125 WAT 4611 ATOM 28125 O WAT 4612 85.403 61.017 104.783 1.00 0.00 O ATOM 28126 H1 WAT 4612 84.829 61.329 104.083 1.00 0.00 H ATOM 28127 H2 WAT 4612 85.997 60.404 104.350 1.00 0.00 H TER 28129 WAT 4612 ATOM 28129 O WAT 4613 0.132 2.199 139.546 1.00 0.00 O ATOM 28130 H1 WAT 4613 0.398 2.146 138.629 1.00 0.00 H ATOM 28131 H2 WAT 4613 0.510 1.419 139.951 1.00 0.00 H TER 28133 WAT 4613 ATOM 28133 O WAT 4614 60.513 60.665 133.320 1.00 0.00 O ATOM 28134 H1 WAT 4614 60.600 61.564 133.636 1.00 0.00 H ATOM 28135 H2 WAT 4614 61.199 60.576 132.658 1.00 0.00 H TER 28137 WAT 4614 ATOM 28137 O WAT 4615 93.879 51.672 17.868 1.00 0.00 O ATOM 28138 H1 WAT 4615 94.611 51.803 17.265 1.00 0.00 H ATOM 28139 H2 WAT 4615 94.293 51.500 18.714 1.00 0.00 H TER 28141 WAT 4615 ATOM 28141 O WAT 4616 44.725 45.336 8.628 1.00 0.00 O ATOM 28142 H1 WAT 4616 45.324 45.950 9.053 1.00 0.00 H ATOM 28143 H2 WAT 4616 44.656 45.655 7.727 1.00 0.00 H TER 28145 WAT 4616 ATOM 28145 O WAT 4617 90.708 71.338 126.848 1.00 0.00 O ATOM 28146 H1 WAT 4617 91.545 71.089 127.239 1.00 0.00 H ATOM 28147 H2 WAT 4617 90.172 70.547 126.906 1.00 0.00 H TER 28149 WAT 4617 ATOM 28149 O WAT 4618 82.790 31.609 118.915 1.00 0.00 O ATOM 28150 H1 WAT 4618 82.831 32.029 119.775 1.00 0.00 H ATOM 28151 H2 WAT 4618 83.623 31.144 118.836 1.00 0.00 H TER 28153 WAT 4618 ATOM 28153 O WAT 4619 79.412 33.480 57.581 1.00 0.00 O ATOM 28154 H1 WAT 4619 80.106 33.769 56.988 1.00 0.00 H ATOM 28155 H2 WAT 4619 79.473 32.525 57.574 1.00 0.00 H TER 28157 WAT 4619 ATOM 28157 O WAT 4620 99.024 132.358 122.412 1.00 0.00 O ATOM 28158 H1 WAT 4620 99.777 132.841 122.072 1.00 0.00 H ATOM 28159 H2 WAT 4620 99.339 131.459 122.507 1.00 0.00 H TER 28161 WAT 4620 ATOM 28161 O WAT 4621 35.632 125.513 1.907 1.00 0.00 O ATOM 28162 H1 WAT 4621 36.014 125.502 1.030 1.00 0.00 H ATOM 28163 H2 WAT 4621 34.687 125.542 1.757 1.00 0.00 H TER 28165 WAT 4621 ATOM 28165 O WAT 4622 72.174 9.238 118.055 1.00 0.00 O ATOM 28166 H1 WAT 4622 71.541 8.560 117.818 1.00 0.00 H ATOM 28167 H2 WAT 4622 72.680 8.853 118.770 1.00 0.00 H TER 28169 WAT 4622 ATOM 28169 O WAT 4623 11.398 11.481 71.832 1.00 0.00 O ATOM 28170 H1 WAT 4623 11.384 10.903 71.069 1.00 0.00 H ATOM 28171 H2 WAT 4623 10.591 11.990 71.761 1.00 0.00 H TER 28173 WAT 4623 ATOM 28173 O WAT 4624 126.740 60.641 143.312 1.00 0.00 O ATOM 28174 H1 WAT 4624 126.650 59.703 143.481 1.00 0.00 H ATOM 28175 H2 WAT 4624 126.326 61.060 144.066 1.00 0.00 H TER 28177 WAT 4624 ATOM 28177 O WAT 4625 10.376 23.316 98.309 1.00 0.00 O ATOM 28178 H1 WAT 4625 9.729 22.624 98.449 1.00 0.00 H ATOM 28179 H2 WAT 4625 10.112 23.727 97.485 1.00 0.00 H TER 28181 WAT 4625 ATOM 28181 O WAT 4626 30.836 63.332 123.994 1.00 0.00 O ATOM 28182 H1 WAT 4626 31.447 62.804 124.507 1.00 0.00 H ATOM 28183 H2 WAT 4626 31.257 64.189 123.927 1.00 0.00 H TER 28185 WAT 4626 ATOM 28185 O WAT 4627 68.035 18.248 111.913 1.00 0.00 O ATOM 28186 H1 WAT 4627 68.445 17.839 111.150 1.00 0.00 H ATOM 28187 H2 WAT 4627 67.414 17.593 112.231 1.00 0.00 H TER 28189 WAT 4627 ATOM 28189 O WAT 4628 117.466 61.822 122.948 1.00 0.00 O ATOM 28190 H1 WAT 4628 117.638 61.260 122.192 1.00 0.00 H ATOM 28191 H2 WAT 4628 117.786 62.684 122.683 1.00 0.00 H TER 28193 WAT 4628 ATOM 28193 O WAT 4629 50.289 129.385 103.595 1.00 0.00 O ATOM 28194 H1 WAT 4629 50.431 129.264 102.656 1.00 0.00 H ATOM 28195 H2 WAT 4629 50.796 128.684 104.005 1.00 0.00 H TER 28197 WAT 4629 ATOM 28197 O WAT 4630 52.329 18.631 94.033 1.00 0.00 O ATOM 28198 H1 WAT 4630 52.602 18.036 93.334 1.00 0.00 H ATOM 28199 H2 WAT 4630 52.705 19.476 93.788 1.00 0.00 H TER 28201 WAT 4630 ATOM 28201 O WAT 4631 99.297 93.239 130.951 1.00 0.00 O ATOM 28202 H1 WAT 4631 99.061 93.379 131.868 1.00 0.00 H ATOM 28203 H2 WAT 4631 99.755 92.399 130.946 1.00 0.00 H TER 28205 WAT 4631 ATOM 28205 O WAT 4632 45.718 79.611 8.563 1.00 0.00 O ATOM 28206 H1 WAT 4632 46.225 80.325 8.949 1.00 0.00 H ATOM 28207 H2 WAT 4632 45.807 78.890 9.186 1.00 0.00 H TER 28209 WAT 4632 ATOM 28209 O WAT 4633 29.386 13.963 149.140 1.00 0.00 O ATOM 28210 H1 WAT 4633 28.782 13.554 148.520 1.00 0.00 H ATOM 28211 H2 WAT 4633 29.865 14.607 148.619 1.00 0.00 H TER 28213 WAT 4633 ATOM 28213 O WAT 4634 54.210 65.733 68.873 1.00 0.00 O ATOM 28214 H1 WAT 4634 53.869 66.595 68.632 1.00 0.00 H ATOM 28215 H2 WAT 4634 54.480 65.342 68.042 1.00 0.00 H TER 28217 WAT 4634 ATOM 28217 O WAT 4635 26.776 42.295 111.561 1.00 0.00 O ATOM 28218 H1 WAT 4635 25.971 41.949 111.176 1.00 0.00 H ATOM 28219 H2 WAT 4635 26.594 43.224 111.702 1.00 0.00 H TER 28221 WAT 4635 ATOM 28221 O WAT 4636 103.863 31.736 102.638 1.00 0.00 O ATOM 28222 H1 WAT 4636 103.750 32.392 101.950 1.00 0.00 H ATOM 28223 H2 WAT 4636 102.973 31.547 102.936 1.00 0.00 H TER 28225 WAT 4636 ATOM 28225 O WAT 4637 89.580 12.986 144.004 1.00 0.00 O ATOM 28226 H1 WAT 4637 90.149 13.217 143.269 1.00 0.00 H ATOM 28227 H2 WAT 4637 89.972 12.193 144.369 1.00 0.00 H TER 28229 WAT 4637 ATOM 28229 O WAT 4638 54.234 141.976 85.913 1.00 0.00 O ATOM 28230 H1 WAT 4638 54.671 141.176 86.204 1.00 0.00 H ATOM 28231 H2 WAT 4638 53.316 141.724 85.813 1.00 0.00 H TER 28233 WAT 4638 ATOM 28233 O WAT 4639 82.418 63.429 12.123 1.00 0.00 O ATOM 28234 H1 WAT 4639 82.627 63.247 11.206 1.00 0.00 H ATOM 28235 H2 WAT 4639 82.600 64.362 12.230 1.00 0.00 H TER 28237 WAT 4639 ATOM 28237 O WAT 4640 35.052 12.606 141.235 1.00 0.00 O ATOM 28238 H1 WAT 4640 35.352 13.168 140.520 1.00 0.00 H ATOM 28239 H2 WAT 4640 34.853 11.769 140.815 1.00 0.00 H TER 28241 WAT 4640 ATOM 28241 O WAT 4641 88.969 24.458 12.879 1.00 0.00 O ATOM 28242 H1 WAT 4641 89.318 23.710 12.395 1.00 0.00 H ATOM 28243 H2 WAT 4641 89.651 25.126 12.814 1.00 0.00 H TER 28245 WAT 4641 ATOM 28245 O WAT 4642 108.774 99.764 135.873 1.00 0.00 O ATOM 28246 H1 WAT 4642 108.613 99.062 135.242 1.00 0.00 H ATOM 28247 H2 WAT 4642 109.428 100.321 135.449 1.00 0.00 H TER 28249 WAT 4642 ATOM 28249 O WAT 4643 67.107 117.331 87.682 1.00 0.00 O ATOM 28250 H1 WAT 4643 67.870 116.753 87.690 1.00 0.00 H ATOM 28251 H2 WAT 4643 66.384 116.776 87.975 1.00 0.00 H TER 28253 WAT 4643 ATOM 28253 O WAT 4644 17.555 72.272 100.024 1.00 0.00 O ATOM 28254 H1 WAT 4644 16.680 72.628 99.869 1.00 0.00 H ATOM 28255 H2 WAT 4644 17.448 71.325 99.935 1.00 0.00 H TER 28257 WAT 4644 ATOM 28257 O WAT 4645 98.341 96.305 81.626 1.00 0.00 O ATOM 28258 H1 WAT 4645 98.463 95.429 81.991 1.00 0.00 H ATOM 28259 H2 WAT 4645 99.178 96.745 81.772 1.00 0.00 H TER 28261 WAT 4645 ATOM 28261 O WAT 4646 55.908 16.054 113.756 1.00 0.00 O ATOM 28262 H1 WAT 4646 55.146 16.180 114.321 1.00 0.00 H ATOM 28263 H2 WAT 4646 55.705 15.266 113.253 1.00 0.00 H TER 28265 WAT 4646 ATOM 28265 O WAT 4647 101.579 141.543 105.251 1.00 0.00 O ATOM 28266 H1 WAT 4647 101.654 141.826 104.340 1.00 0.00 H ATOM 28267 H2 WAT 4647 100.708 141.833 105.521 1.00 0.00 H TER 28269 WAT 4647 ATOM 28269 O WAT 4648 6.702 105.675 1.865 1.00 0.00 O ATOM 28270 H1 WAT 4648 6.841 104.843 2.319 1.00 0.00 H ATOM 28271 H2 WAT 4648 7.526 105.838 1.406 1.00 0.00 H TER 28273 WAT 4648 ATOM 28273 O WAT 4649 45.326 70.892 121.213 1.00 0.00 O ATOM 28274 H1 WAT 4649 44.434 71.199 121.376 1.00 0.00 H ATOM 28275 H2 WAT 4649 45.445 70.166 121.825 1.00 0.00 H TER 28277 WAT 4649 ATOM 28277 O WAT 4650 65.507 102.585 127.340 1.00 0.00 O ATOM 28278 H1 WAT 4650 66.420 102.520 127.620 1.00 0.00 H ATOM 28279 H2 WAT 4650 65.479 102.119 126.504 1.00 0.00 H TER 28281 WAT 4650 ATOM 28281 O WAT 4651 131.778 1.119 96.334 1.00 0.00 O ATOM 28282 H1 WAT 4651 131.910 0.385 96.934 1.00 0.00 H ATOM 28283 H2 WAT 4651 131.106 1.654 96.756 1.00 0.00 H TER 28285 WAT 4651 ATOM 28285 O WAT 4652 59.827 88.374 146.769 1.00 0.00 O ATOM 28286 H1 WAT 4652 60.204 88.922 147.457 1.00 0.00 H ATOM 28287 H2 WAT 4652 59.046 88.849 146.485 1.00 0.00 H TER 28289 WAT 4652 ATOM 28289 O WAT 4653 140.965 100.952 98.441 1.00 0.00 O ATOM 28290 H1 WAT 4653 140.768 100.998 97.505 1.00 0.00 H ATOM 28291 H2 WAT 4653 141.413 100.114 98.551 1.00 0.00 H TER 28293 WAT 4653 ATOM 28293 O WAT 4654 79.036 7.619 113.419 1.00 0.00 O ATOM 28294 H1 WAT 4654 79.567 7.315 112.683 1.00 0.00 H ATOM 28295 H2 WAT 4654 78.829 8.528 113.205 1.00 0.00 H TER 28297 WAT 4654 ATOM 28297 O WAT 4655 60.405 114.266 0.587 1.00 0.00 O ATOM 28298 H1 WAT 4655 60.243 113.860 -0.265 1.00 0.00 H ATOM 28299 H2 WAT 4655 60.387 113.538 1.207 1.00 0.00 H TER 28301 WAT 4655 ATOM 28301 O WAT 4656 100.157 39.504 75.068 1.00 0.00 O ATOM 28302 H1 WAT 4656 100.422 38.823 74.449 1.00 0.00 H ATOM 28303 H2 WAT 4656 100.971 39.956 75.290 1.00 0.00 H TER 28305 WAT 4656 ATOM 28305 O WAT 4657 5.398 138.053 91.031 1.00 0.00 O ATOM 28306 H1 WAT 4657 4.855 137.439 90.539 1.00 0.00 H ATOM 28307 H2 WAT 4657 6.096 138.297 90.423 1.00 0.00 H TER 28309 WAT 4657 ATOM 28309 O WAT 4658 121.442 38.513 144.467 1.00 0.00 O ATOM 28310 H1 WAT 4658 121.108 37.648 144.232 1.00 0.00 H ATOM 28311 H2 WAT 4658 122.386 38.454 144.317 1.00 0.00 H TER 28313 WAT 4658 ATOM 28313 O WAT 4659 65.100 89.517 154.468 1.00 0.00 O ATOM 28314 H1 WAT 4659 66.026 89.551 154.710 1.00 0.00 H ATOM 28315 H2 WAT 4659 65.102 89.557 153.511 1.00 0.00 H TER 28317 WAT 4659 ATOM 28317 O WAT 4660 140.013 141.854 127.182 1.00 0.00 O ATOM 28318 H1 WAT 4660 140.094 141.097 126.601 1.00 0.00 H ATOM 28319 H2 WAT 4660 140.554 141.633 127.940 1.00 0.00 H TER 28321 WAT 4660 ATOM 28321 O WAT 4661 61.789 102.305 120.833 1.00 0.00 O ATOM 28322 H1 WAT 4661 61.942 101.913 121.692 1.00 0.00 H ATOM 28323 H2 WAT 4661 61.267 101.655 120.362 1.00 0.00 H TER 28325 WAT 4661 ATOM 28325 O WAT 4662 13.615 135.953 157.473 1.00 0.00 O ATOM 28326 H1 WAT 4662 13.736 136.659 156.838 1.00 0.00 H ATOM 28327 H2 WAT 4662 12.882 135.443 157.128 1.00 0.00 H TER 28329 WAT 4662 ATOM 28329 O WAT 4663 39.838 37.235 95.757 1.00 0.00 O ATOM 28330 H1 WAT 4663 39.992 37.289 94.813 1.00 0.00 H ATOM 28331 H2 WAT 4663 39.313 38.010 95.958 1.00 0.00 H TER 28333 WAT 4663 ATOM 28333 O WAT 4664 67.338 68.325 127.533 1.00 0.00 O ATOM 28334 H1 WAT 4664 67.823 68.730 126.814 1.00 0.00 H ATOM 28335 H2 WAT 4664 66.643 67.827 127.103 1.00 0.00 H TER 28337 WAT 4664 ATOM 28337 O WAT 4665 100.277 88.815 79.478 1.00 0.00 O ATOM 28338 H1 WAT 4665 100.910 89.178 80.097 1.00 0.00 H ATOM 28339 H2 WAT 4665 99.434 89.172 79.760 1.00 0.00 H TER 28341 WAT 4665 ATOM 28341 O WAT 4666 116.764 81.171 66.063 1.00 0.00 O ATOM 28342 H1 WAT 4666 116.110 81.096 66.758 1.00 0.00 H ATOM 28343 H2 WAT 4666 116.734 80.326 65.614 1.00 0.00 H TER 28345 WAT 4666 ATOM 28345 O WAT 4667 138.908 27.783 150.045 1.00 0.00 O ATOM 28346 H1 WAT 4667 139.075 28.702 150.255 1.00 0.00 H ATOM 28347 H2 WAT 4667 137.988 27.759 149.784 1.00 0.00 H TER 28349 WAT 4667 ATOM 28349 O WAT 4668 9.504 88.962 7.094 1.00 0.00 O ATOM 28350 H1 WAT 4668 8.812 88.919 7.753 1.00 0.00 H ATOM 28351 H2 WAT 4668 9.363 88.189 6.547 1.00 0.00 H TER 28353 WAT 4668 ATOM 28353 O WAT 4669 12.990 93.920 66.257 1.00 0.00 O ATOM 28354 H1 WAT 4669 13.335 93.051 66.462 1.00 0.00 H ATOM 28355 H2 WAT 4669 13.504 94.210 65.503 1.00 0.00 H TER 28357 WAT 4669 ATOM 28357 O WAT 4670 71.850 92.693 20.999 1.00 0.00 O ATOM 28358 H1 WAT 4670 72.677 92.270 21.234 1.00 0.00 H ATOM 28359 H2 WAT 4670 71.853 92.707 20.042 1.00 0.00 H TER 28361 WAT 4670 ATOM 28361 O WAT 4671 27.754 96.485 61.825 1.00 0.00 O ATOM 28362 H1 WAT 4671 28.219 96.964 61.140 1.00 0.00 H ATOM 28363 H2 WAT 4671 27.955 96.962 62.630 1.00 0.00 H TER 28365 WAT 4671 ATOM 28365 O WAT 4672 89.031 111.616 156.430 1.00 0.00 O ATOM 28366 H1 WAT 4672 88.160 111.997 156.312 1.00 0.00 H ATOM 28367 H2 WAT 4672 88.865 110.696 156.633 1.00 0.00 H TER 28369 WAT 4672 ATOM 28369 O WAT 4673 63.220 12.628 85.648 1.00 0.00 O ATOM 28370 H1 WAT 4673 63.677 13.239 86.226 1.00 0.00 H ATOM 28371 H2 WAT 4673 63.108 13.111 84.829 1.00 0.00 H TER 28373 WAT 4673 ATOM 28373 O WAT 4674 99.125 39.229 6.623 1.00 0.00 O ATOM 28374 H1 WAT 4674 98.975 38.614 5.905 1.00 0.00 H ATOM 28375 H2 WAT 4674 98.516 38.952 7.308 1.00 0.00 H TER 28377 WAT 4674 ATOM 28377 O WAT 4675 143.561 109.009 130.598 1.00 0.00 O ATOM 28378 H1 WAT 4675 143.367 108.899 131.529 1.00 0.00 H ATOM 28379 H2 WAT 4675 144.384 108.537 130.469 1.00 0.00 H TER 28381 WAT 4675 ATOM 28381 O WAT 4676 30.974 117.757 89.005 1.00 0.00 O ATOM 28382 H1 WAT 4676 31.522 116.972 88.977 1.00 0.00 H ATOM 28383 H2 WAT 4676 30.140 117.480 88.625 1.00 0.00 H TER 28385 WAT 4676 ATOM 28385 O WAT 4677 14.363 15.372 124.571 1.00 0.00 O ATOM 28386 H1 WAT 4677 14.842 15.617 125.363 1.00 0.00 H ATOM 28387 H2 WAT 4677 13.450 15.309 124.853 1.00 0.00 H TER 28389 WAT 4677 ATOM 28389 O WAT 4678 49.940 109.048 135.358 1.00 0.00 O ATOM 28390 H1 WAT 4678 49.984 109.931 135.724 1.00 0.00 H ATOM 28391 H2 WAT 4678 50.579 108.546 135.864 1.00 0.00 H TER 28393 WAT 4678 ATOM 28393 O WAT 4679 129.989 11.261 73.960 1.00 0.00 O ATOM 28394 H1 WAT 4679 129.700 12.147 74.178 1.00 0.00 H ATOM 28395 H2 WAT 4679 129.596 11.083 73.106 1.00 0.00 H TER 28397 WAT 4679 ATOM 28397 O WAT 4680 2.847 57.996 104.065 1.00 0.00 O ATOM 28398 H1 WAT 4680 3.166 58.271 104.925 1.00 0.00 H ATOM 28399 H2 WAT 4680 2.594 57.080 104.185 1.00 0.00 H TER 28401 WAT 4680 ATOM 28401 O WAT 4681 109.045 99.410 116.662 1.00 0.00 O ATOM 28402 H1 WAT 4681 109.021 98.505 116.352 1.00 0.00 H ATOM 28403 H2 WAT 4681 108.194 99.771 116.415 1.00 0.00 H TER 28405 WAT 4681 ATOM 28405 O WAT 4682 106.723 135.882 55.526 1.00 0.00 O ATOM 28406 H1 WAT 4682 106.285 136.554 56.049 1.00 0.00 H ATOM 28407 H2 WAT 4682 106.129 135.725 54.791 1.00 0.00 H TER 28409 WAT 4682 ATOM 28409 O WAT 4683 45.089 13.577 1.192 1.00 0.00 O ATOM 28410 H1 WAT 4683 44.536 13.460 1.965 1.00 0.00 H ATOM 28411 H2 WAT 4683 44.680 14.297 0.712 1.00 0.00 H TER 28413 WAT 4683 ATOM 28413 O WAT 4684 40.418 122.793 145.809 1.00 0.00 O ATOM 28414 H1 WAT 4684 40.246 121.857 145.906 1.00 0.00 H ATOM 28415 H2 WAT 4684 40.513 123.114 146.706 1.00 0.00 H TER 28417 WAT 4684 ATOM 28417 O WAT 4685 142.296 129.564 100.960 1.00 0.00 O ATOM 28418 H1 WAT 4685 142.253 129.167 101.830 1.00 0.00 H ATOM 28419 H2 WAT 4685 141.448 129.993 100.850 1.00 0.00 H TER 28421 WAT 4685 ATOM 28421 O WAT 4686 36.126 95.716 3.527 1.00 0.00 O ATOM 28422 H1 WAT 4686 35.309 95.358 3.873 1.00 0.00 H ATOM 28423 H2 WAT 4686 36.167 96.605 3.879 1.00 0.00 H TER 28425 WAT 4686 ATOM 28425 O WAT 4687 40.904 24.435 83.592 1.00 0.00 O ATOM 28426 H1 WAT 4687 40.209 23.780 83.534 1.00 0.00 H ATOM 28427 H2 WAT 4687 41.022 24.576 84.531 1.00 0.00 H TER 28429 WAT 4687 ATOM 28429 O WAT 4688 58.484 55.055 11.468 1.00 0.00 O ATOM 28430 H1 WAT 4688 57.620 55.328 11.158 1.00 0.00 H ATOM 28431 H2 WAT 4688 58.540 54.128 11.236 1.00 0.00 H TER 28433 WAT 4688 ATOM 28433 O WAT 4689 55.640 92.521 100.633 1.00 0.00 O ATOM 28434 H1 WAT 4689 55.572 92.861 99.740 1.00 0.00 H ATOM 28435 H2 WAT 4689 56.581 92.456 100.793 1.00 0.00 H TER 28437 WAT 4689 ATOM 28437 O WAT 4690 121.901 5.577 78.569 1.00 0.00 O ATOM 28438 H1 WAT 4690 122.027 6.054 79.389 1.00 0.00 H ATOM 28439 H2 WAT 4690 122.672 5.014 78.498 1.00 0.00 H TER 28441 WAT 4690 ATOM 28441 O WAT 4691 126.064 0.192 106.675 1.00 0.00 O ATOM 28442 H1 WAT 4691 126.665 0.740 106.170 1.00 0.00 H ATOM 28443 H2 WAT 4691 125.543 0.814 107.183 1.00 0.00 H TER 28445 WAT 4691 ATOM 28445 O WAT 4692 54.641 77.891 125.190 1.00 0.00 O ATOM 28446 H1 WAT 4692 55.169 78.551 124.741 1.00 0.00 H ATOM 28447 H2 WAT 4692 54.178 78.379 125.872 1.00 0.00 H TER 28449 WAT 4692 ATOM 28449 O WAT 4693 139.924 1.324 84.804 1.00 0.00 O ATOM 28450 H1 WAT 4693 140.178 1.315 85.727 1.00 0.00 H ATOM 28451 H2 WAT 4693 139.831 2.252 84.590 1.00 0.00 H TER 28453 WAT 4693 ATOM 28453 O WAT 4694 113.327 131.381 15.365 1.00 0.00 O ATOM 28454 H1 WAT 4694 113.883 131.436 14.588 1.00 0.00 H ATOM 28455 H2 WAT 4694 112.541 130.924 15.067 1.00 0.00 H TER 28457 WAT 4694 ATOM 28457 O WAT 4695 95.370 51.512 82.723 1.00 0.00 O ATOM 28458 H1 WAT 4695 95.389 52.178 82.036 1.00 0.00 H ATOM 28459 H2 WAT 4695 95.587 50.696 82.272 1.00 0.00 H TER 28461 WAT 4695 ATOM 28461 O WAT 4696 78.971 95.363 80.159 1.00 0.00 O ATOM 28462 H1 WAT 4696 79.676 95.381 79.511 1.00 0.00 H ATOM 28463 H2 WAT 4696 79.352 95.767 80.938 1.00 0.00 H TER 28465 WAT 4696 ATOM 28465 O WAT 4697 33.335 38.644 2.585 1.00 0.00 O ATOM 28466 H1 WAT 4697 33.233 38.256 3.454 1.00 0.00 H ATOM 28467 H2 WAT 4697 33.565 37.908 2.019 1.00 0.00 H TER 28469 WAT 4697 ATOM 28469 O WAT 4698 49.426 120.770 154.969 1.00 0.00 O ATOM 28470 H1 WAT 4698 49.755 121.421 155.589 1.00 0.00 H ATOM 28471 H2 WAT 4698 50.212 120.426 154.544 1.00 0.00 H TER 28473 WAT 4698 ATOM 28473 O WAT 4699 115.276 108.809 134.941 1.00 0.00 O ATOM 28474 H1 WAT 4699 115.785 108.075 135.285 1.00 0.00 H ATOM 28475 H2 WAT 4699 115.653 109.580 135.363 1.00 0.00 H TER 28477 WAT 4699 ATOM 28477 O WAT 4700 25.790 80.482 63.635 1.00 0.00 O ATOM 28478 H1 WAT 4700 25.645 81.277 63.121 1.00 0.00 H ATOM 28479 H2 WAT 4700 26.465 80.727 64.269 1.00 0.00 H TER 28481 WAT 4700 ATOM 28481 O WAT 4701 48.052 47.896 13.427 1.00 0.00 O ATOM 28482 H1 WAT 4701 48.552 48.549 12.938 1.00 0.00 H ATOM 28483 H2 WAT 4701 48.508 47.822 14.265 1.00 0.00 H TER 28485 WAT 4701 ATOM 28485 O WAT 4702 14.339 79.422 118.178 1.00 0.00 O ATOM 28486 H1 WAT 4702 14.912 79.897 117.576 1.00 0.00 H ATOM 28487 H2 WAT 4702 14.255 78.551 117.791 1.00 0.00 H TER 28489 WAT 4702 ATOM 28489 O WAT 4703 20.155 69.027 112.208 1.00 0.00 O ATOM 28490 H1 WAT 4703 20.917 69.139 112.777 1.00 0.00 H ATOM 28491 H2 WAT 4703 20.428 68.368 111.569 1.00 0.00 H TER 28493 WAT 4703 ATOM 28493 O WAT 4704 96.373 51.149 69.322 1.00 0.00 O ATOM 28494 H1 WAT 4704 96.461 51.635 68.502 1.00 0.00 H ATOM 28495 H2 WAT 4704 96.664 50.263 69.108 1.00 0.00 H TER 28497 WAT 4704 ATOM 28497 O WAT 4705 36.437 101.938 103.734 1.00 0.00 O ATOM 28498 H1 WAT 4705 37.293 102.337 103.578 1.00 0.00 H ATOM 28499 H2 WAT 4705 36.358 101.906 104.688 1.00 0.00 H TER 28501 WAT 4705 ATOM 28501 O WAT 4706 14.887 34.820 87.747 1.00 0.00 O ATOM 28502 H1 WAT 4706 15.174 34.371 86.952 1.00 0.00 H ATOM 28503 H2 WAT 4706 13.983 34.531 87.873 1.00 0.00 H TER 28505 WAT 4706 ATOM 28505 O WAT 4707 34.272 96.013 57.745 1.00 0.00 O ATOM 28506 H1 WAT 4707 34.726 96.682 58.258 1.00 0.00 H ATOM 28507 H2 WAT 4707 33.943 95.394 58.396 1.00 0.00 H TER 28509 WAT 4707 ATOM 28509 O WAT 4708 65.624 63.552 75.134 1.00 0.00 O ATOM 28510 H1 WAT 4708 65.423 62.805 74.571 1.00 0.00 H ATOM 28511 H2 WAT 4708 66.427 63.921 74.764 1.00 0.00 H TER 28513 WAT 4708 ATOM 28513 O WAT 4709 94.340 117.988 16.911 1.00 0.00 O ATOM 28514 H1 WAT 4709 93.392 118.069 17.016 1.00 0.00 H ATOM 28515 H2 WAT 4709 94.599 118.785 16.448 1.00 0.00 H TER 28517 WAT 4709 ATOM 28517 O WAT 4710 14.537 102.244 98.649 1.00 0.00 O ATOM 28518 H1 WAT 4710 14.147 101.892 99.450 1.00 0.00 H ATOM 28519 H2 WAT 4710 13.831 102.743 98.239 1.00 0.00 H TER 28521 WAT 4710 ATOM 28521 O WAT 4711 89.692 107.114 2.695 1.00 0.00 O ATOM 28522 H1 WAT 4711 89.724 107.883 3.263 1.00 0.00 H ATOM 28523 H2 WAT 4711 90.064 107.414 1.866 1.00 0.00 H TER 28525 WAT 4711 ATOM 28525 O WAT 4712 132.977 38.809 65.040 1.00 0.00 O ATOM 28526 H1 WAT 4712 132.738 38.073 64.476 1.00 0.00 H ATOM 28527 H2 WAT 4712 132.655 39.582 64.576 1.00 0.00 H TER 28529 WAT 4712 ATOM 28529 O WAT 4713 64.893 102.990 73.912 1.00 0.00 O ATOM 28530 H1 WAT 4713 64.824 103.939 74.008 1.00 0.00 H ATOM 28531 H2 WAT 4713 64.156 102.751 73.350 1.00 0.00 H TER 28533 WAT 4713 ATOM 28533 O WAT 4714 17.659 47.967 130.070 1.00 0.00 O ATOM 28534 H1 WAT 4714 17.514 48.123 129.137 1.00 0.00 H ATOM 28535 H2 WAT 4714 17.387 48.782 130.493 1.00 0.00 H TER 28537 WAT 4714 ATOM 28537 O WAT 4715 79.090 14.229 13.945 1.00 0.00 O ATOM 28538 H1 WAT 4715 78.281 14.572 14.324 1.00 0.00 H ATOM 28539 H2 WAT 4715 78.936 13.288 13.859 1.00 0.00 H TER 28541 WAT 4715 ATOM 28541 O WAT 4716 56.541 139.981 138.395 1.00 0.00 O ATOM 28542 H1 WAT 4716 56.240 139.083 138.536 1.00 0.00 H ATOM 28543 H2 WAT 4716 57.154 140.143 139.112 1.00 0.00 H TER 28545 WAT 4716 ATOM 28545 O WAT 4717 14.632 19.472 84.024 1.00 0.00 O ATOM 28546 H1 WAT 4717 15.191 20.090 84.496 1.00 0.00 H ATOM 28547 H2 WAT 4717 14.771 19.680 83.100 1.00 0.00 H TER 28549 WAT 4717 ATOM 28549 O WAT 4718 140.421 61.370 78.352 1.00 0.00 O ATOM 28550 H1 WAT 4718 141.340 61.545 78.552 1.00 0.00 H ATOM 28551 H2 WAT 4718 140.069 62.218 78.082 1.00 0.00 H TER 28553 WAT 4718 ATOM 28553 O WAT 4719 4.377 102.420 17.282 1.00 0.00 O ATOM 28554 H1 WAT 4719 4.971 101.834 17.752 1.00 0.00 H ATOM 28555 H2 WAT 4719 4.417 103.243 17.769 1.00 0.00 H TER 28557 WAT 4719 ATOM 28557 O WAT 4720 65.255 41.634 76.191 1.00 0.00 O ATOM 28558 H1 WAT 4720 65.747 41.103 76.817 1.00 0.00 H ATOM 28559 H2 WAT 4720 64.911 42.360 76.711 1.00 0.00 H TER 28561 WAT 4720 ATOM 28561 O WAT 4721 131.695 57.997 140.016 1.00 0.00 O ATOM 28562 H1 WAT 4721 131.489 58.066 139.084 1.00 0.00 H ATOM 28563 H2 WAT 4721 132.539 57.547 140.043 1.00 0.00 H TER 28565 WAT 4721 ATOM 28565 O WAT 4722 137.272 75.276 4.341 1.00 0.00 O ATOM 28566 H1 WAT 4722 137.294 74.542 4.956 1.00 0.00 H ATOM 28567 H2 WAT 4722 136.681 74.987 3.645 1.00 0.00 H TER 28569 WAT 4722 ATOM 28569 O WAT 4723 62.522 142.033 112.265 1.00 0.00 O ATOM 28570 H1 WAT 4723 62.693 141.588 113.095 1.00 0.00 H ATOM 28571 H2 WAT 4723 63.391 142.230 111.916 1.00 0.00 H TER 28573 WAT 4723 ATOM 28573 O WAT 4724 111.791 100.886 70.253 1.00 0.00 O ATOM 28574 H1 WAT 4724 111.803 101.817 70.032 1.00 0.00 H ATOM 28575 H2 WAT 4724 111.935 100.440 69.418 1.00 0.00 H TER 28577 WAT 4724 ATOM 28577 O WAT 4725 119.649 116.362 80.173 1.00 0.00 O ATOM 28578 H1 WAT 4725 120.041 116.506 79.312 1.00 0.00 H ATOM 28579 H2 WAT 4725 119.645 117.227 80.582 1.00 0.00 H TER 28581 WAT 4725 ATOM 28581 O WAT 4726 26.399 64.822 107.235 1.00 0.00 O ATOM 28582 H1 WAT 4726 26.106 63.940 107.465 1.00 0.00 H ATOM 28583 H2 WAT 4726 25.769 65.402 107.661 1.00 0.00 H TER 28585 WAT 4726 ATOM 28585 O WAT 4727 38.001 53.683 154.725 1.00 0.00 O ATOM 28586 H1 WAT 4727 38.848 53.236 154.722 1.00 0.00 H ATOM 28587 H2 WAT 4727 37.372 53.004 154.969 1.00 0.00 H TER 28589 WAT 4727 ATOM 28589 O WAT 4728 49.932 137.407 65.644 1.00 0.00 O ATOM 28590 H1 WAT 4728 49.666 136.490 65.581 1.00 0.00 H ATOM 28591 H2 WAT 4728 50.194 137.642 64.753 1.00 0.00 H TER 28593 WAT 4728 ATOM 28593 O WAT 4729 101.957 101.006 102.426 1.00 0.00 O ATOM 28594 H1 WAT 4729 101.657 101.853 102.757 1.00 0.00 H ATOM 28595 H2 WAT 4729 101.485 100.362 102.954 1.00 0.00 H TER 28597 WAT 4729 ATOM 28597 O WAT 4730 129.542 23.562 96.635 1.00 0.00 O ATOM 28598 H1 WAT 4730 128.882 23.395 95.962 1.00 0.00 H ATOM 28599 H2 WAT 4730 130.019 24.329 96.317 1.00 0.00 H TER 28601 WAT 4730 ATOM 28601 O WAT 4731 142.701 58.635 110.417 1.00 0.00 O ATOM 28602 H1 WAT 4731 142.527 58.762 111.349 1.00 0.00 H ATOM 28603 H2 WAT 4731 143.655 58.609 110.352 1.00 0.00 H TER 28605 WAT 4731 ATOM 28605 O WAT 4732 129.654 103.209 72.551 1.00 0.00 O ATOM 28606 H1 WAT 4732 130.142 103.134 73.371 1.00 0.00 H ATOM 28607 H2 WAT 4732 130.139 102.662 71.933 1.00 0.00 H TER 28609 WAT 4732 ATOM 28609 O WAT 4733 4.325 8.488 16.930 1.00 0.00 O ATOM 28610 H1 WAT 4733 4.991 8.944 16.416 1.00 0.00 H ATOM 28611 H2 WAT 4733 4.065 9.120 17.600 1.00 0.00 H TER 28613 WAT 4733 ATOM 28613 O WAT 4734 32.784 32.546 108.341 1.00 0.00 O ATOM 28614 H1 WAT 4734 33.253 33.277 107.938 1.00 0.00 H ATOM 28615 H2 WAT 4734 33.073 32.551 109.254 1.00 0.00 H TER 28617 WAT 4734 ATOM 28617 O WAT 4735 32.846 47.848 60.065 1.00 0.00 O ATOM 28618 H1 WAT 4735 33.718 48.076 60.387 1.00 0.00 H ATOM 28619 H2 WAT 4735 32.912 46.923 59.828 1.00 0.00 H TER 28621 WAT 4735 ATOM 28621 O WAT 4736 117.197 19.363 146.394 1.00 0.00 O ATOM 28622 H1 WAT 4736 116.522 20.041 146.355 1.00 0.00 H ATOM 28623 H2 WAT 4736 117.452 19.227 145.482 1.00 0.00 H TER 28625 WAT 4736 ATOM 28625 O WAT 4737 2.610 35.493 93.369 1.00 0.00 O ATOM 28626 H1 WAT 4737 3.200 36.229 93.208 1.00 0.00 H ATOM 28627 H2 WAT 4737 3.042 34.744 92.959 1.00 0.00 H TER 28629 WAT 4737 ATOM 28629 O WAT 4738 61.848 113.889 149.203 1.00 0.00 O ATOM 28630 H1 WAT 4738 61.182 114.575 149.147 1.00 0.00 H ATOM 28631 H2 WAT 4738 61.704 113.486 150.060 1.00 0.00 H TER 28633 WAT 4738 ATOM 28633 O WAT 4739 1.170 123.290 123.259 1.00 0.00 O ATOM 28634 H1 WAT 4739 0.603 122.921 122.582 1.00 0.00 H ATOM 28635 H2 WAT 4739 1.715 122.556 123.541 1.00 0.00 H TER 28637 WAT 4739 ATOM 28637 O WAT 4740 135.908 65.869 152.674 1.00 0.00 O ATOM 28638 H1 WAT 4740 134.977 66.012 152.847 1.00 0.00 H ATOM 28639 H2 WAT 4740 136.224 65.394 153.443 1.00 0.00 H TER 28641 WAT 4740 ATOM 28641 O WAT 4741 126.931 110.800 95.547 1.00 0.00 O ATOM 28642 H1 WAT 4741 126.973 110.113 94.882 1.00 0.00 H ATOM 28643 H2 WAT 4741 127.361 111.552 95.141 1.00 0.00 H TER 28645 WAT 4741 ATOM 28645 O WAT 4742 6.784 85.367 133.360 1.00 0.00 O ATOM 28646 H1 WAT 4742 6.282 84.883 132.704 1.00 0.00 H ATOM 28647 H2 WAT 4742 7.617 85.560 132.929 1.00 0.00 H TER 28649 WAT 4742 ATOM 28649 O WAT 4743 69.522 33.273 105.445 1.00 0.00 O ATOM 28650 H1 WAT 4743 70.308 33.660 105.830 1.00 0.00 H ATOM 28651 H2 WAT 4743 69.021 34.022 105.121 1.00 0.00 H TER 28653 WAT 4743 ATOM 28653 O WAT 4744 131.759 56.896 51.666 1.00 0.00 O ATOM 28654 H1 WAT 4744 132.629 57.221 51.896 1.00 0.00 H ATOM 28655 H2 WAT 4744 131.873 55.951 51.572 1.00 0.00 H TER 28657 WAT 4744 ATOM 28657 O WAT 4745 90.388 43.999 64.551 1.00 0.00 O ATOM 28658 H1 WAT 4745 90.446 43.603 63.682 1.00 0.00 H ATOM 28659 H2 WAT 4745 89.448 44.077 64.717 1.00 0.00 H TER 28661 WAT 4745 ATOM 28661 O WAT 4746 89.638 75.496 65.454 1.00 0.00 O ATOM 28662 H1 WAT 4746 90.131 74.908 66.026 1.00 0.00 H ATOM 28663 H2 WAT 4746 90.269 75.763 64.785 1.00 0.00 H TER 28665 WAT 4746 ATOM 28665 O WAT 4747 105.599 68.108 142.957 1.00 0.00 O ATOM 28666 H1 WAT 4747 105.746 68.770 142.281 1.00 0.00 H ATOM 28667 H2 WAT 4747 106.161 67.376 142.702 1.00 0.00 H TER 28669 WAT 4747 ATOM 28669 O WAT 4748 129.655 36.450 100.907 1.00 0.00 O ATOM 28670 H1 WAT 4748 130.503 36.671 100.521 1.00 0.00 H ATOM 28671 H2 WAT 4748 129.360 35.684 100.415 1.00 0.00 H TER 28673 WAT 4748 ATOM 28673 O WAT 4749 15.427 69.433 67.659 1.00 0.00 O ATOM 28674 H1 WAT 4749 15.459 68.590 67.206 1.00 0.00 H ATOM 28675 H2 WAT 4749 16.345 69.666 67.797 1.00 0.00 H TER 28677 WAT 4749 ATOM 28677 O WAT 4750 130.697 48.668 5.945 1.00 0.00 O ATOM 28678 H1 WAT 4750 131.365 48.207 5.438 1.00 0.00 H ATOM 28679 H2 WAT 4750 131.112 48.837 6.791 1.00 0.00 H TER 28681 WAT 4750 ATOM 28681 O WAT 4751 58.544 48.563 126.038 1.00 0.00 O ATOM 28682 H1 WAT 4751 58.375 47.626 126.136 1.00 0.00 H ATOM 28683 H2 WAT 4751 59.252 48.744 126.656 1.00 0.00 H TER 28685 WAT 4751 ATOM 28685 O WAT 4752 69.307 39.494 103.173 1.00 0.00 O ATOM 28686 H1 WAT 4752 69.453 38.649 102.747 1.00 0.00 H ATOM 28687 H2 WAT 4752 69.812 39.445 103.984 1.00 0.00 H TER 28689 WAT 4752 ATOM 28689 O WAT 4753 102.329 113.883 152.628 1.00 0.00 O ATOM 28690 H1 WAT 4753 101.761 114.653 152.636 1.00 0.00 H ATOM 28691 H2 WAT 4753 103.124 114.175 152.182 1.00 0.00 H TER 28693 WAT 4753 ATOM 28693 O WAT 4754 123.324 54.072 87.960 1.00 0.00 O ATOM 28694 H1 WAT 4754 123.499 53.130 87.947 1.00 0.00 H ATOM 28695 H2 WAT 4754 122.369 54.138 87.981 1.00 0.00 H TER 28697 WAT 4754 ATOM 28697 O WAT 4755 132.826 97.348 63.250 1.00 0.00 O ATOM 28698 H1 WAT 4755 132.336 98.091 63.601 1.00 0.00 H ATOM 28699 H2 WAT 4755 133.693 97.702 63.056 1.00 0.00 H TER 28701 WAT 4755 ATOM 28701 O WAT 4756 69.089 49.591 5.004 1.00 0.00 O ATOM 28702 H1 WAT 4756 68.640 49.447 5.838 1.00 0.00 H ATOM 28703 H2 WAT 4756 69.186 50.542 4.946 1.00 0.00 H TER 28705 WAT 4756 ATOM 28705 O WAT 4757 97.077 29.320 94.191 1.00 0.00 O ATOM 28706 H1 WAT 4757 97.924 29.023 94.523 1.00 0.00 H ATOM 28707 H2 WAT 4757 96.706 28.550 93.759 1.00 0.00 H TER 28709 WAT 4757 ATOM 28709 O WAT 4758 124.115 30.047 107.772 1.00 0.00 O ATOM 28710 H1 WAT 4758 124.766 29.758 108.412 1.00 0.00 H ATOM 28711 H2 WAT 4758 123.698 30.805 108.180 1.00 0.00 H TER 28713 WAT 4758 ATOM 28713 O WAT 4759 101.825 133.292 116.659 1.00 0.00 O ATOM 28714 H1 WAT 4759 101.017 133.040 116.213 1.00 0.00 H ATOM 28715 H2 WAT 4759 102.463 133.404 115.955 1.00 0.00 H TER 28717 WAT 4759 ATOM 28717 O WAT 4760 95.146 77.644 4.694 1.00 0.00 O ATOM 28718 H1 WAT 4760 94.650 76.900 5.034 1.00 0.00 H ATOM 28719 H2 WAT 4760 94.645 77.938 3.933 1.00 0.00 H TER 28721 WAT 4760 ATOM 28721 O WAT 4761 56.704 139.275 74.567 1.00 0.00 O ATOM 28722 H1 WAT 4761 56.519 139.819 73.802 1.00 0.00 H ATOM 28723 H2 WAT 4761 57.656 139.302 74.656 1.00 0.00 H TER 28725 WAT 4761 ATOM 28725 O WAT 4762 30.135 144.500 24.861 1.00 0.00 O ATOM 28726 H1 WAT 4762 29.352 143.956 24.941 1.00 0.00 H ATOM 28727 H2 WAT 4762 30.324 144.512 23.922 1.00 0.00 H TER 28729 WAT 4762 ATOM 28729 O WAT 4763 65.116 21.025 60.771 1.00 0.00 O ATOM 28730 H1 WAT 4763 65.227 20.145 60.411 1.00 0.00 H ATOM 28731 H2 WAT 4763 66.008 21.338 60.921 1.00 0.00 H TER 28733 WAT 4763 ATOM 28733 O WAT 4764 71.392 13.206 21.648 1.00 0.00 O ATOM 28734 H1 WAT 4764 71.951 12.737 22.267 1.00 0.00 H ATOM 28735 H2 WAT 4764 71.305 12.609 20.905 1.00 0.00 H TER 28737 WAT 4764 ATOM 28737 O WAT 4765 1.555 16.831 155.304 1.00 0.00 O ATOM 28738 H1 WAT 4765 1.552 16.029 154.782 1.00 0.00 H ATOM 28739 H2 WAT 4765 1.064 17.462 154.777 1.00 0.00 H TER 28741 WAT 4765 ATOM 28741 O WAT 4766 110.971 71.840 122.909 1.00 0.00 O ATOM 28742 H1 WAT 4766 110.408 72.193 122.219 1.00 0.00 H ATOM 28743 H2 WAT 4766 110.419 71.206 123.366 1.00 0.00 H TER 28745 WAT 4766 ATOM 28745 O WAT 4767 24.475 62.867 124.841 1.00 0.00 O ATOM 28746 H1 WAT 4767 24.550 62.589 125.754 1.00 0.00 H ATOM 28747 H2 WAT 4767 24.688 63.800 124.857 1.00 0.00 H TER 28749 WAT 4767 ATOM 28749 O WAT 4768 1.743 125.204 91.033 1.00 0.00 O ATOM 28750 H1 WAT 4768 0.884 125.143 90.614 1.00 0.00 H ATOM 28751 H2 WAT 4768 2.230 124.454 90.690 1.00 0.00 H TER 28753 WAT 4768 ATOM 28753 O WAT 4769 76.082 117.671 113.026 1.00 0.00 O ATOM 28754 H1 WAT 4769 76.420 116.894 113.470 1.00 0.00 H ATOM 28755 H2 WAT 4769 76.843 118.041 112.577 1.00 0.00 H TER 28757 WAT 4769 ATOM 28757 O WAT 4770 104.107 126.099 25.684 1.00 0.00 O ATOM 28758 H1 WAT 4770 103.386 125.922 25.080 1.00 0.00 H ATOM 28759 H2 WAT 4770 104.896 125.910 25.177 1.00 0.00 H TER 28761 WAT 4770 ATOM 28761 O WAT 4771 105.689 145.033 98.031 1.00 0.00 O ATOM 28762 H1 WAT 4771 106.601 144.964 98.315 1.00 0.00 H ATOM 28763 H2 WAT 4771 105.196 145.168 98.840 1.00 0.00 H TER 28765 WAT 4771 ATOM 28765 O WAT 4772 89.136 59.547 85.877 1.00 0.00 O ATOM 28766 H1 WAT 4772 88.562 59.910 85.201 1.00 0.00 H ATOM 28767 H2 WAT 4772 89.806 60.218 86.007 1.00 0.00 H TER 28769 WAT 4772 ATOM 28769 O WAT 4773 15.912 84.654 24.889 1.00 0.00 O ATOM 28770 H1 WAT 4773 16.796 84.957 24.679 1.00 0.00 H ATOM 28771 H2 WAT 4773 15.954 84.416 25.815 1.00 0.00 H TER 28773 WAT 4773 ATOM 28773 O WAT 4774 30.620 57.561 18.033 1.00 0.00 O ATOM 28774 H1 WAT 4774 29.846 57.872 18.503 1.00 0.00 H ATOM 28775 H2 WAT 4774 30.531 56.608 18.031 1.00 0.00 H TER 28777 WAT 4774 ATOM 28777 O WAT 4775 136.663 113.753 28.142 1.00 0.00 O ATOM 28778 H1 WAT 4775 137.475 113.895 28.628 1.00 0.00 H ATOM 28779 H2 WAT 4775 136.734 112.857 27.814 1.00 0.00 H TER 28781 WAT 4775 ATOM 28781 O WAT 4776 61.533 13.984 150.692 1.00 0.00 O ATOM 28782 H1 WAT 4776 62.093 13.951 149.916 1.00 0.00 H ATOM 28783 H2 WAT 4776 60.745 13.503 150.439 1.00 0.00 H TER 28785 WAT 4776 ATOM 28785 O WAT 4777 131.510 29.165 65.820 1.00 0.00 O ATOM 28786 H1 WAT 4777 131.435 28.213 65.745 1.00 0.00 H ATOM 28787 H2 WAT 4777 130.607 29.480 65.779 1.00 0.00 H TER 28789 WAT 4777 ATOM 28789 O WAT 4778 13.165 10.312 118.088 1.00 0.00 O ATOM 28790 H1 WAT 4778 13.832 9.664 118.316 1.00 0.00 H ATOM 28791 H2 WAT 4778 13.646 11.138 118.024 1.00 0.00 H TER 28793 WAT 4778 ATOM 28793 O WAT 4779 124.112 67.351 8.838 1.00 0.00 O ATOM 28794 H1 WAT 4779 123.918 67.854 8.047 1.00 0.00 H ATOM 28795 H2 WAT 4779 123.629 67.801 9.532 1.00 0.00 H TER 28797 WAT 4779 ATOM 28797 O WAT 4780 35.768 66.841 17.024 1.00 0.00 O ATOM 28798 H1 WAT 4780 35.360 67.081 17.856 1.00 0.00 H ATOM 28799 H2 WAT 4780 36.036 67.675 16.640 1.00 0.00 H TER 28801 WAT 4780 ATOM 28801 O WAT 4781 58.790 109.682 137.679 1.00 0.00 O ATOM 28802 H1 WAT 4781 57.964 109.464 137.248 1.00 0.00 H ATOM 28803 H2 WAT 4781 58.921 110.611 137.490 1.00 0.00 H TER 28805 WAT 4781 ATOM 28805 O WAT 4782 39.742 4.945 9.514 1.00 0.00 O ATOM 28806 H1 WAT 4782 40.534 4.626 9.947 1.00 0.00 H ATOM 28807 H2 WAT 4782 39.583 4.314 8.812 1.00 0.00 H TER 28809 WAT 4782 ATOM 28809 O WAT 4783 82.086 112.983 148.165 1.00 0.00 O ATOM 28810 H1 WAT 4783 82.582 112.214 147.883 1.00 0.00 H ATOM 28811 H2 WAT 4783 82.754 113.629 148.393 1.00 0.00 H TER 28813 WAT 4783 ATOM 28813 O WAT 4784 64.492 9.726 103.989 1.00 0.00 O ATOM 28814 H1 WAT 4784 64.124 8.920 104.351 1.00 0.00 H ATOM 28815 H2 WAT 4784 63.856 10.404 104.217 1.00 0.00 H TER 28817 WAT 4784 ATOM 28817 O WAT 4785 144.641 68.595 11.650 1.00 0.00 O ATOM 28818 H1 WAT 4785 144.263 68.207 10.861 1.00 0.00 H ATOM 28819 H2 WAT 4785 144.248 69.466 11.701 1.00 0.00 H TER 28821 WAT 4785 ATOM 28821 O WAT 4786 50.886 69.379 1.610 1.00 0.00 O ATOM 28822 H1 WAT 4786 50.817 68.653 2.229 1.00 0.00 H ATOM 28823 H2 WAT 4786 51.520 69.079 0.959 1.00 0.00 H TER 28825 WAT 4786 ATOM 28825 O WAT 4787 143.889 44.132 109.188 1.00 0.00 O ATOM 28826 H1 WAT 4787 144.084 44.947 108.725 1.00 0.00 H ATOM 28827 H2 WAT 4787 142.986 43.930 108.947 1.00 0.00 H TER 28829 WAT 4787 ATOM 28829 O WAT 4788 86.577 6.440 10.489 1.00 0.00 O ATOM 28830 H1 WAT 4788 86.803 7.082 11.162 1.00 0.00 H ATOM 28831 H2 WAT 4788 87.222 5.741 10.600 1.00 0.00 H TER 28833 WAT 4788 ATOM 28833 O WAT 4789 137.220 88.432 6.245 1.00 0.00 O ATOM 28834 H1 WAT 4789 136.510 89.033 6.018 1.00 0.00 H ATOM 28835 H2 WAT 4789 137.519 88.729 7.104 1.00 0.00 H TER 28837 WAT 4789 ATOM 28837 O WAT 4790 4.356 6.043 147.457 1.00 0.00 O ATOM 28838 H1 WAT 4790 3.417 6.180 147.585 1.00 0.00 H ATOM 28839 H2 WAT 4790 4.425 5.660 146.583 1.00 0.00 H TER 28841 WAT 4790 ATOM 28841 O WAT 4791 110.261 13.386 127.114 1.00 0.00 O ATOM 28842 H1 WAT 4791 111.050 13.072 126.673 1.00 0.00 H ATOM 28843 H2 WAT 4791 110.070 14.225 126.696 1.00 0.00 H TER 28845 WAT 4791 ATOM 28845 O WAT 4792 145.609 77.061 129.974 1.00 0.00 O ATOM 28846 H1 WAT 4792 146.223 77.735 129.685 1.00 0.00 H ATOM 28847 H2 WAT 4792 145.603 76.421 129.262 1.00 0.00 H TER 28849 WAT 4792 ATOM 28849 O WAT 4793 27.969 141.384 143.596 1.00 0.00 O ATOM 28850 H1 WAT 4793 28.770 141.016 143.968 1.00 0.00 H ATOM 28851 H2 WAT 4793 27.995 142.309 143.839 1.00 0.00 H TER 28853 WAT 4793 ATOM 28853 O WAT 4794 133.239 42.939 152.165 1.00 0.00 O ATOM 28854 H1 WAT 4794 132.559 43.606 152.258 1.00 0.00 H ATOM 28855 H2 WAT 4794 134.014 43.425 151.881 1.00 0.00 H TER 28857 WAT 4794 ATOM 28857 O WAT 4795 140.667 74.967 73.811 1.00 0.00 O ATOM 28858 H1 WAT 4795 140.773 74.330 74.517 1.00 0.00 H ATOM 28859 H2 WAT 4795 141.266 74.668 73.127 1.00 0.00 H TER 28861 WAT 4795 ATOM 28861 O WAT 4796 145.561 53.485 68.445 1.00 0.00 O ATOM 28862 H1 WAT 4796 146.220 53.964 67.943 1.00 0.00 H ATOM 28863 H2 WAT 4796 144.748 53.968 68.296 1.00 0.00 H TER 28865 WAT 4796 ATOM 28865 O WAT 4797 18.328 47.842 80.019 1.00 0.00 O ATOM 28866 H1 WAT 4797 18.760 48.412 80.655 1.00 0.00 H ATOM 28867 H2 WAT 4797 17.411 48.117 80.035 1.00 0.00 H TER 28869 WAT 4797 ATOM 28869 O WAT 4798 0.635 122.603 95.039 1.00 0.00 O ATOM 28870 H1 WAT 4798 -0.079 123.101 94.640 1.00 0.00 H ATOM 28871 H2 WAT 4798 1.186 123.266 95.456 1.00 0.00 H TER 28873 WAT 4798 ATOM 28873 O WAT 4799 92.555 118.883 13.340 1.00 0.00 O ATOM 28874 H1 WAT 4799 92.688 119.603 12.723 1.00 0.00 H ATOM 28875 H2 WAT 4799 92.511 118.102 12.789 1.00 0.00 H TER 28877 WAT 4799 ATOM 28877 O WAT 4800 21.503 68.988 154.523 1.00 0.00 O ATOM 28878 H1 WAT 4800 21.414 69.297 155.425 1.00 0.00 H ATOM 28879 H2 WAT 4800 22.201 68.335 154.562 1.00 0.00 H TER 28881 WAT 4800 ATOM 28881 O WAT 4801 31.952 69.076 131.137 1.00 0.00 O ATOM 28882 H1 WAT 4801 31.204 69.135 131.731 1.00 0.00 H ATOM 28883 H2 WAT 4801 32.689 69.413 131.646 1.00 0.00 H TER 28885 WAT 4801 ATOM 28885 O WAT 4802 42.718 66.839 72.347 1.00 0.00 O ATOM 28886 H1 WAT 4802 41.809 67.135 72.301 1.00 0.00 H ATOM 28887 H2 WAT 4802 42.882 66.713 73.282 1.00 0.00 H TER 28889 WAT 4802 ATOM 28889 O WAT 4803 47.974 25.928 135.167 1.00 0.00 O ATOM 28890 H1 WAT 4803 48.534 26.613 135.533 1.00 0.00 H ATOM 28891 H2 WAT 4803 48.288 25.120 135.572 1.00 0.00 H TER 28893 WAT 4803 ATOM 28893 O WAT 4804 57.615 69.900 153.920 1.00 0.00 O ATOM 28894 H1 WAT 4804 56.667 69.892 154.051 1.00 0.00 H ATOM 28895 H2 WAT 4804 57.734 69.631 153.009 1.00 0.00 H TER 28897 WAT 4804 ATOM 28897 O WAT 4805 78.410 112.865 2.649 1.00 0.00 O ATOM 28898 H1 WAT 4805 78.670 112.519 1.795 1.00 0.00 H ATOM 28899 H2 WAT 4805 77.464 112.990 2.579 1.00 0.00 H TER 28901 WAT 4805 ATOM 28901 O WAT 4806 54.558 113.454 63.366 1.00 0.00 O ATOM 28902 H1 WAT 4806 55.154 113.084 64.017 1.00 0.00 H ATOM 28903 H2 WAT 4806 53.694 113.403 63.776 1.00 0.00 H TER 28905 WAT 4806 ATOM 28905 O WAT 4807 34.722 55.156 131.692 1.00 0.00 O ATOM 28906 H1 WAT 4807 35.181 55.828 132.195 1.00 0.00 H ATOM 28907 H2 WAT 4807 35.321 54.409 131.686 1.00 0.00 H TER 28909 WAT 4807 ATOM 28909 O WAT 4808 45.251 142.320 4.451 1.00 0.00 O ATOM 28910 H1 WAT 4808 45.397 143.171 4.037 1.00 0.00 H ATOM 28911 H2 WAT 4808 45.440 141.683 3.761 1.00 0.00 H TER 28913 WAT 4808 ATOM 28913 O WAT 4809 109.130 90.014 19.634 1.00 0.00 O ATOM 28914 H1 WAT 4809 109.741 89.392 20.029 1.00 0.00 H ATOM 28915 H2 WAT 4809 108.694 90.427 20.379 1.00 0.00 H TER 28917 WAT 4809 ATOM 28917 O WAT 4810 52.906 27.146 2.016 1.00 0.00 O ATOM 28918 H1 WAT 4810 52.121 27.680 1.894 1.00 0.00 H ATOM 28919 H2 WAT 4810 52.997 27.067 2.966 1.00 0.00 H TER 28921 WAT 4810 ATOM 28921 O WAT 4811 26.003 119.695 65.143 1.00 0.00 O ATOM 28922 H1 WAT 4811 25.939 119.324 64.263 1.00 0.00 H ATOM 28923 H2 WAT 4811 25.719 118.988 65.722 1.00 0.00 H TER 28925 WAT 4811 ATOM 28925 O WAT 4812 93.580 90.110 13.762 1.00 0.00 O ATOM 28926 H1 WAT 4812 92.947 90.823 13.678 1.00 0.00 H ATOM 28927 H2 WAT 4812 94.433 90.535 13.671 1.00 0.00 H TER 28929 WAT 4812 ATOM 28929 O WAT 4813 97.908 140.216 16.823 1.00 0.00 O ATOM 28930 H1 WAT 4813 97.384 139.419 16.898 1.00 0.00 H ATOM 28931 H2 WAT 4813 97.264 140.924 16.786 1.00 0.00 H TER 28933 WAT 4813 ATOM 28933 O WAT 4814 5.735 114.988 79.236 1.00 0.00 O ATOM 28934 H1 WAT 4814 5.449 114.566 80.046 1.00 0.00 H ATOM 28935 H2 WAT 4814 5.019 114.835 78.620 1.00 0.00 H TER 28937 WAT 4814 ATOM 28937 O WAT 4815 135.573 130.022 78.986 1.00 0.00 O ATOM 28938 H1 WAT 4815 135.435 130.248 79.905 1.00 0.00 H ATOM 28939 H2 WAT 4815 136.525 129.985 78.889 1.00 0.00 H TER 28941 WAT 4815 ATOM 28941 O WAT 4816 144.261 115.194 126.487 1.00 0.00 O ATOM 28942 H1 WAT 4816 145.025 114.933 127.000 1.00 0.00 H ATOM 28943 H2 WAT 4816 143.523 114.765 126.921 1.00 0.00 H TER 28945 WAT 4816 ATOM 28945 O WAT 4817 4.363 27.930 144.170 1.00 0.00 O ATOM 28946 H1 WAT 4817 3.408 28.001 144.161 1.00 0.00 H ATOM 28947 H2 WAT 4817 4.670 28.819 143.990 1.00 0.00 H TER 28949 WAT 4817 ATOM 28949 O WAT 4818 30.612 127.254 153.698 1.00 0.00 O ATOM 28950 H1 WAT 4818 31.298 127.507 154.317 1.00 0.00 H ATOM 28951 H2 WAT 4818 30.518 128.013 153.122 1.00 0.00 H TER 28953 WAT 4818 ATOM 28953 O WAT 4819 95.055 55.298 106.273 1.00 0.00 O ATOM 28954 H1 WAT 4819 95.972 55.043 106.376 1.00 0.00 H ATOM 28955 H2 WAT 4819 95.079 56.045 105.676 1.00 0.00 H TER 28957 WAT 4819 ATOM 28957 O WAT 4820 69.999 83.882 101.150 1.00 0.00 O ATOM 28958 H1 WAT 4820 70.615 83.186 101.379 1.00 0.00 H ATOM 28959 H2 WAT 4820 69.699 83.656 100.270 1.00 0.00 H TER 28961 WAT 4820 ATOM 28961 O WAT 4821 57.717 86.103 76.057 1.00 0.00 O ATOM 28962 H1 WAT 4821 57.595 86.445 75.171 1.00 0.00 H ATOM 28963 H2 WAT 4821 58.573 85.675 76.032 1.00 0.00 H TER 28965 WAT 4821 ATOM 28965 O WAT 4822 60.979 134.611 83.335 1.00 0.00 O ATOM 28966 H1 WAT 4822 61.905 134.489 83.126 1.00 0.00 H ATOM 28967 H2 WAT 4822 60.962 135.379 83.906 1.00 0.00 H TER 28969 WAT 4822 ATOM 28969 O WAT 4823 90.054 83.674 149.305 1.00 0.00 O ATOM 28970 H1 WAT 4823 90.417 84.483 149.665 1.00 0.00 H ATOM 28971 H2 WAT 4823 89.879 83.128 150.071 1.00 0.00 H TER 28973 WAT 4823 ATOM 28973 O WAT 4824 60.236 3.011 84.039 1.00 0.00 O ATOM 28974 H1 WAT 4824 60.074 2.206 83.547 1.00 0.00 H ATOM 28975 H2 WAT 4824 60.057 3.714 83.414 1.00 0.00 H TER 28977 WAT 4824 ATOM 28977 O WAT 4825 101.039 43.681 12.611 1.00 0.00 O ATOM 28978 H1 WAT 4825 100.187 43.429 12.256 1.00 0.00 H ATOM 28979 H2 WAT 4825 100.863 43.897 13.527 1.00 0.00 H TER 28981 WAT 4825 ATOM 28981 O WAT 4826 52.632 119.811 80.410 1.00 0.00 O ATOM 28982 H1 WAT 4826 52.110 119.605 81.185 1.00 0.00 H ATOM 28983 H2 WAT 4826 53.080 120.627 80.633 1.00 0.00 H TER 28985 WAT 4826 ATOM 28985 O WAT 4827 27.865 85.832 89.524 1.00 0.00 O ATOM 28986 H1 WAT 4827 27.110 86.278 89.908 1.00 0.00 H ATOM 28987 H2 WAT 4827 27.522 85.422 88.730 1.00 0.00 H TER 28989 WAT 4827 ATOM 28989 O WAT 4828 36.139 110.270 153.259 1.00 0.00 O ATOM 28990 H1 WAT 4828 36.668 110.856 153.801 1.00 0.00 H ATOM 28991 H2 WAT 4828 35.555 109.833 153.878 1.00 0.00 H TER 28993 WAT 4828 ATOM 28993 O WAT 4829 136.939 72.882 73.363 1.00 0.00 O ATOM 28994 H1 WAT 4829 137.451 73.472 72.810 1.00 0.00 H ATOM 28995 H2 WAT 4829 136.968 73.284 74.232 1.00 0.00 H TER 28997 WAT 4829 ATOM 28997 O WAT 4830 4.385 143.685 138.198 1.00 0.00 O ATOM 28998 H1 WAT 4830 3.445 143.621 138.366 1.00 0.00 H ATOM 28999 H2 WAT 4830 4.613 144.580 138.449 1.00 0.00 H TER 29001 WAT 4830 ATOM 29001 O WAT 4831 110.966 17.980 142.165 1.00 0.00 O ATOM 29002 H1 WAT 4831 110.310 17.316 142.376 1.00 0.00 H ATOM 29003 H2 WAT 4831 111.803 17.523 142.244 1.00 0.00 H TER 29005 WAT 4831 ATOM 29005 O WAT 4832 122.321 122.204 119.192 1.00 0.00 O ATOM 29006 H1 WAT 4832 123.109 122.445 118.705 1.00 0.00 H ATOM 29007 H2 WAT 4832 122.020 123.026 119.580 1.00 0.00 H TER 29009 WAT 4832 ATOM 29009 O WAT 4833 9.626 134.348 77.620 1.00 0.00 O ATOM 29010 H1 WAT 4833 8.869 134.883 77.861 1.00 0.00 H ATOM 29011 H2 WAT 4833 9.377 133.457 77.863 1.00 0.00 H TER 29013 WAT 4833 ATOM 29013 O WAT 4834 144.550 114.255 89.446 1.00 0.00 O ATOM 29014 H1 WAT 4834 145.292 114.755 89.106 1.00 0.00 H ATOM 29015 H2 WAT 4834 143.889 114.308 88.756 1.00 0.00 H TER 29017 WAT 4834 ATOM 29017 O WAT 4835 119.765 4.345 124.250 1.00 0.00 O ATOM 29018 H1 WAT 4835 118.876 4.226 124.583 1.00 0.00 H ATOM 29019 H2 WAT 4835 119.843 3.707 123.541 1.00 0.00 H TER 29021 WAT 4835 ATOM 29021 O WAT 4836 71.464 61.253 24.048 1.00 0.00 O ATOM 29022 H1 WAT 4836 71.742 60.393 23.732 1.00 0.00 H ATOM 29023 H2 WAT 4836 71.636 61.229 24.989 1.00 0.00 H TER 29025 WAT 4836 ATOM 29025 O WAT 4837 6.319 47.954 10.906 1.00 0.00 O ATOM 29026 H1 WAT 4837 5.950 48.766 10.559 1.00 0.00 H ATOM 29027 H2 WAT 4837 5.724 47.270 10.599 1.00 0.00 H TER 29029 WAT 4837 ATOM 29029 O WAT 4838 13.955 20.948 129.156 1.00 0.00 O ATOM 29030 H1 WAT 4838 13.856 20.193 128.576 1.00 0.00 H ATOM 29031 H2 WAT 4838 14.646 21.472 128.753 1.00 0.00 H TER 29033 WAT 4838 ATOM 29033 O WAT 4839 127.988 60.900 79.524 1.00 0.00 O ATOM 29034 H1 WAT 4839 127.850 60.023 79.168 1.00 0.00 H ATOM 29035 H2 WAT 4839 127.110 61.277 79.579 1.00 0.00 H TER 29037 WAT 4839 ATOM 29037 O WAT 4840 99.473 19.555 55.792 1.00 0.00 O ATOM 29038 H1 WAT 4840 100.323 19.158 55.597 1.00 0.00 H ATOM 29039 H2 WAT 4840 98.945 19.382 55.012 1.00 0.00 H TER 29041 WAT 4840 ATOM 29041 O WAT 4841 124.658 134.859 81.507 1.00 0.00 O ATOM 29042 H1 WAT 4841 124.649 135.799 81.689 1.00 0.00 H ATOM 29043 H2 WAT 4841 125.497 134.707 81.073 1.00 0.00 H TER 29045 WAT 4841 ATOM 29045 O WAT 4842 33.310 91.997 76.500 1.00 0.00 O ATOM 29046 H1 WAT 4842 33.551 92.692 77.113 1.00 0.00 H ATOM 29047 H2 WAT 4842 33.924 92.096 75.773 1.00 0.00 H TER 29049 WAT 4842 ATOM 29049 O WAT 4843 66.258 120.268 89.967 1.00 0.00 O ATOM 29050 H1 WAT 4843 67.048 119.831 89.648 1.00 0.00 H ATOM 29051 H2 WAT 4843 66.230 120.061 90.901 1.00 0.00 H TER 29053 WAT 4843 ATOM 29053 O WAT 4844 49.997 85.718 132.020 1.00 0.00 O ATOM 29054 H1 WAT 4844 50.136 85.354 131.145 1.00 0.00 H ATOM 29055 H2 WAT 4844 50.495 86.535 132.021 1.00 0.00 H TER 29057 WAT 4844 ATOM 29057 O WAT 4845 90.031 113.492 72.142 1.00 0.00 O ATOM 29058 H1 WAT 4845 89.387 112.800 72.291 1.00 0.00 H ATOM 29059 H2 WAT 4845 90.763 113.049 71.712 1.00 0.00 H TER 29061 WAT 4845 ATOM 29061 O WAT 4846 122.209 15.720 157.356 1.00 0.00 O ATOM 29062 H1 WAT 4846 122.577 15.790 156.475 1.00 0.00 H ATOM 29063 H2 WAT 4846 122.309 14.796 157.585 1.00 0.00 H TER 29065 WAT 4846 ATOM 29065 O WAT 4847 24.110 1.459 128.035 1.00 0.00 O ATOM 29066 H1 WAT 4847 23.272 1.364 128.486 1.00 0.00 H ATOM 29067 H2 WAT 4847 24.041 0.878 127.277 1.00 0.00 H TER 29069 WAT 4847 ATOM 29069 O WAT 4848 38.954 65.220 62.970 1.00 0.00 O ATOM 29070 H1 WAT 4848 39.666 65.837 63.141 1.00 0.00 H ATOM 29071 H2 WAT 4848 39.286 64.662 62.266 1.00 0.00 H TER 29073 WAT 4848 ATOM 29073 O WAT 4849 11.311 62.358 77.361 1.00 0.00 O ATOM 29074 H1 WAT 4849 11.979 62.902 77.777 1.00 0.00 H ATOM 29075 H2 WAT 4849 10.723 62.112 78.075 1.00 0.00 H TER 29077 WAT 4849 ATOM 29077 O WAT 4850 117.080 99.136 117.603 1.00 0.00 O ATOM 29078 H1 WAT 4850 117.081 98.894 116.677 1.00 0.00 H ATOM 29079 H2 WAT 4850 117.641 99.911 117.648 1.00 0.00 H TER 29081 WAT 4850 ATOM 29081 O WAT 4851 7.827 64.615 153.312 1.00 0.00 O ATOM 29082 H1 WAT 4851 7.675 65.507 153.001 1.00 0.00 H ATOM 29083 H2 WAT 4851 7.522 64.057 152.597 1.00 0.00 H TER 29085 WAT 4851 ATOM 29085 O WAT 4852 99.399 94.254 119.081 1.00 0.00 O ATOM 29086 H1 WAT 4852 98.545 94.585 118.803 1.00 0.00 H ATOM 29087 H2 WAT 4852 99.728 94.919 119.686 1.00 0.00 H TER 29089 WAT 4852 ATOM 29089 O WAT 4853 3.719 101.753 145.480 1.00 0.00 O ATOM 29090 H1 WAT 4853 3.617 100.988 144.914 1.00 0.00 H ATOM 29091 H2 WAT 4853 3.070 102.378 145.156 1.00 0.00 H TER 29093 WAT 4853 ATOM 29093 O WAT 4854 134.433 86.481 72.782 1.00 0.00 O ATOM 29094 H1 WAT 4854 134.873 86.267 73.605 1.00 0.00 H ATOM 29095 H2 WAT 4854 135.039 86.184 72.103 1.00 0.00 H TER 29097 WAT 4854 ATOM 29097 O WAT 4855 124.003 56.209 153.187 1.00 0.00 O ATOM 29098 H1 WAT 4855 123.473 57.006 153.190 1.00 0.00 H ATOM 29099 H2 WAT 4855 124.458 56.220 154.029 1.00 0.00 H TER 29101 WAT 4855 ATOM 29101 O WAT 4856 67.257 53.839 10.983 1.00 0.00 O ATOM 29102 H1 WAT 4856 67.316 53.759 11.935 1.00 0.00 H ATOM 29103 H2 WAT 4856 68.158 53.729 10.678 1.00 0.00 H TER 29105 WAT 4856 ATOM 29105 O WAT 4857 15.753 130.208 62.677 1.00 0.00 O ATOM 29106 H1 WAT 4857 16.020 130.899 63.283 1.00 0.00 H ATOM 29107 H2 WAT 4857 16.574 129.805 62.396 1.00 0.00 H TER 29109 WAT 4857 ATOM 29109 O WAT 4858 95.755 107.863 1.672 1.00 0.00 O ATOM 29110 H1 WAT 4858 94.917 108.201 1.986 1.00 0.00 H ATOM 29111 H2 WAT 4858 96.133 107.417 2.430 1.00 0.00 H TER 29113 WAT 4858 ATOM 29113 O WAT 4859 23.780 41.573 83.665 1.00 0.00 O ATOM 29114 H1 WAT 4859 24.540 41.841 84.183 1.00 0.00 H ATOM 29115 H2 WAT 4859 23.562 42.346 83.144 1.00 0.00 H TER 29117 WAT 4859 ATOM 29117 O WAT 4860 91.887 98.356 129.755 1.00 0.00 O ATOM 29118 H1 WAT 4860 91.275 97.811 130.250 1.00 0.00 H ATOM 29119 H2 WAT 4860 92.610 98.517 130.362 1.00 0.00 H TER 29121 WAT 4860 ATOM 29121 O WAT 4861 128.902 12.270 12.816 1.00 0.00 O ATOM 29122 H1 WAT 4861 129.653 11.748 13.097 1.00 0.00 H ATOM 29123 H2 WAT 4861 129.113 12.533 11.921 1.00 0.00 H TER 29125 WAT 4861 ATOM 29125 O WAT 4862 139.538 36.223 141.424 1.00 0.00 O ATOM 29126 H1 WAT 4862 139.855 37.029 141.016 1.00 0.00 H ATOM 29127 H2 WAT 4862 138.891 35.881 140.807 1.00 0.00 H TER 29129 WAT 4862 ATOM 29129 O WAT 4863 56.524 103.380 91.108 1.00 0.00 O ATOM 29130 H1 WAT 4863 57.416 103.051 91.217 1.00 0.00 H ATOM 29131 H2 WAT 4863 56.046 103.031 91.860 1.00 0.00 H TER 29133 WAT 4863 ATOM 29133 O WAT 4864 96.584 24.249 2.282 1.00 0.00 O ATOM 29134 H1 WAT 4864 95.890 23.620 2.475 1.00 0.00 H ATOM 29135 H2 WAT 4864 96.176 25.105 2.412 1.00 0.00 H TER 29137 WAT 4864 ATOM 29137 O WAT 4865 10.087 119.103 56.113 1.00 0.00 O ATOM 29138 H1 WAT 4865 9.353 119.717 56.115 1.00 0.00 H ATOM 29139 H2 WAT 4865 9.734 118.311 55.707 1.00 0.00 H TER 29141 WAT 4865 ATOM 29141 O WAT 4866 101.242 86.879 136.514 1.00 0.00 O ATOM 29142 H1 WAT 4866 101.635 87.752 136.522 1.00 0.00 H ATOM 29143 H2 WAT 4866 100.765 86.823 137.342 1.00 0.00 H TER 29145 WAT 4866 ATOM 29145 O WAT 4867 22.432 128.194 69.386 1.00 0.00 O ATOM 29146 H1 WAT 4867 22.454 129.134 69.564 1.00 0.00 H ATOM 29147 H2 WAT 4867 21.800 127.846 70.016 1.00 0.00 H TER 29149 WAT 4867 ATOM 29149 O WAT 4868 28.737 133.393 14.921 1.00 0.00 O ATOM 29150 H1 WAT 4868 29.398 132.944 14.395 1.00 0.00 H ATOM 29151 H2 WAT 4868 28.708 132.900 15.741 1.00 0.00 H TER 29153 WAT 4868 ATOM 29153 O WAT 4869 57.159 64.518 138.277 1.00 0.00 O ATOM 29154 H1 WAT 4869 57.902 64.430 138.875 1.00 0.00 H ATOM 29155 H2 WAT 4869 56.917 63.618 138.061 1.00 0.00 H TER 29157 WAT 4869 ATOM 29157 O WAT 4870 97.085 42.121 15.545 1.00 0.00 O ATOM 29158 H1 WAT 4870 97.671 41.568 15.027 1.00 0.00 H ATOM 29159 H2 WAT 4870 96.512 42.533 14.898 1.00 0.00 H TER 29161 WAT 4870 ATOM 29161 O WAT 4871 33.221 63.377 89.577 1.00 0.00 O ATOM 29162 H1 WAT 4871 33.721 62.893 88.919 1.00 0.00 H ATOM 29163 H2 WAT 4871 32.310 63.135 89.412 1.00 0.00 H TER 29165 WAT 4871 ATOM 29165 O WAT 4872 9.882 32.585 149.305 1.00 0.00 O ATOM 29166 H1 WAT 4872 9.507 32.572 150.186 1.00 0.00 H ATOM 29167 H2 WAT 4872 9.416 33.291 148.857 1.00 0.00 H TER 29169 WAT 4872 ATOM 29169 O WAT 4873 15.012 41.708 85.773 1.00 0.00 O ATOM 29170 H1 WAT 4873 15.425 42.570 85.823 1.00 0.00 H ATOM 29171 H2 WAT 4873 14.480 41.743 84.978 1.00 0.00 H TER 29173 WAT 4873 ATOM 29173 O WAT 4874 117.192 32.004 2.152 1.00 0.00 O ATOM 29174 H1 WAT 4874 117.823 31.622 2.763 1.00 0.00 H ATOM 29175 H2 WAT 4874 117.550 31.808 1.285 1.00 0.00 H TER 29177 WAT 4874 ATOM 29177 O WAT 4875 44.098 41.823 9.475 1.00 0.00 O ATOM 29178 H1 WAT 4875 44.623 41.381 10.142 1.00 0.00 H ATOM 29179 H2 WAT 4875 43.664 42.535 9.945 1.00 0.00 H TER 29181 WAT 4875 ATOM 29181 O WAT 4876 110.765 67.033 145.315 1.00 0.00 O ATOM 29182 H1 WAT 4876 110.253 66.773 144.549 1.00 0.00 H ATOM 29183 H2 WAT 4876 110.112 67.194 145.996 1.00 0.00 H TER 29185 WAT 4876 ATOM 29185 O WAT 4877 117.505 40.008 137.452 1.00 0.00 O ATOM 29186 H1 WAT 4877 116.768 39.509 137.099 1.00 0.00 H ATOM 29187 H2 WAT 4877 117.208 40.918 137.435 1.00 0.00 H TER 29189 WAT 4877 ATOM 29189 O WAT 4878 18.481 138.875 0.443 1.00 0.00 O ATOM 29190 H1 WAT 4878 17.612 138.756 0.061 1.00 0.00 H ATOM 29191 H2 WAT 4878 18.312 139.180 1.334 1.00 0.00 H TER 29193 WAT 4878 ATOM 29193 O WAT 4879 39.637 101.392 148.405 1.00 0.00 O ATOM 29194 H1 WAT 4879 38.815 101.122 148.814 1.00 0.00 H ATOM 29195 H2 WAT 4879 40.317 100.997 148.950 1.00 0.00 H TER 29197 WAT 4879 ATOM 29197 O WAT 4880 117.073 55.040 127.601 1.00 0.00 O ATOM 29198 H1 WAT 4880 117.183 54.548 128.414 1.00 0.00 H ATOM 29199 H2 WAT 4880 116.599 54.443 127.022 1.00 0.00 H TER 29201 WAT 4880 ATOM 29201 O WAT 4881 47.623 17.523 61.523 1.00 0.00 O ATOM 29202 H1 WAT 4881 47.478 17.207 60.631 1.00 0.00 H ATOM 29203 H2 WAT 4881 46.778 17.887 61.789 1.00 0.00 H TER 29205 WAT 4881 ATOM 29205 O WAT 4882 76.727 99.642 108.706 1.00 0.00 O ATOM 29206 H1 WAT 4882 76.474 98.900 108.156 1.00 0.00 H ATOM 29207 H2 WAT 4882 77.601 99.881 108.397 1.00 0.00 H TER 29209 WAT 4882 ATOM 29209 O WAT 4883 69.588 142.233 74.745 1.00 0.00 O ATOM 29210 H1 WAT 4883 68.882 141.768 75.192 1.00 0.00 H ATOM 29211 H2 WAT 4883 70.360 141.682 74.878 1.00 0.00 H TER 29213 WAT 4883 ATOM 29213 O WAT 4884 33.399 2.955 113.339 1.00 0.00 O ATOM 29214 H1 WAT 4884 33.494 3.878 113.105 1.00 0.00 H ATOM 29215 H2 WAT 4884 33.813 2.881 114.199 1.00 0.00 H TER 29217 WAT 4884 ATOM 29217 O WAT 4885 130.520 42.194 7.225 1.00 0.00 O ATOM 29218 H1 WAT 4885 130.907 42.015 8.082 1.00 0.00 H ATOM 29219 H2 WAT 4885 130.859 41.500 6.659 1.00 0.00 H TER 29221 WAT 4885 ATOM 29221 O WAT 4886 119.634 29.197 19.313 1.00 0.00 O ATOM 29222 H1 WAT 4886 120.061 28.343 19.246 1.00 0.00 H ATOM 29223 H2 WAT 4886 119.498 29.469 18.405 1.00 0.00 H TER 29225 WAT 4886 ATOM 29225 O WAT 4887 11.849 3.512 136.809 1.00 0.00 O ATOM 29226 H1 WAT 4887 12.743 3.339 137.103 1.00 0.00 H ATOM 29227 H2 WAT 4887 11.917 3.562 135.855 1.00 0.00 H TER 29229 WAT 4887 ATOM 29229 O WAT 4888 15.044 82.642 87.707 1.00 0.00 O ATOM 29230 H1 WAT 4888 14.479 82.431 88.450 1.00 0.00 H ATOM 29231 H2 WAT 4888 15.251 81.793 87.315 1.00 0.00 H TER 29233 WAT 4888 ATOM 29233 O WAT 4889 48.106 83.820 124.004 1.00 0.00 O ATOM 29234 H1 WAT 4889 48.971 83.806 124.415 1.00 0.00 H ATOM 29235 H2 WAT 4889 47.615 84.473 124.502 1.00 0.00 H TER 29237 WAT 4889 ATOM 29237 O WAT 4890 67.943 123.575 85.770 1.00 0.00 O ATOM 29238 H1 WAT 4890 68.036 123.966 84.901 1.00 0.00 H ATOM 29239 H2 WAT 4890 66.998 123.482 85.891 1.00 0.00 H TER 29241 WAT 4890 ATOM 29241 O WAT 4891 73.381 16.826 137.671 1.00 0.00 O ATOM 29242 H1 WAT 4891 72.973 17.211 138.447 1.00 0.00 H ATOM 29243 H2 WAT 4891 73.880 16.082 138.008 1.00 0.00 H TER 29245 WAT 4891 ATOM 29245 O WAT 4892 75.349 129.313 65.639 1.00 0.00 O ATOM 29246 H1 WAT 4892 75.381 129.312 64.682 1.00 0.00 H ATOM 29247 H2 WAT 4892 76.227 129.583 65.908 1.00 0.00 H TER 29249 WAT 4892 ATOM 29249 O WAT 4893 142.388 118.156 12.405 1.00 0.00 O ATOM 29250 H1 WAT 4893 142.498 117.225 12.595 1.00 0.00 H ATOM 29251 H2 WAT 4893 143.280 118.485 12.293 1.00 0.00 H TER 29253 WAT 4893 ATOM 29253 O WAT 4894 24.099 0.140 8.096 1.00 0.00 O ATOM 29254 H1 WAT 4894 23.747 0.707 8.782 1.00 0.00 H ATOM 29255 H2 WAT 4894 25.043 0.296 8.117 1.00 0.00 H TER 29257 WAT 4894 ATOM 29257 O WAT 4895 89.990 53.486 55.801 1.00 0.00 O ATOM 29258 H1 WAT 4895 90.104 54.140 55.112 1.00 0.00 H ATOM 29259 H2 WAT 4895 90.828 53.479 56.265 1.00 0.00 H TER 29261 WAT 4895 ATOM 29261 O WAT 4896 30.389 77.225 139.652 1.00 0.00 O ATOM 29262 H1 WAT 4896 30.715 77.952 140.182 1.00 0.00 H ATOM 29263 H2 WAT 4896 30.478 76.457 140.217 1.00 0.00 H TER 29265 WAT 4896 ATOM 29265 O WAT 4897 69.117 126.735 86.483 1.00 0.00 O ATOM 29266 H1 WAT 4897 69.820 126.090 86.411 1.00 0.00 H ATOM 29267 H2 WAT 4897 69.565 127.553 86.701 1.00 0.00 H TER 29269 WAT 4897 ATOM 29269 O WAT 4898 139.304 12.422 107.211 1.00 0.00 O ATOM 29270 H1 WAT 4898 138.488 12.903 107.349 1.00 0.00 H ATOM 29271 H2 WAT 4898 139.745 12.452 108.060 1.00 0.00 H TER 29273 WAT 4898 ATOM 29273 O WAT 4899 11.281 97.235 137.506 1.00 0.00 O ATOM 29274 H1 WAT 4899 10.648 97.949 137.580 1.00 0.00 H ATOM 29275 H2 WAT 4899 10.755 96.440 137.592 1.00 0.00 H TER 29277 WAT 4899 ATOM 29277 O WAT 4900 140.707 127.304 152.602 1.00 0.00 O ATOM 29278 H1 WAT 4900 140.962 128.052 153.142 1.00 0.00 H ATOM 29279 H2 WAT 4900 139.762 127.227 152.730 1.00 0.00 H TER 29281 WAT 4900 ATOM 29281 O WAT 4901 122.707 42.949 139.330 1.00 0.00 O ATOM 29282 H1 WAT 4901 121.795 42.859 139.052 1.00 0.00 H ATOM 29283 H2 WAT 4901 123.063 43.634 138.763 1.00 0.00 H TER 29285 WAT 4901 ATOM 29285 O WAT 4902 137.953 93.816 14.812 1.00 0.00 O ATOM 29286 H1 WAT 4902 137.695 93.484 13.952 1.00 0.00 H ATOM 29287 H2 WAT 4902 137.406 94.591 14.944 1.00 0.00 H TER 29289 WAT 4902 ATOM 29289 O WAT 4903 94.807 13.412 17.218 1.00 0.00 O ATOM 29290 H1 WAT 4903 95.756 13.406 17.337 1.00 0.00 H ATOM 29291 H2 WAT 4903 94.631 14.215 16.728 1.00 0.00 H TER 29293 WAT 4903 ATOM 29293 O WAT 4904 104.171 89.008 150.852 1.00 0.00 O ATOM 29294 H1 WAT 4904 103.961 89.942 150.843 1.00 0.00 H ATOM 29295 H2 WAT 4904 104.968 88.947 151.379 1.00 0.00 H TER 29297 WAT 4904 ATOM 29297 O WAT 4905 4.400 64.548 74.937 1.00 0.00 O ATOM 29298 H1 WAT 4905 4.479 65.269 75.562 1.00 0.00 H ATOM 29299 H2 WAT 4905 5.070 64.728 74.277 1.00 0.00 H TER 29301 WAT 4905 ATOM 29301 O WAT 4906 127.844 54.521 19.735 1.00 0.00 O ATOM 29302 H1 WAT 4906 128.359 54.696 18.948 1.00 0.00 H ATOM 29303 H2 WAT 4906 128.198 53.699 20.075 1.00 0.00 H TER 29305 WAT 4906 ATOM 29305 O WAT 4907 133.283 109.175 66.304 1.00 0.00 O ATOM 29306 H1 WAT 4907 134.043 109.213 65.723 1.00 0.00 H ATOM 29307 H2 WAT 4907 133.642 109.331 67.177 1.00 0.00 H TER 29309 WAT 4907 ATOM 29309 O WAT 4908 45.381 143.790 97.979 1.00 0.00 O ATOM 29310 H1 WAT 4908 45.897 143.617 98.767 1.00 0.00 H ATOM 29311 H2 WAT 4908 44.472 143.696 98.263 1.00 0.00 H TER 29313 WAT 4908 ATOM 29313 O WAT 4909 57.295 138.877 100.130 1.00 0.00 O ATOM 29314 H1 WAT 4909 57.616 139.395 100.869 1.00 0.00 H ATOM 29315 H2 WAT 4909 57.906 139.070 99.419 1.00 0.00 H TER 29317 WAT 4909 ATOM 29317 O WAT 4910 113.309 103.979 96.801 1.00 0.00 O ATOM 29318 H1 WAT 4910 114.230 104.206 96.933 1.00 0.00 H ATOM 29319 H2 WAT 4910 113.328 103.258 96.172 1.00 0.00 H TER 29321 WAT 4910 ATOM 29321 O WAT 4911 24.207 111.656 85.569 1.00 0.00 O ATOM 29322 H1 WAT 4911 24.290 112.567 85.851 1.00 0.00 H ATOM 29323 H2 WAT 4911 24.410 111.143 86.351 1.00 0.00 H TER 29325 WAT 4911 ATOM 29325 O WAT 4912 94.435 81.395 3.799 1.00 0.00 O ATOM 29326 H1 WAT 4912 94.014 82.249 3.699 1.00 0.00 H ATOM 29327 H2 WAT 4912 95.205 81.570 4.340 1.00 0.00 H TER 29329 WAT 4912 ATOM 29329 O WAT 4913 109.218 103.222 117.897 1.00 0.00 O ATOM 29330 H1 WAT 4913 108.536 102.965 118.517 1.00 0.00 H ATOM 29331 H2 WAT 4913 109.373 104.148 118.080 1.00 0.00 H TER 29333 WAT 4913 ATOM 29333 O WAT 4914 72.572 99.047 124.856 1.00 0.00 O ATOM 29334 H1 WAT 4914 71.912 98.804 124.206 1.00 0.00 H ATOM 29335 H2 WAT 4914 73.306 98.457 124.685 1.00 0.00 H TER 29337 WAT 4914 ATOM 29337 O WAT 4915 7.111 72.600 60.803 1.00 0.00 O ATOM 29338 H1 WAT 4915 6.469 72.034 61.233 1.00 0.00 H ATOM 29339 H2 WAT 4915 7.959 72.223 61.039 1.00 0.00 H TER 29341 WAT 4915 ATOM 29341 O WAT 4916 88.480 34.283 145.758 1.00 0.00 O ATOM 29342 H1 WAT 4916 88.111 33.862 144.981 1.00 0.00 H ATOM 29343 H2 WAT 4916 88.735 33.556 146.326 1.00 0.00 H TER 29345 WAT 4916 ATOM 29345 O WAT 4917 31.201 74.846 66.461 1.00 0.00 O ATOM 29346 H1 WAT 4917 30.432 75.303 66.121 1.00 0.00 H ATOM 29347 H2 WAT 4917 31.146 73.969 66.081 1.00 0.00 H TER 29349 WAT 4917 ATOM 29349 O WAT 4918 4.764 10.212 9.259 1.00 0.00 O ATOM 29350 H1 WAT 4918 5.319 9.494 8.956 1.00 0.00 H ATOM 29351 H2 WAT 4918 5.379 10.913 9.479 1.00 0.00 H TER 29353 WAT 4918 ATOM 29353 O WAT 4919 17.907 142.587 20.346 1.00 0.00 O ATOM 29354 H1 WAT 4919 17.128 142.360 20.854 1.00 0.00 H ATOM 29355 H2 WAT 4919 18.634 142.210 20.841 1.00 0.00 H TER 29357 WAT 4919 ATOM 29357 O WAT 4920 90.362 18.650 93.426 1.00 0.00 O ATOM 29358 H1 WAT 4920 89.983 18.142 94.143 1.00 0.00 H ATOM 29359 H2 WAT 4920 90.965 19.257 93.855 1.00 0.00 H TER 29361 WAT 4920 ATOM 29361 O WAT 4921 79.625 36.386 89.075 1.00 0.00 O ATOM 29362 H1 WAT 4921 80.547 36.529 89.289 1.00 0.00 H ATOM 29363 H2 WAT 4921 79.492 36.861 88.254 1.00 0.00 H TER 29365 WAT 4921 ATOM 29365 O WAT 4922 60.340 101.912 3.162 1.00 0.00 O ATOM 29366 H1 WAT 4922 59.990 102.194 4.007 1.00 0.00 H ATOM 29367 H2 WAT 4922 60.672 102.715 2.761 1.00 0.00 H TER 29369 WAT 4922 ATOM 29369 O WAT 4923 91.766 44.970 127.368 1.00 0.00 O ATOM 29370 H1 WAT 4923 92.578 44.628 127.743 1.00 0.00 H ATOM 29371 H2 WAT 4923 91.176 45.059 128.117 1.00 0.00 H TER 29373 WAT 4923 ATOM 29373 O WAT 4924 10.421 12.897 104.006 1.00 0.00 O ATOM 29374 H1 WAT 4924 9.864 13.394 104.606 1.00 0.00 H ATOM 29375 H2 WAT 4924 10.445 12.015 104.376 1.00 0.00 H TER 29377 WAT 4924 ATOM 29377 O WAT 4925 3.821 92.203 91.855 1.00 0.00 O ATOM 29378 H1 WAT 4925 4.540 92.388 92.460 1.00 0.00 H ATOM 29379 H2 WAT 4925 4.173 91.539 91.262 1.00 0.00 H TER 29381 WAT 4925 ATOM 29381 O WAT 4926 27.743 74.904 13.794 1.00 0.00 O ATOM 29382 H1 WAT 4926 28.618 74.797 13.420 1.00 0.00 H ATOM 29383 H2 WAT 4926 27.632 74.144 14.365 1.00 0.00 H TER 29385 WAT 4926 ATOM 29385 O WAT 4927 126.180 97.166 11.769 1.00 0.00 O ATOM 29386 H1 WAT 4927 125.522 97.414 11.120 1.00 0.00 H ATOM 29387 H2 WAT 4927 126.579 96.371 11.414 1.00 0.00 H TER 29389 WAT 4927 ATOM 29389 O WAT 4928 62.328 116.392 140.377 1.00 0.00 O ATOM 29390 H1 WAT 4928 62.721 116.129 141.209 1.00 0.00 H ATOM 29391 H2 WAT 4928 61.666 115.723 140.203 1.00 0.00 H TER 29393 WAT 4928 ATOM 29393 O WAT 4929 87.723 83.272 153.900 1.00 0.00 O ATOM 29394 H1 WAT 4929 86.798 83.081 153.744 1.00 0.00 H ATOM 29395 H2 WAT 4929 88.173 82.923 153.131 1.00 0.00 H TER 29397 WAT 4929 ATOM 29397 O WAT 4930 43.247 55.036 148.238 1.00 0.00 O ATOM 29398 H1 WAT 4930 43.081 55.572 149.014 1.00 0.00 H ATOM 29399 H2 WAT 4930 43.679 54.252 148.577 1.00 0.00 H TER 29401 WAT 4930 ATOM 29401 O WAT 4931 43.249 136.081 123.862 1.00 0.00 O ATOM 29402 H1 WAT 4931 42.910 135.682 123.061 1.00 0.00 H ATOM 29403 H2 WAT 4931 43.452 135.340 124.432 1.00 0.00 H TER 29405 WAT 4931 ATOM 29405 O WAT 4932 34.719 86.380 131.299 1.00 0.00 O ATOM 29406 H1 WAT 4932 34.425 85.847 132.038 1.00 0.00 H ATOM 29407 H2 WAT 4932 35.012 85.743 130.647 1.00 0.00 H TER 29409 WAT 4932 ATOM 29409 O WAT 4933 91.648 -0.104 90.210 1.00 0.00 O ATOM 29410 H1 WAT 4933 91.487 0.334 91.046 1.00 0.00 H ATOM 29411 H2 WAT 4933 92.342 0.412 89.799 1.00 0.00 H TER 29413 WAT 4933 ATOM 29413 O WAT 4934 76.187 98.425 128.443 1.00 0.00 O ATOM 29414 H1 WAT 4934 76.311 98.276 129.381 1.00 0.00 H ATOM 29415 H2 WAT 4934 76.463 97.605 128.032 1.00 0.00 H TER 29417 WAT 4934 ATOM 29417 O WAT 4935 11.663 23.269 73.032 1.00 0.00 O ATOM 29418 H1 WAT 4935 11.948 22.564 73.614 1.00 0.00 H ATOM 29419 H2 WAT 4935 11.386 23.970 73.622 1.00 0.00 H TER 29421 WAT 4935 ATOM 29421 O WAT 4936 28.139 13.365 157.404 1.00 0.00 O ATOM 29422 H1 WAT 4936 27.503 13.619 156.735 1.00 0.00 H ATOM 29423 H2 WAT 4936 28.041 12.416 157.479 1.00 0.00 H TER 29425 WAT 4936 ATOM 29425 O WAT 4937 106.242 5.371 151.750 1.00 0.00 O ATOM 29426 H1 WAT 4937 106.801 4.852 151.172 1.00 0.00 H ATOM 29427 H2 WAT 4937 106.844 5.742 152.396 1.00 0.00 H TER 29429 WAT 4937 ATOM 29429 O WAT 4938 13.804 101.851 90.337 1.00 0.00 O ATOM 29430 H1 WAT 4938 14.559 102.414 90.510 1.00 0.00 H ATOM 29431 H2 WAT 4938 13.530 101.545 91.201 1.00 0.00 H TER 29433 WAT 4938 ATOM 29433 O WAT 4939 141.080 79.774 90.486 1.00 0.00 O ATOM 29434 H1 WAT 4939 140.440 80.485 90.459 1.00 0.00 H ATOM 29435 H2 WAT 4939 140.832 79.258 91.253 1.00 0.00 H TER 29437 WAT 4939 ATOM 29437 O WAT 4940 142.456 117.600 71.909 1.00 0.00 O ATOM 29438 H1 WAT 4940 142.160 118.146 71.181 1.00 0.00 H ATOM 29439 H2 WAT 4940 141.897 117.854 72.643 1.00 0.00 H TER 29441 WAT 4940 ATOM 29441 O WAT 4941 62.764 114.087 82.545 1.00 0.00 O ATOM 29442 H1 WAT 4941 63.628 114.323 82.883 1.00 0.00 H ATOM 29443 H2 WAT 4941 62.330 114.926 82.390 1.00 0.00 H TER 29445 WAT 4941 ATOM 29445 O WAT 4942 75.718 6.544 127.180 1.00 0.00 O ATOM 29446 H1 WAT 4942 76.376 7.039 126.692 1.00 0.00 H ATOM 29447 H2 WAT 4942 75.191 7.212 127.618 1.00 0.00 H TER 29449 WAT 4942 ATOM 29449 O WAT 4943 34.340 45.060 60.912 1.00 0.00 O ATOM 29450 H1 WAT 4943 34.468 44.448 60.187 1.00 0.00 H ATOM 29451 H2 WAT 4943 35.116 44.946 61.461 1.00 0.00 H TER 29453 WAT 4943 ATOM 29453 O WAT 4944 132.499 94.562 150.047 1.00 0.00 O ATOM 29454 H1 WAT 4944 132.974 94.565 149.216 1.00 0.00 H ATOM 29455 H2 WAT 4944 131.595 94.362 149.805 1.00 0.00 H TER 29457 WAT 4944 ATOM 29457 O WAT 4945 23.555 88.923 81.908 1.00 0.00 O ATOM 29458 H1 WAT 4945 22.835 89.479 81.610 1.00 0.00 H ATOM 29459 H2 WAT 4945 23.135 88.263 82.460 1.00 0.00 H TER 29461 WAT 4945 ATOM 29461 O WAT 4946 46.662 138.326 157.977 1.00 0.00 O ATOM 29462 H1 WAT 4946 47.234 137.910 157.332 1.00 0.00 H ATOM 29463 H2 WAT 4946 45.787 138.002 157.767 1.00 0.00 H TER 29465 WAT 4946 ATOM 29465 O WAT 4947 68.856 109.126 70.895 1.00 0.00 O ATOM 29466 H1 WAT 4947 69.132 108.218 71.024 1.00 0.00 H ATOM 29467 H2 WAT 4947 68.881 109.252 69.947 1.00 0.00 H TER 29469 WAT 4947 ATOM 29469 O WAT 4948 89.275 11.610 66.176 1.00 0.00 O ATOM 29470 H1 WAT 4948 88.499 12.046 65.824 1.00 0.00 H ATOM 29471 H2 WAT 4948 88.931 10.996 66.825 1.00 0.00 H TER 29473 WAT 4948 ATOM 29473 O WAT 4949 18.967 89.846 126.688 1.00 0.00 O ATOM 29474 H1 WAT 4949 18.055 90.089 126.525 1.00 0.00 H ATOM 29475 H2 WAT 4949 19.181 89.236 125.982 1.00 0.00 H TER 29477 WAT 4949 ATOM 29477 O WAT 4950 56.888 144.468 138.701 1.00 0.00 O ATOM 29478 H1 WAT 4950 57.753 144.250 138.355 1.00 0.00 H ATOM 29479 H2 WAT 4950 56.345 143.710 138.485 1.00 0.00 H TER 29481 WAT 4950 ATOM 29481 O WAT 4951 31.323 18.809 154.281 1.00 0.00 O ATOM 29482 H1 WAT 4951 30.863 19.296 153.596 1.00 0.00 H ATOM 29483 H2 WAT 4951 30.679 18.176 154.598 1.00 0.00 H TER 29485 WAT 4951 ATOM 29485 O WAT 4952 75.286 58.861 132.190 1.00 0.00 O ATOM 29486 H1 WAT 4952 75.013 58.563 131.322 1.00 0.00 H ATOM 29487 H2 WAT 4952 75.497 59.787 132.070 1.00 0.00 H TER 29489 WAT 4952 ATOM 29489 O WAT 4953 44.930 94.672 115.749 1.00 0.00 O ATOM 29490 H1 WAT 4953 45.108 94.790 114.816 1.00 0.00 H ATOM 29491 H2 WAT 4953 45.667 94.152 116.069 1.00 0.00 H TER 29493 WAT 4953 ATOM 29493 O WAT 4954 44.966 68.518 82.203 1.00 0.00 O ATOM 29494 H1 WAT 4954 44.973 68.134 81.326 1.00 0.00 H ATOM 29495 H2 WAT 4954 44.040 68.546 82.445 1.00 0.00 H TER 29497 WAT 4954 ATOM 29497 O WAT 4955 136.350 50.876 74.707 1.00 0.00 O ATOM 29498 H1 WAT 4955 137.092 50.271 74.699 1.00 0.00 H ATOM 29499 H2 WAT 4955 136.460 51.379 75.514 1.00 0.00 H TER 29501 WAT 4955 ATOM 29501 O WAT 4956 32.015 3.061 3.247 1.00 0.00 O ATOM 29502 H1 WAT 4956 31.364 3.411 3.856 1.00 0.00 H ATOM 29503 H2 WAT 4956 32.180 3.778 2.635 1.00 0.00 H TER 29505 WAT 4956 ATOM 29505 O WAT 4957 129.733 100.159 133.598 1.00 0.00 O ATOM 29506 H1 WAT 4957 130.347 100.828 133.902 1.00 0.00 H ATOM 29507 H2 WAT 4957 129.982 100.001 132.687 1.00 0.00 H TER 29509 WAT 4957 ATOM 29509 O WAT 4958 2.868 123.870 99.549 1.00 0.00 O ATOM 29510 H1 WAT 4958 3.652 124.416 99.510 1.00 0.00 H ATOM 29511 H2 WAT 4958 2.296 124.221 98.866 1.00 0.00 H TER 29513 WAT 4958 ATOM 29513 O WAT 4959 84.844 39.148 136.873 1.00 0.00 O ATOM 29514 H1 WAT 4959 84.816 39.205 137.828 1.00 0.00 H ATOM 29515 H2 WAT 4959 85.639 38.648 136.686 1.00 0.00 H TER 29517 WAT 4959 ATOM 29517 O WAT 4960 128.189 66.272 75.977 1.00 0.00 O ATOM 29518 H1 WAT 4960 127.662 66.969 75.586 1.00 0.00 H ATOM 29519 H2 WAT 4960 128.887 66.115 75.341 1.00 0.00 H TER 29521 WAT 4960 ATOM 29521 O WAT 4961 34.224 75.463 123.225 1.00 0.00 O ATOM 29522 H1 WAT 4961 33.367 75.215 123.572 1.00 0.00 H ATOM 29523 H2 WAT 4961 34.422 74.791 122.572 1.00 0.00 H TER 29525 WAT 4961 ATOM 29525 O WAT 4962 48.444 127.640 130.903 1.00 0.00 O ATOM 29526 H1 WAT 4962 47.500 127.483 130.898 1.00 0.00 H ATOM 29527 H2 WAT 4962 48.822 126.820 131.224 1.00 0.00 H TER 29529 WAT 4962 ATOM 29529 O WAT 4963 71.961 51.029 86.555 1.00 0.00 O ATOM 29530 H1 WAT 4963 71.563 51.087 85.687 1.00 0.00 H ATOM 29531 H2 WAT 4963 71.816 50.122 86.825 1.00 0.00 H TER 29533 WAT 4963 ATOM 29533 O WAT 4964 49.588 32.341 10.539 1.00 0.00 O ATOM 29534 H1 WAT 4964 50.380 32.732 10.170 1.00 0.00 H ATOM 29535 H2 WAT 4964 49.750 32.318 11.482 1.00 0.00 H TER 29537 WAT 4964 ATOM 29537 O WAT 4965 42.037 9.384 4.611 1.00 0.00 O ATOM 29538 H1 WAT 4965 42.294 9.367 5.533 1.00 0.00 H ATOM 29539 H2 WAT 4965 41.503 8.598 4.496 1.00 0.00 H TER 29541 WAT 4965 ATOM 29541 O WAT 4966 121.712 48.084 63.567 1.00 0.00 O ATOM 29542 H1 WAT 4966 121.381 48.360 62.713 1.00 0.00 H ATOM 29543 H2 WAT 4966 121.735 47.129 63.519 1.00 0.00 H TER 29545 WAT 4966 ATOM 29545 O WAT 4967 64.310 7.588 6.885 1.00 0.00 O ATOM 29546 H1 WAT 4967 63.482 7.125 6.753 1.00 0.00 H ATOM 29547 H2 WAT 4967 64.470 8.035 6.054 1.00 0.00 H TER 29549 WAT 4967 ATOM 29549 O WAT 4968 16.351 59.454 79.365 1.00 0.00 O ATOM 29550 H1 WAT 4968 17.103 59.175 79.888 1.00 0.00 H ATOM 29551 H2 WAT 4968 16.727 60.003 78.678 1.00 0.00 H TER 29553 WAT 4968 ATOM 29553 O WAT 4969 29.447 18.694 76.072 1.00 0.00 O ATOM 29554 H1 WAT 4969 30.189 18.349 76.568 1.00 0.00 H ATOM 29555 H2 WAT 4969 29.610 19.636 76.021 1.00 0.00 H TER 29557 WAT 4969 ATOM 29557 O WAT 4970 87.885 109.995 25.543 1.00 0.00 O ATOM 29558 H1 WAT 4970 88.228 109.365 26.177 1.00 0.00 H ATOM 29559 H2 WAT 4970 86.967 110.107 25.790 1.00 0.00 H TER 29561 WAT 4970 ATOM 29561 O WAT 4971 108.404 10.749 1.922 1.00 0.00 O ATOM 29562 H1 WAT 4971 108.712 11.572 2.301 1.00 0.00 H ATOM 29563 H2 WAT 4971 108.962 10.079 2.319 1.00 0.00 H TER 29565 WAT 4971 ATOM 29565 O WAT 4972 71.216 31.710 136.146 1.00 0.00 O ATOM 29566 H1 WAT 4972 72.036 32.141 136.385 1.00 0.00 H ATOM 29567 H2 WAT 4972 70.611 31.937 136.853 1.00 0.00 H TER 29569 WAT 4972 ATOM 29569 O WAT 4973 21.708 84.673 79.698 1.00 0.00 O ATOM 29570 H1 WAT 4973 21.926 85.543 79.364 1.00 0.00 H ATOM 29571 H2 WAT 4973 21.555 84.807 80.633 1.00 0.00 H TER 29573 WAT 4973 ATOM 29573 O WAT 4974 18.615 123.713 156.752 1.00 0.00 O ATOM 29574 H1 WAT 4974 19.449 123.954 157.154 1.00 0.00 H ATOM 29575 H2 WAT 4974 18.827 122.971 156.185 1.00 0.00 H TER 29577 WAT 4974 ATOM 29577 O WAT 4975 137.069 52.534 11.069 1.00 0.00 O ATOM 29578 H1 WAT 4975 136.772 52.874 11.913 1.00 0.00 H ATOM 29579 H2 WAT 4975 137.956 52.217 11.237 1.00 0.00 H TER 29581 WAT 4975 ATOM 29581 O WAT 4976 13.765 127.956 104.392 1.00 0.00 O ATOM 29582 H1 WAT 4976 13.693 127.072 104.752 1.00 0.00 H ATOM 29583 H2 WAT 4976 14.179 128.465 105.089 1.00 0.00 H TER 29585 WAT 4976 ATOM 29585 O WAT 4977 129.546 73.272 148.021 1.00 0.00 O ATOM 29586 H1 WAT 4977 130.139 72.845 147.403 1.00 0.00 H ATOM 29587 H2 WAT 4977 129.809 74.192 148.008 1.00 0.00 H TER 29589 WAT 4977 ATOM 29589 O WAT 4978 74.933 130.209 144.240 1.00 0.00 O ATOM 29590 H1 WAT 4978 75.237 131.117 144.229 1.00 0.00 H ATOM 29591 H2 WAT 4978 73.985 130.272 144.125 1.00 0.00 H TER 29593 WAT 4978 ATOM 29593 O WAT 4979 28.535 93.924 67.697 1.00 0.00 O ATOM 29594 H1 WAT 4979 29.438 93.608 67.663 1.00 0.00 H ATOM 29595 H2 WAT 4979 28.454 94.500 66.936 1.00 0.00 H TER 29597 WAT 4979 ATOM 29597 O WAT 4980 14.107 14.208 100.063 1.00 0.00 O ATOM 29598 H1 WAT 4980 14.280 13.505 100.689 1.00 0.00 H ATOM 29599 H2 WAT 4980 13.776 14.929 100.598 1.00 0.00 H TER 29601 WAT 4980 ATOM 29601 O WAT 4981 119.952 74.847 144.512 1.00 0.00 O ATOM 29602 H1 WAT 4981 120.441 75.374 145.144 1.00 0.00 H ATOM 29603 H2 WAT 4981 119.075 74.773 144.889 1.00 0.00 H TER 29605 WAT 4981 ATOM 29605 O WAT 4982 99.662 117.731 57.342 1.00 0.00 O ATOM 29606 H1 WAT 4982 99.315 117.160 58.027 1.00 0.00 H ATOM 29607 H2 WAT 4982 100.268 117.175 56.851 1.00 0.00 H TER 29609 WAT 4982 ATOM 29609 O WAT 4983 79.090 139.794 108.757 1.00 0.00 O ATOM 29610 H1 WAT 4983 79.614 139.102 109.161 1.00 0.00 H ATOM 29611 H2 WAT 4983 78.301 139.348 108.449 1.00 0.00 H TER 29613 WAT 4983 ATOM 29613 O WAT 4984 132.939 3.450 119.370 1.00 0.00 O ATOM 29614 H1 WAT 4984 132.846 2.514 119.547 1.00 0.00 H ATOM 29615 H2 WAT 4984 132.136 3.688 118.907 1.00 0.00 H TER 29617 WAT 4984 ATOM 29617 O WAT 4985 34.273 113.554 0.345 1.00 0.00 O ATOM 29618 H1 WAT 4985 34.313 112.912 1.054 1.00 0.00 H ATOM 29619 H2 WAT 4985 33.557 114.139 0.591 1.00 0.00 H TER 29621 WAT 4985 ATOM 29621 O WAT 4986 60.348 21.375 4.519 1.00 0.00 O ATOM 29622 H1 WAT 4986 60.416 20.473 4.206 1.00 0.00 H ATOM 29623 H2 WAT 4986 60.868 21.884 3.897 1.00 0.00 H TER 29625 WAT 4986 ATOM 29625 O WAT 4987 126.760 3.427 124.139 1.00 0.00 O ATOM 29626 H1 WAT 4987 126.501 3.423 123.217 1.00 0.00 H ATOM 29627 H2 WAT 4987 126.183 2.785 124.553 1.00 0.00 H TER 29629 WAT 4987 ATOM 29629 O WAT 4988 58.966 86.911 149.114 1.00 0.00 O ATOM 29630 H1 WAT 4988 59.179 87.256 148.247 1.00 0.00 H ATOM 29631 H2 WAT 4988 58.232 86.316 148.962 1.00 0.00 H TER 29633 WAT 4988 ATOM 29633 O WAT 4989 90.175 79.179 63.649 1.00 0.00 O ATOM 29634 H1 WAT 4989 89.537 78.565 63.285 1.00 0.00 H ATOM 29635 H2 WAT 4989 90.153 79.929 63.054 1.00 0.00 H TER 29637 WAT 4989 ATOM 29637 O WAT 4990 103.577 61.379 110.923 1.00 0.00 O ATOM 29638 H1 WAT 4990 103.106 61.935 111.544 1.00 0.00 H ATOM 29639 H2 WAT 4990 103.185 60.512 111.033 1.00 0.00 H TER 29641 WAT 4990 ATOM 29641 O WAT 4991 78.374 9.982 112.238 1.00 0.00 O ATOM 29642 H1 WAT 4991 78.843 10.773 111.972 1.00 0.00 H ATOM 29643 H2 WAT 4991 77.449 10.222 112.184 1.00 0.00 H TER 29645 WAT 4991 ATOM 29645 O WAT 4992 70.422 96.810 85.487 1.00 0.00 O ATOM 29646 H1 WAT 4992 69.638 97.262 85.175 1.00 0.00 H ATOM 29647 H2 WAT 4992 70.251 96.647 86.415 1.00 0.00 H TER 29649 WAT 4992 ATOM 29649 O WAT 4993 104.232 76.648 76.229 1.00 0.00 O ATOM 29650 H1 WAT 4993 104.956 76.334 76.771 1.00 0.00 H ATOM 29651 H2 WAT 4993 104.141 77.571 76.464 1.00 0.00 H TER 29653 WAT 4993 ATOM 29653 O WAT 4994 6.600 1.196 68.657 1.00 0.00 O ATOM 29654 H1 WAT 4994 7.162 1.872 69.035 1.00 0.00 H ATOM 29655 H2 WAT 4994 6.562 1.409 67.725 1.00 0.00 H TER 29657 WAT 4994 ATOM 29657 O WAT 4995 1.743 46.363 118.925 1.00 0.00 O ATOM 29658 H1 WAT 4995 1.281 47.010 118.392 1.00 0.00 H ATOM 29659 H2 WAT 4995 1.122 46.136 119.618 1.00 0.00 H TER 29661 WAT 4995 ATOM 29661 O WAT 4996 37.755 67.437 2.708 1.00 0.00 O ATOM 29662 H1 WAT 4996 37.955 68.108 3.360 1.00 0.00 H ATOM 29663 H2 WAT 4996 36.834 67.584 2.489 1.00 0.00 H TER 29665 WAT 4996 ATOM 29665 O WAT 4997 29.237 104.371 130.167 1.00 0.00 O ATOM 29666 H1 WAT 4997 29.948 104.917 129.832 1.00 0.00 H ATOM 29667 H2 WAT 4997 29.320 104.427 131.119 1.00 0.00 H TER 29669 WAT 4997 ATOM 29669 O WAT 4998 39.246 100.824 64.027 1.00 0.00 O ATOM 29670 H1 WAT 4998 39.157 100.989 63.088 1.00 0.00 H ATOM 29671 H2 WAT 4998 38.412 101.109 64.400 1.00 0.00 H TER 29673 WAT 4998 ATOM 29673 O WAT 4999 63.921 66.692 129.695 1.00 0.00 O ATOM 29674 H1 WAT 4999 63.760 65.983 130.317 1.00 0.00 H ATOM 29675 H2 WAT 4999 64.065 66.249 128.858 1.00 0.00 H TER 29677 WAT 4999 ATOM 29677 O WAT 5000 28.904 123.327 22.787 1.00 0.00 O ATOM 29678 H1 WAT 5000 28.485 122.635 22.276 1.00 0.00 H ATOM 29679 H2 WAT 5000 29.693 122.918 23.143 1.00 0.00 H TER 29681 WAT 5000 ATOM 29681 O WAT 5001 22.162 91.315 106.187 1.00 0.00 O ATOM 29682 H1 WAT 5001 22.261 90.400 105.926 1.00 0.00 H ATOM 29683 H2 WAT 5001 21.754 91.275 107.052 1.00 0.00 H TER 29685 WAT 5001 ATOM 29685 O WAT 5002 102.783 111.371 11.260 1.00 0.00 O ATOM 29686 H1 WAT 5002 102.551 110.858 10.485 1.00 0.00 H ATOM 29687 H2 WAT 5002 103.730 111.259 11.347 1.00 0.00 H TER 29689 WAT 5002 ATOM 29689 O WAT 5003 62.598 67.550 133.347 1.00 0.00 O ATOM 29690 H1 WAT 5003 62.487 67.680 134.289 1.00 0.00 H ATOM 29691 H2 WAT 5003 62.087 66.765 133.151 1.00 0.00 H TER 29693 WAT 5003 ATOM 29693 O WAT 5004 5.513 103.147 90.306 1.00 0.00 O ATOM 29694 H1 WAT 5004 5.209 103.487 91.148 1.00 0.00 H ATOM 29695 H2 WAT 5004 5.023 102.334 90.184 1.00 0.00 H TER 29697 WAT 5004 ATOM 29697 O WAT 5005 62.031 74.701 139.731 1.00 0.00 O ATOM 29698 H1 WAT 5005 62.489 75.510 139.503 1.00 0.00 H ATOM 29699 H2 WAT 5005 61.634 74.882 140.583 1.00 0.00 H TER 29701 WAT 5005 ATOM 29701 O WAT 5006 6.772 3.718 6.590 1.00 0.00 O ATOM 29702 H1 WAT 5006 6.995 3.989 5.699 1.00 0.00 H ATOM 29703 H2 WAT 5006 7.252 4.325 7.152 1.00 0.00 H TER 29705 WAT 5006 ATOM 29705 O WAT 5007 68.789 81.051 139.857 1.00 0.00 O ATOM 29706 H1 WAT 5007 69.313 81.780 140.190 1.00 0.00 H ATOM 29707 H2 WAT 5007 69.429 80.368 139.656 1.00 0.00 H TER 29709 WAT 5007 ATOM 29709 O WAT 5008 64.300 54.018 155.236 1.00 0.00 O ATOM 29710 H1 WAT 5008 64.985 53.703 155.826 1.00 0.00 H ATOM 29711 H2 WAT 5008 63.513 53.548 155.510 1.00 0.00 H TER 29713 WAT 5008 ATOM 29713 O WAT 5009 83.302 26.970 56.144 1.00 0.00 O ATOM 29714 H1 WAT 5009 83.011 27.863 56.328 1.00 0.00 H ATOM 29715 H2 WAT 5009 83.685 27.018 55.268 1.00 0.00 H TER 29717 WAT 5009 ATOM 29717 O WAT 5010 127.095 130.520 110.968 1.00 0.00 O ATOM 29718 H1 WAT 5010 126.850 130.690 111.877 1.00 0.00 H ATOM 29719 H2 WAT 5010 126.611 129.728 110.734 1.00 0.00 H TER 29721 WAT 5010 ATOM 29721 O WAT 5011 97.861 31.688 127.913 1.00 0.00 O ATOM 29722 H1 WAT 5011 97.425 31.693 127.061 1.00 0.00 H ATOM 29723 H2 WAT 5011 98.745 32.008 127.732 1.00 0.00 H TER 29725 WAT 5011 ATOM 29725 O WAT 5012 111.898 118.757 57.180 1.00 0.00 O ATOM 29726 H1 WAT 5012 111.775 119.695 57.036 1.00 0.00 H ATOM 29727 H2 WAT 5012 111.998 118.670 58.128 1.00 0.00 H TER 29729 WAT 5012 ATOM 29729 O WAT 5013 80.740 138.062 110.151 1.00 0.00 O ATOM 29730 H1 WAT 5013 81.402 138.186 109.470 1.00 0.00 H ATOM 29731 H2 WAT 5013 80.958 138.713 110.818 1.00 0.00 H TER 29733 WAT 5013 ATOM 29733 O WAT 5014 99.178 1.205 158.093 1.00 0.00 O ATOM 29734 H1 WAT 5014 99.999 1.282 158.580 1.00 0.00 H ATOM 29735 H2 WAT 5014 99.439 0.874 157.234 1.00 0.00 H TER 29737 WAT 5014 ATOM 29737 O WAT 5015 28.595 22.874 29.902 1.00 0.00 O ATOM 29738 H1 WAT 5015 28.446 22.298 29.152 1.00 0.00 H ATOM 29739 H2 WAT 5015 27.719 23.149 30.170 1.00 0.00 H TER 29741 WAT 5015 ATOM 29741 O WAT 5016 49.757 133.664 128.607 1.00 0.00 O ATOM 29742 H1 WAT 5016 49.423 132.826 128.287 1.00 0.00 H ATOM 29743 H2 WAT 5016 49.715 134.244 127.847 1.00 0.00 H TER 29745 WAT 5016 ATOM 29745 O WAT 5017 9.008 138.468 120.627 1.00 0.00 O ATOM 29746 H1 WAT 5017 9.687 137.901 120.261 1.00 0.00 H ATOM 29747 H2 WAT 5017 9.366 138.759 121.466 1.00 0.00 H TER 29749 WAT 5017 ATOM 29749 O WAT 5018 83.959 51.909 149.522 1.00 0.00 O ATOM 29750 H1 WAT 5018 83.803 51.985 150.463 1.00 0.00 H ATOM 29751 H2 WAT 5018 83.943 50.968 149.352 1.00 0.00 H TER 29753 WAT 5018 ATOM 29753 O WAT 5019 75.033 97.883 23.592 1.00 0.00 O ATOM 29754 H1 WAT 5019 74.153 97.823 23.965 1.00 0.00 H ATOM 29755 H2 WAT 5019 75.529 97.197 24.038 1.00 0.00 H TER 29757 WAT 5019 ATOM 29757 O WAT 5020 109.155 75.027 90.126 1.00 0.00 O ATOM 29758 H1 WAT 5020 109.400 75.936 90.298 1.00 0.00 H ATOM 29759 H2 WAT 5020 108.763 75.046 89.252 1.00 0.00 H TER 29761 WAT 5020 ATOM 29761 O WAT 5021 137.915 63.237 18.279 1.00 0.00 O ATOM 29762 H1 WAT 5021 138.230 64.140 18.324 1.00 0.00 H ATOM 29763 H2 WAT 5021 137.620 63.042 19.168 1.00 0.00 H TER 29765 WAT 5021 ATOM 29765 O WAT 5022 114.570 19.131 12.294 1.00 0.00 O ATOM 29766 H1 WAT 5022 114.642 18.427 12.939 1.00 0.00 H ATOM 29767 H2 WAT 5022 113.628 19.246 12.169 1.00 0.00 H TER 29769 WAT 5022 ATOM 29769 O WAT 5023 38.636 85.617 128.657 1.00 0.00 O ATOM 29770 H1 WAT 5023 39.312 84.951 128.781 1.00 0.00 H ATOM 29771 H2 WAT 5023 38.483 85.629 127.713 1.00 0.00 H TER 29773 WAT 5023 ATOM 29773 O WAT 5024 135.246 85.983 116.496 1.00 0.00 O ATOM 29774 H1 WAT 5024 135.186 85.176 115.984 1.00 0.00 H ATOM 29775 H2 WAT 5024 135.896 85.790 117.171 1.00 0.00 H TER 29777 WAT 5024 ATOM 29777 O WAT 5025 70.080 77.558 87.822 1.00 0.00 O ATOM 29778 H1 WAT 5025 70.418 78.401 87.520 1.00 0.00 H ATOM 29779 H2 WAT 5025 69.129 77.665 87.814 1.00 0.00 H TER 29781 WAT 5025 ATOM 29781 O WAT 5026 112.413 69.590 107.375 1.00 0.00 O ATOM 29782 H1 WAT 5026 113.232 69.411 106.913 1.00 0.00 H ATOM 29783 H2 WAT 5026 112.391 70.542 107.465 1.00 0.00 H TER 29785 WAT 5026 ATOM 29785 O WAT 5027 46.861 67.270 75.689 1.00 0.00 O ATOM 29786 H1 WAT 5027 46.357 68.083 75.662 1.00 0.00 H ATOM 29787 H2 WAT 5027 46.693 66.856 74.843 1.00 0.00 H TER 29789 WAT 5027 ATOM 29789 O WAT 5028 112.129 52.036 76.793 1.00 0.00 O ATOM 29790 H1 WAT 5028 112.257 51.335 76.154 1.00 0.00 H ATOM 29791 H2 WAT 5028 111.186 52.200 76.782 1.00 0.00 H TER 29793 WAT 5028 ATOM 29793 O WAT 5029 59.165 89.176 8.532 1.00 0.00 O ATOM 29794 H1 WAT 5029 58.466 88.845 7.969 1.00 0.00 H ATOM 29795 H2 WAT 5029 58.763 89.244 9.398 1.00 0.00 H TER 29797 WAT 5029 ATOM 29797 O WAT 5030 5.082 101.337 70.577 1.00 0.00 O ATOM 29798 H1 WAT 5030 5.240 102.132 71.087 1.00 0.00 H ATOM 29799 H2 WAT 5030 5.258 100.622 71.188 1.00 0.00 H TER 29801 WAT 5030 ATOM 29801 O WAT 5031 63.727 13.829 156.695 1.00 0.00 O ATOM 29802 H1 WAT 5031 63.907 13.176 157.372 1.00 0.00 H ATOM 29803 H2 WAT 5031 63.875 13.366 155.871 1.00 0.00 H TER 29805 WAT 5031 ATOM 29805 O WAT 5032 143.523 45.687 66.604 1.00 0.00 O ATOM 29806 H1 WAT 5032 142.956 44.994 66.264 1.00 0.00 H ATOM 29807 H2 WAT 5032 143.732 45.410 67.496 1.00 0.00 H TER 29809 WAT 5032 ATOM 29809 O WAT 5033 93.433 33.866 99.066 1.00 0.00 O ATOM 29810 H1 WAT 5033 94.179 34.265 98.617 1.00 0.00 H ATOM 29811 H2 WAT 5033 92.831 34.594 99.222 1.00 0.00 H TER 29813 WAT 5033 ATOM 29813 O WAT 5034 40.830 121.061 151.429 1.00 0.00 O ATOM 29814 H1 WAT 5034 41.564 121.478 151.881 1.00 0.00 H ATOM 29815 H2 WAT 5034 41.212 120.712 150.624 1.00 0.00 H TER 29817 WAT 5034 ATOM 29817 O WAT 5035 59.109 3.133 135.318 1.00 0.00 O ATOM 29818 H1 WAT 5035 59.553 2.472 135.849 1.00 0.00 H ATOM 29819 H2 WAT 5035 59.777 3.435 134.703 1.00 0.00 H TER 29821 WAT 5035 ATOM 29821 O WAT 5036 82.368 66.249 138.955 1.00 0.00 O ATOM 29822 H1 WAT 5036 82.363 66.522 139.872 1.00 0.00 H ATOM 29823 H2 WAT 5036 83.245 66.472 138.643 1.00 0.00 H TER 29825 WAT 5036 ATOM 29825 O WAT 5037 117.862 17.980 91.112 1.00 0.00 O ATOM 29826 H1 WAT 5037 117.596 18.622 90.454 1.00 0.00 H ATOM 29827 H2 WAT 5037 117.916 17.154 90.631 1.00 0.00 H TER 29829 WAT 5037 ATOM 29829 O WAT 5038 95.504 95.014 9.650 1.00 0.00 O ATOM 29830 H1 WAT 5038 96.215 94.784 10.248 1.00 0.00 H ATOM 29831 H2 WAT 5038 94.721 95.021 10.200 1.00 0.00 H TER 29833 WAT 5038 ATOM 29833 O WAT 5039 36.647 142.902 114.391 1.00 0.00 O ATOM 29834 H1 WAT 5039 36.762 142.064 114.839 1.00 0.00 H ATOM 29835 H2 WAT 5039 37.140 142.808 113.576 1.00 0.00 H TER 29837 WAT 5039 ATOM 29837 O WAT 5040 18.319 59.686 91.249 1.00 0.00 O ATOM 29838 H1 WAT 5040 17.539 59.191 91.501 1.00 0.00 H ATOM 29839 H2 WAT 5040 18.690 59.191 90.518 1.00 0.00 H TER 29841 WAT 5040 ATOM 29841 O WAT 5041 36.132 66.423 143.685 1.00 0.00 O ATOM 29842 H1 WAT 5041 35.328 66.940 143.641 1.00 0.00 H ATOM 29843 H2 WAT 5041 36.275 66.281 144.621 1.00 0.00 H TER 29845 WAT 5041 ATOM 29845 O WAT 5042 47.691 52.248 4.644 1.00 0.00 O ATOM 29846 H1 WAT 5042 47.134 52.770 4.066 1.00 0.00 H ATOM 29847 H2 WAT 5042 47.654 52.701 5.486 1.00 0.00 H TER 29849 WAT 5042 ATOM 29849 O WAT 5043 140.838 68.565 96.385 1.00 0.00 O ATOM 29850 H1 WAT 5043 140.577 68.768 95.487 1.00 0.00 H ATOM 29851 H2 WAT 5043 140.420 67.725 96.572 1.00 0.00 H TER 29853 WAT 5043 ATOM 29853 O WAT 5044 29.762 109.257 150.561 1.00 0.00 O ATOM 29854 H1 WAT 5044 30.524 109.363 149.992 1.00 0.00 H ATOM 29855 H2 WAT 5044 29.993 108.528 151.137 1.00 0.00 H TER 29857 WAT 5044 ATOM 29857 O WAT 5045 82.977 26.695 74.737 1.00 0.00 O ATOM 29858 H1 WAT 5045 82.762 26.066 75.426 1.00 0.00 H ATOM 29859 H2 WAT 5045 82.871 27.550 75.152 1.00 0.00 H TER 29861 WAT 5045 ATOM 29861 O WAT 5046 59.944 78.218 112.122 1.00 0.00 O ATOM 29862 H1 WAT 5046 60.866 78.473 112.114 1.00 0.00 H ATOM 29863 H2 WAT 5046 59.880 77.530 111.459 1.00 0.00 H TER 29865 WAT 5046 ATOM 29865 O WAT 5047 78.665 142.222 0.523 1.00 0.00 O ATOM 29866 H1 WAT 5047 77.719 142.239 0.665 1.00 0.00 H ATOM 29867 H2 WAT 5047 78.881 143.109 0.237 1.00 0.00 H TER 29869 WAT 5047 ATOM 29869 O WAT 5048 116.088 63.807 100.942 1.00 0.00 O ATOM 29870 H1 WAT 5048 115.273 63.459 101.304 1.00 0.00 H ATOM 29871 H2 WAT 5048 115.822 64.252 100.137 1.00 0.00 H TER 29873 WAT 5048 ATOM 29873 O WAT 5049 57.271 26.214 3.933 1.00 0.00 O ATOM 29874 H1 WAT 5049 58.060 25.846 4.332 1.00 0.00 H ATOM 29875 H2 WAT 5049 56.549 25.751 4.358 1.00 0.00 H TER 29877 WAT 5049 ATOM 29877 O WAT 5050 16.861 73.505 139.976 1.00 0.00 O ATOM 29878 H1 WAT 5050 15.916 73.443 139.832 1.00 0.00 H ATOM 29879 H2 WAT 5050 17.080 74.406 139.738 1.00 0.00 H TER 29881 WAT 5050 ATOM 29881 O WAT 5051 120.552 98.466 127.054 1.00 0.00 O ATOM 29882 H1 WAT 5051 119.794 98.151 126.562 1.00 0.00 H ATOM 29883 H2 WAT 5051 120.210 99.183 127.588 1.00 0.00 H TER 29885 WAT 5051 ATOM 29885 O WAT 5052 8.352 101.849 70.828 1.00 0.00 O ATOM 29886 H1 WAT 5052 8.967 102.464 71.228 1.00 0.00 H ATOM 29887 H2 WAT 5052 7.491 102.238 70.978 1.00 0.00 H TER 29889 WAT 5052 ATOM 29889 O WAT 5053 55.609 139.815 127.784 1.00 0.00 O ATOM 29890 H1 WAT 5053 55.387 140.199 128.632 1.00 0.00 H ATOM 29891 H2 WAT 5053 55.775 140.568 127.217 1.00 0.00 H TER 29893 WAT 5053 ATOM 29893 O WAT 5054 26.042 40.356 69.487 1.00 0.00 O ATOM 29894 H1 WAT 5054 26.730 40.619 70.098 1.00 0.00 H ATOM 29895 H2 WAT 5054 25.267 40.836 69.777 1.00 0.00 H TER 29897 WAT 5054 ATOM 29897 O WAT 5055 138.436 102.901 70.848 1.00 0.00 O ATOM 29898 H1 WAT 5055 138.250 102.299 70.127 1.00 0.00 H ATOM 29899 H2 WAT 5055 137.622 102.932 71.350 1.00 0.00 H TER 29901 WAT 5055 ATOM 29901 O WAT 5056 57.613 97.661 141.641 1.00 0.00 O ATOM 29902 H1 WAT 5056 58.251 97.900 140.969 1.00 0.00 H ATOM 29903 H2 WAT 5056 56.765 97.738 141.205 1.00 0.00 H TER 29905 WAT 5056 ATOM 29905 O WAT 5057 33.221 91.034 120.640 1.00 0.00 O ATOM 29906 H1 WAT 5057 32.757 91.175 119.815 1.00 0.00 H ATOM 29907 H2 WAT 5057 32.974 91.782 121.184 1.00 0.00 H TER 29909 WAT 5057 ATOM 29909 O WAT 5058 18.592 130.082 90.097 1.00 0.00 O ATOM 29910 H1 WAT 5058 18.516 130.391 91.000 1.00 0.00 H ATOM 29911 H2 WAT 5058 18.635 129.129 90.173 1.00 0.00 H TER 29913 WAT 5058 ATOM 29913 O WAT 5059 12.058 126.641 122.283 1.00 0.00 O ATOM 29914 H1 WAT 5059 12.155 127.509 121.890 1.00 0.00 H ATOM 29915 H2 WAT 5059 12.437 126.043 121.638 1.00 0.00 H TER 29917 WAT 5059 ATOM 29917 O WAT 5060 103.133 49.757 61.163 1.00 0.00 O ATOM 29918 H1 WAT 5060 103.467 49.114 60.538 1.00 0.00 H ATOM 29919 H2 WAT 5060 103.425 50.601 60.818 1.00 0.00 H TER 29921 WAT 5060 ATOM 29921 O WAT 5061 102.715 129.253 135.035 1.00 0.00 O ATOM 29922 H1 WAT 5061 102.788 129.251 134.080 1.00 0.00 H ATOM 29923 H2 WAT 5061 103.573 129.545 135.340 1.00 0.00 H TER 29925 WAT 5061 ATOM 29925 O WAT 5062 122.407 10.345 78.198 1.00 0.00 O ATOM 29926 H1 WAT 5062 122.880 9.924 78.916 1.00 0.00 H ATOM 29927 H2 WAT 5062 122.416 11.276 78.418 1.00 0.00 H TER 29929 WAT 5062 ATOM 29929 O WAT 5063 68.483 143.727 64.499 1.00 0.00 O ATOM 29930 H1 WAT 5063 69.144 144.212 64.993 1.00 0.00 H ATOM 29931 H2 WAT 5063 68.951 142.966 64.157 1.00 0.00 H TER 29933 WAT 5063 ATOM 29933 O WAT 5064 34.154 80.013 106.311 1.00 0.00 O ATOM 29934 H1 WAT 5064 34.709 80.757 106.078 1.00 0.00 H ATOM 29935 H2 WAT 5064 34.506 79.283 105.803 1.00 0.00 H TER 29937 WAT 5064 ATOM 29937 O WAT 5065 20.238 56.739 98.526 1.00 0.00 O ATOM 29938 H1 WAT 5065 19.312 56.725 98.284 1.00 0.00 H ATOM 29939 H2 WAT 5065 20.425 55.843 98.808 1.00 0.00 H TER 29941 WAT 5065 ATOM 29941 O WAT 5066 119.398 25.051 117.292 1.00 0.00 O ATOM 29942 H1 WAT 5066 118.929 25.873 117.148 1.00 0.00 H ATOM 29943 H2 WAT 5066 120.236 25.317 117.671 1.00 0.00 H TER 29945 WAT 5066 ATOM 29945 O WAT 5067 144.749 90.902 136.092 1.00 0.00 O ATOM 29946 H1 WAT 5067 145.645 90.581 136.188 1.00 0.00 H ATOM 29947 H2 WAT 5067 144.329 90.695 136.926 1.00 0.00 H TER 29949 WAT 5067 ATOM 29949 O WAT 5068 114.450 86.775 156.061 1.00 0.00 O ATOM 29950 H1 WAT 5068 113.996 87.556 156.379 1.00 0.00 H ATOM 29951 H2 WAT 5068 115.135 87.115 155.485 1.00 0.00 H TER 29953 WAT 5068 ATOM 29953 O WAT 5069 120.212 54.498 59.377 1.00 0.00 O ATOM 29954 H1 WAT 5069 120.962 53.995 59.696 1.00 0.00 H ATOM 29955 H2 WAT 5069 119.996 54.097 58.534 1.00 0.00 H TER 29957 WAT 5069 ATOM 29957 O WAT 5070 63.526 91.825 134.610 1.00 0.00 O ATOM 29958 H1 WAT 5070 64.337 91.322 134.529 1.00 0.00 H ATOM 29959 H2 WAT 5070 63.248 91.687 135.515 1.00 0.00 H TER 29961 WAT 5070 ATOM 29961 O WAT 5071 23.780 14.087 93.561 1.00 0.00 O ATOM 29962 H1 WAT 5071 23.775 13.136 93.668 1.00 0.00 H ATOM 29963 H2 WAT 5071 24.610 14.275 93.123 1.00 0.00 H TER 29965 WAT 5071 ATOM 29965 O WAT 5072 53.243 16.804 110.482 1.00 0.00 O ATOM 29966 H1 WAT 5072 53.548 15.899 110.544 1.00 0.00 H ATOM 29967 H2 WAT 5072 52.317 16.761 110.723 1.00 0.00 H TER 29969 WAT 5072 ATOM 29969 O WAT 5073 93.264 84.276 11.739 1.00 0.00 O ATOM 29970 H1 WAT 5073 92.723 84.177 10.955 1.00 0.00 H ATOM 29971 H2 WAT 5073 93.456 85.213 11.780 1.00 0.00 H TER 29973 WAT 5073 ATOM 29973 O WAT 5074 118.581 57.541 63.550 1.00 0.00 O ATOM 29974 H1 WAT 5074 119.295 57.089 63.100 1.00 0.00 H ATOM 29975 H2 WAT 5074 118.517 57.103 64.398 1.00 0.00 H TER 29977 WAT 5074 ATOM 29977 O WAT 5075 83.639 74.299 54.683 1.00 0.00 O ATOM 29978 H1 WAT 5075 84.472 74.588 55.055 1.00 0.00 H ATOM 29979 H2 WAT 5075 83.122 75.101 54.604 1.00 0.00 H TER 29981 WAT 5075 ATOM 29981 O WAT 5076 119.203 115.126 146.302 1.00 0.00 O ATOM 29982 H1 WAT 5076 120.079 115.385 146.588 1.00 0.00 H ATOM 29983 H2 WAT 5076 119.283 114.194 146.101 1.00 0.00 H TER 29985 WAT 5076 ATOM 29985 O WAT 5077 128.201 123.259 132.198 1.00 0.00 O ATOM 29986 H1 WAT 5077 128.714 123.977 132.568 1.00 0.00 H ATOM 29987 H2 WAT 5077 127.792 123.634 131.418 1.00 0.00 H TER 29989 WAT 5077 ATOM 29989 O WAT 5078 18.416 87.743 58.425 1.00 0.00 O ATOM 29990 H1 WAT 5078 17.510 87.436 58.377 1.00 0.00 H ATOM 29991 H2 WAT 5078 18.608 88.060 57.542 1.00 0.00 H TER 29993 WAT 5078 ATOM 29993 O WAT 5079 31.439 31.792 97.030 1.00 0.00 O ATOM 29994 H1 WAT 5079 31.633 32.214 97.867 1.00 0.00 H ATOM 29995 H2 WAT 5079 30.515 31.987 96.873 1.00 0.00 H TER 29997 WAT 5079 ATOM 29997 O WAT 5080 94.439 116.196 100.336 1.00 0.00 O ATOM 29998 H1 WAT 5080 94.774 116.744 101.046 1.00 0.00 H ATOM 29999 H2 WAT 5080 93.842 116.768 99.853 1.00 0.00 H TER 30001 WAT 5080 ATOM 30001 O WAT 5081 139.693 26.235 65.600 1.00 0.00 O ATOM 30002 H1 WAT 5081 140.338 25.537 65.708 1.00 0.00 H ATOM 30003 H2 WAT 5081 140.032 26.959 66.126 1.00 0.00 H TER 30005 WAT 5081 ATOM 30005 O WAT 5082 121.566 130.164 148.259 1.00 0.00 O ATOM 30006 H1 WAT 5082 121.288 130.922 147.745 1.00 0.00 H ATOM 30007 H2 WAT 5082 121.047 129.437 147.916 1.00 0.00 H TER 30009 WAT 5082 ATOM 30009 O WAT 5083 113.149 98.876 95.073 1.00 0.00 O ATOM 30010 H1 WAT 5083 113.562 98.039 95.287 1.00 0.00 H ATOM 30011 H2 WAT 5083 113.774 99.308 94.490 1.00 0.00 H TER 30013 WAT 5083 ATOM 30013 O WAT 5084 63.849 63.905 70.022 1.00 0.00 O ATOM 30014 H1 WAT 5084 62.893 63.887 70.075 1.00 0.00 H ATOM 30015 H2 WAT 5084 64.039 64.548 69.339 1.00 0.00 H TER 30017 WAT 5084 ATOM 30017 O WAT 5085 55.236 139.728 80.112 1.00 0.00 O ATOM 30018 H1 WAT 5085 54.736 138.938 80.318 1.00 0.00 H ATOM 30019 H2 WAT 5085 55.518 139.603 79.205 1.00 0.00 H TER 30021 WAT 5085 ATOM 30021 O WAT 5086 48.724 141.147 126.254 1.00 0.00 O ATOM 30022 H1 WAT 5086 49.498 141.607 125.930 1.00 0.00 H ATOM 30023 H2 WAT 5086 48.424 141.674 126.994 1.00 0.00 H TER 30025 WAT 5086 ATOM 30025 O WAT 5087 139.869 61.173 128.088 1.00 0.00 O ATOM 30026 H1 WAT 5087 140.639 60.849 127.621 1.00 0.00 H ATOM 30027 H2 WAT 5087 139.144 60.646 127.751 1.00 0.00 H TER 30029 WAT 5087 ATOM 30029 O WAT 5088 45.088 111.949 89.307 1.00 0.00 O ATOM 30030 H1 WAT 5088 45.650 111.729 88.564 1.00 0.00 H ATOM 30031 H2 WAT 5088 44.266 111.492 89.129 1.00 0.00 H TER 30033 WAT 5088 ATOM 30033 O WAT 5089 29.605 2.883 129.679 1.00 0.00 O ATOM 30034 H1 WAT 5089 29.831 3.740 129.318 1.00 0.00 H ATOM 30035 H2 WAT 5089 28.651 2.838 129.611 1.00 0.00 H TER 30037 WAT 5089 ATOM 30037 O WAT 5090 57.252 117.529 86.675 1.00 0.00 O ATOM 30038 H1 WAT 5090 57.194 116.622 86.373 1.00 0.00 H ATOM 30039 H2 WAT 5090 56.544 117.980 86.215 1.00 0.00 H TER 30041 WAT 5090 ATOM 30041 O WAT 5091 138.338 132.112 148.591 1.00 0.00 O ATOM 30042 H1 WAT 5091 137.873 132.210 147.760 1.00 0.00 H ATOM 30043 H2 WAT 5091 137.922 132.747 149.175 1.00 0.00 H TER 30045 WAT 5091 ATOM 30045 O WAT 5092 102.002 33.903 13.175 1.00 0.00 O ATOM 30046 H1 WAT 5092 101.967 33.331 12.409 1.00 0.00 H ATOM 30047 H2 WAT 5092 101.149 33.795 13.594 1.00 0.00 H TER 30049 WAT 5092 ATOM 30049 O WAT 5093 26.009 36.313 81.294 1.00 0.00 O ATOM 30050 H1 WAT 5093 25.128 36.024 81.056 1.00 0.00 H ATOM 30051 H2 WAT 5093 26.592 35.715 80.827 1.00 0.00 H TER 30053 WAT 5093 ATOM 30053 O WAT 5094 107.801 118.657 75.744 1.00 0.00 O ATOM 30054 H1 WAT 5094 107.686 117.793 76.138 1.00 0.00 H ATOM 30055 H2 WAT 5094 107.490 119.268 76.413 1.00 0.00 H TER 30057 WAT 5094 ATOM 30057 O WAT 5095 20.312 15.457 117.184 1.00 0.00 O ATOM 30058 H1 WAT 5095 19.792 16.245 117.343 1.00 0.00 H ATOM 30059 H2 WAT 5095 19.929 15.073 116.395 1.00 0.00 H TER 30061 WAT 5095 ATOM 30061 O WAT 5096 43.067 44.037 10.505 1.00 0.00 O ATOM 30062 H1 WAT 5096 42.153 44.250 10.694 1.00 0.00 H ATOM 30063 H2 WAT 5096 43.366 44.748 9.937 1.00 0.00 H TER 30065 WAT 5096 ATOM 30065 O WAT 5097 102.166 87.370 106.843 1.00 0.00 O ATOM 30066 H1 WAT 5097 101.617 87.960 107.358 1.00 0.00 H ATOM 30067 H2 WAT 5097 102.603 87.940 106.210 1.00 0.00 H TER 30069 WAT 5097 ATOM 30069 O WAT 5098 50.806 73.221 7.449 1.00 0.00 O ATOM 30070 H1 WAT 5098 50.805 72.275 7.302 1.00 0.00 H ATOM 30071 H2 WAT 5098 49.885 73.474 7.387 1.00 0.00 H TER 30073 WAT 5098 ATOM 30073 O WAT 5099 87.455 70.129 3.525 1.00 0.00 O ATOM 30074 H1 WAT 5099 86.832 70.466 2.881 1.00 0.00 H ATOM 30075 H2 WAT 5099 87.532 70.829 4.173 1.00 0.00 H TER 30077 WAT 5099 ATOM 30077 O WAT 5100 29.220 124.500 114.564 1.00 0.00 O ATOM 30078 H1 WAT 5100 29.955 124.158 114.055 1.00 0.00 H ATOM 30079 H2 WAT 5100 28.862 125.204 114.024 1.00 0.00 H TER 30081 WAT 5100 ATOM 30081 O WAT 5101 58.347 74.458 19.244 1.00 0.00 O ATOM 30082 H1 WAT 5101 58.387 75.411 19.333 1.00 0.00 H ATOM 30083 H2 WAT 5101 57.834 74.314 18.449 1.00 0.00 H TER 30085 WAT 5101 ATOM 30085 O WAT 5102 85.196 77.742 60.223 1.00 0.00 O ATOM 30086 H1 WAT 5102 84.333 77.519 59.875 1.00 0.00 H ATOM 30087 H2 WAT 5102 85.687 76.920 60.188 1.00 0.00 H TER 30089 WAT 5102 ATOM 30089 O WAT 5103 72.356 89.630 145.132 1.00 0.00 O ATOM 30090 H1 WAT 5103 72.206 89.241 144.271 1.00 0.00 H ATOM 30091 H2 WAT 5103 72.272 88.899 145.743 1.00 0.00 H TER 30093 WAT 5103 ATOM 30093 O WAT 5104 115.993 67.689 150.754 1.00 0.00 O ATOM 30094 H1 WAT 5104 116.122 68.607 150.990 1.00 0.00 H ATOM 30095 H2 WAT 5104 116.696 67.500 150.132 1.00 0.00 H TER 30097 WAT 5104 ATOM 30097 O WAT 5105 52.186 51.539 86.257 1.00 0.00 O ATOM 30098 H1 WAT 5105 52.810 50.919 85.879 1.00 0.00 H ATOM 30099 H2 WAT 5105 52.703 52.328 86.421 1.00 0.00 H TER 30101 WAT 5105 ATOM 30101 O WAT 5106 76.187 88.703 11.855 1.00 0.00 O ATOM 30102 H1 WAT 5106 75.343 89.150 11.916 1.00 0.00 H ATOM 30103 H2 WAT 5106 76.815 89.400 11.667 1.00 0.00 H TER 30105 WAT 5106 ATOM 30105 O WAT 5107 135.055 6.200 147.584 1.00 0.00 O ATOM 30106 H1 WAT 5107 134.805 6.591 146.746 1.00 0.00 H ATOM 30107 H2 WAT 5107 135.978 5.973 147.476 1.00 0.00 H TER 30109 WAT 5107 ATOM 30109 O WAT 5108 40.727 130.351 118.106 1.00 0.00 O ATOM 30110 H1 WAT 5108 41.597 129.952 118.144 1.00 0.00 H ATOM 30111 H2 WAT 5108 40.163 129.741 118.582 1.00 0.00 H TER 30113 WAT 5108 ATOM 30113 O WAT 5109 140.205 98.847 30.911 1.00 0.00 O ATOM 30114 H1 WAT 5109 140.966 98.268 30.914 1.00 0.00 H ATOM 30115 H2 WAT 5109 140.569 99.720 30.759 1.00 0.00 H TER 30117 WAT 5109 ATOM 30117 O WAT 5110 117.550 37.090 104.354 1.00 0.00 O ATOM 30118 H1 WAT 5110 117.481 36.853 103.430 1.00 0.00 H ATOM 30119 H2 WAT 5110 118.488 37.048 104.543 1.00 0.00 H TER 30121 WAT 5110 ATOM 30121 O WAT 5111 33.606 71.767 123.021 1.00 0.00 O ATOM 30122 H1 WAT 5111 32.841 72.339 123.077 1.00 0.00 H ATOM 30123 H2 WAT 5111 33.304 71.012 122.515 1.00 0.00 H TER 30125 WAT 5111 ATOM 30125 O WAT 5112 141.602 145.127 2.471 1.00 0.00 O ATOM 30126 H1 WAT 5112 142.485 145.094 2.840 1.00 0.00 H ATOM 30127 H2 WAT 5112 141.555 144.367 1.891 1.00 0.00 H TER 30129 WAT 5112 ATOM 30129 O WAT 5113 102.623 31.374 97.161 1.00 0.00 O ATOM 30130 H1 WAT 5113 102.830 31.442 96.229 1.00 0.00 H ATOM 30131 H2 WAT 5113 103.473 31.414 97.599 1.00 0.00 H TER 30133 WAT 5113 ATOM 30133 O WAT 5114 4.024 144.537 156.249 1.00 0.00 O ATOM 30134 H1 WAT 5114 4.084 145.345 156.758 1.00 0.00 H ATOM 30135 H2 WAT 5114 3.173 144.589 155.815 1.00 0.00 H TER 30137 WAT 5114 ATOM 30137 O WAT 5115 99.007 136.942 98.359 1.00 0.00 O ATOM 30138 H1 WAT 5115 98.906 135.990 98.381 1.00 0.00 H ATOM 30139 H2 WAT 5115 99.615 137.101 97.636 1.00 0.00 H TER 30141 WAT 5115 ATOM 30141 O WAT 5116 33.037 126.302 141.587 1.00 0.00 O ATOM 30142 H1 WAT 5116 33.067 125.347 141.534 1.00 0.00 H ATOM 30143 H2 WAT 5116 33.600 126.519 142.330 1.00 0.00 H TER 30145 WAT 5116 ATOM 30145 O WAT 5117 119.978 14.187 117.231 1.00 0.00 O ATOM 30146 H1 WAT 5117 119.730 13.354 117.633 1.00 0.00 H ATOM 30147 H2 WAT 5117 119.145 14.594 116.991 1.00 0.00 H TER 30149 WAT 5117 ATOM 30149 O WAT 5118 19.914 32.634 2.321 1.00 0.00 O ATOM 30150 H1 WAT 5118 20.592 33.309 2.288 1.00 0.00 H ATOM 30151 H2 WAT 5118 19.858 32.308 1.423 1.00 0.00 H TER 30153 WAT 5118 ATOM 30153 O WAT 5119 88.799 116.805 70.427 1.00 0.00 O ATOM 30154 H1 WAT 5119 88.721 115.961 69.982 1.00 0.00 H ATOM 30155 H2 WAT 5119 88.518 116.630 71.325 1.00 0.00 H TER 30157 WAT 5119 ATOM 30157 O WAT 5120 26.903 59.540 139.692 1.00 0.00 O ATOM 30158 H1 WAT 5120 26.300 59.027 139.154 1.00 0.00 H ATOM 30159 H2 WAT 5120 27.001 60.367 139.221 1.00 0.00 H TER 30161 WAT 5120 ATOM 30161 O WAT 5121 130.905 102.388 120.652 1.00 0.00 O ATOM 30162 H1 WAT 5121 131.012 101.516 120.272 1.00 0.00 H ATOM 30163 H2 WAT 5121 131.437 102.958 120.097 1.00 0.00 H TER 30165 WAT 5121 ATOM 30165 O WAT 5122 114.282 123.924 65.885 1.00 0.00 O ATOM 30166 H1 WAT 5122 113.779 123.132 65.697 1.00 0.00 H ATOM 30167 H2 WAT 5122 113.919 124.584 65.294 1.00 0.00 H TER 30169 WAT 5122 ATOM 30169 O WAT 5123 139.996 91.506 104.087 1.00 0.00 O ATOM 30170 H1 WAT 5123 140.267 90.628 103.818 1.00 0.00 H ATOM 30171 H2 WAT 5123 139.073 91.410 104.320 1.00 0.00 H TER 30173 WAT 5123 ATOM 30173 O WAT 5124 96.385 142.152 132.038 1.00 0.00 O ATOM 30174 H1 WAT 5124 96.296 142.475 132.934 1.00 0.00 H ATOM 30175 H2 WAT 5124 97.296 142.331 131.807 1.00 0.00 H TER 30177 WAT 5124 ATOM 30177 O WAT 5125 123.345 129.360 91.339 1.00 0.00 O ATOM 30178 H1 WAT 5125 123.528 129.677 92.223 1.00 0.00 H ATOM 30179 H2 WAT 5125 122.465 128.988 91.395 1.00 0.00 H TER 30181 WAT 5125 ATOM 30181 O WAT 5126 105.567 5.317 114.309 1.00 0.00 O ATOM 30182 H1 WAT 5126 105.402 6.257 114.373 1.00 0.00 H ATOM 30183 H2 WAT 5126 106.101 5.221 113.520 1.00 0.00 H TER 30185 WAT 5126 ATOM 30185 O WAT 5127 112.087 37.005 118.777 1.00 0.00 O ATOM 30186 H1 WAT 5127 112.319 36.868 117.858 1.00 0.00 H ATOM 30187 H2 WAT 5127 111.858 37.933 118.830 1.00 0.00 H TER 30189 WAT 5127 ATOM 30189 O WAT 5128 77.854 20.338 124.411 1.00 0.00 O ATOM 30190 H1 WAT 5128 78.631 19.779 124.446 1.00 0.00 H ATOM 30191 H2 WAT 5128 77.566 20.405 125.321 1.00 0.00 H TER 30193 WAT 5128 ATOM 30193 O WAT 5129 36.554 50.900 20.425 1.00 0.00 O ATOM 30194 H1 WAT 5129 35.685 50.843 20.027 1.00 0.00 H ATOM 30195 H2 WAT 5129 36.508 51.672 20.989 1.00 0.00 H TER 30197 WAT 5129 ATOM 30197 O WAT 5130 54.145 95.594 125.119 1.00 0.00 O ATOM 30198 H1 WAT 5130 53.468 94.973 125.390 1.00 0.00 H ATOM 30199 H2 WAT 5130 54.552 95.184 124.356 1.00 0.00 H TER 30201 WAT 5130 ATOM 30201 O WAT 5131 126.949 59.168 110.869 1.00 0.00 O ATOM 30202 H1 WAT 5131 127.651 59.224 110.221 1.00 0.00 H ATOM 30203 H2 WAT 5131 126.245 58.701 110.420 1.00 0.00 H TER 30205 WAT 5131 ATOM 30205 O WAT 5132 130.257 60.126 69.734 1.00 0.00 O ATOM 30206 H1 WAT 5132 131.205 60.184 69.852 1.00 0.00 H ATOM 30207 H2 WAT 5132 130.029 59.254 70.056 1.00 0.00 H TER 30209 WAT 5132 ATOM 30209 O WAT 5133 141.767 140.937 147.179 1.00 0.00 O ATOM 30210 H1 WAT 5133 142.329 140.190 146.973 1.00 0.00 H ATOM 30211 H2 WAT 5133 142.354 141.572 147.589 1.00 0.00 H TER 30213 WAT 5133 ATOM 30213 O WAT 5134 20.635 89.256 20.202 1.00 0.00 O ATOM 30214 H1 WAT 5134 21.255 89.148 19.481 1.00 0.00 H ATOM 30215 H2 WAT 5134 20.264 88.383 20.333 1.00 0.00 H TER 30217 WAT 5134 ATOM 30217 O WAT 5135 22.987 141.926 103.849 1.00 0.00 O ATOM 30218 H1 WAT 5135 23.696 141.299 103.993 1.00 0.00 H ATOM 30219 H2 WAT 5135 23.383 142.780 104.024 1.00 0.00 H TER 30221 WAT 5135 ATOM 30221 O WAT 5136 21.127 58.422 69.446 1.00 0.00 O ATOM 30222 H1 WAT 5136 21.900 58.944 69.232 1.00 0.00 H ATOM 30223 H2 WAT 5136 21.453 57.524 69.506 1.00 0.00 H TER 30225 WAT 5136 ATOM 30225 O WAT 5137 124.170 38.017 136.853 1.00 0.00 O ATOM 30226 H1 WAT 5137 125.118 37.994 136.981 1.00 0.00 H ATOM 30227 H2 WAT 5137 123.884 38.804 137.317 1.00 0.00 H TER 30229 WAT 5137 ATOM 30229 O WAT 5138 108.484 45.065 111.740 1.00 0.00 O ATOM 30230 H1 WAT 5138 108.945 44.229 111.665 1.00 0.00 H ATOM 30231 H2 WAT 5138 108.603 45.482 110.887 1.00 0.00 H TER 30233 WAT 5138 ATOM 30233 O WAT 5139 11.528 115.936 53.183 1.00 0.00 O ATOM 30234 H1 WAT 5139 12.283 116.516 53.087 1.00 0.00 H ATOM 30235 H2 WAT 5139 11.881 115.058 53.041 1.00 0.00 H TER 30237 WAT 5139 ATOM 30237 O WAT 5140 62.491 16.820 138.749 1.00 0.00 O ATOM 30238 H1 WAT 5140 62.906 16.129 138.232 1.00 0.00 H ATOM 30239 H2 WAT 5140 62.247 16.392 139.569 1.00 0.00 H TER 30241 WAT 5140 ATOM 30241 O WAT 5141 36.189 102.570 111.545 1.00 0.00 O ATOM 30242 H1 WAT 5141 36.035 101.627 111.492 1.00 0.00 H ATOM 30243 H2 WAT 5141 35.491 102.957 111.017 1.00 0.00 H TER 30245 WAT 5141 ATOM 30245 O WAT 5142 24.717 111.674 99.899 1.00 0.00 O ATOM 30246 H1 WAT 5142 25.646 111.865 99.770 1.00 0.00 H ATOM 30247 H2 WAT 5142 24.708 110.847 100.381 1.00 0.00 H TER 30249 WAT 5142 ATOM 30249 O WAT 5143 99.767 82.456 65.625 1.00 0.00 O ATOM 30250 H1 WAT 5143 99.618 81.854 66.354 1.00 0.00 H ATOM 30251 H2 WAT 5143 100.084 81.898 64.915 1.00 0.00 H TER 30253 WAT 5143 ATOM 30253 O WAT 5144 104.969 16.727 57.739 1.00 0.00 O ATOM 30254 H1 WAT 5144 104.696 17.610 57.992 1.00 0.00 H ATOM 30255 H2 WAT 5144 105.125 16.278 58.570 1.00 0.00 H TER 30257 WAT 5144 ATOM 30257 O WAT 5145 71.532 71.110 156.651 1.00 0.00 O ATOM 30258 H1 WAT 5145 71.743 71.721 155.945 1.00 0.00 H ATOM 30259 H2 WAT 5145 72.256 71.202 157.270 1.00 0.00 H TER 30261 WAT 5145 ATOM 30261 O WAT 5146 114.104 28.487 25.624 1.00 0.00 O ATOM 30262 H1 WAT 5146 114.744 27.828 25.357 1.00 0.00 H ATOM 30263 H2 WAT 5146 113.579 28.054 26.297 1.00 0.00 H TER 30265 WAT 5146 ATOM 30265 O WAT 5147 93.914 33.371 6.614 1.00 0.00 O ATOM 30266 H1 WAT 5147 94.231 32.653 6.067 1.00 0.00 H ATOM 30267 H2 WAT 5147 94.708 33.814 6.913 1.00 0.00 H TER 30269 WAT 5147 ATOM 30269 O WAT 5148 53.435 24.030 97.246 1.00 0.00 O ATOM 30270 H1 WAT 5148 54.139 23.543 97.674 1.00 0.00 H ATOM 30271 H2 WAT 5148 52.960 23.370 96.740 1.00 0.00 H TER 30273 WAT 5148 ATOM 30273 O WAT 5149 71.731 124.026 74.995 1.00 0.00 O ATOM 30274 H1 WAT 5149 71.537 124.377 75.864 1.00 0.00 H ATOM 30275 H2 WAT 5149 72.483 123.449 75.132 1.00 0.00 H TER 30277 WAT 5149 ATOM 30277 O WAT 5150 103.198 78.981 97.693 1.00 0.00 O ATOM 30278 H1 WAT 5150 102.342 79.410 97.708 1.00 0.00 H ATOM 30279 H2 WAT 5150 103.815 79.685 97.492 1.00 0.00 H TER 30281 WAT 5150 ATOM 30281 O WAT 5151 97.459 6.951 90.987 1.00 0.00 O ATOM 30282 H1 WAT 5151 96.864 7.399 91.587 1.00 0.00 H ATOM 30283 H2 WAT 5151 98.270 7.458 91.031 1.00 0.00 H TER 30285 WAT 5151 ATOM 30285 O WAT 5152 18.466 141.844 -0.064 1.00 0.00 O ATOM 30286 H1 WAT 5152 17.537 141.989 0.112 1.00 0.00 H ATOM 30287 H2 WAT 5152 18.617 140.931 0.183 1.00 0.00 H TER 30289 WAT 5152 ATOM 30289 O WAT 5153 28.731 36.461 15.338 1.00 0.00 O ATOM 30290 H1 WAT 5153 27.965 35.887 15.339 1.00 0.00 H ATOM 30291 H2 WAT 5153 29.359 36.023 15.911 1.00 0.00 H TER 30293 WAT 5153 ATOM 30293 O WAT 5154 58.272 97.668 123.776 1.00 0.00 O ATOM 30294 H1 WAT 5154 58.176 96.716 123.813 1.00 0.00 H ATOM 30295 H2 WAT 5154 57.440 98.006 124.107 1.00 0.00 H TER 30297 WAT 5154 ATOM 30297 O WAT 5155 33.725 144.132 121.759 1.00 0.00 O ATOM 30298 H1 WAT 5155 32.912 143.682 121.987 1.00 0.00 H ATOM 30299 H2 WAT 5155 33.501 144.657 120.991 1.00 0.00 H TER 30301 WAT 5155 ATOM 30301 O WAT 5156 138.253 45.912 22.536 1.00 0.00 O ATOM 30302 H1 WAT 5156 138.632 46.083 23.398 1.00 0.00 H ATOM 30303 H2 WAT 5156 137.344 45.674 22.717 1.00 0.00 H TER 30305 WAT 5156 ATOM 30305 O WAT 5157 89.654 118.726 143.332 1.00 0.00 O ATOM 30306 H1 WAT 5157 90.518 118.316 143.310 1.00 0.00 H ATOM 30307 H2 WAT 5157 89.283 118.549 142.467 1.00 0.00 H TER 30309 WAT 5157 ATOM 30309 O WAT 5158 130.613 53.215 15.571 1.00 0.00 O ATOM 30310 H1 WAT 5158 130.342 54.061 15.215 1.00 0.00 H ATOM 30311 H2 WAT 5158 130.150 53.147 16.406 1.00 0.00 H TER 30313 WAT 5158 ATOM 30313 O WAT 5159 117.808 66.912 137.951 1.00 0.00 O ATOM 30314 H1 WAT 5159 117.815 65.955 137.972 1.00 0.00 H ATOM 30315 H2 WAT 5159 116.942 67.138 137.612 1.00 0.00 H TER 30317 WAT 5159 ATOM 30317 O WAT 5160 76.867 107.348 144.053 1.00 0.00 O ATOM 30318 H1 WAT 5160 76.242 107.209 144.764 1.00 0.00 H ATOM 30319 H2 WAT 5160 77.572 107.858 144.450 1.00 0.00 H TER 30321 WAT 5160 ATOM 30321 O WAT 5161 138.142 16.051 127.715 1.00 0.00 O ATOM 30322 H1 WAT 5161 137.471 15.771 128.338 1.00 0.00 H ATOM 30323 H2 WAT 5161 138.971 15.834 128.142 1.00 0.00 H TER 30325 WAT 5161 ATOM 30325 O WAT 5162 98.490 24.266 116.908 1.00 0.00 O ATOM 30326 H1 WAT 5162 98.053 25.118 116.898 1.00 0.00 H ATOM 30327 H2 WAT 5162 98.497 23.990 115.992 1.00 0.00 H TER 30329 WAT 5162 ATOM 30329 O WAT 5163 96.656 82.775 19.656 1.00 0.00 O ATOM 30330 H1 WAT 5163 95.959 82.359 19.148 1.00 0.00 H ATOM 30331 H2 WAT 5163 96.770 82.206 20.417 1.00 0.00 H TER 30333 WAT 5163 ATOM 30333 O WAT 5164 24.894 44.804 13.112 1.00 0.00 O ATOM 30334 H1 WAT 5164 25.407 45.591 13.296 1.00 0.00 H ATOM 30335 H2 WAT 5164 25.445 44.292 12.520 1.00 0.00 H TER 30337 WAT 5164 ATOM 30337 O WAT 5165 50.858 15.027 89.632 1.00 0.00 O ATOM 30338 H1 WAT 5165 51.740 14.666 89.545 1.00 0.00 H ATOM 30339 H2 WAT 5165 50.835 15.755 89.011 1.00 0.00 H TER 30341 WAT 5165 ATOM 30341 O WAT 5166 101.494 106.181 10.351 1.00 0.00 O ATOM 30342 H1 WAT 5166 101.935 105.350 10.525 1.00 0.00 H ATOM 30343 H2 WAT 5166 101.807 106.767 11.040 1.00 0.00 H TER 30345 WAT 5166 ATOM 30345 O WAT 5167 136.318 25.947 89.621 1.00 0.00 O ATOM 30346 H1 WAT 5167 135.646 25.720 90.265 1.00 0.00 H ATOM 30347 H2 WAT 5167 137.089 26.163 90.146 1.00 0.00 H TER 30349 WAT 5167 ATOM 30349 O WAT 5168 16.218 54.664 4.930 1.00 0.00 O ATOM 30350 H1 WAT 5168 16.497 54.913 5.811 1.00 0.00 H ATOM 30351 H2 WAT 5168 15.572 53.972 5.069 1.00 0.00 H TER 30353 WAT 5168 ATOM 30353 O WAT 5169 101.932 65.565 125.081 1.00 0.00 O ATOM 30354 H1 WAT 5169 102.339 66.281 125.568 1.00 0.00 H ATOM 30355 H2 WAT 5169 101.643 65.966 124.261 1.00 0.00 H TER 30357 WAT 5169 ATOM 30357 O WAT 5170 26.620 18.762 20.481 1.00 0.00 O ATOM 30358 H1 WAT 5170 27.200 19.131 21.147 1.00 0.00 H ATOM 30359 H2 WAT 5170 25.766 19.153 20.663 1.00 0.00 H TER 30361 WAT 5170 ATOM 30361 O WAT 5171 81.186 11.518 113.552 1.00 0.00 O ATOM 30362 H1 WAT 5171 81.695 12.311 113.721 1.00 0.00 H ATOM 30363 H2 WAT 5171 80.611 11.436 114.313 1.00 0.00 H TER 30365 WAT 5171 ATOM 30365 O WAT 5172 122.648 47.953 1.681 1.00 0.00 O ATOM 30366 H1 WAT 5172 122.780 47.027 1.886 1.00 0.00 H ATOM 30367 H2 WAT 5172 121.787 47.987 1.265 1.00 0.00 H TER 30369 WAT 5172 ATOM 30369 O WAT 5173 131.636 116.253 117.186 1.00 0.00 O ATOM 30370 H1 WAT 5173 131.228 116.029 118.022 1.00 0.00 H ATOM 30371 H2 WAT 5173 130.933 116.163 116.543 1.00 0.00 H TER 30373 WAT 5173 ATOM 30373 O WAT 5174 13.359 67.006 110.196 1.00 0.00 O ATOM 30374 H1 WAT 5174 13.758 67.558 109.523 1.00 0.00 H ATOM 30375 H2 WAT 5174 13.922 67.117 110.962 1.00 0.00 H TER 30377 WAT 5174 ATOM 30377 O WAT 5175 76.941 111.010 94.863 1.00 0.00 O ATOM 30378 H1 WAT 5175 76.036 110.765 95.055 1.00 0.00 H ATOM 30379 H2 WAT 5175 77.303 110.251 94.405 1.00 0.00 H TER 30381 WAT 5175 ATOM 30381 O WAT 5176 56.978 103.435 113.716 1.00 0.00 O ATOM 30382 H1 WAT 5176 56.886 102.525 113.997 1.00 0.00 H ATOM 30383 H2 WAT 5176 57.717 103.424 113.107 1.00 0.00 H TER 30385 WAT 5176 ATOM 30385 O WAT 5177 1.551 21.342 137.762 1.00 0.00 O ATOM 30386 H1 WAT 5177 1.888 21.789 138.538 1.00 0.00 H ATOM 30387 H2 WAT 5177 2.301 20.855 137.421 1.00 0.00 H TER 30389 WAT 5177 ATOM 30389 O WAT 5178 130.788 116.948 120.010 1.00 0.00 O ATOM 30390 H1 WAT 5178 130.797 117.892 119.849 1.00 0.00 H ATOM 30391 H2 WAT 5178 129.860 116.722 120.058 1.00 0.00 H TER 30393 WAT 5178 ATOM 30393 O WAT 5179 42.527 100.612 111.017 1.00 0.00 O ATOM 30394 H1 WAT 5179 42.672 101.076 110.192 1.00 0.00 H ATOM 30395 H2 WAT 5179 42.015 101.223 111.548 1.00 0.00 H TER 30397 WAT 5179 ATOM 30397 O WAT 5180 26.670 95.628 104.023 1.00 0.00 O ATOM 30398 H1 WAT 5180 26.516 95.062 103.266 1.00 0.00 H ATOM 30399 H2 WAT 5180 26.487 95.071 104.779 1.00 0.00 H TER 30401 WAT 5180 ATOM 30401 O WAT 5181 61.442 89.269 25.788 1.00 0.00 O ATOM 30402 H1 WAT 5181 62.115 89.031 25.150 1.00 0.00 H ATOM 30403 H2 WAT 5181 61.766 88.920 26.619 1.00 0.00 H TER 30405 WAT 5181 ATOM 30405 O WAT 5182 33.041 140.178 91.332 1.00 0.00 O ATOM 30406 H1 WAT 5182 33.779 139.598 91.520 1.00 0.00 H ATOM 30407 H2 WAT 5182 32.631 139.800 90.554 1.00 0.00 H TER 30409 WAT 5182 ATOM 30409 O WAT 5183 114.242 80.634 25.147 1.00 0.00 O ATOM 30410 H1 WAT 5183 115.127 80.811 24.828 1.00 0.00 H ATOM 30411 H2 WAT 5183 114.173 81.140 25.956 1.00 0.00 H TER 30413 WAT 5183 ATOM 30413 O WAT 5184 9.333 128.812 62.253 1.00 0.00 O ATOM 30414 H1 WAT 5184 9.099 127.885 62.301 1.00 0.00 H ATOM 30415 H2 WAT 5184 9.725 128.914 61.386 1.00 0.00 H TER 30417 WAT 5184 ATOM 30417 O WAT 5185 134.471 9.811 99.040 1.00 0.00 O ATOM 30418 H1 WAT 5185 135.379 9.754 99.339 1.00 0.00 H ATOM 30419 H2 WAT 5185 134.350 9.035 98.492 1.00 0.00 H TER 30421 WAT 5185 ATOM 30421 O WAT 5186 127.565 9.783 103.804 1.00 0.00 O ATOM 30422 H1 WAT 5186 128.164 9.389 103.171 1.00 0.00 H ATOM 30423 H2 WAT 5186 127.454 10.684 103.500 1.00 0.00 H TER 30425 WAT 5186 ATOM 30425 O WAT 5187 28.142 18.892 126.370 1.00 0.00 O ATOM 30426 H1 WAT 5187 28.412 19.039 125.464 1.00 0.00 H ATOM 30427 H2 WAT 5187 28.085 17.940 126.452 1.00 0.00 H TER 30429 WAT 5187 ATOM 30429 O WAT 5188 47.920 5.289 61.001 1.00 0.00 O ATOM 30430 H1 WAT 5188 47.491 4.572 61.468 1.00 0.00 H ATOM 30431 H2 WAT 5188 47.383 5.422 60.221 1.00 0.00 H TER 30433 WAT 5188 ATOM 30433 O WAT 5189 20.037 32.449 86.438 1.00 0.00 O ATOM 30434 H1 WAT 5189 20.597 32.559 87.206 1.00 0.00 H ATOM 30435 H2 WAT 5189 20.325 33.131 85.831 1.00 0.00 H TER 30437 WAT 5189 ATOM 30437 O WAT 5190 25.596 52.315 56.210 1.00 0.00 O ATOM 30438 H1 WAT 5190 25.416 51.387 56.056 1.00 0.00 H ATOM 30439 H2 WAT 5190 25.577 52.710 55.339 1.00 0.00 H TER 30441 WAT 5190 ATOM 30441 O WAT 5191 13.460 54.459 93.720 1.00 0.00 O ATOM 30442 H1 WAT 5191 13.184 54.118 94.571 1.00 0.00 H ATOM 30443 H2 WAT 5191 12.659 54.474 93.197 1.00 0.00 H TER 30445 WAT 5191 ATOM 30445 O WAT 5192 11.613 118.900 60.933 1.00 0.00 O ATOM 30446 H1 WAT 5192 12.551 118.733 61.022 1.00 0.00 H ATOM 30447 H2 WAT 5192 11.423 119.562 61.598 1.00 0.00 H TER 30449 WAT 5192 ATOM 30449 O WAT 5193 14.233 14.046 79.441 1.00 0.00 O ATOM 30450 H1 WAT 5193 14.659 14.076 80.298 1.00 0.00 H ATOM 30451 H2 WAT 5193 13.638 14.796 79.443 1.00 0.00 H TER 30453 WAT 5193 ATOM 30453 O WAT 5194 21.669 4.594 67.296 1.00 0.00 O ATOM 30454 H1 WAT 5194 22.262 5.155 66.796 1.00 0.00 H ATOM 30455 H2 WAT 5194 21.236 5.189 67.908 1.00 0.00 H TER 30457 WAT 5194 ATOM 30457 O WAT 5195 60.127 2.090 101.415 1.00 0.00 O ATOM 30458 H1 WAT 5195 60.814 2.378 102.017 1.00 0.00 H ATOM 30459 H2 WAT 5195 60.346 2.511 100.584 1.00 0.00 H TER 30461 WAT 5195 ATOM 30461 O WAT 5196 83.074 29.401 75.856 1.00 0.00 O ATOM 30462 H1 WAT 5196 82.691 29.886 76.587 1.00 0.00 H ATOM 30463 H2 WAT 5196 82.603 29.719 75.085 1.00 0.00 H TER 30465 WAT 5196 ATOM 30465 O WAT 5197 62.747 104.583 123.392 1.00 0.00 O ATOM 30466 H1 WAT 5197 62.547 103.677 123.159 1.00 0.00 H ATOM 30467 H2 WAT 5197 63.511 104.805 122.860 1.00 0.00 H TER 30469 WAT 5197 ATOM 30469 O WAT 5198 121.418 109.027 132.595 1.00 0.00 O ATOM 30470 H1 WAT 5198 121.124 108.831 131.705 1.00 0.00 H ATOM 30471 H2 WAT 5198 120.696 108.740 133.154 1.00 0.00 H TER 30473 WAT 5198 ATOM 30473 O WAT 5199 80.139 32.020 72.412 1.00 0.00 O ATOM 30474 H1 WAT 5199 79.202 31.952 72.232 1.00 0.00 H ATOM 30475 H2 WAT 5199 80.214 32.762 73.012 1.00 0.00 H TER 30477 WAT 5199 ATOM 30477 O WAT 5200 89.506 25.678 115.950 1.00 0.00 O ATOM 30478 H1 WAT 5200 89.897 25.458 115.104 1.00 0.00 H ATOM 30479 H2 WAT 5200 90.158 26.233 116.378 1.00 0.00 H TER 30481 WAT 5200 ATOM 30481 O WAT 5201 134.740 77.803 25.837 1.00 0.00 O ATOM 30482 H1 WAT 5201 135.086 78.309 26.572 1.00 0.00 H ATOM 30483 H2 WAT 5201 134.917 78.345 25.069 1.00 0.00 H TER 30485 WAT 5201 ATOM 30485 O WAT 5202 5.042 69.469 133.568 1.00 0.00 O ATOM 30486 H1 WAT 5202 4.307 69.480 132.955 1.00 0.00 H ATOM 30487 H2 WAT 5202 4.707 69.903 134.352 1.00 0.00 H TER 30489 WAT 5202 ATOM 30489 O WAT 5203 3.882 143.159 118.118 1.00 0.00 O ATOM 30490 H1 WAT 5203 2.957 143.193 118.364 1.00 0.00 H ATOM 30491 H2 WAT 5203 4.117 144.071 117.946 1.00 0.00 H TER 30493 WAT 5203 ATOM 30493 O WAT 5204 43.418 142.332 86.889 1.00 0.00 O ATOM 30494 H1 WAT 5204 43.346 142.505 85.951 1.00 0.00 H ATOM 30495 H2 WAT 5204 43.988 141.565 86.948 1.00 0.00 H TER 30497 WAT 5204 ATOM 30497 O WAT 5205 119.093 74.043 16.385 1.00 0.00 O ATOM 30498 H1 WAT 5205 119.548 73.563 17.077 1.00 0.00 H ATOM 30499 H2 WAT 5205 119.761 74.186 15.714 1.00 0.00 H TER 30501 WAT 5205 ATOM 30501 O WAT 5206 4.942 69.244 75.182 1.00 0.00 O ATOM 30502 H1 WAT 5206 4.192 69.838 75.159 1.00 0.00 H ATOM 30503 H2 WAT 5206 5.596 69.663 74.622 1.00 0.00 H TER 30505 WAT 5206 ATOM 30505 O WAT 5207 38.509 86.758 145.566 1.00 0.00 O ATOM 30506 H1 WAT 5207 38.985 86.003 145.910 1.00 0.00 H ATOM 30507 H2 WAT 5207 37.974 86.402 144.857 1.00 0.00 H TER 30509 WAT 5207 ATOM 30509 O WAT 5208 8.321 36.136 154.897 1.00 0.00 O ATOM 30510 H1 WAT 5208 8.885 35.505 155.345 1.00 0.00 H ATOM 30511 H2 WAT 5208 7.966 36.681 155.599 1.00 0.00 H TER 30513 WAT 5208 ATOM 30513 O WAT 5209 4.292 106.692 149.631 1.00 0.00 O ATOM 30514 H1 WAT 5209 4.613 107.336 148.999 1.00 0.00 H ATOM 30515 H2 WAT 5209 3.926 105.990 149.092 1.00 0.00 H TER 30517 WAT 5209 ATOM 30517 O WAT 5210 127.804 79.545 136.395 1.00 0.00 O ATOM 30518 H1 WAT 5210 127.074 79.403 136.998 1.00 0.00 H ATOM 30519 H2 WAT 5210 127.622 78.963 135.658 1.00 0.00 H TER 30521 WAT 5210 ATOM 30521 O WAT 5211 77.184 72.415 104.127 1.00 0.00 O ATOM 30522 H1 WAT 5211 77.581 71.981 104.882 1.00 0.00 H ATOM 30523 H2 WAT 5211 76.580 71.766 103.768 1.00 0.00 H TER 30525 WAT 5211 ATOM 30525 O WAT 5212 92.469 140.157 152.456 1.00 0.00 O ATOM 30526 H1 WAT 5212 93.303 140.334 152.891 1.00 0.00 H ATOM 30527 H2 WAT 5212 92.666 140.226 151.522 1.00 0.00 H TER 30529 WAT 5212 ATOM 30529 O WAT 5213 124.792 39.015 3.729 1.00 0.00 O ATOM 30530 H1 WAT 5213 124.303 38.752 2.949 1.00 0.00 H ATOM 30531 H2 WAT 5213 124.343 38.577 4.452 1.00 0.00 H TER 30533 WAT 5213 ATOM 30533 O WAT 5214 41.864 100.997 116.639 1.00 0.00 O ATOM 30534 H1 WAT 5214 42.314 100.279 116.195 1.00 0.00 H ATOM 30535 H2 WAT 5214 42.007 101.756 116.074 1.00 0.00 H TER 30537 WAT 5214 ATOM 30537 O WAT 5215 53.364 102.149 139.864 1.00 0.00 O ATOM 30538 H1 WAT 5215 53.436 103.102 139.821 1.00 0.00 H ATOM 30539 H2 WAT 5215 53.715 101.844 139.027 1.00 0.00 H TER 30541 WAT 5215 ATOM 30541 O WAT 5216 31.921 99.052 129.271 1.00 0.00 O ATOM 30542 H1 WAT 5216 31.243 99.617 129.644 1.00 0.00 H ATOM 30543 H2 WAT 5216 31.693 98.985 128.344 1.00 0.00 H TER 30545 WAT 5216 ATOM 30545 O WAT 5217 140.578 102.356 57.616 1.00 0.00 O ATOM 30546 H1 WAT 5217 140.501 102.820 58.450 1.00 0.00 H ATOM 30547 H2 WAT 5217 139.935 101.650 57.674 1.00 0.00 H TER 30549 WAT 5217 ATOM 30549 O WAT 5218 3.551 20.934 127.361 1.00 0.00 O ATOM 30550 H1 WAT 5218 3.899 20.130 127.746 1.00 0.00 H ATOM 30551 H2 WAT 5218 4.165 21.150 126.659 1.00 0.00 H TER 30553 WAT 5218 ATOM 30553 O WAT 5219 5.803 42.998 89.135 1.00 0.00 O ATOM 30554 H1 WAT 5219 6.091 42.118 89.380 1.00 0.00 H ATOM 30555 H2 WAT 5219 5.830 43.494 89.953 1.00 0.00 H TER 30557 WAT 5219 ATOM 30557 O WAT 5220 135.145 38.628 150.796 1.00 0.00 O ATOM 30558 H1 WAT 5220 135.435 39.344 151.361 1.00 0.00 H ATOM 30559 H2 WAT 5220 134.284 38.904 150.483 1.00 0.00 H TER 30561 WAT 5220 ATOM 30561 O WAT 5221 93.827 123.173 8.269 1.00 0.00 O ATOM 30562 H1 WAT 5221 93.996 122.995 9.194 1.00 0.00 H ATOM 30563 H2 WAT 5221 94.494 122.668 7.803 1.00 0.00 H TER 30565 WAT 5221 ATOM 30565 O WAT 5222 2.449 52.218 75.550 1.00 0.00 O ATOM 30566 H1 WAT 5222 3.130 52.867 75.726 1.00 0.00 H ATOM 30567 H2 WAT 5222 1.701 52.732 75.247 1.00 0.00 H TER 30569 WAT 5222 ATOM 30569 O WAT 5223 81.862 105.792 16.542 1.00 0.00 O ATOM 30570 H1 WAT 5223 82.775 106.032 16.385 1.00 0.00 H ATOM 30571 H2 WAT 5223 81.754 104.952 16.097 1.00 0.00 H TER 30573 WAT 5223 ATOM 30573 O WAT 5224 69.920 27.758 1.981 1.00 0.00 O ATOM 30574 H1 WAT 5224 70.096 26.822 1.881 1.00 0.00 H ATOM 30575 H2 WAT 5224 69.455 27.826 2.815 1.00 0.00 H TER 30577 WAT 5224 ATOM 30577 O WAT 5225 20.925 110.818 65.049 1.00 0.00 O ATOM 30578 H1 WAT 5225 20.097 110.761 65.526 1.00 0.00 H ATOM 30579 H2 WAT 5225 21.149 111.748 65.068 1.00 0.00 H TER 30581 WAT 5225 ATOM 30581 O WAT 5226 131.823 81.999 99.185 1.00 0.00 O ATOM 30582 H1 WAT 5226 130.872 81.982 99.071 1.00 0.00 H ATOM 30583 H2 WAT 5226 132.032 82.924 99.313 1.00 0.00 H TER 30585 WAT 5226 ATOM 30585 O WAT 5227 111.237 138.383 4.436 1.00 0.00 O ATOM 30586 H1 WAT 5227 111.216 138.989 3.696 1.00 0.00 H ATOM 30587 H2 WAT 5227 111.351 138.944 5.203 1.00 0.00 H TER 30589 WAT 5227 ATOM 30589 O WAT 5228 144.046 97.255 151.318 1.00 0.00 O ATOM 30590 H1 WAT 5228 144.976 97.273 151.546 1.00 0.00 H ATOM 30591 H2 WAT 5228 143.593 97.385 152.152 1.00 0.00 H TER 30593 WAT 5228 ATOM 30593 O WAT 5229 98.676 49.567 12.047 1.00 0.00 O ATOM 30594 H1 WAT 5229 98.223 48.757 11.813 1.00 0.00 H ATOM 30595 H2 WAT 5229 98.030 50.066 12.547 1.00 0.00 H TER 30597 WAT 5229 ATOM 30597 O WAT 5230 66.000 73.110 78.248 1.00 0.00 O ATOM 30598 H1 WAT 5230 66.816 73.058 78.747 1.00 0.00 H ATOM 30599 H2 WAT 5230 65.364 73.470 78.866 1.00 0.00 H TER 30601 WAT 5230 ATOM 30601 O WAT 5231 43.823 142.178 110.562 1.00 0.00 O ATOM 30602 H1 WAT 5231 44.722 142.384 110.309 1.00 0.00 H ATOM 30603 H2 WAT 5231 43.740 141.237 110.409 1.00 0.00 H TER 30605 WAT 5231 ATOM 30605 O WAT 5232 77.711 34.555 88.293 1.00 0.00 O ATOM 30606 H1 WAT 5232 78.282 35.210 88.693 1.00 0.00 H ATOM 30607 H2 WAT 5232 78.199 33.735 88.366 1.00 0.00 H TER 30609 WAT 5232 ATOM 30609 O WAT 5233 128.646 101.614 142.423 1.00 0.00 O ATOM 30610 H1 WAT 5233 129.515 101.351 142.727 1.00 0.00 H ATOM 30611 H2 WAT 5233 128.635 102.565 142.523 1.00 0.00 H TER 30613 WAT 5233 ATOM 30613 O WAT 5234 70.758 104.751 88.793 1.00 0.00 O ATOM 30614 H1 WAT 5234 70.364 104.536 87.948 1.00 0.00 H ATOM 30615 H2 WAT 5234 70.128 105.340 89.208 1.00 0.00 H TER 30617 WAT 5234 ATOM 30617 O WAT 5235 6.529 94.481 129.690 1.00 0.00 O ATOM 30618 H1 WAT 5235 5.698 94.367 130.150 1.00 0.00 H ATOM 30619 H2 WAT 5235 6.683 95.425 129.704 1.00 0.00 H TER 30621 WAT 5235 ATOM 30621 O WAT 5236 106.674 115.034 139.767 1.00 0.00 O ATOM 30622 H1 WAT 5236 107.313 115.399 140.380 1.00 0.00 H ATOM 30623 H2 WAT 5236 106.903 114.107 139.708 1.00 0.00 H TER 30625 WAT 5236 ATOM 30625 O WAT 5237 75.188 46.121 150.281 1.00 0.00 O ATOM 30626 H1 WAT 5237 75.178 46.900 150.836 1.00 0.00 H ATOM 30627 H2 WAT 5237 75.756 45.505 150.743 1.00 0.00 H TER 30629 WAT 5237 ATOM 30629 O WAT 5238 76.348 112.257 68.745 1.00 0.00 O ATOM 30630 H1 WAT 5238 76.130 111.957 67.863 1.00 0.00 H ATOM 30631 H2 WAT 5238 75.550 112.111 69.252 1.00 0.00 H TER 30633 WAT 5238 ATOM 30633 O WAT 5239 85.170 42.275 128.810 1.00 0.00 O ATOM 30634 H1 WAT 5239 84.976 42.882 129.524 1.00 0.00 H ATOM 30635 H2 WAT 5239 85.025 41.407 129.188 1.00 0.00 H TER 30637 WAT 5239 ATOM 30637 O WAT 5240 50.676 62.463 30.341 1.00 0.00 O ATOM 30638 H1 WAT 5240 50.797 63.413 30.363 1.00 0.00 H ATOM 30639 H2 WAT 5240 50.933 62.169 31.215 1.00 0.00 H TER 30641 WAT 5240 ATOM 30641 O WAT 5241 23.383 52.422 16.046 1.00 0.00 O ATOM 30642 H1 WAT 5241 23.794 51.768 15.479 1.00 0.00 H ATOM 30643 H2 WAT 5241 23.047 51.918 16.787 1.00 0.00 H TER 30645 WAT 5241 ATOM 30645 O WAT 5242 30.786 114.200 110.654 1.00 0.00 O ATOM 30646 H1 WAT 5242 31.332 114.986 110.637 1.00 0.00 H ATOM 30647 H2 WAT 5242 31.220 113.620 111.280 1.00 0.00 H TER 30649 WAT 5242 ATOM 30649 O WAT 5243 12.185 6.031 103.136 1.00 0.00 O ATOM 30650 H1 WAT 5243 12.011 6.461 103.973 1.00 0.00 H ATOM 30651 H2 WAT 5243 11.326 5.960 102.719 1.00 0.00 H TER 30653 WAT 5243 ATOM 30653 O WAT 5244 99.119 10.681 72.102 1.00 0.00 O ATOM 30654 H1 WAT 5244 98.242 10.757 72.479 1.00 0.00 H ATOM 30655 H2 WAT 5244 99.659 10.346 72.818 1.00 0.00 H TER 30657 WAT 5244 ATOM 30657 O WAT 5245 125.729 58.602 68.406 1.00 0.00 O ATOM 30658 H1 WAT 5245 125.010 59.200 68.613 1.00 0.00 H ATOM 30659 H2 WAT 5245 125.532 58.288 67.524 1.00 0.00 H TER 30661 WAT 5245 ATOM 30661 O WAT 5246 81.655 38.483 16.680 1.00 0.00 O ATOM 30662 H1 WAT 5246 80.745 38.217 16.547 1.00 0.00 H ATOM 30663 H2 WAT 5246 82.159 37.677 16.564 1.00 0.00 H TER 30665 WAT 5246 ATOM 30665 O WAT 5247 77.580 92.867 85.503 1.00 0.00 O ATOM 30666 H1 WAT 5247 78.117 92.373 86.123 1.00 0.00 H ATOM 30667 H2 WAT 5247 76.686 92.567 85.667 1.00 0.00 H TER 30669 WAT 5247 ATOM 30669 O WAT 5248 91.584 53.542 84.887 1.00 0.00 O ATOM 30670 H1 WAT 5248 91.317 52.634 84.744 1.00 0.00 H ATOM 30671 H2 WAT 5248 91.541 53.943 84.019 1.00 0.00 H TER 30673 WAT 5248 ATOM 30673 O WAT 5249 49.553 104.035 104.384 1.00 0.00 O ATOM 30674 H1 WAT 5249 49.822 104.667 105.050 1.00 0.00 H ATOM 30675 H2 WAT 5249 49.075 104.557 103.739 1.00 0.00 H TER 30677 WAT 5249 ATOM 30677 O WAT 5250 25.490 131.445 128.791 1.00 0.00 O ATOM 30678 H1 WAT 5250 26.341 131.291 128.380 1.00 0.00 H ATOM 30679 H2 WAT 5250 25.131 130.570 128.933 1.00 0.00 H TER 30681 WAT 5250 ATOM 30681 O WAT 5251 114.587 137.265 70.250 1.00 0.00 O ATOM 30682 H1 WAT 5251 114.384 137.962 70.875 1.00 0.00 H ATOM 30683 H2 WAT 5251 113.995 137.424 69.515 1.00 0.00 H TER 30685 WAT 5251 ATOM 30685 O WAT 5252 61.497 8.052 70.155 1.00 0.00 O ATOM 30686 H1 WAT 5252 62.043 7.591 70.793 1.00 0.00 H ATOM 30687 H2 WAT 5252 61.577 8.975 70.394 1.00 0.00 H TER 30689 WAT 5252 ATOM 30689 O WAT 5253 18.929 125.904 153.584 1.00 0.00 O ATOM 30690 H1 WAT 5253 19.226 125.151 153.073 1.00 0.00 H ATOM 30691 H2 WAT 5253 18.183 125.574 154.085 1.00 0.00 H TER 30693 WAT 5253 ATOM 30693 O WAT 5254 14.480 112.895 151.213 1.00 0.00 O ATOM 30694 H1 WAT 5254 14.891 113.348 150.477 1.00 0.00 H ATOM 30695 H2 WAT 5254 13.559 113.148 151.166 1.00 0.00 H TER 30697 WAT 5254 ATOM 30697 O WAT 5255 125.602 21.374 90.073 1.00 0.00 O ATOM 30698 H1 WAT 5255 125.814 21.568 89.160 1.00 0.00 H ATOM 30699 H2 WAT 5255 126.177 21.948 90.580 1.00 0.00 H TER 30701 WAT 5255 ATOM 30701 O WAT 5256 108.881 134.290 73.859 1.00 0.00 O ATOM 30702 H1 WAT 5256 108.524 135.083 73.459 1.00 0.00 H ATOM 30703 H2 WAT 5256 109.684 134.114 73.369 1.00 0.00 H TER 30705 WAT 5256 ATOM 30705 O WAT 5257 34.414 98.910 85.539 1.00 0.00 O ATOM 30706 H1 WAT 5257 34.066 99.751 85.241 1.00 0.00 H ATOM 30707 H2 WAT 5257 35.239 99.132 85.970 1.00 0.00 H TER 30709 WAT 5257 ATOM 30709 O WAT 5258 126.929 52.512 132.517 1.00 0.00 O ATOM 30710 H1 WAT 5258 127.300 53.293 132.106 1.00 0.00 H ATOM 30711 H2 WAT 5258 127.687 52.038 132.859 1.00 0.00 H TER 30713 WAT 5258 ATOM 30713 O WAT 5259 76.470 94.633 22.265 1.00 0.00 O ATOM 30714 H1 WAT 5259 76.532 94.999 23.147 1.00 0.00 H ATOM 30715 H2 WAT 5259 76.076 93.770 22.391 1.00 0.00 H TER 30717 WAT 5259 ATOM 30717 O WAT 5260 74.934 10.955 128.492 1.00 0.00 O ATOM 30718 H1 WAT 5260 75.773 10.599 128.200 1.00 0.00 H ATOM 30719 H2 WAT 5260 75.128 11.863 128.725 1.00 0.00 H TER 30721 WAT 5260 ATOM 30721 O WAT 5261 7.828 55.011 129.860 1.00 0.00 O ATOM 30722 H1 WAT 5261 7.139 55.544 130.258 1.00 0.00 H ATOM 30723 H2 WAT 5261 8.576 55.107 130.449 1.00 0.00 H TER 30725 WAT 5261 ATOM 30725 O WAT 5262 40.923 63.148 138.246 1.00 0.00 O ATOM 30726 H1 WAT 5262 41.163 62.280 138.573 1.00 0.00 H ATOM 30727 H2 WAT 5262 41.031 63.726 139.001 1.00 0.00 H TER 30729 WAT 5262 ATOM 30729 O WAT 5263 57.450 140.087 61.453 1.00 0.00 O ATOM 30730 H1 WAT 5263 58.336 139.873 61.745 1.00 0.00 H ATOM 30731 H2 WAT 5263 57.071 139.246 61.199 1.00 0.00 H TER 30733 WAT 5263 ATOM 30733 O WAT 5264 111.144 79.477 144.850 1.00 0.00 O ATOM 30734 H1 WAT 5264 111.904 78.894 144.862 1.00 0.00 H ATOM 30735 H2 WAT 5264 110.534 79.061 144.241 1.00 0.00 H TER 30737 WAT 5264 ATOM 30737 O WAT 5265 131.022 53.397 141.497 1.00 0.00 O ATOM 30738 H1 WAT 5265 131.288 53.174 140.605 1.00 0.00 H ATOM 30739 H2 WAT 5265 131.599 52.877 142.056 1.00 0.00 H TER 30741 WAT 5265 ATOM 30741 O WAT 5266 103.512 134.893 124.787 1.00 0.00 O ATOM 30742 H1 WAT 5266 102.687 134.935 124.304 1.00 0.00 H ATOM 30743 H2 WAT 5266 103.710 133.958 124.842 1.00 0.00 H TER 30745 WAT 5266 ATOM 30745 O WAT 5267 21.378 69.628 88.325 1.00 0.00 O ATOM 30746 H1 WAT 5267 22.163 69.167 88.031 1.00 0.00 H ATOM 30747 H2 WAT 5267 20.864 69.759 87.529 1.00 0.00 H TER 30749 WAT 5267 ATOM 30749 O WAT 5268 139.825 112.632 6.443 1.00 0.00 O ATOM 30750 H1 WAT 5268 139.992 113.367 5.854 1.00 0.00 H ATOM 30751 H2 WAT 5268 140.634 112.121 6.423 1.00 0.00 H TER 30753 WAT 5268 ATOM 30753 O WAT 5269 142.568 24.246 23.689 1.00 0.00 O ATOM 30754 H1 WAT 5269 143.215 23.947 24.329 1.00 0.00 H ATOM 30755 H2 WAT 5269 143.090 24.602 22.970 1.00 0.00 H TER 30757 WAT 5269 ATOM 30757 O WAT 5270 91.630 94.473 68.024 1.00 0.00 O ATOM 30758 H1 WAT 5270 91.379 94.760 68.902 1.00 0.00 H ATOM 30759 H2 WAT 5270 91.119 95.029 67.435 1.00 0.00 H TER 30761 WAT 5270 ATOM 30761 O WAT 5271 109.236 127.427 69.823 1.00 0.00 O ATOM 30762 H1 WAT 5271 109.260 127.820 68.951 1.00 0.00 H ATOM 30763 H2 WAT 5271 108.337 127.562 70.122 1.00 0.00 H TER 30765 WAT 5271 ATOM 30765 O WAT 5272 68.887 130.198 124.837 1.00 0.00 O ATOM 30766 H1 WAT 5272 68.277 130.331 124.111 1.00 0.00 H ATOM 30767 H2 WAT 5272 68.773 129.279 125.080 1.00 0.00 H TER 30769 WAT 5272 ATOM 30769 O WAT 5273 10.689 122.359 133.908 1.00 0.00 O ATOM 30770 H1 WAT 5273 11.248 123.118 133.741 1.00 0.00 H ATOM 30771 H2 WAT 5273 9.821 122.730 134.063 1.00 0.00 H TER 30773 WAT 5273 ATOM 30773 O WAT 5274 20.503 36.064 75.704 1.00 0.00 O ATOM 30774 H1 WAT 5274 20.061 36.765 75.224 1.00 0.00 H ATOM 30775 H2 WAT 5274 21.219 35.795 75.128 1.00 0.00 H TER 30777 WAT 5274 ATOM 30777 O WAT 5275 96.693 81.908 122.279 1.00 0.00 O ATOM 30778 H1 WAT 5275 96.073 82.028 122.998 1.00 0.00 H ATOM 30779 H2 WAT 5275 97.369 81.334 122.638 1.00 0.00 H TER 30781 WAT 5275 ATOM 30781 O WAT 5276 25.462 10.485 98.293 1.00 0.00 O ATOM 30782 H1 WAT 5276 25.289 11.407 98.486 1.00 0.00 H ATOM 30783 H2 WAT 5276 24.593 10.088 98.224 1.00 0.00 H TER 30785 WAT 5276 ATOM 30785 O WAT 5277 20.636 119.274 136.157 1.00 0.00 O ATOM 30786 H1 WAT 5277 20.698 118.457 135.662 1.00 0.00 H ATOM 30787 H2 WAT 5277 20.105 119.849 135.605 1.00 0.00 H TER 30789 WAT 5277 ATOM 30789 O WAT 5278 76.781 50.836 10.814 1.00 0.00 O ATOM 30790 H1 WAT 5278 76.921 51.137 9.916 1.00 0.00 H ATOM 30791 H2 WAT 5278 77.302 50.036 10.882 1.00 0.00 H TER 30793 WAT 5278 ATOM 30793 O WAT 5279 79.503 88.795 124.363 1.00 0.00 O ATOM 30794 H1 WAT 5279 79.338 89.525 124.960 1.00 0.00 H ATOM 30795 H2 WAT 5279 78.882 88.927 123.646 1.00 0.00 H TER 30797 WAT 5279 ATOM 30797 O WAT 5280 10.786 86.190 91.378 1.00 0.00 O ATOM 30798 H1 WAT 5280 10.374 85.627 90.723 1.00 0.00 H ATOM 30799 H2 WAT 5280 10.405 85.908 92.210 1.00 0.00 H TER 30801 WAT 5280 ATOM 30801 O WAT 5281 10.074 64.823 71.123 1.00 0.00 O ATOM 30802 H1 WAT 5281 9.433 64.188 70.805 1.00 0.00 H ATOM 30803 H2 WAT 5281 9.547 65.541 71.474 1.00 0.00 H TER 30805 WAT 5281 ATOM 30805 O WAT 5282 62.858 79.568 8.856 1.00 0.00 O ATOM 30806 H1 WAT 5282 63.472 79.944 8.225 1.00 0.00 H ATOM 30807 H2 WAT 5282 62.333 80.312 9.151 1.00 0.00 H TER 30809 WAT 5282 ATOM 30809 O WAT 5283 117.905 104.552 141.083 1.00 0.00 O ATOM 30810 H1 WAT 5283 117.613 105.442 141.281 1.00 0.00 H ATOM 30811 H2 WAT 5283 118.424 104.642 140.284 1.00 0.00 H TER 30813 WAT 5283 ATOM 30813 O WAT 5284 83.191 49.635 73.057 1.00 0.00 O ATOM 30814 H1 WAT 5284 83.184 49.260 73.938 1.00 0.00 H ATOM 30815 H2 WAT 5284 84.118 49.782 72.867 1.00 0.00 H TER 30817 WAT 5284 ATOM 30817 O WAT 5285 28.150 67.123 73.092 1.00 0.00 O ATOM 30818 H1 WAT 5285 28.420 68.022 72.905 1.00 0.00 H ATOM 30819 H2 WAT 5285 28.645 66.590 72.469 1.00 0.00 H TER 30821 WAT 5285 ATOM 30821 O WAT 5286 72.755 127.213 134.316 1.00 0.00 O ATOM 30822 H1 WAT 5286 73.530 126.708 134.070 1.00 0.00 H ATOM 30823 H2 WAT 5286 73.021 127.693 135.100 1.00 0.00 H TER 30825 WAT 5286 ATOM 30825 O WAT 5287 78.569 25.534 12.557 1.00 0.00 O ATOM 30826 H1 WAT 5287 77.780 25.073 12.843 1.00 0.00 H ATOM 30827 H2 WAT 5287 78.946 24.968 11.883 1.00 0.00 H TER 30829 WAT 5287 ATOM 30829 O WAT 5288 60.932 95.540 94.945 1.00 0.00 O ATOM 30830 H1 WAT 5288 60.192 96.131 95.086 1.00 0.00 H ATOM 30831 H2 WAT 5288 60.854 95.273 94.029 1.00 0.00 H TER 30833 WAT 5288 ATOM 30833 O WAT 5289 67.349 92.345 137.370 1.00 0.00 O ATOM 30834 H1 WAT 5289 67.931 93.094 137.497 1.00 0.00 H ATOM 30835 H2 WAT 5289 66.555 92.574 137.852 1.00 0.00 H TER 30837 WAT 5289 ATOM 30837 O WAT 5290 133.997 8.591 23.027 1.00 0.00 O ATOM 30838 H1 WAT 5290 133.495 8.900 22.273 1.00 0.00 H ATOM 30839 H2 WAT 5290 134.911 8.724 22.776 1.00 0.00 H TER 30841 WAT 5290 ATOM 30841 O WAT 5291 28.435 25.037 114.902 1.00 0.00 O ATOM 30842 H1 WAT 5291 29.219 25.262 115.402 1.00 0.00 H ATOM 30843 H2 WAT 5291 28.061 25.881 114.648 1.00 0.00 H TER 30845 WAT 5291 ATOM 30845 O WAT 5292 42.999 38.133 101.744 1.00 0.00 O ATOM 30846 H1 WAT 5292 42.265 37.783 101.237 1.00 0.00 H ATOM 30847 H2 WAT 5292 43.183 37.456 102.396 1.00 0.00 H TER 30849 WAT 5292 ATOM 30849 O WAT 5293 76.090 22.646 90.494 1.00 0.00 O ATOM 30850 H1 WAT 5293 76.094 23.530 90.862 1.00 0.00 H ATOM 30851 H2 WAT 5293 75.501 22.702 89.742 1.00 0.00 H TER 30853 WAT 5293 ATOM 30853 O WAT 5294 139.001 16.935 100.537 1.00 0.00 O ATOM 30854 H1 WAT 5294 139.568 17.544 101.010 1.00 0.00 H ATOM 30855 H2 WAT 5294 138.778 17.395 99.728 1.00 0.00 H TER 30857 WAT 5294 ATOM 30857 O WAT 5295 15.304 96.520 137.462 1.00 0.00 O ATOM 30858 H1 WAT 5295 16.223 96.581 137.725 1.00 0.00 H ATOM 30859 H2 WAT 5295 15.324 96.579 136.507 1.00 0.00 H TER 30861 WAT 5295 ATOM 30861 O WAT 5296 9.110 5.954 130.541 1.00 0.00 O ATOM 30862 H1 WAT 5296 9.296 6.696 131.117 1.00 0.00 H ATOM 30863 H2 WAT 5296 8.742 5.287 131.121 1.00 0.00 H TER 30865 WAT 5296 ATOM 30865 O WAT 5297 25.418 51.738 157.100 1.00 0.00 O ATOM 30866 H1 WAT 5297 25.635 50.904 157.517 1.00 0.00 H ATOM 30867 H2 WAT 5297 25.838 52.398 157.651 1.00 0.00 H TER 30869 WAT 5297 ATOM 30869 O WAT 5298 44.736 114.699 89.904 1.00 0.00 O ATOM 30870 H1 WAT 5298 43.814 114.806 89.671 1.00 0.00 H ATOM 30871 H2 WAT 5298 44.916 113.771 89.751 1.00 0.00 H TER 30873 WAT 5298 ATOM 30873 O WAT 5299 119.211 30.150 109.188 1.00 0.00 O ATOM 30874 H1 WAT 5299 119.614 31.019 109.196 1.00 0.00 H ATOM 30875 H2 WAT 5299 119.863 29.588 108.770 1.00 0.00 H TER 30877 WAT 5299 ATOM 30877 O WAT 5300 30.592 42.854 22.170 1.00 0.00 O ATOM 30878 H1 WAT 5300 30.524 43.593 22.774 1.00 0.00 H ATOM 30879 H2 WAT 5300 31.203 42.252 22.596 1.00 0.00 H TER 30881 WAT 5300 ATOM 30881 O WAT 5301 13.749 10.684 112.075 1.00 0.00 O ATOM 30882 H1 WAT 5301 13.919 10.009 111.418 1.00 0.00 H ATOM 30883 H2 WAT 5301 13.048 10.319 112.615 1.00 0.00 H TER 30885 WAT 5301 ATOM 30885 O WAT 5302 133.304 32.859 86.990 1.00 0.00 O ATOM 30886 H1 WAT 5302 132.894 33.665 87.304 1.00 0.00 H ATOM 30887 H2 WAT 5302 134.124 32.801 87.480 1.00 0.00 H TER 30889 WAT 5302 ATOM 30889 O WAT 5303 135.881 30.544 103.635 1.00 0.00 O ATOM 30890 H1 WAT 5303 135.028 30.953 103.487 1.00 0.00 H ATOM 30891 H2 WAT 5303 135.740 29.618 103.437 1.00 0.00 H TER 30893 WAT 5303 ATOM 30893 O WAT 5304 61.294 40.977 89.257 1.00 0.00 O ATOM 30894 H1 WAT 5304 60.941 40.274 88.711 1.00 0.00 H ATOM 30895 H2 WAT 5304 61.522 41.669 88.637 1.00 0.00 H TER 30897 WAT 5304 ATOM 30897 O WAT 5305 110.490 37.361 129.559 1.00 0.00 O ATOM 30898 H1 WAT 5305 110.781 38.226 129.272 1.00 0.00 H ATOM 30899 H2 WAT 5305 110.063 36.984 128.790 1.00 0.00 H TER 30901 WAT 5305 ATOM 30901 O WAT 5306 109.857 64.818 78.442 1.00 0.00 O ATOM 30902 H1 WAT 5306 109.508 64.522 79.283 1.00 0.00 H ATOM 30903 H2 WAT 5306 110.800 64.895 78.588 1.00 0.00 H TER 30905 WAT 5306 ATOM 30905 O WAT 5307 94.548 122.635 91.583 1.00 0.00 O ATOM 30906 H1 WAT 5307 94.510 121.839 91.053 1.00 0.00 H ATOM 30907 H2 WAT 5307 94.213 122.369 92.440 1.00 0.00 H TER 30909 WAT 5307 ATOM 30909 O WAT 5308 139.206 145.098 119.844 1.00 0.00 O ATOM 30910 H1 WAT 5308 138.444 145.671 119.923 1.00 0.00 H ATOM 30911 H2 WAT 5308 139.065 144.419 120.504 1.00 0.00 H TER 30913 WAT 5308 ATOM 30913 O WAT 5309 100.582 97.632 108.901 1.00 0.00 O ATOM 30914 H1 WAT 5309 100.833 97.691 109.822 1.00 0.00 H ATOM 30915 H2 WAT 5309 100.203 98.488 108.700 1.00 0.00 H TER 30917 WAT 5309 ATOM 30917 O WAT 5310 38.189 57.995 24.420 1.00 0.00 O ATOM 30918 H1 WAT 5310 37.640 57.682 23.701 1.00 0.00 H ATOM 30919 H2 WAT 5310 38.578 58.805 24.089 1.00 0.00 H TER 30921 WAT 5310 ATOM 30921 O WAT 5311 28.412 75.948 135.192 1.00 0.00 O ATOM 30922 H1 WAT 5311 28.619 76.674 134.605 1.00 0.00 H ATOM 30923 H2 WAT 5311 27.641 75.536 134.802 1.00 0.00 H TER 30925 WAT 5311 ATOM 30925 O WAT 5312 45.948 90.172 75.905 1.00 0.00 O ATOM 30926 H1 WAT 5312 46.524 90.530 76.580 1.00 0.00 H ATOM 30927 H2 WAT 5312 45.201 90.770 75.886 1.00 0.00 H TER 30929 WAT 5312 ATOM 30929 O WAT 5313 94.127 62.434 70.272 1.00 0.00 O ATOM 30930 H1 WAT 5313 95.004 62.584 70.625 1.00 0.00 H ATOM 30931 H2 WAT 5313 93.538 62.796 70.933 1.00 0.00 H TER 30933 WAT 5313 ATOM 30933 O WAT 5314 114.019 100.770 65.091 1.00 0.00 O ATOM 30934 H1 WAT 5314 113.330 101.173 64.563 1.00 0.00 H ATOM 30935 H2 WAT 5314 114.662 100.464 64.451 1.00 0.00 H TER 30937 WAT 5314 ATOM 30937 O WAT 5315 99.090 55.256 133.794 1.00 0.00 O ATOM 30938 H1 WAT 5315 98.211 55.611 133.664 1.00 0.00 H ATOM 30939 H2 WAT 5315 99.123 55.034 134.725 1.00 0.00 H TER 30941 WAT 5315 ATOM 30941 O WAT 5316 63.558 68.950 26.921 1.00 0.00 O ATOM 30942 H1 WAT 5316 63.324 68.152 26.447 1.00 0.00 H ATOM 30943 H2 WAT 5316 63.932 69.524 26.252 1.00 0.00 H TER 30945 WAT 5316 ATOM 30945 O WAT 5317 33.099 104.215 137.533 1.00 0.00 O ATOM 30946 H1 WAT 5317 33.055 103.619 138.281 1.00 0.00 H ATOM 30947 H2 WAT 5317 34.034 104.293 137.343 1.00 0.00 H TER 30949 WAT 5317 ATOM 30949 O WAT 5318 25.057 110.913 141.007 1.00 0.00 O ATOM 30950 H1 WAT 5318 24.946 111.863 141.054 1.00 0.00 H ATOM 30951 H2 WAT 5318 24.273 110.602 140.553 1.00 0.00 H TER 30953 WAT 5318 ATOM 30953 O WAT 5319 146.026 41.971 115.294 1.00 0.00 O ATOM 30954 H1 WAT 5319 146.001 42.458 114.471 1.00 0.00 H ATOM 30955 H2 WAT 5319 145.375 42.402 115.847 1.00 0.00 H TER 30957 WAT 5319 ATOM 30957 O WAT 5320 62.840 126.208 146.672 1.00 0.00 O ATOM 30958 H1 WAT 5320 62.895 125.929 145.758 1.00 0.00 H ATOM 30959 H2 WAT 5320 62.003 125.859 146.979 1.00 0.00 H TER 30961 WAT 5320 ATOM 30961 O WAT 5321 80.111 19.067 7.212 1.00 0.00 O ATOM 30962 H1 WAT 5321 79.437 18.390 7.161 1.00 0.00 H ATOM 30963 H2 WAT 5321 80.818 18.744 6.654 1.00 0.00 H TER 30965 WAT 5321 ATOM 30965 O WAT 5322 120.917 9.958 93.776 1.00 0.00 O ATOM 30966 H1 WAT 5322 120.376 9.252 94.131 1.00 0.00 H ATOM 30967 H2 WAT 5322 121.209 10.446 94.547 1.00 0.00 H TER 30969 WAT 5322 ATOM 30969 O WAT 5323 75.446 133.309 132.826 1.00 0.00 O ATOM 30970 H1 WAT 5323 75.374 133.362 133.779 1.00 0.00 H ATOM 30971 H2 WAT 5323 75.308 134.207 132.525 1.00 0.00 H TER 30973 WAT 5323 ATOM 30973 O WAT 5324 22.213 95.487 16.055 1.00 0.00 O ATOM 30974 H1 WAT 5324 21.962 95.440 15.133 1.00 0.00 H ATOM 30975 H2 WAT 5324 22.442 94.587 16.287 1.00 0.00 H TER 30977 WAT 5324 ATOM 30977 O WAT 5325 10.056 111.518 73.534 1.00 0.00 O ATOM 30978 H1 WAT 5325 10.175 111.564 74.482 1.00 0.00 H ATOM 30979 H2 WAT 5325 9.118 111.368 73.417 1.00 0.00 H TER 30981 WAT 5325 ATOM 30981 O WAT 5326 119.605 8.309 7.786 1.00 0.00 O ATOM 30982 H1 WAT 5326 120.378 8.873 7.750 1.00 0.00 H ATOM 30983 H2 WAT 5326 118.873 8.893 7.590 1.00 0.00 H TER 30985 WAT 5326 ATOM 30985 O WAT 5327 24.505 75.489 146.925 1.00 0.00 O ATOM 30986 H1 WAT 5327 24.356 74.595 147.233 1.00 0.00 H ATOM 30987 H2 WAT 5327 25.177 75.836 147.512 1.00 0.00 H TER 30989 WAT 5327 ATOM 30989 O WAT 5328 119.525 35.228 75.229 1.00 0.00 O ATOM 30990 H1 WAT 5328 119.511 35.920 74.568 1.00 0.00 H ATOM 30991 H2 WAT 5328 118.962 34.542 74.870 1.00 0.00 H TER 30993 WAT 5328 ATOM 30993 O WAT 5329 33.400 62.819 98.292 1.00 0.00 O ATOM 30994 H1 WAT 5329 33.625 63.728 98.093 1.00 0.00 H ATOM 30995 H2 WAT 5329 32.465 62.844 98.496 1.00 0.00 H TER 30997 WAT 5329 ATOM 30997 O WAT 5330 142.124 143.173 105.322 1.00 0.00 O ATOM 30998 H1 WAT 5330 141.843 142.374 104.875 1.00 0.00 H ATOM 30999 H2 WAT 5330 142.987 143.362 104.954 1.00 0.00 H TER 31001 WAT 5330 ATOM 31001 O WAT 5331 121.636 80.538 106.282 1.00 0.00 O ATOM 31002 H1 WAT 5331 121.482 80.185 105.406 1.00 0.00 H ATOM 31003 H2 WAT 5331 120.809 80.403 106.743 1.00 0.00 H TER 31005 WAT 5331 ATOM 31005 O WAT 5332 110.704 61.237 103.524 1.00 0.00 O ATOM 31006 H1 WAT 5332 110.647 62.084 103.082 1.00 0.00 H ATOM 31007 H2 WAT 5332 111.259 61.402 104.287 1.00 0.00 H TER 31009 WAT 5332 ATOM 31009 O WAT 5333 4.128 121.896 87.272 1.00 0.00 O ATOM 31010 H1 WAT 5333 5.048 122.147 87.359 1.00 0.00 H ATOM 31011 H2 WAT 5333 3.727 122.166 88.098 1.00 0.00 H TER 31013 WAT 5333 ATOM 31013 O WAT 5334 100.603 70.341 92.364 1.00 0.00 O ATOM 31014 H1 WAT 5334 101.020 71.137 92.695 1.00 0.00 H ATOM 31015 H2 WAT 5334 99.780 70.282 92.850 1.00 0.00 H TER 31017 WAT 5334 ATOM 31017 O WAT 5335 115.577 114.354 11.787 1.00 0.00 O ATOM 31018 H1 WAT 5335 115.214 114.688 10.966 1.00 0.00 H ATOM 31019 H2 WAT 5335 114.812 114.078 12.292 1.00 0.00 H TER 31021 WAT 5335 ATOM 31021 O WAT 5336 127.417 24.639 138.167 1.00 0.00 O ATOM 31022 H1 WAT 5336 126.628 24.873 138.655 1.00 0.00 H ATOM 31023 H2 WAT 5336 127.109 24.038 137.488 1.00 0.00 H TER 31025 WAT 5336 ATOM 31025 O WAT 5337 82.835 70.907 5.518 1.00 0.00 O ATOM 31026 H1 WAT 5337 82.954 70.836 6.466 1.00 0.00 H ATOM 31027 H2 WAT 5337 82.987 71.832 5.326 1.00 0.00 H TER 31029 WAT 5337 ATOM 31029 O WAT 5338 11.260 115.226 136.243 1.00 0.00 O ATOM 31030 H1 WAT 5338 10.447 115.711 136.098 1.00 0.00 H ATOM 31031 H2 WAT 5338 11.547 115.497 137.115 1.00 0.00 H TER 31033 WAT 5338 ATOM 31033 O WAT 5339 93.495 107.208 73.809 1.00 0.00 O ATOM 31034 H1 WAT 5339 93.880 107.145 74.683 1.00 0.00 H ATOM 31035 H2 WAT 5339 94.219 107.015 73.214 1.00 0.00 H TER 31037 WAT 5339 ATOM 31037 O WAT 5340 10.858 8.870 117.242 1.00 0.00 O ATOM 31038 H1 WAT 5340 10.000 9.213 117.491 1.00 0.00 H ATOM 31039 H2 WAT 5340 11.469 9.576 117.451 1.00 0.00 H TER 31041 WAT 5340 ATOM 31041 O WAT 5341 24.633 14.365 62.229 1.00 0.00 O ATOM 31042 H1 WAT 5341 24.032 13.656 62.458 1.00 0.00 H ATOM 31043 H2 WAT 5341 25.432 13.920 61.947 1.00 0.00 H TER 31045 WAT 5341 ATOM 31045 O WAT 5342 141.668 23.855 153.002 1.00 0.00 O ATOM 31046 H1 WAT 5342 142.320 24.540 153.151 1.00 0.00 H ATOM 31047 H2 WAT 5342 141.587 23.414 153.847 1.00 0.00 H TER 31049 WAT 5342 ATOM 31049 O WAT 5343 90.992 109.833 72.680 1.00 0.00 O ATOM 31050 H1 WAT 5343 90.132 110.250 72.728 1.00 0.00 H ATOM 31051 H2 WAT 5343 91.368 109.959 73.551 1.00 0.00 H TER 31053 WAT 5343 ATOM 31053 O WAT 5344 123.943 80.185 127.361 1.00 0.00 O ATOM 31054 H1 WAT 5344 123.657 81.098 127.366 1.00 0.00 H ATOM 31055 H2 WAT 5344 123.628 79.840 126.525 1.00 0.00 H TER 31057 WAT 5344 ATOM 31057 O WAT 5345 47.390 17.314 147.262 1.00 0.00 O ATOM 31058 H1 WAT 5345 48.000 17.905 147.703 1.00 0.00 H ATOM 31059 H2 WAT 5345 46.573 17.404 147.752 1.00 0.00 H TER 31061 WAT 5345 ATOM 31061 O WAT 5346 127.144 16.376 94.398 1.00 0.00 O ATOM 31062 H1 WAT 5346 127.254 15.469 94.115 1.00 0.00 H ATOM 31063 H2 WAT 5346 126.280 16.627 94.070 1.00 0.00 H TER 31065 WAT 5346 ATOM 31065 O WAT 5347 140.578 95.602 127.193 1.00 0.00 O ATOM 31066 H1 WAT 5347 140.901 96.405 126.784 1.00 0.00 H ATOM 31067 H2 WAT 5347 140.827 94.907 126.584 1.00 0.00 H TER 31069 WAT 5347 ATOM 31069 O WAT 5348 74.794 69.305 78.888 1.00 0.00 O ATOM 31070 H1 WAT 5348 75.103 68.996 78.037 1.00 0.00 H ATOM 31071 H2 WAT 5348 73.888 68.999 78.940 1.00 0.00 H TER 31073 WAT 5348 ATOM 31073 O WAT 5349 80.158 135.193 67.686 1.00 0.00 O ATOM 31074 H1 WAT 5349 79.577 135.368 68.426 1.00 0.00 H ATOM 31075 H2 WAT 5349 80.501 134.315 67.854 1.00 0.00 H TER 31077 WAT 5349 ATOM 31077 O WAT 5350 57.809 76.982 149.780 1.00 0.00 O ATOM 31078 H1 WAT 5350 56.870 77.164 149.834 1.00 0.00 H ATOM 31079 H2 WAT 5350 58.113 77.020 150.687 1.00 0.00 H TER 31081 WAT 5350 ATOM 31081 O WAT 5351 71.112 38.792 112.530 1.00 0.00 O ATOM 31082 H1 WAT 5351 71.829 39.184 112.033 1.00 0.00 H ATOM 31083 H2 WAT 5351 70.423 38.645 111.881 1.00 0.00 H TER 31085 WAT 5351 ATOM 31085 O WAT 5352 88.441 24.332 6.179 1.00 0.00 O ATOM 31086 H1 WAT 5352 87.522 24.587 6.254 1.00 0.00 H ATOM 31087 H2 WAT 5352 88.614 23.825 6.972 1.00 0.00 H TER 31089 WAT 5352 ATOM 31089 O WAT 5353 145.414 130.364 75.699 1.00 0.00 O ATOM 31090 H1 WAT 5353 145.651 131.088 76.279 1.00 0.00 H ATOM 31091 H2 WAT 5353 144.922 130.777 74.989 1.00 0.00 H TER 31093 WAT 5353 ATOM 31093 O WAT 5354 75.973 16.713 64.131 1.00 0.00 O ATOM 31094 H1 WAT 5354 76.789 16.427 63.722 1.00 0.00 H ATOM 31095 H2 WAT 5354 76.047 16.425 65.041 1.00 0.00 H TER 31097 WAT 5354 ATOM 31097 O WAT 5355 73.143 126.496 97.748 1.00 0.00 O ATOM 31098 H1 WAT 5355 73.202 125.541 97.743 1.00 0.00 H ATOM 31099 H2 WAT 5355 72.438 126.690 98.367 1.00 0.00 H TER 31101 WAT 5355 ATOM 31101 O WAT 5356 105.612 132.503 150.211 1.00 0.00 O ATOM 31102 H1 WAT 5356 105.628 131.574 150.440 1.00 0.00 H ATOM 31103 H2 WAT 5356 105.240 132.526 149.330 1.00 0.00 H TER 31105 WAT 5356 ATOM 31105 O WAT 5357 13.480 126.661 108.877 1.00 0.00 O ATOM 31106 H1 WAT 5357 13.541 127.612 108.967 1.00 0.00 H ATOM 31107 H2 WAT 5357 13.517 126.333 109.775 1.00 0.00 H TER 31109 WAT 5357 ATOM 31109 O WAT 5358 87.588 70.135 78.486 1.00 0.00 O ATOM 31110 H1 WAT 5358 87.920 70.796 79.094 1.00 0.00 H ATOM 31111 H2 WAT 5358 87.286 70.638 77.729 1.00 0.00 H TER 31113 WAT 5358 ATOM 31113 O WAT 5359 21.074 73.911 8.749 1.00 0.00 O ATOM 31114 H1 WAT 5359 21.567 73.675 7.963 1.00 0.00 H ATOM 31115 H2 WAT 5359 21.713 73.851 9.459 1.00 0.00 H TER 31117 WAT 5359 ATOM 31117 O WAT 5360 22.666 125.806 80.095 1.00 0.00 O ATOM 31118 H1 WAT 5360 23.533 126.149 80.313 1.00 0.00 H ATOM 31119 H2 WAT 5360 22.117 126.585 80.005 1.00 0.00 H TER 31121 WAT 5360 ATOM 31121 O WAT 5361 127.536 30.316 92.101 1.00 0.00 O ATOM 31122 H1 WAT 5361 126.654 29.968 91.966 1.00 0.00 H ATOM 31123 H2 WAT 5361 127.653 30.952 91.395 1.00 0.00 H TER 31125 WAT 5361 ATOM 31125 O WAT 5362 30.976 86.060 63.608 1.00 0.00 O ATOM 31126 H1 WAT 5362 30.095 85.841 63.303 1.00 0.00 H ATOM 31127 H2 WAT 5362 31.457 85.234 63.565 1.00 0.00 H TER 31129 WAT 5362 ATOM 31129 O WAT 5363 27.616 132.794 65.711 1.00 0.00 O ATOM 31130 H1 WAT 5363 27.807 132.383 64.868 1.00 0.00 H ATOM 31131 H2 WAT 5363 26.714 132.538 65.904 1.00 0.00 H TER 31133 WAT 5363 ATOM 31133 O WAT 5364 59.790 111.590 1.989 1.00 0.00 O ATOM 31134 H1 WAT 5364 59.560 110.719 2.315 1.00 0.00 H ATOM 31135 H2 WAT 5364 58.956 112.058 1.949 1.00 0.00 H TER 31137 WAT 5364 ATOM 31137 O WAT 5365 140.027 34.508 19.273 1.00 0.00 O ATOM 31138 H1 WAT 5365 139.694 34.966 18.502 1.00 0.00 H ATOM 31139 H2 WAT 5365 139.329 33.896 19.509 1.00 0.00 H TER 31141 WAT 5365 ATOM 31141 O WAT 5366 86.657 50.267 109.617 1.00 0.00 O ATOM 31142 H1 WAT 5366 87.510 50.653 109.816 1.00 0.00 H ATOM 31143 H2 WAT 5366 86.616 49.482 110.163 1.00 0.00 H TER 31145 WAT 5366 ATOM 31145 O WAT 5367 125.051 96.998 136.137 1.00 0.00 O ATOM 31146 H1 WAT 5367 124.673 96.184 135.805 1.00 0.00 H ATOM 31147 H2 WAT 5367 125.934 96.756 136.417 1.00 0.00 H TER 31149 WAT 5367 ATOM 31149 O WAT 5368 81.881 30.360 4.336 1.00 0.00 O ATOM 31150 H1 WAT 5368 81.957 29.625 3.727 1.00 0.00 H ATOM 31151 H2 WAT 5368 81.591 31.092 3.793 1.00 0.00 H TER 31153 WAT 5368 ATOM 31153 O WAT 5369 16.360 111.018 93.238 1.00 0.00 O ATOM 31154 H1 WAT 5369 15.961 110.261 93.667 1.00 0.00 H ATOM 31155 H2 WAT 5369 15.972 111.774 93.678 1.00 0.00 H TER 31157 WAT 5369 ATOM 31157 O WAT 5370 109.972 52.254 140.460 1.00 0.00 O ATOM 31158 H1 WAT 5370 109.733 52.539 141.341 1.00 0.00 H ATOM 31159 H2 WAT 5370 109.496 51.433 140.336 1.00 0.00 H TER 31161 WAT 5370 ATOM 31161 O WAT 5371 84.418 38.988 23.735 1.00 0.00 O ATOM 31162 H1 WAT 5371 84.263 38.051 23.619 1.00 0.00 H ATOM 31163 H2 WAT 5371 83.560 39.347 23.962 1.00 0.00 H TER 31165 WAT 5371 ATOM 31165 O WAT 5372 85.947 95.477 61.796 1.00 0.00 O ATOM 31166 H1 WAT 5372 86.553 96.208 61.676 1.00 0.00 H ATOM 31167 H2 WAT 5372 85.253 95.634 61.156 1.00 0.00 H TER 31169 WAT 5372 ATOM 31169 O WAT 5373 64.650 65.630 9.790 1.00 0.00 O ATOM 31170 H1 WAT 5373 64.980 65.539 8.897 1.00 0.00 H ATOM 31171 H2 WAT 5373 65.364 65.311 10.343 1.00 0.00 H TER 31173 WAT 5373 ATOM 31173 O WAT 5374 114.049 123.734 128.906 1.00 0.00 O ATOM 31174 H1 WAT 5374 114.926 123.959 128.595 1.00 0.00 H ATOM 31175 H2 WAT 5374 113.464 124.298 128.401 1.00 0.00 H TER 31177 WAT 5374 ATOM 31177 O WAT 5375 100.660 61.360 106.616 1.00 0.00 O ATOM 31178 H1 WAT 5375 99.828 61.698 106.285 1.00 0.00 H ATOM 31179 H2 WAT 5375 101.324 61.801 106.087 1.00 0.00 H TER 31181 WAT 5375 ATOM 31181 O WAT 5376 72.992 100.555 12.037 1.00 0.00 O ATOM 31182 H1 WAT 5376 72.174 101.016 11.849 1.00 0.00 H ATOM 31183 H2 WAT 5376 73.674 101.212 11.898 1.00 0.00 H TER 31185 WAT 5376 ATOM 31185 O WAT 5377 86.574 52.128 145.666 1.00 0.00 O ATOM 31186 H1 WAT 5377 86.409 53.031 145.397 1.00 0.00 H ATOM 31187 H2 WAT 5377 86.657 52.173 146.619 1.00 0.00 H TER 31189 WAT 5377 ATOM 31189 O WAT 5378 15.473 28.996 24.601 1.00 0.00 O ATOM 31190 H1 WAT 5378 15.170 28.449 23.877 1.00 0.00 H ATOM 31191 H2 WAT 5378 15.032 29.835 24.468 1.00 0.00 H TER 31193 WAT 5378 ATOM 31193 O WAT 5379 3.468 21.367 104.170 1.00 0.00 O ATOM 31194 H1 WAT 5379 4.189 21.793 103.705 1.00 0.00 H ATOM 31195 H2 WAT 5379 3.291 21.941 104.915 1.00 0.00 H TER 31197 WAT 5379 ATOM 31197 O WAT 5380 86.621 33.248 139.060 1.00 0.00 O ATOM 31198 H1 WAT 5380 86.067 32.985 139.795 1.00 0.00 H ATOM 31199 H2 WAT 5380 86.160 32.924 138.286 1.00 0.00 H TER 31201 WAT 5380 ATOM 31201 O WAT 5381 83.833 87.739 134.448 1.00 0.00 O ATOM 31202 H1 WAT 5381 83.012 87.893 133.981 1.00 0.00 H ATOM 31203 H2 WAT 5381 84.495 87.687 133.758 1.00 0.00 H TER 31205 WAT 5381 ATOM 31205 O WAT 5382 26.804 98.662 66.887 1.00 0.00 O ATOM 31206 H1 WAT 5382 27.396 98.670 66.135 1.00 0.00 H ATOM 31207 H2 WAT 5382 25.928 98.679 66.502 1.00 0.00 H TER 31209 WAT 5382 ATOM 31209 O WAT 5383 110.942 53.440 68.049 1.00 0.00 O ATOM 31210 H1 WAT 5383 111.418 53.281 67.234 1.00 0.00 H ATOM 31211 H2 WAT 5383 111.420 52.936 68.707 1.00 0.00 H TER 31213 WAT 5383 ATOM 31213 O WAT 5384 46.616 111.305 128.738 1.00 0.00 O ATOM 31214 H1 WAT 5384 46.490 111.705 127.878 1.00 0.00 H ATOM 31215 H2 WAT 5384 46.780 110.380 128.551 1.00 0.00 H TER 31217 WAT 5384 ATOM 31217 O WAT 5385 66.976 115.838 60.275 1.00 0.00 O ATOM 31218 H1 WAT 5385 66.414 115.181 60.685 1.00 0.00 H ATOM 31219 H2 WAT 5385 66.392 116.576 60.099 1.00 0.00 H TER 31221 WAT 5385 ATOM 31221 O WAT 5386 75.210 71.682 122.838 1.00 0.00 O ATOM 31222 H1 WAT 5386 74.347 71.308 122.658 1.00 0.00 H ATOM 31223 H2 WAT 5386 75.607 71.794 121.975 1.00 0.00 H TER 31225 WAT 5386 ATOM 31225 O WAT 5387 92.794 37.360 84.672 1.00 0.00 O ATOM 31226 H1 WAT 5387 93.298 38.174 84.641 1.00 0.00 H ATOM 31227 H2 WAT 5387 93.449 36.679 84.823 1.00 0.00 H TER 31229 WAT 5387 ATOM 31229 O WAT 5388 92.468 85.145 88.261 1.00 0.00 O ATOM 31230 H1 WAT 5388 92.566 84.193 88.235 1.00 0.00 H ATOM 31231 H2 WAT 5388 92.361 85.400 87.345 1.00 0.00 H TER 31233 WAT 5388 ATOM 31233 O WAT 5389 3.876 68.397 8.046 1.00 0.00 O ATOM 31234 H1 WAT 5389 3.488 69.270 8.000 1.00 0.00 H ATOM 31235 H2 WAT 5389 4.710 68.480 7.584 1.00 0.00 H TER 31237 WAT 5389 ATOM 31237 O WAT 5390 127.775 24.531 79.310 1.00 0.00 O ATOM 31238 H1 WAT 5390 127.122 25.184 79.058 1.00 0.00 H ATOM 31239 H2 WAT 5390 128.603 25.010 79.315 1.00 0.00 H TER 31241 WAT 5390 ATOM 31241 O WAT 5391 99.094 93.933 61.177 1.00 0.00 O ATOM 31242 H1 WAT 5391 99.887 94.458 61.286 1.00 0.00 H ATOM 31243 H2 WAT 5391 98.396 94.576 61.054 1.00 0.00 H TER 31245 WAT 5391 ATOM 31245 O WAT 5392 51.676 133.500 64.834 1.00 0.00 O ATOM 31246 H1 WAT 5392 52.630 133.420 64.833 1.00 0.00 H ATOM 31247 H2 WAT 5392 51.377 132.804 64.249 1.00 0.00 H TER 31249 WAT 5392 ATOM 31249 O WAT 5393 106.067 86.085 101.065 1.00 0.00 O ATOM 31250 H1 WAT 5393 106.463 86.785 101.584 1.00 0.00 H ATOM 31251 H2 WAT 5393 105.234 85.907 101.500 1.00 0.00 H TER 31253 WAT 5393 ATOM 31253 O WAT 5394 123.800 137.524 119.476 1.00 0.00 O ATOM 31254 H1 WAT 5394 123.510 136.613 119.443 1.00 0.00 H ATOM 31255 H2 WAT 5394 123.561 137.883 118.621 1.00 0.00 H TER 31257 WAT 5394 ATOM 31257 O WAT 5395 79.363 23.491 139.297 1.00 0.00 O ATOM 31258 H1 WAT 5395 78.786 23.968 139.894 1.00 0.00 H ATOM 31259 H2 WAT 5395 80.093 23.206 139.846 1.00 0.00 H TER 31261 WAT 5395 ATOM 31261 O WAT 5396 105.311 9.605 88.607 1.00 0.00 O ATOM 31262 H1 WAT 5396 105.804 9.981 87.878 1.00 0.00 H ATOM 31263 H2 WAT 5396 104.482 10.083 88.607 1.00 0.00 H TER 31265 WAT 5396 ATOM 31265 O WAT 5397 111.378 14.159 70.071 1.00 0.00 O ATOM 31266 H1 WAT 5397 111.096 14.361 69.179 1.00 0.00 H ATOM 31267 H2 WAT 5397 110.608 14.337 70.612 1.00 0.00 H TER 31269 WAT 5397 ATOM 31269 O WAT 5398 32.789 135.919 134.552 1.00 0.00 O ATOM 31270 H1 WAT 5398 32.188 136.429 135.094 1.00 0.00 H ATOM 31271 H2 WAT 5398 32.557 135.007 134.728 1.00 0.00 H TER 31273 WAT 5398 ATOM 31273 O WAT 5399 54.660 130.645 93.277 1.00 0.00 O ATOM 31274 H1 WAT 5399 54.840 129.773 92.926 1.00 0.00 H ATOM 31275 H2 WAT 5399 54.764 131.231 92.527 1.00 0.00 H TER 31277 WAT 5399 ATOM 31277 O WAT 5400 2.588 130.262 106.462 1.00 0.00 O ATOM 31278 H1 WAT 5400 3.237 130.941 106.278 1.00 0.00 H ATOM 31279 H2 WAT 5400 2.688 129.634 105.746 1.00 0.00 H TER 31281 WAT 5400 ATOM 31281 O WAT 5401 107.746 141.461 88.211 1.00 0.00 O ATOM 31282 H1 WAT 5401 107.184 141.785 87.508 1.00 0.00 H ATOM 31283 H2 WAT 5401 107.515 141.997 88.970 1.00 0.00 H TER 31285 WAT 5401 ATOM 31285 O WAT 5402 35.322 98.989 3.371 1.00 0.00 O ATOM 31286 H1 WAT 5402 35.153 99.731 3.950 1.00 0.00 H ATOM 31287 H2 WAT 5402 34.461 98.594 3.230 1.00 0.00 H TER 31289 WAT 5402 ATOM 31289 O WAT 5403 137.607 142.628 71.520 1.00 0.00 O ATOM 31290 H1 WAT 5403 137.481 141.699 71.709 1.00 0.00 H ATOM 31291 H2 WAT 5403 138.545 142.773 71.647 1.00 0.00 H TER 31293 WAT 5403 ATOM 31293 O WAT 5404 4.626 111.194 114.525 1.00 0.00 O ATOM 31294 H1 WAT 5404 4.728 110.243 114.501 1.00 0.00 H ATOM 31295 H2 WAT 5404 4.422 111.436 113.622 1.00 0.00 H TER 31297 WAT 5404 ATOM 31297 O WAT 5405 64.802 108.324 156.775 1.00 0.00 O ATOM 31298 H1 WAT 5405 65.246 108.091 157.590 1.00 0.00 H ATOM 31299 H2 WAT 5405 65.511 108.551 156.173 1.00 0.00 H TER 31301 WAT 5405 ATOM 31301 O WAT 5406 43.009 81.178 136.042 1.00 0.00 O ATOM 31302 H1 WAT 5406 42.916 80.457 135.419 1.00 0.00 H ATOM 31303 H2 WAT 5406 43.593 81.798 135.604 1.00 0.00 H TER 31305 WAT 5406 ATOM 31305 O WAT 5407 38.441 23.090 83.895 1.00 0.00 O ATOM 31306 H1 WAT 5407 37.543 23.010 83.573 1.00 0.00 H ATOM 31307 H2 WAT 5407 38.738 22.187 84.004 1.00 0.00 H TER 31309 WAT 5407 ATOM 31309 O WAT 5408 116.475 15.279 63.456 1.00 0.00 O ATOM 31310 H1 WAT 5408 115.614 15.161 63.055 1.00 0.00 H ATOM 31311 H2 WAT 5408 117.095 15.037 62.768 1.00 0.00 H TER 31313 WAT 5408 ATOM 31313 O WAT 5409 142.010 37.196 63.502 1.00 0.00 O ATOM 31314 H1 WAT 5409 142.435 36.583 64.102 1.00 0.00 H ATOM 31315 H2 WAT 5409 141.696 36.648 62.783 1.00 0.00 H TER 31317 WAT 5409 ATOM 31317 O WAT 5410 3.581 22.002 100.002 1.00 0.00 O ATOM 31318 H1 WAT 5410 4.103 21.894 99.207 1.00 0.00 H ATOM 31319 H2 WAT 5410 4.216 22.249 100.674 1.00 0.00 H TER 31321 WAT 5410 ATOM 31321 O WAT 5411 96.316 143.183 134.862 1.00 0.00 O ATOM 31322 H1 WAT 5411 95.901 143.982 134.535 1.00 0.00 H ATOM 31323 H2 WAT 5411 95.585 142.596 135.055 1.00 0.00 H TER 31325 WAT 5411 ATOM 31325 O WAT 5412 89.336 40.601 136.881 1.00 0.00 O ATOM 31326 H1 WAT 5412 89.156 39.891 137.497 1.00 0.00 H ATOM 31327 H2 WAT 5412 89.197 41.400 137.390 1.00 0.00 H TER 31329 WAT 5412 ATOM 31329 O WAT 5413 142.824 20.882 7.790 1.00 0.00 O ATOM 31330 H1 WAT 5413 142.543 19.978 7.651 1.00 0.00 H ATOM 31331 H2 WAT 5413 142.329 21.389 7.146 1.00 0.00 H TER 31333 WAT 5413 ATOM 31333 O WAT 5414 60.106 84.273 16.789 1.00 0.00 O ATOM 31334 H1 WAT 5414 60.247 84.605 17.675 1.00 0.00 H ATOM 31335 H2 WAT 5414 60.406 83.364 16.823 1.00 0.00 H TER 31337 WAT 5414 ATOM 31337 O WAT 5415 113.015 102.892 73.815 1.00 0.00 O ATOM 31338 H1 WAT 5415 113.355 102.343 73.108 1.00 0.00 H ATOM 31339 H2 WAT 5415 112.065 102.863 73.705 1.00 0.00 H TER 31341 WAT 5415 ATOM 31341 O WAT 5416 127.735 125.778 116.492 1.00 0.00 O ATOM 31342 H1 WAT 5416 127.478 126.017 117.383 1.00 0.00 H ATOM 31343 H2 WAT 5416 127.615 124.829 116.455 1.00 0.00 H TER 31345 WAT 5416 ATOM 31345 O WAT 5417 126.811 103.002 138.846 1.00 0.00 O ATOM 31346 H1 WAT 5417 126.416 102.712 139.669 1.00 0.00 H ATOM 31347 H2 WAT 5417 126.636 103.942 138.815 1.00 0.00 H TER 31349 WAT 5417 ATOM 31349 O WAT 5418 116.524 117.456 69.243 1.00 0.00 O ATOM 31350 H1 WAT 5418 115.775 116.920 68.982 1.00 0.00 H ATOM 31351 H2 WAT 5418 117.215 117.221 68.624 1.00 0.00 H TER 31353 WAT 5418 ATOM 31353 O WAT 5419 141.531 26.298 109.642 1.00 0.00 O ATOM 31354 H1 WAT 5419 141.495 26.144 108.698 1.00 0.00 H ATOM 31355 H2 WAT 5419 141.681 25.431 110.020 1.00 0.00 H TER 31357 WAT 5419 ATOM 31357 O WAT 5420 19.830 10.168 91.953 1.00 0.00 O ATOM 31358 H1 WAT 5420 19.590 10.496 91.086 1.00 0.00 H ATOM 31359 H2 WAT 5420 20.770 10.334 92.021 1.00 0.00 H TER 31361 WAT 5420 ATOM 31361 O WAT 5421 54.622 90.052 0.732 1.00 0.00 O ATOM 31362 H1 WAT 5421 55.267 90.234 1.416 1.00 0.00 H ATOM 31363 H2 WAT 5421 55.003 89.332 0.229 1.00 0.00 H TER 31365 WAT 5421 ATOM 31365 O WAT 5422 34.470 92.330 124.696 1.00 0.00 O ATOM 31366 H1 WAT 5422 33.900 91.992 125.387 1.00 0.00 H ATOM 31367 H2 WAT 5422 35.098 92.888 125.155 1.00 0.00 H TER 31369 WAT 5422 ATOM 31369 O WAT 5423 15.185 75.826 61.489 1.00 0.00 O ATOM 31370 H1 WAT 5423 15.808 76.039 60.794 1.00 0.00 H ATOM 31371 H2 WAT 5423 15.187 76.597 62.056 1.00 0.00 H TER 31373 WAT 5423 ATOM 31373 O WAT 5424 34.265 79.494 157.913 1.00 0.00 O ATOM 31374 H1 WAT 5424 33.603 79.869 158.494 1.00 0.00 H ATOM 31375 H2 WAT 5424 33.971 78.596 157.761 1.00 0.00 H TER 31377 WAT 5424 ATOM 31377 O WAT 5425 25.267 101.403 60.188 1.00 0.00 O ATOM 31378 H1 WAT 5425 24.601 102.049 59.952 1.00 0.00 H ATOM 31379 H2 WAT 5425 24.933 100.995 60.986 1.00 0.00 H TER 31381 WAT 5425 ATOM 31381 O WAT 5426 5.765 100.077 18.182 1.00 0.00 O ATOM 31382 H1 WAT 5426 5.994 99.514 18.922 1.00 0.00 H ATOM 31383 H2 WAT 5426 5.474 99.470 17.501 1.00 0.00 H TER 31385 WAT 5426 ATOM 31385 O WAT 5427 117.583 12.145 96.617 1.00 0.00 O ATOM 31386 H1 WAT 5427 117.794 11.247 96.361 1.00 0.00 H ATOM 31387 H2 WAT 5427 117.632 12.644 95.802 1.00 0.00 H TER 31389 WAT 5427 ATOM 31389 O WAT 5428 5.281 118.148 67.442 1.00 0.00 O ATOM 31390 H1 WAT 5428 4.935 117.679 68.202 1.00 0.00 H ATOM 31391 H2 WAT 5428 6.204 117.898 67.407 1.00 0.00 H TER 31393 WAT 5428 ATOM 31393 O WAT 5429 82.951 95.683 122.348 1.00 0.00 O ATOM 31394 H1 WAT 5429 82.316 96.129 122.909 1.00 0.00 H ATOM 31395 H2 WAT 5429 82.865 94.758 122.578 1.00 0.00 H TER 31397 WAT 5429 ATOM 31397 O WAT 5430 37.486 15.296 104.199 1.00 0.00 O ATOM 31398 H1 WAT 5430 37.957 15.439 105.019 1.00 0.00 H ATOM 31399 H2 WAT 5430 37.972 15.806 103.551 1.00 0.00 H TER 31401 WAT 5430 ATOM 31401 O WAT 5431 116.390 55.868 149.766 1.00 0.00 O ATOM 31402 H1 WAT 5431 115.443 55.994 149.705 1.00 0.00 H ATOM 31403 H2 WAT 5431 116.509 55.328 150.548 1.00 0.00 H TER 31405 WAT 5431 ATOM 31405 O WAT 5432 87.646 86.227 134.377 1.00 0.00 O ATOM 31406 H1 WAT 5432 86.811 85.839 134.113 1.00 0.00 H ATOM 31407 H2 WAT 5432 87.521 87.168 134.256 1.00 0.00 H TER 31409 WAT 5432 ATOM 31409 O WAT 5433 90.567 18.842 110.974 1.00 0.00 O ATOM 31410 H1 WAT 5433 90.920 19.072 110.114 1.00 0.00 H ATOM 31411 H2 WAT 5433 89.648 18.633 110.808 1.00 0.00 H TER 31413 WAT 5433 ATOM 31413 O WAT 5434 94.613 4.301 109.964 1.00 0.00 O ATOM 31414 H1 WAT 5434 94.364 4.849 110.708 1.00 0.00 H ATOM 31415 H2 WAT 5434 93.843 3.756 109.800 1.00 0.00 H TER 31417 WAT 5434 ATOM 31417 O WAT 5435 121.482 8.310 109.007 1.00 0.00 O ATOM 31418 H1 WAT 5435 121.389 8.938 109.724 1.00 0.00 H ATOM 31419 H2 WAT 5435 121.084 8.746 108.254 1.00 0.00 H TER 31421 WAT 5435 ATOM 31421 O WAT 5436 91.034 25.430 140.555 1.00 0.00 O ATOM 31422 H1 WAT 5436 91.210 24.507 140.736 1.00 0.00 H ATOM 31423 H2 WAT 5436 90.636 25.760 141.361 1.00 0.00 H TER 31425 WAT 5436 ATOM 31425 O WAT 5437 121.461 115.543 88.067 1.00 0.00 O ATOM 31426 H1 WAT 5437 122.256 115.334 87.575 1.00 0.00 H ATOM 31427 H2 WAT 5437 121.202 114.712 88.466 1.00 0.00 H TER 31429 WAT 5437 ATOM 31429 O WAT 5438 16.677 67.397 105.223 1.00 0.00 O ATOM 31430 H1 WAT 5438 17.092 68.156 105.633 1.00 0.00 H ATOM 31431 H2 WAT 5438 16.273 66.923 105.950 1.00 0.00 H TER 31433 WAT 5438 ATOM 31433 O WAT 5439 108.500 9.785 148.011 1.00 0.00 O ATOM 31434 H1 WAT 5439 108.074 9.000 148.355 1.00 0.00 H ATOM 31435 H2 WAT 5439 109.411 9.525 147.879 1.00 0.00 H TER 31437 WAT 5439 ATOM 31437 O WAT 5440 62.996 111.577 8.916 1.00 0.00 O ATOM 31438 H1 WAT 5440 63.119 112.525 8.977 1.00 0.00 H ATOM 31439 H2 WAT 5440 62.382 111.369 9.620 1.00 0.00 H TER 31441 WAT 5440 ATOM 31441 O WAT 5441 4.678 127.556 21.321 1.00 0.00 O ATOM 31442 H1 WAT 5441 4.413 126.676 21.588 1.00 0.00 H ATOM 31443 H2 WAT 5441 4.156 127.737 20.539 1.00 0.00 H TER 31445 WAT 5441 ATOM 31445 O WAT 5442 3.749 106.319 11.674 1.00 0.00 O ATOM 31446 H1 WAT 5442 3.449 105.429 11.861 1.00 0.00 H ATOM 31447 H2 WAT 5442 3.005 106.876 11.905 1.00 0.00 H TER 31449 WAT 5442 ATOM 31449 O WAT 5443 69.788 88.585 134.214 1.00 0.00 O ATOM 31450 H1 WAT 5443 69.392 88.987 133.441 1.00 0.00 H ATOM 31451 H2 WAT 5443 70.150 89.322 134.707 1.00 0.00 H TER 31453 WAT 5443 ATOM 31453 O WAT 5444 21.381 136.573 9.315 1.00 0.00 O ATOM 31454 H1 WAT 5444 21.424 136.431 8.369 1.00 0.00 H ATOM 31455 H2 WAT 5444 22.168 137.080 9.517 1.00 0.00 H TER 31457 WAT 5444 ATOM 31457 O WAT 5445 20.550 21.419 85.271 1.00 0.00 O ATOM 31458 H1 WAT 5445 21.399 21.691 84.920 1.00 0.00 H ATOM 31459 H2 WAT 5445 20.234 20.764 84.649 1.00 0.00 H TER 31461 WAT 5445 ATOM 31461 O WAT 5446 139.506 98.651 12.284 1.00 0.00 O ATOM 31462 H1 WAT 5446 140.279 98.945 12.766 1.00 0.00 H ATOM 31463 H2 WAT 5446 139.209 99.428 11.811 1.00 0.00 H TER 31465 WAT 5446 ATOM 31465 O WAT 5447 108.843 39.571 58.812 1.00 0.00 O ATOM 31466 H1 WAT 5447 108.787 38.619 58.890 1.00 0.00 H ATOM 31467 H2 WAT 5447 109.416 39.717 58.059 1.00 0.00 H TER 31469 WAT 5447 ATOM 31469 O WAT 5448 118.854 129.036 15.895 1.00 0.00 O ATOM 31470 H1 WAT 5448 118.579 129.512 15.111 1.00 0.00 H ATOM 31471 H2 WAT 5448 119.555 129.572 16.266 1.00 0.00 H TER 31473 WAT 5448 ATOM 31473 O WAT 5449 132.651 45.423 22.789 1.00 0.00 O ATOM 31474 H1 WAT 5449 132.378 44.954 23.577 1.00 0.00 H ATOM 31475 H2 WAT 5449 132.300 44.902 22.066 1.00 0.00 H TER 31477 WAT 5449 ATOM 31477 O WAT 5450 34.547 103.518 133.675 1.00 0.00 O ATOM 31478 H1 WAT 5450 34.642 104.470 133.639 1.00 0.00 H ATOM 31479 H2 WAT 5450 35.142 103.192 132.999 1.00 0.00 H TER 31481 WAT 5450 ATOM 31481 O WAT 5451 66.632 54.820 59.646 1.00 0.00 O ATOM 31482 H1 WAT 5451 66.708 53.951 60.042 1.00 0.00 H ATOM 31483 H2 WAT 5451 66.844 55.426 60.356 1.00 0.00 H TER 31485 WAT 5451 ATOM 31485 O WAT 5452 68.019 71.193 140.576 1.00 0.00 O ATOM 31486 H1 WAT 5452 67.122 71.342 140.277 1.00 0.00 H ATOM 31487 H2 WAT 5452 68.142 71.821 141.288 1.00 0.00 H TER 31489 WAT 5452 ATOM 31489 O WAT 5453 88.644 77.926 111.599 1.00 0.00 O ATOM 31490 H1 WAT 5453 88.278 77.626 112.431 1.00 0.00 H ATOM 31491 H2 WAT 5453 87.994 78.541 111.259 1.00 0.00 H TER 31493 WAT 5453 ATOM 31493 O WAT 5454 11.853 84.600 98.427 1.00 0.00 O ATOM 31494 H1 WAT 5454 12.005 84.628 99.371 1.00 0.00 H ATOM 31495 H2 WAT 5454 12.722 84.465 98.048 1.00 0.00 H TER 31497 WAT 5454 ATOM 31497 O WAT 5455 60.203 100.058 98.710 1.00 0.00 O ATOM 31498 H1 WAT 5455 60.708 99.511 99.312 1.00 0.00 H ATOM 31499 H2 WAT 5455 59.351 99.626 98.651 1.00 0.00 H TER 31501 WAT 5455 ATOM 31501 O WAT 5456 76.802 14.754 92.835 1.00 0.00 O ATOM 31502 H1 WAT 5456 76.559 14.500 91.945 1.00 0.00 H ATOM 31503 H2 WAT 5456 76.202 14.264 93.397 1.00 0.00 H TER 31505 WAT 5456 ATOM 31505 O WAT 5457 107.636 114.854 18.370 1.00 0.00 O ATOM 31506 H1 WAT 5457 106.752 115.074 18.663 1.00 0.00 H ATOM 31507 H2 WAT 5457 107.961 114.241 19.029 1.00 0.00 H TER 31509 WAT 5457 ATOM 31509 O WAT 5458 100.709 28.524 71.636 1.00 0.00 O ATOM 31510 H1 WAT 5458 101.013 27.653 71.380 1.00 0.00 H ATOM 31511 H2 WAT 5458 100.507 28.442 72.568 1.00 0.00 H TER 31513 WAT 5458 ATOM 31513 O WAT 5459 16.351 136.225 131.472 1.00 0.00 O ATOM 31514 H1 WAT 5459 16.879 136.523 132.212 1.00 0.00 H ATOM 31515 H2 WAT 5459 15.811 135.521 131.832 1.00 0.00 H TER 31517 WAT 5459 ATOM 31517 O WAT 5460 98.663 27.829 143.379 1.00 0.00 O ATOM 31518 H1 WAT 5460 99.057 28.438 144.004 1.00 0.00 H ATOM 31519 H2 WAT 5460 98.811 26.964 143.761 1.00 0.00 H TER 31521 WAT 5460 ATOM 31521 O WAT 5461 62.736 31.123 107.827 1.00 0.00 O ATOM 31522 H1 WAT 5461 63.413 31.034 108.498 1.00 0.00 H ATOM 31523 H2 WAT 5461 62.515 32.055 107.832 1.00 0.00 H TER 31525 WAT 5461 ATOM 31525 O WAT 5462 58.895 93.731 151.587 1.00 0.00 O ATOM 31526 H1 WAT 5462 58.113 94.274 151.685 1.00 0.00 H ATOM 31527 H2 WAT 5462 58.810 93.062 152.266 1.00 0.00 H TER 31529 WAT 5462 ATOM 31529 O WAT 5463 46.510 82.325 65.167 1.00 0.00 O ATOM 31530 H1 WAT 5463 46.318 81.458 65.524 1.00 0.00 H ATOM 31531 H2 WAT 5463 45.679 82.619 64.792 1.00 0.00 H TER 31533 WAT 5463 ATOM 31533 O WAT 5464 82.107 108.504 96.603 1.00 0.00 O ATOM 31534 H1 WAT 5464 82.438 107.619 96.759 1.00 0.00 H ATOM 31535 H2 WAT 5464 81.486 108.656 97.315 1.00 0.00 H TER 31537 WAT 5464 ATOM 31537 O WAT 5465 108.979 66.646 64.234 1.00 0.00 O ATOM 31538 H1 WAT 5465 108.069 66.891 64.401 1.00 0.00 H ATOM 31539 H2 WAT 5465 108.936 66.080 63.464 1.00 0.00 H TER 31541 WAT 5465 ATOM 31541 O WAT 5466 14.355 48.307 119.976 1.00 0.00 O ATOM 31542 H1 WAT 5466 14.131 48.801 119.187 1.00 0.00 H ATOM 31543 H2 WAT 5466 15.288 48.472 120.106 1.00 0.00 H TER 31545 WAT 5466 ATOM 31545 O WAT 5467 143.770 117.583 65.869 1.00 0.00 O ATOM 31546 H1 WAT 5467 143.316 118.413 65.725 1.00 0.00 H ATOM 31547 H2 WAT 5467 143.156 116.917 65.560 1.00 0.00 H TER 31549 WAT 5467 ATOM 31549 O WAT 5468 107.907 43.936 72.319 1.00 0.00 O ATOM 31550 H1 WAT 5468 107.771 43.372 71.558 1.00 0.00 H ATOM 31551 H2 WAT 5468 107.928 44.823 71.959 1.00 0.00 H TER 31553 WAT 5468 ATOM 31553 O WAT 5469 47.614 140.335 69.884 1.00 0.00 O ATOM 31554 H1 WAT 5469 46.661 140.251 69.916 1.00 0.00 H ATOM 31555 H2 WAT 5469 47.902 139.587 69.361 1.00 0.00 H TER 31557 WAT 5469 ATOM 31557 O WAT 5470 79.256 130.274 147.595 1.00 0.00 O ATOM 31558 H1 WAT 5470 78.597 129.866 147.034 1.00 0.00 H ATOM 31559 H2 WAT 5470 79.271 129.730 148.383 1.00 0.00 H TER 31561 WAT 5470 ATOM 31561 O WAT 5471 43.866 31.579 140.648 1.00 0.00 O ATOM 31562 H1 WAT 5471 44.055 32.501 140.473 1.00 0.00 H ATOM 31563 H2 WAT 5471 42.913 31.540 140.725 1.00 0.00 H TER 31565 WAT 5471 ATOM 31565 O WAT 5472 72.167 61.516 76.949 1.00 0.00 O ATOM 31566 H1 WAT 5472 71.511 62.162 77.210 1.00 0.00 H ATOM 31567 H2 WAT 5472 71.736 60.671 77.080 1.00 0.00 H TER 31569 WAT 5472 ATOM 31569 O WAT 5473 132.746 87.215 80.562 1.00 0.00 O ATOM 31570 H1 WAT 5473 133.506 87.135 81.138 1.00 0.00 H ATOM 31571 H2 WAT 5473 132.235 86.422 80.728 1.00 0.00 H TER 31573 WAT 5473 ATOM 31573 O WAT 5474 46.809 66.884 13.021 1.00 0.00 O ATOM 31574 H1 WAT 5474 47.295 66.230 13.522 1.00 0.00 H ATOM 31575 H2 WAT 5474 47.059 66.724 12.111 1.00 0.00 H TER 31577 WAT 5474 ATOM 31577 O WAT 5475 32.941 15.523 107.425 1.00 0.00 O ATOM 31578 H1 WAT 5475 32.322 15.398 108.144 1.00 0.00 H ATOM 31579 H2 WAT 5475 32.605 14.968 106.720 1.00 0.00 H TER 31581 WAT 5475 ATOM 31581 O WAT 5476 9.181 137.476 116.275 1.00 0.00 O ATOM 31582 H1 WAT 5476 9.876 137.938 116.744 1.00 0.00 H ATOM 31583 H2 WAT 5476 9.319 137.705 115.356 1.00 0.00 H TER 31585 WAT 5476 ATOM 31585 O WAT 5477 80.082 106.853 115.644 1.00 0.00 O ATOM 31586 H1 WAT 5477 79.531 107.427 116.176 1.00 0.00 H ATOM 31587 H2 WAT 5477 79.462 106.349 115.116 1.00 0.00 H TER 31589 WAT 5477 ATOM 31589 O WAT 5478 85.853 139.702 134.974 1.00 0.00 O ATOM 31590 H1 WAT 5478 85.754 140.124 134.120 1.00 0.00 H ATOM 31591 H2 WAT 5478 85.243 140.171 135.544 1.00 0.00 H TER 31593 WAT 5478 ATOM 31593 O WAT 5479 51.236 71.727 143.424 1.00 0.00 O ATOM 31594 H1 WAT 5479 51.901 72.401 143.287 1.00 0.00 H ATOM 31595 H2 WAT 5479 51.694 71.031 143.896 1.00 0.00 H TER 31597 WAT 5479 ATOM 31597 O WAT 5480 14.905 10.461 139.726 1.00 0.00 O ATOM 31598 H1 WAT 5480 14.712 11.384 139.896 1.00 0.00 H ATOM 31599 H2 WAT 5480 14.211 9.984 140.182 1.00 0.00 H TER 31601 WAT 5480 ATOM 31601 O WAT 5481 107.612 57.692 9.648 1.00 0.00 O ATOM 31602 H1 WAT 5481 108.014 58.121 10.404 1.00 0.00 H ATOM 31603 H2 WAT 5481 107.305 56.850 9.986 1.00 0.00 H TER 31605 WAT 5481 ATOM 31605 O WAT 5482 115.139 12.764 55.574 1.00 0.00 O ATOM 31606 H1 WAT 5482 114.253 12.402 55.555 1.00 0.00 H ATOM 31607 H2 WAT 5482 115.143 13.422 54.879 1.00 0.00 H TER 31609 WAT 5482 ATOM 31609 O WAT 5483 124.556 28.914 111.881 1.00 0.00 O ATOM 31610 H1 WAT 5483 125.187 29.629 111.793 1.00 0.00 H ATOM 31611 H2 WAT 5483 124.793 28.299 111.186 1.00 0.00 H TER 31613 WAT 5483 ATOM 31613 O WAT 5484 27.959 53.395 57.758 1.00 0.00 O ATOM 31614 H1 WAT 5484 27.189 53.034 57.320 1.00 0.00 H ATOM 31615 H2 WAT 5484 28.693 52.893 57.404 1.00 0.00 H TER 31617 WAT 5484 ATOM 31617 O WAT 5485 80.520 101.106 121.053 1.00 0.00 O ATOM 31618 H1 WAT 5485 79.899 100.523 120.618 1.00 0.00 H ATOM 31619 H2 WAT 5485 80.489 100.844 121.974 1.00 0.00 H TER 31621 WAT 5485 ATOM 31621 O WAT 5486 25.667 40.618 138.500 1.00 0.00 O ATOM 31622 H1 WAT 5486 24.852 41.115 138.423 1.00 0.00 H ATOM 31623 H2 WAT 5486 25.901 40.684 139.425 1.00 0.00 H TER 31625 WAT 5486 ATOM 31625 O WAT 5487 26.175 103.323 109.732 1.00 0.00 O ATOM 31626 H1 WAT 5487 25.769 103.091 110.568 1.00 0.00 H ATOM 31627 H2 WAT 5487 26.794 102.613 109.562 1.00 0.00 H TER 31629 WAT 5487 ATOM 31629 O WAT 5488 32.430 78.314 131.031 1.00 0.00 O ATOM 31630 H1 WAT 5488 31.725 77.784 131.402 1.00 0.00 H ATOM 31631 H2 WAT 5488 32.370 79.150 131.494 1.00 0.00 H TER 31633 WAT 5488 ATOM 31633 O WAT 5489 76.052 87.375 14.256 1.00 0.00 O ATOM 31634 H1 WAT 5489 76.082 87.759 13.380 1.00 0.00 H ATOM 31635 H2 WAT 5489 76.917 87.555 14.626 1.00 0.00 H TER 31637 WAT 5489 ATOM 31637 O WAT 5490 88.315 38.220 132.347 1.00 0.00 O ATOM 31638 H1 WAT 5490 88.468 38.190 133.292 1.00 0.00 H ATOM 31639 H2 WAT 5490 88.052 37.329 132.119 1.00 0.00 H TER 31641 WAT 5490 ATOM 31641 O WAT 5491 33.510 73.109 23.799 1.00 0.00 O ATOM 31642 H1 WAT 5491 33.375 73.951 23.364 1.00 0.00 H ATOM 31643 H2 WAT 5491 32.843 73.085 24.486 1.00 0.00 H TER 31645 WAT 5491 ATOM 31645 O WAT 5492 86.937 140.093 79.150 1.00 0.00 O ATOM 31646 H1 WAT 5492 86.059 140.452 79.276 1.00 0.00 H ATOM 31647 H2 WAT 5492 87.283 140.565 78.393 1.00 0.00 H TER 31649 WAT 5492 ATOM 31649 O WAT 5493 91.236 98.689 101.143 1.00 0.00 O ATOM 31650 H1 WAT 5493 92.105 98.460 100.813 1.00 0.00 H ATOM 31651 H2 WAT 5493 91.130 99.613 100.916 1.00 0.00 H TER 31653 WAT 5493 ATOM 31653 O WAT 5494 124.798 23.887 153.797 1.00 0.00 O ATOM 31654 H1 WAT 5494 124.769 24.826 153.980 1.00 0.00 H ATOM 31655 H2 WAT 5494 125.526 23.562 154.328 1.00 0.00 H TER 31657 WAT 5494 ATOM 31657 O WAT 5495 68.422 13.471 150.316 1.00 0.00 O ATOM 31658 H1 WAT 5495 67.575 13.664 150.717 1.00 0.00 H ATOM 31659 H2 WAT 5495 68.644 14.264 149.829 1.00 0.00 H TER 31661 WAT 5495 ATOM 31661 O WAT 5496 110.976 86.023 91.531 1.00 0.00 O ATOM 31662 H1 WAT 5496 110.431 85.243 91.425 1.00 0.00 H ATOM 31663 H2 WAT 5496 110.452 86.733 91.158 1.00 0.00 H TER 31665 WAT 5496 ATOM 31665 O WAT 5497 120.168 120.090 11.363 1.00 0.00 O ATOM 31666 H1 WAT 5497 120.631 119.825 10.568 1.00 0.00 H ATOM 31667 H2 WAT 5497 120.776 120.680 11.808 1.00 0.00 H TER 31669 WAT 5497 ATOM 31669 O WAT 5498 65.441 44.235 141.187 1.00 0.00 O ATOM 31670 H1 WAT 5498 66.259 44.559 141.564 1.00 0.00 H ATOM 31671 H2 WAT 5498 65.465 44.526 140.276 1.00 0.00 H TER 31673 WAT 5498 ATOM 31673 O WAT 5499 142.831 100.053 9.587 1.00 0.00 O ATOM 31674 H1 WAT 5499 142.869 99.370 10.256 1.00 0.00 H ATOM 31675 H2 WAT 5499 143.574 100.623 9.785 1.00 0.00 H TER 31677 WAT 5499 ATOM 31677 O WAT 5500 85.303 130.859 106.676 1.00 0.00 O ATOM 31678 H1 WAT 5500 84.854 130.317 107.324 1.00 0.00 H ATOM 31679 H2 WAT 5500 84.683 131.563 106.481 1.00 0.00 H TER 31681 WAT 5500 ATOM 31681 O WAT 5501 29.024 63.866 107.900 1.00 0.00 O ATOM 31682 H1 WAT 5501 29.740 64.493 107.802 1.00 0.00 H ATOM 31683 H2 WAT 5501 28.230 64.386 107.774 1.00 0.00 H TER 31685 WAT 5501 ATOM 31685 O WAT 5502 107.972 120.594 16.360 1.00 0.00 O ATOM 31686 H1 WAT 5502 108.740 120.155 16.724 1.00 0.00 H ATOM 31687 H2 WAT 5502 107.291 120.476 17.022 1.00 0.00 H TER 31689 WAT 5502 ATOM 31689 O WAT 5503 130.021 12.918 134.247 1.00 0.00 O ATOM 31690 H1 WAT 5503 129.408 13.029 134.973 1.00 0.00 H ATOM 31691 H2 WAT 5503 130.060 11.972 134.108 1.00 0.00 H TER 31693 WAT 5503 ATOM 31693 O WAT 5504 126.899 95.151 72.777 1.00 0.00 O ATOM 31694 H1 WAT 5504 126.394 95.442 72.017 1.00 0.00 H ATOM 31695 H2 WAT 5504 127.287 95.953 73.127 1.00 0.00 H TER 31697 WAT 5504 ATOM 31697 O WAT 5505 7.526 143.382 109.689 1.00 0.00 O ATOM 31698 H1 WAT 5505 6.602 143.138 109.746 1.00 0.00 H ATOM 31699 H2 WAT 5505 7.671 143.557 108.759 1.00 0.00 H TER 31701 WAT 5505 ATOM 31701 O WAT 5506 1.449 127.632 123.996 1.00 0.00 O ATOM 31702 H1 WAT 5506 2.033 127.506 123.249 1.00 0.00 H ATOM 31703 H2 WAT 5506 1.956 127.332 124.750 1.00 0.00 H TER 31705 WAT 5506 ATOM 31705 O WAT 5507 145.107 22.061 140.828 1.00 0.00 O ATOM 31706 H1 WAT 5507 145.069 21.107 140.900 1.00 0.00 H ATOM 31707 H2 WAT 5507 144.910 22.239 139.908 1.00 0.00 H TER 31709 WAT 5507 ATOM 31709 O WAT 5508 26.783 44.304 92.134 1.00 0.00 O ATOM 31710 H1 WAT 5508 27.076 44.684 91.307 1.00 0.00 H ATOM 31711 H2 WAT 5508 27.580 44.224 92.658 1.00 0.00 H TER 31713 WAT 5508 ATOM 31713 O WAT 5509 143.311 7.848 106.956 1.00 0.00 O ATOM 31714 H1 WAT 5509 143.727 8.457 106.346 1.00 0.00 H ATOM 31715 H2 WAT 5509 143.773 7.984 107.783 1.00 0.00 H TER 31717 WAT 5509 ATOM 31717 O WAT 5510 137.253 70.080 149.040 1.00 0.00 O ATOM 31718 H1 WAT 5510 137.668 70.022 148.179 1.00 0.00 H ATOM 31719 H2 WAT 5510 136.614 70.787 148.952 1.00 0.00 H TER 31721 WAT 5510 ATOM 31721 O WAT 5511 43.746 12.321 151.983 1.00 0.00 O ATOM 31722 H1 WAT 5511 43.084 13.013 151.981 1.00 0.00 H ATOM 31723 H2 WAT 5511 43.796 12.040 152.897 1.00 0.00 H TER 31725 WAT 5511 ATOM 31725 O WAT 5512 90.181 97.459 19.898 1.00 0.00 O ATOM 31726 H1 WAT 5512 89.543 97.959 19.389 1.00 0.00 H ATOM 31727 H2 WAT 5512 90.723 98.124 20.323 1.00 0.00 H TER 31729 WAT 5512 ATOM 31729 O WAT 5513 34.149 107.433 135.901 1.00 0.00 O ATOM 31730 H1 WAT 5513 34.221 107.430 136.855 1.00 0.00 H ATOM 31731 H2 WAT 5513 33.251 107.149 135.727 1.00 0.00 H TER 31733 WAT 5513 ATOM 31733 O WAT 5514 26.300 111.381 63.507 1.00 0.00 O ATOM 31734 H1 WAT 5514 27.160 111.687 63.795 1.00 0.00 H ATOM 31735 H2 WAT 5514 25.773 111.361 64.306 1.00 0.00 H TER 31737 WAT 5514 ATOM 31737 O WAT 5515 98.849 126.242 69.103 1.00 0.00 O ATOM 31738 H1 WAT 5515 98.798 126.159 70.056 1.00 0.00 H ATOM 31739 H2 WAT 5515 98.772 125.344 68.780 1.00 0.00 H TER 31741 WAT 5515 ATOM 31741 O WAT 5516 103.504 92.763 103.866 1.00 0.00 O ATOM 31742 H1 WAT 5516 103.522 93.715 103.965 1.00 0.00 H ATOM 31743 H2 WAT 5516 104.228 92.451 104.409 1.00 0.00 H TER 31745 WAT 5516 ATOM 31745 O WAT 5517 130.637 69.631 128.636 1.00 0.00 O ATOM 31746 H1 WAT 5517 130.698 70.464 128.167 1.00 0.00 H ATOM 31747 H2 WAT 5517 131.155 69.765 129.430 1.00 0.00 H TER 31749 WAT 5517 ATOM 31749 O WAT 5518 89.897 127.471 125.985 1.00 0.00 O ATOM 31750 H1 WAT 5518 90.100 126.754 125.385 1.00 0.00 H ATOM 31751 H2 WAT 5518 90.741 127.891 126.151 1.00 0.00 H TER 31753 WAT 5518 ATOM 31753 O WAT 5519 85.280 87.996 98.495 1.00 0.00 O ATOM 31754 H1 WAT 5519 85.954 88.459 98.994 1.00 0.00 H ATOM 31755 H2 WAT 5519 85.696 87.173 98.239 1.00 0.00 H TER 31757 WAT 5519 ATOM 31757 O WAT 5520 61.607 101.157 10.292 1.00 0.00 O ATOM 31758 H1 WAT 5520 60.715 100.816 10.365 1.00 0.00 H ATOM 31759 H2 WAT 5520 61.850 100.999 9.380 1.00 0.00 H TER 31761 WAT 5520 ATOM 31761 O WAT 5521 19.736 68.605 144.446 1.00 0.00 O ATOM 31762 H1 WAT 5521 19.669 67.654 144.524 1.00 0.00 H ATOM 31763 H2 WAT 5521 19.649 68.926 145.343 1.00 0.00 H TER 31765 WAT 5521 ATOM 31765 O WAT 5522 69.600 82.137 151.315 1.00 0.00 O ATOM 31766 H1 WAT 5522 69.568 83.061 151.565 1.00 0.00 H ATOM 31767 H2 WAT 5522 69.443 82.139 150.371 1.00 0.00 H TER 31769 WAT 5522 ATOM 31769 O WAT 5523 76.947 45.981 123.975 1.00 0.00 O ATOM 31770 H1 WAT 5523 77.375 45.126 124.017 1.00 0.00 H ATOM 31771 H2 WAT 5523 77.387 46.502 124.647 1.00 0.00 H TER 31773 WAT 5523 ATOM 31773 O WAT 5524 112.378 128.573 134.643 1.00 0.00 O ATOM 31774 H1 WAT 5524 111.679 128.271 135.223 1.00 0.00 H ATOM 31775 H2 WAT 5524 112.542 127.832 134.059 1.00 0.00 H TER 31777 WAT 5524 ATOM 31777 O WAT 5525 143.304 14.384 17.177 1.00 0.00 O ATOM 31778 H1 WAT 5525 143.761 14.904 16.516 1.00 0.00 H ATOM 31779 H2 WAT 5525 143.790 14.543 17.985 1.00 0.00 H TER 31781 WAT 5525 ATOM 31781 O WAT 5526 103.024 24.537 91.947 1.00 0.00 O ATOM 31782 H1 WAT 5526 102.855 24.854 92.834 1.00 0.00 H ATOM 31783 H2 WAT 5526 103.331 25.309 91.472 1.00 0.00 H TER 31785 WAT 5526 ATOM 31785 O WAT 5527 58.498 31.568 151.233 1.00 0.00 O ATOM 31786 H1 WAT 5527 58.392 31.670 152.179 1.00 0.00 H ATOM 31787 H2 WAT 5527 57.633 31.766 150.873 1.00 0.00 H TER 31789 WAT 5527 ATOM 31789 O WAT 5528 69.102 69.448 79.390 1.00 0.00 O ATOM 31790 H1 WAT 5528 68.872 69.019 80.215 1.00 0.00 H ATOM 31791 H2 WAT 5528 69.161 70.378 79.612 1.00 0.00 H TER 31793 WAT 5528 ATOM 31793 O WAT 5529 100.461 33.133 6.850 1.00 0.00 O ATOM 31794 H1 WAT 5529 101.114 33.833 6.881 1.00 0.00 H ATOM 31795 H2 WAT 5529 100.968 32.340 6.678 1.00 0.00 H TER 31797 WAT 5529 ATOM 31797 O WAT 5530 123.081 91.339 104.457 1.00 0.00 O ATOM 31798 H1 WAT 5530 122.619 90.703 105.004 1.00 0.00 H ATOM 31799 H2 WAT 5530 123.128 90.925 103.596 1.00 0.00 H TER 31801 WAT 5530 ATOM 31801 O WAT 5531 3.564 128.410 11.473 1.00 0.00 O ATOM 31802 H1 WAT 5531 4.009 129.229 11.255 1.00 0.00 H ATOM 31803 H2 WAT 5531 3.682 127.860 10.698 1.00 0.00 H TER 31805 WAT 5531 ATOM 31805 O WAT 5532 118.074 50.809 22.929 1.00 0.00 O ATOM 31806 H1 WAT 5532 117.565 51.414 22.389 1.00 0.00 H ATOM 31807 H2 WAT 5532 117.484 50.570 23.643 1.00 0.00 H TER 31809 WAT 5532 ATOM 31809 O WAT 5533 39.921 88.568 87.871 1.00 0.00 O ATOM 31810 H1 WAT 5533 39.832 89.124 87.097 1.00 0.00 H ATOM 31811 H2 WAT 5533 39.386 88.997 88.538 1.00 0.00 H TER 31813 WAT 5533 ATOM 31813 O WAT 5534 5.343 109.627 95.871 1.00 0.00 O ATOM 31814 H1 WAT 5534 5.627 110.339 95.298 1.00 0.00 H ATOM 31815 H2 WAT 5534 4.655 110.015 96.412 1.00 0.00 H TER 31817 WAT 5534 ATOM 31817 O WAT 5535 37.693 79.965 88.809 1.00 0.00 O ATOM 31818 H1 WAT 5535 37.275 80.250 89.621 1.00 0.00 H ATOM 31819 H2 WAT 5535 37.991 79.074 88.992 1.00 0.00 H TER 31821 WAT 5535 ATOM 31821 O WAT 5536 43.496 112.857 132.316 1.00 0.00 O ATOM 31822 H1 WAT 5536 44.131 113.520 132.047 1.00 0.00 H ATOM 31823 H2 WAT 5536 42.699 113.080 131.835 1.00 0.00 H TER 31825 WAT 5536 ATOM 31825 O WAT 5537 82.304 58.230 133.305 1.00 0.00 O ATOM 31826 H1 WAT 5537 81.944 58.511 132.464 1.00 0.00 H ATOM 31827 H2 WAT 5537 81.771 57.474 133.552 1.00 0.00 H TER 31829 WAT 5537 ATOM 31829 O WAT 5538 77.396 24.518 143.531 1.00 0.00 O ATOM 31830 H1 WAT 5538 77.143 24.960 144.341 1.00 0.00 H ATOM 31831 H2 WAT 5538 76.714 23.860 143.394 1.00 0.00 H TER 31833 WAT 5538 ATOM 31833 O WAT 5539 4.545 130.940 10.916 1.00 0.00 O ATOM 31834 H1 WAT 5539 5.120 131.689 10.759 1.00 0.00 H ATOM 31835 H2 WAT 5539 3.746 131.146 10.430 1.00 0.00 H TER 31837 WAT 5539 ATOM 31837 O WAT 5540 112.208 56.299 141.503 1.00 0.00 O ATOM 31838 H1 WAT 5540 112.711 57.003 141.911 1.00 0.00 H ATOM 31839 H2 WAT 5540 111.777 55.857 142.235 1.00 0.00 H TER 31841 WAT 5540 ATOM 31841 O WAT 5541 27.491 75.047 2.476 1.00 0.00 O ATOM 31842 H1 WAT 5541 26.957 75.682 1.999 1.00 0.00 H ATOM 31843 H2 WAT 5541 27.707 74.379 1.826 1.00 0.00 H TER 31845 WAT 5541 ATOM 31845 O WAT 5542 95.752 95.450 148.874 1.00 0.00 O ATOM 31846 H1 WAT 5542 96.368 94.943 149.402 1.00 0.00 H ATOM 31847 H2 WAT 5542 96.177 96.300 148.760 1.00 0.00 H TER 31849 WAT 5542 ATOM 31849 O WAT 5543 99.379 6.800 12.155 1.00 0.00 O ATOM 31850 H1 WAT 5543 99.632 6.135 12.794 1.00 0.00 H ATOM 31851 H2 WAT 5543 98.511 7.087 12.438 1.00 0.00 H TER 31853 WAT 5543 ATOM 31853 O WAT 5544 56.039 54.485 58.628 1.00 0.00 O ATOM 31854 H1 WAT 5544 56.292 55.404 58.545 1.00 0.00 H ATOM 31855 H2 WAT 5544 56.784 54.070 59.062 1.00 0.00 H TER 31857 WAT 5544 ATOM 31857 O WAT 5545 64.512 119.784 75.952 1.00 0.00 O ATOM 31858 H1 WAT 5545 65.387 119.442 76.136 1.00 0.00 H ATOM 31859 H2 WAT 5545 63.986 119.007 75.763 1.00 0.00 H TER 31861 WAT 5545 ATOM 31861 O WAT 5546 115.339 14.772 93.096 1.00 0.00 O ATOM 31862 H1 WAT 5546 115.811 14.328 92.392 1.00 0.00 H ATOM 31863 H2 WAT 5546 115.250 15.675 92.793 1.00 0.00 H TER 31865 WAT 5546 ATOM 31865 O WAT 5547 138.729 65.187 156.245 1.00 0.00 O ATOM 31866 H1 WAT 5547 139.634 65.073 156.535 1.00 0.00 H ATOM 31867 H2 WAT 5547 138.412 65.942 156.741 1.00 0.00 H TER 31869 WAT 5547 ATOM 31869 O WAT 5548 91.986 70.428 155.561 1.00 0.00 O ATOM 31870 H1 WAT 5548 91.225 69.852 155.622 1.00 0.00 H ATOM 31871 H2 WAT 5548 92.514 70.054 154.855 1.00 0.00 H TER 31873 WAT 5548 ATOM 31873 O WAT 5549 18.645 37.454 86.804 1.00 0.00 O ATOM 31874 H1 WAT 5549 17.913 38.067 86.747 1.00 0.00 H ATOM 31875 H2 WAT 5549 18.466 36.803 86.124 1.00 0.00 H TER 31877 WAT 5549 ATOM 31877 O WAT 5550 21.896 93.006 122.595 1.00 0.00 O ATOM 31878 H1 WAT 5550 21.337 93.635 123.052 1.00 0.00 H ATOM 31879 H2 WAT 5550 22.341 93.525 121.924 1.00 0.00 H TER 31881 WAT 5550 ATOM 31881 O WAT 5551 24.993 22.506 15.372 1.00 0.00 O ATOM 31882 H1 WAT 5551 25.082 23.092 14.620 1.00 0.00 H ATOM 31883 H2 WAT 5551 25.847 22.080 15.447 1.00 0.00 H TER 31885 WAT 5551 ATOM 31885 O WAT 5552 92.232 21.627 11.367 1.00 0.00 O ATOM 31886 H1 WAT 5552 92.593 21.255 12.172 1.00 0.00 H ATOM 31887 H2 WAT 5552 91.398 22.014 11.635 1.00 0.00 H TER 31889 WAT 5552 ATOM 31889 O WAT 5553 96.344 117.611 74.708 1.00 0.00 O ATOM 31890 H1 WAT 5553 96.267 118.564 74.654 1.00 0.00 H ATOM 31891 H2 WAT 5553 96.242 117.415 75.639 1.00 0.00 H TER 31893 WAT 5553 ATOM 31893 O WAT 5554 80.822 101.421 5.088 1.00 0.00 O ATOM 31894 H1 WAT 5554 81.691 101.811 4.992 1.00 0.00 H ATOM 31895 H2 WAT 5554 80.352 101.684 4.297 1.00 0.00 H TER 31897 WAT 5554 ATOM 31897 O WAT 5555 125.692 143.474 14.267 1.00 0.00 O ATOM 31898 H1 WAT 5555 125.376 144.044 13.566 1.00 0.00 H ATOM 31899 H2 WAT 5555 124.965 143.434 14.888 1.00 0.00 H TER 31901 WAT 5555 ATOM 31901 O WAT 5556 135.461 69.724 95.762 1.00 0.00 O ATOM 31902 H1 WAT 5556 136.064 68.987 95.663 1.00 0.00 H ATOM 31903 H2 WAT 5556 136.030 70.485 95.874 1.00 0.00 H TER 31905 WAT 5556 ATOM 31905 O WAT 5557 47.549 138.081 94.870 1.00 0.00 O ATOM 31906 H1 WAT 5557 47.083 137.392 94.396 1.00 0.00 H ATOM 31907 H2 WAT 5557 48.288 138.304 94.303 1.00 0.00 H TER 31909 WAT 5557 ATOM 31909 O WAT 5558 98.366 31.004 152.899 1.00 0.00 O ATOM 31910 H1 WAT 5558 98.218 30.105 152.606 1.00 0.00 H ATOM 31911 H2 WAT 5558 99.052 31.335 152.320 1.00 0.00 H TER 31913 WAT 5558 ATOM 31913 O WAT 5559 24.445 75.224 124.709 1.00 0.00 O ATOM 31914 H1 WAT 5559 23.906 75.975 124.462 1.00 0.00 H ATOM 31915 H2 WAT 5559 24.117 74.505 124.169 1.00 0.00 H TER 31917 WAT 5559 ATOM 31917 O WAT 5560 145.647 27.849 127.054 1.00 0.00 O ATOM 31918 H1 WAT 5560 145.039 27.873 127.793 1.00 0.00 H ATOM 31919 H2 WAT 5560 146.393 28.376 127.340 1.00 0.00 H TER 31921 WAT 5560 ATOM 31921 O WAT 5561 48.433 47.897 147.820 1.00 0.00 O ATOM 31922 H1 WAT 5561 49.158 47.279 147.915 1.00 0.00 H ATOM 31923 H2 WAT 5561 47.869 47.503 147.154 1.00 0.00 H TER 31925 WAT 5561 ATOM 31925 O WAT 5562 12.688 42.238 140.367 1.00 0.00 O ATOM 31926 H1 WAT 5562 13.592 42.077 140.095 1.00 0.00 H ATOM 31927 H2 WAT 5562 12.584 41.724 141.168 1.00 0.00 H TER 31929 WAT 5562 ATOM 31929 O WAT 5563 75.977 122.002 76.711 1.00 0.00 O ATOM 31930 H1 WAT 5563 75.232 122.304 76.193 1.00 0.00 H ATOM 31931 H2 WAT 5563 75.719 121.134 77.020 1.00 0.00 H TER 31933 WAT 5563 ATOM 31933 O WAT 5564 42.967 115.496 119.055 1.00 0.00 O ATOM 31934 H1 WAT 5564 42.792 114.569 119.217 1.00 0.00 H ATOM 31935 H2 WAT 5564 43.210 115.536 118.131 1.00 0.00 H TER 31937 WAT 5564 ATOM 31937 O WAT 5565 23.689 145.062 131.774 1.00 0.00 O ATOM 31938 H1 WAT 5565 24.135 145.870 131.517 1.00 0.00 H ATOM 31939 H2 WAT 5565 23.706 145.074 132.730 1.00 0.00 H TER 31941 WAT 5565 ATOM 31941 O WAT 5566 79.491 122.029 103.470 1.00 0.00 O ATOM 31942 H1 WAT 5566 80.272 122.107 104.019 1.00 0.00 H ATOM 31943 H2 WAT 5566 79.829 122.009 102.575 1.00 0.00 H TER 31945 WAT 5566 ATOM 31945 O WAT 5567 108.562 12.274 141.653 1.00 0.00 O ATOM 31946 H1 WAT 5567 108.442 12.499 142.575 1.00 0.00 H ATOM 31947 H2 WAT 5567 108.451 13.104 141.188 1.00 0.00 H TER 31949 WAT 5567 ATOM 31949 O WAT 5568 125.059 122.284 13.918 1.00 0.00 O ATOM 31950 H1 WAT 5568 125.432 123.138 13.696 1.00 0.00 H ATOM 31951 H2 WAT 5568 125.382 121.697 13.234 1.00 0.00 H TER 31953 WAT 5568 ATOM 31953 O WAT 5569 106.238 91.753 154.938 1.00 0.00 O ATOM 31954 H1 WAT 5569 107.124 91.643 155.283 1.00 0.00 H ATOM 31955 H2 WAT 5569 105.762 92.202 155.637 1.00 0.00 H TER 31957 WAT 5569 ATOM 31957 O WAT 5570 54.677 116.453 150.555 1.00 0.00 O ATOM 31958 H1 WAT 5570 54.309 116.455 151.439 1.00 0.00 H ATOM 31959 H2 WAT 5570 54.550 117.349 150.241 1.00 0.00 H TER 31961 WAT 5570 ATOM 31961 O WAT 5571 102.903 95.675 150.458 1.00 0.00 O ATOM 31962 H1 WAT 5571 102.813 95.662 151.411 1.00 0.00 H ATOM 31963 H2 WAT 5571 103.388 96.479 150.274 1.00 0.00 H TER 31965 WAT 5571 ATOM 31965 O WAT 5572 42.723 17.205 142.591 1.00 0.00 O ATOM 31966 H1 WAT 5572 41.786 17.167 142.787 1.00 0.00 H ATOM 31967 H2 WAT 5572 42.852 18.071 142.205 1.00 0.00 H TER 31969 WAT 5572 ATOM 31969 O WAT 5573 5.776 145.025 101.639 1.00 0.00 O ATOM 31970 H1 WAT 5573 6.672 145.272 101.411 1.00 0.00 H ATOM 31971 H2 WAT 5573 5.832 144.738 102.551 1.00 0.00 H TER 31973 WAT 5573 ATOM 31973 O WAT 5574 47.094 144.910 0.956 1.00 0.00 O ATOM 31974 H1 WAT 5574 46.481 144.814 1.685 1.00 0.00 H ATOM 31975 H2 WAT 5574 47.845 144.369 1.201 1.00 0.00 H TER 31977 WAT 5574 ATOM 31977 O WAT 5575 22.570 123.290 149.804 1.00 0.00 O ATOM 31978 H1 WAT 5575 22.807 124.082 149.323 1.00 0.00 H ATOM 31979 H2 WAT 5575 22.288 122.674 149.128 1.00 0.00 H TER 31981 WAT 5575 ATOM 31981 O WAT 5576 120.340 1.722 82.409 1.00 0.00 O ATOM 31982 H1 WAT 5576 120.535 0.960 81.864 1.00 0.00 H ATOM 31983 H2 WAT 5576 119.577 2.125 81.995 1.00 0.00 H TER 31985 WAT 5576 ATOM 31985 O WAT 5577 143.218 85.985 31.625 1.00 0.00 O ATOM 31986 H1 WAT 5577 142.471 85.948 31.026 1.00 0.00 H ATOM 31987 H2 WAT 5577 143.011 85.343 32.304 1.00 0.00 H TER 31989 WAT 5577 ATOM 31989 O WAT 5578 109.260 16.955 105.958 1.00 0.00 O ATOM 31990 H1 WAT 5578 108.314 16.945 106.102 1.00 0.00 H ATOM 31991 H2 WAT 5578 109.357 17.039 105.010 1.00 0.00 H TER 31993 WAT 5578 ATOM 31993 O WAT 5579 13.707 101.135 92.964 1.00 0.00 O ATOM 31994 H1 WAT 5579 13.315 100.536 93.600 1.00 0.00 H ATOM 31995 H2 WAT 5579 14.365 101.618 93.464 1.00 0.00 H TER 31997 WAT 5579 ATOM 31997 O WAT 5580 104.251 85.115 9.515 1.00 0.00 O ATOM 31998 H1 WAT 5580 103.678 84.348 9.555 1.00 0.00 H ATOM 31999 H2 WAT 5580 105.045 84.845 9.977 1.00 0.00 H TER 32001 WAT 5580 ATOM 32001 O WAT 5581 40.875 59.674 124.925 1.00 0.00 O ATOM 32002 H1 WAT 5581 41.499 59.691 124.198 1.00 0.00 H ATOM 32003 H2 WAT 5581 41.132 60.412 125.478 1.00 0.00 H TER 32005 WAT 5581 ATOM 32005 O WAT 5582 12.021 99.786 123.762 1.00 0.00 O ATOM 32006 H1 WAT 5582 11.425 99.110 124.086 1.00 0.00 H ATOM 32007 H2 WAT 5582 11.534 100.604 123.866 1.00 0.00 H TER 32009 WAT 5582 ATOM 32009 O WAT 5583 54.099 72.770 18.484 1.00 0.00 O ATOM 32010 H1 WAT 5583 54.367 73.431 19.123 1.00 0.00 H ATOM 32011 H2 WAT 5583 53.770 72.044 19.013 1.00 0.00 H TER 32013 WAT 5583 ATOM 32013 O WAT 5584 58.856 17.019 121.349 1.00 0.00 O ATOM 32014 H1 WAT 5584 57.984 17.267 121.659 1.00 0.00 H ATOM 32015 H2 WAT 5584 59.404 17.779 121.545 1.00 0.00 H TER 32017 WAT 5584 ATOM 32017 O WAT 5585 93.089 114.016 144.507 1.00 0.00 O ATOM 32018 H1 WAT 5585 92.636 114.407 145.254 1.00 0.00 H ATOM 32019 H2 WAT 5585 92.680 114.419 143.742 1.00 0.00 H TER 32021 WAT 5585 ATOM 32021 O WAT 5586 104.383 24.090 138.372 1.00 0.00 O ATOM 32022 H1 WAT 5586 104.381 23.133 138.344 1.00 0.00 H ATOM 32023 H2 WAT 5586 103.940 24.354 137.565 1.00 0.00 H TER 32025 WAT 5586 ATOM 32025 O WAT 5587 40.580 45.231 146.138 1.00 0.00 O ATOM 32026 H1 WAT 5587 39.854 44.953 146.696 1.00 0.00 H ATOM 32027 H2 WAT 5587 40.788 46.115 146.439 1.00 0.00 H TER 32029 WAT 5587 ATOM 32029 O WAT 5588 0.360 34.736 150.228 1.00 0.00 O ATOM 32030 H1 WAT 5588 -0.401 34.301 150.612 1.00 0.00 H ATOM 32031 H2 WAT 5588 0.126 35.665 150.220 1.00 0.00 H TER 32033 WAT 5588 ATOM 32033 O WAT 5589 34.634 28.052 73.375 1.00 0.00 O ATOM 32034 H1 WAT 5589 35.261 28.230 72.674 1.00 0.00 H ATOM 32035 H2 WAT 5589 35.145 27.597 74.044 1.00 0.00 H TER 32037 WAT 5589 ATOM 32037 O WAT 5590 94.093 18.257 106.211 1.00 0.00 O ATOM 32038 H1 WAT 5590 94.411 17.464 106.643 1.00 0.00 H ATOM 32039 H2 WAT 5590 93.514 18.665 106.856 1.00 0.00 H TER 32041 WAT 5590 ATOM 32041 O WAT 5591 140.253 72.428 155.412 1.00 0.00 O ATOM 32042 H1 WAT 5591 140.231 71.642 154.866 1.00 0.00 H ATOM 32043 H2 WAT 5591 140.318 73.151 154.789 1.00 0.00 H TER 32045 WAT 5591 ATOM 32045 O WAT 5592 71.805 11.079 19.898 1.00 0.00 O ATOM 32046 H1 WAT 5592 72.689 11.081 20.265 1.00 0.00 H ATOM 32047 H2 WAT 5592 71.378 10.325 20.305 1.00 0.00 H TER 32049 WAT 5592 ATOM 32049 O WAT 5593 85.105 19.419 19.090 1.00 0.00 O ATOM 32050 H1 WAT 5593 85.737 18.701 19.124 1.00 0.00 H ATOM 32051 H2 WAT 5593 85.482 20.042 18.469 1.00 0.00 H TER 32053 WAT 5593 ATOM 32053 O WAT 5594 20.444 37.300 109.785 1.00 0.00 O ATOM 32054 H1 WAT 5594 20.537 38.083 109.243 1.00 0.00 H ATOM 32055 H2 WAT 5594 20.009 36.665 109.215 1.00 0.00 H TER 32057 WAT 5594 ATOM 32057 O WAT 5595 105.490 105.376 153.047 1.00 0.00 O ATOM 32058 H1 WAT 5595 105.559 106.057 152.378 1.00 0.00 H ATOM 32059 H2 WAT 5595 104.753 104.835 152.763 1.00 0.00 H TER 32061 WAT 5595 ATOM 32061 O WAT 5596 136.345 135.353 15.350 1.00 0.00 O ATOM 32062 H1 WAT 5596 135.585 134.909 15.727 1.00 0.00 H ATOM 32063 H2 WAT 5596 137.042 135.223 15.993 1.00 0.00 H TER 32065 WAT 5596 ATOM 32065 O WAT 5597 121.061 103.032 84.921 1.00 0.00 O ATOM 32066 H1 WAT 5597 121.334 103.945 84.823 1.00 0.00 H ATOM 32067 H2 WAT 5597 120.237 103.080 85.406 1.00 0.00 H TER 32069 WAT 5597 ATOM 32069 O WAT 5598 117.452 20.465 22.784 1.00 0.00 O ATOM 32070 H1 WAT 5598 116.576 20.643 22.441 1.00 0.00 H ATOM 32071 H2 WAT 5598 117.672 19.599 22.441 1.00 0.00 H TER 32073 WAT 5598 ATOM 32073 O WAT 5599 67.656 96.304 91.600 1.00 0.00 O ATOM 32074 H1 WAT 5599 68.437 96.466 92.130 1.00 0.00 H ATOM 32075 H2 WAT 5599 67.214 97.152 91.560 1.00 0.00 H TER 32077 WAT 5599 ATOM 32077 O WAT 5600 12.549 117.907 12.236 1.00 0.00 O ATOM 32078 H1 WAT 5600 12.443 118.495 11.488 1.00 0.00 H ATOM 32079 H2 WAT 5600 12.605 117.034 11.849 1.00 0.00 H TER 32081 WAT 5600 ATOM 32081 O WAT 5601 59.294 20.311 80.910 1.00 0.00 O ATOM 32082 H1 WAT 5601 59.658 21.102 81.308 1.00 0.00 H ATOM 32083 H2 WAT 5601 59.637 19.594 81.444 1.00 0.00 H TER 32085 WAT 5601 ATOM 32085 O WAT 5602 34.229 112.516 87.416 1.00 0.00 O ATOM 32086 H1 WAT 5602 34.614 111.759 86.975 1.00 0.00 H ATOM 32087 H2 WAT 5602 34.536 112.448 88.320 1.00 0.00 H TER 32089 WAT 5602 ATOM 32089 O WAT 5603 140.260 13.541 1.943 1.00 0.00 O ATOM 32090 H1 WAT 5603 139.995 14.336 2.407 1.00 0.00 H ATOM 32091 H2 WAT 5603 139.696 12.856 2.302 1.00 0.00 H TER 32093 WAT 5603 ATOM 32093 O WAT 5604 108.487 126.608 97.618 1.00 0.00 O ATOM 32094 H1 WAT 5604 108.098 125.983 97.006 1.00 0.00 H ATOM 32095 H2 WAT 5604 108.410 127.454 97.178 1.00 0.00 H TER 32097 WAT 5604 ATOM 32097 O WAT 5605 83.253 38.885 121.569 1.00 0.00 O ATOM 32098 H1 WAT 5605 84.132 38.948 121.196 1.00 0.00 H ATOM 32099 H2 WAT 5605 83.319 39.329 122.415 1.00 0.00 H TER 32101 WAT 5605 ATOM 32101 O WAT 5606 28.889 66.911 105.987 1.00 0.00 O ATOM 32102 H1 WAT 5606 29.198 67.158 106.859 1.00 0.00 H ATOM 32103 H2 WAT 5606 29.499 66.232 105.700 1.00 0.00 H TER 32105 WAT 5606 ATOM 32105 O WAT 5607 99.622 44.642 154.607 1.00 0.00 O ATOM 32106 H1 WAT 5607 99.561 45.556 154.327 1.00 0.00 H ATOM 32107 H2 WAT 5607 99.870 44.690 155.530 1.00 0.00 H TER 32109 WAT 5607 ATOM 32109 O WAT 5608 103.105 11.565 113.967 1.00 0.00 O ATOM 32110 H1 WAT 5608 103.733 10.911 113.660 1.00 0.00 H ATOM 32111 H2 WAT 5608 102.249 11.163 113.819 1.00 0.00 H TER 32113 WAT 5608 ATOM 32113 O WAT 5609 113.018 5.454 69.917 1.00 0.00 O ATOM 32114 H1 WAT 5609 113.553 5.993 69.334 1.00 0.00 H ATOM 32115 H2 WAT 5609 113.160 4.558 69.610 1.00 0.00 H TER 32117 WAT 5609 ATOM 32117 O WAT 5610 58.789 87.774 151.872 1.00 0.00 O ATOM 32118 H1 WAT 5610 57.935 87.341 151.901 1.00 0.00 H ATOM 32119 H2 WAT 5610 59.104 87.621 150.981 1.00 0.00 H TER 32121 WAT 5610 ATOM 32121 O WAT 5611 10.321 50.096 109.893 1.00 0.00 O ATOM 32122 H1 WAT 5611 10.527 50.984 109.603 1.00 0.00 H ATOM 32123 H2 WAT 5611 9.641 49.799 109.289 1.00 0.00 H TER 32125 WAT 5611 ATOM 32125 O WAT 5612 36.234 10.351 143.127 1.00 0.00 O ATOM 32126 H1 WAT 5612 36.292 10.681 142.230 1.00 0.00 H ATOM 32127 H2 WAT 5612 36.944 9.712 143.193 1.00 0.00 H TER 32129 WAT 5612 ATOM 32129 O WAT 5613 102.868 4.837 1.956 1.00 0.00 O ATOM 32130 H1 WAT 5613 102.369 5.634 1.774 1.00 0.00 H ATOM 32131 H2 WAT 5613 102.930 4.807 2.911 1.00 0.00 H TER 32133 WAT 5613 ATOM 32133 O WAT 5614 74.700 33.144 84.792 1.00 0.00 O ATOM 32134 H1 WAT 5614 74.129 32.501 84.372 1.00 0.00 H ATOM 32135 H2 WAT 5614 75.587 32.850 84.585 1.00 0.00 H TER 32137 WAT 5614 ATOM 32137 O WAT 5615 69.553 95.168 158.880 1.00 0.00 O ATOM 32138 H1 WAT 5615 68.977 94.761 158.232 1.00 0.00 H ATOM 32139 H2 WAT 5615 70.257 94.531 159.008 1.00 0.00 H TER 32141 WAT 5615 ATOM 32141 O WAT 5616 77.265 64.632 0.293 1.00 0.00 O ATOM 32142 H1 WAT 5616 77.121 63.844 0.816 1.00 0.00 H ATOM 32143 H2 WAT 5616 77.965 64.393 -0.314 1.00 0.00 H TER 32145 WAT 5616 ATOM 32145 O WAT 5617 138.138 59.998 126.289 1.00 0.00 O ATOM 32146 H1 WAT 5617 137.318 60.003 126.782 1.00 0.00 H ATOM 32147 H2 WAT 5617 138.394 59.076 126.259 1.00 0.00 H TER 32149 WAT 5617 ATOM 32149 O WAT 5618 56.964 24.560 122.062 1.00 0.00 O ATOM 32150 H1 WAT 5618 56.699 23.957 122.756 1.00 0.00 H ATOM 32151 H2 WAT 5618 57.569 25.166 122.490 1.00 0.00 H TER 32153 WAT 5618 ATOM 32153 O WAT 5619 35.657 89.313 109.041 1.00 0.00 O ATOM 32154 H1 WAT 5619 36.461 89.815 108.909 1.00 0.00 H ATOM 32155 H2 WAT 5619 35.752 88.555 108.464 1.00 0.00 H TER 32157 WAT 5619 ATOM 32157 O WAT 5620 30.908 9.916 119.257 1.00 0.00 O ATOM 32158 H1 WAT 5620 31.156 9.965 118.334 1.00 0.00 H ATOM 32159 H2 WAT 5620 30.387 9.115 119.323 1.00 0.00 H TER 32161 WAT 5620 ATOM 32161 O WAT 5621 1.252 61.462 158.104 1.00 0.00 O ATOM 32162 H1 WAT 5621 0.725 61.510 157.307 1.00 0.00 H ATOM 32163 H2 WAT 5621 0.968 62.214 158.624 1.00 0.00 H TER 32165 WAT 5621 ATOM 32165 O WAT 5622 90.605 47.930 90.148 1.00 0.00 O ATOM 32166 H1 WAT 5622 91.032 47.234 89.649 1.00 0.00 H ATOM 32167 H2 WAT 5622 90.967 48.740 89.789 1.00 0.00 H TER 32169 WAT 5622 ATOM 32169 O WAT 5623 42.622 140.028 127.809 1.00 0.00 O ATOM 32170 H1 WAT 5623 41.960 139.592 128.346 1.00 0.00 H ATOM 32171 H2 WAT 5623 42.151 140.744 127.382 1.00 0.00 H TER 32173 WAT 5623 ATOM 32173 O WAT 5624 0.832 124.952 68.008 1.00 0.00 O ATOM 32174 H1 WAT 5624 0.587 125.458 67.233 1.00 0.00 H ATOM 32175 H2 WAT 5624 0.158 125.161 68.654 1.00 0.00 H TER 32177 WAT 5624 ATOM 32177 O WAT 5625 89.583 24.154 83.143 1.00 0.00 O ATOM 32178 H1 WAT 5625 89.532 23.679 83.973 1.00 0.00 H ATOM 32179 H2 WAT 5625 89.950 23.521 82.527 1.00 0.00 H TER 32181 WAT 5625 ATOM 32181 O WAT 5626 113.666 34.423 79.526 1.00 0.00 O ATOM 32182 H1 WAT 5626 113.697 35.233 80.035 1.00 0.00 H ATOM 32183 H2 WAT 5626 113.776 34.706 78.618 1.00 0.00 H TER 32185 WAT 5626 ATOM 32185 O WAT 5627 27.084 77.023 155.113 1.00 0.00 O ATOM 32186 H1 WAT 5627 27.598 76.566 154.447 1.00 0.00 H ATOM 32187 H2 WAT 5627 27.702 77.177 155.827 1.00 0.00 H TER 32189 WAT 5627 ATOM 32189 O WAT 5628 123.561 110.506 5.276 1.00 0.00 O ATOM 32190 H1 WAT 5628 122.917 111.177 5.052 1.00 0.00 H ATOM 32191 H2 WAT 5628 124.180 110.515 4.545 1.00 0.00 H TER 32193 WAT 5628 ATOM 32193 O WAT 5629 8.773 125.326 153.324 1.00 0.00 O ATOM 32194 H1 WAT 5629 9.627 125.392 152.898 1.00 0.00 H ATOM 32195 H2 WAT 5629 8.863 125.846 154.123 1.00 0.00 H TER 32197 WAT 5629 ATOM 32197 O WAT 5630 122.081 37.062 100.490 1.00 0.00 O ATOM 32198 H1 WAT 5630 122.582 36.774 99.727 1.00 0.00 H ATOM 32199 H2 WAT 5630 121.348 37.556 100.123 1.00 0.00 H TER 32201 WAT 5630 ATOM 32201 O WAT 5631 92.907 91.255 130.229 1.00 0.00 O ATOM 32202 H1 WAT 5631 92.726 92.189 130.336 1.00 0.00 H ATOM 32203 H2 WAT 5631 93.281 91.182 129.351 1.00 0.00 H TER 32205 WAT 5631 ATOM 32205 O WAT 5632 100.386 9.416 140.224 1.00 0.00 O ATOM 32206 H1 WAT 5632 100.750 10.299 140.158 1.00 0.00 H ATOM 32207 H2 WAT 5632 100.732 8.956 139.459 1.00 0.00 H TER 32209 WAT 5632 ATOM 32209 O WAT 5633 126.982 67.029 125.544 1.00 0.00 O ATOM 32210 H1 WAT 5633 127.489 66.560 126.206 1.00 0.00 H ATOM 32211 H2 WAT 5633 126.623 66.340 124.984 1.00 0.00 H TER 32213 WAT 5633 ATOM 32213 O WAT 5634 76.808 129.682 15.925 1.00 0.00 O ATOM 32214 H1 WAT 5634 76.359 129.909 15.111 1.00 0.00 H ATOM 32215 H2 WAT 5634 76.103 129.503 16.546 1.00 0.00 H TER 32217 WAT 5634 ATOM 32217 O WAT 5635 10.275 52.215 147.624 1.00 0.00 O ATOM 32218 H1 WAT 5635 9.612 51.692 147.173 1.00 0.00 H ATOM 32219 H2 WAT 5635 10.043 53.122 147.422 1.00 0.00 H TER 32221 WAT 5635 ATOM 32221 O WAT 5636 10.366 2.001 79.670 1.00 0.00 O ATOM 32222 H1 WAT 5636 11.309 1.909 79.531 1.00 0.00 H ATOM 32223 H2 WAT 5636 10.084 1.138 79.975 1.00 0.00 H TER 32225 WAT 5636 ATOM 32225 O WAT 5637 103.642 46.904 120.625 1.00 0.00 O ATOM 32226 H1 WAT 5637 102.742 47.229 120.603 1.00 0.00 H ATOM 32227 H2 WAT 5637 104.108 47.446 119.989 1.00 0.00 H TER 32229 WAT 5637 ATOM 32229 O WAT 5638 29.033 7.544 141.813 1.00 0.00 O ATOM 32230 H1 WAT 5638 28.228 7.811 142.257 1.00 0.00 H ATOM 32231 H2 WAT 5638 29.217 8.257 141.201 1.00 0.00 H TER 32233 WAT 5638 ATOM 32233 O WAT 5639 72.891 138.784 16.294 1.00 0.00 O ATOM 32234 H1 WAT 5639 72.926 138.221 15.521 1.00 0.00 H ATOM 32235 H2 WAT 5639 73.761 138.705 16.687 1.00 0.00 H TER 32237 WAT 5639 ATOM 32237 O WAT 5640 12.461 136.101 95.260 1.00 0.00 O ATOM 32238 H1 WAT 5640 12.937 136.192 94.435 1.00 0.00 H ATOM 32239 H2 WAT 5640 12.964 135.455 95.756 1.00 0.00 H TER 32241 WAT 5640 ATOM 32241 O WAT 5641 67.856 32.764 3.534 1.00 0.00 O ATOM 32242 H1 WAT 5641 68.342 31.954 3.688 1.00 0.00 H ATOM 32243 H2 WAT 5641 68.309 33.179 2.800 1.00 0.00 H TER 32245 WAT 5641 ATOM 32245 O WAT 5642 49.472 122.360 147.207 1.00 0.00 O ATOM 32246 H1 WAT 5642 49.630 121.692 146.540 1.00 0.00 H ATOM 32247 H2 WAT 5642 49.633 121.912 148.037 1.00 0.00 H TER 32249 WAT 5642 ATOM 32249 O WAT 5643 54.900 34.092 67.999 1.00 0.00 O ATOM 32250 H1 WAT 5643 55.522 34.721 67.632 1.00 0.00 H ATOM 32251 H2 WAT 5643 54.431 34.583 68.673 1.00 0.00 H TER 32253 WAT 5643 ATOM 32253 O WAT 5644 48.509 43.425 99.700 1.00 0.00 O ATOM 32254 H1 WAT 5644 48.799 43.255 98.804 1.00 0.00 H ATOM 32255 H2 WAT 5644 47.827 42.773 99.859 1.00 0.00 H TER 32257 WAT 5644 ATOM 32257 O WAT 5645 95.852 20.081 130.490 1.00 0.00 O ATOM 32258 H1 WAT 5645 95.056 20.496 130.823 1.00 0.00 H ATOM 32259 H2 WAT 5645 95.537 19.346 129.964 1.00 0.00 H TER 32261 WAT 5645 ATOM 32261 O WAT 5646 114.049 54.289 155.349 1.00 0.00 O ATOM 32262 H1 WAT 5646 114.775 53.789 155.722 1.00 0.00 H ATOM 32263 H2 WAT 5646 113.769 53.776 154.591 1.00 0.00 H TER 32265 WAT 5646 ATOM 32265 O WAT 5647 101.916 98.833 94.563 1.00 0.00 O ATOM 32266 H1 WAT 5647 101.160 98.657 94.002 1.00 0.00 H ATOM 32267 H2 WAT 5647 101.634 98.561 95.436 1.00 0.00 H TER 32269 WAT 5647 ATOM 32269 O WAT 5648 39.948 84.689 65.234 1.00 0.00 O ATOM 32270 H1 WAT 5648 39.364 85.103 64.597 1.00 0.00 H ATOM 32271 H2 WAT 5648 40.466 85.412 65.588 1.00 0.00 H TER 32273 WAT 5648 ATOM 32273 O WAT 5649 2.301 132.796 143.324 1.00 0.00 O ATOM 32274 H1 WAT 5649 2.070 131.879 143.176 1.00 0.00 H ATOM 32275 H2 WAT 5649 2.837 132.783 144.117 1.00 0.00 H TER 32277 WAT 5649 ATOM 32277 O WAT 5650 55.206 82.776 145.748 1.00 0.00 O ATOM 32278 H1 WAT 5650 54.582 83.010 145.061 1.00 0.00 H ATOM 32279 H2 WAT 5650 55.602 81.959 145.443 1.00 0.00 H TER 32281 WAT 5650 ATOM 32281 O WAT 5651 51.884 86.768 125.402 1.00 0.00 O ATOM 32282 H1 WAT 5651 51.535 85.906 125.175 1.00 0.00 H ATOM 32283 H2 WAT 5651 52.827 86.690 125.255 1.00 0.00 H TER 32285 WAT 5651 ATOM 32285 O WAT 5652 101.723 125.230 99.676 1.00 0.00 O ATOM 32286 H1 WAT 5652 101.783 125.527 100.584 1.00 0.00 H ATOM 32287 H2 WAT 5652 101.298 124.374 99.732 1.00 0.00 H TER 32289 WAT 5652 ATOM 32289 O WAT 5653 19.110 52.607 136.788 1.00 0.00 O ATOM 32290 H1 WAT 5653 18.639 52.252 136.034 1.00 0.00 H ATOM 32291 H2 WAT 5653 19.542 51.848 137.181 1.00 0.00 H TER 32293 WAT 5653 ATOM 32293 O WAT 5654 106.129 42.310 135.348 1.00 0.00 O ATOM 32294 H1 WAT 5654 105.574 41.776 134.779 1.00 0.00 H ATOM 32295 H2 WAT 5654 106.303 41.751 136.105 1.00 0.00 H TER 32297 WAT 5654 ATOM 32297 O WAT 5655 110.120 12.464 5.763 1.00 0.00 O ATOM 32298 H1 WAT 5655 109.563 11.806 6.178 1.00 0.00 H ATOM 32299 H2 WAT 5655 110.690 11.963 5.179 1.00 0.00 H TER 32301 WAT 5655 ATOM 32301 O WAT 5656 48.505 3.041 137.342 1.00 0.00 O ATOM 32302 H1 WAT 5656 47.933 3.532 137.932 1.00 0.00 H ATOM 32303 H2 WAT 5656 48.006 2.254 137.125 1.00 0.00 H TER 32305 WAT 5656 ATOM 32305 O WAT 5657 120.028 47.431 149.190 1.00 0.00 O ATOM 32306 H1 WAT 5657 119.986 48.377 149.052 1.00 0.00 H ATOM 32307 H2 WAT 5657 120.636 47.322 149.921 1.00 0.00 H TER 32309 WAT 5657 ATOM 32309 O WAT 5658 103.598 8.754 53.791 1.00 0.00 O ATOM 32310 H1 WAT 5658 103.021 9.463 53.506 1.00 0.00 H ATOM 32311 H2 WAT 5658 103.191 7.960 53.444 1.00 0.00 H TER 32313 WAT 5658 ATOM 32313 O WAT 5659 69.864 2.020 148.465 1.00 0.00 O ATOM 32314 H1 WAT 5659 70.735 2.003 148.068 1.00 0.00 H ATOM 32315 H2 WAT 5659 69.555 1.116 148.404 1.00 0.00 H TER 32317 WAT 5659 ATOM 32317 O WAT 5660 88.800 74.047 78.155 1.00 0.00 O ATOM 32318 H1 WAT 5660 87.898 74.329 78.002 1.00 0.00 H ATOM 32319 H2 WAT 5660 88.931 73.320 77.546 1.00 0.00 H TER 32321 WAT 5660 ATOM 32321 O WAT 5661 118.304 77.918 127.588 1.00 0.00 O ATOM 32322 H1 WAT 5661 118.574 77.149 128.090 1.00 0.00 H ATOM 32323 H2 WAT 5661 118.126 77.581 126.710 1.00 0.00 H TER 32325 WAT 5661 ATOM 32325 O WAT 5662 79.463 29.383 69.353 1.00 0.00 O ATOM 32326 H1 WAT 5662 79.154 29.260 70.250 1.00 0.00 H ATOM 32327 H2 WAT 5662 80.252 29.919 69.443 1.00 0.00 H TER 32329 WAT 5662 ATOM 32329 O WAT 5663 95.437 0.052 126.210 1.00 0.00 O ATOM 32330 H1 WAT 5663 96.103 0.720 126.049 1.00 0.00 H ATOM 32331 H2 WAT 5663 95.931 -0.764 126.288 1.00 0.00 H TER 32333 WAT 5663 ATOM 32333 O WAT 5664 140.814 123.859 103.810 1.00 0.00 O ATOM 32334 H1 WAT 5664 141.553 124.302 104.228 1.00 0.00 H ATOM 32335 H2 WAT 5664 140.747 123.021 104.267 1.00 0.00 H TER 32337 WAT 5664 ATOM 32337 O WAT 5665 144.619 131.036 101.022 1.00 0.00 O ATOM 32338 H1 WAT 5665 145.262 130.906 100.326 1.00 0.00 H ATOM 32339 H2 WAT 5665 143.843 130.561 100.723 1.00 0.00 H TER 32341 WAT 5665 ATOM 32341 O WAT 5666 30.866 123.158 19.125 1.00 0.00 O ATOM 32342 H1 WAT 5666 31.312 122.647 19.800 1.00 0.00 H ATOM 32343 H2 WAT 5666 30.132 122.607 18.852 1.00 0.00 H TER 32345 WAT 5666 ATOM 32345 O WAT 5667 49.399 26.175 104.515 1.00 0.00 O ATOM 32346 H1 WAT 5667 48.867 25.381 104.463 1.00 0.00 H ATOM 32347 H2 WAT 5667 49.487 26.343 105.454 1.00 0.00 H TER 32349 WAT 5667 ATOM 32349 O WAT 5668 2.498 101.501 69.221 1.00 0.00 O ATOM 32350 H1 WAT 5668 2.455 100.813 68.557 1.00 0.00 H ATOM 32351 H2 WAT 5668 3.368 101.405 69.610 1.00 0.00 H TER 32353 WAT 5668 ATOM 32353 O WAT 5669 55.170 18.310 154.550 1.00 0.00 O ATOM 32354 H1 WAT 5669 55.853 18.975 154.464 1.00 0.00 H ATOM 32355 H2 WAT 5669 55.645 17.499 154.730 1.00 0.00 H TER 32357 WAT 5669 ATOM 32357 O WAT 5670 116.859 56.026 103.700 1.00 0.00 O ATOM 32358 H1 WAT 5670 117.392 56.483 103.049 1.00 0.00 H ATOM 32359 H2 WAT 5670 117.381 56.058 104.502 1.00 0.00 H TER 32361 WAT 5670 ATOM 32361 O WAT 5671 60.894 29.717 123.918 1.00 0.00 O ATOM 32362 H1 WAT 5671 60.430 30.372 124.439 1.00 0.00 H ATOM 32363 H2 WAT 5671 61.674 30.172 123.601 1.00 0.00 H TER 32365 WAT 5671 ATOM 32365 O WAT 5672 14.256 86.756 80.141 1.00 0.00 O ATOM 32366 H1 WAT 5672 13.528 87.378 80.131 1.00 0.00 H ATOM 32367 H2 WAT 5672 14.744 86.945 79.340 1.00 0.00 H TER 32369 WAT 5672 ATOM 32369 O WAT 5673 127.054 52.040 8.240 1.00 0.00 O ATOM 32370 H1 WAT 5673 127.662 51.301 8.239 1.00 0.00 H ATOM 32371 H2 WAT 5673 126.724 52.080 7.342 1.00 0.00 H TER 32373 WAT 5673 ATOM 32373 O WAT 5674 71.437 23.890 80.689 1.00 0.00 O ATOM 32374 H1 WAT 5674 72.383 24.021 80.630 1.00 0.00 H ATOM 32375 H2 WAT 5674 71.076 24.775 80.747 1.00 0.00 H TER 32377 WAT 5674 ATOM 32377 O WAT 5675 127.710 136.666 112.926 1.00 0.00 O ATOM 32378 H1 WAT 5675 128.518 136.360 112.513 1.00 0.00 H ATOM 32379 H2 WAT 5675 127.947 137.504 113.323 1.00 0.00 H TER 32381 WAT 5675 ATOM 32381 O WAT 5676 8.107 59.529 148.833 1.00 0.00 O ATOM 32382 H1 WAT 5676 7.175 59.412 148.653 1.00 0.00 H ATOM 32383 H2 WAT 5676 8.270 58.995 149.611 1.00 0.00 H TER 32385 WAT 5676 ATOM 32385 O WAT 5677 99.039 119.384 115.098 1.00 0.00 O ATOM 32386 H1 WAT 5677 99.115 118.881 114.287 1.00 0.00 H ATOM 32387 H2 WAT 5677 99.212 118.747 115.792 1.00 0.00 H TER 32389 WAT 5677 ATOM 32389 O WAT 5678 7.351 24.259 15.818 1.00 0.00 O ATOM 32390 H1 WAT 5678 7.724 24.426 14.953 1.00 0.00 H ATOM 32391 H2 WAT 5678 8.111 24.176 16.395 1.00 0.00 H TER 32393 WAT 5678 ATOM 32393 O WAT 5679 132.726 136.019 96.648 1.00 0.00 O ATOM 32394 H1 WAT 5679 132.585 135.166 97.058 1.00 0.00 H ATOM 32395 H2 WAT 5679 132.357 136.647 97.268 1.00 0.00 H TER 32397 WAT 5679 ATOM 32397 O WAT 5680 133.090 28.342 82.344 1.00 0.00 O ATOM 32398 H1 WAT 5680 133.396 28.200 83.240 1.00 0.00 H ATOM 32399 H2 WAT 5680 133.337 29.245 82.147 1.00 0.00 H TER 32401 WAT 5680 ATOM 32401 O WAT 5681 134.182 129.876 147.494 1.00 0.00 O ATOM 32402 H1 WAT 5681 134.951 130.081 146.962 1.00 0.00 H ATOM 32403 H2 WAT 5681 133.978 128.966 147.281 1.00 0.00 H TER 32405 WAT 5681 ATOM 32405 O WAT 5682 127.059 122.530 66.601 1.00 0.00 O ATOM 32406 H1 WAT 5682 127.472 122.591 65.739 1.00 0.00 H ATOM 32407 H2 WAT 5682 126.586 121.698 66.582 1.00 0.00 H TER 32409 WAT 5682 ATOM 32409 O WAT 5683 60.530 33.910 120.143 1.00 0.00 O ATOM 32410 H1 WAT 5683 60.662 33.367 119.366 1.00 0.00 H ATOM 32411 H2 WAT 5683 61.069 34.685 119.988 1.00 0.00 H TER 32413 WAT 5683 ATOM 32413 O WAT 5684 137.311 139.422 104.733 1.00 0.00 O ATOM 32414 H1 WAT 5684 136.957 138.788 105.356 1.00 0.00 H ATOM 32415 H2 WAT 5684 138.057 139.814 105.187 1.00 0.00 H TER 32417 WAT 5684 ATOM 32417 O WAT 5685 53.044 15.592 86.855 1.00 0.00 O ATOM 32418 H1 WAT 5685 52.715 14.916 86.263 1.00 0.00 H ATOM 32419 H2 WAT 5685 53.400 15.106 87.599 1.00 0.00 H TER 32421 WAT 5685 ATOM 32421 O WAT 5686 8.194 78.713 74.112 1.00 0.00 O ATOM 32422 H1 WAT 5686 8.522 77.820 74.219 1.00 0.00 H ATOM 32423 H2 WAT 5686 8.982 79.255 74.084 1.00 0.00 H TER 32425 WAT 5686 ATOM 32425 O WAT 5687 114.964 27.944 72.158 1.00 0.00 O ATOM 32426 H1 WAT 5687 114.823 28.881 72.025 1.00 0.00 H ATOM 32427 H2 WAT 5687 114.843 27.558 71.290 1.00 0.00 H TER 32429 WAT 5687 ATOM 32429 O WAT 5688 9.549 131.333 111.763 1.00 0.00 O ATOM 32430 H1 WAT 5688 8.893 130.790 111.326 1.00 0.00 H ATOM 32431 H2 WAT 5688 9.963 131.825 111.054 1.00 0.00 H TER 32433 WAT 5688 ATOM 32433 O WAT 5689 93.718 33.261 14.343 1.00 0.00 O ATOM 32434 H1 WAT 5689 93.307 33.974 13.855 1.00 0.00 H ATOM 32435 H2 WAT 5689 94.646 33.320 14.116 1.00 0.00 H TER 32437 WAT 5689 ATOM 32437 O WAT 5690 113.531 125.305 91.337 1.00 0.00 O ATOM 32438 H1 WAT 5690 113.511 126.108 90.817 1.00 0.00 H ATOM 32439 H2 WAT 5690 112.616 125.024 91.377 1.00 0.00 H TER 32441 WAT 5690 ATOM 32441 O WAT 5691 5.465 143.107 107.298 1.00 0.00 O ATOM 32442 H1 WAT 5691 6.151 142.499 107.020 1.00 0.00 H ATOM 32443 H2 WAT 5691 4.720 142.546 107.512 1.00 0.00 H TER 32445 WAT 5691 ATOM 32445 O WAT 5692 64.735 35.366 70.818 1.00 0.00 O ATOM 32446 H1 WAT 5692 64.414 35.805 70.030 1.00 0.00 H ATOM 32447 H2 WAT 5692 63.952 35.230 71.352 1.00 0.00 H TER 32449 WAT 5692 ATOM 32449 O WAT 5693 7.861 127.831 76.553 1.00 0.00 O ATOM 32450 H1 WAT 5693 6.974 127.495 76.425 1.00 0.00 H ATOM 32451 H2 WAT 5693 8.416 127.052 76.542 1.00 0.00 H TER 32453 WAT 5693 ATOM 32453 O WAT 5694 58.171 103.190 156.288 1.00 0.00 O ATOM 32454 H1 WAT 5694 57.983 102.315 155.946 1.00 0.00 H ATOM 32455 H2 WAT 5694 57.342 103.483 156.666 1.00 0.00 H TER 32457 WAT 5694 ATOM 32457 O WAT 5695 73.202 126.250 13.265 1.00 0.00 O ATOM 32458 H1 WAT 5695 73.815 126.143 13.992 1.00 0.00 H ATOM 32459 H2 WAT 5695 72.338 126.138 13.661 1.00 0.00 H TER 32461 WAT 5695 ATOM 32461 O WAT 5696 116.659 131.528 67.587 1.00 0.00 O ATOM 32462 H1 WAT 5696 117.322 131.998 67.081 1.00 0.00 H ATOM 32463 H2 WAT 5696 116.136 132.218 67.996 1.00 0.00 H TER 32465 WAT 5696 ATOM 32465 O WAT 5697 32.910 15.257 24.177 1.00 0.00 O ATOM 32466 H1 WAT 5697 33.380 16.081 24.045 1.00 0.00 H ATOM 32467 H2 WAT 5697 31.985 15.498 24.124 1.00 0.00 H TER 32469 WAT 5697 ATOM 32469 O WAT 5698 88.704 75.613 158.065 1.00 0.00 O ATOM 32470 H1 WAT 5698 88.392 76.094 158.832 1.00 0.00 H ATOM 32471 H2 WAT 5698 87.981 75.029 157.838 1.00 0.00 H TER 32473 WAT 5698 ATOM 32473 O WAT 5699 123.977 70.642 138.296 1.00 0.00 O ATOM 32474 H1 WAT 5699 123.412 71.137 137.703 1.00 0.00 H ATOM 32475 H2 WAT 5699 124.260 69.886 137.782 1.00 0.00 H TER 32477 WAT 5699 ATOM 32477 O WAT 5700 71.988 103.140 101.542 1.00 0.00 O ATOM 32478 H1 WAT 5700 71.861 103.273 100.603 1.00 0.00 H ATOM 32479 H2 WAT 5700 72.181 102.206 101.627 1.00 0.00 H TER 32481 WAT 5700 ATOM 32481 O WAT 5701 136.842 32.127 112.588 1.00 0.00 O ATOM 32482 H1 WAT 5701 137.663 31.844 112.184 1.00 0.00 H ATOM 32483 H2 WAT 5701 137.042 32.987 112.958 1.00 0.00 H TER 32485 WAT 5701 ATOM 32485 O WAT 5702 62.914 113.196 124.178 1.00 0.00 O ATOM 32486 H1 WAT 5702 63.257 112.716 123.424 1.00 0.00 H ATOM 32487 H2 WAT 5702 62.082 113.559 123.872 1.00 0.00 H TER 32489 WAT 5702 ATOM 32489 O WAT 5703 111.130 15.564 150.208 1.00 0.00 O ATOM 32490 H1 WAT 5703 111.908 16.065 149.965 1.00 0.00 H ATOM 32491 H2 WAT 5703 111.131 14.815 149.612 1.00 0.00 H TER 32493 WAT 5703 ATOM 32493 O WAT 5704 141.491 38.280 84.370 1.00 0.00 O ATOM 32494 H1 WAT 5704 140.979 37.517 84.636 1.00 0.00 H ATOM 32495 H2 WAT 5704 141.399 38.895 85.098 1.00 0.00 H TER 32497 WAT 5704 ATOM 32497 O WAT 5705 25.386 0.571 16.474 1.00 0.00 O ATOM 32498 H1 WAT 5705 24.842 1.310 16.743 1.00 0.00 H ATOM 32499 H2 WAT 5705 24.807 0.030 15.936 1.00 0.00 H TER 32501 WAT 5705 ATOM 32501 O WAT 5706 66.879 11.204 149.368 1.00 0.00 O ATOM 32502 H1 WAT 5706 67.493 11.798 149.799 1.00 0.00 H ATOM 32503 H2 WAT 5706 66.018 11.590 149.530 1.00 0.00 H TER 32505 WAT 5706 ATOM 32505 O WAT 5707 40.444 28.634 9.876 1.00 0.00 O ATOM 32506 H1 WAT 5707 40.518 27.855 10.428 1.00 0.00 H ATOM 32507 H2 WAT 5707 39.955 29.260 10.411 1.00 0.00 H TER 32509 WAT 5707 ATOM 32509 O WAT 5708 91.909 47.357 149.553 1.00 0.00 O ATOM 32510 H1 WAT 5708 91.953 46.526 150.025 1.00 0.00 H ATOM 32511 H2 WAT 5708 92.623 47.879 149.918 1.00 0.00 H TER 32513 WAT 5708 ATOM 32513 O WAT 5709 96.314 116.619 137.546 1.00 0.00 O ATOM 32514 H1 WAT 5709 96.726 117.176 136.885 1.00 0.00 H ATOM 32515 H2 WAT 5709 97.035 116.346 138.113 1.00 0.00 H TER 32517 WAT 5709 ATOM 32517 O WAT 5710 43.927 135.279 58.506 1.00 0.00 O ATOM 32518 H1 WAT 5710 44.705 135.631 58.073 1.00 0.00 H ATOM 32519 H2 WAT 5710 44.159 135.256 59.434 1.00 0.00 H TER 32521 WAT 5710 ATOM 32521 O WAT 5711 12.343 79.423 95.533 1.00 0.00 O ATOM 32522 H1 WAT 5711 12.791 78.765 95.001 1.00 0.00 H ATOM 32523 H2 WAT 5711 13.050 79.934 95.927 1.00 0.00 H TER 32525 WAT 5711 ATOM 32525 O WAT 5712 78.323 93.643 112.142 1.00 0.00 O ATOM 32526 H1 WAT 5712 79.177 93.879 111.778 1.00 0.00 H ATOM 32527 H2 WAT 5712 77.816 93.342 111.388 1.00 0.00 H TER 32529 WAT 5712 ATOM 32529 O WAT 5713 59.515 41.786 132.193 1.00 0.00 O ATOM 32530 H1 WAT 5713 60.143 41.253 131.705 1.00 0.00 H ATOM 32531 H2 WAT 5713 59.915 42.655 132.229 1.00 0.00 H TER 32533 WAT 5713 ATOM 32533 O WAT 5714 101.576 16.768 156.950 1.00 0.00 O ATOM 32534 H1 WAT 5714 100.790 16.352 157.306 1.00 0.00 H ATOM 32535 H2 WAT 5714 101.257 17.572 156.540 1.00 0.00 H TER 32537 WAT 5714 ATOM 32537 O WAT 5715 16.040 2.010 55.960 1.00 0.00 O ATOM 32538 H1 WAT 5715 16.721 1.403 56.248 1.00 0.00 H ATOM 32539 H2 WAT 5715 16.490 2.610 55.365 1.00 0.00 H TER 32541 WAT 5715 ATOM 32541 O WAT 5716 101.585 43.811 113.178 1.00 0.00 O ATOM 32542 H1 WAT 5716 100.665 44.029 113.029 1.00 0.00 H ATOM 32543 H2 WAT 5716 101.865 44.412 113.868 1.00 0.00 H TER 32545 WAT 5716 ATOM 32545 O WAT 5717 57.378 24.401 142.331 1.00 0.00 O ATOM 32546 H1 WAT 5717 57.910 24.991 141.796 1.00 0.00 H ATOM 32547 H2 WAT 5717 57.419 24.775 143.212 1.00 0.00 H TER 32549 WAT 5717 ATOM 32549 O WAT 5718 109.077 57.256 97.719 1.00 0.00 O ATOM 32550 H1 WAT 5718 109.860 57.533 97.243 1.00 0.00 H ATOM 32551 H2 WAT 5718 109.392 57.049 98.598 1.00 0.00 H TER 32553 WAT 5718 ATOM 32553 O WAT 5719 61.022 64.818 113.284 1.00 0.00 O ATOM 32554 H1 WAT 5719 60.169 65.196 113.073 1.00 0.00 H ATOM 32555 H2 WAT 5719 60.895 64.402 114.137 1.00 0.00 H TER 32557 WAT 5719 ATOM 32557 O WAT 5720 21.975 47.208 67.163 1.00 0.00 O ATOM 32558 H1 WAT 5720 21.244 47.085 66.557 1.00 0.00 H ATOM 32559 H2 WAT 5720 22.407 46.354 67.194 1.00 0.00 H TER 32561 WAT 5720 ATOM 32561 O WAT 5721 88.095 53.499 139.061 1.00 0.00 O ATOM 32562 H1 WAT 5721 89.026 53.566 139.274 1.00 0.00 H ATOM 32563 H2 WAT 5721 87.829 54.398 138.865 1.00 0.00 H TER 32565 WAT 5721 ATOM 32565 O WAT 5722 10.107 120.641 123.537 1.00 0.00 O ATOM 32566 H1 WAT 5722 10.776 120.845 122.883 1.00 0.00 H ATOM 32567 H2 WAT 5722 9.678 121.479 123.710 1.00 0.00 H TER 32569 WAT 5722 ATOM 32569 O WAT 5723 37.493 64.714 16.242 1.00 0.00 O ATOM 32570 H1 WAT 5723 36.908 65.448 16.429 1.00 0.00 H ATOM 32571 H2 WAT 5723 37.084 63.965 16.676 1.00 0.00 H TER 32573 WAT 5723 ATOM 32573 O WAT 5724 130.455 22.389 9.317 1.00 0.00 O ATOM 32574 H1 WAT 5724 129.605 22.430 9.756 1.00 0.00 H ATOM 32575 H2 WAT 5724 130.655 21.454 9.270 1.00 0.00 H TER 32577 WAT 5724 ATOM 32577 O WAT 5725 144.459 61.976 66.101 1.00 0.00 O ATOM 32578 H1 WAT 5725 144.143 62.635 65.482 1.00 0.00 H ATOM 32579 H2 WAT 5725 145.236 61.606 65.681 1.00 0.00 H TER 32581 WAT 5725 ATOM 32581 O WAT 5726 102.431 32.031 68.982 1.00 0.00 O ATOM 32582 H1 WAT 5726 102.519 32.984 68.986 1.00 0.00 H ATOM 32583 H2 WAT 5726 102.079 31.819 69.847 1.00 0.00 H TER 32585 WAT 5726 ATOM 32585 O WAT 5727 121.244 89.988 24.218 1.00 0.00 O ATOM 32586 H1 WAT 5727 120.895 89.922 25.107 1.00 0.00 H ATOM 32587 H2 WAT 5727 122.190 89.887 24.324 1.00 0.00 H TER 32589 WAT 5727 ATOM 32589 O WAT 5728 12.126 47.521 6.207 1.00 0.00 O ATOM 32590 H1 WAT 5728 12.731 47.381 5.479 1.00 0.00 H ATOM 32591 H2 WAT 5728 12.693 47.651 6.967 1.00 0.00 H TER 32593 WAT 5728 ATOM 32593 O WAT 5729 99.085 50.133 136.639 1.00 0.00 O ATOM 32594 H1 WAT 5729 98.810 49.767 137.479 1.00 0.00 H ATOM 32595 H2 WAT 5729 98.294 50.116 136.100 1.00 0.00 H TER 32597 WAT 5729 ATOM 32597 O WAT 5730 33.314 145.647 5.799 1.00 0.00 O ATOM 32598 H1 WAT 5730 33.803 146.049 6.517 1.00 0.00 H ATOM 32599 H2 WAT 5730 32.455 146.068 5.830 1.00 0.00 H TER 32601 WAT 5730 ATOM 32601 O WAT 5731 1.352 83.680 111.509 1.00 0.00 O ATOM 32602 H1 WAT 5731 2.192 84.004 111.185 1.00 0.00 H ATOM 32603 H2 WAT 5731 0.697 84.164 111.005 1.00 0.00 H TER 32605 WAT 5731 ATOM 32605 O WAT 5732 120.134 97.039 112.278 1.00 0.00 O ATOM 32606 H1 WAT 5732 120.073 96.086 112.225 1.00 0.00 H ATOM 32607 H2 WAT 5732 119.511 97.356 111.624 1.00 0.00 H TER 32609 WAT 5732 ATOM 32609 O WAT 5733 128.398 125.321 24.776 1.00 0.00 O ATOM 32610 H1 WAT 5733 128.248 124.457 24.393 1.00 0.00 H ATOM 32611 H2 WAT 5733 127.712 125.872 24.400 1.00 0.00 H TER 32613 WAT 5733 ATOM 32613 O WAT 5734 111.337 15.586 137.130 1.00 0.00 O ATOM 32614 H1 WAT 5734 110.652 14.923 137.218 1.00 0.00 H ATOM 32615 H2 WAT 5734 110.897 16.413 137.329 1.00 0.00 H TER 32617 WAT 5734 ATOM 32617 O WAT 5735 81.315 92.241 100.620 1.00 0.00 O ATOM 32618 H1 WAT 5735 80.363 92.194 100.705 1.00 0.00 H ATOM 32619 H2 WAT 5735 81.505 91.789 99.798 1.00 0.00 H TER 32621 WAT 5735 ATOM 32621 O WAT 5736 31.746 77.984 125.863 1.00 0.00 O ATOM 32622 H1 WAT 5736 31.160 77.845 126.606 1.00 0.00 H ATOM 32623 H2 WAT 5736 31.739 77.150 125.393 1.00 0.00 H TER 32625 WAT 5736 ATOM 32625 O WAT 5737 26.234 125.284 60.354 1.00 0.00 O ATOM 32626 H1 WAT 5737 26.757 124.888 59.658 1.00 0.00 H ATOM 32627 H2 WAT 5737 25.327 125.102 60.105 1.00 0.00 H TER 32629 WAT 5737 ATOM 32629 O WAT 5738 60.784 70.511 158.695 1.00 0.00 O ATOM 32630 H1 WAT 5738 61.085 70.915 157.881 1.00 0.00 H ATOM 32631 H2 WAT 5738 59.856 70.330 158.544 1.00 0.00 H TER 32633 WAT 5738 ATOM 32633 O WAT 5739 50.192 1.464 110.107 1.00 0.00 O ATOM 32634 H1 WAT 5739 51.102 1.181 110.198 1.00 0.00 H ATOM 32635 H2 WAT 5739 49.788 0.798 109.551 1.00 0.00 H TER 32637 WAT 5739 ATOM 32637 O WAT 5740 63.777 123.045 63.315 1.00 0.00 O ATOM 32638 H1 WAT 5740 64.380 122.451 62.867 1.00 0.00 H ATOM 32639 H2 WAT 5740 63.096 123.228 62.667 1.00 0.00 H TER 32641 WAT 5740 ATOM 32641 O WAT 5741 40.430 56.358 3.987 1.00 0.00 O ATOM 32642 H1 WAT 5741 41.330 56.621 3.791 1.00 0.00 H ATOM 32643 H2 WAT 5741 40.252 56.738 4.847 1.00 0.00 H TER 32645 WAT 5741 ATOM 32645 O WAT 5742 38.106 141.777 125.094 1.00 0.00 O ATOM 32646 H1 WAT 5742 37.219 141.753 124.734 1.00 0.00 H ATOM 32647 H2 WAT 5742 37.978 141.817 126.041 1.00 0.00 H TER 32649 WAT 5742 ATOM 32649 O WAT 5743 16.234 109.955 111.111 1.00 0.00 O ATOM 32650 H1 WAT 5743 16.085 109.011 111.065 1.00 0.00 H ATOM 32651 H2 WAT 5743 15.363 110.328 111.247 1.00 0.00 H TER 32653 WAT 5743 ATOM 32653 O WAT 5744 140.624 24.108 136.212 1.00 0.00 O ATOM 32654 H1 WAT 5744 140.052 23.614 136.800 1.00 0.00 H ATOM 32655 H2 WAT 5744 141.299 24.473 136.786 1.00 0.00 H TER 32657 WAT 5744 ATOM 32657 O WAT 5745 37.133 101.733 27.579 1.00 0.00 O ATOM 32658 H1 WAT 5745 36.620 101.109 28.092 1.00 0.00 H ATOM 32659 H2 WAT 5745 36.523 102.447 27.390 1.00 0.00 H TER 32661 WAT 5745 ATOM 32661 O WAT 5746 125.679 93.726 95.013 1.00 0.00 O ATOM 32662 H1 WAT 5746 125.076 93.511 94.301 1.00 0.00 H ATOM 32663 H2 WAT 5746 126.541 93.750 94.597 1.00 0.00 H TER 32665 WAT 5746 ATOM 32665 O WAT 5747 46.614 46.960 119.642 1.00 0.00 O ATOM 32666 H1 WAT 5747 47.473 47.170 120.008 1.00 0.00 H ATOM 32667 H2 WAT 5747 46.157 47.800 119.607 1.00 0.00 H TER 32669 WAT 5747 ATOM 32669 O WAT 5748 115.428 32.543 137.509 1.00 0.00 O ATOM 32670 H1 WAT 5748 115.452 33.458 137.229 1.00 0.00 H ATOM 32671 H2 WAT 5748 114.915 32.100 136.833 1.00 0.00 H TER 32673 WAT 5748 ATOM 32673 O WAT 5749 115.137 82.866 146.795 1.00 0.00 O ATOM 32674 H1 WAT 5749 116.034 82.616 147.014 1.00 0.00 H ATOM 32675 H2 WAT 5749 114.918 83.553 147.425 1.00 0.00 H TER 32677 WAT 5749 ATOM 32677 O WAT 5750 120.654 46.957 18.965 1.00 0.00 O ATOM 32678 H1 WAT 5750 120.708 47.289 19.861 1.00 0.00 H ATOM 32679 H2 WAT 5750 120.448 46.028 19.066 1.00 0.00 H TER 32681 WAT 5750 ATOM 32681 O WAT 5751 110.759 127.148 5.460 1.00 0.00 O ATOM 32682 H1 WAT 5751 109.966 126.944 5.955 1.00 0.00 H ATOM 32683 H2 WAT 5751 110.656 128.065 5.208 1.00 0.00 H TER 32685 WAT 5751 ATOM 32685 O WAT 5752 38.667 101.500 113.736 1.00 0.00 O ATOM 32686 H1 WAT 5752 38.333 102.341 114.049 1.00 0.00 H ATOM 32687 H2 WAT 5752 38.707 100.952 114.519 1.00 0.00 H TER 32689 WAT 5752 ATOM 32689 O WAT 5753 132.661 111.745 13.030 1.00 0.00 O ATOM 32690 H1 WAT 5753 133.117 112.203 13.736 1.00 0.00 H ATOM 32691 H2 WAT 5753 132.642 110.830 13.311 1.00 0.00 H TER 32693 WAT 5753 ATOM 32693 O WAT 5754 137.862 1.622 12.838 1.00 0.00 O ATOM 32694 H1 WAT 5754 137.570 2.168 12.108 1.00 0.00 H ATOM 32695 H2 WAT 5754 137.495 2.044 13.615 1.00 0.00 H TER 32697 WAT 5754 ATOM 32697 O WAT 5755 139.156 74.347 62.252 1.00 0.00 O ATOM 32698 H1 WAT 5755 138.618 73.596 62.503 1.00 0.00 H ATOM 32699 H2 WAT 5755 138.525 75.043 62.070 1.00 0.00 H TER 32701 WAT 5755 ATOM 32701 O WAT 5756 136.782 64.861 65.716 1.00 0.00 O ATOM 32702 H1 WAT 5756 137.251 64.170 65.247 1.00 0.00 H ATOM 32703 H2 WAT 5756 135.923 64.482 65.904 1.00 0.00 H TER 32705 WAT 5756 ATOM 32705 O WAT 5757 62.312 95.766 88.616 1.00 0.00 O ATOM 32706 H1 WAT 5757 62.831 94.972 88.748 1.00 0.00 H ATOM 32707 H2 WAT 5757 62.376 95.940 87.676 1.00 0.00 H TER 32709 WAT 5757 ATOM 32709 O WAT 5758 122.997 14.397 61.186 1.00 0.00 O ATOM 32710 H1 WAT 5758 122.747 13.516 60.908 1.00 0.00 H ATOM 32711 H2 WAT 5758 122.510 14.980 60.603 1.00 0.00 H TER 32713 WAT 5758 ATOM 32713 O WAT 5759 102.365 8.457 58.388 1.00 0.00 O ATOM 32714 H1 WAT 5759 102.238 7.659 58.901 1.00 0.00 H ATOM 32715 H2 WAT 5759 103.031 8.948 58.870 1.00 0.00 H TER 32717 WAT 5759 ATOM 32717 O WAT 5760 32.436 88.407 131.118 1.00 0.00 O ATOM 32718 H1 WAT 5760 31.840 88.207 131.840 1.00 0.00 H ATOM 32719 H2 WAT 5760 33.300 88.152 131.444 1.00 0.00 H TER 32721 WAT 5760 ATOM 32721 O WAT 5761 120.971 12.832 65.349 1.00 0.00 O ATOM 32722 H1 WAT 5761 121.585 13.446 65.752 1.00 0.00 H ATOM 32723 H2 WAT 5761 121.438 11.997 65.341 1.00 0.00 H TER 32725 WAT 5761 ATOM 32725 O WAT 5762 19.580 108.546 93.794 1.00 0.00 O ATOM 32726 H1 WAT 5762 20.069 109.365 93.870 1.00 0.00 H ATOM 32727 H2 WAT 5762 20.238 107.862 93.920 1.00 0.00 H TER 32729 WAT 5762 ATOM 32729 O WAT 5763 9.125 142.120 95.675 1.00 0.00 O ATOM 32730 H1 WAT 5763 8.678 142.334 94.857 1.00 0.00 H ATOM 32731 H2 WAT 5763 10.039 141.990 95.422 1.00 0.00 H TER 32733 WAT 5763 ATOM 32733 O WAT 5764 31.397 53.683 12.582 1.00 0.00 O ATOM 32734 H1 WAT 5764 31.021 53.504 11.720 1.00 0.00 H ATOM 32735 H2 WAT 5764 30.850 54.381 12.942 1.00 0.00 H TER 32737 WAT 5764 ATOM 32737 O WAT 5765 41.167 82.868 70.197 1.00 0.00 O ATOM 32738 H1 WAT 5765 41.246 82.858 71.151 1.00 0.00 H ATOM 32739 H2 WAT 5765 41.842 82.260 69.895 1.00 0.00 H TER 32741 WAT 5765 ATOM 32741 O WAT 5766 20.211 11.441 146.542 1.00 0.00 O ATOM 32742 H1 WAT 5766 20.734 11.661 145.771 1.00 0.00 H ATOM 32743 H2 WAT 5766 20.606 10.636 146.878 1.00 0.00 H TER 32745 WAT 5766 ATOM 32745 O WAT 5767 141.513 14.648 68.650 1.00 0.00 O ATOM 32746 H1 WAT 5767 140.629 14.601 68.286 1.00 0.00 H ATOM 32747 H2 WAT 5767 141.860 13.761 68.554 1.00 0.00 H TER 32749 WAT 5767 ATOM 32749 O WAT 5768 90.632 39.569 99.230 1.00 0.00 O ATOM 32750 H1 WAT 5768 90.992 38.842 99.738 1.00 0.00 H ATOM 32751 H2 WAT 5768 91.347 39.833 98.650 1.00 0.00 H TER 32753 WAT 5768 ATOM 32753 O WAT 5769 130.638 70.458 96.744 1.00 0.00 O ATOM 32754 H1 WAT 5769 130.513 71.407 96.709 1.00 0.00 H ATOM 32755 H2 WAT 5769 129.757 70.097 96.638 1.00 0.00 H TER 32757 WAT 5769 ATOM 32757 O WAT 5770 134.729 2.166 84.128 1.00 0.00 O ATOM 32758 H1 WAT 5770 134.269 2.990 83.969 1.00 0.00 H ATOM 32759 H2 WAT 5770 135.466 2.406 84.689 1.00 0.00 H TER 32761 WAT 5770 ATOM 32761 O WAT 5771 39.256 81.010 69.690 1.00 0.00 O ATOM 32762 H1 WAT 5771 38.345 81.300 69.729 1.00 0.00 H ATOM 32763 H2 WAT 5771 39.762 81.767 69.987 1.00 0.00 H TER 32765 WAT 5771 ATOM 32765 O WAT 5772 18.619 135.021 92.086 1.00 0.00 O ATOM 32766 H1 WAT 5772 18.193 135.201 91.248 1.00 0.00 H ATOM 32767 H2 WAT 5772 18.200 135.622 92.702 1.00 0.00 H TER 32769 WAT 5772 ATOM 32769 O WAT 5773 75.027 75.600 0.837 1.00 0.00 O ATOM 32770 H1 WAT 5773 74.384 75.024 1.250 1.00 0.00 H ATOM 32771 H2 WAT 5773 74.927 75.438 -0.101 1.00 0.00 H TER 32773 WAT 5773 ATOM 32773 O WAT 5774 138.196 121.189 124.811 1.00 0.00 O ATOM 32774 H1 WAT 5774 138.532 121.746 125.514 1.00 0.00 H ATOM 32775 H2 WAT 5774 138.885 120.539 124.671 1.00 0.00 H TER 32777 WAT 5774 ATOM 32777 O WAT 5775 86.305 4.580 59.191 1.00 0.00 O ATOM 32778 H1 WAT 5775 86.458 3.731 59.607 1.00 0.00 H ATOM 32779 H2 WAT 5775 87.090 5.089 59.390 1.00 0.00 H TER 32781 WAT 5775 ATOM 32781 O WAT 5776 145.431 91.208 95.171 1.00 0.00 O ATOM 32782 H1 WAT 5776 144.779 90.876 94.553 1.00 0.00 H ATOM 32783 H2 WAT 5776 145.520 90.512 95.822 1.00 0.00 H TER 32785 WAT 5776 ATOM 32785 O WAT 5777 89.121 76.505 141.539 1.00 0.00 O ATOM 32786 H1 WAT 5777 89.865 77.097 141.431 1.00 0.00 H ATOM 32787 H2 WAT 5777 89.432 75.839 142.154 1.00 0.00 H TER 32789 WAT 5777 ATOM 32789 O WAT 5778 82.159 53.413 7.799 1.00 0.00 O ATOM 32790 H1 WAT 5778 82.107 54.218 7.284 1.00 0.00 H ATOM 32791 H2 WAT 5778 82.589 52.785 7.218 1.00 0.00 H TER 32793 WAT 5778 ATOM 32793 O WAT 5779 105.654 126.640 16.344 1.00 0.00 O ATOM 32794 H1 WAT 5779 104.747 126.586 16.041 1.00 0.00 H ATOM 32795 H2 WAT 5779 106.043 125.805 16.085 1.00 0.00 H TER 32797 WAT 5779 ATOM 32797 O WAT 5780 119.920 35.466 84.946 1.00 0.00 O ATOM 32798 H1 WAT 5780 119.352 36.045 84.438 1.00 0.00 H ATOM 32799 H2 WAT 5780 119.577 34.588 84.780 1.00 0.00 H TER 32801 WAT 5780 ATOM 32801 O WAT 5781 51.896 105.269 100.238 1.00 0.00 O ATOM 32802 H1 WAT 5781 51.053 105.639 99.976 1.00 0.00 H ATOM 32803 H2 WAT 5781 52.159 104.722 99.498 1.00 0.00 H TER 32805 WAT 5781 ATOM 32805 O WAT 5782 141.336 72.681 75.411 1.00 0.00 O ATOM 32806 H1 WAT 5782 142.178 73.044 75.687 1.00 0.00 H ATOM 32807 H2 WAT 5782 140.719 72.970 76.083 1.00 0.00 H TER 32809 WAT 5782 ATOM 32809 O WAT 5783 66.675 62.915 118.367 1.00 0.00 O ATOM 32810 H1 WAT 5783 66.393 62.048 118.074 1.00 0.00 H ATOM 32811 H2 WAT 5783 67.204 62.744 119.146 1.00 0.00 H TER 32813 WAT 5783 ATOM 32813 O WAT 5784 118.297 61.944 150.256 1.00 0.00 O ATOM 32814 H1 WAT 5784 117.974 62.767 149.888 1.00 0.00 H ATOM 32815 H2 WAT 5784 118.355 61.352 149.506 1.00 0.00 H TER 32817 WAT 5784 ATOM 32817 O WAT 5785 144.451 43.844 63.413 1.00 0.00 O ATOM 32818 H1 WAT 5785 143.562 43.722 63.748 1.00 0.00 H ATOM 32819 H2 WAT 5785 144.459 44.741 63.079 1.00 0.00 H TER 32821 WAT 5785 ATOM 32821 O WAT 5786 119.852 6.805 152.447 1.00 0.00 O ATOM 32822 H1 WAT 5786 120.643 6.743 152.982 1.00 0.00 H ATOM 32823 H2 WAT 5786 119.363 7.536 152.825 1.00 0.00 H TER 32825 WAT 5786 ATOM 32825 O WAT 5787 69.260 60.440 139.032 1.00 0.00 O ATOM 32826 H1 WAT 5787 69.561 60.766 139.880 1.00 0.00 H ATOM 32827 H2 WAT 5787 69.689 61.006 138.391 1.00 0.00 H TER 32829 WAT 5787 ATOM 32829 O WAT 5788 76.925 84.476 125.306 1.00 0.00 O ATOM 32830 H1 WAT 5788 77.684 84.075 124.884 1.00 0.00 H ATOM 32831 H2 WAT 5788 77.297 85.022 125.999 1.00 0.00 H TER 32833 WAT 5788 ATOM 32833 O WAT 5789 37.221 36.581 75.350 1.00 0.00 O ATOM 32834 H1 WAT 5789 38.047 36.194 75.057 1.00 0.00 H ATOM 32835 H2 WAT 5789 36.985 36.079 76.130 1.00 0.00 H TER 32837 WAT 5789 ATOM 32837 O WAT 5790 42.417 28.846 13.963 1.00 0.00 O ATOM 32838 H1 WAT 5790 43.131 29.483 13.953 1.00 0.00 H ATOM 32839 H2 WAT 5790 42.851 27.998 13.875 1.00 0.00 H TER 32841 WAT 5790 ATOM 32841 O WAT 5791 62.541 111.978 14.213 1.00 0.00 O ATOM 32842 H1 WAT 5791 62.014 111.798 14.992 1.00 0.00 H ATOM 32843 H2 WAT 5791 62.725 112.916 14.260 1.00 0.00 H TER 32845 WAT 5791 ATOM 32845 O WAT 5792 23.353 9.201 71.568 1.00 0.00 O ATOM 32846 H1 WAT 5792 22.588 9.471 71.059 1.00 0.00 H ATOM 32847 H2 WAT 5792 23.712 8.458 71.083 1.00 0.00 H TER 32849 WAT 5792 ATOM 32849 O WAT 5793 116.100 58.627 74.090 1.00 0.00 O ATOM 32850 H1 WAT 5793 116.453 58.805 73.218 1.00 0.00 H ATOM 32851 H2 WAT 5793 116.652 57.924 74.433 1.00 0.00 H TER 32853 WAT 5793 ATOM 32853 O WAT 5794 105.938 90.170 93.592 1.00 0.00 O ATOM 32854 H1 WAT 5794 105.770 91.106 93.701 1.00 0.00 H ATOM 32855 H2 WAT 5794 105.168 89.743 93.967 1.00 0.00 H TER 32857 WAT 5794 ATOM 32857 O WAT 5795 79.597 4.412 83.554 1.00 0.00 O ATOM 32858 H1 WAT 5795 79.845 3.665 83.009 1.00 0.00 H ATOM 32859 H2 WAT 5795 79.534 4.052 84.439 1.00 0.00 H TER 32861 WAT 5795 ATOM 32861 O WAT 5796 16.919 117.987 72.442 1.00 0.00 O ATOM 32862 H1 WAT 5796 17.771 118.377 72.638 1.00 0.00 H ATOM 32863 H2 WAT 5796 16.339 118.736 72.303 1.00 0.00 H TER 32865 WAT 5796 ATOM 32865 O WAT 5797 29.631 127.020 102.861 1.00 0.00 O ATOM 32866 H1 WAT 5797 28.946 127.660 102.670 1.00 0.00 H ATOM 32867 H2 WAT 5797 29.299 126.198 102.500 1.00 0.00 H TER 32869 WAT 5797 ATOM 32869 O WAT 5798 70.852 62.645 2.628 1.00 0.00 O ATOM 32870 H1 WAT 5798 69.981 62.468 2.982 1.00 0.00 H ATOM 32871 H2 WAT 5798 71.105 61.830 2.195 1.00 0.00 H TER 32873 WAT 5798 ATOM 32873 O WAT 5799 135.162 57.646 156.073 1.00 0.00 O ATOM 32874 H1 WAT 5799 134.707 58.449 155.818 1.00 0.00 H ATOM 32875 H2 WAT 5799 134.768 57.405 156.912 1.00 0.00 H TER 32877 WAT 5799 ATOM 32877 O WAT 5800 51.379 15.494 136.667 1.00 0.00 O ATOM 32878 H1 WAT 5800 51.856 14.665 136.696 1.00 0.00 H ATOM 32879 H2 WAT 5800 50.833 15.484 137.453 1.00 0.00 H TER 32881 WAT 5800 ATOM 32881 O WAT 5801 35.961 41.295 71.712 1.00 0.00 O ATOM 32882 H1 WAT 5801 36.400 40.514 71.376 1.00 0.00 H ATOM 32883 H2 WAT 5801 36.673 41.888 71.949 1.00 0.00 H TER 32885 WAT 5801 ATOM 32885 O WAT 5802 3.393 124.275 121.701 1.00 0.00 O ATOM 32886 H1 WAT 5802 3.742 124.982 122.243 1.00 0.00 H ATOM 32887 H2 WAT 5802 2.688 123.897 122.226 1.00 0.00 H TER 32889 WAT 5802 ATOM 32889 O WAT 5803 90.701 128.287 7.659 1.00 0.00 O ATOM 32890 H1 WAT 5803 91.508 127.772 7.657 1.00 0.00 H ATOM 32891 H2 WAT 5803 90.792 128.872 8.411 1.00 0.00 H TER 32893 WAT 5803 ATOM 32893 O WAT 5804 103.084 43.958 81.834 1.00 0.00 O ATOM 32894 H1 WAT 5804 103.390 43.486 82.609 1.00 0.00 H ATOM 32895 H2 WAT 5804 102.420 44.561 82.167 1.00 0.00 H TER 32897 WAT 5804 ATOM 32897 O WAT 5805 81.915 94.570 63.217 1.00 0.00 O ATOM 32898 H1 WAT 5805 81.380 95.144 62.668 1.00 0.00 H ATOM 32899 H2 WAT 5805 81.903 94.984 64.080 1.00 0.00 H TER 32901 WAT 5805 ATOM 32901 O WAT 5806 141.131 2.703 96.838 1.00 0.00 O ATOM 32902 H1 WAT 5806 141.118 3.370 96.151 1.00 0.00 H ATOM 32903 H2 WAT 5806 140.306 2.827 97.308 1.00 0.00 H TER 32905 WAT 5806 ATOM 32905 O WAT 5807 106.444 84.022 111.634 1.00 0.00 O ATOM 32906 H1 WAT 5807 105.875 84.692 112.013 1.00 0.00 H ATOM 32907 H2 WAT 5807 106.182 83.977 110.715 1.00 0.00 H TER 32909 WAT 5807 ATOM 32909 O WAT 5808 30.450 49.894 63.053 1.00 0.00 O ATOM 32910 H1 WAT 5808 31.205 50.312 63.468 1.00 0.00 H ATOM 32911 H2 WAT 5808 29.978 50.614 62.634 1.00 0.00 H TER 32913 WAT 5808 ATOM 32913 O WAT 5809 22.584 140.937 71.489 1.00 0.00 O ATOM 32914 H1 WAT 5809 23.507 141.192 71.484 1.00 0.00 H ATOM 32915 H2 WAT 5809 22.423 140.602 70.607 1.00 0.00 H TER 32917 WAT 5809 ATOM 32917 O WAT 5810 6.817 46.771 135.007 1.00 0.00 O ATOM 32918 H1 WAT 5810 6.707 46.827 135.956 1.00 0.00 H ATOM 32919 H2 WAT 5810 7.056 47.658 134.741 1.00 0.00 H TER 32921 WAT 5810 ATOM 32921 O WAT 5811 49.544 93.624 103.431 1.00 0.00 O ATOM 32922 H1 WAT 5811 48.915 92.930 103.237 1.00 0.00 H ATOM 32923 H2 WAT 5811 49.295 93.936 104.301 1.00 0.00 H TER 32925 WAT 5811 ATOM 32925 O WAT 5812 130.212 93.609 81.055 1.00 0.00 O ATOM 32926 H1 WAT 5812 130.250 92.916 80.397 1.00 0.00 H ATOM 32927 H2 WAT 5812 129.321 93.954 80.989 1.00 0.00 H TER 32929 WAT 5812 ATOM 32929 O WAT 5813 142.461 5.679 12.456 1.00 0.00 O ATOM 32930 H1 WAT 5813 141.809 5.003 12.267 1.00 0.00 H ATOM 32931 H2 WAT 5813 142.468 5.745 13.411 1.00 0.00 H TER 32933 WAT 5813 ATOM 32933 O WAT 5814 5.470 20.627 81.403 1.00 0.00 O ATOM 32934 H1 WAT 5814 5.401 21.540 81.682 1.00 0.00 H ATOM 32935 H2 WAT 5814 5.265 20.646 80.468 1.00 0.00 H TER 32937 WAT 5814 ATOM 32937 O WAT 5815 77.759 64.330 83.556 1.00 0.00 O ATOM 32938 H1 WAT 5815 78.527 64.714 83.133 1.00 0.00 H ATOM 32939 H2 WAT 5815 77.400 63.731 82.901 1.00 0.00 H TER 32941 WAT 5815 ATOM 32941 O WAT 5816 70.244 136.922 157.356 1.00 0.00 O ATOM 32942 H1 WAT 5816 70.971 137.517 157.542 1.00 0.00 H ATOM 32943 H2 WAT 5816 70.248 136.303 158.087 1.00 0.00 H TER 32945 WAT 5816 ATOM 32945 O WAT 5817 90.610 37.462 67.851 1.00 0.00 O ATOM 32946 H1 WAT 5817 90.646 38.122 68.543 1.00 0.00 H ATOM 32947 H2 WAT 5817 91.027 36.690 68.235 1.00 0.00 H TER 32949 WAT 5817 ATOM 32949 O WAT 5818 36.616 135.501 140.335 1.00 0.00 O ATOM 32950 H1 WAT 5818 35.882 135.186 139.808 1.00 0.00 H ATOM 32951 H2 WAT 5818 37.386 135.355 139.785 1.00 0.00 H TER 32953 WAT 5818 ATOM 32953 O WAT 5819 7.703 28.485 85.991 1.00 0.00 O ATOM 32954 H1 WAT 5819 8.189 29.017 86.622 1.00 0.00 H ATOM 32955 H2 WAT 5819 7.189 29.119 85.491 1.00 0.00 H TER 32957 WAT 5819 ATOM 32957 O WAT 5820 29.096 141.269 64.403 1.00 0.00 O ATOM 32958 H1 WAT 5820 28.240 141.603 64.670 1.00 0.00 H ATOM 32959 H2 WAT 5820 29.648 141.377 65.178 1.00 0.00 H TER 32961 WAT 5820 ATOM 32961 O WAT 5821 16.410 17.768 121.575 1.00 0.00 O ATOM 32962 H1 WAT 5821 15.542 17.390 121.721 1.00 0.00 H ATOM 32963 H2 WAT 5821 17.010 17.027 121.655 1.00 0.00 H TER 32965 WAT 5821 ATOM 32965 O WAT 5822 72.581 39.676 16.964 1.00 0.00 O ATOM 32966 H1 WAT 5822 73.160 39.218 16.354 1.00 0.00 H ATOM 32967 H2 WAT 5822 72.356 39.018 17.621 1.00 0.00 H TER 32969 WAT 5822 ATOM 32969 O WAT 5823 64.430 95.564 101.411 1.00 0.00 O ATOM 32970 H1 WAT 5823 63.694 95.632 100.803 1.00 0.00 H ATOM 32971 H2 WAT 5823 64.088 95.054 102.145 1.00 0.00 H TER 32973 WAT 5823 ATOM 32973 O WAT 5824 5.929 59.304 131.445 1.00 0.00 O ATOM 32974 H1 WAT 5824 5.981 59.705 130.578 1.00 0.00 H ATOM 32975 H2 WAT 5824 5.630 60.010 132.018 1.00 0.00 H TER 32977 WAT 5824 ATOM 32977 O WAT 5825 25.329 107.234 105.006 1.00 0.00 O ATOM 32978 H1 WAT 5825 25.934 107.165 104.268 1.00 0.00 H ATOM 32979 H2 WAT 5825 24.979 106.350 105.112 1.00 0.00 H TER 32981 WAT 5825 ATOM 32981 O WAT 5826 41.260 61.996 63.271 1.00 0.00 O ATOM 32982 H1 WAT 5826 40.624 62.480 62.745 1.00 0.00 H ATOM 32983 H2 WAT 5826 40.739 61.341 63.735 1.00 0.00 H TER 32985 WAT 5826 ATOM 32985 O WAT 5827 47.965 34.760 134.084 1.00 0.00 O ATOM 32986 H1 WAT 5827 47.124 34.325 133.948 1.00 0.00 H ATOM 32987 H2 WAT 5827 47.842 35.276 134.881 1.00 0.00 H TER 32989 WAT 5827 ATOM 32989 O WAT 5828 11.381 141.047 128.479 1.00 0.00 O ATOM 32990 H1 WAT 5828 12.002 140.914 129.195 1.00 0.00 H ATOM 32991 H2 WAT 5828 11.482 140.272 127.927 1.00 0.00 H TER 32993 WAT 5828 ATOM 32993 O WAT 5829 131.539 25.876 150.001 1.00 0.00 O ATOM 32994 H1 WAT 5829 132.458 26.132 150.081 1.00 0.00 H ATOM 32995 H2 WAT 5829 131.072 26.700 149.859 1.00 0.00 H TER 32997 WAT 5829 ATOM 32997 O WAT 5830 37.666 136.245 101.725 1.00 0.00 O ATOM 32998 H1 WAT 5830 36.844 135.968 101.319 1.00 0.00 H ATOM 32999 H2 WAT 5830 37.569 136.008 102.648 1.00 0.00 H TER 33001 WAT 5830 ATOM 33001 O WAT 5831 133.392 61.166 104.791 1.00 0.00 O ATOM 33002 H1 WAT 5831 133.829 60.993 105.625 1.00 0.00 H ATOM 33003 H2 WAT 5831 134.043 60.934 104.128 1.00 0.00 H TER 33005 WAT 5831 ATOM 33005 O WAT 5832 85.739 133.724 3.170 1.00 0.00 O ATOM 33006 H1 WAT 5832 86.508 134.118 3.582 1.00 0.00 H ATOM 33007 H2 WAT 5832 85.004 134.006 3.715 1.00 0.00 H TER 33009 WAT 5832 ATOM 33009 O WAT 5833 135.425 16.835 20.930 1.00 0.00 O ATOM 33010 H1 WAT 5833 135.760 17.513 20.344 1.00 0.00 H ATOM 33011 H2 WAT 5833 134.616 17.204 21.285 1.00 0.00 H TER 33013 WAT 5833 ATOM 33013 O WAT 5834 3.425 2.300 126.111 1.00 0.00 O ATOM 33014 H1 WAT 5834 3.374 1.352 125.992 1.00 0.00 H ATOM 33015 H2 WAT 5834 3.701 2.413 127.021 1.00 0.00 H TER 33017 WAT 5834 ATOM 33017 O WAT 5835 17.743 117.112 122.163 1.00 0.00 O ATOM 33018 H1 WAT 5835 17.445 117.735 122.826 1.00 0.00 H ATOM 33019 H2 WAT 5835 18.604 116.828 122.471 1.00 0.00 H TER 33021 WAT 5835 ATOM 33021 O WAT 5836 1.339 17.242 135.785 1.00 0.00 O ATOM 33022 H1 WAT 5836 1.857 16.847 136.486 1.00 0.00 H ATOM 33023 H2 WAT 5836 1.655 16.820 134.987 1.00 0.00 H TER 33025 WAT 5836 ATOM 33025 O WAT 5837 51.166 115.855 130.629 1.00 0.00 O ATOM 33026 H1 WAT 5837 50.752 115.621 131.460 1.00 0.00 H ATOM 33027 H2 WAT 5837 50.555 116.469 130.222 1.00 0.00 H TER 33029 WAT 5837 ATOM 33029 O WAT 5838 90.000 1.756 62.105 1.00 0.00 O ATOM 33030 H1 WAT 5838 89.823 2.112 61.234 1.00 0.00 H ATOM 33031 H2 WAT 5838 90.915 1.478 62.069 1.00 0.00 H TER 33033 WAT 5838 ATOM 33033 O WAT 5839 125.578 102.554 81.916 1.00 0.00 O ATOM 33034 H1 WAT 5839 125.513 101.798 82.499 1.00 0.00 H ATOM 33035 H2 WAT 5839 126.378 103.001 82.192 1.00 0.00 H TER 33037 WAT 5839 ATOM 33037 O WAT 5840 30.647 141.720 0.592 1.00 0.00 O ATOM 33038 H1 WAT 5840 31.479 141.526 1.023 1.00 0.00 H ATOM 33039 H2 WAT 5840 30.685 141.233 -0.232 1.00 0.00 H TER 33041 WAT 5840 ATOM 33041 O WAT 5841 102.472 118.084 86.536 1.00 0.00 O ATOM 33042 H1 WAT 5841 101.730 117.671 86.976 1.00 0.00 H ATOM 33043 H2 WAT 5841 103.123 117.387 86.456 1.00 0.00 H TER 33045 WAT 5841 ATOM 33045 O WAT 5842 70.651 139.138 92.803 1.00 0.00 O ATOM 33046 H1 WAT 5842 71.026 139.819 93.361 1.00 0.00 H ATOM 33047 H2 WAT 5842 70.690 139.503 91.919 1.00 0.00 H TER 33049 WAT 5842 ATOM 33049 O WAT 5843 114.950 42.912 112.143 1.00 0.00 O ATOM 33050 H1 WAT 5843 115.188 42.334 111.419 1.00 0.00 H ATOM 33051 H2 WAT 5843 115.746 42.974 112.671 1.00 0.00 H TER 33053 WAT 5843 ATOM 33053 O WAT 5844 16.094 114.999 122.957 1.00 0.00 O ATOM 33054 H1 WAT 5844 16.470 115.691 122.413 1.00 0.00 H ATOM 33055 H2 WAT 5844 15.148 115.100 122.851 1.00 0.00 H TER 33057 WAT 5844 ATOM 33057 O WAT 5845 56.154 123.546 126.244 1.00 0.00 O ATOM 33058 H1 WAT 5845 56.072 122.834 125.610 1.00 0.00 H ATOM 33059 H2 WAT 5845 56.285 123.105 127.084 1.00 0.00 H TER 33061 WAT 5845 ATOM 33061 O WAT 5846 54.580 101.369 114.792 1.00 0.00 O ATOM 33062 H1 WAT 5846 54.682 102.105 115.395 1.00 0.00 H ATOM 33063 H2 WAT 5846 55.467 101.027 114.680 1.00 0.00 H TER 33065 WAT 5846 ATOM 33065 O WAT 5847 121.974 135.469 155.340 1.00 0.00 O ATOM 33066 H1 WAT 5847 122.907 135.254 155.355 1.00 0.00 H ATOM 33067 H2 WAT 5847 121.590 134.828 154.741 1.00 0.00 H TER 33069 WAT 5847 ATOM 33069 O WAT 5848 34.419 19.667 66.983 1.00 0.00 O ATOM 33070 H1 WAT 5848 34.837 18.920 67.411 1.00 0.00 H ATOM 33071 H2 WAT 5848 35.126 20.089 66.494 1.00 0.00 H TER 33073 WAT 5848 ATOM 33073 O WAT 5849 47.288 17.989 139.024 1.00 0.00 O ATOM 33074 H1 WAT 5849 46.689 17.397 139.480 1.00 0.00 H ATOM 33075 H2 WAT 5849 46.790 18.297 138.267 1.00 0.00 H TER 33077 WAT 5849 ATOM 33077 O WAT 5850 19.381 68.203 10.887 1.00 0.00 O ATOM 33078 H1 WAT 5850 18.838 68.990 10.842 1.00 0.00 H ATOM 33079 H2 WAT 5850 19.645 68.146 11.805 1.00 0.00 H TER 33081 WAT 5850 ATOM 33081 O WAT 5851 126.928 125.922 19.780 1.00 0.00 O ATOM 33082 H1 WAT 5851 127.700 126.324 20.178 1.00 0.00 H ATOM 33083 H2 WAT 5851 126.619 125.295 20.435 1.00 0.00 H TER 33085 WAT 5851 ATOM 33085 O WAT 5852 85.596 131.413 157.314 1.00 0.00 O ATOM 33086 H1 WAT 5852 84.664 131.236 157.185 1.00 0.00 H ATOM 33087 H2 WAT 5852 85.618 132.123 157.955 1.00 0.00 H TER 33089 WAT 5852 ATOM 33089 O WAT 5853 4.715 92.963 109.943 1.00 0.00 O ATOM 33090 H1 WAT 5853 4.027 92.770 110.580 1.00 0.00 H ATOM 33091 H2 WAT 5853 5.378 92.289 110.094 1.00 0.00 H TER 33093 WAT 5853 ATOM 33093 O WAT 5854 36.032 4.934 20.452 1.00 0.00 O ATOM 33094 H1 WAT 5854 36.034 3.994 20.635 1.00 0.00 H ATOM 33095 H2 WAT 5854 36.939 5.207 20.591 1.00 0.00 H TER 33097 WAT 5854 ATOM 33097 O WAT 5855 82.811 94.056 153.495 1.00 0.00 O ATOM 33098 H1 WAT 5855 81.946 93.784 153.185 1.00 0.00 H ATOM 33099 H2 WAT 5855 82.764 93.963 154.446 1.00 0.00 H TER 33101 WAT 5855 ATOM 33101 O WAT 5856 6.520 13.346 129.625 1.00 0.00 O ATOM 33102 H1 WAT 5856 6.298 14.166 130.066 1.00 0.00 H ATOM 33103 H2 WAT 5856 5.728 12.813 129.698 1.00 0.00 H TER 33105 WAT 5856 ATOM 33105 O WAT 5857 145.009 67.248 67.997 1.00 0.00 O ATOM 33106 H1 WAT 5857 144.188 66.970 67.591 1.00 0.00 H ATOM 33107 H2 WAT 5857 144.991 68.203 67.943 1.00 0.00 H TER 33109 WAT 5857 ATOM 33109 O WAT 5858 51.740 131.384 16.696 1.00 0.00 O ATOM 33110 H1 WAT 5858 52.537 131.912 16.637 1.00 0.00 H ATOM 33111 H2 WAT 5858 51.089 131.975 17.074 1.00 0.00 H TER 33113 WAT 5858 ATOM 33113 O WAT 5859 60.606 84.843 122.478 1.00 0.00 O ATOM 33114 H1 WAT 5859 60.549 85.587 123.077 1.00 0.00 H ATOM 33115 H2 WAT 5859 60.581 84.074 123.048 1.00 0.00 H TER 33117 WAT 5859 ATOM 33117 O WAT 5860 105.381 139.809 116.549 1.00 0.00 O ATOM 33118 H1 WAT 5860 104.705 139.195 116.835 1.00 0.00 H ATOM 33119 H2 WAT 5860 106.154 139.264 116.403 1.00 0.00 H TER 33121 WAT 5860 ATOM 33121 O WAT 5861 60.630 75.303 75.644 1.00 0.00 O ATOM 33122 H1 WAT 5861 59.874 74.851 75.269 1.00 0.00 H ATOM 33123 H2 WAT 5861 60.308 75.663 76.471 1.00 0.00 H TER 33125 WAT 5861 ATOM 33125 O WAT 5862 36.562 106.834 150.094 1.00 0.00 O ATOM 33126 H1 WAT 5862 35.617 106.781 149.953 1.00 0.00 H ATOM 33127 H2 WAT 5862 36.730 106.236 150.822 1.00 0.00 H TER 33129 WAT 5862 ATOM 33129 O WAT 5863 59.544 24.356 95.049 1.00 0.00 O ATOM 33130 H1 WAT 5863 59.139 24.451 94.187 1.00 0.00 H ATOM 33131 H2 WAT 5863 59.580 25.247 95.396 1.00 0.00 H TER 33133 WAT 5863 ATOM 33133 O WAT 5864 78.790 119.086 67.257 1.00 0.00 O ATOM 33134 H1 WAT 5864 78.258 118.290 67.266 1.00 0.00 H ATOM 33135 H2 WAT 5864 78.287 119.704 66.728 1.00 0.00 H TER 33137 WAT 5864 ATOM 33137 O WAT 5865 78.571 98.780 16.692 1.00 0.00 O ATOM 33138 H1 WAT 5865 79.030 99.017 15.886 1.00 0.00 H ATOM 33139 H2 WAT 5865 79.169 99.040 17.393 1.00 0.00 H TER 33141 WAT 5865 ATOM 33141 O WAT 5866 70.806 105.356 158.327 1.00 0.00 O ATOM 33142 H1 WAT 5866 70.146 104.825 158.772 1.00 0.00 H ATOM 33143 H2 WAT 5866 71.517 104.744 158.136 1.00 0.00 H TER 33145 WAT 5866 ATOM 33145 O WAT 5867 135.108 12.441 65.612 1.00 0.00 O ATOM 33146 H1 WAT 5867 136.005 12.238 65.876 1.00 0.00 H ATOM 33147 H2 WAT 5867 134.941 11.863 64.868 1.00 0.00 H TER 33149 WAT 5867 ATOM 33149 O WAT 5868 57.425 145.130 5.820 1.00 0.00 O ATOM 33150 H1 WAT 5868 58.216 145.471 6.237 1.00 0.00 H ATOM 33151 H2 WAT 5868 56.963 145.909 5.510 1.00 0.00 H TER 33153 WAT 5868 ATOM 33153 O WAT 5869 88.877 2.014 68.050 1.00 0.00 O ATOM 33154 H1 WAT 5869 88.454 2.543 67.375 1.00 0.00 H ATOM 33155 H2 WAT 5869 88.157 1.708 68.601 1.00 0.00 H TER 33157 WAT 5869 ATOM 33157 O WAT 5870 107.552 9.022 145.417 1.00 0.00 O ATOM 33158 H1 WAT 5870 107.931 9.309 146.248 1.00 0.00 H ATOM 33159 H2 WAT 5870 106.845 9.645 145.248 1.00 0.00 H TER 33161 WAT 5870 ATOM 33161 O WAT 5871 44.081 110.914 73.042 1.00 0.00 O ATOM 33162 H1 WAT 5871 44.143 109.967 72.914 1.00 0.00 H ATOM 33163 H2 WAT 5871 44.929 111.162 73.409 1.00 0.00 H TER 33165 WAT 5871 ATOM 33165 O WAT 5872 89.268 112.074 5.625 1.00 0.00 O ATOM 33166 H1 WAT 5872 88.562 112.663 5.359 1.00 0.00 H ATOM 33167 H2 WAT 5872 90.067 112.586 5.499 1.00 0.00 H TER 33169 WAT 5872 ATOM 33169 O WAT 5873 143.267 87.089 135.355 1.00 0.00 O ATOM 33170 H1 WAT 5873 142.495 86.544 135.202 1.00 0.00 H ATOM 33171 H2 WAT 5873 143.013 87.957 135.042 1.00 0.00 H TER 33173 WAT 5873 ATOM 33173 O WAT 5874 38.763 145.875 154.109 1.00 0.00 O ATOM 33174 H1 WAT 5874 39.432 146.550 153.992 1.00 0.00 H ATOM 33175 H2 WAT 5874 39.208 145.176 154.588 1.00 0.00 H TER 33177 WAT 5874 ATOM 33177 O WAT 5875 47.984 145.488 26.125 1.00 0.00 O ATOM 33178 H1 WAT 5875 47.061 145.626 26.340 1.00 0.00 H ATOM 33179 H2 WAT 5875 48.014 144.607 25.751 1.00 0.00 H TER 33181 WAT 5875 ATOM 33181 O WAT 5876 38.491 72.537 74.105 1.00 0.00 O ATOM 33182 H1 WAT 5876 38.700 72.068 73.297 1.00 0.00 H ATOM 33183 H2 WAT 5876 38.213 71.854 74.714 1.00 0.00 H TER 33185 WAT 5876 ATOM 33185 O WAT 5877 54.177 110.145 152.340 1.00 0.00 O ATOM 33186 H1 WAT 5877 54.271 109.680 153.170 1.00 0.00 H ATOM 33187 H2 WAT 5877 53.247 110.371 152.296 1.00 0.00 H TER 33189 WAT 5877 ATOM 33189 O WAT 5878 62.608 108.002 12.560 1.00 0.00 O ATOM 33190 H1 WAT 5878 62.063 108.521 13.151 1.00 0.00 H ATOM 33191 H2 WAT 5878 62.041 107.816 11.812 1.00 0.00 H TER 33193 WAT 5878 ATOM 33193 O WAT 5879 98.457 117.377 11.404 1.00 0.00 O ATOM 33194 H1 WAT 5879 98.844 116.569 11.742 1.00 0.00 H ATOM 33195 H2 WAT 5879 98.875 117.504 10.552 1.00 0.00 H TER 33197 WAT 5879 ATOM 33197 O WAT 5880 145.569 79.489 19.358 1.00 0.00 O ATOM 33198 H1 WAT 5880 145.296 79.253 20.244 1.00 0.00 H ATOM 33199 H2 WAT 5880 145.873 80.393 19.433 1.00 0.00 H TER 33201 WAT 5880 ATOM 33201 O WAT 5881 88.335 116.185 132.496 1.00 0.00 O ATOM 33202 H1 WAT 5881 87.654 116.599 131.966 1.00 0.00 H ATOM 33203 H2 WAT 5881 89.096 116.142 131.916 1.00 0.00 H TER 33205 WAT 5881 ATOM 33205 O WAT 5882 143.502 111.725 78.559 1.00 0.00 O ATOM 33206 H1 WAT 5882 142.652 112.153 78.457 1.00 0.00 H ATOM 33207 H2 WAT 5882 143.857 111.682 77.672 1.00 0.00 H TER 33209 WAT 5882 ATOM 33209 O WAT 5883 145.598 75.156 128.140 1.00 0.00 O ATOM 33210 H1 WAT 5883 145.703 74.952 127.211 1.00 0.00 H ATOM 33211 H2 WAT 5883 144.980 74.499 128.461 1.00 0.00 H TER 33213 WAT 5883 ATOM 33213 O WAT 5884 1.481 18.105 103.012 1.00 0.00 O ATOM 33214 H1 WAT 5884 1.095 18.883 103.414 1.00 0.00 H ATOM 33215 H2 WAT 5884 0.765 17.716 102.508 1.00 0.00 H TER 33217 WAT 5884 ATOM 33217 O WAT 5885 124.458 22.990 115.814 1.00 0.00 O ATOM 33218 H1 WAT 5885 124.813 22.213 116.246 1.00 0.00 H ATOM 33219 H2 WAT 5885 125.224 23.431 115.447 1.00 0.00 H TER 33221 WAT 5885 ATOM 33221 O WAT 5886 63.939 75.500 96.123 1.00 0.00 O ATOM 33222 H1 WAT 5886 64.148 74.568 96.055 1.00 0.00 H ATOM 33223 H2 WAT 5886 64.468 75.811 96.858 1.00 0.00 H TER 33225 WAT 5886 ATOM 33225 O WAT 5887 111.508 136.576 12.123 1.00 0.00 O ATOM 33226 H1 WAT 5887 110.658 136.830 11.763 1.00 0.00 H ATOM 33227 H2 WAT 5887 111.302 135.906 12.775 1.00 0.00 H TER 33229 WAT 5887 ATOM 33229 O WAT 5888 91.016 43.881 141.843 1.00 0.00 O ATOM 33230 H1 WAT 5888 90.212 44.124 141.383 1.00 0.00 H ATOM 33231 H2 WAT 5888 91.650 44.550 141.586 1.00 0.00 H TER 33233 WAT 5888 ATOM 33233 O WAT 5889 80.101 111.609 154.438 1.00 0.00 O ATOM 33234 H1 WAT 5889 79.307 111.930 154.010 1.00 0.00 H ATOM 33235 H2 WAT 5889 79.791 111.214 155.253 1.00 0.00 H TER 33237 WAT 5889 ATOM 33237 O WAT 5890 145.666 39.085 78.833 1.00 0.00 O ATOM 33238 H1 WAT 5890 145.407 39.994 78.680 1.00 0.00 H ATOM 33239 H2 WAT 5890 145.522 38.650 77.993 1.00 0.00 H TER 33241 WAT 5890 ATOM 33241 O WAT 5891 125.821 34.562 145.992 1.00 0.00 O ATOM 33242 H1 WAT 5891 125.523 33.901 145.367 1.00 0.00 H ATOM 33243 H2 WAT 5891 126.149 34.058 146.737 1.00 0.00 H TER 33245 WAT 5891 ATOM 33245 O WAT 5892 74.383 9.058 116.184 1.00 0.00 O ATOM 33246 H1 WAT 5892 73.866 9.340 115.429 1.00 0.00 H ATOM 33247 H2 WAT 5892 73.985 9.509 116.929 1.00 0.00 H TER 33249 WAT 5892 ATOM 33249 O WAT 5893 115.911 21.242 149.296 1.00 0.00 O ATOM 33250 H1 WAT 5893 116.848 21.209 149.486 1.00 0.00 H ATOM 33251 H2 WAT 5893 115.506 21.494 150.126 1.00 0.00 H TER 33253 WAT 5893 ATOM 33253 O WAT 5894 90.701 104.197 138.574 1.00 0.00 O ATOM 33254 H1 WAT 5894 91.550 104.494 138.248 1.00 0.00 H ATOM 33255 H2 WAT 5894 90.247 105.001 138.828 1.00 0.00 H TER 33257 WAT 5894 ATOM 33257 O WAT 5895 122.929 20.223 93.589 1.00 0.00 O ATOM 33258 H1 WAT 5895 123.753 20.436 94.026 1.00 0.00 H ATOM 33259 H2 WAT 5895 122.498 21.069 93.464 1.00 0.00 H TER 33261 WAT 5895 ATOM 33261 O WAT 5896 123.607 66.658 22.021 1.00 0.00 O ATOM 33262 H1 WAT 5896 122.695 66.948 22.018 1.00 0.00 H ATOM 33263 H2 WAT 5896 123.743 66.304 22.900 1.00 0.00 H TER 33265 WAT 5896 ATOM 33265 O WAT 5897 104.817 36.671 147.564 1.00 0.00 O ATOM 33266 H1 WAT 5897 104.503 35.830 147.233 1.00 0.00 H ATOM 33267 H2 WAT 5897 105.504 36.442 148.189 1.00 0.00 H TER 33269 WAT 5897 ATOM 33269 O WAT 5898 40.195 19.552 116.683 1.00 0.00 O ATOM 33270 H1 WAT 5898 40.457 20.218 117.319 1.00 0.00 H ATOM 33271 H2 WAT 5898 39.632 18.956 117.177 1.00 0.00 H TER 33273 WAT 5898 ATOM 33273 O WAT 5899 38.305 128.489 55.887 1.00 0.00 O ATOM 33274 H1 WAT 5899 37.389 128.766 55.922 1.00 0.00 H ATOM 33275 H2 WAT 5899 38.442 128.011 56.705 1.00 0.00 H TER 33277 WAT 5899 ATOM 33277 O WAT 5900 119.210 130.142 99.137 1.00 0.00 O ATOM 33278 H1 WAT 5900 119.759 129.499 98.687 1.00 0.00 H ATOM 33279 H2 WAT 5900 118.572 129.616 99.619 1.00 0.00 H TER 33281 WAT 5900 ATOM 33281 O WAT 5901 100.898 112.258 98.795 1.00 0.00 O ATOM 33282 H1 WAT 5901 101.380 111.631 98.256 1.00 0.00 H ATOM 33283 H2 WAT 5901 101.227 112.113 99.682 1.00 0.00 H TER 33285 WAT 5901 ATOM 33285 O WAT 5902 77.807 37.276 135.240 1.00 0.00 O ATOM 33286 H1 WAT 5902 77.307 36.524 134.921 1.00 0.00 H ATOM 33287 H2 WAT 5902 78.442 36.901 135.849 1.00 0.00 H TER 33289 WAT 5902 ATOM 33289 O WAT 5903 41.232 122.487 125.796 1.00 0.00 O ATOM 33290 H1 WAT 5903 41.670 122.018 125.085 1.00 0.00 H ATOM 33291 H2 WAT 5903 41.613 123.365 125.774 1.00 0.00 H TER 33293 WAT 5903 ATOM 33293 O WAT 5904 20.156 142.063 107.749 1.00 0.00 O ATOM 33294 H1 WAT 5904 19.793 142.092 108.634 1.00 0.00 H ATOM 33295 H2 WAT 5904 20.794 141.349 107.775 1.00 0.00 H TER 33297 WAT 5904 ATOM 33297 O WAT 5905 13.434 29.705 136.397 1.00 0.00 O ATOM 33298 H1 WAT 5905 14.157 29.082 136.328 1.00 0.00 H ATOM 33299 H2 WAT 5905 13.779 30.515 136.023 1.00 0.00 H TER 33301 WAT 5905 ATOM 33301 O WAT 5906 27.490 134.860 72.282 1.00 0.00 O ATOM 33302 H1 WAT 5906 28.285 135.295 72.591 1.00 0.00 H ATOM 33303 H2 WAT 5906 27.191 135.400 71.550 1.00 0.00 H TER 33305 WAT 5906 ATOM 33305 O WAT 5907 87.320 39.811 80.493 1.00 0.00 O ATOM 33306 H1 WAT 5907 86.410 39.892 80.207 1.00 0.00 H ATOM 33307 H2 WAT 5907 87.822 39.746 79.680 1.00 0.00 H TER 33309 WAT 5907 ATOM 33309 O WAT 5908 36.693 29.529 103.107 1.00 0.00 O ATOM 33310 H1 WAT 5908 37.190 28.765 102.816 1.00 0.00 H ATOM 33311 H2 WAT 5908 36.092 29.185 103.769 1.00 0.00 H TER 33313 WAT 5908 ATOM 33313 O WAT 5909 138.258 67.672 139.619 1.00 0.00 O ATOM 33314 H1 WAT 5909 137.965 66.924 140.138 1.00 0.00 H ATOM 33315 H2 WAT 5909 138.176 68.421 140.209 1.00 0.00 H TER 33317 WAT 5909 ATOM 33317 O WAT 5910 101.697 143.581 20.625 1.00 0.00 O ATOM 33318 H1 WAT 5910 102.564 143.866 20.915 1.00 0.00 H ATOM 33319 H2 WAT 5910 101.175 143.551 21.427 1.00 0.00 H TER 33321 WAT 5910 ATOM 33321 O WAT 5911 27.724 90.900 79.518 1.00 0.00 O ATOM 33322 H1 WAT 5911 28.557 90.518 79.795 1.00 0.00 H ATOM 33323 H2 WAT 5911 27.178 90.880 80.304 1.00 0.00 H TER 33325 WAT 5911 ATOM 33325 O WAT 5912 106.699 35.523 64.567 1.00 0.00 O ATOM 33326 H1 WAT 5912 107.354 35.665 65.250 1.00 0.00 H ATOM 33327 H2 WAT 5912 107.141 34.971 63.922 1.00 0.00 H TER 33329 WAT 5912 ATOM 33329 O WAT 5913 53.087 86.034 28.337 1.00 0.00 O ATOM 33330 H1 WAT 5913 52.264 86.106 27.855 1.00 0.00 H ATOM 33331 H2 WAT 5913 53.020 85.200 28.802 1.00 0.00 H TER 33333 WAT 5913 ATOM 33333 O WAT 5914 145.456 3.169 124.026 1.00 0.00 O ATOM 33334 H1 WAT 5914 145.703 2.479 123.410 1.00 0.00 H ATOM 33335 H2 WAT 5914 145.905 2.936 124.839 1.00 0.00 H TER 33337 WAT 5914 ATOM 33337 O WAT 5915 42.399 25.669 110.440 1.00 0.00 O ATOM 33338 H1 WAT 5915 41.639 25.661 111.022 1.00 0.00 H ATOM 33339 H2 WAT 5915 43.036 25.098 110.871 1.00 0.00 H TER 33341 WAT 5915 ATOM 33341 O WAT 5916 4.684 137.892 151.939 1.00 0.00 O ATOM 33342 H1 WAT 5916 5.341 137.205 151.831 1.00 0.00 H ATOM 33343 H2 WAT 5916 5.183 138.660 152.215 1.00 0.00 H TER 33345 WAT 5916 ATOM 33345 O WAT 5917 4.935 5.692 70.529 1.00 0.00 O ATOM 33346 H1 WAT 5917 4.200 6.119 70.968 1.00 0.00 H ATOM 33347 H2 WAT 5917 5.407 6.407 70.101 1.00 0.00 H TER 33349 WAT 5917 ATOM 33349 O WAT 5918 73.140 118.880 136.132 1.00 0.00 O ATOM 33350 H1 WAT 5918 72.593 118.313 136.677 1.00 0.00 H ATOM 33351 H2 WAT 5918 72.713 119.735 136.173 1.00 0.00 H TER 33353 WAT 5918 ATOM 33353 O WAT 5919 64.883 8.151 51.752 1.00 0.00 O ATOM 33354 H1 WAT 5919 64.684 7.756 52.601 1.00 0.00 H ATOM 33355 H2 WAT 5919 64.984 9.084 51.941 1.00 0.00 H TER 33357 WAT 5919 ATOM 33357 O WAT 5920 70.347 47.858 80.531 1.00 0.00 O ATOM 33358 H1 WAT 5920 70.733 48.235 79.741 1.00 0.00 H ATOM 33359 H2 WAT 5920 69.619 47.325 80.211 1.00 0.00 H TER 33361 WAT 5920 ATOM 33361 O WAT 5921 77.926 123.102 88.127 1.00 0.00 O ATOM 33362 H1 WAT 5921 77.541 123.686 88.781 1.00 0.00 H ATOM 33363 H2 WAT 5921 77.179 122.790 87.617 1.00 0.00 H TER 33365 WAT 5921 ATOM 33365 O WAT 5922 132.892 66.059 153.749 1.00 0.00 O ATOM 33366 H1 WAT 5922 132.155 66.207 153.156 1.00 0.00 H ATOM 33367 H2 WAT 5922 132.654 65.269 154.235 1.00 0.00 H TER 33369 WAT 5922 ATOM 33369 O WAT 5923 89.557 133.973 130.015 1.00 0.00 O ATOM 33370 H1 WAT 5923 89.596 134.926 130.097 1.00 0.00 H ATOM 33371 H2 WAT 5923 89.634 133.652 130.914 1.00 0.00 H TER 33373 WAT 5923 ATOM 33373 O WAT 5924 136.002 43.379 151.323 1.00 0.00 O ATOM 33374 H1 WAT 5924 136.682 42.758 151.584 1.00 0.00 H ATOM 33375 H2 WAT 5924 136.038 43.386 150.367 1.00 0.00 H TER 33377 WAT 5924 ATOM 33377 O WAT 5925 31.852 118.908 137.922 1.00 0.00 O ATOM 33378 H1 WAT 5925 32.007 118.089 138.394 1.00 0.00 H ATOM 33379 H2 WAT 5925 32.724 119.198 137.654 1.00 0.00 H TER 33381 WAT 5925 ATOM 33381 O WAT 5926 17.361 107.132 7.562 1.00 0.00 O ATOM 33382 H1 WAT 5926 17.345 106.564 8.332 1.00 0.00 H ATOM 33383 H2 WAT 5926 17.517 108.008 7.914 1.00 0.00 H TER 33385 WAT 5926 ATOM 33385 O WAT 5927 40.235 112.573 150.814 1.00 0.00 O ATOM 33386 H1 WAT 5927 40.874 113.273 150.945 1.00 0.00 H ATOM 33387 H2 WAT 5927 39.697 112.588 151.607 1.00 0.00 H TER 33389 WAT 5927 ATOM 33389 O WAT 5928 104.129 36.546 95.622 1.00 0.00 O ATOM 33390 H1 WAT 5928 103.573 36.782 96.364 1.00 0.00 H ATOM 33391 H2 WAT 5928 104.303 37.376 95.179 1.00 0.00 H TER 33393 WAT 5928 ATOM 33393 O WAT 5929 118.182 68.692 80.832 1.00 0.00 O ATOM 33394 H1 WAT 5929 119.006 68.310 81.137 1.00 0.00 H ATOM 33395 H2 WAT 5929 117.649 67.938 80.578 1.00 0.00 H TER 33397 WAT 5929 ATOM 33397 O WAT 5930 56.754 20.303 79.425 1.00 0.00 O ATOM 33398 H1 WAT 5930 57.297 20.288 80.213 1.00 0.00 H ATOM 33399 H2 WAT 5930 56.018 19.726 79.630 1.00 0.00 H TER 33401 WAT 5930 ATOM 33401 O WAT 5931 133.778 73.460 110.793 1.00 0.00 O ATOM 33402 H1 WAT 5931 133.829 72.746 111.428 1.00 0.00 H ATOM 33403 H2 WAT 5931 132.935 73.333 110.358 1.00 0.00 H TER 33405 WAT 5931 ATOM 33405 O WAT 5932 131.975 82.036 90.174 1.00 0.00 O ATOM 33406 H1 WAT 5932 131.832 81.605 89.331 1.00 0.00 H ATOM 33407 H2 WAT 5932 132.299 81.340 90.746 1.00 0.00 H TER 33409 WAT 5932 ATOM 33409 O WAT 5933 9.623 121.395 69.850 1.00 0.00 O ATOM 33410 H1 WAT 5933 9.400 122.309 70.031 1.00 0.00 H ATOM 33411 H2 WAT 5933 9.759 121.007 70.714 1.00 0.00 H TER 33413 WAT 5933 ATOM 33413 O WAT 5934 51.207 110.377 141.070 1.00 0.00 O ATOM 33414 H1 WAT 5934 50.856 110.682 140.233 1.00 0.00 H ATOM 33415 H2 WAT 5934 50.533 109.791 141.413 1.00 0.00 H TER 33417 WAT 5934 ATOM 33417 O WAT 5935 12.367 66.670 70.604 1.00 0.00 O ATOM 33418 H1 WAT 5935 11.802 65.910 70.745 1.00 0.00 H ATOM 33419 H2 WAT 5935 12.196 66.929 69.698 1.00 0.00 H TER 33421 WAT 5935 ATOM 33421 O WAT 5936 0.352 92.019 3.204 1.00 0.00 O ATOM 33422 H1 WAT 5936 -0.362 92.438 3.683 1.00 0.00 H ATOM 33423 H2 WAT 5936 0.743 92.726 2.690 1.00 0.00 H TER 33425 WAT 5936 ATOM 33425 O WAT 5937 120.188 49.367 16.815 1.00 0.00 O ATOM 33426 H1 WAT 5937 120.074 48.741 17.530 1.00 0.00 H ATOM 33427 H2 WAT 5937 119.598 50.088 17.031 1.00 0.00 H TER 33429 WAT 5937 ATOM 33429 O WAT 5938 53.219 102.351 142.701 1.00 0.00 O ATOM 33430 H1 WAT 5938 53.310 102.094 141.784 1.00 0.00 H ATOM 33431 H2 WAT 5938 53.992 101.983 143.131 1.00 0.00 H TER 33433 WAT 5938 ATOM 33433 O WAT 5939 90.645 125.629 1.893 1.00 0.00 O ATOM 33434 H1 WAT 5939 90.945 125.900 2.760 1.00 0.00 H ATOM 33435 H2 WAT 5939 90.691 126.426 1.364 1.00 0.00 H TER 33437 WAT 5939 ATOM 33437 O WAT 5940 85.730 32.626 70.679 1.00 0.00 O ATOM 33438 H1 WAT 5940 86.360 33.323 70.864 1.00 0.00 H ATOM 33439 H2 WAT 5940 86.172 32.065 70.042 1.00 0.00 H TER 33441 WAT 5940 ATOM 33441 O WAT 5941 26.407 29.286 1.560 1.00 0.00 O ATOM 33442 H1 WAT 5941 27.074 29.954 1.716 1.00 0.00 H ATOM 33443 H2 WAT 5941 25.656 29.572 2.080 1.00 0.00 H TER 33445 WAT 5941 ATOM 33445 O WAT 5942 34.705 132.244 118.210 1.00 0.00 O ATOM 33446 H1 WAT 5942 34.490 132.810 117.469 1.00 0.00 H ATOM 33447 H2 WAT 5942 34.154 131.471 118.089 1.00 0.00 H TER 33449 WAT 5942 ATOM 33449 O WAT 5943 16.816 7.570 112.503 1.00 0.00 O ATOM 33450 H1 WAT 5943 17.746 7.769 112.399 1.00 0.00 H ATOM 33451 H2 WAT 5943 16.597 7.893 113.377 1.00 0.00 H TER 33453 WAT 5943 ATOM 33453 O WAT 5944 13.884 110.054 16.619 1.00 0.00 O ATOM 33454 H1 WAT 5944 14.695 109.768 16.200 1.00 0.00 H ATOM 33455 H2 WAT 5944 14.137 110.253 17.521 1.00 0.00 H TER 33457 WAT 5944 ATOM 33457 O WAT 5945 106.510 102.671 150.463 1.00 0.00 O ATOM 33458 H1 WAT 5945 105.634 102.865 150.130 1.00 0.00 H ATOM 33459 H2 WAT 5945 106.817 101.945 149.919 1.00 0.00 H TER 33461 WAT 5945 ATOM 33461 O WAT 5946 66.638 5.859 21.065 1.00 0.00 O ATOM 33462 H1 WAT 5946 67.138 6.190 20.319 1.00 0.00 H ATOM 33463 H2 WAT 5946 65.746 6.170 20.912 1.00 0.00 H TER 33465 WAT 5946 ATOM 33465 O WAT 5947 44.652 18.234 125.400 1.00 0.00 O ATOM 33466 H1 WAT 5947 45.271 18.465 124.707 1.00 0.00 H ATOM 33467 H2 WAT 5947 44.850 18.844 126.110 1.00 0.00 H TER 33469 WAT 5947 ATOM 33469 O WAT 5948 106.408 143.178 58.695 1.00 0.00 O ATOM 33470 H1 WAT 5948 105.931 142.457 59.105 1.00 0.00 H ATOM 33471 H2 WAT 5948 107.330 142.981 58.861 1.00 0.00 H TER 33473 WAT 5948 ATOM 33473 O WAT 5949 82.979 42.714 127.083 1.00 0.00 O ATOM 33474 H1 WAT 5949 83.291 42.634 126.182 1.00 0.00 H ATOM 33475 H2 WAT 5949 83.760 42.582 127.620 1.00 0.00 H TER 33477 WAT 5949 ATOM 33477 O WAT 5950 42.238 6.786 73.325 1.00 0.00 O ATOM 33478 H1 WAT 5950 41.618 7.233 73.901 1.00 0.00 H ATOM 33479 H2 WAT 5950 42.564 7.473 72.744 1.00 0.00 H TER 33481 WAT 5950 ATOM 33481 O WAT 5951 54.308 43.976 82.811 1.00 0.00 O ATOM 33482 H1 WAT 5951 54.004 43.683 83.671 1.00 0.00 H ATOM 33483 H2 WAT 5951 53.717 44.692 82.579 1.00 0.00 H TER 33485 WAT 5951 ATOM 33485 O WAT 5952 84.234 134.067 98.527 1.00 0.00 O ATOM 33486 H1 WAT 5952 83.410 134.267 98.082 1.00 0.00 H ATOM 33487 H2 WAT 5952 84.152 133.148 98.782 1.00 0.00 H TER 33489 WAT 5952 ATOM 33489 O WAT 5953 137.261 122.098 147.484 1.00 0.00 O ATOM 33490 H1 WAT 5953 138.093 121.757 147.157 1.00 0.00 H ATOM 33491 H2 WAT 5953 137.494 122.579 148.278 1.00 0.00 H TER 33493 WAT 5953 ATOM 33493 O WAT 5954 109.487 63.998 28.468 1.00 0.00 O ATOM 33494 H1 WAT 5954 109.254 64.430 27.646 1.00 0.00 H ATOM 33495 H2 WAT 5954 110.052 64.625 28.918 1.00 0.00 H TER 33497 WAT 5954 ATOM 33497 O WAT 5955 77.467 121.657 17.348 1.00 0.00 O ATOM 33498 H1 WAT 5955 77.985 122.461 17.298 1.00 0.00 H ATOM 33499 H2 WAT 5955 76.931 121.766 18.133 1.00 0.00 H TER 33501 WAT 5955 ATOM 33501 O WAT 5956 0.104 92.064 68.989 1.00 0.00 O ATOM 33502 H1 WAT 5956 0.692 92.794 68.796 1.00 0.00 H ATOM 33503 H2 WAT 5956 0.198 91.476 68.239 1.00 0.00 H TER 33505 WAT 5956 ATOM 33505 O WAT 5957 47.001 43.560 113.503 1.00 0.00 O ATOM 33506 H1 WAT 5957 47.541 43.124 112.843 1.00 0.00 H ATOM 33507 H2 WAT 5957 47.138 43.048 114.300 1.00 0.00 H TER 33509 WAT 5957 ATOM 33509 O WAT 5958 19.844 30.184 120.812 1.00 0.00 O ATOM 33510 H1 WAT 5958 20.034 29.250 120.718 1.00 0.00 H ATOM 33511 H2 WAT 5958 20.393 30.607 120.152 1.00 0.00 H TER 33513 WAT 5958 ATOM 33513 O WAT 5959 71.067 23.240 15.096 1.00 0.00 O ATOM 33514 H1 WAT 5959 70.793 23.729 14.320 1.00 0.00 H ATOM 33515 H2 WAT 5959 71.434 23.905 15.680 1.00 0.00 H TER 33517 WAT 5959 ATOM 33517 O WAT 5960 68.177 110.075 87.623 1.00 0.00 O ATOM 33518 H1 WAT 5960 67.885 110.884 88.042 1.00 0.00 H ATOM 33519 H2 WAT 5960 68.462 110.346 86.751 1.00 0.00 H TER 33521 WAT 5960 ATOM 33521 O WAT 5961 18.507 96.910 57.853 1.00 0.00 O ATOM 33522 H1 WAT 5961 17.663 97.302 58.078 1.00 0.00 H ATOM 33523 H2 WAT 5961 18.315 95.980 57.735 1.00 0.00 H TER 33525 WAT 5961 ATOM 33525 O WAT 5962 43.867 51.102 22.731 1.00 0.00 O ATOM 33526 H1 WAT 5962 43.441 51.533 23.472 1.00 0.00 H ATOM 33527 H2 WAT 5962 43.950 51.790 22.070 1.00 0.00 H TER 33529 WAT 5962 ATOM 33529 O WAT 5963 51.357 35.876 126.054 1.00 0.00 O ATOM 33530 H1 WAT 5963 50.798 35.103 125.978 1.00 0.00 H ATOM 33531 H2 WAT 5963 51.226 36.178 126.953 1.00 0.00 H TER 33533 WAT 5963 ATOM 33533 O WAT 5964 55.102 139.303 86.275 1.00 0.00 O ATOM 33534 H1 WAT 5964 54.623 138.506 86.503 1.00 0.00 H ATOM 33535 H2 WAT 5964 55.507 139.105 85.431 1.00 0.00 H TER 33537 WAT 5964 ATOM 33537 O WAT 5965 21.431 134.788 0.956 1.00 0.00 O ATOM 33538 H1 WAT 5965 20.509 135.003 0.814 1.00 0.00 H ATOM 33539 H2 WAT 5965 21.653 135.216 1.783 1.00 0.00 H TER 33541 WAT 5965 ATOM 33541 O WAT 5966 60.724 3.887 116.872 1.00 0.00 O ATOM 33542 H1 WAT 5966 60.239 3.569 116.111 1.00 0.00 H ATOM 33543 H2 WAT 5966 61.376 3.207 117.042 1.00 0.00 H TER 33545 WAT 5966 ATOM 33545 O WAT 5967 69.507 99.243 151.828 1.00 0.00 O ATOM 33546 H1 WAT 5967 69.210 100.055 152.238 1.00 0.00 H ATOM 33547 H2 WAT 5967 69.816 99.510 150.963 1.00 0.00 H TER 33549 WAT 5967 ATOM 33549 O WAT 5968 143.757 54.857 84.761 1.00 0.00 O ATOM 33550 H1 WAT 5968 142.956 54.936 85.279 1.00 0.00 H ATOM 33551 H2 WAT 5968 144.103 55.749 84.719 1.00 0.00 H TER 33553 WAT 5968 ATOM 33553 O WAT 5969 28.293 81.919 96.433 1.00 0.00 O ATOM 33554 H1 WAT 5969 28.117 81.932 95.492 1.00 0.00 H ATOM 33555 H2 WAT 5969 28.850 82.682 96.583 1.00 0.00 H TER 33557 WAT 5969 ATOM 33557 O WAT 5970 90.556 43.622 149.416 1.00 0.00 O ATOM 33558 H1 WAT 5970 91.207 43.045 149.016 1.00 0.00 H ATOM 33559 H2 WAT 5970 89.975 43.032 149.897 1.00 0.00 H TER 33561 WAT 5970 ATOM 33561 O WAT 5971 54.837 12.379 91.593 1.00 0.00 O ATOM 33562 H1 WAT 5971 54.407 13.187 91.875 1.00 0.00 H ATOM 33563 H2 WAT 5971 54.612 11.739 92.269 1.00 0.00 H TER 33565 WAT 5971 ATOM 33565 O WAT 5972 101.332 133.391 56.267 1.00 0.00 O ATOM 33566 H1 WAT 5972 101.327 133.302 57.220 1.00 0.00 H ATOM 33567 H2 WAT 5972 100.973 132.563 55.947 1.00 0.00 H TER 33569 WAT 5972 ATOM 33569 O WAT 5973 31.065 45.841 130.245 1.00 0.00 O ATOM 33570 H1 WAT 5973 31.520 45.375 129.544 1.00 0.00 H ATOM 33571 H2 WAT 5973 31.488 45.537 131.048 1.00 0.00 H TER 33573 WAT 5973 ATOM 33573 O WAT 5974 85.716 13.497 141.512 1.00 0.00 O ATOM 33574 H1 WAT 5974 85.083 13.300 142.202 1.00 0.00 H ATOM 33575 H2 WAT 5974 86.395 12.829 141.613 1.00 0.00 H TER 33577 WAT 5974 ATOM 33577 O WAT 5975 89.232 142.303 81.232 1.00 0.00 O ATOM 33578 H1 WAT 5975 88.942 141.969 82.080 1.00 0.00 H ATOM 33579 H2 WAT 5975 89.351 141.520 80.694 1.00 0.00 H TER 33581 WAT 5975 ATOM 33581 O WAT 5976 81.230 6.194 76.126 1.00 0.00 O ATOM 33582 H1 WAT 5976 80.538 5.928 75.520 1.00 0.00 H ATOM 33583 H2 WAT 5976 81.555 7.021 75.769 1.00 0.00 H TER 33585 WAT 5976 ATOM 33585 O WAT 5977 2.364 6.639 74.963 1.00 0.00 O ATOM 33586 H1 WAT 5977 2.712 6.886 75.820 1.00 0.00 H ATOM 33587 H2 WAT 5977 2.003 5.763 75.094 1.00 0.00 H TER 33589 WAT 5977 ATOM 33589 O WAT 5978 107.009 10.307 85.581 1.00 0.00 O ATOM 33590 H1 WAT 5978 106.729 9.448 85.264 1.00 0.00 H ATOM 33591 H2 WAT 5978 107.961 10.239 85.647 1.00 0.00 H TER 33593 WAT 5978 ATOM 33593 O WAT 5979 58.947 126.644 90.373 1.00 0.00 O ATOM 33594 H1 WAT 5979 58.348 127.325 90.066 1.00 0.00 H ATOM 33595 H2 WAT 5979 59.425 126.374 89.589 1.00 0.00 H TER 33597 WAT 5979 ATOM 33597 O WAT 5980 33.978 67.620 73.532 1.00 0.00 O ATOM 33598 H1 WAT 5980 34.589 67.865 74.227 1.00 0.00 H ATOM 33599 H2 WAT 5980 34.479 67.728 72.724 1.00 0.00 H TER 33601 WAT 5980 ATOM 33601 O WAT 5981 34.392 35.121 133.527 1.00 0.00 O ATOM 33602 H1 WAT 5981 35.091 34.934 132.901 1.00 0.00 H ATOM 33603 H2 WAT 5981 34.573 36.010 133.830 1.00 0.00 H TER 33605 WAT 5981 ATOM 33605 O WAT 5982 23.128 131.351 155.338 1.00 0.00 O ATOM 33606 H1 WAT 5982 22.247 131.725 155.359 1.00 0.00 H ATOM 33607 H2 WAT 5982 23.338 131.286 154.406 1.00 0.00 H TER 33609 WAT 5982 ATOM 33609 O WAT 5983 126.720 19.024 65.029 1.00 0.00 O ATOM 33610 H1 WAT 5983 126.415 19.591 65.737 1.00 0.00 H ATOM 33611 H2 WAT 5983 126.874 18.178 65.450 1.00 0.00 H TER 33613 WAT 5983 ATOM 33613 O WAT 5984 126.359 53.063 75.066 1.00 0.00 O ATOM 33614 H1 WAT 5984 127.186 53.363 74.689 1.00 0.00 H ATOM 33615 H2 WAT 5984 126.589 52.269 75.548 1.00 0.00 H TER 33617 WAT 5984 ATOM 33617 O WAT 5985 52.797 133.240 49.090 1.00 0.00 O ATOM 33618 H1 WAT 5985 52.169 132.690 49.558 1.00 0.00 H ATOM 33619 H2 WAT 5985 52.802 132.893 48.198 1.00 0.00 H TER 33621 WAT 5985 ATOM 33621 O WAT 5986 104.669 105.539 93.750 1.00 0.00 O ATOM 33622 H1 WAT 5986 105.462 105.015 93.633 1.00 0.00 H ATOM 33623 H2 WAT 5986 103.974 104.894 93.885 1.00 0.00 H TER 33625 WAT 5986 ATOM 33625 O WAT 5987 86.948 27.238 84.360 1.00 0.00 O ATOM 33626 H1 WAT 5987 86.592 26.938 83.524 1.00 0.00 H ATOM 33627 H2 WAT 5987 87.757 27.693 84.125 1.00 0.00 H TER 33629 WAT 5987 ATOM 33629 O WAT 5988 145.883 31.059 100.520 1.00 0.00 O ATOM 33630 H1 WAT 5988 145.656 31.975 100.361 1.00 0.00 H ATOM 33631 H2 WAT 5988 145.060 30.651 100.789 1.00 0.00 H TER 33633 WAT 5988 ATOM 33633 O WAT 5989 78.692 123.820 4.893 1.00 0.00 O ATOM 33634 H1 WAT 5989 79.205 124.279 4.228 1.00 0.00 H ATOM 33635 H2 WAT 5989 79.161 122.997 5.030 1.00 0.00 H TER 33637 WAT 5989 ATOM 33637 O WAT 5990 52.923 86.636 137.249 1.00 0.00 O ATOM 33638 H1 WAT 5990 52.878 85.680 137.259 1.00 0.00 H ATOM 33639 H2 WAT 5990 53.196 86.873 138.135 1.00 0.00 H TER 33641 WAT 5990 ATOM 33641 O WAT 5991 18.870 88.268 55.847 1.00 0.00 O ATOM 33642 H1 WAT 5991 19.697 88.737 55.962 1.00 0.00 H ATOM 33643 H2 WAT 5991 18.265 88.929 55.509 1.00 0.00 H TER 33645 WAT 5991 ATOM 33645 O WAT 5992 84.008 65.725 75.063 1.00 0.00 O ATOM 33646 H1 WAT 5992 84.191 66.345 74.357 1.00 0.00 H ATOM 33647 H2 WAT 5992 83.910 66.272 75.842 1.00 0.00 H TER 33649 WAT 5992 ATOM 33649 O WAT 5993 73.435 73.905 123.570 1.00 0.00 O ATOM 33650 H1 WAT 5993 72.529 73.696 123.341 1.00 0.00 H ATOM 33651 H2 WAT 5993 73.946 73.183 123.205 1.00 0.00 H TER 33653 WAT 5993 ATOM 33653 O WAT 5994 8.545 20.946 74.418 1.00 0.00 O ATOM 33654 H1 WAT 5994 8.778 21.875 74.432 1.00 0.00 H ATOM 33655 H2 WAT 5994 8.406 20.721 75.338 1.00 0.00 H TER 33657 WAT 5994 ATOM 33657 O WAT 5995 57.594 28.821 97.233 1.00 0.00 O ATOM 33658 H1 WAT 5995 56.818 28.397 96.865 1.00 0.00 H ATOM 33659 H2 WAT 5995 58.295 28.614 96.615 1.00 0.00 H TER 33661 WAT 5995 ATOM 33661 O WAT 5996 131.173 56.707 152.676 1.00 0.00 O ATOM 33662 H1 WAT 5996 131.105 57.582 153.058 1.00 0.00 H ATOM 33663 H2 WAT 5996 131.944 56.751 152.111 1.00 0.00 H TER 33665 WAT 5996 ATOM 33665 O WAT 5997 20.514 27.588 12.805 1.00 0.00 O ATOM 33666 H1 WAT 5997 19.739 27.053 12.972 1.00 0.00 H ATOM 33667 H2 WAT 5997 20.930 27.682 13.662 1.00 0.00 H TER 33669 WAT 5997 ATOM 33669 O WAT 5998 122.619 104.117 66.915 1.00 0.00 O ATOM 33670 H1 WAT 5998 122.524 104.927 66.414 1.00 0.00 H ATOM 33671 H2 WAT 5998 122.075 104.251 67.692 1.00 0.00 H TER 33673 WAT 5998 ATOM 33673 O WAT 5999 21.214 25.044 158.238 1.00 0.00 O ATOM 33674 H1 WAT 5999 20.445 24.621 158.621 1.00 0.00 H ATOM 33675 H2 WAT 5999 21.813 25.163 158.975 1.00 0.00 H TER 33677 WAT 5999 ATOM 33677 O WAT 6000 118.255 105.784 116.114 1.00 0.00 O ATOM 33678 H1 WAT 6000 119.172 106.055 116.077 1.00 0.00 H ATOM 33679 H2 WAT 6000 118.191 105.270 116.920 1.00 0.00 H TER 33681 WAT 6000 ATOM 33681 O WAT 6001 110.054 12.642 91.221 1.00 0.00 O ATOM 33682 H1 WAT 6001 109.915 12.122 92.013 1.00 0.00 H ATOM 33683 H2 WAT 6001 110.748 12.181 90.750 1.00 0.00 H TER 33685 WAT 6001 ATOM 33685 O WAT 6002 49.320 3.807 54.648 1.00 0.00 O ATOM 33686 H1 WAT 6002 49.400 3.391 55.507 1.00 0.00 H ATOM 33687 H2 WAT 6002 49.648 4.696 54.781 1.00 0.00 H TER 33689 WAT 6002 ATOM 33689 O WAT 6003 86.134 122.683 109.438 1.00 0.00 O ATOM 33690 H1 WAT 6003 86.139 122.702 108.481 1.00 0.00 H ATOM 33691 H2 WAT 6003 86.627 123.462 109.695 1.00 0.00 H TER 33693 WAT 6003 ATOM 33693 O WAT 6004 116.138 70.606 11.586 1.00 0.00 O ATOM 33694 H1 WAT 6004 115.418 70.387 12.177 1.00 0.00 H ATOM 33695 H2 WAT 6004 116.029 70.011 10.844 1.00 0.00 H TER 33697 WAT 6004 ATOM 33697 O WAT 6005 69.585 48.488 55.810 1.00 0.00 O ATOM 33698 H1 WAT 6005 69.691 47.926 55.043 1.00 0.00 H ATOM 33699 H2 WAT 6005 70.454 48.513 56.211 1.00 0.00 H TER 33701 WAT 6005 ATOM 33701 O WAT 6006 61.798 125.924 93.443 1.00 0.00 O ATOM 33702 H1 WAT 6006 61.710 125.128 92.919 1.00 0.00 H ATOM 33703 H2 WAT 6006 62.740 126.093 93.465 1.00 0.00 H TER 33705 WAT 6006 ATOM 33705 O WAT 6007 15.241 121.042 106.502 1.00 0.00 O ATOM 33706 H1 WAT 6007 16.008 120.547 106.215 1.00 0.00 H ATOM 33707 H2 WAT 6007 14.970 121.534 105.727 1.00 0.00 H TER 33709 WAT 6007 ATOM 33709 O WAT 6008 125.087 1.360 125.140 1.00 0.00 O ATOM 33710 H1 WAT 6008 124.711 1.171 126.000 1.00 0.00 H ATOM 33711 H2 WAT 6008 125.431 0.519 124.839 1.00 0.00 H TER 33713 WAT 6008 ATOM 33713 O WAT 6009 54.814 112.411 82.803 1.00 0.00 O ATOM 33714 H1 WAT 6009 54.147 112.148 82.169 1.00 0.00 H ATOM 33715 H2 WAT 6009 55.641 112.136 82.408 1.00 0.00 H TER 33717 WAT 6009 ATOM 33717 O WAT 6010 90.830 107.829 132.839 1.00 0.00 O ATOM 33718 H1 WAT 6010 90.273 107.068 132.675 1.00 0.00 H ATOM 33719 H2 WAT 6010 91.173 108.064 131.977 1.00 0.00 H TER 33721 WAT 6010 ATOM 33721 O WAT 6011 9.523 136.107 152.189 1.00 0.00 O ATOM 33722 H1 WAT 6011 9.928 136.582 152.915 1.00 0.00 H ATOM 33723 H2 WAT 6011 9.900 136.505 151.403 1.00 0.00 H TER 33725 WAT 6011 ATOM 33725 O WAT 6012 117.601 59.600 124.597 1.00 0.00 O ATOM 33726 H1 WAT 6012 116.682 59.357 124.712 1.00 0.00 H ATOM 33727 H2 WAT 6012 117.573 60.395 124.065 1.00 0.00 H TER 33729 WAT 6012 ATOM 33729 O WAT 6013 0.050 13.878 141.872 1.00 0.00 O ATOM 33730 H1 WAT 6013 0.745 13.525 141.317 1.00 0.00 H ATOM 33731 H2 WAT 6013 -0.678 14.040 141.272 1.00 0.00 H TER 33733 WAT 6013 ATOM 33733 O WAT 6014 104.149 14.885 93.149 1.00 0.00 O ATOM 33734 H1 WAT 6014 104.858 14.510 93.671 1.00 0.00 H ATOM 33735 H2 WAT 6014 104.566 15.140 92.326 1.00 0.00 H TER 33737 WAT 6014 ATOM 33737 O WAT 6015 10.986 25.918 22.470 1.00 0.00 O ATOM 33738 H1 WAT 6015 11.128 26.277 23.346 1.00 0.00 H ATOM 33739 H2 WAT 6015 10.825 26.684 21.920 1.00 0.00 H TER 33741 WAT 6015 ATOM 33741 O WAT 6016 87.736 51.301 74.419 1.00 0.00 O ATOM 33742 H1 WAT 6016 87.616 52.147 74.852 1.00 0.00 H ATOM 33743 H2 WAT 6016 88.678 51.139 74.467 1.00 0.00 H TER 33745 WAT 6016 ATOM 33745 O WAT 6017 92.627 8.275 66.469 1.00 0.00 O ATOM 33746 H1 WAT 6017 93.095 9.091 66.294 1.00 0.00 H ATOM 33747 H2 WAT 6017 91.934 8.524 67.082 1.00 0.00 H TER 33749 WAT 6017 ATOM 33749 O WAT 6018 139.036 82.656 27.300 1.00 0.00 O ATOM 33750 H1 WAT 6018 138.639 81.943 27.800 1.00 0.00 H ATOM 33751 H2 WAT 6018 139.597 82.217 26.660 1.00 0.00 H TER 33753 WAT 6018 ATOM 33753 O WAT 6019 98.122 144.420 71.738 1.00 0.00 O ATOM 33754 H1 WAT 6019 98.844 143.912 72.109 1.00 0.00 H ATOM 33755 H2 WAT 6019 97.334 143.948 72.007 1.00 0.00 H TER 33757 WAT 6019 ATOM 33757 O WAT 6020 70.151 64.147 156.028 1.00 0.00 O ATOM 33758 H1 WAT 6020 69.447 64.672 155.646 1.00 0.00 H ATOM 33759 H2 WAT 6020 69.942 64.110 156.961 1.00 0.00 H TER 33761 WAT 6020 ATOM 33761 O WAT 6021 3.450 38.403 133.899 1.00 0.00 O ATOM 33762 H1 WAT 6021 3.365 39.352 133.985 1.00 0.00 H ATOM 33763 H2 WAT 6021 2.548 38.085 133.855 1.00 0.00 H TER 33765 WAT 6021 ATOM 33765 O WAT 6022 94.622 88.458 146.946 1.00 0.00 O ATOM 33766 H1 WAT 6022 94.576 87.763 146.289 1.00 0.00 H ATOM 33767 H2 WAT 6022 93.712 88.605 147.204 1.00 0.00 H TER 33769 WAT 6022 ATOM 33769 O WAT 6023 120.106 32.677 15.942 1.00 0.00 O ATOM 33770 H1 WAT 6023 119.246 33.097 15.974 1.00 0.00 H ATOM 33771 H2 WAT 6023 120.462 32.792 16.822 1.00 0.00 H TER 33773 WAT 6023 ATOM 33773 O WAT 6024 21.593 56.140 141.835 1.00 0.00 O ATOM 33774 H1 WAT 6024 21.720 56.817 142.500 1.00 0.00 H ATOM 33775 H2 WAT 6024 21.983 56.507 141.042 1.00 0.00 H TER 33777 WAT 6024 ATOM 33777 O WAT 6025 68.597 110.839 149.545 1.00 0.00 O ATOM 33778 H1 WAT 6025 68.076 111.555 149.180 1.00 0.00 H ATOM 33779 H2 WAT 6025 69.442 111.238 149.750 1.00 0.00 H TER 33781 WAT 6025 ATOM 33781 O WAT 6026 88.135 143.737 73.619 1.00 0.00 O ATOM 33782 H1 WAT 6026 89.031 143.464 73.423 1.00 0.00 H ATOM 33783 H2 WAT 6026 87.658 142.918 73.754 1.00 0.00 H TER 33785 WAT 6026 ATOM 33785 O WAT 6027 68.650 135.774 76.906 1.00 0.00 O ATOM 33786 H1 WAT 6027 69.393 135.397 77.377 1.00 0.00 H ATOM 33787 H2 WAT 6027 68.670 135.350 76.048 1.00 0.00 H TER 33789 WAT 6027 ATOM 33789 O WAT 6028 72.705 97.570 140.547 1.00 0.00 O ATOM 33790 H1 WAT 6028 72.555 96.714 140.146 1.00 0.00 H ATOM 33791 H2 WAT 6028 72.550 97.429 141.480 1.00 0.00 H TER 33793 WAT 6028 ATOM 33793 O WAT 6029 48.135 98.599 19.600 1.00 0.00 O ATOM 33794 H1 WAT 6029 47.430 98.906 19.030 1.00 0.00 H ATOM 33795 H2 WAT 6029 48.369 99.365 20.125 1.00 0.00 H TER 33797 WAT 6029 ATOM 33797 O WAT 6030 129.314 88.695 18.726 1.00 0.00 O ATOM 33798 H1 WAT 6030 130.092 88.617 18.174 1.00 0.00 H ATOM 33799 H2 WAT 6030 128.932 89.539 18.486 1.00 0.00 H TER 33801 WAT 6030 ATOM 33801 O WAT 6031 112.458 110.790 86.197 1.00 0.00 O ATOM 33802 H1 WAT 6031 112.609 111.518 85.594 1.00 0.00 H ATOM 33803 H2 WAT 6031 111.529 110.582 86.092 1.00 0.00 H TER 33805 WAT 6031 ATOM 33805 O WAT 6032 21.330 75.003 111.504 1.00 0.00 O ATOM 33806 H1 WAT 6032 20.879 74.168 111.380 1.00 0.00 H ATOM 33807 H2 WAT 6032 20.629 75.630 111.679 1.00 0.00 H TER 33809 WAT 6032 ATOM 33809 O WAT 6033 132.698 98.486 18.975 1.00 0.00 O ATOM 33810 H1 WAT 6033 132.295 98.074 19.739 1.00 0.00 H ATOM 33811 H2 WAT 6033 133.629 98.275 19.052 1.00 0.00 H TER 33813 WAT 6033 ATOM 33813 O WAT 6034 51.233 84.015 62.934 1.00 0.00 O ATOM 33814 H1 WAT 6034 50.927 84.692 63.538 1.00 0.00 H ATOM 33815 H2 WAT 6034 51.414 84.486 62.120 1.00 0.00 H TER 33817 WAT 6034 ATOM 33817 O WAT 6035 143.046 123.387 74.516 1.00 0.00 O ATOM 33818 H1 WAT 6035 142.686 123.151 73.661 1.00 0.00 H ATOM 33819 H2 WAT 6035 143.310 124.302 74.420 1.00 0.00 H TER 33821 WAT 6035 ATOM 33821 O WAT 6036 78.290 138.447 94.649 1.00 0.00 O ATOM 33822 H1 WAT 6036 78.107 137.512 94.741 1.00 0.00 H ATOM 33823 H2 WAT 6036 78.175 138.623 93.716 1.00 0.00 H TER 33825 WAT 6036 ATOM 33825 O WAT 6037 82.905 138.826 148.401 1.00 0.00 O ATOM 33826 H1 WAT 6037 82.696 138.124 149.018 1.00 0.00 H ATOM 33827 H2 WAT 6037 82.074 139.020 147.969 1.00 0.00 H TER 33829 WAT 6037 ATOM 33829 O WAT 6038 61.283 112.107 103.851 1.00 0.00 O ATOM 33830 H1 WAT 6038 62.227 112.162 104.000 1.00 0.00 H ATOM 33831 H2 WAT 6038 61.198 111.607 103.039 1.00 0.00 H TER 33833 WAT 6038 ATOM 33833 O WAT 6039 50.717 44.546 111.411 1.00 0.00 O ATOM 33834 H1 WAT 6039 51.119 44.137 110.645 1.00 0.00 H ATOM 33835 H2 WAT 6039 50.560 45.452 111.145 1.00 0.00 H TER 33837 WAT 6039 ATOM 33837 O WAT 6040 118.006 43.934 139.169 1.00 0.00 O ATOM 33838 H1 WAT 6040 118.765 43.540 138.739 1.00 0.00 H ATOM 33839 H2 WAT 6040 117.744 43.290 139.828 1.00 0.00 H TER 33841 WAT 6040 ATOM 33841 O WAT 6041 59.615 41.228 96.419 1.00 0.00 O ATOM 33842 H1 WAT 6041 59.934 40.664 97.123 1.00 0.00 H ATOM 33843 H2 WAT 6041 59.353 42.036 96.860 1.00 0.00 H TER 33845 WAT 6041 ATOM 33845 O WAT 6042 98.812 25.832 134.599 1.00 0.00 O ATOM 33846 H1 WAT 6042 99.482 26.343 134.144 1.00 0.00 H ATOM 33847 H2 WAT 6042 98.113 25.725 133.954 1.00 0.00 H TER 33849 WAT 6042 ATOM 33849 O WAT 6043 111.744 122.136 123.061 1.00 0.00 O ATOM 33850 H1 WAT 6043 112.648 121.929 122.826 1.00 0.00 H ATOM 33851 H2 WAT 6043 111.565 122.965 122.619 1.00 0.00 H TER 33853 WAT 6043 ATOM 33853 O WAT 6044 126.090 92.624 11.435 1.00 0.00 O ATOM 33854 H1 WAT 6044 125.659 91.770 11.396 1.00 0.00 H ATOM 33855 H2 WAT 6044 126.911 92.456 11.898 1.00 0.00 H TER 33857 WAT 6044 ATOM 33857 O WAT 6045 14.134 134.308 82.523 1.00 0.00 O ATOM 33858 H1 WAT 6045 13.322 134.013 82.111 1.00 0.00 H ATOM 33859 H2 WAT 6045 14.779 133.641 82.287 1.00 0.00 H TER 33861 WAT 6045 ATOM 33861 O WAT 6046 97.535 1.616 8.799 1.00 0.00 O ATOM 33862 H1 WAT 6046 96.668 2.011 8.883 1.00 0.00 H ATOM 33863 H2 WAT 6046 97.420 0.718 9.113 1.00 0.00 H TER 33865 WAT 6046 ATOM 33865 O WAT 6047 58.377 73.368 135.905 1.00 0.00 O ATOM 33866 H1 WAT 6047 57.779 74.113 135.844 1.00 0.00 H ATOM 33867 H2 WAT 6047 58.960 73.588 136.632 1.00 0.00 H TER 33869 WAT 6047 ATOM 33869 O WAT 6048 102.683 64.203 10.244 1.00 0.00 O ATOM 33870 H1 WAT 6048 101.841 64.547 9.948 1.00 0.00 H ATOM 33871 H2 WAT 6048 103.001 64.853 10.870 1.00 0.00 H TER 33873 WAT 6048 ATOM 33873 O WAT 6049 111.880 109.279 97.999 1.00 0.00 O ATOM 33874 H1 WAT 6049 112.496 108.578 97.787 1.00 0.00 H ATOM 33875 H2 WAT 6049 111.027 108.846 98.036 1.00 0.00 H TER 33877 WAT 6049 ATOM 33877 O WAT 6050 109.560 137.951 91.845 1.00 0.00 O ATOM 33878 H1 WAT 6050 109.871 137.770 92.731 1.00 0.00 H ATOM 33879 H2 WAT 6050 110.130 137.430 91.279 1.00 0.00 H TER 33881 WAT 6050 ATOM 33881 O WAT 6051 5.698 39.874 70.312 1.00 0.00 O ATOM 33882 H1 WAT 6051 5.349 40.574 69.760 1.00 0.00 H ATOM 33883 H2 WAT 6051 5.579 39.078 69.794 1.00 0.00 H TER 33885 WAT 6051 ATOM 33885 O WAT 6052 58.783 132.057 66.291 1.00 0.00 O ATOM 33886 H1 WAT 6052 58.403 132.010 67.169 1.00 0.00 H ATOM 33887 H2 WAT 6052 58.757 131.155 65.971 1.00 0.00 H TER 33889 WAT 6052 ATOM 33889 O WAT 6053 59.191 5.789 76.025 1.00 0.00 O ATOM 33890 H1 WAT 6053 58.967 6.471 76.658 1.00 0.00 H ATOM 33891 H2 WAT 6053 59.517 5.064 76.558 1.00 0.00 H TER 33893 WAT 6053 ATOM 33893 O WAT 6054 67.844 139.601 82.833 1.00 0.00 O ATOM 33894 H1 WAT 6054 67.755 139.414 81.899 1.00 0.00 H ATOM 33895 H2 WAT 6054 67.253 138.980 83.259 1.00 0.00 H TER 33897 WAT 6054 ATOM 33897 O WAT 6055 7.688 37.653 89.682 1.00 0.00 O ATOM 33898 H1 WAT 6055 7.388 37.067 90.376 1.00 0.00 H ATOM 33899 H2 WAT 6055 7.178 38.453 89.806 1.00 0.00 H TER 33901 WAT 6055 ATOM 33901 O WAT 6056 87.687 49.363 63.524 1.00 0.00 O ATOM 33902 H1 WAT 6056 88.220 50.117 63.776 1.00 0.00 H ATOM 33903 H2 WAT 6056 87.899 49.216 62.603 1.00 0.00 H TER 33905 WAT 6056 ATOM 33905 O WAT 6057 23.445 39.964 104.039 1.00 0.00 O ATOM 33906 H1 WAT 6057 24.042 39.556 104.666 1.00 0.00 H ATOM 33907 H2 WAT 6057 24.000 40.552 103.527 1.00 0.00 H TER 33909 WAT 6057 ATOM 33909 O WAT 6058 129.792 41.364 63.008 1.00 0.00 O ATOM 33910 H1 WAT 6058 129.660 40.416 63.011 1.00 0.00 H ATOM 33911 H2 WAT 6058 129.821 41.600 62.081 1.00 0.00 H TER 33913 WAT 6058 ATOM 33913 O WAT 6059 144.945 106.556 154.293 1.00 0.00 O ATOM 33914 H1 WAT 6059 145.738 106.450 154.820 1.00 0.00 H ATOM 33915 H2 WAT 6059 145.266 106.661 153.397 1.00 0.00 H TER 33917 WAT 6059 ATOM 33917 O WAT 6060 95.140 62.178 83.892 1.00 0.00 O ATOM 33918 H1 WAT 6060 95.470 61.376 83.486 1.00 0.00 H ATOM 33919 H2 WAT 6060 94.357 62.397 83.387 1.00 0.00 H TER 33921 WAT 6060 ATOM 33921 O WAT 6061 128.846 53.269 123.220 1.00 0.00 O ATOM 33922 H1 WAT 6061 128.120 53.893 123.218 1.00 0.00 H ATOM 33923 H2 WAT 6061 128.424 52.411 123.253 1.00 0.00 H TER 33925 WAT 6061 ATOM 33925 O WAT 6062 24.706 140.476 153.472 1.00 0.00 O ATOM 33926 H1 WAT 6062 25.578 140.333 153.839 1.00 0.00 H ATOM 33927 H2 WAT 6062 24.220 139.681 153.694 1.00 0.00 H TER 33929 WAT 6062 ATOM 33929 O WAT 6063 55.782 54.910 68.917 1.00 0.00 O ATOM 33930 H1 WAT 6063 56.159 54.323 68.260 1.00 0.00 H ATOM 33931 H2 WAT 6063 54.977 54.473 69.194 1.00 0.00 H TER 33933 WAT 6063 ATOM 33933 O WAT 6064 55.697 48.825 86.644 1.00 0.00 O ATOM 33934 H1 WAT 6064 56.006 49.731 86.627 1.00 0.00 H ATOM 33935 H2 WAT 6064 56.324 48.348 86.100 1.00 0.00 H TER 33937 WAT 6064 ATOM 33937 O WAT 6065 119.732 112.816 2.818 1.00 0.00 O ATOM 33938 H1 WAT 6065 119.143 112.085 2.630 1.00 0.00 H ATOM 33939 H2 WAT 6065 120.356 112.464 3.452 1.00 0.00 H TER 33941 WAT 6065 ATOM 33941 O WAT 6066 144.564 95.410 130.975 1.00 0.00 O ATOM 33942 H1 WAT 6066 144.587 94.697 131.613 1.00 0.00 H ATOM 33943 H2 WAT 6066 143.678 95.380 130.615 1.00 0.00 H TER 33945 WAT 6066 ATOM 33945 O WAT 6067 69.446 120.512 80.357 1.00 0.00 O ATOM 33946 H1 WAT 6067 68.513 120.455 80.150 1.00 0.00 H ATOM 33947 H2 WAT 6067 69.710 121.375 80.040 1.00 0.00 H TER 33949 WAT 6067 ATOM 33949 O WAT 6068 5.893 42.453 114.739 1.00 0.00 O ATOM 33950 H1 WAT 6068 6.471 42.035 115.377 1.00 0.00 H ATOM 33951 H2 WAT 6068 5.015 42.345 115.104 1.00 0.00 H TER 33953 WAT 6068 ATOM 33953 O WAT 6069 136.821 129.326 75.458 1.00 0.00 O ATOM 33954 H1 WAT 6069 135.907 129.355 75.741 1.00 0.00 H ATOM 33955 H2 WAT 6069 137.007 128.394 75.345 1.00 0.00 H TER 33957 WAT 6069 ATOM 33957 O WAT 6070 31.063 110.633 142.400 1.00 0.00 O ATOM 33958 H1 WAT 6070 31.700 110.398 143.076 1.00 0.00 H ATOM 33959 H2 WAT 6070 30.283 110.897 142.888 1.00 0.00 H TER 33961 WAT 6070 ATOM 33961 O WAT 6071 139.598 43.944 86.342 1.00 0.00 O ATOM 33962 H1 WAT 6071 139.707 44.286 87.229 1.00 0.00 H ATOM 33963 H2 WAT 6071 139.093 44.617 85.886 1.00 0.00 H TER 33965 WAT 6071 ATOM 33965 O WAT 6072 142.243 90.987 6.263 1.00 0.00 O ATOM 33966 H1 WAT 6072 141.574 90.316 6.130 1.00 0.00 H ATOM 33967 H2 WAT 6072 142.540 90.854 7.164 1.00 0.00 H TER 33969 WAT 6072 ATOM 33969 O WAT 6073 19.858 9.451 114.636 1.00 0.00 O ATOM 33970 H1 WAT 6073 20.408 9.240 115.391 1.00 0.00 H ATOM 33971 H2 WAT 6073 19.131 9.953 115.002 1.00 0.00 H TER 33973 WAT 6073 ATOM 33973 O WAT 6074 111.579 1.648 107.553 1.00 0.00 O ATOM 33974 H1 WAT 6074 111.282 1.441 106.667 1.00 0.00 H ATOM 33975 H2 WAT 6074 112.367 1.119 107.671 1.00 0.00 H TER 33977 WAT 6074 ATOM 33977 O WAT 6075 145.131 128.305 81.178 1.00 0.00 O ATOM 33978 H1 WAT 6075 145.504 129.100 81.560 1.00 0.00 H ATOM 33979 H2 WAT 6075 144.339 128.142 81.690 1.00 0.00 H TER 33981 WAT 6075 ATOM 33981 O WAT 6076 52.427 70.286 103.516 1.00 0.00 O ATOM 33982 H1 WAT 6076 52.679 69.418 103.199 1.00 0.00 H ATOM 33983 H2 WAT 6076 52.018 70.121 104.366 1.00 0.00 H TER 33985 WAT 6076 ATOM 33985 O WAT 6077 141.182 24.945 10.869 1.00 0.00 O ATOM 33986 H1 WAT 6077 140.387 24.447 10.678 1.00 0.00 H ATOM 33987 H2 WAT 6077 141.781 24.302 11.249 1.00 0.00 H TER 33989 WAT 6077 ATOM 33989 O WAT 6078 102.366 111.570 127.381 1.00 0.00 O ATOM 33990 H1 WAT 6078 103.042 111.006 127.760 1.00 0.00 H ATOM 33991 H2 WAT 6078 102.670 112.460 127.560 1.00 0.00 H TER 33993 WAT 6078 ATOM 33993 O WAT 6079 73.189 107.542 76.485 1.00 0.00 O ATOM 33994 H1 WAT 6079 72.232 107.562 76.491 1.00 0.00 H ATOM 33995 H2 WAT 6079 73.440 107.819 77.366 1.00 0.00 H TER 33997 WAT 6079 ATOM 33997 O WAT 6080 98.568 17.644 156.054 1.00 0.00 O ATOM 33998 H1 WAT 6080 98.448 18.488 156.489 1.00 0.00 H ATOM 33999 H2 WAT 6080 97.866 17.094 156.402 1.00 0.00 H TER 34001 WAT 6080 ATOM 34001 O WAT 6081 63.964 132.761 16.151 1.00 0.00 O ATOM 34002 H1 WAT 6081 64.844 132.419 15.992 1.00 0.00 H ATOM 34003 H2 WAT 6081 63.604 132.911 15.277 1.00 0.00 H TER 34005 WAT 6081 ATOM 34005 O WAT 6082 17.223 52.153 140.594 1.00 0.00 O ATOM 34006 H1 WAT 6082 16.724 52.849 141.022 1.00 0.00 H ATOM 34007 H2 WAT 6082 16.873 52.121 139.703 1.00 0.00 H TER 34009 WAT 6082 ATOM 34009 O WAT 6083 36.718 117.717 156.268 1.00 0.00 O ATOM 34010 H1 WAT 6083 37.141 118.203 156.975 1.00 0.00 H ATOM 34011 H2 WAT 6083 37.387 117.656 155.586 1.00 0.00 H TER 34013 WAT 6083 ATOM 34013 O WAT 6084 101.757 54.741 5.528 1.00 0.00 O ATOM 34014 H1 WAT 6084 101.330 55.565 5.292 1.00 0.00 H ATOM 34015 H2 WAT 6084 101.055 54.092 5.505 1.00 0.00 H TER 34017 WAT 6084 ATOM 34017 O WAT 6085 100.110 53.333 94.003 1.00 0.00 O ATOM 34018 H1 WAT 6085 101.014 53.553 94.224 1.00 0.00 H ATOM 34019 H2 WAT 6085 99.581 53.928 94.535 1.00 0.00 H TER 34021 WAT 6085 ATOM 34021 O WAT 6086 142.821 107.683 77.720 1.00 0.00 O ATOM 34022 H1 WAT 6086 143.511 107.812 78.371 1.00 0.00 H ATOM 34023 H2 WAT 6086 142.445 106.829 77.934 1.00 0.00 H TER 34025 WAT 6086 ATOM 34025 O WAT 6087 39.255 72.433 157.642 1.00 0.00 O ATOM 34026 H1 WAT 6087 39.129 72.481 156.695 1.00 0.00 H ATOM 34027 H2 WAT 6087 40.180 72.643 157.772 1.00 0.00 H TER 34029 WAT 6087 ATOM 34029 O WAT 6088 117.115 93.414 111.612 1.00 0.00 O ATOM 34030 H1 WAT 6088 116.598 94.215 111.699 1.00 0.00 H ATOM 34031 H2 WAT 6088 116.999 93.153 110.698 1.00 0.00 H TER 34033 WAT 6088 ATOM 34033 O WAT 6089 62.264 89.281 138.364 1.00 0.00 O ATOM 34034 H1 WAT 6089 62.997 88.674 138.463 1.00 0.00 H ATOM 34035 H2 WAT 6089 61.531 88.728 138.093 1.00 0.00 H TER 34037 WAT 6089 ATOM 34037 O WAT 6090 118.046 57.430 107.861 1.00 0.00 O ATOM 34038 H1 WAT 6090 118.528 58.066 108.390 1.00 0.00 H ATOM 34039 H2 WAT 6090 117.423 57.958 107.362 1.00 0.00 H TER 34041 WAT 6090 ATOM 34041 O WAT 6091 101.571 28.663 107.551 1.00 0.00 O ATOM 34042 H1 WAT 6091 101.454 29.287 106.835 1.00 0.00 H ATOM 34043 H2 WAT 6091 102.481 28.777 107.823 1.00 0.00 H TER 34045 WAT 6091 ATOM 34045 O WAT 6092 120.301 92.323 70.302 1.00 0.00 O ATOM 34046 H1 WAT 6092 120.319 92.329 69.345 1.00 0.00 H ATOM 34047 H2 WAT 6092 120.573 91.436 70.541 1.00 0.00 H TER 34049 WAT 6092 ATOM 34049 O WAT 6093 144.932 45.172 126.869 1.00 0.00 O ATOM 34050 H1 WAT 6093 144.112 44.818 127.214 1.00 0.00 H ATOM 34051 H2 WAT 6093 144.691 46.025 126.508 1.00 0.00 H TER 34053 WAT 6093 ATOM 34053 O WAT 6094 72.091 44.832 70.801 1.00 0.00 O ATOM 34054 H1 WAT 6094 71.504 44.970 71.544 1.00 0.00 H ATOM 34055 H2 WAT 6094 72.967 44.978 71.157 1.00 0.00 H TER 34057 WAT 6094 ATOM 34057 O WAT 6095 76.193 63.224 14.608 1.00 0.00 O ATOM 34058 H1 WAT 6095 77.051 62.801 14.655 1.00 0.00 H ATOM 34059 H2 WAT 6095 75.567 62.502 14.671 1.00 0.00 H TER 34061 WAT 6095 ATOM 34061 O WAT 6096 144.619 95.531 100.812 1.00 0.00 O ATOM 34062 H1 WAT 6096 145.016 96.261 100.337 1.00 0.00 H ATOM 34063 H2 WAT 6096 144.094 95.947 101.496 1.00 0.00 H TER 34065 WAT 6096 ATOM 34065 O WAT 6097 21.061 102.041 117.795 1.00 0.00 O ATOM 34066 H1 WAT 6097 21.085 101.087 117.873 1.00 0.00 H ATOM 34067 H2 WAT 6097 20.137 102.247 117.658 1.00 0.00 H TER 34069 WAT 6097 ATOM 34069 O WAT 6098 121.002 93.134 134.365 1.00 0.00 O ATOM 34070 H1 WAT 6098 120.596 94.001 134.388 1.00 0.00 H ATOM 34071 H2 WAT 6098 121.824 93.266 133.893 1.00 0.00 H TER 34073 WAT 6098 ATOM 34073 O WAT 6099 105.008 76.327 66.404 1.00 0.00 O ATOM 34074 H1 WAT 6099 105.721 76.939 66.220 1.00 0.00 H ATOM 34075 H2 WAT 6099 104.964 76.291 67.360 1.00 0.00 H TER 34077 WAT 6099 ATOM 34077 O WAT 6100 91.276 52.360 14.245 1.00 0.00 O ATOM 34078 H1 WAT 6100 91.097 52.217 13.315 1.00 0.00 H ATOM 34079 H2 WAT 6100 91.062 51.525 14.661 1.00 0.00 H TER 34081 WAT 6100 ATOM 34081 O WAT 6101 63.862 61.303 101.442 1.00 0.00 O ATOM 34082 H1 WAT 6101 63.667 61.307 100.505 1.00 0.00 H ATOM 34083 H2 WAT 6101 64.217 62.174 101.617 1.00 0.00 H TER 34085 WAT 6101 ATOM 34085 O WAT 6102 144.461 57.477 88.593 1.00 0.00 O ATOM 34086 H1 WAT 6102 144.197 58.096 87.913 1.00 0.00 H ATOM 34087 H2 WAT 6102 144.838 56.739 88.113 1.00 0.00 H TER 34089 WAT 6102 ATOM 34089 O WAT 6103 113.587 26.663 77.969 1.00 0.00 O ATOM 34090 H1 WAT 6103 114.032 27.508 78.030 1.00 0.00 H ATOM 34091 H2 WAT 6103 114.275 26.048 77.715 1.00 0.00 H TER 34093 WAT 6103 ATOM 34093 O WAT 6104 75.591 140.583 108.613 1.00 0.00 O ATOM 34094 H1 WAT 6104 76.100 140.815 107.836 1.00 0.00 H ATOM 34095 H2 WAT 6104 75.036 141.346 108.772 1.00 0.00 H TER 34097 WAT 6104 ATOM 34097 O WAT 6105 57.452 93.002 87.048 1.00 0.00 O ATOM 34098 H1 WAT 6105 57.749 93.272 87.917 1.00 0.00 H ATOM 34099 H2 WAT 6105 58.248 92.992 86.515 1.00 0.00 H TER 34101 WAT 6105 ATOM 34101 O WAT 6106 73.069 58.796 18.494 1.00 0.00 O ATOM 34102 H1 WAT 6106 73.258 57.878 18.687 1.00 0.00 H ATOM 34103 H2 WAT 6106 73.718 59.040 17.834 1.00 0.00 H TER 34105 WAT 6106 ATOM 34105 O WAT 6107 129.693 5.487 14.159 1.00 0.00 O ATOM 34106 H1 WAT 6107 128.865 5.228 14.565 1.00 0.00 H ATOM 34107 H2 WAT 6107 129.553 6.394 13.887 1.00 0.00 H TER 34109 WAT 6107 ATOM 34109 O WAT 6108 65.308 16.331 80.011 1.00 0.00 O ATOM 34110 H1 WAT 6108 65.231 16.754 79.155 1.00 0.00 H ATOM 34111 H2 WAT 6108 66.131 16.662 80.369 1.00 0.00 H TER 34113 WAT 6108 ATOM 34113 O WAT 6109 118.827 104.234 7.723 1.00 0.00 O ATOM 34114 H1 WAT 6109 118.045 104.643 8.094 1.00 0.00 H ATOM 34115 H2 WAT 6109 119.300 104.955 7.308 1.00 0.00 H TER 34117 WAT 6109 ATOM 34117 O WAT 6110 22.245 60.241 9.932 1.00 0.00 O ATOM 34118 H1 WAT 6110 22.225 59.671 9.163 1.00 0.00 H ATOM 34119 H2 WAT 6110 22.399 59.646 10.666 1.00 0.00 H TER 34121 WAT 6110 ATOM 34121 O WAT 6111 23.827 77.418 66.781 1.00 0.00 O ATOM 34122 H1 WAT 6111 24.174 78.170 67.260 1.00 0.00 H ATOM 34123 H2 WAT 6111 23.153 77.788 66.211 1.00 0.00 H TER 34125 WAT 6111 ATOM 34125 O WAT 6112 24.889 87.310 94.912 1.00 0.00 O ATOM 34126 H1 WAT 6112 24.594 88.201 94.729 1.00 0.00 H ATOM 34127 H2 WAT 6112 25.650 87.422 95.482 1.00 0.00 H TER 34129 WAT 6112 ATOM 34129 O WAT 6113 83.421 88.187 96.569 1.00 0.00 O ATOM 34130 H1 WAT 6113 83.834 88.009 95.725 1.00 0.00 H ATOM 34131 H2 WAT 6113 84.126 88.083 97.208 1.00 0.00 H TER 34133 WAT 6113 ATOM 34133 O WAT 6114 62.206 98.457 74.376 1.00 0.00 O ATOM 34134 H1 WAT 6114 62.525 97.865 73.694 1.00 0.00 H ATOM 34135 H2 WAT 6114 61.255 98.456 74.267 1.00 0.00 H TER 34137 WAT 6114 ATOM 34137 O WAT 6115 70.333 107.420 76.800 1.00 0.00 O ATOM 34138 H1 WAT 6115 70.484 108.336 77.031 1.00 0.00 H ATOM 34139 H2 WAT 6115 70.097 107.442 75.872 1.00 0.00 H TER 34141 WAT 6115 ATOM 34141 O WAT 6116 130.953 67.240 147.945 1.00 0.00 O ATOM 34142 H1 WAT 6116 130.024 67.460 147.880 1.00 0.00 H ATOM 34143 H2 WAT 6116 131.282 67.326 147.051 1.00 0.00 H TER 34145 WAT 6116 ATOM 34145 O WAT 6117 57.449 94.103 3.085 1.00 0.00 O ATOM 34146 H1 WAT 6117 58.222 94.431 3.544 1.00 0.00 H ATOM 34147 H2 WAT 6117 56.747 94.147 3.734 1.00 0.00 H TER 34149 WAT 6117 ATOM 34149 O WAT 6118 82.276 2.138 59.683 1.00 0.00 O ATOM 34150 H1 WAT 6118 81.995 2.752 59.004 1.00 0.00 H ATOM 34151 H2 WAT 6118 82.383 2.679 60.465 1.00 0.00 H TER 34153 WAT 6118 ATOM 34153 O WAT 6119 67.317 1.940 144.997 1.00 0.00 O ATOM 34154 H1 WAT 6119 67.665 2.241 145.836 1.00 0.00 H ATOM 34155 H2 WAT 6119 67.057 2.741 144.543 1.00 0.00 H TER 34157 WAT 6119 ATOM 34157 O WAT 6120 109.868 127.712 1.606 1.00 0.00 O ATOM 34158 H1 WAT 6120 110.498 127.031 1.842 1.00 0.00 H ATOM 34159 H2 WAT 6120 110.136 128.474 2.119 1.00 0.00 H TER 34161 WAT 6120 ATOM 34161 O WAT 6121 48.481 59.286 62.111 1.00 0.00 O ATOM 34162 H1 WAT 6121 48.825 58.924 62.928 1.00 0.00 H ATOM 34163 H2 WAT 6121 49.103 59.002 61.442 1.00 0.00 H TER 34165 WAT 6121 ATOM 34165 O WAT 6122 97.799 133.773 71.799 1.00 0.00 O ATOM 34166 H1 WAT 6122 97.564 133.888 70.878 1.00 0.00 H ATOM 34167 H2 WAT 6122 98.740 133.598 71.785 1.00 0.00 H TER 34169 WAT 6122 ATOM 34169 O WAT 6123 131.996 75.997 140.297 1.00 0.00 O ATOM 34170 H1 WAT 6123 131.686 75.614 139.476 1.00 0.00 H ATOM 34171 H2 WAT 6123 131.456 76.778 140.417 1.00 0.00 H TER 34173 WAT 6123 ATOM 34173 O WAT 6124 3.857 77.253 128.144 1.00 0.00 O ATOM 34174 H1 WAT 6124 4.248 77.003 128.981 1.00 0.00 H ATOM 34175 H2 WAT 6124 4.524 77.792 127.720 1.00 0.00 H TER 34177 WAT 6124 ATOM 34177 O WAT 6125 30.721 106.261 128.502 1.00 0.00 O ATOM 34178 H1 WAT 6125 30.672 107.130 128.899 1.00 0.00 H ATOM 34179 H2 WAT 6125 31.635 105.998 128.613 1.00 0.00 H TER 34181 WAT 6125 ATOM 34181 O WAT 6126 143.970 14.308 147.818 1.00 0.00 O ATOM 34182 H1 WAT 6126 144.004 14.776 148.652 1.00 0.00 H ATOM 34183 H2 WAT 6126 143.592 13.456 148.037 1.00 0.00 H TER 34185 WAT 6126 ATOM 34185 O WAT 6127 139.878 19.744 83.259 1.00 0.00 O ATOM 34186 H1 WAT 6127 139.717 20.321 82.512 1.00 0.00 H ATOM 34187 H2 WAT 6127 140.423 20.263 83.850 1.00 0.00 H TER 34189 WAT 6127 ATOM 34189 O WAT 6128 3.164 98.039 89.855 1.00 0.00 O ATOM 34190 H1 WAT 6128 3.467 97.504 90.589 1.00 0.00 H ATOM 34191 H2 WAT 6128 2.219 98.114 89.987 1.00 0.00 H TER 34193 WAT 6128 ATOM 34193 O WAT 6129 35.834 4.962 145.502 1.00 0.00 O ATOM 34194 H1 WAT 6129 35.224 5.524 145.024 1.00 0.00 H ATOM 34195 H2 WAT 6129 36.158 4.347 144.844 1.00 0.00 H TER 34197 WAT 6129 ATOM 34197 O WAT 6130 109.525 36.009 116.651 1.00 0.00 O ATOM 34198 H1 WAT 6130 108.581 35.935 116.512 1.00 0.00 H ATOM 34199 H2 WAT 6130 109.615 36.234 117.577 1.00 0.00 H TER 34201 WAT 6130 ATOM 34201 O WAT 6131 31.834 22.410 8.689 1.00 0.00 O ATOM 34202 H1 WAT 6131 30.897 22.254 8.807 1.00 0.00 H ATOM 34203 H2 WAT 6131 32.236 21.549 8.805 1.00 0.00 H TER 34205 WAT 6131 ATOM 34205 O WAT 6132 116.226 139.004 60.462 1.00 0.00 O ATOM 34206 H1 WAT 6132 115.285 138.847 60.381 1.00 0.00 H ATOM 34207 H2 WAT 6132 116.632 138.277 59.991 1.00 0.00 H TER 34209 WAT 6132 ATOM 34209 O WAT 6133 7.258 41.307 143.356 1.00 0.00 O ATOM 34210 H1 WAT 6133 7.887 40.952 143.984 1.00 0.00 H ATOM 34211 H2 WAT 6133 6.752 41.945 143.858 1.00 0.00 H TER 34213 WAT 6133 ATOM 34213 O WAT 6134 12.273 116.251 56.124 1.00 0.00 O ATOM 34214 H1 WAT 6134 12.863 115.546 56.391 1.00 0.00 H ATOM 34215 H2 WAT 6134 12.288 116.226 55.167 1.00 0.00 H TER 34217 WAT 6134 ATOM 34217 O WAT 6135 108.171 46.193 57.631 1.00 0.00 O ATOM 34218 H1 WAT 6135 107.751 46.444 58.454 1.00 0.00 H ATOM 34219 H2 WAT 6135 108.606 46.992 57.331 1.00 0.00 H TER 34221 WAT 6135 ATOM 34221 O WAT 6136 32.491 89.568 70.982 1.00 0.00 O ATOM 34222 H1 WAT 6136 31.865 89.458 71.697 1.00 0.00 H ATOM 34223 H2 WAT 6136 32.349 88.806 70.420 1.00 0.00 H TER 34225 WAT 6136 ATOM 34225 O WAT 6137 70.631 42.943 158.146 1.00 0.00 O ATOM 34226 H1 WAT 6137 71.553 42.993 158.399 1.00 0.00 H ATOM 34227 H2 WAT 6137 70.198 43.604 158.687 1.00 0.00 H TER 34229 WAT 6137 ATOM 34229 O WAT 6138 133.484 30.125 92.404 1.00 0.00 O ATOM 34230 H1 WAT 6138 132.880 30.360 91.699 1.00 0.00 H ATOM 34231 H2 WAT 6138 133.594 30.934 92.904 1.00 0.00 H TER 34233 WAT 6138 ATOM 34233 O WAT 6139 32.545 79.763 153.298 1.00 0.00 O ATOM 34234 H1 WAT 6139 32.789 80.633 153.615 1.00 0.00 H ATOM 34235 H2 WAT 6139 33.357 79.259 153.332 1.00 0.00 H TER 34237 WAT 6139 ATOM 34237 O WAT 6140 17.112 81.921 125.291 1.00 0.00 O ATOM 34238 H1 WAT 6140 16.865 81.478 126.102 1.00 0.00 H ATOM 34239 H2 WAT 6140 16.749 82.803 125.379 1.00 0.00 H TER 34241 WAT 6140 ATOM 34241 O WAT 6141 71.689 57.672 5.837 1.00 0.00 O ATOM 34242 H1 WAT 6141 71.283 57.298 6.619 1.00 0.00 H ATOM 34243 H2 WAT 6141 71.864 56.918 5.274 1.00 0.00 H TER 34245 WAT 6141 ATOM 34245 O WAT 6142 85.552 62.641 19.728 1.00 0.00 O ATOM 34246 H1 WAT 6142 86.029 63.446 19.929 1.00 0.00 H ATOM 34247 H2 WAT 6142 85.205 62.352 20.572 1.00 0.00 H TER 34249 WAT 6142 ATOM 34249 O WAT 6143 4.371 75.308 77.383 1.00 0.00 O ATOM 34250 H1 WAT 6143 4.173 76.143 76.958 1.00 0.00 H ATOM 34251 H2 WAT 6143 4.877 74.822 76.732 1.00 0.00 H TER 34253 WAT 6143 ATOM 34253 O WAT 6144 101.458 70.135 114.894 1.00 0.00 O ATOM 34254 H1 WAT 6144 101.334 70.339 115.821 1.00 0.00 H ATOM 34255 H2 WAT 6144 102.237 69.579 114.873 1.00 0.00 H TER 34257 WAT 6144 ATOM 34257 O WAT 6145 89.676 26.264 66.750 1.00 0.00 O ATOM 34258 H1 WAT 6145 89.756 26.358 65.801 1.00 0.00 H ATOM 34259 H2 WAT 6145 90.185 25.480 66.957 1.00 0.00 H TER 34261 WAT 6145 ATOM 34261 O WAT 6146 86.596 68.762 125.595 1.00 0.00 O ATOM 34262 H1 WAT 6146 86.225 68.124 126.205 1.00 0.00 H ATOM 34263 H2 WAT 6146 85.889 69.390 125.446 1.00 0.00 H TER 34265 WAT 6146 ATOM 34265 O WAT 6147 89.492 11.877 115.287 1.00 0.00 O ATOM 34266 H1 WAT 6147 88.785 11.263 115.487 1.00 0.00 H ATOM 34267 H2 WAT 6147 90.249 11.320 115.106 1.00 0.00 H TER 34269 WAT 6147 ATOM 34269 O WAT 6148 35.651 117.834 131.461 1.00 0.00 O ATOM 34270 H1 WAT 6148 34.696 117.850 131.401 1.00 0.00 H ATOM 34271 H2 WAT 6148 35.878 116.905 131.414 1.00 0.00 H TER 34273 WAT 6148 ATOM 34273 O WAT 6149 119.155 80.546 72.639 1.00 0.00 O ATOM 34274 H1 WAT 6149 118.450 80.653 73.277 1.00 0.00 H ATOM 34275 H2 WAT 6149 119.019 79.671 72.276 1.00 0.00 H TER 34277 WAT 6149 ATOM 34277 O WAT 6150 84.439 51.549 77.250 1.00 0.00 O ATOM 34278 H1 WAT 6150 84.720 51.148 78.073 1.00 0.00 H ATOM 34279 H2 WAT 6150 84.771 50.961 76.572 1.00 0.00 H TER 34281 WAT 6150 ATOM 34281 O WAT 6151 87.932 94.314 75.165 1.00 0.00 O ATOM 34282 H1 WAT 6151 88.424 94.227 74.349 1.00 0.00 H ATOM 34283 H2 WAT 6151 88.383 95.010 75.644 1.00 0.00 H TER 34285 WAT 6151 ATOM 34285 O WAT 6152 125.295 63.846 92.719 1.00 0.00 O ATOM 34286 H1 WAT 6152 125.575 63.635 93.610 1.00 0.00 H ATOM 34287 H2 WAT 6152 126.098 64.115 92.274 1.00 0.00 H TER 34289 WAT 6152 ATOM 34289 O WAT 6153 110.748 131.522 99.515 1.00 0.00 O ATOM 34290 H1 WAT 6153 110.863 130.599 99.740 1.00 0.00 H ATOM 34291 H2 WAT 6153 109.893 131.753 99.879 1.00 0.00 H TER 34293 WAT 6153 ATOM 34293 O WAT 6154 68.970 52.884 138.990 1.00 0.00 O ATOM 34294 H1 WAT 6154 69.820 52.445 138.977 1.00 0.00 H ATOM 34295 H2 WAT 6154 68.835 53.170 138.086 1.00 0.00 H TER 34297 WAT 6154 ATOM 34297 O WAT 6155 93.828 67.583 8.226 1.00 0.00 O ATOM 34298 H1 WAT 6155 94.080 68.430 7.856 1.00 0.00 H ATOM 34299 H2 WAT 6155 93.203 67.224 7.597 1.00 0.00 H TER 34301 WAT 6155 ATOM 34301 O WAT 6156 97.586 64.031 10.114 1.00 0.00 O ATOM 34302 H1 WAT 6156 97.591 63.134 9.777 1.00 0.00 H ATOM 34303 H2 WAT 6156 96.729 64.375 9.865 1.00 0.00 H TER 34305 WAT 6156 ATOM 34305 O WAT 6157 119.504 76.536 142.447 1.00 0.00 O ATOM 34306 H1 WAT 6157 119.625 75.901 143.153 1.00 0.00 H ATOM 34307 H2 WAT 6157 119.365 77.370 142.895 1.00 0.00 H TER 34309 WAT 6157 ATOM 34309 O WAT 6158 104.320 7.441 2.495 1.00 0.00 O ATOM 34310 H1 WAT 6158 105.076 7.212 3.036 1.00 0.00 H ATOM 34311 H2 WAT 6158 104.053 6.614 2.094 1.00 0.00 H TER 34313 WAT 6158 ATOM 34313 O WAT 6159 100.829 47.208 125.683 1.00 0.00 O ATOM 34314 H1 WAT 6159 101.167 48.054 125.977 1.00 0.00 H ATOM 34315 H2 WAT 6159 100.402 47.398 124.848 1.00 0.00 H TER 34317 WAT 6159 ATOM 34317 O WAT 6160 85.300 29.639 5.279 1.00 0.00 O ATOM 34318 H1 WAT 6160 85.533 29.705 6.205 1.00 0.00 H ATOM 34319 H2 WAT 6160 85.035 28.727 5.163 1.00 0.00 H TER 34321 WAT 6160 ATOM 34321 O WAT 6161 93.575 78.820 70.726 1.00 0.00 O ATOM 34322 H1 WAT 6161 93.186 77.948 70.803 1.00 0.00 H ATOM 34323 H2 WAT 6161 93.745 79.087 71.629 1.00 0.00 H TER 34325 WAT 6161 ATOM 34325 O WAT 6162 11.212 5.010 58.313 1.00 0.00 O ATOM 34326 H1 WAT 6162 11.204 4.142 58.717 1.00 0.00 H ATOM 34327 H2 WAT 6162 11.111 5.617 59.047 1.00 0.00 H TER 34329 WAT 6162 ATOM 34329 O WAT 6163 112.508 8.350 105.235 1.00 0.00 O ATOM 34330 H1 WAT 6163 113.219 7.748 105.016 1.00 0.00 H ATOM 34331 H2 WAT 6163 112.211 8.689 104.391 1.00 0.00 H TER 34333 WAT 6163 ATOM 34333 O WAT 6164 44.833 54.460 155.747 1.00 0.00 O ATOM 34334 H1 WAT 6164 45.258 55.307 155.885 1.00 0.00 H ATOM 34335 H2 WAT 6164 45.427 53.826 156.148 1.00 0.00 H TER 34337 WAT 6164 ATOM 34337 O WAT 6165 97.758 60.105 113.942 1.00 0.00 O ATOM 34338 H1 WAT 6165 97.393 59.745 113.133 1.00 0.00 H ATOM 34339 H2 WAT 6165 97.616 61.048 113.870 1.00 0.00 H TER 34341 WAT 6165 ATOM 34341 O WAT 6166 72.773 40.918 97.213 1.00 0.00 O ATOM 34342 H1 WAT 6166 73.521 41.452 96.945 1.00 0.00 H ATOM 34343 H2 WAT 6166 72.018 41.498 97.116 1.00 0.00 H TER 34345 WAT 6166 ATOM 34345 O WAT 6167 11.281 11.330 62.064 1.00 0.00 O ATOM 34346 H1 WAT 6167 11.524 11.748 61.238 1.00 0.00 H ATOM 34347 H2 WAT 6167 12.117 11.128 62.485 1.00 0.00 H TER 34349 WAT 6167 ATOM 34349 O WAT 6168 120.648 65.247 93.968 1.00 0.00 O ATOM 34350 H1 WAT 6168 120.465 65.814 93.219 1.00 0.00 H ATOM 34351 H2 WAT 6168 120.826 65.851 94.688 1.00 0.00 H TER 34353 WAT 6168 ATOM 34353 O WAT 6169 10.441 83.468 133.736 1.00 0.00 O ATOM 34354 H1 WAT 6169 10.606 82.835 133.038 1.00 0.00 H ATOM 34355 H2 WAT 6169 9.625 83.172 134.140 1.00 0.00 H TER 34357 WAT 6169 ATOM 34357 O WAT 6170 70.598 57.133 58.704 1.00 0.00 O ATOM 34358 H1 WAT 6170 69.764 57.196 58.239 1.00 0.00 H ATOM 34359 H2 WAT 6170 71.252 57.041 58.012 1.00 0.00 H TER 34361 WAT 6170 ATOM 34361 O WAT 6171 100.257 6.682 119.373 1.00 0.00 O ATOM 34362 H1 WAT 6171 100.220 6.239 118.525 1.00 0.00 H ATOM 34363 H2 WAT 6171 99.354 6.673 119.688 1.00 0.00 H TER 34365 WAT 6171 ATOM 34365 O WAT 6172 94.196 74.454 153.159 1.00 0.00 O ATOM 34366 H1 WAT 6172 93.593 73.890 152.675 1.00 0.00 H ATOM 34367 H2 WAT 6172 93.711 75.269 153.287 1.00 0.00 H TER 34369 WAT 6172 ATOM 34369 O WAT 6173 16.829 19.959 141.142 1.00 0.00 O ATOM 34370 H1 WAT 6173 15.886 20.120 141.171 1.00 0.00 H ATOM 34371 H2 WAT 6173 17.219 20.758 141.498 1.00 0.00 H TER 34373 WAT 6173 ATOM 34373 O WAT 6174 127.214 55.423 56.331 1.00 0.00 O ATOM 34374 H1 WAT 6174 128.031 55.154 55.913 1.00 0.00 H ATOM 34375 H2 WAT 6174 127.316 55.162 57.246 1.00 0.00 H TER 34377 WAT 6174 ATOM 34377 O WAT 6175 122.098 86.583 150.666 1.00 0.00 O ATOM 34378 H1 WAT 6175 121.590 85.800 150.880 1.00 0.00 H ATOM 34379 H2 WAT 6175 121.604 87.304 151.055 1.00 0.00 H TER 34381 WAT 6175 ATOM 34381 O WAT 6176 106.483 98.033 97.573 1.00 0.00 O ATOM 34382 H1 WAT 6176 106.460 98.533 96.757 1.00 0.00 H ATOM 34383 H2 WAT 6176 105.654 98.239 98.005 1.00 0.00 H TER 34385 WAT 6176 ATOM 34385 O WAT 6177 36.409 23.161 62.255 1.00 0.00 O ATOM 34386 H1 WAT 6177 36.759 24.038 62.410 1.00 0.00 H ATOM 34387 H2 WAT 6177 36.505 23.028 61.312 1.00 0.00 H TER 34389 WAT 6177 ATOM 34389 O WAT 6178 104.822 145.076 70.482 1.00 0.00 O ATOM 34390 H1 WAT 6178 104.808 145.262 69.543 1.00 0.00 H ATOM 34391 H2 WAT 6178 104.664 145.925 70.897 1.00 0.00 H TER 34393 WAT 6178 ATOM 34393 O WAT 6179 124.481 80.600 136.313 1.00 0.00 O ATOM 34394 H1 WAT 6179 123.980 80.620 137.128 1.00 0.00 H ATOM 34395 H2 WAT 6179 125.131 81.295 136.414 1.00 0.00 H TER 34397 WAT 6179 ATOM 34397 O WAT 6180 123.249 42.767 105.357 1.00 0.00 O ATOM 34398 H1 WAT 6180 122.431 43.004 104.919 1.00 0.00 H ATOM 34399 H2 WAT 6180 123.608 43.601 105.660 1.00 0.00 H TER 34401 WAT 6180 ATOM 34401 O WAT 6181 122.708 88.674 99.923 1.00 0.00 O ATOM 34402 H1 WAT 6181 123.451 88.814 100.510 1.00 0.00 H ATOM 34403 H2 WAT 6181 122.867 87.812 99.538 1.00 0.00 H TER 34405 WAT 6181 ATOM 34405 O WAT 6182 89.410 144.091 129.766 1.00 0.00 O ATOM 34406 H1 WAT 6182 88.744 143.991 130.445 1.00 0.00 H ATOM 34407 H2 WAT 6182 88.939 144.463 129.021 1.00 0.00 H TER 34409 WAT 6182 ATOM 34409 O WAT 6183 71.065 64.711 17.003 1.00 0.00 O ATOM 34410 H1 WAT 6183 71.318 65.352 17.668 1.00 0.00 H ATOM 34411 H2 WAT 6183 71.337 65.105 16.175 1.00 0.00 H TER 34413 WAT 6183 ATOM 34413 O WAT 6184 139.110 97.311 114.595 1.00 0.00 O ATOM 34414 H1 WAT 6184 139.149 96.975 115.491 1.00 0.00 H ATOM 34415 H2 WAT 6184 138.223 97.661 114.509 1.00 0.00 H TER 34417 WAT 6184 ATOM 34417 O WAT 6185 24.825 42.720 99.233 1.00 0.00 O ATOM 34418 H1 WAT 6185 25.329 43.467 99.556 1.00 0.00 H ATOM 34419 H2 WAT 6185 25.328 42.397 98.485 1.00 0.00 H TER 34421 WAT 6185 ATOM 34421 O WAT 6186 102.966 19.950 134.256 1.00 0.00 O ATOM 34422 H1 WAT 6186 103.371 20.572 133.652 1.00 0.00 H ATOM 34423 H2 WAT 6186 103.000 20.386 135.108 1.00 0.00 H TER 34425 WAT 6186 ATOM 34425 O WAT 6187 54.662 143.497 137.013 1.00 0.00 O ATOM 34426 H1 WAT 6187 55.031 142.720 136.595 1.00 0.00 H ATOM 34427 H2 WAT 6187 54.703 144.175 136.338 1.00 0.00 H TER 34429 WAT 6187 ATOM 34429 O WAT 6188 54.600 134.209 99.720 1.00 0.00 O ATOM 34430 H1 WAT 6188 54.651 135.143 99.927 1.00 0.00 H ATOM 34431 H2 WAT 6188 54.397 133.789 100.556 1.00 0.00 H TER 34433 WAT 6188 ATOM 34433 O WAT 6189 38.104 1.580 125.517 1.00 0.00 O ATOM 34434 H1 WAT 6189 38.136 2.496 125.794 1.00 0.00 H ATOM 34435 H2 WAT 6189 38.733 1.526 124.798 1.00 0.00 H TER 34437 WAT 6189 ATOM 34437 O WAT 6190 136.453 10.440 17.465 1.00 0.00 O ATOM 34438 H1 WAT 6190 136.331 9.875 18.229 1.00 0.00 H ATOM 34439 H2 WAT 6190 137.273 10.902 17.638 1.00 0.00 H TER 34441 WAT 6190 ATOM 34441 O WAT 6191 107.262 128.099 132.128 1.00 0.00 O ATOM 34442 H1 WAT 6191 106.669 127.366 132.290 1.00 0.00 H ATOM 34443 H2 WAT 6191 107.793 128.157 132.922 1.00 0.00 H TER 34445 WAT 6191 ATOM 34445 O WAT 6192 8.127 2.499 134.519 1.00 0.00 O ATOM 34446 H1 WAT 6192 8.416 2.868 133.685 1.00 0.00 H ATOM 34447 H2 WAT 6192 7.826 3.255 135.024 1.00 0.00 H TER 34449 WAT 6192 ATOM 34449 O WAT 6193 49.488 43.349 96.944 1.00 0.00 O ATOM 34450 H1 WAT 6193 50.061 42.669 96.590 1.00 0.00 H ATOM 34451 H2 WAT 6193 48.947 43.617 96.201 1.00 0.00 H TER 34453 WAT 6193 ATOM 34453 O WAT 6194 76.001 72.224 133.108 1.00 0.00 O ATOM 34454 H1 WAT 6194 75.382 71.857 132.476 1.00 0.00 H ATOM 34455 H2 WAT 6194 75.478 72.833 133.629 1.00 0.00 H TER 34457 WAT 6194 ATOM 34457 O WAT 6195 75.537 83.739 76.274 1.00 0.00 O ATOM 34458 H1 WAT 6195 76.278 83.944 76.845 1.00 0.00 H ATOM 34459 H2 WAT 6195 75.445 84.510 75.715 1.00 0.00 H TER 34461 WAT 6195 ATOM 34461 O WAT 6196 134.387 137.965 95.166 1.00 0.00 O ATOM 34462 H1 WAT 6196 134.875 138.270 95.931 1.00 0.00 H ATOM 34463 H2 WAT 6196 133.797 137.294 95.511 1.00 0.00 H TER 34465 WAT 6196 ATOM 34465 O WAT 6197 32.871 68.645 146.336 1.00 0.00 O ATOM 34466 H1 WAT 6197 33.010 67.883 146.899 1.00 0.00 H ATOM 34467 H2 WAT 6197 33.419 69.329 146.720 1.00 0.00 H TER 34469 WAT 6197 ATOM 34469 O WAT 6198 114.167 59.416 139.255 1.00 0.00 O ATOM 34470 H1 WAT 6198 113.379 58.979 138.933 1.00 0.00 H ATOM 34471 H2 WAT 6198 113.904 60.330 139.369 1.00 0.00 H TER 34473 WAT 6198 ATOM 34473 O WAT 6199 75.825 70.846 129.319 1.00 0.00 O ATOM 34474 H1 WAT 6199 76.630 70.414 129.603 1.00 0.00 H ATOM 34475 H2 WAT 6199 76.117 71.681 128.954 1.00 0.00 H TER 34477 WAT 6199 ATOM 34477 O WAT 6200 40.683 66.200 120.545 1.00 0.00 O ATOM 34478 H1 WAT 6200 40.811 65.710 119.733 1.00 0.00 H ATOM 34479 H2 WAT 6200 40.035 66.868 120.322 1.00 0.00 H TER 34481 WAT 6200 ATOM 34481 O WAT 6201 9.006 122.469 151.543 1.00 0.00 O ATOM 34482 H1 WAT 6201 8.218 122.985 151.712 1.00 0.00 H ATOM 34483 H2 WAT 6201 9.168 122.002 152.362 1.00 0.00 H TER 34485 WAT 6201 ATOM 34485 O WAT 6202 22.065 40.120 63.835 1.00 0.00 O ATOM 34486 H1 WAT 6202 22.509 40.414 63.039 1.00 0.00 H ATOM 34487 H2 WAT 6202 21.981 40.910 64.369 1.00 0.00 H TER 34489 WAT 6202 ATOM 34489 O WAT 6203 21.570 47.005 57.582 1.00 0.00 O ATOM 34490 H1 WAT 6203 21.593 46.076 57.354 1.00 0.00 H ATOM 34491 H2 WAT 6203 20.651 47.179 57.784 1.00 0.00 H TER 34493 WAT 6203 ATOM 34493 O WAT 6204 45.644 116.685 143.439 1.00 0.00 O ATOM 34494 H1 WAT 6204 46.441 116.441 143.910 1.00 0.00 H ATOM 34495 H2 WAT 6204 45.048 115.949 143.581 1.00 0.00 H TER 34497 WAT 6204 ATOM 34497 O WAT 6205 125.190 48.236 4.422 1.00 0.00 O ATOM 34498 H1 WAT 6205 125.448 48.552 5.288 1.00 0.00 H ATOM 34499 H2 WAT 6205 124.462 47.638 4.592 1.00 0.00 H TER 34501 WAT 6205 ATOM 34501 O WAT 6206 34.321 125.638 101.479 1.00 0.00 O ATOM 34502 H1 WAT 6206 35.130 126.140 101.574 1.00 0.00 H ATOM 34503 H2 WAT 6206 33.691 126.091 102.039 1.00 0.00 H TER 34505 WAT 6206 ATOM 34505 O WAT 6207 35.584 117.255 96.769 1.00 0.00 O ATOM 34506 H1 WAT 6207 34.753 117.708 96.628 1.00 0.00 H ATOM 34507 H2 WAT 6207 36.226 117.958 96.867 1.00 0.00 H TER 34509 WAT 6207 ATOM 34509 O WAT 6208 37.784 47.398 146.093 1.00 0.00 O ATOM 34510 H1 WAT 6208 38.027 47.106 146.971 1.00 0.00 H ATOM 34511 H2 WAT 6208 38.582 47.794 145.743 1.00 0.00 H TER 34513 WAT 6208 ATOM 34513 O WAT 6209 39.269 14.705 19.667 1.00 0.00 O ATOM 34514 H1 WAT 6209 39.362 15.629 19.898 1.00 0.00 H ATOM 34515 H2 WAT 6209 38.447 14.437 20.079 1.00 0.00 H TER 34517 WAT 6209 ATOM 34517 O WAT 6210 61.166 11.611 3.051 1.00 0.00 O ATOM 34518 H1 WAT 6210 61.017 11.082 2.268 1.00 0.00 H ATOM 34519 H2 WAT 6210 61.512 10.993 3.695 1.00 0.00 H TER 34521 WAT 6210 ATOM 34521 O WAT 6211 37.844 122.230 86.790 1.00 0.00 O ATOM 34522 H1 WAT 6211 37.149 122.455 86.171 1.00 0.00 H ATOM 34523 H2 WAT 6211 38.586 121.983 86.237 1.00 0.00 H TER 34525 WAT 6211 ATOM 34525 O WAT 6212 138.167 19.285 110.028 1.00 0.00 O ATOM 34526 H1 WAT 6212 138.559 18.614 109.468 1.00 0.00 H ATOM 34527 H2 WAT 6212 137.232 19.080 110.028 1.00 0.00 H TER 34529 WAT 6212 ATOM 34529 O WAT 6213 114.614 120.118 83.476 1.00 0.00 O ATOM 34530 H1 WAT 6213 115.036 120.288 82.634 1.00 0.00 H ATOM 34531 H2 WAT 6213 113.847 120.690 83.478 1.00 0.00 H TER 34533 WAT 6213 ATOM 34533 O WAT 6214 84.407 105.274 126.192 1.00 0.00 O ATOM 34534 H1 WAT 6214 83.702 105.761 125.765 1.00 0.00 H ATOM 34535 H2 WAT 6214 85.208 105.712 125.905 1.00 0.00 H TER 34537 WAT 6214 ATOM 34537 O WAT 6215 6.674 134.823 3.658 1.00 0.00 O ATOM 34538 H1 WAT 6215 6.756 135.250 4.510 1.00 0.00 H ATOM 34539 H2 WAT 6215 7.494 135.027 3.207 1.00 0.00 H TER 34541 WAT 6215 ATOM 34541 O WAT 6216 9.688 59.201 6.312 1.00 0.00 O ATOM 34542 H1 WAT 6216 10.376 59.213 6.978 1.00 0.00 H ATOM 34543 H2 WAT 6216 8.880 59.060 6.806 1.00 0.00 H TER 34545 WAT 6216 ATOM 34545 O WAT 6217 139.572 7.703 59.621 1.00 0.00 O ATOM 34546 H1 WAT 6217 139.931 7.030 60.199 1.00 0.00 H ATOM 34547 H2 WAT 6217 138.822 7.282 59.200 1.00 0.00 H TER 34549 WAT 6217 ATOM 34549 O WAT 6218 103.583 116.186 96.509 1.00 0.00 O ATOM 34550 H1 WAT 6218 103.639 115.750 95.660 1.00 0.00 H ATOM 34551 H2 WAT 6218 102.646 116.334 96.641 1.00 0.00 H TER 34553 WAT 6218 ATOM 34553 O WAT 6219 98.758 14.742 130.047 1.00 0.00 O ATOM 34554 H1 WAT 6219 98.506 13.930 129.609 1.00 0.00 H ATOM 34555 H2 WAT 6219 98.592 14.576 130.975 1.00 0.00 H TER 34557 WAT 6219 ATOM 34557 O WAT 6220 92.339 36.528 124.188 1.00 0.00 O ATOM 34558 H1 WAT 6220 92.549 36.399 125.113 1.00 0.00 H ATOM 34559 H2 WAT 6220 91.405 36.736 124.182 1.00 0.00 H TER 34561 WAT 6220 ATOM 34561 O WAT 6221 137.979 27.061 131.426 1.00 0.00 O ATOM 34562 H1 WAT 6221 138.831 26.654 131.270 1.00 0.00 H ATOM 34563 H2 WAT 6221 137.845 27.632 130.669 1.00 0.00 H TER 34565 WAT 6221 ATOM 34565 O WAT 6222 66.817 124.440 109.460 1.00 0.00 O ATOM 34566 H1 WAT 6222 66.825 123.511 109.230 1.00 0.00 H ATOM 34567 H2 WAT 6222 65.980 124.570 109.905 1.00 0.00 H TER 34569 WAT 6222 ATOM 34569 O WAT 6223 17.102 22.944 134.121 1.00 0.00 O ATOM 34570 H1 WAT 6223 16.814 23.618 134.737 1.00 0.00 H ATOM 34571 H2 WAT 6223 17.373 22.213 134.676 1.00 0.00 H TER 34573 WAT 6223 ATOM 34573 O WAT 6224 95.066 68.565 156.335 1.00 0.00 O ATOM 34574 H1 WAT 6224 94.761 67.682 156.125 1.00 0.00 H ATOM 34575 H2 WAT 6224 94.719 68.737 157.210 1.00 0.00 H TER 34577 WAT 6224 ATOM 34577 O WAT 6225 65.128 127.747 145.482 1.00 0.00 O ATOM 34578 H1 WAT 6225 64.301 128.076 145.130 1.00 0.00 H ATOM 34579 H2 WAT 6225 65.414 127.091 144.847 1.00 0.00 H TER 34581 WAT 6225 ATOM 34581 O WAT 6226 16.429 71.240 125.322 1.00 0.00 O ATOM 34582 H1 WAT 6226 16.045 70.596 125.917 1.00 0.00 H ATOM 34583 H2 WAT 6226 15.679 71.610 124.855 1.00 0.00 H TER 34585 WAT 6226 ATOM 34585 O WAT 6227 1.291 35.536 91.153 1.00 0.00 O ATOM 34586 H1 WAT 6227 1.707 35.649 92.008 1.00 0.00 H ATOM 34587 H2 WAT 6227 1.750 34.794 90.760 1.00 0.00 H TER 34589 WAT 6227 ATOM 34589 O WAT 6228 18.056 46.317 7.591 1.00 0.00 O ATOM 34590 H1 WAT 6228 17.613 46.109 6.769 1.00 0.00 H ATOM 34591 H2 WAT 6228 17.957 45.527 8.123 1.00 0.00 H TER 34593 WAT 6228 ATOM 34593 O WAT 6229 75.562 76.920 100.976 1.00 0.00 O ATOM 34594 H1 WAT 6229 75.553 76.018 101.297 1.00 0.00 H ATOM 34595 H2 WAT 6229 74.638 77.163 100.916 1.00 0.00 H TER 34597 WAT 6229 ATOM 34597 O WAT 6230 105.066 120.489 8.263 1.00 0.00 O ATOM 34598 H1 WAT 6230 105.626 119.980 7.678 1.00 0.00 H ATOM 34599 H2 WAT 6230 105.455 121.364 8.266 1.00 0.00 H TER 34601 WAT 6230 ATOM 34601 O WAT 6231 60.369 126.529 98.337 1.00 0.00 O ATOM 34602 H1 WAT 6231 61.170 126.031 98.500 1.00 0.00 H ATOM 34603 H2 WAT 6231 60.654 127.443 98.317 1.00 0.00 H TER 34605 WAT 6231 ATOM 34605 O WAT 6232 64.008 11.241 98.081 1.00 0.00 O ATOM 34606 H1 WAT 6232 64.812 11.022 97.610 1.00 0.00 H ATOM 34607 H2 WAT 6232 64.189 12.090 98.483 1.00 0.00 H TER 34609 WAT 6232 ATOM 34609 O WAT 6233 5.156 105.904 14.075 1.00 0.00 O ATOM 34610 H1 WAT 6233 4.514 106.126 13.401 1.00 0.00 H ATOM 34611 H2 WAT 6233 5.989 105.858 13.606 1.00 0.00 H TER 34613 WAT 6233 ATOM 34613 O WAT 6234 95.122 128.032 22.756 1.00 0.00 O ATOM 34614 H1 WAT 6234 95.621 127.224 22.868 1.00 0.00 H ATOM 34615 H2 WAT 6234 94.959 128.339 23.648 1.00 0.00 H TER 34617 WAT 6234 ATOM 34617 O WAT 6235 51.880 54.429 154.237 1.00 0.00 O ATOM 34618 H1 WAT 6235 51.348 54.897 154.881 1.00 0.00 H ATOM 34619 H2 WAT 6235 52.375 55.116 153.791 1.00 0.00 H TER 34621 WAT 6235 ATOM 34621 O WAT 6236 48.335 83.971 137.974 1.00 0.00 O ATOM 34622 H1 WAT 6236 47.757 83.220 137.839 1.00 0.00 H ATOM 34623 H2 WAT 6236 48.503 84.305 137.092 1.00 0.00 H TER 34625 WAT 6236 ATOM 34625 O WAT 6237 108.263 145.259 95.849 1.00 0.00 O ATOM 34626 H1 WAT 6237 108.836 144.584 95.486 1.00 0.00 H ATOM 34627 H2 WAT 6237 108.051 145.820 95.103 1.00 0.00 H TER 34629 WAT 6237 ATOM 34629 O WAT 6238 103.968 102.368 67.099 1.00 0.00 O ATOM 34630 H1 WAT 6238 104.214 102.777 66.269 1.00 0.00 H ATOM 34631 H2 WAT 6238 104.791 102.034 67.456 1.00 0.00 H TER 34633 WAT 6238 ATOM 34633 O WAT 6239 143.423 87.882 87.735 1.00 0.00 O ATOM 34634 H1 WAT 6239 143.376 88.231 88.626 1.00 0.00 H ATOM 34635 H2 WAT 6239 143.790 87.005 87.842 1.00 0.00 H TER 34637 WAT 6239 ATOM 34637 O WAT 6240 22.012 82.514 109.217 1.00 0.00 O ATOM 34638 H1 WAT 6240 21.715 83.127 108.544 1.00 0.00 H ATOM 34639 H2 WAT 6240 21.510 81.715 109.052 1.00 0.00 H TER 34641 WAT 6240 ATOM 34641 O WAT 6241 115.658 98.604 103.741 1.00 0.00 O ATOM 34642 H1 WAT 6241 115.999 98.050 103.039 1.00 0.00 H ATOM 34643 H2 WAT 6241 115.747 98.070 104.531 1.00 0.00 H TER 34645 WAT 6241 ATOM 34645 O WAT 6242 10.620 120.097 3.806 1.00 0.00 O ATOM 34646 H1 WAT 6242 10.888 120.173 4.722 1.00 0.00 H ATOM 34647 H2 WAT 6242 10.646 119.158 3.625 1.00 0.00 H TER 34649 WAT 6242 ATOM 34649 O WAT 6243 97.562 35.218 109.121 1.00 0.00 O ATOM 34650 H1 WAT 6243 97.723 35.134 110.061 1.00 0.00 H ATOM 34651 H2 WAT 6243 96.722 35.672 109.062 1.00 0.00 H TER 34653 WAT 6243 ATOM 34653 O WAT 6244 136.163 52.076 143.666 1.00 0.00 O ATOM 34654 H1 WAT 6244 137.070 51.849 143.461 1.00 0.00 H ATOM 34655 H2 WAT 6244 135.684 51.908 142.855 1.00 0.00 H TER 34657 WAT 6244 ATOM 34657 O WAT 6245 118.519 84.709 22.513 1.00 0.00 O ATOM 34658 H1 WAT 6245 118.742 84.373 23.381 1.00 0.00 H ATOM 34659 H2 WAT 6245 118.612 83.953 21.933 1.00 0.00 H TER 34661 WAT 6245 ATOM 34661 O WAT 6246 65.260 70.625 140.222 1.00 0.00 O ATOM 34662 H1 WAT 6246 65.244 69.733 140.568 1.00 0.00 H ATOM 34663 H2 WAT 6246 64.707 71.125 140.823 1.00 0.00 H TER 34665 WAT 6246 ATOM 34665 O WAT 6247 92.977 112.416 26.930 1.00 0.00 O ATOM 34666 H1 WAT 6247 92.144 112.449 27.402 1.00 0.00 H ATOM 34667 H2 WAT 6247 93.217 111.489 26.934 1.00 0.00 H TER 34669 WAT 6247 ATOM 34669 O WAT 6248 47.103 128.192 22.868 1.00 0.00 O ATOM 34670 H1 WAT 6248 46.915 127.361 23.304 1.00 0.00 H ATOM 34671 H2 WAT 6248 46.245 128.518 22.594 1.00 0.00 H TER 34673 WAT 6248 ATOM 34673 O WAT 6249 115.226 5.118 65.887 1.00 0.00 O ATOM 34674 H1 WAT 6249 115.553 4.792 66.726 1.00 0.00 H ATOM 34675 H2 WAT 6249 115.044 4.329 65.378 1.00 0.00 H TER 34677 WAT 6249 ATOM 34677 O WAT 6250 97.555 2.692 15.638 1.00 0.00 O ATOM 34678 H1 WAT 6250 98.111 2.473 16.386 1.00 0.00 H ATOM 34679 H2 WAT 6250 97.892 2.153 14.923 1.00 0.00 H TER 34681 WAT 6250 ATOM 34681 O WAT 6251 78.281 85.762 102.490 1.00 0.00 O ATOM 34682 H1 WAT 6251 77.767 85.264 101.854 1.00 0.00 H ATOM 34683 H2 WAT 6251 78.546 86.551 102.017 1.00 0.00 H TER 34685 WAT 6251 ATOM 34685 O WAT 6252 128.324 69.641 3.105 1.00 0.00 O ATOM 34686 H1 WAT 6252 128.485 70.358 2.492 1.00 0.00 H ATOM 34687 H2 WAT 6252 127.978 70.068 3.888 1.00 0.00 H TER 34689 WAT 6252 ATOM 34689 O WAT 6253 3.079 87.487 112.359 1.00 0.00 O ATOM 34690 H1 WAT 6253 3.379 86.741 111.840 1.00 0.00 H ATOM 34691 H2 WAT 6253 3.703 88.185 112.157 1.00 0.00 H TER 34693 WAT 6253 ATOM 34693 O WAT 6254 8.584 80.806 79.431 1.00 0.00 O ATOM 34694 H1 WAT 6254 7.959 80.118 79.204 1.00 0.00 H ATOM 34695 H2 WAT 6254 8.175 81.613 79.118 1.00 0.00 H TER 34697 WAT 6254 ATOM 34697 O WAT 6255 91.670 89.286 69.121 1.00 0.00 O ATOM 34698 H1 WAT 6255 92.232 89.848 68.589 1.00 0.00 H ATOM 34699 H2 WAT 6255 91.169 89.894 69.666 1.00 0.00 H TER 34701 WAT 6255 ATOM 34701 O WAT 6256 97.597 7.074 126.983 1.00 0.00 O ATOM 34702 H1 WAT 6256 97.039 6.439 127.432 1.00 0.00 H ATOM 34703 H2 WAT 6256 97.033 7.455 126.310 1.00 0.00 H TER 34705 WAT 6256 ATOM 34705 O WAT 6257 51.079 137.430 75.257 1.00 0.00 O ATOM 34706 H1 WAT 6257 50.302 137.465 75.815 1.00 0.00 H ATOM 34707 H2 WAT 6257 51.192 136.499 75.062 1.00 0.00 H TER 34709 WAT 6257 ATOM 34709 O WAT 6258 30.055 143.171 69.675 1.00 0.00 O ATOM 34710 H1 WAT 6258 30.283 143.787 68.980 1.00 0.00 H ATOM 34711 H2 WAT 6258 30.859 142.676 69.831 1.00 0.00 H TER 34713 WAT 6258 ATOM 34713 O WAT 6259 106.216 72.614 10.186 1.00 0.00 O ATOM 34714 H1 WAT 6259 105.305 72.330 10.120 1.00 0.00 H ATOM 34715 H2 WAT 6259 106.388 73.061 9.357 1.00 0.00 H TER 34717 WAT 6259 ATOM 34717 O WAT 6260 56.082 123.666 105.224 1.00 0.00 O ATOM 34718 H1 WAT 6260 56.713 124.197 104.739 1.00 0.00 H ATOM 34719 H2 WAT 6260 55.529 124.304 105.676 1.00 0.00 H TER 34721 WAT 6260 ATOM 34721 O WAT 6261 145.637 115.274 105.335 1.00 0.00 O ATOM 34722 H1 WAT 6261 146.241 115.306 104.594 1.00 0.00 H ATOM 34723 H2 WAT 6261 144.952 115.905 105.113 1.00 0.00 H TER 34725 WAT 6261 ATOM 34725 O WAT 6262 7.310 6.601 125.169 1.00 0.00 O ATOM 34726 H1 WAT 6262 6.356 6.528 125.122 1.00 0.00 H ATOM 34727 H2 WAT 6262 7.504 6.602 126.106 1.00 0.00 H TER 34729 WAT 6262 ATOM 34729 O WAT 6263 144.188 114.221 140.040 1.00 0.00 O ATOM 34730 H1 WAT 6263 144.772 114.875 139.657 1.00 0.00 H ATOM 34731 H2 WAT 6263 143.513 114.083 139.375 1.00 0.00 H TER 34733 WAT 6263 ATOM 34733 O WAT 6264 97.154 132.686 117.399 1.00 0.00 O ATOM 34734 H1 WAT 6264 96.234 132.474 117.242 1.00 0.00 H ATOM 34735 H2 WAT 6264 97.180 132.982 118.308 1.00 0.00 H TER 34737 WAT 6264 ATOM 34737 O WAT 6265 115.830 55.015 16.461 1.00 0.00 O ATOM 34738 H1 WAT 6265 116.524 55.364 15.902 1.00 0.00 H ATOM 34739 H2 WAT 6265 116.097 55.251 17.350 1.00 0.00 H TER 34741 WAT 6265 ATOM 34741 O WAT 6266 1.991 114.331 107.199 1.00 0.00 O ATOM 34742 H1 WAT 6266 2.158 114.291 108.141 1.00 0.00 H ATOM 34743 H2 WAT 6266 1.566 115.178 107.067 1.00 0.00 H TER 34745 WAT 6266 ATOM 34745 O WAT 6267 17.245 116.045 128.473 1.00 0.00 O ATOM 34746 H1 WAT 6267 16.991 116.111 127.552 1.00 0.00 H ATOM 34747 H2 WAT 6267 16.426 115.867 128.935 1.00 0.00 H TER 34749 WAT 6267 ATOM 34749 O WAT 6268 59.457 112.352 120.557 1.00 0.00 O ATOM 34750 H1 WAT 6268 59.206 111.683 119.920 1.00 0.00 H ATOM 34751 H2 WAT 6268 59.741 111.855 121.325 1.00 0.00 H TER 34753 WAT 6268 ATOM 34753 O WAT 6269 17.368 49.449 83.384 1.00 0.00 O ATOM 34754 H1 WAT 6269 17.757 48.575 83.357 1.00 0.00 H ATOM 34755 H2 WAT 6269 16.429 49.290 83.485 1.00 0.00 H TER 34757 WAT 6269 ATOM 34757 O WAT 6270 57.476 70.183 92.104 1.00 0.00 O ATOM 34758 H1 WAT 6270 56.771 70.024 91.476 1.00 0.00 H ATOM 34759 H2 WAT 6270 57.044 70.168 92.958 1.00 0.00 H TER 34761 WAT 6270 ATOM 34761 O WAT 6271 51.761 42.251 128.829 1.00 0.00 O ATOM 34762 H1 WAT 6271 52.406 42.412 129.518 1.00 0.00 H ATOM 34763 H2 WAT 6271 51.139 41.638 129.222 1.00 0.00 H TER 34765 WAT 6271 ATOM 34765 O WAT 6272 60.175 29.718 88.499 1.00 0.00 O ATOM 34766 H1 WAT 6272 60.054 29.203 89.298 1.00 0.00 H ATOM 34767 H2 WAT 6272 59.337 29.651 88.042 1.00 0.00 H TER 34769 WAT 6272 ATOM 34769 O WAT 6273 102.275 86.890 142.954 1.00 0.00 O ATOM 34770 H1 WAT 6273 101.486 86.480 142.601 1.00 0.00 H ATOM 34771 H2 WAT 6273 102.455 86.409 143.762 1.00 0.00 H TER 34773 WAT 6273 ATOM 34773 O WAT 6274 49.333 9.494 74.655 1.00 0.00 O ATOM 34774 H1 WAT 6274 48.786 9.283 75.413 1.00 0.00 H ATOM 34775 H2 WAT 6274 50.027 10.050 75.008 1.00 0.00 H TER 34777 WAT 6274 ATOM 34777 O WAT 6275 42.691 9.006 82.596 1.00 0.00 O ATOM 34778 H1 WAT 6275 43.165 9.502 81.928 1.00 0.00 H ATOM 34779 H2 WAT 6275 41.781 9.287 82.500 1.00 0.00 H TER 34781 WAT 6275 ATOM 34781 O WAT 6276 10.798 59.285 108.769 1.00 0.00 O ATOM 34782 H1 WAT 6276 10.814 60.241 108.726 1.00 0.00 H ATOM 34783 H2 WAT 6276 11.571 59.010 108.275 1.00 0.00 H TER 34785 WAT 6276 ATOM 34785 O WAT 6277 116.399 56.697 156.205 1.00 0.00 O ATOM 34786 H1 WAT 6277 116.195 56.893 155.291 1.00 0.00 H ATOM 34787 H2 WAT 6277 115.719 57.149 156.705 1.00 0.00 H TER 34789 WAT 6277 ATOM 34789 O WAT 6278 46.041 62.472 109.869 1.00 0.00 O ATOM 34790 H1 WAT 6278 45.653 62.171 109.047 1.00 0.00 H ATOM 34791 H2 WAT 6278 46.668 63.146 109.606 1.00 0.00 H TER 34793 WAT 6278 ATOM 34793 O WAT 6279 53.645 2.525 79.379 1.00 0.00 O ATOM 34794 H1 WAT 6279 52.804 2.819 79.732 1.00 0.00 H ATOM 34795 H2 WAT 6279 53.916 1.818 79.965 1.00 0.00 H TER 34797 WAT 6279 ATOM 34797 O WAT 6280 109.823 15.674 15.109 1.00 0.00 O ATOM 34798 H1 WAT 6280 110.502 16.131 14.612 1.00 0.00 H ATOM 34799 H2 WAT 6280 110.188 15.587 15.989 1.00 0.00 H TER 34801 WAT 6280 ATOM 34801 O WAT 6281 115.367 109.806 97.189 1.00 0.00 O ATOM 34802 H1 WAT 6281 115.540 109.667 98.120 1.00 0.00 H ATOM 34803 H2 WAT 6281 115.895 110.572 96.960 1.00 0.00 H TER 34805 WAT 6281 ATOM 34805 O WAT 6282 28.405 26.032 108.683 1.00 0.00 O ATOM 34806 H1 WAT 6282 29.164 25.851 109.238 1.00 0.00 H ATOM 34807 H2 WAT 6282 27.813 26.534 109.243 1.00 0.00 H TER 34809 WAT 6282 ATOM 34809 O WAT 6283 30.948 111.021 139.404 1.00 0.00 O ATOM 34810 H1 WAT 6283 31.085 110.920 140.346 1.00 0.00 H ATOM 34811 H2 WAT 6283 30.016 111.222 139.318 1.00 0.00 H TER 34813 WAT 6283 ATOM 34813 O WAT 6284 37.771 39.486 67.222 1.00 0.00 O ATOM 34814 H1 WAT 6284 37.010 39.890 67.638 1.00 0.00 H ATOM 34815 H2 WAT 6284 38.447 39.493 67.900 1.00 0.00 H TER 34817 WAT 6284 ATOM 34817 O WAT 6285 23.489 117.149 6.629 1.00 0.00 O ATOM 34818 H1 WAT 6285 23.014 116.668 7.306 1.00 0.00 H ATOM 34819 H2 WAT 6285 23.495 116.559 5.875 1.00 0.00 H TER 34821 WAT 6285 ATOM 34821 O WAT 6286 75.767 65.342 76.050 1.00 0.00 O ATOM 34822 H1 WAT 6286 76.044 66.249 75.925 1.00 0.00 H ATOM 34823 H2 WAT 6286 74.925 65.284 75.598 1.00 0.00 H TER 34825 WAT 6286 ATOM 34825 O WAT 6287 29.527 113.056 13.514 1.00 0.00 O ATOM 34826 H1 WAT 6287 29.085 113.309 12.704 1.00 0.00 H ATOM 34827 H2 WAT 6287 29.415 112.107 13.563 1.00 0.00 H TER 34829 WAT 6287 ATOM 34829 O WAT 6288 19.482 57.983 133.464 1.00 0.00 O ATOM 34830 H1 WAT 6288 19.165 57.599 132.647 1.00 0.00 H ATOM 34831 H2 WAT 6288 19.214 57.361 134.141 1.00 0.00 H TER 34833 WAT 6288 ATOM 34833 O WAT 6289 70.928 81.478 155.549 1.00 0.00 O ATOM 34834 H1 WAT 6289 70.450 82.126 156.065 1.00 0.00 H ATOM 34835 H2 WAT 6289 71.088 80.757 156.158 1.00 0.00 H TER 34837 WAT 6289 ATOM 34837 O WAT 6290 68.465 51.701 146.223 1.00 0.00 O ATOM 34838 H1 WAT 6290 68.146 50.946 146.718 1.00 0.00 H ATOM 34839 H2 WAT 6290 68.643 51.355 145.348 1.00 0.00 H TER 34841 WAT 6290 ATOM 34841 O WAT 6291 60.589 135.583 113.449 1.00 0.00 O ATOM 34842 H1 WAT 6291 61.059 134.756 113.555 1.00 0.00 H ATOM 34843 H2 WAT 6291 60.594 135.975 114.323 1.00 0.00 H TER 34845 WAT 6291 ATOM 34845 O WAT 6292 61.980 81.170 70.235 1.00 0.00 O ATOM 34846 H1 WAT 6292 61.441 80.816 70.942 1.00 0.00 H ATOM 34847 H2 WAT 6292 62.662 81.671 70.682 1.00 0.00 H TER 34849 WAT 6292 ATOM 34849 O WAT 6293 98.252 86.704 116.760 1.00 0.00 O ATOM 34850 H1 WAT 6293 98.868 86.580 117.482 1.00 0.00 H ATOM 34851 H2 WAT 6293 98.415 85.963 116.176 1.00 0.00 H TER 34853 WAT 6293 ATOM 34853 O WAT 6294 84.498 99.531 77.727 1.00 0.00 O ATOM 34854 H1 WAT 6294 84.534 100.380 78.168 1.00 0.00 H ATOM 34855 H2 WAT 6294 84.277 98.910 78.421 1.00 0.00 H TER 34857 WAT 6294 ATOM 34857 O WAT 6295 40.927 140.496 67.870 1.00 0.00 O ATOM 34858 H1 WAT 6295 40.424 140.010 68.523 1.00 0.00 H ATOM 34859 H2 WAT 6295 40.444 140.369 67.053 1.00 0.00 H TER 34861 WAT 6295 ATOM 34861 O WAT 6296 11.841 63.538 91.031 1.00 0.00 O ATOM 34862 H1 WAT 6296 11.836 62.768 90.463 1.00 0.00 H ATOM 34863 H2 WAT 6296 11.842 64.281 90.428 1.00 0.00 H TER 34865 WAT 6296 ATOM 34865 O WAT 6297 99.252 120.501 133.088 1.00 0.00 O ATOM 34866 H1 WAT 6297 98.943 119.595 133.054 1.00 0.00 H ATOM 34867 H2 WAT 6297 98.468 121.027 132.931 1.00 0.00 H TER 34869 WAT 6297 ATOM 34869 O WAT 6298 34.637 7.218 90.394 1.00 0.00 O ATOM 34870 H1 WAT 6298 33.934 7.609 90.913 1.00 0.00 H ATOM 34871 H2 WAT 6298 34.189 6.622 89.795 1.00 0.00 H TER 34873 WAT 6298 ATOM 34873 O WAT 6299 41.591 3.957 73.142 1.00 0.00 O ATOM 34874 H1 WAT 6299 41.736 4.866 73.404 1.00 0.00 H ATOM 34875 H2 WAT 6299 41.399 4.005 72.206 1.00 0.00 H TER 34877 WAT 6299 ATOM 34877 O WAT 6300 120.486 54.246 75.706 1.00 0.00 O ATOM 34878 H1 WAT 6300 120.454 55.024 76.262 1.00 0.00 H ATOM 34879 H2 WAT 6300 119.751 53.709 76.003 1.00 0.00 H TER 34881 WAT 6300 ATOM 34881 O WAT 6301 50.020 92.909 108.350 1.00 0.00 O ATOM 34882 H1 WAT 6301 49.960 93.055 109.294 1.00 0.00 H ATOM 34883 H2 WAT 6301 49.512 92.112 108.198 1.00 0.00 H TER 34885 WAT 6301 ATOM 34885 O WAT 6302 144.610 32.561 94.656 1.00 0.00 O ATOM 34886 H1 WAT 6302 144.147 32.470 95.489 1.00 0.00 H ATOM 34887 H2 WAT 6302 145.422 32.069 94.779 1.00 0.00 H TER 34889 WAT 6302 ATOM 34889 O WAT 6303 18.368 5.266 153.515 1.00 0.00 O ATOM 34890 H1 WAT 6303 19.070 4.985 152.929 1.00 0.00 H ATOM 34891 H2 WAT 6303 18.668 6.107 153.861 1.00 0.00 H TER 34893 WAT 6303 ATOM 34893 O WAT 6304 13.791 88.482 148.337 1.00 0.00 O ATOM 34894 H1 WAT 6304 13.024 87.956 148.564 1.00 0.00 H ATOM 34895 H2 WAT 6304 13.602 88.813 147.458 1.00 0.00 H TER 34897 WAT 6304 ATOM 34897 O WAT 6305 91.264 104.107 28.813 1.00 0.00 O ATOM 34898 H1 WAT 6305 92.028 104.540 29.194 1.00 0.00 H ATOM 34899 H2 WAT 6305 91.315 103.207 29.134 1.00 0.00 H TER 34901 WAT 6305 ATOM 34901 O WAT 6306 48.525 4.645 13.841 1.00 0.00 O ATOM 34902 H1 WAT 6306 49.154 4.162 14.377 1.00 0.00 H ATOM 34903 H2 WAT 6306 48.189 5.327 14.422 1.00 0.00 H TER 34905 WAT 6306 ATOM 34905 O WAT 6307 137.152 55.565 90.679 1.00 0.00 O ATOM 34906 H1 WAT 6307 136.658 54.864 90.254 1.00 0.00 H ATOM 34907 H2 WAT 6307 138.048 55.231 90.728 1.00 0.00 H TER 34909 WAT 6307 ATOM 34909 O WAT 6308 57.952 77.362 70.222 1.00 0.00 O ATOM 34910 H1 WAT 6308 58.117 76.463 70.505 1.00 0.00 H ATOM 34911 H2 WAT 6308 57.000 77.455 70.260 1.00 0.00 H TER 34913 WAT 6308 ATOM 34913 O WAT 6309 78.784 141.446 82.344 1.00 0.00 O ATOM 34914 H1 WAT 6309 78.493 141.029 83.155 1.00 0.00 H ATOM 34915 H2 WAT 6309 79.160 142.280 82.625 1.00 0.00 H TER 34917 WAT 6309 ATOM 34917 O WAT 6310 15.796 29.191 77.891 1.00 0.00 O ATOM 34918 H1 WAT 6310 15.374 28.342 77.755 1.00 0.00 H ATOM 34919 H2 WAT 6310 16.732 29.008 77.815 1.00 0.00 H TER 34921 WAT 6310 ATOM 34921 O WAT 6311 28.160 8.371 57.726 1.00 0.00 O ATOM 34922 H1 WAT 6311 29.010 8.500 58.147 1.00 0.00 H ATOM 34923 H2 WAT 6311 27.890 9.249 57.457 1.00 0.00 H TER 34925 WAT 6311 ATOM 34925 O WAT 6312 69.976 81.907 85.479 1.00 0.00 O ATOM 34926 H1 WAT 6312 69.830 82.666 86.043 1.00 0.00 H ATOM 34927 H2 WAT 6312 69.186 81.851 84.943 1.00 0.00 H TER 34929 WAT 6312 ATOM 34929 O WAT 6313 20.583 12.669 83.588 1.00 0.00 O ATOM 34930 H1 WAT 6313 21.025 11.829 83.463 1.00 0.00 H ATOM 34931 H2 WAT 6313 21.277 13.322 83.490 1.00 0.00 H TER 34933 WAT 6313 ATOM 34933 O WAT 6314 40.778 141.539 110.515 1.00 0.00 O ATOM 34934 H1 WAT 6314 41.422 140.867 110.739 1.00 0.00 H ATOM 34935 H2 WAT 6314 40.414 141.812 111.357 1.00 0.00 H TER 34937 WAT 6314 ATOM 34937 O WAT 6315 27.079 7.382 11.571 1.00 0.00 O ATOM 34938 H1 WAT 6315 26.986 7.808 12.423 1.00 0.00 H ATOM 34939 H2 WAT 6315 26.464 7.846 11.003 1.00 0.00 H TER 34941 WAT 6315 ATOM 34941 O WAT 6316 49.183 61.444 12.572 1.00 0.00 O ATOM 34942 H1 WAT 6316 49.366 60.711 13.159 1.00 0.00 H ATOM 34943 H2 WAT 6316 49.646 62.185 12.963 1.00 0.00 H TER 34945 WAT 6316 ATOM 34945 O WAT 6317 103.061 30.462 91.190 1.00 0.00 O ATOM 34946 H1 WAT 6317 103.932 30.637 91.546 1.00 0.00 H ATOM 34947 H2 WAT 6317 103.209 30.313 90.256 1.00 0.00 H TER 34949 WAT 6317 ATOM 34949 O WAT 6318 52.261 15.919 17.420 1.00 0.00 O ATOM 34950 H1 WAT 6318 51.793 15.461 18.118 1.00 0.00 H ATOM 34951 H2 WAT 6318 53.158 15.995 17.743 1.00 0.00 H TER 34953 WAT 6318 ATOM 34953 O WAT 6319 120.966 88.296 14.456 1.00 0.00 O ATOM 34954 H1 WAT 6319 121.784 88.431 14.934 1.00 0.00 H ATOM 34955 H2 WAT 6319 121.060 87.430 14.059 1.00 0.00 H TER 34957 WAT 6319 ATOM 34957 O WAT 6320 143.962 139.657 23.319 1.00 0.00 O ATOM 34958 H1 WAT 6320 143.609 140.368 23.853 1.00 0.00 H ATOM 34959 H2 WAT 6320 143.273 138.992 23.319 1.00 0.00 H TER 34961 WAT 6320 ATOM 34961 O WAT 6321 88.061 144.146 144.279 1.00 0.00 O ATOM 34962 H1 WAT 6321 88.730 143.781 144.858 1.00 0.00 H ATOM 34963 H2 WAT 6321 87.274 143.636 144.471 1.00 0.00 H TER 34965 WAT 6321 ATOM 34965 O WAT 6322 58.845 83.818 89.370 1.00 0.00 O ATOM 34966 H1 WAT 6322 58.154 84.112 88.776 1.00 0.00 H ATOM 34967 H2 WAT 6322 58.764 82.864 89.376 1.00 0.00 H TER 34969 WAT 6322 ATOM 34969 O WAT 6323 4.266 66.653 76.557 1.00 0.00 O ATOM 34970 H1 WAT 6323 4.999 66.761 77.163 1.00 0.00 H ATOM 34971 H2 WAT 6323 4.235 67.476 76.070 1.00 0.00 H TER 34973 WAT 6323 ATOM 34973 O WAT 6324 59.956 138.650 11.020 1.00 0.00 O ATOM 34974 H1 WAT 6324 60.365 137.843 11.333 1.00 0.00 H ATOM 34975 H2 WAT 6324 59.262 138.355 10.431 1.00 0.00 H TER 34977 WAT 6324 ATOM 34977 O WAT 6325 117.786 67.901 84.742 1.00 0.00 O ATOM 34978 H1 WAT 6325 118.414 67.652 85.419 1.00 0.00 H ATOM 34979 H2 WAT 6325 118.278 68.479 84.159 1.00 0.00 H TER 34981 WAT 6325 ATOM 34981 O WAT 6326 7.547 87.633 123.486 1.00 0.00 O ATOM 34982 H1 WAT 6326 8.103 87.223 122.823 1.00 0.00 H ATOM 34983 H2 WAT 6326 8.012 87.490 124.310 1.00 0.00 H TER 34985 WAT 6326 ATOM 34985 O WAT 6327 128.452 103.107 132.153 1.00 0.00 O ATOM 34986 H1 WAT 6327 129.172 102.755 132.676 1.00 0.00 H ATOM 34987 H2 WAT 6327 128.386 102.512 131.406 1.00 0.00 H TER 34989 WAT 6327 ATOM 34989 O WAT 6328 145.567 6.371 -0.232 1.00 0.00 O ATOM 34990 H1 WAT 6328 146.202 5.728 0.084 1.00 0.00 H ATOM 34991 H2 WAT 6328 145.514 7.019 0.471 1.00 0.00 H TER 34993 WAT 6328 ATOM 34993 O WAT 6329 101.788 63.519 152.903 1.00 0.00 O ATOM 34994 H1 WAT 6329 101.866 63.712 151.969 1.00 0.00 H ATOM 34995 H2 WAT 6329 101.588 62.583 152.938 1.00 0.00 H TER 34997 WAT 6329 ATOM 34997 O WAT 6330 31.116 72.835 133.556 1.00 0.00 O ATOM 34998 H1 WAT 6330 31.895 72.289 133.663 1.00 0.00 H ATOM 34999 H2 WAT 6330 31.245 73.560 134.168 1.00 0.00 H TER 35001 WAT 6330 ATOM 35001 O WAT 6331 27.555 10.604 157.599 1.00 0.00 O ATOM 35002 H1 WAT 6331 28.432 10.328 157.863 1.00 0.00 H ATOM 35003 H2 WAT 6331 27.005 10.417 158.360 1.00 0.00 H TER 35005 WAT 6331 ATOM 35005 O WAT 6332 32.436 77.100 106.483 1.00 0.00 O ATOM 35006 H1 WAT 6332 32.234 76.555 105.723 1.00 0.00 H ATOM 35007 H2 WAT 6332 31.823 77.833 106.423 1.00 0.00 H TER 35009 WAT 6332 ATOM 35009 O WAT 6333 35.551 100.194 153.992 1.00 0.00 O ATOM 35010 H1 WAT 6333 36.243 100.706 153.573 1.00 0.00 H ATOM 35011 H2 WAT 6333 34.830 100.205 153.363 1.00 0.00 H TER 35013 WAT 6333 ATOM 35013 O WAT 6334 145.780 47.917 117.674 1.00 0.00 O ATOM 35014 H1 WAT 6334 145.438 48.606 118.243 1.00 0.00 H ATOM 35015 H2 WAT 6334 145.204 47.169 117.830 1.00 0.00 H TER 35017 WAT 6334 ATOM 35017 O WAT 6335 33.012 99.786 23.818 1.00 0.00 O ATOM 35018 H1 WAT 6335 32.352 99.301 24.313 1.00 0.00 H ATOM 35019 H2 WAT 6335 33.717 99.942 24.447 1.00 0.00 H TER 35021 WAT 6335 ATOM 35021 O WAT 6336 76.046 28.633 0.128 1.00 0.00 O ATOM 35022 H1 WAT 6336 76.753 28.013 0.312 1.00 0.00 H ATOM 35023 H2 WAT 6336 75.840 29.020 0.979 1.00 0.00 H TER 35025 WAT 6336 ATOM 35025 O WAT 6337 13.082 124.136 102.201 1.00 0.00 O ATOM 35026 H1 WAT 6337 13.482 123.999 103.060 1.00 0.00 H ATOM 35027 H2 WAT 6337 13.803 124.432 101.646 1.00 0.00 H TER 35029 WAT 6337 ATOM 35029 O WAT 6338 32.264 3.755 155.938 1.00 0.00 O ATOM 35030 H1 WAT 6338 32.475 3.594 155.018 1.00 0.00 H ATOM 35031 H2 WAT 6338 32.633 4.620 156.120 1.00 0.00 H TER 35033 WAT 6338 ATOM 35033 O WAT 6339 29.019 141.553 108.322 1.00 0.00 O ATOM 35034 H1 WAT 6339 29.298 140.743 108.750 1.00 0.00 H ATOM 35035 H2 WAT 6339 28.068 141.563 108.424 1.00 0.00 H TER 35037 WAT 6339 ATOM 35037 O WAT 6340 115.670 16.585 109.669 1.00 0.00 O ATOM 35038 H1 WAT 6340 116.480 17.049 109.877 1.00 0.00 H ATOM 35039 H2 WAT 6340 115.959 15.757 109.286 1.00 0.00 H TER 35041 WAT 6340 ATOM 35041 O WAT 6341 16.666 82.423 62.279 1.00 0.00 O ATOM 35042 H1 WAT 6341 17.282 83.037 61.881 1.00 0.00 H ATOM 35043 H2 WAT 6341 16.046 82.978 62.752 1.00 0.00 H TER 35045 WAT 6341 ATOM 35045 O WAT 6342 107.660 91.372 21.505 1.00 0.00 O ATOM 35046 H1 WAT 6342 107.121 91.117 22.253 1.00 0.00 H ATOM 35047 H2 WAT 6342 107.983 92.244 21.728 1.00 0.00 H TER 35049 WAT 6342 ATOM 35049 O WAT 6343 105.114 34.095 71.252 1.00 0.00 O ATOM 35050 H1 WAT 6343 104.785 34.056 70.354 1.00 0.00 H ATOM 35051 H2 WAT 6343 105.494 34.970 71.330 1.00 0.00 H TER 35053 WAT 6343 ATOM 35053 O WAT 6344 47.666 10.084 118.400 1.00 0.00 O ATOM 35054 H1 WAT 6344 46.761 10.372 118.282 1.00 0.00 H ATOM 35055 H2 WAT 6344 47.597 9.284 118.920 1.00 0.00 H TER 35057 WAT 6344 ATOM 35057 O WAT 6345 64.759 68.068 113.865 1.00 0.00 O ATOM 35058 H1 WAT 6345 63.957 68.339 114.312 1.00 0.00 H ATOM 35059 H2 WAT 6345 65.421 68.041 114.557 1.00 0.00 H TER 35061 WAT 6345 ATOM 35061 O WAT 6346 129.114 59.440 59.258 1.00 0.00 O ATOM 35062 H1 WAT 6346 130.032 59.491 58.992 1.00 0.00 H ATOM 35063 H2 WAT 6346 129.126 59.628 60.197 1.00 0.00 H TER 35065 WAT 6346 ATOM 35065 O WAT 6347 22.493 61.450 138.224 1.00 0.00 O ATOM 35066 H1 WAT 6347 21.679 61.915 138.033 1.00 0.00 H ATOM 35067 H2 WAT 6347 22.421 61.210 139.148 1.00 0.00 H TER 35069 WAT 6347 ATOM 35069 O WAT 6348 83.964 25.999 141.955 1.00 0.00 O ATOM 35070 H1 WAT 6348 83.119 26.255 141.587 1.00 0.00 H ATOM 35071 H2 WAT 6348 84.505 26.786 141.886 1.00 0.00 H TER 35073 WAT 6348 ATOM 35073 O WAT 6349 51.115 22.403 154.194 1.00 0.00 O ATOM 35074 H1 WAT 6349 51.453 21.534 153.979 1.00 0.00 H ATOM 35075 H2 WAT 6349 51.587 22.654 154.988 1.00 0.00 H TER 35077 WAT 6349 ATOM 35077 O WAT 6350 15.612 87.545 75.253 1.00 0.00 O ATOM 35078 H1 WAT 6350 15.240 87.050 74.524 1.00 0.00 H ATOM 35079 H2 WAT 6350 16.366 87.998 74.875 1.00 0.00 H TER 35081 WAT 6350 ATOM 35081 O WAT 6351 24.795 48.774 88.779 1.00 0.00 O ATOM 35082 H1 WAT 6351 24.783 49.457 89.450 1.00 0.00 H ATOM 35083 H2 WAT 6351 25.271 49.167 88.048 1.00 0.00 H TER 35085 WAT 6351 ATOM 35085 O WAT 6352 136.512 37.805 145.568 1.00 0.00 O ATOM 35086 H1 WAT 6352 136.062 38.645 145.476 1.00 0.00 H ATOM 35087 H2 WAT 6352 135.875 37.158 145.264 1.00 0.00 H TER 35089 WAT 6352 ATOM 35089 O WAT 6353 6.008 7.037 11.135 1.00 0.00 O ATOM 35090 H1 WAT 6353 5.103 7.168 10.853 1.00 0.00 H ATOM 35091 H2 WAT 6353 6.531 7.223 10.355 1.00 0.00 H TER 35093 WAT 6353 ATOM 35093 O WAT 6354 127.202 112.649 72.730 1.00 0.00 O ATOM 35094 H1 WAT 6354 126.321 112.276 72.716 1.00 0.00 H ATOM 35095 H2 WAT 6354 127.652 112.231 71.997 1.00 0.00 H TER 35097 WAT 6354 ATOM 35097 O WAT 6355 49.442 30.765 16.628 1.00 0.00 O ATOM 35098 H1 WAT 6355 50.290 31.029 16.269 1.00 0.00 H ATOM 35099 H2 WAT 6355 49.449 31.096 17.526 1.00 0.00 H TER 35101 WAT 6355 ATOM 35101 O WAT 6356 42.537 27.530 141.643 1.00 0.00 O ATOM 35102 H1 WAT 6356 42.950 27.234 140.832 1.00 0.00 H ATOM 35103 H2 WAT 6356 41.628 27.236 141.570 1.00 0.00 H TER 35105 WAT 6356 ATOM 35105 O WAT 6357 26.027 10.426 1.289 1.00 0.00 O ATOM 35106 H1 WAT 6357 25.075 10.390 1.385 1.00 0.00 H ATOM 35107 H2 WAT 6357 26.332 9.577 1.611 1.00 0.00 H TER 35109 WAT 6357 ATOM 35109 O WAT 6358 10.886 91.454 6.467 1.00 0.00 O ATOM 35110 H1 WAT 6358 10.281 90.743 6.678 1.00 0.00 H ATOM 35111 H2 WAT 6358 11.687 91.236 6.944 1.00 0.00 H TER 35113 WAT 6358 ATOM 35113 O WAT 6359 76.192 86.290 108.712 1.00 0.00 O ATOM 35114 H1 WAT 6359 76.412 87.097 109.177 1.00 0.00 H ATOM 35115 H2 WAT 6359 76.882 86.197 108.055 1.00 0.00 H TER 35117 WAT 6359 ATOM 35117 O WAT 6360 18.274 131.745 86.660 1.00 0.00 O ATOM 35118 H1 WAT 6360 17.799 132.243 87.325 1.00 0.00 H ATOM 35119 H2 WAT 6360 19.185 132.021 86.759 1.00 0.00 H TER 35121 WAT 6360 ATOM 35121 O WAT 6361 114.242 49.761 72.146 1.00 0.00 O ATOM 35122 H1 WAT 6361 114.477 48.833 72.138 1.00 0.00 H ATOM 35123 H2 WAT 6361 113.286 49.767 72.091 1.00 0.00 H TER 35125 WAT 6361 ATOM 35125 O WAT 6362 118.575 60.206 5.796 1.00 0.00 O ATOM 35126 H1 WAT 6362 118.566 61.069 5.382 1.00 0.00 H ATOM 35127 H2 WAT 6362 119.469 60.106 6.123 1.00 0.00 H TER 35129 WAT 6362 ATOM 35129 O WAT 6363 66.212 140.037 136.333 1.00 0.00 O ATOM 35130 H1 WAT 6363 66.575 140.112 135.450 1.00 0.00 H ATOM 35131 H2 WAT 6363 66.010 140.938 136.586 1.00 0.00 H TER 35133 WAT 6363 ATOM 35133 O WAT 6364 74.962 136.545 158.502 1.00 0.00 O ATOM 35134 H1 WAT 6364 75.343 137.386 158.754 1.00 0.00 H ATOM 35135 H2 WAT 6364 74.636 136.687 157.613 1.00 0.00 H TER 35137 WAT 6364 ATOM 35137 O WAT 6365 125.197 13.243 78.077 1.00 0.00 O ATOM 35138 H1 WAT 6365 124.951 12.780 78.878 1.00 0.00 H ATOM 35139 H2 WAT 6365 124.597 13.988 78.037 1.00 0.00 H TER 35141 WAT 6365 ATOM 35141 O WAT 6366 44.192 97.069 65.885 1.00 0.00 O ATOM 35142 H1 WAT 6366 44.167 97.999 65.660 1.00 0.00 H ATOM 35143 H2 WAT 6366 43.370 96.718 65.541 1.00 0.00 H TER 35145 WAT 6366 ATOM 35145 O WAT 6367 14.497 138.210 21.935 1.00 0.00 O ATOM 35146 H1 WAT 6367 13.860 138.885 21.701 1.00 0.00 H ATOM 35147 H2 WAT 6367 14.096 137.391 21.644 1.00 0.00 H TER 35149 WAT 6367 ATOM 35149 O WAT 6368 15.140 117.638 119.588 1.00 0.00 O ATOM 35150 H1 WAT 6368 14.740 117.744 120.451 1.00 0.00 H ATOM 35151 H2 WAT 6368 15.499 116.750 119.598 1.00 0.00 H TER 35153 WAT 6368 ATOM 35153 O WAT 6369 82.930 123.032 123.434 1.00 0.00 O ATOM 35154 H1 WAT 6369 83.495 122.280 123.614 1.00 0.00 H ATOM 35155 H2 WAT 6369 82.056 122.743 123.697 1.00 0.00 H TER 35157 WAT 6369 ATOM 35157 O WAT 6370 144.267 56.342 148.675 1.00 0.00 O ATOM 35158 H1 WAT 6370 144.278 57.297 148.612 1.00 0.00 H ATOM 35159 H2 WAT 6370 144.730 56.151 149.491 1.00 0.00 H TER 35161 WAT 6370 ATOM 35161 O WAT 6371 16.913 119.908 97.652 1.00 0.00 O ATOM 35162 H1 WAT 6371 17.576 119.515 98.221 1.00 0.00 H ATOM 35163 H2 WAT 6371 16.584 120.656 98.150 1.00 0.00 H TER 35165 WAT 6371 ATOM 35165 O WAT 6372 99.467 35.950 55.023 1.00 0.00 O ATOM 35166 H1 WAT 6372 98.833 35.873 54.310 1.00 0.00 H ATOM 35167 H2 WAT 6372 99.943 36.758 54.834 1.00 0.00 H TER 35169 WAT 6372 ATOM 35169 O WAT 6373 114.496 112.293 0.275 1.00 0.00 O ATOM 35170 H1 WAT 6373 113.856 111.716 -0.142 1.00 0.00 H ATOM 35171 H2 WAT 6373 114.563 111.967 1.173 1.00 0.00 H TER 35173 WAT 6373 ATOM 35173 O WAT 6374 83.363 122.613 109.482 1.00 0.00 O ATOM 35174 H1 WAT 6374 84.290 122.730 109.690 1.00 0.00 H ATOM 35175 H2 WAT 6374 83.356 121.981 108.764 1.00 0.00 H TER 35177 WAT 6374 ATOM 35177 O WAT 6375 33.203 2.853 88.035 1.00 0.00 O ATOM 35178 H1 WAT 6375 33.086 3.696 88.473 1.00 0.00 H ATOM 35179 H2 WAT 6375 33.313 3.077 87.111 1.00 0.00 H TER 35181 WAT 6375 ATOM 35181 O WAT 6376 116.318 64.474 119.837 1.00 0.00 O ATOM 35182 H1 WAT 6376 117.043 64.702 120.419 1.00 0.00 H ATOM 35183 H2 WAT 6376 116.065 63.590 120.105 1.00 0.00 H TER 35185 WAT 6376 ATOM 35185 O WAT 6377 59.165 133.907 11.504 1.00 0.00 O ATOM 35186 H1 WAT 6377 58.275 133.561 11.437 1.00 0.00 H ATOM 35187 H2 WAT 6377 59.449 133.670 12.386 1.00 0.00 H TER 35189 WAT 6377 ATOM 35189 O WAT 6378 135.772 125.018 3.145 1.00 0.00 O ATOM 35190 H1 WAT 6378 135.063 125.278 3.734 1.00 0.00 H ATOM 35191 H2 WAT 6378 135.327 124.641 2.386 1.00 0.00 H TER 35193 WAT 6378 ATOM 35193 O WAT 6379 44.484 30.773 69.031 1.00 0.00 O ATOM 35194 H1 WAT 6379 43.697 31.242 69.306 1.00 0.00 H ATOM 35195 H2 WAT 6379 44.884 31.341 68.373 1.00 0.00 H TER 35197 WAT 6379 ATOM 35197 O WAT 6380 72.239 65.687 140.793 1.00 0.00 O ATOM 35198 H1 WAT 6380 72.425 65.787 139.859 1.00 0.00 H ATOM 35199 H2 WAT 6380 71.693 64.903 140.846 1.00 0.00 H TER 35201 WAT 6380 ATOM 35201 O WAT 6381 7.698 16.698 123.723 1.00 0.00 O ATOM 35202 H1 WAT 6381 8.508 16.556 123.234 1.00 0.00 H ATOM 35203 H2 WAT 6381 7.062 16.117 123.306 1.00 0.00 H TER 35205 WAT 6381 ATOM 35205 O WAT 6382 137.192 138.020 60.148 1.00 0.00 O ATOM 35206 H1 WAT 6382 137.765 137.686 60.838 1.00 0.00 H ATOM 35207 H2 WAT 6382 136.756 137.242 59.801 1.00 0.00 H TER 35209 WAT 6382 ATOM 35209 O WAT 6383 36.805 0.726 117.075 1.00 0.00 O ATOM 35210 H1 WAT 6383 36.953 1.611 117.409 1.00 0.00 H ATOM 35211 H2 WAT 6383 37.408 0.645 116.336 1.00 0.00 H TER 35213 WAT 6383 ATOM 35213 O WAT 6384 62.596 3.685 102.734 1.00 0.00 O ATOM 35214 H1 WAT 6384 63.455 4.061 102.542 1.00 0.00 H ATOM 35215 H2 WAT 6384 62.098 4.409 103.114 1.00 0.00 H TER 35217 WAT 6384 ATOM 35217 O WAT 6385 20.070 22.196 14.352 1.00 0.00 O ATOM 35218 H1 WAT 6385 19.712 22.456 15.200 1.00 0.00 H ATOM 35219 H2 WAT 6385 20.759 21.566 14.566 1.00 0.00 H TER 35221 WAT 6385 ATOM 35221 O WAT 6386 44.349 113.365 7.019 1.00 0.00 O ATOM 35222 H1 WAT 6386 44.153 113.579 7.931 1.00 0.00 H ATOM 35223 H2 WAT 6386 43.896 114.038 6.511 1.00 0.00 H TER 35225 WAT 6386 ATOM 35225 O WAT 6387 23.746 139.043 146.824 1.00 0.00 O ATOM 35226 H1 WAT 6387 23.860 139.136 147.770 1.00 0.00 H ATOM 35227 H2 WAT 6387 23.435 139.901 146.534 1.00 0.00 H TER 35229 WAT 6387 ATOM 35229 O WAT 6388 92.645 82.685 15.974 1.00 0.00 O ATOM 35230 H1 WAT 6388 91.955 82.022 15.944 1.00 0.00 H ATOM 35231 H2 WAT 6388 92.274 83.393 16.500 1.00 0.00 H TER 35233 WAT 6388 ATOM 35233 O WAT 6389 66.594 90.626 58.068 1.00 0.00 O ATOM 35234 H1 WAT 6389 66.084 89.816 58.077 1.00 0.00 H ATOM 35235 H2 WAT 6389 66.146 91.199 58.691 1.00 0.00 H TER 35237 WAT 6389 ATOM 35237 O WAT 6390 105.991 58.505 16.305 1.00 0.00 O ATOM 35238 H1 WAT 6390 105.762 59.082 17.034 1.00 0.00 H ATOM 35239 H2 WAT 6390 106.831 58.121 16.558 1.00 0.00 H TER 35241 WAT 6390 ATOM 35241 O WAT 6391 111.901 145.427 145.152 1.00 0.00 O ATOM 35242 H1 WAT 6391 111.650 146.336 144.985 1.00 0.00 H ATOM 35243 H2 WAT 6391 112.298 145.444 146.023 1.00 0.00 H TER 35245 WAT 6391 ATOM 35245 O WAT 6392 81.359 49.083 68.430 1.00 0.00 O ATOM 35246 H1 WAT 6392 82.221 48.705 68.258 1.00 0.00 H ATOM 35247 H2 WAT 6392 81.286 49.807 67.808 1.00 0.00 H TER 35249 WAT 6392 ATOM 35249 O WAT 6393 109.535 127.677 87.872 1.00 0.00 O ATOM 35250 H1 WAT 6393 108.867 127.174 87.406 1.00 0.00 H ATOM 35251 H2 WAT 6393 109.250 127.667 88.786 1.00 0.00 H TER 35253 WAT 6393 ATOM 35253 O WAT 6394 33.658 104.921 8.051 1.00 0.00 O ATOM 35254 H1 WAT 6394 32.725 104.933 8.268 1.00 0.00 H ATOM 35255 H2 WAT 6394 33.998 105.740 8.411 1.00 0.00 H TER 35257 WAT 6394 ATOM 35257 O WAT 6395 37.955 69.991 128.988 1.00 0.00 O ATOM 35258 H1 WAT 6395 38.307 69.711 129.833 1.00 0.00 H ATOM 35259 H2 WAT 6395 37.353 70.704 129.203 1.00 0.00 H TER 35261 WAT 6395 ATOM 35261 O WAT 6396 43.204 41.130 95.668 1.00 0.00 O ATOM 35262 H1 WAT 6396 44.086 40.798 95.501 1.00 0.00 H ATOM 35263 H2 WAT 6396 42.632 40.560 95.153 1.00 0.00 H TER 35265 WAT 6396 ATOM 35265 O WAT 6397 76.951 23.930 117.899 1.00 0.00 O ATOM 35266 H1 WAT 6397 76.820 23.967 118.847 1.00 0.00 H ATOM 35267 H2 WAT 6397 76.103 24.176 117.531 1.00 0.00 H TER 35269 WAT 6397 ATOM 35269 O WAT 6398 74.872 128.365 4.227 1.00 0.00 O ATOM 35270 H1 WAT 6398 75.605 128.355 3.612 1.00 0.00 H ATOM 35271 H2 WAT 6398 74.188 128.860 3.777 1.00 0.00 H TER 35273 WAT 6398 ATOM 35273 O WAT 6399 122.640 120.263 151.262 1.00 0.00 O ATOM 35274 H1 WAT 6399 122.532 121.186 151.031 1.00 0.00 H ATOM 35275 H2 WAT 6399 122.067 120.137 152.018 1.00 0.00 H TER 35277 WAT 6399 ATOM 35277 O WAT 6400 42.928 90.546 6.522 1.00 0.00 O ATOM 35278 H1 WAT 6400 42.454 91.035 7.195 1.00 0.00 H ATOM 35279 H2 WAT 6400 43.036 91.169 5.804 1.00 0.00 H TER 35281 WAT 6400 ATOM 35281 O WAT 6401 26.397 125.839 153.028 1.00 0.00 O ATOM 35282 H1 WAT 6401 25.666 125.261 152.812 1.00 0.00 H ATOM 35283 H2 WAT 6401 26.543 126.350 152.232 1.00 0.00 H TER 35285 WAT 6401 ATOM 35285 O WAT 6402 74.315 55.954 94.966 1.00 0.00 O ATOM 35286 H1 WAT 6402 73.960 55.704 95.820 1.00 0.00 H ATOM 35287 H2 WAT 6402 74.576 55.125 94.565 1.00 0.00 H TER 35289 WAT 6402 ATOM 35289 O WAT 6403 118.906 59.012 142.606 1.00 0.00 O ATOM 35290 H1 WAT 6403 118.463 59.073 143.453 1.00 0.00 H ATOM 35291 H2 WAT 6403 118.347 59.508 142.008 1.00 0.00 H TER 35293 WAT 6403 ATOM 35293 O WAT 6404 41.140 115.855 146.309 1.00 0.00 O ATOM 35294 H1 WAT 6404 42.094 115.876 146.229 1.00 0.00 H ATOM 35295 H2 WAT 6404 40.906 114.943 146.140 1.00 0.00 H TER 35297 WAT 6404 ATOM 35297 O WAT 6405 23.749 83.955 87.039 1.00 0.00 O ATOM 35298 H1 WAT 6405 23.804 84.879 86.798 1.00 0.00 H ATOM 35299 H2 WAT 6405 22.816 83.801 87.189 1.00 0.00 H TER 35301 WAT 6405 ATOM 35301 O WAT 6406 70.787 77.560 118.274 1.00 0.00 O ATOM 35302 H1 WAT 6406 70.386 77.903 119.073 1.00 0.00 H ATOM 35303 H2 WAT 6406 70.077 77.558 117.632 1.00 0.00 H TER 35305 WAT 6406 ATOM 35305 O WAT 6407 64.024 40.940 143.437 1.00 0.00 O ATOM 35306 H1 WAT 6407 64.929 40.745 143.679 1.00 0.00 H ATOM 35307 H2 WAT 6407 63.588 41.121 144.270 1.00 0.00 H TER 35309 WAT 6407 ATOM 35309 O WAT 6408 17.441 75.265 157.151 1.00 0.00 O ATOM 35310 H1 WAT 6408 18.230 75.174 156.616 1.00 0.00 H ATOM 35311 H2 WAT 6408 17.142 74.367 157.292 1.00 0.00 H TER 35313 WAT 6408 ATOM 35313 O WAT 6409 141.029 9.100 92.179 1.00 0.00 O ATOM 35314 H1 WAT 6409 140.687 9.989 92.279 1.00 0.00 H ATOM 35315 H2 WAT 6409 140.461 8.697 91.523 1.00 0.00 H TER 35317 WAT 6409 ATOM 35317 O WAT 6410 46.228 10.915 11.844 1.00 0.00 O ATOM 35318 H1 WAT 6410 46.552 10.268 11.218 1.00 0.00 H ATOM 35319 H2 WAT 6410 46.959 11.521 11.964 1.00 0.00 H TER 35321 WAT 6410 ATOM 35321 O WAT 6411 111.293 4.752 64.560 1.00 0.00 O ATOM 35322 H1 WAT 6411 111.814 5.145 63.859 1.00 0.00 H ATOM 35323 H2 WAT 6411 111.863 4.080 64.934 1.00 0.00 H TER 35325 WAT 6411 ATOM 35325 O WAT 6412 37.802 96.898 142.696 1.00 0.00 O ATOM 35326 H1 WAT 6412 37.642 97.704 143.187 1.00 0.00 H ATOM 35327 H2 WAT 6412 38.189 97.192 141.872 1.00 0.00 H TER 35329 WAT 6412 ATOM 35329 O WAT 6413 24.187 34.320 140.110 1.00 0.00 O ATOM 35330 H1 WAT 6413 23.739 34.375 140.954 1.00 0.00 H ATOM 35331 H2 WAT 6413 24.621 33.468 140.125 1.00 0.00 H TER 35333 WAT 6413 ATOM 35333 O WAT 6414 68.454 35.201 16.515 1.00 0.00 O ATOM 35334 H1 WAT 6414 69.124 34.981 17.162 1.00 0.00 H ATOM 35335 H2 WAT 6414 68.836 34.943 15.676 1.00 0.00 H TER 35337 WAT 6414 ATOM 35337 O WAT 6415 0.174 48.994 156.898 1.00 0.00 O ATOM 35338 H1 WAT 6415 0.213 49.950 156.883 1.00 0.00 H ATOM 35339 H2 WAT 6415 0.328 48.762 157.814 1.00 0.00 H TER 35341 WAT 6415 ATOM 35341 O WAT 6416 110.742 110.199 103.607 1.00 0.00 O ATOM 35342 H1 WAT 6416 110.758 109.585 102.873 1.00 0.00 H ATOM 35343 H2 WAT 6416 110.047 110.818 103.387 1.00 0.00 H TER 35345 WAT 6416 ATOM 35345 O WAT 6417 76.689 17.660 92.751 1.00 0.00 O ATOM 35346 H1 WAT 6417 76.355 17.788 91.863 1.00 0.00 H ATOM 35347 H2 WAT 6417 76.914 16.731 92.791 1.00 0.00 H TER 35349 WAT 6417 ATOM 35349 O WAT 6418 124.070 96.737 3.563 1.00 0.00 O ATOM 35350 H1 WAT 6418 123.608 96.231 4.233 1.00 0.00 H ATOM 35351 H2 WAT 6418 123.465 97.443 3.337 1.00 0.00 H TER 35353 WAT 6418 ATOM 35353 O WAT 6419 21.494 10.960 153.748 1.00 0.00 O ATOM 35354 H1 WAT 6419 21.904 11.631 154.295 1.00 0.00 H ATOM 35355 H2 WAT 6419 22.010 10.170 153.910 1.00 0.00 H TER 35357 WAT 6419 ATOM 35357 O WAT 6420 113.833 69.946 136.180 1.00 0.00 O ATOM 35358 H1 WAT 6420 114.324 70.749 136.354 1.00 0.00 H ATOM 35359 H2 WAT 6420 114.233 69.588 135.388 1.00 0.00 H TER 35361 WAT 6420 ATOM 35361 O WAT 6421 109.718 43.877 121.090 1.00 0.00 O ATOM 35362 H1 WAT 6421 109.411 43.370 121.841 1.00 0.00 H ATOM 35363 H2 WAT 6421 110.362 43.310 120.666 1.00 0.00 H TER 35365 WAT 6421 ATOM 35365 O WAT 6422 53.793 55.453 3.721 1.00 0.00 O ATOM 35366 H1 WAT 6422 54.012 56.004 4.472 1.00 0.00 H ATOM 35367 H2 WAT 6422 54.433 54.742 3.751 1.00 0.00 H TER 35369 WAT 6422 ATOM 35369 O WAT 6423 87.831 124.157 145.742 1.00 0.00 O ATOM 35370 H1 WAT 6423 87.577 123.907 146.631 1.00 0.00 H ATOM 35371 H2 WAT 6423 88.229 125.022 145.841 1.00 0.00 H TER 35373 WAT 6423 ATOM 35373 O WAT 6424 140.369 143.228 86.068 1.00 0.00 O ATOM 35374 H1 WAT 6424 140.940 142.628 86.549 1.00 0.00 H ATOM 35375 H2 WAT 6424 140.924 143.985 85.878 1.00 0.00 H TER 35377 WAT 6424 ATOM 35377 O WAT 6425 6.333 82.836 144.841 1.00 0.00 O ATOM 35378 H1 WAT 6425 5.890 82.907 145.687 1.00 0.00 H ATOM 35379 H2 WAT 6425 6.960 83.559 144.838 1.00 0.00 H TER 35381 WAT 6425 ATOM 35381 O WAT 6426 144.550 55.884 132.469 1.00 0.00 O ATOM 35382 H1 WAT 6426 143.626 55.675 132.331 1.00 0.00 H ATOM 35383 H2 WAT 6426 144.660 56.753 132.082 1.00 0.00 H TER 35385 WAT 6426 ATOM 35385 O WAT 6427 82.071 138.268 102.705 1.00 0.00 O ATOM 35386 H1 WAT 6427 81.431 138.974 102.798 1.00 0.00 H ATOM 35387 H2 WAT 6427 82.590 138.307 103.508 1.00 0.00 H TER 35389 WAT 6427 ATOM 35389 O WAT 6428 127.655 145.255 74.039 1.00 0.00 O ATOM 35390 H1 WAT 6428 127.243 145.764 74.738 1.00 0.00 H ATOM 35391 H2 WAT 6428 127.383 144.353 74.207 1.00 0.00 H TER 35393 WAT 6428 ATOM 35393 O WAT 6429 42.010 59.042 67.408 1.00 0.00 O ATOM 35394 H1 WAT 6429 41.475 58.532 66.799 1.00 0.00 H ATOM 35395 H2 WAT 6429 42.142 58.460 68.156 1.00 0.00 H TER 35397 WAT 6429 ATOM 35397 O WAT 6430 23.770 38.718 136.058 1.00 0.00 O ATOM 35398 H1 WAT 6430 23.708 37.939 135.504 1.00 0.00 H ATOM 35399 H2 WAT 6430 24.667 38.703 136.393 1.00 0.00 H TER 35401 WAT 6430 ATOM 35401 O WAT 6431 87.808 40.472 87.673 1.00 0.00 O ATOM 35402 H1 WAT 6431 87.189 41.154 87.932 1.00 0.00 H ATOM 35403 H2 WAT 6431 88.558 40.595 88.256 1.00 0.00 H TER 35405 WAT 6431 ATOM 35405 O WAT 6432 29.148 23.577 157.456 1.00 0.00 O ATOM 35406 H1 WAT 6432 29.230 22.831 156.862 1.00 0.00 H ATOM 35407 H2 WAT 6432 29.455 24.325 156.943 1.00 0.00 H TER 35409 WAT 6432 ATOM 35409 O WAT 6433 75.955 77.152 66.495 1.00 0.00 O ATOM 35410 H1 WAT 6433 76.340 78.021 66.381 1.00 0.00 H ATOM 35411 H2 WAT 6433 76.687 76.601 66.774 1.00 0.00 H TER 35413 WAT 6433 ATOM 35413 O WAT 6434 49.241 99.081 95.434 1.00 0.00 O ATOM 35414 H1 WAT 6434 49.358 99.945 95.039 1.00 0.00 H ATOM 35415 H2 WAT 6434 48.710 98.598 94.801 1.00 0.00 H TER 35417 WAT 6434 ATOM 35417 O WAT 6435 136.602 97.728 134.130 1.00 0.00 O ATOM 35418 H1 WAT 6435 135.873 97.864 134.735 1.00 0.00 H ATOM 35419 H2 WAT 6435 137.316 97.412 134.684 1.00 0.00 H TER 35421 WAT 6435 ATOM 35421 O WAT 6436 98.122 104.468 151.472 1.00 0.00 O ATOM 35422 H1 WAT 6436 98.536 104.649 152.316 1.00 0.00 H ATOM 35423 H2 WAT 6436 98.797 104.673 150.825 1.00 0.00 H TER 35425 WAT 6436 ATOM 35425 O WAT 6437 98.732 124.943 16.093 1.00 0.00 O ATOM 35426 H1 WAT 6437 98.455 124.833 15.183 1.00 0.00 H ATOM 35427 H2 WAT 6437 98.245 124.274 16.573 1.00 0.00 H TER 35429 WAT 6437 ATOM 35429 O WAT 6438 81.039 139.754 116.588 1.00 0.00 O ATOM 35430 H1 WAT 6438 81.027 138.928 116.106 1.00 0.00 H ATOM 35431 H2 WAT 6438 80.359 139.653 117.254 1.00 0.00 H TER 35433 WAT 6438 ATOM 35433 O WAT 6439 137.434 76.978 9.229 1.00 0.00 O ATOM 35434 H1 WAT 6439 137.663 76.838 10.148 1.00 0.00 H ATOM 35435 H2 WAT 6439 136.673 77.557 9.258 1.00 0.00 H TER 35437 WAT 6439 ATOM 35437 O WAT 6440 62.673 31.094 131.817 1.00 0.00 O ATOM 35438 H1 WAT 6440 62.709 30.657 130.966 1.00 0.00 H ATOM 35439 H2 WAT 6440 63.283 30.602 132.366 1.00 0.00 H TER 35441 WAT 6440 ATOM 35441 O WAT 6441 61.357 33.992 1.991 1.00 0.00 O ATOM 35442 H1 WAT 6441 61.370 33.050 2.162 1.00 0.00 H ATOM 35443 H2 WAT 6441 62.208 34.174 1.593 1.00 0.00 H TER 35445 WAT 6441 ATOM 35445 O WAT 6442 17.868 100.810 103.439 1.00 0.00 O ATOM 35446 H1 WAT 6442 17.503 100.302 102.715 1.00 0.00 H ATOM 35447 H2 WAT 6442 17.514 100.395 104.225 1.00 0.00 H TER 35449 WAT 6442 ATOM 35449 O WAT 6443 130.718 94.439 75.124 1.00 0.00 O ATOM 35450 H1 WAT 6443 130.799 94.682 76.047 1.00 0.00 H ATOM 35451 H2 WAT 6443 131.305 93.690 75.021 1.00 0.00 H TER 35453 WAT 6443 ATOM 35453 O WAT 6444 120.234 126.927 80.076 1.00 0.00 O ATOM 35454 H1 WAT 6444 120.923 127.372 79.583 1.00 0.00 H ATOM 35455 H2 WAT 6444 120.515 126.987 80.989 1.00 0.00 H TER 35457 WAT 6444 ATOM 35457 O WAT 6445 65.780 127.222 71.465 1.00 0.00 O ATOM 35458 H1 WAT 6445 65.090 127.714 71.910 1.00 0.00 H ATOM 35459 H2 WAT 6445 66.491 127.176 72.105 1.00 0.00 H TER 35461 WAT 6445 ATOM 35461 O WAT 6446 131.546 63.740 11.747 1.00 0.00 O ATOM 35462 H1 WAT 6446 131.468 64.667 11.969 1.00 0.00 H ATOM 35463 H2 WAT 6446 130.700 63.363 11.991 1.00 0.00 H TER 35465 WAT 6446 ATOM 35465 O WAT 6447 108.213 44.540 105.811 1.00 0.00 O ATOM 35466 H1 WAT 6447 107.677 44.036 106.423 1.00 0.00 H ATOM 35467 H2 WAT 6447 108.531 45.281 106.326 1.00 0.00 H TER 35469 WAT 6447 ATOM 35469 O WAT 6448 61.049 63.731 122.713 1.00 0.00 O ATOM 35470 H1 WAT 6448 60.329 63.679 123.342 1.00 0.00 H ATOM 35471 H2 WAT 6448 60.625 63.651 121.858 1.00 0.00 H TER 35473 WAT 6448 ATOM 35473 O WAT 6449 22.398 86.306 71.112 1.00 0.00 O ATOM 35474 H1 WAT 6449 21.592 86.627 71.516 1.00 0.00 H ATOM 35475 H2 WAT 6449 22.330 85.353 71.168 1.00 0.00 H TER 35477 WAT 6449 ATOM 35477 O WAT 6450 26.312 51.959 131.380 1.00 0.00 O ATOM 35478 H1 WAT 6450 25.522 52.313 130.972 1.00 0.00 H ATOM 35479 H2 WAT 6450 26.130 51.025 131.482 1.00 0.00 H TER 35481 WAT 6450 ATOM 35481 O WAT 6451 47.224 93.735 119.783 1.00 0.00 O ATOM 35482 H1 WAT 6451 46.306 93.975 119.911 1.00 0.00 H ATOM 35483 H2 WAT 6451 47.259 92.802 119.997 1.00 0.00 H TER 35485 WAT 6451 ATOM 35485 O WAT 6452 78.343 91.094 155.825 1.00 0.00 O ATOM 35486 H1 WAT 6452 79.077 90.709 156.303 1.00 0.00 H ATOM 35487 H2 WAT 6452 78.581 90.998 154.903 1.00 0.00 H TER 35489 WAT 6452 ATOM 35489 O WAT 6453 10.710 118.359 111.138 1.00 0.00 O ATOM 35490 H1 WAT 6453 10.969 119.183 111.551 1.00 0.00 H ATOM 35491 H2 WAT 6453 9.754 118.382 111.137 1.00 0.00 H TER 35493 WAT 6453 ATOM 35493 O WAT 6454 131.470 58.048 90.963 1.00 0.00 O ATOM 35494 H1 WAT 6454 130.758 58.459 90.473 1.00 0.00 H ATOM 35495 H2 WAT 6454 132.267 58.346 90.523 1.00 0.00 H TER 35497 WAT 6454 ATOM 35497 O WAT 6455 142.944 0.195 97.294 1.00 0.00 O ATOM 35498 H1 WAT 6455 143.736 0.206 96.756 1.00 0.00 H ATOM 35499 H2 WAT 6455 142.447 0.959 97.003 1.00 0.00 H TER 35501 WAT 6455 ATOM 35501 O WAT 6456 120.857 0.583 156.039 1.00 0.00 O ATOM 35502 H1 WAT 6456 120.630 1.333 155.488 1.00 0.00 H ATOM 35503 H2 WAT 6456 120.682 0.880 156.932 1.00 0.00 H TER 35505 WAT 6456 ATOM 35505 O WAT 6457 104.994 26.180 8.656 1.00 0.00 O ATOM 35506 H1 WAT 6457 104.422 26.805 9.101 1.00 0.00 H ATOM 35507 H2 WAT 6457 104.654 25.321 8.909 1.00 0.00 H TER 35509 WAT 6457 ATOM 35509 O WAT 6458 34.576 116.607 68.497 1.00 0.00 O ATOM 35510 H1 WAT 6458 35.424 116.275 68.789 1.00 0.00 H ATOM 35511 H2 WAT 6458 34.571 116.455 67.552 1.00 0.00 H TER 35513 WAT 6458 ATOM 35513 O WAT 6459 63.020 114.315 105.843 1.00 0.00 O ATOM 35514 H1 WAT 6459 63.911 114.563 105.597 1.00 0.00 H ATOM 35515 H2 WAT 6459 63.128 113.517 106.360 1.00 0.00 H TER 35517 WAT 6459 ATOM 35517 O WAT 6460 2.214 80.604 2.583 1.00 0.00 O ATOM 35518 H1 WAT 6460 2.285 79.705 2.260 1.00 0.00 H ATOM 35519 H2 WAT 6460 2.682 81.129 1.934 1.00 0.00 H TER 35521 WAT 6460 ATOM 35521 O WAT 6461 77.696 44.814 80.676 1.00 0.00 O ATOM 35522 H1 WAT 6461 77.345 43.986 81.004 1.00 0.00 H ATOM 35523 H2 WAT 6461 77.229 45.486 81.174 1.00 0.00 H TER 35525 WAT 6461 ATOM 35525 O WAT 6462 66.599 10.004 7.150 1.00 0.00 O ATOM 35526 H1 WAT 6462 66.342 9.373 6.478 1.00 0.00 H ATOM 35527 H2 WAT 6462 65.787 10.200 7.617 1.00 0.00 H TER 35529 WAT 6462 ATOM 35529 O WAT 6463 111.596 87.508 100.067 1.00 0.00 O ATOM 35530 H1 WAT 6463 111.198 87.336 99.214 1.00 0.00 H ATOM 35531 H2 WAT 6463 110.874 87.826 100.609 1.00 0.00 H TER 35533 WAT 6463 ATOM 35533 O WAT 6464 55.294 106.801 128.379 1.00 0.00 O ATOM 35534 H1 WAT 6464 55.829 106.434 129.083 1.00 0.00 H ATOM 35535 H2 WAT 6464 55.926 107.206 127.785 1.00 0.00 H TER 35537 WAT 6464 ATOM 35537 O WAT 6465 71.316 38.650 75.878 1.00 0.00 O ATOM 35538 H1 WAT 6465 72.266 38.644 75.763 1.00 0.00 H ATOM 35539 H2 WAT 6465 70.988 38.062 75.198 1.00 0.00 H TER 35541 WAT 6465 ATOM 35541 O WAT 6466 134.266 47.026 25.735 1.00 0.00 O ATOM 35542 H1 WAT 6466 133.328 47.202 25.818 1.00 0.00 H ATOM 35543 H2 WAT 6466 134.347 46.084 25.885 1.00 0.00 H TER 35545 WAT 6466 ATOM 35545 O WAT 6467 113.023 56.824 146.957 1.00 0.00 O ATOM 35546 H1 WAT 6467 113.911 57.048 146.682 1.00 0.00 H ATOM 35547 H2 WAT 6467 113.041 56.898 147.911 1.00 0.00 H TER 35549 WAT 6467 ATOM 35549 O WAT 6468 18.844 36.354 121.393 1.00 0.00 O ATOM 35550 H1 WAT 6468 19.246 35.488 121.325 1.00 0.00 H ATOM 35551 H2 WAT 6468 19.338 36.794 122.085 1.00 0.00 H TER 35553 WAT 6468 ATOM 35553 O WAT 6469 90.780 133.868 114.032 1.00 0.00 O ATOM 35554 H1 WAT 6469 90.092 134.072 114.664 1.00 0.00 H ATOM 35555 H2 WAT 6469 91.195 134.711 113.848 1.00 0.00 H TER 35557 WAT 6469 ATOM 35557 O WAT 6470 67.285 28.920 20.582 1.00 0.00 O ATOM 35558 H1 WAT 6470 67.467 28.254 21.245 1.00 0.00 H ATOM 35559 H2 WAT 6470 68.074 28.941 20.041 1.00 0.00 H TER 35561 WAT 6470 ATOM 35561 O WAT 6471 49.077 96.885 123.871 1.00 0.00 O ATOM 35562 H1 WAT 6471 48.874 96.149 123.293 1.00 0.00 H ATOM 35563 H2 WAT 6471 48.312 96.960 124.441 1.00 0.00 H TER 35565 WAT 6471 ATOM 35565 O WAT 6472 101.411 106.211 27.177 1.00 0.00 O ATOM 35566 H1 WAT 6472 100.460 106.176 27.081 1.00 0.00 H ATOM 35567 H2 WAT 6472 101.592 107.109 27.454 1.00 0.00 H TER 35569 WAT 6472 ATOM 35569 O WAT 6473 75.934 115.138 12.858 1.00 0.00 O ATOM 35570 H1 WAT 6473 75.290 115.846 12.842 1.00 0.00 H ATOM 35571 H2 WAT 6473 75.664 114.552 12.151 1.00 0.00 H TER 35573 WAT 6473 ATOM 35573 O WAT 6474 134.359 72.160 23.084 1.00 0.00 O ATOM 35574 H1 WAT 6474 134.762 72.961 23.420 1.00 0.00 H ATOM 35575 H2 WAT 6474 134.816 71.989 22.261 1.00 0.00 H TER 35577 WAT 6474 ATOM 35577 O WAT 6475 60.263 47.660 13.071 1.00 0.00 O ATOM 35578 H1 WAT 6475 60.958 47.949 12.479 1.00 0.00 H ATOM 35579 H2 WAT 6475 59.453 47.835 12.594 1.00 0.00 H TER 35581 WAT 6475 ATOM 35581 O WAT 6476 8.983 139.590 156.726 1.00 0.00 O ATOM 35582 H1 WAT 6476 9.676 139.945 157.283 1.00 0.00 H ATOM 35583 H2 WAT 6476 8.350 140.304 156.646 1.00 0.00 H TER 35585 WAT 6476 ATOM 35585 O WAT 6477 78.384 103.067 81.182 1.00 0.00 O ATOM 35586 H1 WAT 6477 78.212 102.421 80.497 1.00 0.00 H ATOM 35587 H2 WAT 6477 77.682 102.936 81.818 1.00 0.00 H TER 35589 WAT 6477 ATOM 35589 O WAT 6478 76.835 92.020 96.680 1.00 0.00 O ATOM 35590 H1 WAT 6478 76.584 91.106 96.812 1.00 0.00 H ATOM 35591 H2 WAT 6478 76.299 92.312 95.942 1.00 0.00 H TER 35593 WAT 6478 ATOM 35593 O WAT 6479 140.950 32.323 63.632 1.00 0.00 O ATOM 35594 H1 WAT 6479 140.686 33.086 63.119 1.00 0.00 H ATOM 35595 H2 WAT 6479 141.765 32.590 64.056 1.00 0.00 H TER 35597 WAT 6479 ATOM 35597 O WAT 6480 46.078 110.349 83.705 1.00 0.00 O ATOM 35598 H1 WAT 6480 46.564 111.003 83.203 1.00 0.00 H ATOM 35599 H2 WAT 6480 46.365 110.479 84.609 1.00 0.00 H TER 35601 WAT 6480 ATOM 35601 O WAT 6481 96.132 62.877 101.648 1.00 0.00 O ATOM 35602 H1 WAT 6481 95.701 63.730 101.699 1.00 0.00 H ATOM 35603 H2 WAT 6481 95.896 62.540 100.784 1.00 0.00 H TER 35605 WAT 6481 ATOM 35605 O WAT 6482 23.163 66.584 76.965 1.00 0.00 O ATOM 35606 H1 WAT 6482 22.516 66.849 76.310 1.00 0.00 H ATOM 35607 H2 WAT 6482 23.283 67.361 77.511 1.00 0.00 H TER 35609 WAT 6482 ATOM 35609 O WAT 6483 65.377 87.587 9.787 1.00 0.00 O ATOM 35610 H1 WAT 6483 65.361 87.833 10.711 1.00 0.00 H ATOM 35611 H2 WAT 6483 65.838 88.306 9.355 1.00 0.00 H TER 35613 WAT 6483 ATOM 35613 O WAT 6484 97.368 61.086 119.957 1.00 0.00 O ATOM 35614 H1 WAT 6484 97.907 61.632 120.529 1.00 0.00 H ATOM 35615 H2 WAT 6484 97.310 60.246 120.413 1.00 0.00 H TER 35617 WAT 6484 ATOM 35617 O WAT 6485 112.501 62.748 142.717 1.00 0.00 O ATOM 35618 H1 WAT 6485 112.894 62.672 143.587 1.00 0.00 H ATOM 35619 H2 WAT 6485 113.155 63.217 142.199 1.00 0.00 H TER 35621 WAT 6485 ATOM 35621 O WAT 6486 118.872 129.845 140.057 1.00 0.00 O ATOM 35622 H1 WAT 6486 119.352 130.575 139.665 1.00 0.00 H ATOM 35623 H2 WAT 6486 118.985 129.962 141.000 1.00 0.00 H TER 35625 WAT 6486 ATOM 35625 O WAT 6487 59.213 2.622 7.289 1.00 0.00 O ATOM 35626 H1 WAT 6487 59.647 3.326 7.771 1.00 0.00 H ATOM 35627 H2 WAT 6487 59.005 3.007 6.438 1.00 0.00 H TER 35629 WAT 6487 ATOM 35629 O WAT 6488 112.181 144.904 91.935 1.00 0.00 O ATOM 35630 H1 WAT 6488 113.055 144.604 91.687 1.00 0.00 H ATOM 35631 H2 WAT 6488 111.585 144.316 91.471 1.00 0.00 H TER 35633 WAT 6488 ATOM 35633 O WAT 6489 0.122 44.244 71.606 1.00 0.00 O ATOM 35634 H1 WAT 6489 0.616 45.049 71.448 1.00 0.00 H ATOM 35635 H2 WAT 6489 0.645 43.764 72.248 1.00 0.00 H TER 35637 WAT 6489 ATOM 35637 O WAT 6490 116.655 91.679 1.105 1.00 0.00 O ATOM 35638 H1 WAT 6490 116.939 91.514 0.206 1.00 0.00 H ATOM 35639 H2 WAT 6490 115.863 91.151 1.207 1.00 0.00 H TER 35641 WAT 6490 ATOM 35641 O WAT 6491 77.896 39.047 9.677 1.00 0.00 O ATOM 35642 H1 WAT 6491 78.836 39.226 9.642 1.00 0.00 H ATOM 35643 H2 WAT 6491 77.584 39.228 8.791 1.00 0.00 H TER 35645 WAT 6491 ATOM 35645 O WAT 6492 56.830 119.014 139.764 1.00 0.00 O ATOM 35646 H1 WAT 6492 55.896 119.171 139.900 1.00 0.00 H ATOM 35647 H2 WAT 6492 56.899 118.066 139.646 1.00 0.00 H TER 35649 WAT 6492 ATOM 35649 O WAT 6493 5.667 95.498 3.691 1.00 0.00 O ATOM 35650 H1 WAT 6493 6.203 96.244 3.423 1.00 0.00 H ATOM 35651 H2 WAT 6493 6.202 94.732 3.484 1.00 0.00 H TER 35653 WAT 6493 ATOM 35653 O WAT 6494 84.378 81.710 19.695 1.00 0.00 O ATOM 35654 H1 WAT 6494 85.150 81.315 19.291 1.00 0.00 H ATOM 35655 H2 WAT 6494 84.389 82.619 19.395 1.00 0.00 H TER 35657 WAT 6494 ATOM 35657 O WAT 6495 48.680 95.604 0.958 1.00 0.00 O ATOM 35658 H1 WAT 6495 49.114 95.684 0.108 1.00 0.00 H ATOM 35659 H2 WAT 6495 47.986 94.961 0.813 1.00 0.00 H TER 35661 WAT 6495 ATOM 35661 O WAT 6496 38.368 40.577 110.741 1.00 0.00 O ATOM 35662 H1 WAT 6496 38.734 40.772 109.878 1.00 0.00 H ATOM 35663 H2 WAT 6496 38.932 41.051 111.353 1.00 0.00 H TER 35665 WAT 6496 ATOM 35665 O WAT 6497 137.875 35.772 87.162 1.00 0.00 O ATOM 35666 H1 WAT 6497 138.440 35.414 87.847 1.00 0.00 H ATOM 35667 H2 WAT 6497 138.221 36.649 87.000 1.00 0.00 H TER 35669 WAT 6497 ATOM 35669 O WAT 6498 62.457 43.291 140.080 1.00 0.00 O ATOM 35670 H1 WAT 6498 62.907 43.570 140.877 1.00 0.00 H ATOM 35671 H2 WAT 6498 63.148 42.916 139.534 1.00 0.00 H TER 35673 WAT 6498 ATOM 35673 O WAT 6499 82.306 107.186 152.038 1.00 0.00 O ATOM 35674 H1 WAT 6499 83.107 107.573 152.392 1.00 0.00 H ATOM 35675 H2 WAT 6499 81.665 107.896 152.065 1.00 0.00 H TER 35677 WAT 6499 ATOM 35677 O WAT 6500 123.892 94.534 13.113 1.00 0.00 O ATOM 35678 H1 WAT 6500 123.375 95.270 13.440 1.00 0.00 H ATOM 35679 H2 WAT 6500 123.723 94.523 12.171 1.00 0.00 H TER 35681 WAT 6500 ATOM 35681 O WAT 6501 133.866 81.064 92.696 1.00 0.00 O ATOM 35682 H1 WAT 6501 133.275 80.315 92.623 1.00 0.00 H ATOM 35683 H2 WAT 6501 133.286 81.824 92.735 1.00 0.00 H TER 35685 WAT 6501 ATOM 35685 O WAT 6502 83.117 8.842 72.308 1.00 0.00 O ATOM 35686 H1 WAT 6502 83.521 8.080 71.892 1.00 0.00 H ATOM 35687 H2 WAT 6502 82.646 9.280 71.599 1.00 0.00 H TER 35689 WAT 6502 ATOM 35689 O WAT 6503 133.148 4.735 83.783 1.00 0.00 O ATOM 35690 H1 WAT 6503 133.870 5.348 83.647 1.00 0.00 H ATOM 35691 H2 WAT 6503 132.798 4.964 84.644 1.00 0.00 H TER 35693 WAT 6503 ATOM 35693 O WAT 6504 63.394 83.746 1.898 1.00 0.00 O ATOM 35694 H1 WAT 6504 63.595 84.221 1.092 1.00 0.00 H ATOM 35695 H2 WAT 6504 62.832 84.342 2.393 1.00 0.00 H TER 35697 WAT 6504 ATOM 35697 O WAT 6505 48.327 60.913 15.898 1.00 0.00 O ATOM 35698 H1 WAT 6505 48.734 60.428 15.181 1.00 0.00 H ATOM 35699 H2 WAT 6505 48.898 60.754 16.649 1.00 0.00 H TER 35701 WAT 6505 ATOM 35701 O WAT 6506 115.845 143.325 136.418 1.00 0.00 O ATOM 35702 H1 WAT 6506 115.195 143.852 135.953 1.00 0.00 H ATOM 35703 H2 WAT 6506 115.328 142.695 136.919 1.00 0.00 H TER 35705 WAT 6506 ATOM 35705 O WAT 6507 37.377 112.634 80.829 1.00 0.00 O ATOM 35706 H1 WAT 6507 38.010 112.116 80.331 1.00 0.00 H ATOM 35707 H2 WAT 6507 37.043 113.274 80.200 1.00 0.00 H TER 35709 WAT 6507 ATOM 35709 O WAT 6508 135.302 72.941 28.868 1.00 0.00 O ATOM 35710 H1 WAT 6508 135.713 72.126 29.156 1.00 0.00 H ATOM 35711 H2 WAT 6508 136.032 73.487 28.575 1.00 0.00 H TER 35713 WAT 6508 ATOM 35713 O WAT 6509 19.546 137.400 96.928 1.00 0.00 O ATOM 35714 H1 WAT 6509 19.513 137.815 96.066 1.00 0.00 H ATOM 35715 H2 WAT 6509 19.081 138.007 97.504 1.00 0.00 H TER 35717 WAT 6509 ATOM 35717 O WAT 6510 72.162 24.154 75.840 1.00 0.00 O ATOM 35718 H1 WAT 6510 72.911 24.709 76.056 1.00 0.00 H ATOM 35719 H2 WAT 6510 72.371 23.793 74.978 1.00 0.00 H TER 35721 WAT 6510 ATOM 35721 O WAT 6511 14.053 90.955 70.907 1.00 0.00 O ATOM 35722 H1 WAT 6511 13.673 90.157 71.276 1.00 0.00 H ATOM 35723 H2 WAT 6511 13.997 90.830 69.960 1.00 0.00 H TER 35725 WAT 6511 ATOM 35725 O WAT 6512 122.492 61.131 5.725 1.00 0.00 O ATOM 35726 H1 WAT 6512 121.882 61.507 6.360 1.00 0.00 H ATOM 35727 H2 WAT 6512 123.357 61.279 6.107 1.00 0.00 H TER 35729 WAT 6512 ATOM 35729 O WAT 6513 65.452 27.152 70.864 1.00 0.00 O ATOM 35730 H1 WAT 6513 65.925 27.839 70.395 1.00 0.00 H ATOM 35731 H2 WAT 6513 65.028 27.607 71.592 1.00 0.00 H TER 35733 WAT 6513 ATOM 35733 O WAT 6514 70.868 11.897 15.113 1.00 0.00 O ATOM 35734 H1 WAT 6514 71.265 11.547 15.911 1.00 0.00 H ATOM 35735 H2 WAT 6514 71.611 12.166 14.574 1.00 0.00 H TER 35737 WAT 6514 ATOM 35737 O WAT 6515 71.344 17.049 76.950 1.00 0.00 O ATOM 35738 H1 WAT 6515 71.537 17.227 76.029 1.00 0.00 H ATOM 35739 H2 WAT 6515 70.777 17.772 77.219 1.00 0.00 H TER 35741 WAT 6515 ATOM 35741 O WAT 6516 13.015 128.221 132.172 1.00 0.00 O ATOM 35742 H1 WAT 6516 13.597 128.805 132.658 1.00 0.00 H ATOM 35743 H2 WAT 6516 12.168 128.668 132.176 1.00 0.00 H TER 35745 WAT 6516 ATOM 35745 O WAT 6517 35.700 86.618 91.875 1.00 0.00 O ATOM 35746 H1 WAT 6517 36.181 86.015 92.442 1.00 0.00 H ATOM 35747 H2 WAT 6517 35.725 87.455 92.340 1.00 0.00 H TER 35749 WAT 6517 ATOM 35749 O WAT 6518 7.027 51.289 142.377 1.00 0.00 O ATOM 35750 H1 WAT 6518 7.480 50.572 141.933 1.00 0.00 H ATOM 35751 H2 WAT 6518 6.819 50.940 143.244 1.00 0.00 H TER 35753 WAT 6518 ATOM 35753 O WAT 6519 26.368 31.194 91.403 1.00 0.00 O ATOM 35754 H1 WAT 6519 26.717 31.949 90.930 1.00 0.00 H ATOM 35755 H2 WAT 6519 26.983 31.058 92.124 1.00 0.00 H TER 35757 WAT 6519 ATOM 35757 O WAT 6520 75.657 23.868 6.892 1.00 0.00 O ATOM 35758 H1 WAT 6520 76.162 23.086 7.115 1.00 0.00 H ATOM 35759 H2 WAT 6520 74.986 23.922 7.572 1.00 0.00 H TER 35761 WAT 6520 ATOM 35761 O WAT 6521 134.533 100.271 25.860 1.00 0.00 O ATOM 35762 H1 WAT 6521 134.337 99.979 26.751 1.00 0.00 H ATOM 35763 H2 WAT 6521 134.699 99.464 25.374 1.00 0.00 H TER 35765 WAT 6521 ATOM 35765 O WAT 6522 10.918 143.358 120.836 1.00 0.00 O ATOM 35766 H1 WAT 6522 10.711 144.279 120.676 1.00 0.00 H ATOM 35767 H2 WAT 6522 11.083 142.995 119.965 1.00 0.00 H TER 35769 WAT 6522 ATOM 35769 O WAT 6523 92.322 76.703 60.437 1.00 0.00 O ATOM 35770 H1 WAT 6523 91.875 77.511 60.187 1.00 0.00 H ATOM 35771 H2 WAT 6523 92.277 76.152 59.655 1.00 0.00 H TER 35773 WAT 6523 ATOM 35773 O WAT 6524 74.803 75.380 142.247 1.00 0.00 O ATOM 35774 H1 WAT 6524 74.483 74.919 143.022 1.00 0.00 H ATOM 35775 H2 WAT 6524 74.700 76.307 142.460 1.00 0.00 H TER 35777 WAT 6524 ATOM 35777 O WAT 6525 49.131 35.248 144.750 1.00 0.00 O ATOM 35778 H1 WAT 6525 48.246 35.371 144.407 1.00 0.00 H ATOM 35779 H2 WAT 6525 49.002 34.826 145.600 1.00 0.00 H TER 35781 WAT 6525 ATOM 35781 O WAT 6526 96.139 112.100 68.396 1.00 0.00 O ATOM 35782 H1 WAT 6526 95.413 112.118 67.772 1.00 0.00 H ATOM 35783 H2 WAT 6526 96.471 111.204 68.352 1.00 0.00 H TER 35785 WAT 6526 ATOM 35785 O WAT 6527 66.303 54.627 120.166 1.00 0.00 O ATOM 35786 H1 WAT 6527 66.715 54.388 120.997 1.00 0.00 H ATOM 35787 H2 WAT 6527 67.033 54.707 119.552 1.00 0.00 H TER 35789 WAT 6527 ATOM 35789 O WAT 6528 5.543 84.388 6.787 1.00 0.00 O ATOM 35790 H1 WAT 6528 5.792 83.775 6.095 1.00 0.00 H ATOM 35791 H2 WAT 6528 4.656 84.125 7.031 1.00 0.00 H TER 35793 WAT 6528 ATOM 35793 O WAT 6529 73.277 135.950 134.416 1.00 0.00 O ATOM 35794 H1 WAT 6529 73.592 136.027 135.317 1.00 0.00 H ATOM 35795 H2 WAT 6529 72.426 135.519 134.496 1.00 0.00 H TER 35797 WAT 6529 ATOM 35797 O WAT 6530 110.053 81.949 80.219 1.00 0.00 O ATOM 35798 H1 WAT 6530 110.795 82.447 80.562 1.00 0.00 H ATOM 35799 H2 WAT 6530 110.372 81.576 79.398 1.00 0.00 H TER 35801 WAT 6530 ATOM 35801 O WAT 6531 68.321 15.378 80.207 1.00 0.00 O ATOM 35802 H1 WAT 6531 68.030 14.945 81.009 1.00 0.00 H ATOM 35803 H2 WAT 6531 69.276 15.393 80.275 1.00 0.00 H TER 35805 WAT 6531 ATOM 35805 O WAT 6532 65.004 49.531 128.478 1.00 0.00 O ATOM 35806 H1 WAT 6532 64.310 49.572 127.820 1.00 0.00 H ATOM 35807 H2 WAT 6532 64.992 48.623 128.782 1.00 0.00 H TER 35809 WAT 6532 ATOM 35809 O WAT 6533 48.953 41.429 60.825 1.00 0.00 O ATOM 35810 H1 WAT 6533 49.585 41.780 60.199 1.00 0.00 H ATOM 35811 H2 WAT 6533 48.786 40.536 60.522 1.00 0.00 H TER 35813 WAT 6533 ATOM 35813 O WAT 6534 34.947 107.193 154.723 1.00 0.00 O ATOM 35814 H1 WAT 6534 34.906 108.041 155.165 1.00 0.00 H ATOM 35815 H2 WAT 6534 34.135 106.753 154.975 1.00 0.00 H TER 35817 WAT 6534 ATOM 35817 O WAT 6535 18.261 17.427 90.553 1.00 0.00 O ATOM 35818 H1 WAT 6535 18.368 17.118 89.654 1.00 0.00 H ATOM 35819 H2 WAT 6535 18.761 18.243 90.587 1.00 0.00 H TER 35821 WAT 6535 ATOM 35821 O WAT 6536 6.849 69.462 103.272 1.00 0.00 O ATOM 35822 H1 WAT 6536 7.465 69.360 103.997 1.00 0.00 H ATOM 35823 H2 WAT 6536 6.794 70.408 103.137 1.00 0.00 H TER 35825 WAT 6536 ATOM 35825 O WAT 6537 130.693 130.282 82.584 1.00 0.00 O ATOM 35826 H1 WAT 6537 131.493 129.976 82.156 1.00 0.00 H ATOM 35827 H2 WAT 6537 130.034 130.280 81.889 1.00 0.00 H TER 35829 WAT 6537 ATOM 35829 O WAT 6538 7.904 21.163 141.256 1.00 0.00 O ATOM 35830 H1 WAT 6538 7.535 21.771 140.616 1.00 0.00 H ATOM 35831 H2 WAT 6538 8.066 21.700 142.032 1.00 0.00 H TER 35833 WAT 6538 ATOM 35833 O WAT 6539 90.942 91.907 100.543 1.00 0.00 O ATOM 35834 H1 WAT 6539 90.370 92.369 101.156 1.00 0.00 H ATOM 35835 H2 WAT 6539 91.537 91.406 101.102 1.00 0.00 H TER 35837 WAT 6539 ATOM 35837 O WAT 6540 15.616 57.813 87.712 1.00 0.00 O ATOM 35838 H1 WAT 6540 16.340 57.335 87.308 1.00 0.00 H ATOM 35839 H2 WAT 6540 15.411 58.509 87.088 1.00 0.00 H TER 35841 WAT 6540 ATOM 35841 O WAT 6541 62.405 92.122 98.501 1.00 0.00 O ATOM 35842 H1 WAT 6541 61.960 91.633 99.193 1.00 0.00 H ATOM 35843 H2 WAT 6541 62.612 92.967 98.899 1.00 0.00 H TER 35845 WAT 6541 ATOM 35845 O WAT 6542 28.181 60.019 98.001 1.00 0.00 O ATOM 35846 H1 WAT 6542 29.081 60.086 97.681 1.00 0.00 H ATOM 35847 H2 WAT 6542 27.688 59.672 97.258 1.00 0.00 H TER 35849 WAT 6542 ATOM 35849 O WAT 6543 53.315 140.234 70.266 1.00 0.00 O ATOM 35850 H1 WAT 6543 53.483 139.309 70.086 1.00 0.00 H ATOM 35851 H2 WAT 6543 52.469 140.408 69.853 1.00 0.00 H TER 35853 WAT 6543 ATOM 35853 O WAT 6544 30.117 117.331 100.548 1.00 0.00 O ATOM 35854 H1 WAT 6544 30.979 117.737 100.454 1.00 0.00 H ATOM 35855 H2 WAT 6544 30.303 116.429 100.806 1.00 0.00 H TER 35857 WAT 6544 ATOM 35857 O WAT 6545 140.496 66.370 86.253 1.00 0.00 O ATOM 35858 H1 WAT 6545 139.887 65.667 86.478 1.00 0.00 H ATOM 35859 H2 WAT 6545 140.949 66.566 87.073 1.00 0.00 H TER 35861 WAT 6545 ATOM 35861 O WAT 6546 87.824 57.240 6.332 1.00 0.00 O ATOM 35862 H1 WAT 6546 88.473 57.888 6.605 1.00 0.00 H ATOM 35863 H2 WAT 6546 87.770 57.342 5.381 1.00 0.00 H TER 35865 WAT 6546 ATOM 35865 O WAT 6547 98.769 33.547 70.930 1.00 0.00 O ATOM 35866 H1 WAT 6547 98.561 33.075 70.124 1.00 0.00 H ATOM 35867 H2 WAT 6547 99.629 33.213 71.187 1.00 0.00 H TER 35869 WAT 6547 ATOM 35869 O WAT 6548 25.593 108.542 92.184 1.00 0.00 O ATOM 35870 H1 WAT 6548 25.434 108.198 91.305 1.00 0.00 H ATOM 35871 H2 WAT 6548 26.269 107.971 92.547 1.00 0.00 H TER 35873 WAT 6548 ATOM 35873 O WAT 6549 19.736 145.417 132.511 1.00 0.00 O ATOM 35874 H1 WAT 6549 20.367 146.124 132.641 1.00 0.00 H ATOM 35875 H2 WAT 6549 18.882 145.833 132.630 1.00 0.00 H TER 35877 WAT 6549 ATOM 35877 O WAT 6550 73.317 11.146 88.968 1.00 0.00 O ATOM 35878 H1 WAT 6550 73.468 11.685 89.744 1.00 0.00 H ATOM 35879 H2 WAT 6550 72.787 11.697 88.393 1.00 0.00 H TER 35881 WAT 6550 ATOM 35881 O WAT 6551 54.642 106.558 69.722 1.00 0.00 O ATOM 35882 H1 WAT 6551 55.131 107.118 69.118 1.00 0.00 H ATOM 35883 H2 WAT 6551 54.128 107.168 70.251 1.00 0.00 H TER 35885 WAT 6551 ATOM 35885 O WAT 6552 141.271 99.870 23.497 1.00 0.00 O ATOM 35886 H1 WAT 6552 140.974 100.746 23.250 1.00 0.00 H ATOM 35887 H2 WAT 6552 140.912 99.733 24.374 1.00 0.00 H TER 35889 WAT 6552 ATOM 35889 O WAT 6553 133.512 97.759 157.945 1.00 0.00 O ATOM 35890 H1 WAT 6553 134.409 98.020 158.154 1.00 0.00 H ATOM 35891 H2 WAT 6553 133.468 96.835 158.193 1.00 0.00 H TER 35893 WAT 6553 ATOM 35893 O WAT 6554 48.763 145.259 104.645 1.00 0.00 O ATOM 35894 H1 WAT 6554 48.929 144.430 105.093 1.00 0.00 H ATOM 35895 H2 WAT 6554 49.368 145.878 105.055 1.00 0.00 H TER 35897 WAT 6554 ATOM 35897 O WAT 6555 1.367 95.248 92.821 1.00 0.00 O ATOM 35898 H1 WAT 6555 0.614 94.851 92.381 1.00 0.00 H ATOM 35899 H2 WAT 6555 1.861 94.505 93.166 1.00 0.00 H TER 35901 WAT 6555 ATOM 35901 O WAT 6556 28.306 53.757 69.940 1.00 0.00 O ATOM 35902 H1 WAT 6556 27.588 53.841 70.567 1.00 0.00 H ATOM 35903 H2 WAT 6556 28.426 52.813 69.839 1.00 0.00 H TER 35905 WAT 6556 ATOM 35905 O WAT 6557 47.495 21.616 67.602 1.00 0.00 O ATOM 35906 H1 WAT 6557 46.792 22.245 67.434 1.00 0.00 H ATOM 35907 H2 WAT 6557 48.177 21.846 66.971 1.00 0.00 H TER 35909 WAT 6557 ATOM 35909 O WAT 6558 50.717 95.835 87.001 1.00 0.00 O ATOM 35910 H1 WAT 6558 49.836 96.180 87.140 1.00 0.00 H ATOM 35911 H2 WAT 6558 50.577 94.952 86.657 1.00 0.00 H TER 35913 WAT 6558 ATOM 35913 O WAT 6559 56.909 32.352 64.604 1.00 0.00 O ATOM 35914 H1 WAT 6559 57.522 31.703 64.951 1.00 0.00 H ATOM 35915 H2 WAT 6559 56.044 31.980 64.776 1.00 0.00 H TER 35917 WAT 6559 ATOM 35917 O WAT 6560 116.221 0.946 122.953 1.00 0.00 O ATOM 35918 H1 WAT 6560 116.099 0.855 122.008 1.00 0.00 H ATOM 35919 H2 WAT 6560 116.897 0.305 123.171 1.00 0.00 H TER 35921 WAT 6560 ATOM 35921 O WAT 6561 50.205 92.601 139.706 1.00 0.00 O ATOM 35922 H1 WAT 6561 50.906 92.733 139.068 1.00 0.00 H ATOM 35923 H2 WAT 6561 50.622 92.751 140.555 1.00 0.00 H TER 35925 WAT 6561 ATOM 35925 O WAT 6562 45.023 12.617 62.607 1.00 0.00 O ATOM 35926 H1 WAT 6562 45.769 13.023 62.164 1.00 0.00 H ATOM 35927 H2 WAT 6562 45.156 12.819 63.533 1.00 0.00 H TER 35929 WAT 6562 ATOM 35929 O WAT 6563 35.417 70.189 7.227 1.00 0.00 O ATOM 35930 H1 WAT 6563 35.050 69.464 6.721 1.00 0.00 H ATOM 35931 H2 WAT 6563 35.270 70.961 6.682 1.00 0.00 H TER 35933 WAT 6563 ATOM 35933 O WAT 6564 42.729 51.818 146.630 1.00 0.00 O ATOM 35934 H1 WAT 6564 42.803 52.478 145.941 1.00 0.00 H ATOM 35935 H2 WAT 6564 41.812 51.858 146.902 1.00 0.00 H TER 35937 WAT 6564 ATOM 35937 O WAT 6565 102.826 128.795 94.606 1.00 0.00 O ATOM 35938 H1 WAT 6565 102.389 129.255 95.323 1.00 0.00 H ATOM 35939 H2 WAT 6565 102.113 128.516 94.031 1.00 0.00 H TER 35941 WAT 6565 ATOM 35941 O WAT 6566 78.155 72.510 62.986 1.00 0.00 O ATOM 35942 H1 WAT 6566 77.885 72.855 62.135 1.00 0.00 H ATOM 35943 H2 WAT 6566 77.971 73.220 63.602 1.00 0.00 H TER 35945 WAT 6566 ATOM 35945 O WAT 6567 38.236 2.588 77.287 1.00 0.00 O ATOM 35946 H1 WAT 6567 38.061 2.944 78.157 1.00 0.00 H ATOM 35947 H2 WAT 6567 38.248 3.353 76.712 1.00 0.00 H TER 35949 WAT 6567 ATOM 35949 O WAT 6568 1.965 138.551 25.232 1.00 0.00 O ATOM 35950 H1 WAT 6568 2.268 139.063 25.983 1.00 0.00 H ATOM 35951 H2 WAT 6568 2.767 138.313 24.766 1.00 0.00 H TER 35953 WAT 6568 ATOM 35953 O WAT 6569 120.111 1.554 139.253 1.00 0.00 O ATOM 35954 H1 WAT 6569 120.690 1.707 140.001 1.00 0.00 H ATOM 35955 H2 WAT 6569 120.705 1.382 138.522 1.00 0.00 H TER 35957 WAT 6569 ATOM 35957 O WAT 6570 28.141 33.186 128.782 1.00 0.00 O ATOM 35958 H1 WAT 6570 27.319 33.479 128.389 1.00 0.00 H ATOM 35959 H2 WAT 6570 28.719 33.948 128.725 1.00 0.00 H TER 35961 WAT 6570 ATOM 35961 O WAT 6571 49.719 61.153 20.647 1.00 0.00 O ATOM 35962 H1 WAT 6571 49.245 61.978 20.535 1.00 0.00 H ATOM 35963 H2 WAT 6571 50.238 61.281 21.441 1.00 0.00 H TER 35965 WAT 6571 ATOM 35965 O WAT 6572 42.338 73.661 67.620 1.00 0.00 O ATOM 35966 H1 WAT 6572 42.289 72.941 68.249 1.00 0.00 H ATOM 35967 H2 WAT 6572 41.685 74.291 67.927 1.00 0.00 H TER 35969 WAT 6572 ATOM 35969 O WAT 6573 7.501 115.713 140.528 1.00 0.00 O ATOM 35970 H1 WAT 6573 8.423 115.959 140.595 1.00 0.00 H ATOM 35971 H2 WAT 6573 7.239 115.519 141.428 1.00 0.00 H TER 35973 WAT 6573 ATOM 35973 O WAT 6574 126.444 45.414 135.262 1.00 0.00 O ATOM 35974 H1 WAT 6574 126.153 46.257 134.913 1.00 0.00 H ATOM 35975 H2 WAT 6574 126.332 45.496 136.209 1.00 0.00 H TER 35977 WAT 6574 ATOM 35977 O WAT 6575 45.132 110.019 56.919 1.00 0.00 O ATOM 35978 H1 WAT 6575 44.676 109.435 57.525 1.00 0.00 H ATOM 35979 H2 WAT 6575 45.785 109.461 56.496 1.00 0.00 H TER 35981 WAT 6575 ATOM 35981 O WAT 6576 8.475 135.438 140.186 1.00 0.00 O ATOM 35982 H1 WAT 6576 9.022 135.746 139.463 1.00 0.00 H ATOM 35983 H2 WAT 6576 9.078 134.958 140.754 1.00 0.00 H TER 35985 WAT 6576 ATOM 35985 O WAT 6577 23.945 135.861 130.428 1.00 0.00 O ATOM 35986 H1 WAT 6577 24.417 136.521 129.920 1.00 0.00 H ATOM 35987 H2 WAT 6577 24.554 135.125 130.489 1.00 0.00 H TER 35989 WAT 6577 ATOM 35989 O WAT 6578 138.763 133.917 123.343 1.00 0.00 O ATOM 35990 H1 WAT 6578 138.426 133.283 123.976 1.00 0.00 H ATOM 35991 H2 WAT 6578 138.994 133.391 122.577 1.00 0.00 H TER 35993 WAT 6578 ATOM 35993 O WAT 6579 30.991 78.575 155.486 1.00 0.00 O ATOM 35994 H1 WAT 6579 31.644 78.784 154.817 1.00 0.00 H ATOM 35995 H2 WAT 6579 30.958 79.355 156.040 1.00 0.00 H TER 35997 WAT 6579 ATOM 35997 O WAT 6580 50.077 4.622 59.407 1.00 0.00 O ATOM 35998 H1 WAT 6580 50.246 5.331 58.786 1.00 0.00 H ATOM 35999 H2 WAT 6580 49.320 4.921 59.911 1.00 0.00 H TER 36001 WAT 6580 ATOM 36001 O WAT 6581 22.566 16.832 26.373 1.00 0.00 O ATOM 36002 H1 WAT 6581 23.049 17.644 26.528 1.00 0.00 H ATOM 36003 H2 WAT 6581 21.845 16.859 27.002 1.00 0.00 H TER 36005 WAT 6581 ATOM 36005 O WAT 6582 112.370 95.137 142.916 1.00 0.00 O ATOM 36006 H1 WAT 6582 113.165 95.448 142.484 1.00 0.00 H ATOM 36007 H2 WAT 6582 112.384 95.557 143.776 1.00 0.00 H TER 36009 WAT 6582 ATOM 36009 O WAT 6583 85.755 130.683 66.491 1.00 0.00 O ATOM 36010 H1 WAT 6583 85.467 130.818 67.393 1.00 0.00 H ATOM 36011 H2 WAT 6583 86.687 130.904 66.501 1.00 0.00 H TER 36013 WAT 6583 ATOM 36013 O WAT 6584 133.556 30.067 148.064 1.00 0.00 O ATOM 36014 H1 WAT 6584 133.119 29.596 147.355 1.00 0.00 H ATOM 36015 H2 WAT 6584 134.489 29.965 147.881 1.00 0.00 H TER 36017 WAT 6584 ATOM 36017 O WAT 6585 73.343 9.078 91.121 1.00 0.00 O ATOM 36018 H1 WAT 6585 73.386 9.724 90.416 1.00 0.00 H ATOM 36019 H2 WAT 6585 74.051 8.464 90.928 1.00 0.00 H TER 36021 WAT 6585 ATOM 36021 O WAT 6586 132.730 57.024 106.782 1.00 0.00 O ATOM 36022 H1 WAT 6586 133.212 57.262 107.574 1.00 0.00 H ATOM 36023 H2 WAT 6586 132.488 56.107 106.915 1.00 0.00 H TER 36025 WAT 6586 ATOM 36025 O WAT 6587 11.716 135.878 78.999 1.00 0.00 O ATOM 36026 H1 WAT 6587 12.387 136.281 78.449 1.00 0.00 H ATOM 36027 H2 WAT 6587 11.083 135.515 78.378 1.00 0.00 H TER 36029 WAT 6587 ATOM 36029 O WAT 6588 49.841 145.524 85.204 1.00 0.00 O ATOM 36030 H1 WAT 6588 49.221 144.795 85.191 1.00 0.00 H ATOM 36031 H2 WAT 6588 50.576 145.224 84.669 1.00 0.00 H TER 36033 WAT 6588 ATOM 36033 O WAT 6589 135.835 55.775 124.870 1.00 0.00 O ATOM 36034 H1 WAT 6589 135.763 54.860 125.143 1.00 0.00 H ATOM 36035 H2 WAT 6589 134.949 56.124 124.964 1.00 0.00 H TER 36037 WAT 6589 ATOM 36037 O WAT 6590 8.895 46.551 139.732 1.00 0.00 O ATOM 36038 H1 WAT 6590 9.093 45.629 139.893 1.00 0.00 H ATOM 36039 H2 WAT 6590 9.748 46.957 139.580 1.00 0.00 H TER 36041 WAT 6590 ATOM 36041 O WAT 6591 69.514 47.505 145.797 1.00 0.00 O ATOM 36042 H1 WAT 6591 70.006 46.701 145.631 1.00 0.00 H ATOM 36043 H2 WAT 6591 68.604 47.218 145.868 1.00 0.00 H TER 36045 WAT 6591 ATOM 36045 O WAT 6592 38.537 123.612 3.484 1.00 0.00 O ATOM 36046 H1 WAT 6592 39.388 123.906 3.809 1.00 0.00 H ATOM 36047 H2 WAT 6592 38.556 123.809 2.547 1.00 0.00 H TER 36049 WAT 6592 ATOM 36049 O WAT 6593 117.493 34.620 115.050 1.00 0.00 O ATOM 36050 H1 WAT 6593 117.294 33.708 114.838 1.00 0.00 H ATOM 36051 H2 WAT 6593 118.450 34.657 115.073 1.00 0.00 H TER 36053 WAT 6593 ATOM 36053 O WAT 6594 68.377 66.064 17.414 1.00 0.00 O ATOM 36054 H1 WAT 6594 68.010 65.756 18.242 1.00 0.00 H ATOM 36055 H2 WAT 6594 69.298 65.805 17.449 1.00 0.00 H TER 36057 WAT 6594 ATOM 36057 O WAT 6595 57.904 47.711 78.054 1.00 0.00 O ATOM 36058 H1 WAT 6595 58.386 47.098 77.500 1.00 0.00 H ATOM 36059 H2 WAT 6595 57.263 48.112 77.466 1.00 0.00 H TER 36061 WAT 6595 ATOM 36061 O WAT 6596 90.792 81.103 79.940 1.00 0.00 O ATOM 36062 H1 WAT 6596 91.103 81.958 80.239 1.00 0.00 H ATOM 36063 H2 WAT 6596 90.753 80.572 80.735 1.00 0.00 H TER 36065 WAT 6596 ATOM 36065 O WAT 6597 117.820 76.426 83.885 1.00 0.00 O ATOM 36066 H1 WAT 6597 117.545 75.769 84.525 1.00 0.00 H ATOM 36067 H2 WAT 6597 118.754 76.259 83.757 1.00 0.00 H TER 36069 WAT 6597 ATOM 36069 O WAT 6598 143.167 142.266 101.345 1.00 0.00 O ATOM 36070 H1 WAT 6598 142.948 141.456 101.806 1.00 0.00 H ATOM 36071 H2 WAT 6598 142.408 142.437 100.788 1.00 0.00 H TER 36073 WAT 6598 ATOM 36073 O WAT 6599 46.181 17.482 106.011 1.00 0.00 O ATOM 36074 H1 WAT 6599 46.221 17.218 106.930 1.00 0.00 H ATOM 36075 H2 WAT 6599 45.255 17.669 105.855 1.00 0.00 H TER 36077 WAT 6599 ATOM 36077 O WAT 6600 135.817 30.461 91.301 1.00 0.00 O ATOM 36078 H1 WAT 6600 135.737 31.412 91.377 1.00 0.00 H ATOM 36079 H2 WAT 6600 134.999 30.122 91.664 1.00 0.00 H TER 36081 WAT 6600 ATOM 36081 O WAT 6601 66.404 4.884 63.901 1.00 0.00 O ATOM 36082 H1 WAT 6601 67.024 5.179 64.568 1.00 0.00 H ATOM 36083 H2 WAT 6601 66.941 4.745 63.121 1.00 0.00 H TER 36085 WAT 6601 ATOM 36085 O WAT 6602 23.452 34.019 97.275 1.00 0.00 O ATOM 36086 H1 WAT 6602 23.574 33.404 96.552 1.00 0.00 H ATOM 36087 H2 WAT 6602 23.078 33.489 97.979 1.00 0.00 H TER 36089 WAT 6602 ATOM 36089 O WAT 6603 102.981 86.595 20.353 1.00 0.00 O ATOM 36090 H1 WAT 6603 102.359 86.050 19.870 1.00 0.00 H ATOM 36091 H2 WAT 6603 103.000 86.216 21.231 1.00 0.00 H TER 36093 WAT 6603 ATOM 36093 O WAT 6604 132.432 85.801 154.630 1.00 0.00 O ATOM 36094 H1 WAT 6604 132.632 86.359 155.382 1.00 0.00 H ATOM 36095 H2 WAT 6604 131.758 85.202 154.948 1.00 0.00 H TER 36097 WAT 6604 ATOM 36097 O WAT 6605 80.490 10.007 102.579 1.00 0.00 O ATOM 36098 H1 WAT 6605 81.036 9.285 102.269 1.00 0.00 H ATOM 36099 H2 WAT 6605 79.783 9.581 103.064 1.00 0.00 H TER 36101 WAT 6605 ATOM 36101 O WAT 6606 36.895 55.428 92.319 1.00 0.00 O ATOM 36102 H1 WAT 6606 36.595 55.619 91.431 1.00 0.00 H ATOM 36103 H2 WAT 6606 37.769 55.815 92.366 1.00 0.00 H TER 36105 WAT 6606 ATOM 36105 O WAT 6607 72.293 40.414 149.115 1.00 0.00 O ATOM 36106 H1 WAT 6607 71.906 39.904 148.403 1.00 0.00 H ATOM 36107 H2 WAT 6607 72.481 39.770 149.797 1.00 0.00 H TER 36109 WAT 6607 ATOM 36109 O WAT 6608 115.704 115.999 75.219 1.00 0.00 O ATOM 36110 H1 WAT 6608 115.838 116.850 75.636 1.00 0.00 H ATOM 36111 H2 WAT 6608 116.551 115.559 75.295 1.00 0.00 H TER 36113 WAT 6608 ATOM 36113 O WAT 6609 58.665 17.668 11.871 1.00 0.00 O ATOM 36114 H1 WAT 6609 58.345 17.684 12.773 1.00 0.00 H ATOM 36115 H2 WAT 6609 58.284 18.449 11.468 1.00 0.00 H TER 36117 WAT 6609 ATOM 36117 O WAT 6610 41.492 91.569 101.737 1.00 0.00 O ATOM 36118 H1 WAT 6610 41.294 90.739 102.170 1.00 0.00 H ATOM 36119 H2 WAT 6610 40.663 92.047 101.743 1.00 0.00 H TER 36121 WAT 6610 ATOM 36121 O WAT 6611 86.086 75.321 108.091 1.00 0.00 O ATOM 36122 H1 WAT 6611 85.961 75.016 108.990 1.00 0.00 H ATOM 36123 H2 WAT 6611 85.743 74.612 107.548 1.00 0.00 H TER 36125 WAT 6611 ATOM 36125 O WAT 6612 2.832 69.850 104.505 1.00 0.00 O ATOM 36126 H1 WAT 6612 3.187 70.361 103.777 1.00 0.00 H ATOM 36127 H2 WAT 6612 2.805 70.465 105.238 1.00 0.00 H TER 36129 WAT 6612 ATOM 36129 O WAT 6613 38.226 131.086 84.863 1.00 0.00 O ATOM 36130 H1 WAT 6613 37.287 130.901 84.884 1.00 0.00 H ATOM 36131 H2 WAT 6613 38.624 130.271 84.557 1.00 0.00 H TER 36133 WAT 6613 ATOM 36133 O WAT 6614 35.166 91.493 65.873 1.00 0.00 O ATOM 36134 H1 WAT 6614 35.752 90.903 66.348 1.00 0.00 H ATOM 36135 H2 WAT 6614 34.287 91.226 66.143 1.00 0.00 H TER 36137 WAT 6614 ATOM 36137 O WAT 6615 118.593 9.883 16.169 1.00 0.00 O ATOM 36138 H1 WAT 6615 119.425 9.722 15.725 1.00 0.00 H ATOM 36139 H2 WAT 6615 117.928 9.619 15.534 1.00 0.00 H TER 36141 WAT 6615 ATOM 36141 O WAT 6616 64.283 102.008 116.901 1.00 0.00 O ATOM 36142 H1 WAT 6616 63.454 101.685 116.546 1.00 0.00 H ATOM 36143 H2 WAT 6616 64.067 102.300 117.787 1.00 0.00 H TER 36145 WAT 6616 ATOM 36145 O WAT 6617 94.204 48.223 150.622 1.00 0.00 O ATOM 36146 H1 WAT 6617 94.538 47.784 151.405 1.00 0.00 H ATOM 36147 H2 WAT 6617 94.926 48.174 149.995 1.00 0.00 H TER 36149 WAT 6617 ATOM 36149 O WAT 6618 104.128 126.357 92.907 1.00 0.00 O ATOM 36150 H1 WAT 6618 104.255 126.733 93.778 1.00 0.00 H ATOM 36151 H2 WAT 6618 103.241 125.998 92.927 1.00 0.00 H TER 36153 WAT 6618 ATOM 36153 O WAT 6619 48.294 72.626 84.042 1.00 0.00 O ATOM 36154 H1 WAT 6619 47.758 71.846 84.189 1.00 0.00 H ATOM 36155 H2 WAT 6619 48.359 73.037 84.904 1.00 0.00 H TER 36157 WAT 6619 ATOM 36157 O WAT 6620 13.773 16.756 138.913 1.00 0.00 O ATOM 36158 H1 WAT 6620 14.312 17.390 138.439 1.00 0.00 H ATOM 36159 H2 WAT 6620 12.983 16.669 138.380 1.00 0.00 H TER 36161 WAT 6620 ATOM 36161 O WAT 6621 57.949 17.301 68.367 1.00 0.00 O ATOM 36162 H1 WAT 6621 57.940 16.345 68.334 1.00 0.00 H ATOM 36163 H2 WAT 6621 58.877 17.532 68.391 1.00 0.00 H TER 36165 WAT 6621 ATOM 36165 O WAT 6622 108.908 36.264 98.336 1.00 0.00 O ATOM 36166 H1 WAT 6622 109.290 36.013 97.495 1.00 0.00 H ATOM 36167 H2 WAT 6622 108.014 36.533 98.122 1.00 0.00 H TER 36169 WAT 6622 ATOM 36169 O WAT 6623 139.156 125.837 102.960 1.00 0.00 O ATOM 36170 H1 WAT 6623 139.515 124.963 103.115 1.00 0.00 H ATOM 36171 H2 WAT 6623 138.518 125.711 102.257 1.00 0.00 H TER 36173 WAT 6623 ATOM 36173 O WAT 6624 118.745 75.979 18.390 1.00 0.00 O ATOM 36174 H1 WAT 6624 118.964 75.706 17.499 1.00 0.00 H ATOM 36175 H2 WAT 6624 119.554 75.848 18.886 1.00 0.00 H TER 36177 WAT 6624 ATOM 36177 O WAT 6625 104.128 113.757 158.533 1.00 0.00 O ATOM 36178 H1 WAT 6625 103.203 113.982 158.635 1.00 0.00 H ATOM 36179 H2 WAT 6625 104.154 112.804 158.626 1.00 0.00 H TER 36181 WAT 6625 ATOM 36181 O WAT 6626 138.417 119.337 144.710 1.00 0.00 O ATOM 36182 H1 WAT 6626 138.327 118.770 145.476 1.00 0.00 H ATOM 36183 H2 WAT 6626 138.785 120.150 145.057 1.00 0.00 H TER 36185 WAT 6626 ATOM 36185 O WAT 6627 55.553 125.792 77.761 1.00 0.00 O ATOM 36186 H1 WAT 6627 56.038 126.090 76.991 1.00 0.00 H ATOM 36187 H2 WAT 6627 55.681 126.486 78.408 1.00 0.00 H TER 36189 WAT 6627 ATOM 36189 O WAT 6628 17.058 14.406 22.430 1.00 0.00 O ATOM 36190 H1 WAT 6628 16.915 13.544 22.040 1.00 0.00 H ATOM 36191 H2 WAT 6628 17.699 14.253 23.124 1.00 0.00 H TER 36193 WAT 6628 ATOM 36193 O WAT 6629 9.298 70.565 126.638 1.00 0.00 O ATOM 36194 H1 WAT 6629 9.502 71.463 126.898 1.00 0.00 H ATOM 36195 H2 WAT 6629 10.069 70.276 126.149 1.00 0.00 H TER 36197 WAT 6629 ATOM 36197 O WAT 6630 71.370 79.755 139.191 1.00 0.00 O ATOM 36198 H1 WAT 6630 72.073 80.403 139.236 1.00 0.00 H ATOM 36199 H2 WAT 6630 71.391 79.319 140.043 1.00 0.00 H TER 36201 WAT 6630 ATOM 36201 O WAT 6631 118.502 33.639 153.950 1.00 0.00 O ATOM 36202 H1 WAT 6631 118.004 33.628 154.768 1.00 0.00 H ATOM 36203 H2 WAT 6631 118.120 34.360 153.448 1.00 0.00 H TER 36205 WAT 6631 ATOM 36205 O WAT 6632 66.034 79.640 90.887 1.00 0.00 O ATOM 36206 H1 WAT 6632 66.356 79.527 91.781 1.00 0.00 H ATOM 36207 H2 WAT 6632 65.152 79.996 90.993 1.00 0.00 H TER 36209 WAT 6632 ATOM 36209 O WAT 6633 18.259 23.119 125.398 1.00 0.00 O ATOM 36210 H1 WAT 6633 18.851 23.849 125.578 1.00 0.00 H ATOM 36211 H2 WAT 6633 18.089 22.730 126.256 1.00 0.00 H TER 36213 WAT 6633 ATOM 36213 O WAT 6634 52.632 0.676 136.674 1.00 0.00 O ATOM 36214 H1 WAT 6634 52.254 1.405 137.166 1.00 0.00 H ATOM 36215 H2 WAT 6634 51.895 0.305 136.190 1.00 0.00 H TER 36217 WAT 6634 ATOM 36217 O WAT 6635 111.942 31.015 131.772 1.00 0.00 O ATOM 36218 H1 WAT 6635 112.350 31.866 131.609 1.00 0.00 H ATOM 36219 H2 WAT 6635 111.219 31.207 132.368 1.00 0.00 H TER 36221 WAT 6635 ATOM 36221 O WAT 6636 131.954 81.194 2.085 1.00 0.00 O ATOM 36222 H1 WAT 6636 132.299 80.501 1.523 1.00 0.00 H ATOM 36223 H2 WAT 6636 131.384 80.739 2.705 1.00 0.00 H TER 36225 WAT 6636 ATOM 36225 O WAT 6637 132.349 142.806 111.897 1.00 0.00 O ATOM 36226 H1 WAT 6637 132.772 142.170 112.474 1.00 0.00 H ATOM 36227 H2 WAT 6637 132.938 142.876 111.146 1.00 0.00 H TER 36229 WAT 6637 ATOM 36229 O WAT 6638 36.397 141.667 23.158 1.00 0.00 O ATOM 36230 H1 WAT 6638 36.848 141.148 23.824 1.00 0.00 H ATOM 36231 H2 WAT 6638 36.104 141.024 22.512 1.00 0.00 H TER 36233 WAT 6638 ATOM 36233 O WAT 6639 125.455 131.278 146.087 1.00 0.00 O ATOM 36234 H1 WAT 6639 126.110 131.554 146.729 1.00 0.00 H ATOM 36235 H2 WAT 6639 125.049 130.504 146.478 1.00 0.00 H TER 36237 WAT 6639 ATOM 36237 O WAT 6640 24.423 91.874 109.297 1.00 0.00 O ATOM 36238 H1 WAT 6640 24.592 91.640 108.384 1.00 0.00 H ATOM 36239 H2 WAT 6640 25.075 92.547 109.496 1.00 0.00 H TER 36241 WAT 6640 ATOM 36241 O WAT 6641 109.303 127.814 106.797 1.00 0.00 O ATOM 36242 H1 WAT 6641 110.122 127.823 106.302 1.00 0.00 H ATOM 36243 H2 WAT 6641 109.309 126.973 107.255 1.00 0.00 H TER 36245 WAT 6641 ATOM 36245 O WAT 6642 127.487 88.909 89.944 1.00 0.00 O ATOM 36246 H1 WAT 6642 126.899 88.609 89.251 1.00 0.00 H ATOM 36247 H2 WAT 6642 128.326 89.047 89.505 1.00 0.00 H TER 36249 WAT 6642 ATOM 36249 O WAT 6643 9.222 102.777 137.428 1.00 0.00 O ATOM 36250 H1 WAT 6643 9.168 103.723 137.295 1.00 0.00 H ATOM 36251 H2 WAT 6643 8.488 102.422 136.927 1.00 0.00 H TER 36253 WAT 6643 ATOM 36253 O WAT 6644 107.074 112.251 20.031 1.00 0.00 O ATOM 36254 H1 WAT 6644 107.356 112.731 20.809 1.00 0.00 H ATOM 36255 H2 WAT 6644 107.863 111.801 19.728 1.00 0.00 H TER 36257 WAT 6644 ATOM 36257 O WAT 6645 64.259 138.261 96.984 1.00 0.00 O ATOM 36258 H1 WAT 6645 64.601 137.372 97.076 1.00 0.00 H ATOM 36259 H2 WAT 6645 63.750 138.239 96.174 1.00 0.00 H TER 36261 WAT 6645 ATOM 36261 O WAT 6646 105.773 27.777 96.214 1.00 0.00 O ATOM 36262 H1 WAT 6646 106.636 27.892 96.611 1.00 0.00 H ATOM 36263 H2 WAT 6646 105.209 27.508 96.940 1.00 0.00 H TER 36265 WAT 6646 ATOM 36265 O WAT 6647 123.106 77.883 141.684 1.00 0.00 O ATOM 36266 H1 WAT 6647 122.769 76.990 141.750 1.00 0.00 H ATOM 36267 H2 WAT 6647 123.926 77.867 142.178 1.00 0.00 H TER 36269 WAT 6647 ATOM 36269 O WAT 6648 18.831 63.275 80.722 1.00 0.00 O ATOM 36270 H1 WAT 6648 17.874 63.288 80.707 1.00 0.00 H ATOM 36271 H2 WAT 6648 19.078 62.915 79.870 1.00 0.00 H TER 36273 WAT 6648 ATOM 36273 O WAT 6649 52.570 8.823 122.394 1.00 0.00 O ATOM 36274 H1 WAT 6649 52.207 9.600 121.970 1.00 0.00 H ATOM 36275 H2 WAT 6649 52.002 8.107 122.109 1.00 0.00 H TER 36277 WAT 6649 ATOM 36277 O WAT 6650 12.509 69.143 111.939 1.00 0.00 O ATOM 36278 H1 WAT 6650 12.242 69.075 111.022 1.00 0.00 H ATOM 36279 H2 WAT 6650 12.492 68.241 112.260 1.00 0.00 H TER 36281 WAT 6650 ATOM 36281 O WAT 6651 6.533 43.343 154.378 1.00 0.00 O ATOM 36282 H1 WAT 6651 6.340 44.276 154.477 1.00 0.00 H ATOM 36283 H2 WAT 6651 7.371 43.223 154.825 1.00 0.00 H TER 36285 WAT 6651 ATOM 36285 O WAT 6652 48.034 131.682 74.442 1.00 0.00 O ATOM 36286 H1 WAT 6652 48.427 130.848 74.184 1.00 0.00 H ATOM 36287 H2 WAT 6652 48.081 131.682 75.399 1.00 0.00 H TER 36289 WAT 6652 ATOM 36289 O WAT 6653 101.082 53.590 123.087 1.00 0.00 O ATOM 36290 H1 WAT 6653 101.780 54.220 122.909 1.00 0.00 H ATOM 36291 H2 WAT 6653 101.145 53.421 124.027 1.00 0.00 H TER 36293 WAT 6653 ATOM 36293 O WAT 6654 62.339 10.692 88.697 1.00 0.00 O ATOM 36294 H1 WAT 6654 63.249 10.871 88.458 1.00 0.00 H ATOM 36295 H2 WAT 6654 62.331 9.765 88.935 1.00 0.00 H TER 36297 WAT 6654 ATOM 36297 O WAT 6655 98.030 62.582 17.631 1.00 0.00 O ATOM 36298 H1 WAT 6655 98.043 62.383 18.568 1.00 0.00 H ATOM 36299 H2 WAT 6655 98.219 63.519 17.582 1.00 0.00 H TER 36301 WAT 6655 ATOM 36301 O WAT 6656 57.862 112.254 78.418 1.00 0.00 O ATOM 36302 H1 WAT 6656 57.450 111.972 79.235 1.00 0.00 H ATOM 36303 H2 WAT 6656 57.794 111.493 77.841 1.00 0.00 H TER 36305 WAT 6656 ATOM 36305 O WAT 6657 110.228 98.725 156.091 1.00 0.00 O ATOM 36306 H1 WAT 6657 109.756 99.554 156.013 1.00 0.00 H ATOM 36307 H2 WAT 6657 110.370 98.443 155.188 1.00 0.00 H TER 36309 WAT 6657 ATOM 36309 O WAT 6658 19.342 5.649 103.539 1.00 0.00 O ATOM 36310 H1 WAT 6658 19.653 5.218 104.335 1.00 0.00 H ATOM 36311 H2 WAT 6658 18.438 5.895 103.738 1.00 0.00 H TER 36313 WAT 6658 ATOM 36313 O WAT 6659 25.698 127.443 21.699 1.00 0.00 O ATOM 36314 H1 WAT 6659 25.909 126.682 22.239 1.00 0.00 H ATOM 36315 H2 WAT 6659 25.545 127.081 20.825 1.00 0.00 H TER 36317 WAT 6659 ATOM 36317 O WAT 6660 61.049 138.093 99.282 1.00 0.00 O ATOM 36318 H1 WAT 6660 61.181 137.602 100.093 1.00 0.00 H ATOM 36319 H2 WAT 6660 61.736 138.760 99.291 1.00 0.00 H TER 36321 WAT 6660 ATOM 36321 O WAT 6661 138.318 86.410 144.223 1.00 0.00 O ATOM 36322 H1 WAT 6661 137.466 86.652 143.862 1.00 0.00 H ATOM 36323 H2 WAT 6661 138.194 86.439 145.172 1.00 0.00 H TER 36325 WAT 6661 ATOM 36325 O WAT 6662 59.968 57.103 10.419 1.00 0.00 O ATOM 36326 H1 WAT 6662 60.755 56.872 9.925 1.00 0.00 H ATOM 36327 H2 WAT 6662 59.637 56.266 10.746 1.00 0.00 H TER 36329 WAT 6662 ATOM 36329 O WAT 6663 65.268 27.419 8.062 1.00 0.00 O ATOM 36330 H1 WAT 6663 65.306 28.335 8.338 1.00 0.00 H ATOM 36331 H2 WAT 6663 64.438 27.345 7.590 1.00 0.00 H TER 36333 WAT 6663 ATOM 36333 O WAT 6664 135.531 39.794 120.554 1.00 0.00 O ATOM 36334 H1 WAT 6664 135.235 39.703 121.459 1.00 0.00 H ATOM 36335 H2 WAT 6664 135.207 39.008 120.115 1.00 0.00 H TER 36337 WAT 6664 ATOM 36337 O WAT 6665 15.667 20.452 125.394 1.00 0.00 O ATOM 36338 H1 WAT 6665 16.069 20.882 126.149 1.00 0.00 H ATOM 36339 H2 WAT 6665 16.299 20.574 124.685 1.00 0.00 H TER 36341 WAT 6665 ATOM 36341 O WAT 6666 8.515 114.756 133.079 1.00 0.00 O ATOM 36342 H1 WAT 6666 7.569 114.652 132.973 1.00 0.00 H ATOM 36343 H2 WAT 6666 8.731 114.221 133.843 1.00 0.00 H TER 36345 WAT 6666 ATOM 36345 O WAT 6667 111.732 40.146 146.727 1.00 0.00 O ATOM 36346 H1 WAT 6667 111.548 40.036 145.794 1.00 0.00 H ATOM 36347 H2 WAT 6667 111.199 40.897 146.989 1.00 0.00 H TER 36349 WAT 6667 ATOM 36349 O WAT 6668 53.434 43.815 101.392 1.00 0.00 O ATOM 36350 H1 WAT 6668 54.073 43.465 100.770 1.00 0.00 H ATOM 36351 H2 WAT 6668 52.606 43.408 101.139 1.00 0.00 H TER 36353 WAT 6668 ATOM 36353 O WAT 6669 17.360 23.353 6.874 1.00 0.00 O ATOM 36354 H1 WAT 6669 17.835 22.532 6.746 1.00 0.00 H ATOM 36355 H2 WAT 6669 16.908 23.500 6.044 1.00 0.00 H TER 36357 WAT 6669 ATOM 36357 O WAT 6670 74.981 100.527 118.000 1.00 0.00 O ATOM 36358 H1 WAT 6670 74.529 101.141 118.578 1.00 0.00 H ATOM 36359 H2 WAT 6670 75.266 99.819 118.578 1.00 0.00 H TER 36361 WAT 6670 ATOM 36361 O WAT 6671 117.659 133.232 109.635 1.00 0.00 O ATOM 36362 H1 WAT 6671 117.885 134.160 109.579 1.00 0.00 H ATOM 36363 H2 WAT 6671 117.731 133.023 110.567 1.00 0.00 H TER 36365 WAT 6671 ATOM 36365 O WAT 6672 18.528 7.456 116.870 1.00 0.00 O ATOM 36366 H1 WAT 6672 18.610 7.316 117.813 1.00 0.00 H ATOM 36367 H2 WAT 6672 18.781 6.619 116.480 1.00 0.00 H TER 36369 WAT 6672 ATOM 36369 O WAT 6673 118.183 101.930 92.998 1.00 0.00 O ATOM 36370 H1 WAT 6673 119.065 101.598 92.831 1.00 0.00 H ATOM 36371 H2 WAT 6673 117.923 101.515 93.820 1.00 0.00 H TER 36373 WAT 6673 ATOM 36373 O WAT 6674 0.168 84.006 11.156 1.00 0.00 O ATOM 36374 H1 WAT 6674 0.997 83.567 10.964 1.00 0.00 H ATOM 36375 H2 WAT 6674 0.416 84.767 11.680 1.00 0.00 H TER 36377 WAT 6674 ATOM 36377 O WAT 6675 89.545 70.351 106.073 1.00 0.00 O ATOM 36378 H1 WAT 6675 89.481 71.303 106.149 1.00 0.00 H ATOM 36379 H2 WAT 6675 90.249 70.209 105.441 1.00 0.00 H TER 36381 WAT 6675 ATOM 36381 O WAT 6676 14.270 62.014 80.640 1.00 0.00 O ATOM 36382 H1 WAT 6676 14.314 61.405 79.903 1.00 0.00 H ATOM 36383 H2 WAT 6676 13.658 61.606 81.252 1.00 0.00 H TER 36385 WAT 6676 ATOM 36385 O WAT 6677 123.068 43.177 93.562 1.00 0.00 O ATOM 36386 H1 WAT 6677 122.434 42.468 93.667 1.00 0.00 H ATOM 36387 H2 WAT 6677 122.706 43.721 92.863 1.00 0.00 H TER 36389 WAT 6677 ATOM 36389 O WAT 6678 114.409 65.660 77.993 1.00 0.00 O ATOM 36390 H1 WAT 6678 113.767 65.221 78.552 1.00 0.00 H ATOM 36391 H2 WAT 6678 113.901 66.317 77.517 1.00 0.00 H TER 36393 WAT 6678 ATOM 36393 O WAT 6679 77.758 49.703 117.165 1.00 0.00 O ATOM 36394 H1 WAT 6679 78.634 49.919 116.844 1.00 0.00 H ATOM 36395 H2 WAT 6679 77.896 48.968 117.761 1.00 0.00 H TER 36397 WAT 6679 ATOM 36397 O WAT 6680 40.567 118.595 79.843 1.00 0.00 O ATOM 36398 H1 WAT 6680 41.341 118.033 79.806 1.00 0.00 H ATOM 36399 H2 WAT 6680 40.342 118.632 80.772 1.00 0.00 H TER 36401 WAT 6680 ATOM 36401 O WAT 6681 116.744 36.220 74.074 1.00 0.00 O ATOM 36402 H1 WAT 6681 117.027 35.311 74.177 1.00 0.00 H ATOM 36403 H2 WAT 6681 116.438 36.275 73.169 1.00 0.00 H TER 36405 WAT 6681 ATOM 36405 O WAT 6682 119.074 140.860 112.989 1.00 0.00 O ATOM 36406 H1 WAT 6682 118.810 141.286 112.173 1.00 0.00 H ATOM 36407 H2 WAT 6682 118.838 139.941 112.867 1.00 0.00 H TER 36409 WAT 6682 ATOM 36409 O WAT 6683 104.698 110.140 105.048 1.00 0.00 O ATOM 36410 H1 WAT 6683 104.205 109.709 105.746 1.00 0.00 H ATOM 36411 H2 WAT 6683 104.047 110.664 104.583 1.00 0.00 H TER 36413 WAT 6683 ATOM 36413 O WAT 6684 129.416 131.613 94.765 1.00 0.00 O ATOM 36414 H1 WAT 6684 129.687 130.803 94.332 1.00 0.00 H ATOM 36415 H2 WAT 6684 128.733 131.340 95.378 1.00 0.00 H TER 36417 WAT 6684 ATOM 36417 O WAT 6685 79.552 94.213 136.782 1.00 0.00 O ATOM 36418 H1 WAT 6685 79.072 94.952 137.155 1.00 0.00 H ATOM 36419 H2 WAT 6685 80.246 94.617 136.260 1.00 0.00 H TER 36421 WAT 6685 ATOM 36421 O WAT 6686 54.883 65.851 120.755 1.00 0.00 O ATOM 36422 H1 WAT 6686 54.739 65.135 120.136 1.00 0.00 H ATOM 36423 H2 WAT 6686 54.443 66.603 120.358 1.00 0.00 H TER 36425 WAT 6686 ATOM 36425 O WAT 6687 124.699 68.748 16.781 1.00 0.00 O ATOM 36426 H1 WAT 6687 125.480 69.243 16.530 1.00 0.00 H ATOM 36427 H2 WAT 6687 124.174 68.708 15.981 1.00 0.00 H TER 36429 WAT 6687 ATOM 36429 O WAT 6688 7.149 93.201 24.113 1.00 0.00 O ATOM 36430 H1 WAT 6688 7.755 93.437 24.815 1.00 0.00 H ATOM 36431 H2 WAT 6688 6.620 92.493 24.481 1.00 0.00 H TER 36433 WAT 6688 ATOM 36433 O WAT 6689 13.218 115.656 76.183 1.00 0.00 O ATOM 36434 H1 WAT 6689 13.117 115.075 75.429 1.00 0.00 H ATOM 36435 H2 WAT 6689 13.657 116.431 75.831 1.00 0.00 H TER 36437 WAT 6689 ATOM 36437 O WAT 6690 0.156 81.478 97.699 1.00 0.00 O ATOM 36438 H1 WAT 6690 0.371 81.573 98.627 1.00 0.00 H ATOM 36439 H2 WAT 6690 -0.220 82.324 97.453 1.00 0.00 H TER 36441 WAT 6690 ATOM 36441 O WAT 6691 46.371 47.149 125.195 1.00 0.00 O ATOM 36442 H1 WAT 6691 47.088 46.620 124.844 1.00 0.00 H ATOM 36443 H2 WAT 6691 46.125 47.727 124.473 1.00 0.00 H TER 36445 WAT 6691 ATOM 36445 O WAT 6692 122.961 5.358 7.211 1.00 0.00 O ATOM 36446 H1 WAT 6692 122.239 5.152 6.617 1.00 0.00 H ATOM 36447 H2 WAT 6692 123.737 5.363 6.651 1.00 0.00 H TER 36449 WAT 6692 ATOM 36449 O WAT 6693 122.314 65.196 15.790 1.00 0.00 O ATOM 36450 H1 WAT 6693 122.038 65.532 16.643 1.00 0.00 H ATOM 36451 H2 WAT 6693 121.504 65.136 15.283 1.00 0.00 H TER 36453 WAT 6693 ATOM 36453 O WAT 6694 75.605 66.965 23.654 1.00 0.00 O ATOM 36454 H1 WAT 6694 76.064 66.132 23.544 1.00 0.00 H ATOM 36455 H2 WAT 6694 76.190 67.614 23.264 1.00 0.00 H TER 36457 WAT 6694 ATOM 36457 O WAT 6695 29.497 103.857 14.464 1.00 0.00 O ATOM 36458 H1 WAT 6695 29.175 104.056 13.584 1.00 0.00 H ATOM 36459 H2 WAT 6695 29.889 104.676 14.766 1.00 0.00 H TER 36461 WAT 6695 ATOM 36461 O WAT 6696 123.112 38.276 117.488 1.00 0.00 O ATOM 36462 H1 WAT 6696 123.530 37.416 117.456 1.00 0.00 H ATOM 36463 H2 WAT 6696 123.782 38.880 117.168 1.00 0.00 H TER 36465 WAT 6696 ATOM 36465 O WAT 6697 43.733 30.589 93.800 1.00 0.00 O ATOM 36466 H1 WAT 6697 42.965 30.468 94.358 1.00 0.00 H ATOM 36467 H2 WAT 6697 43.380 30.626 92.911 1.00 0.00 H TER 36469 WAT 6697 ATOM 36469 O WAT 6698 32.179 97.961 134.051 1.00 0.00 O ATOM 36470 H1 WAT 6698 32.465 97.104 133.735 1.00 0.00 H ATOM 36471 H2 WAT 6698 32.721 98.587 133.570 1.00 0.00 H TER 36473 WAT 6698 ATOM 36473 O WAT 6699 48.382 21.647 19.596 1.00 0.00 O ATOM 36474 H1 WAT 6699 47.534 22.074 19.720 1.00 0.00 H ATOM 36475 H2 WAT 6699 48.326 20.848 20.120 1.00 0.00 H TER 36477 WAT 6699 ATOM 36477 O WAT 6700 117.901 57.105 66.582 1.00 0.00 O ATOM 36478 H1 WAT 6700 117.825 58.040 66.769 1.00 0.00 H ATOM 36479 H2 WAT 6700 118.193 56.718 67.408 1.00 0.00 H TER 36481 WAT 6700 ATOM 36481 O WAT 6701 111.737 28.847 114.904 1.00 0.00 O ATOM 36482 H1 WAT 6701 111.456 28.593 114.025 1.00 0.00 H ATOM 36483 H2 WAT 6701 110.949 29.203 115.314 1.00 0.00 H TER 36485 WAT 6701 ATOM 36485 O WAT 6702 54.859 10.606 103.525 1.00 0.00 O ATOM 36486 H1 WAT 6702 55.397 9.815 103.564 1.00 0.00 H ATOM 36487 H2 WAT 6702 54.121 10.366 102.964 1.00 0.00 H TER 36489 WAT 6702 ATOM 36489 O WAT 6703 140.109 145.711 7.021 1.00 0.00 O ATOM 36490 H1 WAT 6703 140.018 145.599 6.075 1.00 0.00 H ATOM 36491 H2 WAT 6703 139.371 145.227 7.391 1.00 0.00 H TER 36493 WAT 6703 ATOM 36493 O WAT 6704 65.424 131.562 60.351 1.00 0.00 O ATOM 36494 H1 WAT 6704 65.962 132.353 60.374 1.00 0.00 H ATOM 36495 H2 WAT 6704 64.558 131.853 60.636 1.00 0.00 H TER 36497 WAT 6704 ATOM 36497 O WAT 6705 64.115 129.220 148.403 1.00 0.00 O ATOM 36498 H1 WAT 6705 64.346 128.767 147.592 1.00 0.00 H ATOM 36499 H2 WAT 6705 64.646 128.793 149.075 1.00 0.00 H TER 36501 WAT 6705 ATOM 36501 O WAT 6706 59.835 95.229 56.903 1.00 0.00 O ATOM 36502 H1 WAT 6706 59.854 95.351 55.954 1.00 0.00 H ATOM 36503 H2 WAT 6706 60.312 94.412 57.050 1.00 0.00 H TER 36505 WAT 6706 ATOM 36505 O WAT 6707 99.899 24.845 102.661 1.00 0.00 O ATOM 36506 H1 WAT 6707 100.775 24.955 102.291 1.00 0.00 H ATOM 36507 H2 WAT 6707 99.706 25.687 103.074 1.00 0.00 H TER 36509 WAT 6707 ATOM 36509 O WAT 6708 134.057 62.010 62.404 1.00 0.00 O ATOM 36510 H1 WAT 6708 134.461 62.875 62.330 1.00 0.00 H ATOM 36511 H2 WAT 6708 134.561 61.568 63.087 1.00 0.00 H TER 36513 WAT 6708 ATOM 36513 O WAT 6709 134.753 8.257 10.218 1.00 0.00 O ATOM 36514 H1 WAT 6709 134.114 7.828 10.786 1.00 0.00 H ATOM 36515 H2 WAT 6709 135.436 8.564 10.814 1.00 0.00 H TER 36517 WAT 6709 ATOM 36517 O WAT 6710 64.212 138.733 80.172 1.00 0.00 O ATOM 36518 H1 WAT 6710 64.735 138.008 80.514 1.00 0.00 H ATOM 36519 H2 WAT 6710 64.747 139.511 80.331 1.00 0.00 H TER 36521 WAT 6710 ATOM 36521 O WAT 6711 112.663 32.689 149.625 1.00 0.00 O ATOM 36522 H1 WAT 6711 111.856 32.521 149.139 1.00 0.00 H ATOM 36523 H2 WAT 6711 113.156 31.871 149.560 1.00 0.00 H TER 36525 WAT 6711 ATOM 36525 O WAT 6712 10.912 105.607 154.839 1.00 0.00 O ATOM 36526 H1 WAT 6712 11.648 105.007 154.714 1.00 0.00 H ATOM 36527 H2 WAT 6712 11.269 106.313 155.378 1.00 0.00 H TER 36529 WAT 6712 ATOM 36529 O WAT 6713 94.555 61.277 79.654 1.00 0.00 O ATOM 36530 H1 WAT 6713 95.484 61.049 79.702 1.00 0.00 H ATOM 36531 H2 WAT 6713 94.366 61.311 78.717 1.00 0.00 H TER 36533 WAT 6713 ATOM 36533 O WAT 6714 49.486 75.249 118.723 1.00 0.00 O ATOM 36534 H1 WAT 6714 48.896 74.647 119.176 1.00 0.00 H ATOM 36535 H2 WAT 6714 48.939 76.007 118.514 1.00 0.00 H TER 36537 WAT 6714 ATOM 36537 O WAT 6715 84.926 32.488 66.980 1.00 0.00 O ATOM 36538 H1 WAT 6715 84.085 32.784 66.634 1.00 0.00 H ATOM 36539 H2 WAT 6715 85.474 32.363 66.205 1.00 0.00 H TER 36541 WAT 6715 ATOM 36541 O WAT 6716 84.599 46.873 129.816 1.00 0.00 O ATOM 36542 H1 WAT 6716 85.222 47.170 129.153 1.00 0.00 H ATOM 36543 H2 WAT 6716 83.745 47.153 129.485 1.00 0.00 H TER 36545 WAT 6716 ATOM 36545 O WAT 6717 36.199 143.271 50.514 1.00 0.00 O ATOM 36546 H1 WAT 6717 35.703 143.186 49.700 1.00 0.00 H ATOM 36547 H2 WAT 6717 36.112 142.417 50.938 1.00 0.00 H TER 36549 WAT 6717 ATOM 36549 O WAT 6718 137.177 109.287 148.049 1.00 0.00 O ATOM 36550 H1 WAT 6718 137.725 110.063 147.930 1.00 0.00 H ATOM 36551 H2 WAT 6718 137.800 108.573 148.189 1.00 0.00 H TER 36553 WAT 6718 ATOM 36553 O WAT 6719 65.188 46.887 129.637 1.00 0.00 O ATOM 36554 H1 WAT 6719 65.372 46.162 129.041 1.00 0.00 H ATOM 36555 H2 WAT 6719 65.834 46.792 130.337 1.00 0.00 H TER 36557 WAT 6719 ATOM 36557 O WAT 6720 133.435 41.410 89.679 1.00 0.00 O ATOM 36558 H1 WAT 6720 133.365 42.273 90.088 1.00 0.00 H ATOM 36559 H2 WAT 6720 134.362 41.184 89.754 1.00 0.00 H TER 36561 WAT 6720 ATOM 36561 O WAT 6721 38.819 41.622 75.389 1.00 0.00 O ATOM 36562 H1 WAT 6721 38.475 40.782 75.693 1.00 0.00 H ATOM 36563 H2 WAT 6721 39.531 41.823 75.996 1.00 0.00 H TER 36565 WAT 6721 ATOM 36565 O WAT 6722 63.222 53.353 96.174 1.00 0.00 O ATOM 36566 H1 WAT 6722 63.702 53.016 95.418 1.00 0.00 H ATOM 36567 H2 WAT 6722 62.377 52.904 96.141 1.00 0.00 H TER 36569 WAT 6722 ATOM 36569 O WAT 6723 77.535 11.133 13.363 1.00 0.00 O ATOM 36570 H1 WAT 6723 78.314 10.685 13.691 1.00 0.00 H ATOM 36571 H2 WAT 6723 76.843 10.891 13.979 1.00 0.00 H TER 36573 WAT 6723 ATOM 36573 O WAT 6724 123.672 41.245 127.980 1.00 0.00 O ATOM 36574 H1 WAT 6724 123.542 41.762 127.185 1.00 0.00 H ATOM 36575 H2 WAT 6724 122.817 40.852 128.153 1.00 0.00 H TER 36577 WAT 6724 ATOM 36577 O WAT 6725 12.297 53.385 0.617 1.00 0.00 O ATOM 36578 H1 WAT 6725 12.470 52.456 0.765 1.00 0.00 H ATOM 36579 H2 WAT 6725 13.161 53.797 0.645 1.00 0.00 H TER 36581 WAT 6725 ATOM 36581 O WAT 6726 121.632 111.944 91.192 1.00 0.00 O ATOM 36582 H1 WAT 6726 121.154 112.366 90.478 1.00 0.00 H ATOM 36583 H2 WAT 6726 121.116 112.141 91.974 1.00 0.00 H TER 36585 WAT 6726 ATOM 36585 O WAT 6727 137.775 134.912 134.615 1.00 0.00 O ATOM 36586 H1 WAT 6727 138.039 134.117 135.079 1.00 0.00 H ATOM 36587 H2 WAT 6727 137.134 134.613 133.971 1.00 0.00 H TER 36589 WAT 6727 ATOM 36589 O WAT 6728 86.604 17.096 0.530 1.00 0.00 O ATOM 36590 H1 WAT 6728 86.279 17.672 -0.162 1.00 0.00 H ATOM 36591 H2 WAT 6728 86.769 16.262 0.090 1.00 0.00 H TER 36593 WAT 6728 ATOM 36593 O WAT 6729 106.581 86.324 96.423 1.00 0.00 O ATOM 36594 H1 WAT 6729 105.994 86.692 97.083 1.00 0.00 H ATOM 36595 H2 WAT 6729 106.928 87.085 95.959 1.00 0.00 H TER 36597 WAT 6729 ATOM 36597 O WAT 6730 103.885 108.976 16.127 1.00 0.00 O ATOM 36598 H1 WAT 6730 103.270 109.566 16.564 1.00 0.00 H ATOM 36599 H2 WAT 6730 104.301 108.493 16.841 1.00 0.00 H TER 36601 WAT 6730 ATOM 36601 O WAT 6731 51.847 32.389 103.545 1.00 0.00 O ATOM 36602 H1 WAT 6731 52.256 32.669 102.726 1.00 0.00 H ATOM 36603 H2 WAT 6731 51.081 31.884 103.270 1.00 0.00 H TER 36605 WAT 6731 ATOM 36605 O WAT 6732 4.534 93.653 9.821 1.00 0.00 O ATOM 36606 H1 WAT 6732 4.243 93.469 8.928 1.00 0.00 H ATOM 36607 H2 WAT 6732 4.475 94.605 9.900 1.00 0.00 H TER 36609 WAT 6732 ATOM 36609 O WAT 6733 12.012 20.477 93.712 1.00 0.00 O ATOM 36610 H1 WAT 6733 12.676 19.789 93.686 1.00 0.00 H ATOM 36611 H2 WAT 6733 11.581 20.363 94.559 1.00 0.00 H TER 36613 WAT 6733 ATOM 36613 O WAT 6734 108.787 61.396 135.322 1.00 0.00 O ATOM 36614 H1 WAT 6734 108.350 61.020 136.085 1.00 0.00 H ATOM 36615 H2 WAT 6734 109.225 60.652 134.907 1.00 0.00 H TER 36617 WAT 6734 ATOM 36617 O WAT 6735 40.628 42.203 101.922 1.00 0.00 O ATOM 36618 H1 WAT 6735 41.385 41.620 101.981 1.00 0.00 H ATOM 36619 H2 WAT 6735 40.260 42.207 102.806 1.00 0.00 H TER 36621 WAT 6735 ATOM 36621 O WAT 6736 0.055 134.878 105.232 1.00 0.00 O ATOM 36622 H1 WAT 6736 0.669 134.313 104.764 1.00 0.00 H ATOM 36623 H2 WAT 6736 0.133 135.728 104.799 1.00 0.00 H TER 36625 WAT 6736 ATOM 36625 O WAT 6737 25.929 15.876 142.653 1.00 0.00 O ATOM 36626 H1 WAT 6737 25.367 16.542 143.049 1.00 0.00 H ATOM 36627 H2 WAT 6737 25.380 15.093 142.612 1.00 0.00 H TER 36629 WAT 6737 ATOM 36629 O WAT 6738 25.972 23.617 157.757 1.00 0.00 O ATOM 36630 H1 WAT 6738 25.636 24.456 158.071 1.00 0.00 H ATOM 36631 H2 WAT 6738 26.826 23.826 157.379 1.00 0.00 H TER 36633 WAT 6738 ATOM 36633 O WAT 6739 112.034 43.330 86.442 1.00 0.00 O ATOM 36634 H1 WAT 6739 112.189 42.788 87.216 1.00 0.00 H ATOM 36635 H2 WAT 6739 112.809 43.889 86.382 1.00 0.00 H TER 36637 WAT 6739 ATOM 36637 O WAT 6740 42.555 49.986 12.268 1.00 0.00 O ATOM 36638 H1 WAT 6740 42.446 49.058 12.060 1.00 0.00 H ATOM 36639 H2 WAT 6740 42.187 50.080 13.146 1.00 0.00 H TER 36641 WAT 6740 ATOM 36641 O WAT 6741 97.839 13.202 64.748 1.00 0.00 O ATOM 36642 H1 WAT 6741 98.344 13.941 64.409 1.00 0.00 H ATOM 36643 H2 WAT 6741 98.464 12.709 65.280 1.00 0.00 H TER 36645 WAT 6741 ATOM 36645 O WAT 6742 15.724 110.487 103.029 1.00 0.00 O ATOM 36646 H1 WAT 6742 15.838 111.134 102.333 1.00 0.00 H ATOM 36647 H2 WAT 6742 15.386 110.989 103.770 1.00 0.00 H TER 36649 WAT 6742 ATOM 36649 O WAT 6743 139.720 51.335 10.567 1.00 0.00 O ATOM 36650 H1 WAT 6743 140.169 51.729 11.315 1.00 0.00 H ATOM 36651 H2 WAT 6743 139.640 50.409 10.796 1.00 0.00 H TER 36653 WAT 6743 ATOM 36653 O WAT 6744 42.068 72.361 126.383 1.00 0.00 O ATOM 36654 H1 WAT 6744 42.942 72.748 126.328 1.00 0.00 H ATOM 36655 H2 WAT 6744 41.902 72.276 127.322 1.00 0.00 H TER 36657 WAT 6744 ATOM 36657 O WAT 6745 40.418 38.446 27.208 1.00 0.00 O ATOM 36658 H1 WAT 6745 40.486 38.828 26.333 1.00 0.00 H ATOM 36659 H2 WAT 6745 39.746 37.770 27.123 1.00 0.00 H TER 36661 WAT 6745 ATOM 36661 O WAT 6746 116.171 146.081 153.254 1.00 0.00 O ATOM 36662 H1 WAT 6746 116.165 145.124 153.256 1.00 0.00 H ATOM 36663 H2 WAT 6746 117.033 146.316 153.598 1.00 0.00 H TER 36665 WAT 6746 ATOM 36665 O WAT 6747 97.953 18.961 73.097 1.00 0.00 O ATOM 36666 H1 WAT 6747 97.171 18.565 72.712 1.00 0.00 H ATOM 36667 H2 WAT 6747 98.647 18.320 72.943 1.00 0.00 H TER 36669 WAT 6747 ATOM 36669 O WAT 6748 41.425 63.773 22.576 1.00 0.00 O ATOM 36670 H1 WAT 6748 41.150 64.589 22.159 1.00 0.00 H ATOM 36671 H2 WAT 6748 40.626 63.421 22.967 1.00 0.00 H TER 36673 WAT 6748 ATOM 36673 O WAT 6749 5.041 100.563 89.484 1.00 0.00 O ATOM 36674 H1 WAT 6749 4.353 99.898 89.512 1.00 0.00 H ATOM 36675 H2 WAT 6749 5.856 100.063 89.441 1.00 0.00 H TER 36677 WAT 6749 ATOM 36677 O WAT 6750 87.438 113.487 3.863 1.00 0.00 O ATOM 36678 H1 WAT 6750 87.930 113.287 3.066 1.00 0.00 H ATOM 36679 H2 WAT 6750 86.521 113.370 3.614 1.00 0.00 H TER 36681 WAT 6750 ATOM 36681 O WAT 6751 28.270 4.411 117.672 1.00 0.00 O ATOM 36682 H1 WAT 6751 27.364 4.110 117.741 1.00 0.00 H ATOM 36683 H2 WAT 6751 28.224 5.182 117.107 1.00 0.00 H TER 36685 WAT 6751 ATOM 36685 O WAT 6752 56.468 70.716 62.322 1.00 0.00 O ATOM 36686 H1 WAT 6752 57.184 71.314 62.109 1.00 0.00 H ATOM 36687 H2 WAT 6752 56.504 70.046 61.640 1.00 0.00 H TER 36689 WAT 6752 ATOM 36689 O WAT 6753 31.404 43.381 113.278 1.00 0.00 O ATOM 36690 H1 WAT 6753 31.953 43.997 113.763 1.00 0.00 H ATOM 36691 H2 WAT 6753 31.298 43.782 112.415 1.00 0.00 H TER 36693 WAT 6753 ATOM 36693 O WAT 6754 54.317 118.432 131.675 1.00 0.00 O ATOM 36694 H1 WAT 6754 53.678 118.036 131.083 1.00 0.00 H ATOM 36695 H2 WAT 6754 53.999 119.325 131.808 1.00 0.00 H TER 36697 WAT 6754 ATOM 36697 O WAT 6755 32.806 145.085 130.651 1.00 0.00 O ATOM 36698 H1 WAT 6755 32.107 145.487 130.134 1.00 0.00 H ATOM 36699 H2 WAT 6755 32.879 145.640 131.427 1.00 0.00 H TER 36701 WAT 6755 ATOM 36701 O WAT 6756 12.939 106.684 21.290 1.00 0.00 O ATOM 36702 H1 WAT 6756 13.700 106.341 21.758 1.00 0.00 H ATOM 36703 H2 WAT 6756 12.296 105.976 21.328 1.00 0.00 H TER 36705 WAT 6756 ATOM 36705 O WAT 6757 101.518 78.527 108.491 1.00 0.00 O ATOM 36706 H1 WAT 6757 100.693 79.005 108.577 1.00 0.00 H ATOM 36707 H2 WAT 6757 101.414 77.765 109.060 1.00 0.00 H TER 36709 WAT 6757 ATOM 36709 O WAT 6758 70.120 72.463 69.679 1.00 0.00 O ATOM 36710 H1 WAT 6758 69.633 72.078 68.950 1.00 0.00 H ATOM 36711 H2 WAT 6758 70.910 72.823 69.275 1.00 0.00 H TER 36713 WAT 6758 ATOM 36713 O WAT 6759 110.097 3.483 121.482 1.00 0.00 O ATOM 36714 H1 WAT 6759 109.371 3.222 122.049 1.00 0.00 H ATOM 36715 H2 WAT 6759 110.801 3.715 122.087 1.00 0.00 H TER 36717 WAT 6759 ATOM 36717 O WAT 6760 57.740 21.467 2.866 1.00 0.00 O ATOM 36718 H1 WAT 6760 58.627 21.486 3.225 1.00 0.00 H ATOM 36719 H2 WAT 6760 57.752 22.114 2.161 1.00 0.00 H TER 36721 WAT 6760 ATOM 36721 O WAT 6761 124.879 40.556 90.533 1.00 0.00 O ATOM 36722 H1 WAT 6761 125.647 40.028 90.315 1.00 0.00 H ATOM 36723 H2 WAT 6761 124.217 39.917 90.799 1.00 0.00 H TER 36725 WAT 6761 ATOM 36725 O WAT 6762 21.327 49.355 5.950 1.00 0.00 O ATOM 36726 H1 WAT 6762 21.675 50.060 6.496 1.00 0.00 H ATOM 36727 H2 WAT 6762 21.746 49.482 5.099 1.00 0.00 H TER 36729 WAT 6762 ATOM 36729 O WAT 6763 83.208 34.964 123.740 1.00 0.00 O ATOM 36730 H1 WAT 6763 83.888 35.591 123.987 1.00 0.00 H ATOM 36731 H2 WAT 6763 83.409 34.180 124.252 1.00 0.00 H TER 36733 WAT 6763 ATOM 36733 O WAT 6764 29.384 0.978 94.809 1.00 0.00 O ATOM 36734 H1 WAT 6764 30.006 1.698 94.711 1.00 0.00 H ATOM 36735 H2 WAT 6764 29.917 0.238 95.101 1.00 0.00 H TER 36737 WAT 6764 ATOM 36737 O WAT 6765 80.771 2.585 109.023 1.00 0.00 O ATOM 36738 H1 WAT 6765 80.707 1.664 109.275 1.00 0.00 H ATOM 36739 H2 WAT 6765 81.685 2.698 108.761 1.00 0.00 H TER 36741 WAT 6765 ATOM 36741 O WAT 6766 97.939 22.645 8.197 1.00 0.00 O ATOM 36742 H1 WAT 6766 98.575 22.145 7.686 1.00 0.00 H ATOM 36743 H2 WAT 6766 98.053 23.549 7.904 1.00 0.00 H TER 36745 WAT 6766 ATOM 36745 O WAT 6767 83.232 59.430 105.425 1.00 0.00 O ATOM 36746 H1 WAT 6767 84.003 59.987 105.317 1.00 0.00 H ATOM 36747 H2 WAT 6767 83.229 59.203 106.355 1.00 0.00 H TER 36749 WAT 6767 ATOM 36749 O WAT 6768 20.472 113.428 139.834 1.00 0.00 O ATOM 36750 H1 WAT 6768 20.209 114.348 139.791 1.00 0.00 H ATOM 36751 H2 WAT 6768 21.076 113.317 139.100 1.00 0.00 H TER 36753 WAT 6768 ATOM 36753 O WAT 6769 139.009 98.871 87.908 1.00 0.00 O ATOM 36754 H1 WAT 6769 138.503 99.147 88.672 1.00 0.00 H ATOM 36755 H2 WAT 6769 138.548 98.099 87.581 1.00 0.00 H TER 36757 WAT 6769 ATOM 36757 O WAT 6770 143.635 142.779 78.609 1.00 0.00 O ATOM 36758 H1 WAT 6770 143.350 141.902 78.352 1.00 0.00 H ATOM 36759 H2 WAT 6770 143.783 142.716 79.552 1.00 0.00 H TER 36761 WAT 6770 ATOM 36761 O WAT 6771 40.926 66.437 83.597 1.00 0.00 O ATOM 36762 H1 WAT 6771 40.868 65.667 83.031 1.00 0.00 H ATOM 36763 H2 WAT 6771 40.943 67.178 82.991 1.00 0.00 H TER 36765 WAT 6771 ATOM 36765 O WAT 6772 32.316 19.157 146.112 1.00 0.00 O ATOM 36766 H1 WAT 6772 32.483 18.222 146.227 1.00 0.00 H ATOM 36767 H2 WAT 6772 32.049 19.241 145.196 1.00 0.00 H TER 36769 WAT 6772 ATOM 36769 O WAT 6773 1.964 145.655 133.799 1.00 0.00 O ATOM 36770 H1 WAT 6773 1.081 145.526 134.144 1.00 0.00 H ATOM 36771 H2 WAT 6773 2.509 145.052 134.306 1.00 0.00 H TER 36773 WAT 6773 ATOM 36773 O WAT 6774 134.778 39.133 132.274 1.00 0.00 O ATOM 36774 H1 WAT 6774 134.003 39.339 132.797 1.00 0.00 H ATOM 36775 H2 WAT 6774 135.020 38.247 132.543 1.00 0.00 H TER 36777 WAT 6774 ATOM 36777 O WAT 6775 5.297 40.225 141.637 1.00 0.00 O ATOM 36778 H1 WAT 6775 4.521 40.785 141.675 1.00 0.00 H ATOM 36779 H2 WAT 6775 5.844 40.524 142.363 1.00 0.00 H TER 36781 WAT 6775 ATOM 36781 O WAT 6776 85.828 84.110 105.452 1.00 0.00 O ATOM 36782 H1 WAT 6776 86.767 84.271 105.541 1.00 0.00 H ATOM 36783 H2 WAT 6776 85.469 84.946 105.154 1.00 0.00 H TER 36785 WAT 6776 ATOM 36785 O WAT 6777 104.386 98.415 82.034 1.00 0.00 O ATOM 36786 H1 WAT 6777 103.619 98.182 82.557 1.00 0.00 H ATOM 36787 H2 WAT 6777 104.291 97.904 81.230 1.00 0.00 H TER 36789 WAT 6777 ATOM 36789 O WAT 6778 87.591 140.183 71.258 1.00 0.00 O ATOM 36790 H1 WAT 6778 86.808 140.251 71.804 1.00 0.00 H ATOM 36791 H2 WAT 6778 87.716 141.065 70.907 1.00 0.00 H TER 36793 WAT 6778 ATOM 36793 O WAT 6779 104.627 81.171 107.990 1.00 0.00 O ATOM 36794 H1 WAT 6779 104.893 81.528 107.142 1.00 0.00 H ATOM 36795 H2 WAT 6779 105.450 81.023 108.456 1.00 0.00 H TER 36797 WAT 6779 ATOM 36797 O WAT 6780 14.956 139.855 57.279 1.00 0.00 O ATOM 36798 H1 WAT 6780 14.282 139.471 57.838 1.00 0.00 H ATOM 36799 H2 WAT 6780 14.470 140.252 56.556 1.00 0.00 H TER 36801 WAT 6780 ATOM 36801 O WAT 6781 12.646 57.891 136.687 1.00 0.00 O ATOM 36802 H1 WAT 6781 13.445 57.909 136.160 1.00 0.00 H ATOM 36803 H2 WAT 6781 12.031 58.448 136.209 1.00 0.00 H TER 36805 WAT 6781 ATOM 36805 O WAT 6782 51.068 29.696 11.030 1.00 0.00 O ATOM 36806 H1 WAT 6782 50.535 29.254 10.369 1.00 0.00 H ATOM 36807 H2 WAT 6782 50.954 30.628 10.843 1.00 0.00 H TER 36809 WAT 6782 ATOM 36809 O WAT 6783 0.414 78.312 94.438 1.00 0.00 O ATOM 36810 H1 WAT 6783 -0.354 78.056 94.948 1.00 0.00 H ATOM 36811 H2 WAT 6783 0.230 79.209 94.161 1.00 0.00 H TER 36813 WAT 6783 ATOM 36813 O WAT 6784 25.840 119.591 101.043 1.00 0.00 O ATOM 36814 H1 WAT 6784 25.685 120.421 101.494 1.00 0.00 H ATOM 36815 H2 WAT 6784 25.536 119.745 100.148 1.00 0.00 H TER 36817 WAT 6784 ATOM 36817 O WAT 6785 33.580 0.122 117.156 1.00 0.00 O ATOM 36818 H1 WAT 6785 34.327 0.305 117.726 1.00 0.00 H ATOM 36819 H2 WAT 6785 33.971 -0.207 116.347 1.00 0.00 H TER 36821 WAT 6785 ATOM 36821 O WAT 6786 79.934 139.858 102.775 1.00 0.00 O ATOM 36822 H1 WAT 6786 79.449 139.451 102.056 1.00 0.00 H ATOM 36823 H2 WAT 6786 79.340 139.805 103.524 1.00 0.00 H TER 36825 WAT 6786 ATOM 36825 O WAT 6787 79.605 40.705 103.051 1.00 0.00 O ATOM 36826 H1 WAT 6787 80.433 41.169 102.928 1.00 0.00 H ATOM 36827 H2 WAT 6787 79.795 40.049 103.721 1.00 0.00 H TER 36829 WAT 6787 ATOM 36829 O WAT 6788 58.815 104.160 122.495 1.00 0.00 O ATOM 36830 H1 WAT 6788 58.045 104.295 123.049 1.00 0.00 H ATOM 36831 H2 WAT 6788 59.551 104.448 123.035 1.00 0.00 H TER 36833 WAT 6788 ATOM 36833 O WAT 6789 25.712 114.018 135.634 1.00 0.00 O ATOM 36834 H1 WAT 6789 25.941 113.768 136.529 1.00 0.00 H ATOM 36835 H2 WAT 6789 26.485 113.790 135.116 1.00 0.00 H TER 36837 WAT 6789 ATOM 36837 O WAT 6790 107.888 111.503 122.216 1.00 0.00 O ATOM 36838 H1 WAT 6790 107.725 112.393 122.528 1.00 0.00 H ATOM 36839 H2 WAT 6790 107.234 111.365 121.532 1.00 0.00 H TER 36841 WAT 6790 ATOM 36841 O WAT 6791 35.147 116.208 117.454 1.00 0.00 O ATOM 36842 H1 WAT 6791 34.269 116.477 117.186 1.00 0.00 H ATOM 36843 H2 WAT 6791 35.515 116.982 117.882 1.00 0.00 H TER 36845 WAT 6791 ATOM 36845 O WAT 6792 69.727 8.990 69.762 1.00 0.00 O ATOM 36846 H1 WAT 6792 70.051 9.137 68.873 1.00 0.00 H ATOM 36847 H2 WAT 6792 70.320 9.494 70.320 1.00 0.00 H TER 36849 WAT 6792 ATOM 36849 O WAT 6793 115.670 128.116 80.096 1.00 0.00 O ATOM 36850 H1 WAT 6793 115.188 128.314 80.899 1.00 0.00 H ATOM 36851 H2 WAT 6793 116.167 127.324 80.304 1.00 0.00 H TER 36853 WAT 6793 ATOM 36853 O WAT 6794 117.985 96.933 119.161 1.00 0.00 O ATOM 36854 H1 WAT 6794 117.834 97.472 118.385 1.00 0.00 H ATOM 36855 H2 WAT 6794 118.777 97.298 119.556 1.00 0.00 H TER 36857 WAT 6794 ATOM 36857 O WAT 6795 16.622 62.763 16.398 1.00 0.00 O ATOM 36858 H1 WAT 6795 17.274 62.946 17.075 1.00 0.00 H ATOM 36859 H2 WAT 6795 16.189 63.604 16.248 1.00 0.00 H TER 36861 WAT 6795 ATOM 36861 O WAT 6796 32.570 33.069 61.348 1.00 0.00 O ATOM 36862 H1 WAT 6796 32.871 33.075 60.439 1.00 0.00 H ATOM 36863 H2 WAT 6796 33.370 32.970 61.864 1.00 0.00 H TER 36865 WAT 6796 ATOM 36865 O WAT 6797 127.991 0.650 63.698 1.00 0.00 O ATOM 36866 H1 WAT 6797 127.505 1.456 63.875 1.00 0.00 H ATOM 36867 H2 WAT 6797 127.484 -0.036 64.131 1.00 0.00 H TER 36869 WAT 6797 ATOM 36869 O WAT 6798 74.428 138.275 23.473 1.00 0.00 O ATOM 36870 H1 WAT 6798 74.274 138.775 24.275 1.00 0.00 H ATOM 36871 H2 WAT 6798 73.994 138.783 22.787 1.00 0.00 H TER 36873 WAT 6798 ATOM 36873 O WAT 6799 15.107 14.124 114.035 1.00 0.00 O ATOM 36874 H1 WAT 6799 14.740 13.452 113.461 1.00 0.00 H ATOM 36875 H2 WAT 6799 14.867 14.952 113.619 1.00 0.00 H TER 36877 WAT 6799 ATOM 36877 O WAT 6800 99.932 100.363 145.039 1.00 0.00 O ATOM 36878 H1 WAT 6800 100.353 99.655 144.550 1.00 0.00 H ATOM 36879 H2 WAT 6800 100.425 100.415 145.858 1.00 0.00 H TER 36881 WAT 6800 ATOM 36881 O WAT 6801 126.716 103.753 87.040 1.00 0.00 O ATOM 36882 H1 WAT 6801 126.526 102.818 87.117 1.00 0.00 H ATOM 36883 H2 WAT 6801 125.998 104.182 87.505 1.00 0.00 H TER 36885 WAT 6801 ATOM 36885 O WAT 6802 2.575 9.316 3.466 1.00 0.00 O ATOM 36886 H1 WAT 6802 2.279 10.209 3.289 1.00 0.00 H ATOM 36887 H2 WAT 6802 2.487 9.219 4.414 1.00 0.00 H TER 36889 WAT 6802 ATOM 36889 O WAT 6803 89.633 43.905 108.792 1.00 0.00 O ATOM 36890 H1 WAT 6803 89.359 43.051 109.124 1.00 0.00 H ATOM 36891 H2 WAT 6803 88.861 44.461 108.894 1.00 0.00 H TER 36893 WAT 6803 ATOM 36893 O WAT 6804 36.527 49.544 87.115 1.00 0.00 O ATOM 36894 H1 WAT 6804 36.568 48.815 87.734 1.00 0.00 H ATOM 36895 H2 WAT 6804 37.311 49.445 86.576 1.00 0.00 H TER 36897 WAT 6804 ATOM 36897 O WAT 6805 65.543 24.317 73.812 1.00 0.00 O ATOM 36898 H1 WAT 6805 65.430 23.686 74.524 1.00 0.00 H ATOM 36899 H2 WAT 6805 66.469 24.250 73.578 1.00 0.00 H TER 36901 WAT 6805 ATOM 36901 O WAT 6806 68.079 111.984 111.679 1.00 0.00 O ATOM 36902 H1 WAT 6806 68.833 111.809 111.117 1.00 0.00 H ATOM 36903 H2 WAT 6806 68.402 112.611 112.326 1.00 0.00 H TER 36905 WAT 6806 ATOM 36905 O WAT 6807 116.429 89.840 70.410 1.00 0.00 O ATOM 36906 H1 WAT 6807 117.223 89.522 69.979 1.00 0.00 H ATOM 36907 H2 WAT 6807 116.644 89.834 71.343 1.00 0.00 H TER 36909 WAT 6807 ATOM 36909 O WAT 6808 127.261 38.679 130.600 1.00 0.00 O ATOM 36910 H1 WAT 6808 126.869 38.258 131.366 1.00 0.00 H ATOM 36911 H2 WAT 6808 126.535 38.781 129.985 1.00 0.00 H TER 36913 WAT 6808 ATOM 36913 O WAT 6809 75.912 43.184 98.902 1.00 0.00 O ATOM 36914 H1 WAT 6809 76.751 43.633 98.798 1.00 0.00 H ATOM 36915 H2 WAT 6809 75.631 42.992 98.007 1.00 0.00 H TER 36917 WAT 6809 ATOM 36917 O WAT 6810 67.176 138.183 147.485 1.00 0.00 O ATOM 36918 H1 WAT 6810 67.059 138.944 146.917 1.00 0.00 H ATOM 36919 H2 WAT 6810 68.124 138.055 147.521 1.00 0.00 H TER 36921 WAT 6810 ATOM 36921 O WAT 6811 3.962 31.755 83.030 1.00 0.00 O ATOM 36922 H1 WAT 6811 4.661 32.106 82.478 1.00 0.00 H ATOM 36923 H2 WAT 6811 4.401 31.124 83.600 1.00 0.00 H TER 36925 WAT 6811 ATOM 36925 O WAT 6812 128.452 142.529 155.967 1.00 0.00 O ATOM 36926 H1 WAT 6812 127.834 143.255 156.054 1.00 0.00 H ATOM 36927 H2 WAT 6812 129.298 142.903 156.216 1.00 0.00 H TER 36929 WAT 6812 ATOM 36929 O WAT 6813 45.679 60.576 6.126 1.00 0.00 O ATOM 36930 H1 WAT 6813 46.381 61.139 5.797 1.00 0.00 H ATOM 36931 H2 WAT 6813 46.057 60.147 6.893 1.00 0.00 H TER 36933 WAT 6813 ATOM 36933 O WAT 6814 137.229 68.680 3.375 1.00 0.00 O ATOM 36934 H1 WAT 6814 137.642 68.261 2.620 1.00 0.00 H ATOM 36935 H2 WAT 6814 136.297 68.485 3.276 1.00 0.00 H TER 36937 WAT 6814 ATOM 36937 O WAT 6815 38.861 100.566 85.106 1.00 0.00 O ATOM 36938 H1 WAT 6815 38.443 100.712 84.257 1.00 0.00 H ATOM 36939 H2 WAT 6815 38.136 100.378 85.702 1.00 0.00 H TER 36941 WAT 6815 ATOM 36941 O WAT 6816 141.442 21.646 88.450 1.00 0.00 O ATOM 36942 H1 WAT 6816 141.178 20.742 88.280 1.00 0.00 H ATOM 36943 H2 WAT 6816 142.121 21.823 87.799 1.00 0.00 H TER 36945 WAT 6816 ATOM 36945 O WAT 6817 24.867 44.264 155.254 1.00 0.00 O ATOM 36946 H1 WAT 6817 25.282 43.403 155.317 1.00 0.00 H ATOM 36947 H2 WAT 6817 25.142 44.721 156.048 1.00 0.00 H TER 36949 WAT 6817 ATOM 36949 O WAT 6818 49.812 101.339 93.724 1.00 0.00 O ATOM 36950 H1 WAT 6818 49.877 102.025 94.388 1.00 0.00 H ATOM 36951 H2 WAT 6818 50.680 100.936 93.711 1.00 0.00 H TER 36953 WAT 6818 ATOM 36953 O WAT 6819 121.883 90.459 101.978 1.00 0.00 O ATOM 36954 H1 WAT 6819 121.179 91.107 101.988 1.00 0.00 H ATOM 36955 H2 WAT 6819 121.760 89.984 101.156 1.00 0.00 H TER 36957 WAT 6819 ATOM 36957 O WAT 6820 113.079 108.854 131.325 1.00 0.00 O ATOM 36958 H1 WAT 6820 113.884 109.243 130.982 1.00 0.00 H ATOM 36959 H2 WAT 6820 113.293 107.929 131.445 1.00 0.00 H TER 36961 WAT 6820 ATOM 36961 O WAT 6821 85.671 141.406 132.797 1.00 0.00 O ATOM 36962 H1 WAT 6821 85.405 142.323 132.867 1.00 0.00 H ATOM 36963 H2 WAT 6821 86.204 141.371 132.003 1.00 0.00 H TER 36965 WAT 6821 ATOM 36965 O WAT 6822 101.494 4.858 56.873 1.00 0.00 O ATOM 36966 H1 WAT 6822 102.032 4.913 56.083 1.00 0.00 H ATOM 36967 H2 WAT 6822 100.779 5.475 56.720 1.00 0.00 H TER 36969 WAT 6822 ATOM 36969 O WAT 6823 23.788 7.047 69.850 1.00 0.00 O ATOM 36970 H1 WAT 6823 23.157 7.407 69.227 1.00 0.00 H ATOM 36971 H2 WAT 6823 24.637 7.157 69.421 1.00 0.00 H TER 36973 WAT 6823 ATOM 36973 O WAT 6824 103.260 99.046 27.573 1.00 0.00 O ATOM 36974 H1 WAT 6824 102.325 98.862 27.658 1.00 0.00 H ATOM 36975 H2 WAT 6824 103.691 98.273 27.938 1.00 0.00 H TER 36977 WAT 6824 ATOM 36977 O WAT 6825 106.839 88.387 111.496 1.00 0.00 O ATOM 36978 H1 WAT 6825 107.586 88.738 111.012 1.00 0.00 H ATOM 36979 H2 WAT 6825 106.240 88.076 110.817 1.00 0.00 H TER 36981 WAT 6825 ATOM 36981 O WAT 6826 55.275 141.106 136.149 1.00 0.00 O ATOM 36982 H1 WAT 6826 55.641 140.798 136.977 1.00 0.00 H ATOM 36983 H2 WAT 6826 55.634 140.511 135.491 1.00 0.00 H TER 36985 WAT 6826 ATOM 36985 O WAT 6827 112.737 135.030 129.820 1.00 0.00 O ATOM 36986 H1 WAT 6827 113.553 134.687 130.184 1.00 0.00 H ATOM 36987 H2 WAT 6827 112.576 135.836 130.310 1.00 0.00 H TER 36989 WAT 6827 ATOM 36989 O WAT 6828 119.513 81.395 64.087 1.00 0.00 O ATOM 36990 H1 WAT 6828 119.715 81.262 63.161 1.00 0.00 H ATOM 36991 H2 WAT 6828 119.722 80.557 64.501 1.00 0.00 H TER 36993 WAT 6828 ATOM 36993 O WAT 6829 14.106 66.124 10.335 1.00 0.00 O ATOM 36994 H1 WAT 6829 14.415 65.403 9.787 1.00 0.00 H ATOM 36995 H2 WAT 6829 13.396 65.745 10.853 1.00 0.00 H TER 36997 WAT 6829 ATOM 36997 O WAT 6830 14.945 58.185 99.182 1.00 0.00 O ATOM 36998 H1 WAT 6830 14.727 57.539 98.510 1.00 0.00 H ATOM 36999 H2 WAT 6830 14.341 58.910 99.022 1.00 0.00 H TER 37001 WAT 6830 ATOM 37001 O WAT 6831 7.549 81.129 70.313 1.00 0.00 O ATOM 37002 H1 WAT 6831 7.647 80.283 70.751 1.00 0.00 H ATOM 37003 H2 WAT 6831 6.649 81.127 69.987 1.00 0.00 H TER 37005 WAT 6831 ATOM 37005 O WAT 6832 104.385 4.757 66.209 1.00 0.00 O ATOM 37006 H1 WAT 6832 104.448 5.064 65.305 1.00 0.00 H ATOM 37007 H2 WAT 6832 105.169 5.102 66.635 1.00 0.00 H TER 37009 WAT 6832 ATOM 37009 O WAT 6833 17.525 119.247 137.700 1.00 0.00 O ATOM 37010 H1 WAT 6833 17.669 120.097 137.285 1.00 0.00 H ATOM 37011 H2 WAT 6833 16.590 119.078 137.581 1.00 0.00 H TER 37013 WAT 6833 ATOM 37013 O WAT 6834 26.064 2.012 145.963 1.00 0.00 O ATOM 37014 H1 WAT 6834 26.087 2.368 145.075 1.00 0.00 H ATOM 37015 H2 WAT 6834 25.171 2.178 146.264 1.00 0.00 H TER 37017 WAT 6834 ATOM 37017 O WAT 6835 144.343 33.700 14.399 1.00 0.00 O ATOM 37018 H1 WAT 6835 144.172 33.737 13.458 1.00 0.00 H ATOM 37019 H2 WAT 6835 143.846 32.941 14.704 1.00 0.00 H TER 37021 WAT 6835 ATOM 37021 O WAT 6836 32.654 46.737 80.595 1.00 0.00 O ATOM 37022 H1 WAT 6836 32.257 46.386 81.392 1.00 0.00 H ATOM 37023 H2 WAT 6836 33.590 46.565 80.698 1.00 0.00 H TER 37025 WAT 6836 ATOM 37025 O WAT 6837 128.790 76.836 104.467 1.00 0.00 O ATOM 37026 H1 WAT 6837 129.317 77.480 104.941 1.00 0.00 H ATOM 37027 H2 WAT 6837 129.177 76.809 103.591 1.00 0.00 H TER 37029 WAT 6837 ATOM 37029 O WAT 6838 108.530 79.483 113.228 1.00 0.00 O ATOM 37030 H1 WAT 6838 107.874 79.793 113.853 1.00 0.00 H ATOM 37031 H2 WAT 6838 109.369 79.699 113.635 1.00 0.00 H TER 37033 WAT 6838 ATOM 37033 O WAT 6839 144.649 133.238 5.347 1.00 0.00 O ATOM 37034 H1 WAT 6839 144.191 132.489 5.729 1.00 0.00 H ATOM 37035 H2 WAT 6839 144.060 133.555 4.662 1.00 0.00 H TER 37037 WAT 6839 ATOM 37037 O WAT 6840 43.430 45.629 152.253 1.00 0.00 O ATOM 37038 H1 WAT 6840 44.374 45.600 152.095 1.00 0.00 H ATOM 37039 H2 WAT 6840 43.321 46.304 152.923 1.00 0.00 H TER 37041 WAT 6840 ATOM 37041 O WAT 6841 100.627 25.626 142.229 1.00 0.00 O ATOM 37042 H1 WAT 6841 99.794 25.649 141.757 1.00 0.00 H ATOM 37043 H2 WAT 6841 101.278 25.428 141.557 1.00 0.00 H TER 37045 WAT 6841 ATOM 37045 O WAT 6842 27.675 46.127 84.053 1.00 0.00 O ATOM 37046 H1 WAT 6842 28.497 46.423 83.664 1.00 0.00 H ATOM 37047 H2 WAT 6842 27.652 45.186 83.878 1.00 0.00 H TER 37049 WAT 6842 ATOM 37049 O WAT 6843 79.876 83.222 4.336 1.00 0.00 O ATOM 37050 H1 WAT 6843 79.891 82.290 4.552 1.00 0.00 H ATOM 37051 H2 WAT 6843 78.989 83.378 4.012 1.00 0.00 H TER 37053 WAT 6843 ATOM 37053 O WAT 6844 119.635 17.634 139.722 1.00 0.00 O ATOM 37054 H1 WAT 6844 119.105 16.871 139.492 1.00 0.00 H ATOM 37055 H2 WAT 6844 119.014 18.363 139.728 1.00 0.00 H TER 37057 WAT 6844 ATOM 37057 O WAT 6845 110.614 27.415 136.258 1.00 0.00 O ATOM 37058 H1 WAT 6845 110.059 28.186 136.141 1.00 0.00 H ATOM 37059 H2 WAT 6845 110.797 27.113 135.368 1.00 0.00 H TER 37061 WAT 6845 ATOM 37061 O WAT 6846 101.034 52.008 135.937 1.00 0.00 O ATOM 37062 H1 WAT 6846 100.404 51.337 136.200 1.00 0.00 H ATOM 37063 H2 WAT 6846 100.958 52.049 134.984 1.00 0.00 H TER 37065 WAT 6846 ATOM 37065 O WAT 6847 28.914 62.969 114.180 1.00 0.00 O ATOM 37066 H1 WAT 6847 28.327 63.714 114.306 1.00 0.00 H ATOM 37067 H2 WAT 6847 29.784 63.311 114.384 1.00 0.00 H TER 37069 WAT 6847 ATOM 37069 O WAT 6848 0.802 105.971 22.024 1.00 0.00 O ATOM 37070 H1 WAT 6848 0.116 106.084 22.682 1.00 0.00 H ATOM 37071 H2 WAT 6848 1.050 105.049 22.093 1.00 0.00 H TER 37073 WAT 6848 ATOM 37073 O WAT 6849 128.425 94.144 94.159 1.00 0.00 O ATOM 37074 H1 WAT 6849 128.529 93.344 93.643 1.00 0.00 H ATOM 37075 H2 WAT 6849 129.113 94.727 93.837 1.00 0.00 H TER 37077 WAT 6849 ATOM 37077 O WAT 6850 92.586 31.210 146.161 1.00 0.00 O ATOM 37078 H1 WAT 6850 92.211 30.524 146.713 1.00 0.00 H ATOM 37079 H2 WAT 6850 93.277 31.598 146.698 1.00 0.00 H TER 37081 WAT 6850 ATOM 37081 O WAT 6851 102.198 6.799 88.599 1.00 0.00 O ATOM 37082 H1 WAT 6851 102.005 6.293 89.389 1.00 0.00 H ATOM 37083 H2 WAT 6851 103.123 6.624 88.423 1.00 0.00 H TER 37085 WAT 6851 ATOM 37085 O WAT 6852 140.499 21.316 131.153 1.00 0.00 O ATOM 37086 H1 WAT 6852 141.068 21.918 130.673 1.00 0.00 H ATOM 37087 H2 WAT 6852 140.356 20.588 130.548 1.00 0.00 H TER 37089 WAT 6852 ATOM 37089 O WAT 6853 52.689 6.219 147.335 1.00 0.00 O ATOM 37090 H1 WAT 6853 53.156 5.500 146.910 1.00 0.00 H ATOM 37091 H2 WAT 6853 53.324 6.586 147.951 1.00 0.00 H TER 37093 WAT 6853 ATOM 37093 O WAT 6854 80.083 128.287 105.847 1.00 0.00 O ATOM 37094 H1 WAT 6854 80.495 128.117 105.001 1.00 0.00 H ATOM 37095 H2 WAT 6854 79.279 128.759 105.632 1.00 0.00 H TER 37097 WAT 6854 ATOM 37097 O WAT 6855 87.114 42.443 83.992 1.00 0.00 O ATOM 37098 H1 WAT 6855 87.945 42.822 84.278 1.00 0.00 H ATOM 37099 H2 WAT 6855 87.055 41.611 84.462 1.00 0.00 H TER 37101 WAT 6855 ATOM 37101 O WAT 6856 46.743 38.291 8.944 1.00 0.00 O ATOM 37102 H1 WAT 6856 46.817 38.748 8.107 1.00 0.00 H ATOM 37103 H2 WAT 6856 47.489 38.605 9.455 1.00 0.00 H TER 37105 WAT 6856 ATOM 37105 O WAT 6857 132.682 140.819 91.018 1.00 0.00 O ATOM 37106 H1 WAT 6857 131.959 140.310 91.386 1.00 0.00 H ATOM 37107 H2 WAT 6857 132.947 140.330 90.240 1.00 0.00 H TER 37109 WAT 6857 ATOM 37109 O WAT 6858 114.923 9.930 90.248 1.00 0.00 O ATOM 37110 H1 WAT 6858 115.166 9.145 90.739 1.00 0.00 H ATOM 37111 H2 WAT 6858 114.803 9.624 89.350 1.00 0.00 H TER 37113 WAT 6858 ATOM 37113 O WAT 6859 102.731 3.965 81.536 1.00 0.00 O ATOM 37114 H1 WAT 6859 101.928 4.125 82.030 1.00 0.00 H ATOM 37115 H2 WAT 6859 103.040 4.837 81.291 1.00 0.00 H TER 37117 WAT 6859 ATOM 37117 O WAT 6860 125.822 10.920 138.098 1.00 0.00 O ATOM 37118 H1 WAT 6860 125.652 11.465 137.329 1.00 0.00 H ATOM 37119 H2 WAT 6860 126.256 10.142 137.749 1.00 0.00 H TER 37121 WAT 6860 ATOM 37121 O WAT 6861 104.626 57.677 8.460 1.00 0.00 O ATOM 37122 H1 WAT 6861 105.292 57.450 9.109 1.00 0.00 H ATOM 37123 H2 WAT 6861 104.933 57.271 7.650 1.00 0.00 H TER 37125 WAT 6861 ATOM 37125 O WAT 6862 111.732 126.400 70.418 1.00 0.00 O ATOM 37126 H1 WAT 6862 110.818 126.539 70.170 1.00 0.00 H ATOM 37127 H2 WAT 6862 112.235 126.798 69.707 1.00 0.00 H TER 37129 WAT 6862 ATOM 37129 O WAT 6863 80.522 13.863 141.071 1.00 0.00 O ATOM 37130 H1 WAT 6863 79.966 13.301 141.610 1.00 0.00 H ATOM 37131 H2 WAT 6863 81.416 13.620 141.315 1.00 0.00 H TER 37133 WAT 6863 ATOM 37133 O WAT 6864 123.534 24.279 111.412 1.00 0.00 O ATOM 37134 H1 WAT 6864 122.757 24.038 110.906 1.00 0.00 H ATOM 37135 H2 WAT 6864 123.222 24.343 112.314 1.00 0.00 H TER 37137 WAT 6864 ATOM 37137 O WAT 6865 32.193 67.208 108.031 1.00 0.00 O ATOM 37138 H1 WAT 6865 31.310 67.418 107.727 1.00 0.00 H ATOM 37139 H2 WAT 6865 32.096 67.072 108.973 1.00 0.00 H TER 37141 WAT 6865 ATOM 37141 O WAT 6866 129.287 99.209 70.851 1.00 0.00 O ATOM 37142 H1 WAT 6866 129.959 99.856 70.636 1.00 0.00 H ATOM 37143 H2 WAT 6866 128.462 99.690 70.785 1.00 0.00 H TER 37145 WAT 6866 ATOM 37145 O WAT 6867 94.043 126.825 20.392 1.00 0.00 O ATOM 37146 H1 WAT 6867 94.654 127.043 21.095 1.00 0.00 H ATOM 37147 H2 WAT 6867 93.341 126.339 20.826 1.00 0.00 H TER 37149 WAT 6867 ATOM 37149 O WAT 6868 24.410 118.013 23.824 1.00 0.00 O ATOM 37150 H1 WAT 6868 25.113 118.309 24.402 1.00 0.00 H ATOM 37151 H2 WAT 6868 24.206 118.778 23.285 1.00 0.00 H TER 37153 WAT 6868 ATOM 37153 O WAT 6869 38.888 28.357 124.407 1.00 0.00 O ATOM 37154 H1 WAT 6869 38.698 28.301 123.471 1.00 0.00 H ATOM 37155 H2 WAT 6869 39.170 27.474 124.647 1.00 0.00 H TER 37157 WAT 6869 ATOM 37157 O WAT 6870 94.436 57.889 60.248 1.00 0.00 O ATOM 37158 H1 WAT 6870 93.980 57.165 60.677 1.00 0.00 H ATOM 37159 H2 WAT 6870 93.736 58.450 59.916 1.00 0.00 H TER 37161 WAT 6870 ATOM 37161 O WAT 6871 22.506 85.958 109.716 1.00 0.00 O ATOM 37162 H1 WAT 6871 22.686 85.818 110.646 1.00 0.00 H ATOM 37163 H2 WAT 6871 22.420 85.076 109.354 1.00 0.00 H TER 37165 WAT 6871 ATOM 37165 O WAT 6872 137.747 78.807 138.962 1.00 0.00 O ATOM 37166 H1 WAT 6872 137.913 79.028 139.878 1.00 0.00 H ATOM 37167 H2 WAT 6872 138.084 79.555 138.470 1.00 0.00 H TER 37169 WAT 6872 ATOM 37169 O WAT 6873 54.603 68.750 123.001 1.00 0.00 O ATOM 37170 H1 WAT 6873 54.667 69.092 123.892 1.00 0.00 H ATOM 37171 H2 WAT 6873 55.485 68.436 122.801 1.00 0.00 H TER 37173 WAT 6873 ATOM 37173 O WAT 6874 111.016 105.853 6.838 1.00 0.00 O ATOM 37174 H1 WAT 6874 110.469 105.368 7.457 1.00 0.00 H ATOM 37175 H2 WAT 6874 111.913 105.671 7.117 1.00 0.00 H TER 37177 WAT 6874 ATOM 37177 O WAT 6875 33.984 24.220 1.083 1.00 0.00 O ATOM 37178 H1 WAT 6875 34.429 23.390 0.917 1.00 0.00 H ATOM 37179 H2 WAT 6875 33.861 24.241 2.032 1.00 0.00 H TER 37181 WAT 6875 ATOM 37181 O WAT 6876 49.415 134.685 65.818 1.00 0.00 O ATOM 37182 H1 WAT 6876 49.596 134.585 66.753 1.00 0.00 H ATOM 37183 H2 WAT 6876 50.175 134.297 65.384 1.00 0.00 H TER 37185 WAT 6876 ATOM 37185 O WAT 6877 27.436 76.734 122.516 1.00 0.00 O ATOM 37186 H1 WAT 6877 26.974 75.898 122.455 1.00 0.00 H ATOM 37187 H2 WAT 6877 26.746 77.378 122.674 1.00 0.00 H TER 37189 WAT 6877 ATOM 37189 O WAT 6878 34.635 76.596 91.640 1.00 0.00 O ATOM 37190 H1 WAT 6878 34.568 75.704 91.299 1.00 0.00 H ATOM 37191 H2 WAT 6878 33.757 76.961 91.532 1.00 0.00 H TER 37193 WAT 6878 ATOM 37193 O WAT 6879 23.680 36.793 148.255 1.00 0.00 O ATOM 37194 H1 WAT 6879 23.574 36.687 149.200 1.00 0.00 H ATOM 37195 H2 WAT 6879 24.563 36.471 148.076 1.00 0.00 H TER 37197 WAT 6879 ATOM 37197 O WAT 6880 89.118 141.779 17.619 1.00 0.00 O ATOM 37198 H1 WAT 6880 89.728 141.207 18.087 1.00 0.00 H ATOM 37199 H2 WAT 6880 88.275 141.331 17.682 1.00 0.00 H TER 37201 WAT 6880 ATOM 37201 O WAT 6881 40.337 111.321 143.294 1.00 0.00 O ATOM 37202 H1 WAT 6881 40.498 110.381 143.213 1.00 0.00 H ATOM 37203 H2 WAT 6881 39.924 111.565 142.466 1.00 0.00 H TER 37205 WAT 6881 ATOM 37205 O WAT 6882 114.232 113.689 120.768 1.00 0.00 O ATOM 37206 H1 WAT 6882 113.859 112.890 121.141 1.00 0.00 H ATOM 37207 H2 WAT 6882 113.486 114.139 120.372 1.00 0.00 H TER 37209 WAT 6882 ATOM 37209 O WAT 6883 109.368 45.017 0.108 1.00 0.00 O ATOM 37210 H1 WAT 6883 108.780 45.671 0.485 1.00 0.00 H ATOM 37211 H2 WAT 6883 108.787 44.394 -0.328 1.00 0.00 H TER 37213 WAT 6883 ATOM 37213 O WAT 6884 27.121 66.601 153.300 1.00 0.00 O ATOM 37214 H1 WAT 6884 26.587 66.697 152.512 1.00 0.00 H ATOM 37215 H2 WAT 6884 27.981 66.331 152.977 1.00 0.00 H TER 37217 WAT 6884 ATOM 37217 O WAT 6885 59.912 73.757 115.770 1.00 0.00 O ATOM 37218 H1 WAT 6885 59.375 73.290 116.410 1.00 0.00 H ATOM 37219 H2 WAT 6885 59.292 74.040 115.098 1.00 0.00 H TER 37221 WAT 6885 ATOM 37221 O WAT 6886 136.892 127.455 13.073 1.00 0.00 O ATOM 37222 H1 WAT 6886 137.054 127.882 13.914 1.00 0.00 H ATOM 37223 H2 WAT 6886 136.048 127.018 13.185 1.00 0.00 H TER 37225 WAT 6886 ATOM 37225 O WAT 6887 90.876 65.775 156.185 1.00 0.00 O ATOM 37226 H1 WAT 6887 91.820 65.933 156.224 1.00 0.00 H ATOM 37227 H2 WAT 6887 90.727 65.433 155.304 1.00 0.00 H TER 37229 WAT 6887 ATOM 37229 O WAT 6888 12.994 116.481 23.961 1.00 0.00 O ATOM 37230 H1 WAT 6888 12.870 116.511 24.910 1.00 0.00 H ATOM 37231 H2 WAT 6888 12.504 115.709 23.679 1.00 0.00 H TER 37233 WAT 6888 ATOM 37233 O WAT 6889 59.596 73.995 85.469 1.00 0.00 O ATOM 37234 H1 WAT 6889 59.693 74.829 85.928 1.00 0.00 H ATOM 37235 H2 WAT 6889 58.664 73.788 85.542 1.00 0.00 H TER 37237 WAT 6889 ATOM 37237 O WAT 6890 6.058 54.185 70.681 1.00 0.00 O ATOM 37238 H1 WAT 6890 6.459 53.351 70.927 1.00 0.00 H ATOM 37239 H2 WAT 6890 6.796 54.786 70.584 1.00 0.00 H TER 37241 WAT 6890 ATOM 37241 O WAT 6891 82.705 119.110 103.712 1.00 0.00 O ATOM 37242 H1 WAT 6891 83.426 118.526 103.475 1.00 0.00 H ATOM 37243 H2 WAT 6891 82.836 119.886 103.167 1.00 0.00 H TER 37245 WAT 6891 ATOM 37245 O WAT 6892 107.280 58.674 2.378 1.00 0.00 O ATOM 37246 H1 WAT 6892 108.181 58.402 2.201 1.00 0.00 H ATOM 37247 H2 WAT 6892 107.027 59.180 1.606 1.00 0.00 H TER 37249 WAT 6892 ATOM 37249 O WAT 6893 98.673 47.390 6.770 1.00 0.00 O ATOM 37250 H1 WAT 6893 97.739 47.184 6.739 1.00 0.00 H ATOM 37251 H2 WAT 6893 98.859 47.789 5.920 1.00 0.00 H TER 37253 WAT 6893 ATOM 37253 O WAT 6894 74.592 92.947 67.282 1.00 0.00 O ATOM 37254 H1 WAT 6894 75.269 93.384 67.799 1.00 0.00 H ATOM 37255 H2 WAT 6894 73.930 92.691 67.924 1.00 0.00 H TER 37257 WAT 6894 ATOM 37257 O WAT 6895 66.191 75.923 16.839 1.00 0.00 O ATOM 37258 H1 WAT 6895 66.681 75.256 16.357 1.00 0.00 H ATOM 37259 H2 WAT 6895 65.549 75.427 17.348 1.00 0.00 H TER 37261 WAT 6895 ATOM 37261 O WAT 6896 10.150 120.794 75.622 1.00 0.00 O ATOM 37262 H1 WAT 6896 11.061 120.947 75.871 1.00 0.00 H ATOM 37263 H2 WAT 6896 10.158 120.802 74.665 1.00 0.00 H TER 37265 WAT 6896 ATOM 37265 O WAT 6897 85.532 39.514 103.876 1.00 0.00 O ATOM 37266 H1 WAT 6897 85.195 40.174 104.482 1.00 0.00 H ATOM 37267 H2 WAT 6897 85.235 38.680 104.239 1.00 0.00 H TER 37269 WAT 6897 ATOM 37269 O WAT 6898 137.956 16.441 83.735 1.00 0.00 O ATOM 37270 H1 WAT 6898 138.609 16.271 83.056 1.00 0.00 H ATOM 37271 H2 WAT 6898 137.940 17.394 83.819 1.00 0.00 H TER 37273 WAT 6898 ATOM 37273 O WAT 6899 115.772 101.599 26.381 1.00 0.00 O ATOM 37274 H1 WAT 6899 115.999 102.526 26.465 1.00 0.00 H ATOM 37275 H2 WAT 6899 116.493 101.137 26.810 1.00 0.00 H TER 37277 WAT 6899 ATOM 37277 O WAT 6900 14.560 77.347 57.197 1.00 0.00 O ATOM 37278 H1 WAT 6900 13.918 77.943 57.584 1.00 0.00 H ATOM 37279 H2 WAT 6900 14.033 76.653 56.801 1.00 0.00 H TER 37281 WAT 6900 ATOM 37281 O WAT 6901 55.616 132.875 62.040 1.00 0.00 O ATOM 37282 H1 WAT 6901 55.411 133.772 61.776 1.00 0.00 H ATOM 37283 H2 WAT 6901 55.469 132.353 61.252 1.00 0.00 H TER 37285 WAT 6901 ATOM 37285 O WAT 6902 101.603 91.872 77.001 1.00 0.00 O ATOM 37286 H1 WAT 6902 100.750 91.463 76.856 1.00 0.00 H ATOM 37287 H2 WAT 6902 101.706 92.477 76.267 1.00 0.00 H TER 37289 WAT 6902 ATOM 37289 O WAT 6903 6.931 74.437 87.972 1.00 0.00 O ATOM 37290 H1 WAT 6903 7.139 73.979 87.157 1.00 0.00 H ATOM 37291 H2 WAT 6903 6.471 75.228 87.691 1.00 0.00 H TER 37293 WAT 6903 ATOM 37293 O WAT 6904 87.244 30.176 90.557 1.00 0.00 O ATOM 37294 H1 WAT 6904 87.614 30.795 91.186 1.00 0.00 H ATOM 37295 H2 WAT 6904 87.663 29.341 90.767 1.00 0.00 H TER 37297 WAT 6904 ATOM 37297 O WAT 6905 134.674 71.408 64.225 1.00 0.00 O ATOM 37298 H1 WAT 6905 135.088 71.986 63.584 1.00 0.00 H ATOM 37299 H2 WAT 6905 134.633 70.557 63.787 1.00 0.00 H TER 37301 WAT 6905 ATOM 37301 O WAT 6906 118.763 62.862 157.299 1.00 0.00 O ATOM 37302 H1 WAT 6906 118.210 62.843 158.080 1.00 0.00 H ATOM 37303 H2 WAT 6906 119.249 62.038 157.328 1.00 0.00 H TER 37305 WAT 6906 ATOM 37305 O WAT 6907 68.139 93.234 132.335 1.00 0.00 O ATOM 37306 H1 WAT 6907 67.293 93.138 131.897 1.00 0.00 H ATOM 37307 H2 WAT 6907 68.216 92.450 132.879 1.00 0.00 H TER 37309 WAT 6907 ATOM 37309 O WAT 6908 77.056 93.434 29.108 1.00 0.00 O ATOM 37310 H1 WAT 6908 76.969 93.200 30.033 1.00 0.00 H ATOM 37311 H2 WAT 6908 76.394 92.904 28.664 1.00 0.00 H TER 37313 WAT 6908 ATOM 37313 O WAT 6909 111.292 13.951 140.098 1.00 0.00 O ATOM 37314 H1 WAT 6909 111.436 13.609 140.981 1.00 0.00 H ATOM 37315 H2 WAT 6909 112.117 14.382 139.871 1.00 0.00 H TER 37317 WAT 6909 ATOM 37317 O WAT 6910 119.766 65.628 125.596 1.00 0.00 O ATOM 37318 H1 WAT 6910 118.915 65.369 125.242 1.00 0.00 H ATOM 37319 H2 WAT 6910 119.560 66.293 126.252 1.00 0.00 H TER 37321 WAT 6910 ATOM 37321 O WAT 6911 52.165 139.911 133.597 1.00 0.00 O ATOM 37322 H1 WAT 6911 52.854 139.329 133.277 1.00 0.00 H ATOM 37323 H2 WAT 6911 51.784 140.290 132.805 1.00 0.00 H TER 37325 WAT 6911 ATOM 37325 O WAT 6912 114.129 18.151 152.346 1.00 0.00 O ATOM 37326 H1 WAT 6912 113.516 18.760 152.757 1.00 0.00 H ATOM 37327 H2 WAT 6912 114.356 18.566 151.514 1.00 0.00 H TER 37329 WAT 6912 ATOM 37329 O WAT 6913 44.363 29.584 61.326 1.00 0.00 O ATOM 37330 H1 WAT 6913 44.947 28.904 60.991 1.00 0.00 H ATOM 37331 H2 WAT 6913 43.512 29.382 60.935 1.00 0.00 H TER 37333 WAT 6913 ATOM 37333 O WAT 6914 27.828 120.404 61.801 1.00 0.00 O ATOM 37334 H1 WAT 6914 28.605 120.163 61.297 1.00 0.00 H ATOM 37335 H2 WAT 6914 27.511 121.204 61.383 1.00 0.00 H TER 37337 WAT 6914 ATOM 37337 O WAT 6915 127.737 54.660 108.356 1.00 0.00 O ATOM 37338 H1 WAT 6915 127.842 55.599 108.203 1.00 0.00 H ATOM 37339 H2 WAT 6915 128.364 54.459 109.050 1.00 0.00 H TER 37341 WAT 6915 ATOM 37341 O WAT 6916 120.973 101.520 93.139 1.00 0.00 O ATOM 37342 H1 WAT 6916 120.975 102.443 93.392 1.00 0.00 H ATOM 37343 H2 WAT 6916 121.079 101.046 93.964 1.00 0.00 H TER 37345 WAT 6916 ATOM 37345 O WAT 6917 91.010 142.458 20.135 1.00 0.00 O ATOM 37346 H1 WAT 6917 91.130 141.603 19.723 1.00 0.00 H ATOM 37347 H2 WAT 6917 90.797 142.258 21.047 1.00 0.00 H TER 37349 WAT 6917 ATOM 37349 O WAT 6918 94.522 79.551 87.944 1.00 0.00 O ATOM 37350 H1 WAT 6918 95.141 79.864 87.285 1.00 0.00 H ATOM 37351 H2 WAT 6918 93.691 79.475 87.476 1.00 0.00 H TER 37353 WAT 6918 ATOM 37353 O WAT 6919 134.698 121.218 7.157 1.00 0.00 O ATOM 37354 H1 WAT 6919 133.861 120.774 7.023 1.00 0.00 H ATOM 37355 H2 WAT 6919 134.942 121.001 8.057 1.00 0.00 H TER 37357 WAT 6919 ATOM 37357 O WAT 6920 99.319 6.265 76.199 1.00 0.00 O ATOM 37358 H1 WAT 6920 98.627 6.859 75.908 1.00 0.00 H ATOM 37359 H2 WAT 6920 99.610 6.627 77.036 1.00 0.00 H TER 37361 WAT 6920 ATOM 37361 O WAT 6921 48.847 63.471 19.332 1.00 0.00 O ATOM 37362 H1 WAT 6921 48.305 63.425 18.544 1.00 0.00 H ATOM 37363 H2 WAT 6921 49.743 63.536 19.002 1.00 0.00 H TER 37365 WAT 6921 ATOM 37365 O WAT 6922 78.163 82.088 133.748 1.00 0.00 O ATOM 37366 H1 WAT 6922 77.652 81.280 133.787 1.00 0.00 H ATOM 37367 H2 WAT 6922 78.718 82.059 134.528 1.00 0.00 H TER 37369 WAT 6922 ATOM 37369 O WAT 6923 144.574 92.964 30.098 1.00 0.00 O ATOM 37370 H1 WAT 6923 144.676 92.075 30.438 1.00 0.00 H ATOM 37371 H2 WAT 6923 144.613 92.863 29.147 1.00 0.00 H TER 37373 WAT 6923 ATOM 37373 O WAT 6924 13.110 1.309 109.799 1.00 0.00 O ATOM 37374 H1 WAT 6924 12.411 0.668 109.928 1.00 0.00 H ATOM 37375 H2 WAT 6924 13.842 0.974 110.317 1.00 0.00 H TER 37377 WAT 6924 ATOM 37377 O WAT 6925 25.216 75.425 141.349 1.00 0.00 O ATOM 37378 H1 WAT 6925 25.403 75.032 142.202 1.00 0.00 H ATOM 37379 H2 WAT 6925 24.640 74.794 140.917 1.00 0.00 H TER 37381 WAT 6925 ATOM 37381 O WAT 6926 76.718 142.371 3.052 1.00 0.00 O ATOM 37382 H1 WAT 6926 76.203 142.646 2.293 1.00 0.00 H ATOM 37383 H2 WAT 6926 76.550 141.432 3.129 1.00 0.00 H TER 37385 WAT 6926 ATOM 37385 O WAT 6927 72.541 23.216 141.970 1.00 0.00 O ATOM 37386 H1 WAT 6927 71.609 23.256 141.757 1.00 0.00 H ATOM 37387 H2 WAT 6927 72.983 23.265 141.122 1.00 0.00 H TER 37389 WAT 6927 ATOM 37389 O WAT 6928 116.946 40.986 104.018 1.00 0.00 O ATOM 37390 H1 WAT 6928 116.617 41.884 104.066 1.00 0.00 H ATOM 37391 H2 WAT 6928 117.878 41.061 104.222 1.00 0.00 H TER 37393 WAT 6928 ATOM 37393 O WAT 6929 30.086 77.614 96.864 1.00 0.00 O ATOM 37394 H1 WAT 6929 29.788 77.286 96.015 1.00 0.00 H ATOM 37395 H2 WAT 6929 29.286 77.909 97.300 1.00 0.00 H TER 37397 WAT 6929 ATOM 37397 O WAT 6930 4.741 140.824 142.555 1.00 0.00 O ATOM 37398 H1 WAT 6930 4.151 140.571 143.265 1.00 0.00 H ATOM 37399 H2 WAT 6930 4.161 141.022 141.820 1.00 0.00 H TER 37401 WAT 6930 ATOM 37401 O WAT 6931 111.569 30.320 118.760 1.00 0.00 O ATOM 37402 H1 WAT 6931 111.808 29.798 119.526 1.00 0.00 H ATOM 37403 H2 WAT 6931 111.128 29.702 118.176 1.00 0.00 H TER 37405 WAT 6931 ATOM 37405 O WAT 6932 72.097 25.195 155.981 1.00 0.00 O ATOM 37406 H1 WAT 6932 72.023 24.901 156.889 1.00 0.00 H ATOM 37407 H2 WAT 6932 71.628 26.029 155.960 1.00 0.00 H TER 37409 WAT 6932 ATOM 37409 O WAT 6933 9.987 145.215 62.551 1.00 0.00 O ATOM 37410 H1 WAT 6933 10.238 145.633 61.727 1.00 0.00 H ATOM 37411 H2 WAT 6933 10.376 144.342 62.506 1.00 0.00 H TER 37413 WAT 6933 ATOM 37413 O WAT 6934 98.937 71.190 149.899 1.00 0.00 O ATOM 37414 H1 WAT 6934 99.538 70.611 149.430 1.00 0.00 H ATOM 37415 H2 WAT 6934 99.469 71.575 150.596 1.00 0.00 H TER 37417 WAT 6934 ATOM 37417 O WAT 6935 109.442 81.304 22.592 1.00 0.00 O ATOM 37418 H1 WAT 6935 109.289 82.247 22.531 1.00 0.00 H ATOM 37419 H2 WAT 6935 109.667 81.157 23.511 1.00 0.00 H TER 37421 WAT 6935 ATOM 37421 O WAT 6936 5.681 84.350 105.300 1.00 0.00 O ATOM 37422 H1 WAT 6936 4.781 84.070 105.134 1.00 0.00 H ATOM 37423 H2 WAT 6936 6.187 83.538 105.304 1.00 0.00 H TER 37425 WAT 6936 ATOM 37425 O WAT 6937 96.074 47.025 7.356 1.00 0.00 O ATOM 37426 H1 WAT 6937 95.497 46.476 6.823 1.00 0.00 H ATOM 37427 H2 WAT 6937 95.723 47.909 7.255 1.00 0.00 H TER 37429 WAT 6937 ATOM 37429 O WAT 6938 67.670 52.985 27.336 1.00 0.00 O ATOM 37430 H1 WAT 6938 67.666 53.936 27.222 1.00 0.00 H ATOM 37431 H2 WAT 6938 67.265 52.647 26.537 1.00 0.00 H TER 37433 WAT 6938 ATOM 37433 O WAT 6939 81.434 40.607 7.883 1.00 0.00 O ATOM 37434 H1 WAT 6939 80.797 41.126 7.391 1.00 0.00 H ATOM 37435 H2 WAT 6939 81.199 40.747 8.801 1.00 0.00 H TER 37437 WAT 6939 ATOM 37437 O WAT 6940 29.696 114.833 157.069 1.00 0.00 O ATOM 37438 H1 WAT 6940 29.833 115.771 156.936 1.00 0.00 H ATOM 37439 H2 WAT 6940 30.041 114.663 157.946 1.00 0.00 H TER 37441 WAT 6940 ATOM 37441 O WAT 6941 66.242 129.879 158.664 1.00 0.00 O ATOM 37442 H1 WAT 6941 65.421 130.266 158.969 1.00 0.00 H ATOM 37443 H2 WAT 6941 66.078 129.657 157.748 1.00 0.00 H TER 37445 WAT 6941 ATOM 37445 O WAT 6942 41.371 20.454 89.251 1.00 0.00 O ATOM 37446 H1 WAT 6942 40.768 21.147 88.984 1.00 0.00 H ATOM 37447 H2 WAT 6942 42.230 20.877 89.266 1.00 0.00 H TER 37449 WAT 6942 ATOM 37449 O WAT 6943 20.260 52.223 82.698 1.00 0.00 O ATOM 37450 H1 WAT 6943 20.084 51.488 82.111 1.00 0.00 H ATOM 37451 H2 WAT 6943 20.887 52.767 82.221 1.00 0.00 H TER 37453 WAT 6943 ATOM 37453 O WAT 6944 55.764 15.221 66.019 1.00 0.00 O ATOM 37454 H1 WAT 6944 55.385 15.542 66.837 1.00 0.00 H ATOM 37455 H2 WAT 6944 55.017 14.884 65.524 1.00 0.00 H TER 37457 WAT 6944 ATOM 37457 O WAT 6945 112.735 98.642 103.766 1.00 0.00 O ATOM 37458 H1 WAT 6945 112.325 99.234 103.136 1.00 0.00 H ATOM 37459 H2 WAT 6945 113.674 98.730 103.603 1.00 0.00 H TER 37461 WAT 6945 ATOM 37461 O WAT 6946 87.190 38.782 14.641 1.00 0.00 O ATOM 37462 H1 WAT 6946 86.886 39.683 14.755 1.00 0.00 H ATOM 37463 H2 WAT 6946 88.047 38.763 15.066 1.00 0.00 H TER 37465 WAT 6946 ATOM 37465 O WAT 6947 52.750 78.589 64.418 1.00 0.00 O ATOM 37466 H1 WAT 6947 53.645 78.848 64.635 1.00 0.00 H ATOM 37467 H2 WAT 6947 52.818 78.198 63.547 1.00 0.00 H TER 37469 WAT 6947 ATOM 37469 O WAT 6948 115.916 85.741 22.878 1.00 0.00 O ATOM 37470 H1 WAT 6948 116.846 85.516 22.914 1.00 0.00 H ATOM 37471 H2 WAT 6948 115.484 85.050 23.380 1.00 0.00 H TER 37473 WAT 6948 ATOM 37473 O WAT 6949 104.289 122.420 144.877 1.00 0.00 O ATOM 37474 H1 WAT 6949 104.411 123.310 144.547 1.00 0.00 H ATOM 37475 H2 WAT 6949 103.408 122.177 144.593 1.00 0.00 H TER 37477 WAT 6949 ATOM 37477 O WAT 6950 113.586 85.661 65.556 1.00 0.00 O ATOM 37478 H1 WAT 6950 113.985 86.530 65.514 1.00 0.00 H ATOM 37479 H2 WAT 6950 112.836 85.714 64.963 1.00 0.00 H TER 37481 WAT 6950 ATOM 37481 O WAT 6951 51.318 27.316 121.462 1.00 0.00 O ATOM 37482 H1 WAT 6951 50.508 27.818 121.545 1.00 0.00 H ATOM 37483 H2 WAT 6951 51.730 27.655 120.668 1.00 0.00 H TER 37485 WAT 6951 ATOM 37485 O WAT 6952 16.421 120.802 117.970 1.00 0.00 O ATOM 37486 H1 WAT 6952 15.878 120.138 117.545 1.00 0.00 H ATOM 37487 H2 WAT 6952 17.075 120.300 118.457 1.00 0.00 H TER 37489 WAT 6952 ATOM 37489 O WAT 6953 32.686 101.207 96.266 1.00 0.00 O ATOM 37490 H1 WAT 6953 33.228 101.388 95.499 1.00 0.00 H ATOM 37491 H2 WAT 6953 33.313 101.082 96.979 1.00 0.00 H TER 37493 WAT 6953 ATOM 37493 O WAT 6954 30.746 36.964 10.535 1.00 0.00 O ATOM 37494 H1 WAT 6954 30.551 36.867 11.467 1.00 0.00 H ATOM 37495 H2 WAT 6954 30.567 37.885 10.348 1.00 0.00 H TER 37497 WAT 6954 ATOM 37497 O WAT 6955 53.589 144.705 123.844 1.00 0.00 O ATOM 37498 H1 WAT 6955 53.542 143.868 124.305 1.00 0.00 H ATOM 37499 H2 WAT 6955 54.526 144.874 123.747 1.00 0.00 H TER 37501 WAT 6955 ATOM 37501 O WAT 6956 13.327 60.088 65.753 1.00 0.00 O ATOM 37502 H1 WAT 6956 13.615 59.290 66.196 1.00 0.00 H ATOM 37503 H2 WAT 6956 12.966 59.783 64.921 1.00 0.00 H TER 37505 WAT 6956 ATOM 37505 O WAT 6957 130.228 25.436 65.153 1.00 0.00 O ATOM 37506 H1 WAT 6957 129.772 25.299 64.322 1.00 0.00 H ATOM 37507 H2 WAT 6957 129.533 25.656 65.773 1.00 0.00 H TER 37509 WAT 6957 ATOM 37509 O WAT 6958 71.393 25.935 84.041 1.00 0.00 O ATOM 37510 H1 WAT 6958 71.513 26.499 84.804 1.00 0.00 H ATOM 37511 H2 WAT 6958 71.256 26.541 83.313 1.00 0.00 H TER 37513 WAT 6958 ATOM 37513 O WAT 6959 50.112 6.683 54.287 1.00 0.00 O ATOM 37514 H1 WAT 6959 49.781 6.263 53.494 1.00 0.00 H ATOM 37515 H2 WAT 6959 51.061 6.715 54.164 1.00 0.00 H TER 37517 WAT 6959 ATOM 37517 O WAT 6960 59.422 51.459 157.119 1.00 0.00 O ATOM 37518 H1 WAT 6960 58.961 50.849 157.695 1.00 0.00 H ATOM 37519 H2 WAT 6960 60.126 50.938 156.732 1.00 0.00 H TER 37521 WAT 6960 ATOM 37521 O WAT 6961 76.897 57.617 124.712 1.00 0.00 O ATOM 37522 H1 WAT 6961 77.420 56.832 124.550 1.00 0.00 H ATOM 37523 H2 WAT 6961 77.504 58.343 124.570 1.00 0.00 H TER 37525 WAT 6961 ATOM 37525 O WAT 6962 61.924 133.126 9.589 1.00 0.00 O ATOM 37526 H1 WAT 6962 61.741 134.009 9.909 1.00 0.00 H ATOM 37527 H2 WAT 6962 61.660 133.144 8.670 1.00 0.00 H TER 37529 WAT 6962 ATOM 37529 O WAT 6963 56.345 66.379 100.275 1.00 0.00 O ATOM 37530 H1 WAT 6963 56.431 66.680 101.179 1.00 0.00 H ATOM 37531 H2 WAT 6963 55.669 65.702 100.310 1.00 0.00 H TER 37533 WAT 6963 ATOM 37533 O WAT 6964 124.769 7.202 158.712 1.00 0.00 O ATOM 37534 H1 WAT 6964 125.596 6.754 158.531 1.00 0.00 H ATOM 37535 H2 WAT 6964 124.906 8.095 158.395 1.00 0.00 H TER 37537 WAT 6964 ATOM 37537 O WAT 6965 25.923 88.881 69.915 1.00 0.00 O ATOM 37538 H1 WAT 6965 26.057 87.939 70.015 1.00 0.00 H ATOM 37539 H2 WAT 6965 25.267 88.957 69.222 1.00 0.00 H TER 37541 WAT 6965 ATOM 37541 O WAT 6966 15.096 57.062 71.397 1.00 0.00 O ATOM 37542 H1 WAT 6966 15.050 57.850 70.855 1.00 0.00 H ATOM 37543 H2 WAT 6966 14.269 57.055 71.880 1.00 0.00 H TER 37545 WAT 6966 ATOM 37545 O WAT 6967 41.737 132.145 132.077 1.00 0.00 O ATOM 37546 H1 WAT 6967 41.058 132.272 132.739 1.00 0.00 H ATOM 37547 H2 WAT 6967 42.191 131.347 132.349 1.00 0.00 H TER 37549 WAT 6967 ATOM 37549 O WAT 6968 55.607 75.849 152.360 1.00 0.00 O ATOM 37550 H1 WAT 6968 55.517 75.926 153.310 1.00 0.00 H ATOM 37551 H2 WAT 6968 55.374 76.715 152.026 1.00 0.00 H TER 37553 WAT 6968 ATOM 37553 O WAT 6969 133.416 18.252 61.584 1.00 0.00 O ATOM 37554 H1 WAT 6969 133.478 17.626 60.863 1.00 0.00 H ATOM 37555 H2 WAT 6969 133.279 19.097 61.157 1.00 0.00 H TER 37557 WAT 6969 ATOM 37557 O WAT 6970 114.672 28.516 141.593 1.00 0.00 O ATOM 37558 H1 WAT 6970 115.383 29.133 141.764 1.00 0.00 H ATOM 37559 H2 WAT 6970 114.674 28.405 140.642 1.00 0.00 H TER 37561 WAT 6970 ATOM 37561 O WAT 6971 113.324 71.610 80.317 1.00 0.00 O ATOM 37562 H1 WAT 6971 114.234 71.904 80.359 1.00 0.00 H ATOM 37563 H2 WAT 6971 112.944 72.111 79.595 1.00 0.00 H TER 37565 WAT 6971 ATOM 37565 O WAT 6972 49.761 37.792 14.728 1.00 0.00 O ATOM 37566 H1 WAT 6972 49.604 38.734 14.664 1.00 0.00 H ATOM 37567 H2 WAT 6972 49.784 37.616 15.668 1.00 0.00 H TER 37569 WAT 6972 ATOM 37569 O WAT 6973 13.897 96.771 17.383 1.00 0.00 O ATOM 37570 H1 WAT 6973 14.537 96.991 16.706 1.00 0.00 H ATOM 37571 H2 WAT 6973 14.408 96.730 18.191 1.00 0.00 H TER 37573 WAT 6973 ATOM 37573 O WAT 6974 30.220 12.898 5.332 1.00 0.00 O ATOM 37574 H1 WAT 6974 29.994 12.305 4.615 1.00 0.00 H ATOM 37575 H2 WAT 6974 30.855 12.409 5.855 1.00 0.00 H TER 37577 WAT 6974 ATOM 37577 O WAT 6975 18.419 17.729 150.716 1.00 0.00 O ATOM 37578 H1 WAT 6975 17.977 18.393 151.246 1.00 0.00 H ATOM 37579 H2 WAT 6975 18.704 18.198 149.933 1.00 0.00 H TER 37581 WAT 6975 ATOM 37581 O WAT 6976 79.383 78.732 98.835 1.00 0.00 O ATOM 37582 H1 WAT 6976 78.986 78.593 97.975 1.00 0.00 H ATOM 37583 H2 WAT 6976 80.325 78.740 98.666 1.00 0.00 H TER 37585 WAT 6976 ATOM 37585 O WAT 6977 45.707 59.283 19.200 1.00 0.00 O ATOM 37586 H1 WAT 6977 45.621 60.209 18.970 1.00 0.00 H ATOM 37587 H2 WAT 6977 46.471 59.250 19.777 1.00 0.00 H TER 37589 WAT 6977 ATOM 37589 O WAT 6978 137.190 50.874 123.599 1.00 0.00 O ATOM 37590 H1 WAT 6978 136.839 50.316 122.905 1.00 0.00 H ATOM 37591 H2 WAT 6978 137.829 50.322 124.051 1.00 0.00 H TER 37593 WAT 6978 ATOM 37593 O WAT 6979 69.755 15.335 68.163 1.00 0.00 O ATOM 37594 H1 WAT 6979 70.286 15.705 68.868 1.00 0.00 H ATOM 37595 H2 WAT 6979 68.861 15.608 68.368 1.00 0.00 H TER 37597 WAT 6979 ATOM 37597 O WAT 6980 65.305 73.050 95.853 1.00 0.00 O ATOM 37598 H1 WAT 6980 65.351 72.105 95.997 1.00 0.00 H ATOM 37599 H2 WAT 6980 66.041 73.405 96.352 1.00 0.00 H TER 37601 WAT 6980 ATOM 37601 O WAT 6981 30.534 98.319 57.341 1.00 0.00 O ATOM 37602 H1 WAT 6981 30.310 99.048 56.762 1.00 0.00 H ATOM 37603 H2 WAT 6981 29.696 97.901 57.536 1.00 0.00 H TER 37605 WAT 6981 ATOM 37605 O WAT 6982 8.356 40.886 12.018 1.00 0.00 O ATOM 37606 H1 WAT 6982 8.762 40.878 11.151 1.00 0.00 H ATOM 37607 H2 WAT 6982 8.601 40.045 12.404 1.00 0.00 H TER 37609 WAT 6982 ATOM 37609 O WAT 6983 14.450 101.735 139.954 1.00 0.00 O ATOM 37610 H1 WAT 6983 14.519 101.116 139.226 1.00 0.00 H ATOM 37611 H2 WAT 6983 13.638 101.491 140.398 1.00 0.00 H TER 37613 WAT 6983 ATOM 37613 O WAT 6984 16.425 98.616 79.065 1.00 0.00 O ATOM 37614 H1 WAT 6984 17.022 98.055 78.569 1.00 0.00 H ATOM 37615 H2 WAT 6984 16.313 98.166 79.902 1.00 0.00 H TER 37617 WAT 6984 ATOM 37617 O WAT 6985 78.321 12.926 139.210 1.00 0.00 O ATOM 37618 H1 WAT 6985 79.122 12.774 139.712 1.00 0.00 H ATOM 37619 H2 WAT 6985 78.183 13.872 139.260 1.00 0.00 H TER 37621 WAT 6985 ATOM 37621 O WAT 6986 87.492 57.809 122.543 1.00 0.00 O ATOM 37622 H1 WAT 6986 88.109 58.511 122.337 1.00 0.00 H ATOM 37623 H2 WAT 6986 87.289 57.933 123.470 1.00 0.00 H TER 37625 WAT 6986 ATOM 37625 O WAT 6987 82.692 42.339 26.283 1.00 0.00 O ATOM 37626 H1 WAT 6987 82.675 41.589 25.688 1.00 0.00 H ATOM 37627 H2 WAT 6987 82.815 43.096 25.711 1.00 0.00 H TER 37629 WAT 6987 ATOM 37629 O WAT 6988 91.582 72.095 24.743 1.00 0.00 O ATOM 37630 H1 WAT 6988 91.449 72.889 24.225 1.00 0.00 H ATOM 37631 H2 WAT 6988 91.465 72.378 25.650 1.00 0.00 H TER 37633 WAT 6988 ATOM 37633 O WAT 6989 131.086 101.523 70.768 1.00 0.00 O ATOM 37634 H1 WAT 6989 132.005 101.789 70.788 1.00 0.00 H ATOM 37635 H2 WAT 6989 130.726 101.962 69.997 1.00 0.00 H TER 37637 WAT 6989 ATOM 37637 O WAT 6990 1.479 124.517 11.739 1.00 0.00 O ATOM 37638 H1 WAT 6990 2.079 123.814 11.988 1.00 0.00 H ATOM 37639 H2 WAT 6990 1.765 125.270 12.256 1.00 0.00 H TER 37641 WAT 6990 ATOM 37641 O WAT 6991 136.506 19.167 142.266 1.00 0.00 O ATOM 37642 H1 WAT 6991 136.948 19.176 143.115 1.00 0.00 H ATOM 37643 H2 WAT 6991 137.207 19.015 141.633 1.00 0.00 H TER 37645 WAT 6991 ATOM 37645 O WAT 6992 122.721 82.464 121.941 1.00 0.00 O ATOM 37646 H1 WAT 6992 123.079 82.629 121.069 1.00 0.00 H ATOM 37647 H2 WAT 6992 121.879 82.919 121.944 1.00 0.00 H TER 37649 WAT 6992 ATOM 37649 O WAT 6993 128.701 12.010 69.430 1.00 0.00 O ATOM 37650 H1 WAT 6993 128.460 11.394 68.737 1.00 0.00 H ATOM 37651 H2 WAT 6993 128.694 12.866 69.002 1.00 0.00 H TER 37653 WAT 6993 ATOM 37653 O WAT 6994 96.273 16.526 134.937 1.00 0.00 O ATOM 37654 H1 WAT 6994 96.004 15.704 135.347 1.00 0.00 H ATOM 37655 H2 WAT 6994 95.527 16.777 134.392 1.00 0.00 H TER 37657 WAT 6994 ATOM 37657 O WAT 6995 56.948 103.609 126.634 1.00 0.00 O ATOM 37658 H1 WAT 6995 56.910 104.200 125.882 1.00 0.00 H ATOM 37659 H2 WAT 6995 56.156 103.807 127.135 1.00 0.00 H TER 37661 WAT 6995 ATOM 37661 O WAT 6996 12.019 102.352 143.459 1.00 0.00 O ATOM 37662 H1 WAT 6996 12.109 101.962 142.590 1.00 0.00 H ATOM 37663 H2 WAT 6996 12.817 102.095 143.921 1.00 0.00 H TER 37665 WAT 6996 ATOM 37665 O WAT 6997 4.908 132.499 73.232 1.00 0.00 O ATOM 37666 H1 WAT 6997 4.706 132.254 72.328 1.00 0.00 H ATOM 37667 H2 WAT 6997 5.297 133.370 73.163 1.00 0.00 H TER 37669 WAT 6997 ATOM 37669 O WAT 6998 72.690 71.668 115.144 1.00 0.00 O ATOM 37670 H1 WAT 6998 71.808 71.368 114.920 1.00 0.00 H ATOM 37671 H2 WAT 6998 72.549 72.473 115.643 1.00 0.00 H TER 37673 WAT 6998 ATOM 37673 O WAT 6999 93.906 96.736 79.727 1.00 0.00 O ATOM 37674 H1 WAT 6999 94.642 97.259 80.044 1.00 0.00 H ATOM 37675 H2 WAT 6999 93.799 97.002 78.814 1.00 0.00 H TER 37677 WAT 6999 ATOM 37677 O WAT 7000 62.555 107.325 125.624 1.00 0.00 O ATOM 37678 H1 WAT 7000 63.065 106.628 126.035 1.00 0.00 H ATOM 37679 H2 WAT 7000 61.823 106.871 125.206 1.00 0.00 H TER 37681 WAT 7000 ATOM 37681 O WAT 7001 13.205 139.402 133.279 1.00 0.00 O ATOM 37682 H1 WAT 7001 13.991 139.032 133.680 1.00 0.00 H ATOM 37683 H2 WAT 7001 12.857 139.999 133.942 1.00 0.00 H TER 37685 WAT 7001 ATOM 37685 O WAT 7002 10.999 113.838 67.254 1.00 0.00 O ATOM 37686 H1 WAT 7002 10.591 114.211 66.472 1.00 0.00 H ATOM 37687 H2 WAT 7002 11.926 114.059 67.169 1.00 0.00 H TER 37689 WAT 7002 ATOM 37689 O WAT 7003 51.154 113.594 101.577 1.00 0.00 O ATOM 37690 H1 WAT 7003 51.415 113.110 102.360 1.00 0.00 H ATOM 37691 H2 WAT 7003 51.965 113.700 101.079 1.00 0.00 H TER 37693 WAT 7003 ATOM 37693 O WAT 7004 139.802 16.068 145.007 1.00 0.00 O ATOM 37694 H1 WAT 7004 138.958 15.631 144.899 1.00 0.00 H ATOM 37695 H2 WAT 7004 139.948 16.077 145.953 1.00 0.00 H TER 37697 WAT 7004 ATOM 37697 O WAT 7005 29.124 132.111 146.167 1.00 0.00 O ATOM 37698 H1 WAT 7005 28.583 132.602 146.785 1.00 0.00 H ATOM 37699 H2 WAT 7005 28.800 132.371 145.305 1.00 0.00 H TER 37701 WAT 7005 ATOM 37701 O WAT 7006 31.705 16.957 100.103 1.00 0.00 O ATOM 37702 H1 WAT 7006 31.227 16.129 100.144 1.00 0.00 H ATOM 37703 H2 WAT 7006 32.596 16.732 100.370 1.00 0.00 H TER 37705 WAT 7006 ATOM 37705 O WAT 7007 13.380 102.993 101.708 1.00 0.00 O ATOM 37706 H1 WAT 7007 13.962 102.681 102.400 1.00 0.00 H ATOM 37707 H2 WAT 7007 12.499 102.846 102.051 1.00 0.00 H TER 37709 WAT 7007 ATOM 37709 O WAT 7008 2.792 53.166 151.099 1.00 0.00 O ATOM 37710 H1 WAT 7008 2.507 53.817 150.458 1.00 0.00 H ATOM 37711 H2 WAT 7008 2.573 53.553 151.947 1.00 0.00 H TER 37713 WAT 7008 ATOM 37713 O WAT 7009 92.130 103.309 16.690 1.00 0.00 O ATOM 37714 H1 WAT 7009 91.951 104.160 17.092 1.00 0.00 H ATOM 37715 H2 WAT 7009 93.046 103.131 16.903 1.00 0.00 H TER 37717 WAT 7009 ATOM 37717 O WAT 7010 110.920 128.519 140.814 1.00 0.00 O ATOM 37718 H1 WAT 7010 111.593 128.068 140.304 1.00 0.00 H ATOM 37719 H2 WAT 7010 111.410 129.043 141.448 1.00 0.00 H TER 37721 WAT 7010 ATOM 37721 O WAT 7011 50.260 10.151 129.292 1.00 0.00 O ATOM 37722 H1 WAT 7011 49.758 10.181 128.478 1.00 0.00 H ATOM 37723 H2 WAT 7011 49.597 10.137 129.982 1.00 0.00 H TER 37725 WAT 7011 ATOM 37725 O WAT 7012 19.481 108.049 124.134 1.00 0.00 O ATOM 37726 H1 WAT 7012 19.526 108.978 123.909 1.00 0.00 H ATOM 37727 H2 WAT 7012 18.569 107.909 124.391 1.00 0.00 H TER 37729 WAT 7012 ATOM 37729 O WAT 7013 11.397 50.500 145.757 1.00 0.00 O ATOM 37730 H1 WAT 7013 12.026 50.687 145.060 1.00 0.00 H ATOM 37731 H2 WAT 7013 11.419 51.278 146.314 1.00 0.00 H TER 37733 WAT 7013 ATOM 37733 O WAT 7014 131.611 57.663 99.864 1.00 0.00 O ATOM 37734 H1 WAT 7014 130.982 57.290 100.482 1.00 0.00 H ATOM 37735 H2 WAT 7014 132.467 57.444 100.232 1.00 0.00 H TER 37737 WAT 7014 ATOM 37737 O WAT 7015 43.677 98.323 6.699 1.00 0.00 O ATOM 37738 H1 WAT 7015 43.377 98.305 7.608 1.00 0.00 H ATOM 37739 H2 WAT 7015 43.783 97.401 6.463 1.00 0.00 H TER 37741 WAT 7015 ATOM 37741 O WAT 7016 124.141 100.320 152.224 1.00 0.00 O ATOM 37742 H1 WAT 7016 123.230 100.050 152.341 1.00 0.00 H ATOM 37743 H2 WAT 7016 124.649 99.523 152.380 1.00 0.00 H TER 37745 WAT 7016 ATOM 37745 O WAT 7017 32.957 112.628 120.460 1.00 0.00 O ATOM 37746 H1 WAT 7017 32.234 112.145 120.060 1.00 0.00 H ATOM 37747 H2 WAT 7017 33.502 112.898 119.720 1.00 0.00 H TER 37749 WAT 7017 ATOM 37749 O WAT 7018 31.361 34.698 85.486 1.00 0.00 O ATOM 37750 H1 WAT 7018 30.905 34.009 85.970 1.00 0.00 H ATOM 37751 H2 WAT 7018 31.085 35.511 85.909 1.00 0.00 H TER 37753 WAT 7018 ATOM 37753 O WAT 7019 25.784 125.685 91.375 1.00 0.00 O ATOM 37754 H1 WAT 7019 25.378 125.777 90.512 1.00 0.00 H ATOM 37755 H2 WAT 7019 25.632 124.771 91.615 1.00 0.00 H TER 37757 WAT 7019 ATOM 37757 O WAT 7020 104.150 51.286 5.188 1.00 0.00 O ATOM 37758 H1 WAT 7020 103.973 50.387 5.466 1.00 0.00 H ATOM 37759 H2 WAT 7020 103.700 51.370 4.347 1.00 0.00 H TER 37761 WAT 7020 ATOM 37761 O WAT 7021 137.310 32.604 148.588 1.00 0.00 O ATOM 37762 H1 WAT 7021 138.198 32.663 148.236 1.00 0.00 H ATOM 37763 H2 WAT 7021 136.873 33.395 148.272 1.00 0.00 H TER 37765 WAT 7021 ATOM 37765 O WAT 7022 103.097 139.307 74.907 1.00 0.00 O ATOM 37766 H1 WAT 7022 104.028 139.195 75.099 1.00 0.00 H ATOM 37767 H2 WAT 7022 103.060 139.420 73.957 1.00 0.00 H TER 37769 WAT 7022 ATOM 37769 O WAT 7023 67.876 137.913 108.970 1.00 0.00 O ATOM 37770 H1 WAT 7023 68.195 137.892 109.873 1.00 0.00 H ATOM 37771 H2 WAT 7023 67.393 137.093 108.868 1.00 0.00 H TER 37773 WAT 7023 ATOM 37773 O WAT 7024 19.997 77.655 106.401 1.00 0.00 O ATOM 37774 H1 WAT 7024 19.734 77.551 107.315 1.00 0.00 H ATOM 37775 H2 WAT 7024 19.945 78.598 106.243 1.00 0.00 H TER 37777 WAT 7024 ATOM 37777 O WAT 7025 105.841 64.183 14.254 1.00 0.00 O ATOM 37778 H1 WAT 7025 105.515 63.587 14.928 1.00 0.00 H ATOM 37779 H2 WAT 7025 105.062 64.431 13.756 1.00 0.00 H TER 37781 WAT 7025 ATOM 37781 O WAT 7026 102.878 64.446 143.099 1.00 0.00 O ATOM 37782 H1 WAT 7026 102.357 63.837 142.576 1.00 0.00 H ATOM 37783 H2 WAT 7026 103.488 64.838 142.474 1.00 0.00 H TER 37785 WAT 7026 ATOM 37785 O WAT 7027 27.991 85.745 145.799 1.00 0.00 O ATOM 37786 H1 WAT 7027 28.095 85.415 144.906 1.00 0.00 H ATOM 37787 H2 WAT 7027 28.158 86.685 145.727 1.00 0.00 H TER 37789 WAT 7027 ATOM 37789 O WAT 7028 66.750 52.613 117.496 1.00 0.00 O ATOM 37790 H1 WAT 7028 67.536 53.028 117.850 1.00 0.00 H ATOM 37791 H2 WAT 7028 66.820 52.734 116.549 1.00 0.00 H TER 37793 WAT 7028 ATOM 37793 O WAT 7029 98.101 78.823 136.675 1.00 0.00 O ATOM 37794 H1 WAT 7029 97.281 78.971 136.203 1.00 0.00 H ATOM 37795 H2 WAT 7029 97.869 78.927 137.597 1.00 0.00 H TER 37797 WAT 7029 ATOM 37797 O WAT 7030 15.453 99.669 65.768 1.00 0.00 O ATOM 37798 H1 WAT 7030 15.364 99.578 66.717 1.00 0.00 H ATOM 37799 H2 WAT 7030 16.257 100.174 65.650 1.00 0.00 H TER 37801 WAT 7030 ATOM 37801 O WAT 7031 10.217 128.846 147.249 1.00 0.00 O ATOM 37802 H1 WAT 7031 9.358 129.193 147.007 1.00 0.00 H ATOM 37803 H2 WAT 7031 10.037 127.961 147.567 1.00 0.00 H TER 37805 WAT 7031 ATOM 37805 O WAT 7032 118.483 80.356 156.023 1.00 0.00 O ATOM 37806 H1 WAT 7032 118.669 81.173 155.561 1.00 0.00 H ATOM 37807 H2 WAT 7032 117.529 80.278 155.998 1.00 0.00 H TER 37809 WAT 7032 ATOM 37809 O WAT 7033 9.126 135.499 60.944 1.00 0.00 O ATOM 37810 H1 WAT 7033 9.633 135.514 60.132 1.00 0.00 H ATOM 37811 H2 WAT 7033 8.272 135.153 60.687 1.00 0.00 H TER 37813 WAT 7033 ATOM 37813 O WAT 7034 103.156 6.018 119.177 1.00 0.00 O ATOM 37814 H1 WAT 7034 102.612 6.558 118.604 1.00 0.00 H ATOM 37815 H2 WAT 7034 103.878 5.728 118.619 1.00 0.00 H TER 37817 WAT 7034 ATOM 37817 O WAT 7035 56.790 54.508 134.139 1.00 0.00 O ATOM 37818 H1 WAT 7035 56.410 53.884 134.757 1.00 0.00 H ATOM 37819 H2 WAT 7035 57.576 54.832 134.580 1.00 0.00 H TER 37821 WAT 7035 ATOM 37821 O WAT 7036 16.645 26.826 4.211 1.00 0.00 O ATOM 37822 H1 WAT 7036 15.801 27.098 3.851 1.00 0.00 H ATOM 37823 H2 WAT 7036 17.229 27.565 4.039 1.00 0.00 H TER 37825 WAT 7036 ATOM 37825 O WAT 7037 143.872 38.529 94.484 1.00 0.00 O ATOM 37826 H1 WAT 7037 144.249 38.502 95.364 1.00 0.00 H ATOM 37827 H2 WAT 7037 143.809 39.462 94.280 1.00 0.00 H TER 37829 WAT 7037 ATOM 37829 O WAT 7038 19.423 135.142 99.223 1.00 0.00 O ATOM 37830 H1 WAT 7038 19.759 135.574 98.438 1.00 0.00 H ATOM 37831 H2 WAT 7038 18.824 135.780 99.610 1.00 0.00 H TER 37833 WAT 7038 ATOM 37833 O WAT 7039 51.026 20.030 2.205 1.00 0.00 O ATOM 37834 H1 WAT 7039 50.772 20.630 2.906 1.00 0.00 H ATOM 37835 H2 WAT 7039 51.842 19.636 2.512 1.00 0.00 H TER 37837 WAT 7039 ATOM 37837 O WAT 7040 91.157 83.636 80.703 1.00 0.00 O ATOM 37838 H1 WAT 7040 91.631 84.120 80.027 1.00 0.00 H ATOM 37839 H2 WAT 7040 90.297 84.054 80.738 1.00 0.00 H TER 37841 WAT 7040 ATOM 37841 O WAT 7041 65.400 100.085 71.188 1.00 0.00 O ATOM 37842 H1 WAT 7041 66.011 100.725 71.554 1.00 0.00 H ATOM 37843 H2 WAT 7041 64.634 100.130 71.760 1.00 0.00 H TER 37845 WAT 7041 ATOM 37845 O WAT 7042 7.145 18.654 138.852 1.00 0.00 O ATOM 37846 H1 WAT 7042 7.360 18.890 137.950 1.00 0.00 H ATOM 37847 H2 WAT 7042 6.330 19.121 139.034 1.00 0.00 H TER 37849 WAT 7042 ATOM 37849 O WAT 7043 98.660 127.414 152.821 1.00 0.00 O ATOM 37850 H1 WAT 7043 97.830 127.824 153.063 1.00 0.00 H ATOM 37851 H2 WAT 7043 99.189 128.131 152.473 1.00 0.00 H TER 37853 WAT 7043 ATOM 37853 O WAT 7044 80.981 124.307 138.527 1.00 0.00 O ATOM 37854 H1 WAT 7044 80.827 123.529 137.992 1.00 0.00 H ATOM 37855 H2 WAT 7044 81.052 123.973 139.422 1.00 0.00 H TER 37857 WAT 7044 ATOM 37857 O WAT 7045 44.243 144.034 140.201 1.00 0.00 O ATOM 37858 H1 WAT 7045 44.976 144.635 140.068 1.00 0.00 H ATOM 37859 H2 WAT 7045 44.471 143.549 140.994 1.00 0.00 H TER 37861 WAT 7045 ATOM 37861 O WAT 7046 108.083 81.913 91.511 1.00 0.00 O ATOM 37862 H1 WAT 7046 107.494 81.341 91.019 1.00 0.00 H ATOM 37863 H2 WAT 7046 107.852 81.764 92.428 1.00 0.00 H TER 37865 WAT 7046 ATOM 37865 O WAT 7047 22.450 143.071 67.327 1.00 0.00 O ATOM 37866 H1 WAT 7047 23.180 143.448 66.837 1.00 0.00 H ATOM 37867 H2 WAT 7047 21.940 142.596 66.670 1.00 0.00 H TER 37869 WAT 7047 ATOM 37869 O WAT 7048 6.437 100.687 84.521 1.00 0.00 O ATOM 37870 H1 WAT 7048 7.363 100.638 84.281 1.00 0.00 H ATOM 37871 H2 WAT 7048 5.972 100.685 83.685 1.00 0.00 H TER 37873 WAT 7048 ATOM 37873 O WAT 7049 3.695 102.673 84.600 1.00 0.00 O ATOM 37874 H1 WAT 7049 4.342 102.616 83.897 1.00 0.00 H ATOM 37875 H2 WAT 7049 4.204 102.567 85.404 1.00 0.00 H TER 37877 WAT 7049 ATOM 37877 O WAT 7050 136.468 3.782 67.678 1.00 0.00 O ATOM 37878 H1 WAT 7050 136.318 2.838 67.638 1.00 0.00 H ATOM 37879 H2 WAT 7050 137.420 3.876 67.645 1.00 0.00 H TER 37881 WAT 7050 ATOM 37881 O WAT 7051 41.219 0.675 113.100 1.00 0.00 O ATOM 37882 H1 WAT 7051 42.154 0.601 112.909 1.00 0.00 H ATOM 37883 H2 WAT 7051 41.181 0.900 114.029 1.00 0.00 H TER 37885 WAT 7051 ATOM 37885 O WAT 7052 74.863 113.640 82.077 1.00 0.00 O ATOM 37886 H1 WAT 7052 74.197 114.223 81.712 1.00 0.00 H ATOM 37887 H2 WAT 7052 75.690 113.972 81.728 1.00 0.00 H TER 37889 WAT 7052 ATOM 37889 O WAT 7053 45.833 145.115 85.366 1.00 0.00 O ATOM 37890 H1 WAT 7053 44.893 145.013 85.221 1.00 0.00 H ATOM 37891 H2 WAT 7053 45.901 145.472 86.252 1.00 0.00 H TER 37893 WAT 7053 ATOM 37893 O WAT 7054 142.341 21.831 135.963 1.00 0.00 O ATOM 37894 H1 WAT 7054 142.044 22.741 135.966 1.00 0.00 H ATOM 37895 H2 WAT 7054 141.545 21.319 135.820 1.00 0.00 H TER 37897 WAT 7054 ATOM 37897 O WAT 7055 67.883 116.986 122.667 1.00 0.00 O ATOM 37898 H1 WAT 7055 67.623 116.492 121.889 1.00 0.00 H ATOM 37899 H2 WAT 7055 67.073 117.392 122.975 1.00 0.00 H TER 37901 WAT 7055 ATOM 37901 O WAT 7056 98.585 93.727 96.194 1.00 0.00 O ATOM 37902 H1 WAT 7056 99.254 93.122 95.875 1.00 0.00 H ATOM 37903 H2 WAT 7056 99.076 94.499 96.477 1.00 0.00 H TER 37905 WAT 7056 ATOM 37905 O WAT 7057 142.645 125.587 70.959 1.00 0.00 O ATOM 37906 H1 WAT 7057 142.122 124.876 71.328 1.00 0.00 H ATOM 37907 H2 WAT 7057 143.105 125.962 71.710 1.00 0.00 H TER 37909 WAT 7057 ATOM 37909 O WAT 7058 34.026 8.594 157.455 1.00 0.00 O ATOM 37910 H1 WAT 7058 34.118 8.347 158.376 1.00 0.00 H ATOM 37911 H2 WAT 7058 34.917 8.791 157.169 1.00 0.00 H TER 37913 WAT 7058 ATOM 37913 O WAT 7059 62.728 12.030 129.776 1.00 0.00 O ATOM 37914 H1 WAT 7059 62.959 11.123 129.979 1.00 0.00 H ATOM 37915 H2 WAT 7059 63.463 12.544 130.109 1.00 0.00 H TER 37917 WAT 7059 ATOM 37917 O WAT 7060 137.628 32.355 98.999 1.00 0.00 O ATOM 37918 H1 WAT 7060 137.987 31.469 98.946 1.00 0.00 H ATOM 37919 H2 WAT 7060 137.124 32.361 99.813 1.00 0.00 H TER 37921 WAT 7060 ATOM 37921 O WAT 7061 65.368 111.339 80.294 1.00 0.00 O ATOM 37922 H1 WAT 7061 66.071 111.171 79.667 1.00 0.00 H ATOM 37923 H2 WAT 7061 65.821 111.543 81.113 1.00 0.00 H TER 37925 WAT 7061 ATOM 37925 O WAT 7062 96.757 127.620 139.064 1.00 0.00 O ATOM 37926 H1 WAT 7062 96.961 126.709 139.274 1.00 0.00 H ATOM 37927 H2 WAT 7062 97.196 127.777 138.228 1.00 0.00 H TER 37929 WAT 7062 ATOM 37929 O WAT 7063 11.913 65.601 88.805 1.00 0.00 O ATOM 37930 H1 WAT 7063 12.350 66.236 89.372 1.00 0.00 H ATOM 37931 H2 WAT 7063 12.445 65.585 88.009 1.00 0.00 H TER 37933 WAT 7063 ATOM 37933 O WAT 7064 102.220 13.222 51.491 1.00 0.00 O ATOM 37934 H1 WAT 7064 103.146 13.365 51.295 1.00 0.00 H ATOM 37935 H2 WAT 7064 101.769 13.402 50.666 1.00 0.00 H TER 37937 WAT 7064 ATOM 37937 O WAT 7065 62.269 23.183 3.637 1.00 0.00 O ATOM 37938 H1 WAT 7065 62.815 22.985 2.876 1.00 0.00 H ATOM 37939 H2 WAT 7065 62.663 23.968 4.017 1.00 0.00 H TER 37941 WAT 7065 ATOM 37941 O WAT 7066 55.004 106.235 154.275 1.00 0.00 O ATOM 37942 H1 WAT 7066 54.859 107.071 154.718 1.00 0.00 H ATOM 37943 H2 WAT 7066 55.467 106.467 153.471 1.00 0.00 H TER 37945 WAT 7066 ATOM 37945 O WAT 7067 126.340 117.964 126.937 1.00 0.00 O ATOM 37946 H1 WAT 7067 127.225 118.321 126.851 1.00 0.00 H ATOM 37947 H2 WAT 7067 126.416 117.060 126.634 1.00 0.00 H TER 37949 WAT 7067 ATOM 37949 O WAT 7068 125.798 61.301 9.708 1.00 0.00 O ATOM 37950 H1 WAT 7068 125.981 60.455 10.115 1.00 0.00 H ATOM 37951 H2 WAT 7068 125.400 61.081 8.866 1.00 0.00 H TER 37953 WAT 7068 ATOM 37953 O WAT 7069 70.641 38.397 59.339 1.00 0.00 O ATOM 37954 H1 WAT 7069 71.539 38.412 59.669 1.00 0.00 H ATOM 37955 H2 WAT 7069 70.480 39.292 59.041 1.00 0.00 H TER 37957 WAT 7069 ATOM 37957 O WAT 7070 138.498 66.252 136.276 1.00 0.00 O ATOM 37958 H1 WAT 7070 139.225 66.875 136.255 1.00 0.00 H ATOM 37959 H2 WAT 7070 138.787 65.567 136.878 1.00 0.00 H TER 37961 WAT 7070 ATOM 37961 O WAT 7071 39.343 138.943 57.334 1.00 0.00 O ATOM 37962 H1 WAT 7071 38.441 138.715 57.107 1.00 0.00 H ATOM 37963 H2 WAT 7071 39.482 139.801 56.931 1.00 0.00 H TER 37965 WAT 7071 ATOM 37965 O WAT 7072 109.067 2.945 1.407 1.00 0.00 O ATOM 37966 H1 WAT 7072 108.554 2.220 1.764 1.00 0.00 H ATOM 37967 H2 WAT 7072 108.649 3.144 0.569 1.00 0.00 H TER 37969 WAT 7072 ATOM 37969 O WAT 7073 92.117 12.501 102.369 1.00 0.00 O ATOM 37970 H1 WAT 7073 92.099 13.449 102.235 1.00 0.00 H ATOM 37971 H2 WAT 7073 92.413 12.393 103.273 1.00 0.00 H TER 37973 WAT 7073 ATOM 37973 O WAT 7074 55.351 52.027 120.323 1.00 0.00 O ATOM 37974 H1 WAT 7074 54.696 51.430 120.684 1.00 0.00 H ATOM 37975 H2 WAT 7074 55.903 51.472 119.771 1.00 0.00 H TER 37977 WAT 7074 ATOM 37977 O WAT 7075 128.264 2.922 84.829 1.00 0.00 O ATOM 37978 H1 WAT 7075 128.673 2.550 84.047 1.00 0.00 H ATOM 37979 H2 WAT 7075 127.771 3.676 84.506 1.00 0.00 H TER 37981 WAT 7075 ATOM 37981 O WAT 7076 95.921 51.286 136.969 1.00 0.00 O ATOM 37982 H1 WAT 7076 96.192 50.418 136.671 1.00 0.00 H ATOM 37983 H2 WAT 7076 96.534 51.887 136.544 1.00 0.00 H TER 37985 WAT 7076 ATOM 37985 O WAT 7077 57.310 131.082 11.384 1.00 0.00 O ATOM 37986 H1 WAT 7077 58.210 131.236 11.097 1.00 0.00 H ATOM 37987 H2 WAT 7077 57.397 130.525 12.157 1.00 0.00 H TER 37989 WAT 7077 ATOM 37989 O WAT 7078 27.962 10.596 129.686 1.00 0.00 O ATOM 37990 H1 WAT 7078 28.571 10.061 129.177 1.00 0.00 H ATOM 37991 H2 WAT 7078 28.490 10.940 130.407 1.00 0.00 H TER 37993 WAT 7078 ATOM 37993 O WAT 7079 49.991 84.680 120.128 1.00 0.00 O ATOM 37994 H1 WAT 7079 49.252 84.660 120.735 1.00 0.00 H ATOM 37995 H2 WAT 7079 49.996 83.811 119.727 1.00 0.00 H TER 37997 WAT 7079 ATOM 37997 O WAT 7080 98.407 57.321 108.172 1.00 0.00 O ATOM 37998 H1 WAT 7080 98.557 56.508 108.655 1.00 0.00 H ATOM 37999 H2 WAT 7080 99.208 57.449 107.663 1.00 0.00 H TER 38001 WAT 7080 ATOM 38001 O WAT 7081 54.903 34.492 147.599 1.00 0.00 O ATOM 38002 H1 WAT 7081 54.430 35.119 147.051 1.00 0.00 H ATOM 38003 H2 WAT 7081 54.340 33.718 147.618 1.00 0.00 H TER 38005 WAT 7081 ATOM 38005 O WAT 7082 26.815 8.840 155.557 1.00 0.00 O ATOM 38006 H1 WAT 7082 26.995 9.525 156.200 1.00 0.00 H ATOM 38007 H2 WAT 7082 26.515 8.095 156.078 1.00 0.00 H TER 38009 WAT 7082 ATOM 38009 O WAT 7083 145.071 126.959 94.959 1.00 0.00 O ATOM 38010 H1 WAT 7083 145.574 127.742 94.735 1.00 0.00 H ATOM 38011 H2 WAT 7083 144.833 126.577 94.115 1.00 0.00 H TER 38013 WAT 7083 ATOM 38013 O WAT 7084 116.186 79.408 118.091 1.00 0.00 O ATOM 38014 H1 WAT 7084 116.410 80.301 117.828 1.00 0.00 H ATOM 38015 H2 WAT 7084 116.796 78.854 117.603 1.00 0.00 H TER 38017 WAT 7084 ATOM 38017 O WAT 7085 17.289 30.114 134.344 1.00 0.00 O ATOM 38018 H1 WAT 7085 16.575 30.740 134.461 1.00 0.00 H ATOM 38019 H2 WAT 7085 16.869 29.339 133.971 1.00 0.00 H TER 38021 WAT 7085 ATOM 38021 O WAT 7086 19.134 94.092 149.783 1.00 0.00 O ATOM 38022 H1 WAT 7086 19.752 94.500 149.176 1.00 0.00 H ATOM 38023 H2 WAT 7086 19.673 93.821 150.526 1.00 0.00 H TER 38025 WAT 7086 ATOM 38025 O WAT 7087 121.055 32.100 126.710 1.00 0.00 O ATOM 38026 H1 WAT 7087 121.955 32.030 127.027 1.00 0.00 H ATOM 38027 H2 WAT 7087 120.567 32.459 127.451 1.00 0.00 H TER 38029 WAT 7087 ATOM 38029 O WAT 7088 18.932 107.723 105.921 1.00 0.00 O ATOM 38030 H1 WAT 7088 18.367 107.443 105.201 1.00 0.00 H ATOM 38031 H2 WAT 7088 18.735 108.653 106.032 1.00 0.00 H TER 38033 WAT 7088 ATOM 38033 O WAT 7089 34.161 68.029 119.870 1.00 0.00 O ATOM 38034 H1 WAT 7089 34.960 67.668 119.486 1.00 0.00 H ATOM 38035 H2 WAT 7089 34.471 68.617 120.559 1.00 0.00 H TER 38037 WAT 7089 ATOM 38037 O WAT 7090 38.655 98.041 149.727 1.00 0.00 O ATOM 38038 H1 WAT 7090 39.225 97.272 149.713 1.00 0.00 H ATOM 38039 H2 WAT 7090 38.724 98.407 148.846 1.00 0.00 H TER 38041 WAT 7090 ATOM 38041 O WAT 7091 29.600 0.969 112.432 1.00 0.00 O ATOM 38042 H1 WAT 7091 30.454 0.690 112.762 1.00 0.00 H ATOM 38043 H2 WAT 7091 29.756 1.840 112.069 1.00 0.00 H TER 38045 WAT 7091 ATOM 38045 O WAT 7092 91.218 122.972 20.152 1.00 0.00 O ATOM 38046 H1 WAT 7092 90.737 122.213 19.821 1.00 0.00 H ATOM 38047 H2 WAT 7092 90.992 123.012 21.081 1.00 0.00 H TER 38049 WAT 7092 ATOM 38049 O WAT 7093 8.659 2.487 3.857 1.00 0.00 O ATOM 38050 H1 WAT 7093 8.665 1.539 3.720 1.00 0.00 H ATOM 38051 H2 WAT 7093 9.483 2.669 4.309 1.00 0.00 H TER 38053 WAT 7093 ATOM 38053 O WAT 7094 8.718 53.670 157.854 1.00 0.00 O ATOM 38054 H1 WAT 7094 8.508 53.219 158.672 1.00 0.00 H ATOM 38055 H2 WAT 7094 9.459 53.183 157.495 1.00 0.00 H TER 38057 WAT 7094 ATOM 38057 O WAT 7095 137.445 30.964 108.109 1.00 0.00 O ATOM 38058 H1 WAT 7095 137.858 31.656 108.625 1.00 0.00 H ATOM 38059 H2 WAT 7095 136.750 30.626 108.673 1.00 0.00 H TER 38061 WAT 7095 ATOM 38061 O WAT 7096 7.345 138.111 77.077 1.00 0.00 O ATOM 38062 H1 WAT 7096 7.315 138.923 77.584 1.00 0.00 H ATOM 38063 H2 WAT 7096 7.591 137.441 77.714 1.00 0.00 H TER 38065 WAT 7096 ATOM 38065 O WAT 7097 56.619 52.873 67.212 1.00 0.00 O ATOM 38066 H1 WAT 7097 57.325 52.432 67.683 1.00 0.00 H ATOM 38067 H2 WAT 7097 56.904 52.874 66.298 1.00 0.00 H TER 38069 WAT 7097 ATOM 38069 O WAT 7098 123.243 53.036 14.151 1.00 0.00 O ATOM 38070 H1 WAT 7098 122.866 52.158 14.085 1.00 0.00 H ATOM 38071 H2 WAT 7098 123.399 53.298 13.244 1.00 0.00 H TER 38073 WAT 7098 ATOM 38073 O WAT 7099 77.304 103.907 68.224 1.00 0.00 O ATOM 38074 H1 WAT 7099 77.541 102.982 68.157 1.00 0.00 H ATOM 38075 H2 WAT 7099 77.850 104.343 67.570 1.00 0.00 H TER 38077 WAT 7099 ATOM 38077 O WAT 7100 11.688 55.500 154.428 1.00 0.00 O ATOM 38078 H1 WAT 7100 11.506 55.363 155.358 1.00 0.00 H ATOM 38079 H2 WAT 7100 10.884 55.232 153.984 1.00 0.00 H TER 38081 WAT 7100 ATOM 38081 O WAT 7101 83.759 31.244 152.206 1.00 0.00 O ATOM 38082 H1 WAT 7101 83.733 32.072 151.726 1.00 0.00 H ATOM 38083 H2 WAT 7101 84.381 30.704 151.719 1.00 0.00 H TER 38085 WAT 7101 ATOM 38085 O WAT 7102 44.189 144.509 114.358 1.00 0.00 O ATOM 38086 H1 WAT 7102 43.703 143.778 113.977 1.00 0.00 H ATOM 38087 H2 WAT 7102 44.712 144.112 115.054 1.00 0.00 H TER 38089 WAT 7102 ATOM 38089 O WAT 7103 136.955 17.768 118.615 1.00 0.00 O ATOM 38090 H1 WAT 7103 136.516 17.267 117.927 1.00 0.00 H ATOM 38091 H2 WAT 7103 137.605 18.295 118.150 1.00 0.00 H TER 38093 WAT 7103 ATOM 38093 O WAT 7104 3.801 36.686 130.845 1.00 0.00 O ATOM 38094 H1 WAT 7104 3.265 36.952 130.098 1.00 0.00 H ATOM 38095 H2 WAT 7104 4.388 36.017 130.492 1.00 0.00 H TER 38097 WAT 7104 ATOM 38097 O WAT 7105 66.487 41.628 153.621 1.00 0.00 O ATOM 38098 H1 WAT 7105 66.189 41.170 152.835 1.00 0.00 H ATOM 38099 H2 WAT 7105 67.188 41.077 153.968 1.00 0.00 H TER 38101 WAT 7105 ATOM 38101 O WAT 7106 123.140 52.377 118.154 1.00 0.00 O ATOM 38102 H1 WAT 7106 123.443 52.349 117.247 1.00 0.00 H ATOM 38103 H2 WAT 7106 122.933 53.299 118.308 1.00 0.00 H TER 38105 WAT 7106 ATOM 38105 O WAT 7107 28.084 130.351 23.160 1.00 0.00 O ATOM 38106 H1 WAT 7107 27.797 129.662 22.561 1.00 0.00 H ATOM 38107 H2 WAT 7107 27.646 131.141 22.842 1.00 0.00 H TER 38109 WAT 7107 ATOM 38109 O WAT 7108 143.071 105.372 7.344 1.00 0.00 O ATOM 38110 H1 WAT 7108 143.304 104.680 6.725 1.00 0.00 H ATOM 38111 H2 WAT 7108 142.784 106.100 6.793 1.00 0.00 H TER 38113 WAT 7108 ATOM 38113 O WAT 7109 79.036 114.089 134.191 1.00 0.00 O ATOM 38114 H1 WAT 7109 78.831 114.588 133.400 1.00 0.00 H ATOM 38115 H2 WAT 7109 78.771 114.662 134.910 1.00 0.00 H TER 38117 WAT 7109 ATOM 38117 O WAT 7110 40.488 127.137 5.835 1.00 0.00 O ATOM 38118 H1 WAT 7110 41.089 127.872 5.956 1.00 0.00 H ATOM 38119 H2 WAT 7110 40.174 127.229 4.936 1.00 0.00 H TER 38121 WAT 7110 ATOM 38121 O WAT 7111 145.614 7.240 100.950 1.00 0.00 O ATOM 38122 H1 WAT 7111 146.329 6.717 100.590 1.00 0.00 H ATOM 38123 H2 WAT 7111 145.780 7.258 101.892 1.00 0.00 H TER 38125 WAT 7111 ATOM 38125 O WAT 7112 82.776 85.835 118.405 1.00 0.00 O ATOM 38126 H1 WAT 7112 81.906 85.479 118.584 1.00 0.00 H ATOM 38127 H2 WAT 7112 83.025 85.450 117.565 1.00 0.00 H TER 38129 WAT 7112 ATOM 38129 O WAT 7113 113.094 97.128 63.832 1.00 0.00 O ATOM 38130 H1 WAT 7113 112.319 97.649 64.043 1.00 0.00 H ATOM 38131 H2 WAT 7113 112.746 96.342 63.411 1.00 0.00 H TER 38133 WAT 7113 ATOM 38133 O WAT 7114 51.273 30.872 79.054 1.00 0.00 O ATOM 38134 H1 WAT 7114 51.714 31.283 78.309 1.00 0.00 H ATOM 38135 H2 WAT 7114 51.860 31.026 79.794 1.00 0.00 H TER 38137 WAT 7114 ATOM 38137 O WAT 7115 28.587 24.886 58.471 1.00 0.00 O ATOM 38138 H1 WAT 7115 28.924 25.161 59.323 1.00 0.00 H ATOM 38139 H2 WAT 7115 29.355 24.884 57.899 1.00 0.00 H TER 38141 WAT 7115 ATOM 38141 O WAT 7116 65.683 80.915 18.784 1.00 0.00 O ATOM 38142 H1 WAT 7116 65.133 80.838 18.004 1.00 0.00 H ATOM 38143 H2 WAT 7116 66.516 81.253 18.457 1.00 0.00 H TER 38145 WAT 7116 ATOM 38145 O WAT 7117 123.244 26.878 78.085 1.00 0.00 O ATOM 38146 H1 WAT 7117 124.176 26.837 77.870 1.00 0.00 H ATOM 38147 H2 WAT 7117 122.850 26.166 77.580 1.00 0.00 H TER 38149 WAT 7117 ATOM 38149 O WAT 7118 43.207 34.039 91.298 1.00 0.00 O ATOM 38150 H1 WAT 7118 43.898 33.645 91.831 1.00 0.00 H ATOM 38151 H2 WAT 7118 43.609 34.825 90.929 1.00 0.00 H TER 38153 WAT 7118 ATOM 38153 O WAT 7119 98.546 34.139 114.529 1.00 0.00 O ATOM 38154 H1 WAT 7119 98.082 33.539 115.112 1.00 0.00 H ATOM 38155 H2 WAT 7119 98.820 34.860 115.095 1.00 0.00 H TER 38157 WAT 7119 ATOM 38157 O WAT 7120 62.070 25.192 114.924 1.00 0.00 O ATOM 38158 H1 WAT 7120 61.654 25.972 115.291 1.00 0.00 H ATOM 38159 H2 WAT 7120 62.603 25.522 114.201 1.00 0.00 H TER 38161 WAT 7120 ATOM 38161 O WAT 7121 49.258 57.505 64.199 1.00 0.00 O ATOM 38162 H1 WAT 7121 49.143 57.731 65.122 1.00 0.00 H ATOM 38163 H2 WAT 7121 48.754 56.700 64.085 1.00 0.00 H TER 38165 WAT 7121 ATOM 38165 O WAT 7122 48.479 6.458 78.531 1.00 0.00 O ATOM 38166 H1 WAT 7122 47.653 6.159 78.911 1.00 0.00 H ATOM 38167 H2 WAT 7122 48.253 7.270 78.076 1.00 0.00 H TER 38169 WAT 7122 ATOM 38169 O WAT 7123 82.862 64.387 151.318 1.00 0.00 O ATOM 38170 H1 WAT 7123 83.030 64.962 150.571 1.00 0.00 H ATOM 38171 H2 WAT 7123 81.937 64.525 151.523 1.00 0.00 H TER 38173 WAT 7123 ATOM 38173 O WAT 7124 77.662 134.462 121.510 1.00 0.00 O ATOM 38174 H1 WAT 7124 77.127 135.144 121.916 1.00 0.00 H ATOM 38175 H2 WAT 7124 78.342 134.273 122.156 1.00 0.00 H TER 38177 WAT 7124 ATOM 38177 O WAT 7125 124.518 59.494 18.058 1.00 0.00 O ATOM 38178 H1 WAT 7125 123.771 59.571 17.465 1.00 0.00 H ATOM 38179 H2 WAT 7125 124.400 58.645 18.484 1.00 0.00 H TER 38181 WAT 7125 ATOM 38181 O WAT 7126 19.679 6.341 80.674 1.00 0.00 O ATOM 38182 H1 WAT 7126 19.421 6.848 79.904 1.00 0.00 H ATOM 38183 H2 WAT 7126 19.234 6.771 81.404 1.00 0.00 H TER 38185 WAT 7126 ATOM 38185 O WAT 7127 46.567 40.847 123.928 1.00 0.00 O ATOM 38186 H1 WAT 7127 47.240 41.275 123.398 1.00 0.00 H ATOM 38187 H2 WAT 7127 45.745 41.049 123.482 1.00 0.00 H TER 38189 WAT 7127 ATOM 38189 O WAT 7128 133.108 37.339 74.584 1.00 0.00 O ATOM 38190 H1 WAT 7128 134.004 37.462 74.271 1.00 0.00 H ATOM 38191 H2 WAT 7128 133.194 36.746 75.330 1.00 0.00 H TER 38193 WAT 7128 ATOM 38193 O WAT 7129 112.115 42.915 119.978 1.00 0.00 O ATOM 38194 H1 WAT 7129 112.758 42.448 119.444 1.00 0.00 H ATOM 38195 H2 WAT 7129 112.295 43.841 119.815 1.00 0.00 H TER 38197 WAT 7129 ATOM 38197 O WAT 7130 16.954 97.474 21.164 1.00 0.00 O ATOM 38198 H1 WAT 7130 16.343 96.788 20.895 1.00 0.00 H ATOM 38199 H2 WAT 7130 17.550 97.039 21.774 1.00 0.00 H TER 38201 WAT 7130 ATOM 38201 O WAT 7131 87.586 133.110 63.441 1.00 0.00 O ATOM 38202 H1 WAT 7131 87.513 132.353 62.859 1.00 0.00 H ATOM 38203 H2 WAT 7131 87.836 132.737 64.287 1.00 0.00 H TER 38205 WAT 7131 ATOM 38205 O WAT 7132 6.921 144.547 121.608 1.00 0.00 O ATOM 38206 H1 WAT 7132 7.824 144.805 121.423 1.00 0.00 H ATOM 38207 H2 WAT 7132 6.734 143.857 120.971 1.00 0.00 H TER 38209 WAT 7132 ATOM 38209 O WAT 7133 9.727 129.071 4.929 1.00 0.00 O ATOM 38210 H1 WAT 7133 9.651 128.956 5.876 1.00 0.00 H ATOM 38211 H2 WAT 7133 10.243 128.319 4.638 1.00 0.00 H TER 38213 WAT 7133 ATOM 38213 O WAT 7134 97.438 98.684 91.438 1.00 0.00 O ATOM 38214 H1 WAT 7134 98.385 98.823 91.438 1.00 0.00 H ATOM 38215 H2 WAT 7134 97.213 98.569 90.515 1.00 0.00 H TER 38217 WAT 7134 ATOM 38217 O WAT 7135 75.544 91.489 8.708 1.00 0.00 O ATOM 38218 H1 WAT 7135 75.111 91.849 7.934 1.00 0.00 H ATOM 38219 H2 WAT 7135 74.826 91.243 9.292 1.00 0.00 H TER 38221 WAT 7135 ATOM 38221 O WAT 7136 37.356 73.046 71.385 1.00 0.00 O ATOM 38222 H1 WAT 7136 37.595 73.937 71.129 1.00 0.00 H ATOM 38223 H2 WAT 7136 36.657 73.161 72.028 1.00 0.00 H TER 38225 WAT 7136 ATOM 38225 O WAT 7137 81.632 117.037 111.529 1.00 0.00 O ATOM 38226 H1 WAT 7137 81.690 117.562 110.730 1.00 0.00 H ATOM 38227 H2 WAT 7137 82.469 117.181 111.971 1.00 0.00 H TER 38229 WAT 7137 ATOM 38229 O WAT 7138 107.830 129.627 80.829 1.00 0.00 O ATOM 38230 H1 WAT 7138 108.238 129.407 79.992 1.00 0.00 H ATOM 38231 H2 WAT 7138 108.539 129.556 81.468 1.00 0.00 H TER 38233 WAT 7138 ATOM 38233 O WAT 7139 60.972 47.641 19.405 1.00 0.00 O ATOM 38234 H1 WAT 7139 60.684 46.729 19.358 1.00 0.00 H ATOM 38235 H2 WAT 7139 60.304 48.128 18.922 1.00 0.00 H TER 38237 WAT 7139 ATOM 38237 O WAT 7140 128.450 71.981 111.198 1.00 0.00 O ATOM 38238 H1 WAT 7140 128.691 71.741 110.304 1.00 0.00 H ATOM 38239 H2 WAT 7140 127.665 71.465 111.381 1.00 0.00 H TER 38241 WAT 7140 ATOM 38241 O WAT 7141 54.455 31.311 13.402 1.00 0.00 O ATOM 38242 H1 WAT 7141 54.596 32.229 13.172 1.00 0.00 H ATOM 38243 H2 WAT 7141 53.550 31.278 13.714 1.00 0.00 H TER 38245 WAT 7141 ATOM 38245 O WAT 7142 29.310 114.482 125.899 1.00 0.00 O ATOM 38246 H1 WAT 7142 29.878 115.152 126.279 1.00 0.00 H ATOM 38247 H2 WAT 7142 29.898 113.937 125.377 1.00 0.00 H TER 38249 WAT 7142 ATOM 38249 O WAT 7143 27.449 4.465 81.180 1.00 0.00 O ATOM 38250 H1 WAT 7143 28.254 4.218 80.724 1.00 0.00 H ATOM 38251 H2 WAT 7143 26.856 4.746 80.483 1.00 0.00 H TER 38253 WAT 7143 ATOM 38253 O WAT 7144 61.905 134.053 143.114 1.00 0.00 O ATOM 38254 H1 WAT 7144 61.815 133.160 143.445 1.00 0.00 H ATOM 38255 H2 WAT 7144 61.236 134.125 142.433 1.00 0.00 H TER 38257 WAT 7144 ATOM 38257 O WAT 7145 44.270 60.786 146.963 1.00 0.00 O ATOM 38258 H1 WAT 7145 44.755 61.589 146.772 1.00 0.00 H ATOM 38259 H2 WAT 7145 44.272 60.726 147.918 1.00 0.00 H TER 38261 WAT 7145 ATOM 38261 O WAT 7146 137.792 144.518 8.304 1.00 0.00 O ATOM 38262 H1 WAT 7146 136.879 144.695 8.076 1.00 0.00 H ATOM 38263 H2 WAT 7146 137.968 145.093 9.049 1.00 0.00 H TER 38265 WAT 7146 ATOM 38265 O WAT 7147 112.699 19.698 122.379 1.00 0.00 O ATOM 38266 H1 WAT 7147 112.531 18.822 122.725 1.00 0.00 H ATOM 38267 H2 WAT 7147 112.032 20.249 122.787 1.00 0.00 H TER 38269 WAT 7147 ATOM 38269 O WAT 7148 7.376 114.349 67.553 1.00 0.00 O ATOM 38270 H1 WAT 7148 8.120 114.594 68.104 1.00 0.00 H ATOM 38271 H2 WAT 7148 7.458 114.904 66.778 1.00 0.00 H TER 38273 WAT 7148 ATOM 38273 O WAT 7149 2.935 119.971 142.151 1.00 0.00 O ATOM 38274 H1 WAT 7149 3.090 120.289 141.262 1.00 0.00 H ATOM 38275 H2 WAT 7149 1.982 119.930 142.229 1.00 0.00 H TER 38277 WAT 7149 ATOM 38277 O WAT 7150 58.344 141.931 98.824 1.00 0.00 O ATOM 38278 H1 WAT 7150 59.171 141.690 99.241 1.00 0.00 H ATOM 38279 H2 WAT 7150 58.224 141.277 98.135 1.00 0.00 H TER 38281 WAT 7150 ATOM 38281 O WAT 7151 134.393 136.477 20.672 1.00 0.00 O ATOM 38282 H1 WAT 7151 133.852 136.154 21.393 1.00 0.00 H ATOM 38283 H2 WAT 7151 134.915 137.180 21.060 1.00 0.00 H TER 38285 WAT 7151 ATOM 38285 O WAT 7152 60.625 61.870 155.461 1.00 0.00 O ATOM 38286 H1 WAT 7152 60.678 60.981 155.111 1.00 0.00 H ATOM 38287 H2 WAT 7152 60.333 61.754 156.365 1.00 0.00 H TER 38289 WAT 7152 ATOM 38289 O WAT 7153 38.054 79.381 145.482 1.00 0.00 O ATOM 38290 H1 WAT 7153 38.263 78.872 146.265 1.00 0.00 H ATOM 38291 H2 WAT 7153 37.772 78.729 144.840 1.00 0.00 H TER 38293 WAT 7153 ATOM 38293 O WAT 7154 17.841 120.509 113.756 1.00 0.00 O ATOM 38294 H1 WAT 7154 18.477 119.804 113.882 1.00 0.00 H ATOM 38295 H2 WAT 7154 17.036 120.062 113.495 1.00 0.00 H TER 38297 WAT 7154 ATOM 38297 O WAT 7155 36.439 47.085 96.408 1.00 0.00 O ATOM 38298 H1 WAT 7155 35.945 47.645 97.007 1.00 0.00 H ATOM 38299 H2 WAT 7155 36.466 47.577 95.587 1.00 0.00 H TER 38301 WAT 7155 ATOM 38301 O WAT 7156 2.919 42.306 115.512 1.00 0.00 O ATOM 38302 H1 WAT 7156 1.990 42.140 115.352 1.00 0.00 H ATOM 38303 H2 WAT 7156 2.933 43.107 116.036 1.00 0.00 H TER 38305 WAT 7156 ATOM 38305 O WAT 7157 2.176 66.696 91.306 1.00 0.00 O ATOM 38306 H1 WAT 7157 2.268 65.908 90.769 1.00 0.00 H ATOM 38307 H2 WAT 7157 2.140 67.413 90.673 1.00 0.00 H TER 38309 WAT 7157 ATOM 38309 O WAT 7158 101.536 91.850 5.373 1.00 0.00 O ATOM 38310 H1 WAT 7158 102.023 91.081 5.076 1.00 0.00 H ATOM 38311 H2 WAT 7158 101.905 92.576 4.872 1.00 0.00 H TER 38313 WAT 7158 ATOM 38313 O WAT 7159 86.979 51.259 19.192 1.00 0.00 O ATOM 38314 H1 WAT 7159 86.535 52.065 19.457 1.00 0.00 H ATOM 38315 H2 WAT 7159 87.298 50.882 20.011 1.00 0.00 H TER 38317 WAT 7159 ATOM 38317 O WAT 7160 99.974 114.807 21.903 1.00 0.00 O ATOM 38318 H1 WAT 7160 99.118 114.944 22.309 1.00 0.00 H ATOM 38319 H2 WAT 7160 100.521 115.508 22.257 1.00 0.00 H TER 38321 WAT 7160 ATOM 38321 O WAT 7161 30.831 12.535 128.070 1.00 0.00 O ATOM 38322 H1 WAT 7161 31.034 12.260 128.964 1.00 0.00 H ATOM 38323 H2 WAT 7161 31.489 13.201 127.869 1.00 0.00 H TER 38325 WAT 7161 ATOM 38325 O WAT 7162 4.044 10.453 18.880 1.00 0.00 O ATOM 38326 H1 WAT 7162 3.307 10.506 19.489 1.00 0.00 H ATOM 38327 H2 WAT 7162 4.714 11.018 19.264 1.00 0.00 H TER 38329 WAT 7162 ATOM 38329 O WAT 7163 105.174 17.233 122.519 1.00 0.00 O ATOM 38330 H1 WAT 7163 104.952 16.389 122.126 1.00 0.00 H ATOM 38331 H2 WAT 7163 106.101 17.156 122.745 1.00 0.00 H TER 38333 WAT 7163 ATOM 38333 O WAT 7164 144.785 79.738 114.120 1.00 0.00 O ATOM 38334 H1 WAT 7164 144.765 80.392 113.421 1.00 0.00 H ATOM 38335 H2 WAT 7164 143.886 79.416 114.173 1.00 0.00 H TER 38337 WAT 7164 ATOM 38337 O WAT 7165 81.160 31.102 143.646 1.00 0.00 O ATOM 38338 H1 WAT 7165 81.014 30.188 143.403 1.00 0.00 H ATOM 38339 H2 WAT 7165 80.930 31.599 142.861 1.00 0.00 H TER 38341 WAT 7165 ATOM 38341 O WAT 7166 107.540 106.086 14.048 1.00 0.00 O ATOM 38342 H1 WAT 7166 108.276 106.605 13.722 1.00 0.00 H ATOM 38343 H2 WAT 7166 107.856 105.183 14.028 1.00 0.00 H TER 38345 WAT 7166 ATOM 38345 O WAT 7167 4.746 111.243 136.662 1.00 0.00 O ATOM 38346 H1 WAT 7167 5.169 112.087 136.504 1.00 0.00 H ATOM 38347 H2 WAT 7167 3.903 111.309 136.214 1.00 0.00 H TER 38349 WAT 7167 ATOM 38349 O WAT 7168 61.869 1.978 109.309 1.00 0.00 O ATOM 38350 H1 WAT 7168 62.581 1.611 108.786 1.00 0.00 H ATOM 38351 H2 WAT 7168 62.065 1.706 110.205 1.00 0.00 H TER 38353 WAT 7168 ATOM 38353 O WAT 7169 58.909 55.507 14.325 1.00 0.00 O ATOM 38354 H1 WAT 7169 58.785 55.228 13.418 1.00 0.00 H ATOM 38355 H2 WAT 7169 59.093 54.698 14.802 1.00 0.00 H TER 38357 WAT 7169 ATOM 38357 O WAT 7170 134.039 99.087 107.623 1.00 0.00 O ATOM 38358 H1 WAT 7170 133.102 99.176 107.448 1.00 0.00 H ATOM 38359 H2 WAT 7170 134.265 99.872 108.121 1.00 0.00 H TER 38361 WAT 7170 ATOM 38361 O WAT 7171 40.935 60.616 139.129 1.00 0.00 O ATOM 38362 H1 WAT 7171 40.096 60.161 139.206 1.00 0.00 H ATOM 38363 H2 WAT 7171 41.335 60.529 139.994 1.00 0.00 H TER 38365 WAT 7171 ATOM 38365 O WAT 7172 131.004 114.145 21.361 1.00 0.00 O ATOM 38366 H1 WAT 7172 131.150 114.142 20.415 1.00 0.00 H ATOM 38367 H2 WAT 7172 131.862 114.346 21.734 1.00 0.00 H TER 38369 WAT 7172 ATOM 38369 O WAT 7173 108.300 66.729 91.671 1.00 0.00 O ATOM 38370 H1 WAT 7173 107.843 67.301 92.288 1.00 0.00 H ATOM 38371 H2 WAT 7173 107.992 65.849 91.886 1.00 0.00 H TER 38373 WAT 7173 ATOM 38373 O WAT 7174 50.524 111.950 136.091 1.00 0.00 O ATOM 38374 H1 WAT 7174 50.379 112.891 135.987 1.00 0.00 H ATOM 38375 H2 WAT 7174 50.741 111.642 135.212 1.00 0.00 H TER 38377 WAT 7174 ATOM 38377 O WAT 7175 3.818 141.593 55.092 1.00 0.00 O ATOM 38378 H1 WAT 7175 4.731 141.336 55.222 1.00 0.00 H ATOM 38379 H2 WAT 7175 3.371 140.779 54.862 1.00 0.00 H TER 38381 WAT 7175 ATOM 38381 O WAT 7176 39.634 52.616 21.891 1.00 0.00 O ATOM 38382 H1 WAT 7176 39.383 51.991 22.572 1.00 0.00 H ATOM 38383 H2 WAT 7176 40.406 53.058 22.245 1.00 0.00 H TER 38385 WAT 7176 ATOM 38385 O WAT 7177 142.223 5.807 91.029 1.00 0.00 O ATOM 38386 H1 WAT 7177 142.457 6.726 91.158 1.00 0.00 H ATOM 38387 H2 WAT 7177 142.847 5.490 90.377 1.00 0.00 H TER 38389 WAT 7177 ATOM 38389 O WAT 7178 128.161 16.505 143.279 1.00 0.00 O ATOM 38390 H1 WAT 7178 128.297 17.399 143.591 1.00 0.00 H ATOM 38391 H2 WAT 7178 128.098 16.589 142.328 1.00 0.00 H TER 38393 WAT 7178 ATOM 38393 O WAT 7179 51.673 55.073 73.014 1.00 0.00 O ATOM 38394 H1 WAT 7179 50.749 55.229 72.815 1.00 0.00 H ATOM 38395 H2 WAT 7179 51.684 54.856 73.946 1.00 0.00 H TER 38397 WAT 7179 ATOM 38397 O WAT 7180 70.364 144.628 97.480 1.00 0.00 O ATOM 38398 H1 WAT 7180 70.170 144.279 98.350 1.00 0.00 H ATOM 38399 H2 WAT 7180 71.114 144.116 97.178 1.00 0.00 H TER 38401 WAT 7180 ATOM 38401 O WAT 7181 42.733 32.029 101.529 1.00 0.00 O ATOM 38402 H1 WAT 7181 42.455 32.594 102.250 1.00 0.00 H ATOM 38403 H2 WAT 7181 43.424 32.525 101.089 1.00 0.00 H TER 38405 WAT 7181 ATOM 38405 O WAT 7182 7.568 50.034 127.209 1.00 0.00 O ATOM 38406 H1 WAT 7182 7.641 50.959 126.975 1.00 0.00 H ATOM 38407 H2 WAT 7182 6.669 49.936 127.523 1.00 0.00 H TER 38409 WAT 7182 ATOM 38409 O WAT 7183 77.397 5.792 155.997 1.00 0.00 O ATOM 38410 H1 WAT 7183 76.814 6.391 155.530 1.00 0.00 H ATOM 38411 H2 WAT 7183 77.661 5.152 155.337 1.00 0.00 H TER 38413 WAT 7183 ATOM 38413 O WAT 7184 31.622 50.938 0.181 1.00 0.00 O ATOM 38414 H1 WAT 7184 31.941 50.045 0.048 1.00 0.00 H ATOM 38415 H2 WAT 7184 31.676 51.073 1.127 1.00 0.00 H TER 38417 WAT 7184 ATOM 38417 O WAT 7185 128.482 4.753 58.641 1.00 0.00 O ATOM 38418 H1 WAT 7185 128.610 3.821 58.463 1.00 0.00 H ATOM 38419 H2 WAT 7185 128.207 5.122 57.802 1.00 0.00 H TER 38421 WAT 7185 ATOM 38421 O WAT 7186 73.263 3.381 95.982 1.00 0.00 O ATOM 38422 H1 WAT 7186 72.966 3.913 96.721 1.00 0.00 H ATOM 38423 H2 WAT 7186 73.379 4.007 95.267 1.00 0.00 H TER 38425 WAT 7186 ATOM 38425 O WAT 7187 84.287 51.237 10.101 1.00 0.00 O ATOM 38426 H1 WAT 7187 84.622 52.032 10.517 1.00 0.00 H ATOM 38427 H2 WAT 7187 84.769 50.525 10.522 1.00 0.00 H TER 38429 WAT 7187 ATOM 38429 O WAT 7188 91.435 111.278 80.324 1.00 0.00 O ATOM 38430 H1 WAT 7188 92.170 111.340 80.934 1.00 0.00 H ATOM 38431 H2 WAT 7188 91.397 110.352 80.087 1.00 0.00 H TER 38433 WAT 7188 ATOM 38433 O WAT 7189 29.854 135.367 5.892 1.00 0.00 O ATOM 38434 H1 WAT 7189 29.093 135.947 5.925 1.00 0.00 H ATOM 38435 H2 WAT 7189 30.606 135.952 5.981 1.00 0.00 H TER 38437 WAT 7189 ATOM 38437 O WAT 7190 85.946 101.877 68.495 1.00 0.00 O ATOM 38438 H1 WAT 7190 85.723 102.639 69.030 1.00 0.00 H ATOM 38439 H2 WAT 7190 85.859 101.133 69.090 1.00 0.00 H TER 38441 WAT 7190 ATOM 38441 O WAT 7191 11.176 36.480 6.940 1.00 0.00 O ATOM 38442 H1 WAT 7191 10.570 35.871 6.516 1.00 0.00 H ATOM 38443 H2 WAT 7191 10.779 36.660 7.792 1.00 0.00 H TER 38445 WAT 7191 ATOM 38445 O WAT 7192 64.803 37.439 119.857 1.00 0.00 O ATOM 38446 H1 WAT 7192 65.486 37.465 120.527 1.00 0.00 H ATOM 38447 H2 WAT 7192 64.745 38.340 119.539 1.00 0.00 H TER 38449 WAT 7192 ATOM 38449 O WAT 7193 30.656 102.464 6.636 1.00 0.00 O ATOM 38450 H1 WAT 7193 31.324 102.534 7.317 1.00 0.00 H ATOM 38451 H2 WAT 7193 29.975 101.914 7.023 1.00 0.00 H TER 38453 WAT 7193 ATOM 38453 O WAT 7194 33.153 62.460 118.402 1.00 0.00 O ATOM 38454 H1 WAT 7194 32.337 62.124 118.773 1.00 0.00 H ATOM 38455 H2 WAT 7194 33.558 62.950 119.117 1.00 0.00 H TER 38457 WAT 7194 ATOM 38457 O WAT 7195 22.870 79.334 101.068 1.00 0.00 O ATOM 38458 H1 WAT 7195 22.239 78.889 100.503 1.00 0.00 H ATOM 38459 H2 WAT 7195 23.359 78.626 101.487 1.00 0.00 H TER 38461 WAT 7195 ATOM 38461 O WAT 7196 138.975 50.842 149.343 1.00 0.00 O ATOM 38462 H1 WAT 7196 139.509 50.106 149.046 1.00 0.00 H ATOM 38463 H2 WAT 7196 139.472 51.224 150.066 1.00 0.00 H TER 38465 WAT 7196 ATOM 38465 O WAT 7197 82.331 18.713 156.136 1.00 0.00 O ATOM 38466 H1 WAT 7197 81.393 18.693 155.950 1.00 0.00 H ATOM 38467 H2 WAT 7197 82.669 19.422 155.590 1.00 0.00 H TER 38469 WAT 7197 ATOM 38469 O WAT 7198 116.827 20.868 158.542 1.00 0.00 O ATOM 38470 H1 WAT 7198 117.143 20.204 157.929 1.00 0.00 H ATOM 38471 H2 WAT 7198 116.277 20.384 159.158 1.00 0.00 H TER 38473 WAT 7198 ATOM 38473 O WAT 7199 29.600 60.765 71.507 1.00 0.00 O ATOM 38474 H1 WAT 7199 29.711 59.952 72.001 1.00 0.00 H ATOM 38475 H2 WAT 7199 29.978 61.440 72.070 1.00 0.00 H TER 38477 WAT 7199 ATOM 38477 O WAT 7200 40.596 106.827 67.448 1.00 0.00 O ATOM 38478 H1 WAT 7200 41.177 106.650 66.708 1.00 0.00 H ATOM 38479 H2 WAT 7200 40.567 107.782 67.506 1.00 0.00 H TER 38481 WAT 7200 ATOM 38481 O WAT 7201 144.359 116.774 120.015 1.00 0.00 O ATOM 38482 H1 WAT 7201 144.004 116.769 119.126 1.00 0.00 H ATOM 38483 H2 WAT 7201 145.304 116.872 119.896 1.00 0.00 H TER 38485 WAT 7201 ATOM 38485 O WAT 7202 30.814 121.419 78.151 1.00 0.00 O ATOM 38486 H1 WAT 7202 30.633 122.297 77.817 1.00 0.00 H ATOM 38487 H2 WAT 7202 30.257 121.337 78.925 1.00 0.00 H TER 38489 WAT 7202 ATOM 38489 O WAT 7203 49.855 132.277 54.953 1.00 0.00 O ATOM 38490 H1 WAT 7203 49.661 132.460 55.873 1.00 0.00 H ATOM 38491 H2 WAT 7203 50.598 132.845 54.748 1.00 0.00 H TER 38493 WAT 7203 ATOM 38493 O WAT 7204 144.565 57.976 2.580 1.00 0.00 O ATOM 38494 H1 WAT 7204 144.633 57.822 3.523 1.00 0.00 H ATOM 38495 H2 WAT 7204 143.850 57.408 2.295 1.00 0.00 H TER 38497 WAT 7204 ATOM 38497 O WAT 7205 18.169 134.480 17.430 1.00 0.00 O ATOM 38498 H1 WAT 7205 18.316 133.669 16.943 1.00 0.00 H ATOM 38499 H2 WAT 7205 17.567 134.231 18.132 1.00 0.00 H TER 38501 WAT 7205 ATOM 38501 O WAT 7206 1.723 30.783 106.263 1.00 0.00 O ATOM 38502 H1 WAT 7206 2.622 30.477 106.144 1.00 0.00 H ATOM 38503 H2 WAT 7206 1.257 30.461 105.492 1.00 0.00 H TER 38505 WAT 7206 ATOM 38505 O WAT 7207 41.711 74.326 122.250 1.00 0.00 O ATOM 38506 H1 WAT 7207 40.865 74.043 122.596 1.00 0.00 H ATOM 38507 H2 WAT 7207 41.509 75.101 121.726 1.00 0.00 H TER 38509 WAT 7207 ATOM 38509 O WAT 7208 8.740 139.595 146.143 1.00 0.00 O ATOM 38510 H1 WAT 7208 9.008 138.691 146.309 1.00 0.00 H ATOM 38511 H2 WAT 7208 8.984 139.754 145.231 1.00 0.00 H TER 38513 WAT 7208 ATOM 38513 O WAT 7209 60.480 44.529 21.515 1.00 0.00 O ATOM 38514 H1 WAT 7209 59.713 44.615 22.080 1.00 0.00 H ATOM 38515 H2 WAT 7209 60.966 43.790 21.880 1.00 0.00 H TER 38517 WAT 7209 ATOM 38517 O WAT 7210 86.611 1.493 64.638 1.00 0.00 O ATOM 38518 H1 WAT 7210 87.261 2.184 64.767 1.00 0.00 H ATOM 38519 H2 WAT 7210 85.934 1.899 64.097 1.00 0.00 H TER 38521 WAT 7210 ATOM 38521 O WAT 7211 34.094 116.564 25.788 1.00 0.00 O ATOM 38522 H1 WAT 7211 33.315 116.933 26.205 1.00 0.00 H ATOM 38523 H2 WAT 7211 34.325 115.812 26.333 1.00 0.00 H TER 38525 WAT 7211 ATOM 38525 O WAT 7212 37.337 136.940 146.156 1.00 0.00 O ATOM 38526 H1 WAT 7212 37.107 136.751 145.247 1.00 0.00 H ATOM 38527 H2 WAT 7212 36.586 137.425 146.498 1.00 0.00 H TER 38529 WAT 7212 ATOM 38529 O WAT 7213 141.671 79.677 117.613 1.00 0.00 O ATOM 38530 H1 WAT 7213 140.973 80.285 117.855 1.00 0.00 H ATOM 38531 H2 WAT 7213 141.385 78.832 117.959 1.00 0.00 H TER 38533 WAT 7213 ATOM 38533 O WAT 7214 74.805 109.433 126.443 1.00 0.00 O ATOM 38534 H1 WAT 7214 75.739 109.272 126.575 1.00 0.00 H ATOM 38535 H2 WAT 7214 74.528 109.894 127.234 1.00 0.00 H TER 38537 WAT 7214 ATOM 38537 O WAT 7215 36.582 32.714 145.064 1.00 0.00 O ATOM 38538 H1 WAT 7215 36.111 33.506 144.804 1.00 0.00 H ATOM 38539 H2 WAT 7215 36.740 32.249 144.242 1.00 0.00 H TER 38541 WAT 7215 ATOM 38541 O WAT 7216 107.860 120.254 147.747 1.00 0.00 O ATOM 38542 H1 WAT 7216 107.932 121.199 147.886 1.00 0.00 H ATOM 38543 H2 WAT 7216 107.386 120.169 146.920 1.00 0.00 H TER 38545 WAT 7216 ATOM 38545 O WAT 7217 27.404 132.887 104.353 1.00 0.00 O ATOM 38546 H1 WAT 7217 26.719 132.564 103.767 1.00 0.00 H ATOM 38547 H2 WAT 7217 28.012 133.352 103.777 1.00 0.00 H TER 38549 WAT 7217 ATOM 38549 O WAT 7218 91.972 80.617 156.813 1.00 0.00 O ATOM 38550 H1 WAT 7218 92.901 80.444 156.663 1.00 0.00 H ATOM 38551 H2 WAT 7218 91.787 80.214 157.662 1.00 0.00 H TER 38553 WAT 7218 ATOM 38553 O WAT 7219 34.993 46.440 76.246 1.00 0.00 O ATOM 38554 H1 WAT 7219 35.054 46.170 75.330 1.00 0.00 H ATOM 38555 H2 WAT 7219 34.421 45.788 76.651 1.00 0.00 H TER 38557 WAT 7219 ATOM 38557 O WAT 7220 44.416 97.612 108.480 1.00 0.00 O ATOM 38558 H1 WAT 7220 43.826 97.323 107.783 1.00 0.00 H ATOM 38559 H2 WAT 7220 43.842 97.767 109.230 1.00 0.00 H TER 38561 WAT 7220 ATOM 38561 O WAT 7221 39.339 139.787 65.743 1.00 0.00 O ATOM 38562 H1 WAT 7221 39.351 140.425 65.030 1.00 0.00 H ATOM 38563 H2 WAT 7221 38.569 140.022 66.262 1.00 0.00 H TER 38565 WAT 7221 ATOM 38565 O WAT 7222 4.596 88.407 83.607 1.00 0.00 O ATOM 38566 H1 WAT 7222 5.264 88.615 82.954 1.00 0.00 H ATOM 38567 H2 WAT 7222 4.566 89.178 84.173 1.00 0.00 H TER 38569 WAT 7222 ATOM 38569 O WAT 7223 42.676 126.216 64.182 1.00 0.00 O ATOM 38570 H1 WAT 7223 42.989 126.615 63.371 1.00 0.00 H ATOM 38571 H2 WAT 7223 42.342 126.950 64.698 1.00 0.00 H TER 38573 WAT 7223 ATOM 38573 O WAT 7224 115.292 15.028 53.805 1.00 0.00 O ATOM 38574 H1 WAT 7224 115.891 15.715 54.097 1.00 0.00 H ATOM 38575 H2 WAT 7224 114.429 15.324 54.093 1.00 0.00 H TER 38577 WAT 7224 ATOM 38577 O WAT 7225 63.535 83.213 95.732 1.00 0.00 O ATOM 38578 H1 WAT 7225 62.728 83.037 96.215 1.00 0.00 H ATOM 38579 H2 WAT 7225 64.139 83.554 96.393 1.00 0.00 H TER 38581 WAT 7225 ATOM 38581 O WAT 7226 47.257 88.443 91.306 1.00 0.00 O ATOM 38582 H1 WAT 7226 48.105 87.999 91.323 1.00 0.00 H ATOM 38583 H2 WAT 7226 47.057 88.611 92.227 1.00 0.00 H TER 38585 WAT 7226 ATOM 38585 O WAT 7227 29.921 93.618 78.548 1.00 0.00 O ATOM 38586 H1 WAT 7227 29.791 93.040 79.300 1.00 0.00 H ATOM 38587 H2 WAT 7227 29.154 94.191 78.552 1.00 0.00 H TER 38589 WAT 7227 ATOM 38589 O WAT 7228 34.591 12.119 67.842 1.00 0.00 O ATOM 38590 H1 WAT 7228 34.150 11.377 67.429 1.00 0.00 H ATOM 38591 H2 WAT 7228 35.117 11.728 68.539 1.00 0.00 H TER 38593 WAT 7228 ATOM 38593 O WAT 7229 70.877 19.542 52.350 1.00 0.00 O ATOM 38594 H1 WAT 7229 70.223 19.247 51.717 1.00 0.00 H ATOM 38595 H2 WAT 7229 70.937 18.828 52.984 1.00 0.00 H TER 38597 WAT 7229 ATOM 38597 O WAT 7230 95.007 54.505 138.890 1.00 0.00 O ATOM 38598 H1 WAT 7230 95.789 55.044 139.001 1.00 0.00 H ATOM 38599 H2 WAT 7230 95.326 53.604 138.945 1.00 0.00 H TER 38601 WAT 7230 ATOM 38601 O WAT 7231 136.910 86.521 64.052 1.00 0.00 O ATOM 38602 H1 WAT 7231 137.138 86.310 63.147 1.00 0.00 H ATOM 38603 H2 WAT 7231 135.959 86.422 64.089 1.00 0.00 H TER 38605 WAT 7231 ATOM 38605 O WAT 7232 75.362 51.666 148.086 1.00 0.00 O ATOM 38606 H1 WAT 7232 75.197 50.787 147.743 1.00 0.00 H ATOM 38607 H2 WAT 7232 76.299 51.804 147.947 1.00 0.00 H TER 38609 WAT 7232 ATOM 38609 O WAT 7233 2.621 106.635 25.925 1.00 0.00 O ATOM 38610 H1 WAT 7233 2.578 107.014 25.047 1.00 0.00 H ATOM 38611 H2 WAT 7233 1.890 106.018 25.956 1.00 0.00 H TER 38613 WAT 7233 ATOM 38613 O WAT 7234 96.565 106.635 15.096 1.00 0.00 O ATOM 38614 H1 WAT 7234 97.405 106.716 15.549 1.00 0.00 H ATOM 38615 H2 WAT 7234 95.911 106.696 15.792 1.00 0.00 H TER 38617 WAT 7234 ATOM 38617 O WAT 7235 110.187 8.401 91.730 1.00 0.00 O ATOM 38618 H1 WAT 7235 110.052 9.322 91.951 1.00 0.00 H ATOM 38619 H2 WAT 7235 110.388 8.407 90.794 1.00 0.00 H TER 38621 WAT 7235 ATOM 38621 O WAT 7236 100.855 124.700 148.386 1.00 0.00 O ATOM 38622 H1 WAT 7236 100.457 123.837 148.501 1.00 0.00 H ATOM 38623 H2 WAT 7236 101.545 124.736 149.048 1.00 0.00 H TER 38625 WAT 7236 ATOM 38625 O WAT 7237 75.751 72.050 149.143 1.00 0.00 O ATOM 38626 H1 WAT 7237 74.940 71.793 148.706 1.00 0.00 H ATOM 38627 H2 WAT 7237 76.436 71.565 148.683 1.00 0.00 H TER 38629 WAT 7237 ATOM 38629 O WAT 7238 88.505 120.937 148.793 1.00 0.00 O ATOM 38630 H1 WAT 7238 87.549 120.887 148.773 1.00 0.00 H ATOM 38631 H2 WAT 7238 88.706 121.816 148.473 1.00 0.00 H TER 38633 WAT 7238 ATOM 38633 O WAT 7239 117.446 142.892 133.277 1.00 0.00 O ATOM 38634 H1 WAT 7239 117.200 142.460 132.460 1.00 0.00 H ATOM 38635 H2 WAT 7239 116.628 143.262 133.609 1.00 0.00 H TER 38637 WAT 7239 ATOM 38637 O WAT 7240 50.456 1.203 158.537 1.00 0.00 O ATOM 38638 H1 WAT 7240 49.844 0.936 157.851 1.00 0.00 H ATOM 38639 H2 WAT 7240 50.192 2.095 158.760 1.00 0.00 H TER 38641 WAT 7240 ATOM 38641 O WAT 7241 55.557 87.766 116.980 1.00 0.00 O ATOM 38642 H1 WAT 7241 55.033 88.563 116.894 1.00 0.00 H ATOM 38643 H2 WAT 7241 54.928 87.053 116.864 1.00 0.00 H TER 38645 WAT 7241 ATOM 38645 O WAT 7242 2.509 14.325 143.788 1.00 0.00 O ATOM 38646 H1 WAT 7242 2.938 14.902 143.156 1.00 0.00 H ATOM 38647 H2 WAT 7242 1.581 14.552 143.727 1.00 0.00 H TER 38649 WAT 7242 ATOM 38649 O WAT 7243 98.843 72.970 7.181 1.00 0.00 O ATOM 38650 H1 WAT 7243 99.645 72.768 6.698 1.00 0.00 H ATOM 38651 H2 WAT 7243 98.165 73.023 6.507 1.00 0.00 H TER 38653 WAT 7243 ATOM 38653 O WAT 7244 141.973 69.537 71.449 1.00 0.00 O ATOM 38654 H1 WAT 7244 142.070 70.348 70.950 1.00 0.00 H ATOM 38655 H2 WAT 7244 142.531 68.907 70.992 1.00 0.00 H TER 38657 WAT 7244 ATOM 38657 O WAT 7245 99.018 120.342 58.322 1.00 0.00 O ATOM 38658 H1 WAT 7245 98.154 120.204 57.934 1.00 0.00 H ATOM 38659 H2 WAT 7245 99.509 119.550 58.100 1.00 0.00 H TER 38661 WAT 7245 ATOM 38661 O WAT 7246 38.942 36.235 90.127 1.00 0.00 O ATOM 38662 H1 WAT 7246 38.128 36.639 89.826 1.00 0.00 H ATOM 38663 H2 WAT 7246 39.284 35.782 89.357 1.00 0.00 H TER 38665 WAT 7246 ATOM 38665 O WAT 7247 87.695 100.551 140.848 1.00 0.00 O ATOM 38666 H1 WAT 7247 87.472 100.291 141.742 1.00 0.00 H ATOM 38667 H2 WAT 7247 87.923 101.478 140.919 1.00 0.00 H TER 38669 WAT 7247 ATOM 38669 O WAT 7248 76.859 4.505 83.663 1.00 0.00 O ATOM 38670 H1 WAT 7248 76.921 3.567 83.844 1.00 0.00 H ATOM 38671 H2 WAT 7248 77.725 4.744 83.333 1.00 0.00 H TER 38673 WAT 7248 ATOM 38673 O WAT 7249 124.330 61.587 91.235 1.00 0.00 O ATOM 38674 H1 WAT 7249 123.710 61.428 91.947 1.00 0.00 H ATOM 38675 H2 WAT 7249 124.799 62.379 91.499 1.00 0.00 H TER 38677 WAT 7249 ATOM 38677 O WAT 7250 10.693 50.772 98.193 1.00 0.00 O ATOM 38678 H1 WAT 7250 11.237 50.799 98.981 1.00 0.00 H ATOM 38679 H2 WAT 7250 10.905 51.581 97.728 1.00 0.00 H TER 38681 WAT 7250 ATOM 38681 O WAT 7251 76.213 40.645 67.573 1.00 0.00 O ATOM 38682 H1 WAT 7251 76.070 40.876 66.655 1.00 0.00 H ATOM 38683 H2 WAT 7251 76.868 39.948 67.545 1.00 0.00 H TER 38685 WAT 7251 ATOM 38685 O WAT 7252 15.820 139.137 70.925 1.00 0.00 O ATOM 38686 H1 WAT 7252 15.784 140.004 71.329 1.00 0.00 H ATOM 38687 H2 WAT 7252 15.709 138.528 71.655 1.00 0.00 H TER 38689 WAT 7252 ATOM 38689 O WAT 7253 70.465 112.495 18.673 1.00 0.00 O ATOM 38690 H1 WAT 7253 70.152 111.598 18.552 1.00 0.00 H ATOM 38691 H2 WAT 7253 70.671 112.552 19.606 1.00 0.00 H TER 38693 WAT 7253 ATOM 38693 O WAT 7254 67.751 82.096 17.483 1.00 0.00 O ATOM 38694 H1 WAT 7254 67.219 82.013 16.692 1.00 0.00 H ATOM 38695 H2 WAT 7254 68.418 81.415 17.396 1.00 0.00 H TER 38697 WAT 7254 ATOM 38697 O WAT 7255 124.248 112.811 113.701 1.00 0.00 O ATOM 38698 H1 WAT 7255 124.087 113.598 113.182 1.00 0.00 H ATOM 38699 H2 WAT 7255 123.597 112.849 114.402 1.00 0.00 H TER 38701 WAT 7255 ATOM 38701 O WAT 7256 103.571 114.977 102.572 1.00 0.00 O ATOM 38702 H1 WAT 7256 104.468 115.121 102.270 1.00 0.00 H ATOM 38703 H2 WAT 7256 103.245 115.852 102.780 1.00 0.00 H TER 38705 WAT 7256 ATOM 38705 O WAT 7257 19.483 41.394 14.104 1.00 0.00 O ATOM 38706 H1 WAT 7257 19.593 42.262 13.716 1.00 0.00 H ATOM 38707 H2 WAT 7257 18.796 40.982 13.580 1.00 0.00 H TER 38709 WAT 7257 ATOM 38709 O WAT 7258 97.452 57.139 104.253 1.00 0.00 O ATOM 38710 H1 WAT 7258 97.756 56.431 104.822 1.00 0.00 H ATOM 38711 H2 WAT 7258 98.251 57.594 103.988 1.00 0.00 H TER 38713 WAT 7258 ATOM 38713 O WAT 7259 45.384 94.626 25.053 1.00 0.00 O ATOM 38714 H1 WAT 7259 45.505 93.891 24.453 1.00 0.00 H ATOM 38715 H2 WAT 7259 45.539 94.255 25.921 1.00 0.00 H TER 38717 WAT 7259 ATOM 38717 O WAT 7260 129.535 123.784 110.483 1.00 0.00 O ATOM 38718 H1 WAT 7260 129.686 124.554 109.936 1.00 0.00 H ATOM 38719 H2 WAT 7260 128.960 123.226 109.959 1.00 0.00 H TER 38721 WAT 7260 ATOM 38721 O WAT 7261 105.881 48.442 134.550 1.00 0.00 O ATOM 38722 H1 WAT 7261 105.580 49.123 133.948 1.00 0.00 H ATOM 38723 H2 WAT 7261 105.077 48.041 134.879 1.00 0.00 H TER 38725 WAT 7261 ATOM 38725 O WAT 7262 59.297 67.024 5.621 1.00 0.00 O ATOM 38726 H1 WAT 7262 58.600 66.411 5.853 1.00 0.00 H ATOM 38727 H2 WAT 7262 59.990 66.852 6.258 1.00 0.00 H TER 38729 WAT 7262 ATOM 38729 O WAT 7263 80.074 144.019 146.869 1.00 0.00 O ATOM 38730 H1 WAT 7263 79.820 144.666 147.528 1.00 0.00 H ATOM 38731 H2 WAT 7263 79.557 143.243 147.084 1.00 0.00 H TER 38733 WAT 7263 ATOM 38733 O WAT 7264 129.262 78.761 71.671 1.00 0.00 O ATOM 38734 H1 WAT 7264 130.125 79.052 71.378 1.00 0.00 H ATOM 38735 H2 WAT 7264 129.206 77.849 71.384 1.00 0.00 H TER 38737 WAT 7264 ATOM 38737 O WAT 7265 121.289 64.769 129.426 1.00 0.00 O ATOM 38738 H1 WAT 7265 121.692 65.020 128.595 1.00 0.00 H ATOM 38739 H2 WAT 7265 121.124 65.599 129.873 1.00 0.00 H TER 38741 WAT 7265 ATOM 38741 O WAT 7266 68.357 66.845 14.638 1.00 0.00 O ATOM 38742 H1 WAT 7266 68.337 66.639 15.572 1.00 0.00 H ATOM 38743 H2 WAT 7266 68.807 66.100 14.238 1.00 0.00 H TER 38745 WAT 7266 ATOM 38745 O WAT 7267 68.395 127.086 135.242 1.00 0.00 O ATOM 38746 H1 WAT 7267 68.706 127.961 135.010 1.00 0.00 H ATOM 38747 H2 WAT 7267 69.193 126.578 135.383 1.00 0.00 H TER 38749 WAT 7267 ATOM 38749 O WAT 7268 93.848 124.054 97.270 1.00 0.00 O ATOM 38750 H1 WAT 7268 93.444 124.316 98.098 1.00 0.00 H ATOM 38751 H2 WAT 7268 93.834 124.848 96.735 1.00 0.00 H TER 38753 WAT 7268 ATOM 38753 O WAT 7269 0.423 136.328 93.134 1.00 0.00 O ATOM 38754 H1 WAT 7269 0.242 136.159 94.059 1.00 0.00 H ATOM 38755 H2 WAT 7269 -0.244 136.964 92.872 1.00 0.00 H TER 38757 WAT 7269 ATOM 38757 O WAT 7270 125.878 129.400 67.819 1.00 0.00 O ATOM 38758 H1 WAT 7270 126.094 129.914 67.041 1.00 0.00 H ATOM 38759 H2 WAT 7270 125.592 128.553 67.475 1.00 0.00 H TER 38761 WAT 7270 ATOM 38761 O WAT 7271 56.942 74.332 88.686 1.00 0.00 O ATOM 38762 H1 WAT 7271 57.804 74.743 88.625 1.00 0.00 H ATOM 38763 H2 WAT 7271 56.867 74.067 89.603 1.00 0.00 H TER 38765 WAT 7271 ATOM 38765 O WAT 7272 83.296 34.929 12.739 1.00 0.00 O ATOM 38766 H1 WAT 7272 82.412 34.876 13.102 1.00 0.00 H ATOM 38767 H2 WAT 7272 83.858 35.076 13.499 1.00 0.00 H TER 38769 WAT 7272 ATOM 38769 O WAT 7273 115.779 18.141 142.231 1.00 0.00 O ATOM 38770 H1 WAT 7273 116.376 17.457 141.925 1.00 0.00 H ATOM 38771 H2 WAT 7273 116.306 18.668 142.831 1.00 0.00 H TER 38773 WAT 7273 ATOM 38773 O WAT 7274 57.487 129.054 112.725 1.00 0.00 O ATOM 38774 H1 WAT 7274 57.694 129.582 113.496 1.00 0.00 H ATOM 38775 H2 WAT 7274 57.553 128.149 113.029 1.00 0.00 H TER 38777 WAT 7274 ATOM 38777 O WAT 7275 65.428 52.176 108.170 1.00 0.00 O ATOM 38778 H1 WAT 7275 64.645 51.726 108.485 1.00 0.00 H ATOM 38779 H2 WAT 7275 65.095 52.854 107.582 1.00 0.00 H TER 38781 WAT 7275 ATOM 38781 O WAT 7276 66.085 110.882 20.298 1.00 0.00 O ATOM 38782 H1 WAT 7276 66.855 110.322 20.406 1.00 0.00 H ATOM 38783 H2 WAT 7276 65.357 110.353 20.624 1.00 0.00 H TER 38785 WAT 7276 ATOM 38785 O WAT 7277 128.460 81.385 7.235 1.00 0.00 O ATOM 38786 H1 WAT 7277 128.233 81.127 8.129 1.00 0.00 H ATOM 38787 H2 WAT 7277 128.301 82.328 7.210 1.00 0.00 H TER 38789 WAT 7277 ATOM 38789 O WAT 7278 40.836 115.082 84.664 1.00 0.00 O ATOM 38790 H1 WAT 7278 41.222 115.778 84.134 1.00 0.00 H ATOM 38791 H2 WAT 7278 40.208 115.531 85.230 1.00 0.00 H TER 38793 WAT 7278 ATOM 38793 O WAT 7279 95.042 73.340 24.477 1.00 0.00 O ATOM 38794 H1 WAT 7279 95.825 73.284 25.026 1.00 0.00 H ATOM 38795 H2 WAT 7279 94.439 73.892 24.975 1.00 0.00 H TER 38797 WAT 7279 ATOM 38797 O WAT 7280 48.350 55.957 146.232 1.00 0.00 O ATOM 38798 H1 WAT 7280 49.292 55.898 146.073 1.00 0.00 H ATOM 38799 H2 WAT 7280 48.264 55.898 147.183 1.00 0.00 H TER 38801 WAT 7280 ATOM 38801 O WAT 7281 14.704 27.765 16.578 1.00 0.00 O ATOM 38802 H1 WAT 7281 14.367 26.956 16.192 1.00 0.00 H ATOM 38803 H2 WAT 7281 15.650 27.629 16.629 1.00 0.00 H TER 38805 WAT 7281 ATOM 38805 O WAT 7282 58.340 124.335 66.948 1.00 0.00 O ATOM 38806 H1 WAT 7282 58.260 125.062 67.566 1.00 0.00 H ATOM 38807 H2 WAT 7282 57.734 123.672 67.278 1.00 0.00 H TER 38809 WAT 7282 ATOM 38809 O WAT 7283 25.957 49.828 10.059 1.00 0.00 O ATOM 38810 H1 WAT 7283 25.934 48.955 9.667 1.00 0.00 H ATOM 38811 H2 WAT 7283 26.698 50.261 9.637 1.00 0.00 H TER 38813 WAT 7283 ATOM 38813 O WAT 7284 65.111 63.804 102.030 1.00 0.00 O ATOM 38814 H1 WAT 7284 66.056 63.691 102.137 1.00 0.00 H ATOM 38815 H2 WAT 7284 64.972 64.747 102.123 1.00 0.00 H TER 38817 WAT 7284 ATOM 38817 O WAT 7285 125.775 27.258 24.561 1.00 0.00 O ATOM 38818 H1 WAT 7285 125.174 27.640 25.200 1.00 0.00 H ATOM 38819 H2 WAT 7285 126.418 26.786 25.090 1.00 0.00 H TER 38821 WAT 7285 ATOM 38821 O WAT 7286 47.085 82.467 18.279 1.00 0.00 O ATOM 38822 H1 WAT 7286 46.139 82.507 18.424 1.00 0.00 H ATOM 38823 H2 WAT 7286 47.217 82.911 17.441 1.00 0.00 H TER 38825 WAT 7286 ATOM 38825 O WAT 7287 124.184 18.160 95.909 1.00 0.00 O ATOM 38826 H1 WAT 7287 124.827 18.256 95.206 1.00 0.00 H ATOM 38827 H2 WAT 7287 124.644 17.666 96.588 1.00 0.00 H TER 38829 WAT 7287 ATOM 38829 O WAT 7288 111.249 99.922 10.850 1.00 0.00 O ATOM 38830 H1 WAT 7288 110.628 99.251 10.566 1.00 0.00 H ATOM 38831 H2 WAT 7288 110.843 100.313 11.623 1.00 0.00 H TER 38833 WAT 7288 ATOM 38833 O WAT 7289 137.550 78.735 84.992 1.00 0.00 O ATOM 38834 H1 WAT 7289 138.502 78.737 84.897 1.00 0.00 H ATOM 38835 H2 WAT 7289 137.393 78.280 85.820 1.00 0.00 H TER 38837 WAT 7289 ATOM 38837 O WAT 7290 88.920 76.357 2.230 1.00 0.00 O ATOM 38838 H1 WAT 7290 89.278 76.288 3.115 1.00 0.00 H ATOM 38839 H2 WAT 7290 89.284 77.173 1.887 1.00 0.00 H TER 38841 WAT 7290 ATOM 38841 O WAT 7291 80.664 107.881 -0.170 1.00 0.00 O ATOM 38842 H1 WAT 7291 81.202 107.113 0.023 1.00 0.00 H ATOM 38843 H2 WAT 7291 80.369 108.190 0.687 1.00 0.00 H TER 38845 WAT 7291 ATOM 38845 O WAT 7292 75.896 121.383 91.965 1.00 0.00 O ATOM 38846 H1 WAT 7292 75.612 120.990 91.139 1.00 0.00 H ATOM 38847 H2 WAT 7292 75.874 120.661 92.593 1.00 0.00 H TER 38849 WAT 7292 ATOM 38849 O WAT 7293 17.732 26.007 79.081 1.00 0.00 O ATOM 38850 H1 WAT 7293 16.939 25.551 79.362 1.00 0.00 H ATOM 38851 H2 WAT 7293 18.396 25.748 79.721 1.00 0.00 H TER 38853 WAT 7293 ATOM 38853 O WAT 7294 70.326 18.493 103.845 1.00 0.00 O ATOM 38854 H1 WAT 7294 69.633 19.122 103.642 1.00 0.00 H ATOM 38855 H2 WAT 7294 70.301 17.867 103.122 1.00 0.00 H TER 38857 WAT 7294 ATOM 38857 O WAT 7295 136.419 136.310 67.987 1.00 0.00 O ATOM 38858 H1 WAT 7295 136.487 135.620 67.327 1.00 0.00 H ATOM 38859 H2 WAT 7295 135.479 136.477 68.062 1.00 0.00 H TER 38861 WAT 7295 ATOM 38861 O WAT 7296 22.775 69.758 64.127 1.00 0.00 O ATOM 38862 H1 WAT 7296 22.519 70.656 63.919 1.00 0.00 H ATOM 38863 H2 WAT 7296 23.580 69.850 64.637 1.00 0.00 H TER 38865 WAT 7296 ATOM 38865 O WAT 7297 14.315 80.060 158.038 1.00 0.00 O ATOM 38866 H1 WAT 7297 13.839 80.846 157.769 1.00 0.00 H ATOM 38867 H2 WAT 7297 14.814 80.335 158.808 1.00 0.00 H TER 38869 WAT 7297 ATOM 38869 O WAT 7298 91.624 3.441 21.434 1.00 0.00 O ATOM 38870 H1 WAT 7298 91.977 3.959 20.710 1.00 0.00 H ATOM 38871 H2 WAT 7298 91.766 3.985 22.209 1.00 0.00 H TER 38873 WAT 7298 ATOM 38873 O WAT 7299 143.234 43.820 155.493 1.00 0.00 O ATOM 38874 H1 WAT 7299 142.881 44.581 155.031 1.00 0.00 H ATOM 38875 H2 WAT 7299 143.354 44.122 156.394 1.00 0.00 H TER 38877 WAT 7299 ATOM 38877 O WAT 7300 78.439 118.593 111.675 1.00 0.00 O ATOM 38878 H1 WAT 7300 78.588 117.809 111.146 1.00 0.00 H ATOM 38879 H2 WAT 7300 78.246 119.280 111.036 1.00 0.00 H TER 38881 WAT 7300 ATOM 38881 O WAT 7301 99.727 88.314 5.675 1.00 0.00 O ATOM 38882 H1 WAT 7301 99.901 87.676 6.367 1.00 0.00 H ATOM 38883 H2 WAT 7301 98.975 87.956 5.203 1.00 0.00 H TER 38885 WAT 7301 ATOM 38885 O WAT 7302 70.167 74.128 137.569 1.00 0.00 O ATOM 38886 H1 WAT 7302 69.256 74.281 137.320 1.00 0.00 H ATOM 38887 H2 WAT 7302 70.599 73.875 136.754 1.00 0.00 H TER 38889 WAT 7302 ATOM 38889 O WAT 7303 13.474 114.981 17.978 1.00 0.00 O ATOM 38890 H1 WAT 7303 12.830 115.347 18.584 1.00 0.00 H ATOM 38891 H2 WAT 7303 12.952 114.504 17.333 1.00 0.00 H TER 38893 WAT 7303 ATOM 38893 O WAT 7304 41.147 48.313 118.202 1.00 0.00 O ATOM 38894 H1 WAT 7304 41.404 49.183 117.897 1.00 0.00 H ATOM 38895 H2 WAT 7304 40.211 48.257 118.008 1.00 0.00 H TER 38897 WAT 7304 ATOM 38897 O WAT 7305 38.250 10.384 79.330 1.00 0.00 O ATOM 38898 H1 WAT 7305 38.077 10.881 78.531 1.00 0.00 H ATOM 38899 H2 WAT 7305 37.480 9.824 79.435 1.00 0.00 H TER 38901 WAT 7305 ATOM 38901 O WAT 7306 131.859 7.976 82.092 1.00 0.00 O ATOM 38902 H1 WAT 7306 132.688 7.972 81.615 1.00 0.00 H ATOM 38903 H2 WAT 7306 131.577 7.061 82.092 1.00 0.00 H TER 38905 WAT 7306 ATOM 38905 O WAT 7307 57.228 114.888 85.604 1.00 0.00 O ATOM 38906 H1 WAT 7307 56.358 114.520 85.757 1.00 0.00 H ATOM 38907 H2 WAT 7307 57.801 114.124 85.531 1.00 0.00 H TER 38909 WAT 7307 ATOM 38909 O WAT 7308 48.206 126.169 114.211 1.00 0.00 O ATOM 38910 H1 WAT 7308 48.783 125.461 114.496 1.00 0.00 H ATOM 38911 H2 WAT 7308 47.372 125.738 114.023 1.00 0.00 H TER 38913 WAT 7308 ATOM 38913 O WAT 7309 44.895 67.858 3.933 1.00 0.00 O ATOM 38914 H1 WAT 7309 44.549 67.026 3.612 1.00 0.00 H ATOM 38915 H2 WAT 7309 44.750 68.471 3.212 1.00 0.00 H TER 38917 WAT 7309 ATOM 38917 O WAT 7310 60.129 118.445 136.881 1.00 0.00 O ATOM 38918 H1 WAT 7310 59.752 117.621 137.188 1.00 0.00 H ATOM 38919 H2 WAT 7310 60.394 118.900 137.680 1.00 0.00 H TER 38921 WAT 7310 ATOM 38921 O WAT 7311 88.862 52.888 119.141 1.00 0.00 O ATOM 38922 H1 WAT 7311 88.623 52.166 119.722 1.00 0.00 H ATOM 38923 H2 WAT 7311 88.104 52.994 118.566 1.00 0.00 H TER 38925 WAT 7311 ATOM 38925 O WAT 7312 129.199 50.424 100.512 1.00 0.00 O ATOM 38926 H1 WAT 7312 130.076 50.503 100.888 1.00 0.00 H ATOM 38927 H2 WAT 7312 129.034 51.276 100.107 1.00 0.00 H TER 38929 WAT 7312 ATOM 38929 O WAT 7313 91.059 36.620 0.784 1.00 0.00 O ATOM 38930 H1 WAT 7313 91.259 35.933 1.419 1.00 0.00 H ATOM 38931 H2 WAT 7313 91.872 37.118 0.705 1.00 0.00 H TER 38933 WAT 7313 ATOM 38933 O WAT 7314 100.542 122.369 80.191 1.00 0.00 O ATOM 38934 H1 WAT 7314 100.513 121.607 80.770 1.00 0.00 H ATOM 38935 H2 WAT 7314 99.745 122.857 80.397 1.00 0.00 H TER 38937 WAT 7314 ATOM 38937 O WAT 7315 25.342 123.856 147.294 1.00 0.00 O ATOM 38938 H1 WAT 7315 25.038 124.651 146.855 1.00 0.00 H ATOM 38939 H2 WAT 7315 26.296 123.936 147.301 1.00 0.00 H TER 38941 WAT 7315 ATOM 38941 O WAT 7316 56.340 84.939 100.762 1.00 0.00 O ATOM 38942 H1 WAT 7316 56.775 84.802 101.603 1.00 0.00 H ATOM 38943 H2 WAT 7316 55.428 84.694 100.921 1.00 0.00 H TER 38945 WAT 7316 ATOM 38945 O WAT 7317 132.738 96.818 60.444 1.00 0.00 O ATOM 38946 H1 WAT 7317 133.680 96.693 60.331 1.00 0.00 H ATOM 38947 H2 WAT 7317 132.624 96.939 61.387 1.00 0.00 H TER 38949 WAT 7317 ATOM 38949 O WAT 7318 123.861 9.184 13.885 1.00 0.00 O ATOM 38950 H1 WAT 7318 123.436 9.568 14.653 1.00 0.00 H ATOM 38951 H2 WAT 7318 123.138 8.958 13.300 1.00 0.00 H TER 38953 WAT 7318 ATOM 38953 O WAT 7319 53.369 144.825 96.452 1.00 0.00 O ATOM 38954 H1 WAT 7319 52.988 144.986 97.315 1.00 0.00 H ATOM 38955 H2 WAT 7319 54.310 144.953 96.577 1.00 0.00 H TER 38957 WAT 7319 ATOM 38957 O WAT 7320 52.075 51.875 124.697 1.00 0.00 O ATOM 38958 H1 WAT 7320 51.973 52.797 124.936 1.00 0.00 H ATOM 38959 H2 WAT 7320 51.181 51.533 124.677 1.00 0.00 H TER 38961 WAT 7320 ATOM 38961 O WAT 7321 84.362 19.171 73.800 1.00 0.00 O ATOM 38962 H1 WAT 7321 83.450 19.375 74.006 1.00 0.00 H ATOM 38963 H2 WAT 7321 84.786 19.078 74.653 1.00 0.00 H TER 38965 WAT 7321 ATOM 38965 O WAT 7322 66.050 95.228 18.972 1.00 0.00 O ATOM 38966 H1 WAT 7322 65.224 95.667 18.770 1.00 0.00 H ATOM 38967 H2 WAT 7322 66.304 94.806 18.152 1.00 0.00 H TER 38969 WAT 7322 ATOM 38969 O WAT 7323 138.786 137.061 121.325 1.00 0.00 O ATOM 38970 H1 WAT 7323 138.891 137.713 120.632 1.00 0.00 H ATOM 38971 H2 WAT 7323 138.944 136.222 120.892 1.00 0.00 H TER 38973 WAT 7323 ATOM 38973 O WAT 7324 67.884 75.253 123.144 1.00 0.00 O ATOM 38974 H1 WAT 7324 67.125 74.988 123.664 1.00 0.00 H ATOM 38975 H2 WAT 7324 67.732 76.179 122.954 1.00 0.00 H TER 38977 WAT 7324 ATOM 38977 O WAT 7325 57.055 105.818 84.551 1.00 0.00 O ATOM 38978 H1 WAT 7325 57.414 104.931 84.570 1.00 0.00 H ATOM 38979 H2 WAT 7325 57.094 106.113 85.461 1.00 0.00 H TER 38981 WAT 7325 ATOM 38981 O WAT 7326 72.811 69.803 132.090 1.00 0.00 O ATOM 38982 H1 WAT 7326 72.163 70.260 132.626 1.00 0.00 H ATOM 38983 H2 WAT 7326 72.296 69.369 131.410 1.00 0.00 H TER 38985 WAT 7326 ATOM 38985 O WAT 7327 111.424 82.733 94.455 1.00 0.00 O ATOM 38986 H1 WAT 7327 112.240 83.231 94.402 1.00 0.00 H ATOM 38987 H2 WAT 7327 111.654 81.860 94.137 1.00 0.00 H TER 38989 WAT 7327 ATOM 38989 O WAT 7328 66.834 55.314 73.705 1.00 0.00 O ATOM 38990 H1 WAT 7328 66.074 54.755 73.541 1.00 0.00 H ATOM 38991 H2 WAT 7328 66.485 56.205 73.682 1.00 0.00 H TER 38993 WAT 7328 ATOM 38993 O WAT 7329 105.306 140.468 105.753 1.00 0.00 O ATOM 38994 H1 WAT 7329 105.475 140.748 104.853 1.00 0.00 H ATOM 38995 H2 WAT 7329 105.573 139.549 105.772 1.00 0.00 H TER 38997 WAT 7329 ATOM 38997 O WAT 7330 65.562 119.423 152.775 1.00 0.00 O ATOM 38998 H1 WAT 7330 65.537 120.165 153.379 1.00 0.00 H ATOM 38999 H2 WAT 7330 66.470 119.388 152.476 1.00 0.00 H TER 39001 WAT 7330 ATOM 39001 O WAT 7331 143.370 81.824 84.727 1.00 0.00 O ATOM 39002 H1 WAT 7331 143.073 81.220 85.408 1.00 0.00 H ATOM 39003 H2 WAT 7331 144.010 82.384 85.165 1.00 0.00 H TER 39005 WAT 7331 ATOM 39005 O WAT 7332 71.735 51.217 91.024 1.00 0.00 O ATOM 39006 H1 WAT 7332 72.375 51.834 91.380 1.00 0.00 H ATOM 39007 H2 WAT 7332 72.225 50.403 90.911 1.00 0.00 H TER 39009 WAT 7332 ATOM 39009 O WAT 7333 41.480 66.178 149.223 1.00 0.00 O ATOM 39010 H1 WAT 7333 41.408 66.915 148.617 1.00 0.00 H ATOM 39011 H2 WAT 7333 41.506 66.581 150.090 1.00 0.00 H TER 39013 WAT 7333 ATOM 39013 O WAT 7334 68.481 55.923 154.325 1.00 0.00 O ATOM 39014 H1 WAT 7334 68.293 55.173 153.760 1.00 0.00 H ATOM 39015 H2 WAT 7334 69.129 55.595 154.949 1.00 0.00 H TER 39017 WAT 7334 ATOM 39017 O WAT 7335 47.682 103.542 138.227 1.00 0.00 O ATOM 39018 H1 WAT 7335 47.769 104.424 137.866 1.00 0.00 H ATOM 39019 H2 WAT 7335 48.116 103.588 139.079 1.00 0.00 H TER 39021 WAT 7335 ATOM 39021 O WAT 7336 92.171 15.645 94.306 1.00 0.00 O ATOM 39022 H1 WAT 7336 92.933 15.110 94.530 1.00 0.00 H ATOM 39023 H2 WAT 7336 92.269 15.821 93.370 1.00 0.00 H TER 39025 WAT 7336 ATOM 39025 O WAT 7337 77.565 141.766 154.262 1.00 0.00 O ATOM 39026 H1 WAT 7337 77.471 142.522 153.683 1.00 0.00 H ATOM 39027 H2 WAT 7337 77.341 142.100 155.131 1.00 0.00 H TER 39029 WAT 7337 ATOM 39029 O WAT 7338 31.101 11.669 130.685 1.00 0.00 O ATOM 39030 H1 WAT 7338 31.306 10.736 130.750 1.00 0.00 H ATOM 39031 H2 WAT 7338 31.930 12.110 130.866 1.00 0.00 H TER 39033 WAT 7338 ATOM 39033 O WAT 7339 93.904 73.356 112.835 1.00 0.00 O ATOM 39034 H1 WAT 7339 93.628 74.174 112.421 1.00 0.00 H ATOM 39035 H2 WAT 7339 94.824 73.263 112.590 1.00 0.00 H TER 39037 WAT 7339 ATOM 39037 O WAT 7340 95.208 34.348 126.254 1.00 0.00 O ATOM 39038 H1 WAT 7340 95.862 34.445 126.946 1.00 0.00 H ATOM 39039 H2 WAT 7340 94.555 35.020 126.445 1.00 0.00 H TER 39041 WAT 7340 ATOM 39041 O WAT 7341 128.700 57.179 111.879 1.00 0.00 O ATOM 39042 H1 WAT 7341 129.100 56.827 111.085 1.00 0.00 H ATOM 39043 H2 WAT 7341 128.202 57.940 111.580 1.00 0.00 H TER 39045 WAT 7341 ATOM 39045 O WAT 7342 52.931 136.643 142.088 1.00 0.00 O ATOM 39046 H1 WAT 7342 53.887 136.693 142.059 1.00 0.00 H ATOM 39047 H2 WAT 7342 52.643 137.123 141.312 1.00 0.00 H TER 39049 WAT 7342 ATOM 39049 O WAT 7343 106.047 116.343 94.103 1.00 0.00 O ATOM 39050 H1 WAT 7343 105.628 117.026 94.628 1.00 0.00 H ATOM 39051 H2 WAT 7343 106.696 116.810 93.577 1.00 0.00 H TER 39053 WAT 7343 ATOM 39053 O WAT 7344 91.332 13.515 141.896 1.00 0.00 O ATOM 39054 H1 WAT 7344 91.150 14.039 141.117 1.00 0.00 H ATOM 39055 H2 WAT 7344 91.736 12.716 141.558 1.00 0.00 H TER 39057 WAT 7344 ATOM 39057 O WAT 7345 52.781 96.550 83.425 1.00 0.00 O ATOM 39058 H1 WAT 7345 53.662 96.898 83.283 1.00 0.00 H ATOM 39059 H2 WAT 7345 52.368 96.586 82.563 1.00 0.00 H TER 39061 WAT 7345 ATOM 39061 O WAT 7346 15.888 58.722 56.769 1.00 0.00 O ATOM 39062 H1 WAT 7346 16.195 59.603 56.555 1.00 0.00 H ATOM 39063 H2 WAT 7346 15.564 58.373 55.939 1.00 0.00 H TER 39065 WAT 7346 ATOM 39065 O WAT 7347 45.382 90.698 133.058 1.00 0.00 O ATOM 39066 H1 WAT 7347 44.910 90.332 132.310 1.00 0.00 H ATOM 39067 H2 WAT 7347 46.135 91.145 132.671 1.00 0.00 H TER 39069 WAT 7347 ATOM 39069 O WAT 7348 40.589 2.895 111.615 1.00 0.00 O ATOM 39070 H1 WAT 7348 40.825 2.119 112.124 1.00 0.00 H ATOM 39071 H2 WAT 7348 40.896 3.631 112.144 1.00 0.00 H TER 39073 WAT 7348 ATOM 39073 O WAT 7349 107.983 21.123 122.561 1.00 0.00 O ATOM 39074 H1 WAT 7349 107.204 21.633 122.784 1.00 0.00 H ATOM 39075 H2 WAT 7349 107.950 20.367 123.146 1.00 0.00 H TER 39077 WAT 7349 ATOM 39077 O WAT 7350 34.573 75.937 140.760 1.00 0.00 O ATOM 39078 H1 WAT 7350 34.905 76.779 141.071 1.00 0.00 H ATOM 39079 H2 WAT 7350 35.258 75.610 140.177 1.00 0.00 H TER 39081 WAT 7350 ATOM 39081 O WAT 7351 127.060 23.781 0.706 1.00 0.00 O ATOM 39082 H1 WAT 7351 126.670 22.949 0.436 1.00 0.00 H ATOM 39083 H2 WAT 7351 127.735 23.953 0.049 1.00 0.00 H TER 39085 WAT 7351 ATOM 39085 O WAT 7352 59.400 115.531 148.718 1.00 0.00 O ATOM 39086 H1 WAT 7352 58.839 116.135 148.232 1.00 0.00 H ATOM 39087 H2 WAT 7352 59.331 114.704 148.241 1.00 0.00 H TER 39089 WAT 7352 ATOM 39089 O WAT 7353 95.340 112.977 145.823 1.00 0.00 O ATOM 39090 H1 WAT 7353 95.493 112.115 145.434 1.00 0.00 H ATOM 39091 H2 WAT 7353 94.526 113.280 145.420 1.00 0.00 H TER 39093 WAT 7353 ATOM 39093 O WAT 7354 38.593 108.896 81.729 1.00 0.00 O ATOM 39094 H1 WAT 7354 38.440 109.705 82.217 1.00 0.00 H ATOM 39095 H2 WAT 7354 39.162 109.158 81.005 1.00 0.00 H TER 39097 WAT 7354 ATOM 39097 O WAT 7355 11.341 89.567 119.978 1.00 0.00 O ATOM 39098 H1 WAT 7355 10.566 89.015 119.871 1.00 0.00 H ATOM 39099 H2 WAT 7355 11.866 89.397 119.196 1.00 0.00 H TER 39101 WAT 7355 ATOM 39101 O WAT 7356 36.295 138.337 156.193 1.00 0.00 O ATOM 39102 H1 WAT 7356 36.921 137.830 155.676 1.00 0.00 H ATOM 39103 H2 WAT 7356 35.516 137.783 156.239 1.00 0.00 H TER 39105 WAT 7356 ATOM 39105 O WAT 7357 49.574 21.456 13.886 1.00 0.00 O ATOM 39106 H1 WAT 7357 48.776 21.016 13.594 1.00 0.00 H ATOM 39107 H2 WAT 7357 49.303 21.960 14.653 1.00 0.00 H TER 39109 WAT 7357 ATOM 39109 O WAT 7358 143.553 113.732 65.433 1.00 0.00 O ATOM 39110 H1 WAT 7358 142.596 113.758 65.429 1.00 0.00 H ATOM 39111 H2 WAT 7358 143.810 114.263 64.679 1.00 0.00 H TER 39113 WAT 7358 ATOM 39113 O WAT 7359 114.045 137.735 74.692 1.00 0.00 O ATOM 39114 H1 WAT 7359 114.606 136.966 74.587 1.00 0.00 H ATOM 39115 H2 WAT 7359 114.550 138.325 75.251 1.00 0.00 H TER 39117 WAT 7359 ATOM 39117 O WAT 7360 143.687 74.860 23.373 1.00 0.00 O ATOM 39118 H1 WAT 7360 144.496 74.408 23.609 1.00 0.00 H ATOM 39119 H2 WAT 7360 143.678 75.641 23.926 1.00 0.00 H TER 39121 WAT 7360 ATOM 39121 O WAT 7361 43.969 54.772 25.501 1.00 0.00 O ATOM 39122 H1 WAT 7361 44.776 55.101 25.897 1.00 0.00 H ATOM 39123 H2 WAT 7361 43.288 55.365 25.815 1.00 0.00 H TER 39125 WAT 7361 ATOM 39125 O WAT 7362 46.429 69.477 134.998 1.00 0.00 O ATOM 39126 H1 WAT 7362 47.204 69.527 134.437 1.00 0.00 H ATOM 39127 H2 WAT 7362 46.166 68.558 134.962 1.00 0.00 H TER 39129 WAT 7362 ATOM 39129 O WAT 7363 74.442 28.865 67.829 1.00 0.00 O ATOM 39130 H1 WAT 7363 74.986 28.631 68.581 1.00 0.00 H ATOM 39131 H2 WAT 7363 74.959 29.514 67.352 1.00 0.00 H TER 39133 WAT 7363 ATOM 39133 O WAT 7364 26.381 4.893 148.397 1.00 0.00 O ATOM 39134 H1 WAT 7364 26.449 5.636 148.997 1.00 0.00 H ATOM 39135 H2 WAT 7364 26.461 5.281 147.526 1.00 0.00 H TER 39137 WAT 7364 ATOM 39137 O WAT 7365 17.242 97.059 142.800 1.00 0.00 O ATOM 39138 H1 WAT 7365 17.687 97.673 142.215 1.00 0.00 H ATOM 39139 H2 WAT 7365 16.352 97.001 142.455 1.00 0.00 H TER 39141 WAT 7365 ATOM 39141 O WAT 7366 93.240 63.011 73.170 1.00 0.00 O ATOM 39142 H1 WAT 7366 93.849 62.274 73.217 1.00 0.00 H ATOM 39143 H2 WAT 7366 93.726 63.747 73.541 1.00 0.00 H TER 39145 WAT 7366 ATOM 39145 O WAT 7367 74.936 13.384 5.710 1.00 0.00 O ATOM 39146 H1 WAT 7367 75.494 13.507 6.478 1.00 0.00 H ATOM 39147 H2 WAT 7367 75.389 12.721 5.188 1.00 0.00 H TER 39149 WAT 7367 ATOM 39149 O WAT 7368 23.603 44.282 103.160 1.00 0.00 O ATOM 39150 H1 WAT 7368 24.011 44.022 103.986 1.00 0.00 H ATOM 39151 H2 WAT 7368 24.058 45.088 102.912 1.00 0.00 H TER 39153 WAT 7368 ATOM 39153 O WAT 7369 102.832 92.397 98.026 1.00 0.00 O ATOM 39154 H1 WAT 7369 102.432 91.992 97.256 1.00 0.00 H ATOM 39155 H2 WAT 7369 103.764 92.447 97.813 1.00 0.00 H TER 39157 WAT 7369 ATOM 39157 O WAT 7370 62.100 36.043 74.762 1.00 0.00 O ATOM 39158 H1 WAT 7370 61.512 36.640 74.300 1.00 0.00 H ATOM 39159 H2 WAT 7370 61.935 35.188 74.364 1.00 0.00 H TER 39161 WAT 7370 ATOM 39161 O WAT 7371 46.183 44.126 107.117 1.00 0.00 O ATOM 39162 H1 WAT 7371 46.506 43.935 107.998 1.00 0.00 H ATOM 39163 H2 WAT 7371 46.019 45.069 107.121 1.00 0.00 H TER 39165 WAT 7371 ATOM 39165 O WAT 7372 56.111 103.568 150.730 1.00 0.00 O ATOM 39166 H1 WAT 7372 56.309 102.635 150.654 1.00 0.00 H ATOM 39167 H2 WAT 7372 55.963 103.707 151.665 1.00 0.00 H TER 39169 WAT 7372 ATOM 39169 O WAT 7373 56.817 106.436 139.747 1.00 0.00 O ATOM 39170 H1 WAT 7373 57.673 106.855 139.835 1.00 0.00 H ATOM 39171 H2 WAT 7373 56.799 105.779 140.442 1.00 0.00 H TER 39173 WAT 7373 ATOM 39173 O WAT 7374 95.443 113.853 115.152 1.00 0.00 O ATOM 39174 H1 WAT 7374 95.820 114.315 114.403 1.00 0.00 H ATOM 39175 H2 WAT 7374 95.051 113.065 114.774 1.00 0.00 H TER 39177 WAT 7374 ATOM 39177 O WAT 7375 65.640 36.394 90.243 1.00 0.00 O ATOM 39178 H1 WAT 7375 66.077 37.053 90.782 1.00 0.00 H ATOM 39179 H2 WAT 7375 65.879 36.622 89.345 1.00 0.00 H TER 39181 WAT 7375 ATOM 39181 O WAT 7376 18.312 80.885 144.918 1.00 0.00 O ATOM 39182 H1 WAT 7376 18.712 81.676 145.279 1.00 0.00 H ATOM 39183 H2 WAT 7376 17.423 81.152 144.684 1.00 0.00 H TER 39185 WAT 7376 ATOM 39185 O WAT 7377 139.149 45.371 19.744 1.00 0.00 O ATOM 39186 H1 WAT 7377 139.108 45.224 20.689 1.00 0.00 H ATOM 39187 H2 WAT 7377 139.038 44.501 19.361 1.00 0.00 H TER 39189 WAT 7377 ATOM 39189 O WAT 7378 89.596 48.898 97.017 1.00 0.00 O ATOM 39190 H1 WAT 7378 90.273 48.621 97.635 1.00 0.00 H ATOM 39191 H2 WAT 7378 89.726 49.842 96.927 1.00 0.00 H TER 39193 WAT 7378 ATOM 39193 O WAT 7379 106.693 97.583 158.173 1.00 0.00 O ATOM 39194 H1 WAT 7379 106.413 97.074 158.934 1.00 0.00 H ATOM 39195 H2 WAT 7379 106.110 97.302 157.468 1.00 0.00 H TER 39197 WAT 7379 ATOM 39197 O WAT 7380 140.336 80.864 107.096 1.00 0.00 O ATOM 39198 H1 WAT 7380 139.507 81.322 107.234 1.00 0.00 H ATOM 39199 H2 WAT 7380 140.327 80.626 106.169 1.00 0.00 H TER 39201 WAT 7380 ATOM 39201 O WAT 7381 89.433 30.875 132.645 1.00 0.00 O ATOM 39202 H1 WAT 7381 89.005 30.166 133.125 1.00 0.00 H ATOM 39203 H2 WAT 7381 90.368 30.724 132.777 1.00 0.00 H TER 39205 WAT 7381 ATOM 39205 O WAT 7382 38.880 41.694 15.587 1.00 0.00 O ATOM 39206 H1 WAT 7382 38.578 42.472 16.055 1.00 0.00 H ATOM 39207 H2 WAT 7382 38.670 40.966 16.172 1.00 0.00 H TER 39209 WAT 7382 ATOM 39209 O WAT 7383 52.061 16.552 147.320 1.00 0.00 O ATOM 39210 H1 WAT 7383 52.122 16.027 148.118 1.00 0.00 H ATOM 39211 H2 WAT 7383 51.519 16.029 146.730 1.00 0.00 H TER 39213 WAT 7383 ATOM 39213 O WAT 7384 81.739 112.480 83.225 1.00 0.00 O ATOM 39214 H1 WAT 7384 81.943 113.188 82.613 1.00 0.00 H ATOM 39215 H2 WAT 7384 82.567 112.302 83.671 1.00 0.00 H TER 39217 WAT 7384 ATOM 39217 O WAT 7385 133.689 102.802 11.322 1.00 0.00 O ATOM 39218 H1 WAT 7385 134.496 102.359 11.583 1.00 0.00 H ATOM 39219 H2 WAT 7385 133.306 103.106 12.145 1.00 0.00 H TER 39221 WAT 7385 ATOM 39221 O WAT 7386 91.994 133.472 85.686 1.00 0.00 O ATOM 39222 H1 WAT 7386 91.714 132.569 85.540 1.00 0.00 H ATOM 39223 H2 WAT 7386 92.095 133.541 86.636 1.00 0.00 H TER 39225 WAT 7386 ATOM 39225 O WAT 7387 99.869 5.168 136.309 1.00 0.00 O ATOM 39226 H1 WAT 7387 100.509 4.478 136.132 1.00 0.00 H ATOM 39227 H2 WAT 7387 100.155 5.554 137.137 1.00 0.00 H TER 39229 WAT 7387 ATOM 39229 O WAT 7388 37.276 97.804 100.968 1.00 0.00 O ATOM 39230 H1 WAT 7388 37.912 97.094 101.054 1.00 0.00 H ATOM 39231 H2 WAT 7388 36.510 97.393 100.567 1.00 0.00 H TER 39233 WAT 7388 ATOM 39233 O WAT 7389 73.869 72.201 130.836 1.00 0.00 O ATOM 39234 H1 WAT 7389 73.300 71.525 131.204 1.00 0.00 H ATOM 39235 H2 WAT 7389 74.600 71.716 130.452 1.00 0.00 H TER 39237 WAT 7389 ATOM 39237 O WAT 7390 23.491 3.852 77.685 1.00 0.00 O ATOM 39238 H1 WAT 7390 23.128 3.295 78.373 1.00 0.00 H ATOM 39239 H2 WAT 7390 23.716 3.246 76.979 1.00 0.00 H TER 39241 WAT 7390 ATOM 39241 O WAT 7391 138.114 24.113 151.921 1.00 0.00 O ATOM 39242 H1 WAT 7391 138.698 24.668 151.404 1.00 0.00 H ATOM 39243 H2 WAT 7391 138.335 24.315 152.830 1.00 0.00 H TER 39245 WAT 7391 ATOM 39245 O WAT 7392 10.099 115.778 57.887 1.00 0.00 O ATOM 39246 H1 WAT 7392 9.386 116.120 57.348 1.00 0.00 H ATOM 39247 H2 WAT 7392 10.848 115.732 57.292 1.00 0.00 H TER 39249 WAT 7392 ATOM 39249 O WAT 7393 4.491 110.716 62.329 1.00 0.00 O ATOM 39250 H1 WAT 7393 5.284 110.201 62.186 1.00 0.00 H ATOM 39251 H2 WAT 7393 3.812 110.251 61.839 1.00 0.00 H TER 39253 WAT 7393 ATOM 39253 O WAT 7394 76.282 101.126 87.561 1.00 0.00 O ATOM 39254 H1 WAT 7394 77.111 101.198 87.087 1.00 0.00 H ATOM 39255 H2 WAT 7394 75.887 100.319 87.231 1.00 0.00 H TER 39257 WAT 7394 ATOM 39257 O WAT 7395 140.124 7.774 114.893 1.00 0.00 O ATOM 39258 H1 WAT 7395 139.774 8.201 114.112 1.00 0.00 H ATOM 39259 H2 WAT 7395 139.466 7.934 115.569 1.00 0.00 H TER 39261 WAT 7395 ATOM 39261 O WAT 7396 55.983 4.625 117.754 1.00 0.00 O ATOM 39262 H1 WAT 7396 55.341 4.255 117.147 1.00 0.00 H ATOM 39263 H2 WAT 7396 55.456 5.068 118.419 1.00 0.00 H TER 39265 WAT 7396 ATOM 39265 O WAT 7397 89.937 83.792 54.212 1.00 0.00 O ATOM 39266 H1 WAT 7397 90.083 82.893 54.508 1.00 0.00 H ATOM 39267 H2 WAT 7397 89.079 84.025 54.568 1.00 0.00 H TER 39269 WAT 7397 ATOM 39269 O WAT 7398 84.457 33.192 58.253 1.00 0.00 O ATOM 39270 H1 WAT 7398 83.838 32.940 58.938 1.00 0.00 H ATOM 39271 H2 WAT 7398 84.029 32.933 57.437 1.00 0.00 H TER 39273 WAT 7398 ATOM 39273 O WAT 7399 65.339 86.577 110.051 1.00 0.00 O ATOM 39274 H1 WAT 7399 64.965 86.935 110.856 1.00 0.00 H ATOM 39275 H2 WAT 7399 64.928 87.082 109.350 1.00 0.00 H TER 39277 WAT 7399 ATOM 39277 O WAT 7400 77.532 40.588 7.265 1.00 0.00 O ATOM 39278 H1 WAT 7400 76.627 40.798 7.032 1.00 0.00 H ATOM 39279 H2 WAT 7400 78.021 41.387 7.070 1.00 0.00 H TER 39281 WAT 7400 ATOM 39281 O WAT 7401 127.453 89.479 65.875 1.00 0.00 O ATOM 39282 H1 WAT 7401 127.724 89.737 64.994 1.00 0.00 H ATOM 39283 H2 WAT 7401 127.129 88.584 65.773 1.00 0.00 H TER 39285 WAT 7401 ATOM 39285 O WAT 7402 27.002 49.728 71.887 1.00 0.00 O ATOM 39286 H1 WAT 7402 26.463 50.228 71.273 1.00 0.00 H ATOM 39287 H2 WAT 7402 26.376 49.203 72.384 1.00 0.00 H TER 39289 WAT 7402 ATOM 39289 O WAT 7403 9.681 63.892 128.717 1.00 0.00 O ATOM 39290 H1 WAT 7403 9.984 63.045 129.046 1.00 0.00 H ATOM 39291 H2 WAT 7403 10.403 64.209 128.173 1.00 0.00 H TER 39293 WAT 7403 ATOM 39293 O WAT 7404 41.534 51.163 150.792 1.00 0.00 O ATOM 39294 H1 WAT 7404 41.989 50.664 151.471 1.00 0.00 H ATOM 39295 H2 WAT 7404 42.231 51.471 150.213 1.00 0.00 H TER 39297 WAT 7404 ATOM 39297 O WAT 7405 10.729 36.672 21.691 1.00 0.00 O ATOM 39298 H1 WAT 7405 10.275 36.292 20.939 1.00 0.00 H ATOM 39299 H2 WAT 7405 10.265 37.491 21.862 1.00 0.00 H TER 39301 WAT 7405 ATOM 39301 O WAT 7406 35.396 122.101 116.958 1.00 0.00 O ATOM 39302 H1 WAT 7406 36.332 121.958 117.099 1.00 0.00 H ATOM 39303 H2 WAT 7406 34.968 121.531 117.597 1.00 0.00 H TER 39305 WAT 7406 ATOM 39305 O WAT 7407 35.908 12.924 128.253 1.00 0.00 O ATOM 39306 H1 WAT 7407 35.365 13.566 128.710 1.00 0.00 H ATOM 39307 H2 WAT 7407 35.824 13.154 127.328 1.00 0.00 H TER 39309 WAT 7407 ATOM 39309 O WAT 7408 142.764 86.513 148.966 1.00 0.00 O ATOM 39310 H1 WAT 7408 142.215 87.221 149.302 1.00 0.00 H ATOM 39311 H2 WAT 7408 143.237 86.191 149.734 1.00 0.00 H TER 39313 WAT 7408 ATOM 39313 O WAT 7409 68.677 13.638 15.314 1.00 0.00 O ATOM 39314 H1 WAT 7409 69.620 13.547 15.448 1.00 0.00 H ATOM 39315 H2 WAT 7409 68.459 12.959 14.675 1.00 0.00 H TER 39317 WAT 7409 ATOM 39317 O WAT 7410 61.073 86.923 75.035 1.00 0.00 O ATOM 39318 H1 WAT 7410 61.823 87.100 74.467 1.00 0.00 H ATOM 39319 H2 WAT 7410 60.322 87.271 74.555 1.00 0.00 H TER 39321 WAT 7410 ATOM 39321 O WAT 7411 56.390 22.478 107.772 1.00 0.00 O ATOM 39322 H1 WAT 7411 55.656 23.093 107.759 1.00 0.00 H ATOM 39323 H2 WAT 7411 57.065 22.900 107.240 1.00 0.00 H TER 39325 WAT 7411 ATOM 39325 O WAT 7412 48.598 0.205 125.311 1.00 0.00 O ATOM 39326 H1 WAT 7412 49.387 -0.138 124.891 1.00 0.00 H ATOM 39327 H2 WAT 7412 48.733 1.153 125.334 1.00 0.00 H TER 39329 WAT 7412 ATOM 39329 O WAT 7413 55.273 104.888 58.340 1.00 0.00 O ATOM 39330 H1 WAT 7413 54.933 104.587 59.183 1.00 0.00 H ATOM 39331 H2 WAT 7413 55.977 104.274 58.133 1.00 0.00 H TER 39333 WAT 7413 ATOM 39333 O WAT 7414 22.667 116.492 1.193 1.00 0.00 O ATOM 39334 H1 WAT 7414 22.977 117.075 1.886 1.00 0.00 H ATOM 39335 H2 WAT 7414 22.926 116.926 0.381 1.00 0.00 H TER 39337 WAT 7414 ATOM 39337 O WAT 7415 116.718 105.481 20.708 1.00 0.00 O ATOM 39338 H1 WAT 7415 116.389 106.279 21.123 1.00 0.00 H ATOM 39339 H2 WAT 7415 117.669 105.589 20.703 1.00 0.00 H TER 39341 WAT 7415 ATOM 39341 O WAT 7416 5.183 15.621 15.838 1.00 0.00 O ATOM 39342 H1 WAT 7416 5.431 15.599 14.914 1.00 0.00 H ATOM 39343 H2 WAT 7416 5.419 16.502 16.129 1.00 0.00 H TER 39345 WAT 7416 ATOM 39345 O WAT 7417 79.737 125.123 109.257 1.00 0.00 O ATOM 39346 H1 WAT 7417 79.119 125.415 108.587 1.00 0.00 H ATOM 39347 H2 WAT 7417 80.417 125.796 109.266 1.00 0.00 H TER 39349 WAT 7417 ATOM 39349 O WAT 7418 52.714 120.538 93.415 1.00 0.00 O ATOM 39350 H1 WAT 7418 53.241 120.246 92.671 1.00 0.00 H ATOM 39351 H2 WAT 7418 53.262 120.361 94.180 1.00 0.00 H TER 39353 WAT 7418 ATOM 39353 O WAT 7419 41.908 56.432 117.179 1.00 0.00 O ATOM 39354 H1 WAT 7419 42.317 56.985 117.844 1.00 0.00 H ATOM 39355 H2 WAT 7419 41.047 56.219 117.540 1.00 0.00 H TER 39357 WAT 7419 ATOM 39357 O WAT 7420 143.808 57.780 91.702 1.00 0.00 O ATOM 39358 H1 WAT 7420 143.729 58.209 92.553 1.00 0.00 H ATOM 39359 H2 WAT 7420 143.018 58.038 91.229 1.00 0.00 H TER 39361 WAT 7420 ATOM 39361 O WAT 7421 12.487 130.478 147.789 1.00 0.00 O ATOM 39362 H1 WAT 7421 11.688 130.014 147.540 1.00 0.00 H ATOM 39363 H2 WAT 7421 12.386 131.350 147.409 1.00 0.00 H TER 39365 WAT 7421 ATOM 39365 O WAT 7422 135.074 8.117 13.993 1.00 0.00 O ATOM 39366 H1 WAT 7422 135.339 7.211 13.835 1.00 0.00 H ATOM 39367 H2 WAT 7422 135.668 8.424 14.678 1.00 0.00 H TER 39369 WAT 7422 ATOM 39369 O WAT 7423 143.706 145.369 21.315 1.00 0.00 O ATOM 39370 H1 WAT 7423 144.156 145.966 20.717 1.00 0.00 H ATOM 39371 H2 WAT 7423 142.806 145.694 21.347 1.00 0.00 H TER 39373 WAT 7423 ATOM 39373 O WAT 7424 138.322 35.548 121.737 1.00 0.00 O ATOM 39374 H1 WAT 7424 138.444 36.320 121.185 1.00 0.00 H ATOM 39375 H2 WAT 7424 139.123 35.038 121.617 1.00 0.00 H TER 39377 WAT 7424 ATOM 39377 O WAT 7425 6.386 35.194 142.760 1.00 0.00 O ATOM 39378 H1 WAT 7425 5.883 35.938 142.428 1.00 0.00 H ATOM 39379 H2 WAT 7425 6.683 35.472 143.626 1.00 0.00 H TER 39381 WAT 7425 ATOM 39381 O WAT 7426 64.342 69.580 79.385 1.00 0.00 O ATOM 39382 H1 WAT 7426 64.897 69.620 78.606 1.00 0.00 H ATOM 39383 H2 WAT 7426 63.476 69.346 79.051 1.00 0.00 H TER 39385 WAT 7426 ATOM 39385 O WAT 7427 128.792 123.197 157.590 1.00 0.00 O ATOM 39386 H1 WAT 7427 129.032 123.826 158.271 1.00 0.00 H ATOM 39387 H2 WAT 7427 127.900 122.931 157.813 1.00 0.00 H TER 39389 WAT 7427 ATOM 39389 O WAT 7428 97.186 26.994 73.812 1.00 0.00 O ATOM 39390 H1 WAT 7428 97.174 26.043 73.921 1.00 0.00 H ATOM 39391 H2 WAT 7428 96.354 27.197 73.385 1.00 0.00 H TER 39393 WAT 7428 ATOM 39393 O WAT 7429 13.130 118.264 85.415 1.00 0.00 O ATOM 39394 H1 WAT 7429 13.906 118.653 85.819 1.00 0.00 H ATOM 39395 H2 WAT 7429 13.298 118.317 84.474 1.00 0.00 H TER 39397 WAT 7429 ATOM 39397 O WAT 7430 130.375 97.044 69.485 1.00 0.00 O ATOM 39398 H1 WAT 7430 129.870 97.657 70.019 1.00 0.00 H ATOM 39399 H2 WAT 7430 130.122 96.179 69.808 1.00 0.00 H TER 39401 WAT 7430 ATOM 39401 O WAT 7431 11.922 124.509 77.167 1.00 0.00 O ATOM 39402 H1 WAT 7431 11.929 124.852 78.060 1.00 0.00 H ATOM 39403 H2 WAT 7431 12.843 124.506 76.905 1.00 0.00 H TER 39405 WAT 7431 ATOM 39405 O WAT 7432 119.091 24.560 138.388 1.00 0.00 O ATOM 39406 H1 WAT 7432 118.344 24.323 137.838 1.00 0.00 H ATOM 39407 H2 WAT 7432 119.498 23.723 138.613 1.00 0.00 H TER 39409 WAT 7432 ATOM 39409 O WAT 7433 137.561 118.415 89.922 1.00 0.00 O ATOM 39410 H1 WAT 7433 136.804 118.994 89.826 1.00 0.00 H ATOM 39411 H2 WAT 7433 138.111 118.847 90.575 1.00 0.00 H TER 39413 WAT 7433 ATOM 39413 O WAT 7434 9.520 54.752 146.833 1.00 0.00 O ATOM 39414 H1 WAT 7434 9.012 54.580 146.040 1.00 0.00 H ATOM 39415 H2 WAT 7434 8.958 55.320 147.360 1.00 0.00 H TER 39417 WAT 7434 ATOM 39417 O WAT 7435 73.325 62.475 72.788 1.00 0.00 O ATOM 39418 H1 WAT 7435 73.353 63.203 72.168 1.00 0.00 H ATOM 39419 H2 WAT 7435 74.242 62.231 72.913 1.00 0.00 H TER 39421 WAT 7435 ATOM 39421 O WAT 7436 124.033 76.066 74.026 1.00 0.00 O ATOM 39422 H1 WAT 7436 123.135 75.879 73.750 1.00 0.00 H ATOM 39423 H2 WAT 7436 124.537 75.310 73.726 1.00 0.00 H TER 39425 WAT 7436 ATOM 39425 O WAT 7437 1.176 92.223 90.546 1.00 0.00 O ATOM 39426 H1 WAT 7437 2.034 91.859 90.762 1.00 0.00 H ATOM 39427 H2 WAT 7437 1.350 92.843 89.838 1.00 0.00 H TER 39429 WAT 7437 ATOM 39429 O WAT 7438 26.145 47.196 9.269 1.00 0.00 O ATOM 39430 H1 WAT 7438 26.890 46.596 9.289 1.00 0.00 H ATOM 39431 H2 WAT 7438 25.663 47.007 10.073 1.00 0.00 H TER 39433 WAT 7438 ATOM 39433 O WAT 7439 74.301 78.257 1.408 1.00 0.00 O ATOM 39434 H1 WAT 7439 74.589 77.386 1.134 1.00 0.00 H ATOM 39435 H2 WAT 7439 75.055 78.625 1.869 1.00 0.00 H TER 39437 WAT 7439 ATOM 39437 O WAT 7440 29.055 74.238 95.334 1.00 0.00 O ATOM 39438 H1 WAT 7440 29.376 73.519 95.879 1.00 0.00 H ATOM 39439 H2 WAT 7440 29.726 74.344 94.659 1.00 0.00 H TER 39441 WAT 7440 ATOM 39441 O WAT 7441 11.563 100.565 87.892 1.00 0.00 O ATOM 39442 H1 WAT 7441 11.663 100.197 88.770 1.00 0.00 H ATOM 39443 H2 WAT 7441 11.808 99.852 87.304 1.00 0.00 H TER 39445 WAT 7441 ATOM 39445 O WAT 7442 55.245 43.705 157.712 1.00 0.00 O ATOM 39446 H1 WAT 7442 55.524 43.898 158.607 1.00 0.00 H ATOM 39447 H2 WAT 7442 55.999 43.941 157.171 1.00 0.00 H TER 39449 WAT 7442 ATOM 39449 O WAT 7443 55.681 107.483 77.884 1.00 0.00 O ATOM 39450 H1 WAT 7443 55.365 108.327 78.205 1.00 0.00 H ATOM 39451 H2 WAT 7443 56.556 107.395 78.263 1.00 0.00 H TER 39453 WAT 7443 ATOM 39453 O WAT 7444 55.645 127.858 115.807 1.00 0.00 O ATOM 39454 H1 WAT 7444 54.733 127.651 115.601 1.00 0.00 H ATOM 39455 H2 WAT 7444 55.782 127.494 116.682 1.00 0.00 H TER 39457 WAT 7444 ATOM 39457 O WAT 7445 29.356 96.851 76.730 1.00 0.00 O ATOM 39458 H1 WAT 7445 29.204 97.718 76.354 1.00 0.00 H ATOM 39459 H2 WAT 7445 28.718 96.286 76.296 1.00 0.00 H TER 39461 WAT 7445 ATOM 39461 O WAT 7446 46.800 63.291 131.323 1.00 0.00 O ATOM 39462 H1 WAT 7446 46.742 62.336 131.349 1.00 0.00 H ATOM 39463 H2 WAT 7446 46.145 63.588 131.955 1.00 0.00 H TER 39465 WAT 7446 ATOM 39465 O WAT 7447 0.689 2.502 9.482 1.00 0.00 O ATOM 39466 H1 WAT 7447 0.268 2.028 10.200 1.00 0.00 H ATOM 39467 H2 WAT 7447 1.591 2.182 9.481 1.00 0.00 H TER 39469 WAT 7447 ATOM 39469 O WAT 7448 69.949 7.709 51.326 1.00 0.00 O ATOM 39470 H1 WAT 7448 69.331 8.044 50.676 1.00 0.00 H ATOM 39471 H2 WAT 7448 70.506 7.104 50.836 1.00 0.00 H TER 39473 WAT 7448 ATOM 39473 O WAT 7449 125.571 56.073 7.198 1.00 0.00 O ATOM 39474 H1 WAT 7449 126.496 56.155 6.968 1.00 0.00 H ATOM 39475 H2 WAT 7449 125.194 55.547 6.492 1.00 0.00 H TER 39477 WAT 7449 ATOM 39477 O WAT 7450 3.003 93.950 75.520 1.00 0.00 O ATOM 39478 H1 WAT 7450 2.740 94.672 74.948 1.00 0.00 H ATOM 39479 H2 WAT 7450 2.941 93.172 74.967 1.00 0.00 H TER 39481 WAT 7450 ATOM 39481 O WAT 7451 103.243 46.277 157.079 1.00 0.00 O ATOM 39482 H1 WAT 7451 103.602 46.346 157.964 1.00 0.00 H ATOM 39483 H2 WAT 7451 102.534 45.639 157.158 1.00 0.00 H TER 39485 WAT 7451 ATOM 39485 O WAT 7452 49.204 51.216 0.863 1.00 0.00 O ATOM 39486 H1 WAT 7452 49.389 51.155 -0.074 1.00 0.00 H ATOM 39487 H2 WAT 7452 48.349 50.799 0.967 1.00 0.00 H TER 39489 WAT 7452 ATOM 39489 O WAT 7453 141.576 91.906 2.874 1.00 0.00 O ATOM 39490 H1 WAT 7453 142.502 92.120 2.759 1.00 0.00 H ATOM 39491 H2 WAT 7453 141.557 90.951 2.933 1.00 0.00 H TER 39493 WAT 7453 ATOM 39493 O WAT 7454 17.296 121.632 130.975 1.00 0.00 O ATOM 39494 H1 WAT 7454 16.649 122.032 130.394 1.00 0.00 H ATOM 39495 H2 WAT 7454 17.682 122.370 131.447 1.00 0.00 H TER 39497 WAT 7454 ATOM 39497 O WAT 7455 88.845 140.850 62.849 1.00 0.00 O ATOM 39498 H1 WAT 7455 88.741 140.579 63.761 1.00 0.00 H ATOM 39499 H2 WAT 7455 88.082 141.402 62.675 1.00 0.00 H TER 39501 WAT 7455 ATOM 39501 O WAT 7456 34.109 121.600 130.542 1.00 0.00 O ATOM 39502 H1 WAT 7456 34.331 122.521 130.684 1.00 0.00 H ATOM 39503 H2 WAT 7456 34.173 121.202 131.410 1.00 0.00 H TER 39505 WAT 7456 ATOM 39505 O WAT 7457 27.275 123.319 124.525 1.00 0.00 O ATOM 39506 H1 WAT 7457 27.273 123.519 125.461 1.00 0.00 H ATOM 39507 H2 WAT 7457 26.456 122.844 124.380 1.00 0.00 H TER 39509 WAT 7457 ATOM 39509 O WAT 7458 14.700 23.306 82.581 1.00 0.00 O ATOM 39510 H1 WAT 7458 13.946 23.390 83.164 1.00 0.00 H ATOM 39511 H2 WAT 7458 14.681 22.393 82.293 1.00 0.00 H TER 39513 WAT 7458 ATOM 39513 O WAT 7459 108.362 86.836 77.623 1.00 0.00 O ATOM 39514 H1 WAT 7459 107.412 86.739 77.685 1.00 0.00 H ATOM 39515 H2 WAT 7459 108.652 86.937 78.529 1.00 0.00 H TER 39517 WAT 7459 ATOM 39517 O WAT 7460 20.638 102.085 114.348 1.00 0.00 O ATOM 39518 H1 WAT 7460 20.239 102.296 115.192 1.00 0.00 H ATOM 39519 H2 WAT 7460 20.775 101.138 114.377 1.00 0.00 H TER 39521 WAT 7460 ATOM 39521 O WAT 7461 131.810 49.992 101.672 1.00 0.00 O ATOM 39522 H1 WAT 7461 131.672 50.870 102.025 1.00 0.00 H ATOM 39523 H2 WAT 7461 132.350 50.129 100.893 1.00 0.00 H TER 39525 WAT 7461 ATOM 39525 O WAT 7462 11.742 44.541 84.985 1.00 0.00 O ATOM 39526 H1 WAT 7462 11.178 44.386 84.228 1.00 0.00 H ATOM 39527 H2 WAT 7462 12.193 43.708 85.123 1.00 0.00 H TER 39529 WAT 7462 ATOM 39529 O WAT 7463 20.915 93.840 90.863 1.00 0.00 O ATOM 39530 H1 WAT 7463 21.039 92.909 91.050 1.00 0.00 H ATOM 39531 H2 WAT 7463 21.162 93.935 89.943 1.00 0.00 H TER 39533 WAT 7463 ATOM 39533 O WAT 7464 59.899 133.053 81.097 1.00 0.00 O ATOM 39534 H1 WAT 7464 60.142 133.273 81.996 1.00 0.00 H ATOM 39535 H2 WAT 7464 60.614 132.500 80.783 1.00 0.00 H TER 39537 WAT 7464 ATOM 39537 O WAT 7465 13.114 145.504 69.183 1.00 0.00 O ATOM 39538 H1 WAT 7465 12.401 145.465 68.546 1.00 0.00 H ATOM 39539 H2 WAT 7465 13.688 144.775 68.947 1.00 0.00 H TER 39541 WAT 7465 ATOM 39541 O WAT 7466 111.940 58.775 126.029 1.00 0.00 O ATOM 39542 H1 WAT 7466 111.953 59.361 125.272 1.00 0.00 H ATOM 39543 H2 WAT 7466 112.669 59.072 126.574 1.00 0.00 H TER 39545 WAT 7466 ATOM 39545 O WAT 7467 41.969 115.392 137.046 1.00 0.00 O ATOM 39546 H1 WAT 7467 42.233 114.918 136.257 1.00 0.00 H ATOM 39547 H2 WAT 7467 41.548 116.186 136.718 1.00 0.00 H TER 39549 WAT 7467 ATOM 39549 O WAT 7468 74.191 43.056 131.496 1.00 0.00 O ATOM 39550 H1 WAT 7468 73.569 43.774 131.375 1.00 0.00 H ATOM 39551 H2 WAT 7468 75.043 43.441 131.290 1.00 0.00 H TER 39553 WAT 7468 ATOM 39553 O WAT 7469 5.727 68.440 6.026 1.00 0.00 O ATOM 39554 H1 WAT 7469 5.220 67.629 6.047 1.00 0.00 H ATOM 39555 H2 WAT 7469 6.398 68.321 6.698 1.00 0.00 H TER 39557 WAT 7469 ATOM 39557 O WAT 7470 75.293 84.541 66.535 1.00 0.00 O ATOM 39558 H1 WAT 7470 75.623 85.266 66.003 1.00 0.00 H ATOM 39559 H2 WAT 7470 75.006 84.953 67.349 1.00 0.00 H TER 39561 WAT 7470 ATOM 39561 O WAT 7471 129.476 68.094 155.109 1.00 0.00 O ATOM 39562 H1 WAT 7471 129.586 67.186 154.827 1.00 0.00 H ATOM 39563 H2 WAT 7471 128.711 68.404 154.624 1.00 0.00 H TER 39565 WAT 7471 ATOM 39565 O WAT 7472 85.191 129.232 123.290 1.00 0.00 O ATOM 39566 H1 WAT 7472 85.611 128.603 123.877 1.00 0.00 H ATOM 39567 H2 WAT 7472 84.422 129.534 123.774 1.00 0.00 H TER 39569 WAT 7472 ATOM 39569 O WAT 7473 99.101 41.751 157.869 1.00 0.00 O ATOM 39570 H1 WAT 7473 99.184 41.022 158.483 1.00 0.00 H ATOM 39571 H2 WAT 7473 98.638 41.380 157.118 1.00 0.00 H TER 39573 WAT 7473 ATOM 39573 O WAT 7474 27.276 7.962 2.220 1.00 0.00 O ATOM 39574 H1 WAT 7474 27.504 7.889 3.147 1.00 0.00 H ATOM 39575 H2 WAT 7474 26.438 7.505 2.143 1.00 0.00 H TER 39577 WAT 7474 ATOM 39577 O WAT 7475 75.791 74.339 101.985 1.00 0.00 O ATOM 39578 H1 WAT 7475 75.795 74.809 102.819 1.00 0.00 H ATOM 39579 H2 WAT 7475 75.190 73.608 102.125 1.00 0.00 H TER 39581 WAT 7475 ATOM 39581 O WAT 7476 13.478 61.840 70.504 1.00 0.00 O ATOM 39582 H1 WAT 7476 12.780 62.100 71.105 1.00 0.00 H ATOM 39583 H2 WAT 7476 13.038 61.728 69.661 1.00 0.00 H TER 39585 WAT 7476 ATOM 39585 O WAT 7477 135.607 77.988 126.272 1.00 0.00 O ATOM 39586 H1 WAT 7477 135.626 78.594 127.013 1.00 0.00 H ATOM 39587 H2 WAT 7477 136.463 77.560 126.291 1.00 0.00 H TER 39589 WAT 7477 ATOM 39589 O WAT 7478 117.406 84.357 101.622 1.00 0.00 O ATOM 39590 H1 WAT 7478 118.034 83.666 101.836 1.00 0.00 H ATOM 39591 H2 WAT 7478 117.494 84.989 102.335 1.00 0.00 H TER 39593 WAT 7478 ATOM 39593 O WAT 7479 39.221 43.110 157.206 1.00 0.00 O ATOM 39594 H1 WAT 7479 39.550 44.006 157.274 1.00 0.00 H ATOM 39595 H2 WAT 7479 38.621 43.017 157.946 1.00 0.00 H TER 39597 WAT 7479 ATOM 39597 O WAT 7480 22.253 71.049 90.641 1.00 0.00 O ATOM 39598 H1 WAT 7480 21.919 70.477 89.949 1.00 0.00 H ATOM 39599 H2 WAT 7480 21.567 71.043 91.308 1.00 0.00 H TER 39601 WAT 7480 ATOM 39601 O WAT 7481 50.397 135.670 126.879 1.00 0.00 O ATOM 39602 H1 WAT 7481 49.532 136.046 127.045 1.00 0.00 H ATOM 39603 H2 WAT 7481 50.549 135.822 125.947 1.00 0.00 H TER 39605 WAT 7481 ATOM 39605 O WAT 7482 0.371 66.716 149.305 1.00 0.00 O ATOM 39606 H1 WAT 7482 0.961 65.987 149.498 1.00 0.00 H ATOM 39607 H2 WAT 7482 0.224 66.661 148.360 1.00 0.00 H TER 39609 WAT 7482 ATOM 39609 O WAT 7483 139.553 134.610 77.742 1.00 0.00 O ATOM 39610 H1 WAT 7483 139.537 135.558 77.874 1.00 0.00 H ATOM 39611 H2 WAT 7483 139.381 134.244 78.609 1.00 0.00 H TER 39613 WAT 7483 ATOM 39613 O WAT 7484 42.225 142.039 13.200 1.00 0.00 O ATOM 39614 H1 WAT 7484 41.607 141.982 13.928 1.00 0.00 H ATOM 39615 H2 WAT 7484 41.674 142.146 12.425 1.00 0.00 H TER 39617 WAT 7484 ATOM 39617 O WAT 7485 3.570 88.049 55.622 1.00 0.00 O ATOM 39618 H1 WAT 7485 3.982 87.375 55.083 1.00 0.00 H ATOM 39619 H2 WAT 7485 4.191 88.777 55.611 1.00 0.00 H TER 39621 WAT 7485 ATOM 39621 O WAT 7486 123.295 93.521 132.824 1.00 0.00 O ATOM 39622 H1 WAT 7486 123.872 93.797 133.536 1.00 0.00 H ATOM 39623 H2 WAT 7486 123.469 92.585 132.724 1.00 0.00 H TER 39625 WAT 7486 ATOM 39625 O WAT 7487 1.226 72.606 109.369 1.00 0.00 O ATOM 39626 H1 WAT 7487 0.938 73.014 110.186 1.00 0.00 H ATOM 39627 H2 WAT 7487 1.062 71.672 109.497 1.00 0.00 H TER 39629 WAT 7487 ATOM 39629 O WAT 7488 64.952 21.282 156.908 1.00 0.00 O ATOM 39630 H1 WAT 7488 64.889 20.741 157.695 1.00 0.00 H ATOM 39631 H2 WAT 7488 64.045 21.399 156.625 1.00 0.00 H TER 39633 WAT 7488 ATOM 39633 O WAT 7489 108.737 74.712 158.003 1.00 0.00 O ATOM 39634 H1 WAT 7489 108.991 74.716 157.080 1.00 0.00 H ATOM 39635 H2 WAT 7489 109.128 75.509 158.362 1.00 0.00 H TER 39637 WAT 7489 ATOM 39637 O WAT 7490 50.189 26.514 117.880 1.00 0.00 O ATOM 39638 H1 WAT 7490 49.741 27.346 118.034 1.00 0.00 H ATOM 39639 H2 WAT 7490 50.010 26.313 116.961 1.00 0.00 H TER 39641 WAT 7490 ATOM 39641 O WAT 7491 117.159 138.624 137.894 1.00 0.00 O ATOM 39642 H1 WAT 7491 116.817 138.666 138.787 1.00 0.00 H ATOM 39643 H2 WAT 7491 117.675 139.424 137.797 1.00 0.00 H TER 39645 WAT 7491 ATOM 39645 O WAT 7492 76.576 21.223 134.002 1.00 0.00 O ATOM 39646 H1 WAT 7492 77.279 21.713 134.429 1.00 0.00 H ATOM 39647 H2 WAT 7492 76.373 20.515 134.613 1.00 0.00 H TER 39649 WAT 7492 ATOM 39649 O WAT 7493 26.930 104.893 101.223 1.00 0.00 O ATOM 39650 H1 WAT 7493 27.693 104.348 101.419 1.00 0.00 H ATOM 39651 H2 WAT 7493 26.181 104.309 101.344 1.00 0.00 H TER 39653 WAT 7493 ATOM 39653 O WAT 7494 81.192 7.183 155.449 1.00 0.00 O ATOM 39654 H1 WAT 7494 81.409 7.034 156.369 1.00 0.00 H ATOM 39655 H2 WAT 7494 80.303 7.537 155.467 1.00 0.00 H TER 39657 WAT 7494 ATOM 39657 O WAT 7495 80.129 40.498 157.153 1.00 0.00 O ATOM 39658 H1 WAT 7495 80.989 40.193 156.865 1.00 0.00 H ATOM 39659 H2 WAT 7495 79.511 39.886 156.754 1.00 0.00 H TER 39661 WAT 7495 ATOM 39661 O WAT 7496 46.488 93.848 16.306 1.00 0.00 O ATOM 39662 H1 WAT 7496 47.312 93.384 16.456 1.00 0.00 H ATOM 39663 H2 WAT 7496 46.089 93.394 15.565 1.00 0.00 H TER 39665 WAT 7496 ATOM 39665 O WAT 7497 23.782 77.698 77.164 1.00 0.00 O ATOM 39666 H1 WAT 7497 24.167 78.482 76.773 1.00 0.00 H ATOM 39667 H2 WAT 7497 22.839 77.866 77.158 1.00 0.00 H TER 39669 WAT 7497 ATOM 39669 O WAT 7498 33.859 100.172 133.019 1.00 0.00 O ATOM 39670 H1 WAT 7498 34.251 100.750 133.673 1.00 0.00 H ATOM 39671 H2 WAT 7498 33.657 100.748 132.281 1.00 0.00 H TER 39673 WAT 7498 ATOM 39673 O WAT 7499 50.106 56.016 53.923 1.00 0.00 O ATOM 39674 H1 WAT 7499 49.830 55.286 53.368 1.00 0.00 H ATOM 39675 H2 WAT 7499 51.060 55.938 53.962 1.00 0.00 H TER 39677 WAT 7499 ATOM 39677 O WAT 7500 15.879 116.584 79.227 1.00 0.00 O ATOM 39678 H1 WAT 7500 16.394 116.386 80.009 1.00 0.00 H ATOM 39679 H2 WAT 7500 15.679 115.728 78.849 1.00 0.00 H TER 39681 WAT 7500 ATOM 39681 O WAT 7501 48.216 99.398 105.691 1.00 0.00 O ATOM 39682 H1 WAT 7501 49.156 99.311 105.851 1.00 0.00 H ATOM 39683 H2 WAT 7501 47.840 99.562 106.555 1.00 0.00 H TER 39685 WAT 7501 ATOM 39685 O WAT 7502 71.455 104.203 119.156 1.00 0.00 O ATOM 39686 H1 WAT 7502 71.941 105.027 119.121 1.00 0.00 H ATOM 39687 H2 WAT 7502 70.900 104.284 119.932 1.00 0.00 H TER 39689 WAT 7502 ATOM 39689 O WAT 7503 94.557 13.386 83.297 1.00 0.00 O ATOM 39690 H1 WAT 7503 95.352 13.466 83.824 1.00 0.00 H ATOM 39691 H2 WAT 7503 94.077 14.197 83.463 1.00 0.00 H TER 39693 WAT 7503 ATOM 39693 O WAT 7504 3.593 58.661 118.199 1.00 0.00 O ATOM 39694 H1 WAT 7504 4.291 58.842 117.569 1.00 0.00 H ATOM 39695 H2 WAT 7504 3.696 57.733 118.411 1.00 0.00 H TER 39697 WAT 7504 ATOM 39697 O WAT 7505 55.512 1.267 17.283 1.00 0.00 O ATOM 39698 H1 WAT 7505 55.946 1.748 16.579 1.00 0.00 H ATOM 39699 H2 WAT 7505 54.742 1.795 17.494 1.00 0.00 H TER 39701 WAT 7505 ATOM 39701 O WAT 7506 84.839 93.740 29.385 1.00 0.00 O ATOM 39702 H1 WAT 7506 84.852 94.481 28.779 1.00 0.00 H ATOM 39703 H2 WAT 7506 84.382 94.071 30.158 1.00 0.00 H TER 39705 WAT 7506 ATOM 39705 O WAT 7507 46.034 129.013 81.603 1.00 0.00 O ATOM 39706 H1 WAT 7507 46.487 128.325 81.116 1.00 0.00 H ATOM 39707 H2 WAT 7507 45.257 129.206 81.078 1.00 0.00 H TER 39709 WAT 7507 ATOM 39709 O WAT 7508 24.933 122.824 97.216 1.00 0.00 O ATOM 39710 H1 WAT 7508 25.785 123.260 97.217 1.00 0.00 H ATOM 39711 H2 WAT 7508 24.322 123.493 96.908 1.00 0.00 H TER 39713 WAT 7508 ATOM 39713 O WAT 7509 73.509 110.951 81.733 1.00 0.00 O ATOM 39714 H1 WAT 7509 74.456 110.962 81.594 1.00 0.00 H ATOM 39715 H2 WAT 7509 73.357 111.618 82.403 1.00 0.00 H TER 39717 WAT 7509 ATOM 39717 O WAT 7510 63.302 50.675 109.197 1.00 0.00 O ATOM 39718 H1 WAT 7510 63.511 49.782 109.472 1.00 0.00 H ATOM 39719 H2 WAT 7510 62.425 50.834 109.545 1.00 0.00 H TER 39721 WAT 7510 ATOM 39721 O WAT 7511 92.095 122.487 72.239 1.00 0.00 O ATOM 39722 H1 WAT 7511 92.271 123.401 72.462 1.00 0.00 H ATOM 39723 H2 WAT 7511 92.229 122.441 71.292 1.00 0.00 H TER 39725 WAT 7511 ATOM 39725 O WAT 7512 100.431 103.122 28.270 1.00 0.00 O ATOM 39726 H1 WAT 7512 99.761 102.632 27.792 1.00 0.00 H ATOM 39727 H2 WAT 7512 100.362 104.014 27.930 1.00 0.00 H TER 39729 WAT 7512 ATOM 39729 O WAT 7513 104.567 141.975 118.330 1.00 0.00 O ATOM 39730 H1 WAT 7513 105.055 141.907 119.151 1.00 0.00 H ATOM 39731 H2 WAT 7513 104.279 141.080 118.148 1.00 0.00 H TER 39733 WAT 7513 ATOM 39733 O WAT 7514 119.870 3.633 77.738 1.00 0.00 O ATOM 39734 H1 WAT 7514 120.078 3.624 76.804 1.00 0.00 H ATOM 39735 H2 WAT 7514 120.520 4.220 78.123 1.00 0.00 H TER 39737 WAT 7514 ATOM 39737 O WAT 7515 33.119 49.371 68.953 1.00 0.00 O ATOM 39738 H1 WAT 7515 33.976 48.954 68.859 1.00 0.00 H ATOM 39739 H2 WAT 7515 33.311 50.309 68.977 1.00 0.00 H TER 39741 WAT 7515 ATOM 39741 O WAT 7516 54.250 87.958 93.404 1.00 0.00 O ATOM 39742 H1 WAT 7516 54.774 87.935 92.603 1.00 0.00 H ATOM 39743 H2 WAT 7516 53.662 87.207 93.327 1.00 0.00 H TER 39745 WAT 7516 ATOM 39745 O WAT 7517 20.851 94.779 63.467 1.00 0.00 O ATOM 39746 H1 WAT 7517 21.081 95.410 64.150 1.00 0.00 H ATOM 39747 H2 WAT 7517 19.967 94.491 63.696 1.00 0.00 H TER 39749 WAT 7517 ATOM 39749 O WAT 7518 41.098 91.213 158.689 1.00 0.00 O ATOM 39750 H1 WAT 7518 41.472 90.335 158.607 1.00 0.00 H ATOM 39751 H2 WAT 7518 40.169 91.097 158.487 1.00 0.00 H TER 39753 WAT 7518 ATOM 39753 O WAT 7519 123.779 51.328 87.844 1.00 0.00 O ATOM 39754 H1 WAT 7519 123.562 50.559 88.370 1.00 0.00 H ATOM 39755 H2 WAT 7519 123.080 51.377 87.191 1.00 0.00 H TER 39757 WAT 7519 ATOM 39757 O WAT 7520 67.446 130.722 86.098 1.00 0.00 O ATOM 39758 H1 WAT 7520 67.075 130.508 85.242 1.00 0.00 H ATOM 39759 H2 WAT 7520 67.649 131.656 86.044 1.00 0.00 H TER 39761 WAT 7520 ATOM 39761 O WAT 7521 100.551 137.304 141.395 1.00 0.00 O ATOM 39762 H1 WAT 7521 100.023 137.684 140.693 1.00 0.00 H ATOM 39763 H2 WAT 7521 100.690 138.026 142.008 1.00 0.00 H TER 39765 WAT 7521 ATOM 39765 O WAT 7522 8.977 79.031 5.630 1.00 0.00 O ATOM 39766 H1 WAT 7522 9.339 79.736 6.167 1.00 0.00 H ATOM 39767 H2 WAT 7522 9.692 78.784 5.044 1.00 0.00 H TER 39769 WAT 7522 ATOM 39769 O WAT 7523 99.298 62.548 75.808 1.00 0.00 O ATOM 39770 H1 WAT 7523 99.880 63.127 76.300 1.00 0.00 H ATOM 39771 H2 WAT 7523 98.471 63.029 75.756 1.00 0.00 H TER 39773 WAT 7523 ATOM 39773 O WAT 7524 77.076 17.187 119.891 1.00 0.00 O ATOM 39774 H1 WAT 7524 76.553 17.638 119.228 1.00 0.00 H ATOM 39775 H2 WAT 7524 77.981 17.307 119.606 1.00 0.00 H TER 39777 WAT 7524 ATOM 39777 O WAT 7525 142.783 126.606 88.572 1.00 0.00 O ATOM 39778 H1 WAT 7525 142.929 127.501 88.878 1.00 0.00 H ATOM 39779 H2 WAT 7525 143.614 126.159 88.731 1.00 0.00 H TER 39781 WAT 7525 ATOM 39781 O WAT 7526 134.799 17.171 140.971 1.00 0.00 O ATOM 39782 H1 WAT 7526 135.216 17.803 141.557 1.00 0.00 H ATOM 39783 H2 WAT 7526 134.203 17.697 140.438 1.00 0.00 H TER 39785 WAT 7526 ATOM 39785 O WAT 7527 62.892 90.878 155.795 1.00 0.00 O ATOM 39786 H1 WAT 7527 63.463 90.716 155.044 1.00 0.00 H ATOM 39787 H2 WAT 7527 62.288 90.136 155.802 1.00 0.00 H TER 39789 WAT 7527 ATOM 39789 O WAT 7528 12.997 118.432 72.945 1.00 0.00 O ATOM 39790 H1 WAT 7528 13.311 118.020 72.140 1.00 0.00 H ATOM 39791 H2 WAT 7528 13.399 119.301 72.942 1.00 0.00 H TER 39793 WAT 7528 ATOM 39793 O WAT 7529 36.662 67.565 135.315 1.00 0.00 O ATOM 39794 H1 WAT 7529 37.221 68.302 135.562 1.00 0.00 H ATOM 39795 H2 WAT 7529 36.961 66.842 135.866 1.00 0.00 H TER 39797 WAT 7529 ATOM 39797 O WAT 7530 76.529 97.607 131.151 1.00 0.00 O ATOM 39798 H1 WAT 7530 77.229 98.219 131.379 1.00 0.00 H ATOM 39799 H2 WAT 7530 75.941 97.624 131.906 1.00 0.00 H TER 39801 WAT 7530 ATOM 39801 O WAT 7531 110.796 93.228 22.955 1.00 0.00 O ATOM 39802 H1 WAT 7531 110.922 93.505 22.047 1.00 0.00 H ATOM 39803 H2 WAT 7531 110.405 93.988 23.385 1.00 0.00 H TER 39805 WAT 7531 ATOM 39805 O WAT 7532 61.892 82.754 128.650 1.00 0.00 O ATOM 39806 H1 WAT 7532 61.356 81.981 128.830 1.00 0.00 H ATOM 39807 H2 WAT 7532 62.785 82.415 128.584 1.00 0.00 H TER 39809 WAT 7532 ATOM 39809 O WAT 7533 57.807 144.521 61.481 1.00 0.00 O ATOM 39810 H1 WAT 7533 56.991 144.022 61.508 1.00 0.00 H ATOM 39811 H2 WAT 7533 57.541 145.400 61.210 1.00 0.00 H TER 39813 WAT 7533 ATOM 39813 O WAT 7534 10.710 88.806 114.439 1.00 0.00 O ATOM 39814 H1 WAT 7534 11.481 89.308 114.176 1.00 0.00 H ATOM 39815 H2 WAT 7534 9.974 89.274 114.046 1.00 0.00 H TER 39817 WAT 7534 ATOM 39817 O WAT 7535 7.589 136.360 91.919 1.00 0.00 O ATOM 39818 H1 WAT 7535 6.778 136.863 91.843 1.00 0.00 H ATOM 39819 H2 WAT 7535 7.740 136.015 91.039 1.00 0.00 H TER 39821 WAT 7535 ATOM 39821 O WAT 7536 49.892 126.408 125.163 1.00 0.00 O ATOM 39822 H1 WAT 7536 49.002 126.743 125.276 1.00 0.00 H ATOM 39823 H2 WAT 7536 50.129 126.064 126.024 1.00 0.00 H TER 39825 WAT 7536 ATOM 39825 O WAT 7537 6.577 73.223 16.568 1.00 0.00 O ATOM 39826 H1 WAT 7537 5.914 72.887 15.963 1.00 0.00 H ATOM 39827 H2 WAT 7537 6.476 72.687 17.355 1.00 0.00 H TER 39829 WAT 7537 ATOM 39829 O WAT 7538 115.955 95.234 65.644 1.00 0.00 O ATOM 39830 H1 WAT 7538 115.862 94.662 64.882 1.00 0.00 H ATOM 39831 H2 WAT 7538 115.078 95.593 65.782 1.00 0.00 H TER 39833 WAT 7538 ATOM 39833 O WAT 7539 71.974 93.524 136.863 1.00 0.00 O ATOM 39834 H1 WAT 7539 72.614 92.957 137.294 1.00 0.00 H ATOM 39835 H2 WAT 7539 72.350 93.695 135.999 1.00 0.00 H TER 39837 WAT 7539 ATOM 39837 O WAT 7540 6.008 33.134 125.269 1.00 0.00 O ATOM 39838 H1 WAT 7540 5.521 33.132 124.445 1.00 0.00 H ATOM 39839 H2 WAT 7540 6.559 33.915 125.221 1.00 0.00 H TER 39841 WAT 7540 ATOM 39841 O WAT 7541 125.291 137.493 107.512 1.00 0.00 O ATOM 39842 H1 WAT 7541 125.185 137.076 106.657 1.00 0.00 H ATOM 39843 H2 WAT 7541 124.513 137.230 108.005 1.00 0.00 H TER 39845 WAT 7541 ATOM 39845 O WAT 7542 60.954 91.122 152.376 1.00 0.00 O ATOM 39846 H1 WAT 7542 60.624 91.331 151.502 1.00 0.00 H ATOM 39847 H2 WAT 7542 61.809 91.550 152.417 1.00 0.00 H TER 39849 WAT 7542 ATOM 39849 O WAT 7543 2.719 16.331 100.319 1.00 0.00 O ATOM 39850 H1 WAT 7543 2.713 15.431 100.644 1.00 0.00 H ATOM 39851 H2 WAT 7543 2.941 16.860 101.086 1.00 0.00 H TER 39853 WAT 7543 ATOM 39853 O WAT 7544 138.525 31.958 116.107 1.00 0.00 O ATOM 39854 H1 WAT 7544 139.474 31.848 116.051 1.00 0.00 H ATOM 39855 H2 WAT 7544 138.314 32.573 115.404 1.00 0.00 H TER 39857 WAT 7544 ATOM 39857 O WAT 7545 72.261 58.021 10.170 1.00 0.00 O ATOM 39858 H1 WAT 7545 72.306 57.285 9.560 1.00 0.00 H ATOM 39859 H2 WAT 7545 72.011 58.768 9.626 1.00 0.00 H TER 39861 WAT 7545 ATOM 39861 O WAT 7546 140.117 54.241 105.203 1.00 0.00 O ATOM 39862 H1 WAT 7546 139.912 55.040 104.717 1.00 0.00 H ATOM 39863 H2 WAT 7546 139.468 54.214 105.906 1.00 0.00 H TER 39865 WAT 7546 ATOM 39865 O WAT 7547 90.429 57.660 67.630 1.00 0.00 O ATOM 39866 H1 WAT 7547 89.939 57.001 67.138 1.00 0.00 H ATOM 39867 H2 WAT 7547 90.162 58.494 67.245 1.00 0.00 H TER 39869 WAT 7547 ATOM 39869 O WAT 7548 104.125 115.556 151.285 1.00 0.00 O ATOM 39870 H1 WAT 7548 103.837 115.203 150.444 1.00 0.00 H ATOM 39871 H2 WAT 7548 105.064 115.375 151.313 1.00 0.00 H TER 39873 WAT 7548 ATOM 39873 O WAT 7549 88.219 3.960 117.664 1.00 0.00 O ATOM 39874 H1 WAT 7549 88.356 3.275 117.010 1.00 0.00 H ATOM 39875 H2 WAT 7549 88.852 4.640 117.436 1.00 0.00 H TER 39877 WAT 7549 ATOM 39877 O WAT 7550 66.705 134.015 139.562 1.00 0.00 O ATOM 39878 H1 WAT 7550 66.238 134.839 139.423 1.00 0.00 H ATOM 39879 H2 WAT 7550 66.350 133.424 138.899 1.00 0.00 H TER 39881 WAT 7550 ATOM 39881 O WAT 7551 62.550 127.162 57.348 1.00 0.00 O ATOM 39882 H1 WAT 7551 62.552 126.206 57.391 1.00 0.00 H ATOM 39883 H2 WAT 7551 63.052 127.438 58.114 1.00 0.00 H TER 39885 WAT 7551 ATOM 39885 O WAT 7552 127.160 27.824 6.998 1.00 0.00 O ATOM 39886 H1 WAT 7552 127.213 28.154 7.895 1.00 0.00 H ATOM 39887 H2 WAT 7552 126.239 27.928 6.758 1.00 0.00 H TER 39889 WAT 7552 ATOM 39889 O WAT 7553 111.534 23.289 121.361 1.00 0.00 O ATOM 39890 H1 WAT 7553 110.757 23.352 120.805 1.00 0.00 H ATOM 39891 H2 WAT 7553 111.235 22.815 122.137 1.00 0.00 H TER 39893 WAT 7553 ATOM 39893 O WAT 7554 111.139 118.788 109.307 1.00 0.00 O ATOM 39894 H1 WAT 7554 111.519 118.182 108.671 1.00 0.00 H ATOM 39895 H2 WAT 7554 111.792 119.481 109.397 1.00 0.00 H TER 39897 WAT 7554 ATOM 39897 O WAT 7555 6.712 73.225 144.245 1.00 0.00 O ATOM 39898 H1 WAT 7555 6.363 73.939 144.779 1.00 0.00 H ATOM 39899 H2 WAT 7555 6.095 72.504 144.376 1.00 0.00 H TER 39901 WAT 7555 ATOM 39901 O WAT 7556 130.573 59.364 130.841 1.00 0.00 O ATOM 39902 H1 WAT 7556 131.426 59.112 130.487 1.00 0.00 H ATOM 39903 H2 WAT 7556 130.379 60.204 130.426 1.00 0.00 H TER 39905 WAT 7556 ATOM 39905 O WAT 7557 145.000 49.023 11.365 1.00 0.00 O ATOM 39906 H1 WAT 7557 145.707 48.981 10.721 1.00 0.00 H ATOM 39907 H2 WAT 7557 144.542 49.839 11.165 1.00 0.00 H TER 39909 WAT 7557 ATOM 39909 O WAT 7558 28.889 76.235 102.052 1.00 0.00 O ATOM 39910 H1 WAT 7558 28.433 76.393 101.225 1.00 0.00 H ATOM 39911 H2 WAT 7558 29.697 75.790 101.800 1.00 0.00 H TER 39913 WAT 7558 ATOM 39913 O WAT 7559 131.018 4.658 150.654 1.00 0.00 O ATOM 39914 H1 WAT 7559 130.379 4.416 151.324 1.00 0.00 H ATOM 39915 H2 WAT 7559 130.489 4.962 149.917 1.00 0.00 H TER 39917 WAT 7559 ATOM 39917 O WAT 7560 4.240 85.746 95.873 1.00 0.00 O ATOM 39918 H1 WAT 7560 3.480 85.164 95.840 1.00 0.00 H ATOM 39919 H2 WAT 7560 4.608 85.710 94.991 1.00 0.00 H TER 39921 WAT 7560 ATOM 39921 O WAT 7561 89.078 47.478 75.340 1.00 0.00 O ATOM 39922 H1 WAT 7561 89.484 48.256 74.957 1.00 0.00 H ATOM 39923 H2 WAT 7561 89.038 47.666 76.278 1.00 0.00 H TER 39925 WAT 7561 ATOM 39925 O WAT 7562 128.343 63.119 69.769 1.00 0.00 O ATOM 39926 H1 WAT 7562 127.926 62.337 70.131 1.00 0.00 H ATOM 39927 H2 WAT 7562 128.823 62.802 69.004 1.00 0.00 H TER 39929 WAT 7562 ATOM 39929 O WAT 7563 14.458 130.043 81.235 1.00 0.00 O ATOM 39930 H1 WAT 7563 13.710 129.449 81.294 1.00 0.00 H ATOM 39931 H2 WAT 7563 14.633 130.300 82.140 1.00 0.00 H TER 39933 WAT 7563 ATOM 39933 O WAT 7564 69.433 55.934 74.751 1.00 0.00 O ATOM 39934 H1 WAT 7564 70.177 55.494 74.339 1.00 0.00 H ATOM 39935 H2 WAT 7564 68.681 55.688 74.211 1.00 0.00 H TER 39937 WAT 7564 ATOM 39937 O WAT 7565 78.014 81.228 137.511 1.00 0.00 O ATOM 39938 H1 WAT 7565 77.510 81.718 138.160 1.00 0.00 H ATOM 39939 H2 WAT 7565 78.927 81.436 137.710 1.00 0.00 H TER 39941 WAT 7565 ATOM 39941 O WAT 7566 50.930 130.029 83.477 1.00 0.00 O ATOM 39942 H1 WAT 7566 51.651 130.643 83.339 1.00 0.00 H ATOM 39943 H2 WAT 7566 50.247 130.323 82.874 1.00 0.00 H TER 39945 WAT 7566 ATOM 39945 O WAT 7567 67.852 25.194 142.233 1.00 0.00 O ATOM 39946 H1 WAT 7567 67.664 26.089 141.952 1.00 0.00 H ATOM 39947 H2 WAT 7567 67.019 24.870 142.575 1.00 0.00 H TER 39949 WAT 7567 ATOM 39949 O WAT 7568 92.897 75.664 127.694 1.00 0.00 O ATOM 39950 H1 WAT 7568 93.704 75.209 127.455 1.00 0.00 H ATOM 39951 H2 WAT 7568 92.512 75.124 128.384 1.00 0.00 H TER 39953 WAT 7568 ATOM 39953 O WAT 7569 5.052 57.906 141.852 1.00 0.00 O ATOM 39954 H1 WAT 7569 4.193 57.764 142.250 1.00 0.00 H ATOM 39955 H2 WAT 7569 5.451 58.594 142.384 1.00 0.00 H TER 39957 WAT 7569 ATOM 39957 O WAT 7570 2.612 57.427 62.698 1.00 0.00 O ATOM 39958 H1 WAT 7570 1.714 57.318 63.011 1.00 0.00 H ATOM 39959 H2 WAT 7570 2.596 58.248 62.206 1.00 0.00 H TER 39961 WAT 7570 ATOM 39961 O WAT 7571 68.970 40.772 27.280 1.00 0.00 O ATOM 39962 H1 WAT 7571 69.510 40.162 27.782 1.00 0.00 H ATOM 39963 H2 WAT 7571 68.349 40.214 26.813 1.00 0.00 H TER 39965 WAT 7571 ATOM 39965 O WAT 7572 118.729 29.205 150.319 1.00 0.00 O ATOM 39966 H1 WAT 7572 118.178 29.744 150.887 1.00 0.00 H ATOM 39967 H2 WAT 7572 118.111 28.764 149.735 1.00 0.00 H TER 39969 WAT 7572 ATOM 39969 O WAT 7573 133.068 52.696 14.013 1.00 0.00 O ATOM 39970 H1 WAT 7573 132.257 52.891 14.482 1.00 0.00 H ATOM 39971 H2 WAT 7573 133.675 52.405 14.694 1.00 0.00 H TER 39973 WAT 7573 ATOM 39973 O WAT 7574 25.737 31.868 57.081 1.00 0.00 O ATOM 39974 H1 WAT 7574 25.079 31.369 57.565 1.00 0.00 H ATOM 39975 H2 WAT 7574 25.230 32.417 56.483 1.00 0.00 H TER 39977 WAT 7574 ATOM 39977 O WAT 7575 141.527 60.773 69.614 1.00 0.00 O ATOM 39978 H1 WAT 7575 141.130 59.907 69.710 1.00 0.00 H ATOM 39979 H2 WAT 7575 140.856 61.296 69.174 1.00 0.00 H TER 39981 WAT 7575 ATOM 39981 O WAT 7576 32.901 66.192 88.724 1.00 0.00 O ATOM 39982 H1 WAT 7576 32.964 65.248 88.871 1.00 0.00 H ATOM 39983 H2 WAT 7576 33.218 66.316 87.829 1.00 0.00 H TER 39985 WAT 7576 ATOM 39985 O WAT 7577 87.747 90.063 66.979 1.00 0.00 O ATOM 39986 H1 WAT 7577 88.270 89.335 67.314 1.00 0.00 H ATOM 39987 H2 WAT 7577 88.240 90.845 67.225 1.00 0.00 H TER 39989 WAT 7577 ATOM 39989 O WAT 7578 109.126 35.235 151.531 1.00 0.00 O ATOM 39990 H1 WAT 7578 109.454 35.710 150.768 1.00 0.00 H ATOM 39991 H2 WAT 7578 108.447 35.804 151.895 1.00 0.00 H TER 39993 WAT 7578 ATOM 39993 O WAT 7579 112.709 88.943 60.877 1.00 0.00 O ATOM 39994 H1 WAT 7579 112.566 89.813 60.504 1.00 0.00 H ATOM 39995 H2 WAT 7579 113.097 88.437 60.164 1.00 0.00 H TER 39997 WAT 7579 ATOM 39997 O WAT 7580 85.153 9.001 0.224 1.00 0.00 O ATOM 39998 H1 WAT 7580 85.527 9.607 0.864 1.00 0.00 H ATOM 39999 H2 WAT 7580 85.907 8.521 -0.119 1.00 0.00 H TER 40001 WAT 7580 ATOM 40001 O WAT 7581 105.023 145.964 141.085 1.00 0.00 O ATOM 40002 H1 WAT 7581 104.833 145.105 141.464 1.00 0.00 H ATOM 40003 H2 WAT 7581 104.301 146.122 140.477 1.00 0.00 H TER 40005 WAT 7581 ATOM 40005 O WAT 7582 54.833 112.939 155.070 1.00 0.00 O ATOM 40006 H1 WAT 7582 53.933 112.862 154.753 1.00 0.00 H ATOM 40007 H2 WAT 7582 55.370 112.897 154.279 1.00 0.00 H TER 40009 WAT 7582 ATOM 40009 O WAT 7583 6.604 73.928 53.982 1.00 0.00 O ATOM 40010 H1 WAT 7583 7.422 74.425 53.969 1.00 0.00 H ATOM 40011 H2 WAT 7583 6.069 74.365 54.644 1.00 0.00 H TER 40013 WAT 7583 ATOM 40013 O WAT 7584 118.150 26.695 119.938 1.00 0.00 O ATOM 40014 H1 WAT 7584 117.366 27.066 119.532 1.00 0.00 H ATOM 40015 H2 WAT 7584 118.045 26.878 120.872 1.00 0.00 H TER 40017 WAT 7584 ATOM 40017 O WAT 7585 39.624 115.497 72.962 1.00 0.00 O ATOM 40018 H1 WAT 7585 40.040 115.233 73.782 1.00 0.00 H ATOM 40019 H2 WAT 7585 40.140 115.066 72.281 1.00 0.00 H TER 40021 WAT 7585 ATOM 40021 O WAT 7586 83.255 43.267 137.645 1.00 0.00 O ATOM 40022 H1 WAT 7586 82.420 42.980 138.014 1.00 0.00 H ATOM 40023 H2 WAT 7586 83.044 44.071 137.171 1.00 0.00 H TER 40025 WAT 7586 ATOM 40025 O WAT 7587 127.764 21.117 152.571 1.00 0.00 O ATOM 40026 H1 WAT 7587 128.002 20.435 151.943 1.00 0.00 H ATOM 40027 H2 WAT 7587 127.314 20.648 153.274 1.00 0.00 H TER 40029 WAT 7587 ATOM 40029 O WAT 7588 19.745 138.119 131.482 1.00 0.00 O ATOM 40030 H1 WAT 7588 20.436 137.992 132.131 1.00 0.00 H ATOM 40031 H2 WAT 7588 19.815 137.357 130.906 1.00 0.00 H TER 40033 WAT 7588 ATOM 40033 O WAT 7589 58.284 93.628 89.645 1.00 0.00 O ATOM 40034 H1 WAT 7589 58.080 94.009 90.499 1.00 0.00 H ATOM 40035 H2 WAT 7589 58.929 92.946 89.835 1.00 0.00 H TER 40037 WAT 7589 ATOM 40037 O WAT 7590 47.237 79.757 14.884 1.00 0.00 O ATOM 40038 H1 WAT 7590 47.182 80.706 14.999 1.00 0.00 H ATOM 40039 H2 WAT 7590 46.943 79.607 13.985 1.00 0.00 H TER 40041 WAT 7590 ATOM 40041 O WAT 7591 55.442 60.328 0.243 1.00 0.00 O ATOM 40042 H1 WAT 7591 54.754 60.786 -0.240 1.00 0.00 H ATOM 40043 H2 WAT 7591 55.728 60.956 0.906 1.00 0.00 H TER 40045 WAT 7591 ATOM 40045 O WAT 7592 141.219 107.036 92.993 1.00 0.00 O ATOM 40046 H1 WAT 7592 141.447 107.805 92.470 1.00 0.00 H ATOM 40047 H2 WAT 7592 141.955 106.929 93.595 1.00 0.00 H TER 40049 WAT 7592 ATOM 40049 O WAT 7593 81.676 76.556 117.350 1.00 0.00 O ATOM 40050 H1 WAT 7593 81.552 77.425 116.969 1.00 0.00 H ATOM 40051 H2 WAT 7593 82.623 76.479 117.468 1.00 0.00 H TER 40053 WAT 7593 ATOM 40053 O WAT 7594 128.038 -0.087 7.998 1.00 0.00 O ATOM 40054 H1 WAT 7594 127.854 0.624 7.383 1.00 0.00 H ATOM 40055 H2 WAT 7594 127.574 0.163 8.797 1.00 0.00 H TER 40057 WAT 7594 ATOM 40057 O WAT 7595 50.672 9.949 78.004 1.00 0.00 O ATOM 40058 H1 WAT 7595 50.065 10.623 77.699 1.00 0.00 H ATOM 40059 H2 WAT 7595 50.216 9.528 78.733 1.00 0.00 H TER 40061 WAT 7595 ATOM 40061 O WAT 7596 141.410 85.540 58.558 1.00 0.00 O ATOM 40062 H1 WAT 7596 141.692 86.109 59.273 1.00 0.00 H ATOM 40063 H2 WAT 7596 142.060 85.681 57.869 1.00 0.00 H TER 40065 WAT 7596 ATOM 40065 O WAT 7597 135.846 32.597 88.151 1.00 0.00 O ATOM 40066 H1 WAT 7597 136.757 32.849 88.004 1.00 0.00 H ATOM 40067 H2 WAT 7597 135.663 32.873 89.049 1.00 0.00 H TER 40069 WAT 7597 ATOM 40069 O WAT 7598 5.029 107.442 3.143 1.00 0.00 O ATOM 40070 H1 WAT 7598 5.601 108.014 3.654 1.00 0.00 H ATOM 40071 H2 WAT 7598 5.628 106.868 2.666 1.00 0.00 H TER 40073 WAT 7598 ATOM 40073 O WAT 7599 11.308 90.522 77.455 1.00 0.00 O ATOM 40074 H1 WAT 7599 12.043 90.527 76.842 1.00 0.00 H ATOM 40075 H2 WAT 7599 11.376 91.357 77.919 1.00 0.00 H TER 40077 WAT 7599 ATOM 40077 O WAT 7600 49.205 95.411 68.458 1.00 0.00 O ATOM 40078 H1 WAT 7600 49.051 95.670 67.549 1.00 0.00 H ATOM 40079 H2 WAT 7600 48.726 94.588 68.557 1.00 0.00 H TER 40081 WAT 7600 ATOM 40081 O WAT 7601 63.114 93.395 129.977 1.00 0.00 O ATOM 40082 H1 WAT 7601 63.440 92.789 129.312 1.00 0.00 H ATOM 40083 H2 WAT 7601 63.761 93.349 130.681 1.00 0.00 H TER 40085 WAT 7601 ATOM 40085 O WAT 7602 46.733 68.192 143.508 1.00 0.00 O ATOM 40086 H1 WAT 7602 47.160 68.979 143.168 1.00 0.00 H ATOM 40087 H2 WAT 7602 46.716 67.589 142.765 1.00 0.00 H TER 40089 WAT 7602 ATOM 40089 O WAT 7603 0.570 88.092 74.696 1.00 0.00 O ATOM 40090 H1 WAT 7603 0.559 88.792 75.348 1.00 0.00 H ATOM 40091 H2 WAT 7603 1.370 88.245 74.193 1.00 0.00 H TER 40093 WAT 7603 ATOM 40093 O WAT 7604 26.300 95.089 12.086 1.00 0.00 O ATOM 40094 H1 WAT 7604 26.516 95.932 12.484 1.00 0.00 H ATOM 40095 H2 WAT 7604 27.149 94.690 11.896 1.00 0.00 H TER 40097 WAT 7604 ATOM 40097 O WAT 7605 126.370 130.894 65.241 1.00 0.00 O ATOM 40098 H1 WAT 7605 126.937 131.643 65.057 1.00 0.00 H ATOM 40099 H2 WAT 7605 126.379 130.382 64.433 1.00 0.00 H TER 40101 WAT 7605 ATOM 40101 O WAT 7606 38.845 67.837 103.650 1.00 0.00 O ATOM 40102 H1 WAT 7606 39.685 67.390 103.756 1.00 0.00 H ATOM 40103 H2 WAT 7606 38.291 67.471 104.339 1.00 0.00 H TER 40105 WAT 7606 ATOM 40105 O WAT 7607 19.382 102.244 5.308 1.00 0.00 O ATOM 40106 H1 WAT 7607 18.605 102.742 5.055 1.00 0.00 H ATOM 40107 H2 WAT 7607 19.830 102.063 4.482 1.00 0.00 H TER 40109 WAT 7607 ATOM 40109 O WAT 7608 62.781 46.833 1.195 1.00 0.00 O ATOM 40110 H1 WAT 7608 62.595 47.263 2.030 1.00 0.00 H ATOM 40111 H2 WAT 7608 63.440 47.391 0.780 1.00 0.00 H TER 40113 WAT 7608 ATOM 40113 O WAT 7609 85.099 128.051 6.906 1.00 0.00 O ATOM 40114 H1 WAT 7609 85.156 128.517 7.739 1.00 0.00 H ATOM 40115 H2 WAT 7609 85.841 127.446 6.918 1.00 0.00 H TER 40117 WAT 7609 ATOM 40117 O WAT 7610 58.503 102.805 86.912 1.00 0.00 O ATOM 40118 H1 WAT 7610 58.297 102.796 85.977 1.00 0.00 H ATOM 40119 H2 WAT 7610 58.664 101.887 87.130 1.00 0.00 H TER 40121 WAT 7610 ATOM 40121 O WAT 7611 30.893 107.697 105.802 1.00 0.00 O ATOM 40122 H1 WAT 7611 30.765 106.749 105.831 1.00 0.00 H ATOM 40123 H2 WAT 7611 31.085 107.940 106.707 1.00 0.00 H TER 40125 WAT 7611 ATOM 40125 O WAT 7612 99.224 85.837 2.329 1.00 0.00 O ATOM 40126 H1 WAT 7612 99.113 85.779 1.380 1.00 0.00 H ATOM 40127 H2 WAT 7612 99.395 84.936 2.606 1.00 0.00 H TER 40129 WAT 7612 ATOM 40129 O WAT 7613 83.291 21.694 147.943 1.00 0.00 O ATOM 40130 H1 WAT 7613 83.803 22.331 147.444 1.00 0.00 H ATOM 40131 H2 WAT 7613 82.643 21.366 147.319 1.00 0.00 H TER 40133 WAT 7613 ATOM 40133 O WAT 7614 72.788 44.738 137.501 1.00 0.00 O ATOM 40134 H1 WAT 7614 73.267 44.842 136.679 1.00 0.00 H ATOM 40135 H2 WAT 7614 73.266 44.057 137.973 1.00 0.00 H TER 40137 WAT 7614 ATOM 40137 O WAT 7615 94.633 103.858 17.991 1.00 0.00 O ATOM 40138 H1 WAT 7615 94.180 104.182 18.769 1.00 0.00 H ATOM 40139 H2 WAT 7615 94.980 104.645 17.571 1.00 0.00 H TER 40141 WAT 7615 ATOM 40141 O WAT 7616 32.633 48.818 141.028 1.00 0.00 O ATOM 40142 H1 WAT 7616 32.088 48.326 141.641 1.00 0.00 H ATOM 40143 H2 WAT 7616 33.113 48.147 140.542 1.00 0.00 H TER 40145 WAT 7616 ATOM 40145 O WAT 7617 59.937 139.639 104.443 1.00 0.00 O ATOM 40146 H1 WAT 7617 60.522 140.347 104.713 1.00 0.00 H ATOM 40147 H2 WAT 7617 60.521 138.964 104.098 1.00 0.00 H TER 40149 WAT 7617 ATOM 40149 O WAT 7618 58.810 89.981 136.070 1.00 0.00 O ATOM 40150 H1 WAT 7618 58.472 90.412 135.285 1.00 0.00 H ATOM 40151 H2 WAT 7618 58.067 89.966 136.674 1.00 0.00 H TER 40153 WAT 7618 ATOM 40153 O WAT 7619 53.521 56.750 104.073 1.00 0.00 O ATOM 40154 H1 WAT 7619 52.894 57.264 103.565 1.00 0.00 H ATOM 40155 H2 WAT 7619 53.034 55.969 104.335 1.00 0.00 H TER 40157 WAT 7619 ATOM 40157 O WAT 7620 12.918 15.997 134.122 1.00 0.00 O ATOM 40158 H1 WAT 7620 13.828 15.959 134.416 1.00 0.00 H ATOM 40159 H2 WAT 7620 12.403 15.827 134.911 1.00 0.00 H TER 40161 WAT 7620 ATOM 40161 O WAT 7621 65.845 101.631 158.203 1.00 0.00 O ATOM 40162 H1 WAT 7621 64.985 102.028 158.345 1.00 0.00 H ATOM 40163 H2 WAT 7621 66.177 101.459 159.084 1.00 0.00 H TER 40165 WAT 7621 ATOM 40165 O WAT 7622 82.582 27.324 145.070 1.00 0.00 O ATOM 40166 H1 WAT 7622 81.915 27.755 144.535 1.00 0.00 H ATOM 40167 H2 WAT 7622 82.990 28.036 145.563 1.00 0.00 H TER 40169 WAT 7622 ATOM 40169 O WAT 7623 32.643 47.726 111.183 1.00 0.00 O ATOM 40170 H1 WAT 7623 33.177 47.905 110.409 1.00 0.00 H ATOM 40171 H2 WAT 7623 32.805 46.802 111.377 1.00 0.00 H TER 40173 WAT 7623 ATOM 40173 O WAT 7624 75.947 114.921 0.247 1.00 0.00 O ATOM 40174 H1 WAT 7624 76.121 115.639 0.855 1.00 0.00 H ATOM 40175 H2 WAT 7624 75.296 115.274 -0.360 1.00 0.00 H TER 40177 WAT 7624 ATOM 40177 O WAT 7625 62.740 69.844 95.014 1.00 0.00 O ATOM 40178 H1 WAT 7625 61.984 70.136 95.525 1.00 0.00 H ATOM 40179 H2 WAT 7625 62.601 68.904 94.899 1.00 0.00 H TER 40181 WAT 7625 ATOM 40181 O WAT 7626 62.384 113.946 76.673 1.00 0.00 O ATOM 40182 H1 WAT 7626 61.543 114.337 76.907 1.00 0.00 H ATOM 40183 H2 WAT 7626 62.438 113.155 77.209 1.00 0.00 H TER 40185 WAT 7626 ATOM 40185 O WAT 7627 90.365 131.427 86.726 1.00 0.00 O ATOM 40186 H1 WAT 7627 90.913 130.839 87.247 1.00 0.00 H ATOM 40187 H2 WAT 7627 89.468 131.174 86.944 1.00 0.00 H TER 40189 WAT 7627 ATOM 40189 O WAT 7628 59.607 37.666 92.181 1.00 0.00 O ATOM 40190 H1 WAT 7628 59.013 37.204 91.589 1.00 0.00 H ATOM 40191 H2 WAT 7628 59.028 38.160 92.762 1.00 0.00 H TER 40193 WAT 7628 ATOM 40193 O WAT 7629 118.104 44.821 126.469 1.00 0.00 O ATOM 40194 H1 WAT 7629 118.535 44.190 127.046 1.00 0.00 H ATOM 40195 H2 WAT 7629 118.098 45.637 126.969 1.00 0.00 H TER 40197 WAT 7629 ATOM 40197 O WAT 7630 81.622 10.624 105.172 1.00 0.00 O ATOM 40198 H1 WAT 7630 80.872 10.628 105.767 1.00 0.00 H ATOM 40199 H2 WAT 7630 81.246 10.807 104.311 1.00 0.00 H TER 40201 WAT 7630 ATOM 40201 O WAT 7631 14.804 73.616 102.161 1.00 0.00 O ATOM 40202 H1 WAT 7631 14.945 73.447 101.229 1.00 0.00 H ATOM 40203 H2 WAT 7631 13.984 74.108 102.193 1.00 0.00 H TER 40205 WAT 7631 ATOM 40205 O WAT 7632 115.127 101.219 142.603 1.00 0.00 O ATOM 40206 H1 WAT 7632 115.642 101.531 143.348 1.00 0.00 H ATOM 40207 H2 WAT 7632 115.483 101.692 141.851 1.00 0.00 H TER 40209 WAT 7632 ATOM 40209 O WAT 7633 45.299 34.795 3.479 1.00 0.00 O ATOM 40210 H1 WAT 7633 45.404 35.738 3.602 1.00 0.00 H ATOM 40211 H2 WAT 7633 45.116 34.458 4.357 1.00 0.00 H TER 40213 WAT 7633 ATOM 40213 O WAT 7634 58.442 77.556 147.045 1.00 0.00 O ATOM 40214 H1 WAT 7634 58.697 78.474 146.947 1.00 0.00 H ATOM 40215 H2 WAT 7634 58.038 77.512 147.912 1.00 0.00 H TER 40217 WAT 7634 ATOM 40217 O WAT 7635 102.174 42.621 109.964 1.00 0.00 O ATOM 40218 H1 WAT 7635 102.117 43.353 109.350 1.00 0.00 H ATOM 40219 H2 WAT 7635 101.272 42.314 110.055 1.00 0.00 H TER 40221 WAT 7635 ATOM 40221 O WAT 7636 53.838 65.574 2.060 1.00 0.00 O ATOM 40222 H1 WAT 7636 54.343 65.518 1.249 1.00 0.00 H ATOM 40223 H2 WAT 7636 53.556 64.676 2.230 1.00 0.00 H TER 40225 WAT 7636 ATOM 40225 O WAT 7637 76.316 54.141 67.611 1.00 0.00 O ATOM 40226 H1 WAT 7637 76.784 54.674 68.254 1.00 0.00 H ATOM 40227 H2 WAT 7637 75.955 53.414 68.119 1.00 0.00 H TER 40229 WAT 7637 ATOM 40229 O WAT 7638 50.043 73.844 23.112 1.00 0.00 O ATOM 40230 H1 WAT 7638 49.838 74.401 23.863 1.00 0.00 H ATOM 40231 H2 WAT 7638 50.759 73.287 23.416 1.00 0.00 H TER 40233 WAT 7638 ATOM 40233 O WAT 7639 39.970 100.333 6.126 1.00 0.00 O ATOM 40234 H1 WAT 7639 40.555 100.977 6.524 1.00 0.00 H ATOM 40235 H2 WAT 7639 39.926 100.587 5.204 1.00 0.00 H TER 40237 WAT 7639 ATOM 40237 O WAT 7640 120.810 80.808 96.438 1.00 0.00 O ATOM 40238 H1 WAT 7640 120.106 81.369 96.113 1.00 0.00 H ATOM 40239 H2 WAT 7640 120.374 80.196 97.032 1.00 0.00 H TER 40241 WAT 7640 ATOM 40241 O WAT 7641 81.910 2.186 145.766 1.00 0.00 O ATOM 40242 H1 WAT 7641 81.917 2.216 146.723 1.00 0.00 H ATOM 40243 H2 WAT 7641 81.037 1.863 145.543 1.00 0.00 H TER 40245 WAT 7641 ATOM 40245 O WAT 7642 64.331 123.668 101.997 1.00 0.00 O ATOM 40246 H1 WAT 7642 63.989 123.178 101.249 1.00 0.00 H ATOM 40247 H2 WAT 7642 65.222 123.905 101.741 1.00 0.00 H TER 40249 WAT 7642 ATOM 40249 O WAT 7643 103.980 103.069 13.953 1.00 0.00 O ATOM 40250 H1 WAT 7643 104.459 103.894 13.870 1.00 0.00 H ATOM 40251 H2 WAT 7643 104.353 102.506 13.275 1.00 0.00 H TER 40253 WAT 7643 ATOM 40253 O WAT 7644 62.432 40.224 96.962 1.00 0.00 O ATOM 40254 H1 WAT 7644 62.623 40.386 97.886 1.00 0.00 H ATOM 40255 H2 WAT 7644 62.203 39.296 96.924 1.00 0.00 H TER 40257 WAT 7644 ATOM 40257 O WAT 7645 143.720 70.591 157.200 1.00 0.00 O ATOM 40258 H1 WAT 7645 142.932 71.081 157.433 1.00 0.00 H ATOM 40259 H2 WAT 7645 144.230 70.559 158.010 1.00 0.00 H TER 40261 WAT 7645 ATOM 40261 O WAT 7646 145.596 135.491 113.449 1.00 0.00 O ATOM 40262 H1 WAT 7646 144.720 135.796 113.685 1.00 0.00 H ATOM 40263 H2 WAT 7646 145.852 136.044 112.711 1.00 0.00 H TER 40265 WAT 7646 ATOM 40265 O WAT 7647 130.332 72.183 118.055 1.00 0.00 O ATOM 40266 H1 WAT 7647 130.443 72.860 117.388 1.00 0.00 H ATOM 40267 H2 WAT 7647 131.126 72.238 118.587 1.00 0.00 H TER 40269 WAT 7647 ATOM 40269 O WAT 7648 119.241 4.400 153.572 1.00 0.00 O ATOM 40270 H1 WAT 7648 119.165 4.587 154.508 1.00 0.00 H ATOM 40271 H2 WAT 7648 119.572 5.213 153.192 1.00 0.00 H TER 40273 WAT 7648 ATOM 40273 O WAT 7649 46.550 9.816 3.460 1.00 0.00 O ATOM 40274 H1 WAT 7649 46.341 10.156 2.590 1.00 0.00 H ATOM 40275 H2 WAT 7649 45.890 9.141 3.618 1.00 0.00 H TER 40277 WAT 7649 ATOM 40277 O WAT 7650 52.018 54.031 141.936 1.00 0.00 O ATOM 40278 H1 WAT 7650 51.579 54.062 141.086 1.00 0.00 H ATOM 40279 H2 WAT 7650 52.876 54.426 141.777 1.00 0.00 H TER 40281 WAT 7650 ATOM 40281 O WAT 7651 107.517 122.717 87.978 1.00 0.00 O ATOM 40282 H1 WAT 7651 106.795 123.104 87.483 1.00 0.00 H ATOM 40283 H2 WAT 7651 107.090 122.187 88.651 1.00 0.00 H TER 40285 WAT 7651 ATOM 40285 O WAT 7652 90.955 135.640 137.484 1.00 0.00 O ATOM 40286 H1 WAT 7652 91.458 134.921 137.101 1.00 0.00 H ATOM 40287 H2 WAT 7652 91.573 136.079 138.069 1.00 0.00 H TER 40289 WAT 7652 ATOM 40289 O WAT 7653 109.377 122.789 89.943 1.00 0.00 O ATOM 40290 H1 WAT 7653 108.705 122.885 89.268 1.00 0.00 H ATOM 40291 H2 WAT 7653 109.093 123.370 90.649 1.00 0.00 H TER 40293 WAT 7653 ATOM 40293 O WAT 7654 19.872 132.468 152.336 1.00 0.00 O ATOM 40294 H1 WAT 7654 18.993 132.510 151.959 1.00 0.00 H ATOM 40295 H2 WAT 7654 20.260 131.682 151.953 1.00 0.00 H TER 40297 WAT 7654 ATOM 40297 O WAT 7655 129.296 127.958 91.420 1.00 0.00 O ATOM 40298 H1 WAT 7655 130.041 128.494 91.693 1.00 0.00 H ATOM 40299 H2 WAT 7655 128.630 128.591 91.154 1.00 0.00 H TER 40301 WAT 7655 ATOM 40301 O WAT 7656 92.115 4.483 100.854 1.00 0.00 O ATOM 40302 H1 WAT 7656 92.195 4.724 99.931 1.00 0.00 H ATOM 40303 H2 WAT 7656 91.660 3.642 100.843 1.00 0.00 H TER 40305 WAT 7656 ATOM 40305 O WAT 7657 1.136 60.901 95.718 1.00 0.00 O ATOM 40306 H1 WAT 7657 1.019 61.265 94.841 1.00 0.00 H ATOM 40307 H2 WAT 7657 0.401 61.251 96.223 1.00 0.00 H TER 40309 WAT 7657 ATOM 40309 O WAT 7658 110.058 1.659 85.189 1.00 0.00 O ATOM 40310 H1 WAT 7658 109.305 1.068 85.183 1.00 0.00 H ATOM 40311 H2 WAT 7658 110.805 1.098 84.982 1.00 0.00 H TER 40313 WAT 7658 ATOM 40313 O WAT 7659 42.679 106.167 81.934 1.00 0.00 O ATOM 40314 H1 WAT 7659 42.071 106.245 81.199 1.00 0.00 H ATOM 40315 H2 WAT 7659 43.533 106.391 81.564 1.00 0.00 H TER 40317 WAT 7659 ATOM 40317 O WAT 7660 134.046 93.532 151.960 1.00 0.00 O ATOM 40318 H1 WAT 7660 133.333 93.911 151.446 1.00 0.00 H ATOM 40319 H2 WAT 7660 134.104 92.626 151.656 1.00 0.00 H TER 40321 WAT 7660 ATOM 40321 O WAT 7661 129.202 111.939 70.265 1.00 0.00 O ATOM 40322 H1 WAT 7661 128.990 111.949 69.331 1.00 0.00 H ATOM 40323 H2 WAT 7661 129.990 111.398 70.325 1.00 0.00 H TER 40325 WAT 7661 ATOM 40325 O WAT 7662 133.286 141.555 13.731 1.00 0.00 O ATOM 40326 H1 WAT 7662 133.832 142.256 14.088 1.00 0.00 H ATOM 40327 H2 WAT 7662 133.407 141.618 12.783 1.00 0.00 H TER 40329 WAT 7662 ATOM 40329 O WAT 7663 111.502 16.834 71.760 1.00 0.00 O ATOM 40330 H1 WAT 7663 111.958 16.255 72.371 1.00 0.00 H ATOM 40331 H2 WAT 7663 110.607 16.879 72.096 1.00 0.00 H TER 40333 WAT 7663 ATOM 40333 O WAT 7664 19.435 67.999 152.673 1.00 0.00 O ATOM 40334 H1 WAT 7664 20.214 68.338 153.114 1.00 0.00 H ATOM 40335 H2 WAT 7664 19.020 67.431 153.321 1.00 0.00 H TER 40337 WAT 7664 ATOM 40337 O WAT 7665 43.636 86.034 72.314 1.00 0.00 O ATOM 40338 H1 WAT 7665 44.292 85.596 71.772 1.00 0.00 H ATOM 40339 H2 WAT 7665 42.813 85.912 71.839 1.00 0.00 H TER 40341 WAT 7665 ATOM 40341 O WAT 7666 62.175 42.058 122.926 1.00 0.00 O ATOM 40342 H1 WAT 7666 62.533 41.172 122.989 1.00 0.00 H ATOM 40343 H2 WAT 7666 62.570 42.421 122.134 1.00 0.00 H TER 40345 WAT 7666 ATOM 40345 O WAT 7667 10.069 16.696 122.242 1.00 0.00 O ATOM 40346 H1 WAT 7667 9.599 16.917 121.438 1.00 0.00 H ATOM 40347 H2 WAT 7667 10.429 17.530 122.546 1.00 0.00 H TER 40349 WAT 7667 ATOM 40349 O WAT 7668 19.843 75.493 67.130 1.00 0.00 O ATOM 40350 H1 WAT 7668 19.571 76.399 67.272 1.00 0.00 H ATOM 40351 H2 WAT 7668 19.300 75.190 66.402 1.00 0.00 H TER 40353 WAT 7668 ATOM 40353 O WAT 7669 67.559 56.216 3.570 1.00 0.00 O ATOM 40354 H1 WAT 7669 67.576 56.366 4.516 1.00 0.00 H ATOM 40355 H2 WAT 7669 67.038 56.940 3.222 1.00 0.00 H TER 40357 WAT 7669 ATOM 40357 O WAT 7670 136.196 93.011 111.455 1.00 0.00 O ATOM 40358 H1 WAT 7670 136.225 92.643 112.338 1.00 0.00 H ATOM 40359 H2 WAT 7670 135.606 93.761 111.527 1.00 0.00 H TER 40361 WAT 7670 ATOM 40361 O WAT 7671 2.264 142.287 111.614 1.00 0.00 O ATOM 40362 H1 WAT 7671 2.463 142.698 110.773 1.00 0.00 H ATOM 40363 H2 WAT 7671 1.880 141.442 111.382 1.00 0.00 H TER 40365 WAT 7671 ATOM 40365 O WAT 7672 138.664 92.208 148.912 1.00 0.00 O ATOM 40366 H1 WAT 7672 137.723 92.243 149.084 1.00 0.00 H ATOM 40367 H2 WAT 7672 138.730 92.048 147.971 1.00 0.00 H TER 40369 WAT 7672 ATOM 40369 O WAT 7673 144.524 49.960 79.268 1.00 0.00 O ATOM 40370 H1 WAT 7673 145.239 50.460 78.875 1.00 0.00 H ATOM 40371 H2 WAT 7673 143.731 50.333 78.882 1.00 0.00 H TER 40373 WAT 7673 ATOM 40373 O WAT 7674 10.064 81.056 86.508 1.00 0.00 O ATOM 40374 H1 WAT 7674 9.800 80.943 85.595 1.00 0.00 H ATOM 40375 H2 WAT 7674 9.409 80.568 87.008 1.00 0.00 H TER 40377 WAT 7674 ATOM 40377 O WAT 7675 135.984 121.750 18.074 1.00 0.00 O ATOM 40378 H1 WAT 7675 136.582 121.685 18.818 1.00 0.00 H ATOM 40379 H2 WAT 7675 135.324 121.076 18.237 1.00 0.00 H TER 40381 WAT 7675 ATOM 40381 O WAT 7676 61.673 33.913 157.184 1.00 0.00 O ATOM 40382 H1 WAT 7676 62.380 34.091 157.804 1.00 0.00 H ATOM 40383 H2 WAT 7676 60.889 34.260 157.609 1.00 0.00 H TER 40385 WAT 7676 ATOM 40385 O WAT 7677 129.318 112.216 77.373 1.00 0.00 O ATOM 40386 H1 WAT 7677 129.434 113.140 77.594 1.00 0.00 H ATOM 40387 H2 WAT 7677 129.242 112.206 76.418 1.00 0.00 H TER 40389 WAT 7677 ATOM 40389 O WAT 7678 83.608 16.812 13.266 1.00 0.00 O ATOM 40390 H1 WAT 7678 83.364 16.129 12.642 1.00 0.00 H ATOM 40391 H2 WAT 7678 83.997 17.501 12.728 1.00 0.00 H TER 40393 WAT 7678 ATOM 40393 O WAT 7679 36.539 103.003 91.028 1.00 0.00 O ATOM 40394 H1 WAT 7679 35.634 102.714 90.911 1.00 0.00 H ATOM 40395 H2 WAT 7679 36.567 103.873 90.630 1.00 0.00 H TER 40397 WAT 7679 ATOM 40397 O WAT 7680 130.549 -0.117 147.485 1.00 0.00 O ATOM 40398 H1 WAT 7680 130.748 0.060 148.405 1.00 0.00 H ATOM 40399 H2 WAT 7680 129.974 0.600 147.222 1.00 0.00 H TER 40401 WAT 7680 ATOM 40401 O WAT 7681 142.941 105.325 70.058 1.00 0.00 O ATOM 40402 H1 WAT 7681 143.764 105.430 70.535 1.00 0.00 H ATOM 40403 H2 WAT 7681 142.367 104.862 70.668 1.00 0.00 H TER 40405 WAT 7681 ATOM 40405 O WAT 7682 2.232 76.302 135.893 1.00 0.00 O ATOM 40406 H1 WAT 7682 3.142 76.007 135.867 1.00 0.00 H ATOM 40407 H2 WAT 7682 1.725 75.503 136.038 1.00 0.00 H TER 40409 WAT 7682 ATOM 40409 O WAT 7683 32.490 134.447 124.077 1.00 0.00 O ATOM 40410 H1 WAT 7683 32.735 134.421 125.003 1.00 0.00 H ATOM 40411 H2 WAT 7683 33.221 134.892 123.649 1.00 0.00 H TER 40413 WAT 7683 ATOM 40413 O WAT 7684 126.721 122.666 6.386 1.00 0.00 O ATOM 40414 H1 WAT 7684 127.224 123.195 5.768 1.00 0.00 H ATOM 40415 H2 WAT 7684 126.050 122.244 5.850 1.00 0.00 H TER 40417 WAT 7684 ATOM 40417 O WAT 7685 82.081 2.610 102.857 1.00 0.00 O ATOM 40418 H1 WAT 7685 81.861 1.698 102.662 1.00 0.00 H ATOM 40419 H2 WAT 7685 81.289 3.100 102.633 1.00 0.00 H TER 40421 WAT 7685 ATOM 40421 O WAT 7686 52.443 96.700 104.109 1.00 0.00 O ATOM 40422 H1 WAT 7686 53.349 96.783 104.408 1.00 0.00 H ATOM 40423 H2 WAT 7686 52.300 95.757 104.036 1.00 0.00 H TER 40425 WAT 7686 ATOM 40425 O WAT 7687 124.633 66.027 101.040 1.00 0.00 O ATOM 40426 H1 WAT 7687 125.270 65.375 100.750 1.00 0.00 H ATOM 40427 H2 WAT 7687 125.164 66.775 101.315 1.00 0.00 H TER 40429 WAT 7687 ATOM 40429 O WAT 7688 16.541 131.314 6.017 1.00 0.00 O ATOM 40430 H1 WAT 7688 17.222 130.678 5.796 1.00 0.00 H ATOM 40431 H2 WAT 7688 16.056 130.905 6.734 1.00 0.00 H TER 40433 WAT 7688 ATOM 40433 O WAT 7689 87.402 97.160 7.802 1.00 0.00 O ATOM 40434 H1 WAT 7689 88.108 96.533 7.642 1.00 0.00 H ATOM 40435 H2 WAT 7689 87.242 97.106 8.744 1.00 0.00 H TER 40437 WAT 7689 ATOM 40437 O WAT 7690 42.405 86.624 59.324 1.00 0.00 O ATOM 40438 H1 WAT 7690 42.852 86.647 60.169 1.00 0.00 H ATOM 40439 H2 WAT 7690 42.684 87.427 58.883 1.00 0.00 H TER 40441 WAT 7690 ATOM 40441 O WAT 7691 94.347 143.657 60.815 1.00 0.00 O ATOM 40442 H1 WAT 7691 93.490 143.869 61.187 1.00 0.00 H ATOM 40443 H2 WAT 7691 94.842 144.475 60.873 1.00 0.00 H TER 40445 WAT 7691 ATOM 40445 O WAT 7692 41.764 85.258 157.000 1.00 0.00 O ATOM 40446 H1 WAT 7692 41.246 86.062 157.051 1.00 0.00 H ATOM 40447 H2 WAT 7692 42.665 85.544 157.147 1.00 0.00 H TER 40449 WAT 7692 ATOM 40449 O WAT 7693 144.778 79.175 69.369 1.00 0.00 O ATOM 40450 H1 WAT 7693 144.169 79.095 68.635 1.00 0.00 H ATOM 40451 H2 WAT 7693 145.289 79.959 69.172 1.00 0.00 H TER 40453 WAT 7693 ATOM 40453 O WAT 7694 68.579 143.500 157.882 1.00 0.00 O ATOM 40454 H1 WAT 7694 68.571 143.302 158.819 1.00 0.00 H ATOM 40455 H2 WAT 7694 69.505 143.474 157.640 1.00 0.00 H TER 40457 WAT 7694 ATOM 40457 O WAT 7695 126.374 130.583 6.988 1.00 0.00 O ATOM 40458 H1 WAT 7695 126.386 130.405 7.929 1.00 0.00 H ATOM 40459 H2 WAT 7695 125.825 131.362 6.899 1.00 0.00 H TER 40461 WAT 7695 ATOM 40461 O WAT 7696 49.323 39.718 88.818 1.00 0.00 O ATOM 40462 H1 WAT 7696 48.746 39.512 89.553 1.00 0.00 H ATOM 40463 H2 WAT 7696 50.065 39.122 88.921 1.00 0.00 H TER 40465 WAT 7696 ATOM 40465 O WAT 7697 28.561 73.329 113.031 1.00 0.00 O ATOM 40466 H1 WAT 7697 29.488 73.281 113.267 1.00 0.00 H ATOM 40467 H2 WAT 7697 28.560 73.395 112.076 1.00 0.00 H TER 40469 WAT 7697 ATOM 40469 O WAT 7698 65.749 36.887 114.782 1.00 0.00 O ATOM 40470 H1 WAT 7698 64.810 36.729 114.688 1.00 0.00 H ATOM 40471 H2 WAT 7698 66.131 36.542 113.975 1.00 0.00 H TER 40473 WAT 7698 ATOM 40473 O WAT 7699 136.748 93.274 95.532 1.00 0.00 O ATOM 40474 H1 WAT 7699 137.263 93.476 96.314 1.00 0.00 H ATOM 40475 H2 WAT 7699 136.680 92.319 95.531 1.00 0.00 H TER 40477 WAT 7699 ATOM 40477 O WAT 7700 63.135 134.834 129.327 1.00 0.00 O ATOM 40478 H1 WAT 7700 63.086 134.510 128.427 1.00 0.00 H ATOM 40479 H2 WAT 7700 63.876 135.440 129.323 1.00 0.00 H TER 40481 WAT 7700 ATOM 40481 O WAT 7701 61.854 14.215 73.838 1.00 0.00 O ATOM 40482 H1 WAT 7701 61.207 14.144 74.540 1.00 0.00 H ATOM 40483 H2 WAT 7701 62.663 14.470 74.283 1.00 0.00 H TER 40485 WAT 7701 ATOM 40485 O WAT 7702 73.340 144.108 53.965 1.00 0.00 O ATOM 40486 H1 WAT 7702 74.079 144.637 54.266 1.00 0.00 H ATOM 40487 H2 WAT 7702 73.322 143.360 54.561 1.00 0.00 H TER 40489 WAT 7702 ATOM 40489 O WAT 7703 25.329 64.381 121.849 1.00 0.00 O ATOM 40490 H1 WAT 7703 26.080 64.791 122.278 1.00 0.00 H ATOM 40491 H2 WAT 7703 24.609 64.996 121.986 1.00 0.00 H TER 40493 WAT 7703 ATOM 40493 O WAT 7704 125.846 41.810 142.786 1.00 0.00 O ATOM 40494 H1 WAT 7704 125.801 41.032 142.230 1.00 0.00 H ATOM 40495 H2 WAT 7704 126.219 42.487 142.221 1.00 0.00 H TER 40497 WAT 7704 ATOM 40497 O WAT 7705 56.526 78.265 139.570 1.00 0.00 O ATOM 40498 H1 WAT 7705 57.015 79.081 139.677 1.00 0.00 H ATOM 40499 H2 WAT 7705 56.388 77.950 140.463 1.00 0.00 H TER 40501 WAT 7705 ATOM 40501 O WAT 7706 143.787 124.335 98.179 1.00 0.00 O ATOM 40502 H1 WAT 7706 143.117 124.063 97.552 1.00 0.00 H ATOM 40503 H2 WAT 7706 143.920 125.266 97.998 1.00 0.00 H TER 40505 WAT 7706 ATOM 40505 O WAT 7707 31.774 99.370 141.586 1.00 0.00 O ATOM 40506 H1 WAT 7707 32.026 98.567 142.043 1.00 0.00 H ATOM 40507 H2 WAT 7707 31.240 99.070 140.851 1.00 0.00 H TER 40509 WAT 7707 ATOM 40509 O WAT 7708 111.476 138.637 100.182 1.00 0.00 O ATOM 40510 H1 WAT 7708 110.643 138.996 99.876 1.00 0.00 H ATOM 40511 H2 WAT 7708 111.228 137.972 100.825 1.00 0.00 H TER 40513 WAT 7708 ATOM 40513 O WAT 7709 134.181 1.210 81.419 1.00 0.00 O ATOM 40514 H1 WAT 7709 134.445 1.634 82.235 1.00 0.00 H ATOM 40515 H2 WAT 7709 134.809 0.498 81.304 1.00 0.00 H TER 40517 WAT 7709 ATOM 40517 O WAT 7710 63.490 105.960 110.563 1.00 0.00 O ATOM 40518 H1 WAT 7710 63.825 106.757 110.973 1.00 0.00 H ATOM 40519 H2 WAT 7710 62.542 106.085 110.534 1.00 0.00 H TER 40521 WAT 7710 ATOM 40521 O WAT 7711 34.604 62.527 87.132 1.00 0.00 O ATOM 40522 H1 WAT 7711 34.509 61.662 86.733 1.00 0.00 H ATOM 40523 H2 WAT 7711 34.575 63.136 86.394 1.00 0.00 H TER 40525 WAT 7711 ATOM 40525 O WAT 7712 106.033 43.818 124.150 1.00 0.00 O ATOM 40526 H1 WAT 7712 105.142 44.057 123.894 1.00 0.00 H ATOM 40527 H2 WAT 7712 105.951 43.526 125.058 1.00 0.00 H TER 40529 WAT 7712 ATOM 40529 O WAT 7713 121.211 87.640 91.978 1.00 0.00 O ATOM 40530 H1 WAT 7713 120.655 88.127 91.370 1.00 0.00 H ATOM 40531 H2 WAT 7713 120.596 87.156 92.530 1.00 0.00 H TER 40533 WAT 7713 ATOM 40533 O WAT 7714 3.436 137.622 142.401 1.00 0.00 O ATOM 40534 H1 WAT 7714 3.454 137.839 143.333 1.00 0.00 H ATOM 40535 H2 WAT 7714 2.528 137.772 142.138 1.00 0.00 H TER 40537 WAT 7714 ATOM 40537 O WAT 7715 5.374 29.907 84.704 1.00 0.00 O ATOM 40538 H1 WAT 7715 4.669 29.274 84.565 1.00 0.00 H ATOM 40539 H2 WAT 7715 5.061 30.459 85.421 1.00 0.00 H TER 40541 WAT 7715 ATOM 40541 O WAT 7716 84.755 124.691 153.424 1.00 0.00 O ATOM 40542 H1 WAT 7716 85.677 124.943 153.379 1.00 0.00 H ATOM 40543 H2 WAT 7716 84.548 124.706 154.359 1.00 0.00 H TER 40545 WAT 7716 ATOM 40545 O WAT 7717 22.918 21.591 83.859 1.00 0.00 O ATOM 40546 H1 WAT 7717 22.798 21.495 82.914 1.00 0.00 H ATOM 40547 H2 WAT 7717 23.490 22.353 83.951 1.00 0.00 H TER 40549 WAT 7717 ATOM 40549 O WAT 7718 21.914 67.855 146.162 1.00 0.00 O ATOM 40550 H1 WAT 7718 21.698 68.572 146.758 1.00 0.00 H ATOM 40551 H2 WAT 7718 21.464 68.077 145.347 1.00 0.00 H TER 40553 WAT 7718 ATOM 40553 O WAT 7719 133.197 84.587 69.372 1.00 0.00 O ATOM 40554 H1 WAT 7719 132.449 84.788 69.934 1.00 0.00 H ATOM 40555 H2 WAT 7719 132.815 84.146 68.613 1.00 0.00 H TER 40557 WAT 7719 ATOM 40557 O WAT 7720 18.264 78.689 143.251 1.00 0.00 O ATOM 40558 H1 WAT 7720 18.130 79.458 143.804 1.00 0.00 H ATOM 40559 H2 WAT 7720 19.131 78.819 142.866 1.00 0.00 H TER 40561 WAT 7720 ATOM 40561 O WAT 7721 18.535 60.314 16.315 1.00 0.00 O ATOM 40562 H1 WAT 7721 18.953 60.773 15.586 1.00 0.00 H ATOM 40563 H2 WAT 7721 19.188 60.331 17.015 1.00 0.00 H TER 40565 WAT 7721 ATOM 40565 O WAT 7722 66.451 112.828 82.618 1.00 0.00 O ATOM 40566 H1 WAT 7722 67.362 113.036 82.414 1.00 0.00 H ATOM 40567 H2 WAT 7722 66.497 112.015 83.121 1.00 0.00 H TER 40569 WAT 7722 ATOM 40569 O WAT 7723 73.849 27.474 91.460 1.00 0.00 O ATOM 40570 H1 WAT 7723 73.791 28.277 90.942 1.00 0.00 H ATOM 40571 H2 WAT 7723 73.030 27.013 91.281 1.00 0.00 H TER 40573 WAT 7723 ATOM 40573 O WAT 7724 3.512 123.359 156.913 1.00 0.00 O ATOM 40574 H1 WAT 7724 4.393 122.987 156.879 1.00 0.00 H ATOM 40575 H2 WAT 7724 3.315 123.424 157.847 1.00 0.00 H TER 40577 WAT 7724 ATOM 40577 O WAT 7725 76.537 127.396 53.297 1.00 0.00 O ATOM 40578 H1 WAT 7725 76.926 128.233 53.552 1.00 0.00 H ATOM 40579 H2 WAT 7725 75.672 127.399 53.706 1.00 0.00 H TER 40581 WAT 7725 ATOM 40581 O WAT 7726 29.014 136.116 145.799 1.00 0.00 O ATOM 40582 H1 WAT 7726 28.987 136.309 144.862 1.00 0.00 H ATOM 40583 H2 WAT 7726 29.698 135.452 145.887 1.00 0.00 H TER 40585 WAT 7726 ATOM 40585 O WAT 7727 14.955 131.181 1.638 1.00 0.00 O ATOM 40586 H1 WAT 7727 15.111 130.744 0.801 1.00 0.00 H ATOM 40587 H2 WAT 7727 14.312 130.627 2.081 1.00 0.00 H TER 40589 WAT 7727 ATOM 40589 O WAT 7728 133.594 133.358 21.203 1.00 0.00 O ATOM 40590 H1 WAT 7728 133.306 134.145 21.666 1.00 0.00 H ATOM 40591 H2 WAT 7728 132.787 132.872 21.032 1.00 0.00 H TER 40593 WAT 7728 ATOM 40593 O WAT 7729 53.321 68.816 157.826 1.00 0.00 O ATOM 40594 H1 WAT 7729 53.702 69.694 157.813 1.00 0.00 H ATOM 40595 H2 WAT 7729 53.928 68.283 157.312 1.00 0.00 H TER 40597 WAT 7729 ATOM 40597 O WAT 7730 18.253 31.646 107.173 1.00 0.00 O ATOM 40598 H1 WAT 7730 17.772 32.343 107.620 1.00 0.00 H ATOM 40599 H2 WAT 7730 19.143 31.709 107.519 1.00 0.00 H TER 40601 WAT 7730 ATOM 40601 O WAT 7731 34.386 28.958 64.028 1.00 0.00 O ATOM 40602 H1 WAT 7731 35.230 29.002 63.579 1.00 0.00 H ATOM 40603 H2 WAT 7731 34.261 28.027 64.213 1.00 0.00 H TER 40605 WAT 7731 ATOM 40605 O WAT 7732 17.410 37.732 62.350 1.00 0.00 O ATOM 40606 H1 WAT 7732 17.504 38.412 61.683 1.00 0.00 H ATOM 40607 H2 WAT 7732 18.295 37.613 62.697 1.00 0.00 H TER 40609 WAT 7732 ATOM 40609 O WAT 7733 121.482 139.694 137.894 1.00 0.00 O ATOM 40610 H1 WAT 7733 121.244 138.798 138.133 1.00 0.00 H ATOM 40611 H2 WAT 7733 120.675 140.196 138.012 1.00 0.00 H TER 40613 WAT 7733 ATOM 40613 O WAT 7734 116.129 132.573 137.946 1.00 0.00 O ATOM 40614 H1 WAT 7734 115.333 133.025 137.668 1.00 0.00 H ATOM 40615 H2 WAT 7734 116.693 132.583 137.173 1.00 0.00 H TER 40617 WAT 7734 ATOM 40617 O WAT 7735 78.294 120.523 13.312 1.00 0.00 O ATOM 40618 H1 WAT 7735 77.852 121.222 12.830 1.00 0.00 H ATOM 40619 H2 WAT 7735 78.881 120.123 12.670 1.00 0.00 H TER 40621 WAT 7735 ATOM 40621 O WAT 7736 106.117 99.249 153.961 1.00 0.00 O ATOM 40622 H1 WAT 7736 105.957 98.845 153.107 1.00 0.00 H ATOM 40623 H2 WAT 7736 106.417 100.134 153.754 1.00 0.00 H TER 40625 WAT 7736 ATOM 40625 O WAT 7737 34.807 52.409 66.106 1.00 0.00 O ATOM 40626 H1 WAT 7737 35.105 52.949 65.374 1.00 0.00 H ATOM 40627 H2 WAT 7737 35.611 52.150 66.555 1.00 0.00 H TER 40629 WAT 7737 ATOM 40629 O WAT 7738 140.275 32.174 85.344 1.00 0.00 O ATOM 40630 H1 WAT 7738 141.140 31.960 85.693 1.00 0.00 H ATOM 40631 H2 WAT 7738 140.450 32.537 84.476 1.00 0.00 H TER 40633 WAT 7738 ATOM 40633 O WAT 7739 64.681 53.573 146.710 1.00 0.00 O ATOM 40634 H1 WAT 7739 65.097 54.246 147.250 1.00 0.00 H ATOM 40635 H2 WAT 7739 64.267 54.060 145.998 1.00 0.00 H TER 40637 WAT 7739 ATOM 40637 O WAT 7740 117.726 107.019 12.506 1.00 0.00 O ATOM 40638 H1 WAT 7740 117.160 107.791 12.527 1.00 0.00 H ATOM 40639 H2 WAT 7740 117.462 106.550 11.715 1.00 0.00 H TER 40641 WAT 7740 ATOM 40641 O WAT 7741 18.423 50.976 92.811 1.00 0.00 O ATOM 40642 H1 WAT 7741 18.266 50.738 91.897 1.00 0.00 H ATOM 40643 H2 WAT 7741 19.375 51.048 92.878 1.00 0.00 H TER 40645 WAT 7741 ATOM 40645 O WAT 7742 83.911 20.767 154.926 1.00 0.00 O ATOM 40646 H1 WAT 7742 83.837 20.203 154.156 1.00 0.00 H ATOM 40647 H2 WAT 7742 84.518 20.304 155.504 1.00 0.00 H TER 40649 WAT 7742 ATOM 40649 O WAT 7743 109.015 81.266 132.481 1.00 0.00 O ATOM 40650 H1 WAT 7743 108.468 81.996 132.770 1.00 0.00 H ATOM 40651 H2 WAT 7743 109.801 81.681 132.126 1.00 0.00 H TER 40653 WAT 7743 ATOM 40653 O WAT 7744 121.077 97.150 83.929 1.00 0.00 O ATOM 40654 H1 WAT 7744 121.835 97.735 83.918 1.00 0.00 H ATOM 40655 H2 WAT 7744 121.161 96.665 84.750 1.00 0.00 H TER 40657 WAT 7744 ATOM 40657 O WAT 7745 141.975 15.244 58.180 1.00 0.00 O ATOM 40658 H1 WAT 7745 142.346 15.235 59.063 1.00 0.00 H ATOM 40659 H2 WAT 7745 141.153 15.726 58.271 1.00 0.00 H TER 40661 WAT 7745 ATOM 40661 O WAT 7746 71.348 1.835 62.513 1.00 0.00 O ATOM 40662 H1 WAT 7746 71.310 2.621 61.968 1.00 0.00 H ATOM 40663 H2 WAT 7746 72.271 1.753 62.752 1.00 0.00 H TER 40665 WAT 7746 ATOM 40665 O WAT 7747 141.698 46.853 103.885 1.00 0.00 O ATOM 40666 H1 WAT 7747 141.885 47.592 104.464 1.00 0.00 H ATOM 40667 H2 WAT 7747 140.748 46.870 103.774 1.00 0.00 H TER 40669 WAT 7747 ATOM 40669 O WAT 7748 87.632 89.238 121.641 1.00 0.00 O ATOM 40670 H1 WAT 7748 87.823 88.340 121.911 1.00 0.00 H ATOM 40671 H2 WAT 7748 86.747 89.403 121.967 1.00 0.00 H TER 40673 WAT 7748 ATOM 40673 O WAT 7749 112.748 14.413 58.674 1.00 0.00 O ATOM 40674 H1 WAT 7749 112.719 15.140 58.053 1.00 0.00 H ATOM 40675 H2 WAT 7749 113.611 14.020 58.544 1.00 0.00 H TER 40677 WAT 7749 ATOM 40677 O WAT 7750 22.503 31.063 113.568 1.00 0.00 O ATOM 40678 H1 WAT 7750 23.296 31.177 113.044 1.00 0.00 H ATOM 40679 H2 WAT 7750 21.792 31.335 112.988 1.00 0.00 H TER 40681 WAT 7750 ATOM 40681 O WAT 7751 57.848 42.236 19.846 1.00 0.00 O ATOM 40682 H1 WAT 7751 57.120 41.851 19.358 1.00 0.00 H ATOM 40683 H2 WAT 7751 57.452 42.549 20.659 1.00 0.00 H TER 40685 WAT 7751 ATOM 40685 O WAT 7752 18.330 121.723 136.702 1.00 0.00 O ATOM 40686 H1 WAT 7752 18.661 121.655 135.806 1.00 0.00 H ATOM 40687 H2 WAT 7752 19.080 122.026 137.212 1.00 0.00 H TER 40689 WAT 7752 ATOM 40689 O WAT 7753 84.275 68.001 144.920 1.00 0.00 O ATOM 40690 H1 WAT 7753 83.690 67.949 145.676 1.00 0.00 H ATOM 40691 H2 WAT 7753 84.235 67.130 144.526 1.00 0.00 H TER 40693 WAT 7753 ATOM 40693 O WAT 7754 122.004 124.296 137.930 1.00 0.00 O ATOM 40694 H1 WAT 7754 121.073 124.134 137.775 1.00 0.00 H ATOM 40695 H2 WAT 7754 122.442 123.510 137.605 1.00 0.00 H TER 40697 WAT 7754 ATOM 40697 O WAT 7755 63.033 50.162 106.052 1.00 0.00 O ATOM 40698 H1 WAT 7755 62.849 50.155 106.991 1.00 0.00 H ATOM 40699 H2 WAT 7755 62.360 50.733 105.681 1.00 0.00 H TER 40701 WAT 7755 ATOM 40701 O WAT 7756 86.588 110.530 94.118 1.00 0.00 O ATOM 40702 H1 WAT 7756 86.314 110.923 93.289 1.00 0.00 H ATOM 40703 H2 WAT 7756 85.774 110.231 94.522 1.00 0.00 H TER 40705 WAT 7756 ATOM 40705 O WAT 7757 141.460 138.020 150.234 1.00 0.00 O ATOM 40706 H1 WAT 7757 142.417 138.024 150.278 1.00 0.00 H ATOM 40707 H2 WAT 7757 141.236 137.126 149.976 1.00 0.00 H TER 40709 WAT 7757 ATOM 40709 O WAT 7758 2.153 86.959 26.955 1.00 0.00 O ATOM 40710 H1 WAT 7758 2.787 86.373 26.542 1.00 0.00 H ATOM 40711 H2 WAT 7758 1.876 87.546 26.251 1.00 0.00 H TER 40713 WAT 7758 ATOM 40713 O WAT 7759 35.327 16.871 121.545 1.00 0.00 O ATOM 40714 H1 WAT 7759 34.852 17.125 120.754 1.00 0.00 H ATOM 40715 H2 WAT 7759 34.777 17.180 122.265 1.00 0.00 H TER 40717 WAT 7759 ATOM 40717 O WAT 7760 125.876 89.472 72.406 1.00 0.00 O ATOM 40718 H1 WAT 7760 125.942 89.018 73.246 1.00 0.00 H ATOM 40719 H2 WAT 7760 126.666 90.010 72.362 1.00 0.00 H TER 40721 WAT 7760 ATOM 40721 O WAT 7761 70.626 140.129 80.331 1.00 0.00 O ATOM 40722 H1 WAT 7761 70.093 140.802 79.909 1.00 0.00 H ATOM 40723 H2 WAT 7761 71.280 140.619 80.830 1.00 0.00 H TER 40725 WAT 7761 ATOM 40725 O WAT 7762 113.945 123.111 58.721 1.00 0.00 O ATOM 40726 H1 WAT 7762 113.149 123.455 58.316 1.00 0.00 H ATOM 40727 H2 WAT 7762 114.429 122.712 57.998 1.00 0.00 H TER 40729 WAT 7762 ATOM 40729 O WAT 7763 12.088 78.244 13.710 1.00 0.00 O ATOM 40730 H1 WAT 7763 11.247 78.110 13.273 1.00 0.00 H ATOM 40731 H2 WAT 7763 11.880 78.217 14.644 1.00 0.00 H TER 40733 WAT 7763 ATOM 40733 O WAT 7764 103.240 91.727 150.718 1.00 0.00 O ATOM 40734 H1 WAT 7764 103.358 92.359 150.010 1.00 0.00 H ATOM 40735 H2 WAT 7764 102.966 92.255 151.468 1.00 0.00 H TER 40737 WAT 7764 ATOM 40737 O WAT 7765 124.127 127.623 81.154 1.00 0.00 O ATOM 40738 H1 WAT 7765 124.641 126.930 81.568 1.00 0.00 H ATOM 40739 H2 WAT 7765 124.778 128.193 80.746 1.00 0.00 H TER 40741 WAT 7765 ATOM 40741 O WAT 7766 143.376 94.515 92.370 1.00 0.00 O ATOM 40742 H1 WAT 7766 142.451 94.677 92.556 1.00 0.00 H ATOM 40743 H2 WAT 7766 143.671 93.956 93.089 1.00 0.00 H TER 40745 WAT 7766 ATOM 40745 O WAT 7767 136.348 46.447 114.325 1.00 0.00 O ATOM 40746 H1 WAT 7767 137.197 46.594 114.742 1.00 0.00 H ATOM 40747 H2 WAT 7767 135.747 46.294 115.055 1.00 0.00 H TER 40749 WAT 7767 ATOM 40749 O WAT 7768 100.309 58.188 86.707 1.00 0.00 O ATOM 40750 H1 WAT 7768 100.707 57.319 86.650 1.00 0.00 H ATOM 40751 H2 WAT 7768 100.605 58.532 87.549 1.00 0.00 H TER 40753 WAT 7768 ATOM 40753 O WAT 7769 133.691 103.411 18.058 1.00 0.00 O ATOM 40754 H1 WAT 7769 134.545 103.843 18.010 1.00 0.00 H ATOM 40755 H2 WAT 7769 133.790 102.761 18.754 1.00 0.00 H TER 40757 WAT 7769 ATOM 40757 O WAT 7770 109.905 62.521 128.874 1.00 0.00 O ATOM 40758 H1 WAT 7770 110.634 62.200 129.405 1.00 0.00 H ATOM 40759 H2 WAT 7770 110.012 62.083 128.030 1.00 0.00 H TER 40761 WAT 7770 ATOM 40761 O WAT 7771 109.554 3.572 118.339 1.00 0.00 O ATOM 40762 H1 WAT 7771 109.654 4.365 117.813 1.00 0.00 H ATOM 40763 H2 WAT 7771 109.951 3.790 119.182 1.00 0.00 H TER 40765 WAT 7771 ATOM 40765 O WAT 7772 116.714 128.352 87.132 1.00 0.00 O ATOM 40766 H1 WAT 7772 116.005 128.731 86.612 1.00 0.00 H ATOM 40767 H2 WAT 7772 116.429 127.455 87.306 1.00 0.00 H TER 40769 WAT 7772 ATOM 40769 O WAT 7773 50.125 75.883 16.093 1.00 0.00 O ATOM 40770 H1 WAT 7773 49.424 75.265 16.298 1.00 0.00 H ATOM 40771 H2 WAT 7773 49.732 76.745 16.230 1.00 0.00 H TER 40773 WAT 7773 ATOM 40773 O WAT 7774 76.690 60.410 6.172 1.00 0.00 O ATOM 40774 H1 WAT 7774 76.538 61.269 6.566 1.00 0.00 H ATOM 40775 H2 WAT 7774 77.110 59.899 6.864 1.00 0.00 H TER 40777 WAT 7774 ATOM 40777 O WAT 7775 3.836 134.963 120.548 1.00 0.00 O ATOM 40778 H1 WAT 7775 3.564 134.716 119.664 1.00 0.00 H ATOM 40779 H2 WAT 7775 4.030 135.898 120.486 1.00 0.00 H TER 40781 WAT 7775 ATOM 40781 O WAT 7776 107.260 13.221 58.769 1.00 0.00 O ATOM 40782 H1 WAT 7776 106.888 12.421 58.397 1.00 0.00 H ATOM 40783 H2 WAT 7776 107.652 13.672 58.021 1.00 0.00 H TER 40785 WAT 7776 ATOM 40785 O WAT 7777 17.159 64.398 92.546 1.00 0.00 O ATOM 40786 H1 WAT 7777 18.107 64.281 92.497 1.00 0.00 H ATOM 40787 H2 WAT 7777 16.934 64.869 91.743 1.00 0.00 H TER 40789 WAT 7777 ATOM 40789 O WAT 7778 81.292 54.752 80.638 1.00 0.00 O ATOM 40790 H1 WAT 7778 81.025 54.818 79.721 1.00 0.00 H ATOM 40791 H2 WAT 7778 80.510 54.441 81.094 1.00 0.00 H TER 40793 WAT 7778 ATOM 40793 O WAT 7779 121.612 68.509 18.162 1.00 0.00 O ATOM 40794 H1 WAT 7779 121.574 68.946 17.311 1.00 0.00 H ATOM 40795 H2 WAT 7779 122.302 68.971 18.638 1.00 0.00 H TER 40797 WAT 7779 ATOM 40797 O WAT 7780 1.073 127.133 116.775 1.00 0.00 O ATOM 40798 H1 WAT 7780 1.250 126.221 116.544 1.00 0.00 H ATOM 40799 H2 WAT 7780 1.440 127.233 117.654 1.00 0.00 H TER 40801 WAT 7780 ATOM 40801 O WAT 7781 125.108 16.804 153.372 1.00 0.00 O ATOM 40802 H1 WAT 7781 124.349 16.850 153.954 1.00 0.00 H ATOM 40803 H2 WAT 7781 125.651 17.549 153.628 1.00 0.00 H TER 40805 WAT 7781 ATOM 40805 O WAT 7782 23.023 97.910 146.203 1.00 0.00 O ATOM 40806 H1 WAT 7782 23.439 98.409 146.905 1.00 0.00 H ATOM 40807 H2 WAT 7782 22.611 98.573 145.649 1.00 0.00 H TER 40809 WAT 7782 ATOM 40809 O WAT 7783 60.858 32.916 63.432 1.00 0.00 O ATOM 40810 H1 WAT 7783 60.790 33.310 62.563 1.00 0.00 H ATOM 40811 H2 WAT 7783 60.120 32.307 63.478 1.00 0.00 H TER 40813 WAT 7783 ATOM 40813 O WAT 7784 127.098 30.817 115.137 1.00 0.00 O ATOM 40814 H1 WAT 7784 127.484 30.024 114.765 1.00 0.00 H ATOM 40815 H2 WAT 7784 126.659 31.239 114.398 1.00 0.00 H TER 40817 WAT 7784 ATOM 40817 O WAT 7785 3.319 0.343 114.514 1.00 0.00 O ATOM 40818 H1 WAT 7785 2.529 -0.066 114.867 1.00 0.00 H ATOM 40819 H2 WAT 7785 3.778 -0.369 114.069 1.00 0.00 H TER 40821 WAT 7785 ATOM 40821 O WAT 7786 1.892 70.328 87.343 1.00 0.00 O ATOM 40822 H1 WAT 7786 1.461 71.158 87.548 1.00 0.00 H ATOM 40823 H2 WAT 7786 1.376 69.961 86.625 1.00 0.00 H TER 40825 WAT 7786 ATOM 40825 O WAT 7787 90.446 35.971 129.928 1.00 0.00 O ATOM 40826 H1 WAT 7787 90.715 36.525 130.661 1.00 0.00 H ATOM 40827 H2 WAT 7787 90.491 35.079 130.272 1.00 0.00 H TER 40829 WAT 7787 ATOM 40829 O WAT 7788 50.669 52.184 133.395 1.00 0.00 O ATOM 40830 H1 WAT 7788 51.026 51.334 133.139 1.00 0.00 H ATOM 40831 H2 WAT 7788 51.131 52.405 134.204 1.00 0.00 H TER 40833 WAT 7788 ATOM 40833 O WAT 7789 70.349 59.497 19.237 1.00 0.00 O ATOM 40834 H1 WAT 7789 70.219 60.419 19.460 1.00 0.00 H ATOM 40835 H2 WAT 7789 71.141 59.490 18.699 1.00 0.00 H TER 40837 WAT 7789 ATOM 40837 O WAT 7790 128.544 133.446 92.915 1.00 0.00 O ATOM 40838 H1 WAT 7790 128.118 133.899 93.643 1.00 0.00 H ATOM 40839 H2 WAT 7790 129.083 132.775 93.334 1.00 0.00 H TER 40841 WAT 7790 ATOM 40841 O WAT 7791 40.041 42.174 99.207 1.00 0.00 O ATOM 40842 H1 WAT 7791 40.293 42.245 100.127 1.00 0.00 H ATOM 40843 H2 WAT 7791 39.131 42.469 99.184 1.00 0.00 H TER 40845 WAT 7791 ATOM 40845 O WAT 7792 143.126 72.641 134.135 1.00 0.00 O ATOM 40846 H1 WAT 7792 143.080 72.703 133.181 1.00 0.00 H ATOM 40847 H2 WAT 7792 142.330 73.075 134.442 1.00 0.00 H TER 40849 WAT 7792 ATOM 40849 O WAT 7793 137.483 7.158 125.382 1.00 0.00 O ATOM 40850 H1 WAT 7793 137.441 7.502 126.274 1.00 0.00 H ATOM 40851 H2 WAT 7793 136.723 6.581 125.312 1.00 0.00 H TER 40853 WAT 7793 ATOM 40853 O WAT 7794 98.534 108.854 8.817 1.00 0.00 O ATOM 40854 H1 WAT 7794 97.914 109.071 9.513 1.00 0.00 H ATOM 40855 H2 WAT 7794 98.406 109.537 8.159 1.00 0.00 H TER 40857 WAT 7794 ATOM 40857 O WAT 7795 77.918 47.991 62.164 1.00 0.00 O ATOM 40858 H1 WAT 7795 77.820 47.264 61.548 1.00 0.00 H ATOM 40859 H2 WAT 7795 78.003 47.569 63.019 1.00 0.00 H TER 40861 WAT 7795 ATOM 40861 O WAT 7796 10.318 117.986 72.287 1.00 0.00 O ATOM 40862 H1 WAT 7796 11.205 117.942 72.643 1.00 0.00 H ATOM 40863 H2 WAT 7796 9.781 117.510 72.920 1.00 0.00 H TER 40865 WAT 7796 ATOM 40865 O WAT 7797 3.131 110.897 4.513 1.00 0.00 O ATOM 40866 H1 WAT 7797 2.344 111.403 4.308 1.00 0.00 H ATOM 40867 H2 WAT 7797 2.861 109.984 4.417 1.00 0.00 H TER 40869 WAT 7797 ATOM 40869 O WAT 7798 116.994 142.214 107.917 1.00 0.00 O ATOM 40870 H1 WAT 7798 117.588 141.931 108.612 1.00 0.00 H ATOM 40871 H2 WAT 7798 116.119 142.084 108.283 1.00 0.00 H TER 40873 WAT 7798 ATOM 40873 O WAT 7799 138.086 19.269 153.512 1.00 0.00 O ATOM 40874 H1 WAT 7799 137.826 20.063 153.045 1.00 0.00 H ATOM 40875 H2 WAT 7799 139.040 19.326 153.567 1.00 0.00 H TER 40877 WAT 7799 ATOM 40877 O WAT 7800 29.031 24.431 148.482 1.00 0.00 O ATOM 40878 H1 WAT 7800 28.229 24.734 148.908 1.00 0.00 H ATOM 40879 H2 WAT 7800 29.629 25.176 148.541 1.00 0.00 H TER 40881 WAT 7800 ATOM 40881 O WAT 7801 14.109 17.139 76.568 1.00 0.00 O ATOM 40882 H1 WAT 7801 13.515 17.568 77.183 1.00 0.00 H ATOM 40883 H2 WAT 7801 14.612 17.856 76.181 1.00 0.00 H TER 40885 WAT 7801 ATOM 40885 O WAT 7802 22.674 93.097 17.444 1.00 0.00 O ATOM 40886 H1 WAT 7802 23.339 93.237 18.119 1.00 0.00 H ATOM 40887 H2 WAT 7802 21.928 92.727 17.917 1.00 0.00 H TER 40889 WAT 7802 ATOM 40889 O WAT 7803 14.875 103.387 137.615 1.00 0.00 O ATOM 40890 H1 WAT 7803 14.611 103.149 138.504 1.00 0.00 H ATOM 40891 H2 WAT 7803 15.817 103.541 137.678 1.00 0.00 H TER 40893 WAT 7803 ATOM 40893 O WAT 7804 144.375 133.548 102.508 1.00 0.00 O ATOM 40894 H1 WAT 7804 145.235 133.830 102.819 1.00 0.00 H ATOM 40895 H2 WAT 7804 144.557 132.784 101.961 1.00 0.00 H TER 40897 WAT 7804 ATOM 40897 O WAT 7805 122.121 10.058 65.108 1.00 0.00 O ATOM 40898 H1 WAT 7805 121.393 9.958 64.493 1.00 0.00 H ATOM 40899 H2 WAT 7805 122.044 9.304 65.693 1.00 0.00 H TER 40901 WAT 7805 ATOM 40901 O WAT 7806 99.224 93.249 3.249 1.00 0.00 O ATOM 40902 H1 WAT 7806 98.372 93.678 3.331 1.00 0.00 H ATOM 40903 H2 WAT 7806 99.402 92.902 4.123 1.00 0.00 H TER 40905 WAT 7806 ATOM 40905 O WAT 7807 124.709 98.334 16.132 1.00 0.00 O ATOM 40906 H1 WAT 7807 124.095 97.624 16.320 1.00 0.00 H ATOM 40907 H2 WAT 7807 124.444 98.658 15.271 1.00 0.00 H TER 40909 WAT 7807 ATOM 40909 O WAT 7808 56.463 63.935 77.802 1.00 0.00 O ATOM 40910 H1 WAT 7808 56.641 63.633 76.911 1.00 0.00 H ATOM 40911 H2 WAT 7808 56.051 63.185 78.231 1.00 0.00 H TER 40913 WAT 7808 ATOM 40913 O WAT 7809 139.401 18.180 3.580 1.00 0.00 O ATOM 40914 H1 WAT 7809 139.193 18.340 2.659 1.00 0.00 H ATOM 40915 H2 WAT 7809 139.560 19.050 3.945 1.00 0.00 H TER 40917 WAT 7809 ATOM 40917 O WAT 7810 31.598 57.421 129.449 1.00 0.00 O ATOM 40918 H1 WAT 7810 31.547 58.250 129.924 1.00 0.00 H ATOM 40919 H2 WAT 7810 31.153 57.593 128.619 1.00 0.00 H TER 40921 WAT 7810 ATOM 40921 O WAT 7811 131.415 54.756 129.327 1.00 0.00 O ATOM 40922 H1 WAT 7811 131.905 55.577 129.281 1.00 0.00 H ATOM 40923 H2 WAT 7811 132.016 54.098 128.977 1.00 0.00 H TER 40925 WAT 7811 ATOM 40925 O WAT 7812 101.825 124.837 92.662 1.00 0.00 O ATOM 40926 H1 WAT 7812 101.667 124.579 93.570 1.00 0.00 H ATOM 40927 H2 WAT 7812 100.955 125.027 92.312 1.00 0.00 H TER 40929 WAT 7812 ATOM 40929 O WAT 7813 135.675 66.886 76.258 1.00 0.00 O ATOM 40930 H1 WAT 7813 136.496 66.894 76.750 1.00 0.00 H ATOM 40931 H2 WAT 7813 135.297 66.026 76.438 1.00 0.00 H TER 40933 WAT 7813 ATOM 40933 O WAT 7814 126.954 52.709 13.087 1.00 0.00 O ATOM 40934 H1 WAT 7814 126.282 52.085 12.815 1.00 0.00 H ATOM 40935 H2 WAT 7814 127.673 52.571 12.471 1.00 0.00 H TER 40937 WAT 7814 ATOM 40937 O WAT 7815 3.468 62.043 85.625 1.00 0.00 O ATOM 40938 H1 WAT 7815 4.234 62.446 85.217 1.00 0.00 H ATOM 40939 H2 WAT 7815 3.802 61.237 86.018 1.00 0.00 H TER 40941 WAT 7815 ATOM 40941 O WAT 7816 71.968 60.226 67.247 1.00 0.00 O ATOM 40942 H1 WAT 7816 71.726 60.312 68.169 1.00 0.00 H ATOM 40943 H2 WAT 7816 71.937 59.284 67.078 1.00 0.00 H TER 40945 WAT 7816 ATOM 40945 O WAT 7817 117.503 69.709 138.709 1.00 0.00 O ATOM 40946 H1 WAT 7817 117.614 68.768 138.840 1.00 0.00 H ATOM 40947 H2 WAT 7817 118.340 70.089 138.976 1.00 0.00 H TER 40949 WAT 7817 ATOM 40949 O WAT 7818 20.866 3.395 118.989 1.00 0.00 O ATOM 40950 H1 WAT 7818 20.126 3.380 118.382 1.00 0.00 H ATOM 40951 H2 WAT 7818 20.675 4.121 119.582 1.00 0.00 H TER 40953 WAT 7818 ATOM 40953 O WAT 7819 141.720 75.325 155.424 1.00 0.00 O ATOM 40954 H1 WAT 7819 140.956 75.817 155.123 1.00 0.00 H ATOM 40955 H2 WAT 7819 141.636 75.313 156.377 1.00 0.00 H TER 40957 WAT 7819 ATOM 40957 O WAT 7820 76.723 92.712 109.922 1.00 0.00 O ATOM 40958 H1 WAT 7820 76.507 91.997 110.521 1.00 0.00 H ATOM 40959 H2 WAT 7820 76.057 93.377 110.093 1.00 0.00 H TER 40961 WAT 7820 ATOM 40961 O WAT 7821 120.837 101.302 14.372 1.00 0.00 O ATOM 40962 H1 WAT 7821 120.808 101.610 15.278 1.00 0.00 H ATOM 40963 H2 WAT 7821 121.252 102.017 13.890 1.00 0.00 H TER 40965 WAT 7821 ATOM 40965 O WAT 7822 13.009 119.134 91.199 1.00 0.00 O ATOM 40966 H1 WAT 7822 13.557 119.892 90.992 1.00 0.00 H ATOM 40967 H2 WAT 7822 13.433 118.403 90.750 1.00 0.00 H TER 40969 WAT 7822 ATOM 40969 O WAT 7823 144.416 87.388 154.213 1.00 0.00 O ATOM 40970 H1 WAT 7823 143.841 87.783 154.867 1.00 0.00 H ATOM 40971 H2 WAT 7823 144.764 88.131 153.719 1.00 0.00 H TER 40973 WAT 7823 ATOM 40973 O WAT 7824 85.908 63.621 142.275 1.00 0.00 O ATOM 40974 H1 WAT 7824 85.788 63.948 143.166 1.00 0.00 H ATOM 40975 H2 WAT 7824 85.275 62.908 142.194 1.00 0.00 H TER 40977 WAT 7824 ATOM 40977 O WAT 7825 96.079 13.072 88.873 1.00 0.00 O ATOM 40978 H1 WAT 7825 96.357 12.584 88.098 1.00 0.00 H ATOM 40979 H2 WAT 7825 95.225 12.701 89.096 1.00 0.00 H TER 40981 WAT 7825 ATOM 40981 O WAT 7826 53.962 116.972 68.490 1.00 0.00 O ATOM 40982 H1 WAT 7826 54.031 117.126 67.548 1.00 0.00 H ATOM 40983 H2 WAT 7826 53.116 117.348 68.733 1.00 0.00 H TER 40985 WAT 7826 ATOM 40985 O WAT 7827 63.037 134.208 115.526 1.00 0.00 O ATOM 40986 H1 WAT 7827 62.270 133.902 116.009 1.00 0.00 H ATOM 40987 H2 WAT 7827 63.768 133.718 115.901 1.00 0.00 H TER 40989 WAT 7827 ATOM 40989 O WAT 7828 102.146 83.033 114.175 1.00 0.00 O ATOM 40990 H1 WAT 7828 102.821 82.632 113.627 1.00 0.00 H ATOM 40991 H2 WAT 7828 102.625 83.646 114.733 1.00 0.00 H TER 40993 WAT 7828 ATOM 40993 O WAT 7829 91.156 101.120 100.226 1.00 0.00 O ATOM 40994 H1 WAT 7829 90.424 100.816 99.690 1.00 0.00 H ATOM 40995 H2 WAT 7829 91.054 102.071 100.255 1.00 0.00 H TER 40997 WAT 7829 ATOM 40997 O WAT 7830 99.142 130.696 105.011 1.00 0.00 O ATOM 40998 H1 WAT 7830 100.047 130.531 104.748 1.00 0.00 H ATOM 40999 H2 WAT 7830 99.132 130.530 105.954 1.00 0.00 H TER 41001 WAT 7830 ATOM 41001 O WAT 7831 7.627 71.210 13.188 1.00 0.00 O ATOM 41002 H1 WAT 7831 7.895 71.414 14.084 1.00 0.00 H ATOM 41003 H2 WAT 7831 7.757 72.027 12.707 1.00 0.00 H TER 41005 WAT 7831 ATOM 41005 O WAT 7832 112.060 24.297 90.775 1.00 0.00 O ATOM 41006 H1 WAT 7832 112.196 24.355 89.829 1.00 0.00 H ATOM 41007 H2 WAT 7832 111.370 24.934 90.957 1.00 0.00 H TER 41009 WAT 7832 ATOM 41009 O WAT 7833 111.537 49.599 71.440 1.00 0.00 O ATOM 41010 H1 WAT 7833 110.971 49.233 70.761 1.00 0.00 H ATOM 41011 H2 WAT 7833 111.153 49.294 72.262 1.00 0.00 H TER 41013 WAT 7833 ATOM 41013 O WAT 7834 81.569 113.497 126.607 1.00 0.00 O ATOM 41014 H1 WAT 7834 80.620 113.380 126.595 1.00 0.00 H ATOM 41015 H2 WAT 7834 81.725 114.117 127.320 1.00 0.00 H TER 41017 WAT 7834 ATOM 41017 O WAT 7835 90.477 128.787 1.339 1.00 0.00 O ATOM 41018 H1 WAT 7835 91.422 128.803 1.496 1.00 0.00 H ATOM 41019 H2 WAT 7835 90.115 128.341 2.105 1.00 0.00 H TER 41021 WAT 7835 ATOM 41021 O WAT 7836 28.069 145.849 56.156 1.00 0.00 O ATOM 41022 H1 WAT 7836 28.051 144.951 55.825 1.00 0.00 H ATOM 41023 H2 WAT 7836 28.972 146.137 56.018 1.00 0.00 H TER 41025 WAT 7836 ATOM 41025 O WAT 7837 67.887 128.853 114.728 1.00 0.00 O ATOM 41026 H1 WAT 7837 67.193 128.265 115.026 1.00 0.00 H ATOM 41027 H2 WAT 7837 68.118 129.362 115.504 1.00 0.00 H TER 41029 WAT 7837 ATOM 41029 O WAT 7838 91.605 19.880 142.023 1.00 0.00 O ATOM 41030 H1 WAT 7838 92.470 19.479 142.106 1.00 0.00 H ATOM 41031 H2 WAT 7838 91.035 19.165 141.741 1.00 0.00 H TER 41033 WAT 7838 ATOM 41033 O WAT 7839 77.033 21.473 129.543 1.00 0.00 O ATOM 41034 H1 WAT 7839 76.909 21.063 130.399 1.00 0.00 H ATOM 41035 H2 WAT 7839 76.717 22.369 129.658 1.00 0.00 H TER 41037 WAT 7839 ATOM 41037 O WAT 7840 48.263 96.821 104.217 1.00 0.00 O ATOM 41038 H1 WAT 7840 47.770 96.525 104.983 1.00 0.00 H ATOM 41039 H2 WAT 7840 48.379 97.761 104.356 1.00 0.00 H TER 41041 WAT 7840 ATOM 41041 O WAT 7841 106.428 14.809 155.409 1.00 0.00 O ATOM 41042 H1 WAT 7841 106.495 14.045 154.837 1.00 0.00 H ATOM 41043 H2 WAT 7841 106.815 15.522 154.902 1.00 0.00 H TER 41045 WAT 7841 ATOM 41045 O WAT 7842 80.813 109.077 85.637 1.00 0.00 O ATOM 41046 H1 WAT 7842 80.228 108.690 86.288 1.00 0.00 H ATOM 41047 H2 WAT 7842 81.061 109.923 86.011 1.00 0.00 H TER 41049 WAT 7842 ATOM 41049 O WAT 7843 142.541 118.381 137.537 1.00 0.00 O ATOM 41050 H1 WAT 7843 142.250 119.277 137.368 1.00 0.00 H ATOM 41051 H2 WAT 7843 142.061 118.117 138.322 1.00 0.00 H TER 41053 WAT 7843 ATOM 41053 O WAT 7844 23.737 44.768 120.072 1.00 0.00 O ATOM 41054 H1 WAT 7844 24.386 44.439 119.450 1.00 0.00 H ATOM 41055 H2 WAT 7844 23.258 45.439 119.585 1.00 0.00 H TER 41057 WAT 7844 ATOM 41057 O WAT 7845 90.396 66.303 131.240 1.00 0.00 O ATOM 41058 H1 WAT 7845 89.840 66.244 130.463 1.00 0.00 H ATOM 41059 H2 WAT 7845 89.834 66.015 131.959 1.00 0.00 H TER 41061 WAT 7845 ATOM 41061 O WAT 7846 14.222 16.528 24.504 1.00 0.00 O ATOM 41062 H1 WAT 7846 15.084 16.923 24.635 1.00 0.00 H ATOM 41063 H2 WAT 7846 14.284 16.096 23.652 1.00 0.00 H TER 41065 WAT 7846 ATOM 41065 O WAT 7847 105.996 54.722 21.722 1.00 0.00 O ATOM 41066 H1 WAT 7847 105.735 55.584 22.046 1.00 0.00 H ATOM 41067 H2 WAT 7847 105.175 54.236 21.645 1.00 0.00 H TER 41069 WAT 7847 ATOM 41069 O WAT 7848 62.517 117.148 18.658 1.00 0.00 O ATOM 41070 H1 WAT 7848 62.081 116.739 19.406 1.00 0.00 H ATOM 41071 H2 WAT 7848 63.084 117.814 19.047 1.00 0.00 H TER 41073 WAT 7848 ATOM 41073 O WAT 7849 35.368 141.688 124.307 1.00 0.00 O ATOM 41074 H1 WAT 7849 35.184 142.491 123.819 1.00 0.00 H ATOM 41075 H2 WAT 7849 35.226 140.985 123.673 1.00 0.00 H TER 41077 WAT 7849 ATOM 41077 O WAT 7850 47.309 109.747 125.520 1.00 0.00 O ATOM 41078 H1 WAT 7850 48.093 109.408 125.953 1.00 0.00 H ATOM 41079 H2 WAT 7850 46.627 109.106 125.724 1.00 0.00 H TER 41081 WAT 7850 ATOM 41081 O WAT 7851 133.578 50.750 87.079 1.00 0.00 O ATOM 41082 H1 WAT 7851 132.711 50.351 87.155 1.00 0.00 H ATOM 41083 H2 WAT 7851 134.067 50.405 87.826 1.00 0.00 H TER 41085 WAT 7851 ATOM 41085 O WAT 7852 120.999 117.655 136.796 1.00 0.00 O ATOM 41086 H1 WAT 7852 120.157 117.467 136.381 1.00 0.00 H ATOM 41087 H2 WAT 7852 120.833 117.545 137.733 1.00 0.00 H TER 41089 WAT 7852 ATOM 41089 O WAT 7853 41.182 85.543 111.439 1.00 0.00 O ATOM 41090 H1 WAT 7853 41.521 84.654 111.542 1.00 0.00 H ATOM 41091 H2 WAT 7853 41.148 85.678 110.492 1.00 0.00 H TER 41093 WAT 7853 ATOM 41093 O WAT 7854 122.662 72.531 151.693 1.00 0.00 O ATOM 41094 H1 WAT 7854 121.740 72.333 151.856 1.00 0.00 H ATOM 41095 H2 WAT 7854 123.081 72.442 152.549 1.00 0.00 H TER 41097 WAT 7854 ATOM 41097 O WAT 7855 120.488 58.207 135.418 1.00 0.00 O ATOM 41098 H1 WAT 7855 120.149 59.066 135.166 1.00 0.00 H ATOM 41099 H2 WAT 7855 120.368 58.171 136.367 1.00 0.00 H TER 41101 WAT 7855 ATOM 41101 O WAT 7856 65.421 115.292 18.986 1.00 0.00 O ATOM 41102 H1 WAT 7856 66.044 114.596 18.776 1.00 0.00 H ATOM 41103 H2 WAT 7856 64.606 115.021 18.564 1.00 0.00 H TER 41105 WAT 7856 ATOM 41105 O WAT 7857 110.240 4.867 134.011 1.00 0.00 O ATOM 41106 H1 WAT 7857 110.622 4.632 133.165 1.00 0.00 H ATOM 41107 H2 WAT 7857 110.523 4.171 134.604 1.00 0.00 H TER 41109 WAT 7857 ATOM 41109 O WAT 7858 131.530 84.510 148.704 1.00 0.00 O ATOM 41110 H1 WAT 7858 131.774 85.424 148.848 1.00 0.00 H ATOM 41111 H2 WAT 7858 132.279 84.132 148.243 1.00 0.00 H TER 41113 WAT 7858 ATOM 41113 O WAT 7859 64.362 132.115 149.041 1.00 0.00 O ATOM 41114 H1 WAT 7859 64.557 131.181 149.108 1.00 0.00 H ATOM 41115 H2 WAT 7859 63.587 132.239 149.589 1.00 0.00 H TER 41117 WAT 7859 ATOM 41117 O WAT 7860 49.726 25.348 7.278 1.00 0.00 O ATOM 41118 H1 WAT 7860 50.044 25.797 6.495 1.00 0.00 H ATOM 41119 H2 WAT 7860 49.012 25.901 7.598 1.00 0.00 H TER 41121 WAT 7860 ATOM 41121 O WAT 7861 64.004 95.940 65.167 1.00 0.00 O ATOM 41122 H1 WAT 7861 64.650 95.279 64.917 1.00 0.00 H ATOM 41123 H2 WAT 7861 64.046 96.593 64.468 1.00 0.00 H TER 41125 WAT 7861 ATOM 41125 O WAT 7862 143.745 97.585 155.832 1.00 0.00 O ATOM 41126 H1 WAT 7862 143.593 97.638 156.776 1.00 0.00 H ATOM 41127 H2 WAT 7862 144.645 97.889 155.717 1.00 0.00 H TER 41129 WAT 7862 ATOM 41129 O WAT 7863 36.511 102.033 132.204 1.00 0.00 O ATOM 41130 H1 WAT 7863 36.534 101.309 131.578 1.00 0.00 H ATOM 41131 H2 WAT 7863 37.170 101.803 132.860 1.00 0.00 H TER 41133 WAT 7863 ATOM 41133 O WAT 7864 78.904 117.067 103.569 1.00 0.00 O ATOM 41134 H1 WAT 7864 78.102 116.941 103.062 1.00 0.00 H ATOM 41135 H2 WAT 7864 79.575 117.255 102.912 1.00 0.00 H TER 41137 WAT 7864 ATOM 41137 O WAT 7865 33.717 12.408 79.357 1.00 0.00 O ATOM 41138 H1 WAT 7865 34.483 12.358 79.928 1.00 0.00 H ATOM 41139 H2 WAT 7865 34.061 12.242 78.479 1.00 0.00 H TER 41141 WAT 7865 ATOM 41141 O WAT 7866 82.682 17.902 115.099 1.00 0.00 O ATOM 41142 H1 WAT 7866 82.087 17.356 114.585 1.00 0.00 H ATOM 41143 H2 WAT 7866 83.540 17.494 114.986 1.00 0.00 H TER 41145 WAT 7866 ATOM 41145 O WAT 7867 138.930 100.986 11.368 1.00 0.00 O ATOM 41146 H1 WAT 7867 138.595 101.655 11.964 1.00 0.00 H ATOM 41147 H2 WAT 7867 139.266 101.478 10.619 1.00 0.00 H TER 41149 WAT 7867 ATOM 41149 O WAT 7868 54.057 54.241 119.031 1.00 0.00 O ATOM 41150 H1 WAT 7868 54.649 53.631 119.470 1.00 0.00 H ATOM 41151 H2 WAT 7868 53.214 53.789 119.017 1.00 0.00 H TER 41153 WAT 7868 ATOM 41153 O WAT 7869 69.936 39.037 142.833 1.00 0.00 O ATOM 41154 H1 WAT 7869 69.627 39.543 142.082 1.00 0.00 H ATOM 41155 H2 WAT 7869 70.412 39.671 143.370 1.00 0.00 H TER 41157 WAT 7869 ATOM 41157 O WAT 7870 103.935 94.360 142.650 1.00 0.00 O ATOM 41158 H1 WAT 7870 103.005 94.564 142.558 1.00 0.00 H ATOM 41159 H2 WAT 7870 103.966 93.405 142.712 1.00 0.00 H TER 41161 WAT 7870 ATOM 41161 O WAT 7871 140.439 14.973 15.566 1.00 0.00 O ATOM 41162 H1 WAT 7871 141.194 14.630 16.045 1.00 0.00 H ATOM 41163 H2 WAT 7871 139.697 14.831 16.154 1.00 0.00 H TER 41165 WAT 7871 ATOM 41165 O WAT 7872 144.528 41.394 95.484 1.00 0.00 O ATOM 41166 H1 WAT 7872 143.680 41.724 95.780 1.00 0.00 H ATOM 41167 H2 WAT 7872 144.833 42.047 94.853 1.00 0.00 H TER 41169 WAT 7872 ATOM 41169 O WAT 7873 124.012 88.530 84.614 1.00 0.00 O ATOM 41170 H1 WAT 7873 124.066 87.627 84.300 1.00 0.00 H ATOM 41171 H2 WAT 7873 124.887 88.719 84.951 1.00 0.00 H TER 41173 WAT 7873 ATOM 41173 O WAT 7874 38.791 112.483 11.383 1.00 0.00 O ATOM 41174 H1 WAT 7874 38.346 112.675 12.208 1.00 0.00 H ATOM 41175 H2 WAT 7874 38.187 111.907 10.914 1.00 0.00 H TER 41177 WAT 7874 ATOM 41177 O WAT 7875 10.542 52.365 128.176 1.00 0.00 O ATOM 41178 H1 WAT 7875 10.410 51.996 129.049 1.00 0.00 H ATOM 41179 H2 WAT 7875 11.063 51.708 127.714 1.00 0.00 H TER 41181 WAT 7875 ATOM 41181 O WAT 7876 81.153 110.719 20.998 1.00 0.00 O ATOM 41182 H1 WAT 7876 81.697 110.348 21.692 1.00 0.00 H ATOM 41183 H2 WAT 7876 80.461 111.191 21.462 1.00 0.00 H TER 41185 WAT 7876 ATOM 41185 O WAT 7877 1.488 132.634 72.316 1.00 0.00 O ATOM 41186 H1 WAT 7877 2.228 132.523 71.720 1.00 0.00 H ATOM 41187 H2 WAT 7877 1.824 132.359 73.169 1.00 0.00 H TER 41189 WAT 7877 ATOM 41189 O WAT 7878 101.970 126.390 109.143 1.00 0.00 O ATOM 41190 H1 WAT 7878 102.669 126.739 109.696 1.00 0.00 H ATOM 41191 H2 WAT 7878 101.978 126.948 108.365 1.00 0.00 H TER 41193 WAT 7878 ATOM 41193 O WAT 7879 49.924 129.601 77.154 1.00 0.00 O ATOM 41194 H1 WAT 7879 50.258 128.818 76.716 1.00 0.00 H ATOM 41195 H2 WAT 7879 50.481 129.700 77.926 1.00 0.00 H TER 41197 WAT 7879 ATOM 41197 O WAT 7880 63.156 46.770 16.629 1.00 0.00 O ATOM 41198 H1 WAT 7880 62.473 47.177 17.163 1.00 0.00 H ATOM 41199 H2 WAT 7880 63.922 47.331 16.751 1.00 0.00 H TER 41201 WAT 7880 ATOM 41201 O WAT 7881 130.730 34.174 147.549 1.00 0.00 O ATOM 41202 H1 WAT 7881 131.603 33.810 147.400 1.00 0.00 H ATOM 41203 H2 WAT 7881 130.709 34.970 147.019 1.00 0.00 H TER 41205 WAT 7881 ATOM 41205 O WAT 7882 115.033 132.732 89.460 1.00 0.00 O ATOM 41206 H1 WAT 7882 115.303 132.882 90.366 1.00 0.00 H ATOM 41207 H2 WAT 7882 115.176 133.573 89.025 1.00 0.00 H TER 41209 WAT 7882 ATOM 41209 O WAT 7883 135.345 88.918 110.953 1.00 0.00 O ATOM 41210 H1 WAT 7883 135.432 89.800 110.591 1.00 0.00 H ATOM 41211 H2 WAT 7883 135.875 88.368 110.376 1.00 0.00 H TER 41213 WAT 7883 ATOM 41213 O WAT 7884 113.037 107.916 105.378 1.00 0.00 O ATOM 41214 H1 WAT 7884 113.433 108.112 104.529 1.00 0.00 H ATOM 41215 H2 WAT 7884 112.713 108.759 105.693 1.00 0.00 H TER 41217 WAT 7884 ATOM 41217 O WAT 7885 117.549 142.109 68.537 1.00 0.00 O ATOM 41218 H1 WAT 7885 118.114 141.583 69.104 1.00 0.00 H ATOM 41219 H2 WAT 7885 117.822 141.881 67.649 1.00 0.00 H TER 41221 WAT 7885 ATOM 41221 O WAT 7886 55.385 144.695 111.387 1.00 0.00 O ATOM 41222 H1 WAT 7886 56.196 144.195 111.470 1.00 0.00 H ATOM 41223 H2 WAT 7886 55.453 145.375 112.058 1.00 0.00 H TER 41225 WAT 7886 ATOM 41225 O WAT 7887 58.967 120.991 120.202 1.00 0.00 O ATOM 41226 H1 WAT 7887 59.815 120.931 119.764 1.00 0.00 H ATOM 41227 H2 WAT 7887 58.395 120.412 119.697 1.00 0.00 H TER 41229 WAT 7887 ATOM 41229 O WAT 7888 64.350 4.752 142.944 1.00 0.00 O ATOM 41230 H1 WAT 7888 65.165 4.461 143.354 1.00 0.00 H ATOM 41231 H2 WAT 7888 63.660 4.388 143.499 1.00 0.00 H TER 41233 WAT 7888 ATOM 41233 O WAT 7889 31.181 103.578 88.717 1.00 0.00 O ATOM 41234 H1 WAT 7889 31.929 102.992 88.833 1.00 0.00 H ATOM 41235 H2 WAT 7889 31.573 104.439 88.568 1.00 0.00 H TER 41237 WAT 7889 ATOM 41237 O WAT 7890 88.001 100.178 79.832 1.00 0.00 O ATOM 41238 H1 WAT 7890 88.424 99.485 80.339 1.00 0.00 H ATOM 41239 H2 WAT 7890 87.941 99.823 78.945 1.00 0.00 H TER 41241 WAT 7890 ATOM 41241 O WAT 7891 131.804 121.047 70.528 1.00 0.00 O ATOM 41242 H1 WAT 7891 131.717 120.658 69.657 1.00 0.00 H ATOM 41243 H2 WAT 7891 130.966 120.868 70.955 1.00 0.00 H TER 41245 WAT 7891 ATOM 41245 O WAT 7892 75.643 111.898 138.308 1.00 0.00 O ATOM 41246 H1 WAT 7892 75.722 112.090 139.242 1.00 0.00 H ATOM 41247 H2 WAT 7892 76.309 111.230 138.143 1.00 0.00 H TER 41249 WAT 7892 ATOM 41249 O WAT 7893 61.911 68.089 10.093 1.00 0.00 O ATOM 41250 H1 WAT 7893 62.164 67.758 10.954 1.00 0.00 H ATOM 41251 H2 WAT 7893 62.630 68.668 9.838 1.00 0.00 H TER 41253 WAT 7893 ATOM 41253 O WAT 7894 102.738 85.663 148.722 1.00 0.00 O ATOM 41254 H1 WAT 7894 103.267 85.342 149.452 1.00 0.00 H ATOM 41255 H2 WAT 7894 102.881 86.610 148.720 1.00 0.00 H TER 41257 WAT 7894 ATOM 41257 O WAT 7895 59.261 55.113 108.981 1.00 0.00 O ATOM 41258 H1 WAT 7895 59.650 54.498 108.359 1.00 0.00 H ATOM 41259 H2 WAT 7895 60.007 55.589 109.346 1.00 0.00 H TER 41261 WAT 7895 ATOM 41261 O WAT 7896 116.604 90.709 148.750 1.00 0.00 O ATOM 41262 H1 WAT 7896 116.221 90.347 147.951 1.00 0.00 H ATOM 41263 H2 WAT 7896 116.265 91.604 148.794 1.00 0.00 H TER 41265 WAT 7896 ATOM 41265 O WAT 7897 89.288 79.812 124.509 1.00 0.00 O ATOM 41266 H1 WAT 7897 89.502 79.944 125.433 1.00 0.00 H ATOM 41267 H2 WAT 7897 89.867 80.414 124.041 1.00 0.00 H TER 41269 WAT 7897 ATOM 41269 O WAT 7898 24.389 74.005 84.392 1.00 0.00 O ATOM 41270 H1 WAT 7898 24.174 74.788 83.886 1.00 0.00 H ATOM 41271 H2 WAT 7898 24.500 73.318 83.734 1.00 0.00 H TER 41273 WAT 7898 ATOM 41273 O WAT 7899 43.128 130.587 112.090 1.00 0.00 O ATOM 41274 H1 WAT 7899 43.747 131.309 111.976 1.00 0.00 H ATOM 41275 H2 WAT 7899 43.383 129.946 111.426 1.00 0.00 H TER 41277 WAT 7899 ATOM 41277 O WAT 7900 137.072 115.696 140.250 1.00 0.00 O ATOM 41278 H1 WAT 7900 136.407 115.063 140.521 1.00 0.00 H ATOM 41279 H2 WAT 7900 137.646 115.782 141.011 1.00 0.00 H TER 41281 WAT 7900 ATOM 41281 O WAT 7901 3.128 23.886 130.943 1.00 0.00 O ATOM 41282 H1 WAT 7901 2.571 23.475 131.604 1.00 0.00 H ATOM 41283 H2 WAT 7901 3.631 24.541 131.427 1.00 0.00 H TER 41285 WAT 7901 ATOM 41285 O WAT 7902 138.267 81.350 12.205 1.00 0.00 O ATOM 41286 H1 WAT 7902 138.615 81.939 11.537 1.00 0.00 H ATOM 41287 H2 WAT 7902 138.300 81.859 13.015 1.00 0.00 H TER 41289 WAT 7902 ATOM 41289 O WAT 7903 20.392 47.865 100.335 1.00 0.00 O ATOM 41290 H1 WAT 7903 20.489 47.343 101.132 1.00 0.00 H ATOM 41291 H2 WAT 7903 19.448 47.898 100.183 1.00 0.00 H TER 41293 WAT 7903 ATOM 41293 O WAT 7904 88.603 100.053 152.403 1.00 0.00 O ATOM 41294 H1 WAT 7904 88.295 99.275 152.868 1.00 0.00 H ATOM 41295 H2 WAT 7904 88.886 99.726 151.549 1.00 0.00 H TER 41297 WAT 7904 ATOM 41297 O WAT 7905 40.279 13.641 137.197 1.00 0.00 O ATOM 41298 H1 WAT 7905 39.681 13.682 136.451 1.00 0.00 H ATOM 41299 H2 WAT 7905 40.495 12.712 137.280 1.00 0.00 H TER 41301 WAT 7905 ATOM 41301 O WAT 7906 44.133 71.070 6.155 1.00 0.00 O ATOM 41302 H1 WAT 7906 43.565 71.698 6.602 1.00 0.00 H ATOM 41303 H2 WAT 7906 44.767 71.613 5.686 1.00 0.00 H TER 41305 WAT 7906 ATOM 41305 O WAT 7907 21.860 123.233 7.045 1.00 0.00 O ATOM 41306 H1 WAT 7907 22.634 122.672 7.016 1.00 0.00 H ATOM 41307 H2 WAT 7907 21.246 122.764 7.611 1.00 0.00 H TER 41309 WAT 7907 ATOM 41309 O WAT 7908 6.871 16.653 115.534 1.00 0.00 O ATOM 41310 H1 WAT 7908 7.212 16.055 114.869 1.00 0.00 H ATOM 41311 H2 WAT 7908 6.013 16.918 115.200 1.00 0.00 H TER 41313 WAT 7908 ATOM 41313 O WAT 7909 107.326 10.626 109.104 1.00 0.00 O ATOM 41314 H1 WAT 7909 107.251 10.419 110.036 1.00 0.00 H ATOM 41315 H2 WAT 7909 107.923 11.374 109.073 1.00 0.00 H TER 41317 WAT 7909 ATOM 41317 O WAT 7910 63.423 50.027 62.811 1.00 0.00 O ATOM 41318 H1 WAT 7910 63.374 49.309 63.442 1.00 0.00 H ATOM 41319 H2 WAT 7910 64.328 50.010 62.500 1.00 0.00 H TER 41321 WAT 7910 ATOM 41321 O WAT 7911 9.764 3.409 96.743 1.00 0.00 O ATOM 41322 H1 WAT 7911 10.461 3.161 96.135 1.00 0.00 H ATOM 41323 H2 WAT 7911 9.483 4.274 96.446 1.00 0.00 H TER 41325 WAT 7911 ATOM 41325 O WAT 7912 130.371 100.270 61.029 1.00 0.00 O ATOM 41326 H1 WAT 7912 130.703 100.149 60.139 1.00 0.00 H ATOM 41327 H2 WAT 7912 129.862 99.478 61.204 1.00 0.00 H TER 41329 WAT 7912 ATOM 41329 O WAT 7913 38.444 76.100 1.055 1.00 0.00 O ATOM 41330 H1 WAT 7913 38.572 76.671 0.297 1.00 0.00 H ATOM 41331 H2 WAT 7913 37.558 76.298 1.357 1.00 0.00 H TER 41333 WAT 7913 ATOM 41333 O WAT 7914 92.165 79.391 112.595 1.00 0.00 O ATOM 41334 H1 WAT 7914 91.427 79.713 113.113 1.00 0.00 H ATOM 41335 H2 WAT 7914 92.921 79.477 113.176 1.00 0.00 H TER 41337 WAT 7914 ATOM 41337 O WAT 7915 18.382 7.554 100.974 1.00 0.00 O ATOM 41338 H1 WAT 7915 18.005 8.375 100.657 1.00 0.00 H ATOM 41339 H2 WAT 7915 18.913 7.811 101.728 1.00 0.00 H TER 41341 WAT 7915 ATOM 41341 O WAT 7916 110.780 107.270 115.007 1.00 0.00 O ATOM 41342 H1 WAT 7916 110.873 108.201 114.802 1.00 0.00 H ATOM 41343 H2 WAT 7916 109.849 107.090 114.881 1.00 0.00 H TER 41345 WAT 7916 ATOM 41345 O WAT 7917 31.000 29.712 114.745 1.00 0.00 O ATOM 41346 H1 WAT 7917 30.559 29.118 114.137 1.00 0.00 H ATOM 41347 H2 WAT 7917 31.849 29.884 114.338 1.00 0.00 H TER 41349 WAT 7917 ATOM 41349 O WAT 7918 88.888 110.604 56.892 1.00 0.00 O ATOM 41350 H1 WAT 7918 88.879 111.017 56.029 1.00 0.00 H ATOM 41351 H2 WAT 7918 89.396 109.802 56.768 1.00 0.00 H TER 41353 WAT 7918 ATOM 41353 O WAT 7919 135.393 119.886 78.091 1.00 0.00 O ATOM 41354 H1 WAT 7919 135.083 118.980 78.109 1.00 0.00 H ATOM 41355 H2 WAT 7919 135.842 120.002 78.928 1.00 0.00 H TER 41357 WAT 7919 ATOM 41357 O WAT 7920 84.142 93.134 3.176 1.00 0.00 O ATOM 41358 H1 WAT 7920 83.567 92.423 3.460 1.00 0.00 H ATOM 41359 H2 WAT 7920 83.955 93.234 2.243 1.00 0.00 H TER 41361 WAT 7920 ATOM 41361 O WAT 7921 116.295 145.494 6.882 1.00 0.00 O ATOM 41362 H1 WAT 7921 116.916 144.785 6.710 1.00 0.00 H ATOM 41363 H2 WAT 7921 116.841 146.224 7.174 1.00 0.00 H TER 41365 WAT 7921 ATOM 41365 O WAT 7922 54.002 84.300 14.154 1.00 0.00 O ATOM 41366 H1 WAT 7922 54.887 83.977 13.984 1.00 0.00 H ATOM 41367 H2 WAT 7922 53.575 84.290 13.298 1.00 0.00 H TER 41369 WAT 7922 ATOM 41369 O WAT 7923 82.795 92.182 119.048 1.00 0.00 O ATOM 41370 H1 WAT 7923 83.097 92.016 118.155 1.00 0.00 H ATOM 41371 H2 WAT 7923 81.930 92.578 118.938 1.00 0.00 H TER 41373 WAT 7923 ATOM 41373 O WAT 7924 94.885 113.476 6.679 1.00 0.00 O ATOM 41374 H1 WAT 7924 94.738 113.751 7.584 1.00 0.00 H ATOM 41375 H2 WAT 7924 94.680 112.541 6.676 1.00 0.00 H TER 41377 WAT 7924 ATOM 41377 O WAT 7925 23.037 99.450 129.892 1.00 0.00 O ATOM 41378 H1 WAT 7925 23.497 100.275 130.047 1.00 0.00 H ATOM 41379 H2 WAT 7925 23.497 99.054 129.152 1.00 0.00 H TER 41381 WAT 7925 ATOM 41381 O WAT 7926 0.483 71.367 151.203 1.00 0.00 O ATOM 41382 H1 WAT 7926 -0.133 71.706 150.553 1.00 0.00 H ATOM 41383 H2 WAT 7926 0.029 71.469 152.040 1.00 0.00 H TER 41385 WAT 7926 ATOM 41385 O WAT 7927 144.547 77.171 85.572 1.00 0.00 O ATOM 41386 H1 WAT 7927 144.447 78.064 85.903 1.00 0.00 H ATOM 41387 H2 WAT 7927 145.282 76.812 86.069 1.00 0.00 H TER 41389 WAT 7927 ATOM 41389 O WAT 7928 52.107 20.140 24.622 1.00 0.00 O ATOM 41390 H1 WAT 7928 52.012 20.826 25.283 1.00 0.00 H ATOM 41391 H2 WAT 7928 51.208 19.920 24.375 1.00 0.00 H TER 41393 WAT 7928 ATOM 41393 O WAT 7929 141.120 43.341 68.007 1.00 0.00 O ATOM 41394 H1 WAT 7929 141.467 43.846 68.742 1.00 0.00 H ATOM 41395 H2 WAT 7929 140.637 43.981 67.484 1.00 0.00 H TER 41397 WAT 7929 ATOM 41397 O WAT 7930 37.375 28.609 59.647 1.00 0.00 O ATOM 41398 H1 WAT 7930 38.176 29.036 59.949 1.00 0.00 H ATOM 41399 H2 WAT 7930 36.909 28.377 60.451 1.00 0.00 H TER 41401 WAT 7930 ATOM 41401 O WAT 7931 55.658 105.151 120.444 1.00 0.00 O ATOM 41402 H1 WAT 7931 55.282 104.327 120.754 1.00 0.00 H ATOM 41403 H2 WAT 7931 54.921 105.617 120.049 1.00 0.00 H TER 41405 WAT 7931 ATOM 41405 O WAT 7932 20.091 138.708 67.576 1.00 0.00 O ATOM 41406 H1 WAT 7932 20.653 138.076 67.128 1.00 0.00 H ATOM 41407 H2 WAT 7932 20.221 138.528 68.507 1.00 0.00 H TER 41409 WAT 7932 ATOM 41409 O WAT 7933 80.631 48.853 61.518 1.00 0.00 O ATOM 41410 H1 WAT 7933 81.195 48.232 61.978 1.00 0.00 H ATOM 41411 H2 WAT 7933 79.879 48.970 62.099 1.00 0.00 H TER 41413 WAT 7933 ATOM 41413 O WAT 7934 106.836 21.089 133.693 1.00 0.00 O ATOM 41414 H1 WAT 7934 106.677 20.945 134.626 1.00 0.00 H ATOM 41415 H2 WAT 7934 106.823 20.212 133.310 1.00 0.00 H TER 41417 WAT 7934 ATOM 41417 O WAT 7935 71.618 74.108 63.215 1.00 0.00 O ATOM 41418 H1 WAT 7935 70.840 73.578 63.040 1.00 0.00 H ATOM 41419 H2 WAT 7935 71.647 74.737 62.494 1.00 0.00 H TER 41421 WAT 7935 ATOM 41421 O WAT 7936 103.351 43.317 4.200 1.00 0.00 O ATOM 41422 H1 WAT 7936 103.008 42.483 3.878 1.00 0.00 H ATOM 41423 H2 WAT 7936 104.076 43.071 4.775 1.00 0.00 H TER 41425 WAT 7936 ATOM 41425 O WAT 7937 131.618 115.721 157.838 1.00 0.00 O ATOM 41426 H1 WAT 7937 132.396 115.387 157.391 1.00 0.00 H ATOM 41427 H2 WAT 7937 131.940 116.453 158.364 1.00 0.00 H TER 41429 WAT 7937 ATOM 41429 O WAT 7938 131.638 64.158 1.230 1.00 0.00 O ATOM 41430 H1 WAT 7938 130.732 64.080 0.932 1.00 0.00 H ATOM 41431 H2 WAT 7938 131.945 63.255 1.302 1.00 0.00 H TER 41433 WAT 7938 ATOM 41433 O WAT 7939 54.700 72.951 134.723 1.00 0.00 O ATOM 41434 H1 WAT 7939 53.791 73.187 134.908 1.00 0.00 H ATOM 41435 H2 WAT 7939 54.664 72.505 133.877 1.00 0.00 H TER 41437 WAT 7939 ATOM 41437 O WAT 7940 59.921 129.474 3.096 1.00 0.00 O ATOM 41438 H1 WAT 7940 59.248 129.234 2.460 1.00 0.00 H ATOM 41439 H2 WAT 7940 60.628 129.848 2.569 1.00 0.00 H TER 41441 WAT 7940 ATOM 41441 O WAT 7941 36.855 40.227 141.582 1.00 0.00 O ATOM 41442 H1 WAT 7941 37.271 39.366 141.624 1.00 0.00 H ATOM 41443 H2 WAT 7941 37.571 40.846 141.729 1.00 0.00 H TER 41445 WAT 7941 ATOM 41445 O WAT 7942 39.816 85.651 118.672 1.00 0.00 O ATOM 41446 H1 WAT 7942 39.323 84.955 118.237 1.00 0.00 H ATOM 41447 H2 WAT 7942 39.766 85.435 119.603 1.00 0.00 H TER 41449 WAT 7942 ATOM 41449 O WAT 7943 88.642 96.725 131.798 1.00 0.00 O ATOM 41450 H1 WAT 7943 88.416 96.064 132.452 1.00 0.00 H ATOM 41451 H2 WAT 7943 88.013 97.432 131.945 1.00 0.00 H TER 41453 WAT 7943 ATOM 41453 O WAT 7944 139.757 4.979 114.556 1.00 0.00 O ATOM 41454 H1 WAT 7944 139.962 5.883 114.793 1.00 0.00 H ATOM 41455 H2 WAT 7944 139.963 4.473 115.342 1.00 0.00 H TER 41457 WAT 7944 ATOM 41457 O WAT 7945 116.352 78.249 105.313 1.00 0.00 O ATOM 41458 H1 WAT 7945 116.487 78.750 104.508 1.00 0.00 H ATOM 41459 H2 WAT 7945 116.810 77.422 105.159 1.00 0.00 H TER 41461 WAT 7945 ATOM 41461 O WAT 7946 92.952 47.899 140.043 1.00 0.00 O ATOM 41462 H1 WAT 7946 92.471 47.071 140.037 1.00 0.00 H ATOM 41463 H2 WAT 7946 92.492 48.448 139.408 1.00 0.00 H TER 41465 WAT 7946 ATOM 41465 O WAT 7947 8.707 3.543 110.945 1.00 0.00 O ATOM 41466 H1 WAT 7947 8.561 2.780 110.386 1.00 0.00 H ATOM 41467 H2 WAT 7947 7.918 3.599 111.484 1.00 0.00 H TER 41469 WAT 7947 ATOM 41469 O WAT 7948 144.863 72.113 137.558 1.00 0.00 O ATOM 41470 H1 WAT 7948 144.462 71.590 136.865 1.00 0.00 H ATOM 41471 H2 WAT 7948 144.754 71.586 138.350 1.00 0.00 H TER 41473 WAT 7948 ATOM 41473 O WAT 7949 54.284 115.898 5.368 1.00 0.00 O ATOM 41474 H1 WAT 7949 54.245 115.030 4.966 1.00 0.00 H ATOM 41475 H2 WAT 7949 55.093 115.889 5.879 1.00 0.00 H TER 41477 WAT 7949 ATOM 41477 O WAT 7950 59.051 41.289 62.942 1.00 0.00 O ATOM 41478 H1 WAT 7950 58.253 41.458 63.444 1.00 0.00 H ATOM 41479 H2 WAT 7950 58.749 41.196 62.038 1.00 0.00 H TER 41481 WAT 7950 ATOM 41481 O WAT 7951 80.076 140.453 157.383 1.00 0.00 O ATOM 41482 H1 WAT 7951 80.209 140.924 156.560 1.00 0.00 H ATOM 41483 H2 WAT 7951 79.514 141.029 157.900 1.00 0.00 H TER 41485 WAT 7951 ATOM 41485 O WAT 7952 92.104 65.047 81.061 1.00 0.00 O ATOM 41486 H1 WAT 7952 93.017 65.330 81.011 1.00 0.00 H ATOM 41487 H2 WAT 7952 91.772 65.449 81.864 1.00 0.00 H TER 41489 WAT 7952 ATOM 41489 O WAT 7953 10.292 111.254 128.322 1.00 0.00 O ATOM 41490 H1 WAT 7953 10.368 110.399 128.745 1.00 0.00 H ATOM 41491 H2 WAT 7953 10.776 111.159 127.502 1.00 0.00 H TER 41493 WAT 7953 ATOM 41493 O WAT 7954 137.829 49.186 82.959 1.00 0.00 O ATOM 41494 H1 WAT 7954 137.524 48.556 83.612 1.00 0.00 H ATOM 41495 H2 WAT 7954 137.029 49.499 82.537 1.00 0.00 H TER 41497 WAT 7954 ATOM 41497 O WAT 7955 82.213 63.067 77.234 1.00 0.00 O ATOM 41498 H1 WAT 7955 81.733 63.819 77.582 1.00 0.00 H ATOM 41499 H2 WAT 7955 81.852 62.937 76.357 1.00 0.00 H TER 41501 WAT 7955 ATOM 41501 O WAT 7956 119.340 18.939 66.747 1.00 0.00 O ATOM 41502 H1 WAT 7956 118.496 19.045 67.187 1.00 0.00 H ATOM 41503 H2 WAT 7956 119.466 17.992 66.696 1.00 0.00 H TER 41505 WAT 7956 ATOM 41505 O WAT 7957 100.949 79.949 5.786 1.00 0.00 O ATOM 41506 H1 WAT 7957 101.000 80.869 6.046 1.00 0.00 H ATOM 41507 H2 WAT 7957 101.492 79.489 6.426 1.00 0.00 H TER 41509 WAT 7957 ATOM 41509 O WAT 7958 42.698 104.818 17.011 1.00 0.00 O ATOM 41510 H1 WAT 7958 43.429 104.498 17.541 1.00 0.00 H ATOM 41511 H2 WAT 7958 41.935 104.742 17.584 1.00 0.00 H TER 41513 WAT 7958 ATOM 41513 O WAT 7959 95.086 31.075 95.403 1.00 0.00 O ATOM 41514 H1 WAT 7959 95.098 30.981 96.356 1.00 0.00 H ATOM 41515 H2 WAT 7959 95.874 30.619 95.107 1.00 0.00 H TER 41517 WAT 7959 ATOM 41517 O WAT 7960 82.974 62.792 132.766 1.00 0.00 O ATOM 41518 H1 WAT 7960 82.766 63.671 133.081 1.00 0.00 H ATOM 41519 H2 WAT 7960 83.931 62.767 132.740 1.00 0.00 H TER 41521 WAT 7960 ATOM 41521 O WAT 7961 104.940 92.240 73.699 1.00 0.00 O ATOM 41522 H1 WAT 7961 105.328 91.782 72.954 1.00 0.00 H ATOM 41523 H2 WAT 7961 104.847 91.566 74.373 1.00 0.00 H TER 41525 WAT 7961 ATOM 41525 O WAT 7962 109.438 73.773 85.540 1.00 0.00 O ATOM 41526 H1 WAT 7962 108.888 74.217 86.185 1.00 0.00 H ATOM 41527 H2 WAT 7962 109.503 74.392 84.813 1.00 0.00 H TER 41529 WAT 7962 ATOM 41529 O WAT 7963 47.862 143.069 142.641 1.00 0.00 O ATOM 41530 H1 WAT 7963 47.793 143.947 143.017 1.00 0.00 H ATOM 41531 H2 WAT 7963 46.964 142.739 142.638 1.00 0.00 H TER 41533 WAT 7963 ATOM 41533 O WAT 7964 125.299 5.613 5.635 1.00 0.00 O ATOM 41534 H1 WAT 7964 124.813 6.170 5.027 1.00 0.00 H ATOM 41535 H2 WAT 7964 125.456 4.805 5.146 1.00 0.00 H TER 41537 WAT 7964 ATOM 41537 O WAT 7965 42.897 97.091 72.961 1.00 0.00 O ATOM 41538 H1 WAT 7965 43.610 97.447 72.431 1.00 0.00 H ATOM 41539 H2 WAT 7965 42.544 96.373 72.436 1.00 0.00 H TER 41541 WAT 7965 ATOM 41541 O WAT 7966 106.137 64.354 129.811 1.00 0.00 O ATOM 41542 H1 WAT 7966 106.011 64.560 130.737 1.00 0.00 H ATOM 41543 H2 WAT 7966 105.913 63.426 129.739 1.00 0.00 H TER 41545 WAT 7966 ATOM 41545 O WAT 7967 27.598 68.438 129.896 1.00 0.00 O ATOM 41546 H1 WAT 7967 27.461 67.850 129.153 1.00 0.00 H ATOM 41547 H2 WAT 7967 26.850 69.034 129.872 1.00 0.00 H TER 41549 WAT 7967 ATOM 41549 O WAT 7968 0.836 45.074 121.338 1.00 0.00 O ATOM 41550 H1 WAT 7968 0.234 45.816 121.278 1.00 0.00 H ATOM 41551 H2 WAT 7968 1.619 45.434 121.753 1.00 0.00 H TER 41553 WAT 7968 ATOM 41553 O WAT 7969 7.869 91.838 125.745 1.00 0.00 O ATOM 41554 H1 WAT 7969 7.378 91.955 126.559 1.00 0.00 H ATOM 41555 H2 WAT 7969 7.998 92.727 125.414 1.00 0.00 H TER 41557 WAT 7969 ATOM 41557 O WAT 7970 31.613 27.210 23.228 1.00 0.00 O ATOM 41558 H1 WAT 7970 31.375 26.562 22.565 1.00 0.00 H ATOM 41559 H2 WAT 7970 31.126 27.996 22.981 1.00 0.00 H TER 41561 WAT 7970 ATOM 41561 O WAT 7971 43.593 98.139 58.881 1.00 0.00 O ATOM 41562 H1 WAT 7971 43.229 98.947 58.518 1.00 0.00 H ATOM 41563 H2 WAT 7971 44.487 98.370 59.131 1.00 0.00 H TER 41565 WAT 7971 ATOM 41565 O WAT 7972 86.083 66.591 148.115 1.00 0.00 O ATOM 41566 H1 WAT 7972 86.079 67.534 147.947 1.00 0.00 H ATOM 41567 H2 WAT 7972 86.988 66.324 147.957 1.00 0.00 H TER 41569 WAT 7972 ATOM 41569 O WAT 7973 127.701 27.926 84.445 1.00 0.00 O ATOM 41570 H1 WAT 7973 128.638 28.119 84.423 1.00 0.00 H ATOM 41571 H2 WAT 7973 127.302 28.619 83.919 1.00 0.00 H TER 41573 WAT 7973 ATOM 41573 O WAT 7974 12.903 116.670 26.777 1.00 0.00 O ATOM 41574 H1 WAT 7974 13.254 115.969 27.325 1.00 0.00 H ATOM 41575 H2 WAT 7974 11.959 116.513 26.760 1.00 0.00 H TER 41577 WAT 7974 ATOM 41577 O WAT 7975 56.757 43.816 129.967 1.00 0.00 O ATOM 41578 H1 WAT 7975 57.538 43.418 129.583 1.00 0.00 H ATOM 41579 H2 WAT 7975 57.097 44.461 130.588 1.00 0.00 H TER 41581 WAT 7975 ATOM 41581 O WAT 7976 135.514 98.236 87.869 1.00 0.00 O ATOM 41582 H1 WAT 7976 135.257 97.386 87.512 1.00 0.00 H ATOM 41583 H2 WAT 7976 135.776 98.048 88.770 1.00 0.00 H TER 41585 WAT 7976 ATOM 41585 O WAT 7977 5.209 83.415 113.300 1.00 0.00 O ATOM 41586 H1 WAT 7977 5.970 83.420 113.880 1.00 0.00 H ATOM 41587 H2 WAT 7977 4.577 83.991 113.730 1.00 0.00 H TER 41589 WAT 7977 ATOM 41589 O WAT 7978 129.715 99.930 89.532 1.00 0.00 O ATOM 41590 H1 WAT 7978 129.134 99.496 88.908 1.00 0.00 H ATOM 41591 H2 WAT 7978 130.252 99.224 89.892 1.00 0.00 H TER 41593 WAT 7978 ATOM 41593 O WAT 7979 3.568 140.052 21.714 1.00 0.00 O ATOM 41594 H1 WAT 7979 3.583 140.971 21.447 1.00 0.00 H ATOM 41595 H2 WAT 7979 2.773 139.969 22.241 1.00 0.00 H TER 41597 WAT 7979 ATOM 41597 O WAT 7980 124.087 126.306 15.347 1.00 0.00 O ATOM 41598 H1 WAT 7980 124.928 126.748 15.468 1.00 0.00 H ATOM 41599 H2 WAT 7980 124.078 125.621 16.016 1.00 0.00 H TER 41601 WAT 7980 ATOM 41601 O WAT 7981 97.105 102.127 152.341 1.00 0.00 O ATOM 41602 H1 WAT 7981 97.800 101.505 152.554 1.00 0.00 H ATOM 41603 H2 WAT 7981 97.566 102.946 152.158 1.00 0.00 H TER 41605 WAT 7981 ATOM 41605 O WAT 7982 115.640 79.774 155.879 1.00 0.00 O ATOM 41606 H1 WAT 7982 114.940 79.996 156.493 1.00 0.00 H ATOM 41607 H2 WAT 7982 115.360 80.156 155.048 1.00 0.00 H TER 41609 WAT 7982 ATOM 41609 O WAT 7983 44.645 37.193 118.098 1.00 0.00 O ATOM 41610 H1 WAT 7983 45.114 36.519 117.606 1.00 0.00 H ATOM 41611 H2 WAT 7983 44.368 37.825 117.434 1.00 0.00 H TER 41613 WAT 7983 ATOM 41613 O WAT 7984 137.638 82.207 108.362 1.00 0.00 O ATOM 41614 H1 WAT 7984 137.211 81.366 108.526 1.00 0.00 H ATOM 41615 H2 WAT 7984 137.297 82.785 109.044 1.00 0.00 H TER 41617 WAT 7984 ATOM 41617 O WAT 7985 123.497 100.675 24.778 1.00 0.00 O ATOM 41618 H1 WAT 7985 124.272 100.321 25.214 1.00 0.00 H ATOM 41619 H2 WAT 7985 122.786 100.088 25.037 1.00 0.00 H TER 41621 WAT 7985 ATOM 41621 O WAT 7986 105.499 45.007 96.544 1.00 0.00 O ATOM 41622 H1 WAT 7986 104.547 44.904 96.532 1.00 0.00 H ATOM 41623 H2 WAT 7986 105.736 44.932 97.468 1.00 0.00 H TER 41625 WAT 7986 ATOM 41625 O WAT 7987 38.300 99.834 143.517 1.00 0.00 O ATOM 41626 H1 WAT 7987 38.429 100.444 144.243 1.00 0.00 H ATOM 41627 H2 WAT 7987 38.737 100.250 142.774 1.00 0.00 H TER 41629 WAT 7987 ATOM 41629 O WAT 7988 70.479 123.574 62.249 1.00 0.00 O ATOM 41630 H1 WAT 7988 70.187 123.544 61.338 1.00 0.00 H ATOM 41631 H2 WAT 7988 69.699 123.830 62.742 1.00 0.00 H TER 41633 WAT 7988 ATOM 41633 O WAT 7989 62.933 79.582 135.929 1.00 0.00 O ATOM 41634 H1 WAT 7989 62.229 79.848 136.521 1.00 0.00 H ATOM 41635 H2 WAT 7989 62.481 79.251 135.152 1.00 0.00 H TER 41637 WAT 7989 ATOM 41637 O WAT 7990 108.136 76.611 109.897 1.00 0.00 O ATOM 41638 H1 WAT 7990 108.442 76.251 109.065 1.00 0.00 H ATOM 41639 H2 WAT 7990 107.204 76.778 109.757 1.00 0.00 H TER 41641 WAT 7990 ATOM 41641 O WAT 7991 68.876 1.715 94.623 1.00 0.00 O ATOM 41642 H1 WAT 7991 68.622 0.804 94.774 1.00 0.00 H ATOM 41643 H2 WAT 7991 69.758 1.781 94.988 1.00 0.00 H TER 41645 WAT 7991 ATOM 41645 O WAT 7992 70.153 29.010 91.977 1.00 0.00 O ATOM 41646 H1 WAT 7992 69.490 28.453 92.386 1.00 0.00 H ATOM 41647 H2 WAT 7992 70.923 28.917 92.539 1.00 0.00 H TER 41649 WAT 7992 ATOM 41649 O WAT 7993 143.883 132.032 137.092 1.00 0.00 O ATOM 41650 H1 WAT 7993 144.476 132.746 136.856 1.00 0.00 H ATOM 41651 H2 WAT 7993 144.129 131.314 136.509 1.00 0.00 H TER 41653 WAT 7993 ATOM 41653 O WAT 7994 82.214 141.537 145.052 1.00 0.00 O ATOM 41654 H1 WAT 7994 82.798 142.291 144.969 1.00 0.00 H ATOM 41655 H2 WAT 7994 82.107 141.217 144.156 1.00 0.00 H TER 41657 WAT 7994 ATOM 41657 O WAT 7995 143.443 77.208 112.470 1.00 0.00 O ATOM 41658 H1 WAT 7995 143.367 76.669 113.257 1.00 0.00 H ATOM 41659 H2 WAT 7995 144.385 77.268 112.311 1.00 0.00 H TER 41661 WAT 7995 ATOM 41661 O WAT 7996 59.244 68.021 120.612 1.00 0.00 O ATOM 41662 H1 WAT 7996 58.826 68.264 121.438 1.00 0.00 H ATOM 41663 H2 WAT 7996 59.880 67.348 120.854 1.00 0.00 H TER 41665 WAT 7996 ATOM 41665 O WAT 7997 81.094 48.118 82.326 1.00 0.00 O ATOM 41666 H1 WAT 7997 81.185 49.067 82.413 1.00 0.00 H ATOM 41667 H2 WAT 7997 81.993 47.793 82.290 1.00 0.00 H TER 41669 WAT 7997 ATOM 41669 O WAT 7998 116.789 99.443 19.159 1.00 0.00 O ATOM 41670 H1 WAT 7998 116.018 99.576 18.608 1.00 0.00 H ATOM 41671 H2 WAT 7998 116.798 98.502 19.335 1.00 0.00 H TER 41673 WAT 7998 ATOM 41673 O WAT 7999 3.132 59.332 74.416 1.00 0.00 O ATOM 41674 H1 WAT 7999 3.522 58.609 73.924 1.00 0.00 H ATOM 41675 H2 WAT 7999 2.838 59.947 73.744 1.00 0.00 H TER 41677 WAT 7999 ATOM 41677 O WAT 8000 15.115 100.355 75.811 1.00 0.00 O ATOM 41678 H1 WAT 8000 14.747 99.511 76.074 1.00 0.00 H ATOM 41679 H2 WAT 8000 14.352 100.894 75.603 1.00 0.00 H TER 41681 WAT 8000 ATOM 41681 O WAT 8001 90.677 106.113 74.047 1.00 0.00 O ATOM 41682 H1 WAT 8001 91.493 106.359 73.611 1.00 0.00 H ATOM 41683 H2 WAT 8001 89.996 106.287 73.397 1.00 0.00 H TER 41685 WAT 8001 ATOM 41685 O WAT 8002 139.394 54.073 27.481 1.00 0.00 O ATOM 41686 H1 WAT 8002 138.512 53.721 27.362 1.00 0.00 H ATOM 41687 H2 WAT 8002 139.965 53.440 27.045 1.00 0.00 H TER 41689 WAT 8002 ATOM 41689 O WAT 8003 69.957 23.035 103.192 1.00 0.00 O ATOM 41690 H1 WAT 8003 69.595 22.829 102.330 1.00 0.00 H ATOM 41691 H2 WAT 8003 70.895 23.149 103.037 1.00 0.00 H TER 41693 WAT 8003 ATOM 41693 O WAT 8004 140.816 109.659 83.387 1.00 0.00 O ATOM 41694 H1 WAT 8004 140.629 109.947 82.493 1.00 0.00 H ATOM 41695 H2 WAT 8004 140.948 108.714 83.311 1.00 0.00 H TER 41697 WAT 8004 ATOM 41697 O WAT 8005 99.063 12.657 157.369 1.00 0.00 O ATOM 41698 H1 WAT 8005 99.231 13.598 157.340 1.00 0.00 H ATOM 41699 H2 WAT 8005 98.644 12.514 158.218 1.00 0.00 H TER 41701 WAT 8005 ATOM 41701 O WAT 8006 84.105 55.302 97.497 1.00 0.00 O ATOM 41702 H1 WAT 8006 83.867 54.691 96.800 1.00 0.00 H ATOM 41703 H2 WAT 8006 83.267 55.622 97.832 1.00 0.00 H TER 41705 WAT 8006 ATOM 41705 O WAT 8007 95.644 94.271 128.013 1.00 0.00 O ATOM 41706 H1 WAT 8007 95.311 95.130 128.274 1.00 0.00 H ATOM 41707 H2 WAT 8007 96.178 94.447 127.238 1.00 0.00 H TER 41709 WAT 8007 ATOM 41709 O WAT 8008 35.091 72.486 77.786 1.00 0.00 O ATOM 41710 H1 WAT 8008 35.754 73.175 77.806 1.00 0.00 H ATOM 41711 H2 WAT 8008 34.268 72.950 77.633 1.00 0.00 H TER 41713 WAT 8008 ATOM 41713 O WAT 8009 61.538 10.959 60.382 1.00 0.00 O ATOM 41714 H1 WAT 8009 62.364 11.233 60.781 1.00 0.00 H ATOM 41715 H2 WAT 8009 61.167 10.335 61.005 1.00 0.00 H TER 41717 WAT 8009 ATOM 41717 O WAT 8010 69.957 57.903 21.531 1.00 0.00 O ATOM 41718 H1 WAT 8010 70.221 58.510 20.840 1.00 0.00 H ATOM 41719 H2 WAT 8010 69.152 58.280 21.886 1.00 0.00 H TER 41721 WAT 8010 ATOM 41721 O WAT 8011 70.298 6.014 148.488 1.00 0.00 O ATOM 41722 H1 WAT 8011 70.219 5.810 147.557 1.00 0.00 H ATOM 41723 H2 WAT 8011 70.911 5.360 148.825 1.00 0.00 H TER 41725 WAT 8011 ATOM 41725 O WAT 8012 116.945 98.270 69.313 1.00 0.00 O ATOM 41726 H1 WAT 8012 117.779 97.861 69.545 1.00 0.00 H ATOM 41727 H2 WAT 8012 117.085 98.618 68.433 1.00 0.00 H TER 41729 WAT 8012 ATOM 41729 O WAT 8013 15.232 7.684 3.510 1.00 0.00 O ATOM 41730 H1 WAT 8013 16.144 7.442 3.672 1.00 0.00 H ATOM 41731 H2 WAT 8013 14.764 7.395 4.294 1.00 0.00 H TER 41733 WAT 8013 ATOM 41733 O WAT 8014 131.373 127.106 128.117 1.00 0.00 O ATOM 41734 H1 WAT 8014 131.062 127.105 127.212 1.00 0.00 H ATOM 41735 H2 WAT 8014 131.995 126.380 128.158 1.00 0.00 H TER 41737 WAT 8014 ATOM 41737 O WAT 8015 79.657 118.815 4.471 1.00 0.00 O ATOM 41738 H1 WAT 8015 79.234 118.250 5.118 1.00 0.00 H ATOM 41739 H2 WAT 8015 79.699 119.673 4.893 1.00 0.00 H TER 41741 WAT 8015 ATOM 41741 O WAT 8016 8.373 28.805 93.292 1.00 0.00 O ATOM 41742 H1 WAT 8016 8.647 27.938 93.592 1.00 0.00 H ATOM 41743 H2 WAT 8016 8.506 29.374 94.050 1.00 0.00 H TER 41745 WAT 8016 ATOM 41745 O WAT 8017 58.100 140.307 119.627 1.00 0.00 O ATOM 41746 H1 WAT 8017 58.118 139.857 118.782 1.00 0.00 H ATOM 41747 H2 WAT 8017 57.176 140.513 119.769 1.00 0.00 H TER 41749 WAT 8017 ATOM 41749 O WAT 8018 68.803 75.342 93.604 1.00 0.00 O ATOM 41750 H1 WAT 8018 68.910 75.817 92.780 1.00 0.00 H ATOM 41751 H2 WAT 8018 67.919 74.977 93.556 1.00 0.00 H TER 41753 WAT 8018 ATOM 41753 O WAT 8019 115.633 11.015 122.556 1.00 0.00 O ATOM 41754 H1 WAT 8019 116.009 11.377 123.358 1.00 0.00 H ATOM 41755 H2 WAT 8019 115.999 11.555 121.855 1.00 0.00 H TER 41757 WAT 8019 ATOM 41757 O WAT 8020 6.558 131.770 115.049 1.00 0.00 O ATOM 41758 H1 WAT 8020 5.778 131.590 115.575 1.00 0.00 H ATOM 41759 H2 WAT 8020 7.271 131.346 115.526 1.00 0.00 H TER 41761 WAT 8020 ATOM 41761 O WAT 8021 96.304 108.288 145.556 1.00 0.00 O ATOM 41762 H1 WAT 8021 96.141 107.668 144.845 1.00 0.00 H ATOM 41763 H2 WAT 8021 97.074 108.780 145.272 1.00 0.00 H TER 41765 WAT 8021 ATOM 41765 O WAT 8022 120.108 70.055 86.308 1.00 0.00 O ATOM 41766 H1 WAT 8022 120.696 69.613 85.696 1.00 0.00 H ATOM 41767 H2 WAT 8022 119.749 69.351 86.847 1.00 0.00 H TER 41769 WAT 8022 ATOM 41769 O WAT 8023 114.431 85.996 102.982 1.00 0.00 O ATOM 41770 H1 WAT 8023 113.826 85.300 103.241 1.00 0.00 H ATOM 41771 H2 WAT 8023 114.198 86.736 103.543 1.00 0.00 H TER 41773 WAT 8023 ATOM 41773 O WAT 8024 116.790 131.155 17.166 1.00 0.00 O ATOM 41774 H1 WAT 8024 115.992 130.794 16.780 1.00 0.00 H ATOM 41775 H2 WAT 8024 117.480 130.546 16.902 1.00 0.00 H TER 41777 WAT 8024 ATOM 41777 O WAT 8025 65.454 8.436 130.451 1.00 0.00 O ATOM 41778 H1 WAT 8025 65.291 7.666 130.995 1.00 0.00 H ATOM 41779 H2 WAT 8025 66.282 8.788 130.777 1.00 0.00 H TER 41781 WAT 8025 ATOM 41781 O WAT 8026 99.999 113.279 116.818 1.00 0.00 O ATOM 41782 H1 WAT 8026 100.361 112.554 117.328 1.00 0.00 H ATOM 41783 H2 WAT 8026 99.051 113.187 116.910 1.00 0.00 H TER 41785 WAT 8026 ATOM 41785 O WAT 8027 128.057 141.816 96.901 1.00 0.00 O ATOM 41786 H1 WAT 8027 128.317 140.925 96.666 1.00 0.00 H ATOM 41787 H2 WAT 8027 127.112 141.760 97.044 1.00 0.00 H TER 41789 WAT 8027 ATOM 41789 O WAT 8028 143.556 32.272 64.994 1.00 0.00 O ATOM 41790 H1 WAT 8028 143.050 31.524 65.309 1.00 0.00 H ATOM 41791 H2 WAT 8028 143.682 32.100 64.061 1.00 0.00 H TER 41793 WAT 8028 ATOM 41793 O WAT 8029 71.837 88.484 85.142 1.00 0.00 O ATOM 41794 H1 WAT 8029 71.907 89.424 84.975 1.00 0.00 H ATOM 41795 H2 WAT 8029 72.688 88.241 85.505 1.00 0.00 H TER 41797 WAT 8029 ATOM 41797 O WAT 8030 80.986 89.007 115.509 1.00 0.00 O ATOM 41798 H1 WAT 8030 81.295 89.746 114.984 1.00 0.00 H ATOM 41799 H2 WAT 8030 81.165 89.266 116.413 1.00 0.00 H TER 41801 WAT 8030 ATOM 41801 O WAT 8031 113.906 108.880 119.942 1.00 0.00 O ATOM 41802 H1 WAT 8031 114.604 108.454 120.440 1.00 0.00 H ATOM 41803 H2 WAT 8031 114.298 109.063 119.088 1.00 0.00 H TER 41805 WAT 8031 ATOM 41805 O WAT 8032 74.456 50.729 150.729 1.00 0.00 O ATOM 41806 H1 WAT 8032 74.854 50.922 149.880 1.00 0.00 H ATOM 41807 H2 WAT 8032 74.563 51.536 151.232 1.00 0.00 H TER 41809 WAT 8032 ATOM 41809 O WAT 8033 52.746 30.461 3.298 1.00 0.00 O ATOM 41810 H1 WAT 8033 53.496 30.960 2.974 1.00 0.00 H ATOM 41811 H2 WAT 8033 53.134 29.751 3.809 1.00 0.00 H TER 41813 WAT 8033 ATOM 41813 O WAT 8034 16.374 61.013 149.805 1.00 0.00 O ATOM 41814 H1 WAT 8034 16.510 61.564 150.576 1.00 0.00 H ATOM 41815 H2 WAT 8034 16.664 61.553 149.071 1.00 0.00 H TER 41817 WAT 8034 ATOM 41817 O WAT 8035 42.430 41.192 81.532 1.00 0.00 O ATOM 41818 H1 WAT 8035 41.566 41.406 81.884 1.00 0.00 H ATOM 41819 H2 WAT 8035 42.258 40.536 80.857 1.00 0.00 H TER 41821 WAT 8035 ATOM 41821 O WAT 8036 142.387 70.929 82.141 1.00 0.00 O ATOM 41822 H1 WAT 8036 142.284 71.228 81.238 1.00 0.00 H ATOM 41823 H2 WAT 8036 143.325 71.005 82.313 1.00 0.00 H TER 41825 WAT 8036 ATOM 41825 O WAT 8037 101.503 74.762 100.057 1.00 0.00 O ATOM 41826 H1 WAT 8037 101.128 74.150 100.690 1.00 0.00 H ATOM 41827 H2 WAT 8037 102.350 75.005 100.431 1.00 0.00 H TER 41829 WAT 8037 ATOM 41829 O WAT 8038 1.886 31.697 126.439 1.00 0.00 O ATOM 41830 H1 WAT 8038 1.435 32.052 125.673 1.00 0.00 H ATOM 41831 H2 WAT 8038 1.563 32.222 127.172 1.00 0.00 H TER 41833 WAT 8038 ATOM 41833 O WAT 8039 3.947 37.415 88.783 1.00 0.00 O ATOM 41834 H1 WAT 8039 3.105 37.195 88.384 1.00 0.00 H ATOM 41835 H2 WAT 8039 4.553 37.477 88.044 1.00 0.00 H TER 41837 WAT 8039 ATOM 41837 O WAT 8040 113.975 22.975 0.544 1.00 0.00 O ATOM 41838 H1 WAT 8040 114.509 22.924 -0.248 1.00 0.00 H ATOM 41839 H2 WAT 8040 114.526 23.438 1.175 1.00 0.00 H TER 41841 WAT 8040 ATOM 41841 O WAT 8041 63.330 61.260 98.681 1.00 0.00 O ATOM 41842 H1 WAT 8041 62.485 61.674 98.861 1.00 0.00 H ATOM 41843 H2 WAT 8041 63.204 60.811 97.845 1.00 0.00 H TER 41845 WAT 8041 ATOM 41845 O WAT 8042 36.034 124.609 71.892 1.00 0.00 O ATOM 41846 H1 WAT 8042 35.544 124.357 71.109 1.00 0.00 H ATOM 41847 H2 WAT 8042 35.367 124.931 72.498 1.00 0.00 H TER 41849 WAT 8042 ATOM 41849 O WAT 8043 43.142 109.656 140.498 1.00 0.00 O ATOM 41850 H1 WAT 8043 43.110 110.613 140.474 1.00 0.00 H ATOM 41851 H2 WAT 8043 43.071 109.391 139.581 1.00 0.00 H TER 41853 WAT 8043 ATOM 41853 O WAT 8044 37.292 74.329 126.382 1.00 0.00 O ATOM 41854 H1 WAT 8044 36.692 73.759 125.902 1.00 0.00 H ATOM 41855 H2 WAT 8044 38.090 73.810 126.479 1.00 0.00 H TER 41857 WAT 8044 ATOM 41857 O WAT 8045 3.598 2.935 65.861 1.00 0.00 O ATOM 41858 H1 WAT 8045 4.012 3.129 65.020 1.00 0.00 H ATOM 41859 H2 WAT 8045 4.162 3.358 66.508 1.00 0.00 H TER 41861 WAT 8045 ATOM 41861 O WAT 8046 130.332 87.968 117.288 1.00 0.00 O ATOM 41862 H1 WAT 8046 130.308 87.804 116.345 1.00 0.00 H ATOM 41863 H2 WAT 8046 130.590 87.129 117.670 1.00 0.00 H TER 41865 WAT 8046 ATOM 41865 O WAT 8047 145.291 84.682 157.723 1.00 0.00 O ATOM 41866 H1 WAT 8047 144.441 85.082 157.538 1.00 0.00 H ATOM 41867 H2 WAT 8047 145.522 84.226 156.913 1.00 0.00 H TER 41869 WAT 8047 ATOM 41869 O WAT 8048 124.728 138.594 137.020 1.00 0.00 O ATOM 41870 H1 WAT 8048 125.605 138.877 136.764 1.00 0.00 H ATOM 41871 H2 WAT 8048 124.878 137.869 137.627 1.00 0.00 H TER 41873 WAT 8048 ATOM 41873 O WAT 8049 113.060 122.623 98.772 1.00 0.00 O ATOM 41874 H1 WAT 8049 112.308 122.882 99.305 1.00 0.00 H ATOM 41875 H2 WAT 8049 112.924 121.690 98.604 1.00 0.00 H TER 41877 WAT 8049 ATOM 41877 O WAT 8050 137.692 8.760 72.305 1.00 0.00 O ATOM 41878 H1 WAT 8050 137.663 7.828 72.088 1.00 0.00 H ATOM 41879 H2 WAT 8050 138.604 8.921 72.547 1.00 0.00 H TER 41881 WAT 8050 ATOM 41881 O WAT 8051 88.175 87.628 22.434 1.00 0.00 O ATOM 41882 H1 WAT 8051 87.660 87.328 23.183 1.00 0.00 H ATOM 41883 H2 WAT 8051 88.930 88.069 22.823 1.00 0.00 H TER 41885 WAT 8051 ATOM 41885 O WAT 8052 127.857 10.254 154.388 1.00 0.00 O ATOM 41886 H1 WAT 8052 127.754 11.078 153.912 1.00 0.00 H ATOM 41887 H2 WAT 8052 127.538 10.445 155.270 1.00 0.00 H TER 41889 WAT 8052 ATOM 41889 O WAT 8053 24.586 95.688 23.729 1.00 0.00 O ATOM 41890 H1 WAT 8053 24.913 95.799 22.836 1.00 0.00 H ATOM 41891 H2 WAT 8053 24.799 96.512 24.166 1.00 0.00 H TER 41893 WAT 8053 ATOM 41893 O WAT 8054 110.444 118.972 146.952 1.00 0.00 O ATOM 41894 H1 WAT 8054 110.549 118.023 147.021 1.00 0.00 H ATOM 41895 H2 WAT 8054 109.542 119.135 147.230 1.00 0.00 H TER 41897 WAT 8054 ATOM 41897 O WAT 8055 12.657 35.114 15.279 1.00 0.00 O ATOM 41898 H1 WAT 8055 13.504 34.971 15.701 1.00 0.00 H ATOM 41899 H2 WAT 8055 12.024 34.697 15.863 1.00 0.00 H TER 41901 WAT 8055 ATOM 41901 O WAT 8056 81.446 100.129 82.896 1.00 0.00 O ATOM 41902 H1 WAT 8056 81.123 99.288 83.219 1.00 0.00 H ATOM 41903 H2 WAT 8056 81.987 100.468 83.608 1.00 0.00 H TER 41905 WAT 8056 ATOM 41905 O WAT 8057 106.755 53.564 91.790 1.00 0.00 O ATOM 41906 H1 WAT 8057 107.340 52.863 91.503 1.00 0.00 H ATOM 41907 H2 WAT 8057 106.664 54.128 91.023 1.00 0.00 H TER 41909 WAT 8057 ATOM 41909 O WAT 8058 49.706 105.433 95.426 1.00 0.00 O ATOM 41910 H1 WAT 8058 49.927 105.060 94.572 1.00 0.00 H ATOM 41911 H2 WAT 8058 49.031 104.851 95.775 1.00 0.00 H TER 41913 WAT 8058 ATOM 41913 O WAT 8059 101.659 139.703 101.941 1.00 0.00 O ATOM 41914 H1 WAT 8059 102.506 139.575 101.516 1.00 0.00 H ATOM 41915 H2 WAT 8059 101.814 139.473 102.857 1.00 0.00 H TER 41917 WAT 8059 ATOM 41917 O WAT 8060 134.061 25.503 137.572 1.00 0.00 O ATOM 41918 H1 WAT 8060 133.228 25.638 137.120 1.00 0.00 H ATOM 41919 H2 WAT 8060 134.031 26.108 138.314 1.00 0.00 H TER 41921 WAT 8060 ATOM 41921 O WAT 8061 101.817 32.674 145.867 1.00 0.00 O ATOM 41922 H1 WAT 8061 102.334 33.451 146.077 1.00 0.00 H ATOM 41923 H2 WAT 8061 102.282 31.954 146.293 1.00 0.00 H TER 41925 WAT 8061 ATOM 41925 O WAT 8062 135.595 60.570 127.645 1.00 0.00 O ATOM 41926 H1 WAT 8062 135.384 60.641 128.576 1.00 0.00 H ATOM 41927 H2 WAT 8062 134.759 60.373 127.224 1.00 0.00 H TER 41929 WAT 8062 ATOM 41929 O WAT 8063 106.139 120.789 125.959 1.00 0.00 O ATOM 41930 H1 WAT 8063 107.022 121.133 125.828 1.00 0.00 H ATOM 41931 H2 WAT 8063 106.071 120.062 125.340 1.00 0.00 H TER 41933 WAT 8063 ATOM 41933 O WAT 8064 130.639 0.758 71.031 1.00 0.00 O ATOM 41934 H1 WAT 8064 131.171 1.144 70.335 1.00 0.00 H ATOM 41935 H2 WAT 8064 131.011 -0.114 71.162 1.00 0.00 H TER 41937 WAT 8064 ATOM 41937 O WAT 8065 72.515 68.949 14.806 1.00 0.00 O ATOM 41938 H1 WAT 8065 71.632 68.751 15.120 1.00 0.00 H ATOM 41939 H2 WAT 8065 72.625 68.392 14.036 1.00 0.00 H TER 41941 WAT 8065 ATOM 41941 O WAT 8066 84.256 71.117 116.838 1.00 0.00 O ATOM 41942 H1 WAT 8066 84.212 70.652 116.002 1.00 0.00 H ATOM 41943 H2 WAT 8066 84.394 70.428 117.488 1.00 0.00 H TER 41945 WAT 8066 ATOM 41945 O WAT 8067 100.579 35.528 25.539 1.00 0.00 O ATOM 41946 H1 WAT 8067 101.306 36.142 25.643 1.00 0.00 H ATOM 41947 H2 WAT 8067 100.985 34.730 25.202 1.00 0.00 H TER 41949 WAT 8067 ATOM 41949 O WAT 8068 115.715 44.585 63.984 1.00 0.00 O ATOM 41950 H1 WAT 8068 116.250 44.644 63.192 1.00 0.00 H ATOM 41951 H2 WAT 8068 114.963 45.150 63.808 1.00 0.00 H TER 41953 WAT 8068 ATOM 41953 O WAT 8069 98.438 11.742 95.954 1.00 0.00 O ATOM 41954 H1 WAT 8069 99.001 11.872 96.717 1.00 0.00 H ATOM 41955 H2 WAT 8069 98.647 12.473 95.374 1.00 0.00 H TER 41957 WAT 8069 ATOM 41957 O WAT 8070 5.769 34.536 155.356 1.00 0.00 O ATOM 41958 H1 WAT 8070 5.082 35.110 155.016 1.00 0.00 H ATOM 41959 H2 WAT 8070 6.566 35.065 155.315 1.00 0.00 H TER 41961 WAT 8070 ATOM 41961 O WAT 8071 85.628 103.209 147.782 1.00 0.00 O ATOM 41962 H1 WAT 8071 85.794 103.195 148.725 1.00 0.00 H ATOM 41963 H2 WAT 8071 84.841 102.676 147.669 1.00 0.00 H TER 41965 WAT 8071 ATOM 41965 O WAT 8072 92.978 77.467 75.358 1.00 0.00 O ATOM 41966 H1 WAT 8072 92.890 77.009 76.193 1.00 0.00 H ATOM 41967 H2 WAT 8072 93.788 77.970 75.444 1.00 0.00 H TER 41969 WAT 8072 ATOM 41969 O WAT 8073 64.111 55.568 133.163 1.00 0.00 O ATOM 41970 H1 WAT 8073 64.320 54.652 133.347 1.00 0.00 H ATOM 41971 H2 WAT 8073 64.677 55.798 132.426 1.00 0.00 H TER 41973 WAT 8073 ATOM 41973 O WAT 8074 129.782 47.043 134.309 1.00 0.00 O ATOM 41974 H1 WAT 8074 130.438 47.390 133.704 1.00 0.00 H ATOM 41975 H2 WAT 8074 129.171 46.563 133.749 1.00 0.00 H TER 41977 WAT 8074 ATOM 41977 O WAT 8075 37.583 74.688 135.722 1.00 0.00 O ATOM 41978 H1 WAT 8075 37.446 73.920 136.276 1.00 0.00 H ATOM 41979 H2 WAT 8075 36.722 74.865 135.342 1.00 0.00 H TER 41981 WAT 8075 ATOM 41981 O WAT 8076 54.693 18.057 78.497 1.00 0.00 O ATOM 41982 H1 WAT 8076 54.836 18.532 77.679 1.00 0.00 H ATOM 41983 H2 WAT 8076 55.129 17.215 78.365 1.00 0.00 H TER 41985 WAT 8076 ATOM 41985 O WAT 8077 124.576 54.914 144.710 1.00 0.00 O ATOM 41986 H1 WAT 8077 123.966 55.284 145.348 1.00 0.00 H ATOM 41987 H2 WAT 8077 125.365 54.723 145.216 1.00 0.00 H TER 41989 WAT 8077 ATOM 41989 O WAT 8078 40.232 139.220 116.041 1.00 0.00 O ATOM 41990 H1 WAT 8078 39.429 138.728 116.213 1.00 0.00 H ATOM 41991 H2 WAT 8078 40.920 138.555 116.018 1.00 0.00 H TER 41993 WAT 8078 ATOM 41993 O WAT 8079 106.561 17.377 116.403 1.00 0.00 O ATOM 41994 H1 WAT 8079 106.825 16.589 115.927 1.00 0.00 H ATOM 41995 H2 WAT 8079 107.367 17.887 116.488 1.00 0.00 H TER 41997 WAT 8079 ATOM 41997 O WAT 8080 11.311 136.620 129.246 1.00 0.00 O ATOM 41998 H1 WAT 8080 11.503 135.774 129.650 1.00 0.00 H ATOM 41999 H2 WAT 8080 11.497 137.261 129.932 1.00 0.00 H TER 42001 WAT 8080 ATOM 42001 O WAT 8081 113.465 77.857 1.437 1.00 0.00 O ATOM 42002 H1 WAT 8081 113.411 77.506 2.326 1.00 0.00 H ATOM 42003 H2 WAT 8081 112.651 78.347 1.323 1.00 0.00 H TER 42005 WAT 8081 ATOM 42005 O WAT 8082 45.024 127.510 106.477 1.00 0.00 O ATOM 42006 H1 WAT 8082 44.171 127.148 106.718 1.00 0.00 H ATOM 42007 H2 WAT 8082 44.827 128.159 105.801 1.00 0.00 H TER 42009 WAT 8082 ATOM 42009 O WAT 8083 72.140 93.356 4.938 1.00 0.00 O ATOM 42010 H1 WAT 8083 71.746 92.485 4.989 1.00 0.00 H ATOM 42011 H2 WAT 8083 71.602 93.897 5.515 1.00 0.00 H TER 42013 WAT 8083 ATOM 42013 O WAT 8084 111.216 53.420 89.428 1.00 0.00 O ATOM 42014 H1 WAT 8084 111.593 53.922 88.706 1.00 0.00 H ATOM 42015 H2 WAT 8084 110.860 52.634 89.013 1.00 0.00 H TER 42017 WAT 8084 ATOM 42017 O WAT 8085 8.377 91.996 19.911 1.00 0.00 O ATOM 42018 H1 WAT 8085 8.549 91.199 19.410 1.00 0.00 H ATOM 42019 H2 WAT 8085 7.706 91.742 20.544 1.00 0.00 H TER 42021 WAT 8085 ATOM 42021 O WAT 8086 132.693 43.070 120.603 1.00 0.00 O ATOM 42022 H1 WAT 8086 132.525 43.456 121.462 1.00 0.00 H ATOM 42023 H2 WAT 8086 133.635 42.898 120.598 1.00 0.00 H TER 42025 WAT 8086 ATOM 42025 O WAT 8087 14.551 103.413 117.890 1.00 0.00 O ATOM 42026 H1 WAT 8087 14.117 102.621 118.205 1.00 0.00 H ATOM 42027 H2 WAT 8087 15.344 103.480 118.421 1.00 0.00 H TER 42029 WAT 8087 ATOM 42029 O WAT 8088 42.809 36.507 137.936 1.00 0.00 O ATOM 42030 H1 WAT 8088 43.349 36.247 138.683 1.00 0.00 H ATOM 42031 H2 WAT 8088 43.351 36.316 137.171 1.00 0.00 H TER 42033 WAT 8088 ATOM 42033 O WAT 8089 69.050 11.122 108.322 1.00 0.00 O ATOM 42034 H1 WAT 8089 69.278 10.896 107.420 1.00 0.00 H ATOM 42035 H2 WAT 8089 68.094 11.099 108.341 1.00 0.00 H TER 42037 WAT 8089 ATOM 42037 O WAT 8090 121.463 20.802 87.761 1.00 0.00 O ATOM 42038 H1 WAT 8090 120.593 20.587 88.097 1.00 0.00 H ATOM 42039 H2 WAT 8090 121.937 19.970 87.773 1.00 0.00 H TER 42041 WAT 8090 ATOM 42041 O WAT 8091 105.991 58.331 134.981 1.00 0.00 O ATOM 42042 H1 WAT 8091 106.613 57.920 134.380 1.00 0.00 H ATOM 42043 H2 WAT 8091 106.064 57.820 135.787 1.00 0.00 H TER 42045 WAT 8091 ATOM 42045 O WAT 8092 109.597 107.644 90.532 1.00 0.00 O ATOM 42046 H1 WAT 8092 110.357 108.148 90.824 1.00 0.00 H ATOM 42047 H2 WAT 8092 109.455 107.927 89.629 1.00 0.00 H TER 42049 WAT 8092 ATOM 42049 O WAT 8093 70.183 77.461 -0.028 1.00 0.00 O ATOM 42050 H1 WAT 8093 70.668 77.553 0.792 1.00 0.00 H ATOM 42051 H2 WAT 8093 70.295 76.542 -0.270 1.00 0.00 H TER 42053 WAT 8093 ATOM 42053 O WAT 8094 83.252 28.995 71.739 1.00 0.00 O ATOM 42054 H1 WAT 8094 82.483 29.023 72.309 1.00 0.00 H ATOM 42055 H2 WAT 8094 83.746 29.783 71.965 1.00 0.00 H TER 42057 WAT 8094 ATOM 42057 O WAT 8095 128.734 37.957 142.964 1.00 0.00 O ATOM 42058 H1 WAT 8095 129.064 38.586 143.606 1.00 0.00 H ATOM 42059 H2 WAT 8095 127.855 38.270 142.751 1.00 0.00 H TER 42061 WAT 8095 ATOM 42061 O WAT 8096 109.458 91.844 79.695 1.00 0.00 O ATOM 42062 H1 WAT 8096 108.844 91.129 79.528 1.00 0.00 H ATOM 42063 H2 WAT 8096 110.168 91.701 79.069 1.00 0.00 H TER 42065 WAT 8096 ATOM 42065 O WAT 8097 134.802 66.781 103.820 1.00 0.00 O ATOM 42066 H1 WAT 8097 134.790 65.886 104.158 1.00 0.00 H ATOM 42067 H2 WAT 8097 133.898 67.083 103.910 1.00 0.00 H TER 42069 WAT 8097 ATOM 42069 O WAT 8098 130.808 6.599 59.580 1.00 0.00 O ATOM 42070 H1 WAT 8098 130.100 6.054 59.237 1.00 0.00 H ATOM 42071 H2 WAT 8098 130.632 7.471 59.228 1.00 0.00 H TER 42073 WAT 8098 ATOM 42073 O WAT 8099 88.400 109.517 139.680 1.00 0.00 O ATOM 42074 H1 WAT 8099 87.447 109.596 139.643 1.00 0.00 H ATOM 42075 H2 WAT 8099 88.723 110.345 139.323 1.00 0.00 H TER 42077 WAT 8099 ATOM 42077 O WAT 8100 12.108 78.093 112.143 1.00 0.00 O ATOM 42078 H1 WAT 8100 11.960 77.559 112.923 1.00 0.00 H ATOM 42079 H2 WAT 8100 13.021 77.928 111.909 1.00 0.00 H TER 42081 WAT 8100 ATOM 42081 O WAT 8101 40.448 75.053 13.662 1.00 0.00 O ATOM 42082 H1 WAT 8101 39.563 74.962 13.309 1.00 0.00 H ATOM 42083 H2 WAT 8101 41.021 74.787 12.942 1.00 0.00 H TER 42085 WAT 8101 ATOM 42085 O WAT 8102 109.892 71.545 105.231 1.00 0.00 O ATOM 42086 H1 WAT 8102 109.335 71.283 105.964 1.00 0.00 H ATOM 42087 H2 WAT 8102 109.962 70.759 104.690 1.00 0.00 H TER 42089 WAT 8102 ATOM 42089 O WAT 8103 123.917 74.384 111.953 1.00 0.00 O ATOM 42090 H1 WAT 8103 124.858 74.260 112.080 1.00 0.00 H ATOM 42091 H2 WAT 8103 123.853 75.108 111.331 1.00 0.00 H TER 42093 WAT 8103 ATOM 42093 O WAT 8104 40.254 118.449 3.164 1.00 0.00 O ATOM 42094 H1 WAT 8104 39.388 118.566 3.555 1.00 0.00 H ATOM 42095 H2 WAT 8104 40.078 118.279 2.239 1.00 0.00 H TER 42097 WAT 8104 ATOM 42097 O WAT 8105 46.543 98.347 132.882 1.00 0.00 O ATOM 42098 H1 WAT 8105 46.753 98.564 131.973 1.00 0.00 H ATOM 42099 H2 WAT 8105 45.590 98.257 132.892 1.00 0.00 H TER 42101 WAT 8105 ATOM 42101 O WAT 8106 15.714 34.034 85.164 1.00 0.00 O ATOM 42102 H1 WAT 8106 16.587 34.422 85.215 1.00 0.00 H ATOM 42103 H2 WAT 8106 15.856 33.102 85.334 1.00 0.00 H TER 42105 WAT 8106 ATOM 42105 O WAT 8107 96.558 48.698 3.486 1.00 0.00 O ATOM 42106 H1 WAT 8107 97.380 48.218 3.591 1.00 0.00 H ATOM 42107 H2 WAT 8107 96.557 48.975 2.570 1.00 0.00 H TER 42109 WAT 8107 ATOM 42109 O WAT 8108 62.865 53.056 130.233 1.00 0.00 O ATOM 42110 H1 WAT 8108 63.802 53.125 130.055 1.00 0.00 H ATOM 42111 H2 WAT 8108 62.598 53.948 130.457 1.00 0.00 H TER 42113 WAT 8108 ATOM 42113 O WAT 8109 99.148 44.699 22.364 1.00 0.00 O ATOM 42114 H1 WAT 8109 99.443 45.542 22.709 1.00 0.00 H ATOM 42115 H2 WAT 8109 99.417 44.062 23.026 1.00 0.00 H TER 42117 WAT 8109 ATOM 42117 O WAT 8110 48.780 114.873 151.494 1.00 0.00 O ATOM 42118 H1 WAT 8110 48.290 114.599 150.718 1.00 0.00 H ATOM 42119 H2 WAT 8110 49.251 114.087 151.771 1.00 0.00 H TER 42121 WAT 8110 ATOM 42121 O WAT 8111 123.650 99.786 96.064 1.00 0.00 O ATOM 42122 H1 WAT 8111 123.872 98.857 96.000 1.00 0.00 H ATOM 42123 H2 WAT 8111 124.338 100.231 95.569 1.00 0.00 H TER 42125 WAT 8111 ATOM 42125 O WAT 8112 103.568 133.896 135.974 1.00 0.00 O ATOM 42126 H1 WAT 8112 103.710 134.753 136.377 1.00 0.00 H ATOM 42127 H2 WAT 8112 104.204 133.859 135.260 1.00 0.00 H TER 42129 WAT 8112 ATOM 42129 O WAT 8113 140.392 89.623 95.380 1.00 0.00 O ATOM 42130 H1 WAT 8113 139.847 89.183 96.033 1.00 0.00 H ATOM 42131 H2 WAT 8113 139.777 89.890 94.696 1.00 0.00 H TER 42133 WAT 8113 ATOM 42133 O WAT 8114 127.681 107.347 75.818 1.00 0.00 O ATOM 42134 H1 WAT 8114 127.495 107.291 76.755 1.00 0.00 H ATOM 42135 H2 WAT 8114 127.139 106.663 75.425 1.00 0.00 H TER 42137 WAT 8114 ATOM 42137 O WAT 8115 83.617 95.663 131.133 1.00 0.00 O ATOM 42138 H1 WAT 8115 83.322 95.795 130.232 1.00 0.00 H ATOM 42139 H2 WAT 8115 82.811 95.522 131.630 1.00 0.00 H TER 42141 WAT 8115 ATOM 42141 O WAT 8116 113.558 30.553 116.752 1.00 0.00 O ATOM 42142 H1 WAT 8116 113.050 29.936 116.225 1.00 0.00 H ATOM 42143 H2 WAT 8116 113.054 30.650 117.560 1.00 0.00 H TER 42145 WAT 8116 ATOM 42145 O WAT 8117 25.670 59.020 144.451 1.00 0.00 O ATOM 42146 H1 WAT 8117 25.407 59.546 145.206 1.00 0.00 H ATOM 42147 H2 WAT 8117 25.438 59.556 143.693 1.00 0.00 H TER 42149 WAT 8117 ATOM 42149 O WAT 8118 73.502 70.087 11.732 1.00 0.00 O ATOM 42150 H1 WAT 8118 72.791 70.694 11.942 1.00 0.00 H ATOM 42151 H2 WAT 8118 74.040 70.066 12.524 1.00 0.00 H TER 42153 WAT 8118 ATOM 42153 O WAT 8119 129.710 116.990 94.994 1.00 0.00 O ATOM 42154 H1 WAT 8119 129.260 117.082 95.834 1.00 0.00 H ATOM 42155 H2 WAT 8119 129.467 116.116 94.687 1.00 0.00 H TER 42157 WAT 8119 ATOM 42157 O WAT 8120 78.480 63.556 70.562 1.00 0.00 O ATOM 42158 H1 WAT 8120 77.707 63.738 71.097 1.00 0.00 H ATOM 42159 H2 WAT 8120 78.517 64.282 69.940 1.00 0.00 H TER 42161 WAT 8120 ATOM 42161 O WAT 8121 22.822 97.922 9.699 1.00 0.00 O ATOM 42162 H1 WAT 8121 22.427 98.770 9.497 1.00 0.00 H ATOM 42163 H2 WAT 8121 22.498 97.709 10.575 1.00 0.00 H TER 42165 WAT 8121 ATOM 42165 O WAT 8122 63.549 35.816 22.801 1.00 0.00 O ATOM 42166 H1 WAT 8122 62.816 35.297 23.132 1.00 0.00 H ATOM 42167 H2 WAT 8122 64.319 35.441 23.228 1.00 0.00 H TER 42169 WAT 8122 ATOM 42169 O WAT 8123 124.101 4.502 112.164 1.00 0.00 O ATOM 42170 H1 WAT 8123 123.182 4.760 112.223 1.00 0.00 H ATOM 42171 H2 WAT 8123 124.157 3.696 112.677 1.00 0.00 H TER 42173 WAT 8123 ATOM 42173 O WAT 8124 78.735 65.500 11.479 1.00 0.00 O ATOM 42174 H1 WAT 8124 78.063 65.465 12.159 1.00 0.00 H ATOM 42175 H2 WAT 8124 79.160 64.643 11.518 1.00 0.00 H TER 42177 WAT 8124 ATOM 42177 O WAT 8125 8.064 51.432 13.657 1.00 0.00 O ATOM 42178 H1 WAT 8125 7.908 51.469 14.601 1.00 0.00 H ATOM 42179 H2 WAT 8125 8.155 50.498 13.466 1.00 0.00 H TER 42181 WAT 8125 ATOM 42181 O WAT 8126 142.334 61.276 103.733 1.00 0.00 O ATOM 42182 H1 WAT 8126 141.651 61.316 104.403 1.00 0.00 H ATOM 42183 H2 WAT 8126 142.718 60.406 103.834 1.00 0.00 H TER 42185 WAT 8126 ATOM 42185 O WAT 8127 21.305 95.983 0.970 1.00 0.00 O ATOM 42186 H1 WAT 8127 20.381 95.739 1.005 1.00 0.00 H ATOM 42187 H2 WAT 8127 21.691 95.573 1.744 1.00 0.00 H TER 42189 WAT 8127 ATOM 42189 O WAT 8128 97.342 27.306 154.748 1.00 0.00 O ATOM 42190 H1 WAT 8128 98.091 27.895 154.653 1.00 0.00 H ATOM 42191 H2 WAT 8128 97.348 26.780 153.948 1.00 0.00 H TER 42193 WAT 8128 ATOM 42193 O WAT 8129 60.749 118.792 82.342 1.00 0.00 O ATOM 42194 H1 WAT 8129 61.238 119.114 83.099 1.00 0.00 H ATOM 42195 H2 WAT 8129 61.340 118.165 81.924 1.00 0.00 H TER 42197 WAT 8129 ATOM 42197 O WAT 8130 9.533 102.247 57.500 1.00 0.00 O ATOM 42198 H1 WAT 8130 8.632 102.290 57.180 1.00 0.00 H ATOM 42199 H2 WAT 8130 9.466 101.804 58.346 1.00 0.00 H TER 42201 WAT 8130 ATOM 42201 O WAT 8131 126.029 44.595 20.927 1.00 0.00 O ATOM 42202 H1 WAT 8131 125.971 45.237 21.635 1.00 0.00 H ATOM 42203 H2 WAT 8131 125.251 44.758 20.392 1.00 0.00 H TER 42205 WAT 8131 ATOM 42205 O WAT 8132 98.849 89.979 142.936 1.00 0.00 O ATOM 42206 H1 WAT 8132 98.555 89.655 143.787 1.00 0.00 H ATOM 42207 H2 WAT 8132 99.805 89.970 142.994 1.00 0.00 H TER 42209 WAT 8132 ATOM 42209 O WAT 8133 7.139 101.560 92.221 1.00 0.00 O ATOM 42210 H1 WAT 8133 6.381 100.975 92.209 1.00 0.00 H ATOM 42211 H2 WAT 8133 7.006 102.139 91.471 1.00 0.00 H TER 42213 WAT 8133 ATOM 42213 O WAT 8134 53.350 12.043 123.962 1.00 0.00 O ATOM 42214 H1 WAT 8134 53.099 12.934 123.720 1.00 0.00 H ATOM 42215 H2 WAT 8134 53.428 12.067 124.915 1.00 0.00 H TER 42217 WAT 8134 ATOM 42217 O WAT 8135 15.973 128.172 57.890 1.00 0.00 O ATOM 42218 H1 WAT 8135 15.284 128.834 57.940 1.00 0.00 H ATOM 42219 H2 WAT 8135 15.645 127.533 57.256 1.00 0.00 H TER 42221 WAT 8135 ATOM 42221 O WAT 8136 55.148 50.362 15.413 1.00 0.00 O ATOM 42222 H1 WAT 8136 54.380 49.901 15.078 1.00 0.00 H ATOM 42223 H2 WAT 8136 55.805 50.267 14.723 1.00 0.00 H TER 42225 WAT 8136 ATOM 42225 O WAT 8137 40.720 24.780 100.142 1.00 0.00 O ATOM 42226 H1 WAT 8137 40.090 24.929 100.847 1.00 0.00 H ATOM 42227 H2 WAT 8137 40.429 23.966 99.730 1.00 0.00 H TER 42229 WAT 8137 ATOM 42229 O WAT 8138 124.214 38.679 121.125 1.00 0.00 O ATOM 42230 H1 WAT 8138 124.275 38.881 122.059 1.00 0.00 H ATOM 42231 H2 WAT 8138 123.958 37.757 121.096 1.00 0.00 H TER 42233 WAT 8138 ATOM 42233 O WAT 8139 6.458 5.153 127.870 1.00 0.00 O ATOM 42234 H1 WAT 8139 7.114 4.461 127.789 1.00 0.00 H ATOM 42235 H2 WAT 8139 6.322 5.462 126.974 1.00 0.00 H TER 42237 WAT 8139 ATOM 42237 O WAT 8140 132.401 91.424 102.702 1.00 0.00 O ATOM 42238 H1 WAT 8140 132.371 92.305 102.331 1.00 0.00 H ATOM 42239 H2 WAT 8140 131.813 90.910 102.149 1.00 0.00 H TER 42241 WAT 8140 ATOM 42241 O WAT 8141 127.383 104.657 107.015 1.00 0.00 O ATOM 42242 H1 WAT 8141 127.581 104.616 106.079 1.00 0.00 H ATOM 42243 H2 WAT 8141 127.006 105.528 107.142 1.00 0.00 H TER 42245 WAT 8141 ATOM 42245 O WAT 8142 56.795 53.003 103.363 1.00 0.00 O ATOM 42246 H1 WAT 8142 57.547 53.219 102.811 1.00 0.00 H ATOM 42247 H2 WAT 8142 56.450 52.191 102.992 1.00 0.00 H TER 42249 WAT 8142 ATOM 42249 O WAT 8143 145.706 17.335 0.760 1.00 0.00 O ATOM 42250 H1 WAT 8143 145.061 16.846 1.270 1.00 0.00 H ATOM 42251 H2 WAT 8143 146.179 16.666 0.266 1.00 0.00 H TER 42253 WAT 8143 ATOM 42253 O WAT 8144 128.286 144.119 120.214 1.00 0.00 O ATOM 42254 H1 WAT 8144 129.233 143.991 120.270 1.00 0.00 H ATOM 42255 H2 WAT 8144 128.164 145.060 120.343 1.00 0.00 H TER 42257 WAT 8144 ATOM 42257 O WAT 8145 28.598 66.490 17.698 1.00 0.00 O ATOM 42258 H1 WAT 8145 28.883 66.546 16.786 1.00 0.00 H ATOM 42259 H2 WAT 8145 29.098 65.758 18.060 1.00 0.00 H TER 42261 WAT 8145 ATOM 42261 O WAT 8146 19.645 100.172 124.230 1.00 0.00 O ATOM 42262 H1 WAT 8146 20.315 99.693 123.743 1.00 0.00 H ATOM 42263 H2 WAT 8146 18.934 100.295 123.601 1.00 0.00 H TER 42265 WAT 8146 ATOM 42265 O WAT 8147 50.185 80.708 132.836 1.00 0.00 O ATOM 42266 H1 WAT 8147 50.792 80.047 133.170 1.00 0.00 H ATOM 42267 H2 WAT 8147 49.375 80.226 132.668 1.00 0.00 H TER 42269 WAT 8147 ATOM 42269 O WAT 8148 135.344 19.360 146.305 1.00 0.00 O ATOM 42270 H1 WAT 8148 136.035 18.849 146.727 1.00 0.00 H ATOM 42271 H2 WAT 8148 134.781 19.642 147.026 1.00 0.00 H TER 42273 WAT 8148 ATOM 42273 O WAT 8149 109.940 115.236 103.740 1.00 0.00 O ATOM 42274 H1 WAT 8149 109.634 114.761 102.967 1.00 0.00 H ATOM 42275 H2 WAT 8149 110.843 114.942 103.859 1.00 0.00 H TER 42277 WAT 8149 ATOM 42277 O WAT 8150 99.538 69.218 9.637 1.00 0.00 O ATOM 42278 H1 WAT 8150 98.866 68.658 10.026 1.00 0.00 H ATOM 42279 H2 WAT 8150 99.642 68.885 8.746 1.00 0.00 H TER 42281 WAT 8150 ATOM 42281 O WAT 8151 55.487 132.047 124.433 1.00 0.00 O ATOM 42282 H1 WAT 8151 54.643 132.459 124.620 1.00 0.00 H ATOM 42283 H2 WAT 8151 55.638 132.220 123.504 1.00 0.00 H TER 42285 WAT 8151 ATOM 42285 O WAT 8152 43.110 89.933 21.616 1.00 0.00 O ATOM 42286 H1 WAT 8152 43.707 89.868 22.361 1.00 0.00 H ATOM 42287 H2 WAT 8152 42.775 89.044 21.499 1.00 0.00 H TER 42289 WAT 8152 ATOM 42289 O WAT 8153 136.309 125.830 65.816 1.00 0.00 O ATOM 42290 H1 WAT 8153 136.439 125.148 65.157 1.00 0.00 H ATOM 42291 H2 WAT 8153 137.190 126.023 66.137 1.00 0.00 H TER 42293 WAT 8153 ATOM 42293 O WAT 8154 22.944 14.651 142.835 1.00 0.00 O ATOM 42294 H1 WAT 8154 23.057 14.581 143.782 1.00 0.00 H ATOM 42295 H2 WAT 8154 22.015 14.467 142.690 1.00 0.00 H TER 42297 WAT 8154 ATOM 42297 O WAT 8155 47.175 120.128 14.412 1.00 0.00 O ATOM 42298 H1 WAT 8155 48.033 120.089 14.835 1.00 0.00 H ATOM 42299 H2 WAT 8155 47.371 120.205 13.479 1.00 0.00 H TER 42301 WAT 8155 ATOM 42301 O WAT 8156 6.448 133.051 154.511 1.00 0.00 O ATOM 42302 H1 WAT 8156 6.357 132.344 153.872 1.00 0.00 H ATOM 42303 H2 WAT 8156 5.583 133.458 154.544 1.00 0.00 H TER 42305 WAT 8156 ATOM 42305 O WAT 8157 12.206 9.405 59.832 1.00 0.00 O ATOM 42306 H1 WAT 8157 12.798 9.718 60.515 1.00 0.00 H ATOM 42307 H2 WAT 8157 12.392 9.964 59.078 1.00 0.00 H TER 42309 WAT 8157 ATOM 42309 O WAT 8158 111.051 137.095 104.598 1.00 0.00 O ATOM 42310 H1 WAT 8158 110.929 136.748 103.714 1.00 0.00 H ATOM 42311 H2 WAT 8158 111.562 136.423 105.050 1.00 0.00 H TER 42313 WAT 8158 ATOM 42313 O WAT 8159 82.164 118.534 129.577 1.00 0.00 O ATOM 42314 H1 WAT 8159 82.161 117.682 129.140 1.00 0.00 H ATOM 42315 H2 WAT 8159 83.008 118.920 129.342 1.00 0.00 H TER 42317 WAT 8159 ATOM 42317 O WAT 8160 21.641 41.305 3.696 1.00 0.00 O ATOM 42318 H1 WAT 8160 21.234 41.186 4.554 1.00 0.00 H ATOM 42319 H2 WAT 8160 21.975 40.438 3.468 1.00 0.00 H TER 42321 WAT 8160 ATOM 42321 O WAT 8161 3.942 84.477 132.085 1.00 0.00 O ATOM 42322 H1 WAT 8161 3.650 85.381 132.202 1.00 0.00 H ATOM 42323 H2 WAT 8161 3.881 84.091 132.959 1.00 0.00 H TER 42325 WAT 8161 ATOM 42325 O WAT 8162 41.932 113.041 11.842 1.00 0.00 O ATOM 42326 H1 WAT 8162 42.000 112.086 11.853 1.00 0.00 H ATOM 42327 H2 WAT 8162 40.995 113.213 11.743 1.00 0.00 H TER 42329 WAT 8162 ATOM 42329 O WAT 8163 88.902 73.248 17.127 1.00 0.00 O ATOM 42330 H1 WAT 8163 88.724 74.093 16.715 1.00 0.00 H ATOM 42331 H2 WAT 8163 88.044 72.937 17.416 1.00 0.00 H TER 42333 WAT 8163 ATOM 42333 O WAT 8164 57.380 106.847 147.565 1.00 0.00 O ATOM 42334 H1 WAT 8164 56.758 106.368 148.113 1.00 0.00 H ATOM 42335 H2 WAT 8164 56.889 107.605 147.250 1.00 0.00 H TER 42337 WAT 8164 ATOM 42337 O WAT 8165 83.150 31.057 111.145 1.00 0.00 O ATOM 42338 H1 WAT 8165 83.767 31.758 111.357 1.00 0.00 H ATOM 42339 H2 WAT 8165 82.789 30.791 111.990 1.00 0.00 H TER 42341 WAT 8165 ATOM 42341 O WAT 8166 102.260 71.355 134.793 1.00 0.00 O ATOM 42342 H1 WAT 8166 101.674 72.083 135.002 1.00 0.00 H ATOM 42343 H2 WAT 8166 101.842 70.590 135.188 1.00 0.00 H TER 42345 WAT 8166 ATOM 42345 O WAT 8167 63.720 112.090 107.258 1.00 0.00 O ATOM 42346 H1 WAT 8167 62.867 111.814 107.596 1.00 0.00 H ATOM 42347 H2 WAT 8167 63.946 111.425 106.607 1.00 0.00 H TER 42349 WAT 8167 ATOM 42349 O WAT 8168 51.465 68.120 99.996 1.00 0.00 O ATOM 42350 H1 WAT 8168 51.362 67.274 99.562 1.00 0.00 H ATOM 42351 H2 WAT 8168 50.929 68.722 99.479 1.00 0.00 H TER 42353 WAT 8168 ATOM 42353 O WAT 8169 53.454 19.132 152.187 1.00 0.00 O ATOM 42354 H1 WAT 8169 54.051 18.859 152.884 1.00 0.00 H ATOM 42355 H2 WAT 8169 53.710 20.034 151.993 1.00 0.00 H TER 42357 WAT 8169 ATOM 42357 O WAT 8170 58.907 94.759 101.105 1.00 0.00 O ATOM 42358 H1 WAT 8170 58.235 95.178 101.643 1.00 0.00 H ATOM 42359 H2 WAT 8170 59.734 95.021 101.508 1.00 0.00 H TER 42361 WAT 8170 ATOM 42361 O WAT 8171 26.727 143.339 59.523 1.00 0.00 O ATOM 42362 H1 WAT 8171 27.678 143.427 59.587 1.00 0.00 H ATOM 42363 H2 WAT 8171 26.588 142.790 58.752 1.00 0.00 H TER 42365 WAT 8171 ATOM 42365 O WAT 8172 140.411 99.767 84.649 1.00 0.00 O ATOM 42366 H1 WAT 8172 141.039 99.059 84.500 1.00 0.00 H ATOM 42367 H2 WAT 8172 139.555 99.357 84.529 1.00 0.00 H TER 42369 WAT 8172 ATOM 42369 O WAT 8173 24.289 67.737 81.090 1.00 0.00 O ATOM 42370 H1 WAT 8173 25.128 67.284 81.176 1.00 0.00 H ATOM 42371 H2 WAT 8173 24.286 68.067 80.191 1.00 0.00 H TER 42373 WAT 8173 ATOM 42373 O WAT 8174 101.680 102.094 62.965 1.00 0.00 O ATOM 42374 H1 WAT 8174 100.859 101.687 62.691 1.00 0.00 H ATOM 42375 H2 WAT 8174 101.772 102.856 62.393 1.00 0.00 H TER 42377 WAT 8174 ATOM 42377 O WAT 8175 99.054 79.957 17.733 1.00 0.00 O ATOM 42378 H1 WAT 8175 99.140 79.910 16.781 1.00 0.00 H ATOM 42379 H2 WAT 8175 98.122 79.810 17.897 1.00 0.00 H TER 42381 WAT 8175 ATOM 42381 O WAT 8176 93.003 24.876 99.915 1.00 0.00 O ATOM 42382 H1 WAT 8176 93.836 24.863 99.445 1.00 0.00 H ATOM 42383 H2 WAT 8176 92.530 25.621 99.542 1.00 0.00 H TER 42385 WAT 8176 ATOM 42385 O WAT 8177 140.295 79.007 3.899 1.00 0.00 O ATOM 42386 H1 WAT 8177 140.443 79.339 4.785 1.00 0.00 H ATOM 42387 H2 WAT 8177 141.107 78.551 3.677 1.00 0.00 H TER 42389 WAT 8177 ATOM 42389 O WAT 8178 76.919 26.703 115.434 1.00 0.00 O ATOM 42390 H1 WAT 8178 77.687 26.498 115.967 1.00 0.00 H ATOM 42391 H2 WAT 8178 76.318 25.974 115.588 1.00 0.00 H TER 42393 WAT 8178 ATOM 42393 O WAT 8179 127.664 45.732 132.430 1.00 0.00 O ATOM 42394 H1 WAT 8179 126.900 45.615 131.865 1.00 0.00 H ATOM 42395 H2 WAT 8179 127.482 45.188 133.195 1.00 0.00 H TER 42397 WAT 8179 ATOM 42397 O WAT 8180 92.791 60.093 62.366 1.00 0.00 O ATOM 42398 H1 WAT 8180 93.644 60.393 62.054 1.00 0.00 H ATOM 42399 H2 WAT 8180 92.158 60.572 61.830 1.00 0.00 H TER 42401 WAT 8180 ATOM 42401 O WAT 8181 65.250 13.186 77.864 1.00 0.00 O ATOM 42402 H1 WAT 8181 66.164 13.468 77.818 1.00 0.00 H ATOM 42403 H2 WAT 8181 64.855 13.524 77.060 1.00 0.00 H TER 42405 WAT 8181 ATOM 42405 O WAT 8182 145.481 11.831 143.731 1.00 0.00 O ATOM 42406 H1 WAT 8182 145.557 12.577 143.136 1.00 0.00 H ATOM 42407 H2 WAT 8182 144.889 11.227 143.284 1.00 0.00 H TER 42409 WAT 8182 ATOM 42409 O WAT 8183 43.586 90.859 139.756 1.00 0.00 O ATOM 42410 H1 WAT 8183 44.272 90.296 140.115 1.00 0.00 H ATOM 42411 H2 WAT 8183 43.613 90.698 138.813 1.00 0.00 H TER 42413 WAT 8183 ATOM 42413 O WAT 8184 17.706 92.777 68.029 1.00 0.00 O ATOM 42414 H1 WAT 8184 18.276 93.473 68.356 1.00 0.00 H ATOM 42415 H2 WAT 8184 17.058 93.230 67.490 1.00 0.00 H TER 42417 WAT 8184 ATOM 42417 O WAT 8185 25.226 35.233 104.521 1.00 0.00 O ATOM 42418 H1 WAT 8185 24.459 35.780 104.689 1.00 0.00 H ATOM 42419 H2 WAT 8185 25.971 35.825 104.625 1.00 0.00 H TER 42421 WAT 8185 ATOM 42421 O WAT 8186 70.546 64.106 23.287 1.00 0.00 O ATOM 42422 H1 WAT 8186 70.380 63.205 23.565 1.00 0.00 H ATOM 42423 H2 WAT 8186 70.650 64.049 22.337 1.00 0.00 H TER 42425 WAT 8186 ATOM 42425 O WAT 8187 15.173 135.214 136.508 1.00 0.00 O ATOM 42426 H1 WAT 8187 15.158 135.034 137.448 1.00 0.00 H ATOM 42427 H2 WAT 8187 15.772 135.955 136.415 1.00 0.00 H TER 42429 WAT 8187 ATOM 42429 O WAT 8188 121.797 72.023 118.221 1.00 0.00 O ATOM 42430 H1 WAT 8188 121.977 72.269 117.314 1.00 0.00 H ATOM 42431 H2 WAT 8188 122.486 72.454 118.727 1.00 0.00 H TER 42433 WAT 8188 ATOM 42433 O WAT 8189 86.292 26.182 3.198 1.00 0.00 O ATOM 42434 H1 WAT 8189 85.463 26.433 2.791 1.00 0.00 H ATOM 42435 H2 WAT 8189 86.044 25.566 3.887 1.00 0.00 H TER 42437 WAT 8189 ATOM 42437 O WAT 8190 99.570 18.537 125.493 1.00 0.00 O ATOM 42438 H1 WAT 8190 98.714 18.965 125.491 1.00 0.00 H ATOM 42439 H2 WAT 8190 99.513 17.890 126.197 1.00 0.00 H TER 42441 WAT 8190 ATOM 42441 O WAT 8191 55.848 110.939 119.970 1.00 0.00 O ATOM 42442 H1 WAT 8191 55.578 110.084 119.637 1.00 0.00 H ATOM 42443 H2 WAT 8191 56.055 111.448 119.186 1.00 0.00 H TER 42445 WAT 8191 ATOM 42445 O WAT 8192 77.994 35.564 2.190 1.00 0.00 O ATOM 42446 H1 WAT 8192 78.203 34.811 2.742 1.00 0.00 H ATOM 42447 H2 WAT 8192 77.357 36.065 2.699 1.00 0.00 H TER 42449 WAT 8192 ATOM 42449 O WAT 8193 142.649 145.367 111.549 1.00 0.00 O ATOM 42450 H1 WAT 8193 141.975 146.014 111.759 1.00 0.00 H ATOM 42451 H2 WAT 8193 143.472 145.795 111.782 1.00 0.00 H TER 42453 WAT 8193 ATOM 42453 O WAT 8194 61.293 111.020 4.983 1.00 0.00 O ATOM 42454 H1 WAT 8194 60.381 110.901 5.248 1.00 0.00 H ATOM 42455 H2 WAT 8194 61.802 110.628 5.693 1.00 0.00 H TER 42457 WAT 8194 ATOM 42457 O WAT 8195 132.063 113.428 82.800 1.00 0.00 O ATOM 42458 H1 WAT 8195 132.834 112.880 82.948 1.00 0.00 H ATOM 42459 H2 WAT 8195 132.262 114.248 83.252 1.00 0.00 H TER 42461 WAT 8195 ATOM 42461 O WAT 8196 138.095 132.818 115.385 1.00 0.00 O ATOM 42462 H1 WAT 8196 138.193 132.435 116.256 1.00 0.00 H ATOM 42463 H2 WAT 8196 137.154 132.963 115.292 1.00 0.00 H TER 42465 WAT 8196 ATOM 42465 O WAT 8197 110.434 45.154 16.472 1.00 0.00 O ATOM 42466 H1 WAT 8197 110.754 46.036 16.284 1.00 0.00 H ATOM 42467 H2 WAT 8197 110.029 44.866 15.653 1.00 0.00 H TER 42469 WAT 8197 ATOM 42469 O WAT 8198 85.210 139.875 62.747 1.00 0.00 O ATOM 42470 H1 WAT 8198 84.424 139.329 62.772 1.00 0.00 H ATOM 42471 H2 WAT 8198 85.185 140.292 61.886 1.00 0.00 H TER 42473 WAT 8198 ATOM 42473 O WAT 8199 36.127 29.212 117.343 1.00 0.00 O ATOM 42474 H1 WAT 8199 36.596 30.046 117.360 1.00 0.00 H ATOM 42475 H2 WAT 8199 36.813 28.550 117.423 1.00 0.00 H TER 42477 WAT 8199 ATOM 42477 O WAT 8200 23.391 75.135 91.182 1.00 0.00 O ATOM 42478 H1 WAT 8200 24.066 75.256 90.515 1.00 0.00 H ATOM 42479 H2 WAT 8200 22.569 75.122 90.691 1.00 0.00 H TER 42481 WAT 8200 ATOM 42481 O WAT 8201 33.132 131.115 156.498 1.00 0.00 O ATOM 42482 H1 WAT 8201 33.153 131.228 155.547 1.00 0.00 H ATOM 42483 H2 WAT 8201 32.503 131.769 156.803 1.00 0.00 H TER 42485 WAT 8201 ATOM 42485 O WAT 8202 5.557 137.857 94.910 1.00 0.00 O ATOM 42486 H1 WAT 8202 6.389 137.711 95.360 1.00 0.00 H ATOM 42487 H2 WAT 8202 5.804 138.234 94.066 1.00 0.00 H TER 42489 WAT 8202 ATOM 42489 O WAT 8203 66.490 33.551 56.695 1.00 0.00 O ATOM 42490 H1 WAT 8203 66.181 33.676 55.798 1.00 0.00 H ATOM 42491 H2 WAT 8203 66.230 34.352 57.151 1.00 0.00 H TER 42493 WAT 8203 ATOM 42493 O WAT 8204 57.705 129.003 7.972 1.00 0.00 O ATOM 42494 H1 WAT 8204 58.306 129.240 8.679 1.00 0.00 H ATOM 42495 H2 WAT 8204 58.275 128.708 7.262 1.00 0.00 H TER 42497 WAT 8204 ATOM 42497 O WAT 8205 82.987 103.233 4.742 1.00 0.00 O ATOM 42498 H1 WAT 8205 83.815 102.947 4.355 1.00 0.00 H ATOM 42499 H2 WAT 8205 83.161 104.122 5.051 1.00 0.00 H TER 42501 WAT 8205 ATOM 42501 O WAT 8206 143.217 52.578 60.079 1.00 0.00 O ATOM 42502 H1 WAT 8206 143.527 53.340 59.589 1.00 0.00 H ATOM 42503 H2 WAT 8206 142.472 52.254 59.573 1.00 0.00 H TER 42505 WAT 8206 ATOM 42505 O WAT 8207 49.277 99.699 11.877 1.00 0.00 O ATOM 42506 H1 WAT 8207 48.670 99.869 11.156 1.00 0.00 H ATOM 42507 H2 WAT 8207 49.366 98.746 11.896 1.00 0.00 H TER 42509 WAT 8207 ATOM 42509 O WAT 8208 108.087 43.505 131.890 1.00 0.00 O ATOM 42510 H1 WAT 8208 107.713 43.927 132.663 1.00 0.00 H ATOM 42511 H2 WAT 8208 108.353 42.637 132.195 1.00 0.00 H TER 42513 WAT 8208 ATOM 42513 O WAT 8209 56.796 107.519 15.152 1.00 0.00 O ATOM 42514 H1 WAT 8209 56.918 108.468 15.122 1.00 0.00 H ATOM 42515 H2 WAT 8209 57.258 107.243 15.943 1.00 0.00 H TER 42517 WAT 8209 ATOM 42517 O WAT 8210 88.468 65.944 10.174 1.00 0.00 O ATOM 42518 H1 WAT 8210 89.220 66.304 10.645 1.00 0.00 H ATOM 42519 H2 WAT 8210 88.828 65.649 9.338 1.00 0.00 H TER 42521 WAT 8210 ATOM 42521 O WAT 8211 48.546 132.318 125.331 1.00 0.00 O ATOM 42522 H1 WAT 8211 48.473 132.610 124.423 1.00 0.00 H ATOM 42523 H2 WAT 8211 49.476 132.407 125.538 1.00 0.00 H TER 42525 WAT 8211 ATOM 42525 O WAT 8212 85.984 114.664 142.866 1.00 0.00 O ATOM 42526 H1 WAT 8212 86.441 114.683 143.707 1.00 0.00 H ATOM 42527 H2 WAT 8212 85.073 114.860 143.084 1.00 0.00 H TER 42529 WAT 8212 ATOM 42529 O WAT 8213 50.038 102.314 25.097 1.00 0.00 O ATOM 42530 H1 WAT 8213 49.392 102.154 24.409 1.00 0.00 H ATOM 42531 H2 WAT 8213 50.765 101.729 24.883 1.00 0.00 H TER 42533 WAT 8213 ATOM 42533 O WAT 8214 138.619 139.426 124.617 1.00 0.00 O ATOM 42534 H1 WAT 8214 138.821 138.506 124.788 1.00 0.00 H ATOM 42535 H2 WAT 8214 139.469 139.828 124.436 1.00 0.00 H TER 42537 WAT 8214 ATOM 42537 O WAT 8215 90.399 96.260 74.702 1.00 0.00 O ATOM 42538 H1 WAT 8215 91.168 96.734 74.385 1.00 0.00 H ATOM 42539 H2 WAT 8215 90.756 95.581 75.275 1.00 0.00 H TER 42541 WAT 8215 ATOM 42541 O WAT 8216 32.286 139.355 133.239 1.00 0.00 O ATOM 42542 H1 WAT 8216 33.156 139.580 132.909 1.00 0.00 H ATOM 42543 H2 WAT 8216 31.987 140.148 133.685 1.00 0.00 H TER 42545 WAT 8216 ATOM 42545 O WAT 8217 58.159 5.459 66.950 1.00 0.00 O ATOM 42546 H1 WAT 8217 58.964 5.817 66.573 1.00 0.00 H ATOM 42547 H2 WAT 8217 57.456 5.910 66.483 1.00 0.00 H TER 42549 WAT 8217 ATOM 42549 O WAT 8218 7.847 121.338 0.551 1.00 0.00 O ATOM 42550 H1 WAT 8218 7.960 120.435 0.849 1.00 0.00 H ATOM 42551 H2 WAT 8218 8.664 121.543 0.095 1.00 0.00 H TER 42553 WAT 8218 ATOM 42553 O WAT 8219 58.337 81.199 18.689 1.00 0.00 O ATOM 42554 H1 WAT 8219 59.162 81.309 18.216 1.00 0.00 H ATOM 42555 H2 WAT 8219 58.499 80.469 19.287 1.00 0.00 H TER 42557 WAT 8219 ATOM 42557 O WAT 8220 77.656 97.866 156.585 1.00 0.00 O ATOM 42558 H1 WAT 8220 76.707 97.847 156.464 1.00 0.00 H ATOM 42559 H2 WAT 8220 78.000 98.156 155.740 1.00 0.00 H TER 42561 WAT 8220 ATOM 42561 O WAT 8221 91.889 34.617 127.841 1.00 0.00 O ATOM 42562 H1 WAT 8221 91.409 35.064 128.538 1.00 0.00 H ATOM 42563 H2 WAT 8221 91.234 34.465 127.159 1.00 0.00 H TER 42565 WAT 8221 ATOM 42565 O WAT 8222 62.330 103.926 84.481 1.00 0.00 O ATOM 42566 H1 WAT 8222 61.712 104.626 84.692 1.00 0.00 H ATOM 42567 H2 WAT 8222 62.166 103.254 85.144 1.00 0.00 H TER 42569 WAT 8222 ATOM 42569 O WAT 8223 133.042 99.961 135.532 1.00 0.00 O ATOM 42570 H1 WAT 8223 133.314 99.158 135.975 1.00 0.00 H ATOM 42571 H2 WAT 8223 133.081 99.746 134.600 1.00 0.00 H TER 42573 WAT 8223 ATOM 42573 O WAT 8224 118.168 131.346 107.663 1.00 0.00 O ATOM 42574 H1 WAT 8224 119.120 131.326 107.561 1.00 0.00 H ATOM 42575 H2 WAT 8224 118.009 132.060 108.282 1.00 0.00 H TER 42577 WAT 8224 ATOM 42577 O WAT 8225 93.659 57.236 88.006 1.00 0.00 O ATOM 42578 H1 WAT 8225 93.042 57.923 87.754 1.00 0.00 H ATOM 42579 H2 WAT 8225 93.130 56.440 88.045 1.00 0.00 H TER 42581 WAT 8225 ATOM 42581 O WAT 8226 21.846 29.493 100.639 1.00 0.00 O ATOM 42582 H1 WAT 8226 20.956 29.703 100.354 1.00 0.00 H ATOM 42583 H2 WAT 8226 22.392 29.680 99.875 1.00 0.00 H TER 42585 WAT 8226 ATOM 42585 O WAT 8227 64.857 102.531 20.986 1.00 0.00 O ATOM 42586 H1 WAT 8227 64.926 101.759 21.548 1.00 0.00 H ATOM 42587 H2 WAT 8227 65.733 102.638 20.617 1.00 0.00 H TER 42589 WAT 8227 ATOM 42589 O WAT 8228 24.035 113.598 53.172 1.00 0.00 O ATOM 42590 H1 WAT 8228 24.908 113.235 53.017 1.00 0.00 H ATOM 42591 H2 WAT 8228 24.189 114.361 53.729 1.00 0.00 H TER 42593 WAT 8228 ATOM 42593 O WAT 8229 122.111 145.152 18.639 1.00 0.00 O ATOM 42594 H1 WAT 8229 121.743 145.968 18.301 1.00 0.00 H ATOM 42595 H2 WAT 8229 122.467 145.386 19.496 1.00 0.00 H TER 42597 WAT 8229 ATOM 42597 O WAT 8230 49.630 92.704 91.418 1.00 0.00 O ATOM 42598 H1 WAT 8230 48.695 92.679 91.621 1.00 0.00 H ATOM 42599 H2 WAT 8230 49.936 93.526 91.799 1.00 0.00 H TER 42601 WAT 8230 ATOM 42601 O WAT 8231 5.383 141.295 58.430 1.00 0.00 O ATOM 42602 H1 WAT 8231 4.854 141.632 59.153 1.00 0.00 H ATOM 42603 H2 WAT 8231 6.007 140.701 58.846 1.00 0.00 H TER 42605 WAT 8231 ATOM 42605 O WAT 8232 96.948 122.497 60.533 1.00 0.00 O ATOM 42606 H1 WAT 8232 96.236 122.600 59.902 1.00 0.00 H ATOM 42607 H2 WAT 8232 96.658 122.985 61.304 1.00 0.00 H TER 42609 WAT 8232 ATOM 42609 O WAT 8233 118.099 74.203 77.667 1.00 0.00 O ATOM 42610 H1 WAT 8233 118.923 74.432 77.237 1.00 0.00 H ATOM 42611 H2 WAT 8233 117.886 73.333 77.329 1.00 0.00 H TER 42613 WAT 8233 ATOM 42613 O WAT 8234 136.284 111.549 149.964 1.00 0.00 O ATOM 42614 H1 WAT 8234 136.213 111.996 149.121 1.00 0.00 H ATOM 42615 H2 WAT 8234 136.028 110.645 149.779 1.00 0.00 H TER 42617 WAT 8234 ATOM 42617 O WAT 8235 90.879 15.369 152.671 1.00 0.00 O ATOM 42618 H1 WAT 8235 91.154 16.271 152.838 1.00 0.00 H ATOM 42619 H2 WAT 8235 90.074 15.456 152.159 1.00 0.00 H TER 42621 WAT 8235 ATOM 42621 O WAT 8236 37.442 63.559 91.009 1.00 0.00 O ATOM 42622 H1 WAT 8236 37.787 64.451 90.980 1.00 0.00 H ATOM 42623 H2 WAT 8236 38.212 63.009 91.155 1.00 0.00 H TER 42625 WAT 8236 ATOM 42625 O WAT 8237 115.098 87.238 139.826 1.00 0.00 O ATOM 42626 H1 WAT 8237 115.522 86.438 140.137 1.00 0.00 H ATOM 42627 H2 WAT 8237 114.290 86.935 139.411 1.00 0.00 H TER 42629 WAT 8237 ATOM 42629 O WAT 8238 112.211 30.420 140.708 1.00 0.00 O ATOM 42630 H1 WAT 8238 111.615 30.219 139.987 1.00 0.00 H ATOM 42631 H2 WAT 8238 112.568 29.570 140.967 1.00 0.00 H TER 42633 WAT 8238 ATOM 42633 O WAT 8239 126.299 109.265 72.192 1.00 0.00 O ATOM 42634 H1 WAT 8239 127.163 109.089 72.565 1.00 0.00 H ATOM 42635 H2 WAT 8239 125.748 108.553 72.517 1.00 0.00 H TER 42637 WAT 8239 ATOM 42637 O WAT 8240 65.077 119.888 131.268 1.00 0.00 O ATOM 42638 H1 WAT 8240 64.889 120.258 132.131 1.00 0.00 H ATOM 42639 H2 WAT 8240 64.434 119.186 131.163 1.00 0.00 H TER 42641 WAT 8240 ATOM 42641 O WAT 8241 127.730 144.626 135.461 1.00 0.00 O ATOM 42642 H1 WAT 8241 128.638 144.815 135.223 1.00 0.00 H ATOM 42643 H2 WAT 8241 127.690 143.671 135.514 1.00 0.00 H TER 42645 WAT 8241 ATOM 42645 O WAT 8242 77.377 115.018 58.679 1.00 0.00 O ATOM 42646 H1 WAT 8242 76.897 114.411 59.243 1.00 0.00 H ATOM 42647 H2 WAT 8242 77.207 114.705 57.791 1.00 0.00 H TER 42649 WAT 8242 ATOM 42649 O WAT 8243 15.342 121.423 148.545 1.00 0.00 O ATOM 42650 H1 WAT 8243 16.191 121.836 148.703 1.00 0.00 H ATOM 42651 H2 WAT 8243 14.719 121.965 149.029 1.00 0.00 H TER 42653 WAT 8243 ATOM 42653 O WAT 8244 145.037 31.642 87.703 1.00 0.00 O ATOM 42654 H1 WAT 8244 145.077 32.508 88.108 1.00 0.00 H ATOM 42655 H2 WAT 8244 145.322 31.041 88.391 1.00 0.00 H TER 42657 WAT 8244 ATOM 42657 O WAT 8245 57.682 115.628 70.748 1.00 0.00 O ATOM 42658 H1 WAT 8245 56.955 115.957 71.276 1.00 0.00 H ATOM 42659 H2 WAT 8245 57.855 114.753 71.097 1.00 0.00 H TER 42661 WAT 8245 ATOM 42661 O WAT 8246 95.434 118.817 139.292 1.00 0.00 O ATOM 42662 H1 WAT 8246 95.072 119.119 138.459 1.00 0.00 H ATOM 42663 H2 WAT 8246 95.501 117.867 139.194 1.00 0.00 H TER 42665 WAT 8246 ATOM 42665 O WAT 8247 76.345 3.835 104.620 1.00 0.00 O ATOM 42666 H1 WAT 8247 75.506 4.127 104.262 1.00 0.00 H ATOM 42667 H2 WAT 8247 76.344 4.154 105.522 1.00 0.00 H TER 42669 WAT 8247 ATOM 42669 O WAT 8248 50.278 22.762 149.881 1.00 0.00 O ATOM 42670 H1 WAT 8248 49.765 22.781 150.690 1.00 0.00 H ATOM 42671 H2 WAT 8248 51.009 23.357 150.047 1.00 0.00 H TER 42673 WAT 8248 ATOM 42673 O WAT 8249 82.174 129.480 88.681 1.00 0.00 O ATOM 42674 H1 WAT 8249 82.857 130.081 88.979 1.00 0.00 H ATOM 42675 H2 WAT 8249 81.401 130.034 88.569 1.00 0.00 H TER 42677 WAT 8249 ATOM 42677 O WAT 8250 82.108 145.279 14.068 1.00 0.00 O ATOM 42678 H1 WAT 8250 82.272 146.191 13.828 1.00 0.00 H ATOM 42679 H2 WAT 8250 81.287 145.304 14.560 1.00 0.00 H TER 42681 WAT 8250 ATOM 42681 O WAT 8251 91.663 88.935 147.380 1.00 0.00 O ATOM 42682 H1 WAT 8251 91.692 89.889 147.313 1.00 0.00 H ATOM 42683 H2 WAT 8251 91.402 88.641 146.508 1.00 0.00 H TER 42685 WAT 8251 ATOM 42685 O WAT 8252 26.631 69.591 158.301 1.00 0.00 O ATOM 42686 H1 WAT 8252 26.491 69.234 159.178 1.00 0.00 H ATOM 42687 H2 WAT 8252 27.417 69.147 157.983 1.00 0.00 H TER 42689 WAT 8252 ATOM 42689 O WAT 8253 53.540 19.100 149.253 1.00 0.00 O ATOM 42690 H1 WAT 8253 53.444 18.816 150.162 1.00 0.00 H ATOM 42691 H2 WAT 8253 54.460 19.349 149.175 1.00 0.00 H TER 42693 WAT 8253 ATOM 42693 O WAT 8254 63.831 15.664 25.809 1.00 0.00 O ATOM 42694 H1 WAT 8254 63.972 15.371 24.909 1.00 0.00 H ATOM 42695 H2 WAT 8254 64.698 15.626 26.213 1.00 0.00 H TER 42697 WAT 8254 ATOM 42697 O WAT 8255 0.281 70.227 146.541 1.00 0.00 O ATOM 42698 H1 WAT 8255 0.668 70.631 145.764 1.00 0.00 H ATOM 42699 H2 WAT 8255 0.615 70.747 147.272 1.00 0.00 H TER 42701 WAT 8255 ATOM 42701 O WAT 8256 89.887 62.449 102.418 1.00 0.00 O ATOM 42702 H1 WAT 8256 89.913 62.549 103.370 1.00 0.00 H ATOM 42703 H2 WAT 8256 89.658 63.320 102.092 1.00 0.00 H TER 42705 WAT 8256 ATOM 42705 O WAT 8257 87.364 42.143 62.705 1.00 0.00 O ATOM 42706 H1 WAT 8257 86.748 42.005 61.986 1.00 0.00 H ATOM 42707 H2 WAT 8257 86.816 42.166 63.489 1.00 0.00 H TER 42709 WAT 8257 ATOM 42709 O WAT 8258 127.510 116.027 77.591 1.00 0.00 O ATOM 42710 H1 WAT 8258 128.343 115.606 77.802 1.00 0.00 H ATOM 42711 H2 WAT 8258 127.294 115.707 76.715 1.00 0.00 H TER 42713 WAT 8258 ATOM 42713 O WAT 8259 98.117 45.257 25.452 1.00 0.00 O ATOM 42714 H1 WAT 8259 97.734 45.751 24.728 1.00 0.00 H ATOM 42715 H2 WAT 8259 99.011 45.591 25.525 1.00 0.00 H TER 42717 WAT 8259 ATOM 42717 O WAT 8260 47.442 88.606 97.327 1.00 0.00 O ATOM 42718 H1 WAT 8260 47.588 88.002 98.055 1.00 0.00 H ATOM 42719 H2 WAT 8260 47.657 88.096 96.546 1.00 0.00 H TER 42721 WAT 8260 ATOM 42721 O WAT 8261 25.867 33.420 120.933 1.00 0.00 O ATOM 42722 H1 WAT 8261 26.725 33.639 120.570 1.00 0.00 H ATOM 42723 H2 WAT 8261 25.636 32.590 120.517 1.00 0.00 H TER 42725 WAT 8261 ATOM 42725 O WAT 8262 135.531 15.876 3.786 1.00 0.00 O ATOM 42726 H1 WAT 8262 135.580 15.248 4.507 1.00 0.00 H ATOM 42727 H2 WAT 8262 134.594 15.982 3.623 1.00 0.00 H TER 42729 WAT 8262 ATOM 42729 O WAT 8263 117.029 87.608 133.198 1.00 0.00 O ATOM 42730 H1 WAT 8263 117.827 87.962 133.593 1.00 0.00 H ATOM 42731 H2 WAT 8263 116.472 88.374 133.056 1.00 0.00 H TER 42733 WAT 8263 ATOM 42733 O WAT 8264 0.407 13.314 64.355 1.00 0.00 O ATOM 42734 H1 WAT 8264 -0.412 12.822 64.294 1.00 0.00 H ATOM 42735 H2 WAT 8264 0.176 14.201 64.079 1.00 0.00 H TER 42737 WAT 8264 ATOM 42737 O WAT 8265 54.520 119.030 103.389 1.00 0.00 O ATOM 42738 H1 WAT 8265 54.847 119.101 102.492 1.00 0.00 H ATOM 42739 H2 WAT 8265 54.468 118.088 103.551 1.00 0.00 H TER 42741 WAT 8265 ATOM 42741 O WAT 8266 15.000 28.749 124.903 1.00 0.00 O ATOM 42742 H1 WAT 8266 14.329 29.364 125.199 1.00 0.00 H ATOM 42743 H2 WAT 8266 15.682 29.303 124.523 1.00 0.00 H TER 42745 WAT 8266 ATOM 42745 O WAT 8267 126.026 75.531 144.832 1.00 0.00 O ATOM 42746 H1 WAT 8267 125.527 75.786 145.608 1.00 0.00 H ATOM 42747 H2 WAT 8267 125.457 74.914 144.373 1.00 0.00 H TER 42749 WAT 8267 ATOM 42749 O WAT 8268 25.289 78.963 2.922 1.00 0.00 O ATOM 42750 H1 WAT 8268 25.487 78.699 3.821 1.00 0.00 H ATOM 42751 H2 WAT 8268 24.779 78.235 2.566 1.00 0.00 H TER 42753 WAT 8268 ATOM 42753 O WAT 8269 45.293 113.100 2.147 1.00 0.00 O ATOM 42754 H1 WAT 8269 45.497 112.677 2.981 1.00 0.00 H ATOM 42755 H2 WAT 8269 44.428 113.489 2.280 1.00 0.00 H TER 42757 WAT 8269 ATOM 42757 O WAT 8270 59.142 55.387 112.568 1.00 0.00 O ATOM 42758 H1 WAT 8270 58.828 54.710 111.969 1.00 0.00 H ATOM 42759 H2 WAT 8270 59.607 56.007 112.006 1.00 0.00 H TER 42761 WAT 8270 ATOM 42761 O WAT 8271 111.014 0.665 134.925 1.00 0.00 O ATOM 42762 H1 WAT 8271 111.253 -0.257 134.827 1.00 0.00 H ATOM 42763 H2 WAT 8271 111.114 1.033 134.047 1.00 0.00 H TER 42765 WAT 8271 ATOM 42765 O WAT 8272 7.459 69.788 3.834 1.00 0.00 O ATOM 42766 H1 WAT 8272 7.534 68.902 3.478 1.00 0.00 H ATOM 42767 H2 WAT 8272 6.704 69.747 4.421 1.00 0.00 H TER 42769 WAT 8272 ATOM 42769 O WAT 8273 106.308 50.647 95.844 1.00 0.00 O ATOM 42770 H1 WAT 8273 106.839 51.331 95.436 1.00 0.00 H ATOM 42771 H2 WAT 8273 106.921 50.169 96.402 1.00 0.00 H TER 42773 WAT 8273 ATOM 42773 O WAT 8274 137.286 14.746 145.150 1.00 0.00 O ATOM 42774 H1 WAT 8274 137.040 14.392 144.296 1.00 0.00 H ATOM 42775 H2 WAT 8274 136.676 15.469 145.296 1.00 0.00 H TER 42777 WAT 8274 ATOM 42777 O WAT 8275 84.128 144.888 141.476 1.00 0.00 O ATOM 42778 H1 WAT 8275 83.859 145.536 142.127 1.00 0.00 H ATOM 42779 H2 WAT 8275 84.717 145.365 140.892 1.00 0.00 H TER 42781 WAT 8275 ATOM 42781 O WAT 8276 127.242 46.166 75.517 1.00 0.00 O ATOM 42782 H1 WAT 8276 126.339 46.423 75.329 1.00 0.00 H ATOM 42783 H2 WAT 8276 127.161 45.383 76.061 1.00 0.00 H TER 42785 WAT 8276 ATOM 42785 O WAT 8277 117.949 124.568 146.792 1.00 0.00 O ATOM 42786 H1 WAT 8277 118.603 123.977 147.166 1.00 0.00 H ATOM 42787 H2 WAT 8277 117.909 125.301 147.406 1.00 0.00 H TER 42789 WAT 8277 ATOM 42789 O WAT 8278 45.843 0.691 62.817 1.00 0.00 O ATOM 42790 H1 WAT 8278 46.259 1.544 62.692 1.00 0.00 H ATOM 42791 H2 WAT 8278 46.572 0.072 62.861 1.00 0.00 H TER 42793 WAT 8278 ATOM 42793 O WAT 8279 72.026 83.943 2.667 1.00 0.00 O ATOM 42794 H1 WAT 8279 72.944 83.713 2.812 1.00 0.00 H ATOM 42795 H2 WAT 8279 71.668 83.201 2.179 1.00 0.00 H TER 42797 WAT 8279 ATOM 42797 O WAT 8280 35.727 57.514 139.242 1.00 0.00 O ATOM 42798 H1 WAT 8280 35.594 58.409 139.554 1.00 0.00 H ATOM 42799 H2 WAT 8280 35.855 56.999 140.039 1.00 0.00 H TER 42801 WAT 8280 ATOM 42801 O WAT 8281 12.698 89.029 4.271 1.00 0.00 O ATOM 42802 H1 WAT 8281 13.413 89.156 3.646 1.00 0.00 H ATOM 42803 H2 WAT 8281 13.107 88.586 5.015 1.00 0.00 H TER 42805 WAT 8281 ATOM 42805 O WAT 8282 74.254 55.344 65.505 1.00 0.00 O ATOM 42806 H1 WAT 8282 74.722 55.914 64.895 1.00 0.00 H ATOM 42807 H2 WAT 8282 74.932 55.021 66.099 1.00 0.00 H TER 42809 WAT 8282 ATOM 42809 O WAT 8283 27.888 64.239 62.261 1.00 0.00 O ATOM 42810 H1 WAT 8283 27.073 64.449 61.805 1.00 0.00 H ATOM 42811 H2 WAT 8283 28.530 64.120 61.561 1.00 0.00 H TER 42813 WAT 8283 ATOM 42813 O WAT 8284 47.459 77.616 110.885 1.00 0.00 O ATOM 42814 H1 WAT 8284 47.325 76.672 110.802 1.00 0.00 H ATOM 42815 H2 WAT 8284 47.308 77.958 110.003 1.00 0.00 H TER 42817 WAT 8284 ATOM 42817 O WAT 8285 10.468 103.032 0.585 1.00 0.00 O ATOM 42818 H1 WAT 8285 9.931 102.740 -0.152 1.00 0.00 H ATOM 42819 H2 WAT 8285 10.108 103.887 0.819 1.00 0.00 H TER 42821 WAT 8285 ATOM 42821 O WAT 8286 76.007 136.127 9.833 1.00 0.00 O ATOM 42822 H1 WAT 8286 75.086 136.089 10.090 1.00 0.00 H ATOM 42823 H2 WAT 8286 75.992 136.473 8.940 1.00 0.00 H TER 42825 WAT 8286 ATOM 42825 O WAT 8287 77.354 4.330 75.539 1.00 0.00 O ATOM 42826 H1 WAT 8287 76.839 4.772 76.214 1.00 0.00 H ATOM 42827 H2 WAT 8287 78.019 4.972 75.288 1.00 0.00 H TER 42829 WAT 8287 ATOM 42829 O WAT 8288 26.872 134.414 127.125 1.00 0.00 O ATOM 42830 H1 WAT 8288 26.049 134.052 127.455 1.00 0.00 H ATOM 42831 H2 WAT 8288 27.331 134.717 127.908 1.00 0.00 H TER 42833 WAT 8288 ATOM 42833 O WAT 8289 25.259 103.181 115.603 1.00 0.00 O ATOM 42834 H1 WAT 8289 25.198 102.292 115.951 1.00 0.00 H ATOM 42835 H2 WAT 8289 25.277 103.066 114.653 1.00 0.00 H TER 42837 WAT 8289 ATOM 42837 O WAT 8290 64.164 62.040 125.383 1.00 0.00 O ATOM 42838 H1 WAT 8290 64.032 61.095 125.455 1.00 0.00 H ATOM 42839 H2 WAT 8290 64.964 62.210 125.881 1.00 0.00 H TER 42841 WAT 8290 ATOM 42841 O WAT 8291 40.587 104.753 119.996 1.00 0.00 O ATOM 42842 H1 WAT 8291 41.257 105.341 119.647 1.00 0.00 H ATOM 42843 H2 WAT 8291 41.069 103.965 120.249 1.00 0.00 H TER 42845 WAT 8291 ATOM 42845 O WAT 8292 125.192 13.084 133.360 1.00 0.00 O ATOM 42846 H1 WAT 8292 126.091 13.139 133.037 1.00 0.00 H ATOM 42847 H2 WAT 8292 124.858 13.979 133.294 1.00 0.00 H TER 42849 WAT 8292 ATOM 42849 O WAT 8293 3.544 29.100 63.848 1.00 0.00 O ATOM 42850 H1 WAT 8293 4.365 28.842 63.428 1.00 0.00 H ATOM 42851 H2 WAT 8293 3.361 28.395 64.469 1.00 0.00 H TER 42853 WAT 8293 ATOM 42853 O WAT 8294 56.656 82.414 62.335 1.00 0.00 O ATOM 42854 H1 WAT 8294 56.921 81.531 62.079 1.00 0.00 H ATOM 42855 H2 WAT 8294 55.927 82.280 62.940 1.00 0.00 H TER 42857 WAT 8294 ATOM 42857 O WAT 8295 2.274 84.623 125.541 1.00 0.00 O ATOM 42858 H1 WAT 8295 2.272 84.427 126.478 1.00 0.00 H ATOM 42859 H2 WAT 8295 1.348 84.678 125.307 1.00 0.00 H TER 42861 WAT 8295 ATOM 42861 O WAT 8296 128.371 97.508 73.090 1.00 0.00 O ATOM 42862 H1 WAT 8296 128.348 98.158 72.388 1.00 0.00 H ATOM 42863 H2 WAT 8296 129.245 97.122 73.030 1.00 0.00 H TER 42865 WAT 8296 ATOM 42865 O WAT 8297 103.839 17.804 116.121 1.00 0.00 O ATOM 42866 H1 WAT 8297 103.778 18.548 115.521 1.00 0.00 H ATOM 42867 H2 WAT 8297 104.747 17.509 116.045 1.00 0.00 H TER 42869 WAT 8297 ATOM 42869 O WAT 8298 108.498 84.187 80.729 1.00 0.00 O ATOM 42870 H1 WAT 8298 109.167 83.507 80.645 1.00 0.00 H ATOM 42871 H2 WAT 8298 108.055 83.987 81.554 1.00 0.00 H TER 42873 WAT 8298 ATOM 42873 O WAT 8299 140.559 108.815 3.079 1.00 0.00 O ATOM 42874 H1 WAT 8299 141.516 108.797 3.051 1.00 0.00 H ATOM 42875 H2 WAT 8299 140.333 108.314 3.863 1.00 0.00 H TER 42877 WAT 8299 ATOM 42877 O WAT 8300 51.951 74.376 79.213 1.00 0.00 O ATOM 42878 H1 WAT 8300 51.004 74.237 79.212 1.00 0.00 H ATOM 42879 H2 WAT 8300 52.242 74.050 78.361 1.00 0.00 H TER 42881 WAT 8300 ATOM 42881 O WAT 8301 120.022 120.115 19.111 1.00 0.00 O ATOM 42882 H1 WAT 8301 119.503 120.461 19.837 1.00 0.00 H ATOM 42883 H2 WAT 8301 120.471 119.354 19.479 1.00 0.00 H TER 42885 WAT 8301 ATOM 42885 O WAT 8302 57.752 57.768 130.247 1.00 0.00 O ATOM 42886 H1 WAT 8302 57.910 57.383 129.385 1.00 0.00 H ATOM 42887 H2 WAT 8302 58.074 58.666 130.170 1.00 0.00 H TER 42889 WAT 8302 ATOM 42889 O WAT 8303 104.659 22.207 158.866 1.00 0.00 O ATOM 42890 H1 WAT 8303 104.264 22.300 157.999 1.00 0.00 H ATOM 42891 H2 WAT 8303 105.315 21.518 158.757 1.00 0.00 H TER 42893 WAT 8303 ATOM 42893 O WAT 8304 84.019 1.114 123.613 1.00 0.00 O ATOM 42894 H1 WAT 8304 84.755 0.540 123.400 1.00 0.00 H ATOM 42895 H2 WAT 8304 84.137 1.875 123.045 1.00 0.00 H TER 42897 WAT 8304 ATOM 42897 O WAT 8305 97.659 81.557 21.956 1.00 0.00 O ATOM 42898 H1 WAT 8305 98.140 80.738 21.840 1.00 0.00 H ATOM 42899 H2 WAT 8305 97.373 81.540 22.870 1.00 0.00 H TER 42901 WAT 8305 ATOM 42901 O WAT 8306 22.223 37.518 144.514 1.00 0.00 O ATOM 42902 H1 WAT 8306 22.040 37.482 143.575 1.00 0.00 H ATOM 42903 H2 WAT 8306 22.200 38.452 144.726 1.00 0.00 H TER 42905 WAT 8306 ATOM 42905 O WAT 8307 145.281 10.426 65.303 1.00 0.00 O ATOM 42906 H1 WAT 8307 145.137 9.966 66.130 1.00 0.00 H ATOM 42907 H2 WAT 8307 144.836 9.888 64.648 1.00 0.00 H TER 42909 WAT 8307 ATOM 42909 O WAT 8308 118.558 136.071 148.214 1.00 0.00 O ATOM 42910 H1 WAT 8308 119.207 136.753 148.042 1.00 0.00 H ATOM 42911 H2 WAT 8308 118.474 135.605 147.383 1.00 0.00 H TER 42913 WAT 8308 ATOM 42913 O WAT 8309 102.080 54.249 139.744 1.00 0.00 O ATOM 42914 H1 WAT 8309 101.460 54.903 140.068 1.00 0.00 H ATOM 42915 H2 WAT 8309 101.882 54.174 138.810 1.00 0.00 H TER 42917 WAT 8309 ATOM 42917 O WAT 8310 119.046 80.151 130.607 1.00 0.00 O ATOM 42918 H1 WAT 8310 119.339 79.298 130.928 1.00 0.00 H ATOM 42919 H2 WAT 8310 119.439 80.228 129.738 1.00 0.00 H TER 42921 WAT 8310 ATOM 42921 O WAT 8311 62.288 134.398 134.344 1.00 0.00 O ATOM 42922 H1 WAT 8311 61.788 134.473 133.531 1.00 0.00 H ATOM 42923 H2 WAT 8311 62.262 133.465 134.556 1.00 0.00 H TER 42925 WAT 8311 ATOM 42925 O WAT 8312 4.863 124.815 127.362 1.00 0.00 O ATOM 42926 H1 WAT 8312 4.851 124.130 128.030 1.00 0.00 H ATOM 42927 H2 WAT 8312 4.810 125.633 127.857 1.00 0.00 H TER 42929 WAT 8312 ATOM 42929 O WAT 8313 65.382 83.208 115.433 1.00 0.00 O ATOM 42930 H1 WAT 8313 65.661 83.976 115.932 1.00 0.00 H ATOM 42931 H2 WAT 8313 65.450 82.483 116.054 1.00 0.00 H TER 42933 WAT 8313 ATOM 42933 O WAT 8314 128.280 17.423 87.711 1.00 0.00 O ATOM 42934 H1 WAT 8314 127.840 17.576 86.875 1.00 0.00 H ATOM 42935 H2 WAT 8314 129.157 17.124 87.469 1.00 0.00 H TER 42937 WAT 8314 ATOM 42937 O WAT 8315 16.342 7.219 16.538 1.00 0.00 O ATOM 42938 H1 WAT 8315 15.560 7.197 15.986 1.00 0.00 H ATOM 42939 H2 WAT 8315 16.891 6.510 16.203 1.00 0.00 H TER 42941 WAT 8315 ATOM 42941 O WAT 8316 64.251 0.161 52.087 1.00 0.00 O ATOM 42942 H1 WAT 8316 63.923 1.053 52.203 1.00 0.00 H ATOM 42943 H2 WAT 8316 63.833 -0.144 51.282 1.00 0.00 H TER 42945 WAT 8316 ATOM 42945 O WAT 8317 80.430 73.211 9.825 1.00 0.00 O ATOM 42946 H1 WAT 8317 81.269 73.036 10.249 1.00 0.00 H ATOM 42947 H2 WAT 8317 79.808 72.643 10.280 1.00 0.00 H TER 42949 WAT 8317 ATOM 42949 O WAT 8318 95.924 140.571 20.313 1.00 0.00 O ATOM 42950 H1 WAT 8318 95.835 140.727 21.253 1.00 0.00 H ATOM 42951 H2 WAT 8318 96.171 141.423 19.952 1.00 0.00 H TER 42953 WAT 8318 ATOM 42953 O WAT 8319 66.004 22.354 113.461 1.00 0.00 O ATOM 42954 H1 WAT 8319 66.168 22.922 114.214 1.00 0.00 H ATOM 42955 H2 WAT 8319 66.656 21.657 113.540 1.00 0.00 H TER 42957 WAT 8319 ATOM 42957 O WAT 8320 116.878 130.237 94.035 1.00 0.00 O ATOM 42958 H1 WAT 8320 117.639 129.701 93.811 1.00 0.00 H ATOM 42959 H2 WAT 8320 117.211 130.872 94.669 1.00 0.00 H TER 42961 WAT 8320 ATOM 42961 O WAT 8321 19.089 27.438 130.947 1.00 0.00 O ATOM 42962 H1 WAT 8321 19.942 27.706 130.605 1.00 0.00 H ATOM 42963 H2 WAT 8321 18.734 26.856 130.276 1.00 0.00 H TER 42965 WAT 8321 ATOM 42965 O WAT 8322 60.957 11.861 100.886 1.00 0.00 O ATOM 42966 H1 WAT 8322 60.351 11.386 101.455 1.00 0.00 H ATOM 42967 H2 WAT 8322 60.760 12.785 101.046 1.00 0.00 H TER 42969 WAT 8322 ATOM 42969 O WAT 8323 79.879 22.908 156.144 1.00 0.00 O ATOM 42970 H1 WAT 8323 79.965 22.374 156.933 1.00 0.00 H ATOM 42971 H2 WAT 8323 80.460 23.653 156.295 1.00 0.00 H TER 42973 WAT 8323 ATOM 42973 O WAT 8324 62.612 137.892 132.865 1.00 0.00 O ATOM 42974 H1 WAT 8324 61.982 138.611 132.811 1.00 0.00 H ATOM 42975 H2 WAT 8324 63.389 138.221 132.411 1.00 0.00 H TER 42977 WAT 8324 ATOM 42977 O WAT 8325 102.331 27.880 103.022 1.00 0.00 O ATOM 42978 H1 WAT 8325 102.258 27.049 102.552 1.00 0.00 H ATOM 42979 H2 WAT 8325 101.433 28.212 103.062 1.00 0.00 H TER 42981 WAT 8325 ATOM 42981 O WAT 8326 78.856 64.668 94.540 1.00 0.00 O ATOM 42982 H1 WAT 8326 78.875 65.446 93.982 1.00 0.00 H ATOM 42983 H2 WAT 8326 78.726 65.011 95.424 1.00 0.00 H TER 42985 WAT 8326 ATOM 42985 O WAT 8327 112.425 82.983 29.227 1.00 0.00 O ATOM 42986 H1 WAT 8327 112.173 83.903 29.299 1.00 0.00 H ATOM 42987 H2 WAT 8327 111.616 82.499 29.395 1.00 0.00 H TER 42989 WAT 8327 ATOM 42989 O WAT 8328 74.329 69.061 115.826 1.00 0.00 O ATOM 42990 H1 WAT 8328 74.546 69.329 116.719 1.00 0.00 H ATOM 42991 H2 WAT 8328 73.924 69.835 115.436 1.00 0.00 H TER 42993 WAT 8328 ATOM 42993 O WAT 8329 58.621 99.701 138.223 1.00 0.00 O ATOM 42994 H1 WAT 8329 58.420 100.506 138.702 1.00 0.00 H ATOM 42995 H2 WAT 8329 59.228 99.229 138.793 1.00 0.00 H TER 42997 WAT 8329 ATOM 42997 O WAT 8330 50.957 104.406 12.775 1.00 0.00 O ATOM 42998 H1 WAT 8330 50.575 103.655 13.230 1.00 0.00 H ATOM 42999 H2 WAT 8330 51.204 105.010 13.475 1.00 0.00 H TER 43001 WAT 8330 ATOM 43001 O WAT 8331 91.453 116.425 101.330 1.00 0.00 O ATOM 43002 H1 WAT 8331 91.378 116.548 102.276 1.00 0.00 H ATOM 43003 H2 WAT 8331 90.817 115.740 101.126 1.00 0.00 H TER 43005 WAT 8331 ATOM 43005 O WAT 8332 116.073 8.306 93.734 1.00 0.00 O ATOM 43006 H1 WAT 8332 116.027 7.427 94.110 1.00 0.00 H ATOM 43007 H2 WAT 8332 116.618 8.203 92.954 1.00 0.00 H TER 43009 WAT 8332 ATOM 43009 O WAT 8333 132.372 130.327 18.435 1.00 0.00 O ATOM 43010 H1 WAT 8333 132.043 131.117 18.006 1.00 0.00 H ATOM 43011 H2 WAT 8333 132.274 130.504 19.371 1.00 0.00 H TER 43013 WAT 8333 ATOM 43013 O WAT 8334 52.658 75.951 98.684 1.00 0.00 O ATOM 43014 H1 WAT 8334 51.845 76.188 98.238 1.00 0.00 H ATOM 43015 H2 WAT 8334 52.585 76.358 99.548 1.00 0.00 H TER 43017 WAT 8334 ATOM 43017 O WAT 8335 119.658 111.601 19.436 1.00 0.00 O ATOM 43018 H1 WAT 8335 119.279 111.067 18.738 1.00 0.00 H ATOM 43019 H2 WAT 8335 120.604 111.504 19.324 1.00 0.00 H TER 43021 WAT 8335 ATOM 43021 O WAT 8336 37.933 144.274 64.507 1.00 0.00 O ATOM 43022 H1 WAT 8336 37.280 144.058 65.172 1.00 0.00 H ATOM 43023 H2 WAT 8336 38.504 143.507 64.473 1.00 0.00 H TER 43025 WAT 8336 ATOM 43025 O WAT 8337 39.721 78.862 64.404 1.00 0.00 O ATOM 43026 H1 WAT 8337 40.018 79.097 63.525 1.00 0.00 H ATOM 43027 H2 WAT 8337 38.809 78.596 64.285 1.00 0.00 H TER 43029 WAT 8337 ATOM 43029 O WAT 8338 129.440 52.478 11.828 1.00 0.00 O ATOM 43030 H1 WAT 8338 129.549 52.269 10.900 1.00 0.00 H ATOM 43031 H2 WAT 8338 129.826 53.348 11.924 1.00 0.00 H TER 43033 WAT 8338 ATOM 43033 O WAT 8339 125.981 131.977 78.734 1.00 0.00 O ATOM 43034 H1 WAT 8339 125.160 131.610 79.061 1.00 0.00 H ATOM 43035 H2 WAT 8339 126.138 131.517 77.909 1.00 0.00 H TER 43037 WAT 8339 ATOM 43037 O WAT 8340 4.757 48.235 98.423 1.00 0.00 O ATOM 43038 H1 WAT 8340 5.672 48.082 98.189 1.00 0.00 H ATOM 43039 H2 WAT 8340 4.297 47.453 98.119 1.00 0.00 H TER 43041 WAT 8340 ATOM 43041 O WAT 8341 115.847 75.990 15.830 1.00 0.00 O ATOM 43042 H1 WAT 8341 114.995 75.616 15.606 1.00 0.00 H ATOM 43043 H2 WAT 8341 116.056 75.614 16.686 1.00 0.00 H TER 43045 WAT 8341 ATOM 43045 O WAT 8342 68.973 59.327 7.062 1.00 0.00 O ATOM 43046 H1 WAT 8342 68.811 58.429 6.770 1.00 0.00 H ATOM 43047 H2 WAT 8342 68.129 59.767 6.963 1.00 0.00 H TER 43049 WAT 8342 ATOM 43049 O WAT 8343 83.200 137.869 7.739 1.00 0.00 O ATOM 43050 H1 WAT 8343 83.145 137.022 8.182 1.00 0.00 H ATOM 43051 H2 WAT 8343 84.116 137.941 7.474 1.00 0.00 H TER 43053 WAT 8343 ATOM 43053 O WAT 8344 73.453 73.025 1.554 1.00 0.00 O ATOM 43054 H1 WAT 8344 72.976 73.646 1.004 1.00 0.00 H ATOM 43055 H2 WAT 8344 73.480 72.219 1.038 1.00 0.00 H TER 43057 WAT 8344 ATOM 43057 O WAT 8345 21.034 101.550 26.322 1.00 0.00 O ATOM 43058 H1 WAT 8345 20.180 101.947 26.146 1.00 0.00 H ATOM 43059 H2 WAT 8345 21.096 100.829 25.695 1.00 0.00 H TER 43061 WAT 8345 ATOM 43061 O WAT 8346 77.351 6.302 72.063 1.00 0.00 O ATOM 43062 H1 WAT 8346 77.383 5.753 71.279 1.00 0.00 H ATOM 43063 H2 WAT 8346 76.434 6.278 72.335 1.00 0.00 H TER 43065 WAT 8346 ATOM 43065 O WAT 8347 129.912 15.289 113.242 1.00 0.00 O ATOM 43066 H1 WAT 8347 130.267 14.602 112.677 1.00 0.00 H ATOM 43067 H2 WAT 8347 130.683 15.754 113.566 1.00 0.00 H TER 43069 WAT 8347 ATOM 43069 O WAT 8348 70.096 94.759 134.030 1.00 0.00 O ATOM 43070 H1 WAT 8348 69.710 94.294 133.288 1.00 0.00 H ATOM 43071 H2 WAT 8348 69.599 95.575 134.087 1.00 0.00 H TER 43073 WAT 8348 ATOM 43073 O WAT 8349 143.622 23.314 104.884 1.00 0.00 O ATOM 43074 H1 WAT 8349 143.850 23.580 105.774 1.00 0.00 H ATOM 43075 H2 WAT 8349 144.181 22.556 104.709 1.00 0.00 H TER 43077 WAT 8349 ATOM 43077 O WAT 8350 129.559 96.263 132.385 1.00 0.00 O ATOM 43078 H1 WAT 8350 128.771 95.762 132.598 1.00 0.00 H ATOM 43079 H2 WAT 8350 129.978 96.420 133.231 1.00 0.00 H TER 43081 WAT 8350 ATOM 43081 O WAT 8351 65.913 18.230 60.044 1.00 0.00 O ATOM 43082 H1 WAT 8351 65.151 17.837 59.618 1.00 0.00 H ATOM 43083 H2 WAT 8351 65.789 18.045 60.975 1.00 0.00 H TER 43085 WAT 8351 ATOM 43085 O WAT 8352 64.759 72.939 151.971 1.00 0.00 O ATOM 43086 H1 WAT 8352 64.650 72.718 152.896 1.00 0.00 H ATOM 43087 H2 WAT 8352 65.135 73.819 151.978 1.00 0.00 H TER 43089 WAT 8352 ATOM 43089 O WAT 8353 66.687 136.249 74.286 1.00 0.00 O ATOM 43090 H1 WAT 8353 67.445 135.667 74.356 1.00 0.00 H ATOM 43091 H2 WAT 8353 67.018 137.106 74.554 1.00 0.00 H TER 43093 WAT 8353 ATOM 43093 O WAT 8354 8.619 23.617 110.619 1.00 0.00 O ATOM 43094 H1 WAT 8354 7.679 23.770 110.712 1.00 0.00 H ATOM 43095 H2 WAT 8354 8.682 22.744 110.230 1.00 0.00 H TER 43097 WAT 8354 ATOM 43097 O WAT 8355 35.040 87.281 135.693 1.00 0.00 O ATOM 43098 H1 WAT 8355 35.101 86.333 135.811 1.00 0.00 H ATOM 43099 H2 WAT 8355 35.949 87.579 135.673 1.00 0.00 H TER 43101 WAT 8355 ATOM 43101 O WAT 8356 97.813 124.333 119.098 1.00 0.00 O ATOM 43102 H1 WAT 8356 97.842 125.290 119.117 1.00 0.00 H ATOM 43103 H2 WAT 8356 98.622 124.061 119.532 1.00 0.00 H TER 43105 WAT 8356 ATOM 43105 O WAT 8357 32.775 125.840 83.881 1.00 0.00 O ATOM 43106 H1 WAT 8357 32.821 126.531 83.220 1.00 0.00 H ATOM 43107 H2 WAT 8357 31.875 125.877 84.204 1.00 0.00 H TER 43109 WAT 8357 ATOM 43109 O WAT 8358 21.988 31.706 125.791 1.00 0.00 O ATOM 43110 H1 WAT 8358 22.329 30.854 125.519 1.00 0.00 H ATOM 43111 H2 WAT 8358 22.624 32.337 125.454 1.00 0.00 H TER 43113 WAT 8358 ATOM 43113 O WAT 8359 139.924 62.380 87.959 1.00 0.00 O ATOM 43114 H1 WAT 8359 139.472 62.352 87.115 1.00 0.00 H ATOM 43115 H2 WAT 8359 140.362 61.532 88.024 1.00 0.00 H TER 43117 WAT 8359 ATOM 43117 O WAT 8360 62.793 144.947 1.446 1.00 0.00 O ATOM 43118 H1 WAT 8360 62.828 144.014 1.658 1.00 0.00 H ATOM 43119 H2 WAT 8360 62.293 145.337 2.162 1.00 0.00 H TER 43121 WAT 8360 ATOM 43121 O WAT 8361 15.159 83.095 112.687 1.00 0.00 O ATOM 43122 H1 WAT 8361 15.172 82.252 112.233 1.00 0.00 H ATOM 43123 H2 WAT 8361 15.698 82.956 113.465 1.00 0.00 H TER 43125 WAT 8361 ATOM 43125 O WAT 8362 57.571 80.841 0.349 1.00 0.00 O ATOM 43126 H1 WAT 8362 56.752 80.854 0.845 1.00 0.00 H ATOM 43127 H2 WAT 8362 58.172 80.333 0.893 1.00 0.00 H TER 43129 WAT 8362 ATOM 43129 O WAT 8363 85.013 40.432 144.510 1.00 0.00 O ATOM 43130 H1 WAT 8363 85.481 41.203 144.190 1.00 0.00 H ATOM 43131 H2 WAT 8363 84.324 40.284 143.862 1.00 0.00 H TER 43133 WAT 8363 ATOM 43133 O WAT 8364 23.798 99.726 112.786 1.00 0.00 O ATOM 43134 H1 WAT 8364 24.467 99.230 113.258 1.00 0.00 H ATOM 43135 H2 WAT 8364 23.050 99.746 113.382 1.00 0.00 H TER 43137 WAT 8364 ATOM 43137 O WAT 8365 95.839 8.457 92.623 1.00 0.00 O ATOM 43138 H1 WAT 8365 96.430 8.862 93.258 1.00 0.00 H ATOM 43139 H2 WAT 8365 94.966 8.748 92.888 1.00 0.00 H TER 43141 WAT 8365 ATOM 43141 O WAT 8366 100.568 78.156 135.921 1.00 0.00 O ATOM 43142 H1 WAT 8366 100.635 78.527 135.042 1.00 0.00 H ATOM 43143 H2 WAT 8366 99.725 78.468 136.250 1.00 0.00 H TER 43145 WAT 8366 ATOM 43145 O WAT 8367 143.862 65.621 114.553 1.00 0.00 O ATOM 43146 H1 WAT 8367 144.810 65.598 114.422 1.00 0.00 H ATOM 43147 H2 WAT 8367 143.721 65.137 115.367 1.00 0.00 H TER 43149 WAT 8367 ATOM 43149 O WAT 8368 48.820 81.125 121.229 1.00 0.00 O ATOM 43150 H1 WAT 8368 48.968 81.051 122.172 1.00 0.00 H ATOM 43151 H2 WAT 8368 49.679 81.339 120.867 1.00 0.00 H TER 43153 WAT 8368 ATOM 43153 O WAT 8369 94.420 33.304 144.492 1.00 0.00 O ATOM 43154 H1 WAT 8369 93.500 33.066 144.611 1.00 0.00 H ATOM 43155 H2 WAT 8369 94.493 34.177 144.876 1.00 0.00 H TER 43157 WAT 8369 ATOM 43157 O WAT 8370 133.855 10.512 111.824 1.00 0.00 O ATOM 43158 H1 WAT 8370 134.451 9.998 111.280 1.00 0.00 H ATOM 43159 H2 WAT 8370 134.350 11.301 112.043 1.00 0.00 H TER 43161 WAT 8370 ATOM 43161 O WAT 8371 67.772 78.067 125.037 1.00 0.00 O ATOM 43162 H1 WAT 8371 67.832 79.018 125.129 1.00 0.00 H ATOM 43163 H2 WAT 8371 68.611 77.741 125.363 1.00 0.00 H TER 43165 WAT 8371 ATOM 43165 O WAT 8372 125.410 26.524 74.178 1.00 0.00 O ATOM 43166 H1 WAT 8372 125.719 26.865 75.018 1.00 0.00 H ATOM 43167 H2 WAT 8372 124.562 26.128 74.378 1.00 0.00 H TER 43169 WAT 8372 ATOM 43169 O WAT 8373 71.844 77.198 149.853 1.00 0.00 O ATOM 43170 H1 WAT 8373 71.435 77.539 150.648 1.00 0.00 H ATOM 43171 H2 WAT 8373 71.787 76.247 149.943 1.00 0.00 H TER 43173 WAT 8373 ATOM 43173 O WAT 8374 135.761 69.418 80.834 1.00 0.00 O ATOM 43174 H1 WAT 8374 135.048 68.835 80.572 1.00 0.00 H ATOM 43175 H2 WAT 8374 135.376 70.294 80.811 1.00 0.00 H TER 43177 WAT 8374 ATOM 43177 O WAT 8375 125.696 72.770 141.201 1.00 0.00 O ATOM 43178 H1 WAT 8375 125.172 73.140 140.490 1.00 0.00 H ATOM 43179 H2 WAT 8375 126.394 73.409 141.342 1.00 0.00 H TER 43181 WAT 8375 ATOM 43181 O WAT 8376 42.941 74.138 115.226 1.00 0.00 O ATOM 43182 H1 WAT 8376 43.031 73.233 114.929 1.00 0.00 H ATOM 43183 H2 WAT 8376 42.002 74.318 115.165 1.00 0.00 H TER 43185 WAT 8376 ATOM 43185 O WAT 8377 18.815 24.559 156.525 1.00 0.00 O ATOM 43186 H1 WAT 8377 18.841 24.089 157.358 1.00 0.00 H ATOM 43187 H2 WAT 8377 19.693 24.928 156.430 1.00 0.00 H TER 43189 WAT 8377 ATOM 43189 O WAT 8378 27.224 87.442 110.370 1.00 0.00 O ATOM 43190 H1 WAT 8378 27.912 86.872 110.025 1.00 0.00 H ATOM 43191 H2 WAT 8378 26.440 87.192 109.883 1.00 0.00 H TER 43193 WAT 8378 ATOM 43193 O WAT 8379 33.177 6.342 156.016 1.00 0.00 O ATOM 43194 H1 WAT 8379 33.565 6.954 156.641 1.00 0.00 H ATOM 43195 H2 WAT 8379 32.571 6.877 155.503 1.00 0.00 H TER 43197 WAT 8379 ATOM 43197 O WAT 8380 130.477 25.294 17.685 1.00 0.00 O ATOM 43198 H1 WAT 8380 129.649 25.701 17.940 1.00 0.00 H ATOM 43199 H2 WAT 8380 130.660 25.648 16.815 1.00 0.00 H TER 43201 WAT 8380 ATOM 43201 O WAT 8381 54.035 91.950 144.252 1.00 0.00 O ATOM 43202 H1 WAT 8381 53.319 92.054 143.625 1.00 0.00 H ATOM 43203 H2 WAT 8381 54.827 92.126 143.743 1.00 0.00 H TER 43205 WAT 8381 ATOM 43205 O WAT 8382 12.820 118.552 143.541 1.00 0.00 O ATOM 43206 H1 WAT 8382 12.189 118.978 144.122 1.00 0.00 H ATOM 43207 H2 WAT 8382 12.835 119.103 142.758 1.00 0.00 H TER 43209 WAT 8382 ATOM 43209 O WAT 8383 129.725 110.113 122.969 1.00 0.00 O ATOM 43210 H1 WAT 8383 129.934 110.888 122.448 1.00 0.00 H ATOM 43211 H2 WAT 8383 129.038 109.669 122.472 1.00 0.00 H TER 43213 WAT 8383 ATOM 43213 O WAT 8384 16.697 136.352 84.156 1.00 0.00 O ATOM 43214 H1 WAT 8384 15.983 136.519 83.540 1.00 0.00 H ATOM 43215 H2 WAT 8384 16.288 135.863 84.870 1.00 0.00 H TER 43217 WAT 8384 ATOM 43217 O WAT 8385 118.641 111.229 126.501 1.00 0.00 O ATOM 43218 H1 WAT 8385 118.869 111.046 125.590 1.00 0.00 H ATOM 43219 H2 WAT 8385 119.361 110.854 127.009 1.00 0.00 H TER 43221 WAT 8385 ATOM 43221 O WAT 8386 6.159 144.560 59.001 1.00 0.00 O ATOM 43222 H1 WAT 8386 6.046 145.296 58.399 1.00 0.00 H ATOM 43223 H2 WAT 8386 6.850 144.843 59.599 1.00 0.00 H TER 43225 WAT 8386 ATOM 43225 O WAT 8387 101.310 48.179 11.698 1.00 0.00 O ATOM 43226 H1 WAT 8387 100.661 48.861 11.871 1.00 0.00 H ATOM 43227 H2 WAT 8387 102.149 48.585 11.916 1.00 0.00 H TER 43229 WAT 8387 ATOM 43229 O WAT 8388 118.772 72.572 125.706 1.00 0.00 O ATOM 43230 H1 WAT 8388 119.174 71.710 125.601 1.00 0.00 H ATOM 43231 H2 WAT 8388 117.862 72.447 125.436 1.00 0.00 H TER 43233 WAT 8388 ATOM 43233 O WAT 8389 133.790 95.354 87.459 1.00 0.00 O ATOM 43234 H1 WAT 8389 134.737 95.254 87.553 1.00 0.00 H ATOM 43235 H2 WAT 8389 133.429 94.526 87.775 1.00 0.00 H TER 43237 WAT 8389 ATOM 43237 O WAT 8390 99.375 12.608 93.013 1.00 0.00 O ATOM 43238 H1 WAT 8390 100.109 13.002 93.484 1.00 0.00 H ATOM 43239 H2 WAT 8390 99.198 13.215 92.295 1.00 0.00 H TER 43241 WAT 8390 ATOM 43241 O WAT 8391 13.407 8.930 87.586 1.00 0.00 O ATOM 43242 H1 WAT 8391 13.953 9.713 87.658 1.00 0.00 H ATOM 43243 H2 WAT 8391 13.704 8.365 88.300 1.00 0.00 H TER 43245 WAT 8391 ATOM 43245 O WAT 8392 10.516 136.384 63.244 1.00 0.00 O ATOM 43246 H1 WAT 8392 10.047 136.620 62.444 1.00 0.00 H ATOM 43247 H2 WAT 8392 11.431 136.314 62.973 1.00 0.00 H TER 43249 WAT 8392 ATOM 43249 O WAT 8393 141.095 68.786 111.857 1.00 0.00 O ATOM 43250 H1 WAT 8393 140.781 67.904 111.658 1.00 0.00 H ATOM 43251 H2 WAT 8393 141.994 68.657 112.158 1.00 0.00 H TER 43253 WAT 8393 ATOM 43253 O WAT 8394 98.982 37.628 4.381 1.00 0.00 O ATOM 43254 H1 WAT 8394 99.629 38.114 3.869 1.00 0.00 H ATOM 43255 H2 WAT 8394 99.198 36.708 4.227 1.00 0.00 H TER 43257 WAT 8394 ATOM 43257 O WAT 8395 141.803 117.157 156.661 1.00 0.00 O ATOM 43258 H1 WAT 8395 142.063 117.787 157.333 1.00 0.00 H ATOM 43259 H2 WAT 8395 142.618 116.717 156.419 1.00 0.00 H TER 43261 WAT 8395 ATOM 43261 O WAT 8396 39.339 115.747 12.598 1.00 0.00 O ATOM 43262 H1 WAT 8396 38.897 116.595 12.643 1.00 0.00 H ATOM 43263 H2 WAT 8396 38.661 115.111 12.823 1.00 0.00 H TER 43265 WAT 8396 ATOM 43265 O WAT 8397 47.065 39.205 6.243 1.00 0.00 O ATOM 43266 H1 WAT 8397 47.977 39.275 5.961 1.00 0.00 H ATOM 43267 H2 WAT 8397 46.706 38.492 5.715 1.00 0.00 H TER 43269 WAT 8397 ATOM 43269 O WAT 8398 11.678 5.344 123.740 1.00 0.00 O ATOM 43270 H1 WAT 8398 11.807 6.274 123.929 1.00 0.00 H ATOM 43271 H2 WAT 8398 10.728 5.241 123.684 1.00 0.00 H TER 43273 WAT 8398 ATOM 43273 O WAT 8399 124.047 60.292 25.767 1.00 0.00 O ATOM 43274 H1 WAT 8399 124.870 60.377 25.286 1.00 0.00 H ATOM 43275 H2 WAT 8399 123.464 60.932 25.359 1.00 0.00 H TER 43277 WAT 8399 ATOM 43277 O WAT 8400 87.442 145.979 11.088 1.00 0.00 O ATOM 43278 H1 WAT 8400 88.278 145.513 11.094 1.00 0.00 H ATOM 43279 H2 WAT 8400 86.835 145.377 10.657 1.00 0.00 H TER 43281 WAT 8400 ATOM 43281 O WAT 8401 23.135 138.261 125.943 1.00 0.00 O ATOM 43282 H1 WAT 8401 22.214 138.322 125.688 1.00 0.00 H ATOM 43283 H2 WAT 8401 23.116 138.207 126.898 1.00 0.00 H TER 43285 WAT 8401 ATOM 43285 O WAT 8402 86.105 108.626 117.615 1.00 0.00 O ATOM 43286 H1 WAT 8402 85.833 108.882 118.497 1.00 0.00 H ATOM 43287 H2 WAT 8402 86.218 109.454 117.149 1.00 0.00 H TER 43289 WAT 8402 ATOM 43289 O WAT 8403 135.374 117.276 109.652 1.00 0.00 O ATOM 43290 H1 WAT 8403 135.267 116.475 110.165 1.00 0.00 H ATOM 43291 H2 WAT 8403 136.243 117.195 109.260 1.00 0.00 H TER 43293 WAT 8403 ATOM 43293 O WAT 8404 85.104 87.230 81.348 1.00 0.00 O ATOM 43294 H1 WAT 8404 85.730 87.665 80.769 1.00 0.00 H ATOM 43295 H2 WAT 8404 85.570 86.458 81.668 1.00 0.00 H TER 43297 WAT 8404 ATOM 43297 O WAT 8405 11.715 16.421 147.353 1.00 0.00 O ATOM 43298 H1 WAT 8405 11.628 17.271 146.921 1.00 0.00 H ATOM 43299 H2 WAT 8405 11.213 16.512 148.163 1.00 0.00 H TER 43301 WAT 8405 ATOM 43301 O WAT 8406 3.773 81.457 120.985 1.00 0.00 O ATOM 43302 H1 WAT 8406 3.310 80.796 120.469 1.00 0.00 H ATOM 43303 H2 WAT 8406 3.727 82.251 120.453 1.00 0.00 H TER 43305 WAT 8406 ATOM 43305 O WAT 8407 89.042 12.680 99.541 1.00 0.00 O ATOM 43306 H1 WAT 8407 88.664 13.128 100.298 1.00 0.00 H ATOM 43307 H2 WAT 8407 88.285 12.415 99.018 1.00 0.00 H TER 43309 WAT 8407 ATOM 43309 O WAT 8408 81.898 116.922 95.292 1.00 0.00 O ATOM 43310 H1 WAT 8408 82.685 116.410 95.104 1.00 0.00 H ATOM 43311 H2 WAT 8408 82.112 117.807 94.998 1.00 0.00 H TER 43313 WAT 8408 ATOM 43313 O WAT 8409 14.923 110.192 151.203 1.00 0.00 O ATOM 43314 H1 WAT 8409 15.438 109.985 151.983 1.00 0.00 H ATOM 43315 H2 WAT 8409 14.699 111.117 151.302 1.00 0.00 H TER 43317 WAT 8409 ATOM 43317 O WAT 8410 128.254 15.748 59.594 1.00 0.00 O ATOM 43318 H1 WAT 8410 128.349 14.878 59.208 1.00 0.00 H ATOM 43319 H2 WAT 8410 127.694 16.223 58.981 1.00 0.00 H TER 43321 WAT 8410 ATOM 43321 O WAT 8411 78.622 140.810 19.344 1.00 0.00 O ATOM 43322 H1 WAT 8411 79.069 140.366 20.065 1.00 0.00 H ATOM 43323 H2 WAT 8411 78.860 141.731 19.447 1.00 0.00 H TER 43325 WAT 8411 ATOM 43325 O WAT 8412 20.196 65.391 129.643 1.00 0.00 O ATOM 43326 H1 WAT 8412 20.475 66.212 129.237 1.00 0.00 H ATOM 43327 H2 WAT 8412 20.984 64.849 129.654 1.00 0.00 H TER 43329 WAT 8412 ATOM 43329 O WAT 8413 115.094 53.845 134.164 1.00 0.00 O ATOM 43330 H1 WAT 8413 115.718 54.204 134.795 1.00 0.00 H ATOM 43331 H2 WAT 8413 114.324 53.624 134.687 1.00 0.00 H TER 43333 WAT 8413 ATOM 43333 O WAT 8414 31.291 42.567 52.480 1.00 0.00 O ATOM 43334 H1 WAT 8414 31.420 43.503 52.328 1.00 0.00 H ATOM 43335 H2 WAT 8414 32.024 42.313 53.041 1.00 0.00 H TER 43337 WAT 8414 ATOM 43337 O WAT 8415 7.143 3.321 82.315 1.00 0.00 O ATOM 43338 H1 WAT 8415 6.997 2.911 81.463 1.00 0.00 H ATOM 43339 H2 WAT 8415 8.014 3.022 82.578 1.00 0.00 H TER 43341 WAT 8415 ATOM 43341 O WAT 8416 58.838 126.964 12.327 1.00 0.00 O ATOM 43342 H1 WAT 8416 59.742 127.153 12.579 1.00 0.00 H ATOM 43343 H2 WAT 8416 58.308 127.513 12.904 1.00 0.00 H TER 43345 WAT 8416 ATOM 43345 O WAT 8417 71.778 22.216 4.855 1.00 0.00 O ATOM 43346 H1 WAT 8417 71.491 21.563 4.216 1.00 0.00 H ATOM 43347 H2 WAT 8417 71.231 22.981 4.677 1.00 0.00 H TER 43349 WAT 8417 ATOM 43349 O WAT 8418 124.052 86.833 118.823 1.00 0.00 O ATOM 43350 H1 WAT 8418 123.922 87.249 119.675 1.00 0.00 H ATOM 43351 H2 WAT 8418 123.174 86.568 118.549 1.00 0.00 H TER 43353 WAT 8418 ATOM 43353 O WAT 8419 71.291 49.483 142.053 1.00 0.00 O ATOM 43354 H1 WAT 8419 71.725 48.725 142.444 1.00 0.00 H ATOM 43355 H2 WAT 8419 70.672 49.776 142.722 1.00 0.00 H TER 43357 WAT 8419 ATOM 43357 O WAT 8420 98.746 0.851 148.675 1.00 0.00 O ATOM 43358 H1 WAT 8420 99.270 1.397 148.089 1.00 0.00 H ATOM 43359 H2 WAT 8420 99.353 0.593 149.368 1.00 0.00 H TER 43361 WAT 8420 ATOM 43361 O WAT 8421 113.211 95.193 131.747 1.00 0.00 O ATOM 43362 H1 WAT 8421 112.757 94.540 132.280 1.00 0.00 H ATOM 43363 H2 WAT 8421 112.548 95.859 131.567 1.00 0.00 H TER 43365 WAT 8421 ATOM 43365 O WAT 8422 6.705 126.106 67.851 1.00 0.00 O ATOM 43366 H1 WAT 8422 5.791 125.856 67.717 1.00 0.00 H ATOM 43367 H2 WAT 8422 6.727 127.044 67.662 1.00 0.00 H TER 43369 WAT 8422 ATOM 43369 O WAT 8423 129.104 62.777 109.039 1.00 0.00 O ATOM 43370 H1 WAT 8423 129.322 63.259 108.241 1.00 0.00 H ATOM 43371 H2 WAT 8423 128.625 63.408 109.577 1.00 0.00 H TER 43373 WAT 8423 ATOM 43373 O WAT 8424 92.688 110.379 84.982 1.00 0.00 O ATOM 43374 H1 WAT 8424 92.804 109.454 85.195 1.00 0.00 H ATOM 43375 H2 WAT 8424 93.114 110.846 85.702 1.00 0.00 H TER 43377 WAT 8424 ATOM 43377 O WAT 8425 121.290 122.438 141.121 1.00 0.00 O ATOM 43378 H1 WAT 8425 121.044 122.724 142.000 1.00 0.00 H ATOM 43379 H2 WAT 8425 120.572 121.868 140.845 1.00 0.00 H TER 43381 WAT 8425 ATOM 43381 O WAT 8426 125.654 25.247 12.688 1.00 0.00 O ATOM 43382 H1 WAT 8426 125.494 24.305 12.637 1.00 0.00 H ATOM 43383 H2 WAT 8426 125.253 25.514 13.515 1.00 0.00 H TER 43385 WAT 8426 ATOM 43385 O WAT 8427 70.404 92.247 87.070 1.00 0.00 O ATOM 43386 H1 WAT 8427 69.727 91.728 86.636 1.00 0.00 H ATOM 43387 H2 WAT 8427 70.460 93.050 86.552 1.00 0.00 H TER 43389 WAT 8427 ATOM 43389 O WAT 8428 37.273 31.230 1.812 1.00 0.00 O ATOM 43390 H1 WAT 8428 38.175 31.517 1.668 1.00 0.00 H ATOM 43391 H2 WAT 8428 37.327 30.275 1.834 1.00 0.00 H TER 43393 WAT 8428 ATOM 43393 O WAT 8429 37.371 98.875 157.657 1.00 0.00 O ATOM 43394 H1 WAT 8429 36.833 98.656 158.418 1.00 0.00 H ATOM 43395 H2 WAT 8429 36.921 99.617 157.252 1.00 0.00 H TER 43397 WAT 8429 ATOM 43397 O WAT 8430 134.335 104.558 152.314 1.00 0.00 O ATOM 43398 H1 WAT 8430 134.850 103.759 152.432 1.00 0.00 H ATOM 43399 H2 WAT 8430 133.550 104.417 152.843 1.00 0.00 H TER 43401 WAT 8430 ATOM 43401 O WAT 8431 133.551 42.859 137.092 1.00 0.00 O ATOM 43402 H1 WAT 8431 134.119 42.909 137.861 1.00 0.00 H ATOM 43403 H2 WAT 8431 132.925 43.573 137.211 1.00 0.00 H TER 43405 WAT 8431 ATOM 43405 O WAT 8432 139.143 43.716 109.735 1.00 0.00 O ATOM 43406 H1 WAT 8432 138.621 44.384 109.290 1.00 0.00 H ATOM 43407 H2 WAT 8432 138.734 42.887 109.486 1.00 0.00 H TER 43409 WAT 8432 ATOM 43409 O WAT 8433 51.177 65.861 155.960 1.00 0.00 O ATOM 43410 H1 WAT 8433 51.998 66.309 155.755 1.00 0.00 H ATOM 43411 H2 WAT 8433 50.619 66.544 156.331 1.00 0.00 H TER 43413 WAT 8433 ATOM 43413 O WAT 8434 89.932 145.210 65.226 1.00 0.00 O ATOM 43414 H1 WAT 8434 90.126 146.145 65.158 1.00 0.00 H ATOM 43415 H2 WAT 8434 90.222 144.968 66.105 1.00 0.00 H TER 43417 WAT 8434 ATOM 43417 O WAT 8435 132.431 79.057 90.389 1.00 0.00 O ATOM 43418 H1 WAT 8435 131.528 78.895 90.115 1.00 0.00 H ATOM 43419 H2 WAT 8435 132.572 78.454 91.119 1.00 0.00 H TER 43421 WAT 8435 ATOM 43421 O WAT 8436 55.117 103.197 60.641 1.00 0.00 O ATOM 43422 H1 WAT 8436 54.616 102.403 60.454 1.00 0.00 H ATOM 43423 H2 WAT 8436 55.881 102.889 61.129 1.00 0.00 H TER 43425 WAT 8436 ATOM 43425 O WAT 8437 35.325 68.889 96.483 1.00 0.00 O ATOM 43426 H1 WAT 8437 34.435 68.591 96.292 1.00 0.00 H ATOM 43427 H2 WAT 8437 35.332 69.809 96.218 1.00 0.00 H TER 43429 WAT 8437 ATOM 43429 O WAT 8438 53.324 112.857 125.340 1.00 0.00 O ATOM 43430 H1 WAT 8438 52.776 112.519 124.632 1.00 0.00 H ATOM 43431 H2 WAT 8438 53.247 112.204 126.035 1.00 0.00 H TER 43433 WAT 8438 ATOM 43433 O WAT 8439 120.650 104.433 112.763 1.00 0.00 O ATOM 43434 H1 WAT 8439 120.193 103.701 112.350 1.00 0.00 H ATOM 43435 H2 WAT 8439 120.982 104.075 113.586 1.00 0.00 H TER 43437 WAT 8439 ATOM 43437 O WAT 8440 11.786 46.164 122.840 1.00 0.00 O ATOM 43438 H1 WAT 8440 11.449 46.126 121.945 1.00 0.00 H ATOM 43439 H2 WAT 8440 12.476 46.827 122.808 1.00 0.00 H TER 43441 WAT 8440 ATOM 43441 O WAT 8441 47.173 95.020 101.998 1.00 0.00 O ATOM 43442 H1 WAT 8441 47.151 95.963 101.836 1.00 0.00 H ATOM 43443 H2 WAT 8441 48.048 94.857 102.350 1.00 0.00 H TER 43445 WAT 8441 ATOM 43445 O WAT 8442 15.959 17.038 110.286 1.00 0.00 O ATOM 43446 H1 WAT 8442 16.816 17.108 110.706 1.00 0.00 H ATOM 43447 H2 WAT 8442 15.360 16.820 111.000 1.00 0.00 H TER 43449 WAT 8442 ATOM 43449 O WAT 8443 63.131 99.727 121.857 1.00 0.00 O ATOM 43450 H1 WAT 8443 63.096 99.818 122.809 1.00 0.00 H ATOM 43451 H2 WAT 8443 64.062 99.633 121.659 1.00 0.00 H TER 43453 WAT 8443 ATOM 43453 O WAT 8444 80.314 49.959 12.868 1.00 0.00 O ATOM 43454 H1 WAT 8444 80.430 50.371 13.724 1.00 0.00 H ATOM 43455 H2 WAT 8444 80.881 50.460 12.282 1.00 0.00 H TER 43457 WAT 8444 ATOM 43457 O WAT 8445 86.866 135.015 129.904 1.00 0.00 O ATOM 43458 H1 WAT 8445 87.621 134.478 130.143 1.00 0.00 H ATOM 43459 H2 WAT 8445 87.244 135.794 129.496 1.00 0.00 H TER 43461 WAT 8445 ATOM 43461 O WAT 8446 55.018 112.144 1.331 1.00 0.00 O ATOM 43462 H1 WAT 8446 54.344 112.632 0.858 1.00 0.00 H ATOM 43463 H2 WAT 8446 55.583 111.790 0.644 1.00 0.00 H TER 43465 WAT 8446 ATOM 43465 O WAT 8447 118.995 37.091 3.304 1.00 0.00 O ATOM 43466 H1 WAT 8447 119.520 36.946 2.517 1.00 0.00 H ATOM 43467 H2 WAT 8447 119.638 37.273 3.990 1.00 0.00 H TER 43469 WAT 8447 ATOM 43469 O WAT 8448 1.804 47.590 68.489 1.00 0.00 O ATOM 43470 H1 WAT 8448 1.239 46.999 67.991 1.00 0.00 H ATOM 43471 H2 WAT 8448 1.353 48.433 68.462 1.00 0.00 H TER 43473 WAT 8448 ATOM 43473 O WAT 8449 94.824 18.134 128.603 1.00 0.00 O ATOM 43474 H1 WAT 8449 94.465 18.404 127.758 1.00 0.00 H ATOM 43475 H2 WAT 8449 95.667 17.735 128.390 1.00 0.00 H TER 43477 WAT 8449 ATOM 43477 O WAT 8450 85.931 52.075 113.293 1.00 0.00 O ATOM 43478 H1 WAT 8450 86.464 51.301 113.113 1.00 0.00 H ATOM 43479 H2 WAT 8450 86.335 52.471 114.065 1.00 0.00 H TER 43481 WAT 8450 ATOM 43481 O WAT 8451 58.813 13.189 73.123 1.00 0.00 O ATOM 43482 H1 WAT 8451 58.846 13.571 74.000 1.00 0.00 H ATOM 43483 H2 WAT 8451 59.169 13.869 72.552 1.00 0.00 H TER 43485 WAT 8451 ATOM 43485 O WAT 8452 57.656 96.711 0.987 1.00 0.00 O ATOM 43486 H1 WAT 8452 57.666 95.850 0.568 1.00 0.00 H ATOM 43487 H2 WAT 8452 56.728 96.935 1.052 1.00 0.00 H TER 43489 WAT 8452 ATOM 43489 O WAT 8453 88.076 121.456 61.947 1.00 0.00 O ATOM 43490 H1 WAT 8453 87.522 120.698 62.134 1.00 0.00 H ATOM 43491 H2 WAT 8453 87.712 121.827 61.143 1.00 0.00 H TER 43493 WAT 8453 ATOM 43493 O WAT 8454 76.954 8.712 20.852 1.00 0.00 O ATOM 43494 H1 WAT 8454 76.126 8.899 21.296 1.00 0.00 H ATOM 43495 H2 WAT 8454 77.186 9.534 20.420 1.00 0.00 H TER 43497 WAT 8454 ATOM 43497 O WAT 8455 125.494 130.642 137.267 1.00 0.00 O ATOM 43498 H1 WAT 8455 126.451 130.616 137.297 1.00 0.00 H ATOM 43499 H2 WAT 8455 125.253 129.918 136.690 1.00 0.00 H TER 43501 WAT 8455 ATOM 43501 O WAT 8456 41.852 128.523 15.503 1.00 0.00 O ATOM 43502 H1 WAT 8456 42.544 129.123 15.781 1.00 0.00 H ATOM 43503 H2 WAT 8456 42.162 127.659 15.774 1.00 0.00 H TER 43505 WAT 8456 ATOM 43505 O WAT 8457 50.885 105.037 106.679 1.00 0.00 O ATOM 43506 H1 WAT 8457 51.264 105.916 106.686 1.00 0.00 H ATOM 43507 H2 WAT 8457 50.288 105.028 107.427 1.00 0.00 H TER 43509 WAT 8457 ATOM 43509 O WAT 8458 114.748 11.576 127.839 1.00 0.00 O ATOM 43510 H1 WAT 8458 115.192 10.747 127.657 1.00 0.00 H ATOM 43511 H2 WAT 8458 115.366 12.064 128.383 1.00 0.00 H TER 43513 WAT 8458 ATOM 43513 O WAT 8459 27.384 137.817 98.315 1.00 0.00 O ATOM 43514 H1 WAT 8459 26.772 137.355 97.742 1.00 0.00 H ATOM 43515 H2 WAT 8459 26.970 138.665 98.474 1.00 0.00 H TER 43517 WAT 8459 ATOM 43517 O WAT 8460 93.961 74.186 79.355 1.00 0.00 O ATOM 43518 H1 WAT 8460 94.467 73.485 78.943 1.00 0.00 H ATOM 43519 H2 WAT 8460 93.647 73.805 80.175 1.00 0.00 H TER 43521 WAT 8460 ATOM 43521 O WAT 8461 38.669 69.588 93.111 1.00 0.00 O ATOM 43522 H1 WAT 8461 37.838 69.901 93.468 1.00 0.00 H ATOM 43523 H2 WAT 8461 39.170 69.313 93.879 1.00 0.00 H TER 43525 WAT 8461 ATOM 43525 O WAT 8462 5.479 131.593 107.719 1.00 0.00 O ATOM 43526 H1 WAT 8462 5.389 132.176 106.965 1.00 0.00 H ATOM 43527 H2 WAT 8462 4.956 132.006 108.406 1.00 0.00 H TER 43529 WAT 8462 ATOM 43529 O WAT 8463 87.516 129.807 131.510 1.00 0.00 O ATOM 43530 H1 WAT 8463 87.852 129.309 130.764 1.00 0.00 H ATOM 43531 H2 WAT 8463 86.964 129.185 131.984 1.00 0.00 H TER 43533 WAT 8463 ATOM 43533 O WAT 8464 73.520 144.159 59.777 1.00 0.00 O ATOM 43534 H1 WAT 8464 74.336 144.100 59.279 1.00 0.00 H ATOM 43535 H2 WAT 8464 72.958 144.726 59.248 1.00 0.00 H TER 43537 WAT 8464 ATOM 43537 O WAT 8465 6.009 72.698 112.970 1.00 0.00 O ATOM 43538 H1 WAT 8465 5.809 71.789 112.745 1.00 0.00 H ATOM 43539 H2 WAT 8465 6.797 72.643 113.510 1.00 0.00 H TER 43541 WAT 8465 ATOM 43541 O WAT 8466 131.879 123.372 118.670 1.00 0.00 O ATOM 43542 H1 WAT 8466 132.315 122.703 119.198 1.00 0.00 H ATOM 43543 H2 WAT 8466 131.324 123.843 119.292 1.00 0.00 H TER 43545 WAT 8466 ATOM 43545 O WAT 8467 18.194 81.503 112.235 1.00 0.00 O ATOM 43546 H1 WAT 8467 17.804 81.665 111.376 1.00 0.00 H ATOM 43547 H2 WAT 8467 18.103 80.559 112.365 1.00 0.00 H TER 43549 WAT 8467 ATOM 43549 O WAT 8468 46.143 125.792 23.979 1.00 0.00 O ATOM 43550 H1 WAT 8468 45.194 125.910 24.032 1.00 0.00 H ATOM 43551 H2 WAT 8468 46.262 124.846 23.892 1.00 0.00 H TER 43553 WAT 8468 ATOM 43553 O WAT 8469 20.373 70.839 85.956 1.00 0.00 O ATOM 43554 H1 WAT 8469 20.473 70.115 85.337 1.00 0.00 H ATOM 43555 H2 WAT 8469 21.216 71.291 85.933 1.00 0.00 H TER 43557 WAT 8469 ATOM 43557 O WAT 8470 139.503 119.721 5.549 1.00 0.00 O ATOM 43558 H1 WAT 8470 139.650 120.593 5.915 1.00 0.00 H ATOM 43559 H2 WAT 8470 140.370 119.434 5.260 1.00 0.00 H TER 43561 WAT 8470 ATOM 43561 O WAT 8471 45.082 14.342 73.631 1.00 0.00 O ATOM 43562 H1 WAT 8471 44.483 14.536 72.910 1.00 0.00 H ATOM 43563 H2 WAT 8471 44.764 14.878 74.357 1.00 0.00 H TER 43565 WAT 8471 ATOM 43565 O WAT 8472 72.968 138.332 146.903 1.00 0.00 O ATOM 43566 H1 WAT 8472 72.663 137.726 146.228 1.00 0.00 H ATOM 43567 H2 WAT 8472 73.654 137.850 147.365 1.00 0.00 H TER 43569 WAT 8472 ATOM 43569 O WAT 8473 60.471 92.890 16.568 1.00 0.00 O ATOM 43570 H1 WAT 8473 60.721 92.544 17.425 1.00 0.00 H ATOM 43571 H2 WAT 8473 60.767 93.801 16.582 1.00 0.00 H TER 43573 WAT 8473 ATOM 43573 O WAT 8474 47.669 63.006 95.389 1.00 0.00 O ATOM 43574 H1 WAT 8474 47.296 63.770 94.951 1.00 0.00 H ATOM 43575 H2 WAT 8474 47.340 63.059 96.286 1.00 0.00 H TER 43577 WAT 8474 ATOM 43577 O WAT 8475 47.003 104.552 142.585 1.00 0.00 O ATOM 43578 H1 WAT 8475 46.086 104.556 142.858 1.00 0.00 H ATOM 43579 H2 WAT 8475 47.495 104.653 143.400 1.00 0.00 H TER 43581 WAT 8475 ATOM 43581 O WAT 8476 88.493 103.178 140.848 1.00 0.00 O ATOM 43582 H1 WAT 8476 88.235 103.486 141.716 1.00 0.00 H ATOM 43583 H2 WAT 8476 89.438 103.044 140.912 1.00 0.00 H TER 43585 WAT 8476 ATOM 43585 O WAT 8477 86.464 87.456 77.768 1.00 0.00 O ATOM 43586 H1 WAT 8477 86.289 87.752 76.874 1.00 0.00 H ATOM 43587 H2 WAT 8477 86.325 88.233 78.309 1.00 0.00 H TER 43589 WAT 8477 ATOM 43589 O WAT 8478 50.543 19.635 80.263 1.00 0.00 O ATOM 43590 H1 WAT 8478 50.376 18.784 80.668 1.00 0.00 H ATOM 43591 H2 WAT 8478 50.233 20.272 80.907 1.00 0.00 H TER 43593 WAT 8478 ATOM 43593 O WAT 8479 41.515 43.942 60.762 1.00 0.00 O ATOM 43594 H1 WAT 8479 41.996 44.504 60.154 1.00 0.00 H ATOM 43595 H2 WAT 8479 41.238 43.196 60.230 1.00 0.00 H TER 43597 WAT 8479 ATOM 43597 O WAT 8480 142.598 136.588 118.030 1.00 0.00 O ATOM 43598 H1 WAT 8480 143.134 135.881 117.669 1.00 0.00 H ATOM 43599 H2 WAT 8480 142.286 137.067 117.262 1.00 0.00 H TER 43601 WAT 8480 ATOM 43601 O WAT 8481 49.923 115.743 133.001 1.00 0.00 O ATOM 43602 H1 WAT 8481 49.591 116.631 132.868 1.00 0.00 H ATOM 43603 H2 WAT 8481 49.218 115.175 132.692 1.00 0.00 H TER 43605 WAT 8481 ATOM 43605 O WAT 8482 18.999 123.056 146.302 1.00 0.00 O ATOM 43606 H1 WAT 8482 18.758 122.582 145.506 1.00 0.00 H ATOM 43607 H2 WAT 8482 18.611 122.545 147.012 1.00 0.00 H TER 43609 WAT 8482 ATOM 43609 O WAT 8483 2.014 5.207 111.487 1.00 0.00 O ATOM 43610 H1 WAT 8483 2.536 4.702 112.110 1.00 0.00 H ATOM 43611 H2 WAT 8483 1.107 5.026 111.732 1.00 0.00 H TER 43613 WAT 8483 ATOM 43613 O WAT 8484 93.200 116.573 66.503 1.00 0.00 O ATOM 43614 H1 WAT 8484 92.984 116.140 65.677 1.00 0.00 H ATOM 43615 H2 WAT 8484 92.870 115.979 67.178 1.00 0.00 H TER 43617 WAT 8484 ATOM 43617 O WAT 8485 126.432 101.617 109.940 1.00 0.00 O ATOM 43618 H1 WAT 8485 126.558 101.570 108.992 1.00 0.00 H ATOM 43619 H2 WAT 8485 127.318 101.612 110.300 1.00 0.00 H TER 43621 WAT 8485 ATOM 43621 O WAT 8486 5.805 50.855 136.700 1.00 0.00 O ATOM 43622 H1 WAT 8486 6.150 51.661 137.084 1.00 0.00 H ATOM 43623 H2 WAT 8486 5.393 50.398 137.434 1.00 0.00 H TER 43625 WAT 8486 ATOM 43625 O WAT 8487 115.079 39.543 94.350 1.00 0.00 O ATOM 43626 H1 WAT 8487 114.781 38.966 95.053 1.00 0.00 H ATOM 43627 H2 WAT 8487 114.588 39.256 93.580 1.00 0.00 H TER 43629 WAT 8487 ATOM 43629 O WAT 8488 137.228 52.676 67.513 1.00 0.00 O ATOM 43630 H1 WAT 8488 137.841 52.839 66.796 1.00 0.00 H ATOM 43631 H2 WAT 8488 136.477 53.237 67.318 1.00 0.00 H TER 43633 WAT 8488 ATOM 43633 O WAT 8489 17.334 69.906 120.542 1.00 0.00 O ATOM 43634 H1 WAT 8489 17.674 69.148 120.068 1.00 0.00 H ATOM 43635 H2 WAT 8489 17.346 70.616 119.899 1.00 0.00 H TER 43637 WAT 8489 ATOM 43637 O WAT 8490 98.491 101.219 110.943 1.00 0.00 O ATOM 43638 H1 WAT 8490 99.027 101.108 110.158 1.00 0.00 H ATOM 43639 H2 WAT 8490 99.107 101.510 111.616 1.00 0.00 H TER 43641 WAT 8490 ATOM 43641 O WAT 8491 136.510 141.838 78.665 1.00 0.00 O ATOM 43642 H1 WAT 8491 137.137 142.054 77.974 1.00 0.00 H ATOM 43643 H2 WAT 8491 136.106 141.020 78.375 1.00 0.00 H TER 43645 WAT 8491 ATOM 43645 O WAT 8492 74.913 48.984 147.267 1.00 0.00 O ATOM 43646 H1 WAT 8492 74.194 49.120 146.649 1.00 0.00 H ATOM 43647 H2 WAT 8492 75.066 48.039 147.251 1.00 0.00 H TER 43649 WAT 8492 ATOM 43649 O WAT 8493 66.913 123.946 101.394 1.00 0.00 O ATOM 43650 H1 WAT 8493 67.367 123.569 102.148 1.00 0.00 H ATOM 43651 H2 WAT 8493 66.756 123.203 100.812 1.00 0.00 H TER 43653 WAT 8493 ATOM 43653 O WAT 8494 10.884 137.829 68.015 1.00 0.00 O ATOM 43654 H1 WAT 8494 10.145 138.167 68.520 1.00 0.00 H ATOM 43655 H2 WAT 8494 11.547 138.517 68.070 1.00 0.00 H TER 43657 WAT 8494 ATOM 43657 O WAT 8495 32.449 44.950 51.366 1.00 0.00 O ATOM 43658 H1 WAT 8495 32.775 45.373 52.160 1.00 0.00 H ATOM 43659 H2 WAT 8495 32.871 44.091 51.362 1.00 0.00 H TER 43661 WAT 8495 ATOM 43661 O WAT 8496 80.558 56.723 3.235 1.00 0.00 O ATOM 43662 H1 WAT 8496 80.091 55.945 2.929 1.00 0.00 H ATOM 43663 H2 WAT 8496 81.153 56.395 3.909 1.00 0.00 H TER 43665 WAT 8496 ATOM 43665 O WAT 8497 87.504 8.762 112.815 1.00 0.00 O ATOM 43666 H1 WAT 8497 87.354 9.673 112.564 1.00 0.00 H ATOM 43667 H2 WAT 8497 87.103 8.682 113.680 1.00 0.00 H TER 43669 WAT 8497 ATOM 43669 O WAT 8498 144.601 66.962 108.585 1.00 0.00 O ATOM 43670 H1 WAT 8498 144.832 66.129 108.174 1.00 0.00 H ATOM 43671 H2 WAT 8498 143.676 66.870 108.810 1.00 0.00 H TER 43673 WAT 8498 ATOM 43673 O WAT 8499 65.886 113.883 131.087 1.00 0.00 O ATOM 43674 H1 WAT 8499 65.872 112.951 130.866 1.00 0.00 H ATOM 43675 H2 WAT 8499 66.816 114.108 131.114 1.00 0.00 H TER 43677 WAT 8499 ATOM 43677 O WAT 8500 108.252 63.876 65.888 1.00 0.00 O ATOM 43678 H1 WAT 8500 107.608 63.846 66.595 1.00 0.00 H ATOM 43679 H2 WAT 8500 107.735 64.038 65.099 1.00 0.00 H TER 43681 WAT 8500 ATOM 43681 O WAT 8501 12.452 3.256 134.147 1.00 0.00 O ATOM 43682 H1 WAT 8501 11.612 3.445 133.730 1.00 0.00 H ATOM 43683 H2 WAT 8501 12.614 2.333 133.952 1.00 0.00 H TER 43685 WAT 8501 ATOM 43685 O WAT 8502 31.186 19.957 86.720 1.00 0.00 O ATOM 43686 H1 WAT 8502 31.148 19.854 87.671 1.00 0.00 H ATOM 43687 H2 WAT 8502 30.421 19.482 86.396 1.00 0.00 H TER 43689 WAT 8502 ATOM 43689 O WAT 8503 28.387 53.677 86.392 1.00 0.00 O ATOM 43690 H1 WAT 8503 27.632 53.839 85.827 1.00 0.00 H ATOM 43691 H2 WAT 8503 28.877 52.987 85.946 1.00 0.00 H TER 43693 WAT 8503 ATOM 43693 O WAT 8504 133.272 22.694 120.696 1.00 0.00 O ATOM 43694 H1 WAT 8504 133.912 23.354 120.429 1.00 0.00 H ATOM 43695 H2 WAT 8504 133.447 21.945 120.126 1.00 0.00 H TER 43697 WAT 8504 ATOM 43697 O WAT 8505 73.711 130.911 100.276 1.00 0.00 O ATOM 43698 H1 WAT 8505 72.948 130.345 100.392 1.00 0.00 H ATOM 43699 H2 WAT 8505 74.055 131.034 101.160 1.00 0.00 H TER 43701 WAT 8505 ATOM 43701 O WAT 8506 69.875 106.196 153.944 1.00 0.00 O ATOM 43702 H1 WAT 8506 69.770 107.100 153.647 1.00 0.00 H ATOM 43703 H2 WAT 8506 69.230 106.098 154.645 1.00 0.00 H TER 43705 WAT 8506 ATOM 43705 O WAT 8507 78.481 4.537 100.126 1.00 0.00 O ATOM 43706 H1 WAT 8507 78.186 4.087 99.335 1.00 0.00 H ATOM 43707 H2 WAT 8507 78.396 5.467 99.919 1.00 0.00 H TER 43709 WAT 8507 ATOM 43709 O WAT 8508 116.149 20.052 111.091 1.00 0.00 O ATOM 43710 H1 WAT 8508 116.269 20.791 111.687 1.00 0.00 H ATOM 43711 H2 WAT 8508 115.878 20.452 110.265 1.00 0.00 H TER 43713 WAT 8508 ATOM 43713 O WAT 8509 77.190 36.738 100.593 1.00 0.00 O ATOM 43714 H1 WAT 8509 76.927 37.292 101.328 1.00 0.00 H ATOM 43715 H2 WAT 8509 77.282 37.344 99.857 1.00 0.00 H TER 43717 WAT 8509 ATOM 43717 O WAT 8510 34.429 50.469 142.187 1.00 0.00 O ATOM 43718 H1 WAT 8510 33.862 49.939 141.626 1.00 0.00 H ATOM 43719 H2 WAT 8510 33.888 51.218 142.435 1.00 0.00 H TER 43721 WAT 8510 ATOM 43721 O WAT 8511 98.337 36.265 138.518 1.00 0.00 O ATOM 43722 H1 WAT 8511 99.119 36.616 138.091 1.00 0.00 H ATOM 43723 H2 WAT 8511 97.890 37.036 138.868 1.00 0.00 H TER 43725 WAT 8511 ATOM 43725 O WAT 8512 108.677 13.998 87.230 1.00 0.00 O ATOM 43726 H1 WAT 8512 108.675 14.003 88.187 1.00 0.00 H ATOM 43727 H2 WAT 8512 108.792 14.916 86.986 1.00 0.00 H TER 43729 WAT 8512 ATOM 43729 O WAT 8513 108.413 111.679 112.952 1.00 0.00 O ATOM 43730 H1 WAT 8513 107.849 110.917 113.083 1.00 0.00 H ATOM 43731 H2 WAT 8513 108.536 112.040 113.830 1.00 0.00 H TER 43733 WAT 8513 ATOM 43733 O WAT 8514 90.004 60.617 63.889 1.00 0.00 O ATOM 43734 H1 WAT 8514 89.569 59.766 63.842 1.00 0.00 H ATOM 43735 H2 WAT 8514 90.282 60.794 62.991 1.00 0.00 H TER 43737 WAT 8514 ATOM 43737 O WAT 8515 116.388 80.819 62.687 1.00 0.00 O ATOM 43738 H1 WAT 8515 115.898 81.029 61.892 1.00 0.00 H ATOM 43739 H2 WAT 8515 117.087 80.237 62.391 1.00 0.00 H TER 43741 WAT 8515 ATOM 43741 O WAT 8516 42.838 2.691 122.604 1.00 0.00 O ATOM 43742 H1 WAT 8516 42.196 3.162 122.073 1.00 0.00 H ATOM 43743 H2 WAT 8516 43.276 2.106 121.985 1.00 0.00 H TER 43745 WAT 8516 ATOM 43745 O WAT 8517 25.635 63.762 82.269 1.00 0.00 O ATOM 43746 H1 WAT 8517 24.841 64.174 81.928 1.00 0.00 H ATOM 43747 H2 WAT 8517 25.437 63.586 83.189 1.00 0.00 H TER 43749 WAT 8517 ATOM 43749 O WAT 8518 110.745 102.939 94.109 1.00 0.00 O ATOM 43750 H1 WAT 8518 111.649 103.004 93.800 1.00 0.00 H ATOM 43751 H2 WAT 8518 110.220 102.919 93.309 1.00 0.00 H TER 43753 WAT 8518 ATOM 43753 O WAT 8519 130.500 63.881 65.527 1.00 0.00 O ATOM 43754 H1 WAT 8519 129.607 63.975 65.194 1.00 0.00 H ATOM 43755 H2 WAT 8519 130.758 64.769 65.775 1.00 0.00 H TER 43757 WAT 8519 ATOM 43757 O WAT 8520 23.706 29.914 69.835 1.00 0.00 O ATOM 43758 H1 WAT 8520 24.296 29.309 69.385 1.00 0.00 H ATOM 43759 H2 WAT 8520 23.432 30.531 69.156 1.00 0.00 H TER 43761 WAT 8520 ATOM 43761 O WAT 8521 37.169 72.257 137.579 1.00 0.00 O ATOM 43762 H1 WAT 8521 36.237 72.122 137.752 1.00 0.00 H ATOM 43763 H2 WAT 8521 37.614 71.735 138.246 1.00 0.00 H TER 43765 WAT 8521 ATOM 43765 O WAT 8522 38.050 133.555 148.836 1.00 0.00 O ATOM 43766 H1 WAT 8522 38.780 133.285 149.394 1.00 0.00 H ATOM 43767 H2 WAT 8522 38.383 134.312 148.355 1.00 0.00 H TER 43769 WAT 8522 ATOM 43769 O WAT 8523 130.053 73.415 125.750 1.00 0.00 O ATOM 43770 H1 WAT 8523 129.351 73.163 126.351 1.00 0.00 H ATOM 43771 H2 WAT 8523 129.737 73.146 124.887 1.00 0.00 H TER 43773 WAT 8523 ATOM 43773 O WAT 8524 137.423 106.125 145.218 1.00 0.00 O ATOM 43774 H1 WAT 8524 137.386 106.704 145.980 1.00 0.00 H ATOM 43775 H2 WAT 8524 137.699 105.280 145.573 1.00 0.00 H TER 43777 WAT 8524 ATOM 43777 O WAT 8525 135.473 88.583 101.302 1.00 0.00 O ATOM 43778 H1 WAT 8525 135.937 88.751 102.121 1.00 0.00 H ATOM 43779 H2 WAT 8525 135.985 87.898 100.872 1.00 0.00 H TER 43781 WAT 8525 ATOM 43781 O WAT 8526 22.950 56.435 139.634 1.00 0.00 O ATOM 43782 H1 WAT 8526 22.963 55.480 139.578 1.00 0.00 H ATOM 43783 H2 WAT 8526 22.418 56.711 138.887 1.00 0.00 H TER 43785 WAT 8526 ATOM 43785 O WAT 8527 93.979 87.844 21.690 1.00 0.00 O ATOM 43786 H1 WAT 8527 93.418 87.130 21.993 1.00 0.00 H ATOM 43787 H2 WAT 8527 93.373 88.483 21.315 1.00 0.00 H TER 43789 WAT 8527 ATOM 43789 O WAT 8528 143.089 143.504 130.205 1.00 0.00 O ATOM 43790 H1 WAT 8528 142.490 143.853 130.865 1.00 0.00 H ATOM 43791 H2 WAT 8528 142.757 142.626 130.020 1.00 0.00 H TER 43793 WAT 8528 ATOM 43793 O WAT 8529 41.153 48.876 141.281 1.00 0.00 O ATOM 43794 H1 WAT 8529 41.247 48.896 140.328 1.00 0.00 H ATOM 43795 H2 WAT 8529 41.723 48.162 141.563 1.00 0.00 H TER 43797 WAT 8529 ATOM 43797 O WAT 8530 35.766 126.724 120.050 1.00 0.00 O ATOM 43798 H1 WAT 8530 36.091 127.511 119.613 1.00 0.00 H ATOM 43799 H2 WAT 8530 34.913 126.980 120.400 1.00 0.00 H TER 43801 WAT 8530 ATOM 43801 O WAT 8531 89.266 60.684 115.542 1.00 0.00 O ATOM 43802 H1 WAT 8531 88.376 60.624 115.195 1.00 0.00 H ATOM 43803 H2 WAT 8531 89.489 61.612 115.471 1.00 0.00 H TER 43805 WAT 8531 ATOM 43805 O WAT 8532 88.371 128.322 74.709 1.00 0.00 O ATOM 43806 H1 WAT 8532 88.648 129.230 74.833 1.00 0.00 H ATOM 43807 H2 WAT 8532 88.179 128.008 75.592 1.00 0.00 H TER 43809 WAT 8532 ATOM 43809 O WAT 8533 74.520 57.557 111.952 1.00 0.00 O ATOM 43810 H1 WAT 8533 74.979 56.727 111.829 1.00 0.00 H ATOM 43811 H2 WAT 8533 73.926 57.396 112.685 1.00 0.00 H TER 43813 WAT 8533 ATOM 43813 O WAT 8534 102.117 85.610 79.947 1.00 0.00 O ATOM 43814 H1 WAT 8534 102.999 85.959 80.077 1.00 0.00 H ATOM 43815 H2 WAT 8534 102.254 84.685 79.743 1.00 0.00 H TER 43817 WAT 8534 ATOM 43817 O WAT 8535 135.851 63.765 3.580 1.00 0.00 O ATOM 43818 H1 WAT 8535 135.976 64.292 4.369 1.00 0.00 H ATOM 43819 H2 WAT 8535 135.506 62.932 3.900 1.00 0.00 H TER 43821 WAT 8535 ATOM 43821 O WAT 8536 98.417 127.285 125.841 1.00 0.00 O ATOM 43822 H1 WAT 8536 98.158 128.189 125.662 1.00 0.00 H ATOM 43823 H2 WAT 8536 97.852 126.758 125.277 1.00 0.00 H TER 43825 WAT 8536 ATOM 43825 O WAT 8537 109.240 10.746 115.424 1.00 0.00 O ATOM 43826 H1 WAT 8537 109.133 11.137 114.557 1.00 0.00 H ATOM 43827 H2 WAT 8537 108.589 10.045 115.453 1.00 0.00 H TER 43829 WAT 8537 ATOM 43829 O WAT 8538 123.705 13.107 109.688 1.00 0.00 O ATOM 43830 H1 WAT 8538 123.965 13.938 110.085 1.00 0.00 H ATOM 43831 H2 WAT 8538 124.042 13.153 108.793 1.00 0.00 H TER 43833 WAT 8538 ATOM 43833 O WAT 8539 138.958 104.447 21.089 1.00 0.00 O ATOM 43834 H1 WAT 8539 138.972 104.858 20.224 1.00 0.00 H ATOM 43835 H2 WAT 8539 138.138 103.953 21.105 1.00 0.00 H TER 43837 WAT 8539 ATOM 43837 O WAT 8540 62.591 142.879 84.181 1.00 0.00 O ATOM 43838 H1 WAT 8540 62.527 143.621 84.782 1.00 0.00 H ATOM 43839 H2 WAT 8540 61.708 142.509 84.162 1.00 0.00 H TER 43841 WAT 8540 ATOM 43841 O WAT 8541 10.264 100.328 64.425 1.00 0.00 O ATOM 43842 H1 WAT 8541 11.058 100.618 64.873 1.00 0.00 H ATOM 43843 H2 WAT 8541 10.025 101.062 63.860 1.00 0.00 H TER 43845 WAT 8541 ATOM 43845 O WAT 8542 132.013 102.613 129.045 1.00 0.00 O ATOM 43846 H1 WAT 8542 131.218 103.134 128.930 1.00 0.00 H ATOM 43847 H2 WAT 8542 132.677 103.073 128.531 1.00 0.00 H TER 43849 WAT 8542 ATOM 43849 O WAT 8543 27.968 114.765 97.602 1.00 0.00 O ATOM 43850 H1 WAT 8543 28.001 115.660 97.940 1.00 0.00 H ATOM 43851 H2 WAT 8543 27.650 114.243 98.339 1.00 0.00 H TER 43853 WAT 8543 ATOM 43853 O WAT 8544 118.132 103.722 133.191 1.00 0.00 O ATOM 43854 H1 WAT 8544 118.707 103.020 132.888 1.00 0.00 H ATOM 43855 H2 WAT 8544 117.863 103.449 134.068 1.00 0.00 H TER 43857 WAT 8544 ATOM 43857 O WAT 8545 38.500 140.013 149.772 1.00 0.00 O ATOM 43858 H1 WAT 8545 38.088 139.574 150.516 1.00 0.00 H ATOM 43859 H2 WAT 8545 37.804 140.552 149.396 1.00 0.00 H TER 43861 WAT 8545 ATOM 43861 O WAT 8546 129.959 71.845 105.827 1.00 0.00 O ATOM 43862 H1 WAT 8546 130.580 72.562 105.695 1.00 0.00 H ATOM 43863 H2 WAT 8546 129.725 71.899 106.754 1.00 0.00 H TER 43865 WAT 8546 ATOM 43865 O WAT 8547 120.612 114.997 1.457 1.00 0.00 O ATOM 43866 H1 WAT 8547 120.478 114.606 0.593 1.00 0.00 H ATOM 43867 H2 WAT 8547 120.333 114.320 2.073 1.00 0.00 H TER 43869 WAT 8547 ATOM 43869 O WAT 8548 46.240 116.043 92.007 1.00 0.00 O ATOM 43870 H1 WAT 8548 45.698 115.547 91.392 1.00 0.00 H ATOM 43871 H2 WAT 8548 45.938 115.763 92.871 1.00 0.00 H TER 43873 WAT 8548 ATOM 43873 O WAT 8549 60.147 74.134 156.015 1.00 0.00 O ATOM 43874 H1 WAT 8549 59.633 73.420 155.638 1.00 0.00 H ATOM 43875 H2 WAT 8549 59.685 74.929 155.750 1.00 0.00 H TER 43877 WAT 8549 ATOM 43877 O WAT 8550 125.464 22.840 151.425 1.00 0.00 O ATOM 43878 H1 WAT 8550 125.206 23.256 152.248 1.00 0.00 H ATOM 43879 H2 WAT 8550 126.207 22.285 151.660 1.00 0.00 H TER 43881 WAT 8550 ATOM 43881 O WAT 8551 59.575 76.605 12.858 1.00 0.00 O ATOM 43882 H1 WAT 8551 59.397 76.647 13.798 1.00 0.00 H ATOM 43883 H2 WAT 8551 58.848 76.098 12.498 1.00 0.00 H TER 43885 WAT 8551 ATOM 43885 O WAT 8552 28.562 9.939 17.074 1.00 0.00 O ATOM 43886 H1 WAT 8552 27.854 10.427 16.655 1.00 0.00 H ATOM 43887 H2 WAT 8552 28.820 10.483 17.818 1.00 0.00 H TER 43889 WAT 8552 ATOM 43889 O WAT 8553 87.931 20.835 105.909 1.00 0.00 O ATOM 43890 H1 WAT 8553 88.789 20.971 106.310 1.00 0.00 H ATOM 43891 H2 WAT 8553 87.817 19.885 105.903 1.00 0.00 H TER 43893 WAT 8553 ATOM 43893 O WAT 8554 27.806 40.138 154.692 1.00 0.00 O ATOM 43894 H1 WAT 8554 27.172 40.745 155.073 1.00 0.00 H ATOM 43895 H2 WAT 8554 27.296 39.618 154.071 1.00 0.00 H TER 43897 WAT 8554 ATOM 43897 O WAT 8555 15.908 110.935 98.342 1.00 0.00 O ATOM 43898 H1 WAT 8555 15.757 110.092 97.915 1.00 0.00 H ATOM 43899 H2 WAT 8555 15.208 111.003 98.992 1.00 0.00 H TER 43901 WAT 8555 ATOM 43901 O WAT 8556 64.636 13.265 125.700 1.00 0.00 O ATOM 43902 H1 WAT 8556 63.775 13.064 126.067 1.00 0.00 H ATOM 43903 H2 WAT 8556 65.253 12.811 126.274 1.00 0.00 H TER 43905 WAT 8556 ATOM 43905 O WAT 8557 74.056 116.710 76.938 1.00 0.00 O ATOM 43906 H1 WAT 8557 74.135 117.159 77.780 1.00 0.00 H ATOM 43907 H2 WAT 8557 73.113 116.638 76.792 1.00 0.00 H TER 43909 WAT 8557 ATOM 43909 O WAT 8558 65.420 12.856 59.359 1.00 0.00 O ATOM 43910 H1 WAT 8558 65.982 12.738 58.593 1.00 0.00 H ATOM 43911 H2 WAT 8558 65.032 11.994 59.506 1.00 0.00 H TER 43913 WAT 8558 ATOM 43913 O WAT 8559 54.192 50.702 95.336 1.00 0.00 O ATOM 43914 H1 WAT 8559 53.913 49.888 95.756 1.00 0.00 H ATOM 43915 H2 WAT 8559 53.378 51.172 95.158 1.00 0.00 H TER 43917 WAT 8559 ATOM 43917 O WAT 8560 15.209 35.523 122.837 1.00 0.00 O ATOM 43918 H1 WAT 8560 15.976 34.960 122.943 1.00 0.00 H ATOM 43919 H2 WAT 8560 14.569 34.974 122.385 1.00 0.00 H TER 43921 WAT 8560 ATOM 43921 O WAT 8561 15.531 122.689 95.447 1.00 0.00 O ATOM 43922 H1 WAT 8561 14.660 122.892 95.107 1.00 0.00 H ATOM 43923 H2 WAT 8561 15.749 121.842 95.058 1.00 0.00 H TER 43925 WAT 8561 ATOM 43925 O WAT 8562 55.834 3.505 147.493 1.00 0.00 O ATOM 43926 H1 WAT 8562 56.310 4.067 146.881 1.00 0.00 H ATOM 43927 H2 WAT 8562 56.317 2.678 147.483 1.00 0.00 H TER 43929 WAT 8562 ATOM 43929 O WAT 8563 37.071 135.179 104.394 1.00 0.00 O ATOM 43930 H1 WAT 8563 37.640 135.720 104.942 1.00 0.00 H ATOM 43931 H2 WAT 8563 36.188 135.350 104.721 1.00 0.00 H TER 43933 WAT 8563 ATOM 43933 O WAT 8564 65.838 48.230 119.994 1.00 0.00 O ATOM 43934 H1 WAT 8564 65.658 47.366 119.623 1.00 0.00 H ATOM 43935 H2 WAT 8564 66.350 48.677 119.320 1.00 0.00 H TER 43937 WAT 8564 ATOM 43937 O WAT 8565 37.630 106.427 154.659 1.00 0.00 O ATOM 43938 H1 WAT 8565 38.180 107.129 154.310 1.00 0.00 H ATOM 43939 H2 WAT 8565 36.745 106.790 154.651 1.00 0.00 H TER 43941 WAT 8565 ATOM 43941 O WAT 8566 115.793 122.295 68.139 1.00 0.00 O ATOM 43942 H1 WAT 8566 115.433 122.961 67.554 1.00 0.00 H ATOM 43943 H2 WAT 8566 115.172 122.255 68.867 1.00 0.00 H TER 43945 WAT 8566 ATOM 43945 O WAT 8567 137.409 53.963 5.340 1.00 0.00 O ATOM 43946 H1 WAT 8567 137.649 53.050 5.181 1.00 0.00 H ATOM 43947 H2 WAT 8567 136.909 54.218 4.564 1.00 0.00 H TER 43949 WAT 8567 ATOM 43949 O WAT 8568 48.047 85.372 88.751 1.00 0.00 O ATOM 43950 H1 WAT 8568 47.688 85.079 87.914 1.00 0.00 H ATOM 43951 H2 WAT 8568 48.150 84.570 89.263 1.00 0.00 H TER 43953 WAT 8568 ATOM 43953 O WAT 8569 45.813 140.884 101.006 1.00 0.00 O ATOM 43954 H1 WAT 8569 46.020 141.445 100.258 1.00 0.00 H ATOM 43955 H2 WAT 8569 46.666 140.613 101.345 1.00 0.00 H TER 43957 WAT 8569 ATOM 43957 O WAT 8570 23.644 72.983 154.374 1.00 0.00 O ATOM 43958 H1 WAT 8570 24.389 72.574 154.814 1.00 0.00 H ATOM 43959 H2 WAT 8570 23.198 72.259 153.934 1.00 0.00 H TER 43961 WAT 8570 ATOM 43961 O WAT 8571 36.294 1.395 4.660 1.00 0.00 O ATOM 43962 H1 WAT 8571 37.081 1.938 4.672 1.00 0.00 H ATOM 43963 H2 WAT 8571 35.579 2.012 4.502 1.00 0.00 H TER 43965 WAT 8571 ATOM 43965 O WAT 8572 123.955 96.962 96.447 1.00 0.00 O ATOM 43966 H1 WAT 8572 124.727 97.022 95.884 1.00 0.00 H ATOM 43967 H2 WAT 8572 124.245 96.441 97.195 1.00 0.00 H TER 43969 WAT 8572 ATOM 43969 O WAT 8573 33.623 11.978 154.164 1.00 0.00 O ATOM 43970 H1 WAT 8573 33.560 11.661 155.065 1.00 0.00 H ATOM 43971 H2 WAT 8573 33.283 12.872 154.201 1.00 0.00 H TER 43973 WAT 8573 ATOM 43973 O WAT 8574 107.541 36.013 107.811 1.00 0.00 O ATOM 43974 H1 WAT 8574 107.974 36.386 108.580 1.00 0.00 H ATOM 43975 H2 WAT 8574 107.609 36.696 107.144 1.00 0.00 H TER 43977 WAT 8574 ATOM 43977 O WAT 8575 81.927 144.146 122.992 1.00 0.00 O ATOM 43978 H1 WAT 8575 81.032 144.355 122.723 1.00 0.00 H ATOM 43979 H2 WAT 8575 82.462 144.839 122.607 1.00 0.00 H TER 43981 WAT 8575 ATOM 43981 O WAT 8576 20.061 129.315 92.582 1.00 0.00 O ATOM 43982 H1 WAT 8576 20.889 129.247 93.056 1.00 0.00 H ATOM 43983 H2 WAT 8576 19.476 128.705 93.032 1.00 0.00 H TER 43985 WAT 8576 ATOM 43985 O WAT 8577 139.867 121.525 105.243 1.00 0.00 O ATOM 43986 H1 WAT 8577 140.436 120.958 104.723 1.00 0.00 H ATOM 43987 H2 WAT 8577 140.402 121.776 105.996 1.00 0.00 H TER 43989 WAT 8577 ATOM 43989 O WAT 8578 86.518 24.888 100.579 1.00 0.00 O ATOM 43990 H1 WAT 8578 86.286 25.803 100.735 1.00 0.00 H ATOM 43991 H2 WAT 8578 85.876 24.388 101.083 1.00 0.00 H TER 43993 WAT 8578 ATOM 43993 O WAT 8579 93.680 41.362 115.236 1.00 0.00 O ATOM 43994 H1 WAT 8579 94.524 41.011 115.518 1.00 0.00 H ATOM 43995 H2 WAT 8579 93.427 40.810 114.496 1.00 0.00 H TER 43997 WAT 8579 ATOM 43997 O WAT 8580 46.721 93.401 90.788 1.00 0.00 O ATOM 43998 H1 WAT 8580 46.722 93.424 89.831 1.00 0.00 H ATOM 43999 H2 WAT 8580 47.061 94.257 91.049 1.00 0.00 H TER 44001 WAT 8580 ATOM 44001 O WAT 8581 143.707 106.298 2.409 1.00 0.00 O ATOM 44002 H1 WAT 8581 144.652 106.404 2.294 1.00 0.00 H ATOM 44003 H2 WAT 8581 143.622 105.713 3.162 1.00 0.00 H TER 44005 WAT 8581 ATOM 44005 O WAT 8582 61.677 19.441 87.951 1.00 0.00 O ATOM 44006 H1 WAT 8582 61.588 20.329 88.298 1.00 0.00 H ATOM 44007 H2 WAT 8582 60.962 18.952 88.359 1.00 0.00 H TER 44009 WAT 8582 ATOM 44009 O WAT 8583 52.299 6.249 110.651 1.00 0.00 O ATOM 44010 H1 WAT 8583 52.923 6.082 109.944 1.00 0.00 H ATOM 44011 H2 WAT 8583 52.076 5.379 110.982 1.00 0.00 H TER 44013 WAT 8583 ATOM 44013 O WAT 8584 42.905 39.054 24.376 1.00 0.00 O ATOM 44014 H1 WAT 8584 42.660 38.142 24.532 1.00 0.00 H ATOM 44015 H2 WAT 8584 42.071 39.514 24.283 1.00 0.00 H TER 44017 WAT 8584 ATOM 44017 O WAT 8585 29.536 104.432 81.431 1.00 0.00 O ATOM 44018 H1 WAT 8585 29.420 105.301 81.815 1.00 0.00 H ATOM 44019 H2 WAT 8585 30.392 104.472 81.003 1.00 0.00 H TER 44021 WAT 8585 ATOM 44021 O WAT 8586 6.503 81.221 149.334 1.00 0.00 O ATOM 44022 H1 WAT 8586 5.944 81.996 149.278 1.00 0.00 H ATOM 44023 H2 WAT 8586 7.320 81.483 148.910 1.00 0.00 H TER 44025 WAT 8586 ATOM 44025 O WAT 8587 109.714 94.148 129.933 1.00 0.00 O ATOM 44026 H1 WAT 8587 110.147 93.322 130.150 1.00 0.00 H ATOM 44027 H2 WAT 8587 109.723 94.645 130.751 1.00 0.00 H TER 44029 WAT 8587 ATOM 44029 O WAT 8588 43.836 107.206 3.606 1.00 0.00 O ATOM 44030 H1 WAT 8588 44.701 107.445 3.939 1.00 0.00 H ATOM 44031 H2 WAT 8588 43.741 107.715 2.801 1.00 0.00 H TER 44033 WAT 8588 ATOM 44033 O WAT 8589 93.713 19.305 126.464 1.00 0.00 O ATOM 44034 H1 WAT 8589 92.929 18.897 126.096 1.00 0.00 H ATOM 44035 H2 WAT 8589 93.379 20.021 127.005 1.00 0.00 H TER 44037 WAT 8589 ATOM 44037 O WAT 8590 42.175 60.623 112.826 1.00 0.00 O ATOM 44038 H1 WAT 8590 41.487 61.242 113.072 1.00 0.00 H ATOM 44039 H2 WAT 8590 42.517 60.302 113.660 1.00 0.00 H TER 44041 WAT 8590 ATOM 44041 O WAT 8591 114.093 86.180 151.347 1.00 0.00 O ATOM 44042 H1 WAT 8591 113.955 87.086 151.625 1.00 0.00 H ATOM 44043 H2 WAT 8591 113.213 85.845 151.176 1.00 0.00 H TER 44045 WAT 8591 ATOM 44045 O WAT 8592 103.793 21.823 105.011 1.00 0.00 O ATOM 44046 H1 WAT 8592 104.011 21.714 105.936 1.00 0.00 H ATOM 44047 H2 WAT 8592 103.692 20.929 104.682 1.00 0.00 H TER 44049 WAT 8592 ATOM 44049 O WAT 8593 52.124 132.817 10.953 1.00 0.00 O ATOM 44050 H1 WAT 8593 52.759 132.672 11.655 1.00 0.00 H ATOM 44051 H2 WAT 8593 51.412 132.206 11.144 1.00 0.00 H TER 44053 WAT 8593 ATOM 44053 O WAT 8594 58.579 116.665 130.725 1.00 0.00 O ATOM 44054 H1 WAT 8594 59.269 116.905 130.108 1.00 0.00 H ATOM 44055 H2 WAT 8594 57.765 116.895 130.276 1.00 0.00 H TER 44057 WAT 8594 ATOM 44057 O WAT 8595 136.263 107.433 87.505 1.00 0.00 O ATOM 44058 H1 WAT 8595 136.179 107.416 86.552 1.00 0.00 H ATOM 44059 H2 WAT 8595 136.466 108.345 87.712 1.00 0.00 H TER 44061 WAT 8595 ATOM 44061 O WAT 8596 16.917 60.484 73.483 1.00 0.00 O ATOM 44062 H1 WAT 8596 17.702 60.981 73.251 1.00 0.00 H ATOM 44063 H2 WAT 8596 16.194 61.093 73.330 1.00 0.00 H TER 44065 WAT 8596 ATOM 44065 O WAT 8597 87.195 55.227 103.755 1.00 0.00 O ATOM 44066 H1 WAT 8597 87.018 54.533 103.120 1.00 0.00 H ATOM 44067 H2 WAT 8597 87.962 55.681 103.406 1.00 0.00 H TER 44069 WAT 8597 ATOM 44069 O WAT 8598 14.416 15.359 22.087 1.00 0.00 O ATOM 44070 H1 WAT 8598 15.361 15.211 22.139 1.00 0.00 H ATOM 44071 H2 WAT 8598 14.048 14.494 21.908 1.00 0.00 H TER 44073 WAT 8598 ATOM 44073 O WAT 8599 10.214 133.346 12.751 1.00 0.00 O ATOM 44074 H1 WAT 8599 9.995 133.187 11.833 1.00 0.00 H ATOM 44075 H2 WAT 8599 11.134 133.609 12.736 1.00 0.00 H TER 44077 WAT 8599 ATOM 44077 O WAT 8600 106.847 57.901 119.831 1.00 0.00 O ATOM 44078 H1 WAT 8600 107.714 57.761 119.449 1.00 0.00 H ATOM 44079 H2 WAT 8600 106.837 57.348 120.612 1.00 0.00 H TER 44081 WAT 8600 ATOM 44081 O WAT 8601 67.774 93.124 14.060 1.00 0.00 O ATOM 44082 H1 WAT 8601 67.944 93.104 13.118 1.00 0.00 H ATOM 44083 H2 WAT 8601 68.341 92.443 14.420 1.00 0.00 H TER 44085 WAT 8601 ATOM 44085 O WAT 8602 133.512 134.924 89.701 1.00 0.00 O ATOM 44086 H1 WAT 8602 133.118 134.189 89.231 1.00 0.00 H ATOM 44087 H2 WAT 8602 134.432 134.913 89.436 1.00 0.00 H TER 44089 WAT 8602 ATOM 44089 O WAT 8603 123.102 132.612 126.119 1.00 0.00 O ATOM 44090 H1 WAT 8603 122.876 132.495 127.042 1.00 0.00 H ATOM 44091 H2 WAT 8603 124.033 132.394 126.071 1.00 0.00 H TER 44093 WAT 8603 ATOM 44093 O WAT 8604 70.240 129.440 77.118 1.00 0.00 O ATOM 44094 H1 WAT 8604 70.042 130.129 77.752 1.00 0.00 H ATOM 44095 H2 WAT 8604 70.674 128.759 77.631 1.00 0.00 H TER 44097 WAT 8604 ATOM 44097 O WAT 8605 65.155 11.252 52.585 1.00 0.00 O ATOM 44098 H1 WAT 8605 65.908 11.075 53.148 1.00 0.00 H ATOM 44099 H2 WAT 8605 64.465 11.528 53.188 1.00 0.00 H TER 44101 WAT 8605 ATOM 44101 O WAT 8606 103.564 33.420 151.294 1.00 0.00 O ATOM 44102 H1 WAT 8606 103.120 32.741 151.802 1.00 0.00 H ATOM 44103 H2 WAT 8606 102.942 33.648 150.603 1.00 0.00 H TER 44105 WAT 8606 ATOM 44105 O WAT 8607 7.286 86.968 99.434 1.00 0.00 O ATOM 44106 H1 WAT 8607 7.782 86.706 98.659 1.00 0.00 H ATOM 44107 H2 WAT 8607 7.954 87.179 100.086 1.00 0.00 H TER 44109 WAT 8607 ATOM 44109 O WAT 8608 121.764 104.324 59.595 1.00 0.00 O ATOM 44110 H1 WAT 8608 122.289 103.536 59.460 1.00 0.00 H ATOM 44111 H2 WAT 8608 120.859 104.029 59.492 1.00 0.00 H TER 44113 WAT 8608 ATOM 44113 O WAT 8609 105.431 7.322 80.558 1.00 0.00 O ATOM 44114 H1 WAT 8609 105.632 8.189 80.909 1.00 0.00 H ATOM 44115 H2 WAT 8609 106.035 6.734 81.010 1.00 0.00 H TER 44117 WAT 8609 ATOM 44117 O WAT 8610 123.351 134.707 92.280 1.00 0.00 O ATOM 44118 H1 WAT 8610 122.493 134.656 92.701 1.00 0.00 H ATOM 44119 H2 WAT 8610 123.331 134.021 91.613 1.00 0.00 H TER 44121 WAT 8610 ATOM 44121 O WAT 8611 80.272 3.716 96.252 1.00 0.00 O ATOM 44122 H1 WAT 8611 79.721 3.980 95.516 1.00 0.00 H ATOM 44123 H2 WAT 8611 80.443 4.529 96.727 1.00 0.00 H TER 44125 WAT 8611 ATOM 44125 O WAT 8612 65.482 137.464 99.747 1.00 0.00 O ATOM 44126 H1 WAT 8612 65.401 136.888 98.987 1.00 0.00 H ATOM 44127 H2 WAT 8612 66.022 138.192 99.440 1.00 0.00 H TER 44129 WAT 8612 ATOM 44129 O WAT 8613 1.212 40.944 92.141 1.00 0.00 O ATOM 44130 H1 WAT 8613 0.954 40.543 91.311 1.00 0.00 H ATOM 44131 H2 WAT 8613 0.997 40.285 92.802 1.00 0.00 H TER 44133 WAT 8613 ATOM 44133 O WAT 8614 81.580 39.831 148.868 1.00 0.00 O ATOM 44134 H1 WAT 8614 82.249 39.624 149.520 1.00 0.00 H ATOM 44135 H2 WAT 8614 82.074 40.107 148.096 1.00 0.00 H TER 44137 WAT 8614 ATOM 44137 O WAT 8615 26.941 68.932 4.859 1.00 0.00 O ATOM 44138 H1 WAT 8615 27.055 68.004 5.061 1.00 0.00 H ATOM 44139 H2 WAT 8615 26.474 68.940 4.024 1.00 0.00 H TER 44141 WAT 8615 ATOM 44141 O WAT 8616 142.116 72.802 127.127 1.00 0.00 O ATOM 44142 H1 WAT 8616 141.684 73.599 127.437 1.00 0.00 H ATOM 44143 H2 WAT 8616 141.398 72.235 126.846 1.00 0.00 H TER 44145 WAT 8616 ATOM 44145 O WAT 8617 78.587 139.666 112.716 1.00 0.00 O ATOM 44146 H1 WAT 8617 77.822 139.558 112.150 1.00 0.00 H ATOM 44147 H2 WAT 8617 78.291 139.371 113.577 1.00 0.00 H TER 44149 WAT 8617 ATOM 44149 O WAT 8618 63.118 110.227 115.783 1.00 0.00 O ATOM 44150 H1 WAT 8618 63.156 109.646 115.024 1.00 0.00 H ATOM 44151 H2 WAT 8618 63.729 110.934 115.575 1.00 0.00 H TER 44153 WAT 8618 ATOM 44153 O WAT 8619 4.346 114.140 19.713 1.00 0.00 O ATOM 44154 H1 WAT 8619 4.100 115.064 19.764 1.00 0.00 H ATOM 44155 H2 WAT 8619 5.160 114.081 20.214 1.00 0.00 H TER 44157 WAT 8619 ATOM 44157 O WAT 8620 113.605 52.888 153.002 1.00 0.00 O ATOM 44158 H1 WAT 8620 114.225 52.783 152.281 1.00 0.00 H ATOM 44159 H2 WAT 8620 113.249 52.010 153.141 1.00 0.00 H TER 44161 WAT 8620 ATOM 44161 O WAT 8621 90.330 117.344 97.023 1.00 0.00 O ATOM 44162 H1 WAT 8621 90.307 116.584 96.442 1.00 0.00 H ATOM 44163 H2 WAT 8621 90.784 118.018 96.518 1.00 0.00 H TER 44165 WAT 8621 ATOM 44165 O WAT 8622 91.159 50.460 109.135 1.00 0.00 O ATOM 44166 H1 WAT 8622 90.701 50.351 108.301 1.00 0.00 H ATOM 44167 H2 WAT 8622 90.478 50.350 109.798 1.00 0.00 H TER 44169 WAT 8622 ATOM 44169 O WAT 8623 9.813 106.383 152.115 1.00 0.00 O ATOM 44170 H1 WAT 8623 10.460 105.903 151.597 1.00 0.00 H ATOM 44171 H2 WAT 8623 10.193 106.426 152.992 1.00 0.00 H TER 44173 WAT 8623 ATOM 44173 O WAT 8624 65.197 136.178 154.950 1.00 0.00 O ATOM 44174 H1 WAT 8624 64.940 136.313 155.862 1.00 0.00 H ATOM 44175 H2 WAT 8624 64.892 136.964 154.496 1.00 0.00 H TER 44177 WAT 8624 ATOM 44177 O WAT 8625 64.917 94.043 154.139 1.00 0.00 O ATOM 44178 H1 WAT 8625 64.396 93.362 153.716 1.00 0.00 H ATOM 44179 H2 WAT 8625 65.395 93.585 154.830 1.00 0.00 H TER 44181 WAT 8625 ATOM 44181 O WAT 8626 114.342 63.664 149.312 1.00 0.00 O ATOM 44182 H1 WAT 8626 114.964 63.837 150.018 1.00 0.00 H ATOM 44183 H2 WAT 8626 113.950 62.820 149.540 1.00 0.00 H TER 44185 WAT 8626 ATOM 44185 O WAT 8627 124.078 57.737 79.746 1.00 0.00 O ATOM 44186 H1 WAT 8627 124.222 58.245 80.543 1.00 0.00 H ATOM 44187 H2 WAT 8627 123.414 57.092 79.989 1.00 0.00 H TER 44189 WAT 8627 ATOM 44189 O WAT 8628 5.478 9.675 93.893 1.00 0.00 O ATOM 44190 H1 WAT 8628 4.656 9.814 94.363 1.00 0.00 H ATOM 44191 H2 WAT 8628 5.440 10.287 93.158 1.00 0.00 H TER 44193 WAT 8628 ATOM 44193 O WAT 8629 50.246 145.527 118.018 1.00 0.00 O ATOM 44194 H1 WAT 8629 50.475 146.456 118.024 1.00 0.00 H ATOM 44195 H2 WAT 8629 50.668 145.171 118.799 1.00 0.00 H TER 44197 WAT 8629 ATOM 44197 O WAT 8630 7.830 95.010 5.612 1.00 0.00 O ATOM 44198 H1 WAT 8630 8.690 94.605 5.496 1.00 0.00 H ATOM 44199 H2 WAT 8630 7.223 94.411 5.177 1.00 0.00 H TER 44201 WAT 8630 ATOM 44201 O WAT 8631 94.330 96.084 151.512 1.00 0.00 O ATOM 44202 H1 WAT 8631 94.731 95.645 150.762 1.00 0.00 H ATOM 44203 H2 WAT 8631 93.802 95.405 151.933 1.00 0.00 H TER 44205 WAT 8631 ATOM 44205 O WAT 8632 75.301 92.344 94.535 1.00 0.00 O ATOM 44206 H1 WAT 8632 74.468 92.037 94.177 1.00 0.00 H ATOM 44207 H2 WAT 8632 75.703 92.835 93.819 1.00 0.00 H TER 44209 WAT 8632 ATOM 44209 O WAT 8633 30.336 0.501 144.441 1.00 0.00 O ATOM 44210 H1 WAT 8633 30.211 1.098 145.178 1.00 0.00 H ATOM 44211 H2 WAT 8633 29.731 -0.221 144.612 1.00 0.00 H TER 44213 WAT 8633 ATOM 44213 O WAT 8634 41.529 110.456 105.294 1.00 0.00 O ATOM 44214 H1 WAT 8634 42.025 110.052 104.583 1.00 0.00 H ATOM 44215 H2 WAT 8634 41.186 109.717 105.797 1.00 0.00 H TER 44217 WAT 8634 ATOM 44217 O WAT 8635 44.643 8.625 139.089 1.00 0.00 O ATOM 44218 H1 WAT 8635 45.554 8.427 138.869 1.00 0.00 H ATOM 44219 H2 WAT 8635 44.664 9.528 139.405 1.00 0.00 H TER 44221 WAT 8635 ATOM 44221 O WAT 8636 124.801 83.267 142.573 1.00 0.00 O ATOM 44222 H1 WAT 8636 124.201 82.645 142.162 1.00 0.00 H ATOM 44223 H2 WAT 8636 124.534 83.287 143.491 1.00 0.00 H TER 44225 WAT 8636 ATOM 44225 O WAT 8637 85.408 17.501 91.320 1.00 0.00 O ATOM 44226 H1 WAT 8637 86.237 17.745 90.909 1.00 0.00 H ATOM 44227 H2 WAT 8637 85.420 17.947 92.167 1.00 0.00 H TER 44229 WAT 8637 ATOM 44229 O WAT 8638 65.224 23.945 149.035 1.00 0.00 O ATOM 44230 H1 WAT 8638 65.165 23.084 149.449 1.00 0.00 H ATOM 44231 H2 WAT 8638 66.026 23.906 148.515 1.00 0.00 H TER 44233 WAT 8638 ATOM 44233 O WAT 8639 63.932 12.222 122.443 1.00 0.00 O ATOM 44234 H1 WAT 8639 63.052 12.153 122.815 1.00 0.00 H ATOM 44235 H2 WAT 8639 63.870 11.777 121.598 1.00 0.00 H TER 44237 WAT 8639 ATOM 44237 O WAT 8640 0.793 63.789 1.000 1.00 0.00 O ATOM 44238 H1 WAT 8640 0.280 63.925 1.797 1.00 0.00 H ATOM 44239 H2 WAT 8640 1.169 64.648 0.808 1.00 0.00 H TER 44241 WAT 8640 ATOM 44241 O WAT 8641 99.702 141.267 138.427 1.00 0.00 O ATOM 44242 H1 WAT 8641 100.437 141.653 137.950 1.00 0.00 H ATOM 44243 H2 WAT 8641 98.986 141.251 137.792 1.00 0.00 H TER 44245 WAT 8641 ATOM 44245 O WAT 8642 93.567 58.192 125.822 1.00 0.00 O ATOM 44246 H1 WAT 8642 92.681 58.403 126.115 1.00 0.00 H ATOM 44247 H2 WAT 8642 93.454 57.869 124.929 1.00 0.00 H TER 44249 WAT 8642 ATOM 44249 O WAT 8643 39.853 26.287 137.707 1.00 0.00 O ATOM 44250 H1 WAT 8643 40.552 25.873 138.214 1.00 0.00 H ATOM 44251 H2 WAT 8643 39.045 25.956 138.097 1.00 0.00 H TER 44253 WAT 8643 ATOM 44253 O WAT 8644 10.771 143.100 131.440 1.00 0.00 O ATOM 44254 H1 WAT 8644 11.586 142.655 131.673 1.00 0.00 H ATOM 44255 H2 WAT 8644 10.669 143.778 132.108 1.00 0.00 H TER 44257 WAT 8644 ATOM 44257 O WAT 8645 137.923 74.563 13.911 1.00 0.00 O ATOM 44258 H1 WAT 8645 138.496 74.457 13.152 1.00 0.00 H ATOM 44259 H2 WAT 8645 137.827 73.679 14.265 1.00 0.00 H TER 44261 WAT 8645 ATOM 44261 O WAT 8646 113.312 119.452 21.053 1.00 0.00 O ATOM 44262 H1 WAT 8646 112.478 119.780 21.390 1.00 0.00 H ATOM 44263 H2 WAT 8646 113.976 119.948 21.533 1.00 0.00 H TER 44265 WAT 8646 ATOM 44265 O WAT 8647 54.431 129.866 143.015 1.00 0.00 O ATOM 44266 H1 WAT 8647 54.867 130.257 142.258 1.00 0.00 H ATOM 44267 H2 WAT 8647 54.744 128.962 143.031 1.00 0.00 H TER 44269 WAT 8647 ATOM 44269 O WAT 8648 79.197 50.352 16.781 1.00 0.00 O ATOM 44270 H1 WAT 8648 79.215 51.290 16.589 1.00 0.00 H ATOM 44271 H2 WAT 8648 78.619 49.982 16.114 1.00 0.00 H TER 44273 WAT 8648 ATOM 44273 O WAT 8649 118.306 88.560 105.130 1.00 0.00 O ATOM 44274 H1 WAT 8649 117.769 87.987 105.677 1.00 0.00 H ATOM 44275 H2 WAT 8649 118.978 87.984 104.767 1.00 0.00 H TER 44277 WAT 8649 ATOM 44277 O WAT 8650 37.390 40.567 17.790 1.00 0.00 O ATOM 44278 H1 WAT 8650 36.617 40.021 17.646 1.00 0.00 H ATOM 44279 H2 WAT 8650 37.967 40.028 18.330 1.00 0.00 H TER 44281 WAT 8650 ATOM 44281 O WAT 8651 129.191 37.237 153.667 1.00 0.00 O ATOM 44282 H1 WAT 8651 129.142 36.290 153.801 1.00 0.00 H ATOM 44283 H2 WAT 8651 128.442 37.438 153.107 1.00 0.00 H TER 44285 WAT 8651 ATOM 44285 O WAT 8652 53.111 88.449 83.442 1.00 0.00 O ATOM 44286 H1 WAT 8652 52.227 88.580 83.099 1.00 0.00 H ATOM 44287 H2 WAT 8652 53.225 87.499 83.455 1.00 0.00 H TER 44289 WAT 8652 ATOM 44289 O WAT 8653 9.351 88.233 57.665 1.00 0.00 O ATOM 44290 H1 WAT 8653 8.730 87.887 57.024 1.00 0.00 H ATOM 44291 H2 WAT 8653 8.802 88.650 58.329 1.00 0.00 H TER 44293 WAT 8653 ATOM 44293 O WAT 8654 94.196 7.088 130.760 1.00 0.00 O ATOM 44294 H1 WAT 8654 94.595 6.595 130.043 1.00 0.00 H ATOM 44295 H2 WAT 8654 93.831 6.418 131.337 1.00 0.00 H TER 44297 WAT 8654 ATOM 44297 O WAT 8655 56.475 121.465 108.453 1.00 0.00 O ATOM 44298 H1 WAT 8655 57.368 121.736 108.241 1.00 0.00 H ATOM 44299 H2 WAT 8655 56.071 121.284 107.604 1.00 0.00 H TER 44301 WAT 8655 ATOM 44301 O WAT 8656 100.953 45.954 115.582 1.00 0.00 O ATOM 44302 H1 WAT 8656 101.842 46.261 115.760 1.00 0.00 H ATOM 44303 H2 WAT 8656 100.638 45.632 116.426 1.00 0.00 H TER 44305 WAT 8656 ATOM 44305 O WAT 8657 9.561 145.685 120.278 1.00 0.00 O ATOM 44306 H1 WAT 8657 9.040 145.450 119.510 1.00 0.00 H ATOM 44307 H2 WAT 8657 9.774 146.609 120.150 1.00 0.00 H TER 44309 WAT 8657 ATOM 44309 O WAT 8658 84.482 82.897 68.945 1.00 0.00 O ATOM 44310 H1 WAT 8658 84.083 82.185 68.445 1.00 0.00 H ATOM 44311 H2 WAT 8658 83.860 83.620 68.868 1.00 0.00 H TER 44313 WAT 8658 ATOM 44313 O WAT 8659 127.083 71.069 5.319 1.00 0.00 O ATOM 44314 H1 WAT 8659 126.367 71.231 4.705 1.00 0.00 H ATOM 44315 H2 WAT 8659 127.534 71.911 5.388 1.00 0.00 H TER 44317 WAT 8659 ATOM 44317 O WAT 8660 95.071 20.728 86.231 1.00 0.00 O ATOM 44318 H1 WAT 8660 95.214 21.671 86.153 1.00 0.00 H ATOM 44319 H2 WAT 8660 95.347 20.373 85.385 1.00 0.00 H TER 44321 WAT 8660 ATOM 44321 O WAT 8661 14.285 91.133 99.801 1.00 0.00 O ATOM 44322 H1 WAT 8661 14.981 91.556 100.303 1.00 0.00 H ATOM 44323 H2 WAT 8661 13.622 90.907 100.454 1.00 0.00 H TER 44325 WAT 8661 ATOM 44325 O WAT 8662 133.179 5.933 96.421 1.00 0.00 O ATOM 44326 H1 WAT 8662 133.344 5.040 96.119 1.00 0.00 H ATOM 44327 H2 WAT 8662 133.750 6.039 97.181 1.00 0.00 H TER 44329 WAT 8662 ATOM 44329 O WAT 8663 96.600 34.837 91.142 1.00 0.00 O ATOM 44330 H1 WAT 8663 96.816 35.726 91.422 1.00 0.00 H ATOM 44331 H2 WAT 8663 97.376 34.541 90.665 1.00 0.00 H TER 44333 WAT 8663 ATOM 44333 O WAT 8664 72.462 49.453 72.247 1.00 0.00 O ATOM 44334 H1 WAT 8664 72.703 49.033 73.073 1.00 0.00 H ATOM 44335 H2 WAT 8664 72.616 50.386 72.399 1.00 0.00 H TER 44337 WAT 8664 ATOM 44337 O WAT 8665 24.434 15.418 89.720 1.00 0.00 O ATOM 44338 H1 WAT 8665 23.492 15.450 89.886 1.00 0.00 H ATOM 44339 H2 WAT 8665 24.790 16.153 90.219 1.00 0.00 H TER 44341 WAT 8665 ATOM 44341 O WAT 8666 18.875 115.184 152.715 1.00 0.00 O ATOM 44342 H1 WAT 8666 18.267 115.570 153.346 1.00 0.00 H ATOM 44343 H2 WAT 8666 18.713 115.664 151.903 1.00 0.00 H TER 44345 WAT 8666 ATOM 44345 O WAT 8667 9.975 139.714 107.519 1.00 0.00 O ATOM 44346 H1 WAT 8667 10.846 140.095 107.636 1.00 0.00 H ATOM 44347 H2 WAT 8667 9.471 140.035 108.267 1.00 0.00 H TER 44349 WAT 8667 ATOM 44349 O WAT 8668 73.844 52.985 13.358 1.00 0.00 O ATOM 44350 H1 WAT 8668 73.151 52.633 13.917 1.00 0.00 H ATOM 44351 H2 WAT 8668 73.755 52.505 12.535 1.00 0.00 H TER 44353 WAT 8668 ATOM 44353 O WAT 8669 134.019 59.648 110.646 1.00 0.00 O ATOM 44354 H1 WAT 8669 134.222 60.458 110.179 1.00 0.00 H ATOM 44355 H2 WAT 8669 133.443 59.921 111.360 1.00 0.00 H TER 44357 WAT 8669 ATOM 44357 O WAT 8670 105.037 122.730 59.844 1.00 0.00 O ATOM 44358 H1 WAT 8670 104.600 123.262 60.510 1.00 0.00 H ATOM 44359 H2 WAT 8670 105.919 123.098 59.785 1.00 0.00 H TER 44361 WAT 8670 ATOM 44361 O WAT 8671 32.808 98.683 0.514 1.00 0.00 O ATOM 44362 H1 WAT 8671 33.420 99.357 0.808 1.00 0.00 H ATOM 44363 H2 WAT 8671 33.367 97.959 0.231 1.00 0.00 H TER 44365 WAT 8671 ATOM 44365 O WAT 8672 80.831 2.150 99.563 1.00 0.00 O ATOM 44366 H1 WAT 8672 80.725 2.859 98.929 1.00 0.00 H ATOM 44367 H2 WAT 8672 79.969 2.063 99.971 1.00 0.00 H TER 44369 WAT 8672 ATOM 44369 O WAT 8673 77.831 62.369 154.105 1.00 0.00 O ATOM 44370 H1 WAT 8673 78.043 61.459 153.896 1.00 0.00 H ATOM 44371 H2 WAT 8673 77.054 62.313 154.661 1.00 0.00 H TER 44373 WAT 8673 ATOM 44373 O WAT 8674 124.863 82.214 156.297 1.00 0.00 O ATOM 44374 H1 WAT 8674 124.009 82.452 156.658 1.00 0.00 H ATOM 44375 H2 WAT 8674 124.660 81.779 155.468 1.00 0.00 H TER 44377 WAT 8674 ATOM 44377 O WAT 8675 103.908 71.294 13.505 1.00 0.00 O ATOM 44378 H1 WAT 8675 103.847 71.333 12.551 1.00 0.00 H ATOM 44379 H2 WAT 8675 104.344 70.461 13.684 1.00 0.00 H TER 44381 WAT 8675 ATOM 44381 O WAT 8676 99.259 114.411 71.517 1.00 0.00 O ATOM 44382 H1 WAT 8676 100.050 114.936 71.637 1.00 0.00 H ATOM 44383 H2 WAT 8676 98.672 114.698 72.217 1.00 0.00 H TER 44385 WAT 8676 ATOM 44385 O WAT 8677 89.317 114.201 98.234 1.00 0.00 O ATOM 44386 H1 WAT 8677 88.682 114.457 97.566 1.00 0.00 H ATOM 44387 H2 WAT 8677 89.999 113.735 97.750 1.00 0.00 H TER 44389 WAT 8677 ATOM 44389 O WAT 8678 106.939 17.226 79.446 1.00 0.00 O ATOM 44390 H1 WAT 8678 107.465 16.482 79.741 1.00 0.00 H ATOM 44391 H2 WAT 8678 107.573 17.829 79.058 1.00 0.00 H TER 44393 WAT 8678 ATOM 44393 O WAT 8679 79.386 61.587 82.774 1.00 0.00 O ATOM 44394 H1 WAT 8679 79.516 62.532 82.847 1.00 0.00 H ATOM 44395 H2 WAT 8679 79.856 61.341 81.976 1.00 0.00 H TER 44397 WAT 8679 ATOM 44397 O WAT 8680 74.688 54.179 8.528 1.00 0.00 O ATOM 44398 H1 WAT 8680 75.429 53.581 8.626 1.00 0.00 H ATOM 44399 H2 WAT 8680 75.037 55.035 8.776 1.00 0.00 H TER 44401 WAT 8680 ATOM 44401 O WAT 8681 114.901 126.251 136.403 1.00 0.00 O ATOM 44402 H1 WAT 8681 114.997 125.319 136.602 1.00 0.00 H ATOM 44403 H2 WAT 8681 115.035 126.308 135.457 1.00 0.00 H TER 44405 WAT 8681 ATOM 44405 O WAT 8682 3.392 100.998 105.987 1.00 0.00 O ATOM 44406 H1 WAT 8682 3.269 100.500 105.179 1.00 0.00 H ATOM 44407 H2 WAT 8682 4.202 101.488 105.846 1.00 0.00 H TER 44409 WAT 8682 ATOM 44409 O WAT 8683 52.478 137.921 109.904 1.00 0.00 O ATOM 44410 H1 WAT 8683 53.416 137.802 110.054 1.00 0.00 H ATOM 44411 H2 WAT 8683 52.428 138.477 109.127 1.00 0.00 H TER 44413 WAT 8683 ATOM 44413 O WAT 8684 20.252 7.021 56.184 1.00 0.00 O ATOM 44414 H1 WAT 8684 20.268 6.774 57.109 1.00 0.00 H ATOM 44415 H2 WAT 8684 20.938 6.488 55.782 1.00 0.00 H TER 44417 WAT 8684 ATOM 44417 O WAT 8685 96.571 120.213 56.848 1.00 0.00 O ATOM 44418 H1 WAT 8685 95.748 120.275 57.333 1.00 0.00 H ATOM 44419 H2 WAT 8685 96.636 119.290 56.603 1.00 0.00 H TER 44421 WAT 8685 ATOM 44421 O WAT 8686 87.073 30.222 87.340 1.00 0.00 O ATOM 44422 H1 WAT 8686 87.947 29.927 87.084 1.00 0.00 H ATOM 44423 H2 WAT 8686 86.887 29.745 88.149 1.00 0.00 H TER 44425 WAT 8686 ATOM 44425 O WAT 8687 128.935 91.971 75.759 1.00 0.00 O ATOM 44426 H1 WAT 8687 129.305 91.201 76.191 1.00 0.00 H ATOM 44427 H2 WAT 8687 129.080 92.686 76.377 1.00 0.00 H TER 44429 WAT 8687 ATOM 44429 O WAT 8688 124.656 93.488 129.809 1.00 0.00 O ATOM 44430 H1 WAT 8688 125.361 94.059 129.502 1.00 0.00 H ATOM 44431 H2 WAT 8688 124.065 93.414 129.060 1.00 0.00 H TER 44433 WAT 8688 ATOM 44433 O WAT 8689 91.952 74.978 118.923 1.00 0.00 O ATOM 44434 H1 WAT 8689 91.837 74.269 118.291 1.00 0.00 H ATOM 44435 H2 WAT 8689 91.274 74.826 119.581 1.00 0.00 H TER 44437 WAT 8689 ATOM 44437 O WAT 8690 33.017 94.227 64.032 1.00 0.00 O ATOM 44438 H1 WAT 8690 33.537 94.303 64.832 1.00 0.00 H ATOM 44439 H2 WAT 8690 33.264 94.992 63.512 1.00 0.00 H TER 44441 WAT 8690 ATOM 44441 O WAT 8691 87.948 24.225 90.746 1.00 0.00 O ATOM 44442 H1 WAT 8691 87.501 25.037 90.509 1.00 0.00 H ATOM 44443 H2 WAT 8691 88.570 24.483 91.427 1.00 0.00 H TER 44445 WAT 8691 ATOM 44445 O WAT 8692 88.993 3.267 106.384 1.00 0.00 O ATOM 44446 H1 WAT 8692 88.173 3.708 106.604 1.00 0.00 H ATOM 44447 H2 WAT 8692 89.616 3.979 106.239 1.00 0.00 H TER 44449 WAT 8692 ATOM 44449 O WAT 8693 44.733 129.273 104.329 1.00 0.00 O ATOM 44450 H1 WAT 8693 45.684 129.169 104.351 1.00 0.00 H ATOM 44451 H2 WAT 8693 44.585 130.179 104.603 1.00 0.00 H TER 44453 WAT 8693 ATOM 44453 O WAT 8694 25.205 94.641 3.865 1.00 0.00 O ATOM 44454 H1 WAT 8694 25.848 94.297 3.245 1.00 0.00 H ATOM 44455 H2 WAT 8694 25.222 94.022 4.595 1.00 0.00 H TER 44457 WAT 8694 ATOM 44457 O WAT 8695 10.299 105.480 91.400 1.00 0.00 O ATOM 44458 H1 WAT 8695 10.793 104.991 90.742 1.00 0.00 H ATOM 44459 H2 WAT 8695 9.930 104.807 91.972 1.00 0.00 H TER 44461 WAT 8695 ATOM 44461 O WAT 8696 110.845 34.658 105.512 1.00 0.00 O ATOM 44462 H1 WAT 8696 110.016 34.191 105.408 1.00 0.00 H ATOM 44463 H2 WAT 8696 111.137 34.831 104.616 1.00 0.00 H TER 44465 WAT 8696 ATOM 44465 O WAT 8697 58.870 64.305 111.118 1.00 0.00 O ATOM 44466 H1 WAT 8697 59.599 64.733 110.670 1.00 0.00 H ATOM 44467 H2 WAT 8697 58.087 64.672 110.708 1.00 0.00 H TER 44469 WAT 8697 ATOM 44469 O WAT 8698 134.081 3.756 24.079 1.00 0.00 O ATOM 44470 H1 WAT 8698 133.839 3.662 23.157 1.00 0.00 H ATOM 44471 H2 WAT 8698 135.032 3.649 24.089 1.00 0.00 H TER 44473 WAT 8698 ATOM 44473 O WAT 8699 33.077 39.229 70.980 1.00 0.00 O ATOM 44474 H1 WAT 8699 32.833 38.912 70.110 1.00 0.00 H ATOM 44475 H2 WAT 8699 34.013 39.042 71.048 1.00 0.00 H TER 44477 WAT 8699 ATOM 44477 O WAT 8700 91.652 92.893 5.236 1.00 0.00 O ATOM 44478 H1 WAT 8700 91.222 92.561 4.448 1.00 0.00 H ATOM 44479 H2 WAT 8700 92.524 92.500 5.217 1.00 0.00 H TER 44481 WAT 8700 ATOM 44481 O WAT 8701 6.084 12.360 64.691 1.00 0.00 O ATOM 44482 H1 WAT 8701 5.218 12.075 64.399 1.00 0.00 H ATOM 44483 H2 WAT 8701 6.224 13.195 64.245 1.00 0.00 H TER 44485 WAT 8701 ATOM 44485 O WAT 8702 124.658 107.306 73.374 1.00 0.00 O ATOM 44486 H1 WAT 8702 123.898 107.246 72.795 1.00 0.00 H ATOM 44487 H2 WAT 8702 125.120 106.477 73.250 1.00 0.00 H TER 44489 WAT 8702 ATOM 44489 O WAT 8703 8.694 75.325 150.539 1.00 0.00 O ATOM 44490 H1 WAT 8703 9.116 75.346 151.398 1.00 0.00 H ATOM 44491 H2 WAT 8703 7.811 75.660 150.697 1.00 0.00 H TER 44493 WAT 8703 ATOM 44493 O WAT 8704 6.280 22.478 5.386 1.00 0.00 O ATOM 44494 H1 WAT 8704 6.160 23.058 4.634 1.00 0.00 H ATOM 44495 H2 WAT 8704 6.515 23.064 6.106 1.00 0.00 H TER 44497 WAT 8704 ATOM 44497 O WAT 8705 25.730 140.094 137.552 1.00 0.00 O ATOM 44498 H1 WAT 8705 24.887 139.661 137.680 1.00 0.00 H ATOM 44499 H2 WAT 8705 26.261 139.451 137.082 1.00 0.00 H TER 44501 WAT 8705 ATOM 44501 O WAT 8706 32.720 101.936 12.401 1.00 0.00 O ATOM 44502 H1 WAT 8706 32.425 101.515 11.593 1.00 0.00 H ATOM 44503 H2 WAT 8706 32.810 102.860 12.170 1.00 0.00 H TER 44505 WAT 8706 ATOM 44505 O WAT 8707 129.594 55.549 17.841 1.00 0.00 O ATOM 44506 H1 WAT 8707 130.485 55.311 18.099 1.00 0.00 H ATOM 44507 H2 WAT 8707 129.488 55.169 16.969 1.00 0.00 H TER 44509 WAT 8707 ATOM 44509 O WAT 8708 129.102 143.010 4.559 1.00 0.00 O ATOM 44510 H1 WAT 8708 128.502 142.604 5.185 1.00 0.00 H ATOM 44511 H2 WAT 8708 129.953 142.618 4.753 1.00 0.00 H TER 44513 WAT 8708 ATOM 44513 O WAT 8709 95.135 65.155 109.478 1.00 0.00 O ATOM 44514 H1 WAT 8709 95.176 65.148 108.522 1.00 0.00 H ATOM 44515 H2 WAT 8709 95.215 64.235 109.729 1.00 0.00 H TER 44517 WAT 8709 ATOM 44517 O WAT 8710 84.271 22.904 158.242 1.00 0.00 O ATOM 44518 H1 WAT 8710 83.773 23.610 158.654 1.00 0.00 H ATOM 44519 H2 WAT 8710 84.306 23.144 157.317 1.00 0.00 H TER 44521 WAT 8710 ATOM 44521 O WAT 8711 9.713 83.659 96.898 1.00 0.00 O ATOM 44522 H1 WAT 8711 10.335 83.936 97.571 1.00 0.00 H ATOM 44523 H2 WAT 8711 8.961 83.328 97.388 1.00 0.00 H TER 44525 WAT 8711 ATOM 44525 O WAT 8712 80.392 68.696 110.590 1.00 0.00 O ATOM 44526 H1 WAT 8712 80.760 69.097 111.377 1.00 0.00 H ATOM 44527 H2 WAT 8712 80.070 69.435 110.073 1.00 0.00 H TER 44529 WAT 8712 ATOM 44529 O WAT 8713 25.531 128.425 149.022 1.00 0.00 O ATOM 44530 H1 WAT 8713 25.349 129.341 148.809 1.00 0.00 H ATOM 44531 H2 WAT 8713 24.741 127.956 148.754 1.00 0.00 H TER 44533 WAT 8713 ATOM 44533 O WAT 8714 50.588 73.946 110.376 1.00 0.00 O ATOM 44534 H1 WAT 8714 50.274 74.786 110.041 1.00 0.00 H ATOM 44535 H2 WAT 8714 49.792 73.467 110.606 1.00 0.00 H TER 44537 WAT 8714 ATOM 44537 O WAT 8715 73.067 82.346 100.819 1.00 0.00 O ATOM 44538 H1 WAT 8715 73.758 81.688 100.749 1.00 0.00 H ATOM 44539 H2 WAT 8715 72.513 82.035 101.535 1.00 0.00 H TER 44541 WAT 8715 ATOM 44541 O WAT 8716 49.657 101.126 82.981 1.00 0.00 O ATOM 44542 H1 WAT 8716 49.621 102.073 83.112 1.00 0.00 H ATOM 44543 H2 WAT 8716 49.979 100.780 83.813 1.00 0.00 H TER 44545 WAT 8716 ATOM 44545 O WAT 8717 10.059 132.887 62.156 1.00 0.00 O ATOM 44546 H1 WAT 8717 9.822 133.719 61.745 1.00 0.00 H ATOM 44547 H2 WAT 8717 9.849 132.227 61.496 1.00 0.00 H TER 44549 WAT 8717 ATOM 44549 O WAT 8718 79.618 72.015 7.229 1.00 0.00 O ATOM 44550 H1 WAT 8718 79.616 72.550 6.435 1.00 0.00 H ATOM 44551 H2 WAT 8718 80.036 72.568 7.889 1.00 0.00 H TER 44553 WAT 8718 ATOM 44553 O WAT 8719 131.215 55.651 155.290 1.00 0.00 O ATOM 44554 H1 WAT 8719 131.303 55.689 154.337 1.00 0.00 H ATOM 44555 H2 WAT 8719 132.115 55.673 155.615 1.00 0.00 H TER 44557 WAT 8719 ATOM 44557 O WAT 8720 135.876 95.183 65.797 1.00 0.00 O ATOM 44558 H1 WAT 8720 135.495 95.736 66.479 1.00 0.00 H ATOM 44559 H2 WAT 8720 136.646 95.666 65.499 1.00 0.00 H TER 44561 WAT 8720 ATOM 44561 O WAT 8721 64.246 107.765 94.253 1.00 0.00 O ATOM 44562 H1 WAT 8721 63.568 107.095 94.335 1.00 0.00 H ATOM 44563 H2 WAT 8721 63.984 108.448 94.871 1.00 0.00 H TER 44565 WAT 8721 ATOM 44565 O WAT 8722 89.958 58.923 155.746 1.00 0.00 O ATOM 44566 H1 WAT 8722 90.042 58.807 156.693 1.00 0.00 H ATOM 44567 H2 WAT 8722 90.815 59.247 155.467 1.00 0.00 H TER 44569 WAT 8722 ATOM 44569 O WAT 8723 70.403 137.856 145.189 1.00 0.00 O ATOM 44570 H1 WAT 8723 70.046 136.987 145.373 1.00 0.00 H ATOM 44571 H2 WAT 8723 71.193 137.686 144.675 1.00 0.00 H TER 44573 WAT 8723 ATOM 44573 O WAT 8724 113.056 112.755 152.292 1.00 0.00 O ATOM 44574 H1 WAT 8724 113.791 112.309 151.871 1.00 0.00 H ATOM 44575 H2 WAT 8724 112.313 112.595 151.710 1.00 0.00 H TER 44577 WAT 8724 ATOM 44577 O WAT 8725 129.746 56.190 66.692 1.00 0.00 O ATOM 44578 H1 WAT 8725 130.117 57.067 66.792 1.00 0.00 H ATOM 44579 H2 WAT 8725 130.415 55.605 67.046 1.00 0.00 H TER 44581 WAT 8725 ATOM 44581 O WAT 8726 141.133 57.934 102.389 1.00 0.00 O ATOM 44582 H1 WAT 8726 141.392 58.293 101.540 1.00 0.00 H ATOM 44583 H2 WAT 8726 140.183 57.836 102.328 1.00 0.00 H TER 44585 WAT 8726 ATOM 44585 O WAT 8727 71.190 118.260 81.217 1.00 0.00 O ATOM 44586 H1 WAT 8727 70.922 117.387 80.932 1.00 0.00 H ATOM 44587 H2 WAT 8727 70.753 118.856 80.608 1.00 0.00 H TER 44589 WAT 8727 ATOM 44589 O WAT 8728 63.338 122.477 97.507 1.00 0.00 O ATOM 44590 H1 WAT 8728 63.476 122.579 98.449 1.00 0.00 H ATOM 44591 H2 WAT 8728 62.386 122.480 97.403 1.00 0.00 H TER 44593 WAT 8728 ATOM 44593 O WAT 8729 101.320 53.257 126.273 1.00 0.00 O ATOM 44594 H1 WAT 8729 101.863 54.023 126.088 1.00 0.00 H ATOM 44595 H2 WAT 8729 101.341 53.173 127.227 1.00 0.00 H TER 44597 WAT 8729 ATOM 44597 O WAT 8730 28.661 117.819 128.656 1.00 0.00 O ATOM 44598 H1 WAT 8730 29.190 118.310 128.028 1.00 0.00 H ATOM 44599 H2 WAT 8730 28.639 118.374 129.436 1.00 0.00 H TER 44601 WAT 8730 ATOM 44601 O WAT 8731 145.648 123.271 21.345 1.00 0.00 O ATOM 44602 H1 WAT 8731 145.706 124.088 20.849 1.00 0.00 H ATOM 44603 H2 WAT 8731 144.821 123.338 21.821 1.00 0.00 H TER 44605 WAT 8731 ATOM 44605 O WAT 8732 139.398 129.334 99.713 1.00 0.00 O ATOM 44606 H1 WAT 8732 140.097 128.784 99.359 1.00 0.00 H ATOM 44607 H2 WAT 8732 138.632 129.121 99.180 1.00 0.00 H TER 44609 WAT 8732 ATOM 44609 O WAT 8733 26.778 18.160 70.392 1.00 0.00 O ATOM 44610 H1 WAT 8733 27.179 19.029 70.392 1.00 0.00 H ATOM 44611 H2 WAT 8733 27.443 17.588 70.775 1.00 0.00 H TER 44613 WAT 8733 ATOM 44613 O WAT 8734 24.974 129.196 2.777 1.00 0.00 O ATOM 44614 H1 WAT 8734 24.371 129.006 2.058 1.00 0.00 H ATOM 44615 H2 WAT 8734 25.370 128.350 2.986 1.00 0.00 H TER 44617 WAT 8734 ATOM 44617 O WAT 8735 83.715 0.533 137.268 1.00 0.00 O ATOM 44618 H1 WAT 8735 83.632 1.486 137.253 1.00 0.00 H ATOM 44619 H2 WAT 8735 84.140 0.343 138.104 1.00 0.00 H TER 44621 WAT 8735 ATOM 44621 O WAT 8736 124.184 69.749 141.033 1.00 0.00 O ATOM 44622 H1 WAT 8736 124.266 70.077 140.137 1.00 0.00 H ATOM 44623 H2 WAT 8736 123.308 70.018 141.308 1.00 0.00 H TER 44625 WAT 8736 ATOM 44625 O WAT 8737 15.007 23.463 18.846 1.00 0.00 O ATOM 44626 H1 WAT 8737 15.293 24.322 19.158 1.00 0.00 H ATOM 44627 H2 WAT 8737 15.208 22.867 19.567 1.00 0.00 H TER 44629 WAT 8737 ATOM 44629 O WAT 8738 2.685 136.180 71.530 1.00 0.00 O ATOM 44630 H1 WAT 8738 2.379 137.061 71.748 1.00 0.00 H ATOM 44631 H2 WAT 8738 1.925 135.619 71.684 1.00 0.00 H TER 44633 WAT 8738 ATOM 44633 O WAT 8739 73.365 117.413 113.062 1.00 0.00 O ATOM 44634 H1 WAT 8739 74.309 117.312 113.183 1.00 0.00 H ATOM 44635 H2 WAT 8739 73.249 117.457 112.113 1.00 0.00 H TER 44637 WAT 8739 ATOM 44637 O WAT 8740 27.433 108.741 149.092 1.00 0.00 O ATOM 44638 H1 WAT 8740 26.903 109.181 149.756 1.00 0.00 H ATOM 44639 H2 WAT 8740 28.336 108.962 149.321 1.00 0.00 H TER 44641 WAT 8740 ATOM 44641 O WAT 8741 122.959 68.235 91.807 1.00 0.00 O ATOM 44642 H1 WAT 8741 123.192 67.372 92.150 1.00 0.00 H ATOM 44643 H2 WAT 8741 123.488 68.329 91.015 1.00 0.00 H TER 44645 WAT 8741 ATOM 44645 O WAT 8742 33.811 112.532 68.512 1.00 0.00 O ATOM 44646 H1 WAT 8742 34.615 112.944 68.196 1.00 0.00 H ATOM 44647 H2 WAT 8742 33.868 111.627 68.204 1.00 0.00 H TER 44649 WAT 8742 ATOM 44649 O WAT 8743 39.228 97.121 10.310 1.00 0.00 O ATOM 44650 H1 WAT 8743 38.950 98.035 10.258 1.00 0.00 H ATOM 44651 H2 WAT 8743 39.096 96.882 11.227 1.00 0.00 H TER 44653 WAT 8743 ATOM 44653 O WAT 8744 134.996 43.025 113.565 1.00 0.00 O ATOM 44654 H1 WAT 8744 134.285 43.173 112.941 1.00 0.00 H ATOM 44655 H2 WAT 8744 135.584 43.770 113.439 1.00 0.00 H TER 44657 WAT 8744 ATOM 44657 O WAT 8745 76.018 20.943 147.759 1.00 0.00 O ATOM 44658 H1 WAT 8745 76.574 20.266 148.144 1.00 0.00 H ATOM 44659 H2 WAT 8745 76.632 21.606 147.442 1.00 0.00 H TER 44661 WAT 8745 ATOM 44661 O WAT 8746 61.722 94.266 70.375 1.00 0.00 O ATOM 44662 H1 WAT 8746 61.042 93.757 70.814 1.00 0.00 H ATOM 44663 H2 WAT 8746 62.541 93.960 70.766 1.00 0.00 H TER 44665 WAT 8746 ATOM 44665 O WAT 8747 37.562 28.526 83.775 1.00 0.00 O ATOM 44666 H1 WAT 8747 38.094 28.120 83.090 1.00 0.00 H ATOM 44667 H2 WAT 8747 36.851 27.903 83.926 1.00 0.00 H TER 44669 WAT 8747 ATOM 44669 O WAT 8748 57.691 134.158 50.051 1.00 0.00 O ATOM 44670 H1 WAT 8748 57.946 133.859 49.178 1.00 0.00 H ATOM 44671 H2 WAT 8748 57.775 133.382 50.605 1.00 0.00 H TER 44673 WAT 8748 ATOM 44673 O WAT 8749 90.044 115.332 94.929 1.00 0.00 O ATOM 44674 H1 WAT 8749 90.399 114.595 95.425 1.00 0.00 H ATOM 44675 H2 WAT 8749 89.102 115.300 95.095 1.00 0.00 H TER 44677 WAT 8749 ATOM 44677 O WAT 8750 122.481 85.379 77.284 1.00 0.00 O ATOM 44678 H1 WAT 8750 121.967 84.808 77.855 1.00 0.00 H ATOM 44679 H2 WAT 8750 122.511 84.915 76.447 1.00 0.00 H TER 44681 WAT 8750 ATOM 44681 O WAT 8751 115.357 56.269 66.190 1.00 0.00 O ATOM 44682 H1 WAT 8751 114.824 57.033 66.412 1.00 0.00 H ATOM 44683 H2 WAT 8751 116.260 56.577 66.271 1.00 0.00 H TER 44685 WAT 8751 ATOM 44685 O WAT 8752 106.171 28.433 70.065 1.00 0.00 O ATOM 44686 H1 WAT 8752 105.369 28.858 70.367 1.00 0.00 H ATOM 44687 H2 WAT 8752 106.871 29.034 70.319 1.00 0.00 H TER 44689 WAT 8752 ATOM 44689 O WAT 8753 72.683 48.891 75.003 1.00 0.00 O ATOM 44690 H1 WAT 8753 72.194 49.451 75.605 1.00 0.00 H ATOM 44691 H2 WAT 8753 73.601 49.042 75.227 1.00 0.00 H TER 44693 WAT 8753 ATOM 44693 O WAT 8754 132.682 136.315 59.307 1.00 0.00 O ATOM 44694 H1 WAT 8754 132.158 136.862 59.892 1.00 0.00 H ATOM 44695 H2 WAT 8754 132.096 136.115 58.577 1.00 0.00 H TER 44697 WAT 8754 ATOM 44697 O WAT 8755 86.962 103.319 121.222 1.00 0.00 O ATOM 44698 H1 WAT 8755 87.293 103.243 120.327 1.00 0.00 H ATOM 44699 H2 WAT 8755 86.661 102.437 121.441 1.00 0.00 H TER 44701 WAT 8755 ATOM 44701 O WAT 8756 111.508 36.044 57.548 1.00 0.00 O ATOM 44702 H1 WAT 8756 110.589 35.914 57.311 1.00 0.00 H ATOM 44703 H2 WAT 8756 111.785 36.799 57.029 1.00 0.00 H TER 44705 WAT 8756 ATOM 44705 O WAT 8757 75.229 106.352 141.742 1.00 0.00 O ATOM 44706 H1 WAT 8757 75.932 106.177 141.117 1.00 0.00 H ATOM 44707 H2 WAT 8757 75.671 106.735 142.499 1.00 0.00 H TER 44709 WAT 8757 ATOM 44709 O WAT 8758 89.848 135.242 83.228 1.00 0.00 O ATOM 44710 H1 WAT 8758 89.351 134.596 83.730 1.00 0.00 H ATOM 44711 H2 WAT 8758 90.312 135.755 83.889 1.00 0.00 H TER 44713 WAT 8758 ATOM 44713 O WAT 8759 106.824 129.488 84.173 1.00 0.00 O ATOM 44714 H1 WAT 8759 107.046 128.772 84.769 1.00 0.00 H ATOM 44715 H2 WAT 8759 106.182 130.010 84.654 1.00 0.00 H TER 44717 WAT 8759 ATOM 44717 O WAT 8760 124.720 50.185 113.954 1.00 0.00 O ATOM 44718 H1 WAT 8760 124.866 49.965 114.874 1.00 0.00 H ATOM 44719 H2 WAT 8760 124.423 49.366 113.557 1.00 0.00 H TER 44721 WAT 8760 ATOM 44721 O WAT 8761 132.156 132.672 121.150 1.00 0.00 O ATOM 44722 H1 WAT 8761 131.777 132.362 121.972 1.00 0.00 H ATOM 44723 H2 WAT 8761 133.102 132.629 121.292 1.00 0.00 H TER 44725 WAT 8761 ATOM 44725 O WAT 8762 134.727 95.989 132.897 1.00 0.00 O ATOM 44726 H1 WAT 8762 134.113 96.079 133.626 1.00 0.00 H ATOM 44727 H2 WAT 8762 135.438 96.595 133.107 1.00 0.00 H TER 44729 WAT 8762 ATOM 44729 O WAT 8763 76.379 93.422 31.667 1.00 0.00 O ATOM 44730 H1 WAT 8763 75.557 92.940 31.768 1.00 0.00 H ATOM 44731 H2 WAT 8763 76.171 94.124 31.051 1.00 0.00 H TER 44733 WAT 8763 ATOM 44733 O WAT 8764 57.976 123.395 123.463 1.00 0.00 O ATOM 44734 H1 WAT 8764 57.085 123.448 123.117 1.00 0.00 H ATOM 44735 H2 WAT 8764 58.076 124.188 123.989 1.00 0.00 H TER 44737 WAT 8764 ATOM 44737 O WAT 8765 25.047 18.627 129.255 1.00 0.00 O ATOM 44738 H1 WAT 8765 25.844 19.140 129.125 1.00 0.00 H ATOM 44739 H2 WAT 8765 25.296 17.954 129.888 1.00 0.00 H TER 44741 WAT 8765 ATOM 44741 O WAT 8766 21.933 1.000 104.986 1.00 0.00 O ATOM 44742 H1 WAT 8766 21.436 0.577 105.686 1.00 0.00 H ATOM 44743 H2 WAT 8766 22.421 1.697 105.426 1.00 0.00 H TER 44745 WAT 8766 ATOM 44745 O WAT 8767 76.076 133.413 10.516 1.00 0.00 O ATOM 44746 H1 WAT 8767 75.990 133.424 11.470 1.00 0.00 H ATOM 44747 H2 WAT 8767 76.022 134.334 10.260 1.00 0.00 H TER 44749 WAT 8767 ATOM 44749 O WAT 8768 53.753 69.644 71.195 1.00 0.00 O ATOM 44750 H1 WAT 8768 53.045 69.267 71.717 1.00 0.00 H ATOM 44751 H2 WAT 8768 54.519 69.110 71.409 1.00 0.00 H TER 44753 WAT 8768 ATOM 44753 O WAT 8769 115.187 123.804 147.031 1.00 0.00 O ATOM 44754 H1 WAT 8769 114.534 124.474 146.830 1.00 0.00 H ATOM 44755 H2 WAT 8769 116.028 124.244 146.906 1.00 0.00 H TER 44757 WAT 8769 ATOM 44757 O WAT 8770 94.763 117.497 111.302 1.00 0.00 O ATOM 44758 H1 WAT 8770 94.408 117.095 110.509 1.00 0.00 H ATOM 44759 H2 WAT 8770 95.664 117.722 111.073 1.00 0.00 H TER 44761 WAT 8770 ATOM 44761 O WAT 8771 95.938 5.800 144.924 1.00 0.00 O ATOM 44762 H1 WAT 8771 95.535 5.367 144.171 1.00 0.00 H ATOM 44763 H2 WAT 8771 96.723 6.217 144.568 1.00 0.00 H TER 44765 WAT 8771 ATOM 44765 O WAT 8772 93.116 14.892 64.091 1.00 0.00 O ATOM 44766 H1 WAT 8772 93.730 14.190 63.873 1.00 0.00 H ATOM 44767 H2 WAT 8772 92.298 14.439 64.297 1.00 0.00 H TER 44769 WAT 8772 ATOM 44769 O WAT 8773 69.755 105.768 106.872 1.00 0.00 O ATOM 44770 H1 WAT 8773 70.289 105.417 107.585 1.00 0.00 H ATOM 44771 H2 WAT 8773 68.893 105.908 107.265 1.00 0.00 H TER 44773 WAT 8773 ATOM 44773 O WAT 8774 58.022 119.822 90.759 1.00 0.00 O ATOM 44774 H1 WAT 8774 58.852 120.189 91.063 1.00 0.00 H ATOM 44775 H2 WAT 8774 57.488 120.587 90.544 1.00 0.00 H TER 44777 WAT 8774 ATOM 44777 O WAT 8775 35.613 145.906 79.791 1.00 0.00 O ATOM 44778 H1 WAT 8775 36.454 145.758 79.359 1.00 0.00 H ATOM 44779 H2 WAT 8775 35.029 145.251 79.408 1.00 0.00 H TER 44781 WAT 8775 ATOM 44781 O WAT 8776 110.667 80.569 14.510 1.00 0.00 O ATOM 44782 H1 WAT 8776 110.326 80.106 15.276 1.00 0.00 H ATOM 44783 H2 WAT 8776 110.181 81.393 14.492 1.00 0.00 H TER 44785 WAT 8776 ATOM 44785 O WAT 8777 8.710 6.365 2.342 1.00 0.00 O ATOM 44786 H1 WAT 8777 8.474 6.923 3.083 1.00 0.00 H ATOM 44787 H2 WAT 8777 9.528 5.946 2.609 1.00 0.00 H TER 44789 WAT 8777 ATOM 44789 O WAT 8778 129.374 53.797 110.882 1.00 0.00 O ATOM 44790 H1 WAT 8778 130.189 53.960 111.356 1.00 0.00 H ATOM 44791 H2 WAT 8778 129.254 52.849 110.930 1.00 0.00 H TER 44793 WAT 8778 ATOM 44793 O WAT 8779 87.807 134.501 14.259 1.00 0.00 O ATOM 44794 H1 WAT 8779 87.459 134.834 13.431 1.00 0.00 H ATOM 44795 H2 WAT 8779 88.251 135.252 14.651 1.00 0.00 H TER 44797 WAT 8779 ATOM 44797 O WAT 8780 24.694 63.202 104.382 1.00 0.00 O ATOM 44798 H1 WAT 8780 24.510 63.174 103.443 1.00 0.00 H ATOM 44799 H2 WAT 8780 25.515 63.690 104.451 1.00 0.00 H TER 44801 WAT 8780 ATOM 44801 O WAT 8781 27.312 128.703 75.326 1.00 0.00 O ATOM 44802 H1 WAT 8781 27.166 128.985 76.229 1.00 0.00 H ATOM 44803 H2 WAT 8781 26.670 129.197 74.815 1.00 0.00 H TER 44805 WAT 8781 ATOM 44805 O WAT 8782 135.317 6.690 73.958 1.00 0.00 O ATOM 44806 H1 WAT 8782 135.204 5.749 74.095 1.00 0.00 H ATOM 44807 H2 WAT 8782 134.461 6.992 73.653 1.00 0.00 H TER 44809 WAT 8782 ATOM 44809 O WAT 8783 13.458 93.981 1.445 1.00 0.00 O ATOM 44810 H1 WAT 8783 13.580 94.493 2.244 1.00 0.00 H ATOM 44811 H2 WAT 8783 12.568 93.636 1.515 1.00 0.00 H TER 44813 WAT 8783 ATOM 44813 O WAT 8784 27.856 8.846 137.473 1.00 0.00 O ATOM 44814 H1 WAT 8784 26.988 9.151 137.737 1.00 0.00 H ATOM 44815 H2 WAT 8784 27.822 7.896 137.590 1.00 0.00 H TER 44817 WAT 8784 ATOM 44817 O WAT 8785 5.642 16.854 99.064 1.00 0.00 O ATOM 44818 H1 WAT 8785 5.382 17.179 99.926 1.00 0.00 H ATOM 44819 H2 WAT 8785 5.481 17.589 98.473 1.00 0.00 H TER 44821 WAT 8785 ATOM 44821 O WAT 8786 88.125 22.045 74.839 1.00 0.00 O ATOM 44822 H1 WAT 8786 88.439 22.149 75.737 1.00 0.00 H ATOM 44823 H2 WAT 8786 88.236 21.113 74.652 1.00 0.00 H TER 44825 WAT 8786 ATOM 44825 O WAT 8787 2.717 145.157 7.619 1.00 0.00 O ATOM 44826 H1 WAT 8787 2.235 145.980 7.533 1.00 0.00 H ATOM 44827 H2 WAT 8787 2.369 144.602 6.921 1.00 0.00 H TER 44829 WAT 8787 ATOM 44829 O WAT 8788 138.864 43.187 154.050 1.00 0.00 O ATOM 44830 H1 WAT 8788 139.593 42.781 154.518 1.00 0.00 H ATOM 44831 H2 WAT 8788 138.786 42.679 153.242 1.00 0.00 H TER 44833 WAT 8788 ATOM 44833 O WAT 8789 140.405 111.860 117.088 1.00 0.00 O ATOM 44834 H1 WAT 8789 139.982 111.283 117.724 1.00 0.00 H ATOM 44835 H2 WAT 8789 139.951 112.696 117.184 1.00 0.00 H TER 44837 WAT 8789 ATOM 44837 O WAT 8790 62.054 111.580 154.550 1.00 0.00 O ATOM 44838 H1 WAT 8790 61.988 111.865 155.461 1.00 0.00 H ATOM 44839 H2 WAT 8790 61.500 110.801 154.501 1.00 0.00 H TER 44841 WAT 8790 ATOM 44841 O WAT 8791 110.835 120.124 141.952 1.00 0.00 O ATOM 44842 H1 WAT 8791 110.807 120.966 142.405 1.00 0.00 H ATOM 44843 H2 WAT 8791 111.769 119.940 141.847 1.00 0.00 H TER 44845 WAT 8791 ATOM 44845 O WAT 8792 56.109 84.681 129.313 1.00 0.00 O ATOM 44846 H1 WAT 8792 56.423 84.478 128.432 1.00 0.00 H ATOM 44847 H2 WAT 8792 55.287 84.196 129.392 1.00 0.00 H TER 44849 WAT 8792 ATOM 44849 O WAT 8793 107.412 106.016 80.476 1.00 0.00 O ATOM 44850 H1 WAT 8793 107.046 106.679 79.890 1.00 0.00 H ATOM 44851 H2 WAT 8793 107.829 106.519 81.176 1.00 0.00 H TER 44853 WAT 8793 ATOM 44853 O WAT 8794 38.874 79.306 13.320 1.00 0.00 O ATOM 44854 H1 WAT 8794 39.058 80.221 13.532 1.00 0.00 H ATOM 44855 H2 WAT 8794 39.087 78.828 14.122 1.00 0.00 H TER 44857 WAT 8794 ATOM 44857 O WAT 8795 51.148 27.814 8.141 1.00 0.00 O ATOM 44858 H1 WAT 8795 50.251 27.480 8.162 1.00 0.00 H ATOM 44859 H2 WAT 8795 51.669 27.080 7.815 1.00 0.00 H TER 44861 WAT 8795 ATOM 44861 O WAT 8796 56.729 20.550 54.977 1.00 0.00 O ATOM 44862 H1 WAT 8796 57.654 20.318 54.896 1.00 0.00 H ATOM 44863 H2 WAT 8796 56.579 21.184 54.276 1.00 0.00 H TER 44865 WAT 8796 ATOM 44865 O WAT 8797 73.637 26.744 130.819 1.00 0.00 O ATOM 44866 H1 WAT 8797 72.968 27.366 130.535 1.00 0.00 H ATOM 44867 H2 WAT 8797 73.843 26.238 130.033 1.00 0.00 H TER 44869 WAT 8797 ATOM 44869 O WAT 8798 80.080 36.650 69.220 1.00 0.00 O ATOM 44870 H1 WAT 8798 80.599 35.850 69.138 1.00 0.00 H ATOM 44871 H2 WAT 8798 80.572 37.306 68.726 1.00 0.00 H TER 44873 WAT 8798 ATOM 44873 O WAT 8799 35.109 76.937 12.687 1.00 0.00 O ATOM 44874 H1 WAT 8799 34.511 76.576 13.342 1.00 0.00 H ATOM 44875 H2 WAT 8799 35.450 76.170 12.227 1.00 0.00 H TER 44877 WAT 8799 ATOM 44877 O WAT 8800 53.593 83.526 2.509 1.00 0.00 O ATOM 44878 H1 WAT 8800 54.215 84.149 2.133 1.00 0.00 H ATOM 44879 H2 WAT 8800 52.811 84.047 2.690 1.00 0.00 H TER 44881 WAT 8800 ATOM 44881 O WAT 8801 34.136 103.169 152.341 1.00 0.00 O ATOM 44882 H1 WAT 8801 33.813 104.066 152.255 1.00 0.00 H ATOM 44883 H2 WAT 8801 33.434 102.704 152.798 1.00 0.00 H TER 44885 WAT 8801 ATOM 44885 O WAT 8802 35.822 29.362 23.494 1.00 0.00 O ATOM 44886 H1 WAT 8802 35.461 28.681 22.926 1.00 0.00 H ATOM 44887 H2 WAT 8802 35.141 30.035 23.524 1.00 0.00 H TER 44889 WAT 8802 ATOM 44889 O WAT 8803 -0.051 53.955 6.564 1.00 0.00 O ATOM 44890 H1 WAT 8803 0.697 54.511 6.780 1.00 0.00 H ATOM 44891 H2 WAT 8803 0.187 53.092 6.903 1.00 0.00 H TER 44893 WAT 8803 ATOM 44893 O WAT 8804 21.451 58.003 129.465 1.00 0.00 O ATOM 44894 H1 WAT 8804 22.015 57.744 130.194 1.00 0.00 H ATOM 44895 H2 WAT 8804 21.732 57.450 128.736 1.00 0.00 H TER 44897 WAT 8804 ATOM 44897 O WAT 8805 140.819 60.735 54.627 1.00 0.00 O ATOM 44898 H1 WAT 8805 141.335 60.234 55.259 1.00 0.00 H ATOM 44899 H2 WAT 8805 140.827 61.629 54.967 1.00 0.00 H TER 44901 WAT 8805 ATOM 44901 O WAT 8806 76.094 23.937 130.479 1.00 0.00 O ATOM 44902 H1 WAT 8806 75.677 23.513 131.229 1.00 0.00 H ATOM 44903 H2 WAT 8806 75.384 24.412 130.047 1.00 0.00 H TER 44905 WAT 8806 ATOM 44905 O WAT 8807 91.178 20.017 130.737 1.00 0.00 O ATOM 44906 H1 WAT 8807 91.667 19.195 130.752 1.00 0.00 H ATOM 44907 H2 WAT 8807 90.771 20.069 131.602 1.00 0.00 H TER 44909 WAT 8807 ATOM 44909 O WAT 8808 11.498 115.194 81.085 1.00 0.00 O ATOM 44910 H1 WAT 8808 11.844 114.876 80.251 1.00 0.00 H ATOM 44911 H2 WAT 8808 10.582 115.403 80.900 1.00 0.00 H TER 44913 WAT 8808 ATOM 44913 O WAT 8809 107.705 38.280 124.616 1.00 0.00 O ATOM 44914 H1 WAT 8809 107.551 38.967 123.967 1.00 0.00 H ATOM 44915 H2 WAT 8809 108.359 38.652 125.208 1.00 0.00 H TER 44917 WAT 8809 ATOM 44917 O WAT 8810 71.023 79.800 107.118 1.00 0.00 O ATOM 44918 H1 WAT 8810 71.054 79.071 107.737 1.00 0.00 H ATOM 44919 H2 WAT 8810 70.091 79.925 106.941 1.00 0.00 H TER 44921 WAT 8810 ATOM 44921 O WAT 8811 103.186 49.014 108.529 1.00 0.00 O ATOM 44922 H1 WAT 8811 103.589 48.199 108.231 1.00 0.00 H ATOM 44923 H2 WAT 8811 103.890 49.661 108.478 1.00 0.00 H TER 44925 WAT 8811 ATOM 44925 O WAT 8812 45.403 69.629 75.701 1.00 0.00 O ATOM 44926 H1 WAT 8812 45.083 69.911 76.558 1.00 0.00 H ATOM 44927 H2 WAT 8812 44.685 69.827 75.100 1.00 0.00 H TER 44929 WAT 8812 ATOM 44929 O WAT 8813 43.230 56.880 2.946 1.00 0.00 O ATOM 44930 H1 WAT 8813 43.182 56.835 1.991 1.00 0.00 H ATOM 44931 H2 WAT 8813 43.808 57.623 3.122 1.00 0.00 H TER 44933 WAT 8813 ATOM 44933 O WAT 8814 42.846 90.550 79.502 1.00 0.00 O ATOM 44934 H1 WAT 8814 43.786 90.727 79.503 1.00 0.00 H ATOM 44935 H2 WAT 8814 42.446 91.381 79.245 1.00 0.00 H TER 44937 WAT 8814 ATOM 44937 O WAT 8815 62.690 60.192 1.515 1.00 0.00 O ATOM 44938 H1 WAT 8815 63.288 59.923 0.817 1.00 0.00 H ATOM 44939 H2 WAT 8815 62.672 59.447 2.116 1.00 0.00 H TER 44941 WAT 8815 ATOM 44941 O WAT 8816 3.375 136.417 112.933 1.00 0.00 O ATOM 44942 H1 WAT 8816 2.921 136.788 112.176 1.00 0.00 H ATOM 44943 H2 WAT 8816 3.362 135.472 112.780 1.00 0.00 H TER 44945 WAT 8816 ATOM 44945 O WAT 8817 90.718 122.610 81.504 1.00 0.00 O ATOM 44946 H1 WAT 8817 89.997 122.862 80.927 1.00 0.00 H ATOM 44947 H2 WAT 8817 91.493 123.008 81.107 1.00 0.00 H TER 44949 WAT 8817 ATOM 44949 O WAT 8818 42.367 142.157 153.529 1.00 0.00 O ATOM 44950 H1 WAT 8818 43.171 141.848 153.947 1.00 0.00 H ATOM 44951 H2 WAT 8818 42.642 142.917 153.015 1.00 0.00 H TER 44953 WAT 8818 ATOM 44953 O WAT 8819 126.788 112.127 82.353 1.00 0.00 O ATOM 44954 H1 WAT 8819 125.912 111.947 82.696 1.00 0.00 H ATOM 44955 H2 WAT 8819 126.668 112.178 81.405 1.00 0.00 H TER 44957 WAT 8819 ATOM 44957 O WAT 8820 74.990 8.824 139.854 1.00 0.00 O ATOM 44958 H1 WAT 8820 75.916 8.931 140.072 1.00 0.00 H ATOM 44959 H2 WAT 8820 74.568 9.606 140.211 1.00 0.00 H TER 44961 WAT 8820 ATOM 44961 O WAT 8821 124.952 23.469 6.044 1.00 0.00 O ATOM 44962 H1 WAT 8821 125.673 24.024 6.342 1.00 0.00 H ATOM 44963 H2 WAT 8821 124.998 22.695 6.605 1.00 0.00 H TER 44965 WAT 8821 ATOM 44965 O WAT 8822 37.978 126.272 54.215 1.00 0.00 O ATOM 44966 H1 WAT 8822 37.992 127.037 54.790 1.00 0.00 H ATOM 44967 H2 WAT 8822 38.451 126.553 53.431 1.00 0.00 H TER 44969 WAT 8822 ATOM 44969 O WAT 8823 117.341 45.243 96.301 1.00 0.00 O ATOM 44970 H1 WAT 8823 117.137 45.671 97.132 1.00 0.00 H ATOM 44971 H2 WAT 8823 116.593 45.444 95.738 1.00 0.00 H TER 44973 WAT 8823 ATOM 44973 O WAT 8824 141.139 133.017 130.435 1.00 0.00 O ATOM 44974 H1 WAT 8824 141.517 133.760 129.964 1.00 0.00 H ATOM 44975 H2 WAT 8824 140.941 133.361 131.306 1.00 0.00 H TER 44977 WAT 8824 ATOM 44977 O WAT 8825 126.090 95.605 128.695 1.00 0.00 O ATOM 44978 H1 WAT 8825 125.816 96.503 128.880 1.00 0.00 H ATOM 44979 H2 WAT 8825 126.928 95.699 128.242 1.00 0.00 H TER 44981 WAT 8825 ATOM 44981 O WAT 8826 52.904 93.850 75.642 1.00 0.00 O ATOM 44982 H1 WAT 8826 53.612 93.207 75.625 1.00 0.00 H ATOM 44983 H2 WAT 8826 53.339 94.681 75.831 1.00 0.00 H TER 44985 WAT 8826 ATOM 44985 O WAT 8827 122.895 34.236 78.590 1.00 0.00 O ATOM 44986 H1 WAT 8827 123.496 34.945 78.358 1.00 0.00 H ATOM 44987 H2 WAT 8827 122.038 34.543 78.295 1.00 0.00 H TER 44989 WAT 8827 ATOM 44989 O WAT 8828 90.154 83.017 99.277 1.00 0.00 O ATOM 44990 H1 WAT 8828 90.435 82.235 99.751 1.00 0.00 H ATOM 44991 H2 WAT 8828 90.236 83.726 99.915 1.00 0.00 H TER 44993 WAT 8828 ATOM 44993 O WAT 8829 43.483 55.137 107.368 1.00 0.00 O ATOM 44994 H1 WAT 8829 43.263 55.203 106.439 1.00 0.00 H ATOM 44995 H2 WAT 8829 42.806 55.648 107.812 1.00 0.00 H TER 44997 WAT 8829 ATOM 44997 O WAT 8830 59.116 72.028 65.363 1.00 0.00 O ATOM 44998 H1 WAT 8830 59.318 72.948 65.192 1.00 0.00 H ATOM 44999 H2 WAT 8830 59.583 71.549 64.678 1.00 0.00 H TER 45001 WAT 8830 ATOM 45001 O WAT 8831 8.552 144.554 107.047 1.00 0.00 O ATOM 45002 H1 WAT 8831 8.320 143.681 106.733 1.00 0.00 H ATOM 45003 H2 WAT 8831 7.746 145.063 106.958 1.00 0.00 H TER 45005 WAT 8831 ATOM 45005 O WAT 8832 128.937 58.172 56.679 1.00 0.00 O ATOM 45006 H1 WAT 8832 128.005 58.272 56.485 1.00 0.00 H ATOM 45007 H2 WAT 8832 128.995 58.264 57.630 1.00 0.00 H TER 45009 WAT 8832 ATOM 45009 O WAT 8833 114.907 13.446 10.728 1.00 0.00 O ATOM 45010 H1 WAT 8833 114.535 14.186 10.248 1.00 0.00 H ATOM 45011 H2 WAT 8833 115.797 13.364 10.387 1.00 0.00 H TER 45013 WAT 8833 ATOM 45013 O WAT 8834 104.486 1.488 106.793 1.00 0.00 O ATOM 45014 H1 WAT 8834 104.079 0.974 107.490 1.00 0.00 H ATOM 45015 H2 WAT 8834 105.352 1.711 107.134 1.00 0.00 H TER 45017 WAT 8834 ATOM 45017 O WAT 8835 85.228 98.665 57.055 1.00 0.00 O ATOM 45018 H1 WAT 8835 85.812 98.177 56.474 1.00 0.00 H ATOM 45019 H2 WAT 8835 84.410 98.168 57.045 1.00 0.00 H TER 45021 WAT 8835 ATOM 45021 O WAT 8836 105.629 81.595 124.973 1.00 0.00 O ATOM 45022 H1 WAT 8836 104.688 81.769 124.987 1.00 0.00 H ATOM 45023 H2 WAT 8836 105.769 80.981 125.694 1.00 0.00 H TER 45025 WAT 8836 ATOM 45025 O WAT 8837 51.639 32.113 25.599 1.00 0.00 O ATOM 45026 H1 WAT 8837 52.214 32.307 24.859 1.00 0.00 H ATOM 45027 H2 WAT 8837 50.779 32.432 25.324 1.00 0.00 H TER 45029 WAT 8837 ATOM 45029 O WAT 8838 28.924 47.908 52.785 1.00 0.00 O ATOM 45030 H1 WAT 8838 29.304 47.561 53.592 1.00 0.00 H ATOM 45031 H2 WAT 8838 29.107 48.847 52.818 1.00 0.00 H TER 45033 WAT 8838 ATOM 45033 O WAT 8839 56.406 104.875 63.192 1.00 0.00 O ATOM 45034 H1 WAT 8839 55.766 104.946 62.484 1.00 0.00 H ATOM 45035 H2 WAT 8839 56.018 104.250 63.804 1.00 0.00 H TER 45037 WAT 8839 ATOM 45037 O WAT 8840 18.746 28.756 124.631 1.00 0.00 O ATOM 45038 H1 WAT 8840 19.261 29.562 124.624 1.00 0.00 H ATOM 45039 H2 WAT 8840 19.203 28.174 124.025 1.00 0.00 H TER 45041 WAT 8840 ATOM 45041 O WAT 8841 22.028 35.039 108.467 1.00 0.00 O ATOM 45042 H1 WAT 8841 21.781 35.940 108.675 1.00 0.00 H ATOM 45043 H2 WAT 8841 22.972 35.079 108.314 1.00 0.00 H TER 45045 WAT 8841 ATOM 45045 O WAT 8842 145.048 104.237 20.417 1.00 0.00 O ATOM 45046 H1 WAT 8842 145.579 104.248 19.621 1.00 0.00 H ATOM 45047 H2 WAT 8842 145.559 104.740 21.052 1.00 0.00 H TER 45049 WAT 8842 ATOM 45049 O WAT 8843 51.014 60.154 135.146 1.00 0.00 O ATOM 45050 H1 WAT 8843 51.744 60.334 135.738 1.00 0.00 H ATOM 45051 H2 WAT 8843 51.351 59.489 134.545 1.00 0.00 H TER 45053 WAT 8843 ATOM 45053 O WAT 8844 47.864 48.873 18.215 1.00 0.00 O ATOM 45054 H1 WAT 8844 46.978 49.051 17.901 1.00 0.00 H ATOM 45055 H2 WAT 8844 48.375 48.725 17.419 1.00 0.00 H TER 45057 WAT 8844 ATOM 45057 O WAT 8845 57.501 39.906 78.970 1.00 0.00 O ATOM 45058 H1 WAT 8845 56.844 39.506 78.400 1.00 0.00 H ATOM 45059 H2 WAT 8845 57.094 39.913 79.836 1.00 0.00 H TER 45061 WAT 8845 ATOM 45061 O WAT 8846 125.608 107.920 131.488 1.00 0.00 O ATOM 45062 H1 WAT 8846 126.243 108.567 131.183 1.00 0.00 H ATOM 45063 H2 WAT 8846 125.247 107.542 130.686 1.00 0.00 H TER 45065 WAT 8846 ATOM 45065 O WAT 8847 121.434 25.008 65.283 1.00 0.00 O ATOM 45066 H1 WAT 8847 120.607 25.276 65.682 1.00 0.00 H ATOM 45067 H2 WAT 8847 122.085 25.599 65.662 1.00 0.00 H TER 45069 WAT 8847 ATOM 45069 O WAT 8848 136.646 143.409 65.639 1.00 0.00 O ATOM 45070 H1 WAT 8848 136.458 143.198 64.725 1.00 0.00 H ATOM 45071 H2 WAT 8848 137.071 144.266 65.605 1.00 0.00 H TER 45073 WAT 8848 ATOM 45073 O WAT 8849 23.798 78.535 73.428 1.00 0.00 O ATOM 45074 H1 WAT 8849 23.261 77.847 73.821 1.00 0.00 H ATOM 45075 H2 WAT 8849 23.475 79.345 73.822 1.00 0.00 H TER 45077 WAT 8849 ATOM 45077 O WAT 8850 145.538 64.761 9.872 1.00 0.00 O ATOM 45078 H1 WAT 8850 145.829 63.992 9.383 1.00 0.00 H ATOM 45079 H2 WAT 8850 145.924 64.653 10.742 1.00 0.00 H TER 45081 WAT 8850 ATOM 45081 O WAT 8851 34.840 52.326 151.247 1.00 0.00 O ATOM 45082 H1 WAT 8851 34.242 52.350 150.501 1.00 0.00 H ATOM 45083 H2 WAT 8851 34.350 52.734 151.961 1.00 0.00 H TER 45085 WAT 8851 ATOM 45085 O WAT 8852 18.035 105.441 20.329 1.00 0.00 O ATOM 45086 H1 WAT 8852 18.625 105.703 19.621 1.00 0.00 H ATOM 45087 H2 WAT 8852 17.267 106.003 20.221 1.00 0.00 H TER 45089 WAT 8852 ATOM 45089 O WAT 8853 14.977 86.485 70.177 1.00 0.00 O ATOM 45090 H1 WAT 8853 14.455 85.690 70.069 1.00 0.00 H ATOM 45091 H2 WAT 8853 15.178 86.763 69.283 1.00 0.00 H TER 45093 WAT 8853 ATOM 45093 O WAT 8854 12.916 37.499 118.471 1.00 0.00 O ATOM 45094 H1 WAT 8854 12.591 38.049 117.758 1.00 0.00 H ATOM 45095 H2 WAT 8854 13.217 38.120 119.135 1.00 0.00 H TER 45097 WAT 8854 ATOM 45097 O WAT 8855 3.684 23.739 156.730 1.00 0.00 O ATOM 45098 H1 WAT 8855 4.495 24.048 156.325 1.00 0.00 H ATOM 45099 H2 WAT 8855 3.341 23.091 156.115 1.00 0.00 H TER 45101 WAT 8855 ATOM 45101 O WAT 8856 95.739 93.709 82.933 1.00 0.00 O ATOM 45102 H1 WAT 8856 96.694 93.763 82.952 1.00 0.00 H ATOM 45103 H2 WAT 8856 95.506 93.898 82.024 1.00 0.00 H TER 45105 WAT 8856 ATOM 45105 O WAT 8857 97.488 34.135 74.511 1.00 0.00 O ATOM 45106 H1 WAT 8857 97.020 34.304 73.693 1.00 0.00 H ATOM 45107 H2 WAT 8857 97.059 33.361 74.876 1.00 0.00 H TER 45109 WAT 8857 ATOM 45109 O WAT 8858 143.638 48.200 85.801 1.00 0.00 O ATOM 45110 H1 WAT 8858 144.120 49.021 85.900 1.00 0.00 H ATOM 45111 H2 WAT 8858 143.689 48.003 84.866 1.00 0.00 H TER 45113 WAT 8858 ATOM 45113 O WAT 8859 89.195 88.042 68.277 1.00 0.00 O ATOM 45114 H1 WAT 8859 88.944 87.908 69.191 1.00 0.00 H ATOM 45115 H2 WAT 8859 90.031 88.506 68.324 1.00 0.00 H TER 45117 WAT 8859 ATOM 45117 O WAT 8860 11.407 49.877 127.012 1.00 0.00 O ATOM 45118 H1 WAT 8860 10.855 49.676 126.256 1.00 0.00 H ATOM 45119 H2 WAT 8860 10.933 49.511 127.759 1.00 0.00 H TER 45121 WAT 8860 ATOM 45121 O WAT 8861 134.004 67.894 18.466 1.00 0.00 O ATOM 45122 H1 WAT 8861 133.379 68.585 18.687 1.00 0.00 H ATOM 45123 H2 WAT 8861 134.426 67.679 19.298 1.00 0.00 H TER 45125 WAT 8861 ATOM 45125 O WAT 8862 29.280 41.916 92.174 1.00 0.00 O ATOM 45126 H1 WAT 8862 30.204 41.906 91.925 1.00 0.00 H ATOM 45127 H2 WAT 8862 29.162 41.119 92.691 1.00 0.00 H TER 45129 WAT 8862 ATOM 45129 O WAT 8863 3.940 138.735 0.185 1.00 0.00 O ATOM 45130 H1 WAT 8863 3.572 137.953 0.597 1.00 0.00 H ATOM 45131 H2 WAT 8863 3.979 138.519 -0.747 1.00 0.00 H TER 45133 WAT 8863 ATOM 45133 O WAT 8864 31.634 32.631 69.982 1.00 0.00 O ATOM 45134 H1 WAT 8864 31.177 33.037 69.245 1.00 0.00 H ATOM 45135 H2 WAT 8864 32.259 33.296 70.271 1.00 0.00 H TER 45137 WAT 8864 ATOM 45137 O WAT 8865 34.630 48.344 101.858 1.00 0.00 O ATOM 45138 H1 WAT 8865 33.780 47.935 102.023 1.00 0.00 H ATOM 45139 H2 WAT 8865 34.612 48.568 100.928 1.00 0.00 H TER 45141 WAT 8865 ATOM 45141 O WAT 8866 119.546 47.949 14.597 1.00 0.00 O ATOM 45142 H1 WAT 8866 119.691 48.681 15.196 1.00 0.00 H ATOM 45143 H2 WAT 8866 120.300 47.375 14.733 1.00 0.00 H TER 45145 WAT 8866 ATOM 45145 O WAT 8867 52.531 84.319 16.470 1.00 0.00 O ATOM 45146 H1 WAT 8867 52.970 84.428 15.627 1.00 0.00 H ATOM 45147 H2 WAT 8867 52.943 84.968 17.040 1.00 0.00 H TER 45149 WAT 8867 ATOM 45149 O WAT 8868 7.170 41.183 96.326 1.00 0.00 O ATOM 45150 H1 WAT 8868 7.111 40.513 97.007 1.00 0.00 H ATOM 45151 H2 WAT 8868 7.996 40.998 95.879 1.00 0.00 H TER 45153 WAT 8868 ATOM 45153 O WAT 8869 6.108 15.090 62.955 1.00 0.00 O ATOM 45154 H1 WAT 8869 5.220 14.733 62.948 1.00 0.00 H ATOM 45155 H2 WAT 8869 6.198 15.527 62.108 1.00 0.00 H TER 45157 WAT 8869 ATOM 45157 O WAT 8870 130.728 18.061 151.495 1.00 0.00 O ATOM 45158 H1 WAT 8870 129.976 18.167 152.078 1.00 0.00 H ATOM 45159 H2 WAT 8870 130.995 18.955 151.283 1.00 0.00 H TER 45161 WAT 8870 ATOM 45161 O WAT 8871 69.869 42.677 85.788 1.00 0.00 O ATOM 45162 H1 WAT 8871 69.689 42.350 86.670 1.00 0.00 H ATOM 45163 H2 WAT 8871 69.072 43.143 85.538 1.00 0.00 H TER 45165 WAT 8871 ATOM 45165 O WAT 8872 20.605 87.747 108.356 1.00 0.00 O ATOM 45166 H1 WAT 8872 21.040 88.183 107.623 1.00 0.00 H ATOM 45167 H2 WAT 8872 21.239 87.096 108.658 1.00 0.00 H TER 45169 WAT 8872 ATOM 45169 O WAT 8873 71.081 20.750 72.300 1.00 0.00 O ATOM 45170 H1 WAT 8873 70.164 20.874 72.058 1.00 0.00 H ATOM 45171 H2 WAT 8873 71.521 20.542 71.475 1.00 0.00 H TER 45173 WAT 8873 ATOM 45173 O WAT 8874 121.745 66.946 60.122 1.00 0.00 O ATOM 45174 H1 WAT 8874 122.327 66.439 59.557 1.00 0.00 H ATOM 45175 H2 WAT 8874 120.980 67.129 59.577 1.00 0.00 H TER 45177 WAT 8874 ATOM 45177 O WAT 8875 94.494 29.001 73.502 1.00 0.00 O ATOM 45178 H1 WAT 8875 94.651 28.624 74.367 1.00 0.00 H ATOM 45179 H2 WAT 8875 93.984 28.337 73.039 1.00 0.00 H TER 45181 WAT 8875 ATOM 45181 O WAT 8876 21.964 129.223 102.318 1.00 0.00 O ATOM 45182 H1 WAT 8876 22.514 129.480 103.057 1.00 0.00 H ATOM 45183 H2 WAT 8876 21.071 129.246 102.664 1.00 0.00 H TER 45185 WAT 8876 ATOM 45185 O WAT 8877 137.616 86.146 158.361 1.00 0.00 O ATOM 45186 H1 WAT 8877 137.873 85.682 159.158 1.00 0.00 H ATOM 45187 H2 WAT 8877 137.921 85.585 157.648 1.00 0.00 H TER 45189 WAT 8877 ATOM 45189 O WAT 8878 144.342 72.948 143.839 1.00 0.00 O ATOM 45190 H1 WAT 8878 143.910 72.384 143.197 1.00 0.00 H ATOM 45191 H2 WAT 8878 144.040 73.830 143.624 1.00 0.00 H TER 45193 WAT 8878 ATOM 45193 O WAT 8879 24.117 90.961 91.886 1.00 0.00 O ATOM 45194 H1 WAT 8879 23.749 90.515 92.649 1.00 0.00 H ATOM 45195 H2 WAT 8879 23.373 91.080 91.296 1.00 0.00 H TER 45197 WAT 8879 ATOM 45197 O WAT 8880 48.983 92.516 63.844 1.00 0.00 O ATOM 45198 H1 WAT 8880 49.187 91.819 64.468 1.00 0.00 H ATOM 45199 H2 WAT 8880 48.027 92.558 63.837 1.00 0.00 H TER 45201 WAT 8880 ATOM 45201 O WAT 8881 41.127 23.597 56.132 1.00 0.00 O ATOM 45202 H1 WAT 8881 41.567 24.387 55.820 1.00 0.00 H ATOM 45203 H2 WAT 8881 40.534 23.356 55.420 1.00 0.00 H TER 45205 WAT 8881 ATOM 45205 O WAT 8882 82.969 37.457 1.516 1.00 0.00 O ATOM 45206 H1 WAT 8882 83.731 37.275 2.067 1.00 0.00 H ATOM 45207 H2 WAT 8882 82.270 36.920 1.888 1.00 0.00 H TER 45209 WAT 8882 ATOM 45209 O WAT 8883 124.165 96.258 113.489 1.00 0.00 O ATOM 45210 H1 WAT 8883 123.786 95.487 113.067 1.00 0.00 H ATOM 45211 H2 WAT 8883 123.681 96.996 113.120 1.00 0.00 H TER 45213 WAT 8883 ATOM 45213 O WAT 8884 46.919 130.664 0.753 1.00 0.00 O ATOM 45214 H1 WAT 8884 47.368 129.922 1.156 1.00 0.00 H ATOM 45215 H2 WAT 8884 47.409 130.832 -0.052 1.00 0.00 H TER 45217 WAT 8884 ATOM 45217 O WAT 8885 2.607 105.655 108.886 1.00 0.00 O ATOM 45218 H1 WAT 8885 2.643 104.698 108.902 1.00 0.00 H ATOM 45219 H2 WAT 8885 3.343 105.913 108.331 1.00 0.00 H TER 45221 WAT 8885 ATOM 45221 O WAT 8886 60.451 2.939 132.127 1.00 0.00 O ATOM 45222 H1 WAT 8886 59.654 2.414 132.201 1.00 0.00 H ATOM 45223 H2 WAT 8886 61.075 2.513 132.715 1.00 0.00 H TER 45225 WAT 8886 ATOM 45225 O WAT 8887 114.685 10.885 3.165 1.00 0.00 O ATOM 45226 H1 WAT 8887 115.394 10.393 3.579 1.00 0.00 H ATOM 45227 H2 WAT 8887 115.065 11.743 2.978 1.00 0.00 H TER 45229 WAT 8887 ATOM 45229 O WAT 8888 77.625 92.108 103.009 1.00 0.00 O ATOM 45230 H1 WAT 8888 78.149 91.465 102.531 1.00 0.00 H ATOM 45231 H2 WAT 8888 76.765 92.074 102.589 1.00 0.00 H TER 45233 WAT 8888 ATOM 45233 O WAT 8889 5.577 50.758 12.576 1.00 0.00 O ATOM 45234 H1 WAT 8889 5.780 51.622 12.218 1.00 0.00 H ATOM 45235 H2 WAT 8889 6.189 50.651 13.304 1.00 0.00 H TER 45237 WAT 8889 ATOM 45237 O WAT 8890 19.820 28.905 138.437 1.00 0.00 O ATOM 45238 H1 WAT 8890 20.163 29.104 139.308 1.00 0.00 H ATOM 45239 H2 WAT 8890 19.713 29.760 138.020 1.00 0.00 H TER 45241 WAT 8890 ATOM 45241 O WAT 8891 111.587 83.072 99.858 1.00 0.00 O ATOM 45242 H1 WAT 8891 112.464 83.450 99.924 1.00 0.00 H ATOM 45243 H2 WAT 8891 111.533 82.748 98.959 1.00 0.00 H TER 45245 WAT 8891 ATOM 45245 O WAT 8892 74.362 128.744 115.817 1.00 0.00 O ATOM 45246 H1 WAT 8892 74.498 128.129 115.097 1.00 0.00 H ATOM 45247 H2 WAT 8892 74.815 128.347 116.561 1.00 0.00 H TER 45249 WAT 8892 ATOM 45249 O WAT 8893 6.527 28.655 15.941 1.00 0.00 O ATOM 45250 H1 WAT 8893 5.843 29.313 15.815 1.00 0.00 H ATOM 45251 H2 WAT 8893 6.072 27.908 16.329 1.00 0.00 H TER 45253 WAT 8893 ATOM 45253 O WAT 8894 16.098 145.625 112.332 1.00 0.00 O ATOM 45254 H1 WAT 8894 15.404 146.062 112.824 1.00 0.00 H ATOM 45255 H2 WAT 8894 15.651 145.238 111.579 1.00 0.00 H TER 45257 WAT 8894 ATOM 45257 O WAT 8895 60.479 15.151 130.761 1.00 0.00 O ATOM 45258 H1 WAT 8895 59.541 15.271 130.912 1.00 0.00 H ATOM 45259 H2 WAT 8895 60.833 16.040 130.732 1.00 0.00 H TER 45261 WAT 8895 ATOM 45261 O WAT 8896 128.407 56.977 85.025 1.00 0.00 O ATOM 45262 H1 WAT 8896 129.014 57.036 84.286 1.00 0.00 H ATOM 45263 H2 WAT 8896 128.521 57.803 85.494 1.00 0.00 H TER 45265 WAT 8896 ATOM 45265 O WAT 8897 34.991 26.115 58.878 1.00 0.00 O ATOM 45266 H1 WAT 8897 35.530 25.473 58.416 1.00 0.00 H ATOM 45267 H2 WAT 8897 34.815 26.794 58.225 1.00 0.00 H TER 45269 WAT 8897 ATOM 45269 O WAT 8898 111.502 85.685 151.224 1.00 0.00 O ATOM 45270 H1 WAT 8898 111.093 86.424 151.674 1.00 0.00 H ATOM 45271 H2 WAT 8898 111.521 84.986 151.879 1.00 0.00 H TER 45273 WAT 8898 ATOM 45273 O WAT 8899 63.382 124.923 129.718 1.00 0.00 O ATOM 45274 H1 WAT 8899 63.858 124.093 129.705 1.00 0.00 H ATOM 45275 H2 WAT 8899 64.007 125.551 130.081 1.00 0.00 H TER 45277 WAT 8899 ATOM 45277 O WAT 8900 0.628 76.936 71.357 1.00 0.00 O ATOM 45278 H1 WAT 8900 1.385 76.562 71.807 1.00 0.00 H ATOM 45279 H2 WAT 8900 0.885 76.961 70.435 1.00 0.00 H TER 45281 WAT 8900 ATOM 45281 O WAT 8901 69.249 35.148 135.288 1.00 0.00 O ATOM 45282 H1 WAT 8901 68.489 34.998 134.726 1.00 0.00 H ATOM 45283 H2 WAT 8901 69.900 34.515 134.986 1.00 0.00 H TER 45285 WAT 8901 ATOM 45285 O WAT 8902 126.068 15.542 81.521 1.00 0.00 O ATOM 45286 H1 WAT 8902 125.905 14.779 82.074 1.00 0.00 H ATOM 45287 H2 WAT 8902 126.718 15.243 80.885 1.00 0.00 H TER 45289 WAT 8902 ATOM 45289 O WAT 8903 130.665 86.577 10.350 1.00 0.00 O ATOM 45290 H1 WAT 8903 130.412 85.833 9.804 1.00 0.00 H ATOM 45291 H2 WAT 8903 130.280 86.388 11.206 1.00 0.00 H TER 45293 WAT 8903 ATOM 45293 O WAT 8904 124.283 97.517 62.879 1.00 0.00 O ATOM 45294 H1 WAT 8904 123.523 96.955 62.729 1.00 0.00 H ATOM 45295 H2 WAT 8904 124.923 97.233 62.226 1.00 0.00 H TER 45297 WAT 8904 ATOM 45297 O WAT 8905 137.334 65.269 140.885 1.00 0.00 O ATOM 45298 H1 WAT 8905 136.413 65.405 140.666 1.00 0.00 H ATOM 45299 H2 WAT 8905 137.483 64.337 140.729 1.00 0.00 H TER 45301 WAT 8905 ATOM 45301 O WAT 8906 122.389 29.079 117.717 1.00 0.00 O ATOM 45302 H1 WAT 8906 122.494 28.160 117.965 1.00 0.00 H ATOM 45303 H2 WAT 8906 123.251 29.341 117.396 1.00 0.00 H TER 45305 WAT 8906 ATOM 45305 O WAT 8907 70.860 86.190 119.836 1.00 0.00 O ATOM 45306 H1 WAT 8907 70.395 86.852 119.324 1.00 0.00 H ATOM 45307 H2 WAT 8907 70.314 86.059 120.611 1.00 0.00 H TER 45309 WAT 8907 ATOM 45309 O WAT 8908 30.915 39.978 132.747 1.00 0.00 O ATOM 45310 H1 WAT 8908 31.758 40.185 133.151 1.00 0.00 H ATOM 45311 H2 WAT 8908 30.365 39.689 133.476 1.00 0.00 H TER 45313 WAT 8908 ATOM 45313 O WAT 8909 13.050 35.852 4.919 1.00 0.00 O ATOM 45314 H1 WAT 8909 12.663 36.010 5.780 1.00 0.00 H ATOM 45315 H2 WAT 8909 13.539 35.036 5.022 1.00 0.00 H TER 45317 WAT 8909 ATOM 45317 O WAT 8910 56.815 143.587 14.938 1.00 0.00 O ATOM 45318 H1 WAT 8910 56.243 144.175 14.445 1.00 0.00 H ATOM 45319 H2 WAT 8910 57.369 144.170 15.456 1.00 0.00 H TER 45321 WAT 8910 ATOM 45321 O WAT 8911 91.831 53.026 62.271 1.00 0.00 O ATOM 45322 H1 WAT 8911 92.240 52.998 61.406 1.00 0.00 H ATOM 45323 H2 WAT 8911 92.358 53.655 62.765 1.00 0.00 H TER 45325 WAT 8911 ATOM 45325 O WAT 8912 111.808 52.382 122.655 1.00 0.00 O ATOM 45326 H1 WAT 8912 111.246 51.752 123.106 1.00 0.00 H ATOM 45327 H2 WAT 8912 112.489 51.848 122.247 1.00 0.00 H TER 45329 WAT 8912 ATOM 45329 O WAT 8913 106.323 32.223 94.630 1.00 0.00 O ATOM 45330 H1 WAT 8913 105.906 32.758 95.306 1.00 0.00 H ATOM 45331 H2 WAT 8913 106.855 31.593 95.117 1.00 0.00 H TER 45333 WAT 8913 ATOM 45333 O WAT 8914 51.878 137.999 151.026 1.00 0.00 O ATOM 45334 H1 WAT 8914 51.622 137.931 150.106 1.00 0.00 H ATOM 45335 H2 WAT 8914 52.790 137.708 151.042 1.00 0.00 H TER 45337 WAT 8914 ATOM 45337 O WAT 8915 89.350 112.868 10.059 1.00 0.00 O ATOM 45338 H1 WAT 8915 88.444 113.175 10.053 1.00 0.00 H ATOM 45339 H2 WAT 8915 89.336 112.071 9.529 1.00 0.00 H TER 45341 WAT 8915 ATOM 45341 O WAT 8916 108.696 57.591 144.742 1.00 0.00 O ATOM 45342 H1 WAT 8916 108.701 58.459 144.339 1.00 0.00 H ATOM 45343 H2 WAT 8916 107.887 57.186 144.428 1.00 0.00 H TER 45345 WAT 8916 ATOM 45345 O WAT 8917 115.665 24.433 123.616 1.00 0.00 O ATOM 45346 H1 WAT 8917 116.308 24.776 124.237 1.00 0.00 H ATOM 45347 H2 WAT 8917 114.961 25.082 123.618 1.00 0.00 H TER 45349 WAT 8917 ATOM 45349 O WAT 8918 48.807 96.378 137.264 1.00 0.00 O ATOM 45350 H1 WAT 8918 49.693 96.401 137.625 1.00 0.00 H ATOM 45351 H2 WAT 8918 48.640 95.450 137.097 1.00 0.00 H TER 45353 WAT 8918 ATOM 45353 O WAT 8919 95.428 137.122 75.316 1.00 0.00 O ATOM 45354 H1 WAT 8919 95.937 136.387 74.974 1.00 0.00 H ATOM 45355 H2 WAT 8919 94.525 136.804 75.326 1.00 0.00 H TER 45357 WAT 8919 ATOM 45357 O WAT 8920 57.828 79.328 123.937 1.00 0.00 O ATOM 45358 H1 WAT 8920 58.773 79.352 123.788 1.00 0.00 H ATOM 45359 H2 WAT 8920 57.563 78.453 123.654 1.00 0.00 H TER 45361 WAT 8920 ATOM 45361 O WAT 8921 104.280 63.462 23.612 1.00 0.00 O ATOM 45362 H1 WAT 8921 104.310 64.375 23.325 1.00 0.00 H ATOM 45363 H2 WAT 8921 105.128 63.101 23.351 1.00 0.00 H TER 45365 WAT 8921 ATOM 45365 O WAT 8922 1.338 53.428 88.766 1.00 0.00 O ATOM 45366 H1 WAT 8922 0.890 52.727 89.240 1.00 0.00 H ATOM 45367 H2 WAT 8922 0.707 53.710 88.104 1.00 0.00 H TER 45369 WAT 8922 ATOM 45369 O WAT 8923 82.877 102.406 12.521 1.00 0.00 O ATOM 45370 H1 WAT 8923 82.166 102.433 11.881 1.00 0.00 H ATOM 45371 H2 WAT 8923 82.706 101.617 13.036 1.00 0.00 H TER 45373 WAT 8923 ATOM 45373 O WAT 8924 34.925 115.356 83.861 1.00 0.00 O ATOM 45374 H1 WAT 8924 35.558 115.310 84.577 1.00 0.00 H ATOM 45375 H2 WAT 8924 34.327 114.626 84.022 1.00 0.00 H TER 45377 WAT 8924 ATOM 45377 O WAT 8925 42.524 53.582 60.292 1.00 0.00 O ATOM 45378 H1 WAT 8925 41.651 53.503 60.677 1.00 0.00 H ATOM 45379 H2 WAT 8925 42.748 52.691 60.022 1.00 0.00 H TER 45381 WAT 8925 ATOM 45381 O WAT 8926 84.152 45.690 12.214 1.00 0.00 O ATOM 45382 H1 WAT 8926 84.885 45.864 11.623 1.00 0.00 H ATOM 45383 H2 WAT 8926 83.435 46.223 11.869 1.00 0.00 H TER 45385 WAT 8926 ATOM 45385 O WAT 8927 45.018 120.165 85.127 1.00 0.00 O ATOM 45386 H1 WAT 8927 45.686 119.960 85.782 1.00 0.00 H ATOM 45387 H2 WAT 8927 45.436 120.805 84.552 1.00 0.00 H TER 45389 WAT 8927 ATOM 45389 O WAT 8928 11.362 4.275 131.242 1.00 0.00 O ATOM 45390 H1 WAT 8928 10.657 4.722 130.774 1.00 0.00 H ATOM 45391 H2 WAT 8928 12.107 4.308 130.642 1.00 0.00 H TER 45393 WAT 8928 ATOM 45393 O WAT 8929 47.101 52.666 75.447 1.00 0.00 O ATOM 45394 H1 WAT 8929 46.309 52.963 75.896 1.00 0.00 H ATOM 45395 H2 WAT 8929 47.136 53.193 74.649 1.00 0.00 H TER 45397 WAT 8929 ATOM 45397 O WAT 8930 38.910 69.238 106.543 1.00 0.00 O ATOM 45398 H1 WAT 8930 38.004 69.489 106.723 1.00 0.00 H ATOM 45399 H2 WAT 8930 39.058 69.508 105.637 1.00 0.00 H TER 45401 WAT 8930 ATOM 45401 O WAT 8931 5.501 90.394 130.231 1.00 0.00 O ATOM 45402 H1 WAT 8931 6.200 90.534 130.870 1.00 0.00 H ATOM 45403 H2 WAT 8931 5.680 91.028 129.537 1.00 0.00 H TER 45405 WAT 8931 ATOM 45405 O WAT 8932 63.964 53.124 86.272 1.00 0.00 O ATOM 45406 H1 WAT 8932 63.679 52.362 86.775 1.00 0.00 H ATOM 45407 H2 WAT 8932 64.917 53.122 86.352 1.00 0.00 H TER 45409 WAT 8932 ATOM 45409 O WAT 8933 29.525 75.370 69.517 1.00 0.00 O ATOM 45410 H1 WAT 8933 29.006 76.156 69.692 1.00 0.00 H ATOM 45411 H2 WAT 8933 30.318 75.697 69.092 1.00 0.00 H TER 45413 WAT 8933 ATOM 45413 O WAT 8934 15.666 68.777 78.757 1.00 0.00 O ATOM 45414 H1 WAT 8934 15.304 69.557 79.178 1.00 0.00 H ATOM 45415 H2 WAT 8934 15.075 68.070 79.014 1.00 0.00 H TER 45417 WAT 8934 ATOM 45417 O WAT 8935 51.649 136.751 144.906 1.00 0.00 O ATOM 45418 H1 WAT 8935 52.093 136.684 144.060 1.00 0.00 H ATOM 45419 H2 WAT 8935 51.870 137.626 145.223 1.00 0.00 H TER 45421 WAT 8935 ATOM 45421 O WAT 8936 135.336 17.561 123.898 1.00 0.00 O ATOM 45422 H1 WAT 8936 135.648 17.376 123.012 1.00 0.00 H ATOM 45423 H2 WAT 8936 134.624 18.189 123.775 1.00 0.00 H TER 45425 WAT 8936 ATOM 45425 O WAT 8937 74.847 29.847 142.254 1.00 0.00 O ATOM 45426 H1 WAT 8937 75.502 29.355 141.758 1.00 0.00 H ATOM 45427 H2 WAT 8937 75.356 30.481 142.759 1.00 0.00 H TER 45429 WAT 8937 ATOM 45429 O WAT 8938 141.849 40.961 113.929 1.00 0.00 O ATOM 45430 H1 WAT 8938 140.974 41.344 113.994 1.00 0.00 H ATOM 45431 H2 WAT 8938 142.129 41.152 113.034 1.00 0.00 H TER 45433 WAT 8938 ATOM 45433 O WAT 8939 41.139 108.913 92.463 1.00 0.00 O ATOM 45434 H1 WAT 8939 41.055 108.146 91.897 1.00 0.00 H ATOM 45435 H2 WAT 8939 40.237 109.158 92.669 1.00 0.00 H TER 45437 WAT 8939 ATOM 45437 O WAT 8940 16.897 110.137 141.845 1.00 0.00 O ATOM 45438 H1 WAT 8940 17.192 110.555 142.654 1.00 0.00 H ATOM 45439 H2 WAT 8940 17.675 109.692 141.507 1.00 0.00 H TER 45441 WAT 8940 ATOM 45441 O WAT 8941 105.998 79.338 120.544 1.00 0.00 O ATOM 45442 H1 WAT 8941 105.804 78.559 121.065 1.00 0.00 H ATOM 45443 H2 WAT 8941 106.954 79.386 120.531 1.00 0.00 H TER 45445 WAT 8941 ATOM 45445 O WAT 8942 31.658 20.353 15.229 1.00 0.00 O ATOM 45446 H1 WAT 8942 31.022 21.033 15.004 1.00 0.00 H ATOM 45447 H2 WAT 8942 31.646 19.757 14.479 1.00 0.00 H TER 45449 WAT 8942 ATOM 45449 O WAT 8943 79.362 75.064 124.505 1.00 0.00 O ATOM 45450 H1 WAT 8943 79.321 75.902 124.046 1.00 0.00 H ATOM 45451 H2 WAT 8943 78.581 74.593 124.213 1.00 0.00 H TER 45453 WAT 8943 ATOM 45453 O WAT 8944 28.071 103.791 118.661 1.00 0.00 O ATOM 45454 H1 WAT 8944 27.542 104.493 119.040 1.00 0.00 H ATOM 45455 H2 WAT 8944 28.693 103.561 119.352 1.00 0.00 H TER 45457 WAT 8944 ATOM 45457 O WAT 8945 14.420 133.058 5.046 1.00 0.00 O ATOM 45458 H1 WAT 8945 14.658 133.053 4.119 1.00 0.00 H ATOM 45459 H2 WAT 8945 15.105 132.541 5.472 1.00 0.00 H TER 45461 WAT 8945 ATOM 45461 O WAT 8946 14.363 13.852 108.982 1.00 0.00 O ATOM 45462 H1 WAT 8946 14.998 13.954 109.691 1.00 0.00 H ATOM 45463 H2 WAT 8946 13.626 14.406 109.238 1.00 0.00 H TER 45465 WAT 8946 ATOM 45465 O WAT 8947 59.195 66.075 9.044 1.00 0.00 O ATOM 45466 H1 WAT 8947 59.187 65.593 8.217 1.00 0.00 H ATOM 45467 H2 WAT 8947 59.125 66.994 8.787 1.00 0.00 H TER 45469 WAT 8947 ATOM 45469 O WAT 8948 120.097 24.145 74.223 1.00 0.00 O ATOM 45470 H1 WAT 8948 119.892 24.262 75.151 1.00 0.00 H ATOM 45471 H2 WAT 8948 120.521 23.288 74.179 1.00 0.00 H TER 45473 WAT 8948 ATOM 45473 O WAT 8949 43.850 87.390 18.286 1.00 0.00 O ATOM 45474 H1 WAT 8949 44.364 88.084 18.701 1.00 0.00 H ATOM 45475 H2 WAT 8949 43.029 87.816 18.038 1.00 0.00 H TER 45477 WAT 8949 ATOM 45477 O WAT 8950 23.342 135.025 70.182 1.00 0.00 O ATOM 45478 H1 WAT 8950 23.228 134.648 71.055 1.00 0.00 H ATOM 45479 H2 WAT 8950 23.411 135.967 70.336 1.00 0.00 H TER 45481 WAT 8950 ATOM 45481 O WAT 8951 136.366 56.390 140.705 1.00 0.00 O ATOM 45482 H1 WAT 8951 137.054 56.428 141.370 1.00 0.00 H ATOM 45483 H2 WAT 8951 136.835 56.243 139.884 1.00 0.00 H TER 45485 WAT 8951 ATOM 45485 O WAT 8952 7.557 54.914 6.400 1.00 0.00 O ATOM 45486 H1 WAT 8952 8.256 54.962 5.748 1.00 0.00 H ATOM 45487 H2 WAT 8952 7.787 54.161 6.943 1.00 0.00 H TER 45489 WAT 8952 ATOM 45489 O WAT 8953 86.700 5.425 63.721 1.00 0.00 O ATOM 45490 H1 WAT 8953 86.874 4.534 63.417 1.00 0.00 H ATOM 45491 H2 WAT 8953 87.359 5.961 63.281 1.00 0.00 H TER 45493 WAT 8953 ATOM 45493 O WAT 8954 87.991 66.083 90.153 1.00 0.00 O ATOM 45494 H1 WAT 8954 87.599 66.856 89.746 1.00 0.00 H ATOM 45495 H2 WAT 8954 88.896 66.081 89.839 1.00 0.00 H TER 45497 WAT 8954 ATOM 45497 O WAT 8955 96.360 65.772 27.000 1.00 0.00 O ATOM 45498 H1 WAT 8955 96.778 65.538 26.172 1.00 0.00 H ATOM 45499 H2 WAT 8955 97.073 66.110 27.542 1.00 0.00 H TER 45501 WAT 8955 ATOM 45501 O WAT 8956 103.630 64.728 71.025 1.00 0.00 O ATOM 45502 H1 WAT 8956 104.405 64.891 71.562 1.00 0.00 H ATOM 45503 H2 WAT 8956 103.025 64.272 71.610 1.00 0.00 H TER 45505 WAT 8956 ATOM 45505 O WAT 8957 135.566 110.213 78.443 1.00 0.00 O ATOM 45506 H1 WAT 8957 135.786 110.380 77.527 1.00 0.00 H ATOM 45507 H2 WAT 8957 135.333 109.285 78.469 1.00 0.00 H TER 45509 WAT 8957 ATOM 45509 O WAT 8958 140.828 103.192 142.313 1.00 0.00 O ATOM 45510 H1 WAT 8958 141.086 102.540 141.661 1.00 0.00 H ATOM 45511 H2 WAT 8958 141.302 102.939 143.105 1.00 0.00 H TER 45513 WAT 8958 ATOM 45513 O WAT 8959 83.443 39.979 95.928 1.00 0.00 O ATOM 45514 H1 WAT 8959 83.781 40.681 96.484 1.00 0.00 H ATOM 45515 H2 WAT 8959 83.180 40.418 95.120 1.00 0.00 H TER 45517 WAT 8959 ATOM 45517 O WAT 8960 100.583 52.840 113.367 1.00 0.00 O ATOM 45518 H1 WAT 8960 101.385 53.357 113.292 1.00 0.00 H ATOM 45519 H2 WAT 8960 100.872 51.933 113.266 1.00 0.00 H TER 45521 WAT 8960 ATOM 45521 O WAT 8961 21.059 108.711 27.125 1.00 0.00 O ATOM 45522 H1 WAT 8961 21.715 109.221 26.650 1.00 0.00 H ATOM 45523 H2 WAT 8961 20.224 109.119 26.893 1.00 0.00 H TER 45525 WAT 8961 ATOM 45525 O WAT 8962 66.453 19.963 13.707 1.00 0.00 O ATOM 45526 H1 WAT 8962 66.783 19.552 14.507 1.00 0.00 H ATOM 45527 H2 WAT 8962 66.497 19.272 13.047 1.00 0.00 H TER 45529 WAT 8962 ATOM 45529 O WAT 8963 47.792 104.474 92.036 1.00 0.00 O ATOM 45530 H1 WAT 8963 47.420 104.249 91.183 1.00 0.00 H ATOM 45531 H2 WAT 8963 48.738 104.484 91.890 1.00 0.00 H TER 45533 WAT 8963 ATOM 45533 O WAT 8964 120.629 109.321 3.730 1.00 0.00 O ATOM 45534 H1 WAT 8964 121.035 108.500 3.452 1.00 0.00 H ATOM 45535 H2 WAT 8964 120.496 109.810 2.918 1.00 0.00 H TER 45537 WAT 8964 ATOM 45537 O WAT 8965 124.629 141.541 2.782 1.00 0.00 O ATOM 45538 H1 WAT 8965 124.389 140.708 3.187 1.00 0.00 H ATOM 45539 H2 WAT 8965 124.214 141.516 1.919 1.00 0.00 H TER 45541 WAT 8965 ATOM 45541 O WAT 8966 10.807 12.998 153.910 1.00 0.00 O ATOM 45542 H1 WAT 8966 10.446 12.201 154.299 1.00 0.00 H ATOM 45543 H2 WAT 8966 10.216 13.198 153.184 1.00 0.00 H TER 45545 WAT 8966 ATOM 45545 O WAT 8967 115.450 35.984 116.832 1.00 0.00 O ATOM 45546 H1 WAT 8967 115.925 35.336 116.313 1.00 0.00 H ATOM 45547 H2 WAT 8967 114.535 35.879 116.568 1.00 0.00 H TER 45549 WAT 8967 ATOM 45549 O WAT 8968 143.996 96.013 63.179 1.00 0.00 O ATOM 45550 H1 WAT 8968 144.020 96.941 62.944 1.00 0.00 H ATOM 45551 H2 WAT 8968 143.150 95.706 62.854 1.00 0.00 H TER 45553 WAT 8968 ATOM 45553 O WAT 8969 74.269 74.754 156.748 1.00 0.00 O ATOM 45554 H1 WAT 8969 73.974 75.136 155.922 1.00 0.00 H ATOM 45555 H2 WAT 8969 74.621 73.898 156.504 1.00 0.00 H TER 45557 WAT 8969 ATOM 45557 O WAT 8970 16.542 24.886 152.979 1.00 0.00 O ATOM 45558 H1 WAT 8970 15.721 24.850 153.470 1.00 0.00 H ATOM 45559 H2 WAT 8970 16.997 25.652 153.330 1.00 0.00 H TER 45561 WAT 8970 ATOM 45561 O WAT 8971 43.103 41.346 14.223 1.00 0.00 O ATOM 45562 H1 WAT 8971 43.542 40.513 14.054 1.00 0.00 H ATOM 45563 H2 WAT 8971 43.362 41.577 15.115 1.00 0.00 H TER 45565 WAT 8971 ATOM 45565 O WAT 8972 13.740 115.247 13.554 1.00 0.00 O ATOM 45566 H1 WAT 8972 12.931 114.736 13.544 1.00 0.00 H ATOM 45567 H2 WAT 8972 13.954 115.376 12.630 1.00 0.00 H TER 45569 WAT 8972 ATOM 45569 O WAT 8973 87.122 138.526 88.224 1.00 0.00 O ATOM 45570 H1 WAT 8973 87.743 138.181 88.865 1.00 0.00 H ATOM 45571 H2 WAT 8973 86.293 138.579 88.699 1.00 0.00 H TER 45573 WAT 8973 ATOM 45573 O WAT 8974 103.713 29.423 20.491 1.00 0.00 O ATOM 45574 H1 WAT 8974 104.551 29.049 20.764 1.00 0.00 H ATOM 45575 H2 WAT 8974 103.804 29.550 19.547 1.00 0.00 H TER 45577 WAT 8974 ATOM 45577 O WAT 8975 45.587 102.419 2.557 1.00 0.00 O ATOM 45578 H1 WAT 8975 45.044 101.654 2.363 1.00 0.00 H ATOM 45579 H2 WAT 8975 45.059 102.940 3.162 1.00 0.00 H TER 45581 WAT 8975 ATOM 45581 O WAT 8976 36.740 39.116 114.596 1.00 0.00 O ATOM 45582 H1 WAT 8976 36.040 39.727 114.365 1.00 0.00 H ATOM 45583 H2 WAT 8976 36.398 38.634 115.349 1.00 0.00 H TER 45585 WAT 8976 ATOM 45585 O WAT 8977 107.325 0.741 76.984 1.00 0.00 O ATOM 45586 H1 WAT 8977 107.158 0.126 77.698 1.00 0.00 H ATOM 45587 H2 WAT 8977 108.241 0.593 76.749 1.00 0.00 H TER 45589 WAT 8977 ATOM 45589 O WAT 8978 8.643 17.818 104.217 1.00 0.00 O ATOM 45590 H1 WAT 8978 8.219 18.443 103.629 1.00 0.00 H ATOM 45591 H2 WAT 8978 8.178 17.917 105.048 1.00 0.00 H TER 45593 WAT 8978 ATOM 45593 O WAT 8979 118.534 105.371 14.768 1.00 0.00 O ATOM 45594 H1 WAT 8979 119.008 105.912 15.398 1.00 0.00 H ATOM 45595 H2 WAT 8979 118.541 105.883 13.959 1.00 0.00 H TER 45597 WAT 8979 ATOM 45597 O WAT 8980 93.091 59.253 95.794 1.00 0.00 O ATOM 45598 H1 WAT 8980 93.589 59.740 96.451 1.00 0.00 H ATOM 45599 H2 WAT 8980 93.060 59.837 95.036 1.00 0.00 H TER 45601 WAT 8980 ATOM 45601 O WAT 8981 93.702 52.665 93.923 1.00 0.00 O ATOM 45602 H1 WAT 8981 92.862 52.865 94.336 1.00 0.00 H ATOM 45603 H2 WAT 8981 94.327 52.647 94.648 1.00 0.00 H TER 45605 WAT 8981 ATOM 45605 O WAT 8982 126.641 11.504 130.073 1.00 0.00 O ATOM 45606 H1 WAT 8982 127.162 10.785 129.715 1.00 0.00 H ATOM 45607 H2 WAT 8982 127.192 11.878 130.761 1.00 0.00 H TER 45609 WAT 8982 ATOM 45609 O WAT 8983 71.175 132.648 7.351 1.00 0.00 O ATOM 45610 H1 WAT 8983 70.278 132.315 7.377 1.00 0.00 H ATOM 45611 H2 WAT 8983 71.370 132.880 8.259 1.00 0.00 H TER 45613 WAT 8983 ATOM 45613 O WAT 8984 8.181 52.254 108.033 1.00 0.00 O ATOM 45614 H1 WAT 8984 7.948 52.809 107.289 1.00 0.00 H ATOM 45615 H2 WAT 8984 8.919 52.703 108.445 1.00 0.00 H TER 45617 WAT 8984 ATOM 45617 O WAT 8985 113.358 130.369 72.746 1.00 0.00 O ATOM 45618 H1 WAT 8985 113.879 129.712 72.285 1.00 0.00 H ATOM 45619 H2 WAT 8985 113.673 131.207 72.407 1.00 0.00 H TER 45621 WAT 8985 ATOM 45621 O WAT 8986 1.171 112.722 126.089 1.00 0.00 O ATOM 45622 H1 WAT 8986 1.529 113.357 125.469 1.00 0.00 H ATOM 45623 H2 WAT 8986 0.788 113.257 126.784 1.00 0.00 H TER 45625 WAT 8986 ATOM 45625 O WAT 8987 113.403 27.792 111.139 1.00 0.00 O ATOM 45626 H1 WAT 8987 113.361 28.743 111.236 1.00 0.00 H ATOM 45627 H2 WAT 8987 112.787 27.596 110.433 1.00 0.00 H TER 45629 WAT 8987 ATOM 45629 O WAT 8988 39.411 72.972 155.167 1.00 0.00 O ATOM 45630 H1 WAT 8988 40.287 73.157 155.506 1.00 0.00 H ATOM 45631 H2 WAT 8988 39.073 73.825 154.896 1.00 0.00 H TER 45633 WAT 8988 ATOM 45633 O WAT 8989 103.594 17.712 127.154 1.00 0.00 O ATOM 45634 H1 WAT 8989 103.178 16.865 127.318 1.00 0.00 H ATOM 45635 H2 WAT 8989 104.464 17.631 127.544 1.00 0.00 H TER 45637 WAT 8989 ATOM 45637 O WAT 8990 60.691 128.647 87.853 1.00 0.00 O ATOM 45638 H1 WAT 8990 60.775 129.356 88.490 1.00 0.00 H ATOM 45639 H2 WAT 8990 59.907 128.868 87.350 1.00 0.00 H TER 45641 WAT 8990 ATOM 45641 O WAT 8991 25.284 1.406 154.672 1.00 0.00 O ATOM 45642 H1 WAT 8991 25.193 2.324 154.417 1.00 0.00 H ATOM 45643 H2 WAT 8991 26.131 1.141 154.313 1.00 0.00 H TER 45645 WAT 8991 ATOM 45645 O WAT 8992 61.921 107.494 79.053 1.00 0.00 O ATOM 45646 H1 WAT 8992 61.606 106.720 79.520 1.00 0.00 H ATOM 45647 H2 WAT 8992 61.138 108.029 78.923 1.00 0.00 H TER 45649 WAT 8992 ATOM 45649 O WAT 8993 45.651 55.488 30.154 1.00 0.00 O ATOM 45650 H1 WAT 8993 45.430 56.077 29.433 1.00 0.00 H ATOM 45651 H2 WAT 8993 45.663 54.617 29.757 1.00 0.00 H TER 45653 WAT 8993 ATOM 45653 O WAT 8994 12.072 131.474 7.797 1.00 0.00 O ATOM 45654 H1 WAT 8994 12.847 131.101 8.218 1.00 0.00 H ATOM 45655 H2 WAT 8994 12.014 132.363 8.148 1.00 0.00 H TER 45657 WAT 8994 ATOM 45657 O WAT 8995 55.469 18.814 118.865 1.00 0.00 O ATOM 45658 H1 WAT 8995 54.618 19.172 118.616 1.00 0.00 H ATOM 45659 H2 WAT 8995 55.514 17.969 118.416 1.00 0.00 H TER 45661 WAT 8995 ATOM 45661 O WAT 8996 50.124 102.111 69.808 1.00 0.00 O ATOM 45662 H1 WAT 8996 49.563 102.265 69.048 1.00 0.00 H ATOM 45663 H2 WAT 8996 49.755 102.666 70.495 1.00 0.00 H TER 45665 WAT 8996 ATOM 45665 O WAT 8997 23.551 109.038 94.161 1.00 0.00 O ATOM 45666 H1 WAT 8997 23.446 109.970 93.974 1.00 0.00 H ATOM 45667 H2 WAT 8997 24.083 108.706 93.438 1.00 0.00 H TER 45669 WAT 8997 ATOM 45669 O WAT 8998 116.293 20.699 132.545 1.00 0.00 O ATOM 45670 H1 WAT 8998 116.365 20.573 131.599 1.00 0.00 H ATOM 45671 H2 WAT 8998 116.608 21.590 132.694 1.00 0.00 H TER 45673 WAT 8998 ATOM 45673 O WAT 8999 19.560 144.886 13.810 1.00 0.00 O ATOM 45674 H1 WAT 8999 19.706 144.021 13.427 1.00 0.00 H ATOM 45675 H2 WAT 8999 19.236 145.418 13.082 1.00 0.00 H TER 45677 WAT 8999 ATOM 45677 O WAT 9000 89.068 124.934 91.645 1.00 0.00 O ATOM 45678 H1 WAT 9000 88.545 125.736 91.659 1.00 0.00 H ATOM 45679 H2 WAT 9000 88.700 124.396 92.346 1.00 0.00 H TER 45681 WAT 9000 ATOM 45681 O WAT 9001 76.065 135.260 84.667 1.00 0.00 O ATOM 45682 H1 WAT 9001 76.575 134.804 85.336 1.00 0.00 H ATOM 45683 H2 WAT 9001 75.153 135.121 84.924 1.00 0.00 H TER 45685 WAT 9001 ATOM 45685 O WAT 9002 130.219 145.388 151.037 1.00 0.00 O ATOM 45686 H1 WAT 9002 130.065 145.406 151.981 1.00 0.00 H ATOM 45687 H2 WAT 9002 130.775 146.149 150.870 1.00 0.00 H TER 45689 WAT 9002 ATOM 45689 O WAT 9003 31.175 87.176 154.066 1.00 0.00 O ATOM 45690 H1 WAT 9003 31.158 87.715 153.275 1.00 0.00 H ATOM 45691 H2 WAT 9003 30.739 86.363 153.811 1.00 0.00 H TER 45693 WAT 9003 ATOM 45693 O WAT 9004 14.124 58.988 6.961 1.00 0.00 O ATOM 45694 H1 WAT 9004 13.923 58.069 6.785 1.00 0.00 H ATOM 45695 H2 WAT 9004 14.532 58.983 7.827 1.00 0.00 H TER 45697 WAT 9004 ATOM 45697 O WAT 9005 68.042 17.397 108.971 1.00 0.00 O ATOM 45698 H1 WAT 9005 68.659 18.111 108.813 1.00 0.00 H ATOM 45699 H2 WAT 9005 68.587 16.610 108.995 1.00 0.00 H TER 45701 WAT 9005 ATOM 45701 O WAT 9006 7.247 144.916 61.787 1.00 0.00 O ATOM 45702 H1 WAT 9006 8.179 144.939 62.004 1.00 0.00 H ATOM 45703 H2 WAT 9006 7.020 143.986 61.806 1.00 0.00 H TER 45705 WAT 9006 ATOM 45705 O WAT 9007 62.471 72.077 16.688 1.00 0.00 O ATOM 45706 H1 WAT 9007 62.018 72.529 17.400 1.00 0.00 H ATOM 45707 H2 WAT 9007 63.093 72.722 16.352 1.00 0.00 H TER 45709 WAT 9007 ATOM 45709 O WAT 9008 62.805 64.222 5.355 1.00 0.00 O ATOM 45710 H1 WAT 9008 63.062 64.701 4.568 1.00 0.00 H ATOM 45711 H2 WAT 9008 61.852 64.304 5.387 1.00 0.00 H TER 45713 WAT 9008 ATOM 45713 O WAT 9009 145.343 137.498 24.488 1.00 0.00 O ATOM 45714 H1 WAT 9009 144.854 138.246 24.146 1.00 0.00 H ATOM 45715 H2 WAT 9009 146.152 137.877 24.833 1.00 0.00 H TER 45717 WAT 9009 ATOM 45717 O WAT 9010 117.170 109.188 111.598 1.00 0.00 O ATOM 45718 H1 WAT 9010 116.456 109.199 110.960 1.00 0.00 H ATOM 45719 H2 WAT 9010 117.070 110.006 112.084 1.00 0.00 H TER 45721 WAT 9010 ATOM 45721 O WAT 9011 121.842 13.268 3.271 1.00 0.00 O ATOM 45722 H1 WAT 9011 121.071 13.189 3.833 1.00 0.00 H ATOM 45723 H2 WAT 9011 122.061 14.199 3.294 1.00 0.00 H TER 45725 WAT 9011 ATOM 45725 O WAT 9012 126.325 30.858 120.681 1.00 0.00 O ATOM 45726 H1 WAT 9012 127.104 31.074 121.193 1.00 0.00 H ATOM 45727 H2 WAT 9012 126.176 31.630 120.134 1.00 0.00 H TER 45729 WAT 9012 ATOM 45729 O WAT 9013 44.107 104.175 4.072 1.00 0.00 O ATOM 45730 H1 WAT 9013 44.062 104.944 3.503 1.00 0.00 H ATOM 45731 H2 WAT 9013 44.491 104.501 4.886 1.00 0.00 H TER 45733 WAT 9013 ATOM 45733 O WAT 9014 11.888 114.444 1.738 1.00 0.00 O ATOM 45734 H1 WAT 9014 11.049 114.894 1.635 1.00 0.00 H ATOM 45735 H2 WAT 9014 11.671 113.638 2.206 1.00 0.00 H TER 45737 WAT 9014 ATOM 45737 O WAT 9015 19.396 114.710 7.652 1.00 0.00 O ATOM 45738 H1 WAT 9015 19.020 113.839 7.519 1.00 0.00 H ATOM 45739 H2 WAT 9015 20.080 114.779 6.986 1.00 0.00 H TER 45741 WAT 9015 ATOM 45741 O WAT 9016 107.513 74.462 71.802 1.00 0.00 O ATOM 45742 H1 WAT 9016 107.732 73.802 71.144 1.00 0.00 H ATOM 45743 H2 WAT 9016 107.836 75.284 71.433 1.00 0.00 H TER 45745 WAT 9016 ATOM 45745 O WAT 9017 127.545 53.747 102.805 1.00 0.00 O ATOM 45746 H1 WAT 9017 127.219 54.394 102.180 1.00 0.00 H ATOM 45747 H2 WAT 9017 127.907 54.267 103.522 1.00 0.00 H TER 45749 WAT 9017 ATOM 45749 O WAT 9018 11.568 130.131 75.719 1.00 0.00 O ATOM 45750 H1 WAT 9018 12.302 130.337 75.140 1.00 0.00 H ATOM 45751 H2 WAT 9018 11.847 130.443 76.580 1.00 0.00 H TER 45753 WAT 9018 ATOM 45753 O WAT 9019 99.791 101.153 139.169 1.00 0.00 O ATOM 45754 H1 WAT 9019 99.436 102.032 139.309 1.00 0.00 H ATOM 45755 H2 WAT 9019 100.695 101.208 139.479 1.00 0.00 H TER 45757 WAT 9019 ATOM 45757 O WAT 9020 61.729 134.774 137.219 1.00 0.00 O ATOM 45758 H1 WAT 9020 61.818 135.550 137.773 1.00 0.00 H ATOM 45759 H2 WAT 9020 61.975 135.076 136.344 1.00 0.00 H TER 45761 WAT 9020 ATOM 45761 O WAT 9021 69.906 48.457 15.481 1.00 0.00 O ATOM 45762 H1 WAT 9021 70.742 48.053 15.715 1.00 0.00 H ATOM 45763 H2 WAT 9021 69.648 48.944 16.264 1.00 0.00 H TER 45765 WAT 9021 ATOM 45765 O WAT 9022 43.253 70.810 86.425 1.00 0.00 O ATOM 45766 H1 WAT 9022 42.540 70.774 87.063 1.00 0.00 H ATOM 45767 H2 WAT 9022 43.937 71.320 86.859 1.00 0.00 H TER 45769 WAT 9022 ATOM 45769 O WAT 9023 84.300 69.496 27.205 1.00 0.00 O ATOM 45770 H1 WAT 9023 84.802 68.698 27.373 1.00 0.00 H ATOM 45771 H2 WAT 9023 83.410 69.282 27.483 1.00 0.00 H TER 45773 WAT 9023 ATOM 45773 O WAT 9024 117.381 87.973 114.479 1.00 0.00 O ATOM 45774 H1 WAT 9024 117.482 88.923 114.420 1.00 0.00 H ATOM 45775 H2 WAT 9024 118.166 87.677 114.940 1.00 0.00 H TER 45777 WAT 9024 ATOM 45777 O WAT 9025 64.241 115.094 96.264 1.00 0.00 O ATOM 45778 H1 WAT 9025 64.554 114.190 96.231 1.00 0.00 H ATOM 45779 H2 WAT 9025 63.617 115.104 96.990 1.00 0.00 H TER 45781 WAT 9025 ATOM 45781 O WAT 9026 137.929 11.601 71.806 1.00 0.00 O ATOM 45782 H1 WAT 9026 137.886 10.787 72.307 1.00 0.00 H ATOM 45783 H2 WAT 9026 137.040 11.953 71.844 1.00 0.00 H TER 45785 WAT 9026 ATOM 45785 O WAT 9027 132.697 89.600 77.743 1.00 0.00 O ATOM 45786 H1 WAT 9027 132.767 88.650 77.835 1.00 0.00 H ATOM 45787 H2 WAT 9027 132.739 89.753 76.799 1.00 0.00 H TER 45789 WAT 9027 ATOM 45789 O WAT 9028 40.670 124.562 157.373 1.00 0.00 O ATOM 45790 H1 WAT 9028 40.519 125.269 156.746 1.00 0.00 H ATOM 45791 H2 WAT 9028 40.067 124.747 158.093 1.00 0.00 H TER 45793 WAT 9028 ATOM 45793 O WAT 9029 95.066 26.413 71.686 1.00 0.00 O ATOM 45794 H1 WAT 9029 95.186 26.719 70.787 1.00 0.00 H ATOM 45795 H2 WAT 9029 94.360 25.769 71.627 1.00 0.00 H TER 45797 WAT 9029 ATOM 45797 O WAT 9030 140.798 74.391 110.844 1.00 0.00 O ATOM 45798 H1 WAT 9030 140.274 74.407 110.043 1.00 0.00 H ATOM 45799 H2 WAT 9030 140.300 74.922 111.466 1.00 0.00 H TER 45801 WAT 9030 ATOM 45801 O WAT 9031 96.578 89.372 63.887 1.00 0.00 O ATOM 45802 H1 WAT 9031 96.791 88.628 64.450 1.00 0.00 H ATOM 45803 H2 WAT 9031 96.718 89.047 62.997 1.00 0.00 H TER 45805 WAT 9031 ATOM 45805 O WAT 9032 42.407 142.718 67.838 1.00 0.00 O ATOM 45806 H1 WAT 9032 41.729 142.051 67.942 1.00 0.00 H ATOM 45807 H2 WAT 9032 41.966 143.542 68.046 1.00 0.00 H TER 45809 WAT 9032 ATOM 45809 O WAT 9033 133.991 61.857 108.985 1.00 0.00 O ATOM 45810 H1 WAT 9033 133.106 62.020 109.309 1.00 0.00 H ATOM 45811 H2 WAT 9033 134.531 62.519 109.418 1.00 0.00 H TER 45813 WAT 9033 ATOM 45813 O WAT 9034 74.342 18.096 15.142 1.00 0.00 O ATOM 45814 H1 WAT 9034 74.691 18.377 15.988 1.00 0.00 H ATOM 45815 H2 WAT 9034 74.954 18.453 14.499 1.00 0.00 H TER 45817 WAT 9034 ATOM 45817 O WAT 9035 98.765 12.740 135.868 1.00 0.00 O ATOM 45818 H1 WAT 9035 99.314 12.756 135.084 1.00 0.00 H ATOM 45819 H2 WAT 9035 98.985 13.549 136.331 1.00 0.00 H TER 45821 WAT 9035 ATOM 45821 O WAT 9036 9.577 91.150 13.442 1.00 0.00 O ATOM 45822 H1 WAT 9036 8.887 90.757 13.977 1.00 0.00 H ATOM 45823 H2 WAT 9036 10.391 90.898 13.879 1.00 0.00 H TER 45825 WAT 9036 ATOM 45825 O WAT 9037 52.877 0.925 121.103 1.00 0.00 O ATOM 45826 H1 WAT 9037 53.775 1.255 121.088 1.00 0.00 H ATOM 45827 H2 WAT 9037 52.732 0.667 122.014 1.00 0.00 H TER 45829 WAT 9037 ATOM 45829 O WAT 9038 13.245 115.663 98.426 1.00 0.00 O ATOM 45830 H1 WAT 9038 12.920 115.083 97.737 1.00 0.00 H ATOM 45831 H2 WAT 9038 12.562 116.327 98.522 1.00 0.00 H TER 45833 WAT 9038 ATOM 45833 O WAT 9039 131.912 50.242 90.593 1.00 0.00 O ATOM 45834 H1 WAT 9039 131.792 49.522 89.974 1.00 0.00 H ATOM 45835 H2 WAT 9039 131.566 51.010 90.138 1.00 0.00 H TER 45837 WAT 9039 ATOM 45837 O WAT 9040 143.924 108.634 66.145 1.00 0.00 O ATOM 45838 H1 WAT 9040 144.603 107.975 66.290 1.00 0.00 H ATOM 45839 H2 WAT 9040 144.407 109.439 65.959 1.00 0.00 H TER 45841 WAT 9040 ATOM 45841 O WAT 9041 3.011 122.761 152.429 1.00 0.00 O ATOM 45842 H1 WAT 9041 3.442 123.482 152.889 1.00 0.00 H ATOM 45843 H2 WAT 9041 3.629 122.511 151.743 1.00 0.00 H TER 45845 WAT 9041 ATOM 45845 O WAT 9042 86.671 116.712 89.137 1.00 0.00 O ATOM 45846 H1 WAT 9042 87.366 117.097 89.672 1.00 0.00 H ATOM 45847 H2 WAT 9042 85.932 116.617 89.738 1.00 0.00 H TER 45849 WAT 9042 ATOM 45849 O WAT 9043 47.451 104.453 129.641 1.00 0.00 O ATOM 45850 H1 WAT 9043 48.264 104.016 129.894 1.00 0.00 H ATOM 45851 H2 WAT 9043 47.365 105.178 130.261 1.00 0.00 H TER 45853 WAT 9043 ATOM 45853 O WAT 9044 8.759 24.799 13.530 1.00 0.00 O ATOM 45854 H1 WAT 9044 9.327 25.351 14.067 1.00 0.00 H ATOM 45855 H2 WAT 9044 9.352 24.163 13.130 1.00 0.00 H TER 45857 WAT 9044 ATOM 45857 O WAT 9045 32.119 24.924 92.960 1.00 0.00 O ATOM 45858 H1 WAT 9045 31.625 24.610 93.718 1.00 0.00 H ATOM 45859 H2 WAT 9045 31.729 24.468 92.214 1.00 0.00 H TER 45861 WAT 9045 ATOM 45861 O WAT 9046 16.253 38.794 111.160 1.00 0.00 O ATOM 45862 H1 WAT 9046 17.205 38.709 111.219 1.00 0.00 H ATOM 45863 H2 WAT 9046 16.028 38.384 110.324 1.00 0.00 H TER 45865 WAT 9046 ATOM 45865 O WAT 9047 72.462 122.049 11.639 1.00 0.00 O ATOM 45866 H1 WAT 9047 71.822 121.468 11.229 1.00 0.00 H ATOM 45867 H2 WAT 9047 72.936 121.489 12.253 1.00 0.00 H TER 45869 WAT 9047 ATOM 45869 O WAT 9048 132.296 21.778 80.050 1.00 0.00 O ATOM 45870 H1 WAT 9048 132.720 22.623 79.902 1.00 0.00 H ATOM 45871 H2 WAT 9048 133.019 21.173 80.216 1.00 0.00 H TER 45873 WAT 9048 ATOM 45873 O WAT 9049 108.671 28.050 141.761 1.00 0.00 O ATOM 45874 H1 WAT 9049 107.873 27.581 142.004 1.00 0.00 H ATOM 45875 H2 WAT 9049 109.287 27.858 142.467 1.00 0.00 H TER 45877 WAT 9049 ATOM 45877 O WAT 9050 108.845 136.111 99.373 1.00 0.00 O ATOM 45878 H1 WAT 9050 108.360 136.864 99.036 1.00 0.00 H ATOM 45879 H2 WAT 9050 108.231 135.379 99.302 1.00 0.00 H TER 45881 WAT 9050 ATOM 45881 O WAT 9051 139.626 120.150 64.391 1.00 0.00 O ATOM 45882 H1 WAT 9051 139.512 121.030 64.032 1.00 0.00 H ATOM 45883 H2 WAT 9051 140.290 119.748 63.831 1.00 0.00 H TER 45885 WAT 9051 ATOM 45885 O WAT 9052 73.017 86.928 82.779 1.00 0.00 O ATOM 45886 H1 WAT 9052 72.857 87.484 83.542 1.00 0.00 H ATOM 45887 H2 WAT 9052 73.032 86.038 83.130 1.00 0.00 H TER 45889 WAT 9052 ATOM 45889 O WAT 9053 106.470 117.587 99.737 1.00 0.00 O ATOM 45890 H1 WAT 9053 105.701 117.623 99.167 1.00 0.00 H ATOM 45891 H2 WAT 9053 107.165 117.238 99.179 1.00 0.00 H TER 45893 WAT 9053 ATOM 45893 O WAT 9054 97.019 5.209 14.644 1.00 0.00 O ATOM 45894 H1 WAT 9054 97.056 4.287 14.899 1.00 0.00 H ATOM 45895 H2 WAT 9054 97.097 5.198 13.690 1.00 0.00 H TER 45897 WAT 9054 ATOM 45897 O WAT 9055 76.722 19.451 113.374 1.00 0.00 O ATOM 45898 H1 WAT 9055 77.337 20.157 113.572 1.00 0.00 H ATOM 45899 H2 WAT 9055 75.880 19.768 113.701 1.00 0.00 H TER 45901 WAT 9055 ATOM 45901 O WAT 9056 113.348 26.546 119.944 1.00 0.00 O ATOM 45902 H1 WAT 9056 113.432 25.602 119.807 1.00 0.00 H ATOM 45903 H2 WAT 9056 112.404 26.700 119.971 1.00 0.00 H TER 45905 WAT 9056 ATOM 45905 O WAT 9057 18.008 71.653 24.723 1.00 0.00 O ATOM 45906 H1 WAT 9057 17.235 72.063 24.336 1.00 0.00 H ATOM 45907 H2 WAT 9057 17.924 70.725 24.500 1.00 0.00 H TER 45909 WAT 9057 ATOM 45909 O WAT 9058 143.478 89.159 90.499 1.00 0.00 O ATOM 45910 H1 WAT 9058 142.599 89.084 90.872 1.00 0.00 H ATOM 45911 H2 WAT 9058 143.474 90.001 90.044 1.00 0.00 H TER 45913 WAT 9058 ATOM 45913 O WAT 9059 89.207 103.095 62.543 1.00 0.00 O ATOM 45914 H1 WAT 9059 89.528 102.998 61.646 1.00 0.00 H ATOM 45915 H2 WAT 9059 89.627 103.893 62.863 1.00 0.00 H TER 45917 WAT 9059 ATOM 45917 O WAT 9060 9.952 138.572 55.378 1.00 0.00 O ATOM 45918 H1 WAT 9060 9.537 138.381 56.219 1.00 0.00 H ATOM 45919 H2 WAT 9060 9.605 137.908 54.783 1.00 0.00 H TER 45921 WAT 9060 ATOM 45921 O WAT 9061 92.670 31.540 131.013 1.00 0.00 O ATOM 45922 H1 WAT 9061 91.887 32.083 130.922 1.00 0.00 H ATOM 45923 H2 WAT 9061 92.747 31.387 131.955 1.00 0.00 H TER 45925 WAT 9061 ATOM 45925 O WAT 9062 63.984 41.209 102.964 1.00 0.00 O ATOM 45926 H1 WAT 9062 64.097 40.937 102.053 1.00 0.00 H ATOM 45927 H2 WAT 9062 63.130 41.642 102.980 1.00 0.00 H TER 45929 WAT 9062 ATOM 45929 O WAT 9063 66.483 98.740 91.727 1.00 0.00 O ATOM 45930 H1 WAT 9063 66.493 98.842 92.679 1.00 0.00 H ATOM 45931 H2 WAT 9063 65.592 98.454 91.526 1.00 0.00 H TER 45933 WAT 9063 ATOM 45933 O WAT 9064 -0.020 16.721 99.591 1.00 0.00 O ATOM 45934 H1 WAT 9064 -0.233 15.930 99.096 1.00 0.00 H ATOM 45935 H2 WAT 9064 0.920 16.653 99.758 1.00 0.00 H TER 45937 WAT 9064 ATOM 45937 O WAT 9065 47.084 140.223 130.413 1.00 0.00 O ATOM 45938 H1 WAT 9065 47.376 140.395 131.309 1.00 0.00 H ATOM 45939 H2 WAT 9065 47.893 140.075 129.923 1.00 0.00 H TER 45941 WAT 9065 ATOM 45941 O WAT 9066 99.565 61.226 148.574 1.00 0.00 O ATOM 45942 H1 WAT 9066 99.353 61.846 149.272 1.00 0.00 H ATOM 45943 H2 WAT 9066 99.926 60.466 149.030 1.00 0.00 H TER 45945 WAT 9066 ATOM 45945 O WAT 9067 83.141 76.135 58.955 1.00 0.00 O ATOM 45946 H1 WAT 9067 82.264 76.216 58.580 1.00 0.00 H ATOM 45947 H2 WAT 9067 83.562 75.451 58.435 1.00 0.00 H TER 45949 WAT 9067 ATOM 45949 O WAT 9068 26.698 69.076 107.296 1.00 0.00 O ATOM 45950 H1 WAT 9068 27.530 68.635 107.468 1.00 0.00 H ATOM 45951 H2 WAT 9068 26.444 68.776 106.423 1.00 0.00 H TER 45953 WAT 9068 ATOM 45953 O WAT 9069 12.710 80.395 11.241 1.00 0.00 O ATOM 45954 H1 WAT 9069 13.551 80.784 11.483 1.00 0.00 H ATOM 45955 H2 WAT 9069 12.062 80.901 11.731 1.00 0.00 H TER 45957 WAT 9069 ATOM 45957 O WAT 9070 41.746 80.113 23.109 1.00 0.00 O ATOM 45958 H1 WAT 9070 41.058 80.608 23.554 1.00 0.00 H ATOM 45959 H2 WAT 9070 41.443 79.205 23.136 1.00 0.00 H TER 45961 WAT 9070 ATOM 45961 O WAT 9071 116.859 37.970 107.099 1.00 0.00 O ATOM 45962 H1 WAT 9071 117.288 37.937 106.244 1.00 0.00 H ATOM 45963 H2 WAT 9071 116.351 38.782 107.080 1.00 0.00 H TER 45965 WAT 9071 ATOM 45965 O WAT 9072 44.148 26.017 150.526 1.00 0.00 O ATOM 45966 H1 WAT 9072 44.352 26.213 151.441 1.00 0.00 H ATOM 45967 H2 WAT 9072 44.136 26.872 150.095 1.00 0.00 H TER 45969 WAT 9072 ATOM 45969 O WAT 9073 36.908 101.245 88.741 1.00 0.00 O ATOM 45970 H1 WAT 9073 36.360 101.415 89.507 1.00 0.00 H ATOM 45971 H2 WAT 9073 37.674 101.806 88.865 1.00 0.00 H TER 45973 WAT 9073 ATOM 45973 O WAT 9074 99.822 58.804 91.523 1.00 0.00 O ATOM 45974 H1 WAT 9074 100.445 58.809 90.796 1.00 0.00 H ATOM 45975 H2 WAT 9074 99.477 57.911 91.537 1.00 0.00 H TER 45977 WAT 9074 ATOM 45977 O WAT 9075 67.981 48.365 100.712 1.00 0.00 O ATOM 45978 H1 WAT 9075 68.216 48.285 99.788 1.00 0.00 H ATOM 45979 H2 WAT 9075 67.025 48.413 100.712 1.00 0.00 H TER 45981 WAT 9075 ATOM 45981 O WAT 9076 7.178 121.947 68.002 1.00 0.00 O ATOM 45982 H1 WAT 9076 7.846 122.577 67.733 1.00 0.00 H ATOM 45983 H2 WAT 9076 7.592 121.442 68.702 1.00 0.00 H TER 45985 WAT 9076 ATOM 45985 O WAT 9077 37.615 122.434 63.749 1.00 0.00 O ATOM 45986 H1 WAT 9077 37.215 123.279 63.543 1.00 0.00 H ATOM 45987 H2 WAT 9077 38.464 122.657 64.132 1.00 0.00 H TER 45989 WAT 9077 ATOM 45989 O WAT 9078 138.976 75.374 95.000 1.00 0.00 O ATOM 45990 H1 WAT 9078 138.991 74.544 94.524 1.00 0.00 H ATOM 45991 H2 WAT 9078 138.992 75.120 95.923 1.00 0.00 H TER 45993 WAT 9078 ATOM 45993 O WAT 9079 143.917 57.446 66.792 1.00 0.00 O ATOM 45994 H1 WAT 9079 143.570 57.179 65.941 1.00 0.00 H ATOM 45995 H2 WAT 9079 143.354 58.171 67.064 1.00 0.00 H TER 45997 WAT 9079 ATOM 45997 O WAT 9080 92.854 34.607 117.628 1.00 0.00 O ATOM 45998 H1 WAT 9080 93.725 34.214 117.669 1.00 0.00 H ATOM 45999 H2 WAT 9080 92.268 33.928 117.963 1.00 0.00 H TER 46001 WAT 9080 ATOM 46001 O WAT 9081 21.740 81.227 144.645 1.00 0.00 O ATOM 46002 H1 WAT 9081 21.221 81.134 145.444 1.00 0.00 H ATOM 46003 H2 WAT 9081 22.603 80.887 144.880 1.00 0.00 H TER 46005 WAT 9081 ATOM 46005 O WAT 9082 53.647 143.537 99.636 1.00 0.00 O ATOM 46006 H1 WAT 9082 53.443 144.437 99.891 1.00 0.00 H ATOM 46007 H2 WAT 9082 54.465 143.338 100.090 1.00 0.00 H TER 46009 WAT 9082 ATOM 46009 O WAT 9083 119.783 81.117 18.479 1.00 0.00 O ATOM 46010 H1 WAT 9083 119.277 80.305 18.479 1.00 0.00 H ATOM 46011 H2 WAT 9083 119.547 81.546 19.302 1.00 0.00 H TER 46013 WAT 9083 ATOM 46013 O WAT 9084 41.281 76.095 136.818 1.00 0.00 O ATOM 46014 H1 WAT 9084 41.694 76.706 137.428 1.00 0.00 H ATOM 46015 H2 WAT 9084 40.857 75.446 137.381 1.00 0.00 H TER 46017 WAT 9084 ATOM 46017 O WAT 9085 28.523 116.712 87.729 1.00 0.00 O ATOM 46018 H1 WAT 9085 29.262 116.285 87.296 1.00 0.00 H ATOM 46019 H2 WAT 9085 28.177 117.317 87.072 1.00 0.00 H TER 46021 WAT 9085 ATOM 46021 O WAT 9086 74.991 112.067 149.355 1.00 0.00 O ATOM 46022 H1 WAT 9086 75.888 112.152 149.030 1.00 0.00 H ATOM 46023 H2 WAT 9086 74.483 112.672 148.815 1.00 0.00 H TER 46025 WAT 9086 ATOM 46025 O WAT 9087 95.338 43.332 13.746 1.00 0.00 O ATOM 46026 H1 WAT 9087 95.565 44.204 13.420 1.00 0.00 H ATOM 46027 H2 WAT 9087 95.121 42.832 12.959 1.00 0.00 H TER 46029 WAT 9087 ATOM 46029 O WAT 9088 60.463 67.780 140.707 1.00 0.00 O ATOM 46030 H1 WAT 9088 59.677 68.076 140.248 1.00 0.00 H ATOM 46031 H2 WAT 9088 60.702 68.515 141.272 1.00 0.00 H TER 46033 WAT 9088 ATOM 46033 O WAT 9089 95.161 135.924 122.021 1.00 0.00 O ATOM 46034 H1 WAT 9089 94.220 135.752 122.009 1.00 0.00 H ATOM 46035 H2 WAT 9089 95.277 136.573 122.714 1.00 0.00 H TER 46037 WAT 9089 ATOM 46037 O WAT 9090 70.507 83.402 140.364 1.00 0.00 O ATOM 46038 H1 WAT 9090 69.978 84.185 140.210 1.00 0.00 H ATOM 46039 H2 WAT 9090 71.012 83.605 141.151 1.00 0.00 H TER 46041 WAT 9090 ATOM 46041 O WAT 9091 107.140 134.064 137.804 1.00 0.00 O ATOM 46042 H1 WAT 9091 106.459 133.408 137.656 1.00 0.00 H ATOM 46043 H2 WAT 9091 107.958 133.612 137.598 1.00 0.00 H TER 46045 WAT 9091 ATOM 46045 O WAT 9092 136.398 125.030 61.468 1.00 0.00 O ATOM 46046 H1 WAT 9092 136.736 124.237 61.053 1.00 0.00 H ATOM 46047 H2 WAT 9092 136.320 124.802 62.394 1.00 0.00 H TER 46049 WAT 9092 ATOM 46049 O WAT 9093 31.475 39.372 8.384 1.00 0.00 O ATOM 46050 H1 WAT 9093 30.892 39.522 9.127 1.00 0.00 H ATOM 46051 H2 WAT 9093 31.389 38.437 8.197 1.00 0.00 H TER 46053 WAT 9093 ATOM 46053 O WAT 9094 50.413 75.542 107.569 1.00 0.00 O ATOM 46054 H1 WAT 9094 51.209 75.327 108.055 1.00 0.00 H ATOM 46055 H2 WAT 9094 50.723 76.035 106.809 1.00 0.00 H TER 46057 WAT 9094 ATOM 46057 O WAT 9095 10.507 101.694 4.594 1.00 0.00 O ATOM 46058 H1 WAT 9095 11.423 101.879 4.800 1.00 0.00 H ATOM 46059 H2 WAT 9095 10.530 101.329 3.709 1.00 0.00 H TER 46061 WAT 9095 ATOM 46061 O WAT 9096 142.027 87.489 111.472 1.00 0.00 O ATOM 46062 H1 WAT 9096 142.391 86.605 111.521 1.00 0.00 H ATOM 46063 H2 WAT 9096 142.257 87.794 110.594 1.00 0.00 H TER 46065 WAT 9096 ATOM 46065 O WAT 9097 80.665 69.365 99.288 1.00 0.00 O ATOM 46066 H1 WAT 9097 79.863 69.222 98.786 1.00 0.00 H ATOM 46067 H2 WAT 9097 80.391 69.908 100.027 1.00 0.00 H TER 46069 WAT 9097 ATOM 46069 O WAT 9098 117.516 52.225 79.738 1.00 0.00 O ATOM 46070 H1 WAT 9098 118.431 52.040 79.528 1.00 0.00 H ATOM 46071 H2 WAT 9098 117.017 51.781 79.052 1.00 0.00 H TER 46073 WAT 9098 ATOM 46073 O WAT 9099 78.598 139.212 105.043 1.00 0.00 O ATOM 46074 H1 WAT 9099 78.025 139.812 105.519 1.00 0.00 H ATOM 46075 H2 WAT 9099 78.142 138.371 105.072 1.00 0.00 H TER 46077 WAT 9099 ATOM 46077 O WAT 9100 47.853 104.095 116.447 1.00 0.00 O ATOM 46078 H1 WAT 9100 47.158 103.791 115.863 1.00 0.00 H ATOM 46079 H2 WAT 9100 47.466 104.058 117.321 1.00 0.00 H TER 46081 WAT 9100 ATOM 46081 O WAT 9101 76.056 97.441 107.364 1.00 0.00 O ATOM 46082 H1 WAT 9101 76.669 96.799 107.724 1.00 0.00 H ATOM 46083 H2 WAT 9101 76.485 97.762 106.570 1.00 0.00 H TER 46085 WAT 9101 ATOM 46085 O WAT 9102 123.751 36.633 88.147 1.00 0.00 O ATOM 46086 H1 WAT 9102 123.575 37.239 88.866 1.00 0.00 H ATOM 46087 H2 WAT 9102 122.909 36.538 87.702 1.00 0.00 H TER 46089 WAT 9102 ATOM 46089 O WAT 9103 1.009 119.838 0.432 1.00 0.00 O ATOM 46090 H1 WAT 9103 1.174 119.201 1.126 1.00 0.00 H ATOM 46091 H2 WAT 9103 1.114 119.342 -0.379 1.00 0.00 H TER 46093 WAT 9103 ATOM 46093 O WAT 9104 63.869 122.600 75.532 1.00 0.00 O ATOM 46094 H1 WAT 9104 63.058 122.857 75.969 1.00 0.00 H ATOM 46095 H2 WAT 9104 63.990 121.681 75.771 1.00 0.00 H TER 46097 WAT 9104 ATOM 46097 O WAT 9105 138.120 93.553 134.793 1.00 0.00 O ATOM 46098 H1 WAT 9105 137.475 93.449 134.094 1.00 0.00 H ATOM 46099 H2 WAT 9105 138.007 92.776 135.341 1.00 0.00 H TER 46101 WAT 9105 ATOM 46101 O WAT 9106 44.242 103.942 126.367 1.00 0.00 O ATOM 46102 H1 WAT 9106 44.447 104.626 125.729 1.00 0.00 H ATOM 46103 H2 WAT 9106 45.081 103.512 126.534 1.00 0.00 H TER 46105 WAT 9106 ATOM 46105 O WAT 9107 67.702 122.238 92.256 1.00 0.00 O ATOM 46106 H1 WAT 9107 67.193 123.018 92.481 1.00 0.00 H ATOM 46107 H2 WAT 9107 68.507 122.581 91.869 1.00 0.00 H TER 46109 WAT 9107 ATOM 46109 O WAT 9108 42.257 110.586 75.088 1.00 0.00 O ATOM 46110 H1 WAT 9108 42.155 109.641 75.199 1.00 0.00 H ATOM 46111 H2 WAT 9108 42.896 110.677 74.382 1.00 0.00 H TER 46113 WAT 9108 ATOM 46113 O WAT 9109 135.337 100.719 13.931 1.00 0.00 O ATOM 46114 H1 WAT 9109 134.416 100.533 13.746 1.00 0.00 H ATOM 46115 H2 WAT 9109 135.819 100.080 13.406 1.00 0.00 H TER 46117 WAT 9109 ATOM 46117 O WAT 9110 134.457 63.921 136.659 1.00 0.00 O ATOM 46118 H1 WAT 9110 134.956 64.689 136.938 1.00 0.00 H ATOM 46119 H2 WAT 9110 134.906 63.182 137.068 1.00 0.00 H TER 46121 WAT 9110 ATOM 46121 O WAT 9111 130.443 140.762 23.221 1.00 0.00 O ATOM 46122 H1 WAT 9111 130.605 141.503 22.638 1.00 0.00 H ATOM 46123 H2 WAT 9111 131.310 140.518 23.545 1.00 0.00 H TER 46125 WAT 9111 ATOM 46125 O WAT 9112 62.695 27.122 96.996 1.00 0.00 O ATOM 46126 H1 WAT 9112 62.855 27.504 97.859 1.00 0.00 H ATOM 46127 H2 WAT 9112 63.534 26.737 96.744 1.00 0.00 H TER 46129 WAT 9112 ATOM 46129 O WAT 9113 1.691 109.524 145.913 1.00 0.00 O ATOM 46130 H1 WAT 9113 1.098 110.142 145.486 1.00 0.00 H ATOM 46131 H2 WAT 9113 1.207 109.220 146.681 1.00 0.00 H TER 46133 WAT 9113 ATOM 46133 O WAT 9114 35.747 47.548 149.757 1.00 0.00 O ATOM 46134 H1 WAT 9114 36.224 48.238 149.296 1.00 0.00 H ATOM 46135 H2 WAT 9114 35.116 48.017 150.303 1.00 0.00 H TER 46137 WAT 9114 ATOM 46137 O WAT 9115 72.716 23.074 55.054 1.00 0.00 O ATOM 46138 H1 WAT 9115 73.489 22.722 54.614 1.00 0.00 H ATOM 46139 H2 WAT 9115 72.000 22.925 54.437 1.00 0.00 H TER 46141 WAT 9115 ATOM 46141 O WAT 9116 106.441 93.169 145.664 1.00 0.00 O ATOM 46142 H1 WAT 9116 106.432 94.004 145.195 1.00 0.00 H ATOM 46143 H2 WAT 9116 106.471 93.414 146.589 1.00 0.00 H TER 46145 WAT 9116 ATOM 46145 O WAT 9117 84.115 100.952 7.900 1.00 0.00 O ATOM 46146 H1 WAT 9117 83.822 101.827 7.648 1.00 0.00 H ATOM 46147 H2 WAT 9117 83.317 100.424 7.904 1.00 0.00 H TER 46149 WAT 9117 ATOM 46149 O WAT 9118 42.638 24.326 74.558 1.00 0.00 O ATOM 46150 H1 WAT 9118 43.178 24.086 75.311 1.00 0.00 H ATOM 46151 H2 WAT 9118 41.839 23.809 74.661 1.00 0.00 H TER 46153 WAT 9118 ATOM 46153 O WAT 9119 52.152 14.724 11.566 1.00 0.00 O ATOM 46154 H1 WAT 9119 52.848 14.081 11.707 1.00 0.00 H ATOM 46155 H2 WAT 9119 52.230 15.327 12.305 1.00 0.00 H TER 46157 WAT 9119 ATOM 46157 O WAT 9120 45.961 32.944 23.839 1.00 0.00 O ATOM 46158 H1 WAT 9120 46.410 33.275 23.061 1.00 0.00 H ATOM 46159 H2 WAT 9120 46.197 33.561 24.532 1.00 0.00 H TER 46161 WAT 9120 ATOM 46161 O WAT 9121 93.816 111.196 131.646 1.00 0.00 O ATOM 46162 H1 WAT 9121 93.610 112.031 132.067 1.00 0.00 H ATOM 46163 H2 WAT 9121 94.633 110.915 132.060 1.00 0.00 H TER 46165 WAT 9121 ATOM 46165 O WAT 9122 100.751 24.985 2.928 1.00 0.00 O ATOM 46166 H1 WAT 9122 100.475 25.897 2.841 1.00 0.00 H ATOM 46167 H2 WAT 9122 100.150 24.497 2.366 1.00 0.00 H TER 46169 WAT 9122 ATOM 46169 O WAT 9123 34.336 3.905 57.714 1.00 0.00 O ATOM 46170 H1 WAT 9123 34.160 4.717 57.238 1.00 0.00 H ATOM 46171 H2 WAT 9123 33.780 3.253 57.288 1.00 0.00 H TER 46173 WAT 9123 ATOM 46173 O WAT 9124 113.588 109.961 73.707 1.00 0.00 O ATOM 46174 H1 WAT 9124 114.293 109.314 73.718 1.00 0.00 H ATOM 46175 H2 WAT 9124 114.016 110.787 73.935 1.00 0.00 H TER 46177 WAT 9124 ATOM 46177 O WAT 9125 46.901 43.336 7.620 1.00 0.00 O ATOM 46178 H1 WAT 9125 46.212 43.803 8.092 1.00 0.00 H ATOM 46179 H2 WAT 9125 47.417 42.913 8.305 1.00 0.00 H TER 46181 WAT 9125 ATOM 46181 O WAT 9126 83.072 72.299 156.044 1.00 0.00 O ATOM 46182 H1 WAT 9126 82.509 73.071 156.098 1.00 0.00 H ATOM 46183 H2 WAT 9126 83.569 72.307 156.862 1.00 0.00 H TER 46185 WAT 9126 ATOM 46185 O WAT 9127 7.920 138.708 14.511 1.00 0.00 O ATOM 46186 H1 WAT 9127 7.060 139.074 14.718 1.00 0.00 H ATOM 46187 H2 WAT 9127 8.480 138.990 15.234 1.00 0.00 H TER 46189 WAT 9127 ATOM 46189 O WAT 9128 91.352 129.856 155.611 1.00 0.00 O ATOM 46190 H1 WAT 9128 91.390 129.010 156.057 1.00 0.00 H ATOM 46191 H2 WAT 9128 91.937 129.757 154.860 1.00 0.00 H TER 46193 WAT 9128 ATOM 46193 O WAT 9129 49.064 14.948 146.732 1.00 0.00 O ATOM 46194 H1 WAT 9129 48.638 15.688 147.164 1.00 0.00 H ATOM 46195 H2 WAT 9129 48.403 14.255 146.736 1.00 0.00 H TER 46197 WAT 9129 ATOM 46197 O WAT 9130 37.395 15.415 154.620 1.00 0.00 O ATOM 46198 H1 WAT 9130 38.284 15.149 154.856 1.00 0.00 H ATOM 46199 H2 WAT 9130 37.216 14.954 153.800 1.00 0.00 H TER 46201 WAT 9130 ATOM 46201 O WAT 9131 27.821 78.639 83.656 1.00 0.00 O ATOM 46202 H1 WAT 9131 27.906 79.580 83.503 1.00 0.00 H ATOM 46203 H2 WAT 9131 26.989 78.546 84.119 1.00 0.00 H TER 46205 WAT 9131 ATOM 46205 O WAT 9132 107.221 0.859 85.149 1.00 0.00 O ATOM 46206 H1 WAT 9132 107.132 0.230 85.866 1.00 0.00 H ATOM 46207 H2 WAT 9132 106.922 1.689 85.520 1.00 0.00 H TER 46209 WAT 9132 ATOM 46209 O WAT 9133 35.297 44.787 142.256 1.00 0.00 O ATOM 46210 H1 WAT 9133 35.812 44.501 141.502 1.00 0.00 H ATOM 46211 H2 WAT 9133 35.940 45.160 142.858 1.00 0.00 H TER 46213 WAT 9133 ATOM 46213 O WAT 9134 130.207 39.609 128.201 1.00 0.00 O ATOM 46214 H1 WAT 9134 131.064 39.824 127.834 1.00 0.00 H ATOM 46215 H2 WAT 9134 129.582 39.908 127.541 1.00 0.00 H TER 46217 WAT 9134 ATOM 46217 O WAT 9135 64.859 70.873 106.388 1.00 0.00 O ATOM 46218 H1 WAT 9135 64.099 71.098 106.925 1.00 0.00 H ATOM 46219 H2 WAT 9135 65.423 70.367 106.972 1.00 0.00 H TER 46221 WAT 9135 ATOM 46221 O WAT 9136 104.950 61.000 78.450 1.00 0.00 O ATOM 46222 H1 WAT 9136 104.290 60.308 78.467 1.00 0.00 H ATOM 46223 H2 WAT 9136 104.699 61.588 79.162 1.00 0.00 H TER 46225 WAT 9136 ATOM 46225 O WAT 9137 48.243 70.354 10.455 1.00 0.00 O ATOM 46226 H1 WAT 9137 47.428 70.067 10.866 1.00 0.00 H ATOM 46227 H2 WAT 9137 48.106 71.283 10.273 1.00 0.00 H TER 46229 WAT 9137 ATOM 46229 O WAT 9138 43.888 111.137 100.400 1.00 0.00 O ATOM 46230 H1 WAT 9138 43.689 111.553 101.239 1.00 0.00 H ATOM 46231 H2 WAT 9138 43.736 110.205 100.552 1.00 0.00 H TER 46233 WAT 9138 ATOM 46233 O WAT 9139 135.856 21.622 132.802 1.00 0.00 O ATOM 46234 H1 WAT 9139 136.798 21.455 132.781 1.00 0.00 H ATOM 46235 H2 WAT 9139 135.458 20.769 132.629 1.00 0.00 H TER 46237 WAT 9139 ATOM 46237 O WAT 9140 95.343 66.388 131.536 1.00 0.00 O ATOM 46238 H1 WAT 9140 94.693 66.346 132.236 1.00 0.00 H ATOM 46239 H2 WAT 9140 95.524 65.473 131.321 1.00 0.00 H TER 46241 WAT 9140 ATOM 46241 O WAT 9141 106.102 124.851 140.191 1.00 0.00 O ATOM 46242 H1 WAT 9141 106.911 124.948 139.689 1.00 0.00 H ATOM 46243 H2 WAT 9141 106.366 124.377 140.980 1.00 0.00 H TER 46245 WAT 9141 ATOM 46245 O WAT 9142 141.779 145.279 136.737 1.00 0.00 O ATOM 46246 H1 WAT 9142 142.615 145.506 136.330 1.00 0.00 H ATOM 46247 H2 WAT 9142 141.182 145.147 136.000 1.00 0.00 H TER 46249 WAT 9142 ATOM 46249 O WAT 9143 35.907 52.151 81.554 1.00 0.00 O ATOM 46250 H1 WAT 9143 35.981 51.248 81.863 1.00 0.00 H ATOM 46251 H2 WAT 9143 36.435 52.175 80.756 1.00 0.00 H TER 46253 WAT 9143 ATOM 46253 O WAT 9144 10.667 7.143 60.336 1.00 0.00 O ATOM 46254 H1 WAT 9144 10.960 6.662 61.110 1.00 0.00 H ATOM 46255 H2 WAT 9144 11.285 7.870 60.257 1.00 0.00 H TER 46257 WAT 9144 ATOM 46257 O WAT 9145 35.100 51.671 107.275 1.00 0.00 O ATOM 46258 H1 WAT 9145 34.963 51.711 108.222 1.00 0.00 H ATOM 46259 H2 WAT 9145 35.225 50.740 107.090 1.00 0.00 H TER 46261 WAT 9145 ATOM 46261 O WAT 9146 6.728 44.964 115.756 1.00 0.00 O ATOM 46262 H1 WAT 9146 6.416 44.668 116.611 1.00 0.00 H ATOM 46263 H2 WAT 9146 6.565 44.223 115.172 1.00 0.00 H TER 46265 WAT 9146 ATOM 46265 O WAT 9147 24.649 5.528 143.833 1.00 0.00 O ATOM 46266 H1 WAT 9147 24.356 6.410 143.605 1.00 0.00 H ATOM 46267 H2 WAT 9147 24.122 4.950 143.281 1.00 0.00 H TER 46269 WAT 9147 ATOM 46269 O WAT 9148 28.948 7.044 0.263 1.00 0.00 O ATOM 46270 H1 WAT 9148 29.405 7.769 -0.165 1.00 0.00 H ATOM 46271 H2 WAT 9148 28.445 7.459 0.963 1.00 0.00 H TER 46273 WAT 9148 ATOM 46273 O WAT 9149 38.639 107.938 149.008 1.00 0.00 O ATOM 46274 H1 WAT 9149 37.896 107.568 149.485 1.00 0.00 H ATOM 46275 H2 WAT 9149 38.331 108.796 148.715 1.00 0.00 H TER 46277 WAT 9149 ATOM 46277 O WAT 9150 56.823 95.857 107.803 1.00 0.00 O ATOM 46278 H1 WAT 9150 56.586 96.448 108.518 1.00 0.00 H ATOM 46279 H2 WAT 9150 57.595 96.260 107.406 1.00 0.00 H TER 46281 WAT 9150 ATOM 46281 O WAT 9151 140.582 130.565 93.489 1.00 0.00 O ATOM 46282 H1 WAT 9151 140.073 130.629 94.297 1.00 0.00 H ATOM 46283 H2 WAT 9151 139.943 130.713 92.791 1.00 0.00 H TER 46285 WAT 9151 ATOM 46285 O WAT 9152 68.329 35.673 103.854 1.00 0.00 O ATOM 46286 H1 WAT 9152 68.869 36.086 103.180 1.00 0.00 H ATOM 46287 H2 WAT 9152 67.809 36.390 104.217 1.00 0.00 H TER 46289 WAT 9152 ATOM 46289 O WAT 9153 137.978 45.741 132.493 1.00 0.00 O ATOM 46290 H1 WAT 9153 138.188 46.090 133.359 1.00 0.00 H ATOM 46291 H2 WAT 9153 137.928 44.794 132.621 1.00 0.00 H TER 46293 WAT 9153 ATOM 46293 O WAT 9154 74.365 78.786 73.109 1.00 0.00 O ATOM 46294 H1 WAT 9154 73.581 79.267 72.845 1.00 0.00 H ATOM 46295 H2 WAT 9154 74.128 78.380 73.943 1.00 0.00 H TER 46297 WAT 9154 ATOM 46297 O WAT 9155 2.304 -0.012 81.033 1.00 0.00 O ATOM 46298 H1 WAT 9155 2.217 0.871 81.393 1.00 0.00 H ATOM 46299 H2 WAT 9155 2.472 -0.566 81.796 1.00 0.00 H TER 46301 WAT 9155 ATOM 46301 O WAT 9156 119.167 125.558 141.772 1.00 0.00 O ATOM 46302 H1 WAT 9156 118.857 126.055 141.015 1.00 0.00 H ATOM 46303 H2 WAT 9156 120.119 125.545 141.677 1.00 0.00 H TER 46305 WAT 9156 ATOM 46305 O WAT 9157 89.978 24.898 79.704 1.00 0.00 O ATOM 46306 H1 WAT 9157 90.241 24.265 80.372 1.00 0.00 H ATOM 46307 H2 WAT 9157 89.085 24.644 79.471 1.00 0.00 H TER 46309 WAT 9157 ATOM 46309 O WAT 9158 123.953 107.717 158.901 1.00 0.00 O ATOM 46310 H1 WAT 9158 124.018 108.010 157.992 1.00 0.00 H ATOM 46311 H2 WAT 9158 123.680 106.802 158.838 1.00 0.00 H TER 46313 WAT 9158 ATOM 46313 O WAT 9159 92.485 24.612 4.082 1.00 0.00 O ATOM 46314 H1 WAT 9159 93.290 25.048 3.802 1.00 0.00 H ATOM 46315 H2 WAT 9159 92.552 23.729 3.718 1.00 0.00 H TER 46317 WAT 9159 ATOM 46317 O WAT 9160 11.171 51.191 6.004 1.00 0.00 O ATOM 46318 H1 WAT 9160 10.877 51.481 6.867 1.00 0.00 H ATOM 46319 H2 WAT 9160 11.991 50.728 6.173 1.00 0.00 H TER 46321 WAT 9160 ATOM 46321 O WAT 9161 100.574 127.167 85.462 1.00 0.00 O ATOM 46322 H1 WAT 9161 100.665 127.783 86.189 1.00 0.00 H ATOM 46323 H2 WAT 9161 101.357 127.308 84.930 1.00 0.00 H TER 46325 WAT 9161 ATOM 46325 O WAT 9162 102.389 79.269 114.993 1.00 0.00 O ATOM 46326 H1 WAT 9162 102.776 79.941 114.432 1.00 0.00 H ATOM 46327 H2 WAT 9162 102.516 78.452 114.511 1.00 0.00 H TER 46329 WAT 9162 ATOM 46329 O WAT 9163 73.830 101.569 124.307 1.00 0.00 O ATOM 46330 H1 WAT 9163 73.460 100.705 124.490 1.00 0.00 H ATOM 46331 H2 WAT 9163 74.499 101.690 124.981 1.00 0.00 H TER 46333 WAT 9163 ATOM 46333 O WAT 9164 88.151 85.274 57.204 1.00 0.00 O ATOM 46334 H1 WAT 9164 89.078 85.247 56.965 1.00 0.00 H ATOM 46335 H2 WAT 9164 87.730 84.665 56.597 1.00 0.00 H TER 46337 WAT 9164 ATOM 46337 O WAT 9165 100.179 83.258 141.402 1.00 0.00 O ATOM 46338 H1 WAT 9165 99.923 82.602 140.754 1.00 0.00 H ATOM 46339 H2 WAT 9165 99.981 82.851 142.245 1.00 0.00 H TER 46341 WAT 9165 ATOM 46341 O WAT 9166 56.130 57.787 123.491 1.00 0.00 O ATOM 46342 H1 WAT 9166 55.837 56.917 123.220 1.00 0.00 H ATOM 46343 H2 WAT 9166 56.905 57.956 122.955 1.00 0.00 H TER 46345 WAT 9166 ATOM 46345 O WAT 9167 32.570 14.357 17.029 1.00 0.00 O ATOM 46346 H1 WAT 9167 33.029 14.228 16.198 1.00 0.00 H ATOM 46347 H2 WAT 9167 32.870 15.212 17.338 1.00 0.00 H TER 46349 WAT 9167 ATOM 46349 O WAT 9168 75.746 48.727 115.094 1.00 0.00 O ATOM 46350 H1 WAT 9168 76.388 49.048 115.728 1.00 0.00 H ATOM 46351 H2 WAT 9168 75.291 49.513 114.795 1.00 0.00 H TER 46353 WAT 9168 ATOM 46353 O WAT 9169 87.732 3.813 9.877 1.00 0.00 O ATOM 46354 H1 WAT 9169 86.944 3.270 9.908 1.00 0.00 H ATOM 46355 H2 WAT 9169 88.393 3.251 9.472 1.00 0.00 H TER 46357 WAT 9169 ATOM 46357 O WAT 9170 127.613 95.488 148.849 1.00 0.00 O ATOM 46358 H1 WAT 9170 126.674 95.490 148.661 1.00 0.00 H ATOM 46359 H2 WAT 9170 128.008 95.058 148.090 1.00 0.00 H TER 46361 WAT 9170 ATOM 46361 O WAT 9171 13.575 31.755 90.449 1.00 0.00 O ATOM 46362 H1 WAT 9171 12.646 31.703 90.227 1.00 0.00 H ATOM 46363 H2 WAT 9171 13.690 32.640 90.794 1.00 0.00 H TER 46365 WAT 9171 ATOM 46365 O WAT 9172 124.743 47.491 0.003 1.00 0.00 O ATOM 46366 H1 WAT 9172 123.870 47.832 0.202 1.00 0.00 H ATOM 46367 H2 WAT 9172 125.315 47.910 0.646 1.00 0.00 H TER 46369 WAT 9172 ATOM 46369 O WAT 9173 54.184 16.323 139.958 1.00 0.00 O ATOM 46370 H1 WAT 9173 54.899 15.835 139.549 1.00 0.00 H ATOM 46371 H2 WAT 9173 54.384 17.241 139.775 1.00 0.00 H TER 46373 WAT 9173 ATOM 46373 O WAT 9174 98.207 99.240 115.021 1.00 0.00 O ATOM 46374 H1 WAT 9174 98.238 100.154 114.738 1.00 0.00 H ATOM 46375 H2 WAT 9174 97.514 98.848 114.489 1.00 0.00 H TER 46377 WAT 9174 ATOM 46377 O WAT 9175 130.176 58.387 107.074 1.00 0.00 O ATOM 46378 H1 WAT 9175 129.781 58.625 106.235 1.00 0.00 H ATOM 46379 H2 WAT 9175 130.988 57.938 106.837 1.00 0.00 H TER 46381 WAT 9175 ATOM 46381 O WAT 9176 51.591 95.955 11.522 1.00 0.00 O ATOM 46382 H1 WAT 9176 50.711 95.839 11.881 1.00 0.00 H ATOM 46383 H2 WAT 9176 51.937 95.066 11.445 1.00 0.00 H TER 46385 WAT 9176 ATOM 46385 O WAT 9177 33.881 8.933 72.085 1.00 0.00 O ATOM 46386 H1 WAT 9177 33.754 8.164 71.529 1.00 0.00 H ATOM 46387 H2 WAT 9177 34.536 8.659 72.728 1.00 0.00 H TER 46389 WAT 9177 ATOM 46389 O WAT 9178 72.623 62.471 131.374 1.00 0.00 O ATOM 46390 H1 WAT 9178 73.556 62.673 131.300 1.00 0.00 H ATOM 46391 H2 WAT 9178 72.525 62.107 132.253 1.00 0.00 H TER 46393 WAT 9178 ATOM 46393 O WAT 9179 81.855 135.656 153.273 1.00 0.00 O ATOM 46394 H1 WAT 9179 82.651 135.292 153.660 1.00 0.00 H ATOM 46395 H2 WAT 9179 82.160 136.134 152.502 1.00 0.00 H TER 46397 WAT 9179 ATOM 46397 O WAT 9180 109.455 129.713 71.649 1.00 0.00 O ATOM 46398 H1 WAT 9180 109.526 130.536 71.167 1.00 0.00 H ATOM 46399 H2 WAT 9180 109.689 129.039 71.010 1.00 0.00 H TER 46401 WAT 9180 ATOM 46401 O WAT 9181 32.850 52.628 14.567 1.00 0.00 O ATOM 46402 H1 WAT 9181 32.774 53.234 15.304 1.00 0.00 H ATOM 46403 H2 WAT 9181 32.295 53.007 13.886 1.00 0.00 H TER 46405 WAT 9181 ATOM 46405 O WAT 9182 131.188 27.481 57.415 1.00 0.00 O ATOM 46406 H1 WAT 9182 130.732 27.321 58.242 1.00 0.00 H ATOM 46407 H2 WAT 9182 130.567 27.989 56.893 1.00 0.00 H TER 46409 WAT 9182 ATOM 46409 O WAT 9183 36.063 58.305 96.681 1.00 0.00 O ATOM 46410 H1 WAT 9183 35.287 58.071 97.191 1.00 0.00 H ATOM 46411 H2 WAT 9183 35.983 57.792 95.877 1.00 0.00 H TER 46413 WAT 9183 ATOM 46413 O WAT 9184 42.866 49.920 112.852 1.00 0.00 O ATOM 46414 H1 WAT 9184 42.553 50.825 112.820 1.00 0.00 H ATOM 46415 H2 WAT 9184 43.113 49.721 111.949 1.00 0.00 H TER 46417 WAT 9184 ATOM 46417 O WAT 9185 64.189 88.108 111.983 1.00 0.00 O ATOM 46418 H1 WAT 9185 64.434 87.954 112.895 1.00 0.00 H ATOM 46419 H2 WAT 9185 64.668 88.900 111.736 1.00 0.00 H TER 46421 WAT 9185 ATOM 46421 O WAT 9186 117.796 9.157 137.567 1.00 0.00 O ATOM 46422 H1 WAT 9186 118.542 8.590 137.761 1.00 0.00 H ATOM 46423 H2 WAT 9186 117.334 9.240 138.401 1.00 0.00 H TER 46425 WAT 9186 ATOM 46425 O WAT 9187 109.938 90.795 92.571 1.00 0.00 O ATOM 46426 H1 WAT 9187 110.755 90.966 93.040 1.00 0.00 H ATOM 46427 H2 WAT 9187 109.632 91.660 92.299 1.00 0.00 H TER 46429 WAT 9187 ATOM 46429 O WAT 9188 43.587 39.478 155.241 1.00 0.00 O ATOM 46430 H1 WAT 9188 42.946 39.519 154.532 1.00 0.00 H ATOM 46431 H2 WAT 9188 43.660 38.545 155.446 1.00 0.00 H TER 46433 WAT 9188 ATOM 46433 O WAT 9189 113.388 71.472 133.159 1.00 0.00 O ATOM 46434 H1 WAT 9189 113.781 72.292 133.460 1.00 0.00 H ATOM 46435 H2 WAT 9189 112.500 71.715 132.896 1.00 0.00 H TER 46437 WAT 9189 ATOM 46437 O WAT 9190 43.740 117.133 74.398 1.00 0.00 O ATOM 46438 H1 WAT 9190 43.015 116.878 74.969 1.00 0.00 H ATOM 46439 H2 WAT 9190 43.691 118.088 74.362 1.00 0.00 H TER 46441 WAT 9190 ATOM 46441 O WAT 9191 56.503 22.284 66.985 1.00 0.00 O ATOM 46442 H1 WAT 9191 56.262 22.437 66.071 1.00 0.00 H ATOM 46443 H2 WAT 9191 56.329 21.353 67.126 1.00 0.00 H TER 46445 WAT 9191 ATOM 46445 O WAT 9192 16.921 33.941 133.647 1.00 0.00 O ATOM 46446 H1 WAT 9192 15.995 33.707 133.578 1.00 0.00 H ATOM 46447 H2 WAT 9192 17.015 34.712 133.087 1.00 0.00 H TER 46449 WAT 9192 ATOM 46449 O WAT 9193 126.387 34.315 97.521 1.00 0.00 O ATOM 46450 H1 WAT 9193 126.020 34.547 96.668 1.00 0.00 H ATOM 46451 H2 WAT 9193 127.230 33.911 97.317 1.00 0.00 H TER 46453 WAT 9193 ATOM 46453 O WAT 9194 132.084 38.413 88.983 1.00 0.00 O ATOM 46454 H1 WAT 9194 132.697 38.569 89.702 1.00 0.00 H ATOM 46455 H2 WAT 9194 132.557 37.833 88.386 1.00 0.00 H TER 46457 WAT 9194 ATOM 46457 O WAT 9195 92.932 123.503 136.365 1.00 0.00 O ATOM 46458 H1 WAT 9195 92.560 123.432 137.244 1.00 0.00 H ATOM 46459 H2 WAT 9195 93.141 124.432 136.267 1.00 0.00 H TER 46461 WAT 9195 ATOM 46461 O WAT 9196 78.618 22.802 61.875 1.00 0.00 O ATOM 46462 H1 WAT 9196 79.465 22.376 62.011 1.00 0.00 H ATOM 46463 H2 WAT 9196 78.099 22.155 61.397 1.00 0.00 H TER 46465 WAT 9196 ATOM 46465 O WAT 9197 37.583 42.263 144.879 1.00 0.00 O ATOM 46466 H1 WAT 9197 37.932 41.376 144.959 1.00 0.00 H ATOM 46467 H2 WAT 9197 36.633 42.151 144.909 1.00 0.00 H TER 46469 WAT 9197 ATOM 46469 O WAT 9198 5.408 59.190 116.058 1.00 0.00 O ATOM 46470 H1 WAT 9198 5.532 58.424 115.497 1.00 0.00 H ATOM 46471 H2 WAT 9198 6.154 59.170 116.658 1.00 0.00 H TER 46473 WAT 9198 ATOM 46473 O WAT 9199 108.654 69.733 136.181 1.00 0.00 O ATOM 46474 H1 WAT 9199 109.610 69.785 136.208 1.00 0.00 H ATOM 46475 H2 WAT 9199 108.359 70.523 136.633 1.00 0.00 H TER 46477 WAT 9199 ATOM 46477 O WAT 9200 83.612 86.243 26.771 1.00 0.00 O ATOM 46478 H1 WAT 9200 83.902 86.003 25.892 1.00 0.00 H ATOM 46479 H2 WAT 9200 84.103 87.039 26.976 1.00 0.00 H TER 46481 WAT 9200 ATOM 46481 O WAT 9201 40.431 117.063 149.978 1.00 0.00 O ATOM 46482 H1 WAT 9201 40.268 117.523 150.802 1.00 0.00 H ATOM 46483 H2 WAT 9201 41.174 116.491 150.167 1.00 0.00 H TER 46485 WAT 9201 ATOM 46485 O WAT 9202 138.975 5.628 141.887 1.00 0.00 O ATOM 46486 H1 WAT 9202 139.055 4.687 141.731 1.00 0.00 H ATOM 46487 H2 WAT 9202 139.118 5.728 142.828 1.00 0.00 H TER 46489 WAT 9202 ATOM 46489 O WAT 9203 102.013 98.627 85.765 1.00 0.00 O ATOM 46490 H1 WAT 9203 101.828 97.778 86.166 1.00 0.00 H ATOM 46491 H2 WAT 9203 101.390 98.690 85.041 1.00 0.00 H TER 46493 WAT 9203 ATOM 46493 O WAT 9204 143.952 144.675 75.689 1.00 0.00 O ATOM 46494 H1 WAT 9204 143.585 144.603 76.571 1.00 0.00 H ATOM 46495 H2 WAT 9204 143.782 143.822 75.289 1.00 0.00 H TER 46497 WAT 9204 ATOM 46497 O WAT 9205 1.836 5.147 144.131 1.00 0.00 O ATOM 46498 H1 WAT 9205 1.183 5.031 143.441 1.00 0.00 H ATOM 46499 H2 WAT 9205 2.045 6.080 144.108 1.00 0.00 H TER 46501 WAT 9205 ATOM 46501 O WAT 9206 32.216 41.855 85.005 1.00 0.00 O ATOM 46502 H1 WAT 9206 32.510 42.170 84.150 1.00 0.00 H ATOM 46503 H2 WAT 9206 31.405 41.381 84.820 1.00 0.00 H TER 46505 WAT 9206 ATOM 46505 O WAT 9207 63.698 7.849 155.443 1.00 0.00 O ATOM 46506 H1 WAT 9207 64.570 7.930 155.829 1.00 0.00 H ATOM 46507 H2 WAT 9207 63.395 8.751 155.344 1.00 0.00 H TER 46509 WAT 9207 ATOM 46509 O WAT 9208 55.374 2.050 121.928 1.00 0.00 O ATOM 46510 H1 WAT 9208 55.699 2.944 121.826 1.00 0.00 H ATOM 46511 H2 WAT 9208 56.108 1.496 121.661 1.00 0.00 H TER 46513 WAT 9208 ATOM 46513 O WAT 9209 30.856 50.633 89.132 1.00 0.00 O ATOM 46514 H1 WAT 9209 31.045 50.178 88.311 1.00 0.00 H ATOM 46515 H2 WAT 9209 30.167 51.258 88.906 1.00 0.00 H TER 46517 WAT 9209 ATOM 46517 O WAT 9210 77.689 68.171 7.148 1.00 0.00 O ATOM 46518 H1 WAT 9210 78.368 67.870 7.753 1.00 0.00 H ATOM 46519 H2 WAT 9210 77.883 67.719 6.327 1.00 0.00 H TER 46521 WAT 9210 ATOM 46521 O WAT 9211 49.591 86.854 106.909 1.00 0.00 O ATOM 46522 H1 WAT 9211 49.556 86.189 106.222 1.00 0.00 H ATOM 46523 H2 WAT 9211 49.379 87.673 106.461 1.00 0.00 H TER 46525 WAT 9211 ATOM 46525 O WAT 9212 116.452 14.326 108.240 1.00 0.00 O ATOM 46526 H1 WAT 9212 116.978 13.888 107.572 1.00 0.00 H ATOM 46527 H2 WAT 9212 115.625 13.844 108.249 1.00 0.00 H TER 46529 WAT 9212 ATOM 46529 O WAT 9213 86.938 143.466 140.565 1.00 0.00 O ATOM 46530 H1 WAT 9213 87.385 143.947 139.868 1.00 0.00 H ATOM 46531 H2 WAT 9213 87.639 143.003 141.024 1.00 0.00 H TER 46533 WAT 9213 ATOM 46533 O WAT 9214 19.832 80.194 2.156 1.00 0.00 O ATOM 46534 H1 WAT 9214 20.397 79.482 2.455 1.00 0.00 H ATOM 46535 H2 WAT 9214 19.460 79.874 1.334 1.00 0.00 H TER 46537 WAT 9214 ATOM 46537 O WAT 9215 107.984 142.543 19.298 1.00 0.00 O ATOM 46538 H1 WAT 9215 108.814 142.528 18.822 1.00 0.00 H ATOM 46539 H2 WAT 9215 107.525 141.756 19.002 1.00 0.00 H TER 46541 WAT 9215 ATOM 46541 O WAT 9216 143.954 56.268 137.671 1.00 0.00 O ATOM 46542 H1 WAT 9216 144.512 55.493 137.732 1.00 0.00 H ATOM 46543 H2 WAT 9216 144.278 56.736 136.901 1.00 0.00 H TER 46545 WAT 9216 ATOM 46545 O WAT 9217 52.543 133.231 138.174 1.00 0.00 O ATOM 46546 H1 WAT 9217 52.242 132.329 138.065 1.00 0.00 H ATOM 46547 H2 WAT 9217 52.244 133.480 139.049 1.00 0.00 H TER 46549 WAT 9217 ATOM 46549 O WAT 9218 39.019 4.143 122.843 1.00 0.00 O ATOM 46550 H1 WAT 9218 39.874 4.087 122.417 1.00 0.00 H ATOM 46551 H2 WAT 9218 38.786 3.235 123.034 1.00 0.00 H TER 46553 WAT 9218 ATOM 46553 O WAT 9219 68.457 73.064 6.405 1.00 0.00 O ATOM 46554 H1 WAT 9219 68.079 72.719 7.215 1.00 0.00 H ATOM 46555 H2 WAT 9219 68.866 72.305 5.990 1.00 0.00 H TER 46557 WAT 9219 ATOM 46557 O WAT 9220 4.239 1.421 157.120 1.00 0.00 O ATOM 46558 H1 WAT 9220 5.011 1.767 157.567 1.00 0.00 H ATOM 46559 H2 WAT 9220 3.522 1.986 157.408 1.00 0.00 H TER 46561 WAT 9220 ATOM 46561 O WAT 9221 61.790 89.032 94.223 1.00 0.00 O ATOM 46562 H1 WAT 9221 60.868 88.814 94.361 1.00 0.00 H ATOM 46563 H2 WAT 9221 62.244 88.638 94.967 1.00 0.00 H TER 46565 WAT 9221 ATOM 46565 O WAT 9222 49.756 119.858 145.666 1.00 0.00 O ATOM 46566 H1 WAT 9222 50.554 119.915 145.141 1.00 0.00 H ATOM 46567 H2 WAT 9222 49.050 120.054 145.051 1.00 0.00 H TER 46569 WAT 9222 ATOM 46569 O WAT 9223 115.486 139.074 122.038 1.00 0.00 O ATOM 46570 H1 WAT 9223 114.638 138.843 121.658 1.00 0.00 H ATOM 46571 H2 WAT 9223 115.394 138.871 122.969 1.00 0.00 H TER 46573 WAT 9223 ATOM 46573 O WAT 9224 38.936 54.138 8.696 1.00 0.00 O ATOM 46574 H1 WAT 9224 38.182 54.712 8.559 1.00 0.00 H ATOM 46575 H2 WAT 9224 39.387 54.512 9.453 1.00 0.00 H TER 46577 WAT 9224 ATOM 46577 O WAT 9225 63.054 140.106 99.161 1.00 0.00 O ATOM 46578 H1 WAT 9225 63.836 139.811 98.694 1.00 0.00 H ATOM 46579 H2 WAT 9225 62.532 140.553 98.495 1.00 0.00 H TER 46581 WAT 9225 ATOM 46581 O WAT 9226 114.917 99.996 96.887 1.00 0.00 O ATOM 46582 H1 WAT 9226 114.153 99.488 96.613 1.00 0.00 H ATOM 46583 H2 WAT 9226 114.692 100.314 97.761 1.00 0.00 H TER 46585 WAT 9226 ATOM 46585 O WAT 9227 112.359 45.750 120.132 1.00 0.00 O ATOM 46586 H1 WAT 9227 111.501 46.036 120.445 1.00 0.00 H ATOM 46587 H2 WAT 9227 112.875 45.623 120.928 1.00 0.00 H TER 46589 WAT 9227 ATOM 46589 O WAT 9228 128.599 91.985 12.633 1.00 0.00 O ATOM 46590 H1 WAT 9228 128.899 91.673 13.486 1.00 0.00 H ATOM 46591 H2 WAT 9228 129.342 92.477 12.283 1.00 0.00 H TER 46593 WAT 9228 ATOM 46593 O WAT 9229 18.101 63.005 69.927 1.00 0.00 O ATOM 46594 H1 WAT 9229 18.990 62.956 70.280 1.00 0.00 H ATOM 46595 H2 WAT 9229 17.865 62.096 69.746 1.00 0.00 H TER 46597 WAT 9229 ATOM 46597 O WAT 9230 113.518 80.351 97.735 1.00 0.00 O ATOM 46598 H1 WAT 9230 113.015 81.156 97.613 1.00 0.00 H ATOM 46599 H2 WAT 9230 114.431 80.638 97.743 1.00 0.00 H TER 46601 WAT 9230 ATOM 46601 O WAT 9231 116.149 71.875 105.102 1.00 0.00 O ATOM 46602 H1 WAT 9231 115.816 71.822 104.206 1.00 0.00 H ATOM 46603 H2 WAT 9231 116.971 71.384 105.081 1.00 0.00 H TER 46605 WAT 9231 ATOM 46605 O WAT 9232 101.614 102.290 0.398 1.00 0.00 O ATOM 46606 H1 WAT 9232 100.890 102.837 0.091 1.00 0.00 H ATOM 46607 H2 WAT 9232 101.281 101.878 1.196 1.00 0.00 H TER 46609 WAT 9232 ATOM 46609 O WAT 9233 32.988 53.307 135.471 1.00 0.00 O ATOM 46610 H1 WAT 9233 32.955 53.526 134.540 1.00 0.00 H ATOM 46611 H2 WAT 9233 32.137 53.582 135.813 1.00 0.00 H TER 46613 WAT 9233 ATOM 46613 O WAT 9234 96.170 66.019 106.615 1.00 0.00 O ATOM 46614 H1 WAT 9234 95.783 66.798 107.015 1.00 0.00 H ATOM 46615 H2 WAT 9234 95.420 65.480 106.364 1.00 0.00 H TER 46617 WAT 9234 ATOM 46617 O WAT 9235 122.691 78.401 107.719 1.00 0.00 O ATOM 46618 H1 WAT 9235 122.407 77.590 107.297 1.00 0.00 H ATOM 46619 H2 WAT 9235 122.090 79.067 107.384 1.00 0.00 H TER 46621 WAT 9235 ATOM 46621 O WAT 9236 14.891 129.072 87.620 1.00 0.00 O ATOM 46622 H1 WAT 9236 14.240 128.426 87.893 1.00 0.00 H ATOM 46623 H2 WAT 9236 14.912 129.707 88.336 1.00 0.00 H TER 46625 WAT 9236 ATOM 46625 O WAT 9237 0.386 25.226 126.253 1.00 0.00 O ATOM 46626 H1 WAT 9237 0.157 26.082 126.615 1.00 0.00 H ATOM 46627 H2 WAT 9237 1.016 24.864 126.876 1.00 0.00 H TER 46629 WAT 9237 ATOM 46629 O WAT 9238 13.042 60.272 125.932 1.00 0.00 O ATOM 46630 H1 WAT 9238 13.666 59.809 126.491 1.00 0.00 H ATOM 46631 H2 WAT 9238 13.061 59.793 125.104 1.00 0.00 H TER 46633 WAT 9238 ATOM 46633 O WAT 9239 61.836 42.289 14.456 1.00 0.00 O ATOM 46634 H1 WAT 9239 61.586 41.422 14.775 1.00 0.00 H ATOM 46635 H2 WAT 9239 62.593 42.531 14.990 1.00 0.00 H TER 46637 WAT 9239 ATOM 46637 O WAT 9240 37.797 28.462 0.959 1.00 0.00 O ATOM 46638 H1 WAT 9240 38.067 27.973 1.736 1.00 0.00 H ATOM 46639 H2 WAT 9240 37.456 27.795 0.363 1.00 0.00 H TER 46641 WAT 9240 ATOM 46641 O WAT 9241 114.675 134.838 1.389 1.00 0.00 O ATOM 46642 H1 WAT 9241 113.935 135.081 0.833 1.00 0.00 H ATOM 46643 H2 WAT 9241 114.673 135.490 2.089 1.00 0.00 H TER 46645 WAT 9241 ATOM 46645 O WAT 9242 4.158 96.677 10.295 1.00 0.00 O ATOM 46646 H1 WAT 9242 3.538 97.390 10.450 1.00 0.00 H ATOM 46647 H2 WAT 9242 4.717 96.674 11.072 1.00 0.00 H TER 46649 WAT 9242 ATOM 46649 O WAT 9243 46.464 17.905 78.876 1.00 0.00 O ATOM 46650 H1 WAT 9243 47.266 18.263 79.256 1.00 0.00 H ATOM 46651 H2 WAT 9243 46.588 17.994 77.930 1.00 0.00 H TER 46653 WAT 9243 ATOM 46653 O WAT 9244 89.384 99.571 18.004 1.00 0.00 O ATOM 46654 H1 WAT 9244 88.740 100.267 18.130 1.00 0.00 H ATOM 46655 H2 WAT 9244 90.226 99.988 18.185 1.00 0.00 H TER 46657 WAT 9244 ATOM 46657 O WAT 9245 30.867 126.238 136.088 1.00 0.00 O ATOM 46658 H1 WAT 9245 30.672 127.159 136.261 1.00 0.00 H ATOM 46659 H2 WAT 9245 31.818 126.173 136.179 1.00 0.00 H TER 46661 WAT 9245 ATOM 46661 O WAT 9246 10.389 101.892 96.628 1.00 0.00 O ATOM 46662 H1 WAT 9246 10.953 102.627 96.868 1.00 0.00 H ATOM 46663 H2 WAT 9246 10.127 102.075 95.726 1.00 0.00 H TER 46665 WAT 9246 ATOM 46665 O WAT 9247 55.833 43.761 78.091 1.00 0.00 O ATOM 46666 H1 WAT 9247 55.189 43.372 78.682 1.00 0.00 H ATOM 46667 H2 WAT 9247 56.429 44.240 78.667 1.00 0.00 H TER 46669 WAT 9247 ATOM 46669 O WAT 9248 35.365 125.225 65.818 1.00 0.00 O ATOM 46670 H1 WAT 9248 35.558 124.853 64.958 1.00 0.00 H ATOM 46671 H2 WAT 9248 35.244 126.160 65.654 1.00 0.00 H TER 46673 WAT 9248 ATOM 46673 O WAT 9249 140.715 92.227 -0.087 1.00 0.00 O ATOM 46674 H1 WAT 9249 140.691 93.181 -0.017 1.00 0.00 H ATOM 46675 H2 WAT 9249 141.101 91.936 0.739 1.00 0.00 H TER 46677 WAT 9249 ATOM 46677 O WAT 9250 33.233 41.933 100.048 1.00 0.00 O ATOM 46678 H1 WAT 9250 33.271 42.827 99.705 1.00 0.00 H ATOM 46679 H2 WAT 9250 32.448 41.558 99.650 1.00 0.00 H TER 46681 WAT 9250 ATOM 46681 O WAT 9251 18.512 32.608 63.055 1.00 0.00 O ATOM 46682 H1 WAT 9251 19.349 32.413 62.635 1.00 0.00 H ATOM 46683 H2 WAT 9251 18.053 33.167 62.429 1.00 0.00 H TER 46685 WAT 9251 ATOM 46685 O WAT 9252 94.522 77.221 62.066 1.00 0.00 O ATOM 46686 H1 WAT 9252 93.661 77.464 61.726 1.00 0.00 H ATOM 46687 H2 WAT 9252 95.088 77.957 61.832 1.00 0.00 H TER 46689 WAT 9252 ATOM 46689 O WAT 9253 54.561 57.539 117.944 1.00 0.00 O ATOM 46690 H1 WAT 9253 55.330 58.049 117.690 1.00 0.00 H ATOM 46691 H2 WAT 9253 54.812 57.120 118.768 1.00 0.00 H TER 46693 WAT 9253 ATOM 46693 O WAT 9254 89.806 116.575 141.290 1.00 0.00 O ATOM 46694 H1 WAT 9254 90.632 116.776 141.731 1.00 0.00 H ATOM 46695 H2 WAT 9254 89.937 116.875 140.390 1.00 0.00 H TER 46697 WAT 9254 ATOM 46697 O WAT 9255 4.441 36.690 4.002 1.00 0.00 O ATOM 46698 H1 WAT 9255 4.235 37.387 3.379 1.00 0.00 H ATOM 46699 H2 WAT 9255 3.772 36.024 3.845 1.00 0.00 H TER 46701 WAT 9255 ATOM 46701 O WAT 9256 121.092 144.215 7.964 1.00 0.00 O ATOM 46702 H1 WAT 9256 121.051 143.492 7.338 1.00 0.00 H ATOM 46703 H2 WAT 9256 121.861 144.719 7.697 1.00 0.00 H TER 46705 WAT 9256 ATOM 46705 O WAT 9257 31.863 47.892 157.968 1.00 0.00 O ATOM 46706 H1 WAT 9257 32.153 47.041 158.296 1.00 0.00 H ATOM 46707 H2 WAT 9257 32.640 48.265 157.552 1.00 0.00 H TER 46709 WAT 9257 ATOM 46709 O WAT 9258 44.694 50.906 87.177 1.00 0.00 O ATOM 46710 H1 WAT 9258 44.656 50.879 86.220 1.00 0.00 H ATOM 46711 H2 WAT 9258 45.616 50.757 87.384 1.00 0.00 H TER 46713 WAT 9258 ATOM 46713 O WAT 9259 80.941 118.352 98.913 1.00 0.00 O ATOM 46714 H1 WAT 9259 80.806 119.034 98.254 1.00 0.00 H ATOM 46715 H2 WAT 9259 80.725 117.537 98.461 1.00 0.00 H TER 46717 WAT 9259 ATOM 46717 O WAT 9260 25.863 103.920 122.828 1.00 0.00 O ATOM 46718 H1 WAT 9260 26.545 104.584 122.732 1.00 0.00 H ATOM 46719 H2 WAT 9260 25.392 103.936 121.994 1.00 0.00 H TER 46721 WAT 9260 ATOM 46721 O WAT 9261 54.473 32.623 85.411 1.00 0.00 O ATOM 46722 H1 WAT 9261 54.555 31.689 85.216 1.00 0.00 H ATOM 46723 H2 WAT 9261 53.530 32.778 85.452 1.00 0.00 H TER 46725 WAT 9261 ATOM 46725 O WAT 9262 97.255 95.208 91.260 1.00 0.00 O ATOM 46726 H1 WAT 9262 96.567 95.835 91.484 1.00 0.00 H ATOM 46727 H2 WAT 9262 97.951 95.379 91.895 1.00 0.00 H TER 46729 WAT 9262 ATOM 46729 O WAT 9263 75.994 131.267 87.798 1.00 0.00 O ATOM 46730 H1 WAT 9263 75.292 131.915 87.853 1.00 0.00 H ATOM 46731 H2 WAT 9263 76.569 131.593 87.106 1.00 0.00 H TER 46733 WAT 9263 ATOM 46733 O WAT 9264 132.439 8.987 2.254 1.00 0.00 O ATOM 46734 H1 WAT 9264 131.920 8.276 2.630 1.00 0.00 H ATOM 46735 H2 WAT 9264 132.538 9.615 2.970 1.00 0.00 H TER 46737 WAT 9264 ATOM 46737 O WAT 9265 72.739 7.377 141.943 1.00 0.00 O ATOM 46738 H1 WAT 9265 73.290 7.892 141.353 1.00 0.00 H ATOM 46739 H2 WAT 9265 72.557 7.966 142.675 1.00 0.00 H TER 46741 WAT 9265 ATOM 46741 O WAT 9266 92.532 96.132 82.353 1.00 0.00 O ATOM 46742 H1 WAT 9266 93.060 96.525 81.658 1.00 0.00 H ATOM 46743 H2 WAT 9266 92.187 95.328 81.966 1.00 0.00 H TER 46745 WAT 9266 ATOM 46745 O WAT 9267 104.494 35.341 141.428 1.00 0.00 O ATOM 46746 H1 WAT 9267 105.370 35.612 141.154 1.00 0.00 H ATOM 46747 H2 WAT 9267 104.620 34.973 142.303 1.00 0.00 H TER 46749 WAT 9267 ATOM 46749 O WAT 9268 51.270 26.809 80.967 1.00 0.00 O ATOM 46750 H1 WAT 9268 51.202 27.281 80.138 1.00 0.00 H ATOM 46751 H2 WAT 9268 52.211 26.733 81.124 1.00 0.00 H TER 46753 WAT 9268 ATOM 46753 O WAT 9269 86.197 27.901 109.081 1.00 0.00 O ATOM 46754 H1 WAT 9269 86.170 27.528 109.962 1.00 0.00 H ATOM 46755 H2 WAT 9269 85.615 28.660 109.124 1.00 0.00 H TER 46757 WAT 9269 ATOM 46757 O WAT 9270 47.519 52.791 135.288 1.00 0.00 O ATOM 46758 H1 WAT 9270 47.843 52.113 134.694 1.00 0.00 H ATOM 46759 H2 WAT 9270 47.977 53.586 135.016 1.00 0.00 H TER 46761 WAT 9270 ATOM 46761 O WAT 9271 139.379 15.590 3.472 1.00 0.00 O ATOM 46762 H1 WAT 9271 139.154 15.242 4.335 1.00 0.00 H ATOM 46763 H2 WAT 9271 139.474 16.532 3.611 1.00 0.00 H TER 46765 WAT 9271 ATOM 46765 O WAT 9272 3.203 125.903 84.188 1.00 0.00 O ATOM 46766 H1 WAT 9272 3.498 125.228 84.800 1.00 0.00 H ATOM 46767 H2 WAT 9272 3.946 126.502 84.115 1.00 0.00 H TER 46769 WAT 9272 ATOM 46769 O WAT 9273 53.073 28.027 90.562 1.00 0.00 O ATOM 46770 H1 WAT 9273 53.710 28.649 90.914 1.00 0.00 H ATOM 46771 H2 WAT 9273 52.224 28.443 90.713 1.00 0.00 H TER 46773 WAT 9273 ATOM 46773 O WAT 9274 68.399 41.777 2.329 1.00 0.00 O ATOM 46774 H1 WAT 9274 69.042 42.484 2.282 1.00 0.00 H ATOM 46775 H2 WAT 9274 67.974 41.783 1.472 1.00 0.00 H TER 46777 WAT 9274 ATOM 46777 O WAT 9275 18.036 96.325 104.042 1.00 0.00 O ATOM 46778 H1 WAT 9275 18.507 96.537 103.236 1.00 0.00 H ATOM 46779 H2 WAT 9275 17.827 97.175 104.428 1.00 0.00 H TER 46781 WAT 9275 ATOM 46781 O WAT 9276 39.867 109.994 2.598 1.00 0.00 O ATOM 46782 H1 WAT 9276 40.648 109.899 2.054 1.00 0.00 H ATOM 46783 H2 WAT 9276 39.173 109.562 2.099 1.00 0.00 H TER 46785 WAT 9276 ATOM 46785 O WAT 9277 63.697 104.181 2.897 1.00 0.00 O ATOM 46786 H1 WAT 9277 62.789 104.478 2.964 1.00 0.00 H ATOM 46787 H2 WAT 9277 63.647 103.370 2.390 1.00 0.00 H TER 46789 WAT 9277 ATOM 46789 O WAT 9278 26.957 4.147 21.068 1.00 0.00 O ATOM 46790 H1 WAT 9278 26.253 4.570 20.577 1.00 0.00 H ATOM 46791 H2 WAT 9278 26.647 4.139 21.974 1.00 0.00 H TER 46793 WAT 9278 ATOM 46793 O WAT 9279 76.869 130.437 68.676 1.00 0.00 O ATOM 46794 H1 WAT 9279 76.787 130.946 67.869 1.00 0.00 H ATOM 46795 H2 WAT 9279 77.591 130.851 69.148 1.00 0.00 H TER 46797 WAT 9279 ATOM 46797 O WAT 9280 82.903 37.481 141.511 1.00 0.00 O ATOM 46798 H1 WAT 9280 81.951 37.376 141.505 1.00 0.00 H ATOM 46799 H2 WAT 9280 83.221 36.744 142.032 1.00 0.00 H TER 46801 WAT 9280 ATOM 46801 O WAT 9281 17.879 82.420 109.744 1.00 0.00 O ATOM 46802 H1 WAT 9281 18.577 81.903 109.343 1.00 0.00 H ATOM 46803 H2 WAT 9281 17.202 82.473 109.069 1.00 0.00 H TER 46805 WAT 9281 ATOM 46805 O WAT 9282 93.692 60.141 98.364 1.00 0.00 O ATOM 46806 H1 WAT 9282 94.136 60.930 98.672 1.00 0.00 H ATOM 46807 H2 WAT 9282 93.657 59.571 99.132 1.00 0.00 H TER 46809 WAT 9282 ATOM 46809 O WAT 9283 103.067 76.187 145.306 1.00 0.00 O ATOM 46810 H1 WAT 9283 102.396 75.505 145.259 1.00 0.00 H ATOM 46811 H2 WAT 9283 102.576 77.008 145.279 1.00 0.00 H TER 46813 WAT 9283 ATOM 46813 O WAT 9284 98.892 139.472 19.534 1.00 0.00 O ATOM 46814 H1 WAT 9284 98.009 139.750 19.775 1.00 0.00 H ATOM 46815 H2 WAT 9284 99.417 139.634 20.318 1.00 0.00 H TER 46817 WAT 9284 ATOM 46817 O WAT 9285 86.356 105.277 17.703 1.00 0.00 O ATOM 46818 H1 WAT 9285 87.298 105.370 17.845 1.00 0.00 H ATOM 46819 H2 WAT 9285 86.034 104.851 18.497 1.00 0.00 H TER 46821 WAT 9285 ATOM 46821 O WAT 9286 59.414 40.335 117.062 1.00 0.00 O ATOM 46822 H1 WAT 9286 59.775 39.757 117.734 1.00 0.00 H ATOM 46823 H2 WAT 9286 59.224 41.151 117.525 1.00 0.00 H TER 46825 WAT 9286 ATOM 46825 O WAT 9287 33.965 17.934 24.647 1.00 0.00 O ATOM 46826 H1 WAT 9287 33.883 18.391 23.810 1.00 0.00 H ATOM 46827 H2 WAT 9287 34.487 18.524 25.191 1.00 0.00 H TER 46829 WAT 9287 ATOM 46829 O WAT 9288 119.834 75.702 118.052 1.00 0.00 O ATOM 46830 H1 WAT 9288 120.508 75.218 117.573 1.00 0.00 H ATOM 46831 H2 WAT 9288 120.300 76.446 118.434 1.00 0.00 H TER 46833 WAT 9288 ATOM 46833 O WAT 9289 60.959 2.516 64.350 1.00 0.00 O ATOM 46834 H1 WAT 9289 61.356 1.825 64.881 1.00 0.00 H ATOM 46835 H2 WAT 9289 60.037 2.514 64.606 1.00 0.00 H TER 46837 WAT 9289 ATOM 46837 O WAT 9290 133.694 55.193 58.525 1.00 0.00 O ATOM 46838 H1 WAT 9290 132.861 55.020 58.089 1.00 0.00 H ATOM 46839 H2 WAT 9290 133.605 54.783 59.385 1.00 0.00 H TER 46841 WAT 9290 ATOM 46841 O WAT 9291 1.406 70.018 56.081 1.00 0.00 O ATOM 46842 H1 WAT 9291 0.513 69.675 56.072 1.00 0.00 H ATOM 46843 H2 WAT 9291 1.315 70.932 55.813 1.00 0.00 H TER 46845 WAT 9291 ATOM 46845 O WAT 9292 34.080 56.677 82.808 1.00 0.00 O ATOM 46846 H1 WAT 9292 34.086 57.573 82.472 1.00 0.00 H ATOM 46847 H2 WAT 9292 33.269 56.616 83.312 1.00 0.00 H TER 46849 WAT 9292 ATOM 46849 O WAT 9293 114.916 44.876 131.394 1.00 0.00 O ATOM 46850 H1 WAT 9293 115.471 44.736 132.161 1.00 0.00 H ATOM 46851 H2 WAT 9293 115.328 45.604 130.929 1.00 0.00 H TER 46853 WAT 9293 ATOM 46853 O WAT 9294 97.073 17.367 61.646 1.00 0.00 O ATOM 46854 H1 WAT 9294 98.004 17.191 61.779 1.00 0.00 H ATOM 46855 H2 WAT 9294 96.732 17.526 62.526 1.00 0.00 H TER 46857 WAT 9294 ATOM 46857 O WAT 9295 69.991 140.199 8.335 1.00 0.00 O ATOM 46858 H1 WAT 9295 70.466 139.842 7.584 1.00 0.00 H ATOM 46859 H2 WAT 9295 70.651 140.691 8.824 1.00 0.00 H TER 46861 WAT 9295 ATOM 46861 O WAT 9296 49.376 50.349 83.428 1.00 0.00 O ATOM 46862 H1 WAT 9296 48.533 50.700 83.140 1.00 0.00 H ATOM 46863 H2 WAT 9296 49.806 50.066 82.621 1.00 0.00 H TER 46865 WAT 9296 ATOM 46865 O WAT 9297 100.313 81.679 13.121 1.00 0.00 O ATOM 46866 H1 WAT 9297 99.852 81.533 12.295 1.00 0.00 H ATOM 46867 H2 WAT 9297 100.119 82.590 13.345 1.00 0.00 H TER 46869 WAT 9297 ATOM 46869 O WAT 9298 53.889 99.647 12.594 1.00 0.00 O ATOM 46870 H1 WAT 9298 53.279 99.473 13.310 1.00 0.00 H ATOM 46871 H2 WAT 9298 54.603 99.025 12.731 1.00 0.00 H TER 46873 WAT 9298 ATOM 46873 O WAT 9299 134.119 42.918 65.008 1.00 0.00 O ATOM 46874 H1 WAT 9299 134.649 42.659 65.762 1.00 0.00 H ATOM 46875 H2 WAT 9299 133.370 42.323 65.025 1.00 0.00 H TER 46877 WAT 9299 ATOM 46877 O WAT 9300 16.277 3.246 109.112 1.00 0.00 O ATOM 46878 H1 WAT 9300 15.736 3.298 108.324 1.00 0.00 H ATOM 46879 H2 WAT 9300 16.809 2.461 108.986 1.00 0.00 H TER 46881 WAT 9300 ATOM 46881 O WAT 9301 71.655 134.009 131.111 1.00 0.00 O ATOM 46882 H1 WAT 9301 71.877 133.314 131.730 1.00 0.00 H ATOM 46883 H2 WAT 9301 72.423 134.581 131.107 1.00 0.00 H TER 46885 WAT 9301 ATOM 46885 O WAT 9302 81.238 78.081 16.150 1.00 0.00 O ATOM 46886 H1 WAT 9302 81.701 78.455 16.899 1.00 0.00 H ATOM 46887 H2 WAT 9302 80.802 77.305 16.501 1.00 0.00 H TER 46889 WAT 9302 ATOM 46889 O WAT 9303 37.780 94.984 133.281 1.00 0.00 O ATOM 46890 H1 WAT 9303 37.203 95.521 133.824 1.00 0.00 H ATOM 46891 H2 WAT 9303 37.197 94.580 132.638 1.00 0.00 H TER 46893 WAT 9303 ATOM 46893 O WAT 9304 141.031 126.877 8.489 1.00 0.00 O ATOM 46894 H1 WAT 9304 141.263 127.791 8.653 1.00 0.00 H ATOM 46895 H2 WAT 9304 140.576 126.599 9.284 1.00 0.00 H TER 46897 WAT 9304 ATOM 46897 O WAT 9305 61.501 40.274 141.885 1.00 0.00 O ATOM 46898 H1 WAT 9305 61.034 41.088 141.701 1.00 0.00 H ATOM 46899 H2 WAT 9305 62.259 40.544 142.404 1.00 0.00 H TER 46901 WAT 9305 ATOM 46901 O WAT 9306 130.146 38.946 92.735 1.00 0.00 O ATOM 46902 H1 WAT 9306 131.013 38.913 93.138 1.00 0.00 H ATOM 46903 H2 WAT 9306 129.821 38.048 92.791 1.00 0.00 H TER 46905 WAT 9306 ATOM 46905 O WAT 9307 132.853 68.600 96.268 1.00 0.00 O ATOM 46906 H1 WAT 9307 132.257 69.299 96.536 1.00 0.00 H ATOM 46907 H2 WAT 9307 133.723 68.998 96.309 1.00 0.00 H TER 46909 WAT 9307 ATOM 46909 O WAT 9308 106.170 28.082 21.198 1.00 0.00 O ATOM 46910 H1 WAT 9308 106.094 27.993 22.147 1.00 0.00 H ATOM 46911 H2 WAT 9308 105.990 27.205 20.859 1.00 0.00 H TER 46913 WAT 9308 ATOM 46913 O WAT 9309 25.400 50.280 6.627 1.00 0.00 O ATOM 46914 H1 WAT 9309 24.522 50.497 6.941 1.00 0.00 H ATOM 46915 H2 WAT 9309 25.983 50.573 7.327 1.00 0.00 H TER 46917 WAT 9309 ATOM 46917 O WAT 9310 119.740 8.184 83.383 1.00 0.00 O ATOM 46918 H1 WAT 9310 119.893 7.507 84.043 1.00 0.00 H ATOM 46919 H2 WAT 9310 120.134 7.834 82.584 1.00 0.00 H TER 46921 WAT 9310 ATOM 46921 O WAT 9311 2.883 43.623 10.657 1.00 0.00 O ATOM 46922 H1 WAT 9311 3.573 44.266 10.821 1.00 0.00 H ATOM 46923 H2 WAT 9311 2.075 44.136 10.646 1.00 0.00 H TER 46925 WAT 9311 ATOM 46925 O WAT 9312 123.929 81.728 107.334 1.00 0.00 O ATOM 46926 H1 WAT 9312 123.174 81.316 106.915 1.00 0.00 H ATOM 46927 H2 WAT 9312 123.866 81.465 108.252 1.00 0.00 H TER 46929 WAT 9312 ATOM 46929 O WAT 9313 14.211 95.499 79.365 1.00 0.00 O ATOM 46930 H1 WAT 9313 14.224 94.767 79.981 1.00 0.00 H ATOM 46931 H2 WAT 9313 13.755 95.157 78.596 1.00 0.00 H TER 46933 WAT 9313 ATOM 46933 O WAT 9314 118.888 23.979 108.785 1.00 0.00 O ATOM 46934 H1 WAT 9314 119.120 24.907 108.759 1.00 0.00 H ATOM 46935 H2 WAT 9314 118.679 23.758 107.878 1.00 0.00 H TER 46937 WAT 9314 ATOM 46937 O WAT 9315 53.255 144.662 64.023 1.00 0.00 O ATOM 46938 H1 WAT 9315 53.872 144.869 64.725 1.00 0.00 H ATOM 46939 H2 WAT 9315 52.670 145.419 63.986 1.00 0.00 H TER 46941 WAT 9315 ATOM 46941 O WAT 9316 78.548 76.422 132.017 1.00 0.00 O ATOM 46942 H1 WAT 9316 77.800 75.982 132.421 1.00 0.00 H ATOM 46943 H2 WAT 9316 78.234 76.683 131.151 1.00 0.00 H TER 46945 WAT 9316 ATOM 46945 O WAT 9317 3.713 74.532 5.959 1.00 0.00 O ATOM 46946 H1 WAT 9317 4.337 74.835 6.619 1.00 0.00 H ATOM 46947 H2 WAT 9317 3.837 75.128 5.220 1.00 0.00 H TER 46949 WAT 9317 ATOM 46949 O WAT 9318 64.255 36.815 105.679 1.00 0.00 O ATOM 46950 H1 WAT 9318 63.539 36.227 105.441 1.00 0.00 H ATOM 46951 H2 WAT 9318 65.015 36.241 105.774 1.00 0.00 H TER 46953 WAT 9318 ATOM 46953 O WAT 9319 127.599 75.325 123.370 1.00 0.00 O ATOM 46954 H1 WAT 9319 128.104 75.912 122.807 1.00 0.00 H ATOM 46955 H2 WAT 9319 126.763 75.218 122.916 1.00 0.00 H TER 46957 WAT 9319 ATOM 46957 O WAT 9320 90.542 105.667 60.054 1.00 0.00 O ATOM 46958 H1 WAT 9320 90.434 104.965 59.413 1.00 0.00 H ATOM 46959 H2 WAT 9320 91.471 105.639 60.285 1.00 0.00 H TER 46961 WAT 9320 ATOM 46961 O WAT 9321 97.645 36.949 146.502 1.00 0.00 O ATOM 46962 H1 WAT 9321 96.795 37.140 146.899 1.00 0.00 H ATOM 46963 H2 WAT 9321 97.622 36.008 146.328 1.00 0.00 H TER 46965 WAT 9321 ATOM 46965 O WAT 9322 80.637 21.644 122.195 1.00 0.00 O ATOM 46966 H1 WAT 9322 79.700 21.795 122.320 1.00 0.00 H ATOM 46967 H2 WAT 9322 80.821 21.987 121.321 1.00 0.00 H TER 46969 WAT 9322 ATOM 46969 O WAT 9323 65.610 63.981 150.986 1.00 0.00 O ATOM 46970 H1 WAT 9323 64.938 64.467 150.507 1.00 0.00 H ATOM 46971 H2 WAT 9323 65.675 63.145 150.524 1.00 0.00 H TER 46973 WAT 9323 ATOM 46973 O WAT 9324 102.561 145.081 65.524 1.00 0.00 O ATOM 46974 H1 WAT 9324 101.985 145.820 65.720 1.00 0.00 H ATOM 46975 H2 WAT 9324 103.240 145.121 66.197 1.00 0.00 H TER 46977 WAT 9324 ATOM 46977 O WAT 9325 93.871 141.087 97.619 1.00 0.00 O ATOM 46978 H1 WAT 9325 93.597 141.109 98.536 1.00 0.00 H ATOM 46979 H2 WAT 9325 93.991 142.007 97.383 1.00 0.00 H TER 46981 WAT 9325 ATOM 46981 O WAT 9326 89.816 45.473 4.151 1.00 0.00 O ATOM 46982 H1 WAT 9326 90.492 46.036 4.528 1.00 0.00 H ATOM 46983 H2 WAT 9326 89.151 45.406 4.837 1.00 0.00 H TER 46985 WAT 9326 ATOM 46985 O WAT 9327 138.449 46.455 6.980 1.00 0.00 O ATOM 46986 H1 WAT 9327 138.978 47.219 7.210 1.00 0.00 H ATOM 46987 H2 WAT 9327 137.966 46.248 7.780 1.00 0.00 H TER 46989 WAT 9327 ATOM 46989 O WAT 9328 63.822 69.376 129.406 1.00 0.00 O ATOM 46990 H1 WAT 9328 63.911 68.429 129.518 1.00 0.00 H ATOM 46991 H2 WAT 9328 64.672 69.730 129.668 1.00 0.00 H TER 46993 WAT 9328 ATOM 46993 O WAT 9329 33.339 44.071 105.128 1.00 0.00 O ATOM 46994 H1 WAT 9329 33.996 43.747 105.744 1.00 0.00 H ATOM 46995 H2 WAT 9329 33.836 44.286 104.339 1.00 0.00 H TER 46997 WAT 9329 ATOM 46997 O WAT 9330 63.775 0.933 56.744 1.00 0.00 O ATOM 46998 H1 WAT 9330 64.076 1.616 56.144 1.00 0.00 H ATOM 46999 H2 WAT 9330 63.534 1.405 57.541 1.00 0.00 H TER 47001 WAT 9330 ATOM 47001 O WAT 9331 93.361 113.990 98.975 1.00 0.00 O ATOM 47002 H1 WAT 9331 93.735 114.710 99.483 1.00 0.00 H ATOM 47003 H2 WAT 9331 94.073 113.705 98.403 1.00 0.00 H TER 47005 WAT 9331 ATOM 47005 O WAT 9332 62.408 86.310 114.766 1.00 0.00 O ATOM 47006 H1 WAT 9332 62.393 85.455 115.197 1.00 0.00 H ATOM 47007 H2 WAT 9332 61.552 86.380 114.343 1.00 0.00 H TER 47009 WAT 9332 ATOM 47009 O WAT 9333 61.126 95.426 17.271 1.00 0.00 O ATOM 47010 H1 WAT 9333 60.928 95.683 16.370 1.00 0.00 H ATOM 47011 H2 WAT 9333 60.402 95.781 17.786 1.00 0.00 H TER 47013 WAT 9333 ATOM 47013 O WAT 9334 127.637 23.423 84.628 1.00 0.00 O ATOM 47014 H1 WAT 9334 126.959 24.092 84.720 1.00 0.00 H ATOM 47015 H2 WAT 9334 127.164 22.639 84.347 1.00 0.00 H TER 47017 WAT 9334 ATOM 47017 O WAT 9335 125.262 62.561 95.593 1.00 0.00 O ATOM 47018 H1 WAT 9335 125.502 62.549 96.520 1.00 0.00 H ATOM 47019 H2 WAT 9335 124.321 62.385 95.588 1.00 0.00 H TER 47021 WAT 9335 ATOM 47021 O WAT 9336 58.792 132.141 123.735 1.00 0.00 O ATOM 47022 H1 WAT 9336 59.178 131.265 123.750 1.00 0.00 H ATOM 47023 H2 WAT 9336 58.795 132.420 124.651 1.00 0.00 H TER 47025 WAT 9336 ATOM 47025 O WAT 9337 71.233 123.274 95.362 1.00 0.00 O ATOM 47026 H1 WAT 9337 71.766 123.459 94.589 1.00 0.00 H ATOM 47027 H2 WAT 9337 71.650 122.513 95.765 1.00 0.00 H TER 47029 WAT 9337 ATOM 47029 O WAT 9338 84.340 24.294 144.339 1.00 0.00 O ATOM 47030 H1 WAT 9338 84.186 24.815 143.550 1.00 0.00 H ATOM 47031 H2 WAT 9338 84.788 23.509 144.024 1.00 0.00 H TER 47033 WAT 9338 ATOM 47033 O WAT 9339 85.437 87.609 120.185 1.00 0.00 O ATOM 47034 H1 WAT 9339 86.111 88.284 120.102 1.00 0.00 H ATOM 47035 H2 WAT 9339 85.879 86.797 119.936 1.00 0.00 H TER 47037 WAT 9339 ATOM 47037 O WAT 9340 140.361 37.052 104.966 1.00 0.00 O ATOM 47038 H1 WAT 9340 140.329 37.664 105.701 1.00 0.00 H ATOM 47039 H2 WAT 9340 139.511 36.613 104.983 1.00 0.00 H TER 47041 WAT 9340 ATOM 47041 O WAT 9341 60.141 14.439 54.740 1.00 0.00 O ATOM 47042 H1 WAT 9341 59.185 14.414 54.769 1.00 0.00 H ATOM 47043 H2 WAT 9341 60.399 13.533 54.568 1.00 0.00 H TER 47045 WAT 9341 ATOM 47045 O WAT 9342 93.324 96.394 100.576 1.00 0.00 O ATOM 47046 H1 WAT 9342 93.919 95.718 100.900 1.00 0.00 H ATOM 47047 H2 WAT 9342 92.853 95.974 99.857 1.00 0.00 H TER 47049 WAT 9342 ATOM 47049 O WAT 9343 74.745 19.594 70.477 1.00 0.00 O ATOM 47050 H1 WAT 9343 75.314 19.428 69.726 1.00 0.00 H ATOM 47051 H2 WAT 9343 75.205 20.264 70.983 1.00 0.00 H TER 47053 WAT 9343 ATOM 47053 O WAT 9344 101.607 112.130 2.636 1.00 0.00 O ATOM 47054 H1 WAT 9344 101.449 112.470 1.756 1.00 0.00 H ATOM 47055 H2 WAT 9344 100.792 112.298 3.108 1.00 0.00 H TER 47057 WAT 9344 ATOM 47057 O WAT 9345 38.775 80.106 122.683 1.00 0.00 O ATOM 47058 H1 WAT 9345 38.199 80.474 123.354 1.00 0.00 H ATOM 47059 H2 WAT 9345 39.218 80.866 122.305 1.00 0.00 H TER 47061 WAT 9345 ATOM 47061 O WAT 9346 27.878 127.730 116.429 1.00 0.00 O ATOM 47062 H1 WAT 9346 27.165 128.031 115.865 1.00 0.00 H ATOM 47063 H2 WAT 9346 27.667 128.085 117.292 1.00 0.00 H TER 47065 WAT 9346 ATOM 47065 O WAT 9347 34.900 133.125 97.521 1.00 0.00 O ATOM 47066 H1 WAT 9347 35.741 132.685 97.639 1.00 0.00 H ATOM 47067 H2 WAT 9347 34.490 133.096 98.385 1.00 0.00 H TER 47069 WAT 9347 ATOM 47069 O WAT 9348 65.163 111.397 122.529 1.00 0.00 O ATOM 47070 H1 WAT 9348 65.745 111.154 121.809 1.00 0.00 H ATOM 47071 H2 WAT 9348 65.510 110.925 123.286 1.00 0.00 H TER 47073 WAT 9348 ATOM 47073 O WAT 9349 123.474 115.457 125.414 1.00 0.00 O ATOM 47074 H1 WAT 9349 123.074 116.316 125.549 1.00 0.00 H ATOM 47075 H2 WAT 9349 122.979 114.870 125.985 1.00 0.00 H TER 47077 WAT 9349 ATOM 47077 O WAT 9350 110.734 92.019 154.652 1.00 0.00 O ATOM 47078 H1 WAT 9350 110.773 92.817 154.126 1.00 0.00 H ATOM 47079 H2 WAT 9350 111.473 91.494 154.346 1.00 0.00 H TER 47081 WAT 9350 ATOM 47081 O WAT 9351 69.584 111.985 128.758 1.00 0.00 O ATOM 47082 H1 WAT 9351 70.236 112.298 128.130 1.00 0.00 H ATOM 47083 H2 WAT 9351 69.589 111.034 128.654 1.00 0.00 H TER 47085 WAT 9351 ATOM 47085 O WAT 9352 109.867 136.530 94.146 1.00 0.00 O ATOM 47086 H1 WAT 9352 109.269 135.965 93.655 1.00 0.00 H ATOM 47087 H2 WAT 9352 109.318 136.932 94.819 1.00 0.00 H TER 47089 WAT 9352 ATOM 47089 O WAT 9353 14.743 85.017 155.929 1.00 0.00 O ATOM 47090 H1 WAT 9353 14.464 85.180 156.830 1.00 0.00 H ATOM 47091 H2 WAT 9353 15.670 84.790 156.003 1.00 0.00 H TER 47093 WAT 9353 ATOM 47093 O WAT 9354 17.983 41.892 3.634 1.00 0.00 O ATOM 47094 H1 WAT 9354 17.557 42.462 4.274 1.00 0.00 H ATOM 47095 H2 WAT 9354 18.541 42.479 3.125 1.00 0.00 H TER 47097 WAT 9354 ATOM 47097 O WAT 9355 8.922 34.132 90.252 1.00 0.00 O ATOM 47098 H1 WAT 9355 9.540 34.853 90.134 1.00 0.00 H ATOM 47099 H2 WAT 9355 8.957 33.649 89.426 1.00 0.00 H TER 47101 WAT 9355 ATOM 47101 O WAT 9356 12.429 59.604 49.118 1.00 0.00 O ATOM 47102 H1 WAT 9356 12.324 58.797 49.621 1.00 0.00 H ATOM 47103 H2 WAT 9356 11.920 60.256 49.600 1.00 0.00 H TER 47105 WAT 9356 ATOM 47105 O WAT 9357 40.291 77.090 140.046 1.00 0.00 O ATOM 47106 H1 WAT 9357 41.094 77.502 139.726 1.00 0.00 H ATOM 47107 H2 WAT 9357 39.585 77.598 139.645 1.00 0.00 H TER 47109 WAT 9357 ATOM 47109 O WAT 9358 136.317 40.544 126.483 1.00 0.00 O ATOM 47110 H1 WAT 9358 135.677 41.131 126.080 1.00 0.00 H ATOM 47111 H2 WAT 9358 136.489 39.882 125.813 1.00 0.00 H TER 47113 WAT 9358 ATOM 47113 O WAT 9359 94.354 67.128 75.188 1.00 0.00 O ATOM 47114 H1 WAT 9359 94.451 67.378 76.107 1.00 0.00 H ATOM 47115 H2 WAT 9359 93.565 67.586 74.897 1.00 0.00 H TER 47117 WAT 9359 ATOM 47117 O WAT 9360 97.204 20.480 3.853 1.00 0.00 O ATOM 47118 H1 WAT 9360 97.692 19.970 4.500 1.00 0.00 H ATOM 47119 H2 WAT 9360 96.635 21.046 4.374 1.00 0.00 H TER 47121 WAT 9360 ATOM 47121 O WAT 9361 52.461 76.732 94.725 1.00 0.00 O ATOM 47122 H1 WAT 9361 51.987 76.792 93.896 1.00 0.00 H ATOM 47123 H2 WAT 9361 53.129 77.415 94.669 1.00 0.00 H TER 47125 WAT 9361 ATOM 47125 O WAT 9362 72.126 136.180 84.819 1.00 0.00 O ATOM 47126 H1 WAT 9362 71.419 136.311 85.451 1.00 0.00 H ATOM 47127 H2 WAT 9362 71.681 135.924 84.011 1.00 0.00 H TER 47129 WAT 9362 ATOM 47129 O WAT 9363 0.434 85.029 82.407 1.00 0.00 O ATOM 47130 H1 WAT 9363 -0.120 85.517 83.016 1.00 0.00 H ATOM 47131 H2 WAT 9363 0.684 85.671 81.743 1.00 0.00 H TER 47133 WAT 9363 ATOM 47133 O WAT 9364 124.643 101.320 118.082 1.00 0.00 O ATOM 47134 H1 WAT 9364 124.178 100.830 117.404 1.00 0.00 H ATOM 47135 H2 WAT 9364 125.044 102.054 117.616 1.00 0.00 H TER 47137 WAT 9364 ATOM 47137 O WAT 9365 87.765 32.964 143.613 1.00 0.00 O ATOM 47138 H1 WAT 9365 87.057 32.413 143.946 1.00 0.00 H ATOM 47139 H2 WAT 9365 87.324 33.747 143.283 1.00 0.00 H TER 47141 WAT 9365 ATOM 47141 O WAT 9366 138.576 11.971 115.970 1.00 0.00 O ATOM 47142 H1 WAT 9366 138.480 12.921 116.041 1.00 0.00 H ATOM 47143 H2 WAT 9366 137.864 11.701 115.391 1.00 0.00 H TER 47145 WAT 9366 ATOM 47145 O WAT 9367 141.787 121.956 83.779 1.00 0.00 O ATOM 47146 H1 WAT 9367 141.060 122.285 83.251 1.00 0.00 H ATOM 47147 H2 WAT 9367 142.455 121.708 83.139 1.00 0.00 H TER 47149 WAT 9367 ATOM 47149 O WAT 9368 126.643 12.843 14.964 1.00 0.00 O ATOM 47150 H1 WAT 9368 127.444 12.645 14.478 1.00 0.00 H ATOM 47151 H2 WAT 9368 126.358 11.998 15.311 1.00 0.00 H TER 47153 WAT 9368 ATOM 47153 O WAT 9369 142.338 82.309 147.724 1.00 0.00 O ATOM 47154 H1 WAT 9369 141.916 81.455 147.627 1.00 0.00 H ATOM 47155 H2 WAT 9369 141.693 82.843 148.187 1.00 0.00 H TER 47157 WAT 9369 ATOM 47157 O WAT 9370 111.679 124.504 88.398 1.00 0.00 O ATOM 47158 H1 WAT 9370 112.129 123.667 88.510 1.00 0.00 H ATOM 47159 H2 WAT 9370 111.347 124.717 89.270 1.00 0.00 H TER 47161 WAT 9370 ATOM 47161 O WAT 9371 47.457 45.457 128.878 1.00 0.00 O ATOM 47162 H1 WAT 9371 47.091 46.218 128.427 1.00 0.00 H ATOM 47163 H2 WAT 9371 46.758 44.803 128.849 1.00 0.00 H TER 47165 WAT 9371 ATOM 47165 O WAT 9372 50.270 143.604 134.219 1.00 0.00 O ATOM 47166 H1 WAT 9372 51.202 143.388 134.226 1.00 0.00 H ATOM 47167 H2 WAT 9372 49.868 142.948 134.788 1.00 0.00 H TER 47169 WAT 9372 ATOM 47169 O WAT 9373 30.463 139.284 100.700 1.00 0.00 O ATOM 47170 H1 WAT 9373 30.005 139.670 99.954 1.00 0.00 H ATOM 47171 H2 WAT 9373 30.002 139.624 101.467 1.00 0.00 H TER 47173 WAT 9373 ATOM 47173 O WAT 9374 128.951 117.016 111.911 1.00 0.00 O ATOM 47174 H1 WAT 9374 128.467 117.597 112.498 1.00 0.00 H ATOM 47175 H2 WAT 9374 128.320 116.785 111.229 1.00 0.00 H TER 47177 WAT 9374 ATOM 47177 O WAT 9375 9.098 82.081 15.159 1.00 0.00 O ATOM 47178 H1 WAT 9375 8.171 82.162 14.936 1.00 0.00 H ATOM 47179 H2 WAT 9375 9.401 82.984 15.255 1.00 0.00 H TER 47181 WAT 9375 ATOM 47181 O WAT 9376 92.103 86.683 9.221 1.00 0.00 O ATOM 47182 H1 WAT 9376 91.290 87.187 9.193 1.00 0.00 H ATOM 47183 H2 WAT 9376 92.748 87.288 9.586 1.00 0.00 H TER 47185 WAT 9376 ATOM 47185 O WAT 9377 89.438 113.869 16.338 1.00 0.00 O ATOM 47186 H1 WAT 9377 88.905 114.586 15.993 1.00 0.00 H ATOM 47187 H2 WAT 9377 88.839 113.370 16.892 1.00 0.00 H TER 47189 WAT 9377 ATOM 47189 O WAT 9378 120.015 42.756 79.112 1.00 0.00 O ATOM 47190 H1 WAT 9378 119.999 41.802 79.197 1.00 0.00 H ATOM 47191 H2 WAT 9378 119.988 43.077 80.013 1.00 0.00 H TER 47193 WAT 9378 ATOM 47193 O WAT 9379 92.703 126.013 74.822 1.00 0.00 O ATOM 47194 H1 WAT 9379 92.173 126.623 75.335 1.00 0.00 H ATOM 47195 H2 WAT 9379 93.599 126.166 75.121 1.00 0.00 H TER 47197 WAT 9379 ATOM 47197 O WAT 9380 65.264 132.836 116.562 1.00 0.00 O ATOM 47198 H1 WAT 9380 65.097 132.315 117.348 1.00 0.00 H ATOM 47199 H2 WAT 9380 65.731 133.608 116.882 1.00 0.00 H TER 47201 WAT 9380 ATOM 47201 O WAT 9381 16.676 135.278 15.113 1.00 0.00 O ATOM 47202 H1 WAT 9381 17.202 135.809 15.712 1.00 0.00 H ATOM 47203 H2 WAT 9381 16.149 135.915 14.630 1.00 0.00 H TER 47205 WAT 9381 ATOM 47205 O WAT 9382 90.672 82.539 83.423 1.00 0.00 O ATOM 47206 H1 WAT 9382 90.835 83.003 82.602 1.00 0.00 H ATOM 47207 H2 WAT 9382 91.537 82.243 83.706 1.00 0.00 H TER 47209 WAT 9382 ATOM 47209 O WAT 9383 74.982 88.125 125.684 1.00 0.00 O ATOM 47210 H1 WAT 9383 75.520 87.767 126.390 1.00 0.00 H ATOM 47211 H2 WAT 9383 75.435 87.866 124.882 1.00 0.00 H TER 47213 WAT 9383 ATOM 47213 O WAT 9384 98.742 67.332 76.108 1.00 0.00 O ATOM 47214 H1 WAT 9384 98.029 67.556 75.509 1.00 0.00 H ATOM 47215 H2 WAT 9384 99.041 68.175 76.448 1.00 0.00 H TER 47217 WAT 9384 ATOM 47217 O WAT 9385 137.250 48.538 142.647 1.00 0.00 O ATOM 47218 H1 WAT 9385 137.825 49.275 142.853 1.00 0.00 H ATOM 47219 H2 WAT 9385 137.388 48.380 141.713 1.00 0.00 H TER 47221 WAT 9385 ATOM 47221 O WAT 9386 29.501 127.759 108.833 1.00 0.00 O ATOM 47222 H1 WAT 9386 28.746 128.021 108.306 1.00 0.00 H ATOM 47223 H2 WAT 9386 29.840 126.979 108.394 1.00 0.00 H TER 47225 WAT 9386 ATOM 47225 O WAT 9387 34.543 60.892 69.147 1.00 0.00 O ATOM 47226 H1 WAT 9387 35.150 60.154 69.211 1.00 0.00 H ATOM 47227 H2 WAT 9387 34.164 60.968 70.023 1.00 0.00 H TER 47229 WAT 9387 ATOM 47229 O WAT 9388 134.095 116.644 74.857 1.00 0.00 O ATOM 47230 H1 WAT 9388 134.325 116.840 75.765 1.00 0.00 H ATOM 47231 H2 WAT 9388 134.919 116.731 74.377 1.00 0.00 H TER 47233 WAT 9388 ATOM 47233 O WAT 9389 72.184 54.598 110.779 1.00 0.00 O ATOM 47234 H1 WAT 9389 71.911 55.169 111.497 1.00 0.00 H ATOM 47235 H2 WAT 9389 72.389 55.197 110.061 1.00 0.00 H TER 47237 WAT 9389 ATOM 47237 O WAT 9390 46.741 107.667 82.630 1.00 0.00 O ATOM 47238 H1 WAT 9390 47.695 107.717 82.562 1.00 0.00 H ATOM 47239 H2 WAT 9390 46.474 108.543 82.908 1.00 0.00 H TER 47241 WAT 9390 ATOM 47241 O WAT 9391 137.851 111.233 64.194 1.00 0.00 O ATOM 47242 H1 WAT 9391 138.403 110.911 63.481 1.00 0.00 H ATOM 47243 H2 WAT 9391 137.763 112.171 64.024 1.00 0.00 H TER 47245 WAT 9391 ATOM 47245 O WAT 9392 142.557 105.322 150.488 1.00 0.00 O ATOM 47246 H1 WAT 9392 142.597 104.469 150.921 1.00 0.00 H ATOM 47247 H2 WAT 9392 143.457 105.491 150.210 1.00 0.00 H TER 47249 WAT 9392 ATOM 47249 O WAT 9393 130.586 105.481 123.968 1.00 0.00 O ATOM 47250 H1 WAT 9393 130.113 106.313 123.971 1.00 0.00 H ATOM 47251 H2 WAT 9393 131.161 105.536 123.205 1.00 0.00 H TER 47253 WAT 9393 ATOM 47253 O WAT 9394 59.897 87.705 5.217 1.00 0.00 O ATOM 47254 H1 WAT 9394 59.183 87.210 5.619 1.00 0.00 H ATOM 47255 H2 WAT 9394 59.512 88.077 4.423 1.00 0.00 H TER 47257 WAT 9394 ATOM 47257 O WAT 9395 47.560 128.290 86.326 1.00 0.00 O ATOM 47258 H1 WAT 9395 46.762 127.765 86.263 1.00 0.00 H ATOM 47259 H2 WAT 9395 47.896 128.112 87.204 1.00 0.00 H TER 47261 WAT 9395 ATOM 47261 O WAT 9396 58.199 89.304 122.845 1.00 0.00 O ATOM 47262 H1 WAT 9396 57.828 88.801 123.570 1.00 0.00 H ATOM 47263 H2 WAT 9396 59.033 88.873 122.656 1.00 0.00 H TER 47265 WAT 9396 ATOM 47265 O WAT 9397 109.731 110.396 26.666 1.00 0.00 O ATOM 47266 H1 WAT 9397 109.933 110.875 25.861 1.00 0.00 H ATOM 47267 H2 WAT 9397 109.077 110.937 27.108 1.00 0.00 H TER 47269 WAT 9397 ATOM 47269 O WAT 9398 99.821 11.586 121.636 1.00 0.00 O ATOM 47270 H1 WAT 9398 99.742 11.054 120.844 1.00 0.00 H ATOM 47271 H2 WAT 9398 100.764 11.687 121.765 1.00 0.00 H TER 47273 WAT 9398 ATOM 47273 O WAT 9399 42.412 56.863 128.762 1.00 0.00 O ATOM 47274 H1 WAT 9399 42.288 56.057 128.261 1.00 0.00 H ATOM 47275 H2 WAT 9399 42.639 57.521 128.105 1.00 0.00 H TER 47277 WAT 9399 ATOM 47277 O WAT 9400 16.623 129.438 99.071 1.00 0.00 O ATOM 47278 H1 WAT 9400 16.358 128.562 98.787 1.00 0.00 H ATOM 47279 H2 WAT 9400 17.389 129.289 99.624 1.00 0.00 H TER 47281 WAT 9400 ATOM 47281 O WAT 9401 134.906 134.684 3.658 1.00 0.00 O ATOM 47282 H1 WAT 9401 134.756 135.168 2.846 1.00 0.00 H ATOM 47283 H2 WAT 9401 135.838 134.804 3.839 1.00 0.00 H TER 47285 WAT 9401 ATOM 47285 O WAT 9402 51.297 92.935 147.301 1.00 0.00 O ATOM 47286 H1 WAT 9402 50.653 93.640 147.370 1.00 0.00 H ATOM 47287 H2 WAT 9402 52.095 93.367 146.997 1.00 0.00 H TER 47289 WAT 9402 ATOM 47289 O WAT 9403 41.019 101.911 105.591 1.00 0.00 O ATOM 47290 H1 WAT 9403 41.671 102.563 105.850 1.00 0.00 H ATOM 47291 H2 WAT 9403 40.338 102.417 105.147 1.00 0.00 H TER 47293 WAT 9403 ATOM 47293 O WAT 9404 33.961 28.620 10.476 1.00 0.00 O ATOM 47294 H1 WAT 9404 34.674 29.143 10.842 1.00 0.00 H ATOM 47295 H2 WAT 9404 33.165 29.066 10.765 1.00 0.00 H TER 47297 WAT 9404 ATOM 47297 O WAT 9405 124.498 141.539 16.595 1.00 0.00 O ATOM 47298 H1 WAT 9405 124.054 142.379 16.708 1.00 0.00 H ATOM 47299 H2 WAT 9405 124.770 141.291 17.479 1.00 0.00 H TER 47301 WAT 9405 ATOM 47301 O WAT 9406 141.721 71.496 131.241 1.00 0.00 O ATOM 47302 H1 WAT 9406 142.658 71.414 131.419 1.00 0.00 H ATOM 47303 H2 WAT 9406 141.562 70.899 130.511 1.00 0.00 H TER 47305 WAT 9406 ATOM 47305 O WAT 9407 8.414 89.847 113.364 1.00 0.00 O ATOM 47306 H1 WAT 9407 7.568 89.876 113.810 1.00 0.00 H ATOM 47307 H2 WAT 9407 8.573 90.751 113.093 1.00 0.00 H TER 47309 WAT 9407 ATOM 47309 O WAT 9408 122.505 131.484 128.870 1.00 0.00 O ATOM 47310 H1 WAT 9408 122.290 130.729 128.322 1.00 0.00 H ATOM 47311 H2 WAT 9408 123.451 131.421 129.004 1.00 0.00 H TER 47313 WAT 9408 ATOM 47313 O WAT 9409 117.216 46.384 69.000 1.00 0.00 O ATOM 47314 H1 WAT 9409 116.596 47.105 68.896 1.00 0.00 H ATOM 47315 H2 WAT 9409 118.069 46.770 68.801 1.00 0.00 H TER 47317 WAT 9409 ATOM 47317 O WAT 9410 21.182 112.896 154.747 1.00 0.00 O ATOM 47318 H1 WAT 9410 20.621 112.121 154.740 1.00 0.00 H ATOM 47319 H2 WAT 9410 21.778 112.754 155.483 1.00 0.00 H TER 47321 WAT 9410 ATOM 47321 O WAT 9411 54.928 126.935 142.242 1.00 0.00 O ATOM 47322 H1 WAT 9411 55.602 127.297 141.667 1.00 0.00 H ATOM 47323 H2 WAT 9411 54.131 126.944 141.711 1.00 0.00 H TER 47325 WAT 9411 ATOM 47325 O WAT 9412 63.540 114.115 17.073 1.00 0.00 O ATOM 47326 H1 WAT 9412 63.504 114.335 16.142 1.00 0.00 H ATOM 47327 H2 WAT 9412 64.130 113.363 17.119 1.00 0.00 H TER 47329 WAT 9412 ATOM 47329 O WAT 9413 126.712 57.530 16.424 1.00 0.00 O ATOM 47330 H1 WAT 9413 127.468 57.454 15.842 1.00 0.00 H ATOM 47331 H2 WAT 9413 125.955 57.494 15.840 1.00 0.00 H TER 47333 WAT 9413 ATOM 47333 O WAT 9414 5.888 136.778 81.059 1.00 0.00 O ATOM 47334 H1 WAT 9414 5.729 137.716 80.957 1.00 0.00 H ATOM 47335 H2 WAT 9414 5.070 136.364 80.783 1.00 0.00 H TER 47337 WAT 9414 ATOM 47337 O WAT 9415 126.147 104.163 64.198 1.00 0.00 O ATOM 47338 H1 WAT 9415 125.438 103.880 63.621 1.00 0.00 H ATOM 47339 H2 WAT 9415 126.857 104.407 63.603 1.00 0.00 H TER 47341 WAT 9415 ATOM 47341 O WAT 9416 41.540 111.639 91.291 1.00 0.00 O ATOM 47342 H1 WAT 9416 40.838 112.220 91.585 1.00 0.00 H ATOM 47343 H2 WAT 9416 41.278 110.772 91.600 1.00 0.00 H TER 47345 WAT 9416 ATOM 47345 O WAT 9417 129.623 143.788 78.086 1.00 0.00 O ATOM 47346 H1 WAT 9417 129.084 143.280 77.480 1.00 0.00 H ATOM 47347 H2 WAT 9417 130.439 143.942 77.609 1.00 0.00 H TER 47349 WAT 9417 ATOM 47349 O WAT 9418 4.213 142.941 115.177 1.00 0.00 O ATOM 47350 H1 WAT 9418 4.221 142.000 115.003 1.00 0.00 H ATOM 47351 H2 WAT 9418 4.076 143.009 116.122 1.00 0.00 H TER 47353 WAT 9418 ATOM 47353 O WAT 9419 12.379 105.653 114.829 1.00 0.00 O ATOM 47354 H1 WAT 9419 12.484 106.535 114.473 1.00 0.00 H ATOM 47355 H2 WAT 9419 12.291 105.784 115.773 1.00 0.00 H TER 47357 WAT 9419 ATOM 47357 O WAT 9420 43.137 56.076 114.418 1.00 0.00 O ATOM 47358 H1 WAT 9420 44.044 56.136 114.118 1.00 0.00 H ATOM 47359 H2 WAT 9420 43.198 56.102 115.372 1.00 0.00 H TER 47361 WAT 9420 ATOM 47361 O WAT 9421 73.695 61.602 3.580 1.00 0.00 O ATOM 47362 H1 WAT 9421 74.109 62.395 3.920 1.00 0.00 H ATOM 47363 H2 WAT 9421 73.180 61.903 2.831 1.00 0.00 H TER 47365 WAT 9421 ATOM 47365 O WAT 9422 33.494 32.393 20.722 1.00 0.00 O ATOM 47366 H1 WAT 9422 33.690 31.964 21.555 1.00 0.00 H ATOM 47367 H2 WAT 9422 34.229 32.990 20.581 1.00 0.00 H TER 47369 WAT 9422 ATOM 47369 O WAT 9423 79.827 141.980 65.405 1.00 0.00 O ATOM 47370 H1 WAT 9423 80.281 142.276 64.617 1.00 0.00 H ATOM 47371 H2 WAT 9423 80.469 142.092 66.107 1.00 0.00 H TER 47373 WAT 9423 ATOM 47373 O WAT 9424 145.054 124.410 127.491 1.00 0.00 O ATOM 47374 H1 WAT 9424 144.747 125.281 127.742 1.00 0.00 H ATOM 47375 H2 WAT 9424 145.317 124.503 126.576 1.00 0.00 H TER 47377 WAT 9424 ATOM 47377 O WAT 9425 39.976 62.224 77.801 1.00 0.00 O ATOM 47378 H1 WAT 9425 39.923 63.173 77.911 1.00 0.00 H ATOM 47379 H2 WAT 9425 40.861 62.070 77.473 1.00 0.00 H TER 47381 WAT 9425 ATOM 47381 O WAT 9426 23.469 57.420 0.157 1.00 0.00 O ATOM 47382 H1 WAT 9426 22.882 57.616 0.887 1.00 0.00 H ATOM 47383 H2 WAT 9426 24.003 56.689 0.468 1.00 0.00 H TER 47385 WAT 9426 ATOM 47385 O WAT 9427 0.504 100.099 156.612 1.00 0.00 O ATOM 47386 H1 WAT 9427 1.257 100.643 156.843 1.00 0.00 H ATOM 47387 H2 WAT 9427 0.093 100.558 155.879 1.00 0.00 H TER 47389 WAT 9427 ATOM 47389 O WAT 9428 61.475 29.263 142.152 1.00 0.00 O ATOM 47390 H1 WAT 9428 62.367 28.915 142.166 1.00 0.00 H ATOM 47391 H2 WAT 9428 61.106 29.010 142.999 1.00 0.00 H TER 47393 WAT 9428 ATOM 47393 O WAT 9429 129.059 76.389 92.510 1.00 0.00 O ATOM 47394 H1 WAT 9429 128.341 75.875 92.879 1.00 0.00 H ATOM 47395 H2 WAT 9429 128.860 77.291 92.759 1.00 0.00 H TER 47397 WAT 9429 ATOM 47397 O WAT 9430 40.762 72.629 59.758 1.00 0.00 O ATOM 47398 H1 WAT 9430 40.499 72.284 60.612 1.00 0.00 H ATOM 47399 H2 WAT 9430 40.726 73.579 59.863 1.00 0.00 H TER 47401 WAT 9430 ATOM 47401 O WAT 9431 35.979 48.688 143.786 1.00 0.00 O ATOM 47402 H1 WAT 9431 35.273 49.297 143.569 1.00 0.00 H ATOM 47403 H2 WAT 9431 35.559 48.018 144.327 1.00 0.00 H TER 47405 WAT 9431 ATOM 47405 O WAT 9432 89.343 17.748 103.858 1.00 0.00 O ATOM 47406 H1 WAT 9432 88.631 18.188 103.395 1.00 0.00 H ATOM 47407 H2 WAT 9432 90.139 18.147 103.508 1.00 0.00 H TER 47409 WAT 9432 ATOM 47409 O WAT 9433 82.513 25.214 132.372 1.00 0.00 O ATOM 47410 H1 WAT 9433 82.951 25.285 131.524 1.00 0.00 H ATOM 47411 H2 WAT 9433 81.689 25.687 132.256 1.00 0.00 H TER 47413 WAT 9433 ATOM 47413 O WAT 9434 134.840 65.281 115.479 1.00 0.00 O ATOM 47414 H1 WAT 9434 135.412 64.684 114.997 1.00 0.00 H ATOM 47415 H2 WAT 9434 134.710 66.020 114.886 1.00 0.00 H TER 47417 WAT 9434 ATOM 47417 O WAT 9435 124.608 105.255 104.416 1.00 0.00 O ATOM 47418 H1 WAT 9435 123.957 105.228 105.117 1.00 0.00 H ATOM 47419 H2 WAT 9435 124.389 104.511 103.856 1.00 0.00 H TER 47421 WAT 9435 ATOM 47421 O WAT 9436 78.554 59.407 66.773 1.00 0.00 O ATOM 47422 H1 WAT 9436 78.494 60.122 67.408 1.00 0.00 H ATOM 47423 H2 WAT 9436 78.181 59.769 65.969 1.00 0.00 H TER 47425 WAT 9436 ATOM 47425 O WAT 9437 92.207 95.070 132.300 1.00 0.00 O ATOM 47426 H1 WAT 9437 93.109 94.758 132.382 1.00 0.00 H ATOM 47427 H2 WAT 9437 91.893 94.684 131.483 1.00 0.00 H TER 47429 WAT 9437 ATOM 47429 O WAT 9438 23.186 47.331 15.525 1.00 0.00 O ATOM 47430 H1 WAT 9438 22.652 46.555 15.693 1.00 0.00 H ATOM 47431 H2 WAT 9438 22.625 48.067 15.771 1.00 0.00 H TER 47433 WAT 9438 ATOM 47433 O WAT 9439 23.718 76.656 83.251 1.00 0.00 O ATOM 47434 H1 WAT 9439 24.170 76.525 82.418 1.00 0.00 H ATOM 47435 H2 WAT 9439 22.869 77.024 83.008 1.00 0.00 H TER 47437 WAT 9439 ATOM 47437 O WAT 9440 86.219 95.760 78.680 1.00 0.00 O ATOM 47438 H1 WAT 9440 85.789 95.554 79.510 1.00 0.00 H ATOM 47439 H2 WAT 9440 85.499 95.895 78.064 1.00 0.00 H TER 47441 WAT 9440 ATOM 47441 O WAT 9441 54.948 51.765 83.640 1.00 0.00 O ATOM 47442 H1 WAT 9441 54.649 52.193 82.838 1.00 0.00 H ATOM 47443 H2 WAT 9441 54.223 51.194 83.891 1.00 0.00 H TER 47445 WAT 9441 ATOM 47445 O WAT 9442 63.670 1.349 23.089 1.00 0.00 O ATOM 47446 H1 WAT 9442 64.131 2.166 22.901 1.00 0.00 H ATOM 47447 H2 WAT 9442 62.749 1.603 23.156 1.00 0.00 H TER 47449 WAT 9442 ATOM 47449 O WAT 9443 29.284 4.694 65.202 1.00 0.00 O ATOM 47450 H1 WAT 9443 28.833 5.024 65.979 1.00 0.00 H ATOM 47451 H2 WAT 9443 30.049 5.262 65.111 1.00 0.00 H TER 47453 WAT 9443 ATOM 47453 O WAT 9444 132.215 145.473 80.410 1.00 0.00 O ATOM 47454 H1 WAT 9444 132.915 145.974 80.827 1.00 0.00 H ATOM 47455 H2 WAT 9444 131.607 145.272 81.122 1.00 0.00 H TER 47457 WAT 9444 ATOM 47457 O WAT 9445 82.044 114.438 124.029 1.00 0.00 O ATOM 47458 H1 WAT 9445 82.026 115.389 124.136 1.00 0.00 H ATOM 47459 H2 WAT 9445 82.115 114.098 124.921 1.00 0.00 H TER 47461 WAT 9445 ATOM 47461 O WAT 9446 42.599 82.952 98.645 1.00 0.00 O ATOM 47462 H1 WAT 9446 42.515 82.338 97.915 1.00 0.00 H ATOM 47463 H2 WAT 9446 42.855 82.407 99.389 1.00 0.00 H TER 47465 WAT 9446 ATOM 47465 O WAT 9447 81.652 131.951 9.579 1.00 0.00 O ATOM 47466 H1 WAT 9447 81.820 131.023 9.420 1.00 0.00 H ATOM 47467 H2 WAT 9447 80.713 131.998 9.757 1.00 0.00 H TER 47469 WAT 9447 ATOM 47469 O WAT 9448 24.902 127.196 84.319 1.00 0.00 O ATOM 47470 H1 WAT 9448 25.546 126.629 83.895 1.00 0.00 H ATOM 47471 H2 WAT 9448 25.129 127.163 85.248 1.00 0.00 H TER 47473 WAT 9448 ATOM 47473 O WAT 9449 118.405 116.539 91.575 1.00 0.00 O ATOM 47474 H1 WAT 9449 117.946 116.992 90.867 1.00 0.00 H ATOM 47475 H2 WAT 9449 118.300 115.609 91.372 1.00 0.00 H TER 47477 WAT 9449 ATOM 47477 O WAT 9450 117.329 32.621 127.677 1.00 0.00 O ATOM 47478 H1 WAT 9450 117.909 33.098 127.083 1.00 0.00 H ATOM 47479 H2 WAT 9450 117.883 32.401 128.426 1.00 0.00 H TER 47481 WAT 9450 ATOM 47481 O WAT 9451 13.074 89.057 79.020 1.00 0.00 O ATOM 47482 H1 WAT 9451 13.929 89.316 78.675 1.00 0.00 H ATOM 47483 H2 WAT 9451 12.448 89.599 78.539 1.00 0.00 H TER 47485 WAT 9451 ATOM 47485 O WAT 9452 129.652 17.721 158.184 1.00 0.00 O ATOM 47486 H1 WAT 9452 130.008 16.835 158.114 1.00 0.00 H ATOM 47487 H2 WAT 9452 129.058 17.800 157.437 1.00 0.00 H TER 47489 WAT 9452 ATOM 47489 O WAT 9453 134.327 3.944 90.153 1.00 0.00 O ATOM 47490 H1 WAT 9453 134.300 3.071 89.762 1.00 0.00 H ATOM 47491 H2 WAT 9453 134.853 4.463 89.544 1.00 0.00 H TER 47493 WAT 9453 ATOM 47493 O WAT 9454 101.387 50.831 6.393 1.00 0.00 O ATOM 47494 H1 WAT 9454 101.106 50.288 7.130 1.00 0.00 H ATOM 47495 H2 WAT 9454 102.267 51.122 6.632 1.00 0.00 H TER 47497 WAT 9454 ATOM 47497 O WAT 9455 28.238 69.072 102.685 1.00 0.00 O ATOM 47498 H1 WAT 9455 28.286 68.116 102.707 1.00 0.00 H ATOM 47499 H2 WAT 9455 27.725 69.304 103.458 1.00 0.00 H TER 47501 WAT 9455 ATOM 47501 O WAT 9456 145.327 9.482 58.405 1.00 0.00 O ATOM 47502 H1 WAT 9456 145.418 10.372 58.745 1.00 0.00 H ATOM 47503 H2 WAT 9456 145.470 9.569 57.463 1.00 0.00 H TER 47505 WAT 9456 ATOM 47505 O WAT 9457 65.647 51.385 28.524 1.00 0.00 O ATOM 47506 H1 WAT 9457 66.406 51.968 28.491 1.00 0.00 H ATOM 47507 H2 WAT 9457 66.021 50.505 28.541 1.00 0.00 H TER 47509 WAT 9457 ATOM 47509 O WAT 9458 115.082 33.431 133.581 1.00 0.00 O ATOM 47510 H1 WAT 9458 115.397 32.543 133.751 1.00 0.00 H ATOM 47511 H2 WAT 9458 115.441 33.954 134.297 1.00 0.00 H TER 47513 WAT 9458 ATOM 47513 O WAT 9459 90.525 144.755 77.789 1.00 0.00 O ATOM 47514 H1 WAT 9459 91.337 145.228 77.969 1.00 0.00 H ATOM 47515 H2 WAT 9459 90.726 143.843 78.001 1.00 0.00 H TER 47517 WAT 9459 ATOM 47517 O WAT 9460 57.552 140.815 58.727 1.00 0.00 O ATOM 47518 H1 WAT 9460 58.167 140.186 58.349 1.00 0.00 H ATOM 47519 H2 WAT 9460 57.589 140.650 59.669 1.00 0.00 H TER 47521 WAT 9460 ATOM 47521 O WAT 9461 134.035 27.076 122.708 1.00 0.00 O ATOM 47522 H1 WAT 9461 134.233 27.984 122.941 1.00 0.00 H ATOM 47523 H2 WAT 9461 133.087 27.063 122.579 1.00 0.00 H TER 47525 WAT 9461 ATOM 47525 O WAT 9462 13.950 109.270 26.486 1.00 0.00 O ATOM 47526 H1 WAT 9462 14.650 109.561 25.902 1.00 0.00 H ATOM 47527 H2 WAT 9462 14.323 108.523 26.954 1.00 0.00 H TER 47529 WAT 9462 ATOM 47529 O WAT 9463 84.524 90.995 29.249 1.00 0.00 O ATOM 47530 H1 WAT 9463 84.483 91.947 29.339 1.00 0.00 H ATOM 47531 H2 WAT 9463 85.361 90.752 29.645 1.00 0.00 H TER 47533 WAT 9463 ATOM 47533 O WAT 9464 104.350 39.731 138.325 1.00 0.00 O ATOM 47534 H1 WAT 9464 103.569 40.187 138.010 1.00 0.00 H ATOM 47535 H2 WAT 9464 104.399 38.941 137.788 1.00 0.00 H TER 47537 WAT 9464 ATOM 47537 O WAT 9465 50.436 75.452 74.681 1.00 0.00 O ATOM 47538 H1 WAT 9465 50.372 76.369 74.949 1.00 0.00 H ATOM 47539 H2 WAT 9465 51.287 75.388 74.248 1.00 0.00 H TER 47541 WAT 9465 ATOM 47541 O WAT 9466 14.601 80.688 110.560 1.00 0.00 O ATOM 47542 H1 WAT 9466 14.171 80.177 109.874 1.00 0.00 H ATOM 47543 H2 WAT 9466 15.038 81.398 110.090 1.00 0.00 H TER 47545 WAT 9466 ATOM 47545 O WAT 9467 113.507 141.900 3.804 1.00 0.00 O ATOM 47546 H1 WAT 9467 113.518 141.115 4.351 1.00 0.00 H ATOM 47547 H2 WAT 9467 112.798 142.433 4.164 1.00 0.00 H TER 47549 WAT 9467 ATOM 47549 O WAT 9468 121.504 11.391 85.540 1.00 0.00 O ATOM 47550 H1 WAT 9468 121.700 10.709 84.898 1.00 0.00 H ATOM 47551 H2 WAT 9468 120.558 11.521 85.469 1.00 0.00 H TER 47553 WAT 9468 ATOM 47553 O WAT 9469 133.028 91.139 67.761 1.00 0.00 O ATOM 47554 H1 WAT 9469 132.545 91.263 68.578 1.00 0.00 H ATOM 47555 H2 WAT 9469 132.890 91.952 67.275 1.00 0.00 H TER 47557 WAT 9469 ATOM 47557 O WAT 9470 33.134 74.204 84.977 1.00 0.00 O ATOM 47558 H1 WAT 9470 32.885 74.700 84.198 1.00 0.00 H ATOM 47559 H2 WAT 9470 32.886 74.767 85.710 1.00 0.00 H TER 47561 WAT 9470 ATOM 47561 O WAT 9471 7.378 79.799 93.509 1.00 0.00 O ATOM 47562 H1 WAT 9471 8.066 79.414 94.052 1.00 0.00 H ATOM 47563 H2 WAT 9471 6.590 79.305 93.734 1.00 0.00 H TER 47565 WAT 9471 ATOM 47565 O WAT 9472 98.786 40.106 54.480 1.00 0.00 O ATOM 47566 H1 WAT 9472 98.067 40.399 55.040 1.00 0.00 H ATOM 47567 H2 WAT 9472 98.373 39.922 53.637 1.00 0.00 H TER 47569 WAT 9472 ATOM 47569 O WAT 9473 22.937 123.393 89.457 1.00 0.00 O ATOM 47570 H1 WAT 9473 22.520 123.451 90.317 1.00 0.00 H ATOM 47571 H2 WAT 9473 23.673 122.795 89.588 1.00 0.00 H TER 47573 WAT 9473 ATOM 47573 O WAT 9474 107.729 11.954 130.205 1.00 0.00 O ATOM 47574 H1 WAT 9474 106.862 11.966 130.610 1.00 0.00 H ATOM 47575 H2 WAT 9474 107.868 11.038 129.963 1.00 0.00 H TER 47577 WAT 9474 ATOM 47577 O WAT 9475 24.081 59.309 63.379 1.00 0.00 O ATOM 47578 H1 WAT 9475 23.508 59.125 64.123 1.00 0.00 H ATOM 47579 H2 WAT 9475 24.240 58.453 62.982 1.00 0.00 H TER 47581 WAT 9475 ATOM 47581 O WAT 9476 92.113 35.253 78.955 1.00 0.00 O ATOM 47582 H1 WAT 9476 92.836 35.145 78.337 1.00 0.00 H ATOM 47583 H2 WAT 9476 91.326 35.210 78.413 1.00 0.00 H TER 47585 WAT 9476 ATOM 47585 O WAT 9477 135.632 137.771 106.109 1.00 0.00 O ATOM 47586 H1 WAT 9477 136.135 136.968 105.973 1.00 0.00 H ATOM 47587 H2 WAT 9477 134.718 137.498 106.031 1.00 0.00 H TER 47589 WAT 9477 ATOM 47589 O WAT 9478 13.563 3.332 144.136 1.00 0.00 O ATOM 47590 H1 WAT 9478 14.221 3.901 143.737 1.00 0.00 H ATOM 47591 H2 WAT 9478 12.766 3.497 143.631 1.00 0.00 H TER 47593 WAT 9478 ATOM 47593 O WAT 9479 116.367 58.294 4.727 1.00 0.00 O ATOM 47594 H1 WAT 9479 117.055 57.670 4.957 1.00 0.00 H ATOM 47595 H2 WAT 9479 116.745 59.151 4.926 1.00 0.00 H TER 47597 WAT 9479 ATOM 47597 O WAT 9480 67.014 105.408 67.585 1.00 0.00 O ATOM 47598 H1 WAT 9480 67.620 104.751 67.926 1.00 0.00 H ATOM 47599 H2 WAT 9480 67.573 106.032 67.122 1.00 0.00 H TER 47601 WAT 9480 ATOM 47601 O WAT 9481 106.758 92.208 135.092 1.00 0.00 O ATOM 47602 H1 WAT 9481 106.035 92.541 134.561 1.00 0.00 H ATOM 47603 H2 WAT 9481 107.514 92.731 134.822 1.00 0.00 H TER 47605 WAT 9481 ATOM 47605 O WAT 9482 11.477 62.357 72.274 1.00 0.00 O ATOM 47606 H1 WAT 9482 11.130 63.225 72.072 1.00 0.00 H ATOM 47607 H2 WAT 9482 11.277 62.229 73.202 1.00 0.00 H TER 47609 WAT 9482 ATOM 47609 O WAT 9483 109.573 83.980 90.449 1.00 0.00 O ATOM 47610 H1 WAT 9483 108.992 83.437 90.982 1.00 0.00 H ATOM 47611 H2 WAT 9483 108.983 84.536 89.941 1.00 0.00 H TER 47613 WAT 9483 ATOM 47613 O WAT 9484 100.201 145.875 155.804 1.00 0.00 O ATOM 47614 H1 WAT 9484 100.882 145.522 156.377 1.00 0.00 H ATOM 47615 H2 WAT 9484 99.553 145.174 155.742 1.00 0.00 H TER 47617 WAT 9484 ATOM 47617 O WAT 9485 18.961 142.118 77.182 1.00 0.00 O ATOM 47618 H1 WAT 9485 18.384 141.812 77.882 1.00 0.00 H ATOM 47619 H2 WAT 9485 18.736 143.043 77.074 1.00 0.00 H TER 47621 WAT 9485 ATOM 47621 O WAT 9486 67.219 17.271 52.821 1.00 0.00 O ATOM 47622 H1 WAT 9486 67.681 17.908 52.276 1.00 0.00 H ATOM 47623 H2 WAT 9486 66.974 17.760 53.606 1.00 0.00 H TER 47625 WAT 9486 ATOM 47625 O WAT 9487 96.848 27.516 88.806 1.00 0.00 O ATOM 47626 H1 WAT 9487 96.651 26.587 88.684 1.00 0.00 H ATOM 47627 H2 WAT 9487 97.543 27.698 88.174 1.00 0.00 H TER 47629 WAT 9487 ATOM 47629 O WAT 9488 107.489 73.117 101.851 1.00 0.00 O ATOM 47630 H1 WAT 9488 108.203 73.279 102.467 1.00 0.00 H ATOM 47631 H2 WAT 9488 106.730 73.547 102.245 1.00 0.00 H TER 47633 WAT 9488 ATOM 47633 O WAT 9489 95.826 141.572 9.597 1.00 0.00 O ATOM 47634 H1 WAT 9489 96.162 141.540 10.492 1.00 0.00 H ATOM 47635 H2 WAT 9489 95.673 140.656 9.365 1.00 0.00 H TER 47637 WAT 9489 ATOM 47637 O WAT 9490 58.472 29.586 73.043 1.00 0.00 O ATOM 47638 H1 WAT 9490 57.673 29.796 73.526 1.00 0.00 H ATOM 47639 H2 WAT 9490 58.944 28.978 73.612 1.00 0.00 H TER 47641 WAT 9490 ATOM 47641 O WAT 9491 90.208 89.821 126.400 1.00 0.00 O ATOM 47642 H1 WAT 9491 89.666 90.258 127.057 1.00 0.00 H ATOM 47643 H2 WAT 9491 90.935 89.448 126.899 1.00 0.00 H TER 47645 WAT 9491 ATOM 47645 O WAT 9492 129.938 41.310 133.675 1.00 0.00 O ATOM 47646 H1 WAT 9492 130.185 41.347 132.751 1.00 0.00 H ATOM 47647 H2 WAT 9492 130.744 41.517 134.147 1.00 0.00 H TER 47649 WAT 9492 ATOM 47649 O WAT 9493 29.538 37.296 158.653 1.00 0.00 O ATOM 47650 H1 WAT 9493 29.021 36.774 158.039 1.00 0.00 H ATOM 47651 H2 WAT 9493 30.381 37.415 158.215 1.00 0.00 H TER 47653 WAT 9493 ATOM 47653 O WAT 9494 44.409 95.812 75.070 1.00 0.00 O ATOM 47654 H1 WAT 9494 44.106 95.843 74.162 1.00 0.00 H ATOM 47655 H2 WAT 9494 44.708 96.703 75.253 1.00 0.00 H TER 47657 WAT 9494 ATOM 47657 O WAT 9495 70.688 122.533 128.974 1.00 0.00 O ATOM 47658 H1 WAT 9495 70.376 123.431 129.088 1.00 0.00 H ATOM 47659 H2 WAT 9495 69.950 122.072 128.575 1.00 0.00 H TER 47661 WAT 9495 ATOM 47661 O WAT 9496 74.230 43.104 20.867 1.00 0.00 O ATOM 47662 H1 WAT 9496 74.170 43.256 21.810 1.00 0.00 H ATOM 47663 H2 WAT 9496 74.526 43.941 20.509 1.00 0.00 H TER 47665 WAT 9496 ATOM 47665 O WAT 9497 97.376 131.209 0.741 1.00 0.00 O ATOM 47666 H1 WAT 9497 97.644 131.821 0.055 1.00 0.00 H ATOM 47667 H2 WAT 9497 96.419 131.226 0.716 1.00 0.00 H TER 47669 WAT 9497 ATOM 47669 O WAT 9498 107.237 108.603 96.447 1.00 0.00 O ATOM 47670 H1 WAT 9498 106.375 108.623 96.033 1.00 0.00 H ATOM 47671 H2 WAT 9498 107.193 109.276 97.126 1.00 0.00 H TER 47673 WAT 9498 ATOM 47673 O WAT 9499 8.841 102.302 124.056 1.00 0.00 O ATOM 47674 H1 WAT 9499 8.733 102.072 123.133 1.00 0.00 H ATOM 47675 H2 WAT 9499 8.379 103.135 124.150 1.00 0.00 H TER 47677 WAT 9499 ATOM 47677 O WAT 9500 112.291 66.349 155.109 1.00 0.00 O ATOM 47678 H1 WAT 9500 112.324 66.292 154.154 1.00 0.00 H ATOM 47679 H2 WAT 9500 112.570 67.243 155.306 1.00 0.00 H TER 47681 WAT 9500 ATOM 47681 O WAT 9501 18.792 11.569 77.172 1.00 0.00 O ATOM 47682 H1 WAT 9501 19.403 10.835 77.246 1.00 0.00 H ATOM 47683 H2 WAT 9501 19.211 12.280 77.657 1.00 0.00 H TER 47685 WAT 9501 ATOM 47685 O WAT 9502 8.004 2.627 148.291 1.00 0.00 O ATOM 47686 H1 WAT 9502 7.893 3.166 147.508 1.00 0.00 H ATOM 47687 H2 WAT 9502 7.336 1.947 148.210 1.00 0.00 H TER 47689 WAT 9502 ATOM 47689 O WAT 9503 90.813 90.857 3.101 1.00 0.00 O ATOM 47690 H1 WAT 9503 91.355 91.276 2.433 1.00 0.00 H ATOM 47691 H2 WAT 9503 91.433 90.594 3.782 1.00 0.00 H TER 47693 WAT 9503 ATOM 47693 O WAT 9504 20.677 114.380 84.314 1.00 0.00 O ATOM 47694 H1 WAT 9504 19.875 114.044 83.913 1.00 0.00 H ATOM 47695 H2 WAT 9504 20.562 115.330 84.319 1.00 0.00 H TER 47697 WAT 9504 ATOM 47697 O WAT 9505 109.208 41.270 63.667 1.00 0.00 O ATOM 47698 H1 WAT 9505 109.393 41.469 62.750 1.00 0.00 H ATOM 47699 H2 WAT 9505 108.671 40.478 63.637 1.00 0.00 H TER 47701 WAT 9505 ATOM 47701 O WAT 9506 54.270 21.566 142.221 1.00 0.00 O ATOM 47702 H1 WAT 9506 53.568 20.915 142.219 1.00 0.00 H ATOM 47703 H2 WAT 9506 53.879 22.340 141.815 1.00 0.00 H TER 47705 WAT 9506 ATOM 47705 O WAT 9507 78.082 135.303 55.053 1.00 0.00 O ATOM 47706 H1 WAT 9507 77.346 135.843 54.768 1.00 0.00 H ATOM 47707 H2 WAT 9507 77.853 134.417 54.772 1.00 0.00 H TER 47709 WAT 9507 ATOM 47709 O WAT 9508 57.713 15.185 10.923 1.00 0.00 O ATOM 47710 H1 WAT 9508 58.080 15.958 11.352 1.00 0.00 H ATOM 47711 H2 WAT 9508 58.283 14.466 11.195 1.00 0.00 H TER 47713 WAT 9508 ATOM 47713 O WAT 9509 144.822 29.018 158.523 1.00 0.00 O ATOM 47714 H1 WAT 9509 145.103 29.058 159.438 1.00 0.00 H ATOM 47715 H2 WAT 9509 145.315 29.715 158.091 1.00 0.00 H TER 47717 WAT 9509 ATOM 47717 O WAT 9510 48.007 81.166 109.224 1.00 0.00 O ATOM 47718 H1 WAT 9510 48.099 81.383 108.296 1.00 0.00 H ATOM 47719 H2 WAT 9510 48.720 81.641 109.652 1.00 0.00 H TER 47721 WAT 9510 ATOM 47721 O WAT 9511 38.655 14.883 119.761 1.00 0.00 O ATOM 47722 H1 WAT 9511 39.034 14.336 120.449 1.00 0.00 H ATOM 47723 H2 WAT 9511 37.712 14.734 119.828 1.00 0.00 H TER 47725 WAT 9511 ATOM 47725 O WAT 9512 125.003 57.315 155.797 1.00 0.00 O ATOM 47726 H1 WAT 9512 125.653 57.815 155.303 1.00 0.00 H ATOM 47727 H2 WAT 9512 124.398 57.977 156.133 1.00 0.00 H TER 47729 WAT 9512 ATOM 47729 O WAT 9513 88.960 33.407 133.699 1.00 0.00 O ATOM 47730 H1 WAT 9513 89.117 32.609 133.195 1.00 0.00 H ATOM 47731 H2 WAT 9513 89.623 33.389 134.390 1.00 0.00 H TER 47733 WAT 9513 ATOM 47733 O WAT 9514 115.155 133.030 79.780 1.00 0.00 O ATOM 47734 H1 WAT 9514 115.938 132.580 79.462 1.00 0.00 H ATOM 47735 H2 WAT 9514 115.046 132.716 80.677 1.00 0.00 H TER 47737 WAT 9514 ATOM 47737 O WAT 9515 67.754 55.379 124.141 1.00 0.00 O ATOM 47738 H1 WAT 9515 66.906 55.191 123.739 1.00 0.00 H ATOM 47739 H2 WAT 9515 67.810 56.334 124.146 1.00 0.00 H TER 47741 WAT 9515 ATOM 47741 O WAT 9516 79.854 143.805 94.587 1.00 0.00 O ATOM 47742 H1 WAT 9516 79.651 144.629 95.031 1.00 0.00 H ATOM 47743 H2 WAT 9516 80.366 143.309 95.226 1.00 0.00 H TER 47745 WAT 9516 ATOM 47745 O WAT 9517 25.645 125.775 9.037 1.00 0.00 O ATOM 47746 H1 WAT 9517 25.325 124.926 9.342 1.00 0.00 H ATOM 47747 H2 WAT 9517 26.405 125.564 8.495 1.00 0.00 H TER 47749 WAT 9517 ATOM 47749 O WAT 9518 82.536 17.412 90.538 1.00 0.00 O ATOM 47750 H1 WAT 9518 81.756 16.875 90.400 1.00 0.00 H ATOM 47751 H2 WAT 9518 82.340 17.924 91.322 1.00 0.00 H TER 47753 WAT 9518 ATOM 47753 O WAT 9519 29.624 21.968 18.978 1.00 0.00 O ATOM 47754 H1 WAT 9519 29.771 22.000 19.924 1.00 0.00 H ATOM 47755 H2 WAT 9519 30.503 21.991 18.598 1.00 0.00 H TER 47757 WAT 9519 ATOM 47757 O WAT 9520 1.131 145.008 155.372 1.00 0.00 O ATOM 47758 H1 WAT 9520 1.179 145.684 154.696 1.00 0.00 H ATOM 47759 H2 WAT 9520 0.902 145.483 156.171 1.00 0.00 H TER 47761 WAT 9520 ATOM 47761 O WAT 9521 20.971 125.834 155.558 1.00 0.00 O ATOM 47762 H1 WAT 9521 20.438 126.099 154.808 1.00 0.00 H ATOM 47763 H2 WAT 9521 21.526 126.593 155.738 1.00 0.00 H TER 47765 WAT 9521 ATOM 47765 O WAT 9522 21.516 39.041 123.317 1.00 0.00 O ATOM 47766 H1 WAT 9522 20.788 39.658 123.394 1.00 0.00 H ATOM 47767 H2 WAT 9522 21.827 39.149 122.418 1.00 0.00 H TER 47769 WAT 9522 ATOM 47769 O WAT 9523 33.362 126.903 8.314 1.00 0.00 O ATOM 47770 H1 WAT 9523 32.964 127.767 8.419 1.00 0.00 H ATOM 47771 H2 WAT 9523 33.375 126.758 7.368 1.00 0.00 H TER 47773 WAT 9523 ATOM 47773 O WAT 9524 103.545 110.936 145.688 1.00 0.00 O ATOM 47774 H1 WAT 9524 103.624 111.816 146.057 1.00 0.00 H ATOM 47775 H2 WAT 9524 102.635 110.688 145.851 1.00 0.00 H TER 47777 WAT 9524 ATOM 47777 O WAT 9525 98.863 111.015 133.249 1.00 0.00 O ATOM 47778 H1 WAT 9525 99.548 111.553 133.646 1.00 0.00 H ATOM 47779 H2 WAT 9525 99.082 110.120 133.507 1.00 0.00 H TER 47781 WAT 9525 ATOM 47781 O WAT 9526 137.679 111.801 155.096 1.00 0.00 O ATOM 47782 H1 WAT 9526 137.681 111.665 156.043 1.00 0.00 H ATOM 47783 H2 WAT 9526 137.240 112.643 154.975 1.00 0.00 H TER 47785 WAT 9526 ATOM 47785 O WAT 9527 31.482 103.123 103.540 1.00 0.00 O ATOM 47786 H1 WAT 9527 32.034 102.351 103.414 1.00 0.00 H ATOM 47787 H2 WAT 9527 31.929 103.818 103.057 1.00 0.00 H TER 47789 WAT 9527 ATOM 47789 O WAT 9528 51.894 9.825 57.525 1.00 0.00 O ATOM 47790 H1 WAT 9528 51.623 9.982 56.621 1.00 0.00 H ATOM 47791 H2 WAT 9528 52.209 10.675 57.832 1.00 0.00 H TER 47793 WAT 9528 ATOM 47793 O WAT 9529 94.803 4.265 137.873 1.00 0.00 O ATOM 47794 H1 WAT 9529 94.471 4.543 137.019 1.00 0.00 H ATOM 47795 H2 WAT 9529 95.719 4.038 137.711 1.00 0.00 H TER 47797 WAT 9529 ATOM 47797 O WAT 9530 97.849 113.129 6.330 1.00 0.00 O ATOM 47798 H1 WAT 9530 96.958 113.468 6.416 1.00 0.00 H ATOM 47799 H2 WAT 9530 98.314 113.484 7.087 1.00 0.00 H TER 47801 WAT 9530 ATOM 47801 O WAT 9531 81.928 56.715 124.242 1.00 0.00 O ATOM 47802 H1 WAT 9531 81.976 57.467 124.831 1.00 0.00 H ATOM 47803 H2 WAT 9531 82.198 57.060 123.390 1.00 0.00 H TER 47805 WAT 9531 ATOM 47805 O WAT 9532 114.484 51.190 18.920 1.00 0.00 O ATOM 47806 H1 WAT 9532 115.356 50.828 19.074 1.00 0.00 H ATOM 47807 H2 WAT 9532 113.886 50.473 19.132 1.00 0.00 H TER 47809 WAT 9532 ATOM 47809 O WAT 9533 65.449 20.252 49.261 1.00 0.00 O ATOM 47810 H1 WAT 9533 66.162 20.671 49.744 1.00 0.00 H ATOM 47811 H2 WAT 9533 65.468 19.339 49.551 1.00 0.00 H TER 47813 WAT 9533 ATOM 47813 O WAT 9534 110.625 66.053 124.462 1.00 0.00 O ATOM 47814 H1 WAT 9534 109.756 65.996 124.861 1.00 0.00 H ATOM 47815 H2 WAT 9534 110.656 65.316 123.852 1.00 0.00 H TER 47817 WAT 9534 ATOM 47817 O WAT 9535 112.501 140.184 140.852 1.00 0.00 O ATOM 47818 H1 WAT 9535 112.804 141.083 140.717 1.00 0.00 H ATOM 47819 H2 WAT 9535 113.001 139.874 141.607 1.00 0.00 H TER 47821 WAT 9535 ATOM 47821 O WAT 9536 25.039 131.451 53.827 1.00 0.00 O ATOM 47822 H1 WAT 9536 25.670 130.896 54.284 1.00 0.00 H ATOM 47823 H2 WAT 9536 25.061 131.143 52.921 1.00 0.00 H TER 47825 WAT 9536 ATOM 47825 O WAT 9537 114.880 30.809 75.821 1.00 0.00 O ATOM 47826 H1 WAT 9537 115.576 31.431 76.033 1.00 0.00 H ATOM 47827 H2 WAT 9537 114.128 31.358 75.597 1.00 0.00 H TER 47829 WAT 9537 ATOM 47829 O WAT 9538 116.779 141.823 18.894 1.00 0.00 O ATOM 47830 H1 WAT 9538 116.721 142.055 17.967 1.00 0.00 H ATOM 47831 H2 WAT 9538 116.077 142.323 19.311 1.00 0.00 H TER 47833 WAT 9538 ATOM 47833 O WAT 9539 84.247 42.738 124.618 1.00 0.00 O ATOM 47834 H1 WAT 9539 84.770 43.205 123.966 1.00 0.00 H ATOM 47835 H2 WAT 9539 83.927 41.963 124.157 1.00 0.00 H TER 47837 WAT 9539 ATOM 47837 O WAT 9540 12.077 48.305 151.351 1.00 0.00 O ATOM 47838 H1 WAT 9540 11.205 48.256 150.959 1.00 0.00 H ATOM 47839 H2 WAT 9540 12.677 48.258 150.607 1.00 0.00 H TER 47841 WAT 9540 ATOM 47841 O WAT 9541 107.812 123.126 10.762 1.00 0.00 O ATOM 47842 H1 WAT 9541 107.126 122.989 11.415 1.00 0.00 H ATOM 47843 H2 WAT 9541 108.260 122.282 10.704 1.00 0.00 H TER 47845 WAT 9541 ATOM 47845 O WAT 9542 106.077 128.352 64.111 1.00 0.00 O ATOM 47846 H1 WAT 9542 107.018 128.243 63.971 1.00 0.00 H ATOM 47847 H2 WAT 9542 105.928 129.292 64.013 1.00 0.00 H TER 47849 WAT 9542 ATOM 47849 O WAT 9543 19.103 23.434 0.386 1.00 0.00 O ATOM 47850 H1 WAT 9543 18.389 23.885 0.836 1.00 0.00 H ATOM 47851 H2 WAT 9543 19.221 22.621 0.878 1.00 0.00 H TER 47853 WAT 9543 ATOM 47853 O WAT 9544 75.361 144.149 79.369 1.00 0.00 O ATOM 47854 H1 WAT 9544 74.678 144.477 78.784 1.00 0.00 H ATOM 47855 H2 WAT 9544 75.046 143.289 79.647 1.00 0.00 H TER 47857 WAT 9544 ATOM 47857 O WAT 9545 10.866 52.828 108.995 1.00 0.00 O ATOM 47858 H1 WAT 9545 11.223 53.126 109.832 1.00 0.00 H ATOM 47859 H2 WAT 9545 11.426 53.239 108.336 1.00 0.00 H TER 47861 WAT 9545 ATOM 47861 O WAT 9546 143.137 15.226 132.733 1.00 0.00 O ATOM 47862 H1 WAT 9546 142.363 15.698 133.041 1.00 0.00 H ATOM 47863 H2 WAT 9546 143.870 15.806 132.942 1.00 0.00 H TER 47865 WAT 9546 ATOM 47865 O WAT 9547 24.066 139.797 85.902 1.00 0.00 O ATOM 47866 H1 WAT 9547 23.441 140.289 85.370 1.00 0.00 H ATOM 47867 H2 WAT 9547 24.740 139.517 85.282 1.00 0.00 H TER 47869 WAT 9547 ATOM 47869 O WAT 9548 23.017 145.745 71.211 1.00 0.00 O ATOM 47870 H1 WAT 9548 23.777 145.178 71.078 1.00 0.00 H ATOM 47871 H2 WAT 9548 23.367 146.633 71.148 1.00 0.00 H TER 47873 WAT 9548 ATOM 47873 O WAT 9549 16.700 64.953 68.360 1.00 0.00 O ATOM 47874 H1 WAT 9549 17.102 64.308 68.943 1.00 0.00 H ATOM 47875 H2 WAT 9549 15.786 64.991 68.639 1.00 0.00 H TER 47877 WAT 9549 ATOM 47877 O WAT 9550 46.833 32.860 70.493 1.00 0.00 O ATOM 47878 H1 WAT 9550 46.546 32.847 69.580 1.00 0.00 H ATOM 47879 H2 WAT 9550 47.575 32.256 70.520 1.00 0.00 H TER 47881 WAT 9550 ATOM 47881 O WAT 9551 42.657 144.858 132.254 1.00 0.00 O ATOM 47882 H1 WAT 9551 43.378 145.267 131.775 1.00 0.00 H ATOM 47883 H2 WAT 9551 43.038 144.062 132.626 1.00 0.00 H TER 47885 WAT 9551 ATOM 47885 O WAT 9552 104.200 0.487 158.513 1.00 0.00 O ATOM 47886 H1 WAT 9552 104.260 0.816 157.616 1.00 0.00 H ATOM 47887 H2 WAT 9552 104.740 -0.303 158.515 1.00 0.00 H TER 47889 WAT 9552 ATOM 47889 O WAT 9553 6.929 41.037 136.414 1.00 0.00 O ATOM 47890 H1 WAT 9553 6.354 41.230 135.674 1.00 0.00 H ATOM 47891 H2 WAT 9553 6.332 40.858 137.141 1.00 0.00 H TER 47893 WAT 9553 ATOM 47893 O WAT 9554 87.503 31.863 99.787 1.00 0.00 O ATOM 47894 H1 WAT 9554 87.703 32.102 98.882 1.00 0.00 H ATOM 47895 H2 WAT 9554 88.115 31.155 99.989 1.00 0.00 H TER 47897 WAT 9554 ATOM 47897 O WAT 9555 84.429 56.253 81.590 1.00 0.00 O ATOM 47898 H1 WAT 9555 83.892 56.374 80.806 1.00 0.00 H ATOM 47899 H2 WAT 9555 85.027 57.000 81.587 1.00 0.00 H TER 47901 WAT 9555 ATOM 47901 O WAT 9556 119.879 57.840 153.422 1.00 0.00 O ATOM 47902 H1 WAT 9556 119.621 57.599 154.311 1.00 0.00 H ATOM 47903 H2 WAT 9556 119.719 57.052 152.904 1.00 0.00 H TER 47905 WAT 9556 ATOM 47905 O WAT 9557 77.910 64.106 125.599 1.00 0.00 O ATOM 47906 H1 WAT 9557 78.863 64.067 125.518 1.00 0.00 H ATOM 47907 H2 WAT 9557 77.730 63.770 126.477 1.00 0.00 H TER 47909 WAT 9557 ATOM 47909 O WAT 9558 108.675 29.449 60.882 1.00 0.00 O ATOM 47910 H1 WAT 9558 108.822 30.083 60.180 1.00 0.00 H ATOM 47911 H2 WAT 9558 109.220 28.698 60.644 1.00 0.00 H TER 47913 WAT 9558 ATOM 47913 O WAT 9559 87.383 104.076 79.498 1.00 0.00 O ATOM 47914 H1 WAT 9559 87.326 105.013 79.311 1.00 0.00 H ATOM 47915 H2 WAT 9559 86.799 103.945 80.245 1.00 0.00 H TER 47917 WAT 9559 ATOM 47917 O WAT 9560 34.599 36.150 80.489 1.00 0.00 O ATOM 47918 H1 WAT 9560 34.927 35.542 79.827 1.00 0.00 H ATOM 47919 H2 WAT 9560 33.892 35.672 80.924 1.00 0.00 H TER 47921 WAT 9560 ATOM 47921 O WAT 9561 76.602 63.612 137.355 1.00 0.00 O ATOM 47922 H1 WAT 9561 77.496 63.417 137.074 1.00 0.00 H ATOM 47923 H2 WAT 9561 76.558 64.568 137.372 1.00 0.00 H TER 47925 WAT 9561 ATOM 47925 O WAT 9562 128.734 35.031 135.481 1.00 0.00 O ATOM 47926 H1 WAT 9562 128.364 34.349 136.041 1.00 0.00 H ATOM 47927 H2 WAT 9562 128.924 35.755 136.079 1.00 0.00 H TER 47929 WAT 9562 ATOM 47929 O WAT 9563 41.186 5.211 84.064 1.00 0.00 O ATOM 47930 H1 WAT 9563 42.126 5.047 83.987 1.00 0.00 H ATOM 47931 H2 WAT 9563 41.062 6.075 83.672 1.00 0.00 H TER 47933 WAT 9563 ATOM 47933 O WAT 9564 64.888 96.045 86.329 1.00 0.00 O ATOM 47934 H1 WAT 9564 65.639 96.485 86.729 1.00 0.00 H ATOM 47935 H2 WAT 9564 65.214 95.733 85.486 1.00 0.00 H TER 47937 WAT 9564 ATOM 47937 O WAT 9565 89.141 1.115 124.014 1.00 0.00 O ATOM 47938 H1 WAT 9565 89.431 0.294 123.618 1.00 0.00 H ATOM 47939 H2 WAT 9565 88.323 1.323 123.563 1.00 0.00 H TER 47941 WAT 9565 ATOM 47941 O WAT 9566 92.650 30.287 138.610 1.00 0.00 O ATOM 47942 H1 WAT 9566 92.462 29.528 138.058 1.00 0.00 H ATOM 47943 H2 WAT 9566 92.527 29.969 139.505 1.00 0.00 H TER 47945 WAT 9566 ATOM 47945 O WAT 9567 13.011 143.782 76.825 1.00 0.00 O ATOM 47946 H1 WAT 9567 12.866 143.281 77.627 1.00 0.00 H ATOM 47947 H2 WAT 9567 12.211 144.297 76.715 1.00 0.00 H TER 47949 WAT 9567 ATOM 47949 O WAT 9568 36.526 5.359 123.353 1.00 0.00 O ATOM 47950 H1 WAT 9568 36.015 4.587 123.594 1.00 0.00 H ATOM 47951 H2 WAT 9568 37.358 5.007 123.037 1.00 0.00 H TER 47953 WAT 9568 ATOM 47953 O WAT 9569 80.326 97.944 69.130 1.00 0.00 O ATOM 47954 H1 WAT 9569 80.780 98.117 68.305 1.00 0.00 H ATOM 47955 H2 WAT 9569 81.018 97.670 69.731 1.00 0.00 H TER 47957 WAT 9569 ATOM 47957 O WAT 9570 119.799 88.622 145.490 1.00 0.00 O ATOM 47958 H1 WAT 9570 120.663 88.890 145.177 1.00 0.00 H ATOM 47959 H2 WAT 9570 119.972 88.178 146.320 1.00 0.00 H TER 47961 WAT 9570 ATOM 47961 O WAT 9571 127.604 65.061 132.532 1.00 0.00 O ATOM 47962 H1 WAT 9571 127.914 64.261 132.956 1.00 0.00 H ATOM 47963 H2 WAT 9571 128.124 65.760 132.930 1.00 0.00 H TER 47965 WAT 9571 ATOM 47965 O WAT 9572 33.734 14.981 118.383 1.00 0.00 O ATOM 47966 H1 WAT 9572 34.222 14.703 119.158 1.00 0.00 H ATOM 47967 H2 WAT 9572 32.993 14.377 118.337 1.00 0.00 H TER 47969 WAT 9572 ATOM 47969 O WAT 9573 66.581 81.641 150.851 1.00 0.00 O ATOM 47970 H1 WAT 9573 66.762 81.044 150.126 1.00 0.00 H ATOM 47971 H2 WAT 9573 67.212 81.394 151.528 1.00 0.00 H TER 47973 WAT 9573 ATOM 47973 O WAT 9574 130.656 31.634 109.689 1.00 0.00 O ATOM 47974 H1 WAT 9574 131.142 31.329 110.455 1.00 0.00 H ATOM 47975 H2 WAT 9574 129.801 31.891 110.034 1.00 0.00 H TER 47977 WAT 9574 ATOM 47977 O WAT 9575 134.757 79.755 72.608 1.00 0.00 O ATOM 47978 H1 WAT 9575 135.511 80.266 72.313 1.00 0.00 H ATOM 47979 H2 WAT 9575 134.091 79.903 71.936 1.00 0.00 H TER 47981 WAT 9575 ATOM 47981 O WAT 9576 20.556 56.221 149.965 1.00 0.00 O ATOM 47982 H1 WAT 9576 21.477 56.357 149.738 1.00 0.00 H ATOM 47983 H2 WAT 9576 20.071 56.584 149.224 1.00 0.00 H TER 47985 WAT 9576 ATOM 47985 O WAT 9577 35.929 94.634 112.785 1.00 0.00 O ATOM 47986 H1 WAT 9577 35.793 95.576 112.690 1.00 0.00 H ATOM 47987 H2 WAT 9577 36.337 94.536 113.646 1.00 0.00 H TER 47989 WAT 9577 ATOM 47989 O WAT 9578 56.824 90.560 2.640 1.00 0.00 O ATOM 47990 H1 WAT 9578 56.422 90.414 3.496 1.00 0.00 H ATOM 47991 H2 WAT 9578 57.697 90.899 2.840 1.00 0.00 H TER 47993 WAT 9578 ATOM 47993 O WAT 9579 58.054 18.979 127.203 1.00 0.00 O ATOM 47994 H1 WAT 9579 57.810 19.902 127.258 1.00 0.00 H ATOM 47995 H2 WAT 9579 58.224 18.722 128.109 1.00 0.00 H TER 47997 WAT 9579 ATOM 47997 O WAT 9580 39.356 37.257 22.481 1.00 0.00 O ATOM 47998 H1 WAT 9580 39.884 37.214 21.683 1.00 0.00 H ATOM 47999 H2 WAT 9580 38.888 36.422 22.503 1.00 0.00 H TER 48001 WAT 9580 ATOM 48001 O WAT 9581 70.519 37.324 158.457 1.00 0.00 O ATOM 48002 H1 WAT 9581 70.549 37.500 159.398 1.00 0.00 H ATOM 48003 H2 WAT 9581 70.925 36.462 158.361 1.00 0.00 H TER 48005 WAT 9581 ATOM 48005 O WAT 9582 82.197 83.877 111.000 1.00 0.00 O ATOM 48006 H1 WAT 9582 82.505 82.980 111.130 1.00 0.00 H ATOM 48007 H2 WAT 9582 82.082 84.221 111.886 1.00 0.00 H TER 48009 WAT 9582 ATOM 48009 O WAT 9583 81.346 117.763 73.309 1.00 0.00 O ATOM 48010 H1 WAT 9583 81.332 117.394 72.426 1.00 0.00 H ATOM 48011 H2 WAT 9583 82.276 117.814 73.532 1.00 0.00 H TER 48013 WAT 9583 ATOM 48013 O WAT 9584 69.443 14.748 105.779 1.00 0.00 O ATOM 48014 H1 WAT 9584 68.511 14.865 105.963 1.00 0.00 H ATOM 48015 H2 WAT 9584 69.483 14.581 104.837 1.00 0.00 H TER 48017 WAT 9584 ATOM 48017 O WAT 9585 89.039 100.471 109.925 1.00 0.00 O ATOM 48018 H1 WAT 9585 89.818 100.623 109.391 1.00 0.00 H ATOM 48019 H2 WAT 9585 88.878 99.530 109.851 1.00 0.00 H TER 48021 WAT 9585 ATOM 48021 O WAT 9586 138.624 58.439 6.527 1.00 0.00 O ATOM 48022 H1 WAT 9586 138.171 57.733 6.988 1.00 0.00 H ATOM 48023 H2 WAT 9586 138.851 59.067 7.213 1.00 0.00 H TER 48025 WAT 9586 ATOM 48025 O WAT 9587 135.250 111.309 126.169 1.00 0.00 O ATOM 48026 H1 WAT 9587 134.306 111.441 126.088 1.00 0.00 H ATOM 48027 H2 WAT 9587 135.338 110.507 126.683 1.00 0.00 H TER 48029 WAT 9587 ATOM 48029 O WAT 9588 123.716 104.522 81.573 1.00 0.00 O ATOM 48030 H1 WAT 9588 124.389 103.859 81.724 1.00 0.00 H ATOM 48031 H2 WAT 9588 123.544 104.890 82.440 1.00 0.00 H TER 48033 WAT 9588 ATOM 48033 O WAT 9589 99.658 97.013 113.811 1.00 0.00 O ATOM 48034 H1 WAT 9589 99.345 97.772 114.303 1.00 0.00 H ATOM 48035 H2 WAT 9589 98.863 96.530 113.584 1.00 0.00 H TER 48037 WAT 9589 ATOM 48037 O WAT 9590 15.223 70.483 100.846 1.00 0.00 O ATOM 48038 H1 WAT 9590 15.472 70.680 101.749 1.00 0.00 H ATOM 48039 H2 WAT 9590 15.797 69.761 100.591 1.00 0.00 H TER 48041 WAT 9590 ATOM 48041 O WAT 9591 106.784 146.123 10.750 1.00 0.00 O ATOM 48042 H1 WAT 9591 107.089 146.151 11.657 1.00 0.00 H ATOM 48043 H2 WAT 9591 106.984 145.233 10.457 1.00 0.00 H TER 48045 WAT 9591 ATOM 48045 O WAT 9592 7.465 91.110 90.913 1.00 0.00 O ATOM 48046 H1 WAT 9592 8.394 91.264 91.087 1.00 0.00 H ATOM 48047 H2 WAT 9592 7.262 91.681 90.172 1.00 0.00 H TER 48049 WAT 9592 ATOM 48049 O WAT 9593 71.672 14.750 137.221 1.00 0.00 O ATOM 48050 H1 WAT 9593 71.951 14.346 136.399 1.00 0.00 H ATOM 48051 H2 WAT 9593 72.344 15.406 137.406 1.00 0.00 H TER 48053 WAT 9593 ATOM 48053 O WAT 9594 135.361 93.023 0.671 1.00 0.00 O ATOM 48054 H1 WAT 9594 134.755 93.690 0.350 1.00 0.00 H ATOM 48055 H2 WAT 9594 136.012 93.513 1.174 1.00 0.00 H TER 48057 WAT 9594 ATOM 48057 O WAT 9595 60.795 100.839 23.504 1.00 0.00 O ATOM 48058 H1 WAT 9595 60.242 100.704 22.734 1.00 0.00 H ATOM 48059 H2 WAT 9595 60.509 101.680 23.860 1.00 0.00 H TER 48061 WAT 9595 ATOM 48061 O WAT 9596 142.687 47.571 111.297 1.00 0.00 O ATOM 48062 H1 WAT 9596 143.097 48.198 111.893 1.00 0.00 H ATOM 48063 H2 WAT 9596 142.561 48.060 110.484 1.00 0.00 H TER 48065 WAT 9596 ATOM 48065 O WAT 9597 24.211 84.072 57.099 1.00 0.00 O ATOM 48066 H1 WAT 9597 23.540 83.639 57.627 1.00 0.00 H ATOM 48067 H2 WAT 9597 24.830 84.423 57.739 1.00 0.00 H TER 48069 WAT 9597 ATOM 48069 O WAT 9598 144.437 58.194 117.599 1.00 0.00 O ATOM 48070 H1 WAT 9598 144.399 58.084 116.649 1.00 0.00 H ATOM 48071 H2 WAT 9598 144.248 57.324 117.949 1.00 0.00 H TER 48073 WAT 9598 ATOM 48073 O WAT 9599 39.224 74.210 21.787 1.00 0.00 O ATOM 48074 H1 WAT 9599 39.860 74.100 22.494 1.00 0.00 H ATOM 48075 H2 WAT 9599 38.417 74.475 22.230 1.00 0.00 H TER 48077 WAT 9599 ATOM 48077 O WAT 9600 8.300 110.846 101.485 1.00 0.00 O ATOM 48078 H1 WAT 9600 7.842 110.180 101.999 1.00 0.00 H ATOM 48079 H2 WAT 9600 9.073 111.061 102.007 1.00 0.00 H TER 48081 WAT 9600 ATOM 48081 O WAT 9601 36.956 66.508 105.384 1.00 0.00 O ATOM 48082 H1 WAT 9601 36.959 65.854 104.686 1.00 0.00 H ATOM 48083 H2 WAT 9601 36.030 66.705 105.523 1.00 0.00 H TER 48085 WAT 9601 ATOM 48085 O WAT 9602 19.479 31.214 82.214 1.00 0.00 O ATOM 48086 H1 WAT 9602 18.738 30.710 82.550 1.00 0.00 H ATOM 48087 H2 WAT 9602 19.910 30.623 81.596 1.00 0.00 H TER 48089 WAT 9602 ATOM 48089 O WAT 9603 32.651 78.607 15.792 1.00 0.00 O ATOM 48090 H1 WAT 9603 32.230 78.905 14.986 1.00 0.00 H ATOM 48091 H2 WAT 9603 33.170 79.357 16.083 1.00 0.00 H TER 48093 WAT 9603 ATOM 48093 O WAT 9604 32.851 141.363 140.835 1.00 0.00 O ATOM 48094 H1 WAT 9604 33.112 140.886 141.622 1.00 0.00 H ATOM 48095 H2 WAT 9604 31.998 140.996 140.604 1.00 0.00 H TER 48097 WAT 9604 ATOM 48097 O WAT 9605 73.254 124.462 90.305 1.00 0.00 O ATOM 48098 H1 WAT 9605 73.362 124.351 89.361 1.00 0.00 H ATOM 48099 H2 WAT 9605 74.128 124.692 90.621 1.00 0.00 H TER 48101 WAT 9605 ATOM 48101 O WAT 9606 8.847 123.570 90.493 1.00 0.00 O ATOM 48102 H1 WAT 9606 9.410 123.472 91.261 1.00 0.00 H ATOM 48103 H2 WAT 9606 8.861 122.709 90.075 1.00 0.00 H TER 48105 WAT 9606 ATOM 48105 O WAT 9607 23.219 40.017 97.263 1.00 0.00 O ATOM 48106 H1 WAT 9607 23.295 39.089 97.038 1.00 0.00 H ATOM 48107 H2 WAT 9607 23.049 40.022 98.205 1.00 0.00 H TER 48109 WAT 9607 ATOM 48109 O WAT 9608 101.930 125.049 12.764 1.00 0.00 O ATOM 48110 H1 WAT 9608 101.786 125.322 13.670 1.00 0.00 H ATOM 48111 H2 WAT 9608 101.379 125.636 12.246 1.00 0.00 H TER 48113 WAT 9608 ATOM 48113 O WAT 9609 102.929 49.220 66.372 1.00 0.00 O ATOM 48114 H1 WAT 9609 103.466 48.504 66.032 1.00 0.00 H ATOM 48115 H2 WAT 9609 102.058 48.837 66.476 1.00 0.00 H TER 48117 WAT 9609 ATOM 48117 O WAT 9610 60.795 135.688 9.967 1.00 0.00 O ATOM 48118 H1 WAT 9610 60.217 135.054 10.392 1.00 0.00 H ATOM 48119 H2 WAT 9610 60.557 135.646 9.041 1.00 0.00 H TER 48121 WAT 9610 ATOM 48121 O WAT 9611 112.222 137.673 152.362 1.00 0.00 O ATOM 48122 H1 WAT 9611 111.783 136.823 152.366 1.00 0.00 H ATOM 48123 H2 WAT 9611 111.850 138.139 153.111 1.00 0.00 H TER 48125 WAT 9611 ATOM 48125 O WAT 9612 138.186 144.031 153.252 1.00 0.00 O ATOM 48126 H1 WAT 9612 137.653 144.171 152.469 1.00 0.00 H ATOM 48127 H2 WAT 9612 139.069 144.288 152.989 1.00 0.00 H TER 48129 WAT 9612 ATOM 48129 O WAT 9613 95.241 124.692 18.781 1.00 0.00 O ATOM 48130 H1 WAT 9613 94.982 124.957 17.898 1.00 0.00 H ATOM 48131 H2 WAT 9613 94.853 125.355 19.353 1.00 0.00 H TER 48133 WAT 9613 ATOM 48133 O WAT 9614 31.408 60.130 77.070 1.00 0.00 O ATOM 48134 H1 WAT 9614 30.635 59.890 77.581 1.00 0.00 H ATOM 48135 H2 WAT 9614 31.251 61.038 76.811 1.00 0.00 H TER 48137 WAT 9614 ATOM 48137 O WAT 9615 145.543 21.755 100.359 1.00 0.00 O ATOM 48138 H1 WAT 9615 145.666 21.110 99.663 1.00 0.00 H ATOM 48139 H2 WAT 9615 144.773 21.447 100.837 1.00 0.00 H TER 48141 WAT 9615 ATOM 48141 O WAT 9616 52.010 37.535 157.421 1.00 0.00 O ATOM 48142 H1 WAT 9616 52.151 37.961 158.267 1.00 0.00 H ATOM 48143 H2 WAT 9616 51.251 36.969 157.562 1.00 0.00 H TER 48145 WAT 9616 ATOM 48145 O WAT 9617 85.364 22.146 143.383 1.00 0.00 O ATOM 48146 H1 WAT 9617 85.681 22.464 142.538 1.00 0.00 H ATOM 48147 H2 WAT 9617 86.146 21.806 143.819 1.00 0.00 H TER 48149 WAT 9617 ATOM 48149 O WAT 9618 133.870 139.132 68.617 1.00 0.00 O ATOM 48150 H1 WAT 9618 133.428 139.517 67.860 1.00 0.00 H ATOM 48151 H2 WAT 9618 133.455 138.276 68.726 1.00 0.00 H TER 48153 WAT 9618 ATOM 48153 O WAT 9619 78.316 3.588 53.249 1.00 0.00 O ATOM 48154 H1 WAT 9619 77.510 4.062 53.454 1.00 0.00 H ATOM 48155 H2 WAT 9619 78.159 2.700 53.570 1.00 0.00 H TER 48157 WAT 9619 ATOM 48157 O WAT 9620 66.995 16.150 115.370 1.00 0.00 O ATOM 48158 H1 WAT 9620 66.564 15.404 115.786 1.00 0.00 H ATOM 48159 H2 WAT 9620 67.707 16.379 115.967 1.00 0.00 H TER 48161 WAT 9620 ATOM 48161 O WAT 9621 55.455 126.352 68.996 1.00 0.00 O ATOM 48162 H1 WAT 9621 55.415 126.195 69.940 1.00 0.00 H ATOM 48163 H2 WAT 9621 56.391 126.386 68.798 1.00 0.00 H TER 48165 WAT 9621 ATOM 48165 O WAT 9622 133.556 115.030 12.540 1.00 0.00 O ATOM 48166 H1 WAT 9622 133.575 115.438 11.675 1.00 0.00 H ATOM 48167 H2 WAT 9622 133.139 115.682 13.104 1.00 0.00 H TER 48169 WAT 9622 ATOM 48169 O WAT 9623 54.556 69.844 133.799 1.00 0.00 O ATOM 48170 H1 WAT 9623 54.340 69.096 133.242 1.00 0.00 H ATOM 48171 H2 WAT 9623 54.082 69.680 134.614 1.00 0.00 H TER 48173 WAT 9623 ATOM 48173 O WAT 9624 33.925 38.887 110.909 1.00 0.00 O ATOM 48174 H1 WAT 9624 34.738 39.132 110.467 1.00 0.00 H ATOM 48175 H2 WAT 9624 33.301 39.567 110.657 1.00 0.00 H TER 48177 WAT 9624 ATOM 48177 O WAT 9625 70.436 100.903 10.755 1.00 0.00 O ATOM 48178 H1 WAT 9625 69.555 101.273 10.698 1.00 0.00 H ATOM 48179 H2 WAT 9625 70.424 100.164 10.146 1.00 0.00 H TER 48181 WAT 9625 ATOM 48181 O WAT 9626 127.247 68.442 94.039 1.00 0.00 O ATOM 48182 H1 WAT 9626 127.963 67.832 94.218 1.00 0.00 H ATOM 48183 H2 WAT 9626 126.456 67.908 94.107 1.00 0.00 H TER 48185 WAT 9626 ATOM 48185 O WAT 9627 67.423 102.285 67.828 1.00 0.00 O ATOM 48186 H1 WAT 9627 66.545 102.001 68.081 1.00 0.00 H ATOM 48187 H2 WAT 9627 67.471 102.106 66.888 1.00 0.00 H TER 48189 WAT 9627 ATOM 48189 O WAT 9628 11.692 68.305 128.803 1.00 0.00 O ATOM 48190 H1 WAT 9628 12.151 69.124 128.988 1.00 0.00 H ATOM 48191 H2 WAT 9628 10.801 68.452 129.122 1.00 0.00 H TER 48193 WAT 9628 ATOM 48193 O WAT 9629 6.653 37.361 110.425 1.00 0.00 O ATOM 48194 H1 WAT 9629 6.709 36.464 110.753 1.00 0.00 H ATOM 48195 H2 WAT 9629 5.842 37.704 110.801 1.00 0.00 H TER 48197 WAT 9629 ATOM 48197 O WAT 9630 1.294 4.242 56.894 1.00 0.00 O ATOM 48198 H1 WAT 9630 2.206 3.994 56.744 1.00 0.00 H ATOM 48199 H2 WAT 9630 1.152 4.993 56.317 1.00 0.00 H TER 48201 WAT 9630 ATOM 48201 O WAT 9631 109.640 31.426 10.844 1.00 0.00 O ATOM 48202 H1 WAT 9631 109.834 30.546 10.522 1.00 0.00 H ATOM 48203 H2 WAT 9631 109.632 31.973 10.058 1.00 0.00 H TER 48205 WAT 9631 ATOM 48205 O WAT 9632 112.371 108.036 10.405 1.00 0.00 O ATOM 48206 H1 WAT 9632 111.481 108.277 10.149 1.00 0.00 H ATOM 48207 H2 WAT 9632 112.909 108.779 10.133 1.00 0.00 H TER 48209 WAT 9632 ATOM 48209 O WAT 9633 142.303 60.887 132.927 1.00 0.00 O ATOM 48210 H1 WAT 9633 141.847 60.092 133.201 1.00 0.00 H ATOM 48211 H2 WAT 9633 141.659 61.366 132.406 1.00 0.00 H TER 48213 WAT 9633 ATOM 48213 O WAT 9634 64.326 71.024 110.824 1.00 0.00 O ATOM 48214 H1 WAT 9634 63.979 71.425 111.621 1.00 0.00 H ATOM 48215 H2 WAT 9634 64.771 70.233 111.129 1.00 0.00 H TER 48217 WAT 9634 ATOM 48217 O WAT 9635 88.092 16.668 126.976 1.00 0.00 O ATOM 48218 H1 WAT 9635 88.309 16.983 127.853 1.00 0.00 H ATOM 48219 H2 WAT 9635 88.711 15.955 126.817 1.00 0.00 H TER 48221 WAT 9635 ATOM 48221 O WAT 9636 120.502 140.234 131.910 1.00 0.00 O ATOM 48222 H1 WAT 9636 121.309 140.455 131.445 1.00 0.00 H ATOM 48223 H2 WAT 9636 120.501 139.278 131.947 1.00 0.00 H TER 48225 WAT 9636 ATOM 48225 O WAT 9637 29.843 125.271 20.953 1.00 0.00 O ATOM 48226 H1 WAT 9637 30.533 124.648 20.729 1.00 0.00 H ATOM 48227 H2 WAT 9637 29.318 124.820 21.614 1.00 0.00 H TER 48229 WAT 9637 ATOM 48229 O WAT 9638 59.730 24.342 1.969 1.00 0.00 O ATOM 48230 H1 WAT 9638 59.899 24.256 2.907 1.00 0.00 H ATOM 48231 H2 WAT 9638 59.788 25.283 1.801 1.00 0.00 H TER 48233 WAT 9638 ATOM 48233 O WAT 9639 59.049 42.953 81.898 1.00 0.00 O ATOM 48234 H1 WAT 9639 58.374 43.616 82.044 1.00 0.00 H ATOM 48235 H2 WAT 9639 59.085 42.854 80.947 1.00 0.00 H TER 48237 WAT 9639 ATOM 48237 O WAT 9640 33.746 94.812 155.081 1.00 0.00 O ATOM 48238 H1 WAT 9640 33.874 93.917 155.395 1.00 0.00 H ATOM 48239 H2 WAT 9640 33.394 95.283 155.836 1.00 0.00 H TER 48241 WAT 9640 ATOM 48241 O WAT 9641 29.935 52.352 140.626 1.00 0.00 O ATOM 48242 H1 WAT 9641 29.458 52.305 139.798 1.00 0.00 H ATOM 48243 H2 WAT 9641 29.966 53.286 140.833 1.00 0.00 H TER 48245 WAT 9641 ATOM 48245 O WAT 9642 138.352 83.182 93.857 1.00 0.00 O ATOM 48246 H1 WAT 9642 137.707 83.102 93.154 1.00 0.00 H ATOM 48247 H2 WAT 9642 138.394 84.122 94.037 1.00 0.00 H TER 48249 WAT 9642 ATOM 48249 O WAT 9643 83.718 32.741 104.408 1.00 0.00 O ATOM 48250 H1 WAT 9643 84.364 32.035 104.383 1.00 0.00 H ATOM 48251 H2 WAT 9643 83.882 33.186 105.240 1.00 0.00 H TER 48253 WAT 9643 ATOM 48253 O WAT 9644 24.237 4.575 10.669 1.00 0.00 O ATOM 48254 H1 WAT 9644 25.125 4.684 11.009 1.00 0.00 H ATOM 48255 H2 WAT 9644 23.867 5.458 10.680 1.00 0.00 H TER 48257 WAT 9644 ATOM 48257 O WAT 9645 126.038 85.454 31.444 1.00 0.00 O ATOM 48258 H1 WAT 9645 126.654 86.134 31.173 1.00 0.00 H ATOM 48259 H2 WAT 9645 126.039 84.828 30.720 1.00 0.00 H TER 48261 WAT 9645 ATOM 48261 O WAT 9646 40.268 25.598 70.713 1.00 0.00 O ATOM 48262 H1 WAT 9646 40.862 25.932 71.384 1.00 0.00 H ATOM 48263 H2 WAT 9646 39.396 25.845 71.020 1.00 0.00 H TER 48265 WAT 9646 ATOM 48265 O WAT 9647 129.467 11.738 118.669 1.00 0.00 O ATOM 48266 H1 WAT 9647 128.599 11.460 118.963 1.00 0.00 H ATOM 48267 H2 WAT 9647 129.394 12.687 118.568 1.00 0.00 H TER 48269 WAT 9647 ATOM 48269 O WAT 9648 97.537 30.382 88.814 1.00 0.00 O ATOM 48270 H1 WAT 9648 96.982 31.103 88.518 1.00 0.00 H ATOM 48271 H2 WAT 9648 97.892 30.681 89.651 1.00 0.00 H TER 48273 WAT 9648 ATOM 48273 O WAT 9649 88.666 99.800 95.525 1.00 0.00 O ATOM 48274 H1 WAT 9649 89.090 100.627 95.755 1.00 0.00 H ATOM 48275 H2 WAT 9649 89.021 99.167 96.148 1.00 0.00 H TER 48277 WAT 9649 ATOM 48277 O WAT 9650 73.928 80.639 80.980 1.00 0.00 O ATOM 48278 H1 WAT 9650 74.763 80.685 81.446 1.00 0.00 H ATOM 48279 H2 WAT 9650 74.051 81.196 80.211 1.00 0.00 H TER 48281 WAT 9650 ATOM 48281 O WAT 9651 91.060 102.494 68.248 1.00 0.00 O ATOM 48282 H1 WAT 9651 91.893 102.929 68.434 1.00 0.00 H ATOM 48283 H2 WAT 9651 90.442 102.889 68.862 1.00 0.00 H TER 48285 WAT 9651 ATOM 48285 O WAT 9652 123.307 120.031 120.631 1.00 0.00 O ATOM 48286 H1 WAT 9652 122.993 120.102 121.532 1.00 0.00 H ATOM 48287 H2 WAT 9652 122.734 120.614 120.132 1.00 0.00 H TER 48289 WAT 9652 ATOM 48289 O WAT 9653 17.561 38.495 124.713 1.00 0.00 O ATOM 48290 H1 WAT 9653 16.787 39.003 124.955 1.00 0.00 H ATOM 48291 H2 WAT 9653 17.293 38.006 123.935 1.00 0.00 H TER 48293 WAT 9653 ATOM 48293 O WAT 9654 30.243 23.070 74.308 1.00 0.00 O ATOM 48294 H1 WAT 9654 30.827 23.537 74.905 1.00 0.00 H ATOM 48295 H2 WAT 9654 29.485 23.648 74.214 1.00 0.00 H TER 48297 WAT 9654 ATOM 48297 O WAT 9655 141.438 8.540 143.297 1.00 0.00 O ATOM 48298 H1 WAT 9655 140.801 8.413 144.001 1.00 0.00 H ATOM 48299 H2 WAT 9655 140.934 8.939 142.588 1.00 0.00 H TER 48301 WAT 9655 ATOM 48301 O WAT 9656 74.247 2.891 80.593 1.00 0.00 O ATOM 48302 H1 WAT 9656 73.761 2.266 81.131 1.00 0.00 H ATOM 48303 H2 WAT 9656 74.308 3.678 81.136 1.00 0.00 H TER 48305 WAT 9656 ATOM 48305 O WAT 9657 81.825 67.365 8.618 1.00 0.00 O ATOM 48306 H1 WAT 9657 82.065 66.897 7.818 1.00 0.00 H ATOM 48307 H2 WAT 9657 81.664 68.264 8.330 1.00 0.00 H TER 48309 WAT 9657 ATOM 48309 O WAT 9658 53.378 120.636 158.400 1.00 0.00 O ATOM 48310 H1 WAT 9658 53.281 120.889 157.482 1.00 0.00 H ATOM 48311 H2 WAT 9658 52.494 120.394 158.677 1.00 0.00 H TER 48313 WAT 9658 ATOM 48313 O WAT 9659 113.312 126.652 93.750 1.00 0.00 O ATOM 48314 H1 WAT 9659 113.541 126.458 92.841 1.00 0.00 H ATOM 48315 H2 WAT 9659 114.019 127.220 94.059 1.00 0.00 H TER 48317 WAT 9659 ATOM 48317 O WAT 9660 101.716 16.757 152.502 1.00 0.00 O ATOM 48318 H1 WAT 9660 101.368 16.690 151.613 1.00 0.00 H ATOM 48319 H2 WAT 9660 100.964 16.578 153.067 1.00 0.00 H TER 48321 WAT 9660 ATOM 48321 O WAT 9661 107.048 137.902 139.621 1.00 0.00 O ATOM 48322 H1 WAT 9661 107.416 137.297 140.265 1.00 0.00 H ATOM 48323 H2 WAT 9661 106.106 137.885 139.787 1.00 0.00 H TER 48325 WAT 9661 ATOM 48325 O WAT 9662 93.041 2.786 86.795 1.00 0.00 O ATOM 48326 H1 WAT 9662 92.465 2.360 86.161 1.00 0.00 H ATOM 48327 H2 WAT 9662 92.628 3.633 86.963 1.00 0.00 H TER 48329 WAT 9662 ATOM 48329 O WAT 9663 47.616 40.373 86.632 1.00 0.00 O ATOM 48330 H1 WAT 9663 48.039 40.182 87.469 1.00 0.00 H ATOM 48331 H2 WAT 9663 46.752 39.967 86.703 1.00 0.00 H TER 48333 WAT 9663 ATOM 48333 O WAT 9664 45.933 90.615 72.870 1.00 0.00 O ATOM 48334 H1 WAT 9664 45.759 91.536 73.066 1.00 0.00 H ATOM 48335 H2 WAT 9664 46.176 90.233 73.714 1.00 0.00 H TER 48337 WAT 9664 ATOM 48337 O WAT 9665 29.675 93.901 60.674 1.00 0.00 O ATOM 48338 H1 WAT 9665 29.906 93.143 61.210 1.00 0.00 H ATOM 48339 H2 WAT 9665 30.100 94.640 61.109 1.00 0.00 H TER 48341 WAT 9665 ATOM 48341 O WAT 9666 4.457 126.929 129.086 1.00 0.00 O ATOM 48342 H1 WAT 9666 3.868 126.649 129.786 1.00 0.00 H ATOM 48343 H2 WAT 9666 4.427 127.885 129.114 1.00 0.00 H TER 48345 WAT 9666 ATOM 48345 O WAT 9667 26.439 1.382 54.321 1.00 0.00 O ATOM 48346 H1 WAT 9667 26.873 1.525 53.480 1.00 0.00 H ATOM 48347 H2 WAT 9667 27.080 0.896 54.841 1.00 0.00 H TER 48349 WAT 9667 ATOM 48349 O WAT 9668 81.919 106.481 27.493 1.00 0.00 O ATOM 48350 H1 WAT 9668 82.048 107.208 28.103 1.00 0.00 H ATOM 48351 H2 WAT 9668 81.202 106.767 26.927 1.00 0.00 H TER 48353 WAT 9668 ATOM 48353 O WAT 9669 136.807 139.917 89.170 1.00 0.00 O ATOM 48354 H1 WAT 9669 137.222 140.621 89.668 1.00 0.00 H ATOM 48355 H2 WAT 9669 137.082 140.070 88.266 1.00 0.00 H TER 48357 WAT 9669 ATOM 48357 O WAT 9670 39.266 115.865 143.281 1.00 0.00 O ATOM 48358 H1 WAT 9670 39.531 116.475 142.592 1.00 0.00 H ATOM 48359 H2 WAT 9670 38.722 116.388 143.869 1.00 0.00 H TER 48361 WAT 9670 ATOM 48361 O WAT 9671 54.861 1.715 124.856 1.00 0.00 O ATOM 48362 H1 WAT 9671 55.392 0.931 125.001 1.00 0.00 H ATOM 48363 H2 WAT 9671 55.038 1.960 123.948 1.00 0.00 H TER 48365 WAT 9671 ATOM 48365 O WAT 9672 132.775 36.780 125.011 1.00 0.00 O ATOM 48366 H1 WAT 9672 132.208 37.482 124.694 1.00 0.00 H ATOM 48367 H2 WAT 9672 132.240 36.310 125.651 1.00 0.00 H TER 48369 WAT 9672 ATOM 48369 O WAT 9673 143.258 72.580 7.347 1.00 0.00 O ATOM 48370 H1 WAT 9673 143.341 73.223 8.051 1.00 0.00 H ATOM 48371 H2 WAT 9673 143.283 73.100 6.544 1.00 0.00 H TER 48373 WAT 9673 ATOM 48373 O WAT 9674 66.607 10.018 155.840 1.00 0.00 O ATOM 48374 H1 WAT 9674 66.485 10.038 154.891 1.00 0.00 H ATOM 48375 H2 WAT 9674 66.771 10.930 156.080 1.00 0.00 H TER 48377 WAT 9674 ATOM 48377 O WAT 9675 24.440 75.108 96.332 1.00 0.00 O ATOM 48378 H1 WAT 9675 24.495 75.087 95.377 1.00 0.00 H ATOM 48379 H2 WAT 9675 25.291 75.443 96.614 1.00 0.00 H TER 48381 WAT 9675 ATOM 48381 O WAT 9676 83.200 19.081 152.363 1.00 0.00 O ATOM 48382 H1 WAT 9676 83.390 19.567 151.561 1.00 0.00 H ATOM 48383 H2 WAT 9676 82.262 18.896 152.315 1.00 0.00 H TER 48385 WAT 9676 ATOM 48385 O WAT 9677 140.139 125.061 106.916 1.00 0.00 O ATOM 48386 H1 WAT 9677 139.359 124.732 106.469 1.00 0.00 H ATOM 48387 H2 WAT 9677 139.942 124.957 107.848 1.00 0.00 H TER 48389 WAT 9677 ATOM 48389 O WAT 9678 131.941 97.469 150.329 1.00 0.00 O ATOM 48390 H1 WAT 9678 131.243 97.583 149.683 1.00 0.00 H ATOM 48391 H2 WAT 9678 132.240 96.569 150.202 1.00 0.00 H TER 48393 WAT 9678 ATOM 48393 O WAT 9679 124.025 107.759 18.621 1.00 0.00 O ATOM 48394 H1 WAT 9679 124.518 107.593 19.425 1.00 0.00 H ATOM 48395 H2 WAT 9679 124.243 107.021 18.051 1.00 0.00 H TER 48397 WAT 9679 ATOM 48397 O WAT 9680 54.998 69.149 91.151 1.00 0.00 O ATOM 48398 H1 WAT 9680 54.163 69.335 91.580 1.00 0.00 H ATOM 48399 H2 WAT 9680 55.047 68.194 91.125 1.00 0.00 H TER 48401 WAT 9680 ATOM 48401 O WAT 9681 119.525 49.796 7.908 1.00 0.00 O ATOM 48402 H1 WAT 9681 120.220 49.696 8.559 1.00 0.00 H ATOM 48403 H2 WAT 9681 118.741 49.987 8.422 1.00 0.00 H TER 48405 WAT 9681 ATOM 48405 O WAT 9682 134.738 100.644 145.289 1.00 0.00 O ATOM 48406 H1 WAT 9682 134.539 100.819 144.369 1.00 0.00 H ATOM 48407 H2 WAT 9682 135.542 100.125 145.265 1.00 0.00 H TER 48409 WAT 9682 ATOM 48409 O WAT 9683 104.293 115.341 91.163 1.00 0.00 O ATOM 48410 H1 WAT 9683 104.821 114.568 90.967 1.00 0.00 H ATOM 48411 H2 WAT 9683 104.881 116.080 91.005 1.00 0.00 H TER 48413 WAT 9683 ATOM 48413 O WAT 9684 104.749 22.701 12.425 1.00 0.00 O ATOM 48414 H1 WAT 9684 105.266 22.221 11.778 1.00 0.00 H ATOM 48415 H2 WAT 9684 105.084 23.597 12.382 1.00 0.00 H TER 48417 WAT 9684 ATOM 48417 O WAT 9685 12.641 102.434 156.888 1.00 0.00 O ATOM 48418 H1 WAT 9685 11.969 102.721 157.506 1.00 0.00 H ATOM 48419 H2 WAT 9685 12.532 103.009 156.131 1.00 0.00 H TER 48421 WAT 9685 ATOM 48421 O WAT 9686 43.694 98.900 12.496 1.00 0.00 O ATOM 48422 H1 WAT 9686 42.825 99.220 12.739 1.00 0.00 H ATOM 48423 H2 WAT 9686 43.690 98.901 11.539 1.00 0.00 H TER 48425 WAT 9686 ATOM 48425 O WAT 9687 1.687 129.818 0.931 1.00 0.00 O ATOM 48426 H1 WAT 9687 2.319 130.392 0.500 1.00 0.00 H ATOM 48427 H2 WAT 9687 2.067 129.647 1.793 1.00 0.00 H TER 48429 WAT 9687 ATOM 48429 O WAT 9688 137.461 7.437 101.906 1.00 0.00 O ATOM 48430 H1 WAT 9688 136.896 6.795 101.476 1.00 0.00 H ATOM 48431 H2 WAT 9688 138.291 7.381 101.432 1.00 0.00 H TER 48433 WAT 9688 ATOM 48433 O WAT 9689 18.923 7.605 146.561 1.00 0.00 O ATOM 48434 H1 WAT 9689 19.000 7.808 147.493 1.00 0.00 H ATOM 48435 H2 WAT 9689 18.144 7.052 146.499 1.00 0.00 H TER 48437 WAT 9689 ATOM 48437 O WAT 9690 49.492 133.573 14.705 1.00 0.00 O ATOM 48438 H1 WAT 9690 49.646 133.392 15.633 1.00 0.00 H ATOM 48439 H2 WAT 9690 50.056 134.321 14.510 1.00 0.00 H TER 48441 WAT 9690 ATOM 48441 O WAT 9691 67.625 57.426 103.067 1.00 0.00 O ATOM 48442 H1 WAT 9691 68.574 57.522 102.981 1.00 0.00 H ATOM 48443 H2 WAT 9691 67.407 57.912 103.863 1.00 0.00 H TER 48445 WAT 9691 ATOM 48445 O WAT 9692 70.881 105.346 133.624 1.00 0.00 O ATOM 48446 H1 WAT 9692 70.828 106.294 133.750 1.00 0.00 H ATOM 48447 H2 WAT 9692 70.044 105.110 133.225 1.00 0.00 H TER 48449 WAT 9692 ATOM 48449 O WAT 9693 37.946 42.220 122.791 1.00 0.00 O ATOM 48450 H1 WAT 9693 38.633 42.880 122.888 1.00 0.00 H ATOM 48451 H2 WAT 9693 38.221 41.502 123.360 1.00 0.00 H TER 48453 WAT 9693 ATOM 48453 O WAT 9694 34.697 25.247 121.745 1.00 0.00 O ATOM 48454 H1 WAT 9694 33.864 25.307 122.212 1.00 0.00 H ATOM 48455 H2 WAT 9694 35.235 24.672 122.290 1.00 0.00 H TER 48457 WAT 9694 ATOM 48457 O WAT 9695 91.335 137.761 64.615 1.00 0.00 O ATOM 48458 H1 WAT 9695 90.723 138.495 64.661 1.00 0.00 H ATOM 48459 H2 WAT 9695 91.535 137.674 63.682 1.00 0.00 H TER 48461 WAT 9695 ATOM 48461 O WAT 9696 53.325 36.327 16.037 1.00 0.00 O ATOM 48462 H1 WAT 9696 54.206 36.697 15.983 1.00 0.00 H ATOM 48463 H2 WAT 9696 52.918 36.785 16.772 1.00 0.00 H TER 48465 WAT 9696 ATOM 48465 O WAT 9697 75.966 63.070 74.067 1.00 0.00 O ATOM 48466 H1 WAT 9697 76.909 63.075 74.232 1.00 0.00 H ATOM 48467 H2 WAT 9697 75.623 63.773 74.619 1.00 0.00 H TER 48469 WAT 9697 ATOM 48469 O WAT 9698 86.106 28.563 8.019 1.00 0.00 O ATOM 48470 H1 WAT 9698 85.392 28.865 8.580 1.00 0.00 H ATOM 48471 H2 WAT 9698 86.791 28.289 8.630 1.00 0.00 H TER 48473 WAT 9698 ATOM 48473 O WAT 9699 83.645 20.211 7.655 1.00 0.00 O ATOM 48474 H1 WAT 9699 84.371 19.614 7.837 1.00 0.00 H ATOM 48475 H2 WAT 9699 83.365 20.517 8.518 1.00 0.00 H TER 48477 WAT 9699 ATOM 48477 O WAT 9700 114.803 101.364 90.709 1.00 0.00 O ATOM 48478 H1 WAT 9700 115.036 100.834 89.946 1.00 0.00 H ATOM 48479 H2 WAT 9700 113.853 101.462 90.652 1.00 0.00 H TER 48481 WAT 9700 ATOM 48481 O WAT 9701 61.626 129.804 107.114 1.00 0.00 O ATOM 48482 H1 WAT 9701 62.351 129.189 107.002 1.00 0.00 H ATOM 48483 H2 WAT 9701 61.881 130.571 106.601 1.00 0.00 H TER 48485 WAT 9701 ATOM 48485 O WAT 9702 15.730 109.069 65.188 1.00 0.00 O ATOM 48486 H1 WAT 9702 16.403 109.652 65.540 1.00 0.00 H ATOM 48487 H2 WAT 9702 15.648 109.325 64.270 1.00 0.00 H TER 48489 WAT 9702 ATOM 48489 O WAT 9703 107.989 94.914 153.285 1.00 0.00 O ATOM 48490 H1 WAT 9703 108.315 95.662 152.785 1.00 0.00 H ATOM 48491 H2 WAT 9703 108.148 94.159 152.719 1.00 0.00 H TER 48493 WAT 9703 ATOM 48493 O WAT 9704 103.266 13.268 158.541 1.00 0.00 O ATOM 48494 H1 WAT 9704 102.708 13.374 157.770 1.00 0.00 H ATOM 48495 H2 WAT 9704 102.659 13.039 159.245 1.00 0.00 H TER 48497 WAT 9704 ATOM 48497 O WAT 9705 62.785 -0.047 90.678 1.00 0.00 O ATOM 48498 H1 WAT 9705 63.532 -0.542 91.016 1.00 0.00 H ATOM 48499 H2 WAT 9705 63.177 0.706 90.236 1.00 0.00 H TER 48501 WAT 9705 ATOM 48501 O WAT 9706 137.450 58.067 78.841 1.00 0.00 O ATOM 48502 H1 WAT 9706 137.163 58.849 78.369 1.00 0.00 H ATOM 48503 H2 WAT 9706 137.028 57.341 78.381 1.00 0.00 H TER 48505 WAT 9706 ATOM 48505 O WAT 9707 11.916 144.552 143.894 1.00 0.00 O ATOM 48506 H1 WAT 9707 12.311 143.778 143.492 1.00 0.00 H ATOM 48507 H2 WAT 9707 11.819 145.173 143.172 1.00 0.00 H TER 48509 WAT 9707 ATOM 48509 O WAT 9708 50.480 92.186 1.325 1.00 0.00 O ATOM 48510 H1 WAT 9708 51.263 92.401 0.819 1.00 0.00 H ATOM 48511 H2 WAT 9708 49.765 92.613 0.852 1.00 0.00 H TER 48513 WAT 9708 ATOM 48513 O WAT 9709 128.128 38.804 117.151 1.00 0.00 O ATOM 48514 H1 WAT 9709 127.504 38.858 117.875 1.00 0.00 H ATOM 48515 H2 WAT 9709 128.959 39.090 117.530 1.00 0.00 H TER 48517 WAT 9709 ATOM 48517 O WAT 9710 80.980 118.286 91.619 1.00 0.00 O ATOM 48518 H1 WAT 9710 80.730 117.363 91.674 1.00 0.00 H ATOM 48519 H2 WAT 9710 81.913 118.294 91.832 1.00 0.00 H TER 48521 WAT 9710 ATOM 48521 O WAT 9711 136.741 52.436 71.331 1.00 0.00 O ATOM 48522 H1 WAT 9711 136.992 53.076 71.997 1.00 0.00 H ATOM 48523 H2 WAT 9711 136.326 52.957 70.644 1.00 0.00 H TER 48525 WAT 9711 ATOM 48525 O WAT 9712 57.169 86.453 26.256 1.00 0.00 O ATOM 48526 H1 WAT 9712 57.953 86.543 26.797 1.00 0.00 H ATOM 48527 H2 WAT 9712 57.392 85.769 25.624 1.00 0.00 H TER 48529 WAT 9712 ATOM 48529 O WAT 9713 45.904 87.861 7.032 1.00 0.00 O ATOM 48530 H1 WAT 9713 46.319 88.677 6.750 1.00 0.00 H ATOM 48531 H2 WAT 9713 46.557 87.185 6.852 1.00 0.00 H TER 48533 WAT 9713 ATOM 48533 O WAT 9714 114.514 92.097 139.667 1.00 0.00 O ATOM 48534 H1 WAT 9714 114.882 91.483 139.031 1.00 0.00 H ATOM 48535 H2 WAT 9714 115.043 92.889 139.569 1.00 0.00 H TER 48537 WAT 9714 ATOM 48537 O WAT 9715 64.109 64.017 158.391 1.00 0.00 O ATOM 48538 H1 WAT 9715 64.052 64.195 157.453 1.00 0.00 H ATOM 48539 H2 WAT 9715 64.191 64.881 158.794 1.00 0.00 H TER 48541 WAT 9715 ATOM 48541 O WAT 9716 19.242 22.259 95.122 1.00 0.00 O ATOM 48542 H1 WAT 9716 19.343 21.814 94.281 1.00 0.00 H ATOM 48543 H2 WAT 9716 18.910 21.583 95.713 1.00 0.00 H TER 48545 WAT 9716 ATOM 48545 O WAT 9717 93.087 121.763 16.637 1.00 0.00 O ATOM 48546 H1 WAT 9717 93.189 121.777 17.589 1.00 0.00 H ATOM 48547 H2 WAT 9717 92.141 121.721 16.498 1.00 0.00 H TER 48549 WAT 9717 ATOM 48549 O WAT 9718 108.461 141.406 158.332 1.00 0.00 O ATOM 48550 H1 WAT 9718 107.728 140.886 158.663 1.00 0.00 H ATOM 48551 H2 WAT 9718 108.399 141.326 157.380 1.00 0.00 H TER 48553 WAT 9718 ATOM 48553 O WAT 9719 100.092 93.873 25.754 1.00 0.00 O ATOM 48554 H1 WAT 9719 100.380 93.169 25.172 1.00 0.00 H ATOM 48555 H2 WAT 9719 100.904 94.271 26.067 1.00 0.00 H TER 48557 WAT 9719 ATOM 48557 O WAT 9720 103.253 76.014 21.695 1.00 0.00 O ATOM 48558 H1 WAT 9720 102.318 75.812 21.658 1.00 0.00 H ATOM 48559 H2 WAT 9720 103.628 75.319 22.236 1.00 0.00 H TER 48561 WAT 9720 ATOM 48561 O WAT 9721 107.632 12.821 75.793 1.00 0.00 O ATOM 48562 H1 WAT 9721 106.868 13.095 75.285 1.00 0.00 H ATOM 48563 H2 WAT 9721 108.025 13.639 76.096 1.00 0.00 H TER 48565 WAT 9721 ATOM 48565 O WAT 9722 82.901 51.428 135.975 1.00 0.00 O ATOM 48566 H1 WAT 9722 82.216 51.102 136.559 1.00 0.00 H ATOM 48567 H2 WAT 9722 82.427 51.886 135.282 1.00 0.00 H TER 48569 WAT 9722 ATOM 48569 O WAT 9723 101.959 88.472 73.103 1.00 0.00 O ATOM 48570 H1 WAT 9723 101.488 88.360 72.277 1.00 0.00 H ATOM 48571 H2 WAT 9723 101.390 89.035 73.628 1.00 0.00 H TER 48573 WAT 9723 ATOM 48573 O WAT 9724 108.433 129.606 97.246 1.00 0.00 O ATOM 48574 H1 WAT 9724 108.190 129.620 96.320 1.00 0.00 H ATOM 48575 H2 WAT 9724 109.051 130.330 97.342 1.00 0.00 H TER 48577 WAT 9724 ATOM 48577 O WAT 9725 14.943 97.215 101.378 1.00 0.00 O ATOM 48578 H1 WAT 9725 15.480 97.990 101.545 1.00 0.00 H ATOM 48579 H2 WAT 9725 15.132 96.985 100.468 1.00 0.00 H TER 48581 WAT 9725 ATOM 48581 O WAT 9726 72.695 62.723 83.048 1.00 0.00 O ATOM 48582 H1 WAT 9726 73.197 62.128 82.491 1.00 0.00 H ATOM 48583 H2 WAT 9726 72.808 63.583 82.642 1.00 0.00 H TER 48585 WAT 9726 ATOM 48585 O WAT 9727 93.193 102.201 140.092 1.00 0.00 O ATOM 48586 H1 WAT 9727 93.973 101.803 140.478 1.00 0.00 H ATOM 48587 H2 WAT 9727 92.514 102.091 140.757 1.00 0.00 H TER 48589 WAT 9727 ATOM 48589 O WAT 9728 91.355 46.871 112.005 1.00 0.00 O ATOM 48590 H1 WAT 9728 90.815 46.956 111.220 1.00 0.00 H ATOM 48591 H2 WAT 9728 92.180 46.501 111.690 1.00 0.00 H TER 48593 WAT 9728 ATOM 48593 O WAT 9729 126.549 80.770 154.073 1.00 0.00 O ATOM 48594 H1 WAT 9729 126.566 79.972 153.545 1.00 0.00 H ATOM 48595 H2 WAT 9729 127.053 80.549 154.857 1.00 0.00 H TER 48597 WAT 9729 ATOM 48597 O WAT 9730 38.083 16.245 79.926 1.00 0.00 O ATOM 48598 H1 WAT 9730 38.818 16.512 79.374 1.00 0.00 H ATOM 48599 H2 WAT 9730 38.284 16.615 80.786 1.00 0.00 H TER 48601 WAT 9730 ATOM 48601 O WAT 9731 60.901 37.158 125.956 1.00 0.00 O ATOM 48602 H1 WAT 9731 60.838 36.539 125.228 1.00 0.00 H ATOM 48603 H2 WAT 9731 60.572 36.673 126.712 1.00 0.00 H TER 48605 WAT 9731 ATOM 48605 O WAT 9732 90.805 128.833 12.099 1.00 0.00 O ATOM 48606 H1 WAT 9732 90.811 128.987 13.044 1.00 0.00 H ATOM 48607 H2 WAT 9732 91.722 128.675 11.876 1.00 0.00 H TER 48609 WAT 9732 ATOM 48609 O WAT 9733 61.375 116.559 144.668 1.00 0.00 O ATOM 48610 H1 WAT 9733 61.965 116.737 145.400 1.00 0.00 H ATOM 48611 H2 WAT 9733 61.686 117.130 143.965 1.00 0.00 H TER 48613 WAT 9733 ATOM 48613 O WAT 9734 67.593 74.388 146.528 1.00 0.00 O ATOM 48614 H1 WAT 9734 66.932 73.858 146.082 1.00 0.00 H ATOM 48615 H2 WAT 9734 68.397 73.872 146.466 1.00 0.00 H TER 48617 WAT 9734 ATOM 48617 O WAT 9735 99.896 27.077 92.399 1.00 0.00 O ATOM 48618 H1 WAT 9735 100.223 26.184 92.286 1.00 0.00 H ATOM 48619 H2 WAT 9735 100.451 27.609 91.828 1.00 0.00 H TER 48621 WAT 9735 ATOM 48621 O WAT 9736 50.016 15.649 15.342 1.00 0.00 O ATOM 48622 H1 WAT 9736 49.971 15.728 16.295 1.00 0.00 H ATOM 48623 H2 WAT 9736 49.577 16.434 15.015 1.00 0.00 H TER 48625 WAT 9736 ATOM 48625 O WAT 9737 12.907 126.279 127.206 1.00 0.00 O ATOM 48626 H1 WAT 9737 12.177 126.897 127.250 1.00 0.00 H ATOM 48627 H2 WAT 9737 13.079 126.047 128.119 1.00 0.00 H TER 48629 WAT 9737 ATOM 48629 O WAT 9738 114.209 1.260 11.409 1.00 0.00 O ATOM 48630 H1 WAT 9738 114.782 0.736 11.967 1.00 0.00 H ATOM 48631 H2 WAT 9738 114.432 2.167 11.621 1.00 0.00 H TER 48633 WAT 9738 ATOM 48633 O WAT 9739 94.253 55.222 82.332 1.00 0.00 O ATOM 48634 H1 WAT 9739 95.112 55.316 82.744 1.00 0.00 H ATOM 48635 H2 WAT 9739 94.386 54.564 81.649 1.00 0.00 H TER 48637 WAT 9739 ATOM 48637 O WAT 9740 35.186 0.535 128.036 1.00 0.00 O ATOM 48638 H1 WAT 9740 34.411 1.017 128.324 1.00 0.00 H ATOM 48639 H2 WAT 9740 35.261 -0.190 128.656 1.00 0.00 H TER 48641 WAT 9740 ATOM 48641 O WAT 9741 52.433 102.427 133.753 1.00 0.00 O ATOM 48642 H1 WAT 9741 52.323 103.142 133.126 1.00 0.00 H ATOM 48643 H2 WAT 9741 53.130 101.887 133.381 1.00 0.00 H TER 48645 WAT 9741 ATOM 48645 O WAT 9742 45.550 29.212 71.531 1.00 0.00 O ATOM 48646 H1 WAT 9742 44.758 28.832 71.151 1.00 0.00 H ATOM 48647 H2 WAT 9742 46.091 29.442 70.777 1.00 0.00 H TER 48649 WAT 9742 ATOM 48649 O WAT 9743 97.207 71.844 22.436 1.00 0.00 O ATOM 48650 H1 WAT 9743 96.890 71.116 22.970 1.00 0.00 H ATOM 48651 H2 WAT 9743 98.098 72.000 22.749 1.00 0.00 H TER 48653 WAT 9743 ATOM 48653 O WAT 9744 84.263 72.202 23.344 1.00 0.00 O ATOM 48654 H1 WAT 9744 83.512 72.397 23.903 1.00 0.00 H ATOM 48655 H2 WAT 9744 84.435 73.021 22.878 1.00 0.00 H TER 48657 WAT 9744 ATOM 48657 O WAT 9745 49.902 43.574 11.508 1.00 0.00 O ATOM 48658 H1 WAT 9745 49.307 44.321 11.452 1.00 0.00 H ATOM 48659 H2 WAT 9745 50.749 43.920 11.226 1.00 0.00 H TER 48661 WAT 9745 ATOM 48661 O WAT 9746 116.038 13.990 129.404 1.00 0.00 O ATOM 48662 H1 WAT 9746 115.347 14.648 129.323 1.00 0.00 H ATOM 48663 H2 WAT 9746 116.831 14.440 129.113 1.00 0.00 H TER 48665 WAT 9746 ATOM 48665 O WAT 9747 139.880 104.231 138.492 1.00 0.00 O ATOM 48666 H1 WAT 9747 140.611 104.264 137.874 1.00 0.00 H ATOM 48667 H2 WAT 9747 140.025 103.427 138.991 1.00 0.00 H TER 48669 WAT 9747 ATOM 48669 O WAT 9748 120.516 114.761 16.117 1.00 0.00 O ATOM 48670 H1 WAT 9748 120.385 114.422 15.232 1.00 0.00 H ATOM 48671 H2 WAT 9748 120.202 115.664 16.077 1.00 0.00 H TER 48673 WAT 9748 ATOM 48673 O WAT 9749 61.531 91.137 14.454 1.00 0.00 O ATOM 48674 H1 WAT 9749 60.840 90.550 14.760 1.00 0.00 H ATOM 48675 H2 WAT 9749 61.521 91.864 15.077 1.00 0.00 H TER 48677 WAT 9749 ATOM 48677 O WAT 9750 104.259 108.509 124.081 1.00 0.00 O ATOM 48678 H1 WAT 9750 104.018 108.104 123.248 1.00 0.00 H ATOM 48679 H2 WAT 9750 103.447 108.516 124.587 1.00 0.00 H TER 48681 WAT 9750 ATOM 48681 O WAT 9751 112.610 20.250 153.063 1.00 0.00 O ATOM 48682 H1 WAT 9751 113.289 20.538 153.673 1.00 0.00 H ATOM 48683 H2 WAT 9751 111.915 19.906 153.624 1.00 0.00 H TER 48685 WAT 9751 ATOM 48685 O WAT 9752 23.937 65.371 152.773 1.00 0.00 O ATOM 48686 H1 WAT 9752 23.932 65.672 151.864 1.00 0.00 H ATOM 48687 H2 WAT 9752 24.100 64.430 152.712 1.00 0.00 H TER 48689 WAT 9752 ATOM 48689 O WAT 9753 81.194 30.140 151.821 1.00 0.00 O ATOM 48690 H1 WAT 9753 80.355 30.598 151.867 1.00 0.00 H ATOM 48691 H2 WAT 9753 81.847 30.839 151.779 1.00 0.00 H TER 48693 WAT 9753 ATOM 48693 O WAT 9754 1.927 131.913 114.328 1.00 0.00 O ATOM 48694 H1 WAT 9754 1.098 132.386 114.258 1.00 0.00 H ATOM 48695 H2 WAT 9754 1.708 131.009 114.100 1.00 0.00 H TER 48697 WAT 9754 ATOM 48697 O WAT 9755 125.129 67.878 86.961 1.00 0.00 O ATOM 48698 H1 WAT 9755 125.053 68.453 86.200 1.00 0.00 H ATOM 48699 H2 WAT 9755 124.227 67.628 87.164 1.00 0.00 H TER 48701 WAT 9755 ATOM 48701 O WAT 9756 69.585 44.477 2.133 1.00 0.00 O ATOM 48702 H1 WAT 9756 70.536 44.471 2.243 1.00 0.00 H ATOM 48703 H2 WAT 9756 69.268 45.060 2.822 1.00 0.00 H TER 48705 WAT 9756 ATOM 48705 O WAT 9757 35.887 8.914 133.498 1.00 0.00 O ATOM 48706 H1 WAT 9757 36.034 9.658 134.082 1.00 0.00 H ATOM 48707 H2 WAT 9757 35.164 9.190 132.935 1.00 0.00 H TER 48709 WAT 9757 ATOM 48709 O WAT 9758 45.789 50.111 75.186 1.00 0.00 O ATOM 48710 H1 WAT 9758 46.455 50.779 75.024 1.00 0.00 H ATOM 48711 H2 WAT 9758 45.281 50.453 75.922 1.00 0.00 H TER 48713 WAT 9758 ATOM 48713 O WAT 9759 25.005 21.454 107.453 1.00 0.00 O ATOM 48714 H1 WAT 9759 25.353 20.684 107.004 1.00 0.00 H ATOM 48715 H2 WAT 9759 24.058 21.399 107.322 1.00 0.00 H TER 48717 WAT 9759 ATOM 48717 O WAT 9760 62.156 132.726 157.522 1.00 0.00 O ATOM 48718 H1 WAT 9760 61.693 133.563 157.480 1.00 0.00 H ATOM 48719 H2 WAT 9760 61.963 132.304 156.685 1.00 0.00 H TER 48721 WAT 9760 ATOM 48721 O WAT 9761 85.899 83.243 1.132 1.00 0.00 O ATOM 48722 H1 WAT 9761 86.488 83.114 1.875 1.00 0.00 H ATOM 48723 H2 WAT 9761 85.985 84.172 0.917 1.00 0.00 H TER 48725 WAT 9761 ATOM 48725 O WAT 9762 11.691 80.870 154.229 1.00 0.00 O ATOM 48726 H1 WAT 9762 11.163 80.359 154.842 1.00 0.00 H ATOM 48727 H2 WAT 9762 11.615 81.772 154.541 1.00 0.00 H TER 48729 WAT 9762 ATOM 48729 O WAT 9763 142.331 75.666 27.380 1.00 0.00 O ATOM 48730 H1 WAT 9763 142.241 74.904 26.809 1.00 0.00 H ATOM 48731 H2 WAT 9763 142.543 76.387 26.787 1.00 0.00 H TER 48733 WAT 9763 ATOM 48733 O WAT 9764 90.105 103.637 124.997 1.00 0.00 O ATOM 48734 H1 WAT 9764 90.874 104.059 125.380 1.00 0.00 H ATOM 48735 H2 WAT 9764 90.448 103.144 124.252 1.00 0.00 H TER 48737 WAT 9764 ATOM 48737 O WAT 9765 72.232 56.637 81.092 1.00 0.00 O ATOM 48738 H1 WAT 9765 71.289 56.604 80.932 1.00 0.00 H ATOM 48739 H2 WAT 9765 72.626 56.571 80.222 1.00 0.00 H TER 48741 WAT 9765 ATOM 48741 O WAT 9766 116.157 104.494 76.351 1.00 0.00 O ATOM 48742 H1 WAT 9766 115.664 104.601 77.164 1.00 0.00 H ATOM 48743 H2 WAT 9766 117.057 104.338 76.635 1.00 0.00 H TER 48745 WAT 9766 ATOM 48745 O WAT 9767 3.557 132.254 75.656 1.00 0.00 O ATOM 48746 H1 WAT 9767 3.993 132.534 74.851 1.00 0.00 H ATOM 48747 H2 WAT 9767 4.218 131.740 76.120 1.00 0.00 H TER 48749 WAT 9767 ATOM 48749 O WAT 9768 40.265 117.934 68.938 1.00 0.00 O ATOM 48750 H1 WAT 9768 39.546 117.583 68.414 1.00 0.00 H ATOM 48751 H2 WAT 9768 39.835 118.441 69.627 1.00 0.00 H TER 48753 WAT 9768 ATOM 48753 O WAT 9769 34.725 140.130 86.463 1.00 0.00 O ATOM 48754 H1 WAT 9769 34.518 140.497 87.322 1.00 0.00 H ATOM 48755 H2 WAT 9769 34.040 139.480 86.308 1.00 0.00 H TER 48757 WAT 9769 ATOM 48757 O WAT 9770 82.519 93.318 57.441 1.00 0.00 O ATOM 48758 H1 WAT 9770 81.958 93.757 58.079 1.00 0.00 H ATOM 48759 H2 WAT 9770 82.249 93.678 56.596 1.00 0.00 H TER 48761 WAT 9770 ATOM 48761 O WAT 9771 41.717 29.439 145.976 1.00 0.00 O ATOM 48762 H1 WAT 9771 41.840 30.026 146.721 1.00 0.00 H ATOM 48763 H2 WAT 9771 40.861 29.680 145.620 1.00 0.00 H TER 48765 WAT 9771 ATOM 48765 O WAT 9772 91.775 62.594 136.333 1.00 0.00 O ATOM 48766 H1 WAT 9772 92.278 63.398 136.201 1.00 0.00 H ATOM 48767 H2 WAT 9772 91.646 62.545 137.280 1.00 0.00 H TER 48769 WAT 9772 ATOM 48769 O WAT 9773 134.301 73.710 145.804 1.00 0.00 O ATOM 48770 H1 WAT 9773 135.027 74.327 145.718 1.00 0.00 H ATOM 48771 H2 WAT 9773 133.843 73.987 146.598 1.00 0.00 H TER 48773 WAT 9773 ATOM 48773 O WAT 9774 77.958 100.677 79.006 1.00 0.00 O ATOM 48774 H1 WAT 9774 78.459 100.454 78.221 1.00 0.00 H ATOM 48775 H2 WAT 9774 77.434 101.435 78.749 1.00 0.00 H TER 48777 WAT 9774 ATOM 48777 O WAT 9775 60.643 20.980 20.537 1.00 0.00 O ATOM 48778 H1 WAT 9775 60.372 20.132 20.889 1.00 0.00 H ATOM 48779 H2 WAT 9775 61.471 20.801 20.092 1.00 0.00 H TER 48781 WAT 9775 ATOM 48781 O WAT 9776 24.079 90.650 116.969 1.00 0.00 O ATOM 48782 H1 WAT 9776 23.519 90.099 116.422 1.00 0.00 H ATOM 48783 H2 WAT 9776 24.970 90.425 116.703 1.00 0.00 H TER 48785 WAT 9776 ATOM 48785 O WAT 9777 24.410 122.754 76.726 1.00 0.00 O ATOM 48786 H1 WAT 9777 23.832 122.917 77.471 1.00 0.00 H ATOM 48787 H2 WAT 9777 23.926 123.086 75.970 1.00 0.00 H TER 48789 WAT 9777 ATOM 48789 O WAT 9778 139.075 89.717 138.242 1.00 0.00 O ATOM 48790 H1 WAT 9778 139.233 88.829 137.921 1.00 0.00 H ATOM 48791 H2 WAT 9778 138.395 90.063 137.665 1.00 0.00 H TER 48793 WAT 9778 ATOM 48793 O WAT 9779 142.552 100.037 122.636 1.00 0.00 O ATOM 48794 H1 WAT 9779 142.044 99.273 122.364 1.00 0.00 H ATOM 48795 H2 WAT 9779 141.925 100.589 123.102 1.00 0.00 H TER 48797 WAT 9779 ATOM 48797 O WAT 9780 7.338 87.001 56.286 1.00 0.00 O ATOM 48798 H1 WAT 9780 6.758 87.759 56.360 1.00 0.00 H ATOM 48799 H2 WAT 9780 7.095 86.439 57.021 1.00 0.00 H TER 48801 WAT 9780 ATOM 48801 O WAT 9781 79.649 130.291 84.675 1.00 0.00 O ATOM 48802 H1 WAT 9781 80.457 130.539 84.225 1.00 0.00 H ATOM 48803 H2 WAT 9781 79.459 129.408 84.358 1.00 0.00 H TER 48805 WAT 9781 ATOM 48805 O WAT 9782 72.234 25.573 111.159 1.00 0.00 O ATOM 48806 H1 WAT 9782 71.778 26.068 110.478 1.00 0.00 H ATOM 48807 H2 WAT 9782 73.108 25.421 110.800 1.00 0.00 H TER 48809 WAT 9782 ATOM 48809 O WAT 9783 118.396 59.302 127.393 1.00 0.00 O ATOM 48810 H1 WAT 9783 117.582 58.825 127.556 1.00 0.00 H ATOM 48811 H2 WAT 9783 118.276 59.692 126.527 1.00 0.00 H TER 48813 WAT 9783 ATOM 48813 O WAT 9784 93.061 120.787 21.927 1.00 0.00 O ATOM 48814 H1 WAT 9784 92.484 121.550 21.963 1.00 0.00 H ATOM 48815 H2 WAT 9784 93.040 120.429 22.814 1.00 0.00 H TER 48817 WAT 9784 ATOM 48817 O WAT 9785 32.569 18.369 12.775 1.00 0.00 O ATOM 48818 H1 WAT 9785 32.148 18.102 11.958 1.00 0.00 H ATOM 48819 H2 WAT 9785 33.013 19.189 12.560 1.00 0.00 H TER 48821 WAT 9785 ATOM 48821 O WAT 9786 140.896 85.625 135.355 1.00 0.00 O ATOM 48822 H1 WAT 9786 140.535 84.739 135.342 1.00 0.00 H ATOM 48823 H2 WAT 9786 140.128 86.197 135.348 1.00 0.00 H TER 48825 WAT 9786 ATOM 48825 O WAT 9787 121.988 56.413 15.291 1.00 0.00 O ATOM 48826 H1 WAT 9787 121.453 55.689 14.967 1.00 0.00 H ATOM 48827 H2 WAT 9787 121.603 56.636 16.138 1.00 0.00 H TER 48829 WAT 9787 ATOM 48829 O WAT 9788 130.565 26.335 1.305 1.00 0.00 O ATOM 48830 H1 WAT 9788 130.800 26.639 2.182 1.00 0.00 H ATOM 48831 H2 WAT 9788 131.016 26.938 0.714 1.00 0.00 H TER 48833 WAT 9788 ATOM 48833 O WAT 9789 47.421 70.057 82.474 1.00 0.00 O ATOM 48834 H1 WAT 9789 47.947 69.403 82.014 1.00 0.00 H ATOM 48835 H2 WAT 9789 46.533 69.700 82.466 1.00 0.00 H TER 48837 WAT 9789 ATOM 48837 O WAT 9790 112.287 3.962 11.130 1.00 0.00 O ATOM 48838 H1 WAT 9790 112.146 3.297 11.804 1.00 0.00 H ATOM 48839 H2 WAT 9790 111.411 4.294 10.934 1.00 0.00 H TER 48841 WAT 9790 ATOM 48841 O WAT 9791 32.249 81.490 150.835 1.00 0.00 O ATOM 48842 H1 WAT 9791 31.403 81.883 151.049 1.00 0.00 H ATOM 48843 H2 WAT 9791 32.416 80.876 151.550 1.00 0.00 H TER 48845 WAT 9791 ATOM 48845 O WAT 9792 21.027 44.697 91.867 1.00 0.00 O ATOM 48846 H1 WAT 9792 21.435 43.925 91.476 1.00 0.00 H ATOM 48847 H2 WAT 9792 21.208 44.617 92.803 1.00 0.00 H TER 48849 WAT 9792 ATOM 48849 O WAT 9793 119.467 120.402 137.924 1.00 0.00 O ATOM 48850 H1 WAT 9793 119.883 119.627 138.300 1.00 0.00 H ATOM 48851 H2 WAT 9793 120.058 120.674 137.222 1.00 0.00 H TER 48853 WAT 9793 ATOM 48853 O WAT 9794 91.760 40.885 145.365 1.00 0.00 O ATOM 48854 H1 WAT 9794 92.625 41.285 145.276 1.00 0.00 H ATOM 48855 H2 WAT 9794 91.206 41.375 144.757 1.00 0.00 H TER 48857 WAT 9794 ATOM 48857 O WAT 9795 20.679 42.588 97.640 1.00 0.00 O ATOM 48858 H1 WAT 9795 20.621 43.273 98.307 1.00 0.00 H ATOM 48859 H2 WAT 9795 21.099 41.853 98.088 1.00 0.00 H TER 48861 WAT 9795 ATOM 48861 O WAT 9796 -0.082 89.503 108.274 1.00 0.00 O ATOM 48862 H1 WAT 9796 0.671 89.706 107.719 1.00 0.00 H ATOM 48863 H2 WAT 9796 0.288 89.405 109.152 1.00 0.00 H TER 48865 WAT 9796 ATOM 48865 O WAT 9797 121.160 69.576 127.082 1.00 0.00 O ATOM 48866 H1 WAT 9797 122.017 69.754 126.695 1.00 0.00 H ATOM 48867 H2 WAT 9797 120.998 70.322 127.659 1.00 0.00 H TER 48869 WAT 9797 ATOM 48869 O WAT 9798 127.656 121.081 138.628 1.00 0.00 O ATOM 48870 H1 WAT 9798 127.083 121.743 138.240 1.00 0.00 H ATOM 48871 H2 WAT 9798 128.533 121.460 138.571 1.00 0.00 H TER 48873 WAT 9798 ATOM 48873 O WAT 9799 139.071 66.602 74.306 1.00 0.00 O ATOM 48874 H1 WAT 9799 138.493 67.166 73.791 1.00 0.00 H ATOM 48875 H2 WAT 9799 139.934 67.010 74.228 1.00 0.00 H TER 48877 WAT 9799 ATOM 48877 O WAT 9800 33.313 60.935 137.745 1.00 0.00 O ATOM 48878 H1 WAT 9800 33.374 60.918 138.700 1.00 0.00 H ATOM 48879 H2 WAT 9800 32.454 61.318 137.566 1.00 0.00 H TER 48881 WAT 9800 ATOM 48881 O WAT 9801 7.924 26.985 138.220 1.00 0.00 O ATOM 48882 H1 WAT 9801 7.035 27.241 137.974 1.00 0.00 H ATOM 48883 H2 WAT 9801 8.453 27.181 137.446 1.00 0.00 H TER 48885 WAT 9801 ATOM 48885 O WAT 9802 44.574 140.385 77.786 1.00 0.00 O ATOM 48886 H1 WAT 9802 44.828 141.012 77.108 1.00 0.00 H ATOM 48887 H2 WAT 9802 43.617 140.401 77.781 1.00 0.00 H TER 48889 WAT 9802 ATOM 48889 O WAT 9803 2.156 18.900 64.303 1.00 0.00 O ATOM 48890 H1 WAT 9803 1.963 18.349 63.543 1.00 0.00 H ATOM 48891 H2 WAT 9803 2.341 19.763 63.932 1.00 0.00 H TER 48893 WAT 9803 ATOM 48893 O WAT 9804 17.184 121.177 92.248 1.00 0.00 O ATOM 48894 H1 WAT 9804 17.893 120.770 91.751 1.00 0.00 H ATOM 48895 H2 WAT 9804 17.273 120.817 93.131 1.00 0.00 H TER 48897 WAT 9804 ATOM 48897 O WAT 9805 41.154 111.923 111.427 1.00 0.00 O ATOM 48898 H1 WAT 9805 41.725 111.159 111.350 1.00 0.00 H ATOM 48899 H2 WAT 9805 41.719 112.609 111.784 1.00 0.00 H TER 48901 WAT 9805 ATOM 48901 O WAT 9806 69.374 52.500 5.200 1.00 0.00 O ATOM 48902 H1 WAT 9806 69.399 52.819 6.103 1.00 0.00 H ATOM 48903 H2 WAT 9806 68.695 53.026 4.779 1.00 0.00 H TER 48905 WAT 9806 ATOM 48905 O WAT 9807 34.199 131.392 141.402 1.00 0.00 O ATOM 48906 H1 WAT 9807 34.387 131.360 140.464 1.00 0.00 H ATOM 48907 H2 WAT 9807 34.816 132.038 141.748 1.00 0.00 H TER 48909 WAT 9807 ATOM 48909 O WAT 9808 126.465 114.660 158.298 1.00 0.00 O ATOM 48910 H1 WAT 9808 127.335 114.810 158.666 1.00 0.00 H ATOM 48911 H2 WAT 9808 126.604 114.007 157.612 1.00 0.00 H TER 48913 WAT 9808 ATOM 48913 O WAT 9809 6.392 53.370 11.517 1.00 0.00 O ATOM 48914 H1 WAT 9809 7.271 53.261 11.155 1.00 0.00 H ATOM 48915 H2 WAT 9809 6.113 54.234 11.213 1.00 0.00 H TER 48917 WAT 9809 ATOM 48917 O WAT 9810 55.217 83.595 78.487 1.00 0.00 O ATOM 48918 H1 WAT 9810 54.650 83.735 79.246 1.00 0.00 H ATOM 48919 H2 WAT 9810 55.632 84.444 78.338 1.00 0.00 H TER 48921 WAT 9810 ATOM 48921 O WAT 9811 1.562 140.596 106.189 1.00 0.00 O ATOM 48922 H1 WAT 9811 1.380 139.876 105.585 1.00 0.00 H ATOM 48923 H2 WAT 9811 0.817 140.601 106.789 1.00 0.00 H TER 48925 WAT 9811 ATOM 48925 O WAT 9812 145.794 25.348 84.041 1.00 0.00 O ATOM 48926 H1 WAT 9812 144.875 25.385 83.777 1.00 0.00 H ATOM 48927 H2 WAT 9812 145.780 25.514 84.984 1.00 0.00 H TER 48929 WAT 9812 ATOM 48929 O WAT 9813 33.868 49.030 89.643 1.00 0.00 O ATOM 48930 H1 WAT 9813 34.666 48.595 89.342 1.00 0.00 H ATOM 48931 H2 WAT 9813 33.186 48.363 89.559 1.00 0.00 H TER 48933 WAT 9813 ATOM 48933 O WAT 9814 28.829 23.792 107.062 1.00 0.00 O ATOM 48934 H1 WAT 9814 28.750 24.586 107.590 1.00 0.00 H ATOM 48935 H2 WAT 9814 28.936 23.088 107.702 1.00 0.00 H TER 48937 WAT 9814 ATOM 48937 O WAT 9815 30.738 31.029 7.513 1.00 0.00 O ATOM 48938 H1 WAT 9815 30.593 30.085 7.583 1.00 0.00 H ATOM 48939 H2 WAT 9815 29.859 31.400 7.438 1.00 0.00 H TER 48941 WAT 9815 ATOM 48941 O WAT 9816 48.211 124.220 102.513 1.00 0.00 O ATOM 48942 H1 WAT 9816 47.848 124.195 103.398 1.00 0.00 H ATOM 48943 H2 WAT 9816 49.043 123.752 102.582 1.00 0.00 H TER 48945 WAT 9816 ATOM 48945 O WAT 9817 119.194 16.794 122.736 1.00 0.00 O ATOM 48946 H1 WAT 9817 119.871 16.802 122.059 1.00 0.00 H ATOM 48947 H2 WAT 9817 118.400 16.520 122.277 1.00 0.00 H TER 48949 WAT 9817 ATOM 48949 O WAT 9818 131.111 116.967 69.726 1.00 0.00 O ATOM 48950 H1 WAT 9818 131.024 117.350 68.853 1.00 0.00 H ATOM 48951 H2 WAT 9818 130.318 116.443 69.838 1.00 0.00 H TER 48953 WAT 9818 ATOM 48953 O WAT 9819 127.198 25.139 7.229 1.00 0.00 O ATOM 48954 H1 WAT 9819 127.318 26.089 7.209 1.00 0.00 H ATOM 48955 H2 WAT 9819 128.087 24.787 7.275 1.00 0.00 H TER 48957 WAT 9819 ATOM 48957 O WAT 9820 43.192 72.519 71.095 1.00 0.00 O ATOM 48958 H1 WAT 9820 43.150 71.965 71.875 1.00 0.00 H ATOM 48959 H2 WAT 9820 43.060 73.408 71.425 1.00 0.00 H TER 48961 WAT 9820 ATOM 48961 O WAT 9821 42.759 129.548 59.284 1.00 0.00 O ATOM 48962 H1 WAT 9821 42.609 130.493 59.257 1.00 0.00 H ATOM 48963 H2 WAT 9821 42.900 129.301 58.370 1.00 0.00 H TER 48965 WAT 9821 ATOM 48965 O WAT 9822 117.934 13.883 104.256 1.00 0.00 O ATOM 48966 H1 WAT 9822 117.785 13.478 103.401 1.00 0.00 H ATOM 48967 H2 WAT 9822 117.470 14.719 104.210 1.00 0.00 H TER 48969 WAT 9822 ATOM 48969 O WAT 9823 63.122 89.719 146.515 1.00 0.00 O ATOM 48970 H1 WAT 9823 63.577 90.243 147.174 1.00 0.00 H ATOM 48971 H2 WAT 9823 62.267 89.536 146.904 1.00 0.00 H TER 48973 WAT 9823 ATOM 48973 O WAT 9824 110.957 44.999 66.899 1.00 0.00 O ATOM 48974 H1 WAT 9824 110.503 44.234 66.546 1.00 0.00 H ATOM 48975 H2 WAT 9824 110.378 45.324 67.588 1.00 0.00 H TER 48977 WAT 9824 ATOM 48977 O WAT 9825 29.907 37.529 152.740 1.00 0.00 O ATOM 48978 H1 WAT 9825 28.982 37.301 152.832 1.00 0.00 H ATOM 48979 H2 WAT 9825 29.934 38.121 151.988 1.00 0.00 H TER 48981 WAT 9825 ATOM 48981 O WAT 9826 103.716 83.973 6.861 1.00 0.00 O ATOM 48982 H1 WAT 9826 104.091 84.158 7.722 1.00 0.00 H ATOM 48983 H2 WAT 9826 102.913 83.486 7.049 1.00 0.00 H TER 48985 WAT 9826 ATOM 48985 O WAT 9827 103.327 122.620 11.978 1.00 0.00 O ATOM 48986 H1 WAT 9827 102.726 123.359 12.069 1.00 0.00 H ATOM 48987 H2 WAT 9827 103.133 122.259 11.112 1.00 0.00 H TER 48989 WAT 9827 ATOM 48989 O WAT 9828 110.680 28.671 4.499 1.00 0.00 O ATOM 48990 H1 WAT 9828 111.633 28.663 4.409 1.00 0.00 H ATOM 48991 H2 WAT 9828 110.355 28.645 3.599 1.00 0.00 H TER 48993 WAT 9828 ATOM 48993 O WAT 9829 130.885 73.004 66.525 1.00 0.00 O ATOM 48994 H1 WAT 9829 131.084 72.216 66.019 1.00 0.00 H ATOM 48995 H2 WAT 9829 130.988 72.735 67.438 1.00 0.00 H TER 48997 WAT 9829 ATOM 48997 O WAT 9830 59.072 79.300 2.236 1.00 0.00 O ATOM 48998 H1 WAT 9830 58.614 79.648 3.002 1.00 0.00 H ATOM 48999 H2 WAT 9830 59.999 79.443 2.426 1.00 0.00 H TER 49001 WAT 9830 ATOM 49001 O WAT 9831 137.849 83.145 81.210 1.00 0.00 O ATOM 49002 H1 WAT 9831 137.404 83.310 80.379 1.00 0.00 H ATOM 49003 H2 WAT 9831 137.144 82.935 81.822 1.00 0.00 H TER 49005 WAT 9831 ATOM 49005 O WAT 9832 56.319 37.879 74.013 1.00 0.00 O ATOM 49006 H1 WAT 9832 56.813 38.697 73.962 1.00 0.00 H ATOM 49007 H2 WAT 9832 56.969 37.196 73.846 1.00 0.00 H TER 49009 WAT 9832 ATOM 49009 O WAT 9833 105.544 137.471 101.876 1.00 0.00 O ATOM 49010 H1 WAT 9833 105.411 138.389 101.640 1.00 0.00 H ATOM 49011 H2 WAT 9833 104.961 136.987 101.291 1.00 0.00 H TER 49013 WAT 9833 ATOM 49013 O WAT 9834 121.037 11.732 72.441 1.00 0.00 O ATOM 49014 H1 WAT 9834 120.353 11.670 71.774 1.00 0.00 H ATOM 49015 H2 WAT 9834 121.052 12.658 72.682 1.00 0.00 H TER 49017 WAT 9834 ATOM 49017 O WAT 9835 29.825 46.785 103.225 1.00 0.00 O ATOM 49018 H1 WAT 9835 29.622 47.360 103.963 1.00 0.00 H ATOM 49019 H2 WAT 9835 29.223 47.062 102.533 1.00 0.00 H TER 49021 WAT 9835 ATOM 49021 O WAT 9836 42.493 116.850 57.328 1.00 0.00 O ATOM 49022 H1 WAT 9836 41.806 116.834 56.661 1.00 0.00 H ATOM 49023 H2 WAT 9836 43.121 116.187 57.042 1.00 0.00 H TER 49025 WAT 9836 ATOM 49025 O WAT 9837 90.616 31.528 7.544 1.00 0.00 O ATOM 49026 H1 WAT 9837 90.762 30.910 6.827 1.00 0.00 H ATOM 49027 H2 WAT 9837 90.666 32.390 7.130 1.00 0.00 H TER 49029 WAT 9837 ATOM 49029 O WAT 9838 5.166 99.201 4.061 1.00 0.00 O ATOM 49030 H1 WAT 9838 5.655 98.649 3.451 1.00 0.00 H ATOM 49031 H2 WAT 9838 5.731 99.959 4.205 1.00 0.00 H TER 49033 WAT 9838 ATOM 49033 O WAT 9839 91.586 62.970 128.719 1.00 0.00 O ATOM 49034 H1 WAT 9839 92.531 62.852 128.628 1.00 0.00 H ATOM 49035 H2 WAT 9839 91.417 63.839 128.353 1.00 0.00 H TER 49037 WAT 9839 ATOM 49037 O WAT 9840 134.744 32.358 79.227 1.00 0.00 O ATOM 49038 H1 WAT 9840 135.410 32.331 79.914 1.00 0.00 H ATOM 49039 H2 WAT 9840 134.212 31.577 79.378 1.00 0.00 H TER 49041 WAT 9840 ATOM 49041 O WAT 9841 21.666 61.707 109.068 1.00 0.00 O ATOM 49042 H1 WAT 9841 21.892 61.039 108.421 1.00 0.00 H ATOM 49043 H2 WAT 9841 20.738 61.559 109.251 1.00 0.00 H TER 49045 WAT 9841 ATOM 49045 O WAT 9842 143.397 98.008 87.745 1.00 0.00 O ATOM 49046 H1 WAT 9842 142.624 97.758 88.251 1.00 0.00 H ATOM 49047 H2 WAT 9842 143.199 98.889 87.427 1.00 0.00 H TER 49049 WAT 9842 ATOM 49049 O WAT 9843 143.092 99.640 20.214 1.00 0.00 O ATOM 49050 H1 WAT 9843 143.121 99.072 20.983 1.00 0.00 H ATOM 49051 H2 WAT 9843 143.171 100.527 20.567 1.00 0.00 H TER 49053 WAT 9843 ATOM 49053 O WAT 9844 115.046 41.607 132.660 1.00 0.00 O ATOM 49054 H1 WAT 9844 114.697 40.962 133.275 1.00 0.00 H ATOM 49055 H2 WAT 9844 115.982 41.645 132.859 1.00 0.00 H TER 49057 WAT 9844 ATOM 49057 O WAT 9845 9.750 105.657 112.272 1.00 0.00 O ATOM 49058 H1 WAT 9845 10.190 104.888 112.634 1.00 0.00 H ATOM 49059 H2 WAT 9845 8.825 105.523 112.476 1.00 0.00 H TER 49061 WAT 9845 ATOM 49061 O WAT 9846 72.820 132.447 94.456 1.00 0.00 O ATOM 49062 H1 WAT 9846 73.706 132.577 94.117 1.00 0.00 H ATOM 49063 H2 WAT 9846 72.862 131.610 94.920 1.00 0.00 H TER 49065 WAT 9846 ATOM 49065 O WAT 9847 137.579 125.594 98.423 1.00 0.00 O ATOM 49066 H1 WAT 9847 137.520 124.813 97.873 1.00 0.00 H ATOM 49067 H2 WAT 9847 137.478 125.266 99.316 1.00 0.00 H TER 49069 WAT 9847 ATOM 49069 O WAT 9848 75.420 97.027 101.544 1.00 0.00 O ATOM 49070 H1 WAT 9848 76.266 97.473 101.510 1.00 0.00 H ATOM 49071 H2 WAT 9848 74.880 97.488 100.903 1.00 0.00 H TER 49073 WAT 9848 ATOM 49073 O WAT 9849 61.562 19.575 137.632 1.00 0.00 O ATOM 49074 H1 WAT 9849 61.874 18.681 137.489 1.00 0.00 H ATOM 49075 H2 WAT 9849 61.072 19.787 136.838 1.00 0.00 H TER 49077 WAT 9849 ATOM 49077 O WAT 9850 73.212 70.904 147.956 1.00 0.00 O ATOM 49078 H1 WAT 9850 73.396 70.096 148.435 1.00 0.00 H ATOM 49079 H2 WAT 9850 73.268 70.654 147.034 1.00 0.00 H TER 49081 WAT 9850 ATOM 49081 O WAT 9851 51.344 31.766 152.285 1.00 0.00 O ATOM 49082 H1 WAT 9851 51.861 32.440 151.844 1.00 0.00 H ATOM 49083 H2 WAT 9851 50.935 31.274 151.574 1.00 0.00 H TER 49085 WAT 9851 ATOM 49085 O WAT 9852 57.440 143.708 85.056 1.00 0.00 O ATOM 49086 H1 WAT 9852 56.581 143.441 84.728 1.00 0.00 H ATOM 49087 H2 WAT 9852 57.377 143.604 86.005 1.00 0.00 H TER 49089 WAT 9852 ATOM 49089 O WAT 9853 134.730 108.944 99.452 1.00 0.00 O ATOM 49090 H1 WAT 9853 135.172 108.854 100.297 1.00 0.00 H ATOM 49091 H2 WAT 9853 135.060 108.212 98.930 1.00 0.00 H TER 49093 WAT 9853 ATOM 49093 O WAT 9854 23.810 106.858 77.402 1.00 0.00 O ATOM 49094 H1 WAT 9854 22.984 106.458 77.672 1.00 0.00 H ATOM 49095 H2 WAT 9854 24.473 106.198 77.606 1.00 0.00 H TER 49097 WAT 9854 ATOM 49097 O WAT 9855 72.340 79.746 8.716 1.00 0.00 O ATOM 49098 H1 WAT 9855 73.092 79.282 9.084 1.00 0.00 H ATOM 49099 H2 WAT 9855 72.586 80.671 8.756 1.00 0.00 H TER 49101 WAT 9855 ATOM 49101 O WAT 9856 36.006 142.546 81.693 1.00 0.00 O ATOM 49102 H1 WAT 9856 35.081 142.748 81.554 1.00 0.00 H ATOM 49103 H2 WAT 9856 36.016 141.998 82.478 1.00 0.00 H TER 49105 WAT 9856 ATOM 49105 O WAT 9857 47.653 38.446 115.865 1.00 0.00 O ATOM 49106 H1 WAT 9857 47.730 39.365 115.608 1.00 0.00 H ATOM 49107 H2 WAT 9857 47.814 38.447 116.809 1.00 0.00 H TER 49109 WAT 9857 ATOM 49109 O WAT 9858 28.407 29.381 139.046 1.00 0.00 O ATOM 49110 H1 WAT 9858 27.794 28.819 139.521 1.00 0.00 H ATOM 49111 H2 WAT 9858 27.851 30.030 138.614 1.00 0.00 H TER 49113 WAT 9858 ATOM 49113 O WAT 9859 58.850 15.996 57.589 1.00 0.00 O ATOM 49114 H1 WAT 9859 59.034 15.091 57.839 1.00 0.00 H ATOM 49115 H2 WAT 9859 59.693 16.339 57.293 1.00 0.00 H TER 49117 WAT 9859 ATOM 49117 O WAT 9860 143.787 124.360 9.030 1.00 0.00 O ATOM 49118 H1 WAT 9860 144.175 124.007 9.831 1.00 0.00 H ATOM 49119 H2 WAT 9860 143.759 125.306 9.175 1.00 0.00 H TER 49121 WAT 9860 ATOM 49121 O WAT 9861 26.501 39.383 19.284 1.00 0.00 O ATOM 49122 H1 WAT 9861 26.501 38.450 19.070 1.00 0.00 H ATOM 49123 H2 WAT 9861 27.426 39.605 19.387 1.00 0.00 H TER 49125 WAT 9861 ATOM 49125 O WAT 9862 33.699 126.046 67.897 1.00 0.00 O ATOM 49126 H1 WAT 9862 33.997 126.941 68.061 1.00 0.00 H ATOM 49127 H2 WAT 9862 34.185 125.770 67.120 1.00 0.00 H TER 49129 WAT 9862 ATOM 49129 O WAT 9863 15.038 40.245 12.022 1.00 0.00 O ATOM 49130 H1 WAT 9863 14.856 39.728 11.237 1.00 0.00 H ATOM 49131 H2 WAT 9863 14.238 40.751 12.166 1.00 0.00 H TER 49133 WAT 9863 ATOM 49133 O WAT 9864 9.759 82.738 128.375 1.00 0.00 O ATOM 49134 H1 WAT 9864 10.021 83.644 128.214 1.00 0.00 H ATOM 49135 H2 WAT 9864 9.307 82.473 127.574 1.00 0.00 H TER 49137 WAT 9864 ATOM 49137 O WAT 9865 16.547 83.769 120.132 1.00 0.00 O ATOM 49138 H1 WAT 9865 15.771 83.772 119.572 1.00 0.00 H ATOM 49139 H2 WAT 9865 16.679 84.689 120.363 1.00 0.00 H TER 49141 WAT 9865 ATOM 49141 O WAT 9866 37.759 31.887 104.570 1.00 0.00 O ATOM 49142 H1 WAT 9866 38.646 31.864 104.211 1.00 0.00 H ATOM 49143 H2 WAT 9866 37.409 31.012 104.403 1.00 0.00 H TER 49145 WAT 9866 ATOM 49145 O WAT 9867 74.398 45.610 62.470 1.00 0.00 O ATOM 49146 H1 WAT 9867 75.187 45.149 62.187 1.00 0.00 H ATOM 49147 H2 WAT 9867 74.580 46.532 62.285 1.00 0.00 H TER 49149 WAT 9867 ATOM 49149 O WAT 9868 82.946 103.133 84.066 1.00 0.00 O ATOM 49150 H1 WAT 9868 82.011 103.328 83.998 1.00 0.00 H ATOM 49151 H2 WAT 9868 83.308 103.865 84.565 1.00 0.00 H TER 49153 WAT 9868 ATOM 49153 O WAT 9869 131.239 136.697 92.373 1.00 0.00 O ATOM 49154 H1 WAT 9869 131.071 136.222 93.187 1.00 0.00 H ATOM 49155 H2 WAT 9869 131.008 136.076 91.681 1.00 0.00 H TER 49157 WAT 9869 ATOM 49157 O WAT 9870 95.669 52.485 156.555 1.00 0.00 O ATOM 49158 H1 WAT 9870 95.257 52.878 155.786 1.00 0.00 H ATOM 49159 H2 WAT 9870 95.100 51.748 156.781 1.00 0.00 H TER 49161 WAT 9870 ATOM 49161 O WAT 9871 27.378 113.253 133.140 1.00 0.00 O ATOM 49162 H1 WAT 9871 27.453 114.035 132.592 1.00 0.00 H ATOM 49163 H2 WAT 9871 27.105 112.563 132.536 1.00 0.00 H TER 49165 WAT 9871 ATOM 49165 O WAT 9872 99.562 142.677 99.840 1.00 0.00 O ATOM 49166 H1 WAT 9872 100.453 142.828 100.157 1.00 0.00 H ATOM 49167 H2 WAT 9872 99.000 142.954 100.564 1.00 0.00 H TER 49169 WAT 9872 ATOM 49169 O WAT 9873 33.044 35.758 98.365 1.00 0.00 O ATOM 49170 H1 WAT 9873 33.186 36.382 99.077 1.00 0.00 H ATOM 49171 H2 WAT 9873 33.624 36.057 97.665 1.00 0.00 H TER 49173 WAT 9873 ATOM 49173 O WAT 9874 23.910 66.368 112.111 1.00 0.00 O ATOM 49174 H1 WAT 9874 24.564 67.054 112.248 1.00 0.00 H ATOM 49175 H2 WAT 9874 24.103 65.716 112.785 1.00 0.00 H TER 49177 WAT 9874 ATOM 49177 O WAT 9875 61.767 79.147 87.843 1.00 0.00 O ATOM 49178 H1 WAT 9875 61.182 78.805 88.519 1.00 0.00 H ATOM 49179 H2 WAT 9875 62.645 78.917 88.148 1.00 0.00 H TER 49181 WAT 9875 ATOM 49181 O WAT 9876 81.619 134.678 115.943 1.00 0.00 O ATOM 49182 H1 WAT 9876 81.272 133.856 116.289 1.00 0.00 H ATOM 49183 H2 WAT 9876 82.553 134.650 116.150 1.00 0.00 H TER 49185 WAT 9876 ATOM 49185 O WAT 9877 62.337 140.423 157.940 1.00 0.00 O ATOM 49186 H1 WAT 9877 62.143 139.601 158.390 1.00 0.00 H ATOM 49187 H2 WAT 9877 63.173 140.264 157.502 1.00 0.00 H TER 49189 WAT 9877 ATOM 49189 O WAT 9878 144.507 142.208 140.249 1.00 0.00 O ATOM 49190 H1 WAT 9878 143.583 142.165 140.003 1.00 0.00 H ATOM 49191 H2 WAT 9878 144.496 142.349 141.195 1.00 0.00 H TER 49193 WAT 9878 ATOM 49193 O WAT 9879 120.937 133.203 13.575 1.00 0.00 O ATOM 49194 H1 WAT 9879 119.983 133.222 13.492 1.00 0.00 H ATOM 49195 H2 WAT 9879 121.142 133.945 14.145 1.00 0.00 H TER 49197 WAT 9879 ATOM 49197 O WAT 9880 14.197 118.554 5.253 1.00 0.00 O ATOM 49198 H1 WAT 9880 14.887 118.179 4.705 1.00 0.00 H ATOM 49199 H2 WAT 9880 14.630 119.262 5.731 1.00 0.00 H TER 49201 WAT 9880 ATOM 49201 O WAT 9881 32.407 88.510 57.888 1.00 0.00 O ATOM 49202 H1 WAT 9881 31.977 89.281 58.260 1.00 0.00 H ATOM 49203 H2 WAT 9881 32.275 88.594 56.944 1.00 0.00 H TER 49205 WAT 9881 ATOM 49205 O WAT 9882 3.268 144.127 87.554 1.00 0.00 O ATOM 49206 H1 WAT 9882 2.397 143.732 87.613 1.00 0.00 H ATOM 49207 H2 WAT 9882 3.120 144.970 87.125 1.00 0.00 H TER 49209 WAT 9882 ATOM 49209 O WAT 9883 89.715 25.540 123.571 1.00 0.00 O ATOM 49210 H1 WAT 9883 89.418 26.101 124.288 1.00 0.00 H ATOM 49211 H2 WAT 9883 90.469 26.001 123.203 1.00 0.00 H TER 49213 WAT 9883 ATOM 49213 O WAT 9884 93.286 18.589 5.990 1.00 0.00 O ATOM 49214 H1 WAT 9884 93.432 19.267 6.649 1.00 0.00 H ATOM 49215 H2 WAT 9884 94.162 18.370 5.672 1.00 0.00 H TER 49217 WAT 9884 ATOM 49217 O WAT 9885 64.008 130.852 124.189 1.00 0.00 O ATOM 49218 H1 WAT 9885 63.481 131.513 123.740 1.00 0.00 H ATOM 49219 H2 WAT 9885 63.460 130.067 124.187 1.00 0.00 H TER 49221 WAT 9885 ATOM 49221 O WAT 9886 121.016 34.598 130.660 1.00 0.00 O ATOM 49222 H1 WAT 9886 120.935 35.505 130.954 1.00 0.00 H ATOM 49223 H2 WAT 9886 121.830 34.581 130.157 1.00 0.00 H TER 49225 WAT 9886 ATOM 49225 O WAT 9887 107.857 30.707 127.128 1.00 0.00 O ATOM 49226 H1 WAT 9887 107.499 29.956 126.655 1.00 0.00 H ATOM 49227 H2 WAT 9887 107.606 31.465 126.601 1.00 0.00 H TER 49229 WAT 9887 ATOM 49229 O WAT 9888 44.638 87.384 142.961 1.00 0.00 O ATOM 49230 H1 WAT 9888 45.570 87.583 142.870 1.00 0.00 H ATOM 49231 H2 WAT 9888 44.243 87.713 142.153 1.00 0.00 H TER 49233 WAT 9888 ATOM 49233 O WAT 9889 125.325 41.872 139.634 1.00 0.00 O ATOM 49234 H1 WAT 9889 124.494 42.303 139.833 1.00 0.00 H ATOM 49235 H2 WAT 9889 125.240 40.999 140.017 1.00 0.00 H TER 49237 WAT 9889 ATOM 49237 O WAT 9890 40.721 11.228 153.570 1.00 0.00 O ATOM 49238 H1 WAT 9890 39.976 11.634 153.128 1.00 0.00 H ATOM 49239 H2 WAT 9890 40.886 10.426 153.074 1.00 0.00 H TER 49241 WAT 9890 ATOM 49241 O WAT 9891 78.894 50.891 133.811 1.00 0.00 O ATOM 49242 H1 WAT 9891 79.658 50.408 134.126 1.00 0.00 H ATOM 49243 H2 WAT 9891 78.882 51.690 134.338 1.00 0.00 H TER 49245 WAT 9891 ATOM 49245 O WAT 9892 40.858 53.726 4.154 1.00 0.00 O ATOM 49246 H1 WAT 9892 40.570 53.481 5.034 1.00 0.00 H ATOM 49247 H2 WAT 9892 40.712 54.671 4.109 1.00 0.00 H TER 49249 WAT 9892 ATOM 49249 O WAT 9893 142.209 140.787 115.215 1.00 0.00 O ATOM 49250 H1 WAT 9893 141.941 140.020 115.720 1.00 0.00 H ATOM 49251 H2 WAT 9893 141.813 140.656 114.353 1.00 0.00 H TER 49253 WAT 9893 ATOM 49253 O WAT 9894 76.644 126.150 73.200 1.00 0.00 O ATOM 49254 H1 WAT 9894 76.891 125.946 74.102 1.00 0.00 H ATOM 49255 H2 WAT 9894 77.010 125.431 72.683 1.00 0.00 H TER 49257 WAT 9894 ATOM 49257 O WAT 9895 68.524 104.170 149.384 1.00 0.00 O ATOM 49258 H1 WAT 9895 68.327 103.748 148.548 1.00 0.00 H ATOM 49259 H2 WAT 9895 68.079 105.016 149.337 1.00 0.00 H TER 49261 WAT 9895 ATOM 49261 O WAT 9896 144.208 92.676 5.223 1.00 0.00 O ATOM 49262 H1 WAT 9896 144.658 92.698 6.067 1.00 0.00 H ATOM 49263 H2 WAT 9896 143.401 92.190 5.394 1.00 0.00 H TER 49265 WAT 9896 ATOM 49265 O WAT 9897 64.250 101.969 94.708 1.00 0.00 O ATOM 49266 H1 WAT 9897 64.048 101.380 95.435 1.00 0.00 H ATOM 49267 H2 WAT 9897 64.575 102.765 95.129 1.00 0.00 H TER 49269 WAT 9897 ATOM 49269 O WAT 9898 85.881 39.285 120.979 1.00 0.00 O ATOM 49270 H1 WAT 9898 86.434 38.743 120.416 1.00 0.00 H ATOM 49271 H2 WAT 9898 86.162 39.071 121.869 1.00 0.00 H TER 49273 WAT 9898 ATOM 49273 O WAT 9899 143.520 84.755 107.261 1.00 0.00 O ATOM 49274 H1 WAT 9899 143.145 84.121 107.872 1.00 0.00 H ATOM 49275 H2 WAT 9899 144.463 84.594 107.297 1.00 0.00 H TER 49277 WAT 9899 ATOM 49277 O WAT 9900 106.832 96.921 5.248 1.00 0.00 O ATOM 49278 H1 WAT 9900 107.331 96.148 5.514 1.00 0.00 H ATOM 49279 H2 WAT 9900 107.164 97.130 4.374 1.00 0.00 H TER 49281 WAT 9900 ATOM 49281 O WAT 9901 87.787 2.771 76.016 1.00 0.00 O ATOM 49282 H1 WAT 9901 88.031 3.052 75.134 1.00 0.00 H ATOM 49283 H2 WAT 9901 86.846 2.606 75.962 1.00 0.00 H TER 49285 WAT 9901 ATOM 49285 O WAT 9902 115.846 16.980 17.114 1.00 0.00 O ATOM 49286 H1 WAT 9902 116.008 17.456 16.300 1.00 0.00 H ATOM 49287 H2 WAT 9902 115.011 17.324 17.431 1.00 0.00 H TER 49289 WAT 9902 ATOM 49289 O WAT 9903 52.894 40.021 15.846 1.00 0.00 O ATOM 49290 H1 WAT 9903 53.551 39.622 16.417 1.00 0.00 H ATOM 49291 H2 WAT 9903 52.927 39.501 15.043 1.00 0.00 H TER 49293 WAT 9903 ATOM 49293 O WAT 9904 55.597 64.095 31.326 1.00 0.00 O ATOM 49294 H1 WAT 9904 55.739 64.150 30.381 1.00 0.00 H ATOM 49295 H2 WAT 9904 54.747 64.512 31.466 1.00 0.00 H TER 49297 WAT 9904 ATOM 49297 O WAT 9905 44.543 120.149 7.879 1.00 0.00 O ATOM 49298 H1 WAT 9905 44.246 119.259 8.072 1.00 0.00 H ATOM 49299 H2 WAT 9905 44.437 120.236 6.931 1.00 0.00 H TER 49301 WAT 9905 ATOM 49301 O WAT 9906 110.941 80.475 9.667 1.00 0.00 O ATOM 49302 H1 WAT 9906 111.024 81.385 9.385 1.00 0.00 H ATOM 49303 H2 WAT 9906 110.311 80.504 10.388 1.00 0.00 H TER 49305 WAT 9906 ATOM 49305 O WAT 9907 90.631 68.822 70.043 1.00 0.00 O ATOM 49306 H1 WAT 9907 91.303 68.762 70.722 1.00 0.00 H ATOM 49307 H2 WAT 9907 91.095 69.154 69.275 1.00 0.00 H TER 49309 WAT 9907 ATOM 49309 O WAT 9908 49.302 136.115 71.750 1.00 0.00 O ATOM 49310 H1 WAT 9908 48.963 135.955 70.869 1.00 0.00 H ATOM 49311 H2 WAT 9908 50.181 136.468 71.608 1.00 0.00 H TER 49313 WAT 9908 ATOM 49313 O WAT 9909 96.405 13.316 156.853 1.00 0.00 O ATOM 49314 H1 WAT 9909 97.259 12.883 156.865 1.00 0.00 H ATOM 49315 H2 WAT 9909 95.778 12.606 156.711 1.00 0.00 H TER 49317 WAT 9909 ATOM 49317 O WAT 9910 111.098 116.445 67.954 1.00 0.00 O ATOM 49318 H1 WAT 9910 112.019 116.648 68.114 1.00 0.00 H ATOM 49319 H2 WAT 9910 110.858 115.846 68.661 1.00 0.00 H TER 49321 WAT 9910 ATOM 49321 O WAT 9911 142.855 10.858 108.738 1.00 0.00 O ATOM 49322 H1 WAT 9911 142.613 11.646 109.225 1.00 0.00 H ATOM 49323 H2 WAT 9911 142.297 10.876 107.960 1.00 0.00 H TER 49325 WAT 9911 ATOM 49325 O WAT 9912 22.676 103.747 8.826 1.00 0.00 O ATOM 49326 H1 WAT 9912 22.895 102.867 9.132 1.00 0.00 H ATOM 49327 H2 WAT 9912 21.757 103.688 8.566 1.00 0.00 H TER 49329 WAT 9912 ATOM 49329 O WAT 9913 12.649 47.240 112.637 1.00 0.00 O ATOM 49330 H1 WAT 9913 12.829 46.897 111.762 1.00 0.00 H ATOM 49331 H2 WAT 9913 13.427 47.015 113.147 1.00 0.00 H TER 49333 WAT 9913 ATOM 49333 O WAT 9914 139.053 132.680 141.193 1.00 0.00 O ATOM 49334 H1 WAT 9914 138.443 132.176 140.655 1.00 0.00 H ATOM 49335 H2 WAT 9914 138.938 132.332 142.077 1.00 0.00 H TER 49337 WAT 9914 ATOM 49337 O WAT 9915 125.612 113.377 8.883 1.00 0.00 O ATOM 49338 H1 WAT 9915 126.422 113.176 9.351 1.00 0.00 H ATOM 49339 H2 WAT 9915 125.487 112.635 8.291 1.00 0.00 H TER 49341 WAT 9915 ATOM 49341 O WAT 9916 98.156 93.091 133.602 1.00 0.00 O ATOM 49342 H1 WAT 9916 97.299 92.717 133.807 1.00 0.00 H ATOM 49343 H2 WAT 9916 98.106 93.994 133.916 1.00 0.00 H TER 49345 WAT 9916 ATOM 49345 O WAT 9917 132.881 101.326 20.235 1.00 0.00 O ATOM 49346 H1 WAT 9917 133.406 101.253 21.033 1.00 0.00 H ATOM 49347 H2 WAT 9917 132.524 100.448 20.103 1.00 0.00 H TER 49349 WAT 9917 ATOM 49349 O WAT 9918 142.529 66.254 129.888 1.00 0.00 O ATOM 49350 H1 WAT 9918 141.834 65.626 129.689 1.00 0.00 H ATOM 49351 H2 WAT 9918 143.282 65.945 129.384 1.00 0.00 H TER 49353 WAT 9918 ATOM 49353 O WAT 9919 52.957 69.416 93.500 1.00 0.00 O ATOM 49354 H1 WAT 9919 53.695 69.983 93.720 1.00 0.00 H ATOM 49355 H2 WAT 9919 52.322 69.565 94.201 1.00 0.00 H TER 49357 WAT 9919 ATOM 49357 O WAT 9920 84.701 75.559 125.756 1.00 0.00 O ATOM 49358 H1 WAT 9920 85.481 75.039 125.561 1.00 0.00 H ATOM 49359 H2 WAT 9920 84.014 74.911 125.911 1.00 0.00 H TER 49361 WAT 9920 ATOM 49361 O WAT 9921 16.391 32.085 8.491 1.00 0.00 O ATOM 49362 H1 WAT 9921 16.082 31.231 8.793 1.00 0.00 H ATOM 49363 H2 WAT 9921 17.026 31.881 7.805 1.00 0.00 H TER 49365 WAT 9921 ATOM 49365 O WAT 9922 65.347 98.911 134.370 1.00 0.00 O ATOM 49366 H1 WAT 9922 65.332 99.863 134.469 1.00 0.00 H ATOM 49367 H2 WAT 9922 65.672 98.588 135.210 1.00 0.00 H TER 49369 WAT 9922 ATOM 49369 O WAT 9923 71.227 1.298 98.315 1.00 0.00 O ATOM 49370 H1 WAT 9923 71.196 1.958 97.622 1.00 0.00 H ATOM 49371 H2 WAT 9923 70.908 0.498 97.898 1.00 0.00 H TER 49373 WAT 9923 ATOM 49373 O WAT 9924 19.134 132.761 112.151 1.00 0.00 O ATOM 49374 H1 WAT 9924 18.699 132.406 111.375 1.00 0.00 H ATOM 49375 H2 WAT 9924 19.742 132.073 112.420 1.00 0.00 H TER 49377 WAT 9924 ATOM 49377 O WAT 9925 77.277 125.973 147.853 1.00 0.00 O ATOM 49378 H1 WAT 9925 76.652 126.039 147.130 1.00 0.00 H ATOM 49379 H2 WAT 9925 78.024 125.505 147.481 1.00 0.00 H TER 49381 WAT 9925 ATOM 49381 O WAT 9926 114.811 41.618 62.763 1.00 0.00 O ATOM 49382 H1 WAT 9926 115.009 42.553 62.823 1.00 0.00 H ATOM 49383 H2 WAT 9926 114.274 41.437 63.535 1.00 0.00 H TER 49385 WAT 9926 ATOM 49385 O WAT 9927 27.911 76.158 74.423 1.00 0.00 O ATOM 49386 H1 WAT 9927 28.653 76.405 73.871 1.00 0.00 H ATOM 49387 H2 WAT 9927 27.632 75.308 74.084 1.00 0.00 H TER 49389 WAT 9927 ATOM 49389 O WAT 9928 90.057 86.352 150.589 1.00 0.00 O ATOM 49390 H1 WAT 9928 89.516 86.681 149.872 1.00 0.00 H ATOM 49391 H2 WAT 9928 90.867 86.859 150.531 1.00 0.00 H TER 49393 WAT 9928 ATOM 49393 O WAT 9929 3.472 71.949 2.216 1.00 0.00 O ATOM 49394 H1 WAT 9929 4.210 72.078 1.620 1.00 0.00 H ATOM 49395 H2 WAT 9929 3.844 71.473 2.958 1.00 0.00 H TER 49397 WAT 9929 ATOM 49397 O WAT 9930 7.639 66.321 10.633 1.00 0.00 O ATOM 49398 H1 WAT 9930 7.010 66.897 11.067 1.00 0.00 H ATOM 49399 H2 WAT 9930 7.588 66.563 9.709 1.00 0.00 H TER 49401 WAT 9930 ATOM 49401 O WAT 9931 138.261 98.281 29.040 1.00 0.00 O ATOM 49402 H1 WAT 9931 137.663 99.023 29.135 1.00 0.00 H ATOM 49403 H2 WAT 9931 138.797 98.302 29.832 1.00 0.00 H TER 49405 WAT 9931 ATOM 49405 O WAT 9932 45.514 40.011 104.019 1.00 0.00 O ATOM 49406 H1 WAT 9932 45.565 40.855 104.467 1.00 0.00 H ATOM 49407 H2 WAT 9932 45.881 40.178 103.151 1.00 0.00 H TER 49409 WAT 9932 ATOM 49409 O WAT 9933 57.356 14.796 55.290 1.00 0.00 O ATOM 49410 H1 WAT 9933 57.769 15.201 56.053 1.00 0.00 H ATOM 49411 H2 WAT 9933 57.028 15.534 54.776 1.00 0.00 H TER 49413 WAT 9933 ATOM 49413 O WAT 9934 127.997 106.097 80.902 1.00 0.00 O ATOM 49414 H1 WAT 9934 128.258 105.176 80.890 1.00 0.00 H ATOM 49415 H2 WAT 9934 128.817 106.580 80.808 1.00 0.00 H TER 49417 WAT 9934 ATOM 49417 O WAT 9935 42.232 13.972 63.181 1.00 0.00 O ATOM 49418 H1 WAT 9935 42.584 13.086 63.095 1.00 0.00 H ATOM 49419 H2 WAT 9935 41.624 14.060 62.447 1.00 0.00 H TER 49421 WAT 9935 ATOM 49421 O WAT 9936 37.799 131.714 0.606 1.00 0.00 O ATOM 49422 H1 WAT 9936 38.481 132.165 1.104 1.00 0.00 H ATOM 49423 H2 WAT 9936 37.232 131.327 1.273 1.00 0.00 H TER 49425 WAT 9936 ATOM 49425 O WAT 9937 114.292 80.000 143.658 1.00 0.00 O ATOM 49426 H1 WAT 9937 115.097 80.000 143.141 1.00 0.00 H ATOM 49427 H2 WAT 9937 113.627 79.645 143.068 1.00 0.00 H TER 49429 WAT 9937 ATOM 49429 O WAT 9938 123.553 52.174 101.516 1.00 0.00 O ATOM 49430 H1 WAT 9938 123.519 51.985 100.579 1.00 0.00 H ATOM 49431 H2 WAT 9938 123.412 53.119 101.576 1.00 0.00 H TER 49433 WAT 9938 ATOM 49433 O WAT 9939 7.516 49.735 134.594 1.00 0.00 O ATOM 49434 H1 WAT 9939 8.390 50.060 134.810 1.00 0.00 H ATOM 49435 H2 WAT 9939 6.932 50.206 135.188 1.00 0.00 H TER 49437 WAT 9939 ATOM 49437 O WAT 9940 131.688 54.193 112.429 1.00 0.00 O ATOM 49438 H1 WAT 9940 132.153 54.975 112.132 1.00 0.00 H ATOM 49439 H2 WAT 9940 132.357 53.673 112.876 1.00 0.00 H TER 49441 WAT 9940 ATOM 49441 O WAT 9941 11.016 76.011 9.603 1.00 0.00 O ATOM 49442 H1 WAT 9941 11.715 76.176 10.236 1.00 0.00 H ATOM 49443 H2 WAT 9941 10.384 75.473 10.080 1.00 0.00 H TER 49445 WAT 9941 ATOM 49445 O WAT 9942 136.312 61.943 150.621 1.00 0.00 O ATOM 49446 H1 WAT 9942 136.239 61.028 150.893 1.00 0.00 H ATOM 49447 H2 WAT 9942 136.791 62.367 151.334 1.00 0.00 H TER 49449 WAT 9942 ATOM 49449 O WAT 9943 139.065 31.211 0.598 1.00 0.00 O ATOM 49450 H1 WAT 9943 138.735 30.363 0.893 1.00 0.00 H ATOM 49451 H2 WAT 9943 140.015 31.145 0.694 1.00 0.00 H TER 49453 WAT 9943 ATOM 49453 O WAT 9944 78.486 41.065 98.641 1.00 0.00 O ATOM 49454 H1 WAT 9944 77.962 41.817 98.918 1.00 0.00 H ATOM 49455 H2 WAT 9944 79.232 41.059 99.241 1.00 0.00 H TER 49457 WAT 9944 ATOM 49457 O WAT 9945 121.043 143.910 128.922 1.00 0.00 O ATOM 49458 H1 WAT 9945 121.588 143.159 128.687 1.00 0.00 H ATOM 49459 H2 WAT 9945 121.384 144.197 129.769 1.00 0.00 H TER 49461 WAT 9945 ATOM 49461 O WAT 9946 91.568 47.415 26.369 1.00 0.00 O ATOM 49462 H1 WAT 9946 90.858 47.894 26.797 1.00 0.00 H ATOM 49463 H2 WAT 9946 91.327 47.406 25.443 1.00 0.00 H TER 49465 WAT 9946 ATOM 49465 O WAT 9947 98.222 145.368 64.787 1.00 0.00 O ATOM 49466 H1 WAT 9947 98.249 145.743 65.668 1.00 0.00 H ATOM 49467 H2 WAT 9947 97.914 146.084 64.232 1.00 0.00 H TER 49469 WAT 9947 ATOM 49469 O WAT 9948 43.886 99.202 115.835 1.00 0.00 O ATOM 49470 H1 WAT 9948 44.017 98.789 116.689 1.00 0.00 H ATOM 49471 H2 WAT 9948 43.610 98.485 115.263 1.00 0.00 H TER 49473 WAT 9948 ATOM 49473 O WAT 9949 35.740 5.063 116.608 1.00 0.00 O ATOM 49474 H1 WAT 9949 35.284 4.222 116.612 1.00 0.00 H ATOM 49475 H2 WAT 9949 36.027 5.175 115.702 1.00 0.00 H TER 49477 WAT 9949 ATOM 49477 O WAT 9950 109.492 46.233 5.406 1.00 0.00 O ATOM 49478 H1 WAT 9950 109.160 45.336 5.446 1.00 0.00 H ATOM 49479 H2 WAT 9950 110.156 46.212 4.717 1.00 0.00 H TER 49481 WAT 9950 ATOM 49481 O WAT 9951 107.731 64.100 16.475 1.00 0.00 O ATOM 49482 H1 WAT 9951 107.116 63.709 17.096 1.00 0.00 H ATOM 49483 H2 WAT 9951 107.175 64.480 15.795 1.00 0.00 H TER 49485 WAT 9951 ATOM 49485 O WAT 9952 144.036 64.737 64.761 1.00 0.00 O ATOM 49486 H1 WAT 9952 143.547 65.205 65.438 1.00 0.00 H ATOM 49487 H2 WAT 9952 143.736 65.123 63.939 1.00 0.00 H TER 49489 WAT 9952 ATOM 49489 O WAT 9953 129.273 14.816 66.891 1.00 0.00 O ATOM 49490 H1 WAT 9953 129.564 15.587 67.378 1.00 0.00 H ATOM 49491 H2 WAT 9953 129.284 15.095 65.975 1.00 0.00 H TER 49493 WAT 9953 ATOM 49493 O WAT 9954 135.667 81.835 149.669 1.00 0.00 O ATOM 49494 H1 WAT 9954 135.111 81.490 150.367 1.00 0.00 H ATOM 49495 H2 WAT 9954 135.058 82.058 148.965 1.00 0.00 H TER 49497 WAT 9954 ATOM 49497 O WAT 9955 69.486 9.467 97.298 1.00 0.00 O ATOM 49498 H1 WAT 9955 69.269 8.883 96.571 1.00 0.00 H ATOM 49499 H2 WAT 9955 69.233 8.979 98.082 1.00 0.00 H TER 49501 WAT 9955 ATOM 49501 O WAT 9956 42.333 104.241 138.716 1.00 0.00 O ATOM 49502 H1 WAT 9956 41.897 104.002 137.898 1.00 0.00 H ATOM 49503 H2 WAT 9956 43.267 104.183 138.515 1.00 0.00 H TER 49505 WAT 9956 ATOM 49505 O WAT 9957 22.657 54.069 6.641 1.00 0.00 O ATOM 49506 H1 WAT 9957 22.732 54.999 6.853 1.00 0.00 H ATOM 49507 H2 WAT 9957 22.619 54.044 5.685 1.00 0.00 H TER 49509 WAT 9957 ATOM 49509 O WAT 9958 13.374 48.435 122.686 1.00 0.00 O ATOM 49510 H1 WAT 9958 14.100 48.487 123.307 1.00 0.00 H ATOM 49511 H2 WAT 9958 13.770 48.629 121.836 1.00 0.00 H TER 49513 WAT 9958 ATOM 49513 O WAT 9959 108.452 81.055 106.435 1.00 0.00 O ATOM 49514 H1 WAT 9959 107.882 81.730 106.802 1.00 0.00 H ATOM 49515 H2 WAT 9959 108.448 81.225 105.493 1.00 0.00 H TER 49517 WAT 9959 ATOM 49517 O WAT 9960 110.040 127.602 155.340 1.00 0.00 O ATOM 49518 H1 WAT 9960 109.451 128.189 154.866 1.00 0.00 H ATOM 49519 H2 WAT 9960 110.820 128.130 155.510 1.00 0.00 H TER 49521 WAT 9960 ATOM 49521 O WAT 9961 140.760 90.910 89.131 1.00 0.00 O ATOM 49522 H1 WAT 9961 139.849 91.154 88.964 1.00 0.00 H ATOM 49523 H2 WAT 9961 141.207 91.071 88.300 1.00 0.00 H TER 49525 WAT 9961 ATOM 49525 O WAT 9962 23.400 96.450 110.849 1.00 0.00 O ATOM 49526 H1 WAT 9962 23.371 96.075 109.969 1.00 0.00 H ATOM 49527 H2 WAT 9962 22.505 96.748 111.012 1.00 0.00 H TER 49529 WAT 9962 ATOM 49529 O WAT 9963 118.563 50.362 126.664 1.00 0.00 O ATOM 49530 H1 WAT 9963 119.157 50.715 127.327 1.00 0.00 H ATOM 49531 H2 WAT 9963 117.752 50.856 126.780 1.00 0.00 H TER 49533 WAT 9963 ATOM 49533 O WAT 9964 90.063 132.826 90.266 1.00 0.00 O ATOM 49534 H1 WAT 9964 90.896 132.363 90.181 1.00 0.00 H ATOM 49535 H2 WAT 9964 89.408 132.131 90.338 1.00 0.00 H TER 49537 WAT 9964 ATOM 49537 O WAT 9965 63.158 61.148 105.439 1.00 0.00 O ATOM 49538 H1 WAT 9965 62.595 61.198 104.666 1.00 0.00 H ATOM 49539 H2 WAT 9965 63.686 60.362 105.300 1.00 0.00 H TER 49541 WAT 9965 ATOM 49541 O WAT 9966 104.432 2.055 60.316 1.00 0.00 O ATOM 49542 H1 WAT 9966 104.903 1.522 59.675 1.00 0.00 H ATOM 49543 H2 WAT 9966 105.121 2.486 60.822 1.00 0.00 H TER 49545 WAT 9966 ATOM 49545 O WAT 9967 71.737 141.681 105.906 1.00 0.00 O ATOM 49546 H1 WAT 9967 71.631 142.235 105.133 1.00 0.00 H ATOM 49547 H2 WAT 9967 71.381 142.203 106.625 1.00 0.00 H TER 49549 WAT 9967 ATOM 49549 O WAT 9968 71.068 131.110 147.231 1.00 0.00 O ATOM 49550 H1 WAT 9968 71.291 130.800 146.353 1.00 0.00 H ATOM 49551 H2 WAT 9968 71.492 130.487 147.821 1.00 0.00 H TER 49553 WAT 9968 ATOM 49553 O WAT 9969 58.841 51.224 129.396 1.00 0.00 O ATOM 49554 H1 WAT 9969 59.118 50.837 130.227 1.00 0.00 H ATOM 49555 H2 WAT 9969 58.507 52.089 129.635 1.00 0.00 H TER 49557 WAT 9969 ATOM 49557 O WAT 9970 72.421 16.517 58.019 1.00 0.00 O ATOM 49558 H1 WAT 9970 71.631 16.076 58.333 1.00 0.00 H ATOM 49559 H2 WAT 9970 72.890 15.845 57.526 1.00 0.00 H TER 49561 WAT 9970 ATOM 49561 O WAT 9971 121.834 40.715 10.163 1.00 0.00 O ATOM 49562 H1 WAT 9971 121.510 41.583 10.403 1.00 0.00 H ATOM 49563 H2 WAT 9971 121.938 40.752 9.212 1.00 0.00 H TER 49565 WAT 9971 ATOM 49565 O WAT 9972 142.312 105.218 157.647 1.00 0.00 O ATOM 49566 H1 WAT 9972 142.693 106.013 157.273 1.00 0.00 H ATOM 49567 H2 WAT 9972 141.987 104.730 156.891 1.00 0.00 H TER 49569 WAT 9972 ATOM 49569 O WAT 9973 43.835 3.880 158.267 1.00 0.00 O ATOM 49570 H1 WAT 9973 44.694 3.841 157.848 1.00 0.00 H ATOM 49571 H2 WAT 9973 43.283 3.305 157.737 1.00 0.00 H TER 49573 WAT 9973 ATOM 49573 O WAT 9974 24.811 64.757 73.212 1.00 0.00 O ATOM 49574 H1 WAT 9974 24.109 64.109 73.279 1.00 0.00 H ATOM 49575 H2 WAT 9974 24.537 65.334 72.499 1.00 0.00 H TER 49577 WAT 9974 ATOM 49577 O WAT 9975 130.478 4.838 136.789 1.00 0.00 O ATOM 49578 H1 WAT 9975 130.767 3.979 136.479 1.00 0.00 H ATOM 49579 H2 WAT 9975 129.660 4.662 137.254 1.00 0.00 H TER 49581 WAT 9975 ATOM 49581 O WAT 9976 8.724 40.305 94.295 1.00 0.00 O ATOM 49582 H1 WAT 9976 8.525 40.853 93.535 1.00 0.00 H ATOM 49583 H2 WAT 9976 9.268 39.600 93.945 1.00 0.00 H TER 49585 WAT 9976 ATOM 49585 O WAT 9977 112.135 61.532 121.384 1.00 0.00 O ATOM 49586 H1 WAT 9977 111.771 62.407 121.515 1.00 0.00 H ATOM 49587 H2 WAT 9977 111.377 60.986 121.173 1.00 0.00 H TER 49589 WAT 9977 ATOM 49589 O WAT 9978 3.218 91.999 149.310 1.00 0.00 O ATOM 49590 H1 WAT 9978 3.463 92.553 150.052 1.00 0.00 H ATOM 49591 H2 WAT 9978 2.854 91.210 149.710 1.00 0.00 H TER 49593 WAT 9978 ATOM 49593 O WAT 9979 100.781 131.524 87.884 1.00 0.00 O ATOM 49594 H1 WAT 9979 100.603 132.276 88.449 1.00 0.00 H ATOM 49595 H2 WAT 9979 101.035 131.910 87.045 1.00 0.00 H TER 49597 WAT 9979 ATOM 49597 O WAT 9980 137.713 7.031 92.436 1.00 0.00 O ATOM 49598 H1 WAT 9980 138.451 7.262 93.000 1.00 0.00 H ATOM 49599 H2 WAT 9980 137.226 6.375 92.934 1.00 0.00 H TER 49601 WAT 9980 ATOM 49601 O WAT 9981 45.698 67.014 22.427 1.00 0.00 O ATOM 49602 H1 WAT 9981 45.046 67.715 22.411 1.00 0.00 H ATOM 49603 H2 WAT 9981 46.539 67.468 22.390 1.00 0.00 H TER 49605 WAT 9981 ATOM 49605 O WAT 9982 17.688 47.849 99.515 1.00 0.00 O ATOM 49606 H1 WAT 9982 17.067 47.456 100.128 1.00 0.00 H ATOM 49607 H2 WAT 9982 17.654 47.283 98.744 1.00 0.00 H TER 49609 WAT 9982 ATOM 49609 O WAT 9983 115.460 89.844 13.601 1.00 0.00 O ATOM 49610 H1 WAT 9983 116.107 90.546 13.672 1.00 0.00 H ATOM 49611 H2 WAT 9983 114.619 90.298 13.548 1.00 0.00 H TER 49613 WAT 9983 ATOM 49613 O WAT 9984 38.546 28.224 121.254 1.00 0.00 O ATOM 49614 H1 WAT 9984 38.680 28.822 120.519 1.00 0.00 H ATOM 49615 H2 WAT 9984 37.619 27.990 121.207 1.00 0.00 H TER 49617 WAT 9984 ATOM 49617 O WAT 9985 119.595 80.701 81.170 1.00 0.00 O ATOM 49618 H1 WAT 9985 119.294 81.541 80.826 1.00 0.00 H ATOM 49619 H2 WAT 9985 119.790 80.179 80.391 1.00 0.00 H TER 49621 WAT 9985 ATOM 49621 O WAT 9986 66.934 19.983 138.132 1.00 0.00 O ATOM 49622 H1 WAT 9986 66.835 19.291 138.786 1.00 0.00 H ATOM 49623 H2 WAT 9986 67.391 20.686 138.595 1.00 0.00 H TER 49625 WAT 9986 ATOM 49625 O WAT 9987 49.041 69.620 17.950 1.00 0.00 O ATOM 49626 H1 WAT 9987 49.501 68.928 17.475 1.00 0.00 H ATOM 49627 H2 WAT 9987 48.293 69.178 18.352 1.00 0.00 H TER 49629 WAT 9987 ATOM 49629 O WAT 9988 121.640 4.447 90.218 1.00 0.00 O ATOM 49630 H1 WAT 9988 122.200 3.779 90.613 1.00 0.00 H ATOM 49631 H2 WAT 9988 120.893 4.515 90.813 1.00 0.00 H TER 49633 WAT 9988 ATOM 49633 O WAT 9989 10.073 95.490 122.816 1.00 0.00 O ATOM 49634 H1 WAT 9989 10.851 95.693 122.296 1.00 0.00 H ATOM 49635 H2 WAT 9989 9.812 96.330 123.195 1.00 0.00 H TER 49637 WAT 9989 ATOM 49637 O WAT 9990 48.806 93.428 73.354 1.00 0.00 O ATOM 49638 H1 WAT 9990 47.890 93.706 73.353 1.00 0.00 H ATOM 49639 H2 WAT 9990 48.853 92.758 72.671 1.00 0.00 H TER 49641 WAT 9990 ATOM 49641 O WAT 9991 140.388 135.148 71.556 1.00 0.00 O ATOM 49642 H1 WAT 9991 141.288 135.101 71.233 1.00 0.00 H ATOM 49643 H2 WAT 9991 139.851 135.178 70.765 1.00 0.00 H TER 49645 WAT 9991 ATOM 49645 O WAT 9992 60.193 104.462 65.163 1.00 0.00 O ATOM 49646 H1 WAT 9992 60.557 104.570 64.285 1.00 0.00 H ATOM 49647 H2 WAT 9992 60.748 103.798 65.573 1.00 0.00 H TER 49649 WAT 9992 ATOM 49649 O WAT 9993 56.717 81.044 82.287 1.00 0.00 O ATOM 49650 H1 WAT 9993 55.921 80.524 82.176 1.00 0.00 H ATOM 49651 H2 WAT 9993 57.223 80.879 81.492 1.00 0.00 H TER 49653 WAT 9993 ATOM 49653 O WAT 9994 96.243 24.216 5.155 1.00 0.00 O ATOM 49654 H1 WAT 9994 96.026 23.290 5.256 1.00 0.00 H ATOM 49655 H2 WAT 9994 96.562 24.290 4.255 1.00 0.00 H TER 49657 WAT 9994 ATOM 49657 O WAT 9995 25.631 34.435 135.575 1.00 0.00 O ATOM 49658 H1 WAT 9995 24.958 34.307 136.244 1.00 0.00 H ATOM 49659 H2 WAT 9995 25.494 33.718 134.957 1.00 0.00 H TER 49661 WAT 9995 ATOM 49661 O WAT 9996 18.021 125.846 130.239 1.00 0.00 O ATOM 49662 H1 WAT 9996 17.682 126.236 131.044 1.00 0.00 H ATOM 49663 H2 WAT 9996 18.421 126.578 129.769 1.00 0.00 H TER 49665 WAT 9996 ATOM 49665 O WAT 9997 19.013 8.515 78.980 1.00 0.00 O ATOM 49666 H1 WAT 9997 19.179 8.266 78.071 1.00 0.00 H ATOM 49667 H2 WAT 9997 18.060 8.569 79.044 1.00 0.00 H TER 49669 WAT 9997 ATOM 49669 O WAT 9998 36.234 49.785 121.917 1.00 0.00 O ATOM 49670 H1 WAT 9998 35.477 50.062 122.433 1.00 0.00 H ATOM 49671 H2 WAT 9998 35.961 49.904 121.008 1.00 0.00 H TER 49673 WAT 9998 ATOM 49673 O WAT 9999 15.423 88.557 94.391 1.00 0.00 O ATOM 49674 H1 WAT 9999 14.733 89.220 94.412 1.00 0.00 H ATOM 49675 H2 WAT 9999 16.237 89.060 94.342 1.00 0.00 H TER 49677 WAT 9999 ATOM 49677 O WAT 0 72.895 118.587 69.160 1.00 0.00 O ATOM 49678 H1 WAT 0 72.347 119.217 68.692 1.00 0.00 H ATOM 49679 H2 WAT 0 73.403 118.155 68.474 1.00 0.00 H TER 49681 WAT 0 ATOM 49681 O WAT 1 105.436 73.825 110.597 1.00 0.00 O ATOM 49682 H1 WAT 1 105.805 74.439 111.233 1.00 0.00 H ATOM 49683 H2 WAT 1 105.988 73.046 110.669 1.00 0.00 H TER 49685 WAT 1 ATOM 49685 O WAT 2 38.198 84.018 17.245 1.00 0.00 O ATOM 49686 H1 WAT 2 37.428 84.562 17.079 1.00 0.00 H ATOM 49687 H2 WAT 2 38.878 84.389 16.683 1.00 0.00 H TER 49689 WAT 2 ATOM 49689 O WAT 3 145.163 40.902 144.675 1.00 0.00 O ATOM 49690 H1 WAT 3 144.318 41.351 144.634 1.00 0.00 H ATOM 49691 H2 WAT 3 145.692 41.442 145.262 1.00 0.00 H TER 49693 WAT 3 ATOM 49693 O WAT 4 19.799 127.969 70.995 1.00 0.00 O ATOM 49694 H1 WAT 4 19.131 127.429 71.417 1.00 0.00 H ATOM 49695 H2 WAT 4 19.360 128.337 70.228 1.00 0.00 H TER 49697 WAT 4 ATOM 49697 O WAT 5 144.420 34.766 68.353 1.00 0.00 O ATOM 49698 H1 WAT 5 144.239 35.153 69.210 1.00 0.00 H ATOM 49699 H2 WAT 5 144.960 35.417 67.906 1.00 0.00 H TER 49701 WAT 5 ATOM 49701 O WAT 6 91.694 38.797 122.515 1.00 0.00 O ATOM 49702 H1 WAT 6 91.190 39.379 123.083 1.00 0.00 H ATOM 49703 H2 WAT 6 91.714 37.963 122.984 1.00 0.00 H TER 49705 WAT 6 ATOM 49705 O WAT 7 136.624 6.466 68.671 1.00 0.00 O ATOM 49706 H1 WAT 7 136.235 5.665 68.320 1.00 0.00 H ATOM 49707 H2 WAT 7 136.008 7.157 68.428 1.00 0.00 H TER 49709 WAT 7 ATOM 49709 O WAT 8 97.545 87.895 144.848 1.00 0.00 O ATOM 49710 H1 WAT 8 96.671 88.272 144.941 1.00 0.00 H ATOM 49711 H2 WAT 8 97.980 88.090 145.678 1.00 0.00 H TER 49713 WAT 8 ATOM 49713 O WAT 9 81.078 87.327 91.184 1.00 0.00 O ATOM 49714 H1 WAT 9 81.060 87.339 92.141 1.00 0.00 H ATOM 49715 H2 WAT 9 81.841 87.856 90.953 1.00 0.00 H TER 49717 WAT 9 ATOM 49717 O WAT 10 4.385 134.648 91.317 1.00 0.00 O ATOM 49718 H1 WAT 10 4.365 133.709 91.504 1.00 0.00 H ATOM 49719 H2 WAT 10 4.890 135.024 92.038 1.00 0.00 H TER 49721 WAT 10 ATOM 49721 O WAT 11 135.809 55.018 97.499 1.00 0.00 O ATOM 49722 H1 WAT 11 134.933 55.144 97.135 1.00 0.00 H ATOM 49723 H2 WAT 11 136.018 55.854 97.915 1.00 0.00 H TER 49725 WAT 11 ATOM 49725 O WAT 12 39.455 76.387 151.844 1.00 0.00 O ATOM 49726 H1 WAT 12 40.352 76.145 152.076 1.00 0.00 H ATOM 49727 H2 WAT 12 39.544 77.215 151.373 1.00 0.00 H TER 49729 WAT 12 ATOM 49729 O WAT 13 83.658 124.683 79.240 1.00 0.00 O ATOM 49730 H1 WAT 13 83.720 125.085 78.373 1.00 0.00 H ATOM 49731 H2 WAT 13 82.718 124.580 79.390 1.00 0.00 H TER 49733 WAT 13 ATOM 49733 O WAT 14 30.082 83.383 24.993 1.00 0.00 O ATOM 49734 H1 WAT 14 29.700 84.238 25.191 1.00 0.00 H ATOM 49735 H2 WAT 14 30.994 83.573 24.774 1.00 0.00 H TER 49737 WAT 14 ATOM 49737 O WAT 15 131.472 34.400 103.900 1.00 0.00 O ATOM 49738 H1 WAT 15 131.775 34.843 104.692 1.00 0.00 H ATOM 49739 H2 WAT 15 130.818 34.992 103.529 1.00 0.00 H TER 49741 WAT 15 ATOM 49741 O WAT 16 10.261 91.509 127.086 1.00 0.00 O ATOM 49742 H1 WAT 16 10.228 92.433 127.335 1.00 0.00 H ATOM 49743 H2 WAT 16 9.454 91.365 126.592 1.00 0.00 H TER 49745 WAT 16 ATOM 49745 O WAT 17 5.080 29.926 156.479 1.00 0.00 O ATOM 49746 H1 WAT 17 5.153 30.853 156.706 1.00 0.00 H ATOM 49747 H2 WAT 17 5.790 29.504 156.964 1.00 0.00 H TER 49749 WAT 17 ATOM 49749 O WAT 18 36.937 104.755 97.827 1.00 0.00 O ATOM 49750 H1 WAT 18 36.443 105.574 97.784 1.00 0.00 H ATOM 49751 H2 WAT 18 37.831 105.025 98.035 1.00 0.00 H TER 49753 WAT 18 ATOM 49753 O WAT 19 40.134 93.915 156.240 1.00 0.00 O ATOM 49754 H1 WAT 19 39.349 93.673 156.732 1.00 0.00 H ATOM 49755 H2 WAT 19 40.221 93.232 155.575 1.00 0.00 H TER 49757 WAT 19 ATOM 49757 O WAT 20 71.036 66.054 120.281 1.00 0.00 O ATOM 49758 H1 WAT 20 70.085 65.997 120.193 1.00 0.00 H ATOM 49759 H2 WAT 20 71.338 66.366 119.428 1.00 0.00 H TER 49761 WAT 20 ATOM 49761 O WAT 21 82.429 51.970 70.187 1.00 0.00 O ATOM 49762 H1 WAT 21 82.927 51.562 69.479 1.00 0.00 H ATOM 49763 H2 WAT 21 82.943 52.741 70.428 1.00 0.00 H TER 49765 WAT 21 ATOM 49765 O WAT 22 88.957 49.543 140.337 1.00 0.00 O ATOM 49766 H1 WAT 22 88.237 49.940 140.828 1.00 0.00 H ATOM 49767 H2 WAT 22 89.062 48.674 140.725 1.00 0.00 H TER 49769 WAT 22 ATOM 49769 O WAT 23 37.866 121.457 118.078 1.00 0.00 O ATOM 49770 H1 WAT 23 37.895 121.246 119.011 1.00 0.00 H ATOM 49771 H2 WAT 23 38.781 121.426 117.797 1.00 0.00 H TER 49773 WAT 23 ATOM 49773 O WAT 24 2.249 134.713 66.905 1.00 0.00 O ATOM 49774 H1 WAT 24 2.600 134.939 67.766 1.00 0.00 H ATOM 49775 H2 WAT 24 2.699 135.305 66.301 1.00 0.00 H TER 49777 WAT 24 ATOM 49777 O WAT 25 123.842 3.103 158.151 1.00 0.00 O ATOM 49778 H1 WAT 25 123.524 2.973 159.044 1.00 0.00 H ATOM 49779 H2 WAT 25 123.244 3.748 157.774 1.00 0.00 H TER 49781 WAT 25 ATOM 49781 O WAT 26 73.216 127.291 141.552 1.00 0.00 O ATOM 49782 H1 WAT 26 73.315 126.734 140.780 1.00 0.00 H ATOM 49783 H2 WAT 26 74.108 127.567 141.763 1.00 0.00 H TER 49785 WAT 26 ATOM 49785 O WAT 27 38.244 42.082 63.357 1.00 0.00 O ATOM 49786 H1 WAT 27 37.348 41.995 63.032 1.00 0.00 H ATOM 49787 H2 WAT 27 38.409 43.024 63.357 1.00 0.00 H TER 49789 WAT 27 ATOM 49789 O WAT 28 19.671 104.061 82.191 1.00 0.00 O ATOM 49790 H1 WAT 28 19.647 103.558 81.376 1.00 0.00 H ATOM 49791 H2 WAT 28 18.941 104.675 82.114 1.00 0.00 H TER 49793 WAT 28 ATOM 49793 O WAT 29 5.314 10.140 148.633 1.00 0.00 O ATOM 49794 H1 WAT 29 5.305 11.090 148.516 1.00 0.00 H ATOM 49795 H2 WAT 29 5.348 10.016 149.582 1.00 0.00 H TER 49797 WAT 29 ATOM 49797 O WAT 30 73.757 32.059 67.759 1.00 0.00 O ATOM 49798 H1 WAT 30 73.616 31.411 67.068 1.00 0.00 H ATOM 49799 H2 WAT 30 72.926 32.531 67.817 1.00 0.00 H TER 49801 WAT 30 ATOM 49801 O WAT 31 103.063 59.127 4.481 1.00 0.00 O ATOM 49802 H1 WAT 31 104.002 59.285 4.576 1.00 0.00 H ATOM 49803 H2 WAT 31 102.956 58.860 3.567 1.00 0.00 H TER 49805 WAT 31 ATOM 49805 O WAT 32 6.413 8.241 8.110 1.00 0.00 O ATOM 49806 H1 WAT 32 7.093 8.885 7.914 1.00 0.00 H ATOM 49807 H2 WAT 32 6.097 7.958 7.252 1.00 0.00 H TER 49809 WAT 32 ATOM 49809 O WAT 33 23.913 17.138 11.096 1.00 0.00 O ATOM 49810 H1 WAT 33 23.654 16.957 10.192 1.00 0.00 H ATOM 49811 H2 WAT 33 23.557 18.008 11.277 1.00 0.00 H TER 49813 WAT 33 ATOM 49813 O WAT 34 32.006 5.157 67.794 1.00 0.00 O ATOM 49814 H1 WAT 34 31.653 4.492 67.203 1.00 0.00 H ATOM 49815 H2 WAT 34 31.471 5.083 68.585 1.00 0.00 H TER 49817 WAT 34 ATOM 49817 O WAT 35 88.522 128.769 108.407 1.00 0.00 O ATOM 49818 H1 WAT 35 87.823 128.120 108.331 1.00 0.00 H ATOM 49819 H2 WAT 35 88.843 128.672 109.303 1.00 0.00 H TER 49821 WAT 35 ATOM 49821 O WAT 36 144.723 123.940 140.668 1.00 0.00 O ATOM 49822 H1 WAT 36 144.910 124.625 141.310 1.00 0.00 H ATOM 49823 H2 WAT 36 144.190 123.304 141.146 1.00 0.00 H TER 49825 WAT 36 ATOM 49825 O WAT 37 58.146 23.591 92.391 1.00 0.00 O ATOM 49826 H1 WAT 37 58.704 22.850 92.154 1.00 0.00 H ATOM 49827 H2 WAT 37 58.354 24.264 91.743 1.00 0.00 H TER 49829 WAT 37 ATOM 49829 O WAT 38 30.860 6.355 152.833 1.00 0.00 O ATOM 49830 H1 WAT 38 31.642 6.836 152.561 1.00 0.00 H ATOM 49831 H2 WAT 38 30.407 6.951 153.429 1.00 0.00 H TER 49833 WAT 38 ATOM 49833 O WAT 39 7.474 53.787 140.977 1.00 0.00 O ATOM 49834 H1 WAT 39 7.298 53.017 141.517 1.00 0.00 H ATOM 49835 H2 WAT 39 6.653 54.278 140.984 1.00 0.00 H TER 49837 WAT 39 ATOM 49837 O WAT 40 104.964 26.859 148.279 1.00 0.00 O ATOM 49838 H1 WAT 40 105.771 26.508 147.903 1.00 0.00 H ATOM 49839 H2 WAT 40 105.129 26.881 149.222 1.00 0.00 H TER 49841 WAT 40 ATOM 49841 O WAT 41 16.336 74.738 77.989 1.00 0.00 O ATOM 49842 H1 WAT 41 15.412 74.980 78.053 1.00 0.00 H ATOM 49843 H2 WAT 41 16.402 73.913 78.470 1.00 0.00 H TER 49845 WAT 41 ATOM 49845 O WAT 42 125.485 12.970 136.219 1.00 0.00 O ATOM 49846 H1 WAT 42 125.263 12.680 135.334 1.00 0.00 H ATOM 49847 H2 WAT 42 126.366 13.335 136.137 1.00 0.00 H TER 49849 WAT 42 ATOM 49849 O WAT 43 97.001 51.650 4.006 1.00 0.00 O ATOM 49850 H1 WAT 43 96.932 50.727 4.251 1.00 0.00 H ATOM 49851 H2 WAT 43 96.832 52.127 4.819 1.00 0.00 H TER 49853 WAT 43 ATOM 49853 O WAT 44 8.691 96.850 87.277 1.00 0.00 O ATOM 49854 H1 WAT 44 8.810 95.952 86.968 1.00 0.00 H ATOM 49855 H2 WAT 44 9.389 96.975 87.921 1.00 0.00 H TER 49857 WAT 44 ATOM 49857 O WAT 45 96.424 72.583 96.162 1.00 0.00 O ATOM 49858 H1 WAT 45 97.132 73.115 95.798 1.00 0.00 H ATOM 49859 H2 WAT 45 96.846 72.051 96.837 1.00 0.00 H TER 49861 WAT 45 ATOM 49861 O WAT 46 43.385 97.867 132.814 1.00 0.00 O ATOM 49862 H1 WAT 46 43.425 98.823 132.854 1.00 0.00 H ATOM 49863 H2 WAT 46 43.039 97.678 131.942 1.00 0.00 H TER 49865 WAT 46 ATOM 49865 O WAT 47 96.451 132.404 90.251 1.00 0.00 O ATOM 49866 H1 WAT 47 97.063 132.255 90.971 1.00 0.00 H ATOM 49867 H2 WAT 47 96.954 132.200 89.462 1.00 0.00 H TER 49869 WAT 47 ATOM 49869 O WAT 48 59.359 91.588 81.164 1.00 0.00 O ATOM 49870 H1 WAT 48 59.291 92.356 81.731 1.00 0.00 H ATOM 49871 H2 WAT 48 59.089 91.903 80.301 1.00 0.00 H TER 49873 WAT 48 ATOM 49873 O WAT 49 2.054 76.639 124.012 1.00 0.00 O ATOM 49874 H1 WAT 49 1.493 75.920 124.305 1.00 0.00 H ATOM 49875 H2 WAT 49 1.682 77.417 124.428 1.00 0.00 H TER 49877 WAT 49 ATOM 49877 O WAT 50 133.447 129.046 154.447 1.00 0.00 O ATOM 49878 H1 WAT 50 134.148 128.709 155.005 1.00 0.00 H ATOM 49879 H2 WAT 50 133.346 129.959 154.714 1.00 0.00 H TER 49881 WAT 50 ATOM 49881 O WAT 51 116.505 32.027 108.133 1.00 0.00 O ATOM 49882 H1 WAT 51 116.414 31.473 108.909 1.00 0.00 H ATOM 49883 H2 WAT 51 116.103 32.859 108.385 1.00 0.00 H TER 49885 WAT 51 ATOM 49885 O WAT 52 122.951 82.532 100.417 1.00 0.00 O ATOM 49886 H1 WAT 52 122.046 82.663 100.133 1.00 0.00 H ATOM 49887 H2 WAT 52 123.111 81.598 100.280 1.00 0.00 H TER 49889 WAT 52 ATOM 49889 O WAT 53 139.671 74.924 125.220 1.00 0.00 O ATOM 49890 H1 WAT 53 140.171 74.980 126.035 1.00 0.00 H ATOM 49891 H2 WAT 53 140.329 75.003 124.530 1.00 0.00 H TER 49893 WAT 53 ATOM 49893 O WAT 54 0.298 84.394 118.741 1.00 0.00 O ATOM 49894 H1 WAT 54 0.201 83.450 118.615 1.00 0.00 H ATOM 49895 H2 WAT 54 0.626 84.716 117.902 1.00 0.00 H TER 49897 WAT 54 ATOM 49897 O WAT 55 78.509 89.638 127.398 1.00 0.00 O ATOM 49898 H1 WAT 55 77.946 90.333 127.056 1.00 0.00 H ATOM 49899 H2 WAT 55 78.296 89.593 128.330 1.00 0.00 H TER 49901 WAT 55 ATOM 49901 O WAT 56 136.109 6.545 17.736 1.00 0.00 O ATOM 49902 H1 WAT 56 136.380 6.925 16.900 1.00 0.00 H ATOM 49903 H2 WAT 56 136.871 6.650 18.305 1.00 0.00 H TER 49905 WAT 56 ATOM 49905 O WAT 57 68.272 109.436 128.712 1.00 0.00 O ATOM 49906 H1 WAT 57 68.410 108.990 129.547 1.00 0.00 H ATOM 49907 H2 WAT 57 67.346 109.678 128.720 1.00 0.00 H TER 49909 WAT 57 ATOM 49909 O WAT 58 45.385 68.328 109.778 1.00 0.00 O ATOM 49910 H1 WAT 58 44.974 68.732 110.543 1.00 0.00 H ATOM 49911 H2 WAT 58 44.990 68.775 109.030 1.00 0.00 H TER 49913 WAT 58 ATOM 49913 O WAT 59 32.639 17.088 136.933 1.00 0.00 O ATOM 49914 H1 WAT 59 32.441 16.467 136.233 1.00 0.00 H ATOM 49915 H2 WAT 59 33.594 17.154 136.933 1.00 0.00 H TER 49917 WAT 59 ATOM 49917 O WAT 60 20.509 7.719 62.692 1.00 0.00 O ATOM 49918 H1 WAT 60 21.243 7.871 62.097 1.00 0.00 H ATOM 49919 H2 WAT 60 19.739 7.702 62.124 1.00 0.00 H TER 49921 WAT 60 ATOM 49921 O WAT 61 58.321 117.055 121.750 1.00 0.00 O ATOM 49922 H1 WAT 61 59.202 116.699 121.868 1.00 0.00 H ATOM 49923 H2 WAT 61 57.829 116.346 121.336 1.00 0.00 H TER 49925 WAT 61 ATOM 49925 O WAT 62 100.007 61.074 66.215 1.00 0.00 O ATOM 49926 H1 WAT 62 100.133 60.185 66.548 1.00 0.00 H ATOM 49927 H2 WAT 62 100.200 61.639 66.962 1.00 0.00 H TER 49929 WAT 62 ATOM 49929 O WAT 63 26.774 141.946 68.836 1.00 0.00 O ATOM 49930 H1 WAT 63 26.338 141.239 68.359 1.00 0.00 H ATOM 49931 H2 WAT 63 27.473 141.510 69.323 1.00 0.00 H TER 49933 WAT 63 ATOM 49933 O WAT 64 44.531 111.587 66.285 1.00 0.00 O ATOM 49934 H1 WAT 64 44.091 111.487 67.129 1.00 0.00 H ATOM 49935 H2 WAT 64 44.928 110.732 66.119 1.00 0.00 H TER 49937 WAT 64 ATOM 49937 O WAT 65 26.619 22.502 109.372 1.00 0.00 O ATOM 49938 H1 WAT 65 26.053 22.108 108.708 1.00 0.00 H ATOM 49939 H2 WAT 65 26.333 22.108 110.196 1.00 0.00 H TER 49941 WAT 65 ATOM 49941 O WAT 66 72.973 85.668 158.426 1.00 0.00 O ATOM 49942 H1 WAT 66 73.203 86.071 157.589 1.00 0.00 H ATOM 49943 H2 WAT 66 73.111 84.731 158.286 1.00 0.00 H TER 49945 WAT 66 ATOM 49945 O WAT 67 17.004 93.254 21.854 1.00 0.00 O ATOM 49946 H1 WAT 67 16.066 93.268 22.042 1.00 0.00 H ATOM 49947 H2 WAT 67 17.329 94.089 22.191 1.00 0.00 H TER 49949 WAT 67 ATOM 49949 O WAT 68 51.928 98.618 127.626 1.00 0.00 O ATOM 49950 H1 WAT 68 51.126 98.363 127.170 1.00 0.00 H ATOM 49951 H2 WAT 68 52.088 99.518 127.344 1.00 0.00 H TER 49953 WAT 68 ATOM 49953 O WAT 69 115.710 54.001 85.792 1.00 0.00 O ATOM 49954 H1 WAT 69 116.293 53.353 85.395 1.00 0.00 H ATOM 49955 H2 WAT 69 115.684 53.763 86.719 1.00 0.00 H TER 49957 WAT 69 ATOM 49957 O WAT 70 41.382 103.709 78.771 1.00 0.00 O ATOM 49958 H1 WAT 70 42.169 103.181 78.910 1.00 0.00 H ATOM 49959 H2 WAT 70 41.161 103.571 77.850 1.00 0.00 H TER 49961 WAT 70 ATOM 49961 O WAT 71 127.256 80.044 9.475 1.00 0.00 O ATOM 49962 H1 WAT 71 126.576 80.718 9.484 1.00 0.00 H ATOM 49963 H2 WAT 71 126.790 79.232 9.675 1.00 0.00 H TER 49965 WAT 71 ATOM 49965 O WAT 72 121.147 47.581 130.585 1.00 0.00 O ATOM 49966 H1 WAT 72 120.800 48.425 130.876 1.00 0.00 H ATOM 49967 H2 WAT 72 120.376 47.020 130.506 1.00 0.00 H TER 49969 WAT 72 ATOM 49969 O WAT 73 72.384 136.740 143.147 1.00 0.00 O ATOM 49970 H1 WAT 73 73.254 137.122 143.033 1.00 0.00 H ATOM 49971 H2 WAT 73 72.092 136.538 142.258 1.00 0.00 H TER 49973 WAT 73 ATOM 49973 O WAT 74 77.254 89.122 20.334 1.00 0.00 O ATOM 49974 H1 WAT 74 76.652 88.607 20.873 1.00 0.00 H ATOM 49975 H2 WAT 74 78.125 88.835 20.608 1.00 0.00 H TER 49977 WAT 74 ATOM 49977 O WAT 75 17.364 76.410 8.612 1.00 0.00 O ATOM 49978 H1 WAT 75 17.596 75.483 8.550 1.00 0.00 H ATOM 49979 H2 WAT 75 17.267 76.571 9.550 1.00 0.00 H TER 49981 WAT 75 ATOM 49981 O WAT 76 34.314 43.210 79.846 1.00 0.00 O ATOM 49982 H1 WAT 76 33.714 42.487 80.031 1.00 0.00 H ATOM 49983 H2 WAT 76 34.951 42.841 79.234 1.00 0.00 H TER 49985 WAT 76 ATOM 49985 O WAT 77 91.343 134.587 73.593 1.00 0.00 O ATOM 49986 H1 WAT 77 92.181 134.620 73.131 1.00 0.00 H ATOM 49987 H2 WAT 77 91.298 133.698 73.945 1.00 0.00 H TER 49989 WAT 77 ATOM 49989 O WAT 78 71.082 79.269 148.037 1.00 0.00 O ATOM 49990 H1 WAT 78 70.663 78.885 147.268 1.00 0.00 H ATOM 49991 H2 WAT 78 71.414 78.518 148.530 1.00 0.00 H TER 49993 WAT 78 ATOM 49993 O WAT 79 117.655 89.565 141.901 1.00 0.00 O ATOM 49994 H1 WAT 79 117.463 90.379 141.436 1.00 0.00 H ATOM 49995 H2 WAT 79 116.845 89.058 141.838 1.00 0.00 H TER 49997 WAT 79 ATOM 49997 O WAT 80 87.497 54.560 86.686 1.00 0.00 O ATOM 49998 H1 WAT 80 86.724 54.460 87.243 1.00 0.00 H ATOM 49999 H2 WAT 80 87.990 55.275 87.087 1.00 0.00 H TER 50001 WAT 80 ATOM 50001 O WAT 81 97.129 95.150 117.960 1.00 0.00 O ATOM 50002 H1 WAT 81 97.025 95.452 117.058 1.00 0.00 H ATOM 50003 H2 WAT 81 96.334 94.648 118.138 1.00 0.00 H TER 50005 WAT 81 ATOM 50005 O WAT 82 107.942 66.189 111.401 1.00 0.00 O ATOM 50006 H1 WAT 82 107.983 66.297 112.351 1.00 0.00 H ATOM 50007 H2 WAT 82 108.857 66.132 111.126 1.00 0.00 H TER 50009 WAT 82 ATOM 50009 O WAT 83 61.226 56.342 3.453 1.00 0.00 O ATOM 50010 H1 WAT 83 60.630 56.653 2.772 1.00 0.00 H ATOM 50011 H2 WAT 83 61.980 56.930 3.398 1.00 0.00 H TER 50013 WAT 83 ATOM 50013 O WAT 84 19.173 121.101 82.070 1.00 0.00 O ATOM 50014 H1 WAT 84 20.013 120.766 81.756 1.00 0.00 H ATOM 50015 H2 WAT 84 19.234 122.049 81.951 1.00 0.00 H TER 50017 WAT 84 ATOM 50017 O WAT 85 19.325 96.486 78.261 1.00 0.00 O ATOM 50018 H1 WAT 85 18.670 95.801 78.127 1.00 0.00 H ATOM 50019 H2 WAT 85 20.106 96.163 77.811 1.00 0.00 H TER 50021 WAT 85 ATOM 50021 O WAT 86 116.472 36.709 93.127 1.00 0.00 O ATOM 50022 H1 WAT 86 117.147 36.831 92.460 1.00 0.00 H ATOM 50023 H2 WAT 86 115.974 35.948 92.828 1.00 0.00 H TER 50025 WAT 86 ATOM 50025 O WAT 87 102.746 31.106 80.962 1.00 0.00 O ATOM 50026 H1 WAT 87 101.849 31.193 81.285 1.00 0.00 H ATOM 50027 H2 WAT 87 103.272 31.618 81.577 1.00 0.00 H TER 50029 WAT 87 ATOM 50029 O WAT 88 34.754 74.066 157.460 1.00 0.00 O ATOM 50030 H1 WAT 88 35.099 73.894 156.584 1.00 0.00 H ATOM 50031 H2 WAT 88 35.469 73.828 158.050 1.00 0.00 H TER 50033 WAT 88 ATOM 50033 O WAT 89 85.686 27.392 11.607 1.00 0.00 O ATOM 50034 H1 WAT 89 86.447 26.819 11.513 1.00 0.00 H ATOM 50035 H2 WAT 89 85.477 27.361 12.540 1.00 0.00 H TER 50037 WAT 89 ATOM 50037 O WAT 90 62.049 23.273 95.090 1.00 0.00 O ATOM 50038 H1 WAT 90 61.110 23.266 94.906 1.00 0.00 H ATOM 50039 H2 WAT 90 62.185 22.520 95.666 1.00 0.00 H TER 50041 WAT 90 ATOM 50041 O WAT 91 56.280 144.648 2.857 1.00 0.00 O ATOM 50042 H1 WAT 91 57.010 144.096 3.136 1.00 0.00 H ATOM 50043 H2 WAT 91 55.593 144.029 2.608 1.00 0.00 H TER 50045 WAT 91 ATOM 50045 O WAT 92 142.392 51.641 131.073 1.00 0.00 O ATOM 50046 H1 WAT 92 142.114 50.966 130.453 1.00 0.00 H ATOM 50047 H2 WAT 92 141.586 52.103 131.301 1.00 0.00 H TER 50049 WAT 92 ATOM 50049 O WAT 93 126.986 6.220 101.551 1.00 0.00 O ATOM 50050 H1 WAT 93 126.443 6.501 102.287 1.00 0.00 H ATOM 50051 H2 WAT 93 127.732 5.780 101.959 1.00 0.00 H TER 50053 WAT 93 ATOM 50053 O WAT 94 36.562 60.156 103.060 1.00 0.00 O ATOM 50054 H1 WAT 94 35.626 59.965 103.122 1.00 0.00 H ATOM 50055 H2 WAT 94 36.991 59.342 103.325 1.00 0.00 H TER 50057 WAT 94 ATOM 50057 O WAT 95 103.812 37.593 18.744 1.00 0.00 O ATOM 50058 H1 WAT 95 103.926 37.608 19.694 1.00 0.00 H ATOM 50059 H2 WAT 95 104.674 37.821 18.396 1.00 0.00 H TER 50061 WAT 95 ATOM 50061 O WAT 96 138.329 117.156 68.198 1.00 0.00 O ATOM 50062 H1 WAT 96 138.436 117.602 69.038 1.00 0.00 H ATOM 50063 H2 WAT 96 138.378 116.225 68.413 1.00 0.00 H TER 50065 WAT 96 ATOM 50065 O WAT 97 54.491 26.484 158.426 1.00 0.00 O ATOM 50066 H1 WAT 97 53.896 26.731 159.133 1.00 0.00 H ATOM 50067 H2 WAT 97 55.241 26.089 158.871 1.00 0.00 H TER 50069 WAT 97 ATOM 50069 O WAT 98 110.639 85.537 6.375 1.00 0.00 O ATOM 50070 H1 WAT 98 109.792 85.696 6.792 1.00 0.00 H ATOM 50071 H2 WAT 98 111.155 85.089 7.045 1.00 0.00 H TER 50073 WAT 98 ATOM 50073 O WAT 99 36.095 1.999 134.060 1.00 0.00 O ATOM 50074 H1 WAT 99 35.211 2.170 133.734 1.00 0.00 H ATOM 50075 H2 WAT 99 35.961 1.622 134.929 1.00 0.00 H TER 50077 WAT 99 ATOM 50077 O WAT 100 49.980 58.109 73.018 1.00 0.00 O ATOM 50078 H1 WAT 100 49.643 57.214 72.986 1.00 0.00 H ATOM 50079 H2 WAT 100 50.512 58.136 73.814 1.00 0.00 H TER 50081 WAT 100 ATOM 50081 O WAT 101 128.717 41.168 99.545 1.00 0.00 O ATOM 50082 H1 WAT 101 129.394 41.844 99.555 1.00 0.00 H ATOM 50083 H2 WAT 101 128.691 40.868 98.636 1.00 0.00 H TER 50085 WAT 101 ATOM 50085 O WAT 102 81.843 10.563 70.267 1.00 0.00 O ATOM 50086 H1 WAT 102 81.121 10.656 70.889 1.00 0.00 H ATOM 50087 H2 WAT 102 82.394 11.331 70.423 1.00 0.00 H TER 50089 WAT 102 ATOM 50089 O WAT 103 34.041 105.229 86.199 1.00 0.00 O ATOM 50090 H1 WAT 103 33.510 105.273 85.404 1.00 0.00 H ATOM 50091 H2 WAT 103 34.186 104.293 86.337 1.00 0.00 H TER 50093 WAT 103 ATOM 50093 O WAT 104 85.832 73.665 53.199 1.00 0.00 O ATOM 50094 H1 WAT 104 84.928 73.584 53.503 1.00 0.00 H ATOM 50095 H2 WAT 104 86.007 72.841 52.745 1.00 0.00 H TER 50097 WAT 104 ATOM 50097 O WAT 105 46.893 41.178 107.383 1.00 0.00 O ATOM 50098 H1 WAT 105 46.533 41.888 107.915 1.00 0.00 H ATOM 50099 H2 WAT 105 46.511 40.383 107.754 1.00 0.00 H TER 50101 WAT 105 ATOM 50101 O WAT 106 31.711 86.502 144.543 1.00 0.00 O ATOM 50102 H1 WAT 106 32.370 86.715 145.203 1.00 0.00 H ATOM 50103 H2 WAT 106 32.217 86.219 143.782 1.00 0.00 H TER 50105 WAT 106 ATOM 50105 O WAT 107 76.389 135.460 155.200 1.00 0.00 O ATOM 50106 H1 WAT 107 77.172 135.257 154.689 1.00 0.00 H ATOM 50107 H2 WAT 107 75.898 136.073 154.653 1.00 0.00 H TER 50109 WAT 107 ATOM 50109 O WAT 108 89.765 68.703 14.009 1.00 0.00 O ATOM 50110 H1 WAT 108 89.145 68.046 14.325 1.00 0.00 H ATOM 50111 H2 WAT 108 90.143 68.315 13.219 1.00 0.00 H TER 50113 WAT 108 ATOM 50113 O WAT 109 3.588 140.882 101.310 1.00 0.00 O ATOM 50114 H1 WAT 109 2.775 140.952 100.809 1.00 0.00 H ATOM 50115 H2 WAT 109 3.360 141.203 102.182 1.00 0.00 H TER 50117 WAT 109 ATOM 50117 O WAT 110 75.839 123.609 95.993 1.00 0.00 O ATOM 50118 H1 WAT 110 75.095 123.537 96.591 1.00 0.00 H ATOM 50119 H2 WAT 110 75.971 122.719 95.667 1.00 0.00 H TER 50121 WAT 110 ATOM 50121 O WAT 111 62.444 56.425 120.766 1.00 0.00 O ATOM 50122 H1 WAT 111 61.813 57.107 120.535 1.00 0.00 H ATOM 50123 H2 WAT 111 63.281 56.752 120.437 1.00 0.00 H TER 50125 WAT 111 ATOM 50125 O WAT 112 77.064 96.084 2.094 1.00 0.00 O ATOM 50126 H1 WAT 112 76.885 96.990 2.346 1.00 0.00 H ATOM 50127 H2 WAT 112 77.325 95.655 2.909 1.00 0.00 H TER 50129 WAT 112 ATOM 50129 O WAT 113 108.926 132.095 111.833 1.00 0.00 O ATOM 50130 H1 WAT 113 109.364 132.187 112.679 1.00 0.00 H ATOM 50131 H2 WAT 113 109.637 131.946 111.210 1.00 0.00 H TER 50133 WAT 113 ATOM 50133 O WAT 114 30.097 32.947 89.013 1.00 0.00 O ATOM 50134 H1 WAT 114 30.876 33.310 89.435 1.00 0.00 H ATOM 50135 H2 WAT 114 29.365 33.400 89.431 1.00 0.00 H TER 50137 WAT 114 ATOM 50137 O WAT 115 88.179 115.040 148.785 1.00 0.00 O ATOM 50138 H1 WAT 115 88.051 115.989 148.763 1.00 0.00 H ATOM 50139 H2 WAT 115 87.763 114.761 149.600 1.00 0.00 H TER 50141 WAT 115 ATOM 50141 O WAT 116 94.640 115.004 4.415 1.00 0.00 O ATOM 50142 H1 WAT 116 95.508 115.116 4.028 1.00 0.00 H ATOM 50143 H2 WAT 116 94.711 114.204 4.936 1.00 0.00 H TER 50145 WAT 116 ATOM 50145 O WAT 117 85.218 35.365 66.617 1.00 0.00 O ATOM 50146 H1 WAT 117 85.998 35.090 66.136 1.00 0.00 H ATOM 50147 H2 WAT 117 85.038 34.641 67.216 1.00 0.00 H TER 50149 WAT 117 ATOM 50149 O WAT 118 12.234 61.303 138.028 1.00 0.00 O ATOM 50150 H1 WAT 118 11.423 61.044 138.465 1.00 0.00 H ATOM 50151 H2 WAT 118 12.773 60.511 138.035 1.00 0.00 H TER 50153 WAT 118 ATOM 50153 O WAT 119 35.439 1.374 111.578 1.00 0.00 O ATOM 50154 H1 WAT 119 35.530 0.436 111.409 1.00 0.00 H ATOM 50155 H2 WAT 119 35.029 1.423 112.441 1.00 0.00 H TER 50157 WAT 119 ATOM 50157 O WAT 120 139.820 86.579 107.674 1.00 0.00 O ATOM 50158 H1 WAT 120 139.524 87.039 108.460 1.00 0.00 H ATOM 50159 H2 WAT 120 139.847 85.658 107.933 1.00 0.00 H TER 50161 WAT 120 ATOM 50161 O WAT 121 62.803 104.886 117.323 1.00 0.00 O ATOM 50162 H1 WAT 121 63.409 104.679 118.035 1.00 0.00 H ATOM 50163 H2 WAT 121 62.159 105.474 117.720 1.00 0.00 H TER 50165 WAT 121 ATOM 50165 O WAT 122 105.988 60.815 90.764 1.00 0.00 O ATOM 50166 H1 WAT 122 105.666 61.033 91.638 1.00 0.00 H ATOM 50167 H2 WAT 122 105.436 61.323 90.171 1.00 0.00 H TER 50169 WAT 122 ATOM 50169 O WAT 123 112.257 132.723 154.681 1.00 0.00 O ATOM 50170 H1 WAT 123 111.880 132.610 155.553 1.00 0.00 H ATOM 50171 H2 WAT 123 113.110 133.127 154.839 1.00 0.00 H TER 50173 WAT 123 ATOM 50173 O WAT 124 101.183 127.584 11.568 1.00 0.00 O ATOM 50174 H1 WAT 124 100.757 127.944 10.789 1.00 0.00 H ATOM 50175 H2 WAT 124 100.535 127.689 12.265 1.00 0.00 H TER 50177 WAT 124 ATOM 50177 O WAT 125 45.834 54.174 146.960 1.00 0.00 O ATOM 50178 H1 WAT 125 45.591 53.340 146.557 1.00 0.00 H ATOM 50179 H2 WAT 125 46.333 54.630 146.283 1.00 0.00 H TER 50181 WAT 125 ATOM 50181 O WAT 126 127.927 124.398 4.605 1.00 0.00 O ATOM 50182 H1 WAT 126 127.971 123.900 3.789 1.00 0.00 H ATOM 50183 H2 WAT 126 128.790 124.281 5.004 1.00 0.00 H TER 50185 WAT 126 ATOM 50185 O WAT 127 120.327 89.817 1.767 1.00 0.00 O ATOM 50186 H1 WAT 127 120.847 90.432 1.250 1.00 0.00 H ATOM 50187 H2 WAT 127 120.745 88.969 1.622 1.00 0.00 H TER 50189 WAT 127 ATOM 50189 O WAT 128 25.106 47.507 129.461 1.00 0.00 O ATOM 50190 H1 WAT 128 25.683 47.204 128.759 1.00 0.00 H ATOM 50191 H2 WAT 128 24.742 46.705 129.835 1.00 0.00 H TER 50193 WAT 128 ATOM 50193 O WAT 129 22.928 8.673 106.020 1.00 0.00 O ATOM 50194 H1 WAT 129 22.848 7.734 105.850 1.00 0.00 H ATOM 50195 H2 WAT 129 23.240 9.040 105.192 1.00 0.00 H TER 50197 WAT 129 ATOM 50197 O WAT 130 117.828 104.693 113.542 1.00 0.00 O ATOM 50198 H1 WAT 130 117.679 105.238 114.314 1.00 0.00 H ATOM 50199 H2 WAT 130 118.767 104.507 113.557 1.00 0.00 H TER 50201 WAT 130 ATOM 50201 O WAT 131 129.048 81.516 61.493 1.00 0.00 O ATOM 50202 H1 WAT 131 129.943 81.375 61.802 1.00 0.00 H ATOM 50203 H2 WAT 131 128.579 80.722 61.749 1.00 0.00 H TER 50205 WAT 131 ATOM 50205 O WAT 132 27.900 54.591 97.633 1.00 0.00 O ATOM 50206 H1 WAT 132 27.677 55.519 97.564 1.00 0.00 H ATOM 50207 H2 WAT 132 28.606 54.466 96.999 1.00 0.00 H TER 50209 WAT 132 ATOM 50209 O WAT 133 113.809 7.232 67.604 1.00 0.00 O ATOM 50210 H1 WAT 133 114.191 8.003 67.184 1.00 0.00 H ATOM 50211 H2 WAT 133 113.957 6.521 66.981 1.00 0.00 H TER 50213 WAT 133 ATOM 50213 O WAT 134 37.273 132.034 136.529 1.00 0.00 O ATOM 50214 H1 WAT 134 37.693 132.890 136.611 1.00 0.00 H ATOM 50215 H2 WAT 134 36.609 132.157 135.851 1.00 0.00 H TER 50217 WAT 134 ATOM 50217 O WAT 135 137.627 141.415 133.639 1.00 0.00 O ATOM 50218 H1 WAT 135 137.078 142.107 133.271 1.00 0.00 H ATOM 50219 H2 WAT 135 137.281 140.607 133.260 1.00 0.00 H TER 50221 WAT 135 ATOM 50221 O WAT 136 51.573 37.532 138.544 1.00 0.00 O ATOM 50222 H1 WAT 136 51.071 38.297 138.826 1.00 0.00 H ATOM 50223 H2 WAT 136 52.263 37.443 139.202 1.00 0.00 H TER 50225 WAT 136 ATOM 50225 O WAT 137 88.750 97.036 104.316 1.00 0.00 O ATOM 50226 H1 WAT 137 88.413 96.729 105.158 1.00 0.00 H ATOM 50227 H2 WAT 137 89.448 96.418 104.098 1.00 0.00 H TER 50229 WAT 137 ATOM 50229 O WAT 138 51.402 15.462 75.413 1.00 0.00 O ATOM 50230 H1 WAT 138 51.631 16.226 75.942 1.00 0.00 H ATOM 50231 H2 WAT 138 50.445 15.456 75.403 1.00 0.00 H TER 50233 WAT 138 ATOM 50233 O WAT 139 92.553 104.631 125.844 1.00 0.00 O ATOM 50234 H1 WAT 139 92.960 103.875 126.267 1.00 0.00 H ATOM 50235 H2 WAT 139 93.177 104.893 125.168 1.00 0.00 H TER 50237 WAT 139 ATOM 50237 O WAT 140 25.892 55.769 56.586 1.00 0.00 O ATOM 50238 H1 WAT 140 25.593 56.633 56.304 1.00 0.00 H ATOM 50239 H2 WAT 140 25.318 55.545 57.319 1.00 0.00 H TER 50241 WAT 140 ATOM 50241 O WAT 141 108.135 100.819 28.095 1.00 0.00 O ATOM 50242 H1 WAT 141 107.970 99.909 28.343 1.00 0.00 H ATOM 50243 H2 WAT 141 107.841 101.329 28.850 1.00 0.00 H TER 50245 WAT 141 ATOM 50245 O WAT 142 139.043 120.718 109.982 1.00 0.00 O ATOM 50246 H1 WAT 142 139.494 119.945 110.322 1.00 0.00 H ATOM 50247 H2 WAT 142 139.747 121.315 109.730 1.00 0.00 H TER 50249 WAT 142 ATOM 50249 O WAT 143 98.302 103.988 17.787 1.00 0.00 O ATOM 50250 H1 WAT 143 97.607 103.633 17.234 1.00 0.00 H ATOM 50251 H2 WAT 143 98.484 104.852 17.418 1.00 0.00 H TER 50253 WAT 143 ATOM 50253 O WAT 144 139.647 5.327 63.615 1.00 0.00 O ATOM 50254 H1 WAT 144 140.148 5.396 62.802 1.00 0.00 H ATOM 50255 H2 WAT 144 139.785 4.426 63.906 1.00 0.00 H TER 50257 WAT 144 ATOM 50257 O WAT 145 40.118 88.948 92.995 1.00 0.00 O ATOM 50258 H1 WAT 145 40.221 88.032 93.255 1.00 0.00 H ATOM 50259 H2 WAT 145 40.733 89.426 93.550 1.00 0.00 H TER 50261 WAT 145 ATOM 50261 O WAT 146 19.976 143.823 157.209 1.00 0.00 O ATOM 50262 H1 WAT 146 19.589 143.030 157.579 1.00 0.00 H ATOM 50263 H2 WAT 146 20.850 143.867 157.596 1.00 0.00 H TER 50265 WAT 146 ATOM 50265 O WAT 147 27.508 102.129 67.137 1.00 0.00 O ATOM 50266 H1 WAT 147 27.800 101.578 66.411 1.00 0.00 H ATOM 50267 H2 WAT 147 26.938 102.781 66.729 1.00 0.00 H TER 50269 WAT 147 ATOM 50269 O WAT 148 94.463 63.790 146.975 1.00 0.00 O ATOM 50270 H1 WAT 148 94.607 63.100 146.327 1.00 0.00 H ATOM 50271 H2 WAT 148 94.880 63.461 147.771 1.00 0.00 H TER 50273 WAT 148 ATOM 50273 O WAT 149 113.526 121.086 128.851 1.00 0.00 O ATOM 50274 H1 WAT 149 113.830 121.968 129.066 1.00 0.00 H ATOM 50275 H2 WAT 149 112.716 120.983 129.350 1.00 0.00 H TER 50277 WAT 149 ATOM 50277 O WAT 150 144.668 123.090 148.779 1.00 0.00 O ATOM 50278 H1 WAT 150 144.649 123.433 149.672 1.00 0.00 H ATOM 50279 H2 WAT 150 144.407 122.173 148.868 1.00 0.00 H TER 50281 WAT 150 ATOM 50281 O WAT 151 88.406 128.395 3.394 1.00 0.00 O ATOM 50282 H1 WAT 151 87.898 129.182 3.200 1.00 0.00 H ATOM 50283 H2 WAT 151 87.923 127.687 2.969 1.00 0.00 H TER 50285 WAT 151 ATOM 50285 O WAT 152 27.329 101.457 88.220 1.00 0.00 O ATOM 50286 H1 WAT 152 27.600 101.813 89.066 1.00 0.00 H ATOM 50287 H2 WAT 152 27.984 100.787 88.021 1.00 0.00 H TER 50289 WAT 152 ATOM 50289 O WAT 153 19.581 33.558 13.034 1.00 0.00 O ATOM 50290 H1 WAT 153 19.649 33.716 12.093 1.00 0.00 H ATOM 50291 H2 WAT 153 19.772 32.625 13.134 1.00 0.00 H TER 50293 WAT 153 ATOM 50293 O WAT 154 97.324 121.031 19.516 1.00 0.00 O ATOM 50294 H1 WAT 154 97.935 120.587 20.105 1.00 0.00 H ATOM 50295 H2 WAT 154 97.180 120.406 18.806 1.00 0.00 H TER 50297 WAT 154 ATOM 50297 O WAT 155 81.122 127.876 115.112 1.00 0.00 O ATOM 50298 H1 WAT 155 80.899 127.556 114.238 1.00 0.00 H ATOM 50299 H2 WAT 155 80.299 127.837 115.599 1.00 0.00 H TER 50301 WAT 155 ATOM 50301 O WAT 156 16.247 94.071 4.754 1.00 0.00 O ATOM 50302 H1 WAT 156 16.525 93.359 4.178 1.00 0.00 H ATOM 50303 H2 WAT 156 17.054 94.367 5.175 1.00 0.00 H TER 50305 WAT 156 ATOM 50305 O WAT 157 118.347 127.931 112.547 1.00 0.00 O ATOM 50306 H1 WAT 157 119.203 128.310 112.743 1.00 0.00 H ATOM 50307 H2 WAT 157 118.498 126.986 112.543 1.00 0.00 H TER 50309 WAT 157 ATOM 50309 O WAT 158 73.935 70.607 23.220 1.00 0.00 O ATOM 50310 H1 WAT 158 74.772 70.512 23.674 1.00 0.00 H ATOM 50311 H2 WAT 158 73.522 71.365 23.633 1.00 0.00 H TER 50313 WAT 158 ATOM 50313 O WAT 159 16.884 60.956 144.587 1.00 0.00 O ATOM 50314 H1 WAT 159 17.756 60.677 144.307 1.00 0.00 H ATOM 50315 H2 WAT 159 16.288 60.340 144.162 1.00 0.00 H TER 50317 WAT 159 ATOM 50317 O WAT 160 115.411 118.083 126.346 1.00 0.00 O ATOM 50318 H1 WAT 160 115.685 117.188 126.146 1.00 0.00 H ATOM 50319 H2 WAT 160 114.796 118.307 125.648 1.00 0.00 H TER 50321 WAT 160 ATOM 50321 O WAT 161 121.196 118.588 92.229 1.00 0.00 O ATOM 50322 H1 WAT 161 120.567 118.992 91.631 1.00 0.00 H ATOM 50323 H2 WAT 161 121.356 117.721 91.858 1.00 0.00 H TER 50325 WAT 161 ATOM 50325 O WAT 162 141.182 99.420 145.078 1.00 0.00 O ATOM 50326 H1 WAT 162 141.738 98.780 144.633 1.00 0.00 H ATOM 50327 H2 WAT 162 141.585 100.266 144.881 1.00 0.00 H TER 50329 WAT 162 ATOM 50329 O WAT 163 52.402 9.752 143.685 1.00 0.00 O ATOM 50330 H1 WAT 163 52.469 9.047 144.328 1.00 0.00 H ATOM 50331 H2 WAT 163 51.735 9.450 143.067 1.00 0.00 H TER 50333 WAT 163 ATOM 50333 O WAT 164 17.192 2.271 66.583 1.00 0.00 O ATOM 50334 H1 WAT 164 16.673 1.568 66.972 1.00 0.00 H ATOM 50335 H2 WAT 164 16.559 2.791 66.087 1.00 0.00 H TER 50337 WAT 164 ATOM 50337 O WAT 165 51.257 134.733 75.433 1.00 0.00 O ATOM 50338 H1 WAT 165 50.781 134.255 74.753 1.00 0.00 H ATOM 50339 H2 WAT 165 51.157 134.196 76.218 1.00 0.00 H TER 50341 WAT 165 ATOM 50341 O WAT 166 133.092 11.776 67.384 1.00 0.00 O ATOM 50342 H1 WAT 166 132.718 12.620 67.131 1.00 0.00 H ATOM 50343 H2 WAT 166 133.676 11.547 66.662 1.00 0.00 H TER 50345 WAT 166 ATOM 50345 O WAT 167 61.929 65.727 21.680 1.00 0.00 O ATOM 50346 H1 WAT 167 61.396 65.350 22.380 1.00 0.00 H ATOM 50347 H2 WAT 167 61.632 66.634 21.615 1.00 0.00 H TER 50349 WAT 167 ATOM 50349 O WAT 168 93.724 101.857 156.808 1.00 0.00 O ATOM 50350 H1 WAT 168 93.194 101.494 157.517 1.00 0.00 H ATOM 50351 H2 WAT 168 94.395 102.376 157.252 1.00 0.00 H TER 50353 WAT 168 ATOM 50353 O WAT 169 120.160 125.202 71.018 1.00 0.00 O ATOM 50354 H1 WAT 169 119.438 124.828 70.514 1.00 0.00 H ATOM 50355 H2 WAT 169 119.872 126.091 71.226 1.00 0.00 H TER 50357 WAT 169 ATOM 50357 O WAT 170 13.496 96.270 139.502 1.00 0.00 O ATOM 50358 H1 WAT 170 14.302 96.235 138.988 1.00 0.00 H ATOM 50359 H2 WAT 170 12.942 96.896 139.036 1.00 0.00 H TER 50361 WAT 170 ATOM 50361 O WAT 171 14.416 70.890 74.598 1.00 0.00 O ATOM 50362 H1 WAT 171 15.366 70.931 74.711 1.00 0.00 H ATOM 50363 H2 WAT 171 14.180 70.005 74.877 1.00 0.00 H TER 50365 WAT 171 ATOM 50365 O WAT 172 69.704 111.028 73.228 1.00 0.00 O ATOM 50366 H1 WAT 172 69.813 110.569 72.395 1.00 0.00 H ATOM 50367 H2 WAT 172 70.597 111.166 73.544 1.00 0.00 H TER 50369 WAT 172 ATOM 50369 O WAT 173 109.163 108.082 94.513 1.00 0.00 O ATOM 50370 H1 WAT 173 108.558 108.288 95.225 1.00 0.00 H ATOM 50371 H2 WAT 173 108.662 108.256 93.716 1.00 0.00 H TER 50373 WAT 173 ATOM 50373 O WAT 174 123.037 95.733 16.344 1.00 0.00 O ATOM 50374 H1 WAT 174 122.324 95.894 15.727 1.00 0.00 H ATOM 50375 H2 WAT 174 122.908 94.828 16.629 1.00 0.00 H TER 50377 WAT 174 ATOM 50377 O WAT 175 66.060 8.105 22.936 1.00 0.00 O ATOM 50378 H1 WAT 175 65.145 8.316 22.750 1.00 0.00 H ATOM 50379 H2 WAT 175 66.282 7.423 22.302 1.00 0.00 H TER 50381 WAT 175 ATOM 50381 O WAT 176 142.232 128.214 123.036 1.00 0.00 O ATOM 50382 H1 WAT 176 143.042 127.718 122.923 1.00 0.00 H ATOM 50383 H2 WAT 176 141.605 127.577 123.378 1.00 0.00 H TER 50385 WAT 176 ATOM 50385 O WAT 177 87.530 28.699 94.561 1.00 0.00 O ATOM 50386 H1 WAT 177 87.846 28.291 93.755 1.00 0.00 H ATOM 50387 H2 WAT 177 86.920 28.061 94.930 1.00 0.00 H TER 50389 WAT 177 ATOM 50389 O WAT 178 140.459 96.544 152.749 1.00 0.00 O ATOM 50390 H1 WAT 178 140.531 97.497 152.794 1.00 0.00 H ATOM 50391 H2 WAT 178 141.172 96.224 153.301 1.00 0.00 H TER 50393 WAT 178 ATOM 50393 O WAT 179 109.573 144.393 142.977 1.00 0.00 O ATOM 50394 H1 WAT 179 109.664 145.334 143.127 1.00 0.00 H ATOM 50395 H2 WAT 179 110.315 144.003 143.440 1.00 0.00 H TER 50397 WAT 179 ATOM 50397 O WAT 180 130.520 136.510 105.603 1.00 0.00 O ATOM 50398 H1 WAT 180 130.416 135.600 105.324 1.00 0.00 H ATOM 50399 H2 WAT 180 129.936 136.597 106.356 1.00 0.00 H TER 50401 WAT 180 ATOM 50401 O WAT 181 36.726 89.555 80.275 1.00 0.00 O ATOM 50402 H1 WAT 181 36.864 88.609 80.319 1.00 0.00 H ATOM 50403 H2 WAT 181 36.279 89.694 79.441 1.00 0.00 H TER 50405 WAT 181 ATOM 50405 O WAT 182 135.331 124.353 91.896 1.00 0.00 O ATOM 50406 H1 WAT 182 134.803 124.102 91.138 1.00 0.00 H ATOM 50407 H2 WAT 182 134.904 123.925 92.638 1.00 0.00 H TER 50409 WAT 182 ATOM 50409 O WAT 183 31.879 25.812 84.749 1.00 0.00 O ATOM 50410 H1 WAT 183 32.219 24.991 84.392 1.00 0.00 H ATOM 50411 H2 WAT 183 32.263 26.491 84.195 1.00 0.00 H TER 50413 WAT 183 ATOM 50413 O WAT 184 57.040 125.246 149.208 1.00 0.00 O ATOM 50414 H1 WAT 184 57.853 124.782 149.410 1.00 0.00 H ATOM 50415 H2 WAT 184 56.347 124.640 149.471 1.00 0.00 H TER 50417 WAT 184 ATOM 50417 O WAT 185 41.004 23.958 93.834 1.00 0.00 O ATOM 50418 H1 WAT 185 41.732 23.481 93.436 1.00 0.00 H ATOM 50419 H2 WAT 185 41.410 24.732 94.224 1.00 0.00 H TER 50421 WAT 185 ATOM 50421 O WAT 186 117.506 50.176 119.444 1.00 0.00 O ATOM 50422 H1 WAT 186 116.753 49.616 119.634 1.00 0.00 H ATOM 50423 H2 WAT 186 118.239 49.567 119.348 1.00 0.00 H TER 50425 WAT 186 ATOM 50425 O WAT 187 129.576 54.152 145.976 1.00 0.00 O ATOM 50426 H1 WAT 187 130.478 54.280 145.681 1.00 0.00 H ATOM 50427 H2 WAT 187 129.482 54.746 146.721 1.00 0.00 H TER 50429 WAT 187 ATOM 50429 O WAT 188 104.185 103.342 85.398 1.00 0.00 O ATOM 50430 H1 WAT 188 104.761 103.432 86.158 1.00 0.00 H ATOM 50431 H2 WAT 188 103.959 102.412 85.377 1.00 0.00 H TER 50433 WAT 188 ATOM 50433 O WAT 189 117.005 15.004 158.109 1.00 0.00 O ATOM 50434 H1 WAT 189 117.686 15.480 157.634 1.00 0.00 H ATOM 50435 H2 WAT 189 117.243 15.100 159.031 1.00 0.00 H TER 50437 WAT 189 ATOM 50437 O WAT 190 52.774 117.343 12.467 1.00 0.00 O ATOM 50438 H1 WAT 190 53.592 117.381 11.970 1.00 0.00 H ATOM 50439 H2 WAT 190 52.743 118.175 12.940 1.00 0.00 H TER 50441 WAT 190 ATOM 50441 O WAT 191 25.129 109.089 78.384 1.00 0.00 O ATOM 50442 H1 WAT 191 24.906 109.339 79.280 1.00 0.00 H ATOM 50443 H2 WAT 191 24.520 108.381 78.174 1.00 0.00 H TER 50445 WAT 191 ATOM 50445 O WAT 192 80.283 73.133 55.609 1.00 0.00 O ATOM 50446 H1 WAT 192 81.187 73.149 55.922 1.00 0.00 H ATOM 50447 H2 WAT 192 80.067 72.202 55.548 1.00 0.00 H TER 50449 WAT 192 ATOM 50449 O WAT 193 86.022 130.570 119.669 1.00 0.00 O ATOM 50450 H1 WAT 193 86.001 129.696 120.059 1.00 0.00 H ATOM 50451 H2 WAT 193 86.904 130.893 119.853 1.00 0.00 H TER 50453 WAT 193 ATOM 50453 O WAT 194 49.862 118.022 123.999 1.00 0.00 O ATOM 50454 H1 WAT 194 49.036 118.499 123.917 1.00 0.00 H ATOM 50455 H2 WAT 194 50.407 118.580 124.553 1.00 0.00 H TER 50457 WAT 194 ATOM 50457 O WAT 195 24.665 43.178 90.356 1.00 0.00 O ATOM 50458 H1 WAT 195 24.628 44.066 90.000 1.00 0.00 H ATOM 50459 H2 WAT 195 25.142 43.270 91.181 1.00 0.00 H TER 50461 WAT 195 ATOM 50461 O WAT 196 78.834 30.344 20.245 1.00 0.00 O ATOM 50462 H1 WAT 196 79.578 30.905 20.030 1.00 0.00 H ATOM 50463 H2 WAT 196 78.858 29.651 19.586 1.00 0.00 H TER 50465 WAT 196 ATOM 50465 O WAT 197 132.411 26.036 116.609 1.00 0.00 O ATOM 50466 H1 WAT 197 132.059 25.933 115.725 1.00 0.00 H ATOM 50467 H2 WAT 197 132.471 25.144 116.949 1.00 0.00 H TER 50469 WAT 197 ATOM 50469 O WAT 198 109.248 12.130 73.700 1.00 0.00 O ATOM 50470 H1 WAT 198 110.062 11.880 74.137 1.00 0.00 H ATOM 50471 H2 WAT 198 108.649 12.344 74.415 1.00 0.00 H TER 50473 WAT 198 ATOM 50473 O WAT 199 119.049 11.960 122.260 1.00 0.00 O ATOM 50474 H1 WAT 199 119.755 11.368 121.999 1.00 0.00 H ATOM 50475 H2 WAT 199 118.359 11.809 121.614 1.00 0.00 H TER 50477 WAT 199 ATOM 50477 O WAT 200 24.652 102.662 16.714 1.00 0.00 O ATOM 50478 H1 WAT 200 25.378 103.286 16.699 1.00 0.00 H ATOM 50479 H2 WAT 200 25.074 101.803 16.708 1.00 0.00 H TER 50481 WAT 200 ATOM 50481 O WAT 201 67.469 117.102 154.944 1.00 0.00 O ATOM 50482 H1 WAT 201 68.279 116.857 154.497 1.00 0.00 H ATOM 50483 H2 WAT 201 67.611 118.008 155.216 1.00 0.00 H TER 50485 WAT 201 ATOM 50485 O WAT 202 74.643 81.485 110.095 1.00 0.00 O ATOM 50486 H1 WAT 202 74.519 82.415 109.905 1.00 0.00 H ATOM 50487 H2 WAT 202 74.462 81.045 109.264 1.00 0.00 H TER 50489 WAT 202 ATOM 50489 O WAT 203 131.065 55.335 83.423 1.00 0.00 O ATOM 50490 H1 WAT 203 131.408 55.154 84.298 1.00 0.00 H ATOM 50491 H2 WAT 203 131.452 54.658 82.868 1.00 0.00 H TER 50493 WAT 203 ATOM 50493 O WAT 204 30.150 11.655 98.015 1.00 0.00 O ATOM 50494 H1 WAT 204 30.574 11.695 98.873 1.00 0.00 H ATOM 50495 H2 WAT 204 30.869 11.512 97.400 1.00 0.00 H TER 50497 WAT 204 ATOM 50497 O WAT 205 11.205 105.294 75.610 1.00 0.00 O ATOM 50498 H1 WAT 205 11.409 105.806 76.393 1.00 0.00 H ATOM 50499 H2 WAT 205 12.050 105.171 75.177 1.00 0.00 H TER 50501 WAT 205 ATOM 50501 O WAT 206 102.991 81.823 27.633 1.00 0.00 O ATOM 50502 H1 WAT 206 103.453 81.765 26.797 1.00 0.00 H ATOM 50503 H2 WAT 206 103.443 81.197 28.200 1.00 0.00 H TER 50505 WAT 206 ATOM 50505 O WAT 207 2.238 53.455 114.480 1.00 0.00 O ATOM 50506 H1 WAT 207 2.556 52.554 114.411 1.00 0.00 H ATOM 50507 H2 WAT 207 2.624 53.903 113.727 1.00 0.00 H TER 50509 WAT 207 ATOM 50509 O WAT 208 103.157 73.144 98.474 1.00 0.00 O ATOM 50510 H1 WAT 208 103.618 72.559 99.075 1.00 0.00 H ATOM 50511 H2 WAT 208 102.571 73.651 99.035 1.00 0.00 H TER 50513 WAT 208 ATOM 50513 O WAT 209 11.102 44.040 3.831 1.00 0.00 O ATOM 50514 H1 WAT 209 10.411 44.593 3.466 1.00 0.00 H ATOM 50515 H2 WAT 209 11.032 43.218 3.345 1.00 0.00 H TER 50517 WAT 209 ATOM 50517 O WAT 210 49.382 24.153 54.681 1.00 0.00 O ATOM 50518 H1 WAT 210 48.637 24.126 54.081 1.00 0.00 H ATOM 50519 H2 WAT 210 49.073 23.703 55.468 1.00 0.00 H TER 50521 WAT 210 ATOM 50521 O WAT 211 61.186 116.608 124.173 1.00 0.00 O ATOM 50522 H1 WAT 211 60.862 115.722 124.338 1.00 0.00 H ATOM 50523 H2 WAT 211 60.809 117.136 124.876 1.00 0.00 H TER 50525 WAT 211 ATOM 50525 O WAT 212 124.933 23.092 108.039 1.00 0.00 O ATOM 50526 H1 WAT 212 125.817 23.453 107.977 1.00 0.00 H ATOM 50527 H2 WAT 212 124.360 23.859 108.033 1.00 0.00 H TER 50529 WAT 212 ATOM 50529 O WAT 213 12.285 4.936 126.852 1.00 0.00 O ATOM 50530 H1 WAT 213 11.978 4.993 125.947 1.00 0.00 H ATOM 50531 H2 WAT 213 12.761 5.754 126.996 1.00 0.00 H TER 50533 WAT 213 ATOM 50533 O WAT 214 45.666 30.217 134.706 1.00 0.00 O ATOM 50534 H1 WAT 214 45.653 30.623 133.840 1.00 0.00 H ATOM 50535 H2 WAT 214 46.235 29.454 134.604 1.00 0.00 H TER 50537 WAT 214 ATOM 50537 O WAT 215 22.003 15.253 12.054 1.00 0.00 O ATOM 50538 H1 WAT 215 21.708 15.147 11.149 1.00 0.00 H ATOM 50539 H2 WAT 215 22.907 15.556 11.977 1.00 0.00 H TER 50541 WAT 215 ATOM 50541 O WAT 216 125.559 26.239 125.458 1.00 0.00 O ATOM 50542 H1 WAT 216 124.753 26.346 125.963 1.00 0.00 H ATOM 50543 H2 WAT 216 125.735 27.109 125.100 1.00 0.00 H TER 50545 WAT 216 ATOM 50545 O WAT 217 86.623 106.459 131.067 1.00 0.00 O ATOM 50546 H1 WAT 217 87.534 106.376 131.350 1.00 0.00 H ATOM 50547 H2 WAT 217 86.680 106.787 130.169 1.00 0.00 H TER 50549 WAT 217 ATOM 50549 O WAT 218 143.491 51.100 9.470 1.00 0.00 O ATOM 50550 H1 WAT 218 142.738 50.532 9.634 1.00 0.00 H ATOM 50551 H2 WAT 218 143.689 51.488 10.322 1.00 0.00 H TER 50553 WAT 218 ATOM 50553 O WAT 219 39.206 97.709 92.686 1.00 0.00 O ATOM 50554 H1 WAT 219 39.024 98.623 92.901 1.00 0.00 H ATOM 50555 H2 WAT 219 38.344 97.320 92.540 1.00 0.00 H TER 50557 WAT 219 ATOM 50557 O WAT 220 22.572 48.181 72.826 1.00 0.00 O ATOM 50558 H1 WAT 220 22.205 48.237 71.944 1.00 0.00 H ATOM 50559 H2 WAT 220 22.246 48.963 73.272 1.00 0.00 H TER 50561 WAT 220 ATOM 50561 O WAT 221 100.121 25.641 8.927 1.00 0.00 O ATOM 50562 H1 WAT 221 99.383 25.537 9.527 1.00 0.00 H ATOM 50563 H2 WAT 221 99.754 25.461 8.062 1.00 0.00 H TER 50565 WAT 221 ATOM 50565 O WAT 222 128.763 36.270 67.720 1.00 0.00 O ATOM 50566 H1 WAT 222 128.172 36.638 68.376 1.00 0.00 H ATOM 50567 H2 WAT 222 128.375 35.424 67.495 1.00 0.00 H TER 50569 WAT 222 ATOM 50569 O WAT 223 73.085 114.097 147.961 1.00 0.00 O ATOM 50570 H1 WAT 223 73.514 114.896 148.268 1.00 0.00 H ATOM 50571 H2 WAT 223 72.191 114.369 147.753 1.00 0.00 H TER 50573 WAT 223 ATOM 50573 O WAT 224 59.398 7.155 138.600 1.00 0.00 O ATOM 50574 H1 WAT 224 59.062 7.632 137.841 1.00 0.00 H ATOM 50575 H2 WAT 224 58.867 6.360 138.638 1.00 0.00 H TER 50577 WAT 224 ATOM 50577 O WAT 225 40.925 83.007 72.870 1.00 0.00 O ATOM 50578 H1 WAT 225 39.982 82.912 73.005 1.00 0.00 H ATOM 50579 H2 WAT 225 41.228 83.503 73.631 1.00 0.00 H TER 50581 WAT 225 ATOM 50581 O WAT 226 65.195 81.977 157.044 1.00 0.00 O ATOM 50582 H1 WAT 226 65.163 81.135 156.591 1.00 0.00 H ATOM 50583 H2 WAT 226 64.709 82.574 156.475 1.00 0.00 H TER 50585 WAT 226 ATOM 50585 O WAT 227 114.277 101.053 124.821 1.00 0.00 O ATOM 50586 H1 WAT 227 114.648 100.665 125.615 1.00 0.00 H ATOM 50587 H2 WAT 227 114.010 101.932 125.087 1.00 0.00 H TER 50589 WAT 227 ATOM 50589 O WAT 228 118.583 19.063 18.985 1.00 0.00 O ATOM 50590 H1 WAT 228 119.468 19.416 19.075 1.00 0.00 H ATOM 50591 H2 WAT 228 118.335 18.810 19.874 1.00 0.00 H TER 50593 WAT 228 ATOM 50593 O WAT 229 32.388 47.199 74.109 1.00 0.00 O ATOM 50594 H1 WAT 229 32.189 47.617 74.947 1.00 0.00 H ATOM 50595 H2 WAT 229 32.721 47.909 73.560 1.00 0.00 H TER 50597 WAT 229 ATOM 50597 O WAT 230 86.842 125.828 2.421 1.00 0.00 O ATOM 50598 H1 WAT 230 87.010 125.304 3.204 1.00 0.00 H ATOM 50599 H2 WAT 230 86.252 126.520 2.718 1.00 0.00 H TER 50601 WAT 230 ATOM 50601 O WAT 231 135.171 26.464 112.167 1.00 0.00 O ATOM 50602 H1 WAT 231 134.454 27.003 112.502 1.00 0.00 H ATOM 50603 H2 WAT 231 134.764 25.621 111.968 1.00 0.00 H TER 50605 WAT 231 ATOM 50605 O WAT 232 99.372 82.584 18.624 1.00 0.00 O ATOM 50606 H1 WAT 232 99.573 81.683 18.375 1.00 0.00 H ATOM 50607 H2 WAT 232 98.531 82.525 19.078 1.00 0.00 H TER 50609 WAT 232 ATOM 50609 O WAT 233 127.114 13.918 90.730 1.00 0.00 O ATOM 50610 H1 WAT 233 126.697 14.618 90.228 1.00 0.00 H ATOM 50611 H2 WAT 233 127.237 13.210 90.098 1.00 0.00 H TER 50613 WAT 233 ATOM 50613 O WAT 234 88.667 42.425 97.427 1.00 0.00 O ATOM 50614 H1 WAT 234 89.285 42.558 96.708 1.00 0.00 H ATOM 50615 H2 WAT 234 88.029 43.131 97.328 1.00 0.00 H TER 50617 WAT 234 ATOM 50617 O WAT 235 88.049 136.842 148.954 1.00 0.00 O ATOM 50618 H1 WAT 235 88.414 137.542 149.495 1.00 0.00 H ATOM 50619 H2 WAT 235 88.814 136.369 148.626 1.00 0.00 H TER 50621 WAT 235 ATOM 50621 O WAT 236 140.328 4.520 17.347 1.00 0.00 O ATOM 50622 H1 WAT 236 139.892 5.361 17.483 1.00 0.00 H ATOM 50623 H2 WAT 236 141.141 4.587 17.848 1.00 0.00 H TER 50625 WAT 236 ATOM 50625 O WAT 237 112.748 68.696 98.288 1.00 0.00 O ATOM 50626 H1 WAT 237 112.772 69.490 97.754 1.00 0.00 H ATOM 50627 H2 WAT 237 111.942 68.773 98.798 1.00 0.00 H TER 50629 WAT 237 ATOM 50629 O WAT 238 125.007 126.667 147.837 1.00 0.00 O ATOM 50630 H1 WAT 238 125.179 126.612 146.897 1.00 0.00 H ATOM 50631 H2 WAT 238 125.876 126.675 148.239 1.00 0.00 H TER 50633 WAT 238 ATOM 50633 O WAT 239 92.727 1.772 7.659 1.00 0.00 O ATOM 50634 H1 WAT 239 92.366 2.224 6.896 1.00 0.00 H ATOM 50635 H2 WAT 239 93.198 1.023 7.292 1.00 0.00 H TER 50637 WAT 239 ATOM 50637 O WAT 240 13.136 113.676 131.958 1.00 0.00 O ATOM 50638 H1 WAT 240 12.786 114.364 132.523 1.00 0.00 H ATOM 50639 H2 WAT 240 12.505 113.611 131.241 1.00 0.00 H TER 50641 WAT 240 ATOM 50641 O WAT 241 111.106 93.563 7.332 1.00 0.00 O ATOM 50642 H1 WAT 241 110.525 94.179 6.886 1.00 0.00 H ATOM 50643 H2 WAT 241 110.858 93.626 8.255 1.00 0.00 H TER 50645 WAT 241 ATOM 50645 O WAT 242 117.889 31.586 13.857 1.00 0.00 O ATOM 50646 H1 WAT 242 117.672 31.124 13.048 1.00 0.00 H ATOM 50647 H2 WAT 242 117.383 31.136 14.533 1.00 0.00 H TER 50649 WAT 242 ATOM 50649 O WAT 243 91.016 93.111 120.677 1.00 0.00 O ATOM 50650 H1 WAT 243 90.903 93.945 120.220 1.00 0.00 H ATOM 50651 H2 WAT 243 90.335 92.545 120.315 1.00 0.00 H TER 50653 WAT 243 ATOM 50653 O WAT 244 43.006 135.307 158.465 1.00 0.00 O ATOM 50654 H1 WAT 244 42.872 135.653 159.348 1.00 0.00 H ATOM 50655 H2 WAT 244 42.170 134.898 158.239 1.00 0.00 H TER 50657 WAT 244 ATOM 50657 O WAT 245 56.406 141.769 125.737 1.00 0.00 O ATOM 50658 H1 WAT 245 55.463 141.850 125.600 1.00 0.00 H ATOM 50659 H2 WAT 245 56.770 141.681 124.856 1.00 0.00 H TER 50661 WAT 245 ATOM 50661 O WAT 246 90.787 115.150 2.104 1.00 0.00 O ATOM 50662 H1 WAT 246 90.440 115.424 1.255 1.00 0.00 H ATOM 50663 H2 WAT 246 90.734 115.934 2.650 1.00 0.00 H TER 50665 WAT 246 ATOM 50665 O WAT 247 85.972 18.805 67.644 1.00 0.00 O ATOM 50666 H1 WAT 247 86.253 19.697 67.848 1.00 0.00 H ATOM 50667 H2 WAT 247 86.369 18.618 66.794 1.00 0.00 H TER 50669 WAT 247 ATOM 50669 O WAT 248 107.587 97.237 140.158 1.00 0.00 O ATOM 50670 H1 WAT 248 107.314 98.071 140.540 1.00 0.00 H ATOM 50671 H2 WAT 248 107.006 96.590 140.557 1.00 0.00 H TER 50673 WAT 248 ATOM 50673 O WAT 249 33.937 49.890 78.414 1.00 0.00 O ATOM 50674 H1 WAT 249 33.509 49.466 77.670 1.00 0.00 H ATOM 50675 H2 WAT 249 33.535 50.758 78.459 1.00 0.00 H TER 50677 WAT 249 ATOM 50677 O WAT 250 93.452 12.736 54.843 1.00 0.00 O ATOM 50678 H1 WAT 250 92.644 12.769 54.331 1.00 0.00 H ATOM 50679 H2 WAT 250 93.923 11.977 54.497 1.00 0.00 H TER 50681 WAT 250 ATOM 50681 O WAT 251 14.926 11.178 87.686 1.00 0.00 O ATOM 50682 H1 WAT 251 15.029 11.419 88.607 1.00 0.00 H ATOM 50683 H2 WAT 251 14.349 11.850 87.326 1.00 0.00 H TER 50685 WAT 251 ATOM 50685 O WAT 252 2.527 127.092 94.909 1.00 0.00 O ATOM 50686 H1 WAT 252 3.445 127.192 95.163 1.00 0.00 H ATOM 50687 H2 WAT 252 2.531 126.375 94.275 1.00 0.00 H TER 50689 WAT 252 ATOM 50689 O WAT 253 131.019 1.903 75.690 1.00 0.00 O ATOM 50690 H1 WAT 253 131.190 2.828 75.865 1.00 0.00 H ATOM 50691 H2 WAT 253 131.682 1.654 75.046 1.00 0.00 H TER 50693 WAT 253 ATOM 50693 O WAT 254 76.320 31.572 14.542 1.00 0.00 O ATOM 50694 H1 WAT 254 76.088 31.229 13.679 1.00 0.00 H ATOM 50695 H2 WAT 254 76.806 30.860 14.960 1.00 0.00 H TER 50697 WAT 254 ATOM 50697 O WAT 255 84.030 87.559 93.832 1.00 0.00 O ATOM 50698 H1 WAT 255 84.261 86.635 93.737 1.00 0.00 H ATOM 50699 H2 WAT 255 83.103 87.599 93.599 1.00 0.00 H TER 50701 WAT 255 ATOM 50701 O WAT 256 128.506 73.906 65.216 1.00 0.00 O ATOM 50702 H1 WAT 256 129.171 73.674 65.864 1.00 0.00 H ATOM 50703 H2 WAT 256 128.786 74.758 64.880 1.00 0.00 H TER 50705 WAT 256 ATOM 50705 O WAT 257 122.812 142.448 108.802 1.00 0.00 O ATOM 50706 H1 WAT 257 123.342 141.765 108.391 1.00 0.00 H ATOM 50707 H2 WAT 257 123.450 143.048 109.186 1.00 0.00 H TER 50709 WAT 257 ATOM 50709 O WAT 258 36.648 106.274 111.447 1.00 0.00 O ATOM 50710 H1 WAT 258 36.712 106.579 110.541 1.00 0.00 H ATOM 50711 H2 WAT 258 36.218 105.421 111.382 1.00 0.00 H TER 50713 WAT 258 ATOM 50713 O WAT 259 10.057 40.387 14.945 1.00 0.00 O ATOM 50714 H1 WAT 259 10.632 40.052 15.633 1.00 0.00 H ATOM 50715 H2 WAT 259 9.533 41.061 15.377 1.00 0.00 H TER 50717 WAT 259 ATOM 50717 O WAT 260 36.998 57.842 100.589 1.00 0.00 O ATOM 50718 H1 WAT 260 36.956 58.232 101.462 1.00 0.00 H ATOM 50719 H2 WAT 260 36.142 58.025 100.203 1.00 0.00 H TER 50721 WAT 260 ATOM 50721 O WAT 261 124.107 38.099 156.028 1.00 0.00 O ATOM 50722 H1 WAT 261 125.028 38.176 156.278 1.00 0.00 H ATOM 50723 H2 WAT 261 123.637 38.614 156.684 1.00 0.00 H TER 50725 WAT 261 ATOM 50725 O WAT 262 2.729 112.949 135.059 1.00 0.00 O ATOM 50726 H1 WAT 262 2.865 113.775 134.595 1.00 0.00 H ATOM 50727 H2 WAT 262 2.699 112.288 134.368 1.00 0.00 H TER 50729 WAT 262 ATOM 50729 O WAT 263 84.374 140.929 149.375 1.00 0.00 O ATOM 50730 H1 WAT 263 83.884 140.128 149.189 1.00 0.00 H ATOM 50731 H2 WAT 263 84.743 141.186 148.530 1.00 0.00 H TER 50733 WAT 263 ATOM 50733 O WAT 264 105.068 6.605 157.065 1.00 0.00 O ATOM 50734 H1 WAT 264 104.143 6.536 156.830 1.00 0.00 H ATOM 50735 H2 WAT 264 105.201 7.536 157.242 1.00 0.00 H TER 50737 WAT 264 ATOM 50737 O WAT 265 2.273 126.847 126.549 1.00 0.00 O ATOM 50738 H1 WAT 265 2.910 127.485 126.872 1.00 0.00 H ATOM 50739 H2 WAT 265 2.389 126.085 127.116 1.00 0.00 H TER 50741 WAT 265 ATOM 50741 O WAT 266 46.727 143.995 91.143 1.00 0.00 O ATOM 50742 H1 WAT 266 47.325 143.371 90.732 1.00 0.00 H ATOM 50743 H2 WAT 266 45.973 144.027 90.555 1.00 0.00 H TER 50745 WAT 266 ATOM 50745 O WAT 267 91.929 39.573 138.130 1.00 0.00 O ATOM 50746 H1 WAT 267 92.858 39.354 138.057 1.00 0.00 H ATOM 50747 H2 WAT 267 91.814 39.825 139.046 1.00 0.00 H TER 50749 WAT 267 ATOM 50749 O WAT 268 4.436 111.772 140.077 1.00 0.00 O ATOM 50750 H1 WAT 268 5.218 112.287 139.880 1.00 0.00 H ATOM 50751 H2 WAT 268 3.943 111.761 139.257 1.00 0.00 H TER 50753 WAT 268 ATOM 50753 O WAT 269 69.090 5.267 150.833 1.00 0.00 O ATOM 50754 H1 WAT 269 69.178 5.625 149.950 1.00 0.00 H ATOM 50755 H2 WAT 269 68.314 5.697 151.190 1.00 0.00 H TER 50757 WAT 269 ATOM 50757 O WAT 270 0.605 7.167 89.346 1.00 0.00 O ATOM 50758 H1 WAT 270 0.438 7.347 90.271 1.00 0.00 H ATOM 50759 H2 WAT 270 1.544 7.319 89.238 1.00 0.00 H TER 50761 WAT 270 ATOM 50761 O WAT 271 131.132 55.909 88.346 1.00 0.00 O ATOM 50762 H1 WAT 271 130.407 56.334 88.804 1.00 0.00 H ATOM 50763 H2 WAT 271 131.809 55.804 89.014 1.00 0.00 H TER 50765 WAT 271 ATOM 50765 O WAT 272 35.522 85.932 151.981 1.00 0.00 O ATOM 50766 H1 WAT 272 34.888 86.630 152.143 1.00 0.00 H ATOM 50767 H2 WAT 272 35.738 86.015 151.052 1.00 0.00 H TER 50769 WAT 272 ATOM 50769 O WAT 273 13.740 130.454 73.979 1.00 0.00 O ATOM 50770 H1 WAT 273 13.703 131.405 73.878 1.00 0.00 H ATOM 50771 H2 WAT 273 14.478 130.304 74.570 1.00 0.00 H TER 50773 WAT 273 ATOM 50773 O WAT 274 10.021 49.514 115.642 1.00 0.00 O ATOM 50774 H1 WAT 274 10.248 49.545 114.713 1.00 0.00 H ATOM 50775 H2 WAT 274 9.446 48.753 115.724 1.00 0.00 H TER 50777 WAT 274 ATOM 50777 O WAT 275 47.588 58.472 123.912 1.00 0.00 O ATOM 50778 H1 WAT 275 46.897 58.125 124.475 1.00 0.00 H ATOM 50779 H2 WAT 275 47.979 59.181 124.422 1.00 0.00 H TER 50781 WAT 275 ATOM 50781 O WAT 276 17.334 131.372 107.404 1.00 0.00 O ATOM 50782 H1 WAT 276 18.076 130.768 107.417 1.00 0.00 H ATOM 50783 H2 WAT 276 17.288 131.714 108.297 1.00 0.00 H TER 50785 WAT 276 ATOM 50785 O WAT 277 81.754 71.945 145.714 1.00 0.00 O ATOM 50786 H1 WAT 277 81.569 72.345 146.564 1.00 0.00 H ATOM 50787 H2 WAT 277 81.127 71.226 145.646 1.00 0.00 H TER 50789 WAT 277 ATOM 50789 O WAT 278 73.632 53.641 25.931 1.00 0.00 O ATOM 50790 H1 WAT 278 73.788 54.412 26.476 1.00 0.00 H ATOM 50791 H2 WAT 278 74.500 53.392 25.613 1.00 0.00 H TER 50793 WAT 278 ATOM 50793 O WAT 279 132.106 141.259 84.027 1.00 0.00 O ATOM 50794 H1 WAT 279 131.761 140.460 83.629 1.00 0.00 H ATOM 50795 H2 WAT 279 131.329 141.734 84.322 1.00 0.00 H TER 50797 WAT 279 ATOM 50797 O WAT 280 58.303 9.350 15.269 1.00 0.00 O ATOM 50798 H1 WAT 280 58.777 8.903 15.970 1.00 0.00 H ATOM 50799 H2 WAT 280 58.807 10.149 15.112 1.00 0.00 H TER 50801 WAT 280 ATOM 50801 O WAT 281 127.490 33.141 2.737 1.00 0.00 O ATOM 50802 H1 WAT 281 127.882 32.518 2.125 1.00 0.00 H ATOM 50803 H2 WAT 281 128.159 33.269 3.410 1.00 0.00 H TER 50805 WAT 281 ATOM 50805 O WAT 282 31.009 60.239 100.062 1.00 0.00 O ATOM 50806 H1 WAT 282 31.047 61.183 99.909 1.00 0.00 H ATOM 50807 H2 WAT 282 31.926 59.963 100.078 1.00 0.00 H TER 50809 WAT 282 ATOM 50809 O WAT 283 141.432 101.178 74.819 1.00 0.00 O ATOM 50810 H1 WAT 283 141.514 100.369 74.315 1.00 0.00 H ATOM 50811 H2 WAT 283 140.939 101.767 74.247 1.00 0.00 H TER 50813 WAT 283 ATOM 50813 O WAT 284 102.077 68.708 95.400 1.00 0.00 O ATOM 50814 H1 WAT 284 101.823 69.539 95.803 1.00 0.00 H ATOM 50815 H2 WAT 284 103.031 68.690 95.469 1.00 0.00 H TER 50817 WAT 284 ATOM 50817 O WAT 285 63.917 30.426 127.293 1.00 0.00 O ATOM 50818 H1 WAT 285 63.402 29.738 126.871 1.00 0.00 H ATOM 50819 H2 WAT 285 63.460 31.237 127.073 1.00 0.00 H TER 50821 WAT 285 ATOM 50821 O WAT 286 111.653 113.973 123.561 1.00 0.00 O ATOM 50822 H1 WAT 286 110.927 114.282 123.018 1.00 0.00 H ATOM 50823 H2 WAT 286 111.545 113.023 123.585 1.00 0.00 H TER 50825 WAT 286 ATOM 50825 O WAT 287 37.274 55.058 11.606 1.00 0.00 O ATOM 50826 H1 WAT 287 38.218 55.210 11.609 1.00 0.00 H ATOM 50827 H2 WAT 287 37.166 54.227 11.143 1.00 0.00 H TER 50829 WAT 287 ATOM 50829 O WAT 288 43.334 108.687 107.447 1.00 0.00 O ATOM 50830 H1 WAT 288 43.692 109.557 107.271 1.00 0.00 H ATOM 50831 H2 WAT 288 42.478 108.855 107.841 1.00 0.00 H TER 50833 WAT 288 ATOM 50833 O WAT 289 128.432 62.650 101.442 1.00 0.00 O ATOM 50834 H1 WAT 289 128.667 62.433 102.344 1.00 0.00 H ATOM 50835 H2 WAT 289 129.173 63.160 101.117 1.00 0.00 H TER 50837 WAT 289 ATOM 50837 O WAT 290 23.371 90.249 23.857 1.00 0.00 O ATOM 50838 H1 WAT 290 24.231 89.839 23.767 1.00 0.00 H ATOM 50839 H2 WAT 290 23.226 90.297 24.802 1.00 0.00 H TER 50841 WAT 290 ATOM 50841 O WAT 291 13.160 110.056 83.032 1.00 0.00 O ATOM 50842 H1 WAT 291 13.236 109.824 83.958 1.00 0.00 H ATOM 50843 H2 WAT 291 13.321 109.235 82.566 1.00 0.00 H TER 50845 WAT 291 ATOM 50845 O WAT 292 104.558 72.772 156.769 1.00 0.00 O ATOM 50846 H1 WAT 292 105.276 72.165 156.586 1.00 0.00 H ATOM 50847 H2 WAT 292 104.146 72.424 157.559 1.00 0.00 H TER 50849 WAT 292 ATOM 50849 O WAT 293 99.303 106.350 3.526 1.00 0.00 O ATOM 50850 H1 WAT 293 99.340 107.306 3.499 1.00 0.00 H ATOM 50851 H2 WAT 293 99.604 106.074 2.660 1.00 0.00 H TER 50853 WAT 293 ATOM 50853 O WAT 294 43.076 120.211 124.295 1.00 0.00 O ATOM 50854 H1 WAT 294 43.097 119.714 125.113 1.00 0.00 H ATOM 50855 H2 WAT 294 42.158 120.187 124.023 1.00 0.00 H TER 50857 WAT 294 ATOM 50857 O WAT 295 114.619 27.202 66.737 1.00 0.00 O ATOM 50858 H1 WAT 295 115.023 27.831 67.335 1.00 0.00 H ATOM 50859 H2 WAT 295 115.063 27.348 65.901 1.00 0.00 H TER 50861 WAT 295 ATOM 50861 O WAT 296 117.901 14.562 82.065 1.00 0.00 O ATOM 50862 H1 WAT 296 117.274 14.275 81.401 1.00 0.00 H ATOM 50863 H2 WAT 296 117.475 15.305 82.492 1.00 0.00 H TER 50865 WAT 296 ATOM 50865 O WAT 297 9.183 49.772 72.654 1.00 0.00 O ATOM 50866 H1 WAT 297 9.839 49.076 72.618 1.00 0.00 H ATOM 50867 H2 WAT 297 8.425 49.411 72.194 1.00 0.00 H TER 50869 WAT 297 ATOM 50869 O WAT 298 101.318 70.310 66.664 1.00 0.00 O ATOM 50870 H1 WAT 298 102.002 70.871 67.030 1.00 0.00 H ATOM 50871 H2 WAT 298 101.790 69.556 66.310 1.00 0.00 H TER 50873 WAT 298 ATOM 50873 O WAT 299 92.197 57.020 154.419 1.00 0.00 O ATOM 50874 H1 WAT 299 93.141 57.104 154.549 1.00 0.00 H ATOM 50875 H2 WAT 299 91.971 57.740 153.830 1.00 0.00 H TER 50877 WAT 299 ATOM 50877 O WAT 300 15.032 108.015 156.554 1.00 0.00 O ATOM 50878 H1 WAT 300 14.562 108.759 156.178 1.00 0.00 H ATOM 50879 H2 WAT 300 14.716 107.964 157.456 1.00 0.00 H TER 50881 WAT 300 ATOM 50881 O WAT 301 70.365 9.102 67.170 1.00 0.00 O ATOM 50882 H1 WAT 301 71.055 8.588 66.751 1.00 0.00 H ATOM 50883 H2 WAT 301 70.532 10.001 66.889 1.00 0.00 H TER 50885 WAT 301 ATOM 50885 O WAT 302 44.584 90.577 23.969 1.00 0.00 O ATOM 50886 H1 WAT 302 44.025 91.287 24.284 1.00 0.00 H ATOM 50887 H2 WAT 302 45.402 91.007 23.721 1.00 0.00 H TER 50889 WAT 302 ATOM 50889 O WAT 303 4.734 3.816 135.391 1.00 0.00 O ATOM 50890 H1 WAT 303 3.853 4.192 135.396 1.00 0.00 H ATOM 50891 H2 WAT 303 4.655 3.028 134.853 1.00 0.00 H TER 50893 WAT 303 ATOM 50893 O WAT 304 68.396 67.402 100.896 1.00 0.00 O ATOM 50894 H1 WAT 304 68.684 67.151 101.774 1.00 0.00 H ATOM 50895 H2 WAT 304 68.085 68.301 100.994 1.00 0.00 H TER 50897 WAT 304 ATOM 50897 O WAT 305 7.678 128.015 126.592 1.00 0.00 O ATOM 50898 H1 WAT 305 7.481 128.714 127.216 1.00 0.00 H ATOM 50899 H2 WAT 305 8.635 127.988 126.558 1.00 0.00 H TER 50901 WAT 305 ATOM 50901 O WAT 306 16.334 21.996 127.723 1.00 0.00 O ATOM 50902 H1 WAT 306 16.708 22.607 128.358 1.00 0.00 H ATOM 50903 H2 WAT 306 15.630 22.490 127.302 1.00 0.00 H TER 50905 WAT 306 ATOM 50905 O WAT 307 79.001 23.583 55.218 1.00 0.00 O ATOM 50906 H1 WAT 307 79.727 24.082 55.592 1.00 0.00 H ATOM 50907 H2 WAT 307 78.939 23.891 54.314 1.00 0.00 H TER 50909 WAT 307 ATOM 50909 O WAT 308 135.904 116.577 1.670 1.00 0.00 O ATOM 50910 H1 WAT 308 135.784 115.734 1.233 1.00 0.00 H ATOM 50911 H2 WAT 308 136.463 116.380 2.421 1.00 0.00 H TER 50913 WAT 308 ATOM 50913 O WAT 309 114.121 73.917 134.721 1.00 0.00 O ATOM 50914 H1 WAT 309 113.240 74.242 134.537 1.00 0.00 H ATOM 50915 H2 WAT 309 114.681 74.371 134.091 1.00 0.00 H TER 50917 WAT 309 ATOM 50917 O WAT 310 1.397 31.360 17.288 1.00 0.00 O ATOM 50918 H1 WAT 310 1.561 31.679 18.176 1.00 0.00 H ATOM 50919 H2 WAT 310 0.739 30.673 17.398 1.00 0.00 H TER 50921 WAT 310 ATOM 50921 O WAT 311 106.568 70.037 106.382 1.00 0.00 O ATOM 50922 H1 WAT 311 107.517 70.021 106.503 1.00 0.00 H ATOM 50923 H2 WAT 311 106.213 69.760 107.227 1.00 0.00 H TER 50925 WAT 311 ATOM 50925 O WAT 312 67.650 37.384 77.567 1.00 0.00 O ATOM 50926 H1 WAT 312 67.018 37.759 76.953 1.00 0.00 H ATOM 50927 H2 WAT 312 67.968 36.594 77.130 1.00 0.00 H TER 50929 WAT 312 ATOM 50929 O WAT 313 120.791 131.461 107.621 1.00 0.00 O ATOM 50930 H1 WAT 313 121.418 131.441 106.899 1.00 0.00 H ATOM 50931 H2 WAT 313 121.331 131.553 108.406 1.00 0.00 H TER 50933 WAT 313 ATOM 50933 O WAT 314 105.917 103.585 87.606 1.00 0.00 O ATOM 50934 H1 WAT 314 105.641 104.421 87.981 1.00 0.00 H ATOM 50935 H2 WAT 314 105.425 102.928 88.098 1.00 0.00 H TER 50937 WAT 314 ATOM 50937 O WAT 315 145.377 7.539 109.020 1.00 0.00 O ATOM 50938 H1 WAT 315 145.800 8.397 109.040 1.00 0.00 H ATOM 50939 H2 WAT 315 145.731 7.079 109.781 1.00 0.00 H TER 50941 WAT 315 ATOM 50941 O WAT 316 95.446 94.461 101.266 1.00 0.00 O ATOM 50942 H1 WAT 316 95.474 93.724 100.655 1.00 0.00 H ATOM 50943 H2 WAT 316 95.678 94.079 102.112 1.00 0.00 H TER 50945 WAT 316 ATOM 50945 O WAT 317 0.556 79.878 140.094 1.00 0.00 O ATOM 50946 H1 WAT 317 0.392 78.997 139.760 1.00 0.00 H ATOM 50947 H2 WAT 317 0.676 79.759 141.036 1.00 0.00 H TER 50949 WAT 317 ATOM 50949 O WAT 318 110.923 125.049 91.566 1.00 0.00 O ATOM 50950 H1 WAT 318 110.668 125.953 91.752 1.00 0.00 H ATOM 50951 H2 WAT 318 110.348 124.519 92.119 1.00 0.00 H TER 50953 WAT 318 ATOM 50953 O WAT 319 61.854 36.480 155.521 1.00 0.00 O ATOM 50954 H1 WAT 319 61.995 35.608 155.890 1.00 0.00 H ATOM 50955 H2 WAT 319 61.020 36.765 155.893 1.00 0.00 H TER 50957 WAT 319 ATOM 50957 O WAT 320 125.032 53.668 96.594 1.00 0.00 O ATOM 50958 H1 WAT 320 125.834 53.150 96.520 1.00 0.00 H ATOM 50959 H2 WAT 320 125.322 54.509 96.946 1.00 0.00 H TER 50961 WAT 320 ATOM 50961 O WAT 321 14.767 73.228 62.530 1.00 0.00 O ATOM 50962 H1 WAT 321 15.142 73.080 63.398 1.00 0.00 H ATOM 50963 H2 WAT 321 14.963 74.145 62.337 1.00 0.00 H TER 50965 WAT 321 ATOM 50965 O WAT 322 47.903 65.672 155.540 1.00 0.00 O ATOM 50966 H1 WAT 322 48.344 65.638 156.389 1.00 0.00 H ATOM 50967 H2 WAT 322 47.316 66.426 155.605 1.00 0.00 H TER 50969 WAT 322 ATOM 50969 O WAT 323 72.984 138.849 7.079 1.00 0.00 O ATOM 50970 H1 WAT 323 73.318 139.498 6.460 1.00 0.00 H ATOM 50971 H2 WAT 323 73.659 138.170 7.102 1.00 0.00 H TER 50973 WAT 323 ATOM 50973 O WAT 324 87.844 54.295 148.544 1.00 0.00 O ATOM 50974 H1 WAT 324 88.498 54.481 147.870 1.00 0.00 H ATOM 50975 H2 WAT 324 87.274 55.064 148.543 1.00 0.00 H TER 50977 WAT 324 ATOM 50977 O WAT 325 62.590 104.630 142.874 1.00 0.00 O ATOM 50978 H1 WAT 325 62.365 105.376 143.430 1.00 0.00 H ATOM 50979 H2 WAT 325 62.449 104.946 141.981 1.00 0.00 H TER 50981 WAT 325 ATOM 50981 O WAT 326 131.588 34.291 14.728 1.00 0.00 O ATOM 50982 H1 WAT 326 131.714 34.993 14.090 1.00 0.00 H ATOM 50983 H2 WAT 326 130.706 34.434 15.071 1.00 0.00 H TER 50985 WAT 326 ATOM 50985 O WAT 327 35.114 108.389 106.375 1.00 0.00 O ATOM 50986 H1 WAT 327 34.471 107.862 105.900 1.00 0.00 H ATOM 50987 H2 WAT 327 35.780 108.600 105.721 1.00 0.00 H TER 50989 WAT 327 ATOM 50989 O WAT 328 7.167 33.162 64.380 1.00 0.00 O ATOM 50990 H1 WAT 328 6.914 32.291 64.687 1.00 0.00 H ATOM 50991 H2 WAT 328 8.099 33.227 64.586 1.00 0.00 H TER 50993 WAT 328 ATOM 50993 O WAT 329 73.243 42.810 111.736 1.00 0.00 O ATOM 50994 H1 WAT 329 73.143 42.978 112.673 1.00 0.00 H ATOM 50995 H2 WAT 329 72.456 43.186 111.340 1.00 0.00 H TER 50997 WAT 329 ATOM 50997 O WAT 330 17.616 135.513 3.335 1.00 0.00 O ATOM 50998 H1 WAT 330 16.869 134.936 3.175 1.00 0.00 H ATOM 50999 H2 WAT 330 18.321 134.924 3.603 1.00 0.00 H TER 51001 WAT 330 ATOM 51001 O WAT 331 93.578 142.885 146.632 1.00 0.00 O ATOM 51002 H1 WAT 331 94.198 142.192 146.404 1.00 0.00 H ATOM 51003 H2 WAT 331 93.956 143.678 146.251 1.00 0.00 H TER 51005 WAT 331 ATOM 51005 O WAT 332 99.135 6.971 146.806 1.00 0.00 O ATOM 51006 H1 WAT 332 99.868 7.534 147.055 1.00 0.00 H ATOM 51007 H2 WAT 332 99.215 6.877 145.857 1.00 0.00 H TER 51009 WAT 332 ATOM 51009 O WAT 333 98.397 38.674 89.368 1.00 0.00 O ATOM 51010 H1 WAT 333 97.668 38.219 89.790 1.00 0.00 H ATOM 51011 H2 WAT 333 99.051 37.993 89.218 1.00 0.00 H TER 51013 WAT 333 ATOM 51013 O WAT 334 123.050 46.175 148.405 1.00 0.00 O ATOM 51014 H1 WAT 334 122.989 45.241 148.204 1.00 0.00 H ATOM 51015 H2 WAT 334 123.448 46.206 149.275 1.00 0.00 H TER 51017 WAT 334 ATOM 51017 O WAT 335 11.057 34.996 76.560 1.00 0.00 O ATOM 51018 H1 WAT 335 10.726 35.224 75.691 1.00 0.00 H ATOM 51019 H2 WAT 335 11.638 35.720 76.792 1.00 0.00 H TER 51021 WAT 335 ATOM 51021 O WAT 336 85.318 54.286 89.095 1.00 0.00 O ATOM 51022 H1 WAT 336 85.312 54.395 90.046 1.00 0.00 H ATOM 51023 H2 WAT 336 84.705 53.570 88.931 1.00 0.00 H TER 51025 WAT 336 ATOM 51025 O WAT 337 3.681 117.772 92.211 1.00 0.00 O ATOM 51026 H1 WAT 337 4.500 117.813 92.705 1.00 0.00 H ATOM 51027 H2 WAT 337 3.522 116.836 92.087 1.00 0.00 H TER 51029 WAT 337 ATOM 51029 O WAT 338 98.335 102.303 125.971 1.00 0.00 O ATOM 51030 H1 WAT 338 98.785 102.764 125.263 1.00 0.00 H ATOM 51031 H2 WAT 338 98.784 101.460 126.031 1.00 0.00 H TER 51033 WAT 338 ATOM 51033 O WAT 339 75.664 62.079 145.221 1.00 0.00 O ATOM 51034 H1 WAT 339 75.756 61.211 144.829 1.00 0.00 H ATOM 51035 H2 WAT 339 76.384 62.588 144.850 1.00 0.00 H TER 51037 WAT 339 ATOM 51037 O WAT 340 136.516 10.320 114.280 1.00 0.00 O ATOM 51038 H1 WAT 340 136.225 9.560 114.785 1.00 0.00 H ATOM 51039 H2 WAT 340 137.098 9.955 113.614 1.00 0.00 H TER 51041 WAT 340 ATOM 51041 O WAT 341 6.227 116.971 19.087 1.00 0.00 O ATOM 51042 H1 WAT 341 6.829 117.626 18.734 1.00 0.00 H ATOM 51043 H2 WAT 341 6.505 116.856 19.996 1.00 0.00 H TER 51045 WAT 341 ATOM 51045 O WAT 342 101.728 29.040 153.298 1.00 0.00 O ATOM 51046 H1 WAT 342 102.342 28.555 153.849 1.00 0.00 H ATOM 51047 H2 WAT 342 100.870 28.865 153.684 1.00 0.00 H TER 51049 WAT 342 ATOM 51049 O WAT 343 108.318 129.502 154.191 1.00 0.00 O ATOM 51050 H1 WAT 343 107.860 130.136 154.742 1.00 0.00 H ATOM 51051 H2 WAT 343 108.552 129.993 153.403 1.00 0.00 H TER 51053 WAT 343 ATOM 51053 O WAT 344 132.973 56.192 150.445 1.00 0.00 O ATOM 51054 H1 WAT 344 133.588 55.788 151.057 1.00 0.00 H ATOM 51055 H2 WAT 344 132.497 55.456 150.062 1.00 0.00 H TER 51057 WAT 344 ATOM 51057 O WAT 345 18.265 99.531 86.292 1.00 0.00 O ATOM 51058 H1 WAT 345 17.478 100.076 86.285 1.00 0.00 H ATOM 51059 H2 WAT 345 17.958 98.663 86.032 1.00 0.00 H TER 51061 WAT 345 ATOM 51061 O WAT 346 120.528 22.306 113.276 1.00 0.00 O ATOM 51062 H1 WAT 346 121.400 21.990 113.513 1.00 0.00 H ATOM 51063 H2 WAT 346 119.991 21.516 113.229 1.00 0.00 H TER 51065 WAT 346 ATOM 51065 O WAT 347 26.554 61.324 157.368 1.00 0.00 O ATOM 51066 H1 WAT 347 27.161 60.806 156.840 1.00 0.00 H ATOM 51067 H2 WAT 347 27.041 62.120 157.581 1.00 0.00 H TER 51069 WAT 347 ATOM 51069 O WAT 348 145.583 91.831 75.096 1.00 0.00 O ATOM 51070 H1 WAT 348 145.730 91.256 75.846 1.00 0.00 H ATOM 51071 H2 WAT 348 146.449 91.933 74.699 1.00 0.00 H TER 51073 WAT 348 ATOM 51073 O WAT 349 62.332 100.925 157.107 1.00 0.00 O ATOM 51074 H1 WAT 349 62.598 101.362 156.298 1.00 0.00 H ATOM 51075 H2 WAT 349 61.617 101.463 157.446 1.00 0.00 H TER 51077 WAT 349 ATOM 51077 O WAT 350 42.269 33.043 96.780 1.00 0.00 O ATOM 51078 H1 WAT 350 41.961 32.547 97.539 1.00 0.00 H ATOM 51079 H2 WAT 350 43.197 32.820 96.708 1.00 0.00 H TER 51081 WAT 350 ATOM 51081 O WAT 351 59.437 55.665 118.736 1.00 0.00 O ATOM 51082 H1 WAT 351 60.188 55.084 118.621 1.00 0.00 H ATOM 51083 H2 WAT 351 59.343 56.106 117.892 1.00 0.00 H TER 51085 WAT 351 ATOM 51085 O WAT 352 73.627 133.939 85.399 1.00 0.00 O ATOM 51086 H1 WAT 352 73.882 133.936 86.321 1.00 0.00 H ATOM 51087 H2 WAT 352 73.064 134.708 85.308 1.00 0.00 H TER 51089 WAT 352 ATOM 51089 O WAT 353 103.962 131.944 95.242 1.00 0.00 O ATOM 51090 H1 WAT 353 103.104 131.734 94.875 1.00 0.00 H ATOM 51091 H2 WAT 353 104.369 132.512 94.588 1.00 0.00 H TER 51093 WAT 353 ATOM 51093 O WAT 354 86.614 114.448 155.715 1.00 0.00 O ATOM 51094 H1 WAT 354 85.853 114.730 155.208 1.00 0.00 H ATOM 51095 H2 WAT 354 86.370 113.588 156.055 1.00 0.00 H TER 51097 WAT 354 ATOM 51097 O WAT 355 31.876 132.949 81.245 1.00 0.00 O ATOM 51098 H1 WAT 355 31.027 133.381 81.341 1.00 0.00 H ATOM 51099 H2 WAT 355 31.859 132.241 81.889 1.00 0.00 H TER 51101 WAT 355 ATOM 51101 O WAT 356 63.586 59.384 118.597 1.00 0.00 O ATOM 51102 H1 WAT 356 63.608 58.929 117.754 1.00 0.00 H ATOM 51103 H2 WAT 356 62.709 59.764 118.641 1.00 0.00 H TER 51105 WAT 356 ATOM 51105 O WAT 357 98.743 82.016 92.879 1.00 0.00 O ATOM 51106 H1 WAT 357 99.497 81.567 93.262 1.00 0.00 H ATOM 51107 H2 WAT 357 99.124 82.671 92.296 1.00 0.00 H TER 51109 WAT 357 ATOM 51109 O WAT 358 8.819 26.644 98.646 1.00 0.00 O ATOM 51110 H1 WAT 358 8.604 26.102 97.887 1.00 0.00 H ATOM 51111 H2 WAT 358 9.776 26.656 98.668 1.00 0.00 H TER 51113 WAT 358 ATOM 51113 O WAT 359 140.590 20.070 154.807 1.00 0.00 O ATOM 51114 H1 WAT 359 140.618 19.466 155.549 1.00 0.00 H ATOM 51115 H2 WAT 359 140.234 20.880 155.170 1.00 0.00 H TER 51117 WAT 359 ATOM 51117 O WAT 360 39.807 3.165 138.509 1.00 0.00 O ATOM 51118 H1 WAT 360 39.806 2.675 139.331 1.00 0.00 H ATOM 51119 H2 WAT 360 40.494 3.821 138.621 1.00 0.00 H TER 51121 WAT 360 ATOM 51121 O WAT 361 104.025 69.255 122.846 1.00 0.00 O ATOM 51122 H1 WAT 361 103.954 70.204 122.956 1.00 0.00 H ATOM 51123 H2 WAT 361 103.220 68.909 123.232 1.00 0.00 H TER 51125 WAT 361 ATOM 51125 O WAT 362 11.591 129.494 111.386 1.00 0.00 O ATOM 51126 H1 WAT 362 12.262 129.687 112.041 1.00 0.00 H ATOM 51127 H2 WAT 362 10.885 130.112 111.577 1.00 0.00 H TER 51129 WAT 362 ATOM 51129 O WAT 363 109.204 135.160 144.458 1.00 0.00 O ATOM 51130 H1 WAT 363 109.844 134.551 144.087 1.00 0.00 H ATOM 51131 H2 WAT 363 109.292 135.951 143.927 1.00 0.00 H TER 51133 WAT 363 ATOM 51133 O WAT 364 12.518 53.452 148.511 1.00 0.00 O ATOM 51134 H1 WAT 364 11.795 52.903 148.206 1.00 0.00 H ATOM 51135 H2 WAT 364 12.906 53.804 147.710 1.00 0.00 H TER 51137 WAT 364 ATOM 51137 O WAT 365 23.600 140.166 93.393 1.00 0.00 O ATOM 51138 H1 WAT 365 23.431 140.125 92.452 1.00 0.00 H ATOM 51139 H2 WAT 365 24.436 140.626 93.466 1.00 0.00 H TER 51141 WAT 365 ATOM 51141 O WAT 366 124.726 26.202 0.961 1.00 0.00 O ATOM 51142 H1 WAT 366 125.069 25.324 0.789 1.00 0.00 H ATOM 51143 H2 WAT 366 125.295 26.550 1.648 1.00 0.00 H TER 51145 WAT 366 ATOM 51145 O WAT 367 84.087 3.570 120.137 1.00 0.00 O ATOM 51146 H1 WAT 367 83.283 3.660 119.626 1.00 0.00 H ATOM 51147 H2 WAT 367 84.578 2.879 119.692 1.00 0.00 H TER 51149 WAT 367 ATOM 51149 O WAT 368 63.557 143.340 10.214 1.00 0.00 O ATOM 51150 H1 WAT 368 63.904 142.889 10.983 1.00 0.00 H ATOM 51151 H2 WAT 368 62.828 142.792 9.923 1.00 0.00 H TER 51153 WAT 368 ATOM 51153 O WAT 369 40.559 9.350 73.694 1.00 0.00 O ATOM 51154 H1 WAT 369 41.284 9.880 73.363 1.00 0.00 H ATOM 51155 H2 WAT 369 40.680 9.346 74.644 1.00 0.00 H TER 51157 WAT 369 ATOM 51157 O WAT 370 28.020 98.011 0.406 1.00 0.00 O ATOM 51158 H1 WAT 370 28.734 98.618 0.211 1.00 0.00 H ATOM 51159 H2 WAT 370 28.425 97.144 0.362 1.00 0.00 H TER 51161 WAT 370 ATOM 51161 O WAT 371 45.250 90.931 65.390 1.00 0.00 O ATOM 51162 H1 WAT 371 45.957 91.455 65.013 1.00 0.00 H ATOM 51163 H2 WAT 371 45.302 91.101 66.331 1.00 0.00 H TER 51165 WAT 371 ATOM 51165 O WAT 372 39.684 84.282 68.249 1.00 0.00 O ATOM 51166 H1 WAT 372 39.895 84.394 67.322 1.00 0.00 H ATOM 51167 H2 WAT 372 40.472 83.892 68.628 1.00 0.00 H TER 51169 WAT 372 ATOM 51169 O WAT 373 3.536 143.598 59.861 1.00 0.00 O ATOM 51170 H1 WAT 373 2.947 144.150 60.376 1.00 0.00 H ATOM 51171 H2 WAT 373 4.152 144.213 59.462 1.00 0.00 H TER 51173 WAT 373 ATOM 51173 O WAT 374 14.092 33.452 6.172 1.00 0.00 O ATOM 51174 H1 WAT 374 13.427 32.892 6.574 1.00 0.00 H ATOM 51175 H2 WAT 374 14.455 33.953 6.902 1.00 0.00 H TER 51177 WAT 374 ATOM 51177 O WAT 375 44.282 123.528 67.510 1.00 0.00 O ATOM 51178 H1 WAT 375 44.212 123.305 68.438 1.00 0.00 H ATOM 51179 H2 WAT 375 45.157 123.905 67.420 1.00 0.00 H TER 51181 WAT 375 ATOM 51181 O WAT 376 25.166 54.472 97.987 1.00 0.00 O ATOM 51182 H1 WAT 376 24.542 54.128 97.348 1.00 0.00 H ATOM 51183 H2 WAT 376 26.016 54.149 97.689 1.00 0.00 H TER 51185 WAT 376 ATOM 51185 O WAT 377 3.977 21.194 97.041 1.00 0.00 O ATOM 51186 H1 WAT 377 3.863 21.251 96.092 1.00 0.00 H ATOM 51187 H2 WAT 377 4.586 20.466 97.165 1.00 0.00 H TER 51189 WAT 377 ATOM 51189 O WAT 378 4.883 106.857 108.057 1.00 0.00 O ATOM 51190 H1 WAT 378 4.841 106.733 107.109 1.00 0.00 H ATOM 51191 H2 WAT 378 4.861 107.806 108.176 1.00 0.00 H TER 51193 WAT 378 ATOM 51193 O WAT 379 81.342 10.594 133.757 1.00 0.00 O ATOM 51194 H1 WAT 379 81.982 10.284 133.116 1.00 0.00 H ATOM 51195 H2 WAT 379 81.773 11.333 134.187 1.00 0.00 H TER 51197 WAT 379 ATOM 51197 O WAT 380 80.665 20.028 88.326 1.00 0.00 O ATOM 51198 H1 WAT 380 80.966 20.303 87.460 1.00 0.00 H ATOM 51199 H2 WAT 380 80.988 20.708 88.918 1.00 0.00 H TER 51201 WAT 380 ATOM 51201 O WAT 381 44.562 129.718 12.681 1.00 0.00 O ATOM 51202 H1 WAT 381 44.401 128.889 13.133 1.00 0.00 H ATOM 51203 H2 WAT 381 45.512 129.749 12.569 1.00 0.00 H TER 51205 WAT 381 ATOM 51205 O WAT 382 36.748 121.183 102.041 1.00 0.00 O ATOM 51206 H1 WAT 382 37.104 121.937 101.571 1.00 0.00 H ATOM 51207 H2 WAT 382 37.484 120.576 102.113 1.00 0.00 H TER 51209 WAT 382 ATOM 51209 O WAT 383 37.107 113.641 137.489 1.00 0.00 O ATOM 51210 H1 WAT 383 36.153 113.707 137.541 1.00 0.00 H ATOM 51211 H2 WAT 383 37.395 113.618 138.402 1.00 0.00 H TER 51213 WAT 383 ATOM 51213 O WAT 384 34.430 94.335 87.646 1.00 0.00 O ATOM 51214 H1 WAT 384 33.985 94.756 86.910 1.00 0.00 H ATOM 51215 H2 WAT 384 33.893 93.568 87.845 1.00 0.00 H TER 51217 WAT 384 ATOM 51217 O WAT 385 118.741 15.317 90.468 1.00 0.00 O ATOM 51218 H1 WAT 385 118.162 14.557 90.410 1.00 0.00 H ATOM 51219 H2 WAT 385 119.411 15.058 91.101 1.00 0.00 H TER 51221 WAT 385 ATOM 51221 O WAT 386 21.271 78.506 147.917 1.00 0.00 O ATOM 51222 H1 WAT 386 21.023 78.243 148.804 1.00 0.00 H ATOM 51223 H2 WAT 386 21.024 79.429 147.864 1.00 0.00 H TER 51225 WAT 386 ATOM 51225 O WAT 387 64.199 129.554 62.714 1.00 0.00 O ATOM 51226 H1 WAT 387 63.302 129.622 63.041 1.00 0.00 H ATOM 51227 H2 WAT 387 64.741 129.539 63.502 1.00 0.00 H TER 51229 WAT 387 ATOM 51229 O WAT 388 121.677 38.720 55.025 1.00 0.00 O ATOM 51230 H1 WAT 388 121.615 38.221 54.210 1.00 0.00 H ATOM 51231 H2 WAT 388 121.223 39.542 54.838 1.00 0.00 H TER 51233 WAT 388 ATOM 51233 O WAT 389 133.412 71.375 88.955 1.00 0.00 O ATOM 51234 H1 WAT 389 133.325 70.426 89.042 1.00 0.00 H ATOM 51235 H2 WAT 389 133.413 71.531 88.011 1.00 0.00 H TER 51237 WAT 389 ATOM 51237 O WAT 390 5.050 97.486 106.952 1.00 0.00 O ATOM 51238 H1 WAT 390 4.446 96.878 106.525 1.00 0.00 H ATOM 51239 H2 WAT 390 4.494 98.205 107.253 1.00 0.00 H TER 51241 WAT 390 ATOM 51241 O WAT 391 110.078 105.359 102.132 1.00 0.00 O ATOM 51242 H1 WAT 391 110.381 104.725 102.782 1.00 0.00 H ATOM 51243 H2 WAT 391 109.582 104.837 101.501 1.00 0.00 H TER 51245 WAT 391 ATOM 51245 O WAT 392 8.449 126.692 84.999 1.00 0.00 O ATOM 51246 H1 WAT 392 8.169 125.857 85.374 1.00 0.00 H ATOM 51247 H2 WAT 392 8.795 127.185 85.744 1.00 0.00 H TER 51249 WAT 392 ATOM 51249 O WAT 393 86.170 84.678 122.419 1.00 0.00 O ATOM 51250 H1 WAT 393 85.817 84.910 123.278 1.00 0.00 H ATOM 51251 H2 WAT 393 86.817 85.359 122.234 1.00 0.00 H TER 51253 WAT 393 ATOM 51253 O WAT 394 75.669 41.978 114.267 1.00 0.00 O ATOM 51254 H1 WAT 394 74.885 41.521 114.572 1.00 0.00 H ATOM 51255 H2 WAT 394 76.383 41.591 114.774 1.00 0.00 H TER 51257 WAT 394 ATOM 51257 O WAT 395 104.649 27.091 114.942 1.00 0.00 O ATOM 51258 H1 WAT 395 104.048 27.019 114.200 1.00 0.00 H ATOM 51259 H2 WAT 395 104.084 27.045 115.713 1.00 0.00 H TER 51261 WAT 395 ATOM 51261 O WAT 396 7.993 118.086 119.716 1.00 0.00 O ATOM 51262 H1 WAT 396 7.219 117.558 119.519 1.00 0.00 H ATOM 51263 H2 WAT 396 8.708 117.640 119.262 1.00 0.00 H TER 51265 WAT 396 ATOM 51265 O WAT 397 66.646 106.081 54.262 1.00 0.00 O ATOM 51266 H1 WAT 397 66.049 105.878 54.983 1.00 0.00 H ATOM 51267 H2 WAT 397 66.341 106.925 53.929 1.00 0.00 H TER 51269 WAT 397 ATOM 51269 O WAT 398 94.751 38.952 14.878 1.00 0.00 O ATOM 51270 H1 WAT 398 94.792 39.337 15.753 1.00 0.00 H ATOM 51271 H2 WAT 398 93.822 38.764 14.742 1.00 0.00 H TER 51273 WAT 398 ATOM 51273 O WAT 399 35.269 66.341 133.369 1.00 0.00 O ATOM 51274 H1 WAT 399 35.531 66.883 134.113 1.00 0.00 H ATOM 51275 H2 WAT 399 34.912 66.963 132.734 1.00 0.00 H TER 51277 WAT 399 ATOM 51277 O WAT 400 109.955 126.117 141.325 1.00 0.00 O ATOM 51278 H1 WAT 400 110.432 126.887 141.013 1.00 0.00 H ATOM 51279 H2 WAT 400 110.637 125.527 141.646 1.00 0.00 H TER 51281 WAT 400 ATOM 51281 O WAT 401 59.497 88.702 12.119 1.00 0.00 O ATOM 51282 H1 WAT 401 60.359 88.405 12.408 1.00 0.00 H ATOM 51283 H2 WAT 401 59.593 89.649 12.013 1.00 0.00 H TER 51285 WAT 401 ATOM 51285 O WAT 402 118.825 114.441 151.240 1.00 0.00 O ATOM 51286 H1 WAT 402 117.881 114.471 151.091 1.00 0.00 H ATOM 51287 H2 WAT 402 119.188 114.114 150.417 1.00 0.00 H TER 51289 WAT 402 ATOM 51289 O WAT 403 21.551 123.992 131.693 1.00 0.00 O ATOM 51290 H1 WAT 403 22.015 123.344 131.162 1.00 0.00 H ATOM 51291 H2 WAT 403 21.906 123.877 132.574 1.00 0.00 H TER 51293 WAT 403 ATOM 51293 O WAT 404 96.480 94.076 63.823 1.00 0.00 O ATOM 51294 H1 WAT 404 95.836 94.199 63.126 1.00 0.00 H ATOM 51295 H2 WAT 404 97.080 93.413 63.482 1.00 0.00 H TER 51297 WAT 404 ATOM 51297 O WAT 405 91.799 11.531 74.369 1.00 0.00 O ATOM 51298 H1 WAT 405 91.448 10.664 74.572 1.00 0.00 H ATOM 51299 H2 WAT 405 91.408 12.107 75.026 1.00 0.00 H TER 51301 WAT 405 ATOM 51301 O WAT 406 119.444 136.429 8.899 1.00 0.00 O ATOM 51302 H1 WAT 406 119.095 136.600 9.773 1.00 0.00 H ATOM 51303 H2 WAT 406 118.949 137.014 8.325 1.00 0.00 H TER 51305 WAT 406 ATOM 51305 O WAT 407 98.260 40.043 130.455 1.00 0.00 O ATOM 51306 H1 WAT 407 98.204 40.913 130.058 1.00 0.00 H ATOM 51307 H2 WAT 407 98.066 40.190 131.381 1.00 0.00 H TER 51309 WAT 407 ATOM 51309 O WAT 408 87.592 12.738 84.860 1.00 0.00 O ATOM 51310 H1 WAT 408 87.801 13.387 84.189 1.00 0.00 H ATOM 51311 H2 WAT 408 88.303 12.099 84.804 1.00 0.00 H TER 51313 WAT 408 ATOM 51313 O WAT 409 144.392 58.562 131.508 1.00 0.00 O ATOM 51314 H1 WAT 409 143.875 58.413 130.716 1.00 0.00 H ATOM 51315 H2 WAT 409 143.942 59.279 131.956 1.00 0.00 H TER 51317 WAT 409 ATOM 51317 O WAT 410 70.968 88.550 158.897 1.00 0.00 O ATOM 51318 H1 WAT 410 71.841 88.569 158.504 1.00 0.00 H ATOM 51319 H2 WAT 410 70.592 87.721 158.603 1.00 0.00 H TER 51321 WAT 410 ATOM 51321 O WAT 411 83.324 90.399 83.183 1.00 0.00 O ATOM 51322 H1 WAT 411 82.832 90.568 82.379 1.00 0.00 H ATOM 51323 H2 WAT 411 82.765 90.740 83.881 1.00 0.00 H TER 51325 WAT 411 ATOM 51325 O WAT 412 21.532 118.355 80.530 1.00 0.00 O ATOM 51326 H1 WAT 412 21.664 119.299 80.441 1.00 0.00 H ATOM 51327 H2 WAT 412 21.050 118.106 79.742 1.00 0.00 H TER 51329 WAT 412 ATOM 51329 O WAT 413 114.174 115.796 68.905 1.00 0.00 O ATOM 51330 H1 WAT 413 113.726 116.218 69.639 1.00 0.00 H ATOM 51331 H2 WAT 413 114.392 114.922 69.229 1.00 0.00 H TER 51333 WAT 413 ATOM 51333 O WAT 414 35.242 28.687 57.886 1.00 0.00 O ATOM 51334 H1 WAT 414 35.910 28.531 58.553 1.00 0.00 H ATOM 51335 H2 WAT 414 34.663 29.342 58.276 1.00 0.00 H TER 51337 WAT 414 ATOM 51337 O WAT 415 120.412 116.438 112.347 1.00 0.00 O ATOM 51338 H1 WAT 415 119.477 116.644 112.356 1.00 0.00 H ATOM 51339 H2 WAT 415 120.842 117.276 112.517 1.00 0.00 H TER 51341 WAT 415 ATOM 51341 O WAT 416 77.306 36.833 59.071 1.00 0.00 O ATOM 51342 H1 WAT 416 76.497 36.528 58.660 1.00 0.00 H ATOM 51343 H2 WAT 416 77.017 37.263 59.876 1.00 0.00 H TER 51345 WAT 416 ATOM 51345 O WAT 417 86.577 89.046 6.974 1.00 0.00 O ATOM 51346 H1 WAT 417 86.545 90.003 6.979 1.00 0.00 H ATOM 51347 H2 WAT 417 85.793 88.782 6.494 1.00 0.00 H TER 51349 WAT 417 ATOM 51349 O WAT 418 49.382 49.240 11.608 1.00 0.00 O ATOM 51350 H1 WAT 418 48.893 49.863 11.070 1.00 0.00 H ATOM 51351 H2 WAT 418 50.169 49.717 11.871 1.00 0.00 H TER 51353 WAT 418 ATOM 51353 O WAT 419 104.441 64.215 127.571 1.00 0.00 O ATOM 51354 H1 WAT 419 105.031 63.750 126.977 1.00 0.00 H ATOM 51355 H2 WAT 419 104.901 64.220 128.411 1.00 0.00 H TER 51357 WAT 419 ATOM 51357 O WAT 420 13.348 0.150 133.929 1.00 0.00 O ATOM 51358 H1 WAT 420 12.694 -0.013 134.609 1.00 0.00 H ATOM 51359 H2 WAT 420 14.165 0.284 134.409 1.00 0.00 H TER 51361 WAT 420 ATOM 51361 O WAT 421 7.160 117.335 157.712 1.00 0.00 O ATOM 51362 H1 WAT 421 7.749 117.712 158.366 1.00 0.00 H ATOM 51363 H2 WAT 421 6.713 116.625 158.174 1.00 0.00 H TER 51365 WAT 421 ATOM 51365 O WAT 422 27.348 106.846 103.115 1.00 0.00 O ATOM 51366 H1 WAT 422 27.024 107.651 102.712 1.00 0.00 H ATOM 51367 H2 WAT 422 27.430 106.229 102.387 1.00 0.00 H TER 51369 WAT 422 ATOM 51369 O WAT 423 142.614 110.592 128.438 1.00 0.00 O ATOM 51370 H1 WAT 423 142.859 110.070 129.202 1.00 0.00 H ATOM 51371 H2 WAT 423 142.961 110.102 127.693 1.00 0.00 H TER 51373 WAT 423 ATOM 51373 O WAT 424 59.276 73.352 93.771 1.00 0.00 O ATOM 51374 H1 WAT 424 59.787 72.577 93.538 1.00 0.00 H ATOM 51375 H2 WAT 424 59.408 73.451 94.714 1.00 0.00 H TER 51377 WAT 424 ATOM 51377 O WAT 425 115.008 28.668 138.506 1.00 0.00 O ATOM 51378 H1 WAT 425 115.671 29.335 138.686 1.00 0.00 H ATOM 51379 H2 WAT 425 114.174 29.131 138.590 1.00 0.00 H TER 51381 WAT 425 ATOM 51381 O WAT 426 141.161 82.352 88.132 1.00 0.00 O ATOM 51382 H1 WAT 426 141.254 82.241 89.078 1.00 0.00 H ATOM 51383 H2 WAT 426 140.277 82.702 88.017 1.00 0.00 H TER 51385 WAT 426 ATOM 51385 O WAT 427 117.117 122.762 95.999 1.00 0.00 O ATOM 51386 H1 WAT 427 116.283 123.189 95.800 1.00 0.00 H ATOM 51387 H2 WAT 427 117.100 122.634 96.947 1.00 0.00 H TER 51389 WAT 427 ATOM 51389 O WAT 428 33.257 33.529 140.370 1.00 0.00 O ATOM 51390 H1 WAT 428 32.524 33.523 139.755 1.00 0.00 H ATOM 51391 H2 WAT 428 34.018 33.295 139.838 1.00 0.00 H TER 51393 WAT 428 ATOM 51393 O WAT 429 2.050 20.123 130.268 1.00 0.00 O ATOM 51394 H1 WAT 429 1.452 20.864 130.372 1.00 0.00 H ATOM 51395 H2 WAT 429 2.118 19.745 131.145 1.00 0.00 H TER 51397 WAT 429 ATOM 51397 O WAT 430 93.616 48.861 12.498 1.00 0.00 O ATOM 51398 H1 WAT 430 94.046 49.386 13.173 1.00 0.00 H ATOM 51399 H2 WAT 430 92.816 49.345 12.291 1.00 0.00 H TER 51401 WAT 430 ATOM 51401 O WAT 431 12.952 144.918 113.499 1.00 0.00 O ATOM 51402 H1 WAT 431 13.545 145.544 113.915 1.00 0.00 H ATOM 51403 H2 WAT 431 13.430 144.089 113.516 1.00 0.00 H TER 51405 WAT 431 ATOM 51405 O WAT 432 18.937 116.756 150.406 1.00 0.00 O ATOM 51406 H1 WAT 432 18.630 116.652 149.505 1.00 0.00 H ATOM 51407 H2 WAT 432 19.841 117.058 150.317 1.00 0.00 H TER 51409 WAT 432 ATOM 51409 O WAT 433 63.176 44.959 122.071 1.00 0.00 O ATOM 51410 H1 WAT 433 63.876 45.518 122.408 1.00 0.00 H ATOM 51411 H2 WAT 433 62.744 45.492 121.404 1.00 0.00 H TER 51413 WAT 433 ATOM 51413 O WAT 434 116.367 12.866 101.870 1.00 0.00 O ATOM 51414 H1 WAT 434 115.542 12.427 102.077 1.00 0.00 H ATOM 51415 H2 WAT 434 116.104 13.729 101.550 1.00 0.00 H TER 51417 WAT 434 ATOM 51417 O WAT 435 8.021 62.532 0.741 1.00 0.00 O ATOM 51418 H1 WAT 435 7.512 63.338 0.830 1.00 0.00 H ATOM 51419 H2 WAT 435 7.694 61.964 1.439 1.00 0.00 H TER 51421 WAT 435 ATOM 51421 O WAT 436 126.363 79.545 104.457 1.00 0.00 O ATOM 51422 H1 WAT 436 125.482 79.741 104.138 1.00 0.00 H ATOM 51423 H2 WAT 436 126.220 79.007 105.236 1.00 0.00 H TER 51425 WAT 436 ATOM 51425 O WAT 437 109.908 57.468 83.795 1.00 0.00 O ATOM 51426 H1 WAT 437 109.995 57.907 82.948 1.00 0.00 H ATOM 51427 H2 WAT 437 110.343 56.624 83.673 1.00 0.00 H TER 51429 WAT 437 ATOM 51429 O WAT 438 134.035 21.539 94.374 1.00 0.00 O ATOM 51430 H1 WAT 438 134.949 21.780 94.219 1.00 0.00 H ATOM 51431 H2 WAT 438 134.050 21.072 95.209 1.00 0.00 H TER 51433 WAT 438 ATOM 51433 O WAT 439 90.495 103.793 107.335 1.00 0.00 O ATOM 51434 H1 WAT 439 89.636 104.064 107.660 1.00 0.00 H ATOM 51435 H2 WAT 439 90.811 104.547 106.837 1.00 0.00 H TER 51437 WAT 439 ATOM 51437 O WAT 440 72.345 51.257 15.808 1.00 0.00 O ATOM 51438 H1 WAT 440 71.902 51.942 16.308 1.00 0.00 H ATOM 51439 H2 WAT 440 73.117 51.040 16.331 1.00 0.00 H TER 51441 WAT 440 ATOM 51441 O WAT 441 19.088 80.115 93.278 1.00 0.00 O ATOM 51442 H1 WAT 441 19.727 80.825 93.217 1.00 0.00 H ATOM 51443 H2 WAT 441 18.770 80.001 92.382 1.00 0.00 H TER 51445 WAT 441 ATOM 51445 O WAT 442 11.434 27.065 98.795 1.00 0.00 O ATOM 51446 H1 WAT 442 11.752 27.182 97.900 1.00 0.00 H ATOM 51447 H2 WAT 442 12.134 27.414 99.347 1.00 0.00 H TER 51449 WAT 442 ATOM 51449 O WAT 443 19.076 6.781 126.665 1.00 0.00 O ATOM 51450 H1 WAT 443 19.120 6.880 125.714 1.00 0.00 H ATOM 51451 H2 WAT 443 19.355 7.630 127.007 1.00 0.00 H TER 51453 WAT 443 ATOM 51453 O WAT 444 143.540 131.439 82.730 1.00 0.00 O ATOM 51454 H1 WAT 444 143.026 131.340 81.929 1.00 0.00 H ATOM 51455 H2 WAT 444 143.705 132.380 82.795 1.00 0.00 H TER 51457 WAT 444 ATOM 51457 O WAT 445 53.835 19.121 3.431 1.00 0.00 O ATOM 51458 H1 WAT 445 54.106 20.037 3.498 1.00 0.00 H ATOM 51459 H2 WAT 445 54.048 18.874 2.531 1.00 0.00 H TER 51461 WAT 445 ATOM 51461 O WAT 446 48.836 85.057 10.171 1.00 0.00 O ATOM 51462 H1 WAT 446 49.258 85.871 10.448 1.00 0.00 H ATOM 51463 H2 WAT 446 48.136 85.340 9.582 1.00 0.00 H TER 51465 WAT 446 ATOM 51465 O WAT 447 72.338 126.376 153.031 1.00 0.00 O ATOM 51466 H1 WAT 447 71.746 126.538 152.296 1.00 0.00 H ATOM 51467 H2 WAT 447 73.127 126.015 152.628 1.00 0.00 H TER 51469 WAT 447 ATOM 51469 O WAT 448 3.969 111.560 111.761 1.00 0.00 O ATOM 51470 H1 WAT 448 4.083 112.172 111.034 1.00 0.00 H ATOM 51471 H2 WAT 448 3.044 111.318 111.728 1.00 0.00 H TER 51473 WAT 448 ATOM 51473 O WAT 449 36.998 120.542 77.193 1.00 0.00 O ATOM 51474 H1 WAT 449 37.159 120.139 76.340 1.00 0.00 H ATOM 51475 H2 WAT 449 36.706 121.430 76.988 1.00 0.00 H TER 51477 WAT 449 ATOM 51477 O WAT 450 100.482 4.782 144.913 1.00 0.00 O ATOM 51478 H1 WAT 450 100.976 4.853 145.730 1.00 0.00 H ATOM 51479 H2 WAT 450 100.891 4.051 144.449 1.00 0.00 H TER 51481 WAT 450 ATOM 51481 O WAT 451 34.377 71.676 138.229 1.00 0.00 O ATOM 51482 H1 WAT 451 34.754 71.143 138.929 1.00 0.00 H ATOM 51483 H2 WAT 451 33.842 72.326 138.684 1.00 0.00 H TER 51485 WAT 451 ATOM 51485 O WAT 452 119.335 20.864 91.611 1.00 0.00 O ATOM 51486 H1 WAT 452 119.079 21.538 90.981 1.00 0.00 H ATOM 51487 H2 WAT 452 119.936 20.299 91.126 1.00 0.00 H TER 51489 WAT 452 ATOM 51489 O WAT 453 26.987 78.818 9.039 1.00 0.00 O ATOM 51490 H1 WAT 453 26.380 78.108 8.830 1.00 0.00 H ATOM 51491 H2 WAT 453 27.241 78.656 9.948 1.00 0.00 H TER 51493 WAT 453 ATOM 51493 O WAT 454 9.053 53.548 11.028 1.00 0.00 O ATOM 51494 H1 WAT 454 9.096 54.481 11.239 1.00 0.00 H ATOM 51495 H2 WAT 454 9.658 53.440 10.294 1.00 0.00 H TER 51497 WAT 454 ATOM 51497 O WAT 455 88.074 101.825 71.644 1.00 0.00 O ATOM 51498 H1 WAT 455 87.287 101.318 71.444 1.00 0.00 H ATOM 51499 H2 WAT 455 88.799 101.237 71.432 1.00 0.00 H TER 51501 WAT 455 ATOM 51501 O WAT 456 104.701 10.219 117.602 1.00 0.00 O ATOM 51502 H1 WAT 456 104.790 10.669 116.762 1.00 0.00 H ATOM 51503 H2 WAT 456 104.590 10.924 118.240 1.00 0.00 H TER 51505 WAT 456 ATOM 51505 O WAT 457 86.939 93.905 70.458 1.00 0.00 O ATOM 51506 H1 WAT 457 86.283 94.471 70.865 1.00 0.00 H ATOM 51507 H2 WAT 457 87.045 94.259 69.575 1.00 0.00 H TER 51509 WAT 457 ATOM 51509 O WAT 458 5.983 50.444 144.860 1.00 0.00 O ATOM 51510 H1 WAT 458 5.194 50.962 145.017 1.00 0.00 H ATOM 51511 H2 WAT 458 6.548 50.634 145.610 1.00 0.00 H TER 51513 WAT 458 ATOM 51513 O WAT 459 73.150 125.224 139.766 1.00 0.00 O ATOM 51514 H1 WAT 459 74.016 124.970 140.085 1.00 0.00 H ATOM 51515 H2 WAT 459 72.542 124.686 140.272 1.00 0.00 H TER 51517 WAT 459 ATOM 51517 O WAT 460 9.929 123.862 140.568 1.00 0.00 O ATOM 51518 H1 WAT 460 10.238 123.361 139.813 1.00 0.00 H ATOM 51519 H2 WAT 460 10.678 123.884 141.164 1.00 0.00 H TER 51521 WAT 460 ATOM 51521 O WAT 461 8.699 82.724 25.625 1.00 0.00 O ATOM 51522 H1 WAT 461 9.588 82.986 25.385 1.00 0.00 H ATOM 51523 H2 WAT 461 8.813 81.908 26.112 1.00 0.00 H TER 51525 WAT 461 ATOM 51525 O WAT 462 135.859 143.192 155.359 1.00 0.00 O ATOM 51526 H1 WAT 462 136.231 143.884 154.812 1.00 0.00 H ATOM 51527 H2 WAT 462 135.937 142.399 154.828 1.00 0.00 H TER 51529 WAT 462 ATOM 51529 O WAT 463 72.746 145.291 7.334 1.00 0.00 O ATOM 51530 H1 WAT 463 73.142 145.224 8.203 1.00 0.00 H ATOM 51531 H2 WAT 463 71.856 144.959 7.450 1.00 0.00 H TER 51533 WAT 463 ATOM 51533 O WAT 464 18.281 133.817 6.628 1.00 0.00 O ATOM 51534 H1 WAT 464 17.614 133.131 6.596 1.00 0.00 H ATOM 51535 H2 WAT 464 18.924 133.496 7.260 1.00 0.00 H TER 51537 WAT 464 ATOM 51537 O WAT 465 57.572 3.567 101.854 1.00 0.00 O ATOM 51538 H1 WAT 465 57.505 4.380 101.352 1.00 0.00 H ATOM 51539 H2 WAT 465 58.448 3.236 101.657 1.00 0.00 H TER 51541 WAT 465 ATOM 51541 O WAT 466 81.094 80.626 107.352 1.00 0.00 O ATOM 51542 H1 WAT 466 82.047 80.547 107.392 1.00 0.00 H ATOM 51543 H2 WAT 466 80.942 81.474 106.934 1.00 0.00 H TER 51545 WAT 466 ATOM 51545 O WAT 467 101.381 137.488 107.939 1.00 0.00 O ATOM 51546 H1 WAT 467 101.225 138.412 107.741 1.00 0.00 H ATOM 51547 H2 WAT 467 102.317 137.364 107.777 1.00 0.00 H TER 51549 WAT 467 ATOM 51549 O WAT 468 49.165 106.476 114.584 1.00 0.00 O ATOM 51550 H1 WAT 468 49.918 106.133 114.102 1.00 0.00 H ATOM 51551 H2 WAT 468 48.658 105.699 114.819 1.00 0.00 H TER 51553 WAT 468 ATOM 51553 O WAT 469 105.951 98.311 86.521 1.00 0.00 O ATOM 51554 H1 WAT 469 105.439 97.555 86.232 1.00 0.00 H ATOM 51555 H2 WAT 469 106.291 98.694 85.713 1.00 0.00 H TER 51557 WAT 469 ATOM 51557 O WAT 470 136.234 18.817 13.188 1.00 0.00 O ATOM 51558 H1 WAT 470 136.446 18.584 12.284 1.00 0.00 H ATOM 51559 H2 WAT 470 136.694 19.642 13.337 1.00 0.00 H TER 51561 WAT 470 ATOM 51561 O WAT 471 11.600 114.062 23.048 1.00 0.00 O ATOM 51562 H1 WAT 471 10.817 114.431 22.638 1.00 0.00 H ATOM 51563 H2 WAT 471 12.239 114.006 22.338 1.00 0.00 H TER 51565 WAT 471 ATOM 51565 O WAT 472 1.722 9.303 129.500 1.00 0.00 O ATOM 51566 H1 WAT 472 1.724 9.388 128.547 1.00 0.00 H ATOM 51567 H2 WAT 472 0.974 9.828 129.785 1.00 0.00 H TER 51569 WAT 472 ATOM 51569 O WAT 473 85.335 104.558 67.168 1.00 0.00 O ATOM 51570 H1 WAT 473 85.174 105.478 66.958 1.00 0.00 H ATOM 51571 H2 WAT 473 86.257 104.421 66.950 1.00 0.00 H TER 51573 WAT 473 ATOM 51573 O WAT 474 145.933 15.253 122.651 1.00 0.00 O ATOM 51574 H1 WAT 474 146.466 15.528 121.905 1.00 0.00 H ATOM 51575 H2 WAT 474 145.125 15.760 122.567 1.00 0.00 H TER 51577 WAT 474 ATOM 51577 O WAT 475 81.268 48.363 152.277 1.00 0.00 O ATOM 51578 H1 WAT 475 80.877 49.165 151.931 1.00 0.00 H ATOM 51579 H2 WAT 475 81.820 48.039 151.565 1.00 0.00 H TER 51581 WAT 475 ATOM 51581 O WAT 476 143.863 22.878 10.378 1.00 0.00 O ATOM 51582 H1 WAT 476 143.748 23.451 9.620 1.00 0.00 H ATOM 51583 H2 WAT 476 144.200 23.454 11.065 1.00 0.00 H TER 51585 WAT 476 ATOM 51585 O WAT 477 79.041 75.131 5.835 1.00 0.00 O ATOM 51586 H1 WAT 477 78.230 75.123 6.343 1.00 0.00 H ATOM 51587 H2 WAT 477 78.770 74.897 4.947 1.00 0.00 H TER 51589 WAT 477 ATOM 51589 O WAT 478 114.578 94.860 105.182 1.00 0.00 O ATOM 51590 H1 WAT 478 115.105 95.621 105.426 1.00 0.00 H ATOM 51591 H2 WAT 478 115.091 94.108 105.478 1.00 0.00 H TER 51593 WAT 478 ATOM 51593 O WAT 479 117.828 28.276 110.689 1.00 0.00 O ATOM 51594 H1 WAT 479 118.459 27.639 110.355 1.00 0.00 H ATOM 51595 H2 WAT 479 118.077 29.101 110.272 1.00 0.00 H TER 51597 WAT 479 ATOM 51597 O WAT 480 66.475 112.366 22.812 1.00 0.00 O ATOM 51598 H1 WAT 480 66.214 111.877 22.032 1.00 0.00 H ATOM 51599 H2 WAT 480 66.436 113.284 22.544 1.00 0.00 H TER 51601 WAT 480 ATOM 51601 O WAT 481 37.199 64.942 141.345 1.00 0.00 O ATOM 51602 H1 WAT 481 36.370 64.593 141.018 1.00 0.00 H ATOM 51603 H2 WAT 481 36.943 65.640 141.948 1.00 0.00 H TER 51605 WAT 481 ATOM 51605 O WAT 482 28.099 57.983 63.455 1.00 0.00 O ATOM 51606 H1 WAT 482 28.958 57.711 63.133 1.00 0.00 H ATOM 51607 H2 WAT 482 27.714 58.471 62.727 1.00 0.00 H TER 51609 WAT 482 ATOM 51609 O WAT 483 22.787 53.511 139.561 1.00 0.00 O ATOM 51610 H1 WAT 483 23.075 52.626 139.336 1.00 0.00 H ATOM 51611 H2 WAT 483 21.919 53.390 139.946 1.00 0.00 H TER 51613 WAT 483 ATOM 51613 O WAT 484 25.905 138.609 101.851 1.00 0.00 O ATOM 51614 H1 WAT 484 25.385 138.841 102.620 1.00 0.00 H ATOM 51615 H2 WAT 484 26.813 138.670 102.149 1.00 0.00 H TER 51617 WAT 484 ATOM 51617 O WAT 485 103.764 105.128 68.806 1.00 0.00 O ATOM 51618 H1 WAT 485 103.578 105.618 69.607 1.00 0.00 H ATOM 51619 H2 WAT 485 104.482 104.542 69.045 1.00 0.00 H TER 51621 WAT 485 ATOM 51621 O WAT 486 36.009 77.344 89.365 1.00 0.00 O ATOM 51622 H1 WAT 486 35.667 76.744 88.702 1.00 0.00 H ATOM 51623 H2 WAT 486 35.541 77.108 90.166 1.00 0.00 H TER 51625 WAT 486 ATOM 51625 O WAT 487 17.335 16.956 132.698 1.00 0.00 O ATOM 51626 H1 WAT 487 16.828 17.713 132.403 1.00 0.00 H ATOM 51627 H2 WAT 487 18.244 17.190 132.511 1.00 0.00 H TER 51629 WAT 487 ATOM 51629 O WAT 488 14.050 139.181 11.961 1.00 0.00 O ATOM 51630 H1 WAT 488 13.381 139.626 12.481 1.00 0.00 H ATOM 51631 H2 WAT 488 14.865 139.629 12.186 1.00 0.00 H TER 51633 WAT 488 ATOM 51633 O WAT 489 68.627 91.763 134.820 1.00 0.00 O ATOM 51634 H1 WAT 489 69.353 91.283 135.218 1.00 0.00 H ATOM 51635 H2 WAT 489 68.207 92.213 135.552 1.00 0.00 H TER 51637 WAT 489 ATOM 51637 O WAT 490 139.199 133.005 66.108 1.00 0.00 O ATOM 51638 H1 WAT 490 139.356 132.461 65.336 1.00 0.00 H ATOM 51639 H2 WAT 490 140.021 133.478 66.239 1.00 0.00 H TER 51641 WAT 490 ATOM 51641 O WAT 491 8.213 69.519 141.417 1.00 0.00 O ATOM 51642 H1 WAT 491 9.160 69.589 141.295 1.00 0.00 H ATOM 51643 H2 WAT 491 7.923 68.941 140.710 1.00 0.00 H TER 51645 WAT 491 ATOM 51645 O WAT 492 52.934 125.814 3.400 1.00 0.00 O ATOM 51646 H1 WAT 492 53.823 125.796 3.756 1.00 0.00 H ATOM 51647 H2 WAT 492 52.864 125.009 2.888 1.00 0.00 H TER 51649 WAT 492 ATOM 51649 O WAT 493 3.324 13.819 122.716 1.00 0.00 O ATOM 51650 H1 WAT 493 2.888 14.245 121.978 1.00 0.00 H ATOM 51651 H2 WAT 493 4.178 14.250 122.770 1.00 0.00 H TER 51653 WAT 493 ATOM 51653 O WAT 494 117.157 17.382 80.323 1.00 0.00 O ATOM 51654 H1 WAT 494 117.177 18.269 79.964 1.00 0.00 H ATOM 51655 H2 WAT 494 118.059 17.071 80.244 1.00 0.00 H TER 51657 WAT 494 ATOM 51657 O WAT 495 134.517 110.191 73.560 1.00 0.00 O ATOM 51658 H1 WAT 495 134.503 111.057 73.151 1.00 0.00 H ATOM 51659 H2 WAT 495 133.903 110.261 74.290 1.00 0.00 H TER 51661 WAT 495 ATOM 51661 O WAT 496 134.138 89.011 154.782 1.00 0.00 O ATOM 51662 H1 WAT 496 133.962 88.547 155.601 1.00 0.00 H ATOM 51663 H2 WAT 496 133.473 89.698 154.748 1.00 0.00 H TER 51665 WAT 496 ATOM 51665 O WAT 497 74.320 61.891 108.212 1.00 0.00 O ATOM 51666 H1 WAT 497 74.067 62.693 107.755 1.00 0.00 H ATOM 51667 H2 WAT 497 75.031 62.161 108.793 1.00 0.00 H TER 51669 WAT 497 ATOM 51669 O WAT 498 49.528 45.346 147.893 1.00 0.00 O ATOM 51670 H1 WAT 498 50.104 45.188 147.145 1.00 0.00 H ATOM 51671 H2 WAT 498 48.688 44.969 147.632 1.00 0.00 H TER 51673 WAT 498 ATOM 51673 O WAT 499 73.077 106.675 13.402 1.00 0.00 O ATOM 51674 H1 WAT 499 73.439 106.072 14.052 1.00 0.00 H ATOM 51675 H2 WAT 499 73.675 106.613 12.658 1.00 0.00 H TER 51677 WAT 499 ATOM 51677 O WAT 500 137.276 63.632 145.632 1.00 0.00 O ATOM 51678 H1 WAT 500 137.902 63.071 145.174 1.00 0.00 H ATOM 51679 H2 WAT 500 137.114 63.183 146.462 1.00 0.00 H TER 51681 WAT 500 ATOM 51681 O WAT 501 55.567 121.227 124.916 1.00 0.00 O ATOM 51682 H1 WAT 501 55.227 120.746 125.671 1.00 0.00 H ATOM 51683 H2 WAT 501 56.507 121.051 124.924 1.00 0.00 H TER 51685 WAT 501 ATOM 51685 O WAT 502 82.949 61.567 98.351 1.00 0.00 O ATOM 51686 H1 WAT 502 83.754 61.777 98.824 1.00 0.00 H ATOM 51687 H2 WAT 502 82.783 62.336 97.806 1.00 0.00 H TER 51689 WAT 502 ATOM 51689 O WAT 503 2.246 6.478 22.893 1.00 0.00 O ATOM 51690 H1 WAT 503 2.106 7.408 23.070 1.00 0.00 H ATOM 51691 H2 WAT 503 1.622 6.271 22.197 1.00 0.00 H TER 51693 WAT 503 ATOM 51693 O WAT 504 35.606 41.315 14.646 1.00 0.00 O ATOM 51694 H1 WAT 504 36.510 41.003 14.665 1.00 0.00 H ATOM 51695 H2 WAT 504 35.183 40.869 15.379 1.00 0.00 H TER 51697 WAT 504 ATOM 51697 O WAT 505 62.897 26.700 78.341 1.00 0.00 O ATOM 51698 H1 WAT 505 63.391 27.154 79.023 1.00 0.00 H ATOM 51699 H2 WAT 505 62.048 26.515 78.742 1.00 0.00 H TER 51701 WAT 505 ATOM 51701 O WAT 506 2.563 120.958 4.837 1.00 0.00 O ATOM 51702 H1 WAT 506 1.735 120.949 4.355 1.00 0.00 H ATOM 51703 H2 WAT 506 2.421 120.355 5.567 1.00 0.00 H TER 51705 WAT 506 ATOM 51705 O WAT 507 63.804 27.496 105.663 1.00 0.00 O ATOM 51706 H1 WAT 507 63.433 27.695 104.803 1.00 0.00 H ATOM 51707 H2 WAT 507 64.735 27.700 105.575 1.00 0.00 H TER 51709 WAT 507 ATOM 51709 O WAT 508 58.725 13.651 90.810 1.00 0.00 O ATOM 51710 H1 WAT 508 59.111 14.238 91.460 1.00 0.00 H ATOM 51711 H2 WAT 508 59.477 13.257 90.367 1.00 0.00 H TER 51713 WAT 508 ATOM 51713 O WAT 509 81.575 75.670 84.077 1.00 0.00 O ATOM 51714 H1 WAT 509 81.430 75.683 83.131 1.00 0.00 H ATOM 51715 H2 WAT 509 80.872 76.212 84.435 1.00 0.00 H TER 51717 WAT 509 ATOM 51717 O WAT 510 67.900 104.487 21.790 1.00 0.00 O ATOM 51718 H1 WAT 510 67.047 104.555 22.219 1.00 0.00 H ATOM 51719 H2 WAT 510 67.932 105.241 21.201 1.00 0.00 H TER 51721 WAT 510 ATOM 51721 O WAT 511 53.970 88.570 135.049 1.00 0.00 O ATOM 51722 H1 WAT 511 54.162 88.296 135.946 1.00 0.00 H ATOM 51723 H2 WAT 511 53.783 89.506 135.120 1.00 0.00 H TER 51725 WAT 511 ATOM 51725 O WAT 512 11.622 113.384 114.605 1.00 0.00 O ATOM 51726 H1 WAT 512 10.967 113.654 113.960 1.00 0.00 H ATOM 51727 H2 WAT 512 12.022 114.203 114.896 1.00 0.00 H TER 51729 WAT 512 ATOM 51729 O WAT 513 53.515 120.866 112.090 1.00 0.00 O ATOM 51730 H1 WAT 513 53.806 120.705 112.988 1.00 0.00 H ATOM 51731 H2 WAT 513 54.281 121.238 111.654 1.00 0.00 H TER 51733 WAT 513 ATOM 51733 O WAT 514 118.424 76.331 5.273 1.00 0.00 O ATOM 51734 H1 WAT 514 118.494 75.886 4.428 1.00 0.00 H ATOM 51735 H2 WAT 514 118.271 77.249 5.048 1.00 0.00 H TER 51737 WAT 514 ATOM 51737 O WAT 515 110.393 123.296 100.124 1.00 0.00 O ATOM 51738 H1 WAT 515 110.163 123.877 100.849 1.00 0.00 H ATOM 51739 H2 WAT 515 109.599 123.254 99.590 1.00 0.00 H TER 51741 WAT 515 ATOM 51741 O WAT 516 88.001 41.243 157.841 1.00 0.00 O ATOM 51742 H1 WAT 516 88.107 41.239 156.889 1.00 0.00 H ATOM 51743 H2 WAT 516 88.820 40.877 158.174 1.00 0.00 H TER 51745 WAT 516 ATOM 51745 O WAT 517 102.120 41.092 106.225 1.00 0.00 O ATOM 51746 H1 WAT 517 101.544 41.776 106.566 1.00 0.00 H ATOM 51747 H2 WAT 517 102.976 41.514 106.152 1.00 0.00 H TER 51749 WAT 517 ATOM 51749 O WAT 518 87.345 19.858 116.398 1.00 0.00 O ATOM 51750 H1 WAT 518 87.605 20.400 117.143 1.00 0.00 H ATOM 51751 H2 WAT 518 87.441 20.433 115.639 1.00 0.00 H TER 51753 WAT 518 ATOM 51753 O WAT 519 83.634 142.611 10.730 1.00 0.00 O ATOM 51754 H1 WAT 519 83.150 141.807 10.543 1.00 0.00 H ATOM 51755 H2 WAT 519 82.982 143.202 11.106 1.00 0.00 H TER 51757 WAT 519 ATOM 51757 O WAT 520 64.214 136.303 60.146 1.00 0.00 O ATOM 51758 H1 WAT 520 63.436 136.858 60.097 1.00 0.00 H ATOM 51759 H2 WAT 520 64.210 135.963 61.041 1.00 0.00 H TER 51761 WAT 520 ATOM 51761 O WAT 521 78.476 82.820 92.304 1.00 0.00 O ATOM 51762 H1 WAT 521 79.137 83.054 91.653 1.00 0.00 H ATOM 51763 H2 WAT 521 78.816 82.026 92.716 1.00 0.00 H TER 51765 WAT 521 ATOM 51765 O WAT 522 67.850 52.128 112.800 1.00 0.00 O ATOM 51766 H1 WAT 522 67.553 51.226 112.919 1.00 0.00 H ATOM 51767 H2 WAT 522 67.604 52.345 111.901 1.00 0.00 H TER 51769 WAT 522 ATOM 51769 O WAT 523 75.628 139.032 62.776 1.00 0.00 O ATOM 51770 H1 WAT 523 75.426 138.888 61.852 1.00 0.00 H ATOM 51771 H2 WAT 523 75.486 138.179 63.188 1.00 0.00 H TER 51773 WAT 523 ATOM 51773 O WAT 524 22.163 21.988 81.178 1.00 0.00 O ATOM 51774 H1 WAT 524 21.509 22.470 81.684 1.00 0.00 H ATOM 51775 H2 WAT 524 21.652 21.478 80.550 1.00 0.00 H TER 51777 WAT 524 ATOM 51777 O WAT 525 87.252 18.231 105.600 1.00 0.00 O ATOM 51778 H1 WAT 525 86.623 18.246 104.878 1.00 0.00 H ATOM 51779 H2 WAT 525 88.027 17.805 105.235 1.00 0.00 H TER 51781 WAT 525 ATOM 51781 O WAT 526 90.107 75.756 72.712 1.00 0.00 O ATOM 51782 H1 WAT 526 90.103 75.083 72.031 1.00 0.00 H ATOM 51783 H2 WAT 526 89.272 76.211 72.604 1.00 0.00 H TER 51785 WAT 526 ATOM 51785 O WAT 527 24.220 104.817 90.332 1.00 0.00 O ATOM 51786 H1 WAT 527 25.140 104.977 90.544 1.00 0.00 H ATOM 51787 H2 WAT 527 24.032 103.959 90.712 1.00 0.00 H TER 51789 WAT 527 ATOM 51789 O WAT 528 51.198 30.023 86.901 1.00 0.00 O ATOM 51790 H1 WAT 528 51.415 30.883 87.261 1.00 0.00 H ATOM 51791 H2 WAT 528 51.245 30.141 85.952 1.00 0.00 H TER 51793 WAT 528 ATOM 51793 O WAT 529 35.904 102.013 62.698 1.00 0.00 O ATOM 51794 H1 WAT 529 35.011 102.321 62.855 1.00 0.00 H ATOM 51795 H2 WAT 529 36.450 102.788 62.830 1.00 0.00 H TER 51797 WAT 529 ATOM 51797 O WAT 530 46.163 129.080 73.877 1.00 0.00 O ATOM 51798 H1 WAT 530 47.061 129.249 73.593 1.00 0.00 H ATOM 51799 H2 WAT 530 45.903 128.294 73.396 1.00 0.00 H TER 51801 WAT 530 ATOM 51801 O WAT 531 20.332 10.653 110.677 1.00 0.00 O ATOM 51802 H1 WAT 531 19.565 11.224 110.627 1.00 0.00 H ATOM 51803 H2 WAT 531 20.698 10.819 111.545 1.00 0.00 H TER 51805 WAT 531 ATOM 51805 O WAT 532 126.632 0.210 82.509 1.00 0.00 O ATOM 51806 H1 WAT 532 126.109 1.010 82.448 1.00 0.00 H ATOM 51807 H2 WAT 532 126.697 0.037 83.448 1.00 0.00 H TER 51809 WAT 532 ATOM 51809 O WAT 533 6.939 83.143 129.911 1.00 0.00 O ATOM 51810 H1 WAT 533 6.766 82.237 129.655 1.00 0.00 H ATOM 51811 H2 WAT 533 7.201 83.576 129.098 1.00 0.00 H TER 51813 WAT 533 ATOM 51813 O WAT 534 27.932 45.994 110.409 1.00 0.00 O ATOM 51814 H1 WAT 534 28.710 46.523 110.233 1.00 0.00 H ATOM 51815 H2 WAT 534 28.114 45.153 109.989 1.00 0.00 H TER 51817 WAT 534 ATOM 51817 O WAT 535 29.994 100.810 70.357 1.00 0.00 O ATOM 51818 H1 WAT 535 29.159 101.112 70.715 1.00 0.00 H ATOM 51819 H2 WAT 535 30.398 100.318 71.072 1.00 0.00 H TER 51821 WAT 535 ATOM 51821 O WAT 536 88.344 68.933 88.381 1.00 0.00 O ATOM 51822 H1 WAT 536 88.102 69.827 88.619 1.00 0.00 H ATOM 51823 H2 WAT 536 87.522 68.444 88.416 1.00 0.00 H TER 51825 WAT 536 ATOM 51825 O WAT 537 96.343 52.598 55.433 1.00 0.00 O ATOM 51826 H1 WAT 537 95.527 52.969 55.097 1.00 0.00 H ATOM 51827 H2 WAT 537 96.208 51.651 55.401 1.00 0.00 H TER 51829 WAT 537 ATOM 51829 O WAT 538 66.462 96.483 119.612 1.00 0.00 O ATOM 51830 H1 WAT 538 65.930 95.688 119.650 1.00 0.00 H ATOM 51831 H2 WAT 538 67.127 96.293 118.951 1.00 0.00 H TER 51833 WAT 538 ATOM 51833 O WAT 539 52.223 138.300 6.955 1.00 0.00 O ATOM 51834 H1 WAT 539 51.622 137.712 7.414 1.00 0.00 H ATOM 51835 H2 WAT 539 52.913 138.483 7.592 1.00 0.00 H TER 51837 WAT 539 ATOM 51837 O WAT 540 137.602 124.378 126.284 1.00 0.00 O ATOM 51838 H1 WAT 540 138.128 125.172 126.377 1.00 0.00 H ATOM 51839 H2 WAT 540 138.244 123.673 126.207 1.00 0.00 H TER 51841 WAT 540 ATOM 51841 O WAT 541 70.882 69.699 1.353 1.00 0.00 O ATOM 51842 H1 WAT 541 70.271 70.389 1.096 1.00 0.00 H ATOM 51843 H2 WAT 541 70.520 68.902 0.965 1.00 0.00 H TER 51845 WAT 541 ATOM 51845 O WAT 542 63.642 130.032 129.280 1.00 0.00 O ATOM 51846 H1 WAT 542 62.939 129.435 129.025 1.00 0.00 H ATOM 51847 H2 WAT 542 63.195 130.758 129.714 1.00 0.00 H TER 51849 WAT 542 ATOM 51849 O WAT 543 75.481 125.542 121.466 1.00 0.00 O ATOM 51850 H1 WAT 543 75.307 124.687 121.859 1.00 0.00 H ATOM 51851 H2 WAT 543 76.432 125.636 121.508 1.00 0.00 H TER 51853 WAT 543 ATOM 51853 O WAT 544 141.846 26.386 96.953 1.00 0.00 O ATOM 51854 H1 WAT 544 142.011 27.272 96.630 1.00 0.00 H ATOM 51855 H2 WAT 544 141.483 26.515 97.830 1.00 0.00 H TER 51857 WAT 544 ATOM 51857 O WAT 545 107.650 39.279 131.303 1.00 0.00 O ATOM 51858 H1 WAT 545 107.379 39.853 130.587 1.00 0.00 H ATOM 51859 H2 WAT 545 108.093 39.861 131.921 1.00 0.00 H TER 51861 WAT 545 ATOM 51861 O WAT 546 49.712 128.902 127.550 1.00 0.00 O ATOM 51862 H1 WAT 546 50.387 128.522 128.113 1.00 0.00 H ATOM 51863 H2 WAT 546 48.988 128.277 127.588 1.00 0.00 H TER 51865 WAT 546 ATOM 51865 O WAT 547 126.139 125.687 145.390 1.00 0.00 O ATOM 51866 H1 WAT 547 126.885 125.134 145.624 1.00 0.00 H ATOM 51867 H2 WAT 547 126.474 126.264 144.705 1.00 0.00 H TER 51869 WAT 547 ATOM 51869 O WAT 548 99.419 65.951 86.629 1.00 0.00 O ATOM 51870 H1 WAT 548 98.973 65.151 86.353 1.00 0.00 H ATOM 51871 H2 WAT 548 98.776 66.646 86.486 1.00 0.00 H TER 51873 WAT 548 ATOM 51873 O WAT 549 131.092 58.115 97.187 1.00 0.00 O ATOM 51874 H1 WAT 549 131.204 57.839 98.097 1.00 0.00 H ATOM 51875 H2 WAT 549 131.106 57.299 96.686 1.00 0.00 H TER 51877 WAT 549 ATOM 51877 O WAT 550 76.877 56.671 114.633 1.00 0.00 O ATOM 51878 H1 WAT 550 76.277 55.937 114.499 1.00 0.00 H ATOM 51879 H2 WAT 550 77.681 56.408 114.183 1.00 0.00 H TER 51881 WAT 550 ATOM 51881 O WAT 551 91.558 41.602 83.654 1.00 0.00 O ATOM 51882 H1 WAT 551 91.165 42.472 83.727 1.00 0.00 H ATOM 51883 H2 WAT 551 90.815 41.011 83.536 1.00 0.00 H TER 51885 WAT 551 ATOM 51885 O WAT 552 21.023 57.703 17.305 1.00 0.00 O ATOM 51886 H1 WAT 552 21.225 56.798 17.066 1.00 0.00 H ATOM 51887 H2 WAT 552 20.141 57.662 17.673 1.00 0.00 H TER 51889 WAT 552 ATOM 51889 O WAT 553 110.964 94.278 90.193 1.00 0.00 O ATOM 51890 H1 WAT 553 110.292 94.188 90.868 1.00 0.00 H ATOM 51891 H2 WAT 553 111.690 93.738 90.504 1.00 0.00 H TER 51893 WAT 553 ATOM 51893 O WAT 554 2.917 129.143 140.045 1.00 0.00 O ATOM 51894 H1 WAT 554 3.649 129.759 140.097 1.00 0.00 H ATOM 51895 H2 WAT 554 3.255 128.337 140.434 1.00 0.00 H TER 51897 WAT 554 ATOM 51897 O WAT 555 21.438 85.789 58.096 1.00 0.00 O ATOM 51898 H1 WAT 555 21.578 84.879 58.356 1.00 0.00 H ATOM 51899 H2 WAT 555 21.633 85.803 57.159 1.00 0.00 H TER 51901 WAT 555 ATOM 51901 O WAT 556 67.437 12.352 99.225 1.00 0.00 O ATOM 51902 H1 WAT 556 66.993 12.111 100.038 1.00 0.00 H ATOM 51903 H2 WAT 556 68.292 12.678 99.507 1.00 0.00 H TER 51905 WAT 556 ATOM 51905 O WAT 557 68.216 45.169 106.025 1.00 0.00 O ATOM 51906 H1 WAT 557 68.533 45.694 106.760 1.00 0.00 H ATOM 51907 H2 WAT 557 68.794 44.406 106.008 1.00 0.00 H TER 51909 WAT 557 ATOM 51909 O WAT 558 88.156 104.719 99.902 1.00 0.00 O ATOM 51910 H1 WAT 558 87.556 104.290 99.292 1.00 0.00 H ATOM 51911 H2 WAT 558 87.600 104.999 100.629 1.00 0.00 H TER 51913 WAT 558 ATOM 51913 O WAT 559 123.896 7.112 107.997 1.00 0.00 O ATOM 51914 H1 WAT 559 123.745 7.117 107.052 1.00 0.00 H ATOM 51915 H2 WAT 559 123.118 7.530 108.367 1.00 0.00 H TER 51917 WAT 559 ATOM 51917 O WAT 560 12.548 109.447 93.597 1.00 0.00 O ATOM 51918 H1 WAT 560 12.143 110.156 93.099 1.00 0.00 H ATOM 51919 H2 WAT 560 12.224 109.566 94.490 1.00 0.00 H TER 51921 WAT 560 ATOM 51921 O WAT 561 31.143 35.658 1.944 1.00 0.00 O ATOM 51922 H1 WAT 561 30.543 35.647 2.690 1.00 0.00 H ATOM 51923 H2 WAT 561 30.780 36.318 1.354 1.00 0.00 H TER 51925 WAT 561 ATOM 51925 O WAT 562 67.504 113.009 103.009 1.00 0.00 O ATOM 51926 H1 WAT 562 67.096 112.314 103.526 1.00 0.00 H ATOM 51927 H2 WAT 562 67.004 113.795 103.230 1.00 0.00 H TER 51929 WAT 562 ATOM 51929 O WAT 563 125.671 51.689 94.060 1.00 0.00 O ATOM 51930 H1 WAT 563 125.030 51.255 93.497 1.00 0.00 H ATOM 51931 H2 WAT 563 126.303 52.073 93.452 1.00 0.00 H TER 51933 WAT 563 ATOM 51933 O WAT 564 68.002 85.667 112.822 1.00 0.00 O ATOM 51934 H1 WAT 564 68.383 86.094 112.055 1.00 0.00 H ATOM 51935 H2 WAT 564 67.371 85.045 112.461 1.00 0.00 H TER 51937 WAT 564 ATOM 51937 O WAT 565 27.703 97.723 101.280 1.00 0.00 O ATOM 51938 H1 WAT 565 28.263 97.270 101.911 1.00 0.00 H ATOM 51939 H2 WAT 565 28.034 97.446 100.425 1.00 0.00 H TER 51941 WAT 565 ATOM 51941 O WAT 566 51.026 13.533 51.802 1.00 0.00 O ATOM 51942 H1 WAT 566 51.760 14.140 51.708 1.00 0.00 H ATOM 51943 H2 WAT 566 50.288 14.086 52.057 1.00 0.00 H TER 51945 WAT 566 ATOM 51945 O WAT 567 144.685 51.090 13.764 1.00 0.00 O ATOM 51946 H1 WAT 567 145.081 50.232 13.612 1.00 0.00 H ATOM 51947 H2 WAT 567 143.798 50.895 14.064 1.00 0.00 H TER 51949 WAT 567 ATOM 51949 O WAT 568 78.755 5.571 88.231 1.00 0.00 O ATOM 51950 H1 WAT 568 79.272 5.536 89.036 1.00 0.00 H ATOM 51951 H2 WAT 568 78.651 6.505 88.052 1.00 0.00 H TER 51953 WAT 568 ATOM 51953 O WAT 569 17.265 56.818 154.386 1.00 0.00 O ATOM 51954 H1 WAT 569 17.330 56.197 155.112 1.00 0.00 H ATOM 51955 H2 WAT 569 17.989 56.584 153.805 1.00 0.00 H TER 51957 WAT 569 ATOM 51957 O WAT 570 142.224 8.979 1.912 1.00 0.00 O ATOM 51958 H1 WAT 570 141.753 9.251 1.125 1.00 0.00 H ATOM 51959 H2 WAT 570 143.147 8.996 1.657 1.00 0.00 H TER 51961 WAT 570 ATOM 51961 O WAT 571 56.226 138.501 123.131 1.00 0.00 O ATOM 51962 H1 WAT 571 55.478 138.302 122.568 1.00 0.00 H ATOM 51963 H2 WAT 571 55.868 138.481 124.019 1.00 0.00 H TER 51965 WAT 571 ATOM 51965 O WAT 572 111.754 55.784 65.088 1.00 0.00 O ATOM 51966 H1 WAT 572 112.370 55.142 64.734 1.00 0.00 H ATOM 51967 H2 WAT 572 110.891 55.400 64.932 1.00 0.00 H TER 51969 WAT 572 ATOM 51969 O WAT 573 96.669 81.644 114.965 1.00 0.00 O ATOM 51970 H1 WAT 573 97.098 81.666 115.820 1.00 0.00 H ATOM 51971 H2 WAT 573 97.382 81.759 114.337 1.00 0.00 H TER 51973 WAT 573 ATOM 51973 O WAT 574 41.345 35.801 129.475 1.00 0.00 O ATOM 51974 H1 WAT 574 40.844 34.997 129.339 1.00 0.00 H ATOM 51975 H2 WAT 574 40.835 36.295 130.117 1.00 0.00 H TER 51977 WAT 574 ATOM 51977 O WAT 575 71.910 112.977 134.299 1.00 0.00 O ATOM 51978 H1 WAT 575 71.041 112.936 134.697 1.00 0.00 H ATOM 51979 H2 WAT 575 72.179 112.062 134.216 1.00 0.00 H TER 51981 WAT 575 ATOM 51981 O WAT 576 99.762 36.055 89.060 1.00 0.00 O ATOM 51982 H1 WAT 576 99.069 35.430 89.275 1.00 0.00 H ATOM 51983 H2 WAT 576 99.930 35.914 88.128 1.00 0.00 H TER 51985 WAT 576 ATOM 51985 O WAT 577 115.896 63.947 117.065 1.00 0.00 O ATOM 51986 H1 WAT 577 115.201 64.530 116.758 1.00 0.00 H ATOM 51987 H2 WAT 577 115.994 64.160 117.993 1.00 0.00 H TER 51989 WAT 577 ATOM 51989 O WAT 578 112.907 102.149 59.182 1.00 0.00 O ATOM 51990 H1 WAT 578 112.519 102.489 59.988 1.00 0.00 H ATOM 51991 H2 WAT 578 112.505 102.668 58.485 1.00 0.00 H TER 51993 WAT 578 ATOM 51993 O WAT 579 76.159 106.653 89.347 1.00 0.00 O ATOM 51994 H1 WAT 579 76.189 107.081 88.491 1.00 0.00 H ATOM 51995 H2 WAT 579 76.958 106.126 89.378 1.00 0.00 H TER 51997 WAT 579 ATOM 51997 O WAT 580 79.298 59.806 154.107 1.00 0.00 O ATOM 51998 H1 WAT 580 78.440 59.541 154.437 1.00 0.00 H ATOM 51999 H2 WAT 580 79.223 59.731 153.156 1.00 0.00 H TER 52001 WAT 580 ATOM 52001 O WAT 581 138.343 89.997 25.954 1.00 0.00 O ATOM 52002 H1 WAT 581 138.365 90.380 26.831 1.00 0.00 H ATOM 52003 H2 WAT 581 137.433 90.090 25.674 1.00 0.00 H TER 52005 WAT 581 ATOM 52005 O WAT 582 48.203 127.914 89.021 1.00 0.00 O ATOM 52006 H1 WAT 582 48.879 127.243 88.925 1.00 0.00 H ATOM 52007 H2 WAT 582 48.663 128.665 89.396 1.00 0.00 H TER 52009 WAT 582 ATOM 52009 O WAT 583 40.558 8.953 155.535 1.00 0.00 O ATOM 52010 H1 WAT 583 40.556 9.863 155.240 1.00 0.00 H ATOM 52011 H2 WAT 583 40.291 8.450 154.765 1.00 0.00 H TER 52013 WAT 583 ATOM 52013 O WAT 584 122.455 9.236 104.141 1.00 0.00 O ATOM 52014 H1 WAT 584 123.356 9.555 104.098 1.00 0.00 H ATOM 52015 H2 WAT 584 122.267 8.928 103.255 1.00 0.00 H TER 52017 WAT 584 ATOM 52017 O WAT 585 24.115 55.521 13.955 1.00 0.00 O ATOM 52018 H1 WAT 585 23.436 55.704 14.605 1.00 0.00 H ATOM 52019 H2 WAT 585 23.687 54.949 13.317 1.00 0.00 H TER 52021 WAT 585 ATOM 52021 O WAT 586 43.636 105.202 75.814 1.00 0.00 O ATOM 52022 H1 WAT 586 44.362 104.648 75.525 1.00 0.00 H ATOM 52023 H2 WAT 586 44.053 105.894 76.327 1.00 0.00 H TER 52025 WAT 586 ATOM 52025 O WAT 587 110.884 135.058 114.066 1.00 0.00 O ATOM 52026 H1 WAT 587 110.120 135.201 113.507 1.00 0.00 H ATOM 52027 H2 WAT 587 110.892 135.810 114.658 1.00 0.00 H TER 52029 WAT 587 ATOM 52029 O WAT 588 86.376 55.492 120.103 1.00 0.00 O ATOM 52030 H1 WAT 588 86.490 55.141 120.987 1.00 0.00 H ATOM 52031 H2 WAT 588 86.676 56.399 120.165 1.00 0.00 H TER 52033 WAT 588 ATOM 52033 O WAT 589 47.550 96.832 117.440 1.00 0.00 O ATOM 52034 H1 WAT 589 48.109 96.145 117.803 1.00 0.00 H ATOM 52035 H2 WAT 589 47.867 97.639 117.846 1.00 0.00 H TER 52037 WAT 589 ATOM 52037 O WAT 590 94.194 111.657 114.135 1.00 0.00 O ATOM 52038 H1 WAT 590 93.466 111.635 114.757 1.00 0.00 H ATOM 52039 H2 WAT 590 93.775 111.761 113.281 1.00 0.00 H TER 52041 WAT 590 ATOM 52041 O WAT 591 82.528 139.127 95.507 1.00 0.00 O ATOM 52042 H1 WAT 591 82.312 138.725 96.349 1.00 0.00 H ATOM 52043 H2 WAT 591 83.470 138.991 95.411 1.00 0.00 H TER 52045 WAT 591 ATOM 52045 O WAT 592 27.605 50.563 153.401 1.00 0.00 O ATOM 52046 H1 WAT 592 27.390 50.852 152.514 1.00 0.00 H ATOM 52047 H2 WAT 592 26.950 49.894 153.601 1.00 0.00 H TER 52049 WAT 592 ATOM 52049 O WAT 593 37.880 45.404 121.460 1.00 0.00 O ATOM 52050 H1 WAT 593 38.375 45.269 122.268 1.00 0.00 H ATOM 52051 H2 WAT 593 37.030 45.735 121.752 1.00 0.00 H TER 52053 WAT 593 ATOM 52053 O WAT 594 35.860 90.757 130.129 1.00 0.00 O ATOM 52054 H1 WAT 594 35.202 91.433 129.963 1.00 0.00 H ATOM 52055 H2 WAT 594 36.682 91.146 129.831 1.00 0.00 H TER 52057 WAT 594 ATOM 52057 O WAT 595 80.400 48.020 148.617 1.00 0.00 O ATOM 52058 H1 WAT 595 79.612 47.476 148.617 1.00 0.00 H ATOM 52059 H2 WAT 595 80.834 47.812 147.790 1.00 0.00 H TER 52061 WAT 595 ATOM 52061 O WAT 596 43.354 17.460 138.686 1.00 0.00 O ATOM 52062 H1 WAT 596 42.623 17.921 139.097 1.00 0.00 H ATOM 52063 H2 WAT 596 42.943 16.746 138.199 1.00 0.00 H TER 52065 WAT 596 ATOM 52065 O WAT 597 33.221 3.629 91.975 1.00 0.00 O ATOM 52066 H1 WAT 597 33.322 2.768 92.383 1.00 0.00 H ATOM 52067 H2 WAT 597 33.623 4.236 92.596 1.00 0.00 H TER 52069 WAT 597 ATOM 52069 O WAT 598 3.854 113.079 128.206 1.00 0.00 O ATOM 52070 H1 WAT 598 4.564 112.595 127.784 1.00 0.00 H ATOM 52071 H2 WAT 598 3.094 112.929 127.643 1.00 0.00 H TER 52073 WAT 598 ATOM 52073 O WAT 599 103.211 88.876 104.834 1.00 0.00 O ATOM 52074 H1 WAT 599 103.541 89.083 103.959 1.00 0.00 H ATOM 52075 H2 WAT 599 102.604 89.588 105.035 1.00 0.00 H TER 52077 WAT 599 ATOM 52077 O WAT 600 87.229 103.592 22.063 1.00 0.00 O ATOM 52078 H1 WAT 600 88.173 103.749 22.093 1.00 0.00 H ATOM 52079 H2 WAT 600 86.980 103.456 22.977 1.00 0.00 H TER 52081 WAT 600 ATOM 52081 O WAT 601 65.438 9.654 119.708 1.00 0.00 O ATOM 52082 H1 WAT 601 64.517 9.759 119.469 1.00 0.00 H ATOM 52083 H2 WAT 601 65.804 10.537 119.646 1.00 0.00 H TER 52085 WAT 601 ATOM 52085 O WAT 602 119.130 74.282 72.074 1.00 0.00 O ATOM 52086 H1 WAT 602 118.943 73.463 72.532 1.00 0.00 H ATOM 52087 H2 WAT 602 118.462 74.891 72.389 1.00 0.00 H TER 52089 WAT 602 ATOM 52089 O WAT 603 105.304 64.355 83.861 1.00 0.00 O ATOM 52090 H1 WAT 603 106.095 63.849 84.048 1.00 0.00 H ATOM 52091 H2 WAT 603 104.600 63.865 84.286 1.00 0.00 H TER 52093 WAT 603 ATOM 52093 O WAT 604 55.095 64.652 75.090 1.00 0.00 O ATOM 52094 H1 WAT 604 55.030 65.320 75.772 1.00 0.00 H ATOM 52095 H2 WAT 604 54.600 63.909 75.434 1.00 0.00 H TER 52097 WAT 604 ATOM 52097 O WAT 605 105.251 45.658 15.520 1.00 0.00 O ATOM 52098 H1 WAT 605 104.973 44.885 15.029 1.00 0.00 H ATOM 52099 H2 WAT 605 105.618 46.244 14.858 1.00 0.00 H TER 52101 WAT 605 ATOM 52101 O WAT 606 38.472 57.153 58.973 1.00 0.00 O ATOM 52102 H1 WAT 606 38.878 57.721 58.318 1.00 0.00 H ATOM 52103 H2 WAT 606 38.088 56.438 58.464 1.00 0.00 H TER 52105 WAT 606 ATOM 52105 O WAT 607 59.652 140.742 107.861 1.00 0.00 O ATOM 52106 H1 WAT 607 59.874 140.927 108.774 1.00 0.00 H ATOM 52107 H2 WAT 607 60.116 141.413 107.361 1.00 0.00 H TER 52109 WAT 607 ATOM 52109 O WAT 608 44.504 123.734 116.196 1.00 0.00 O ATOM 52110 H1 WAT 608 45.217 123.099 116.133 1.00 0.00 H ATOM 52111 H2 WAT 608 43.726 123.205 116.373 1.00 0.00 H TER 52113 WAT 608 ATOM 52113 O WAT 609 6.659 79.150 115.656 1.00 0.00 O ATOM 52114 H1 WAT 609 6.036 79.012 114.943 1.00 0.00 H ATOM 52115 H2 WAT 609 6.393 78.526 116.331 1.00 0.00 H TER 52117 WAT 609 ATOM 52117 O WAT 610 29.478 86.008 99.071 1.00 0.00 O ATOM 52118 H1 WAT 610 29.266 86.916 98.852 1.00 0.00 H ATOM 52119 H2 WAT 610 28.632 85.606 99.268 1.00 0.00 H TER 52121 WAT 610 ATOM 52121 O WAT 611 90.388 9.725 103.546 1.00 0.00 O ATOM 52122 H1 WAT 611 90.579 8.793 103.445 1.00 0.00 H ATOM 52123 H2 WAT 611 90.378 10.066 102.652 1.00 0.00 H TER 52125 WAT 611 ATOM 52125 O WAT 612 90.688 18.851 97.634 1.00 0.00 O ATOM 52126 H1 WAT 612 90.490 19.756 97.395 1.00 0.00 H ATOM 52127 H2 WAT 612 91.638 18.781 97.541 1.00 0.00 H TER 52129 WAT 612 ATOM 52129 O WAT 613 130.897 88.548 68.017 1.00 0.00 O ATOM 52130 H1 WAT 613 130.632 88.004 67.275 1.00 0.00 H ATOM 52131 H2 WAT 613 131.843 88.417 68.085 1.00 0.00 H TER 52133 WAT 613 ATOM 52133 O WAT 614 80.369 96.985 112.824 1.00 0.00 O ATOM 52134 H1 WAT 614 80.626 97.862 113.111 1.00 0.00 H ATOM 52135 H2 WAT 614 80.268 96.488 113.636 1.00 0.00 H TER 52137 WAT 614 ATOM 52137 O WAT 615 108.301 56.741 114.536 1.00 0.00 O ATOM 52138 H1 WAT 615 109.161 56.930 114.161 1.00 0.00 H ATOM 52139 H2 WAT 615 108.282 55.788 114.625 1.00 0.00 H TER 52141 WAT 615 ATOM 52141 O WAT 616 73.595 74.585 24.737 1.00 0.00 O ATOM 52142 H1 WAT 616 73.760 74.574 25.679 1.00 0.00 H ATOM 52143 H2 WAT 616 73.175 73.743 24.557 1.00 0.00 H TER 52145 WAT 616 ATOM 52145 O WAT 617 88.035 141.770 3.724 1.00 0.00 O ATOM 52146 H1 WAT 617 88.071 142.657 3.367 1.00 0.00 H ATOM 52147 H2 WAT 617 87.796 141.221 2.977 1.00 0.00 H TER 52149 WAT 617 ATOM 52149 O WAT 618 142.999 136.137 67.833 1.00 0.00 O ATOM 52150 H1 WAT 618 142.653 136.911 67.388 1.00 0.00 H ATOM 52151 H2 WAT 618 142.576 135.400 67.393 1.00 0.00 H TER 52153 WAT 618 ATOM 52153 O WAT 619 116.387 117.884 7.376 1.00 0.00 O ATOM 52154 H1 WAT 619 116.404 117.017 6.972 1.00 0.00 H ATOM 52155 H2 WAT 619 116.257 118.487 6.644 1.00 0.00 H TER 52157 WAT 619 ATOM 52157 O WAT 620 26.706 43.077 103.323 1.00 0.00 O ATOM 52158 H1 WAT 620 27.230 43.068 104.124 1.00 0.00 H ATOM 52159 H2 WAT 620 26.545 44.005 103.152 1.00 0.00 H TER 52161 WAT 620 ATOM 52161 O WAT 621 81.162 45.207 141.810 1.00 0.00 O ATOM 52162 H1 WAT 621 80.836 45.920 141.261 1.00 0.00 H ATOM 52163 H2 WAT 621 80.702 45.317 142.643 1.00 0.00 H TER 52165 WAT 621 ATOM 52165 O WAT 622 103.085 24.239 88.143 1.00 0.00 O ATOM 52166 H1 WAT 622 102.290 24.335 87.619 1.00 0.00 H ATOM 52167 H2 WAT 622 103.364 25.137 88.322 1.00 0.00 H TER 52169 WAT 622 ATOM 52169 O WAT 623 46.397 92.450 106.786 1.00 0.00 O ATOM 52170 H1 WAT 623 45.860 92.957 106.177 1.00 0.00 H ATOM 52171 H2 WAT 623 45.871 91.675 106.981 1.00 0.00 H TER 52173 WAT 623 ATOM 52173 O WAT 624 107.613 13.493 97.361 1.00 0.00 O ATOM 52174 H1 WAT 624 108.347 13.776 96.815 1.00 0.00 H ATOM 52175 H2 WAT 624 106.846 13.901 96.961 1.00 0.00 H TER 52177 WAT 624 ATOM 52177 O WAT 625 41.236 72.698 134.986 1.00 0.00 O ATOM 52178 H1 WAT 625 40.772 72.445 135.784 1.00 0.00 H ATOM 52179 H2 WAT 625 41.833 73.392 135.265 1.00 0.00 H TER 52181 WAT 625 ATOM 52181 O WAT 626 78.677 44.976 113.760 1.00 0.00 O ATOM 52182 H1 WAT 626 78.418 45.789 114.194 1.00 0.00 H ATOM 52183 H2 WAT 626 78.302 45.043 112.882 1.00 0.00 H TER 52185 WAT 626 ATOM 52185 O WAT 627 111.363 14.293 50.540 1.00 0.00 O ATOM 52186 H1 WAT 627 111.351 15.230 50.345 1.00 0.00 H ATOM 52187 H2 WAT 627 112.114 13.957 50.052 1.00 0.00 H TER 52189 WAT 627 ATOM 52189 O WAT 628 1.600 7.831 94.648 1.00 0.00 O ATOM 52190 H1 WAT 628 1.669 6.886 94.519 1.00 0.00 H ATOM 52191 H2 WAT 628 0.721 7.961 95.003 1.00 0.00 H TER 52193 WAT 628 ATOM 52193 O WAT 629 21.377 105.961 90.803 1.00 0.00 O ATOM 52194 H1 WAT 629 22.015 106.665 90.690 1.00 0.00 H ATOM 52195 H2 WAT 629 21.854 105.165 90.567 1.00 0.00 H TER 52197 WAT 629 ATOM 52197 O WAT 630 18.377 30.965 141.882 1.00 0.00 O ATOM 52198 H1 WAT 630 19.017 30.323 141.574 1.00 0.00 H ATOM 52199 H2 WAT 630 17.547 30.489 141.895 1.00 0.00 H TER 52201 WAT 630 ATOM 52201 O WAT 631 42.011 69.253 97.507 1.00 0.00 O ATOM 52202 H1 WAT 631 41.774 69.777 98.272 1.00 0.00 H ATOM 52203 H2 WAT 631 42.733 69.733 97.102 1.00 0.00 H TER 52205 WAT 631 ATOM 52205 O WAT 632 101.443 112.260 19.001 1.00 0.00 O ATOM 52206 H1 WAT 632 101.517 111.873 18.128 1.00 0.00 H ATOM 52207 H2 WAT 632 102.199 111.918 19.479 1.00 0.00 H TER 52209 WAT 632 ATOM 52209 O WAT 633 94.654 133.561 9.790 1.00 0.00 O ATOM 52210 H1 WAT 633 94.771 133.459 10.735 1.00 0.00 H ATOM 52211 H2 WAT 633 95.533 133.451 9.427 1.00 0.00 H TER 52213 WAT 633 ATOM 52213 O WAT 634 75.294 82.909 62.687 1.00 0.00 O ATOM 52214 H1 WAT 634 74.925 82.628 61.849 1.00 0.00 H ATOM 52215 H2 WAT 634 75.905 82.212 62.925 1.00 0.00 H TER 52217 WAT 634 ATOM 52217 O WAT 635 140.253 129.456 130.284 1.00 0.00 O ATOM 52218 H1 WAT 635 140.425 129.436 129.343 1.00 0.00 H ATOM 52219 H2 WAT 635 140.881 130.090 130.629 1.00 0.00 H TER 52221 WAT 635 ATOM 52221 O WAT 636 98.641 6.889 72.980 1.00 0.00 O ATOM 52222 H1 WAT 636 98.845 6.630 72.081 1.00 0.00 H ATOM 52223 H2 WAT 636 99.448 7.289 73.303 1.00 0.00 H TER 52225 WAT 636 ATOM 52225 O WAT 637 51.672 127.792 129.292 1.00 0.00 O ATOM 52226 H1 WAT 637 51.471 127.171 129.993 1.00 0.00 H ATOM 52227 H2 WAT 637 52.042 128.550 129.744 1.00 0.00 H TER 52229 WAT 637 ATOM 52229 O WAT 638 67.047 29.034 69.229 1.00 0.00 O ATOM 52230 H1 WAT 638 67.076 29.910 69.614 1.00 0.00 H ATOM 52231 H2 WAT 638 66.318 29.068 68.610 1.00 0.00 H TER 52233 WAT 638 ATOM 52233 O WAT 639 121.904 86.266 123.087 1.00 0.00 O ATOM 52234 H1 WAT 639 121.147 85.729 122.850 1.00 0.00 H ATOM 52235 H2 WAT 639 121.738 86.529 123.992 1.00 0.00 H TER 52237 WAT 639 ATOM 52237 O WAT 640 30.412 79.818 99.214 1.00 0.00 O ATOM 52238 H1 WAT 640 29.975 80.669 99.255 1.00 0.00 H ATOM 52239 H2 WAT 640 31.151 79.957 98.621 1.00 0.00 H TER 52241 WAT 640 ATOM 52241 O WAT 641 57.451 119.578 136.348 1.00 0.00 O ATOM 52242 H1 WAT 641 57.168 120.313 136.892 1.00 0.00 H ATOM 52243 H2 WAT 641 58.324 119.360 136.676 1.00 0.00 H TER 52245 WAT 641 ATOM 52245 O WAT 642 88.105 130.648 8.786 1.00 0.00 O ATOM 52246 H1 WAT 642 87.777 129.862 9.222 1.00 0.00 H ATOM 52247 H2 WAT 642 87.933 130.498 7.857 1.00 0.00 H TER 52249 WAT 642 ATOM 52249 O WAT 643 23.294 79.498 156.008 1.00 0.00 O ATOM 52250 H1 WAT 643 24.177 79.637 155.666 1.00 0.00 H ATOM 52251 H2 WAT 643 22.917 80.376 156.061 1.00 0.00 H TER 52253 WAT 643 ATOM 52253 O WAT 644 73.742 41.842 84.978 1.00 0.00 O ATOM 52254 H1 WAT 644 73.185 42.619 85.017 1.00 0.00 H ATOM 52255 H2 WAT 644 73.858 41.676 84.042 1.00 0.00 H TER 52257 WAT 644 ATOM 52257 O WAT 645 90.695 102.227 119.647 1.00 0.00 O ATOM 52258 H1 WAT 645 90.888 101.302 119.496 1.00 0.00 H ATOM 52259 H2 WAT 645 90.966 102.384 120.551 1.00 0.00 H TER 52261 WAT 645 ATOM 52261 O WAT 646 124.321 44.532 76.652 1.00 0.00 O ATOM 52262 H1 WAT 646 125.132 44.277 77.092 1.00 0.00 H ATOM 52263 H2 WAT 646 123.692 44.659 77.362 1.00 0.00 H TER 52265 WAT 646 ATOM 52265 O WAT 647 15.259 131.588 118.658 1.00 0.00 O ATOM 52266 H1 WAT 647 15.712 131.088 119.337 1.00 0.00 H ATOM 52267 H2 WAT 647 14.412 131.808 119.048 1.00 0.00 H TER 52269 WAT 647 ATOM 52269 O WAT 648 19.516 103.700 124.944 1.00 0.00 O ATOM 52270 H1 WAT 648 19.768 104.592 125.183 1.00 0.00 H ATOM 52271 H2 WAT 648 20.177 103.145 125.358 1.00 0.00 H TER 52273 WAT 648 ATOM 52273 O WAT 649 94.142 114.606 12.061 1.00 0.00 O ATOM 52274 H1 WAT 649 94.224 115.273 12.742 1.00 0.00 H ATOM 52275 H2 WAT 649 94.540 113.824 12.443 1.00 0.00 H TER 52277 WAT 649 ATOM 52277 O WAT 650 71.563 15.592 94.749 1.00 0.00 O ATOM 52278 H1 WAT 650 71.081 15.925 95.506 1.00 0.00 H ATOM 52279 H2 WAT 650 70.897 15.487 94.069 1.00 0.00 H TER 52281 WAT 650 ATOM 52281 O WAT 651 84.466 131.266 145.543 1.00 0.00 O ATOM 52282 H1 WAT 651 84.574 130.315 145.559 1.00 0.00 H ATOM 52283 H2 WAT 651 83.739 131.415 144.939 1.00 0.00 H TER 52285 WAT 651 ATOM 52285 O WAT 652 66.673 24.007 68.424 1.00 0.00 O ATOM 52286 H1 WAT 652 66.777 23.083 68.650 1.00 0.00 H ATOM 52287 H2 WAT 652 65.754 24.198 68.612 1.00 0.00 H TER 52289 WAT 652 ATOM 52289 O WAT 653 103.054 108.779 140.047 1.00 0.00 O ATOM 52290 H1 WAT 653 103.920 109.180 139.963 1.00 0.00 H ATOM 52291 H2 WAT 653 102.444 109.516 140.005 1.00 0.00 H TER 52293 WAT 653 ATOM 52293 O WAT 654 135.279 2.854 115.182 1.00 0.00 O ATOM 52294 H1 WAT 654 136.001 3.447 114.971 1.00 0.00 H ATOM 52295 H2 WAT 654 135.407 2.640 116.106 1.00 0.00 H TER 52297 WAT 654 ATOM 52297 O WAT 655 77.268 113.740 63.000 1.00 0.00 O ATOM 52298 H1 WAT 655 77.557 114.632 62.810 1.00 0.00 H ATOM 52299 H2 WAT 655 76.583 113.845 63.659 1.00 0.00 H TER 52301 WAT 655 ATOM 52301 O WAT 656 115.017 112.801 105.549 1.00 0.00 O ATOM 52302 H1 WAT 656 114.953 111.999 106.068 1.00 0.00 H ATOM 52303 H2 WAT 656 115.913 113.106 105.689 1.00 0.00 H TER 52305 WAT 656 ATOM 52305 O WAT 657 44.072 3.710 86.493 1.00 0.00 O ATOM 52306 H1 WAT 657 43.663 4.560 86.330 1.00 0.00 H ATOM 52307 H2 WAT 657 44.837 3.698 85.918 1.00 0.00 H TER 52309 WAT 657 ATOM 52309 O WAT 658 86.874 79.293 135.703 1.00 0.00 O ATOM 52310 H1 WAT 658 87.616 78.960 135.199 1.00 0.00 H ATOM 52311 H2 WAT 658 86.161 78.683 135.513 1.00 0.00 H TER 52313 WAT 658 ATOM 52313 O WAT 659 96.989 37.173 25.876 1.00 0.00 O ATOM 52314 H1 WAT 659 97.412 37.729 26.530 1.00 0.00 H ATOM 52315 H2 WAT 659 96.073 37.451 25.881 1.00 0.00 H TER 52317 WAT 659 ATOM 52317 O WAT 660 132.941 131.596 155.292 1.00 0.00 O ATOM 52318 H1 WAT 660 133.659 132.100 155.674 1.00 0.00 H ATOM 52319 H2 WAT 660 132.829 131.964 154.416 1.00 0.00 H TER 52321 WAT 660 ATOM 52321 O WAT 661 43.127 37.587 79.517 1.00 0.00 O ATOM 52322 H1 WAT 661 42.523 36.985 79.953 1.00 0.00 H ATOM 52323 H2 WAT 661 43.777 37.800 80.187 1.00 0.00 H TER 52325 WAT 661 ATOM 52325 O WAT 662 12.788 50.288 59.115 1.00 0.00 O ATOM 52326 H1 WAT 662 12.581 51.218 59.021 1.00 0.00 H ATOM 52327 H2 WAT 662 13.392 50.251 59.857 1.00 0.00 H TER 52329 WAT 662 ATOM 52329 O WAT 663 110.934 28.267 131.063 1.00 0.00 O ATOM 52330 H1 WAT 663 111.385 29.097 131.217 1.00 0.00 H ATOM 52331 H2 WAT 663 110.571 28.352 130.181 1.00 0.00 H TER 52333 WAT 663 ATOM 52333 O WAT 664 76.002 7.731 154.010 1.00 0.00 O ATOM 52334 H1 WAT 664 75.140 7.374 154.222 1.00 0.00 H ATOM 52335 H2 WAT 664 76.151 7.473 153.100 1.00 0.00 H TER 52337 WAT 664 ATOM 52337 O WAT 665 54.034 127.112 138.118 1.00 0.00 O ATOM 52338 H1 WAT 665 54.239 127.203 137.187 1.00 0.00 H ATOM 52339 H2 WAT 665 53.984 128.012 138.441 1.00 0.00 H TER 52341 WAT 665 ATOM 52341 O WAT 666 98.069 55.613 76.142 1.00 0.00 O ATOM 52342 H1 WAT 666 97.695 55.557 75.263 1.00 0.00 H ATOM 52343 H2 WAT 666 98.773 56.256 76.062 1.00 0.00 H TER 52345 WAT 666 ATOM 52345 O WAT 667 10.578 80.670 62.048 1.00 0.00 O ATOM 52346 H1 WAT 667 11.124 80.862 62.810 1.00 0.00 H ATOM 52347 H2 WAT 667 10.626 79.718 61.953 1.00 0.00 H TER 52349 WAT 667 ATOM 52349 O WAT 668 23.557 29.353 17.470 1.00 0.00 O ATOM 52350 H1 WAT 668 22.605 29.261 17.512 1.00 0.00 H ATOM 52351 H2 WAT 668 23.887 28.456 17.509 1.00 0.00 H TER 52353 WAT 668 ATOM 52353 O WAT 669 75.653 98.453 141.352 1.00 0.00 O ATOM 52354 H1 WAT 669 76.146 98.836 142.078 1.00 0.00 H ATOM 52355 H2 WAT 669 75.128 97.763 141.757 1.00 0.00 H TER 52357 WAT 669 ATOM 52357 O WAT 670 109.446 39.964 104.181 1.00 0.00 O ATOM 52358 H1 WAT 670 109.452 40.188 103.250 1.00 0.00 H ATOM 52359 H2 WAT 670 109.871 40.708 104.609 1.00 0.00 H TER 52361 WAT 670 ATOM 52361 O WAT 671 11.140 138.356 9.292 1.00 0.00 O ATOM 52362 H1 WAT 671 11.112 137.841 8.487 1.00 0.00 H ATOM 52363 H2 WAT 671 10.242 138.668 9.408 1.00 0.00 H TER 52365 WAT 671 ATOM 52365 O WAT 672 103.578 44.903 11.253 1.00 0.00 O ATOM 52366 H1 WAT 672 103.335 44.006 11.024 1.00 0.00 H ATOM 52367 H2 WAT 672 102.825 45.430 10.986 1.00 0.00 H TER 52369 WAT 672 ATOM 52369 O WAT 673 7.301 38.887 108.200 1.00 0.00 O ATOM 52370 H1 WAT 673 6.967 38.353 108.921 1.00 0.00 H ATOM 52371 H2 WAT 673 6.881 39.739 108.317 1.00 0.00 H TER 52373 WAT 673 ATOM 52373 O WAT 674 42.568 116.411 130.664 1.00 0.00 O ATOM 52374 H1 WAT 674 43.518 116.402 130.546 1.00 0.00 H ATOM 52375 H2 WAT 674 42.221 116.610 129.794 1.00 0.00 H TER 52377 WAT 674 ATOM 52377 O WAT 675 22.298 21.460 106.591 1.00 0.00 O ATOM 52378 H1 WAT 675 22.351 22.061 105.848 1.00 0.00 H ATOM 52379 H2 WAT 675 21.832 20.697 106.251 1.00 0.00 H TER 52381 WAT 675 ATOM 52381 O WAT 676 11.354 26.551 18.451 1.00 0.00 O ATOM 52382 H1 WAT 676 11.331 25.638 18.735 1.00 0.00 H ATOM 52383 H2 WAT 676 10.765 26.583 17.697 1.00 0.00 H TER 52385 WAT 676 ATOM 52385 O WAT 677 79.429 4.454 91.473 1.00 0.00 O ATOM 52386 H1 WAT 677 78.963 3.623 91.384 1.00 0.00 H ATOM 52387 H2 WAT 677 78.737 5.115 91.502 1.00 0.00 H TER 52389 WAT 677 ATOM 52389 O WAT 678 60.434 15.798 71.707 1.00 0.00 O ATOM 52390 H1 WAT 678 60.607 15.588 70.789 1.00 0.00 H ATOM 52391 H2 WAT 678 60.820 15.070 72.195 1.00 0.00 H TER 52393 WAT 678 ATOM 52393 O WAT 679 0.471 43.080 79.608 1.00 0.00 O ATOM 52394 H1 WAT 679 1.426 43.067 79.682 1.00 0.00 H ATOM 52395 H2 WAT 679 0.214 43.922 79.985 1.00 0.00 H TER 52397 WAT 679 ATOM 52397 O WAT 680 97.124 105.418 124.983 1.00 0.00 O ATOM 52398 H1 WAT 680 97.156 105.576 125.926 1.00 0.00 H ATOM 52399 H2 WAT 680 96.254 105.720 124.719 1.00 0.00 H TER 52401 WAT 680 ATOM 52401 O WAT 681 63.629 67.269 108.010 1.00 0.00 O ATOM 52402 H1 WAT 681 63.510 66.792 108.831 1.00 0.00 H ATOM 52403 H2 WAT 681 63.029 68.013 108.076 1.00 0.00 H TER 52405 WAT 681 ATOM 52405 O WAT 682 55.929 35.252 104.832 1.00 0.00 O ATOM 52406 H1 WAT 682 55.978 34.390 104.417 1.00 0.00 H ATOM 52407 H2 WAT 682 56.740 35.689 104.573 1.00 0.00 H TER 52409 WAT 682 ATOM 52409 O WAT 683 123.478 112.331 70.018 1.00 0.00 O ATOM 52410 H1 WAT 683 123.423 111.417 70.296 1.00 0.00 H ATOM 52411 H2 WAT 683 124.331 112.400 69.589 1.00 0.00 H TER 52413 WAT 683 ATOM 52413 O WAT 684 37.315 89.540 148.863 1.00 0.00 O ATOM 52414 H1 WAT 684 36.749 90.061 149.433 1.00 0.00 H ATOM 52415 H2 WAT 684 37.380 90.053 148.057 1.00 0.00 H TER 52417 WAT 684 ATOM 52417 O WAT 685 36.447 123.894 155.988 1.00 0.00 O ATOM 52418 H1 WAT 685 36.241 122.984 155.774 1.00 0.00 H ATOM 52419 H2 WAT 685 37.256 124.075 155.511 1.00 0.00 H TER 52421 WAT 685 ATOM 52421 O WAT 686 67.353 49.000 126.629 1.00 0.00 O ATOM 52422 H1 WAT 686 67.139 48.103 126.371 1.00 0.00 H ATOM 52423 H2 WAT 686 66.644 49.255 127.219 1.00 0.00 H TER 52425 WAT 686 ATOM 52425 O WAT 687 143.453 23.873 102.064 1.00 0.00 O ATOM 52426 H1 WAT 687 143.436 23.897 103.021 1.00 0.00 H ATOM 52427 H2 WAT 687 143.494 22.941 101.849 1.00 0.00 H TER 52429 WAT 687 ATOM 52429 O WAT 688 71.295 115.413 57.491 1.00 0.00 O ATOM 52430 H1 WAT 688 70.860 114.831 56.868 1.00 0.00 H ATOM 52431 H2 WAT 688 71.994 114.879 57.869 1.00 0.00 H TER 52433 WAT 688 ATOM 52433 O WAT 689 116.168 81.719 7.675 1.00 0.00 O ATOM 52434 H1 WAT 689 116.104 82.363 8.380 1.00 0.00 H ATOM 52435 H2 WAT 689 115.299 81.715 7.274 1.00 0.00 H TER 52437 WAT 689 ATOM 52437 O WAT 690 15.750 46.175 117.779 1.00 0.00 O ATOM 52438 H1 WAT 690 15.942 47.112 117.754 1.00 0.00 H ATOM 52439 H2 WAT 690 16.594 45.763 117.965 1.00 0.00 H TER 52441 WAT 690 ATOM 52441 O WAT 691 5.744 9.367 12.673 1.00 0.00 O ATOM 52442 H1 WAT 691 5.711 8.565 12.151 1.00 0.00 H ATOM 52443 H2 WAT 691 4.827 9.572 12.857 1.00 0.00 H TER 52445 WAT 691 ATOM 52445 O WAT 692 19.094 47.050 58.583 1.00 0.00 O ATOM 52446 H1 WAT 692 18.339 47.614 58.751 1.00 0.00 H ATOM 52447 H2 WAT 692 18.756 46.161 58.690 1.00 0.00 H TER 52449 WAT 692 ATOM 52449 O WAT 693 98.831 16.254 6.681 1.00 0.00 O ATOM 52450 H1 WAT 693 98.752 17.205 6.609 1.00 0.00 H ATOM 52451 H2 WAT 693 98.731 15.937 5.783 1.00 0.00 H TER 52453 WAT 693 ATOM 52453 O WAT 694 109.377 64.050 157.064 1.00 0.00 O ATOM 52454 H1 WAT 694 110.151 63.726 156.602 1.00 0.00 H ATOM 52455 H2 WAT 694 108.992 63.270 157.462 1.00 0.00 H TER 52457 WAT 694 ATOM 52457 O WAT 695 67.842 61.506 96.617 1.00 0.00 O ATOM 52458 H1 WAT 695 68.329 61.107 97.338 1.00 0.00 H ATOM 52459 H2 WAT 695 68.487 61.600 95.916 1.00 0.00 H TER 52461 WAT 695 ATOM 52461 O WAT 696 144.811 50.860 86.310 1.00 0.00 O ATOM 52462 H1 WAT 696 145.571 50.873 85.729 1.00 0.00 H ATOM 52463 H2 WAT 696 145.152 50.538 87.144 1.00 0.00 H TER 52465 WAT 696 ATOM 52465 O WAT 697 100.673 66.220 74.165 1.00 0.00 O ATOM 52466 H1 WAT 697 99.899 66.349 74.714 1.00 0.00 H ATOM 52467 H2 WAT 697 101.123 67.064 74.185 1.00 0.00 H TER 52469 WAT 697 ATOM 52469 O WAT 698 28.296 115.330 151.724 1.00 0.00 O ATOM 52470 H1 WAT 698 28.248 115.375 152.678 1.00 0.00 H ATOM 52471 H2 WAT 698 27.778 116.076 151.422 1.00 0.00 H TER 52473 WAT 698 ATOM 52473 O WAT 699 19.362 0.520 2.355 1.00 0.00 O ATOM 52474 H1 WAT 699 19.678 0.677 1.465 1.00 0.00 H ATOM 52475 H2 WAT 699 18.457 0.230 2.240 1.00 0.00 H TER 52477 WAT 699 ATOM 52477 O WAT 700 121.098 65.349 83.568 1.00 0.00 O ATOM 52478 H1 WAT 700 120.317 64.814 83.428 1.00 0.00 H ATOM 52479 H2 WAT 700 120.971 66.112 83.005 1.00 0.00 H TER 52481 WAT 700 ATOM 52481 O WAT 701 46.647 43.254 134.347 1.00 0.00 O ATOM 52482 H1 WAT 701 46.622 42.856 133.477 1.00 0.00 H ATOM 52483 H2 WAT 701 45.903 42.869 134.809 1.00 0.00 H TER 52485 WAT 701 ATOM 52485 O WAT 702 97.857 121.289 151.030 1.00 0.00 O ATOM 52486 H1 WAT 702 98.474 121.792 150.497 1.00 0.00 H ATOM 52487 H2 WAT 702 97.007 121.692 150.856 1.00 0.00 H TER 52489 WAT 702 ATOM 52489 O WAT 703 46.558 3.032 144.835 1.00 0.00 O ATOM 52490 H1 WAT 703 46.430 3.444 145.689 1.00 0.00 H ATOM 52491 H2 WAT 703 45.891 2.346 144.798 1.00 0.00 H TER 52493 WAT 703 ATOM 52493 O WAT 704 107.092 114.301 80.222 1.00 0.00 O ATOM 52494 H1 WAT 704 106.199 114.104 80.506 1.00 0.00 H ATOM 52495 H2 WAT 704 107.204 113.796 79.416 1.00 0.00 H TER 52497 WAT 704 ATOM 52497 O WAT 705 48.762 41.812 66.224 1.00 0.00 O ATOM 52498 H1 WAT 705 48.171 41.868 66.975 1.00 0.00 H ATOM 52499 H2 WAT 705 49.083 42.705 66.104 1.00 0.00 H TER 52501 WAT 705 ATOM 52501 O WAT 706 77.509 36.740 146.004 1.00 0.00 O ATOM 52502 H1 WAT 706 76.999 37.437 145.590 1.00 0.00 H ATOM 52503 H2 WAT 706 77.382 35.980 145.435 1.00 0.00 H TER 52505 WAT 706 ATOM 52505 O WAT 707 120.345 3.952 60.436 1.00 0.00 O ATOM 52506 H1 WAT 707 119.937 4.750 60.770 1.00 0.00 H ATOM 52507 H2 WAT 707 121.273 4.172 60.357 1.00 0.00 H TER 52509 WAT 707 ATOM 52509 O WAT 708 60.026 69.130 130.560 1.00 0.00 O ATOM 52510 H1 WAT 708 59.532 68.901 131.347 1.00 0.00 H ATOM 52511 H2 WAT 708 60.850 69.489 130.889 1.00 0.00 H TER 52513 WAT 708 ATOM 52513 O WAT 709 119.945 4.471 87.978 1.00 0.00 O ATOM 52514 H1 WAT 709 120.598 4.506 88.677 1.00 0.00 H ATOM 52515 H2 WAT 709 120.423 4.729 87.190 1.00 0.00 H TER 52517 WAT 709 ATOM 52517 O WAT 710 1.517 57.861 147.191 1.00 0.00 O ATOM 52518 H1 WAT 710 2.070 58.638 147.281 1.00 0.00 H ATOM 52519 H2 WAT 710 2.034 57.261 146.653 1.00 0.00 H TER 52521 WAT 710 ATOM 52521 O WAT 711 97.021 24.361 92.919 1.00 0.00 O ATOM 52522 H1 WAT 711 97.576 23.614 92.697 1.00 0.00 H ATOM 52523 H2 WAT 711 97.235 25.023 92.262 1.00 0.00 H TER 52525 WAT 711 ATOM 52525 O WAT 712 80.419 133.344 132.163 1.00 0.00 O ATOM 52526 H1 WAT 712 80.855 132.508 132.329 1.00 0.00 H ATOM 52527 H2 WAT 712 79.539 133.101 131.874 1.00 0.00 H TER 52529 WAT 712 ATOM 52529 O WAT 713 25.876 90.215 151.985 1.00 0.00 O ATOM 52530 H1 WAT 713 25.780 90.790 152.745 1.00 0.00 H ATOM 52531 H2 WAT 713 26.492 89.541 152.271 1.00 0.00 H TER 52533 WAT 713 ATOM 52533 O WAT 714 13.843 72.111 124.336 1.00 0.00 O ATOM 52534 H1 WAT 714 14.022 71.642 123.520 1.00 0.00 H ATOM 52535 H2 WAT 714 14.201 72.987 124.191 1.00 0.00 H TER 52537 WAT 714 ATOM 52537 O WAT 715 119.113 124.369 95.172 1.00 0.00 O ATOM 52538 H1 WAT 715 118.363 123.849 95.461 1.00 0.00 H ATOM 52539 H2 WAT 715 119.025 125.198 95.643 1.00 0.00 H TER 52541 WAT 715 ATOM 52541 O WAT 716 23.457 88.881 128.136 1.00 0.00 O ATOM 52542 H1 WAT 716 23.342 89.704 127.661 1.00 0.00 H ATOM 52543 H2 WAT 716 22.597 88.461 128.097 1.00 0.00 H TER 52545 WAT 716 ATOM 52545 O WAT 717 4.379 135.308 102.405 1.00 0.00 O ATOM 52546 H1 WAT 717 3.820 136.068 102.244 1.00 0.00 H ATOM 52547 H2 WAT 717 5.001 135.309 101.677 1.00 0.00 H TER 52549 WAT 717 ATOM 52549 O WAT 718 128.307 6.232 118.547 1.00 0.00 O ATOM 52550 H1 WAT 718 128.898 5.560 118.208 1.00 0.00 H ATOM 52551 H2 WAT 718 128.888 6.907 118.899 1.00 0.00 H TER 52553 WAT 718 ATOM 52553 O WAT 719 78.772 98.805 86.109 1.00 0.00 O ATOM 52554 H1 WAT 719 79.240 99.626 86.265 1.00 0.00 H ATOM 52555 H2 WAT 719 78.662 98.769 85.159 1.00 0.00 H TER 52557 WAT 719 ATOM 52557 O WAT 720 86.982 73.370 113.295 1.00 0.00 O ATOM 52558 H1 WAT 720 87.294 72.694 112.693 1.00 0.00 H ATOM 52559 H2 WAT 720 86.028 73.341 113.214 1.00 0.00 H TER 52561 WAT 720 ATOM 52561 O WAT 721 75.713 3.949 109.510 1.00 0.00 O ATOM 52562 H1 WAT 721 76.345 3.523 110.090 1.00 0.00 H ATOM 52563 H2 WAT 721 75.778 4.879 109.727 1.00 0.00 H TER 52565 WAT 721 ATOM 52565 O WAT 722 94.875 29.515 149.240 1.00 0.00 O ATOM 52566 H1 WAT 722 95.618 30.092 149.062 1.00 0.00 H ATOM 52567 H2 WAT 722 95.026 28.752 148.682 1.00 0.00 H TER 52569 WAT 722 ATOM 52569 O WAT 723 80.506 20.263 9.645 1.00 0.00 O ATOM 52570 H1 WAT 723 81.049 19.607 10.084 1.00 0.00 H ATOM 52571 H2 WAT 723 80.290 19.868 8.800 1.00 0.00 H TER 52573 WAT 723 ATOM 52573 O WAT 724 71.184 23.257 123.407 1.00 0.00 O ATOM 52574 H1 WAT 724 70.455 23.834 123.633 1.00 0.00 H ATOM 52575 H2 WAT 724 71.506 23.594 122.571 1.00 0.00 H TER 52577 WAT 724 ATOM 52577 O WAT 725 96.144 109.969 154.232 1.00 0.00 O ATOM 52578 H1 WAT 725 96.360 109.067 153.996 1.00 0.00 H ATOM 52579 H2 WAT 725 95.845 110.366 153.414 1.00 0.00 H TER 52581 WAT 725 ATOM 52581 O WAT 726 51.000 28.165 78.536 1.00 0.00 O ATOM 52582 H1 WAT 726 51.413 27.974 77.694 1.00 0.00 H ATOM 52583 H2 WAT 726 51.131 29.105 78.660 1.00 0.00 H TER 52585 WAT 726 ATOM 52585 O WAT 727 127.618 126.529 154.880 1.00 0.00 O ATOM 52586 H1 WAT 727 127.941 126.523 153.979 1.00 0.00 H ATOM 52587 H2 WAT 727 126.704 126.806 154.806 1.00 0.00 H TER 52589 WAT 727 ATOM 52589 O WAT 728 135.184 82.317 132.985 1.00 0.00 O ATOM 52590 H1 WAT 728 135.683 83.115 132.808 1.00 0.00 H ATOM 52591 H2 WAT 728 135.829 81.613 132.924 1.00 0.00 H TER 52593 WAT 728 ATOM 52593 O WAT 729 24.714 108.652 113.410 1.00 0.00 O ATOM 52594 H1 WAT 729 25.589 108.942 113.152 1.00 0.00 H ATOM 52595 H2 WAT 729 24.783 107.699 113.461 1.00 0.00 H TER 52597 WAT 729 ATOM 52597 O WAT 730 96.952 37.357 155.982 1.00 0.00 O ATOM 52598 H1 WAT 730 97.722 37.326 156.550 1.00 0.00 H ATOM 52599 H2 WAT 730 96.239 37.026 156.528 1.00 0.00 H TER 52601 WAT 730 ATOM 52601 O WAT 731 138.252 39.133 84.266 1.00 0.00 O ATOM 52602 H1 WAT 731 138.470 40.051 84.427 1.00 0.00 H ATOM 52603 H2 WAT 731 137.295 39.115 84.242 1.00 0.00 H TER 52605 WAT 731 ATOM 52605 O WAT 732 71.711 144.618 154.861 1.00 0.00 O ATOM 52606 H1 WAT 732 70.797 144.444 155.086 1.00 0.00 H ATOM 52607 H2 WAT 732 71.668 145.309 154.200 1.00 0.00 H TER 52609 WAT 732 ATOM 52609 O WAT 733 66.653 21.270 120.099 1.00 0.00 O ATOM 52610 H1 WAT 733 67.178 21.842 120.660 1.00 0.00 H ATOM 52611 H2 WAT 733 66.830 21.578 119.211 1.00 0.00 H TER 52613 WAT 733 ATOM 52613 O WAT 734 41.254 62.811 157.419 1.00 0.00 O ATOM 52614 H1 WAT 734 40.359 62.628 157.704 1.00 0.00 H ATOM 52615 H2 WAT 734 41.151 63.381 156.657 1.00 0.00 H TER 52617 WAT 734 ATOM 52617 O WAT 735 45.309 6.988 151.474 1.00 0.00 O ATOM 52618 H1 WAT 735 44.840 7.057 152.305 1.00 0.00 H ATOM 52619 H2 WAT 735 46.217 6.814 151.725 1.00 0.00 H TER 52621 WAT 735 ATOM 52621 O WAT 736 16.491 106.199 135.877 1.00 0.00 O ATOM 52622 H1 WAT 736 15.830 105.574 135.579 1.00 0.00 H ATOM 52623 H2 WAT 736 16.044 107.045 135.862 1.00 0.00 H TER 52625 WAT 736 ATOM 52625 O WAT 737 27.573 13.187 6.357 1.00 0.00 O ATOM 52626 H1 WAT 737 27.185 12.773 5.586 1.00 0.00 H ATOM 52627 H2 WAT 737 28.504 13.261 6.146 1.00 0.00 H TER 52629 WAT 737 ATOM 52629 O WAT 738 84.908 120.640 123.809 1.00 0.00 O ATOM 52630 H1 WAT 738 84.664 120.271 122.960 1.00 0.00 H ATOM 52631 H2 WAT 738 85.533 121.333 123.597 1.00 0.00 H TER 52633 WAT 738 ATOM 52633 O WAT 739 123.513 138.343 134.626 1.00 0.00 O ATOM 52634 H1 WAT 739 122.643 138.515 134.986 1.00 0.00 H ATOM 52635 H2 WAT 739 124.087 138.318 135.391 1.00 0.00 H TER 52637 WAT 739 ATOM 52637 O WAT 740 86.392 78.517 122.798 1.00 0.00 O ATOM 52638 H1 WAT 740 86.787 79.013 123.515 1.00 0.00 H ATOM 52639 H2 WAT 740 86.632 79.002 122.009 1.00 0.00 H TER 52641 WAT 740 ATOM 52641 O WAT 741 35.853 24.632 82.412 1.00 0.00 O ATOM 52642 H1 WAT 741 36.312 25.403 82.078 1.00 0.00 H ATOM 52643 H2 WAT 741 34.948 24.749 82.124 1.00 0.00 H TER 52645 WAT 741 ATOM 52645 O WAT 742 20.015 27.933 7.468 1.00 0.00 O ATOM 52646 H1 WAT 742 20.805 27.859 6.932 1.00 0.00 H ATOM 52647 H2 WAT 742 19.834 27.037 7.752 1.00 0.00 H TER 52649 WAT 742 ATOM 52649 O WAT 743 127.396 136.530 64.492 1.00 0.00 O ATOM 52650 H1 WAT 743 126.735 136.938 63.932 1.00 0.00 H ATOM 52651 H2 WAT 743 127.577 135.688 64.074 1.00 0.00 H TER 52653 WAT 743 ATOM 52653 O WAT 744 101.656 28.436 96.890 1.00 0.00 O ATOM 52654 H1 WAT 744 101.921 29.352 96.967 1.00 0.00 H ATOM 52655 H2 WAT 744 102.093 28.126 96.097 1.00 0.00 H TER 52657 WAT 744 ATOM 52657 O WAT 745 46.678 105.647 67.600 1.00 0.00 O ATOM 52658 H1 WAT 745 47.391 106.023 68.116 1.00 0.00 H ATOM 52659 H2 WAT 745 47.012 105.634 66.703 1.00 0.00 H TER 52661 WAT 745 ATOM 52661 O WAT 746 60.825 6.814 133.426 1.00 0.00 O ATOM 52662 H1 WAT 746 61.173 7.055 132.567 1.00 0.00 H ATOM 52663 H2 WAT 746 59.920 7.126 133.414 1.00 0.00 H TER 52665 WAT 746 ATOM 52665 O WAT 747 115.823 104.397 62.262 1.00 0.00 O ATOM 52666 H1 WAT 747 116.587 103.885 62.526 1.00 0.00 H ATOM 52667 H2 WAT 747 115.578 104.039 61.408 1.00 0.00 H TER 52669 WAT 747 ATOM 52669 O WAT 748 116.702 136.261 18.879 1.00 0.00 O ATOM 52670 H1 WAT 748 116.682 137.216 18.824 1.00 0.00 H ATOM 52671 H2 WAT 748 116.507 136.069 19.796 1.00 0.00 H TER 52673 WAT 748 ATOM 52673 O WAT 749 104.804 31.638 52.148 1.00 0.00 O ATOM 52674 H1 WAT 749 104.200 32.086 52.740 1.00 0.00 H ATOM 52675 H2 WAT 749 105.660 31.724 52.569 1.00 0.00 H TER 52677 WAT 749 ATOM 52677 O WAT 750 43.783 38.769 139.298 1.00 0.00 O ATOM 52678 H1 WAT 750 43.389 38.015 138.858 1.00 0.00 H ATOM 52679 H2 WAT 750 43.097 39.437 139.289 1.00 0.00 H TER 52681 WAT 750 ATOM 52681 O WAT 751 133.899 83.455 141.147 1.00 0.00 O ATOM 52682 H1 WAT 751 134.629 82.836 141.143 1.00 0.00 H ATOM 52683 H2 WAT 751 134.301 84.302 140.957 1.00 0.00 H TER 52685 WAT 751 ATOM 52685 O WAT 752 142.692 117.165 21.007 1.00 0.00 O ATOM 52686 H1 WAT 752 143.421 117.052 21.617 1.00 0.00 H ATOM 52687 H2 WAT 752 141.942 116.773 21.455 1.00 0.00 H TER 52689 WAT 752 ATOM 52689 O WAT 753 36.958 136.149 19.969 1.00 0.00 O ATOM 52690 H1 WAT 753 37.420 136.652 20.639 1.00 0.00 H ATOM 52691 H2 WAT 753 37.053 135.237 20.246 1.00 0.00 H TER 52693 WAT 753 ATOM 52693 O WAT 754 87.399 119.849 118.597 1.00 0.00 O ATOM 52694 H1 WAT 754 86.589 120.347 118.490 1.00 0.00 H ATOM 52695 H2 WAT 754 87.716 119.713 117.704 1.00 0.00 H TER 52697 WAT 754 ATOM 52697 O WAT 755 35.940 97.895 89.921 1.00 0.00 O ATOM 52698 H1 WAT 755 36.156 98.588 90.544 1.00 0.00 H ATOM 52699 H2 WAT 755 35.141 98.200 89.490 1.00 0.00 H TER 52701 WAT 755 ATOM 52701 O WAT 756 36.801 131.560 14.857 1.00 0.00 O ATOM 52702 H1 WAT 756 35.890 131.269 14.832 1.00 0.00 H ATOM 52703 H2 WAT 756 36.826 132.208 15.561 1.00 0.00 H TER 52705 WAT 756 ATOM 52705 O WAT 757 113.954 87.164 91.781 1.00 0.00 O ATOM 52706 H1 WAT 757 113.819 87.710 92.556 1.00 0.00 H ATOM 52707 H2 WAT 757 113.240 86.527 91.811 1.00 0.00 H TER 52709 WAT 757 ATOM 52709 O WAT 758 100.720 93.600 93.666 1.00 0.00 O ATOM 52710 H1 WAT 758 100.168 92.819 93.628 1.00 0.00 H ATOM 52711 H2 WAT 758 100.102 94.330 93.679 1.00 0.00 H TER 52713 WAT 758 ATOM 52713 O WAT 759 92.472 5.086 15.455 1.00 0.00 O ATOM 52714 H1 WAT 759 93.117 4.792 16.098 1.00 0.00 H ATOM 52715 H2 WAT 759 91.856 5.618 15.959 1.00 0.00 H TER 52717 WAT 759 ATOM 52717 O WAT 760 20.063 40.776 135.427 1.00 0.00 O ATOM 52718 H1 WAT 760 19.511 40.120 135.002 1.00 0.00 H ATOM 52719 H2 WAT 760 20.380 40.345 136.220 1.00 0.00 H TER 52721 WAT 760 ATOM 52721 O WAT 761 120.292 7.928 137.917 1.00 0.00 O ATOM 52722 H1 WAT 761 120.310 6.997 137.695 1.00 0.00 H ATOM 52723 H2 WAT 761 120.954 8.023 138.603 1.00 0.00 H TER 52725 WAT 761 ATOM 52725 O WAT 762 120.133 69.007 68.808 1.00 0.00 O ATOM 52726 H1 WAT 762 121.024 69.272 69.034 1.00 0.00 H ATOM 52727 H2 WAT 762 119.612 69.803 68.913 1.00 0.00 H TER 52729 WAT 762 ATOM 52729 O WAT 763 45.453 124.102 137.324 1.00 0.00 O ATOM 52730 H1 WAT 763 45.858 124.315 136.483 1.00 0.00 H ATOM 52731 H2 WAT 763 45.104 123.219 137.204 1.00 0.00 H TER 52733 WAT 763 ATOM 52733 O WAT 764 115.697 78.813 132.797 1.00 0.00 O ATOM 52734 H1 WAT 764 116.437 78.214 132.902 1.00 0.00 H ATOM 52735 H2 WAT 764 115.132 78.385 132.154 1.00 0.00 H TER 52737 WAT 764 ATOM 52737 O WAT 765 12.520 82.515 7.175 1.00 0.00 O ATOM 52738 H1 WAT 765 12.635 82.989 6.351 1.00 0.00 H ATOM 52739 H2 WAT 765 13.339 82.658 7.650 1.00 0.00 H TER 52741 WAT 765 ATOM 52741 O WAT 766 111.476 61.668 71.563 1.00 0.00 O ATOM 52742 H1 WAT 766 112.023 61.837 70.797 1.00 0.00 H ATOM 52743 H2 WAT 766 112.093 61.626 72.294 1.00 0.00 H TER 52745 WAT 766 ATOM 52745 O WAT 767 120.437 69.084 25.491 1.00 0.00 O ATOM 52746 H1 WAT 767 119.824 68.854 26.189 1.00 0.00 H ATOM 52747 H2 WAT 767 120.737 68.242 25.148 1.00 0.00 H TER 52749 WAT 767 ATOM 52749 O WAT 768 128.579 59.369 86.171 1.00 0.00 O ATOM 52750 H1 WAT 768 127.685 59.707 86.224 1.00 0.00 H ATOM 52751 H2 WAT 768 128.807 59.153 87.076 1.00 0.00 H TER 52753 WAT 768 ATOM 52753 O WAT 769 4.803 58.624 54.844 1.00 0.00 O ATOM 52754 H1 WAT 769 4.034 58.117 55.103 1.00 0.00 H ATOM 52755 H2 WAT 769 4.628 59.507 55.170 1.00 0.00 H TER 52757 WAT 769 ATOM 52757 O WAT 770 128.114 85.959 73.661 1.00 0.00 O ATOM 52758 H1 WAT 770 128.135 85.063 73.325 1.00 0.00 H ATOM 52759 H2 WAT 770 127.723 86.471 72.953 1.00 0.00 H TER 52761 WAT 770 ATOM 52761 O WAT 771 79.079 19.396 94.922 1.00 0.00 O ATOM 52762 H1 WAT 771 79.963 19.109 95.153 1.00 0.00 H ATOM 52763 H2 WAT 771 79.134 20.351 94.906 1.00 0.00 H TER 52765 WAT 771 ATOM 52765 O WAT 772 138.704 113.678 92.105 1.00 0.00 O ATOM 52766 H1 WAT 772 138.436 114.408 92.663 1.00 0.00 H ATOM 52767 H2 WAT 772 137.916 113.141 92.017 1.00 0.00 H TER 52769 WAT 772 ATOM 52769 O WAT 773 134.033 69.288 21.725 1.00 0.00 O ATOM 52770 H1 WAT 773 133.206 69.658 22.033 1.00 0.00 H ATOM 52771 H2 WAT 773 134.404 69.966 21.160 1.00 0.00 H TER 52773 WAT 773 ATOM 52773 O WAT 774 118.916 49.520 110.876 1.00 0.00 O ATOM 52774 H1 WAT 774 119.656 49.890 111.357 1.00 0.00 H ATOM 52775 H2 WAT 774 118.717 50.172 110.203 1.00 0.00 H TER 52777 WAT 774 ATOM 52777 O WAT 775 124.916 34.740 129.139 1.00 0.00 O ATOM 52778 H1 WAT 775 125.455 35.175 128.479 1.00 0.00 H ATOM 52779 H2 WAT 775 125.530 34.510 129.836 1.00 0.00 H TER 52781 WAT 775 ATOM 52781 O WAT 776 29.140 77.302 156.904 1.00 0.00 O ATOM 52782 H1 WAT 776 29.677 77.109 157.672 1.00 0.00 H ATOM 52783 H2 WAT 776 29.708 77.828 156.341 1.00 0.00 H TER 52785 WAT 776 ATOM 52785 O WAT 777 114.046 124.101 81.859 1.00 0.00 O ATOM 52786 H1 WAT 777 113.193 123.748 81.604 1.00 0.00 H ATOM 52787 H2 WAT 777 113.958 124.285 82.795 1.00 0.00 H TER 52789 WAT 777 ATOM 52789 O WAT 778 121.907 43.735 112.226 1.00 0.00 O ATOM 52790 H1 WAT 778 122.454 43.085 112.667 1.00 0.00 H ATOM 52791 H2 WAT 778 121.066 43.296 112.101 1.00 0.00 H TER 52793 WAT 778 ATOM 52793 O WAT 779 81.495 1.545 120.721 1.00 0.00 O ATOM 52794 H1 WAT 779 81.627 2.415 120.344 1.00 0.00 H ATOM 52795 H2 WAT 779 81.021 1.060 120.045 1.00 0.00 H TER 52797 WAT 779 ATOM 52797 O WAT 780 37.082 138.147 83.479 1.00 0.00 O ATOM 52798 H1 WAT 780 37.510 138.117 82.623 1.00 0.00 H ATOM 52799 H2 WAT 780 36.264 137.665 83.355 1.00 0.00 H TER 52801 WAT 780 ATOM 52801 O WAT 781 10.467 76.741 106.837 1.00 0.00 O ATOM 52802 H1 WAT 781 9.966 77.549 106.952 1.00 0.00 H ATOM 52803 H2 WAT 781 10.180 76.401 105.989 1.00 0.00 H TER 52805 WAT 781 ATOM 52805 O WAT 782 71.032 2.048 126.294 1.00 0.00 O ATOM 52806 H1 WAT 782 70.552 1.222 126.360 1.00 0.00 H ATOM 52807 H2 WAT 782 71.925 1.788 126.069 1.00 0.00 H TER 52809 WAT 782 ATOM 52809 O WAT 783 30.980 44.276 110.794 1.00 0.00 O ATOM 52810 H1 WAT 783 30.347 43.880 110.195 1.00 0.00 H ATOM 52811 H2 WAT 783 30.462 44.886 111.320 1.00 0.00 H TER 52813 WAT 783 ATOM 52813 O WAT 784 109.068 46.100 14.108 1.00 0.00 O ATOM 52814 H1 WAT 784 109.124 45.441 13.417 1.00 0.00 H ATOM 52815 H2 WAT 784 109.133 46.937 13.648 1.00 0.00 H TER 52817 WAT 784 ATOM 52817 O WAT 785 53.692 128.986 71.080 1.00 0.00 O ATOM 52818 H1 WAT 785 53.912 129.912 71.180 1.00 0.00 H ATOM 52819 H2 WAT 785 53.051 128.816 71.770 1.00 0.00 H TER 52821 WAT 785 ATOM 52821 O WAT 786 73.136 26.023 105.343 1.00 0.00 O ATOM 52822 H1 WAT 786 73.916 26.201 104.817 1.00 0.00 H ATOM 52823 H2 WAT 786 73.461 25.967 106.242 1.00 0.00 H TER 52825 WAT 786 ATOM 52825 O WAT 787 111.980 109.992 107.605 1.00 0.00 O ATOM 52826 H1 WAT 787 112.163 109.764 108.517 1.00 0.00 H ATOM 52827 H2 WAT 787 111.025 110.028 107.553 1.00 0.00 H TER 52829 WAT 787 ATOM 52829 O WAT 788 13.637 76.886 117.631 1.00 0.00 O ATOM 52830 H1 WAT 788 12.689 76.804 117.522 1.00 0.00 H ATOM 52831 H2 WAT 788 13.907 76.051 118.014 1.00 0.00 H TER 52833 WAT 788 ATOM 52833 O WAT 789 0.125 50.366 106.245 1.00 0.00 O ATOM 52834 H1 WAT 789 1.075 50.365 106.129 1.00 0.00 H ATOM 52835 H2 WAT 789 -0.015 49.914 107.077 1.00 0.00 H TER 52837 WAT 789 ATOM 52837 O WAT 790 86.938 48.481 1.654 1.00 0.00 O ATOM 52838 H1 WAT 790 87.608 47.999 2.140 1.00 0.00 H ATOM 52839 H2 WAT 790 86.705 49.211 2.228 1.00 0.00 H TER 52841 WAT 790 ATOM 52841 O WAT 791 73.124 124.472 144.808 1.00 0.00 O ATOM 52842 H1 WAT 791 72.507 125.009 144.311 1.00 0.00 H ATOM 52843 H2 WAT 791 73.704 124.098 144.145 1.00 0.00 H TER 52845 WAT 791 ATOM 52845 O WAT 792 131.860 80.116 116.479 1.00 0.00 O ATOM 52846 H1 WAT 792 131.365 80.539 117.182 1.00 0.00 H ATOM 52847 H2 WAT 792 132.326 79.400 116.912 1.00 0.00 H TER 52849 WAT 792 ATOM 52849 O WAT 793 26.773 37.364 108.648 1.00 0.00 O ATOM 52850 H1 WAT 793 26.316 37.051 109.429 1.00 0.00 H ATOM 52851 H2 WAT 793 27.187 38.182 108.926 1.00 0.00 H TER 52853 WAT 793 ATOM 52853 O WAT 794 72.951 66.565 97.522 1.00 0.00 O ATOM 52854 H1 WAT 794 73.046 65.622 97.387 1.00 0.00 H ATOM 52855 H2 WAT 794 72.688 66.903 96.666 1.00 0.00 H TER 52857 WAT 794 ATOM 52857 O WAT 795 126.416 17.633 20.318 1.00 0.00 O ATOM 52858 H1 WAT 795 125.824 18.384 20.272 1.00 0.00 H ATOM 52859 H2 WAT 795 126.785 17.565 19.437 1.00 0.00 H TER 52861 WAT 795 ATOM 52861 O WAT 796 39.137 111.661 124.478 1.00 0.00 O ATOM 52862 H1 WAT 796 39.572 112.415 124.876 1.00 0.00 H ATOM 52863 H2 WAT 796 38.485 111.392 125.125 1.00 0.00 H TER 52865 WAT 796 ATOM 52865 O WAT 797 102.593 89.910 80.829 1.00 0.00 O ATOM 52866 H1 WAT 797 102.700 90.726 80.340 1.00 0.00 H ATOM 52867 H2 WAT 797 103.274 89.333 80.482 1.00 0.00 H TER 52869 WAT 797 ATOM 52869 O WAT 798 113.099 15.075 73.344 1.00 0.00 O ATOM 52870 H1 WAT 798 113.319 15.954 73.654 1.00 0.00 H ATOM 52871 H2 WAT 798 113.685 14.929 72.602 1.00 0.00 H TER 52873 WAT 798 ATOM 52873 O WAT 799 22.108 123.854 78.323 1.00 0.00 O ATOM 52874 H1 WAT 799 21.450 124.391 77.882 1.00 0.00 H ATOM 52875 H2 WAT 799 22.415 124.399 79.048 1.00 0.00 H TER 52877 WAT 799 ATOM 52877 O WAT 800 55.500 101.225 125.748 1.00 0.00 O ATOM 52878 H1 WAT 800 56.198 101.822 126.019 1.00 0.00 H ATOM 52879 H2 WAT 800 55.034 101.700 125.059 1.00 0.00 H TER 52881 WAT 800 ATOM 52881 O WAT 801 114.185 38.658 117.497 1.00 0.00 O ATOM 52882 H1 WAT 801 113.638 38.663 118.283 1.00 0.00 H ATOM 52883 H2 WAT 801 114.764 37.904 117.613 1.00 0.00 H TER 52885 WAT 801 ATOM 52885 O WAT 802 30.726 80.661 122.360 1.00 0.00 O ATOM 52886 H1 WAT 802 31.099 81.197 123.059 1.00 0.00 H ATOM 52887 H2 WAT 802 30.703 81.242 121.599 1.00 0.00 H TER 52889 WAT 802 ATOM 52889 O WAT 803 105.665 58.444 59.148 1.00 0.00 O ATOM 52890 H1 WAT 803 106.413 58.397 58.552 1.00 0.00 H ATOM 52891 H2 WAT 803 105.069 59.069 58.735 1.00 0.00 H TER 52893 WAT 803 ATOM 52893 O WAT 804 128.151 62.803 134.080 1.00 0.00 O ATOM 52894 H1 WAT 804 128.814 62.119 133.986 1.00 0.00 H ATOM 52895 H2 WAT 804 128.456 63.332 134.817 1.00 0.00 H TER 52897 WAT 804 ATOM 52897 O WAT 805 67.628 89.874 21.849 1.00 0.00 O ATOM 52898 H1 WAT 805 68.305 89.966 21.179 1.00 0.00 H ATOM 52899 H2 WAT 805 67.657 88.949 22.094 1.00 0.00 H TER 52901 WAT 805 ATOM 52901 O WAT 806 2.138 125.558 150.797 1.00 0.00 O ATOM 52902 H1 WAT 806 1.510 125.589 150.075 1.00 0.00 H ATOM 52903 H2 WAT 806 2.202 124.629 151.019 1.00 0.00 H TER 52905 WAT 806 ATOM 52905 O WAT 807 99.075 126.145 1.084 1.00 0.00 O ATOM 52906 H1 WAT 807 98.364 126.399 0.496 1.00 0.00 H ATOM 52907 H2 WAT 807 99.787 125.883 0.499 1.00 0.00 H TER 52909 WAT 807 ATOM 52909 O WAT 808 68.423 140.653 59.374 1.00 0.00 O ATOM 52910 H1 WAT 808 69.234 141.145 59.248 1.00 0.00 H ATOM 52911 H2 WAT 808 67.728 141.291 59.215 1.00 0.00 H TER 52913 WAT 808 ATOM 52913 O WAT 809 122.612 99.870 143.114 1.00 0.00 O ATOM 52914 H1 WAT 809 123.260 100.272 142.535 1.00 0.00 H ATOM 52915 H2 WAT 809 122.221 100.607 143.584 1.00 0.00 H TER 52917 WAT 809 ATOM 52917 O WAT 810 52.232 100.572 24.689 1.00 0.00 O ATOM 52918 H1 WAT 810 52.064 100.103 23.872 1.00 0.00 H ATOM 52919 H2 WAT 810 52.936 101.184 24.473 1.00 0.00 H TER 52921 WAT 810 ATOM 52921 O WAT 811 36.419 140.838 84.001 1.00 0.00 O ATOM 52922 H1 WAT 811 35.769 140.765 84.700 1.00 0.00 H ATOM 52923 H2 WAT 811 36.429 139.973 83.592 1.00 0.00 H TER 52925 WAT 811 ATOM 52925 O WAT 812 99.336 91.646 120.477 1.00 0.00 O ATOM 52926 H1 WAT 812 99.276 92.413 119.907 1.00 0.00 H ATOM 52927 H2 WAT 812 98.428 91.371 120.605 1.00 0.00 H TER 52929 WAT 812 ATOM 52929 O WAT 813 133.713 87.295 4.708 1.00 0.00 O ATOM 52930 H1 WAT 813 133.499 86.427 4.365 1.00 0.00 H ATOM 52931 H2 WAT 813 133.847 87.155 5.646 1.00 0.00 H TER 52933 WAT 813 ATOM 52933 O WAT 814 100.629 117.917 147.344 1.00 0.00 O ATOM 52934 H1 WAT 814 99.826 117.436 147.541 1.00 0.00 H ATOM 52935 H2 WAT 814 100.468 118.311 146.486 1.00 0.00 H TER 52937 WAT 814 ATOM 52937 O WAT 815 99.450 28.712 117.846 1.00 0.00 O ATOM 52938 H1 WAT 815 100.010 28.181 118.412 1.00 0.00 H ATOM 52939 H2 WAT 815 99.043 28.081 117.252 1.00 0.00 H TER 52941 WAT 815 ATOM 52941 O WAT 816 110.498 22.010 100.470 1.00 0.00 O ATOM 52942 H1 WAT 816 110.742 21.243 100.988 1.00 0.00 H ATOM 52943 H2 WAT 816 111.231 22.135 99.867 1.00 0.00 H TER 52945 WAT 816 ATOM 52945 O WAT 817 16.619 101.808 71.770 1.00 0.00 O ATOM 52946 H1 WAT 817 16.790 101.740 70.830 1.00 0.00 H ATOM 52947 H2 WAT 817 17.294 102.404 72.094 1.00 0.00 H TER 52949 WAT 817 ATOM 52949 O WAT 818 0.490 84.361 101.471 1.00 0.00 O ATOM 52950 H1 WAT 818 -0.407 84.582 101.720 1.00 0.00 H ATOM 52951 H2 WAT 818 0.634 84.833 100.651 1.00 0.00 H TER 52953 WAT 818 ATOM 52953 O WAT 819 94.063 129.768 111.884 1.00 0.00 O ATOM 52954 H1 WAT 819 94.142 129.076 111.228 1.00 0.00 H ATOM 52955 H2 WAT 819 93.180 130.117 111.759 1.00 0.00 H TER 52957 WAT 819 ATOM 52957 O WAT 820 127.578 46.220 87.442 1.00 0.00 O ATOM 52958 H1 WAT 820 128.323 46.305 88.036 1.00 0.00 H ATOM 52959 H2 WAT 820 127.575 45.296 87.192 1.00 0.00 H TER 52961 WAT 820 ATOM 52961 O WAT 821 117.200 56.268 88.247 1.00 0.00 O ATOM 52962 H1 WAT 821 116.895 56.446 87.357 1.00 0.00 H ATOM 52963 H2 WAT 821 116.419 56.364 88.791 1.00 0.00 H TER 52965 WAT 821 ATOM 52965 O WAT 822 48.284 67.425 72.841 1.00 0.00 O ATOM 52966 H1 WAT 822 48.131 67.910 73.651 1.00 0.00 H ATOM 52967 H2 WAT 822 47.698 67.832 72.203 1.00 0.00 H TER 52969 WAT 822 ATOM 52969 O WAT 823 134.056 70.127 11.122 1.00 0.00 O ATOM 52970 H1 WAT 823 133.406 70.304 11.801 1.00 0.00 H ATOM 52971 H2 WAT 823 133.872 69.231 10.841 1.00 0.00 H TER 52973 WAT 823 ATOM 52973 O WAT 824 59.535 40.820 5.954 1.00 0.00 O ATOM 52974 H1 WAT 824 60.426 40.888 6.297 1.00 0.00 H ATOM 52975 H2 WAT 824 59.427 41.601 5.411 1.00 0.00 H TER 52977 WAT 824 ATOM 52977 O WAT 825 90.711 51.674 6.855 1.00 0.00 O ATOM 52978 H1 WAT 825 90.482 50.910 7.385 1.00 0.00 H ATOM 52979 H2 WAT 825 89.880 52.128 6.718 1.00 0.00 H TER 52981 WAT 825 ATOM 52981 O WAT 826 132.498 51.448 140.185 1.00 0.00 O ATOM 52982 H1 WAT 826 132.997 51.463 139.368 1.00 0.00 H ATOM 52983 H2 WAT 826 132.055 50.599 140.179 1.00 0.00 H TER 52985 WAT 826 ATOM 52985 O WAT 827 118.557 64.852 89.196 1.00 0.00 O ATOM 52986 H1 WAT 827 119.505 64.876 89.330 1.00 0.00 H ATOM 52987 H2 WAT 827 118.200 64.615 90.051 1.00 0.00 H TER 52989 WAT 827 ATOM 52989 O WAT 828 7.745 81.626 9.888 1.00 0.00 O ATOM 52990 H1 WAT 828 8.699 81.656 9.816 1.00 0.00 H ATOM 52991 H2 WAT 828 7.461 81.142 9.112 1.00 0.00 H TER 52993 WAT 828 ATOM 52993 O WAT 829 113.415 41.272 154.392 1.00 0.00 O ATOM 52994 H1 WAT 829 113.379 40.396 154.776 1.00 0.00 H ATOM 52995 H2 WAT 829 113.931 41.785 155.015 1.00 0.00 H TER 52997 WAT 829 ATOM 52997 O WAT 830 49.694 27.893 136.112 1.00 0.00 O ATOM 52998 H1 WAT 830 49.928 28.558 135.464 1.00 0.00 H ATOM 52999 H2 WAT 830 49.620 28.376 136.934 1.00 0.00 H TER 53001 WAT 830 ATOM 53001 O WAT 831 32.239 61.734 67.300 1.00 0.00 O ATOM 53002 H1 WAT 831 32.548 61.824 66.399 1.00 0.00 H ATOM 53003 H2 WAT 831 32.915 61.213 67.734 1.00 0.00 H TER 53005 WAT 831 ATOM 53005 O WAT 832 56.879 51.433 85.633 1.00 0.00 O ATOM 53006 H1 WAT 832 57.780 51.249 85.366 1.00 0.00 H ATOM 53007 H2 WAT 832 56.372 51.374 84.824 1.00 0.00 H TER 53009 WAT 832 ATOM 53009 O WAT 833 91.243 61.861 126.183 1.00 0.00 O ATOM 53010 H1 WAT 833 90.813 61.010 126.272 1.00 0.00 H ATOM 53011 H2 WAT 833 91.499 62.095 127.075 1.00 0.00 H TER 53013 WAT 833 ATOM 53013 O WAT 834 49.306 8.322 80.170 1.00 0.00 O ATOM 53014 H1 WAT 834 49.015 7.502 79.771 1.00 0.00 H ATOM 53015 H2 WAT 834 48.497 8.774 80.407 1.00 0.00 H TER 53017 WAT 834 ATOM 53017 O WAT 835 27.621 108.141 139.303 1.00 0.00 O ATOM 53018 H1 WAT 835 27.966 107.321 138.950 1.00 0.00 H ATOM 53019 H2 WAT 835 28.036 108.225 140.162 1.00 0.00 H TER 53021 WAT 835 ATOM 53021 O WAT 836 121.467 94.943 157.351 1.00 0.00 O ATOM 53022 H1 WAT 836 120.892 94.484 157.964 1.00 0.00 H ATOM 53023 H2 WAT 836 120.870 95.434 156.785 1.00 0.00 H TER 53025 WAT 836 ATOM 53025 O WAT 837 64.400 37.676 150.355 1.00 0.00 O ATOM 53026 H1 WAT 837 65.049 37.262 149.786 1.00 0.00 H ATOM 53027 H2 WAT 837 63.613 37.743 149.813 1.00 0.00 H TER 53029 WAT 837 ATOM 53029 O WAT 838 131.303 95.841 146.812 1.00 0.00 O ATOM 53030 H1 WAT 838 130.798 96.554 147.203 1.00 0.00 H ATOM 53031 H2 WAT 838 132.182 96.204 146.700 1.00 0.00 H TER 53033 WAT 838 ATOM 53033 O WAT 839 11.313 89.884 100.798 1.00 0.00 O ATOM 53034 H1 WAT 839 10.807 89.081 100.672 1.00 0.00 H ATOM 53035 H2 WAT 839 11.372 89.983 101.748 1.00 0.00 H TER 53037 WAT 839 ATOM 53037 O WAT 840 61.773 13.977 94.179 1.00 0.00 O ATOM 53038 H1 WAT 840 62.134 13.581 93.386 1.00 0.00 H ATOM 53039 H2 WAT 840 61.010 13.439 94.390 1.00 0.00 H TER 53041 WAT 840 ATOM 53041 O WAT 841 17.794 79.648 90.829 1.00 0.00 O ATOM 53042 H1 WAT 841 17.333 80.309 90.313 1.00 0.00 H ATOM 53043 H2 WAT 841 17.098 79.119 91.217 1.00 0.00 H TER 53045 WAT 841 ATOM 53045 O WAT 842 99.173 52.687 65.082 1.00 0.00 O ATOM 53046 H1 WAT 842 98.754 53.089 64.320 1.00 0.00 H ATOM 53047 H2 WAT 842 99.519 53.426 65.582 1.00 0.00 H TER 53049 WAT 842 ATOM 53049 O WAT 843 47.921 44.323 158.568 1.00 0.00 O ATOM 53050 H1 WAT 843 47.309 45.041 158.728 1.00 0.00 H ATOM 53051 H2 WAT 843 47.486 43.781 157.909 1.00 0.00 H TER 53053 WAT 843 ATOM 53053 O WAT 844 77.036 74.384 150.420 1.00 0.00 O ATOM 53054 H1 WAT 844 77.344 74.994 149.749 1.00 0.00 H ATOM 53055 H2 WAT 844 76.755 73.611 149.931 1.00 0.00 H TER 53057 WAT 844 ATOM 53057 O WAT 845 50.478 74.243 133.175 1.00 0.00 O ATOM 53058 H1 WAT 845 49.879 74.714 133.755 1.00 0.00 H ATOM 53059 H2 WAT 845 51.149 74.887 132.950 1.00 0.00 H TER 53061 WAT 845 ATOM 53061 O WAT 846 143.005 106.393 122.322 1.00 0.00 O ATOM 53062 H1 WAT 846 142.764 105.666 121.748 1.00 0.00 H ATOM 53063 H2 WAT 846 142.794 106.082 123.203 1.00 0.00 H TER 53065 WAT 846 ATOM 53065 O WAT 847 39.814 69.314 83.988 1.00 0.00 O ATOM 53066 H1 WAT 847 40.220 69.257 84.853 1.00 0.00 H ATOM 53067 H2 WAT 847 39.828 70.248 83.778 1.00 0.00 H TER 53069 WAT 847 ATOM 53069 O WAT 848 81.892 126.883 89.357 1.00 0.00 O ATOM 53070 H1 WAT 848 81.918 127.840 89.346 1.00 0.00 H ATOM 53071 H2 WAT 848 81.325 126.667 90.097 1.00 0.00 H TER 53073 WAT 848 ATOM 53073 O WAT 849 14.922 124.131 132.781 1.00 0.00 O ATOM 53074 H1 WAT 849 15.747 124.491 133.106 1.00 0.00 H ATOM 53075 H2 WAT 849 14.949 123.207 133.031 1.00 0.00 H TER 53077 WAT 849 ATOM 53077 O WAT 850 33.394 37.066 16.293 1.00 0.00 O ATOM 53078 H1 WAT 850 33.597 36.917 15.369 1.00 0.00 H ATOM 53079 H2 WAT 850 32.754 37.778 16.285 1.00 0.00 H TER 53081 WAT 850 ATOM 53081 O WAT 851 22.464 39.685 76.143 1.00 0.00 O ATOM 53082 H1 WAT 851 23.156 40.048 75.591 1.00 0.00 H ATOM 53083 H2 WAT 851 21.711 39.601 75.558 1.00 0.00 H TER 53085 WAT 851 ATOM 53085 O WAT 852 61.888 7.569 108.366 1.00 0.00 O ATOM 53086 H1 WAT 852 62.720 7.555 107.894 1.00 0.00 H ATOM 53087 H2 WAT 852 61.708 6.650 108.563 1.00 0.00 H TER 53089 WAT 852 ATOM 53089 O WAT 853 15.635 31.431 13.203 1.00 0.00 O ATOM 53090 H1 WAT 853 15.594 31.368 14.157 1.00 0.00 H ATOM 53091 H2 WAT 853 16.512 31.118 12.980 1.00 0.00 H TER 53093 WAT 853 ATOM 53093 O WAT 854 0.684 76.746 87.926 1.00 0.00 O ATOM 53094 H1 WAT 854 0.020 76.855 88.607 1.00 0.00 H ATOM 53095 H2 WAT 854 1.306 76.121 88.296 1.00 0.00 H TER 53097 WAT 854 ATOM 53097 O WAT 855 11.613 45.464 116.042 1.00 0.00 O ATOM 53098 H1 WAT 855 12.262 45.367 116.739 1.00 0.00 H ATOM 53099 H2 WAT 855 11.367 44.566 115.817 1.00 0.00 H TER 53101 WAT 855 ATOM 53101 O WAT 856 42.989 138.187 118.872 1.00 0.00 O ATOM 53102 H1 WAT 856 42.748 138.347 119.784 1.00 0.00 H ATOM 53103 H2 WAT 856 43.549 138.927 118.639 1.00 0.00 H TER 53105 WAT 856 ATOM 53105 O WAT 857 14.129 92.130 82.191 1.00 0.00 O ATOM 53106 H1 WAT 857 14.998 91.764 82.356 1.00 0.00 H ATOM 53107 H2 WAT 857 13.549 91.369 82.168 1.00 0.00 H TER 53109 WAT 857 ATOM 53109 O WAT 858 13.706 65.991 86.826 1.00 0.00 O ATOM 53110 H1 WAT 858 14.534 65.731 86.422 1.00 0.00 H ATOM 53111 H2 WAT 858 13.103 66.096 86.089 1.00 0.00 H TER 53113 WAT 858 ATOM 53113 O WAT 859 132.862 89.049 7.998 1.00 0.00 O ATOM 53114 H1 WAT 859 133.301 89.646 7.391 1.00 0.00 H ATOM 53115 H2 WAT 859 133.157 89.330 8.865 1.00 0.00 H TER 53117 WAT 859 ATOM 53117 O WAT 860 119.133 23.993 105.719 1.00 0.00 O ATOM 53118 H1 WAT 860 118.242 24.096 105.384 1.00 0.00 H ATOM 53119 H2 WAT 860 119.501 24.877 105.696 1.00 0.00 H TER 53121 WAT 860 ATOM 53121 O WAT 861 86.842 8.458 95.454 1.00 0.00 O ATOM 53122 H1 WAT 861 86.237 8.946 94.896 1.00 0.00 H ATOM 53123 H2 WAT 861 87.505 9.100 95.709 1.00 0.00 H TER 53125 WAT 861 ATOM 53125 O WAT 862 1.290 122.014 148.156 1.00 0.00 O ATOM 53126 H1 WAT 862 0.430 122.409 148.013 1.00 0.00 H ATOM 53127 H2 WAT 862 1.257 121.690 149.056 1.00 0.00 H TER 53129 WAT 862 ATOM 53129 O WAT 863 114.725 5.658 97.954 1.00 0.00 O ATOM 53130 H1 WAT 863 113.881 5.613 97.506 1.00 0.00 H ATOM 53131 H2 WAT 863 114.733 4.893 98.529 1.00 0.00 H TER 53133 WAT 863 ATOM 53133 O WAT 864 129.889 97.527 121.298 1.00 0.00 O ATOM 53134 H1 WAT 864 129.805 98.015 122.118 1.00 0.00 H ATOM 53135 H2 WAT 864 129.822 98.194 120.615 1.00 0.00 H TER 53137 WAT 864 ATOM 53137 O WAT 865 128.384 108.734 7.841 1.00 0.00 O ATOM 53138 H1 WAT 865 129.265 108.608 7.491 1.00 0.00 H ATOM 53139 H2 WAT 865 127.965 109.336 7.226 1.00 0.00 H TER 53141 WAT 865 ATOM 53141 O WAT 866 39.508 85.841 73.724 1.00 0.00 O ATOM 53142 H1 WAT 866 40.123 85.445 74.341 1.00 0.00 H ATOM 53143 H2 WAT 866 38.844 86.252 74.278 1.00 0.00 H TER 53145 WAT 866 ATOM 53145 O WAT 867 8.307 51.406 86.236 1.00 0.00 O ATOM 53146 H1 WAT 867 9.119 51.593 85.765 1.00 0.00 H ATOM 53147 H2 WAT 867 8.582 50.883 86.989 1.00 0.00 H TER 53149 WAT 867 ATOM 53149 O WAT 868 78.957 104.505 56.628 1.00 0.00 O ATOM 53150 H1 WAT 868 79.436 103.771 57.014 1.00 0.00 H ATOM 53151 H2 WAT 868 79.640 105.087 56.294 1.00 0.00 H TER 53153 WAT 868 ATOM 53153 O WAT 869 77.176 104.301 16.737 1.00 0.00 O ATOM 53154 H1 WAT 869 77.055 105.246 16.645 1.00 0.00 H ATOM 53155 H2 WAT 869 77.035 104.131 17.668 1.00 0.00 H TER 53157 WAT 869 ATOM 53157 O WAT 870 123.620 3.410 92.771 1.00 0.00 O ATOM 53158 H1 WAT 870 124.100 3.448 93.598 1.00 0.00 H ATOM 53159 H2 WAT 870 122.948 2.745 92.914 1.00 0.00 H TER 53161 WAT 870 ATOM 53161 O WAT 871 126.069 33.298 119.651 1.00 0.00 O ATOM 53162 H1 WAT 871 126.550 33.996 120.094 1.00 0.00 H ATOM 53163 H2 WAT 871 125.284 33.172 120.184 1.00 0.00 H TER 53165 WAT 871 ATOM 53165 O WAT 872 90.483 5.199 62.360 1.00 0.00 O ATOM 53166 H1 WAT 872 90.466 5.492 63.271 1.00 0.00 H ATOM 53167 H2 WAT 872 89.675 5.546 61.982 1.00 0.00 H TER 53169 WAT 872 ATOM 53169 O WAT 873 23.853 103.971 70.048 1.00 0.00 O ATOM 53170 H1 WAT 873 23.902 103.353 70.778 1.00 0.00 H ATOM 53171 H2 WAT 873 23.930 103.424 69.266 1.00 0.00 H TER 53173 WAT 873 ATOM 53173 O WAT 874 100.527 123.674 75.121 1.00 0.00 O ATOM 53174 H1 WAT 874 101.245 123.597 75.749 1.00 0.00 H ATOM 53175 H2 WAT 874 99.973 122.913 75.295 1.00 0.00 H TER 53177 WAT 874 ATOM 53177 O WAT 875 21.721 45.169 130.836 1.00 0.00 O ATOM 53178 H1 WAT 875 22.542 45.334 130.373 1.00 0.00 H ATOM 53179 H2 WAT 875 21.908 44.413 131.393 1.00 0.00 H TER 53181 WAT 875 ATOM 53181 O WAT 876 63.378 113.837 117.625 1.00 0.00 O ATOM 53182 H1 WAT 876 64.125 113.263 117.793 1.00 0.00 H ATOM 53183 H2 WAT 876 63.520 114.162 116.736 1.00 0.00 H TER 53185 WAT 876 ATOM 53185 O WAT 877 53.166 92.527 4.553 1.00 0.00 O ATOM 53186 H1 WAT 877 52.329 92.264 4.934 1.00 0.00 H ATOM 53187 H2 WAT 877 52.929 93.120 3.840 1.00 0.00 H TER 53189 WAT 877 ATOM 53189 O WAT 878 86.703 114.462 30.021 1.00 0.00 O ATOM 53190 H1 WAT 878 86.616 114.021 30.865 1.00 0.00 H ATOM 53191 H2 WAT 878 87.648 114.545 29.891 1.00 0.00 H TER 53193 WAT 878 ATOM 53193 O WAT 879 83.344 76.621 107.967 1.00 0.00 O ATOM 53194 H1 WAT 879 82.747 76.190 108.579 1.00 0.00 H ATOM 53195 H2 WAT 879 84.189 76.198 108.118 1.00 0.00 H TER 53197 WAT 879 ATOM 53197 O WAT 880 135.769 135.732 129.215 1.00 0.00 O ATOM 53198 H1 WAT 880 135.802 135.479 128.292 1.00 0.00 H ATOM 53199 H2 WAT 880 134.842 135.904 129.383 1.00 0.00 H TER 53201 WAT 880 ATOM 53201 O WAT 881 116.090 100.172 6.910 1.00 0.00 O ATOM 53202 H1 WAT 881 116.731 100.025 7.606 1.00 0.00 H ATOM 53203 H2 WAT 881 116.353 99.572 6.212 1.00 0.00 H TER 53205 WAT 881 ATOM 53205 O WAT 882 46.631 111.867 11.676 1.00 0.00 O ATOM 53206 H1 WAT 882 46.768 112.085 12.598 1.00 0.00 H ATOM 53207 H2 WAT 882 47.427 112.169 11.237 1.00 0.00 H TER 53209 WAT 882 ATOM 53209 O WAT 883 137.956 38.401 89.824 1.00 0.00 O ATOM 53210 H1 WAT 883 138.009 38.300 88.874 1.00 0.00 H ATOM 53211 H2 WAT 883 138.850 38.248 90.131 1.00 0.00 H TER 53213 WAT 883 ATOM 53213 O WAT 884 130.656 69.408 4.468 1.00 0.00 O ATOM 53214 H1 WAT 884 129.819 69.290 4.018 1.00 0.00 H ATOM 53215 H2 WAT 884 130.441 69.330 5.397 1.00 0.00 H TER 53217 WAT 884 ATOM 53217 O WAT 885 11.988 85.272 145.432 1.00 0.00 O ATOM 53218 H1 WAT 885 12.764 85.510 145.939 1.00 0.00 H ATOM 53219 H2 WAT 885 12.080 85.757 144.612 1.00 0.00 H TER 53221 WAT 885 ATOM 53221 O WAT 886 75.329 114.521 100.309 1.00 0.00 O ATOM 53222 H1 WAT 886 74.392 114.328 100.338 1.00 0.00 H ATOM 53223 H2 WAT 886 75.751 113.662 100.314 1.00 0.00 H TER 53225 WAT 886 ATOM 53225 O WAT 887 101.331 58.579 64.062 1.00 0.00 O ATOM 53226 H1 WAT 887 100.716 58.550 63.329 1.00 0.00 H ATOM 53227 H2 WAT 887 102.145 58.906 63.678 1.00 0.00 H TER 53229 WAT 887 ATOM 53229 O WAT 888 86.770 130.032 81.438 1.00 0.00 O ATOM 53230 H1 WAT 888 85.826 130.176 81.375 1.00 0.00 H ATOM 53231 H2 WAT 888 87.155 130.893 81.278 1.00 0.00 H TER 53233 WAT 888 ATOM 53233 O WAT 889 39.310 42.778 125.941 1.00 0.00 O ATOM 53234 H1 WAT 889 38.383 42.968 126.089 1.00 0.00 H ATOM 53235 H2 WAT 889 39.739 43.023 126.761 1.00 0.00 H TER 53237 WAT 889 ATOM 53237 O WAT 890 45.746 69.158 126.193 1.00 0.00 O ATOM 53238 H1 WAT 890 44.869 69.381 126.505 1.00 0.00 H ATOM 53239 H2 WAT 890 46.162 68.722 126.936 1.00 0.00 H TER 53241 WAT 890 ATOM 53241 O WAT 891 23.197 20.098 9.162 1.00 0.00 O ATOM 53242 H1 WAT 891 24.142 20.227 9.080 1.00 0.00 H ATOM 53243 H2 WAT 891 23.032 19.258 8.734 1.00 0.00 H TER 53245 WAT 891 ATOM 53245 O WAT 892 6.509 35.541 62.413 1.00 0.00 O ATOM 53246 H1 WAT 892 6.270 35.490 61.488 1.00 0.00 H ATOM 53247 H2 WAT 892 6.934 34.704 62.598 1.00 0.00 H TER 53249 WAT 892 ATOM 53249 O WAT 893 6.479 46.966 137.902 1.00 0.00 O ATOM 53250 H1 WAT 893 6.007 47.449 138.580 1.00 0.00 H ATOM 53251 H2 WAT 893 7.368 46.879 138.245 1.00 0.00 H TER 53253 WAT 893 ATOM 53253 O WAT 894 55.301 79.845 148.207 1.00 0.00 O ATOM 53254 H1 WAT 894 55.585 80.700 148.530 1.00 0.00 H ATOM 53255 H2 WAT 894 55.889 79.657 147.475 1.00 0.00 H TER 53257 WAT 894 ATOM 53257 O WAT 895 86.264 106.113 139.478 1.00 0.00 O ATOM 53258 H1 WAT 895 87.135 105.964 139.847 1.00 0.00 H ATOM 53259 H2 WAT 895 85.914 105.234 139.329 1.00 0.00 H TER 53261 WAT 895 ATOM 53261 O WAT 896 109.287 38.461 66.631 1.00 0.00 O ATOM 53262 H1 WAT 896 109.303 39.401 66.815 1.00 0.00 H ATOM 53263 H2 WAT 896 108.757 38.382 65.838 1.00 0.00 H TER 53265 WAT 896 ATOM 53265 O WAT 897 110.181 2.397 95.765 1.00 0.00 O ATOM 53266 H1 WAT 897 109.642 1.986 96.441 1.00 0.00 H ATOM 53267 H2 WAT 897 109.593 3.016 95.333 1.00 0.00 H TER 53269 WAT 897 ATOM 53269 O WAT 898 19.690 20.368 101.020 1.00 0.00 O ATOM 53270 H1 WAT 898 18.978 20.920 100.697 1.00 0.00 H ATOM 53271 H2 WAT 898 20.467 20.687 100.562 1.00 0.00 H TER 53273 WAT 898 ATOM 53273 O WAT 899 80.701 55.240 116.546 1.00 0.00 O ATOM 53274 H1 WAT 899 81.216 55.237 117.353 1.00 0.00 H ATOM 53275 H2 WAT 899 80.982 54.453 116.079 1.00 0.00 H TER 53277 WAT 899 ATOM 53277 O WAT 900 20.362 89.035 111.091 1.00 0.00 O ATOM 53278 H1 WAT 900 20.585 88.727 110.212 1.00 0.00 H ATOM 53279 H2 WAT 900 20.943 89.781 111.238 1.00 0.00 H TER 53281 WAT 900 ATOM 53281 O WAT 901 86.176 9.893 15.459 1.00 0.00 O ATOM 53282 H1 WAT 901 86.413 9.166 16.035 1.00 0.00 H ATOM 53283 H2 WAT 901 87.002 10.154 15.051 1.00 0.00 H TER 53285 WAT 901 ATOM 53285 O WAT 902 39.439 141.894 63.868 1.00 0.00 O ATOM 53286 H1 WAT 902 40.233 141.478 63.530 1.00 0.00 H ATOM 53287 H2 WAT 902 38.722 141.413 63.454 1.00 0.00 H TER 53289 WAT 902 ATOM 53289 O WAT 903 92.633 81.546 66.791 1.00 0.00 O ATOM 53290 H1 WAT 903 92.512 82.417 66.414 1.00 0.00 H ATOM 53291 H2 WAT 903 92.872 80.994 66.046 1.00 0.00 H TER 53293 WAT 903 ATOM 53293 O WAT 904 121.262 107.852 1.413 1.00 0.00 O ATOM 53294 H1 WAT 904 120.869 107.065 1.035 1.00 0.00 H ATOM 53295 H2 WAT 904 122.204 107.733 1.286 1.00 0.00 H TER 53297 WAT 904 ATOM 53297 O WAT 905 93.840 16.599 74.327 1.00 0.00 O ATOM 53298 H1 WAT 905 93.270 15.899 74.007 1.00 0.00 H ATOM 53299 H2 WAT 905 94.374 16.183 75.003 1.00 0.00 H TER 53301 WAT 905 ATOM 53301 O WAT 906 36.241 25.289 135.352 1.00 0.00 O ATOM 53302 H1 WAT 906 35.804 24.444 135.455 1.00 0.00 H ATOM 53303 H2 WAT 906 36.710 25.216 134.521 1.00 0.00 H TER 53305 WAT 906 ATOM 53305 O WAT 907 37.548 76.441 105.079 1.00 0.00 O ATOM 53306 H1 WAT 907 37.964 75.807 105.663 1.00 0.00 H ATOM 53307 H2 WAT 907 36.873 75.939 104.623 1.00 0.00 H TER 53309 WAT 907 ATOM 53309 O WAT 908 76.406 62.805 2.152 1.00 0.00 O ATOM 53310 H1 WAT 908 75.700 62.477 1.594 1.00 0.00 H ATOM 53311 H2 WAT 908 77.110 62.165 2.048 1.00 0.00 H TER 53313 WAT 908 ATOM 53313 O WAT 909 14.556 10.122 127.703 1.00 0.00 O ATOM 53314 H1 WAT 909 14.786 11.019 127.461 1.00 0.00 H ATOM 53315 H2 WAT 909 13.741 10.208 128.196 1.00 0.00 H TER 53317 WAT 909 ATOM 53317 O WAT 910 101.157 48.261 120.307 1.00 0.00 O ATOM 53318 H1 WAT 910 101.567 49.116 120.436 1.00 0.00 H ATOM 53319 H2 WAT 910 100.655 48.112 121.108 1.00 0.00 H TER 53321 WAT 910 ATOM 53321 O WAT 911 0.225 76.997 18.226 1.00 0.00 O ATOM 53322 H1 WAT 911 0.394 77.903 18.484 1.00 0.00 H ATOM 53323 H2 WAT 911 0.097 76.532 19.053 1.00 0.00 H TER 53325 WAT 911 ATOM 53325 O WAT 912 129.863 81.211 91.718 1.00 0.00 O ATOM 53326 H1 WAT 912 130.513 81.727 91.240 1.00 0.00 H ATOM 53327 H2 WAT 912 129.028 81.636 91.522 1.00 0.00 H TER 53329 WAT 912 ATOM 53329 O WAT 913 99.447 59.335 137.885 1.00 0.00 O ATOM 53330 H1 WAT 913 99.109 58.869 137.121 1.00 0.00 H ATOM 53331 H2 WAT 913 99.527 60.244 137.596 1.00 0.00 H TER 53333 WAT 913 ATOM 53333 O WAT 914 107.796 109.395 152.483 1.00 0.00 O ATOM 53334 H1 WAT 914 108.572 109.945 152.591 1.00 0.00 H ATOM 53335 H2 WAT 914 107.138 109.981 152.109 1.00 0.00 H TER 53337 WAT 914 ATOM 53337 O WAT 915 111.509 81.004 153.898 1.00 0.00 O ATOM 53338 H1 WAT 915 111.319 80.283 153.298 1.00 0.00 H ATOM 53339 H2 WAT 915 112.464 81.067 153.902 1.00 0.00 H TER 53341 WAT 915 ATOM 53341 O WAT 916 59.356 72.235 72.537 1.00 0.00 O ATOM 53342 H1 WAT 916 59.463 71.787 73.376 1.00 0.00 H ATOM 53343 H2 WAT 916 58.815 71.642 72.016 1.00 0.00 H TER 53345 WAT 916 ATOM 53345 O WAT 917 45.273 21.992 132.218 1.00 0.00 O ATOM 53346 H1 WAT 917 44.432 21.622 132.484 1.00 0.00 H ATOM 53347 H2 WAT 917 45.451 22.673 132.867 1.00 0.00 H TER 53349 WAT 917 ATOM 53349 O WAT 918 7.742 8.759 3.694 1.00 0.00 O ATOM 53350 H1 WAT 918 7.113 8.467 4.353 1.00 0.00 H ATOM 53351 H2 WAT 918 7.498 9.667 3.516 1.00 0.00 H TER 53353 WAT 918 ATOM 53353 O WAT 919 61.231 135.537 55.874 1.00 0.00 O ATOM 53354 H1 WAT 919 61.756 135.498 55.074 1.00 0.00 H ATOM 53355 H2 WAT 919 60.541 136.171 55.678 1.00 0.00 H TER 53357 WAT 919 ATOM 53357 O WAT 920 44.649 105.097 20.651 1.00 0.00 O ATOM 53358 H1 WAT 920 45.186 105.289 21.419 1.00 0.00 H ATOM 53359 H2 WAT 920 44.459 105.955 20.271 1.00 0.00 H TER 53361 WAT 920 ATOM 53361 O WAT 921 82.031 81.660 129.782 1.00 0.00 O ATOM 53362 H1 WAT 921 81.529 82.197 129.170 1.00 0.00 H ATOM 53363 H2 WAT 921 81.386 81.067 130.166 1.00 0.00 H TER 53365 WAT 921 ATOM 53365 O WAT 922 18.603 139.406 82.663 1.00 0.00 O ATOM 53366 H1 WAT 922 18.708 140.268 83.065 1.00 0.00 H ATOM 53367 H2 WAT 922 19.412 138.942 82.877 1.00 0.00 H TER 53369 WAT 922 ATOM 53369 O WAT 923 49.695 121.624 8.419 1.00 0.00 O ATOM 53370 H1 WAT 923 48.938 121.076 8.210 1.00 0.00 H ATOM 53371 H2 WAT 923 49.991 121.957 7.572 1.00 0.00 H TER 53373 WAT 923 ATOM 53373 O WAT 924 16.860 38.822 22.703 1.00 0.00 O ATOM 53374 H1 WAT 924 17.621 39.401 22.748 1.00 0.00 H ATOM 53375 H2 WAT 924 16.968 38.348 21.878 1.00 0.00 H TER 53377 WAT 924 ATOM 53377 O WAT 925 12.610 35.450 135.112 1.00 0.00 O ATOM 53378 H1 WAT 925 11.708 35.134 135.161 1.00 0.00 H ATOM 53379 H2 WAT 925 13.096 34.881 135.708 1.00 0.00 H TER 53381 WAT 925 ATOM 53381 O WAT 926 108.713 77.106 134.531 1.00 0.00 O ATOM 53382 H1 WAT 926 108.841 77.018 135.475 1.00 0.00 H ATOM 53383 H2 WAT 926 108.230 76.319 134.279 1.00 0.00 H TER 53385 WAT 926 ATOM 53385 O WAT 927 114.112 132.983 86.195 1.00 0.00 O ATOM 53386 H1 WAT 927 113.614 132.396 86.764 1.00 0.00 H ATOM 53387 H2 WAT 927 114.930 132.516 86.026 1.00 0.00 H TER 53389 WAT 927 ATOM 53389 O WAT 928 138.929 142.547 131.296 1.00 0.00 O ATOM 53390 H1 WAT 928 138.822 143.370 130.820 1.00 0.00 H ATOM 53391 H2 WAT 928 138.257 142.576 131.978 1.00 0.00 H TER 53393 WAT 928 ATOM 53393 O WAT 929 50.367 122.230 105.729 1.00 0.00 O ATOM 53394 H1 WAT 929 50.133 123.154 105.636 1.00 0.00 H ATOM 53395 H2 WAT 929 51.306 122.239 105.917 1.00 0.00 H TER 53397 WAT 929 ATOM 53397 O WAT 930 123.729 97.610 139.998 1.00 0.00 O ATOM 53398 H1 WAT 930 124.061 98.073 139.228 1.00 0.00 H ATOM 53399 H2 WAT 930 123.923 96.689 139.825 1.00 0.00 H TER 53401 WAT 930 ATOM 53401 O WAT 931 111.647 48.002 149.125 1.00 0.00 O ATOM 53402 H1 WAT 931 112.319 48.358 148.544 1.00 0.00 H ATOM 53403 H2 WAT 931 111.612 47.070 148.909 1.00 0.00 H TER 53405 WAT 931 ATOM 53405 O WAT 932 101.833 27.602 116.229 1.00 0.00 O ATOM 53406 H1 WAT 932 102.193 28.427 115.903 1.00 0.00 H ATOM 53407 H2 WAT 932 101.633 27.099 115.439 1.00 0.00 H TER 53409 WAT 932 ATOM 53409 O WAT 933 133.122 122.914 16.994 1.00 0.00 O ATOM 53410 H1 WAT 933 133.140 123.100 16.055 1.00 0.00 H ATOM 53411 H2 WAT 933 132.286 122.469 17.133 1.00 0.00 H TER 53413 WAT 933 ATOM 53413 O WAT 934 109.486 3.909 16.879 1.00 0.00 O ATOM 53414 H1 WAT 934 109.666 4.777 16.519 1.00 0.00 H ATOM 53415 H2 WAT 934 109.736 3.975 17.801 1.00 0.00 H TER 53417 WAT 934 ATOM 53417 O WAT 935 77.018 124.581 84.894 1.00 0.00 O ATOM 53418 H1 WAT 935 77.914 124.298 85.076 1.00 0.00 H ATOM 53419 H2 WAT 935 76.716 124.964 85.717 1.00 0.00 H TER 53421 WAT 935 ATOM 53421 O WAT 936 101.058 111.274 118.579 1.00 0.00 O ATOM 53422 H1 WAT 936 101.751 110.827 118.092 1.00 0.00 H ATOM 53423 H2 WAT 936 100.418 110.589 118.770 1.00 0.00 H TER 53425 WAT 936 ATOM 53425 O WAT 937 80.494 74.473 131.713 1.00 0.00 O ATOM 53426 H1 WAT 937 79.910 75.158 132.037 1.00 0.00 H ATOM 53427 H2 WAT 937 80.812 74.807 130.874 1.00 0.00 H TER 53429 WAT 937 ATOM 53429 O WAT 938 138.596 58.161 71.828 1.00 0.00 O ATOM 53430 H1 WAT 938 137.657 58.129 72.012 1.00 0.00 H ATOM 53431 H2 WAT 938 138.713 57.581 71.076 1.00 0.00 H TER 53433 WAT 938 ATOM 53433 O WAT 939 54.942 29.482 11.096 1.00 0.00 O ATOM 53434 H1 WAT 939 55.830 29.436 10.743 1.00 0.00 H ATOM 53435 H2 WAT 939 55.032 29.983 11.907 1.00 0.00 H TER 53437 WAT 939 ATOM 53437 O WAT 940 109.864 58.198 88.874 1.00 0.00 O ATOM 53438 H1 WAT 940 110.759 58.260 89.206 1.00 0.00 H ATOM 53439 H2 WAT 940 109.343 58.713 89.490 1.00 0.00 H TER 53441 WAT 940 ATOM 53441 O WAT 941 0.327 55.723 143.701 1.00 0.00 O ATOM 53442 H1 WAT 941 -0.080 55.235 144.417 1.00 0.00 H ATOM 53443 H2 WAT 941 0.077 56.633 143.859 1.00 0.00 H TER 53445 WAT 941 ATOM 53445 O WAT 942 68.928 123.674 1.999 1.00 0.00 O ATOM 53446 H1 WAT 942 69.054 123.018 2.684 1.00 0.00 H ATOM 53447 H2 WAT 942 68.377 123.239 1.348 1.00 0.00 H TER 53449 WAT 942 ATOM 53449 O WAT 943 36.079 33.866 20.764 1.00 0.00 O ATOM 53450 H1 WAT 943 35.869 34.777 20.560 1.00 0.00 H ATOM 53451 H2 WAT 943 36.302 33.476 19.919 1.00 0.00 H TER 53453 WAT 943 ATOM 53453 O WAT 944 13.287 14.457 145.213 1.00 0.00 O ATOM 53454 H1 WAT 944 13.070 14.487 146.145 1.00 0.00 H ATOM 53455 H2 WAT 944 13.044 13.573 144.939 1.00 0.00 H TER 53457 WAT 944 ATOM 53457 O WAT 945 87.435 92.896 29.362 1.00 0.00 O ATOM 53458 H1 WAT 945 86.514 93.157 29.336 1.00 0.00 H ATOM 53459 H2 WAT 945 87.412 91.941 29.418 1.00 0.00 H TER 53461 WAT 945 ATOM 53461 O WAT 946 130.188 119.719 85.845 1.00 0.00 O ATOM 53462 H1 WAT 946 130.539 119.419 86.683 1.00 0.00 H ATOM 53463 H2 WAT 946 130.591 119.142 85.196 1.00 0.00 H TER 53465 WAT 946 ATOM 53465 O WAT 947 46.702 47.078 145.505 1.00 0.00 O ATOM 53466 H1 WAT 947 45.950 47.598 145.221 1.00 0.00 H ATOM 53467 H2 WAT 947 46.888 46.502 144.763 1.00 0.00 H TER 53469 WAT 947 ATOM 53469 O WAT 948 125.694 26.481 3.542 1.00 0.00 O ATOM 53470 H1 WAT 948 125.392 27.389 3.500 1.00 0.00 H ATOM 53471 H2 WAT 948 126.648 26.549 3.593 1.00 0.00 H TER 53473 WAT 948 ATOM 53473 O WAT 949 137.031 133.474 85.695 1.00 0.00 O ATOM 53474 H1 WAT 949 136.094 133.321 85.817 1.00 0.00 H ATOM 53475 H2 WAT 949 137.205 133.192 84.797 1.00 0.00 H TER 53477 WAT 949 ATOM 53477 O WAT 950 121.072 101.933 108.415 1.00 0.00 O ATOM 53478 H1 WAT 950 120.715 102.818 108.347 1.00 0.00 H ATOM 53479 H2 WAT 950 121.613 101.831 107.632 1.00 0.00 H TER 53481 WAT 950 ATOM 53481 O WAT 951 116.339 109.101 17.926 1.00 0.00 O ATOM 53482 H1 WAT 951 117.065 108.498 18.082 1.00 0.00 H ATOM 53483 H2 WAT 951 115.645 108.552 17.562 1.00 0.00 H TER 53485 WAT 951 ATOM 53485 O WAT 952 23.439 109.382 115.847 1.00 0.00 O ATOM 53486 H1 WAT 952 23.924 109.280 115.027 1.00 0.00 H ATOM 53487 H2 WAT 952 24.026 109.032 116.517 1.00 0.00 H TER 53489 WAT 952 ATOM 53489 O WAT 953 130.965 4.192 154.024 1.00 0.00 O ATOM 53490 H1 WAT 953 130.835 4.513 154.916 1.00 0.00 H ATOM 53491 H2 WAT 953 131.745 3.640 154.079 1.00 0.00 H TER 53493 WAT 953 ATOM 53493 O WAT 954 2.840 101.774 115.287 1.00 0.00 O ATOM 53494 H1 WAT 954 3.573 101.973 115.869 1.00 0.00 H ATOM 53495 H2 WAT 954 2.067 102.078 115.763 1.00 0.00 H TER 53497 WAT 954 ATOM 53497 O WAT 955 33.105 24.059 69.517 1.00 0.00 O ATOM 53498 H1 WAT 955 33.266 23.362 68.881 1.00 0.00 H ATOM 53499 H2 WAT 955 32.178 24.272 69.410 1.00 0.00 H TER 53501 WAT 955 ATOM 53501 O WAT 956 130.002 128.004 131.309 1.00 0.00 O ATOM 53502 H1 WAT 956 130.855 127.590 131.180 1.00 0.00 H ATOM 53503 H2 WAT 956 129.455 127.650 130.607 1.00 0.00 H TER 53505 WAT 956 ATOM 53505 O WAT 957 105.153 14.611 96.568 1.00 0.00 O ATOM 53506 H1 WAT 957 105.017 15.225 95.846 1.00 0.00 H ATOM 53507 H2 WAT 957 104.589 13.867 96.358 1.00 0.00 H TER 53509 WAT 957 ATOM 53509 O WAT 958 99.980 37.853 130.092 1.00 0.00 O ATOM 53510 H1 WAT 958 99.526 37.045 130.330 1.00 0.00 H ATOM 53511 H2 WAT 958 99.311 38.534 130.162 1.00 0.00 H TER 53513 WAT 958 ATOM 53513 O WAT 959 84.822 122.929 57.888 1.00 0.00 O ATOM 53514 H1 WAT 959 84.294 123.454 57.286 1.00 0.00 H ATOM 53515 H2 WAT 959 84.271 122.173 58.091 1.00 0.00 H TER 53517 WAT 959 ATOM 53517 O WAT 960 14.426 143.459 103.337 1.00 0.00 O ATOM 53518 H1 WAT 960 13.697 143.965 102.978 1.00 0.00 H ATOM 53519 H2 WAT 960 14.104 143.142 104.181 1.00 0.00 H TER 53521 WAT 960 ATOM 53521 O WAT 961 143.175 0.426 101.917 1.00 0.00 O ATOM 53522 H1 WAT 961 142.913 -0.107 101.166 1.00 0.00 H ATOM 53523 H2 WAT 961 144.123 0.304 101.978 1.00 0.00 H TER 53525 WAT 961 ATOM 53525 O WAT 962 49.347 97.461 98.346 1.00 0.00 O ATOM 53526 H1 WAT 962 49.875 98.245 98.196 1.00 0.00 H ATOM 53527 H2 WAT 962 48.980 97.583 99.222 1.00 0.00 H TER 53529 WAT 962 ATOM 53529 O WAT 963 130.521 103.046 114.272 1.00 0.00 O ATOM 53530 H1 WAT 963 129.683 103.252 113.858 1.00 0.00 H ATOM 53531 H2 WAT 963 131.033 103.851 114.191 1.00 0.00 H TER 53533 WAT 963 ATOM 53533 O WAT 964 116.979 48.258 93.009 1.00 0.00 O ATOM 53534 H1 WAT 964 116.715 47.704 92.274 1.00 0.00 H ATOM 53535 H2 WAT 964 117.618 47.730 93.489 1.00 0.00 H TER 53537 WAT 964 ATOM 53537 O WAT 965 145.060 122.656 153.928 1.00 0.00 O ATOM 53538 H1 WAT 965 145.394 123.422 154.395 1.00 0.00 H ATOM 53539 H2 WAT 965 145.844 122.194 153.632 1.00 0.00 H TER 53541 WAT 965 ATOM 53541 O WAT 966 26.430 25.700 138.812 1.00 0.00 O ATOM 53542 H1 WAT 966 25.679 25.598 138.226 1.00 0.00 H ATOM 53543 H2 WAT 966 26.426 24.906 139.346 1.00 0.00 H TER 53545 WAT 966 ATOM 53545 O WAT 967 56.612 76.324 21.951 1.00 0.00 O ATOM 53546 H1 WAT 967 57.278 75.765 22.352 1.00 0.00 H ATOM 53547 H2 WAT 967 56.130 75.740 21.366 1.00 0.00 H TER 53549 WAT 967 ATOM 53549 O WAT 968 99.778 2.263 92.709 1.00 0.00 O ATOM 53550 H1 WAT 968 99.713 1.308 92.726 1.00 0.00 H ATOM 53551 H2 WAT 968 99.490 2.508 91.830 1.00 0.00 H TER 53553 WAT 968 ATOM 53553 O WAT 969 105.691 15.185 90.878 1.00 0.00 O ATOM 53554 H1 WAT 969 105.408 14.480 90.296 1.00 0.00 H ATOM 53555 H2 WAT 969 105.934 15.900 90.290 1.00 0.00 H TER 53557 WAT 969 ATOM 53557 O WAT 970 64.255 21.145 137.858 1.00 0.00 O ATOM 53558 H1 WAT 970 65.057 20.623 137.826 1.00 0.00 H ATOM 53559 H2 WAT 970 63.716 20.714 138.521 1.00 0.00 H TER 53561 WAT 970 ATOM 53561 O WAT 971 29.270 18.001 85.779 1.00 0.00 O ATOM 53562 H1 WAT 971 28.580 18.096 86.436 1.00 0.00 H ATOM 53563 H2 WAT 971 28.804 17.990 84.943 1.00 0.00 H TER 53565 WAT 971 ATOM 53565 O WAT 972 33.723 107.741 4.400 1.00 0.00 O ATOM 53566 H1 WAT 972 34.436 108.355 4.223 1.00 0.00 H ATOM 53567 H2 WAT 972 34.156 106.971 4.768 1.00 0.00 H TER 53569 WAT 972 ATOM 53569 O WAT 973 97.711 141.196 110.808 1.00 0.00 O ATOM 53570 H1 WAT 973 97.385 140.422 110.348 1.00 0.00 H ATOM 53571 H2 WAT 973 97.107 141.311 111.541 1.00 0.00 H TER 53573 WAT 973 ATOM 53573 O WAT 974 37.747 97.268 75.652 1.00 0.00 O ATOM 53574 H1 WAT 974 37.931 96.509 75.098 1.00 0.00 H ATOM 53575 H2 WAT 974 37.683 98.001 75.040 1.00 0.00 H TER 53577 WAT 974 ATOM 53577 O WAT 975 131.420 67.180 127.328 1.00 0.00 O ATOM 53578 H1 WAT 975 132.262 67.030 127.758 1.00 0.00 H ATOM 53579 H2 WAT 975 131.018 67.890 127.828 1.00 0.00 H TER 53581 WAT 975 ATOM 53581 O WAT 976 48.068 108.398 92.347 1.00 0.00 O ATOM 53582 H1 WAT 976 47.616 109.140 91.946 1.00 0.00 H ATOM 53583 H2 WAT 976 47.366 107.844 92.687 1.00 0.00 H TER 53585 WAT 976 ATOM 53585 O WAT 977 122.864 101.806 59.824 1.00 0.00 O ATOM 53586 H1 WAT 977 122.999 102.058 60.738 1.00 0.00 H ATOM 53587 H2 WAT 977 122.909 100.850 59.830 1.00 0.00 H TER 53589 WAT 977 ATOM 53589 O WAT 978 13.339 78.245 150.723 1.00 0.00 O ATOM 53590 H1 WAT 978 12.724 78.883 151.086 1.00 0.00 H ATOM 53591 H2 WAT 978 14.189 78.503 151.078 1.00 0.00 H TER 53593 WAT 978 ATOM 53593 O WAT 979 1.250 97.010 80.203 1.00 0.00 O ATOM 53594 H1 WAT 979 0.925 97.121 81.097 1.00 0.00 H ATOM 53595 H2 WAT 979 1.216 97.889 79.825 1.00 0.00 H TER 53597 WAT 979 ATOM 53597 O WAT 980 94.400 87.998 114.283 1.00 0.00 O ATOM 53598 H1 WAT 980 93.824 87.376 113.840 1.00 0.00 H ATOM 53599 H2 WAT 980 94.217 88.837 113.861 1.00 0.00 H TER 53601 WAT 980 ATOM 53601 O WAT 981 138.800 22.392 128.511 1.00 0.00 O ATOM 53602 H1 WAT 981 138.248 22.658 129.246 1.00 0.00 H ATOM 53603 H2 WAT 981 139.559 22.974 128.558 1.00 0.00 H TER 53605 WAT 981 ATOM 53605 O WAT 982 85.383 94.744 115.622 1.00 0.00 O ATOM 53606 H1 WAT 982 85.798 94.046 115.116 1.00 0.00 H ATOM 53607 H2 WAT 982 85.690 95.553 115.211 1.00 0.00 H TER 53609 WAT 982 ATOM 53609 O WAT 983 100.618 120.486 69.810 1.00 0.00 O ATOM 53610 H1 WAT 983 101.136 120.488 69.005 1.00 0.00 H ATOM 53611 H2 WAT 983 100.566 121.407 70.065 1.00 0.00 H TER 53613 WAT 983 ATOM 53613 O WAT 984 39.006 110.396 140.124 1.00 0.00 O ATOM 53614 H1 WAT 984 38.197 110.124 139.692 1.00 0.00 H ATOM 53615 H2 WAT 984 39.079 111.331 139.929 1.00 0.00 H TER 53617 WAT 984 ATOM 53617 O WAT 985 120.895 102.053 17.447 1.00 0.00 O ATOM 53618 H1 WAT 985 121.603 101.723 18.001 1.00 0.00 H ATOM 53619 H2 WAT 985 120.571 102.826 17.908 1.00 0.00 H TER 53621 WAT 985 ATOM 53621 O WAT 986 66.922 6.576 152.025 1.00 0.00 O ATOM 53622 H1 WAT 986 66.956 7.508 151.810 1.00 0.00 H ATOM 53623 H2 WAT 986 66.207 6.232 151.489 1.00 0.00 H TER 53625 WAT 986 ATOM 53625 O WAT 987 78.273 8.006 116.805 1.00 0.00 O ATOM 53626 H1 WAT 987 78.344 8.001 117.760 1.00 0.00 H ATOM 53627 H2 WAT 987 78.418 7.096 116.549 1.00 0.00 H TER 53629 WAT 987 ATOM 53629 O WAT 988 130.642 49.691 19.848 1.00 0.00 O ATOM 53630 H1 WAT 988 130.905 50.391 19.251 1.00 0.00 H ATOM 53631 H2 WAT 988 129.689 49.768 19.902 1.00 0.00 H TER 53633 WAT 988 ATOM 53633 O WAT 989 146.128 141.020 102.105 1.00 0.00 O ATOM 53634 H1 WAT 989 146.168 140.531 101.283 1.00 0.00 H ATOM 53635 H2 WAT 989 145.193 141.154 102.258 1.00 0.00 H TER 53637 WAT 989 ATOM 53637 O WAT 990 76.422 113.089 116.041 1.00 0.00 O ATOM 53638 H1 WAT 990 76.695 113.667 116.753 1.00 0.00 H ATOM 53639 H2 WAT 990 75.687 113.545 115.631 1.00 0.00 H TER 53641 WAT 990 ATOM 53641 O WAT 991 84.227 120.986 99.790 1.00 0.00 O ATOM 53642 H1 WAT 991 83.943 121.242 98.912 1.00 0.00 H ATOM 53643 H2 WAT 991 85.181 121.065 99.765 1.00 0.00 H TER 53645 WAT 991 ATOM 53645 O WAT 992 119.661 94.214 112.390 1.00 0.00 O ATOM 53646 H1 WAT 992 118.825 93.891 112.055 1.00 0.00 H ATOM 53647 H2 WAT 992 120.308 93.907 111.754 1.00 0.00 H TER 53649 WAT 992 ATOM 53649 O WAT 993 71.035 69.177 141.027 1.00 0.00 O ATOM 53650 H1 WAT 993 71.325 70.066 141.232 1.00 0.00 H ATOM 53651 H2 WAT 993 71.049 68.721 141.868 1.00 0.00 H TER 53653 WAT 993 ATOM 53653 O WAT 994 82.223 34.491 79.150 1.00 0.00 O ATOM 53654 H1 WAT 994 81.478 34.183 79.665 1.00 0.00 H ATOM 53655 H2 WAT 994 81.992 34.283 78.245 1.00 0.00 H TER 53657 WAT 994 ATOM 53657 O WAT 995 132.228 105.300 134.403 1.00 0.00 O ATOM 53658 H1 WAT 995 131.950 106.199 134.223 1.00 0.00 H ATOM 53659 H2 WAT 995 133.184 105.334 134.372 1.00 0.00 H TER 53661 WAT 995 ATOM 53661 O WAT 996 133.732 77.382 9.840 1.00 0.00 O ATOM 53662 H1 WAT 996 134.253 76.700 9.417 1.00 0.00 H ATOM 53663 H2 WAT 996 134.002 77.355 10.758 1.00 0.00 H TER 53665 WAT 996 ATOM 53665 O WAT 997 29.266 11.181 85.514 1.00 0.00 O ATOM 53666 H1 WAT 997 29.940 10.599 85.864 1.00 0.00 H ATOM 53667 H2 WAT 997 28.908 10.709 84.762 1.00 0.00 H TER 53669 WAT 997 ATOM 53669 O WAT 998 15.106 126.401 70.551 1.00 0.00 O ATOM 53670 H1 WAT 998 15.621 126.853 69.882 1.00 0.00 H ATOM 53671 H2 WAT 998 14.384 127.000 70.742 1.00 0.00 H TER 53673 WAT 998 ATOM 53673 O WAT 999 145.386 32.042 153.505 1.00 0.00 O ATOM 53674 H1 WAT 999 145.226 32.596 154.269 1.00 0.00 H ATOM 53675 H2 WAT 999 144.977 31.206 153.724 1.00 0.00 H TER 53677 WAT 999 ATOM 53677 O WAT 1000 4.396 117.812 99.876 1.00 0.00 O ATOM 53678 H1 WAT 1000 4.711 118.469 100.497 1.00 0.00 H ATOM 53679 H2 WAT 1000 3.642 118.223 99.454 1.00 0.00 H TER 53681 WAT 1000 ATOM 53681 O WAT 1001 128.018 25.520 105.587 1.00 0.00 O ATOM 53682 H1 WAT 1001 128.069 26.081 106.361 1.00 0.00 H ATOM 53683 H2 WAT 1001 127.091 25.524 105.349 1.00 0.00 H TER 53685 WAT 1001 ATOM 53685 O WAT 1002 17.575 80.194 70.388 1.00 0.00 O ATOM 53686 H1 WAT 1002 17.552 81.015 70.879 1.00 0.00 H ATOM 53687 H2 WAT 1002 16.780 80.210 69.856 1.00 0.00 H TER 53689 WAT 1002 ATOM 53689 O WAT 1003 86.951 133.623 127.437 1.00 0.00 O ATOM 53690 H1 WAT 1003 86.942 134.175 128.219 1.00 0.00 H ATOM 53691 H2 WAT 1003 86.215 133.023 127.559 1.00 0.00 H TER 53693 WAT 1003 ATOM 53693 O WAT 1004 129.913 98.578 136.470 1.00 0.00 O ATOM 53694 H1 WAT 1004 129.190 99.059 136.874 1.00 0.00 H ATOM 53695 H2 WAT 1004 130.203 99.142 135.753 1.00 0.00 H TER 53697 WAT 1004 ATOM 53697 O WAT 1005 140.509 75.581 158.484 1.00 0.00 O ATOM 53698 H1 WAT 1005 140.066 76.355 158.138 1.00 0.00 H ATOM 53699 H2 WAT 1005 139.823 74.916 158.541 1.00 0.00 H TER 53701 WAT 1005 ATOM 53701 O WAT 1006 140.611 115.101 62.048 1.00 0.00 O ATOM 53702 H1 WAT 1006 140.935 114.233 62.289 1.00 0.00 H ATOM 53703 H2 WAT 1006 141.340 115.690 62.238 1.00 0.00 H TER 53705 WAT 1006 ATOM 53705 O WAT 1007 128.818 76.961 0.344 1.00 0.00 O ATOM 53706 H1 WAT 1007 128.351 77.796 0.371 1.00 0.00 H ATOM 53707 H2 WAT 1007 128.129 76.303 0.258 1.00 0.00 H TER 53709 WAT 1007 ATOM 53709 O WAT 1008 28.476 67.389 138.221 1.00 0.00 O ATOM 53710 H1 WAT 1008 28.740 67.950 137.492 1.00 0.00 H ATOM 53711 H2 WAT 1008 27.603 67.699 138.459 1.00 0.00 H TER 53713 WAT 1008 ATOM 53713 O WAT 1009 74.113 58.422 142.445 1.00 0.00 O ATOM 53714 H1 WAT 1009 74.628 58.306 141.646 1.00 0.00 H ATOM 53715 H2 WAT 1009 74.043 57.541 142.814 1.00 0.00 H TER 53717 WAT 1009 ATOM 53717 O WAT 1010 80.583 83.196 124.451 1.00 0.00 O ATOM 53718 H1 WAT 1010 79.822 82.690 124.162 1.00 0.00 H ATOM 53719 H2 WAT 1010 80.414 84.083 124.135 1.00 0.00 H TER 53721 WAT 1010 ATOM 53721 O WAT 1011 39.182 113.992 57.439 1.00 0.00 O ATOM 53722 H1 WAT 1011 39.415 114.720 58.015 1.00 0.00 H ATOM 53723 H2 WAT 1011 39.959 113.858 56.895 1.00 0.00 H TER 53725 WAT 1011 ATOM 53725 O WAT 1012 84.381 98.610 20.137 1.00 0.00 O ATOM 53726 H1 WAT 1012 83.780 97.955 19.781 1.00 0.00 H ATOM 53727 H2 WAT 1012 84.342 99.335 19.514 1.00 0.00 H TER 53729 WAT 1012 ATOM 53729 O WAT 1013 35.642 33.084 152.116 1.00 0.00 O ATOM 53730 H1 WAT 1013 36.281 32.939 152.814 1.00 0.00 H ATOM 53731 H2 WAT 1013 34.799 32.870 152.515 1.00 0.00 H TER 53733 WAT 1013 ATOM 53733 O WAT 1014 28.178 82.145 114.337 1.00 0.00 O ATOM 53734 H1 WAT 1014 28.758 82.152 115.098 1.00 0.00 H ATOM 53735 H2 WAT 1014 27.297 82.193 114.707 1.00 0.00 H TER 53737 WAT 1014 ATOM 53737 O WAT 1015 30.661 91.519 69.998 1.00 0.00 O ATOM 53738 H1 WAT 1015 29.985 90.845 69.929 1.00 0.00 H ATOM 53739 H2 WAT 1015 31.458 91.038 70.220 1.00 0.00 H TER 53741 WAT 1015 ATOM 53741 O WAT 1016 104.191 35.034 130.258 1.00 0.00 O ATOM 53742 H1 WAT 1016 104.169 35.982 130.128 1.00 0.00 H ATOM 53743 H2 WAT 1016 105.115 34.801 130.169 1.00 0.00 H TER 53745 WAT 1016 ATOM 53745 O WAT 1017 67.426 34.677 20.257 1.00 0.00 O ATOM 53746 H1 WAT 1017 67.106 34.683 19.355 1.00 0.00 H ATOM 53747 H2 WAT 1017 68.356 34.466 20.180 1.00 0.00 H TER 53749 WAT 1017 ATOM 53749 O WAT 1018 30.803 126.247 53.180 1.00 0.00 O ATOM 53750 H1 WAT 1018 31.183 127.120 53.281 1.00 0.00 H ATOM 53751 H2 WAT 1018 30.642 126.164 52.241 1.00 0.00 H TER 53753 WAT 1018 ATOM 53753 O WAT 1019 36.555 104.931 21.503 1.00 0.00 O ATOM 53754 H1 WAT 1019 36.089 104.666 20.710 1.00 0.00 H ATOM 53755 H2 WAT 1019 36.563 105.888 21.468 1.00 0.00 H TER 53757 WAT 1019 ATOM 53757 O WAT 1020 138.623 135.460 87.269 1.00 0.00 O ATOM 53758 H1 WAT 1020 139.487 135.599 86.881 1.00 0.00 H ATOM 53759 H2 WAT 1020 138.275 134.695 86.811 1.00 0.00 H TER 53761 WAT 1020 ATOM 53761 O WAT 1021 69.893 101.334 126.571 1.00 0.00 O ATOM 53762 H1 WAT 1021 70.292 100.519 126.876 1.00 0.00 H ATOM 53763 H2 WAT 1021 69.279 101.575 127.264 1.00 0.00 H TER 53765 WAT 1021 ATOM 53765 O WAT 1022 126.385 34.619 115.881 1.00 0.00 O ATOM 53766 H1 WAT 1022 126.776 33.993 115.272 1.00 0.00 H ATOM 53767 H2 WAT 1022 125.912 35.235 115.322 1.00 0.00 H TER 53769 WAT 1022 ATOM 53769 O WAT 1023 101.615 70.094 11.254 1.00 0.00 O ATOM 53770 H1 WAT 1023 101.328 69.801 12.119 1.00 0.00 H ATOM 53771 H2 WAT 1023 100.878 69.895 10.677 1.00 0.00 H TER 53773 WAT 1023 ATOM 53773 O WAT 1024 64.544 135.987 139.559 1.00 0.00 O ATOM 53774 H1 WAT 1024 64.293 135.213 140.064 1.00 0.00 H ATOM 53775 H2 WAT 1024 63.733 136.485 139.465 1.00 0.00 H TER 53777 WAT 1024 ATOM 53777 O WAT 1025 41.151 81.307 17.308 1.00 0.00 O ATOM 53778 H1 WAT 1025 41.375 80.774 18.071 1.00 0.00 H ATOM 53779 H2 WAT 1025 41.995 81.528 16.914 1.00 0.00 H TER 53781 WAT 1025 ATOM 53781 O WAT 1026 20.212 58.319 93.042 1.00 0.00 O ATOM 53782 H1 WAT 1026 19.573 58.653 92.412 1.00 0.00 H ATOM 53783 H2 WAT 1026 20.183 58.944 93.766 1.00 0.00 H TER 53785 WAT 1026 ATOM 53785 O WAT 1027 65.599 47.068 66.693 1.00 0.00 O ATOM 53786 H1 WAT 1027 65.898 46.987 65.787 1.00 0.00 H ATOM 53787 H2 WAT 1027 65.209 47.941 66.739 1.00 0.00 H TER 53789 WAT 1027 ATOM 53789 O WAT 1028 76.804 32.079 122.144 1.00 0.00 O ATOM 53790 H1 WAT 1028 76.687 31.329 122.727 1.00 0.00 H ATOM 53791 H2 WAT 1028 77.749 32.225 122.128 1.00 0.00 H TER 53793 WAT 1028 ATOM 53793 O WAT 1029 70.415 136.496 68.276 1.00 0.00 O ATOM 53794 H1 WAT 1029 70.613 135.950 69.038 1.00 0.00 H ATOM 53795 H2 WAT 1029 71.184 136.406 67.713 1.00 0.00 H TER 53797 WAT 1029 ATOM 53797 O WAT 1030 101.613 37.754 132.517 1.00 0.00 O ATOM 53798 H1 WAT 1030 101.142 37.757 131.684 1.00 0.00 H ATOM 53799 H2 WAT 1030 102.053 36.904 132.539 1.00 0.00 H TER 53801 WAT 1030 ATOM 53801 O WAT 1031 0.479 12.296 90.667 1.00 0.00 O ATOM 53802 H1 WAT 1031 0.653 11.708 91.403 1.00 0.00 H ATOM 53803 H2 WAT 1031 -0.181 11.837 90.146 1.00 0.00 H TER 53805 WAT 1031 ATOM 53805 O WAT 1032 12.594 97.097 12.218 1.00 0.00 O ATOM 53806 H1 WAT 1032 11.968 97.603 11.701 1.00 0.00 H ATOM 53807 H2 WAT 1032 12.994 96.496 11.590 1.00 0.00 H TER 53809 WAT 1032 ATOM 53809 O WAT 1033 119.147 84.386 88.509 1.00 0.00 O ATOM 53810 H1 WAT 1033 118.773 84.583 87.650 1.00 0.00 H ATOM 53811 H2 WAT 1033 120.071 84.207 88.333 1.00 0.00 H TER 53813 WAT 1033 ATOM 53813 O WAT 1034 35.668 14.953 148.013 1.00 0.00 O ATOM 53814 H1 WAT 1034 35.785 14.955 147.063 1.00 0.00 H ATOM 53815 H2 WAT 1034 34.806 14.560 148.148 1.00 0.00 H TER 53817 WAT 1034 ATOM 53817 O WAT 1035 1.618 15.464 19.999 1.00 0.00 O ATOM 53818 H1 WAT 1035 2.005 14.634 20.277 1.00 0.00 H ATOM 53819 H2 WAT 1035 1.509 15.373 19.053 1.00 0.00 H TER 53821 WAT 1035 ATOM 53821 O WAT 1036 3.829 78.273 146.268 1.00 0.00 O ATOM 53822 H1 WAT 1036 4.667 78.723 146.163 1.00 0.00 H ATOM 53823 H2 WAT 1036 3.800 78.035 147.195 1.00 0.00 H TER 53825 WAT 1036 ATOM 53825 O WAT 1037 144.054 145.118 3.929 1.00 0.00 O ATOM 53826 H1 WAT 1037 144.775 144.550 3.655 1.00 0.00 H ATOM 53827 H2 WAT 1037 144.265 145.353 4.833 1.00 0.00 H TER 53829 WAT 1037 ATOM 53829 O WAT 1038 87.165 121.169 111.669 1.00 0.00 O ATOM 53830 H1 WAT 1038 86.955 121.561 110.821 1.00 0.00 H ATOM 53831 H2 WAT 1038 87.796 120.479 111.463 1.00 0.00 H TER 53833 WAT 1038 ATOM 53833 O WAT 1039 120.302 75.554 100.855 1.00 0.00 O ATOM 53834 H1 WAT 1039 120.988 75.634 100.192 1.00 0.00 H ATOM 53835 H2 WAT 1039 119.850 74.739 100.635 1.00 0.00 H TER 53837 WAT 1039 ATOM 53837 O WAT 1040 70.074 34.639 66.219 1.00 0.00 O ATOM 53838 H1 WAT 1040 69.823 35.551 66.364 1.00 0.00 H ATOM 53839 H2 WAT 1040 70.662 34.670 65.464 1.00 0.00 H TER 53841 WAT 1040 ATOM 53841 O WAT 1041 99.069 119.410 80.262 1.00 0.00 O ATOM 53842 H1 WAT 1041 98.303 119.458 79.690 1.00 0.00 H ATOM 53843 H2 WAT 1041 98.726 119.589 81.138 1.00 0.00 H TER 53845 WAT 1041 ATOM 53845 O WAT 1042 86.650 88.010 85.754 1.00 0.00 O ATOM 53846 H1 WAT 1042 86.050 88.113 85.015 1.00 0.00 H ATOM 53847 H2 WAT 1042 87.042 87.147 85.625 1.00 0.00 H TER 53849 WAT 1042 ATOM 53849 O WAT 1043 127.767 59.327 128.295 1.00 0.00 O ATOM 53850 H1 WAT 1043 127.789 58.598 127.674 1.00 0.00 H ATOM 53851 H2 WAT 1043 128.639 59.718 128.236 1.00 0.00 H TER 53853 WAT 1043 ATOM 53853 O WAT 1044 81.887 130.375 82.756 1.00 0.00 O ATOM 53854 H1 WAT 1044 82.210 129.518 83.034 1.00 0.00 H ATOM 53855 H2 WAT 1044 82.465 130.626 82.036 1.00 0.00 H TER 53857 WAT 1044 ATOM 53857 O WAT 1045 78.488 96.036 104.958 1.00 0.00 O ATOM 53858 H1 WAT 1045 77.679 95.789 105.406 1.00 0.00 H ATOM 53859 H2 WAT 1045 78.595 95.373 104.276 1.00 0.00 H TER 53861 WAT 1045 ATOM 53861 O WAT 1046 10.695 129.892 131.478 1.00 0.00 O ATOM 53862 H1 WAT 1046 10.297 129.824 132.346 1.00 0.00 H ATOM 53863 H2 WAT 1046 10.465 129.070 131.044 1.00 0.00 H TER 53865 WAT 1046 ATOM 53865 O WAT 1047 120.660 47.579 96.756 1.00 0.00 O ATOM 53866 H1 WAT 1047 120.926 48.156 96.040 1.00 0.00 H ATOM 53867 H2 WAT 1047 120.731 46.697 96.391 1.00 0.00 H TER 53869 WAT 1047 ATOM 53869 O WAT 1048 92.661 64.158 87.390 1.00 0.00 O ATOM 53870 H1 WAT 1048 93.140 63.382 87.099 1.00 0.00 H ATOM 53871 H2 WAT 1048 92.572 64.044 88.337 1.00 0.00 H TER 53873 WAT 1048 ATOM 53873 O WAT 1049 77.268 131.720 85.400 1.00 0.00 O ATOM 53874 H1 WAT 1049 77.953 131.079 85.210 1.00 0.00 H ATOM 53875 H2 WAT 1049 76.501 131.400 84.924 1.00 0.00 H TER 53877 WAT 1049 ATOM 53877 O WAT 1050 38.083 117.491 61.831 1.00 0.00 O ATOM 53878 H1 WAT 1050 39.006 117.333 61.632 1.00 0.00 H ATOM 53879 H2 WAT 1050 37.609 117.096 61.099 1.00 0.00 H TER 53881 WAT 1050 ATOM 53881 O WAT 1051 8.520 89.632 137.945 1.00 0.00 O ATOM 53882 H1 WAT 1051 8.799 90.145 137.187 1.00 0.00 H ATOM 53883 H2 WAT 1051 8.321 88.766 137.588 1.00 0.00 H TER 53885 WAT 1051 ATOM 53885 O WAT 1052 66.359 49.278 138.273 1.00 0.00 O ATOM 53886 H1 WAT 1052 66.378 50.120 138.727 1.00 0.00 H ATOM 53887 H2 WAT 1052 67.226 48.903 138.426 1.00 0.00 H TER 53889 WAT 1052 ATOM 53889 O WAT 1053 139.474 82.878 23.766 1.00 0.00 O ATOM 53890 H1 WAT 1053 139.918 82.373 24.447 1.00 0.00 H ATOM 53891 H2 WAT 1053 140.148 83.030 23.103 1.00 0.00 H TER 53893 WAT 1053 ATOM 53893 O WAT 1054 125.218 131.515 16.443 1.00 0.00 O ATOM 53894 H1 WAT 1054 124.509 131.643 15.814 1.00 0.00 H ATOM 53895 H2 WAT 1054 125.329 130.565 16.490 1.00 0.00 H TER 53897 WAT 1054 ATOM 53897 O WAT 1055 43.350 37.144 105.552 1.00 0.00 O ATOM 53898 H1 WAT 1055 43.795 36.865 104.752 1.00 0.00 H ATOM 53899 H2 WAT 1055 43.126 38.061 105.394 1.00 0.00 H TER 53901 WAT 1055 ATOM 53901 O WAT 1056 87.760 44.694 65.290 1.00 0.00 O ATOM 53902 H1 WAT 1056 87.699 45.057 64.407 1.00 0.00 H ATOM 53903 H2 WAT 1056 87.062 44.040 65.329 1.00 0.00 H TER 53905 WAT 1056 ATOM 53905 O WAT 1057 139.485 134.690 147.292 1.00 0.00 O ATOM 53906 H1 WAT 1057 139.756 134.403 146.420 1.00 0.00 H ATOM 53907 H2 WAT 1057 139.095 133.912 147.690 1.00 0.00 H TER 53909 WAT 1057 ATOM 53909 O WAT 1058 79.378 41.827 112.119 1.00 0.00 O ATOM 53910 H1 WAT 1058 80.249 42.143 112.358 1.00 0.00 H ATOM 53911 H2 WAT 1058 79.215 41.099 112.719 1.00 0.00 H TER 53913 WAT 1058 ATOM 53913 O WAT 1059 101.596 90.982 106.110 1.00 0.00 O ATOM 53914 H1 WAT 1059 101.019 91.731 105.960 1.00 0.00 H ATOM 53915 H2 WAT 1059 101.153 90.472 106.788 1.00 0.00 H TER 53917 WAT 1059 ATOM 53917 O WAT 1060 5.507 141.976 92.128 1.00 0.00 O ATOM 53918 H1 WAT 1060 5.030 141.431 91.503 1.00 0.00 H ATOM 53919 H2 WAT 1060 5.214 141.669 92.986 1.00 0.00 H TER 53921 WAT 1060 ATOM 53921 O WAT 1061 52.533 102.313 148.902 1.00 0.00 O ATOM 53922 H1 WAT 1061 51.613 102.053 148.858 1.00 0.00 H ATOM 53923 H2 WAT 1061 52.546 103.043 149.520 1.00 0.00 H TER 53925 WAT 1061 ATOM 53925 O WAT 1062 139.086 15.467 151.210 1.00 0.00 O ATOM 53926 H1 WAT 1062 138.780 14.822 150.572 1.00 0.00 H ATOM 53927 H2 WAT 1062 139.575 16.104 150.689 1.00 0.00 H TER 53929 WAT 1062 ATOM 53929 O WAT 1063 86.975 143.232 101.752 1.00 0.00 O ATOM 53930 H1 WAT 1063 87.606 143.080 101.049 1.00 0.00 H ATOM 53931 H2 WAT 1063 87.286 142.687 102.475 1.00 0.00 H TER 53933 WAT 1063 ATOM 53933 O WAT 1064 54.681 16.577 4.460 1.00 0.00 O ATOM 53934 H1 WAT 1064 53.824 16.151 4.415 1.00 0.00 H ATOM 53935 H2 WAT 1064 54.529 17.455 4.111 1.00 0.00 H TER 53937 WAT 1064 ATOM 53937 O WAT 1065 114.465 92.032 78.281 1.00 0.00 O ATOM 53938 H1 WAT 1065 113.691 92.197 78.818 1.00 0.00 H ATOM 53939 H2 WAT 1065 114.759 91.160 78.546 1.00 0.00 H TER 53941 WAT 1065 ATOM 53941 O WAT 1066 101.648 136.472 158.676 1.00 0.00 O ATOM 53942 H1 WAT 1066 101.169 137.106 158.143 1.00 0.00 H ATOM 53943 H2 WAT 1066 102.499 136.882 158.830 1.00 0.00 H TER 53945 WAT 1066 ATOM 53945 O WAT 1067 15.552 3.558 133.904 1.00 0.00 O ATOM 53946 H1 WAT 1067 15.914 3.585 133.018 1.00 0.00 H ATOM 53947 H2 WAT 1067 14.606 3.634 133.779 1.00 0.00 H TER 53949 WAT 1067 ATOM 53949 O WAT 1068 62.185 145.644 131.060 1.00 0.00 O ATOM 53950 H1 WAT 1068 61.231 145.713 131.073 1.00 0.00 H ATOM 53951 H2 WAT 1068 62.375 144.847 131.556 1.00 0.00 H TER 53953 WAT 1068 ATOM 53953 O WAT 1069 75.755 14.176 20.233 1.00 0.00 O ATOM 53954 H1 WAT 1069 75.607 14.798 20.945 1.00 0.00 H ATOM 53955 H2 WAT 1069 76.603 13.781 20.433 1.00 0.00 H TER 53957 WAT 1069 ATOM 53957 O WAT 1070 119.119 46.753 121.955 1.00 0.00 O ATOM 53958 H1 WAT 1070 119.596 47.515 121.626 1.00 0.00 H ATOM 53959 H2 WAT 1070 119.059 46.897 122.899 1.00 0.00 H TER 53961 WAT 1070 ATOM 53961 O WAT 1071 9.230 142.575 16.833 1.00 0.00 O ATOM 53962 H1 WAT 1071 9.788 143.172 17.331 1.00 0.00 H ATOM 53963 H2 WAT 1071 8.491 142.396 17.415 1.00 0.00 H TER 53965 WAT 1071 ATOM 53965 O WAT 1072 141.863 61.343 21.536 1.00 0.00 O ATOM 53966 H1 WAT 1072 141.399 60.969 20.787 1.00 0.00 H ATOM 53967 H2 WAT 1072 142.378 60.616 21.886 1.00 0.00 H TER 53969 WAT 1072 ATOM 53969 O WAT 1073 100.147 142.877 153.751 1.00 0.00 O ATOM 53970 H1 WAT 1073 99.845 142.570 152.896 1.00 0.00 H ATOM 53971 H2 WAT 1073 99.424 143.409 154.084 1.00 0.00 H TER 53973 WAT 1073 ATOM 53973 O WAT 1074 96.908 31.430 81.796 1.00 0.00 O ATOM 53974 H1 WAT 1074 96.372 30.638 81.759 1.00 0.00 H ATOM 53975 H2 WAT 1074 96.293 32.125 82.031 1.00 0.00 H TER 53977 WAT 1074 ATOM 53977 O WAT 1075 24.201 116.408 135.359 1.00 0.00 O ATOM 53978 H1 WAT 1075 24.548 115.517 135.329 1.00 0.00 H ATOM 53979 H2 WAT 1075 23.293 116.322 135.069 1.00 0.00 H TER 53981 WAT 1075 ATOM 53981 O WAT 1076 37.054 7.497 16.673 1.00 0.00 O ATOM 53982 H1 WAT 1076 37.446 7.859 15.878 1.00 0.00 H ATOM 53983 H2 WAT 1076 37.201 8.169 17.339 1.00 0.00 H TER 53985 WAT 1076 ATOM 53985 O WAT 1077 11.590 127.131 78.731 1.00 0.00 O ATOM 53986 H1 WAT 1077 10.961 127.847 78.819 1.00 0.00 H ATOM 53987 H2 WAT 1077 12.109 127.361 77.961 1.00 0.00 H TER 53989 WAT 1077 ATOM 53989 O WAT 1078 25.874 23.244 4.084 1.00 0.00 O ATOM 53990 H1 WAT 1078 25.434 22.650 4.693 1.00 0.00 H ATOM 53991 H2 WAT 1078 25.775 22.826 3.228 1.00 0.00 H TER 53993 WAT 1078 ATOM 53993 O WAT 1079 84.131 35.751 136.468 1.00 0.00 O ATOM 53994 H1 WAT 1079 83.304 36.202 136.638 1.00 0.00 H ATOM 53995 H2 WAT 1079 84.399 36.060 135.603 1.00 0.00 H TER 53997 WAT 1079 ATOM 53997 O WAT 1080 3.785 40.973 14.028 1.00 0.00 O ATOM 53998 H1 WAT 1080 4.356 41.700 14.275 1.00 0.00 H ATOM 53999 H2 WAT 1080 4.225 40.196 14.372 1.00 0.00 H TER 54001 WAT 1080 ATOM 54001 O WAT 1081 118.381 106.271 127.284 1.00 0.00 O ATOM 54002 H1 WAT 1081 118.435 105.315 127.299 1.00 0.00 H ATOM 54003 H2 WAT 1081 118.272 106.519 128.202 1.00 0.00 H TER 54005 WAT 1081 ATOM 54005 O WAT 1082 54.183 43.565 90.118 1.00 0.00 O ATOM 54006 H1 WAT 1082 54.455 44.461 90.317 1.00 0.00 H ATOM 54007 H2 WAT 1082 54.683 43.022 90.727 1.00 0.00 H TER 54009 WAT 1082 ATOM 54009 O WAT 1083 51.507 18.400 15.962 1.00 0.00 O ATOM 54010 H1 WAT 1083 52.171 19.068 16.130 1.00 0.00 H ATOM 54011 H2 WAT 1083 51.731 17.685 16.558 1.00 0.00 H TER 54013 WAT 1083 ATOM 54013 O WAT 1084 53.160 90.711 156.119 1.00 0.00 O ATOM 54014 H1 WAT 1084 53.618 91.351 155.575 1.00 0.00 H ATOM 54015 H2 WAT 1084 52.261 90.715 155.789 1.00 0.00 H TER 54017 WAT 1084 ATOM 54017 O WAT 1085 85.852 95.813 118.389 1.00 0.00 O ATOM 54018 H1 WAT 1085 85.197 95.308 118.869 1.00 0.00 H ATOM 54019 H2 WAT 1085 85.861 95.424 117.514 1.00 0.00 H TER 54021 WAT 1085 ATOM 54021 O WAT 1086 0.874 51.311 111.550 1.00 0.00 O ATOM 54022 H1 WAT 1086 0.717 50.674 110.853 1.00 0.00 H ATOM 54023 H2 WAT 1086 1.815 51.259 111.716 1.00 0.00 H TER 54025 WAT 1086 ATOM 54025 O WAT 1087 37.185 104.232 119.197 1.00 0.00 O ATOM 54026 H1 WAT 1087 37.628 103.394 119.064 1.00 0.00 H ATOM 54027 H2 WAT 1087 36.797 104.435 118.346 1.00 0.00 H TER 54029 WAT 1087 ATOM 54029 O WAT 1088 34.020 28.605 115.851 1.00 0.00 O ATOM 54030 H1 WAT 1088 34.810 28.850 116.333 1.00 0.00 H ATOM 54031 H2 WAT 1088 33.302 28.984 116.358 1.00 0.00 H TER 54033 WAT 1088 ATOM 54033 O WAT 1089 2.491 119.312 6.902 1.00 0.00 O ATOM 54034 H1 WAT 1089 2.757 119.296 7.821 1.00 0.00 H ATOM 54035 H2 WAT 1089 3.286 119.090 6.419 1.00 0.00 H TER 54037 WAT 1089 ATOM 54037 O WAT 1090 38.431 40.249 120.032 1.00 0.00 O ATOM 54038 H1 WAT 1090 39.111 40.715 120.520 1.00 0.00 H ATOM 54039 H2 WAT 1090 38.864 39.455 119.719 1.00 0.00 H TER 54041 WAT 1090 ATOM 54041 O WAT 1091 46.577 132.657 155.516 1.00 0.00 O ATOM 54042 H1 WAT 1091 47.323 132.322 155.019 1.00 0.00 H ATOM 54043 H2 WAT 1091 46.316 131.928 156.079 1.00 0.00 H TER 54045 WAT 1091 ATOM 54045 O WAT 1092 4.333 131.172 119.724 1.00 0.00 O ATOM 54046 H1 WAT 1092 4.194 131.535 118.850 1.00 0.00 H ATOM 54047 H2 WAT 1092 4.583 131.925 120.260 1.00 0.00 H TER 54049 WAT 1092 ATOM 54049 O WAT 1093 108.552 84.604 138.715 1.00 0.00 O ATOM 54050 H1 WAT 1093 109.113 83.942 139.119 1.00 0.00 H ATOM 54051 H2 WAT 1093 107.999 84.919 139.430 1.00 0.00 H TER 54053 WAT 1093 ATOM 54053 O WAT 1094 34.369 59.989 86.023 1.00 0.00 O ATOM 54054 H1 WAT 1094 35.207 59.618 85.745 1.00 0.00 H ATOM 54055 H2 WAT 1094 33.722 59.328 85.779 1.00 0.00 H TER 54057 WAT 1094 ATOM 54057 O WAT 1095 22.272 18.579 79.045 1.00 0.00 O ATOM 54058 H1 WAT 1095 22.981 18.469 79.679 1.00 0.00 H ATOM 54059 H2 WAT 1095 22.647 19.131 78.359 1.00 0.00 H TER 54061 WAT 1095 ATOM 54061 O WAT 1096 124.693 41.090 134.314 1.00 0.00 O ATOM 54062 H1 WAT 1096 125.096 40.835 135.143 1.00 0.00 H ATOM 54063 H2 WAT 1096 125.362 41.614 133.873 1.00 0.00 H TER 54065 WAT 1096 ATOM 54065 O WAT 1097 18.498 136.616 74.636 1.00 0.00 O ATOM 54066 H1 WAT 1097 18.750 136.323 75.512 1.00 0.00 H ATOM 54067 H2 WAT 1097 19.329 136.762 74.184 1.00 0.00 H TER 54069 WAT 1097 ATOM 54069 O WAT 1098 63.507 39.906 74.867 1.00 0.00 O ATOM 54070 H1 WAT 1098 64.194 40.465 75.230 1.00 0.00 H ATOM 54071 H2 WAT 1098 63.841 39.016 74.973 1.00 0.00 H TER 54073 WAT 1098 ATOM 54073 O WAT 1099 41.499 68.857 19.347 1.00 0.00 O ATOM 54074 H1 WAT 1099 42.165 69.538 19.255 1.00 0.00 H ATOM 54075 H2 WAT 1099 41.247 68.891 20.270 1.00 0.00 H TER 54077 WAT 1099 ATOM 54077 O WAT 1100 53.400 135.216 112.071 1.00 0.00 O ATOM 54078 H1 WAT 1100 53.101 135.041 112.964 1.00 0.00 H ATOM 54079 H2 WAT 1100 53.989 135.966 112.158 1.00 0.00 H TER 54081 WAT 1100 ATOM 54081 O WAT 1101 105.222 107.550 151.196 1.00 0.00 O ATOM 54082 H1 WAT 1101 105.572 108.408 150.957 1.00 0.00 H ATOM 54083 H2 WAT 1101 104.721 107.709 151.996 1.00 0.00 H TER 54085 WAT 1101 ATOM 54085 O WAT 1102 98.181 90.309 129.862 1.00 0.00 O ATOM 54086 H1 WAT 1102 97.349 90.097 129.440 1.00 0.00 H ATOM 54087 H2 WAT 1102 98.613 90.907 129.252 1.00 0.00 H TER 54089 WAT 1102 ATOM 54089 O WAT 1103 62.326 53.855 149.631 1.00 0.00 O ATOM 54090 H1 WAT 1103 62.476 53.318 150.409 1.00 0.00 H ATOM 54091 H2 WAT 1103 62.628 53.312 148.903 1.00 0.00 H TER 54093 WAT 1103 ATOM 54093 O WAT 1104 120.654 34.173 136.384 1.00 0.00 O ATOM 54094 H1 WAT 1104 121.393 34.422 136.939 1.00 0.00 H ATOM 54095 H2 WAT 1104 120.990 33.458 135.844 1.00 0.00 H TER 54097 WAT 1104 ATOM 54097 O WAT 1105 30.386 90.286 113.748 1.00 0.00 O ATOM 54098 H1 WAT 1105 30.709 89.918 114.571 1.00 0.00 H ATOM 54099 H2 WAT 1105 30.890 89.836 113.071 1.00 0.00 H TER 54101 WAT 1105 ATOM 54101 O WAT 1106 48.921 103.303 140.773 1.00 0.00 O ATOM 54102 H1 WAT 1106 48.243 103.545 141.404 1.00 0.00 H ATOM 54103 H2 WAT 1106 49.377 102.567 141.182 1.00 0.00 H TER 54105 WAT 1106 ATOM 54105 O WAT 1107 77.631 144.809 62.031 1.00 0.00 O ATOM 54106 H1 WAT 1107 76.876 144.857 62.617 1.00 0.00 H ATOM 54107 H2 WAT 1107 77.252 144.808 61.152 1.00 0.00 H TER 54109 WAT 1107 ATOM 54109 O WAT 1108 37.841 143.494 86.152 1.00 0.00 O ATOM 54110 H1 WAT 1108 38.313 143.204 85.371 1.00 0.00 H ATOM 54111 H2 WAT 1108 38.323 144.266 86.449 1.00 0.00 H TER 54113 WAT 1108 ATOM 54113 O WAT 1109 142.036 114.830 138.350 1.00 0.00 O ATOM 54114 H1 WAT 1109 142.142 115.157 137.456 1.00 0.00 H ATOM 54115 H2 WAT 1109 141.249 114.286 138.314 1.00 0.00 H TER 54117 WAT 1109 ATOM 54117 O WAT 1110 132.428 54.299 148.393 1.00 0.00 O ATOM 54118 H1 WAT 1110 132.594 53.458 148.819 1.00 0.00 H ATOM 54119 H2 WAT 1110 133.277 54.556 148.033 1.00 0.00 H TER 54121 WAT 1110 ATOM 54121 O WAT 1111 135.549 68.069 87.982 1.00 0.00 O ATOM 54122 H1 WAT 1111 135.481 68.506 87.133 1.00 0.00 H ATOM 54123 H2 WAT 1111 136.490 68.022 88.153 1.00 0.00 H TER 54125 WAT 1111 ATOM 54125 O WAT 1112 3.476 31.448 90.475 1.00 0.00 O ATOM 54126 H1 WAT 1112 4.135 30.754 90.440 1.00 0.00 H ATOM 54127 H2 WAT 1112 3.808 32.060 91.131 1.00 0.00 H TER 54129 WAT 1112 ATOM 54129 O WAT 1113 32.883 32.560 133.367 1.00 0.00 O ATOM 54130 H1 WAT 1113 33.356 33.388 133.283 1.00 0.00 H ATOM 54131 H2 WAT 1113 32.603 32.537 134.282 1.00 0.00 H TER 54133 WAT 1113 ATOM 54133 O WAT 1114 34.051 7.786 146.357 1.00 0.00 O ATOM 54134 H1 WAT 1114 33.619 6.953 146.548 1.00 0.00 H ATOM 54135 H2 WAT 1114 34.882 7.739 146.830 1.00 0.00 H TER 54137 WAT 1114 ATOM 54137 O WAT 1115 46.727 7.118 74.749 1.00 0.00 O ATOM 54138 H1 WAT 1115 47.522 6.589 74.817 1.00 0.00 H ATOM 54139 H2 WAT 1115 46.739 7.454 73.853 1.00 0.00 H TER 54141 WAT 1115 ATOM 54141 O WAT 1116 83.964 12.142 139.207 1.00 0.00 O ATOM 54142 H1 WAT 1116 84.853 11.789 139.208 1.00 0.00 H ATOM 54143 H2 WAT 1116 83.712 12.161 140.130 1.00 0.00 H TER 54145 WAT 1116 ATOM 54145 O WAT 1117 93.692 9.607 1.737 1.00 0.00 O ATOM 54146 H1 WAT 1117 93.452 10.038 2.557 1.00 0.00 H ATOM 54147 H2 WAT 1117 94.103 8.787 2.008 1.00 0.00 H TER 54149 WAT 1117 ATOM 54149 O WAT 1118 114.892 104.190 138.187 1.00 0.00 O ATOM 54150 H1 WAT 1118 114.238 104.352 138.866 1.00 0.00 H ATOM 54151 H2 WAT 1118 115.362 105.020 138.104 1.00 0.00 H TER 54153 WAT 1118 ATOM 54153 O WAT 1119 30.680 14.665 101.524 1.00 0.00 O ATOM 54154 H1 WAT 1119 29.816 14.559 101.922 1.00 0.00 H ATOM 54155 H2 WAT 1119 30.779 13.900 100.957 1.00 0.00 H TER 54157 WAT 1119 ATOM 54157 O WAT 1120 84.547 83.165 131.496 1.00 0.00 O ATOM 54158 H1 WAT 1120 84.536 82.614 130.714 1.00 0.00 H ATOM 54159 H2 WAT 1120 83.625 83.354 131.668 1.00 0.00 H TER 54161 WAT 1120 ATOM 54161 O WAT 1121 89.901 119.690 60.649 1.00 0.00 O ATOM 54162 H1 WAT 1121 89.469 120.251 61.293 1.00 0.00 H ATOM 54163 H2 WAT 1121 90.409 119.070 61.174 1.00 0.00 H TER 54165 WAT 1121 ATOM 54165 O WAT 1122 140.202 118.237 142.793 1.00 0.00 O ATOM 54166 H1 WAT 1122 140.106 118.729 141.978 1.00 0.00 H ATOM 54167 H2 WAT 1122 139.551 118.619 143.382 1.00 0.00 H TER 54169 WAT 1122 ATOM 54169 O WAT 1123 33.920 114.183 94.514 1.00 0.00 O ATOM 54170 H1 WAT 1123 34.355 114.097 93.666 1.00 0.00 H ATOM 54171 H2 WAT 1123 34.558 114.635 95.066 1.00 0.00 H TER 54173 WAT 1123 ATOM 54173 O WAT 1124 3.829 71.924 72.074 1.00 0.00 O ATOM 54174 H1 WAT 1124 4.582 72.510 72.149 1.00 0.00 H ATOM 54175 H2 WAT 1124 4.092 71.279 71.417 1.00 0.00 H TER 54177 WAT 1124 ATOM 54177 O WAT 1125 58.224 126.840 4.906 1.00 0.00 O ATOM 54178 H1 WAT 1125 57.687 127.632 4.929 1.00 0.00 H ATOM 54179 H2 WAT 1125 58.189 126.500 5.800 1.00 0.00 H TER 54181 WAT 1125 ATOM 54181 O WAT 1126 17.685 32.347 66.278 1.00 0.00 O ATOM 54182 H1 WAT 1126 17.174 31.739 66.812 1.00 0.00 H ATOM 54183 H2 WAT 1126 17.500 32.087 65.375 1.00 0.00 H TER 54185 WAT 1126 ATOM 54185 O WAT 1127 7.014 82.908 115.526 1.00 0.00 O ATOM 54186 H1 WAT 1127 7.854 82.466 115.409 1.00 0.00 H ATOM 54187 H2 WAT 1127 6.494 82.300 116.052 1.00 0.00 H TER 54189 WAT 1127 ATOM 54189 O WAT 1128 123.555 44.874 9.809 1.00 0.00 O ATOM 54190 H1 WAT 1128 123.896 44.052 9.457 1.00 0.00 H ATOM 54191 H2 WAT 1128 122.958 45.195 9.133 1.00 0.00 H TER 54193 WAT 1128 ATOM 54193 O WAT 1129 127.385 13.311 98.505 1.00 0.00 O ATOM 54194 H1 WAT 1129 127.456 13.978 99.188 1.00 0.00 H ATOM 54195 H2 WAT 1129 128.279 13.205 98.179 1.00 0.00 H TER 54197 WAT 1129 ATOM 54197 O WAT 1130 125.974 125.700 77.020 1.00 0.00 O ATOM 54198 H1 WAT 1130 125.578 125.659 76.150 1.00 0.00 H ATOM 54199 H2 WAT 1130 125.239 125.865 77.610 1.00 0.00 H TER 54201 WAT 1130 ATOM 54201 O WAT 1131 5.653 10.866 70.116 1.00 0.00 O ATOM 54202 H1 WAT 1131 6.166 11.062 70.900 1.00 0.00 H ATOM 54203 H2 WAT 1131 5.621 9.910 70.084 1.00 0.00 H TER 54205 WAT 1131 ATOM 54205 O WAT 1132 11.293 21.634 137.554 1.00 0.00 O ATOM 54206 H1 WAT 1132 10.721 21.529 138.314 1.00 0.00 H ATOM 54207 H2 WAT 1132 11.380 22.581 137.448 1.00 0.00 H TER 54209 WAT 1132 ATOM 54209 O WAT 1133 6.622 15.906 146.085 1.00 0.00 O ATOM 54210 H1 WAT 1133 6.118 15.161 145.757 1.00 0.00 H ATOM 54211 H2 WAT 1133 6.315 16.650 145.568 1.00 0.00 H TER 54213 WAT 1133 ATOM 54213 O WAT 1134 92.763 0.723 96.825 1.00 0.00 O ATOM 54214 H1 WAT 1134 91.848 0.706 96.547 1.00 0.00 H ATOM 54215 H2 WAT 1134 92.724 0.884 97.768 1.00 0.00 H TER 54217 WAT 1134 ATOM 54217 O WAT 1135 38.344 10.686 67.693 1.00 0.00 O ATOM 54218 H1 WAT 1135 39.125 10.231 68.007 1.00 0.00 H ATOM 54219 H2 WAT 1135 37.826 10.845 68.483 1.00 0.00 H TER 54221 WAT 1135 ATOM 54221 O WAT 1136 86.891 59.082 103.467 1.00 0.00 O ATOM 54222 H1 WAT 1136 86.333 58.383 103.126 1.00 0.00 H ATOM 54223 H2 WAT 1136 87.449 59.325 102.727 1.00 0.00 H TER 54225 WAT 1136 ATOM 54225 O WAT 1137 81.471 65.420 93.788 1.00 0.00 O ATOM 54226 H1 WAT 1137 81.579 65.296 92.845 1.00 0.00 H ATOM 54227 H2 WAT 1137 81.280 64.545 94.124 1.00 0.00 H TER 54229 WAT 1137 ATOM 54229 O WAT 1138 22.676 58.614 110.979 1.00 0.00 O ATOM 54230 H1 WAT 1138 22.727 59.561 111.115 1.00 0.00 H ATOM 54231 H2 WAT 1138 22.662 58.246 111.863 1.00 0.00 H TER 54233 WAT 1138 ATOM 54233 O WAT 1139 121.565 132.338 19.138 1.00 0.00 O ATOM 54234 H1 WAT 1139 120.985 132.684 19.817 1.00 0.00 H ATOM 54235 H2 WAT 1139 122.423 132.709 19.344 1.00 0.00 H TER 54237 WAT 1139 ATOM 54237 O WAT 1140 113.653 8.058 56.698 1.00 0.00 O ATOM 54238 H1 WAT 1140 113.383 8.330 55.821 1.00 0.00 H ATOM 54239 H2 WAT 1140 114.276 8.730 56.976 1.00 0.00 H TER 54241 WAT 1140 ATOM 54241 O WAT 1141 114.837 84.229 116.961 1.00 0.00 O ATOM 54242 H1 WAT 1141 114.673 84.568 116.081 1.00 0.00 H ATOM 54243 H2 WAT 1141 114.399 83.378 116.976 1.00 0.00 H TER 54245 WAT 1141 ATOM 54245 O WAT 1142 47.910 62.898 22.501 1.00 0.00 O ATOM 54246 H1 WAT 1142 47.752 62.880 23.445 1.00 0.00 H ATOM 54247 H2 WAT 1142 48.815 63.197 22.415 1.00 0.00 H TER 54249 WAT 1142 ATOM 54249 O WAT 1143 36.354 64.819 5.376 1.00 0.00 O ATOM 54250 H1 WAT 1143 36.273 63.929 5.719 1.00 0.00 H ATOM 54251 H2 WAT 1143 35.503 65.222 5.550 1.00 0.00 H TER 54253 WAT 1143 ATOM 54253 O WAT 1144 117.269 75.782 62.271 1.00 0.00 O ATOM 54254 H1 WAT 1144 117.359 74.836 62.387 1.00 0.00 H ATOM 54255 H2 WAT 1144 118.078 76.145 62.632 1.00 0.00 H TER 54257 WAT 1144 ATOM 54257 O WAT 1145 37.904 31.111 75.118 1.00 0.00 O ATOM 54258 H1 WAT 1145 38.543 30.768 75.743 1.00 0.00 H ATOM 54259 H2 WAT 1145 38.208 31.998 74.927 1.00 0.00 H TER 54261 WAT 1145 ATOM 54261 O WAT 1146 18.867 37.367 16.534 1.00 0.00 O ATOM 54262 H1 WAT 1146 18.546 38.269 16.500 1.00 0.00 H ATOM 54263 H2 WAT 1146 18.321 36.895 15.906 1.00 0.00 H TER 54265 WAT 1146 ATOM 54265 O WAT 1147 33.832 100.158 121.833 1.00 0.00 O ATOM 54266 H1 WAT 1147 34.482 100.046 122.526 1.00 0.00 H ATOM 54267 H2 WAT 1147 33.250 100.845 122.159 1.00 0.00 H TER 54269 WAT 1147 ATOM 54269 O WAT 1148 86.439 89.836 151.619 1.00 0.00 O ATOM 54270 H1 WAT 1148 86.799 90.698 151.412 1.00 0.00 H ATOM 54271 H2 WAT 1148 86.240 89.877 152.554 1.00 0.00 H TER 54273 WAT 1148 ATOM 54273 O WAT 1149 39.929 53.967 25.129 1.00 0.00 O ATOM 54274 H1 WAT 1149 40.411 54.441 24.452 1.00 0.00 H ATOM 54275 H2 WAT 1149 39.069 53.805 24.741 1.00 0.00 H TER 54277 WAT 1149 ATOM 54277 O WAT 1150 19.003 118.459 14.419 1.00 0.00 O ATOM 54278 H1 WAT 1150 19.360 118.167 13.581 1.00 0.00 H ATOM 54279 H2 WAT 1150 19.677 118.231 15.059 1.00 0.00 H TER 54281 WAT 1150 ATOM 54281 O WAT 1151 73.105 8.098 77.474 1.00 0.00 O ATOM 54282 H1 WAT 1151 73.207 7.462 78.183 1.00 0.00 H ATOM 54283 H2 WAT 1151 72.317 7.816 77.010 1.00 0.00 H TER 54285 WAT 1151 ATOM 54285 O WAT 1152 54.153 102.512 23.985 1.00 0.00 O ATOM 54286 H1 WAT 1152 54.417 103.403 24.215 1.00 0.00 H ATOM 54287 H2 WAT 1152 54.134 102.508 23.028 1.00 0.00 H TER 54289 WAT 1152 ATOM 54289 O WAT 1153 63.725 59.824 19.561 1.00 0.00 O ATOM 54290 H1 WAT 1153 64.532 59.699 20.062 1.00 0.00 H ATOM 54291 H2 WAT 1153 63.182 60.381 20.119 1.00 0.00 H TER 54293 WAT 1153 ATOM 54293 O WAT 1154 86.838 135.214 106.566 1.00 0.00 O ATOM 54294 H1 WAT 1154 86.381 135.653 105.848 1.00 0.00 H ATOM 54295 H2 WAT 1154 86.599 135.717 107.345 1.00 0.00 H TER 54297 WAT 1154 ATOM 54297 O WAT 1155 25.247 89.422 63.620 1.00 0.00 O ATOM 54298 H1 WAT 1155 24.716 89.700 62.874 1.00 0.00 H ATOM 54299 H2 WAT 1155 24.611 89.241 64.313 1.00 0.00 H TER 54301 WAT 1155 ATOM 54301 O WAT 1156 144.792 71.616 10.427 1.00 0.00 O ATOM 54302 H1 WAT 1156 145.613 72.108 10.457 1.00 0.00 H ATOM 54303 H2 WAT 1156 145.021 70.794 9.994 1.00 0.00 H TER 54305 WAT 1156 ATOM 54305 O WAT 1157 56.628 110.248 140.848 1.00 0.00 O ATOM 54306 H1 WAT 1157 55.834 110.526 140.391 1.00 0.00 H ATOM 54307 H2 WAT 1157 56.529 110.598 141.733 1.00 0.00 H TER 54309 WAT 1157 ATOM 54309 O WAT 1158 14.179 125.132 106.484 1.00 0.00 O ATOM 54310 H1 WAT 1158 13.734 124.501 107.049 1.00 0.00 H ATOM 54311 H2 WAT 1158 14.191 125.942 106.994 1.00 0.00 H TER 54313 WAT 1158 ATOM 54313 O WAT 1159 29.243 85.728 109.244 1.00 0.00 O ATOM 54314 H1 WAT 1159 29.722 85.853 108.425 1.00 0.00 H ATOM 54315 H2 WAT 1159 29.354 84.799 109.447 1.00 0.00 H TER 54317 WAT 1159 ATOM 54317 O WAT 1160 91.746 72.097 71.391 1.00 0.00 O ATOM 54318 H1 WAT 1160 91.922 71.428 70.729 1.00 0.00 H ATOM 54319 H2 WAT 1160 91.245 71.640 72.066 1.00 0.00 H TER 54321 WAT 1160 ATOM 54321 O WAT 1161 107.091 68.297 7.497 1.00 0.00 O ATOM 54322 H1 WAT 1161 106.322 68.816 7.731 1.00 0.00 H ATOM 54323 H2 WAT 1161 107.749 68.536 8.150 1.00 0.00 H TER 54325 WAT 1161 ATOM 54325 O WAT 1162 131.834 30.334 86.350 1.00 0.00 O ATOM 54326 H1 WAT 1162 132.493 30.056 85.713 1.00 0.00 H ATOM 54327 H2 WAT 1162 132.111 31.211 86.613 1.00 0.00 H TER 54329 WAT 1162 ATOM 54329 O WAT 1163 35.583 56.638 94.677 1.00 0.00 O ATOM 54330 H1 WAT 1163 36.084 56.281 93.944 1.00 0.00 H ATOM 54331 H2 WAT 1163 34.806 57.022 94.272 1.00 0.00 H TER 54333 WAT 1163 ATOM 54333 O WAT 1164 97.433 73.156 25.851 1.00 0.00 O ATOM 54334 H1 WAT 1164 97.829 72.802 26.647 1.00 0.00 H ATOM 54335 H2 WAT 1164 97.965 72.799 25.139 1.00 0.00 H TER 54337 WAT 1164 ATOM 54337 O WAT 1165 49.703 120.593 89.102 1.00 0.00 O ATOM 54338 H1 WAT 1165 50.007 120.087 88.348 1.00 0.00 H ATOM 54339 H2 WAT 1165 50.435 121.175 89.310 1.00 0.00 H TER 54341 WAT 1165 ATOM 54341 O WAT 1166 15.095 131.115 113.492 1.00 0.00 O ATOM 54342 H1 WAT 1166 15.034 131.980 113.896 1.00 0.00 H ATOM 54343 H2 WAT 1166 14.473 130.577 113.982 1.00 0.00 H TER 54345 WAT 1166 ATOM 54345 O WAT 1167 96.730 34.439 27.637 1.00 0.00 O ATOM 54346 H1 WAT 1167 96.812 34.766 26.741 1.00 0.00 H ATOM 54347 H2 WAT 1167 97.572 34.643 28.044 1.00 0.00 H TER 54349 WAT 1167 ATOM 54349 O WAT 1168 113.996 108.198 148.507 1.00 0.00 O ATOM 54350 H1 WAT 1168 114.450 108.827 147.946 1.00 0.00 H ATOM 54351 H2 WAT 1168 113.875 107.427 147.954 1.00 0.00 H TER 54353 WAT 1168 ATOM 54353 O WAT 1169 59.859 0.257 15.144 1.00 0.00 O ATOM 54354 H1 WAT 1169 59.079 0.448 15.665 1.00 0.00 H ATOM 54355 H2 WAT 1169 59.599 -0.474 14.583 1.00 0.00 H TER 54357 WAT 1169 ATOM 54357 O WAT 1170 11.971 78.427 157.995 1.00 0.00 O ATOM 54358 H1 WAT 1170 11.837 77.948 158.813 1.00 0.00 H ATOM 54359 H2 WAT 1170 12.705 79.013 158.179 1.00 0.00 H TER 54361 WAT 1170 ATOM 54361 O WAT 1171 143.622 140.984 1.058 1.00 0.00 O ATOM 54362 H1 WAT 1171 142.995 140.939 0.336 1.00 0.00 H ATOM 54363 H2 WAT 1171 144.177 140.213 0.942 1.00 0.00 H TER 54365 WAT 1171 ATOM 54365 O WAT 1172 25.866 8.772 130.304 1.00 0.00 O ATOM 54366 H1 WAT 1172 26.556 9.420 130.163 1.00 0.00 H ATOM 54367 H2 WAT 1172 26.009 8.118 129.619 1.00 0.00 H TER 54369 WAT 1172 ATOM 54369 O WAT 1173 100.804 61.476 73.658 1.00 0.00 O ATOM 54370 H1 WAT 1173 101.562 61.280 74.210 1.00 0.00 H ATOM 54371 H2 WAT 1173 100.137 61.786 74.270 1.00 0.00 H TER 54373 WAT 1173 ATOM 54373 O WAT 1174 61.835 29.804 135.276 1.00 0.00 O ATOM 54374 H1 WAT 1174 60.947 30.083 135.052 1.00 0.00 H ATOM 54375 H2 WAT 1174 62.398 30.294 134.678 1.00 0.00 H TER 54377 WAT 1174 ATOM 54377 O WAT 1175 36.607 4.921 7.410 1.00 0.00 O ATOM 54378 H1 WAT 1175 36.682 5.124 8.342 1.00 0.00 H ATOM 54379 H2 WAT 1175 35.673 4.765 7.272 1.00 0.00 H TER 54381 WAT 1175 ATOM 54381 O WAT 1176 131.425 62.113 117.120 1.00 0.00 O ATOM 54382 H1 WAT 1176 131.390 62.616 116.306 1.00 0.00 H ATOM 54383 H2 WAT 1176 132.044 62.592 117.671 1.00 0.00 H TER 54385 WAT 1176 ATOM 54385 O WAT 1177 122.254 2.997 146.720 1.00 0.00 O ATOM 54386 H1 WAT 1177 122.040 3.915 146.553 1.00 0.00 H ATOM 54387 H2 WAT 1177 122.955 3.029 147.372 1.00 0.00 H TER 54389 WAT 1177 ATOM 54389 O WAT 1178 44.587 12.356 113.652 1.00 0.00 O ATOM 54390 H1 WAT 1178 45.433 11.916 113.568 1.00 0.00 H ATOM 54391 H2 WAT 1178 44.152 12.200 112.814 1.00 0.00 H TER 54393 WAT 1178 ATOM 54393 O WAT 1179 135.205 130.701 108.405 1.00 0.00 O ATOM 54394 H1 WAT 1179 135.724 131.226 107.796 1.00 0.00 H ATOM 54395 H2 WAT 1179 135.793 129.996 108.676 1.00 0.00 H TER 54397 WAT 1179 ATOM 54397 O WAT 1180 112.892 98.697 127.895 1.00 0.00 O ATOM 54398 H1 WAT 1180 113.412 98.035 128.351 1.00 0.00 H ATOM 54399 H2 WAT 1180 113.152 99.526 128.299 1.00 0.00 H TER 54401 WAT 1180 ATOM 54401 O WAT 1181 5.937 135.632 87.352 1.00 0.00 O ATOM 54402 H1 WAT 1181 6.819 135.636 87.724 1.00 0.00 H ATOM 54403 H2 WAT 1181 5.388 136.015 88.035 1.00 0.00 H TER 54405 WAT 1181 ATOM 54405 O WAT 1182 12.752 22.998 14.035 1.00 0.00 O ATOM 54406 H1 WAT 1182 11.928 22.832 13.577 1.00 0.00 H ATOM 54407 H2 WAT 1182 13.046 22.133 14.321 1.00 0.00 H TER 54409 WAT 1182 ATOM 54409 O WAT 1183 16.683 78.597 107.463 1.00 0.00 O ATOM 54410 H1 WAT 1183 16.890 78.308 108.351 1.00 0.00 H ATOM 54411 H2 WAT 1183 16.981 77.881 106.902 1.00 0.00 H TER 54413 WAT 1183 ATOM 54413 O WAT 1184 118.331 135.300 116.551 1.00 0.00 O ATOM 54414 H1 WAT 1184 118.937 134.879 117.161 1.00 0.00 H ATOM 54415 H2 WAT 1184 118.812 136.058 116.219 1.00 0.00 H TER 54417 WAT 1184 ATOM 54417 O WAT 1185 51.395 26.044 73.558 1.00 0.00 O ATOM 54418 H1 WAT 1185 51.540 25.845 74.483 1.00 0.00 H ATOM 54419 H2 WAT 1185 51.984 25.451 73.091 1.00 0.00 H TER 54421 WAT 1185 ATOM 54421 O WAT 1186 17.130 98.134 110.040 1.00 0.00 O ATOM 54422 H1 WAT 1186 17.079 97.280 109.610 1.00 0.00 H ATOM 54423 H2 WAT 1186 16.737 98.742 109.414 1.00 0.00 H TER 54425 WAT 1186 ATOM 54425 O WAT 1187 92.113 64.926 78.177 1.00 0.00 O ATOM 54426 H1 WAT 1187 91.979 64.953 79.124 1.00 0.00 H ATOM 54427 H2 WAT 1187 91.368 65.407 77.816 1.00 0.00 H TER 54429 WAT 1187 ATOM 54429 O WAT 1188 127.050 117.890 155.611 1.00 0.00 O ATOM 54430 H1 WAT 1188 127.280 118.447 154.868 1.00 0.00 H ATOM 54431 H2 WAT 1188 127.803 117.309 155.717 1.00 0.00 H TER 54433 WAT 1188 ATOM 54433 O WAT 1189 46.687 5.121 52.631 1.00 0.00 O ATOM 54434 H1 WAT 1189 46.007 5.042 51.962 1.00 0.00 H ATOM 54435 H2 WAT 1189 46.680 4.277 53.082 1.00 0.00 H TER 54437 WAT 1189 ATOM 54437 O WAT 1190 83.135 110.465 68.873 1.00 0.00 O ATOM 54438 H1 WAT 1190 83.413 109.761 69.458 1.00 0.00 H ATOM 54439 H2 WAT 1190 82.711 111.101 69.449 1.00 0.00 H TER 54441 WAT 1190 ATOM 54441 O WAT 1191 124.002 33.036 24.027 1.00 0.00 O ATOM 54442 H1 WAT 1191 124.229 32.282 23.484 1.00 0.00 H ATOM 54443 H2 WAT 1191 123.202 33.384 23.632 1.00 0.00 H TER 54445 WAT 1191 ATOM 54445 O WAT 1192 101.319 17.346 101.084 1.00 0.00 O ATOM 54446 H1 WAT 1192 100.625 16.690 101.148 1.00 0.00 H ATOM 54447 H2 WAT 1192 101.610 17.299 100.173 1.00 0.00 H TER 54449 WAT 1192 ATOM 54449 O WAT 1193 107.875 70.943 86.618 1.00 0.00 O ATOM 54450 H1 WAT 1193 108.447 70.757 85.873 1.00 0.00 H ATOM 54451 H2 WAT 1193 107.182 71.496 86.255 1.00 0.00 H TER 54453 WAT 1193 ATOM 54453 O WAT 1194 74.183 21.091 125.984 1.00 0.00 O ATOM 54454 H1 WAT 1194 73.702 21.795 125.550 1.00 0.00 H ATOM 54455 H2 WAT 1194 74.159 20.365 125.360 1.00 0.00 H TER 54457 WAT 1194 ATOM 54457 O WAT 1195 40.879 11.798 91.947 1.00 0.00 O ATOM 54458 H1 WAT 1195 41.536 12.254 92.474 1.00 0.00 H ATOM 54459 H2 WAT 1195 40.571 11.089 92.511 1.00 0.00 H TER 54461 WAT 1195 ATOM 54461 O WAT 1196 4.789 29.760 111.823 1.00 0.00 O ATOM 54462 H1 WAT 1196 3.868 29.562 111.995 1.00 0.00 H ATOM 54463 H2 WAT 1196 5.270 29.250 112.475 1.00 0.00 H TER 54465 WAT 1196 ATOM 54465 O WAT 1197 13.928 102.608 72.449 1.00 0.00 O ATOM 54466 H1 WAT 1197 13.645 102.444 73.349 1.00 0.00 H ATOM 54467 H2 WAT 1197 14.773 102.163 72.379 1.00 0.00 H TER 54469 WAT 1197 ATOM 54469 O WAT 1198 46.135 140.614 156.658 1.00 0.00 O ATOM 54470 H1 WAT 1198 46.393 141.244 157.331 1.00 0.00 H ATOM 54471 H2 WAT 1198 46.268 139.759 157.067 1.00 0.00 H TER 54473 WAT 1198 ATOM 54473 O WAT 1199 88.414 141.881 136.142 1.00 0.00 O ATOM 54474 H1 WAT 1199 87.898 141.221 136.606 1.00 0.00 H ATOM 54475 H2 WAT 1199 88.865 142.362 136.836 1.00 0.00 H TER 54477 WAT 1199 ATOM 54477 O WAT 1200 63.828 9.550 80.849 1.00 0.00 O ATOM 54478 H1 WAT 1200 64.632 9.392 81.343 1.00 0.00 H ATOM 54479 H2 WAT 1200 63.289 10.083 81.433 1.00 0.00 H TER 54481 WAT 1200 ATOM 54481 O WAT 1201 52.121 71.114 90.098 1.00 0.00 O ATOM 54482 H1 WAT 1201 51.823 71.707 90.788 1.00 0.00 H ATOM 54483 H2 WAT 1201 51.759 70.262 90.342 1.00 0.00 H TER 54485 WAT 1201 ATOM 54485 O WAT 1202 54.165 11.607 111.530 1.00 0.00 O ATOM 54486 H1 WAT 1202 53.360 11.171 111.251 1.00 0.00 H ATOM 54487 H2 WAT 1202 54.832 10.921 111.497 1.00 0.00 H TER 54489 WAT 1202 ATOM 54489 O WAT 1203 56.784 23.052 86.685 1.00 0.00 O ATOM 54490 H1 WAT 1203 56.633 23.921 87.056 1.00 0.00 H ATOM 54491 H2 WAT 1203 55.964 22.582 86.835 1.00 0.00 H TER 54493 WAT 1203 ATOM 54493 O WAT 1204 7.536 27.671 106.300 1.00 0.00 O ATOM 54494 H1 WAT 1204 7.239 28.578 106.221 1.00 0.00 H ATOM 54495 H2 WAT 1204 7.086 27.209 105.593 1.00 0.00 H TER 54497 WAT 1204 ATOM 54497 O WAT 1205 48.781 29.098 98.275 1.00 0.00 O ATOM 54498 H1 WAT 1205 49.026 28.314 97.783 1.00 0.00 H ATOM 54499 H2 WAT 1205 48.787 28.819 99.190 1.00 0.00 H TER 54501 WAT 1205 ATOM 54501 O WAT 1206 127.303 56.103 92.553 1.00 0.00 O ATOM 54502 H1 WAT 1206 127.087 55.880 91.648 1.00 0.00 H ATOM 54503 H2 WAT 1206 126.456 56.258 92.971 1.00 0.00 H TER 54505 WAT 1206 ATOM 54505 O WAT 1207 85.472 131.254 26.161 1.00 0.00 O ATOM 54506 H1 WAT 1207 85.507 131.602 27.052 1.00 0.00 H ATOM 54507 H2 WAT 1207 84.545 131.295 25.925 1.00 0.00 H TER 54509 WAT 1207 ATOM 54509 O WAT 1208 58.965 31.250 84.822 1.00 0.00 O ATOM 54510 H1 WAT 1208 58.645 30.350 84.759 1.00 0.00 H ATOM 54511 H2 WAT 1208 59.908 31.180 84.673 1.00 0.00 H TER 54513 WAT 1208 ATOM 54513 O WAT 1209 107.874 86.193 20.628 1.00 0.00 O ATOM 54514 H1 WAT 1209 107.617 86.053 21.539 1.00 0.00 H ATOM 54515 H2 WAT 1209 108.721 86.636 20.683 1.00 0.00 H TER 54517 WAT 1209 ATOM 54517 O WAT 1210 98.767 97.005 74.790 1.00 0.00 O ATOM 54518 H1 WAT 1210 99.618 97.194 75.186 1.00 0.00 H ATOM 54519 H2 WAT 1210 98.964 96.394 74.081 1.00 0.00 H TER 54521 WAT 1210 ATOM 54521 O WAT 1211 125.330 130.242 158.329 1.00 0.00 O ATOM 54522 H1 WAT 1211 125.031 131.090 158.002 1.00 0.00 H ATOM 54523 H2 WAT 1211 126.284 130.279 158.252 1.00 0.00 H TER 54525 WAT 1211 ATOM 54525 O WAT 1212 110.251 129.224 137.262 1.00 0.00 O ATOM 54526 H1 WAT 1212 110.165 128.277 137.150 1.00 0.00 H ATOM 54527 H2 WAT 1212 110.965 129.327 137.891 1.00 0.00 H TER 54529 WAT 1212 ATOM 54529 O WAT 1213 138.138 102.489 142.625 1.00 0.00 O ATOM 54530 H1 WAT 1213 137.675 103.198 142.178 1.00 0.00 H ATOM 54531 H2 WAT 1213 139.065 102.695 142.504 1.00 0.00 H TER 54533 WAT 1213 ATOM 54533 O WAT 1214 30.961 58.318 92.797 1.00 0.00 O ATOM 54534 H1 WAT 1214 30.827 57.561 92.227 1.00 0.00 H ATOM 54535 H2 WAT 1214 30.866 59.074 92.217 1.00 0.00 H TER 54537 WAT 1214 ATOM 54537 O WAT 1215 27.049 27.078 153.032 1.00 0.00 O ATOM 54538 H1 WAT 1215 26.111 27.031 152.845 1.00 0.00 H ATOM 54539 H2 WAT 1215 27.194 26.406 153.698 1.00 0.00 H TER 54541 WAT 1215 ATOM 54541 O WAT 1216 84.120 71.199 7.954 1.00 0.00 O ATOM 54542 H1 WAT 1216 85.014 71.132 8.290 1.00 0.00 H ATOM 54543 H2 WAT 1216 83.977 72.139 7.839 1.00 0.00 H TER 54545 WAT 1216 ATOM 54545 O WAT 1217 144.533 101.757 138.556 1.00 0.00 O ATOM 54546 H1 WAT 1217 144.576 101.988 137.628 1.00 0.00 H ATOM 54547 H2 WAT 1217 145.259 101.146 138.684 1.00 0.00 H TER 54549 WAT 1217 ATOM 54549 O WAT 1218 33.351 108.142 146.498 1.00 0.00 O ATOM 54550 H1 WAT 1218 34.268 107.918 146.657 1.00 0.00 H ATOM 54551 H2 WAT 1218 32.949 107.320 146.219 1.00 0.00 H TER 54553 WAT 1218 ATOM 54553 O WAT 1219 131.802 110.847 80.616 1.00 0.00 O ATOM 54554 H1 WAT 1219 132.393 111.561 80.377 1.00 0.00 H ATOM 54555 H2 WAT 1219 131.276 111.202 81.333 1.00 0.00 H TER 54557 WAT 1219 ATOM 54557 O WAT 1220 27.395 51.530 13.779 1.00 0.00 O ATOM 54558 H1 WAT 1220 27.624 52.104 13.047 1.00 0.00 H ATOM 54559 H2 WAT 1220 27.510 52.076 14.556 1.00 0.00 H TER 54561 WAT 1220 ATOM 54561 O WAT 1221 26.787 78.865 146.289 1.00 0.00 O ATOM 54562 H1 WAT 1221 27.693 79.079 146.065 1.00 0.00 H ATOM 54563 H2 WAT 1221 26.294 79.046 145.489 1.00 0.00 H TER 54565 WAT 1221 ATOM 54565 O WAT 1222 30.729 10.979 154.019 1.00 0.00 O ATOM 54566 H1 WAT 1222 30.427 11.540 154.733 1.00 0.00 H ATOM 54567 H2 WAT 1222 31.664 11.170 153.944 1.00 0.00 H TER 54569 WAT 1222 ATOM 54569 O WAT 1223 143.423 10.483 142.518 1.00 0.00 O ATOM 54570 H1 WAT 1223 142.853 11.220 142.299 1.00 0.00 H ATOM 54571 H2 WAT 1223 142.823 9.786 142.781 1.00 0.00 H TER 54573 WAT 1223 ATOM 54573 O WAT 1224 45.721 25.721 142.407 1.00 0.00 O ATOM 54574 H1 WAT 1224 45.922 26.589 142.059 1.00 0.00 H ATOM 54575 H2 WAT 1224 45.429 25.883 143.304 1.00 0.00 H TER 54577 WAT 1224 ATOM 54577 O WAT 1225 54.025 18.600 70.060 1.00 0.00 O ATOM 54578 H1 WAT 1225 53.186 18.197 69.836 1.00 0.00 H ATOM 54579 H2 WAT 1225 54.656 18.179 69.476 1.00 0.00 H TER 54581 WAT 1225 ATOM 54581 O WAT 1226 78.279 116.301 13.788 1.00 0.00 O ATOM 54582 H1 WAT 1226 77.994 117.129 14.176 1.00 0.00 H ATOM 54583 H2 WAT 1226 77.510 115.979 13.319 1.00 0.00 H TER 54585 WAT 1226 ATOM 54585 O WAT 1227 95.728 117.115 83.699 1.00 0.00 O ATOM 54586 H1 WAT 1227 96.490 116.762 83.240 1.00 0.00 H ATOM 54587 H2 WAT 1227 95.942 117.022 84.627 1.00 0.00 H TER 54589 WAT 1227 ATOM 54589 O WAT 1228 139.738 17.031 11.401 1.00 0.00 O ATOM 54590 H1 WAT 1228 140.072 17.839 11.011 1.00 0.00 H ATOM 54591 H2 WAT 1228 139.953 17.107 12.331 1.00 0.00 H TER 54593 WAT 1228 ATOM 54593 O WAT 1229 105.744 2.077 112.943 1.00 0.00 O ATOM 54594 H1 WAT 1229 106.596 2.176 112.517 1.00 0.00 H ATOM 54595 H2 WAT 1229 105.890 2.373 113.841 1.00 0.00 H TER 54597 WAT 1229 ATOM 54597 O WAT 1230 19.131 71.942 140.209 1.00 0.00 O ATOM 54598 H1 WAT 1230 18.391 72.522 140.028 1.00 0.00 H ATOM 54599 H2 WAT 1230 19.811 72.226 139.598 1.00 0.00 H TER 54601 WAT 1230 ATOM 54601 O WAT 1231 28.207 135.830 99.966 1.00 0.00 O ATOM 54602 H1 WAT 1231 27.969 135.059 99.452 1.00 0.00 H ATOM 54603 H2 WAT 1231 28.148 136.558 99.348 1.00 0.00 H TER 54605 WAT 1231 ATOM 54605 O WAT 1232 134.181 137.859 140.867 1.00 0.00 O ATOM 54606 H1 WAT 1232 135.006 137.604 140.455 1.00 0.00 H ATOM 54607 H2 WAT 1232 134.368 138.708 141.269 1.00 0.00 H TER 54609 WAT 1232 ATOM 54609 O WAT 1233 36.480 94.315 109.801 1.00 0.00 O ATOM 54610 H1 WAT 1233 35.695 94.427 109.264 1.00 0.00 H ATOM 54611 H2 WAT 1233 36.163 94.374 110.702 1.00 0.00 H TER 54613 WAT 1233 ATOM 54613 O WAT 1234 133.863 21.372 129.483 1.00 0.00 O ATOM 54614 H1 WAT 1234 134.600 21.325 128.873 1.00 0.00 H ATOM 54615 H2 WAT 1234 133.724 20.466 129.760 1.00 0.00 H TER 54617 WAT 1234 ATOM 54617 O WAT 1235 111.417 97.227 125.811 1.00 0.00 O ATOM 54618 H1 WAT 1235 111.977 97.836 126.293 1.00 0.00 H ATOM 54619 H2 WAT 1235 111.377 96.448 126.367 1.00 0.00 H TER 54621 WAT 1235 ATOM 54621 O WAT 1236 56.303 110.348 149.881 1.00 0.00 O ATOM 54622 H1 WAT 1236 55.418 110.206 149.546 1.00 0.00 H ATOM 54623 H2 WAT 1236 56.300 109.939 150.747 1.00 0.00 H TER 54625 WAT 1236 ATOM 54625 O WAT 1237 111.178 33.429 156.585 1.00 0.00 O ATOM 54626 H1 WAT 1237 110.579 33.020 155.960 1.00 0.00 H ATOM 54627 H2 WAT 1237 110.833 34.314 156.703 1.00 0.00 H TER 54629 WAT 1237 ATOM 54629 O WAT 1238 117.637 38.986 18.746 1.00 0.00 O ATOM 54630 H1 WAT 1238 116.841 38.843 18.233 1.00 0.00 H ATOM 54631 H2 WAT 1238 117.672 38.243 19.347 1.00 0.00 H TER 54633 WAT 1238 ATOM 54633 O WAT 1239 85.992 129.872 77.698 1.00 0.00 O ATOM 54634 H1 WAT 1239 85.323 129.957 77.018 1.00 0.00 H ATOM 54635 H2 WAT 1239 86.293 130.767 77.852 1.00 0.00 H TER 54637 WAT 1239 ATOM 54637 O WAT 1240 37.165 24.543 77.893 1.00 0.00 O ATOM 54638 H1 WAT 1240 37.249 23.620 78.134 1.00 0.00 H ATOM 54639 H2 WAT 1240 37.243 25.015 78.722 1.00 0.00 H TER 54641 WAT 1240 ATOM 54641 O WAT 1241 107.385 125.388 152.041 1.00 0.00 O ATOM 54642 H1 WAT 1241 107.663 126.300 151.962 1.00 0.00 H ATOM 54643 H2 WAT 1241 108.143 124.938 152.415 1.00 0.00 H TER 54645 WAT 1241 ATOM 54645 O WAT 1242 55.010 45.316 103.480 1.00 0.00 O ATOM 54646 H1 WAT 1242 55.837 45.092 103.053 1.00 0.00 H ATOM 54647 H2 WAT 1242 55.270 45.705 104.315 1.00 0.00 H TER 54649 WAT 1242 ATOM 54649 O WAT 1243 123.808 109.403 150.797 1.00 0.00 O ATOM 54650 H1 WAT 1243 123.067 109.925 150.490 1.00 0.00 H ATOM 54651 H2 WAT 1243 124.580 109.891 150.508 1.00 0.00 H TER 54653 WAT 1243 ATOM 54653 O WAT 1244 37.183 9.786 26.882 1.00 0.00 O ATOM 54654 H1 WAT 1244 37.261 10.731 27.012 1.00 0.00 H ATOM 54655 H2 WAT 1244 37.521 9.638 25.999 1.00 0.00 H TER 54657 WAT 1244 ATOM 54657 O WAT 1245 135.517 9.131 153.613 1.00 0.00 O ATOM 54658 H1 WAT 1245 134.928 8.378 153.569 1.00 0.00 H ATOM 54659 H2 WAT 1245 134.984 9.870 153.318 1.00 0.00 H TER 54661 WAT 1245 ATOM 54661 O WAT 1246 124.288 136.129 152.554 1.00 0.00 O ATOM 54662 H1 WAT 1246 123.726 136.887 152.719 1.00 0.00 H ATOM 54663 H2 WAT 1246 125.178 136.478 152.593 1.00 0.00 H TER 54665 WAT 1246 ATOM 54665 O WAT 1247 4.929 98.180 142.212 1.00 0.00 O ATOM 54666 H1 WAT 1247 5.842 98.270 142.487 1.00 0.00 H ATOM 54667 H2 WAT 1247 4.733 97.251 142.333 1.00 0.00 H TER 54669 WAT 1247 ATOM 54669 O WAT 1248 112.737 7.723 127.869 1.00 0.00 O ATOM 54670 H1 WAT 1248 112.545 8.194 127.058 1.00 0.00 H ATOM 54671 H2 WAT 1248 113.636 7.972 128.083 1.00 0.00 H TER 54673 WAT 1248 ATOM 54673 O WAT 1249 138.456 91.775 146.042 1.00 0.00 O ATOM 54674 H1 WAT 1249 138.598 91.117 145.361 1.00 0.00 H ATOM 54675 H2 WAT 1249 138.217 92.569 145.562 1.00 0.00 H TER 54677 WAT 1249 ATOM 54677 O WAT 1250 101.992 20.534 10.913 1.00 0.00 O ATOM 54678 H1 WAT 1250 101.740 21.397 11.241 1.00 0.00 H ATOM 54679 H2 WAT 1250 102.111 20.003 11.700 1.00 0.00 H TER 54681 WAT 1250 ATOM 54681 O WAT 1251 96.939 68.269 4.819 1.00 0.00 O ATOM 54682 H1 WAT 1251 97.841 68.460 4.562 1.00 0.00 H ATOM 54683 H2 WAT 1251 96.440 68.330 4.005 1.00 0.00 H TER 54685 WAT 1251 ATOM 54685 O WAT 1252 12.178 89.317 23.162 1.00 0.00 O ATOM 54686 H1 WAT 1252 12.430 90.057 23.714 1.00 0.00 H ATOM 54687 H2 WAT 1252 12.107 89.688 22.282 1.00 0.00 H TER 54689 WAT 1252 ATOM 54689 O WAT 1253 128.836 136.578 60.647 1.00 0.00 O ATOM 54690 H1 WAT 1253 129.216 135.872 61.169 1.00 0.00 H ATOM 54691 H2 WAT 1253 127.891 136.440 60.707 1.00 0.00 H TER 54693 WAT 1253 ATOM 54693 O WAT 1254 127.513 29.241 78.739 1.00 0.00 O ATOM 54694 H1 WAT 1254 127.984 28.819 79.457 1.00 0.00 H ATOM 54695 H2 WAT 1254 127.219 30.076 79.104 1.00 0.00 H TER 54697 WAT 1254 ATOM 54697 O WAT 1255 130.465 116.774 3.459 1.00 0.00 O ATOM 54698 H1 WAT 1255 131.222 116.536 2.923 1.00 0.00 H ATOM 54699 H2 WAT 1255 130.219 117.646 3.150 1.00 0.00 H TER 54701 WAT 1255 ATOM 54701 O WAT 1256 132.410 77.176 15.777 1.00 0.00 O ATOM 54702 H1 WAT 1256 131.518 77.155 16.123 1.00 0.00 H ATOM 54703 H2 WAT 1256 132.340 76.775 14.911 1.00 0.00 H TER 54705 WAT 1256 ATOM 54705 O WAT 1257 45.972 38.391 107.584 1.00 0.00 O ATOM 54706 H1 WAT 1257 46.544 38.427 106.817 1.00 0.00 H ATOM 54707 H2 WAT 1257 45.153 38.020 107.255 1.00 0.00 H TER 54709 WAT 1257 ATOM 54709 O WAT 1258 4.420 59.437 100.153 1.00 0.00 O ATOM 54710 H1 WAT 1258 4.031 59.790 99.353 1.00 0.00 H ATOM 54711 H2 WAT 1258 4.970 60.147 100.486 1.00 0.00 H TER 54713 WAT 1258 ATOM 54713 O WAT 1259 60.529 47.281 130.717 1.00 0.00 O ATOM 54714 H1 WAT 1259 61.484 47.245 130.765 1.00 0.00 H ATOM 54715 H2 WAT 1259 60.308 48.169 130.997 1.00 0.00 H TER 54717 WAT 1259 ATOM 54717 O WAT 1260 90.527 117.274 92.593 1.00 0.00 O ATOM 54718 H1 WAT 1260 91.129 116.848 91.983 1.00 0.00 H ATOM 54719 H2 WAT 1260 90.158 116.555 93.106 1.00 0.00 H TER 54721 WAT 1260 ATOM 54721 O WAT 1261 4.246 131.504 64.170 1.00 0.00 O ATOM 54722 H1 WAT 1261 5.173 131.676 64.332 1.00 0.00 H ATOM 54723 H2 WAT 1261 3.835 131.575 65.032 1.00 0.00 H TER 54725 WAT 1261 ATOM 54725 O WAT 1262 32.450 77.157 71.574 1.00 0.00 O ATOM 54726 H1 WAT 1262 32.806 76.636 72.294 1.00 0.00 H ATOM 54727 H2 WAT 1262 31.552 77.353 71.841 1.00 0.00 H TER 54729 WAT 1262 ATOM 54729 O WAT 1263 27.932 34.093 5.500 1.00 0.00 O ATOM 54730 H1 WAT 1263 27.827 33.153 5.353 1.00 0.00 H ATOM 54731 H2 WAT 1263 27.072 34.464 5.300 1.00 0.00 H TER 54733 WAT 1263 ATOM 54733 O WAT 1264 80.788 25.429 98.226 1.00 0.00 O ATOM 54734 H1 WAT 1264 79.897 25.511 98.567 1.00 0.00 H ATOM 54735 H2 WAT 1264 81.349 25.596 98.983 1.00 0.00 H TER 54737 WAT 1264 ATOM 54737 O WAT 1265 0.079 58.701 156.752 1.00 0.00 O ATOM 54738 H1 WAT 1265 0.755 58.298 157.297 1.00 0.00 H ATOM 54739 H2 WAT 1265 -0.724 58.619 157.267 1.00 0.00 H TER 54741 WAT 1265 ATOM 54741 O WAT 1266 61.499 121.415 69.060 1.00 0.00 O ATOM 54742 H1 WAT 1266 62.398 121.591 69.337 1.00 0.00 H ATOM 54743 H2 WAT 1266 60.992 121.423 69.873 1.00 0.00 H TER 54745 WAT 1266 ATOM 54745 O WAT 1267 37.931 90.716 27.985 1.00 0.00 O ATOM 54746 H1 WAT 1267 38.419 91.295 28.572 1.00 0.00 H ATOM 54747 H2 WAT 1267 37.433 91.310 27.423 1.00 0.00 H TER 54749 WAT 1267 ATOM 54749 O WAT 1268 125.961 137.659 68.463 1.00 0.00 O ATOM 54750 H1 WAT 1268 125.070 137.373 68.260 1.00 0.00 H ATOM 54751 H2 WAT 1268 126.082 137.429 69.384 1.00 0.00 H TER 54753 WAT 1268 ATOM 54753 O WAT 1269 99.317 115.908 142.082 1.00 0.00 O ATOM 54754 H1 WAT 1269 98.687 115.562 141.450 1.00 0.00 H ATOM 54755 H2 WAT 1269 99.234 116.859 142.007 1.00 0.00 H TER 54757 WAT 1269 ATOM 54757 O WAT 1270 96.699 36.823 132.339 1.00 0.00 O ATOM 54758 H1 WAT 1270 96.375 37.625 131.928 1.00 0.00 H ATOM 54759 H2 WAT 1270 96.498 36.932 133.268 1.00 0.00 H TER 54761 WAT 1270 ATOM 54761 O WAT 1271 137.875 111.275 157.873 1.00 0.00 O ATOM 54762 H1 WAT 1271 137.041 110.903 158.160 1.00 0.00 H ATOM 54763 H2 WAT 1271 138.537 110.774 158.350 1.00 0.00 H TER 54765 WAT 1271 ATOM 54765 O WAT 1272 96.217 58.375 117.072 1.00 0.00 O ATOM 54766 H1 WAT 1272 96.140 59.328 117.024 1.00 0.00 H ATOM 54767 H2 WAT 1272 97.127 58.196 116.834 1.00 0.00 H TER 54769 WAT 1272 ATOM 54769 O WAT 1273 7.662 37.835 9.391 1.00 0.00 O ATOM 54770 H1 WAT 1273 8.484 37.363 9.518 1.00 0.00 H ATOM 54771 H2 WAT 1273 7.587 38.399 10.160 1.00 0.00 H TER 54773 WAT 1273 ATOM 54773 O WAT 1274 10.135 123.317 3.692 1.00 0.00 O ATOM 54774 H1 WAT 1274 10.601 124.019 3.238 1.00 0.00 H ATOM 54775 H2 WAT 1274 10.824 122.717 3.975 1.00 0.00 H TER 54777 WAT 1274 ATOM 54777 O WAT 1275 74.721 113.112 127.568 1.00 0.00 O ATOM 54778 H1 WAT 1275 74.944 113.296 126.656 1.00 0.00 H ATOM 54779 H2 WAT 1275 73.774 113.246 127.615 1.00 0.00 H TER 54781 WAT 1275 ATOM 54781 O WAT 1276 85.646 87.665 88.532 1.00 0.00 O ATOM 54782 H1 WAT 1276 85.063 86.954 88.264 1.00 0.00 H ATOM 54783 H2 WAT 1276 85.779 88.178 87.735 1.00 0.00 H TER 54785 WAT 1276 ATOM 54785 O WAT 1277 86.517 17.224 20.686 1.00 0.00 O ATOM 54786 H1 WAT 1277 86.214 17.638 21.494 1.00 0.00 H ATOM 54787 H2 WAT 1277 87.280 16.710 20.952 1.00 0.00 H TER 54789 WAT 1277 ATOM 54789 O WAT 1278 37.280 89.432 84.702 1.00 0.00 O ATOM 54790 H1 WAT 1278 38.223 89.583 84.768 1.00 0.00 H ATOM 54791 H2 WAT 1278 37.172 88.502 84.897 1.00 0.00 H TER 54793 WAT 1278 ATOM 54793 O WAT 1279 94.389 42.477 125.875 1.00 0.00 O ATOM 54794 H1 WAT 1279 95.126 41.965 126.209 1.00 0.00 H ATOM 54795 H2 WAT 1279 94.186 42.080 125.028 1.00 0.00 H TER 54797 WAT 1279 ATOM 54797 O WAT 1280 144.367 15.073 85.580 1.00 0.00 O ATOM 54798 H1 WAT 1280 143.645 15.363 85.022 1.00 0.00 H ATOM 54799 H2 WAT 1280 144.792 14.378 85.079 1.00 0.00 H TER 54801 WAT 1280 ATOM 54801 O WAT 1281 106.365 144.478 18.236 1.00 0.00 O ATOM 54802 H1 WAT 1281 106.981 145.167 17.990 1.00 0.00 H ATOM 54803 H2 WAT 1281 106.901 143.829 18.693 1.00 0.00 H TER 54805 WAT 1281 ATOM 54805 O WAT 1282 85.551 24.787 125.600 1.00 0.00 O ATOM 54806 H1 WAT 1282 84.876 24.321 126.092 1.00 0.00 H ATOM 54807 H2 WAT 1282 86.367 24.342 125.831 1.00 0.00 H TER 54809 WAT 1282 ATOM 54809 O WAT 1283 12.568 5.065 61.589 1.00 0.00 O ATOM 54810 H1 WAT 1283 13.055 4.287 61.317 1.00 0.00 H ATOM 54811 H2 WAT 1283 11.896 4.730 62.183 1.00 0.00 H TER 54813 WAT 1283 ATOM 54813 O WAT 1284 103.197 135.869 112.156 1.00 0.00 O ATOM 54814 H1 WAT 1284 103.532 136.384 112.890 1.00 0.00 H ATOM 54815 H2 WAT 1284 102.392 135.472 112.490 1.00 0.00 H TER 54817 WAT 1284 ATOM 54817 O WAT 1285 95.458 102.620 86.226 1.00 0.00 O ATOM 54818 H1 WAT 1285 95.700 101.792 86.643 1.00 0.00 H ATOM 54819 H2 WAT 1285 95.331 102.395 85.304 1.00 0.00 H TER 54821 WAT 1285 ATOM 54821 O WAT 1286 145.591 61.039 76.397 1.00 0.00 O ATOM 54822 H1 WAT 1286 145.985 61.869 76.126 1.00 0.00 H ATOM 54823 H2 WAT 1286 145.833 60.949 77.319 1.00 0.00 H TER 54825 WAT 1286 ATOM 54825 O WAT 1287 31.496 83.023 69.925 1.00 0.00 O ATOM 54826 H1 WAT 1287 30.710 83.547 70.081 1.00 0.00 H ATOM 54827 H2 WAT 1287 31.526 82.412 70.661 1.00 0.00 H TER 54829 WAT 1287 ATOM 54829 O WAT 1288 117.111 69.330 14.369 1.00 0.00 O ATOM 54830 H1 WAT 1288 116.718 70.187 14.204 1.00 0.00 H ATOM 54831 H2 WAT 1288 116.651 68.737 13.776 1.00 0.00 H TER 54833 WAT 1288 ATOM 54833 O WAT 1289 65.456 53.008 143.179 1.00 0.00 O ATOM 54834 H1 WAT 1289 66.257 53.531 143.219 1.00 0.00 H ATOM 54835 H2 WAT 1289 65.303 52.876 142.244 1.00 0.00 H TER 54837 WAT 1289 ATOM 54837 O WAT 1290 44.358 18.848 26.208 1.00 0.00 O ATOM 54838 H1 WAT 1290 43.800 19.272 26.860 1.00 0.00 H ATOM 54839 H2 WAT 1290 44.134 19.280 25.384 1.00 0.00 H TER 54841 WAT 1290 ATOM 54841 O WAT 1291 37.274 140.809 116.232 1.00 0.00 O ATOM 54842 H1 WAT 1291 37.990 141.014 116.833 1.00 0.00 H ATOM 54843 H2 WAT 1291 37.352 139.867 116.078 1.00 0.00 H TER 54845 WAT 1291 ATOM 54845 O WAT 1292 111.125 89.603 149.376 1.00 0.00 O ATOM 54846 H1 WAT 1292 110.950 89.346 150.282 1.00 0.00 H ATOM 54847 H2 WAT 1292 111.043 88.792 148.876 1.00 0.00 H TER 54849 WAT 1292 ATOM 54849 O WAT 1293 30.015 114.734 107.991 1.00 0.00 O ATOM 54850 H1 WAT 1293 30.195 113.998 107.406 1.00 0.00 H ATOM 54851 H2 WAT 1293 30.268 114.418 108.858 1.00 0.00 H TER 54853 WAT 1293 ATOM 54853 O WAT 1294 53.333 96.351 121.685 1.00 0.00 O ATOM 54854 H1 WAT 1294 53.757 95.547 121.983 1.00 0.00 H ATOM 54855 H2 WAT 1294 53.793 96.580 120.878 1.00 0.00 H TER 54857 WAT 1294 ATOM 54857 O WAT 1295 57.369 112.598 105.949 1.00 0.00 O ATOM 54858 H1 WAT 1295 57.346 112.094 105.136 1.00 0.00 H ATOM 54859 H2 WAT 1295 57.424 113.510 105.663 1.00 0.00 H TER 54861 WAT 1295 ATOM 54861 O WAT 1296 41.160 49.230 134.815 1.00 0.00 O ATOM 54862 H1 WAT 1296 41.292 49.750 134.022 1.00 0.00 H ATOM 54863 H2 WAT 1296 41.984 49.311 135.294 1.00 0.00 H TER 54865 WAT 1296 ATOM 54865 O WAT 1297 76.242 101.666 137.067 1.00 0.00 O ATOM 54866 H1 WAT 1297 76.965 101.811 136.456 1.00 0.00 H ATOM 54867 H2 WAT 1297 76.113 100.718 137.064 1.00 0.00 H TER 54869 WAT 1297 ATOM 54869 O WAT 1298 37.039 87.595 14.772 1.00 0.00 O ATOM 54870 H1 WAT 1298 37.944 87.746 15.043 1.00 0.00 H ATOM 54871 H2 WAT 1298 36.865 88.276 14.123 1.00 0.00 H TER 54873 WAT 1298 ATOM 54873 O WAT 1299 116.265 86.735 88.287 1.00 0.00 O ATOM 54874 H1 WAT 1299 117.002 86.970 87.724 1.00 0.00 H ATOM 54875 H2 WAT 1299 116.666 86.520 89.129 1.00 0.00 H TER 54877 WAT 1299 ATOM 54877 O WAT 1300 56.295 139.563 77.621 1.00 0.00 O ATOM 54878 H1 WAT 1300 57.198 139.306 77.434 1.00 0.00 H ATOM 54879 H2 WAT 1300 55.810 139.327 76.830 1.00 0.00 H TER 54881 WAT 1300 ATOM 54881 O WAT 1301 51.885 23.474 86.760 1.00 0.00 O ATOM 54882 H1 WAT 1301 51.878 24.378 86.444 1.00 0.00 H ATOM 54883 H2 WAT 1301 51.090 23.398 87.287 1.00 0.00 H TER 54885 WAT 1301 ATOM 54885 O WAT 1302 125.230 116.511 99.494 1.00 0.00 O ATOM 54886 H1 WAT 1302 125.260 117.450 99.678 1.00 0.00 H ATOM 54887 H2 WAT 1302 125.828 116.123 100.133 1.00 0.00 H TER 54889 WAT 1302 ATOM 54889 O WAT 1303 2.870 2.384 22.650 1.00 0.00 O ATOM 54890 H1 WAT 1303 2.490 3.212 22.357 1.00 0.00 H ATOM 54891 H2 WAT 1303 3.756 2.614 22.931 1.00 0.00 H TER 54893 WAT 1303 ATOM 54893 O WAT 1304 38.731 132.556 88.887 1.00 0.00 O ATOM 54894 H1 WAT 1304 37.804 132.719 89.063 1.00 0.00 H ATOM 54895 H2 WAT 1304 38.766 132.354 87.952 1.00 0.00 H TER 54897 WAT 1304 ATOM 54897 O WAT 1305 72.469 141.173 18.941 1.00 0.00 O ATOM 54898 H1 WAT 1305 72.228 141.055 19.860 1.00 0.00 H ATOM 54899 H2 WAT 1305 73.286 141.671 18.970 1.00 0.00 H TER 54901 WAT 1305 ATOM 54901 O WAT 1306 110.262 118.139 84.801 1.00 0.00 O ATOM 54902 H1 WAT 1306 109.777 118.363 84.007 1.00 0.00 H ATOM 54903 H2 WAT 1306 111.181 118.155 84.533 1.00 0.00 H TER 54905 WAT 1306 ATOM 54905 O WAT 1307 110.172 105.076 79.774 1.00 0.00 O ATOM 54906 H1 WAT 1307 110.122 104.504 79.008 1.00 0.00 H ATOM 54907 H2 WAT 1307 109.259 105.232 80.015 1.00 0.00 H TER 54909 WAT 1307 ATOM 54909 O WAT 1308 122.234 32.192 143.885 1.00 0.00 O ATOM 54910 H1 WAT 1308 121.901 32.570 143.071 1.00 0.00 H ATOM 54911 H2 WAT 1308 121.704 31.407 144.019 1.00 0.00 H TER 54913 WAT 1308 ATOM 54913 O WAT 1309 136.040 135.531 75.875 1.00 0.00 O ATOM 54914 H1 WAT 1309 136.276 134.604 75.918 1.00 0.00 H ATOM 54915 H2 WAT 1309 136.217 135.781 74.968 1.00 0.00 H TER 54917 WAT 1309 ATOM 54917 O WAT 1310 59.108 64.032 140.316 1.00 0.00 O ATOM 54918 H1 WAT 1310 58.441 63.926 140.994 1.00 0.00 H ATOM 54919 H2 WAT 1310 59.771 64.593 140.717 1.00 0.00 H TER 54921 WAT 1310 ATOM 54921 O WAT 1311 45.791 114.192 67.025 1.00 0.00 O ATOM 54922 H1 WAT 1311 45.179 113.492 66.794 1.00 0.00 H ATOM 54923 H2 WAT 1311 46.621 113.742 67.184 1.00 0.00 H TER 54925 WAT 1311 ATOM 54925 O WAT 1312 143.670 46.811 146.530 1.00 0.00 O ATOM 54926 H1 WAT 1312 143.875 46.103 147.140 1.00 0.00 H ATOM 54927 H2 WAT 1312 144.114 47.577 146.893 1.00 0.00 H TER 54929 WAT 1312 ATOM 54929 O WAT 1313 14.050 105.320 87.824 1.00 0.00 O ATOM 54930 H1 WAT 1313 14.025 105.698 88.703 1.00 0.00 H ATOM 54931 H2 WAT 1313 13.578 104.492 87.906 1.00 0.00 H TER 54933 WAT 1313 ATOM 54933 O WAT 1314 137.322 40.753 73.007 1.00 0.00 O ATOM 54934 H1 WAT 1314 138.054 41.355 72.876 1.00 0.00 H ATOM 54935 H2 WAT 1314 137.735 39.921 73.239 1.00 0.00 H TER 54937 WAT 1314 ATOM 54937 O WAT 1315 49.722 49.497 146.167 1.00 0.00 O ATOM 54938 H1 WAT 1315 50.368 50.025 146.636 1.00 0.00 H ATOM 54939 H2 WAT 1315 49.217 49.068 146.858 1.00 0.00 H TER 54941 WAT 1315 ATOM 54941 O WAT 1316 138.183 82.972 103.874 1.00 0.00 O ATOM 54942 H1 WAT 1316 138.707 83.407 104.547 1.00 0.00 H ATOM 54943 H2 WAT 1316 138.823 82.679 103.225 1.00 0.00 H TER 54945 WAT 1316 ATOM 54945 O WAT 1317 63.212 81.611 120.699 1.00 0.00 O ATOM 54946 H1 WAT 1317 63.931 82.238 120.621 1.00 0.00 H ATOM 54947 H2 WAT 1317 63.611 80.763 120.505 1.00 0.00 H TER 54949 WAT 1317 ATOM 54949 O WAT 1318 4.987 132.755 61.380 1.00 0.00 O ATOM 54950 H1 WAT 1318 4.463 132.185 60.816 1.00 0.00 H ATOM 54951 H2 WAT 1318 5.334 132.171 62.055 1.00 0.00 H TER 54953 WAT 1318 ATOM 54953 O WAT 1319 115.910 144.356 85.154 1.00 0.00 O ATOM 54954 H1 WAT 1319 115.942 144.788 86.008 1.00 0.00 H ATOM 54955 H2 WAT 1319 116.709 144.643 84.711 1.00 0.00 H TER 54957 WAT 1319 ATOM 54957 O WAT 1320 76.328 70.946 64.162 1.00 0.00 O ATOM 54958 H1 WAT 1320 75.656 70.861 63.486 1.00 0.00 H ATOM 54959 H2 WAT 1320 77.056 71.386 63.723 1.00 0.00 H TER 54961 WAT 1320 ATOM 54961 O WAT 1321 135.384 60.919 145.620 1.00 0.00 O ATOM 54962 H1 WAT 1321 135.007 61.787 145.476 1.00 0.00 H ATOM 54963 H2 WAT 1321 135.438 60.534 144.746 1.00 0.00 H TER 54965 WAT 1321 ATOM 54965 O WAT 1322 80.466 61.944 131.850 1.00 0.00 O ATOM 54966 H1 WAT 1322 80.472 60.995 131.979 1.00 0.00 H ATOM 54967 H2 WAT 1322 81.380 62.206 131.960 1.00 0.00 H TER 54969 WAT 1322 ATOM 54969 O WAT 1323 125.357 8.080 64.616 1.00 0.00 O ATOM 54970 H1 WAT 1323 125.586 8.454 63.765 1.00 0.00 H ATOM 54971 H2 WAT 1323 124.417 7.908 64.557 1.00 0.00 H TER 54973 WAT 1323 ATOM 54973 O WAT 1324 144.293 134.401 134.759 1.00 0.00 O ATOM 54974 H1 WAT 1324 144.373 135.306 135.060 1.00 0.00 H ATOM 54975 H2 WAT 1324 144.960 133.925 135.253 1.00 0.00 H TER 54977 WAT 1324 ATOM 54977 O WAT 1325 39.860 68.318 16.029 1.00 0.00 O ATOM 54978 H1 WAT 1325 39.642 67.697 15.334 1.00 0.00 H ATOM 54979 H2 WAT 1325 40.579 67.901 16.504 1.00 0.00 H TER 54981 WAT 1325 ATOM 54981 O WAT 1326 0.853 53.367 106.317 1.00 0.00 O ATOM 54982 H1 WAT 1326 1.384 53.909 106.902 1.00 0.00 H ATOM 54983 H2 WAT 1326 0.587 52.623 106.857 1.00 0.00 H TER 54985 WAT 1326 ATOM 54985 O WAT 1327 123.623 142.579 71.717 1.00 0.00 O ATOM 54986 H1 WAT 1327 122.875 142.893 71.208 1.00 0.00 H ATOM 54987 H2 WAT 1327 123.232 142.118 72.459 1.00 0.00 H TER 54989 WAT 1327 ATOM 54989 O WAT 1328 4.381 28.071 149.065 1.00 0.00 O ATOM 54990 H1 WAT 1328 4.591 28.590 148.288 1.00 0.00 H ATOM 54991 H2 WAT 1328 5.232 27.851 149.443 1.00 0.00 H TER 54993 WAT 1328 ATOM 54993 O WAT 1329 30.287 119.358 60.346 1.00 0.00 O ATOM 54994 H1 WAT 1329 30.606 118.751 61.013 1.00 0.00 H ATOM 54995 H2 WAT 1329 30.057 118.799 59.603 1.00 0.00 H TER 54997 WAT 1329 ATOM 54997 O WAT 1330 144.231 93.119 17.280 1.00 0.00 O ATOM 54998 H1 WAT 1330 144.630 93.070 18.149 1.00 0.00 H ATOM 54999 H2 WAT 1330 143.289 93.102 17.447 1.00 0.00 H TER 55001 WAT 1330 ATOM 55001 O WAT 1331 134.120 46.204 140.621 1.00 0.00 O ATOM 55002 H1 WAT 1331 134.088 46.060 139.675 1.00 0.00 H ATOM 55003 H2 WAT 1331 135.047 46.354 140.809 1.00 0.00 H TER 55005 WAT 1331 ATOM 55005 O WAT 1332 130.388 69.847 7.412 1.00 0.00 O ATOM 55006 H1 WAT 1332 130.408 68.933 7.695 1.00 0.00 H ATOM 55007 H2 WAT 1332 131.182 70.230 7.787 1.00 0.00 H TER 55009 WAT 1332 ATOM 55009 O WAT 1333 132.858 27.029 153.357 1.00 0.00 O ATOM 55010 H1 WAT 1333 132.521 27.896 153.586 1.00 0.00 H ATOM 55011 H2 WAT 1333 132.087 26.462 153.371 1.00 0.00 H TER 55013 WAT 1333 ATOM 55013 O WAT 1334 71.792 56.866 106.136 1.00 0.00 O ATOM 55014 H1 WAT 1334 71.269 57.646 106.318 1.00 0.00 H ATOM 55015 H2 WAT 1334 72.659 57.205 105.912 1.00 0.00 H TER 55017 WAT 1334 ATOM 55017 O WAT 1335 96.185 37.760 52.291 1.00 0.00 O ATOM 55018 H1 WAT 1335 95.624 37.813 53.065 1.00 0.00 H ATOM 55019 H2 WAT 1335 96.687 36.955 52.414 1.00 0.00 H TER 55021 WAT 1335 ATOM 55021 O WAT 1336 27.104 74.641 68.085 1.00 0.00 O ATOM 55022 H1 WAT 1336 27.937 74.823 68.521 1.00 0.00 H ATOM 55023 H2 WAT 1336 26.453 75.108 68.608 1.00 0.00 H TER 55025 WAT 1336 ATOM 55025 O WAT 1337 110.010 12.871 117.144 1.00 0.00 O ATOM 55026 H1 WAT 1337 109.220 13.003 117.668 1.00 0.00 H ATOM 55027 H2 WAT 1337 109.821 12.094 116.617 1.00 0.00 H TER 55029 WAT 1337 ATOM 55029 O WAT 1338 66.620 103.766 24.298 1.00 0.00 O ATOM 55030 H1 WAT 1338 65.680 103.839 24.459 1.00 0.00 H ATOM 55031 H2 WAT 1338 66.781 102.824 24.240 1.00 0.00 H TER 55033 WAT 1338 ATOM 55033 O WAT 1339 5.506 19.837 108.520 1.00 0.00 O ATOM 55034 H1 WAT 1339 6.375 20.235 108.487 1.00 0.00 H ATOM 55035 H2 WAT 1339 4.901 20.573 108.431 1.00 0.00 H TER 55037 WAT 1339 ATOM 55037 O WAT 1340 90.717 104.086 1.852 1.00 0.00 O ATOM 55038 H1 WAT 1340 91.332 104.415 1.196 1.00 0.00 H ATOM 55039 H2 WAT 1340 89.859 104.160 1.433 1.00 0.00 H TER 55041 WAT 1340 ATOM 55041 O WAT 1341 24.878 42.596 8.627 1.00 0.00 O ATOM 55042 H1 WAT 1341 24.093 43.079 8.369 1.00 0.00 H ATOM 55043 H2 WAT 1341 24.551 41.741 8.909 1.00 0.00 H TER 55045 WAT 1341 ATOM 55045 O WAT 1342 35.145 102.881 115.248 1.00 0.00 O ATOM 55046 H1 WAT 1342 34.859 102.992 116.155 1.00 0.00 H ATOM 55047 H2 WAT 1342 36.074 103.109 115.260 1.00 0.00 H TER 55049 WAT 1342 ATOM 55049 O WAT 1343 96.246 125.805 98.288 1.00 0.00 O ATOM 55050 H1 WAT 1343 97.171 126.049 98.323 1.00 0.00 H ATOM 55051 H2 WAT 1343 95.783 126.636 98.176 1.00 0.00 H TER 55053 WAT 1343 ATOM 55053 O WAT 1344 142.203 12.841 136.511 1.00 0.00 O ATOM 55054 H1 WAT 1344 142.052 12.061 137.045 1.00 0.00 H ATOM 55055 H2 WAT 1344 141.863 13.563 137.040 1.00 0.00 H TER 55057 WAT 1344 ATOM 55057 O WAT 1345 24.569 11.161 125.325 1.00 0.00 O ATOM 55058 H1 WAT 1345 25.180 11.305 126.048 1.00 0.00 H ATOM 55059 H2 WAT 1345 23.733 11.498 125.647 1.00 0.00 H TER 55061 WAT 1345 ATOM 55061 O WAT 1346 71.229 82.137 13.940 1.00 0.00 O ATOM 55062 H1 WAT 1346 71.603 82.927 14.330 1.00 0.00 H ATOM 55063 H2 WAT 1346 71.760 81.981 13.159 1.00 0.00 H TER 55065 WAT 1346 ATOM 55065 O WAT 1347 126.141 83.381 88.979 1.00 0.00 O ATOM 55066 H1 WAT 1347 125.713 83.924 88.317 1.00 0.00 H ATOM 55067 H2 WAT 1347 127.035 83.270 88.657 1.00 0.00 H TER 55069 WAT 1347 ATOM 55069 O WAT 1348 37.608 124.947 19.891 1.00 0.00 O ATOM 55070 H1 WAT 1348 36.995 124.398 19.403 1.00 0.00 H ATOM 55071 H2 WAT 1348 37.519 124.656 20.799 1.00 0.00 H TER 55073 WAT 1348 ATOM 55073 O WAT 1349 117.945 52.777 117.965 1.00 0.00 O ATOM 55074 H1 WAT 1349 117.814 52.259 118.760 1.00 0.00 H ATOM 55075 H2 WAT 1349 118.241 53.631 118.282 1.00 0.00 H TER 55077 WAT 1349 ATOM 55077 O WAT 1350 56.932 49.596 13.374 1.00 0.00 O ATOM 55078 H1 WAT 1350 57.065 48.901 12.730 1.00 0.00 H ATOM 55079 H2 WAT 1350 57.456 49.327 14.129 1.00 0.00 H TER 55081 WAT 1350 ATOM 55081 O WAT 1351 97.473 10.432 139.816 1.00 0.00 O ATOM 55082 H1 WAT 1351 98.343 10.033 139.833 1.00 0.00 H ATOM 55083 H2 WAT 1351 97.234 10.446 138.889 1.00 0.00 H TER 55085 WAT 1351 ATOM 55085 O WAT 1352 85.515 77.458 102.469 1.00 0.00 O ATOM 55086 H1 WAT 1352 85.917 78.163 101.962 1.00 0.00 H ATOM 55087 H2 WAT 1352 86.253 76.926 102.767 1.00 0.00 H TER 55089 WAT 1352 ATOM 55089 O WAT 1353 80.580 107.801 133.425 1.00 0.00 O ATOM 55090 H1 WAT 1353 81.216 107.790 132.709 1.00 0.00 H ATOM 55091 H2 WAT 1353 79.869 108.357 133.106 1.00 0.00 H TER 55093 WAT 1353 ATOM 55093 O WAT 1354 104.466 16.951 110.803 1.00 0.00 O ATOM 55094 H1 WAT 1354 103.610 17.037 111.221 1.00 0.00 H ATOM 55095 H2 WAT 1354 105.078 17.342 111.426 1.00 0.00 H TER 55097 WAT 1354 ATOM 55097 O WAT 1355 59.676 129.686 103.811 1.00 0.00 O ATOM 55098 H1 WAT 1355 60.391 130.268 104.069 1.00 0.00 H ATOM 55099 H2 WAT 1355 60.047 129.145 103.114 1.00 0.00 H TER 55101 WAT 1355 ATOM 55101 O WAT 1356 92.060 139.491 117.442 1.00 0.00 O ATOM 55102 H1 WAT 1356 91.493 140.093 117.924 1.00 0.00 H ATOM 55103 H2 WAT 1356 92.761 139.278 118.058 1.00 0.00 H TER 55105 WAT 1356 ATOM 55105 O WAT 1357 12.966 63.397 60.088 1.00 0.00 O ATOM 55106 H1 WAT 1357 13.283 64.223 59.722 1.00 0.00 H ATOM 55107 H2 WAT 1357 12.510 63.650 60.891 1.00 0.00 H TER 55109 WAT 1357 ATOM 55109 O WAT 1358 36.922 128.610 118.429 1.00 0.00 O ATOM 55110 H1 WAT 1358 37.586 128.232 117.853 1.00 0.00 H ATOM 55111 H2 WAT 1358 37.347 129.376 118.814 1.00 0.00 H TER 55113 WAT 1358 ATOM 55113 O WAT 1359 102.298 70.396 117.957 1.00 0.00 O ATOM 55114 H1 WAT 1359 102.921 69.701 117.747 1.00 0.00 H ATOM 55115 H2 WAT 1359 102.740 70.920 118.625 1.00 0.00 H TER 55117 WAT 1359 ATOM 55117 O WAT 1360 82.220 79.889 119.968 1.00 0.00 O ATOM 55118 H1 WAT 1360 81.471 80.458 120.140 1.00 0.00 H ATOM 55119 H2 WAT 1360 82.854 80.115 120.649 1.00 0.00 H TER 55121 WAT 1360 ATOM 55121 O WAT 1361 56.771 131.852 121.815 1.00 0.00 O ATOM 55122 H1 WAT 1361 57.075 131.638 120.933 1.00 0.00 H ATOM 55123 H2 WAT 1361 57.570 131.890 122.341 1.00 0.00 H TER 55125 WAT 1361 ATOM 55125 O WAT 1362 112.961 67.702 14.377 1.00 0.00 O ATOM 55126 H1 WAT 1362 112.604 68.178 15.127 1.00 0.00 H ATOM 55127 H2 WAT 1362 112.268 67.090 14.131 1.00 0.00 H TER 55129 WAT 1362 ATOM 55129 O WAT 1363 37.651 83.083 9.670 1.00 0.00 O ATOM 55130 H1 WAT 1363 38.337 82.610 10.140 1.00 0.00 H ATOM 55131 H2 WAT 1363 36.834 82.775 10.062 1.00 0.00 H TER 55133 WAT 1363 ATOM 55133 O WAT 1364 6.720 142.173 126.830 1.00 0.00 O ATOM 55134 H1 WAT 1364 6.002 142.011 126.218 1.00 0.00 H ATOM 55135 H2 WAT 1364 6.607 143.086 127.095 1.00 0.00 H TER 55137 WAT 1364 ATOM 55137 O WAT 1365 3.816 122.819 80.875 1.00 0.00 O ATOM 55138 H1 WAT 1365 3.724 123.746 81.095 1.00 0.00 H ATOM 55139 H2 WAT 1365 4.400 122.810 80.117 1.00 0.00 H TER 55141 WAT 1365 ATOM 55141 O WAT 1366 98.282 116.859 151.673 1.00 0.00 O ATOM 55142 H1 WAT 1366 97.640 117.171 152.311 1.00 0.00 H ATOM 55143 H2 WAT 1366 97.801 116.226 151.140 1.00 0.00 H TER 55145 WAT 1366 ATOM 55145 O WAT 1367 128.938 49.411 17.018 1.00 0.00 O ATOM 55146 H1 WAT 1367 128.981 50.348 17.207 1.00 0.00 H ATOM 55147 H2 WAT 1367 128.112 49.125 17.409 1.00 0.00 H TER 55149 WAT 1367 ATOM 55149 O WAT 1368 72.955 125.955 18.734 1.00 0.00 O ATOM 55150 H1 WAT 1368 73.082 125.018 18.882 1.00 0.00 H ATOM 55151 H2 WAT 1368 72.418 126.002 17.943 1.00 0.00 H TER 55153 WAT 1368 ATOM 55153 O WAT 1369 42.530 38.378 71.682 1.00 0.00 O ATOM 55154 H1 WAT 1369 42.287 39.304 71.665 1.00 0.00 H ATOM 55155 H2 WAT 1369 43.180 38.288 70.985 1.00 0.00 H TER 55157 WAT 1369 ATOM 55157 O WAT 1370 22.758 128.074 156.208 1.00 0.00 O ATOM 55158 H1 WAT 1370 22.675 129.022 156.105 1.00 0.00 H ATOM 55159 H2 WAT 1370 23.560 127.851 155.737 1.00 0.00 H TER 55161 WAT 1370 ATOM 55161 O WAT 1371 80.878 125.253 98.290 1.00 0.00 O ATOM 55162 H1 WAT 1371 81.695 125.355 98.779 1.00 0.00 H ATOM 55163 H2 WAT 1371 80.953 124.394 97.876 1.00 0.00 H TER 55165 WAT 1371 ATOM 55165 O WAT 1372 55.146 100.023 76.304 1.00 0.00 O ATOM 55166 H1 WAT 1372 55.121 99.321 75.654 1.00 0.00 H ATOM 55167 H2 WAT 1372 56.064 100.070 76.571 1.00 0.00 H TER 55169 WAT 1372 ATOM 55169 O WAT 1373 130.724 28.578 150.555 1.00 0.00 O ATOM 55170 H1 WAT 1373 130.363 28.305 151.398 1.00 0.00 H ATOM 55171 H2 WAT 1373 131.592 28.922 150.766 1.00 0.00 H TER 55173 WAT 1373 ATOM 55173 O WAT 1374 4.824 44.423 5.036 1.00 0.00 O ATOM 55174 H1 WAT 1374 5.134 45.068 5.672 1.00 0.00 H ATOM 55175 H2 WAT 1374 5.543 43.795 4.962 1.00 0.00 H TER 55177 WAT 1374 ATOM 55177 O WAT 1375 32.882 126.377 76.659 1.00 0.00 O ATOM 55178 H1 WAT 1375 32.979 125.444 76.470 1.00 0.00 H ATOM 55179 H2 WAT 1375 33.151 126.814 75.852 1.00 0.00 H TER 55181 WAT 1375 ATOM 55181 O WAT 1376 80.646 31.995 105.781 1.00 0.00 O ATOM 55182 H1 WAT 1376 80.975 32.879 105.943 1.00 0.00 H ATOM 55183 H2 WAT 1376 80.561 31.608 106.653 1.00 0.00 H TER 55185 WAT 1376 ATOM 55185 O WAT 1377 62.833 123.719 3.941 1.00 0.00 O ATOM 55186 H1 WAT 1377 62.257 124.483 3.970 1.00 0.00 H ATOM 55187 H2 WAT 1377 63.714 124.086 3.872 1.00 0.00 H TER 55189 WAT 1377 ATOM 55189 O WAT 1378 43.496 26.061 103.562 1.00 0.00 O ATOM 55190 H1 WAT 1378 44.010 26.500 104.239 1.00 0.00 H ATOM 55191 H2 WAT 1378 43.574 26.629 102.795 1.00 0.00 H TER 55193 WAT 1378 ATOM 55193 O WAT 1379 50.058 30.480 106.516 1.00 0.00 O ATOM 55194 H1 WAT 1379 49.118 30.499 106.695 1.00 0.00 H ATOM 55195 H2 WAT 1379 50.319 31.401 106.504 1.00 0.00 H TER 55197 WAT 1379 ATOM 55197 O WAT 1380 10.773 59.046 18.006 1.00 0.00 O ATOM 55198 H1 WAT 1380 11.380 58.799 17.308 1.00 0.00 H ATOM 55199 H2 WAT 1380 9.958 59.257 17.550 1.00 0.00 H TER 55201 WAT 1380 ATOM 55201 O WAT 1381 82.200 38.085 156.383 1.00 0.00 O ATOM 55202 H1 WAT 1381 82.970 38.040 156.950 1.00 0.00 H ATOM 55203 H2 WAT 1381 81.938 37.173 156.263 1.00 0.00 H TER 55205 WAT 1381 ATOM 55205 O WAT 1382 60.310 26.375 79.407 1.00 0.00 O ATOM 55206 H1 WAT 1382 59.555 26.666 78.897 1.00 0.00 H ATOM 55207 H2 WAT 1382 60.100 25.474 79.653 1.00 0.00 H TER 55209 WAT 1382 ATOM 55209 O WAT 1383 23.900 60.224 129.012 1.00 0.00 O ATOM 55210 H1 WAT 1383 22.965 60.382 128.885 1.00 0.00 H ATOM 55211 H2 WAT 1383 24.323 61.024 128.699 1.00 0.00 H TER 55213 WAT 1383 ATOM 55213 O WAT 1384 2.407 80.425 12.964 1.00 0.00 O ATOM 55214 H1 WAT 1384 1.457 80.346 12.882 1.00 0.00 H ATOM 55215 H2 WAT 1384 2.730 80.373 12.065 1.00 0.00 H TER 55217 WAT 1384 ATOM 55217 O WAT 1385 87.176 136.328 137.035 1.00 0.00 O ATOM 55218 H1 WAT 1385 87.988 136.753 136.760 1.00 0.00 H ATOM 55219 H2 WAT 1385 87.313 136.124 137.960 1.00 0.00 H TER 55221 WAT 1385 ATOM 55221 O WAT 1386 18.494 81.345 130.840 1.00 0.00 O ATOM 55222 H1 WAT 1386 19.370 80.965 130.906 1.00 0.00 H ATOM 55223 H2 WAT 1386 18.314 81.685 131.717 1.00 0.00 H TER 55225 WAT 1386 ATOM 55225 O WAT 1387 89.040 57.865 113.214 1.00 0.00 O ATOM 55226 H1 WAT 1387 89.625 58.243 112.557 1.00 0.00 H ATOM 55227 H2 WAT 1387 88.176 58.211 112.992 1.00 0.00 H TER 55229 WAT 1387 ATOM 55229 O WAT 1388 34.846 31.514 111.095 1.00 0.00 O ATOM 55230 H1 WAT 1388 34.369 32.328 111.258 1.00 0.00 H ATOM 55231 H2 WAT 1388 35.384 31.390 111.878 1.00 0.00 H TER 55233 WAT 1388 ATOM 55233 O WAT 1389 133.307 97.533 15.221 1.00 0.00 O ATOM 55234 H1 WAT 1389 134.054 97.344 15.790 1.00 0.00 H ATOM 55235 H2 WAT 1389 133.319 98.485 15.120 1.00 0.00 H TER 55237 WAT 1389 ATOM 55237 O WAT 1390 114.594 33.707 2.016 1.00 0.00 O ATOM 55238 H1 WAT 1390 114.562 32.761 1.877 1.00 0.00 H ATOM 55239 H2 WAT 1390 113.863 34.050 1.500 1.00 0.00 H TER 55241 WAT 1390 ATOM 55241 O WAT 1391 133.413 5.691 116.196 1.00 0.00 O ATOM 55242 H1 WAT 1391 133.277 4.970 115.581 1.00 0.00 H ATOM 55243 H2 WAT 1391 134.093 5.374 116.791 1.00 0.00 H TER 55245 WAT 1391 ATOM 55245 O WAT 1392 28.942 102.246 20.444 1.00 0.00 O ATOM 55246 H1 WAT 1392 28.034 102.256 20.747 1.00 0.00 H ATOM 55247 H2 WAT 1392 28.904 101.820 19.588 1.00 0.00 H TER 55249 WAT 1392 ATOM 55249 O WAT 1393 135.040 114.332 90.010 1.00 0.00 O ATOM 55250 H1 WAT 1393 134.613 113.728 89.401 1.00 0.00 H ATOM 55251 H2 WAT 1393 135.797 114.663 89.527 1.00 0.00 H TER 55253 WAT 1393 ATOM 55253 O WAT 1394 86.178 12.199 12.600 1.00 0.00 O ATOM 55254 H1 WAT 1394 86.587 13.052 12.747 1.00 0.00 H ATOM 55255 H2 WAT 1394 86.889 11.569 12.715 1.00 0.00 H TER 55257 WAT 1394 ATOM 55257 O WAT 1395 130.125 82.428 117.635 1.00 0.00 O ATOM 55258 H1 WAT 1395 130.756 82.298 118.342 1.00 0.00 H ATOM 55259 H2 WAT 1395 130.046 83.379 117.557 1.00 0.00 H TER 55261 WAT 1395 ATOM 55261 O WAT 1396 96.728 107.347 153.061 1.00 0.00 O ATOM 55262 H1 WAT 1396 96.664 106.483 153.468 1.00 0.00 H ATOM 55263 H2 WAT 1396 97.662 107.463 152.890 1.00 0.00 H TER 55265 WAT 1396 ATOM 55265 O WAT 1397 132.504 126.079 150.262 1.00 0.00 O ATOM 55266 H1 WAT 1397 132.209 126.345 149.391 1.00 0.00 H ATOM 55267 H2 WAT 1397 132.955 126.849 150.608 1.00 0.00 H TER 55269 WAT 1397 ATOM 55269 O WAT 1398 28.498 27.546 2.497 1.00 0.00 O ATOM 55270 H1 WAT 1398 27.657 27.838 2.146 1.00 0.00 H ATOM 55271 H2 WAT 1398 29.121 28.216 2.216 1.00 0.00 H TER 55273 WAT 1398 ATOM 55273 O WAT 1399 55.391 62.916 28.690 1.00 0.00 O ATOM 55274 H1 WAT 1399 55.259 62.044 28.317 1.00 0.00 H ATOM 55275 H2 WAT 1399 56.266 62.880 29.077 1.00 0.00 H TER 55277 WAT 1399 ATOM 55277 O WAT 1400 46.614 2.557 121.952 1.00 0.00 O ATOM 55278 H1 WAT 1400 47.525 2.616 121.664 1.00 0.00 H ATOM 55279 H2 WAT 1400 46.123 3.049 121.293 1.00 0.00 H TER 55281 WAT 1400 ATOM 55281 O WAT 1401 63.669 95.179 145.933 1.00 0.00 O ATOM 55282 H1 WAT 1401 63.653 94.234 145.786 1.00 0.00 H ATOM 55283 H2 WAT 1401 64.579 95.370 146.163 1.00 0.00 H TER 55285 WAT 1401 ATOM 55285 O WAT 1402 22.299 64.840 104.146 1.00 0.00 O ATOM 55286 H1 WAT 1402 21.745 64.059 104.162 1.00 0.00 H ATOM 55287 H2 WAT 1402 23.142 64.528 103.817 1.00 0.00 H TER 55289 WAT 1402 ATOM 55289 O WAT 1403 20.358 49.179 11.992 1.00 0.00 O ATOM 55290 H1 WAT 1403 21.186 48.779 12.260 1.00 0.00 H ATOM 55291 H2 WAT 1403 20.103 48.697 11.205 1.00 0.00 H TER 55293 WAT 1403 ATOM 55293 O WAT 1404 57.064 70.261 13.759 1.00 0.00 O ATOM 55294 H1 WAT 1404 56.533 70.326 12.966 1.00 0.00 H ATOM 55295 H2 WAT 1404 56.531 70.677 14.438 1.00 0.00 H TER 55297 WAT 1404 ATOM 55297 O WAT 1405 4.629 19.162 105.274 1.00 0.00 O ATOM 55298 H1 WAT 1405 4.737 19.616 106.109 1.00 0.00 H ATOM 55299 H2 WAT 1405 4.191 19.800 104.710 1.00 0.00 H TER 55301 WAT 1405 ATOM 55301 O WAT 1406 34.147 95.851 18.248 1.00 0.00 O ATOM 55302 H1 WAT 1406 34.019 95.270 18.998 1.00 0.00 H ATOM 55303 H2 WAT 1406 33.404 95.669 17.674 1.00 0.00 H TER 55305 WAT 1406 ATOM 55305 O WAT 1407 2.512 96.706 87.285 1.00 0.00 O ATOM 55306 H1 WAT 1407 2.533 95.756 87.177 1.00 0.00 H ATOM 55307 H2 WAT 1407 2.476 96.839 88.233 1.00 0.00 H TER 55309 WAT 1407 ATOM 55309 O WAT 1408 26.999 133.630 13.045 1.00 0.00 O ATOM 55310 H1 WAT 1408 27.771 133.736 13.601 1.00 0.00 H ATOM 55311 H2 WAT 1408 27.289 133.908 12.176 1.00 0.00 H TER 55313 WAT 1408 ATOM 55313 O WAT 1409 36.871 38.891 133.207 1.00 0.00 O ATOM 55314 H1 WAT 1409 36.204 39.018 132.532 1.00 0.00 H ATOM 55315 H2 WAT 1409 37.520 38.319 132.799 1.00 0.00 H TER 55317 WAT 1409 ATOM 55317 O WAT 1410 71.120 71.039 105.499 1.00 0.00 O ATOM 55318 H1 WAT 1410 70.290 71.444 105.249 1.00 0.00 H ATOM 55319 H2 WAT 1410 71.039 70.129 105.213 1.00 0.00 H TER 55321 WAT 1410 ATOM 55321 O WAT 1411 121.675 13.428 75.839 1.00 0.00 O ATOM 55322 H1 WAT 1411 121.088 12.780 76.229 1.00 0.00 H ATOM 55323 H2 WAT 1411 122.365 12.909 75.426 1.00 0.00 H TER 55325 WAT 1411 ATOM 55325 O WAT 1412 18.911 134.287 13.165 1.00 0.00 O ATOM 55326 H1 WAT 1412 18.351 134.866 13.682 1.00 0.00 H ATOM 55327 H2 WAT 1412 18.530 134.306 12.287 1.00 0.00 H TER 55329 WAT 1412 ATOM 55329 O WAT 1413 88.829 31.951 120.002 1.00 0.00 O ATOM 55330 H1 WAT 1413 88.711 32.876 119.785 1.00 0.00 H ATOM 55331 H2 WAT 1413 89.078 31.951 120.926 1.00 0.00 H TER 55333 WAT 1413 ATOM 55333 O WAT 1414 43.394 65.120 110.112 1.00 0.00 O ATOM 55334 H1 WAT 1414 43.303 64.225 110.441 1.00 0.00 H ATOM 55335 H2 WAT 1414 43.155 65.060 109.187 1.00 0.00 H TER 55337 WAT 1414 ATOM 55337 O WAT 1415 16.227 16.140 86.073 1.00 0.00 O ATOM 55338 H1 WAT 1415 16.672 16.705 85.441 1.00 0.00 H ATOM 55339 H2 WAT 1415 16.931 15.791 86.619 1.00 0.00 H TER 55341 WAT 1415 ATOM 55341 O WAT 1416 138.093 73.987 105.852 1.00 0.00 O ATOM 55342 H1 WAT 1416 138.886 74.167 105.347 1.00 0.00 H ATOM 55343 H2 WAT 1416 138.413 73.627 106.679 1.00 0.00 H TER 55345 WAT 1416 ATOM 55345 O WAT 1417 31.826 42.433 121.100 1.00 0.00 O ATOM 55346 H1 WAT 1417 30.919 42.172 121.259 1.00 0.00 H ATOM 55347 H2 WAT 1417 31.847 42.674 120.174 1.00 0.00 H TER 55349 WAT 1417 ATOM 55349 O WAT 1418 53.261 97.361 4.721 1.00 0.00 O ATOM 55350 H1 WAT 1418 52.919 97.904 5.431 1.00 0.00 H ATOM 55351 H2 WAT 1418 53.592 96.577 5.157 1.00 0.00 H TER 55353 WAT 1418 ATOM 55353 O WAT 1419 139.677 103.562 102.691 1.00 0.00 O ATOM 55354 H1 WAT 1419 139.237 102.934 102.118 1.00 0.00 H ATOM 55355 H2 WAT 1419 140.264 104.047 102.110 1.00 0.00 H TER 55357 WAT 1419 ATOM 55357 O WAT 1420 138.366 136.702 62.439 1.00 0.00 O ATOM 55358 H1 WAT 1420 138.748 135.826 62.398 1.00 0.00 H ATOM 55359 H2 WAT 1420 137.508 136.572 62.843 1.00 0.00 H TER 55361 WAT 1420 ATOM 55361 O WAT 1421 74.544 79.057 124.583 1.00 0.00 O ATOM 55362 H1 WAT 1421 75.015 78.760 125.362 1.00 0.00 H ATOM 55363 H2 WAT 1421 75.164 78.931 123.865 1.00 0.00 H TER 55365 WAT 1421 ATOM 55365 O WAT 1422 18.222 43.113 7.087 1.00 0.00 O ATOM 55366 H1 WAT 1422 18.838 42.763 6.444 1.00 0.00 H ATOM 55367 H2 WAT 1422 17.576 42.416 7.204 1.00 0.00 H TER 55369 WAT 1422 ATOM 55369 O WAT 1423 59.197 63.855 124.711 1.00 0.00 O ATOM 55370 H1 WAT 1423 58.909 63.388 125.495 1.00 0.00 H ATOM 55371 H2 WAT 1423 58.387 64.162 124.303 1.00 0.00 H TER 55373 WAT 1423 ATOM 55373 O WAT 1424 84.628 73.684 133.790 1.00 0.00 O ATOM 55374 H1 WAT 1424 85.138 72.985 134.198 1.00 0.00 H ATOM 55375 H2 WAT 1424 84.562 73.428 132.871 1.00 0.00 H TER 55377 WAT 1424 ATOM 55377 O WAT 1425 128.105 78.605 81.614 1.00 0.00 O ATOM 55378 H1 WAT 1425 128.734 79.322 81.532 1.00 0.00 H ATOM 55379 H2 WAT 1425 128.639 77.812 81.568 1.00 0.00 H TER 55381 WAT 1425 ATOM 55381 O WAT 1426 90.431 26.939 64.132 1.00 0.00 O ATOM 55382 H1 WAT 1426 90.709 26.312 63.464 1.00 0.00 H ATOM 55383 H2 WAT 1426 89.619 27.311 63.787 1.00 0.00 H TER 55385 WAT 1426 ATOM 55385 O WAT 1427 77.117 3.700 158.013 1.00 0.00 O ATOM 55386 H1 WAT 1427 77.967 3.846 158.428 1.00 0.00 H ATOM 55387 H2 WAT 1427 76.904 4.538 157.602 1.00 0.00 H TER 55389 WAT 1427 ATOM 55389 O WAT 1428 73.922 42.406 102.603 1.00 0.00 O ATOM 55390 H1 WAT 1428 74.240 43.306 102.680 1.00 0.00 H ATOM 55391 H2 WAT 1428 73.820 42.110 103.508 1.00 0.00 H TER 55393 WAT 1428 ATOM 55393 O WAT 1429 120.133 24.923 79.084 1.00 0.00 O ATOM 55394 H1 WAT 1429 119.973 25.631 79.707 1.00 0.00 H ATOM 55395 H2 WAT 1429 120.240 24.143 79.629 1.00 0.00 H TER 55397 WAT 1429 ATOM 55397 O WAT 1430 12.402 97.080 100.326 1.00 0.00 O ATOM 55398 H1 WAT 1430 12.238 97.588 99.531 1.00 0.00 H ATOM 55399 H2 WAT 1430 13.309 97.283 100.557 1.00 0.00 H TER 55401 WAT 1430 ATOM 55401 O WAT 1431 116.622 54.499 115.581 1.00 0.00 O ATOM 55402 H1 WAT 1431 115.925 55.132 115.755 1.00 0.00 H ATOM 55403 H2 WAT 1431 116.564 53.874 116.303 1.00 0.00 H TER 55405 WAT 1431 ATOM 55405 O WAT 1432 11.829 93.189 14.752 1.00 0.00 O ATOM 55406 H1 WAT 1432 12.069 93.528 15.615 1.00 0.00 H ATOM 55407 H2 WAT 1432 11.201 93.826 14.411 1.00 0.00 H TER 55409 WAT 1432 ATOM 55409 O WAT 1433 136.067 100.739 101.876 1.00 0.00 O ATOM 55410 H1 WAT 1433 136.009 100.929 100.939 1.00 0.00 H ATOM 55411 H2 WAT 1433 137.006 100.686 102.052 1.00 0.00 H TER 55413 WAT 1433 ATOM 55413 O WAT 1434 28.305 64.326 13.757 1.00 0.00 O ATOM 55414 H1 WAT 1434 29.123 64.267 14.251 1.00 0.00 H ATOM 55415 H2 WAT 1434 28.451 65.040 13.137 1.00 0.00 H TER 55417 WAT 1434 ATOM 55417 O WAT 1435 143.691 11.088 146.954 1.00 0.00 O ATOM 55418 H1 WAT 1435 144.385 10.448 146.796 1.00 0.00 H ATOM 55419 H2 WAT 1435 142.965 10.572 147.306 1.00 0.00 H TER 55421 WAT 1435 ATOM 55421 O WAT 1436 92.680 119.375 65.566 1.00 0.00 O ATOM 55422 H1 WAT 1436 92.680 118.470 65.879 1.00 0.00 H ATOM 55423 H2 WAT 1436 92.656 119.904 66.363 1.00 0.00 H TER 55425 WAT 1436 ATOM 55425 O WAT 1437 144.078 142.955 115.263 1.00 0.00 O ATOM 55426 H1 WAT 1437 143.886 143.427 116.073 1.00 0.00 H ATOM 55427 H2 WAT 1437 143.610 142.125 115.353 1.00 0.00 H TER 55429 WAT 1437 ATOM 55429 O WAT 1438 15.420 145.228 140.641 1.00 0.00 O ATOM 55430 H1 WAT 1438 14.958 144.528 141.103 1.00 0.00 H ATOM 55431 H2 WAT 1438 14.912 146.017 140.831 1.00 0.00 H TER 55433 WAT 1438 ATOM 55433 O WAT 1439 116.542 105.782 69.514 1.00 0.00 O ATOM 55434 H1 WAT 1439 116.092 105.732 68.670 1.00 0.00 H ATOM 55435 H2 WAT 1439 117.437 106.040 69.294 1.00 0.00 H TER 55437 WAT 1439 ATOM 55437 O WAT 1440 95.478 30.705 61.373 1.00 0.00 O ATOM 55438 H1 WAT 1440 95.343 30.943 60.456 1.00 0.00 H ATOM 55439 H2 WAT 1440 95.433 31.536 61.845 1.00 0.00 H TER 55441 WAT 1440 ATOM 55441 O WAT 1441 119.549 90.895 130.789 1.00 0.00 O ATOM 55442 H1 WAT 1441 118.747 91.094 130.305 1.00 0.00 H ATOM 55443 H2 WAT 1441 120.075 91.691 130.715 1.00 0.00 H TER 55445 WAT 1441 ATOM 55445 O WAT 1442 99.073 108.996 124.695 1.00 0.00 O ATOM 55446 H1 WAT 1442 98.332 109.529 124.407 1.00 0.00 H ATOM 55447 H2 WAT 1442 99.018 109.006 125.651 1.00 0.00 H TER 55449 WAT 1442 ATOM 55449 O WAT 1443 109.862 91.045 24.757 1.00 0.00 O ATOM 55450 H1 WAT 1443 108.933 91.256 24.852 1.00 0.00 H ATOM 55451 H2 WAT 1443 110.186 91.678 24.116 1.00 0.00 H TER 55453 WAT 1443 ATOM 55453 O WAT 1444 23.394 133.831 149.058 1.00 0.00 O ATOM 55454 H1 WAT 1444 23.196 134.180 148.189 1.00 0.00 H ATOM 55455 H2 WAT 1444 22.575 133.922 149.545 1.00 0.00 H TER 55457 WAT 1444 ATOM 55457 O WAT 1445 85.088 57.766 115.482 1.00 0.00 O ATOM 55458 H1 WAT 1445 84.492 57.858 116.226 1.00 0.00 H ATOM 55459 H2 WAT 1445 84.694 57.081 114.943 1.00 0.00 H TER 55461 WAT 1445 ATOM 55461 O WAT 1446 102.834 72.406 113.795 1.00 0.00 O ATOM 55462 H1 WAT 1446 102.325 71.653 114.095 1.00 0.00 H ATOM 55463 H2 WAT 1446 102.222 72.911 113.260 1.00 0.00 H TER 55465 WAT 1446 ATOM 55465 O WAT 1447 0.114 96.870 4.987 1.00 0.00 O ATOM 55466 H1 WAT 1447 0.607 96.723 4.180 1.00 0.00 H ATOM 55467 H2 WAT 1447 0.763 96.776 5.685 1.00 0.00 H TER 55469 WAT 1447 ATOM 55469 O WAT 1448 69.346 18.895 87.861 1.00 0.00 O ATOM 55470 H1 WAT 1448 69.713 19.227 87.042 1.00 0.00 H ATOM 55471 H2 WAT 1448 68.535 18.459 87.600 1.00 0.00 H TER 55473 WAT 1448 ATOM 55473 O WAT 1449 111.452 117.226 116.130 1.00 0.00 O ATOM 55474 H1 WAT 1449 112.053 116.549 115.819 1.00 0.00 H ATOM 55475 H2 WAT 1449 110.804 116.752 116.651 1.00 0.00 H TER 55477 WAT 1449 ATOM 55477 O WAT 1450 60.437 101.090 95.896 1.00 0.00 O ATOM 55478 H1 WAT 1450 61.009 101.849 96.004 1.00 0.00 H ATOM 55479 H2 WAT 1450 60.382 100.706 96.771 1.00 0.00 H TER 55481 WAT 1450 ATOM 55481 O WAT 1451 8.851 98.891 138.159 1.00 0.00 O ATOM 55482 H1 WAT 1451 8.925 99.833 138.007 1.00 0.00 H ATOM 55483 H2 WAT 1451 8.132 98.612 137.592 1.00 0.00 H TER 55485 WAT 1451 ATOM 55485 O WAT 1452 77.464 63.059 151.206 1.00 0.00 O ATOM 55486 H1 WAT 1452 77.139 63.741 151.794 1.00 0.00 H ATOM 55487 H2 WAT 1452 77.806 62.382 151.790 1.00 0.00 H TER 55489 WAT 1452 ATOM 55489 O WAT 1453 130.571 50.013 144.203 1.00 0.00 O ATOM 55490 H1 WAT 1453 130.085 50.495 144.872 1.00 0.00 H ATOM 55491 H2 WAT 1453 130.650 49.127 144.556 1.00 0.00 H TER 55493 WAT 1453 ATOM 55493 O WAT 1454 9.630 45.246 13.355 1.00 0.00 O ATOM 55494 H1 WAT 1454 10.460 45.370 13.816 1.00 0.00 H ATOM 55495 H2 WAT 1454 9.318 46.134 13.181 1.00 0.00 H TER 55497 WAT 1454 ATOM 55497 O WAT 1455 91.186 118.829 154.055 1.00 0.00 O ATOM 55498 H1 WAT 1455 90.265 118.887 154.309 1.00 0.00 H ATOM 55499 H2 WAT 1455 91.558 119.675 154.307 1.00 0.00 H TER 55501 WAT 1455 ATOM 55501 O WAT 1456 87.602 114.472 95.764 1.00 0.00 O ATOM 55502 H1 WAT 1456 86.987 114.722 95.074 1.00 0.00 H ATOM 55503 H2 WAT 1456 87.868 113.581 95.536 1.00 0.00 H TER 55505 WAT 1456 ATOM 55505 O WAT 1457 3.152 68.541 157.634 1.00 0.00 O ATOM 55506 H1 WAT 1457 3.537 67.999 156.945 1.00 0.00 H ATOM 55507 H2 WAT 1457 3.723 68.407 158.391 1.00 0.00 H TER 55509 WAT 1457 ATOM 55509 O WAT 1458 121.441 37.574 112.164 1.00 0.00 O ATOM 55510 H1 WAT 1458 121.522 37.571 113.118 1.00 0.00 H ATOM 55511 H2 WAT 1458 120.506 37.453 112.002 1.00 0.00 H TER 55513 WAT 1458 ATOM 55513 O WAT 1459 119.740 31.193 97.455 1.00 0.00 O ATOM 55514 H1 WAT 1459 119.787 30.237 97.456 1.00 0.00 H ATOM 55515 H2 WAT 1459 120.434 31.468 98.055 1.00 0.00 H TER 55517 WAT 1459 ATOM 55517 O WAT 1460 24.266 72.282 19.044 1.00 0.00 O ATOM 55518 H1 WAT 1460 23.903 71.491 19.443 1.00 0.00 H ATOM 55519 H2 WAT 1460 24.998 72.522 19.612 1.00 0.00 H TER 55521 WAT 1460 ATOM 55521 O WAT 1461 67.451 102.533 19.764 1.00 0.00 O ATOM 55522 H1 WAT 1461 67.845 103.198 20.329 1.00 0.00 H ATOM 55523 H2 WAT 1461 68.185 102.187 19.255 1.00 0.00 H TER 55525 WAT 1461 ATOM 55525 O WAT 1462 52.432 62.513 84.544 1.00 0.00 O ATOM 55526 H1 WAT 1462 53.367 62.608 84.728 1.00 0.00 H ATOM 55527 H2 WAT 1462 52.366 61.694 84.053 1.00 0.00 H TER 55529 WAT 1462 ATOM 55529 O WAT 1463 30.941 51.321 72.848 1.00 0.00 O ATOM 55530 H1 WAT 1463 31.344 50.518 72.518 1.00 0.00 H ATOM 55531 H2 WAT 1463 31.268 52.009 72.268 1.00 0.00 H TER 55533 WAT 1463 ATOM 55533 O WAT 1464 34.790 85.959 115.962 1.00 0.00 O ATOM 55534 H1 WAT 1464 34.554 86.868 115.781 1.00 0.00 H ATOM 55535 H2 WAT 1464 35.191 85.984 116.830 1.00 0.00 H TER 55537 WAT 1464 ATOM 55537 O WAT 1465 100.207 18.124 118.706 1.00 0.00 O ATOM 55538 H1 WAT 1465 101.101 18.434 118.568 1.00 0.00 H ATOM 55539 H2 WAT 1465 99.856 18.699 119.386 1.00 0.00 H TER 55541 WAT 1465 ATOM 55541 O WAT 1466 113.661 70.287 123.143 1.00 0.00 O ATOM 55542 H1 WAT 1466 112.899 70.859 123.228 1.00 0.00 H ATOM 55543 H2 WAT 1466 113.291 69.411 123.026 1.00 0.00 H TER 55545 WAT 1466 ATOM 55545 O WAT 1467 87.952 48.465 119.069 1.00 0.00 O ATOM 55546 H1 WAT 1467 88.892 48.527 118.897 1.00 0.00 H ATOM 55547 H2 WAT 1467 87.548 48.475 118.202 1.00 0.00 H TER 55549 WAT 1467 ATOM 55549 O WAT 1468 99.599 112.258 101.988 1.00 0.00 O ATOM 55550 H1 WAT 1468 99.526 112.102 102.929 1.00 0.00 H ATOM 55551 H2 WAT 1468 99.388 113.186 101.881 1.00 0.00 H TER 55553 WAT 1468 ATOM 55553 O WAT 1469 6.278 70.255 143.247 1.00 0.00 O ATOM 55554 H1 WAT 1469 5.681 70.716 142.657 1.00 0.00 H ATOM 55555 H2 WAT 1469 7.009 69.989 142.689 1.00 0.00 H TER 55557 WAT 1469 ATOM 55557 O WAT 1470 120.305 97.660 147.555 1.00 0.00 O ATOM 55558 H1 WAT 1470 120.488 96.849 147.082 1.00 0.00 H ATOM 55559 H2 WAT 1470 120.253 97.395 148.474 1.00 0.00 H TER 55561 WAT 1470 ATOM 55561 O WAT 1471 20.464 9.618 81.852 1.00 0.00 O ATOM 55562 H1 WAT 1471 21.400 9.648 82.049 1.00 0.00 H ATOM 55563 H2 WAT 1471 20.409 9.803 80.914 1.00 0.00 H TER 55565 WAT 1471 ATOM 55565 O WAT 1472 104.265 68.226 27.465 1.00 0.00 O ATOM 55566 H1 WAT 1472 105.038 67.781 27.119 1.00 0.00 H ATOM 55567 H2 WAT 1472 104.285 69.093 27.059 1.00 0.00 H TER 55569 WAT 1472 ATOM 55569 O WAT 1473 15.098 76.227 6.978 1.00 0.00 O ATOM 55570 H1 WAT 1473 15.212 76.427 6.049 1.00 0.00 H ATOM 55571 H2 WAT 1473 15.968 76.354 7.358 1.00 0.00 H TER 55573 WAT 1473 ATOM 55573 O WAT 1474 24.638 102.627 138.316 1.00 0.00 O ATOM 55574 H1 WAT 1474 23.955 101.974 138.161 1.00 0.00 H ATOM 55575 H2 WAT 1474 25.233 102.531 137.572 1.00 0.00 H TER 55577 WAT 1474 ATOM 55577 O WAT 1475 102.496 49.658 111.166 1.00 0.00 O ATOM 55578 H1 WAT 1475 102.503 49.353 110.258 1.00 0.00 H ATOM 55579 H2 WAT 1475 102.884 50.532 111.128 1.00 0.00 H TER 55581 WAT 1475 ATOM 55581 O WAT 1476 97.670 14.795 133.243 1.00 0.00 O ATOM 55582 H1 WAT 1476 97.152 15.274 133.890 1.00 0.00 H ATOM 55583 H2 WAT 1476 98.451 15.334 133.115 1.00 0.00 H TER 55585 WAT 1476 ATOM 55585 O WAT 1477 80.977 61.604 117.683 1.00 0.00 O ATOM 55586 H1 WAT 1477 81.250 62.490 117.448 1.00 0.00 H ATOM 55587 H2 WAT 1477 80.180 61.727 118.199 1.00 0.00 H TER 55589 WAT 1477 ATOM 55589 O WAT 1478 83.830 40.919 114.449 1.00 0.00 O ATOM 55590 H1 WAT 1478 83.552 41.148 113.563 1.00 0.00 H ATOM 55591 H2 WAT 1478 83.209 41.370 115.020 1.00 0.00 H TER 55593 WAT 1478 ATOM 55593 O WAT 1479 93.863 123.004 121.351 1.00 0.00 O ATOM 55594 H1 WAT 1479 94.139 123.702 120.757 1.00 0.00 H ATOM 55595 H2 WAT 1479 94.273 122.214 121.000 1.00 0.00 H TER 55597 WAT 1479 ATOM 55597 O WAT 1480 128.484 145.341 141.589 1.00 0.00 O ATOM 55598 H1 WAT 1480 127.569 145.503 141.817 1.00 0.00 H ATOM 55599 H2 WAT 1480 128.452 145.005 140.693 1.00 0.00 H TER 55601 WAT 1480 ATOM 55601 O WAT 1481 19.021 103.392 72.640 1.00 0.00 O ATOM 55602 H1 WAT 1481 19.071 103.912 73.442 1.00 0.00 H ATOM 55603 H2 WAT 1481 19.926 103.335 72.334 1.00 0.00 H TER 55605 WAT 1481 ATOM 55605 O WAT 1482 131.495 111.031 1.137 1.00 0.00 O ATOM 55606 H1 WAT 1482 131.738 110.376 1.791 1.00 0.00 H ATOM 55607 H2 WAT 1482 132.092 111.762 1.296 1.00 0.00 H TER 55609 WAT 1482 ATOM 55609 O WAT 1483 49.768 90.064 118.267 1.00 0.00 O ATOM 55610 H1 WAT 1483 49.056 89.560 118.660 1.00 0.00 H ATOM 55611 H2 WAT 1483 50.564 89.683 118.639 1.00 0.00 H TER 55613 WAT 1483 ATOM 55613 O WAT 1484 26.957 71.667 122.570 1.00 0.00 O ATOM 55614 H1 WAT 1484 26.727 70.809 122.927 1.00 0.00 H ATOM 55615 H2 WAT 1484 27.520 72.061 123.237 1.00 0.00 H TER 55617 WAT 1484 ATOM 55617 O WAT 1485 136.780 111.411 131.920 1.00 0.00 O ATOM 55618 H1 WAT 1485 136.533 111.069 132.780 1.00 0.00 H ATOM 55619 H2 WAT 1485 136.758 112.362 132.026 1.00 0.00 H TER 55621 WAT 1485 ATOM 55621 O WAT 1486 66.297 36.887 117.503 1.00 0.00 O ATOM 55622 H1 WAT 1486 65.974 36.856 116.603 1.00 0.00 H ATOM 55623 H2 WAT 1486 65.516 37.052 118.032 1.00 0.00 H TER 55625 WAT 1486 ATOM 55625 O WAT 1487 48.565 53.376 141.250 1.00 0.00 O ATOM 55626 H1 WAT 1487 49.148 53.723 140.575 1.00 0.00 H ATOM 55627 H2 WAT 1487 48.040 52.717 140.797 1.00 0.00 H TER 55629 WAT 1487 ATOM 55629 O WAT 1488 53.630 60.660 143.085 1.00 0.00 O ATOM 55630 H1 WAT 1488 54.353 61.028 143.593 1.00 0.00 H ATOM 55631 H2 WAT 1488 53.573 61.218 142.309 1.00 0.00 H TER 55633 WAT 1488 ATOM 55633 O WAT 1489 41.140 0.631 97.312 1.00 0.00 O ATOM 55634 H1 WAT 1489 40.217 0.885 97.339 1.00 0.00 H ATOM 55635 H2 WAT 1489 41.610 1.453 97.172 1.00 0.00 H TER 55637 WAT 1489 ATOM 55637 O WAT 1490 19.982 125.696 22.569 1.00 0.00 O ATOM 55638 H1 WAT 1490 20.345 125.270 21.792 1.00 0.00 H ATOM 55639 H2 WAT 1490 19.483 126.436 22.225 1.00 0.00 H TER 55641 WAT 1490 ATOM 55641 O WAT 1491 34.381 90.451 27.767 1.00 0.00 O ATOM 55642 H1 WAT 1491 35.001 90.052 28.378 1.00 0.00 H ATOM 55643 H2 WAT 1491 34.565 90.027 26.928 1.00 0.00 H TER 55645 WAT 1491 ATOM 55645 O WAT 1492 5.897 140.400 135.375 1.00 0.00 O ATOM 55646 H1 WAT 1492 5.278 140.993 134.949 1.00 0.00 H ATOM 55647 H2 WAT 1492 5.361 139.662 135.664 1.00 0.00 H TER 55649 WAT 1492 ATOM 55649 O WAT 1493 131.828 59.129 59.291 1.00 0.00 O ATOM 55650 H1 WAT 1493 131.595 58.204 59.370 1.00 0.00 H ATOM 55651 H2 WAT 1493 132.335 59.180 58.481 1.00 0.00 H TER 55653 WAT 1493 ATOM 55653 O WAT 1494 25.534 108.190 117.428 1.00 0.00 O ATOM 55654 H1 WAT 1494 26.443 108.279 117.142 1.00 0.00 H ATOM 55655 H2 WAT 1494 25.493 108.678 118.251 1.00 0.00 H TER 55657 WAT 1494 ATOM 55657 O WAT 1495 91.715 130.924 122.254 1.00 0.00 O ATOM 55658 H1 WAT 1495 90.815 130.848 122.572 1.00 0.00 H ATOM 55659 H2 WAT 1495 91.782 130.262 121.566 1.00 0.00 H TER 55661 WAT 1495 ATOM 55661 O WAT 1496 133.323 15.605 103.329 1.00 0.00 O ATOM 55662 H1 WAT 1496 132.483 15.283 103.656 1.00 0.00 H ATOM 55663 H2 WAT 1496 133.576 14.972 102.657 1.00 0.00 H TER 55665 WAT 1496 ATOM 55665 O WAT 1497 111.547 100.314 -0.283 1.00 0.00 O ATOM 55666 H1 WAT 1497 110.623 100.136 -0.106 1.00 0.00 H ATOM 55667 H2 WAT 1497 111.991 100.113 0.541 1.00 0.00 H TER 55669 WAT 1497 ATOM 55669 O WAT 1498 67.888 36.119 10.411 1.00 0.00 O ATOM 55670 H1 WAT 1498 68.547 36.607 9.918 1.00 0.00 H ATOM 55671 H2 WAT 1498 67.188 36.752 10.568 1.00 0.00 H TER 55673 WAT 1498 ATOM 55673 O WAT 1499 142.259 56.525 106.799 1.00 0.00 O ATOM 55674 H1 WAT 1499 141.589 56.090 107.327 1.00 0.00 H ATOM 55675 H2 WAT 1499 143.058 56.455 107.322 1.00 0.00 H TER 55677 WAT 1499 ATOM 55677 O WAT 1500 111.130 118.111 136.031 1.00 0.00 O ATOM 55678 H1 WAT 1500 110.723 118.971 135.924 1.00 0.00 H ATOM 55679 H2 WAT 1500 110.430 117.489 135.833 1.00 0.00 H TER 55681 WAT 1500 ATOM 55681 O WAT 1501 26.723 133.280 18.042 1.00 0.00 O ATOM 55682 H1 WAT 1501 25.940 133.330 18.590 1.00 0.00 H ATOM 55683 H2 WAT 1501 26.765 132.363 17.768 1.00 0.00 H TER 55685 WAT 1501 ATOM 55685 O WAT 1502 40.887 139.922 60.620 1.00 0.00 O ATOM 55686 H1 WAT 1502 41.279 140.238 61.434 1.00 0.00 H ATOM 55687 H2 WAT 1502 40.196 140.555 60.425 1.00 0.00 H TER 55689 WAT 1502 ATOM 55689 O WAT 1503 92.561 35.227 73.989 1.00 0.00 O ATOM 55690 H1 WAT 1503 93.259 35.227 73.334 1.00 0.00 H ATOM 55691 H2 WAT 1503 92.221 36.122 73.976 1.00 0.00 H TER 55693 WAT 1503 ATOM 55693 O WAT 1504 104.438 87.083 73.070 1.00 0.00 O ATOM 55694 H1 WAT 1504 104.913 87.781 72.619 1.00 0.00 H ATOM 55695 H2 WAT 1504 103.544 87.416 73.153 1.00 0.00 H TER 55697 WAT 1504 ATOM 55697 O WAT 1505 29.924 13.855 22.525 1.00 0.00 O ATOM 55698 H1 WAT 1505 30.374 14.587 22.103 1.00 0.00 H ATOM 55699 H2 WAT 1505 30.415 13.081 22.249 1.00 0.00 H TER 55701 WAT 1505 ATOM 55701 O WAT 1506 83.811 91.750 6.393 1.00 0.00 O ATOM 55702 H1 WAT 1506 84.615 92.036 6.827 1.00 0.00 H ATOM 55703 H2 WAT 1506 83.230 92.509 6.441 1.00 0.00 H TER 55705 WAT 1506 ATOM 55705 O WAT 1507 95.833 91.816 134.747 1.00 0.00 O ATOM 55706 H1 WAT 1507 95.069 92.385 134.651 1.00 0.00 H ATOM 55707 H2 WAT 1507 95.473 90.977 135.032 1.00 0.00 H TER 55709 WAT 1507 ATOM 55709 O WAT 1508 53.124 129.596 116.372 1.00 0.00 O ATOM 55710 H1 WAT 1508 52.917 129.377 115.463 1.00 0.00 H ATOM 55711 H2 WAT 1508 52.438 129.168 116.884 1.00 0.00 H TER 55713 WAT 1508 ATOM 55713 O WAT 1509 119.483 16.674 58.252 1.00 0.00 O ATOM 55714 H1 WAT 1509 119.376 17.130 57.418 1.00 0.00 H ATOM 55715 H2 WAT 1509 118.714 16.107 58.316 1.00 0.00 H TER 55717 WAT 1509 ATOM 55717 O WAT 1510 51.429 38.424 147.171 1.00 0.00 O ATOM 55718 H1 WAT 1510 52.005 37.711 146.895 1.00 0.00 H ATOM 55719 H2 WAT 1510 51.406 38.358 148.126 1.00 0.00 H TER 55721 WAT 1510 ATOM 55721 O WAT 1511 91.764 102.835 76.205 1.00 0.00 O ATOM 55722 H1 WAT 1511 91.458 102.423 77.013 1.00 0.00 H ATOM 55723 H2 WAT 1511 91.372 102.312 75.506 1.00 0.00 H TER 55725 WAT 1511 ATOM 55725 O WAT 1512 54.378 46.381 116.184 1.00 0.00 O ATOM 55726 H1 WAT 1512 54.875 45.628 115.866 1.00 0.00 H ATOM 55727 H2 WAT 1512 54.074 46.119 117.053 1.00 0.00 H TER 55729 WAT 1512 ATOM 55729 O WAT 1513 50.582 33.921 154.200 1.00 0.00 O ATOM 55730 H1 WAT 1513 51.439 34.336 154.105 1.00 0.00 H ATOM 55731 H2 WAT 1513 50.420 33.509 153.351 1.00 0.00 H TER 55733 WAT 1513 ATOM 55733 O WAT 1514 83.800 45.706 142.845 1.00 0.00 O ATOM 55734 H1 WAT 1514 83.976 46.633 143.009 1.00 0.00 H ATOM 55735 H2 WAT 1514 82.990 45.704 142.335 1.00 0.00 H TER 55737 WAT 1514 ATOM 55737 O WAT 1515 74.751 78.815 59.949 1.00 0.00 O ATOM 55738 H1 WAT 1515 74.503 79.494 59.322 1.00 0.00 H ATOM 55739 H2 WAT 1515 75.073 78.095 59.408 1.00 0.00 H TER 55741 WAT 1515 ATOM 55741 O WAT 1516 58.104 53.372 75.916 1.00 0.00 O ATOM 55742 H1 WAT 1516 58.756 52.839 75.460 1.00 0.00 H ATOM 55743 H2 WAT 1516 57.721 52.780 76.563 1.00 0.00 H TER 55745 WAT 1516 ATOM 55745 O WAT 1517 11.779 120.000 10.854 1.00 0.00 O ATOM 55746 H1 WAT 1517 10.925 120.339 10.585 1.00 0.00 H ATOM 55747 H2 WAT 1517 11.946 120.417 11.700 1.00 0.00 H TER 55749 WAT 1517 ATOM 55749 O WAT 1518 19.131 128.591 100.667 1.00 0.00 O ATOM 55750 H1 WAT 1518 19.552 129.450 100.681 1.00 0.00 H ATOM 55751 H2 WAT 1518 18.709 128.517 101.523 1.00 0.00 H TER 55753 WAT 1518 ATOM 55753 O WAT 1519 38.033 70.080 23.759 1.00 0.00 O ATOM 55754 H1 WAT 1519 37.369 70.762 23.858 1.00 0.00 H ATOM 55755 H2 WAT 1519 38.702 70.302 24.407 1.00 0.00 H TER 55757 WAT 1519 ATOM 55757 O WAT 1520 59.978 35.604 63.631 1.00 0.00 O ATOM 55758 H1 WAT 1520 60.527 36.347 63.379 1.00 0.00 H ATOM 55759 H2 WAT 1520 60.565 34.848 63.591 1.00 0.00 H TER 55761 WAT 1520 ATOM 55761 O WAT 1521 91.638 51.944 54.148 1.00 0.00 O ATOM 55762 H1 WAT 1521 90.973 52.197 54.788 1.00 0.00 H ATOM 55763 H2 WAT 1521 91.409 51.046 53.906 1.00 0.00 H TER 55765 WAT 1521 ATOM 55765 O WAT 1522 125.103 116.240 156.551 1.00 0.00 O ATOM 55766 H1 WAT 1522 125.772 116.847 156.233 1.00 0.00 H ATOM 55767 H2 WAT 1522 125.586 115.610 157.086 1.00 0.00 H TER 55769 WAT 1522 ATOM 55769 O WAT 1523 78.209 69.772 130.801 1.00 0.00 O ATOM 55770 H1 WAT 1523 78.304 70.566 131.327 1.00 0.00 H ATOM 55771 H2 WAT 1523 78.835 69.881 130.086 1.00 0.00 H TER 55773 WAT 1523 ATOM 55773 O WAT 1524 132.722 37.159 60.917 1.00 0.00 O ATOM 55774 H1 WAT 1524 132.543 36.729 60.081 1.00 0.00 H ATOM 55775 H2 WAT 1524 133.509 36.725 61.246 1.00 0.00 H TER 55777 WAT 1524 ATOM 55777 O WAT 1525 132.134 50.422 106.955 1.00 0.00 O ATOM 55778 H1 WAT 1525 131.386 50.934 106.648 1.00 0.00 H ATOM 55779 H2 WAT 1525 131.769 49.840 107.622 1.00 0.00 H TER 55781 WAT 1525 ATOM 55781 O WAT 1526 141.598 59.605 87.601 1.00 0.00 O ATOM 55782 H1 WAT 1526 140.849 59.435 87.028 1.00 0.00 H ATOM 55783 H2 WAT 1526 142.355 59.299 87.102 1.00 0.00 H TER 55785 WAT 1526 ATOM 55785 O WAT 1527 118.060 139.524 98.615 1.00 0.00 O ATOM 55786 H1 WAT 1527 117.979 139.998 99.443 1.00 0.00 H ATOM 55787 H2 WAT 1527 117.165 139.260 98.402 1.00 0.00 H TER 55789 WAT 1527 ATOM 55789 O WAT 1528 69.637 5.288 94.808 1.00 0.00 O ATOM 55790 H1 WAT 1528 69.638 4.677 95.545 1.00 0.00 H ATOM 55791 H2 WAT 1528 69.017 4.909 94.185 1.00 0.00 H TER 55793 WAT 1528 ATOM 55793 O WAT 1529 38.861 18.409 1.404 1.00 0.00 O ATOM 55794 H1 WAT 1529 39.325 19.058 0.876 1.00 0.00 H ATOM 55795 H2 WAT 1529 39.554 17.915 1.842 1.00 0.00 H TER 55797 WAT 1529 ATOM 55797 O WAT 1530 141.284 48.561 137.650 1.00 0.00 O ATOM 55798 H1 WAT 1530 141.172 48.057 138.456 1.00 0.00 H ATOM 55799 H2 WAT 1530 141.608 47.925 137.012 1.00 0.00 H TER 55801 WAT 1530 ATOM 55801 O WAT 1531 27.140 89.847 21.886 1.00 0.00 O ATOM 55802 H1 WAT 1531 26.601 89.416 21.223 1.00 0.00 H ATOM 55803 H2 WAT 1531 26.626 89.784 22.691 1.00 0.00 H TER 55805 WAT 1531 ATOM 55805 O WAT 1532 18.263 67.115 4.831 1.00 0.00 O ATOM 55806 H1 WAT 1532 18.561 67.833 4.272 1.00 0.00 H ATOM 55807 H2 WAT 1532 18.840 67.151 5.595 1.00 0.00 H TER 55809 WAT 1532 ATOM 55809 O WAT 1533 73.283 51.316 103.015 1.00 0.00 O ATOM 55810 H1 WAT 1533 72.515 51.237 102.448 1.00 0.00 H ATOM 55811 H2 WAT 1533 73.227 52.203 103.370 1.00 0.00 H TER 55813 WAT 1533 ATOM 55813 O WAT 1534 13.352 1.397 79.933 1.00 0.00 O ATOM 55814 H1 WAT 1534 14.078 2.021 79.936 1.00 0.00 H ATOM 55815 H2 WAT 1534 13.467 0.892 80.738 1.00 0.00 H TER 55817 WAT 1534 ATOM 55817 O WAT 1535 134.106 44.527 126.962 1.00 0.00 O ATOM 55818 H1 WAT 1535 133.330 44.569 127.521 1.00 0.00 H ATOM 55819 H2 WAT 1535 134.842 44.536 127.573 1.00 0.00 H TER 55821 WAT 1535 ATOM 55821 O WAT 1536 133.588 95.922 103.074 1.00 0.00 O ATOM 55822 H1 WAT 1536 133.079 95.802 103.875 1.00 0.00 H ATOM 55823 H2 WAT 1536 133.343 95.180 102.521 1.00 0.00 H TER 55825 WAT 1536 ATOM 55825 O WAT 1537 18.746 129.840 62.383 1.00 0.00 O ATOM 55826 H1 WAT 1537 18.688 130.784 62.233 1.00 0.00 H ATOM 55827 H2 WAT 1537 19.352 129.527 61.711 1.00 0.00 H TER 55829 WAT 1537 ATOM 55829 O WAT 1538 101.857 1.606 94.523 1.00 0.00 O ATOM 55830 H1 WAT 1538 101.976 2.217 95.250 1.00 0.00 H ATOM 55831 H2 WAT 1538 101.069 1.914 94.077 1.00 0.00 H TER 55833 WAT 1538 ATOM 55833 O WAT 1539 63.856 104.761 148.493 1.00 0.00 O ATOM 55834 H1 WAT 1539 64.755 104.533 148.256 1.00 0.00 H ATOM 55835 H2 WAT 1539 63.934 105.188 149.346 1.00 0.00 H TER 55837 WAT 1539 ATOM 55837 O WAT 1540 11.524 25.964 125.513 1.00 0.00 O ATOM 55838 H1 WAT 1540 11.000 25.314 125.981 1.00 0.00 H ATOM 55839 H2 WAT 1540 10.950 26.726 125.439 1.00 0.00 H TER 55841 WAT 1540 ATOM 55841 O WAT 1541 43.966 105.583 141.208 1.00 0.00 O ATOM 55842 H1 WAT 1541 43.090 105.832 140.911 1.00 0.00 H ATOM 55843 H2 WAT 1541 44.228 104.879 140.615 1.00 0.00 H TER 55845 WAT 1541 ATOM 55845 O WAT 1542 128.424 64.488 117.005 1.00 0.00 O ATOM 55846 H1 WAT 1542 128.503 63.647 116.556 1.00 0.00 H ATOM 55847 H2 WAT 1542 128.535 64.276 117.932 1.00 0.00 H TER 55849 WAT 1542 ATOM 55849 O WAT 1543 27.666 40.907 143.619 1.00 0.00 O ATOM 55850 H1 WAT 1543 28.532 40.569 143.850 1.00 0.00 H ATOM 55851 H2 WAT 1543 27.107 40.657 144.355 1.00 0.00 H TER 55853 WAT 1543 ATOM 55853 O WAT 1544 61.570 102.147 123.760 1.00 0.00 O ATOM 55854 H1 WAT 1544 60.805 101.573 123.793 1.00 0.00 H ATOM 55855 H2 WAT 1544 61.642 102.502 124.646 1.00 0.00 H TER 55857 WAT 1544 ATOM 55857 O WAT 1545 65.065 45.184 2.240 1.00 0.00 O ATOM 55858 H1 WAT 1545 64.280 45.307 1.707 1.00 0.00 H ATOM 55859 H2 WAT 1545 65.264 44.251 2.163 1.00 0.00 H TER 55861 WAT 1545 ATOM 55861 O WAT 1546 27.118 75.365 18.820 1.00 0.00 O ATOM 55862 H1 WAT 1546 27.156 74.804 19.594 1.00 0.00 H ATOM 55863 H2 WAT 1546 26.185 75.536 18.693 1.00 0.00 H TER 55865 WAT 1546 ATOM 55865 O WAT 1547 2.731 95.045 65.926 1.00 0.00 O ATOM 55866 H1 WAT 1547 3.515 94.989 65.380 1.00 0.00 H ATOM 55867 H2 WAT 1547 2.079 94.518 65.464 1.00 0.00 H TER 55869 WAT 1547 ATOM 55869 O WAT 1548 23.873 0.010 77.177 1.00 0.00 O ATOM 55870 H1 WAT 1548 24.763 -0.343 77.190 1.00 0.00 H ATOM 55871 H2 WAT 1548 23.832 0.528 76.374 1.00 0.00 H TER 55873 WAT 1548 ATOM 55873 O WAT 1549 32.620 121.371 142.519 1.00 0.00 O ATOM 55874 H1 WAT 1549 32.621 120.675 141.861 1.00 0.00 H ATOM 55875 H2 WAT 1549 32.169 120.989 143.271 1.00 0.00 H TER 55877 WAT 1549 ATOM 55877 O WAT 1550 4.098 73.369 147.383 1.00 0.00 O ATOM 55878 H1 WAT 1550 4.683 74.074 147.105 1.00 0.00 H ATOM 55879 H2 WAT 1550 4.306 73.237 148.308 1.00 0.00 H TER 55881 WAT 1550 ATOM 55881 O WAT 1551 119.359 129.640 20.207 1.00 0.00 O ATOM 55882 H1 WAT 1551 119.882 129.443 20.984 1.00 0.00 H ATOM 55883 H2 WAT 1551 119.296 128.806 19.743 1.00 0.00 H TER 55885 WAT 1551 ATOM 55885 O WAT 1552 37.218 14.414 22.454 1.00 0.00 O ATOM 55886 H1 WAT 1552 37.202 15.058 21.746 1.00 0.00 H ATOM 55887 H2 WAT 1552 36.744 14.834 23.171 1.00 0.00 H TER 55889 WAT 1552 ATOM 55889 O WAT 1553 133.779 39.712 1.524 1.00 0.00 O ATOM 55890 H1 WAT 1553 132.950 39.900 1.965 1.00 0.00 H ATOM 55891 H2 WAT 1553 134.444 39.844 2.200 1.00 0.00 H TER 55893 WAT 1553 ATOM 55893 O WAT 1554 84.273 112.161 105.353 1.00 0.00 O ATOM 55894 H1 WAT 1554 84.938 111.562 105.692 1.00 0.00 H ATOM 55895 H2 WAT 1554 84.329 112.067 104.402 1.00 0.00 H TER 55897 WAT 1554 ATOM 55897 O WAT 1555 53.742 143.930 144.753 1.00 0.00 O ATOM 55898 H1 WAT 1555 54.640 144.239 144.868 1.00 0.00 H ATOM 55899 H2 WAT 1555 53.347 144.559 144.150 1.00 0.00 H TER 55901 WAT 1555 ATOM 55901 O WAT 1556 19.887 96.565 17.260 1.00 0.00 O ATOM 55902 H1 WAT 1556 20.066 96.394 18.185 1.00 0.00 H ATOM 55903 H2 WAT 1556 20.650 96.214 16.800 1.00 0.00 H TER 55905 WAT 1556 ATOM 55905 O WAT 1557 141.675 60.225 9.528 1.00 0.00 O ATOM 55906 H1 WAT 1557 141.834 60.834 10.249 1.00 0.00 H ATOM 55907 H2 WAT 1557 141.848 59.361 9.902 1.00 0.00 H TER 55909 WAT 1557 ATOM 55909 O WAT 1558 128.630 99.494 75.326 1.00 0.00 O ATOM 55910 H1 WAT 1558 128.451 98.850 74.640 1.00 0.00 H ATOM 55911 H2 WAT 1558 127.996 99.294 76.014 1.00 0.00 H TER 55913 WAT 1558 ATOM 55913 O WAT 1559 113.436 26.516 87.146 1.00 0.00 O ATOM 55914 H1 WAT 1559 112.878 26.925 86.485 1.00 0.00 H ATOM 55915 H2 WAT 1559 114.226 26.262 86.669 1.00 0.00 H TER 55917 WAT 1559 ATOM 55917 O WAT 1560 96.460 62.208 59.117 1.00 0.00 O ATOM 55918 H1 WAT 1560 95.806 61.846 58.519 1.00 0.00 H ATOM 55919 H2 WAT 1560 96.906 62.882 58.604 1.00 0.00 H TER 55921 WAT 1560 ATOM 55921 O WAT 1561 59.268 58.477 14.672 1.00 0.00 O ATOM 55922 H1 WAT 1561 58.435 58.937 14.570 1.00 0.00 H ATOM 55923 H2 WAT 1561 59.050 57.554 14.546 1.00 0.00 H TER 55925 WAT 1561 ATOM 55925 O WAT 1562 44.025 4.198 132.980 1.00 0.00 O ATOM 55926 H1 WAT 1562 44.825 3.673 132.956 1.00 0.00 H ATOM 55927 H2 WAT 1562 43.732 4.230 132.069 1.00 0.00 H TER 55929 WAT 1562 ATOM 55929 O WAT 1563 105.036 34.214 68.355 1.00 0.00 O ATOM 55930 H1 WAT 1563 105.064 33.342 67.962 1.00 0.00 H ATOM 55931 H2 WAT 1563 104.386 34.689 67.838 1.00 0.00 H TER 55933 WAT 1563 ATOM 55933 O WAT 1564 77.531 124.647 97.924 1.00 0.00 O ATOM 55934 H1 WAT 1564 77.954 123.795 98.028 1.00 0.00 H ATOM 55935 H2 WAT 1564 76.790 124.478 97.342 1.00 0.00 H TER 55937 WAT 1564 ATOM 55937 O WAT 1565 108.225 73.028 91.813 1.00 0.00 O ATOM 55938 H1 WAT 1565 107.484 73.564 92.094 1.00 0.00 H ATOM 55939 H2 WAT 1565 108.653 73.548 91.133 1.00 0.00 H TER 55941 WAT 1565 ATOM 55941 O WAT 1566 89.831 29.971 23.687 1.00 0.00 O ATOM 55942 H1 WAT 1566 90.184 29.085 23.608 1.00 0.00 H ATOM 55943 H2 WAT 1566 88.950 29.847 24.041 1.00 0.00 H TER 55945 WAT 1566 ATOM 55945 O WAT 1567 5.489 122.331 154.492 1.00 0.00 O ATOM 55946 H1 WAT 1567 5.824 122.733 153.691 1.00 0.00 H ATOM 55947 H2 WAT 1567 4.698 121.868 154.214 1.00 0.00 H TER 55949 WAT 1567 ATOM 55949 O WAT 1568 47.063 62.112 100.848 1.00 0.00 O ATOM 55950 H1 WAT 1568 47.344 61.581 100.103 1.00 0.00 H ATOM 55951 H2 WAT 1568 46.108 62.039 100.847 1.00 0.00 H TER 55953 WAT 1568 ATOM 55953 O WAT 1569 136.505 110.266 83.709 1.00 0.00 O ATOM 55954 H1 WAT 1569 136.936 109.467 83.404 1.00 0.00 H ATOM 55955 H2 WAT 1569 137.220 110.886 83.848 1.00 0.00 H TER 55957 WAT 1569 ATOM 55957 O WAT 1570 108.151 95.033 95.868 1.00 0.00 O ATOM 55958 H1 WAT 1570 107.799 94.267 95.415 1.00 0.00 H ATOM 55959 H2 WAT 1570 107.378 95.499 96.188 1.00 0.00 H TER 55961 WAT 1570 ATOM 55961 O WAT 1571 30.310 109.338 90.266 1.00 0.00 O ATOM 55962 H1 WAT 1571 30.031 110.139 90.710 1.00 0.00 H ATOM 55963 H2 WAT 1571 31.147 109.117 90.675 1.00 0.00 H TER 55965 WAT 1571 ATOM 55965 O WAT 1572 41.786 37.152 59.063 1.00 0.00 O ATOM 55966 H1 WAT 1572 41.289 37.921 58.783 1.00 0.00 H ATOM 55967 H2 WAT 1572 41.240 36.408 58.811 1.00 0.00 H TER 55969 WAT 1572 ATOM 55969 O WAT 1573 84.818 77.156 81.383 1.00 0.00 O ATOM 55970 H1 WAT 1573 85.628 77.617 81.162 1.00 0.00 H ATOM 55971 H2 WAT 1573 84.128 77.806 81.247 1.00 0.00 H TER 55973 WAT 1573 ATOM 55973 O WAT 1574 12.424 101.011 61.945 1.00 0.00 O ATOM 55974 H1 WAT 1574 12.991 101.622 62.417 1.00 0.00 H ATOM 55975 H2 WAT 1574 12.733 101.049 61.040 1.00 0.00 H TER 55977 WAT 1574 ATOM 55977 O WAT 1575 134.071 108.383 114.032 1.00 0.00 O ATOM 55978 H1 WAT 1575 133.712 109.124 114.519 1.00 0.00 H ATOM 55979 H2 WAT 1575 133.806 108.541 113.125 1.00 0.00 H TER 55981 WAT 1575 ATOM 55981 O WAT 1576 34.642 19.994 112.239 1.00 0.00 O ATOM 55982 H1 WAT 1576 35.281 19.302 112.411 1.00 0.00 H ATOM 55983 H2 WAT 1576 34.643 20.523 113.036 1.00 0.00 H TER 55985 WAT 1576 ATOM 55985 O WAT 1577 49.025 2.498 69.426 1.00 0.00 O ATOM 55986 H1 WAT 1577 48.781 3.332 69.828 1.00 0.00 H ATOM 55987 H2 WAT 1577 49.958 2.590 69.232 1.00 0.00 H TER 55989 WAT 1577 ATOM 55989 O WAT 1578 133.951 79.955 153.879 1.00 0.00 O ATOM 55990 H1 WAT 1578 134.755 80.238 154.314 1.00 0.00 H ATOM 55991 H2 WAT 1578 133.882 79.023 154.085 1.00 0.00 H TER 55993 WAT 1578 ATOM 55993 O WAT 1579 16.611 53.639 129.225 1.00 0.00 O ATOM 55994 H1 WAT 1579 16.014 52.892 129.189 1.00 0.00 H ATOM 55995 H2 WAT 1579 16.150 54.336 128.757 1.00 0.00 H TER 55997 WAT 1579 ATOM 55997 O WAT 1580 136.945 69.688 62.282 1.00 0.00 O ATOM 55998 H1 WAT 1580 137.346 70.436 62.726 1.00 0.00 H ATOM 55999 H2 WAT 1580 136.340 70.079 61.652 1.00 0.00 H TER 56001 WAT 1580 ATOM 56001 O WAT 1581 2.493 106.272 111.537 1.00 0.00 O ATOM 56002 H1 WAT 1581 2.720 106.015 110.643 1.00 0.00 H ATOM 56003 H2 WAT 1581 3.176 106.894 111.788 1.00 0.00 H TER 56005 WAT 1581 ATOM 56005 O WAT 1582 94.701 106.585 17.240 1.00 0.00 O ATOM 56006 H1 WAT 1582 93.825 106.913 17.443 1.00 0.00 H ATOM 56007 H2 WAT 1582 95.260 106.954 17.924 1.00 0.00 H TER 56009 WAT 1582 ATOM 56009 O WAT 1583 99.836 112.339 15.208 1.00 0.00 O ATOM 56010 H1 WAT 1583 100.139 111.896 14.415 1.00 0.00 H ATOM 56011 H2 WAT 1583 99.961 113.270 15.024 1.00 0.00 H TER 56013 WAT 1583 ATOM 56013 O WAT 1584 15.285 71.000 71.385 1.00 0.00 O ATOM 56014 H1 WAT 1584 15.185 70.055 71.272 1.00 0.00 H ATOM 56015 H2 WAT 1584 14.815 71.195 72.196 1.00 0.00 H TER 56017 WAT 1584 ATOM 56017 O WAT 1585 24.078 100.812 116.207 1.00 0.00 O ATOM 56018 H1 WAT 1585 24.044 100.948 117.154 1.00 0.00 H ATOM 56019 H2 WAT 1585 24.859 100.275 116.070 1.00 0.00 H TER 56021 WAT 1585 ATOM 56021 O WAT 1586 45.463 33.475 133.555 1.00 0.00 O ATOM 56022 H1 WAT 1586 44.973 33.952 132.885 1.00 0.00 H ATOM 56023 H2 WAT 1586 44.790 33.105 134.127 1.00 0.00 H TER 56025 WAT 1586 ATOM 56025 O WAT 1587 26.516 108.900 134.486 1.00 0.00 O ATOM 56026 H1 WAT 1587 27.254 109.503 134.580 1.00 0.00 H ATOM 56027 H2 WAT 1587 26.124 109.130 133.644 1.00 0.00 H TER 56029 WAT 1587 ATOM 56029 O WAT 1588 73.621 144.862 73.583 1.00 0.00 O ATOM 56030 H1 WAT 1588 74.225 145.412 74.082 1.00 0.00 H ATOM 56031 H2 WAT 1588 72.753 145.196 73.806 1.00 0.00 H TER 56033 WAT 1588 ATOM 56033 O WAT 1589 65.016 60.835 152.724 1.00 0.00 O ATOM 56034 H1 WAT 1589 64.641 61.162 153.542 1.00 0.00 H ATOM 56035 H2 WAT 1589 65.427 60.005 152.964 1.00 0.00 H TER 56037 WAT 1589 ATOM 56037 O WAT 1590 134.769 16.578 53.911 1.00 0.00 O ATOM 56038 H1 WAT 1590 134.957 17.392 53.444 1.00 0.00 H ATOM 56039 H2 WAT 1590 134.966 16.776 54.827 1.00 0.00 H TER 56041 WAT 1590 ATOM 56041 O WAT 1591 98.431 28.957 86.163 1.00 0.00 O ATOM 56042 H1 WAT 1591 98.539 28.790 85.226 1.00 0.00 H ATOM 56043 H2 WAT 1591 98.123 29.862 86.210 1.00 0.00 H TER 56045 WAT 1591 ATOM 56045 O WAT 1592 18.828 128.054 152.108 1.00 0.00 O ATOM 56046 H1 WAT 1592 18.904 127.255 152.629 1.00 0.00 H ATOM 56047 H2 WAT 1592 18.329 127.790 151.336 1.00 0.00 H TER 56049 WAT 1592 ATOM 56049 O WAT 1593 141.912 91.351 132.241 1.00 0.00 O ATOM 56050 H1 WAT 1593 141.811 91.728 131.367 1.00 0.00 H ATOM 56051 H2 WAT 1593 141.284 91.828 132.783 1.00 0.00 H TER 56053 WAT 1593 ATOM 56053 O WAT 1594 84.118 39.696 21.123 1.00 0.00 O ATOM 56054 H1 WAT 1594 84.221 39.566 22.066 1.00 0.00 H ATOM 56055 H2 WAT 1594 83.302 40.189 21.036 1.00 0.00 H TER 56057 WAT 1594 ATOM 56057 O WAT 1595 121.544 124.821 9.056 1.00 0.00 O ATOM 56058 H1 WAT 1595 122.089 124.352 9.688 1.00 0.00 H ATOM 56059 H2 WAT 1595 121.905 125.707 9.039 1.00 0.00 H TER 56061 WAT 1595 ATOM 56061 O WAT 1596 74.445 61.940 112.495 1.00 0.00 O ATOM 56062 H1 WAT 1596 74.152 61.205 111.956 1.00 0.00 H ATOM 56063 H2 WAT 1596 73.821 62.640 112.304 1.00 0.00 H TER 56065 WAT 1596 ATOM 56065 O WAT 1597 141.131 143.133 0.294 1.00 0.00 O ATOM 56066 H1 WAT 1597 140.939 142.279 0.681 1.00 0.00 H ATOM 56067 H2 WAT 1597 140.272 143.503 0.091 1.00 0.00 H TER 56069 WAT 1597 ATOM 56069 O WAT 1598 42.630 48.759 18.959 1.00 0.00 O ATOM 56070 H1 WAT 1598 42.443 48.036 18.362 1.00 0.00 H ATOM 56071 H2 WAT 1598 43.099 48.353 19.688 1.00 0.00 H TER 56073 WAT 1598 ATOM 56073 O WAT 1599 75.387 130.579 128.673 1.00 0.00 O ATOM 56074 H1 WAT 1599 75.425 131.229 127.972 1.00 0.00 H ATOM 56075 H2 WAT 1599 74.939 131.026 129.391 1.00 0.00 H TER 56077 WAT 1599 ATOM 56077 O WAT 1600 139.867 48.650 114.621 1.00 0.00 O ATOM 56078 H1 WAT 1600 140.013 48.291 113.745 1.00 0.00 H ATOM 56079 H2 WAT 1600 139.520 47.915 115.126 1.00 0.00 H TER 56081 WAT 1600 ATOM 56081 O WAT 1601 9.910 135.810 18.204 1.00 0.00 O ATOM 56082 H1 WAT 1601 9.332 136.200 17.548 1.00 0.00 H ATOM 56083 H2 WAT 1601 10.511 136.516 18.443 1.00 0.00 H TER 56085 WAT 1601 ATOM 56085 O WAT 1602 12.253 120.207 121.789 1.00 0.00 O ATOM 56086 H1 WAT 1602 12.019 120.407 120.883 1.00 0.00 H ATOM 56087 H2 WAT 1602 12.964 120.815 121.992 1.00 0.00 H TER 56089 WAT 1602 ATOM 56089 O WAT 1603 46.380 48.908 109.087 1.00 0.00 O ATOM 56090 H1 WAT 1603 47.168 49.439 109.204 1.00 0.00 H ATOM 56091 H2 WAT 1603 45.990 49.233 108.276 1.00 0.00 H TER 56093 WAT 1603 ATOM 56093 O WAT 1604 29.497 126.463 72.655 1.00 0.00 O ATOM 56094 H1 WAT 1604 29.224 125.927 73.399 1.00 0.00 H ATOM 56095 H2 WAT 1604 30.324 126.074 72.370 1.00 0.00 H TER 56097 WAT 1604 ATOM 56097 O WAT 1605 91.822 29.191 95.216 1.00 0.00 O ATOM 56098 H1 WAT 1605 92.210 29.640 94.466 1.00 0.00 H ATOM 56099 H2 WAT 1605 91.507 28.360 94.861 1.00 0.00 H TER 56101 WAT 1605 ATOM 56101 O WAT 1606 131.815 139.522 64.321 1.00 0.00 O ATOM 56102 H1 WAT 1606 131.811 140.250 63.700 1.00 0.00 H ATOM 56103 H2 WAT 1606 131.336 139.852 65.081 1.00 0.00 H TER 56105 WAT 1606 ATOM 56105 O WAT 1607 22.366 14.772 83.205 1.00 0.00 O ATOM 56106 H1 WAT 1607 23.271 14.469 83.124 1.00 0.00 H ATOM 56107 H2 WAT 1607 22.217 15.292 82.415 1.00 0.00 H TER 56109 WAT 1607 ATOM 56109 O WAT 1608 76.211 102.179 120.681 1.00 0.00 O ATOM 56110 H1 WAT 1608 75.760 102.561 119.928 1.00 0.00 H ATOM 56111 H2 WAT 1608 76.100 102.824 121.380 1.00 0.00 H TER 56113 WAT 1608 ATOM 56113 O WAT 1609 99.227 88.517 67.704 1.00 0.00 O ATOM 56114 H1 WAT 1609 99.083 89.147 68.410 1.00 0.00 H ATOM 56115 H2 WAT 1609 99.500 89.050 66.958 1.00 0.00 H TER 56117 WAT 1609 ATOM 56117 O WAT 1610 123.612 66.233 71.227 1.00 0.00 O ATOM 56118 H1 WAT 1610 122.816 66.701 71.477 1.00 0.00 H ATOM 56119 H2 WAT 1610 123.737 66.451 70.303 1.00 0.00 H TER 56121 WAT 1610 ATOM 56121 O WAT 1611 35.418 144.797 110.675 1.00 0.00 O ATOM 56122 H1 WAT 1611 36.326 144.507 110.592 1.00 0.00 H ATOM 56123 H2 WAT 1611 35.054 144.698 109.795 1.00 0.00 H TER 56125 WAT 1611 ATOM 56125 O WAT 1612 56.665 128.229 89.330 1.00 0.00 O ATOM 56126 H1 WAT 1612 56.250 128.092 88.479 1.00 0.00 H ATOM 56127 H2 WAT 1612 56.043 127.865 89.961 1.00 0.00 H TER 56129 WAT 1612 ATOM 56129 O WAT 1613 99.830 36.310 94.222 1.00 0.00 O ATOM 56130 H1 WAT 1613 100.487 35.858 93.694 1.00 0.00 H ATOM 56131 H2 WAT 1613 99.953 35.964 95.106 1.00 0.00 H TER 56133 WAT 1613 ATOM 56133 O WAT 1614 49.589 47.337 15.525 1.00 0.00 O ATOM 56134 H1 WAT 1614 50.177 46.988 14.856 1.00 0.00 H ATOM 56135 H2 WAT 1614 49.463 46.611 16.136 1.00 0.00 H TER 56137 WAT 1614 ATOM 56137 O WAT 1615 61.764 138.377 60.481 1.00 0.00 O ATOM 56138 H1 WAT 1615 62.000 139.276 60.255 1.00 0.00 H ATOM 56139 H2 WAT 1615 61.203 138.088 59.760 1.00 0.00 H TER 56141 WAT 1615 ATOM 56141 O WAT 1616 61.387 52.490 85.032 1.00 0.00 O ATOM 56142 H1 WAT 1616 62.294 52.597 85.320 1.00 0.00 H ATOM 56143 H2 WAT 1616 61.319 53.039 84.251 1.00 0.00 H TER 56145 WAT 1616 ATOM 56145 O WAT 1617 6.790 96.296 114.391 1.00 0.00 O ATOM 56146 H1 WAT 1617 7.587 96.352 113.865 1.00 0.00 H ATOM 56147 H2 WAT 1617 6.085 96.208 113.749 1.00 0.00 H TER 56149 WAT 1617 ATOM 56149 O WAT 1618 70.096 98.239 17.497 1.00 0.00 O ATOM 56150 H1 WAT 1618 69.525 98.410 18.245 1.00 0.00 H ATOM 56151 H2 WAT 1618 69.542 98.393 16.732 1.00 0.00 H TER 56153 WAT 1618 ATOM 56153 O WAT 1619 48.329 66.130 20.405 1.00 0.00 O ATOM 56154 H1 WAT 1619 49.249 66.386 20.343 1.00 0.00 H ATOM 56155 H2 WAT 1619 48.316 65.214 20.128 1.00 0.00 H TER 56157 WAT 1619 ATOM 56157 O WAT 1620 65.115 125.464 82.362 1.00 0.00 O ATOM 56158 H1 WAT 1620 65.149 126.334 81.965 1.00 0.00 H ATOM 56159 H2 WAT 1620 65.836 125.458 82.991 1.00 0.00 H TER 56161 WAT 1620 ATOM 56161 O WAT 1621 99.856 48.867 130.084 1.00 0.00 O ATOM 56162 H1 WAT 1621 100.440 48.801 130.839 1.00 0.00 H ATOM 56163 H2 WAT 1621 99.736 47.963 129.794 1.00 0.00 H TER 56165 WAT 1621 ATOM 56165 O WAT 1622 122.110 53.391 131.808 1.00 0.00 O ATOM 56166 H1 WAT 1622 121.270 53.597 132.219 1.00 0.00 H ATOM 56167 H2 WAT 1622 122.174 54.002 131.074 1.00 0.00 H TER 56169 WAT 1622 ATOM 56169 O WAT 1623 145.455 97.890 116.588 1.00 0.00 O ATOM 56170 H1 WAT 1623 144.719 97.464 117.027 1.00 0.00 H ATOM 56171 H2 WAT 1623 145.867 98.420 117.271 1.00 0.00 H TER 56173 WAT 1623 ATOM 56173 O WAT 1624 126.857 4.573 147.689 1.00 0.00 O ATOM 56174 H1 WAT 1624 127.434 4.541 146.925 1.00 0.00 H ATOM 56175 H2 WAT 1624 127.439 4.784 148.419 1.00 0.00 H TER 56177 WAT 1624 ATOM 56177 O WAT 1625 129.457 89.686 125.795 1.00 0.00 O ATOM 56178 H1 WAT 1625 130.086 89.239 125.229 1.00 0.00 H ATOM 56179 H2 WAT 1625 129.212 89.030 126.447 1.00 0.00 H TER 56181 WAT 1625 ATOM 56181 O WAT 1626 14.586 93.135 142.065 1.00 0.00 O ATOM 56182 H1 WAT 1626 14.329 92.231 141.885 1.00 0.00 H ATOM 56183 H2 WAT 1626 15.024 93.095 142.916 1.00 0.00 H TER 56185 WAT 1626 ATOM 56185 O WAT 1627 70.779 97.745 134.157 1.00 0.00 O ATOM 56186 H1 WAT 1627 71.453 98.223 134.640 1.00 0.00 H ATOM 56187 H2 WAT 1627 69.976 98.243 134.311 1.00 0.00 H TER 56189 WAT 1627 ATOM 56189 O WAT 1628 36.557 71.520 118.038 1.00 0.00 O ATOM 56190 H1 WAT 1628 36.964 70.824 117.521 1.00 0.00 H ATOM 56191 H2 WAT 1628 36.067 72.037 117.399 1.00 0.00 H TER 56193 WAT 1628 ATOM 56193 O WAT 1629 81.709 57.749 8.261 1.00 0.00 O ATOM 56194 H1 WAT 1629 82.046 58.366 7.611 1.00 0.00 H ATOM 56195 H2 WAT 1629 81.056 58.249 8.750 1.00 0.00 H TER 56197 WAT 1629 ATOM 56197 O WAT 1630 78.068 49.601 157.483 1.00 0.00 O ATOM 56198 H1 WAT 1630 78.706 48.887 157.473 1.00 0.00 H ATOM 56199 H2 WAT 1630 77.268 49.203 157.825 1.00 0.00 H TER 56201 WAT 1630 ATOM 56201 O WAT 1631 141.964 144.644 67.007 1.00 0.00 O ATOM 56202 H1 WAT 1631 141.361 145.364 66.820 1.00 0.00 H ATOM 56203 H2 WAT 1631 142.598 144.671 66.291 1.00 0.00 H TER 56205 WAT 1631 ATOM 56205 O WAT 1632 131.669 90.395 86.868 1.00 0.00 O ATOM 56206 H1 WAT 1632 132.233 89.985 86.212 1.00 0.00 H ATOM 56207 H2 WAT 1632 132.268 90.655 87.568 1.00 0.00 H TER 56209 WAT 1632 ATOM 56209 O WAT 1633 58.058 78.527 107.569 1.00 0.00 O ATOM 56210 H1 WAT 1633 58.184 77.624 107.861 1.00 0.00 H ATOM 56211 H2 WAT 1633 57.144 78.562 107.286 1.00 0.00 H TER 56213 WAT 1633 ATOM 56213 O WAT 1634 9.185 69.349 129.211 1.00 0.00 O ATOM 56214 H1 WAT 1634 9.005 70.173 129.664 1.00 0.00 H ATOM 56215 H2 WAT 1634 9.109 69.565 128.282 1.00 0.00 H TER 56217 WAT 1634 ATOM 56217 O WAT 1635 55.396 17.196 15.215 1.00 0.00 O ATOM 56218 H1 WAT 1635 55.513 16.292 15.509 1.00 0.00 H ATOM 56219 H2 WAT 1635 55.266 17.694 16.022 1.00 0.00 H TER 56221 WAT 1635 ATOM 56221 O WAT 1636 20.183 45.998 3.627 1.00 0.00 O ATOM 56222 H1 WAT 1636 19.491 46.633 3.812 1.00 0.00 H ATOM 56223 H2 WAT 1636 20.780 46.460 3.038 1.00 0.00 H TER 56225 WAT 1636 ATOM 56225 O WAT 1637 12.874 82.017 127.663 1.00 0.00 O ATOM 56226 H1 WAT 1637 12.976 82.110 128.610 1.00 0.00 H ATOM 56227 H2 WAT 1637 12.800 82.916 127.341 1.00 0.00 H TER 56229 WAT 1637 ATOM 56229 O WAT 1638 118.454 134.838 156.229 1.00 0.00 O ATOM 56230 H1 WAT 1638 117.859 134.922 156.975 1.00 0.00 H ATOM 56231 H2 WAT 1638 118.689 135.739 156.008 1.00 0.00 H TER 56233 WAT 1638 ATOM 56233 O WAT 1639 104.639 74.137 71.530 1.00 0.00 O ATOM 56234 H1 WAT 1639 105.307 74.684 71.943 1.00 0.00 H ATOM 56235 H2 WAT 1639 103.825 74.629 71.641 1.00 0.00 H TER 56237 WAT 1639 ATOM 56237 O WAT 1640 34.330 6.745 118.850 1.00 0.00 O ATOM 56238 H1 WAT 1640 34.455 6.426 119.744 1.00 0.00 H ATOM 56239 H2 WAT 1640 34.644 6.031 118.295 1.00 0.00 H TER 56241 WAT 1640 ATOM 56241 O WAT 1641 113.561 143.068 76.387 1.00 0.00 O ATOM 56242 H1 WAT 1641 113.515 143.865 76.915 1.00 0.00 H ATOM 56243 H2 WAT 1641 112.771 143.093 75.846 1.00 0.00 H TER 56245 WAT 1641 ATOM 56245 O WAT 1642 3.308 31.239 150.651 1.00 0.00 O ATOM 56246 H1 WAT 1642 3.341 30.407 151.124 1.00 0.00 H ATOM 56247 H2 WAT 1642 2.970 31.865 151.290 1.00 0.00 H TER 56249 WAT 1642 ATOM 56249 O WAT 1643 110.390 34.007 77.290 1.00 0.00 O ATOM 56250 H1 WAT 1643 109.638 34.470 77.660 1.00 0.00 H ATOM 56251 H2 WAT 1643 110.006 33.273 76.809 1.00 0.00 H TER 56253 WAT 1643 ATOM 56253 O WAT 1644 70.179 29.593 117.261 1.00 0.00 O ATOM 56254 H1 WAT 1644 69.841 30.486 117.202 1.00 0.00 H ATOM 56255 H2 WAT 1644 70.664 29.574 118.087 1.00 0.00 H TER 56257 WAT 1644 ATOM 56257 O WAT 1645 35.203 132.493 134.718 1.00 0.00 O ATOM 56258 H1 WAT 1645 35.203 132.598 133.767 1.00 0.00 H ATOM 56259 H2 WAT 1645 34.329 132.161 134.922 1.00 0.00 H TER 56261 WAT 1645 ATOM 56261 O WAT 1646 30.681 27.476 93.219 1.00 0.00 O ATOM 56262 H1 WAT 1646 31.170 27.982 93.868 1.00 0.00 H ATOM 56263 H2 WAT 1646 31.191 26.673 93.109 1.00 0.00 H TER 56265 WAT 1646 ATOM 56265 O WAT 1647 47.176 99.552 89.865 1.00 0.00 O ATOM 56266 H1 WAT 1647 47.350 98.630 90.054 1.00 0.00 H ATOM 56267 H2 WAT 1647 46.602 99.535 89.099 1.00 0.00 H TER 56269 WAT 1647 ATOM 56269 O WAT 1648 142.648 67.317 65.373 1.00 0.00 O ATOM 56270 H1 WAT 1648 142.966 68.150 65.023 1.00 0.00 H ATOM 56271 H2 WAT 1648 141.835 67.152 64.895 1.00 0.00 H TER 56273 WAT 1648 ATOM 56273 O WAT 1649 128.129 77.774 20.070 1.00 0.00 O ATOM 56274 H1 WAT 1649 128.626 76.964 20.183 1.00 0.00 H ATOM 56275 H2 WAT 1649 127.214 77.492 20.051 1.00 0.00 H TER 56277 WAT 1649 ATOM 56277 O WAT 1650 7.509 60.449 134.247 1.00 0.00 O ATOM 56278 H1 WAT 1650 7.649 59.523 134.442 1.00 0.00 H ATOM 56279 H2 WAT 1650 7.677 60.524 133.307 1.00 0.00 H TER 56281 WAT 1650 ATOM 56281 O WAT 1651 13.918 113.685 57.173 1.00 0.00 O ATOM 56282 H1 WAT 1651 13.573 113.004 57.751 1.00 0.00 H ATOM 56283 H2 WAT 1651 14.267 114.349 57.767 1.00 0.00 H TER 56285 WAT 1651 ATOM 56285 O WAT 1652 137.063 73.844 85.685 1.00 0.00 O ATOM 56286 H1 WAT 1652 137.173 74.093 86.602 1.00 0.00 H ATOM 56287 H2 WAT 1652 136.866 74.666 85.235 1.00 0.00 H TER 56289 WAT 1652 ATOM 56289 O WAT 1653 140.550 38.884 157.248 1.00 0.00 O ATOM 56290 H1 WAT 1653 140.640 39.266 156.374 1.00 0.00 H ATOM 56291 H2 WAT 1653 139.671 39.138 157.530 1.00 0.00 H TER 56293 WAT 1653 ATOM 56293 O WAT 1654 41.999 54.025 122.666 1.00 0.00 O ATOM 56294 H1 WAT 1654 41.622 54.017 121.787 1.00 0.00 H ATOM 56295 H2 WAT 1654 41.583 53.286 123.112 1.00 0.00 H TER 56297 WAT 1654 ATOM 56297 O WAT 1655 76.130 82.820 129.027 1.00 0.00 O ATOM 56298 H1 WAT 1655 75.531 82.076 129.081 1.00 0.00 H ATOM 56299 H2 WAT 1655 75.954 83.327 129.820 1.00 0.00 H TER 56301 WAT 1655 ATOM 56301 O WAT 1656 69.689 49.597 71.693 1.00 0.00 O ATOM 56302 H1 WAT 1656 70.617 49.807 71.797 1.00 0.00 H ATOM 56303 H2 WAT 1656 69.671 48.649 71.561 1.00 0.00 H TER 56305 WAT 1656 ATOM 56305 O WAT 1657 25.757 21.493 102.093 1.00 0.00 O ATOM 56306 H1 WAT 1657 25.257 22.230 101.743 1.00 0.00 H ATOM 56307 H2 WAT 1657 26.292 21.876 102.790 1.00 0.00 H TER 56309 WAT 1657 ATOM 56309 O WAT 1658 113.560 21.323 14.488 1.00 0.00 O ATOM 56310 H1 WAT 1658 114.136 20.586 14.285 1.00 0.00 H ATOM 56311 H2 WAT 1658 112.701 20.924 14.627 1.00 0.00 H TER 56313 WAT 1658 ATOM 56313 O WAT 1659 99.704 86.354 81.225 1.00 0.00 O ATOM 56314 H1 WAT 1659 99.785 87.303 81.320 1.00 0.00 H ATOM 56315 H2 WAT 1659 100.524 86.083 80.812 1.00 0.00 H TER 56317 WAT 1659 ATOM 56317 O WAT 1660 136.127 45.640 142.924 1.00 0.00 O ATOM 56318 H1 WAT 1660 136.888 45.106 143.149 1.00 0.00 H ATOM 56319 H2 WAT 1660 136.492 46.496 142.700 1.00 0.00 H TER 56321 WAT 1660 ATOM 56321 O WAT 1661 136.816 142.226 62.886 1.00 0.00 O ATOM 56322 H1 WAT 1661 136.563 141.917 62.016 1.00 0.00 H ATOM 56323 H2 WAT 1661 137.744 142.446 62.802 1.00 0.00 H TER 56325 WAT 1661 ATOM 56325 O WAT 1662 73.119 57.916 69.915 1.00 0.00 O ATOM 56326 H1 WAT 1662 73.690 57.424 70.505 1.00 0.00 H ATOM 56327 H2 WAT 1662 72.527 57.258 69.551 1.00 0.00 H TER 56329 WAT 1662 ATOM 56329 O WAT 1663 112.299 59.554 135.864 1.00 0.00 O ATOM 56330 H1 WAT 1663 112.791 59.878 135.110 1.00 0.00 H ATOM 56331 H2 WAT 1663 111.420 59.387 135.523 1.00 0.00 H TER 56333 WAT 1663 ATOM 56333 O WAT 1664 103.329 8.690 85.428 1.00 0.00 O ATOM 56334 H1 WAT 1664 103.098 8.072 84.734 1.00 0.00 H ATOM 56335 H2 WAT 1664 102.861 8.369 86.199 1.00 0.00 H TER 56337 WAT 1664 ATOM 56337 O WAT 1665 1.364 47.140 151.463 1.00 0.00 O ATOM 56338 H1 WAT 1665 1.019 47.608 150.703 1.00 0.00 H ATOM 56339 H2 WAT 1665 0.659 47.179 152.109 1.00 0.00 H TER 56341 WAT 1665 ATOM 56341 O WAT 1666 122.568 86.291 8.084 1.00 0.00 O ATOM 56342 H1 WAT 1666 123.351 86.771 7.815 1.00 0.00 H ATOM 56343 H2 WAT 1666 122.050 86.932 8.571 1.00 0.00 H TER 56345 WAT 1666 ATOM 56345 O WAT 1667 45.465 111.061 131.526 1.00 0.00 O ATOM 56346 H1 WAT 1667 44.668 111.468 131.863 1.00 0.00 H ATOM 56347 H2 WAT 1667 45.678 111.564 130.740 1.00 0.00 H TER 56349 WAT 1667 ATOM 56349 O WAT 1668 106.346 137.946 153.954 1.00 0.00 O ATOM 56350 H1 WAT 1668 105.508 138.406 153.981 1.00 0.00 H ATOM 56351 H2 WAT 1668 106.860 138.423 153.302 1.00 0.00 H TER 56353 WAT 1668 ATOM 56353 O WAT 1669 79.268 56.448 7.599 1.00 0.00 O ATOM 56354 H1 WAT 1669 80.106 56.813 7.884 1.00 0.00 H ATOM 56355 H2 WAT 1669 79.282 56.530 6.645 1.00 0.00 H TER 56357 WAT 1669 ATOM 56357 O WAT 1670 119.903 88.797 110.253 1.00 0.00 O ATOM 56358 H1 WAT 1670 120.364 88.700 111.086 1.00 0.00 H ATOM 56359 H2 WAT 1670 119.317 89.542 110.389 1.00 0.00 H TER 56361 WAT 1670 ATOM 56361 O WAT 1671 16.670 6.350 140.176 1.00 0.00 O ATOM 56362 H1 WAT 1671 17.022 5.519 139.855 1.00 0.00 H ATOM 56363 H2 WAT 1671 17.086 6.471 141.030 1.00 0.00 H TER 56365 WAT 1671 ATOM 56365 O WAT 1672 19.246 9.007 133.603 1.00 0.00 O ATOM 56366 H1 WAT 1672 18.423 8.523 133.548 1.00 0.00 H ATOM 56367 H2 WAT 1672 19.067 9.716 134.220 1.00 0.00 H TER 56369 WAT 1672 ATOM 56369 O WAT 1673 137.000 48.069 147.177 1.00 0.00 O ATOM 56370 H1 WAT 1673 136.309 47.900 146.537 1.00 0.00 H ATOM 56371 H2 WAT 1673 136.548 48.080 148.021 1.00 0.00 H TER 56373 WAT 1673 ATOM 56373 O WAT 1674 36.583 138.841 136.981 1.00 0.00 O ATOM 56374 H1 WAT 1674 36.968 139.565 136.489 1.00 0.00 H ATOM 56375 H2 WAT 1674 35.959 139.259 137.574 1.00 0.00 H TER 56377 WAT 1674 ATOM 56377 O WAT 1675 130.308 73.091 112.861 1.00 0.00 O ATOM 56378 H1 WAT 1675 130.323 73.998 112.556 1.00 0.00 H ATOM 56379 H2 WAT 1675 129.652 72.665 112.310 1.00 0.00 H TER 56381 WAT 1675 ATOM 56381 O WAT 1676 28.672 69.800 120.819 1.00 0.00 O ATOM 56382 H1 WAT 1676 28.370 69.962 121.713 1.00 0.00 H ATOM 56383 H2 WAT 1676 28.079 70.312 120.270 1.00 0.00 H TER 56385 WAT 1676 ATOM 56385 O WAT 1677 121.160 67.064 116.988 1.00 0.00 O ATOM 56386 H1 WAT 1677 121.356 67.430 116.125 1.00 0.00 H ATOM 56387 H2 WAT 1677 121.221 67.811 117.584 1.00 0.00 H TER 56389 WAT 1677 ATOM 56389 O WAT 1678 144.376 110.272 0.545 1.00 0.00 O ATOM 56390 H1 WAT 1678 145.322 110.130 0.562 1.00 0.00 H ATOM 56391 H2 WAT 1678 144.268 111.195 0.772 1.00 0.00 H TER 56393 WAT 1678 ATOM 56393 O WAT 1679 59.767 116.969 58.675 1.00 0.00 O ATOM 56394 H1 WAT 1679 59.639 117.744 58.128 1.00 0.00 H ATOM 56395 H2 WAT 1679 59.784 116.239 58.055 1.00 0.00 H TER 56397 WAT 1679 ATOM 56397 O WAT 1680 18.890 139.238 20.551 1.00 0.00 O ATOM 56398 H1 WAT 1680 19.262 140.020 20.958 1.00 0.00 H ATOM 56399 H2 WAT 1680 19.153 139.298 19.633 1.00 0.00 H TER 56401 WAT 1680 ATOM 56401 O WAT 1681 49.138 118.244 127.014 1.00 0.00 O ATOM 56402 H1 WAT 1681 49.793 117.613 126.716 1.00 0.00 H ATOM 56403 H2 WAT 1681 49.647 119.005 127.292 1.00 0.00 H TER 56405 WAT 1681 ATOM 56405 O WAT 1682 30.834 109.193 96.739 1.00 0.00 O ATOM 56406 H1 WAT 1682 30.143 109.849 96.836 1.00 0.00 H ATOM 56407 H2 WAT 1682 31.064 109.222 95.811 1.00 0.00 H TER 56409 WAT 1682 ATOM 56409 O WAT 1683 45.033 63.672 138.577 1.00 0.00 O ATOM 56410 H1 WAT 1683 44.420 64.095 137.976 1.00 0.00 H ATOM 56411 H2 WAT 1683 44.920 62.735 138.414 1.00 0.00 H TER 56413 WAT 1683 ATOM 56413 O WAT 1684 119.278 42.962 128.368 1.00 0.00 O ATOM 56414 H1 WAT 1684 119.833 43.345 129.047 1.00 0.00 H ATOM 56415 H2 WAT 1684 118.424 42.855 128.787 1.00 0.00 H TER 56417 WAT 1684 ATOM 56417 O WAT 1685 117.811 74.449 98.523 1.00 0.00 O ATOM 56418 H1 WAT 1685 117.085 74.457 97.899 1.00 0.00 H ATOM 56419 H2 WAT 1685 117.405 74.655 99.365 1.00 0.00 H TER 56421 WAT 1685 ATOM 56421 O WAT 1686 111.275 114.867 144.885 1.00 0.00 O ATOM 56422 H1 WAT 1686 111.884 115.495 144.498 1.00 0.00 H ATOM 56423 H2 WAT 1686 111.826 114.133 145.155 1.00 0.00 H TER 56425 WAT 1686 ATOM 56425 O WAT 1687 90.994 0.393 130.304 1.00 0.00 O ATOM 56426 H1 WAT 1687 91.648 0.240 129.622 1.00 0.00 H ATOM 56427 H2 WAT 1687 90.220 -0.082 130.003 1.00 0.00 H TER 56429 WAT 1687 ATOM 56429 O WAT 1688 102.874 109.862 91.558 1.00 0.00 O ATOM 56430 H1 WAT 1688 103.340 110.425 92.175 1.00 0.00 H ATOM 56431 H2 WAT 1688 101.984 109.810 91.906 1.00 0.00 H TER 56433 WAT 1688 ATOM 56433 O WAT 1689 110.006 81.313 150.482 1.00 0.00 O ATOM 56434 H1 WAT 1689 109.531 81.354 149.652 1.00 0.00 H ATOM 56435 H2 WAT 1689 109.393 81.666 151.126 1.00 0.00 H TER 56437 WAT 1689 ATOM 56437 O WAT 1690 69.783 143.791 72.226 1.00 0.00 O ATOM 56438 H1 WAT 1690 70.280 143.387 71.515 1.00 0.00 H ATOM 56439 H2 WAT 1690 69.795 143.139 72.927 1.00 0.00 H TER 56441 WAT 1690 ATOM 56441 O WAT 1691 22.782 10.313 83.846 1.00 0.00 O ATOM 56442 H1 WAT 1691 23.305 10.557 84.610 1.00 0.00 H ATOM 56443 H2 WAT 1691 22.656 9.368 83.935 1.00 0.00 H TER 56445 WAT 1691 ATOM 56445 O WAT 1692 19.782 35.595 97.140 1.00 0.00 O ATOM 56446 H1 WAT 1692 20.190 35.232 96.354 1.00 0.00 H ATOM 56447 H2 WAT 1692 20.480 36.096 97.563 1.00 0.00 H TER 56449 WAT 1692 ATOM 56449 O WAT 1693 75.555 26.033 1.404 1.00 0.00 O ATOM 56450 H1 WAT 1693 74.825 26.601 1.651 1.00 0.00 H ATOM 56451 H2 WAT 1693 75.345 25.747 0.515 1.00 0.00 H TER 56453 WAT 1693 ATOM 56453 O WAT 1694 84.125 123.220 20.804 1.00 0.00 O ATOM 56454 H1 WAT 1694 83.520 123.845 20.404 1.00 0.00 H ATOM 56455 H2 WAT 1694 84.000 122.413 20.306 1.00 0.00 H TER 56457 WAT 1694 ATOM 56457 O WAT 1695 58.348 80.816 109.207 1.00 0.00 O ATOM 56458 H1 WAT 1695 57.627 81.369 108.906 1.00 0.00 H ATOM 56459 H2 WAT 1695 58.284 80.026 108.671 1.00 0.00 H TER 56461 WAT 1695 ATOM 56461 O WAT 1696 93.399 13.201 124.590 1.00 0.00 O ATOM 56462 H1 WAT 1696 94.095 13.490 124.000 1.00 0.00 H ATOM 56463 H2 WAT 1696 92.823 12.670 124.040 1.00 0.00 H TER 56465 WAT 1696 ATOM 56465 O WAT 1697 62.784 143.932 137.651 1.00 0.00 O ATOM 56466 H1 WAT 1697 62.439 144.457 138.372 1.00 0.00 H ATOM 56467 H2 WAT 1697 62.280 143.119 137.684 1.00 0.00 H TER 56469 WAT 1697 ATOM 56469 O WAT 1698 64.491 127.391 137.721 1.00 0.00 O ATOM 56470 H1 WAT 1698 64.022 127.163 138.523 1.00 0.00 H ATOM 56471 H2 WAT 1698 64.352 128.333 137.621 1.00 0.00 H TER 56473 WAT 1698 ATOM 56473 O WAT 1699 41.324 50.842 82.012 1.00 0.00 O ATOM 56474 H1 WAT 1699 40.471 50.461 82.217 1.00 0.00 H ATOM 56475 H2 WAT 1699 41.935 50.107 82.069 1.00 0.00 H TER 56477 WAT 1699 ATOM 56477 O WAT 1700 125.003 69.407 72.556 1.00 0.00 O ATOM 56478 H1 WAT 1700 125.213 69.229 71.639 1.00 0.00 H ATOM 56479 H2 WAT 1700 125.034 68.550 72.980 1.00 0.00 H TER 56481 WAT 1700 ATOM 56481 O WAT 1701 106.361 56.591 74.029 1.00 0.00 O ATOM 56482 H1 WAT 1701 106.363 56.594 73.072 1.00 0.00 H ATOM 56483 H2 WAT 1701 107.203 56.976 74.272 1.00 0.00 H TER 56485 WAT 1701 ATOM 56485 O WAT 1702 32.714 68.675 14.264 1.00 0.00 O ATOM 56486 H1 WAT 1702 32.594 69.130 15.097 1.00 0.00 H ATOM 56487 H2 WAT 1702 33.476 69.097 13.868 1.00 0.00 H TER 56489 WAT 1702 ATOM 56489 O WAT 1703 12.343 107.960 17.217 1.00 0.00 O ATOM 56490 H1 WAT 1703 12.949 108.675 17.023 1.00 0.00 H ATOM 56491 H2 WAT 1703 12.909 107.208 17.393 1.00 0.00 H TER 56493 WAT 1703 ATOM 56493 O WAT 1704 10.336 30.801 99.314 1.00 0.00 O ATOM 56494 H1 WAT 1704 9.494 31.129 99.630 1.00 0.00 H ATOM 56495 H2 WAT 1704 10.935 31.541 99.416 1.00 0.00 H TER 56497 WAT 1704 ATOM 56497 O WAT 1705 115.186 116.164 108.324 1.00 0.00 O ATOM 56498 H1 WAT 1705 115.357 116.671 107.531 1.00 0.00 H ATOM 56499 H2 WAT 1705 114.274 115.886 108.239 1.00 0.00 H TER 56501 WAT 1705 ATOM 56501 O WAT 1706 39.858 114.476 70.341 1.00 0.00 O ATOM 56502 H1 WAT 1706 40.591 114.530 69.728 1.00 0.00 H ATOM 56503 H2 WAT 1706 39.815 113.551 70.582 1.00 0.00 H TER 56505 WAT 1706 ATOM 56505 O WAT 1707 101.309 93.333 124.223 1.00 0.00 O ATOM 56506 H1 WAT 1707 101.318 93.061 125.141 1.00 0.00 H ATOM 56507 H2 WAT 1707 101.831 94.135 124.206 1.00 0.00 H TER 56509 WAT 1707 ATOM 56509 O WAT 1708 72.469 72.283 138.135 1.00 0.00 O ATOM 56510 H1 WAT 1708 73.114 71.834 138.681 1.00 0.00 H ATOM 56511 H2 WAT 1708 71.644 71.833 138.318 1.00 0.00 H TER 56513 WAT 1708 ATOM 56513 O WAT 1709 65.389 32.313 136.193 1.00 0.00 O ATOM 56514 H1 WAT 1709 64.594 32.450 135.677 1.00 0.00 H ATOM 56515 H2 WAT 1709 65.837 31.589 135.755 1.00 0.00 H TER 56517 WAT 1709 ATOM 56517 O WAT 1710 119.291 50.874 13.289 1.00 0.00 O ATOM 56518 H1 WAT 1710 119.105 51.603 13.880 1.00 0.00 H ATOM 56519 H2 WAT 1710 118.500 50.336 13.316 1.00 0.00 H TER 56521 WAT 1710 ATOM 56521 O WAT 1711 53.057 125.770 76.316 1.00 0.00 O ATOM 56522 H1 WAT 1711 53.165 125.101 75.639 1.00 0.00 H ATOM 56523 H2 WAT 1711 53.917 125.832 76.731 1.00 0.00 H TER 56525 WAT 1711 ATOM 56525 O WAT 1712 137.293 60.451 70.593 1.00 0.00 O ATOM 56526 H1 WAT 1712 136.402 60.324 70.919 1.00 0.00 H ATOM 56527 H2 WAT 1712 137.726 59.611 70.746 1.00 0.00 H TER 56529 WAT 1712 ATOM 56529 O WAT 1713 3.798 41.165 86.231 1.00 0.00 O ATOM 56530 H1 WAT 1713 3.176 40.618 85.751 1.00 0.00 H ATOM 56531 H2 WAT 1713 3.941 41.921 85.663 1.00 0.00 H TER 56533 WAT 1713 ATOM 56533 O WAT 1714 12.082 10.457 78.624 1.00 0.00 O ATOM 56534 H1 WAT 1714 12.691 10.192 77.934 1.00 0.00 H ATOM 56535 H2 WAT 1714 11.236 10.528 78.182 1.00 0.00 H TER 56537 WAT 1714 ATOM 56537 O WAT 1715 102.406 32.097 2.117 1.00 0.00 O ATOM 56538 H1 WAT 1715 102.628 32.148 1.187 1.00 0.00 H ATOM 56539 H2 WAT 1715 101.981 31.245 2.216 1.00 0.00 H TER 56541 WAT 1715 ATOM 56541 O WAT 1716 119.865 57.928 124.245 1.00 0.00 O ATOM 56542 H1 WAT 1716 119.040 58.413 124.246 1.00 0.00 H ATOM 56543 H2 WAT 1716 119.763 57.280 124.941 1.00 0.00 H TER 56545 WAT 1716 ATOM 56545 O WAT 1717 52.572 104.032 151.164 1.00 0.00 O ATOM 56546 H1 WAT 1717 52.340 104.912 151.462 1.00 0.00 H ATOM 56547 H2 WAT 1717 53.021 103.637 151.912 1.00 0.00 H TER 56549 WAT 1717 ATOM 56549 O WAT 1718 132.965 10.460 128.765 1.00 0.00 O ATOM 56550 H1 WAT 1718 132.956 9.577 128.395 1.00 0.00 H ATOM 56551 H2 WAT 1718 132.041 10.679 128.884 1.00 0.00 H TER 56553 WAT 1718 ATOM 56553 O WAT 1719 41.406 5.500 138.231 1.00 0.00 O ATOM 56554 H1 WAT 1719 41.033 6.381 138.273 1.00 0.00 H ATOM 56555 H2 WAT 1719 42.127 5.576 137.605 1.00 0.00 H TER 56557 WAT 1719 ATOM 56557 O WAT 1720 54.025 27.017 13.423 1.00 0.00 O ATOM 56558 H1 WAT 1720 54.956 27.240 13.415 1.00 0.00 H ATOM 56559 H2 WAT 1720 53.741 27.143 12.518 1.00 0.00 H TER 56561 WAT 1720 ATOM 56561 O WAT 1721 95.391 30.353 141.877 1.00 0.00 O ATOM 56562 H1 WAT 1721 95.439 30.511 142.820 1.00 0.00 H ATOM 56563 H2 WAT 1721 95.702 29.454 141.770 1.00 0.00 H TER 56565 WAT 1721 ATOM 56565 O WAT 1722 83.693 20.221 159.009 1.00 0.00 O ATOM 56566 H1 WAT 1722 83.707 21.164 158.846 1.00 0.00 H ATOM 56567 H2 WAT 1722 84.065 19.836 158.215 1.00 0.00 H TER 56569 WAT 1722 ATOM 56569 O WAT 1723 35.675 117.491 121.104 1.00 0.00 O ATOM 56570 H1 WAT 1723 35.819 117.810 120.213 1.00 0.00 H ATOM 56571 H2 WAT 1723 35.296 116.619 120.988 1.00 0.00 H TER 56573 WAT 1723 ATOM 56573 O WAT 1724 124.047 102.325 144.085 1.00 0.00 O ATOM 56574 H1 WAT 1724 123.109 102.462 144.215 1.00 0.00 H ATOM 56575 H2 WAT 1724 124.337 101.880 144.881 1.00 0.00 H TER 56577 WAT 1724 ATOM 56577 O WAT 1725 79.607 77.346 122.932 1.00 0.00 O ATOM 56578 H1 WAT 1725 79.725 78.063 123.556 1.00 0.00 H ATOM 56579 H2 WAT 1725 79.547 77.778 122.080 1.00 0.00 H TER 56581 WAT 1725 ATOM 56581 O WAT 1726 118.204 142.541 4.099 1.00 0.00 O ATOM 56582 H1 WAT 1726 118.027 143.017 4.911 1.00 0.00 H ATOM 56583 H2 WAT 1726 117.604 142.926 3.461 1.00 0.00 H TER 56585 WAT 1726 ATOM 56585 O WAT 1727 51.299 56.518 117.045 1.00 0.00 O ATOM 56586 H1 WAT 1727 50.506 56.135 117.421 1.00 0.00 H ATOM 56587 H2 WAT 1727 51.783 56.854 117.799 1.00 0.00 H TER 56589 WAT 1727 ATOM 56589 O WAT 1728 120.759 78.836 94.557 1.00 0.00 O ATOM 56590 H1 WAT 1728 121.283 78.207 95.054 1.00 0.00 H ATOM 56591 H2 WAT 1728 120.664 79.586 95.144 1.00 0.00 H TER 56593 WAT 1728 ATOM 56593 O WAT 1729 26.196 15.905 122.601 1.00 0.00 O ATOM 56594 H1 WAT 1729 27.145 15.981 122.700 1.00 0.00 H ATOM 56595 H2 WAT 1729 26.062 15.028 122.242 1.00 0.00 H TER 56597 WAT 1729 ATOM 56597 O WAT 1730 57.577 125.419 59.943 1.00 0.00 O ATOM 56598 H1 WAT 1730 57.658 124.544 60.324 1.00 0.00 H ATOM 56599 H2 WAT 1730 58.120 125.388 59.155 1.00 0.00 H TER 56601 WAT 1730 ATOM 56601 O WAT 1731 25.380 33.264 150.554 1.00 0.00 O ATOM 56602 H1 WAT 1731 24.983 34.048 150.173 1.00 0.00 H ATOM 56603 H2 WAT 1731 26.218 33.567 150.905 1.00 0.00 H TER 56605 WAT 1731 ATOM 56605 O WAT 1732 2.303 45.879 15.282 1.00 0.00 O ATOM 56606 H1 WAT 1732 2.107 45.220 15.948 1.00 0.00 H ATOM 56607 H2 WAT 1732 1.956 46.695 15.643 1.00 0.00 H TER 56609 WAT 1732 ATOM 56609 O WAT 1733 82.705 35.637 19.862 1.00 0.00 O ATOM 56610 H1 WAT 1733 83.146 35.259 20.624 1.00 0.00 H ATOM 56611 H2 WAT 1733 81.778 35.448 20.005 1.00 0.00 H TER 56613 WAT 1733 ATOM 56613 O WAT 1734 112.112 137.117 9.233 1.00 0.00 O ATOM 56614 H1 WAT 1734 112.023 136.391 9.849 1.00 0.00 H ATOM 56615 H2 WAT 1734 111.718 137.864 9.684 1.00 0.00 H TER 56617 WAT 1734 ATOM 56617 O WAT 1735 90.478 58.799 145.304 1.00 0.00 O ATOM 56618 H1 WAT 1735 90.064 59.652 145.437 1.00 0.00 H ATOM 56619 H2 WAT 1735 90.513 58.695 144.354 1.00 0.00 H TER 56621 WAT 1735 ATOM 56621 O WAT 1736 58.709 83.554 112.843 1.00 0.00 O ATOM 56622 H1 WAT 1736 59.269 83.882 112.140 1.00 0.00 H ATOM 56623 H2 WAT 1736 58.081 82.982 112.402 1.00 0.00 H TER 56625 WAT 1736 ATOM 56625 O WAT 1737 144.317 100.209 95.298 1.00 0.00 O ATOM 56626 H1 WAT 1737 144.483 100.458 94.389 1.00 0.00 H ATOM 56627 H2 WAT 1737 143.914 99.342 95.239 1.00 0.00 H TER 56629 WAT 1737 ATOM 56629 O WAT 1738 25.215 12.871 89.978 1.00 0.00 O ATOM 56630 H1 WAT 1738 26.094 12.826 90.356 1.00 0.00 H ATOM 56631 H2 WAT 1738 25.051 13.806 89.863 1.00 0.00 H TER 56633 WAT 1738 ATOM 56633 O WAT 1739 26.296 47.325 105.768 1.00 0.00 O ATOM 56634 H1 WAT 1739 27.188 47.667 105.823 1.00 0.00 H ATOM 56635 H2 WAT 1739 25.744 48.104 105.692 1.00 0.00 H TER 56637 WAT 1739 ATOM 56637 O WAT 1740 6.111 28.438 134.678 1.00 0.00 O ATOM 56638 H1 WAT 1740 6.773 27.748 134.628 1.00 0.00 H ATOM 56639 H2 WAT 1740 6.452 29.050 135.330 1.00 0.00 H TER 56641 WAT 1740 ATOM 56641 O WAT 1741 124.674 81.163 140.053 1.00 0.00 O ATOM 56642 H1 WAT 1741 125.387 80.791 139.534 1.00 0.00 H ATOM 56643 H2 WAT 1741 123.889 81.004 139.531 1.00 0.00 H TER 56645 WAT 1741 ATOM 56645 O WAT 1742 3.284 14.807 8.526 1.00 0.00 O ATOM 56646 H1 WAT 1742 3.592 14.882 9.429 1.00 0.00 H ATOM 56647 H2 WAT 1742 2.353 15.024 8.571 1.00 0.00 H TER 56649 WAT 1742 ATOM 56649 O WAT 1743 108.303 134.132 92.834 1.00 0.00 O ATOM 56650 H1 WAT 1743 107.436 133.829 92.566 1.00 0.00 H ATOM 56651 H2 WAT 1743 108.477 133.669 93.653 1.00 0.00 H TER 56653 WAT 1743 ATOM 56653 O WAT 1744 135.823 61.090 64.381 1.00 0.00 O ATOM 56654 H1 WAT 1744 135.535 61.289 65.272 1.00 0.00 H ATOM 56655 H2 WAT 1744 136.371 61.836 64.135 1.00 0.00 H TER 56657 WAT 1744 ATOM 56657 O WAT 1745 68.987 15.930 153.726 1.00 0.00 O ATOM 56658 H1 WAT 1745 69.592 16.391 153.146 1.00 0.00 H ATOM 56659 H2 WAT 1745 68.857 16.529 154.461 1.00 0.00 H TER 56661 WAT 1745 ATOM 56661 O WAT 1746 61.744 105.189 129.191 1.00 0.00 O ATOM 56662 H1 WAT 1746 60.965 104.726 129.499 1.00 0.00 H ATOM 56663 H2 WAT 1746 62.464 104.577 129.347 1.00 0.00 H TER 56665 WAT 1746 ATOM 56665 O WAT 1747 32.804 130.592 97.584 1.00 0.00 O ATOM 56666 H1 WAT 1747 33.386 130.403 96.848 1.00 0.00 H ATOM 56667 H2 WAT 1747 33.277 131.243 98.103 1.00 0.00 H TER 56669 WAT 1747 ATOM 56669 O WAT 1748 119.293 63.990 118.647 1.00 0.00 O ATOM 56670 H1 WAT 1748 118.490 63.962 118.126 1.00 0.00 H ATOM 56671 H2 WAT 1748 119.028 63.680 119.513 1.00 0.00 H TER 56673 WAT 1748 ATOM 56673 O WAT 1749 113.630 12.869 100.714 1.00 0.00 O ATOM 56674 H1 WAT 1749 113.754 12.277 101.456 1.00 0.00 H ATOM 56675 H2 WAT 1749 113.799 12.327 99.944 1.00 0.00 H TER 56677 WAT 1749 ATOM 56677 O WAT 1750 57.146 15.885 139.856 1.00 0.00 O ATOM 56678 H1 WAT 1750 57.698 15.935 139.075 1.00 0.00 H ATOM 56679 H2 WAT 1750 56.979 14.950 139.972 1.00 0.00 H TER 56681 WAT 1750 ATOM 56681 O WAT 1751 56.731 55.723 90.556 1.00 0.00 O ATOM 56682 H1 WAT 1751 56.340 56.457 90.082 1.00 0.00 H ATOM 56683 H2 WAT 1751 57.052 56.109 91.371 1.00 0.00 H TER 56685 WAT 1751 ATOM 56685 O WAT 1752 68.314 19.286 19.687 1.00 0.00 O ATOM 56686 H1 WAT 1752 68.087 19.050 20.586 1.00 0.00 H ATOM 56687 H2 WAT 1752 69.240 19.057 19.605 1.00 0.00 H TER 56689 WAT 1752 ATOM 56689 O WAT 1753 39.264 0.989 83.416 1.00 0.00 O ATOM 56690 H1 WAT 1753 38.920 0.263 82.896 1.00 0.00 H ATOM 56691 H2 WAT 1753 39.376 0.624 84.293 1.00 0.00 H TER 56693 WAT 1753 ATOM 56693 O WAT 1754 107.189 56.992 83.458 1.00 0.00 O ATOM 56694 H1 WAT 1754 106.989 57.877 83.153 1.00 0.00 H ATOM 56695 H2 WAT 1754 108.133 57.000 83.616 1.00 0.00 H TER 56697 WAT 1754 ATOM 56697 O WAT 1755 37.843 15.257 12.900 1.00 0.00 O ATOM 56698 H1 WAT 1755 37.045 14.971 13.345 1.00 0.00 H ATOM 56699 H2 WAT 1755 38.003 14.584 12.239 1.00 0.00 H TER 56701 WAT 1755 ATOM 56701 O WAT 1756 57.209 104.420 5.493 1.00 0.00 O ATOM 56702 H1 WAT 1756 57.484 105.328 5.622 1.00 0.00 H ATOM 56703 H2 WAT 1756 56.257 104.467 5.406 1.00 0.00 H TER 56705 WAT 1756 ATOM 56705 O WAT 1757 24.911 100.702 146.812 1.00 0.00 O ATOM 56706 H1 WAT 1757 25.089 99.925 147.342 1.00 0.00 H ATOM 56707 H2 WAT 1757 25.611 101.313 147.042 1.00 0.00 H TER 56709 WAT 1757 ATOM 56709 O WAT 1758 80.864 51.323 57.201 1.00 0.00 O ATOM 56710 H1 WAT 1758 80.738 51.765 58.041 1.00 0.00 H ATOM 56711 H2 WAT 1758 79.986 51.274 56.823 1.00 0.00 H TER 56713 WAT 1758 ATOM 56713 O WAT 1759 111.066 79.763 1.830 1.00 0.00 O ATOM 56714 H1 WAT 1759 111.153 79.978 0.901 1.00 0.00 H ATOM 56715 H2 WAT 1759 110.130 79.853 2.010 1.00 0.00 H TER 56717 WAT 1759 ATOM 56717 O WAT 1760 142.342 89.558 113.513 1.00 0.00 O ATOM 56718 H1 WAT 1760 142.256 88.798 112.938 1.00 0.00 H ATOM 56719 H2 WAT 1760 141.789 90.227 113.110 1.00 0.00 H TER 56721 WAT 1760 ATOM 56721 O WAT 1761 49.226 98.992 80.486 1.00 0.00 O ATOM 56722 H1 WAT 1761 48.457 99.503 80.738 1.00 0.00 H ATOM 56723 H2 WAT 1761 49.407 98.441 81.248 1.00 0.00 H TER 56725 WAT 1761 ATOM 56725 O WAT 1762 116.956 119.612 97.536 1.00 0.00 O ATOM 56726 H1 WAT 1762 117.612 119.373 96.881 1.00 0.00 H ATOM 56727 H2 WAT 1762 116.158 119.766 97.030 1.00 0.00 H TER 56729 WAT 1762 ATOM 56729 O WAT 1763 103.316 110.766 134.623 1.00 0.00 O ATOM 56730 H1 WAT 1763 103.409 111.241 135.450 1.00 0.00 H ATOM 56731 H2 WAT 1763 103.196 111.452 133.966 1.00 0.00 H TER 56733 WAT 1763 ATOM 56733 O WAT 1764 12.680 140.544 2.556 1.00 0.00 O ATOM 56734 H1 WAT 1764 13.370 141.151 2.822 1.00 0.00 H ATOM 56735 H2 WAT 1764 13.085 139.679 2.618 1.00 0.00 H TER 56737 WAT 1764 ATOM 56737 O WAT 1765 40.218 5.211 94.574 1.00 0.00 O ATOM 56738 H1 WAT 1765 41.047 4.767 94.393 1.00 0.00 H ATOM 56739 H2 WAT 1765 40.147 5.874 93.888 1.00 0.00 H TER 56741 WAT 1765 ATOM 56741 O WAT 1766 139.516 95.589 123.541 1.00 0.00 O ATOM 56742 H1 WAT 1766 138.754 96.166 123.604 1.00 0.00 H ATOM 56743 H2 WAT 1766 139.341 94.892 124.173 1.00 0.00 H TER 56745 WAT 1766 ATOM 56745 O WAT 1767 78.281 1.449 100.237 1.00 0.00 O ATOM 56746 H1 WAT 1767 77.966 1.458 101.141 1.00 0.00 H ATOM 56747 H2 WAT 1767 77.558 1.816 99.729 1.00 0.00 H TER 56749 WAT 1767 ATOM 56749 O WAT 1768 114.458 135.549 156.773 1.00 0.00 O ATOM 56750 H1 WAT 1768 115.060 135.439 157.510 1.00 0.00 H ATOM 56751 H2 WAT 1768 115.010 135.451 155.997 1.00 0.00 H TER 56753 WAT 1768 ATOM 56753 O WAT 1769 56.174 68.268 96.240 1.00 0.00 O ATOM 56754 H1 WAT 1769 56.935 68.333 96.818 1.00 0.00 H ATOM 56755 H2 WAT 1769 55.516 67.807 96.760 1.00 0.00 H TER 56757 WAT 1769 ATOM 56757 O WAT 1770 100.889 53.586 150.659 1.00 0.00 O ATOM 56758 H1 WAT 1770 101.348 53.938 149.896 1.00 0.00 H ATOM 56759 H2 WAT 1770 101.433 53.841 151.405 1.00 0.00 H TER 56761 WAT 1770 ATOM 56761 O WAT 1771 12.634 55.845 66.967 1.00 0.00 O ATOM 56762 H1 WAT 1771 12.822 54.925 67.151 1.00 0.00 H ATOM 56763 H2 WAT 1771 12.154 56.151 67.737 1.00 0.00 H TER 56765 WAT 1771 ATOM 56765 O WAT 1772 6.593 48.323 118.864 1.00 0.00 O ATOM 56766 H1 WAT 1772 6.315 48.847 118.113 1.00 0.00 H ATOM 56767 H2 WAT 1772 6.588 48.937 119.599 1.00 0.00 H TER 56769 WAT 1772 ATOM 56769 O WAT 1773 132.935 111.880 18.358 1.00 0.00 O ATOM 56770 H1 WAT 1773 132.747 111.266 19.068 1.00 0.00 H ATOM 56771 H2 WAT 1773 133.759 112.295 18.612 1.00 0.00 H TER 56773 WAT 1773 ATOM 56773 O WAT 1774 73.898 119.040 3.298 1.00 0.00 O ATOM 56774 H1 WAT 1774 73.642 118.476 4.028 1.00 0.00 H ATOM 56775 H2 WAT 1774 73.109 119.541 3.094 1.00 0.00 H TER 56777 WAT 1774 ATOM 56777 O WAT 1775 139.379 80.982 138.598 1.00 0.00 O ATOM 56778 H1 WAT 1775 140.075 80.823 137.961 1.00 0.00 H ATOM 56779 H2 WAT 1775 139.775 80.766 139.443 1.00 0.00 H TER 56781 WAT 1775 ATOM 56781 O WAT 1776 43.340 67.365 92.807 1.00 0.00 O ATOM 56782 H1 WAT 1776 43.269 67.588 91.879 1.00 0.00 H ATOM 56783 H2 WAT 1776 43.359 68.210 93.256 1.00 0.00 H TER 56785 WAT 1776 ATOM 56785 O WAT 1777 11.669 118.949 14.592 1.00 0.00 O ATOM 56786 H1 WAT 1777 11.941 118.459 13.815 1.00 0.00 H ATOM 56787 H2 WAT 1777 12.346 118.762 15.242 1.00 0.00 H TER 56789 WAT 1777 ATOM 56789 O WAT 1778 100.673 131.669 128.823 1.00 0.00 O ATOM 56790 H1 WAT 1778 100.381 131.690 129.735 1.00 0.00 H ATOM 56791 H2 WAT 1778 101.347 132.347 128.773 1.00 0.00 H TER 56793 WAT 1778 ATOM 56793 O WAT 1779 25.561 125.992 71.867 1.00 0.00 O ATOM 56794 H1 WAT 1779 25.849 125.113 71.621 1.00 0.00 H ATOM 56795 H2 WAT 1779 24.948 126.246 71.177 1.00 0.00 H TER 56797 WAT 1779 ATOM 56797 O WAT 1780 63.814 68.243 125.823 1.00 0.00 O ATOM 56798 H1 WAT 1780 63.109 68.419 125.199 1.00 0.00 H ATOM 56799 H2 WAT 1780 64.308 69.062 125.864 1.00 0.00 H TER 56801 WAT 1780 ATOM 56801 O WAT 1781 39.863 75.492 91.663 1.00 0.00 O ATOM 56802 H1 WAT 1781 39.500 76.286 91.270 1.00 0.00 H ATOM 56803 H2 WAT 1781 40.587 75.249 91.087 1.00 0.00 H TER 56805 WAT 1781 ATOM 56805 O WAT 1782 5.727 144.952 74.400 1.00 0.00 O ATOM 56806 H1 WAT 1782 6.494 144.444 74.134 1.00 0.00 H ATOM 56807 H2 WAT 1782 6.054 145.541 75.080 1.00 0.00 H TER 56809 WAT 1782 ATOM 56809 O WAT 1783 82.007 47.745 154.974 1.00 0.00 O ATOM 56810 H1 WAT 1783 81.227 47.262 155.247 1.00 0.00 H ATOM 56811 H2 WAT 1783 81.786 48.090 154.109 1.00 0.00 H TER 56813 WAT 1783 ATOM 56813 O WAT 1784 65.997 6.836 156.869 1.00 0.00 O ATOM 56814 H1 WAT 1784 66.480 7.530 157.318 1.00 0.00 H ATOM 56815 H2 WAT 1784 66.655 6.396 156.331 1.00 0.00 H TER 56817 WAT 1784 ATOM 56817 O WAT 1785 57.429 117.599 126.619 1.00 0.00 O ATOM 56818 H1 WAT 1785 58.347 117.868 126.583 1.00 0.00 H ATOM 56819 H2 WAT 1785 57.204 117.395 125.711 1.00 0.00 H TER 56821 WAT 1785 ATOM 56821 O WAT 1786 77.508 105.507 70.529 1.00 0.00 O ATOM 56822 H1 WAT 1786 78.271 105.130 70.967 1.00 0.00 H ATOM 56823 H2 WAT 1786 77.334 104.914 69.798 1.00 0.00 H TER 56825 WAT 1786 ATOM 56825 O WAT 1787 43.575 125.538 143.990 1.00 0.00 O ATOM 56826 H1 WAT 1787 43.790 126.461 144.124 1.00 0.00 H ATOM 56827 H2 WAT 1787 43.872 125.105 144.791 1.00 0.00 H TER 56829 WAT 1787 ATOM 56829 O WAT 1788 5.389 54.760 149.473 1.00 0.00 O ATOM 56830 H1 WAT 1788 5.843 55.287 148.816 1.00 0.00 H ATOM 56831 H2 WAT 1788 6.073 54.208 149.852 1.00 0.00 H TER 56833 WAT 1788 ATOM 56833 O WAT 1789 11.647 9.755 83.046 1.00 0.00 O ATOM 56834 H1 WAT 1789 10.969 9.959 83.690 1.00 0.00 H ATOM 56835 H2 WAT 1789 12.370 10.344 83.265 1.00 0.00 H TER 56837 WAT 1789 ATOM 56837 O WAT 1790 70.606 55.996 113.171 1.00 0.00 O ATOM 56838 H1 WAT 1790 71.243 56.671 113.404 1.00 0.00 H ATOM 56839 H2 WAT 1790 70.999 55.179 113.476 1.00 0.00 H TER 56841 WAT 1790 ATOM 56841 O WAT 1791 13.385 62.280 120.783 1.00 0.00 O ATOM 56842 H1 WAT 1791 12.730 62.402 121.471 1.00 0.00 H ATOM 56843 H2 WAT 1791 12.879 62.262 119.971 1.00 0.00 H TER 56845 WAT 1791 ATOM 56845 O WAT 1792 127.879 43.375 130.523 1.00 0.00 O ATOM 56846 H1 WAT 1792 127.242 43.073 129.876 1.00 0.00 H ATOM 56847 H2 WAT 1792 127.433 43.276 131.364 1.00 0.00 H TER 56849 WAT 1792 ATOM 56849 O WAT 1793 53.133 100.661 100.403 1.00 0.00 O ATOM 56850 H1 WAT 1793 52.834 101.455 100.846 1.00 0.00 H ATOM 56851 H2 WAT 1793 52.347 100.308 99.986 1.00 0.00 H TER 56853 WAT 1793 ATOM 56853 O WAT 1794 103.563 97.012 6.605 1.00 0.00 O ATOM 56854 H1 WAT 1794 102.609 97.042 6.529 1.00 0.00 H ATOM 56855 H2 WAT 1794 103.862 97.829 6.207 1.00 0.00 H TER 56857 WAT 1794 ATOM 56857 O WAT 1795 13.612 101.619 126.023 1.00 0.00 O ATOM 56858 H1 WAT 1795 13.406 100.818 125.542 1.00 0.00 H ATOM 56859 H2 WAT 1795 14.508 101.487 126.334 1.00 0.00 H TER 56861 WAT 1795 ATOM 56861 O WAT 1796 75.817 113.308 125.033 1.00 0.00 O ATOM 56862 H1 WAT 1796 75.364 114.150 124.973 1.00 0.00 H ATOM 56863 H2 WAT 1796 75.363 112.746 124.405 1.00 0.00 H TER 56865 WAT 1796 ATOM 56865 O WAT 1797 130.917 14.971 128.525 1.00 0.00 O ATOM 56866 H1 WAT 1797 131.332 14.241 128.065 1.00 0.00 H ATOM 56867 H2 WAT 1797 130.071 15.077 128.092 1.00 0.00 H TER 56869 WAT 1797 ATOM 56869 O WAT 1798 143.804 131.773 73.819 1.00 0.00 O ATOM 56870 H1 WAT 1798 142.956 131.331 73.776 1.00 0.00 H ATOM 56871 H2 WAT 1798 143.596 132.663 74.104 1.00 0.00 H TER 56873 WAT 1798 ATOM 56873 O WAT 1799 12.587 19.927 154.540 1.00 0.00 O ATOM 56874 H1 WAT 1799 13.445 20.329 154.402 1.00 0.00 H ATOM 56875 H2 WAT 1799 12.583 19.684 155.466 1.00 0.00 H TER 56877 WAT 1799 ATOM 56877 O WAT 1800 122.373 51.388 155.018 1.00 0.00 O ATOM 56878 H1 WAT 1800 122.160 50.462 154.900 1.00 0.00 H ATOM 56879 H2 WAT 1800 123.241 51.384 155.422 1.00 0.00 H TER 56881 WAT 1800 ATOM 56881 O WAT 1801 80.598 11.437 12.776 1.00 0.00 O ATOM 56882 H1 WAT 1801 80.696 10.487 12.720 1.00 0.00 H ATOM 56883 H2 WAT 1801 81.496 11.769 12.801 1.00 0.00 H TER 56885 WAT 1801 ATOM 56885 O WAT 1802 137.627 141.228 158.293 1.00 0.00 O ATOM 56886 H1 WAT 1802 137.049 141.339 159.048 1.00 0.00 H ATOM 56887 H2 WAT 1802 137.642 142.089 157.874 1.00 0.00 H TER 56889 WAT 1802 ATOM 56889 O WAT 1803 81.981 38.496 82.959 1.00 0.00 O ATOM 56890 H1 WAT 1803 82.906 38.380 83.178 1.00 0.00 H ATOM 56891 H2 WAT 1803 81.704 37.642 82.629 1.00 0.00 H TER 56893 WAT 1803 ATOM 56893 O WAT 1804 102.484 111.455 138.694 1.00 0.00 O ATOM 56894 H1 WAT 1804 102.322 112.051 139.426 1.00 0.00 H ATOM 56895 H2 WAT 1804 102.986 111.976 138.067 1.00 0.00 H TER 56897 WAT 1804 ATOM 56897 O WAT 1805 58.350 23.010 156.921 1.00 0.00 O ATOM 56898 H1 WAT 1805 59.197 23.144 156.496 1.00 0.00 H ATOM 56899 H2 WAT 1805 57.995 22.224 156.506 1.00 0.00 H TER 56901 WAT 1805 ATOM 56901 O WAT 1806 14.017 110.193 118.873 1.00 0.00 O ATOM 56902 H1 WAT 1806 14.501 110.373 119.679 1.00 0.00 H ATOM 56903 H2 WAT 1806 13.493 109.418 119.076 1.00 0.00 H TER 56905 WAT 1806 ATOM 56905 O WAT 1807 131.834 89.297 130.238 1.00 0.00 O ATOM 56906 H1 WAT 1807 132.173 88.485 129.862 1.00 0.00 H ATOM 56907 H2 WAT 1807 132.121 89.980 129.631 1.00 0.00 H TER 56909 WAT 1807 ATOM 56909 O WAT 1808 115.115 80.017 100.837 1.00 0.00 O ATOM 56910 H1 WAT 1808 114.315 79.503 100.947 1.00 0.00 H ATOM 56911 H2 WAT 1808 115.583 79.581 100.125 1.00 0.00 H TER 56913 WAT 1808 ATOM 56913 O WAT 1809 42.755 115.660 53.436 1.00 0.00 O ATOM 56914 H1 WAT 1809 42.156 115.228 52.827 1.00 0.00 H ATOM 56915 H2 WAT 1809 42.195 115.948 54.158 1.00 0.00 H TER 56917 WAT 1809 ATOM 56917 O WAT 1810 87.734 44.574 80.051 1.00 0.00 O ATOM 56918 H1 WAT 1810 87.047 44.757 80.692 1.00 0.00 H ATOM 56919 H2 WAT 1810 88.148 43.770 80.366 1.00 0.00 H TER 56921 WAT 1810 ATOM 56921 O WAT 1811 142.878 34.908 95.523 1.00 0.00 O ATOM 56922 H1 WAT 1811 143.767 35.150 95.262 1.00 0.00 H ATOM 56923 H2 WAT 1811 143.000 34.210 96.167 1.00 0.00 H TER 56925 WAT 1811 ATOM 56925 O WAT 1812 128.087 106.549 127.250 1.00 0.00 O ATOM 56926 H1 WAT 1812 127.226 106.231 127.521 1.00 0.00 H ATOM 56927 H2 WAT 1812 128.699 106.130 127.856 1.00 0.00 H TER 56929 WAT 1812 ATOM 56929 O WAT 1813 134.659 110.774 138.484 1.00 0.00 O ATOM 56930 H1 WAT 1813 134.345 110.309 139.260 1.00 0.00 H ATOM 56931 H2 WAT 1813 134.149 110.407 137.762 1.00 0.00 H TER 56933 WAT 1813 ATOM 56933 O WAT 1814 61.323 107.107 108.053 1.00 0.00 O ATOM 56934 H1 WAT 1814 61.049 106.527 108.764 1.00 0.00 H ATOM 56935 H2 WAT 1814 60.646 107.002 107.384 1.00 0.00 H TER 56937 WAT 1814 ATOM 56937 O WAT 1815 91.970 85.946 22.151 1.00 0.00 O ATOM 56938 H1 WAT 1815 91.194 86.218 21.661 1.00 0.00 H ATOM 56939 H2 WAT 1815 92.190 85.086 21.794 1.00 0.00 H TER 56941 WAT 1815 ATOM 56941 O WAT 1816 124.881 22.460 3.236 1.00 0.00 O ATOM 56942 H1 WAT 1816 124.860 22.982 4.038 1.00 0.00 H ATOM 56943 H2 WAT 1816 125.394 22.985 2.622 1.00 0.00 H TER 56945 WAT 1816 ATOM 56945 O WAT 1817 85.393 70.663 99.295 1.00 0.00 O ATOM 56946 H1 WAT 1817 84.529 70.360 99.574 1.00 0.00 H ATOM 56947 H2 WAT 1817 85.802 70.991 100.096 1.00 0.00 H TER 56949 WAT 1817 ATOM 56949 O WAT 1818 7.152 130.715 62.786 1.00 0.00 O ATOM 56950 H1 WAT 1818 8.064 130.443 62.680 1.00 0.00 H ATOM 56951 H2 WAT 1818 6.718 130.413 61.988 1.00 0.00 H TER 56953 WAT 1818 ATOM 56953 O WAT 1819 86.271 0.319 101.424 1.00 0.00 O ATOM 56954 H1 WAT 1819 87.170 0.040 101.594 1.00 0.00 H ATOM 56955 H2 WAT 1819 86.350 1.239 101.171 1.00 0.00 H TER 56957 WAT 1819 ATOM 56957 O WAT 1820 46.284 133.277 105.961 1.00 0.00 O ATOM 56958 H1 WAT 1820 47.136 132.895 106.171 1.00 0.00 H ATOM 56959 H2 WAT 1820 46.274 133.331 105.005 1.00 0.00 H TER 56961 WAT 1820 ATOM 56961 O WAT 1821 127.965 115.779 100.749 1.00 0.00 O ATOM 56962 H1 WAT 1821 128.771 115.842 100.238 1.00 0.00 H ATOM 56963 H2 WAT 1821 128.055 116.454 101.423 1.00 0.00 H TER 56965 WAT 1821 ATOM 56965 O WAT 1822 79.522 131.205 111.776 1.00 0.00 O ATOM 56966 H1 WAT 1822 79.183 130.696 111.039 1.00 0.00 H ATOM 56967 H2 WAT 1822 80.462 131.271 111.608 1.00 0.00 H TER 56969 WAT 1822 ATOM 56969 O WAT 1823 119.712 38.278 158.245 1.00 0.00 O ATOM 56970 H1 WAT 1823 119.109 37.715 157.760 1.00 0.00 H ATOM 56971 H2 WAT 1823 119.144 38.853 158.757 1.00 0.00 H TER 56973 WAT 1823 ATOM 56973 O WAT 1824 40.540 37.810 125.488 1.00 0.00 O ATOM 56974 H1 WAT 1824 39.970 37.218 125.979 1.00 0.00 H ATOM 56975 H2 WAT 1824 41.422 37.464 125.629 1.00 0.00 H TER 56977 WAT 1824 ATOM 56977 O WAT 1825 104.876 63.158 157.092 1.00 0.00 O ATOM 56978 H1 WAT 1825 104.501 62.556 157.734 1.00 0.00 H ATOM 56979 H2 WAT 1825 104.591 64.025 157.381 1.00 0.00 H TER 56981 WAT 1825 ATOM 56981 O WAT 1826 60.664 79.028 120.810 1.00 0.00 O ATOM 56982 H1 WAT 1826 60.627 79.375 121.701 1.00 0.00 H ATOM 56983 H2 WAT 1826 60.344 78.129 120.890 1.00 0.00 H TER 56985 WAT 1826 ATOM 56985 O WAT 1827 68.022 127.501 72.999 1.00 0.00 O ATOM 56986 H1 WAT 1827 68.677 127.951 72.465 1.00 0.00 H ATOM 56987 H2 WAT 1827 68.417 126.652 73.197 1.00 0.00 H TER 56989 WAT 1827 ATOM 56989 O WAT 1828 41.215 69.244 137.362 1.00 0.00 O ATOM 56990 H1 WAT 1828 41.316 68.779 136.532 1.00 0.00 H ATOM 56991 H2 WAT 1828 40.703 70.022 137.140 1.00 0.00 H TER 56993 WAT 1828 ATOM 56993 O WAT 1829 84.333 131.468 99.875 1.00 0.00 O ATOM 56994 H1 WAT 1829 83.551 130.933 100.015 1.00 0.00 H ATOM 56995 H2 WAT 1829 84.983 131.104 100.476 1.00 0.00 H TER 56997 WAT 1829 ATOM 56997 O WAT 1830 1.522 86.800 70.285 1.00 0.00 O ATOM 56998 H1 WAT 1830 2.144 86.976 70.991 1.00 0.00 H ATOM 56999 H2 WAT 1830 0.741 86.470 70.729 1.00 0.00 H TER 57001 WAT 1830 ATOM 57001 O WAT 1831 122.081 114.592 63.350 1.00 0.00 O ATOM 57002 H1 WAT 1831 122.754 115.092 63.812 1.00 0.00 H ATOM 57003 H2 WAT 1831 121.359 114.528 63.975 1.00 0.00 H TER 57005 WAT 1831 ATOM 57005 O WAT 1832 106.549 15.106 144.994 1.00 0.00 O ATOM 57006 H1 WAT 1832 106.341 14.223 145.301 1.00 0.00 H ATOM 57007 H2 WAT 1832 106.894 15.553 145.767 1.00 0.00 H TER 57009 WAT 1832 ATOM 57009 O WAT 1833 46.567 39.506 65.489 1.00 0.00 O ATOM 57010 H1 WAT 1833 46.811 40.340 65.087 1.00 0.00 H ATOM 57011 H2 WAT 1833 47.355 38.967 65.418 1.00 0.00 H TER 57013 WAT 1833 ATOM 57013 O WAT 1834 26.679 134.333 59.168 1.00 0.00 O ATOM 57014 H1 WAT 1834 27.432 133.766 58.998 1.00 0.00 H ATOM 57015 H2 WAT 1834 26.403 134.105 60.055 1.00 0.00 H TER 57017 WAT 1834 ATOM 57017 O WAT 1835 102.351 58.021 18.058 1.00 0.00 O ATOM 57018 H1 WAT 1835 102.608 57.300 17.482 1.00 0.00 H ATOM 57019 H2 WAT 1835 101.706 58.514 17.551 1.00 0.00 H TER 57021 WAT 1835 ATOM 57021 O WAT 1836 33.429 132.519 2.841 1.00 0.00 O ATOM 57022 H1 WAT 1836 33.773 133.389 2.639 1.00 0.00 H ATOM 57023 H2 WAT 1836 33.883 132.262 3.644 1.00 0.00 H TER 57025 WAT 1836 ATOM 57025 O WAT 1837 33.288 59.711 0.597 1.00 0.00 O ATOM 57026 H1 WAT 1837 33.903 60.212 0.061 1.00 0.00 H ATOM 57027 H2 WAT 1837 33.749 58.895 0.791 1.00 0.00 H TER 57029 WAT 1837 ATOM 57029 O WAT 1838 31.765 55.851 20.229 1.00 0.00 O ATOM 57030 H1 WAT 1838 31.828 55.139 20.866 1.00 0.00 H ATOM 57031 H2 WAT 1838 31.475 56.606 20.741 1.00 0.00 H TER 57033 WAT 1838 ATOM 57033 O WAT 1839 142.046 19.024 118.758 1.00 0.00 O ATOM 57034 H1 WAT 1839 142.613 19.009 119.529 1.00 0.00 H ATOM 57035 H2 WAT 1839 141.633 19.887 118.780 1.00 0.00 H TER 57037 WAT 1839 ATOM 57037 O WAT 1840 119.760 30.095 130.566 1.00 0.00 O ATOM 57038 H1 WAT 1840 119.890 30.298 131.493 1.00 0.00 H ATOM 57039 H2 WAT 1840 118.943 29.598 130.542 1.00 0.00 H TER 57041 WAT 1840 ATOM 57041 O WAT 1841 19.839 6.083 22.121 1.00 0.00 O ATOM 57042 H1 WAT 1841 19.979 6.503 21.273 1.00 0.00 H ATOM 57043 H2 WAT 1841 20.057 6.758 22.763 1.00 0.00 H TER 57045 WAT 1841 ATOM 57045 O WAT 1842 95.455 111.659 107.808 1.00 0.00 O ATOM 57046 H1 WAT 1842 95.433 110.753 107.499 1.00 0.00 H ATOM 57047 H2 WAT 1842 95.966 111.623 108.617 1.00 0.00 H TER 57049 WAT 1842 ATOM 57049 O WAT 1843 33.102 124.077 57.522 1.00 0.00 O ATOM 57050 H1 WAT 1843 33.037 124.824 58.117 1.00 0.00 H ATOM 57051 H2 WAT 1843 32.512 124.294 56.800 1.00 0.00 H TER 57053 WAT 1843 ATOM 57053 O WAT 1844 51.971 53.258 137.626 1.00 0.00 O ATOM 57054 H1 WAT 1844 52.800 52.959 138.000 1.00 0.00 H ATOM 57055 H2 WAT 1844 51.447 52.462 137.537 1.00 0.00 H TER 57057 WAT 1844 ATOM 57057 O WAT 1845 134.423 107.963 125.436 1.00 0.00 O ATOM 57058 H1 WAT 1845 133.917 107.181 125.659 1.00 0.00 H ATOM 57059 H2 WAT 1845 135.053 108.052 126.151 1.00 0.00 H TER 57061 WAT 1845 ATOM 57061 O WAT 1846 118.774 21.832 6.563 1.00 0.00 O ATOM 57062 H1 WAT 1846 118.980 22.015 7.480 1.00 0.00 H ATOM 57063 H2 WAT 1846 119.494 22.227 6.072 1.00 0.00 H TER 57065 WAT 1846 ATOM 57065 O WAT 1847 37.598 29.671 108.623 1.00 0.00 O ATOM 57066 H1 WAT 1847 36.729 29.278 108.705 1.00 0.00 H ATOM 57067 H2 WAT 1847 37.713 30.168 109.432 1.00 0.00 H TER 57069 WAT 1847 ATOM 57069 O WAT 1848 117.632 115.909 126.332 1.00 0.00 O ATOM 57070 H1 WAT 1848 117.805 115.639 125.430 1.00 0.00 H ATOM 57071 H2 WAT 1848 118.358 116.494 126.550 1.00 0.00 H TER 57073 WAT 1848 ATOM 57073 O WAT 1849 11.506 128.099 85.197 1.00 0.00 O ATOM 57074 H1 WAT 1849 12.005 127.335 85.486 1.00 0.00 H ATOM 57075 H2 WAT 1849 12.151 128.804 85.150 1.00 0.00 H TER 57077 WAT 1849 ATOM 57077 O WAT 1850 19.867 120.742 27.221 1.00 0.00 O ATOM 57078 H1 WAT 1850 20.598 121.343 27.369 1.00 0.00 H ATOM 57079 H2 WAT 1850 19.455 120.650 28.080 1.00 0.00 H TER 57081 WAT 1850 ATOM 57081 O WAT 1851 75.019 102.474 70.410 1.00 0.00 O ATOM 57082 H1 WAT 1851 75.025 101.847 69.687 1.00 0.00 H ATOM 57083 H2 WAT 1851 75.804 102.264 70.916 1.00 0.00 H TER 57085 WAT 1851 ATOM 57085 O WAT 1852 58.451 112.621 137.741 1.00 0.00 O ATOM 57086 H1 WAT 1852 57.726 112.950 138.272 1.00 0.00 H ATOM 57087 H2 WAT 1852 59.183 112.548 138.353 1.00 0.00 H TER 57089 WAT 1852 ATOM 57089 O WAT 1853 96.411 14.197 99.264 1.00 0.00 O ATOM 57090 H1 WAT 1853 96.292 13.844 98.382 1.00 0.00 H ATOM 57091 H2 WAT 1853 96.696 15.099 99.125 1.00 0.00 H TER 57093 WAT 1853 ATOM 57093 O WAT 1854 112.109 118.182 120.349 1.00 0.00 O ATOM 57094 H1 WAT 1854 112.805 118.179 121.006 1.00 0.00 H ATOM 57095 H2 WAT 1854 112.546 118.443 119.538 1.00 0.00 H TER 57097 WAT 1854 ATOM 57097 O WAT 1855 32.091 94.064 138.868 1.00 0.00 O ATOM 57098 H1 WAT 1855 32.683 94.247 139.597 1.00 0.00 H ATOM 57099 H2 WAT 1855 32.057 93.109 138.821 1.00 0.00 H TER 57101 WAT 1855 ATOM 57101 O WAT 1856 86.922 10.286 8.510 1.00 0.00 O ATOM 57102 H1 WAT 1856 86.693 9.875 9.344 1.00 0.00 H ATOM 57103 H2 WAT 1856 86.277 10.985 8.403 1.00 0.00 H TER 57105 WAT 1856 ATOM 57105 O WAT 1857 56.594 102.243 69.387 1.00 0.00 O ATOM 57106 H1 WAT 1857 56.956 102.379 70.262 1.00 0.00 H ATOM 57107 H2 WAT 1857 57.025 102.903 68.844 1.00 0.00 H TER 57109 WAT 1857 ATOM 57109 O WAT 1858 58.164 63.569 96.601 1.00 0.00 O ATOM 57110 H1 WAT 1858 58.467 64.458 96.414 1.00 0.00 H ATOM 57111 H2 WAT 1858 58.290 63.466 97.544 1.00 0.00 H TER 57113 WAT 1858 ATOM 57113 O WAT 1859 2.065 141.965 153.300 1.00 0.00 O ATOM 57114 H1 WAT 1859 1.653 141.989 154.164 1.00 0.00 H ATOM 57115 H2 WAT 1859 1.580 142.609 152.785 1.00 0.00 H TER 57117 WAT 1859 ATOM 57117 O WAT 1860 144.231 10.951 102.848 1.00 0.00 O ATOM 57118 H1 WAT 1860 145.107 11.197 102.551 1.00 0.00 H ATOM 57119 H2 WAT 1860 143.707 10.917 102.048 1.00 0.00 H TER 57121 WAT 1860 ATOM 57121 O WAT 1861 93.976 130.723 141.893 1.00 0.00 O ATOM 57122 H1 WAT 1861 93.635 131.421 141.334 1.00 0.00 H ATOM 57123 H2 WAT 1861 94.210 131.164 142.710 1.00 0.00 H TER 57125 WAT 1861 ATOM 57125 O WAT 1862 61.557 26.253 17.461 1.00 0.00 O ATOM 57126 H1 WAT 1862 60.860 25.800 16.986 1.00 0.00 H ATOM 57127 H2 WAT 1862 61.591 25.815 18.312 1.00 0.00 H TER 57129 WAT 1862 ATOM 57129 O WAT 1863 140.627 20.769 151.166 1.00 0.00 O ATOM 57130 H1 WAT 1863 141.347 21.396 151.103 1.00 0.00 H ATOM 57131 H2 WAT 1863 139.850 21.272 150.921 1.00 0.00 H TER 57133 WAT 1863 ATOM 57133 O WAT 1864 1.586 87.181 77.961 1.00 0.00 O ATOM 57134 H1 WAT 1864 1.781 86.249 78.058 1.00 0.00 H ATOM 57135 H2 WAT 1864 2.443 87.597 77.869 1.00 0.00 H TER 57137 WAT 1864 ATOM 57137 O WAT 1865 79.419 99.710 19.146 1.00 0.00 O ATOM 57138 H1 WAT 1865 80.074 100.279 19.551 1.00 0.00 H ATOM 57139 H2 WAT 1865 79.683 98.825 19.397 1.00 0.00 H TER 57141 WAT 1865 ATOM 57141 O WAT 1866 28.917 127.083 9.264 1.00 0.00 O ATOM 57142 H1 WAT 1866 28.674 126.509 8.538 1.00 0.00 H ATOM 57143 H2 WAT 1866 29.817 126.836 9.474 1.00 0.00 H TER 57145 WAT 1866 ATOM 57145 O WAT 1867 115.190 141.542 78.332 1.00 0.00 O ATOM 57146 H1 WAT 1867 114.589 142.073 77.808 1.00 0.00 H ATOM 57147 H2 WAT 1867 116.057 141.893 78.131 1.00 0.00 H TER 57149 WAT 1867 ATOM 57149 O WAT 1868 37.110 102.848 122.095 1.00 0.00 O ATOM 57150 H1 WAT 1868 37.705 102.145 122.357 1.00 0.00 H ATOM 57151 H2 WAT 1868 37.664 103.627 122.051 1.00 0.00 H TER 57153 WAT 1868 ATOM 57153 O WAT 1869 31.430 122.312 23.224 1.00 0.00 O ATOM 57154 H1 WAT 1869 31.832 123.169 23.361 1.00 0.00 H ATOM 57155 H2 WAT 1869 31.731 122.042 22.357 1.00 0.00 H TER 57157 WAT 1869 ATOM 57157 O WAT 1870 23.880 13.821 101.401 1.00 0.00 O ATOM 57158 H1 WAT 1870 23.764 14.671 101.825 1.00 0.00 H ATOM 57159 H2 WAT 1870 24.638 13.940 100.829 1.00 0.00 H TER 57161 WAT 1870 ATOM 57161 O WAT 1871 17.922 3.857 145.113 1.00 0.00 O ATOM 57162 H1 WAT 1871 17.623 3.959 146.016 1.00 0.00 H ATOM 57163 H2 WAT 1871 18.877 3.890 145.171 1.00 0.00 H TER 57165 WAT 1871 ATOM 57165 O WAT 1872 39.361 13.315 67.234 1.00 0.00 O ATOM 57166 H1 WAT 1872 39.811 13.063 66.428 1.00 0.00 H ATOM 57167 H2 WAT 1872 39.086 12.485 67.624 1.00 0.00 H TER 57169 WAT 1872 ATOM 57169 O WAT 1873 142.939 36.891 92.450 1.00 0.00 O ATOM 57170 H1 WAT 1873 142.117 36.495 92.739 1.00 0.00 H ATOM 57171 H2 WAT 1873 143.242 37.393 93.207 1.00 0.00 H TER 57173 WAT 1873 ATOM 57173 O WAT 1874 69.010 102.797 77.787 1.00 0.00 O ATOM 57174 H1 WAT 1874 69.465 103.457 77.264 1.00 0.00 H ATOM 57175 H2 WAT 1874 68.459 103.302 78.384 1.00 0.00 H TER 57177 WAT 1874 ATOM 57177 O WAT 1875 20.686 38.171 103.759 1.00 0.00 O ATOM 57178 H1 WAT 1875 20.727 38.940 104.328 1.00 0.00 H ATOM 57179 H2 WAT 1875 19.757 38.081 103.547 1.00 0.00 H TER 57181 WAT 1875 ATOM 57181 O WAT 1876 37.863 49.924 90.104 1.00 0.00 O ATOM 57182 H1 WAT 1876 38.555 49.614 89.519 1.00 0.00 H ATOM 57183 H2 WAT 1876 38.288 49.999 90.958 1.00 0.00 H TER 57185 WAT 1876 ATOM 57185 O WAT 1877 111.994 10.111 16.602 1.00 0.00 O ATOM 57186 H1 WAT 1877 111.765 9.516 17.315 1.00 0.00 H ATOM 57187 H2 WAT 1877 112.793 9.741 16.227 1.00 0.00 H TER 57189 WAT 1877 ATOM 57189 O WAT 1878 35.195 74.794 128.350 1.00 0.00 O ATOM 57190 H1 WAT 1878 35.450 75.607 128.786 1.00 0.00 H ATOM 57191 H2 WAT 1878 35.886 74.641 127.706 1.00 0.00 H TER 57193 WAT 1878 ATOM 57193 O WAT 1879 92.368 25.180 129.374 1.00 0.00 O ATOM 57194 H1 WAT 1879 92.733 24.315 129.188 1.00 0.00 H ATOM 57195 H2 WAT 1879 92.995 25.792 128.988 1.00 0.00 H TER 57197 WAT 1879 ATOM 57197 O WAT 1880 107.350 2.271 137.153 1.00 0.00 O ATOM 57198 H1 WAT 1880 107.827 1.481 137.408 1.00 0.00 H ATOM 57199 H2 WAT 1880 106.866 2.523 137.939 1.00 0.00 H TER 57201 WAT 1880 ATOM 57201 O WAT 1881 108.683 111.387 118.164 1.00 0.00 O ATOM 57202 H1 WAT 1881 108.073 110.775 117.753 1.00 0.00 H ATOM 57203 H2 WAT 1881 109.549 111.032 117.963 1.00 0.00 H TER 57205 WAT 1881 ATOM 57205 O WAT 1882 37.110 84.447 76.445 1.00 0.00 O ATOM 57206 H1 WAT 1882 36.876 84.547 77.367 1.00 0.00 H ATOM 57207 H2 WAT 1882 37.176 85.343 76.115 1.00 0.00 H TER 57209 WAT 1882 ATOM 57209 O WAT 1883 103.062 115.479 88.840 1.00 0.00 O ATOM 57210 H1 WAT 1883 103.542 115.565 89.663 1.00 0.00 H ATOM 57211 H2 WAT 1883 103.738 115.309 88.184 1.00 0.00 H TER 57213 WAT 1883 ATOM 57213 O WAT 1884 134.681 0.232 73.071 1.00 0.00 O ATOM 57214 H1 WAT 1884 133.894 0.777 73.044 1.00 0.00 H ATOM 57215 H2 WAT 1884 135.014 0.248 72.173 1.00 0.00 H TER 57217 WAT 1884 ATOM 57217 O WAT 1885 80.517 96.721 72.986 1.00 0.00 O ATOM 57218 H1 WAT 1885 80.875 97.292 73.666 1.00 0.00 H ATOM 57219 H2 WAT 1885 80.711 95.835 73.291 1.00 0.00 H TER 57221 WAT 1885 ATOM 57221 O WAT 1886 12.494 18.620 118.844 1.00 0.00 O ATOM 57222 H1 WAT 1886 12.166 17.741 119.032 1.00 0.00 H ATOM 57223 H2 WAT 1886 11.707 19.162 118.788 1.00 0.00 H TER 57225 WAT 1886 ATOM 57225 O WAT 1887 73.204 101.729 120.009 1.00 0.00 O ATOM 57226 H1 WAT 1887 72.996 102.496 120.542 1.00 0.00 H ATOM 57227 H2 WAT 1887 72.590 101.772 119.276 1.00 0.00 H TER 57229 WAT 1887 ATOM 57229 O WAT 1888 120.635 142.389 67.814 1.00 0.00 O ATOM 57230 H1 WAT 1888 119.873 142.349 67.235 1.00 0.00 H ATOM 57231 H2 WAT 1888 121.359 142.639 67.239 1.00 0.00 H TER 57233 WAT 1888 ATOM 57233 O WAT 1889 118.539 65.025 98.657 1.00 0.00 O ATOM 57234 H1 WAT 1889 118.524 64.900 97.708 1.00 0.00 H ATOM 57235 H2 WAT 1889 117.804 65.613 98.833 1.00 0.00 H TER 57237 WAT 1889 ATOM 57237 O WAT 1890 42.065 120.058 149.175 1.00 0.00 O ATOM 57238 H1 WAT 1890 41.757 119.461 148.494 1.00 0.00 H ATOM 57239 H2 WAT 1890 42.956 120.284 148.910 1.00 0.00 H TER 57241 WAT 1890 ATOM 57241 O WAT 1891 114.754 25.256 59.267 1.00 0.00 O ATOM 57242 H1 WAT 1891 114.130 24.538 59.158 1.00 0.00 H ATOM 57243 H2 WAT 1891 115.227 25.291 58.436 1.00 0.00 H TER 57245 WAT 1891 ATOM 57245 O WAT 1892 21.230 58.850 142.985 1.00 0.00 O ATOM 57246 H1 WAT 1892 20.857 59.635 143.385 1.00 0.00 H ATOM 57247 H2 WAT 1892 21.751 58.450 143.681 1.00 0.00 H TER 57249 WAT 1892 ATOM 57249 O WAT 1893 136.492 114.250 70.485 1.00 0.00 O ATOM 57250 H1 WAT 1893 136.507 114.393 71.432 1.00 0.00 H ATOM 57251 H2 WAT 1893 135.996 114.991 70.138 1.00 0.00 H TER 57253 WAT 1893 ATOM 57253 O WAT 1894 72.399 133.854 80.990 1.00 0.00 O ATOM 57254 H1 WAT 1894 73.028 134.342 80.457 1.00 0.00 H ATOM 57255 H2 WAT 1894 71.936 133.298 80.363 1.00 0.00 H TER 57257 WAT 1894 ATOM 57257 O WAT 1895 39.160 26.515 2.857 1.00 0.00 O ATOM 57258 H1 WAT 1895 39.295 25.610 3.136 1.00 0.00 H ATOM 57259 H2 WAT 1895 40.044 26.876 2.779 1.00 0.00 H TER 57261 WAT 1895 ATOM 57261 O WAT 1896 65.524 111.183 130.101 1.00 0.00 O ATOM 57262 H1 WAT 1896 64.684 111.546 129.819 1.00 0.00 H ATOM 57263 H2 WAT 1896 65.304 110.618 130.842 1.00 0.00 H TER 57265 WAT 1896 ATOM 57265 O WAT 1897 92.563 82.103 146.550 1.00 0.00 O ATOM 57266 H1 WAT 1897 91.667 81.888 146.808 1.00 0.00 H ATOM 57267 H2 WAT 1897 92.934 82.544 147.314 1.00 0.00 H TER 57269 WAT 1897 ATOM 57269 O WAT 1898 133.951 61.294 79.880 1.00 0.00 O ATOM 57270 H1 WAT 1898 133.687 60.642 80.530 1.00 0.00 H ATOM 57271 H2 WAT 1898 133.655 62.128 80.244 1.00 0.00 H TER 57273 WAT 1898 ATOM 57273 O WAT 1899 1.379 3.736 75.118 1.00 0.00 O ATOM 57274 H1 WAT 1899 1.464 3.774 76.071 1.00 0.00 H ATOM 57275 H2 WAT 1899 2.012 3.071 74.848 1.00 0.00 H TER 57277 WAT 1899 ATOM 57277 O WAT 1900 123.181 54.635 94.624 1.00 0.00 O ATOM 57278 H1 WAT 1900 122.729 54.218 93.890 1.00 0.00 H ATOM 57279 H2 WAT 1900 123.754 53.951 94.971 1.00 0.00 H TER 57281 WAT 1900 ATOM 57281 O WAT 1901 28.402 43.602 146.895 1.00 0.00 O ATOM 57282 H1 WAT 1901 29.148 44.144 147.152 1.00 0.00 H ATOM 57283 H2 WAT 1901 27.635 44.103 147.174 1.00 0.00 H TER 57285 WAT 1901 ATOM 57285 O WAT 1902 67.600 2.898 69.058 1.00 0.00 O ATOM 57286 H1 WAT 1902 68.209 3.468 69.528 1.00 0.00 H ATOM 57287 H2 WAT 1902 67.102 3.491 68.495 1.00 0.00 H TER 57289 WAT 1902 ATOM 57289 O WAT 1903 138.031 47.970 158.318 1.00 0.00 O ATOM 57290 H1 WAT 1903 138.966 48.011 158.114 1.00 0.00 H ATOM 57291 H2 WAT 1903 137.926 47.148 158.797 1.00 0.00 H TER 57293 WAT 1903 ATOM 57293 O WAT 1904 17.365 81.023 23.017 1.00 0.00 O ATOM 57294 H1 WAT 1904 17.420 81.109 23.968 1.00 0.00 H ATOM 57295 H2 WAT 1904 16.989 81.853 22.723 1.00 0.00 H TER 57297 WAT 1904 ATOM 57297 O WAT 1905 126.748 6.093 66.241 1.00 0.00 O ATOM 57298 H1 WAT 1905 126.708 5.280 65.737 1.00 0.00 H ATOM 57299 H2 WAT 1905 126.449 6.768 65.632 1.00 0.00 H TER 57301 WAT 1905 ATOM 57301 O WAT 1906 20.617 20.994 8.756 1.00 0.00 O ATOM 57302 H1 WAT 1906 20.025 20.562 9.372 1.00 0.00 H ATOM 57303 H2 WAT 1906 21.457 20.552 8.883 1.00 0.00 H TER 57305 WAT 1906 ATOM 57305 O WAT 1907 67.928 34.172 83.744 1.00 0.00 O ATOM 57306 H1 WAT 1907 68.554 33.452 83.824 1.00 0.00 H ATOM 57307 H2 WAT 1907 67.771 34.249 82.803 1.00 0.00 H TER 57309 WAT 1907 ATOM 57309 O WAT 1908 122.030 94.509 8.060 1.00 0.00 O ATOM 57310 H1 WAT 1908 122.772 95.114 8.070 1.00 0.00 H ATOM 57311 H2 WAT 1908 122.203 93.906 8.783 1.00 0.00 H TER 57313 WAT 1908 ATOM 57313 O WAT 1909 17.238 95.581 63.886 1.00 0.00 O ATOM 57314 H1 WAT 1909 16.870 96.463 63.837 1.00 0.00 H ATOM 57315 H2 WAT 1909 17.555 95.404 63.000 1.00 0.00 H TER 57317 WAT 1909 ATOM 57317 O WAT 1910 97.669 32.198 6.972 1.00 0.00 O ATOM 57318 H1 WAT 1910 97.787 31.398 7.483 1.00 0.00 H ATOM 57319 H2 WAT 1910 98.553 32.439 6.696 1.00 0.00 H TER 57321 WAT 1910 ATOM 57321 O WAT 1911 86.165 102.268 24.440 1.00 0.00 O ATOM 57322 H1 WAT 1911 85.280 101.904 24.471 1.00 0.00 H ATOM 57323 H2 WAT 1911 86.211 102.852 25.196 1.00 0.00 H TER 57325 WAT 1911 ATOM 57325 O WAT 1912 9.103 48.553 79.633 1.00 0.00 O ATOM 57326 H1 WAT 1912 8.560 49.154 79.123 1.00 0.00 H ATOM 57327 H2 WAT 1912 9.782 48.267 79.022 1.00 0.00 H TER 57329 WAT 1912 ATOM 57329 O WAT 1913 75.856 3.795 63.616 1.00 0.00 O ATOM 57330 H1 WAT 1913 75.759 3.879 64.565 1.00 0.00 H ATOM 57331 H2 WAT 1913 75.323 4.504 63.257 1.00 0.00 H TER 57333 WAT 1913 ATOM 57333 O WAT 1914 15.125 20.525 135.724 1.00 0.00 O ATOM 57334 H1 WAT 1914 14.690 20.881 136.498 1.00 0.00 H ATOM 57335 H2 WAT 1914 15.054 19.576 135.824 1.00 0.00 H TER 57337 WAT 1914 ATOM 57337 O WAT 1915 104.387 145.360 67.683 1.00 0.00 O ATOM 57338 H1 WAT 1915 104.718 146.206 67.381 1.00 0.00 H ATOM 57339 H2 WAT 1915 105.056 144.731 67.413 1.00 0.00 H TER 57341 WAT 1915 ATOM 57341 O WAT 1916 136.514 118.646 125.660 1.00 0.00 O ATOM 57342 H1 WAT 1916 137.331 119.105 125.465 1.00 0.00 H ATOM 57343 H2 WAT 1916 136.392 118.051 124.920 1.00 0.00 H TER 57345 WAT 1916 ATOM 57345 O WAT 1917 133.902 24.946 156.602 1.00 0.00 O ATOM 57346 H1 WAT 1917 133.745 24.064 156.941 1.00 0.00 H ATOM 57347 H2 WAT 1917 133.736 25.522 157.348 1.00 0.00 H TER 57349 WAT 1917 ATOM 57349 O WAT 1918 10.261 68.067 64.849 1.00 0.00 O ATOM 57350 H1 WAT 1918 11.204 67.911 64.911 1.00 0.00 H ATOM 57351 H2 WAT 1918 10.011 68.373 65.721 1.00 0.00 H TER 57353 WAT 1918 ATOM 57353 O WAT 1919 126.760 86.576 153.323 1.00 0.00 O ATOM 57354 H1 WAT 1919 126.432 85.724 153.610 1.00 0.00 H ATOM 57355 H2 WAT 1919 126.748 86.528 152.367 1.00 0.00 H TER 57357 WAT 1919 ATOM 57357 O WAT 1920 61.796 37.179 139.388 1.00 0.00 O ATOM 57358 H1 WAT 1920 62.300 37.897 139.770 1.00 0.00 H ATOM 57359 H2 WAT 1920 62.445 36.652 138.922 1.00 0.00 H TER 57361 WAT 1920 ATOM 57361 O WAT 1921 103.358 139.338 113.202 1.00 0.00 O ATOM 57362 H1 WAT 1921 102.665 139.074 112.597 1.00 0.00 H ATOM 57363 H2 WAT 1921 103.473 140.274 113.040 1.00 0.00 H TER 57365 WAT 1921 ATOM 57365 O WAT 1922 76.179 4.832 13.183 1.00 0.00 O ATOM 57366 H1 WAT 1922 75.492 4.882 13.848 1.00 0.00 H ATOM 57367 H2 WAT 1922 75.865 5.389 12.471 1.00 0.00 H TER 57369 WAT 1922 ATOM 57369 O WAT 1923 4.628 14.732 112.640 1.00 0.00 O ATOM 57370 H1 WAT 1923 4.913 13.933 113.084 1.00 0.00 H ATOM 57371 H2 WAT 1923 4.390 14.444 111.758 1.00 0.00 H TER 57373 WAT 1923 ATOM 57373 O WAT 1924 2.272 9.203 103.052 1.00 0.00 O ATOM 57374 H1 WAT 1924 3.016 8.881 103.561 1.00 0.00 H ATOM 57375 H2 WAT 1924 2.454 10.134 102.926 1.00 0.00 H TER 57377 WAT 1924 ATOM 57377 O WAT 1925 6.432 113.699 135.986 1.00 0.00 O ATOM 57378 H1 WAT 1925 6.016 114.205 135.287 1.00 0.00 H ATOM 57379 H2 WAT 1925 7.370 113.814 135.840 1.00 0.00 H TER 57381 WAT 1925 ATOM 57381 O WAT 1926 104.263 39.405 6.304 1.00 0.00 O ATOM 57382 H1 WAT 1926 104.414 39.878 5.486 1.00 0.00 H ATOM 57383 H2 WAT 1926 103.328 39.202 6.294 1.00 0.00 H TER 57385 WAT 1926 ATOM 57385 O WAT 1927 102.417 48.322 82.483 1.00 0.00 O ATOM 57386 H1 WAT 1927 102.925 48.826 83.119 1.00 0.00 H ATOM 57387 H2 WAT 1927 101.894 48.977 82.021 1.00 0.00 H TER 57389 WAT 1927 ATOM 57389 O WAT 1928 128.024 26.594 11.201 1.00 0.00 O ATOM 57390 H1 WAT 1928 127.897 26.422 12.134 1.00 0.00 H ATOM 57391 H2 WAT 1928 127.246 27.088 10.940 1.00 0.00 H TER 57393 WAT 1928 ATOM 57393 O WAT 1929 15.760 11.488 24.275 1.00 0.00 O ATOM 57394 H1 WAT 1929 15.407 10.751 24.773 1.00 0.00 H ATOM 57395 H2 WAT 1929 16.653 11.592 24.603 1.00 0.00 H TER 57397 WAT 1929 ATOM 57397 O WAT 1930 140.646 125.460 116.816 1.00 0.00 O ATOM 57398 H1 WAT 1930 140.451 126.010 116.058 1.00 0.00 H ATOM 57399 H2 WAT 1930 140.362 124.584 116.556 1.00 0.00 H TER 57401 WAT 1930 ATOM 57401 O WAT 1931 57.193 92.674 125.377 1.00 0.00 O ATOM 57402 H1 WAT 1931 57.050 92.998 126.266 1.00 0.00 H ATOM 57403 H2 WAT 1931 57.920 93.200 125.044 1.00 0.00 H TER 57405 WAT 1931 ATOM 57405 O WAT 1932 106.883 67.056 108.822 1.00 0.00 O ATOM 57406 H1 WAT 1932 107.454 66.568 108.228 1.00 0.00 H ATOM 57407 H2 WAT 1932 107.155 66.778 109.697 1.00 0.00 H TER 57409 WAT 1932 ATOM 57409 O WAT 1933 81.078 17.735 1.682 1.00 0.00 O ATOM 57410 H1 WAT 1933 81.732 17.519 2.347 1.00 0.00 H ATOM 57411 H2 WAT 1933 80.670 18.540 2.000 1.00 0.00 H TER 57413 WAT 1933 ATOM 57413 O WAT 1934 121.403 40.933 93.754 1.00 0.00 O ATOM 57414 H1 WAT 1934 121.167 40.983 92.828 1.00 0.00 H ATOM 57415 H2 WAT 1934 120.898 41.633 94.168 1.00 0.00 H TER 57417 WAT 1934 ATOM 57417 O WAT 1935 130.008 23.790 23.035 1.00 0.00 O ATOM 57418 H1 WAT 1935 129.835 24.697 23.288 1.00 0.00 H ATOM 57419 H2 WAT 1935 130.524 23.433 23.757 1.00 0.00 H TER 57421 WAT 1935 ATOM 57421 O WAT 1936 56.276 4.196 92.085 1.00 0.00 O ATOM 57422 H1 WAT 1936 55.548 4.065 91.479 1.00 0.00 H ATOM 57423 H2 WAT 1936 56.921 3.535 91.832 1.00 0.00 H TER 57425 WAT 1936 ATOM 57425 O WAT 1937 97.784 99.720 74.224 1.00 0.00 O ATOM 57426 H1 WAT 1937 96.906 99.360 74.097 1.00 0.00 H ATOM 57427 H2 WAT 1937 98.314 98.970 74.494 1.00 0.00 H TER 57429 WAT 1937 ATOM 57429 O WAT 1938 74.312 9.107 3.391 1.00 0.00 O ATOM 57430 H1 WAT 1938 74.923 9.832 3.518 1.00 0.00 H ATOM 57431 H2 WAT 1938 74.423 8.857 2.474 1.00 0.00 H TER 57433 WAT 1938 ATOM 57433 O WAT 1939 37.306 24.933 148.605 1.00 0.00 O ATOM 57434 H1 WAT 1939 36.505 24.693 148.139 1.00 0.00 H ATOM 57435 H2 WAT 1939 38.013 24.703 148.002 1.00 0.00 H TER 57437 WAT 1939 ATOM 57437 O WAT 1940 102.673 61.453 7.218 1.00 0.00 O ATOM 57438 H1 WAT 1940 103.486 61.077 7.557 1.00 0.00 H ATOM 57439 H2 WAT 1940 102.095 60.701 7.092 1.00 0.00 H TER 57441 WAT 1940 ATOM 57441 O WAT 1941 17.338 32.807 95.782 1.00 0.00 O ATOM 57442 H1 WAT 1941 17.708 32.108 95.242 1.00 0.00 H ATOM 57443 H2 WAT 1941 16.608 33.147 95.265 1.00 0.00 H TER 57445 WAT 1941 ATOM 57445 O WAT 1942 141.745 86.534 116.308 1.00 0.00 O ATOM 57446 H1 WAT 1942 141.859 86.875 117.195 1.00 0.00 H ATOM 57447 H2 WAT 1942 142.635 86.457 115.965 1.00 0.00 H TER 57449 WAT 1942 ATOM 57449 O WAT 1943 36.577 85.180 149.228 1.00 0.00 O ATOM 57450 H1 WAT 1943 36.100 84.489 148.768 1.00 0.00 H ATOM 57451 H2 WAT 1943 36.670 85.879 148.581 1.00 0.00 H TER 57453 WAT 1943 ATOM 57453 O WAT 1944 73.470 62.399 22.534 1.00 0.00 O ATOM 57454 H1 WAT 1944 74.156 61.745 22.665 1.00 0.00 H ATOM 57455 H2 WAT 1944 72.683 61.997 22.901 1.00 0.00 H TER 57457 WAT 1944 ATOM 57457 O WAT 1945 54.446 104.020 65.504 1.00 0.00 O ATOM 57458 H1 WAT 1945 54.740 103.829 66.395 1.00 0.00 H ATOM 57459 H2 WAT 1945 53.621 104.491 65.619 1.00 0.00 H TER 57461 WAT 1945 ATOM 57461 O WAT 1946 5.866 28.591 101.860 1.00 0.00 O ATOM 57462 H1 WAT 1946 6.242 29.447 102.063 1.00 0.00 H ATOM 57463 H2 WAT 1946 6.622 28.040 101.656 1.00 0.00 H TER 57465 WAT 1946 ATOM 57465 O WAT 1947 82.605 107.123 125.084 1.00 0.00 O ATOM 57466 H1 WAT 1947 83.022 107.256 124.233 1.00 0.00 H ATOM 57467 H2 WAT 1947 82.439 108.007 125.410 1.00 0.00 H TER 57469 WAT 1947 ATOM 57469 O WAT 1948 91.085 16.625 85.174 1.00 0.00 O ATOM 57470 H1 WAT 1948 91.663 17.371 85.334 1.00 0.00 H ATOM 57471 H2 WAT 1948 91.125 16.113 85.982 1.00 0.00 H TER 57473 WAT 1948 ATOM 57473 O WAT 1949 101.747 92.830 62.152 1.00 0.00 O ATOM 57474 H1 WAT 1949 101.734 93.459 61.431 1.00 0.00 H ATOM 57475 H2 WAT 1949 102.659 92.545 62.205 1.00 0.00 H TER 57477 WAT 1949 ATOM 57477 O WAT 1950 46.706 121.804 131.389 1.00 0.00 O ATOM 57478 H1 WAT 1950 46.298 122.609 131.707 1.00 0.00 H ATOM 57479 H2 WAT 1950 46.573 121.172 132.096 1.00 0.00 H TER 57481 WAT 1950 ATOM 57481 O WAT 1951 12.240 82.228 101.379 1.00 0.00 O ATOM 57482 H1 WAT 1951 12.585 83.062 101.059 1.00 0.00 H ATOM 57483 H2 WAT 1951 11.377 82.154 100.972 1.00 0.00 H TER 57485 WAT 1951 ATOM 57485 O WAT 1952 106.094 61.234 112.120 1.00 0.00 O ATOM 57486 H1 WAT 1952 105.189 61.451 111.895 1.00 0.00 H ATOM 57487 H2 WAT 1952 106.056 60.972 113.040 1.00 0.00 H TER 57489 WAT 1952 ATOM 57489 O WAT 1953 59.234 136.326 61.999 1.00 0.00 O ATOM 57490 H1 WAT 1953 58.487 136.859 61.727 1.00 0.00 H ATOM 57491 H2 WAT 1953 58.845 135.584 62.461 1.00 0.00 H TER 57493 WAT 1953 ATOM 57493 O WAT 1954 118.553 138.287 134.778 1.00 0.00 O ATOM 57494 H1 WAT 1954 118.021 138.819 134.186 1.00 0.00 H ATOM 57495 H2 WAT 1954 119.269 138.865 135.043 1.00 0.00 H TER 57497 WAT 1954 ATOM 57497 O WAT 1955 116.166 59.701 118.970 1.00 0.00 O ATOM 57498 H1 WAT 1955 116.420 58.898 119.424 1.00 0.00 H ATOM 57499 H2 WAT 1955 116.204 59.474 118.041 1.00 0.00 H TER 57501 WAT 1955 ATOM 57501 O WAT 1956 61.750 13.896 115.947 1.00 0.00 O ATOM 57502 H1 WAT 1956 61.799 13.178 115.316 1.00 0.00 H ATOM 57503 H2 WAT 1956 60.824 13.945 116.183 1.00 0.00 H TER 57505 WAT 1956 ATOM 57505 O WAT 1957 49.767 53.341 145.098 1.00 0.00 O ATOM 57506 H1 WAT 1957 49.759 53.587 146.023 1.00 0.00 H ATOM 57507 H2 WAT 1957 50.679 53.112 144.919 1.00 0.00 H TER 57509 WAT 1957 ATOM 57509 O WAT 1958 77.740 15.923 153.869 1.00 0.00 O ATOM 57510 H1 WAT 1958 77.262 15.270 153.358 1.00 0.00 H ATOM 57511 H2 WAT 1958 78.266 15.409 154.482 1.00 0.00 H TER 57513 WAT 1958 ATOM 57513 O WAT 1959 67.342 16.380 68.772 1.00 0.00 O ATOM 57514 H1 WAT 1959 67.017 15.530 68.476 1.00 0.00 H ATOM 57515 H2 WAT 1959 67.098 16.986 68.072 1.00 0.00 H TER 57517 WAT 1959 ATOM 57517 O WAT 1960 25.005 80.138 76.255 1.00 0.00 O ATOM 57518 H1 WAT 1960 24.694 80.968 75.894 1.00 0.00 H ATOM 57519 H2 WAT 1960 25.642 79.822 75.615 1.00 0.00 H TER 57521 WAT 1960 ATOM 57521 O WAT 1961 86.223 34.715 5.479 1.00 0.00 O ATOM 57522 H1 WAT 1961 85.284 34.838 5.338 1.00 0.00 H ATOM 57523 H2 WAT 1961 86.526 34.260 4.693 1.00 0.00 H TER 57525 WAT 1961 ATOM 57525 O WAT 1962 134.986 15.016 106.337 1.00 0.00 O ATOM 57526 H1 WAT 1962 134.756 15.613 107.050 1.00 0.00 H ATOM 57527 H2 WAT 1962 135.664 14.451 106.707 1.00 0.00 H TER 57529 WAT 1962 ATOM 57529 O WAT 1963 82.009 50.331 142.128 1.00 0.00 O ATOM 57530 H1 WAT 1963 82.468 51.154 142.295 1.00 0.00 H ATOM 57531 H2 WAT 1963 81.405 50.240 142.865 1.00 0.00 H TER 57533 WAT 1963 ATOM 57533 O WAT 1964 139.269 92.752 155.334 1.00 0.00 O ATOM 57534 H1 WAT 1964 138.964 93.200 154.546 1.00 0.00 H ATOM 57535 H2 WAT 1964 139.231 93.420 156.019 1.00 0.00 H TER 57537 WAT 1964 ATOM 57537 O WAT 1965 123.852 104.480 107.437 1.00 0.00 O ATOM 57538 H1 WAT 1965 123.027 104.940 107.587 1.00 0.00 H ATOM 57539 H2 WAT 1965 124.206 104.330 108.313 1.00 0.00 H TER 57541 WAT 1965 ATOM 57541 O WAT 1966 108.506 138.578 2.672 1.00 0.00 O ATOM 57542 H1 WAT 1966 108.962 137.823 2.298 1.00 0.00 H ATOM 57543 H2 WAT 1966 108.012 138.218 3.409 1.00 0.00 H TER 57545 WAT 1966 ATOM 57545 O WAT 1967 92.113 36.767 111.191 1.00 0.00 O ATOM 57546 H1 WAT 1967 92.996 36.762 111.560 1.00 0.00 H ATOM 57547 H2 WAT 1967 91.537 36.863 111.949 1.00 0.00 H TER 57549 WAT 1967 ATOM 57549 O WAT 1968 31.146 36.453 65.090 1.00 0.00 O ATOM 57550 H1 WAT 1968 30.952 35.738 64.483 1.00 0.00 H ATOM 57551 H2 WAT 1968 30.518 36.339 65.803 1.00 0.00 H TER 57553 WAT 1968 ATOM 57553 O WAT 1969 12.742 111.463 62.987 1.00 0.00 O ATOM 57554 H1 WAT 1969 13.411 111.521 63.670 1.00 0.00 H ATOM 57555 H2 WAT 1969 13.106 110.851 62.348 1.00 0.00 H TER 57557 WAT 1969 ATOM 57557 O WAT 1970 55.873 52.922 74.451 1.00 0.00 O ATOM 57558 H1 WAT 1970 55.218 52.540 75.034 1.00 0.00 H ATOM 57559 H2 WAT 1970 56.609 53.135 75.025 1.00 0.00 H TER 57561 WAT 1970 ATOM 57561 O WAT 1971 52.628 108.441 125.565 1.00 0.00 O ATOM 57562 H1 WAT 1971 51.674 108.375 125.599 1.00 0.00 H ATOM 57563 H2 WAT 1971 52.935 107.541 125.674 1.00 0.00 H TER 57565 WAT 1971 ATOM 57565 O WAT 1972 29.157 112.088 101.073 1.00 0.00 O ATOM 57566 H1 WAT 1972 29.804 112.786 100.973 1.00 0.00 H ATOM 57567 H2 WAT 1972 29.233 111.575 100.269 1.00 0.00 H TER 57569 WAT 1972 ATOM 57569 O WAT 1973 90.411 23.165 116.589 1.00 0.00 O ATOM 57570 H1 WAT 1973 89.540 22.860 116.336 1.00 0.00 H ATOM 57571 H2 WAT 1973 90.331 24.118 116.621 1.00 0.00 H TER 57573 WAT 1973 ATOM 57573 O WAT 1974 124.175 113.292 14.082 1.00 0.00 O ATOM 57574 H1 WAT 1974 124.007 113.156 15.014 1.00 0.00 H ATOM 57575 H2 WAT 1974 123.888 114.190 13.916 1.00 0.00 H TER 57577 WAT 1974 ATOM 57577 O WAT 1975 131.200 41.608 12.853 1.00 0.00 O ATOM 57578 H1 WAT 1975 130.908 41.248 13.690 1.00 0.00 H ATOM 57579 H2 WAT 1975 131.994 41.116 12.645 1.00 0.00 H TER 57581 WAT 1975 ATOM 57581 O WAT 1976 65.181 76.666 144.954 1.00 0.00 O ATOM 57582 H1 WAT 1976 65.069 76.856 144.023 1.00 0.00 H ATOM 57583 H2 WAT 1976 66.013 76.195 145.005 1.00 0.00 H TER 57585 WAT 1976 ATOM 57585 O WAT 1977 29.920 31.572 158.057 1.00 0.00 O ATOM 57586 H1 WAT 1977 30.530 30.835 158.062 1.00 0.00 H ATOM 57587 H2 WAT 1977 29.928 31.896 158.958 1.00 0.00 H TER 57589 WAT 1977 ATOM 57589 O WAT 1978 34.591 25.210 91.591 1.00 0.00 O ATOM 57590 H1 WAT 1978 35.472 24.924 91.832 1.00 0.00 H ATOM 57591 H2 WAT 1978 34.053 24.998 92.354 1.00 0.00 H TER 57593 WAT 1978 ATOM 57593 O WAT 1979 82.723 71.071 10.357 1.00 0.00 O ATOM 57594 H1 WAT 1979 83.491 71.346 10.857 1.00 0.00 H ATOM 57595 H2 WAT 1979 83.042 70.979 9.459 1.00 0.00 H TER 57597 WAT 1979 ATOM 57597 O WAT 1980 64.459 70.893 76.743 1.00 0.00 O ATOM 57598 H1 WAT 1980 65.076 70.494 76.129 1.00 0.00 H ATOM 57599 H2 WAT 1980 64.979 71.541 77.218 1.00 0.00 H TER 57601 WAT 1980 ATOM 57601 O WAT 1981 124.697 4.448 135.651 1.00 0.00 O ATOM 57602 H1 WAT 1981 124.203 5.104 136.144 1.00 0.00 H ATOM 57603 H2 WAT 1981 124.099 4.169 134.958 1.00 0.00 H TER 57605 WAT 1981 ATOM 57605 O WAT 1982 75.060 108.087 19.434 1.00 0.00 O ATOM 57606 H1 WAT 1982 75.405 107.700 20.239 1.00 0.00 H ATOM 57607 H2 WAT 1982 74.509 108.810 19.732 1.00 0.00 H TER 57609 WAT 1982 ATOM 57609 O WAT 1983 21.819 65.496 125.093 1.00 0.00 O ATOM 57610 H1 WAT 1983 22.463 65.466 125.801 1.00 0.00 H ATOM 57611 H2 WAT 1983 21.677 66.430 124.939 1.00 0.00 H TER 57613 WAT 1983 ATOM 57613 O WAT 1984 30.763 115.704 69.869 1.00 0.00 O ATOM 57614 H1 WAT 1984 31.426 116.167 70.381 1.00 0.00 H ATOM 57615 H2 WAT 1984 31.026 115.838 68.958 1.00 0.00 H TER 57617 WAT 1984 ATOM 57617 O WAT 1985 65.394 68.217 133.338 1.00 0.00 O ATOM 57618 H1 WAT 1985 64.519 67.868 133.165 1.00 0.00 H ATOM 57619 H2 WAT 1985 65.242 69.120 133.614 1.00 0.00 H TER 57621 WAT 1985 ATOM 57621 O WAT 1986 20.172 66.207 107.446 1.00 0.00 O ATOM 57622 H1 WAT 1986 20.985 65.783 107.722 1.00 0.00 H ATOM 57623 H2 WAT 1986 19.797 66.556 108.255 1.00 0.00 H TER 57625 WAT 1986 ATOM 57625 O WAT 1987 20.483 0.732 120.026 1.00 0.00 O ATOM 57626 H1 WAT 1987 21.280 0.641 120.548 1.00 0.00 H ATOM 57627 H2 WAT 1987 20.525 1.622 119.678 1.00 0.00 H TER 57629 WAT 1987 ATOM 57629 O WAT 1988 80.104 69.479 148.604 1.00 0.00 O ATOM 57630 H1 WAT 1988 80.298 69.958 149.410 1.00 0.00 H ATOM 57631 H2 WAT 1988 79.201 69.716 148.395 1.00 0.00 H TER 57633 WAT 1988 ATOM 57633 O WAT 1989 98.245 121.955 74.028 1.00 0.00 O ATOM 57634 H1 WAT 1989 97.593 121.319 74.323 1.00 0.00 H ATOM 57635 H2 WAT 1989 98.929 121.424 73.620 1.00 0.00 H TER 57637 WAT 1989 ATOM 57637 O WAT 1990 43.291 86.318 23.823 1.00 0.00 O ATOM 57638 H1 WAT 1990 43.521 85.559 23.287 1.00 0.00 H ATOM 57639 H2 WAT 1990 42.991 85.944 24.651 1.00 0.00 H TER 57641 WAT 1990 ATOM 57641 O WAT 1991 74.319 145.305 119.296 1.00 0.00 O ATOM 57642 H1 WAT 1991 74.503 144.715 118.564 1.00 0.00 H ATOM 57643 H2 WAT 1991 74.625 146.161 118.997 1.00 0.00 H TER 57645 WAT 1991 ATOM 57645 O WAT 1992 67.724 77.429 76.062 1.00 0.00 O ATOM 57646 H1 WAT 1992 67.195 76.632 76.083 1.00 0.00 H ATOM 57647 H2 WAT 1992 67.338 77.954 75.360 1.00 0.00 H TER 57649 WAT 1992 ATOM 57649 O WAT 1993 46.209 89.734 124.051 1.00 0.00 O ATOM 57650 H1 WAT 1993 45.279 89.685 123.829 1.00 0.00 H ATOM 57651 H2 WAT 1993 46.287 90.525 124.584 1.00 0.00 H TER 57653 WAT 1993 ATOM 57653 O WAT 1994 60.180 85.428 111.122 1.00 0.00 O ATOM 57654 H1 WAT 1994 60.144 85.889 111.960 1.00 0.00 H ATOM 57655 H2 WAT 1994 61.035 84.998 111.121 1.00 0.00 H TER 57657 WAT 1994 ATOM 57657 O WAT 1995 98.254 75.658 87.357 1.00 0.00 O ATOM 57658 H1 WAT 1995 98.429 76.594 87.455 1.00 0.00 H ATOM 57659 H2 WAT 1995 99.110 75.242 87.461 1.00 0.00 H TER 57661 WAT 1995 ATOM 57661 O WAT 1996 128.774 122.222 16.490 1.00 0.00 O ATOM 57662 H1 WAT 1996 128.087 121.678 16.106 1.00 0.00 H ATOM 57663 H2 WAT 1996 128.434 122.464 17.352 1.00 0.00 H TER 57665 WAT 1996 ATOM 57665 O WAT 1997 21.533 128.267 143.707 1.00 0.00 O ATOM 57666 H1 WAT 1997 22.167 128.888 144.066 1.00 0.00 H ATOM 57667 H2 WAT 1997 21.217 127.780 144.468 1.00 0.00 H TER 57669 WAT 1997 ATOM 57669 O WAT 1998 40.827 81.668 132.107 1.00 0.00 O ATOM 57670 H1 WAT 1998 41.587 82.108 131.727 1.00 0.00 H ATOM 57671 H2 WAT 1998 40.647 80.942 131.509 1.00 0.00 H TER 57673 WAT 1998 ATOM 57673 O WAT 1999 64.293 0.423 108.045 1.00 0.00 O ATOM 57674 H1 WAT 1999 64.877 -0.330 108.138 1.00 0.00 H ATOM 57675 H2 WAT 1999 64.823 1.172 108.317 1.00 0.00 H TER 57677 WAT 1999 ATOM 57677 O WAT 2000 13.437 113.857 91.997 1.00 0.00 O ATOM 57678 H1 WAT 2000 13.829 114.447 91.353 1.00 0.00 H ATOM 57679 H2 WAT 2000 13.280 114.409 92.763 1.00 0.00 H TER 57681 WAT 2000 ATOM 57681 O WAT 2001 100.279 136.880 53.976 1.00 0.00 O ATOM 57682 H1 WAT 2001 101.176 136.652 53.733 1.00 0.00 H ATOM 57683 H2 WAT 2001 99.862 136.040 54.166 1.00 0.00 H TER 57685 WAT 2001 ATOM 57685 O WAT 2002 14.336 33.404 119.483 1.00 0.00 O ATOM 57686 H1 WAT 2002 15.016 34.079 119.482 1.00 0.00 H ATOM 57687 H2 WAT 2002 13.799 33.606 118.717 1.00 0.00 H TER 57689 WAT 2002 ATOM 57689 O WAT 2003 119.546 109.036 130.438 1.00 0.00 O ATOM 57690 H1 WAT 2003 118.664 108.736 130.219 1.00 0.00 H ATOM 57691 H2 WAT 2003 119.417 109.909 130.808 1.00 0.00 H TER 57693 WAT 2003 ATOM 57693 O WAT 2004 138.379 115.650 60.349 1.00 0.00 O ATOM 57694 H1 WAT 2004 138.392 114.891 59.765 1.00 0.00 H ATOM 57695 H2 WAT 2004 139.153 115.540 60.901 1.00 0.00 H TER 57697 WAT 2004 ATOM 57697 O WAT 2005 133.782 5.799 77.512 1.00 0.00 O ATOM 57698 H1 WAT 2005 133.234 6.309 78.109 1.00 0.00 H ATOM 57699 H2 WAT 2005 133.182 5.507 76.826 1.00 0.00 H TER 57701 WAT 2005 ATOM 57701 O WAT 2006 68.536 68.030 65.762 1.00 0.00 O ATOM 57702 H1 WAT 2006 68.836 68.759 65.220 1.00 0.00 H ATOM 57703 H2 WAT 2006 67.588 68.009 65.633 1.00 0.00 H TER 57705 WAT 2006 ATOM 57705 O WAT 2007 69.236 129.657 134.076 1.00 0.00 O ATOM 57706 H1 WAT 2007 68.499 129.899 133.516 1.00 0.00 H ATOM 57707 H2 WAT 2007 69.427 130.450 134.577 1.00 0.00 H TER 57709 WAT 2007 ATOM 57709 O WAT 2008 85.445 100.725 74.895 1.00 0.00 O ATOM 57710 H1 WAT 2008 86.272 100.268 75.045 1.00 0.00 H ATOM 57711 H2 WAT 2008 84.919 100.529 75.671 1.00 0.00 H TER 57713 WAT 2008 ATOM 57713 O WAT 2009 129.192 72.040 108.574 1.00 0.00 O ATOM 57714 H1 WAT 2009 128.705 72.830 108.339 1.00 0.00 H ATOM 57715 H2 WAT 2009 130.004 72.367 108.963 1.00 0.00 H TER 57717 WAT 2009 ATOM 57717 O WAT 2010 49.596 0.063 73.743 1.00 0.00 O ATOM 57718 H1 WAT 2010 48.670 0.304 73.732 1.00 0.00 H ATOM 57719 H2 WAT 2010 49.974 0.596 74.444 1.00 0.00 H TER 57721 WAT 2010 ATOM 57721 O WAT 2011 133.051 85.271 87.999 1.00 0.00 O ATOM 57722 H1 WAT 2011 133.625 86.028 87.888 1.00 0.00 H ATOM 57723 H2 WAT 2011 133.525 84.698 88.602 1.00 0.00 H TER 57725 WAT 2011 ATOM 57725 O WAT 2012 117.518 101.695 125.489 1.00 0.00 O ATOM 57726 H1 WAT 2012 117.016 101.242 126.166 1.00 0.00 H ATOM 57727 H2 WAT 2012 117.015 102.489 125.309 1.00 0.00 H TER 57729 WAT 2012 ATOM 57729 O WAT 2013 134.032 116.967 90.116 1.00 0.00 O ATOM 57730 H1 WAT 2013 134.770 117.346 90.594 1.00 0.00 H ATOM 57731 H2 WAT 2013 134.186 116.023 90.146 1.00 0.00 H TER 57733 WAT 2013 ATOM 57733 O WAT 2014 35.075 104.444 3.030 1.00 0.00 O ATOM 57734 H1 WAT 2014 34.256 104.018 2.777 1.00 0.00 H ATOM 57735 H2 WAT 2014 34.951 104.673 3.952 1.00 0.00 H TER 57737 WAT 2014 ATOM 57737 O WAT 2015 78.911 20.144 58.005 1.00 0.00 O ATOM 57738 H1 WAT 2015 78.326 20.137 57.248 1.00 0.00 H ATOM 57739 H2 WAT 2015 78.324 20.142 58.762 1.00 0.00 H TER 57741 WAT 2015 ATOM 57741 O WAT 2016 88.700 103.689 144.272 1.00 0.00 O ATOM 57742 H1 WAT 2016 88.163 104.357 144.699 1.00 0.00 H ATOM 57743 H2 WAT 2016 88.234 102.869 144.432 1.00 0.00 H TER 57745 WAT 2016 ATOM 57745 O WAT 2017 3.193 70.449 149.382 1.00 0.00 O ATOM 57746 H1 WAT 2017 2.444 70.857 148.948 1.00 0.00 H ATOM 57747 H2 WAT 2017 3.629 71.170 149.836 1.00 0.00 H TER 57749 WAT 2017 ATOM 57749 O WAT 2018 30.248 94.125 91.663 1.00 0.00 O ATOM 57750 H1 WAT 2018 29.420 94.601 91.603 1.00 0.00 H ATOM 57751 H2 WAT 2018 29.995 93.232 91.897 1.00 0.00 H TER 57753 WAT 2018 ATOM 57753 O WAT 2019 40.158 49.812 92.142 1.00 0.00 O ATOM 57754 H1 WAT 2019 40.000 48.912 92.427 1.00 0.00 H ATOM 57755 H2 WAT 2019 40.862 49.738 91.497 1.00 0.00 H TER 57757 WAT 2019 ATOM 57757 O WAT 2020 72.536 52.181 109.863 1.00 0.00 O ATOM 57758 H1 WAT 2020 71.994 52.083 109.080 1.00 0.00 H ATOM 57759 H2 WAT 2020 72.407 53.090 110.132 1.00 0.00 H TER 57761 WAT 2020 ATOM 57761 O WAT 2021 49.466 12.335 77.147 1.00 0.00 O ATOM 57762 H1 WAT 2021 50.031 12.468 76.386 1.00 0.00 H ATOM 57763 H2 WAT 2021 49.570 13.133 77.665 1.00 0.00 H TER 57765 WAT 2021 ATOM 57765 O WAT 2022 36.748 9.176 156.242 1.00 0.00 O ATOM 57766 H1 WAT 2022 36.725 8.263 155.957 1.00 0.00 H ATOM 57767 H2 WAT 2022 36.734 9.681 155.429 1.00 0.00 H TER 57769 WAT 2022 ATOM 57769 O WAT 2023 49.662 73.872 60.685 1.00 0.00 O ATOM 57770 H1 WAT 2023 49.055 73.150 60.522 1.00 0.00 H ATOM 57771 H2 WAT 2023 49.902 73.780 61.607 1.00 0.00 H TER 57773 WAT 2023 ATOM 57773 O WAT 2024 63.473 85.802 148.333 1.00 0.00 O ATOM 57774 H1 WAT 2024 62.980 86.514 148.742 1.00 0.00 H ATOM 57775 H2 WAT 2024 62.841 85.088 148.252 1.00 0.00 H TER 57777 WAT 2024 ATOM 57777 O WAT 2025 106.383 128.900 90.980 1.00 0.00 O ATOM 57778 H1 WAT 2025 105.637 128.995 91.572 1.00 0.00 H ATOM 57779 H2 WAT 2025 106.262 129.593 90.330 1.00 0.00 H TER 57781 WAT 2025 ATOM 57781 O WAT 2026 131.330 0.830 6.985 1.00 0.00 O ATOM 57782 H1 WAT 2026 131.452 1.643 7.475 1.00 0.00 H ATOM 57783 H2 WAT 2026 132.189 0.648 6.605 1.00 0.00 H TER 57785 WAT 2026 ATOM 57785 O WAT 2027 4.460 26.536 24.901 1.00 0.00 O ATOM 57786 H1 WAT 2027 4.904 25.928 24.310 1.00 0.00 H ATOM 57787 H2 WAT 2027 3.772 26.011 25.310 1.00 0.00 H TER 57789 WAT 2027 ATOM 57789 O WAT 2028 15.436 80.174 133.617 1.00 0.00 O ATOM 57790 H1 WAT 2028 15.262 81.031 133.228 1.00 0.00 H ATOM 57791 H2 WAT 2028 15.673 79.618 132.875 1.00 0.00 H TER 57793 WAT 2028 ATOM 57793 O WAT 2029 97.356 34.342 100.346 1.00 0.00 O ATOM 57794 H1 WAT 2029 97.322 34.563 101.277 1.00 0.00 H ATOM 57795 H2 WAT 2029 96.755 34.960 99.931 1.00 0.00 H TER 57797 WAT 2029 ATOM 57797 O WAT 2030 24.896 61.049 118.276 1.00 0.00 O ATOM 57798 H1 WAT 2030 25.572 61.607 117.892 1.00 0.00 H ATOM 57799 H2 WAT 2030 24.676 61.474 119.105 1.00 0.00 H TER 57801 WAT 2030 ATOM 57801 O WAT 2031 116.452 110.676 64.638 1.00 0.00 O ATOM 57802 H1 WAT 2031 115.845 110.006 64.951 1.00 0.00 H ATOM 57803 H2 WAT 2031 116.903 110.265 63.901 1.00 0.00 H TER 57805 WAT 2031 ATOM 57805 O WAT 2032 140.446 77.512 139.019 1.00 0.00 O ATOM 57806 H1 WAT 2032 141.289 77.788 139.378 1.00 0.00 H ATOM 57807 H2 WAT 2032 139.856 78.243 139.205 1.00 0.00 H TER 57809 WAT 2032 ATOM 57809 O WAT 2033 48.026 113.299 131.564 1.00 0.00 O ATOM 57810 H1 WAT 2033 48.280 112.491 132.010 1.00 0.00 H ATOM 57811 H2 WAT 2033 48.377 113.205 130.679 1.00 0.00 H TER 57813 WAT 2033 ATOM 57813 O WAT 2034 124.965 127.289 138.699 1.00 0.00 O ATOM 57814 H1 WAT 2034 125.492 128.088 138.735 1.00 0.00 H ATOM 57815 H2 WAT 2034 125.586 126.584 138.882 1.00 0.00 H TER 57817 WAT 2034 ATOM 57817 O WAT 2035 47.885 34.897 62.114 1.00 0.00 O ATOM 57818 H1 WAT 2035 47.303 35.650 62.012 1.00 0.00 H ATOM 57819 H2 WAT 2035 48.038 34.838 63.057 1.00 0.00 H TER 57821 WAT 2035 ATOM 57821 O WAT 2036 0.709 79.586 101.718 1.00 0.00 O ATOM 57822 H1 WAT 2036 1.169 78.863 101.291 1.00 0.00 H ATOM 57823 H2 WAT 2036 0.772 80.310 101.096 1.00 0.00 H TER 57825 WAT 2036 ATOM 57825 O WAT 2037 134.408 141.434 82.364 1.00 0.00 O ATOM 57826 H1 WAT 2037 134.557 142.369 82.223 1.00 0.00 H ATOM 57827 H2 WAT 2037 133.669 141.398 82.971 1.00 0.00 H TER 57829 WAT 2037 ATOM 57829 O WAT 2038 13.004 118.495 82.494 1.00 0.00 O ATOM 57830 H1 WAT 2038 12.969 117.539 82.461 1.00 0.00 H ATOM 57831 H2 WAT 2038 13.299 118.755 81.622 1.00 0.00 H TER 57833 WAT 2038 ATOM 57833 O WAT 2039 87.934 63.935 148.923 1.00 0.00 O ATOM 57834 H1 WAT 2039 88.741 64.428 148.772 1.00 0.00 H ATOM 57835 H2 WAT 2039 88.067 63.512 149.771 1.00 0.00 H TER 57837 WAT 2039 ATOM 57837 O WAT 2040 71.513 78.653 111.999 1.00 0.00 O ATOM 57838 H1 WAT 2040 71.240 79.568 112.059 1.00 0.00 H ATOM 57839 H2 WAT 2040 71.259 78.385 111.115 1.00 0.00 H TER 57841 WAT 2040 ATOM 57841 O WAT 2041 125.411 124.384 120.188 1.00 0.00 O ATOM 57842 H1 WAT 2041 124.723 125.025 120.012 1.00 0.00 H ATOM 57843 H2 WAT 2041 125.608 124.493 121.119 1.00 0.00 H TER 57845 WAT 2041 ATOM 57845 O WAT 2042 79.279 107.568 156.222 1.00 0.00 O ATOM 57846 H1 WAT 2042 79.639 107.848 157.064 1.00 0.00 H ATOM 57847 H2 WAT 2042 80.048 107.361 155.690 1.00 0.00 H TER 57849 WAT 2042 ATOM 57849 O WAT 2043 54.346 15.871 133.552 1.00 0.00 O ATOM 57850 H1 WAT 2043 53.563 15.409 133.256 1.00 0.00 H ATOM 57851 H2 WAT 2043 54.097 16.248 134.397 1.00 0.00 H TER 57853 WAT 2043 ATOM 57853 O WAT 2044 117.754 10.118 82.529 1.00 0.00 O ATOM 57854 H1 WAT 2044 118.566 9.621 82.628 1.00 0.00 H ATOM 57855 H2 WAT 2044 117.917 10.697 81.784 1.00 0.00 H TER 57857 WAT 2044 ATOM 57857 O WAT 2045 38.990 17.982 82.578 1.00 0.00 O ATOM 57858 H1 WAT 2045 38.158 18.448 82.493 1.00 0.00 H ATOM 57859 H2 WAT 2045 39.654 18.636 82.359 1.00 0.00 H TER 57861 WAT 2045 ATOM 57861 O WAT 2046 112.225 112.367 77.549 1.00 0.00 O ATOM 57862 H1 WAT 2046 112.272 111.784 76.791 1.00 0.00 H ATOM 57863 H2 WAT 2046 111.994 113.220 77.180 1.00 0.00 H TER 57865 WAT 2046 ATOM 57865 O WAT 2047 46.859 130.807 147.252 1.00 0.00 O ATOM 57866 H1 WAT 2047 47.029 131.145 148.131 1.00 0.00 H ATOM 57867 H2 WAT 2047 47.115 129.886 147.297 1.00 0.00 H TER 57869 WAT 2047 ATOM 57869 O WAT 2048 42.300 4.126 70.413 1.00 0.00 O ATOM 57870 H1 WAT 2048 43.229 4.223 70.619 1.00 0.00 H ATOM 57871 H2 WAT 2048 41.998 5.018 70.241 1.00 0.00 H TER 57873 WAT 2048 ATOM 57873 O WAT 2049 40.427 31.607 120.892 1.00 0.00 O ATOM 57874 H1 WAT 2049 40.247 30.921 120.249 1.00 0.00 H ATOM 57875 H2 WAT 2049 41.371 31.756 120.824 1.00 0.00 H TER 57877 WAT 2049 ATOM 57877 O WAT 2050 69.213 128.173 58.647 1.00 0.00 O ATOM 57878 H1 WAT 2050 69.641 128.329 59.489 1.00 0.00 H ATOM 57879 H2 WAT 2050 69.308 127.232 58.501 1.00 0.00 H TER 57881 WAT 2050 ATOM 57881 O WAT 2051 84.130 98.755 108.876 1.00 0.00 O ATOM 57882 H1 WAT 2051 83.565 98.868 109.640 1.00 0.00 H ATOM 57883 H2 WAT 2051 83.523 98.636 108.145 1.00 0.00 H TER 57885 WAT 2051 ATOM 57885 O WAT 2052 61.856 43.211 106.659 1.00 0.00 O ATOM 57886 H1 WAT 2052 62.429 43.902 106.327 1.00 0.00 H ATOM 57887 H2 WAT 2052 62.430 42.656 107.186 1.00 0.00 H TER 57889 WAT 2052 ATOM 57889 O WAT 2053 74.080 94.944 65.166 1.00 0.00 O ATOM 57890 H1 WAT 2053 73.396 94.667 64.557 1.00 0.00 H ATOM 57891 H2 WAT 2053 74.314 94.147 65.642 1.00 0.00 H TER 57893 WAT 2053 ATOM 57893 O WAT 2054 12.497 76.558 83.068 1.00 0.00 O ATOM 57894 H1 WAT 2054 13.200 76.819 83.662 1.00 0.00 H ATOM 57895 H2 WAT 2054 11.912 77.315 83.040 1.00 0.00 H TER 57897 WAT 2054 ATOM 57897 O WAT 2055 55.211 94.621 63.870 1.00 0.00 O ATOM 57898 H1 WAT 2055 54.882 94.991 63.050 1.00 0.00 H ATOM 57899 H2 WAT 2055 54.626 93.886 64.053 1.00 0.00 H TER 57901 WAT 2055 ATOM 57901 O WAT 2056 23.914 117.263 111.216 1.00 0.00 O ATOM 57902 H1 WAT 2056 23.894 117.785 110.414 1.00 0.00 H ATOM 57903 H2 WAT 2056 24.387 117.809 111.845 1.00 0.00 H TER 57905 WAT 2056 ATOM 57905 O WAT 2057 40.390 137.301 108.414 1.00 0.00 O ATOM 57906 H1 WAT 2057 40.485 138.243 108.555 1.00 0.00 H ATOM 57907 H2 WAT 2057 40.611 136.909 109.259 1.00 0.00 H TER 57909 WAT 2057 ATOM 57909 O WAT 2058 108.270 130.025 94.456 1.00 0.00 O ATOM 57910 H1 WAT 2058 109.096 129.653 94.146 1.00 0.00 H ATOM 57911 H2 WAT 2058 108.487 130.927 94.691 1.00 0.00 H TER 57913 WAT 2058 ATOM 57913 O WAT 2059 126.187 56.701 78.234 1.00 0.00 O ATOM 57914 H1 WAT 2059 125.575 57.066 78.873 1.00 0.00 H ATOM 57915 H2 WAT 2059 125.700 56.698 77.410 1.00 0.00 H TER 57917 WAT 2059 ATOM 57917 O WAT 2060 108.194 51.258 90.919 1.00 0.00 O ATOM 57918 H1 WAT 2060 108.934 50.846 91.366 1.00 0.00 H ATOM 57919 H2 WAT 2060 108.409 51.190 89.989 1.00 0.00 H TER 57921 WAT 2060 ATOM 57921 O WAT 2061 112.277 69.509 67.554 1.00 0.00 O ATOM 57922 H1 WAT 2061 112.755 69.531 68.383 1.00 0.00 H ATOM 57923 H2 WAT 2061 111.594 70.172 67.654 1.00 0.00 H TER 57925 WAT 2061 ATOM 57925 O WAT 2062 0.395 143.635 3.258 1.00 0.00 O ATOM 57926 H1 WAT 2062 1.058 144.157 2.807 1.00 0.00 H ATOM 57927 H2 WAT 2062 0.824 142.796 3.426 1.00 0.00 H TER 57929 WAT 2062 ATOM 57929 O WAT 2063 65.466 86.012 131.525 1.00 0.00 O ATOM 57930 H1 WAT 2063 66.061 85.274 131.658 1.00 0.00 H ATOM 57931 H2 WAT 2063 64.593 85.643 131.665 1.00 0.00 H TER 57933 WAT 2063 ATOM 57933 O WAT 2064 79.889 45.612 122.261 1.00 0.00 O ATOM 57934 H1 WAT 2064 79.288 45.281 122.928 1.00 0.00 H ATOM 57935 H2 WAT 2064 79.407 45.524 121.439 1.00 0.00 H TER 57937 WAT 2064 ATOM 57937 O WAT 2065 90.882 94.771 22.550 1.00 0.00 O ATOM 57938 H1 WAT 2065 91.052 95.640 22.913 1.00 0.00 H ATOM 57939 H2 WAT 2065 91.371 94.175 23.117 1.00 0.00 H TER 57941 WAT 2065 ATOM 57941 O WAT 2066 71.313 77.214 154.597 1.00 0.00 O ATOM 57942 H1 WAT 2066 72.269 77.205 154.554 1.00 0.00 H ATOM 57943 H2 WAT 2066 71.110 77.867 155.268 1.00 0.00 H TER 57945 WAT 2066 ATOM 57945 O WAT 2067 106.799 145.139 119.403 1.00 0.00 O ATOM 57946 H1 WAT 2067 107.108 144.402 118.877 1.00 0.00 H ATOM 57947 H2 WAT 2067 107.505 145.300 120.028 1.00 0.00 H TER 57949 WAT 2067 ATOM 57949 O WAT 2068 42.239 119.106 112.834 1.00 0.00 O ATOM 57950 H1 WAT 2068 42.135 119.668 112.066 1.00 0.00 H ATOM 57951 H2 WAT 2068 41.469 118.538 112.821 1.00 0.00 H TER 57953 WAT 2068 ATOM 57953 O WAT 2069 85.291 95.569 140.454 1.00 0.00 O ATOM 57954 H1 WAT 2069 84.810 94.995 141.050 1.00 0.00 H ATOM 57955 H2 WAT 2069 85.789 96.150 141.029 1.00 0.00 H TER 57957 WAT 2069 ATOM 57957 O WAT 2070 109.053 104.168 150.932 1.00 0.00 O ATOM 57958 H1 WAT 2070 109.025 104.157 151.888 1.00 0.00 H ATOM 57959 H2 WAT 2070 108.312 103.623 150.664 1.00 0.00 H TER 57961 WAT 2070 ATOM 57961 O WAT 2071 47.577 103.605 84.803 1.00 0.00 O ATOM 57962 H1 WAT 2071 47.213 103.782 85.670 1.00 0.00 H ATOM 57963 H2 WAT 2071 47.411 102.674 84.658 1.00 0.00 H TER 57965 WAT 2071 ATOM 57965 O WAT 2072 119.697 43.101 94.513 1.00 0.00 O ATOM 57966 H1 WAT 2072 118.859 42.648 94.418 1.00 0.00 H ATOM 57967 H2 WAT 2072 119.675 43.788 93.847 1.00 0.00 H TER 57969 WAT 2072 ATOM 57969 O WAT 2073 52.892 85.092 147.908 1.00 0.00 O ATOM 57970 H1 WAT 2073 52.488 85.363 148.733 1.00 0.00 H ATOM 57971 H2 WAT 2073 52.994 84.144 147.992 1.00 0.00 H TER 57973 WAT 2073 ATOM 57973 O WAT 2074 127.416 23.110 94.808 1.00 0.00 O ATOM 57974 H1 WAT 2074 126.739 22.435 94.864 1.00 0.00 H ATOM 57975 H2 WAT 2074 127.008 23.818 94.309 1.00 0.00 H TER 57977 WAT 2074 ATOM 57977 O WAT 2075 16.211 90.882 150.823 1.00 0.00 O ATOM 57978 H1 WAT 2075 15.751 91.218 150.054 1.00 0.00 H ATOM 57979 H2 WAT 2075 16.220 89.932 150.701 1.00 0.00 H TER 57981 WAT 2075 ATOM 57981 O WAT 2076 74.545 102.127 109.025 1.00 0.00 O ATOM 57982 H1 WAT 2076 74.587 102.870 108.422 1.00 0.00 H ATOM 57983 H2 WAT 2076 75.454 101.841 109.116 1.00 0.00 H TER 57985 WAT 2076 ATOM 57985 O WAT 2077 93.354 77.756 101.002 1.00 0.00 O ATOM 57986 H1 WAT 2077 93.632 78.664 100.887 1.00 0.00 H ATOM 57987 H2 WAT 2077 94.005 77.243 100.522 1.00 0.00 H TER 57989 WAT 2077 ATOM 57989 O WAT 2078 6.877 136.244 148.945 1.00 0.00 O ATOM 57990 H1 WAT 2078 6.709 136.351 149.881 1.00 0.00 H ATOM 57991 H2 WAT 2078 7.419 135.457 148.887 1.00 0.00 H TER 57993 WAT 2078 ATOM 57993 O WAT 2079 7.406 63.288 76.363 1.00 0.00 O ATOM 57994 H1 WAT 2079 6.493 63.009 76.295 1.00 0.00 H ATOM 57995 H2 WAT 2079 7.482 63.648 77.247 1.00 0.00 H TER 57997 WAT 2079 ATOM 57997 O WAT 2080 80.081 21.223 153.853 1.00 0.00 O ATOM 57998 H1 WAT 2080 80.822 21.533 153.332 1.00 0.00 H ATOM 57999 H2 WAT 2080 80.089 21.777 154.634 1.00 0.00 H TER 58001 WAT 2080 ATOM 58001 O WAT 2081 29.985 105.847 3.513 1.00 0.00 O ATOM 58002 H1 WAT 2081 29.771 105.229 2.815 1.00 0.00 H ATOM 58003 H2 WAT 2081 30.728 106.346 3.172 1.00 0.00 H TER 58005 WAT 2081 ATOM 58005 O WAT 2082 53.447 117.961 76.023 1.00 0.00 O ATOM 58006 H1 WAT 2082 52.967 117.249 75.600 1.00 0.00 H ATOM 58007 H2 WAT 2082 53.667 118.559 75.308 1.00 0.00 H TER 58009 WAT 2082 ATOM 58009 O WAT 2083 17.277 70.326 74.680 1.00 0.00 O ATOM 58010 H1 WAT 2083 17.687 70.130 75.522 1.00 0.00 H ATOM 58011 H2 WAT 2083 17.963 70.763 74.175 1.00 0.00 H TER 58013 WAT 2083 ATOM 58013 O WAT 2084 108.739 17.131 111.701 1.00 0.00 O ATOM 58014 H1 WAT 2084 109.589 17.321 112.097 1.00 0.00 H ATOM 58015 H2 WAT 2084 108.918 16.430 111.074 1.00 0.00 H TER 58017 WAT 2084 ATOM 58017 O WAT 2085 43.736 112.777 82.580 1.00 0.00 O ATOM 58018 H1 WAT 2085 44.094 111.968 82.215 1.00 0.00 H ATOM 58019 H2 WAT 2085 44.221 113.474 82.138 1.00 0.00 H TER 58021 WAT 2085 ATOM 58021 O WAT 2086 88.518 22.855 142.752 1.00 0.00 O ATOM 58022 H1 WAT 2086 89.290 23.399 142.906 1.00 0.00 H ATOM 58023 H2 WAT 2086 87.965 23.382 142.175 1.00 0.00 H TER 58025 WAT 2086 ATOM 58025 O WAT 2087 64.699 119.108 157.938 1.00 0.00 O ATOM 58026 H1 WAT 2087 64.744 119.596 158.760 1.00 0.00 H ATOM 58027 H2 WAT 2087 64.300 118.271 158.178 1.00 0.00 H TER 58029 WAT 2087 ATOM 58029 O WAT 2088 40.773 110.407 146.802 1.00 0.00 O ATOM 58030 H1 WAT 2088 40.717 110.653 147.725 1.00 0.00 H ATOM 58031 H2 WAT 2088 40.835 109.452 146.812 1.00 0.00 H TER 58033 WAT 2088 ATOM 58033 O WAT 2089 138.339 29.719 145.265 1.00 0.00 O ATOM 58034 H1 WAT 2089 139.009 30.211 144.791 1.00 0.00 H ATOM 58035 H2 WAT 2089 138.661 28.818 145.270 1.00 0.00 H TER 58037 WAT 2089 ATOM 58037 O WAT 2090 6.586 7.243 97.627 1.00 0.00 O ATOM 58038 H1 WAT 2090 6.798 8.064 97.183 1.00 0.00 H ATOM 58039 H2 WAT 2090 6.154 7.514 98.437 1.00 0.00 H TER 58041 WAT 2090 ATOM 58041 O WAT 2091 73.840 2.247 25.690 1.00 0.00 O ATOM 58042 H1 WAT 2091 73.861 2.963 26.326 1.00 0.00 H ATOM 58043 H2 WAT 2091 74.249 1.511 26.145 1.00 0.00 H TER 58045 WAT 2091 ATOM 58045 O WAT 2092 129.562 98.496 3.075 1.00 0.00 O ATOM 58046 H1 WAT 2092 130.244 98.575 2.407 1.00 0.00 H ATOM 58047 H2 WAT 2092 128.820 98.986 2.720 1.00 0.00 H TER 58049 WAT 2092 ATOM 58049 O WAT 2093 131.619 10.511 81.121 1.00 0.00 O ATOM 58050 H1 WAT 2093 131.173 11.067 81.760 1.00 0.00 H ATOM 58051 H2 WAT 2093 131.625 9.642 81.523 1.00 0.00 H TER 58053 WAT 2093 ATOM 58053 O WAT 2094 18.711 64.671 143.341 1.00 0.00 O ATOM 58054 H1 WAT 2094 19.538 65.051 143.045 1.00 0.00 H ATOM 58055 H2 WAT 2094 18.788 64.642 144.294 1.00 0.00 H TER 58057 WAT 2094 ATOM 58057 O WAT 2095 86.089 90.633 118.980 1.00 0.00 O ATOM 58058 H1 WAT 2095 86.868 90.929 118.508 1.00 0.00 H ATOM 58059 H2 WAT 2095 85.355 90.928 118.440 1.00 0.00 H TER 58061 WAT 2095 ATOM 58061 O WAT 2096 137.021 122.285 111.490 1.00 0.00 O ATOM 58062 H1 WAT 2096 137.573 121.624 111.072 1.00 0.00 H ATOM 58063 H2 WAT 2096 136.331 121.781 111.922 1.00 0.00 H TER 58065 WAT 2096 ATOM 58065 O WAT 2097 102.804 31.025 148.261 1.00 0.00 O ATOM 58066 H1 WAT 2097 103.734 30.968 148.480 1.00 0.00 H ATOM 58067 H2 WAT 2097 102.390 30.345 148.792 1.00 0.00 H TER 58069 WAT 2097 ATOM 58069 O WAT 2098 40.672 138.957 82.632 1.00 0.00 O ATOM 58070 H1 WAT 2098 41.144 138.141 82.466 1.00 0.00 H ATOM 58071 H2 WAT 2098 39.985 138.976 81.965 1.00 0.00 H TER 58073 WAT 2098 ATOM 58073 O WAT 2099 88.906 26.060 107.040 1.00 0.00 O ATOM 58074 H1 WAT 2099 89.712 25.543 107.057 1.00 0.00 H ATOM 58075 H2 WAT 2099 88.207 25.418 107.165 1.00 0.00 H TER 58077 WAT 2099 ATOM 58077 O WAT 2100 105.403 39.082 100.934 1.00 0.00 O ATOM 58078 H1 WAT 2100 106.102 39.067 100.280 1.00 0.00 H ATOM 58079 H2 WAT 2100 104.995 39.941 100.827 1.00 0.00 H TER 58081 WAT 2100 ATOM 58081 O WAT 2101 34.358 65.729 113.351 1.00 0.00 O ATOM 58082 H1 WAT 2101 34.874 65.554 114.138 1.00 0.00 H ATOM 58083 H2 WAT 2101 33.776 66.447 113.601 1.00 0.00 H TER 58085 WAT 2101 ATOM 58085 O WAT 2102 113.380 134.520 99.064 1.00 0.00 O ATOM 58086 H1 WAT 2102 113.676 134.587 99.972 1.00 0.00 H ATOM 58087 H2 WAT 2102 114.171 134.304 98.569 1.00 0.00 H TER 58089 WAT 2102 ATOM 58089 O WAT 2103 132.707 112.213 152.898 1.00 0.00 O ATOM 58090 H1 WAT 2103 132.315 112.055 153.757 1.00 0.00 H ATOM 58091 H2 WAT 2103 132.163 111.711 152.291 1.00 0.00 H TER 58093 WAT 2103 ATOM 58093 O WAT 2104 123.779 25.996 87.143 1.00 0.00 O ATOM 58094 H1 WAT 2104 124.641 25.623 87.324 1.00 0.00 H ATOM 58095 H2 WAT 2104 123.162 25.354 87.492 1.00 0.00 H TER 58097 WAT 2104 ATOM 58097 O WAT 2105 133.674 45.901 10.486 1.00 0.00 O ATOM 58098 H1 WAT 2105 132.804 46.275 10.346 1.00 0.00 H ATOM 58099 H2 WAT 2105 134.050 46.426 11.192 1.00 0.00 H TER 58101 WAT 2105 ATOM 58101 O WAT 2106 106.637 0.369 63.201 1.00 0.00 O ATOM 58102 H1 WAT 2106 106.032 1.078 62.985 1.00 0.00 H ATOM 58103 H2 WAT 2106 107.282 0.380 62.494 1.00 0.00 H TER 58105 WAT 2106 ATOM 58105 O WAT 2107 92.951 65.274 140.727 1.00 0.00 O ATOM 58106 H1 WAT 2107 93.456 66.023 141.044 1.00 0.00 H ATOM 58107 H2 WAT 2107 93.459 64.939 139.987 1.00 0.00 H TER 58109 WAT 2107 ATOM 58109 O WAT 2108 30.441 121.679 1.809 1.00 0.00 O ATOM 58110 H1 WAT 2108 31.022 122.056 1.148 1.00 0.00 H ATOM 58111 H2 WAT 2108 30.517 120.733 1.683 1.00 0.00 H TER 58113 WAT 2108 ATOM 58113 O WAT 2109 87.460 79.692 120.428 1.00 0.00 O ATOM 58114 H1 WAT 2109 88.139 80.217 120.852 1.00 0.00 H ATOM 58115 H2 WAT 2109 87.117 80.258 119.737 1.00 0.00 H TER 58117 WAT 2109 ATOM 58117 O WAT 2110 46.873 85.724 98.942 1.00 0.00 O ATOM 58118 H1 WAT 2110 47.016 84.777 98.935 1.00 0.00 H ATOM 58119 H2 WAT 2110 46.338 85.891 98.166 1.00 0.00 H TER 58121 WAT 2110 ATOM 58121 O WAT 2111 47.953 106.711 141.078 1.00 0.00 O ATOM 58122 H1 WAT 2111 47.199 107.103 140.639 1.00 0.00 H ATOM 58123 H2 WAT 2111 47.583 106.001 141.603 1.00 0.00 H TER 58125 WAT 2111 ATOM 58125 O WAT 2112 109.175 6.093 152.979 1.00 0.00 O ATOM 58126 H1 WAT 2112 108.972 7.025 152.910 1.00 0.00 H ATOM 58127 H2 WAT 2112 108.761 5.817 153.796 1.00 0.00 H TER 58129 WAT 2112 ATOM 58129 O WAT 2113 35.562 100.073 108.486 1.00 0.00 O ATOM 58130 H1 WAT 2113 35.665 99.245 108.017 1.00 0.00 H ATOM 58131 H2 WAT 2113 35.167 99.826 109.322 1.00 0.00 H TER 58133 WAT 2113 ATOM 58133 O WAT 2114 111.711 31.181 4.983 1.00 0.00 O ATOM 58134 H1 WAT 2114 112.479 31.340 4.434 1.00 0.00 H ATOM 58135 H2 WAT 2114 111.377 30.334 4.688 1.00 0.00 H TER 58137 WAT 2114 ATOM 58137 O WAT 2115 87.687 70.082 121.351 1.00 0.00 O ATOM 58138 H1 WAT 2115 87.043 69.694 121.944 1.00 0.00 H ATOM 58139 H2 WAT 2115 87.456 71.010 121.321 1.00 0.00 H TER 58141 WAT 2115 ATOM 58141 O WAT 2116 45.973 82.285 137.754 1.00 0.00 O ATOM 58142 H1 WAT 2116 45.423 83.058 137.633 1.00 0.00 H ATOM 58143 H2 WAT 2116 45.894 82.079 138.686 1.00 0.00 H TER 58145 WAT 2116 ATOM 58145 O WAT 2117 26.220 123.464 139.138 1.00 0.00 O ATOM 58146 H1 WAT 2117 26.684 123.905 139.851 1.00 0.00 H ATOM 58147 H2 WAT 2117 25.589 122.896 139.579 1.00 0.00 H TER 58149 WAT 2117 ATOM 58149 O WAT 2118 88.412 37.488 0.487 1.00 0.00 O ATOM 58150 H1 WAT 2118 89.366 37.450 0.545 1.00 0.00 H ATOM 58151 H2 WAT 2118 88.115 36.672 0.890 1.00 0.00 H TER 58153 WAT 2118 ATOM 58153 O WAT 2119 108.172 138.503 15.486 1.00 0.00 O ATOM 58154 H1 WAT 2119 107.956 138.072 16.313 1.00 0.00 H ATOM 58155 H2 WAT 2119 108.109 139.438 15.680 1.00 0.00 H TER 58157 WAT 2119 ATOM 58157 O WAT 2120 103.483 23.748 132.879 1.00 0.00 O ATOM 58158 H1 WAT 2120 103.465 24.267 132.074 1.00 0.00 H ATOM 58159 H2 WAT 2120 102.566 23.530 133.044 1.00 0.00 H TER 58161 WAT 2120 ATOM 58161 O WAT 2121 98.836 62.100 14.968 1.00 0.00 O ATOM 58162 H1 WAT 2121 98.742 61.272 14.498 1.00 0.00 H ATOM 58163 H2 WAT 2121 98.563 61.900 15.863 1.00 0.00 H TER 58165 WAT 2121 ATOM 58165 O WAT 2122 74.840 30.689 88.026 1.00 0.00 O ATOM 58166 H1 WAT 2122 74.875 30.081 87.287 1.00 0.00 H ATOM 58167 H2 WAT 2122 74.914 31.555 87.627 1.00 0.00 H TER 58169 WAT 2122 ATOM 58169 O WAT 2123 8.433 32.761 94.213 1.00 0.00 O ATOM 58170 H1 WAT 2123 8.861 32.687 93.360 1.00 0.00 H ATOM 58171 H2 WAT 2123 9.105 33.126 94.788 1.00 0.00 H TER 58173 WAT 2123 ATOM 58173 O WAT 2124 55.722 58.249 89.177 1.00 0.00 O ATOM 58174 H1 WAT 2124 56.242 58.589 88.449 1.00 0.00 H ATOM 58175 H2 WAT 2124 55.628 58.992 89.772 1.00 0.00 H TER 58177 WAT 2124 ATOM 58177 O WAT 2125 25.884 83.024 118.852 1.00 0.00 O ATOM 58178 H1 WAT 2125 25.690 83.108 119.785 1.00 0.00 H ATOM 58179 H2 WAT 2125 25.083 83.313 118.414 1.00 0.00 H TER 58181 WAT 2125 ATOM 58181 O WAT 2126 55.377 13.076 107.648 1.00 0.00 O ATOM 58182 H1 WAT 2126 56.002 13.026 106.924 1.00 0.00 H ATOM 58183 H2 WAT 2126 55.902 13.356 108.398 1.00 0.00 H TER 58185 WAT 2126 ATOM 58185 O WAT 2127 63.811 117.608 1.899 1.00 0.00 O ATOM 58186 H1 WAT 2127 64.756 117.621 1.748 1.00 0.00 H ATOM 58187 H2 WAT 2127 63.599 118.501 2.168 1.00 0.00 H TER 58189 WAT 2127 ATOM 58189 O WAT 2128 87.257 62.113 68.522 1.00 0.00 O ATOM 58190 H1 WAT 2128 87.160 61.169 68.648 1.00 0.00 H ATOM 58191 H2 WAT 2128 88.175 62.289 68.728 1.00 0.00 H TER 58193 WAT 2128 ATOM 58193 O WAT 2129 97.789 40.574 155.888 1.00 0.00 O ATOM 58194 H1 WAT 2129 98.655 40.199 155.729 1.00 0.00 H ATOM 58195 H2 WAT 2129 97.673 41.213 155.186 1.00 0.00 H TER 58197 WAT 2129 ATOM 58197 O WAT 2130 1.996 102.904 71.594 1.00 0.00 O ATOM 58198 H1 WAT 2130 2.047 102.794 70.644 1.00 0.00 H ATOM 58199 H2 WAT 2130 1.151 103.330 71.740 1.00 0.00 H TER 58201 WAT 2130 ATOM 58201 O WAT 2131 12.434 60.043 62.971 1.00 0.00 O ATOM 58202 H1 WAT 2131 11.721 59.416 62.848 1.00 0.00 H ATOM 58203 H2 WAT 2131 13.228 59.540 62.787 1.00 0.00 H TER 58205 WAT 2131 ATOM 58205 O WAT 2132 56.453 98.446 112.355 1.00 0.00 O ATOM 58206 H1 WAT 2132 56.553 97.891 111.582 1.00 0.00 H ATOM 58207 H2 WAT 2132 56.184 99.296 112.007 1.00 0.00 H TER 58209 WAT 2132 ATOM 58209 O WAT 2133 124.662 134.513 155.041 1.00 0.00 O ATOM 58210 H1 WAT 2133 125.161 135.204 155.477 1.00 0.00 H ATOM 58211 H2 WAT 2133 124.445 134.879 154.184 1.00 0.00 H TER 58213 WAT 2133 ATOM 58213 O WAT 2134 38.933 28.065 91.578 1.00 0.00 O ATOM 58214 H1 WAT 2134 38.861 28.672 92.315 1.00 0.00 H ATOM 58215 H2 WAT 2134 38.299 28.389 90.939 1.00 0.00 H TER 58217 WAT 2134 ATOM 58217 O WAT 2135 55.211 58.119 154.415 1.00 0.00 O ATOM 58218 H1 WAT 2135 55.978 57.615 154.687 1.00 0.00 H ATOM 58219 H2 WAT 2135 55.417 59.021 154.661 1.00 0.00 H TER 58221 WAT 2135 ATOM 58221 O WAT 2136 132.213 89.461 74.934 1.00 0.00 O ATOM 58222 H1 WAT 2136 131.770 88.618 75.039 1.00 0.00 H ATOM 58223 H2 WAT 2136 132.655 89.395 74.088 1.00 0.00 H TER 58225 WAT 2136 ATOM 58225 O WAT 2137 69.451 64.420 13.696 1.00 0.00 O ATOM 58226 H1 WAT 2137 69.356 63.477 13.830 1.00 0.00 H ATOM 58227 H2 WAT 2137 69.577 64.517 12.752 1.00 0.00 H TER 58229 WAT 2137 ATOM 58229 O WAT 2138 104.635 141.413 91.761 1.00 0.00 O ATOM 58230 H1 WAT 2138 104.839 140.575 91.345 1.00 0.00 H ATOM 58231 H2 WAT 2138 104.046 141.186 92.480 1.00 0.00 H TER 58233 WAT 2138 ATOM 58233 O WAT 2139 133.287 2.614 16.903 1.00 0.00 O ATOM 58234 H1 WAT 2139 133.465 3.398 17.424 1.00 0.00 H ATOM 58235 H2 WAT 2139 132.332 2.563 16.865 1.00 0.00 H TER 58237 WAT 2139 ATOM 58237 O WAT 2140 50.153 146.079 132.340 1.00 0.00 O ATOM 58238 H1 WAT 2140 50.600 146.061 131.494 1.00 0.00 H ATOM 58239 H2 WAT 2140 50.196 145.175 132.652 1.00 0.00 H TER 58241 WAT 2140 ATOM 58241 O WAT 2141 39.817 65.896 135.351 1.00 0.00 O ATOM 58242 H1 WAT 2141 40.490 65.543 135.933 1.00 0.00 H ATOM 58243 H2 WAT 2141 39.011 65.857 135.866 1.00 0.00 H TER 58245 WAT 2141 ATOM 58245 O WAT 2142 32.007 122.111 128.830 1.00 0.00 O ATOM 58246 H1 WAT 2142 31.955 123.040 129.057 1.00 0.00 H ATOM 58247 H2 WAT 2142 32.809 121.805 129.253 1.00 0.00 H TER 58249 WAT 2142 ATOM 58249 O WAT 2143 19.478 69.766 80.025 1.00 0.00 O ATOM 58250 H1 WAT 2143 18.990 70.576 80.170 1.00 0.00 H ATOM 58251 H2 WAT 2143 20.390 70.001 80.199 1.00 0.00 H TER 58253 WAT 2143 ATOM 58253 O WAT 2144 127.338 47.660 10.454 1.00 0.00 O ATOM 58254 H1 WAT 2144 126.859 47.189 9.772 1.00 0.00 H ATOM 58255 H2 WAT 2144 127.900 46.996 10.854 1.00 0.00 H TER 58257 WAT 2144 ATOM 58257 O WAT 2145 5.884 78.656 139.856 1.00 0.00 O ATOM 58258 H1 WAT 2145 6.278 79.275 140.471 1.00 0.00 H ATOM 58259 H2 WAT 2145 4.950 78.865 139.872 1.00 0.00 H TER 58261 WAT 2145 ATOM 58261 O WAT 2146 104.356 18.021 104.012 1.00 0.00 O ATOM 58262 H1 WAT 2146 105.073 18.571 104.329 1.00 0.00 H ATOM 58263 H2 WAT 2146 104.740 17.517 103.294 1.00 0.00 H TER 58265 WAT 2146 ATOM 58265 O WAT 2147 67.085 98.256 109.824 1.00 0.00 O ATOM 58266 H1 WAT 2147 66.485 97.561 110.095 1.00 0.00 H ATOM 58267 H2 WAT 2147 67.588 98.458 110.613 1.00 0.00 H TER 58269 WAT 2147 ATOM 58269 O WAT 2148 3.090 129.355 133.051 1.00 0.00 O ATOM 58270 H1 WAT 2148 4.028 129.207 133.169 1.00 0.00 H ATOM 58271 H2 WAT 2148 2.673 128.752 133.666 1.00 0.00 H TER 58273 WAT 2148 ATOM 58273 O WAT 2149 105.350 129.949 135.820 1.00 0.00 O ATOM 58274 H1 WAT 2149 105.394 130.805 136.247 1.00 0.00 H ATOM 58275 H2 WAT 2149 105.903 130.041 135.044 1.00 0.00 H TER 58277 WAT 2149 ATOM 58277 O WAT 2150 130.220 97.215 116.203 1.00 0.00 O ATOM 58278 H1 WAT 2150 129.608 96.638 115.746 1.00 0.00 H ATOM 58279 H2 WAT 2150 129.660 97.811 116.701 1.00 0.00 H TER 58281 WAT 2150 ATOM 58281 O WAT 2151 97.612 137.754 121.796 1.00 0.00 O ATOM 58282 H1 WAT 2151 97.889 136.877 122.061 1.00 0.00 H ATOM 58283 H2 WAT 2151 96.994 138.025 122.475 1.00 0.00 H TER 58285 WAT 2151 ATOM 58285 O WAT 2152 32.525 26.518 111.316 1.00 0.00 O ATOM 58286 H1 WAT 2152 32.788 25.621 111.111 1.00 0.00 H ATOM 58287 H2 WAT 2152 33.182 26.822 111.943 1.00 0.00 H TER 58289 WAT 2152 ATOM 58289 O WAT 2153 137.243 20.785 104.382 1.00 0.00 O ATOM 58290 H1 WAT 2153 136.884 20.621 103.510 1.00 0.00 H ATOM 58291 H2 WAT 2153 137.357 21.735 104.419 1.00 0.00 H TER 58293 WAT 2153 ATOM 58293 O WAT 2154 87.252 99.582 77.296 1.00 0.00 O ATOM 58294 H1 WAT 2154 87.506 98.662 77.225 1.00 0.00 H ATOM 58295 H2 WAT 2154 86.312 99.558 77.475 1.00 0.00 H TER 58297 WAT 2154 ATOM 58297 O WAT 2155 33.202 8.626 120.559 1.00 0.00 O ATOM 58298 H1 WAT 2155 33.674 8.283 119.799 1.00 0.00 H ATOM 58299 H2 WAT 2155 32.523 9.188 120.185 1.00 0.00 H TER 58301 WAT 2155 ATOM 58301 O WAT 2156 64.854 48.191 59.934 1.00 0.00 O ATOM 58302 H1 WAT 2156 64.666 48.879 59.296 1.00 0.00 H ATOM 58303 H2 WAT 2156 65.532 47.658 59.520 1.00 0.00 H TER 58305 WAT 2156 ATOM 58305 O WAT 2157 106.580 111.090 133.077 1.00 0.00 O ATOM 58306 H1 WAT 2157 107.169 110.362 132.881 1.00 0.00 H ATOM 58307 H2 WAT 2157 106.139 110.831 133.886 1.00 0.00 H TER 58309 WAT 2157 ATOM 58309 O WAT 2158 125.322 30.478 65.472 1.00 0.00 O ATOM 58310 H1 WAT 2158 125.280 31.420 65.637 1.00 0.00 H ATOM 58311 H2 WAT 2158 126.017 30.379 64.821 1.00 0.00 H TER 58313 WAT 2158 ATOM 58313 O WAT 2159 136.517 60.499 16.275 1.00 0.00 O ATOM 58314 H1 WAT 2159 136.838 60.468 17.176 1.00 0.00 H ATOM 58315 H2 WAT 2159 136.145 61.376 16.184 1.00 0.00 H TER 58317 WAT 2159 ATOM 58317 O WAT 2160 76.166 127.737 109.308 1.00 0.00 O ATOM 58318 H1 WAT 2160 76.594 128.130 110.069 1.00 0.00 H ATOM 58319 H2 WAT 2160 75.492 128.370 109.060 1.00 0.00 H TER 58321 WAT 2160 ATOM 58321 O WAT 2161 88.905 140.450 128.263 1.00 0.00 O ATOM 58322 H1 WAT 2161 87.996 140.150 128.249 1.00 0.00 H ATOM 58323 H2 WAT 2161 88.974 141.040 127.513 1.00 0.00 H TER 58325 WAT 2161 ATOM 58325 O WAT 2162 43.037 63.770 149.692 1.00 0.00 O ATOM 58326 H1 WAT 2162 43.422 63.634 148.826 1.00 0.00 H ATOM 58327 H2 WAT 2162 42.507 64.562 149.596 1.00 0.00 H TER 58329 WAT 2162 ATOM 58329 O WAT 2163 11.528 35.027 101.731 1.00 0.00 O ATOM 58330 H1 WAT 2163 12.409 34.678 101.863 1.00 0.00 H ATOM 58331 H2 WAT 2163 10.956 34.418 102.198 1.00 0.00 H TER 58333 WAT 2163 ATOM 58333 O WAT 2164 79.810 132.850 123.129 1.00 0.00 O ATOM 58334 H1 WAT 2164 80.196 132.539 122.310 1.00 0.00 H ATOM 58335 H2 WAT 2164 80.542 132.873 123.745 1.00 0.00 H TER 58337 WAT 2164 ATOM 58337 O WAT 2165 43.409 128.076 19.753 1.00 0.00 O ATOM 58338 H1 WAT 2165 42.614 127.598 19.517 1.00 0.00 H ATOM 58339 H2 WAT 2165 43.147 128.997 19.744 1.00 0.00 H TER 58341 WAT 2165 ATOM 58341 O WAT 2166 78.315 63.498 131.144 1.00 0.00 O ATOM 58342 H1 WAT 2166 78.651 64.359 131.392 1.00 0.00 H ATOM 58343 H2 WAT 2166 79.075 62.919 131.202 1.00 0.00 H TER 58345 WAT 2166 ATOM 58345 O WAT 2167 9.227 15.784 1.317 1.00 0.00 O ATOM 58346 H1 WAT 2167 9.433 16.627 1.720 1.00 0.00 H ATOM 58347 H2 WAT 2167 8.523 15.980 0.699 1.00 0.00 H TER 58349 WAT 2167 ATOM 58349 O WAT 2168 3.660 4.796 138.876 1.00 0.00 O ATOM 58350 H1 WAT 2168 3.472 4.841 137.938 1.00 0.00 H ATOM 58351 H2 WAT 2168 3.004 5.365 139.279 1.00 0.00 H TER 58353 WAT 2168 ATOM 58353 O WAT 2169 69.917 3.429 96.893 1.00 0.00 O ATOM 58354 H1 WAT 2169 70.261 4.025 97.558 1.00 0.00 H ATOM 58355 H2 WAT 2169 69.009 3.276 97.155 1.00 0.00 H TER 58357 WAT 2169 ATOM 58357 O WAT 2170 126.394 132.428 91.927 1.00 0.00 O ATOM 58358 H1 WAT 2170 125.880 132.324 92.728 1.00 0.00 H ATOM 58359 H2 WAT 2170 127.134 132.976 92.187 1.00 0.00 H TER 58361 WAT 2170 ATOM 58361 O WAT 2171 52.549 16.650 156.361 1.00 0.00 O ATOM 58362 H1 WAT 2171 51.638 16.456 156.580 1.00 0.00 H ATOM 58363 H2 WAT 2171 53.000 15.810 156.445 1.00 0.00 H TER 58365 WAT 2171 ATOM 58365 O WAT 2172 57.288 46.951 129.295 1.00 0.00 O ATOM 58366 H1 WAT 2172 57.384 46.522 130.145 1.00 0.00 H ATOM 58367 H2 WAT 2172 57.909 46.497 128.725 1.00 0.00 H TER 58369 WAT 2172 ATOM 58369 O WAT 2173 41.921 136.980 57.349 1.00 0.00 O ATOM 58370 H1 WAT 2173 41.240 137.231 57.974 1.00 0.00 H ATOM 58371 H2 WAT 2173 42.570 136.515 57.877 1.00 0.00 H TER 58373 WAT 2173 ATOM 58373 O WAT 2174 13.788 100.182 100.334 1.00 0.00 O ATOM 58374 H1 WAT 2174 13.327 99.998 99.515 1.00 0.00 H ATOM 58375 H2 WAT 2174 13.159 99.955 101.019 1.00 0.00 H TER 58377 WAT 2174 ATOM 58377 O WAT 2175 38.903 130.178 134.542 1.00 0.00 O ATOM 58378 H1 WAT 2175 38.766 131.008 135.000 1.00 0.00 H ATOM 58379 H2 WAT 2175 39.802 129.930 134.760 1.00 0.00 H TER 58381 WAT 2175 ATOM 58381 O WAT 2176 68.090 78.950 11.663 1.00 0.00 O ATOM 58382 H1 WAT 2176 67.742 78.176 12.106 1.00 0.00 H ATOM 58383 H2 WAT 2176 67.437 79.631 11.823 1.00 0.00 H TER 58385 WAT 2176 ATOM 58385 O WAT 2177 123.343 24.142 150.269 1.00 0.00 O ATOM 58386 H1 WAT 2177 123.512 24.180 149.327 1.00 0.00 H ATOM 58387 H2 WAT 2177 123.987 23.517 150.603 1.00 0.00 H TER 58389 WAT 2177 ATOM 58389 O WAT 2178 90.008 21.429 96.598 1.00 0.00 O ATOM 58390 H1 WAT 2178 89.217 21.093 96.177 1.00 0.00 H ATOM 58391 H2 WAT 2178 89.795 22.336 96.819 1.00 0.00 H TER 58393 WAT 2178 ATOM 58393 O WAT 2179 51.651 13.705 112.201 1.00 0.00 O ATOM 58394 H1 WAT 2179 51.067 14.390 112.527 1.00 0.00 H ATOM 58395 H2 WAT 2179 52.530 14.068 112.306 1.00 0.00 H TER 58397 WAT 2179 ATOM 58397 O WAT 2180 105.347 96.486 89.193 1.00 0.00 O ATOM 58398 H1 WAT 2180 106.230 96.733 88.918 1.00 0.00 H ATOM 58399 H2 WAT 2180 105.036 97.235 89.700 1.00 0.00 H TER 58401 WAT 2180 ATOM 58401 O WAT 2181 29.055 39.080 58.923 1.00 0.00 O ATOM 58402 H1 WAT 2181 28.940 40.025 58.817 1.00 0.00 H ATOM 58403 H2 WAT 2181 28.592 38.698 58.177 1.00 0.00 H TER 58405 WAT 2181 ATOM 58405 O WAT 2182 22.580 42.080 79.783 1.00 0.00 O ATOM 58406 H1 WAT 2182 23.292 41.955 79.156 1.00 0.00 H ATOM 58407 H2 WAT 2182 22.558 41.267 80.286 1.00 0.00 H TER 58409 WAT 2182 ATOM 58409 O WAT 2183 32.522 69.932 137.034 1.00 0.00 O ATOM 58410 H1 WAT 2183 33.082 70.580 137.462 1.00 0.00 H ATOM 58411 H2 WAT 2183 31.663 70.054 137.438 1.00 0.00 H TER 58413 WAT 2183 ATOM 58413 O WAT 2184 62.726 134.686 70.422 1.00 0.00 O ATOM 58414 H1 WAT 2184 63.148 135.174 69.716 1.00 0.00 H ATOM 58415 H2 WAT 2184 62.487 135.353 71.066 1.00 0.00 H TER 58417 WAT 2184 ATOM 58417 O WAT 2185 61.710 99.570 70.239 1.00 0.00 O ATOM 58418 H1 WAT 2185 61.515 98.664 70.000 1.00 0.00 H ATOM 58419 H2 WAT 2185 60.917 100.054 70.007 1.00 0.00 H TER 58421 WAT 2185 ATOM 58421 O WAT 2186 123.000 56.797 134.785 1.00 0.00 O ATOM 58422 H1 WAT 2186 122.295 57.381 135.067 1.00 0.00 H ATOM 58423 H2 WAT 2186 123.803 57.275 134.989 1.00 0.00 H TER 58425 WAT 2186 ATOM 58425 O WAT 2187 17.314 69.915 151.787 1.00 0.00 O ATOM 58426 H1 WAT 2187 16.706 69.324 151.343 1.00 0.00 H ATOM 58427 H2 WAT 2187 17.939 69.335 152.220 1.00 0.00 H TER 58429 WAT 2187 ATOM 58429 O WAT 2188 76.453 102.327 23.843 1.00 0.00 O ATOM 58430 H1 WAT 2188 76.302 101.599 24.446 1.00 0.00 H ATOM 58431 H2 WAT 2188 75.905 103.036 24.180 1.00 0.00 H TER 58433 WAT 2188 ATOM 58433 O WAT 2189 33.452 84.327 147.905 1.00 0.00 O ATOM 58434 H1 WAT 2189 32.548 84.019 147.979 1.00 0.00 H ATOM 58435 H2 WAT 2189 33.378 85.195 147.509 1.00 0.00 H TER 58437 WAT 2189 ATOM 58437 O WAT 2190 39.365 55.358 142.526 1.00 0.00 O ATOM 58438 H1 WAT 2190 39.878 56.128 142.279 1.00 0.00 H ATOM 58439 H2 WAT 2190 39.664 55.144 143.410 1.00 0.00 H TER 58441 WAT 2190 ATOM 58441 O WAT 2191 74.834 95.138 122.430 1.00 0.00 O ATOM 58442 H1 WAT 2191 74.704 95.617 123.248 1.00 0.00 H ATOM 58443 H2 WAT 2191 75.761 94.899 122.436 1.00 0.00 H TER 58445 WAT 2191 ATOM 58445 O WAT 2192 31.789 115.502 58.950 1.00 0.00 O ATOM 58446 H1 WAT 2192 32.678 115.167 59.070 1.00 0.00 H ATOM 58447 H2 WAT 2192 31.230 114.729 59.024 1.00 0.00 H TER 58449 WAT 2192 ATOM 58449 O WAT 2193 85.575 2.329 9.816 1.00 0.00 O ATOM 58450 H1 WAT 2193 84.960 2.818 10.362 1.00 0.00 H ATOM 58451 H2 WAT 2193 85.853 1.596 10.365 1.00 0.00 H TER 58453 WAT 2193 ATOM 58453 O WAT 2194 143.312 113.116 135.780 1.00 0.00 O ATOM 58454 H1 WAT 2194 144.153 112.664 135.846 1.00 0.00 H ATOM 58455 H2 WAT 2194 142.979 112.877 134.915 1.00 0.00 H TER 58457 WAT 2194 ATOM 58457 O WAT 2195 109.796 11.621 66.110 1.00 0.00 O ATOM 58458 H1 WAT 2195 110.655 11.309 65.826 1.00 0.00 H ATOM 58459 H2 WAT 2195 109.596 11.099 66.887 1.00 0.00 H TER 58461 WAT 2195 ATOM 58461 O WAT 2196 118.310 129.103 123.672 1.00 0.00 O ATOM 58462 H1 WAT 2196 119.134 129.070 124.158 1.00 0.00 H ATOM 58463 H2 WAT 2196 118.502 129.656 122.914 1.00 0.00 H TER 58465 WAT 2196 ATOM 58465 O WAT 2197 58.878 30.756 108.261 1.00 0.00 O ATOM 58466 H1 WAT 2197 59.530 30.179 108.658 1.00 0.00 H ATOM 58467 H2 WAT 2197 58.037 30.405 108.555 1.00 0.00 H TER 58469 WAT 2197 ATOM 58469 O WAT 2198 88.968 65.499 128.751 1.00 0.00 O ATOM 58470 H1 WAT 2198 88.034 65.300 128.694 1.00 0.00 H ATOM 58471 H2 WAT 2198 89.198 65.817 127.878 1.00 0.00 H TER 58473 WAT 2198 ATOM 58473 O WAT 2199 65.868 6.528 59.323 1.00 0.00 O ATOM 58474 H1 WAT 2199 66.390 5.770 59.588 1.00 0.00 H ATOM 58475 H2 WAT 2199 66.470 7.066 58.809 1.00 0.00 H TER 58477 WAT 2199 ATOM 58477 O WAT 2200 58.173 64.340 157.475 1.00 0.00 O ATOM 58478 H1 WAT 2200 58.405 64.666 156.606 1.00 0.00 H ATOM 58479 H2 WAT 2200 58.712 64.854 158.076 1.00 0.00 H TER 58481 WAT 2200 ATOM 58481 O WAT 2201 36.414 102.629 16.156 1.00 0.00 O ATOM 58482 H1 WAT 2201 37.335 102.369 16.181 1.00 0.00 H ATOM 58483 H2 WAT 2201 35.956 101.937 16.633 1.00 0.00 H TER 58485 WAT 2201 ATOM 58485 O WAT 2202 8.506 15.779 7.267 1.00 0.00 O ATOM 58486 H1 WAT 2202 7.986 15.757 6.463 1.00 0.00 H ATOM 58487 H2 WAT 2202 8.842 14.888 7.358 1.00 0.00 H TER 58489 WAT 2202 ATOM 58489 O WAT 2203 87.637 44.769 148.911 1.00 0.00 O ATOM 58490 H1 WAT 2203 88.482 44.743 149.358 1.00 0.00 H ATOM 58491 H2 WAT 2203 87.008 44.992 149.597 1.00 0.00 H TER 58493 WAT 2203 ATOM 58493 O WAT 2204 102.374 100.955 142.523 1.00 0.00 O ATOM 58494 H1 WAT 2204 102.308 101.693 143.129 1.00 0.00 H ATOM 58495 H2 WAT 2204 102.612 101.354 141.686 1.00 0.00 H TER 58497 WAT 2204 ATOM 58497 O WAT 2205 127.603 69.766 7.701 1.00 0.00 O ATOM 58498 H1 WAT 2205 127.293 70.220 6.918 1.00 0.00 H ATOM 58499 H2 WAT 2205 128.557 69.830 7.653 1.00 0.00 H TER 58501 WAT 2205 ATOM 58501 O WAT 2206 38.512 134.302 136.509 1.00 0.00 O ATOM 58502 H1 WAT 2206 38.253 134.998 135.906 1.00 0.00 H ATOM 58503 H2 WAT 2206 38.809 134.763 137.294 1.00 0.00 H TER 58505 WAT 2206 ATOM 58505 O WAT 2207 24.807 7.247 77.723 1.00 0.00 O ATOM 58506 H1 WAT 2207 25.313 6.538 78.120 1.00 0.00 H ATOM 58507 H2 WAT 2207 23.894 6.995 77.862 1.00 0.00 H TER 58509 WAT 2207 ATOM 58509 O WAT 2208 5.816 124.573 101.569 1.00 0.00 O ATOM 58510 H1 WAT 2208 6.188 124.937 102.372 1.00 0.00 H ATOM 58511 H2 WAT 2208 5.322 125.297 101.184 1.00 0.00 H TER 58513 WAT 2208 ATOM 58513 O WAT 2209 53.923 79.392 112.751 1.00 0.00 O ATOM 58514 H1 WAT 2209 53.754 80.315 112.939 1.00 0.00 H ATOM 58515 H2 WAT 2209 53.070 78.968 112.847 1.00 0.00 H TER 58517 WAT 2209 ATOM 58517 O WAT 2210 120.196 5.746 128.100 1.00 0.00 O ATOM 58518 H1 WAT 2210 120.728 5.573 128.877 1.00 0.00 H ATOM 58519 H2 WAT 2210 120.004 6.682 128.145 1.00 0.00 H TER 58521 WAT 2210 ATOM 58521 O WAT 2211 41.725 142.269 126.457 1.00 0.00 O ATOM 58522 H1 WAT 2211 40.973 142.305 127.048 1.00 0.00 H ATOM 58523 H2 WAT 2211 41.384 142.574 125.616 1.00 0.00 H TER 58525 WAT 2211 ATOM 58525 O WAT 2212 91.480 132.368 4.634 1.00 0.00 O ATOM 58526 H1 WAT 2212 91.984 131.554 4.640 1.00 0.00 H ATOM 58527 H2 WAT 2212 90.737 132.186 4.059 1.00 0.00 H TER 58529 WAT 2212 ATOM 58529 O WAT 2213 131.818 114.255 120.164 1.00 0.00 O ATOM 58530 H1 WAT 2213 131.566 115.174 120.261 1.00 0.00 H ATOM 58531 H2 WAT 2213 132.268 114.043 120.981 1.00 0.00 H TER 58533 WAT 2213 ATOM 58533 O WAT 2214 97.134 88.994 152.862 1.00 0.00 O ATOM 58534 H1 WAT 2214 97.789 89.616 153.176 1.00 0.00 H ATOM 58535 H2 WAT 2214 96.994 88.400 153.600 1.00 0.00 H TER 58537 WAT 2214 ATOM 58537 O WAT 2215 46.853 142.079 6.752 1.00 0.00 O ATOM 58538 H1 WAT 2215 46.462 142.051 5.879 1.00 0.00 H ATOM 58539 H2 WAT 2215 47.615 141.503 6.691 1.00 0.00 H TER 58541 WAT 2215 ATOM 58541 O WAT 2216 59.846 104.838 56.310 1.00 0.00 O ATOM 58542 H1 WAT 2216 60.780 104.979 56.466 1.00 0.00 H ATOM 58543 H2 WAT 2216 59.815 104.213 55.586 1.00 0.00 H TER 58545 WAT 2216 ATOM 58545 O WAT 2217 51.073 122.849 91.164 1.00 0.00 O ATOM 58546 H1 WAT 2217 50.224 122.808 91.604 1.00 0.00 H ATOM 58547 H2 WAT 2217 51.713 122.792 91.873 1.00 0.00 H TER 58549 WAT 2217 ATOM 58549 O WAT 2218 0.798 113.152 64.229 1.00 0.00 O ATOM 58550 H1 WAT 2218 1.318 112.929 65.001 1.00 0.00 H ATOM 58551 H2 WAT 2218 0.786 112.350 63.707 1.00 0.00 H TER 58553 WAT 2218 ATOM 58553 O WAT 2219 4.843 85.681 69.491 1.00 0.00 O ATOM 58554 H1 WAT 2219 4.911 86.636 69.490 1.00 0.00 H ATOM 58555 H2 WAT 2219 5.742 85.376 69.609 1.00 0.00 H TER 58557 WAT 2219 ATOM 58557 O WAT 2220 90.323 76.498 22.168 1.00 0.00 O ATOM 58558 H1 WAT 2220 90.632 77.404 22.205 1.00 0.00 H ATOM 58559 H2 WAT 2220 89.433 76.535 22.519 1.00 0.00 H TER 58561 WAT 2220 ATOM 58561 O WAT 2221 31.017 46.526 87.365 1.00 0.00 O ATOM 58562 H1 WAT 2221 30.964 46.105 86.507 1.00 0.00 H ATOM 58563 H2 WAT 2221 30.687 47.413 87.217 1.00 0.00 H TER 58565 WAT 2221 ATOM 58565 O WAT 2222 123.753 109.862 143.404 1.00 0.00 O ATOM 58566 H1 WAT 2222 124.663 110.132 143.532 1.00 0.00 H ATOM 58567 H2 WAT 2222 123.630 109.880 142.455 1.00 0.00 H TER 58569 WAT 2222 ATOM 58569 O WAT 2223 50.463 116.652 65.375 1.00 0.00 O ATOM 58570 H1 WAT 2223 51.094 117.261 65.758 1.00 0.00 H ATOM 58571 H2 WAT 2223 50.950 115.834 65.274 1.00 0.00 H TER 58573 WAT 2223 ATOM 58573 O WAT 2224 52.506 106.205 93.818 1.00 0.00 O ATOM 58574 H1 WAT 2224 53.072 106.393 93.069 1.00 0.00 H ATOM 58575 H2 WAT 2224 51.901 105.536 93.499 1.00 0.00 H TER 58577 WAT 2224 ATOM 58577 O WAT 2225 6.726 67.569 100.370 1.00 0.00 O ATOM 58578 H1 WAT 2225 6.261 67.606 99.534 1.00 0.00 H ATOM 58579 H2 WAT 2225 6.814 68.484 100.636 1.00 0.00 H TER 58581 WAT 2225 ATOM 58581 O WAT 2226 138.383 18.114 132.738 1.00 0.00 O ATOM 58582 H1 WAT 2226 137.973 17.758 133.527 1.00 0.00 H ATOM 58583 H2 WAT 2226 137.655 18.257 132.133 1.00 0.00 H TER 58585 WAT 2226 ATOM 58585 O WAT 2227 39.924 3.414 82.415 1.00 0.00 O ATOM 58586 H1 WAT 2227 39.953 2.561 82.849 1.00 0.00 H ATOM 58587 H2 WAT 2227 40.369 4.006 83.021 1.00 0.00 H TER 58589 WAT 2227 ATOM 58589 O WAT 2228 139.017 116.450 108.809 1.00 0.00 O ATOM 58590 H1 WAT 2228 139.786 116.200 108.297 1.00 0.00 H ATOM 58591 H2 WAT 2228 139.367 116.995 109.515 1.00 0.00 H TER 58593 WAT 2228 ATOM 58593 O WAT 2229 43.167 144.247 61.153 1.00 0.00 O ATOM 58594 H1 WAT 2229 43.441 145.106 60.830 1.00 0.00 H ATOM 58595 H2 WAT 2229 42.531 143.941 60.506 1.00 0.00 H TER 58597 WAT 2229 ATOM 58597 O WAT 2230 42.566 29.734 72.591 1.00 0.00 O ATOM 58598 H1 WAT 2230 42.768 28.926 72.119 1.00 0.00 H ATOM 58599 H2 WAT 2230 43.181 30.377 72.240 1.00 0.00 H TER 58601 WAT 2230 ATOM 58601 O WAT 2231 83.385 130.108 152.977 1.00 0.00 O ATOM 58602 H1 WAT 2231 83.290 130.547 152.132 1.00 0.00 H ATOM 58603 H2 WAT 2231 83.785 129.265 152.765 1.00 0.00 H TER 58605 WAT 2231 ATOM 58605 O WAT 2232 96.918 143.710 75.693 1.00 0.00 O ATOM 58606 H1 WAT 2232 97.843 143.817 75.474 1.00 0.00 H ATOM 58607 H2 WAT 2232 96.479 143.627 74.847 1.00 0.00 H TER 58609 WAT 2232 ATOM 58609 O WAT 2233 7.718 43.345 141.484 1.00 0.00 O ATOM 58610 H1 WAT 2233 7.276 42.601 141.894 1.00 0.00 H ATOM 58611 H2 WAT 2233 8.260 43.714 142.181 1.00 0.00 H TER 58613 WAT 2233 ATOM 58613 O WAT 2234 45.837 135.346 21.338 1.00 0.00 O ATOM 58614 H1 WAT 2234 45.866 135.662 20.435 1.00 0.00 H ATOM 58615 H2 WAT 2234 45.570 134.430 21.263 1.00 0.00 H TER 58617 WAT 2234 ATOM 58617 O WAT 2235 64.059 114.992 142.324 1.00 0.00 O ATOM 58618 H1 WAT 2235 63.598 114.354 142.869 1.00 0.00 H ATOM 58619 H2 WAT 2235 64.192 114.542 141.490 1.00 0.00 H TER 58621 WAT 2235 ATOM 58621 O WAT 2236 7.566 76.753 124.354 1.00 0.00 O ATOM 58622 H1 WAT 2236 7.566 76.062 125.016 1.00 0.00 H ATOM 58623 H2 WAT 2236 8.177 77.408 124.691 1.00 0.00 H TER 58625 WAT 2236 ATOM 58625 O WAT 2237 135.063 4.944 125.973 1.00 0.00 O ATOM 58626 H1 WAT 2237 134.817 5.548 125.272 1.00 0.00 H ATOM 58627 H2 WAT 2237 134.289 4.902 126.535 1.00 0.00 H TER 58629 WAT 2237 ATOM 58629 O WAT 2238 22.221 95.145 3.364 1.00 0.00 O ATOM 58630 H1 WAT 2238 21.906 94.500 3.998 1.00 0.00 H ATOM 58631 H2 WAT 2238 23.161 94.978 3.299 1.00 0.00 H TER 58633 WAT 2238 ATOM 58633 O WAT 2239 71.855 1.304 118.119 1.00 0.00 O ATOM 58634 H1 WAT 2239 72.793 1.440 118.252 1.00 0.00 H ATOM 58635 H2 WAT 2239 71.648 0.531 118.645 1.00 0.00 H TER 58637 WAT 2239 ATOM 58637 O WAT 2240 89.346 71.783 100.053 1.00 0.00 O ATOM 58638 H1 WAT 2240 88.632 71.447 100.594 1.00 0.00 H ATOM 58639 H2 WAT 2240 89.011 71.733 99.157 1.00 0.00 H TER 58641 WAT 2240 ATOM 58641 O WAT 2241 43.089 71.827 58.463 1.00 0.00 O ATOM 58642 H1 WAT 2241 42.309 72.117 58.936 1.00 0.00 H ATOM 58643 H2 WAT 2241 43.802 71.921 59.094 1.00 0.00 H TER 58645 WAT 2241 ATOM 58645 O WAT 2242 38.904 14.682 74.052 1.00 0.00 O ATOM 58646 H1 WAT 2242 38.220 14.267 73.526 1.00 0.00 H ATOM 58647 H2 WAT 2242 38.428 15.149 74.739 1.00 0.00 H TER 58649 WAT 2242 ATOM 58649 O WAT 2243 97.243 88.967 118.484 1.00 0.00 O ATOM 58650 H1 WAT 2243 96.847 89.669 119.000 1.00 0.00 H ATOM 58651 H2 WAT 2243 96.793 89.006 117.640 1.00 0.00 H TER 58653 WAT 2243 ATOM 58653 O WAT 2244 130.972 72.189 3.682 1.00 0.00 O ATOM 58654 H1 WAT 2244 130.646 71.289 3.670 1.00 0.00 H ATOM 58655 H2 WAT 2244 131.638 72.212 2.995 1.00 0.00 H TER 58657 WAT 2244 ATOM 58657 O WAT 2245 47.981 1.225 141.171 1.00 0.00 O ATOM 58658 H1 WAT 2245 47.888 0.693 141.961 1.00 0.00 H ATOM 58659 H2 WAT 2245 48.838 0.984 140.819 1.00 0.00 H TER 58661 WAT 2245 ATOM 58661 O WAT 2246 122.928 2.294 81.881 1.00 0.00 O ATOM 58662 H1 WAT 2246 123.100 1.510 81.360 1.00 0.00 H ATOM 58663 H2 WAT 2246 121.990 2.260 82.064 1.00 0.00 H TER 58665 WAT 2246 ATOM 58665 O WAT 2247 56.636 9.357 92.920 1.00 0.00 O ATOM 58666 H1 WAT 2247 56.869 9.028 93.788 1.00 0.00 H ATOM 58667 H2 WAT 2247 56.103 8.661 92.535 1.00 0.00 H TER 58669 WAT 2247 ATOM 58669 O WAT 2248 73.932 124.557 87.626 1.00 0.00 O ATOM 58670 H1 WAT 2248 74.631 125.156 87.364 1.00 0.00 H ATOM 58671 H2 WAT 2248 73.203 124.771 87.044 1.00 0.00 H TER 58673 WAT 2248 ATOM 58673 O WAT 2249 3.636 7.001 123.121 1.00 0.00 O ATOM 58674 H1 WAT 2249 3.721 6.122 123.492 1.00 0.00 H ATOM 58675 H2 WAT 2249 3.719 6.870 122.177 1.00 0.00 H TER 58677 WAT 2249 ATOM 58677 O WAT 2250 74.552 82.762 150.158 1.00 0.00 O ATOM 58678 H1 WAT 2250 74.364 82.885 149.227 1.00 0.00 H ATOM 58679 H2 WAT 2250 73.743 83.018 150.602 1.00 0.00 H TER 58681 WAT 2250 ATOM 58681 O WAT 2251 109.820 9.904 89.019 1.00 0.00 O ATOM 58682 H1 WAT 2251 109.540 9.121 88.545 1.00 0.00 H ATOM 58683 H2 WAT 2251 110.517 10.274 88.478 1.00 0.00 H TER 58685 WAT 2251 ATOM 58685 O WAT 2252 135.026 107.440 78.401 1.00 0.00 O ATOM 58686 H1 WAT 2252 135.271 107.435 77.476 1.00 0.00 H ATOM 58687 H2 WAT 2252 134.174 107.006 78.426 1.00 0.00 H TER 58689 WAT 2252 ATOM 58689 O WAT 2253 43.448 100.624 133.637 1.00 0.00 O ATOM 58690 H1 WAT 2253 44.090 100.765 134.334 1.00 0.00 H ATOM 58691 H2 WAT 2253 43.484 101.424 133.113 1.00 0.00 H TER 58693 WAT 2253 ATOM 58693 O WAT 2254 66.923 119.880 156.214 1.00 0.00 O ATOM 58694 H1 WAT 2254 66.430 120.572 155.773 1.00 0.00 H ATOM 58695 H2 WAT 2254 66.631 119.921 157.124 1.00 0.00 H TER 58697 WAT 2254 ATOM 58697 O WAT 2255 57.794 137.742 158.265 1.00 0.00 O ATOM 58698 H1 WAT 2255 56.949 138.159 158.096 1.00 0.00 H ATOM 58699 H2 WAT 2255 57.628 136.807 158.146 1.00 0.00 H TER 58701 WAT 2255 ATOM 58701 O WAT 2256 144.324 46.192 105.193 1.00 0.00 O ATOM 58702 H1 WAT 2256 143.492 45.748 105.027 1.00 0.00 H ATOM 58703 H2 WAT 2256 144.991 45.544 104.966 1.00 0.00 H TER 58705 WAT 2256 ATOM 58705 O WAT 2257 112.171 131.532 138.396 1.00 0.00 O ATOM 58706 H1 WAT 2257 112.658 131.153 139.128 1.00 0.00 H ATOM 58707 H2 WAT 2257 111.852 132.370 138.729 1.00 0.00 H TER 58709 WAT 2257 ATOM 58709 O WAT 2258 52.498 36.959 133.724 1.00 0.00 O ATOM 58710 H1 WAT 2258 52.307 37.535 134.464 1.00 0.00 H ATOM 58711 H2 WAT 2258 53.272 37.345 133.314 1.00 0.00 H TER 58713 WAT 2258 ATOM 58713 O WAT 2259 24.224 122.586 112.959 1.00 0.00 O ATOM 58714 H1 WAT 2259 24.966 122.265 112.447 1.00 0.00 H ATOM 58715 H2 WAT 2259 24.418 123.512 113.108 1.00 0.00 H TER 58717 WAT 2259 ATOM 58717 O WAT 2260 121.981 92.427 123.355 1.00 0.00 O ATOM 58718 H1 WAT 2260 121.081 92.750 123.410 1.00 0.00 H ATOM 58719 H2 WAT 2260 122.429 93.061 122.796 1.00 0.00 H TER 58721 WAT 2260 ATOM 58721 O WAT 2261 91.130 70.199 0.463 1.00 0.00 O ATOM 58722 H1 WAT 2261 90.567 69.436 0.591 1.00 0.00 H ATOM 58723 H2 WAT 2261 90.673 70.725 -0.194 1.00 0.00 H TER 58725 WAT 2261 ATOM 58725 O WAT 2262 66.122 94.359 92.453 1.00 0.00 O ATOM 58726 H1 WAT 2262 65.533 94.856 93.020 1.00 0.00 H ATOM 58727 H2 WAT 2262 66.683 95.022 92.050 1.00 0.00 H TER 58729 WAT 2262 ATOM 58729 O WAT 2263 51.807 124.543 12.670 1.00 0.00 O ATOM 58730 H1 WAT 2263 52.427 124.190 13.308 1.00 0.00 H ATOM 58731 H2 WAT 2263 51.534 125.383 13.039 1.00 0.00 H TER 58733 WAT 2263 ATOM 58733 O WAT 2264 101.472 85.619 84.829 1.00 0.00 O ATOM 58734 H1 WAT 2264 101.861 86.402 84.439 1.00 0.00 H ATOM 58735 H2 WAT 2264 102.219 85.054 85.025 1.00 0.00 H TER 58737 WAT 2264 ATOM 58737 O WAT 2265 84.213 24.409 109.400 1.00 0.00 O ATOM 58738 H1 WAT 2265 84.347 23.497 109.661 1.00 0.00 H ATOM 58739 H2 WAT 2265 85.064 24.688 109.063 1.00 0.00 H TER 58741 WAT 2265 ATOM 58741 O WAT 2266 18.247 63.513 1.935 1.00 0.00 O ATOM 58742 H1 WAT 2266 18.694 64.040 2.597 1.00 0.00 H ATOM 58743 H2 WAT 2266 17.950 62.736 2.408 1.00 0.00 H TER 58745 WAT 2266 ATOM 58745 O WAT 2267 6.131 129.632 113.198 1.00 0.00 O ATOM 58746 H1 WAT 2267 5.616 129.803 112.410 1.00 0.00 H ATOM 58747 H2 WAT 2267 6.179 130.479 113.642 1.00 0.00 H TER 58749 WAT 2267 ATOM 58749 O WAT 2268 90.564 79.539 4.742 1.00 0.00 O ATOM 58750 H1 WAT 2268 90.494 80.326 4.202 1.00 0.00 H ATOM 58751 H2 WAT 2268 91.486 79.503 4.995 1.00 0.00 H TER 58753 WAT 2268 ATOM 58753 O WAT 2269 7.716 5.421 150.496 1.00 0.00 O ATOM 58754 H1 WAT 2269 8.515 5.200 150.018 1.00 0.00 H ATOM 58755 H2 WAT 2269 7.014 5.009 149.992 1.00 0.00 H TER 58757 WAT 2269 ATOM 58757 O WAT 2270 127.928 8.528 9.423 1.00 0.00 O ATOM 58758 H1 WAT 2270 127.644 7.839 8.823 1.00 0.00 H ATOM 58759 H2 WAT 2270 127.402 9.289 9.180 1.00 0.00 H TER 58761 WAT 2270 ATOM 58761 O WAT 2271 138.265 116.141 134.511 1.00 0.00 O ATOM 58762 H1 WAT 2271 137.502 116.462 134.992 1.00 0.00 H ATOM 58763 H2 WAT 2271 138.530 115.350 134.980 1.00 0.00 H TER 58765 WAT 2271 ATOM 58765 O WAT 2272 130.453 116.831 24.098 1.00 0.00 O ATOM 58766 H1 WAT 2272 129.866 117.352 24.646 1.00 0.00 H ATOM 58767 H2 WAT 2272 131.232 117.377 23.995 1.00 0.00 H TER 58769 WAT 2272 ATOM 58769 O WAT 2273 102.914 16.516 54.239 1.00 0.00 O ATOM 58770 H1 WAT 2273 102.529 17.258 54.706 1.00 0.00 H ATOM 58771 H2 WAT 2273 102.198 16.171 53.706 1.00 0.00 H TER 58773 WAT 2273 ATOM 58773 O WAT 2274 25.516 106.741 143.174 1.00 0.00 O ATOM 58774 H1 WAT 2274 24.723 106.897 143.687 1.00 0.00 H ATOM 58775 H2 WAT 2274 26.100 106.273 143.771 1.00 0.00 H TER 58777 WAT 2274 ATOM 58777 O WAT 2275 103.761 93.156 120.308 1.00 0.00 O ATOM 58778 H1 WAT 2275 102.813 93.042 120.368 1.00 0.00 H ATOM 58779 H2 WAT 2275 103.881 94.095 120.164 1.00 0.00 H TER 58781 WAT 2275 ATOM 58781 O WAT 2276 13.192 115.853 83.098 1.00 0.00 O ATOM 58782 H1 WAT 2276 12.810 115.476 82.306 1.00 0.00 H ATOM 58783 H2 WAT 2276 12.443 116.024 83.668 1.00 0.00 H TER 58785 WAT 2276 ATOM 58785 O WAT 2277 67.220 129.179 70.285 1.00 0.00 O ATOM 58786 H1 WAT 2277 67.347 129.793 71.008 1.00 0.00 H ATOM 58787 H2 WAT 2277 66.817 128.411 70.690 1.00 0.00 H TER 58789 WAT 2277 ATOM 58789 O WAT 2278 92.080 79.529 123.326 1.00 0.00 O ATOM 58790 H1 WAT 2278 92.000 79.407 122.380 1.00 0.00 H ATOM 58791 H2 WAT 2278 92.565 80.349 123.421 1.00 0.00 H TER 58793 WAT 2278 ATOM 58793 O WAT 2279 15.804 73.397 96.712 1.00 0.00 O ATOM 58794 H1 WAT 2279 16.533 72.846 96.425 1.00 0.00 H ATOM 58795 H2 WAT 2279 15.063 73.110 96.179 1.00 0.00 H TER 58797 WAT 2279 ATOM 58797 O WAT 2280 93.555 113.757 132.822 1.00 0.00 O ATOM 58798 H1 WAT 2280 94.298 113.873 133.414 1.00 0.00 H ATOM 58799 H2 WAT 2280 92.787 113.788 133.393 1.00 0.00 H TER 58801 WAT 2280 ATOM 58801 O WAT 2281 99.444 73.727 90.700 1.00 0.00 O ATOM 58802 H1 WAT 2281 99.994 73.094 90.240 1.00 0.00 H ATOM 58803 H2 WAT 2281 98.877 73.193 91.255 1.00 0.00 H TER 58805 WAT 2281 ATOM 58805 O WAT 2282 18.433 144.517 25.798 1.00 0.00 O ATOM 58806 H1 WAT 2282 17.947 144.899 26.529 1.00 0.00 H ATOM 58807 H2 WAT 2282 18.002 143.677 25.637 1.00 0.00 H TER 58809 WAT 2282 ATOM 58809 O WAT 2283 109.573 86.054 75.050 1.00 0.00 O ATOM 58810 H1 WAT 2283 109.626 86.789 74.439 1.00 0.00 H ATOM 58811 H2 WAT 2283 109.118 86.409 75.813 1.00 0.00 H TER 58813 WAT 2283 ATOM 58813 O WAT 2284 130.904 118.938 135.923 1.00 0.00 O ATOM 58814 H1 WAT 2284 131.129 118.131 135.461 1.00 0.00 H ATOM 58815 H2 WAT 2284 131.545 118.996 136.631 1.00 0.00 H TER 58817 WAT 2284 ATOM 58817 O WAT 2285 97.335 37.388 14.109 1.00 0.00 O ATOM 58818 H1 WAT 2285 97.842 36.841 13.509 1.00 0.00 H ATOM 58819 H2 WAT 2285 96.679 36.796 14.476 1.00 0.00 H TER 58821 WAT 2285 ATOM 58821 O WAT 2286 22.821 141.471 11.860 1.00 0.00 O ATOM 58822 H1 WAT 2286 23.566 141.438 11.260 1.00 0.00 H ATOM 58823 H2 WAT 2286 22.598 140.553 12.015 1.00 0.00 H TER 58825 WAT 2286 ATOM 58825 O WAT 2287 26.873 20.832 23.674 1.00 0.00 O ATOM 58826 H1 WAT 2287 27.426 20.246 23.157 1.00 0.00 H ATOM 58827 H2 WAT 2287 26.126 21.019 23.106 1.00 0.00 H TER 58829 WAT 2287 ATOM 58829 O WAT 2288 116.673 86.540 127.714 1.00 0.00 O ATOM 58830 H1 WAT 2288 115.738 86.402 127.566 1.00 0.00 H ATOM 58831 H2 WAT 2288 116.882 87.327 127.211 1.00 0.00 H TER 58833 WAT 2288 ATOM 58833 O WAT 2289 104.203 117.754 134.495 1.00 0.00 O ATOM 58834 H1 WAT 2289 104.470 116.872 134.755 1.00 0.00 H ATOM 58835 H2 WAT 2289 103.331 117.639 134.117 1.00 0.00 H TER 58837 WAT 2289 ATOM 58837 O WAT 2290 22.014 61.591 54.151 1.00 0.00 O ATOM 58838 H1 WAT 2290 22.065 62.337 54.749 1.00 0.00 H ATOM 58839 H2 WAT 2290 22.825 61.106 54.304 1.00 0.00 H TER 58841 WAT 2290 ATOM 58841 O WAT 2291 6.951 98.589 109.346 1.00 0.00 O ATOM 58842 H1 WAT 2291 6.539 99.241 109.913 1.00 0.00 H ATOM 58843 H2 WAT 2291 6.980 99.006 108.485 1.00 0.00 H TER 58845 WAT 2291 ATOM 58845 O WAT 2292 102.326 118.339 117.170 1.00 0.00 O ATOM 58846 H1 WAT 2292 103.031 118.087 117.766 1.00 0.00 H ATOM 58847 H2 WAT 2292 101.901 119.080 117.600 1.00 0.00 H TER 58849 WAT 2292 ATOM 58849 O WAT 2293 133.531 71.659 104.921 1.00 0.00 O ATOM 58850 H1 WAT 2293 134.488 71.660 104.898 1.00 0.00 H ATOM 58851 H2 WAT 2293 133.276 71.016 104.260 1.00 0.00 H TER 58853 WAT 2293 ATOM 58853 O WAT 2294 86.316 18.254 96.284 1.00 0.00 O ATOM 58854 H1 WAT 2294 86.769 19.097 96.295 1.00 0.00 H ATOM 58855 H2 WAT 2294 86.752 17.739 96.962 1.00 0.00 H TER 58857 WAT 2294 ATOM 58857 O WAT 2295 62.110 16.021 17.346 1.00 0.00 O ATOM 58858 H1 WAT 2295 61.677 15.212 17.619 1.00 0.00 H ATOM 58859 H2 WAT 2295 61.638 16.293 16.559 1.00 0.00 H TER 58861 WAT 2295 ATOM 58861 O WAT 2296 112.828 27.393 59.441 1.00 0.00 O ATOM 58862 H1 WAT 2296 113.347 26.638 59.719 1.00 0.00 H ATOM 58863 H2 WAT 2296 113.070 27.525 58.524 1.00 0.00 H TER 58865 WAT 2296 ATOM 58865 O WAT 2297 138.521 61.810 100.215 1.00 0.00 O ATOM 58866 H1 WAT 2297 139.027 61.873 101.025 1.00 0.00 H ATOM 58867 H2 WAT 2297 137.943 62.573 100.234 1.00 0.00 H TER 58869 WAT 2297 ATOM 58869 O WAT 2298 91.593 68.850 89.307 1.00 0.00 O ATOM 58870 H1 WAT 2298 91.303 69.351 90.069 1.00 0.00 H ATOM 58871 H2 WAT 2298 92.547 68.837 89.378 1.00 0.00 H TER 58873 WAT 2298 ATOM 58873 O WAT 2299 38.766 131.694 61.991 1.00 0.00 O ATOM 58874 H1 WAT 2299 38.554 132.623 62.085 1.00 0.00 H ATOM 58875 H2 WAT 2299 39.494 131.553 62.596 1.00 0.00 H TER 58877 WAT 2299 ATOM 58877 O WAT 2300 50.159 136.630 8.102 1.00 0.00 O ATOM 58878 H1 WAT 2300 49.752 136.269 7.315 1.00 0.00 H ATOM 58879 H2 WAT 2300 50.184 135.897 8.716 1.00 0.00 H TER 58881 WAT 2300 ATOM 58881 O WAT 2301 67.813 79.988 104.127 1.00 0.00 O ATOM 58882 H1 WAT 2301 68.749 80.168 104.031 1.00 0.00 H ATOM 58883 H2 WAT 2301 67.475 79.993 103.232 1.00 0.00 H TER 58885 WAT 2301 ATOM 58885 O WAT 2302 84.786 5.981 152.325 1.00 0.00 O ATOM 58886 H1 WAT 2302 84.312 6.226 151.530 1.00 0.00 H ATOM 58887 H2 WAT 2302 85.682 6.281 152.171 1.00 0.00 H TER 58889 WAT 2302 ATOM 58889 O WAT 2303 84.700 24.787 122.768 1.00 0.00 O ATOM 58890 H1 WAT 2303 85.432 24.750 122.152 1.00 0.00 H ATOM 58891 H2 WAT 2303 85.085 24.551 123.612 1.00 0.00 H TER 58893 WAT 2303 ATOM 58893 O WAT 2304 93.638 80.968 153.325 1.00 0.00 O ATOM 58894 H1 WAT 2304 94.000 80.085 153.399 1.00 0.00 H ATOM 58895 H2 WAT 2304 94.403 81.531 153.208 1.00 0.00 H TER 58897 WAT 2304 ATOM 58897 O WAT 2305 28.809 72.093 149.260 1.00 0.00 O ATOM 58898 H1 WAT 2305 28.494 72.685 148.577 1.00 0.00 H ATOM 58899 H2 WAT 2305 29.067 72.671 149.978 1.00 0.00 H TER 58901 WAT 2305 ATOM 58901 O WAT 2306 24.678 119.232 107.610 1.00 0.00 O ATOM 58902 H1 WAT 2306 24.334 119.420 108.483 1.00 0.00 H ATOM 58903 H2 WAT 2306 24.712 120.085 107.177 1.00 0.00 H TER 58905 WAT 2306 ATOM 58905 O WAT 2307 51.977 19.050 75.658 1.00 0.00 O ATOM 58906 H1 WAT 2307 52.549 18.854 74.916 1.00 0.00 H ATOM 58907 H2 WAT 2307 52.201 18.390 76.314 1.00 0.00 H TER 58909 WAT 2307 ATOM 58909 O WAT 2308 51.062 60.848 132.061 1.00 0.00 O ATOM 58910 H1 WAT 2308 51.930 60.916 132.457 1.00 0.00 H ATOM 58911 H2 WAT 2308 50.458 61.082 132.765 1.00 0.00 H TER 58913 WAT 2308 ATOM 58913 O WAT 2309 130.358 25.434 73.586 1.00 0.00 O ATOM 58914 H1 WAT 2309 129.899 25.292 74.413 1.00 0.00 H ATOM 58915 H2 WAT 2309 130.191 24.638 73.080 1.00 0.00 H TER 58917 WAT 2309 ATOM 58917 O WAT 2310 6.939 132.492 23.038 1.00 0.00 O ATOM 58918 H1 WAT 2310 6.014 132.393 22.813 1.00 0.00 H ATOM 58919 H2 WAT 2310 7.235 131.602 23.230 1.00 0.00 H TER 58921 WAT 2310 ATOM 58921 O WAT 2311 30.777 86.511 14.279 1.00 0.00 O ATOM 58922 H1 WAT 2311 30.675 87.374 13.876 1.00 0.00 H ATOM 58923 H2 WAT 2311 30.583 86.656 15.206 1.00 0.00 H TER 58925 WAT 2311 ATOM 58925 O WAT 2312 4.459 119.497 16.544 1.00 0.00 O ATOM 58926 H1 WAT 2312 4.688 119.890 17.386 1.00 0.00 H ATOM 58927 H2 WAT 2312 4.540 118.554 16.689 1.00 0.00 H TER 58929 WAT 2312 ATOM 58929 O WAT 2313 88.756 105.324 82.897 1.00 0.00 O ATOM 58930 H1 WAT 2313 87.873 104.971 83.009 1.00 0.00 H ATOM 58931 H2 WAT 2313 89.132 105.312 83.777 1.00 0.00 H TER 58933 WAT 2313 ATOM 58933 O WAT 2314 95.479 48.755 123.411 1.00 0.00 O ATOM 58934 H1 WAT 2314 94.579 48.974 123.168 1.00 0.00 H ATOM 58935 H2 WAT 2314 95.786 49.517 123.902 1.00 0.00 H TER 58937 WAT 2314 ATOM 58937 O WAT 2315 34.713 73.301 6.553 1.00 0.00 O ATOM 58938 H1 WAT 2315 34.415 73.229 7.460 1.00 0.00 H ATOM 58939 H2 WAT 2315 33.920 73.505 6.057 1.00 0.00 H TER 58941 WAT 2315 ATOM 58941 O WAT 2316 91.267 94.820 134.821 1.00 0.00 O ATOM 58942 H1 WAT 2316 91.396 94.829 133.872 1.00 0.00 H ATOM 58943 H2 WAT 2316 90.317 94.851 134.934 1.00 0.00 H TER 58945 WAT 2316 ATOM 58945 O WAT 2317 41.630 110.467 149.563 1.00 0.00 O ATOM 58946 H1 WAT 2317 41.277 109.603 149.773 1.00 0.00 H ATOM 58947 H2 WAT 2317 41.146 111.068 150.129 1.00 0.00 H TER 58949 WAT 2317 ATOM 58949 O WAT 2318 37.079 78.828 120.583 1.00 0.00 O ATOM 58950 H1 WAT 2318 37.539 79.306 121.273 1.00 0.00 H ATOM 58951 H2 WAT 2318 37.642 78.077 120.395 1.00 0.00 H TER 58953 WAT 2318 ATOM 58953 O WAT 2319 135.556 39.273 83.707 1.00 0.00 O ATOM 58954 H1 WAT 2319 135.702 39.751 82.891 1.00 0.00 H ATOM 58955 H2 WAT 2319 135.142 38.454 83.434 1.00 0.00 H TER 58957 WAT 2319 ATOM 58957 O WAT 2320 136.562 93.311 85.645 1.00 0.00 O ATOM 58958 H1 WAT 2320 135.789 93.596 85.158 1.00 0.00 H ATOM 58959 H2 WAT 2320 136.316 92.461 86.010 1.00 0.00 H TER 58961 WAT 2320 ATOM 58961 O WAT 2321 60.089 101.009 60.343 1.00 0.00 O ATOM 58962 H1 WAT 2321 60.602 101.782 60.108 1.00 0.00 H ATOM 58963 H2 WAT 2321 60.682 100.482 60.879 1.00 0.00 H TER 58965 WAT 2321 ATOM 58965 O WAT 2322 127.217 142.887 20.767 1.00 0.00 O ATOM 58966 H1 WAT 2322 127.453 142.081 21.226 1.00 0.00 H ATOM 58967 H2 WAT 2322 126.361 143.124 21.122 1.00 0.00 H TER 58969 WAT 2322 ATOM 58969 O WAT 2323 79.443 112.632 137.378 1.00 0.00 O ATOM 58970 H1 WAT 2323 80.351 112.350 137.491 1.00 0.00 H ATOM 58971 H2 WAT 2323 79.044 111.946 136.842 1.00 0.00 H TER 58973 WAT 2323 ATOM 58973 O WAT 2324 54.365 63.695 60.683 1.00 0.00 O ATOM 58974 H1 WAT 2324 53.928 64.429 61.116 1.00 0.00 H ATOM 58975 H2 WAT 2324 53.884 63.580 59.864 1.00 0.00 H TER 58977 WAT 2324 ATOM 58977 O WAT 2325 13.411 4.058 71.616 1.00 0.00 O ATOM 58978 H1 WAT 2325 13.246 3.124 71.743 1.00 0.00 H ATOM 58979 H2 WAT 2325 14.139 4.254 72.205 1.00 0.00 H TER 58981 WAT 2325 ATOM 58981 O WAT 2326 93.131 132.277 60.726 1.00 0.00 O ATOM 58982 H1 WAT 2326 93.394 133.181 60.555 1.00 0.00 H ATOM 58983 H2 WAT 2326 93.941 131.773 60.650 1.00 0.00 H TER 58985 WAT 2326 ATOM 58985 O WAT 2327 39.827 37.608 107.343 1.00 0.00 O ATOM 58986 H1 WAT 2327 40.128 37.623 108.251 1.00 0.00 H ATOM 58987 H2 WAT 2327 38.900 37.377 107.402 1.00 0.00 H TER 58989 WAT 2327 ATOM 58989 O WAT 2328 80.222 15.507 96.008 1.00 0.00 O ATOM 58990 H1 WAT 2328 79.719 15.278 95.227 1.00 0.00 H ATOM 58991 H2 WAT 2328 80.461 14.664 96.394 1.00 0.00 H TER 58993 WAT 2328 ATOM 58993 O WAT 2329 55.521 101.731 1.628 1.00 0.00 O ATOM 58994 H1 WAT 2329 55.645 101.074 2.313 1.00 0.00 H ATOM 58995 H2 WAT 2329 56.233 101.570 1.009 1.00 0.00 H TER 58997 WAT 2329 ATOM 58997 O WAT 2330 70.466 94.216 123.728 1.00 0.00 O ATOM 58998 H1 WAT 2330 70.139 94.791 123.036 1.00 0.00 H ATOM 58999 H2 WAT 2330 69.707 93.693 123.983 1.00 0.00 H TER 59001 WAT 2330 ATOM 59001 O WAT 2331 41.585 27.917 96.990 1.00 0.00 O ATOM 59002 H1 WAT 2331 41.524 28.850 96.785 1.00 0.00 H ATOM 59003 H2 WAT 2331 42.114 27.549 96.283 1.00 0.00 H TER 59005 WAT 2331 ATOM 59005 O WAT 2332 120.458 105.422 132.761 1.00 0.00 O ATOM 59006 H1 WAT 2332 119.623 104.993 132.951 1.00 0.00 H ATOM 59007 H2 WAT 2332 121.117 104.750 132.932 1.00 0.00 H TER 59009 WAT 2332 ATOM 59009 O WAT 2333 23.194 116.856 129.971 1.00 0.00 O ATOM 59010 H1 WAT 2333 24.076 116.836 130.343 1.00 0.00 H ATOM 59011 H2 WAT 2333 22.842 117.706 130.233 1.00 0.00 H TER 59013 WAT 2333 ATOM 59013 O WAT 2334 124.610 73.583 82.764 1.00 0.00 O ATOM 59014 H1 WAT 2334 125.097 73.496 81.945 1.00 0.00 H ATOM 59015 H2 WAT 2334 124.087 72.783 82.818 1.00 0.00 H TER 59017 WAT 2334 ATOM 59017 O WAT 2335 136.044 12.071 121.770 1.00 0.00 O ATOM 59018 H1 WAT 2335 135.630 11.830 122.598 1.00 0.00 H ATOM 59019 H2 WAT 2335 136.549 12.858 121.974 1.00 0.00 H TER 59021 WAT 2335 ATOM 59021 O WAT 2336 21.601 78.892 66.193 1.00 0.00 O ATOM 59022 H1 WAT 2336 20.982 78.430 66.757 1.00 0.00 H ATOM 59023 H2 WAT 2336 21.118 79.044 65.380 1.00 0.00 H TER 59025 WAT 2336 ATOM 59025 O WAT 2337 1.013 70.722 134.989 1.00 0.00 O ATOM 59026 H1 WAT 2337 0.901 71.582 134.584 1.00 0.00 H ATOM 59027 H2 WAT 2337 1.189 70.912 135.911 1.00 0.00 H TER 59029 WAT 2337 ATOM 59029 O WAT 2338 109.467 125.254 21.909 1.00 0.00 O ATOM 59030 H1 WAT 2338 108.897 125.884 21.470 1.00 0.00 H ATOM 59031 H2 WAT 2338 109.297 124.425 21.462 1.00 0.00 H TER 59033 WAT 2338 ATOM 59033 O WAT 2339 51.588 90.731 73.938 1.00 0.00 O ATOM 59034 H1 WAT 2339 52.109 90.341 73.236 1.00 0.00 H ATOM 59035 H2 WAT 2339 51.044 91.384 73.498 1.00 0.00 H TER 59037 WAT 2339 ATOM 59037 O WAT 2340 0.927 136.370 84.411 1.00 0.00 O ATOM 59038 H1 WAT 2340 1.467 135.625 84.146 1.00 0.00 H ATOM 59039 H2 WAT 2340 0.032 136.030 84.410 1.00 0.00 H TER 59041 WAT 2340 ATOM 59041 O WAT 2341 112.892 102.566 26.337 1.00 0.00 O ATOM 59042 H1 WAT 2341 111.961 102.356 26.405 1.00 0.00 H ATOM 59043 H2 WAT 2341 113.339 101.768 26.620 1.00 0.00 H TER 59045 WAT 2341 ATOM 59045 O WAT 2342 53.637 26.874 155.854 1.00 0.00 O ATOM 59046 H1 WAT 2342 53.822 26.702 156.777 1.00 0.00 H ATOM 59047 H2 WAT 2342 52.682 26.848 155.792 1.00 0.00 H TER 59049 WAT 2342 ATOM 59049 O WAT 2343 127.075 43.683 98.864 1.00 0.00 O ATOM 59050 H1 WAT 2343 128.013 43.739 99.045 1.00 0.00 H ATOM 59051 H2 WAT 2343 126.921 44.346 98.191 1.00 0.00 H TER 59053 WAT 2343 ATOM 59053 O WAT 2344 24.247 52.433 72.735 1.00 0.00 O ATOM 59054 H1 WAT 2344 24.183 52.024 71.872 1.00 0.00 H ATOM 59055 H2 WAT 2344 25.021 52.994 72.677 1.00 0.00 H TER 59057 WAT 2344 ATOM 59057 O WAT 2345 4.716 88.771 13.159 1.00 0.00 O ATOM 59058 H1 WAT 2345 4.440 88.912 14.064 1.00 0.00 H ATOM 59059 H2 WAT 2345 5.460 88.173 13.225 1.00 0.00 H TER 59061 WAT 2345 ATOM 59061 O WAT 2346 83.281 28.585 134.736 1.00 0.00 O ATOM 59062 H1 WAT 2346 82.369 28.862 134.652 1.00 0.00 H ATOM 59063 H2 WAT 2346 83.703 28.906 133.939 1.00 0.00 H TER 59065 WAT 2346 ATOM 59065 O WAT 2347 76.962 76.326 77.076 1.00 0.00 O ATOM 59066 H1 WAT 2347 77.910 76.200 77.110 1.00 0.00 H ATOM 59067 H2 WAT 2347 76.810 77.133 77.568 1.00 0.00 H TER 59069 WAT 2347 ATOM 59069 O WAT 2348 116.025 28.004 64.377 1.00 0.00 O ATOM 59070 H1 WAT 2348 115.831 27.616 63.523 1.00 0.00 H ATOM 59071 H2 WAT 2348 116.867 28.442 64.255 1.00 0.00 H TER 59073 WAT 2348 ATOM 59073 O WAT 2349 94.812 23.410 108.480 1.00 0.00 O ATOM 59074 H1 WAT 2349 95.407 22.662 108.426 1.00 0.00 H ATOM 59075 H2 WAT 2349 94.937 23.752 109.365 1.00 0.00 H TER 59077 WAT 2349 ATOM 59077 O WAT 2350 32.615 52.326 69.230 1.00 0.00 O ATOM 59078 H1 WAT 2350 32.781 52.745 68.386 1.00 0.00 H ATOM 59079 H2 WAT 2350 32.076 52.957 69.708 1.00 0.00 H TER 59081 WAT 2350 ATOM 59081 O WAT 2351 68.198 56.700 136.367 1.00 0.00 O ATOM 59082 H1 WAT 2351 68.494 57.226 137.110 1.00 0.00 H ATOM 59083 H2 WAT 2351 68.698 57.033 135.623 1.00 0.00 H TER 59085 WAT 2351 ATOM 59085 O WAT 2352 55.345 104.865 16.495 1.00 0.00 O ATOM 59086 H1 WAT 2352 54.907 105.643 16.150 1.00 0.00 H ATOM 59087 H2 WAT 2352 55.286 104.958 17.445 1.00 0.00 H TER 59089 WAT 2352 ATOM 59089 O WAT 2353 67.676 129.708 90.350 1.00 0.00 O ATOM 59090 H1 WAT 2353 67.269 129.291 91.109 1.00 0.00 H ATOM 59091 H2 WAT 2353 67.595 130.647 90.520 1.00 0.00 H TER 59093 WAT 2353 ATOM 59093 O WAT 2354 64.910 77.038 142.239 1.00 0.00 O ATOM 59094 H1 WAT 2354 64.156 77.559 142.515 1.00 0.00 H ATOM 59095 H2 WAT 2354 65.223 77.474 141.446 1.00 0.00 H TER 59097 WAT 2354 ATOM 59097 O WAT 2355 35.181 22.648 137.446 1.00 0.00 O ATOM 59098 H1 WAT 2355 34.426 22.103 137.668 1.00 0.00 H ATOM 59099 H2 WAT 2355 35.858 22.024 137.183 1.00 0.00 H TER 59101 WAT 2355 ATOM 59101 O WAT 2356 35.223 99.859 28.657 1.00 0.00 O ATOM 59102 H1 WAT 2356 35.077 99.184 29.320 1.00 0.00 H ATOM 59103 H2 WAT 2356 34.352 100.038 28.302 1.00 0.00 H TER 59105 WAT 2356 ATOM 59105 O WAT 2357 143.710 113.714 157.851 1.00 0.00 O ATOM 59106 H1 WAT 2357 143.568 114.387 158.517 1.00 0.00 H ATOM 59107 H2 WAT 2357 142.835 113.378 157.659 1.00 0.00 H TER 59109 WAT 2357 ATOM 59109 O WAT 2358 78.300 44.251 98.428 1.00 0.00 O ATOM 59110 H1 WAT 2358 78.168 44.952 97.790 1.00 0.00 H ATOM 59111 H2 WAT 2358 78.516 44.705 99.242 1.00 0.00 H TER 59113 WAT 2358 ATOM 59113 O WAT 2359 88.071 123.577 17.772 1.00 0.00 O ATOM 59114 H1 WAT 2359 88.375 122.744 18.131 1.00 0.00 H ATOM 59115 H2 WAT 2359 87.593 123.336 16.979 1.00 0.00 H TER 59117 WAT 2359 ATOM 59117 O WAT 2360 54.647 39.439 106.137 1.00 0.00 O ATOM 59118 H1 WAT 2360 53.759 39.346 106.483 1.00 0.00 H ATOM 59119 H2 WAT 2360 54.695 38.798 105.427 1.00 0.00 H TER 59121 WAT 2360 ATOM 59121 O WAT 2361 125.687 44.583 59.745 1.00 0.00 O ATOM 59122 H1 WAT 2361 124.912 44.161 59.375 1.00 0.00 H ATOM 59123 H2 WAT 2361 125.423 45.494 59.879 1.00 0.00 H TER 59125 WAT 2361 ATOM 59125 O WAT 2362 144.900 89.873 112.718 1.00 0.00 O ATOM 59126 H1 WAT 2362 144.865 90.693 112.226 1.00 0.00 H ATOM 59127 H2 WAT 2362 144.020 89.771 113.078 1.00 0.00 H TER 59129 WAT 2362 ATOM 59129 O WAT 2363 90.823 61.829 155.045 1.00 0.00 O ATOM 59130 H1 WAT 2363 90.165 61.627 155.709 1.00 0.00 H ATOM 59131 H2 WAT 2363 90.495 61.412 154.248 1.00 0.00 H TER 59133 WAT 2363 ATOM 59133 O WAT 2364 110.693 51.310 65.075 1.00 0.00 O ATOM 59134 H1 WAT 2364 110.508 52.215 64.825 1.00 0.00 H ATOM 59135 H2 WAT 2364 110.849 50.860 64.245 1.00 0.00 H TER 59137 WAT 2364 ATOM 59137 O WAT 2365 76.806 50.574 143.444 1.00 0.00 O ATOM 59138 H1 WAT 2365 76.022 51.122 143.402 1.00 0.00 H ATOM 59139 H2 WAT 2365 77.258 50.864 144.237 1.00 0.00 H TER 59141 WAT 2365 ATOM 59141 O WAT 2366 10.563 142.823 68.602 1.00 0.00 O ATOM 59142 H1 WAT 2366 11.488 142.647 68.777 1.00 0.00 H ATOM 59143 H2 WAT 2366 10.108 142.513 69.386 1.00 0.00 H TER 59145 WAT 2366 ATOM 59145 O WAT 2367 119.369 8.023 67.356 1.00 0.00 O ATOM 59146 H1 WAT 2367 119.102 7.267 67.879 1.00 0.00 H ATOM 59147 H2 WAT 2367 119.677 8.662 67.998 1.00 0.00 H TER 59149 WAT 2367 ATOM 59149 O WAT 2368 90.990 79.807 25.082 1.00 0.00 O ATOM 59150 H1 WAT 2368 91.577 79.786 25.838 1.00 0.00 H ATOM 59151 H2 WAT 2368 90.115 79.703 25.455 1.00 0.00 H TER 59153 WAT 2368 ATOM 59153 O WAT 2369 116.522 25.504 103.842 1.00 0.00 O ATOM 59154 H1 WAT 2369 116.612 26.108 104.579 1.00 0.00 H ATOM 59155 H2 WAT 2369 115.794 24.933 104.087 1.00 0.00 H TER 59157 WAT 2369 ATOM 59157 O WAT 2370 46.273 66.266 0.774 1.00 0.00 O ATOM 59158 H1 WAT 2370 47.109 66.305 0.311 1.00 0.00 H ATOM 59159 H2 WAT 2370 45.626 66.107 0.087 1.00 0.00 H TER 59161 WAT 2370 ATOM 59161 O WAT 2371 6.657 85.823 80.474 1.00 0.00 O ATOM 59162 H1 WAT 2371 7.024 84.966 80.693 1.00 0.00 H ATOM 59163 H2 WAT 2371 7.201 86.140 79.754 1.00 0.00 H TER 59165 WAT 2371 ATOM 59165 O WAT 2372 48.573 1.200 145.715 1.00 0.00 O ATOM 59166 H1 WAT 2372 47.904 0.590 146.026 1.00 0.00 H ATOM 59167 H2 WAT 2372 48.078 1.920 145.324 1.00 0.00 H TER 59169 WAT 2372 ATOM 59169 O WAT 2373 66.682 63.172 157.500 1.00 0.00 O ATOM 59170 H1 WAT 2373 65.932 63.535 157.972 1.00 0.00 H ATOM 59171 H2 WAT 2373 66.348 62.368 157.101 1.00 0.00 H TER 59173 WAT 2373 ATOM 59173 O WAT 2374 145.221 87.473 72.080 1.00 0.00 O ATOM 59174 H1 WAT 2374 144.936 88.266 71.626 1.00 0.00 H ATOM 59175 H2 WAT 2374 145.258 87.725 73.003 1.00 0.00 H TER 59177 WAT 2374 ATOM 59177 O WAT 2375 42.955 50.821 138.179 1.00 0.00 O ATOM 59178 H1 WAT 2375 42.663 49.916 138.290 1.00 0.00 H ATOM 59179 H2 WAT 2375 43.585 50.783 137.460 1.00 0.00 H TER 59181 WAT 2375 ATOM 59181 O WAT 2376 79.860 106.698 129.670 1.00 0.00 O ATOM 59182 H1 WAT 2376 80.349 107.484 129.424 1.00 0.00 H ATOM 59183 H2 WAT 2376 78.941 106.956 129.601 1.00 0.00 H TER 59185 WAT 2376 ATOM 59185 O WAT 2377 34.921 58.942 109.380 1.00 0.00 O ATOM 59186 H1 WAT 2377 34.637 59.665 108.822 1.00 0.00 H ATOM 59187 H2 WAT 2377 35.875 58.938 109.301 1.00 0.00 H TER 59189 WAT 2377 ATOM 59189 O WAT 2378 5.618 44.410 131.036 1.00 0.00 O ATOM 59190 H1 WAT 2378 5.484 44.528 130.095 1.00 0.00 H ATOM 59191 H2 WAT 2378 5.155 45.146 131.437 1.00 0.00 H TER 59193 WAT 2378 ATOM 59193 O WAT 2379 113.149 33.280 106.219 1.00 0.00 O ATOM 59194 H1 WAT 2379 112.240 33.490 106.005 1.00 0.00 H ATOM 59195 H2 WAT 2379 113.120 32.993 107.132 1.00 0.00 H TER 59197 WAT 2379 ATOM 59197 O WAT 2380 78.460 44.300 110.683 1.00 0.00 O ATOM 59198 H1 WAT 2380 77.810 44.740 110.135 1.00 0.00 H ATOM 59199 H2 WAT 2380 78.054 43.463 110.910 1.00 0.00 H TER 59201 WAT 2380 ATOM 59201 O WAT 2381 50.556 40.069 139.008 1.00 0.00 O ATOM 59202 H1 WAT 2381 50.598 40.366 139.917 1.00 0.00 H ATOM 59203 H2 WAT 2381 49.842 40.576 138.623 1.00 0.00 H TER 59205 WAT 2381 ATOM 59205 O WAT 2382 118.238 39.163 120.904 1.00 0.00 O ATOM 59206 H1 WAT 2382 117.932 38.413 121.414 1.00 0.00 H ATOM 59207 H2 WAT 2382 117.846 39.042 120.040 1.00 0.00 H TER 59209 WAT 2382 ATOM 59209 O WAT 2383 75.249 99.328 10.532 1.00 0.00 O ATOM 59210 H1 WAT 2383 75.543 98.556 11.015 1.00 0.00 H ATOM 59211 H2 WAT 2383 74.360 99.485 10.849 1.00 0.00 H TER 59213 WAT 2383 ATOM 59213 O WAT 2384 51.730 118.524 78.092 1.00 0.00 O ATOM 59214 H1 WAT 2384 52.463 118.277 77.527 1.00 0.00 H ATOM 59215 H2 WAT 2384 52.142 118.831 78.899 1.00 0.00 H TER 59217 WAT 2384 ATOM 59217 O WAT 2385 55.900 56.823 120.726 1.00 0.00 O ATOM 59218 H1 WAT 2385 55.420 56.011 120.885 1.00 0.00 H ATOM 59219 H2 WAT 2385 56.815 56.597 120.891 1.00 0.00 H TER 59221 WAT 2385 ATOM 59221 O WAT 2386 115.661 14.638 137.905 1.00 0.00 O ATOM 59222 H1 WAT 2386 116.239 15.386 137.755 1.00 0.00 H ATOM 59223 H2 WAT 2386 116.216 13.873 137.755 1.00 0.00 H TER 59225 WAT 2386 ATOM 59225 O WAT 2387 45.461 80.886 11.378 1.00 0.00 O ATOM 59226 H1 WAT 2387 46.053 80.172 11.611 1.00 0.00 H ATOM 59227 H2 WAT 2387 44.594 80.574 11.637 1.00 0.00 H TER 59229 WAT 2387 ATOM 59229 O WAT 2388 79.454 25.875 6.473 1.00 0.00 O ATOM 59230 H1 WAT 2388 80.190 25.826 7.083 1.00 0.00 H ATOM 59231 H2 WAT 2388 78.753 26.289 6.976 1.00 0.00 H TER 59233 WAT 2388 ATOM 59233 O WAT 2389 19.655 71.277 91.792 1.00 0.00 O ATOM 59234 H1 WAT 2389 18.936 71.811 91.454 1.00 0.00 H ATOM 59235 H2 WAT 2389 19.572 71.338 92.744 1.00 0.00 H TER 59237 WAT 2389 ATOM 59237 O WAT 2390 112.589 0.380 111.472 1.00 0.00 O ATOM 59238 H1 WAT 2390 113.427 0.301 111.016 1.00 0.00 H ATOM 59239 H2 WAT 2390 112.710 -0.115 112.282 1.00 0.00 H TER 59241 WAT 2390 ATOM 59241 O WAT 2391 67.804 54.417 146.357 1.00 0.00 O ATOM 59242 H1 WAT 2391 67.554 54.451 145.434 1.00 0.00 H ATOM 59243 H2 WAT 2391 67.911 53.484 146.543 1.00 0.00 H TER 59245 WAT 2391 ATOM 59245 O WAT 2392 134.791 3.596 107.302 1.00 0.00 O ATOM 59246 H1 WAT 2392 134.775 3.728 108.250 1.00 0.00 H ATOM 59247 H2 WAT 2392 135.559 3.046 107.150 1.00 0.00 H TER 59249 WAT 2392 ATOM 59249 O WAT 2393 49.430 36.212 90.499 1.00 0.00 O ATOM 59250 H1 WAT 2393 49.011 35.436 90.127 1.00 0.00 H ATOM 59251 H2 WAT 2393 49.067 36.280 91.382 1.00 0.00 H TER 59253 WAT 2393 ATOM 59253 O WAT 2394 3.468 109.487 156.120 1.00 0.00 O ATOM 59254 H1 WAT 2394 2.878 109.580 156.868 1.00 0.00 H ATOM 59255 H2 WAT 2394 3.702 110.385 155.886 1.00 0.00 H TER 59257 WAT 2394 ATOM 59257 O WAT 2395 80.848 108.839 108.180 1.00 0.00 O ATOM 59258 H1 WAT 2395 80.930 109.781 108.332 1.00 0.00 H ATOM 59259 H2 WAT 2395 80.039 108.747 107.677 1.00 0.00 H TER 59261 WAT 2395 ATOM 59261 O WAT 2396 127.887 8.951 83.600 1.00 0.00 O ATOM 59262 H1 WAT 2396 128.771 8.923 83.966 1.00 0.00 H ATOM 59263 H2 WAT 2396 127.954 8.470 82.776 1.00 0.00 H TER 59265 WAT 2396 ATOM 59265 O WAT 2397 107.316 82.943 77.920 1.00 0.00 O ATOM 59266 H1 WAT 2397 108.069 83.075 77.344 1.00 0.00 H ATOM 59267 H2 WAT 2397 107.573 83.349 78.748 1.00 0.00 H TER 59269 WAT 2397 ATOM 59269 O WAT 2398 4.093 96.068 152.825 1.00 0.00 O ATOM 59270 H1 WAT 2398 3.999 96.778 152.190 1.00 0.00 H ATOM 59271 H2 WAT 2398 3.531 96.324 153.556 1.00 0.00 H TER 59273 WAT 2398 ATOM 59273 O WAT 2399 54.983 83.034 73.903 1.00 0.00 O ATOM 59274 H1 WAT 2399 54.709 83.263 74.791 1.00 0.00 H ATOM 59275 H2 WAT 2399 55.895 82.760 73.997 1.00 0.00 H TER 59277 WAT 2399 ATOM 59277 O WAT 2400 114.230 98.595 107.887 1.00 0.00 O ATOM 59278 H1 WAT 2400 114.653 99.212 108.483 1.00 0.00 H ATOM 59279 H2 WAT 2400 113.305 98.842 107.903 1.00 0.00 H TER 59281 WAT 2400 ATOM 59281 O WAT 2401 39.717 54.742 71.738 1.00 0.00 O ATOM 59282 H1 WAT 2401 39.141 55.213 72.340 1.00 0.00 H ATOM 59283 H2 WAT 2401 40.317 54.261 72.309 1.00 0.00 H TER 59285 WAT 2401 ATOM 59285 O WAT 2402 28.996 87.083 60.702 1.00 0.00 O ATOM 59286 H1 WAT 2402 29.790 86.910 60.197 1.00 0.00 H ATOM 59287 H2 WAT 2402 28.926 86.340 61.301 1.00 0.00 H TER 59289 WAT 2402 ATOM 59289 O WAT 2403 14.979 23.875 12.656 1.00 0.00 O ATOM 59290 H1 WAT 2403 15.620 23.209 12.905 1.00 0.00 H ATOM 59291 H2 WAT 2403 14.263 23.764 13.282 1.00 0.00 H TER 59293 WAT 2403 ATOM 59293 O WAT 2404 15.831 118.364 155.388 1.00 0.00 O ATOM 59294 H1 WAT 2404 16.657 118.752 155.675 1.00 0.00 H ATOM 59295 H2 WAT 2404 15.488 117.927 156.168 1.00 0.00 H TER 59297 WAT 2404 ATOM 59297 O WAT 2405 91.382 0.718 143.313 1.00 0.00 O ATOM 59298 H1 WAT 2405 90.907 -0.013 142.917 1.00 0.00 H ATOM 59299 H2 WAT 2405 90.824 1.480 143.153 1.00 0.00 H TER 59301 WAT 2405 ATOM 59301 O WAT 2406 30.375 74.775 141.151 1.00 0.00 O ATOM 59302 H1 WAT 2406 29.444 74.563 141.215 1.00 0.00 H ATOM 59303 H2 WAT 2406 30.778 74.304 141.881 1.00 0.00 H TER 59305 WAT 2406 ATOM 59305 O WAT 2407 133.741 140.474 79.752 1.00 0.00 O ATOM 59306 H1 WAT 2407 134.257 139.740 79.421 1.00 0.00 H ATOM 59307 H2 WAT 2407 134.258 140.821 80.479 1.00 0.00 H TER 59309 WAT 2407 ATOM 59309 O WAT 2408 143.546 101.812 58.165 1.00 0.00 O ATOM 59310 H1 WAT 2408 142.755 101.774 57.628 1.00 0.00 H ATOM 59311 H2 WAT 2408 144.115 102.432 57.710 1.00 0.00 H TER 59313 WAT 2408 ATOM 59313 O WAT 2409 21.148 50.245 76.992 1.00 0.00 O ATOM 59314 H1 WAT 2409 20.797 51.128 77.103 1.00 0.00 H ATOM 59315 H2 WAT 2409 21.311 50.169 76.052 1.00 0.00 H TER 59317 WAT 2409 ATOM 59317 O WAT 2410 119.233 110.019 106.917 1.00 0.00 O ATOM 59318 H1 WAT 2410 119.086 110.421 107.773 1.00 0.00 H ATOM 59319 H2 WAT 2410 118.534 109.371 106.833 1.00 0.00 H TER 59321 WAT 2410 ATOM 59321 O WAT 2411 89.787 23.019 110.490 1.00 0.00 O ATOM 59322 H1 WAT 2411 88.916 23.050 110.886 1.00 0.00 H ATOM 59323 H2 WAT 2411 90.072 23.933 110.466 1.00 0.00 H TER 59325 WAT 2411 ATOM 59325 O WAT 2412 60.583 38.199 88.622 1.00 0.00 O ATOM 59326 H1 WAT 2412 61.160 37.490 88.340 1.00 0.00 H ATOM 59327 H2 WAT 2412 59.699 37.862 88.473 1.00 0.00 H TER 59329 WAT 2412 ATOM 59329 O WAT 2413 69.893 28.523 82.475 1.00 0.00 O ATOM 59330 H1 WAT 2413 69.659 28.501 83.403 1.00 0.00 H ATOM 59331 H2 WAT 2413 70.497 29.262 82.398 1.00 0.00 H TER 59333 WAT 2413 ATOM 59333 O WAT 2414 63.181 134.045 86.029 1.00 0.00 O ATOM 59334 H1 WAT 2414 62.550 133.330 85.944 1.00 0.00 H ATOM 59335 H2 WAT 2414 63.472 134.215 85.133 1.00 0.00 H TER 59337 WAT 2414 ATOM 59337 O WAT 2415 5.890 28.932 70.912 1.00 0.00 O ATOM 59338 H1 WAT 2415 6.647 29.157 71.452 1.00 0.00 H ATOM 59339 H2 WAT 2415 5.167 28.851 71.535 1.00 0.00 H TER 59341 WAT 2415 ATOM 59341 O WAT 2416 91.067 102.609 7.996 1.00 0.00 O ATOM 59342 H1 WAT 2416 91.178 103.460 8.419 1.00 0.00 H ATOM 59343 H2 WAT 2416 91.951 102.243 7.959 1.00 0.00 H TER 59345 WAT 2416 ATOM 59345 O WAT 2417 129.959 2.280 14.281 1.00 0.00 O ATOM 59346 H1 WAT 2417 130.147 2.883 15.000 1.00 0.00 H ATOM 59347 H2 WAT 2417 130.701 2.380 13.685 1.00 0.00 H TER 59349 WAT 2417 ATOM 59349 O WAT 2418 124.837 107.054 125.019 1.00 0.00 O ATOM 59350 H1 WAT 2418 125.533 107.703 125.124 1.00 0.00 H ATOM 59351 H2 WAT 2418 124.789 106.905 124.074 1.00 0.00 H TER 59353 WAT 2418 ATOM 59353 O WAT 2419 112.302 83.430 67.366 1.00 0.00 O ATOM 59354 H1 WAT 2419 112.725 82.672 66.963 1.00 0.00 H ATOM 59355 H2 WAT 2419 111.794 83.825 66.657 1.00 0.00 H TER 59357 WAT 2419 ATOM 59357 O WAT 2420 81.848 21.584 133.974 1.00 0.00 O ATOM 59358 H1 WAT 2420 81.013 21.992 133.746 1.00 0.00 H ATOM 59359 H2 WAT 2420 82.066 21.946 134.832 1.00 0.00 H TER 59361 WAT 2420 ATOM 59361 O WAT 2421 9.810 93.497 115.815 1.00 0.00 O ATOM 59362 H1 WAT 2421 9.588 94.057 116.558 1.00 0.00 H ATOM 59363 H2 WAT 2421 9.017 92.986 115.655 1.00 0.00 H TER 59365 WAT 2421 ATOM 59365 O WAT 2422 44.647 64.120 103.430 1.00 0.00 O ATOM 59366 H1 WAT 2422 44.000 64.766 103.148 1.00 0.00 H ATOM 59367 H2 WAT 2422 45.375 64.226 102.818 1.00 0.00 H TER 59369 WAT 2422 ATOM 59369 O WAT 2423 115.881 65.903 93.791 1.00 0.00 O ATOM 59370 H1 WAT 2423 115.095 66.162 93.310 1.00 0.00 H ATOM 59371 H2 WAT 2423 115.771 66.292 94.658 1.00 0.00 H TER 59373 WAT 2423 ATOM 59373 O WAT 2424 13.813 34.079 114.852 1.00 0.00 O ATOM 59374 H1 WAT 2424 14.078 34.975 115.058 1.00 0.00 H ATOM 59375 H2 WAT 2424 13.330 33.788 115.626 1.00 0.00 H TER 59377 WAT 2424 ATOM 59377 O WAT 2425 96.802 0.337 56.141 1.00 0.00 O ATOM 59378 H1 WAT 2425 97.582 0.554 56.651 1.00 0.00 H ATOM 59379 H2 WAT 2425 96.812 -0.618 56.082 1.00 0.00 H TER 59381 WAT 2425 ATOM 59381 O WAT 2426 85.364 49.377 96.512 1.00 0.00 O ATOM 59382 H1 WAT 2426 85.250 49.810 97.358 1.00 0.00 H ATOM 59383 H2 WAT 2426 86.013 49.912 96.055 1.00 0.00 H TER 59385 WAT 2426 ATOM 59385 O WAT 2427 81.389 96.598 150.133 1.00 0.00 O ATOM 59386 H1 WAT 2427 81.535 96.908 151.027 1.00 0.00 H ATOM 59387 H2 WAT 2427 82.266 96.535 149.754 1.00 0.00 H TER 59389 WAT 2427 ATOM 59389 O WAT 2428 56.660 75.724 82.749 1.00 0.00 O ATOM 59390 H1 WAT 2428 56.761 75.269 81.913 1.00 0.00 H ATOM 59391 H2 WAT 2428 57.545 75.757 83.113 1.00 0.00 H TER 59393 WAT 2428 ATOM 59393 O WAT 2429 91.312 63.437 120.449 1.00 0.00 O ATOM 59394 H1 WAT 2429 91.620 62.532 120.494 1.00 0.00 H ATOM 59395 H2 WAT 2429 91.744 63.874 121.182 1.00 0.00 H TER 59397 WAT 2429 ATOM 59397 O WAT 2430 137.601 120.452 94.292 1.00 0.00 O ATOM 59398 H1 WAT 2430 138.087 121.242 94.529 1.00 0.00 H ATOM 59399 H2 WAT 2430 137.682 119.882 95.057 1.00 0.00 H TER 59401 WAT 2430 ATOM 59401 O WAT 2431 115.167 128.741 105.329 1.00 0.00 O ATOM 59402 H1 WAT 2431 114.213 128.800 105.370 1.00 0.00 H ATOM 59403 H2 WAT 2431 115.394 128.079 105.982 1.00 0.00 H TER 59405 WAT 2431 ATOM 59405 O WAT 2432 88.988 37.852 92.233 1.00 0.00 O ATOM 59406 H1 WAT 2432 88.905 38.803 92.166 1.00 0.00 H ATOM 59407 H2 WAT 2432 88.086 37.534 92.260 1.00 0.00 H TER 59409 WAT 2432 ATOM 59409 O WAT 2433 42.529 58.957 5.220 1.00 0.00 O ATOM 59410 H1 WAT 2433 43.331 58.437 5.285 1.00 0.00 H ATOM 59411 H2 WAT 2433 41.965 58.615 5.914 1.00 0.00 H TER 59413 WAT 2433 ATOM 59413 O WAT 2434 109.106 139.079 19.297 1.00 0.00 O ATOM 59414 H1 WAT 2434 108.285 139.464 18.992 1.00 0.00 H ATOM 59415 H2 WAT 2434 109.428 139.692 19.958 1.00 0.00 H TER 59417 WAT 2434 ATOM 59417 O WAT 2435 14.101 71.706 117.306 1.00 0.00 O ATOM 59418 H1 WAT 2435 13.376 71.295 117.777 1.00 0.00 H ATOM 59419 H2 WAT 2435 13.972 72.645 117.439 1.00 0.00 H TER 59421 WAT 2435 ATOM 59421 O WAT 2436 93.480 110.252 155.902 1.00 0.00 O ATOM 59422 H1 WAT 2436 92.968 110.820 155.326 1.00 0.00 H ATOM 59423 H2 WAT 2436 94.354 110.241 155.512 1.00 0.00 H TER 59425 WAT 2436 ATOM 59425 O WAT 2437 44.417 9.227 158.232 1.00 0.00 O ATOM 59426 H1 WAT 2437 44.472 8.778 157.389 1.00 0.00 H ATOM 59427 H2 WAT 2437 44.823 8.622 158.853 1.00 0.00 H TER 59429 WAT 2437 ATOM 59429 O WAT 2438 51.241 96.742 70.528 1.00 0.00 O ATOM 59430 H1 WAT 2438 50.781 96.519 71.337 1.00 0.00 H ATOM 59431 H2 WAT 2438 50.880 96.144 69.874 1.00 0.00 H TER 59433 WAT 2438 ATOM 59433 O WAT 2439 17.199 72.293 154.311 1.00 0.00 O ATOM 59434 H1 WAT 2439 16.382 72.433 153.834 1.00 0.00 H ATOM 59435 H2 WAT 2439 17.532 71.459 153.978 1.00 0.00 H TER 59437 WAT 2439 ATOM 59437 O WAT 2440 22.487 117.511 103.906 1.00 0.00 O ATOM 59438 H1 WAT 2440 22.045 117.842 103.125 1.00 0.00 H ATOM 59439 H2 WAT 2440 22.633 116.583 103.722 1.00 0.00 H TER 59441 WAT 2440 ATOM 59441 O WAT 2441 27.948 119.584 113.727 1.00 0.00 O ATOM 59442 H1 WAT 2441 27.524 120.268 114.244 1.00 0.00 H ATOM 59443 H2 WAT 2441 28.860 119.865 113.659 1.00 0.00 H TER 59445 WAT 2441 ATOM 59445 O WAT 2442 5.424 78.942 126.578 1.00 0.00 O ATOM 59446 H1 WAT 2442 5.206 78.396 125.823 1.00 0.00 H ATOM 59447 H2 WAT 2442 4.643 79.478 126.719 1.00 0.00 H TER 59449 WAT 2442 ATOM 59449 O WAT 2443 20.968 84.549 103.498 1.00 0.00 O ATOM 59450 H1 WAT 2443 21.640 84.154 104.053 1.00 0.00 H ATOM 59451 H2 WAT 2443 20.475 85.120 104.087 1.00 0.00 H TER 59453 WAT 2443 ATOM 59453 O WAT 2444 86.648 55.875 21.854 1.00 0.00 O ATOM 59454 H1 WAT 2444 87.598 55.983 21.886 1.00 0.00 H ATOM 59455 H2 WAT 2444 86.311 56.759 21.709 1.00 0.00 H TER 59457 WAT 2444 ATOM 59457 O WAT 2445 103.119 66.079 99.608 1.00 0.00 O ATOM 59458 H1 WAT 2445 102.258 66.497 99.632 1.00 0.00 H ATOM 59459 H2 WAT 2445 103.308 65.973 98.676 1.00 0.00 H TER 59461 WAT 2445 ATOM 59461 O WAT 2446 55.412 7.532 125.533 1.00 0.00 O ATOM 59462 H1 WAT 2446 56.357 7.388 125.567 1.00 0.00 H ATOM 59463 H2 WAT 2446 55.032 6.671 125.706 1.00 0.00 H TER 59465 WAT 2446 ATOM 59465 O WAT 2447 86.464 37.183 6.686 1.00 0.00 O ATOM 59466 H1 WAT 2447 86.352 36.249 6.510 1.00 0.00 H ATOM 59467 H2 WAT 2447 86.770 37.549 5.856 1.00 0.00 H TER 59469 WAT 2447 ATOM 59469 O WAT 2448 124.499 38.297 106.237 1.00 0.00 O ATOM 59470 H1 WAT 2448 124.234 38.929 105.569 1.00 0.00 H ATOM 59471 H2 WAT 2448 124.633 38.823 107.025 1.00 0.00 H TER 59473 WAT 2448 ATOM 59473 O WAT 2449 123.544 6.892 105.315 1.00 0.00 O ATOM 59474 H1 WAT 2449 123.210 7.735 105.009 1.00 0.00 H ATOM 59475 H2 WAT 2449 124.330 6.741 104.790 1.00 0.00 H TER 59477 WAT 2449 ATOM 59477 O WAT 2450 22.216 38.350 155.626 1.00 0.00 O ATOM 59478 H1 WAT 2450 22.829 38.112 154.931 1.00 0.00 H ATOM 59479 H2 WAT 2450 22.628 39.093 156.066 1.00 0.00 H TER 59481 WAT 2450 ATOM 59481 O WAT 2451 138.650 47.109 81.422 1.00 0.00 O ATOM 59482 H1 WAT 2451 138.294 47.843 81.923 1.00 0.00 H ATOM 59483 H2 WAT 2451 138.179 47.136 80.589 1.00 0.00 H TER 59485 WAT 2451 ATOM 59485 O WAT 2452 105.756 16.838 53.409 1.00 0.00 O ATOM 59486 H1 WAT 2452 104.820 16.794 53.602 1.00 0.00 H ATOM 59487 H2 WAT 2452 106.183 16.612 54.236 1.00 0.00 H TER 59489 WAT 2452 ATOM 59489 O WAT 2453 47.813 2.503 86.375 1.00 0.00 O ATOM 59490 H1 WAT 2453 48.520 2.188 85.813 1.00 0.00 H ATOM 59491 H2 WAT 2453 47.612 1.761 86.945 1.00 0.00 H TER 59493 WAT 2453 ATOM 59493 O WAT 2454 118.558 15.586 72.682 1.00 0.00 O ATOM 59494 H1 WAT 2454 118.457 16.532 72.573 1.00 0.00 H ATOM 59495 H2 WAT 2454 118.576 15.242 71.789 1.00 0.00 H TER 59497 WAT 2454 ATOM 59497 O WAT 2455 94.772 35.485 71.411 1.00 0.00 O ATOM 59498 H1 WAT 2455 95.261 34.671 71.534 1.00 0.00 H ATOM 59499 H2 WAT 2455 95.051 36.044 72.137 1.00 0.00 H TER 59501 WAT 2455 ATOM 59501 O WAT 2456 59.495 123.439 12.293 1.00 0.00 O ATOM 59502 H1 WAT 2456 59.350 122.509 12.117 1.00 0.00 H ATOM 59503 H2 WAT 2456 60.443 123.550 12.230 1.00 0.00 H TER 59505 WAT 2456 ATOM 59505 O WAT 2457 57.337 1.431 25.869 1.00 0.00 O ATOM 59506 H1 WAT 2457 57.658 2.330 25.792 1.00 0.00 H ATOM 59507 H2 WAT 2457 58.129 0.895 25.900 1.00 0.00 H TER 59509 WAT 2457 ATOM 59509 O WAT 2458 16.330 14.783 71.942 1.00 0.00 O ATOM 59510 H1 WAT 2458 16.110 13.860 71.815 1.00 0.00 H ATOM 59511 H2 WAT 2458 16.529 14.856 72.876 1.00 0.00 H TER 59513 WAT 2458 ATOM 59513 O WAT 2459 132.873 40.360 150.854 1.00 0.00 O ATOM 59514 H1 WAT 2459 133.125 41.186 151.269 1.00 0.00 H ATOM 59515 H2 WAT 2459 132.181 40.011 151.416 1.00 0.00 H TER 59517 WAT 2459 ATOM 59517 O WAT 2460 14.896 136.161 121.498 1.00 0.00 O ATOM 59518 H1 WAT 2460 15.252 137.046 121.419 1.00 0.00 H ATOM 59519 H2 WAT 2460 15.477 135.620 120.963 1.00 0.00 H TER 59521 WAT 2460 ATOM 59521 O WAT 2461 125.449 93.220 15.262 1.00 0.00 O ATOM 59522 H1 WAT 2461 126.319 93.578 15.086 1.00 0.00 H ATOM 59523 H2 WAT 2461 124.921 93.492 14.512 1.00 0.00 H TER 59525 WAT 2461 ATOM 59525 O WAT 2462 35.332 62.921 20.603 1.00 0.00 O ATOM 59526 H1 WAT 2462 35.598 62.830 19.688 1.00 0.00 H ATOM 59527 H2 WAT 2462 35.616 62.106 21.017 1.00 0.00 H TER 59529 WAT 2462 ATOM 59529 O WAT 2463 121.526 74.624 148.764 1.00 0.00 O ATOM 59530 H1 WAT 2463 120.698 74.144 148.793 1.00 0.00 H ATOM 59531 H2 WAT 2463 122.182 73.958 148.562 1.00 0.00 H TER 59533 WAT 2463 ATOM 59533 O WAT 2464 132.134 7.865 124.497 1.00 0.00 O ATOM 59534 H1 WAT 2464 131.402 8.103 125.066 1.00 0.00 H ATOM 59535 H2 WAT 2464 132.304 8.655 123.983 1.00 0.00 H TER 59537 WAT 2464 ATOM 59537 O WAT 2465 50.757 117.750 93.360 1.00 0.00 O ATOM 59538 H1 WAT 2465 51.214 118.420 92.851 1.00 0.00 H ATOM 59539 H2 WAT 2465 50.520 117.081 92.718 1.00 0.00 H TER 59541 WAT 2465 ATOM 59541 O WAT 2466 10.019 36.461 58.905 1.00 0.00 O ATOM 59542 H1 WAT 2466 9.829 35.833 58.208 1.00 0.00 H ATOM 59543 H2 WAT 2466 10.242 37.270 58.444 1.00 0.00 H TER 59545 WAT 2466 ATOM 59545 O WAT 2467 54.622 17.648 99.989 1.00 0.00 O ATOM 59546 H1 WAT 2467 54.648 18.202 100.769 1.00 0.00 H ATOM 59547 H2 WAT 2467 53.993 18.079 99.410 1.00 0.00 H TER 59549 WAT 2467 ATOM 59549 O WAT 2468 35.722 14.537 107.060 1.00 0.00 O ATOM 59550 H1 WAT 2468 34.974 15.105 107.243 1.00 0.00 H ATOM 59551 H2 WAT 2468 35.986 14.205 107.918 1.00 0.00 H TER 59553 WAT 2468 ATOM 59553 O WAT 2469 92.853 53.127 89.078 1.00 0.00 O ATOM 59554 H1 WAT 2469 92.905 53.669 89.866 1.00 0.00 H ATOM 59555 H2 WAT 2469 92.234 52.433 89.304 1.00 0.00 H TER 59557 WAT 2469 ATOM 59557 O WAT 2470 44.030 50.549 131.859 1.00 0.00 O ATOM 59558 H1 WAT 2470 44.185 49.815 132.455 1.00 0.00 H ATOM 59559 H2 WAT 2470 43.079 50.574 131.752 1.00 0.00 H TER 59561 WAT 2470 ATOM 59561 O WAT 2471 117.859 136.134 109.538 1.00 0.00 O ATOM 59562 H1 WAT 2471 117.858 136.571 108.686 1.00 0.00 H ATOM 59563 H2 WAT 2471 117.107 136.506 109.999 1.00 0.00 H TER 59565 WAT 2471 ATOM 59565 O WAT 2472 44.698 138.394 135.514 1.00 0.00 O ATOM 59566 H1 WAT 2472 44.250 137.592 135.243 1.00 0.00 H ATOM 59567 H2 WAT 2472 44.022 139.070 135.476 1.00 0.00 H TER 59569 WAT 2472 ATOM 59569 O WAT 2473 75.144 38.140 145.081 1.00 0.00 O ATOM 59570 H1 WAT 2473 74.906 37.824 144.210 1.00 0.00 H ATOM 59571 H2 WAT 2473 74.881 39.061 145.082 1.00 0.00 H TER 59573 WAT 2473 ATOM 59573 O WAT 2474 4.804 31.968 136.590 1.00 0.00 O ATOM 59574 H1 WAT 2474 4.160 31.272 136.457 1.00 0.00 H ATOM 59575 H2 WAT 2474 5.067 32.224 135.706 1.00 0.00 H TER 59577 WAT 2474 ATOM 59577 O WAT 2475 75.695 128.544 142.144 1.00 0.00 O ATOM 59578 H1 WAT 2475 75.385 129.182 142.786 1.00 0.00 H ATOM 59579 H2 WAT 2475 76.599 128.364 142.403 1.00 0.00 H TER 59581 WAT 2475 ATOM 59581 O WAT 2476 13.924 107.505 0.284 1.00 0.00 O ATOM 59582 H1 WAT 2476 13.783 107.529 1.231 1.00 0.00 H ATOM 59583 H2 WAT 2476 13.137 107.087 -0.064 1.00 0.00 H TER 59585 WAT 2476 ATOM 59585 O WAT 2477 145.751 39.869 57.669 1.00 0.00 O ATOM 59586 H1 WAT 2477 145.165 39.781 56.917 1.00 0.00 H ATOM 59587 H2 WAT 2477 145.291 39.430 58.384 1.00 0.00 H TER 59589 WAT 2477 ATOM 59589 O WAT 2478 48.235 29.978 21.255 1.00 0.00 O ATOM 59590 H1 WAT 2478 48.759 29.186 21.372 1.00 0.00 H ATOM 59591 H2 WAT 2478 47.906 30.179 22.131 1.00 0.00 H TER 59593 WAT 2478 ATOM 59593 O WAT 2479 120.078 106.650 16.842 1.00 0.00 O ATOM 59594 H1 WAT 2479 120.496 107.479 16.605 1.00 0.00 H ATOM 59595 H2 WAT 2479 119.582 106.851 17.635 1.00 0.00 H TER 59597 WAT 2479 ATOM 59597 O WAT 2480 100.527 138.379 156.941 1.00 0.00 O ATOM 59598 H1 WAT 2480 101.308 138.900 156.758 1.00 0.00 H ATOM 59599 H2 WAT 2480 99.914 138.612 156.244 1.00 0.00 H TER 59601 WAT 2480 ATOM 59601 O WAT 2481 62.280 101.002 143.580 1.00 0.00 O ATOM 59602 H1 WAT 2481 61.844 101.245 142.763 1.00 0.00 H ATOM 59603 H2 WAT 2481 63.161 101.367 143.499 1.00 0.00 H TER 59605 WAT 2481 ATOM 59605 O WAT 2482 100.110 47.180 122.956 1.00 0.00 O ATOM 59606 H1 WAT 2482 100.038 46.347 122.489 1.00 0.00 H ATOM 59607 H2 WAT 2482 99.245 47.581 122.866 1.00 0.00 H TER 59609 WAT 2482 ATOM 59609 O WAT 2483 6.612 74.878 103.229 1.00 0.00 O ATOM 59610 H1 WAT 2483 5.872 75.434 103.477 1.00 0.00 H ATOM 59611 H2 WAT 2483 6.945 75.270 102.421 1.00 0.00 H TER 59613 WAT 2483 ATOM 59613 O WAT 2484 136.677 76.367 62.723 1.00 0.00 O ATOM 59614 H1 WAT 2484 136.629 77.215 62.282 1.00 0.00 H ATOM 59615 H2 WAT 2484 136.485 76.563 63.640 1.00 0.00 H TER 59617 WAT 2484 ATOM 59617 O WAT 2485 135.497 81.333 59.368 1.00 0.00 O ATOM 59618 H1 WAT 2485 136.231 80.888 58.943 1.00 0.00 H ATOM 59619 H2 WAT 2485 135.797 82.234 59.483 1.00 0.00 H TER 59621 WAT 2485 ATOM 59621 O WAT 2486 3.420 12.666 81.464 1.00 0.00 O ATOM 59622 H1 WAT 2486 4.341 12.462 81.621 1.00 0.00 H ATOM 59623 H2 WAT 2486 2.968 11.828 81.567 1.00 0.00 H TER 59625 WAT 2486 ATOM 59625 O WAT 2487 110.138 97.220 110.832 1.00 0.00 O ATOM 59626 H1 WAT 2487 109.413 97.618 111.313 1.00 0.00 H ATOM 59627 H2 WAT 2487 110.408 96.480 111.374 1.00 0.00 H TER 59629 WAT 2487 ATOM 59629 O WAT 2488 98.554 133.858 3.835 1.00 0.00 O ATOM 59630 H1 WAT 2488 98.031 134.658 3.781 1.00 0.00 H ATOM 59631 H2 WAT 2488 98.392 133.526 4.718 1.00 0.00 H TER 59633 WAT 2488 ATOM 59633 O WAT 2489 98.058 20.309 156.621 1.00 0.00 O ATOM 59634 H1 WAT 2489 98.309 21.200 156.865 1.00 0.00 H ATOM 59635 H2 WAT 2489 97.428 20.424 155.909 1.00 0.00 H TER 59637 WAT 2489 ATOM 59637 O WAT 2490 101.103 28.195 7.890 1.00 0.00 O ATOM 59638 H1 WAT 2490 100.900 27.463 8.472 1.00 0.00 H ATOM 59639 H2 WAT 2490 101.365 27.781 7.067 1.00 0.00 H TER 59641 WAT 2490 ATOM 59641 O WAT 2491 99.287 102.407 122.203 1.00 0.00 O ATOM 59642 H1 WAT 2491 98.369 102.537 121.969 1.00 0.00 H ATOM 59643 H2 WAT 2491 99.474 101.504 121.947 1.00 0.00 H TER 59645 WAT 2491 ATOM 59645 O WAT 2492 95.047 6.162 153.773 1.00 0.00 O ATOM 59646 H1 WAT 2492 94.661 6.891 153.287 1.00 0.00 H ATOM 59647 H2 WAT 2492 95.660 6.577 154.379 1.00 0.00 H TER 59649 WAT 2492 ATOM 59649 O WAT 2493 31.036 82.216 2.407 1.00 0.00 O ATOM 59650 H1 WAT 2493 31.796 82.570 1.944 1.00 0.00 H ATOM 59651 H2 WAT 2493 31.391 81.506 2.943 1.00 0.00 H TER 59653 WAT 2493 ATOM 59653 O WAT 2494 26.229 104.664 80.603 1.00 0.00 O ATOM 59654 H1 WAT 2494 26.650 103.806 80.561 1.00 0.00 H ATOM 59655 H2 WAT 2494 26.399 104.971 81.494 1.00 0.00 H TER 59657 WAT 2494 ATOM 59657 O WAT 2495 129.676 22.608 154.023 1.00 0.00 O ATOM 59658 H1 WAT 2495 129.109 23.083 154.630 1.00 0.00 H ATOM 59659 H2 WAT 2495 129.082 22.038 153.535 1.00 0.00 H TER 59661 WAT 2495 ATOM 59661 O WAT 2496 10.824 111.408 57.993 1.00 0.00 O ATOM 59662 H1 WAT 2496 11.619 111.210 58.487 1.00 0.00 H ATOM 59663 H2 WAT 2496 10.202 110.730 58.258 1.00 0.00 H TER 59665 WAT 2496 ATOM 59665 O WAT 2497 75.830 115.404 151.504 1.00 0.00 O ATOM 59666 H1 WAT 2497 75.535 116.184 151.973 1.00 0.00 H ATOM 59667 H2 WAT 2497 76.747 115.584 151.294 1.00 0.00 H TER 59669 WAT 2497 ATOM 59669 O WAT 2498 83.344 90.530 101.716 1.00 0.00 O ATOM 59670 H1 WAT 2498 83.655 90.709 102.604 1.00 0.00 H ATOM 59671 H2 WAT 2498 82.801 91.287 101.496 1.00 0.00 H TER 59673 WAT 2498 ATOM 59673 O WAT 2499 4.913 40.148 157.631 1.00 0.00 O ATOM 59674 H1 WAT 2499 5.018 40.346 156.701 1.00 0.00 H ATOM 59675 H2 WAT 2499 3.966 40.160 157.774 1.00 0.00 H TER 59677 WAT 2499 ATOM 59677 O WAT 2500 32.250 131.839 76.759 1.00 0.00 O ATOM 59678 H1 WAT 2500 32.378 132.750 76.493 1.00 0.00 H ATOM 59679 H2 WAT 2500 32.566 131.326 76.015 1.00 0.00 H TER 59681 WAT 2500 ATOM 59681 O WAT 2501 144.787 43.883 2.463 1.00 0.00 O ATOM 59682 H1 WAT 2501 144.489 44.759 2.710 1.00 0.00 H ATOM 59683 H2 WAT 2501 144.020 43.472 2.065 1.00 0.00 H TER 59685 WAT 2501 ATOM 59685 O WAT 2502 117.242 57.667 96.790 1.00 0.00 O ATOM 59686 H1 WAT 2502 117.322 57.584 97.741 1.00 0.00 H ATOM 59687 H2 WAT 2502 117.271 58.610 96.630 1.00 0.00 H TER 59689 WAT 2502 ATOM 59689 O WAT 2503 90.429 7.208 64.767 1.00 0.00 O ATOM 59690 H1 WAT 2503 91.249 7.550 65.122 1.00 0.00 H ATOM 59691 H2 WAT 2503 89.959 7.983 64.460 1.00 0.00 H TER 59693 WAT 2503 ATOM 59693 O WAT 2504 130.958 67.879 140.773 1.00 0.00 O ATOM 59694 H1 WAT 2504 131.440 68.529 140.261 1.00 0.00 H ATOM 59695 H2 WAT 2504 130.045 67.995 140.507 1.00 0.00 H TER 59697 WAT 2504 ATOM 59697 O WAT 2505 138.586 1.332 92.916 1.00 0.00 O ATOM 59698 H1 WAT 2505 138.276 1.737 93.727 1.00 0.00 H ATOM 59699 H2 WAT 2505 139.488 1.641 92.825 1.00 0.00 H TER 59701 WAT 2505 ATOM 59701 O WAT 2506 127.802 79.102 87.997 1.00 0.00 O ATOM 59702 H1 WAT 2506 127.790 80.059 87.983 1.00 0.00 H ATOM 59703 H2 WAT 2506 126.879 78.851 87.946 1.00 0.00 H TER 59705 WAT 2506 ATOM 59705 O WAT 2507 30.153 133.848 91.187 1.00 0.00 O ATOM 59706 H1 WAT 2507 30.191 134.036 90.249 1.00 0.00 H ATOM 59707 H2 WAT 2507 30.287 132.902 91.248 1.00 0.00 H TER 59709 WAT 2507 ATOM 59709 O WAT 2508 71.437 54.419 93.155 1.00 0.00 O ATOM 59710 H1 WAT 2508 71.708 55.337 93.168 1.00 0.00 H ATOM 59711 H2 WAT 2508 71.840 54.062 92.363 1.00 0.00 H TER 59713 WAT 2508 ATOM 59713 O WAT 2509 50.194 8.968 104.271 1.00 0.00 O ATOM 59714 H1 WAT 2509 49.960 8.069 104.040 1.00 0.00 H ATOM 59715 H2 WAT 2509 49.355 9.403 104.423 1.00 0.00 H TER 59717 WAT 2509 ATOM 59717 O WAT 2510 125.451 39.264 108.752 1.00 0.00 O ATOM 59718 H1 WAT 2510 125.992 40.039 108.904 1.00 0.00 H ATOM 59719 H2 WAT 2510 124.789 39.296 109.442 1.00 0.00 H TER 59721 WAT 2510 ATOM 59721 O WAT 2511 81.828 103.620 61.470 1.00 0.00 O ATOM 59722 H1 WAT 2511 82.008 104.034 60.626 1.00 0.00 H ATOM 59723 H2 WAT 2511 80.876 103.515 61.486 1.00 0.00 H TER 59725 WAT 2511 ATOM 59725 O WAT 2512 15.639 145.476 66.605 1.00 0.00 O ATOM 59726 H1 WAT 2512 15.118 144.980 65.973 1.00 0.00 H ATOM 59727 H2 WAT 2512 15.793 144.863 67.323 1.00 0.00 H TER 59729 WAT 2512 ATOM 59729 O WAT 2513 136.003 141.893 97.372 1.00 0.00 O ATOM 59730 H1 WAT 2513 135.742 142.191 96.501 1.00 0.00 H ATOM 59731 H2 WAT 2513 135.331 142.246 97.957 1.00 0.00 H TER 59733 WAT 2513 ATOM 59733 O WAT 2514 37.382 11.763 20.069 1.00 0.00 O ATOM 59734 H1 WAT 2514 38.298 11.755 20.347 1.00 0.00 H ATOM 59735 H2 WAT 2514 37.369 11.235 19.271 1.00 0.00 H TER 59737 WAT 2514 ATOM 59737 O WAT 2515 104.341 107.558 86.935 1.00 0.00 O ATOM 59738 H1 WAT 2515 104.433 107.178 87.808 1.00 0.00 H ATOM 59739 H2 WAT 2515 103.404 107.730 86.846 1.00 0.00 H TER 59741 WAT 2515 ATOM 59741 O WAT 2516 105.242 43.337 116.094 1.00 0.00 O ATOM 59742 H1 WAT 2516 105.819 43.059 115.383 1.00 0.00 H ATOM 59743 H2 WAT 2516 105.590 44.186 116.367 1.00 0.00 H TER 59745 WAT 2516 ATOM 59745 O WAT 2517 59.757 72.918 107.924 1.00 0.00 O ATOM 59746 H1 WAT 2517 59.294 73.726 108.145 1.00 0.00 H ATOM 59747 H2 WAT 2517 60.126 73.083 107.056 1.00 0.00 H TER 59749 WAT 2517 ATOM 59749 O WAT 2518 79.473 40.040 69.593 1.00 0.00 O ATOM 59750 H1 WAT 2518 80.223 39.747 69.076 1.00 0.00 H ATOM 59751 H2 WAT 2518 79.581 40.989 69.656 1.00 0.00 H TER 59753 WAT 2518 ATOM 59753 O WAT 2519 54.345 95.029 5.644 1.00 0.00 O ATOM 59754 H1 WAT 2519 54.287 95.035 6.599 1.00 0.00 H ATOM 59755 H2 WAT 2519 53.999 94.174 5.388 1.00 0.00 H TER 59757 WAT 2519 ATOM 59757 O WAT 2520 136.283 72.091 129.226 1.00 0.00 O ATOM 59758 H1 WAT 2520 135.683 71.781 129.905 1.00 0.00 H ATOM 59759 H2 WAT 2520 135.787 72.761 128.756 1.00 0.00 H TER 59761 WAT 2520 ATOM 59761 O WAT 2521 53.290 103.462 82.749 1.00 0.00 O ATOM 59762 H1 WAT 2521 53.674 104.278 83.070 1.00 0.00 H ATOM 59763 H2 WAT 2521 54.003 102.825 82.801 1.00 0.00 H TER 59765 WAT 2521 ATOM 59765 O WAT 2522 11.139 112.842 3.964 1.00 0.00 O ATOM 59766 H1 WAT 2522 12.041 112.769 4.275 1.00 0.00 H ATOM 59767 H2 WAT 2522 10.892 111.948 3.730 1.00 0.00 H TER 59769 WAT 2522 ATOM 59769 O WAT 2523 83.403 8.033 18.092 1.00 0.00 O ATOM 59770 H1 WAT 2523 83.972 7.291 18.297 1.00 0.00 H ATOM 59771 H2 WAT 2523 82.797 8.083 18.831 1.00 0.00 H TER 59773 WAT 2523 ATOM 59773 O WAT 2524 86.191 145.333 150.325 1.00 0.00 O ATOM 59774 H1 WAT 2524 87.103 145.069 150.445 1.00 0.00 H ATOM 59775 H2 WAT 2524 85.973 145.046 149.438 1.00 0.00 H TER 59777 WAT 2524 ATOM 59777 O WAT 2525 65.269 18.875 24.014 1.00 0.00 O ATOM 59778 H1 WAT 2525 64.473 19.403 23.947 1.00 0.00 H ATOM 59779 H2 WAT 2525 65.356 18.692 24.950 1.00 0.00 H TER 59781 WAT 2525 ATOM 59781 O WAT 2526 112.029 71.436 120.337 1.00 0.00 O ATOM 59782 H1 WAT 2526 111.687 71.489 121.229 1.00 0.00 H ATOM 59783 H2 WAT 2526 112.394 70.553 120.272 1.00 0.00 H TER 59785 WAT 2526 ATOM 59785 O WAT 2527 97.742 111.154 2.502 1.00 0.00 O ATOM 59786 H1 WAT 2527 96.932 111.591 2.239 1.00 0.00 H ATOM 59787 H2 WAT 2527 97.800 110.391 1.926 1.00 0.00 H TER 59789 WAT 2527 ATOM 59789 O WAT 2528 132.704 6.717 151.429 1.00 0.00 O ATOM 59790 H1 WAT 2528 132.154 5.958 151.235 1.00 0.00 H ATOM 59791 H2 WAT 2528 133.100 6.516 152.277 1.00 0.00 H TER 59793 WAT 2528 ATOM 59793 O WAT 2529 130.392 91.259 79.214 1.00 0.00 O ATOM 59794 H1 WAT 2529 129.476 91.387 79.462 1.00 0.00 H ATOM 59795 H2 WAT 2529 130.756 90.714 79.911 1.00 0.00 H TER 59797 WAT 2529 ATOM 59797 O WAT 2530 121.100 34.994 104.455 1.00 0.00 O ATOM 59798 H1 WAT 2530 121.725 35.198 103.759 1.00 0.00 H ATOM 59799 H2 WAT 2530 120.819 35.849 104.781 1.00 0.00 H TER 59801 WAT 2530 ATOM 59801 O WAT 2531 11.102 92.111 61.722 1.00 0.00 O ATOM 59802 H1 WAT 2531 10.518 91.392 61.480 1.00 0.00 H ATOM 59803 H2 WAT 2531 10.809 92.848 61.186 1.00 0.00 H TER 59805 WAT 2531 ATOM 59805 O WAT 2532 39.493 22.747 98.787 1.00 0.00 O ATOM 59806 H1 WAT 2532 39.504 21.877 99.187 1.00 0.00 H ATOM 59807 H2 WAT 2532 40.061 22.666 98.021 1.00 0.00 H TER 59809 WAT 2532 ATOM 59809 O WAT 2533 58.434 72.096 133.429 1.00 0.00 O ATOM 59810 H1 WAT 2533 59.273 72.145 132.971 1.00 0.00 H ATOM 59811 H2 WAT 2533 58.552 72.643 134.205 1.00 0.00 H TER 59813 WAT 2533 ATOM 59813 O WAT 2534 117.953 76.981 157.722 1.00 0.00 O ATOM 59814 H1 WAT 2534 117.544 77.307 158.523 1.00 0.00 H ATOM 59815 H2 WAT 2534 117.235 76.930 157.090 1.00 0.00 H TER 59817 WAT 2534 ATOM 59817 O WAT 2535 115.237 131.976 13.454 1.00 0.00 O ATOM 59818 H1 WAT 2535 114.959 131.843 12.548 1.00 0.00 H ATOM 59819 H2 WAT 2535 116.037 131.457 13.538 1.00 0.00 H TER 59821 WAT 2535 ATOM 59821 O WAT 2536 17.096 39.589 97.096 1.00 0.00 O ATOM 59822 H1 WAT 2536 16.596 38.786 96.949 1.00 0.00 H ATOM 59823 H2 WAT 2536 17.555 39.437 97.922 1.00 0.00 H TER 59825 WAT 2536 ATOM 59825 O WAT 2537 144.863 64.384 131.421 1.00 0.00 O ATOM 59826 H1 WAT 2537 144.530 65.202 131.789 1.00 0.00 H ATOM 59827 H2 WAT 2537 144.626 63.717 132.065 1.00 0.00 H TER 59829 WAT 2537 ATOM 59829 O WAT 2538 46.786 14.588 128.256 1.00 0.00 O ATOM 59830 H1 WAT 2538 45.898 14.304 128.039 1.00 0.00 H ATOM 59831 H2 WAT 2538 46.750 14.795 129.190 1.00 0.00 H TER 59833 WAT 2538 ATOM 59833 O WAT 2539 36.714 96.213 92.729 1.00 0.00 O ATOM 59834 H1 WAT 2539 36.771 95.470 93.329 1.00 0.00 H ATOM 59835 H2 WAT 2539 36.733 95.818 91.857 1.00 0.00 H TER 59837 WAT 2539 ATOM 59837 O WAT 2540 46.294 20.097 2.856 1.00 0.00 O ATOM 59838 H1 WAT 2540 46.919 20.822 2.855 1.00 0.00 H ATOM 59839 H2 WAT 2540 46.837 19.313 2.939 1.00 0.00 H TER 59841 WAT 2540 ATOM 59841 O WAT 2541 37.913 1.305 7.961 1.00 0.00 O ATOM 59842 H1 WAT 2541 37.677 0.913 8.802 1.00 0.00 H ATOM 59843 H2 WAT 2541 38.183 0.563 7.419 1.00 0.00 H TER 59845 WAT 2541 ATOM 59845 O WAT 2542 3.143 65.832 153.900 1.00 0.00 O ATOM 59846 H1 WAT 2542 2.288 65.446 153.710 1.00 0.00 H ATOM 59847 H2 WAT 2542 3.696 65.562 153.167 1.00 0.00 H TER 59849 WAT 2542 ATOM 59849 O WAT 2543 17.353 22.127 148.910 1.00 0.00 O ATOM 59850 H1 WAT 2543 17.867 22.580 149.579 1.00 0.00 H ATOM 59851 H2 WAT 2543 17.608 21.208 148.995 1.00 0.00 H TER 59853 WAT 2543 ATOM 59853 O WAT 2544 91.635 25.611 96.282 1.00 0.00 O ATOM 59854 H1 WAT 2544 90.844 25.154 96.567 1.00 0.00 H ATOM 59855 H2 WAT 2544 91.840 26.208 97.002 1.00 0.00 H TER 59857 WAT 2544 ATOM 59857 O WAT 2545 139.550 73.031 118.035 1.00 0.00 O ATOM 59858 H1 WAT 2545 139.244 72.149 118.248 1.00 0.00 H ATOM 59859 H2 WAT 2545 138.888 73.375 117.436 1.00 0.00 H TER 59861 WAT 2545 ATOM 59861 O WAT 2546 128.415 107.255 103.986 1.00 0.00 O ATOM 59862 H1 WAT 2546 128.472 106.300 104.007 1.00 0.00 H ATOM 59863 H2 WAT 2546 127.512 107.446 104.238 1.00 0.00 H TER 59865 WAT 2546 ATOM 59865 O WAT 2547 61.694 32.770 151.502 1.00 0.00 O ATOM 59866 H1 WAT 2547 61.757 32.696 150.549 1.00 0.00 H ATOM 59867 H2 WAT 2547 60.929 32.242 151.733 1.00 0.00 H TER 59869 WAT 2547 ATOM 59869 O WAT 2548 8.685 117.815 9.574 1.00 0.00 O ATOM 59870 H1 WAT 2548 8.197 117.113 9.144 1.00 0.00 H ATOM 59871 H2 WAT 2548 8.672 118.536 8.945 1.00 0.00 H TER 59873 WAT 2548 ATOM 59873 O WAT 2549 10.311 6.759 17.647 1.00 0.00 O ATOM 59874 H1 WAT 2549 10.621 6.932 18.536 1.00 0.00 H ATOM 59875 H2 WAT 2549 9.644 6.080 17.754 1.00 0.00 H TER 59877 WAT 2549 ATOM 59877 O WAT 2550 88.578 1.455 115.770 1.00 0.00 O ATOM 59878 H1 WAT 2550 88.135 0.654 116.051 1.00 0.00 H ATOM 59879 H2 WAT 2550 88.322 1.561 114.854 1.00 0.00 H TER 59881 WAT 2550 ATOM 59881 O WAT 2551 9.837 47.965 75.541 1.00 0.00 O ATOM 59882 H1 WAT 2551 10.580 47.990 76.145 1.00 0.00 H ATOM 59883 H2 WAT 2551 10.222 47.725 74.698 1.00 0.00 H TER 59885 WAT 2551 ATOM 59885 O WAT 2552 87.257 38.631 56.508 1.00 0.00 O ATOM 59886 H1 WAT 2552 86.469 38.395 56.017 1.00 0.00 H ATOM 59887 H2 WAT 2552 87.898 37.963 56.266 1.00 0.00 H TER 59889 WAT 2552 ATOM 59889 O WAT 2553 64.883 24.050 130.970 1.00 0.00 O ATOM 59890 H1 WAT 2553 64.943 24.584 130.178 1.00 0.00 H ATOM 59891 H2 WAT 2553 64.918 24.682 131.688 1.00 0.00 H TER 59893 WAT 2553 ATOM 59893 O WAT 2554 50.372 93.970 151.414 1.00 0.00 O ATOM 59894 H1 WAT 2554 51.269 93.998 151.082 1.00 0.00 H ATOM 59895 H2 WAT 2554 50.381 94.546 152.179 1.00 0.00 H TER 59897 WAT 2554 ATOM 59897 O WAT 2555 30.974 40.941 81.932 1.00 0.00 O ATOM 59898 H1 WAT 2555 31.445 40.885 81.101 1.00 0.00 H ATOM 59899 H2 WAT 2555 31.362 41.694 82.377 1.00 0.00 H TER 59901 WAT 2555 ATOM 59901 O WAT 2556 70.623 118.256 73.687 1.00 0.00 O ATOM 59902 H1 WAT 2556 70.818 118.810 72.931 1.00 0.00 H ATOM 59903 H2 WAT 2556 69.676 118.123 73.649 1.00 0.00 H TER 59905 WAT 2556 ATOM 59905 O WAT 2557 122.494 47.671 143.589 1.00 0.00 O ATOM 59906 H1 WAT 2557 123.407 47.888 143.778 1.00 0.00 H ATOM 59907 H2 WAT 2557 122.545 46.963 142.946 1.00 0.00 H TER 59909 WAT 2557 ATOM 59909 O WAT 2558 81.405 60.449 146.555 1.00 0.00 O ATOM 59910 H1 WAT 2558 80.948 61.017 147.175 1.00 0.00 H ATOM 59911 H2 WAT 2558 80.816 59.705 146.432 1.00 0.00 H TER 59913 WAT 2558 ATOM 59913 O WAT 2559 19.423 81.274 14.834 1.00 0.00 O ATOM 59914 H1 WAT 2559 18.631 81.146 15.357 1.00 0.00 H ATOM 59915 H2 WAT 2559 19.666 82.187 14.986 1.00 0.00 H TER 59917 WAT 2559 ATOM 59917 O WAT 2560 105.660 102.504 131.317 1.00 0.00 O ATOM 59918 H1 WAT 2560 105.134 103.225 131.664 1.00 0.00 H ATOM 59919 H2 WAT 2560 105.603 101.823 131.988 1.00 0.00 H TER 59921 WAT 2560 ATOM 59921 O WAT 2561 58.834 94.594 116.157 1.00 0.00 O ATOM 59922 H1 WAT 2561 58.164 94.606 115.474 1.00 0.00 H ATOM 59923 H2 WAT 2561 58.670 93.784 116.640 1.00 0.00 H TER 59925 WAT 2561 ATOM 59925 O WAT 2562 76.604 6.519 112.312 1.00 0.00 O ATOM 59926 H1 WAT 2562 76.670 6.777 111.392 1.00 0.00 H ATOM 59927 H2 WAT 2562 77.310 6.997 112.746 1.00 0.00 H TER 59929 WAT 2562 ATOM 59929 O WAT 2563 37.946 47.492 119.335 1.00 0.00 O ATOM 59930 H1 WAT 2563 37.890 46.789 119.982 1.00 0.00 H ATOM 59931 H2 WAT 2563 38.194 47.051 118.523 1.00 0.00 H TER 59933 WAT 2563 ATOM 59933 O WAT 2564 27.197 38.246 66.034 1.00 0.00 O ATOM 59934 H1 WAT 2564 26.959 38.762 66.804 1.00 0.00 H ATOM 59935 H2 WAT 2564 28.049 38.593 65.767 1.00 0.00 H TER 59937 WAT 2564 ATOM 59937 O WAT 2565 91.204 76.731 114.866 1.00 0.00 O ATOM 59938 H1 WAT 2565 90.657 76.059 114.459 1.00 0.00 H ATOM 59939 H2 WAT 2565 90.693 77.536 114.787 1.00 0.00 H TER 59941 WAT 2565 ATOM 59941 O WAT 2566 95.679 128.626 104.659 1.00 0.00 O ATOM 59942 H1 WAT 2566 96.080 128.932 105.473 1.00 0.00 H ATOM 59943 H2 WAT 2566 94.760 128.481 104.884 1.00 0.00 H TER 59945 WAT 2566 ATOM 59945 O WAT 2567 32.113 23.378 83.528 1.00 0.00 O ATOM 59946 H1 WAT 2567 31.461 23.923 83.088 1.00 0.00 H ATOM 59947 H2 WAT 2567 31.638 22.975 84.255 1.00 0.00 H TER 59949 WAT 2567 ATOM 59949 O WAT 2568 26.246 27.508 109.774 1.00 0.00 O ATOM 59950 H1 WAT 2568 26.345 28.288 109.227 1.00 0.00 H ATOM 59951 H2 WAT 2568 25.862 26.854 109.190 1.00 0.00 H TER 59953 WAT 2568 ATOM 59953 O WAT 2569 118.439 25.089 140.948 1.00 0.00 O ATOM 59954 H1 WAT 2569 118.670 24.975 140.026 1.00 0.00 H ATOM 59955 H2 WAT 2569 117.545 25.429 140.931 1.00 0.00 H TER 59957 WAT 2569 ATOM 59957 O WAT 2570 77.066 23.103 101.571 1.00 0.00 O ATOM 59958 H1 WAT 2570 76.626 22.999 100.728 1.00 0.00 H ATOM 59959 H2 WAT 2570 76.399 22.875 102.220 1.00 0.00 H TER 59961 WAT 2570 ATOM 59961 O WAT 2571 42.862 100.274 156.216 1.00 0.00 O ATOM 59962 H1 WAT 2571 43.352 100.796 156.852 1.00 0.00 H ATOM 59963 H2 WAT 2571 43.161 100.593 155.364 1.00 0.00 H TER 59965 WAT 2571 ATOM 59965 O WAT 2572 142.427 32.341 138.888 1.00 0.00 O ATOM 59966 H1 WAT 2572 142.343 33.033 139.544 1.00 0.00 H ATOM 59967 H2 WAT 2572 142.912 32.749 138.170 1.00 0.00 H TER 59969 WAT 2572 ATOM 59969 O WAT 2573 28.542 22.358 141.950 1.00 0.00 O ATOM 59970 H1 WAT 2573 28.081 22.407 142.787 1.00 0.00 H ATOM 59971 H2 WAT 2573 28.312 21.497 141.600 1.00 0.00 H TER 59973 WAT 2573 ATOM 59973 O WAT 2574 130.323 133.181 79.411 1.00 0.00 O ATOM 59974 H1 WAT 2574 130.700 133.699 78.700 1.00 0.00 H ATOM 59975 H2 WAT 2574 130.818 133.443 80.187 1.00 0.00 H TER 59977 WAT 2574 ATOM 59977 O WAT 2575 0.262 116.624 80.828 1.00 0.00 O ATOM 59978 H1 WAT 2575 1.175 116.911 80.827 1.00 0.00 H ATOM 59979 H2 WAT 2575 0.256 115.841 80.277 1.00 0.00 H TER 59981 WAT 2575 ATOM 59981 O WAT 2576 1.324 65.897 69.016 1.00 0.00 O ATOM 59982 H1 WAT 2576 1.962 66.603 69.116 1.00 0.00 H ATOM 59983 H2 WAT 2576 0.519 66.337 68.743 1.00 0.00 H TER 59985 WAT 2576 ATOM 59985 O WAT 2577 0.117 117.814 86.789 1.00 0.00 O ATOM 59986 H1 WAT 2577 0.994 118.152 86.604 1.00 0.00 H ATOM 59987 H2 WAT 2577 -0.154 117.394 85.973 1.00 0.00 H TER 59989 WAT 2577 ATOM 59989 O WAT 2578 118.529 89.536 68.086 1.00 0.00 O ATOM 59990 H1 WAT 2578 119.304 89.921 67.677 1.00 0.00 H ATOM 59991 H2 WAT 2578 118.664 88.591 68.012 1.00 0.00 H TER 59993 WAT 2578 ATOM 59993 O WAT 2579 60.570 55.772 97.493 1.00 0.00 O ATOM 59994 H1 WAT 2579 59.628 55.602 97.502 1.00 0.00 H ATOM 59995 H2 WAT 2579 60.788 55.865 96.566 1.00 0.00 H TER 59997 WAT 2579 ATOM 59997 O WAT 2580 91.723 85.304 141.258 1.00 0.00 O ATOM 59998 H1 WAT 2580 91.805 84.557 141.851 1.00 0.00 H ATOM 59999 H2 WAT 2580 90.781 85.404 141.127 1.00 0.00 H TER 60001 WAT 2580 ATOM 60001 O WAT 2581 80.275 103.111 83.998 1.00 0.00 O ATOM 60002 H1 WAT 2581 80.191 102.460 83.302 1.00 0.00 H ATOM 60003 H2 WAT 2581 80.253 102.600 84.807 1.00 0.00 H TER 60005 WAT 2581 ATOM 60005 O WAT 2582 107.811 11.807 137.566 1.00 0.00 O ATOM 60006 H1 WAT 2582 107.444 11.096 138.092 1.00 0.00 H ATOM 60007 H2 WAT 2582 107.714 11.511 136.662 1.00 0.00 H TER 60009 WAT 2582 ATOM 60009 O WAT 2583 46.798 117.096 2.593 1.00 0.00 O ATOM 60010 H1 WAT 2583 47.035 116.169 2.587 1.00 0.00 H ATOM 60011 H2 WAT 2583 47.437 117.503 3.178 1.00 0.00 H TER 60013 WAT 2583 ATOM 60013 O WAT 2584 137.055 127.923 61.983 1.00 0.00 O ATOM 60014 H1 WAT 2584 136.508 127.757 62.751 1.00 0.00 H ATOM 60015 H2 WAT 2584 137.140 127.068 61.560 1.00 0.00 H TER 60017 WAT 2584 ATOM 60017 O WAT 2585 46.661 55.788 18.903 1.00 0.00 O ATOM 60018 H1 WAT 2585 45.918 56.288 18.565 1.00 0.00 H ATOM 60019 H2 WAT 2585 47.422 56.341 18.725 1.00 0.00 H TER 60021 WAT 2585 ATOM 60021 O WAT 2586 88.700 23.518 135.035 1.00 0.00 O ATOM 60022 H1 WAT 2586 89.169 23.393 134.210 1.00 0.00 H ATOM 60023 H2 WAT 2586 89.231 23.057 135.685 1.00 0.00 H TER 60025 WAT 2586 ATOM 60025 O WAT 2587 39.796 24.715 58.310 1.00 0.00 O ATOM 60026 H1 WAT 2587 40.166 24.603 57.435 1.00 0.00 H ATOM 60027 H2 WAT 2587 38.852 24.618 58.185 1.00 0.00 H TER 60029 WAT 2587 ATOM 60029 O WAT 2588 35.158 79.572 95.092 1.00 0.00 O ATOM 60030 H1 WAT 2588 35.423 80.476 94.923 1.00 0.00 H ATOM 60031 H2 WAT 2588 34.207 79.577 94.984 1.00 0.00 H TER 60033 WAT 2588 ATOM 60033 O WAT 2589 49.691 79.456 98.058 1.00 0.00 O ATOM 60034 H1 WAT 2589 50.057 78.803 97.461 1.00 0.00 H ATOM 60035 H2 WAT 2589 49.133 78.952 98.650 1.00 0.00 H TER 60037 WAT 2589 ATOM 60037 O WAT 2590 67.594 30.325 132.558 1.00 0.00 O ATOM 60038 H1 WAT 2590 67.261 29.501 132.202 1.00 0.00 H ATOM 60039 H2 WAT 2590 66.989 30.990 132.228 1.00 0.00 H TER 60041 WAT 2590 ATOM 60041 O WAT 2591 3.809 3.050 6.922 1.00 0.00 O ATOM 60042 H1 WAT 2591 4.745 3.243 6.981 1.00 0.00 H ATOM 60043 H2 WAT 2591 3.527 2.950 7.831 1.00 0.00 H TER 60045 WAT 2591 ATOM 60045 O WAT 2592 41.298 140.155 53.862 1.00 0.00 O ATOM 60046 H1 WAT 2592 41.082 139.288 54.207 1.00 0.00 H ATOM 60047 H2 WAT 2592 40.712 140.751 54.328 1.00 0.00 H TER 60049 WAT 2592 ATOM 60049 O WAT 2593 20.601 134.965 86.825 1.00 0.00 O ATOM 60050 H1 WAT 2593 20.804 134.052 87.027 1.00 0.00 H ATOM 60051 H2 WAT 2593 21.404 135.441 87.039 1.00 0.00 H TER 60053 WAT 2593 ATOM 60053 O WAT 2594 144.826 62.030 86.210 1.00 0.00 O ATOM 60054 H1 WAT 2594 144.733 62.606 85.451 1.00 0.00 H ATOM 60055 H2 WAT 2594 144.086 62.256 86.773 1.00 0.00 H TER 60057 WAT 2594 ATOM 60057 O WAT 2595 118.657 23.900 158.257 1.00 0.00 O ATOM 60058 H1 WAT 2595 119.176 23.392 157.633 1.00 0.00 H ATOM 60059 H2 WAT 2595 118.481 23.291 158.974 1.00 0.00 H TER 60061 WAT 2595 ATOM 60061 O WAT 2596 53.735 78.672 120.179 1.00 0.00 O ATOM 60062 H1 WAT 2596 53.522 79.145 120.983 1.00 0.00 H ATOM 60063 H2 WAT 2596 54.125 79.333 119.608 1.00 0.00 H TER 60065 WAT 2596 ATOM 60065 O WAT 2597 117.327 103.110 90.625 1.00 0.00 O ATOM 60066 H1 WAT 2597 117.766 102.829 91.427 1.00 0.00 H ATOM 60067 H2 WAT 2597 116.644 102.454 90.483 1.00 0.00 H TER 60069 WAT 2597 ATOM 60069 O WAT 2598 93.998 51.638 85.173 1.00 0.00 O ATOM 60070 H1 WAT 2598 93.659 52.503 84.944 1.00 0.00 H ATOM 60071 H2 WAT 2598 94.567 51.401 84.441 1.00 0.00 H TER 60073 WAT 2598 ATOM 60073 O WAT 2599 27.979 107.042 93.880 1.00 0.00 O ATOM 60074 H1 WAT 2599 28.653 106.625 93.344 1.00 0.00 H ATOM 60075 H2 WAT 2599 28.420 107.242 94.706 1.00 0.00 H TER 60077 WAT 2599 ATOM 60077 O WAT 2600 7.741 68.506 52.820 1.00 0.00 O ATOM 60078 H1 WAT 2600 7.494 69.423 52.936 1.00 0.00 H ATOM 60079 H2 WAT 2600 7.401 68.066 53.599 1.00 0.00 H TER 60081 WAT 2600 ATOM 60081 O WAT 2601 25.278 92.922 79.312 1.00 0.00 O ATOM 60082 H1 WAT 2601 25.662 92.107 78.990 1.00 0.00 H ATOM 60083 H2 WAT 2601 25.403 92.888 80.260 1.00 0.00 H TER 60085 WAT 2601 ATOM 60085 O WAT 2602 65.771 48.582 15.820 1.00 0.00 O ATOM 60086 H1 WAT 2602 65.456 49.220 15.179 1.00 0.00 H ATOM 60087 H2 WAT 2602 66.182 47.896 15.294 1.00 0.00 H TER 60089 WAT 2602 ATOM 60089 O WAT 2603 32.283 35.456 120.135 1.00 0.00 O ATOM 60090 H1 WAT 2603 31.471 35.553 120.632 1.00 0.00 H ATOM 60091 H2 WAT 2603 32.936 35.930 120.649 1.00 0.00 H TER 60093 WAT 2603 ATOM 60093 O WAT 2604 106.469 7.340 154.402 1.00 0.00 O ATOM 60094 H1 WAT 2604 106.033 6.897 155.130 1.00 0.00 H ATOM 60095 H2 WAT 2604 105.769 7.823 153.963 1.00 0.00 H TER 60097 WAT 2604 ATOM 60097 O WAT 2605 11.917 105.547 12.070 1.00 0.00 O ATOM 60098 H1 WAT 2605 12.582 105.855 12.686 1.00 0.00 H ATOM 60099 H2 WAT 2605 11.337 104.999 12.599 1.00 0.00 H TER 60101 WAT 2605 ATOM 60101 O WAT 2606 139.522 137.338 66.388 1.00 0.00 O ATOM 60102 H1 WAT 2606 138.626 137.584 66.161 1.00 0.00 H ATOM 60103 H2 WAT 2606 139.986 137.322 65.551 1.00 0.00 H TER 60105 WAT 2606 ATOM 60105 O WAT 2607 4.405 71.734 10.764 1.00 0.00 O ATOM 60106 H1 WAT 2607 4.966 71.639 9.995 1.00 0.00 H ATOM 60107 H2 WAT 2607 4.623 72.599 11.114 1.00 0.00 H TER 60109 WAT 2607 ATOM 60109 O WAT 2608 82.438 119.380 118.070 1.00 0.00 O ATOM 60110 H1 WAT 2608 81.669 118.821 118.190 1.00 0.00 H ATOM 60111 H2 WAT 2608 82.173 120.010 117.401 1.00 0.00 H TER 60113 WAT 2608 ATOM 60113 O WAT 2609 45.319 5.284 90.696 1.00 0.00 O ATOM 60114 H1 WAT 2609 45.388 5.632 89.807 1.00 0.00 H ATOM 60115 H2 WAT 2609 45.775 5.925 91.240 1.00 0.00 H TER 60117 WAT 2609 ATOM 60117 O WAT 2610 108.459 32.753 115.560 1.00 0.00 O ATOM 60118 H1 WAT 2610 108.911 32.771 116.404 1.00 0.00 H ATOM 60119 H2 WAT 2610 108.919 33.402 115.028 1.00 0.00 H TER 60121 WAT 2610 ATOM 60121 O WAT 2611 58.154 139.981 156.363 1.00 0.00 O ATOM 60122 H1 WAT 2611 58.287 139.263 156.983 1.00 0.00 H ATOM 60123 H2 WAT 2611 58.855 140.602 156.563 1.00 0.00 H TER 60125 WAT 2611 ATOM 60125 O WAT 2612 28.460 99.944 14.605 1.00 0.00 O ATOM 60126 H1 WAT 2612 28.058 99.269 15.151 1.00 0.00 H ATOM 60127 H2 WAT 2612 29.400 99.771 14.664 1.00 0.00 H TER 60129 WAT 2612 ATOM 60129 O WAT 2613 45.651 128.520 123.108 1.00 0.00 O ATOM 60130 H1 WAT 2613 45.540 127.989 122.319 1.00 0.00 H ATOM 60131 H2 WAT 2613 45.852 129.396 122.781 1.00 0.00 H TER 60133 WAT 2613 ATOM 60133 O WAT 2614 31.153 77.527 116.012 1.00 0.00 O ATOM 60134 H1 WAT 2614 31.636 76.991 115.384 1.00 0.00 H ATOM 60135 H2 WAT 2614 31.787 78.179 116.308 1.00 0.00 H TER 60137 WAT 2614 ATOM 60137 O WAT 2615 124.744 49.061 140.775 1.00 0.00 O ATOM 60138 H1 WAT 2615 124.887 49.121 141.719 1.00 0.00 H ATOM 60139 H2 WAT 2615 125.405 48.439 140.471 1.00 0.00 H TER 60141 WAT 2615 ATOM 60141 O WAT 2616 58.115 102.637 74.806 1.00 0.00 O ATOM 60142 H1 WAT 2616 58.367 102.018 74.121 1.00 0.00 H ATOM 60143 H2 WAT 2616 57.909 103.445 74.334 1.00 0.00 H TER 60145 WAT 2616 ATOM 60145 O WAT 2617 131.988 60.210 87.435 1.00 0.00 O ATOM 60146 H1 WAT 2617 132.614 60.404 88.132 1.00 0.00 H ATOM 60147 H2 WAT 2617 131.138 60.183 87.875 1.00 0.00 H TER 60149 WAT 2617 ATOM 60149 O WAT 2618 98.891 8.511 109.954 1.00 0.00 O ATOM 60150 H1 WAT 2618 98.303 8.024 110.531 1.00 0.00 H ATOM 60151 H2 WAT 2618 99.401 7.835 109.506 1.00 0.00 H TER 60153 WAT 2618 ATOM 60153 O WAT 2619 49.371 11.096 63.469 1.00 0.00 O ATOM 60154 H1 WAT 2619 48.881 11.449 62.726 1.00 0.00 H ATOM 60155 H2 WAT 2619 50.077 10.587 63.070 1.00 0.00 H TER 60157 WAT 2619 ATOM 60157 O WAT 2620 46.012 80.101 66.702 1.00 0.00 O ATOM 60158 H1 WAT 2620 46.658 80.530 67.262 1.00 0.00 H ATOM 60159 H2 WAT 2620 46.509 79.431 66.232 1.00 0.00 H TER 60161 WAT 2620 ATOM 60161 O WAT 2621 82.554 54.656 10.420 1.00 0.00 O ATOM 60162 H1 WAT 2621 82.295 54.007 9.766 1.00 0.00 H ATOM 60163 H2 WAT 2621 82.447 55.498 9.978 1.00 0.00 H TER 60165 WAT 2621 ATOM 60165 O WAT 2622 67.305 117.026 85.005 1.00 0.00 O ATOM 60166 H1 WAT 2622 67.513 116.096 84.920 1.00 0.00 H ATOM 60167 H2 WAT 2622 66.957 117.114 85.893 1.00 0.00 H TER 60169 WAT 2622 ATOM 60169 O WAT 2623 20.243 65.657 70.150 1.00 0.00 O ATOM 60170 H1 WAT 2623 20.301 66.396 70.755 1.00 0.00 H ATOM 60171 H2 WAT 2623 20.822 65.895 69.425 1.00 0.00 H TER 60173 WAT 2623 ATOM 60173 O WAT 2624 98.837 121.640 86.087 1.00 0.00 O ATOM 60174 H1 WAT 2624 99.709 121.963 85.860 1.00 0.00 H ATOM 60175 H2 WAT 2624 98.243 122.332 85.797 1.00 0.00 H TER 60177 WAT 2624 ATOM 60177 O WAT 2625 115.660 89.796 109.767 1.00 0.00 O ATOM 60178 H1 WAT 2625 114.957 90.426 109.608 1.00 0.00 H ATOM 60179 H2 WAT 2625 116.455 90.328 109.799 1.00 0.00 H TER 60181 WAT 2625 ATOM 60181 O WAT 2626 87.716 131.140 87.352 1.00 0.00 O ATOM 60182 H1 WAT 2626 87.144 130.894 86.626 1.00 0.00 H ATOM 60183 H2 WAT 2626 87.521 132.064 87.509 1.00 0.00 H TER 60185 WAT 2626 ATOM 60185 O WAT 2627 89.138 43.010 138.221 1.00 0.00 O ATOM 60186 H1 WAT 2627 88.439 43.202 137.597 1.00 0.00 H ATOM 60187 H2 WAT 2627 89.869 43.561 137.940 1.00 0.00 H TER 60189 WAT 2627 ATOM 60189 O WAT 2628 97.775 143.146 16.507 1.00 0.00 O ATOM 60190 H1 WAT 2628 97.420 143.351 15.642 1.00 0.00 H ATOM 60191 H2 WAT 2628 98.093 143.986 16.840 1.00 0.00 H TER 60193 WAT 2628 ATOM 60193 O WAT 2629 48.191 50.272 100.529 1.00 0.00 O ATOM 60194 H1 WAT 2629 47.757 50.469 99.698 1.00 0.00 H ATOM 60195 H2 WAT 2629 49.122 50.231 100.308 1.00 0.00 H TER 60197 WAT 2629 ATOM 60197 O WAT 2630 66.013 5.454 72.211 1.00 0.00 O ATOM 60198 H1 WAT 2630 65.837 4.572 71.883 1.00 0.00 H ATOM 60199 H2 WAT 2630 65.990 6.008 71.431 1.00 0.00 H TER 60201 WAT 2630 ATOM 60201 O WAT 2631 20.801 133.102 26.820 1.00 0.00 O ATOM 60202 H1 WAT 2631 20.303 132.489 27.362 1.00 0.00 H ATOM 60203 H2 WAT 2631 20.195 133.350 26.122 1.00 0.00 H TER 60205 WAT 2631 ATOM 60205 O WAT 2632 100.956 68.684 88.207 1.00 0.00 O ATOM 60206 H1 WAT 2632 101.704 68.135 87.974 1.00 0.00 H ATOM 60207 H2 WAT 2632 100.570 68.932 87.367 1.00 0.00 H TER 60209 WAT 2632 ATOM 60209 O WAT 2633 43.655 19.645 66.808 1.00 0.00 O ATOM 60210 H1 WAT 2633 43.489 20.111 67.628 1.00 0.00 H ATOM 60211 H2 WAT 2633 43.457 20.285 66.125 1.00 0.00 H TER 60213 WAT 2633 ATOM 60213 O WAT 2634 52.492 136.789 72.548 1.00 0.00 O ATOM 60214 H1 WAT 2634 52.176 137.685 72.432 1.00 0.00 H ATOM 60215 H2 WAT 2634 53.047 136.830 73.327 1.00 0.00 H TER 60217 WAT 2634 ATOM 60217 O WAT 2635 24.451 63.851 22.800 1.00 0.00 O ATOM 60218 H1 WAT 2635 23.825 64.052 23.496 1.00 0.00 H ATOM 60219 H2 WAT 2635 24.634 64.696 22.391 1.00 0.00 H TER 60221 WAT 2635 ATOM 60221 O WAT 2636 144.637 24.866 91.047 1.00 0.00 O ATOM 60222 H1 WAT 2636 144.929 24.325 90.313 1.00 0.00 H ATOM 60223 H2 WAT 2636 144.766 24.315 91.818 1.00 0.00 H TER 60225 WAT 2636 ATOM 60225 O WAT 2637 10.496 72.040 57.684 1.00 0.00 O ATOM 60226 H1 WAT 2637 10.806 71.530 58.432 1.00 0.00 H ATOM 60227 H2 WAT 2637 9.810 72.601 58.045 1.00 0.00 H TER 60229 WAT 2637 ATOM 60229 O WAT 2638 62.469 11.058 82.829 1.00 0.00 O ATOM 60230 H1 WAT 2638 61.667 11.122 82.311 1.00 0.00 H ATOM 60231 H2 WAT 2638 62.173 10.789 83.698 1.00 0.00 H TER 60233 WAT 2638 ATOM 60233 O WAT 2639 82.110 34.650 112.411 1.00 0.00 O ATOM 60234 H1 WAT 2639 81.544 33.965 112.767 1.00 0.00 H ATOM 60235 H2 WAT 2639 82.445 35.109 113.181 1.00 0.00 H TER 60237 WAT 2639 ATOM 60237 O WAT 2640 144.408 134.568 116.446 1.00 0.00 O ATOM 60238 H1 WAT 2640 144.891 134.141 115.739 1.00 0.00 H ATOM 60239 H2 WAT 2640 143.549 134.144 116.440 1.00 0.00 H TER 60241 WAT 2640 ATOM 60241 O WAT 2641 108.173 102.034 133.609 1.00 0.00 O ATOM 60242 H1 WAT 2641 107.305 101.672 133.788 1.00 0.00 H ATOM 60243 H2 WAT 2641 108.479 102.353 134.458 1.00 0.00 H TER 60245 WAT 2641 ATOM 60245 O WAT 2642 128.599 118.622 137.652 1.00 0.00 O ATOM 60246 H1 WAT 2642 129.319 118.750 137.034 1.00 0.00 H ATOM 60247 H2 WAT 2642 128.447 119.490 138.026 1.00 0.00 H TER 60249 WAT 2642 ATOM 60249 O WAT 2643 44.837 129.316 21.852 1.00 0.00 O ATOM 60250 H1 WAT 2643 44.965 130.098 21.315 1.00 0.00 H ATOM 60251 H2 WAT 2643 44.598 128.633 21.226 1.00 0.00 H TER 60253 WAT 2643 ATOM 60253 O WAT 2644 52.476 5.686 137.050 1.00 0.00 O ATOM 60254 H1 WAT 2644 53.287 5.178 137.031 1.00 0.00 H ATOM 60255 H2 WAT 2644 52.714 6.499 137.497 1.00 0.00 H TER 60257 WAT 2644 ATOM 60257 O WAT 2645 43.721 130.170 125.953 1.00 0.00 O ATOM 60258 H1 WAT 2645 43.122 130.420 125.249 1.00 0.00 H ATOM 60259 H2 WAT 2645 44.582 130.139 125.535 1.00 0.00 H TER 60261 WAT 2645 ATOM 60261 O WAT 2646 95.256 139.497 60.842 1.00 0.00 O ATOM 60262 H1 WAT 2646 94.632 139.770 61.515 1.00 0.00 H ATOM 60263 H2 WAT 2646 95.373 140.273 60.295 1.00 0.00 H TER 60265 WAT 2646 ATOM 60265 O WAT 2647 144.685 48.508 4.527 1.00 0.00 O ATOM 60266 H1 WAT 2647 145.419 49.119 4.464 1.00 0.00 H ATOM 60267 H2 WAT 2647 144.983 47.839 5.144 1.00 0.00 H TER 60269 WAT 2647 ATOM 60269 O WAT 2648 34.051 70.566 9.465 1.00 0.00 O ATOM 60270 H1 WAT 2648 33.907 71.496 9.291 1.00 0.00 H ATOM 60271 H2 WAT 2648 34.437 70.228 8.657 1.00 0.00 H TER 60273 WAT 2648 ATOM 60273 O WAT 2649 130.501 110.413 63.099 1.00 0.00 O ATOM 60274 H1 WAT 2649 131.260 109.884 62.852 1.00 0.00 H ATOM 60275 H2 WAT 2649 129.753 109.950 62.723 1.00 0.00 H TER 60277 WAT 2649 ATOM 60277 O WAT 2650 38.241 42.898 135.853 1.00 0.00 O ATOM 60278 H1 WAT 2650 37.680 43.626 135.585 1.00 0.00 H ATOM 60279 H2 WAT 2650 38.503 42.483 135.031 1.00 0.00 H TER 60281 WAT 2650 ATOM 60281 O WAT 2651 121.299 60.451 66.418 1.00 0.00 O ATOM 60282 H1 WAT 2651 120.863 59.780 66.943 1.00 0.00 H ATOM 60283 H2 WAT 2651 121.050 60.249 65.516 1.00 0.00 H TER 60285 WAT 2651 ATOM 60285 O WAT 2652 40.121 110.034 73.272 1.00 0.00 O ATOM 60286 H1 WAT 2652 40.761 110.342 73.915 1.00 0.00 H ATOM 60287 H2 WAT 2652 39.283 110.070 73.733 1.00 0.00 H TER 60289 WAT 2652 ATOM 60289 O WAT 2653 70.713 74.854 119.080 1.00 0.00 O ATOM 60290 H1 WAT 2653 70.943 75.759 118.870 1.00 0.00 H ATOM 60291 H2 WAT 2653 69.968 74.927 119.676 1.00 0.00 H TER 60293 WAT 2653 ATOM 60293 O WAT 2654 72.798 142.845 113.778 1.00 0.00 O ATOM 60294 H1 WAT 2654 73.549 142.703 113.202 1.00 0.00 H ATOM 60295 H2 WAT 2654 72.731 142.038 114.289 1.00 0.00 H TER 60297 WAT 2654 ATOM 60297 O WAT 2655 115.235 114.975 66.331 1.00 0.00 O ATOM 60298 H1 WAT 2655 115.775 115.615 65.867 1.00 0.00 H ATOM 60299 H2 WAT 2655 114.854 115.467 67.059 1.00 0.00 H TER 60301 WAT 2655 ATOM 60301 O WAT 2656 49.487 6.381 11.795 1.00 0.00 O ATOM 60302 H1 WAT 2656 49.772 7.181 12.236 1.00 0.00 H ATOM 60303 H2 WAT 2656 49.163 5.821 12.501 1.00 0.00 H TER 60305 WAT 2656 ATOM 60305 O WAT 2657 12.665 40.731 142.627 1.00 0.00 O ATOM 60306 H1 WAT 2657 11.814 41.168 142.638 1.00 0.00 H ATOM 60307 H2 WAT 2657 12.455 39.801 142.545 1.00 0.00 H TER 60309 WAT 2657 ATOM 60309 O WAT 2658 19.879 34.628 137.737 1.00 0.00 O ATOM 60310 H1 WAT 2658 20.152 34.273 138.584 1.00 0.00 H ATOM 60311 H2 WAT 2658 20.625 34.467 137.159 1.00 0.00 H TER 60313 WAT 2658 ATOM 60313 O WAT 2659 38.257 120.689 114.151 1.00 0.00 O ATOM 60314 H1 WAT 2659 39.095 120.986 114.507 1.00 0.00 H ATOM 60315 H2 WAT 2659 37.651 121.407 114.333 1.00 0.00 H TER 60317 WAT 2659 ATOM 60317 O WAT 2660 86.897 80.182 144.675 1.00 0.00 O ATOM 60318 H1 WAT 2660 86.819 80.955 144.115 1.00 0.00 H ATOM 60319 H2 WAT 2660 87.828 80.137 144.891 1.00 0.00 H TER 60321 WAT 2660 ATOM 60321 O WAT 2661 58.476 35.312 112.747 1.00 0.00 O ATOM 60322 H1 WAT 2661 58.217 36.160 113.107 1.00 0.00 H ATOM 60323 H2 WAT 2661 58.574 35.470 111.808 1.00 0.00 H TER 60325 WAT 2661 ATOM 60325 O WAT 2662 116.740 45.060 156.739 1.00 0.00 O ATOM 60326 H1 WAT 2662 116.204 45.830 156.546 1.00 0.00 H ATOM 60327 H2 WAT 2662 116.134 44.323 156.668 1.00 0.00 H TER 60329 WAT 2662 ATOM 60329 O WAT 2663 59.576 107.908 122.302 1.00 0.00 O ATOM 60330 H1 WAT 2663 59.646 107.216 122.960 1.00 0.00 H ATOM 60331 H2 WAT 2663 58.675 108.223 122.381 1.00 0.00 H TER 60333 WAT 2663 ATOM 60333 O WAT 2664 27.645 23.575 82.142 1.00 0.00 O ATOM 60334 H1 WAT 2664 28.524 23.912 82.317 1.00 0.00 H ATOM 60335 H2 WAT 2664 27.419 23.076 82.927 1.00 0.00 H TER 60337 WAT 2664 ATOM 60337 O WAT 2665 142.742 2.545 74.207 1.00 0.00 O ATOM 60338 H1 WAT 2665 142.054 3.211 74.185 1.00 0.00 H ATOM 60339 H2 WAT 2665 142.361 1.793 73.752 1.00 0.00 H TER 60341 WAT 2665 ATOM 60341 O WAT 2666 106.381 84.483 11.280 1.00 0.00 O ATOM 60342 H1 WAT 2666 107.262 84.308 10.949 1.00 0.00 H ATOM 60343 H2 WAT 2666 106.499 84.608 12.222 1.00 0.00 H TER 60345 WAT 2666 ATOM 60345 O WAT 2667 144.468 142.516 123.118 1.00 0.00 O ATOM 60346 H1 WAT 2667 143.569 142.771 123.322 1.00 0.00 H ATOM 60347 H2 WAT 2667 144.379 141.710 122.610 1.00 0.00 H TER 60349 WAT 2667 ATOM 60349 O WAT 2668 128.911 40.614 75.366 1.00 0.00 O ATOM 60350 H1 WAT 2668 128.887 41.009 74.494 1.00 0.00 H ATOM 60351 H2 WAT 2668 128.001 40.631 75.662 1.00 0.00 H TER 60353 WAT 2668 ATOM 60353 O WAT 2669 4.013 82.928 134.307 1.00 0.00 O ATOM 60354 H1 WAT 2669 4.866 82.910 134.739 1.00 0.00 H ATOM 60355 H2 WAT 2669 3.485 82.292 134.790 1.00 0.00 H TER 60357 WAT 2669 ATOM 60357 O WAT 2670 76.421 140.975 10.532 1.00 0.00 O ATOM 60358 H1 WAT 2670 76.243 141.871 10.245 1.00 0.00 H ATOM 60359 H2 WAT 2670 76.198 140.973 11.463 1.00 0.00 H TER 60361 WAT 2670 ATOM 60361 O WAT 2671 128.988 116.046 90.775 1.00 0.00 O ATOM 60362 H1 WAT 2671 129.933 116.165 90.674 1.00 0.00 H ATOM 60363 H2 WAT 2671 128.736 115.491 90.037 1.00 0.00 H TER 60365 WAT 2671 ATOM 60365 O WAT 2672 133.171 78.632 19.208 1.00 0.00 O ATOM 60366 H1 WAT 2672 132.820 78.704 20.096 1.00 0.00 H ATOM 60367 H2 WAT 2672 132.554 79.124 18.666 1.00 0.00 H TER 60369 WAT 2672 ATOM 60369 O WAT 2673 17.712 40.312 10.177 1.00 0.00 O ATOM 60370 H1 WAT 2673 17.598 39.441 9.798 1.00 0.00 H ATOM 60371 H2 WAT 2673 16.846 40.544 10.512 1.00 0.00 H TER 60373 WAT 2673 ATOM 60373 O WAT 2674 49.650 116.642 9.287 1.00 0.00 O ATOM 60374 H1 WAT 2674 48.960 117.177 9.679 1.00 0.00 H ATOM 60375 H2 WAT 2674 49.383 116.538 8.374 1.00 0.00 H TER 60377 WAT 2674 ATOM 60377 O WAT 2675 96.767 46.773 23.531 1.00 0.00 O ATOM 60378 H1 WAT 2675 97.068 47.611 23.178 1.00 0.00 H ATOM 60379 H2 WAT 2675 95.888 46.955 23.863 1.00 0.00 H TER 60381 WAT 2675 ATOM 60381 O WAT 2676 26.018 37.685 78.997 1.00 0.00 O ATOM 60382 H1 WAT 2676 25.531 37.054 78.468 1.00 0.00 H ATOM 60383 H2 WAT 2676 25.693 37.553 79.887 1.00 0.00 H TER 60385 WAT 2676 ATOM 60385 O WAT 2677 7.794 9.620 90.331 1.00 0.00 O ATOM 60386 H1 WAT 2677 7.247 10.381 90.527 1.00 0.00 H ATOM 60387 H2 WAT 2677 8.383 9.921 89.639 1.00 0.00 H TER 60389 WAT 2677 ATOM 60389 O WAT 2678 37.682 117.660 81.754 1.00 0.00 O ATOM 60390 H1 WAT 2678 37.744 116.714 81.889 1.00 0.00 H ATOM 60391 H2 WAT 2678 37.638 118.025 82.638 1.00 0.00 H TER 60393 WAT 2678 ATOM 60393 O WAT 2679 87.770 38.840 59.282 1.00 0.00 O ATOM 60394 H1 WAT 2679 87.657 38.910 58.334 1.00 0.00 H ATOM 60395 H2 WAT 2679 88.284 38.041 59.403 1.00 0.00 H TER 60397 WAT 2679 ATOM 60397 O WAT 2680 136.619 41.368 75.790 1.00 0.00 O ATOM 60398 H1 WAT 2680 137.332 41.008 76.317 1.00 0.00 H ATOM 60399 H2 WAT 2680 136.880 41.196 74.885 1.00 0.00 H TER 60401 WAT 2680 ATOM 60401 O WAT 2681 117.111 87.744 137.804 1.00 0.00 O ATOM 60402 H1 WAT 2681 117.653 87.015 138.106 1.00 0.00 H ATOM 60403 H2 WAT 2681 116.449 87.848 138.488 1.00 0.00 H TER 60405 WAT 2681 ATOM 60405 O WAT 2682 126.500 102.438 89.905 1.00 0.00 O ATOM 60406 H1 WAT 2682 127.308 102.935 89.777 1.00 0.00 H ATOM 60407 H2 WAT 2682 125.898 103.061 90.314 1.00 0.00 H TER 60409 WAT 2682 ATOM 60409 O WAT 2683 100.683 20.159 132.681 1.00 0.00 O ATOM 60410 H1 WAT 2683 99.932 20.085 133.270 1.00 0.00 H ATOM 60411 H2 WAT 2683 101.445 20.084 133.255 1.00 0.00 H TER 60413 WAT 2683 ATOM 60413 O WAT 2684 123.023 113.771 79.475 1.00 0.00 O ATOM 60414 H1 WAT 2684 123.821 113.250 79.388 1.00 0.00 H ATOM 60415 H2 WAT 2684 123.292 114.662 79.251 1.00 0.00 H TER 60417 WAT 2684 ATOM 60417 O WAT 2685 62.936 82.759 65.611 1.00 0.00 O ATOM 60418 H1 WAT 2685 63.333 82.393 66.401 1.00 0.00 H ATOM 60419 H2 WAT 2685 63.024 83.706 65.714 1.00 0.00 H TER 60421 WAT 2685 ATOM 60421 O WAT 2686 57.537 29.449 87.618 1.00 0.00 O ATOM 60422 H1 WAT 2686 57.561 29.251 86.682 1.00 0.00 H ATOM 60423 H2 WAT 2686 57.318 28.616 88.034 1.00 0.00 H TER 60425 WAT 2686 ATOM 60425 O WAT 2687 143.552 132.349 110.558 1.00 0.00 O ATOM 60426 H1 WAT 2687 143.701 131.446 110.278 1.00 0.00 H ATOM 60427 H2 WAT 2687 144.223 132.855 110.099 1.00 0.00 H TER 60429 WAT 2687 ATOM 60429 O WAT 2688 3.851 132.298 70.607 1.00 0.00 O ATOM 60430 H1 WAT 2688 3.900 131.627 69.926 1.00 0.00 H ATOM 60431 H2 WAT 2688 4.061 133.115 70.155 1.00 0.00 H TER 60433 WAT 2688 ATOM 60433 O WAT 2689 25.078 34.938 69.028 1.00 0.00 O ATOM 60434 H1 WAT 2689 25.977 34.746 69.294 1.00 0.00 H ATOM 60435 H2 WAT 2689 24.826 35.692 69.561 1.00 0.00 H TER 60437 WAT 2689 ATOM 60437 O WAT 2690 106.234 55.173 134.642 1.00 0.00 O ATOM 60438 H1 WAT 2690 106.936 55.208 135.291 1.00 0.00 H ATOM 60439 H2 WAT 2690 106.421 54.387 134.129 1.00 0.00 H TER 60441 WAT 2690 ATOM 60441 O WAT 2691 76.386 28.562 60.391 1.00 0.00 O ATOM 60442 H1 WAT 2691 76.482 28.017 61.172 1.00 0.00 H ATOM 60443 H2 WAT 2691 76.537 27.962 59.661 1.00 0.00 H TER 60445 WAT 2691 ATOM 60445 O WAT 2692 117.343 119.174 114.276 1.00 0.00 O ATOM 60446 H1 WAT 2692 117.953 119.375 114.985 1.00 0.00 H ATOM 60447 H2 WAT 2692 116.525 119.595 114.537 1.00 0.00 H TER 60449 WAT 2692 ATOM 60449 O WAT 2693 95.935 115.321 108.390 1.00 0.00 O ATOM 60450 H1 WAT 2693 96.480 115.970 107.943 1.00 0.00 H ATOM 60451 H2 WAT 2693 96.552 114.811 108.915 1.00 0.00 H TER 60453 WAT 2693 ATOM 60453 O WAT 2694 141.247 53.591 14.975 1.00 0.00 O ATOM 60454 H1 WAT 2694 140.910 54.487 14.964 1.00 0.00 H ATOM 60455 H2 WAT 2694 140.762 53.161 15.678 1.00 0.00 H TER 60457 WAT 2694 ATOM 60457 O WAT 2695 2.586 49.928 148.401 1.00 0.00 O ATOM 60458 H1 WAT 2695 3.453 49.631 148.678 1.00 0.00 H ATOM 60459 H2 WAT 2695 2.702 50.858 148.207 1.00 0.00 H TER 60461 WAT 2695 ATOM 60461 O WAT 2696 34.378 66.476 14.448 1.00 0.00 O ATOM 60462 H1 WAT 2696 34.947 66.603 15.207 1.00 0.00 H ATOM 60463 H2 WAT 2696 33.738 67.185 14.508 1.00 0.00 H TER 60465 WAT 2696 ATOM 60465 O WAT 2697 145.695 41.355 67.599 1.00 0.00 O ATOM 60466 H1 WAT 2697 145.770 42.114 67.020 1.00 0.00 H ATOM 60467 H2 WAT 2697 144.988 41.583 68.203 1.00 0.00 H TER 60469 WAT 2697 ATOM 60469 O WAT 2698 76.911 104.842 148.017 1.00 0.00 O ATOM 60470 H1 WAT 2698 77.713 104.577 147.566 1.00 0.00 H ATOM 60471 H2 WAT 2698 76.258 104.199 147.742 1.00 0.00 H TER 60473 WAT 2698 ATOM 60473 O WAT 2699 15.096 98.546 22.801 1.00 0.00 O ATOM 60474 H1 WAT 2699 14.299 98.046 22.629 1.00 0.00 H ATOM 60475 H2 WAT 2699 15.766 98.122 22.264 1.00 0.00 H TER 60477 WAT 2699 ATOM 60477 O WAT 2700 109.046 102.731 115.167 1.00 0.00 O ATOM 60478 H1 WAT 2700 109.262 102.901 116.084 1.00 0.00 H ATOM 60479 H2 WAT 2700 109.894 102.639 114.733 1.00 0.00 H TER 60481 WAT 2700 ATOM 60481 O WAT 2701 60.506 15.021 135.475 1.00 0.00 O ATOM 60482 H1 WAT 2701 61.156 14.911 134.781 1.00 0.00 H ATOM 60483 H2 WAT 2701 59.839 15.590 135.090 1.00 0.00 H TER 60485 WAT 2701 ATOM 60485 O WAT 2702 37.666 98.563 133.938 1.00 0.00 O ATOM 60486 H1 WAT 2702 36.982 97.963 134.235 1.00 0.00 H ATOM 60487 H2 WAT 2702 37.870 99.093 134.708 1.00 0.00 H TER 60489 WAT 2702 ATOM 60489 O WAT 2703 16.185 115.929 153.734 1.00 0.00 O ATOM 60490 H1 WAT 2703 16.301 116.726 154.251 1.00 0.00 H ATOM 60491 H2 WAT 2703 16.192 115.222 154.379 1.00 0.00 H TER 60493 WAT 2703 ATOM 60493 O WAT 2704 1.567 43.200 127.723 1.00 0.00 O ATOM 60494 H1 WAT 2704 1.891 42.624 127.031 1.00 0.00 H ATOM 60495 H2 WAT 2704 1.558 42.651 128.507 1.00 0.00 H TER 60497 WAT 2704 ATOM 60497 O WAT 2705 41.410 38.169 133.140 1.00 0.00 O ATOM 60498 H1 WAT 2705 41.469 37.251 133.401 1.00 0.00 H ATOM 60499 H2 WAT 2705 40.923 38.153 132.316 1.00 0.00 H TER 60501 WAT 2705 ATOM 60501 O WAT 2706 67.163 82.634 154.099 1.00 0.00 O ATOM 60502 H1 WAT 2706 66.419 82.063 154.293 1.00 0.00 H ATOM 60503 H2 WAT 2706 67.892 82.033 153.945 1.00 0.00 H TER 60505 WAT 2706 ATOM 60505 O WAT 2707 17.841 71.285 87.958 1.00 0.00 O ATOM 60506 H1 WAT 2707 18.708 71.376 87.562 1.00 0.00 H ATOM 60507 H2 WAT 2707 17.512 72.181 88.023 1.00 0.00 H TER 60509 WAT 2707 ATOM 60509 O WAT 2708 86.776 116.538 67.645 1.00 0.00 O ATOM 60510 H1 WAT 2708 87.697 116.642 67.883 1.00 0.00 H ATOM 60511 H2 WAT 2708 86.324 117.230 68.127 1.00 0.00 H TER 60513 WAT 2708 ATOM 60513 O WAT 2709 12.373 3.370 66.957 1.00 0.00 O ATOM 60514 H1 WAT 2709 11.904 2.896 66.270 1.00 0.00 H ATOM 60515 H2 WAT 2709 12.214 4.293 66.764 1.00 0.00 H TER 60517 WAT 2709 ATOM 60517 O WAT 2710 64.594 81.546 153.934 1.00 0.00 O ATOM 60518 H1 WAT 2710 64.024 80.811 154.160 1.00 0.00 H ATOM 60519 H2 WAT 2710 64.322 81.798 153.051 1.00 0.00 H TER 60521 WAT 2710 ATOM 60521 O WAT 2711 60.814 71.426 92.359 1.00 0.00 O ATOM 60522 H1 WAT 2711 60.572 71.525 91.438 1.00 0.00 H ATOM 60523 H2 WAT 2711 60.920 70.482 92.478 1.00 0.00 H TER 60525 WAT 2711 ATOM 60525 O WAT 2712 135.048 111.972 71.293 1.00 0.00 O ATOM 60526 H1 WAT 2712 135.397 112.823 71.029 1.00 0.00 H ATOM 60527 H2 WAT 2712 134.100 112.101 71.325 1.00 0.00 H TER 60529 WAT 2712 ATOM 60529 O WAT 2713 40.983 38.943 116.321 1.00 0.00 O ATOM 60530 H1 WAT 2713 41.164 39.394 117.146 1.00 0.00 H ATOM 60531 H2 WAT 2713 41.842 38.653 116.013 1.00 0.00 H TER 60533 WAT 2713 ATOM 60533 O WAT 2714 57.315 28.484 63.956 1.00 0.00 O ATOM 60534 H1 WAT 2714 56.490 28.649 63.499 1.00 0.00 H ATOM 60535 H2 WAT 2714 57.955 28.353 63.257 1.00 0.00 H TER 60537 WAT 2714 ATOM 60537 O WAT 2715 7.449 94.556 141.195 1.00 0.00 O ATOM 60538 H1 WAT 2715 7.170 95.099 140.458 1.00 0.00 H ATOM 60539 H2 WAT 2715 7.157 93.673 140.966 1.00 0.00 H TER 60541 WAT 2715 ATOM 60541 O WAT 2716 10.222 98.599 94.271 1.00 0.00 O ATOM 60542 H1 WAT 2716 10.023 99.145 93.511 1.00 0.00 H ATOM 60543 H2 WAT 2716 10.069 97.703 93.969 1.00 0.00 H TER 60545 WAT 2716 ATOM 60545 O WAT 2717 141.889 37.966 144.598 1.00 0.00 O ATOM 60546 H1 WAT 2717 142.709 37.935 145.090 1.00 0.00 H ATOM 60547 H2 WAT 2717 142.132 37.706 143.709 1.00 0.00 H TER 60549 WAT 2717 ATOM 60549 O WAT 2718 140.495 125.678 84.657 1.00 0.00 O ATOM 60550 H1 WAT 2718 140.734 126.559 84.947 1.00 0.00 H ATOM 60551 H2 WAT 2718 140.007 125.309 85.393 1.00 0.00 H TER 60553 WAT 2718 ATOM 60553 O WAT 2719 141.662 133.870 121.256 1.00 0.00 O ATOM 60554 H1 WAT 2719 141.953 134.773 121.383 1.00 0.00 H ATOM 60555 H2 WAT 2719 142.442 133.408 120.948 1.00 0.00 H TER 60557 WAT 2719 ATOM 60557 O WAT 2720 16.932 6.580 96.253 1.00 0.00 O ATOM 60558 H1 WAT 2720 16.642 6.906 97.105 1.00 0.00 H ATOM 60559 H2 WAT 2720 16.741 7.295 95.645 1.00 0.00 H TER 60561 WAT 2720 ATOM 60561 O WAT 2721 57.667 136.636 150.325 1.00 0.00 O ATOM 60562 H1 WAT 2721 57.231 136.351 151.128 1.00 0.00 H ATOM 60563 H2 WAT 2721 58.465 136.108 150.286 1.00 0.00 H TER 60565 WAT 2721 ATOM 60565 O WAT 2722 114.670 101.428 133.988 1.00 0.00 O ATOM 60566 H1 WAT 2722 114.744 100.722 134.631 1.00 0.00 H ATOM 60567 H2 WAT 2722 113.742 101.443 133.756 1.00 0.00 H TER 60569 WAT 2722 ATOM 60569 O WAT 2723 130.037 121.399 9.717 1.00 0.00 O ATOM 60570 H1 WAT 2723 129.913 120.771 10.429 1.00 0.00 H ATOM 60571 H2 WAT 2723 129.846 120.901 8.923 1.00 0.00 H TER 60573 WAT 2723 ATOM 60573 O WAT 2724 89.623 122.136 99.175 1.00 0.00 O ATOM 60574 H1 WAT 2724 89.885 122.452 98.310 1.00 0.00 H ATOM 60575 H2 WAT 2724 88.667 122.115 99.143 1.00 0.00 H TER 60577 WAT 2724 ATOM 60577 O WAT 2725 83.476 1.482 72.819 1.00 0.00 O ATOM 60578 H1 WAT 2725 83.906 0.658 73.048 1.00 0.00 H ATOM 60579 H2 WAT 2725 84.195 2.074 72.598 1.00 0.00 H TER 60581 WAT 2725 ATOM 60581 O WAT 2726 37.604 126.222 153.802 1.00 0.00 O ATOM 60582 H1 WAT 2726 36.786 126.614 154.109 1.00 0.00 H ATOM 60583 H2 WAT 2726 38.059 126.937 153.356 1.00 0.00 H TER 60585 WAT 2726 ATOM 60585 O WAT 2727 110.392 113.884 107.009 1.00 0.00 O ATOM 60586 H1 WAT 2727 110.990 113.395 106.444 1.00 0.00 H ATOM 60587 H2 WAT 2727 109.599 113.988 106.484 1.00 0.00 H TER 60589 WAT 2727 ATOM 60589 O WAT 2728 17.376 59.800 130.126 1.00 0.00 O ATOM 60590 H1 WAT 2728 18.017 60.415 130.480 1.00 0.00 H ATOM 60591 H2 WAT 2728 16.664 60.353 129.804 1.00 0.00 H TER 60593 WAT 2728 ATOM 60593 O WAT 2729 94.194 5.463 102.447 1.00 0.00 O ATOM 60594 H1 WAT 2729 93.561 4.916 101.981 1.00 0.00 H ATOM 60595 H2 WAT 2729 93.756 6.309 102.540 1.00 0.00 H TER 60597 WAT 2729 ATOM 60597 O WAT 2730 104.045 9.066 105.914 1.00 0.00 O ATOM 60598 H1 WAT 2730 104.161 8.306 106.484 1.00 0.00 H ATOM 60599 H2 WAT 2730 104.404 9.799 106.415 1.00 0.00 H TER 60601 WAT 2730 ATOM 60601 O WAT 2731 107.432 114.458 59.147 1.00 0.00 O ATOM 60602 H1 WAT 2731 106.957 113.686 58.840 1.00 0.00 H ATOM 60603 H2 WAT 2731 107.001 115.194 58.712 1.00 0.00 H TER 60605 WAT 2731 ATOM 60605 O WAT 2732 58.549 119.927 68.320 1.00 0.00 O ATOM 60606 H1 WAT 2732 59.440 119.578 68.334 1.00 0.00 H ATOM 60607 H2 WAT 2732 58.028 119.275 68.789 1.00 0.00 H TER 60609 WAT 2732 ATOM 60609 O WAT 2733 101.650 81.127 24.030 1.00 0.00 O ATOM 60610 H1 WAT 2733 102.565 81.208 24.299 1.00 0.00 H ATOM 60611 H2 WAT 2733 101.189 81.789 24.546 1.00 0.00 H TER 60613 WAT 2733 ATOM 60613 O WAT 2734 66.222 119.116 148.956 1.00 0.00 O ATOM 60614 H1 WAT 2734 66.244 118.956 148.012 1.00 0.00 H ATOM 60615 H2 WAT 2734 65.452 119.670 149.086 1.00 0.00 H TER 60617 WAT 2734 ATOM 60617 O WAT 2735 102.063 17.524 8.507 1.00 0.00 O ATOM 60618 H1 WAT 2735 101.535 16.732 8.606 1.00 0.00 H ATOM 60619 H2 WAT 2735 101.494 18.231 8.812 1.00 0.00 H TER 60621 WAT 2735 ATOM 60621 O WAT 2736 12.942 109.715 139.030 1.00 0.00 O ATOM 60622 H1 WAT 2736 12.698 108.949 138.510 1.00 0.00 H ATOM 60623 H2 WAT 2736 12.451 110.437 138.637 1.00 0.00 H TER 60625 WAT 2736 ATOM 60625 O WAT 2737 26.335 46.389 16.316 1.00 0.00 O ATOM 60626 H1 WAT 2737 25.752 45.653 16.133 1.00 0.00 H ATOM 60627 H2 WAT 2737 26.885 46.459 15.535 1.00 0.00 H TER 60629 WAT 2737 ATOM 60629 O WAT 2738 111.889 115.469 120.011 1.00 0.00 O ATOM 60630 H1 WAT 2738 112.073 116.403 120.110 1.00 0.00 H ATOM 60631 H2 WAT 2738 111.300 115.263 120.737 1.00 0.00 H TER 60633 WAT 2738 ATOM 60633 O WAT 2739 18.428 67.119 135.560 1.00 0.00 O ATOM 60634 H1 WAT 2739 19.030 67.790 135.237 1.00 0.00 H ATOM 60635 H2 WAT 2739 18.901 66.699 136.278 1.00 0.00 H TER 60637 WAT 2739 ATOM 60637 O WAT 2740 135.371 91.905 71.566 1.00 0.00 O ATOM 60638 H1 WAT 2740 135.102 91.071 71.182 1.00 0.00 H ATOM 60639 H2 WAT 2740 134.555 92.396 71.667 1.00 0.00 H TER 60641 WAT 2740 ATOM 60641 O WAT 2741 119.105 58.395 89.514 1.00 0.00 O ATOM 60642 H1 WAT 2741 118.326 57.938 89.195 1.00 0.00 H ATOM 60643 H2 WAT 2741 119.521 57.773 90.110 1.00 0.00 H TER 60645 WAT 2741 ATOM 60645 O WAT 2742 47.831 49.704 116.213 1.00 0.00 O ATOM 60646 H1 WAT 2742 48.341 49.041 115.749 1.00 0.00 H ATOM 60647 H2 WAT 2742 47.467 50.255 115.521 1.00 0.00 H TER 60649 WAT 2742 ATOM 60649 O WAT 2743 100.400 137.615 123.787 1.00 0.00 O ATOM 60650 H1 WAT 2743 101.181 137.740 124.327 1.00 0.00 H ATOM 60651 H2 WAT 2743 99.703 138.062 124.268 1.00 0.00 H TER 60653 WAT 2743 ATOM 60653 O WAT 2744 66.774 14.301 74.159 1.00 0.00 O ATOM 60654 H1 WAT 2744 67.248 14.842 74.790 1.00 0.00 H ATOM 60655 H2 WAT 2744 67.186 13.439 74.225 1.00 0.00 H TER 60657 WAT 2744 ATOM 60657 O WAT 2745 94.779 60.808 74.003 1.00 0.00 O ATOM 60658 H1 WAT 2745 94.510 59.890 73.965 1.00 0.00 H ATOM 60659 H2 WAT 2745 95.680 60.807 73.679 1.00 0.00 H TER 60661 WAT 2745 ATOM 60661 O WAT 2746 131.076 54.248 4.540 1.00 0.00 O ATOM 60662 H1 WAT 2746 131.893 54.394 5.017 1.00 0.00 H ATOM 60663 H2 WAT 2746 131.337 53.755 3.762 1.00 0.00 H TER 60665 WAT 2746 ATOM 60665 O WAT 2747 59.286 122.874 89.126 1.00 0.00 O ATOM 60666 H1 WAT 2747 60.140 122.521 88.874 1.00 0.00 H ATOM 60667 H2 WAT 2747 59.185 123.660 88.589 1.00 0.00 H TER 60669 WAT 2747 ATOM 60669 O WAT 2748 86.667 98.686 131.073 1.00 0.00 O ATOM 60670 H1 WAT 2748 86.990 98.506 130.190 1.00 0.00 H ATOM 60671 H2 WAT 2748 87.119 99.487 131.335 1.00 0.00 H TER 60673 WAT 2748 ATOM 60673 O WAT 2749 137.546 100.330 120.771 1.00 0.00 O ATOM 60674 H1 WAT 2749 136.923 99.813 121.281 1.00 0.00 H ATOM 60675 H2 WAT 2749 137.549 99.917 119.907 1.00 0.00 H TER 60677 WAT 2749 ATOM 60677 O WAT 2750 32.193 138.308 144.737 1.00 0.00 O ATOM 60678 H1 WAT 2750 32.066 138.073 145.657 1.00 0.00 H ATOM 60679 H2 WAT 2750 32.135 137.477 144.267 1.00 0.00 H TER 60681 WAT 2750 ATOM 60681 O WAT 2751 5.797 89.424 56.521 1.00 0.00 O ATOM 60682 H1 WAT 2751 6.230 90.027 55.917 1.00 0.00 H ATOM 60683 H2 WAT 2751 5.353 89.992 57.150 1.00 0.00 H TER 60685 WAT 2751 ATOM 60685 O WAT 2752 72.200 86.505 13.468 1.00 0.00 O ATOM 60686 H1 WAT 2752 72.806 87.166 13.802 1.00 0.00 H ATOM 60687 H2 WAT 2752 71.333 86.888 13.599 1.00 0.00 H TER 60689 WAT 2752 ATOM 60689 O WAT 2753 114.266 8.143 73.429 1.00 0.00 O ATOM 60690 H1 WAT 2753 113.396 8.123 73.032 1.00 0.00 H ATOM 60691 H2 WAT 2753 114.773 7.504 72.928 1.00 0.00 H TER 60693 WAT 2753 ATOM 60693 O WAT 2754 69.601 84.756 83.034 1.00 0.00 O ATOM 60694 H1 WAT 2754 70.454 84.835 83.461 1.00 0.00 H ATOM 60695 H2 WAT 2754 69.700 85.236 82.212 1.00 0.00 H TER 60697 WAT 2754 ATOM 60697 O WAT 2755 141.454 43.326 108.195 1.00 0.00 O ATOM 60698 H1 WAT 2755 140.721 43.673 108.704 1.00 0.00 H ATOM 60699 H2 WAT 2755 141.543 42.419 108.488 1.00 0.00 H TER 60701 WAT 2755 ATOM 60701 O WAT 2756 50.137 80.206 146.582 1.00 0.00 O ATOM 60702 H1 WAT 2756 49.815 81.076 146.819 1.00 0.00 H ATOM 60703 H2 WAT 2756 51.025 80.174 146.938 1.00 0.00 H TER 60705 WAT 2756 ATOM 60705 O WAT 2757 57.881 121.567 102.867 1.00 0.00 O ATOM 60706 H1 WAT 2757 57.827 121.014 102.089 1.00 0.00 H ATOM 60707 H2 WAT 2757 56.993 121.902 102.986 1.00 0.00 H TER 60709 WAT 2757 ATOM 60709 O WAT 2758 118.552 9.171 153.752 1.00 0.00 O ATOM 60710 H1 WAT 2758 117.803 8.597 153.591 1.00 0.00 H ATOM 60711 H2 WAT 2758 118.475 9.857 153.089 1.00 0.00 H TER 60713 WAT 2758 ATOM 60713 O WAT 2759 93.406 101.473 133.773 1.00 0.00 O ATOM 60714 H1 WAT 2759 93.960 101.346 134.543 1.00 0.00 H ATOM 60715 H2 WAT 2759 93.942 101.994 133.175 1.00 0.00 H TER 60717 WAT 2759 ATOM 60717 O WAT 2760 109.677 142.409 99.465 1.00 0.00 O ATOM 60718 H1 WAT 2760 110.155 142.374 100.293 1.00 0.00 H ATOM 60719 H2 WAT 2760 108.782 142.156 99.693 1.00 0.00 H TER 60721 WAT 2760 ATOM 60721 O WAT 2761 64.635 82.331 127.511 1.00 0.00 O ATOM 60722 H1 WAT 2761 64.291 82.393 126.620 1.00 0.00 H ATOM 60723 H2 WAT 2761 64.760 83.240 127.783 1.00 0.00 H TER 60725 WAT 2761 ATOM 60725 O WAT 2762 112.196 55.306 17.394 1.00 0.00 O ATOM 60726 H1 WAT 2762 112.809 55.369 16.661 1.00 0.00 H ATOM 60727 H2 WAT 2762 112.631 54.729 18.021 1.00 0.00 H TER 60729 WAT 2762 ATOM 60729 O WAT 2763 140.472 30.131 17.098 1.00 0.00 O ATOM 60730 H1 WAT 2763 140.646 30.276 16.168 1.00 0.00 H ATOM 60731 H2 WAT 2763 141.308 30.309 17.529 1.00 0.00 H TER 60733 WAT 2763 ATOM 60733 O WAT 2764 84.592 42.396 61.911 1.00 0.00 O ATOM 60734 H1 WAT 2764 84.154 41.939 61.193 1.00 0.00 H ATOM 60735 H2 WAT 2764 84.443 43.324 61.730 1.00 0.00 H TER 60737 WAT 2764 ATOM 60737 O WAT 2765 9.365 30.391 117.677 1.00 0.00 O ATOM 60738 H1 WAT 2765 8.975 30.603 118.525 1.00 0.00 H ATOM 60739 H2 WAT 2765 8.677 30.586 117.041 1.00 0.00 H TER 60741 WAT 2765 ATOM 60741 O WAT 2766 102.770 143.048 86.080 1.00 0.00 O ATOM 60742 H1 WAT 2766 102.243 143.516 86.727 1.00 0.00 H ATOM 60743 H2 WAT 2766 102.924 143.690 85.387 1.00 0.00 H TER 60745 WAT 2766 ATOM 60745 O WAT 2767 113.585 95.865 75.897 1.00 0.00 O ATOM 60746 H1 WAT 2767 114.181 95.805 76.643 1.00 0.00 H ATOM 60747 H2 WAT 2767 113.490 96.805 75.742 1.00 0.00 H TER 60749 WAT 2767 ATOM 60749 O WAT 2768 71.130 99.981 7.240 1.00 0.00 O ATOM 60750 H1 WAT 2768 70.599 99.511 7.883 1.00 0.00 H ATOM 60751 H2 WAT 2768 71.989 99.559 7.285 1.00 0.00 H TER 60753 WAT 2768 ATOM 60753 O WAT 2769 96.254 138.056 158.495 1.00 0.00 O ATOM 60754 H1 WAT 2769 96.920 138.743 158.515 1.00 0.00 H ATOM 60755 H2 WAT 2769 96.703 137.297 158.122 1.00 0.00 H TER 60757 WAT 2769 ATOM 60757 O WAT 2770 18.273 119.494 119.624 1.00 0.00 O ATOM 60758 H1 WAT 2770 17.860 119.594 120.481 1.00 0.00 H ATOM 60759 H2 WAT 2770 18.310 118.547 119.485 1.00 0.00 H TER 60761 WAT 2770 ATOM 60761 O WAT 2771 135.991 82.351 152.785 1.00 0.00 O ATOM 60762 H1 WAT 2771 135.523 83.168 152.960 1.00 0.00 H ATOM 60763 H2 WAT 2771 136.913 82.605 152.759 1.00 0.00 H TER 60765 WAT 2771 ATOM 60765 O WAT 2772 103.050 143.183 138.961 1.00 0.00 O ATOM 60766 H1 WAT 2772 103.974 143.001 138.789 1.00 0.00 H ATOM 60767 H2 WAT 2772 102.588 142.811 138.209 1.00 0.00 H TER 60769 WAT 2772 ATOM 60769 O WAT 2773 133.767 12.179 117.193 1.00 0.00 O ATOM 60770 H1 WAT 2773 134.695 12.115 117.419 1.00 0.00 H ATOM 60771 H2 WAT 2773 133.520 13.069 117.443 1.00 0.00 H TER 60773 WAT 2773 ATOM 60773 O WAT 2774 142.086 7.103 73.144 1.00 0.00 O ATOM 60774 H1 WAT 2774 142.187 7.787 72.483 1.00 0.00 H ATOM 60775 H2 WAT 2774 141.661 6.382 72.680 1.00 0.00 H TER 60777 WAT 2774 ATOM 60777 O WAT 2775 55.519 75.614 92.861 1.00 0.00 O ATOM 60778 H1 WAT 2775 55.964 74.898 92.408 1.00 0.00 H ATOM 60779 H2 WAT 2775 55.021 76.059 92.175 1.00 0.00 H TER 60781 WAT 2775 ATOM 60781 O WAT 2776 122.267 55.325 118.668 1.00 0.00 O ATOM 60782 H1 WAT 2776 121.327 55.190 118.793 1.00 0.00 H ATOM 60783 H2 WAT 2776 122.326 56.088 118.093 1.00 0.00 H TER 60785 WAT 2776 ATOM 60785 O WAT 2777 95.074 98.153 158.910 1.00 0.00 O ATOM 60786 H1 WAT 2777 95.687 98.871 158.753 1.00 0.00 H ATOM 60787 H2 WAT 2777 95.450 97.410 158.438 1.00 0.00 H TER 60789 WAT 2777 ATOM 60789 O WAT 2778 62.731 8.682 110.893 1.00 0.00 O ATOM 60790 H1 WAT 2778 62.281 8.219 110.186 1.00 0.00 H ATOM 60791 H2 WAT 2778 63.516 9.042 110.482 1.00 0.00 H TER 60793 WAT 2778 ATOM 60793 O WAT 2779 35.984 128.134 97.525 1.00 0.00 O ATOM 60794 H1 WAT 2779 35.642 127.529 98.183 1.00 0.00 H ATOM 60795 H2 WAT 2779 35.298 128.794 97.425 1.00 0.00 H TER 60797 WAT 2779 ATOM 60797 O WAT 2780 16.110 38.842 142.141 1.00 0.00 O ATOM 60798 H1 WAT 2780 15.869 39.752 141.972 1.00 0.00 H ATOM 60799 H2 WAT 2780 15.893 38.704 143.063 1.00 0.00 H TER 60801 WAT 2780 ATOM 60801 O WAT 2781 14.001 77.627 85.294 1.00 0.00 O ATOM 60802 H1 WAT 2781 13.363 77.159 85.833 1.00 0.00 H ATOM 60803 H2 WAT 2781 14.055 78.497 85.689 1.00 0.00 H TER 60805 WAT 2781 ATOM 60805 O WAT 2782 126.617 49.917 145.633 1.00 0.00 O ATOM 60806 H1 WAT 2782 127.572 49.984 145.622 1.00 0.00 H ATOM 60807 H2 WAT 2782 126.364 50.241 146.497 1.00 0.00 H TER 60809 WAT 2782 ATOM 60809 O WAT 2783 132.558 126.909 112.702 1.00 0.00 O ATOM 60810 H1 WAT 2783 132.119 126.713 111.874 1.00 0.00 H ATOM 60811 H2 WAT 2783 132.637 127.863 112.711 1.00 0.00 H TER 60813 WAT 2783 ATOM 60813 O WAT 2784 0.959 24.490 152.988 1.00 0.00 O ATOM 60814 H1 WAT 2784 1.152 23.906 152.255 1.00 0.00 H ATOM 60815 H2 WAT 2784 1.059 23.941 153.766 1.00 0.00 H TER 60817 WAT 2784 ATOM 60817 O WAT 2785 6.909 101.500 68.349 1.00 0.00 O ATOM 60818 H1 WAT 2785 7.656 101.320 68.919 1.00 0.00 H ATOM 60819 H2 WAT 2785 6.143 101.339 68.900 1.00 0.00 H TER 60821 WAT 2785 ATOM 60821 O WAT 2786 125.330 45.566 130.853 1.00 0.00 O ATOM 60822 H1 WAT 2786 124.699 44.892 131.103 1.00 0.00 H ATOM 60823 H2 WAT 2786 124.822 46.377 130.838 1.00 0.00 H TER 60825 WAT 2786 ATOM 60825 O WAT 2787 97.050 126.857 58.233 1.00 0.00 O ATOM 60826 H1 WAT 2787 97.741 126.207 58.358 1.00 0.00 H ATOM 60827 H2 WAT 2787 96.953 127.272 59.090 1.00 0.00 H TER 60829 WAT 2787 ATOM 60829 O WAT 2788 110.382 123.272 82.370 1.00 0.00 O ATOM 60830 H1 WAT 2788 111.114 122.766 82.722 1.00 0.00 H ATOM 60831 H2 WAT 2788 110.019 123.728 83.130 1.00 0.00 H TER 60833 WAT 2788 ATOM 60833 O WAT 2789 26.351 55.466 129.471 1.00 0.00 O ATOM 60834 H1 WAT 2789 26.718 56.261 129.084 1.00 0.00 H ATOM 60835 H2 WAT 2789 26.692 55.456 130.366 1.00 0.00 H TER 60837 WAT 2789 ATOM 60837 O WAT 2790 91.466 98.455 126.870 1.00 0.00 O ATOM 60838 H1 WAT 2790 92.350 98.494 126.505 1.00 0.00 H ATOM 60839 H2 WAT 2790 91.600 98.328 127.809 1.00 0.00 H TER 60841 WAT 2790 ATOM 60841 O WAT 2791 121.725 78.145 19.873 1.00 0.00 O ATOM 60842 H1 WAT 2791 122.033 79.051 19.874 1.00 0.00 H ATOM 60843 H2 WAT 2791 122.498 77.630 19.641 1.00 0.00 H TER 60845 WAT 2791 ATOM 60845 O WAT 2792 8.713 72.416 96.147 1.00 0.00 O ATOM 60846 H1 WAT 2792 8.219 72.886 95.475 1.00 0.00 H ATOM 60847 H2 WAT 2792 8.135 71.702 96.414 1.00 0.00 H TER 60849 WAT 2792 ATOM 60849 O WAT 2793 72.166 94.634 111.269 1.00 0.00 O ATOM 60850 H1 WAT 2793 71.661 94.659 110.456 1.00 0.00 H ATOM 60851 H2 WAT 2793 72.444 93.722 111.351 1.00 0.00 H TER 60853 WAT 2793 ATOM 60853 O WAT 2794 63.287 57.164 157.250 1.00 0.00 O ATOM 60854 H1 WAT 2794 62.366 57.349 157.432 1.00 0.00 H ATOM 60855 H2 WAT 2794 63.365 56.215 157.351 1.00 0.00 H TER 60857 WAT 2794 ATOM 60857 O WAT 2795 93.551 78.221 135.016 1.00 0.00 O ATOM 60858 H1 WAT 2795 93.703 77.903 135.906 1.00 0.00 H ATOM 60859 H2 WAT 2795 92.730 78.710 135.074 1.00 0.00 H TER 60861 WAT 2795 ATOM 60861 O WAT 2796 122.294 126.714 154.385 1.00 0.00 O ATOM 60862 H1 WAT 2796 121.595 126.827 155.030 1.00 0.00 H ATOM 60863 H2 WAT 2796 122.185 125.817 154.069 1.00 0.00 H TER 60865 WAT 2796 ATOM 60865 O WAT 2797 61.963 28.669 26.678 1.00 0.00 O ATOM 60866 H1 WAT 2797 62.331 27.988 27.242 1.00 0.00 H ATOM 60867 H2 WAT 2797 61.234 28.240 26.230 1.00 0.00 H TER 60869 WAT 2797 ATOM 60869 O WAT 2798 101.170 13.035 107.535 1.00 0.00 O ATOM 60870 H1 WAT 2798 101.021 13.947 107.785 1.00 0.00 H ATOM 60871 H2 WAT 2798 101.207 13.052 106.579 1.00 0.00 H TER 60873 WAT 2798 ATOM 60873 O WAT 2799 75.168 120.062 54.224 1.00 0.00 O ATOM 60874 H1 WAT 2799 76.125 120.068 54.223 1.00 0.00 H ATOM 60875 H2 WAT 2799 74.930 119.911 55.139 1.00 0.00 H TER 60877 WAT 2799 ATOM 60877 O WAT 2800 86.599 61.385 150.806 1.00 0.00 O ATOM 60878 H1 WAT 2800 86.422 60.903 151.613 1.00 0.00 H ATOM 60879 H2 WAT 2800 85.744 61.718 150.533 1.00 0.00 H TER 60881 WAT 2800 ATOM 60881 O WAT 2801 27.663 138.760 92.016 1.00 0.00 O ATOM 60882 H1 WAT 2801 27.811 139.645 91.684 1.00 0.00 H ATOM 60883 H2 WAT 2801 27.925 138.187 91.295 1.00 0.00 H TER 60885 WAT 2801 ATOM 60885 O WAT 2802 95.252 33.453 62.442 1.00 0.00 O ATOM 60886 H1 WAT 2802 95.077 33.933 61.633 1.00 0.00 H ATOM 60887 H2 WAT 2802 94.463 33.574 62.969 1.00 0.00 H TER 60889 WAT 2802 ATOM 60889 O WAT 2803 99.821 34.709 14.846 1.00 0.00 O ATOM 60890 H1 WAT 2803 99.601 35.347 14.168 1.00 0.00 H ATOM 60891 H2 WAT 2803 99.861 35.221 15.654 1.00 0.00 H TER 60893 WAT 2803 ATOM 60893 O WAT 2804 22.908 22.852 88.309 1.00 0.00 O ATOM 60894 H1 WAT 2804 22.155 22.361 88.637 1.00 0.00 H ATOM 60895 H2 WAT 2804 23.103 22.453 87.461 1.00 0.00 H TER 60897 WAT 2804 ATOM 60897 O WAT 2805 41.078 121.116 114.680 1.00 0.00 O ATOM 60898 H1 WAT 2805 41.522 120.320 114.388 1.00 0.00 H ATOM 60899 H2 WAT 2805 41.590 121.415 115.431 1.00 0.00 H TER 60901 WAT 2805 ATOM 60901 O WAT 2806 74.041 10.890 141.941 1.00 0.00 O ATOM 60902 H1 WAT 2806 73.091 10.893 141.825 1.00 0.00 H ATOM 60903 H2 WAT 2806 74.177 11.267 142.810 1.00 0.00 H TER 60905 WAT 2806 ATOM 60905 O WAT 2807 141.797 59.659 126.466 1.00 0.00 O ATOM 60906 H1 WAT 2807 141.634 58.794 126.089 1.00 0.00 H ATOM 60907 H2 WAT 2807 142.104 60.187 125.729 1.00 0.00 H TER 60909 WAT 2807 ATOM 60909 O WAT 2808 103.842 68.995 113.565 1.00 0.00 O ATOM 60910 H1 WAT 2808 104.011 68.193 114.059 1.00 0.00 H ATOM 60911 H2 WAT 2808 104.680 69.458 113.565 1.00 0.00 H TER 60913 WAT 2808 ATOM 60913 O WAT 2809 14.012 121.282 135.948 1.00 0.00 O ATOM 60914 H1 WAT 2809 14.319 121.733 136.735 1.00 0.00 H ATOM 60915 H2 WAT 2809 14.565 121.625 135.245 1.00 0.00 H TER 60917 WAT 2809 ATOM 60917 O WAT 2810 23.564 54.317 2.107 1.00 0.00 O ATOM 60918 H1 WAT 2810 24.486 54.362 2.358 1.00 0.00 H ATOM 60919 H2 WAT 2810 23.549 53.729 1.352 1.00 0.00 H TER 60921 WAT 2810 ATOM 60921 O WAT 2811 131.172 13.398 93.853 1.00 0.00 O ATOM 60922 H1 WAT 2811 131.110 14.346 93.972 1.00 0.00 H ATOM 60923 H2 WAT 2811 130.753 13.235 93.008 1.00 0.00 H TER 60925 WAT 2811 ATOM 60925 O WAT 2812 62.869 2.225 117.455 1.00 0.00 O ATOM 60926 H1 WAT 2812 63.670 2.740 117.547 1.00 0.00 H ATOM 60927 H2 WAT 2812 62.975 1.504 118.075 1.00 0.00 H TER 60929 WAT 2812 ATOM 60929 O WAT 2813 61.037 33.340 141.426 1.00 0.00 O ATOM 60930 H1 WAT 2813 61.358 34.224 141.607 1.00 0.00 H ATOM 60931 H2 WAT 2813 60.644 33.401 140.556 1.00 0.00 H TER 60933 WAT 2813 ATOM 60933 O WAT 2814 45.997 8.039 112.420 1.00 0.00 O ATOM 60934 H1 WAT 2814 46.293 7.586 111.631 1.00 0.00 H ATOM 60935 H2 WAT 2814 45.080 8.249 112.247 1.00 0.00 H TER 60937 WAT 2814 ATOM 60937 O WAT 2815 74.723 23.108 17.385 1.00 0.00 O ATOM 60938 H1 WAT 2815 74.981 23.648 18.131 1.00 0.00 H ATOM 60939 H2 WAT 2815 74.383 22.303 17.778 1.00 0.00 H TER 60941 WAT 2815 ATOM 60941 O WAT 2816 43.411 88.112 92.725 1.00 0.00 O ATOM 60942 H1 WAT 2816 42.587 88.465 93.062 1.00 0.00 H ATOM 60943 H2 WAT 2816 43.267 87.167 92.681 1.00 0.00 H TER 60945 WAT 2816 ATOM 60945 O WAT 2817 0.830 125.537 71.902 1.00 0.00 O ATOM 60946 H1 WAT 2817 0.349 126.352 72.046 1.00 0.00 H ATOM 60947 H2 WAT 2817 0.257 125.016 71.339 1.00 0.00 H TER 60949 WAT 2817 ATOM 60949 O WAT 2818 49.741 102.000 149.130 1.00 0.00 O ATOM 60950 H1 WAT 2818 49.400 101.343 148.523 1.00 0.00 H ATOM 60951 H2 WAT 2818 49.449 101.705 149.992 1.00 0.00 H TER 60953 WAT 2818 ATOM 60953 O WAT 2819 140.463 112.262 28.646 1.00 0.00 O ATOM 60954 H1 WAT 2819 141.340 112.589 28.443 1.00 0.00 H ATOM 60955 H2 WAT 2819 140.271 111.640 27.944 1.00 0.00 H TER 60957 WAT 2819 ATOM 60957 O WAT 2820 60.505 136.749 6.287 1.00 0.00 O ATOM 60958 H1 WAT 2820 59.851 137.285 5.839 1.00 0.00 H ATOM 60959 H2 WAT 2820 61.258 136.747 5.696 1.00 0.00 H TER 60961 WAT 2820 ATOM 60961 O WAT 2821 135.895 68.676 151.039 1.00 0.00 O ATOM 60962 H1 WAT 2821 136.225 69.136 150.267 1.00 0.00 H ATOM 60963 H2 WAT 2821 134.979 68.489 150.831 1.00 0.00 H TER 60965 WAT 2821 ATOM 60965 O WAT 2822 88.427 36.950 19.949 1.00 0.00 O ATOM 60966 H1 WAT 2822 89.300 37.167 19.622 1.00 0.00 H ATOM 60967 H2 WAT 2822 88.568 36.202 20.530 1.00 0.00 H TER 60969 WAT 2822 ATOM 60969 O WAT 2823 95.946 53.956 18.450 1.00 0.00 O ATOM 60970 H1 WAT 2823 95.679 54.381 19.265 1.00 0.00 H ATOM 60971 H2 WAT 2823 96.740 54.420 18.187 1.00 0.00 H TER 60973 WAT 2823 ATOM 60973 O WAT 2824 46.722 68.106 86.972 1.00 0.00 O ATOM 60974 H1 WAT 2824 46.371 68.015 86.086 1.00 0.00 H ATOM 60975 H2 WAT 2824 47.471 68.693 86.874 1.00 0.00 H TER 60977 WAT 2824 ATOM 60977 O WAT 2825 109.200 2.967 102.034 1.00 0.00 O ATOM 60978 H1 WAT 2825 108.691 2.395 101.459 1.00 0.00 H ATOM 60979 H2 WAT 2825 108.556 3.572 102.401 1.00 0.00 H TER 60981 WAT 2825 ATOM 60981 O WAT 2826 45.452 77.246 4.446 1.00 0.00 O ATOM 60982 H1 WAT 2826 45.318 77.622 3.576 1.00 0.00 H ATOM 60983 H2 WAT 2826 44.580 77.236 4.840 1.00 0.00 H TER 60985 WAT 2826 ATOM 60985 O WAT 2827 20.549 41.617 109.350 1.00 0.00 O ATOM 60986 H1 WAT 2827 20.478 40.741 108.970 1.00 0.00 H ATOM 60987 H2 WAT 2827 19.650 41.850 109.584 1.00 0.00 H TER 60989 WAT 2827 ATOM 60989 O WAT 2828 54.308 84.107 9.349 1.00 0.00 O ATOM 60990 H1 WAT 2828 53.762 83.366 9.613 1.00 0.00 H ATOM 60991 H2 WAT 2828 55.007 84.134 10.002 1.00 0.00 H TER 60993 WAT 2828 ATOM 60993 O WAT 2829 66.166 82.252 81.535 1.00 0.00 O ATOM 60994 H1 WAT 2829 66.590 82.008 80.712 1.00 0.00 H ATOM 60995 H2 WAT 2829 65.580 81.519 81.728 1.00 0.00 H TER 60997 WAT 2829 ATOM 60997 O WAT 2830 95.304 136.871 108.698 1.00 0.00 O ATOM 60998 H1 WAT 2830 95.232 135.978 109.035 1.00 0.00 H ATOM 60999 H2 WAT 2830 94.411 137.103 108.443 1.00 0.00 H TER 61001 WAT 2830 ATOM 61001 O WAT 2831 30.661 18.273 138.885 1.00 0.00 O ATOM 61002 H1 WAT 2831 29.821 17.850 138.706 1.00 0.00 H ATOM 61003 H2 WAT 2831 31.243 17.951 138.196 1.00 0.00 H TER 61005 WAT 2831 ATOM 61005 O WAT 2832 71.283 107.934 60.642 1.00 0.00 O ATOM 61006 H1 WAT 2832 70.693 108.684 60.721 1.00 0.00 H ATOM 61007 H2 WAT 2832 71.401 107.820 59.699 1.00 0.00 H TER 61009 WAT 2832 ATOM 61009 O WAT 2833 142.194 101.499 11.994 1.00 0.00 O ATOM 61010 H1 WAT 2833 142.352 100.890 11.273 1.00 0.00 H ATOM 61011 H2 WAT 2833 141.907 100.943 12.719 1.00 0.00 H TER 61013 WAT 2833 ATOM 61013 O WAT 2834 86.673 117.867 142.521 1.00 0.00 O ATOM 61014 H1 WAT 2834 86.803 117.993 143.461 1.00 0.00 H ATOM 61015 H2 WAT 2834 87.209 117.104 142.305 1.00 0.00 H TER 61017 WAT 2834 ATOM 61017 O WAT 2835 45.515 92.397 70.376 1.00 0.00 O ATOM 61018 H1 WAT 2835 45.683 91.654 70.956 1.00 0.00 H ATOM 61019 H2 WAT 2835 44.562 92.429 70.297 1.00 0.00 H TER 61021 WAT 2835 ATOM 61021 O WAT 2836 72.140 39.730 64.276 1.00 0.00 O ATOM 61022 H1 WAT 2836 72.550 39.302 65.027 1.00 0.00 H ATOM 61023 H2 WAT 2836 72.872 40.088 63.775 1.00 0.00 H TER 61025 WAT 2836 ATOM 61025 O WAT 2837 59.089 51.280 21.242 1.00 0.00 O ATOM 61026 H1 WAT 2837 59.954 51.354 21.645 1.00 0.00 H ATOM 61027 H2 WAT 2837 59.262 51.278 20.301 1.00 0.00 H TER 61029 WAT 2837 ATOM 61029 O WAT 2838 72.994 50.907 130.518 1.00 0.00 O ATOM 61030 H1 WAT 2838 73.123 51.000 129.574 1.00 0.00 H ATOM 61031 H2 WAT 2838 73.404 50.069 130.734 1.00 0.00 H TER 61033 WAT 2838 ATOM 61033 O WAT 2839 70.386 137.536 104.799 1.00 0.00 O ATOM 61034 H1 WAT 2839 70.495 136.721 105.289 1.00 0.00 H ATOM 61035 H2 WAT 2839 71.229 137.981 104.882 1.00 0.00 H TER 61037 WAT 2839 ATOM 61037 O WAT 2840 98.833 131.146 13.825 1.00 0.00 O ATOM 61038 H1 WAT 2840 98.007 130.701 14.012 1.00 0.00 H ATOM 61039 H2 WAT 2840 99.325 131.092 14.644 1.00 0.00 H TER 61041 WAT 2840 ATOM 61041 O WAT 2841 61.820 65.692 79.901 1.00 0.00 O ATOM 61042 H1 WAT 2841 62.630 66.101 79.597 1.00 0.00 H ATOM 61043 H2 WAT 2841 61.541 65.140 79.170 1.00 0.00 H TER 61045 WAT 2841 ATOM 61045 O WAT 2842 47.383 6.751 136.425 1.00 0.00 O ATOM 61046 H1 WAT 2842 46.906 6.784 137.254 1.00 0.00 H ATOM 61047 H2 WAT 2842 46.736 6.445 135.788 1.00 0.00 H TER 61049 WAT 2842 ATOM 61049 O WAT 2843 81.275 133.127 7.244 1.00 0.00 O ATOM 61050 H1 WAT 2843 82.134 132.965 6.855 1.00 0.00 H ATOM 61051 H2 WAT 2843 81.263 132.586 8.034 1.00 0.00 H TER 61053 WAT 2843 ATOM 61053 O WAT 2844 52.769 87.996 113.921 1.00 0.00 O ATOM 61054 H1 WAT 2844 53.703 88.202 113.916 1.00 0.00 H ATOM 61055 H2 WAT 2844 52.352 88.780 114.280 1.00 0.00 H TER 61057 WAT 2844 ATOM 61057 O WAT 2845 98.639 11.998 149.741 1.00 0.00 O ATOM 61058 H1 WAT 2845 98.854 12.557 148.994 1.00 0.00 H ATOM 61059 H2 WAT 2845 97.724 12.201 149.936 1.00 0.00 H TER 61061 WAT 2845 ATOM 61061 O WAT 2846 6.148 57.315 79.538 1.00 0.00 O ATOM 61062 H1 WAT 2846 5.760 56.666 78.952 1.00 0.00 H ATOM 61063 H2 WAT 2846 6.616 56.797 80.193 1.00 0.00 H TER 61065 WAT 2846 ATOM 61065 O WAT 2847 1.456 125.682 97.029 1.00 0.00 O ATOM 61066 H1 WAT 2847 1.685 126.022 96.164 1.00 0.00 H ATOM 61067 H2 WAT 2847 0.529 125.898 97.133 1.00 0.00 H TER 61069 WAT 2847 ATOM 61069 O WAT 2848 71.640 69.189 123.011 1.00 0.00 O ATOM 61070 H1 WAT 2848 71.973 69.998 122.623 1.00 0.00 H ATOM 61071 H2 WAT 2848 72.223 68.506 122.679 1.00 0.00 H TER 61073 WAT 2848 ATOM 61073 O WAT 2849 53.250 10.796 98.515 1.00 0.00 O ATOM 61074 H1 WAT 2849 53.280 9.856 98.336 1.00 0.00 H ATOM 61075 H2 WAT 2849 54.055 11.140 98.128 1.00 0.00 H TER 61077 WAT 2849 ATOM 61077 O WAT 2850 67.097 60.422 13.290 1.00 0.00 O ATOM 61078 H1 WAT 2850 67.244 59.477 13.245 1.00 0.00 H ATOM 61079 H2 WAT 2850 66.247 60.512 13.720 1.00 0.00 H TER 61081 WAT 2850 ATOM 61081 O WAT 2851 66.186 112.079 108.431 1.00 0.00 O ATOM 61082 H1 WAT 2851 65.316 112.041 108.035 1.00 0.00 H ATOM 61083 H2 WAT 2851 66.326 113.009 108.612 1.00 0.00 H TER 61085 WAT 2851 ATOM 61085 O WAT 2852 42.477 68.656 13.690 1.00 0.00 O ATOM 61086 H1 WAT 2852 43.134 68.064 13.323 1.00 0.00 H ATOM 61087 H2 WAT 2852 41.712 68.102 13.842 1.00 0.00 H TER 61089 WAT 2852 ATOM 61089 O WAT 2853 50.731 126.666 85.524 1.00 0.00 O ATOM 61090 H1 WAT 2853 50.378 126.481 86.394 1.00 0.00 H ATOM 61091 H2 WAT 2853 50.391 127.535 85.308 1.00 0.00 H TER 61093 WAT 2853 ATOM 61093 O WAT 2854 144.034 71.884 146.542 1.00 0.00 O ATOM 61094 H1 WAT 2854 144.820 71.339 146.530 1.00 0.00 H ATOM 61095 H2 WAT 2854 143.963 72.223 145.649 1.00 0.00 H TER 61097 WAT 2854 ATOM 61097 O WAT 2855 69.901 145.550 61.357 1.00 0.00 O ATOM 61098 H1 WAT 2855 70.218 146.440 61.512 1.00 0.00 H ATOM 61099 H2 WAT 2855 69.054 145.517 61.800 1.00 0.00 H TER 61101 WAT 2855 ATOM 61101 O WAT 2856 99.760 117.760 94.831 1.00 0.00 O ATOM 61102 H1 WAT 2856 99.097 117.365 94.265 1.00 0.00 H ATOM 61103 H2 WAT 2856 99.922 117.102 95.507 1.00 0.00 H TER 61105 WAT 2856 ATOM 61105 O WAT 2857 67.150 91.502 91.686 1.00 0.00 O ATOM 61106 H1 WAT 2857 66.786 92.275 92.117 1.00 0.00 H ATOM 61107 H2 WAT 2857 67.832 91.847 91.111 1.00 0.00 H TER 61109 WAT 2857 ATOM 61109 O WAT 2858 57.643 114.514 156.414 1.00 0.00 O ATOM 61110 H1 WAT 2858 58.259 113.794 156.274 1.00 0.00 H ATOM 61111 H2 WAT 2858 58.084 115.088 157.040 1.00 0.00 H TER 61113 WAT 2858 ATOM 61113 O WAT 2859 70.758 78.262 103.750 1.00 0.00 O ATOM 61114 H1 WAT 2859 70.619 79.207 103.694 1.00 0.00 H ATOM 61115 H2 WAT 2859 70.710 78.068 104.687 1.00 0.00 H TER 61117 WAT 2859 ATOM 61117 O WAT 2860 8.811 86.490 97.062 1.00 0.00 O ATOM 61118 H1 WAT 2860 9.595 87.017 97.220 1.00 0.00 H ATOM 61119 H2 WAT 2860 9.089 85.591 97.233 1.00 0.00 H TER 61121 WAT 2860 ATOM 61121 O WAT 2861 94.891 38.777 123.730 1.00 0.00 O ATOM 61122 H1 WAT 2861 94.188 38.184 123.998 1.00 0.00 H ATOM 61123 H2 WAT 2861 95.037 38.573 122.807 1.00 0.00 H TER 61125 WAT 2861 ATOM 61125 O WAT 2862 47.386 63.391 135.843 1.00 0.00 O ATOM 61126 H1 WAT 2862 46.532 63.801 135.981 1.00 0.00 H ATOM 61127 H2 WAT 2862 47.361 62.598 136.378 1.00 0.00 H TER 61129 WAT 2862 ATOM 61129 O WAT 2863 60.902 103.253 93.492 1.00 0.00 O ATOM 61130 H1 WAT 2863 60.095 103.401 93.985 1.00 0.00 H ATOM 61131 H2 WAT 2863 61.505 102.871 94.129 1.00 0.00 H TER 61133 WAT 2863 ATOM 61133 O WAT 2864 141.648 91.998 146.854 1.00 0.00 O ATOM 61134 H1 WAT 2864 140.737 91.719 146.761 1.00 0.00 H ATOM 61135 H2 WAT 2864 142.099 91.594 146.112 1.00 0.00 H TER 61137 WAT 2864 ATOM 61137 O WAT 2865 60.927 139.398 7.160 1.00 0.00 O ATOM 61138 H1 WAT 2865 61.825 139.643 7.385 1.00 0.00 H ATOM 61139 H2 WAT 2865 60.965 138.451 7.023 1.00 0.00 H TER 61141 WAT 2865 ATOM 61141 O WAT 2866 97.888 15.773 52.715 1.00 0.00 O ATOM 61142 H1 WAT 2866 97.052 15.355 52.921 1.00 0.00 H ATOM 61143 H2 WAT 2866 97.745 16.700 52.904 1.00 0.00 H TER 61145 WAT 2866 ATOM 61145 O WAT 2867 42.792 44.273 69.360 1.00 0.00 O ATOM 61146 H1 WAT 2867 42.957 44.984 68.741 1.00 0.00 H ATOM 61147 H2 WAT 2867 42.168 43.703 68.910 1.00 0.00 H TER 61149 WAT 2867 ATOM 61149 O WAT 2868 31.013 83.487 91.545 1.00 0.00 O ATOM 61150 H1 WAT 2868 30.127 83.126 91.577 1.00 0.00 H ATOM 61151 H2 WAT 2868 31.585 82.719 91.529 1.00 0.00 H TER 61153 WAT 2868 ATOM 61153 O WAT 2869 119.035 34.570 1.136 1.00 0.00 O ATOM 61154 H1 WAT 2869 119.793 35.113 0.921 1.00 0.00 H ATOM 61155 H2 WAT 2869 119.405 33.710 1.337 1.00 0.00 H TER 61157 WAT 2869 ATOM 61157 O WAT 2870 128.704 77.463 67.737 1.00 0.00 O ATOM 61158 H1 WAT 2870 128.269 78.316 67.733 1.00 0.00 H ATOM 61159 H2 WAT 2870 129.614 77.657 67.514 1.00 0.00 H TER 61161 WAT 2870 ATOM 61161 O WAT 2871 129.532 36.077 139.017 1.00 0.00 O ATOM 61162 H1 WAT 2871 129.745 35.792 139.905 1.00 0.00 H ATOM 61163 H2 WAT 2871 130.119 35.570 138.456 1.00 0.00 H TER 61165 WAT 2871 ATOM 61165 O WAT 2872 36.099 3.088 107.046 1.00 0.00 O ATOM 61166 H1 WAT 2872 36.165 3.996 106.750 1.00 0.00 H ATOM 61167 H2 WAT 2872 35.163 2.892 107.010 1.00 0.00 H TER 61169 WAT 2872 ATOM 61169 O WAT 2873 138.834 67.187 7.710 1.00 0.00 O ATOM 61170 H1 WAT 2873 138.019 67.607 7.984 1.00 0.00 H ATOM 61171 H2 WAT 2873 138.905 66.413 8.270 1.00 0.00 H TER 61173 WAT 2873 ATOM 61173 O WAT 2874 83.851 12.484 84.045 1.00 0.00 O ATOM 61174 H1 WAT 2874 84.607 12.072 83.626 1.00 0.00 H ATOM 61175 H2 WAT 2874 84.159 12.714 84.922 1.00 0.00 H TER 61177 WAT 2874 ATOM 61177 O WAT 2875 115.272 14.703 7.576 1.00 0.00 O ATOM 61178 H1 WAT 2875 115.694 14.152 8.235 1.00 0.00 H ATOM 61179 H2 WAT 2875 115.408 15.597 7.888 1.00 0.00 H TER 61181 WAT 2875 ATOM 61181 O WAT 2876 8.984 0.995 105.161 1.00 0.00 O ATOM 61182 H1 WAT 2876 9.756 1.504 105.408 1.00 0.00 H ATOM 61183 H2 WAT 2876 8.283 1.339 105.714 1.00 0.00 H TER 61185 WAT 2876 ATOM 61185 O WAT 2877 93.410 19.932 113.024 1.00 0.00 O ATOM 61186 H1 WAT 2877 92.496 19.670 113.141 1.00 0.00 H ATOM 61187 H2 WAT 2877 93.912 19.250 113.470 1.00 0.00 H TER 61189 WAT 2877 ATOM 61189 O WAT 2878 130.365 56.825 102.182 1.00 0.00 O ATOM 61190 H1 WAT 2878 130.863 57.499 102.644 1.00 0.00 H ATOM 61191 H2 WAT 2878 129.512 57.227 102.019 1.00 0.00 H TER 61193 WAT 2878 ATOM 61193 O WAT 2879 58.050 88.918 129.639 1.00 0.00 O ATOM 61194 H1 WAT 2879 58.827 88.452 129.330 1.00 0.00 H ATOM 61195 H2 WAT 2879 57.884 88.554 130.509 1.00 0.00 H TER 61197 WAT 2879 ATOM 61197 O WAT 2880 69.792 37.180 101.740 1.00 0.00 O ATOM 61198 H1 WAT 2880 69.295 37.229 100.924 1.00 0.00 H ATOM 61199 H2 WAT 2880 70.693 37.019 101.462 1.00 0.00 H TER 61201 WAT 2880 ATOM 61201 O WAT 2881 44.597 70.343 154.581 1.00 0.00 O ATOM 61202 H1 WAT 2881 45.443 70.574 154.198 1.00 0.00 H ATOM 61203 H2 WAT 2881 44.570 70.821 155.410 1.00 0.00 H TER 61205 WAT 2881 ATOM 61205 O WAT 2882 143.123 58.128 128.879 1.00 0.00 O ATOM 61206 H1 WAT 2882 143.659 57.410 128.542 1.00 0.00 H ATOM 61207 H2 WAT 2882 143.111 58.771 128.170 1.00 0.00 H TER 61209 WAT 2882 ATOM 61209 O WAT 2883 123.086 128.733 18.212 1.00 0.00 O ATOM 61210 H1 WAT 2883 123.730 128.659 17.508 1.00 0.00 H ATOM 61211 H2 WAT 2883 123.591 128.598 19.014 1.00 0.00 H TER 61213 WAT 2883 ATOM 61213 O WAT 2884 123.553 127.970 21.459 1.00 0.00 O ATOM 61214 H1 WAT 2884 123.168 128.804 21.190 1.00 0.00 H ATOM 61215 H2 WAT 2884 124.400 127.941 21.014 1.00 0.00 H TER 61217 WAT 2884 ATOM 61217 O WAT 2885 98.152 88.624 122.249 1.00 0.00 O ATOM 61218 H1 WAT 2885 99.095 88.519 122.118 1.00 0.00 H ATOM 61219 H2 WAT 2885 97.754 88.071 121.576 1.00 0.00 H TER 61221 WAT 2885 ATOM 61221 O WAT 2886 91.156 88.078 55.767 1.00 0.00 O ATOM 61222 H1 WAT 2886 90.731 88.395 54.970 1.00 0.00 H ATOM 61223 H2 WAT 2886 91.047 88.790 56.397 1.00 0.00 H TER 61225 WAT 2886 ATOM 61225 O WAT 2887 1.939 137.706 91.439 1.00 0.00 O ATOM 61226 H1 WAT 2887 2.880 137.655 91.274 1.00 0.00 H ATOM 61227 H2 WAT 2887 1.777 137.042 92.109 1.00 0.00 H TER 61229 WAT 2887 ATOM 61229 O WAT 2888 18.923 98.245 64.892 1.00 0.00 O ATOM 61230 H1 WAT 2888 19.781 98.600 65.125 1.00 0.00 H ATOM 61231 H2 WAT 2888 19.002 98.015 63.966 1.00 0.00 H TER 61233 WAT 2888 ATOM 61233 O WAT 2889 60.607 117.618 71.424 1.00 0.00 O ATOM 61234 H1 WAT 2889 61.150 116.910 71.076 1.00 0.00 H ATOM 61235 H2 WAT 2889 61.222 118.334 71.583 1.00 0.00 H TER 61237 WAT 2889 ATOM 61237 O WAT 2890 31.401 125.340 55.937 1.00 0.00 O ATOM 61238 H1 WAT 2890 30.515 125.523 56.251 1.00 0.00 H ATOM 61239 H2 WAT 2890 31.341 125.429 54.986 1.00 0.00 H TER 61241 WAT 2890 ATOM 61241 O WAT 2891 131.260 144.287 72.531 1.00 0.00 O ATOM 61242 H1 WAT 2891 130.537 143.660 72.562 1.00 0.00 H ATOM 61243 H2 WAT 2891 131.671 144.222 73.393 1.00 0.00 H TER 61245 WAT 2891 ATOM 61245 O WAT 2892 13.349 5.801 22.829 1.00 0.00 O ATOM 61246 H1 WAT 2892 12.812 5.024 22.670 1.00 0.00 H ATOM 61247 H2 WAT 2892 13.403 6.234 21.977 1.00 0.00 H TER 61249 WAT 2892 ATOM 61249 O WAT 2893 118.025 66.038 113.605 1.00 0.00 O ATOM 61250 H1 WAT 2893 118.813 65.497 113.667 1.00 0.00 H ATOM 61251 H2 WAT 2893 117.303 65.410 113.597 1.00 0.00 H TER 61253 WAT 2893 ATOM 61253 O WAT 2894 78.072 68.819 98.109 1.00 0.00 O ATOM 61254 H1 WAT 2894 77.401 68.777 97.428 1.00 0.00 H ATOM 61255 H2 WAT 2894 78.882 68.568 97.664 1.00 0.00 H TER 61257 WAT 2894 ATOM 61257 O WAT 2895 5.537 1.373 58.426 1.00 0.00 O ATOM 61258 H1 WAT 2895 5.012 1.345 59.226 1.00 0.00 H ATOM 61259 H2 WAT 2895 6.159 2.086 58.572 1.00 0.00 H TER 61261 WAT 2895 ATOM 61261 O WAT 2896 130.256 116.200 11.524 1.00 0.00 O ATOM 61262 H1 WAT 2896 131.145 116.234 11.172 1.00 0.00 H ATOM 61263 H2 WAT 2896 130.372 116.238 12.474 1.00 0.00 H TER 61265 WAT 2896 ATOM 61265 O WAT 2897 33.276 23.791 79.268 1.00 0.00 O ATOM 61266 H1 WAT 2897 33.543 24.450 78.627 1.00 0.00 H ATOM 61267 H2 WAT 2897 32.812 23.131 78.754 1.00 0.00 H TER 61269 WAT 2897 ATOM 61269 O WAT 2898 119.686 143.872 110.280 1.00 0.00 O ATOM 61270 H1 WAT 2898 120.180 144.355 109.617 1.00 0.00 H ATOM 61271 H2 WAT 2898 118.815 144.268 110.264 1.00 0.00 H TER 61273 WAT 2898 ATOM 61273 O WAT 2899 40.311 131.753 144.778 1.00 0.00 O ATOM 61274 H1 WAT 2899 39.464 131.827 145.219 1.00 0.00 H ATOM 61275 H2 WAT 2899 40.545 130.829 144.863 1.00 0.00 H TER 61277 WAT 2899 ATOM 61277 O WAT 2900 54.470 18.978 139.567 1.00 0.00 O ATOM 61278 H1 WAT 2900 54.060 19.794 139.854 1.00 0.00 H ATOM 61279 H2 WAT 2900 55.340 18.993 139.966 1.00 0.00 H TER 61281 WAT 2900 ATOM 61281 O WAT 2901 104.007 29.866 17.737 1.00 0.00 O ATOM 61282 H1 WAT 2901 104.918 30.068 17.520 1.00 0.00 H ATOM 61283 H2 WAT 2901 103.499 30.544 17.292 1.00 0.00 H TER 61285 WAT 2901 ATOM 61285 O WAT 2902 10.318 82.218 158.754 1.00 0.00 O ATOM 61286 H1 WAT 2902 9.575 81.775 158.345 1.00 0.00 H ATOM 61287 H2 WAT 2902 10.021 83.120 158.879 1.00 0.00 H TER 61289 WAT 2902 ATOM 61289 O WAT 2903 110.908 64.650 97.592 1.00 0.00 O ATOM 61290 H1 WAT 2903 110.318 65.133 97.013 1.00 0.00 H ATOM 61291 H2 WAT 2903 110.652 63.734 97.484 1.00 0.00 H TER 61293 WAT 2903 ATOM 61293 O WAT 2904 49.580 136.371 89.570 1.00 0.00 O ATOM 61294 H1 WAT 2904 49.660 135.945 90.424 1.00 0.00 H ATOM 61295 H2 WAT 2904 48.984 135.807 89.076 1.00 0.00 H TER 61297 WAT 2904 ATOM 61297 O WAT 2905 49.650 84.913 67.536 1.00 0.00 O ATOM 61298 H1 WAT 2905 49.577 84.082 68.005 1.00 0.00 H ATOM 61299 H2 WAT 2905 50.507 84.873 67.110 1.00 0.00 H TER 61301 WAT 2905 ATOM 61301 O WAT 2906 51.510 38.493 149.849 1.00 0.00 O ATOM 61302 H1 WAT 2906 50.849 37.834 150.059 1.00 0.00 H ATOM 61303 H2 WAT 2906 52.287 38.216 150.335 1.00 0.00 H TER 61305 WAT 2906 ATOM 61305 O WAT 2907 30.112 96.495 85.555 1.00 0.00 O ATOM 61306 H1 WAT 2907 29.166 96.628 85.503 1.00 0.00 H ATOM 61307 H2 WAT 2907 30.279 96.317 86.480 1.00 0.00 H TER 61309 WAT 2907 ATOM 61309 O WAT 2908 7.775 102.297 121.294 1.00 0.00 O ATOM 61310 H1 WAT 2908 6.935 102.489 121.711 1.00 0.00 H ATOM 61311 H2 WAT 2908 7.856 101.344 121.346 1.00 0.00 H TER 61313 WAT 2908 ATOM 61313 O WAT 2909 101.493 33.262 19.005 1.00 0.00 O ATOM 61314 H1 WAT 2909 100.848 33.893 18.687 1.00 0.00 H ATOM 61315 H2 WAT 2909 101.195 32.420 18.659 1.00 0.00 H TER 61317 WAT 2909 ATOM 61317 O WAT 2910 62.807 76.808 5.012 1.00 0.00 O ATOM 61318 H1 WAT 2910 63.745 76.793 5.201 1.00 0.00 H ATOM 61319 H2 WAT 2910 62.628 77.715 4.761 1.00 0.00 H TER 61321 WAT 2910 ATOM 61321 O WAT 2911 4.784 57.878 136.084 1.00 0.00 O ATOM 61322 H1 WAT 2911 4.548 57.657 136.985 1.00 0.00 H ATOM 61323 H2 WAT 2911 4.023 57.615 135.567 1.00 0.00 H TER 61325 WAT 2911 ATOM 61325 O WAT 2912 35.179 135.244 108.139 1.00 0.00 O ATOM 61326 H1 WAT 2912 34.528 134.542 108.157 1.00 0.00 H ATOM 61327 H2 WAT 2912 35.262 135.516 109.053 1.00 0.00 H TER 61329 WAT 2912 ATOM 61329 O WAT 2913 77.353 123.365 68.761 1.00 0.00 O ATOM 61330 H1 WAT 2913 78.168 123.298 68.264 1.00 0.00 H ATOM 61331 H2 WAT 2913 77.237 122.498 69.149 1.00 0.00 H TER 61333 WAT 2913 ATOM 61333 O WAT 2914 105.919 106.109 89.204 1.00 0.00 O ATOM 61334 H1 WAT 2914 106.848 106.109 88.972 1.00 0.00 H ATOM 61335 H2 WAT 2914 105.736 107.014 89.456 1.00 0.00 H TER 61337 WAT 2914 ATOM 61337 O WAT 2915 125.561 71.240 93.512 1.00 0.00 O ATOM 61338 H1 WAT 2915 125.084 72.033 93.271 1.00 0.00 H ATOM 61339 H2 WAT 2915 124.883 70.631 93.804 1.00 0.00 H TER 61341 WAT 2915 ATOM 61341 O WAT 2916 84.990 30.132 139.608 1.00 0.00 O ATOM 61342 H1 WAT 2916 84.396 30.681 140.120 1.00 0.00 H ATOM 61343 H2 WAT 2916 85.182 29.389 140.180 1.00 0.00 H TER 61345 WAT 2916 ATOM 61345 O WAT 2917 76.169 25.927 103.710 1.00 0.00 O ATOM 61346 H1 WAT 2917 76.978 25.997 104.218 1.00 0.00 H ATOM 61347 H2 WAT 2917 76.446 25.572 102.865 1.00 0.00 H TER 61349 WAT 2917 ATOM 61349 O WAT 2918 12.806 42.226 105.443 1.00 0.00 O ATOM 61350 H1 WAT 2918 12.647 41.566 106.118 1.00 0.00 H ATOM 61351 H2 WAT 2918 12.504 41.816 104.632 1.00 0.00 H TER 61353 WAT 2918 ATOM 61353 O WAT 2919 3.269 94.223 89.964 1.00 0.00 O ATOM 61354 H1 WAT 2919 3.570 93.627 90.650 1.00 0.00 H ATOM 61355 H2 WAT 2919 4.069 94.628 89.629 1.00 0.00 H TER 61357 WAT 2919 ATOM 61357 O WAT 2920 45.733 54.739 120.067 1.00 0.00 O ATOM 61358 H1 WAT 2920 45.999 55.136 120.897 1.00 0.00 H ATOM 61359 H2 WAT 2920 45.111 54.056 120.318 1.00 0.00 H TER 61361 WAT 2920 ATOM 61361 O WAT 2921 83.849 142.066 103.625 1.00 0.00 O ATOM 61362 H1 WAT 2921 83.034 142.238 103.154 1.00 0.00 H ATOM 61363 H2 WAT 2921 84.220 142.933 103.787 1.00 0.00 H TER 61365 WAT 2921 ATOM 61365 O WAT 2922 144.147 136.601 78.773 1.00 0.00 O ATOM 61366 H1 WAT 2922 144.803 136.530 78.079 1.00 0.00 H ATOM 61367 H2 WAT 2922 143.635 135.795 78.701 1.00 0.00 H TER 61369 WAT 2922 ATOM 61369 O WAT 2923 113.264 117.856 112.122 1.00 0.00 O ATOM 61370 H1 WAT 2923 112.458 117.345 112.052 1.00 0.00 H ATOM 61371 H2 WAT 2923 113.163 118.354 112.933 1.00 0.00 H TER 61373 WAT 2923 ATOM 61373 O WAT 2924 43.201 97.601 22.701 1.00 0.00 O ATOM 61374 H1 WAT 2924 42.939 97.020 23.416 1.00 0.00 H ATOM 61375 H2 WAT 2924 42.814 97.208 21.919 1.00 0.00 H TER 61377 WAT 2924 ATOM 61377 O WAT 2925 98.763 142.437 64.869 1.00 0.00 O ATOM 61378 H1 WAT 2925 99.714 142.376 64.957 1.00 0.00 H ATOM 61379 H2 WAT 2925 98.570 143.365 64.999 1.00 0.00 H TER 61381 WAT 2925 ATOM 61381 O WAT 2926 40.409 48.312 107.140 1.00 0.00 O ATOM 61382 H1 WAT 2926 40.166 48.822 106.368 1.00 0.00 H ATOM 61383 H2 WAT 2926 40.716 47.477 106.788 1.00 0.00 H TER 61385 WAT 2926 ATOM 61385 O WAT 2927 16.950 29.825 98.495 1.00 0.00 O ATOM 61386 H1 WAT 2927 17.395 29.193 99.060 1.00 0.00 H ATOM 61387 H2 WAT 2927 17.204 29.573 97.608 1.00 0.00 H TER 61389 WAT 2927 ATOM 61389 O WAT 2928 119.852 3.980 158.762 1.00 0.00 O ATOM 61390 H1 WAT 2928 119.378 4.265 157.981 1.00 0.00 H ATOM 61391 H2 WAT 2928 119.220 4.075 159.474 1.00 0.00 H TER 61393 WAT 2928 ATOM 61393 O WAT 2929 114.713 94.471 97.217 1.00 0.00 O ATOM 61394 H1 WAT 2929 113.794 94.356 97.458 1.00 0.00 H ATOM 61395 H2 WAT 2929 115.095 93.597 97.305 1.00 0.00 H TER 61397 WAT 2929 ATOM 61397 O WAT 2930 133.969 68.822 63.398 1.00 0.00 O ATOM 61398 H1 WAT 2930 133.968 68.675 62.452 1.00 0.00 H ATOM 61399 H2 WAT 2930 133.104 68.530 63.687 1.00 0.00 H TER 61401 WAT 2930 ATOM 61401 O WAT 2931 115.516 8.706 83.868 1.00 0.00 O ATOM 61402 H1 WAT 2931 116.003 8.592 84.684 1.00 0.00 H ATOM 61403 H2 WAT 2931 115.996 9.387 83.396 1.00 0.00 H TER 61405 WAT 2931 ATOM 61405 O WAT 2932 144.147 97.907 70.153 1.00 0.00 O ATOM 61406 H1 WAT 2932 144.655 97.781 69.352 1.00 0.00 H ATOM 61407 H2 WAT 2932 144.536 97.300 70.782 1.00 0.00 H TER 61409 WAT 2932 ATOM 61409 O WAT 2933 124.740 134.409 61.981 1.00 0.00 O ATOM 61410 H1 WAT 2933 125.501 133.832 62.043 1.00 0.00 H ATOM 61411 H2 WAT 2933 125.069 135.193 61.541 1.00 0.00 H TER 61413 WAT 2933 ATOM 61413 O WAT 2934 36.334 61.352 110.784 1.00 0.00 O ATOM 61414 H1 WAT 2934 35.730 61.265 111.521 1.00 0.00 H ATOM 61415 H2 WAT 2934 37.176 61.052 111.127 1.00 0.00 H TER 61417 WAT 2934 ATOM 61417 O WAT 2935 66.015 114.116 64.842 1.00 0.00 O ATOM 61418 H1 WAT 2935 65.097 114.039 65.104 1.00 0.00 H ATOM 61419 H2 WAT 2935 66.044 114.906 64.302 1.00 0.00 H TER 61421 WAT 2935 ATOM 61421 O WAT 2936 118.743 140.987 138.005 1.00 0.00 O ATOM 61422 H1 WAT 2936 118.758 141.777 138.545 1.00 0.00 H ATOM 61423 H2 WAT 2936 118.669 141.312 137.107 1.00 0.00 H TER 61425 WAT 2936 ATOM 61425 O WAT 2937 141.344 40.307 86.062 1.00 0.00 O ATOM 61426 H1 WAT 2937 140.539 40.821 85.996 1.00 0.00 H ATOM 61427 H2 WAT 2937 141.286 39.879 86.916 1.00 0.00 H TER 61429 WAT 2937 ATOM 61429 O WAT 2938 21.728 100.407 9.212 1.00 0.00 O ATOM 61430 H1 WAT 2938 20.833 100.171 8.966 1.00 0.00 H ATOM 61431 H2 WAT 2938 22.141 100.668 8.389 1.00 0.00 H TER 61433 WAT 2938 ATOM 61433 O WAT 2939 140.150 45.977 63.971 1.00 0.00 O ATOM 61434 H1 WAT 2939 140.707 45.842 63.204 1.00 0.00 H ATOM 61435 H2 WAT 2939 139.340 45.511 63.763 1.00 0.00 H TER 61437 WAT 2939 ATOM 61437 O WAT 2940 78.869 89.483 72.778 1.00 0.00 O ATOM 61438 H1 WAT 2940 79.508 89.594 72.074 1.00 0.00 H ATOM 61439 H2 WAT 2940 78.749 88.536 72.846 1.00 0.00 H TER 61441 WAT 2940 ATOM 61441 O WAT 2941 116.531 31.377 131.127 1.00 0.00 O ATOM 61442 H1 WAT 2941 116.069 31.417 131.965 1.00 0.00 H ATOM 61443 H2 WAT 2941 117.316 31.907 131.261 1.00 0.00 H TER 61445 WAT 2941 ATOM 61445 O WAT 2942 48.884 99.584 125.980 1.00 0.00 O ATOM 61446 H1 WAT 2942 48.006 99.326 126.259 1.00 0.00 H ATOM 61447 H2 WAT 2942 48.815 99.683 125.031 1.00 0.00 H TER 61449 WAT 2942 ATOM 61449 O WAT 2943 27.881 36.857 98.557 1.00 0.00 O ATOM 61450 H1 WAT 2943 28.381 37.488 99.074 1.00 0.00 H ATOM 61451 H2 WAT 2943 28.544 36.364 98.074 1.00 0.00 H TER 61453 WAT 2943 ATOM 61453 O WAT 2944 142.381 120.739 115.641 1.00 0.00 O ATOM 61454 H1 WAT 2944 142.932 120.838 114.865 1.00 0.00 H ATOM 61455 H2 WAT 2944 141.752 120.058 115.404 1.00 0.00 H TER 61457 WAT 2944 ATOM 61457 O WAT 2945 60.388 83.545 80.226 1.00 0.00 O ATOM 61458 H1 WAT 2945 61.249 83.715 80.608 1.00 0.00 H ATOM 61459 H2 WAT 2945 59.776 83.660 80.953 1.00 0.00 H TER 61461 WAT 2945 ATOM 61461 O WAT 2946 82.708 39.439 98.981 1.00 0.00 O ATOM 61462 H1 WAT 2946 83.566 39.556 99.389 1.00 0.00 H ATOM 61463 H2 WAT 2946 82.158 39.078 99.677 1.00 0.00 H TER 61465 WAT 2946 ATOM 61465 O WAT 2947 97.253 139.795 86.975 1.00 0.00 O ATOM 61466 H1 WAT 2947 96.932 140.085 87.829 1.00 0.00 H ATOM 61467 H2 WAT 2947 97.204 140.576 86.423 1.00 0.00 H TER 61469 WAT 2947 ATOM 61469 O WAT 2948 112.883 80.218 17.211 1.00 0.00 O ATOM 61470 H1 WAT 2948 112.016 80.261 16.807 1.00 0.00 H ATOM 61471 H2 WAT 2948 113.021 79.287 17.384 1.00 0.00 H TER 61473 WAT 2948 ATOM 61473 O WAT 2949 97.396 92.813 107.218 1.00 0.00 O ATOM 61474 H1 WAT 2949 97.596 93.746 107.138 1.00 0.00 H ATOM 61475 H2 WAT 2949 96.818 92.757 107.979 1.00 0.00 H TER 61477 WAT 2949 ATOM 61477 O WAT 2950 40.525 98.391 64.790 1.00 0.00 O ATOM 61478 H1 WAT 2950 40.319 99.313 64.638 1.00 0.00 H ATOM 61479 H2 WAT 2950 39.672 97.962 64.854 1.00 0.00 H TER 61481 WAT 2950 ATOM 61481 O WAT 2951 55.217 72.701 100.532 1.00 0.00 O ATOM 61482 H1 WAT 2951 55.573 71.838 100.321 1.00 0.00 H ATOM 61483 H2 WAT 2951 55.102 72.688 101.482 1.00 0.00 H TER 61485 WAT 2951 ATOM 61485 O WAT 2952 19.797 92.975 1.635 1.00 0.00 O ATOM 61486 H1 WAT 2952 20.282 92.780 2.437 1.00 0.00 H ATOM 61487 H2 WAT 2952 18.886 92.779 1.853 1.00 0.00 H TER 61489 WAT 2952 ATOM 61489 O WAT 2953 69.435 79.576 6.842 1.00 0.00 O ATOM 61490 H1 WAT 2953 69.814 78.732 6.598 1.00 0.00 H ATOM 61491 H2 WAT 2953 69.481 79.592 7.798 1.00 0.00 H TER 61493 WAT 2953 ATOM 61493 O WAT 2954 70.007 6.279 113.030 1.00 0.00 O ATOM 61494 H1 WAT 2954 70.214 7.171 112.753 1.00 0.00 H ATOM 61495 H2 WAT 2954 70.238 6.257 113.959 1.00 0.00 H TER 61497 WAT 2954 ATOM 61497 O WAT 2955 123.429 3.355 70.318 1.00 0.00 O ATOM 61498 H1 WAT 2955 123.568 3.174 69.389 1.00 0.00 H ATOM 61499 H2 WAT 2955 124.192 2.976 70.753 1.00 0.00 H TER 61501 WAT 2955 ATOM 61501 O WAT 2956 81.984 33.161 83.193 1.00 0.00 O ATOM 61502 H1 WAT 2956 82.438 32.804 82.430 1.00 0.00 H ATOM 61503 H2 WAT 2956 81.489 33.905 82.851 1.00 0.00 H TER 61505 WAT 2956 ATOM 61505 O WAT 2957 106.472 54.972 89.450 1.00 0.00 O ATOM 61506 H1 WAT 2957 106.555 55.846 89.831 1.00 0.00 H ATOM 61507 H2 WAT 2957 106.976 55.015 88.638 1.00 0.00 H TER 61509 WAT 2957 ATOM 61509 O WAT 2958 133.024 51.517 59.483 1.00 0.00 O ATOM 61510 H1 WAT 2958 133.260 52.321 59.945 1.00 0.00 H ATOM 61511 H2 WAT 2958 132.117 51.655 59.211 1.00 0.00 H TER 61513 WAT 2958 ATOM 61513 O WAT 2959 86.437 126.590 109.031 1.00 0.00 O ATOM 61514 H1 WAT 2959 87.188 126.023 109.204 1.00 0.00 H ATOM 61515 H2 WAT 2959 85.881 126.079 108.442 1.00 0.00 H TER 61517 WAT 2959 ATOM 61517 O WAT 2960 96.355 67.477 135.921 1.00 0.00 O ATOM 61518 H1 WAT 2960 96.461 66.649 136.391 1.00 0.00 H ATOM 61519 H2 WAT 2960 96.831 68.116 136.452 1.00 0.00 H TER 61521 WAT 2960 ATOM 61521 O WAT 2961 75.306 132.005 126.251 1.00 0.00 O ATOM 61522 H1 WAT 2961 75.772 132.431 125.531 1.00 0.00 H ATOM 61523 H2 WAT 2961 74.449 131.787 125.885 1.00 0.00 H TER 61525 WAT 2961 ATOM 61525 O WAT 2962 3.477 104.439 148.049 1.00 0.00 O ATOM 61526 H1 WAT 2962 4.172 104.186 147.441 1.00 0.00 H ATOM 61527 H2 WAT 2962 3.725 104.032 148.879 1.00 0.00 H TER 61529 WAT 2962 ATOM 61529 O WAT 2963 136.916 1.434 117.036 1.00 0.00 O ATOM 61530 H1 WAT 2963 137.517 2.080 117.407 1.00 0.00 H ATOM 61531 H2 WAT 2963 137.323 1.177 116.208 1.00 0.00 H TER 61533 WAT 2963 ATOM 61533 O WAT 2964 70.280 68.187 74.247 1.00 0.00 O ATOM 61534 H1 WAT 2964 70.092 67.731 75.068 1.00 0.00 H ATOM 61535 H2 WAT 2964 70.611 67.504 73.664 1.00 0.00 H TER 61537 WAT 2964 ATOM 61537 O WAT 2965 55.528 41.224 91.347 1.00 0.00 O ATOM 61538 H1 WAT 2965 56.474 41.083 91.323 1.00 0.00 H ATOM 61539 H2 WAT 2965 55.358 41.561 92.227 1.00 0.00 H TER 61541 WAT 2965 ATOM 61541 O WAT 2966 25.473 55.374 146.911 1.00 0.00 O ATOM 61542 H1 WAT 2966 25.175 55.858 146.140 1.00 0.00 H ATOM 61543 H2 WAT 2966 26.218 55.879 147.237 1.00 0.00 H TER 61545 WAT 2966 ATOM 61545 O WAT 2967 72.432 32.263 25.487 1.00 0.00 O ATOM 61546 H1 WAT 2967 72.972 32.321 24.699 1.00 0.00 H ATOM 61547 H2 WAT 2967 72.081 31.373 25.471 1.00 0.00 H TER 61549 WAT 2967 ATOM 61549 O WAT 2968 97.742 9.261 88.315 1.00 0.00 O ATOM 61550 H1 WAT 2968 97.063 9.819 88.693 1.00 0.00 H ATOM 61551 H2 WAT 2968 98.512 9.414 88.863 1.00 0.00 H TER 61553 WAT 2968 ATOM 61553 O WAT 2969 131.976 36.399 1.883 1.00 0.00 O ATOM 61554 H1 WAT 2969 131.790 35.550 2.286 1.00 0.00 H ATOM 61555 H2 WAT 2969 132.610 36.203 1.193 1.00 0.00 H TER 61557 WAT 2969 ATOM 61557 O WAT 2970 31.355 24.565 76.393 1.00 0.00 O ATOM 61558 H1 WAT 2970 30.798 25.220 75.975 1.00 0.00 H ATOM 61559 H2 WAT 2970 32.133 25.051 76.667 1.00 0.00 H TER 61561 WAT 2970 ATOM 61561 O WAT 2971 75.417 50.035 85.615 1.00 0.00 O ATOM 61562 H1 WAT 2971 75.594 49.486 86.379 1.00 0.00 H ATOM 61563 H2 WAT 2971 75.644 50.920 85.898 1.00 0.00 H TER 61565 WAT 2971 ATOM 61565 O WAT 2972 143.846 76.298 136.752 1.00 0.00 O ATOM 61566 H1 WAT 2972 143.455 75.593 137.269 1.00 0.00 H ATOM 61567 H2 WAT 2972 144.266 75.851 136.017 1.00 0.00 H TER 61569 WAT 2972 ATOM 61569 O WAT 2973 90.200 83.080 7.018 1.00 0.00 O ATOM 61570 H1 WAT 2973 89.489 82.442 6.962 1.00 0.00 H ATOM 61571 H2 WAT 2973 90.984 82.586 6.777 1.00 0.00 H TER 61573 WAT 2973 ATOM 61573 O WAT 2974 13.292 92.685 112.617 1.00 0.00 O ATOM 61574 H1 WAT 2974 12.455 92.395 112.256 1.00 0.00 H ATOM 61575 H2 WAT 2974 13.559 91.976 113.203 1.00 0.00 H TER 61577 WAT 2974 ATOM 61577 O WAT 2975 13.384 139.776 147.408 1.00 0.00 O ATOM 61578 H1 WAT 2975 13.343 138.914 146.995 1.00 0.00 H ATOM 61579 H2 WAT 2975 14.296 140.048 147.307 1.00 0.00 H TER 61581 WAT 2975 ATOM 61581 O WAT 2976 0.745 9.579 77.292 1.00 0.00 O ATOM 61582 H1 WAT 2976 0.695 9.191 78.165 1.00 0.00 H ATOM 61583 H2 WAT 2976 0.589 10.512 77.435 1.00 0.00 H TER 61585 WAT 2976 ATOM 61585 O WAT 2977 6.770 95.953 151.739 1.00 0.00 O ATOM 61586 H1 WAT 2977 7.073 96.703 152.250 1.00 0.00 H ATOM 61587 H2 WAT 2977 5.888 95.778 152.070 1.00 0.00 H TER 61589 WAT 2977 ATOM 61589 O WAT 2978 137.447 107.865 63.813 1.00 0.00 O ATOM 61590 H1 WAT 2978 138.251 108.123 64.263 1.00 0.00 H ATOM 61591 H2 WAT 2978 137.709 107.760 62.898 1.00 0.00 H TER 61593 WAT 2978 ATOM 61593 O WAT 2979 127.800 79.257 16.154 1.00 0.00 O ATOM 61594 H1 WAT 2979 127.192 79.983 16.294 1.00 0.00 H ATOM 61595 H2 WAT 2979 127.259 78.560 15.783 1.00 0.00 H TER 61597 WAT 2979 ATOM 61597 O WAT 2980 129.039 2.423 116.998 1.00 0.00 O ATOM 61598 H1 WAT 2980 128.563 2.678 116.208 1.00 0.00 H ATOM 61599 H2 WAT 2980 128.354 2.235 117.640 1.00 0.00 H TER 61601 WAT 2980 ATOM 61601 O WAT 2981 94.071 45.116 67.154 1.00 0.00 O ATOM 61602 H1 WAT 2981 93.625 45.350 66.340 1.00 0.00 H ATOM 61603 H2 WAT 2981 93.917 44.176 67.250 1.00 0.00 H TER 61605 WAT 2981 ATOM 61605 O WAT 2982 125.995 139.542 94.897 1.00 0.00 O ATOM 61606 H1 WAT 2982 125.750 140.458 95.027 1.00 0.00 H ATOM 61607 H2 WAT 2982 125.422 139.239 94.192 1.00 0.00 H TER 61609 WAT 2982 ATOM 61609 O WAT 2983 97.945 144.318 111.088 1.00 0.00 O ATOM 61610 H1 WAT 2983 98.725 144.268 111.639 1.00 0.00 H ATOM 61611 H2 WAT 2983 97.733 143.405 110.890 1.00 0.00 H TER 61613 WAT 2983 ATOM 61613 O WAT 2984 135.986 32.336 69.409 1.00 0.00 O ATOM 61614 H1 WAT 2984 136.428 32.544 68.586 1.00 0.00 H ATOM 61615 H2 WAT 2984 135.399 31.612 69.189 1.00 0.00 H TER 61617 WAT 2984 ATOM 61617 O WAT 2985 138.372 104.805 157.594 1.00 0.00 O ATOM 61618 H1 WAT 2985 137.944 104.857 158.448 1.00 0.00 H ATOM 61619 H2 WAT 2985 137.652 104.825 156.963 1.00 0.00 H TER 61621 WAT 2985 ATOM 61621 O WAT 2986 133.185 19.198 113.281 1.00 0.00 O ATOM 61622 H1 WAT 2986 132.456 19.506 113.820 1.00 0.00 H ATOM 61623 H2 WAT 2986 133.967 19.515 113.733 1.00 0.00 H TER 61625 WAT 2986 ATOM 61625 O WAT 2987 118.274 118.173 83.212 1.00 0.00 O ATOM 61626 H1 WAT 2987 118.485 118.654 84.012 1.00 0.00 H ATOM 61627 H2 WAT 2987 117.322 118.074 83.237 1.00 0.00 H TER 61629 WAT 2987 ATOM 61629 O WAT 2988 127.377 47.867 70.905 1.00 0.00 O ATOM 61630 H1 WAT 2988 128.130 48.398 70.647 1.00 0.00 H ATOM 61631 H2 WAT 2988 126.796 48.479 71.357 1.00 0.00 H TER 61633 WAT 2988 ATOM 61633 O WAT 2989 53.282 90.341 92.235 1.00 0.00 O ATOM 61634 H1 WAT 2989 53.609 89.582 92.718 1.00 0.00 H ATOM 61635 H2 WAT 2989 52.569 90.680 92.776 1.00 0.00 H TER 61637 WAT 2989 ATOM 61637 O WAT 2990 34.509 97.629 155.485 1.00 0.00 O ATOM 61638 H1 WAT 2990 34.758 98.306 154.855 1.00 0.00 H ATOM 61639 H2 WAT 2990 33.664 97.308 155.169 1.00 0.00 H TER 61641 WAT 2990 ATOM 61641 O WAT 2991 0.929 99.125 147.143 1.00 0.00 O ATOM 61642 H1 WAT 2991 0.440 99.870 146.794 1.00 0.00 H ATOM 61643 H2 WAT 2991 0.255 98.516 147.444 1.00 0.00 H TER 61645 WAT 2991 ATOM 61645 O WAT 2992 120.871 89.563 66.403 1.00 0.00 O ATOM 61646 H1 WAT 2992 121.065 90.348 65.890 1.00 0.00 H ATOM 61647 H2 WAT 2992 121.474 88.901 66.067 1.00 0.00 H TER 61649 WAT 2992 ATOM 61649 O WAT 2993 68.269 67.563 81.619 1.00 0.00 O ATOM 61650 H1 WAT 2993 67.719 66.837 81.323 1.00 0.00 H ATOM 61651 H2 WAT 2993 68.813 67.185 82.310 1.00 0.00 H TER 61653 WAT 2993 ATOM 61653 O WAT 2994 110.538 67.953 94.386 1.00 0.00 O ATOM 61654 H1 WAT 2994 110.200 68.758 94.778 1.00 0.00 H ATOM 61655 H2 WAT 2994 111.118 67.587 95.053 1.00 0.00 H TER 61657 WAT 2994 ATOM 61657 O WAT 2995 123.239 2.686 16.080 1.00 0.00 O ATOM 61658 H1 WAT 2995 123.410 3.440 15.515 1.00 0.00 H ATOM 61659 H2 WAT 2995 124.102 2.307 16.243 1.00 0.00 H TER 61661 WAT 2995 ATOM 61661 O WAT 2996 34.383 58.911 75.401 1.00 0.00 O ATOM 61662 H1 WAT 2996 34.701 58.864 74.499 1.00 0.00 H ATOM 61663 H2 WAT 2996 33.519 58.500 75.372 1.00 0.00 H TER 61665 WAT 2996 ATOM 61665 O WAT 2997 63.797 139.646 87.334 1.00 0.00 O ATOM 61666 H1 WAT 2997 64.278 139.270 88.071 1.00 0.00 H ATOM 61667 H2 WAT 2997 63.998 140.581 87.369 1.00 0.00 H TER 61669 WAT 2997 ATOM 61669 O WAT 2998 137.648 106.239 136.768 1.00 0.00 O ATOM 61670 H1 WAT 2998 137.604 105.314 136.526 1.00 0.00 H ATOM 61671 H2 WAT 2998 137.216 106.284 137.621 1.00 0.00 H TER 61673 WAT 2998 ATOM 61673 O WAT 2999 11.931 76.287 92.319 1.00 0.00 O ATOM 61674 H1 WAT 2999 11.188 76.534 91.768 1.00 0.00 H ATOM 61675 H2 WAT 2999 11.683 75.440 92.690 1.00 0.00 H TER 61677 WAT 2999 ATOM 61677 O WAT 3000 13.106 67.485 126.382 1.00 0.00 O ATOM 61678 H1 WAT 3000 12.481 67.844 127.012 1.00 0.00 H ATOM 61679 H2 WAT 3000 13.646 66.885 126.896 1.00 0.00 H TER 61681 WAT 3000 ATOM 61681 O WAT 3001 122.561 145.137 67.799 1.00 0.00 O ATOM 61682 H1 WAT 3001 123.125 145.348 68.543 1.00 0.00 H ATOM 61683 H2 WAT 3001 121.806 145.718 67.898 1.00 0.00 H TER 61685 WAT 3001 ATOM 61685 O WAT 3002 25.551 103.070 1.951 1.00 0.00 O ATOM 61686 H1 WAT 3002 24.738 103.519 1.720 1.00 0.00 H ATOM 61687 H2 WAT 3002 25.362 102.143 1.811 1.00 0.00 H TER 61689 WAT 3002 ATOM 61689 O WAT 3003 50.827 24.832 157.718 1.00 0.00 O ATOM 61690 H1 WAT 3003 50.229 24.278 157.217 1.00 0.00 H ATOM 61691 H2 WAT 3003 50.792 25.681 157.278 1.00 0.00 H TER 61693 WAT 3003 ATOM 61693 O WAT 3004 106.619 78.886 85.406 1.00 0.00 O ATOM 61694 H1 WAT 3004 106.590 78.059 84.924 1.00 0.00 H ATOM 61695 H2 WAT 3004 106.022 79.462 84.930 1.00 0.00 H TER 61697 WAT 3004 ATOM 61697 O WAT 3005 42.885 49.580 100.389 1.00 0.00 O ATOM 61698 H1 WAT 3005 43.443 50.341 100.226 1.00 0.00 H ATOM 61699 H2 WAT 3005 43.148 48.944 99.724 1.00 0.00 H TER 61701 WAT 3005 ATOM 61701 O WAT 3006 61.571 6.549 2.176 1.00 0.00 O ATOM 61702 H1 WAT 3006 61.209 5.884 2.762 1.00 0.00 H ATOM 61703 H2 WAT 3006 61.505 6.160 1.303 1.00 0.00 H TER 61705 WAT 3006 ATOM 61705 O WAT 3007 132.197 130.744 126.778 1.00 0.00 O ATOM 61706 H1 WAT 3007 132.351 130.134 126.057 1.00 0.00 H ATOM 61707 H2 WAT 3007 132.932 131.357 126.734 1.00 0.00 H TER 61709 WAT 3007 ATOM 61709 O WAT 3008 35.475 22.922 142.397 1.00 0.00 O ATOM 61710 H1 WAT 3008 35.249 23.310 141.551 1.00 0.00 H ATOM 61711 H2 WAT 3008 34.691 22.439 142.657 1.00 0.00 H TER 61713 WAT 3008 ATOM 61713 O WAT 3009 6.332 56.457 74.769 1.00 0.00 O ATOM 61714 H1 WAT 3009 5.742 56.749 74.074 1.00 0.00 H ATOM 61715 H2 WAT 3009 6.360 57.190 75.383 1.00 0.00 H TER 61717 WAT 3009 ATOM 61717 O WAT 3010 9.917 140.365 2.928 1.00 0.00 O ATOM 61718 H1 WAT 3010 9.380 140.825 2.283 1.00 0.00 H ATOM 61719 H2 WAT 3010 10.815 140.475 2.615 1.00 0.00 H TER 61721 WAT 3010 ATOM 61721 O WAT 3011 61.045 27.365 118.561 1.00 0.00 O ATOM 61722 H1 WAT 3011 61.049 27.699 117.664 1.00 0.00 H ATOM 61723 H2 WAT 3011 60.202 27.647 118.917 1.00 0.00 H TER 61725 WAT 3011 ATOM 61725 O WAT 3012 44.376 82.231 142.338 1.00 0.00 O ATOM 61726 H1 WAT 3012 43.575 82.197 142.862 1.00 0.00 H ATOM 61727 H2 WAT 3012 44.526 83.165 142.191 1.00 0.00 H TER 61729 WAT 3012 ATOM 61729 O WAT 3013 19.520 65.376 63.920 1.00 0.00 O ATOM 61730 H1 WAT 3013 19.318 65.729 64.786 1.00 0.00 H ATOM 61731 H2 WAT 3013 20.281 64.813 64.062 1.00 0.00 H TER 61733 WAT 3013 ATOM 61733 O WAT 3014 19.829 50.020 2.816 1.00 0.00 O ATOM 61734 H1 WAT 3014 19.931 50.807 3.351 1.00 0.00 H ATOM 61735 H2 WAT 3014 20.649 49.955 2.326 1.00 0.00 H TER 61737 WAT 3014 ATOM 61737 O WAT 3015 134.262 50.707 105.262 1.00 0.00 O ATOM 61738 H1 WAT 3015 134.951 50.771 105.923 1.00 0.00 H ATOM 61739 H2 WAT 3015 133.473 50.490 105.760 1.00 0.00 H TER 61741 WAT 3015 ATOM 61741 O WAT 3016 142.161 102.049 109.263 1.00 0.00 O ATOM 61742 H1 WAT 3016 141.985 102.965 109.477 1.00 0.00 H ATOM 61743 H2 WAT 3016 143.040 102.057 108.884 1.00 0.00 H TER 61745 WAT 3016 ATOM 61745 O WAT 3017 45.030 133.289 0.055 1.00 0.00 O ATOM 61746 H1 WAT 3017 44.184 133.733 -0.005 1.00 0.00 H ATOM 61747 H2 WAT 3017 45.013 132.857 0.909 1.00 0.00 H TER 61749 WAT 3017 ATOM 61749 O WAT 3018 131.136 15.134 11.296 1.00 0.00 O ATOM 61750 H1 WAT 3018 130.664 15.965 11.343 1.00 0.00 H ATOM 61751 H2 WAT 3018 132.037 15.381 11.088 1.00 0.00 H TER 61753 WAT 3018 ATOM 61753 O WAT 3019 42.137 17.134 91.648 1.00 0.00 O ATOM 61754 H1 WAT 3019 42.290 16.883 92.559 1.00 0.00 H ATOM 61755 H2 WAT 3019 43.000 17.392 91.323 1.00 0.00 H TER 61757 WAT 3019 ATOM 61757 O WAT 3020 63.861 101.959 1.259 1.00 0.00 O ATOM 61758 H1 WAT 3020 63.083 101.523 0.909 1.00 0.00 H ATOM 61759 H2 WAT 3020 64.455 101.244 1.485 1.00 0.00 H TER 61761 WAT 3020 ATOM 61761 O WAT 3021 142.034 35.528 135.533 1.00 0.00 O ATOM 61762 H1 WAT 3021 141.390 35.020 136.026 1.00 0.00 H ATOM 61763 H2 WAT 3021 142.756 35.660 136.146 1.00 0.00 H TER 61765 WAT 3021 ATOM 61765 O WAT 3022 16.432 137.093 150.121 1.00 0.00 O ATOM 61766 H1 WAT 3022 16.650 137.706 150.824 1.00 0.00 H ATOM 61767 H2 WAT 3022 15.745 136.539 150.491 1.00 0.00 H TER 61769 WAT 3022 ATOM 61769 O WAT 3023 122.231 120.137 17.162 1.00 0.00 O ATOM 61770 H1 WAT 3023 121.553 120.433 17.769 1.00 0.00 H ATOM 61771 H2 WAT 3023 121.792 119.491 16.608 1.00 0.00 H TER 61773 WAT 3023 ATOM 61773 O WAT 3024 133.525 145.478 107.208 1.00 0.00 O ATOM 61774 H1 WAT 3024 133.681 144.576 106.929 1.00 0.00 H ATOM 61775 H2 WAT 3024 133.610 145.995 106.406 1.00 0.00 H TER 61777 WAT 3024 ATOM 61777 O WAT 3025 143.922 77.883 74.122 1.00 0.00 O ATOM 61778 H1 WAT 3025 143.057 77.754 74.511 1.00 0.00 H ATOM 61779 H2 WAT 3025 143.782 78.538 73.439 1.00 0.00 H TER 61781 WAT 3025 ATOM 61781 O WAT 3026 130.847 47.781 22.558 1.00 0.00 O ATOM 61782 H1 WAT 3026 130.040 47.366 22.861 1.00 0.00 H ATOM 61783 H2 WAT 3026 131.510 47.094 22.625 1.00 0.00 H TER 61785 WAT 3026 ATOM 61785 O WAT 3027 132.430 117.922 0.553 1.00 0.00 O ATOM 61786 H1 WAT 3027 133.291 118.287 0.758 1.00 0.00 H ATOM 61787 H2 WAT 3027 132.006 118.594 0.019 1.00 0.00 H TER 61789 WAT 3027 ATOM 61789 O WAT 3028 117.668 10.199 111.873 1.00 0.00 O ATOM 61790 H1 WAT 3028 117.582 10.644 112.716 1.00 0.00 H ATOM 61791 H2 WAT 3028 117.306 10.817 111.238 1.00 0.00 H TER 61793 WAT 3028 ATOM 61793 O WAT 3029 139.679 34.350 98.318 1.00 0.00 O ATOM 61794 H1 WAT 3029 138.868 33.888 98.528 1.00 0.00 H ATOM 61795 H2 WAT 3029 140.365 33.834 98.741 1.00 0.00 H TER 61797 WAT 3029 ATOM 61797 O WAT 3030 36.256 143.729 150.258 1.00 0.00 O ATOM 61798 H1 WAT 3030 36.585 143.324 149.456 1.00 0.00 H ATOM 61799 H2 WAT 3030 35.308 143.770 150.134 1.00 0.00 H TER 61801 WAT 3030 ATOM 61801 O WAT 3031 56.496 75.303 135.486 1.00 0.00 O ATOM 61802 H1 WAT 3031 55.956 74.690 134.987 1.00 0.00 H ATOM 61803 H2 WAT 3031 56.298 75.106 136.402 1.00 0.00 H TER 61805 WAT 3031 ATOM 61805 O WAT 3032 97.687 120.353 70.013 1.00 0.00 O ATOM 61806 H1 WAT 3032 98.576 120.158 69.717 1.00 0.00 H ATOM 61807 H2 WAT 3032 97.122 119.876 69.404 1.00 0.00 H TER 61809 WAT 3032 ATOM 61809 O WAT 3033 38.698 136.079 124.222 1.00 0.00 O ATOM 61810 H1 WAT 3033 39.067 136.949 124.070 1.00 0.00 H ATOM 61811 H2 WAT 3033 38.509 136.060 125.160 1.00 0.00 H TER 61813 WAT 3033 ATOM 61813 O WAT 3034 139.961 69.353 105.402 1.00 0.00 O ATOM 61814 H1 WAT 3034 139.060 69.429 105.717 1.00 0.00 H ATOM 61815 H2 WAT 3034 140.251 68.495 105.713 1.00 0.00 H TER 61817 WAT 3034 ATOM 61817 O WAT 3035 99.821 103.499 157.504 1.00 0.00 O ATOM 61818 H1 WAT 3035 99.038 103.016 157.238 1.00 0.00 H ATOM 61819 H2 WAT 3035 100.467 103.300 156.826 1.00 0.00 H TER 61821 WAT 3035 ATOM 61821 O WAT 3036 123.678 110.806 94.814 1.00 0.00 O ATOM 61822 H1 WAT 3036 123.739 109.861 94.958 1.00 0.00 H ATOM 61823 H2 WAT 3036 123.947 111.193 95.647 1.00 0.00 H TER 61825 WAT 3036 ATOM 61825 O WAT 3037 64.441 15.898 1.286 1.00 0.00 O ATOM 61826 H1 WAT 3037 64.444 14.950 1.416 1.00 0.00 H ATOM 61827 H2 WAT 3037 63.517 16.143 1.328 1.00 0.00 H TER 61829 WAT 3037 ATOM 61829 O WAT 3038 93.310 77.137 123.784 1.00 0.00 O ATOM 61830 H1 WAT 3038 93.070 78.057 123.678 1.00 0.00 H ATOM 61831 H2 WAT 3038 94.002 77.144 124.445 1.00 0.00 H TER 61833 WAT 3038 ATOM 61833 O WAT 3039 102.752 29.554 145.993 1.00 0.00 O ATOM 61834 H1 WAT 3039 103.579 29.777 145.566 1.00 0.00 H ATOM 61835 H2 WAT 3039 102.820 29.942 146.865 1.00 0.00 H TER 61837 WAT 3039 ATOM 61837 O WAT 3040 84.307 24.611 65.439 1.00 0.00 O ATOM 61838 H1 WAT 3040 83.612 23.990 65.219 1.00 0.00 H ATOM 61839 H2 WAT 3040 83.915 25.186 66.096 1.00 0.00 H TER 61841 WAT 3040 ATOM 61841 O WAT 3041 45.842 126.892 130.992 1.00 0.00 O ATOM 61842 H1 WAT 3041 45.530 127.019 130.096 1.00 0.00 H ATOM 61843 H2 WAT 3041 45.073 127.053 131.538 1.00 0.00 H TER 61845 WAT 3041 ATOM 61845 O WAT 3042 112.901 25.324 99.671 1.00 0.00 O ATOM 61846 H1 WAT 3042 113.077 25.778 100.494 1.00 0.00 H ATOM 61847 H2 WAT 3042 112.002 25.566 99.450 1.00 0.00 H TER 61849 WAT 3042 ATOM 61849 O WAT 3043 126.618 34.347 78.730 1.00 0.00 O ATOM 61850 H1 WAT 3043 126.335 35.138 79.189 1.00 0.00 H ATOM 61851 H2 WAT 3043 127.188 33.898 79.355 1.00 0.00 H TER 61853 WAT 3043 ATOM 61853 O WAT 3044 108.701 33.600 141.656 1.00 0.00 O ATOM 61854 H1 WAT 3044 108.589 32.652 141.723 1.00 0.00 H ATOM 61855 H2 WAT 3044 109.645 33.723 141.551 1.00 0.00 H TER 61857 WAT 3044 ATOM 61857 O WAT 3045 61.796 69.450 19.338 1.00 0.00 O ATOM 61858 H1 WAT 3045 62.620 69.035 19.595 1.00 0.00 H ATOM 61859 H2 WAT 3045 61.169 69.171 20.005 1.00 0.00 H TER 61861 WAT 3045 ATOM 61861 O WAT 3046 144.075 93.487 95.977 1.00 0.00 O ATOM 61862 H1 WAT 3046 144.694 92.761 95.902 1.00 0.00 H ATOM 61863 H2 WAT 3046 144.612 94.234 96.241 1.00 0.00 H TER 61865 WAT 3046 ATOM 61865 O WAT 3047 100.576 30.141 76.663 1.00 0.00 O ATOM 61866 H1 WAT 3047 99.782 29.692 76.954 1.00 0.00 H ATOM 61867 H2 WAT 3047 101.226 29.937 77.336 1.00 0.00 H TER 61869 WAT 3047 ATOM 61869 O WAT 3048 106.637 19.017 70.641 1.00 0.00 O ATOM 61870 H1 WAT 3048 106.729 18.227 70.108 1.00 0.00 H ATOM 61871 H2 WAT 3048 105.901 18.829 71.224 1.00 0.00 H TER 61873 WAT 3048 ATOM 61873 O WAT 3049 45.066 86.496 138.660 1.00 0.00 O ATOM 61874 H1 WAT 3049 44.469 86.900 139.290 1.00 0.00 H ATOM 61875 H2 WAT 3049 45.866 86.332 139.160 1.00 0.00 H TER 61877 WAT 3049 ATOM 61877 O WAT 3050 4.295 42.228 65.571 1.00 0.00 O ATOM 61878 H1 WAT 3050 4.730 41.555 65.047 1.00 0.00 H ATOM 61879 H2 WAT 3050 5.003 42.811 65.846 1.00 0.00 H TER 61881 WAT 3050 ATOM 61881 O WAT 3051 17.625 70.457 10.798 1.00 0.00 O ATOM 61882 H1 WAT 3051 17.094 70.053 11.484 1.00 0.00 H ATOM 61883 H2 WAT 3051 17.901 71.294 11.171 1.00 0.00 H TER 61885 WAT 3051 ATOM 61885 O WAT 3052 127.157 0.857 121.102 1.00 0.00 O ATOM 61886 H1 WAT 3052 126.734 0.311 121.764 1.00 0.00 H ATOM 61887 H2 WAT 3052 127.900 1.253 121.556 1.00 0.00 H TER 61889 WAT 3052 ATOM 61889 O WAT 3053 99.331 138.797 130.037 1.00 0.00 O ATOM 61890 H1 WAT 3053 98.540 138.258 130.005 1.00 0.00 H ATOM 61891 H2 WAT 3053 99.650 138.702 130.934 1.00 0.00 H TER 61893 WAT 3053 ATOM 61893 O WAT 3054 41.865 52.183 24.717 1.00 0.00 O ATOM 61894 H1 WAT 3054 41.087 52.739 24.673 1.00 0.00 H ATOM 61895 H2 WAT 3054 41.520 51.300 24.847 1.00 0.00 H TER 61897 WAT 3054 ATOM 61897 O WAT 3055 67.528 68.668 12.521 1.00 0.00 O ATOM 61898 H1 WAT 3055 68.394 68.832 12.149 1.00 0.00 H ATOM 61899 H2 WAT 3055 67.695 68.106 13.278 1.00 0.00 H TER 61901 WAT 3055 ATOM 61901 O WAT 3056 13.634 139.369 101.731 1.00 0.00 O ATOM 61902 H1 WAT 3056 14.114 138.759 101.171 1.00 0.00 H ATOM 61903 H2 WAT 3056 13.188 138.810 102.367 1.00 0.00 H TER 61905 WAT 3056 ATOM 61905 O WAT 3057 52.492 109.910 100.591 1.00 0.00 O ATOM 61906 H1 WAT 3057 53.028 110.370 101.237 1.00 0.00 H ATOM 61907 H2 WAT 3057 53.121 109.408 100.072 1.00 0.00 H TER 61909 WAT 3057 ATOM 61909 O WAT 3058 142.391 55.658 109.882 1.00 0.00 O ATOM 61910 H1 WAT 3058 143.247 55.235 109.806 1.00 0.00 H ATOM 61911 H2 WAT 3058 142.580 56.594 109.815 1.00 0.00 H TER 61913 WAT 3058 ATOM 61913 O WAT 3059 102.330 11.058 3.386 1.00 0.00 O ATOM 61914 H1 WAT 3059 101.575 10.676 3.834 1.00 0.00 H ATOM 61915 H2 WAT 3059 102.967 10.345 3.339 1.00 0.00 H TER 61917 WAT 3059 ATOM 61917 O WAT 3060 15.703 100.031 108.157 1.00 0.00 O ATOM 61918 H1 WAT 3060 15.288 100.464 107.411 1.00 0.00 H ATOM 61919 H2 WAT 3060 16.154 100.736 108.622 1.00 0.00 H TER 61921 WAT 3060 ATOM 61921 O WAT 3061 118.994 100.445 106.248 1.00 0.00 O ATOM 61922 H1 WAT 3061 118.780 99.938 105.465 1.00 0.00 H ATOM 61923 H2 WAT 3061 119.562 99.868 106.759 1.00 0.00 H TER 61925 WAT 3061 ATOM 61925 O WAT 3062 130.733 86.917 95.045 1.00 0.00 O ATOM 61926 H1 WAT 3062 129.822 86.901 94.753 1.00 0.00 H ATOM 61927 H2 WAT 3062 130.988 87.838 94.983 1.00 0.00 H TER 61929 WAT 3062 ATOM 61929 O WAT 3063 144.829 124.020 70.261 1.00 0.00 O ATOM 61930 H1 WAT 3063 144.480 123.192 70.591 1.00 0.00 H ATOM 61931 H2 WAT 3063 144.238 124.686 70.611 1.00 0.00 H TER 61933 WAT 3063 ATOM 61933 O WAT 3064 64.658 105.656 155.206 1.00 0.00 O ATOM 61934 H1 WAT 3064 64.668 106.298 155.916 1.00 0.00 H ATOM 61935 H2 WAT 3064 65.100 104.889 155.570 1.00 0.00 H TER 61937 WAT 3064 ATOM 61937 O WAT 3065 38.546 81.924 59.515 1.00 0.00 O ATOM 61938 H1 WAT 3065 38.007 81.788 60.295 1.00 0.00 H ATOM 61939 H2 WAT 3065 38.674 81.046 59.156 1.00 0.00 H TER 61941 WAT 3065 ATOM 61941 O WAT 3066 14.299 45.826 95.626 1.00 0.00 O ATOM 61942 H1 WAT 3066 14.431 46.063 94.709 1.00 0.00 H ATOM 61943 H2 WAT 3066 13.394 45.517 95.667 1.00 0.00 H TER 61945 WAT 3066 ATOM 61945 O WAT 3067 98.559 75.693 145.455 1.00 0.00 O ATOM 61946 H1 WAT 3067 97.946 75.002 145.703 1.00 0.00 H ATOM 61947 H2 WAT 3067 98.958 75.380 144.643 1.00 0.00 H TER 61949 WAT 3067 ATOM 61949 O WAT 3068 105.354 123.125 131.773 1.00 0.00 O ATOM 61950 H1 WAT 3068 104.628 122.626 132.149 1.00 0.00 H ATOM 61951 H2 WAT 3068 106.012 122.465 131.558 1.00 0.00 H TER 61953 WAT 3068 ATOM 61953 O WAT 3069 64.390 78.338 101.103 1.00 0.00 O ATOM 61954 H1 WAT 3069 64.351 78.211 100.155 1.00 0.00 H ATOM 61955 H2 WAT 3069 65.171 78.875 101.241 1.00 0.00 H TER 61957 WAT 3069 ATOM 61957 O WAT 3070 59.280 19.759 55.275 1.00 0.00 O ATOM 61958 H1 WAT 3070 59.966 20.422 55.347 1.00 0.00 H ATOM 61959 H2 WAT 3070 59.436 19.345 54.426 1.00 0.00 H TER 61961 WAT 3070 ATOM 61961 O WAT 3071 53.629 7.147 11.225 1.00 0.00 O ATOM 61962 H1 WAT 3071 53.960 7.773 10.581 1.00 0.00 H ATOM 61963 H2 WAT 3071 54.335 7.068 11.867 1.00 0.00 H TER 61965 WAT 3071 ATOM 61965 O WAT 3072 79.456 80.940 20.198 1.00 0.00 O ATOM 61966 H1 WAT 3072 80.245 80.681 20.674 1.00 0.00 H ATOM 61967 H2 WAT 3072 79.386 81.883 20.345 1.00 0.00 H TER 61969 WAT 3072 ATOM 61969 O WAT 3073 77.582 21.717 19.945 1.00 0.00 O ATOM 61970 H1 WAT 3073 77.604 20.977 19.337 1.00 0.00 H ATOM 61971 H2 WAT 3073 78.075 22.407 19.500 1.00 0.00 H TER 61973 WAT 3073 ATOM 61973 O WAT 3074 132.416 89.939 16.870 1.00 0.00 O ATOM 61974 H1 WAT 3074 132.304 89.028 17.144 1.00 0.00 H ATOM 61975 H2 WAT 3074 132.940 89.886 16.071 1.00 0.00 H TER 61977 WAT 3074 ATOM 61977 O WAT 3075 30.717 91.377 54.826 1.00 0.00 O ATOM 61978 H1 WAT 3075 29.974 91.611 54.269 1.00 0.00 H ATOM 61979 H2 WAT 3075 30.843 92.140 55.390 1.00 0.00 H TER 61981 WAT 3075 ATOM 61981 O WAT 3076 96.518 88.852 156.312 1.00 0.00 O ATOM 61982 H1 WAT 3076 96.437 88.557 157.219 1.00 0.00 H ATOM 61983 H2 WAT 3076 95.846 89.527 156.218 1.00 0.00 H TER 61985 WAT 3076 ATOM 61985 O WAT 3077 131.492 114.861 80.563 1.00 0.00 O ATOM 61986 H1 WAT 3077 132.241 115.457 80.538 1.00 0.00 H ATOM 61987 H2 WAT 3077 131.684 114.266 81.287 1.00 0.00 H TER 61989 WAT 3077 ATOM 61989 O WAT 3078 43.833 33.525 129.236 1.00 0.00 O ATOM 61990 H1 WAT 3078 42.934 33.343 128.962 1.00 0.00 H ATOM 61991 H2 WAT 3078 44.227 32.661 129.354 1.00 0.00 H TER 61993 WAT 3078 ATOM 61993 O WAT 3079 101.339 99.502 81.414 1.00 0.00 O ATOM 61994 H1 WAT 3079 100.957 99.814 82.235 1.00 0.00 H ATOM 61995 H2 WAT 3079 101.275 98.549 81.468 1.00 0.00 H TER 61997 WAT 3079 ATOM 61997 O WAT 3080 111.094 136.146 56.975 1.00 0.00 O ATOM 61998 H1 WAT 3080 110.645 135.580 56.347 1.00 0.00 H ATOM 61999 H2 WAT 3080 111.207 135.598 57.752 1.00 0.00 H TER 62001 WAT 3080 ATOM 62001 O WAT 3081 88.130 32.995 81.201 1.00 0.00 O ATOM 62002 H1 WAT 3081 88.093 32.962 82.156 1.00 0.00 H ATOM 62003 H2 WAT 3081 87.592 32.257 80.914 1.00 0.00 H TER 62005 WAT 3081 ATOM 62005 O WAT 3082 10.071 75.722 25.024 1.00 0.00 O ATOM 62006 H1 WAT 3082 10.115 76.562 24.567 1.00 0.00 H ATOM 62007 H2 WAT 3082 10.378 75.916 25.910 1.00 0.00 H TER 62009 WAT 3082 ATOM 62009 O WAT 3083 36.491 80.263 7.689 1.00 0.00 O ATOM 62010 H1 WAT 3083 36.485 80.788 8.490 1.00 0.00 H ATOM 62011 H2 WAT 3083 35.953 79.500 7.899 1.00 0.00 H TER 62013 WAT 3083 ATOM 62013 O WAT 3084 25.353 127.247 155.309 1.00 0.00 O ATOM 62014 H1 WAT 3084 25.465 126.807 156.151 1.00 0.00 H ATOM 62015 H2 WAT 3084 26.002 126.837 154.737 1.00 0.00 H TER 62017 WAT 3084 ATOM 62017 O WAT 3085 4.922 113.440 124.014 1.00 0.00 O ATOM 62018 H1 WAT 3085 5.494 114.018 123.509 1.00 0.00 H ATOM 62019 H2 WAT 3085 5.093 112.566 123.662 1.00 0.00 H TER 62021 WAT 3085 ATOM 62021 O WAT 3086 72.576 14.354 134.649 1.00 0.00 O ATOM 62022 H1 WAT 3086 72.649 13.400 134.623 1.00 0.00 H ATOM 62023 H2 WAT 3086 72.338 14.600 133.755 1.00 0.00 H TER 62025 WAT 3086 ATOM 62025 O WAT 3087 47.875 39.710 90.964 1.00 0.00 O ATOM 62026 H1 WAT 3087 47.187 39.072 90.773 1.00 0.00 H ATOM 62027 H2 WAT 3087 47.561 40.175 91.740 1.00 0.00 H TER 62029 WAT 3087 ATOM 62029 O WAT 3088 6.213 118.300 93.724 1.00 0.00 O ATOM 62030 H1 WAT 3088 6.305 117.360 93.569 1.00 0.00 H ATOM 62031 H2 WAT 3088 6.715 118.709 93.019 1.00 0.00 H TER 62033 WAT 3088 ATOM 62033 O WAT 3089 122.522 1.172 116.982 1.00 0.00 O ATOM 62034 H1 WAT 3089 123.228 1.508 116.431 1.00 0.00 H ATOM 62035 H2 WAT 3089 121.933 0.728 116.372 1.00 0.00 H TER 62037 WAT 3089 ATOM 62037 O WAT 3090 126.531 111.294 113.399 1.00 0.00 O ATOM 62038 H1 WAT 3090 126.249 110.520 113.886 1.00 0.00 H ATOM 62039 H2 WAT 3090 125.742 111.830 113.323 1.00 0.00 H TER 62041 WAT 3090 ATOM 62041 O WAT 3091 128.746 40.829 150.984 1.00 0.00 O ATOM 62042 H1 WAT 3091 129.025 40.680 150.080 1.00 0.00 H ATOM 62043 H2 WAT 3091 129.370 40.331 151.512 1.00 0.00 H TER 62045 WAT 3091 ATOM 62045 O WAT 3092 140.242 141.005 95.869 1.00 0.00 O ATOM 62046 H1 WAT 3092 140.473 140.603 95.032 1.00 0.00 H ATOM 62047 H2 WAT 3092 139.597 140.409 96.251 1.00 0.00 H TER 62049 WAT 3092 ATOM 62049 O WAT 3093 23.362 126.206 5.317 1.00 0.00 O ATOM 62050 H1 WAT 3093 22.675 125.622 5.639 1.00 0.00 H ATOM 62051 H2 WAT 3093 23.507 126.824 6.034 1.00 0.00 H TER 62053 WAT 3093 ATOM 62053 O WAT 3094 129.632 16.204 109.209 1.00 0.00 O ATOM 62054 H1 WAT 3094 130.157 16.297 108.414 1.00 0.00 H ATOM 62055 H2 WAT 3094 129.322 15.299 109.186 1.00 0.00 H TER 62057 WAT 3094 ATOM 62057 O WAT 3095 31.716 52.904 107.042 1.00 0.00 O ATOM 62058 H1 WAT 3095 32.383 52.713 106.383 1.00 0.00 H ATOM 62059 H2 WAT 3095 31.172 53.584 106.643 1.00 0.00 H TER 62061 WAT 3095 ATOM 62061 O WAT 3096 13.398 84.648 150.740 1.00 0.00 O ATOM 62062 H1 WAT 3096 13.226 83.808 150.316 1.00 0.00 H ATOM 62063 H2 WAT 3096 14.092 85.045 150.214 1.00 0.00 H TER 62065 WAT 3096 ATOM 62065 O WAT 3097 23.161 33.941 115.449 1.00 0.00 O ATOM 62066 H1 WAT 3097 22.331 34.413 115.397 1.00 0.00 H ATOM 62067 H2 WAT 3097 23.008 33.132 114.961 1.00 0.00 H TER 62069 WAT 3097 ATOM 62069 O WAT 3098 62.019 76.208 102.223 1.00 0.00 O ATOM 62070 H1 WAT 3098 61.518 75.393 102.237 1.00 0.00 H ATOM 62071 H2 WAT 3098 62.355 76.299 103.115 1.00 0.00 H TER 62073 WAT 3098 ATOM 62073 O WAT 3099 121.936 48.589 116.721 1.00 0.00 O ATOM 62074 H1 WAT 3099 121.539 48.247 115.921 1.00 0.00 H ATOM 62075 H2 WAT 3099 121.390 49.338 116.960 1.00 0.00 H TER 62077 WAT 3099 ATOM 62077 O WAT 3100 134.039 120.492 150.707 1.00 0.00 O ATOM 62078 H1 WAT 3100 134.283 121.002 149.935 1.00 0.00 H ATOM 62079 H2 WAT 3100 133.943 121.142 151.403 1.00 0.00 H TER 62081 WAT 3100 ATOM 62081 O WAT 3101 93.583 33.589 94.845 1.00 0.00 O ATOM 62082 H1 WAT 3101 94.148 32.817 94.879 1.00 0.00 H ATOM 62083 H2 WAT 3101 92.782 33.320 95.294 1.00 0.00 H TER 62085 WAT 3101 ATOM 62085 O WAT 3102 63.691 42.198 150.553 1.00 0.00 O ATOM 62086 H1 WAT 3102 63.831 42.874 151.216 1.00 0.00 H ATOM 62087 H2 WAT 3102 62.985 41.657 150.907 1.00 0.00 H TER 62089 WAT 3102 ATOM 62089 O WAT 3103 27.526 36.463 124.351 1.00 0.00 O ATOM 62090 H1 WAT 3103 26.724 36.925 124.594 1.00 0.00 H ATOM 62091 H2 WAT 3103 27.225 35.615 124.025 1.00 0.00 H TER 62093 WAT 3103 ATOM 62093 O WAT 3104 20.244 125.060 142.513 1.00 0.00 O ATOM 62094 H1 WAT 3104 19.402 125.513 142.562 1.00 0.00 H ATOM 62095 H2 WAT 3104 20.621 125.345 141.681 1.00 0.00 H TER 62097 WAT 3104 ATOM 62097 O WAT 3105 93.229 119.659 144.116 1.00 0.00 O ATOM 62098 H1 WAT 3105 93.646 119.695 143.255 1.00 0.00 H ATOM 62099 H2 WAT 3105 92.899 120.546 144.259 1.00 0.00 H TER 62101 WAT 3105 ATOM 62101 O WAT 3106 94.884 123.035 1.015 1.00 0.00 O ATOM 62102 H1 WAT 3106 95.726 123.170 1.451 1.00 0.00 H ATOM 62103 H2 WAT 3106 94.601 122.168 1.306 1.00 0.00 H TER 62105 WAT 3106 ATOM 62105 O WAT 3107 75.775 6.024 85.804 1.00 0.00 O ATOM 62106 H1 WAT 3107 74.973 6.120 85.289 1.00 0.00 H ATOM 62107 H2 WAT 3107 76.342 5.475 85.263 1.00 0.00 H TER 62109 WAT 3107 ATOM 62109 O WAT 3108 72.864 55.332 97.264 1.00 0.00 O ATOM 62110 H1 WAT 3108 72.666 54.405 97.133 1.00 0.00 H ATOM 62111 H2 WAT 3108 72.080 55.688 97.683 1.00 0.00 H TER 62113 WAT 3108 ATOM 62113 O WAT 3109 20.034 141.855 80.897 1.00 0.00 O ATOM 62114 H1 WAT 3109 20.553 142.196 80.169 1.00 0.00 H ATOM 62115 H2 WAT 3109 20.486 141.052 81.158 1.00 0.00 H TER 62117 WAT 3109 ATOM 62117 O WAT 3110 18.152 119.988 25.168 1.00 0.00 O ATOM 62118 H1 WAT 3110 18.772 120.237 25.854 1.00 0.00 H ATOM 62119 H2 WAT 3110 17.291 120.102 25.570 1.00 0.00 H TER 62121 WAT 3110 ATOM 62121 O WAT 3111 19.214 26.710 133.776 1.00 0.00 O ATOM 62122 H1 WAT 3111 20.039 26.431 134.172 1.00 0.00 H ATOM 62123 H2 WAT 3111 19.474 27.180 132.984 1.00 0.00 H TER 62125 WAT 3111 ATOM 62125 O WAT 3112 11.215 144.708 108.013 1.00 0.00 O ATOM 62126 H1 WAT 3112 10.371 144.464 107.633 1.00 0.00 H ATOM 62127 H2 WAT 3112 11.550 145.392 107.433 1.00 0.00 H TER 62129 WAT 3112 ATOM 62129 O WAT 3113 64.145 12.747 6.214 1.00 0.00 O ATOM 62130 H1 WAT 3113 63.880 11.843 6.385 1.00 0.00 H ATOM 62131 H2 WAT 3113 63.951 13.211 7.028 1.00 0.00 H TER 62133 WAT 3113 ATOM 62133 O WAT 3114 128.093 4.052 90.970 1.00 0.00 O ATOM 62134 H1 WAT 3114 128.621 4.799 90.687 1.00 0.00 H ATOM 62135 H2 WAT 3114 128.588 3.669 91.694 1.00 0.00 H TER 62137 WAT 3114 ATOM 62137 O WAT 3115 67.861 9.282 18.018 1.00 0.00 O ATOM 62138 H1 WAT 3115 66.927 9.111 18.141 1.00 0.00 H ATOM 62139 H2 WAT 3115 67.915 10.229 17.886 1.00 0.00 H TER 62141 WAT 3115 ATOM 62141 O WAT 3116 98.539 56.722 152.177 1.00 0.00 O ATOM 62142 H1 WAT 3116 98.365 55.926 152.679 1.00 0.00 H ATOM 62143 H2 WAT 3116 97.762 57.265 152.313 1.00 0.00 H TER 62145 WAT 3116 ATOM 62145 O WAT 3117 114.469 59.299 16.170 1.00 0.00 O ATOM 62146 H1 WAT 3117 114.802 58.414 16.318 1.00 0.00 H ATOM 62147 H2 WAT 3117 114.173 59.295 15.260 1.00 0.00 H TER 62149 WAT 3117 ATOM 62149 O WAT 3118 108.654 90.932 156.173 1.00 0.00 O ATOM 62150 H1 WAT 3118 109.251 91.143 155.455 1.00 0.00 H ATOM 62151 H2 WAT 3118 108.495 89.992 156.084 1.00 0.00 H TER 62153 WAT 3118 ATOM 62153 O WAT 3119 32.177 42.441 118.197 1.00 0.00 O ATOM 62154 H1 WAT 3119 31.606 43.072 117.759 1.00 0.00 H ATOM 62155 H2 WAT 3119 32.774 42.142 117.511 1.00 0.00 H TER 62157 WAT 3119 ATOM 62157 O WAT 3120 1.747 106.224 75.197 1.00 0.00 O ATOM 62158 H1 WAT 3120 2.277 105.770 74.542 1.00 0.00 H ATOM 62159 H2 WAT 3120 1.597 107.093 74.824 1.00 0.00 H TER 62161 WAT 3120 ATOM 62161 O WAT 3121 65.547 38.855 15.123 1.00 0.00 O ATOM 62162 H1 WAT 3121 64.959 38.832 15.878 1.00 0.00 H ATOM 62163 H2 WAT 3121 65.668 37.936 14.886 1.00 0.00 H TER 62165 WAT 3121 ATOM 62165 O WAT 3122 122.791 118.928 97.657 1.00 0.00 O ATOM 62166 H1 WAT 3122 122.399 118.056 97.622 1.00 0.00 H ATOM 62167 H2 WAT 3122 122.732 119.254 96.759 1.00 0.00 H TER 62169 WAT 3122 ATOM 62169 O WAT 3123 1.758 17.442 71.589 1.00 0.00 O ATOM 62170 H1 WAT 3123 2.215 16.960 72.278 1.00 0.00 H ATOM 62171 H2 WAT 3123 1.705 18.339 71.918 1.00 0.00 H TER 62173 WAT 3123 ATOM 62173 O WAT 3124 78.607 68.475 88.505 1.00 0.00 O ATOM 62174 H1 WAT 3124 79.551 68.355 88.615 1.00 0.00 H ATOM 62175 H2 WAT 3124 78.312 68.835 89.341 1.00 0.00 H TER 62177 WAT 3124 ATOM 62177 O WAT 3125 110.581 87.180 94.306 1.00 0.00 O ATOM 62178 H1 WAT 3125 110.796 86.748 93.479 1.00 0.00 H ATOM 62179 H2 WAT 3125 110.057 86.537 94.783 1.00 0.00 H TER 62181 WAT 3125 ATOM 62181 O WAT 3126 28.893 74.394 71.940 1.00 0.00 O ATOM 62182 H1 WAT 3126 29.615 73.985 72.417 1.00 0.00 H ATOM 62183 H2 WAT 3126 29.303 74.774 71.163 1.00 0.00 H TER 62185 WAT 3126 ATOM 62185 O WAT 3127 142.088 42.388 96.218 1.00 0.00 O ATOM 62186 H1 WAT 3127 141.658 43.219 96.418 1.00 0.00 H ATOM 62187 H2 WAT 3127 141.370 41.791 96.008 1.00 0.00 H TER 62189 WAT 3127 ATOM 62189 O WAT 3128 23.908 69.118 136.491 1.00 0.00 O ATOM 62190 H1 WAT 3128 23.248 68.505 136.813 1.00 0.00 H ATOM 62191 H2 WAT 3128 23.414 69.906 136.265 1.00 0.00 H TER 62193 WAT 3128 ATOM 62193 O WAT 3129 133.471 107.688 70.135 1.00 0.00 O ATOM 62194 H1 WAT 3129 133.691 108.562 69.814 1.00 0.00 H ATOM 62195 H2 WAT 3129 133.072 107.840 70.992 1.00 0.00 H TER 62197 WAT 3129 ATOM 62197 O WAT 3130 54.345 30.402 130.452 1.00 0.00 O ATOM 62198 H1 WAT 3130 54.994 30.930 130.917 1.00 0.00 H ATOM 62199 H2 WAT 3130 54.405 29.537 130.858 1.00 0.00 H TER 62201 WAT 3130 ATOM 62201 O WAT 3131 97.901 133.145 148.545 1.00 0.00 O ATOM 62202 H1 WAT 3131 97.870 132.455 149.208 1.00 0.00 H ATOM 62203 H2 WAT 3131 97.627 133.936 149.008 1.00 0.00 H TER 62205 WAT 3131 ATOM 62205 O WAT 3132 128.308 6.943 98.256 1.00 0.00 O ATOM 62206 H1 WAT 3132 128.284 7.894 98.146 1.00 0.00 H ATOM 62207 H2 WAT 3132 129.090 6.667 97.778 1.00 0.00 H TER 62209 WAT 3132 ATOM 62209 O WAT 3133 144.768 27.501 60.030 1.00 0.00 O ATOM 62210 H1 WAT 3133 144.124 27.153 60.647 1.00 0.00 H ATOM 62211 H2 WAT 3133 144.703 26.927 59.267 1.00 0.00 H TER 62213 WAT 3133 ATOM 62213 O WAT 3134 110.132 92.413 18.810 1.00 0.00 O ATOM 62214 H1 WAT 3134 110.979 92.630 19.200 1.00 0.00 H ATOM 62215 H2 WAT 3134 109.902 91.567 19.193 1.00 0.00 H TER 62217 WAT 3134 ATOM 62217 O WAT 3135 32.970 140.091 100.530 1.00 0.00 O ATOM 62218 H1 WAT 3135 32.088 139.752 100.685 1.00 0.00 H ATOM 62219 H2 WAT 3135 33.522 139.617 101.151 1.00 0.00 H TER 62221 WAT 3135 ATOM 62221 O WAT 3136 7.894 91.489 131.907 1.00 0.00 O ATOM 62222 H1 WAT 3136 8.081 91.442 130.970 1.00 0.00 H ATOM 62223 H2 WAT 3136 8.328 92.290 132.199 1.00 0.00 H TER 62225 WAT 3136 ATOM 62225 O WAT 3137 125.301 63.653 73.374 1.00 0.00 O ATOM 62226 H1 WAT 3137 126.000 63.004 73.293 1.00 0.00 H ATOM 62227 H2 WAT 3137 125.733 64.492 73.209 1.00 0.00 H TER 62229 WAT 3137 ATOM 62229 O WAT 3138 26.333 22.460 144.915 1.00 0.00 O ATOM 62230 H1 WAT 3138 27.026 22.419 145.573 1.00 0.00 H ATOM 62231 H2 WAT 3138 26.250 23.392 144.712 1.00 0.00 H TER 62233 WAT 3138 ATOM 62233 O WAT 3139 14.440 132.272 131.077 1.00 0.00 O ATOM 62234 H1 WAT 3139 13.811 131.651 131.443 1.00 0.00 H ATOM 62235 H2 WAT 3139 14.662 131.910 130.219 1.00 0.00 H TER 62237 WAT 3139 ATOM 62237 O WAT 3140 49.467 0.950 60.442 1.00 0.00 O ATOM 62238 H1 WAT 3140 49.336 0.568 59.574 1.00 0.00 H ATOM 62239 H2 WAT 3140 48.673 1.460 60.602 1.00 0.00 H TER 62241 WAT 3140 ATOM 62241 O WAT 3141 56.135 45.746 71.133 1.00 0.00 O ATOM 62242 H1 WAT 3141 56.965 45.837 71.601 1.00 0.00 H ATOM 62243 H2 WAT 3141 55.970 46.615 70.767 1.00 0.00 H TER 62245 WAT 3141 ATOM 62245 O WAT 3142 14.296 1.110 157.159 1.00 0.00 O ATOM 62246 H1 WAT 3142 14.506 1.523 156.322 1.00 0.00 H ATOM 62247 H2 WAT 3142 14.346 0.171 156.983 1.00 0.00 H TER 62249 WAT 3142 ATOM 62249 O WAT 3143 80.212 129.950 13.046 1.00 0.00 O ATOM 62250 H1 WAT 3143 79.656 129.185 13.192 1.00 0.00 H ATOM 62251 H2 WAT 3143 79.702 130.509 12.461 1.00 0.00 H TER 62253 WAT 3143 ATOM 62253 O WAT 3144 125.468 59.226 95.945 1.00 0.00 O ATOM 62254 H1 WAT 3144 126.370 59.537 95.874 1.00 0.00 H ATOM 62255 H2 WAT 3144 125.389 58.563 95.259 1.00 0.00 H TER 62257 WAT 3144 ATOM 62257 O WAT 3145 9.683 25.316 61.388 1.00 0.00 O ATOM 62258 H1 WAT 3145 9.393 24.420 61.216 1.00 0.00 H ATOM 62259 H2 WAT 3145 9.673 25.393 62.342 1.00 0.00 H TER 62261 WAT 3145 ATOM 62261 O WAT 3146 83.184 15.162 141.691 1.00 0.00 O ATOM 62262 H1 WAT 3146 83.989 14.802 141.318 1.00 0.00 H ATOM 62263 H2 WAT 3146 83.243 14.964 142.625 1.00 0.00 H TER 62265 WAT 3146 ATOM 62265 O WAT 3147 78.830 29.501 136.835 1.00 0.00 O ATOM 62266 H1 WAT 3147 79.217 29.647 135.972 1.00 0.00 H ATOM 62267 H2 WAT 3147 78.549 28.587 136.820 1.00 0.00 H TER 62269 WAT 3147 ATOM 62269 O WAT 3148 92.124 9.934 152.483 1.00 0.00 O ATOM 62270 H1 WAT 3148 91.843 9.313 153.155 1.00 0.00 H ATOM 62271 H2 WAT 3148 91.371 10.010 151.897 1.00 0.00 H TER 62273 WAT 3148 ATOM 62273 O WAT 3149 24.077 65.880 147.259 1.00 0.00 O ATOM 62274 H1 WAT 3149 23.493 66.498 146.819 1.00 0.00 H ATOM 62275 H2 WAT 3149 23.690 65.022 147.089 1.00 0.00 H TER 62277 WAT 3149 ATOM 62277 O WAT 3150 96.602 65.934 152.601 1.00 0.00 O ATOM 62278 H1 WAT 3150 96.871 65.747 153.500 1.00 0.00 H ATOM 62279 H2 WAT 3150 95.653 66.052 152.654 1.00 0.00 H TER 62281 WAT 3150 ATOM 62281 O WAT 3151 67.003 110.185 72.744 1.00 0.00 O ATOM 62282 H1 WAT 3151 67.279 110.983 73.195 1.00 0.00 H ATOM 62283 H2 WAT 3151 67.682 110.036 72.085 1.00 0.00 H TER 62285 WAT 3151 ATOM 62285 O WAT 3152 54.417 129.428 132.259 1.00 0.00 O ATOM 62286 H1 WAT 3152 54.823 129.042 131.482 1.00 0.00 H ATOM 62287 H2 WAT 3152 53.858 128.733 132.607 1.00 0.00 H TER 62289 WAT 3152 ATOM 62289 O WAT 3153 13.813 87.070 10.000 1.00 0.00 O ATOM 62290 H1 WAT 3153 12.951 87.186 9.601 1.00 0.00 H ATOM 62291 H2 WAT 3153 14.429 87.360 9.328 1.00 0.00 H TER 62293 WAT 3153 ATOM 62293 O WAT 3154 124.440 73.728 143.660 1.00 0.00 O ATOM 62294 H1 WAT 3154 124.747 73.023 144.230 1.00 0.00 H ATOM 62295 H2 WAT 3154 124.802 73.516 142.800 1.00 0.00 H TER 62297 WAT 3154 ATOM 62297 O WAT 3155 64.341 107.186 77.525 1.00 0.00 O ATOM 62298 H1 WAT 3155 63.433 107.346 77.783 1.00 0.00 H ATOM 62299 H2 WAT 3155 64.506 107.818 76.825 1.00 0.00 H TER 62301 WAT 3155 ATOM 62301 O WAT 3156 81.055 68.101 85.920 1.00 0.00 O ATOM 62302 H1 WAT 3156 80.697 67.230 85.750 1.00 0.00 H ATOM 62303 H2 WAT 3156 81.704 68.232 85.228 1.00 0.00 H TER 62305 WAT 3156 ATOM 62305 O WAT 3157 135.185 101.729 135.723 1.00 0.00 O ATOM 62306 H1 WAT 3157 134.505 101.056 135.693 1.00 0.00 H ATOM 62307 H2 WAT 3157 135.827 101.451 135.070 1.00 0.00 H TER 62309 WAT 3157 ATOM 62309 O WAT 3158 18.834 73.135 96.318 1.00 0.00 O ATOM 62310 H1 WAT 3158 19.145 72.868 97.183 1.00 0.00 H ATOM 62311 H2 WAT 3158 18.930 74.087 96.311 1.00 0.00 H TER 62313 WAT 3158 ATOM 62313 O WAT 3159 113.726 144.722 143.231 1.00 0.00 O ATOM 62314 H1 WAT 3159 113.097 145.003 143.895 1.00 0.00 H ATOM 62315 H2 WAT 3159 114.565 144.699 143.691 1.00 0.00 H TER 62317 WAT 3159 ATOM 62317 O WAT 3160 10.816 65.332 149.505 1.00 0.00 O ATOM 62318 H1 WAT 3160 10.728 65.971 150.213 1.00 0.00 H ATOM 62319 H2 WAT 3160 11.560 65.644 148.992 1.00 0.00 H TER 62321 WAT 3160 ATOM 62321 O WAT 3161 140.398 117.599 94.239 1.00 0.00 O ATOM 62322 H1 WAT 3161 141.274 117.470 93.875 1.00 0.00 H ATOM 62323 H2 WAT 3161 139.940 118.123 93.581 1.00 0.00 H TER 62325 WAT 3161 ATOM 62325 O WAT 3162 70.946 54.958 102.857 1.00 0.00 O ATOM 62326 H1 WAT 3162 70.962 55.858 103.182 1.00 0.00 H ATOM 62327 H2 WAT 3162 71.517 54.477 103.456 1.00 0.00 H TER 62329 WAT 3162 ATOM 62329 O WAT 3163 40.325 53.214 63.400 1.00 0.00 O ATOM 62330 H1 WAT 3163 40.173 53.420 62.477 1.00 0.00 H ATOM 62331 H2 WAT 3163 39.516 52.792 63.688 1.00 0.00 H TER 62333 WAT 3163 ATOM 62333 O WAT 3164 32.733 33.279 111.070 1.00 0.00 O ATOM 62334 H1 WAT 3164 32.115 32.602 111.343 1.00 0.00 H ATOM 62335 H2 WAT 3164 32.348 34.096 111.385 1.00 0.00 H TER 62337 WAT 3164 ATOM 62337 O WAT 3165 81.650 13.343 93.694 1.00 0.00 O ATOM 62338 H1 WAT 3165 81.005 13.991 93.412 1.00 0.00 H ATOM 62339 H2 WAT 3165 82.204 13.206 92.925 1.00 0.00 H TER 62341 WAT 3165 ATOM 62341 O WAT 3166 21.108 65.806 58.546 1.00 0.00 O ATOM 62342 H1 WAT 3166 20.256 65.371 58.582 1.00 0.00 H ATOM 62343 H2 WAT 3166 21.356 65.772 57.622 1.00 0.00 H TER 62345 WAT 3166 ATOM 62345 O WAT 3167 109.127 107.614 154.038 1.00 0.00 O ATOM 62346 H1 WAT 3167 108.602 106.819 153.954 1.00 0.00 H ATOM 62347 H2 WAT 3167 108.619 108.287 153.585 1.00 0.00 H TER 62349 WAT 3167 ATOM 62349 O WAT 3168 60.805 77.194 153.946 1.00 0.00 O ATOM 62350 H1 WAT 3168 59.931 77.130 153.560 1.00 0.00 H ATOM 62351 H2 WAT 3168 61.345 76.608 153.415 1.00 0.00 H TER 62353 WAT 3168 ATOM 62353 O WAT 3169 46.075 143.856 106.923 1.00 0.00 O ATOM 62354 H1 WAT 3169 45.422 143.156 106.897 1.00 0.00 H ATOM 62355 H2 WAT 3169 45.793 144.471 106.246 1.00 0.00 H TER 62357 WAT 3169 ATOM 62357 O WAT 3170 10.249 18.515 7.468 1.00 0.00 O ATOM 62358 H1 WAT 3170 9.742 19.248 7.119 1.00 0.00 H ATOM 62359 H2 WAT 3170 9.659 17.763 7.403 1.00 0.00 H TER 62361 WAT 3170 ATOM 62361 O WAT 3171 123.894 60.292 134.211 1.00 0.00 O ATOM 62362 H1 WAT 3171 124.569 60.968 134.143 1.00 0.00 H ATOM 62363 H2 WAT 3171 124.330 59.562 134.651 1.00 0.00 H TER 62365 WAT 3171 ATOM 62365 O WAT 3172 72.939 110.269 94.378 1.00 0.00 O ATOM 62366 H1 WAT 3172 72.439 110.213 95.192 1.00 0.00 H ATOM 62367 H2 WAT 3172 72.304 110.062 93.692 1.00 0.00 H TER 62369 WAT 3172 ATOM 62369 O WAT 3173 93.867 113.898 88.955 1.00 0.00 O ATOM 62370 H1 WAT 3173 93.898 113.023 89.342 1.00 0.00 H ATOM 62371 H2 WAT 3173 94.771 114.211 88.999 1.00 0.00 H TER 62373 WAT 3173 ATOM 62373 O WAT 3174 57.510 138.673 153.801 1.00 0.00 O ATOM 62374 H1 WAT 3174 58.128 138.845 153.091 1.00 0.00 H ATOM 62375 H2 WAT 3174 57.926 139.049 154.577 1.00 0.00 H TER 62377 WAT 3174 ATOM 62377 O WAT 3175 85.030 97.827 5.404 1.00 0.00 O ATOM 62378 H1 WAT 3175 85.477 97.931 6.244 1.00 0.00 H ATOM 62379 H2 WAT 3175 84.741 98.711 5.175 1.00 0.00 H TER 62381 WAT 3175 ATOM 62381 O WAT 3176 145.812 103.655 73.058 1.00 0.00 O ATOM 62382 H1 WAT 3176 146.148 103.267 73.866 1.00 0.00 H ATOM 62383 H2 WAT 3176 145.143 103.040 72.757 1.00 0.00 H TER 62385 WAT 3176 ATOM 62385 O WAT 3177 32.644 119.489 146.938 1.00 0.00 O ATOM 62386 H1 WAT 3177 32.299 119.438 147.829 1.00 0.00 H ATOM 62387 H2 WAT 3177 32.815 118.580 146.694 1.00 0.00 H TER 62389 WAT 3177 ATOM 62389 O WAT 3178 71.615 1.446 94.886 1.00 0.00 O ATOM 62390 H1 WAT 3178 71.977 0.587 95.105 1.00 0.00 H ATOM 62391 H2 WAT 3178 72.203 2.070 95.313 1.00 0.00 H TER 62393 WAT 3178 ATOM 62393 O WAT 3179 71.233 55.994 26.752 1.00 0.00 O ATOM 62394 H1 WAT 3179 71.174 55.477 25.949 1.00 0.00 H ATOM 62395 H2 WAT 3179 71.613 56.827 26.473 1.00 0.00 H TER 62397 WAT 3179 ATOM 62397 O WAT 3180 20.498 102.174 134.223 1.00 0.00 O ATOM 62398 H1 WAT 3180 20.473 102.572 133.353 1.00 0.00 H ATOM 62399 H2 WAT 3180 20.438 101.233 134.057 1.00 0.00 H TER 62401 WAT 3180 ATOM 62401 O WAT 3181 43.586 121.017 10.317 1.00 0.00 O ATOM 62402 H1 WAT 3181 43.438 120.102 10.559 1.00 0.00 H ATOM 62403 H2 WAT 3181 43.793 120.988 9.383 1.00 0.00 H TER 62405 WAT 3181 ATOM 62405 O WAT 3182 42.234 55.196 6.963 1.00 0.00 O ATOM 62406 H1 WAT 3182 42.115 54.355 7.405 1.00 0.00 H ATOM 62407 H2 WAT 3182 43.057 55.536 7.313 1.00 0.00 H TER 62409 WAT 3182 ATOM 62409 O WAT 3183 4.474 33.260 18.058 1.00 0.00 O ATOM 62410 H1 WAT 3183 3.549 33.420 17.869 1.00 0.00 H ATOM 62411 H2 WAT 3183 4.641 33.743 18.867 1.00 0.00 H TER 62413 WAT 3183 ATOM 62413 O WAT 3184 145.702 84.742 3.026 1.00 0.00 O ATOM 62414 H1 WAT 3184 145.963 85.516 2.527 1.00 0.00 H ATOM 62415 H2 WAT 3184 144.751 84.815 3.102 1.00 0.00 H TER 62417 WAT 3184 ATOM 62417 O WAT 3185 89.686 5.154 154.078 1.00 0.00 O ATOM 62418 H1 WAT 3185 89.180 4.373 153.856 1.00 0.00 H ATOM 62419 H2 WAT 3185 89.053 5.740 154.492 1.00 0.00 H TER 62421 WAT 3185 ATOM 62421 O WAT 3186 14.481 33.409 158.011 1.00 0.00 O ATOM 62422 H1 WAT 3186 14.933 34.200 157.718 1.00 0.00 H ATOM 62423 H2 WAT 3186 14.670 32.760 157.333 1.00 0.00 H TER 62425 WAT 3186 ATOM 62425 O WAT 3187 145.625 53.299 3.897 1.00 0.00 O ATOM 62426 H1 WAT 3187 145.798 53.518 4.813 1.00 0.00 H ATOM 62427 H2 WAT 3187 145.867 52.376 3.822 1.00 0.00 H TER 62429 WAT 3187 ATOM 62429 O WAT 3188 46.702 11.098 19.260 1.00 0.00 O ATOM 62430 H1 WAT 3188 46.938 10.257 18.868 1.00 0.00 H ATOM 62431 H2 WAT 3188 47.525 11.438 19.612 1.00 0.00 H TER 62433 WAT 3188 ATOM 62433 O WAT 3189 39.586 17.855 157.054 1.00 0.00 O ATOM 62434 H1 WAT 3189 40.209 18.430 157.498 1.00 0.00 H ATOM 62435 H2 WAT 3189 38.859 18.430 156.814 1.00 0.00 H TER 62437 WAT 3189 ATOM 62437 O WAT 3190 23.242 56.737 131.112 1.00 0.00 O ATOM 62438 H1 WAT 3190 23.588 56.609 130.228 1.00 0.00 H ATOM 62439 H2 WAT 3190 23.160 55.852 131.467 1.00 0.00 H TER 62441 WAT 3190 ATOM 62441 O WAT 3191 46.438 10.731 148.576 1.00 0.00 O ATOM 62442 H1 WAT 3191 47.066 10.247 148.039 1.00 0.00 H ATOM 62443 H2 WAT 3191 46.928 10.969 149.362 1.00 0.00 H TER 62445 WAT 3191 ATOM 62445 O WAT 3192 6.022 44.214 118.424 1.00 0.00 O ATOM 62446 H1 WAT 3192 6.715 44.159 119.081 1.00 0.00 H ATOM 62447 H2 WAT 3192 5.386 44.824 118.798 1.00 0.00 H TER 62449 WAT 3192 ATOM 62449 O WAT 3193 116.329 6.738 81.728 1.00 0.00 O ATOM 62450 H1 WAT 3193 116.153 7.339 82.452 1.00 0.00 H ATOM 62451 H2 WAT 3193 115.713 6.018 81.860 1.00 0.00 H TER 62453 WAT 3193 ATOM 62453 O WAT 3194 139.059 111.151 75.982 1.00 0.00 O ATOM 62454 H1 WAT 3194 138.180 110.791 75.864 1.00 0.00 H ATOM 62455 H2 WAT 3194 139.642 110.401 75.867 1.00 0.00 H TER 62457 WAT 3194 ATOM 62457 O WAT 3195 125.116 29.631 83.100 1.00 0.00 O ATOM 62458 H1 WAT 3195 125.248 28.898 82.498 1.00 0.00 H ATOM 62459 H2 WAT 3195 125.899 30.172 82.993 1.00 0.00 H TER 62461 WAT 3195 ATOM 62461 O WAT 3196 24.771 88.002 9.849 1.00 0.00 O ATOM 62462 H1 WAT 3196 25.207 87.321 10.361 1.00 0.00 H ATOM 62463 H2 WAT 3196 24.250 88.487 10.489 1.00 0.00 H TER 62465 WAT 3196 ATOM 62465 O WAT 3197 60.063 86.395 8.936 1.00 0.00 O ATOM 62466 H1 WAT 3197 60.999 86.378 9.137 1.00 0.00 H ATOM 62467 H2 WAT 3197 59.861 87.322 8.813 1.00 0.00 H TER 62469 WAT 3197 ATOM 62469 O WAT 3198 56.270 66.005 13.167 1.00 0.00 O ATOM 62470 H1 WAT 3198 57.208 65.994 13.358 1.00 0.00 H ATOM 62471 H2 WAT 3198 56.193 66.537 12.375 1.00 0.00 H TER 62473 WAT 3198 ATOM 62473 O WAT 3199 105.932 91.376 121.680 1.00 0.00 O ATOM 62474 H1 WAT 3199 106.274 92.262 121.801 1.00 0.00 H ATOM 62475 H2 WAT 3199 105.084 91.503 121.254 1.00 0.00 H TER 62477 WAT 3199 ATOM 62477 O WAT 3200 32.297 81.049 131.956 1.00 0.00 O ATOM 62478 H1 WAT 3200 32.641 81.150 132.843 1.00 0.00 H ATOM 62479 H2 WAT 3200 32.696 81.765 131.462 1.00 0.00 H TER 62481 WAT 3200 ATOM 62481 O WAT 3201 32.445 20.289 91.722 1.00 0.00 O ATOM 62482 H1 WAT 3201 32.411 19.435 92.153 1.00 0.00 H ATOM 62483 H2 WAT 3201 33.075 20.792 92.237 1.00 0.00 H TER 62485 WAT 3201 ATOM 62485 O WAT 3202 118.733 140.704 124.685 1.00 0.00 O ATOM 62486 H1 WAT 3202 118.391 139.839 124.458 1.00 0.00 H ATOM 62487 H2 WAT 3202 119.662 140.660 124.461 1.00 0.00 H TER 62489 WAT 3202 ATOM 62489 O WAT 3203 143.623 20.777 65.641 1.00 0.00 O ATOM 62490 H1 WAT 3203 143.335 20.793 64.729 1.00 0.00 H ATOM 62491 H2 WAT 3203 144.197 20.012 65.698 1.00 0.00 H TER 62493 WAT 3203 ATOM 62493 O WAT 3204 9.275 21.340 123.340 1.00 0.00 O ATOM 62494 H1 WAT 3204 9.954 22.015 123.316 1.00 0.00 H ATOM 62495 H2 WAT 3204 9.016 21.294 124.260 1.00 0.00 H TER 62497 WAT 3204 ATOM 62497 O WAT 3205 43.515 137.793 84.010 1.00 0.00 O ATOM 62498 H1 WAT 3205 42.877 138.032 84.682 1.00 0.00 H ATOM 62499 H2 WAT 3205 43.916 136.987 84.336 1.00 0.00 H TER 62501 WAT 3205 ATOM 62501 O WAT 3206 49.258 69.242 154.423 1.00 0.00 O ATOM 62502 H1 WAT 3206 48.507 69.691 154.036 1.00 0.00 H ATOM 62503 H2 WAT 3206 49.494 68.572 153.781 1.00 0.00 H TER 62505 WAT 3206 ATOM 62505 O WAT 3207 20.380 38.392 158.851 1.00 0.00 O ATOM 62506 H1 WAT 3207 19.498 38.699 159.059 1.00 0.00 H ATOM 62507 H2 WAT 3207 20.286 37.948 158.008 1.00 0.00 H TER 62509 WAT 3207 ATOM 62509 O WAT 3208 21.204 122.791 3.912 1.00 0.00 O ATOM 62510 H1 WAT 3208 21.364 122.060 3.316 1.00 0.00 H ATOM 62511 H2 WAT 3208 21.798 122.636 4.647 1.00 0.00 H TER 62513 WAT 3208 ATOM 62513 O WAT 3209 57.543 119.328 60.033 1.00 0.00 O ATOM 62514 H1 WAT 3209 58.197 119.076 60.685 1.00 0.00 H ATOM 62515 H2 WAT 3209 57.979 119.991 59.499 1.00 0.00 H TER 62517 WAT 3209 ATOM 62517 O WAT 3210 127.483 84.219 85.769 1.00 0.00 O ATOM 62518 H1 WAT 3210 127.141 83.526 85.205 1.00 0.00 H ATOM 62519 H2 WAT 3210 127.633 84.957 85.177 1.00 0.00 H TER 62521 WAT 3210 ATOM 62521 O WAT 3211 48.101 71.735 118.623 1.00 0.00 O ATOM 62522 H1 WAT 3211 48.160 72.012 117.709 1.00 0.00 H ATOM 62523 H2 WAT 3211 48.923 71.273 118.788 1.00 0.00 H TER 62525 WAT 3211 ATOM 62525 O WAT 3212 5.109 130.205 91.168 1.00 0.00 O ATOM 62526 H1 WAT 3212 4.226 130.111 91.524 1.00 0.00 H ATOM 62527 H2 WAT 3212 5.559 129.400 91.426 1.00 0.00 H TER 62529 WAT 3212 ATOM 62529 O WAT 3213 123.138 97.177 65.552 1.00 0.00 O ATOM 62530 H1 WAT 3213 122.400 96.630 65.280 1.00 0.00 H ATOM 62531 H2 WAT 3213 123.565 97.427 64.732 1.00 0.00 H TER 62533 WAT 3213 ATOM 62533 O WAT 3214 115.574 36.549 1.145 1.00 0.00 O ATOM 62534 H1 WAT 3214 115.603 37.341 0.608 1.00 0.00 H ATOM 62535 H2 WAT 3214 114.954 36.757 1.845 1.00 0.00 H TER 62537 WAT 3214 ATOM 62537 O WAT 3215 90.986 24.862 146.542 1.00 0.00 O ATOM 62538 H1 WAT 3215 91.587 25.260 145.913 1.00 0.00 H ATOM 62539 H2 WAT 3215 90.125 25.202 146.301 1.00 0.00 H TER 62541 WAT 3215 ATOM 62541 O WAT 3216 96.898 9.094 103.418 1.00 0.00 O ATOM 62542 H1 WAT 3216 97.213 8.863 104.292 1.00 0.00 H ATOM 62543 H2 WAT 3216 97.689 9.129 102.880 1.00 0.00 H TER 62545 WAT 3216 ATOM 62545 O WAT 3217 114.102 30.834 157.331 1.00 0.00 O ATOM 62546 H1 WAT 3217 113.795 31.010 156.442 1.00 0.00 H ATOM 62547 H2 WAT 3217 113.866 29.920 157.489 1.00 0.00 H TER 62549 WAT 3217 ATOM 62549 O WAT 3218 49.605 18.874 23.378 1.00 0.00 O ATOM 62550 H1 WAT 3218 49.912 18.010 23.104 1.00 0.00 H ATOM 62551 H2 WAT 3218 49.103 18.707 24.176 1.00 0.00 H TER 62553 WAT 3218 ATOM 62553 O WAT 3219 102.919 18.503 -0.054 1.00 0.00 O ATOM 62554 H1 WAT 3219 102.476 17.806 -0.538 1.00 0.00 H ATOM 62555 H2 WAT 3219 102.548 18.456 0.827 1.00 0.00 H TER 62557 WAT 3219 ATOM 62557 O WAT 3220 19.983 144.411 125.188 1.00 0.00 O ATOM 62558 H1 WAT 3220 19.484 143.956 124.510 1.00 0.00 H ATOM 62559 H2 WAT 3220 19.808 143.914 125.988 1.00 0.00 H TER 62561 WAT 3220 ATOM 62561 O WAT 3221 20.091 80.512 108.432 1.00 0.00 O ATOM 62562 H1 WAT 3221 20.605 79.806 108.824 1.00 0.00 H ATOM 62563 H2 WAT 3221 20.545 80.713 107.614 1.00 0.00 H TER 62565 WAT 3221 ATOM 62565 O WAT 3222 98.998 92.277 6.079 1.00 0.00 O ATOM 62566 H1 WAT 3222 98.462 91.575 6.447 1.00 0.00 H ATOM 62567 H2 WAT 3222 99.847 91.868 5.913 1.00 0.00 H TER 62569 WAT 3222 ATOM 62569 O WAT 3223 54.889 8.426 145.527 1.00 0.00 O ATOM 62570 H1 WAT 3223 55.800 8.706 145.436 1.00 0.00 H ATOM 62571 H2 WAT 3223 54.774 7.761 144.848 1.00 0.00 H TER 62573 WAT 3223 ATOM 62573 O WAT 3224 2.690 100.979 73.478 1.00 0.00 O ATOM 62574 H1 WAT 3224 2.892 101.535 74.231 1.00 0.00 H ATOM 62575 H2 WAT 3224 2.445 101.593 72.786 1.00 0.00 H TER 62577 WAT 3224 ATOM 62577 O WAT 3225 7.896 3.382 69.610 1.00 0.00 O ATOM 62578 H1 WAT 3225 8.841 3.489 69.499 1.00 0.00 H ATOM 62579 H2 WAT 3225 7.720 3.714 70.491 1.00 0.00 H TER 62581 WAT 3225 ATOM 62581 O WAT 3226 55.454 133.196 150.619 1.00 0.00 O ATOM 62582 H1 WAT 3226 55.794 133.488 149.774 1.00 0.00 H ATOM 62583 H2 WAT 3226 56.163 132.674 150.995 1.00 0.00 H TER 62585 WAT 3226 ATOM 62585 O WAT 3227 43.196 83.877 66.444 1.00 0.00 O ATOM 62586 H1 WAT 3227 42.938 83.256 65.764 1.00 0.00 H ATOM 62587 H2 WAT 3227 44.144 83.769 66.520 1.00 0.00 H TER 62589 WAT 3227 ATOM 62589 O WAT 3228 90.178 90.305 144.094 1.00 0.00 O ATOM 62590 H1 WAT 3228 90.171 89.356 144.218 1.00 0.00 H ATOM 62591 H2 WAT 3228 89.768 90.654 144.885 1.00 0.00 H TER 62593 WAT 3228 ATOM 62593 O WAT 3229 37.181 26.352 118.575 1.00 0.00 O ATOM 62594 H1 WAT 3229 36.617 26.811 119.198 1.00 0.00 H ATOM 62595 H2 WAT 3229 36.751 25.507 118.440 1.00 0.00 H TER 62597 WAT 3229 ATOM 62597 O WAT 3230 115.349 49.965 89.560 1.00 0.00 O ATOM 62598 H1 WAT 3230 115.856 50.626 90.031 1.00 0.00 H ATOM 62599 H2 WAT 3230 114.576 50.436 89.247 1.00 0.00 H TER 62601 WAT 3230 ATOM 62601 O WAT 3231 144.249 29.403 106.104 1.00 0.00 O ATOM 62602 H1 WAT 3231 144.164 28.922 105.280 1.00 0.00 H ATOM 62603 H2 WAT 3231 143.347 29.583 106.370 1.00 0.00 H TER 62605 WAT 3231 ATOM 62605 O WAT 3232 117.772 33.402 74.227 1.00 0.00 O ATOM 62606 H1 WAT 3232 117.722 32.561 74.681 1.00 0.00 H ATOM 62607 H2 WAT 3232 117.513 33.205 73.327 1.00 0.00 H TER 62609 WAT 3232 ATOM 62609 O WAT 3233 70.349 9.006 145.621 1.00 0.00 O ATOM 62610 H1 WAT 3233 70.308 9.681 146.299 1.00 0.00 H ATOM 62611 H2 WAT 3233 69.587 9.175 145.068 1.00 0.00 H TER 62613 WAT 3233 ATOM 62613 O WAT 3234 62.340 16.020 107.322 1.00 0.00 O ATOM 62614 H1 WAT 3234 62.936 16.274 106.618 1.00 0.00 H ATOM 62615 H2 WAT 3234 61.656 15.512 106.886 1.00 0.00 H TER 62617 WAT 3234 ATOM 62617 O WAT 3235 3.029 76.019 108.109 1.00 0.00 O ATOM 62618 H1 WAT 3235 2.189 75.952 108.563 1.00 0.00 H ATOM 62619 H2 WAT 3235 3.448 75.170 108.255 1.00 0.00 H TER 62621 WAT 3235 ATOM 62621 O WAT 3236 97.780 115.988 123.372 1.00 0.00 O ATOM 62622 H1 WAT 3236 97.085 115.779 122.749 1.00 0.00 H ATOM 62623 H2 WAT 3236 98.396 116.524 122.873 1.00 0.00 H TER 62625 WAT 3236 ATOM 62625 O WAT 3237 119.616 11.606 154.990 1.00 0.00 O ATOM 62626 H1 WAT 3237 119.423 10.709 154.720 1.00 0.00 H ATOM 62627 H2 WAT 3237 120.560 11.697 154.862 1.00 0.00 H TER 62629 WAT 3237 ATOM 62629 O WAT 3238 73.135 25.763 141.949 1.00 0.00 O ATOM 62630 H1 WAT 3238 72.870 24.843 141.957 1.00 0.00 H ATOM 62631 H2 WAT 3238 72.316 26.249 142.050 1.00 0.00 H TER 62633 WAT 3238 ATOM 62633 O WAT 3239 136.031 103.158 72.041 1.00 0.00 O ATOM 62634 H1 WAT 3239 135.745 104.071 72.061 1.00 0.00 H ATOM 62635 H2 WAT 3239 135.310 102.690 71.620 1.00 0.00 H TER 62637 WAT 3239 ATOM 62637 O WAT 3240 77.138 9.243 71.050 1.00 0.00 O ATOM 62638 H1 WAT 3240 77.427 9.749 70.291 1.00 0.00 H ATOM 62639 H2 WAT 3240 76.355 8.783 70.749 1.00 0.00 H TER 62641 WAT 3240 ATOM 62641 O WAT 3241 109.588 93.990 140.004 1.00 0.00 O ATOM 62642 H1 WAT 3241 109.375 94.862 140.336 1.00 0.00 H ATOM 62643 H2 WAT 3241 110.544 93.975 139.968 1.00 0.00 H TER 62645 WAT 3241 ATOM 62645 O WAT 3242 104.514 10.794 129.304 1.00 0.00 O ATOM 62646 H1 WAT 3242 105.188 10.741 128.626 1.00 0.00 H ATOM 62647 H2 WAT 3242 104.541 9.940 129.735 1.00 0.00 H TER 62649 WAT 3242 ATOM 62649 O WAT 3243 96.923 99.289 61.318 1.00 0.00 O ATOM 62650 H1 WAT 3243 96.357 99.988 60.991 1.00 0.00 H ATOM 62651 H2 WAT 3243 96.332 98.706 61.795 1.00 0.00 H TER 62653 WAT 3243 ATOM 62653 O WAT 3244 36.073 85.490 112.234 1.00 0.00 O ATOM 62654 H1 WAT 3244 35.237 85.042 112.368 1.00 0.00 H ATOM 62655 H2 WAT 3244 36.464 85.532 113.107 1.00 0.00 H TER 62657 WAT 3244 ATOM 62657 O WAT 3245 105.311 130.964 78.357 1.00 0.00 O ATOM 62658 H1 WAT 3245 104.574 130.709 78.912 1.00 0.00 H ATOM 62659 H2 WAT 3245 105.876 131.481 78.931 1.00 0.00 H TER 62661 WAT 3245 ATOM 62661 O WAT 3246 105.291 112.950 155.571 1.00 0.00 O ATOM 62662 H1 WAT 3246 104.597 112.297 155.668 1.00 0.00 H ATOM 62663 H2 WAT 3246 104.849 113.790 155.699 1.00 0.00 H TER 62665 WAT 3246 ATOM 62665 O WAT 3247 145.696 69.371 131.194 1.00 0.00 O ATOM 62666 H1 WAT 3247 146.070 68.947 130.421 1.00 0.00 H ATOM 62667 H2 WAT 3247 145.436 68.647 131.763 1.00 0.00 H TER 62669 WAT 3247 ATOM 62669 O WAT 3248 97.044 103.413 68.780 1.00 0.00 O ATOM 62670 H1 WAT 3248 97.907 103.499 69.186 1.00 0.00 H ATOM 62671 H2 WAT 3248 97.053 104.046 68.062 1.00 0.00 H TER 62673 WAT 3248 ATOM 62673 O WAT 3249 42.106 104.613 95.280 1.00 0.00 O ATOM 62674 H1 WAT 3249 42.137 104.524 96.232 1.00 0.00 H ATOM 62675 H2 WAT 3249 42.646 105.381 95.093 1.00 0.00 H TER 62677 WAT 3249 ATOM 62677 O WAT 3250 14.555 81.622 123.979 1.00 0.00 O ATOM 62678 H1 WAT 3250 15.367 81.582 124.484 1.00 0.00 H ATOM 62679 H2 WAT 3250 14.635 80.913 123.341 1.00 0.00 H TER 62681 WAT 3250 ATOM 62681 O WAT 3251 125.687 106.894 92.061 1.00 0.00 O ATOM 62682 H1 WAT 3251 126.296 107.506 92.474 1.00 0.00 H ATOM 62683 H2 WAT 3251 124.834 107.323 92.131 1.00 0.00 H TER 62685 WAT 3251 ATOM 62685 O WAT 3252 126.558 55.440 67.076 1.00 0.00 O ATOM 62686 H1 WAT 3252 127.173 56.099 67.396 1.00 0.00 H ATOM 62687 H2 WAT 3252 126.792 54.643 67.551 1.00 0.00 H TER 62689 WAT 3252 ATOM 62689 O WAT 3253 117.270 108.881 79.414 1.00 0.00 O ATOM 62690 H1 WAT 3253 117.324 108.409 80.245 1.00 0.00 H ATOM 62691 H2 WAT 3253 118.162 108.859 79.068 1.00 0.00 H TER 62693 WAT 3253 ATOM 62693 O WAT 3254 55.533 50.903 101.401 1.00 0.00 O ATOM 62694 H1 WAT 3254 55.378 50.094 101.889 1.00 0.00 H ATOM 62695 H2 WAT 3254 56.449 50.848 101.130 1.00 0.00 H TER 62697 WAT 3254 ATOM 62697 O WAT 3255 46.217 47.955 141.385 1.00 0.00 O ATOM 62698 H1 WAT 3255 45.705 48.740 141.579 1.00 0.00 H ATOM 62699 H2 WAT 3255 46.740 48.193 140.619 1.00 0.00 H TER 62701 WAT 3255 ATOM 62701 O WAT 3256 53.023 76.821 141.565 1.00 0.00 O ATOM 62702 H1 WAT 3256 53.947 77.001 141.737 1.00 0.00 H ATOM 62703 H2 WAT 3256 53.014 75.929 141.218 1.00 0.00 H TER 62705 WAT 3256 ATOM 62705 O WAT 3257 26.948 25.416 22.727 1.00 0.00 O ATOM 62706 H1 WAT 3257 26.421 25.654 23.490 1.00 0.00 H ATOM 62707 H2 WAT 3257 26.668 24.527 22.509 1.00 0.00 H TER 62709 WAT 3257 ATOM 62709 O WAT 3258 120.539 103.474 75.999 1.00 0.00 O ATOM 62710 H1 WAT 3258 120.307 102.587 76.272 1.00 0.00 H ATOM 62711 H2 WAT 3258 120.292 104.025 76.741 1.00 0.00 H TER 62713 WAT 3258 ATOM 62713 O WAT 3259 140.801 135.031 75.247 1.00 0.00 O ATOM 62714 H1 WAT 3259 140.269 134.476 74.677 1.00 0.00 H ATOM 62715 H2 WAT 3259 140.371 134.977 76.101 1.00 0.00 H TER 62717 WAT 3259 ATOM 62717 O WAT 3260 136.972 129.308 145.984 1.00 0.00 O ATOM 62718 H1 WAT 3260 137.236 130.116 145.544 1.00 0.00 H ATOM 62719 H2 WAT 3260 137.672 129.138 146.614 1.00 0.00 H TER 62721 WAT 3260 ATOM 62721 O WAT 3261 66.832 95.075 115.145 1.00 0.00 O ATOM 62722 H1 WAT 3261 66.902 95.926 114.712 1.00 0.00 H ATOM 62723 H2 WAT 3261 66.058 95.153 115.703 1.00 0.00 H TER 62725 WAT 3261 ATOM 62725 O WAT 3262 118.554 99.538 146.186 1.00 0.00 O ATOM 62726 H1 WAT 3262 119.147 98.909 146.597 1.00 0.00 H ATOM 62727 H2 WAT 3262 117.800 99.576 146.775 1.00 0.00 H TER 62729 WAT 3262 ATOM 62729 O WAT 3263 138.170 142.670 100.046 1.00 0.00 O ATOM 62730 H1 WAT 3263 137.873 142.902 99.166 1.00 0.00 H ATOM 62731 H2 WAT 3263 137.473 142.980 100.624 1.00 0.00 H TER 62733 WAT 3263 ATOM 62733 O WAT 3264 49.082 35.258 77.756 1.00 0.00 O ATOM 62734 H1 WAT 3264 49.304 34.356 77.986 1.00 0.00 H ATOM 62735 H2 WAT 3264 49.278 35.762 78.546 1.00 0.00 H TER 62737 WAT 3264 ATOM 62737 O WAT 3265 84.305 32.502 141.059 1.00 0.00 O ATOM 62738 H1 WAT 3265 84.627 32.313 141.940 1.00 0.00 H ATOM 62739 H2 WAT 3265 84.499 33.429 140.926 1.00 0.00 H TER 62741 WAT 3265 ATOM 62741 O WAT 3266 86.003 43.549 90.606 1.00 0.00 O ATOM 62742 H1 WAT 3266 85.209 44.084 90.615 1.00 0.00 H ATOM 62743 H2 WAT 3266 85.854 42.910 89.910 1.00 0.00 H TER 62745 WAT 3266 ATOM 62745 O WAT 3267 80.713 24.396 68.444 1.00 0.00 O ATOM 62746 H1 WAT 3267 80.584 24.197 69.371 1.00 0.00 H ATOM 62747 H2 WAT 3267 81.508 24.930 68.422 1.00 0.00 H TER 62749 WAT 3267 ATOM 62749 O WAT 3268 137.253 60.829 134.367 1.00 0.00 O ATOM 62750 H1 WAT 3268 137.951 61.365 133.990 1.00 0.00 H ATOM 62751 H2 WAT 3268 136.450 61.315 134.176 1.00 0.00 H TER 62753 WAT 3268 ATOM 62753 O WAT 3269 26.269 69.204 138.260 1.00 0.00 O ATOM 62754 H1 WAT 3269 25.623 69.091 137.562 1.00 0.00 H ATOM 62755 H2 WAT 3269 25.809 68.938 139.057 1.00 0.00 H TER 62757 WAT 3269 ATOM 62757 O WAT 3270 105.375 47.008 5.198 1.00 0.00 O ATOM 62758 H1 WAT 3270 106.241 47.377 5.373 1.00 0.00 H ATOM 62759 H2 WAT 3270 105.033 47.533 4.474 1.00 0.00 H TER 62761 WAT 3270 ATOM 62761 O WAT 3271 31.983 69.697 5.664 1.00 0.00 O ATOM 62762 H1 WAT 3271 31.581 68.829 5.705 1.00 0.00 H ATOM 62763 H2 WAT 3271 31.809 69.999 4.773 1.00 0.00 H TER 62765 WAT 3271 ATOM 62765 O WAT 3272 55.784 120.638 15.891 1.00 0.00 O ATOM 62766 H1 WAT 3272 55.081 120.085 15.549 1.00 0.00 H ATOM 62767 H2 WAT 3272 55.343 121.438 16.175 1.00 0.00 H TER 62769 WAT 3272 ATOM 62769 O WAT 3273 125.289 60.962 6.836 1.00 0.00 O ATOM 62770 H1 WAT 3273 126.223 60.874 7.027 1.00 0.00 H ATOM 62771 H2 WAT 3273 125.029 60.101 6.510 1.00 0.00 H TER 62773 WAT 3273 ATOM 62773 O WAT 3274 28.469 18.539 143.259 1.00 0.00 O ATOM 62774 H1 WAT 3274 27.688 18.784 143.755 1.00 0.00 H ATOM 62775 H2 WAT 3274 28.699 17.670 143.587 1.00 0.00 H TER 62777 WAT 3274 ATOM 62777 O WAT 3275 124.083 141.502 112.176 1.00 0.00 O ATOM 62778 H1 WAT 3275 124.548 142.284 112.475 1.00 0.00 H ATOM 62779 H2 WAT 3275 124.577 141.208 111.411 1.00 0.00 H TER 62781 WAT 3275 ATOM 62781 O WAT 3276 56.042 137.288 138.881 1.00 0.00 O ATOM 62782 H1 WAT 3276 56.835 136.955 138.461 1.00 0.00 H ATOM 62783 H2 WAT 3276 55.406 136.578 138.789 1.00 0.00 H TER 62785 WAT 3276 ATOM 62785 O WAT 3277 3.341 87.463 58.308 1.00 0.00 O ATOM 62786 H1 WAT 3277 2.477 87.824 58.510 1.00 0.00 H ATOM 62787 H2 WAT 3277 3.398 87.498 57.353 1.00 0.00 H TER 62789 WAT 3277 ATOM 62789 O WAT 3278 57.434 24.729 152.906 1.00 0.00 O ATOM 62790 H1 WAT 3278 56.835 25.256 153.435 1.00 0.00 H ATOM 62791 H2 WAT 3278 58.175 24.553 153.487 1.00 0.00 H TER 62793 WAT 3278 ATOM 62793 O WAT 3279 112.131 130.077 17.488 1.00 0.00 O ATOM 62794 H1 WAT 3279 112.719 130.461 16.838 1.00 0.00 H ATOM 62795 H2 WAT 3279 111.255 130.210 17.126 1.00 0.00 H TER 62797 WAT 3279 ATOM 62797 O WAT 3280 19.429 82.702 105.474 1.00 0.00 O ATOM 62798 H1 WAT 3280 18.984 81.858 105.398 1.00 0.00 H ATOM 62799 H2 WAT 3280 20.360 82.488 105.418 1.00 0.00 H TER 62801 WAT 3280 ATOM 62801 O WAT 3281 128.920 139.270 70.987 1.00 0.00 O ATOM 62802 H1 WAT 3281 128.383 138.559 70.636 1.00 0.00 H ATOM 62803 H2 WAT 3281 128.617 139.376 71.889 1.00 0.00 H TER 62805 WAT 3281 ATOM 62805 O WAT 3282 21.321 122.828 103.916 1.00 0.00 O ATOM 62806 H1 WAT 3282 21.795 123.624 103.675 1.00 0.00 H ATOM 62807 H2 WAT 3282 20.970 122.498 103.089 1.00 0.00 H TER 62809 WAT 3282 ATOM 62809 O WAT 3283 52.926 120.761 63.517 1.00 0.00 O ATOM 62810 H1 WAT 3283 53.559 120.539 62.834 1.00 0.00 H ATOM 62811 H2 WAT 3283 52.776 121.700 63.409 1.00 0.00 H TER 62813 WAT 3283 ATOM 62813 O WAT 3284 134.293 80.056 9.400 1.00 0.00 O ATOM 62814 H1 WAT 3284 134.576 80.417 10.240 1.00 0.00 H ATOM 62815 H2 WAT 3284 134.060 79.148 9.596 1.00 0.00 H TER 62817 WAT 3284 ATOM 62817 O WAT 3285 20.952 28.172 88.329 1.00 0.00 O ATOM 62818 H1 WAT 3285 21.835 28.539 88.375 1.00 0.00 H ATOM 62819 H2 WAT 3285 21.088 27.225 88.295 1.00 0.00 H TER 62821 WAT 3285 ATOM 62821 O WAT 3286 122.504 65.387 97.953 1.00 0.00 O ATOM 62822 H1 WAT 3286 122.990 64.563 97.996 1.00 0.00 H ATOM 62823 H2 WAT 3286 122.150 65.502 98.835 1.00 0.00 H TER 62825 WAT 3286 ATOM 62825 O WAT 3287 35.386 131.138 72.966 1.00 0.00 O ATOM 62826 H1 WAT 3287 36.191 130.633 72.850 1.00 0.00 H ATOM 62827 H2 WAT 3287 35.234 131.546 72.113 1.00 0.00 H TER 62829 WAT 3287 ATOM 62829 O WAT 3288 13.313 58.588 94.530 1.00 0.00 O ATOM 62830 H1 WAT 3288 12.754 59.328 94.769 1.00 0.00 H ATOM 62831 H2 WAT 3288 14.201 58.886 94.728 1.00 0.00 H TER 62833 WAT 3288 ATOM 62833 O WAT 3289 54.268 4.522 155.148 1.00 0.00 O ATOM 62834 H1 WAT 3289 53.809 5.244 154.717 1.00 0.00 H ATOM 62835 H2 WAT 3289 53.574 4.014 155.568 1.00 0.00 H TER 62837 WAT 3289 ATOM 62837 O WAT 3290 50.682 21.054 4.713 1.00 0.00 O ATOM 62838 H1 WAT 3290 51.126 20.267 5.028 1.00 0.00 H ATOM 62839 H2 WAT 3290 51.172 21.778 5.103 1.00 0.00 H TER 62841 WAT 3290 ATOM 62841 O WAT 3291 82.413 36.677 138.762 1.00 0.00 O ATOM 62842 H1 WAT 3291 82.474 36.977 139.669 1.00 0.00 H ATOM 62843 H2 WAT 3291 81.829 35.920 138.799 1.00 0.00 H TER 62845 WAT 3291 ATOM 62845 O WAT 3292 82.368 29.799 158.539 1.00 0.00 O ATOM 62846 H1 WAT 3292 81.553 30.002 158.081 1.00 0.00 H ATOM 62847 H2 WAT 3292 82.868 29.270 157.917 1.00 0.00 H TER 62849 WAT 3292 ATOM 62849 O WAT 3293 113.267 105.361 121.344 1.00 0.00 O ATOM 62850 H1 WAT 3293 113.116 106.176 121.823 1.00 0.00 H ATOM 62851 H2 WAT 3293 112.668 104.732 121.747 1.00 0.00 H TER 62853 WAT 3293 ATOM 62853 O WAT 3294 49.139 52.745 77.224 1.00 0.00 O ATOM 62854 H1 WAT 3294 49.195 51.820 77.464 1.00 0.00 H ATOM 62855 H2 WAT 3294 48.369 52.800 76.659 1.00 0.00 H TER 62857 WAT 3294 ATOM 62857 O WAT 3295 68.368 131.666 157.693 1.00 0.00 O ATOM 62858 H1 WAT 3295 68.090 132.491 157.293 1.00 0.00 H ATOM 62859 H2 WAT 3295 67.716 131.028 157.404 1.00 0.00 H TER 62861 WAT 3295 ATOM 62861 O WAT 3296 138.962 10.403 150.218 1.00 0.00 O ATOM 62862 H1 WAT 3296 138.719 10.197 151.121 1.00 0.00 H ATOM 62863 H2 WAT 3296 139.917 10.469 150.236 1.00 0.00 H TER 62865 WAT 3296 ATOM 62865 O WAT 3297 60.817 75.948 1.698 1.00 0.00 O ATOM 62866 H1 WAT 3297 61.256 75.104 1.803 1.00 0.00 H ATOM 62867 H2 WAT 3297 60.553 76.193 2.585 1.00 0.00 H TER 62869 WAT 3297 ATOM 62869 O WAT 3298 20.042 50.952 8.733 1.00 0.00 O ATOM 62870 H1 WAT 3298 20.101 51.572 8.006 1.00 0.00 H ATOM 62871 H2 WAT 3298 19.393 50.309 8.449 1.00 0.00 H TER 62873 WAT 3298 ATOM 62873 O WAT 3299 15.776 28.126 140.042 1.00 0.00 O ATOM 62874 H1 WAT 3299 16.352 27.609 139.479 1.00 0.00 H ATOM 62875 H2 WAT 3299 14.911 27.733 139.925 1.00 0.00 H TER 62877 WAT 3299 ATOM 62877 O WAT 3300 119.594 16.289 156.458 1.00 0.00 O ATOM 62878 H1 WAT 3300 119.727 16.369 155.513 1.00 0.00 H ATOM 62879 H2 WAT 3300 120.478 16.286 156.825 1.00 0.00 H TER 62881 WAT 3300 ATOM 62881 O WAT 3301 68.449 65.110 88.667 1.00 0.00 O ATOM 62882 H1 WAT 3301 67.534 65.079 88.946 1.00 0.00 H ATOM 62883 H2 WAT 3301 68.444 65.669 87.890 1.00 0.00 H TER 62885 WAT 3301 ATOM 62885 O WAT 3302 97.168 58.286 129.129 1.00 0.00 O ATOM 62886 H1 WAT 3302 97.082 57.413 128.747 1.00 0.00 H ATOM 62887 H2 WAT 3302 98.112 58.430 129.190 1.00 0.00 H TER 62889 WAT 3302 ATOM 62889 O WAT 3303 143.393 105.427 58.745 1.00 0.00 O ATOM 62890 H1 WAT 3303 143.469 104.922 57.936 1.00 0.00 H ATOM 62891 H2 WAT 3303 144.251 105.839 58.852 1.00 0.00 H TER 62893 WAT 3303 ATOM 62893 O WAT 3304 21.396 49.115 16.861 1.00 0.00 O ATOM 62894 H1 WAT 3304 21.386 49.812 17.516 1.00 0.00 H ATOM 62895 H2 WAT 3304 21.196 48.320 17.355 1.00 0.00 H TER 62897 WAT 3304 ATOM 62897 O WAT 3305 70.961 118.514 117.639 1.00 0.00 O ATOM 62898 H1 WAT 3305 70.727 117.815 118.250 1.00 0.00 H ATOM 62899 H2 WAT 3305 70.662 118.196 116.787 1.00 0.00 H TER 62901 WAT 3305 ATOM 62901 O WAT 3306 127.615 57.649 65.331 1.00 0.00 O ATOM 62902 H1 WAT 3306 127.734 58.565 65.582 1.00 0.00 H ATOM 62903 H2 WAT 3306 128.504 57.321 65.194 1.00 0.00 H TER 62905 WAT 3306 ATOM 62905 O WAT 3307 49.763 76.236 153.246 1.00 0.00 O ATOM 62906 H1 WAT 3307 49.110 76.428 153.919 1.00 0.00 H ATOM 62907 H2 WAT 3307 49.693 75.291 153.107 1.00 0.00 H TER 62909 WAT 3307 ATOM 62909 O WAT 3308 37.268 82.993 111.633 1.00 0.00 O ATOM 62910 H1 WAT 3308 37.004 83.908 111.736 1.00 0.00 H ATOM 62911 H2 WAT 3308 37.035 82.581 112.464 1.00 0.00 H TER 62913 WAT 3308 ATOM 62913 O WAT 3309 50.148 60.284 112.182 1.00 0.00 O ATOM 62914 H1 WAT 3309 50.967 60.622 112.546 1.00 0.00 H ATOM 62915 H2 WAT 3309 49.852 59.636 112.821 1.00 0.00 H TER 62917 WAT 3309 ATOM 62917 O WAT 3310 103.008 138.392 124.553 1.00 0.00 O ATOM 62918 H1 WAT 3310 103.712 138.541 125.184 1.00 0.00 H ATOM 62919 H2 WAT 3310 103.459 138.203 123.730 1.00 0.00 H TER 62921 WAT 3310 ATOM 62921 O WAT 3311 133.630 94.287 114.184 1.00 0.00 O ATOM 62922 H1 WAT 3311 132.821 93.780 114.109 1.00 0.00 H ATOM 62923 H2 WAT 3311 133.352 95.131 114.539 1.00 0.00 H TER 62925 WAT 3311 ATOM 62925 O WAT 3312 125.373 135.994 122.628 1.00 0.00 O ATOM 62926 H1 WAT 3312 126.179 135.477 122.613 1.00 0.00 H ATOM 62927 H2 WAT 3312 124.878 135.644 123.368 1.00 0.00 H TER 62929 WAT 3312 ATOM 62929 O WAT 3313 140.123 33.631 132.588 1.00 0.00 O ATOM 62930 H1 WAT 3313 141.063 33.567 132.760 1.00 0.00 H ATOM 62931 H2 WAT 3313 140.065 34.006 131.709 1.00 0.00 H TER 62933 WAT 3313 ATOM 62933 O WAT 3314 102.497 19.723 88.177 1.00 0.00 O ATOM 62934 H1 WAT 3314 102.221 20.506 88.655 1.00 0.00 H ATOM 62935 H2 WAT 3314 102.996 19.216 88.816 1.00 0.00 H TER 62937 WAT 3314 ATOM 62937 O WAT 3315 114.098 126.552 112.253 1.00 0.00 O ATOM 62938 H1 WAT 3315 113.865 126.708 113.168 1.00 0.00 H ATOM 62939 H2 WAT 3315 114.948 126.113 112.294 1.00 0.00 H TER 62941 WAT 3315 ATOM 62941 O WAT 3316 78.947 5.681 104.203 1.00 0.00 O ATOM 62942 H1 WAT 3316 79.478 5.216 103.556 1.00 0.00 H ATOM 62943 H2 WAT 3316 78.243 5.069 104.420 1.00 0.00 H TER 62945 WAT 3316 ATOM 62945 O WAT 3317 84.443 143.857 96.256 1.00 0.00 O ATOM 62946 H1 WAT 3317 85.242 144.167 96.684 1.00 0.00 H ATOM 62947 H2 WAT 3317 83.831 143.701 96.975 1.00 0.00 H TER 62949 WAT 3317 ATOM 62949 O WAT 3318 88.463 64.203 74.117 1.00 0.00 O ATOM 62950 H1 WAT 3318 87.955 63.427 74.350 1.00 0.00 H ATOM 62951 H2 WAT 3318 89.368 63.894 74.076 1.00 0.00 H TER 62953 WAT 3318 ATOM 62953 O WAT 3319 61.581 61.298 103.109 1.00 0.00 O ATOM 62954 H1 WAT 3319 61.169 62.151 102.969 1.00 0.00 H ATOM 62955 H2 WAT 3319 62.294 61.270 102.470 1.00 0.00 H TER 62957 WAT 3319 ATOM 62957 O WAT 3320 143.862 105.221 107.016 1.00 0.00 O ATOM 62958 H1 WAT 3320 144.629 105.786 107.109 1.00 0.00 H ATOM 62959 H2 WAT 3320 144.144 104.375 107.364 1.00 0.00 H TER 62961 WAT 3320 ATOM 62961 O WAT 3321 84.832 55.932 109.009 1.00 0.00 O ATOM 62962 H1 WAT 3321 85.584 56.050 108.428 1.00 0.00 H ATOM 62963 H2 WAT 3321 85.208 55.599 109.823 1.00 0.00 H TER 62965 WAT 3321 ATOM 62965 O WAT 3322 63.776 10.436 7.879 1.00 0.00 O ATOM 62966 H1 WAT 3322 62.879 10.127 7.748 1.00 0.00 H ATOM 62967 H2 WAT 3322 63.742 10.930 8.698 1.00 0.00 H TER 62969 WAT 3322 ATOM 62969 O WAT 3323 144.185 143.616 19.075 1.00 0.00 O ATOM 62970 H1 WAT 3323 143.637 142.832 19.096 1.00 0.00 H ATOM 62971 H2 WAT 3323 144.024 144.044 19.916 1.00 0.00 H TER 62973 WAT 3323 ATOM 62973 O WAT 3324 67.300 138.672 90.460 1.00 0.00 O ATOM 62974 H1 WAT 3324 67.653 138.677 89.570 1.00 0.00 H ATOM 62975 H2 WAT 3324 66.351 138.629 90.341 1.00 0.00 H TER 62977 WAT 3324 ATOM 62977 O WAT 3325 92.763 90.268 21.248 1.00 0.00 O ATOM 62978 H1 WAT 3325 92.292 90.518 22.043 1.00 0.00 H ATOM 62979 H2 WAT 3325 93.313 91.025 21.047 1.00 0.00 H TER 62981 WAT 3325 ATOM 62981 O WAT 3326 129.440 9.397 124.640 1.00 0.00 O ATOM 62982 H1 WAT 3326 130.112 10.079 124.639 1.00 0.00 H ATOM 62983 H2 WAT 3326 128.710 9.780 124.154 1.00 0.00 H TER 62985 WAT 3326 ATOM 62985 O WAT 3327 39.609 87.757 68.178 1.00 0.00 O ATOM 62986 H1 WAT 3327 38.663 87.899 68.173 1.00 0.00 H ATOM 62987 H2 WAT 3327 39.722 86.905 68.599 1.00 0.00 H TER 62989 WAT 3327 ATOM 62989 O WAT 3328 90.323 76.005 86.014 1.00 0.00 O ATOM 62990 H1 WAT 3328 90.175 76.759 85.444 1.00 0.00 H ATOM 62991 H2 WAT 3328 90.953 75.464 85.538 1.00 0.00 H TER 62993 WAT 3328 ATOM 62993 O WAT 3329 52.014 96.508 17.171 1.00 0.00 O ATOM 62994 H1 WAT 3329 51.617 97.376 17.248 1.00 0.00 H ATOM 62995 H2 WAT 3329 52.269 96.442 16.251 1.00 0.00 H TER 62997 WAT 3329 ATOM 62997 O WAT 3330 120.182 17.978 8.813 1.00 0.00 O ATOM 62998 H1 WAT 3330 119.283 17.777 9.073 1.00 0.00 H ATOM 62999 H2 WAT 3330 120.615 17.125 8.771 1.00 0.00 H TER 63001 WAT 3330 ATOM 63001 O WAT 3331 140.541 54.349 72.846 1.00 0.00 O ATOM 63002 H1 WAT 3331 140.821 53.436 72.781 1.00 0.00 H ATOM 63003 H2 WAT 3331 141.152 54.743 73.468 1.00 0.00 H TER 63005 WAT 3331 ATOM 63005 O WAT 3332 10.588 134.971 123.477 1.00 0.00 O ATOM 63006 H1 WAT 3332 9.915 135.602 123.733 1.00 0.00 H ATOM 63007 H2 WAT 3332 11.278 135.080 124.132 1.00 0.00 H TER 63009 WAT 3332 ATOM 63009 O WAT 3333 128.839 130.274 80.732 1.00 0.00 O ATOM 63010 H1 WAT 3333 129.106 130.823 79.995 1.00 0.00 H ATOM 63011 H2 WAT 3333 128.238 129.635 80.348 1.00 0.00 H TER 63013 WAT 3333 ATOM 63013 O WAT 3334 70.721 118.152 129.462 1.00 0.00 O ATOM 63014 H1 WAT 3334 70.339 117.274 129.466 1.00 0.00 H ATOM 63015 H2 WAT 3334 70.345 118.580 130.231 1.00 0.00 H TER 63017 WAT 3334 ATOM 63017 O WAT 3335 28.926 79.392 89.106 1.00 0.00 O ATOM 63018 H1 WAT 3335 28.234 79.180 88.478 1.00 0.00 H ATOM 63019 H2 WAT 3335 29.275 80.230 88.803 1.00 0.00 H TER 63021 WAT 3335 ATOM 63021 O WAT 3336 111.591 29.932 106.801 1.00 0.00 O ATOM 63022 H1 WAT 3336 110.827 29.495 107.177 1.00 0.00 H ATOM 63023 H2 WAT 3336 111.883 30.535 107.484 1.00 0.00 H TER 63025 WAT 3336 ATOM 63025 O WAT 3337 102.997 67.137 87.138 1.00 0.00 O ATOM 63026 H1 WAT 3337 102.625 66.528 86.500 1.00 0.00 H ATOM 63027 H2 WAT 3337 103.089 67.960 86.659 1.00 0.00 H TER 63029 WAT 3337 ATOM 63029 O WAT 3338 139.588 109.864 152.257 1.00 0.00 O ATOM 63030 H1 WAT 3338 139.870 110.699 152.630 1.00 0.00 H ATOM 63031 H2 WAT 3338 138.656 109.810 152.466 1.00 0.00 H TER 63033 WAT 3338 ATOM 63033 O WAT 3339 132.172 43.787 105.256 1.00 0.00 O ATOM 63034 H1 WAT 3339 133.127 43.809 105.204 1.00 0.00 H ATOM 63035 H2 WAT 3339 131.966 42.885 105.501 1.00 0.00 H TER 63037 WAT 3339 ATOM 63037 O WAT 3340 116.706 113.411 21.814 1.00 0.00 O ATOM 63038 H1 WAT 3340 117.149 113.125 21.015 1.00 0.00 H ATOM 63039 H2 WAT 3340 116.816 112.681 22.424 1.00 0.00 H TER 63041 WAT 3340 ATOM 63041 O WAT 3341 134.265 126.790 60.932 1.00 0.00 O ATOM 63042 H1 WAT 3341 134.640 127.585 60.552 1.00 0.00 H ATOM 63043 H2 WAT 3341 135.004 126.185 60.998 1.00 0.00 H TER 63045 WAT 3341 ATOM 63045 O WAT 3342 24.375 104.605 105.329 1.00 0.00 O ATOM 63046 H1 WAT 3342 24.268 104.690 106.276 1.00 0.00 H ATOM 63047 H2 WAT 3342 24.988 103.877 105.223 1.00 0.00 H TER 63049 WAT 3342 ATOM 63049 O WAT 3343 104.810 131.590 21.056 1.00 0.00 O ATOM 63050 H1 WAT 3343 104.678 131.629 22.003 1.00 0.00 H ATOM 63051 H2 WAT 3343 105.654 131.152 20.949 1.00 0.00 H TER 63053 WAT 3343 ATOM 63053 O WAT 3344 30.749 83.707 5.384 1.00 0.00 O ATOM 63054 H1 WAT 3344 31.415 84.168 4.874 1.00 0.00 H ATOM 63055 H2 WAT 3344 31.204 82.944 5.740 1.00 0.00 H TER 63057 WAT 3344 ATOM 63057 O WAT 3345 22.332 85.088 75.557 1.00 0.00 O ATOM 63058 H1 WAT 3345 21.618 84.749 75.017 1.00 0.00 H ATOM 63059 H2 WAT 3345 22.935 84.351 75.649 1.00 0.00 H TER 63061 WAT 3345 ATOM 63061 O WAT 3346 138.998 72.044 93.903 1.00 0.00 O ATOM 63062 H1 WAT 3346 139.010 72.633 93.148 1.00 0.00 H ATOM 63063 H2 WAT 3346 139.910 72.008 94.192 1.00 0.00 H TER 63065 WAT 3346 ATOM 63065 O WAT 3347 130.701 59.846 1.585 1.00 0.00 O ATOM 63066 H1 WAT 3347 130.249 60.154 2.371 1.00 0.00 H ATOM 63067 H2 WAT 3347 130.790 58.902 1.715 1.00 0.00 H TER 63069 WAT 3347 ATOM 63069 O WAT 3348 132.192 62.205 26.092 1.00 0.00 O ATOM 63070 H1 WAT 3348 131.895 62.477 25.223 1.00 0.00 H ATOM 63071 H2 WAT 3348 131.614 61.479 26.326 1.00 0.00 H TER 63073 WAT 3348 ATOM 63073 O WAT 3349 3.408 49.979 122.419 1.00 0.00 O ATOM 63074 H1 WAT 3349 3.930 49.345 122.911 1.00 0.00 H ATOM 63075 H2 WAT 3349 2.972 50.503 123.091 1.00 0.00 H TER 63077 WAT 3349 ATOM 63077 O WAT 3350 112.021 53.329 9.009 1.00 0.00 O ATOM 63078 H1 WAT 3350 111.724 53.669 9.854 1.00 0.00 H ATOM 63079 H2 WAT 3350 111.224 53.006 8.588 1.00 0.00 H TER 63081 WAT 3350 ATOM 63081 O WAT 3351 48.450 16.991 91.370 1.00 0.00 O ATOM 63082 H1 WAT 3351 48.177 17.695 91.958 1.00 0.00 H ATOM 63083 H2 WAT 3351 48.469 16.211 91.924 1.00 0.00 H TER 63085 WAT 3351 ATOM 63085 O WAT 3352 136.684 20.293 68.842 1.00 0.00 O ATOM 63086 H1 WAT 3352 137.167 20.957 68.351 1.00 0.00 H ATOM 63087 H2 WAT 3352 137.315 19.585 68.973 1.00 0.00 H TER 63089 WAT 3352 ATOM 63089 O WAT 3353 15.363 102.409 150.030 1.00 0.00 O ATOM 63090 H1 WAT 3353 16.103 102.839 150.457 1.00 0.00 H ATOM 63091 H2 WAT 3353 14.746 102.233 150.740 1.00 0.00 H TER 63093 WAT 3353 ATOM 63093 O WAT 3354 63.251 45.474 88.893 1.00 0.00 O ATOM 63094 H1 WAT 3354 64.087 45.464 89.359 1.00 0.00 H ATOM 63095 H2 WAT 3354 63.423 44.997 88.081 1.00 0.00 H TER 63097 WAT 3354 ATOM 63097 O WAT 3355 84.021 43.859 59.136 1.00 0.00 O ATOM 63098 H1 WAT 3355 83.186 43.472 58.872 1.00 0.00 H ATOM 63099 H2 WAT 3355 83.802 44.759 59.376 1.00 0.00 H TER 63101 WAT 3355 ATOM 63101 O WAT 3356 88.673 27.695 4.369 1.00 0.00 O ATOM 63102 H1 WAT 3356 88.800 27.648 5.317 1.00 0.00 H ATOM 63103 H2 WAT 3356 87.867 27.203 4.211 1.00 0.00 H TER 63105 WAT 3356 ATOM 63105 O WAT 3357 129.910 94.013 136.532 1.00 0.00 O ATOM 63106 H1 WAT 3357 130.393 93.585 137.239 1.00 0.00 H ATOM 63107 H2 WAT 3357 130.149 93.521 135.747 1.00 0.00 H TER 63109 WAT 3357 ATOM 63109 O WAT 3358 46.967 4.541 124.113 1.00 0.00 O ATOM 63110 H1 WAT 3358 46.237 5.109 124.359 1.00 0.00 H ATOM 63111 H2 WAT 3358 46.582 3.902 123.514 1.00 0.00 H TER 63113 WAT 3358 ATOM 63113 O WAT 3359 77.530 91.579 125.844 1.00 0.00 O ATOM 63114 H1 WAT 3359 77.443 92.521 125.995 1.00 0.00 H ATOM 63115 H2 WAT 3359 76.836 91.372 125.218 1.00 0.00 H TER 63117 WAT 3359 ATOM 63117 O WAT 3360 22.003 12.818 132.585 1.00 0.00 O ATOM 63118 H1 WAT 3360 22.029 12.003 133.085 1.00 0.00 H ATOM 63119 H2 WAT 3360 22.914 13.110 132.556 1.00 0.00 H TER 63121 WAT 3360 ATOM 63121 O WAT 3361 80.721 102.681 106.323 1.00 0.00 O ATOM 63122 H1 WAT 3361 81.517 102.774 106.847 1.00 0.00 H ATOM 63123 H2 WAT 3361 80.941 102.019 105.668 1.00 0.00 H TER 63125 WAT 3361 ATOM 63125 O WAT 3362 12.448 60.614 82.538 1.00 0.00 O ATOM 63126 H1 WAT 3362 12.850 60.301 83.349 1.00 0.00 H ATOM 63127 H2 WAT 3362 11.530 60.756 82.766 1.00 0.00 H TER 63129 WAT 3362 ATOM 63129 O WAT 3363 83.603 43.757 117.748 1.00 0.00 O ATOM 63130 H1 WAT 3363 83.123 43.998 118.540 1.00 0.00 H ATOM 63131 H2 WAT 3363 84.077 44.553 117.504 1.00 0.00 H TER 63133 WAT 3363 ATOM 63133 O WAT 3364 83.796 73.882 8.285 1.00 0.00 O ATOM 63134 H1 WAT 3364 83.052 74.333 7.887 1.00 0.00 H ATOM 63135 H2 WAT 3364 84.204 74.542 8.845 1.00 0.00 H TER 63137 WAT 3364 ATOM 63137 O WAT 3365 68.159 9.259 151.261 1.00 0.00 O ATOM 63138 H1 WAT 3365 69.030 9.614 151.440 1.00 0.00 H ATOM 63139 H2 WAT 3365 67.912 9.642 150.420 1.00 0.00 H TER 63141 WAT 3365 ATOM 63141 O WAT 3366 32.479 90.023 154.000 1.00 0.00 O ATOM 63142 H1 WAT 3366 32.656 89.913 154.934 1.00 0.00 H ATOM 63143 H2 WAT 3366 31.573 89.734 153.891 1.00 0.00 H TER 63145 WAT 3366 ATOM 63145 O WAT 3367 11.829 4.344 146.749 1.00 0.00 O ATOM 63146 H1 WAT 3367 12.266 3.688 146.206 1.00 0.00 H ATOM 63147 H2 WAT 3367 12.386 5.120 146.682 1.00 0.00 H TER 63149 WAT 3367 ATOM 63149 O WAT 3368 144.287 65.347 6.760 1.00 0.00 O ATOM 63150 H1 WAT 3368 144.704 64.626 6.288 1.00 0.00 H ATOM 63151 H2 WAT 3368 143.898 65.889 6.074 1.00 0.00 H TER 63153 WAT 3368 ATOM 63153 O WAT 3369 117.215 54.449 1.701 1.00 0.00 O ATOM 63154 H1 WAT 3369 116.590 54.579 0.987 1.00 0.00 H ATOM 63155 H2 WAT 3369 117.924 55.065 1.514 1.00 0.00 H TER 63157 WAT 3369 ATOM 63157 O WAT 3370 43.131 117.245 24.275 1.00 0.00 O ATOM 63158 H1 WAT 3370 42.920 116.972 25.168 1.00 0.00 H ATOM 63159 H2 WAT 3370 42.800 116.536 23.723 1.00 0.00 H TER 63161 WAT 3370 ATOM 63161 O WAT 3371 141.874 133.690 66.264 1.00 0.00 O ATOM 63162 H1 WAT 3371 142.471 133.496 65.542 1.00 0.00 H ATOM 63163 H2 WAT 3371 141.837 132.878 66.770 1.00 0.00 H TER 63165 WAT 3371 ATOM 63165 O WAT 3372 44.385 55.892 111.027 1.00 0.00 O ATOM 63166 H1 WAT 3372 44.817 56.214 110.235 1.00 0.00 H ATOM 63167 H2 WAT 3372 43.454 56.055 110.875 1.00 0.00 H TER 63169 WAT 3372 ATOM 63169 O WAT 3373 40.416 73.186 109.823 1.00 0.00 O ATOM 63170 H1 WAT 3373 40.454 72.549 109.109 1.00 0.00 H ATOM 63171 H2 WAT 3373 40.414 72.653 110.619 1.00 0.00 H TER 63173 WAT 3373 ATOM 63173 O WAT 3374 26.528 77.582 72.390 1.00 0.00 O ATOM 63174 H1 WAT 3374 25.636 77.771 72.682 1.00 0.00 H ATOM 63175 H2 WAT 3374 26.917 77.089 73.113 1.00 0.00 H TER 63177 WAT 3374 ATOM 63177 O WAT 3375 117.765 128.072 73.630 1.00 0.00 O ATOM 63178 H1 WAT 3375 117.868 128.150 72.681 1.00 0.00 H ATOM 63179 H2 WAT 3375 118.334 127.342 73.873 1.00 0.00 H TER 63181 WAT 3375 ATOM 63181 O WAT 3376 141.300 35.700 81.586 1.00 0.00 O ATOM 63182 H1 WAT 3376 141.481 35.188 80.797 1.00 0.00 H ATOM 63183 H2 WAT 3376 140.391 35.983 81.484 1.00 0.00 H TER 63185 WAT 3376 ATOM 63185 O WAT 3377 126.390 67.109 156.673 1.00 0.00 O ATOM 63186 H1 WAT 3377 125.642 66.783 157.172 1.00 0.00 H ATOM 63187 H2 WAT 3377 127.003 66.374 156.652 1.00 0.00 H TER 63189 WAT 3377 ATOM 63189 O WAT 3378 35.554 75.234 21.548 1.00 0.00 O ATOM 63190 H1 WAT 3378 36.141 75.053 22.281 1.00 0.00 H ATOM 63191 H2 WAT 3378 34.692 75.340 21.951 1.00 0.00 H TER 63193 WAT 3378 ATOM 63193 O WAT 3379 97.930 83.413 135.484 1.00 0.00 O ATOM 63194 H1 WAT 3379 98.380 84.157 135.884 1.00 0.00 H ATOM 63195 H2 WAT 3379 97.401 83.800 134.787 1.00 0.00 H TER 63197 WAT 3379 ATOM 63197 O WAT 3380 24.114 51.118 70.221 1.00 0.00 O ATOM 63198 H1 WAT 3380 24.063 50.186 70.010 1.00 0.00 H ATOM 63199 H2 WAT 3380 24.796 51.458 69.641 1.00 0.00 H TER 63201 WAT 3380 ATOM 63201 O WAT 3381 85.336 116.483 135.222 1.00 0.00 O ATOM 63202 H1 WAT 3381 86.221 116.847 135.236 1.00 0.00 H ATOM 63203 H2 WAT 3381 84.874 117.001 134.562 1.00 0.00 H TER 63205 WAT 3381 ATOM 63205 O WAT 3382 130.386 52.235 102.874 1.00 0.00 O ATOM 63206 H1 WAT 3382 129.497 52.549 102.712 1.00 0.00 H ATOM 63207 H2 WAT 3382 130.389 51.988 103.799 1.00 0.00 H TER 63209 WAT 3382 ATOM 63209 O WAT 3383 115.727 31.166 16.600 1.00 0.00 O ATOM 63210 H1 WAT 3383 115.913 30.617 17.363 1.00 0.00 H ATOM 63211 H2 WAT 3383 115.446 32.002 16.970 1.00 0.00 H TER 63213 WAT 3383 ATOM 63213 O WAT 3384 20.600 31.759 28.379 1.00 0.00 O ATOM 63214 H1 WAT 3384 19.644 31.759 28.339 1.00 0.00 H ATOM 63215 H2 WAT 3384 20.803 31.484 29.273 1.00 0.00 H TER 63217 WAT 3384 ATOM 63217 O WAT 3385 36.573 109.313 65.108 1.00 0.00 O ATOM 63218 H1 WAT 3385 37.224 109.481 64.427 1.00 0.00 H ATOM 63219 H2 WAT 3385 36.289 108.413 64.951 1.00 0.00 H TER 63221 WAT 3385 ATOM 63221 O WAT 3386 97.004 4.128 117.008 1.00 0.00 O ATOM 63222 H1 WAT 3386 96.275 3.528 116.853 1.00 0.00 H ATOM 63223 H2 WAT 3386 96.806 4.533 117.852 1.00 0.00 H TER 63225 WAT 3386 ATOM 63225 O WAT 3387 102.240 19.582 70.974 1.00 0.00 O ATOM 63226 H1 WAT 3387 102.562 19.905 70.133 1.00 0.00 H ATOM 63227 H2 WAT 3387 101.758 20.320 71.346 1.00 0.00 H TER 63229 WAT 3387 ATOM 63229 O WAT 3388 86.141 14.466 96.922 1.00 0.00 O ATOM 63230 H1 WAT 3388 85.185 14.459 96.944 1.00 0.00 H ATOM 63231 H2 WAT 3388 86.367 13.949 96.149 1.00 0.00 H TER 63233 WAT 3388 ATOM 63233 O WAT 3389 118.420 124.253 106.326 1.00 0.00 O ATOM 63234 H1 WAT 3389 118.045 123.611 106.930 1.00 0.00 H ATOM 63235 H2 WAT 3389 117.883 124.183 105.538 1.00 0.00 H TER 63237 WAT 3389 ATOM 63237 O WAT 3390 126.732 37.916 137.610 1.00 0.00 O ATOM 63238 H1 WAT 3390 126.802 37.460 138.449 1.00 0.00 H ATOM 63239 H2 WAT 3390 126.647 38.839 137.846 1.00 0.00 H TER 63241 WAT 3390 ATOM 63241 O WAT 3391 78.891 82.111 114.465 1.00 0.00 O ATOM 63242 H1 WAT 3391 78.907 82.321 115.399 1.00 0.00 H ATOM 63243 H2 WAT 3391 79.797 82.226 114.178 1.00 0.00 H TER 63245 WAT 3391 ATOM 63245 O WAT 3392 21.082 114.169 71.058 1.00 0.00 O ATOM 63246 H1 WAT 3392 20.674 113.610 71.719 1.00 0.00 H ATOM 63247 H2 WAT 3392 21.892 114.473 71.467 1.00 0.00 H TER 63249 WAT 3392 ATOM 63249 O WAT 3393 116.243 123.317 74.661 1.00 0.00 O ATOM 63250 H1 WAT 3393 117.155 123.059 74.530 1.00 0.00 H ATOM 63251 H2 WAT 3393 115.815 122.526 74.990 1.00 0.00 H TER 63253 WAT 3393 ATOM 63253 O WAT 3394 19.928 59.692 53.226 1.00 0.00 O ATOM 63254 H1 WAT 3394 20.613 60.351 53.340 1.00 0.00 H ATOM 63255 H2 WAT 3394 19.237 60.147 52.744 1.00 0.00 H TER 63257 WAT 3394 ATOM 63257 O WAT 3395 129.163 77.828 144.387 1.00 0.00 O ATOM 63258 H1 WAT 3395 130.037 77.706 144.016 1.00 0.00 H ATOM 63259 H2 WAT 3395 128.887 76.948 144.644 1.00 0.00 H TER 63261 WAT 3395 ATOM 63261 O WAT 3396 80.488 106.156 109.025 1.00 0.00 O ATOM 63262 H1 WAT 3396 80.973 105.947 109.823 1.00 0.00 H ATOM 63263 H2 WAT 3396 80.580 107.104 108.930 1.00 0.00 H TER 63265 WAT 3396 ATOM 63265 O WAT 3397 51.365 46.482 59.608 1.00 0.00 O ATOM 63266 H1 WAT 3397 52.257 46.370 59.937 1.00 0.00 H ATOM 63267 H2 WAT 3397 51.289 47.420 59.436 1.00 0.00 H TER 63269 WAT 3397 ATOM 63269 O WAT 3398 123.672 118.813 62.738 1.00 0.00 O ATOM 63270 H1 WAT 3398 124.087 119.622 63.037 1.00 0.00 H ATOM 63271 H2 WAT 3398 122.872 118.747 63.259 1.00 0.00 H TER 63273 WAT 3398 ATOM 63273 O WAT 3399 31.965 144.008 104.118 1.00 0.00 O ATOM 63274 H1 WAT 3399 32.504 143.227 103.994 1.00 0.00 H ATOM 63275 H2 WAT 3399 31.099 143.669 104.340 1.00 0.00 H TER 63277 WAT 3399 ATOM 63277 O WAT 3400 117.822 125.910 9.960 1.00 0.00 O ATOM 63278 H1 WAT 3400 118.186 125.279 9.339 1.00 0.00 H ATOM 63279 H2 WAT 3400 118.557 126.136 10.530 1.00 0.00 H TER 63281 WAT 3400 ATOM 63281 O WAT 3401 11.529 122.008 105.323 1.00 0.00 O ATOM 63282 H1 WAT 3401 10.985 122.636 104.848 1.00 0.00 H ATOM 63283 H2 WAT 3401 11.227 122.066 106.229 1.00 0.00 H TER 63285 WAT 3401 ATOM 63285 O WAT 3402 114.169 26.491 70.031 1.00 0.00 O ATOM 63286 H1 WAT 3402 113.343 26.895 70.300 1.00 0.00 H ATOM 63287 H2 WAT 3402 114.477 27.037 69.308 1.00 0.00 H TER 63289 WAT 3402 ATOM 63289 O WAT 3403 43.393 106.985 125.870 1.00 0.00 O ATOM 63290 H1 WAT 3403 42.781 106.287 125.635 1.00 0.00 H ATOM 63291 H2 WAT 3403 43.407 107.559 125.104 1.00 0.00 H TER 63293 WAT 3403 ATOM 63293 O WAT 3404 83.433 98.304 134.143 1.00 0.00 O ATOM 63294 H1 WAT 3404 83.884 99.111 134.391 1.00 0.00 H ATOM 63295 H2 WAT 3404 83.491 98.280 133.188 1.00 0.00 H TER 63297 WAT 3404 ATOM 63297 O WAT 3405 90.239 114.609 104.906 1.00 0.00 O ATOM 63298 H1 WAT 3405 89.525 114.399 105.508 1.00 0.00 H ATOM 63299 H2 WAT 3405 90.518 113.760 104.561 1.00 0.00 H TER 63301 WAT 3405 ATOM 63301 O WAT 3406 58.476 141.397 65.312 1.00 0.00 O ATOM 63302 H1 WAT 3406 58.783 141.979 64.617 1.00 0.00 H ATOM 63303 H2 WAT 3406 57.546 141.267 65.122 1.00 0.00 H TER 63305 WAT 3406 ATOM 63305 O WAT 3407 145.105 67.997 116.600 1.00 0.00 O ATOM 63306 H1 WAT 3407 145.552 68.360 117.364 1.00 0.00 H ATOM 63307 H2 WAT 3407 144.609 67.253 116.943 1.00 0.00 H TER 63309 WAT 3407 ATOM 63309 O WAT 3408 10.743 127.831 11.896 1.00 0.00 O ATOM 63310 H1 WAT 3408 10.130 127.952 11.171 1.00 0.00 H ATOM 63311 H2 WAT 3408 11.229 127.039 11.668 1.00 0.00 H TER 63313 WAT 3408 ATOM 63313 O WAT 3409 144.271 131.014 93.693 1.00 0.00 O ATOM 63314 H1 WAT 3409 144.022 130.091 93.650 1.00 0.00 H ATOM 63315 H2 WAT 3409 143.518 131.447 94.095 1.00 0.00 H TER 63317 WAT 3409 ATOM 63317 O WAT 3410 13.232 141.669 60.930 1.00 0.00 O ATOM 63318 H1 WAT 3410 12.549 142.270 61.228 1.00 0.00 H ATOM 63319 H2 WAT 3410 12.835 140.801 61.000 1.00 0.00 H TER 63321 WAT 3410 ATOM 63321 O WAT 3411 58.591 101.682 121.181 1.00 0.00 O ATOM 63322 H1 WAT 3411 59.083 101.671 120.361 1.00 0.00 H ATOM 63323 H2 WAT 3411 58.614 102.596 121.463 1.00 0.00 H TER 63325 WAT 3411 ATOM 63325 O WAT 3412 123.634 63.213 152.316 1.00 0.00 O ATOM 63326 H1 WAT 3412 122.876 63.701 152.637 1.00 0.00 H ATOM 63327 H2 WAT 3412 124.327 63.403 152.948 1.00 0.00 H TER 63329 WAT 3412 ATOM 63329 O WAT 3413 127.952 39.506 12.866 1.00 0.00 O ATOM 63330 H1 WAT 3413 128.797 39.060 12.812 1.00 0.00 H ATOM 63331 H2 WAT 3413 127.872 39.972 12.034 1.00 0.00 H TER 63333 WAT 3413 ATOM 63333 O WAT 3414 100.932 98.128 76.161 1.00 0.00 O ATOM 63334 H1 WAT 3414 101.266 97.302 76.511 1.00 0.00 H ATOM 63335 H2 WAT 3414 101.717 98.619 75.917 1.00 0.00 H TER 63337 WAT 3414 ATOM 63337 O WAT 3415 125.680 125.268 2.803 1.00 0.00 O ATOM 63338 H1 WAT 3415 125.506 125.083 3.726 1.00 0.00 H ATOM 63339 H2 WAT 3415 126.500 125.762 2.808 1.00 0.00 H TER 63341 WAT 3415 ATOM 63341 O WAT 3416 54.271 43.765 152.490 1.00 0.00 O ATOM 63342 H1 WAT 3416 54.289 43.557 151.556 1.00 0.00 H ATOM 63343 H2 WAT 3416 53.353 43.661 152.741 1.00 0.00 H TER 63345 WAT 3416 ATOM 63345 O WAT 3417 9.333 16.203 91.527 1.00 0.00 O ATOM 63346 H1 WAT 3417 9.045 16.465 90.652 1.00 0.00 H ATOM 63347 H2 WAT 3417 10.202 16.592 91.619 1.00 0.00 H TER 63349 WAT 3417 ATOM 63349 O WAT 3418 56.556 4.869 108.766 1.00 0.00 O ATOM 63350 H1 WAT 3418 55.645 5.142 108.659 1.00 0.00 H ATOM 63351 H2 WAT 3418 56.907 4.852 107.876 1.00 0.00 H TER 63353 WAT 3418 ATOM 63353 O WAT 3419 30.430 1.613 107.389 1.00 0.00 O ATOM 63354 H1 WAT 3419 29.952 1.224 108.121 1.00 0.00 H ATOM 63355 H2 WAT 3419 31.112 0.973 107.181 1.00 0.00 H TER 63357 WAT 3419 ATOM 63357 O WAT 3420 70.729 30.326 12.877 1.00 0.00 O ATOM 63358 H1 WAT 3420 71.641 30.292 12.590 1.00 0.00 H ATOM 63359 H2 WAT 3420 70.243 30.600 12.099 1.00 0.00 H TER 63361 WAT 3420 ATOM 63361 O WAT 3421 120.136 78.673 64.521 1.00 0.00 O ATOM 63362 H1 WAT 3421 119.453 78.284 65.067 1.00 0.00 H ATOM 63363 H2 WAT 3421 120.946 78.526 65.007 1.00 0.00 H TER 63365 WAT 3421 ATOM 63365 O WAT 3422 85.842 12.183 4.135 1.00 0.00 O ATOM 63366 H1 WAT 3422 86.679 11.983 4.554 1.00 0.00 H ATOM 63367 H2 WAT 3422 85.203 11.655 4.614 1.00 0.00 H TER 63369 WAT 3422 ATOM 63369 O WAT 3423 85.012 135.316 141.317 1.00 0.00 O ATOM 63370 H1 WAT 3423 85.578 135.072 140.585 1.00 0.00 H ATOM 63371 H2 WAT 3423 85.434 134.932 142.085 1.00 0.00 H TER 63373 WAT 3423 ATOM 63373 O WAT 3424 30.197 89.681 86.767 1.00 0.00 O ATOM 63374 H1 WAT 3424 31.120 89.786 86.537 1.00 0.00 H ATOM 63375 H2 WAT 3424 29.721 90.087 86.043 1.00 0.00 H TER 63377 WAT 3424 ATOM 63377 O WAT 3425 133.606 119.522 14.820 1.00 0.00 O ATOM 63378 H1 WAT 3425 133.217 118.939 15.471 1.00 0.00 H ATOM 63379 H2 WAT 3425 132.893 119.709 14.210 1.00 0.00 H TER 63381 WAT 3425 ATOM 63381 O WAT 3426 64.575 136.152 151.605 1.00 0.00 O ATOM 63382 H1 WAT 3426 63.752 135.815 151.961 1.00 0.00 H ATOM 63383 H2 WAT 3426 64.991 135.391 151.201 1.00 0.00 H TER 63385 WAT 3426 ATOM 63385 O WAT 3427 89.255 130.822 117.543 1.00 0.00 O ATOM 63386 H1 WAT 3427 88.838 130.088 117.091 1.00 0.00 H ATOM 63387 H2 WAT 3427 88.854 131.600 117.157 1.00 0.00 H TER 63389 WAT 3427 ATOM 63389 O WAT 3428 20.135 70.472 119.655 1.00 0.00 O ATOM 63390 H1 WAT 3428 20.361 71.391 119.794 1.00 0.00 H ATOM 63391 H2 WAT 3428 19.180 70.447 119.725 1.00 0.00 H TER 63393 WAT 3428 ATOM 63393 O WAT 3429 26.640 1.422 86.347 1.00 0.00 O ATOM 63394 H1 WAT 3429 27.316 2.004 86.693 1.00 0.00 H ATOM 63395 H2 WAT 3429 25.884 1.992 86.202 1.00 0.00 H TER 63397 WAT 3429 ATOM 63397 O WAT 3430 82.894 95.562 3.506 1.00 0.00 O ATOM 63398 H1 WAT 3430 83.375 94.734 3.506 1.00 0.00 H ATOM 63399 H2 WAT 3430 83.511 96.198 3.145 1.00 0.00 H TER 63401 WAT 3430 ATOM 63401 O WAT 3431 80.961 86.957 2.886 1.00 0.00 O ATOM 63402 H1 WAT 3431 81.691 87.565 2.775 1.00 0.00 H ATOM 63403 H2 WAT 3431 81.344 86.093 2.733 1.00 0.00 H TER 63405 WAT 3431 ATOM 63405 O WAT 3432 12.686 105.183 68.060 1.00 0.00 O ATOM 63406 H1 WAT 3432 13.141 105.452 68.858 1.00 0.00 H ATOM 63407 H2 WAT 3432 11.896 104.742 68.372 1.00 0.00 H TER 63409 WAT 3432 ATOM 63409 O WAT 3433 126.468 145.252 58.392 1.00 0.00 O ATOM 63410 H1 WAT 3433 127.331 144.890 58.189 1.00 0.00 H ATOM 63411 H2 WAT 3433 126.654 146.041 58.900 1.00 0.00 H TER 63413 WAT 3433 ATOM 63413 O WAT 3434 62.349 102.558 154.799 1.00 0.00 O ATOM 63414 H1 WAT 3434 61.526 103.033 154.690 1.00 0.00 H ATOM 63415 H2 WAT 3434 62.904 102.873 154.086 1.00 0.00 H TER 63417 WAT 3434 ATOM 63417 O WAT 3435 103.011 87.044 145.722 1.00 0.00 O ATOM 63418 H1 WAT 3435 102.808 87.475 146.552 1.00 0.00 H ATOM 63419 H2 WAT 3435 103.655 87.618 145.306 1.00 0.00 H TER 63421 WAT 3435 ATOM 63421 O WAT 3436 125.650 128.215 86.984 1.00 0.00 O ATOM 63422 H1 WAT 3436 125.350 128.979 87.477 1.00 0.00 H ATOM 63423 H2 WAT 3436 126.114 128.582 86.232 1.00 0.00 H TER 63425 WAT 3436 ATOM 63425 O WAT 3437 92.882 75.930 147.189 1.00 0.00 O ATOM 63426 H1 WAT 3437 92.571 75.754 148.077 1.00 0.00 H ATOM 63427 H2 WAT 3437 92.873 76.884 147.116 1.00 0.00 H TER 63429 WAT 3437 ATOM 63429 O WAT 3438 87.404 106.205 144.946 1.00 0.00 O ATOM 63430 H1 WAT 3438 88.033 106.660 145.505 1.00 0.00 H ATOM 63431 H2 WAT 3438 86.746 106.868 144.736 1.00 0.00 H TER 63433 WAT 3438 ATOM 63433 O WAT 3439 140.326 144.328 102.236 1.00 0.00 O ATOM 63434 H1 WAT 3439 140.470 144.074 101.324 1.00 0.00 H ATOM 63435 H2 WAT 3439 141.203 144.366 102.616 1.00 0.00 H TER 63437 WAT 3439 ATOM 63437 O WAT 3440 9.018 53.923 115.558 1.00 0.00 O ATOM 63438 H1 WAT 3440 8.364 54.267 114.948 1.00 0.00 H ATOM 63439 H2 WAT 3440 9.858 54.172 115.173 1.00 0.00 H TER 63441 WAT 3440 ATOM 63441 O WAT 3441 39.758 106.961 157.593 1.00 0.00 O ATOM 63442 H1 WAT 3441 39.852 107.868 157.884 1.00 0.00 H ATOM 63443 H2 WAT 3441 40.308 106.458 158.195 1.00 0.00 H TER 63445 WAT 3441 ATOM 63445 O WAT 3442 101.950 50.657 157.105 1.00 0.00 O ATOM 63446 H1 WAT 3442 101.952 51.341 157.774 1.00 0.00 H ATOM 63447 H2 WAT 3442 101.707 49.861 157.577 1.00 0.00 H TER 63449 WAT 3442 ATOM 63449 O WAT 3443 133.362 67.093 134.798 1.00 0.00 O ATOM 63450 H1 WAT 3443 132.872 66.270 134.768 1.00 0.00 H ATOM 63451 H2 WAT 3443 133.969 66.983 135.529 1.00 0.00 H TER 63453 WAT 3443 ATOM 63453 O WAT 3444 55.813 134.682 108.513 1.00 0.00 O ATOM 63454 H1 WAT 3444 55.216 134.110 108.996 1.00 0.00 H ATOM 63455 H2 WAT 3444 56.631 134.648 109.009 1.00 0.00 H TER 63457 WAT 3444 ATOM 63457 O WAT 3445 9.746 73.116 11.329 1.00 0.00 O ATOM 63458 H1 WAT 3445 9.604 73.566 12.162 1.00 0.00 H ATOM 63459 H2 WAT 3445 8.866 72.965 10.985 1.00 0.00 H TER 63461 WAT 3445 ATOM 63461 O WAT 3446 18.380 27.024 153.973 1.00 0.00 O ATOM 63462 H1 WAT 3446 19.213 26.557 154.030 1.00 0.00 H ATOM 63463 H2 WAT 3446 18.593 27.838 153.516 1.00 0.00 H TER 63465 WAT 3446 ATOM 63465 O WAT 3447 54.602 76.856 148.710 1.00 0.00 O ATOM 63466 H1 WAT 3447 53.879 77.471 148.584 1.00 0.00 H ATOM 63467 H2 WAT 3447 55.099 76.900 147.893 1.00 0.00 H TER 63469 WAT 3447 ATOM 63469 O WAT 3448 6.513 105.093 88.619 1.00 0.00 O ATOM 63470 H1 WAT 3448 5.992 104.463 89.116 1.00 0.00 H ATOM 63471 H2 WAT 3448 6.117 105.099 87.748 1.00 0.00 H TER 63473 WAT 3448 ATOM 63473 O WAT 3449 126.829 126.970 57.015 1.00 0.00 O ATOM 63474 H1 WAT 3449 125.975 126.651 57.306 1.00 0.00 H ATOM 63475 H2 WAT 3449 127.044 126.423 56.259 1.00 0.00 H TER 63477 WAT 3449 ATOM 63477 O WAT 3450 63.440 44.391 18.221 1.00 0.00 O ATOM 63478 H1 WAT 3450 63.701 45.235 17.853 1.00 0.00 H ATOM 63479 H2 WAT 3450 63.651 43.756 17.538 1.00 0.00 H TER 63481 WAT 3450 ATOM 63481 O WAT 3451 54.125 85.329 116.594 1.00 0.00 O ATOM 63482 H1 WAT 3451 54.611 84.529 116.791 1.00 0.00 H ATOM 63483 H2 WAT 3451 53.238 85.028 116.396 1.00 0.00 H TER 63485 WAT 3451 ATOM 63485 O WAT 3452 18.357 80.251 105.376 1.00 0.00 O ATOM 63486 H1 WAT 3452 17.985 79.807 106.138 1.00 0.00 H ATOM 63487 H2 WAT 3452 17.603 80.640 104.933 1.00 0.00 H TER 63489 WAT 3452 ATOM 63489 O WAT 3453 19.441 137.547 4.652 1.00 0.00 O ATOM 63490 H1 WAT 3453 18.676 137.222 5.127 1.00 0.00 H ATOM 63491 H2 WAT 3453 19.473 138.480 4.860 1.00 0.00 H TER 63493 WAT 3453 ATOM 63493 O WAT 3454 71.733 25.702 136.441 1.00 0.00 O ATOM 63494 H1 WAT 3454 71.436 26.611 136.386 1.00 0.00 H ATOM 63495 H2 WAT 3454 71.108 25.213 135.905 1.00 0.00 H TER 63497 WAT 3454 ATOM 63497 O WAT 3455 78.637 138.731 23.666 1.00 0.00 O ATOM 63498 H1 WAT 3455 78.008 139.434 23.829 1.00 0.00 H ATOM 63499 H2 WAT 3455 78.098 137.950 23.541 1.00 0.00 H TER 63501 WAT 3455 ATOM 63501 O WAT 3456 76.403 40.240 15.542 1.00 0.00 O ATOM 63502 H1 WAT 3456 76.158 41.015 16.048 1.00 0.00 H ATOM 63503 H2 WAT 3456 76.673 39.600 16.200 1.00 0.00 H TER 63505 WAT 3456 ATOM 63505 O WAT 3457 18.826 67.619 141.480 1.00 0.00 O ATOM 63506 H1 WAT 3457 18.626 67.271 140.611 1.00 0.00 H ATOM 63507 H2 WAT 3457 18.110 67.309 142.033 1.00 0.00 H TER 63509 WAT 3457 ATOM 63509 O WAT 3458 140.369 133.952 144.711 1.00 0.00 O ATOM 63510 H1 WAT 3458 140.772 133.187 144.300 1.00 0.00 H ATOM 63511 H2 WAT 3458 140.865 134.696 144.370 1.00 0.00 H TER 63513 WAT 3458 ATOM 63513 O WAT 3459 84.827 20.512 90.175 1.00 0.00 O ATOM 63514 H1 WAT 3459 84.739 20.571 89.224 1.00 0.00 H ATOM 63515 H2 WAT 3459 84.696 19.584 90.370 1.00 0.00 H TER 63517 WAT 3459 ATOM 63517 O WAT 3460 1.154 9.739 100.395 1.00 0.00 O ATOM 63518 H1 WAT 3460 0.256 9.533 100.134 1.00 0.00 H ATOM 63519 H2 WAT 3460 1.307 9.201 101.171 1.00 0.00 H TER 63521 WAT 3460 ATOM 63521 O WAT 3461 125.599 138.277 111.711 1.00 0.00 O ATOM 63522 H1 WAT 3461 126.187 139.032 111.739 1.00 0.00 H ATOM 63523 H2 WAT 3461 126.130 137.548 112.031 1.00 0.00 H TER 63525 WAT 3461 ATOM 63525 O WAT 3462 39.719 138.764 121.046 1.00 0.00 O ATOM 63526 H1 WAT 3462 39.337 139.054 121.875 1.00 0.00 H ATOM 63527 H2 WAT 3462 40.227 139.515 120.741 1.00 0.00 H TER 63529 WAT 3462 ATOM 63529 O WAT 3463 140.994 134.876 108.538 1.00 0.00 O ATOM 63530 H1 WAT 3463 141.412 135.019 107.689 1.00 0.00 H ATOM 63531 H2 WAT 3463 140.987 133.925 108.644 1.00 0.00 H TER 63533 WAT 3463 ATOM 63533 O WAT 3464 107.175 117.996 2.740 1.00 0.00 O ATOM 63534 H1 WAT 3464 106.619 118.583 2.227 1.00 0.00 H ATOM 63535 H2 WAT 3464 107.052 118.281 3.646 1.00 0.00 H TER 63537 WAT 3464 ATOM 63537 O WAT 3465 28.048 18.547 120.777 1.00 0.00 O ATOM 63538 H1 WAT 3465 27.510 19.176 121.258 1.00 0.00 H ATOM 63539 H2 WAT 3465 28.123 18.918 119.898 1.00 0.00 H TER 63541 WAT 3465 ATOM 63541 O WAT 3466 23.363 23.179 120.043 1.00 0.00 O ATOM 63542 H1 WAT 3466 23.256 22.393 120.578 1.00 0.00 H ATOM 63543 H2 WAT 3466 22.628 23.741 120.292 1.00 0.00 H TER 63545 WAT 3466 ATOM 63545 O WAT 3467 27.188 113.666 87.814 1.00 0.00 O ATOM 63546 H1 WAT 3467 27.499 113.580 86.912 1.00 0.00 H ATOM 63547 H2 WAT 3467 27.440 112.844 88.234 1.00 0.00 H TER 63549 WAT 3467 ATOM 63549 O WAT 3468 126.702 71.831 61.912 1.00 0.00 O ATOM 63550 H1 WAT 3468 127.590 71.514 61.749 1.00 0.00 H ATOM 63551 H2 WAT 3468 126.790 72.784 61.948 1.00 0.00 H TER 63553 WAT 3468 ATOM 63553 O WAT 3469 63.400 65.538 155.927 1.00 0.00 O ATOM 63554 H1 WAT 3469 63.721 65.371 155.041 1.00 0.00 H ATOM 63555 H2 WAT 3469 62.497 65.220 155.918 1.00 0.00 H TER 63557 WAT 3469 ATOM 63557 O WAT 3470 120.980 29.566 141.982 1.00 0.00 O ATOM 63558 H1 WAT 3470 120.757 29.955 141.136 1.00 0.00 H ATOM 63559 H2 WAT 3470 120.645 28.671 141.930 1.00 0.00 H TER 63561 WAT 3470 ATOM 63561 O WAT 3471 4.136 41.494 68.428 1.00 0.00 O ATOM 63562 H1 WAT 3471 3.332 41.620 68.933 1.00 0.00 H ATOM 63563 H2 WAT 3471 4.035 42.070 67.670 1.00 0.00 H TER 63565 WAT 3471 ATOM 63565 O WAT 3472 22.652 66.804 131.187 1.00 0.00 O ATOM 63566 H1 WAT 3472 22.737 65.928 131.564 1.00 0.00 H ATOM 63567 H2 WAT 3472 22.764 67.396 131.930 1.00 0.00 H TER 63569 WAT 3472 ATOM 63569 O WAT 3473 2.008 24.320 87.787 1.00 0.00 O ATOM 63570 H1 WAT 3473 1.732 25.172 87.451 1.00 0.00 H ATOM 63571 H2 WAT 3473 2.659 24.526 88.458 1.00 0.00 H TER 63573 WAT 3473 ATOM 63573 O WAT 3474 0.266 67.905 128.914 1.00 0.00 O ATOM 63574 H1 WAT 3474 1.138 67.612 129.178 1.00 0.00 H ATOM 63575 H2 WAT 3474 -0.278 67.120 128.970 1.00 0.00 H TER 63577 WAT 3474 ATOM 63577 O WAT 3475 59.644 31.481 3.117 1.00 0.00 O ATOM 63578 H1 WAT 3475 59.814 30.690 3.629 1.00 0.00 H ATOM 63579 H2 WAT 3475 59.799 31.217 2.210 1.00 0.00 H TER 63581 WAT 3475 ATOM 63581 O WAT 3476 46.239 136.105 107.129 1.00 0.00 O ATOM 63582 H1 WAT 3476 46.486 136.737 106.454 1.00 0.00 H ATOM 63583 H2 WAT 3476 46.406 135.251 106.731 1.00 0.00 H TER 63585 WAT 3476 ATOM 63585 O WAT 3477 81.867 130.473 78.137 1.00 0.00 O ATOM 63586 H1 WAT 3477 81.191 130.247 78.776 1.00 0.00 H ATOM 63587 H2 WAT 3477 82.135 129.633 77.765 1.00 0.00 H TER 63589 WAT 3477 ATOM 63589 O WAT 3478 136.559 128.438 86.363 1.00 0.00 O ATOM 63590 H1 WAT 3478 136.497 127.643 85.834 1.00 0.00 H ATOM 63591 H2 WAT 3478 137.423 128.795 86.158 1.00 0.00 H TER 63593 WAT 3478 ATOM 63593 O WAT 3479 79.908 52.938 15.718 1.00 0.00 O ATOM 63594 H1 WAT 3479 80.556 53.588 15.990 1.00 0.00 H ATOM 63595 H2 WAT 3479 79.157 53.455 15.427 1.00 0.00 H TER 63597 WAT 3479 ATOM 63597 O WAT 3480 27.040 26.434 56.745 1.00 0.00 O ATOM 63598 H1 WAT 3480 27.539 27.249 56.804 1.00 0.00 H ATOM 63599 H2 WAT 3480 27.467 25.846 57.368 1.00 0.00 H TER 63601 WAT 3480 ATOM 63601 O WAT 3481 23.784 109.261 104.314 1.00 0.00 O ATOM 63602 H1 WAT 3481 24.258 108.579 104.789 1.00 0.00 H ATOM 63603 H2 WAT 3481 24.282 109.381 103.506 1.00 0.00 H TER 63605 WAT 3481 ATOM 63605 O WAT 3482 91.694 81.637 130.207 1.00 0.00 O ATOM 63606 H1 WAT 3482 92.096 81.739 129.344 1.00 0.00 H ATOM 63607 H2 WAT 3482 92.238 82.169 130.789 1.00 0.00 H TER 63609 WAT 3482 ATOM 63609 O WAT 3483 52.283 59.511 149.535 1.00 0.00 O ATOM 63610 H1 WAT 3483 51.373 59.219 149.590 1.00 0.00 H ATOM 63611 H2 WAT 3483 52.711 58.860 148.979 1.00 0.00 H TER 63613 WAT 3483 ATOM 63613 O WAT 3484 60.884 19.042 85.296 1.00 0.00 O ATOM 63614 H1 WAT 3484 61.081 19.147 86.227 1.00 0.00 H ATOM 63615 H2 WAT 3484 61.517 19.605 84.852 1.00 0.00 H TER 63617 WAT 3484 ATOM 63617 O WAT 3485 43.691 10.416 10.463 1.00 0.00 O ATOM 63618 H1 WAT 3485 43.073 10.607 11.169 1.00 0.00 H ATOM 63619 H2 WAT 3485 44.537 10.332 10.902 1.00 0.00 H TER 63621 WAT 3485 ATOM 63621 O WAT 3486 105.957 18.521 17.818 1.00 0.00 O ATOM 63622 H1 WAT 3486 106.403 17.766 17.435 1.00 0.00 H ATOM 63623 H2 WAT 3486 105.025 18.331 17.704 1.00 0.00 H TER 63625 WAT 3486 ATOM 63625 O WAT 3487 143.155 82.812 103.978 1.00 0.00 O ATOM 63626 H1 WAT 3487 143.960 83.320 104.074 1.00 0.00 H ATOM 63627 H2 WAT 3487 142.888 82.956 103.070 1.00 0.00 H TER 63629 WAT 3487 ATOM 63629 O WAT 3488 119.708 85.384 131.657 1.00 0.00 O ATOM 63630 H1 WAT 3488 119.729 86.328 131.814 1.00 0.00 H ATOM 63631 H2 WAT 3488 119.825 85.295 130.712 1.00 0.00 H TER 63633 WAT 3488 ATOM 63633 O WAT 3489 60.391 99.208 156.265 1.00 0.00 O ATOM 63634 H1 WAT 3489 61.075 99.816 156.547 1.00 0.00 H ATOM 63635 H2 WAT 3489 59.572 99.672 156.440 1.00 0.00 H TER 63637 WAT 3489 ATOM 63637 O WAT 3490 109.257 93.024 115.265 1.00 0.00 O ATOM 63638 H1 WAT 3490 109.834 93.454 115.896 1.00 0.00 H ATOM 63639 H2 WAT 3490 109.829 92.421 114.790 1.00 0.00 H TER 63641 WAT 3490 ATOM 63641 O WAT 3491 82.502 36.357 89.285 1.00 0.00 O ATOM 63642 H1 WAT 3491 82.630 36.929 90.042 1.00 0.00 H ATOM 63643 H2 WAT 3491 83.359 36.326 88.860 1.00 0.00 H TER 63645 WAT 3491 ATOM 63645 O WAT 3492 15.372 126.858 17.545 1.00 0.00 O ATOM 63646 H1 WAT 3492 14.705 127.476 17.245 1.00 0.00 H ATOM 63647 H2 WAT 3492 15.308 126.123 16.935 1.00 0.00 H TER 63649 WAT 3492 ATOM 63649 O WAT 3493 94.208 115.311 57.883 1.00 0.00 O ATOM 63650 H1 WAT 3493 95.140 115.412 58.077 1.00 0.00 H ATOM 63651 H2 WAT 3493 93.896 114.676 58.528 1.00 0.00 H TER 63653 WAT 3493 ATOM 63653 O WAT 3494 107.512 93.738 127.972 1.00 0.00 O ATOM 63654 H1 WAT 3494 108.200 93.704 128.637 1.00 0.00 H ATOM 63655 H2 WAT 3494 107.791 94.431 127.374 1.00 0.00 H TER 63657 WAT 3494 ATOM 63657 O WAT 3495 129.858 25.998 14.588 1.00 0.00 O ATOM 63658 H1 WAT 3495 130.607 25.560 14.183 1.00 0.00 H ATOM 63659 H2 WAT 3495 129.806 26.844 14.141 1.00 0.00 H TER 63661 WAT 3495 ATOM 63661 O WAT 3496 6.590 100.706 80.026 1.00 0.00 O ATOM 63662 H1 WAT 3496 6.868 100.065 79.372 1.00 0.00 H ATOM 63663 H2 WAT 3496 7.299 101.348 80.048 1.00 0.00 H TER 63665 WAT 3496 ATOM 63665 O WAT 3497 61.220 65.149 132.667 1.00 0.00 O ATOM 63666 H1 WAT 3497 60.475 65.646 133.004 1.00 0.00 H ATOM 63667 H2 WAT 3497 61.206 64.330 133.163 1.00 0.00 H TER 63669 WAT 3497 ATOM 63669 O WAT 3498 14.282 64.876 69.593 1.00 0.00 O ATOM 63670 H1 WAT 3498 13.682 65.621 69.619 1.00 0.00 H ATOM 63671 H2 WAT 3498 13.731 64.117 69.787 1.00 0.00 H TER 63673 WAT 3498 ATOM 63673 O WAT 3499 14.967 140.722 112.353 1.00 0.00 O ATOM 63674 H1 WAT 3499 14.868 141.349 111.637 1.00 0.00 H ATOM 63675 H2 WAT 3499 15.884 140.803 112.617 1.00 0.00 H TER 63677 WAT 3499 ATOM 63677 O WAT 3500 104.520 26.020 124.339 1.00 0.00 O ATOM 63678 H1 WAT 3500 104.020 25.665 123.603 1.00 0.00 H ATOM 63679 H2 WAT 3500 104.134 26.881 124.498 1.00 0.00 H TER 63681 WAT 3500 ATOM 63681 O WAT 3501 137.896 32.742 19.804 1.00 0.00 O ATOM 63682 H1 WAT 3501 138.514 32.219 20.315 1.00 0.00 H ATOM 63683 H2 WAT 3501 137.892 32.331 18.939 1.00 0.00 H TER 63685 WAT 3501 ATOM 63685 O WAT 3502 35.695 42.276 24.829 1.00 0.00 O ATOM 63686 H1 WAT 3502 35.506 43.099 24.378 1.00 0.00 H ATOM 63687 H2 WAT 3502 36.081 41.717 24.155 1.00 0.00 H TER 63689 WAT 3502 ATOM 63689 O WAT 3503 34.872 100.383 13.311 1.00 0.00 O ATOM 63690 H1 WAT 3503 34.213 100.904 12.853 1.00 0.00 H ATOM 63691 H2 WAT 3503 34.557 99.482 13.241 1.00 0.00 H TER 63693 WAT 3503 ATOM 63693 O WAT 3504 110.159 36.518 123.194 1.00 0.00 O ATOM 63694 H1 WAT 3504 109.305 36.089 123.248 1.00 0.00 H ATOM 63695 H2 WAT 3504 110.544 36.396 124.062 1.00 0.00 H TER 63697 WAT 3504 ATOM 63697 O WAT 3505 109.033 57.941 137.003 1.00 0.00 O ATOM 63698 H1 WAT 3505 109.756 57.900 137.629 1.00 0.00 H ATOM 63699 H2 WAT 3505 108.864 57.027 136.773 1.00 0.00 H TER 63701 WAT 3505 ATOM 63701 O WAT 3506 131.578 41.461 85.203 1.00 0.00 O ATOM 63702 H1 WAT 3506 131.414 42.152 85.845 1.00 0.00 H ATOM 63703 H2 WAT 3506 131.455 41.888 84.355 1.00 0.00 H TER 63705 WAT 3506 ATOM 63705 O WAT 3507 99.065 24.704 67.006 1.00 0.00 O ATOM 63706 H1 WAT 3507 98.545 24.039 66.556 1.00 0.00 H ATOM 63707 H2 WAT 3507 98.580 25.519 66.873 1.00 0.00 H TER 63709 WAT 3507 ATOM 63709 O WAT 3508 49.514 36.492 100.995 1.00 0.00 O ATOM 63710 H1 WAT 3508 49.544 36.295 100.059 1.00 0.00 H ATOM 63711 H2 WAT 3508 50.370 36.219 101.325 1.00 0.00 H TER 63713 WAT 3508 ATOM 63713 O WAT 3509 29.736 88.936 102.745 1.00 0.00 O ATOM 63714 H1 WAT 3509 30.009 89.386 103.545 1.00 0.00 H ATOM 63715 H2 WAT 3509 30.337 89.257 102.073 1.00 0.00 H TER 63717 WAT 3509 ATOM 63717 O WAT 3510 139.771 133.807 0.790 1.00 0.00 O ATOM 63718 H1 WAT 3510 139.351 133.803 -0.070 1.00 0.00 H ATOM 63719 H2 WAT 3510 139.470 133.000 1.208 1.00 0.00 H TER 63721 WAT 3510 ATOM 63721 O WAT 3511 139.404 101.845 128.606 1.00 0.00 O ATOM 63722 H1 WAT 3511 139.729 100.974 128.376 1.00 0.00 H ATOM 63723 H2 WAT 3511 139.126 102.224 127.772 1.00 0.00 H TER 63725 WAT 3511 ATOM 63725 O WAT 3512 135.370 6.111 138.428 1.00 0.00 O ATOM 63726 H1 WAT 3512 136.186 6.274 137.956 1.00 0.00 H ATOM 63727 H2 WAT 3512 134.689 6.477 137.863 1.00 0.00 H TER 63729 WAT 3512 ATOM 63729 O WAT 3513 50.709 35.651 70.165 1.00 0.00 O ATOM 63730 H1 WAT 3513 50.584 36.525 70.533 1.00 0.00 H ATOM 63731 H2 WAT 3513 50.078 35.102 70.631 1.00 0.00 H TER 63733 WAT 3513 ATOM 63733 O WAT 3514 30.593 67.391 145.612 1.00 0.00 O ATOM 63734 H1 WAT 3514 31.416 67.878 145.655 1.00 0.00 H ATOM 63735 H2 WAT 3514 30.150 67.596 146.436 1.00 0.00 H TER 63737 WAT 3514 ATOM 63737 O WAT 3515 58.896 55.363 121.505 1.00 0.00 O ATOM 63738 H1 WAT 3515 59.040 55.481 120.566 1.00 0.00 H ATOM 63739 H2 WAT 3515 58.118 54.808 121.559 1.00 0.00 H TER 63741 WAT 3515 ATOM 63741 O WAT 3516 86.751 33.816 126.340 1.00 0.00 O ATOM 63742 H1 WAT 3516 86.521 34.650 126.750 1.00 0.00 H ATOM 63743 H2 WAT 3516 86.627 33.968 125.403 1.00 0.00 H TER 63745 WAT 3516 ATOM 63745 O WAT 3517 111.743 100.408 102.196 1.00 0.00 O ATOM 63746 H1 WAT 3517 111.156 100.621 101.470 1.00 0.00 H ATOM 63747 H2 WAT 3517 112.287 101.188 102.301 1.00 0.00 H TER 63749 WAT 3517 ATOM 63749 O WAT 3518 7.879 55.363 99.372 1.00 0.00 O ATOM 63750 H1 WAT 3518 8.407 55.517 100.155 1.00 0.00 H ATOM 63751 H2 WAT 3518 7.685 54.425 99.395 1.00 0.00 H TER 63753 WAT 3518 ATOM 63753 O WAT 3519 105.433 36.993 79.205 1.00 0.00 O ATOM 63754 H1 WAT 3519 105.290 37.629 78.504 1.00 0.00 H ATOM 63755 H2 WAT 3519 104.895 37.311 79.930 1.00 0.00 H TER 63757 WAT 3519 ATOM 63757 O WAT 3520 77.689 126.815 22.921 1.00 0.00 O ATOM 63758 H1 WAT 3520 77.462 126.731 23.847 1.00 0.00 H ATOM 63759 H2 WAT 3520 76.887 127.131 22.505 1.00 0.00 H TER 63761 WAT 3520 ATOM 63761 O WAT 3521 1.006 34.936 13.410 1.00 0.00 O ATOM 63762 H1 WAT 3521 0.468 35.595 13.848 1.00 0.00 H ATOM 63763 H2 WAT 3521 0.927 34.158 13.962 1.00 0.00 H TER 63765 WAT 3521 ATOM 63765 O WAT 3522 115.522 27.535 6.077 1.00 0.00 O ATOM 63766 H1 WAT 3522 116.012 28.204 5.600 1.00 0.00 H ATOM 63767 H2 WAT 3522 116.183 26.892 6.335 1.00 0.00 H TER 63769 WAT 3522 ATOM 63769 O WAT 3523 69.281 89.628 131.635 1.00 0.00 O ATOM 63770 H1 WAT 3523 70.047 90.145 131.387 1.00 0.00 H ATOM 63771 H2 WAT 3523 68.561 90.009 131.133 1.00 0.00 H TER 63773 WAT 3523 ATOM 63773 O WAT 3524 81.834 88.860 11.387 1.00 0.00 O ATOM 63774 H1 WAT 3524 82.265 88.290 10.749 1.00 0.00 H ATOM 63775 H2 WAT 3524 81.024 88.401 11.609 1.00 0.00 H TER 63777 WAT 3524 ATOM 63777 O WAT 3525 66.732 49.905 107.551 1.00 0.00 O ATOM 63778 H1 WAT 3525 66.344 50.780 107.586 1.00 0.00 H ATOM 63779 H2 WAT 3525 67.376 49.957 106.845 1.00 0.00 H TER 63781 WAT 3525 ATOM 63781 O WAT 3526 8.133 114.491 94.759 1.00 0.00 O ATOM 63782 H1 WAT 3526 7.350 114.625 94.224 1.00 0.00 H ATOM 63783 H2 WAT 3526 7.900 114.847 95.617 1.00 0.00 H TER 63785 WAT 3526 ATOM 63785 O WAT 3527 63.696 33.022 83.434 1.00 0.00 O ATOM 63786 H1 WAT 3527 64.248 33.784 83.255 1.00 0.00 H ATOM 63787 H2 WAT 3527 62.956 33.116 82.834 1.00 0.00 H TER 63789 WAT 3527 ATOM 63789 O WAT 3528 43.726 117.265 66.240 1.00 0.00 O ATOM 63790 H1 WAT 3528 44.222 117.828 66.834 1.00 0.00 H ATOM 63791 H2 WAT 3528 43.493 117.837 65.508 1.00 0.00 H TER 63793 WAT 3528 ATOM 63793 O WAT 3529 2.713 15.388 97.588 1.00 0.00 O ATOM 63794 H1 WAT 3529 2.672 16.253 97.179 1.00 0.00 H ATOM 63795 H2 WAT 3529 3.068 15.552 98.462 1.00 0.00 H TER 63797 WAT 3529 ATOM 63797 O WAT 3530 67.637 45.249 135.808 1.00 0.00 O ATOM 63798 H1 WAT 3530 67.019 44.703 136.294 1.00 0.00 H ATOM 63799 H2 WAT 3530 67.539 44.971 134.898 1.00 0.00 H TER 63801 WAT 3530 ATOM 63801 O WAT 3531 35.012 54.065 95.751 1.00 0.00 O ATOM 63802 H1 WAT 3531 35.255 54.922 95.400 1.00 0.00 H ATOM 63803 H2 WAT 3531 34.608 53.610 95.012 1.00 0.00 H TER 63805 WAT 3531 ATOM 63805 O WAT 3532 63.270 89.709 115.274 1.00 0.00 O ATOM 63806 H1 WAT 3532 63.636 88.857 115.036 1.00 0.00 H ATOM 63807 H2 WAT 3532 64.021 90.303 115.268 1.00 0.00 H TER 63809 WAT 3532 ATOM 63809 O WAT 3533 132.653 49.995 96.112 1.00 0.00 O ATOM 63810 H1 WAT 3533 132.267 49.887 95.243 1.00 0.00 H ATOM 63811 H2 WAT 3533 133.239 50.746 96.022 1.00 0.00 H TER 63813 WAT 3533 ATOM 63813 O WAT 3534 144.980 28.586 12.377 1.00 0.00 O ATOM 63814 H1 WAT 3534 144.461 29.129 11.784 1.00 0.00 H ATOM 63815 H2 WAT 3534 145.562 29.204 12.819 1.00 0.00 H TER 63817 WAT 3534 ATOM 63817 O WAT 3535 94.235 94.506 74.092 1.00 0.00 O ATOM 63818 H1 WAT 3535 93.790 93.942 73.460 1.00 0.00 H ATOM 63819 H2 WAT 3535 94.969 93.978 74.408 1.00 0.00 H TER 63821 WAT 3535 ATOM 63821 O WAT 3536 44.083 102.151 95.487 1.00 0.00 O ATOM 63822 H1 WAT 3536 43.610 102.980 95.411 1.00 0.00 H ATOM 63823 H2 WAT 3536 44.784 102.216 94.838 1.00 0.00 H TER 63825 WAT 3536 ATOM 63825 O WAT 3537 47.879 21.885 158.112 1.00 0.00 O ATOM 63826 H1 WAT 3537 48.372 22.335 157.426 1.00 0.00 H ATOM 63827 H2 WAT 3537 48.492 21.238 158.462 1.00 0.00 H TER 63829 WAT 3537 ATOM 63829 O WAT 3538 120.140 132.591 3.147 1.00 0.00 O ATOM 63830 H1 WAT 3538 120.747 133.070 3.711 1.00 0.00 H ATOM 63831 H2 WAT 3538 120.063 133.133 2.362 1.00 0.00 H TER 63833 WAT 3538 ATOM 63833 O WAT 3539 90.190 124.634 107.453 1.00 0.00 O ATOM 63834 H1 WAT 3539 90.917 124.457 106.856 1.00 0.00 H ATOM 63835 H2 WAT 3539 90.520 124.378 108.314 1.00 0.00 H TER 63837 WAT 3539 ATOM 63837 O WAT 3540 92.822 111.105 158.473 1.00 0.00 O ATOM 63838 H1 WAT 3540 92.079 111.698 158.357 1.00 0.00 H ATOM 63839 H2 WAT 3540 93.114 110.910 157.583 1.00 0.00 H TER 63841 WAT 3540 ATOM 63841 O WAT 3541 71.611 111.651 124.349 1.00 0.00 O ATOM 63842 H1 WAT 3541 71.302 110.922 124.887 1.00 0.00 H ATOM 63843 H2 WAT 3541 72.560 111.533 124.307 1.00 0.00 H TER 63845 WAT 3541 ATOM 63845 O WAT 3542 2.671 42.881 156.093 1.00 0.00 O ATOM 63846 H1 WAT 3542 1.795 42.513 156.209 1.00 0.00 H ATOM 63847 H2 WAT 3542 2.698 43.152 155.176 1.00 0.00 H TER 63849 WAT 3542 ATOM 63849 O WAT 3543 2.504 78.983 15.468 1.00 0.00 O ATOM 63850 H1 WAT 3543 1.824 78.310 15.466 1.00 0.00 H ATOM 63851 H2 WAT 3543 2.506 79.326 14.575 1.00 0.00 H TER 63853 WAT 3543 ATOM 63853 O WAT 3544 104.550 65.300 140.986 1.00 0.00 O ATOM 63854 H1 WAT 3544 105.474 65.548 141.005 1.00 0.00 H ATOM 63855 H2 WAT 3544 104.135 65.961 140.432 1.00 0.00 H TER 63857 WAT 3544 ATOM 63857 O WAT 3545 3.852 57.059 157.035 1.00 0.00 O ATOM 63858 H1 WAT 3545 3.924 56.532 156.240 1.00 0.00 H ATOM 63859 H2 WAT 3545 4.516 56.700 157.623 1.00 0.00 H TER 63861 WAT 3545 ATOM 63861 O WAT 3546 11.989 130.305 12.383 1.00 0.00 O ATOM 63862 H1 WAT 3546 11.487 129.534 12.121 1.00 0.00 H ATOM 63863 H2 WAT 3546 11.326 130.956 12.615 1.00 0.00 H TER 63865 WAT 3546 ATOM 63865 O WAT 3547 87.831 7.419 78.278 1.00 0.00 O ATOM 63866 H1 WAT 3547 88.390 6.905 77.695 1.00 0.00 H ATOM 63867 H2 WAT 3547 86.953 7.061 78.146 1.00 0.00 H TER 63869 WAT 3547 ATOM 63869 O WAT 3548 94.463 12.230 74.821 1.00 0.00 O ATOM 63870 H1 WAT 3548 94.320 13.177 74.798 1.00 0.00 H ATOM 63871 H2 WAT 3548 93.619 11.855 74.569 1.00 0.00 H TER 63873 WAT 3548 ATOM 63873 O WAT 3549 128.197 44.467 104.803 1.00 0.00 O ATOM 63874 H1 WAT 3549 128.559 44.528 103.919 1.00 0.00 H ATOM 63875 H2 WAT 3549 127.459 45.077 104.802 1.00 0.00 H TER 63877 WAT 3549 ATOM 63877 O WAT 3550 145.321 14.517 92.979 1.00 0.00 O ATOM 63878 H1 WAT 3550 144.456 14.279 92.647 1.00 0.00 H ATOM 63879 H2 WAT 3550 145.925 14.261 92.282 1.00 0.00 H TER 63881 WAT 3550 ATOM 63881 O WAT 3551 104.846 105.611 12.936 1.00 0.00 O ATOM 63882 H1 WAT 3551 105.741 105.716 13.258 1.00 0.00 H ATOM 63883 H2 WAT 3551 104.903 105.805 12.000 1.00 0.00 H TER 63885 WAT 3551 ATOM 63885 O WAT 3552 64.642 116.967 104.438 1.00 0.00 O ATOM 63886 H1 WAT 3552 63.875 117.516 104.599 1.00 0.00 H ATOM 63887 H2 WAT 3552 65.293 117.567 104.073 1.00 0.00 H TER 63889 WAT 3552 ATOM 63889 O WAT 3553 24.081 48.560 148.101 1.00 0.00 O ATOM 63890 H1 WAT 3553 23.614 49.113 147.474 1.00 0.00 H ATOM 63891 H2 WAT 3553 24.966 48.924 148.129 1.00 0.00 H TER 63893 WAT 3553 ATOM 63893 O WAT 3554 37.445 80.606 80.283 1.00 0.00 O ATOM 63894 H1 WAT 3554 38.251 80.686 80.793 1.00 0.00 H ATOM 63895 H2 WAT 3554 37.183 81.509 80.105 1.00 0.00 H TER 63897 WAT 3554 ATOM 63897 O WAT 3555 1.519 47.676 111.112 1.00 0.00 O ATOM 63898 H1 WAT 3555 1.016 48.162 110.458 1.00 0.00 H ATOM 63899 H2 WAT 3555 1.264 48.065 111.948 1.00 0.00 H TER 63901 WAT 3555 ATOM 63901 O WAT 3556 11.875 2.754 94.998 1.00 0.00 O ATOM 63902 H1 WAT 3556 12.196 2.344 94.195 1.00 0.00 H ATOM 63903 H2 WAT 3556 11.632 3.642 94.734 1.00 0.00 H TER 63905 WAT 3556 ATOM 63905 O WAT 3557 18.270 0.985 11.880 1.00 0.00 O ATOM 63906 H1 WAT 3557 18.653 1.272 11.051 1.00 0.00 H ATOM 63907 H2 WAT 3557 17.343 0.849 11.681 1.00 0.00 H TER 63909 WAT 3557 ATOM 63909 O WAT 3558 46.460 21.106 151.550 1.00 0.00 O ATOM 63910 H1 WAT 3558 45.922 21.864 151.323 1.00 0.00 H ATOM 63911 H2 WAT 3558 47.312 21.477 151.779 1.00 0.00 H TER 63913 WAT 3558 ATOM 63913 O WAT 3559 47.549 91.127 121.435 1.00 0.00 O ATOM 63914 H1 WAT 3559 48.060 90.835 122.190 1.00 0.00 H ATOM 63915 H2 WAT 3559 46.796 90.537 121.413 1.00 0.00 H TER 63917 WAT 3559 ATOM 63917 O WAT 3560 61.341 97.483 147.383 1.00 0.00 O ATOM 63918 H1 WAT 3560 61.876 97.135 148.096 1.00 0.00 H ATOM 63919 H2 WAT 3560 60.440 97.302 147.649 1.00 0.00 H TER 63921 WAT 3560 ATOM 63921 O WAT 3561 118.658 52.275 76.878 1.00 0.00 O ATOM 63922 H1 WAT 3561 119.040 52.240 77.755 1.00 0.00 H ATOM 63923 H2 WAT 3561 118.147 53.085 76.871 1.00 0.00 H TER 63925 WAT 3561 ATOM 63925 O WAT 3562 32.101 42.091 28.033 1.00 0.00 O ATOM 63926 H1 WAT 3562 32.054 42.876 28.578 1.00 0.00 H ATOM 63927 H2 WAT 3562 31.228 41.703 28.097 1.00 0.00 H TER 63929 WAT 3562 ATOM 63929 O WAT 3563 8.706 105.022 72.352 1.00 0.00 O ATOM 63930 H1 WAT 3563 8.647 105.484 73.188 1.00 0.00 H ATOM 63931 H2 WAT 3563 7.872 104.560 72.274 1.00 0.00 H TER 63933 WAT 3563 ATOM 63933 O WAT 3564 133.865 77.135 158.473 1.00 0.00 O ATOM 63934 H1 WAT 3564 133.787 76.391 157.876 1.00 0.00 H ATOM 63935 H2 WAT 3564 134.426 76.816 159.180 1.00 0.00 H TER 63937 WAT 3564 ATOM 63937 O WAT 3565 110.195 6.376 156.338 1.00 0.00 O ATOM 63938 H1 WAT 3565 109.553 7.057 156.538 1.00 0.00 H ATOM 63939 H2 WAT 3565 110.948 6.852 155.988 1.00 0.00 H TER 63941 WAT 3565 ATOM 63941 O WAT 3566 73.598 21.046 135.293 1.00 0.00 O ATOM 63942 H1 WAT 3566 73.930 20.158 135.426 1.00 0.00 H ATOM 63943 H2 WAT 3566 74.201 21.604 135.784 1.00 0.00 H TER 63945 WAT 3566 ATOM 63945 O WAT 3567 92.276 136.550 107.740 1.00 0.00 O ATOM 63946 H1 WAT 3567 92.188 136.433 106.795 1.00 0.00 H ATOM 63947 H2 WAT 3567 91.396 136.400 108.084 1.00 0.00 H TER 63949 WAT 3567 ATOM 63949 O WAT 3568 55.501 78.561 157.457 1.00 0.00 O ATOM 63950 H1 WAT 3568 56.210 77.919 157.424 1.00 0.00 H ATOM 63951 H2 WAT 3568 55.412 78.772 158.387 1.00 0.00 H TER 63953 WAT 3568 ATOM 63953 O WAT 3569 71.099 33.606 134.043 1.00 0.00 O ATOM 63954 H1 WAT 3569 70.938 33.354 133.133 1.00 0.00 H ATOM 63955 H2 WAT 3569 71.170 32.775 134.512 1.00 0.00 H TER 63957 WAT 3569 ATOM 63957 O WAT 3570 74.136 22.992 12.732 1.00 0.00 O ATOM 63958 H1 WAT 3570 73.680 23.832 12.790 1.00 0.00 H ATOM 63959 H2 WAT 3570 73.512 22.410 12.298 1.00 0.00 H TER 63961 WAT 3570 ATOM 63961 O WAT 3571 67.705 107.718 114.703 1.00 0.00 O ATOM 63962 H1 WAT 3571 68.662 107.691 114.719 1.00 0.00 H ATOM 63963 H2 WAT 3571 67.441 107.332 115.538 1.00 0.00 H TER 63965 WAT 3571 ATOM 63965 O WAT 3572 28.668 145.892 151.378 1.00 0.00 O ATOM 63966 H1 WAT 3572 28.351 146.127 150.506 1.00 0.00 H ATOM 63967 H2 WAT 3572 28.382 144.986 151.501 1.00 0.00 H TER 63969 WAT 3572 ATOM 63969 O WAT 3573 80.740 13.210 10.462 1.00 0.00 O ATOM 63970 H1 WAT 3573 79.946 13.616 10.114 1.00 0.00 H ATOM 63971 H2 WAT 3573 80.422 12.556 11.084 1.00 0.00 H TER 63973 WAT 3573 ATOM 63973 O WAT 3574 47.877 34.852 65.011 1.00 0.00 O ATOM 63974 H1 WAT 3574 48.008 35.800 65.002 1.00 0.00 H ATOM 63975 H2 WAT 3574 48.519 34.527 65.643 1.00 0.00 H TER 63977 WAT 3574 ATOM 63977 O WAT 3575 67.640 67.359 122.777 1.00 0.00 O ATOM 63978 H1 WAT 3575 67.910 67.726 121.935 1.00 0.00 H ATOM 63979 H2 WAT 3575 66.727 67.104 122.645 1.00 0.00 H TER 63981 WAT 3575 ATOM 63981 O WAT 3576 11.385 24.179 133.955 1.00 0.00 O ATOM 63982 H1 WAT 3576 11.506 25.000 133.478 1.00 0.00 H ATOM 63983 H2 WAT 3576 12.265 23.809 134.024 1.00 0.00 H TER 63985 WAT 3576 ATOM 63985 O WAT 3577 48.654 70.894 149.181 1.00 0.00 O ATOM 63986 H1 WAT 3577 48.303 70.017 149.341 1.00 0.00 H ATOM 63987 H2 WAT 3577 48.457 71.067 148.261 1.00 0.00 H TER 63989 WAT 3577 ATOM 63989 O WAT 3578 80.206 31.462 103.016 1.00 0.00 O ATOM 63990 H1 WAT 3578 80.489 31.639 103.913 1.00 0.00 H ATOM 63991 H2 WAT 3578 79.255 31.375 103.078 1.00 0.00 H TER 63993 WAT 3578 ATOM 63993 O WAT 3579 60.266 141.927 156.619 1.00 0.00 O ATOM 63994 H1 WAT 3579 60.927 141.395 157.063 1.00 0.00 H ATOM 63995 H2 WAT 3579 60.745 142.365 155.915 1.00 0.00 H TER 63997 WAT 3579 ATOM 63997 O WAT 3580 25.988 3.165 121.038 1.00 0.00 O ATOM 63998 H1 WAT 3580 25.914 2.284 121.406 1.00 0.00 H ATOM 63999 H2 WAT 3580 26.688 3.578 121.544 1.00 0.00 H TER 64001 WAT 3580 ATOM 64001 O WAT 3581 37.109 35.651 95.930 1.00 0.00 O ATOM 64002 H1 WAT 3581 38.009 35.978 95.920 1.00 0.00 H ATOM 64003 H2 WAT 3581 37.201 34.699 95.983 1.00 0.00 H TER 64005 WAT 3581 ATOM 64005 O WAT 3582 19.925 96.648 144.277 1.00 0.00 O ATOM 64006 H1 WAT 3582 19.071 96.958 143.978 1.00 0.00 H ATOM 64007 H2 WAT 3582 20.495 96.743 143.513 1.00 0.00 H TER 64009 WAT 3582 ATOM 64009 O WAT 3583 106.521 64.281 63.654 1.00 0.00 O ATOM 64010 H1 WAT 3583 107.293 64.406 63.102 1.00 0.00 H ATOM 64011 H2 WAT 3583 105.976 65.049 63.481 1.00 0.00 H TER 64013 WAT 3583 ATOM 64013 O WAT 3584 77.453 69.801 13.639 1.00 0.00 O ATOM 64014 H1 WAT 3584 77.594 68.997 13.138 1.00 0.00 H ATOM 64015 H2 WAT 3584 76.523 69.780 13.867 1.00 0.00 H TER 64017 WAT 3584 ATOM 64017 O WAT 3585 135.009 87.981 106.484 1.00 0.00 O ATOM 64018 H1 WAT 3585 134.128 87.896 106.848 1.00 0.00 H ATOM 64019 H2 WAT 3585 135.288 88.862 106.733 1.00 0.00 H TER 64021 WAT 3585 ATOM 64021 O WAT 3586 10.294 144.324 4.536 1.00 0.00 O ATOM 64022 H1 WAT 3586 10.129 144.696 5.403 1.00 0.00 H ATOM 64023 H2 WAT 3586 10.318 143.378 4.682 1.00 0.00 H TER 64025 WAT 3586 ATOM 64025 O WAT 3587 71.615 53.570 77.707 1.00 0.00 O ATOM 64026 H1 WAT 3587 71.428 53.327 76.800 1.00 0.00 H ATOM 64027 H2 WAT 3587 71.691 54.524 77.688 1.00 0.00 H TER 64029 WAT 3587 ATOM 64029 O WAT 3588 139.042 62.591 133.360 1.00 0.00 O ATOM 64030 H1 WAT 3588 138.786 63.503 133.226 1.00 0.00 H ATOM 64031 H2 WAT 3588 138.895 62.174 132.511 1.00 0.00 H TER 64033 WAT 3588 ATOM 64033 O WAT 3589 64.256 79.251 75.753 1.00 0.00 O ATOM 64034 H1 WAT 3589 63.345 79.204 75.464 1.00 0.00 H ATOM 64035 H2 WAT 3589 64.412 78.415 76.192 1.00 0.00 H TER 64037 WAT 3589 ATOM 64037 O WAT 3590 22.058 106.027 70.656 1.00 0.00 O ATOM 64038 H1 WAT 3590 21.278 105.680 70.224 1.00 0.00 H ATOM 64039 H2 WAT 3590 22.747 105.395 70.451 1.00 0.00 H TER 64041 WAT 3590 ATOM 64041 O WAT 3591 73.255 117.034 97.327 1.00 0.00 O ATOM 64042 H1 WAT 3591 73.040 116.282 96.775 1.00 0.00 H ATOM 64043 H2 WAT 3591 72.516 117.108 97.930 1.00 0.00 H TER 64045 WAT 3591 ATOM 64045 O WAT 3592 75.357 46.263 143.271 1.00 0.00 O ATOM 64046 H1 WAT 3592 75.762 46.945 142.735 1.00 0.00 H ATOM 64047 H2 WAT 3592 76.060 45.959 143.845 1.00 0.00 H TER 64049 WAT 3592 ATOM 64049 O WAT 3593 25.922 32.457 22.938 1.00 0.00 O ATOM 64050 H1 WAT 3593 26.138 33.318 23.294 1.00 0.00 H ATOM 64051 H2 WAT 3593 25.711 31.926 23.705 1.00 0.00 H TER 64053 WAT 3593 ATOM 64053 O WAT 3594 41.366 0.949 145.495 1.00 0.00 O ATOM 64054 H1 WAT 3594 40.747 0.237 145.659 1.00 0.00 H ATOM 64055 H2 WAT 3594 41.202 1.575 146.201 1.00 0.00 H TER 64057 WAT 3594 ATOM 64057 O WAT 3595 99.610 102.831 128.845 1.00 0.00 O ATOM 64058 H1 WAT 3595 99.763 101.979 128.436 1.00 0.00 H ATOM 64059 H2 WAT 3595 99.609 102.648 129.785 1.00 0.00 H TER 64061 WAT 3595 ATOM 64061 O WAT 3596 118.332 63.090 135.229 1.00 0.00 O ATOM 64062 H1 WAT 3596 117.405 63.052 134.994 1.00 0.00 H ATOM 64063 H2 WAT 3596 118.777 63.304 134.409 1.00 0.00 H TER 64065 WAT 3596 ATOM 64065 O WAT 3597 107.501 31.212 119.800 1.00 0.00 O ATOM 64066 H1 WAT 3597 108.169 31.662 119.283 1.00 0.00 H ATOM 64067 H2 WAT 3597 106.986 30.726 119.156 1.00 0.00 H TER 64069 WAT 3597 ATOM 64069 O WAT 3598 33.779 83.070 130.554 1.00 0.00 O ATOM 64070 H1 WAT 3598 34.512 83.404 130.037 1.00 0.00 H ATOM 64071 H2 WAT 3598 33.047 83.645 130.332 1.00 0.00 H TER 64073 WAT 3598 ATOM 64073 O WAT 3599 52.825 73.307 99.196 1.00 0.00 O ATOM 64074 H1 WAT 3599 52.805 74.260 99.112 1.00 0.00 H ATOM 64075 H2 WAT 3599 53.533 73.136 99.816 1.00 0.00 H TER 64077 WAT 3599 ATOM 64077 O WAT 3600 37.376 30.428 122.679 1.00 0.00 O ATOM 64078 H1 WAT 3600 36.882 31.059 122.156 1.00 0.00 H ATOM 64079 H2 WAT 3600 37.939 29.981 122.046 1.00 0.00 H TER 64081 WAT 3600 ATOM 64081 O WAT 3601 118.833 142.593 148.779 1.00 0.00 O ATOM 64082 H1 WAT 3601 119.790 142.600 148.765 1.00 0.00 H ATOM 64083 H2 WAT 3601 118.595 141.727 148.445 1.00 0.00 H TER 64085 WAT 3601 ATOM 64085 O WAT 3602 96.870 76.155 16.964 1.00 0.00 O ATOM 64086 H1 WAT 3602 96.583 76.368 16.076 1.00 0.00 H ATOM 64087 H2 WAT 3602 97.662 75.631 16.840 1.00 0.00 H TER 64089 WAT 3602 ATOM 64089 O WAT 3603 9.664 99.079 147.210 1.00 0.00 O ATOM 64090 H1 WAT 3603 9.610 98.437 146.502 1.00 0.00 H ATOM 64091 H2 WAT 3603 10.119 99.826 146.821 1.00 0.00 H TER 64093 WAT 3603 ATOM 64093 O WAT 3604 99.404 36.294 86.059 1.00 0.00 O ATOM 64094 H1 WAT 3604 99.048 37.045 85.584 1.00 0.00 H ATOM 64095 H2 WAT 3604 100.336 36.294 85.841 1.00 0.00 H TER 64097 WAT 3604 ATOM 64097 O WAT 3605 66.521 0.376 86.229 1.00 0.00 O ATOM 64098 H1 WAT 3605 66.762 0.416 87.155 1.00 0.00 H ATOM 64099 H2 WAT 3605 67.141 0.961 85.795 1.00 0.00 H TER 64101 WAT 3605 ATOM 64101 O WAT 3606 121.155 112.328 136.533 1.00 0.00 O ATOM 64102 H1 WAT 3606 121.713 113.083 136.721 1.00 0.00 H ATOM 64103 H2 WAT 3606 120.288 112.704 136.378 1.00 0.00 H TER 64105 WAT 3606 ATOM 64105 O WAT 3607 21.444 143.892 92.797 1.00 0.00 O ATOM 64106 H1 WAT 3607 20.971 143.119 93.105 1.00 0.00 H ATOM 64107 H2 WAT 3607 22.256 143.545 92.428 1.00 0.00 H TER 64109 WAT 3607 ATOM 64109 O WAT 3608 116.626 27.771 148.536 1.00 0.00 O ATOM 64110 H1 WAT 3608 115.949 28.073 147.930 1.00 0.00 H ATOM 64111 H2 WAT 3608 116.565 26.816 148.506 1.00 0.00 H TER 64113 WAT 3608 ATOM 64113 O WAT 3609 67.476 83.165 72.885 1.00 0.00 O ATOM 64114 H1 WAT 3609 67.306 82.343 73.346 1.00 0.00 H ATOM 64115 H2 WAT 3609 67.877 82.897 72.058 1.00 0.00 H TER 64117 WAT 3609 ATOM 64117 O WAT 3610 78.045 133.394 105.028 1.00 0.00 O ATOM 64118 H1 WAT 3610 77.518 133.148 104.268 1.00 0.00 H ATOM 64119 H2 WAT 3610 78.768 133.905 104.664 1.00 0.00 H TER 64121 WAT 3610 ATOM 64121 O WAT 3611 126.243 96.677 89.012 1.00 0.00 O ATOM 64122 H1 WAT 3611 127.132 97.005 88.878 1.00 0.00 H ATOM 64123 H2 WAT 3611 125.984 96.329 88.159 1.00 0.00 H TER 64125 WAT 3611 ATOM 64125 O WAT 3612 138.451 29.755 98.821 1.00 0.00 O ATOM 64126 H1 WAT 3612 137.779 29.296 98.318 1.00 0.00 H ATOM 64127 H2 WAT 3612 138.714 29.129 99.496 1.00 0.00 H TER 64129 WAT 3612 ATOM 64129 O WAT 3613 142.976 91.865 115.570 1.00 0.00 O ATOM 64130 H1 WAT 3613 143.722 92.297 115.154 1.00 0.00 H ATOM 64131 H2 WAT 3613 142.793 91.110 115.010 1.00 0.00 H TER 64133 WAT 3613 ATOM 64133 O WAT 3614 17.366 95.906 116.782 1.00 0.00 O ATOM 64134 H1 WAT 3614 17.823 96.181 115.987 1.00 0.00 H ATOM 64135 H2 WAT 3614 16.982 95.058 116.555 1.00 0.00 H TER 64137 WAT 3614 ATOM 64137 O WAT 3615 105.596 29.284 133.341 1.00 0.00 O ATOM 64138 H1 WAT 3615 105.024 29.786 133.921 1.00 0.00 H ATOM 64139 H2 WAT 3615 105.359 29.574 132.460 1.00 0.00 H TER 64141 WAT 3615 ATOM 64141 O WAT 3616 56.517 85.748 14.478 1.00 0.00 O ATOM 64142 H1 WAT 3616 55.568 85.864 14.430 1.00 0.00 H ATOM 64143 H2 WAT 3616 56.876 86.604 14.243 1.00 0.00 H TER 64145 WAT 3616 ATOM 64145 O WAT 3617 77.126 75.245 16.113 1.00 0.00 O ATOM 64146 H1 WAT 3617 78.039 75.441 16.323 1.00 0.00 H ATOM 64147 H2 WAT 3617 76.740 76.095 15.902 1.00 0.00 H TER 64149 WAT 3617 ATOM 64149 O WAT 3618 4.207 38.151 15.285 1.00 0.00 O ATOM 64150 H1 WAT 3618 4.226 37.326 15.770 1.00 0.00 H ATOM 64151 H2 WAT 3618 4.862 38.699 15.718 1.00 0.00 H TER 64153 WAT 3618 ATOM 64153 O WAT 3619 43.350 90.323 108.081 1.00 0.00 O ATOM 64154 H1 WAT 3619 43.080 89.839 108.862 1.00 0.00 H ATOM 64155 H2 WAT 3619 43.890 89.703 107.590 1.00 0.00 H TER 64157 WAT 3619 ATOM 64157 O WAT 3620 112.046 41.910 101.566 1.00 0.00 O ATOM 64158 H1 WAT 3620 111.850 42.347 102.394 1.00 0.00 H ATOM 64159 H2 WAT 3620 111.300 41.328 101.420 1.00 0.00 H TER 64161 WAT 3620 ATOM 64161 O WAT 3621 84.031 28.762 79.804 1.00 0.00 O ATOM 64162 H1 WAT 3621 84.711 29.260 80.257 1.00 0.00 H ATOM 64163 H2 WAT 3621 83.583 28.280 80.500 1.00 0.00 H TER 64165 WAT 3621 ATOM 64165 O WAT 3622 18.054 90.366 142.273 1.00 0.00 O ATOM 64166 H1 WAT 3622 17.632 90.536 141.431 1.00 0.00 H ATOM 64167 H2 WAT 3622 17.911 89.433 142.429 1.00 0.00 H TER 64169 WAT 3622 ATOM 64169 O WAT 3623 65.656 124.040 12.160 1.00 0.00 O ATOM 64170 H1 WAT 3623 65.745 123.776 11.244 1.00 0.00 H ATOM 64171 H2 WAT 3623 65.857 124.976 12.160 1.00 0.00 H TER 64173 WAT 3623 ATOM 64173 O WAT 3624 129.491 1.960 133.203 1.00 0.00 O ATOM 64174 H1 WAT 3624 128.940 2.651 133.570 1.00 0.00 H ATOM 64175 H2 WAT 3624 130.140 2.426 132.676 1.00 0.00 H TER 64177 WAT 3624 ATOM 64177 O WAT 3625 123.877 26.538 84.429 1.00 0.00 O ATOM 64178 H1 WAT 3625 123.744 26.076 85.256 1.00 0.00 H ATOM 64179 H2 WAT 3625 122.996 26.647 84.070 1.00 0.00 H TER 64181 WAT 3625 ATOM 64181 O WAT 3626 47.935 39.035 156.887 1.00 0.00 O ATOM 64182 H1 WAT 3626 47.576 39.554 156.167 1.00 0.00 H ATOM 64183 H2 WAT 3626 47.244 38.409 157.099 1.00 0.00 H TER 64185 WAT 3626 ATOM 64185 O WAT 3627 48.259 0.912 4.479 1.00 0.00 O ATOM 64186 H1 WAT 3627 47.708 0.296 4.962 1.00 0.00 H ATOM 64187 H2 WAT 3627 48.610 0.400 3.751 1.00 0.00 H TER 64189 WAT 3627 ATOM 64189 O WAT 3628 43.582 126.087 84.307 1.00 0.00 O ATOM 64190 H1 WAT 3628 43.492 126.950 83.902 1.00 0.00 H ATOM 64191 H2 WAT 3628 42.936 126.087 85.014 1.00 0.00 H TER 64193 WAT 3628 ATOM 64193 O WAT 3629 144.480 121.677 14.065 1.00 0.00 O ATOM 64194 H1 WAT 3629 143.925 121.139 14.629 1.00 0.00 H ATOM 64195 H2 WAT 3629 144.993 122.210 14.673 1.00 0.00 H TER 64197 WAT 3629 ATOM 64197 O WAT 3630 123.390 41.861 72.598 1.00 0.00 O ATOM 64198 H1 WAT 3630 123.389 42.233 73.480 1.00 0.00 H ATOM 64199 H2 WAT 3630 123.021 42.551 72.046 1.00 0.00 H TER 64201 WAT 3630 ATOM 64201 O WAT 3631 97.845 113.051 77.558 1.00 0.00 O ATOM 64202 H1 WAT 3631 98.583 112.946 78.158 1.00 0.00 H ATOM 64203 H2 WAT 3631 97.372 112.221 77.611 1.00 0.00 H TER 64205 WAT 3631 ATOM 64205 O WAT 3632 81.709 25.113 110.496 1.00 0.00 O ATOM 64206 H1 WAT 3632 82.560 24.844 110.151 1.00 0.00 H ATOM 64207 H2 WAT 3632 81.917 25.618 111.282 1.00 0.00 H TER 64209 WAT 3632 ATOM 64209 O WAT 3633 36.745 66.335 8.647 1.00 0.00 O ATOM 64210 H1 WAT 3633 36.966 67.180 9.039 1.00 0.00 H ATOM 64211 H2 WAT 3633 35.802 66.246 8.784 1.00 0.00 H TER 64213 WAT 3633 ATOM 64213 O WAT 3634 89.404 101.326 65.026 1.00 0.00 O ATOM 64214 H1 WAT 3634 89.311 102.116 64.493 1.00 0.00 H ATOM 64215 H2 WAT 3634 89.493 100.617 64.389 1.00 0.00 H TER 64217 WAT 3634 ATOM 64217 O WAT 3635 54.826 14.127 69.601 1.00 0.00 O ATOM 64218 H1 WAT 3635 55.540 13.814 69.045 1.00 0.00 H ATOM 64219 H2 WAT 3635 54.031 13.915 69.112 1.00 0.00 H TER 64221 WAT 3635 ATOM 64221 O WAT 3636 81.127 33.115 152.172 1.00 0.00 O ATOM 64222 H1 WAT 3636 81.787 33.192 151.482 1.00 0.00 H ATOM 64223 H2 WAT 3636 80.651 33.944 152.141 1.00 0.00 H TER 64225 WAT 3636 ATOM 64225 O WAT 3637 91.574 55.435 10.046 1.00 0.00 O ATOM 64226 H1 WAT 3637 92.392 55.368 10.538 1.00 0.00 H ATOM 64227 H2 WAT 3637 91.799 55.962 9.279 1.00 0.00 H TER 64229 WAT 3637 ATOM 64229 O WAT 3638 119.814 107.876 151.992 1.00 0.00 O ATOM 64230 H1 WAT 3638 119.323 107.054 151.968 1.00 0.00 H ATOM 64231 H2 WAT 3638 120.375 107.796 152.764 1.00 0.00 H TER 64233 WAT 3638 ATOM 64233 O WAT 3639 25.813 36.196 111.005 1.00 0.00 O ATOM 64234 H1 WAT 3639 25.092 35.620 110.750 1.00 0.00 H ATOM 64235 H2 WAT 3639 25.431 36.787 111.653 1.00 0.00 H TER 64237 WAT 3639 ATOM 64237 O WAT 3640 11.884 35.501 98.985 1.00 0.00 O ATOM 64238 H1 WAT 3640 11.453 35.686 99.820 1.00 0.00 H ATOM 64239 H2 WAT 3640 12.488 36.233 98.861 1.00 0.00 H TER 64241 WAT 3640 ATOM 64241 O WAT 3641 2.099 69.076 89.788 1.00 0.00 O ATOM 64242 H1 WAT 3641 1.942 69.513 88.951 1.00 0.00 H ATOM 64243 H2 WAT 3641 2.955 69.397 90.069 1.00 0.00 H TER 64245 WAT 3641 ATOM 64245 O WAT 3642 77.544 132.381 60.754 1.00 0.00 O ATOM 64246 H1 WAT 3642 77.163 131.852 60.054 1.00 0.00 H ATOM 64247 H2 WAT 3642 78.422 132.597 60.440 1.00 0.00 H TER 64249 WAT 3642 ATOM 64249 O WAT 3643 93.211 139.767 12.849 1.00 0.00 O ATOM 64250 H1 WAT 3643 92.953 139.714 11.928 1.00 0.00 H ATOM 64251 H2 WAT 3643 92.963 138.918 13.216 1.00 0.00 H TER 64253 WAT 3643 ATOM 64253 O WAT 3644 141.420 133.916 19.405 1.00 0.00 O ATOM 64254 H1 WAT 3644 141.722 133.010 19.463 1.00 0.00 H ATOM 64255 H2 WAT 3644 140.465 133.851 19.431 1.00 0.00 H TER 64257 WAT 3644 ATOM 64257 O WAT 3645 55.448 87.573 104.992 1.00 0.00 O ATOM 64258 H1 WAT 3645 55.215 87.013 104.251 1.00 0.00 H ATOM 64259 H2 WAT 3645 54.704 88.167 105.086 1.00 0.00 H TER 64261 WAT 3645 ATOM 64261 O WAT 3646 53.914 37.348 10.832 1.00 0.00 O ATOM 64262 H1 WAT 3646 53.051 37.484 10.440 1.00 0.00 H ATOM 64263 H2 WAT 3646 54.503 37.892 10.309 1.00 0.00 H TER 64265 WAT 3646 ATOM 64265 O WAT 3647 49.220 100.584 87.216 1.00 0.00 O ATOM 64266 H1 WAT 3647 49.857 100.378 86.532 1.00 0.00 H ATOM 64267 H2 WAT 3647 49.552 100.137 87.995 1.00 0.00 H TER 64269 WAT 3647 ATOM 64269 O WAT 3648 132.454 85.427 129.384 1.00 0.00 O ATOM 64270 H1 WAT 3648 131.613 85.384 128.930 1.00 0.00 H ATOM 64271 H2 WAT 3648 132.893 84.608 129.155 1.00 0.00 H TER 64273 WAT 3648 ATOM 64273 O WAT 3649 99.974 52.159 118.981 1.00 0.00 O ATOM 64274 H1 WAT 3649 99.671 51.532 118.324 1.00 0.00 H ATOM 64275 H2 WAT 3649 100.187 52.946 118.480 1.00 0.00 H TER 64277 WAT 3649 ATOM 64277 O WAT 3650 132.655 47.909 142.276 1.00 0.00 O ATOM 64278 H1 WAT 3650 133.210 47.536 141.590 1.00 0.00 H ATOM 64279 H2 WAT 3650 132.122 47.174 142.579 1.00 0.00 H TER 64281 WAT 3650 ATOM 64281 O WAT 3651 100.888 39.706 121.305 1.00 0.00 O ATOM 64282 H1 WAT 3651 101.711 39.392 120.932 1.00 0.00 H ATOM 64283 H2 WAT 3651 100.278 39.717 120.567 1.00 0.00 H TER 64285 WAT 3651 ATOM 64285 O WAT 3652 15.119 127.152 55.000 1.00 0.00 O ATOM 64286 H1 WAT 3652 14.374 127.656 55.329 1.00 0.00 H ATOM 64287 H2 WAT 3652 15.163 126.387 55.574 1.00 0.00 H TER 64289 WAT 3652 ATOM 64289 O WAT 3653 116.113 16.174 119.100 1.00 0.00 O ATOM 64290 H1 WAT 3653 116.657 15.809 119.798 1.00 0.00 H ATOM 64291 H2 WAT 3653 116.043 17.105 119.312 1.00 0.00 H TER 64293 WAT 3653 ATOM 64293 O WAT 3654 125.369 61.608 68.294 1.00 0.00 O ATOM 64294 H1 WAT 3654 124.674 62.013 67.776 1.00 0.00 H ATOM 64295 H2 WAT 3654 125.388 62.112 69.107 1.00 0.00 H TER 64297 WAT 3654 ATOM 64297 O WAT 3655 119.466 39.615 9.068 1.00 0.00 O ATOM 64298 H1 WAT 3655 120.262 39.707 9.592 1.00 0.00 H ATOM 64299 H2 WAT 3655 119.444 38.688 8.828 1.00 0.00 H TER 64301 WAT 3655 ATOM 64301 O WAT 3656 141.700 132.807 124.078 1.00 0.00 O ATOM 64302 H1 WAT 3656 141.472 133.346 123.321 1.00 0.00 H ATOM 64303 H2 WAT 3656 142.475 133.228 124.448 1.00 0.00 H TER 64305 WAT 3656 ATOM 64305 O WAT 3657 96.868 8.405 76.584 1.00 0.00 O ATOM 64306 H1 WAT 3657 96.152 7.789 76.430 1.00 0.00 H ATOM 64307 H2 WAT 3657 97.159 8.216 77.476 1.00 0.00 H TER 64309 WAT 3657 ATOM 64309 O WAT 3658 80.427 79.445 130.989 1.00 0.00 O ATOM 64310 H1 WAT 3658 80.821 79.846 131.764 1.00 0.00 H ATOM 64311 H2 WAT 3658 79.485 79.488 131.149 1.00 0.00 H TER 64313 WAT 3658 ATOM 64313 O WAT 3659 8.616 91.782 72.386 1.00 0.00 O ATOM 64314 H1 WAT 3659 9.038 92.474 71.876 1.00 0.00 H ATOM 64315 H2 WAT 3659 9.128 91.734 73.194 1.00 0.00 H TER 64317 WAT 3659 ATOM 64317 O WAT 3660 143.805 22.286 87.084 1.00 0.00 O ATOM 64318 H1 WAT 3660 143.277 22.925 86.605 1.00 0.00 H ATOM 64319 H2 WAT 3660 144.375 21.900 86.418 1.00 0.00 H TER 64321 WAT 3660 ATOM 64321 O WAT 3661 100.455 27.804 147.672 1.00 0.00 O ATOM 64322 H1 WAT 3661 100.295 28.185 146.808 1.00 0.00 H ATOM 64323 H2 WAT 3661 101.148 27.161 147.526 1.00 0.00 H TER 64325 WAT 3661 ATOM 64325 O WAT 3662 47.707 73.052 80.946 1.00 0.00 O ATOM 64326 H1 WAT 3662 47.684 72.761 81.858 1.00 0.00 H ATOM 64327 H2 WAT 3662 47.483 72.272 80.440 1.00 0.00 H TER 64329 WAT 3662 ATOM 64329 O WAT 3663 130.050 32.790 75.532 1.00 0.00 O ATOM 64330 H1 WAT 3663 129.480 32.836 76.300 1.00 0.00 H ATOM 64331 H2 WAT 3663 130.937 32.807 75.891 1.00 0.00 H TER 64333 WAT 3663 ATOM 64333 O WAT 3664 135.722 37.839 91.392 1.00 0.00 O ATOM 64334 H1 WAT 3664 136.506 37.986 90.862 1.00 0.00 H ATOM 64335 H2 WAT 3664 135.091 38.482 91.069 1.00 0.00 H TER 64337 WAT 3664 ATOM 64337 O WAT 3665 90.072 106.901 91.440 1.00 0.00 O ATOM 64338 H1 WAT 3665 89.754 107.658 91.932 1.00 0.00 H ATOM 64339 H2 WAT 3665 90.429 106.314 92.106 1.00 0.00 H TER 64341 WAT 3665 ATOM 64341 O WAT 3666 4.212 81.605 141.281 1.00 0.00 O ATOM 64342 H1 WAT 3666 3.676 81.092 140.678 1.00 0.00 H ATOM 64343 H2 WAT 3666 4.243 81.080 142.081 1.00 0.00 H TER 64345 WAT 3666 ATOM 64345 O WAT 3667 139.019 61.140 156.705 1.00 0.00 O ATOM 64346 H1 WAT 3667 138.136 60.935 156.398 1.00 0.00 H ATOM 64347 H2 WAT 3667 139.542 61.205 155.906 1.00 0.00 H TER 64349 WAT 3667 ATOM 64349 O WAT 3668 22.100 139.439 113.149 1.00 0.00 O ATOM 64350 H1 WAT 3668 22.353 139.363 112.229 1.00 0.00 H ATOM 64351 H2 WAT 3668 22.003 138.534 113.447 1.00 0.00 H TER 64353 WAT 3668 ATOM 64353 O WAT 3669 11.823 145.249 9.042 1.00 0.00 O ATOM 64354 H1 WAT 3669 11.966 145.879 9.748 1.00 0.00 H ATOM 64355 H2 WAT 3669 11.193 145.678 8.462 1.00 0.00 H TER 64357 WAT 3669 ATOM 64357 O WAT 3670 20.581 88.136 66.542 1.00 0.00 O ATOM 64358 H1 WAT 3670 21.189 87.661 67.109 1.00 0.00 H ATOM 64359 H2 WAT 3670 21.137 88.520 65.864 1.00 0.00 H TER 64361 WAT 3670 ATOM 64361 O WAT 3671 9.576 45.214 99.753 1.00 0.00 O ATOM 64362 H1 WAT 3671 10.080 45.353 98.952 1.00 0.00 H ATOM 64363 H2 WAT 3671 9.516 44.262 99.837 1.00 0.00 H TER 64365 WAT 3671 ATOM 64365 O WAT 3672 144.547 89.903 70.853 1.00 0.00 O ATOM 64366 H1 WAT 3672 143.657 89.825 70.511 1.00 0.00 H ATOM 64367 H2 WAT 3672 144.620 90.817 71.127 1.00 0.00 H TER 64369 WAT 3672 ATOM 64369 O WAT 3673 135.992 55.633 72.738 1.00 0.00 O ATOM 64370 H1 WAT 3673 136.766 55.147 73.024 1.00 0.00 H ATOM 64371 H2 WAT 3673 135.294 55.334 73.320 1.00 0.00 H TER 64373 WAT 3673 ATOM 64373 O WAT 3674 50.874 133.290 78.097 1.00 0.00 O ATOM 64374 H1 WAT 3674 50.245 134.005 78.191 1.00 0.00 H ATOM 64375 H2 WAT 3674 51.454 133.380 78.853 1.00 0.00 H TER 64377 WAT 3674 ATOM 64377 O WAT 3675 135.128 16.327 145.406 1.00 0.00 O ATOM 64378 H1 WAT 3675 134.917 17.076 145.963 1.00 0.00 H ATOM 64379 H2 WAT 3675 134.278 15.953 145.175 1.00 0.00 H TER 64381 WAT 3675 ATOM 64381 O WAT 3676 136.033 144.183 125.299 1.00 0.00 O ATOM 64382 H1 WAT 3676 136.358 143.835 126.130 1.00 0.00 H ATOM 64383 H2 WAT 3676 136.472 145.028 125.205 1.00 0.00 H TER 64385 WAT 3676 ATOM 64385 O WAT 3677 2.984 56.714 16.472 1.00 0.00 O ATOM 64386 H1 WAT 3677 3.126 56.077 17.172 1.00 0.00 H ATOM 64387 H2 WAT 3677 3.796 56.699 15.966 1.00 0.00 H TER 64389 WAT 3677 ATOM 64389 O WAT 3678 75.975 0.283 141.414 1.00 0.00 O ATOM 64390 H1 WAT 3678 75.811 1.222 141.501 1.00 0.00 H ATOM 64391 H2 WAT 3678 75.294 -0.130 141.944 1.00 0.00 H TER 64393 WAT 3678 ATOM 64393 O WAT 3679 104.699 50.731 133.219 1.00 0.00 O ATOM 64394 H1 WAT 3679 104.182 50.778 132.415 1.00 0.00 H ATOM 64395 H2 WAT 3679 104.250 51.317 133.828 1.00 0.00 H TER 64397 WAT 3679 ATOM 64397 O WAT 3680 76.409 83.435 24.789 1.00 0.00 O ATOM 64398 H1 WAT 3680 75.466 83.577 24.878 1.00 0.00 H ATOM 64399 H2 WAT 3680 76.689 84.084 24.144 1.00 0.00 H TER 64401 WAT 3680 ATOM 64401 O WAT 3681 121.711 49.288 126.803 1.00 0.00 O ATOM 64402 H1 WAT 3681 121.981 49.233 125.887 1.00 0.00 H ATOM 64403 H2 WAT 3681 121.921 48.428 127.167 1.00 0.00 H TER 64405 WAT 3681 ATOM 64405 O WAT 3682 33.599 46.309 125.815 1.00 0.00 O ATOM 64406 H1 WAT 3682 32.862 46.763 126.222 1.00 0.00 H ATOM 64407 H2 WAT 3682 33.284 46.074 124.942 1.00 0.00 H TER 64409 WAT 3682 ATOM 64409 O WAT 3683 2.731 98.327 100.005 1.00 0.00 O ATOM 64410 H1 WAT 3683 2.839 99.271 99.887 1.00 0.00 H ATOM 64411 H2 WAT 3683 2.908 98.180 100.934 1.00 0.00 H TER 64413 WAT 3683 ATOM 64413 O WAT 3684 119.016 68.893 93.716 1.00 0.00 O ATOM 64414 H1 WAT 3684 118.271 69.432 93.451 1.00 0.00 H ATOM 64415 H2 WAT 3684 118.673 68.337 94.416 1.00 0.00 H TER 64417 WAT 3684 ATOM 64417 O WAT 3685 120.238 15.261 94.737 1.00 0.00 O ATOM 64418 H1 WAT 3685 121.165 15.126 94.538 1.00 0.00 H ATOM 64419 H2 WAT 3685 120.229 15.996 95.350 1.00 0.00 H TER 64421 WAT 3685 ATOM 64421 O WAT 3686 94.463 120.863 3.138 1.00 0.00 O ATOM 64422 H1 WAT 3686 94.293 120.008 2.743 1.00 0.00 H ATOM 64423 H2 WAT 3686 93.602 121.173 3.418 1.00 0.00 H TER 64425 WAT 3686 ATOM 64425 O WAT 3687 124.977 117.815 71.257 1.00 0.00 O ATOM 64426 H1 WAT 3687 124.253 117.700 70.642 1.00 0.00 H ATOM 64427 H2 WAT 3687 124.598 117.616 72.114 1.00 0.00 H TER 64429 WAT 3687 ATOM 64429 O WAT 3688 114.464 7.880 143.222 1.00 0.00 O ATOM 64430 H1 WAT 3688 114.774 8.709 142.857 1.00 0.00 H ATOM 64431 H2 WAT 3688 115.026 7.727 143.981 1.00 0.00 H TER 64433 WAT 3688 ATOM 64433 O WAT 3689 33.349 64.529 106.483 1.00 0.00 O ATOM 64434 H1 WAT 3689 33.454 65.461 106.289 1.00 0.00 H ATOM 64435 H2 WAT 3689 33.702 64.084 105.712 1.00 0.00 H TER 64437 WAT 3689 ATOM 64437 O WAT 3690 16.942 103.708 103.091 1.00 0.00 O ATOM 64438 H1 WAT 3690 16.234 103.708 103.735 1.00 0.00 H ATOM 64439 H2 WAT 3690 17.393 102.875 103.231 1.00 0.00 H TER 64441 WAT 3690 ATOM 64441 O WAT 3691 123.692 60.534 100.237 1.00 0.00 O ATOM 64442 H1 WAT 3691 123.465 60.163 99.384 1.00 0.00 H ATOM 64443 H2 WAT 3691 122.862 60.567 100.712 1.00 0.00 H TER 64445 WAT 3691 ATOM 64445 O WAT 3692 136.951 141.364 136.326 1.00 0.00 O ATOM 64446 H1 WAT 3692 137.426 142.065 136.773 1.00 0.00 H ATOM 64447 H2 WAT 3692 137.215 141.443 135.409 1.00 0.00 H TER 64449 WAT 3692 ATOM 64449 O WAT 3693 93.866 105.490 29.471 1.00 0.00 O ATOM 64450 H1 WAT 3693 93.920 106.240 28.878 1.00 0.00 H ATOM 64451 H2 WAT 3693 94.777 105.276 29.670 1.00 0.00 H TER 64453 WAT 3693 ATOM 64453 O WAT 3694 2.156 114.307 86.168 1.00 0.00 O ATOM 64454 H1 WAT 3694 2.099 113.631 85.493 1.00 0.00 H ATOM 64455 H2 WAT 3694 2.153 115.132 85.681 1.00 0.00 H TER 64457 WAT 3694 ATOM 64457 O WAT 3695 49.104 13.204 122.905 1.00 0.00 O ATOM 64458 H1 WAT 3695 48.724 12.502 122.377 1.00 0.00 H ATOM 64459 H2 WAT 3695 49.354 12.778 123.725 1.00 0.00 H TER 64461 WAT 3695 ATOM 64461 O WAT 3696 136.819 99.744 149.137 1.00 0.00 O ATOM 64462 H1 WAT 3696 135.947 99.370 149.268 1.00 0.00 H ATOM 64463 H2 WAT 3696 136.715 100.672 149.346 1.00 0.00 H TER 64465 WAT 3696 ATOM 64465 O WAT 3697 89.430 121.626 2.683 1.00 0.00 O ATOM 64466 H1 WAT 3697 88.618 121.825 3.150 1.00 0.00 H ATOM 64467 H2 WAT 3697 89.419 120.675 2.578 1.00 0.00 H TER 64469 WAT 3697 ATOM 64469 O WAT 3698 130.911 99.734 119.623 1.00 0.00 O ATOM 64470 H1 WAT 3698 131.820 99.539 119.398 1.00 0.00 H ATOM 64471 H2 WAT 3698 130.469 99.824 118.778 1.00 0.00 H TER 64473 WAT 3698 ATOM 64473 O WAT 3699 33.362 118.257 57.199 1.00 0.00 O ATOM 64474 H1 WAT 3699 32.818 117.769 57.817 1.00 0.00 H ATOM 64475 H2 WAT 3699 33.854 117.584 56.730 1.00 0.00 H TER 64477 WAT 3699 ATOM 64477 O WAT 3700 106.357 36.377 9.015 1.00 0.00 O ATOM 64478 H1 WAT 3700 105.719 36.851 9.549 1.00 0.00 H ATOM 64479 H2 WAT 3700 106.054 36.499 8.115 1.00 0.00 H TER 64481 WAT 3700 ATOM 64481 O WAT 3701 10.789 120.511 141.889 1.00 0.00 O ATOM 64482 H1 WAT 3701 11.163 121.375 142.061 1.00 0.00 H ATOM 64483 H2 WAT 3701 9.972 120.692 141.424 1.00 0.00 H TER 64485 WAT 3701 ATOM 64485 O WAT 3702 55.562 72.590 78.318 1.00 0.00 O ATOM 64486 H1 WAT 3702 55.155 73.276 77.789 1.00 0.00 H ATOM 64487 H2 WAT 3702 55.075 71.796 78.096 1.00 0.00 H TER 64489 WAT 3702 ATOM 64489 O WAT 3703 33.095 79.238 117.896 1.00 0.00 O ATOM 64490 H1 WAT 3703 33.233 79.999 118.460 1.00 0.00 H ATOM 64491 H2 WAT 3703 33.016 79.604 117.015 1.00 0.00 H TER 64493 WAT 3703 ATOM 64493 O WAT 3704 100.939 42.962 75.244 1.00 0.00 O ATOM 64494 H1 WAT 3704 100.604 43.299 74.413 1.00 0.00 H ATOM 64495 H2 WAT 3704 101.538 43.641 75.554 1.00 0.00 H TER 64497 WAT 3704 ATOM 64497 O WAT 3705 127.656 28.945 118.900 1.00 0.00 O ATOM 64498 H1 WAT 3705 128.443 28.871 119.439 1.00 0.00 H ATOM 64499 H2 WAT 3705 127.126 29.610 119.339 1.00 0.00 H TER 64501 WAT 3705 ATOM 64501 O WAT 3706 106.808 43.297 74.734 1.00 0.00 O ATOM 64502 H1 WAT 3706 106.973 43.410 73.798 1.00 0.00 H ATOM 64503 H2 WAT 3706 106.034 42.735 74.775 1.00 0.00 H TER 64505 WAT 3706 ATOM 64505 O WAT 3707 120.580 103.286 135.712 1.00 0.00 O ATOM 64506 H1 WAT 3707 120.937 102.727 136.402 1.00 0.00 H ATOM 64507 H2 WAT 3707 121.194 103.189 134.984 1.00 0.00 H TER 64509 WAT 3707 ATOM 64509 O WAT 3708 100.203 87.749 126.400 1.00 0.00 O ATOM 64510 H1 WAT 3708 100.605 87.096 125.827 1.00 0.00 H ATOM 64511 H2 WAT 3708 100.374 87.429 127.285 1.00 0.00 H TER 64513 WAT 3708 ATOM 64513 O WAT 3709 106.234 55.401 150.100 1.00 0.00 O ATOM 64514 H1 WAT 3709 106.354 55.528 149.159 1.00 0.00 H ATOM 64515 H2 WAT 3709 106.347 56.274 150.476 1.00 0.00 H TER 64517 WAT 3709 ATOM 64517 O WAT 3710 1.278 38.461 114.866 1.00 0.00 O ATOM 64518 H1 WAT 3710 1.753 37.673 115.130 1.00 0.00 H ATOM 64519 H2 WAT 3710 0.802 38.729 115.652 1.00 0.00 H TER 64521 WAT 3710 ATOM 64521 O WAT 3711 76.994 113.289 143.897 1.00 0.00 O ATOM 64522 H1 WAT 3711 76.384 113.184 144.627 1.00 0.00 H ATOM 64523 H2 WAT 3711 76.966 114.224 143.694 1.00 0.00 H TER 64525 WAT 3711 ATOM 64525 O WAT 3712 45.418 115.066 103.847 1.00 0.00 O ATOM 64526 H1 WAT 3712 45.325 114.170 104.172 1.00 0.00 H ATOM 64527 H2 WAT 3712 45.501 115.600 104.637 1.00 0.00 H TER 64529 WAT 3712 ATOM 64529 O WAT 3713 42.396 98.358 151.889 1.00 0.00 O ATOM 64530 H1 WAT 3713 42.386 98.036 152.791 1.00 0.00 H ATOM 64531 H2 WAT 3713 41.946 97.678 151.387 1.00 0.00 H TER 64533 WAT 3713 ATOM 64533 O WAT 3714 89.473 55.245 144.449 1.00 0.00 O ATOM 64534 H1 WAT 3714 88.928 55.919 144.854 1.00 0.00 H ATOM 64535 H2 WAT 3714 88.936 54.898 143.737 1.00 0.00 H TER 64537 WAT 3714 ATOM 64537 O WAT 3715 26.550 134.415 7.723 1.00 0.00 O ATOM 64538 H1 WAT 3715 25.706 133.966 7.773 1.00 0.00 H ATOM 64539 H2 WAT 3715 26.906 134.161 6.871 1.00 0.00 H TER 64541 WAT 3715 ATOM 64541 O WAT 3716 116.108 115.316 78.124 1.00 0.00 O ATOM 64542 H1 WAT 3716 115.567 114.578 77.846 1.00 0.00 H ATOM 64543 H2 WAT 3716 115.481 116.003 78.349 1.00 0.00 H TER 64545 WAT 3716 ATOM 64545 O WAT 3717 99.362 11.762 16.824 1.00 0.00 O ATOM 64546 H1 WAT 3717 98.594 12.278 17.070 1.00 0.00 H ATOM 64547 H2 WAT 3717 100.103 12.243 17.193 1.00 0.00 H TER 64549 WAT 3717 ATOM 64549 O WAT 3718 83.590 121.139 140.877 1.00 0.00 O ATOM 64550 H1 WAT 3718 83.633 120.241 141.205 1.00 0.00 H ATOM 64551 H2 WAT 3718 84.104 121.123 140.069 1.00 0.00 H TER 64553 WAT 3718 ATOM 64553 O WAT 3719 28.081 36.025 101.799 1.00 0.00 O ATOM 64554 H1 WAT 3719 29.011 36.013 102.024 1.00 0.00 H ATOM 64555 H2 WAT 3719 28.039 35.622 100.932 1.00 0.00 H TER 64557 WAT 3719 ATOM 64557 O WAT 3720 56.500 11.417 84.351 1.00 0.00 O ATOM 64558 H1 WAT 3720 55.730 11.033 84.771 1.00 0.00 H ATOM 64559 H2 WAT 3720 56.922 11.925 85.044 1.00 0.00 H TER 64561 WAT 3720 ATOM 64561 O WAT 3721 28.541 26.004 127.761 1.00 0.00 O ATOM 64562 H1 WAT 3721 28.673 26.804 128.270 1.00 0.00 H ATOM 64563 H2 WAT 3721 28.700 25.295 128.384 1.00 0.00 H TER 64565 WAT 3721 ATOM 64565 O WAT 3722 11.686 9.817 129.237 1.00 0.00 O ATOM 64566 H1 WAT 3722 12.099 8.965 129.381 1.00 0.00 H ATOM 64567 H2 WAT 3722 11.029 9.653 128.561 1.00 0.00 H TER 64569 WAT 3722 ATOM 64569 O WAT 3723 125.845 79.851 151.058 1.00 0.00 O ATOM 64570 H1 WAT 3723 125.636 78.963 150.765 1.00 0.00 H ATOM 64571 H2 WAT 3723 126.595 80.109 150.522 1.00 0.00 H TER 64573 WAT 3723 ATOM 64573 O WAT 3724 128.026 24.219 20.544 1.00 0.00 O ATOM 64574 H1 WAT 3724 128.259 24.978 20.009 1.00 0.00 H ATOM 64575 H2 WAT 3724 128.622 24.261 21.291 1.00 0.00 H TER 64577 WAT 3724 ATOM 64577 O WAT 3725 62.040 34.533 7.981 1.00 0.00 O ATOM 64578 H1 WAT 3725 61.400 33.867 7.729 1.00 0.00 H ATOM 64579 H2 WAT 3725 62.315 34.927 7.153 1.00 0.00 H TER 64581 WAT 3725 ATOM 64581 O WAT 3726 50.514 143.813 89.203 1.00 0.00 O ATOM 64582 H1 WAT 3726 50.607 144.147 90.096 1.00 0.00 H ATOM 64583 H2 WAT 3726 51.378 143.465 88.986 1.00 0.00 H TER 64585 WAT 3726 ATOM 64585 O WAT 3727 69.028 36.490 84.658 1.00 0.00 O ATOM 64586 H1 WAT 3727 68.376 35.884 84.307 1.00 0.00 H ATOM 64587 H2 WAT 3727 68.890 37.301 84.169 1.00 0.00 H TER 64589 WAT 3727 ATOM 64589 O WAT 3728 20.172 110.197 79.340 1.00 0.00 O ATOM 64590 H1 WAT 3728 20.692 109.536 79.798 1.00 0.00 H ATOM 64591 H2 WAT 3728 19.343 109.758 79.147 1.00 0.00 H TER 64593 WAT 3728 ATOM 64593 O WAT 3729 61.554 106.452 100.373 1.00 0.00 O ATOM 64594 H1 WAT 3729 61.008 107.195 100.116 1.00 0.00 H ATOM 64595 H2 WAT 3729 61.983 106.179 99.562 1.00 0.00 H TER 64597 WAT 3729 ATOM 64597 O WAT 3730 139.201 117.241 27.997 1.00 0.00 O ATOM 64598 H1 WAT 3730 139.950 117.805 27.804 1.00 0.00 H ATOM 64599 H2 WAT 3730 138.516 117.541 27.399 1.00 0.00 H TER 64601 WAT 3730 ATOM 64601 O WAT 3731 82.789 81.086 137.400 1.00 0.00 O ATOM 64602 H1 WAT 3731 83.006 80.289 137.884 1.00 0.00 H ATOM 64603 H2 WAT 3731 83.595 81.603 137.417 1.00 0.00 H TER 64605 WAT 3731 ATOM 64605 O WAT 3732 57.690 42.006 13.474 1.00 0.00 O ATOM 64606 H1 WAT 3732 56.796 42.248 13.715 1.00 0.00 H ATOM 64607 H2 WAT 3732 58.233 42.708 13.833 1.00 0.00 H TER 64609 WAT 3732 ATOM 64609 O WAT 3733 144.473 86.565 104.450 1.00 0.00 O ATOM 64610 H1 WAT 3733 144.332 86.223 103.568 1.00 0.00 H ATOM 64611 H2 WAT 3733 143.623 86.478 104.880 1.00 0.00 H TER 64613 WAT 3733 ATOM 64613 O WAT 3734 108.602 36.847 59.731 1.00 0.00 O ATOM 64614 H1 WAT 3734 107.668 36.751 59.914 1.00 0.00 H ATOM 64615 H2 WAT 3734 108.759 36.273 58.982 1.00 0.00 H TER 64617 WAT 3734 ATOM 64617 O WAT 3735 95.315 21.139 116.810 1.00 0.00 O ATOM 64618 H1 WAT 3735 95.759 20.366 116.461 1.00 0.00 H ATOM 64619 H2 WAT 3735 94.500 21.193 116.312 1.00 0.00 H TER 64621 WAT 3735 ATOM 64621 O WAT 3736 84.025 98.872 71.819 1.00 0.00 O ATOM 64622 H1 WAT 3736 84.524 98.877 72.636 1.00 0.00 H ATOM 64623 H2 WAT 3736 83.592 99.725 71.797 1.00 0.00 H TER 64625 WAT 3736 ATOM 64625 O WAT 3737 108.967 48.373 12.587 1.00 0.00 O ATOM 64626 H1 WAT 3737 109.363 48.681 11.772 1.00 0.00 H ATOM 64627 H2 WAT 3737 108.408 49.097 12.870 1.00 0.00 H TER 64629 WAT 3737 ATOM 64629 O WAT 3738 128.701 94.351 60.793 1.00 0.00 O ATOM 64630 H1 WAT 3738 129.058 95.045 60.239 1.00 0.00 H ATOM 64631 H2 WAT 3738 129.397 94.165 61.423 1.00 0.00 H TER 64633 WAT 3738 ATOM 64633 O WAT 3739 38.606 103.237 66.599 1.00 0.00 O ATOM 64634 H1 WAT 3739 38.656 103.242 67.554 1.00 0.00 H ATOM 64635 H2 WAT 3739 37.896 102.627 66.399 1.00 0.00 H TER 64637 WAT 3739 ATOM 64637 O WAT 3740 86.633 96.646 20.570 1.00 0.00 O ATOM 64638 H1 WAT 3740 85.995 97.354 20.654 1.00 0.00 H ATOM 64639 H2 WAT 3740 87.356 96.905 21.142 1.00 0.00 H TER 64641 WAT 3740 ATOM 64641 O WAT 3741 144.132 27.046 129.190 1.00 0.00 O ATOM 64642 H1 WAT 3741 143.187 26.900 129.161 1.00 0.00 H ATOM 64643 H2 WAT 3741 144.278 27.505 130.017 1.00 0.00 H TER 64645 WAT 3741 ATOM 64645 O WAT 3742 80.214 80.280 88.963 1.00 0.00 O ATOM 64646 H1 WAT 3742 80.360 79.538 89.550 1.00 0.00 H ATOM 64647 H2 WAT 3742 80.701 80.058 88.170 1.00 0.00 H TER 64649 WAT 3742 ATOM 64649 O WAT 3743 113.843 11.455 98.443 1.00 0.00 O ATOM 64650 H1 WAT 3743 114.586 10.995 98.052 1.00 0.00 H ATOM 64651 H2 WAT 3743 113.073 11.005 98.095 1.00 0.00 H TER 64653 WAT 3743 ATOM 64653 O WAT 3744 58.376 142.952 143.975 1.00 0.00 O ATOM 64654 H1 WAT 3744 58.287 143.391 143.129 1.00 0.00 H ATOM 64655 H2 WAT 3744 59.263 143.169 144.264 1.00 0.00 H TER 64657 WAT 3744 ATOM 64657 O WAT 3745 28.369 40.912 70.971 1.00 0.00 O ATOM 64658 H1 WAT 3745 29.139 40.522 70.557 1.00 0.00 H ATOM 64659 H2 WAT 3745 28.449 40.677 71.896 1.00 0.00 H TER 64661 WAT 3745 ATOM 64661 O WAT 3746 107.633 81.287 94.185 1.00 0.00 O ATOM 64662 H1 WAT 3746 106.890 80.709 94.009 1.00 0.00 H ATOM 64663 H2 WAT 3746 108.228 80.756 94.715 1.00 0.00 H TER 64665 WAT 3746 ATOM 64665 O WAT 3747 104.513 101.622 62.241 1.00 0.00 O ATOM 64666 H1 WAT 3747 104.705 100.720 62.495 1.00 0.00 H ATOM 64667 H2 WAT 3747 103.607 101.761 62.518 1.00 0.00 H TER 64669 WAT 3747 ATOM 64669 O WAT 3748 75.111 115.230 64.226 1.00 0.00 O ATOM 64670 H1 WAT 3748 74.544 115.033 64.972 1.00 0.00 H ATOM 64671 H2 WAT 3748 74.676 114.818 63.480 1.00 0.00 H TER 64673 WAT 3748 ATOM 64673 O WAT 3749 51.708 123.200 82.842 1.00 0.00 O ATOM 64674 H1 WAT 3749 51.065 123.852 82.563 1.00 0.00 H ATOM 64675 H2 WAT 3749 52.196 123.630 83.544 1.00 0.00 H TER 64677 WAT 3749 ATOM 64677 O WAT 3750 11.544 81.287 2.298 1.00 0.00 O ATOM 64678 H1 WAT 3750 11.182 81.650 1.490 1.00 0.00 H ATOM 64679 H2 WAT 3750 10.786 80.930 2.761 1.00 0.00 H TER 64681 WAT 3750 ATOM 64681 O WAT 3751 91.005 100.369 88.059 1.00 0.00 O ATOM 64682 H1 WAT 3751 91.848 100.283 87.615 1.00 0.00 H ATOM 64683 H2 WAT 3751 90.409 100.691 87.382 1.00 0.00 H TER 64685 WAT 3751 ATOM 64685 O WAT 3752 98.803 45.777 67.955 1.00 0.00 O ATOM 64686 H1 WAT 3752 98.740 44.944 67.488 1.00 0.00 H ATOM 64687 H2 WAT 3752 97.894 46.027 68.123 1.00 0.00 H TER 64689 WAT 3752 ATOM 64689 O WAT 3753 113.725 143.702 122.381 1.00 0.00 O ATOM 64690 H1 WAT 3753 114.431 143.162 122.738 1.00 0.00 H ATOM 64691 H2 WAT 3753 114.060 144.007 121.538 1.00 0.00 H TER 64693 WAT 3753 ATOM 64693 O WAT 3754 60.675 71.206 114.375 1.00 0.00 O ATOM 64694 H1 WAT 3754 60.499 71.970 114.926 1.00 0.00 H ATOM 64695 H2 WAT 3754 61.318 71.515 113.737 1.00 0.00 H TER 64697 WAT 3754 ATOM 64697 O WAT 3755 44.581 59.486 0.267 1.00 0.00 O ATOM 64698 H1 WAT 3755 44.939 60.205 -0.252 1.00 0.00 H ATOM 64699 H2 WAT 3755 44.194 59.912 1.032 1.00 0.00 H TER 64701 WAT 3755 ATOM 64701 O WAT 3756 137.920 144.642 77.905 1.00 0.00 O ATOM 64702 H1 WAT 3756 136.972 144.731 78.005 1.00 0.00 H ATOM 64703 H2 WAT 3756 138.257 144.660 78.801 1.00 0.00 H TER 64705 WAT 3756 ATOM 64705 O WAT 3757 91.913 27.864 133.553 1.00 0.00 O ATOM 64706 H1 WAT 3757 90.976 27.713 133.677 1.00 0.00 H ATOM 64707 H2 WAT 3757 92.335 27.121 133.984 1.00 0.00 H TER 64709 WAT 3757 ATOM 64709 O WAT 3758 129.136 110.935 16.803 1.00 0.00 O ATOM 64710 H1 WAT 3758 129.485 110.044 16.813 1.00 0.00 H ATOM 64711 H2 WAT 3758 129.783 111.440 16.312 1.00 0.00 H TER 64713 WAT 3758 ATOM 64713 O WAT 3759 100.486 40.877 151.931 1.00 0.00 O ATOM 64714 H1 WAT 3759 99.614 41.270 151.975 1.00 0.00 H ATOM 64715 H2 WAT 3759 100.434 40.262 151.199 1.00 0.00 H TER 64717 WAT 3759 ATOM 64717 O WAT 3760 128.084 127.528 77.214 1.00 0.00 O ATOM 64718 H1 WAT 3760 128.106 127.942 76.351 1.00 0.00 H ATOM 64719 H2 WAT 3760 127.328 126.943 77.180 1.00 0.00 H TER 64721 WAT 3760 ATOM 64721 O WAT 3761 8.975 27.466 126.214 1.00 0.00 O ATOM 64722 H1 WAT 3761 8.456 26.674 126.074 1.00 0.00 H ATOM 64723 H2 WAT 3761 9.495 27.276 126.994 1.00 0.00 H TER 64725 WAT 3761 ATOM 64725 O WAT 3762 137.146 83.416 100.707 1.00 0.00 O ATOM 64726 H1 WAT 3762 137.257 82.908 101.511 1.00 0.00 H ATOM 64727 H2 WAT 3762 136.243 83.731 100.745 1.00 0.00 H TER 64729 WAT 3762 ATOM 64729 O WAT 3763 66.785 37.029 122.020 1.00 0.00 O ATOM 64730 H1 WAT 3763 66.906 37.910 122.375 1.00 0.00 H ATOM 64731 H2 WAT 3763 67.661 36.758 121.747 1.00 0.00 H TER 64733 WAT 3763 ATOM 64733 O WAT 3764 35.027 96.139 13.003 1.00 0.00 O ATOM 64734 H1 WAT 3764 35.881 96.513 12.785 1.00 0.00 H ATOM 64735 H2 WAT 3764 35.197 95.583 13.763 1.00 0.00 H TER 64737 WAT 3764 ATOM 64737 O WAT 3765 69.634 139.910 118.643 1.00 0.00 O ATOM 64738 H1 WAT 3765 69.826 138.977 118.740 1.00 0.00 H ATOM 64739 H2 WAT 3765 69.479 140.218 119.536 1.00 0.00 H TER 64741 WAT 3765 ATOM 64741 O WAT 3766 111.020 129.422 94.444 1.00 0.00 O ATOM 64742 H1 WAT 3766 111.211 130.305 94.128 1.00 0.00 H ATOM 64743 H2 WAT 3766 111.464 129.370 95.291 1.00 0.00 H TER 64745 WAT 3766 ATOM 64745 O WAT 3767 46.332 92.696 63.441 1.00 0.00 O ATOM 64746 H1 WAT 3767 45.728 93.427 63.572 1.00 0.00 H ATOM 64747 H2 WAT 3767 46.400 92.610 62.490 1.00 0.00 H TER 64749 WAT 3767 ATOM 64749 O WAT 3768 72.728 109.235 144.109 1.00 0.00 O ATOM 64750 H1 WAT 3768 73.492 109.807 144.031 1.00 0.00 H ATOM 64751 H2 WAT 3768 72.639 109.082 145.049 1.00 0.00 H TER 64753 WAT 3768 ATOM 64753 O WAT 3769 129.179 114.176 150.667 1.00 0.00 O ATOM 64754 H1 WAT 3769 129.269 113.509 149.987 1.00 0.00 H ATOM 64755 H2 WAT 3769 128.408 114.680 150.408 1.00 0.00 H TER 64757 WAT 3769 ATOM 64757 O WAT 3770 100.132 53.786 76.621 1.00 0.00 O ATOM 64758 H1 WAT 3770 100.753 53.813 75.892 1.00 0.00 H ATOM 64759 H2 WAT 3770 99.401 54.333 76.332 1.00 0.00 H TER 64761 WAT 3770 ATOM 64761 O WAT 3771 110.231 39.390 75.434 1.00 0.00 O ATOM 64762 H1 WAT 3771 110.125 40.042 74.742 1.00 0.00 H ATOM 64763 H2 WAT 3771 110.690 39.855 76.134 1.00 0.00 H TER 64765 WAT 3771 ATOM 64765 O WAT 3772 18.033 37.661 103.185 1.00 0.00 O ATOM 64766 H1 WAT 3772 17.843 37.128 103.957 1.00 0.00 H ATOM 64767 H2 WAT 3772 17.377 38.357 103.207 1.00 0.00 H TER 64769 WAT 3772 ATOM 64769 O WAT 3773 142.955 68.214 134.323 1.00 0.00 O ATOM 64770 H1 WAT 3773 142.623 67.591 134.969 1.00 0.00 H ATOM 64771 H2 WAT 3773 143.144 69.005 134.828 1.00 0.00 H TER 64773 WAT 3773 ATOM 64773 O WAT 3774 96.553 23.644 121.950 1.00 0.00 O ATOM 64774 H1 WAT 3774 97.227 22.965 121.992 1.00 0.00 H ATOM 64775 H2 WAT 3774 96.848 24.232 121.255 1.00 0.00 H TER 64777 WAT 3774 ATOM 64777 O WAT 3775 76.271 36.575 107.668 1.00 0.00 O ATOM 64778 H1 WAT 3775 75.647 37.299 107.626 1.00 0.00 H ATOM 64779 H2 WAT 3775 75.960 35.952 107.011 1.00 0.00 H TER 64781 WAT 3775 ATOM 64781 O WAT 3776 73.349 34.668 2.062 1.00 0.00 O ATOM 64782 H1 WAT 3776 73.888 34.191 2.694 1.00 0.00 H ATOM 64783 H2 WAT 3776 72.464 34.330 2.200 1.00 0.00 H TER 64785 WAT 3776 ATOM 64785 O WAT 3777 138.253 62.866 71.376 1.00 0.00 O ATOM 64786 H1 WAT 3777 138.045 61.986 71.060 1.00 0.00 H ATOM 64787 H2 WAT 3777 138.793 62.720 72.153 1.00 0.00 H TER 64789 WAT 3777 ATOM 64789 O WAT 3778 75.131 30.256 93.352 1.00 0.00 O ATOM 64790 H1 WAT 3778 74.761 31.122 93.523 1.00 0.00 H ATOM 64791 H2 WAT 3778 75.275 30.240 92.406 1.00 0.00 H TER 64793 WAT 3778 ATOM 64793 O WAT 3779 97.400 107.975 111.880 1.00 0.00 O ATOM 64794 H1 WAT 3779 96.564 107.511 111.834 1.00 0.00 H ATOM 64795 H2 WAT 3779 97.389 108.404 112.736 1.00 0.00 H TER 64797 WAT 3779 ATOM 64797 O WAT 3780 76.474 57.007 153.328 1.00 0.00 O ATOM 64798 H1 WAT 3780 75.656 56.914 152.839 1.00 0.00 H ATOM 64799 H2 WAT 3780 76.492 56.247 153.910 1.00 0.00 H TER 64801 WAT 3780 ATOM 64801 O WAT 3781 32.790 118.260 104.236 1.00 0.00 O ATOM 64802 H1 WAT 3781 31.977 117.775 104.377 1.00 0.00 H ATOM 64803 H2 WAT 3781 32.522 119.041 103.751 1.00 0.00 H TER 64805 WAT 3781 ATOM 64805 O WAT 3782 78.070 95.105 27.078 1.00 0.00 O ATOM 64806 H1 WAT 3782 78.953 94.736 27.111 1.00 0.00 H ATOM 64807 H2 WAT 3782 77.556 94.549 27.664 1.00 0.00 H TER 64809 WAT 3782 ATOM 64809 O WAT 3783 32.973 96.133 85.697 1.00 0.00 O ATOM 64810 H1 WAT 3783 33.423 96.977 85.736 1.00 0.00 H ATOM 64811 H2 WAT 3783 32.043 96.355 85.737 1.00 0.00 H TER 64813 WAT 3783 ATOM 64813 O WAT 3784 1.988 62.592 75.189 1.00 0.00 O ATOM 64814 H1 WAT 3784 2.122 62.052 74.410 1.00 0.00 H ATOM 64815 H2 WAT 3784 2.605 63.317 75.087 1.00 0.00 H TER 64817 WAT 3784 ATOM 64817 O WAT 3785 132.039 114.300 125.547 1.00 0.00 O ATOM 64818 H1 WAT 3785 131.740 115.033 126.086 1.00 0.00 H ATOM 64819 H2 WAT 3785 132.983 114.432 125.465 1.00 0.00 H TER 64821 WAT 3785 ATOM 64821 O WAT 3786 87.890 21.066 118.898 1.00 0.00 O ATOM 64822 H1 WAT 3786 87.553 20.185 119.062 1.00 0.00 H ATOM 64823 H2 WAT 3786 88.839 20.954 118.841 1.00 0.00 H TER 64825 WAT 3786 ATOM 64825 O WAT 3787 24.544 113.255 119.862 1.00 0.00 O ATOM 64826 H1 WAT 3787 24.385 114.182 120.037 1.00 0.00 H ATOM 64827 H2 WAT 3787 24.080 113.083 119.042 1.00 0.00 H TER 64829 WAT 3787 ATOM 64829 O WAT 3788 114.616 130.624 150.015 1.00 0.00 O ATOM 64830 H1 WAT 3788 114.275 130.692 150.907 1.00 0.00 H ATOM 64831 H2 WAT 3788 114.170 129.861 149.646 1.00 0.00 H TER 64833 WAT 3788 ATOM 64833 O WAT 3789 72.356 92.645 17.849 1.00 0.00 O ATOM 64834 H1 WAT 3789 71.663 93.278 17.661 1.00 0.00 H ATOM 64835 H2 WAT 3789 73.111 92.963 17.354 1.00 0.00 H TER 64837 WAT 3789 ATOM 64837 O WAT 3790 17.612 121.040 122.182 1.00 0.00 O ATOM 64838 H1 WAT 3790 16.701 120.954 122.465 1.00 0.00 H ATOM 64839 H2 WAT 3790 18.125 120.886 122.976 1.00 0.00 H TER 64841 WAT 3790 ATOM 64841 O WAT 3791 57.998 35.812 67.885 1.00 0.00 O ATOM 64842 H1 WAT 3791 58.636 35.231 68.300 1.00 0.00 H ATOM 64843 H2 WAT 3791 57.997 35.547 66.965 1.00 0.00 H TER 64845 WAT 3791 ATOM 64845 O WAT 3792 134.080 94.793 9.524 1.00 0.00 O ATOM 64846 H1 WAT 3792 134.971 95.087 9.333 1.00 0.00 H ATOM 64847 H2 WAT 3792 134.067 94.669 10.473 1.00 0.00 H TER 64849 WAT 3792 ATOM 64849 O WAT 3793 38.081 143.140 157.761 1.00 0.00 O ATOM 64850 H1 WAT 3793 37.302 143.411 158.246 1.00 0.00 H ATOM 64851 H2 WAT 3793 37.743 142.588 157.055 1.00 0.00 H TER 64853 WAT 3793 ATOM 64853 O WAT 3794 92.086 2.990 0.874 1.00 0.00 O ATOM 64854 H1 WAT 3794 91.799 2.771 1.761 1.00 0.00 H ATOM 64855 H2 WAT 3794 91.852 2.223 0.351 1.00 0.00 H TER 64857 WAT 3794 ATOM 64857 O WAT 3795 20.394 62.851 104.711 1.00 0.00 O ATOM 64858 H1 WAT 3795 20.774 62.073 104.302 1.00 0.00 H ATOM 64859 H2 WAT 3795 19.664 63.089 104.140 1.00 0.00 H TER 64861 WAT 3795 ATOM 64861 O WAT 3796 108.519 135.323 126.201 1.00 0.00 O ATOM 64862 H1 WAT 3796 108.578 136.193 126.595 1.00 0.00 H ATOM 64863 H2 WAT 3796 107.601 135.237 125.946 1.00 0.00 H TER 64865 WAT 3796 ATOM 64865 O WAT 3797 112.055 2.435 23.130 1.00 0.00 O ATOM 64866 H1 WAT 3797 111.192 2.155 22.824 1.00 0.00 H ATOM 64867 H2 WAT 3797 112.640 1.718 22.884 1.00 0.00 H TER 64869 WAT 3797 ATOM 64869 O WAT 3798 132.526 142.451 70.639 1.00 0.00 O ATOM 64870 H1 WAT 3798 132.863 141.737 71.181 1.00 0.00 H ATOM 64871 H2 WAT 3798 132.250 143.118 71.267 1.00 0.00 H TER 64873 WAT 3798 ATOM 64873 O WAT 3799 117.897 144.905 97.005 1.00 0.00 O ATOM 64874 H1 WAT 3799 118.334 144.569 96.222 1.00 0.00 H ATOM 64875 H2 WAT 3799 116.980 144.656 96.894 1.00 0.00 H TER 64877 WAT 3799 ATOM 64877 O WAT 3800 11.066 71.316 77.422 1.00 0.00 O ATOM 64878 H1 WAT 3800 11.718 70.961 78.026 1.00 0.00 H ATOM 64879 H2 WAT 3800 11.505 72.058 77.004 1.00 0.00 H TER 64881 WAT 3800 ATOM 64881 O WAT 3801 65.172 57.134 120.315 1.00 0.00 O ATOM 64882 H1 WAT 3801 65.467 56.262 120.052 1.00 0.00 H ATOM 64883 H2 WAT 3801 65.332 57.683 119.549 1.00 0.00 H TER 64885 WAT 3801 ATOM 64885 O WAT 3802 70.311 60.679 108.628 1.00 0.00 O ATOM 64886 H1 WAT 3802 69.412 60.898 108.871 1.00 0.00 H ATOM 64887 H2 WAT 3802 70.688 61.506 108.329 1.00 0.00 H TER 64889 WAT 3802 ATOM 64889 O WAT 3803 68.838 31.788 158.369 1.00 0.00 O ATOM 64890 H1 WAT 3803 67.894 31.942 158.345 1.00 0.00 H ATOM 64891 H2 WAT 3803 68.924 30.836 158.404 1.00 0.00 H TER 64893 WAT 3803 ATOM 64893 O WAT 3804 104.242 23.453 2.533 1.00 0.00 O ATOM 64894 H1 WAT 3804 103.423 23.007 2.747 1.00 0.00 H ATOM 64895 H2 WAT 3804 104.587 22.973 1.780 1.00 0.00 H TER 64897 WAT 3804 ATOM 64897 O WAT 3805 20.616 31.691 16.676 1.00 0.00 O ATOM 64898 H1 WAT 3805 21.053 31.388 15.879 1.00 0.00 H ATOM 64899 H2 WAT 3805 20.809 32.628 16.714 1.00 0.00 H TER 64901 WAT 3805 ATOM 64901 O WAT 3806 70.204 31.850 7.941 1.00 0.00 O ATOM 64902 H1 WAT 3806 69.466 31.284 7.716 1.00 0.00 H ATOM 64903 H2 WAT 3806 70.900 31.244 8.196 1.00 0.00 H TER 64905 WAT 3806 ATOM 64905 O WAT 3807 36.158 9.650 114.855 1.00 0.00 O ATOM 64906 H1 WAT 3807 36.728 8.981 114.475 1.00 0.00 H ATOM 64907 H2 WAT 3807 35.743 10.068 114.100 1.00 0.00 H TER 64909 WAT 3807 ATOM 64909 O WAT 3808 32.715 45.488 114.515 1.00 0.00 O ATOM 64910 H1 WAT 3808 33.238 45.660 115.298 1.00 0.00 H ATOM 64911 H2 WAT 3808 32.313 46.331 114.305 1.00 0.00 H TER 64913 WAT 3808 ATOM 64913 O WAT 3809 52.632 59.856 139.352 1.00 0.00 O ATOM 64914 H1 WAT 3809 53.348 60.424 139.635 1.00 0.00 H ATOM 64915 H2 WAT 3809 52.658 59.116 139.958 1.00 0.00 H TER 64917 WAT 3809 ATOM 64917 O WAT 3810 118.312 133.729 149.878 1.00 0.00 O ATOM 64918 H1 WAT 3810 118.927 133.009 149.735 1.00 0.00 H ATOM 64919 H2 WAT 3810 118.647 134.442 149.335 1.00 0.00 H TER 64921 WAT 3810 ATOM 64921 O WAT 3811 112.173 50.256 10.245 1.00 0.00 O ATOM 64922 H1 WAT 3811 112.827 49.567 10.363 1.00 0.00 H ATOM 64923 H2 WAT 3811 112.408 50.922 10.891 1.00 0.00 H TER 64925 WAT 3811 ATOM 64925 O WAT 3812 12.738 39.824 88.925 1.00 0.00 O ATOM 64926 H1 WAT 3812 13.466 39.292 89.245 1.00 0.00 H ATOM 64927 H2 WAT 3812 12.152 39.198 88.500 1.00 0.00 H TER 64929 WAT 3812 ATOM 64929 O WAT 3813 42.518 60.632 151.722 1.00 0.00 O ATOM 64930 H1 WAT 3813 42.119 59.765 151.793 1.00 0.00 H ATOM 64931 H2 WAT 3813 42.912 60.785 152.581 1.00 0.00 H TER 64933 WAT 3813 ATOM 64933 O WAT 3814 11.834 8.254 138.295 1.00 0.00 O ATOM 64934 H1 WAT 3814 11.312 7.550 137.909 1.00 0.00 H ATOM 64935 H2 WAT 3814 11.251 9.013 138.293 1.00 0.00 H TER 64937 WAT 3814 ATOM 64937 O WAT 3815 81.379 2.878 116.727 1.00 0.00 O ATOM 64938 H1 WAT 3815 82.127 3.428 116.495 1.00 0.00 H ATOM 64939 H2 WAT 3815 80.738 3.041 116.035 1.00 0.00 H TER 64941 WAT 3815 ATOM 64941 O WAT 3816 41.424 93.528 150.523 1.00 0.00 O ATOM 64942 H1 WAT 3816 41.795 92.938 151.180 1.00 0.00 H ATOM 64943 H2 WAT 3816 41.683 93.146 149.685 1.00 0.00 H TER 64945 WAT 3816 ATOM 64945 O WAT 3817 76.087 145.702 95.258 1.00 0.00 O ATOM 64946 H1 WAT 3817 76.978 145.993 95.067 1.00 0.00 H ATOM 64947 H2 WAT 3817 76.170 144.762 95.414 1.00 0.00 H TER 64949 WAT 3817 ATOM 64949 O WAT 3818 143.654 84.059 91.249 1.00 0.00 O ATOM 64950 H1 WAT 3818 143.073 83.306 91.136 1.00 0.00 H ATOM 64951 H2 WAT 3818 144.406 83.867 90.688 1.00 0.00 H TER 64953 WAT 3818 ATOM 64953 O WAT 3819 118.847 32.946 83.747 1.00 0.00 O ATOM 64954 H1 WAT 3819 117.997 32.513 83.829 1.00 0.00 H ATOM 64955 H2 WAT 3819 119.466 32.333 84.144 1.00 0.00 H TER 64957 WAT 3819 ATOM 64957 O WAT 3820 70.187 91.897 74.796 1.00 0.00 O ATOM 64958 H1 WAT 3820 70.690 92.538 75.299 1.00 0.00 H ATOM 64959 H2 WAT 3820 69.569 91.529 75.428 1.00 0.00 H TER 64961 WAT 3820 ATOM 64961 O WAT 3821 133.397 6.347 157.893 1.00 0.00 O ATOM 64962 H1 WAT 3821 133.711 7.170 158.268 1.00 0.00 H ATOM 64963 H2 WAT 3821 134.175 5.951 157.500 1.00 0.00 H TER 64965 WAT 3821 ATOM 64965 O WAT 3822 16.524 76.719 132.404 1.00 0.00 O ATOM 64966 H1 WAT 3822 16.385 75.988 131.802 1.00 0.00 H ATOM 64967 H2 WAT 3822 16.066 77.454 131.998 1.00 0.00 H TER 64969 WAT 3822 ATOM 64969 O WAT 3823 129.521 140.069 130.431 1.00 0.00 O ATOM 64970 H1 WAT 3823 129.550 140.787 129.798 1.00 0.00 H ATOM 64971 H2 WAT 3823 129.476 140.503 131.283 1.00 0.00 H TER 64973 WAT 3823 ATOM 64973 O WAT 3824 143.692 110.642 11.614 1.00 0.00 O ATOM 64974 H1 WAT 3824 144.560 110.525 12.000 1.00 0.00 H ATOM 64975 H2 WAT 3824 143.800 110.385 10.698 1.00 0.00 H TER 64977 WAT 3824 ATOM 64977 O WAT 3825 29.308 22.102 21.881 1.00 0.00 O ATOM 64978 H1 WAT 3825 29.120 21.184 22.074 1.00 0.00 H ATOM 64979 H2 WAT 3825 28.452 22.531 21.900 1.00 0.00 H TER 64981 WAT 3825 ATOM 64981 O WAT 3826 139.602 75.439 119.302 1.00 0.00 O ATOM 64982 H1 WAT 3826 138.952 76.125 119.147 1.00 0.00 H ATOM 64983 H2 WAT 3826 139.321 74.713 118.745 1.00 0.00 H TER 64985 WAT 3826 ATOM 64985 O WAT 3827 136.386 63.004 114.981 1.00 0.00 O ATOM 64986 H1 WAT 3827 137.085 63.419 114.475 1.00 0.00 H ATOM 64987 H2 WAT 3827 135.713 62.795 114.333 1.00 0.00 H TER 64989 WAT 3827 ATOM 64989 O WAT 3828 131.211 21.070 77.476 1.00 0.00 O ATOM 64990 H1 WAT 3828 131.445 21.403 78.342 1.00 0.00 H ATOM 64991 H2 WAT 3828 132.029 20.715 77.127 1.00 0.00 H TER 64993 WAT 3828 ATOM 64993 O WAT 3829 101.522 51.587 63.943 1.00 0.00 O ATOM 64994 H1 WAT 3829 100.838 51.845 64.560 1.00 0.00 H ATOM 64995 H2 WAT 3829 101.379 52.148 63.180 1.00 0.00 H TER 64997 WAT 3829 ATOM 64997 O WAT 3830 111.850 93.438 13.347 1.00 0.00 O ATOM 64998 H1 WAT 3830 112.043 92.536 13.603 1.00 0.00 H ATOM 64999 H2 WAT 3830 112.639 93.732 12.892 1.00 0.00 H TER 65001 WAT 3830 ATOM 65001 O WAT 3831 0.886 66.460 58.103 1.00 0.00 O ATOM 65002 H1 WAT 3831 1.654 66.767 57.621 1.00 0.00 H ATOM 65003 H2 WAT 3831 1.146 65.604 58.446 1.00 0.00 H TER 65005 WAT 3831 ATOM 65005 O WAT 3832 53.051 121.185 97.456 1.00 0.00 O ATOM 65006 H1 WAT 3832 53.782 121.031 96.858 1.00 0.00 H ATOM 65007 H2 WAT 3832 52.475 120.431 97.329 1.00 0.00 H TER 65009 WAT 3832 ATOM 65009 O WAT 3833 102.897 36.151 137.189 1.00 0.00 O ATOM 65010 H1 WAT 3833 102.644 35.458 136.579 1.00 0.00 H ATOM 65011 H2 WAT 3833 102.855 35.738 138.051 1.00 0.00 H TER 65013 WAT 3833 ATOM 65013 O WAT 3834 95.390 65.221 88.461 1.00 0.00 O ATOM 65014 H1 WAT 3834 95.574 66.119 88.186 1.00 0.00 H ATOM 65015 H2 WAT 3834 94.669 64.941 87.897 1.00 0.00 H TER 65017 WAT 3834 ATOM 65017 O WAT 3835 29.928 116.884 113.619 1.00 0.00 O ATOM 65018 H1 WAT 3835 29.580 117.047 112.743 1.00 0.00 H ATOM 65019 H2 WAT 3835 29.271 117.252 114.210 1.00 0.00 H TER 65021 WAT 3835 ATOM 65021 O WAT 3836 58.942 49.211 18.094 1.00 0.00 O ATOM 65022 H1 WAT 3836 58.625 49.034 17.208 1.00 0.00 H ATOM 65023 H2 WAT 3836 58.463 48.593 18.647 1.00 0.00 H TER 65025 WAT 3836 ATOM 65025 O WAT 3837 82.684 42.365 157.761 1.00 0.00 O ATOM 65026 H1 WAT 3837 82.772 43.185 158.248 1.00 0.00 H ATOM 65027 H2 WAT 3837 82.683 41.685 158.435 1.00 0.00 H TER 65029 WAT 3837 ATOM 65029 O WAT 3838 4.802 55.935 94.563 1.00 0.00 O ATOM 65030 H1 WAT 3838 5.738 55.806 94.403 1.00 0.00 H ATOM 65031 H2 WAT 3838 4.767 56.536 95.307 1.00 0.00 H TER 65033 WAT 3838 ATOM 65033 O WAT 3839 101.448 131.998 101.619 1.00 0.00 O ATOM 65034 H1 WAT 3839 101.378 132.853 101.193 1.00 0.00 H ATOM 65035 H2 WAT 3839 100.873 132.063 102.381 1.00 0.00 H TER 65037 WAT 3839 ATOM 65037 O WAT 3840 90.219 89.703 157.188 1.00 0.00 O ATOM 65038 H1 WAT 3840 90.793 90.409 156.892 1.00 0.00 H ATOM 65039 H2 WAT 3840 89.371 90.124 157.323 1.00 0.00 H TER 65041 WAT 3840 ATOM 65041 O WAT 3841 16.702 53.033 108.557 1.00 0.00 O ATOM 65042 H1 WAT 3841 16.851 52.288 109.139 1.00 0.00 H ATOM 65043 H2 WAT 3841 16.676 52.650 107.680 1.00 0.00 H TER 65045 WAT 3841 ATOM 65045 O WAT 3842 108.502 119.167 20.143 1.00 0.00 O ATOM 65046 H1 WAT 3842 107.939 118.541 20.600 1.00 0.00 H ATOM 65047 H2 WAT 3842 108.738 119.809 20.812 1.00 0.00 H TER 65049 WAT 3842 ATOM 65049 O WAT 3843 120.489 1.286 102.572 1.00 0.00 O ATOM 65050 H1 WAT 3843 121.391 1.527 102.359 1.00 0.00 H ATOM 65051 H2 WAT 3843 119.958 1.753 101.927 1.00 0.00 H TER 65053 WAT 3843 ATOM 65053 O WAT 3844 112.859 49.422 75.916 1.00 0.00 O ATOM 65054 H1 WAT 3844 113.421 48.662 75.764 1.00 0.00 H ATOM 65055 H2 WAT 3844 112.422 49.235 76.747 1.00 0.00 H TER 65057 WAT 3844 ATOM 65057 O WAT 3845 8.311 111.792 66.873 1.00 0.00 O ATOM 65058 H1 WAT 3845 7.994 112.670 67.084 1.00 0.00 H ATOM 65059 H2 WAT 3845 8.171 111.707 65.930 1.00 0.00 H TER 65061 WAT 3845 ATOM 65061 O WAT 3846 77.175 141.212 106.231 1.00 0.00 O ATOM 65062 H1 WAT 3846 77.684 142.019 106.314 1.00 0.00 H ATOM 65063 H2 WAT 3846 76.311 141.503 105.940 1.00 0.00 H TER 65065 WAT 3846 ATOM 65065 O WAT 3847 34.285 138.345 109.548 1.00 0.00 O ATOM 65066 H1 WAT 3847 35.126 137.902 109.658 1.00 0.00 H ATOM 65067 H2 WAT 3847 33.693 137.887 110.144 1.00 0.00 H TER 65069 WAT 3847 ATOM 65069 O WAT 3848 29.646 85.441 115.663 1.00 0.00 O ATOM 65070 H1 WAT 3848 30.527 85.294 115.319 1.00 0.00 H ATOM 65071 H2 WAT 3848 29.634 84.973 116.498 1.00 0.00 H TER 65073 WAT 3848 ATOM 65073 O WAT 3849 29.051 72.352 90.057 1.00 0.00 O ATOM 65074 H1 WAT 3849 28.731 71.777 90.751 1.00 0.00 H ATOM 65075 H2 WAT 3849 28.693 71.978 89.252 1.00 0.00 H TER 65077 WAT 3849 ATOM 65077 O WAT 3850 22.275 46.454 113.354 1.00 0.00 O ATOM 65078 H1 WAT 3850 21.676 45.994 112.766 1.00 0.00 H ATOM 65079 H2 WAT 3850 22.918 45.791 113.607 1.00 0.00 H TER 65081 WAT 3850 ATOM 65081 O WAT 3851 11.667 27.529 64.867 1.00 0.00 O ATOM 65082 H1 WAT 3851 12.561 27.842 65.004 1.00 0.00 H ATOM 65083 H2 WAT 3851 11.386 27.953 64.056 1.00 0.00 H TER 65085 WAT 3851 ATOM 65085 O WAT 3852 7.243 89.861 85.411 1.00 0.00 O ATOM 65086 H1 WAT 3852 7.405 88.930 85.258 1.00 0.00 H ATOM 65087 H2 WAT 3852 8.046 90.178 85.826 1.00 0.00 H TER 65089 WAT 3852 ATOM 65089 O WAT 3853 99.802 49.696 141.527 1.00 0.00 O ATOM 65090 H1 WAT 3853 99.550 50.390 142.136 1.00 0.00 H ATOM 65091 H2 WAT 3853 100.378 50.128 140.896 1.00 0.00 H TER 65093 WAT 3853 ATOM 65093 O WAT 3854 131.527 39.087 104.540 1.00 0.00 O ATOM 65094 H1 WAT 3854 130.971 39.618 105.109 1.00 0.00 H ATOM 65095 H2 WAT 3854 130.956 38.380 104.239 1.00 0.00 H TER 65097 WAT 3854 ATOM 65097 O WAT 3855 16.846 14.349 153.490 1.00 0.00 O ATOM 65098 H1 WAT 3855 16.177 14.504 154.157 1.00 0.00 H ATOM 65099 H2 WAT 3855 16.620 14.949 152.780 1.00 0.00 H TER 65101 WAT 3855 ATOM 65101 O WAT 3856 82.941 95.479 125.980 1.00 0.00 O ATOM 65102 H1 WAT 3856 82.721 95.932 126.794 1.00 0.00 H ATOM 65103 H2 WAT 3856 82.578 96.036 125.291 1.00 0.00 H TER 65105 WAT 3856 ATOM 65105 O WAT 3857 91.166 44.225 1.507 1.00 0.00 O ATOM 65106 H1 WAT 3857 90.754 43.837 2.280 1.00 0.00 H ATOM 65107 H2 WAT 3857 92.028 44.507 1.812 1.00 0.00 H TER 65109 WAT 3857 ATOM 65109 O WAT 3858 72.334 58.858 23.147 1.00 0.00 O ATOM 65110 H1 WAT 3858 73.022 58.493 22.590 1.00 0.00 H ATOM 65111 H2 WAT 3858 71.521 58.505 22.786 1.00 0.00 H TER 65113 WAT 3858 ATOM 65113 O WAT 3859 86.444 49.446 133.448 1.00 0.00 O ATOM 65114 H1 WAT 3859 86.282 48.554 133.757 1.00 0.00 H ATOM 65115 H2 WAT 3859 86.766 49.334 132.553 1.00 0.00 H TER 65117 WAT 3859 ATOM 65117 O WAT 3860 5.342 31.893 99.267 1.00 0.00 O ATOM 65118 H1 WAT 3860 5.642 32.482 98.575 1.00 0.00 H ATOM 65119 H2 WAT 3860 4.712 31.317 98.835 1.00 0.00 H TER 65121 WAT 3860 ATOM 65121 O WAT 3861 62.624 25.393 25.316 1.00 0.00 O ATOM 65122 H1 WAT 3861 62.645 24.531 25.733 1.00 0.00 H ATOM 65123 H2 WAT 3861 61.733 25.471 24.974 1.00 0.00 H TER 65125 WAT 3861 ATOM 65125 O WAT 3862 133.803 32.170 3.219 1.00 0.00 O ATOM 65126 H1 WAT 3862 133.257 32.831 2.794 1.00 0.00 H ATOM 65127 H2 WAT 3862 133.774 32.397 4.149 1.00 0.00 H TER 65129 WAT 3862 ATOM 65129 O WAT 3863 121.058 131.694 139.152 1.00 0.00 O ATOM 65130 H1 WAT 3863 121.820 131.280 138.747 1.00 0.00 H ATOM 65131 H2 WAT 3863 120.521 131.982 138.414 1.00 0.00 H TER 65133 WAT 3863 ATOM 65133 O WAT 3864 3.555 145.533 125.806 1.00 0.00 O ATOM 65134 H1 WAT 3864 4.469 145.485 126.086 1.00 0.00 H ATOM 65135 H2 WAT 3864 3.526 145.024 124.996 1.00 0.00 H TER 65137 WAT 3864 ATOM 65137 O WAT 3865 135.544 80.706 25.158 1.00 0.00 O ATOM 65138 H1 WAT 3865 135.684 80.245 25.985 1.00 0.00 H ATOM 65139 H2 WAT 3865 134.630 80.985 25.190 1.00 0.00 H TER 65141 WAT 3865 ATOM 65141 O WAT 3866 90.158 5.083 125.258 1.00 0.00 O ATOM 65142 H1 WAT 3866 89.424 5.343 124.700 1.00 0.00 H ATOM 65143 H2 WAT 3866 89.820 4.349 125.771 1.00 0.00 H TER 65145 WAT 3866 ATOM 65145 O WAT 3867 104.281 110.197 87.817 1.00 0.00 O ATOM 65146 H1 WAT 3867 104.352 109.261 87.629 1.00 0.00 H ATOM 65147 H2 WAT 3867 105.155 110.449 88.115 1.00 0.00 H TER 65149 WAT 3867 ATOM 65149 O WAT 3868 91.122 81.174 140.947 1.00 0.00 O ATOM 65150 H1 WAT 3868 91.405 81.806 141.608 1.00 0.00 H ATOM 65151 H2 WAT 3868 90.414 81.617 140.479 1.00 0.00 H TER 65153 WAT 3868 ATOM 65153 O WAT 3869 112.526 19.384 134.680 1.00 0.00 O ATOM 65154 H1 WAT 3869 113.403 19.068 134.900 1.00 0.00 H ATOM 65155 H2 WAT 3869 112.042 18.595 134.435 1.00 0.00 H TER 65157 WAT 3869 ATOM 65157 O WAT 3870 47.344 1.667 1.912 1.00 0.00 O ATOM 65158 H1 WAT 3870 47.500 1.387 2.814 1.00 0.00 H ATOM 65159 H2 WAT 3870 47.434 0.866 1.394 1.00 0.00 H TER 65161 WAT 3870 ATOM 65161 O WAT 3871 17.982 98.558 16.698 1.00 0.00 O ATOM 65162 H1 WAT 3871 17.185 98.355 16.208 1.00 0.00 H ATOM 65163 H2 WAT 3871 18.439 97.720 16.770 1.00 0.00 H TER 65165 WAT 3871 ATOM 65165 O WAT 3872 108.571 25.198 151.691 1.00 0.00 O ATOM 65166 H1 WAT 3872 109.393 24.809 151.393 1.00 0.00 H ATOM 65167 H2 WAT 3872 108.733 26.141 151.675 1.00 0.00 H TER 65169 WAT 3872 ATOM 65169 O WAT 3873 76.146 119.692 102.704 1.00 0.00 O ATOM 65170 H1 WAT 3873 77.009 119.590 103.107 1.00 0.00 H ATOM 65171 H2 WAT 3873 75.603 120.071 103.395 1.00 0.00 H TER 65173 WAT 3873 ATOM 65173 O WAT 3874 34.811 29.679 101.025 1.00 0.00 O ATOM 65174 H1 WAT 3874 35.466 29.536 101.708 1.00 0.00 H ATOM 65175 H2 WAT 3874 34.227 28.923 101.091 1.00 0.00 H TER 65177 WAT 3874 ATOM 65177 O WAT 3875 48.847 125.343 78.015 1.00 0.00 O ATOM 65178 H1 WAT 3875 49.775 125.574 78.054 1.00 0.00 H ATOM 65179 H2 WAT 3875 48.786 124.518 78.496 1.00 0.00 H TER 65181 WAT 3875 ATOM 65181 O WAT 3876 75.028 133.231 154.273 1.00 0.00 O ATOM 65182 H1 WAT 3876 74.614 132.794 155.018 1.00 0.00 H ATOM 65183 H2 WAT 3876 75.415 134.024 154.645 1.00 0.00 H TER 65185 WAT 3876 ATOM 65185 O WAT 3877 114.002 31.360 67.661 1.00 0.00 O ATOM 65186 H1 WAT 3877 113.901 32.045 67.000 1.00 0.00 H ATOM 65187 H2 WAT 3877 113.765 30.552 67.206 1.00 0.00 H TER 65189 WAT 3877 ATOM 65189 O WAT 3878 67.508 139.648 70.929 1.00 0.00 O ATOM 65190 H1 WAT 3878 66.967 139.899 71.678 1.00 0.00 H ATOM 65191 H2 WAT 3878 67.623 138.703 71.022 1.00 0.00 H TER 65193 WAT 3878 ATOM 65193 O WAT 3879 38.041 24.184 6.409 1.00 0.00 O ATOM 65194 H1 WAT 3879 37.266 24.692 6.171 1.00 0.00 H ATOM 65195 H2 WAT 3879 38.389 24.626 7.183 1.00 0.00 H TER 65197 WAT 3879 ATOM 65197 O WAT 3880 12.389 131.874 116.066 1.00 0.00 O ATOM 65198 H1 WAT 3880 11.580 132.246 115.715 1.00 0.00 H ATOM 65199 H2 WAT 3880 12.526 131.075 115.557 1.00 0.00 H TER 65201 WAT 3880 ATOM 65201 O WAT 3881 141.418 24.164 71.439 1.00 0.00 O ATOM 65202 H1 WAT 3881 142.272 24.461 71.125 1.00 0.00 H ATOM 65203 H2 WAT 3881 141.370 23.246 71.173 1.00 0.00 H TER 65205 WAT 3881 ATOM 65205 O WAT 3882 63.171 64.164 145.894 1.00 0.00 O ATOM 65206 H1 WAT 3882 63.554 64.752 146.545 1.00 0.00 H ATOM 65207 H2 WAT 3882 63.924 63.778 145.447 1.00 0.00 H TER 65209 WAT 3882 ATOM 65209 O WAT 3883 109.224 46.801 85.443 1.00 0.00 O ATOM 65210 H1 WAT 3883 109.579 46.175 86.074 1.00 0.00 H ATOM 65211 H2 WAT 3883 108.623 46.285 84.905 1.00 0.00 H TER 65213 WAT 3883 ATOM 65213 O WAT 3884 0.923 98.624 12.625 1.00 0.00 O ATOM 65214 H1 WAT 3884 0.640 99.217 13.321 1.00 0.00 H ATOM 65215 H2 WAT 3884 0.636 97.759 12.916 1.00 0.00 H TER 65217 WAT 3884 ATOM 65217 O WAT 3885 53.891 30.921 113.840 1.00 0.00 O ATOM 65218 H1 WAT 3885 54.696 30.768 113.346 1.00 0.00 H ATOM 65219 H2 WAT 3885 54.098 31.659 114.414 1.00 0.00 H TER 65221 WAT 3885 ATOM 65221 O WAT 3886 82.276 28.686 2.383 1.00 0.00 O ATOM 65222 H1 WAT 3886 81.372 28.468 2.608 1.00 0.00 H ATOM 65223 H2 WAT 3886 82.202 29.256 1.617 1.00 0.00 H TER 65225 WAT 3886 ATOM 65225 O WAT 3887 139.870 12.616 156.785 1.00 0.00 O ATOM 65226 H1 WAT 3887 139.794 11.707 156.495 1.00 0.00 H ATOM 65227 H2 WAT 3887 139.032 12.803 157.209 1.00 0.00 H TER 65229 WAT 3887 ATOM 65229 O WAT 3888 139.790 23.517 147.143 1.00 0.00 O ATOM 65230 H1 WAT 3888 140.160 23.793 146.305 1.00 0.00 H ATOM 65231 H2 WAT 3888 139.442 24.321 147.528 1.00 0.00 H TER 65233 WAT 3888 ATOM 65233 O WAT 3889 86.675 98.904 143.508 1.00 0.00 O ATOM 65234 H1 WAT 3889 86.934 99.286 144.347 1.00 0.00 H ATOM 65235 H2 WAT 3889 85.735 99.071 143.449 1.00 0.00 H TER 65237 WAT 3889 ATOM 65237 O WAT 3890 10.291 55.829 65.714 1.00 0.00 O ATOM 65238 H1 WAT 3890 9.811 55.155 66.196 1.00 0.00 H ATOM 65239 H2 WAT 3890 11.146 55.868 66.144 1.00 0.00 H TER 65241 WAT 3890 ATOM 65241 O WAT 3891 81.620 19.888 74.354 1.00 0.00 O ATOM 65242 H1 WAT 3891 81.884 20.787 74.550 1.00 0.00 H ATOM 65243 H2 WAT 3891 81.207 19.578 75.159 1.00 0.00 H TER 65245 WAT 3891 ATOM 65245 O WAT 3892 81.682 9.868 60.555 1.00 0.00 O ATOM 65246 H1 WAT 3892 82.037 8.993 60.396 1.00 0.00 H ATOM 65247 H2 WAT 3892 81.842 10.344 59.740 1.00 0.00 H TER 65249 WAT 3892 ATOM 65249 O WAT 3893 87.150 144.627 22.916 1.00 0.00 O ATOM 65250 H1 WAT 3893 86.661 144.672 23.738 1.00 0.00 H ATOM 65251 H2 WAT 3893 87.786 145.340 22.977 1.00 0.00 H TER 65253 WAT 3893 ATOM 65253 O WAT 3894 92.137 93.319 103.448 1.00 0.00 O ATOM 65254 H1 WAT 3894 91.386 93.053 103.978 1.00 0.00 H ATOM 65255 H2 WAT 3894 91.825 93.260 102.544 1.00 0.00 H TER 65257 WAT 3894 ATOM 65257 O WAT 3895 74.487 16.989 142.777 1.00 0.00 O ATOM 65258 H1 WAT 3895 74.504 16.689 143.686 1.00 0.00 H ATOM 65259 H2 WAT 3895 74.645 17.932 142.834 1.00 0.00 H TER 65261 WAT 3895 ATOM 65261 O WAT 3896 133.267 143.254 128.241 1.00 0.00 O ATOM 65262 H1 WAT 3896 132.407 143.442 128.616 1.00 0.00 H ATOM 65263 H2 WAT 3896 133.332 143.838 127.486 1.00 0.00 H TER 65265 WAT 3896 ATOM 65265 O WAT 3897 27.513 5.525 154.945 1.00 0.00 O ATOM 65266 H1 WAT 3897 27.974 4.775 155.321 1.00 0.00 H ATOM 65267 H2 WAT 3897 27.470 5.335 154.008 1.00 0.00 H TER 65269 WAT 3897 ATOM 65269 O WAT 3898 8.325 90.766 83.084 1.00 0.00 O ATOM 65270 H1 WAT 3898 7.873 90.669 83.922 1.00 0.00 H ATOM 65271 H2 WAT 3898 8.754 89.922 82.944 1.00 0.00 H TER 65273 WAT 3898 ATOM 65273 O WAT 3899 61.330 0.682 9.682 1.00 0.00 O ATOM 65274 H1 WAT 3899 61.453 -0.263 9.589 1.00 0.00 H ATOM 65275 H2 WAT 3899 62.064 0.966 10.227 1.00 0.00 H TER 65277 WAT 3899 ATOM 65277 O WAT 3900 98.261 64.788 103.028 1.00 0.00 O ATOM 65278 H1 WAT 3900 97.541 64.347 102.576 1.00 0.00 H ATOM 65279 H2 WAT 3900 97.842 65.506 103.502 1.00 0.00 H TER 65281 WAT 3900 ATOM 65281 O WAT 3901 128.851 67.960 10.328 1.00 0.00 O ATOM 65282 H1 WAT 3901 128.242 67.245 10.140 1.00 0.00 H ATOM 65283 H2 WAT 3901 129.663 67.523 10.582 1.00 0.00 H TER 65285 WAT 3901 ATOM 65285 O WAT 3902 27.818 124.690 4.091 1.00 0.00 O ATOM 65286 H1 WAT 3902 28.577 124.789 4.667 1.00 0.00 H ATOM 65287 H2 WAT 3902 27.345 125.518 4.175 1.00 0.00 H TER 65289 WAT 3902 ATOM 65289 O WAT 3903 137.494 70.154 106.713 1.00 0.00 O ATOM 65290 H1 WAT 3903 136.920 70.812 106.320 1.00 0.00 H ATOM 65291 H2 WAT 3903 137.693 70.499 107.583 1.00 0.00 H TER 65293 WAT 3903 ATOM 65293 O WAT 3904 71.425 111.260 146.667 1.00 0.00 O ATOM 65294 H1 WAT 3904 71.202 111.252 147.598 1.00 0.00 H ATOM 65295 H2 WAT 3904 72.382 111.249 146.649 1.00 0.00 H TER 65297 WAT 3904 ATOM 65297 O WAT 3905 29.127 8.042 153.804 1.00 0.00 O ATOM 65298 H1 WAT 3905 28.773 8.634 153.140 1.00 0.00 H ATOM 65299 H2 WAT 3905 28.485 8.066 154.514 1.00 0.00 H TER 65301 WAT 3905 ATOM 65301 O WAT 3906 145.674 112.729 106.823 1.00 0.00 O ATOM 65302 H1 WAT 3906 146.413 113.240 107.154 1.00 0.00 H ATOM 65303 H2 WAT 3906 145.384 113.204 106.044 1.00 0.00 H TER 65305 WAT 3906 ATOM 65305 O WAT 3907 85.736 62.471 132.495 1.00 0.00 O ATOM 65306 H1 WAT 3907 86.283 62.212 131.753 1.00 0.00 H ATOM 65307 H2 WAT 3907 85.715 61.698 133.058 1.00 0.00 H TER 65309 WAT 3907 ATOM 65309 O WAT 3908 129.800 116.636 141.975 1.00 0.00 O ATOM 65310 H1 WAT 3908 130.169 116.990 141.166 1.00 0.00 H ATOM 65311 H2 WAT 3908 130.305 117.054 142.672 1.00 0.00 H TER 65313 WAT 3908 ATOM 65313 O WAT 3909 133.409 120.961 97.396 1.00 0.00 O ATOM 65314 H1 WAT 3909 132.996 121.687 96.928 1.00 0.00 H ATOM 65315 H2 WAT 3909 134.123 120.682 96.822 1.00 0.00 H TER 65317 WAT 3909 ATOM 65317 O WAT 3910 105.079 87.475 138.426 1.00 0.00 O ATOM 65318 H1 WAT 3910 105.126 87.453 139.381 1.00 0.00 H ATOM 65319 H2 WAT 3910 105.989 87.569 138.143 1.00 0.00 H TER 65321 WAT 3910 ATOM 65321 O WAT 3911 138.316 68.919 67.996 1.00 0.00 O ATOM 65322 H1 WAT 3911 138.664 68.791 68.879 1.00 0.00 H ATOM 65323 H2 WAT 3911 138.203 68.033 67.653 1.00 0.00 H TER 65325 WAT 3911 ATOM 65325 O WAT 3912 145.230 140.700 59.520 1.00 0.00 O ATOM 65326 H1 WAT 3912 144.913 140.300 60.329 1.00 0.00 H ATOM 65327 H2 WAT 3912 144.441 141.031 59.090 1.00 0.00 H TER 65329 WAT 3912 ATOM 65329 O WAT 3913 135.572 38.701 64.924 1.00 0.00 O ATOM 65330 H1 WAT 3913 134.656 38.849 65.162 1.00 0.00 H ATOM 65331 H2 WAT 3913 136.061 39.331 65.453 1.00 0.00 H TER 65333 WAT 3913 ATOM 65333 O WAT 3914 18.844 110.703 144.054 1.00 0.00 O ATOM 65334 H1 WAT 3914 18.731 109.785 144.299 1.00 0.00 H ATOM 65335 H2 WAT 3914 19.162 111.127 144.852 1.00 0.00 H TER 65337 WAT 3914 ATOM 65337 O WAT 3915 100.095 20.274 14.223 1.00 0.00 O ATOM 65338 H1 WAT 3915 100.757 20.893 14.530 1.00 0.00 H ATOM 65339 H2 WAT 3915 100.188 19.517 14.801 1.00 0.00 H TER 65341 WAT 3915 ATOM 65341 O WAT 3916 58.151 117.436 101.694 1.00 0.00 O ATOM 65342 H1 WAT 3916 59.002 117.866 101.610 1.00 0.00 H ATOM 65343 H2 WAT 3916 57.820 117.724 102.545 1.00 0.00 H TER 65345 WAT 3916 ATOM 65345 O WAT 3917 4.051 13.459 92.488 1.00 0.00 O ATOM 65346 H1 WAT 3917 3.729 13.606 91.599 1.00 0.00 H ATOM 65347 H2 WAT 3917 3.307 13.077 92.953 1.00 0.00 H TER 65349 WAT 3917 ATOM 65349 O WAT 3918 118.520 70.341 105.247 1.00 0.00 O ATOM 65350 H1 WAT 3918 118.672 70.980 104.550 1.00 0.00 H ATOM 65351 H2 WAT 3918 119.105 70.613 105.953 1.00 0.00 H TER 65353 WAT 3918 ATOM 65353 O WAT 3919 115.611 107.182 121.679 1.00 0.00 O ATOM 65354 H1 WAT 3919 116.360 107.518 122.171 1.00 0.00 H ATOM 65355 H2 WAT 3919 115.038 106.802 122.345 1.00 0.00 H TER 65357 WAT 3919 ATOM 65357 O WAT 3920 53.833 52.816 24.019 1.00 0.00 O ATOM 65358 H1 WAT 3920 53.124 52.754 24.659 1.00 0.00 H ATOM 65359 H2 WAT 3920 53.833 51.967 23.577 1.00 0.00 H TER 65361 WAT 3920 ATOM 65361 O WAT 3921 43.319 41.168 100.728 1.00 0.00 O ATOM 65362 H1 WAT 3921 43.379 40.341 101.207 1.00 0.00 H ATOM 65363 H2 WAT 3921 43.359 40.914 99.806 1.00 0.00 H TER 65365 WAT 3921 ATOM 65365 O WAT 3922 7.218 91.073 6.006 1.00 0.00 O ATOM 65366 H1 WAT 3922 7.249 91.492 6.867 1.00 0.00 H ATOM 65367 H2 WAT 3922 8.064 90.633 5.923 1.00 0.00 H TER 65369 WAT 3922 ATOM 65369 O WAT 3923 48.655 119.353 53.294 1.00 0.00 O ATOM 65370 H1 WAT 3923 49.437 118.814 53.177 1.00 0.00 H ATOM 65371 H2 WAT 3923 48.946 120.081 53.844 1.00 0.00 H TER 65373 WAT 3923 ATOM 65373 O WAT 3924 64.441 16.095 133.580 1.00 0.00 O ATOM 65374 H1 WAT 3924 64.701 16.886 133.109 1.00 0.00 H ATOM 65375 H2 WAT 3924 65.209 15.525 133.535 1.00 0.00 H TER 65377 WAT 3924 ATOM 65377 O WAT 3925 37.004 137.844 69.161 1.00 0.00 O ATOM 65378 H1 WAT 3925 36.857 136.948 68.859 1.00 0.00 H ATOM 65379 H2 WAT 3925 36.871 138.384 68.382 1.00 0.00 H TER 65381 WAT 3925 ATOM 65381 O WAT 3926 79.295 104.866 123.459 1.00 0.00 O ATOM 65382 H1 WAT 3926 78.822 104.344 124.107 1.00 0.00 H ATOM 65383 H2 WAT 3926 78.952 104.569 122.616 1.00 0.00 H TER 65385 WAT 3926 ATOM 65385 O WAT 3927 105.466 105.086 123.083 1.00 0.00 O ATOM 65386 H1 WAT 3927 105.341 105.934 122.658 1.00 0.00 H ATOM 65387 H2 WAT 3927 106.381 104.863 122.908 1.00 0.00 H TER 65389 WAT 3927 ATOM 65389 O WAT 3928 21.036 136.504 73.520 1.00 0.00 O ATOM 65390 H1 WAT 3928 21.289 137.425 73.584 1.00 0.00 H ATOM 65391 H2 WAT 3928 21.665 136.125 72.906 1.00 0.00 H TER 65393 WAT 3928 ATOM 65393 O WAT 3929 13.331 86.602 14.528 1.00 0.00 O ATOM 65394 H1 WAT 3929 13.017 86.295 13.677 1.00 0.00 H ATOM 65395 H2 WAT 3929 12.840 86.085 15.166 1.00 0.00 H TER 65397 WAT 3929 ATOM 65397 O WAT 3930 17.080 99.804 73.788 1.00 0.00 O ATOM 65398 H1 WAT 3930 16.968 100.424 73.067 1.00 0.00 H ATOM 65399 H2 WAT 3930 16.495 100.126 74.474 1.00 0.00 H TER 65401 WAT 3930 ATOM 65401 O WAT 3931 141.584 0.749 76.630 1.00 0.00 O ATOM 65402 H1 WAT 3931 140.717 1.155 76.619 1.00 0.00 H ATOM 65403 H2 WAT 3931 142.120 1.314 76.072 1.00 0.00 H TER 65405 WAT 3931 ATOM 65405 O WAT 3932 140.304 142.688 11.519 1.00 0.00 O ATOM 65406 H1 WAT 3932 139.865 143.538 11.474 1.00 0.00 H ATOM 65407 H2 WAT 3932 140.175 142.306 10.651 1.00 0.00 H TER 65409 WAT 3932 ATOM 65409 O WAT 3933 97.859 22.312 98.938 1.00 0.00 O ATOM 65410 H1 WAT 3933 97.963 23.054 99.534 1.00 0.00 H ATOM 65411 H2 WAT 3933 98.280 21.581 99.389 1.00 0.00 H TER 65413 WAT 3933 ATOM 65413 O WAT 3934 10.776 28.597 62.242 1.00 0.00 O ATOM 65414 H1 WAT 3934 10.371 29.410 62.544 1.00 0.00 H ATOM 65415 H2 WAT 3934 11.591 28.876 61.824 1.00 0.00 H TER 65417 WAT 3934 ATOM 65417 O WAT 3935 48.992 97.220 149.944 1.00 0.00 O ATOM 65418 H1 WAT 3935 48.371 97.410 149.240 1.00 0.00 H ATOM 65419 H2 WAT 3935 49.086 96.268 149.929 1.00 0.00 H TER 65421 WAT 3935 ATOM 65421 O WAT 3936 30.580 83.832 97.101 1.00 0.00 O ATOM 65422 H1 WAT 3936 31.277 83.210 96.893 1.00 0.00 H ATOM 65423 H2 WAT 3936 30.602 83.907 98.055 1.00 0.00 H TER 65425 WAT 3936 ATOM 65425 O WAT 3937 128.392 16.897 104.788 1.00 0.00 O ATOM 65426 H1 WAT 3937 128.489 16.004 104.458 1.00 0.00 H ATOM 65427 H2 WAT 3937 127.588 16.874 105.308 1.00 0.00 H TER 65429 WAT 3937 ATOM 65429 O WAT 3938 14.333 134.318 12.444 1.00 0.00 O ATOM 65430 H1 WAT 3938 13.852 134.061 13.232 1.00 0.00 H ATOM 65431 H2 WAT 3938 14.219 133.582 11.844 1.00 0.00 H TER 65433 WAT 3938 ATOM 65433 O WAT 3939 69.615 99.687 75.341 1.00 0.00 O ATOM 65434 H1 WAT 3939 70.069 99.562 74.508 1.00 0.00 H ATOM 65435 H2 WAT 3939 69.727 100.617 75.538 1.00 0.00 H TER 65437 WAT 3939 ATOM 65437 O WAT 3940 54.517 41.320 114.388 1.00 0.00 O ATOM 65438 H1 WAT 3940 54.065 40.984 113.615 1.00 0.00 H ATOM 65439 H2 WAT 3940 54.112 40.859 115.122 1.00 0.00 H TER 65441 WAT 3940 ATOM 65441 O WAT 3941 127.828 86.176 155.924 1.00 0.00 O ATOM 65442 H1 WAT 3941 127.645 86.175 154.985 1.00 0.00 H ATOM 65443 H2 WAT 3941 128.653 85.698 156.008 1.00 0.00 H TER 65445 WAT 3941 ATOM 65445 O WAT 3942 79.674 114.655 154.398 1.00 0.00 O ATOM 65446 H1 WAT 3942 80.337 114.402 155.040 1.00 0.00 H ATOM 65447 H2 WAT 3942 79.713 113.970 153.730 1.00 0.00 H TER 65449 WAT 3942 ATOM 65449 O WAT 3943 28.916 84.423 69.777 1.00 0.00 O ATOM 65450 H1 WAT 3943 28.325 83.675 69.863 1.00 0.00 H ATOM 65451 H2 WAT 3943 28.738 84.769 68.903 1.00 0.00 H TER 65453 WAT 3943 ATOM 65453 O WAT 3944 111.467 108.887 19.545 1.00 0.00 O ATOM 65454 H1 WAT 3944 112.175 109.358 19.985 1.00 0.00 H ATOM 65455 H2 WAT 3944 111.583 109.093 18.618 1.00 0.00 H TER 65457 WAT 3944 ATOM 65457 O WAT 3945 65.417 92.154 117.991 1.00 0.00 O ATOM 65458 H1 WAT 3945 66.338 92.200 118.246 1.00 0.00 H ATOM 65459 H2 WAT 3945 65.437 92.007 117.045 1.00 0.00 H TER 65461 WAT 3945 ATOM 65461 O WAT 3946 44.805 22.442 139.467 1.00 0.00 O ATOM 65462 H1 WAT 3946 45.047 22.656 138.566 1.00 0.00 H ATOM 65463 H2 WAT 3946 45.468 21.813 139.751 1.00 0.00 H TER 65465 WAT 3946 ATOM 65465 O WAT 3947 112.900 75.477 20.311 1.00 0.00 O ATOM 65466 H1 WAT 3947 113.239 74.918 21.010 1.00 0.00 H ATOM 65467 H2 WAT 3947 113.584 76.133 20.177 1.00 0.00 H TER 65469 WAT 3947 ATOM 65469 O WAT 3948 101.672 96.863 81.600 1.00 0.00 O ATOM 65470 H1 WAT 3948 101.636 96.571 80.689 1.00 0.00 H ATOM 65471 H2 WAT 3948 101.729 96.054 82.108 1.00 0.00 H TER 65473 WAT 3948 ATOM 65473 O WAT 3949 31.089 120.661 156.922 1.00 0.00 O ATOM 65474 H1 WAT 3949 31.955 120.343 156.668 1.00 0.00 H ATOM 65475 H2 WAT 3949 31.264 121.328 157.586 1.00 0.00 H TER 65477 WAT 3949 ATOM 65477 O WAT 3950 17.900 102.890 88.731 1.00 0.00 O ATOM 65478 H1 WAT 3950 17.520 102.024 88.582 1.00 0.00 H ATOM 65479 H2 WAT 3950 18.776 102.712 89.072 1.00 0.00 H TER 65481 WAT 3950 ATOM 65481 O WAT 3951 100.419 41.008 112.509 1.00 0.00 O ATOM 65482 H1 WAT 3951 100.005 41.314 111.702 1.00 0.00 H ATOM 65483 H2 WAT 3951 100.945 41.750 112.805 1.00 0.00 H TER 65485 WAT 3951 ATOM 65485 O WAT 3952 98.443 63.219 90.892 1.00 0.00 O ATOM 65486 H1 WAT 3952 99.037 63.466 91.600 1.00 0.00 H ATOM 65487 H2 WAT 3952 98.017 64.039 90.641 1.00 0.00 H TER 65489 WAT 3952 ATOM 65489 O WAT 3953 41.498 9.347 158.336 1.00 0.00 O ATOM 65490 H1 WAT 3953 42.435 9.298 158.146 1.00 0.00 H ATOM 65491 H2 WAT 3953 41.078 9.327 157.476 1.00 0.00 H TER 65493 WAT 3953 ATOM 65493 O WAT 3954 97.965 31.904 116.192 1.00 0.00 O ATOM 65494 H1 WAT 3954 97.350 31.727 116.904 1.00 0.00 H ATOM 65495 H2 WAT 3954 97.604 31.434 115.441 1.00 0.00 H TER 65497 WAT 3954 ATOM 65497 O WAT 3955 139.482 77.795 93.617 1.00 0.00 O ATOM 65498 H1 WAT 3955 139.196 76.985 94.039 1.00 0.00 H ATOM 65499 H2 WAT 3955 140.360 77.598 93.290 1.00 0.00 H TER 65501 WAT 3955 ATOM 65501 O WAT 3956 22.160 31.708 91.268 1.00 0.00 O ATOM 65502 H1 WAT 3956 22.646 32.397 91.722 1.00 0.00 H ATOM 65503 H2 WAT 3956 22.771 30.973 91.224 1.00 0.00 H TER 65505 WAT 3956 ATOM 65505 O WAT 3957 97.289 1.986 80.132 1.00 0.00 O ATOM 65506 H1 WAT 3957 96.970 1.301 79.545 1.00 0.00 H ATOM 65507 H2 WAT 3957 98.231 2.024 79.967 1.00 0.00 H TER 65509 WAT 3957 ATOM 65509 O WAT 3958 139.486 88.259 119.855 1.00 0.00 O ATOM 65510 H1 WAT 3958 140.373 88.207 119.498 1.00 0.00 H ATOM 65511 H2 WAT 3958 138.953 88.577 119.126 1.00 0.00 H TER 65513 WAT 3958 ATOM 65513 O WAT 3959 66.377 139.468 1.832 1.00 0.00 O ATOM 65514 H1 WAT 3959 67.013 139.530 2.544 1.00 0.00 H ATOM 65515 H2 WAT 3959 66.283 138.528 1.676 1.00 0.00 H TER 65517 WAT 3959 ATOM 65517 O WAT 3960 23.612 41.028 107.268 1.00 0.00 O ATOM 65518 H1 WAT 3960 23.937 40.129 107.312 1.00 0.00 H ATOM 65519 H2 WAT 3960 22.914 40.999 106.614 1.00 0.00 H TER 65521 WAT 3960 ATOM 65521 O WAT 3961 21.492 42.822 117.144 1.00 0.00 O ATOM 65522 H1 WAT 3961 20.676 42.974 117.620 1.00 0.00 H ATOM 65523 H2 WAT 3961 21.226 42.748 116.228 1.00 0.00 H TER 65525 WAT 3961 ATOM 65525 O WAT 3962 49.584 15.140 60.190 1.00 0.00 O ATOM 65526 H1 WAT 3962 50.154 14.756 59.523 1.00 0.00 H ATOM 65527 H2 WAT 3962 48.942 15.647 59.693 1.00 0.00 H TER 65529 WAT 3962 ATOM 65529 O WAT 3963 41.342 66.975 111.177 1.00 0.00 O ATOM 65530 H1 WAT 3963 42.039 66.467 110.762 1.00 0.00 H ATOM 65531 H2 WAT 3963 40.606 66.367 111.239 1.00 0.00 H TER 65533 WAT 3963 ATOM 65533 O WAT 3964 96.106 68.670 98.648 1.00 0.00 O ATOM 65534 H1 WAT 3964 96.270 67.926 98.068 1.00 0.00 H ATOM 65535 H2 WAT 3964 95.213 68.944 98.439 1.00 0.00 H TER 65537 WAT 3964 ATOM 65537 O WAT 3965 118.545 63.974 81.339 1.00 0.00 O ATOM 65538 H1 WAT 3965 118.236 63.275 80.762 1.00 0.00 H ATOM 65539 H2 WAT 3965 118.969 64.599 80.752 1.00 0.00 H TER 65541 WAT 3965 ATOM 65541 O WAT 3966 138.085 95.298 128.641 1.00 0.00 O ATOM 65542 H1 WAT 3966 137.413 95.948 128.845 1.00 0.00 H ATOM 65543 H2 WAT 3966 138.808 95.808 128.277 1.00 0.00 H TER 65545 WAT 3966 ATOM 65545 O WAT 3967 121.571 0.449 25.128 1.00 0.00 O ATOM 65546 H1 WAT 3967 121.591 -0.145 25.878 1.00 0.00 H ATOM 65547 H2 WAT 3967 121.800 -0.102 24.379 1.00 0.00 H TER 65549 WAT 3967 ATOM 65549 O WAT 3968 74.623 19.409 123.442 1.00 0.00 O ATOM 65550 H1 WAT 3968 75.478 19.009 123.282 1.00 0.00 H ATOM 65551 H2 WAT 3968 73.993 18.750 123.151 1.00 0.00 H TER 65553 WAT 3968 ATOM 65553 O WAT 3969 102.066 138.051 81.451 1.00 0.00 O ATOM 65554 H1 WAT 3969 102.598 138.654 81.969 1.00 0.00 H ATOM 65555 H2 WAT 3969 101.204 138.074 81.866 1.00 0.00 H TER 65557 WAT 3969 ATOM 65557 O WAT 3970 62.118 108.653 3.851 1.00 0.00 O ATOM 65558 H1 WAT 3970 61.971 109.579 4.045 1.00 0.00 H ATOM 65559 H2 WAT 3970 62.999 108.477 4.181 1.00 0.00 H TER 65561 WAT 3970 ATOM 65561 O WAT 3971 107.448 98.184 77.567 1.00 0.00 O ATOM 65562 H1 WAT 3971 107.184 97.553 76.897 1.00 0.00 H ATOM 65563 H2 WAT 3971 108.405 98.168 77.546 1.00 0.00 H TER 65565 WAT 3971 ATOM 65565 O WAT 3972 62.193 45.955 14.195 1.00 0.00 O ATOM 65566 H1 WAT 3972 61.592 46.662 13.958 1.00 0.00 H ATOM 65567 H2 WAT 3972 62.380 46.100 15.122 1.00 0.00 H TER 65569 WAT 3972 ATOM 65569 O WAT 3973 103.420 39.387 58.331 1.00 0.00 O ATOM 65570 H1 WAT 3973 103.114 39.697 57.479 1.00 0.00 H ATOM 65571 H2 WAT 3973 103.761 38.510 58.159 1.00 0.00 H TER 65573 WAT 3973 ATOM 65573 O WAT 3974 3.456 135.195 104.951 1.00 0.00 O ATOM 65574 H1 WAT 3974 3.969 134.996 104.168 1.00 0.00 H ATOM 65575 H2 WAT 3974 3.907 134.732 105.657 1.00 0.00 H TER 65577 WAT 3974 ATOM 65577 O WAT 3975 117.591 49.437 104.326 1.00 0.00 O ATOM 65578 H1 WAT 3975 118.141 48.926 104.920 1.00 0.00 H ATOM 65579 H2 WAT 3975 116.759 49.530 104.790 1.00 0.00 H TER 65581 WAT 3975 ATOM 65581 O WAT 3976 45.306 138.221 81.617 1.00 0.00 O ATOM 65582 H1 WAT 3976 46.142 137.819 81.852 1.00 0.00 H ATOM 65583 H2 WAT 3976 44.709 137.958 82.317 1.00 0.00 H TER 65585 WAT 3976 ATOM 65585 O WAT 3977 144.787 8.935 98.873 1.00 0.00 O ATOM 65586 H1 WAT 3977 145.120 8.116 99.241 1.00 0.00 H ATOM 65587 H2 WAT 3977 145.264 9.039 98.050 1.00 0.00 H TER 65589 WAT 3977 ATOM 65589 O WAT 3978 61.649 -0.129 139.675 1.00 0.00 O ATOM 65590 H1 WAT 3978 62.245 0.611 139.563 1.00 0.00 H ATOM 65591 H2 WAT 3978 61.685 -0.326 140.611 1.00 0.00 H TER 65593 WAT 3978 ATOM 65593 O WAT 3979 41.556 96.366 8.630 1.00 0.00 O ATOM 65594 H1 WAT 3979 40.815 96.248 9.224 1.00 0.00 H ATOM 65595 H2 WAT 3979 42.213 95.742 8.939 1.00 0.00 H TER 65597 WAT 3979 ATOM 65597 O WAT 3980 52.668 92.889 95.038 1.00 0.00 O ATOM 65598 H1 WAT 3980 53.070 93.618 95.510 1.00 0.00 H ATOM 65599 H2 WAT 3980 53.341 92.209 95.028 1.00 0.00 H TER 65601 WAT 3980 ATOM 65601 O WAT 3981 11.938 93.571 129.557 1.00 0.00 O ATOM 65602 H1 WAT 3981 12.489 94.339 129.407 1.00 0.00 H ATOM 65603 H2 WAT 3981 12.086 93.346 130.476 1.00 0.00 H TER 65605 WAT 3981 ATOM 65605 O WAT 3982 62.571 139.547 92.538 1.00 0.00 O ATOM 65606 H1 WAT 3982 62.052 139.046 91.909 1.00 0.00 H ATOM 65607 H2 WAT 3982 62.190 139.331 93.389 1.00 0.00 H TER 65609 WAT 3982 ATOM 65609 O WAT 3983 132.863 43.529 1.315 1.00 0.00 O ATOM 65610 H1 WAT 3983 132.310 42.750 1.382 1.00 0.00 H ATOM 65611 H2 WAT 3983 133.647 43.310 1.819 1.00 0.00 H TER 65613 WAT 3983 ATOM 65613 O WAT 3984 70.190 67.085 9.026 1.00 0.00 O ATOM 65614 H1 WAT 3984 70.880 66.757 8.449 1.00 0.00 H ATOM 65615 H2 WAT 3984 70.162 66.456 9.747 1.00 0.00 H TER 65617 WAT 3984 ATOM 65617 O WAT 3985 0.235 18.995 19.610 1.00 0.00 O ATOM 65618 H1 WAT 3985 0.871 19.710 19.568 1.00 0.00 H ATOM 65619 H2 WAT 3985 -0.006 18.943 20.535 1.00 0.00 H TER 65621 WAT 3985 ATOM 65621 O WAT 3986 84.463 43.267 131.427 1.00 0.00 O ATOM 65622 H1 WAT 3986 84.351 42.332 131.596 1.00 0.00 H ATOM 65623 H2 WAT 3986 84.865 43.608 132.225 1.00 0.00 H TER 65625 WAT 3986 ATOM 65625 O WAT 3987 61.306 76.138 16.865 1.00 0.00 O ATOM 65626 H1 WAT 3987 61.503 75.646 17.662 1.00 0.00 H ATOM 65627 H2 WAT 3987 61.609 77.026 17.050 1.00 0.00 H TER 65629 WAT 3987 ATOM 65629 O WAT 3988 7.434 144.254 116.420 1.00 0.00 O ATOM 65630 H1 WAT 3988 6.591 143.800 116.384 1.00 0.00 H ATOM 65631 H2 WAT 3988 8.056 143.634 116.039 1.00 0.00 H TER 65633 WAT 3988 ATOM 65633 O WAT 3989 128.682 38.432 133.902 1.00 0.00 O ATOM 65634 H1 WAT 3989 128.861 38.131 134.793 1.00 0.00 H ATOM 65635 H2 WAT 3989 128.939 39.355 133.905 1.00 0.00 H TER 65637 WAT 3989 ATOM 65637 O WAT 3990 122.000 32.914 101.163 1.00 0.00 O ATOM 65638 H1 WAT 3990 121.309 33.275 100.607 1.00 0.00 H ATOM 65639 H2 WAT 3990 121.537 32.563 101.924 1.00 0.00 H TER 65641 WAT 3990 ATOM 65641 O WAT 3991 0.820 118.519 68.747 1.00 0.00 O ATOM 65642 H1 WAT 3991 1.386 117.861 68.344 1.00 0.00 H ATOM 65643 H2 WAT 3991 0.928 119.297 68.199 1.00 0.00 H TER 65645 WAT 3991 ATOM 65645 O WAT 3992 68.240 135.088 149.773 1.00 0.00 O ATOM 65646 H1 WAT 3992 69.141 134.789 149.654 1.00 0.00 H ATOM 65647 H2 WAT 3992 68.324 135.943 150.194 1.00 0.00 H TER 65649 WAT 3992 ATOM 65649 O WAT 3993 133.263 109.745 9.407 1.00 0.00 O ATOM 65650 H1 WAT 3993 133.715 110.537 9.699 1.00 0.00 H ATOM 65651 H2 WAT 3993 133.164 109.219 10.200 1.00 0.00 H TER 65653 WAT 3993 ATOM 65653 O WAT 3994 60.372 85.817 156.786 1.00 0.00 O ATOM 65654 H1 WAT 3994 61.161 85.550 157.256 1.00 0.00 H ATOM 65655 H2 WAT 3994 59.841 85.022 156.738 1.00 0.00 H TER 65657 WAT 3994 ATOM 65657 O WAT 3995 87.384 94.183 120.275 1.00 0.00 O ATOM 65658 H1 WAT 3995 88.141 94.749 120.427 1.00 0.00 H ATOM 65659 H2 WAT 3995 86.894 94.619 119.578 1.00 0.00 H TER 65661 WAT 3995 ATOM 65661 O WAT 3996 134.534 52.118 77.736 1.00 0.00 O ATOM 65662 H1 WAT 3996 133.753 52.566 77.409 1.00 0.00 H ATOM 65663 H2 WAT 3996 135.264 52.573 77.316 1.00 0.00 H TER 65665 WAT 3996 ATOM 65665 O WAT 3997 0.540 101.895 106.017 1.00 0.00 O ATOM 65666 H1 WAT 3997 1.305 101.359 105.807 1.00 0.00 H ATOM 65667 H2 WAT 3997 0.785 102.779 105.744 1.00 0.00 H TER 65669 WAT 3997 ATOM 65669 O WAT 3998 102.953 129.772 101.761 1.00 0.00 O ATOM 65670 H1 WAT 3998 103.867 129.954 101.983 1.00 0.00 H ATOM 65671 H2 WAT 3998 102.526 130.628 101.788 1.00 0.00 H TER 65673 WAT 3998 ATOM 65673 O WAT 3999 75.093 59.493 2.074 1.00 0.00 O ATOM 65674 H1 WAT 3999 75.494 58.940 2.745 1.00 0.00 H ATOM 65675 H2 WAT 3999 75.024 60.355 2.484 1.00 0.00 H TER 65677 WAT 3999 ATOM 65677 O WAT 4000 30.519 26.073 116.364 1.00 0.00 O ATOM 65678 H1 WAT 4000 30.307 27.007 116.373 1.00 0.00 H ATOM 65679 H2 WAT 4000 30.412 25.794 117.273 1.00 0.00 H TER 65681 WAT 4000 ATOM 65681 O WAT 4001 82.607 86.394 9.561 1.00 0.00 O ATOM 65682 H1 WAT 4001 82.229 85.538 9.358 1.00 0.00 H ATOM 65683 H2 WAT 4001 83.451 86.396 9.111 1.00 0.00 H TER 65685 WAT 4001 ATOM 65685 O WAT 4002 132.374 18.486 72.721 1.00 0.00 O ATOM 65686 H1 WAT 4002 131.540 18.877 72.458 1.00 0.00 H ATOM 65687 H2 WAT 4002 132.535 17.805 72.068 1.00 0.00 H TER 65689 WAT 4002 ATOM 65689 O WAT 4003 0.534 56.419 119.558 1.00 0.00 O ATOM 65690 H1 WAT 4003 0.040 55.861 118.958 1.00 0.00 H ATOM 65691 H2 WAT 4003 1.448 56.299 119.298 1.00 0.00 H TER 65693 WAT 4003 ATOM 65693 O WAT 4004 110.036 11.689 63.252 1.00 0.00 O ATOM 65694 H1 WAT 4004 109.812 12.085 62.410 1.00 0.00 H ATOM 65695 H2 WAT 4004 109.331 11.962 63.839 1.00 0.00 H TER 65697 WAT 4004 ATOM 65697 O WAT 4005 128.830 31.463 0.702 1.00 0.00 O ATOM 65698 H1 WAT 4005 129.273 31.886 -0.033 1.00 0.00 H ATOM 65699 H2 WAT 4005 129.372 30.699 0.901 1.00 0.00 H TER 65701 WAT 4005 ATOM 65701 O WAT 4006 93.724 38.573 95.041 1.00 0.00 O ATOM 65702 H1 WAT 4006 94.288 39.346 95.055 1.00 0.00 H ATOM 65703 H2 WAT 4006 94.293 37.856 95.320 1.00 0.00 H TER 65705 WAT 4006 ATOM 65705 O WAT 4007 38.564 18.991 127.830 1.00 0.00 O ATOM 65706 H1 WAT 4007 38.045 18.342 127.356 1.00 0.00 H ATOM 65707 H2 WAT 4007 38.552 18.691 128.739 1.00 0.00 H TER 65709 WAT 4007 ATOM 65709 O WAT 4008 144.448 49.458 73.575 1.00 0.00 O ATOM 65710 H1 WAT 4008 143.579 49.116 73.362 1.00 0.00 H ATOM 65711 H2 WAT 4008 144.810 48.824 74.194 1.00 0.00 H TER 65713 WAT 4008 ATOM 65713 O WAT 4009 50.762 123.154 102.482 1.00 0.00 O ATOM 65714 H1 WAT 4009 51.211 123.779 103.052 1.00 0.00 H ATOM 65715 H2 WAT 4009 51.062 123.375 101.601 1.00 0.00 H TER 65717 WAT 4009 ATOM 65717 O WAT 4010 62.487 111.920 80.751 1.00 0.00 O ATOM 65718 H1 WAT 4010 63.328 111.485 80.612 1.00 0.00 H ATOM 65719 H2 WAT 4010 62.599 112.398 81.573 1.00 0.00 H TER 65721 WAT 4010 ATOM 65721 O WAT 4011 60.034 76.337 121.361 1.00 0.00 O ATOM 65722 H1 WAT 4011 60.619 75.765 120.865 1.00 0.00 H ATOM 65723 H2 WAT 4011 60.432 76.389 122.231 1.00 0.00 H TER 65725 WAT 4011 ATOM 65725 O WAT 4012 119.316 13.369 131.006 1.00 0.00 O ATOM 65726 H1 WAT 4012 119.034 13.768 130.183 1.00 0.00 H ATOM 65727 H2 WAT 4012 118.604 12.774 131.240 1.00 0.00 H TER 65729 WAT 4012 ATOM 65729 O WAT 4013 -0.281 99.332 142.724 1.00 0.00 O ATOM 65730 H1 WAT 4013 0.370 99.823 142.224 1.00 0.00 H ATOM 65731 H2 WAT 4013 0.087 98.451 142.798 1.00 0.00 H TER 65733 WAT 4013 ATOM 65733 O WAT 4014 43.413 52.165 73.669 1.00 0.00 O ATOM 65734 H1 WAT 4014 42.585 52.624 73.524 1.00 0.00 H ATOM 65735 H2 WAT 4014 43.717 52.484 74.519 1.00 0.00 H TER 65737 WAT 4014 ATOM 65737 O WAT 4015 75.168 34.149 127.366 1.00 0.00 O ATOM 65738 H1 WAT 4015 74.683 34.271 128.182 1.00 0.00 H ATOM 65739 H2 WAT 4015 75.746 33.405 127.540 1.00 0.00 H TER 65741 WAT 4015 ATOM 65741 O WAT 4016 131.924 54.597 139.033 1.00 0.00 O ATOM 65742 H1 WAT 4016 132.618 54.698 139.685 1.00 0.00 H ATOM 65743 H2 WAT 4016 132.388 54.415 138.216 1.00 0.00 H TER 65745 WAT 4016 ATOM 65745 O WAT 4017 48.682 72.518 13.530 1.00 0.00 O ATOM 65746 H1 WAT 4017 49.544 72.291 13.182 1.00 0.00 H ATOM 65747 H2 WAT 4017 48.076 71.943 13.063 1.00 0.00 H TER 65749 WAT 4017 ATOM 65749 O WAT 4018 62.618 77.535 113.305 1.00 0.00 O ATOM 65750 H1 WAT 4018 62.689 78.445 113.593 1.00 0.00 H ATOM 65751 H2 WAT 4018 61.709 77.295 113.489 1.00 0.00 H TER 65753 WAT 4018 ATOM 65753 O WAT 4019 111.908 102.870 13.767 1.00 0.00 O ATOM 65754 H1 WAT 4019 111.252 102.200 13.577 1.00 0.00 H ATOM 65755 H2 WAT 4019 112.745 102.445 13.580 1.00 0.00 H TER 65757 WAT 4019 ATOM 65757 O WAT 4020 106.638 20.712 151.735 1.00 0.00 O ATOM 65758 H1 WAT 4020 106.536 21.641 151.941 1.00 0.00 H ATOM 65759 H2 WAT 4020 105.798 20.457 151.354 1.00 0.00 H TER 65761 WAT 4020 ATOM 65761 O WAT 4021 82.344 87.605 56.816 1.00 0.00 O ATOM 65762 H1 WAT 4021 81.499 87.238 57.073 1.00 0.00 H ATOM 65763 H2 WAT 4021 82.718 86.953 56.223 1.00 0.00 H TER 65765 WAT 4021 ATOM 65765 O WAT 4022 121.298 38.241 20.032 1.00 0.00 O ATOM 65766 H1 WAT 4022 121.276 37.697 19.244 1.00 0.00 H ATOM 65767 H2 WAT 4022 122.212 38.518 20.106 1.00 0.00 H TER 65769 WAT 4022 ATOM 65769 O WAT 4023 114.043 129.796 145.844 1.00 0.00 O ATOM 65770 H1 WAT 4023 114.157 130.666 146.227 1.00 0.00 H ATOM 65771 H2 WAT 4023 114.307 129.901 144.930 1.00 0.00 H TER 65773 WAT 4023 ATOM 65773 O WAT 4024 75.345 122.144 87.368 1.00 0.00 O ATOM 65774 H1 WAT 4024 74.870 122.956 87.544 1.00 0.00 H ATOM 65775 H2 WAT 4024 74.935 121.793 86.577 1.00 0.00 H TER 65777 WAT 4024 ATOM 65777 O WAT 4025 133.311 109.683 30.351 1.00 0.00 O ATOM 65778 H1 WAT 4025 133.651 109.770 31.241 1.00 0.00 H ATOM 65779 H2 WAT 4025 133.575 108.804 30.078 1.00 0.00 H TER 65781 WAT 4025 ATOM 65781 O WAT 4026 36.733 17.156 64.875 1.00 0.00 O ATOM 65782 H1 WAT 4026 36.536 16.913 63.971 1.00 0.00 H ATOM 65783 H2 WAT 4026 37.241 17.965 64.801 1.00 0.00 H TER 65785 WAT 4026 ATOM 65785 O WAT 4027 43.238 42.599 114.304 1.00 0.00 O ATOM 65786 H1 WAT 4027 43.892 42.261 114.916 1.00 0.00 H ATOM 65787 H2 WAT 4027 43.634 43.393 113.945 1.00 0.00 H TER 65789 WAT 4027 ATOM 65789 O WAT 4028 10.400 111.851 80.514 1.00 0.00 O ATOM 65790 H1 WAT 4028 10.011 110.981 80.607 1.00 0.00 H ATOM 65791 H2 WAT 4028 9.828 112.424 81.025 1.00 0.00 H TER 65793 WAT 4028 ATOM 65793 O WAT 4029 55.343 55.789 93.928 1.00 0.00 O ATOM 65794 H1 WAT 4029 54.872 55.277 94.585 1.00 0.00 H ATOM 65795 H2 WAT 4029 54.873 56.622 93.892 1.00 0.00 H TER 65797 WAT 4029 ATOM 65797 O WAT 4030 18.746 14.256 19.525 1.00 0.00 O ATOM 65798 H1 WAT 4030 18.100 14.404 20.216 1.00 0.00 H ATOM 65799 H2 WAT 4030 19.500 14.785 19.786 1.00 0.00 H TER 65801 WAT 4030 ATOM 65801 O WAT 4031 127.077 86.555 115.148 1.00 0.00 O ATOM 65802 H1 WAT 4031 127.066 85.704 115.585 1.00 0.00 H ATOM 65803 H2 WAT 4031 126.274 86.986 115.443 1.00 0.00 H TER 65805 WAT 4031 ATOM 65805 O WAT 4032 61.849 80.639 80.402 1.00 0.00 O ATOM 65806 H1 WAT 4032 61.460 81.233 79.759 1.00 0.00 H ATOM 65807 H2 WAT 4032 61.691 79.765 80.046 1.00 0.00 H TER 65809 WAT 4032 ATOM 65809 O WAT 4033 78.607 106.072 19.860 1.00 0.00 O ATOM 65810 H1 WAT 4033 77.807 105.557 19.962 1.00 0.00 H ATOM 65811 H2 WAT 4033 78.301 106.943 19.607 1.00 0.00 H TER 65813 WAT 4033 ATOM 65813 O WAT 4034 20.604 85.380 10.195 1.00 0.00 O ATOM 65814 H1 WAT 4034 20.337 86.123 10.737 1.00 0.00 H ATOM 65815 H2 WAT 4034 20.204 84.620 10.618 1.00 0.00 H TER 65817 WAT 4034 ATOM 65817 O WAT 4035 18.221 19.082 130.720 1.00 0.00 O ATOM 65818 H1 WAT 4035 18.736 19.865 130.917 1.00 0.00 H ATOM 65819 H2 WAT 4035 17.396 19.215 131.187 1.00 0.00 H TER 65821 WAT 4035 ATOM 65821 O WAT 4036 4.988 14.108 10.976 1.00 0.00 O ATOM 65822 H1 WAT 4036 4.734 13.471 11.644 1.00 0.00 H ATOM 65823 H2 WAT 4036 5.735 13.706 10.533 1.00 0.00 H TER 65825 WAT 4036 ATOM 65825 O WAT 4037 110.812 89.551 69.702 1.00 0.00 O ATOM 65826 H1 WAT 4037 111.327 90.358 69.675 1.00 0.00 H ATOM 65827 H2 WAT 4037 111.388 88.913 70.123 1.00 0.00 H TER 65829 WAT 4037 ATOM 65829 O WAT 4038 49.559 111.435 15.424 1.00 0.00 O ATOM 65830 H1 WAT 4038 50.346 110.893 15.466 1.00 0.00 H ATOM 65831 H2 WAT 4038 49.367 111.649 16.337 1.00 0.00 H TER 65833 WAT 4038 ATOM 65833 O WAT 4039 65.179 100.536 124.619 1.00 0.00 O ATOM 65834 H1 WAT 4039 65.725 99.777 124.826 1.00 0.00 H ATOM 65835 H2 WAT 4039 64.287 100.250 124.817 1.00 0.00 H TER 65837 WAT 4039 ATOM 65837 O WAT 4040 142.755 41.246 99.847 1.00 0.00 O ATOM 65838 H1 WAT 4040 141.804 41.342 99.786 1.00 0.00 H ATOM 65839 H2 WAT 4040 143.102 42.041 99.442 1.00 0.00 H TER 65841 WAT 4040 ATOM 65841 O WAT 4041 54.208 144.721 17.148 1.00 0.00 O ATOM 65842 H1 WAT 4041 54.148 144.748 18.103 1.00 0.00 H ATOM 65843 H2 WAT 4041 54.835 145.410 16.928 1.00 0.00 H TER 65845 WAT 4041 ATOM 65845 O WAT 4042 105.824 116.161 67.960 1.00 0.00 O ATOM 65846 H1 WAT 4042 105.213 115.424 67.934 1.00 0.00 H ATOM 65847 H2 WAT 4042 106.684 115.765 67.820 1.00 0.00 H TER 65849 WAT 4042 ATOM 65849 O WAT 4043 126.618 138.151 12.666 1.00 0.00 O ATOM 65850 H1 WAT 4043 127.562 138.309 12.690 1.00 0.00 H ATOM 65851 H2 WAT 4043 126.346 138.458 11.801 1.00 0.00 H TER 65853 WAT 4043 ATOM 65853 O WAT 4044 68.876 5.772 55.868 1.00 0.00 O ATOM 65854 H1 WAT 4044 68.424 6.406 56.424 1.00 0.00 H ATOM 65855 H2 WAT 4044 68.933 6.201 55.014 1.00 0.00 H TER 65857 WAT 4044 ATOM 65857 O WAT 4045 114.406 13.206 5.498 1.00 0.00 O ATOM 65858 H1 WAT 4045 114.801 13.828 6.108 1.00 0.00 H ATOM 65859 H2 WAT 4045 113.810 12.687 6.038 1.00 0.00 H TER 65861 WAT 4045 ATOM 65861 O WAT 4046 126.640 6.507 16.758 1.00 0.00 O ATOM 65862 H1 WAT 4046 127.046 6.555 17.623 1.00 0.00 H ATOM 65863 H2 WAT 4046 125.702 6.445 16.937 1.00 0.00 H TER 65865 WAT 4046 ATOM 65865 O WAT 4047 128.003 31.994 110.670 1.00 0.00 O ATOM 65866 H1 WAT 4047 127.740 32.341 111.522 1.00 0.00 H ATOM 65867 H2 WAT 4047 127.473 32.480 110.039 1.00 0.00 H TER 65869 WAT 4047 ATOM 65869 O WAT 4048 127.377 84.815 82.307 1.00 0.00 O ATOM 65870 H1 WAT 4048 127.253 85.606 82.832 1.00 0.00 H ATOM 65871 H2 WAT 4048 126.733 84.891 81.603 1.00 0.00 H TER 65873 WAT 4048 ATOM 65873 O WAT 4049 21.590 3.241 61.522 1.00 0.00 O ATOM 65874 H1 WAT 4049 21.679 3.887 60.821 1.00 0.00 H ATOM 65875 H2 WAT 4049 21.425 3.761 62.308 1.00 0.00 H TER 65877 WAT 4049 ATOM 65877 O WAT 4050 18.049 74.311 25.608 1.00 0.00 O ATOM 65878 H1 WAT 4050 18.305 73.389 25.600 1.00 0.00 H ATOM 65879 H2 WAT 4050 18.087 74.579 24.690 1.00 0.00 H TER 65881 WAT 4050 ATOM 65881 O WAT 4051 1.990 86.868 132.243 1.00 0.00 O ATOM 65882 H1 WAT 4051 2.752 87.125 131.724 1.00 0.00 H ATOM 65883 H2 WAT 4051 2.062 87.385 133.046 1.00 0.00 H TER 65885 WAT 4051 ATOM 65885 O WAT 4052 63.582 142.324 95.908 1.00 0.00 O ATOM 65886 H1 WAT 4052 63.407 142.391 94.969 1.00 0.00 H ATOM 65887 H2 WAT 4052 64.288 141.680 95.974 1.00 0.00 H TER 65889 WAT 4052 ATOM 65889 O WAT 4053 142.464 113.946 143.952 1.00 0.00 O ATOM 65890 H1 WAT 4053 141.509 114.010 143.938 1.00 0.00 H ATOM 65891 H2 WAT 4053 142.759 114.640 143.363 1.00 0.00 H TER 65893 WAT 4053 ATOM 65893 O WAT 4054 129.197 99.265 157.502 1.00 0.00 O ATOM 65894 H1 WAT 4054 128.251 99.186 157.626 1.00 0.00 H ATOM 65895 H2 WAT 4054 129.418 98.562 156.892 1.00 0.00 H TER 65897 WAT 4054 ATOM 65897 O WAT 4055 78.533 130.193 65.953 1.00 0.00 O ATOM 65898 H1 WAT 4055 78.580 130.905 65.316 1.00 0.00 H ATOM 65899 H2 WAT 4055 79.290 130.330 66.522 1.00 0.00 H TER 65901 WAT 4055 ATOM 65901 O WAT 4056 9.217 124.176 144.961 1.00 0.00 O ATOM 65902 H1 WAT 4056 9.409 125.027 145.354 1.00 0.00 H ATOM 65903 H2 WAT 4056 10.077 123.803 144.764 1.00 0.00 H TER 65905 WAT 4056 ATOM 65905 O WAT 4057 106.939 119.869 92.135 1.00 0.00 O ATOM 65906 H1 WAT 4057 107.384 119.068 92.412 1.00 0.00 H ATOM 65907 H2 WAT 4057 107.147 120.507 92.817 1.00 0.00 H TER 65909 WAT 4057 ATOM 65909 O WAT 4058 51.346 139.795 66.587 1.00 0.00 O ATOM 65910 H1 WAT 4058 50.890 138.980 66.376 1.00 0.00 H ATOM 65911 H2 WAT 4058 50.972 140.441 65.988 1.00 0.00 H TER 65913 WAT 4058 ATOM 65913 O WAT 4059 54.267 107.811 150.613 1.00 0.00 O ATOM 65914 H1 WAT 4059 53.649 107.256 151.089 1.00 0.00 H ATOM 65915 H2 WAT 4059 54.327 108.609 151.139 1.00 0.00 H TER 65917 WAT 4059 ATOM 65917 O WAT 4060 79.741 144.166 7.992 1.00 0.00 O ATOM 65918 H1 WAT 4060 79.861 144.738 8.750 1.00 0.00 H ATOM 65919 H2 WAT 4060 78.811 144.242 7.779 1.00 0.00 H TER 65921 WAT 4060 ATOM 65921 O WAT 4061 4.671 80.679 15.874 1.00 0.00 O ATOM 65922 H1 WAT 4061 4.852 80.513 16.800 1.00 0.00 H ATOM 65923 H2 WAT 4061 4.160 79.922 15.590 1.00 0.00 H TER 65925 WAT 4061 ATOM 65925 O WAT 4062 39.017 73.677 105.124 1.00 0.00 O ATOM 65926 H1 WAT 4062 39.867 73.263 104.976 1.00 0.00 H ATOM 65927 H2 WAT 4062 38.405 73.161 104.599 1.00 0.00 H TER 65929 WAT 4062 ATOM 65929 O WAT 4063 31.639 102.844 55.258 1.00 0.00 O ATOM 65930 H1 WAT 4063 30.908 103.442 55.413 1.00 0.00 H ATOM 65931 H2 WAT 4063 32.385 103.260 55.690 1.00 0.00 H TER 65933 WAT 4063 ATOM 65933 O WAT 4064 29.737 12.872 81.341 1.00 0.00 O ATOM 65934 H1 WAT 4064 29.167 13.113 80.611 1.00 0.00 H ATOM 65935 H2 WAT 4064 29.560 11.943 81.487 1.00 0.00 H TER 65937 WAT 4064 ATOM 65937 O WAT 4065 101.875 70.878 153.124 1.00 0.00 O ATOM 65938 H1 WAT 4065 101.262 71.407 152.613 1.00 0.00 H ATOM 65939 H2 WAT 4065 102.663 70.834 152.582 1.00 0.00 H TER 65941 WAT 4065 ATOM 65941 O WAT 4066 10.876 55.716 136.691 1.00 0.00 O ATOM 65942 H1 WAT 4066 11.570 56.375 136.669 1.00 0.00 H ATOM 65943 H2 WAT 4066 10.974 55.293 137.544 1.00 0.00 H TER 65945 WAT 4066 ATOM 65945 O WAT 4067 112.648 118.632 139.562 1.00 0.00 O ATOM 65946 H1 WAT 4067 112.948 117.723 139.591 1.00 0.00 H ATOM 65947 H2 WAT 4067 113.041 119.039 140.334 1.00 0.00 H TER 65949 WAT 4067 ATOM 65949 O WAT 4068 95.658 64.712 16.371 1.00 0.00 O ATOM 65950 H1 WAT 4068 95.407 63.798 16.504 1.00 0.00 H ATOM 65951 H2 WAT 4068 96.180 64.703 15.569 1.00 0.00 H TER 65953 WAT 4068 ATOM 65953 O WAT 4069 15.139 133.411 144.806 1.00 0.00 O ATOM 65954 H1 WAT 4069 15.117 134.358 144.946 1.00 0.00 H ATOM 65955 H2 WAT 4069 15.088 133.308 143.855 1.00 0.00 H TER 65957 WAT 4069 ATOM 65957 O WAT 4070 61.141 21.696 144.746 1.00 0.00 O ATOM 65958 H1 WAT 4070 60.308 21.319 144.463 1.00 0.00 H ATOM 65959 H2 WAT 4070 61.436 22.216 143.998 1.00 0.00 H TER 65961 WAT 4070 ATOM 65961 O WAT 4071 123.606 40.120 158.058 1.00 0.00 O ATOM 65962 H1 WAT 4071 124.051 40.697 158.679 1.00 0.00 H ATOM 65963 H2 WAT 4071 122.764 40.545 157.897 1.00 0.00 H TER 65965 WAT 4071 ATOM 65965 O WAT 4072 64.788 81.676 112.531 1.00 0.00 O ATOM 65966 H1 WAT 4072 65.233 82.297 113.107 1.00 0.00 H ATOM 65967 H2 WAT 4072 64.080 81.317 113.066 1.00 0.00 H TER 65969 WAT 4072 ATOM 65969 O WAT 4073 133.818 1.952 12.530 1.00 0.00 O ATOM 65970 H1 WAT 4073 134.203 1.484 11.790 1.00 0.00 H ATOM 65971 H2 WAT 4073 134.183 1.521 13.303 1.00 0.00 H TER 65973 WAT 4073 ATOM 65973 O WAT 4074 70.369 26.397 80.677 1.00 0.00 O ATOM 65974 H1 WAT 4074 69.966 26.916 81.373 1.00 0.00 H ATOM 65975 H2 WAT 4074 71.162 26.880 80.446 1.00 0.00 H TER 65977 WAT 4074 ATOM 65977 O WAT 4075 8.867 24.750 130.003 1.00 0.00 O ATOM 65978 H1 WAT 4075 8.469 23.895 130.169 1.00 0.00 H ATOM 65979 H2 WAT 4075 8.877 25.179 130.859 1.00 0.00 H TER 65981 WAT 4075 ATOM 65981 O WAT 4076 106.475 128.508 123.274 1.00 0.00 O ATOM 65982 H1 WAT 4076 106.655 127.714 123.777 1.00 0.00 H ATOM 65983 H2 WAT 4076 106.693 129.224 123.871 1.00 0.00 H TER 65985 WAT 4076 ATOM 65985 O WAT 4077 60.939 46.147 105.738 1.00 0.00 O ATOM 65986 H1 WAT 4077 61.077 46.730 106.485 1.00 0.00 H ATOM 65987 H2 WAT 4077 61.109 46.696 104.972 1.00 0.00 H TER 65989 WAT 4077 ATOM 65989 O WAT 4078 81.384 135.050 139.383 1.00 0.00 O ATOM 65990 H1 WAT 4078 81.046 134.370 138.801 1.00 0.00 H ATOM 65991 H2 WAT 4078 80.786 135.788 139.262 1.00 0.00 H TER 65993 WAT 4078 ATOM 65993 O WAT 4079 66.375 53.009 90.325 1.00 0.00 O ATOM 65994 H1 WAT 4079 67.097 52.818 90.923 1.00 0.00 H ATOM 65995 H2 WAT 4079 66.340 52.251 89.741 1.00 0.00 H TER 65997 WAT 4079 ATOM 65997 O WAT 4080 134.398 108.741 21.263 1.00 0.00 O ATOM 65998 H1 WAT 4080 133.898 107.947 21.451 1.00 0.00 H ATOM 65999 H2 WAT 4080 134.679 108.639 20.354 1.00 0.00 H TER 66001 WAT 4080 ATOM 66001 O WAT 4081 71.310 66.960 135.935 1.00 0.00 O ATOM 66002 H1 WAT 4081 70.704 66.287 135.625 1.00 0.00 H ATOM 66003 H2 WAT 4081 70.764 67.558 136.445 1.00 0.00 H TER 66005 WAT 4081 ATOM 66005 O WAT 4082 68.724 3.533 110.188 1.00 0.00 O ATOM 66006 H1 WAT 4082 68.967 2.618 110.327 1.00 0.00 H ATOM 66007 H2 WAT 4082 68.740 3.644 109.237 1.00 0.00 H TER 66009 WAT 4082 ATOM 66009 O WAT 4083 110.028 39.450 8.699 1.00 0.00 O ATOM 66010 H1 WAT 4083 110.032 40.162 9.339 1.00 0.00 H ATOM 66011 H2 WAT 4083 109.480 38.773 9.097 1.00 0.00 H TER 66013 WAT 4083 ATOM 66013 O WAT 4084 66.439 104.314 103.742 1.00 0.00 O ATOM 66014 H1 WAT 4084 65.837 103.639 103.429 1.00 0.00 H ATOM 66015 H2 WAT 4084 65.978 104.726 104.473 1.00 0.00 H TER 66017 WAT 4084 ATOM 66017 O WAT 4085 14.408 114.896 100.896 1.00 0.00 O ATOM 66018 H1 WAT 4085 15.031 114.171 100.847 1.00 0.00 H ATOM 66019 H2 WAT 4085 14.170 115.070 99.985 1.00 0.00 H TER 66021 WAT 4085 ATOM 66021 O WAT 4086 48.916 27.075 87.348 1.00 0.00 O ATOM 66022 H1 WAT 4086 48.640 26.388 87.955 1.00 0.00 H ATOM 66023 H2 WAT 4086 49.740 26.754 86.982 1.00 0.00 H TER 66025 WAT 4086 ATOM 66025 O WAT 4087 23.817 86.968 135.869 1.00 0.00 O ATOM 66026 H1 WAT 4087 23.291 86.800 135.087 1.00 0.00 H ATOM 66027 H2 WAT 4087 24.574 87.458 135.548 1.00 0.00 H TER 66029 WAT 4087 ATOM 66029 O WAT 4088 117.846 133.707 10.837 1.00 0.00 O ATOM 66030 H1 WAT 4088 118.801 133.727 10.786 1.00 0.00 H ATOM 66031 H2 WAT 4088 117.554 133.918 9.950 1.00 0.00 H TER 66033 WAT 4088 ATOM 66033 O WAT 4089 119.735 39.030 141.175 1.00 0.00 O ATOM 66034 H1 WAT 4089 119.784 38.410 140.447 1.00 0.00 H ATOM 66035 H2 WAT 4089 120.648 39.222 141.388 1.00 0.00 H TER 66037 WAT 4089 ATOM 66037 O WAT 4090 109.461 33.595 120.802 1.00 0.00 O ATOM 66038 H1 WAT 4090 109.613 33.310 121.703 1.00 0.00 H ATOM 66039 H2 WAT 4090 109.488 34.551 120.845 1.00 0.00 H TER 66041 WAT 4090 ATOM 66041 O WAT 4091 36.566 143.684 95.619 1.00 0.00 O ATOM 66042 H1 WAT 4091 37.040 143.023 96.125 1.00 0.00 H ATOM 66043 H2 WAT 4091 35.779 143.232 95.313 1.00 0.00 H TER 66045 WAT 4091 ATOM 66045 O WAT 4092 57.678 47.379 88.855 1.00 0.00 O ATOM 66046 H1 WAT 4092 57.444 47.816 89.674 1.00 0.00 H ATOM 66047 H2 WAT 4092 57.757 48.089 88.218 1.00 0.00 H TER 66049 WAT 4092 ATOM 66049 O WAT 4093 91.053 106.979 117.513 1.00 0.00 O ATOM 66050 H1 WAT 4093 91.257 107.128 116.590 1.00 0.00 H ATOM 66051 H2 WAT 4093 91.567 106.207 117.750 1.00 0.00 H TER 66053 WAT 4093 ATOM 66053 O WAT 4094 5.585 79.108 79.899 1.00 0.00 O ATOM 66054 H1 WAT 4094 4.907 79.626 79.465 1.00 0.00 H ATOM 66055 H2 WAT 4094 5.143 78.297 80.150 1.00 0.00 H TER 66057 WAT 4094 ATOM 66057 O WAT 4095 49.074 107.137 69.588 1.00 0.00 O ATOM 66058 H1 WAT 4095 48.733 107.934 69.994 1.00 0.00 H ATOM 66059 H2 WAT 4095 49.939 107.386 69.261 1.00 0.00 H TER 66061 WAT 4095 ATOM 66061 O WAT 4096 64.537 35.262 129.729 1.00 0.00 O ATOM 66062 H1 WAT 4096 64.735 35.234 128.793 1.00 0.00 H ATOM 66063 H2 WAT 4096 65.381 35.435 130.147 1.00 0.00 H TER 66065 WAT 4096 ATOM 66065 O WAT 4097 6.776 39.221 98.775 1.00 0.00 O ATOM 66066 H1 WAT 4097 6.034 38.815 98.327 1.00 0.00 H ATOM 66067 H2 WAT 4097 6.385 39.917 99.303 1.00 0.00 H TER 66069 WAT 4097 ATOM 66069 O WAT 4098 117.745 74.937 86.330 1.00 0.00 O ATOM 66070 H1 WAT 4098 117.632 74.096 86.774 1.00 0.00 H ATOM 66071 H2 WAT 4098 118.687 75.104 86.372 1.00 0.00 H TER 66073 WAT 4098 ATOM 66073 O WAT 4099 22.393 131.840 12.720 1.00 0.00 O ATOM 66074 H1 WAT 4099 21.641 131.544 12.206 1.00 0.00 H ATOM 66075 H2 WAT 4099 23.153 131.491 12.256 1.00 0.00 H TER 66077 WAT 4099 ATOM 66077 O WAT 4100 140.061 70.701 102.737 1.00 0.00 O ATOM 66078 H1 WAT 4100 140.839 70.427 102.251 1.00 0.00 H ATOM 66079 H2 WAT 4100 140.119 70.229 103.568 1.00 0.00 H TER 66081 WAT 4100 ATOM 66081 O WAT 4101 121.360 123.922 66.602 1.00 0.00 O ATOM 66082 H1 WAT 4101 121.653 123.058 66.314 1.00 0.00 H ATOM 66083 H2 WAT 4101 121.643 123.979 67.515 1.00 0.00 H TER 66085 WAT 4101 ATOM 66085 O WAT 4102 72.532 70.392 72.429 1.00 0.00 O ATOM 66086 H1 WAT 4102 72.939 70.554 73.280 1.00 0.00 H ATOM 66087 H2 WAT 4102 71.959 69.640 72.577 1.00 0.00 H TER 66089 WAT 4102 ATOM 66089 O WAT 4103 125.648 77.465 142.747 1.00 0.00 O ATOM 66090 H1 WAT 4103 125.736 76.872 143.493 1.00 0.00 H ATOM 66091 H2 WAT 4103 126.063 78.278 143.037 1.00 0.00 H TER 66093 WAT 4103 ATOM 66093 O WAT 4104 118.916 89.290 122.049 1.00 0.00 O ATOM 66094 H1 WAT 4104 119.599 89.175 121.387 1.00 0.00 H ATOM 66095 H2 WAT 4104 118.320 89.935 121.668 1.00 0.00 H TER 66097 WAT 4104 ATOM 66097 O WAT 4105 96.983 138.030 69.134 1.00 0.00 O ATOM 66098 H1 WAT 4105 97.909 138.268 69.083 1.00 0.00 H ATOM 66099 H2 WAT 4105 96.729 137.857 68.228 1.00 0.00 H TER 66101 WAT 4105 ATOM 66101 O WAT 4106 138.182 44.441 146.900 1.00 0.00 O ATOM 66102 H1 WAT 4106 138.867 43.929 147.331 1.00 0.00 H ATOM 66103 H2 WAT 4106 137.415 44.336 147.464 1.00 0.00 H TER 66105 WAT 4106 ATOM 66105 O WAT 4107 54.930 21.294 132.942 1.00 0.00 O ATOM 66106 H1 WAT 4107 54.464 20.493 133.178 1.00 0.00 H ATOM 66107 H2 WAT 4107 54.795 21.380 131.998 1.00 0.00 H TER 66109 WAT 4107 ATOM 66109 O WAT 4108 131.145 24.427 119.798 1.00 0.00 O ATOM 66110 H1 WAT 4108 131.352 24.621 118.884 1.00 0.00 H ATOM 66111 H2 WAT 4108 131.820 23.805 120.069 1.00 0.00 H TER 66113 WAT 4108 ATOM 66113 O WAT 4109 94.558 127.650 147.389 1.00 0.00 O ATOM 66114 H1 WAT 4109 93.742 128.079 147.131 1.00 0.00 H ATOM 66115 H2 WAT 4109 95.114 127.706 146.612 1.00 0.00 H TER 66117 WAT 4109 ATOM 66117 O WAT 4110 114.946 31.656 88.300 1.00 0.00 O ATOM 66118 H1 WAT 4110 114.971 32.326 88.983 1.00 0.00 H ATOM 66119 H2 WAT 4110 115.810 31.246 88.336 1.00 0.00 H TER 66121 WAT 4110 ATOM 66121 O WAT 4111 9.157 18.827 152.001 1.00 0.00 O ATOM 66122 H1 WAT 4111 8.636 19.536 151.624 1.00 0.00 H ATOM 66123 H2 WAT 4111 8.515 18.158 152.239 1.00 0.00 H TER 66125 WAT 4111 ATOM 66125 O WAT 4112 141.843 144.909 8.995 1.00 0.00 O ATOM 66126 H1 WAT 4112 141.983 145.463 9.762 1.00 0.00 H ATOM 66127 H2 WAT 4112 141.135 145.338 8.515 1.00 0.00 H TER 66129 WAT 4112 ATOM 66129 O WAT 4113 5.296 50.069 128.699 1.00 0.00 O ATOM 66130 H1 WAT 4113 5.309 50.941 129.094 1.00 0.00 H ATOM 66131 H2 WAT 4113 5.004 49.491 129.405 1.00 0.00 H TER 66133 WAT 4113 ATOM 66133 O WAT 4114 15.139 6.155 6.247 1.00 0.00 O ATOM 66134 H1 WAT 4114 15.711 6.907 6.095 1.00 0.00 H ATOM 66135 H2 WAT 4114 14.909 6.212 7.175 1.00 0.00 H TER 66137 WAT 4114 ATOM 66137 O WAT 4115 79.381 103.223 63.791 1.00 0.00 O ATOM 66138 H1 WAT 4115 79.142 102.344 64.087 1.00 0.00 H ATOM 66139 H2 WAT 4115 79.390 103.751 64.589 1.00 0.00 H TER 66141 WAT 4115 ATOM 66141 O WAT 4116 34.564 127.422 5.355 1.00 0.00 O ATOM 66142 H1 WAT 4116 35.147 126.667 5.282 1.00 0.00 H ATOM 66143 H2 WAT 4116 33.969 127.338 4.610 1.00 0.00 H TER 66145 WAT 4116 ATOM 66145 O WAT 4117 114.116 52.966 131.528 1.00 0.00 O ATOM 66146 H1 WAT 4117 114.454 52.897 132.420 1.00 0.00 H ATOM 66147 H2 WAT 4117 114.063 53.908 131.364 1.00 0.00 H TER 66149 WAT 4117 ATOM 66149 O WAT 4118 131.745 1.717 111.270 1.00 0.00 O ATOM 66150 H1 WAT 4118 132.536 1.403 110.832 1.00 0.00 H ATOM 66151 H2 WAT 4118 131.556 1.052 111.931 1.00 0.00 H TER 66153 WAT 4118 ATOM 66153 O WAT 4119 125.019 83.856 138.876 1.00 0.00 O ATOM 66154 H1 WAT 4119 125.102 83.042 139.373 1.00 0.00 H ATOM 66155 H2 WAT 4119 124.229 83.736 138.350 1.00 0.00 H TER 66157 WAT 4119 ATOM 66157 O WAT 4120 46.508 27.124 138.166 1.00 0.00 O ATOM 66158 H1 WAT 4120 46.586 27.286 137.226 1.00 0.00 H ATOM 66159 H2 WAT 4120 47.174 26.461 138.350 1.00 0.00 H TER 66161 WAT 4120 ATOM 66161 O WAT 4121 95.812 30.882 144.659 1.00 0.00 O ATOM 66162 H1 WAT 4121 96.711 31.205 144.718 1.00 0.00 H ATOM 66163 H2 WAT 4121 95.272 31.671 144.701 1.00 0.00 H TER 66165 WAT 4121 ATOM 66165 O WAT 4122 103.645 102.313 24.307 1.00 0.00 O ATOM 66166 H1 WAT 4122 104.016 102.258 23.426 1.00 0.00 H ATOM 66167 H2 WAT 4122 103.363 103.224 24.392 1.00 0.00 H TER 66169 WAT 4122 ATOM 66169 O WAT 4123 91.020 60.692 98.658 1.00 0.00 O ATOM 66170 H1 WAT 4123 91.945 60.450 98.625 1.00 0.00 H ATOM 66171 H2 WAT 4123 90.598 60.113 98.023 1.00 0.00 H TER 66173 WAT 4123 ATOM 66173 O WAT 4124 34.674 12.199 76.793 1.00 0.00 O ATOM 66174 H1 WAT 4124 34.768 11.296 76.488 1.00 0.00 H ATOM 66175 H2 WAT 4124 33.885 12.518 76.356 1.00 0.00 H TER 66177 WAT 4124 ATOM 66177 O WAT 4125 16.100 51.503 137.898 1.00 0.00 O ATOM 66178 H1 WAT 4125 15.415 52.169 137.845 1.00 0.00 H ATOM 66179 H2 WAT 4125 15.624 50.672 137.905 1.00 0.00 H TER 66181 WAT 4125 ATOM 66181 O WAT 4126 65.166 10.860 87.805 1.00 0.00 O ATOM 66182 H1 WAT 4126 65.334 10.690 88.732 1.00 0.00 H ATOM 66183 H2 WAT 4126 65.289 10.011 87.379 1.00 0.00 H TER 66185 WAT 4126 ATOM 66185 O WAT 4127 128.459 114.096 107.625 1.00 0.00 O ATOM 66186 H1 WAT 4127 128.251 114.332 106.720 1.00 0.00 H ATOM 66187 H2 WAT 4127 128.577 113.146 107.603 1.00 0.00 H TER 66189 WAT 4127 ATOM 66189 O WAT 4128 52.318 7.828 7.035 1.00 0.00 O ATOM 66190 H1 WAT 4128 51.410 7.669 7.293 1.00 0.00 H ATOM 66191 H2 WAT 4128 52.725 6.962 7.047 1.00 0.00 H TER 66193 WAT 4128 ATOM 66193 O WAT 4129 60.102 15.104 143.293 1.00 0.00 O ATOM 66194 H1 WAT 4129 60.012 14.163 143.444 1.00 0.00 H ATOM 66195 H2 WAT 4129 60.918 15.190 142.800 1.00 0.00 H TER 66197 WAT 4129 ATOM 66197 O WAT 4130 83.300 31.669 81.074 1.00 0.00 O ATOM 66198 H1 WAT 4130 83.969 31.472 81.730 1.00 0.00 H ATOM 66199 H2 WAT 4130 83.786 32.060 80.348 1.00 0.00 H TER 66201 WAT 4130 ATOM 66201 O WAT 4131 91.697 139.371 76.127 1.00 0.00 O ATOM 66202 H1 WAT 4131 90.872 139.851 76.205 1.00 0.00 H ATOM 66203 H2 WAT 4131 92.001 139.560 75.239 1.00 0.00 H TER 66205 WAT 4131 ATOM 66205 O WAT 4132 106.526 51.241 3.620 1.00 0.00 O ATOM 66206 H1 WAT 4132 106.838 52.143 3.555 1.00 0.00 H ATOM 66207 H2 WAT 4132 105.769 51.291 4.203 1.00 0.00 H TER 66209 WAT 4132 ATOM 66209 O WAT 4133 133.328 5.349 17.625 1.00 0.00 O ATOM 66210 H1 WAT 4133 132.788 5.796 18.276 1.00 0.00 H ATOM 66211 H2 WAT 4133 134.204 5.716 17.747 1.00 0.00 H TER 66213 WAT 4133 ATOM 66213 O WAT 4134 23.917 100.876 74.593 1.00 0.00 O ATOM 66214 H1 WAT 4134 24.457 100.086 74.572 1.00 0.00 H ATOM 66215 H2 WAT 4134 24.316 101.422 75.270 1.00 0.00 H TER 66217 WAT 4134 ATOM 66217 O WAT 4135 137.551 54.602 157.839 1.00 0.00 O ATOM 66218 H1 WAT 4135 136.863 54.100 158.275 1.00 0.00 H ATOM 66219 H2 WAT 4135 137.161 54.872 157.007 1.00 0.00 H TER 66221 WAT 4135 ATOM 66221 O WAT 4136 4.919 50.943 4.043 1.00 0.00 O ATOM 66222 H1 WAT 4136 4.291 51.665 4.019 1.00 0.00 H ATOM 66223 H2 WAT 4136 5.763 51.354 3.857 1.00 0.00 H TER 66225 WAT 4136 ATOM 66225 O WAT 4137 22.831 66.761 11.890 1.00 0.00 O ATOM 66226 H1 WAT 4137 22.439 67.000 12.730 1.00 0.00 H ATOM 66227 H2 WAT 4137 23.459 66.072 12.105 1.00 0.00 H TER 66229 WAT 4137 ATOM 66229 O WAT 4138 16.662 35.288 128.995 1.00 0.00 O ATOM 66230 H1 WAT 4138 16.133 34.505 129.149 1.00 0.00 H ATOM 66231 H2 WAT 4138 17.560 34.961 128.930 1.00 0.00 H TER 66233 WAT 4138 ATOM 66233 O WAT 4139 4.882 87.835 97.669 1.00 0.00 O ATOM 66234 H1 WAT 4139 4.807 87.187 96.969 1.00 0.00 H ATOM 66235 H2 WAT 4139 4.135 88.419 97.535 1.00 0.00 H TER 66237 WAT 4139 ATOM 66237 O WAT 4140 44.577 135.603 150.985 1.00 0.00 O ATOM 66238 H1 WAT 4140 44.868 136.075 150.204 1.00 0.00 H ATOM 66239 H2 WAT 4140 43.967 136.204 151.414 1.00 0.00 H TER 66241 WAT 4140 ATOM 66241 O WAT 4141 132.762 68.538 150.215 1.00 0.00 O ATOM 66242 H1 WAT 4141 132.371 67.713 149.927 1.00 0.00 H ATOM 66243 H2 WAT 4141 132.886 69.039 149.409 1.00 0.00 H TER 66245 WAT 4141 ATOM 66245 O WAT 4142 98.843 96.721 129.943 1.00 0.00 O ATOM 66246 H1 WAT 4142 98.047 96.680 130.474 1.00 0.00 H ATOM 66247 H2 WAT 4142 98.737 96.020 129.300 1.00 0.00 H TER 66249 WAT 4142 ATOM 66249 O WAT 4143 87.635 71.379 111.453 1.00 0.00 O ATOM 66250 H1 WAT 4143 86.758 71.041 111.278 1.00 0.00 H ATOM 66251 H2 WAT 4143 88.224 70.727 111.074 1.00 0.00 H TER 66253 WAT 4143 ATOM 66253 O WAT 4144 34.687 10.822 7.047 1.00 0.00 O ATOM 66254 H1 WAT 4144 35.025 11.679 6.787 1.00 0.00 H ATOM 66255 H2 WAT 4144 33.737 10.933 7.061 1.00 0.00 H TER 66257 WAT 4144 ATOM 66257 O WAT 4145 133.547 145.792 62.009 1.00 0.00 O ATOM 66258 H1 WAT 4145 134.461 145.511 62.050 1.00 0.00 H ATOM 66259 H2 WAT 4145 133.210 145.396 61.205 1.00 0.00 H TER 66261 WAT 4145 ATOM 66261 O WAT 4146 64.076 50.352 79.512 1.00 0.00 O ATOM 66262 H1 WAT 4146 64.493 49.702 78.947 1.00 0.00 H ATOM 66263 H2 WAT 4146 63.446 49.851 80.029 1.00 0.00 H TER 66265 WAT 4146 ATOM 66265 O WAT 4147 53.661 62.762 76.657 1.00 0.00 O ATOM 66266 H1 WAT 4147 53.308 63.256 77.397 1.00 0.00 H ATOM 66267 H2 WAT 4147 53.236 61.906 76.717 1.00 0.00 H TER 66269 WAT 4147 ATOM 66269 O WAT 4148 89.893 29.017 84.343 1.00 0.00 O ATOM 66270 H1 WAT 4148 89.967 28.312 83.700 1.00 0.00 H ATOM 66271 H2 WAT 4148 90.272 29.780 83.907 1.00 0.00 H TER 66273 WAT 4148 ATOM 66273 O WAT 4149 35.444 99.375 143.458 1.00 0.00 O ATOM 66274 H1 WAT 4149 34.771 100.024 143.256 1.00 0.00 H ATOM 66275 H2 WAT 4149 36.229 99.892 143.638 1.00 0.00 H TER 66277 WAT 4149 ATOM 66277 O WAT 4150 75.581 12.559 2.274 1.00 0.00 O ATOM 66278 H1 WAT 4150 76.420 13.019 2.265 1.00 0.00 H ATOM 66279 H2 WAT 4150 75.023 13.065 1.684 1.00 0.00 H TER 66281 WAT 4150 ATOM 66281 O WAT 4151 82.762 109.699 135.903 1.00 0.00 O ATOM 66282 H1 WAT 4151 82.607 110.439 136.489 1.00 0.00 H ATOM 66283 H2 WAT 4151 82.567 110.039 135.030 1.00 0.00 H TER 66285 WAT 4151 ATOM 66285 O WAT 4152 5.595 49.144 6.435 1.00 0.00 O ATOM 66286 H1 WAT 4152 5.403 50.054 6.212 1.00 0.00 H ATOM 66287 H2 WAT 4152 5.335 48.647 5.659 1.00 0.00 H TER 66289 WAT 4152 ATOM 66289 O WAT 4153 79.433 15.017 67.555 1.00 0.00 O ATOM 66290 H1 WAT 4153 79.301 15.570 66.785 1.00 0.00 H ATOM 66291 H2 WAT 4153 79.173 15.568 68.293 1.00 0.00 H TER 66293 WAT 4153 ATOM 66293 O WAT 4154 24.853 56.273 144.408 1.00 0.00 O ATOM 66294 H1 WAT 4154 25.510 56.932 144.184 1.00 0.00 H ATOM 66295 H2 WAT 4154 24.975 55.582 143.756 1.00 0.00 H TER 66297 WAT 4154 ATOM 66297 O WAT 4155 22.955 122.886 137.854 1.00 0.00 O ATOM 66298 H1 WAT 4155 23.164 122.061 137.417 1.00 0.00 H ATOM 66299 H2 WAT 4155 23.292 123.561 137.266 1.00 0.00 H TER 66301 WAT 4155 ATOM 66301 O WAT 4156 101.323 144.404 145.832 1.00 0.00 O ATOM 66302 H1 WAT 4156 100.490 144.432 145.362 1.00 0.00 H ATOM 66303 H2 WAT 4156 101.987 144.412 145.143 1.00 0.00 H TER 66305 WAT 4156 ATOM 66305 O WAT 4157 56.934 23.140 78.685 1.00 0.00 O ATOM 66306 H1 WAT 4157 56.982 23.169 77.729 1.00 0.00 H ATOM 66307 H2 WAT 4157 56.493 22.313 78.877 1.00 0.00 H TER 66309 WAT 4157 ATOM 66309 O WAT 4158 30.628 121.960 105.683 1.00 0.00 O ATOM 66310 H1 WAT 4158 30.312 121.057 105.696 1.00 0.00 H ATOM 66311 H2 WAT 4158 29.863 122.479 105.436 1.00 0.00 H TER 66313 WAT 4158 ATOM 66313 O WAT 4159 77.681 10.208 128.438 1.00 0.00 O ATOM 66314 H1 WAT 4159 77.486 9.601 127.724 1.00 0.00 H ATOM 66315 H2 WAT 4159 78.164 10.921 128.021 1.00 0.00 H TER 66317 WAT 4159 ATOM 66317 O WAT 4160 59.504 43.635 121.425 1.00 0.00 O ATOM 66318 H1 WAT 4160 59.297 42.972 122.084 1.00 0.00 H ATOM 66319 H2 WAT 4160 59.485 44.463 121.905 1.00 0.00 H TER 66321 WAT 4160 ATOM 66321 O WAT 4161 37.837 77.079 125.729 1.00 0.00 O ATOM 66322 H1 WAT 4161 38.736 76.843 125.498 1.00 0.00 H ATOM 66323 H2 WAT 4161 37.459 76.271 126.075 1.00 0.00 H TER 66325 WAT 4161 ATOM 66325 O WAT 4162 133.768 36.984 129.699 1.00 0.00 O ATOM 66326 H1 WAT 4162 134.112 37.585 129.038 1.00 0.00 H ATOM 66327 H2 WAT 4162 134.523 36.774 130.248 1.00 0.00 H TER 66329 WAT 4162 ATOM 66329 O WAT 4163 68.078 54.602 107.462 1.00 0.00 O ATOM 66330 H1 WAT 4163 68.372 55.441 107.105 1.00 0.00 H ATOM 66331 H2 WAT 4163 67.668 54.157 106.721 1.00 0.00 H TER 66333 WAT 4163 ATOM 66333 O WAT 4164 91.959 11.516 82.299 1.00 0.00 O ATOM 66334 H1 WAT 4164 92.882 11.711 82.134 1.00 0.00 H ATOM 66335 H2 WAT 4164 91.725 10.879 81.625 1.00 0.00 H TER 66337 WAT 4164 ATOM 66337 O WAT 4165 6.633 142.457 96.827 1.00 0.00 O ATOM 66338 H1 WAT 4165 7.434 141.989 96.589 1.00 0.00 H ATOM 66339 H2 WAT 4165 6.807 142.797 97.705 1.00 0.00 H TER 66341 WAT 4165 ATOM 66341 O WAT 4166 104.429 117.653 126.123 1.00 0.00 O ATOM 66342 H1 WAT 4166 104.201 116.758 125.871 1.00 0.00 H ATOM 66343 H2 WAT 4166 103.835 118.204 125.612 1.00 0.00 H TER 66345 WAT 4166 ATOM 66345 O WAT 4167 64.125 121.716 92.651 1.00 0.00 O ATOM 66346 H1 WAT 4167 63.606 121.307 91.958 1.00 0.00 H ATOM 66347 H2 WAT 4167 63.489 121.925 93.335 1.00 0.00 H TER 66349 WAT 4167 ATOM 66349 O WAT 4168 131.056 60.012 73.016 1.00 0.00 O ATOM 66350 H1 WAT 4168 131.477 60.645 72.435 1.00 0.00 H ATOM 66351 H2 WAT 4168 131.247 59.161 72.623 1.00 0.00 H TER 66353 WAT 4168 ATOM 66353 O WAT 4169 95.569 44.635 26.242 1.00 0.00 O ATOM 66354 H1 WAT 4169 96.379 44.955 25.844 1.00 0.00 H ATOM 66355 H2 WAT 4169 95.361 43.838 25.755 1.00 0.00 H TER 66357 WAT 4169 ATOM 66357 O WAT 4170 146.080 42.638 59.400 1.00 0.00 O ATOM 66358 H1 WAT 4170 145.313 42.386 59.913 1.00 0.00 H ATOM 66359 H2 WAT 4170 145.730 43.188 58.699 1.00 0.00 H TER 66361 WAT 4170 ATOM 66361 O WAT 4171 68.167 63.425 99.944 1.00 0.00 O ATOM 66362 H1 WAT 4171 67.356 63.349 99.441 1.00 0.00 H ATOM 66363 H2 WAT 4171 68.745 63.947 99.389 1.00 0.00 H TER 66365 WAT 4171 ATOM 66365 O WAT 4172 70.527 7.977 17.075 1.00 0.00 O ATOM 66366 H1 WAT 4172 70.625 7.243 17.683 1.00 0.00 H ATOM 66367 H2 WAT 4172 69.591 8.175 17.087 1.00 0.00 H TER 66369 WAT 4172 ATOM 66369 O WAT 4173 64.795 99.163 75.219 1.00 0.00 O ATOM 66370 H1 WAT 4173 65.148 98.281 75.104 1.00 0.00 H ATOM 66371 H2 WAT 4173 63.847 99.053 75.142 1.00 0.00 H TER 66373 WAT 4173 ATOM 66373 O WAT 4174 122.122 69.709 66.103 1.00 0.00 O ATOM 66374 H1 WAT 4174 121.225 69.813 65.783 1.00 0.00 H ATOM 66375 H2 WAT 4174 122.210 70.372 66.788 1.00 0.00 H TER 66377 WAT 4174 ATOM 66377 O WAT 4175 28.974 133.252 58.002 1.00 0.00 O ATOM 66378 H1 WAT 4175 29.386 132.393 57.910 1.00 0.00 H ATOM 66379 H2 WAT 4175 29.268 133.742 57.234 1.00 0.00 H TER 66381 WAT 4175 ATOM 66381 O WAT 4176 77.985 91.550 93.048 1.00 0.00 O ATOM 66382 H1 WAT 4176 77.276 92.184 92.940 1.00 0.00 H ATOM 66383 H2 WAT 4176 78.191 91.578 93.983 1.00 0.00 H TER 66385 WAT 4176 ATOM 66385 O WAT 4177 102.292 98.046 68.639 1.00 0.00 O ATOM 66386 H1 WAT 4177 102.526 98.617 67.907 1.00 0.00 H ATOM 66387 H2 WAT 4177 101.716 98.581 69.185 1.00 0.00 H TER 66389 WAT 4177 ATOM 66389 O WAT 4178 64.447 134.123 11.427 1.00 0.00 O ATOM 66390 H1 WAT 4178 64.712 133.917 10.531 1.00 0.00 H ATOM 66391 H2 WAT 4178 65.268 134.153 11.919 1.00 0.00 H TER 66393 WAT 4178 ATOM 66393 O WAT 4179 124.547 66.859 75.351 1.00 0.00 O ATOM 66394 H1 WAT 4179 125.220 66.743 74.680 1.00 0.00 H ATOM 66395 H2 WAT 4179 124.711 67.733 75.705 1.00 0.00 H TER 66397 WAT 4179 ATOM 66397 O WAT 4180 3.526 75.621 142.932 1.00 0.00 O ATOM 66398 H1 WAT 4180 3.515 74.695 143.174 1.00 0.00 H ATOM 66399 H2 WAT 4180 2.651 75.787 142.581 1.00 0.00 H TER 66401 WAT 4180 ATOM 66401 O WAT 4181 123.133 37.723 142.134 1.00 0.00 O ATOM 66402 H1 WAT 4181 123.192 36.811 142.421 1.00 0.00 H ATOM 66403 H2 WAT 4181 124.041 37.982 141.974 1.00 0.00 H TER 66405 WAT 4181 ATOM 66405 O WAT 4182 129.271 17.613 98.380 1.00 0.00 O ATOM 66406 H1 WAT 4182 130.211 17.437 98.357 1.00 0.00 H ATOM 66407 H2 WAT 4182 128.921 17.142 97.623 1.00 0.00 H TER 66409 WAT 4182 ATOM 66409 O WAT 4183 10.826 3.813 99.683 1.00 0.00 O ATOM 66410 H1 WAT 4183 11.561 3.231 99.873 1.00 0.00 H ATOM 66411 H2 WAT 4183 10.588 3.612 98.778 1.00 0.00 H TER 66413 WAT 4183 ATOM 66413 O WAT 4184 92.544 92.160 57.193 1.00 0.00 O ATOM 66414 H1 WAT 4184 91.784 91.586 57.103 1.00 0.00 H ATOM 66415 H2 WAT 4184 92.355 92.899 56.614 1.00 0.00 H TER 66417 WAT 4184 ATOM 66417 O WAT 4185 53.794 27.886 107.908 1.00 0.00 O ATOM 66418 H1 WAT 4185 54.609 27.550 108.279 1.00 0.00 H ATOM 66419 H2 WAT 4185 53.891 28.838 107.937 1.00 0.00 H TER 66421 WAT 4185 ATOM 66421 O WAT 4186 143.383 38.293 6.112 1.00 0.00 O ATOM 66422 H1 WAT 4186 144.252 37.939 5.924 1.00 0.00 H ATOM 66423 H2 WAT 4186 143.081 37.795 6.872 1.00 0.00 H TER 66425 WAT 4186 ATOM 66425 O WAT 4187 134.434 135.788 84.016 1.00 0.00 O ATOM 66426 H1 WAT 4187 134.699 136.372 84.727 1.00 0.00 H ATOM 66427 H2 WAT 4187 134.381 136.356 83.247 1.00 0.00 H TER 66429 WAT 4187 ATOM 66429 O WAT 4188 20.050 71.915 144.263 1.00 0.00 O ATOM 66430 H1 WAT 4188 20.269 71.337 143.532 1.00 0.00 H ATOM 66431 H2 WAT 4188 20.375 72.774 143.994 1.00 0.00 H TER 66433 WAT 4188 ATOM 66433 O WAT 4189 89.234 21.931 149.242 1.00 0.00 O ATOM 66434 H1 WAT 4189 89.242 21.000 149.020 1.00 0.00 H ATOM 66435 H2 WAT 4189 90.008 22.288 148.806 1.00 0.00 H TER 66437 WAT 4189 ATOM 66437 O WAT 4190 23.484 81.285 2.877 1.00 0.00 O ATOM 66438 H1 WAT 4190 24.135 81.241 2.176 1.00 0.00 H ATOM 66439 H2 WAT 4190 23.676 80.529 3.431 1.00 0.00 H TER 66441 WAT 4190 ATOM 66441 O WAT 4191 102.819 4.344 122.145 1.00 0.00 O ATOM 66442 H1 WAT 4191 103.013 3.552 121.644 1.00 0.00 H ATOM 66443 H2 WAT 4191 103.012 4.107 123.052 1.00 0.00 H TER 66445 WAT 4191 ATOM 66445 O WAT 4192 128.934 101.999 110.946 1.00 0.00 O ATOM 66446 H1 WAT 4192 129.824 101.752 111.200 1.00 0.00 H ATOM 66447 H2 WAT 4192 128.691 102.687 111.566 1.00 0.00 H TER 66449 WAT 4192 ATOM 66449 O WAT 4193 81.539 144.107 11.512 1.00 0.00 O ATOM 66450 H1 WAT 4193 81.574 144.919 11.006 1.00 0.00 H ATOM 66451 H2 WAT 4193 81.582 144.391 12.424 1.00 0.00 H TER 66453 WAT 4193 ATOM 66453 O WAT 4194 110.833 71.541 8.334 1.00 0.00 O ATOM 66454 H1 WAT 4194 110.916 72.166 7.614 1.00 0.00 H ATOM 66455 H2 WAT 4194 111.574 71.736 8.908 1.00 0.00 H TER 66457 WAT 4194 ATOM 66457 O WAT 4195 10.681 73.743 67.330 1.00 0.00 O ATOM 66458 H1 WAT 4195 11.014 73.988 68.194 1.00 0.00 H ATOM 66459 H2 WAT 4195 10.080 74.450 67.096 1.00 0.00 H TER 66461 WAT 4195 ATOM 66461 O WAT 4196 72.958 82.520 139.315 1.00 0.00 O ATOM 66462 H1 WAT 4196 73.303 82.854 138.487 1.00 0.00 H ATOM 66463 H2 WAT 4196 72.036 82.779 139.313 1.00 0.00 H TER 66465 WAT 4196 ATOM 66465 O WAT 4197 63.590 12.042 101.840 1.00 0.00 O ATOM 66466 H1 WAT 4197 63.312 11.884 102.742 1.00 0.00 H ATOM 66467 H2 WAT 4197 62.797 11.920 101.319 1.00 0.00 H TER 66469 WAT 4197 ATOM 66469 O WAT 4198 139.263 138.384 75.654 1.00 0.00 O ATOM 66470 H1 WAT 4198 138.334 138.374 75.886 1.00 0.00 H ATOM 66471 H2 WAT 4198 139.308 137.905 74.826 1.00 0.00 H TER 66473 WAT 4198 ATOM 66473 O WAT 4199 127.371 98.555 126.972 1.00 0.00 O ATOM 66474 H1 WAT 4199 126.754 99.285 127.021 1.00 0.00 H ATOM 66475 H2 WAT 4199 128.221 98.970 126.823 1.00 0.00 H TER 66477 WAT 4199 ATOM 66477 O WAT 4200 90.790 69.804 66.166 1.00 0.00 O ATOM 66478 H1 WAT 4200 90.571 69.968 65.248 1.00 0.00 H ATOM 66479 H2 WAT 4200 90.792 70.672 66.570 1.00 0.00 H TER 66481 WAT 4200 ATOM 66481 O WAT 4201 48.856 142.261 92.192 1.00 0.00 O ATOM 66482 H1 WAT 4201 48.617 143.095 92.596 1.00 0.00 H ATOM 66483 H2 WAT 4201 49.769 142.125 92.448 1.00 0.00 H TER 66485 WAT 4201 ATOM 66485 O WAT 4202 25.747 -0.112 111.956 1.00 0.00 O ATOM 66486 H1 WAT 4202 24.801 0.036 111.945 1.00 0.00 H ATOM 66487 H2 WAT 4202 26.127 0.765 111.906 1.00 0.00 H TER 66489 WAT 4202 ATOM 66489 O WAT 4203 3.711 30.207 147.310 1.00 0.00 O ATOM 66490 H1 WAT 4203 3.964 30.902 146.703 1.00 0.00 H ATOM 66491 H2 WAT 4203 2.956 30.561 147.779 1.00 0.00 H TER 66493 WAT 4203 ATOM 66493 O WAT 4204 84.598 72.464 158.247 1.00 0.00 O ATOM 66494 H1 WAT 4204 84.774 71.566 158.529 1.00 0.00 H ATOM 66495 H2 WAT 4204 85.465 72.849 158.118 1.00 0.00 H TER 66497 WAT 4204 ATOM 66497 O WAT 4205 134.378 123.707 134.028 1.00 0.00 O ATOM 66498 H1 WAT 4205 135.119 123.491 133.463 1.00 0.00 H ATOM 66499 H2 WAT 4205 134.266 122.935 134.583 1.00 0.00 H TER 66501 WAT 4205 ATOM 66501 O WAT 4206 106.410 79.230 98.642 1.00 0.00 O ATOM 66502 H1 WAT 4206 105.851 78.994 99.382 1.00 0.00 H ATOM 66503 H2 WAT 4206 106.292 78.516 98.016 1.00 0.00 H TER 66505 WAT 4206 ATOM 66505 O WAT 4207 115.687 140.558 71.964 1.00 0.00 O ATOM 66506 H1 WAT 4207 115.441 141.482 71.924 1.00 0.00 H ATOM 66507 H2 WAT 4207 116.503 140.506 71.466 1.00 0.00 H TER 66509 WAT 4207 ATOM 66509 O WAT 4208 81.363 123.163 96.548 1.00 0.00 O ATOM 66510 H1 WAT 4208 80.630 122.823 97.061 1.00 0.00 H ATOM 66511 H2 WAT 4208 82.102 122.602 96.783 1.00 0.00 H TER 66513 WAT 4208 ATOM 66513 O WAT 4209 8.218 107.960 64.815 1.00 0.00 O ATOM 66514 H1 WAT 4209 7.640 108.382 65.450 1.00 0.00 H ATOM 66515 H2 WAT 4209 9.068 108.379 64.949 1.00 0.00 H TER 66517 WAT 4209 ATOM 66517 O WAT 4210 104.161 95.296 71.181 1.00 0.00 O ATOM 66518 H1 WAT 4210 103.568 94.560 71.031 1.00 0.00 H ATOM 66519 H2 WAT 4210 104.419 95.578 70.303 1.00 0.00 H TER 66521 WAT 4210 ATOM 66521 O WAT 4211 52.453 37.022 123.681 1.00 0.00 O ATOM 66522 H1 WAT 4211 52.152 36.729 124.541 1.00 0.00 H ATOM 66523 H2 WAT 4211 52.103 36.373 123.071 1.00 0.00 H TER 66525 WAT 4211 ATOM 66525 O WAT 4212 81.524 104.846 58.911 1.00 0.00 O ATOM 66526 H1 WAT 4212 80.831 105.499 58.819 1.00 0.00 H ATOM 66527 H2 WAT 4212 82.091 104.990 58.153 1.00 0.00 H TER 66529 WAT 4212 ATOM 66529 O WAT 4213 28.266 121.910 100.187 1.00 0.00 O ATOM 66530 H1 WAT 4213 28.624 121.239 100.768 1.00 0.00 H ATOM 66531 H2 WAT 4213 28.846 121.903 99.426 1.00 0.00 H TER 66533 WAT 4213 ATOM 66533 O WAT 4214 98.629 28.053 140.325 1.00 0.00 O ATOM 66534 H1 WAT 4214 99.444 28.281 139.876 1.00 0.00 H ATOM 66535 H2 WAT 4214 98.822 28.185 141.253 1.00 0.00 H TER 66537 WAT 4214 ATOM 66537 O WAT 4215 27.617 38.427 114.865 1.00 0.00 O ATOM 66538 H1 WAT 4215 28.538 38.571 115.081 1.00 0.00 H ATOM 66539 H2 WAT 4215 27.259 39.307 114.745 1.00 0.00 H TER 66541 WAT 4215 ATOM 66541 O WAT 4216 60.353 39.699 65.047 1.00 0.00 O ATOM 66542 H1 WAT 4216 59.862 40.334 65.568 1.00 0.00 H ATOM 66543 H2 WAT 4216 60.178 39.948 64.139 1.00 0.00 H TER 66545 WAT 4216 ATOM 66545 O WAT 4217 72.057 141.357 82.472 1.00 0.00 O ATOM 66546 H1 WAT 4217 71.519 141.137 83.233 1.00 0.00 H ATOM 66547 H2 WAT 4217 72.639 140.604 82.365 1.00 0.00 H TER 66549 WAT 4217 ATOM 66549 O WAT 4218 121.851 15.940 8.288 1.00 0.00 O ATOM 66550 H1 WAT 4218 122.094 15.250 7.671 1.00 0.00 H ATOM 66551 H2 WAT 4218 122.394 16.688 8.037 1.00 0.00 H TER 66553 WAT 4218 ATOM 66553 O WAT 4219 44.779 129.356 77.514 1.00 0.00 O ATOM 66554 H1 WAT 4219 44.305 129.408 76.684 1.00 0.00 H ATOM 66555 H2 WAT 4219 45.612 128.941 77.288 1.00 0.00 H TER 66557 WAT 4219 ATOM 66557 O WAT 4220 28.088 141.703 140.945 1.00 0.00 O ATOM 66558 H1 WAT 4220 27.203 141.416 140.723 1.00 0.00 H ATOM 66559 H2 WAT 4220 28.231 141.375 141.833 1.00 0.00 H TER 66561 WAT 4220 ATOM 66561 O WAT 4221 135.606 78.817 104.419 1.00 0.00 O ATOM 66562 H1 WAT 4221 134.955 78.510 103.788 1.00 0.00 H ATOM 66563 H2 WAT 4221 136.437 78.771 103.946 1.00 0.00 H TER 66565 WAT 4221 ATOM 66565 O WAT 4222 60.391 69.325 117.695 1.00 0.00 O ATOM 66566 H1 WAT 4222 59.858 69.084 116.937 1.00 0.00 H ATOM 66567 H2 WAT 4222 59.846 69.103 118.451 1.00 0.00 H TER 66569 WAT 4222 ATOM 66569 O WAT 4223 9.055 121.196 84.102 1.00 0.00 O ATOM 66570 H1 WAT 4223 9.503 120.422 83.762 1.00 0.00 H ATOM 66571 H2 WAT 4223 9.462 121.353 84.954 1.00 0.00 H TER 66573 WAT 4223 ATOM 66573 O WAT 4224 4.920 67.720 98.261 1.00 0.00 O ATOM 66574 H1 WAT 4224 4.794 68.477 97.688 1.00 0.00 H ATOM 66575 H2 WAT 4224 4.062 67.575 98.658 1.00 0.00 H TER 66577 WAT 4224 ATOM 66577 O WAT 4225 79.251 131.086 137.309 1.00 0.00 O ATOM 66578 H1 WAT 4225 79.921 130.490 136.973 1.00 0.00 H ATOM 66579 H2 WAT 4225 79.173 130.860 138.236 1.00 0.00 H TER 66581 WAT 4225 ATOM 66581 O WAT 4226 6.394 81.717 105.767 1.00 0.00 O ATOM 66582 H1 WAT 4226 6.317 81.316 106.633 1.00 0.00 H ATOM 66583 H2 WAT 4226 5.657 81.360 105.271 1.00 0.00 H TER 66585 WAT 4226 ATOM 66585 O WAT 4227 50.416 50.211 113.453 1.00 0.00 O ATOM 66586 H1 WAT 4227 50.791 51.086 113.352 1.00 0.00 H ATOM 66587 H2 WAT 4227 50.940 49.804 114.143 1.00 0.00 H TER 66589 WAT 4227 ATOM 66589 O WAT 4228 52.685 98.538 26.573 1.00 0.00 O ATOM 66590 H1 WAT 4228 52.471 99.204 25.920 1.00 0.00 H ATOM 66591 H2 WAT 4228 53.578 98.748 26.846 1.00 0.00 H TER 66593 WAT 4228 ATOM 66593 O WAT 4229 36.990 116.129 139.752 1.00 0.00 O ATOM 66594 H1 WAT 4229 37.774 115.988 140.284 1.00 0.00 H ATOM 66595 H2 WAT 4229 37.294 116.656 139.013 1.00 0.00 H TER 66597 WAT 4229 ATOM 66597 O WAT 4230 134.436 118.386 131.415 1.00 0.00 O ATOM 66598 H1 WAT 4230 133.689 118.847 131.795 1.00 0.00 H ATOM 66599 H2 WAT 4230 134.044 117.740 130.826 1.00 0.00 H TER 66601 WAT 4230 ATOM 66601 O WAT 4231 32.090 95.322 78.315 1.00 0.00 O ATOM 66602 H1 WAT 4231 32.934 94.871 78.282 1.00 0.00 H ATOM 66603 H2 WAT 4231 31.443 94.617 78.341 1.00 0.00 H TER 66605 WAT 4231 ATOM 66605 O WAT 4232 112.647 27.996 11.393 1.00 0.00 O ATOM 66606 H1 WAT 4232 113.176 28.779 11.546 1.00 0.00 H ATOM 66607 H2 WAT 4232 113.114 27.298 11.852 1.00 0.00 H TER 66609 WAT 4232 ATOM 66609 O WAT 4233 59.530 5.697 87.891 1.00 0.00 O ATOM 66610 H1 WAT 4233 58.748 5.960 87.405 1.00 0.00 H ATOM 66611 H2 WAT 4233 60.191 5.543 87.216 1.00 0.00 H TER 66613 WAT 4233 ATOM 66613 O WAT 4234 75.800 29.485 150.209 1.00 0.00 O ATOM 66614 H1 WAT 4234 76.120 30.385 150.269 1.00 0.00 H ATOM 66615 H2 WAT 4234 76.496 28.956 150.597 1.00 0.00 H TER 66617 WAT 4234 ATOM 66617 O WAT 4235 138.697 10.779 0.444 1.00 0.00 O ATOM 66618 H1 WAT 4235 138.704 10.937 1.388 1.00 0.00 H ATOM 66619 H2 WAT 4235 138.247 11.540 0.077 1.00 0.00 H TER 66621 WAT 4235 ATOM 66621 O WAT 4236 54.021 34.463 97.271 1.00 0.00 O ATOM 66622 H1 WAT 4236 54.749 34.052 96.804 1.00 0.00 H ATOM 66623 H2 WAT 4236 54.402 34.753 98.100 1.00 0.00 H TER 66625 WAT 4236 ATOM 66625 O WAT 4237 110.250 106.364 18.623 1.00 0.00 O ATOM 66626 H1 WAT 4237 110.577 107.156 19.048 1.00 0.00 H ATOM 66627 H2 WAT 4237 110.416 106.506 17.691 1.00 0.00 H TER 66629 WAT 4237 ATOM 66629 O WAT 4238 33.135 31.070 2.618 1.00 0.00 O ATOM 66630 H1 WAT 4238 33.369 30.202 2.291 1.00 0.00 H ATOM 66631 H2 WAT 4238 32.664 30.900 3.434 1.00 0.00 H TER 66633 WAT 4238 ATOM 66633 O WAT 4239 63.045 72.363 149.935 1.00 0.00 O ATOM 66634 H1 WAT 4239 63.487 72.698 150.715 1.00 0.00 H ATOM 66635 H2 WAT 4239 62.519 71.630 150.253 1.00 0.00 H TER 66637 WAT 4239 ATOM 66637 O WAT 4240 76.716 14.513 142.643 1.00 0.00 O ATOM 66638 H1 WAT 4240 76.280 14.106 141.895 1.00 0.00 H ATOM 66639 H2 WAT 4240 76.849 15.423 142.377 1.00 0.00 H TER 66641 WAT 4240 ATOM 66641 O WAT 4241 87.056 102.073 125.727 1.00 0.00 O ATOM 66642 H1 WAT 4241 87.253 102.474 126.573 1.00 0.00 H ATOM 66643 H2 WAT 4241 87.258 102.755 125.086 1.00 0.00 H TER 66645 WAT 4241 ATOM 66645 O WAT 4242 6.717 0.803 150.534 1.00 0.00 O ATOM 66646 H1 WAT 4242 6.352 -0.009 150.183 1.00 0.00 H ATOM 66647 H2 WAT 4242 6.955 0.588 151.436 1.00 0.00 H TER 66649 WAT 4242 ATOM 66649 O WAT 4243 113.315 96.237 139.500 1.00 0.00 O ATOM 66650 H1 WAT 4243 113.089 95.308 139.458 1.00 0.00 H ATOM 66651 H2 WAT 4243 112.627 96.626 140.040 1.00 0.00 H TER 66653 WAT 4243 ATOM 66653 O WAT 4244 118.670 5.227 150.089 1.00 0.00 O ATOM 66654 H1 WAT 4244 118.726 4.273 150.140 1.00 0.00 H ATOM 66655 H2 WAT 4244 118.896 5.528 150.970 1.00 0.00 H TER 66657 WAT 4244 ATOM 66657 O WAT 4245 96.525 140.580 122.157 1.00 0.00 O ATOM 66658 H1 WAT 4245 97.043 140.098 121.512 1.00 0.00 H ATOM 66659 H2 WAT 4245 97.157 140.838 122.828 1.00 0.00 H TER 66661 WAT 4245 ATOM 66661 O WAT 4246 68.226 16.028 76.016 1.00 0.00 O ATOM 66662 H1 WAT 4246 67.809 16.885 76.099 1.00 0.00 H ATOM 66663 H2 WAT 4246 68.981 16.183 75.448 1.00 0.00 H TER 66665 WAT 4246 ATOM 66665 O WAT 4247 94.415 82.693 130.629 1.00 0.00 O ATOM 66666 H1 WAT 4247 94.381 83.217 129.829 1.00 0.00 H ATOM 66667 H2 WAT 4247 94.281 81.793 130.332 1.00 0.00 H TER 66669 WAT 4247 ATOM 66669 O WAT 4248 56.337 71.241 146.312 1.00 0.00 O ATOM 66670 H1 WAT 4248 57.126 70.757 146.070 1.00 0.00 H ATOM 66671 H2 WAT 4248 55.615 70.677 146.037 1.00 0.00 H TER 66673 WAT 4248 ATOM 66673 O WAT 4249 4.689 103.725 20.946 1.00 0.00 O ATOM 66674 H1 WAT 4249 3.816 103.341 20.864 1.00 0.00 H ATOM 66675 H2 WAT 4249 4.784 104.273 20.167 1.00 0.00 H TER 66677 WAT 4249 ATOM 66677 O WAT 4250 111.682 132.991 80.554 1.00 0.00 O ATOM 66678 H1 WAT 4250 111.179 133.123 81.358 1.00 0.00 H ATOM 66679 H2 WAT 4250 112.157 133.813 80.433 1.00 0.00 H TER 66681 WAT 4250 ATOM 66681 O WAT 4251 41.115 113.580 130.863 1.00 0.00 O ATOM 66682 H1 WAT 4251 40.539 113.499 131.623 1.00 0.00 H ATOM 66683 H2 WAT 4251 40.969 114.472 130.546 1.00 0.00 H TER 66685 WAT 4251 ATOM 66685 O WAT 4252 47.014 14.672 131.072 1.00 0.00 O ATOM 66686 H1 WAT 4252 46.449 14.129 131.622 1.00 0.00 H ATOM 66687 H2 WAT 4252 47.711 14.081 130.788 1.00 0.00 H TER 66689 WAT 4252 ATOM 66689 O WAT 4253 32.234 129.317 123.666 1.00 0.00 O ATOM 66690 H1 WAT 4253 32.202 128.377 123.841 1.00 0.00 H ATOM 66691 H2 WAT 4253 31.970 129.724 124.491 1.00 0.00 H TER 66693 WAT 4253 ATOM 66693 O WAT 4254 83.227 120.999 61.061 1.00 0.00 O ATOM 66694 H1 WAT 4254 83.695 120.188 61.259 1.00 0.00 H ATOM 66695 H2 WAT 4254 83.123 120.990 60.110 1.00 0.00 H TER 66697 WAT 4254 ATOM 66697 O WAT 4255 142.059 49.931 54.901 1.00 0.00 O ATOM 66698 H1 WAT 4255 142.374 49.033 55.005 1.00 0.00 H ATOM 66699 H2 WAT 4255 141.106 49.851 54.892 1.00 0.00 H TER 66701 WAT 4255 ATOM 66701 O WAT 4256 46.350 4.155 68.770 1.00 0.00 O ATOM 66702 H1 WAT 4256 46.387 4.816 69.461 1.00 0.00 H ATOM 66703 H2 WAT 4256 45.415 4.000 68.636 1.00 0.00 H TER 66705 WAT 4256 ATOM 66705 O WAT 4257 135.617 22.644 79.306 1.00 0.00 O ATOM 66706 H1 WAT 4257 136.018 22.847 78.461 1.00 0.00 H ATOM 66707 H2 WAT 4257 135.039 21.903 79.125 1.00 0.00 H TER 66709 WAT 4257 ATOM 66709 O WAT 4258 79.550 83.585 86.492 1.00 0.00 O ATOM 66710 H1 WAT 4258 78.639 83.672 86.774 1.00 0.00 H ATOM 66711 H2 WAT 4258 79.514 82.981 85.751 1.00 0.00 H TER 66713 WAT 4258 ATOM 66713 O WAT 4259 115.371 48.599 120.358 1.00 0.00 O ATOM 66714 H1 WAT 4259 115.726 47.773 120.688 1.00 0.00 H ATOM 66715 H2 WAT 4259 114.808 48.342 119.628 1.00 0.00 H TER 66717 WAT 4259 ATOM 66717 O WAT 4260 93.478 125.258 88.506 1.00 0.00 O ATOM 66718 H1 WAT 4260 92.823 125.540 87.867 1.00 0.00 H ATOM 66719 H2 WAT 4260 92.974 125.077 89.300 1.00 0.00 H TER 66721 WAT 4260 ATOM 66721 O WAT 4261 57.782 85.785 109.956 1.00 0.00 O ATOM 66722 H1 WAT 4261 57.465 86.417 110.601 1.00 0.00 H ATOM 66723 H2 WAT 4261 58.598 85.451 110.328 1.00 0.00 H TER 66725 WAT 4261 ATOM 66725 O WAT 4262 145.003 62.526 153.510 1.00 0.00 O ATOM 66726 H1 WAT 4262 144.065 62.687 153.408 1.00 0.00 H ATOM 66727 H2 WAT 4262 145.081 62.097 154.362 1.00 0.00 H TER 66729 WAT 4262 ATOM 66729 O WAT 4263 23.822 42.251 121.501 1.00 0.00 O ATOM 66730 H1 WAT 4263 23.673 43.060 121.012 1.00 0.00 H ATOM 66731 H2 WAT 4263 24.080 42.544 122.375 1.00 0.00 H TER 66733 WAT 4263 ATOM 66733 O WAT 4264 106.367 33.983 119.626 1.00 0.00 O ATOM 66734 H1 WAT 4264 106.883 33.285 120.030 1.00 0.00 H ATOM 66735 H2 WAT 4264 106.559 34.758 120.155 1.00 0.00 H TER 66737 WAT 4264 ATOM 66737 O WAT 4265 27.694 14.415 125.000 1.00 0.00 O ATOM 66738 H1 WAT 4265 28.118 14.319 124.147 1.00 0.00 H ATOM 66739 H2 WAT 4265 26.768 14.249 124.828 1.00 0.00 H TER 66741 WAT 4265 ATOM 66741 O WAT 4266 125.752 7.104 96.808 1.00 0.00 O ATOM 66742 H1 WAT 4266 125.618 8.045 96.921 1.00 0.00 H ATOM 66743 H2 WAT 4266 126.618 6.939 97.181 1.00 0.00 H TER 66745 WAT 4266 ATOM 66745 O WAT 4267 75.285 106.577 123.540 1.00 0.00 O ATOM 66746 H1 WAT 4267 74.354 106.646 123.753 1.00 0.00 H ATOM 66747 H2 WAT 4267 75.705 106.355 124.371 1.00 0.00 H TER 66749 WAT 4267 ATOM 66749 O WAT 4268 132.725 142.292 77.532 1.00 0.00 O ATOM 66750 H1 WAT 4268 132.749 141.841 78.375 1.00 0.00 H ATOM 66751 H2 WAT 4268 132.810 143.219 77.754 1.00 0.00 H TER 66753 WAT 4268 ATOM 66753 O WAT 4269 32.880 113.390 135.388 1.00 0.00 O ATOM 66754 H1 WAT 4269 32.485 112.548 135.161 1.00 0.00 H ATOM 66755 H2 WAT 4269 33.395 113.629 134.617 1.00 0.00 H TER 66757 WAT 4269 ATOM 66757 O WAT 4270 45.336 104.536 79.068 1.00 0.00 O ATOM 66758 H1 WAT 4270 45.315 105.166 79.789 1.00 0.00 H ATOM 66759 H2 WAT 4270 45.674 105.035 78.324 1.00 0.00 H TER 66761 WAT 4270 ATOM 66761 O WAT 4271 89.544 78.129 84.155 1.00 0.00 O ATOM 66762 H1 WAT 4271 88.875 77.605 83.714 1.00 0.00 H ATOM 66763 H2 WAT 4271 89.057 78.656 84.788 1.00 0.00 H TER 66765 WAT 4271 ATOM 66765 O WAT 4272 113.933 49.238 79.781 1.00 0.00 O ATOM 66766 H1 WAT 4272 113.469 50.056 79.601 1.00 0.00 H ATOM 66767 H2 WAT 4272 114.814 49.381 79.436 1.00 0.00 H TER 66769 WAT 4272 ATOM 66769 O WAT 4273 50.189 106.493 10.972 1.00 0.00 O ATOM 66770 H1 WAT 4273 49.262 106.682 10.823 1.00 0.00 H ATOM 66771 H2 WAT 4273 50.191 105.855 11.686 1.00 0.00 H TER 66773 WAT 4273 ATOM 66773 O WAT 4274 40.190 130.236 17.351 1.00 0.00 O ATOM 66774 H1 WAT 4274 40.580 129.553 16.805 1.00 0.00 H ATOM 66775 H2 WAT 4274 39.925 130.916 16.731 1.00 0.00 H TER 66777 WAT 4274 ATOM 66777 O WAT 4275 137.032 80.440 111.104 1.00 0.00 O ATOM 66778 H1 WAT 4275 137.255 79.661 110.595 1.00 0.00 H ATOM 66779 H2 WAT 4275 137.827 80.640 111.597 1.00 0.00 H TER 66781 WAT 4275 ATOM 66781 O WAT 4276 114.979 33.870 16.940 1.00 0.00 O ATOM 66782 H1 WAT 4276 115.642 33.834 16.250 1.00 0.00 H ATOM 66783 H2 WAT 4276 114.332 34.499 16.618 1.00 0.00 H TER 66785 WAT 4276 ATOM 66785 O WAT 4277 124.536 143.064 25.874 1.00 0.00 O ATOM 66786 H1 WAT 4277 124.083 142.979 25.035 1.00 0.00 H ATOM 66787 H2 WAT 4277 125.063 143.857 25.783 1.00 0.00 H TER 66789 WAT 4277 ATOM 66789 O WAT 4278 81.884 8.203 64.375 1.00 0.00 O ATOM 66790 H1 WAT 4278 82.534 7.672 63.915 1.00 0.00 H ATOM 66791 H2 WAT 4278 82.401 8.843 64.865 1.00 0.00 H TER 66793 WAT 4278 ATOM 66793 O WAT 4279 29.736 138.985 82.441 1.00 0.00 O ATOM 66794 H1 WAT 4279 29.034 138.342 82.533 1.00 0.00 H ATOM 66795 H2 WAT 4279 30.270 138.656 81.718 1.00 0.00 H TER 66797 WAT 4279 ATOM 66797 O WAT 4280 43.207 0.227 147.824 1.00 0.00 O ATOM 66798 H1 WAT 4280 43.138 -0.659 148.180 1.00 0.00 H ATOM 66799 H2 WAT 4280 42.307 0.468 147.603 1.00 0.00 H TER 66801 WAT 4280 ATOM 66801 O WAT 4281 128.062 99.398 101.369 1.00 0.00 O ATOM 66802 H1 WAT 4281 128.740 98.897 100.916 1.00 0.00 H ATOM 66803 H2 WAT 4281 127.403 99.573 100.697 1.00 0.00 H TER 66805 WAT 4281 ATOM 66805 O WAT 4282 17.092 25.083 71.378 1.00 0.00 O ATOM 66806 H1 WAT 4282 17.255 24.263 70.910 1.00 0.00 H ATOM 66807 H2 WAT 4282 17.685 25.713 70.969 1.00 0.00 H TER 66809 WAT 4282 ATOM 66809 O WAT 4283 50.883 53.665 107.251 1.00 0.00 O ATOM 66810 H1 WAT 4283 50.212 52.990 107.358 1.00 0.00 H ATOM 66811 H2 WAT 4283 51.455 53.557 108.011 1.00 0.00 H TER 66813 WAT 4283 ATOM 66813 O WAT 4284 83.439 114.821 16.846 1.00 0.00 O ATOM 66814 H1 WAT 4284 82.542 114.758 16.516 1.00 0.00 H ATOM 66815 H2 WAT 4284 83.619 115.761 16.869 1.00 0.00 H TER 66817 WAT 4284 ATOM 66817 O WAT 4285 92.217 72.906 122.327 1.00 0.00 O ATOM 66818 H1 WAT 4285 92.104 72.051 121.912 1.00 0.00 H ATOM 66819 H2 WAT 4285 91.705 72.851 123.133 1.00 0.00 H TER 66821 WAT 4285 ATOM 66821 O WAT 4286 85.199 28.561 21.680 1.00 0.00 O ATOM 66822 H1 WAT 4286 85.427 28.070 22.470 1.00 0.00 H ATOM 66823 H2 WAT 4286 84.502 29.154 21.960 1.00 0.00 H TER 66825 WAT 4286 ATOM 66825 O WAT 4287 64.621 30.781 65.539 1.00 0.00 O ATOM 66826 H1 WAT 4287 63.785 30.841 66.002 1.00 0.00 H ATOM 66827 H2 WAT 4287 64.497 30.067 64.914 1.00 0.00 H TER 66829 WAT 4287 ATOM 66829 O WAT 4288 24.821 63.934 5.819 1.00 0.00 O ATOM 66830 H1 WAT 4288 25.179 63.852 6.703 1.00 0.00 H ATOM 66831 H2 WAT 4288 23.882 64.064 5.951 1.00 0.00 H TER 66833 WAT 4288 ATOM 66833 O WAT 4289 99.264 35.929 27.950 1.00 0.00 O ATOM 66834 H1 WAT 4289 99.632 36.031 27.072 1.00 0.00 H ATOM 66835 H2 WAT 4289 98.719 36.706 28.072 1.00 0.00 H TER 66837 WAT 4289 ATOM 66837 O WAT 4290 32.040 40.873 114.794 1.00 0.00 O ATOM 66838 H1 WAT 4290 31.423 40.370 115.325 1.00 0.00 H ATOM 66839 H2 WAT 4290 31.507 41.556 114.388 1.00 0.00 H TER 66841 WAT 4290 ATOM 66841 O WAT 4291 123.153 79.447 1.033 1.00 0.00 O ATOM 66842 H1 WAT 4291 122.337 79.551 0.543 1.00 0.00 H ATOM 66843 H2 WAT 4291 123.304 78.502 1.048 1.00 0.00 H TER 66845 WAT 4291 ATOM 66845 O WAT 4292 47.324 85.466 140.115 1.00 0.00 O ATOM 66846 H1 WAT 4292 48.105 85.940 140.400 1.00 0.00 H ATOM 66847 H2 WAT 4292 47.573 85.077 139.276 1.00 0.00 H TER 66849 WAT 4292 ATOM 66849 O WAT 4293 20.598 23.747 82.584 1.00 0.00 O ATOM 66850 H1 WAT 4293 19.862 23.941 83.165 1.00 0.00 H ATOM 66851 H2 WAT 4293 21.355 24.145 83.014 1.00 0.00 H TER 66853 WAT 4293 ATOM 66853 O WAT 4294 142.495 61.728 124.880 1.00 0.00 O ATOM 66854 H1 WAT 4294 142.549 61.443 123.968 1.00 0.00 H ATOM 66855 H2 WAT 4294 141.591 62.027 124.984 1.00 0.00 H TER 66857 WAT 4294 ATOM 66857 O WAT 4295 104.755 143.069 135.645 1.00 0.00 O ATOM 66858 H1 WAT 4295 104.909 142.861 136.566 1.00 0.00 H ATOM 66859 H2 WAT 4295 105.600 143.385 135.325 1.00 0.00 H TER 66861 WAT 4295 ATOM 66861 O WAT 4296 142.210 18.743 130.843 1.00 0.00 O ATOM 66862 H1 WAT 4296 142.204 18.527 129.911 1.00 0.00 H ATOM 66863 H2 WAT 4296 141.659 18.072 131.247 1.00 0.00 H TER 66865 WAT 4296 ATOM 66865 O WAT 4297 18.785 134.046 142.534 1.00 0.00 O ATOM 66866 H1 WAT 4297 18.370 134.832 142.179 1.00 0.00 H ATOM 66867 H2 WAT 4297 19.414 134.376 143.175 1.00 0.00 H TER 66869 WAT 4297 ATOM 66869 O WAT 4298 116.383 58.907 71.330 1.00 0.00 O ATOM 66870 H1 WAT 4298 117.179 58.621 70.881 1.00 0.00 H ATOM 66871 H2 WAT 4298 115.674 58.456 70.871 1.00 0.00 H TER 66873 WAT 4298 ATOM 66873 O WAT 4299 21.901 54.091 76.994 1.00 0.00 O ATOM 66874 H1 WAT 4299 21.146 53.684 77.418 1.00 0.00 H ATOM 66875 H2 WAT 4299 21.526 54.613 76.285 1.00 0.00 H TER 66877 WAT 4299 ATOM 66877 O WAT 4300 16.084 120.173 109.960 1.00 0.00 O ATOM 66878 H1 WAT 4300 15.764 120.206 110.862 1.00 0.00 H ATOM 66879 H2 WAT 4300 16.405 121.058 109.788 1.00 0.00 H TER 66881 WAT 4300 ATOM 66881 O WAT 4301 63.706 93.603 89.441 1.00 0.00 O ATOM 66882 H1 WAT 4301 64.390 94.259 89.574 1.00 0.00 H ATOM 66883 H2 WAT 4301 64.175 92.830 89.126 1.00 0.00 H TER 66885 WAT 4301 ATOM 66885 O WAT 4302 55.765 46.848 98.192 1.00 0.00 O ATOM 66886 H1 WAT 4302 55.935 45.918 98.043 1.00 0.00 H ATOM 66887 H2 WAT 4302 55.076 47.069 97.565 1.00 0.00 H TER 66889 WAT 4302 ATOM 66889 O WAT 4303 128.617 34.590 144.439 1.00 0.00 O ATOM 66890 H1 WAT 4303 127.787 34.559 143.963 1.00 0.00 H ATOM 66891 H2 WAT 4303 128.683 33.733 144.862 1.00 0.00 H TER 66893 WAT 4303 ATOM 66893 O WAT 4304 116.825 19.370 58.599 1.00 0.00 O ATOM 66894 H1 WAT 4304 117.280 19.845 57.903 1.00 0.00 H ATOM 66895 H2 WAT 4304 115.967 19.791 58.654 1.00 0.00 H TER 66897 WAT 4304 ATOM 66897 O WAT 4305 8.303 54.560 144.473 1.00 0.00 O ATOM 66898 H1 WAT 4305 8.367 55.121 143.700 1.00 0.00 H ATOM 66899 H2 WAT 4305 8.559 53.692 144.161 1.00 0.00 H TER 66901 WAT 4305 ATOM 66901 O WAT 4306 119.254 49.309 134.507 1.00 0.00 O ATOM 66902 H1 WAT 4306 119.166 48.426 134.868 1.00 0.00 H ATOM 66903 H2 WAT 4306 118.473 49.771 134.811 1.00 0.00 H TER 66905 WAT 4306 ATOM 66905 O WAT 4307 47.147 84.977 79.858 1.00 0.00 O ATOM 66906 H1 WAT 4307 46.579 84.807 79.106 1.00 0.00 H ATOM 66907 H2 WAT 4307 47.072 85.919 80.007 1.00 0.00 H TER 66909 WAT 4307 ATOM 66909 O WAT 4308 83.858 80.379 107.806 1.00 0.00 O ATOM 66910 H1 WAT 4308 84.257 81.210 108.063 1.00 0.00 H ATOM 66911 H2 WAT 4308 84.446 80.028 107.137 1.00 0.00 H TER 66913 WAT 4308 ATOM 66913 O WAT 4309 126.349 138.281 84.136 1.00 0.00 O ATOM 66914 H1 WAT 4309 125.613 138.017 83.583 1.00 0.00 H ATOM 66915 H2 WAT 4309 126.313 139.238 84.142 1.00 0.00 H TER 66917 WAT 4309 ATOM 66917 O WAT 4310 0.393 8.048 73.476 1.00 0.00 O ATOM 66918 H1 WAT 4310 1.052 7.724 74.091 1.00 0.00 H ATOM 66919 H2 WAT 4310 0.206 8.939 73.773 1.00 0.00 H TER 66921 WAT 4310 ATOM 66921 O WAT 4311 32.245 127.144 117.354 1.00 0.00 O ATOM 66922 H1 WAT 4311 31.809 126.330 117.606 1.00 0.00 H ATOM 66923 H2 WAT 4311 31.549 127.682 116.977 1.00 0.00 H TER 66925 WAT 4311 ATOM 66925 O WAT 4312 124.018 64.759 20.157 1.00 0.00 O ATOM 66926 H1 WAT 4312 123.616 63.904 20.310 1.00 0.00 H ATOM 66927 H2 WAT 4312 123.819 65.262 20.946 1.00 0.00 H TER 66929 WAT 4312 ATOM 66929 O WAT 4313 62.871 32.062 86.271 1.00 0.00 O ATOM 66930 H1 WAT 4313 62.294 32.783 86.019 1.00 0.00 H ATOM 66931 H2 WAT 4313 63.724 32.298 85.907 1.00 0.00 H TER 66933 WAT 4313 ATOM 66933 O WAT 4314 16.793 42.293 117.596 1.00 0.00 O ATOM 66934 H1 WAT 4314 17.465 42.955 117.758 1.00 0.00 H ATOM 66935 H2 WAT 4314 16.680 41.855 118.440 1.00 0.00 H TER 66937 WAT 4314 ATOM 66937 O WAT 4315 52.523 28.584 70.124 1.00 0.00 O ATOM 66938 H1 WAT 4315 53.160 28.049 70.597 1.00 0.00 H ATOM 66939 H2 WAT 4315 52.860 29.477 70.196 1.00 0.00 H TER 66941 WAT 4315 ATOM 66941 O WAT 4316 42.707 87.210 125.593 1.00 0.00 O ATOM 66942 H1 WAT 4316 43.084 86.750 126.343 1.00 0.00 H ATOM 66943 H2 WAT 4316 42.599 88.112 125.894 1.00 0.00 H TER 66945 WAT 4316 ATOM 66945 O WAT 4317 65.746 101.097 6.689 1.00 0.00 O ATOM 66946 H1 WAT 4317 65.475 100.546 5.954 1.00 0.00 H ATOM 66947 H2 WAT 4317 66.207 100.500 7.278 1.00 0.00 H TER 66949 WAT 4317 ATOM 66949 O WAT 4318 24.398 140.958 3.473 1.00 0.00 O ATOM 66950 H1 WAT 4318 24.398 141.126 4.415 1.00 0.00 H ATOM 66951 H2 WAT 4318 23.474 140.842 3.251 1.00 0.00 H TER 66953 WAT 4318 ATOM 66953 O WAT 4319 68.584 114.345 131.678 1.00 0.00 O ATOM 66954 H1 WAT 4319 68.458 114.502 132.614 1.00 0.00 H ATOM 66955 H2 WAT 4319 69.151 113.575 131.638 1.00 0.00 H TER 66957 WAT 4319 ATOM 66957 O WAT 4320 140.262 23.090 76.139 1.00 0.00 O ATOM 66958 H1 WAT 4320 139.687 22.390 75.830 1.00 0.00 H ATOM 66959 H2 WAT 4320 140.089 23.821 75.545 1.00 0.00 H TER 66961 WAT 4320 ATOM 66961 O WAT 4321 33.560 1.380 63.637 1.00 0.00 O ATOM 66962 H1 WAT 4321 33.522 2.232 64.073 1.00 0.00 H ATOM 66963 H2 WAT 4321 34.480 1.122 63.696 1.00 0.00 H TER 66965 WAT 4321 ATOM 66965 O WAT 4322 55.573 101.429 146.856 1.00 0.00 O ATOM 66966 H1 WAT 4322 56.324 100.942 147.196 1.00 0.00 H ATOM 66967 H2 WAT 4322 55.548 101.211 145.924 1.00 0.00 H TER 66969 WAT 4322 ATOM 66969 O WAT 4323 118.908 2.059 89.037 1.00 0.00 O ATOM 66970 H1 WAT 4323 117.955 1.975 89.069 1.00 0.00 H ATOM 66971 H2 WAT 4323 119.060 2.928 88.666 1.00 0.00 H TER 66973 WAT 4323 ATOM 66973 O WAT 4324 124.561 16.126 15.565 1.00 0.00 O ATOM 66974 H1 WAT 4324 123.885 16.725 15.248 1.00 0.00 H ATOM 66975 H2 WAT 4324 124.243 15.837 16.420 1.00 0.00 H TER 66977 WAT 4324 ATOM 66977 O WAT 4325 139.695 131.605 63.751 1.00 0.00 O ATOM 66978 H1 WAT 4325 139.515 131.529 62.814 1.00 0.00 H ATOM 66979 H2 WAT 4325 140.581 131.258 63.854 1.00 0.00 H TER 66981 WAT 4325 ATOM 66981 O WAT 4326 74.824 45.720 1.478 1.00 0.00 O ATOM 66982 H1 WAT 4326 75.263 45.608 2.321 1.00 0.00 H ATOM 66983 H2 WAT 4326 74.429 46.591 1.527 1.00 0.00 H TER 66985 WAT 4326 ATOM 66985 O WAT 4327 19.139 28.953 152.311 1.00 0.00 O ATOM 66986 H1 WAT 4327 18.519 29.652 152.101 1.00 0.00 H ATOM 66987 H2 WAT 4327 19.999 29.372 152.259 1.00 0.00 H TER 66989 WAT 4327 ATOM 66989 O WAT 4328 82.493 46.608 150.334 1.00 0.00 O ATOM 66990 H1 WAT 4328 81.939 46.652 149.555 1.00 0.00 H ATOM 66991 H2 WAT 4328 81.995 46.073 150.952 1.00 0.00 H TER 66993 WAT 4328 ATOM 66993 O WAT 4329 117.912 53.049 106.283 1.00 0.00 O ATOM 66994 H1 WAT 4329 118.295 52.597 105.531 1.00 0.00 H ATOM 66995 H2 WAT 4329 118.053 53.978 106.100 1.00 0.00 H TER 66997 WAT 4329 ATOM 66997 O WAT 4330 140.272 46.573 75.930 1.00 0.00 O ATOM 66998 H1 WAT 4330 139.328 46.713 75.860 1.00 0.00 H ATOM 66999 H2 WAT 4330 140.488 46.019 75.180 1.00 0.00 H TER 67001 WAT 4330 ATOM 67001 O WAT 4331 122.921 99.817 103.007 1.00 0.00 O ATOM 67002 H1 WAT 4331 122.059 99.402 103.032 1.00 0.00 H ATOM 67003 H2 WAT 4331 123.500 99.193 103.446 1.00 0.00 H TER 67005 WAT 4331 ATOM 67005 O WAT 4332 124.345 62.968 98.714 1.00 0.00 O ATOM 67006 H1 WAT 4332 124.102 62.218 99.256 1.00 0.00 H ATOM 67007 H2 WAT 4332 125.115 63.337 99.148 1.00 0.00 H TER 67009 WAT 4332 ATOM 67009 O WAT 4333 6.699 124.877 125.425 1.00 0.00 O ATOM 67010 H1 WAT 4333 5.981 124.799 126.053 1.00 0.00 H ATOM 67011 H2 WAT 4333 6.697 124.042 124.955 1.00 0.00 H TER 67013 WAT 4333 ATOM 67013 O WAT 4334 17.262 39.628 155.411 1.00 0.00 O ATOM 67014 H1 WAT 4334 17.326 40.559 155.625 1.00 0.00 H ATOM 67015 H2 WAT 4334 18.073 39.249 155.748 1.00 0.00 H TER 67017 WAT 4334 ATOM 67017 O WAT 4335 70.636 75.838 3.181 1.00 0.00 O ATOM 67018 H1 WAT 4335 70.931 75.011 3.563 1.00 0.00 H ATOM 67019 H2 WAT 4335 69.697 75.866 3.365 1.00 0.00 H TER 67021 WAT 4335 ATOM 67021 O WAT 4336 65.969 49.561 95.664 1.00 0.00 O ATOM 67022 H1 WAT 4336 65.864 50.486 95.441 1.00 0.00 H ATOM 67023 H2 WAT 4336 66.572 49.561 96.407 1.00 0.00 H TER 67025 WAT 4336 ATOM 67025 O WAT 4337 11.402 31.176 145.852 1.00 0.00 O ATOM 67026 H1 WAT 4337 11.083 30.580 146.530 1.00 0.00 H ATOM 67027 H2 WAT 4337 12.064 30.671 145.380 1.00 0.00 H TER 67029 WAT 4337 ATOM 67029 O WAT 4338 53.608 49.866 138.929 1.00 0.00 O ATOM 67030 H1 WAT 4338 54.071 50.702 138.884 1.00 0.00 H ATOM 67031 H2 WAT 4338 53.652 49.617 139.852 1.00 0.00 H TER 67033 WAT 4338 ATOM 67033 O WAT 4339 53.507 100.996 4.703 1.00 0.00 O ATOM 67034 H1 WAT 4339 53.498 101.327 5.601 1.00 0.00 H ATOM 67035 H2 WAT 4339 54.433 100.855 4.508 1.00 0.00 H TER 67037 WAT 4339 ATOM 67037 O WAT 4340 53.744 84.032 76.096 1.00 0.00 O ATOM 67038 H1 WAT 4340 53.172 84.791 76.209 1.00 0.00 H ATOM 67039 H2 WAT 4340 54.147 83.905 76.955 1.00 0.00 H TER 67041 WAT 4340 ATOM 67041 O WAT 4341 120.602 22.261 126.807 1.00 0.00 O ATOM 67042 H1 WAT 4341 120.871 21.612 126.157 1.00 0.00 H ATOM 67043 H2 WAT 4341 119.717 22.512 126.543 1.00 0.00 H TER 67045 WAT 4341 ATOM 67045 O WAT 4342 131.346 34.403 84.628 1.00 0.00 O ATOM 67046 H1 WAT 4342 131.360 35.354 84.739 1.00 0.00 H ATOM 67047 H2 WAT 4342 131.326 34.059 85.521 1.00 0.00 H TER 67049 WAT 4342 ATOM 67049 O WAT 4343 92.587 89.045 158.744 1.00 0.00 O ATOM 67050 H1 WAT 4343 92.824 88.223 158.315 1.00 0.00 H ATOM 67051 H2 WAT 4343 91.740 89.278 158.364 1.00 0.00 H TER 67053 WAT 4343 ATOM 67053 O WAT 4344 98.877 127.917 101.071 1.00 0.00 O ATOM 67054 H1 WAT 4344 98.182 128.307 101.601 1.00 0.00 H ATOM 67055 H2 WAT 4344 99.558 128.589 101.039 1.00 0.00 H TER 67057 WAT 4344 ATOM 67057 O WAT 4345 63.234 22.014 123.288 1.00 0.00 O ATOM 67058 H1 WAT 4345 63.487 22.052 122.366 1.00 0.00 H ATOM 67059 H2 WAT 4345 62.785 21.174 123.380 1.00 0.00 H TER 67061 WAT 4345 ATOM 67061 O WAT 4346 101.576 1.597 126.218 1.00 0.00 O ATOM 67062 H1 WAT 4346 102.028 1.134 126.923 1.00 0.00 H ATOM 67063 H2 WAT 4346 101.323 0.908 125.603 1.00 0.00 H TER 67065 WAT 4346 ATOM 67065 O WAT 4347 10.523 54.993 8.166 1.00 0.00 O ATOM 67066 H1 WAT 4347 10.687 54.978 7.223 1.00 0.00 H ATOM 67067 H2 WAT 4347 11.119 55.663 8.502 1.00 0.00 H TER 67069 WAT 4347 ATOM 67069 O WAT 4348 63.275 142.739 152.174 1.00 0.00 O ATOM 67070 H1 WAT 4348 62.683 142.436 151.485 1.00 0.00 H ATOM 67071 H2 WAT 4348 64.111 142.317 151.974 1.00 0.00 H TER 67073 WAT 4348 ATOM 67073 O WAT 4349 91.217 120.192 100.340 1.00 0.00 O ATOM 67074 H1 WAT 4349 91.546 119.616 99.649 1.00 0.00 H ATOM 67075 H2 WAT 4349 90.650 120.814 99.884 1.00 0.00 H TER 67077 WAT 4349 ATOM 67077 O WAT 4350 59.418 124.612 112.725 1.00 0.00 O ATOM 67078 H1 WAT 4350 58.571 124.864 113.093 1.00 0.00 H ATOM 67079 H2 WAT 4350 59.918 125.428 112.694 1.00 0.00 H TER 67081 WAT 4350 ATOM 67081 O WAT 4351 20.673 64.035 10.901 1.00 0.00 O ATOM 67082 H1 WAT 4351 20.323 63.145 10.867 1.00 0.00 H ATOM 67083 H2 WAT 4351 21.037 64.116 11.783 1.00 0.00 H TER 67085 WAT 4351 ATOM 67085 O WAT 4352 55.672 6.685 74.168 1.00 0.00 O ATOM 67086 H1 WAT 4352 56.595 6.930 74.101 1.00 0.00 H ATOM 67087 H2 WAT 4352 55.196 7.466 73.885 1.00 0.00 H TER 67089 WAT 4352 ATOM 67089 O WAT 4353 136.847 25.824 55.699 1.00 0.00 O ATOM 67090 H1 WAT 4353 136.701 24.966 56.097 1.00 0.00 H ATOM 67091 H2 WAT 4353 136.983 26.412 56.443 1.00 0.00 H TER 67093 WAT 4353 ATOM 67093 O WAT 4354 124.465 42.183 121.872 1.00 0.00 O ATOM 67094 H1 WAT 4354 124.902 43.018 122.037 1.00 0.00 H ATOM 67095 H2 WAT 4354 124.663 41.986 120.956 1.00 0.00 H TER 67097 WAT 4354 ATOM 67097 O WAT 4355 51.354 29.070 157.952 1.00 0.00 O ATOM 67098 H1 WAT 4355 51.071 28.936 158.857 1.00 0.00 H ATOM 67099 H2 WAT 4355 52.294 29.236 158.017 1.00 0.00 H TER 67101 WAT 4355 ATOM 67101 O WAT 4356 133.995 56.701 95.126 1.00 0.00 O ATOM 67102 H1 WAT 4356 133.699 55.857 95.468 1.00 0.00 H ATOM 67103 H2 WAT 4356 134.558 56.475 94.386 1.00 0.00 H TER 67105 WAT 4356 ATOM 67105 O WAT 4357 79.627 111.822 115.242 1.00 0.00 O ATOM 67106 H1 WAT 4357 79.430 111.342 114.438 1.00 0.00 H ATOM 67107 H2 WAT 4357 79.265 111.277 115.941 1.00 0.00 H TER 67109 WAT 4357 ATOM 67109 O WAT 4358 34.908 81.861 136.660 1.00 0.00 O ATOM 67110 H1 WAT 4358 35.736 82.131 137.057 1.00 0.00 H ATOM 67111 H2 WAT 4358 34.999 80.916 136.534 1.00 0.00 H TER 67113 WAT 4358 ATOM 67113 O WAT 4359 115.799 63.631 86.506 1.00 0.00 O ATOM 67114 H1 WAT 4359 116.700 63.482 86.793 1.00 0.00 H ATOM 67115 H2 WAT 4359 115.887 64.096 85.673 1.00 0.00 H TER 67117 WAT 4359 ATOM 67117 O WAT 4360 15.498 36.746 131.158 1.00 0.00 O ATOM 67118 H1 WAT 4360 15.629 36.369 130.288 1.00 0.00 H ATOM 67119 H2 WAT 4360 14.753 36.263 131.518 1.00 0.00 H TER 67121 WAT 4360 ATOM 67121 O WAT 4361 16.540 22.871 97.791 1.00 0.00 O ATOM 67122 H1 WAT 4361 16.641 22.460 96.932 1.00 0.00 H ATOM 67123 H2 WAT 4361 16.291 23.775 97.597 1.00 0.00 H TER 67125 WAT 4361 ATOM 67125 O WAT 4362 74.440 80.249 153.910 1.00 0.00 O ATOM 67126 H1 WAT 4362 75.029 80.722 153.323 1.00 0.00 H ATOM 67127 H2 WAT 4362 74.066 80.927 154.472 1.00 0.00 H TER 67129 WAT 4362 ATOM 67129 O WAT 4363 17.271 93.487 125.313 1.00 0.00 O ATOM 67130 H1 WAT 4363 17.528 93.971 126.098 1.00 0.00 H ATOM 67131 H2 WAT 4363 17.085 92.602 125.628 1.00 0.00 H TER 67133 WAT 4363 ATOM 67133 O WAT 4364 15.910 103.512 91.395 1.00 0.00 O ATOM 67134 H1 WAT 4364 16.123 103.597 92.325 1.00 0.00 H ATOM 67135 H2 WAT 4364 16.739 103.276 90.980 1.00 0.00 H TER 67137 WAT 4364 ATOM 67137 O WAT 4365 2.823 72.960 61.509 1.00 0.00 O ATOM 67138 H1 WAT 4365 2.624 73.092 60.582 1.00 0.00 H ATOM 67139 H2 WAT 4365 2.239 72.252 61.781 1.00 0.00 H TER 67141 WAT 4365 ATOM 67141 O WAT 4366 133.766 11.277 21.551 1.00 0.00 O ATOM 67142 H1 WAT 4366 134.720 11.341 21.608 1.00 0.00 H ATOM 67143 H2 WAT 4366 133.609 10.456 21.084 1.00 0.00 H TER 67145 WAT 4366 ATOM 67145 O WAT 4367 117.162 28.860 1.811 1.00 0.00 O ATOM 67146 H1 WAT 4367 117.931 28.290 1.805 1.00 0.00 H ATOM 67147 H2 WAT 4367 117.269 29.414 1.038 1.00 0.00 H TER 67149 WAT 4367 ATOM 67149 O WAT 4368 120.483 18.809 90.222 1.00 0.00 O ATOM 67150 H1 WAT 4368 121.052 18.436 90.895 1.00 0.00 H ATOM 67151 H2 WAT 4368 119.604 18.514 90.461 1.00 0.00 H TER 67153 WAT 4368 ATOM 67153 O WAT 4369 56.483 64.134 21.964 1.00 0.00 O ATOM 67154 H1 WAT 4369 56.518 63.246 22.320 1.00 0.00 H ATOM 67155 H2 WAT 4369 57.003 64.091 21.162 1.00 0.00 H TER 67157 WAT 4369 ATOM 67157 O WAT 4370 56.385 38.498 111.119 1.00 0.00 O ATOM 67158 H1 WAT 4370 56.822 38.269 111.939 1.00 0.00 H ATOM 67159 H2 WAT 4370 56.917 39.205 110.754 1.00 0.00 H TER 67161 WAT 4370 ATOM 67161 O WAT 4371 4.654 1.395 96.539 1.00 0.00 O ATOM 67162 H1 WAT 4371 3.970 0.731 96.619 1.00 0.00 H ATOM 67163 H2 WAT 4371 5.078 1.203 95.703 1.00 0.00 H TER 67165 WAT 4371 ATOM 67165 O WAT 4372 15.453 34.603 107.546 1.00 0.00 O ATOM 67166 H1 WAT 4372 15.441 35.492 107.903 1.00 0.00 H ATOM 67167 H2 WAT 4372 14.795 34.132 108.057 1.00 0.00 H TER 67169 WAT 4372 ATOM 67169 O WAT 4373 73.652 133.981 102.044 1.00 0.00 O ATOM 67170 H1 WAT 4373 73.489 134.013 101.101 1.00 0.00 H ATOM 67171 H2 WAT 4373 73.188 134.742 102.392 1.00 0.00 H TER 67173 WAT 4373 ATOM 67173 O WAT 4374 138.880 38.098 138.102 1.00 0.00 O ATOM 67174 H1 WAT 4374 138.742 37.276 137.632 1.00 0.00 H ATOM 67175 H2 WAT 4374 138.971 38.756 137.412 1.00 0.00 H TER 67177 WAT 4374 ATOM 67177 O WAT 4375 124.780 1.084 103.829 1.00 0.00 O ATOM 67178 H1 WAT 4375 125.166 0.252 103.556 1.00 0.00 H ATOM 67179 H2 WAT 4375 125.517 1.695 103.848 1.00 0.00 H TER 67181 WAT 4375 ATOM 67181 O WAT 4376 74.526 144.369 104.079 1.00 0.00 O ATOM 67182 H1 WAT 4376 75.315 144.333 103.538 1.00 0.00 H ATOM 67183 H2 WAT 4376 74.582 145.213 104.527 1.00 0.00 H TER 67185 WAT 4376 ATOM 67185 O WAT 4377 106.225 98.548 21.211 1.00 0.00 O ATOM 67186 H1 WAT 4377 106.152 99.333 21.754 1.00 0.00 H ATOM 67187 H2 WAT 4377 107.153 98.318 21.247 1.00 0.00 H TER 67189 WAT 4377 ATOM 67189 O WAT 4378 21.682 5.429 59.456 1.00 0.00 O ATOM 67190 H1 WAT 4378 20.819 5.779 59.236 1.00 0.00 H ATOM 67191 H2 WAT 4378 22.054 6.071 60.060 1.00 0.00 H TER 67193 WAT 4378 ATOM 67193 O WAT 4379 120.753 140.195 14.634 1.00 0.00 O ATOM 67194 H1 WAT 4379 120.777 140.317 15.583 1.00 0.00 H ATOM 67195 H2 WAT 4379 119.922 140.586 14.363 1.00 0.00 H TER 67197 WAT 4379 ATOM 67197 O WAT 4380 127.248 14.180 53.219 1.00 0.00 O ATOM 67198 H1 WAT 4380 127.330 13.243 53.042 1.00 0.00 H ATOM 67199 H2 WAT 4380 128.143 14.470 53.397 1.00 0.00 H TER 67201 WAT 4380 ATOM 67201 O WAT 4381 110.379 41.790 142.457 1.00 0.00 O ATOM 67202 H1 WAT 4381 110.546 41.016 142.993 1.00 0.00 H ATOM 67203 H2 WAT 4381 110.986 42.450 142.792 1.00 0.00 H TER 67205 WAT 4381 ATOM 67205 O WAT 4382 140.523 6.625 150.516 1.00 0.00 O ATOM 67206 H1 WAT 4382 140.610 5.816 150.011 1.00 0.00 H ATOM 67207 H2 WAT 4382 139.581 6.794 150.536 1.00 0.00 H TER 67209 WAT 4382 ATOM 67209 O WAT 4383 143.919 132.623 127.168 1.00 0.00 O ATOM 67210 H1 WAT 4383 144.092 133.215 127.900 1.00 0.00 H ATOM 67211 H2 WAT 4383 142.988 132.414 127.243 1.00 0.00 H TER 67213 WAT 4383 ATOM 67213 O WAT 4384 51.732 88.374 139.235 1.00 0.00 O ATOM 67214 H1 WAT 4384 51.792 88.876 140.048 1.00 0.00 H ATOM 67215 H2 WAT 4384 50.822 88.079 139.204 1.00 0.00 H TER 67217 WAT 4384 ATOM 67217 O WAT 4385 48.368 58.028 53.188 1.00 0.00 O ATOM 67218 H1 WAT 4385 48.949 57.319 53.465 1.00 0.00 H ATOM 67219 H2 WAT 4385 48.088 58.441 54.005 1.00 0.00 H TER 67221 WAT 4385 ATOM 67221 O WAT 4386 38.674 62.854 140.644 1.00 0.00 O ATOM 67222 H1 WAT 4386 38.222 63.692 140.740 1.00 0.00 H ATOM 67223 H2 WAT 4386 39.582 63.043 140.879 1.00 0.00 H TER 67225 WAT 4386 ATOM 67225 O WAT 4387 23.496 70.394 95.936 1.00 0.00 O ATOM 67226 H1 WAT 4387 23.644 70.578 95.008 1.00 0.00 H ATOM 67227 H2 WAT 4387 23.091 71.192 96.276 1.00 0.00 H TER 67229 WAT 4387 ATOM 67229 O WAT 4388 134.882 66.625 20.839 1.00 0.00 O ATOM 67230 H1 WAT 4388 134.690 67.395 21.373 1.00 0.00 H ATOM 67231 H2 WAT 4388 134.128 66.049 20.967 1.00 0.00 H TER 67233 WAT 4388 ATOM 67233 O WAT 4389 110.426 126.254 148.475 1.00 0.00 O ATOM 67234 H1 WAT 4389 111.309 126.090 148.806 1.00 0.00 H ATOM 67235 H2 WAT 4389 109.896 125.551 148.849 1.00 0.00 H TER 67237 WAT 4389 ATOM 67237 O WAT 4390 33.044 40.740 152.435 1.00 0.00 O ATOM 67238 H1 WAT 4390 32.653 40.511 153.278 1.00 0.00 H ATOM 67239 H2 WAT 4390 32.394 41.304 152.015 1.00 0.00 H TER 67241 WAT 4390 ATOM 67241 O WAT 4391 15.577 78.178 77.215 1.00 0.00 O ATOM 67242 H1 WAT 4391 16.077 77.846 76.470 1.00 0.00 H ATOM 67243 H2 WAT 4391 16.227 78.292 77.908 1.00 0.00 H TER 67245 WAT 4391 ATOM 67245 O WAT 4392 33.770 25.755 81.210 1.00 0.00 O ATOM 67246 H1 WAT 4392 33.551 26.627 81.539 1.00 0.00 H ATOM 67247 H2 WAT 4392 33.237 25.657 80.421 1.00 0.00 H TER 67249 WAT 4392 ATOM 67249 O WAT 4393 9.547 40.877 153.583 1.00 0.00 O ATOM 67250 H1 WAT 4393 9.075 41.118 154.380 1.00 0.00 H ATOM 67251 H2 WAT 4393 9.820 39.972 153.730 1.00 0.00 H TER 67253 WAT 4393 ATOM 67253 O WAT 4394 11.339 8.739 91.237 1.00 0.00 O ATOM 67254 H1 WAT 4394 10.794 7.956 91.311 1.00 0.00 H ATOM 67255 H2 WAT 4394 11.236 9.018 90.327 1.00 0.00 H TER 67257 WAT 4394 ATOM 67257 O WAT 4395 98.851 22.979 157.161 1.00 0.00 O ATOM 67258 H1 WAT 4395 99.767 22.921 156.890 1.00 0.00 H ATOM 67259 H2 WAT 4395 98.532 23.787 156.757 1.00 0.00 H TER 67261 WAT 4395 ATOM 67261 O WAT 4396 44.292 14.520 78.758 1.00 0.00 O ATOM 67262 H1 WAT 4396 45.079 15.011 78.521 1.00 0.00 H ATOM 67263 H2 WAT 4396 44.311 14.484 79.714 1.00 0.00 H TER 67265 WAT 4396 ATOM 67265 O WAT 4397 126.214 77.180 14.900 1.00 0.00 O ATOM 67266 H1 WAT 4397 125.439 77.430 14.396 1.00 0.00 H ATOM 67267 H2 WAT 4397 125.911 76.473 15.470 1.00 0.00 H TER 67269 WAT 4397 ATOM 67269 O WAT 4398 94.503 64.247 138.842 1.00 0.00 O ATOM 67270 H1 WAT 4398 95.114 64.551 139.513 1.00 0.00 H ATOM 67271 H2 WAT 4398 94.467 63.298 138.962 1.00 0.00 H TER 67273 WAT 4398 ATOM 67273 O WAT 4399 25.522 122.381 116.577 1.00 0.00 O ATOM 67274 H1 WAT 4399 24.667 121.957 116.501 1.00 0.00 H ATOM 67275 H2 WAT 4399 25.840 122.124 117.443 1.00 0.00 H TER 67277 WAT 4399 ATOM 67277 O WAT 4400 139.023 126.146 66.254 1.00 0.00 O ATOM 67278 H1 WAT 4400 139.326 125.851 65.395 1.00 0.00 H ATOM 67279 H2 WAT 4400 139.171 125.396 66.830 1.00 0.00 H TER 67281 WAT 4400 ATOM 67281 O WAT 4401 108.883 3.245 12.701 1.00 0.00 O ATOM 67282 H1 WAT 4401 109.191 2.690 11.985 1.00 0.00 H ATOM 67283 H2 WAT 4401 108.711 2.635 13.419 1.00 0.00 H TER 67285 WAT 4401 ATOM 67285 O WAT 4402 112.355 47.911 18.528 1.00 0.00 O ATOM 67286 H1 WAT 4402 111.528 47.512 18.800 1.00 0.00 H ATOM 67287 H2 WAT 4402 112.801 48.119 19.349 1.00 0.00 H TER 67289 WAT 4402 ATOM 67289 O WAT 4403 64.841 105.370 121.692 1.00 0.00 O ATOM 67290 H1 WAT 4403 65.324 105.964 122.266 1.00 0.00 H ATOM 67291 H2 WAT 4403 64.512 105.932 120.990 1.00 0.00 H TER 67293 WAT 4403 ATOM 67293 O WAT 4404 57.702 83.753 153.631 1.00 0.00 O ATOM 67294 H1 WAT 4404 58.103 84.525 154.030 1.00 0.00 H ATOM 67295 H2 WAT 4404 57.990 83.023 154.179 1.00 0.00 H TER 67297 WAT 4404 ATOM 67297 O WAT 4405 117.580 69.604 2.818 1.00 0.00 O ATOM 67298 H1 WAT 4405 117.001 69.857 2.099 1.00 0.00 H ATOM 67299 H2 WAT 4405 117.852 68.712 2.604 1.00 0.00 H TER 67301 WAT 4405 ATOM 67301 O WAT 4406 105.125 123.333 73.412 1.00 0.00 O ATOM 67302 H1 WAT 4406 104.452 123.974 73.643 1.00 0.00 H ATOM 67303 H2 WAT 4406 105.262 123.459 72.473 1.00 0.00 H TER 67305 WAT 4406 ATOM 67305 O WAT 4407 26.225 97.040 72.067 1.00 0.00 O ATOM 67306 H1 WAT 4407 25.777 97.804 71.705 1.00 0.00 H ATOM 67307 H2 WAT 4407 26.790 96.736 71.357 1.00 0.00 H TER 67309 WAT 4407 ATOM 67309 O WAT 4408 99.939 66.405 107.280 1.00 0.00 O ATOM 67310 H1 WAT 4408 100.462 66.835 106.604 1.00 0.00 H ATOM 67311 H2 WAT 4408 99.650 67.118 107.850 1.00 0.00 H TER 67313 WAT 4408 ATOM 67313 O WAT 4409 11.646 43.793 16.643 1.00 0.00 O ATOM 67314 H1 WAT 4409 11.811 42.905 16.325 1.00 0.00 H ATOM 67315 H2 WAT 4409 10.816 44.043 16.237 1.00 0.00 H TER 67317 WAT 4409 ATOM 67317 O WAT 4410 97.074 23.916 12.970 1.00 0.00 O ATOM 67318 H1 WAT 4410 97.595 24.454 13.567 1.00 0.00 H ATOM 67319 H2 WAT 4410 97.719 23.392 12.495 1.00 0.00 H TER 67321 WAT 4410 ATOM 67321 O WAT 4411 27.247 110.537 23.350 1.00 0.00 O ATOM 67322 H1 WAT 4411 27.877 110.421 22.639 1.00 0.00 H ATOM 67323 H2 WAT 4411 27.750 110.947 24.053 1.00 0.00 H TER 67325 WAT 4411 ATOM 67325 O WAT 4412 68.362 106.749 17.942 1.00 0.00 O ATOM 67326 H1 WAT 4412 68.360 106.717 18.899 1.00 0.00 H ATOM 67327 H2 WAT 4412 69.025 106.110 17.682 1.00 0.00 H TER 67329 WAT 4412 ATOM 67329 O WAT 4413 125.197 48.572 128.004 1.00 0.00 O ATOM 67330 H1 WAT 4413 124.895 49.425 127.691 1.00 0.00 H ATOM 67331 H2 WAT 4413 124.796 48.478 128.868 1.00 0.00 H TER 67333 WAT 4413 ATOM 67333 O WAT 4414 53.309 111.481 96.476 1.00 0.00 O ATOM 67334 H1 WAT 4414 53.081 111.556 95.550 1.00 0.00 H ATOM 67335 H2 WAT 4414 52.466 111.475 96.930 1.00 0.00 H TER 67337 WAT 4414 ATOM 67337 O WAT 4415 34.864 46.216 9.351 1.00 0.00 O ATOM 67338 H1 WAT 4415 34.534 45.595 8.702 1.00 0.00 H ATOM 67339 H2 WAT 4415 34.764 47.072 8.935 1.00 0.00 H TER 67341 WAT 4415 ATOM 67341 O WAT 4416 74.551 63.645 150.998 1.00 0.00 O ATOM 67342 H1 WAT 4416 75.299 63.255 151.450 1.00 0.00 H ATOM 67343 H2 WAT 4416 73.965 63.925 151.701 1.00 0.00 H TER 67345 WAT 4416 ATOM 67345 O WAT 4417 120.619 77.177 157.014 1.00 0.00 O ATOM 67346 H1 WAT 4417 119.741 77.203 157.395 1.00 0.00 H ATOM 67347 H2 WAT 4417 120.581 77.794 156.283 1.00 0.00 H TER 67349 WAT 4417 ATOM 67349 O WAT 4418 10.261 100.661 108.025 1.00 0.00 O ATOM 67350 H1 WAT 4418 10.286 101.596 108.225 1.00 0.00 H ATOM 67351 H2 WAT 4418 9.420 100.533 107.585 1.00 0.00 H TER 67353 WAT 4418 ATOM 67353 O WAT 4419 114.814 80.246 146.329 1.00 0.00 O ATOM 67354 H1 WAT 4419 114.763 81.161 146.605 1.00 0.00 H ATOM 67355 H2 WAT 4419 114.660 80.272 145.384 1.00 0.00 H TER 67357 WAT 4419 ATOM 67357 O WAT 4420 145.032 20.720 122.722 1.00 0.00 O ATOM 67358 H1 WAT 4420 145.403 20.043 123.288 1.00 0.00 H ATOM 67359 H2 WAT 4420 145.720 20.901 122.081 1.00 0.00 H TER 67361 WAT 4420 ATOM 67361 O WAT 4421 44.498 49.660 94.114 1.00 0.00 O ATOM 67362 H1 WAT 4421 43.974 49.678 94.915 1.00 0.00 H ATOM 67363 H2 WAT 4421 45.390 49.485 94.414 1.00 0.00 H TER 67365 WAT 4421 ATOM 67365 O WAT 4422 122.282 112.938 66.066 1.00 0.00 O ATOM 67366 H1 WAT 4422 122.113 113.825 65.750 1.00 0.00 H ATOM 67367 H2 WAT 4422 121.886 112.914 66.937 1.00 0.00 H TER 67369 WAT 4422 ATOM 67369 O WAT 4423 73.342 138.526 84.763 1.00 0.00 O ATOM 67370 H1 WAT 4423 73.709 138.620 85.642 1.00 0.00 H ATOM 67371 H2 WAT 4423 72.911 137.671 84.774 1.00 0.00 H TER 67373 WAT 4423 ATOM 67373 O WAT 4424 144.347 100.716 104.229 1.00 0.00 O ATOM 67374 H1 WAT 4424 144.891 99.992 104.540 1.00 0.00 H ATOM 67375 H2 WAT 4424 144.816 101.504 104.505 1.00 0.00 H TER 67377 WAT 4424 ATOM 67377 O WAT 4425 124.052 24.710 131.652 1.00 0.00 O ATOM 67378 H1 WAT 4425 124.879 24.477 132.075 1.00 0.00 H ATOM 67379 H2 WAT 4425 123.954 25.647 131.819 1.00 0.00 H TER 67381 WAT 4425 ATOM 67381 O WAT 4426 142.660 124.939 158.531 1.00 0.00 O ATOM 67382 H1 WAT 4426 142.572 124.256 159.196 1.00 0.00 H ATOM 67383 H2 WAT 4426 143.593 125.156 158.534 1.00 0.00 H TER 67385 WAT 4426 ATOM 67385 O WAT 4427 36.727 12.740 114.123 1.00 0.00 O ATOM 67386 H1 WAT 4427 36.111 12.164 113.671 1.00 0.00 H ATOM 67387 H2 WAT 4427 36.536 13.612 113.779 1.00 0.00 H TER 67389 WAT 4427 ATOM 67389 O WAT 4428 106.463 34.302 89.299 1.00 0.00 O ATOM 67390 H1 WAT 4428 105.663 34.799 89.133 1.00 0.00 H ATOM 67391 H2 WAT 4428 107.148 34.790 88.842 1.00 0.00 H TER 67393 WAT 4428 ATOM 67393 O WAT 4429 99.098 48.430 93.786 1.00 0.00 O ATOM 67394 H1 WAT 4429 98.226 48.597 93.430 1.00 0.00 H ATOM 67395 H2 WAT 4429 99.695 48.849 93.166 1.00 0.00 H TER 67397 WAT 4429 ATOM 67397 O WAT 4430 22.758 43.478 59.154 1.00 0.00 O ATOM 67398 H1 WAT 4430 23.453 44.059 59.465 1.00 0.00 H ATOM 67399 H2 WAT 4430 22.363 43.129 59.953 1.00 0.00 H TER 67401 WAT 4430 ATOM 67401 O WAT 4431 57.610 60.401 140.937 1.00 0.00 O ATOM 67402 H1 WAT 4431 57.967 60.256 140.060 1.00 0.00 H ATOM 67403 H2 WAT 4431 57.812 59.596 141.414 1.00 0.00 H TER 67405 WAT 4431 ATOM 67405 O WAT 4432 15.391 39.245 133.430 1.00 0.00 O ATOM 67406 H1 WAT 4432 14.797 39.171 132.683 1.00 0.00 H ATOM 67407 H2 WAT 4432 15.996 39.945 133.186 1.00 0.00 H TER 67409 WAT 4432 ATOM 67409 O WAT 4433 49.569 101.949 127.753 1.00 0.00 O ATOM 67410 H1 WAT 4433 50.361 102.397 127.456 1.00 0.00 H ATOM 67411 H2 WAT 4433 49.579 101.112 127.288 1.00 0.00 H TER 67413 WAT 4433 ATOM 67413 O WAT 4434 79.364 54.713 100.679 1.00 0.00 O ATOM 67414 H1 WAT 4434 80.055 54.233 100.223 1.00 0.00 H ATOM 67415 H2 WAT 4434 79.750 55.570 100.863 1.00 0.00 H TER 67417 WAT 4434 ATOM 67417 O WAT 4435 115.969 97.017 106.187 1.00 0.00 O ATOM 67418 H1 WAT 4435 115.482 97.434 106.899 1.00 0.00 H ATOM 67419 H2 WAT 4435 116.672 96.538 106.626 1.00 0.00 H TER 67421 WAT 4435 ATOM 67421 O WAT 4436 131.389 110.334 111.886 1.00 0.00 O ATOM 67422 H1 WAT 4436 130.771 110.255 112.613 1.00 0.00 H ATOM 67423 H2 WAT 4436 130.904 110.019 111.123 1.00 0.00 H TER 67425 WAT 4436 ATOM 67425 O WAT 4437 117.430 31.320 151.947 1.00 0.00 O ATOM 67426 H1 WAT 4437 117.446 31.741 152.807 1.00 0.00 H ATOM 67427 H2 WAT 4437 117.767 31.986 151.348 1.00 0.00 H TER 67429 WAT 4437 ATOM 67429 O WAT 4438 71.621 100.203 101.699 1.00 0.00 O ATOM 67430 H1 WAT 4438 72.088 99.431 101.378 1.00 0.00 H ATOM 67431 H2 WAT 4438 71.523 100.051 102.639 1.00 0.00 H TER 67433 WAT 4438 ATOM 67433 O WAT 4439 5.599 128.522 55.672 1.00 0.00 O ATOM 67434 H1 WAT 4439 5.417 127.585 55.751 1.00 0.00 H ATOM 67435 H2 WAT 4439 5.119 128.794 54.890 1.00 0.00 H TER 67437 WAT 4439 ATOM 67437 O WAT 4440 100.678 61.313 0.168 1.00 0.00 O ATOM 67438 H1 WAT 4440 100.587 62.225 -0.109 1.00 0.00 H ATOM 67439 H2 WAT 4440 100.510 61.332 1.110 1.00 0.00 H TER 67441 WAT 4440 ATOM 67441 O WAT 4441 136.767 127.828 117.006 1.00 0.00 O ATOM 67442 H1 WAT 4441 136.081 128.208 116.457 1.00 0.00 H ATOM 67443 H2 WAT 4441 137.181 127.168 116.451 1.00 0.00 H TER 67445 WAT 4441 ATOM 67445 O WAT 4442 34.159 98.998 146.526 1.00 0.00 O ATOM 67446 H1 WAT 4442 35.096 98.812 146.468 1.00 0.00 H ATOM 67447 H2 WAT 4442 34.073 99.896 146.206 1.00 0.00 H TER 67449 WAT 4442 ATOM 67449 O WAT 4443 102.769 83.022 12.730 1.00 0.00 O ATOM 67450 H1 WAT 4443 102.532 83.913 12.473 1.00 0.00 H ATOM 67451 H2 WAT 4443 101.932 82.560 12.793 1.00 0.00 H TER 67453 WAT 4443 ATOM 67453 O WAT 4444 66.589 20.274 110.814 1.00 0.00 O ATOM 67454 H1 WAT 4444 67.133 19.652 111.299 1.00 0.00 H ATOM 67455 H2 WAT 4444 65.886 20.501 111.422 1.00 0.00 H TER 67457 WAT 4444 ATOM 67457 O WAT 4445 61.540 44.494 145.795 1.00 0.00 O ATOM 67458 H1 WAT 4445 62.373 44.950 145.915 1.00 0.00 H ATOM 67459 H2 WAT 4445 61.166 44.881 145.004 1.00 0.00 H TER 67461 WAT 4445 ATOM 67461 O WAT 4446 52.972 126.488 61.450 1.00 0.00 O ATOM 67462 H1 WAT 4446 53.446 125.745 61.822 1.00 0.00 H ATOM 67463 H2 WAT 4446 52.067 126.183 61.381 1.00 0.00 H TER 67465 WAT 4446 ATOM 67465 O WAT 4447 126.170 112.733 79.551 1.00 0.00 O ATOM 67466 H1 WAT 4447 125.962 113.203 78.744 1.00 0.00 H ATOM 67467 H2 WAT 4447 126.601 111.931 79.257 1.00 0.00 H TER 67469 WAT 4447 ATOM 67469 O WAT 4448 44.979 70.183 137.371 1.00 0.00 O ATOM 67470 H1 WAT 4448 45.111 70.142 136.423 1.00 0.00 H ATOM 67471 H2 WAT 4448 45.305 71.048 137.620 1.00 0.00 H TER 67473 WAT 4448 ATOM 67473 O WAT 4449 96.390 105.145 66.621 1.00 0.00 O ATOM 67474 H1 WAT 4449 95.594 105.586 66.919 1.00 0.00 H ATOM 67475 H2 WAT 4449 96.603 105.572 65.791 1.00 0.00 H TER 67477 WAT 4449 ATOM 67477 O WAT 4450 142.765 113.425 102.448 1.00 0.00 O ATOM 67478 H1 WAT 4450 142.472 112.653 102.932 1.00 0.00 H ATOM 67479 H2 WAT 4450 142.537 114.163 103.014 1.00 0.00 H TER 67481 WAT 4450 ATOM 67481 O WAT 4451 96.601 41.818 145.994 1.00 0.00 O ATOM 67482 H1 WAT 4451 97.549 41.702 146.067 1.00 0.00 H ATOM 67483 H2 WAT 4451 96.488 42.752 145.816 1.00 0.00 H TER 67485 WAT 4451 ATOM 67485 O WAT 4452 7.457 31.666 80.415 1.00 0.00 O ATOM 67486 H1 WAT 4452 6.900 32.256 80.924 1.00 0.00 H ATOM 67487 H2 WAT 4452 7.124 30.791 80.615 1.00 0.00 H TER 67489 WAT 4452 ATOM 67489 O WAT 4453 114.557 20.987 4.114 1.00 0.00 O ATOM 67490 H1 WAT 4453 113.634 20.807 4.292 1.00 0.00 H ATOM 67491 H2 WAT 4453 115.005 20.774 4.932 1.00 0.00 H TER 67493 WAT 4453 ATOM 67493 O WAT 4454 85.944 10.861 109.079 1.00 0.00 O ATOM 67494 H1 WAT 4454 85.683 11.228 108.234 1.00 0.00 H ATOM 67495 H2 WAT 4454 85.163 10.940 109.626 1.00 0.00 H TER 67497 WAT 4454 ATOM 67497 O WAT 4455 111.988 74.698 87.440 1.00 0.00 O ATOM 67498 H1 WAT 4455 111.385 74.532 86.716 1.00 0.00 H ATOM 67499 H2 WAT 4455 111.711 74.092 88.127 1.00 0.00 H TER 67501 WAT 4455 ATOM 67501 O WAT 4456 133.622 125.170 4.747 1.00 0.00 O ATOM 67502 H1 WAT 4456 133.125 125.801 4.226 1.00 0.00 H ATOM 67503 H2 WAT 4456 133.242 124.321 4.524 1.00 0.00 H TER 67505 WAT 4456 ATOM 67505 O WAT 4457 55.088 85.045 23.321 1.00 0.00 O ATOM 67506 H1 WAT 4457 54.977 84.218 22.852 1.00 0.00 H ATOM 67507 H2 WAT 4457 55.940 85.372 23.031 1.00 0.00 H TER 67509 WAT 4457 ATOM 67509 O WAT 4458 54.095 43.089 23.502 1.00 0.00 O ATOM 67510 H1 WAT 4458 53.817 42.820 22.626 1.00 0.00 H ATOM 67511 H2 WAT 4458 53.794 43.995 23.581 1.00 0.00 H TER 67513 WAT 4458 ATOM 67513 O WAT 4459 74.580 12.612 120.584 1.00 0.00 O ATOM 67514 H1 WAT 4459 74.807 13.527 120.417 1.00 0.00 H ATOM 67515 H2 WAT 4459 73.977 12.382 119.877 1.00 0.00 H TER 67517 WAT 4459 ATOM 67517 O WAT 4460 36.824 65.332 120.400 1.00 0.00 O ATOM 67518 H1 WAT 4460 37.173 64.591 119.906 1.00 0.00 H ATOM 67519 H2 WAT 4460 36.565 64.958 121.242 1.00 0.00 H TER 67521 WAT 4460 ATOM 67521 O WAT 4461 123.288 98.239 145.326 1.00 0.00 O ATOM 67522 H1 WAT 4461 123.484 97.416 144.879 1.00 0.00 H ATOM 67523 H2 WAT 4461 122.910 98.797 144.647 1.00 0.00 H TER 67525 WAT 4461 ATOM 67525 O WAT 4462 126.928 121.947 152.261 1.00 0.00 O ATOM 67526 H1 WAT 4462 127.060 121.390 151.495 1.00 0.00 H ATOM 67527 H2 WAT 4462 126.492 121.380 152.898 1.00 0.00 H TER 67529 WAT 4462 ATOM 67529 O WAT 4463 88.160 138.045 106.810 1.00 0.00 O ATOM 67530 H1 WAT 4463 87.835 137.147 106.874 1.00 0.00 H ATOM 67531 H2 WAT 4463 88.565 138.214 107.661 1.00 0.00 H TER 67533 WAT 4463 ATOM 67533 O WAT 4464 93.169 72.315 86.106 1.00 0.00 O ATOM 67534 H1 WAT 4464 92.957 72.306 87.039 1.00 0.00 H ATOM 67535 H2 WAT 4464 94.089 72.054 86.067 1.00 0.00 H TER 67537 WAT 4464 ATOM 67537 O WAT 4465 20.261 33.616 132.840 1.00 0.00 O ATOM 67538 H1 WAT 4465 19.377 33.649 133.206 1.00 0.00 H ATOM 67539 H2 WAT 4465 20.193 33.007 132.105 1.00 0.00 H TER 67541 WAT 4465 ATOM 67541 O WAT 4466 31.127 138.447 49.170 1.00 0.00 O ATOM 67542 H1 WAT 4466 30.642 137.731 48.759 1.00 0.00 H ATOM 67543 H2 WAT 4466 30.451 139.068 49.442 1.00 0.00 H TER 67545 WAT 4466 ATOM 67545 O WAT 4467 106.599 69.883 152.879 1.00 0.00 O ATOM 67546 H1 WAT 4467 106.883 68.980 152.736 1.00 0.00 H ATOM 67547 H2 WAT 4467 106.821 70.336 152.065 1.00 0.00 H TER 67549 WAT 4467 ATOM 67549 O WAT 4468 10.055 131.123 87.330 1.00 0.00 O ATOM 67550 H1 WAT 4468 10.578 131.235 86.536 1.00 0.00 H ATOM 67551 H2 WAT 4468 9.915 132.013 87.652 1.00 0.00 H TER 67553 WAT 4468 ATOM 67553 O WAT 4469 81.327 96.273 117.765 1.00 0.00 O ATOM 67554 H1 WAT 4469 82.181 96.208 118.192 1.00 0.00 H ATOM 67555 H2 WAT 4469 81.511 96.122 116.838 1.00 0.00 H TER 67557 WAT 4469 ATOM 67557 O WAT 4470 3.442 15.474 85.425 1.00 0.00 O ATOM 67558 H1 WAT 4470 3.201 14.678 84.951 1.00 0.00 H ATOM 67559 H2 WAT 4470 2.941 15.429 86.239 1.00 0.00 H TER 67561 WAT 4470 ATOM 67561 O WAT 4471 83.575 67.350 158.702 1.00 0.00 O ATOM 67562 H1 WAT 4471 83.435 67.535 157.773 1.00 0.00 H ATOM 67563 H2 WAT 4471 82.716 67.479 159.104 1.00 0.00 H TER 67565 WAT 4471 ATOM 67565 O WAT 4472 18.228 99.595 116.059 1.00 0.00 O ATOM 67566 H1 WAT 4472 17.304 99.525 116.297 1.00 0.00 H ATOM 67567 H2 WAT 4472 18.227 99.625 115.102 1.00 0.00 H TER 67569 WAT 4472 ATOM 67569 O WAT 4473 33.436 123.757 76.517 1.00 0.00 O ATOM 67570 H1 WAT 4473 34.308 123.722 76.126 1.00 0.00 H ATOM 67571 H2 WAT 4473 33.595 123.725 77.461 1.00 0.00 H TER 67573 WAT 4473 ATOM 67573 O WAT 4474 65.875 128.012 4.899 1.00 0.00 O ATOM 67574 H1 WAT 4474 65.746 127.138 4.529 1.00 0.00 H ATOM 67575 H2 WAT 4474 66.825 128.125 4.920 1.00 0.00 H TER 67577 WAT 4474 ATOM 67577 O WAT 4475 115.686 74.275 127.152 1.00 0.00 O ATOM 67578 H1 WAT 4475 115.392 74.780 127.910 1.00 0.00 H ATOM 67579 H2 WAT 4475 116.178 74.903 126.622 1.00 0.00 H TER 67581 WAT 4475 ATOM 67581 O WAT 4476 127.466 6.855 76.961 1.00 0.00 O ATOM 67582 H1 WAT 4476 128.121 6.264 77.332 1.00 0.00 H ATOM 67583 H2 WAT 4476 127.882 7.210 76.175 1.00 0.00 H TER 67585 WAT 4476 ATOM 67585 O WAT 4477 80.690 83.554 127.415 1.00 0.00 O ATOM 67586 H1 WAT 4477 80.654 84.506 127.327 1.00 0.00 H ATOM 67587 H2 WAT 4477 80.235 83.224 126.640 1.00 0.00 H TER 67589 WAT 4477 ATOM 67589 O WAT 4478 146.049 17.700 152.761 1.00 0.00 O ATOM 67590 H1 WAT 4478 145.262 17.420 153.229 1.00 0.00 H ATOM 67591 H2 WAT 4478 145.720 18.091 151.952 1.00 0.00 H TER 67593 WAT 4478 ATOM 67593 O WAT 4479 110.967 43.298 97.344 1.00 0.00 O ATOM 67594 H1 WAT 4479 111.213 44.048 96.802 1.00 0.00 H ATOM 67595 H2 WAT 4479 111.530 42.587 97.039 1.00 0.00 H TER 67597 WAT 4479 ATOM 67597 O WAT 4480 121.476 11.903 104.729 1.00 0.00 O ATOM 67598 H1 WAT 4480 121.725 11.018 104.464 1.00 0.00 H ATOM 67599 H2 WAT 4480 121.781 11.977 105.633 1.00 0.00 H TER 67601 WAT 4480 ATOM 67601 O WAT 4481 80.543 30.129 146.984 1.00 0.00 O ATOM 67602 H1 WAT 4481 79.760 30.667 147.100 1.00 0.00 H ATOM 67603 H2 WAT 4481 80.375 29.346 147.508 1.00 0.00 H TER 67605 WAT 4481 ATOM 67605 O WAT 4482 75.784 94.725 96.805 1.00 0.00 O ATOM 67606 H1 WAT 4482 75.427 95.552 96.480 1.00 0.00 H ATOM 67607 H2 WAT 4482 75.053 94.109 96.745 1.00 0.00 H TER 67609 WAT 4482 ATOM 67609 O WAT 4483 7.200 139.762 142.203 1.00 0.00 O ATOM 67610 H1 WAT 4483 7.813 140.350 142.645 1.00 0.00 H ATOM 67611 H2 WAT 4483 6.336 140.059 142.488 1.00 0.00 H TER 67613 WAT 4483 ATOM 67613 O WAT 4484 50.103 17.498 2.991 1.00 0.00 O ATOM 67614 H1 WAT 4484 50.320 18.407 2.786 1.00 0.00 H ATOM 67615 H2 WAT 4484 49.716 17.535 3.866 1.00 0.00 H TER 67617 WAT 4484 ATOM 67617 O WAT 4485 53.974 72.265 72.871 1.00 0.00 O ATOM 67618 H1 WAT 4485 53.963 71.525 72.263 1.00 0.00 H ATOM 67619 H2 WAT 4485 54.613 72.872 72.497 1.00 0.00 H TER 67621 WAT 4485 ATOM 67621 O WAT 4486 111.785 69.454 87.376 1.00 0.00 O ATOM 67622 H1 WAT 4486 111.304 69.900 88.074 1.00 0.00 H ATOM 67623 H2 WAT 4486 112.681 69.388 87.708 1.00 0.00 H TER 67625 WAT 4486 ATOM 67625 O WAT 4487 49.812 76.573 1.143 1.00 0.00 O ATOM 67626 H1 WAT 4487 49.290 75.781 1.273 1.00 0.00 H ATOM 67627 H2 WAT 4487 49.532 77.162 1.843 1.00 0.00 H TER 67629 WAT 4487 ATOM 67629 O WAT 4488 76.241 13.048 8.512 1.00 0.00 O ATOM 67630 H1 WAT 4488 77.029 13.460 8.865 1.00 0.00 H ATOM 67631 H2 WAT 4488 75.787 12.701 9.281 1.00 0.00 H TER 67633 WAT 4488 ATOM 67633 O WAT 4489 38.573 36.332 56.642 1.00 0.00 O ATOM 67634 H1 WAT 4489 38.870 37.118 56.183 1.00 0.00 H ATOM 67635 H2 WAT 4489 37.939 36.654 57.283 1.00 0.00 H TER 67637 WAT 4489 ATOM 67637 O WAT 4490 81.371 106.757 19.053 1.00 0.00 O ATOM 67638 H1 WAT 4490 80.478 106.478 19.258 1.00 0.00 H ATOM 67639 H2 WAT 4490 81.573 106.323 18.224 1.00 0.00 H TER 67641 WAT 4490 ATOM 67641 O WAT 4491 2.262 27.507 90.980 1.00 0.00 O ATOM 67642 H1 WAT 4491 2.330 28.376 91.376 1.00 0.00 H ATOM 67643 H2 WAT 4491 1.324 27.382 90.835 1.00 0.00 H TER 67645 WAT 4491 ATOM 67645 O WAT 4492 75.821 69.996 103.870 1.00 0.00 O ATOM 67646 H1 WAT 4492 75.507 70.404 103.063 1.00 0.00 H ATOM 67647 H2 WAT 4492 75.025 69.765 104.348 1.00 0.00 H TER 67649 WAT 4492 ATOM 67649 O WAT 4493 31.076 70.552 154.235 1.00 0.00 O ATOM 67650 H1 WAT 4493 31.845 71.117 154.153 1.00 0.00 H ATOM 67651 H2 WAT 4493 31.324 69.905 154.895 1.00 0.00 H TER 67653 WAT 4493 ATOM 67653 O WAT 4494 106.812 124.367 69.148 1.00 0.00 O ATOM 67654 H1 WAT 4494 107.203 124.869 69.863 1.00 0.00 H ATOM 67655 H2 WAT 4494 106.368 125.024 68.610 1.00 0.00 H TER 67657 WAT 4494 ATOM 67657 O WAT 4495 95.462 61.921 17.008 1.00 0.00 O ATOM 67658 H1 WAT 4495 96.387 62.126 17.142 1.00 0.00 H ATOM 67659 H2 WAT 4495 95.139 61.691 17.879 1.00 0.00 H TER 67661 WAT 4495 ATOM 67661 O WAT 4496 121.075 31.971 4.055 1.00 0.00 O ATOM 67662 H1 WAT 4496 120.350 32.473 4.427 1.00 0.00 H ATOM 67663 H2 WAT 4496 121.344 31.382 4.761 1.00 0.00 H TER 67665 WAT 4496 ATOM 67665 O WAT 4497 1.609 4.655 103.077 1.00 0.00 O ATOM 67666 H1 WAT 4497 1.229 5.235 103.737 1.00 0.00 H ATOM 67667 H2 WAT 4497 0.854 4.247 102.654 1.00 0.00 H TER 67669 WAT 4497 ATOM 67669 O WAT 4498 74.505 25.992 125.852 1.00 0.00 O ATOM 67670 H1 WAT 4498 75.422 25.725 125.916 1.00 0.00 H ATOM 67671 H2 WAT 4498 74.049 25.211 125.539 1.00 0.00 H TER 67673 WAT 4498 ATOM 67673 O WAT 4499 73.180 73.567 119.464 1.00 0.00 O ATOM 67674 H1 WAT 4499 72.330 73.995 119.569 1.00 0.00 H ATOM 67675 H2 WAT 4499 73.169 72.853 120.102 1.00 0.00 H TER 67677 WAT 4499 ATOM 67677 O WAT 4500 141.900 97.066 77.657 1.00 0.00 O ATOM 67678 H1 WAT 4500 141.692 96.143 77.802 1.00 0.00 H ATOM 67679 H2 WAT 4500 142.853 97.087 77.577 1.00 0.00 H TER 67681 WAT 4500 ATOM 67681 O WAT 4501 23.387 27.328 128.179 1.00 0.00 O ATOM 67682 H1 WAT 4501 22.509 27.641 127.961 1.00 0.00 H ATOM 67683 H2 WAT 4501 23.246 26.459 128.555 1.00 0.00 H TER 67685 WAT 4501 ATOM 67685 O WAT 4502 111.422 63.163 83.720 1.00 0.00 O ATOM 67686 H1 WAT 4502 111.875 63.625 84.425 1.00 0.00 H ATOM 67687 H2 WAT 4502 111.786 62.277 83.742 1.00 0.00 H TER 67689 WAT 4502 ATOM 67689 O WAT 4503 20.061 36.074 130.759 1.00 0.00 O ATOM 67690 H1 WAT 4503 20.353 35.370 131.338 1.00 0.00 H ATOM 67691 H2 WAT 4503 20.845 36.602 130.610 1.00 0.00 H TER 67693 WAT 4503 ATOM 67693 O WAT 4504 137.544 25.962 63.685 1.00 0.00 O ATOM 67694 H1 WAT 4504 137.913 26.234 62.845 1.00 0.00 H ATOM 67695 H2 WAT 4504 138.032 26.468 64.335 1.00 0.00 H TER 67697 WAT 4504 ATOM 67697 O WAT 4505 143.253 18.898 72.272 1.00 0.00 O ATOM 67698 H1 WAT 4505 143.252 19.855 72.294 1.00 0.00 H ATOM 67699 H2 WAT 4505 143.803 18.676 71.521 1.00 0.00 H TER 67701 WAT 4505 ATOM 67701 O WAT 4506 130.112 141.720 128.166 1.00 0.00 O ATOM 67702 H1 WAT 4506 130.610 141.809 127.354 1.00 0.00 H ATOM 67703 H2 WAT 4506 129.312 142.223 128.012 1.00 0.00 H TER 67705 WAT 4506 ATOM 67705 O WAT 4507 117.876 109.940 13.298 1.00 0.00 O ATOM 67706 H1 WAT 4507 117.435 110.007 14.145 1.00 0.00 H ATOM 67707 H2 WAT 4507 117.298 110.399 12.689 1.00 0.00 H TER 67709 WAT 4507 ATOM 67709 O WAT 4508 124.899 91.214 0.031 1.00 0.00 O ATOM 67710 H1 WAT 4508 125.200 92.065 0.351 1.00 0.00 H ATOM 67711 H2 WAT 4508 125.656 90.638 0.135 1.00 0.00 H TER 67713 WAT 4508 ATOM 67713 O WAT 4509 109.782 94.171 51.845 1.00 0.00 O ATOM 67714 H1 WAT 4509 110.154 94.831 52.431 1.00 0.00 H ATOM 67715 H2 WAT 4509 110.542 93.759 51.435 1.00 0.00 H TER 67717 WAT 4509 ATOM 67717 O WAT 4510 68.669 19.354 147.230 1.00 0.00 O ATOM 67718 H1 WAT 4510 68.181 18.531 147.254 1.00 0.00 H ATOM 67719 H2 WAT 4510 68.153 19.922 146.659 1.00 0.00 H TER 67721 WAT 4510 ATOM 67721 O WAT 4511 73.054 106.739 17.943 1.00 0.00 O ATOM 67722 H1 WAT 4511 72.447 107.456 17.761 1.00 0.00 H ATOM 67723 H2 WAT 4511 73.685 107.110 18.560 1.00 0.00 H TER 67725 WAT 4511 ATOM 67725 O WAT 4512 39.702 62.182 102.906 1.00 0.00 O ATOM 67726 H1 WAT 4512 40.471 62.676 102.622 1.00 0.00 H ATOM 67727 H2 WAT 4512 39.149 62.132 102.127 1.00 0.00 H TER 67729 WAT 4512 ATOM 67729 O WAT 4513 99.243 80.994 89.150 1.00 0.00 O ATOM 67730 H1 WAT 4513 99.139 80.414 88.396 1.00 0.00 H ATOM 67731 H2 WAT 4513 99.018 80.450 89.904 1.00 0.00 H TER 67733 WAT 4513 ATOM 67733 O WAT 4514 75.248 32.800 77.632 1.00 0.00 O ATOM 67734 H1 WAT 4514 75.976 32.433 78.133 1.00 0.00 H ATOM 67735 H2 WAT 4514 74.811 32.038 77.251 1.00 0.00 H TER 67737 WAT 4514 ATOM 67737 O WAT 4515 16.345 143.827 59.543 1.00 0.00 O ATOM 67738 H1 WAT 4515 17.038 144.220 59.012 1.00 0.00 H ATOM 67739 H2 WAT 4515 15.549 144.288 59.276 1.00 0.00 H TER 67741 WAT 4515 ATOM 67741 O WAT 4516 74.267 105.126 130.078 1.00 0.00 O ATOM 67742 H1 WAT 4516 74.651 105.469 129.271 1.00 0.00 H ATOM 67743 H2 WAT 4516 73.516 105.694 130.247 1.00 0.00 H TER 67745 WAT 4516 ATOM 67745 O WAT 4517 114.449 22.396 128.867 1.00 0.00 O ATOM 67746 H1 WAT 4517 114.797 21.550 129.151 1.00 0.00 H ATOM 67747 H2 WAT 4517 114.512 22.953 129.643 1.00 0.00 H TER 67749 WAT 4517 ATOM 67749 O WAT 4518 143.046 102.957 54.108 1.00 0.00 O ATOM 67750 H1 WAT 4518 142.964 103.388 53.257 1.00 0.00 H ATOM 67751 H2 WAT 4518 143.736 102.306 53.981 1.00 0.00 H TER 67753 WAT 4518 ATOM 67753 O WAT 4519 95.727 3.536 64.673 1.00 0.00 O ATOM 67754 H1 WAT 4519 94.777 3.571 64.781 1.00 0.00 H ATOM 67755 H2 WAT 4519 95.921 4.224 64.036 1.00 0.00 H TER 67757 WAT 4519 ATOM 67757 O WAT 4520 71.665 113.721 12.837 1.00 0.00 O ATOM 67758 H1 WAT 4520 70.923 113.398 12.326 1.00 0.00 H ATOM 67759 H2 WAT 4520 71.475 113.448 13.735 1.00 0.00 H TER 67761 WAT 4520 ATOM 67761 O WAT 4521 122.117 13.836 83.347 1.00 0.00 O ATOM 67762 H1 WAT 4521 121.499 14.007 84.058 1.00 0.00 H ATOM 67763 H2 WAT 4521 122.369 12.920 83.463 1.00 0.00 H TER 67765 WAT 4521 ATOM 67765 O WAT 4522 88.850 84.992 126.461 1.00 0.00 O ATOM 67766 H1 WAT 4522 88.243 84.448 125.958 1.00 0.00 H ATOM 67767 H2 WAT 4522 88.544 84.918 127.365 1.00 0.00 H TER 67769 WAT 4522 ATOM 67769 O WAT 4523 7.627 2.844 115.000 1.00 0.00 O ATOM 67770 H1 WAT 4523 8.446 2.490 114.653 1.00 0.00 H ATOM 67771 H2 WAT 4523 7.681 3.785 114.831 1.00 0.00 H TER 67773 WAT 4523 ATOM 67773 O WAT 4524 71.518 111.705 149.342 1.00 0.00 O ATOM 67774 H1 WAT 4524 72.142 112.427 149.264 1.00 0.00 H ATOM 67775 H2 WAT 4524 72.053 110.916 149.255 1.00 0.00 H TER 67777 WAT 4524 ATOM 67777 O WAT 4525 136.065 5.919 120.076 1.00 0.00 O ATOM 67778 H1 WAT 4525 135.362 6.568 120.127 1.00 0.00 H ATOM 67779 H2 WAT 4525 135.832 5.263 120.733 1.00 0.00 H TER 67781 WAT 4525 ATOM 67781 O WAT 4526 134.384 132.378 112.548 1.00 0.00 O ATOM 67782 H1 WAT 4526 133.759 133.012 112.195 1.00 0.00 H ATOM 67783 H2 WAT 4526 134.870 132.865 113.213 1.00 0.00 H TER 67785 WAT 4526 ATOM 67785 O WAT 4527 123.703 70.357 131.032 1.00 0.00 O ATOM 67786 H1 WAT 4527 124.079 69.490 131.187 1.00 0.00 H ATOM 67787 H2 WAT 4527 122.809 70.180 130.737 1.00 0.00 H TER 67789 WAT 4527 ATOM 67789 O WAT 4528 109.963 49.038 66.478 1.00 0.00 O ATOM 67790 H1 WAT 4528 109.149 48.950 65.981 1.00 0.00 H ATOM 67791 H2 WAT 4528 110.285 49.912 66.258 1.00 0.00 H TER 67793 WAT 4528 ATOM 67793 O WAT 4529 9.234 47.012 92.118 1.00 0.00 O ATOM 67794 H1 WAT 4529 9.044 46.315 92.747 1.00 0.00 H ATOM 67795 H2 WAT 4529 8.664 47.734 92.382 1.00 0.00 H TER 67797 WAT 4529 ATOM 67797 O WAT 4530 62.607 53.747 8.047 1.00 0.00 O ATOM 67798 H1 WAT 4530 63.473 53.377 7.872 1.00 0.00 H ATOM 67799 H2 WAT 4530 62.379 54.213 7.244 1.00 0.00 H TER 67801 WAT 4530 ATOM 67801 O WAT 4531 0.408 20.712 151.656 1.00 0.00 O ATOM 67802 H1 WAT 4531 -0.052 21.540 151.517 1.00 0.00 H ATOM 67803 H2 WAT 4531 0.432 20.608 152.607 1.00 0.00 H TER 67805 WAT 4531 ATOM 67805 O WAT 4532 26.888 61.832 23.120 1.00 0.00 O ATOM 67806 H1 WAT 4532 26.264 62.542 22.967 1.00 0.00 H ATOM 67807 H2 WAT 4532 27.690 62.274 23.398 1.00 0.00 H TER 67809 WAT 4532 ATOM 67809 O WAT 4533 93.785 134.472 72.443 1.00 0.00 O ATOM 67810 H1 WAT 4533 94.559 134.572 72.997 1.00 0.00 H ATOM 67811 H2 WAT 4533 93.996 134.958 71.646 1.00 0.00 H TER 67813 WAT 4533 ATOM 67813 O WAT 4534 14.541 122.092 73.595 1.00 0.00 O ATOM 67814 H1 WAT 4534 15.051 121.671 72.903 1.00 0.00 H ATOM 67815 H2 WAT 4534 15.120 122.084 74.358 1.00 0.00 H TER 67817 WAT 4534 ATOM 67817 O WAT 4535 111.202 29.097 92.090 1.00 0.00 O ATOM 67818 H1 WAT 4535 110.625 28.732 92.761 1.00 0.00 H ATOM 67819 H2 WAT 4535 111.872 28.426 91.959 1.00 0.00 H TER 67821 WAT 4535 ATOM 67821 O WAT 4536 71.851 76.151 17.790 1.00 0.00 O ATOM 67822 H1 WAT 4536 71.698 76.649 18.593 1.00 0.00 H ATOM 67823 H2 WAT 4536 72.693 75.718 17.934 1.00 0.00 H TER 67825 WAT 4536 ATOM 67825 O WAT 4537 27.027 21.052 123.069 1.00 0.00 O ATOM 67826 H1 WAT 4537 26.701 21.082 122.170 1.00 0.00 H ATOM 67827 H2 WAT 4537 26.242 20.929 123.604 1.00 0.00 H TER 67829 WAT 4537 ATOM 67829 O WAT 4538 16.304 115.998 95.167 1.00 0.00 O ATOM 67830 H1 WAT 4538 15.866 116.756 94.780 1.00 0.00 H ATOM 67831 H2 WAT 4538 16.132 116.075 96.106 1.00 0.00 H TER 67833 WAT 4538 ATOM 67833 O WAT 4539 4.685 90.079 22.941 1.00 0.00 O ATOM 67834 H1 WAT 4539 3.969 89.976 23.569 1.00 0.00 H ATOM 67835 H2 WAT 4539 5.261 89.333 23.110 1.00 0.00 H TER 67837 WAT 4539 ATOM 67837 O WAT 4540 84.878 119.454 111.632 1.00 0.00 O ATOM 67838 H1 WAT 4540 84.953 119.135 110.733 1.00 0.00 H ATOM 67839 H2 WAT 4540 85.604 120.071 111.729 1.00 0.00 H TER 67841 WAT 4540 ATOM 67841 O WAT 4541 123.807 50.659 92.069 1.00 0.00 O ATOM 67842 H1 WAT 4541 123.295 51.403 91.752 1.00 0.00 H ATOM 67843 H2 WAT 4541 123.896 50.087 91.307 1.00 0.00 H TER 67845 WAT 4541 ATOM 67845 O WAT 4542 32.239 123.371 149.980 1.00 0.00 O ATOM 67846 H1 WAT 4542 32.366 124.224 149.565 1.00 0.00 H ATOM 67847 H2 WAT 4542 32.306 122.743 149.260 1.00 0.00 H TER 67849 WAT 4542 ATOM 67849 O WAT 4543 91.518 13.174 11.478 1.00 0.00 O ATOM 67850 H1 WAT 4543 91.279 13.184 12.405 1.00 0.00 H ATOM 67851 H2 WAT 4543 91.001 12.461 11.105 1.00 0.00 H TER 67853 WAT 4543 ATOM 67853 O WAT 4544 26.901 6.018 136.284 1.00 0.00 O ATOM 67854 H1 WAT 4544 26.955 5.442 137.047 1.00 0.00 H ATOM 67855 H2 WAT 4544 27.581 5.698 135.692 1.00 0.00 H TER 67857 WAT 4544 ATOM 67857 O WAT 4545 86.844 85.167 128.698 1.00 0.00 O ATOM 67858 H1 WAT 4545 86.776 84.918 129.620 1.00 0.00 H ATOM 67859 H2 WAT 4545 85.940 85.171 128.384 1.00 0.00 H TER 67861 WAT 4545 ATOM 67861 O WAT 4546 115.106 63.684 156.898 1.00 0.00 O ATOM 67862 H1 WAT 4546 115.759 64.040 156.296 1.00 0.00 H ATOM 67863 H2 WAT 4546 115.561 62.978 157.356 1.00 0.00 H TER 67865 WAT 4546 ATOM 67865 O WAT 4547 108.737 125.966 6.878 1.00 0.00 O ATOM 67866 H1 WAT 4547 109.108 125.099 7.046 1.00 0.00 H ATOM 67867 H2 WAT 4547 107.867 125.789 6.521 1.00 0.00 H TER 67869 WAT 4547 ATOM 67869 O WAT 4548 61.662 44.145 7.656 1.00 0.00 O ATOM 67870 H1 WAT 4548 62.100 43.516 8.229 1.00 0.00 H ATOM 67871 H2 WAT 4548 61.724 43.757 6.783 1.00 0.00 H TER 67873 WAT 4548 ATOM 67873 O WAT 4549 128.776 75.739 119.693 1.00 0.00 O ATOM 67874 H1 WAT 4549 129.385 75.549 118.979 1.00 0.00 H ATOM 67875 H2 WAT 4549 129.275 76.296 120.291 1.00 0.00 H TER 67877 WAT 4549 ATOM 67877 O WAT 4550 113.719 118.320 104.245 1.00 0.00 O ATOM 67878 H1 WAT 4550 114.317 119.037 104.458 1.00 0.00 H ATOM 67879 H2 WAT 4550 113.382 118.539 103.376 1.00 0.00 H TER 67881 WAT 4550 ATOM 67881 O WAT 4551 123.964 95.464 126.389 1.00 0.00 O ATOM 67882 H1 WAT 4551 124.062 96.160 125.740 1.00 0.00 H ATOM 67883 H2 WAT 4551 124.745 95.538 126.938 1.00 0.00 H TER 67885 WAT 4551 ATOM 67885 O WAT 4552 119.217 73.202 119.227 1.00 0.00 O ATOM 67886 H1 WAT 4552 120.042 72.743 119.385 1.00 0.00 H ATOM 67887 H2 WAT 4552 119.479 74.043 118.853 1.00 0.00 H TER 67889 WAT 4552 ATOM 67889 O WAT 4553 103.498 20.850 111.130 1.00 0.00 O ATOM 67890 H1 WAT 4553 104.431 20.676 111.001 1.00 0.00 H ATOM 67891 H2 WAT 4553 103.067 20.402 110.403 1.00 0.00 H TER 67893 WAT 4553 ATOM 67893 O WAT 4554 122.319 85.702 154.031 1.00 0.00 O ATOM 67894 H1 WAT 4554 122.417 84.802 154.342 1.00 0.00 H ATOM 67895 H2 WAT 4554 121.647 86.079 154.599 1.00 0.00 H TER 67897 WAT 4554 ATOM 67897 O WAT 4555 103.175 17.529 106.948 1.00 0.00 O ATOM 67898 H1 WAT 4555 103.696 17.680 106.159 1.00 0.00 H ATOM 67899 H2 WAT 4555 103.798 17.621 107.668 1.00 0.00 H TER 67901 WAT 4555 ATOM 67901 O WAT 4556 15.744 132.455 115.894 1.00 0.00 O ATOM 67902 H1 WAT 4556 15.639 132.279 116.829 1.00 0.00 H ATOM 67903 H2 WAT 4556 15.879 133.401 115.842 1.00 0.00 H TER 67905 WAT 4556 ATOM 67905 O WAT 4557 66.183 14.542 148.111 1.00 0.00 O ATOM 67906 H1 WAT 4557 66.421 15.431 148.374 1.00 0.00 H ATOM 67907 H2 WAT 4557 67.019 14.114 147.927 1.00 0.00 H TER 67909 WAT 4557 ATOM 67909 O WAT 4558 1.112 42.327 1.287 1.00 0.00 O ATOM 67910 H1 WAT 4558 0.390 42.790 1.712 1.00 0.00 H ATOM 67911 H2 WAT 4558 1.864 42.481 1.858 1.00 0.00 H TER 67913 WAT 4558 ATOM 67913 O WAT 4559 75.623 15.550 106.563 1.00 0.00 O ATOM 67914 H1 WAT 4559 76.112 16.349 106.759 1.00 0.00 H ATOM 67915 H2 WAT 4559 75.344 15.657 105.653 1.00 0.00 H TER 67917 WAT 4559 ATOM 67917 O WAT 4560 36.659 49.037 65.892 1.00 0.00 O ATOM 67918 H1 WAT 4560 37.049 48.429 65.264 1.00 0.00 H ATOM 67919 H2 WAT 4560 37.286 49.757 65.950 1.00 0.00 H TER 67921 WAT 4560 ATOM 67921 O WAT 4561 0.506 90.555 126.763 1.00 0.00 O ATOM 67922 H1 WAT 4561 -0.150 90.740 126.090 1.00 0.00 H ATOM 67923 H2 WAT 4561 0.384 89.628 126.967 1.00 0.00 H TER 67925 WAT 4561 ATOM 67925 O WAT 4562 13.661 1.437 150.587 1.00 0.00 O ATOM 67926 H1 WAT 4562 14.084 0.686 151.005 1.00 0.00 H ATOM 67927 H2 WAT 4562 13.127 1.827 151.279 1.00 0.00 H TER 67929 WAT 4562 ATOM 67929 O WAT 4563 144.663 105.098 126.976 1.00 0.00 O ATOM 67930 H1 WAT 4563 143.875 105.009 126.439 1.00 0.00 H ATOM 67931 H2 WAT 4563 144.334 105.303 127.851 1.00 0.00 H TER 67933 WAT 4563 ATOM 67933 O WAT 4564 116.271 28.660 8.768 1.00 0.00 O ATOM 67934 H1 WAT 4564 116.306 27.815 9.216 1.00 0.00 H ATOM 67935 H2 WAT 4564 115.943 28.454 7.893 1.00 0.00 H TER 67937 WAT 4564 ATOM 67937 O WAT 4565 102.408 122.557 15.066 1.00 0.00 O ATOM 67938 H1 WAT 4565 102.853 122.340 14.247 1.00 0.00 H ATOM 67939 H2 WAT 4565 102.651 123.467 15.237 1.00 0.00 H TER 67941 WAT 4565 ATOM 67941 O WAT 4566 41.564 66.622 107.140 1.00 0.00 O ATOM 67942 H1 WAT 4566 40.760 66.835 107.615 1.00 0.00 H ATOM 67943 H2 WAT 4566 42.034 67.454 107.081 1.00 0.00 H TER 67945 WAT 4566 ATOM 67945 O WAT 4567 39.591 145.826 66.219 1.00 0.00 O ATOM 67946 H1 WAT 4567 39.188 145.361 65.486 1.00 0.00 H ATOM 67947 H2 WAT 4567 40.288 146.347 65.818 1.00 0.00 H TER 67949 WAT 4567 ATOM 67949 O WAT 4568 95.052 29.751 100.097 1.00 0.00 O ATOM 67950 H1 WAT 4568 94.378 30.292 100.506 1.00 0.00 H ATOM 67951 H2 WAT 4568 95.174 30.136 99.229 1.00 0.00 H TER 67953 WAT 4568 ATOM 67953 O WAT 4569 70.529 111.352 110.206 1.00 0.00 O ATOM 67954 H1 WAT 4569 70.656 110.833 111.001 1.00 0.00 H ATOM 67955 H2 WAT 4569 70.419 110.703 109.511 1.00 0.00 H TER 67957 WAT 4569 ATOM 67957 O WAT 4570 119.956 77.920 131.824 1.00 0.00 O ATOM 67958 H1 WAT 4570 120.085 77.452 130.999 1.00 0.00 H ATOM 67959 H2 WAT 4570 119.131 77.577 132.167 1.00 0.00 H TER 67961 WAT 4570 ATOM 67961 O WAT 4571 38.320 1.250 18.746 1.00 0.00 O ATOM 67962 H1 WAT 4571 37.641 0.743 18.300 1.00 0.00 H ATOM 67963 H2 WAT 4571 38.637 0.668 19.437 1.00 0.00 H TER 67965 WAT 4571 ATOM 67965 O WAT 4572 117.977 139.863 156.564 1.00 0.00 O ATOM 67966 H1 WAT 4572 118.539 140.378 157.143 1.00 0.00 H ATOM 67967 H2 WAT 4572 118.509 139.103 156.329 1.00 0.00 H TER 67969 WAT 4572 ATOM 67969 O WAT 4573 129.158 133.043 154.284 1.00 0.00 O ATOM 67970 H1 WAT 4573 129.377 133.435 155.129 1.00 0.00 H ATOM 67971 H2 WAT 4573 129.490 132.147 154.341 1.00 0.00 H TER 67973 WAT 4573 ATOM 67973 O WAT 4574 138.129 71.918 63.674 1.00 0.00 O ATOM 67974 H1 WAT 4574 139.020 71.617 63.494 1.00 0.00 H ATOM 67975 H2 WAT 4574 138.067 71.924 64.629 1.00 0.00 H TER 67977 WAT 4574 ATOM 67977 O WAT 4575 102.655 33.924 64.542 1.00 0.00 O ATOM 67978 H1 WAT 4575 102.978 34.714 64.975 1.00 0.00 H ATOM 67979 H2 WAT 4575 101.866 33.689 65.030 1.00 0.00 H TER 67981 WAT 4575 ATOM 67981 O WAT 4576 1.988 99.581 113.859 1.00 0.00 O ATOM 67982 H1 WAT 4576 1.034 99.543 113.924 1.00 0.00 H ATOM 67983 H2 WAT 4576 2.227 100.395 114.301 1.00 0.00 H TER 67985 WAT 4576 ATOM 67985 O WAT 4577 15.177 119.773 112.490 1.00 0.00 O ATOM 67986 H1 WAT 4577 14.797 120.364 113.140 1.00 0.00 H ATOM 67987 H2 WAT 4577 14.992 118.897 112.826 1.00 0.00 H TER 67989 WAT 4577 ATOM 67989 O WAT 4578 64.742 50.586 92.089 1.00 0.00 O ATOM 67990 H1 WAT 4578 65.549 50.190 92.417 1.00 0.00 H ATOM 67991 H2 WAT 4578 64.072 49.917 92.230 1.00 0.00 H TER 67993 WAT 4578 ATOM 67993 O WAT 4579 30.223 35.235 129.013 1.00 0.00 O ATOM 67994 H1 WAT 4579 30.781 35.966 128.746 1.00 0.00 H ATOM 67995 H2 WAT 4579 30.822 34.618 129.435 1.00 0.00 H TER 67997 WAT 4579 ATOM 67997 O WAT 4580 16.060 98.333 153.640 1.00 0.00 O ATOM 67998 H1 WAT 4580 15.438 98.909 154.084 1.00 0.00 H ATOM 67999 H2 WAT 4580 15.967 97.491 154.086 1.00 0.00 H TER 68001 WAT 4580 ATOM 68001 O WAT 4581 6.973 36.407 19.877 1.00 0.00 O ATOM 68002 H1 WAT 4581 6.162 35.899 19.885 1.00 0.00 H ATOM 68003 H2 WAT 4581 6.916 36.937 19.082 1.00 0.00 H TER 68005 WAT 4581 ATOM 68005 O WAT 4582 17.005 113.065 62.580 1.00 0.00 O ATOM 68006 H1 WAT 4582 16.540 113.323 61.784 1.00 0.00 H ATOM 68007 H2 WAT 4582 16.767 112.146 62.708 1.00 0.00 H TER 68009 WAT 4582 ATOM 68009 O WAT 4583 25.636 66.914 53.865 1.00 0.00 O ATOM 68010 H1 WAT 4583 25.517 66.949 54.814 1.00 0.00 H ATOM 68011 H2 WAT 4583 26.238 66.182 53.726 1.00 0.00 H TER 68013 WAT 4583 ATOM 68013 O WAT 4584 79.927 89.917 140.585 1.00 0.00 O ATOM 68014 H1 WAT 4584 80.278 90.581 139.991 1.00 0.00 H ATOM 68015 H2 WAT 4584 80.475 89.147 140.435 1.00 0.00 H TER 68017 WAT 4584 ATOM 68017 O WAT 4585 63.407 31.510 16.355 1.00 0.00 O ATOM 68018 H1 WAT 4585 62.828 31.252 17.072 1.00 0.00 H ATOM 68019 H2 WAT 4585 63.894 30.713 16.143 1.00 0.00 H TER 68021 WAT 4585 ATOM 68021 O WAT 4586 123.399 23.408 157.768 1.00 0.00 O ATOM 68022 H1 WAT 4586 122.742 24.054 158.026 1.00 0.00 H ATOM 68023 H2 WAT 4586 123.248 22.666 158.353 1.00 0.00 H TER 68025 WAT 4586 ATOM 68025 O WAT 4587 27.307 54.989 105.271 1.00 0.00 O ATOM 68026 H1 WAT 4587 26.840 55.158 104.453 1.00 0.00 H ATOM 68027 H2 WAT 4587 27.084 55.732 105.832 1.00 0.00 H TER 68029 WAT 4587 ATOM 68029 O WAT 4588 27.144 23.989 123.148 1.00 0.00 O ATOM 68030 H1 WAT 4588 26.951 23.281 123.763 1.00 0.00 H ATOM 68031 H2 WAT 4588 27.257 24.762 123.701 1.00 0.00 H TER 68033 WAT 4588 ATOM 68033 O WAT 4589 121.465 88.032 97.240 1.00 0.00 O ATOM 68034 H1 WAT 4589 121.582 87.165 97.627 1.00 0.00 H ATOM 68035 H2 WAT 4589 122.342 88.415 97.239 1.00 0.00 H TER 68037 WAT 4589 ATOM 68037 O WAT 4590 42.670 21.546 156.210 1.00 0.00 O ATOM 68038 H1 WAT 4590 42.385 20.635 156.142 1.00 0.00 H ATOM 68039 H2 WAT 4590 42.381 21.824 157.079 1.00 0.00 H TER 68041 WAT 4590 ATOM 68041 O WAT 4591 52.850 18.886 98.231 1.00 0.00 O ATOM 68042 H1 WAT 4591 53.076 18.631 97.336 1.00 0.00 H ATOM 68043 H2 WAT 4591 52.012 18.455 98.398 1.00 0.00 H TER 68045 WAT 4591 ATOM 68045 O WAT 4592 117.746 100.835 2.994 1.00 0.00 O ATOM 68046 H1 WAT 4592 117.669 101.653 3.486 1.00 0.00 H ATOM 68047 H2 WAT 4592 118.249 100.257 3.567 1.00 0.00 H TER 68049 WAT 4592 ATOM 68049 O WAT 4593 75.422 126.150 129.459 1.00 0.00 O ATOM 68050 H1 WAT 4593 74.862 126.924 129.393 1.00 0.00 H ATOM 68051 H2 WAT 4593 75.067 125.541 128.812 1.00 0.00 H TER 68053 WAT 4593 ATOM 68053 O WAT 4594 87.217 20.423 137.963 1.00 0.00 O ATOM 68054 H1 WAT 4594 86.843 21.125 137.430 1.00 0.00 H ATOM 68055 H2 WAT 4594 87.039 19.624 137.466 1.00 0.00 H TER 68057 WAT 4594 ATOM 68057 O WAT 4595 140.032 27.677 105.840 1.00 0.00 O ATOM 68058 H1 WAT 4595 139.571 28.090 106.570 1.00 0.00 H ATOM 68059 H2 WAT 4595 140.343 28.410 105.308 1.00 0.00 H TER 68061 WAT 4595 ATOM 68061 O WAT 4596 143.134 119.003 158.171 1.00 0.00 O ATOM 68062 H1 WAT 4596 143.700 119.444 157.537 1.00 0.00 H ATOM 68063 H2 WAT 4596 142.482 119.661 158.409 1.00 0.00 H TER 68065 WAT 4596 ATOM 68065 O WAT 4597 136.296 13.139 98.742 1.00 0.00 O ATOM 68066 H1 WAT 4597 136.182 14.058 98.500 1.00 0.00 H ATOM 68067 H2 WAT 4597 135.953 13.082 99.634 1.00 0.00 H TER 68069 WAT 4597 ATOM 68069 O WAT 4598 57.503 35.166 65.222 1.00 0.00 O ATOM 68070 H1 WAT 4598 57.274 34.349 64.779 1.00 0.00 H ATOM 68071 H2 WAT 4598 58.262 35.495 64.741 1.00 0.00 H TER 68073 WAT 4598 ATOM 68073 O WAT 4599 98.382 26.309 109.624 1.00 0.00 O ATOM 68074 H1 WAT 4599 99.305 26.097 109.762 1.00 0.00 H ATOM 68075 H2 WAT 4599 98.052 25.596 109.077 1.00 0.00 H TER 68077 WAT 4599 ATOM 68077 O WAT 4600 128.556 122.919 141.743 1.00 0.00 O ATOM 68078 H1 WAT 4600 128.767 123.172 140.845 1.00 0.00 H ATOM 68079 H2 WAT 4600 127.605 123.010 141.800 1.00 0.00 H TER 68081 WAT 4600 ATOM 68081 O WAT 4601 104.058 38.865 93.936 1.00 0.00 O ATOM 68082 H1 WAT 4601 104.752 38.594 93.336 1.00 0.00 H ATOM 68083 H2 WAT 4601 103.271 38.898 93.392 1.00 0.00 H TER 68085 WAT 4601 ATOM 68085 O WAT 4602 53.721 62.390 130.014 1.00 0.00 O ATOM 68086 H1 WAT 4602 54.361 61.684 130.102 1.00 0.00 H ATOM 68087 H2 WAT 4602 53.791 62.881 130.833 1.00 0.00 H TER 68089 WAT 4602 ATOM 68089 O WAT 4603 41.020 98.094 141.293 1.00 0.00 O ATOM 68090 H1 WAT 4603 40.933 97.862 142.217 1.00 0.00 H ATOM 68091 H2 WAT 4603 41.355 98.990 141.301 1.00 0.00 H TER 68093 WAT 4603 ATOM 68093 O WAT 4604 99.347 107.062 84.939 1.00 0.00 O ATOM 68094 H1 WAT 4604 100.145 106.611 85.213 1.00 0.00 H ATOM 68095 H2 WAT 4604 98.656 106.673 85.475 1.00 0.00 H TER 68097 WAT 4604 ATOM 68097 O WAT 4605 130.383 89.804 119.379 1.00 0.00 O ATOM 68098 H1 WAT 4605 130.397 89.187 118.648 1.00 0.00 H ATOM 68099 H2 WAT 4605 129.453 89.961 119.542 1.00 0.00 H TER 68101 WAT 4605 ATOM 68101 O WAT 4606 131.063 89.304 30.755 1.00 0.00 O ATOM 68102 H1 WAT 4606 131.047 88.397 31.062 1.00 0.00 H ATOM 68103 H2 WAT 4606 131.943 89.614 30.971 1.00 0.00 H TER 68105 WAT 4606 ATOM 68105 O WAT 4607 72.777 115.500 3.101 1.00 0.00 O ATOM 68106 H1 WAT 4607 73.654 115.399 3.471 1.00 0.00 H ATOM 68107 H2 WAT 4607 72.580 114.647 2.715 1.00 0.00 H TER 68109 WAT 4607 ATOM 68109 O WAT 4608 12.753 29.278 79.601 1.00 0.00 O ATOM 68110 H1 WAT 4608 12.135 29.941 79.293 1.00 0.00 H ATOM 68111 H2 WAT 4608 13.133 29.656 80.394 1.00 0.00 H TER 68113 WAT 4608 ATOM 68113 O WAT 4609 95.423 96.952 119.989 1.00 0.00 O ATOM 68114 H1 WAT 4609 94.706 96.676 119.417 1.00 0.00 H ATOM 68115 H2 WAT 4609 95.359 96.374 120.749 1.00 0.00 H TER 68117 WAT 4609 ATOM 68117 O WAT 4610 54.546 138.691 8.394 1.00 0.00 O ATOM 68118 H1 WAT 4610 54.665 137.811 8.037 1.00 0.00 H ATOM 68119 H2 WAT 4610 55.436 139.013 8.538 1.00 0.00 H TER 68121 WAT 4610 ATOM 68121 O WAT 4611 129.322 130.032 147.092 1.00 0.00 O ATOM 68122 H1 WAT 4611 129.109 129.334 147.711 1.00 0.00 H ATOM 68123 H2 WAT 4611 130.054 130.496 147.497 1.00 0.00 H TER 68125 WAT 4611 ATOM 68125 O WAT 4612 74.260 83.719 98.539 1.00 0.00 O ATOM 68126 H1 WAT 4612 74.058 83.726 99.475 1.00 0.00 H ATOM 68127 H2 WAT 4612 73.409 83.624 98.111 1.00 0.00 H TER 68129 WAT 4612 ATOM 68129 O WAT 4613 44.426 145.233 81.270 1.00 0.00 O ATOM 68130 H1 WAT 4613 43.670 145.756 81.537 1.00 0.00 H ATOM 68131 H2 WAT 4613 44.519 145.407 80.333 1.00 0.00 H TER 68133 WAT 4613 ATOM 68133 O WAT 4614 57.502 69.922 19.057 1.00 0.00 O ATOM 68134 H1 WAT 4614 57.743 69.159 19.582 1.00 0.00 H ATOM 68135 H2 WAT 4614 57.429 69.585 18.164 1.00 0.00 H TER 68137 WAT 4614 ATOM 68137 O WAT 4615 70.683 124.264 150.874 1.00 0.00 O ATOM 68138 H1 WAT 4615 70.067 124.216 151.604 1.00 0.00 H ATOM 68139 H2 WAT 4615 70.738 125.197 150.667 1.00 0.00 H TER 68141 WAT 4615 ATOM 68141 O WAT 4616 53.670 114.292 60.385 1.00 0.00 O ATOM 68142 H1 WAT 4616 54.376 114.654 59.851 1.00 0.00 H ATOM 68143 H2 WAT 4616 53.971 114.402 61.287 1.00 0.00 H TER 68145 WAT 4616 ATOM 68145 O WAT 4617 60.577 36.170 19.181 1.00 0.00 O ATOM 68146 H1 WAT 4617 61.457 35.980 19.508 1.00 0.00 H ATOM 68147 H2 WAT 4617 60.616 37.085 18.905 1.00 0.00 H TER 68149 WAT 4617 ATOM 68149 O WAT 4618 134.499 7.621 81.204 1.00 0.00 O ATOM 68150 H1 WAT 4618 135.299 8.148 81.183 1.00 0.00 H ATOM 68151 H2 WAT 4618 134.115 7.735 80.335 1.00 0.00 H TER 68153 WAT 4618 ATOM 68153 O WAT 4619 70.333 111.213 141.704 1.00 0.00 O ATOM 68154 H1 WAT 4619 70.157 110.784 142.542 1.00 0.00 H ATOM 68155 H2 WAT 4619 69.513 111.655 141.484 1.00 0.00 H TER 68157 WAT 4619 ATOM 68157 O WAT 4620 119.822 16.811 79.860 1.00 0.00 O ATOM 68158 H1 WAT 4620 119.842 16.844 78.904 1.00 0.00 H ATOM 68159 H2 WAT 4620 120.221 15.969 80.079 1.00 0.00 H TER 68161 WAT 4620 ATOM 68161 O WAT 4621 104.746 19.786 91.488 1.00 0.00 O ATOM 68162 H1 WAT 4621 104.106 19.077 91.429 1.00 0.00 H ATOM 68163 H2 WAT 4621 105.379 19.484 92.139 1.00 0.00 H TER 68165 WAT 4621 ATOM 68165 O WAT 4622 5.780 100.393 110.979 1.00 0.00 O ATOM 68166 H1 WAT 4622 6.242 100.753 111.736 1.00 0.00 H ATOM 68167 H2 WAT 4622 5.777 101.106 110.340 1.00 0.00 H TER 68169 WAT 4622 ATOM 68169 O WAT 4623 136.326 140.624 112.388 1.00 0.00 O ATOM 68170 H1 WAT 4623 136.949 140.715 113.108 1.00 0.00 H ATOM 68171 H2 WAT 4623 136.132 141.523 112.122 1.00 0.00 H TER 68173 WAT 4623 ATOM 68173 O WAT 4624 7.161 143.094 133.137 1.00 0.00 O ATOM 68174 H1 WAT 4624 7.365 142.846 132.235 1.00 0.00 H ATOM 68175 H2 WAT 4624 6.989 144.034 133.095 1.00 0.00 H TER 68177 WAT 4624 ATOM 68177 O WAT 4625 80.387 93.324 152.329 1.00 0.00 O ATOM 68178 H1 WAT 4625 80.651 92.475 151.975 1.00 0.00 H ATOM 68179 H2 WAT 4625 79.841 93.709 151.645 1.00 0.00 H TER 68181 WAT 4625 ATOM 68181 O WAT 4626 60.190 28.793 144.962 1.00 0.00 O ATOM 68182 H1 WAT 4626 59.994 27.929 145.325 1.00 0.00 H ATOM 68183 H2 WAT 4626 59.342 29.237 144.931 1.00 0.00 H TER 68185 WAT 4626 ATOM 68185 O WAT 4627 5.629 66.167 123.888 1.00 0.00 O ATOM 68186 H1 WAT 4627 6.455 65.713 123.720 1.00 0.00 H ATOM 68187 H2 WAT 4627 5.772 66.622 124.719 1.00 0.00 H TER 68189 WAT 4627 ATOM 68189 O WAT 4628 16.221 84.777 9.074 1.00 0.00 O ATOM 68190 H1 WAT 4628 17.083 84.369 8.993 1.00 0.00 H ATOM 68191 H2 WAT 4628 16.174 85.056 9.989 1.00 0.00 H TER 68193 WAT 4628 ATOM 68193 O WAT 4629 107.487 48.679 5.167 1.00 0.00 O ATOM 68194 H1 WAT 4629 107.309 49.509 4.725 1.00 0.00 H ATOM 68195 H2 WAT 4629 107.920 48.142 4.503 1.00 0.00 H TER 68197 WAT 4629 ATOM 68197 O WAT 4630 118.888 60.560 14.791 1.00 0.00 O ATOM 68198 H1 WAT 4630 117.990 60.780 14.544 1.00 0.00 H ATOM 68199 H2 WAT 4630 118.793 59.899 15.477 1.00 0.00 H TER 68201 WAT 4630 ATOM 68201 O WAT 4631 91.874 45.396 119.313 1.00 0.00 O ATOM 68202 H1 WAT 4631 92.676 45.632 118.847 1.00 0.00 H ATOM 68203 H2 WAT 4631 92.169 45.161 120.193 1.00 0.00 H TER 68205 WAT 4631 ATOM 68205 O WAT 4632 43.805 23.463 76.883 1.00 0.00 O ATOM 68206 H1 WAT 4632 43.433 23.950 77.619 1.00 0.00 H ATOM 68207 H2 WAT 4632 43.370 22.611 76.916 1.00 0.00 H TER 68209 WAT 4632 ATOM 68209 O WAT 4633 49.129 94.014 20.716 1.00 0.00 O ATOM 68210 H1 WAT 4633 48.702 93.266 20.299 1.00 0.00 H ATOM 68211 H2 WAT 4633 49.640 93.631 21.429 1.00 0.00 H TER 68213 WAT 4633 ATOM 68213 O WAT 4634 63.157 72.001 98.727 1.00 0.00 O ATOM 68214 H1 WAT 4634 63.528 72.862 98.920 1.00 0.00 H ATOM 68215 H2 WAT 4634 63.851 71.543 98.252 1.00 0.00 H TER 68217 WAT 4634 ATOM 68217 O WAT 4635 12.692 64.645 65.002 1.00 0.00 O ATOM 68218 H1 WAT 4635 12.606 64.223 64.147 1.00 0.00 H ATOM 68219 H2 WAT 4635 11.848 64.496 65.429 1.00 0.00 H TER 68221 WAT 4635 ATOM 68221 O WAT 4636 100.033 17.716 148.625 1.00 0.00 O ATOM 68222 H1 WAT 4636 100.843 17.322 148.948 1.00 0.00 H ATOM 68223 H2 WAT 4636 99.339 17.270 149.111 1.00 0.00 H TER 68225 WAT 4636 ATOM 68225 O WAT 4637 92.094 39.712 113.325 1.00 0.00 O ATOM 68226 H1 WAT 4637 92.035 40.422 112.685 1.00 0.00 H ATOM 68227 H2 WAT 4637 91.605 38.991 112.929 1.00 0.00 H TER 68229 WAT 4637 ATOM 68229 O WAT 4638 111.376 75.516 147.509 1.00 0.00 O ATOM 68230 H1 WAT 4638 110.783 76.060 148.027 1.00 0.00 H ATOM 68231 H2 WAT 4638 110.805 75.058 146.893 1.00 0.00 H TER 68233 WAT 4638 ATOM 68233 O WAT 4639 89.776 15.590 90.221 1.00 0.00 O ATOM 68234 H1 WAT 4639 90.203 15.238 89.439 1.00 0.00 H ATOM 68235 H2 WAT 4639 89.076 16.147 89.881 1.00 0.00 H TER 68237 WAT 4639 ATOM 68237 O WAT 4640 102.351 12.959 111.315 1.00 0.00 O ATOM 68238 H1 WAT 4640 101.520 13.196 111.728 1.00 0.00 H ATOM 68239 H2 WAT 4640 102.848 12.525 112.008 1.00 0.00 H TER 68241 WAT 4640 ATOM 68241 O WAT 4641 6.208 20.916 131.195 1.00 0.00 O ATOM 68242 H1 WAT 4641 5.307 20.925 130.874 1.00 0.00 H ATOM 68243 H2 WAT 4641 6.195 20.300 131.928 1.00 0.00 H TER 68245 WAT 4641 ATOM 68245 O WAT 4642 92.099 135.696 20.644 1.00 0.00 O ATOM 68246 H1 WAT 4642 91.656 136.536 20.522 1.00 0.00 H ATOM 68247 H2 WAT 4642 91.425 135.119 21.001 1.00 0.00 H TER 68249 WAT 4642 ATOM 68249 O WAT 4643 63.900 14.035 108.716 1.00 0.00 O ATOM 68250 H1 WAT 4643 63.674 13.953 109.642 1.00 0.00 H ATOM 68251 H2 WAT 4643 63.226 14.611 108.355 1.00 0.00 H TER 68253 WAT 4643 ATOM 68253 O WAT 4644 56.124 65.285 70.803 1.00 0.00 O ATOM 68254 H1 WAT 4644 56.145 64.353 70.588 1.00 0.00 H ATOM 68255 H2 WAT 4644 55.725 65.698 70.037 1.00 0.00 H TER 68257 WAT 4644 ATOM 68257 O WAT 4645 68.625 2.067 72.857 1.00 0.00 O ATOM 68258 H1 WAT 4645 68.879 2.838 73.364 1.00 0.00 H ATOM 68259 H2 WAT 4645 68.373 1.419 73.515 1.00 0.00 H TER 68261 WAT 4645 ATOM 68261 O WAT 4646 1.705 -0.109 140.649 1.00 0.00 O ATOM 68262 H1 WAT 4646 2.342 -0.438 141.283 1.00 0.00 H ATOM 68263 H2 WAT 4646 2.102 0.692 140.306 1.00 0.00 H TER 68265 WAT 4646 ATOM 68265 O WAT 4647 17.821 74.624 117.047 1.00 0.00 O ATOM 68266 H1 WAT 4647 17.943 73.710 117.302 1.00 0.00 H ATOM 68267 H2 WAT 4647 17.142 74.596 116.373 1.00 0.00 H TER 68269 WAT 4647 ATOM 68269 O WAT 4648 91.490 72.808 7.102 1.00 0.00 O ATOM 68270 H1 WAT 4648 90.690 72.441 7.477 1.00 0.00 H ATOM 68271 H2 WAT 4648 91.926 73.234 7.840 1.00 0.00 H TER 68273 WAT 4648 ATOM 68273 O WAT 4649 7.224 34.348 136.629 1.00 0.00 O ATOM 68274 H1 WAT 4649 7.645 33.502 136.780 1.00 0.00 H ATOM 68275 H2 WAT 4649 6.913 34.303 135.724 1.00 0.00 H TER 68277 WAT 4649 ATOM 68277 O WAT 4650 53.596 136.385 66.917 1.00 0.00 O ATOM 68278 H1 WAT 4650 53.966 135.635 66.452 1.00 0.00 H ATOM 68279 H2 WAT 4650 52.686 136.138 67.085 1.00 0.00 H TER 68281 WAT 4650 ATOM 68281 O WAT 4651 0.749 72.194 102.826 1.00 0.00 O ATOM 68282 H1 WAT 4651 1.215 72.860 102.321 1.00 0.00 H ATOM 68283 H2 WAT 4651 0.221 72.691 103.450 1.00 0.00 H TER 68285 WAT 4651 ATOM 68285 O WAT 4652 107.311 30.528 23.632 1.00 0.00 O ATOM 68286 H1 WAT 4652 106.880 29.700 23.845 1.00 0.00 H ATOM 68287 H2 WAT 4652 106.823 30.866 22.881 1.00 0.00 H TER 68289 WAT 4652 ATOM 68289 O WAT 4653 140.305 87.195 13.445 1.00 0.00 O ATOM 68290 H1 WAT 4653 139.619 87.063 14.099 1.00 0.00 H ATOM 68291 H2 WAT 4653 140.421 86.334 13.043 1.00 0.00 H TER 68293 WAT 4653 ATOM 68293 O WAT 4654 87.327 116.555 157.244 1.00 0.00 O ATOM 68294 H1 WAT 4654 86.498 117.033 157.211 1.00 0.00 H ATOM 68295 H2 WAT 4654 87.149 115.736 156.781 1.00 0.00 H TER 68297 WAT 4654 ATOM 68297 O WAT 4655 72.255 4.701 150.027 1.00 0.00 O ATOM 68298 H1 WAT 4655 71.837 3.904 150.353 1.00 0.00 H ATOM 68299 H2 WAT 4655 72.927 4.389 149.422 1.00 0.00 H TER 68301 WAT 4655 ATOM 68301 O WAT 4656 104.985 107.561 4.653 1.00 0.00 O ATOM 68302 H1 WAT 4656 104.578 106.792 4.255 1.00 0.00 H ATOM 68303 H2 WAT 4656 104.307 108.236 4.619 1.00 0.00 H TER 68305 WAT 4656 ATOM 68305 O WAT 4657 62.317 128.823 124.239 1.00 0.00 O ATOM 68306 H1 WAT 4657 61.512 128.487 123.845 1.00 0.00 H ATOM 68307 H2 WAT 4657 62.622 128.114 124.804 1.00 0.00 H TER 68309 WAT 4657 ATOM 68309 O WAT 4658 113.901 15.652 139.757 1.00 0.00 O ATOM 68310 H1 WAT 4658 114.449 15.037 139.269 1.00 0.00 H ATOM 68311 H2 WAT 4658 113.769 16.385 139.156 1.00 0.00 H TER 68313 WAT 4658 ATOM 68313 O WAT 4659 123.244 108.200 92.428 1.00 0.00 O ATOM 68314 H1 WAT 4659 122.469 108.090 91.875 1.00 0.00 H ATOM 68315 H2 WAT 4659 123.445 109.134 92.375 1.00 0.00 H TER 68317 WAT 4659 ATOM 68317 O WAT 4660 131.281 2.274 135.676 1.00 0.00 O ATOM 68318 H1 WAT 4660 130.773 2.180 134.870 1.00 0.00 H ATOM 68319 H2 WAT 4660 130.816 1.737 136.316 1.00 0.00 H TER 68321 WAT 4660 ATOM 68321 O WAT 4661 90.901 117.199 103.916 1.00 0.00 O ATOM 68322 H1 WAT 4661 90.932 116.294 104.226 1.00 0.00 H ATOM 68323 H2 WAT 4661 89.989 117.332 103.655 1.00 0.00 H TER 68325 WAT 4661 ATOM 68325 O WAT 4662 102.906 76.769 132.805 1.00 0.00 O ATOM 68326 H1 WAT 4662 103.681 76.521 132.300 1.00 0.00 H ATOM 68327 H2 WAT 4662 102.326 76.011 132.742 1.00 0.00 H TER 68329 WAT 4662 ATOM 68329 O WAT 4663 25.130 35.319 4.219 1.00 0.00 O ATOM 68330 H1 WAT 4663 25.331 36.107 4.723 1.00 0.00 H ATOM 68331 H2 WAT 4663 24.191 35.184 4.350 1.00 0.00 H TER 68333 WAT 4663 ATOM 68333 O WAT 4664 117.163 50.456 19.638 1.00 0.00 O ATOM 68334 H1 WAT 4664 117.736 49.733 19.893 1.00 0.00 H ATOM 68335 H2 WAT 4664 117.322 50.569 18.701 1.00 0.00 H TER 68337 WAT 4664 ATOM 68337 O WAT 4665 23.401 62.425 153.011 1.00 0.00 O ATOM 68338 H1 WAT 4665 23.310 61.977 153.852 1.00 0.00 H ATOM 68339 H2 WAT 4665 22.694 62.069 152.473 1.00 0.00 H TER 68341 WAT 4665 ATOM 68341 O WAT 4666 54.218 39.270 153.407 1.00 0.00 O ATOM 68342 H1 WAT 4666 53.325 39.612 153.445 1.00 0.00 H ATOM 68343 H2 WAT 4666 54.775 40.048 153.449 1.00 0.00 H TER 68345 WAT 4666 ATOM 68345 O WAT 4667 100.729 76.896 155.908 1.00 0.00 O ATOM 68346 H1 WAT 4667 100.559 77.810 155.678 1.00 0.00 H ATOM 68347 H2 WAT 4667 100.404 76.811 156.805 1.00 0.00 H TER 68349 WAT 4667 ATOM 68349 O WAT 4668 60.672 123.176 85.810 1.00 0.00 O ATOM 68350 H1 WAT 4668 61.249 122.745 85.180 1.00 0.00 H ATOM 68351 H2 WAT 4668 59.826 122.743 85.696 1.00 0.00 H TER 68353 WAT 4668 ATOM 68353 O WAT 4669 39.926 93.194 14.327 1.00 0.00 O ATOM 68354 H1 WAT 4669 39.865 92.250 14.475 1.00 0.00 H ATOM 68355 H2 WAT 4669 39.498 93.584 15.089 1.00 0.00 H TER 68357 WAT 4669 ATOM 68357 O WAT 4670 86.683 33.314 118.464 1.00 0.00 O ATOM 68358 H1 WAT 4670 86.376 33.870 119.181 1.00 0.00 H ATOM 68359 H2 WAT 4670 86.265 32.468 118.621 1.00 0.00 H TER 68361 WAT 4670 ATOM 68361 O WAT 4671 92.971 70.922 145.654 1.00 0.00 O ATOM 68362 H1 WAT 4671 92.440 71.198 144.907 1.00 0.00 H ATOM 68363 H2 WAT 4671 93.299 71.740 146.029 1.00 0.00 H TER 68365 WAT 4671 ATOM 68365 O WAT 4672 130.068 15.006 53.744 1.00 0.00 O ATOM 68366 H1 WAT 4672 131.024 15.030 53.727 1.00 0.00 H ATOM 68367 H2 WAT 4672 129.831 15.468 54.548 1.00 0.00 H TER 68369 WAT 4672 ATOM 68369 O WAT 4673 77.716 105.863 5.205 1.00 0.00 O ATOM 68370 H1 WAT 4673 77.610 105.196 5.883 1.00 0.00 H ATOM 68371 H2 WAT 4673 77.577 106.693 5.662 1.00 0.00 H TER 68373 WAT 4673 ATOM 68373 O WAT 4674 128.236 81.909 87.597 1.00 0.00 O ATOM 68374 H1 WAT 4674 128.138 82.628 86.973 1.00 0.00 H ATOM 68375 H2 WAT 4674 129.175 81.877 87.781 1.00 0.00 H TER 68377 WAT 4674 ATOM 68377 O WAT 4675 125.195 67.876 4.341 1.00 0.00 O ATOM 68378 H1 WAT 4675 124.515 67.461 3.810 1.00 0.00 H ATOM 68379 H2 WAT 4675 125.592 68.523 3.758 1.00 0.00 H TER 68381 WAT 4675 ATOM 68381 O WAT 4676 22.843 121.523 115.233 1.00 0.00 O ATOM 68382 H1 WAT 4676 22.285 120.868 114.814 1.00 0.00 H ATOM 68383 H2 WAT 4676 23.526 121.704 114.586 1.00 0.00 H TER 68385 WAT 4676 ATOM 68385 O WAT 4677 52.276 2.740 156.228 1.00 0.00 O ATOM 68386 H1 WAT 4677 52.036 1.921 155.795 1.00 0.00 H ATOM 68387 H2 WAT 4677 52.277 2.526 157.161 1.00 0.00 H TER 68389 WAT 4677 ATOM 68389 O WAT 4678 70.811 84.894 142.614 1.00 0.00 O ATOM 68390 H1 WAT 4678 71.293 85.058 143.425 1.00 0.00 H ATOM 68391 H2 WAT 4678 70.150 85.586 142.585 1.00 0.00 H TER 68393 WAT 4678 ATOM 68393 O WAT 4679 65.763 91.033 69.600 1.00 0.00 O ATOM 68394 H1 WAT 4679 66.113 90.408 68.965 1.00 0.00 H ATOM 68395 H2 WAT 4679 66.530 91.327 70.092 1.00 0.00 H TER 68397 WAT 4679 ATOM 68397 O WAT 4680 41.109 135.696 94.024 1.00 0.00 O ATOM 68398 H1 WAT 4680 41.826 135.769 93.395 1.00 0.00 H ATOM 68399 H2 WAT 4680 40.603 134.941 93.723 1.00 0.00 H TER 68401 WAT 4680 ATOM 68401 O WAT 4681 80.689 87.845 99.998 1.00 0.00 O ATOM 68402 H1 WAT 4681 80.389 87.040 99.578 1.00 0.00 H ATOM 68403 H2 WAT 4681 81.623 87.701 100.153 1.00 0.00 H TER 68405 WAT 4681 ATOM 68405 O WAT 4682 48.390 22.401 147.936 1.00 0.00 O ATOM 68406 H1 WAT 4682 48.898 22.399 147.125 1.00 0.00 H ATOM 68407 H2 WAT 4682 49.046 22.472 148.629 1.00 0.00 H TER 68409 WAT 4682 ATOM 68409 O WAT 4683 57.461 65.077 80.279 1.00 0.00 O ATOM 68410 H1 WAT 4683 57.965 64.318 80.572 1.00 0.00 H ATOM 68411 H2 WAT 4683 57.327 64.928 79.343 1.00 0.00 H TER 68413 WAT 4683 ATOM 68413 O WAT 4684 144.996 93.096 7.655 1.00 0.00 O ATOM 68414 H1 WAT 4684 144.355 93.601 8.155 1.00 0.00 H ATOM 68415 H2 WAT 4684 145.779 93.646 7.644 1.00 0.00 H TER 68417 WAT 4684 ATOM 68417 O WAT 4685 14.231 104.195 11.511 1.00 0.00 O ATOM 68418 H1 WAT 4685 14.047 103.422 10.978 1.00 0.00 H ATOM 68419 H2 WAT 4685 13.447 104.737 11.427 1.00 0.00 H TER 68421 WAT 4685 ATOM 68421 O WAT 4686 82.881 100.704 85.496 1.00 0.00 O ATOM 68422 H1 WAT 4686 83.777 100.395 85.628 1.00 0.00 H ATOM 68423 H2 WAT 4686 82.982 101.574 85.109 1.00 0.00 H TER 68425 WAT 4686 ATOM 68425 O WAT 4687 46.133 85.488 70.904 1.00 0.00 O ATOM 68426 H1 WAT 4687 46.720 84.859 71.324 1.00 0.00 H ATOM 68427 H2 WAT 4687 46.712 86.185 70.593 1.00 0.00 H TER 68429 WAT 4687 ATOM 68429 O WAT 4688 54.593 141.781 96.699 1.00 0.00 O ATOM 68430 H1 WAT 4688 54.151 142.623 96.592 1.00 0.00 H ATOM 68431 H2 WAT 4688 54.670 141.670 97.647 1.00 0.00 H TER 68433 WAT 4688 ATOM 68433 O WAT 4689 47.112 54.919 59.343 1.00 0.00 O ATOM 68434 H1 WAT 4689 47.506 55.753 59.087 1.00 0.00 H ATOM 68435 H2 WAT 4689 47.501 54.278 58.748 1.00 0.00 H TER 68437 WAT 4689 ATOM 68437 O WAT 4690 144.073 77.441 132.297 1.00 0.00 O ATOM 68438 H1 WAT 4690 143.469 76.707 132.410 1.00 0.00 H ATOM 68439 H2 WAT 4690 144.643 77.172 131.577 1.00 0.00 H TER 68441 WAT 4690 ATOM 68441 O WAT 4691 59.188 92.209 146.328 1.00 0.00 O ATOM 68442 H1 WAT 4691 59.292 92.974 145.763 1.00 0.00 H ATOM 68443 H2 WAT 4691 58.665 92.525 147.065 1.00 0.00 H TER 68445 WAT 4691 ATOM 68445 O WAT 4692 69.873 67.442 94.119 1.00 0.00 O ATOM 68446 H1 WAT 4692 69.899 67.782 93.225 1.00 0.00 H ATOM 68447 H2 WAT 4692 69.068 66.924 94.155 1.00 0.00 H TER 68449 WAT 4692 ATOM 68449 O WAT 4693 86.413 57.587 128.529 1.00 0.00 O ATOM 68450 H1 WAT 4693 86.202 57.316 127.636 1.00 0.00 H ATOM 68451 H2 WAT 4693 86.462 56.768 129.022 1.00 0.00 H TER 68453 WAT 4693 ATOM 68453 O WAT 4694 64.631 61.273 69.507 1.00 0.00 O ATOM 68454 H1 WAT 4694 64.349 62.163 69.719 1.00 0.00 H ATOM 68455 H2 WAT 4694 64.134 60.715 70.105 1.00 0.00 H TER 68457 WAT 4694 ATOM 68457 O WAT 4695 40.251 47.615 152.135 1.00 0.00 O ATOM 68458 H1 WAT 4695 40.472 48.407 152.625 1.00 0.00 H ATOM 68459 H2 WAT 4695 40.085 47.924 151.244 1.00 0.00 H TER 68461 WAT 4695 ATOM 68461 O WAT 4696 116.617 69.387 126.077 1.00 0.00 O ATOM 68462 H1 WAT 4696 116.511 70.084 125.430 1.00 0.00 H ATOM 68463 H2 WAT 4696 115.788 68.909 126.053 1.00 0.00 H TER 68465 WAT 4696 ATOM 68465 O WAT 4697 95.684 140.785 138.861 1.00 0.00 O ATOM 68466 H1 WAT 4697 94.846 140.328 138.920 1.00 0.00 H ATOM 68467 H2 WAT 4697 95.459 141.711 138.951 1.00 0.00 H TER 68469 WAT 4697 ATOM 68469 O WAT 4698 39.250 135.159 116.978 1.00 0.00 O ATOM 68470 H1 WAT 4698 39.080 134.451 117.598 1.00 0.00 H ATOM 68471 H2 WAT 4698 39.789 135.782 117.466 1.00 0.00 H TER 68473 WAT 4698 ATOM 68473 O WAT 4699 22.554 38.137 67.370 1.00 0.00 O ATOM 68474 H1 WAT 4699 23.008 38.388 66.566 1.00 0.00 H ATOM 68475 H2 WAT 4699 22.174 38.952 67.696 1.00 0.00 H TER 68477 WAT 4699 ATOM 68477 O WAT 4700 140.010 127.428 105.462 1.00 0.00 O ATOM 68478 H1 WAT 4700 139.977 126.633 105.993 1.00 0.00 H ATOM 68479 H2 WAT 4700 139.327 127.305 104.803 1.00 0.00 H TER 68481 WAT 4700 ATOM 68481 O WAT 4701 15.657 21.454 151.464 1.00 0.00 O ATOM 68482 H1 WAT 4701 16.134 21.757 150.691 1.00 0.00 H ATOM 68483 H2 WAT 4701 14.758 21.331 151.158 1.00 0.00 H TER 68485 WAT 4701 ATOM 68485 O WAT 4702 136.010 3.856 121.897 1.00 0.00 O ATOM 68486 H1 WAT 4702 136.137 4.193 122.784 1.00 0.00 H ATOM 68487 H2 WAT 4702 136.817 3.380 121.703 1.00 0.00 H TER 68489 WAT 4702 ATOM 68489 O WAT 4703 3.306 56.347 19.905 1.00 0.00 O ATOM 68490 H1 WAT 4703 3.479 57.267 19.706 1.00 0.00 H ATOM 68491 H2 WAT 4703 3.654 56.223 20.788 1.00 0.00 H TER 68493 WAT 4703 ATOM 68493 O WAT 4704 65.228 136.580 102.732 1.00 0.00 O ATOM 68494 H1 WAT 4704 65.041 137.027 101.907 1.00 0.00 H ATOM 68495 H2 WAT 4704 66.114 136.862 102.961 1.00 0.00 H TER 68497 WAT 4704 ATOM 68497 O WAT 4705 131.682 77.068 151.777 1.00 0.00 O ATOM 68498 H1 WAT 4705 131.114 77.798 152.027 1.00 0.00 H ATOM 68499 H2 WAT 4705 131.156 76.287 151.949 1.00 0.00 H TER 68501 WAT 4705 ATOM 68501 O WAT 4706 8.613 142.375 57.918 1.00 0.00 O ATOM 68502 H1 WAT 4706 8.412 141.552 58.364 1.00 0.00 H ATOM 68503 H2 WAT 4706 9.519 142.275 57.627 1.00 0.00 H TER 68505 WAT 4706 ATOM 68505 O WAT 4707 143.270 91.910 152.688 1.00 0.00 O ATOM 68506 H1 WAT 4707 142.462 91.559 153.061 1.00 0.00 H ATOM 68507 H2 WAT 4707 142.986 92.652 152.155 1.00 0.00 H TER 68509 WAT 4707 ATOM 68509 O WAT 4708 3.237 14.879 63.276 1.00 0.00 O ATOM 68510 H1 WAT 4708 3.380 15.036 64.209 1.00 0.00 H ATOM 68511 H2 WAT 4708 2.878 15.703 62.947 1.00 0.00 H TER 68513 WAT 4708 ATOM 68513 O WAT 4709 121.400 11.100 138.609 1.00 0.00 O ATOM 68514 H1 WAT 4709 121.298 11.765 137.928 1.00 0.00 H ATOM 68515 H2 WAT 4709 120.906 10.347 138.285 1.00 0.00 H TER 68517 WAT 4709 ATOM 68517 O WAT 4710 108.009 137.695 156.123 1.00 0.00 O ATOM 68518 H1 WAT 4710 108.787 137.145 156.030 1.00 0.00 H ATOM 68519 H2 WAT 4710 107.444 137.436 155.395 1.00 0.00 H TER 68521 WAT 4710 ATOM 68521 O WAT 4711 82.228 100.958 71.697 1.00 0.00 O ATOM 68522 H1 WAT 4711 81.820 100.613 72.491 1.00 0.00 H ATOM 68523 H2 WAT 4711 81.504 101.348 71.206 1.00 0.00 H TER 68525 WAT 4711 ATOM 68525 O WAT 4712 77.033 87.896 135.032 1.00 0.00 O ATOM 68526 H1 WAT 4712 77.897 87.516 135.191 1.00 0.00 H ATOM 68527 H2 WAT 4712 76.769 87.543 134.182 1.00 0.00 H TER 68529 WAT 4712 ATOM 68529 O WAT 4713 2.488 20.163 121.735 1.00 0.00 O ATOM 68530 H1 WAT 4713 2.092 19.810 120.938 1.00 0.00 H ATOM 68531 H2 WAT 4713 3.370 20.425 121.468 1.00 0.00 H TER 68533 WAT 4713 ATOM 68533 O WAT 4714 90.584 63.680 157.969 1.00 0.00 O ATOM 68534 H1 WAT 4714 89.987 63.105 157.491 1.00 0.00 H ATOM 68535 H2 WAT 4714 90.805 64.370 157.343 1.00 0.00 H TER 68537 WAT 4714 ATOM 68537 O WAT 4715 124.198 137.916 22.628 1.00 0.00 O ATOM 68538 H1 WAT 4715 124.679 137.599 23.392 1.00 0.00 H ATOM 68539 H2 WAT 4715 123.835 138.757 22.905 1.00 0.00 H TER 68541 WAT 4715 ATOM 68541 O WAT 4716 102.143 71.698 3.570 1.00 0.00 O ATOM 68542 H1 WAT 4716 102.609 70.885 3.379 1.00 0.00 H ATOM 68543 H2 WAT 4716 102.834 72.332 3.760 1.00 0.00 H TER 68545 WAT 4716 ATOM 68545 O WAT 4717 122.486 69.482 103.516 1.00 0.00 O ATOM 68546 H1 WAT 4717 122.763 69.585 102.605 1.00 0.00 H ATOM 68547 H2 WAT 4717 121.621 69.076 103.459 1.00 0.00 H TER 68549 WAT 4717 ATOM 68549 O WAT 4718 56.361 52.858 88.087 1.00 0.00 O ATOM 68550 H1 WAT 4718 56.686 52.380 87.324 1.00 0.00 H ATOM 68551 H2 WAT 4718 56.880 53.663 88.104 1.00 0.00 H TER 68553 WAT 4718 ATOM 68553 O WAT 4719 44.747 50.777 155.136 1.00 0.00 O ATOM 68554 H1 WAT 4719 45.093 51.302 154.415 1.00 0.00 H ATOM 68555 H2 WAT 4719 44.756 49.879 154.805 1.00 0.00 H TER 68557 WAT 4719 ATOM 68557 O WAT 4720 128.744 98.130 22.747 1.00 0.00 O ATOM 68558 H1 WAT 4720 128.798 97.198 22.958 1.00 0.00 H ATOM 68559 H2 WAT 4720 128.574 98.556 23.587 1.00 0.00 H TER 68561 WAT 4720 ATOM 68561 O WAT 4721 104.213 100.406 97.909 1.00 0.00 O ATOM 68562 H1 WAT 4721 104.253 100.953 97.125 1.00 0.00 H ATOM 68563 H2 WAT 4721 104.733 100.879 98.559 1.00 0.00 H TER 68565 WAT 4721 ATOM 68565 O WAT 4722 34.149 124.264 111.092 1.00 0.00 O ATOM 68566 H1 WAT 4722 34.222 124.279 112.047 1.00 0.00 H ATOM 68567 H2 WAT 4722 33.693 125.078 110.875 1.00 0.00 H TER 68569 WAT 4722 ATOM 68569 O WAT 4723 78.761 22.885 126.329 1.00 0.00 O ATOM 68570 H1 WAT 4723 78.407 22.289 125.670 1.00 0.00 H ATOM 68571 H2 WAT 4723 79.708 22.854 126.195 1.00 0.00 H TER 68573 WAT 4723 ATOM 68573 O WAT 4724 55.338 98.635 70.055 1.00 0.00 O ATOM 68574 H1 WAT 4724 55.714 97.767 70.203 1.00 0.00 H ATOM 68575 H2 WAT 4724 55.885 99.019 69.369 1.00 0.00 H TER 68577 WAT 4724 ATOM 68577 O WAT 4725 128.402 84.556 148.418 1.00 0.00 O ATOM 68578 H1 WAT 4725 129.287 84.190 148.421 1.00 0.00 H ATOM 68579 H2 WAT 4725 128.039 84.299 147.571 1.00 0.00 H TER 68581 WAT 4725 ATOM 68581 O WAT 4726 114.258 125.787 154.785 1.00 0.00 O ATOM 68582 H1 WAT 4726 114.148 124.921 155.176 1.00 0.00 H ATOM 68583 H2 WAT 4726 114.228 125.630 153.842 1.00 0.00 H TER 68585 WAT 4726 ATOM 68585 O WAT 4727 107.966 25.635 3.323 1.00 0.00 O ATOM 68586 H1 WAT 4727 107.110 25.286 3.572 1.00 0.00 H ATOM 68587 H2 WAT 4727 108.444 25.709 4.149 1.00 0.00 H TER 68589 WAT 4727 ATOM 68589 O WAT 4728 107.836 53.724 3.896 1.00 0.00 O ATOM 68590 H1 WAT 4728 108.083 54.539 3.459 1.00 0.00 H ATOM 68591 H2 WAT 4728 107.922 53.917 4.829 1.00 0.00 H TER 68593 WAT 4728 ATOM 68593 O WAT 4729 49.271 89.060 75.086 1.00 0.00 O ATOM 68594 H1 WAT 4729 49.709 88.278 75.419 1.00 0.00 H ATOM 68595 H2 WAT 4729 49.976 89.591 74.715 1.00 0.00 H TER 68597 WAT 4729 ATOM 68597 O WAT 4730 14.120 125.734 129.548 1.00 0.00 O ATOM 68598 H1 WAT 4730 13.435 125.600 130.203 1.00 0.00 H ATOM 68599 H2 WAT 4730 14.378 126.650 129.656 1.00 0.00 H TER 68601 WAT 4730 ATOM 68601 O WAT 4731 115.620 25.248 94.424 1.00 0.00 O ATOM 68602 H1 WAT 4731 115.498 24.512 95.024 1.00 0.00 H ATOM 68603 H2 WAT 4731 116.568 25.302 94.301 1.00 0.00 H TER 68605 WAT 4731 ATOM 68605 O WAT 4732 123.182 66.641 78.642 1.00 0.00 O ATOM 68606 H1 WAT 4732 123.773 66.241 78.005 1.00 0.00 H ATOM 68607 H2 WAT 4732 123.737 67.243 79.139 1.00 0.00 H TER 68609 WAT 4732 ATOM 68609 O WAT 4733 87.849 122.868 118.904 1.00 0.00 O ATOM 68610 H1 WAT 4733 87.209 122.393 119.435 1.00 0.00 H ATOM 68611 H2 WAT 4733 88.325 122.183 118.435 1.00 0.00 H TER 68613 WAT 4733 ATOM 68613 O WAT 4734 141.680 74.137 147.679 1.00 0.00 O ATOM 68614 H1 WAT 4734 141.852 74.049 148.616 1.00 0.00 H ATOM 68615 H2 WAT 4734 140.754 73.915 147.583 1.00 0.00 H TER 68617 WAT 4734 ATOM 68617 O WAT 4735 23.842 9.995 63.492 1.00 0.00 O ATOM 68618 H1 WAT 4735 23.885 10.016 62.536 1.00 0.00 H ATOM 68619 H2 WAT 4735 22.905 9.973 63.689 1.00 0.00 H TER 68621 WAT 4735 ATOM 68621 O WAT 4736 88.180 31.692 9.103 1.00 0.00 O ATOM 68622 H1 WAT 4736 88.988 31.639 8.592 1.00 0.00 H ATOM 68623 H2 WAT 4736 88.216 30.934 9.687 1.00 0.00 H TER 68625 WAT 4736 ATOM 68625 O WAT 4737 69.453 101.906 101.096 1.00 0.00 O ATOM 68626 H1 WAT 4737 69.707 102.820 100.969 1.00 0.00 H ATOM 68627 H2 WAT 4737 70.275 101.453 101.288 1.00 0.00 H TER 68629 WAT 4737 ATOM 68629 O WAT 4738 1.576 13.540 11.559 1.00 0.00 O ATOM 68630 H1 WAT 4738 2.264 13.533 12.225 1.00 0.00 H ATOM 68631 H2 WAT 4738 1.407 12.615 11.380 1.00 0.00 H TER 68633 WAT 4738 ATOM 68633 O WAT 4739 35.118 50.161 25.963 1.00 0.00 O ATOM 68634 H1 WAT 4739 35.594 49.352 26.151 1.00 0.00 H ATOM 68635 H2 WAT 4739 35.671 50.853 26.325 1.00 0.00 H TER 68637 WAT 4739 ATOM 68637 O WAT 4740 134.712 21.510 151.136 1.00 0.00 O ATOM 68638 H1 WAT 4740 134.443 20.775 151.687 1.00 0.00 H ATOM 68639 H2 WAT 4740 134.153 22.236 151.414 1.00 0.00 H TER 68641 WAT 4740 ATOM 68641 O WAT 4741 3.704 101.519 154.150 1.00 0.00 O ATOM 68642 H1 WAT 4741 4.448 101.184 154.650 1.00 0.00 H ATOM 68643 H2 WAT 4741 4.057 102.268 153.669 1.00 0.00 H TER 68645 WAT 4741 ATOM 68645 O WAT 4742 5.729 81.116 11.988 1.00 0.00 O ATOM 68646 H1 WAT 4742 6.471 81.328 11.421 1.00 0.00 H ATOM 68647 H2 WAT 4742 5.959 81.498 12.835 1.00 0.00 H TER 68649 WAT 4742 ATOM 68649 O WAT 4743 37.411 44.493 26.250 1.00 0.00 O ATOM 68650 H1 WAT 4743 36.911 43.682 26.335 1.00 0.00 H ATOM 68651 H2 WAT 4743 36.949 44.990 25.575 1.00 0.00 H TER 68653 WAT 4743 ATOM 68653 O WAT 4744 2.093 15.388 120.834 1.00 0.00 O ATOM 68654 H1 WAT 4744 2.567 16.199 121.018 1.00 0.00 H ATOM 68655 H2 WAT 4744 2.272 15.210 119.911 1.00 0.00 H TER 68657 WAT 4744 ATOM 68657 O WAT 4745 96.774 146.030 116.320 1.00 0.00 O ATOM 68658 H1 WAT 4745 97.659 145.675 116.401 1.00 0.00 H ATOM 68659 H2 WAT 4745 96.356 145.482 115.655 1.00 0.00 H TER 68661 WAT 4745 ATOM 68661 O WAT 4746 142.501 75.720 105.162 1.00 0.00 O ATOM 68662 H1 WAT 4746 142.529 76.179 106.001 1.00 0.00 H ATOM 68663 H2 WAT 4746 141.628 75.907 104.816 1.00 0.00 H TER 68665 WAT 4746 ATOM 68665 O WAT 4747 112.775 32.661 83.616 1.00 0.00 O ATOM 68666 H1 WAT 4747 112.278 31.945 83.221 1.00 0.00 H ATOM 68667 H2 WAT 4747 112.468 32.695 84.522 1.00 0.00 H TER 68669 WAT 4747 ATOM 68669 O WAT 4748 47.331 0.801 134.287 1.00 0.00 O ATOM 68670 H1 WAT 4748 47.104 1.662 133.935 1.00 0.00 H ATOM 68671 H2 WAT 4748 48.237 0.895 134.582 1.00 0.00 H TER 68673 WAT 4748 ATOM 68673 O WAT 4749 82.731 141.368 123.055 1.00 0.00 O ATOM 68674 H1 WAT 4749 82.328 142.195 123.319 1.00 0.00 H ATOM 68675 H2 WAT 4749 82.101 140.977 122.451 1.00 0.00 H TER 68677 WAT 4749 ATOM 68677 O WAT 4750 46.627 54.997 87.719 1.00 0.00 O ATOM 68678 H1 WAT 4750 47.210 54.542 87.111 1.00 0.00 H ATOM 68679 H2 WAT 4750 47.216 55.462 88.313 1.00 0.00 H TER 68681 WAT 4750 ATOM 68681 O WAT 4751 29.840 106.684 117.423 1.00 0.00 O ATOM 68682 H1 WAT 4751 29.025 106.920 116.981 1.00 0.00 H ATOM 68683 H2 WAT 4751 29.699 106.936 118.336 1.00 0.00 H TER 68685 WAT 4751 ATOM 68685 O WAT 4752 83.076 113.533 26.642 1.00 0.00 O ATOM 68686 H1 WAT 4752 83.489 113.829 27.453 1.00 0.00 H ATOM 68687 H2 WAT 4752 83.681 113.803 25.952 1.00 0.00 H TER 68689 WAT 4752 ATOM 68689 O WAT 4753 105.837 81.696 101.176 1.00 0.00 O ATOM 68690 H1 WAT 4753 106.291 82.341 101.718 1.00 0.00 H ATOM 68691 H2 WAT 4753 106.419 80.936 101.169 1.00 0.00 H TER 68693 WAT 4753 ATOM 68693 O WAT 4754 112.383 19.135 88.308 1.00 0.00 O ATOM 68694 H1 WAT 4754 112.856 18.942 87.498 1.00 0.00 H ATOM 68695 H2 WAT 4754 112.825 19.905 88.666 1.00 0.00 H TER 68697 WAT 4754 ATOM 68697 O WAT 4755 2.740 13.273 67.197 1.00 0.00 O ATOM 68698 H1 WAT 4755 2.897 14.141 66.825 1.00 0.00 H ATOM 68699 H2 WAT 4755 2.966 13.365 68.123 1.00 0.00 H TER 68701 WAT 4755 ATOM 68701 O WAT 4756 74.774 139.574 3.070 1.00 0.00 O ATOM 68702 H1 WAT 4756 74.489 139.754 3.966 1.00 0.00 H ATOM 68703 H2 WAT 4756 74.333 138.756 2.838 1.00 0.00 H TER 68705 WAT 4756 ATOM 68705 O WAT 4757 13.804 16.321 15.486 1.00 0.00 O ATOM 68706 H1 WAT 4757 13.337 15.601 15.063 1.00 0.00 H ATOM 68707 H2 WAT 4757 14.266 15.909 16.217 1.00 0.00 H TER 68709 WAT 4757 ATOM 68709 O WAT 4758 22.021 97.822 149.604 1.00 0.00 O ATOM 68710 H1 WAT 4758 22.860 98.238 149.406 1.00 0.00 H ATOM 68711 H2 WAT 4758 21.367 98.488 149.392 1.00 0.00 H TER 68713 WAT 4758 ATOM 68713 O WAT 4759 110.086 18.950 61.434 1.00 0.00 O ATOM 68714 H1 WAT 4759 110.708 18.416 61.928 1.00 0.00 H ATOM 68715 H2 WAT 4759 110.263 19.847 61.718 1.00 0.00 H TER 68717 WAT 4759 ATOM 68717 O WAT 4760 84.962 110.740 11.801 1.00 0.00 O ATOM 68718 H1 WAT 4760 84.403 110.952 11.054 1.00 0.00 H ATOM 68719 H2 WAT 4760 85.830 111.054 11.547 1.00 0.00 H TER 68721 WAT 4760 ATOM 68721 O WAT 4761 47.944 83.866 28.498 1.00 0.00 O ATOM 68722 H1 WAT 4761 48.649 83.611 27.903 1.00 0.00 H ATOM 68723 H2 WAT 4761 47.607 83.037 28.839 1.00 0.00 H TER 68725 WAT 4761 ATOM 68725 O WAT 4762 17.100 68.644 99.959 1.00 0.00 O ATOM 68726 H1 WAT 4762 16.887 67.712 99.935 1.00 0.00 H ATOM 68727 H2 WAT 4762 17.831 68.707 100.573 1.00 0.00 H TER 68729 WAT 4762 ATOM 68729 O WAT 4763 71.654 20.939 137.975 1.00 0.00 O ATOM 68730 H1 WAT 4763 70.977 20.339 137.662 1.00 0.00 H ATOM 68731 H2 WAT 4763 72.234 21.058 137.223 1.00 0.00 H TER 68733 WAT 4763 ATOM 68733 O WAT 4764 117.387 94.521 69.774 1.00 0.00 O ATOM 68734 H1 WAT 4764 116.927 94.385 68.946 1.00 0.00 H ATOM 68735 H2 WAT 4764 118.172 95.014 69.534 1.00 0.00 H TER 68737 WAT 4764 ATOM 68737 O WAT 4765 64.017 74.947 133.211 1.00 0.00 O ATOM 68738 H1 WAT 4765 63.726 74.036 133.235 1.00 0.00 H ATOM 68739 H2 WAT 4765 64.469 75.032 132.372 1.00 0.00 H TER 68741 WAT 4765 ATOM 68741 O WAT 4766 61.578 75.853 134.355 1.00 0.00 O ATOM 68742 H1 WAT 4766 61.609 76.791 134.170 1.00 0.00 H ATOM 68743 H2 WAT 4766 62.402 75.513 134.005 1.00 0.00 H TER 68745 WAT 4766 ATOM 68745 O WAT 4767 90.753 43.508 157.616 1.00 0.00 O ATOM 68746 H1 WAT 4767 90.686 43.792 158.528 1.00 0.00 H ATOM 68747 H2 WAT 4767 90.078 44.009 157.159 1.00 0.00 H TER 68749 WAT 4767 ATOM 68749 O WAT 4768 35.048 72.668 115.951 1.00 0.00 O ATOM 68750 H1 WAT 4768 34.165 72.387 115.714 1.00 0.00 H ATOM 68751 H2 WAT 4768 34.947 73.586 116.205 1.00 0.00 H TER 68753 WAT 4768 ATOM 68753 O WAT 4769 99.313 137.920 152.785 1.00 0.00 O ATOM 68754 H1 WAT 4769 99.680 137.504 152.005 1.00 0.00 H ATOM 68755 H2 WAT 4769 98.942 137.196 153.290 1.00 0.00 H TER 68757 WAT 4769 ATOM 68757 O WAT 4770 113.587 144.667 6.724 1.00 0.00 O ATOM 68758 H1 WAT 4770 113.282 144.120 7.448 1.00 0.00 H ATOM 68759 H2 WAT 4770 114.540 144.669 6.812 1.00 0.00 H TER 68761 WAT 4770 ATOM 68761 O WAT 4771 83.444 121.273 81.204 1.00 0.00 O ATOM 68762 H1 WAT 4771 82.913 121.240 80.409 1.00 0.00 H ATOM 68763 H2 WAT 4771 84.278 120.876 80.952 1.00 0.00 H TER 68765 WAT 4771 ATOM 68765 O WAT 4772 66.912 77.845 127.762 1.00 0.00 O ATOM 68766 H1 WAT 4772 66.852 78.544 127.112 1.00 0.00 H ATOM 68767 H2 WAT 4772 67.190 78.288 128.564 1.00 0.00 H TER 68769 WAT 4772 ATOM 68769 O WAT 4773 36.932 6.451 5.110 1.00 0.00 O ATOM 68770 H1 WAT 4773 36.882 7.388 5.300 1.00 0.00 H ATOM 68771 H2 WAT 4773 36.852 6.028 5.965 1.00 0.00 H TER 68773 WAT 4773 ATOM 68773 O WAT 4774 7.843 62.094 11.575 1.00 0.00 O ATOM 68774 H1 WAT 4774 7.437 62.952 11.698 1.00 0.00 H ATOM 68775 H2 WAT 4774 8.723 62.192 11.939 1.00 0.00 H TER 68777 WAT 4774 ATOM 68777 O WAT 4775 74.700 38.446 103.525 1.00 0.00 O ATOM 68778 H1 WAT 4775 74.032 38.812 102.945 1.00 0.00 H ATOM 68779 H2 WAT 4775 75.526 38.787 103.184 1.00 0.00 H TER 68781 WAT 4775 ATOM 68781 O WAT 4776 84.309 111.233 154.487 1.00 0.00 O ATOM 68782 H1 WAT 4776 83.814 112.047 154.575 1.00 0.00 H ATOM 68783 H2 WAT 4776 84.785 111.152 155.314 1.00 0.00 H TER 68785 WAT 4776 ATOM 68785 O WAT 4777 39.429 52.283 75.339 1.00 0.00 O ATOM 68786 H1 WAT 4777 38.511 52.247 75.072 1.00 0.00 H ATOM 68787 H2 WAT 4777 39.401 52.538 76.261 1.00 0.00 H TER 68789 WAT 4777 ATOM 68789 O WAT 4778 122.773 89.832 93.005 1.00 0.00 O ATOM 68790 H1 WAT 4778 122.129 90.220 93.597 1.00 0.00 H ATOM 68791 H2 WAT 4778 122.318 89.089 92.609 1.00 0.00 H TER 68793 WAT 4778 ATOM 68793 O WAT 4779 42.602 14.772 116.428 1.00 0.00 O ATOM 68794 H1 WAT 4779 42.550 15.356 117.184 1.00 0.00 H ATOM 68795 H2 WAT 4779 41.758 14.872 115.989 1.00 0.00 H TER 68797 WAT 4779 ATOM 68797 O WAT 4780 10.513 82.773 10.191 1.00 0.00 O ATOM 68798 H1 WAT 4780 10.731 82.395 9.339 1.00 0.00 H ATOM 68799 H2 WAT 4780 10.452 83.714 10.028 1.00 0.00 H TER 68801 WAT 4780 ATOM 68801 O WAT 4781 92.184 16.830 143.441 1.00 0.00 O ATOM 68802 H1 WAT 4781 92.493 16.094 143.969 1.00 0.00 H ATOM 68803 H2 WAT 4781 91.276 16.958 143.716 1.00 0.00 H TER 68805 WAT 4781 ATOM 68805 O WAT 4782 77.933 31.472 158.350 1.00 0.00 O ATOM 68806 H1 WAT 4782 78.434 30.705 158.071 1.00 0.00 H ATOM 68807 H2 WAT 4782 77.297 31.127 158.977 1.00 0.00 H TER 68809 WAT 4782 ATOM 68809 O WAT 4783 140.009 134.976 115.705 1.00 0.00 O ATOM 68810 H1 WAT 4783 139.432 134.214 115.666 1.00 0.00 H ATOM 68811 H2 WAT 4783 139.616 135.606 115.101 1.00 0.00 H TER 68813 WAT 4783 ATOM 68813 O WAT 4784 69.842 49.055 60.204 1.00 0.00 O ATOM 68814 H1 WAT 4784 69.857 49.997 60.373 1.00 0.00 H ATOM 68815 H2 WAT 4784 69.251 48.954 59.458 1.00 0.00 H TER 68817 WAT 4784 ATOM 68817 O WAT 4785 14.557 46.571 114.442 1.00 0.00 O ATOM 68818 H1 WAT 4785 14.034 46.801 115.210 1.00 0.00 H ATOM 68819 H2 WAT 4785 14.755 45.642 114.557 1.00 0.00 H TER 68821 WAT 4785 ATOM 68821 O WAT 4786 63.393 28.574 60.019 1.00 0.00 O ATOM 68822 H1 WAT 4786 62.632 28.261 60.507 1.00 0.00 H ATOM 68823 H2 WAT 4786 63.028 28.940 59.213 1.00 0.00 H TER 68825 WAT 4786 ATOM 68825 O WAT 4787 124.118 128.627 13.306 1.00 0.00 O ATOM 68826 H1 WAT 4787 123.955 129.085 12.481 1.00 0.00 H ATOM 68827 H2 WAT 4787 123.493 129.013 13.921 1.00 0.00 H TER 68829 WAT 4787 ATOM 68829 O WAT 4788 111.158 87.574 111.483 1.00 0.00 O ATOM 68830 H1 WAT 4788 111.202 88.148 110.718 1.00 0.00 H ATOM 68831 H2 WAT 4788 110.326 87.112 111.388 1.00 0.00 H TER 68833 WAT 4788 ATOM 68833 O WAT 4789 5.633 12.163 125.942 1.00 0.00 O ATOM 68834 H1 WAT 4789 5.391 11.238 125.911 1.00 0.00 H ATOM 68835 H2 WAT 4789 6.361 12.241 125.325 1.00 0.00 H TER 68837 WAT 4789 ATOM 68837 O WAT 4790 115.362 33.505 146.918 1.00 0.00 O ATOM 68838 H1 WAT 4790 115.636 32.789 147.491 1.00 0.00 H ATOM 68839 H2 WAT 4790 116.151 33.733 146.426 1.00 0.00 H TER 68841 WAT 4790 ATOM 68841 O WAT 4791 87.110 33.620 151.660 1.00 0.00 O ATOM 68842 H1 WAT 4791 86.456 34.097 151.148 1.00 0.00 H ATOM 68843 H2 WAT 4791 87.755 34.284 151.902 1.00 0.00 H TER 68845 WAT 4791 ATOM 68845 O WAT 4792 26.765 77.649 136.829 1.00 0.00 O ATOM 68846 H1 WAT 4792 26.781 78.552 136.513 1.00 0.00 H ATOM 68847 H2 WAT 4792 27.356 77.178 136.242 1.00 0.00 H TER 68849 WAT 4792 ATOM 68849 O WAT 4793 14.270 129.754 4.380 1.00 0.00 O ATOM 68850 H1 WAT 4793 15.031 130.227 4.716 1.00 0.00 H ATOM 68851 H2 WAT 4793 13.538 130.359 4.504 1.00 0.00 H TER 68853 WAT 4793 ATOM 68853 O WAT 4794 80.437 133.537 92.800 1.00 0.00 O ATOM 68854 H1 WAT 4794 81.114 134.076 92.391 1.00 0.00 H ATOM 68855 H2 WAT 4794 80.188 134.021 93.587 1.00 0.00 H TER 68857 WAT 4794 ATOM 68857 O WAT 4795 26.955 66.364 111.426 1.00 0.00 O ATOM 68858 H1 WAT 4795 26.485 66.768 110.697 1.00 0.00 H ATOM 68859 H2 WAT 4795 27.109 67.082 112.040 1.00 0.00 H TER 68861 WAT 4795 ATOM 68861 O WAT 4796 60.021 95.266 156.999 1.00 0.00 O ATOM 68862 H1 WAT 4796 60.847 95.702 157.205 1.00 0.00 H ATOM 68863 H2 WAT 4796 60.277 94.490 156.500 1.00 0.00 H TER 68865 WAT 4796 ATOM 68865 O WAT 4797 1.092 49.730 14.799 1.00 0.00 O ATOM 68866 H1 WAT 4797 1.373 49.232 15.567 1.00 0.00 H ATOM 68867 H2 WAT 4797 1.803 49.619 14.168 1.00 0.00 H TER 68869 WAT 4797 ATOM 68869 O WAT 4798 48.553 92.033 16.807 1.00 0.00 O ATOM 68870 H1 WAT 4798 49.508 92.050 16.883 1.00 0.00 H ATOM 68871 H2 WAT 4798 48.342 91.113 16.650 1.00 0.00 H TER 68873 WAT 4798 ATOM 68873 O WAT 4799 112.340 25.121 -0.089 1.00 0.00 O ATOM 68874 H1 WAT 4799 112.981 24.419 0.023 1.00 0.00 H ATOM 68875 H2 WAT 4799 111.721 24.998 0.631 1.00 0.00 H TER 68877 WAT 4799 ATOM 68877 O WAT 4800 64.991 47.770 25.946 1.00 0.00 O ATOM 68878 H1 WAT 4800 65.364 47.990 25.092 1.00 0.00 H ATOM 68879 H2 WAT 4800 64.693 48.608 26.300 1.00 0.00 H TER 68881 WAT 4800 ATOM 68881 O WAT 4801 59.478 104.255 140.939 1.00 0.00 O ATOM 68882 H1 WAT 4801 59.212 104.658 141.765 1.00 0.00 H ATOM 68883 H2 WAT 4801 60.201 104.799 140.628 1.00 0.00 H TER 68885 WAT 4801 ATOM 68885 O WAT 4802 96.393 98.007 113.206 1.00 0.00 O ATOM 68886 H1 WAT 4802 96.910 98.346 112.475 1.00 0.00 H ATOM 68887 H2 WAT 4802 96.465 97.056 113.131 1.00 0.00 H TER 68889 WAT 4802 ATOM 68889 O WAT 4803 21.931 109.745 126.529 1.00 0.00 O ATOM 68890 H1 WAT 4803 22.184 110.296 127.270 1.00 0.00 H ATOM 68891 H2 WAT 4803 21.547 108.965 126.930 1.00 0.00 H TER 68893 WAT 4803 ATOM 68893 O WAT 4804 82.275 77.550 13.402 1.00 0.00 O ATOM 68894 H1 WAT 4804 81.994 77.466 14.313 1.00 0.00 H ATOM 68895 H2 WAT 4804 81.660 77.006 12.911 1.00 0.00 H TER 68897 WAT 4804 ATOM 68897 O WAT 4805 79.296 26.445 15.231 1.00 0.00 O ATOM 68898 H1 WAT 4805 80.035 25.998 15.643 1.00 0.00 H ATOM 68899 H2 WAT 4805 79.347 26.192 14.309 1.00 0.00 H TER 68901 WAT 4805 ATOM 68901 O WAT 4806 47.323 9.034 9.790 1.00 0.00 O ATOM 68902 H1 WAT 4806 47.173 8.968 8.847 1.00 0.00 H ATOM 68903 H2 WAT 4806 48.251 8.830 9.900 1.00 0.00 H TER 68905 WAT 4806 ATOM 68905 O WAT 4807 64.393 13.877 99.115 1.00 0.00 O ATOM 68906 H1 WAT 4807 64.039 14.243 99.925 1.00 0.00 H ATOM 68907 H2 WAT 4807 64.066 14.456 98.427 1.00 0.00 H TER 68909 WAT 4807 ATOM 68909 O WAT 4808 127.853 77.368 131.442 1.00 0.00 O ATOM 68910 H1 WAT 4808 127.151 76.787 131.148 1.00 0.00 H ATOM 68911 H2 WAT 4808 127.880 78.063 130.784 1.00 0.00 H TER 68913 WAT 4808 ATOM 68913 O WAT 4809 123.151 88.116 121.398 1.00 0.00 O ATOM 68914 H1 WAT 4809 122.821 87.493 122.045 1.00 0.00 H ATOM 68915 H2 WAT 4809 123.380 88.892 121.908 1.00 0.00 H TER 68917 WAT 4809 ATOM 68917 O WAT 4810 27.724 103.162 59.684 1.00 0.00 O ATOM 68918 H1 WAT 4810 27.008 103.214 59.050 1.00 0.00 H ATOM 68919 H2 WAT 4810 27.536 102.373 60.193 1.00 0.00 H TER 68921 WAT 4810 ATOM 68921 O WAT 4811 124.684 84.344 108.381 1.00 0.00 O ATOM 68922 H1 WAT 4811 125.333 84.342 107.677 1.00 0.00 H ATOM 68923 H2 WAT 4811 124.117 83.597 108.187 1.00 0.00 H TER 68925 WAT 4811 ATOM 68925 O WAT 4812 63.016 22.806 154.523 1.00 0.00 O ATOM 68926 H1 WAT 4812 62.834 22.544 153.620 1.00 0.00 H ATOM 68927 H2 WAT 4812 63.847 23.278 154.472 1.00 0.00 H TER 68929 WAT 4812 ATOM 68929 O WAT 4813 3.461 60.322 139.294 1.00 0.00 O ATOM 68930 H1 WAT 4813 3.416 59.438 138.928 1.00 0.00 H ATOM 68931 H2 WAT 4813 3.534 60.894 138.530 1.00 0.00 H TER 68933 WAT 4813 ATOM 68933 O WAT 4814 21.563 128.824 135.409 1.00 0.00 O ATOM 68934 H1 WAT 4814 21.096 129.407 134.811 1.00 0.00 H ATOM 68935 H2 WAT 4814 21.477 129.242 136.266 1.00 0.00 H TER 68937 WAT 4814 ATOM 68937 O WAT 4815 102.495 103.399 83.119 1.00 0.00 O ATOM 68938 H1 WAT 4815 103.046 102.723 82.724 1.00 0.00 H ATOM 68939 H2 WAT 4815 102.731 103.388 84.047 1.00 0.00 H TER 68941 WAT 4815 ATOM 68941 O WAT 4816 29.412 123.723 9.878 1.00 0.00 O ATOM 68942 H1 WAT 4816 29.540 122.872 9.458 1.00 0.00 H ATOM 68943 H2 WAT 4816 30.243 124.181 9.751 1.00 0.00 H TER 68945 WAT 4816 ATOM 68945 O WAT 4817 20.779 6.732 109.761 1.00 0.00 O ATOM 68946 H1 WAT 4817 21.609 7.042 109.398 1.00 0.00 H ATOM 68947 H2 WAT 4817 20.110 7.166 109.232 1.00 0.00 H TER 68949 WAT 4817 ATOM 68949 O WAT 4818 139.622 88.518 126.455 1.00 0.00 O ATOM 68950 H1 WAT 4818 139.247 89.045 125.750 1.00 0.00 H ATOM 68951 H2 WAT 4818 140.429 88.161 126.083 1.00 0.00 H TER 68953 WAT 4818 ATOM 68953 O WAT 4819 54.297 65.238 86.660 1.00 0.00 O ATOM 68954 H1 WAT 4819 53.412 65.447 86.362 1.00 0.00 H ATOM 68955 H2 WAT 4819 54.573 64.512 86.101 1.00 0.00 H TER 68957 WAT 4819 ATOM 68957 O WAT 4820 10.236 43.362 90.204 1.00 0.00 O ATOM 68958 H1 WAT 4820 10.133 43.527 89.267 1.00 0.00 H ATOM 68959 H2 WAT 4820 10.673 44.145 90.538 1.00 0.00 H TER 68961 WAT 4820 ATOM 68961 O WAT 4821 130.299 137.046 9.151 1.00 0.00 O ATOM 68962 H1 WAT 4821 130.714 137.321 9.969 1.00 0.00 H ATOM 68963 H2 WAT 4821 129.970 136.166 9.333 1.00 0.00 H TER 68965 WAT 4821 ATOM 68965 O WAT 4822 84.472 125.389 97.577 1.00 0.00 O ATOM 68966 H1 WAT 4822 83.760 125.753 98.103 1.00 0.00 H ATOM 68967 H2 WAT 4822 84.798 124.651 98.093 1.00 0.00 H TER 68969 WAT 4822 ATOM 68969 O WAT 4823 0.956 21.175 126.362 1.00 0.00 O ATOM 68970 H1 WAT 4823 0.691 20.447 125.800 1.00 0.00 H ATOM 68971 H2 WAT 4823 1.772 20.881 126.767 1.00 0.00 H TER 68973 WAT 4823 ATOM 68973 O WAT 4824 13.655 75.075 126.034 1.00 0.00 O ATOM 68974 H1 WAT 4824 12.782 75.305 125.717 1.00 0.00 H ATOM 68975 H2 WAT 4824 13.743 75.549 126.861 1.00 0.00 H TER 68977 WAT 4824 ATOM 68977 O WAT 4825 3.246 7.968 89.601 1.00 0.00 O ATOM 68978 H1 WAT 4825 3.942 8.596 89.405 1.00 0.00 H ATOM 68979 H2 WAT 4825 3.666 7.112 89.520 1.00 0.00 H TER 68981 WAT 4825 ATOM 68981 O WAT 4826 0.958 63.392 136.743 1.00 0.00 O ATOM 68982 H1 WAT 4826 1.814 62.994 136.903 1.00 0.00 H ATOM 68983 H2 WAT 4826 0.605 62.908 135.996 1.00 0.00 H TER 68985 WAT 4826 ATOM 68985 O WAT 4827 18.027 112.615 136.469 1.00 0.00 O ATOM 68986 H1 WAT 4827 17.136 112.896 136.678 1.00 0.00 H ATOM 68987 H2 WAT 4827 18.508 112.714 137.291 1.00 0.00 H TER 68989 WAT 4827 ATOM 68989 O WAT 4828 19.088 4.197 110.422 1.00 0.00 O ATOM 68990 H1 WAT 4828 19.331 5.075 110.129 1.00 0.00 H ATOM 68991 H2 WAT 4828 19.526 3.609 109.807 1.00 0.00 H TER 68993 WAT 4828 ATOM 68993 O WAT 4829 126.195 74.378 4.075 1.00 0.00 O ATOM 68994 H1 WAT 4829 126.571 74.224 4.941 1.00 0.00 H ATOM 68995 H2 WAT 4829 126.393 75.296 3.888 1.00 0.00 H TER 68997 WAT 4829 ATOM 68997 O WAT 4830 6.816 44.379 18.092 1.00 0.00 O ATOM 68998 H1 WAT 4830 6.417 45.175 17.740 1.00 0.00 H ATOM 68999 H2 WAT 4830 6.657 43.715 17.422 1.00 0.00 H TER 69001 WAT 4830 ATOM 69001 O WAT 4831 15.662 31.635 75.136 1.00 0.00 O ATOM 69002 H1 WAT 4831 15.756 30.755 74.769 1.00 0.00 H ATOM 69003 H2 WAT 4831 16.556 31.898 75.358 1.00 0.00 H TER 69005 WAT 4831 ATOM 69005 O WAT 4832 143.571 64.487 77.381 1.00 0.00 O ATOM 69006 H1 WAT 4832 144.355 64.782 76.918 1.00 0.00 H ATOM 69007 H2 WAT 4832 143.397 63.615 77.028 1.00 0.00 H TER 69009 WAT 4832 ATOM 69009 O WAT 4833 143.180 17.086 62.296 1.00 0.00 O ATOM 69010 H1 WAT 4833 143.894 17.723 62.303 1.00 0.00 H ATOM 69011 H2 WAT 4833 142.640 17.338 61.547 1.00 0.00 H TER 69013 WAT 4833 ATOM 69013 O WAT 4834 101.468 31.375 71.617 1.00 0.00 O ATOM 69014 H1 WAT 4834 101.173 30.548 71.235 1.00 0.00 H ATOM 69015 H2 WAT 4834 101.006 31.429 72.454 1.00 0.00 H TER 69017 WAT 4834 ATOM 69017 O WAT 4835 98.711 102.624 91.953 1.00 0.00 O ATOM 69018 H1 WAT 4835 98.492 102.556 92.883 1.00 0.00 H ATOM 69019 H2 WAT 4835 99.436 102.010 91.832 1.00 0.00 H TER 69021 WAT 4835 ATOM 69021 O WAT 4836 125.740 10.668 16.394 1.00 0.00 O ATOM 69022 H1 WAT 4836 124.808 10.493 16.263 1.00 0.00 H ATOM 69023 H2 WAT 4836 125.893 10.470 17.318 1.00 0.00 H TER 69025 WAT 4836 ATOM 69025 O WAT 4837 121.484 8.145 140.431 1.00 0.00 O ATOM 69026 H1 WAT 4837 122.169 8.783 140.228 1.00 0.00 H ATOM 69027 H2 WAT 4837 120.822 8.647 140.906 1.00 0.00 H TER 69029 WAT 4837 ATOM 69029 O WAT 4838 78.676 34.793 110.465 1.00 0.00 O ATOM 69030 H1 WAT 4838 78.829 33.855 110.582 1.00 0.00 H ATOM 69031 H2 WAT 4838 77.738 34.862 110.289 1.00 0.00 H TER 69033 WAT 4838 ATOM 69033 O WAT 4839 122.795 131.621 15.037 1.00 0.00 O ATOM 69034 H1 WAT 4839 122.155 132.190 14.607 1.00 0.00 H ATOM 69035 H2 WAT 4839 122.295 131.170 15.717 1.00 0.00 H TER 69037 WAT 4839 ATOM 69037 O WAT 4840 103.012 65.431 7.633 1.00 0.00 O ATOM 69038 H1 WAT 4840 102.765 66.071 8.301 1.00 0.00 H ATOM 69039 H2 WAT 4840 103.157 64.620 8.121 1.00 0.00 H TER 69041 WAT 4840 ATOM 69041 O WAT 4841 85.929 22.994 59.911 1.00 0.00 O ATOM 69042 H1 WAT 4841 86.466 23.759 60.117 1.00 0.00 H ATOM 69043 H2 WAT 4841 85.346 23.291 59.212 1.00 0.00 H TER 69045 WAT 4841 ATOM 69045 O WAT 4842 79.041 16.485 72.929 1.00 0.00 O ATOM 69046 H1 WAT 4842 78.292 15.939 72.688 1.00 0.00 H ATOM 69047 H2 WAT 4842 78.659 17.337 73.136 1.00 0.00 H TER 69049 WAT 4842 ATOM 69049 O WAT 4843 108.576 72.423 134.640 1.00 0.00 O ATOM 69050 H1 WAT 4843 107.831 71.875 134.888 1.00 0.00 H ATOM 69051 H2 WAT 4843 109.029 72.598 135.465 1.00 0.00 H TER 69053 WAT 4843 ATOM 69053 O WAT 4844 48.688 106.555 128.331 1.00 0.00 O ATOM 69054 H1 WAT 4844 48.396 107.430 128.588 1.00 0.00 H ATOM 69055 H2 WAT 4844 47.976 105.975 128.601 1.00 0.00 H TER 69057 WAT 4844 ATOM 69057 O WAT 4845 105.878 62.080 70.218 1.00 0.00 O ATOM 69058 H1 WAT 4845 106.516 62.686 69.842 1.00 0.00 H ATOM 69059 H2 WAT 4845 105.168 62.051 69.577 1.00 0.00 H TER 69061 WAT 4845 ATOM 69061 O WAT 4846 108.621 98.649 6.581 1.00 0.00 O ATOM 69062 H1 WAT 4846 108.075 97.921 6.286 1.00 0.00 H ATOM 69063 H2 WAT 4846 109.502 98.425 6.281 1.00 0.00 H TER 69065 WAT 4846 ATOM 69065 O WAT 4847 69.643 118.812 131.865 1.00 0.00 O ATOM 69066 H1 WAT 4847 68.719 118.757 132.109 1.00 0.00 H ATOM 69067 H2 WAT 4847 70.104 118.349 132.565 1.00 0.00 H TER 69069 WAT 4847 ATOM 69069 O WAT 4848 90.205 71.224 94.525 1.00 0.00 O ATOM 69070 H1 WAT 4848 89.732 70.396 94.447 1.00 0.00 H ATOM 69071 H2 WAT 4848 89.855 71.767 93.819 1.00 0.00 H TER 69073 WAT 4848 ATOM 69073 O WAT 4849 85.091 140.014 114.857 1.00 0.00 O ATOM 69074 H1 WAT 4849 85.007 140.080 115.808 1.00 0.00 H ATOM 69075 H2 WAT 4849 84.315 139.526 114.581 1.00 0.00 H TER 69077 WAT 4849 ATOM 69077 O WAT 4850 19.913 42.583 19.489 1.00 0.00 O ATOM 69078 H1 WAT 4850 20.397 42.587 18.663 1.00 0.00 H ATOM 69079 H2 WAT 4850 20.576 42.762 20.156 1.00 0.00 H TER 69081 WAT 4850 ATOM 69081 O WAT 4851 99.253 110.427 6.371 1.00 0.00 O ATOM 69082 H1 WAT 4851 98.764 111.243 6.264 1.00 0.00 H ATOM 69083 H2 WAT 4851 100.053 110.686 6.829 1.00 0.00 H TER 69085 WAT 4851 ATOM 69085 O WAT 4852 111.518 62.994 7.989 1.00 0.00 O ATOM 69086 H1 WAT 4852 111.082 62.144 8.050 1.00 0.00 H ATOM 69087 H2 WAT 4852 111.991 62.961 7.158 1.00 0.00 H TER 69089 WAT 4852 ATOM 69089 O WAT 4853 138.332 141.859 75.494 1.00 0.00 O ATOM 69090 H1 WAT 4853 139.017 141.495 74.933 1.00 0.00 H ATOM 69091 H2 WAT 4853 137.678 141.162 75.556 1.00 0.00 H TER 69093 WAT 4853 ATOM 69093 O WAT 4854 42.875 36.215 24.259 1.00 0.00 O ATOM 69094 H1 WAT 4854 42.461 35.356 24.173 1.00 0.00 H ATOM 69095 H2 WAT 4854 42.897 36.376 25.202 1.00 0.00 H TER 69097 WAT 4854 ATOM 69097 O WAT 4855 128.282 67.071 99.812 1.00 0.00 O ATOM 69098 H1 WAT 4855 129.227 67.170 99.928 1.00 0.00 H ATOM 69099 H2 WAT 4855 127.963 66.791 100.670 1.00 0.00 H TER 69101 WAT 4855 ATOM 69101 O WAT 4856 54.598 24.420 140.883 1.00 0.00 O ATOM 69102 H1 WAT 4856 54.380 25.338 140.723 1.00 0.00 H ATOM 69103 H2 WAT 4856 55.045 24.424 141.729 1.00 0.00 H TER 69105 WAT 4856 ATOM 69105 O WAT 4857 114.040 142.296 118.031 1.00 0.00 O ATOM 69106 H1 WAT 4857 113.473 141.609 118.381 1.00 0.00 H ATOM 69107 H2 WAT 4857 113.926 143.032 118.632 1.00 0.00 H TER 69109 WAT 4857 ATOM 69109 O WAT 4858 78.257 73.439 121.443 1.00 0.00 O ATOM 69110 H1 WAT 4858 77.815 73.334 122.285 1.00 0.00 H ATOM 69111 H2 WAT 4858 79.176 73.247 121.628 1.00 0.00 H TER 69113 WAT 4858 ATOM 69113 O WAT 4859 44.546 60.696 100.749 1.00 0.00 O ATOM 69114 H1 WAT 4859 43.989 60.975 100.022 1.00 0.00 H ATOM 69115 H2 WAT 4859 44.101 59.929 101.109 1.00 0.00 H TER 69117 WAT 4859 ATOM 69117 O WAT 4860 74.164 127.638 81.195 1.00 0.00 O ATOM 69118 H1 WAT 4860 73.725 128.455 80.956 1.00 0.00 H ATOM 69119 H2 WAT 4860 74.909 127.582 80.596 1.00 0.00 H TER 69121 WAT 4860 ATOM 69121 O WAT 4861 71.863 131.166 88.584 1.00 0.00 O ATOM 69122 H1 WAT 4861 72.007 130.593 89.337 1.00 0.00 H ATOM 69123 H2 WAT 4861 71.082 130.812 88.159 1.00 0.00 H TER 69125 WAT 4861 ATOM 69125 O WAT 4862 21.045 18.799 144.756 1.00 0.00 O ATOM 69126 H1 WAT 4862 20.496 18.338 145.390 1.00 0.00 H ATOM 69127 H2 WAT 4862 21.817 19.065 145.256 1.00 0.00 H TER 69129 WAT 4862 ATOM 69129 O WAT 4863 134.402 117.232 5.584 1.00 0.00 O ATOM 69130 H1 WAT 4863 133.774 116.966 4.912 1.00 0.00 H ATOM 69131 H2 WAT 4863 134.626 118.135 5.359 1.00 0.00 H TER 69133 WAT 4863 ATOM 69133 O WAT 4864 28.834 8.126 132.043 1.00 0.00 O ATOM 69134 H1 WAT 4864 28.571 8.513 132.878 1.00 0.00 H ATOM 69135 H2 WAT 4864 29.601 8.633 131.775 1.00 0.00 H TER 69137 WAT 4864 ATOM 69137 O WAT 4865 37.492 7.523 104.520 1.00 0.00 O ATOM 69138 H1 WAT 4865 38.092 7.231 103.834 1.00 0.00 H ATOM 69139 H2 WAT 4865 36.986 8.225 104.113 1.00 0.00 H TER 69141 WAT 4865 ATOM 69141 O WAT 4866 38.101 136.337 77.322 1.00 0.00 O ATOM 69142 H1 WAT 4866 37.347 136.841 77.626 1.00 0.00 H ATOM 69143 H2 WAT 4866 38.378 136.779 76.520 1.00 0.00 H TER 69145 WAT 4866 ATOM 69145 O WAT 4867 106.583 143.915 15.352 1.00 0.00 O ATOM 69146 H1 WAT 4867 106.079 144.722 15.244 1.00 0.00 H ATOM 69147 H2 WAT 4867 106.408 143.641 16.252 1.00 0.00 H TER 69149 WAT 4867 ATOM 69149 O WAT 4868 58.896 69.278 149.236 1.00 0.00 O ATOM 69150 H1 WAT 4868 59.053 70.194 149.464 1.00 0.00 H ATOM 69151 H2 WAT 4868 58.445 68.915 149.999 1.00 0.00 H TER 69153 WAT 4868 ATOM 69153 O WAT 4869 71.353 81.673 65.745 1.00 0.00 O ATOM 69154 H1 WAT 4869 70.684 81.895 65.098 1.00 0.00 H ATOM 69155 H2 WAT 4869 72.030 82.340 65.628 1.00 0.00 H TER 69157 WAT 4869 ATOM 69157 O WAT 4870 120.163 46.521 85.291 1.00 0.00 O ATOM 69158 H1 WAT 4870 120.906 46.935 84.852 1.00 0.00 H ATOM 69159 H2 WAT 4870 119.397 46.990 84.960 1.00 0.00 H TER 69161 WAT 4870 ATOM 69161 O WAT 4871 59.320 28.308 131.926 1.00 0.00 O ATOM 69162 H1 WAT 4871 59.970 27.612 131.826 1.00 0.00 H ATOM 69163 H2 WAT 4871 59.418 28.842 131.137 1.00 0.00 H TER 69165 WAT 4871 ATOM 69165 O WAT 4872 62.180 76.270 108.721 1.00 0.00 O ATOM 69166 H1 WAT 4872 62.698 76.149 109.517 1.00 0.00 H ATOM 69167 H2 WAT 4872 62.289 75.450 108.239 1.00 0.00 H TER 69169 WAT 4872 ATOM 69169 O WAT 4873 15.976 131.993 68.989 1.00 0.00 O ATOM 69170 H1 WAT 4873 15.522 132.560 69.613 1.00 0.00 H ATOM 69171 H2 WAT 4873 15.906 132.453 68.153 1.00 0.00 H TER 69173 WAT 4873 ATOM 69173 O WAT 4874 117.019 85.792 123.986 1.00 0.00 O ATOM 69174 H1 WAT 4874 116.123 85.478 123.861 1.00 0.00 H ATOM 69175 H2 WAT 4874 117.263 86.163 123.138 1.00 0.00 H TER 69177 WAT 4874 ATOM 69177 O WAT 4875 116.281 17.258 69.297 1.00 0.00 O ATOM 69178 H1 WAT 4875 116.007 16.412 68.943 1.00 0.00 H ATOM 69179 H2 WAT 4875 116.072 17.207 70.230 1.00 0.00 H TER 69181 WAT 4875 ATOM 69181 O WAT 4876 119.264 123.729 138.556 1.00 0.00 O ATOM 69182 H1 WAT 4876 118.687 124.466 138.756 1.00 0.00 H ATOM 69183 H2 WAT 4876 119.287 123.218 139.365 1.00 0.00 H TER 69185 WAT 4876 ATOM 69185 O WAT 4877 70.164 52.855 10.652 1.00 0.00 O ATOM 69186 H1 WAT 4877 70.248 53.395 9.866 1.00 0.00 H ATOM 69187 H2 WAT 4877 70.816 53.208 11.257 1.00 0.00 H TER 69189 WAT 4877 ATOM 69189 O WAT 4878 128.040 102.802 26.843 1.00 0.00 O ATOM 69190 H1 WAT 4878 128.148 103.735 27.028 1.00 0.00 H ATOM 69191 H2 WAT 4878 127.624 102.776 25.981 1.00 0.00 H TER 69193 WAT 4878 ATOM 69193 O WAT 4879 126.829 105.616 122.637 1.00 0.00 O ATOM 69194 H1 WAT 4879 127.576 105.167 122.242 1.00 0.00 H ATOM 69195 H2 WAT 4879 127.219 106.214 123.275 1.00 0.00 H TER 69197 WAT 4879 ATOM 69197 O WAT 4880 115.499 38.533 65.574 1.00 0.00 O ATOM 69198 H1 WAT 4880 115.070 39.387 65.613 1.00 0.00 H ATOM 69199 H2 WAT 4880 116.357 38.677 65.971 1.00 0.00 H TER 69201 WAT 4880 ATOM 69201 O WAT 4881 135.849 55.097 107.902 1.00 0.00 O ATOM 69202 H1 WAT 4881 135.918 55.991 107.567 1.00 0.00 H ATOM 69203 H2 WAT 4881 135.210 54.675 107.327 1.00 0.00 H TER 69205 WAT 4881 ATOM 69205 O WAT 4882 85.662 4.266 88.255 1.00 0.00 O ATOM 69206 H1 WAT 4882 84.908 4.610 87.775 1.00 0.00 H ATOM 69207 H2 WAT 4882 85.391 3.391 88.533 1.00 0.00 H TER 69209 WAT 4882 ATOM 69209 O WAT 4883 86.040 16.052 7.050 1.00 0.00 O ATOM 69210 H1 WAT 4883 86.641 15.675 7.693 1.00 0.00 H ATOM 69211 H2 WAT 4883 85.480 15.322 6.789 1.00 0.00 H TER 69213 WAT 4883 ATOM 69213 O WAT 4884 135.719 8.696 19.723 1.00 0.00 O ATOM 69214 H1 WAT 4884 134.831 8.865 20.038 1.00 0.00 H ATOM 69215 H2 WAT 4884 135.599 8.128 18.962 1.00 0.00 H TER 69217 WAT 4884 ATOM 69217 O WAT 4885 0.449 67.741 96.360 1.00 0.00 O ATOM 69218 H1 WAT 4885 -0.442 68.073 96.470 1.00 0.00 H ATOM 69219 H2 WAT 4885 0.586 67.735 95.413 1.00 0.00 H TER 69221 WAT 4885 ATOM 69221 O WAT 4886 6.012 140.485 5.743 1.00 0.00 O ATOM 69222 H1 WAT 4886 6.404 141.185 5.221 1.00 0.00 H ATOM 69223 H2 WAT 4886 6.557 139.719 5.564 1.00 0.00 H TER 69225 WAT 4886 ATOM 69225 O WAT 4887 19.330 56.032 78.752 1.00 0.00 O ATOM 69226 H1 WAT 4887 18.644 56.053 79.419 1.00 0.00 H ATOM 69227 H2 WAT 4887 19.020 55.392 78.110 1.00 0.00 H TER 69229 WAT 4887 ATOM 69229 O WAT 4888 131.834 10.509 12.001 1.00 0.00 O ATOM 69230 H1 WAT 4888 131.798 9.590 11.733 1.00 0.00 H ATOM 69231 H2 WAT 4888 131.345 10.976 11.324 1.00 0.00 H TER 69233 WAT 4888 ATOM 69233 O WAT 4889 32.269 96.863 89.687 1.00 0.00 O ATOM 69234 H1 WAT 4889 31.791 96.309 89.069 1.00 0.00 H ATOM 69235 H2 WAT 4889 32.824 96.255 90.175 1.00 0.00 H TER 69237 WAT 4889 ATOM 69237 O WAT 4890 54.098 39.568 147.787 1.00 0.00 O ATOM 69238 H1 WAT 4890 54.469 39.929 146.981 1.00 0.00 H ATOM 69239 H2 WAT 4890 53.191 39.362 147.562 1.00 0.00 H TER 69241 WAT 4890 ATOM 69241 O WAT 4891 14.834 81.923 81.261 1.00 0.00 O ATOM 69242 H1 WAT 4891 14.670 81.172 80.691 1.00 0.00 H ATOM 69243 H2 WAT 4891 14.487 82.672 80.777 1.00 0.00 H TER 69245 WAT 4891 ATOM 69245 O WAT 4892 80.204 121.116 60.928 1.00 0.00 O ATOM 69246 H1 WAT 4892 81.038 120.928 61.358 1.00 0.00 H ATOM 69247 H2 WAT 4892 80.010 122.022 61.167 1.00 0.00 H TER 69249 WAT 4892 ATOM 69249 O WAT 4893 91.422 112.763 78.125 1.00 0.00 O ATOM 69250 H1 WAT 4893 91.513 112.185 78.883 1.00 0.00 H ATOM 69251 H2 WAT 4893 90.663 112.421 77.653 1.00 0.00 H TER 69253 WAT 4893 ATOM 69253 O WAT 4894 43.693 21.640 89.373 1.00 0.00 O ATOM 69254 H1 WAT 4894 43.935 22.562 89.290 1.00 0.00 H ATOM 69255 H2 WAT 4894 44.173 21.334 90.143 1.00 0.00 H TER 69257 WAT 4894 ATOM 69257 O WAT 4895 0.259 111.855 145.098 1.00 0.00 O ATOM 69258 H1 WAT 4895 -0.695 111.802 145.030 1.00 0.00 H ATOM 69259 H2 WAT 4895 0.459 112.777 144.938 1.00 0.00 H TER 69261 WAT 4895 ATOM 69261 O WAT 4896 140.609 16.849 117.551 1.00 0.00 O ATOM 69262 H1 WAT 4896 140.479 17.324 116.731 1.00 0.00 H ATOM 69263 H2 WAT 4896 141.142 17.437 118.087 1.00 0.00 H TER 69265 WAT 4896 ATOM 69265 O WAT 4897 134.124 133.125 148.788 1.00 0.00 O ATOM 69266 H1 WAT 4897 133.284 132.853 148.418 1.00 0.00 H ATOM 69267 H2 WAT 4897 133.891 133.621 149.573 1.00 0.00 H TER 69269 WAT 4897 ATOM 69269 O WAT 4898 20.106 21.896 62.098 1.00 0.00 O ATOM 69270 H1 WAT 4898 19.189 21.837 61.832 1.00 0.00 H ATOM 69271 H2 WAT 4898 20.443 21.006 61.997 1.00 0.00 H TER 69273 WAT 4898 ATOM 69273 O WAT 4899 48.102 88.409 110.578 1.00 0.00 O ATOM 69274 H1 WAT 4899 48.453 88.935 111.297 1.00 0.00 H ATOM 69275 H2 WAT 4899 48.047 89.017 109.841 1.00 0.00 H TER 69277 WAT 4899 ATOM 69277 O WAT 4900 37.378 64.678 107.462 1.00 0.00 O ATOM 69278 H1 WAT 4900 37.460 65.126 106.620 1.00 0.00 H ATOM 69279 H2 WAT 4900 36.711 65.178 107.934 1.00 0.00 H TER 69281 WAT 4900 ATOM 69281 O WAT 4901 32.976 46.225 117.361 1.00 0.00 O ATOM 69282 H1 WAT 4901 33.038 47.174 117.467 1.00 0.00 H ATOM 69283 H2 WAT 4901 33.655 45.875 117.938 1.00 0.00 H TER 69285 WAT 4901 ATOM 69285 O WAT 4902 111.071 111.304 72.717 1.00 0.00 O ATOM 69286 H1 WAT 4902 111.050 112.229 72.962 1.00 0.00 H ATOM 69287 H2 WAT 4902 111.909 110.986 73.052 1.00 0.00 H TER 69289 WAT 4902 ATOM 69289 O WAT 4903 81.704 71.487 139.681 1.00 0.00 O ATOM 69290 H1 WAT 4903 82.550 71.934 139.726 1.00 0.00 H ATOM 69291 H2 WAT 4903 81.856 70.745 139.096 1.00 0.00 H TER 69293 WAT 4903 ATOM 69293 O WAT 4904 132.824 114.971 3.840 1.00 0.00 O ATOM 69294 H1 WAT 4904 133.650 114.792 4.291 1.00 0.00 H ATOM 69295 H2 WAT 4904 132.152 114.626 4.428 1.00 0.00 H TER 69297 WAT 4904 ATOM 69297 O WAT 4905 46.174 79.894 79.187 1.00 0.00 O ATOM 69298 H1 WAT 4905 46.490 80.173 78.328 1.00 0.00 H ATOM 69299 H2 WAT 4905 45.239 80.095 79.176 1.00 0.00 H TER 69301 WAT 4905 ATOM 69301 O WAT 4906 126.016 47.630 119.263 1.00 0.00 O ATOM 69302 H1 WAT 4906 125.269 47.879 119.806 1.00 0.00 H ATOM 69303 H2 WAT 4906 126.762 48.081 119.661 1.00 0.00 H TER 69305 WAT 4906 ATOM 69305 O WAT 4907 16.468 48.307 145.972 1.00 0.00 O ATOM 69306 H1 WAT 4907 15.691 48.855 145.861 1.00 0.00 H ATOM 69307 H2 WAT 4907 16.467 47.732 145.206 1.00 0.00 H TER 69309 WAT 4907 ATOM 69309 O WAT 4908 39.636 28.964 134.415 1.00 0.00 O ATOM 69310 H1 WAT 4908 38.776 28.561 134.534 1.00 0.00 H ATOM 69311 H2 WAT 4908 40.152 28.297 133.962 1.00 0.00 H TER 69313 WAT 4908 ATOM 69313 O WAT 4909 67.771 56.427 112.360 1.00 0.00 O ATOM 69314 H1 WAT 4909 68.603 56.044 112.637 1.00 0.00 H ATOM 69315 H2 WAT 4909 67.801 57.326 112.687 1.00 0.00 H TER 69317 WAT 4909 ATOM 69317 O WAT 4910 128.624 49.895 155.858 1.00 0.00 O ATOM 69318 H1 WAT 4910 129.546 49.747 155.647 1.00 0.00 H ATOM 69319 H2 WAT 4910 128.202 50.022 155.009 1.00 0.00 H TER 69321 WAT 4910 ATOM 69321 O WAT 4911 82.327 65.765 146.274 1.00 0.00 O ATOM 69322 H1 WAT 4911 82.251 66.027 147.192 1.00 0.00 H ATOM 69323 H2 WAT 4911 81.434 65.818 145.935 1.00 0.00 H TER 69325 WAT 4911 ATOM 69325 O WAT 4912 1.709 9.851 133.425 1.00 0.00 O ATOM 69326 H1 WAT 4912 1.946 9.338 134.197 1.00 0.00 H ATOM 69327 H2 WAT 4912 2.451 9.746 132.831 1.00 0.00 H TER 69329 WAT 4912 ATOM 69329 O WAT 4913 104.231 6.661 75.359 1.00 0.00 O ATOM 69330 H1 WAT 4913 104.643 6.016 74.784 1.00 0.00 H ATOM 69331 H2 WAT 4913 104.512 6.409 76.239 1.00 0.00 H TER 69333 WAT 4913 ATOM 69333 O WAT 4914 24.871 25.603 107.982 1.00 0.00 O ATOM 69334 H1 WAT 4914 25.123 25.102 107.207 1.00 0.00 H ATOM 69335 H2 WAT 4914 24.752 24.944 108.666 1.00 0.00 H TER 69337 WAT 4914 ATOM 69337 O WAT 4915 15.429 59.981 107.616 1.00 0.00 O ATOM 69338 H1 WAT 4915 15.958 59.227 107.354 1.00 0.00 H ATOM 69339 H2 WAT 4915 14.605 59.872 107.140 1.00 0.00 H TER 69341 WAT 4915 ATOM 69341 O WAT 4916 124.765 106.679 121.094 1.00 0.00 O ATOM 69342 H1 WAT 4916 125.465 106.381 121.675 1.00 0.00 H ATOM 69343 H2 WAT 4916 123.959 106.398 121.528 1.00 0.00 H TER 69345 WAT 4916 ATOM 69345 O WAT 4917 143.224 106.532 94.947 1.00 0.00 O ATOM 69346 H1 WAT 4917 142.573 106.219 95.574 1.00 0.00 H ATOM 69347 H2 WAT 4917 143.931 105.888 94.994 1.00 0.00 H TER 69349 WAT 4917 ATOM 69349 O WAT 4918 103.190 108.589 148.119 1.00 0.00 O ATOM 69350 H1 WAT 4918 103.078 108.444 147.179 1.00 0.00 H ATOM 69351 H2 WAT 4918 103.492 107.745 148.456 1.00 0.00 H TER 69353 WAT 4918 ATOM 69353 O WAT 4919 76.310 80.198 119.147 1.00 0.00 O ATOM 69354 H1 WAT 4919 76.916 79.464 119.039 1.00 0.00 H ATOM 69355 H2 WAT 4919 76.525 80.794 118.430 1.00 0.00 H TER 69357 WAT 4919 ATOM 69357 O WAT 4920 106.918 117.053 87.782 1.00 0.00 O ATOM 69358 H1 WAT 4920 107.701 117.559 87.567 1.00 0.00 H ATOM 69359 H2 WAT 4920 106.739 117.266 88.698 1.00 0.00 H TER 69361 WAT 4920 ATOM 69361 O WAT 4921 92.148 66.995 105.015 1.00 0.00 O ATOM 69362 H1 WAT 4921 92.029 67.926 105.205 1.00 0.00 H ATOM 69363 H2 WAT 4921 91.352 66.744 104.545 1.00 0.00 H TER 69365 WAT 4921 ATOM 69365 O WAT 4922 66.077 142.815 65.997 1.00 0.00 O ATOM 69366 H1 WAT 4922 66.576 143.206 65.280 1.00 0.00 H ATOM 69367 H2 WAT 4922 65.746 141.992 65.638 1.00 0.00 H TER 69369 WAT 4922 ATOM 69369 O WAT 4923 5.951 129.727 8.703 1.00 0.00 O ATOM 69370 H1 WAT 4923 5.366 130.022 9.401 1.00 0.00 H ATOM 69371 H2 WAT 4923 5.409 129.149 8.166 1.00 0.00 H TER 69373 WAT 4923 ATOM 69373 O WAT 4924 48.608 66.344 158.331 1.00 0.00 O ATOM 69374 H1 WAT 4924 49.104 67.160 158.272 1.00 0.00 H ATOM 69375 H2 WAT 4924 49.128 65.790 158.914 1.00 0.00 H TER 69377 WAT 4924 ATOM 69377 O WAT 4925 19.132 34.860 151.483 1.00 0.00 O ATOM 69378 H1 WAT 4925 19.554 35.416 150.828 1.00 0.00 H ATOM 69379 H2 WAT 4925 19.853 34.374 151.884 1.00 0.00 H TER 69381 WAT 4925 ATOM 69381 O WAT 4926 102.508 1.501 150.395 1.00 0.00 O ATOM 69382 H1 WAT 4926 103.088 2.249 150.254 1.00 0.00 H ATOM 69383 H2 WAT 4926 102.158 1.303 149.526 1.00 0.00 H TER 69385 WAT 4926 ATOM 69385 O WAT 4927 113.205 35.971 93.247 1.00 0.00 O ATOM 69386 H1 WAT 4927 113.683 35.294 92.769 1.00 0.00 H ATOM 69387 H2 WAT 4927 112.310 35.914 92.914 1.00 0.00 H TER 69389 WAT 4927 ATOM 69389 O WAT 4928 6.191 68.123 71.923 1.00 0.00 O ATOM 69390 H1 WAT 4928 5.552 68.569 71.367 1.00 0.00 H ATOM 69391 H2 WAT 4928 6.370 68.745 72.628 1.00 0.00 H TER 69393 WAT 4928 ATOM 69393 O WAT 4929 119.128 120.549 24.096 1.00 0.00 O ATOM 69394 H1 WAT 4929 118.460 120.989 24.622 1.00 0.00 H ATOM 69395 H2 WAT 4929 118.706 119.742 23.800 1.00 0.00 H TER 69397 WAT 4929 ATOM 69397 O WAT 4930 2.435 48.535 93.418 1.00 0.00 O ATOM 69398 H1 WAT 4930 2.873 48.567 94.269 1.00 0.00 H ATOM 69399 H2 WAT 4930 1.899 49.328 93.395 1.00 0.00 H TER 69401 WAT 4930 ATOM 69401 O WAT 4931 107.090 63.156 81.622 1.00 0.00 O ATOM 69402 H1 WAT 4931 106.882 64.065 81.839 1.00 0.00 H ATOM 69403 H2 WAT 4931 107.989 63.189 81.293 1.00 0.00 H TER 69405 WAT 4931 ATOM 69405 O WAT 4932 1.307 49.979 115.888 1.00 0.00 O ATOM 69406 H1 WAT 4932 0.911 49.387 116.528 1.00 0.00 H ATOM 69407 H2 WAT 4932 2.232 50.012 116.132 1.00 0.00 H TER 69409 WAT 4932 ATOM 69409 O WAT 4933 67.496 117.820 74.232 1.00 0.00 O ATOM 69410 H1 WAT 4933 67.284 118.197 75.085 1.00 0.00 H ATOM 69411 H2 WAT 4933 67.597 116.884 74.402 1.00 0.00 H TER 69413 WAT 4933 ATOM 69413 O WAT 4934 55.088 11.277 79.641 1.00 0.00 O ATOM 69414 H1 WAT 4934 55.472 11.608 80.453 1.00 0.00 H ATOM 69415 H2 WAT 4934 54.182 11.072 79.871 1.00 0.00 H TER 69417 WAT 4934 ATOM 69417 O WAT 4935 67.748 118.266 114.868 1.00 0.00 O ATOM 69418 H1 WAT 4935 67.434 118.222 115.772 1.00 0.00 H ATOM 69419 H2 WAT 4935 68.149 119.132 114.796 1.00 0.00 H TER 69421 WAT 4935 ATOM 69421 O WAT 4936 81.437 119.175 109.783 1.00 0.00 O ATOM 69422 H1 WAT 4936 81.761 119.791 110.441 1.00 0.00 H ATOM 69423 H2 WAT 4936 80.494 119.340 109.746 1.00 0.00 H TER 69425 WAT 4936 ATOM 69425 O WAT 4937 76.694 32.782 101.908 1.00 0.00 O ATOM 69426 H1 WAT 4937 77.568 32.532 101.609 1.00 0.00 H ATOM 69427 H2 WAT 4937 76.776 33.706 102.142 1.00 0.00 H TER 69429 WAT 4937 ATOM 69429 O WAT 4938 99.985 110.397 77.151 1.00 0.00 O ATOM 69430 H1 WAT 4938 99.781 110.766 76.291 1.00 0.00 H ATOM 69431 H2 WAT 4938 100.143 111.159 77.707 1.00 0.00 H TER 69433 WAT 4938 ATOM 69433 O WAT 4939 31.970 92.646 72.207 1.00 0.00 O ATOM 69434 H1 WAT 4939 31.169 92.210 71.916 1.00 0.00 H ATOM 69435 H2 WAT 4939 31.995 93.460 71.704 1.00 0.00 H TER 69437 WAT 4939 ATOM 69437 O WAT 4940 136.533 57.015 115.296 1.00 0.00 O ATOM 69438 H1 WAT 4940 136.152 56.207 115.640 1.00 0.00 H ATOM 69439 H2 WAT 4940 136.136 57.710 115.821 1.00 0.00 H TER 69441 WAT 4940 ATOM 69441 O WAT 4941 31.893 76.093 75.088 1.00 0.00 O ATOM 69442 H1 WAT 4941 31.797 76.599 75.895 1.00 0.00 H ATOM 69443 H2 WAT 4941 32.754 76.342 74.750 1.00 0.00 H TER 69445 WAT 4941 ATOM 69445 O WAT 4942 40.754 108.408 60.836 1.00 0.00 O ATOM 69446 H1 WAT 4942 41.663 108.461 61.131 1.00 0.00 H ATOM 69447 H2 WAT 4942 40.390 109.272 61.026 1.00 0.00 H TER 69449 WAT 4942 ATOM 69449 O WAT 4943 4.873 53.841 97.874 1.00 0.00 O ATOM 69450 H1 WAT 4943 5.062 54.683 98.289 1.00 0.00 H ATOM 69451 H2 WAT 4943 5.310 53.197 98.430 1.00 0.00 H TER 69453 WAT 4943 ATOM 69453 O WAT 4944 133.401 96.415 3.061 1.00 0.00 O ATOM 69454 H1 WAT 4944 133.955 96.517 3.836 1.00 0.00 H ATOM 69455 H2 WAT 4944 133.270 97.308 2.741 1.00 0.00 H TER 69457 WAT 4944 ATOM 69457 O WAT 4945 6.366 98.976 71.449 1.00 0.00 O ATOM 69458 H1 WAT 4945 5.908 98.318 70.927 1.00 0.00 H ATOM 69459 H2 WAT 4945 7.129 99.212 70.921 1.00 0.00 H TER 69461 WAT 4945 ATOM 69461 O WAT 4946 52.236 137.960 18.484 1.00 0.00 O ATOM 69462 H1 WAT 4946 52.849 137.371 18.923 1.00 0.00 H ATOM 69463 H2 WAT 4946 51.996 138.600 19.155 1.00 0.00 H TER 69465 WAT 4946 ATOM 69465 O WAT 4947 64.808 121.366 154.805 1.00 0.00 O ATOM 69466 H1 WAT 4947 63.998 121.031 155.190 1.00 0.00 H ATOM 69467 H2 WAT 4947 64.564 122.214 154.436 1.00 0.00 H TER 69469 WAT 4947 ATOM 69469 O WAT 4948 110.072 102.663 26.363 1.00 0.00 O ATOM 69470 H1 WAT 4948 109.644 103.520 26.371 1.00 0.00 H ATOM 69471 H2 WAT 4948 109.482 102.097 26.861 1.00 0.00 H TER 69473 WAT 4948 ATOM 69473 O WAT 4949 47.835 41.365 131.113 1.00 0.00 O ATOM 69474 H1 WAT 4949 46.981 41.080 131.438 1.00 0.00 H ATOM 69475 H2 WAT 4949 47.644 41.777 130.270 1.00 0.00 H TER 69477 WAT 4949 ATOM 69477 O WAT 4950 86.926 26.950 111.779 1.00 0.00 O ATOM 69478 H1 WAT 4950 86.141 27.441 112.019 1.00 0.00 H ATOM 69479 H2 WAT 4950 87.625 27.346 112.299 1.00 0.00 H TER 69481 WAT 4950 ATOM 69481 O WAT 4951 125.256 18.359 93.348 1.00 0.00 O ATOM 69482 H1 WAT 4951 126.107 18.796 93.307 1.00 0.00 H ATOM 69483 H2 WAT 4951 124.696 18.869 92.762 1.00 0.00 H TER 69485 WAT 4951 ATOM 69485 O WAT 4952 117.952 143.133 156.099 1.00 0.00 O ATOM 69486 H1 WAT 4952 118.115 143.431 156.994 1.00 0.00 H ATOM 69487 H2 WAT 4952 118.144 143.896 155.554 1.00 0.00 H TER 69489 WAT 4952 ATOM 69489 O WAT 4953 8.409 110.168 124.469 1.00 0.00 O ATOM 69490 H1 WAT 4953 7.843 109.832 125.164 1.00 0.00 H ATOM 69491 H2 WAT 4953 8.867 109.395 124.138 1.00 0.00 H TER 69493 WAT 4953 ATOM 69493 O WAT 4954 142.715 2.944 16.686 1.00 0.00 O ATOM 69494 H1 WAT 4954 143.186 2.239 17.129 1.00 0.00 H ATOM 69495 H2 WAT 4954 142.714 3.664 17.317 1.00 0.00 H TER 69497 WAT 4954 ATOM 69497 O WAT 4955 111.600 45.458 57.954 1.00 0.00 O ATOM 69498 H1 WAT 4955 112.487 45.473 57.595 1.00 0.00 H ATOM 69499 H2 WAT 4955 111.677 45.896 58.802 1.00 0.00 H TER 69501 WAT 4955 ATOM 69501 O WAT 4956 108.805 131.678 123.610 1.00 0.00 O ATOM 69502 H1 WAT 4956 109.379 131.075 123.137 1.00 0.00 H ATOM 69503 H2 WAT 4956 109.182 132.543 123.448 1.00 0.00 H TER 69505 WAT 4956 ATOM 69505 O WAT 4957 101.629 13.667 76.386 1.00 0.00 O ATOM 69506 H1 WAT 4957 102.362 13.822 76.981 1.00 0.00 H ATOM 69507 H2 WAT 4957 101.805 14.233 75.635 1.00 0.00 H TER 69509 WAT 4957 ATOM 69509 O WAT 4958 78.550 136.554 98.472 1.00 0.00 O ATOM 69510 H1 WAT 4958 78.593 135.693 98.056 1.00 0.00 H ATOM 69511 H2 WAT 4958 79.388 136.964 98.261 1.00 0.00 H TER 69513 WAT 4958 ATOM 69513 O WAT 4959 124.420 80.666 3.111 1.00 0.00 O ATOM 69514 H1 WAT 4959 124.260 81.593 2.938 1.00 0.00 H ATOM 69515 H2 WAT 4959 123.990 80.209 2.389 1.00 0.00 H TER 69517 WAT 4959 ATOM 69517 O WAT 4960 5.289 112.837 68.641 1.00 0.00 O ATOM 69518 H1 WAT 4960 5.983 113.484 68.514 1.00 0.00 H ATOM 69519 H2 WAT 4960 4.545 113.345 68.965 1.00 0.00 H TER 69521 WAT 4960 ATOM 69521 O WAT 4961 86.627 48.435 128.460 1.00 0.00 O ATOM 69522 H1 WAT 4961 86.300 49.331 128.377 1.00 0.00 H ATOM 69523 H2 WAT 4961 87.451 48.435 127.973 1.00 0.00 H TER 69525 WAT 4961 ATOM 69525 O WAT 4962 26.463 70.576 80.862 1.00 0.00 O ATOM 69526 H1 WAT 4962 26.774 69.879 81.440 1.00 0.00 H ATOM 69527 H2 WAT 4962 26.519 70.201 79.983 1.00 0.00 H TER 69529 WAT 4962 ATOM 69529 O WAT 4963 96.589 124.151 157.363 1.00 0.00 O ATOM 69530 H1 WAT 4963 96.101 123.825 158.120 1.00 0.00 H ATOM 69531 H2 WAT 4963 96.622 125.099 157.490 1.00 0.00 H TER 69533 WAT 4963 ATOM 69533 O WAT 4964 105.167 61.646 63.584 1.00 0.00 O ATOM 69534 H1 WAT 4964 106.089 61.388 63.605 1.00 0.00 H ATOM 69535 H2 WAT 4964 105.186 62.582 63.383 1.00 0.00 H TER 69537 WAT 4964 ATOM 69537 O WAT 4965 109.242 3.361 68.714 1.00 0.00 O ATOM 69538 H1 WAT 4965 109.994 3.742 68.259 1.00 0.00 H ATOM 69539 H2 WAT 4965 109.196 2.462 68.388 1.00 0.00 H TER 69541 WAT 4965 ATOM 69541 O WAT 4966 68.488 37.599 118.850 1.00 0.00 O ATOM 69542 H1 WAT 4966 68.507 38.362 119.427 1.00 0.00 H ATOM 69543 H2 WAT 4966 67.643 37.655 118.404 1.00 0.00 H TER 69545 WAT 4966 ATOM 69545 O WAT 4967 70.403 113.133 86.145 1.00 0.00 O ATOM 69546 H1 WAT 4967 70.727 114.008 85.931 1.00 0.00 H ATOM 69547 H2 WAT 4967 70.981 112.828 86.845 1.00 0.00 H TER 69549 WAT 4967 ATOM 69549 O WAT 4968 83.474 18.747 125.769 1.00 0.00 O ATOM 69550 H1 WAT 4968 83.691 19.656 125.564 1.00 0.00 H ATOM 69551 H2 WAT 4968 83.653 18.269 124.959 1.00 0.00 H TER 69553 WAT 4968 ATOM 69553 O WAT 4969 93.039 39.005 105.402 1.00 0.00 O ATOM 69554 H1 WAT 4969 92.139 39.316 105.300 1.00 0.00 H ATOM 69555 H2 WAT 4969 93.203 39.051 106.344 1.00 0.00 H TER 69557 WAT 4969 ATOM 69557 O WAT 4970 59.942 9.613 153.924 1.00 0.00 O ATOM 69558 H1 WAT 4970 59.370 10.206 154.411 1.00 0.00 H ATOM 69559 H2 WAT 4970 60.083 8.876 154.517 1.00 0.00 H TER 69561 WAT 4970 ATOM 69561 O WAT 4971 136.044 70.653 110.965 1.00 0.00 O ATOM 69562 H1 WAT 4971 135.949 70.995 111.854 1.00 0.00 H ATOM 69563 H2 WAT 4971 135.299 71.019 110.487 1.00 0.00 H TER 69565 WAT 4971 ATOM 69565 O WAT 4972 41.878 93.942 0.405 1.00 0.00 O ATOM 69566 H1 WAT 4972 41.282 93.425 -0.137 1.00 0.00 H ATOM 69567 H2 WAT 4972 41.891 94.805 -0.008 1.00 0.00 H TER 69569 WAT 4972 ATOM 69569 O WAT 4973 138.588 52.237 116.479 1.00 0.00 O ATOM 69570 H1 WAT 4973 139.214 52.760 115.978 1.00 0.00 H ATOM 69571 H2 WAT 4973 138.353 51.518 115.893 1.00 0.00 H TER 69573 WAT 4973 ATOM 69573 O WAT 4974 66.502 17.173 49.955 1.00 0.00 O ATOM 69574 H1 WAT 4974 66.573 16.468 50.599 1.00 0.00 H ATOM 69575 H2 WAT 4974 66.030 16.780 49.221 1.00 0.00 H TER 69577 WAT 4974 ATOM 69577 O WAT 4975 32.807 52.924 153.217 1.00 0.00 O ATOM 69578 H1 WAT 4975 32.431 53.657 153.704 1.00 0.00 H ATOM 69579 H2 WAT 4975 32.074 52.569 152.714 1.00 0.00 H TER 69581 WAT 4975 ATOM 69581 O WAT 4976 104.362 6.472 134.914 1.00 0.00 O ATOM 69582 H1 WAT 4976 103.762 5.933 134.400 1.00 0.00 H ATOM 69583 H2 WAT 4976 104.845 5.846 135.453 1.00 0.00 H TER 69585 WAT 4976 ATOM 69585 O WAT 4977 28.688 114.564 117.050 1.00 0.00 O ATOM 69586 H1 WAT 4977 28.439 115.333 116.537 1.00 0.00 H ATOM 69587 H2 WAT 4977 28.822 114.901 117.936 1.00 0.00 H TER 69589 WAT 4977 ATOM 69589 O WAT 4978 93.134 133.367 96.642 1.00 0.00 O ATOM 69590 H1 WAT 4978 92.348 133.682 96.196 1.00 0.00 H ATOM 69591 H2 WAT 4978 92.969 133.540 97.569 1.00 0.00 H TER 69593 WAT 4978 ATOM 69593 O WAT 4979 28.631 77.375 105.036 1.00 0.00 O ATOM 69594 H1 WAT 4979 27.832 77.901 105.051 1.00 0.00 H ATOM 69595 H2 WAT 4979 28.494 76.751 104.323 1.00 0.00 H TER 69597 WAT 4979 ATOM 69597 O WAT 4980 105.460 55.398 123.842 1.00 0.00 O ATOM 69598 H1 WAT 4980 105.636 54.581 124.309 1.00 0.00 H ATOM 69599 H2 WAT 4980 106.226 55.523 123.282 1.00 0.00 H TER 69601 WAT 4980 ATOM 69601 O WAT 4981 114.078 99.575 115.508 1.00 0.00 O ATOM 69602 H1 WAT 4981 114.050 99.539 116.464 1.00 0.00 H ATOM 69603 H2 WAT 4981 113.158 99.596 115.242 1.00 0.00 H TER 69605 WAT 4981 ATOM 69605 O WAT 4982 112.963 17.116 109.949 1.00 0.00 O ATOM 69606 H1 WAT 4982 112.700 16.206 110.092 1.00 0.00 H ATOM 69607 H2 WAT 4982 113.920 17.091 109.946 1.00 0.00 H TER 69609 WAT 4982 ATOM 69609 O WAT 4983 142.912 110.699 85.358 1.00 0.00 O ATOM 69610 H1 WAT 4983 142.178 110.346 84.855 1.00 0.00 H ATOM 69611 H2 WAT 4983 142.589 110.737 86.258 1.00 0.00 H TER 69613 WAT 4983 ATOM 69613 O WAT 4984 129.584 83.304 79.544 1.00 0.00 O ATOM 69614 H1 WAT 4984 129.107 82.604 79.991 1.00 0.00 H ATOM 69615 H2 WAT 4984 129.723 82.970 78.658 1.00 0.00 H TER 69617 WAT 4984 ATOM 69617 O WAT 4985 9.058 45.380 94.277 1.00 0.00 O ATOM 69618 H1 WAT 4985 8.854 44.491 93.987 1.00 0.00 H ATOM 69619 H2 WAT 4985 8.466 45.534 95.013 1.00 0.00 H TER 69621 WAT 4985 ATOM 69621 O WAT 4986 22.538 131.797 73.993 1.00 0.00 O ATOM 69622 H1 WAT 4986 21.734 131.393 73.667 1.00 0.00 H ATOM 69623 H2 WAT 4986 22.397 131.886 74.936 1.00 0.00 H TER 69625 WAT 4986 ATOM 69625 O WAT 4987 135.889 143.119 132.212 1.00 0.00 O ATOM 69626 H1 WAT 4987 135.011 143.224 132.579 1.00 0.00 H ATOM 69627 H2 WAT 4987 135.748 143.064 131.266 1.00 0.00 H TER 69629 WAT 4987 ATOM 69629 O WAT 4988 85.964 1.559 119.222 1.00 0.00 O ATOM 69630 H1 WAT 4988 85.821 0.721 118.781 1.00 0.00 H ATOM 69631 H2 WAT 4988 86.413 1.327 120.035 1.00 0.00 H TER 69633 WAT 4988 ATOM 69633 O WAT 4989 119.524 62.321 99.082 1.00 0.00 O ATOM 69634 H1 WAT 4989 119.223 63.228 99.030 1.00 0.00 H ATOM 69635 H2 WAT 4989 119.812 62.113 98.193 1.00 0.00 H TER 69637 WAT 4989 ATOM 69637 O WAT 4990 64.662 128.685 115.764 1.00 0.00 O ATOM 69638 H1 WAT 4990 65.095 128.759 116.614 1.00 0.00 H ATOM 69639 H2 WAT 4990 64.907 129.485 115.299 1.00 0.00 H TER 69641 WAT 4990 ATOM 69641 O WAT 4991 81.071 53.345 125.704 1.00 0.00 O ATOM 69642 H1 WAT 4991 80.591 52.632 126.125 1.00 0.00 H ATOM 69643 H2 WAT 4991 80.401 53.838 125.230 1.00 0.00 H TER 69645 WAT 4991 ATOM 69645 O WAT 4992 84.192 45.147 95.385 1.00 0.00 O ATOM 69646 H1 WAT 4992 83.781 45.986 95.173 1.00 0.00 H ATOM 69647 H2 WAT 4992 85.086 45.228 95.053 1.00 0.00 H TER 69649 WAT 4992 ATOM 69649 O WAT 4993 67.723 112.754 74.118 1.00 0.00 O ATOM 69650 H1 WAT 4993 68.552 112.320 73.917 1.00 0.00 H ATOM 69651 H2 WAT 4993 67.570 112.560 75.043 1.00 0.00 H TER 69653 WAT 4993 ATOM 69653 O WAT 4994 57.681 126.570 146.648 1.00 0.00 O ATOM 69654 H1 WAT 4994 58.230 127.340 146.796 1.00 0.00 H ATOM 69655 H2 WAT 4994 57.475 126.251 147.527 1.00 0.00 H TER 69657 WAT 4994 ATOM 69657 O WAT 4995 27.622 79.037 97.073 1.00 0.00 O ATOM 69658 H1 WAT 4995 27.361 78.556 96.288 1.00 0.00 H ATOM 69659 H2 WAT 4995 28.096 79.799 96.740 1.00 0.00 H TER 69661 WAT 4995 ATOM 69661 O WAT 4996 47.986 65.383 67.695 1.00 0.00 O ATOM 69662 H1 WAT 4996 48.599 66.103 67.839 1.00 0.00 H ATOM 69663 H2 WAT 4996 47.996 64.891 68.516 1.00 0.00 H TER 69665 WAT 4996 ATOM 69665 O WAT 4997 79.072 77.421 153.625 1.00 0.00 O ATOM 69666 H1 WAT 4997 79.319 76.793 154.305 1.00 0.00 H ATOM 69667 H2 WAT 4997 78.119 77.477 153.686 1.00 0.00 H TER 69669 WAT 4997 ATOM 69669 O WAT 4998 42.683 106.058 65.495 1.00 0.00 O ATOM 69670 H1 WAT 4998 42.613 106.145 64.544 1.00 0.00 H ATOM 69671 H2 WAT 4998 42.822 105.122 65.640 1.00 0.00 H TER 69673 WAT 4998 ATOM 69673 O WAT 4999 61.761 131.361 155.134 1.00 0.00 O ATOM 69674 H1 WAT 4999 61.627 131.968 154.406 1.00 0.00 H ATOM 69675 H2 WAT 4999 61.530 130.503 154.777 1.00 0.00 H TER 69677 WAT 4999 ATOM 69677 O WAT 5000 78.366 3.150 62.030 1.00 0.00 O ATOM 69678 H1 WAT 5000 77.680 3.482 62.609 1.00 0.00 H ATOM 69679 H2 WAT 5000 78.755 2.421 62.514 1.00 0.00 H TER 69681 WAT 5000 ATOM 69681 O WAT 5001 123.343 97.947 124.879 1.00 0.00 O ATOM 69682 H1 WAT 5001 122.750 98.696 124.927 1.00 0.00 H ATOM 69683 H2 WAT 5001 124.125 98.287 124.444 1.00 0.00 H TER 69685 WAT 5001 ATOM 69685 O WAT 5002 145.157 124.493 58.220 1.00 0.00 O ATOM 69686 H1 WAT 5002 144.425 124.927 57.782 1.00 0.00 H ATOM 69687 H2 WAT 5002 145.283 124.992 59.027 1.00 0.00 H TER 69689 WAT 5002 ATOM 69689 O WAT 5003 6.507 99.086 136.657 1.00 0.00 O ATOM 69690 H1 WAT 5003 6.365 98.168 136.427 1.00 0.00 H ATOM 69691 H2 WAT 5003 6.183 99.160 137.555 1.00 0.00 H TER 69693 WAT 5003 ATOM 69693 O WAT 5004 100.970 87.203 121.349 1.00 0.00 O ATOM 69694 H1 WAT 5004 101.487 86.502 121.746 1.00 0.00 H ATOM 69695 H2 WAT 5004 101.389 88.009 121.651 1.00 0.00 H TER 69697 WAT 5004 ATOM 69697 O WAT 5005 49.352 3.444 0.909 1.00 0.00 O ATOM 69698 H1 WAT 5005 48.761 4.181 0.753 1.00 0.00 H ATOM 69699 H2 WAT 5005 48.772 2.709 1.105 1.00 0.00 H TER 69701 WAT 5005 ATOM 69701 O WAT 5006 112.730 99.202 72.380 1.00 0.00 O ATOM 69702 H1 WAT 5006 111.948 99.373 72.904 1.00 0.00 H ATOM 69703 H2 WAT 5006 112.806 99.966 71.808 1.00 0.00 H TER 69705 WAT 5006 ATOM 69705 O WAT 5007 58.279 42.363 24.969 1.00 0.00 O ATOM 69706 H1 WAT 5007 58.932 43.047 25.116 1.00 0.00 H ATOM 69707 H2 WAT 5007 57.725 42.707 24.268 1.00 0.00 H TER 69709 WAT 5007 ATOM 69709 O WAT 5008 140.386 98.482 122.206 1.00 0.00 O ATOM 69710 H1 WAT 5008 140.121 98.093 121.373 1.00 0.00 H ATOM 69711 H2 WAT 5008 140.171 99.411 122.116 1.00 0.00 H TER 69713 WAT 5008 ATOM 69713 O WAT 5009 54.990 73.075 123.713 1.00 0.00 O ATOM 69714 H1 WAT 5009 54.607 73.951 123.768 1.00 0.00 H ATOM 69715 H2 WAT 5009 55.795 73.133 124.227 1.00 0.00 H TER 69717 WAT 5009 ATOM 69717 O WAT 5010 75.498 120.418 60.652 1.00 0.00 O ATOM 69718 H1 WAT 5010 75.570 119.516 60.964 1.00 0.00 H ATOM 69719 H2 WAT 5010 76.311 120.571 60.172 1.00 0.00 H TER 69721 WAT 5010 ATOM 69721 O WAT 5011 27.371 58.572 102.133 1.00 0.00 O ATOM 69722 H1 WAT 5011 28.256 58.424 101.799 1.00 0.00 H ATOM 69723 H2 WAT 5011 27.138 59.444 101.816 1.00 0.00 H TER 69725 WAT 5011 ATOM 69725 O WAT 5012 144.239 18.001 132.686 1.00 0.00 O ATOM 69726 H1 WAT 5012 143.523 18.218 132.088 1.00 0.00 H ATOM 69727 H2 WAT 5012 144.813 18.767 132.659 1.00 0.00 H TER 69729 WAT 5012 ATOM 69729 O WAT 5013 68.126 24.150 95.774 1.00 0.00 O ATOM 69730 H1 WAT 5013 69.067 24.302 95.690 1.00 0.00 H ATOM 69731 H2 WAT 5013 68.035 23.197 95.749 1.00 0.00 H TER 69733 WAT 5013 ATOM 69733 O WAT 5014 12.575 98.842 1.353 1.00 0.00 O ATOM 69734 H1 WAT 5014 12.969 99.705 1.225 1.00 0.00 H ATOM 69735 H2 WAT 5014 12.990 98.288 0.693 1.00 0.00 H TER 69737 WAT 5014 ATOM 69737 O WAT 5015 118.018 83.938 72.829 1.00 0.00 O ATOM 69738 H1 WAT 5015 118.850 83.850 72.365 1.00 0.00 H ATOM 69739 H2 WAT 5015 117.653 84.764 72.513 1.00 0.00 H TER 69741 WAT 5015 ATOM 69741 O WAT 5016 13.997 70.738 151.023 1.00 0.00 O ATOM 69742 H1 WAT 5016 14.250 70.922 151.927 1.00 0.00 H ATOM 69743 H2 WAT 5016 14.135 71.566 150.562 1.00 0.00 H TER 69745 WAT 5016 ATOM 69745 O WAT 5017 85.388 59.119 120.541 1.00 0.00 O ATOM 69746 H1 WAT 5017 86.031 58.752 121.147 1.00 0.00 H ATOM 69747 H2 WAT 5017 85.910 59.622 119.915 1.00 0.00 H TER 69749 WAT 5017 ATOM 69749 O WAT 5018 63.555 54.780 144.034 1.00 0.00 O ATOM 69750 H1 WAT 5018 64.187 54.117 143.756 1.00 0.00 H ATOM 69751 H2 WAT 5018 62.904 54.800 143.332 1.00 0.00 H TER 69753 WAT 5018 ATOM 69753 O WAT 5019 29.947 136.942 115.968 1.00 0.00 O ATOM 69754 H1 WAT 5019 30.106 136.090 115.562 1.00 0.00 H ATOM 69755 H2 WAT 5019 29.524 136.734 116.802 1.00 0.00 H TER 69757 WAT 5019 ATOM 69757 O WAT 5020 111.721 75.972 98.521 1.00 0.00 O ATOM 69758 H1 WAT 5020 110.869 75.631 98.250 1.00 0.00 H ATOM 69759 H2 WAT 5020 111.527 76.831 98.897 1.00 0.00 H TER 69761 WAT 5020 ATOM 69761 O WAT 5021 109.190 70.748 81.109 1.00 0.00 O ATOM 69762 H1 WAT 5021 109.572 71.569 80.799 1.00 0.00 H ATOM 69763 H2 WAT 5021 109.725 70.066 80.702 1.00 0.00 H TER 69765 WAT 5021 ATOM 69765 O WAT 5022 65.464 58.722 139.379 1.00 0.00 O ATOM 69766 H1 WAT 5022 65.598 59.459 138.784 1.00 0.00 H ATOM 69767 H2 WAT 5022 64.514 58.666 139.481 1.00 0.00 H TER 69769 WAT 5022 ATOM 69769 O WAT 5023 71.771 79.415 122.695 1.00 0.00 O ATOM 69770 H1 WAT 5023 71.585 80.059 122.012 1.00 0.00 H ATOM 69771 H2 WAT 5023 72.724 79.425 122.782 1.00 0.00 H TER 69773 WAT 5023 ATOM 69773 O WAT 5024 33.929 85.245 15.558 1.00 0.00 O ATOM 69774 H1 WAT 5024 33.895 84.410 15.092 1.00 0.00 H ATOM 69775 H2 WAT 5024 34.715 85.185 16.101 1.00 0.00 H TER 69777 WAT 5024 ATOM 69777 O WAT 5025 85.026 27.769 92.278 1.00 0.00 O ATOM 69778 H1 WAT 5025 84.996 28.499 91.659 1.00 0.00 H ATOM 69779 H2 WAT 5025 84.911 26.989 91.736 1.00 0.00 H TER 69781 WAT 5025 ATOM 69781 O WAT 5026 118.356 42.881 86.825 1.00 0.00 O ATOM 69782 H1 WAT 5026 119.209 43.274 86.642 1.00 0.00 H ATOM 69783 H2 WAT 5026 117.742 43.614 86.793 1.00 0.00 H TER 69785 WAT 5026 ATOM 69785 O WAT 5027 138.180 10.195 56.293 1.00 0.00 O ATOM 69786 H1 WAT 5027 137.575 10.805 56.715 1.00 0.00 H ATOM 69787 H2 WAT 5027 138.553 10.693 55.566 1.00 0.00 H TER 69789 WAT 5027 ATOM 69789 O WAT 5028 22.024 112.683 20.170 1.00 0.00 O ATOM 69790 H1 WAT 5028 22.538 112.828 19.376 1.00 0.00 H ATOM 69791 H2 WAT 5028 22.675 112.483 20.843 1.00 0.00 H TER 69793 WAT 5028 ATOM 69793 O WAT 5029 97.608 96.636 95.109 1.00 0.00 O ATOM 69794 H1 WAT 5029 98.216 96.470 95.829 1.00 0.00 H ATOM 69795 H2 WAT 5029 97.429 97.575 95.157 1.00 0.00 H TER 69797 WAT 5029 ATOM 69797 O WAT 5030 82.353 69.124 146.948 1.00 0.00 O ATOM 69798 H1 WAT 5030 81.538 69.202 147.443 1.00 0.00 H ATOM 69799 H2 WAT 5030 82.976 69.674 147.424 1.00 0.00 H TER 69801 WAT 5030 ATOM 69801 O WAT 5031 142.470 131.030 97.631 1.00 0.00 O ATOM 69802 H1 WAT 5031 142.687 131.640 96.927 1.00 0.00 H ATOM 69803 H2 WAT 5031 141.675 131.390 98.024 1.00 0.00 H TER 69805 WAT 5031 ATOM 69805 O WAT 5032 30.627 22.003 11.860 1.00 0.00 O ATOM 69806 H1 WAT 5032 30.419 22.073 12.792 1.00 0.00 H ATOM 69807 H2 WAT 5032 30.646 22.908 11.549 1.00 0.00 H TER 69809 WAT 5032 ATOM 69809 O WAT 5033 145.017 132.841 17.396 1.00 0.00 O ATOM 69810 H1 WAT 5033 145.730 132.394 16.940 1.00 0.00 H ATOM 69811 H2 WAT 5033 145.046 132.492 18.287 1.00 0.00 H TER 69813 WAT 5033 ATOM 69813 O WAT 5034 20.633 96.608 125.183 1.00 0.00 O ATOM 69814 H1 WAT 5034 20.355 95.817 124.722 1.00 0.00 H ATOM 69815 H2 WAT 5034 21.544 96.732 124.919 1.00 0.00 H TER 69817 WAT 5034 ATOM 69817 O WAT 5035 0.361 79.710 142.884 1.00 0.00 O ATOM 69818 H1 WAT 5035 0.202 80.511 143.383 1.00 0.00 H ATOM 69819 H2 WAT 5035 -0.512 79.347 142.730 1.00 0.00 H TER 69821 WAT 5035 ATOM 69821 O WAT 5036 5.508 24.779 146.645 1.00 0.00 O ATOM 69822 H1 WAT 5036 4.870 24.991 147.326 1.00 0.00 H ATOM 69823 H2 WAT 5036 6.275 25.308 146.863 1.00 0.00 H TER 69825 WAT 5036 ATOM 69825 O WAT 5037 130.876 83.023 153.118 1.00 0.00 O ATOM 69826 H1 WAT 5037 130.010 82.875 152.738 1.00 0.00 H ATOM 69827 H2 WAT 5037 131.442 83.192 152.365 1.00 0.00 H TER 69829 WAT 5037 ATOM 69829 O WAT 5038 54.407 5.540 6.586 1.00 0.00 O ATOM 69830 H1 WAT 5038 54.733 5.703 5.701 1.00 0.00 H ATOM 69831 H2 WAT 5038 53.950 4.702 6.523 1.00 0.00 H TER 69833 WAT 5038 ATOM 69833 O WAT 5039 106.982 143.019 117.660 1.00 0.00 O ATOM 69834 H1 WAT 5039 106.093 142.674 117.742 1.00 0.00 H ATOM 69835 H2 WAT 5039 107.485 142.544 118.321 1.00 0.00 H TER 69837 WAT 5039 ATOM 69837 O WAT 5040 46.080 15.019 14.343 1.00 0.00 O ATOM 69838 H1 WAT 5040 46.865 14.928 13.804 1.00 0.00 H ATOM 69839 H2 WAT 5040 46.166 15.882 14.749 1.00 0.00 H TER 69841 WAT 5040 ATOM 69841 O WAT 5041 46.545 73.976 96.849 1.00 0.00 O ATOM 69842 H1 WAT 5041 46.772 74.707 97.425 1.00 0.00 H ATOM 69843 H2 WAT 5041 45.593 73.906 96.916 1.00 0.00 H TER 69845 WAT 5041 ATOM 69845 O WAT 5042 69.527 46.912 107.692 1.00 0.00 O ATOM 69846 H1 WAT 5042 69.329 47.290 108.549 1.00 0.00 H ATOM 69847 H2 WAT 5042 69.442 47.645 107.082 1.00 0.00 H TER 69849 WAT 5042 ATOM 69849 O WAT 5043 115.685 95.180 134.708 1.00 0.00 O ATOM 69850 H1 WAT 5043 116.073 95.324 135.571 1.00 0.00 H ATOM 69851 H2 WAT 5043 115.209 95.989 134.522 1.00 0.00 H TER 69853 WAT 5043 ATOM 69853 O WAT 5044 91.750 84.946 0.595 1.00 0.00 O ATOM 69854 H1 WAT 5044 92.289 84.167 0.730 1.00 0.00 H ATOM 69855 H2 WAT 5044 92.208 85.440 -0.085 1.00 0.00 H TER 69857 WAT 5044 ATOM 69857 O WAT 5045 98.679 19.992 12.042 1.00 0.00 O ATOM 69858 H1 WAT 5045 97.798 19.712 12.291 1.00 0.00 H ATOM 69859 H2 WAT 5045 99.168 20.004 12.864 1.00 0.00 H TER 69861 WAT 5045 ATOM 69861 O WAT 5046 20.698 125.394 139.626 1.00 0.00 O ATOM 69862 H1 WAT 5046 19.791 125.621 139.424 1.00 0.00 H ATOM 69863 H2 WAT 5046 20.728 124.440 139.557 1.00 0.00 H TER 69865 WAT 5046 ATOM 69865 O WAT 5047 15.922 143.802 107.829 1.00 0.00 O ATOM 69866 H1 WAT 5047 16.689 144.359 107.700 1.00 0.00 H ATOM 69867 H2 WAT 5047 15.684 143.515 106.947 1.00 0.00 H TER 69869 WAT 5047 ATOM 69869 O WAT 5048 37.991 8.063 143.205 1.00 0.00 O ATOM 69870 H1 WAT 5048 38.126 7.806 144.117 1.00 0.00 H ATOM 69871 H2 WAT 5048 38.679 7.606 142.722 1.00 0.00 H TER 69873 WAT 5048 ATOM 69873 O WAT 5049 100.828 12.035 151.602 1.00 0.00 O ATOM 69874 H1 WAT 5049 100.204 12.087 150.878 1.00 0.00 H ATOM 69875 H2 WAT 5049 100.961 11.096 151.736 1.00 0.00 H TER 69877 WAT 5049 ATOM 69877 O WAT 5050 67.349 38.112 104.518 1.00 0.00 O ATOM 69878 H1 WAT 5050 66.587 38.150 103.940 1.00 0.00 H ATOM 69879 H2 WAT 5050 68.011 38.645 104.078 1.00 0.00 H TER 69881 WAT 5050 ATOM 69881 O WAT 5051 137.487 128.359 97.724 1.00 0.00 O ATOM 69882 H1 WAT 5051 137.297 128.529 96.801 1.00 0.00 H ATOM 69883 H2 WAT 5051 137.290 127.430 97.842 1.00 0.00 H TER 69885 WAT 5051 ATOM 69885 O WAT 5052 141.682 87.205 99.793 1.00 0.00 O ATOM 69886 H1 WAT 5052 141.144 87.698 100.413 1.00 0.00 H ATOM 69887 H2 WAT 5052 142.500 87.699 99.741 1.00 0.00 H TER 69889 WAT 5052 ATOM 69889 O WAT 5053 41.731 57.434 69.620 1.00 0.00 O ATOM 69890 H1 WAT 5053 41.943 57.741 70.501 1.00 0.00 H ATOM 69891 H2 WAT 5053 42.304 56.679 69.484 1.00 0.00 H TER 69893 WAT 5053 ATOM 69893 O WAT 5054 79.962 116.507 106.223 1.00 0.00 O ATOM 69894 H1 WAT 5054 80.667 117.153 106.196 1.00 0.00 H ATOM 69895 H2 WAT 5054 79.574 116.540 105.349 1.00 0.00 H TER 69897 WAT 5054 ATOM 69897 O WAT 5055 34.038 4.176 126.940 1.00 0.00 O ATOM 69898 H1 WAT 5055 33.322 3.542 126.900 1.00 0.00 H ATOM 69899 H2 WAT 5055 34.233 4.375 126.025 1.00 0.00 H TER 69901 WAT 5055 ATOM 69901 O WAT 5056 83.949 72.264 94.431 1.00 0.00 O ATOM 69902 H1 WAT 5056 83.003 72.352 94.553 1.00 0.00 H ATOM 69903 H2 WAT 5056 84.140 71.361 94.685 1.00 0.00 H TER 69905 WAT 5056 ATOM 69905 O WAT 5057 107.391 74.665 133.584 1.00 0.00 O ATOM 69906 H1 WAT 5057 106.473 74.457 133.414 1.00 0.00 H ATOM 69907 H2 WAT 5057 107.754 73.863 133.960 1.00 0.00 H TER 69909 WAT 5057 ATOM 69909 O WAT 5058 71.492 89.496 71.551 1.00 0.00 O ATOM 69910 H1 WAT 5058 72.097 89.191 70.876 1.00 0.00 H ATOM 69911 H2 WAT 5058 71.985 89.420 72.368 1.00 0.00 H TER 69913 WAT 5058 ATOM 69913 O WAT 5059 29.907 80.339 5.872 1.00 0.00 O ATOM 69914 H1 WAT 5059 30.459 80.269 5.093 1.00 0.00 H ATOM 69915 H2 WAT 5059 29.019 80.177 5.553 1.00 0.00 H TER 69917 WAT 5059 ATOM 69917 O WAT 5060 78.456 74.385 144.251 1.00 0.00 O ATOM 69918 H1 WAT 5060 78.012 75.059 143.736 1.00 0.00 H ATOM 69919 H2 WAT 5060 79.154 74.854 144.708 1.00 0.00 H TER 69921 WAT 5060 ATOM 69921 O WAT 5061 58.788 138.976 48.771 1.00 0.00 O ATOM 69922 H1 WAT 5061 57.922 138.995 48.365 1.00 0.00 H ATOM 69923 H2 WAT 5061 58.972 139.890 48.987 1.00 0.00 H TER 69925 WAT 5061 ATOM 69925 O WAT 5062 47.575 16.300 82.562 1.00 0.00 O ATOM 69926 H1 WAT 5062 47.377 15.549 82.002 1.00 0.00 H ATOM 69927 H2 WAT 5062 47.426 15.981 83.452 1.00 0.00 H TER 69929 WAT 5062 ATOM 69929 O WAT 5063 81.037 75.934 81.443 1.00 0.00 O ATOM 69930 H1 WAT 5063 80.547 76.725 81.218 1.00 0.00 H ATOM 69931 H2 WAT 5063 81.748 75.903 80.803 1.00 0.00 H TER 69933 WAT 5063 ATOM 69933 O WAT 5064 89.751 60.751 152.732 1.00 0.00 O ATOM 69934 H1 WAT 5064 88.917 60.442 153.088 1.00 0.00 H ATOM 69935 H2 WAT 5064 90.237 59.950 152.533 1.00 0.00 H TER 69937 WAT 5064 ATOM 69937 O WAT 5065 79.569 8.172 72.014 1.00 0.00 O ATOM 69938 H1 WAT 5065 79.813 7.466 72.614 1.00 0.00 H ATOM 69939 H2 WAT 5065 78.623 8.074 71.903 1.00 0.00 H TER 69941 WAT 5065 ATOM 69941 O WAT 5066 13.660 138.267 77.502 1.00 0.00 O ATOM 69942 H1 WAT 5066 13.862 138.077 78.418 1.00 0.00 H ATOM 69943 H2 WAT 5066 14.382 138.824 77.209 1.00 0.00 H TER 69945 WAT 5066 ATOM 69945 O WAT 5067 46.981 43.547 3.553 1.00 0.00 O ATOM 69946 H1 WAT 5067 46.797 43.075 4.365 1.00 0.00 H ATOM 69947 H2 WAT 5067 47.521 44.289 3.824 1.00 0.00 H TER 69949 WAT 5067 ATOM 69949 O WAT 5068 1.564 138.958 103.787 1.00 0.00 O ATOM 69950 H1 WAT 5068 0.930 138.247 103.878 1.00 0.00 H ATOM 69951 H2 WAT 5068 1.116 139.612 103.252 1.00 0.00 H TER 69953 WAT 5068 ATOM 69953 O WAT 5069 65.823 109.758 154.330 1.00 0.00 O ATOM 69954 H1 WAT 5069 66.049 110.669 154.141 1.00 0.00 H ATOM 69955 H2 WAT 5069 65.023 109.601 153.828 1.00 0.00 H TER 69957 WAT 5069 ATOM 69957 O WAT 5070 64.071 12.708 154.165 1.00 0.00 O ATOM 69958 H1 WAT 5070 63.864 13.514 153.693 1.00 0.00 H ATOM 69959 H2 WAT 5070 65.002 12.563 153.997 1.00 0.00 H TER 69961 WAT 5070 ATOM 69961 O WAT 5071 4.261 62.888 104.332 1.00 0.00 O ATOM 69962 H1 WAT 5071 4.819 62.228 104.742 1.00 0.00 H ATOM 69963 H2 WAT 5071 4.018 63.474 105.049 1.00 0.00 H TER 69965 WAT 5071 ATOM 69965 O WAT 5072 73.852 116.897 12.078 1.00 0.00 O ATOM 69966 H1 WAT 5072 73.225 116.624 11.409 1.00 0.00 H ATOM 69967 H2 WAT 5072 73.448 116.637 12.906 1.00 0.00 H TER 69969 WAT 5072 ATOM 69969 O WAT 5073 118.387 67.709 144.660 1.00 0.00 O ATOM 69970 H1 WAT 5073 117.979 68.054 143.866 1.00 0.00 H ATOM 69971 H2 WAT 5073 117.685 67.712 145.311 1.00 0.00 H TER 69973 WAT 5073 ATOM 69973 O WAT 5074 44.041 20.051 86.094 1.00 0.00 O ATOM 69974 H1 WAT 5074 43.932 20.279 87.017 1.00 0.00 H ATOM 69975 H2 WAT 5074 43.970 20.885 85.631 1.00 0.00 H TER 69977 WAT 5074 ATOM 69977 O WAT 5075 119.367 7.027 13.621 1.00 0.00 O ATOM 69978 H1 WAT 5075 119.480 6.324 14.260 1.00 0.00 H ATOM 69979 H2 WAT 5075 118.963 6.600 12.865 1.00 0.00 H TER 69981 WAT 5075 ATOM 69981 O WAT 5076 93.304 63.359 3.353 1.00 0.00 O ATOM 69982 H1 WAT 5076 92.952 63.211 2.475 1.00 0.00 H ATOM 69983 H2 WAT 5076 92.557 63.229 3.936 1.00 0.00 H TER 69985 WAT 5076 ATOM 69985 O WAT 5077 72.801 11.989 118.445 1.00 0.00 O ATOM 69986 H1 WAT 5077 72.752 11.041 118.320 1.00 0.00 H ATOM 69987 H2 WAT 5077 73.276 12.307 117.677 1.00 0.00 H TER 69989 WAT 5077 ATOM 69989 O WAT 5078 86.588 53.716 134.811 1.00 0.00 O ATOM 69990 H1 WAT 5078 86.128 53.022 135.283 1.00 0.00 H ATOM 69991 H2 WAT 5078 87.500 53.631 135.091 1.00 0.00 H TER 69993 WAT 5078 ATOM 69993 O WAT 5079 40.779 58.366 0.981 1.00 0.00 O ATOM 69994 H1 WAT 5079 41.492 57.756 0.789 1.00 0.00 H ATOM 69995 H2 WAT 5079 40.053 57.806 1.255 1.00 0.00 H TER 69997 WAT 5079 ATOM 69997 O WAT 5080 130.982 34.044 92.600 1.00 0.00 O ATOM 69998 H1 WAT 5080 130.304 33.477 92.966 1.00 0.00 H ATOM 69999 H2 WAT 5080 131.793 33.746 93.012 1.00 0.00 H TER 70001 WAT 5080 ATOM 70001 O WAT 5081 140.707 102.232 95.794 1.00 0.00 O ATOM 70002 H1 WAT 5081 140.055 102.931 95.732 1.00 0.00 H ATOM 70003 H2 WAT 5081 140.477 101.628 95.088 1.00 0.00 H TER 70005 WAT 5081 ATOM 70005 O WAT 5082 133.491 5.079 9.416 1.00 0.00 O ATOM 70006 H1 WAT 5082 133.587 4.944 10.359 1.00 0.00 H ATOM 70007 H2 WAT 5082 134.365 4.916 9.061 1.00 0.00 H TER 70009 WAT 5082 ATOM 70009 O WAT 5083 3.420 101.037 100.705 1.00 0.00 O ATOM 70010 H1 WAT 5083 2.560 100.708 100.968 1.00 0.00 H ATOM 70011 H2 WAT 5083 4.040 100.543 101.242 1.00 0.00 H TER 70013 WAT 5083 ATOM 70013 O WAT 5084 126.258 73.716 21.461 1.00 0.00 O ATOM 70014 H1 WAT 5084 125.819 73.351 20.693 1.00 0.00 H ATOM 70015 H2 WAT 5084 125.656 74.387 21.784 1.00 0.00 H TER 70017 WAT 5084 ATOM 70017 O WAT 5085 130.764 112.604 15.406 1.00 0.00 O ATOM 70018 H1 WAT 5085 131.710 112.459 15.428 1.00 0.00 H ATOM 70019 H2 WAT 5085 130.500 112.330 14.528 1.00 0.00 H TER 70021 WAT 5085 ATOM 70021 O WAT 5086 28.569 86.994 151.605 1.00 0.00 O ATOM 70022 H1 WAT 5086 28.035 87.070 150.814 1.00 0.00 H ATOM 70023 H2 WAT 5086 29.238 87.672 151.507 1.00 0.00 H TER 70025 WAT 5086 ATOM 70025 O WAT 5087 6.293 9.460 140.538 1.00 0.00 O ATOM 70026 H1 WAT 5087 5.726 8.737 140.807 1.00 0.00 H ATOM 70027 H2 WAT 5087 6.544 9.245 139.640 1.00 0.00 H TER 70029 WAT 5087 ATOM 70029 O WAT 5088 26.424 74.261 121.812 1.00 0.00 O ATOM 70030 H1 WAT 5088 26.618 74.466 120.897 1.00 0.00 H ATOM 70031 H2 WAT 5088 26.598 73.323 121.888 1.00 0.00 H TER 70033 WAT 5088 ATOM 70033 O WAT 5089 76.272 101.015 147.051 1.00 0.00 O ATOM 70034 H1 WAT 5089 75.959 100.710 146.200 1.00 0.00 H ATOM 70035 H2 WAT 5089 76.996 101.605 146.843 1.00 0.00 H TER 70037 WAT 5089 ATOM 70037 O WAT 5090 73.206 86.590 3.352 1.00 0.00 O ATOM 70038 H1 WAT 5090 72.884 85.825 2.875 1.00 0.00 H ATOM 70039 H2 WAT 5090 73.325 86.281 4.250 1.00 0.00 H TER 70041 WAT 5090 ATOM 70041 O WAT 5091 132.512 32.807 76.744 1.00 0.00 O ATOM 70042 H1 WAT 5091 133.195 32.173 76.528 1.00 0.00 H ATOM 70043 H2 WAT 5091 132.145 32.491 77.570 1.00 0.00 H TER 70045 WAT 5091 ATOM 70045 O WAT 5092 103.812 20.192 68.685 1.00 0.00 O ATOM 70046 H1 WAT 5092 104.689 19.902 68.433 1.00 0.00 H ATOM 70047 H2 WAT 5092 103.419 20.504 67.870 1.00 0.00 H TER 70049 WAT 5092 ATOM 70049 O WAT 5093 64.737 57.360 94.598 1.00 0.00 O ATOM 70050 H1 WAT 5093 64.332 58.105 94.156 1.00 0.00 H ATOM 70051 H2 WAT 5093 64.628 57.547 95.531 1.00 0.00 H TER 70053 WAT 5093 ATOM 70053 O WAT 5094 102.737 91.366 66.352 1.00 0.00 O ATOM 70054 H1 WAT 5094 101.866 91.025 66.149 1.00 0.00 H ATOM 70055 H2 WAT 5094 103.295 91.031 65.649 1.00 0.00 H TER 70057 WAT 5094 ATOM 70057 O WAT 5095 129.573 74.601 2.899 1.00 0.00 O ATOM 70058 H1 WAT 5095 130.176 73.963 3.281 1.00 0.00 H ATOM 70059 H2 WAT 5095 128.710 74.335 3.217 1.00 0.00 H TER 70061 WAT 5095 ATOM 70061 O WAT 5096 112.526 119.762 70.035 1.00 0.00 O ATOM 70062 H1 WAT 5096 111.732 120.097 70.451 1.00 0.00 H ATOM 70063 H2 WAT 5096 113.131 120.503 70.042 1.00 0.00 H TER 70065 WAT 5096 ATOM 70065 O WAT 5097 15.298 106.076 120.384 1.00 0.00 O ATOM 70066 H1 WAT 5097 15.779 106.870 120.619 1.00 0.00 H ATOM 70067 H2 WAT 5097 15.593 105.871 119.497 1.00 0.00 H TER 70069 WAT 5097 ATOM 70069 O WAT 5098 144.758 144.400 83.889 1.00 0.00 O ATOM 70070 H1 WAT 5098 144.416 144.266 83.005 1.00 0.00 H ATOM 70071 H2 WAT 5098 145.670 144.661 83.757 1.00 0.00 H TER 70073 WAT 5098 ATOM 70073 O WAT 5099 133.011 83.514 14.828 1.00 0.00 O ATOM 70074 H1 WAT 5099 132.508 82.877 15.336 1.00 0.00 H ATOM 70075 H2 WAT 5099 132.972 83.187 13.929 1.00 0.00 H TER 70077 WAT 5099 ATOM 70077 O WAT 5100 0.802 64.208 12.296 1.00 0.00 O ATOM 70078 H1 WAT 5100 1.029 64.743 13.057 1.00 0.00 H ATOM 70079 H2 WAT 5100 0.367 63.439 12.665 1.00 0.00 H TER 70081 WAT 5100 ATOM 70081 O WAT 5101 33.201 65.815 18.652 1.00 0.00 O ATOM 70082 H1 WAT 5101 32.570 65.642 19.351 1.00 0.00 H ATOM 70083 H2 WAT 5101 33.766 66.502 19.004 1.00 0.00 H TER 70085 WAT 5101 ATOM 70085 O WAT 5102 129.479 36.334 92.353 1.00 0.00 O ATOM 70086 H1 WAT 5102 129.973 35.716 92.891 1.00 0.00 H ATOM 70087 H2 WAT 5102 128.726 35.832 92.041 1.00 0.00 H TER 70089 WAT 5102 ATOM 70089 O WAT 5103 42.077 84.215 145.574 1.00 0.00 O ATOM 70090 H1 WAT 5103 41.452 84.323 144.857 1.00 0.00 H ATOM 70091 H2 WAT 5103 42.556 85.043 145.600 1.00 0.00 H TER 70093 WAT 5103 ATOM 70093 O WAT 5104 27.775 49.650 101.755 1.00 0.00 O ATOM 70094 H1 WAT 5104 27.224 50.234 102.276 1.00 0.00 H ATOM 70095 H2 WAT 5104 27.727 50.005 100.867 1.00 0.00 H TER 70097 WAT 5104 ATOM 70097 O WAT 5105 42.358 85.655 2.189 1.00 0.00 O ATOM 70098 H1 WAT 5105 42.701 85.160 2.933 1.00 0.00 H ATOM 70099 H2 WAT 5105 42.202 84.995 1.514 1.00 0.00 H TER 70101 WAT 5105 ATOM 70101 O WAT 5106 123.482 51.541 147.484 1.00 0.00 O ATOM 70102 H1 WAT 5106 123.122 50.980 148.170 1.00 0.00 H ATOM 70103 H2 WAT 5106 123.439 52.425 147.850 1.00 0.00 H TER 70105 WAT 5106 ATOM 70105 O WAT 5107 111.796 104.762 154.238 1.00 0.00 O ATOM 70106 H1 WAT 5107 112.704 104.542 154.032 1.00 0.00 H ATOM 70107 H2 WAT 5107 111.803 104.949 155.177 1.00 0.00 H TER 70109 WAT 5107 ATOM 70109 O WAT 5108 68.571 58.417 152.280 1.00 0.00 O ATOM 70110 H1 WAT 5108 69.181 59.073 152.616 1.00 0.00 H ATOM 70111 H2 WAT 5108 68.770 57.626 152.780 1.00 0.00 H TER 70113 WAT 5108 ATOM 70113 O WAT 5109 32.664 6.007 14.949 1.00 0.00 O ATOM 70114 H1 WAT 5109 33.179 5.255 14.657 1.00 0.00 H ATOM 70115 H2 WAT 5109 32.947 6.155 15.851 1.00 0.00 H TER 70117 WAT 5109 ATOM 70117 O WAT 5110 93.666 92.297 155.140 1.00 0.00 O ATOM 70118 H1 WAT 5110 93.403 93.027 154.580 1.00 0.00 H ATOM 70119 H2 WAT 5110 94.558 92.512 155.411 1.00 0.00 H TER 70121 WAT 5110 ATOM 70121 O WAT 5111 102.061 50.624 73.582 1.00 0.00 O ATOM 70122 H1 WAT 5111 101.970 49.778 74.022 1.00 0.00 H ATOM 70123 H2 WAT 5111 102.973 50.646 73.293 1.00 0.00 H TER 70125 WAT 5111 ATOM 70125 O WAT 5112 114.346 134.835 72.082 1.00 0.00 O ATOM 70126 H1 WAT 5112 114.766 134.035 71.765 1.00 0.00 H ATOM 70127 H2 WAT 5112 114.579 135.500 71.435 1.00 0.00 H TER 70129 WAT 5112 ATOM 70129 O WAT 5113 48.906 58.102 8.400 1.00 0.00 O ATOM 70130 H1 WAT 5113 49.179 57.620 7.619 1.00 0.00 H ATOM 70131 H2 WAT 5113 49.723 58.293 8.861 1.00 0.00 H TER 70133 WAT 5113 ATOM 70133 O WAT 5114 9.557 62.371 59.306 1.00 0.00 O ATOM 70134 H1 WAT 5114 8.771 62.905 59.191 1.00 0.00 H ATOM 70135 H2 WAT 5114 9.345 61.786 60.034 1.00 0.00 H TER 70137 WAT 5114 ATOM 70137 O WAT 5115 45.214 113.920 136.348 1.00 0.00 O ATOM 70138 H1 WAT 5115 45.391 113.026 136.641 1.00 0.00 H ATOM 70139 H2 WAT 5115 44.944 114.383 137.141 1.00 0.00 H TER 70141 WAT 5115 ATOM 70141 O WAT 5116 121.168 115.535 121.751 1.00 0.00 O ATOM 70142 H1 WAT 5116 121.926 115.039 122.060 1.00 0.00 H ATOM 70143 H2 WAT 5116 121.168 116.329 122.285 1.00 0.00 H TER 70145 WAT 5116 ATOM 70145 O WAT 5117 108.258 136.977 147.912 1.00 0.00 O ATOM 70146 H1 WAT 5117 109.079 136.606 147.589 1.00 0.00 H ATOM 70147 H2 WAT 5117 108.325 136.914 148.865 1.00 0.00 H TER 70149 WAT 5117 ATOM 70149 O WAT 5118 84.646 105.521 3.096 1.00 0.00 O ATOM 70150 H1 WAT 5118 85.545 105.844 3.041 1.00 0.00 H ATOM 70151 H2 WAT 5118 84.359 105.758 3.978 1.00 0.00 H TER 70153 WAT 5118 ATOM 70153 O WAT 5119 109.248 43.254 150.484 1.00 0.00 O ATOM 70154 H1 WAT 5119 109.004 42.685 151.214 1.00 0.00 H ATOM 70155 H2 WAT 5119 109.022 42.750 149.702 1.00 0.00 H TER 70157 WAT 5119 ATOM 70157 O WAT 5120 127.501 22.726 114.645 1.00 0.00 O ATOM 70158 H1 WAT 5120 127.028 21.901 114.751 1.00 0.00 H ATOM 70159 H2 WAT 5120 127.660 22.792 113.703 1.00 0.00 H TER 70161 WAT 5120 ATOM 70161 O WAT 5121 114.942 28.281 154.246 1.00 0.00 O ATOM 70162 H1 WAT 5121 114.129 27.823 154.460 1.00 0.00 H ATOM 70163 H2 WAT 5121 115.519 27.598 153.905 1.00 0.00 H TER 70165 WAT 5121 ATOM 70165 O WAT 5122 35.212 116.665 73.069 1.00 0.00 O ATOM 70166 H1 WAT 5122 35.324 117.480 73.559 1.00 0.00 H ATOM 70167 H2 WAT 5122 35.904 116.092 73.397 1.00 0.00 H TER 70169 WAT 5122 ATOM 70169 O WAT 5123 31.594 69.977 10.844 1.00 0.00 O ATOM 70170 H1 WAT 5123 31.574 69.058 11.112 1.00 0.00 H ATOM 70171 H2 WAT 5123 32.412 70.067 10.356 1.00 0.00 H TER 70173 WAT 5123 ATOM 70173 O WAT 5124 40.209 41.412 91.951 1.00 0.00 O ATOM 70174 H1 WAT 5124 39.309 41.499 92.267 1.00 0.00 H ATOM 70175 H2 WAT 5124 40.262 42.017 91.211 1.00 0.00 H TER 70177 WAT 5124 ATOM 70177 O WAT 5125 76.234 58.750 68.664 1.00 0.00 O ATOM 70178 H1 WAT 5125 76.375 59.612 68.271 1.00 0.00 H ATOM 70179 H2 WAT 5125 75.289 58.703 68.807 1.00 0.00 H TER 70181 WAT 5125 ATOM 70181 O WAT 5126 128.363 104.240 157.379 1.00 0.00 O ATOM 70182 H1 WAT 5126 128.559 104.746 156.591 1.00 0.00 H ATOM 70183 H2 WAT 5126 128.698 103.363 157.190 1.00 0.00 H TER 70185 WAT 5126 ATOM 70185 O WAT 5127 75.029 99.334 76.168 1.00 0.00 O ATOM 70186 H1 WAT 5127 74.088 99.159 76.137 1.00 0.00 H ATOM 70187 H2 WAT 5127 75.315 98.955 76.999 1.00 0.00 H TER 70189 WAT 5127 ATOM 70189 O WAT 5128 34.552 74.293 134.918 1.00 0.00 O ATOM 70190 H1 WAT 5128 34.151 73.444 134.734 1.00 0.00 H ATOM 70191 H2 WAT 5128 33.822 74.848 135.194 1.00 0.00 H TER 70193 WAT 5128 ATOM 70193 O WAT 5129 87.209 19.975 130.125 1.00 0.00 O ATOM 70194 H1 WAT 5129 86.563 20.035 129.421 1.00 0.00 H ATOM 70195 H2 WAT 5129 86.724 19.605 130.863 1.00 0.00 H TER 70197 WAT 5129 ATOM 70197 O WAT 5130 79.798 9.473 137.321 1.00 0.00 O ATOM 70198 H1 WAT 5130 79.727 9.023 136.479 1.00 0.00 H ATOM 70199 H2 WAT 5130 80.730 9.675 137.406 1.00 0.00 H TER 70201 WAT 5130 ATOM 70201 O WAT 5131 44.485 80.270 22.547 1.00 0.00 O ATOM 70202 H1 WAT 5131 44.809 81.049 22.998 1.00 0.00 H ATOM 70203 H2 WAT 5131 43.546 80.258 22.733 1.00 0.00 H TER 70205 WAT 5131 ATOM 70205 O WAT 5132 65.741 56.353 7.955 1.00 0.00 O ATOM 70206 H1 WAT 5132 65.328 55.869 8.670 1.00 0.00 H ATOM 70207 H2 WAT 5132 65.953 57.206 8.334 1.00 0.00 H TER 70209 WAT 5132 ATOM 70209 O WAT 5133 34.655 44.370 102.627 1.00 0.00 O ATOM 70210 H1 WAT 5133 34.493 43.429 102.695 1.00 0.00 H ATOM 70211 H2 WAT 5133 35.503 44.435 102.187 1.00 0.00 H TER 70213 WAT 5133 ATOM 70213 O WAT 5134 96.252 85.025 23.598 1.00 0.00 O ATOM 70214 H1 WAT 5134 95.706 84.458 24.142 1.00 0.00 H ATOM 70215 H2 WAT 5134 97.094 85.054 24.052 1.00 0.00 H TER 70217 WAT 5134 ATOM 70217 O WAT 5135 67.537 3.709 125.787 1.00 0.00 O ATOM 70218 H1 WAT 5135 67.022 4.009 125.038 1.00 0.00 H ATOM 70219 H2 WAT 5135 68.122 4.440 125.984 1.00 0.00 H TER 70221 WAT 5135 ATOM 70221 O WAT 5136 94.627 37.974 60.609 1.00 0.00 O ATOM 70222 H1 WAT 5136 94.106 38.710 60.290 1.00 0.00 H ATOM 70223 H2 WAT 5136 94.072 37.207 60.465 1.00 0.00 H TER 70225 WAT 5136 ATOM 70225 O WAT 5137 31.423 79.073 144.172 1.00 0.00 O ATOM 70226 H1 WAT 5137 30.920 78.296 143.928 1.00 0.00 H ATOM 70227 H2 WAT 5137 30.794 79.792 144.122 1.00 0.00 H TER 70229 WAT 5137 ATOM 70229 O WAT 5138 19.536 135.961 84.144 1.00 0.00 O ATOM 70230 H1 WAT 5138 18.584 136.008 84.052 1.00 0.00 H ATOM 70231 H2 WAT 5138 19.686 135.187 84.688 1.00 0.00 H TER 70233 WAT 5138 ATOM 70233 O WAT 5139 8.442 140.733 109.594 1.00 0.00 O ATOM 70234 H1 WAT 5139 8.126 141.637 109.608 1.00 0.00 H ATOM 70235 H2 WAT 5139 7.648 140.202 109.526 1.00 0.00 H TER 70237 WAT 5139 ATOM 70237 O WAT 5140 142.314 7.853 121.287 1.00 0.00 O ATOM 70238 H1 WAT 5140 141.770 8.127 122.025 1.00 0.00 H ATOM 70239 H2 WAT 5140 141.999 6.975 121.071 1.00 0.00 H TER 70241 WAT 5140 ATOM 70241 O WAT 5141 40.506 128.906 144.510 1.00 0.00 O ATOM 70242 H1 WAT 5141 41.270 128.413 144.810 1.00 0.00 H ATOM 70243 H2 WAT 5141 39.922 128.244 144.141 1.00 0.00 H TER 70245 WAT 5141 ATOM 70245 O WAT 5142 130.199 93.519 132.832 1.00 0.00 O ATOM 70246 H1 WAT 5142 130.031 94.421 132.558 1.00 0.00 H ATOM 70247 H2 WAT 5142 129.408 93.042 132.582 1.00 0.00 H TER 70249 WAT 5142 ATOM 70249 O WAT 5143 141.374 76.681 84.213 1.00 0.00 O ATOM 70250 H1 WAT 5143 141.706 76.234 83.434 1.00 0.00 H ATOM 70251 H2 WAT 5143 140.620 76.159 84.485 1.00 0.00 H TER 70253 WAT 5143 ATOM 70253 O WAT 5144 115.904 17.335 8.003 1.00 0.00 O ATOM 70254 H1 WAT 5144 115.178 17.932 8.184 1.00 0.00 H ATOM 70255 H2 WAT 5144 116.412 17.322 8.814 1.00 0.00 H TER 70257 WAT 5144 ATOM 70257 O WAT 5145 125.562 145.358 4.784 1.00 0.00 O ATOM 70258 H1 WAT 5145 126.217 145.818 4.259 1.00 0.00 H ATOM 70259 H2 WAT 5145 126.055 144.678 5.241 1.00 0.00 H TER 70261 WAT 5145 ATOM 70261 O WAT 5146 95.832 32.896 136.939 1.00 0.00 O ATOM 70262 H1 WAT 5146 95.032 32.774 136.427 1.00 0.00 H ATOM 70263 H2 WAT 5146 95.634 32.503 137.790 1.00 0.00 H TER 70265 WAT 5146 ATOM 70265 O WAT 5147 145.134 23.215 65.050 1.00 0.00 O ATOM 70266 H1 WAT 5147 144.448 23.738 64.635 1.00 0.00 H ATOM 70267 H2 WAT 5147 144.730 22.359 65.191 1.00 0.00 H TER 70269 WAT 5147 ATOM 70269 O WAT 5148 28.698 72.791 124.384 1.00 0.00 O ATOM 70270 H1 WAT 5148 28.574 73.737 124.311 1.00 0.00 H ATOM 70271 H2 WAT 5148 28.348 72.570 125.247 1.00 0.00 H TER 70273 WAT 5148 ATOM 70273 O WAT 5149 8.244 133.862 25.185 1.00 0.00 O ATOM 70274 H1 WAT 5149 7.926 133.292 24.485 1.00 0.00 H ATOM 70275 H2 WAT 5149 8.065 133.375 25.990 1.00 0.00 H TER 70277 WAT 5149 ATOM 70277 O WAT 5150 34.964 61.140 76.849 1.00 0.00 O ATOM 70278 H1 WAT 5150 34.668 61.800 76.223 1.00 0.00 H ATOM 70279 H2 WAT 5150 34.860 60.308 76.387 1.00 0.00 H TER 70281 WAT 5150 ATOM 70281 O WAT 5151 25.087 90.310 106.855 1.00 0.00 O ATOM 70282 H1 WAT 5151 25.880 90.198 107.378 1.00 0.00 H ATOM 70283 H2 WAT 5151 24.870 89.427 106.556 1.00 0.00 H TER 70285 WAT 5151 ATOM 70285 O WAT 5152 49.259 10.672 84.697 1.00 0.00 O ATOM 70286 H1 WAT 5152 49.239 10.250 85.555 1.00 0.00 H ATOM 70287 H2 WAT 5152 49.767 10.076 84.147 1.00 0.00 H TER 70289 WAT 5152 ATOM 70289 O WAT 5153 137.065 44.545 111.829 1.00 0.00 O ATOM 70290 H1 WAT 5153 137.444 43.890 111.242 1.00 0.00 H ATOM 70291 H2 WAT 5153 137.815 44.905 112.302 1.00 0.00 H TER 70293 WAT 5153 ATOM 70293 O WAT 5154 136.014 10.455 136.350 1.00 0.00 O ATOM 70294 H1 WAT 5154 136.655 11.045 135.951 1.00 0.00 H ATOM 70295 H2 WAT 5154 136.521 9.679 136.591 1.00 0.00 H TER 70297 WAT 5154 ATOM 70297 O WAT 5155 42.682 69.284 70.449 1.00 0.00 O ATOM 70298 H1 WAT 5155 43.370 69.483 69.814 1.00 0.00 H ATOM 70299 H2 WAT 5155 42.927 68.432 70.808 1.00 0.00 H TER 70301 WAT 5155 ATOM 70301 O WAT 5156 106.083 40.630 58.107 1.00 0.00 O ATOM 70302 H1 WAT 5156 106.815 40.287 58.620 1.00 0.00 H ATOM 70303 H2 WAT 5156 105.322 40.141 58.417 1.00 0.00 H TER 70305 WAT 5156 ATOM 70305 O WAT 5157 129.359 109.190 86.903 1.00 0.00 O ATOM 70306 H1 WAT 5157 128.841 108.592 87.442 1.00 0.00 H ATOM 70307 H2 WAT 5157 129.239 108.871 86.009 1.00 0.00 H TER 70309 WAT 5157 ATOM 70309 O WAT 5158 67.118 79.594 115.584 1.00 0.00 O ATOM 70310 H1 WAT 5158 66.325 79.701 116.109 1.00 0.00 H ATOM 70311 H2 WAT 5158 66.856 79.010 114.871 1.00 0.00 H TER 70313 WAT 5158 ATOM 70313 O WAT 5159 7.353 19.891 102.968 1.00 0.00 O ATOM 70314 H1 WAT 5159 7.246 20.406 103.768 1.00 0.00 H ATOM 70315 H2 WAT 5159 8.016 20.364 102.466 1.00 0.00 H TER 70317 WAT 5159 ATOM 70317 O WAT 5160 114.783 61.909 120.014 1.00 0.00 O ATOM 70318 H1 WAT 5160 114.180 61.401 120.557 1.00 0.00 H ATOM 70319 H2 WAT 5160 115.311 61.251 119.562 1.00 0.00 H TER 70321 WAT 5160 ATOM 70321 O WAT 5161 9.676 33.610 155.510 1.00 0.00 O ATOM 70322 H1 WAT 5161 10.572 33.515 155.189 1.00 0.00 H ATOM 70323 H2 WAT 5161 9.360 32.711 155.610 1.00 0.00 H TER 70325 WAT 5161 ATOM 70325 O WAT 5162 111.190 13.733 83.304 1.00 0.00 O ATOM 70326 H1 WAT 5162 111.342 14.645 83.550 1.00 0.00 H ATOM 70327 H2 WAT 5162 111.392 13.701 82.369 1.00 0.00 H TER 70329 WAT 5162 ATOM 70329 O WAT 5163 126.054 113.708 94.876 1.00 0.00 O ATOM 70330 H1 WAT 5163 126.125 113.734 95.830 1.00 0.00 H ATOM 70331 H2 WAT 5163 125.116 113.620 94.707 1.00 0.00 H TER 70333 WAT 5163 ATOM 70333 O WAT 5164 3.548 143.698 100.839 1.00 0.00 O ATOM 70334 H1 WAT 5164 4.374 144.131 101.051 1.00 0.00 H ATOM 70335 H2 WAT 5164 3.745 142.763 100.901 1.00 0.00 H TER 70337 WAT 5164 ATOM 70337 O WAT 5165 30.375 132.827 4.768 1.00 0.00 O ATOM 70338 H1 WAT 5165 30.108 133.578 5.298 1.00 0.00 H ATOM 70339 H2 WAT 5165 30.609 133.204 3.920 1.00 0.00 H TER 70341 WAT 5165 ATOM 70341 O WAT 5166 44.222 72.245 156.349 1.00 0.00 O ATOM 70342 H1 WAT 5166 44.741 73.043 156.456 1.00 0.00 H ATOM 70343 H2 WAT 5166 43.362 72.555 156.065 1.00 0.00 H TER 70345 WAT 5166 ATOM 70345 O WAT 5167 60.471 54.977 104.975 1.00 0.00 O ATOM 70346 H1 WAT 5167 61.048 54.967 104.212 1.00 0.00 H ATOM 70347 H2 WAT 5167 61.052 54.808 105.717 1.00 0.00 H TER 70349 WAT 5167 ATOM 70349 O WAT 5168 11.815 133.142 81.271 1.00 0.00 O ATOM 70350 H1 WAT 5168 11.411 132.365 81.657 1.00 0.00 H ATOM 70351 H2 WAT 5168 11.211 133.854 81.480 1.00 0.00 H TER 70353 WAT 5168 ATOM 70353 O WAT 5169 127.928 98.844 87.909 1.00 0.00 O ATOM 70354 H1 WAT 5169 127.231 99.494 87.998 1.00 0.00 H ATOM 70355 H2 WAT 5169 128.063 98.765 86.965 1.00 0.00 H TER 70357 WAT 5169 ATOM 70357 O WAT 5170 5.052 0.249 139.401 1.00 0.00 O ATOM 70358 H1 WAT 5170 5.837 0.746 139.172 1.00 0.00 H ATOM 70359 H2 WAT 5170 4.402 0.917 139.622 1.00 0.00 H TER 70361 WAT 5170 ATOM 70361 O WAT 5171 92.277 130.125 133.983 1.00 0.00 O ATOM 70362 H1 WAT 5171 92.551 130.932 133.547 1.00 0.00 H ATOM 70363 H2 WAT 5171 92.235 130.357 134.911 1.00 0.00 H TER 70365 WAT 5171 ATOM 70365 O WAT 5172 2.861 74.961 126.833 1.00 0.00 O ATOM 70366 H1 WAT 5172 1.924 75.053 126.661 1.00 0.00 H ATOM 70367 H2 WAT 5172 3.095 75.754 127.316 1.00 0.00 H TER 70369 WAT 5172 ATOM 70369 O WAT 5173 5.510 73.729 75.081 1.00 0.00 O ATOM 70370 H1 WAT 5173 6.215 73.435 75.658 1.00 0.00 H ATOM 70371 H2 WAT 5173 5.733 73.365 74.225 1.00 0.00 H TER 70373 WAT 5173 ATOM 70373 O WAT 5174 139.147 30.355 137.956 1.00 0.00 O ATOM 70374 H1 WAT 5174 139.045 31.251 138.277 1.00 0.00 H ATOM 70375 H2 WAT 5174 139.936 30.383 137.415 1.00 0.00 H TER 70377 WAT 5174 ATOM 70377 O WAT 5175 74.402 34.578 153.054 1.00 0.00 O ATOM 70378 H1 WAT 5175 74.743 34.871 152.208 1.00 0.00 H ATOM 70379 H2 WAT 5175 74.827 35.149 153.694 1.00 0.00 H TER 70381 WAT 5175 ATOM 70381 O WAT 5176 56.064 55.989 150.930 1.00 0.00 O ATOM 70382 H1 WAT 5176 56.912 55.713 150.584 1.00 0.00 H ATOM 70383 H2 WAT 5176 55.539 56.179 150.152 1.00 0.00 H TER 70385 WAT 5176 ATOM 70385 O WAT 5177 48.189 36.416 21.504 1.00 0.00 O ATOM 70386 H1 WAT 5177 48.938 36.038 21.044 1.00 0.00 H ATOM 70387 H2 WAT 5177 48.527 36.638 22.371 1.00 0.00 H TER 70389 WAT 5177 ATOM 70389 O WAT 5178 5.090 42.138 105.403 1.00 0.00 O ATOM 70390 H1 WAT 5178 4.281 41.791 105.027 1.00 0.00 H ATOM 70391 H2 WAT 5178 5.223 42.974 104.955 1.00 0.00 H TER 70393 WAT 5178 ATOM 70393 O WAT 5179 89.027 79.022 70.514 1.00 0.00 O ATOM 70394 H1 WAT 5179 89.818 79.295 70.049 1.00 0.00 H ATOM 70395 H2 WAT 5179 89.109 79.419 71.381 1.00 0.00 H TER 70397 WAT 5179 ATOM 70397 O WAT 5180 97.062 85.309 132.982 1.00 0.00 O ATOM 70398 H1 WAT 5180 97.488 85.904 132.365 1.00 0.00 H ATOM 70399 H2 WAT 5180 96.990 84.481 132.506 1.00 0.00 H TER 70401 WAT 5180 ATOM 70401 O WAT 5181 48.341 23.111 111.913 1.00 0.00 O ATOM 70402 H1 WAT 5181 48.271 22.618 111.095 1.00 0.00 H ATOM 70403 H2 WAT 5181 47.546 22.888 112.397 1.00 0.00 H TER 70405 WAT 5181 ATOM 70405 O WAT 5182 3.642 20.105 142.598 1.00 0.00 O ATOM 70406 H1 WAT 5182 3.543 20.992 142.943 1.00 0.00 H ATOM 70407 H2 WAT 5182 4.512 19.830 142.889 1.00 0.00 H TER 70409 WAT 5182 ATOM 70409 O WAT 5183 11.598 145.727 21.463 1.00 0.00 O ATOM 70410 H1 WAT 5183 12.287 145.873 22.111 1.00 0.00 H ATOM 70411 H2 WAT 5183 11.259 144.855 21.666 1.00 0.00 H TER 70413 WAT 5183 ATOM 70413 O WAT 5184 89.577 138.401 92.121 1.00 0.00 O ATOM 70414 H1 WAT 5184 90.364 137.954 92.434 1.00 0.00 H ATOM 70415 H2 WAT 5184 89.508 139.179 92.674 1.00 0.00 H TER 70417 WAT 5184 ATOM 70417 O WAT 5185 118.896 0.353 145.282 1.00 0.00 O ATOM 70418 H1 WAT 5185 118.497 -0.508 145.410 1.00 0.00 H ATOM 70419 H2 WAT 5185 119.055 0.406 144.340 1.00 0.00 H TER 70421 WAT 5185 ATOM 70421 O WAT 5186 116.713 69.836 62.520 1.00 0.00 O ATOM 70422 H1 WAT 5186 116.563 68.900 62.386 1.00 0.00 H ATOM 70423 H2 WAT 5186 117.650 69.953 62.363 1.00 0.00 H TER 70425 WAT 5186 ATOM 70425 O WAT 5187 144.545 36.913 117.873 1.00 0.00 O ATOM 70426 H1 WAT 5187 144.478 37.809 117.543 1.00 0.00 H ATOM 70427 H2 WAT 5187 145.485 36.767 117.980 1.00 0.00 H TER 70429 WAT 5187 ATOM 70429 O WAT 5188 59.106 36.044 142.474 1.00 0.00 O ATOM 70430 H1 WAT 5188 58.897 35.500 143.234 1.00 0.00 H ATOM 70431 H2 WAT 5188 58.396 35.872 141.855 1.00 0.00 H TER 70433 WAT 5188 ATOM 70433 O WAT 5189 85.112 62.772 71.307 1.00 0.00 O ATOM 70434 H1 WAT 5189 84.705 63.000 72.143 1.00 0.00 H ATOM 70435 H2 WAT 5189 84.400 62.832 70.670 1.00 0.00 H TER 70437 WAT 5189 ATOM 70437 O WAT 5190 91.343 4.117 113.399 1.00 0.00 O ATOM 70438 H1 WAT 5190 90.394 4.162 113.278 1.00 0.00 H ATOM 70439 H2 WAT 5190 91.455 3.747 114.275 1.00 0.00 H TER 70441 WAT 5190 ATOM 70441 O WAT 5191 78.713 142.492 109.550 1.00 0.00 O ATOM 70442 H1 WAT 5191 79.594 142.519 109.923 1.00 0.00 H ATOM 70443 H2 WAT 5191 78.454 141.573 109.611 1.00 0.00 H TER 70445 WAT 5191 ATOM 70445 O WAT 5192 57.550 11.826 144.020 1.00 0.00 O ATOM 70446 H1 WAT 5192 58.447 12.161 144.002 1.00 0.00 H ATOM 70447 H2 WAT 5192 57.314 11.823 144.947 1.00 0.00 H TER 70449 WAT 5192 ATOM 70449 O WAT 5193 8.976 44.182 124.410 1.00 0.00 O ATOM 70450 H1 WAT 5193 8.450 44.668 123.775 1.00 0.00 H ATOM 70451 H2 WAT 5193 9.480 44.854 124.868 1.00 0.00 H TER 70453 WAT 5193 ATOM 70453 O WAT 5194 48.406 70.271 133.441 1.00 0.00 O ATOM 70454 H1 WAT 5194 48.213 71.169 133.169 1.00 0.00 H ATOM 70455 H2 WAT 5194 48.235 69.743 132.661 1.00 0.00 H TER 70457 WAT 5194 ATOM 70457 O WAT 5195 122.460 68.162 155.954 1.00 0.00 O ATOM 70458 H1 WAT 5195 122.178 69.051 155.740 1.00 0.00 H ATOM 70459 H2 WAT 5195 122.599 68.176 156.901 1.00 0.00 H TER 70461 WAT 5195 ATOM 70461 O WAT 5196 38.171 90.369 91.771 1.00 0.00 O ATOM 70462 H1 WAT 5196 38.946 89.947 92.143 1.00 0.00 H ATOM 70463 H2 WAT 5196 37.573 89.646 91.579 1.00 0.00 H TER 70465 WAT 5196 ATOM 70465 O WAT 5197 43.736 81.152 78.788 1.00 0.00 O ATOM 70466 H1 WAT 5197 43.177 81.692 79.346 1.00 0.00 H ATOM 70467 H2 WAT 5197 43.688 81.567 77.927 1.00 0.00 H TER 70469 WAT 5197 ATOM 70469 O WAT 5198 61.092 45.410 54.826 1.00 0.00 O ATOM 70470 H1 WAT 5198 61.898 44.915 54.967 1.00 0.00 H ATOM 70471 H2 WAT 5198 60.408 44.743 54.764 1.00 0.00 H TER 70473 WAT 5198 ATOM 70473 O WAT 5199 53.922 145.508 76.943 1.00 0.00 O ATOM 70474 H1 WAT 5199 53.654 146.422 76.849 1.00 0.00 H ATOM 70475 H2 WAT 5199 54.510 145.353 76.204 1.00 0.00 H TER 70477 WAT 5199 ATOM 70477 O WAT 5200 27.772 128.681 66.108 1.00 0.00 O ATOM 70478 H1 WAT 5200 26.822 128.734 66.213 1.00 0.00 H ATOM 70479 H2 WAT 5200 28.044 127.999 66.722 1.00 0.00 H TER 70481 WAT 5200 ATOM 70481 O WAT 5201 0.070 32.700 55.688 1.00 0.00 O ATOM 70482 H1 WAT 5201 0.912 32.556 56.120 1.00 0.00 H ATOM 70483 H2 WAT 5201 -0.542 32.863 56.406 1.00 0.00 H TER 70485 WAT 5201 ATOM 70485 O WAT 5202 143.670 108.463 83.499 1.00 0.00 O ATOM 70486 H1 WAT 5202 143.335 109.326 83.255 1.00 0.00 H ATOM 70487 H2 WAT 5202 143.034 107.848 83.136 1.00 0.00 H TER 70489 WAT 5202 ATOM 70489 O WAT 5203 107.665 138.168 85.460 1.00 0.00 O ATOM 70490 H1 WAT 5203 106.861 138.160 84.940 1.00 0.00 H ATOM 70491 H2 WAT 5203 107.372 138.008 86.357 1.00 0.00 H TER 70493 WAT 5203 ATOM 70493 O WAT 5204 102.635 51.626 10.453 1.00 0.00 O ATOM 70494 H1 WAT 5204 101.839 51.355 9.996 1.00 0.00 H ATOM 70495 H2 WAT 5204 102.383 51.657 11.376 1.00 0.00 H TER 70497 WAT 5204 ATOM 70497 O WAT 5205 125.048 36.692 61.665 1.00 0.00 O ATOM 70498 H1 WAT 5205 124.257 36.935 61.184 1.00 0.00 H ATOM 70499 H2 WAT 5205 125.372 35.912 61.215 1.00 0.00 H TER 70501 WAT 5205 ATOM 70501 O WAT 5206 58.338 73.294 58.442 1.00 0.00 O ATOM 70502 H1 WAT 5206 58.141 73.715 59.279 1.00 0.00 H ATOM 70503 H2 WAT 5206 57.508 73.310 57.964 1.00 0.00 H TER 70505 WAT 5206 ATOM 70505 O WAT 5207 48.454 106.092 145.099 1.00 0.00 O ATOM 70506 H1 WAT 5207 49.377 106.313 144.974 1.00 0.00 H ATOM 70507 H2 WAT 5207 47.997 106.931 145.044 1.00 0.00 H TER 70509 WAT 5207 ATOM 70509 O WAT 5208 2.515 144.097 17.773 1.00 0.00 O ATOM 70510 H1 WAT 5208 2.174 143.414 17.196 1.00 0.00 H ATOM 70511 H2 WAT 5208 2.217 143.843 18.647 1.00 0.00 H TER 70513 WAT 5208 ATOM 70513 O WAT 5209 63.724 85.773 125.437 1.00 0.00 O ATOM 70514 H1 WAT 5209 64.283 85.428 126.133 1.00 0.00 H ATOM 70515 H2 WAT 5209 64.331 86.195 124.829 1.00 0.00 H TER 70517 WAT 5209 ATOM 70517 O WAT 5210 26.040 24.341 72.286 1.00 0.00 O ATOM 70518 H1 WAT 5210 25.418 24.790 72.858 1.00 0.00 H ATOM 70519 H2 WAT 5210 26.606 25.037 71.953 1.00 0.00 H TER 70521 WAT 5210 ATOM 70521 O WAT 5211 84.347 81.014 158.406 1.00 0.00 O ATOM 70522 H1 WAT 5211 85.031 81.539 157.989 1.00 0.00 H ATOM 70523 H2 WAT 5211 84.236 81.409 159.271 1.00 0.00 H TER 70525 WAT 5211 ATOM 70525 O WAT 5212 64.292 103.896 133.238 1.00 0.00 O ATOM 70526 H1 WAT 5212 64.332 103.756 132.292 1.00 0.00 H ATOM 70527 H2 WAT 5212 65.189 104.123 133.485 1.00 0.00 H TER 70529 WAT 5212 ATOM 70529 O WAT 5213 26.971 103.250 73.443 1.00 0.00 O ATOM 70530 H1 WAT 5213 27.100 102.503 72.858 1.00 0.00 H ATOM 70531 H2 WAT 5213 27.492 103.952 73.053 1.00 0.00 H TER 70533 WAT 5213 ATOM 70533 O WAT 5214 68.112 112.779 93.254 1.00 0.00 O ATOM 70534 H1 WAT 5214 67.265 113.123 92.970 1.00 0.00 H ATOM 70535 H2 WAT 5214 67.944 112.417 94.124 1.00 0.00 H TER 70537 WAT 5214 ATOM 70537 O WAT 5215 103.033 67.733 83.074 1.00 0.00 O ATOM 70538 H1 WAT 5215 102.641 67.033 83.597 1.00 0.00 H ATOM 70539 H2 WAT 5215 103.975 67.641 83.219 1.00 0.00 H TER 70541 WAT 5215 ATOM 70541 O WAT 5216 13.769 10.561 148.477 1.00 0.00 O ATOM 70542 H1 WAT 5216 13.535 11.488 148.509 1.00 0.00 H ATOM 70543 H2 WAT 5216 12.958 10.117 148.229 1.00 0.00 H TER 70545 WAT 5216 ATOM 70545 O WAT 5217 0.078 29.458 146.605 1.00 0.00 O ATOM 70546 H1 WAT 5217 0.199 30.158 145.963 1.00 0.00 H ATOM 70547 H2 WAT 5217 0.184 29.889 147.453 1.00 0.00 H TER 70549 WAT 5217 ATOM 70549 O WAT 5218 126.288 46.900 139.828 1.00 0.00 O ATOM 70550 H1 WAT 5218 127.026 46.693 140.401 1.00 0.00 H ATOM 70551 H2 WAT 5218 126.669 47.436 139.132 1.00 0.00 H TER 70553 WAT 5218 ATOM 70553 O WAT 5219 45.236 68.596 6.806 1.00 0.00 O ATOM 70554 H1 WAT 5219 44.816 69.419 6.557 1.00 0.00 H ATOM 70555 H2 WAT 5219 45.176 68.050 6.022 1.00 0.00 H TER 70557 WAT 5219 ATOM 70557 O WAT 5220 46.475 38.456 129.417 1.00 0.00 O ATOM 70558 H1 WAT 5220 47.304 38.810 129.095 1.00 0.00 H ATOM 70559 H2 WAT 5220 46.431 37.575 129.046 1.00 0.00 H TER 70561 WAT 5220 ATOM 70561 O WAT 5221 131.640 68.082 136.472 1.00 0.00 O ATOM 70562 H1 WAT 5221 130.996 68.640 136.035 1.00 0.00 H ATOM 70563 H2 WAT 5221 132.212 67.779 135.767 1.00 0.00 H TER 70565 WAT 5221 ATOM 70565 O WAT 5222 84.646 6.802 155.607 1.00 0.00 O ATOM 70566 H1 WAT 5222 84.449 7.578 155.082 1.00 0.00 H ATOM 70567 H2 WAT 5222 83.792 6.501 155.918 1.00 0.00 H TER 70569 WAT 5222 ATOM 70569 O WAT 5223 144.246 41.528 140.797 1.00 0.00 O ATOM 70570 H1 WAT 5223 144.270 42.096 141.567 1.00 0.00 H ATOM 70571 H2 WAT 5223 143.531 41.877 140.264 1.00 0.00 H TER 70573 WAT 5223 ATOM 70573 O WAT 5224 61.375 84.176 152.974 1.00 0.00 O ATOM 70574 H1 WAT 5224 62.094 84.801 152.872 1.00 0.00 H ATOM 70575 H2 WAT 5224 60.768 84.606 153.576 1.00 0.00 H TER 70577 WAT 5224 ATOM 70577 O WAT 5225 17.800 93.465 99.681 1.00 0.00 O ATOM 70578 H1 WAT 5225 17.024 94.025 99.715 1.00 0.00 H ATOM 70579 H2 WAT 5225 17.748 93.036 98.826 1.00 0.00 H TER 70581 WAT 5225 ATOM 70581 O WAT 5226 35.456 56.761 121.731 1.00 0.00 O ATOM 70582 H1 WAT 5226 36.269 57.243 121.577 1.00 0.00 H ATOM 70583 H2 WAT 5226 34.775 57.433 121.729 1.00 0.00 H TER 70585 WAT 5226 ATOM 70585 O WAT 5227 49.413 36.050 55.988 1.00 0.00 O ATOM 70586 H1 WAT 5227 48.978 36.829 56.334 1.00 0.00 H ATOM 70587 H2 WAT 5227 49.511 35.473 56.746 1.00 0.00 H TER 70589 WAT 5227 ATOM 70589 O WAT 5228 126.682 3.647 19.611 1.00 0.00 O ATOM 70590 H1 WAT 5228 126.287 2.808 19.851 1.00 0.00 H ATOM 70591 H2 WAT 5228 127.284 3.432 18.898 1.00 0.00 H TER 70593 WAT 5228 ATOM 70593 O WAT 5229 59.681 31.796 102.376 1.00 0.00 O ATOM 70594 H1 WAT 5229 59.955 31.627 101.475 1.00 0.00 H ATOM 70595 H2 WAT 5229 59.030 32.493 102.302 1.00 0.00 H TER 70597 WAT 5229 ATOM 70597 O WAT 5230 67.755 58.357 80.559 1.00 0.00 O ATOM 70598 H1 WAT 5230 68.051 59.174 80.159 1.00 0.00 H ATOM 70599 H2 WAT 5230 66.799 58.413 80.540 1.00 0.00 H TER 70601 WAT 5230 ATOM 70601 O WAT 5231 8.367 139.104 93.065 1.00 0.00 O ATOM 70602 H1 WAT 5231 8.135 138.209 92.816 1.00 0.00 H ATOM 70603 H2 WAT 5231 9.191 139.013 93.543 1.00 0.00 H TER 70605 WAT 5231 ATOM 70605 O WAT 5232 62.519 143.640 120.606 1.00 0.00 O ATOM 70606 H1 WAT 5232 62.024 142.821 120.596 1.00 0.00 H ATOM 70607 H2 WAT 5232 63.431 143.368 120.708 1.00 0.00 H TER 70609 WAT 5232 ATOM 70609 O WAT 5233 128.911 124.063 101.535 1.00 0.00 O ATOM 70610 H1 WAT 5233 128.482 123.503 102.181 1.00 0.00 H ATOM 70611 H2 WAT 5233 129.147 124.853 102.021 1.00 0.00 H TER 70613 WAT 5233 ATOM 70613 O WAT 5234 0.510 138.480 88.643 1.00 0.00 O ATOM 70614 H1 WAT 5234 0.823 138.118 89.472 1.00 0.00 H ATOM 70615 H2 WAT 5234 1.088 138.098 87.982 1.00 0.00 H TER 70617 WAT 5234 ATOM 70617 O WAT 5235 85.375 102.661 16.130 1.00 0.00 O ATOM 70618 H1 WAT 5235 86.131 102.135 15.871 1.00 0.00 H ATOM 70619 H2 WAT 5235 85.738 103.335 16.705 1.00 0.00 H TER 70621 WAT 5235 ATOM 70621 O WAT 5236 4.574 11.856 140.609 1.00 0.00 O ATOM 70622 H1 WAT 5236 4.561 12.098 141.535 1.00 0.00 H ATOM 70623 H2 WAT 5236 5.037 11.019 140.587 1.00 0.00 H TER 70625 WAT 5236 ATOM 70625 O WAT 5237 50.886 0.484 64.241 1.00 0.00 O ATOM 70626 H1 WAT 5237 51.209 0.788 63.393 1.00 0.00 H ATOM 70627 H2 WAT 5237 50.315 -0.255 64.029 1.00 0.00 H TER 70629 WAT 5237 ATOM 70629 O WAT 5238 100.043 6.812 141.795 1.00 0.00 O ATOM 70630 H1 WAT 5238 100.141 7.763 141.741 1.00 0.00 H ATOM 70631 H2 WAT 5238 100.829 6.516 142.253 1.00 0.00 H TER 70633 WAT 5238 ATOM 70633 O WAT 5239 130.273 85.151 141.007 1.00 0.00 O ATOM 70634 H1 WAT 5239 129.557 85.475 141.553 1.00 0.00 H ATOM 70635 H2 WAT 5239 129.859 84.941 140.170 1.00 0.00 H TER 70637 WAT 5239 ATOM 70637 O WAT 5240 106.865 79.747 116.212 1.00 0.00 O ATOM 70638 H1 WAT 5240 106.057 79.759 116.726 1.00 0.00 H ATOM 70639 H2 WAT 5240 107.491 79.274 116.762 1.00 0.00 H TER 70641 WAT 5240 ATOM 70641 O WAT 5241 121.228 126.483 65.214 1.00 0.00 O ATOM 70642 H1 WAT 5241 122.073 126.719 64.830 1.00 0.00 H ATOM 70643 H2 WAT 5241 121.301 125.546 65.395 1.00 0.00 H TER 70645 WAT 5241 ATOM 70645 O WAT 5242 68.504 83.031 7.427 1.00 0.00 O ATOM 70646 H1 WAT 5242 68.299 82.385 8.103 1.00 0.00 H ATOM 70647 H2 WAT 5242 68.335 82.576 6.602 1.00 0.00 H TER 70649 WAT 5242 ATOM 70649 O WAT 5243 63.282 112.790 129.512 1.00 0.00 O ATOM 70650 H1 WAT 5243 62.580 112.153 129.649 1.00 0.00 H ATOM 70651 H2 WAT 5243 63.045 113.530 130.072 1.00 0.00 H TER 70653 WAT 5243 ATOM 70653 O WAT 5244 40.316 41.800 70.541 1.00 0.00 O ATOM 70654 H1 WAT 5244 39.811 41.546 69.768 1.00 0.00 H ATOM 70655 H2 WAT 5244 40.017 41.204 71.228 1.00 0.00 H TER 70657 WAT 5244 ATOM 70657 O WAT 5245 98.921 142.029 89.674 1.00 0.00 O ATOM 70658 H1 WAT 5245 99.647 141.546 89.279 1.00 0.00 H ATOM 70659 H2 WAT 5245 99.139 142.070 90.605 1.00 0.00 H TER 70661 WAT 5245 ATOM 70661 O WAT 5246 118.213 102.916 85.241 1.00 0.00 O ATOM 70662 H1 WAT 5246 118.298 102.053 84.835 1.00 0.00 H ATOM 70663 H2 WAT 5246 118.260 103.531 84.509 1.00 0.00 H TER 70665 WAT 5246 ATOM 70665 O WAT 5247 67.095 27.096 145.200 1.00 0.00 O ATOM 70666 H1 WAT 5247 66.558 26.410 144.803 1.00 0.00 H ATOM 70667 H2 WAT 5247 67.060 27.819 144.575 1.00 0.00 H TER 70669 WAT 5247 ATOM 70669 O WAT 5248 133.550 130.783 62.528 1.00 0.00 O ATOM 70670 H1 WAT 5248 133.270 130.708 61.616 1.00 0.00 H ATOM 70671 H2 WAT 5248 132.739 130.724 63.034 1.00 0.00 H TER 70673 WAT 5248 ATOM 70673 O WAT 5249 119.565 29.924 16.473 1.00 0.00 O ATOM 70674 H1 WAT 5249 119.437 30.790 16.085 1.00 0.00 H ATOM 70675 H2 WAT 5249 120.449 29.671 16.206 1.00 0.00 H TER 70677 WAT 5249 ATOM 70677 O WAT 5250 28.465 75.087 90.120 1.00 0.00 O ATOM 70678 H1 WAT 5250 28.810 75.559 90.878 1.00 0.00 H ATOM 70679 H2 WAT 5250 28.859 74.217 90.180 1.00 0.00 H TER 70681 WAT 5250 ATOM 70681 O WAT 5251 28.815 37.938 74.809 1.00 0.00 O ATOM 70682 H1 WAT 5251 29.050 38.390 73.999 1.00 0.00 H ATOM 70683 H2 WAT 5251 27.922 37.627 74.660 1.00 0.00 H TER 70685 WAT 5251 ATOM 70685 O WAT 5252 14.420 51.418 101.325 1.00 0.00 O ATOM 70686 H1 WAT 5252 15.008 51.391 100.570 1.00 0.00 H ATOM 70687 H2 WAT 5252 14.703 50.687 101.875 1.00 0.00 H TER 70689 WAT 5252 ATOM 70689 O WAT 5253 36.312 81.651 101.168 1.00 0.00 O ATOM 70690 H1 WAT 5253 35.398 81.568 100.898 1.00 0.00 H ATOM 70691 H2 WAT 5253 36.772 80.976 100.668 1.00 0.00 H TER 70693 WAT 5253 ATOM 70693 O WAT 5254 80.348 86.501 151.741 1.00 0.00 O ATOM 70694 H1 WAT 5254 79.819 86.265 152.503 1.00 0.00 H ATOM 70695 H2 WAT 5254 81.205 86.724 152.105 1.00 0.00 H TER 70697 WAT 5254 ATOM 70697 O WAT 5255 29.117 69.264 110.491 1.00 0.00 O ATOM 70698 H1 WAT 5255 29.085 70.219 110.549 1.00 0.00 H ATOM 70699 H2 WAT 5255 29.577 68.991 111.285 1.00 0.00 H TER 70701 WAT 5255 ATOM 70701 O WAT 5256 142.385 44.387 114.821 1.00 0.00 O ATOM 70702 H1 WAT 5256 143.149 44.961 114.779 1.00 0.00 H ATOM 70703 H2 WAT 5256 142.436 43.861 114.023 1.00 0.00 H TER 70705 WAT 5256 ATOM 70705 O WAT 5257 99.735 75.039 79.690 1.00 0.00 O ATOM 70706 H1 WAT 5257 99.972 74.973 80.615 1.00 0.00 H ATOM 70707 H2 WAT 5257 98.830 75.350 79.697 1.00 0.00 H TER 70709 WAT 5257 ATOM 70709 O WAT 5258 109.980 105.231 110.329 1.00 0.00 O ATOM 70710 H1 WAT 5258 109.515 105.163 109.495 1.00 0.00 H ATOM 70711 H2 WAT 5258 110.722 105.806 110.143 1.00 0.00 H TER 70713 WAT 5258 ATOM 70713 O WAT 5259 111.445 53.656 111.714 1.00 0.00 O ATOM 70714 H1 WAT 5259 112.180 53.163 111.351 1.00 0.00 H ATOM 70715 H2 WAT 5259 111.837 54.204 112.394 1.00 0.00 H TER 70717 WAT 5259 ATOM 70717 O WAT 5260 94.145 32.495 148.053 1.00 0.00 O ATOM 70718 H1 WAT 5260 93.283 32.902 147.965 1.00 0.00 H ATOM 70719 H2 WAT 5260 94.745 33.109 147.629 1.00 0.00 H TER 70721 WAT 5260 ATOM 70721 O WAT 5261 42.197 74.855 11.348 1.00 0.00 O ATOM 70722 H1 WAT 5261 42.301 75.801 11.450 1.00 0.00 H ATOM 70723 H2 WAT 5261 43.092 74.519 11.308 1.00 0.00 H TER 70725 WAT 5261 ATOM 70725 O WAT 5262 87.746 81.214 57.562 1.00 0.00 O ATOM 70726 H1 WAT 5262 88.660 80.997 57.745 1.00 0.00 H ATOM 70727 H2 WAT 5262 87.250 80.747 58.233 1.00 0.00 H TER 70729 WAT 5262 ATOM 70729 O WAT 5263 68.957 106.295 83.286 1.00 0.00 O ATOM 70730 H1 WAT 5263 68.163 106.076 82.798 1.00 0.00 H ATOM 70731 H2 WAT 5263 68.714 106.179 84.204 1.00 0.00 H TER 70733 WAT 5263 ATOM 70733 O WAT 5264 134.651 35.517 113.749 1.00 0.00 O ATOM 70734 H1 WAT 5264 134.225 34.757 113.353 1.00 0.00 H ATOM 70735 H2 WAT 5264 134.508 35.409 114.690 1.00 0.00 H TER 70737 WAT 5264 ATOM 70737 O WAT 5265 61.516 42.815 11.614 1.00 0.00 O ATOM 70738 H1 WAT 5265 61.816 42.617 12.501 1.00 0.00 H ATOM 70739 H2 WAT 5265 60.619 42.483 11.585 1.00 0.00 H TER 70741 WAT 5265 ATOM 70741 O WAT 5266 84.989 132.548 11.618 1.00 0.00 O ATOM 70742 H1 WAT 5266 84.062 132.457 11.840 1.00 0.00 H ATOM 70743 H2 WAT 5266 84.995 132.696 10.672 1.00 0.00 H TER 70745 WAT 5266 ATOM 70745 O WAT 5267 43.038 86.314 75.070 1.00 0.00 O ATOM 70746 H1 WAT 5267 42.628 87.176 75.148 1.00 0.00 H ATOM 70747 H2 WAT 5267 43.232 86.225 74.137 1.00 0.00 H TER 70749 WAT 5267 ATOM 70749 O WAT 5268 82.973 91.962 129.604 1.00 0.00 O ATOM 70750 H1 WAT 5268 83.622 91.677 128.961 1.00 0.00 H ATOM 70751 H2 WAT 5268 82.343 92.475 129.099 1.00 0.00 H TER 70753 WAT 5268 ATOM 70753 O WAT 5269 45.280 140.807 145.095 1.00 0.00 O ATOM 70754 H1 WAT 5269 44.885 141.101 145.916 1.00 0.00 H ATOM 70755 H2 WAT 5269 46.000 140.237 145.365 1.00 0.00 H TER 70757 WAT 5269 ATOM 70757 O WAT 5270 38.245 92.047 136.720 1.00 0.00 O ATOM 70758 H1 WAT 5270 38.906 91.551 137.203 1.00 0.00 H ATOM 70759 H2 WAT 5270 38.293 92.930 137.086 1.00 0.00 H TER 70761 WAT 5270 ATOM 70761 O WAT 5271 137.352 71.835 96.002 1.00 0.00 O ATOM 70762 H1 WAT 5271 138.022 71.681 95.336 1.00 0.00 H ATOM 70763 H2 WAT 5271 137.841 71.897 96.823 1.00 0.00 H TER 70765 WAT 5271 ATOM 70765 O WAT 5272 91.168 29.238 14.378 1.00 0.00 O ATOM 70766 H1 WAT 5272 91.195 29.808 15.146 1.00 0.00 H ATOM 70767 H2 WAT 5272 90.243 29.014 14.277 1.00 0.00 H TER 70769 WAT 5272 ATOM 70769 O WAT 5273 118.259 110.565 1.553 1.00 0.00 O ATOM 70770 H1 WAT 5273 118.475 109.651 1.738 1.00 0.00 H ATOM 70771 H2 WAT 5273 118.879 110.825 0.872 1.00 0.00 H TER 70773 WAT 5273 ATOM 70773 O WAT 5274 97.938 3.002 114.401 1.00 0.00 O ATOM 70774 H1 WAT 5274 97.610 3.374 115.220 1.00 0.00 H ATOM 70775 H2 WAT 5274 97.304 3.280 113.740 1.00 0.00 H TER 70777 WAT 5274 ATOM 70777 O WAT 5275 55.459 7.931 142.321 1.00 0.00 O ATOM 70778 H1 WAT 5275 56.260 8.065 141.814 1.00 0.00 H ATOM 70779 H2 WAT 5275 55.027 8.785 142.317 1.00 0.00 H TER 70781 WAT 5275 ATOM 70781 O WAT 5276 51.012 18.409 91.174 1.00 0.00 O ATOM 70782 H1 WAT 5276 51.331 18.284 90.281 1.00 0.00 H ATOM 70783 H2 WAT 5276 50.127 18.043 91.167 1.00 0.00 H TER 70785 WAT 5276 ATOM 70785 O WAT 5277 47.658 76.650 123.700 1.00 0.00 O ATOM 70786 H1 WAT 5277 47.995 76.749 122.810 1.00 0.00 H ATOM 70787 H2 WAT 5277 46.772 77.011 123.662 1.00 0.00 H TER 70789 WAT 5277 ATOM 70789 O WAT 5278 94.708 8.430 73.929 1.00 0.00 O ATOM 70790 H1 WAT 5278 94.205 8.312 73.123 1.00 0.00 H ATOM 70791 H2 WAT 5278 95.182 7.605 74.037 1.00 0.00 H TER 70793 WAT 5278 ATOM 70793 O WAT 5279 69.911 80.294 132.589 1.00 0.00 O ATOM 70794 H1 WAT 5279 69.702 79.549 133.152 1.00 0.00 H ATOM 70795 H2 WAT 5279 70.289 79.901 131.802 1.00 0.00 H TER 70797 WAT 5279 ATOM 70797 O WAT 5280 108.639 42.292 79.796 1.00 0.00 O ATOM 70798 H1 WAT 5280 108.026 43.025 79.843 1.00 0.00 H ATOM 70799 H2 WAT 5280 108.494 41.806 80.607 1.00 0.00 H TER 70801 WAT 5280 ATOM 70801 O WAT 5281 20.954 39.109 59.670 1.00 0.00 O ATOM 70802 H1 WAT 5281 20.787 38.187 59.869 1.00 0.00 H ATOM 70803 H2 WAT 5281 21.576 39.390 60.341 1.00 0.00 H TER 70805 WAT 5281 ATOM 70805 O WAT 5282 108.562 73.637 77.459 1.00 0.00 O ATOM 70806 H1 WAT 5282 108.161 72.817 77.171 1.00 0.00 H ATOM 70807 H2 WAT 5282 108.950 73.430 78.309 1.00 0.00 H TER 70809 WAT 5282 ATOM 70809 O WAT 5283 79.989 134.834 3.269 1.00 0.00 O ATOM 70810 H1 WAT 5283 80.919 134.923 3.477 1.00 0.00 H ATOM 70811 H2 WAT 5283 79.821 133.893 3.320 1.00 0.00 H TER 70813 WAT 5283 ATOM 70813 O WAT 5284 66.174 112.071 139.723 1.00 0.00 O ATOM 70814 H1 WAT 5284 65.696 112.889 139.588 1.00 0.00 H ATOM 70815 H2 WAT 5284 66.067 111.593 138.901 1.00 0.00 H TER 70817 WAT 5284 ATOM 70817 O WAT 5285 54.766 38.769 17.626 1.00 0.00 O ATOM 70818 H1 WAT 5285 54.307 38.054 18.066 1.00 0.00 H ATOM 70819 H2 WAT 5285 55.396 38.332 17.052 1.00 0.00 H TER 70821 WAT 5285 ATOM 70821 O WAT 5286 73.569 95.968 82.961 1.00 0.00 O ATOM 70822 H1 WAT 5286 74.203 96.259 82.306 1.00 0.00 H ATOM 70823 H2 WAT 5286 72.850 95.597 82.450 1.00 0.00 H TER 70825 WAT 5286 ATOM 70825 O WAT 5287 58.121 108.505 96.820 1.00 0.00 O ATOM 70826 H1 WAT 5287 57.452 109.149 96.590 1.00 0.00 H ATOM 70827 H2 WAT 5287 58.658 108.942 97.481 1.00 0.00 H TER 70829 WAT 5287 ATOM 70829 O WAT 5288 41.293 101.229 83.164 1.00 0.00 O ATOM 70830 H1 WAT 5288 42.133 101.595 83.443 1.00 0.00 H ATOM 70831 H2 WAT 5288 40.872 100.950 83.977 1.00 0.00 H TER 70833 WAT 5288 ATOM 70833 O WAT 5289 114.687 83.689 4.825 1.00 0.00 O ATOM 70834 H1 WAT 5289 114.284 83.832 5.681 1.00 0.00 H ATOM 70835 H2 WAT 5289 113.950 83.657 4.216 1.00 0.00 H TER 70837 WAT 5289 ATOM 70837 O WAT 5290 50.194 73.932 141.933 1.00 0.00 O ATOM 70838 H1 WAT 5290 50.251 73.117 142.431 1.00 0.00 H ATOM 70839 H2 WAT 5290 50.314 74.621 142.586 1.00 0.00 H TER 70841 WAT 5290 ATOM 70841 O WAT 5291 73.157 53.864 104.041 1.00 0.00 O ATOM 70842 H1 WAT 5291 73.201 53.990 104.989 1.00 0.00 H ATOM 70843 H2 WAT 5291 73.532 54.665 103.675 1.00 0.00 H TER 70845 WAT 5291 ATOM 70845 O WAT 5292 141.023 113.022 156.791 1.00 0.00 O ATOM 70846 H1 WAT 5292 140.362 113.616 156.435 1.00 0.00 H ATOM 70847 H2 WAT 5292 140.773 112.905 157.707 1.00 0.00 H TER 70849 WAT 5292 ATOM 70849 O WAT 5293 106.102 31.607 78.967 1.00 0.00 O ATOM 70850 H1 WAT 5293 106.134 31.180 79.823 1.00 0.00 H ATOM 70851 H2 WAT 5293 106.762 31.149 78.446 1.00 0.00 H TER 70853 WAT 5293 ATOM 70853 O WAT 5294 59.295 2.501 60.341 1.00 0.00 O ATOM 70854 H1 WAT 5294 59.375 3.445 60.205 1.00 0.00 H ATOM 70855 H2 WAT 5294 59.914 2.308 61.045 1.00 0.00 H TER 70857 WAT 5294 ATOM 70857 O WAT 5295 27.735 101.757 4.386 1.00 0.00 O ATOM 70858 H1 WAT 5295 26.845 101.452 4.210 1.00 0.00 H ATOM 70859 H2 WAT 5295 28.190 100.986 4.724 1.00 0.00 H TER 70861 WAT 5295 ATOM 70861 O WAT 5296 10.580 11.398 150.636 1.00 0.00 O ATOM 70862 H1 WAT 5296 10.885 10.660 150.107 1.00 0.00 H ATOM 70863 H2 WAT 5296 10.801 11.156 151.535 1.00 0.00 H TER 70865 WAT 5296 ATOM 70865 O WAT 5297 85.933 25.789 138.121 1.00 0.00 O ATOM 70866 H1 WAT 5297 86.831 25.765 138.452 1.00 0.00 H ATOM 70867 H2 WAT 5297 85.638 26.683 138.290 1.00 0.00 H TER 70869 WAT 5297 ATOM 70869 O WAT 5298 98.915 142.280 141.022 1.00 0.00 O ATOM 70870 H1 WAT 5298 98.612 143.160 140.797 1.00 0.00 H ATOM 70871 H2 WAT 5298 99.048 141.849 140.178 1.00 0.00 H TER 70873 WAT 5298 ATOM 70873 O WAT 5299 127.740 11.899 4.879 1.00 0.00 O ATOM 70874 H1 WAT 5299 128.016 10.982 4.881 1.00 0.00 H ATOM 70875 H2 WAT 5299 128.554 12.394 4.978 1.00 0.00 H TER 70877 WAT 5299 ATOM 70877 O WAT 5300 60.790 62.454 99.533 1.00 0.00 O ATOM 70878 H1 WAT 5300 61.304 63.131 99.973 1.00 0.00 H ATOM 70879 H2 WAT 5300 60.959 61.659 100.039 1.00 0.00 H TER 70881 WAT 5300 ATOM 70881 O WAT 5301 60.591 14.390 101.667 1.00 0.00 O ATOM 70882 H1 WAT 5301 60.250 14.814 100.880 1.00 0.00 H ATOM 70883 H2 WAT 5301 60.111 14.799 102.387 1.00 0.00 H TER 70885 WAT 5301 ATOM 70885 O WAT 5302 142.740 27.651 70.080 1.00 0.00 O ATOM 70886 H1 WAT 5302 143.338 28.285 69.686 1.00 0.00 H ATOM 70887 H2 WAT 5302 142.210 28.167 70.688 1.00 0.00 H TER 70889 WAT 5302 ATOM 70889 O WAT 5303 138.010 15.163 17.188 1.00 0.00 O ATOM 70890 H1 WAT 5303 138.418 15.660 17.897 1.00 0.00 H ATOM 70891 H2 WAT 5303 137.672 15.830 16.591 1.00 0.00 H TER 70893 WAT 5303 ATOM 70893 O WAT 5304 20.663 23.750 24.405 1.00 0.00 O ATOM 70894 H1 WAT 5304 21.402 24.083 24.915 1.00 0.00 H ATOM 70895 H2 WAT 5304 20.173 24.532 24.154 1.00 0.00 H TER 70897 WAT 5304 ATOM 70897 O WAT 5305 128.539 36.745 56.760 1.00 0.00 O ATOM 70898 H1 WAT 5305 129.238 36.095 56.689 1.00 0.00 H ATOM 70899 H2 WAT 5305 127.791 36.256 57.103 1.00 0.00 H TER 70901 WAT 5305 ATOM 70901 O WAT 5306 30.981 93.516 125.154 1.00 0.00 O ATOM 70902 H1 WAT 5306 30.801 93.906 124.299 1.00 0.00 H ATOM 70903 H2 WAT 5306 30.860 94.234 125.776 1.00 0.00 H TER 70905 WAT 5306 ATOM 70905 O WAT 5307 79.275 80.900 71.994 1.00 0.00 O ATOM 70906 H1 WAT 5307 80.003 80.382 72.337 1.00 0.00 H ATOM 70907 H2 WAT 5307 79.684 81.704 71.672 1.00 0.00 H TER 70909 WAT 5307 ATOM 70909 O WAT 5308 117.350 120.143 126.127 1.00 0.00 O ATOM 70910 H1 WAT 5308 116.702 120.825 125.951 1.00 0.00 H ATOM 70911 H2 WAT 5308 116.832 119.351 126.268 1.00 0.00 H TER 70913 WAT 5308 ATOM 70913 O WAT 5309 44.204 144.269 155.271 1.00 0.00 O ATOM 70914 H1 WAT 5309 44.747 144.358 154.488 1.00 0.00 H ATOM 70915 H2 WAT 5309 44.818 144.023 155.963 1.00 0.00 H TER 70917 WAT 5309 ATOM 70917 O WAT 5310 46.720 121.216 121.985 1.00 0.00 O ATOM 70918 H1 WAT 5310 47.573 121.514 122.303 1.00 0.00 H ATOM 70919 H2 WAT 5310 46.090 121.799 122.409 1.00 0.00 H TER 70921 WAT 5310 ATOM 70921 O WAT 5311 123.266 80.353 12.390 1.00 0.00 O ATOM 70922 H1 WAT 5311 123.548 81.011 13.026 1.00 0.00 H ATOM 70923 H2 WAT 5311 122.422 80.673 12.072 1.00 0.00 H TER 70925 WAT 5311 ATOM 70925 O WAT 5312 15.924 140.325 76.759 1.00 0.00 O ATOM 70926 H1 WAT 5312 16.557 139.731 76.357 1.00 0.00 H ATOM 70927 H2 WAT 5312 16.333 140.590 77.583 1.00 0.00 H TER 70929 WAT 5312 ATOM 70929 O WAT 5313 57.322 106.227 59.650 1.00 0.00 O ATOM 70930 H1 WAT 5313 57.938 105.495 59.684 1.00 0.00 H ATOM 70931 H2 WAT 5313 56.566 105.883 59.176 1.00 0.00 H TER 70933 WAT 5313 ATOM 70933 O WAT 5314 124.679 132.270 112.664 1.00 0.00 O ATOM 70934 H1 WAT 5314 124.667 132.805 111.870 1.00 0.00 H ATOM 70935 H2 WAT 5314 125.595 132.275 112.943 1.00 0.00 H TER 70937 WAT 5314 ATOM 70937 O WAT 5315 84.630 79.640 152.976 1.00 0.00 O ATOM 70938 H1 WAT 5315 84.771 80.546 153.250 1.00 0.00 H ATOM 70939 H2 WAT 5315 83.788 79.657 152.521 1.00 0.00 H TER 70941 WAT 5315 ATOM 70941 O WAT 5316 101.373 75.934 18.174 1.00 0.00 O ATOM 70942 H1 WAT 5316 102.007 76.330 17.576 1.00 0.00 H ATOM 70943 H2 WAT 5316 101.896 75.353 18.726 1.00 0.00 H TER 70945 WAT 5316 ATOM 70945 O WAT 5317 42.177 52.772 83.786 1.00 0.00 O ATOM 70946 H1 WAT 5317 42.327 53.620 83.368 1.00 0.00 H ATOM 70947 H2 WAT 5317 41.971 52.181 83.061 1.00 0.00 H TER 70949 WAT 5317 ATOM 70949 O WAT 5318 130.715 143.790 145.540 1.00 0.00 O ATOM 70950 H1 WAT 5318 129.803 143.545 145.381 1.00 0.00 H ATOM 70951 H2 WAT 5318 130.669 144.444 146.237 1.00 0.00 H TER 70953 WAT 5318 ATOM 70953 O WAT 5319 37.345 56.343 8.832 1.00 0.00 O ATOM 70954 H1 WAT 5319 36.614 56.163 9.422 1.00 0.00 H ATOM 70955 H2 WAT 5319 36.933 56.674 8.034 1.00 0.00 H TER 70957 WAT 5319 ATOM 70957 O WAT 5320 36.750 62.603 104.638 1.00 0.00 O ATOM 70958 H1 WAT 5320 37.619 62.830 104.969 1.00 0.00 H ATOM 70959 H2 WAT 5320 36.903 61.862 104.053 1.00 0.00 H TER 70961 WAT 5320 ATOM 70961 O WAT 5321 36.918 52.319 26.334 1.00 0.00 O ATOM 70962 H1 WAT 5321 37.203 52.809 25.563 1.00 0.00 H ATOM 70963 H2 WAT 5321 37.519 52.594 27.027 1.00 0.00 H TER 70965 WAT 5321 ATOM 70965 O WAT 5322 103.138 13.605 136.294 1.00 0.00 O ATOM 70966 H1 WAT 5322 102.788 14.482 136.138 1.00 0.00 H ATOM 70967 H2 WAT 5322 103.886 13.537 135.701 1.00 0.00 H TER 70969 WAT 5322 ATOM 70969 O WAT 5323 77.728 2.794 78.416 1.00 0.00 O ATOM 70970 H1 WAT 5323 77.030 3.447 78.454 1.00 0.00 H ATOM 70971 H2 WAT 5323 78.536 3.308 78.397 1.00 0.00 H TER 70973 WAT 5323 ATOM 70973 O WAT 5324 46.952 120.068 71.259 1.00 0.00 O ATOM 70974 H1 WAT 5324 47.688 120.662 71.114 1.00 0.00 H ATOM 70975 H2 WAT 5324 46.179 120.586 71.032 1.00 0.00 H TER 70977 WAT 5324 ATOM 70977 O WAT 5325 61.874 130.712 110.046 1.00 0.00 O ATOM 70978 H1 WAT 5325 61.287 131.414 110.327 1.00 0.00 H ATOM 70979 H2 WAT 5325 61.634 130.550 109.134 1.00 0.00 H TER 70981 WAT 5325 ATOM 70981 O WAT 5326 106.473 53.260 125.371 1.00 0.00 O ATOM 70982 H1 WAT 5326 106.906 53.296 126.224 1.00 0.00 H ATOM 70983 H2 WAT 5326 105.963 52.450 125.394 1.00 0.00 H TER 70985 WAT 5326 ATOM 70985 O WAT 5327 112.431 60.834 74.197 1.00 0.00 O ATOM 70986 H1 WAT 5327 111.933 61.633 74.367 1.00 0.00 H ATOM 70987 H2 WAT 5327 113.278 60.986 74.615 1.00 0.00 H TER 70989 WAT 5327 ATOM 70989 O WAT 5328 106.124 82.977 154.213 1.00 0.00 O ATOM 70990 H1 WAT 5328 105.505 83.597 154.599 1.00 0.00 H ATOM 70991 H2 WAT 5328 105.631 82.159 154.142 1.00 0.00 H TER 70993 WAT 5328 ATOM 70993 O WAT 5329 104.441 111.838 78.565 1.00 0.00 O ATOM 70994 H1 WAT 5329 103.954 111.810 77.742 1.00 0.00 H ATOM 70995 H2 WAT 5329 105.307 112.166 78.319 1.00 0.00 H TER 70997 WAT 5329 ATOM 70997 O WAT 5330 11.633 75.204 109.170 1.00 0.00 O ATOM 70998 H1 WAT 5330 11.371 75.035 108.265 1.00 0.00 H ATOM 70999 H2 WAT 5330 11.109 75.960 109.434 1.00 0.00 H TER 71001 WAT 5330 ATOM 71001 O WAT 5331 44.389 49.079 9.533 1.00 0.00 O ATOM 71002 H1 WAT 5331 44.181 49.042 8.600 1.00 0.00 H ATOM 71003 H2 WAT 5331 44.885 48.277 9.700 1.00 0.00 H TER 71005 WAT 5331 ATOM 71005 O WAT 5332 14.936 19.575 109.643 1.00 0.00 O ATOM 71006 H1 WAT 5332 15.531 18.859 109.865 1.00 0.00 H ATOM 71007 H2 WAT 5332 15.503 20.254 109.278 1.00 0.00 H TER 71009 WAT 5332 ATOM 71009 O WAT 5333 85.567 60.325 134.225 1.00 0.00 O ATOM 71010 H1 WAT 5333 86.135 59.602 134.493 1.00 0.00 H ATOM 71011 H2 WAT 5333 84.720 59.913 134.056 1.00 0.00 H TER 71013 WAT 5333 ATOM 71013 O WAT 5334 52.336 21.035 13.665 1.00 0.00 O ATOM 71014 H1 WAT 5334 51.449 21.189 13.990 1.00 0.00 H ATOM 71015 H2 WAT 5334 52.906 21.345 14.368 1.00 0.00 H TER 71017 WAT 5334 ATOM 71017 O WAT 5335 140.194 25.931 123.612 1.00 0.00 O ATOM 71018 H1 WAT 5335 139.744 25.088 123.557 1.00 0.00 H ATOM 71019 H2 WAT 5335 140.615 25.922 124.471 1.00 0.00 H TER 71021 WAT 5335 ATOM 71021 O WAT 5336 32.351 138.875 116.380 1.00 0.00 O ATOM 71022 H1 WAT 5336 32.141 139.759 116.682 1.00 0.00 H ATOM 71023 H2 WAT 5336 31.504 138.433 116.325 1.00 0.00 H TER 71025 WAT 5336 ATOM 71025 O WAT 5337 48.039 84.364 155.750 1.00 0.00 O ATOM 71026 H1 WAT 5337 47.310 83.749 155.671 1.00 0.00 H ATOM 71027 H2 WAT 5337 47.623 85.207 155.926 1.00 0.00 H TER 71029 WAT 5337 ATOM 71029 O WAT 5338 85.354 113.844 69.650 1.00 0.00 O ATOM 71030 H1 WAT 5338 85.470 112.904 69.514 1.00 0.00 H ATOM 71031 H2 WAT 5338 86.241 114.203 69.618 1.00 0.00 H TER 71033 WAT 5338 ATOM 71033 O WAT 5339 136.748 95.425 20.829 1.00 0.00 O ATOM 71034 H1 WAT 5339 137.687 95.458 20.648 1.00 0.00 H ATOM 71035 H2 WAT 5339 136.471 94.570 20.499 1.00 0.00 H TER 71037 WAT 5339 ATOM 71037 O WAT 5340 144.645 142.240 74.106 1.00 0.00 O ATOM 71038 H1 WAT 5340 144.510 141.303 73.965 1.00 0.00 H ATOM 71039 H2 WAT 5340 145.460 142.293 74.605 1.00 0.00 H TER 71041 WAT 5340 ATOM 71041 O WAT 5341 75.263 139.930 91.161 1.00 0.00 O ATOM 71042 H1 WAT 5341 75.014 139.019 91.008 1.00 0.00 H ATOM 71043 H2 WAT 5341 76.169 139.884 91.465 1.00 0.00 H TER 71045 WAT 5341 ATOM 71045 O WAT 5342 105.765 8.915 74.718 1.00 0.00 O ATOM 71046 H1 WAT 5342 105.269 8.109 74.859 1.00 0.00 H ATOM 71047 H2 WAT 5342 105.170 9.614 74.992 1.00 0.00 H TER 71049 WAT 5342 ATOM 71049 O WAT 5343 81.622 59.402 119.561 1.00 0.00 O ATOM 71050 H1 WAT 5343 81.547 60.067 118.877 1.00 0.00 H ATOM 71051 H2 WAT 5343 80.945 58.760 119.347 1.00 0.00 H TER 71053 WAT 5343 ATOM 71053 O WAT 5344 138.183 90.012 78.608 1.00 0.00 O ATOM 71054 H1 WAT 5344 138.113 90.384 77.729 1.00 0.00 H ATOM 71055 H2 WAT 5344 137.295 90.061 78.961 1.00 0.00 H TER 71057 WAT 5344 ATOM 71057 O WAT 5345 44.190 3.915 65.029 1.00 0.00 O ATOM 71058 H1 WAT 5345 43.842 4.133 64.165 1.00 0.00 H ATOM 71059 H2 WAT 5345 44.026 4.696 65.557 1.00 0.00 H TER 71061 WAT 5345 ATOM 71061 O WAT 5346 142.950 140.730 110.893 1.00 0.00 O ATOM 71062 H1 WAT 5346 143.687 140.888 111.483 1.00 0.00 H ATOM 71063 H2 WAT 5346 142.590 141.600 110.721 1.00 0.00 H TER 71065 WAT 5346 ATOM 71065 O WAT 5347 101.819 85.386 62.159 1.00 0.00 O ATOM 71066 H1 WAT 5347 101.852 84.515 62.554 1.00 0.00 H ATOM 71067 H2 WAT 5347 100.977 85.412 61.705 1.00 0.00 H TER 71069 WAT 5347 ATOM 71069 O WAT 5348 77.985 57.681 110.003 1.00 0.00 O ATOM 71070 H1 WAT 5348 78.800 57.595 109.508 1.00 0.00 H ATOM 71071 H2 WAT 5348 77.688 58.573 109.823 1.00 0.00 H TER 71073 WAT 5348 ATOM 71073 O WAT 5349 34.428 58.090 114.459 1.00 0.00 O ATOM 71074 H1 WAT 5349 34.198 57.999 113.535 1.00 0.00 H ATOM 71075 H2 WAT 5349 34.152 57.264 114.857 1.00 0.00 H TER 71077 WAT 5349 ATOM 71077 O WAT 5350 43.747 124.085 13.349 1.00 0.00 O ATOM 71078 H1 WAT 5350 43.218 123.287 13.315 1.00 0.00 H ATOM 71079 H2 WAT 5350 43.879 124.323 12.431 1.00 0.00 H TER 71081 WAT 5350 ATOM 71081 O WAT 5351 19.217 16.307 81.315 1.00 0.00 O ATOM 71082 H1 WAT 5351 18.894 16.106 80.437 1.00 0.00 H ATOM 71083 H2 WAT 5351 20.164 16.389 81.209 1.00 0.00 H TER 71085 WAT 5351 ATOM 71085 O WAT 5352 42.293 49.494 128.329 1.00 0.00 O ATOM 71086 H1 WAT 5352 41.986 49.977 129.096 1.00 0.00 H ATOM 71087 H2 WAT 5352 41.504 49.084 127.973 1.00 0.00 H TER 71089 WAT 5352 ATOM 71089 O WAT 5353 33.108 76.193 18.789 1.00 0.00 O ATOM 71090 H1 WAT 5353 32.988 75.530 18.109 1.00 0.00 H ATOM 71091 H2 WAT 5353 33.004 75.715 19.611 1.00 0.00 H TER 71093 WAT 5353 ATOM 71093 O WAT 5354 67.719 45.939 141.864 1.00 0.00 O ATOM 71094 H1 WAT 5354 68.103 45.239 142.393 1.00 0.00 H ATOM 71095 H2 WAT 5354 68.436 46.235 141.303 1.00 0.00 H TER 71097 WAT 5354 ATOM 71097 O WAT 5355 110.027 84.042 12.565 1.00 0.00 O ATOM 71098 H1 WAT 5355 109.570 83.355 13.050 1.00 0.00 H ATOM 71099 H2 WAT 5355 110.938 83.751 12.538 1.00 0.00 H TER 71101 WAT 5355 ATOM 71101 O WAT 5356 42.732 88.991 0.194 1.00 0.00 O ATOM 71102 H1 WAT 5356 41.947 88.472 0.369 1.00 0.00 H ATOM 71103 H2 WAT 5356 43.406 88.603 0.752 1.00 0.00 H TER 71105 WAT 5356 ATOM 71105 O WAT 5357 71.638 78.543 94.708 1.00 0.00 O ATOM 71106 H1 WAT 5357 72.060 79.385 94.878 1.00 0.00 H ATOM 71107 H2 WAT 5357 71.068 78.708 93.957 1.00 0.00 H TER 71109 WAT 5357 ATOM 71109 O WAT 5358 91.509 95.957 104.421 1.00 0.00 O ATOM 71110 H1 WAT 5358 91.817 96.767 104.015 1.00 0.00 H ATOM 71111 H2 WAT 5358 92.014 95.266 103.992 1.00 0.00 H TER 71113 WAT 5358 ATOM 71113 O WAT 5359 104.803 10.275 5.874 1.00 0.00 O ATOM 71114 H1 WAT 5359 104.800 10.994 6.505 1.00 0.00 H ATOM 71115 H2 WAT 5359 104.999 10.693 5.035 1.00 0.00 H TER 71117 WAT 5359 ATOM 71117 O WAT 5360 144.079 33.284 151.305 1.00 0.00 O ATOM 71118 H1 WAT 5360 144.063 32.538 150.705 1.00 0.00 H ATOM 71119 H2 WAT 5360 144.510 32.951 152.091 1.00 0.00 H TER 71121 WAT 5360 ATOM 71121 O WAT 5361 122.944 143.801 96.479 1.00 0.00 O ATOM 71122 H1 WAT 5361 122.819 144.015 95.555 1.00 0.00 H ATOM 71123 H2 WAT 5361 122.605 144.563 96.949 1.00 0.00 H TER 71125 WAT 5361 ATOM 71125 O WAT 5362 79.889 34.060 12.152 1.00 0.00 O ATOM 71126 H1 WAT 5362 78.964 33.878 11.985 1.00 0.00 H ATOM 71127 H2 WAT 5362 80.337 33.766 11.359 1.00 0.00 H TER 71129 WAT 5362 ATOM 71129 O WAT 5363 115.355 102.953 6.444 1.00 0.00 O ATOM 71130 H1 WAT 5363 114.834 102.720 5.675 1.00 0.00 H ATOM 71131 H2 WAT 5363 115.677 102.116 6.778 1.00 0.00 H TER 71133 WAT 5363 ATOM 71133 O WAT 5364 140.220 9.452 76.513 1.00 0.00 O ATOM 71134 H1 WAT 5364 140.537 8.655 76.937 1.00 0.00 H ATOM 71135 H2 WAT 5364 139.282 9.468 76.703 1.00 0.00 H TER 71137 WAT 5364 ATOM 71137 O WAT 5365 50.988 138.996 72.007 1.00 0.00 O ATOM 71138 H1 WAT 5365 50.374 139.189 72.714 1.00 0.00 H ATOM 71139 H2 WAT 5365 50.654 139.489 71.257 1.00 0.00 H TER 71141 WAT 5365 ATOM 71141 O WAT 5366 80.395 20.573 118.392 1.00 0.00 O ATOM 71142 H1 WAT 5366 80.918 21.196 118.896 1.00 0.00 H ATOM 71143 H2 WAT 5366 80.419 19.767 118.908 1.00 0.00 H TER 71145 WAT 5366 ATOM 71145 O WAT 5367 130.446 28.859 108.147 1.00 0.00 O ATOM 71146 H1 WAT 5367 130.179 28.888 109.066 1.00 0.00 H ATOM 71147 H2 WAT 5367 131.399 28.935 108.172 1.00 0.00 H TER 71149 WAT 5367 ATOM 71149 O WAT 5368 141.361 141.260 87.916 1.00 0.00 O ATOM 71150 H1 WAT 5368 141.507 141.603 88.798 1.00 0.00 H ATOM 71151 H2 WAT 5368 142.210 140.905 87.654 1.00 0.00 H TER 71153 WAT 5368 ATOM 71153 O WAT 5369 65.687 60.549 117.125 1.00 0.00 O ATOM 71154 H1 WAT 5369 64.973 60.170 117.637 1.00 0.00 H ATOM 71155 H2 WAT 5369 65.404 60.456 116.215 1.00 0.00 H TER 71157 WAT 5369 ATOM 71157 O WAT 5370 33.800 75.990 100.527 1.00 0.00 O ATOM 71158 H1 WAT 5370 34.496 76.462 100.984 1.00 0.00 H ATOM 71159 H2 WAT 5370 33.630 76.513 99.744 1.00 0.00 H TER 71161 WAT 5370 ATOM 71161 O WAT 5371 58.317 80.938 154.437 1.00 0.00 O ATOM 71162 H1 WAT 5371 58.512 80.568 155.299 1.00 0.00 H ATOM 71163 H2 WAT 5371 58.922 80.492 153.844 1.00 0.00 H TER 71165 WAT 5371 ATOM 71165 O WAT 5372 88.020 59.879 124.870 1.00 0.00 O ATOM 71166 H1 WAT 5372 88.783 59.317 125.004 1.00 0.00 H ATOM 71167 H2 WAT 5372 87.669 60.020 125.750 1.00 0.00 H TER 71169 WAT 5372 ATOM 71169 O WAT 5373 66.515 53.257 110.542 1.00 0.00 O ATOM 71170 H1 WAT 5373 66.191 52.849 109.739 1.00 0.00 H ATOM 71171 H2 WAT 5373 67.266 53.779 110.260 1.00 0.00 H TER 71173 WAT 5373 ATOM 71173 O WAT 5374 104.566 125.546 79.610 1.00 0.00 O ATOM 71174 H1 WAT 5374 105.083 125.143 80.307 1.00 0.00 H ATOM 71175 H2 WAT 5374 103.657 125.429 79.887 1.00 0.00 H TER 71177 WAT 5374 ATOM 71177 O WAT 5375 132.392 31.708 157.345 1.00 0.00 O ATOM 71178 H1 WAT 5375 131.701 31.091 157.105 1.00 0.00 H ATOM 71179 H2 WAT 5375 132.891 31.256 158.026 1.00 0.00 H TER 71181 WAT 5375 ATOM 71181 O WAT 5376 85.854 29.089 67.141 1.00 0.00 O ATOM 71182 H1 WAT 5376 86.608 29.322 66.599 1.00 0.00 H ATOM 71183 H2 WAT 5376 86.064 28.221 67.484 1.00 0.00 H TER 71185 WAT 5376 ATOM 71185 O WAT 5377 64.013 59.244 125.398 1.00 0.00 O ATOM 71186 H1 WAT 5377 63.500 58.609 125.897 1.00 0.00 H ATOM 71187 H2 WAT 5377 64.443 58.724 124.719 1.00 0.00 H TER 71189 WAT 5377 ATOM 71189 O WAT 5378 110.520 29.834 89.479 1.00 0.00 O ATOM 71190 H1 WAT 5378 110.108 30.694 89.554 1.00 0.00 H ATOM 71191 H2 WAT 5378 110.754 29.601 90.377 1.00 0.00 H TER 71193 WAT 5378 ATOM 71193 O WAT 5379 7.298 106.231 91.198 1.00 0.00 O ATOM 71194 H1 WAT 5379 6.815 105.879 90.450 1.00 0.00 H ATOM 71195 H2 WAT 5379 8.201 105.949 91.054 1.00 0.00 H TER 71197 WAT 5379 ATOM 71197 O WAT 5380 134.412 12.765 141.121 1.00 0.00 O ATOM 71198 H1 WAT 5380 133.865 11.979 141.124 1.00 0.00 H ATOM 71199 H2 WAT 5380 134.598 12.923 140.196 1.00 0.00 H TER 71201 WAT 5380 ATOM 71201 O WAT 5381 43.421 125.966 94.676 1.00 0.00 O ATOM 71202 H1 WAT 5381 44.206 126.111 94.147 1.00 0.00 H ATOM 71203 H2 WAT 5381 42.905 125.337 94.172 1.00 0.00 H TER 71205 WAT 5381 ATOM 71205 O WAT 5382 23.373 93.900 106.083 1.00 0.00 O ATOM 71206 H1 WAT 5382 22.900 94.235 105.321 1.00 0.00 H ATOM 71207 H2 WAT 5382 23.140 92.972 106.121 1.00 0.00 H TER 71209 WAT 5382 ATOM 71209 O WAT 5383 89.231 3.497 73.743 1.00 0.00 O ATOM 71210 H1 WAT 5383 89.135 4.179 73.078 1.00 0.00 H ATOM 71211 H2 WAT 5383 90.164 3.282 73.732 1.00 0.00 H TER 71213 WAT 5383 ATOM 71213 O WAT 5384 33.548 130.459 112.460 1.00 0.00 O ATOM 71214 H1 WAT 5384 34.042 129.658 112.283 1.00 0.00 H ATOM 71215 H2 WAT 5384 33.823 131.067 111.774 1.00 0.00 H TER 71217 WAT 5384 ATOM 71217 O WAT 5385 30.372 9.567 88.440 1.00 0.00 O ATOM 71218 H1 WAT 5385 29.488 9.928 88.376 1.00 0.00 H ATOM 71219 H2 WAT 5385 30.947 10.307 88.246 1.00 0.00 H TER 71221 WAT 5385 ATOM 71221 O WAT 5386 1.404 115.798 18.730 1.00 0.00 O ATOM 71222 H1 WAT 5386 0.990 114.993 18.419 1.00 0.00 H ATOM 71223 H2 WAT 5386 1.226 115.810 19.671 1.00 0.00 H TER 71225 WAT 5386 ATOM 71225 O WAT 5387 18.297 112.123 95.079 1.00 0.00 O ATOM 71226 H1 WAT 5387 17.541 111.822 94.575 1.00 0.00 H ATOM 71227 H2 WAT 5387 18.043 112.990 95.396 1.00 0.00 H TER 71229 WAT 5387 ATOM 71229 O WAT 5388 38.687 32.955 11.355 1.00 0.00 O ATOM 71230 H1 WAT 5388 38.767 32.017 11.182 1.00 0.00 H ATOM 71231 H2 WAT 5388 38.408 33.330 10.519 1.00 0.00 H TER 71233 WAT 5388 ATOM 71233 O WAT 5389 9.955 131.246 82.639 1.00 0.00 O ATOM 71234 H1 WAT 5389 9.960 130.377 82.237 1.00 0.00 H ATOM 71235 H2 WAT 5389 9.189 131.241 83.212 1.00 0.00 H TER 71237 WAT 5389 ATOM 71237 O WAT 5390 34.335 20.576 6.697 1.00 0.00 O ATOM 71238 H1 WAT 5390 34.959 19.909 6.409 1.00 0.00 H ATOM 71239 H2 WAT 5390 34.103 21.047 5.897 1.00 0.00 H TER 71241 WAT 5390 ATOM 71241 O WAT 5391 83.109 144.859 4.357 1.00 0.00 O ATOM 71242 H1 WAT 5391 82.303 145.180 4.762 1.00 0.00 H ATOM 71243 H2 WAT 5391 82.848 144.057 3.906 1.00 0.00 H TER 71245 WAT 5391 ATOM 71245 O WAT 5392 30.422 72.185 101.589 1.00 0.00 O ATOM 71246 H1 WAT 5392 30.928 72.993 101.669 1.00 0.00 H ATOM 71247 H2 WAT 5392 29.978 72.096 102.432 1.00 0.00 H TER 71249 WAT 5392 ATOM 71249 O WAT 5393 116.188 39.191 90.495 1.00 0.00 O ATOM 71250 H1 WAT 5393 117.022 38.727 90.576 1.00 0.00 H ATOM 71251 H2 WAT 5393 116.296 39.972 91.038 1.00 0.00 H TER 71253 WAT 5393 ATOM 71253 O WAT 5394 82.270 20.552 67.925 1.00 0.00 O ATOM 71254 H1 WAT 5394 82.646 19.984 67.252 1.00 0.00 H ATOM 71255 H2 WAT 5394 81.734 19.967 68.459 1.00 0.00 H TER 71257 WAT 5394 ATOM 71257 O WAT 5395 27.203 13.216 62.490 1.00 0.00 O ATOM 71258 H1 WAT 5395 27.779 13.908 62.814 1.00 0.00 H ATOM 71259 H2 WAT 5395 27.763 12.686 61.922 1.00 0.00 H TER 71261 WAT 5395 ATOM 71261 O WAT 5396 98.405 143.961 87.575 1.00 0.00 O ATOM 71262 H1 WAT 5396 98.398 143.421 88.365 1.00 0.00 H ATOM 71263 H2 WAT 5396 99.333 144.079 87.373 1.00 0.00 H TER 71265 WAT 5396 ATOM 71265 O WAT 5397 134.371 93.700 63.707 1.00 0.00 O ATOM 71266 H1 WAT 5397 134.989 94.400 63.914 1.00 0.00 H ATOM 71267 H2 WAT 5397 133.987 93.958 62.869 1.00 0.00 H TER 71269 WAT 5397 ATOM 71269 O WAT 5398 7.239 115.166 143.263 1.00 0.00 O ATOM 71270 H1 WAT 5398 6.453 115.629 143.553 1.00 0.00 H ATOM 71271 H2 WAT 5398 7.944 115.533 143.796 1.00 0.00 H TER 71273 WAT 5398 ATOM 71273 O WAT 5399 71.507 67.312 111.558 1.00 0.00 O ATOM 71274 H1 WAT 5399 71.153 67.139 110.685 1.00 0.00 H ATOM 71275 H2 WAT 5399 71.205 66.575 112.089 1.00 0.00 H TER 71277 WAT 5399 ATOM 71277 O WAT 5400 75.020 74.021 87.708 1.00 0.00 O ATOM 71278 H1 WAT 5400 75.086 73.081 87.876 1.00 0.00 H ATOM 71279 H2 WAT 5400 75.381 74.431 88.494 1.00 0.00 H TER 71281 WAT 5400 ATOM 71281 O WAT 5401 48.822 103.982 111.590 1.00 0.00 O ATOM 71282 H1 WAT 5401 48.943 104.098 110.648 1.00 0.00 H ATOM 71283 H2 WAT 5401 47.986 104.407 111.779 1.00 0.00 H TER 71285 WAT 5401 ATOM 71285 O WAT 5402 140.565 48.245 65.485 1.00 0.00 O ATOM 71286 H1 WAT 5402 140.473 47.403 65.041 1.00 0.00 H ATOM 71287 H2 WAT 5402 141.087 48.050 66.263 1.00 0.00 H TER 71289 WAT 5402 ATOM 71289 O WAT 5403 129.109 62.826 96.841 1.00 0.00 O ATOM 71290 H1 WAT 5403 129.232 62.239 97.587 1.00 0.00 H ATOM 71291 H2 WAT 5403 128.587 63.549 97.189 1.00 0.00 H TER 71293 WAT 5403 ATOM 71293 O WAT 5404 37.360 6.017 73.063 1.00 0.00 O ATOM 71294 H1 WAT 5404 37.648 6.516 72.299 1.00 0.00 H ATOM 71295 H2 WAT 5404 36.673 5.441 72.729 1.00 0.00 H TER 71297 WAT 5404 ATOM 71297 O WAT 5405 69.670 28.115 67.548 1.00 0.00 O ATOM 71298 H1 WAT 5405 70.419 28.278 66.974 1.00 0.00 H ATOM 71299 H2 WAT 5405 69.365 27.242 67.301 1.00 0.00 H TER 71301 WAT 5405 ATOM 71301 O WAT 5406 42.627 62.590 3.381 1.00 0.00 O ATOM 71302 H1 WAT 5406 42.276 62.668 2.493 1.00 0.00 H ATOM 71303 H2 WAT 5406 42.854 61.664 3.467 1.00 0.00 H TER 71305 WAT 5406 ATOM 71305 O WAT 5407 108.361 104.927 108.062 1.00 0.00 O ATOM 71306 H1 WAT 5407 108.020 104.156 107.609 1.00 0.00 H ATOM 71307 H2 WAT 5407 108.775 105.447 107.373 1.00 0.00 H TER 71309 WAT 5407 ATOM 71309 O WAT 5408 23.746 81.764 124.860 1.00 0.00 O ATOM 71310 H1 WAT 5408 24.060 80.952 125.260 1.00 0.00 H ATOM 71311 H2 WAT 5408 24.422 82.409 125.067 1.00 0.00 H TER 71313 WAT 5408 ATOM 71313 O WAT 5409 57.289 16.116 146.055 1.00 0.00 O ATOM 71314 H1 WAT 5409 56.364 16.288 146.235 1.00 0.00 H ATOM 71315 H2 WAT 5409 57.290 15.675 145.206 1.00 0.00 H TER 71317 WAT 5409 ATOM 71317 O WAT 5410 6.458 78.175 131.310 1.00 0.00 O ATOM 71318 H1 WAT 5410 7.254 77.920 130.843 1.00 0.00 H ATOM 71319 H2 WAT 5410 5.884 77.413 131.239 1.00 0.00 H TER 71321 WAT 5410 ATOM 71321 O WAT 5411 85.879 108.081 144.183 1.00 0.00 O ATOM 71322 H1 WAT 5411 85.813 109.014 144.390 1.00 0.00 H ATOM 71323 H2 WAT 5411 85.477 107.999 143.319 1.00 0.00 H TER 71325 WAT 5411 ATOM 71325 O WAT 5412 44.512 120.699 98.994 1.00 0.00 O ATOM 71326 H1 WAT 5412 44.740 119.935 99.524 1.00 0.00 H ATOM 71327 H2 WAT 5412 43.673 120.995 99.348 1.00 0.00 H TER 71329 WAT 5412 ATOM 71329 O WAT 5413 137.685 15.574 103.146 1.00 0.00 O ATOM 71330 H1 WAT 5413 137.480 16.163 103.872 1.00 0.00 H ATOM 71331 H2 WAT 5413 138.632 15.444 103.204 1.00 0.00 H TER 71333 WAT 5413 ATOM 71333 O WAT 5414 7.177 86.831 6.809 1.00 0.00 O ATOM 71334 H1 WAT 5414 6.810 85.980 7.049 1.00 0.00 H ATOM 71335 H2 WAT 5414 7.271 86.790 5.857 1.00 0.00 H TER 71337 WAT 5414 ATOM 71337 O WAT 5415 105.889 50.115 141.014 1.00 0.00 O ATOM 71338 H1 WAT 5415 105.400 50.499 140.287 1.00 0.00 H ATOM 71339 H2 WAT 5415 105.370 49.355 141.278 1.00 0.00 H TER 71341 WAT 5415 ATOM 71341 O WAT 5416 14.487 36.721 23.018 1.00 0.00 O ATOM 71342 H1 WAT 5416 14.789 35.871 23.338 1.00 0.00 H ATOM 71343 H2 WAT 5416 15.268 37.274 23.034 1.00 0.00 H TER 71345 WAT 5416 ATOM 71345 O WAT 5417 143.971 107.070 144.597 1.00 0.00 O ATOM 71346 H1 WAT 5417 144.668 107.455 144.065 1.00 0.00 H ATOM 71347 H2 WAT 5417 143.207 107.064 144.021 1.00 0.00 H TER 71349 WAT 5417 ATOM 71349 O WAT 5418 27.969 86.173 7.571 1.00 0.00 O ATOM 71350 H1 WAT 5418 27.311 85.679 8.060 1.00 0.00 H ATOM 71351 H2 WAT 5418 27.762 86.003 6.652 1.00 0.00 H TER 71353 WAT 5418 ATOM 71353 O WAT 5419 46.005 31.975 118.305 1.00 0.00 O ATOM 71354 H1 WAT 5419 45.998 32.441 119.142 1.00 0.00 H ATOM 71355 H2 WAT 5419 46.774 32.316 117.848 1.00 0.00 H TER 71357 WAT 5419 ATOM 71357 O WAT 5420 8.496 74.488 130.094 1.00 0.00 O ATOM 71358 H1 WAT 5420 9.416 74.730 130.203 1.00 0.00 H ATOM 71359 H2 WAT 5420 8.070 74.801 130.892 1.00 0.00 H TER 71361 WAT 5420 ATOM 71361 O WAT 5421 53.247 138.259 127.674 1.00 0.00 O ATOM 71362 H1 WAT 5421 52.768 138.348 126.850 1.00 0.00 H ATOM 71363 H2 WAT 5421 54.063 138.738 127.531 1.00 0.00 H TER 71365 WAT 5421 ATOM 71365 O WAT 5422 125.064 67.015 89.976 1.00 0.00 O ATOM 71366 H1 WAT 5422 125.201 67.547 89.192 1.00 0.00 H ATOM 71367 H2 WAT 5422 125.688 67.362 90.613 1.00 0.00 H TER 71369 WAT 5422 ATOM 71369 O WAT 5423 1.536 121.335 156.236 1.00 0.00 O ATOM 71370 H1 WAT 5423 1.650 121.040 155.333 1.00 0.00 H ATOM 71371 H2 WAT 5423 2.248 121.959 156.375 1.00 0.00 H TER 71373 WAT 5423 ATOM 71373 O WAT 5424 98.253 51.378 99.992 1.00 0.00 O ATOM 71374 H1 WAT 5424 98.624 50.509 99.842 1.00 0.00 H ATOM 71375 H2 WAT 5424 98.840 51.973 99.525 1.00 0.00 H TER 71377 WAT 5424 ATOM 71377 O WAT 5425 91.396 49.286 117.027 1.00 0.00 O ATOM 71378 H1 WAT 5425 90.757 49.762 116.498 1.00 0.00 H ATOM 71379 H2 WAT 5425 92.244 49.528 116.654 1.00 0.00 H TER 71381 WAT 5425 ATOM 71381 O WAT 5426 132.054 44.108 24.943 1.00 0.00 O ATOM 71382 H1 WAT 5426 131.192 44.453 25.175 1.00 0.00 H ATOM 71383 H2 WAT 5426 131.868 43.296 24.471 1.00 0.00 H TER 71385 WAT 5426 ATOM 71385 O WAT 5427 14.367 50.065 61.463 1.00 0.00 O ATOM 71386 H1 WAT 5427 15.091 50.206 60.853 1.00 0.00 H ATOM 71387 H2 WAT 5427 14.749 50.219 62.327 1.00 0.00 H TER 71389 WAT 5427 ATOM 71389 O WAT 5428 93.620 39.405 153.159 1.00 0.00 O ATOM 71390 H1 WAT 5428 92.949 39.752 153.747 1.00 0.00 H ATOM 71391 H2 WAT 5428 94.394 39.301 153.714 1.00 0.00 H TER 71393 WAT 5428 ATOM 71393 O WAT 5429 30.504 0.263 128.863 1.00 0.00 O ATOM 71394 H1 WAT 5429 29.906 1.009 128.813 1.00 0.00 H ATOM 71395 H2 WAT 5429 30.439 -0.155 128.004 1.00 0.00 H TER 71397 WAT 5429 ATOM 71397 O WAT 5430 34.189 37.167 114.085 1.00 0.00 O ATOM 71398 H1 WAT 5430 33.890 38.068 113.970 1.00 0.00 H ATOM 71399 H2 WAT 5430 34.671 37.178 114.912 1.00 0.00 H TER 71401 WAT 5430 ATOM 71401 O WAT 5431 54.364 75.815 116.194 1.00 0.00 O ATOM 71402 H1 WAT 5431 53.679 76.379 116.552 1.00 0.00 H ATOM 71403 H2 WAT 5431 54.079 74.927 116.409 1.00 0.00 H TER 71405 WAT 5431 ATOM 71405 O WAT 5432 64.251 80.531 16.523 1.00 0.00 O ATOM 71406 H1 WAT 5432 63.662 81.027 15.955 1.00 0.00 H ATOM 71407 H2 WAT 5432 64.529 79.787 15.988 1.00 0.00 H TER 71409 WAT 5432 ATOM 71409 O WAT 5433 82.691 135.084 2.227 1.00 0.00 O ATOM 71410 H1 WAT 5433 82.901 134.225 2.596 1.00 0.00 H ATOM 71411 H2 WAT 5433 83.204 135.700 2.749 1.00 0.00 H TER 71413 WAT 5433 ATOM 71413 O WAT 5434 24.429 58.013 15.899 1.00 0.00 O ATOM 71414 H1 WAT 5434 25.363 58.058 15.698 1.00 0.00 H ATOM 71415 H2 WAT 5434 24.365 57.364 16.599 1.00 0.00 H TER 71417 WAT 5434 ATOM 71417 O WAT 5435 61.336 51.247 96.011 1.00 0.00 O ATOM 71418 H1 WAT 5435 60.872 51.070 95.192 1.00 0.00 H ATOM 71419 H2 WAT 5435 62.036 50.594 96.036 1.00 0.00 H TER 71421 WAT 5435 ATOM 71421 O WAT 5436 82.607 54.985 68.079 1.00 0.00 O ATOM 71422 H1 WAT 5436 82.991 55.609 68.695 1.00 0.00 H ATOM 71423 H2 WAT 5436 81.702 55.278 67.973 1.00 0.00 H TER 71425 WAT 5436 ATOM 71425 O WAT 5437 56.884 10.970 75.389 1.00 0.00 O ATOM 71426 H1 WAT 5437 56.000 11.234 75.135 1.00 0.00 H ATOM 71427 H2 WAT 5437 56.751 10.284 76.043 1.00 0.00 H TER 71429 WAT 5437 ATOM 71429 O WAT 5438 124.128 29.069 10.534 1.00 0.00 O ATOM 71430 H1 WAT 5438 124.250 29.970 10.235 1.00 0.00 H ATOM 71431 H2 WAT 5438 124.133 29.130 11.489 1.00 0.00 H TER 71433 WAT 5438 ATOM 71433 O WAT 5439 131.117 90.640 150.626 1.00 0.00 O ATOM 71434 H1 WAT 5439 130.596 91.091 151.290 1.00 0.00 H ATOM 71435 H2 WAT 5439 131.879 90.311 151.102 1.00 0.00 H TER 71437 WAT 5439 ATOM 71437 O WAT 5440 112.797 131.685 103.968 1.00 0.00 O ATOM 71438 H1 WAT 5440 113.267 132.120 104.679 1.00 0.00 H ATOM 71439 H2 WAT 5440 113.469 131.183 103.508 1.00 0.00 H TER 71441 WAT 5440 ATOM 71441 O WAT 5441 10.168 85.417 127.250 1.00 0.00 O ATOM 71442 H1 WAT 5441 10.113 85.796 128.127 1.00 0.00 H ATOM 71443 H2 WAT 5441 11.088 85.512 127.005 1.00 0.00 H TER 71445 WAT 5441 ATOM 71445 O WAT 5442 38.633 42.610 3.023 1.00 0.00 O ATOM 71446 H1 WAT 5442 39.353 43.237 2.949 1.00 0.00 H ATOM 71447 H2 WAT 5442 39.063 41.759 3.104 1.00 0.00 H TER 71449 WAT 5442 ATOM 71449 O WAT 5443 22.328 121.358 66.999 1.00 0.00 O ATOM 71450 H1 WAT 5443 22.816 121.214 66.188 1.00 0.00 H ATOM 71451 H2 WAT 5443 22.053 120.483 67.272 1.00 0.00 H TER 71453 WAT 5443 ATOM 71453 O WAT 5444 64.831 69.807 20.982 1.00 0.00 O ATOM 71454 H1 WAT 5444 64.745 69.353 21.820 1.00 0.00 H ATOM 71455 H2 WAT 5444 65.001 69.111 20.348 1.00 0.00 H TER 71457 WAT 5444 ATOM 71457 O WAT 5445 98.847 142.698 105.776 1.00 0.00 O ATOM 71458 H1 WAT 5445 98.879 143.349 105.074 1.00 0.00 H ATOM 71459 H2 WAT 5445 99.099 143.182 106.563 1.00 0.00 H TER 71461 WAT 5445 ATOM 71461 O WAT 5446 37.435 -0.206 75.637 1.00 0.00 O ATOM 71462 H1 WAT 5446 36.776 0.461 75.442 1.00 0.00 H ATOM 71463 H2 WAT 5446 37.594 -0.117 76.577 1.00 0.00 H TER 71465 WAT 5446 ATOM 71465 O WAT 5447 33.963 20.757 12.139 1.00 0.00 O ATOM 71466 H1 WAT 5447 33.561 20.911 11.284 1.00 0.00 H ATOM 71467 H2 WAT 5447 34.849 21.109 12.054 1.00 0.00 H TER 71469 WAT 5447 ATOM 71469 O WAT 5448 42.733 36.969 63.070 1.00 0.00 O ATOM 71470 H1 WAT 5448 43.543 37.277 63.477 1.00 0.00 H ATOM 71471 H2 WAT 5448 42.410 37.725 62.579 1.00 0.00 H TER 71473 WAT 5448 ATOM 71473 O WAT 5449 9.144 101.820 7.477 1.00 0.00 O ATOM 71474 H1 WAT 5449 9.696 101.720 6.701 1.00 0.00 H ATOM 71475 H2 WAT 5449 9.657 101.435 8.187 1.00 0.00 H TER 71477 WAT 5449 ATOM 71477 O WAT 5450 73.074 95.319 130.889 1.00 0.00 O ATOM 71478 H1 WAT 5450 72.231 94.885 130.755 1.00 0.00 H ATOM 71479 H2 WAT 5450 72.988 96.155 130.430 1.00 0.00 H TER 71481 WAT 5450 ATOM 71481 O WAT 5451 130.655 99.714 21.449 1.00 0.00 O ATOM 71482 H1 WAT 5451 129.936 99.261 21.890 1.00 0.00 H ATOM 71483 H2 WAT 5451 131.326 99.041 21.332 1.00 0.00 H TER 71485 WAT 5451 ATOM 71485 O WAT 5452 143.430 29.745 123.732 1.00 0.00 O ATOM 71486 H1 WAT 5452 143.427 30.544 123.204 1.00 0.00 H ATOM 71487 H2 WAT 5452 143.666 30.040 124.611 1.00 0.00 H TER 71489 WAT 5452 ATOM 71489 O WAT 5453 46.169 125.882 89.787 1.00 0.00 O ATOM 71490 H1 WAT 5453 46.719 126.660 89.884 1.00 0.00 H ATOM 71491 H2 WAT 5453 46.782 125.149 89.836 1.00 0.00 H TER 71493 WAT 5453 ATOM 71493 O WAT 5454 104.397 81.466 97.567 1.00 0.00 O ATOM 71494 H1 WAT 5454 104.038 81.481 98.454 1.00 0.00 H ATOM 71495 H2 WAT 5454 105.303 81.178 97.679 1.00 0.00 H TER 71497 WAT 5454 ATOM 71497 O WAT 5455 53.375 96.560 147.418 1.00 0.00 O ATOM 71498 H1 WAT 5455 52.644 96.478 146.805 1.00 0.00 H ATOM 71499 H2 WAT 5455 54.148 96.638 146.859 1.00 0.00 H TER 71501 WAT 5455 ATOM 71501 O WAT 5456 37.220 57.106 132.425 1.00 0.00 O ATOM 71502 H1 WAT 5456 37.929 57.677 132.721 1.00 0.00 H ATOM 71503 H2 WAT 5456 36.421 57.598 132.615 1.00 0.00 H TER 71505 WAT 5456 ATOM 71505 O WAT 5457 144.946 61.664 97.419 1.00 0.00 O ATOM 71506 H1 WAT 5457 144.327 60.943 97.302 1.00 0.00 H ATOM 71507 H2 WAT 5457 144.768 61.992 98.301 1.00 0.00 H TER 71509 WAT 5457 ATOM 71509 O WAT 5458 27.436 104.574 115.902 1.00 0.00 O ATOM 71510 H1 WAT 5458 27.715 104.576 116.818 1.00 0.00 H ATOM 71511 H2 WAT 5458 26.674 103.996 115.885 1.00 0.00 H TER 71513 WAT 5458 ATOM 71513 O WAT 5459 53.079 70.524 19.896 1.00 0.00 O ATOM 71514 H1 WAT 5459 53.472 70.482 20.768 1.00 0.00 H ATOM 71515 H2 WAT 5459 52.137 70.568 20.059 1.00 0.00 H TER 71517 WAT 5459 ATOM 71517 O WAT 5460 49.485 119.289 112.997 1.00 0.00 O ATOM 71518 H1 WAT 5460 49.364 119.407 113.939 1.00 0.00 H ATOM 71519 H2 WAT 5460 48.932 118.539 112.777 1.00 0.00 H TER 71521 WAT 5460 ATOM 71521 O WAT 5461 24.302 27.275 119.095 1.00 0.00 O ATOM 71522 H1 WAT 5461 24.523 26.464 119.553 1.00 0.00 H ATOM 71523 H2 WAT 5461 23.391 27.445 119.335 1.00 0.00 H TER 71525 WAT 5461 ATOM 71525 O WAT 5462 11.660 104.542 150.817 1.00 0.00 O ATOM 71526 H1 WAT 5462 11.582 104.539 149.863 1.00 0.00 H ATOM 71527 H2 WAT 5462 12.207 103.781 151.014 1.00 0.00 H TER 71529 WAT 5462 ATOM 71529 O WAT 5463 35.078 63.894 139.942 1.00 0.00 O ATOM 71530 H1 WAT 5463 34.551 64.319 139.265 1.00 0.00 H ATOM 71531 H2 WAT 5463 34.471 63.765 140.672 1.00 0.00 H TER 71533 WAT 5463 ATOM 71533 O WAT 5464 43.448 61.365 154.201 1.00 0.00 O ATOM 71534 H1 WAT 5464 42.512 61.341 154.399 1.00 0.00 H ATOM 71535 H2 WAT 5464 43.805 60.591 154.636 1.00 0.00 H TER 71537 WAT 5464 ATOM 71537 O WAT 5465 54.953 18.229 56.467 1.00 0.00 O ATOM 71538 H1 WAT 5465 54.569 17.910 57.284 1.00 0.00 H ATOM 71539 H2 WAT 5465 55.858 18.442 56.695 1.00 0.00 H TER 71541 WAT 5465 ATOM 71541 O WAT 5466 25.003 41.817 124.246 1.00 0.00 O ATOM 71542 H1 WAT 5466 25.402 42.411 124.882 1.00 0.00 H ATOM 71543 H2 WAT 5466 25.727 41.270 123.943 1.00 0.00 H TER 71545 WAT 5466 ATOM 71545 O WAT 5467 80.929 50.662 148.547 1.00 0.00 O ATOM 71546 H1 WAT 5467 80.583 49.770 148.518 1.00 0.00 H ATOM 71547 H2 WAT 5467 81.028 50.850 149.480 1.00 0.00 H TER 71549 WAT 5467 ATOM 71549 O WAT 5468 11.780 87.503 8.093 1.00 0.00 O ATOM 71550 H1 WAT 5468 12.460 87.813 7.495 1.00 0.00 H ATOM 71551 H2 WAT 5468 11.079 88.150 8.015 1.00 0.00 H TER 71553 WAT 5468 ATOM 71553 O WAT 5469 53.911 129.959 109.000 1.00 0.00 O ATOM 71554 H1 WAT 5469 54.314 129.320 109.589 1.00 0.00 H ATOM 71555 H2 WAT 5469 53.191 130.332 109.509 1.00 0.00 H TER 71557 WAT 5469 ATOM 71557 O WAT 5470 93.114 137.242 138.224 1.00 0.00 O ATOM 71558 H1 WAT 5470 93.988 136.941 137.975 1.00 0.00 H ATOM 71559 H2 WAT 5470 93.260 137.785 138.999 1.00 0.00 H TER 71561 WAT 5470 ATOM 71561 O WAT 5471 91.870 134.815 133.216 1.00 0.00 O ATOM 71562 H1 WAT 5471 92.515 134.152 132.970 1.00 0.00 H ATOM 71563 H2 WAT 5471 92.320 135.649 133.080 1.00 0.00 H TER 71565 WAT 5471 ATOM 71565 O WAT 5472 97.416 115.474 117.965 1.00 0.00 O ATOM 71566 H1 WAT 5472 97.356 114.602 117.575 1.00 0.00 H ATOM 71567 H2 WAT 5472 97.690 115.315 118.868 1.00 0.00 H TER 71569 WAT 5472 ATOM 71569 O WAT 5473 106.382 49.313 131.064 1.00 0.00 O ATOM 71570 H1 WAT 5473 105.973 48.524 130.708 1.00 0.00 H ATOM 71571 H2 WAT 5473 107.147 48.992 131.541 1.00 0.00 H TER 71573 WAT 5473 ATOM 71573 O WAT 5474 101.280 43.192 140.141 1.00 0.00 O ATOM 71574 H1 WAT 5474 101.142 43.636 139.304 1.00 0.00 H ATOM 71575 H2 WAT 5474 102.231 43.155 140.239 1.00 0.00 H TER 71577 WAT 5474 ATOM 71577 O WAT 5475 48.708 108.918 2.492 1.00 0.00 O ATOM 71578 H1 WAT 5475 48.269 109.535 3.077 1.00 0.00 H ATOM 71579 H2 WAT 5475 48.448 109.195 1.613 1.00 0.00 H TER 71581 WAT 5475 ATOM 71581 O WAT 5476 127.707 101.658 129.525 1.00 0.00 O ATOM 71582 H1 WAT 5476 127.394 100.782 129.751 1.00 0.00 H ATOM 71583 H2 WAT 5476 126.915 102.196 129.499 1.00 0.00 H TER 71585 WAT 5476 ATOM 71585 O WAT 5477 131.245 77.724 94.897 1.00 0.00 O ATOM 71586 H1 WAT 5477 130.489 78.311 94.895 1.00 0.00 H ATOM 71587 H2 WAT 5477 131.929 78.218 95.349 1.00 0.00 H TER 71589 WAT 5477 ATOM 71589 O WAT 5478 61.258 115.656 13.596 1.00 0.00 O ATOM 71590 H1 WAT 5478 60.390 115.520 13.976 1.00 0.00 H ATOM 71591 H2 WAT 5478 61.539 116.504 13.939 1.00 0.00 H TER 71593 WAT 5478 ATOM 71593 O WAT 5479 18.716 67.839 82.187 1.00 0.00 O ATOM 71594 H1 WAT 5479 19.264 67.173 81.771 1.00 0.00 H ATOM 71595 H2 WAT 5479 18.885 68.636 81.685 1.00 0.00 H TER 71597 WAT 5479 ATOM 71597 O WAT 5480 58.358 119.696 82.879 1.00 0.00 O ATOM 71598 H1 WAT 5480 59.057 119.291 82.365 1.00 0.00 H ATOM 71599 H2 WAT 5480 57.719 118.996 83.009 1.00 0.00 H TER 71601 WAT 5480 ATOM 71601 O WAT 5481 118.204 37.474 83.851 1.00 0.00 O ATOM 71602 H1 WAT 5481 117.469 37.606 83.252 1.00 0.00 H ATOM 71603 H2 WAT 5481 118.763 38.239 83.718 1.00 0.00 H TER 71605 WAT 5481 ATOM 71605 O WAT 5482 104.706 123.951 148.156 1.00 0.00 O ATOM 71606 H1 WAT 5482 104.126 124.404 147.543 1.00 0.00 H ATOM 71607 H2 WAT 5482 104.162 123.261 148.535 1.00 0.00 H TER 71609 WAT 5482 ATOM 71609 O WAT 5483 3.490 103.144 2.790 1.00 0.00 O ATOM 71610 H1 WAT 5483 4.192 103.345 3.408 1.00 0.00 H ATOM 71611 H2 WAT 5483 3.198 102.266 3.035 1.00 0.00 H TER 71613 WAT 5483 ATOM 71613 O WAT 5484 16.048 112.410 127.976 1.00 0.00 O ATOM 71614 H1 WAT 5484 15.823 112.590 127.063 1.00 0.00 H ATOM 71615 H2 WAT 5484 16.799 111.819 127.925 1.00 0.00 H TER 71617 WAT 5484 ATOM 71617 O WAT 5485 36.370 47.752 89.246 1.00 0.00 O ATOM 71618 H1 WAT 5485 36.953 46.997 89.170 1.00 0.00 H ATOM 71619 H2 WAT 5485 36.919 48.442 89.619 1.00 0.00 H TER 71621 WAT 5485 ATOM 71621 O WAT 5486 120.264 139.575 117.807 1.00 0.00 O ATOM 71622 H1 WAT 5486 121.148 139.355 117.513 1.00 0.00 H ATOM 71623 H2 WAT 5486 120.112 140.457 117.470 1.00 0.00 H TER 71625 WAT 5486 ATOM 71625 O WAT 5487 116.668 92.832 122.179 1.00 0.00 O ATOM 71626 H1 WAT 5487 117.459 92.547 122.637 1.00 0.00 H ATOM 71627 H2 WAT 5487 116.884 93.703 121.847 1.00 0.00 H TER 71629 WAT 5487 ATOM 71629 O WAT 5488 54.446 91.121 66.166 1.00 0.00 O ATOM 71630 H1 WAT 5488 53.980 91.600 65.480 1.00 0.00 H ATOM 71631 H2 WAT 5488 54.631 90.266 65.776 1.00 0.00 H TER 71633 WAT 5488 ATOM 71633 O WAT 5489 67.996 23.330 61.289 1.00 0.00 O ATOM 71634 H1 WAT 5489 68.197 22.639 60.657 1.00 0.00 H ATOM 71635 H2 WAT 5489 67.186 23.723 60.965 1.00 0.00 H TER 71637 WAT 5489 ATOM 71637 O WAT 5490 82.113 84.234 3.033 1.00 0.00 O ATOM 71638 H1 WAT 5490 81.985 84.271 2.085 1.00 0.00 H ATOM 71639 H2 WAT 5490 81.395 83.685 3.350 1.00 0.00 H TER 71641 WAT 5490 ATOM 71641 O WAT 5491 57.615 124.223 91.922 1.00 0.00 O ATOM 71642 H1 WAT 5491 58.176 124.839 91.451 1.00 0.00 H ATOM 71643 H2 WAT 5491 57.607 123.438 91.374 1.00 0.00 H TER 71645 WAT 5491 ATOM 71645 O WAT 5492 82.195 47.637 128.465 1.00 0.00 O ATOM 71646 H1 WAT 5492 82.461 47.165 127.676 1.00 0.00 H ATOM 71647 H2 WAT 5492 81.948 48.507 128.152 1.00 0.00 H TER 71649 WAT 5492 ATOM 71649 O WAT 5493 41.858 135.398 82.135 1.00 0.00 O ATOM 71650 H1 WAT 5493 40.928 135.191 82.037 1.00 0.00 H ATOM 71651 H2 WAT 5493 42.040 135.248 83.062 1.00 0.00 H TER 71653 WAT 5493 ATOM 71653 O WAT 5494 69.613 93.944 145.394 1.00 0.00 O ATOM 71654 H1 WAT 5494 69.465 94.332 144.531 1.00 0.00 H ATOM 71655 H2 WAT 5494 69.769 93.017 145.216 1.00 0.00 H TER 71657 WAT 5494 ATOM 71657 O WAT 5495 24.936 141.983 97.030 1.00 0.00 O ATOM 71658 H1 WAT 5495 24.432 141.183 96.880 1.00 0.00 H ATOM 71659 H2 WAT 5495 24.327 142.570 97.477 1.00 0.00 H TER 71661 WAT 5495 ATOM 71661 O WAT 5496 26.089 29.291 145.015 1.00 0.00 O ATOM 71662 H1 WAT 5496 26.996 29.398 145.303 1.00 0.00 H ATOM 71663 H2 WAT 5496 25.588 29.883 145.576 1.00 0.00 H TER 71665 WAT 5496 ATOM 71665 O WAT 5497 50.567 98.248 28.403 1.00 0.00 O ATOM 71666 H1 WAT 5497 51.333 98.362 27.841 1.00 0.00 H ATOM 71667 H2 WAT 5497 50.053 99.045 28.272 1.00 0.00 H TER 71669 WAT 5497 ATOM 71669 O WAT 5498 77.724 121.165 7.593 1.00 0.00 O ATOM 71670 H1 WAT 5498 77.222 121.941 7.845 1.00 0.00 H ATOM 71671 H2 WAT 5498 77.078 120.580 7.196 1.00 0.00 H TER 71673 WAT 5498 ATOM 71673 O WAT 5499 58.271 91.273 68.850 1.00 0.00 O ATOM 71674 H1 WAT 5499 57.482 91.750 68.592 1.00 0.00 H ATOM 71675 H2 WAT 5499 58.917 91.500 68.181 1.00 0.00 H TER 71677 WAT 5499 ATOM 71677 O WAT 5500 66.938 68.005 115.577 1.00 0.00 O ATOM 71678 H1 WAT 5500 67.044 67.128 115.945 1.00 0.00 H ATOM 71679 H2 WAT 5500 66.452 68.488 116.246 1.00 0.00 H TER 71681 WAT 5500 ATOM 71681 O WAT 5501 79.044 8.541 132.366 1.00 0.00 O ATOM 71682 H1 WAT 5501 78.414 9.082 131.890 1.00 0.00 H ATOM 71683 H2 WAT 5501 79.740 9.148 132.616 1.00 0.00 H TER 71685 WAT 5501 ATOM 71685 O WAT 5502 12.030 73.643 62.592 1.00 0.00 O ATOM 71686 H1 WAT 5502 11.476 73.624 61.811 1.00 0.00 H ATOM 71687 H2 WAT 5502 12.890 73.360 62.282 1.00 0.00 H TER 71689 WAT 5502 ATOM 71689 O WAT 5503 107.840 113.889 118.945 1.00 0.00 O ATOM 71690 H1 WAT 5503 108.204 113.010 118.837 1.00 0.00 H ATOM 71691 H2 WAT 5503 106.898 113.748 119.041 1.00 0.00 H TER 71693 WAT 5503 ATOM 71693 O WAT 5504 72.115 16.235 87.153 1.00 0.00 O ATOM 71694 H1 WAT 5504 72.049 17.001 86.583 1.00 0.00 H ATOM 71695 H2 WAT 5504 72.763 15.674 86.726 1.00 0.00 H TER 71697 WAT 5504 ATOM 71697 O WAT 5505 15.493 90.025 77.947 1.00 0.00 O ATOM 71698 H1 WAT 5505 15.030 90.830 78.180 1.00 0.00 H ATOM 71699 H2 WAT 5505 16.334 90.093 78.398 1.00 0.00 H TER 71701 WAT 5505 ATOM 71701 O WAT 5506 96.984 31.212 57.535 1.00 0.00 O ATOM 71702 H1 WAT 5506 96.130 31.226 57.966 1.00 0.00 H ATOM 71703 H2 WAT 5506 97.236 30.288 57.533 1.00 0.00 H TER 71705 WAT 5506 ATOM 71705 O WAT 5507 13.318 132.776 123.292 1.00 0.00 O ATOM 71706 H1 WAT 5507 14.138 132.283 123.286 1.00 0.00 H ATOM 71707 H2 WAT 5507 13.226 133.097 122.395 1.00 0.00 H TER 71709 WAT 5507 ATOM 71709 O WAT 5508 34.997 97.209 6.154 1.00 0.00 O ATOM 71710 H1 WAT 5508 34.632 96.810 6.944 1.00 0.00 H ATOM 71711 H2 WAT 5508 35.821 97.601 6.443 1.00 0.00 H TER 71713 WAT 5508 ATOM 71713 O WAT 5509 116.646 95.044 84.542 1.00 0.00 O ATOM 71714 H1 WAT 5509 117.182 94.298 84.813 1.00 0.00 H ATOM 71715 H2 WAT 5509 115.744 94.736 84.633 1.00 0.00 H TER 71717 WAT 5509 ATOM 71717 O WAT 5510 71.270 100.887 142.868 1.00 0.00 O ATOM 71718 H1 WAT 5510 70.999 100.859 141.951 1.00 0.00 H ATOM 71719 H2 WAT 5510 71.937 101.573 142.899 1.00 0.00 H TER 71721 WAT 5510 ATOM 71721 O WAT 5511 111.109 33.900 101.223 1.00 0.00 O ATOM 71722 H1 WAT 5511 111.791 33.941 100.553 1.00 0.00 H ATOM 71723 H2 WAT 5511 111.140 32.998 101.542 1.00 0.00 H TER 71725 WAT 5511 ATOM 71725 O WAT 5512 31.714 113.670 155.787 1.00 0.00 O ATOM 71726 H1 WAT 5512 32.218 113.163 156.424 1.00 0.00 H ATOM 71727 H2 WAT 5512 30.966 114.002 156.282 1.00 0.00 H TER 71729 WAT 5512 ATOM 71729 O WAT 5513 4.541 49.064 142.860 1.00 0.00 O ATOM 71730 H1 WAT 5513 4.432 49.812 142.272 1.00 0.00 H ATOM 71731 H2 WAT 5513 5.022 49.415 143.609 1.00 0.00 H TER 71733 WAT 5513 ATOM 71733 O WAT 5514 103.160 101.922 91.649 1.00 0.00 O ATOM 71734 H1 WAT 5514 103.858 101.306 91.870 1.00 0.00 H ATOM 71735 H2 WAT 5514 103.613 102.664 91.249 1.00 0.00 H TER 71737 WAT 5514 ATOM 71737 O WAT 5515 135.270 76.998 71.835 1.00 0.00 O ATOM 71738 H1 WAT 5515 134.536 76.581 71.384 1.00 0.00 H ATOM 71739 H2 WAT 5515 134.952 77.873 72.054 1.00 0.00 H TER 71741 WAT 5515 ATOM 71741 O WAT 5516 74.113 94.895 85.784 1.00 0.00 O ATOM 71742 H1 WAT 5516 73.866 95.324 84.964 1.00 0.00 H ATOM 71743 H2 WAT 5516 74.996 95.218 85.967 1.00 0.00 H TER 71745 WAT 5516 ATOM 71745 O WAT 5517 7.243 140.658 122.868 1.00 0.00 O ATOM 71746 H1 WAT 5517 6.674 141.005 122.181 1.00 0.00 H ATOM 71747 H2 WAT 5517 7.974 141.274 122.908 1.00 0.00 H TER 71749 WAT 5517 ATOM 71749 O WAT 5518 15.232 12.650 117.914 1.00 0.00 O ATOM 71750 H1 WAT 5518 14.663 13.114 118.529 1.00 0.00 H ATOM 71751 H2 WAT 5518 16.008 12.426 118.427 1.00 0.00 H TER 71753 WAT 5518 ATOM 71753 O WAT 5519 92.644 76.382 71.403 1.00 0.00 O ATOM 71754 H1 WAT 5519 91.789 76.130 71.752 1.00 0.00 H ATOM 71755 H2 WAT 5519 93.231 76.342 72.158 1.00 0.00 H TER 71757 WAT 5519 ATOM 71757 O WAT 5520 128.572 94.293 157.185 1.00 0.00 O ATOM 71758 H1 WAT 5520 128.546 95.098 156.669 1.00 0.00 H ATOM 71759 H2 WAT 5520 129.128 93.701 156.679 1.00 0.00 H TER 71761 WAT 5520 ATOM 71761 O WAT 5521 5.299 15.749 13.220 1.00 0.00 O ATOM 71762 H1 WAT 5521 5.772 16.491 12.844 1.00 0.00 H ATOM 71763 H2 WAT 5521 5.391 15.052 12.570 1.00 0.00 H TER 71765 WAT 5521 ATOM 71765 O WAT 5522 109.210 137.618 127.475 1.00 0.00 O ATOM 71766 H1 WAT 5522 109.253 138.572 127.400 1.00 0.00 H ATOM 71767 H2 WAT 5522 108.545 137.461 128.145 1.00 0.00 H TER 71769 WAT 5522 ATOM 71769 O WAT 5523 21.206 107.972 116.086 1.00 0.00 O ATOM 71770 H1 WAT 5523 20.870 107.999 115.190 1.00 0.00 H ATOM 71771 H2 WAT 5523 21.997 108.510 116.062 1.00 0.00 H TER 71773 WAT 5523 ATOM 71773 O WAT 5524 23.180 43.569 81.815 1.00 0.00 O ATOM 71774 H1 WAT 5524 22.768 43.092 81.095 1.00 0.00 H ATOM 71775 H2 WAT 5524 24.010 43.879 81.453 1.00 0.00 H TER 71777 WAT 5524 ATOM 71777 O WAT 5525 0.684 131.627 63.233 1.00 0.00 O ATOM 71778 H1 WAT 5525 1.344 130.973 63.465 1.00 0.00 H ATOM 71779 H2 WAT 5525 0.080 131.162 62.654 1.00 0.00 H TER 71781 WAT 5525 ATOM 71781 O WAT 5526 25.205 53.177 81.074 1.00 0.00 O ATOM 71782 H1 WAT 5526 25.816 52.556 80.678 1.00 0.00 H ATOM 71783 H2 WAT 5526 24.344 52.776 80.954 1.00 0.00 H TER 71785 WAT 5526 ATOM 71785 O WAT 5527 24.171 135.298 67.393 1.00 0.00 O ATOM 71786 H1 WAT 5527 24.185 134.971 68.292 1.00 0.00 H ATOM 71787 H2 WAT 5527 23.273 135.604 67.264 1.00 0.00 H TER 71789 WAT 5527 ATOM 71789 O WAT 5528 11.401 24.285 136.638 1.00 0.00 O ATOM 71790 H1 WAT 5528 10.692 24.677 137.149 1.00 0.00 H ATOM 71791 H2 WAT 5528 11.053 24.233 135.748 1.00 0.00 H TER 71793 WAT 5528 ATOM 71793 O WAT 5529 93.221 75.793 112.073 1.00 0.00 O ATOM 71794 H1 WAT 5529 93.598 76.139 112.881 1.00 0.00 H ATOM 71795 H2 WAT 5529 93.860 76.014 111.396 1.00 0.00 H TER 71797 WAT 5529 ATOM 71797 O WAT 5530 45.149 117.779 10.966 1.00 0.00 O ATOM 71798 H1 WAT 5530 44.608 118.259 11.592 1.00 0.00 H ATOM 71799 H2 WAT 5530 44.547 117.541 10.261 1.00 0.00 H TER 71801 WAT 5530 ATOM 71801 O WAT 5531 116.209 90.531 66.845 1.00 0.00 O ATOM 71802 H1 WAT 5531 117.119 90.334 67.069 1.00 0.00 H ATOM 71803 H2 WAT 5531 115.908 91.105 67.549 1.00 0.00 H TER 71805 WAT 5531 ATOM 71805 O WAT 5532 110.255 58.229 123.460 1.00 0.00 O ATOM 71806 H1 WAT 5532 109.722 58.547 124.188 1.00 0.00 H ATOM 71807 H2 WAT 5532 109.949 57.334 123.311 1.00 0.00 H TER 71809 WAT 5532 ATOM 71809 O WAT 5533 30.213 54.611 105.285 1.00 0.00 O ATOM 71810 H1 WAT 5533 29.347 54.919 105.552 1.00 0.00 H ATOM 71811 H2 WAT 5533 30.047 53.775 104.849 1.00 0.00 H TER 71813 WAT 5533 ATOM 71813 O WAT 5534 101.058 63.941 77.331 1.00 0.00 O ATOM 71814 H1 WAT 5534 100.777 64.508 78.049 1.00 0.00 H ATOM 71815 H2 WAT 5534 102.010 63.896 77.421 1.00 0.00 H TER 71817 WAT 5534 ATOM 71817 O WAT 5535 103.508 127.585 90.410 1.00 0.00 O ATOM 71818 H1 WAT 5535 102.946 126.883 90.083 1.00 0.00 H ATOM 71819 H2 WAT 5535 103.847 127.253 91.242 1.00 0.00 H TER 71821 WAT 5535 ATOM 71821 O WAT 5536 44.422 63.981 153.848 1.00 0.00 O ATOM 71822 H1 WAT 5536 43.636 64.402 154.195 1.00 0.00 H ATOM 71823 H2 WAT 5536 44.202 63.051 153.815 1.00 0.00 H TER 71825 WAT 5536 ATOM 71825 O WAT 5537 100.211 9.168 135.686 1.00 0.00 O ATOM 71826 H1 WAT 5537 100.527 10.042 135.914 1.00 0.00 H ATOM 71827 H2 WAT 5537 100.982 8.606 135.761 1.00 0.00 H TER 71829 WAT 5537 ATOM 71829 O WAT 5538 134.745 67.456 155.282 1.00 0.00 O ATOM 71830 H1 WAT 5538 134.792 67.023 156.134 1.00 0.00 H ATOM 71831 H2 WAT 5538 134.108 66.940 154.787 1.00 0.00 H TER 71833 WAT 5538 ATOM 71833 O WAT 5539 131.487 135.745 87.052 1.00 0.00 O ATOM 71834 H1 WAT 5539 131.910 134.928 87.313 1.00 0.00 H ATOM 71835 H2 WAT 5539 131.288 136.187 87.877 1.00 0.00 H TER 71837 WAT 5539 ATOM 71837 O WAT 5540 77.130 123.333 104.339 1.00 0.00 O ATOM 71838 H1 WAT 5540 76.937 123.742 103.496 1.00 0.00 H ATOM 71839 H2 WAT 5540 78.052 123.084 104.279 1.00 0.00 H TER 71841 WAT 5540 ATOM 71841 O WAT 5541 5.935 74.008 64.196 1.00 0.00 O ATOM 71842 H1 WAT 5541 6.194 74.781 64.699 1.00 0.00 H ATOM 71843 H2 WAT 5541 5.287 73.570 64.748 1.00 0.00 H TER 71845 WAT 5541 ATOM 71845 O WAT 5542 113.736 139.377 109.077 1.00 0.00 O ATOM 71846 H1 WAT 5542 114.550 139.350 109.579 1.00 0.00 H ATOM 71847 H2 WAT 5542 114.014 139.289 108.165 1.00 0.00 H TER 71849 WAT 5542 ATOM 71849 O WAT 5543 14.222 54.898 88.039 1.00 0.00 O ATOM 71850 H1 WAT 5543 14.613 55.653 87.600 1.00 0.00 H ATOM 71851 H2 WAT 5543 14.087 54.258 87.341 1.00 0.00 H TER 71853 WAT 5543 ATOM 71853 O WAT 5544 97.897 68.816 155.660 1.00 0.00 O ATOM 71854 H1 WAT 5544 97.156 69.112 156.189 1.00 0.00 H ATOM 71855 H2 WAT 5544 97.695 67.904 155.454 1.00 0.00 H TER 71857 WAT 5544 ATOM 71857 O WAT 5545 124.686 51.012 9.319 1.00 0.00 O ATOM 71858 H1 WAT 5545 125.635 51.133 9.362 1.00 0.00 H ATOM 71859 H2 WAT 5545 124.471 51.134 8.394 1.00 0.00 H TER 71861 WAT 5545 ATOM 71861 O WAT 5546 39.847 25.775 120.884 1.00 0.00 O ATOM 71862 H1 WAT 5546 39.127 26.403 120.840 1.00 0.00 H ATOM 71863 H2 WAT 5546 40.418 26.014 120.154 1.00 0.00 H TER 71865 WAT 5546 ATOM 71865 O WAT 5547 115.639 124.063 71.699 1.00 0.00 O ATOM 71866 H1 WAT 5547 115.635 123.647 72.561 1.00 0.00 H ATOM 71867 H2 WAT 5547 115.141 124.872 71.822 1.00 0.00 H TER 71869 WAT 5547 ATOM 71869 O WAT 5548 48.489 129.216 72.422 1.00 0.00 O ATOM 71870 H1 WAT 5548 48.933 128.379 72.283 1.00 0.00 H ATOM 71871 H2 WAT 5548 48.224 129.494 71.545 1.00 0.00 H TER 71873 WAT 5548 ATOM 71873 O WAT 5549 78.146 25.721 99.188 1.00 0.00 O ATOM 71874 H1 WAT 5549 77.697 25.332 98.437 1.00 0.00 H ATOM 71875 H2 WAT 5549 77.516 26.346 99.547 1.00 0.00 H TER 71877 WAT 5549 ATOM 71877 O WAT 5550 40.475 129.862 6.762 1.00 0.00 O ATOM 71878 H1 WAT 5550 40.945 129.399 7.456 1.00 0.00 H ATOM 71879 H2 WAT 5550 39.764 130.315 7.216 1.00 0.00 H TER 71881 WAT 5550 ATOM 71881 O WAT 5551 126.889 89.457 7.969 1.00 0.00 O ATOM 71882 H1 WAT 5551 126.023 89.244 7.622 1.00 0.00 H ATOM 71883 H2 WAT 5551 127.165 88.662 8.425 1.00 0.00 H TER 71885 WAT 5551 ATOM 71885 O WAT 5552 3.332 116.976 103.866 1.00 0.00 O ATOM 71886 H1 WAT 5552 2.612 116.344 103.861 1.00 0.00 H ATOM 71887 H2 WAT 5552 2.977 117.745 103.419 1.00 0.00 H TER 71889 WAT 5552 ATOM 71889 O WAT 5553 81.930 0.661 86.508 1.00 0.00 O ATOM 71890 H1 WAT 5553 81.956 -0.292 86.421 1.00 0.00 H ATOM 71891 H2 WAT 5553 81.034 0.852 86.786 1.00 0.00 H TER 71893 WAT 5553 ATOM 71893 O WAT 5554 3.336 107.437 96.178 1.00 0.00 O ATOM 71894 H1 WAT 5554 3.949 106.746 96.429 1.00 0.00 H ATOM 71895 H2 WAT 5554 2.494 106.990 96.091 1.00 0.00 H TER 71897 WAT 5554 ATOM 71897 O WAT 5555 122.741 80.826 20.194 1.00 0.00 O ATOM 71898 H1 WAT 5555 122.413 81.376 20.905 1.00 0.00 H ATOM 71899 H2 WAT 5555 122.561 81.328 19.399 1.00 0.00 H TER 71901 WAT 5555 ATOM 71901 O WAT 5556 141.866 55.704 89.988 1.00 0.00 O ATOM 71902 H1 WAT 5556 142.644 55.214 89.721 1.00 0.00 H ATOM 71903 H2 WAT 5556 142.047 56.605 89.717 1.00 0.00 H TER 71905 WAT 5556 ATOM 71905 O WAT 5557 99.574 93.460 108.935 1.00 0.00 O ATOM 71906 H1 WAT 5557 98.866 92.946 108.544 1.00 0.00 H ATOM 71907 H2 WAT 5557 99.127 94.158 109.413 1.00 0.00 H TER 71909 WAT 5557 ATOM 71909 O WAT 5558 24.172 16.833 124.459 1.00 0.00 O ATOM 71910 H1 WAT 5558 24.498 17.180 125.290 1.00 0.00 H ATOM 71911 H2 WAT 5558 24.952 16.503 124.014 1.00 0.00 H TER 71913 WAT 5558 ATOM 71913 O WAT 5559 58.290 143.750 141.043 1.00 0.00 O ATOM 71914 H1 WAT 5559 57.769 144.000 140.280 1.00 0.00 H ATOM 71915 H2 WAT 5559 58.937 143.135 140.699 1.00 0.00 H TER 71917 WAT 5559 ATOM 71917 O WAT 5560 123.716 88.732 4.320 1.00 0.00 O ATOM 71918 H1 WAT 5560 124.497 88.704 3.767 1.00 0.00 H ATOM 71919 H2 WAT 5560 123.623 89.655 4.555 1.00 0.00 H TER 71921 WAT 5560 ATOM 71921 O WAT 5561 62.099 108.082 156.434 1.00 0.00 O ATOM 71922 H1 WAT 5561 63.020 108.073 156.698 1.00 0.00 H ATOM 71923 H2 WAT 5561 61.698 108.750 156.990 1.00 0.00 H TER 71925 WAT 5561 ATOM 71925 O WAT 5562 135.449 19.389 136.229 1.00 0.00 O ATOM 71926 H1 WAT 5562 135.938 18.622 135.932 1.00 0.00 H ATOM 71927 H2 WAT 5562 134.679 19.028 136.668 1.00 0.00 H TER 71929 WAT 5562 ATOM 71929 O WAT 5563 134.920 97.615 74.620 1.00 0.00 O ATOM 71930 H1 WAT 5563 135.834 97.550 74.343 1.00 0.00 H ATOM 71931 H2 WAT 5563 134.570 96.732 74.500 1.00 0.00 H TER 71933 WAT 5563 ATOM 71933 O WAT 5564 28.092 98.529 97.501 1.00 0.00 O ATOM 71934 H1 WAT 5564 27.865 98.114 96.669 1.00 0.00 H ATOM 71935 H2 WAT 5564 28.569 97.854 97.983 1.00 0.00 H TER 71937 WAT 5564 ATOM 71937 O WAT 5565 69.201 15.485 24.863 1.00 0.00 O ATOM 71938 H1 WAT 5565 68.906 14.583 24.986 1.00 0.00 H ATOM 71939 H2 WAT 5565 69.154 15.873 25.737 1.00 0.00 H TER 71941 WAT 5565 ATOM 71941 O WAT 5566 18.060 13.846 2.946 1.00 0.00 O ATOM 71942 H1 WAT 5566 17.762 12.959 3.144 1.00 0.00 H ATOM 71943 H2 WAT 5566 17.411 14.186 2.330 1.00 0.00 H TER 71945 WAT 5566 ATOM 71945 O WAT 5567 140.188 124.495 137.804 1.00 0.00 O ATOM 71946 H1 WAT 5567 140.300 123.683 138.299 1.00 0.00 H ATOM 71947 H2 WAT 5567 139.714 124.232 137.016 1.00 0.00 H TER 71949 WAT 5567 ATOM 71949 O WAT 5568 94.138 11.632 -0.144 1.00 0.00 O ATOM 71950 H1 WAT 5568 93.337 12.126 0.032 1.00 0.00 H ATOM 71951 H2 WAT 5568 94.062 10.850 0.403 1.00 0.00 H TER 71953 WAT 5568 ATOM 71953 O WAT 5569 98.624 5.085 92.559 1.00 0.00 O ATOM 71954 H1 WAT 5569 98.772 4.457 91.852 1.00 0.00 H ATOM 71955 H2 WAT 5569 98.048 5.746 92.176 1.00 0.00 H TER 71957 WAT 5569 ATOM 71957 O WAT 5570 73.804 60.752 105.170 1.00 0.00 O ATOM 71958 H1 WAT 5570 74.677 60.957 105.503 1.00 0.00 H ATOM 71959 H2 WAT 5570 73.802 59.800 105.075 1.00 0.00 H TER 71961 WAT 5570 ATOM 71961 O WAT 5571 7.525 135.674 106.453 1.00 0.00 O ATOM 71962 H1 WAT 5571 8.162 135.004 106.204 1.00 0.00 H ATOM 71963 H2 WAT 5571 7.259 136.071 105.624 1.00 0.00 H TER 71965 WAT 5571 ATOM 71965 O WAT 5572 75.456 138.694 70.383 1.00 0.00 O ATOM 71966 H1 WAT 5572 75.195 139.011 71.247 1.00 0.00 H ATOM 71967 H2 WAT 5572 75.542 137.747 70.490 1.00 0.00 H TER 71969 WAT 5572 ATOM 71969 O WAT 5573 68.856 56.530 120.519 1.00 0.00 O ATOM 71970 H1 WAT 5573 69.597 56.824 121.049 1.00 0.00 H ATOM 71971 H2 WAT 5573 68.128 57.086 120.797 1.00 0.00 H TER 71973 WAT 5573 ATOM 71973 O WAT 5574 85.225 6.789 4.254 1.00 0.00 O ATOM 71974 H1 WAT 5574 85.093 5.904 4.594 1.00 0.00 H ATOM 71975 H2 WAT 5574 84.784 6.788 3.405 1.00 0.00 H TER 71977 WAT 5574 ATOM 71977 O WAT 5575 15.636 133.770 92.498 1.00 0.00 O ATOM 71978 H1 WAT 5575 15.753 133.892 91.556 1.00 0.00 H ATOM 71979 H2 WAT 5575 15.950 134.588 92.886 1.00 0.00 H TER 71981 WAT 5575 ATOM 71981 O WAT 5576 109.726 100.323 15.581 1.00 0.00 O ATOM 71982 H1 WAT 5576 110.489 99.818 15.302 1.00 0.00 H ATOM 71983 H2 WAT 5576 109.427 99.884 16.378 1.00 0.00 H TER 71985 WAT 5576 ATOM 71985 O WAT 5577 133.267 46.189 108.703 1.00 0.00 O ATOM 71986 H1 WAT 5577 133.372 45.524 109.384 1.00 0.00 H ATOM 71987 H2 WAT 5577 133.629 45.784 107.915 1.00 0.00 H TER 71989 WAT 5577 ATOM 71989 O WAT 5578 99.519 87.235 60.401 1.00 0.00 O ATOM 71990 H1 WAT 5578 98.732 87.381 59.876 1.00 0.00 H ATOM 71991 H2 WAT 5578 99.294 86.499 60.969 1.00 0.00 H TER 71993 WAT 5578 ATOM 71993 O WAT 5579 25.700 50.568 90.655 1.00 0.00 O ATOM 71994 H1 WAT 5579 25.177 51.368 90.708 1.00 0.00 H ATOM 71995 H2 WAT 5579 26.566 50.826 90.969 1.00 0.00 H TER 71997 WAT 5579 ATOM 71997 O WAT 5580 126.033 56.677 119.267 1.00 0.00 O ATOM 71998 H1 WAT 5580 125.245 56.600 119.805 1.00 0.00 H ATOM 71999 H2 WAT 5580 126.717 56.250 119.781 1.00 0.00 H TER 72001 WAT 5580 ATOM 72001 O WAT 5581 141.476 12.601 146.811 1.00 0.00 O ATOM 72002 H1 WAT 5581 141.265 13.134 146.045 1.00 0.00 H ATOM 72003 H2 WAT 5581 142.211 12.057 146.529 1.00 0.00 H TER 72005 WAT 5581 ATOM 72005 O WAT 5582 67.389 42.376 20.474 1.00 0.00 O ATOM 72006 H1 WAT 5582 67.313 43.066 21.134 1.00 0.00 H ATOM 72007 H2 WAT 5582 68.028 41.765 20.841 1.00 0.00 H TER 72009 WAT 5582 ATOM 72009 O WAT 5583 90.668 42.384 3.480 1.00 0.00 O ATOM 72010 H1 WAT 5583 90.512 41.478 3.215 1.00 0.00 H ATOM 72011 H2 WAT 5583 89.959 42.581 4.092 1.00 0.00 H TER 72013 WAT 5583 ATOM 72013 O WAT 5584 98.971 145.170 10.744 1.00 0.00 O ATOM 72014 H1 WAT 5584 99.833 145.352 10.368 1.00 0.00 H ATOM 72015 H2 WAT 5584 98.686 144.364 10.312 1.00 0.00 H TER 72017 WAT 5584 ATOM 72017 O WAT 5585 79.097 90.947 137.176 1.00 0.00 O ATOM 72018 H1 WAT 5585 79.632 90.255 136.787 1.00 0.00 H ATOM 72019 H2 WAT 5585 79.718 91.650 137.369 1.00 0.00 H TER 72021 WAT 5585 ATOM 72021 O WAT 5586 78.080 83.174 7.023 1.00 0.00 O ATOM 72022 H1 WAT 5586 78.682 83.036 7.754 1.00 0.00 H ATOM 72023 H2 WAT 5586 77.914 84.116 7.023 1.00 0.00 H TER 72025 WAT 5586 ATOM 72025 O WAT 5587 137.836 33.114 134.196 1.00 0.00 O ATOM 72026 H1 WAT 5587 137.337 32.619 133.547 1.00 0.00 H ATOM 72027 H2 WAT 5587 138.644 33.356 133.744 1.00 0.00 H TER 72029 WAT 5587 ATOM 72029 O WAT 5588 93.344 74.648 143.528 1.00 0.00 O ATOM 72030 H1 WAT 5588 93.660 75.541 143.671 1.00 0.00 H ATOM 72031 H2 WAT 5588 93.860 74.327 142.788 1.00 0.00 H TER 72033 WAT 5588 ATOM 72033 O WAT 5589 52.086 101.780 136.419 1.00 0.00 O ATOM 72034 H1 WAT 5589 51.166 101.517 136.445 1.00 0.00 H ATOM 72035 H2 WAT 5589 52.228 102.070 135.518 1.00 0.00 H TER 72037 WAT 5589 ATOM 72037 O WAT 5590 30.982 42.775 14.090 1.00 0.00 O ATOM 72038 H1 WAT 5590 31.778 42.730 14.620 1.00 0.00 H ATOM 72039 H2 WAT 5590 30.295 42.430 14.660 1.00 0.00 H TER 72041 WAT 5590 ATOM 72041 O WAT 5591 110.920 43.507 90.329 1.00 0.00 O ATOM 72042 H1 WAT 5591 111.020 44.366 89.918 1.00 0.00 H ATOM 72043 H2 WAT 5591 111.699 43.021 90.061 1.00 0.00 H TER 72045 WAT 5591 ATOM 72045 O WAT 5592 28.682 67.831 14.870 1.00 0.00 O ATOM 72046 H1 WAT 5592 28.535 67.448 14.005 1.00 0.00 H ATOM 72047 H2 WAT 5592 29.294 68.550 14.712 1.00 0.00 H TER 72049 WAT 5592 ATOM 72049 O WAT 5593 102.074 35.501 6.484 1.00 0.00 O ATOM 72050 H1 WAT 5593 101.923 35.578 7.427 1.00 0.00 H ATOM 72051 H2 WAT 5593 102.970 35.814 6.359 1.00 0.00 H TER 72053 WAT 5593 ATOM 72053 O WAT 5594 47.381 18.260 144.664 1.00 0.00 O ATOM 72054 H1 WAT 5594 47.249 18.060 145.591 1.00 0.00 H ATOM 72055 H2 WAT 5594 46.620 17.879 144.226 1.00 0.00 H TER 72057 WAT 5594 ATOM 72057 O WAT 5595 6.856 105.538 64.931 1.00 0.00 O ATOM 72058 H1 WAT 5595 5.954 105.842 65.030 1.00 0.00 H ATOM 72059 H2 WAT 5595 7.350 106.324 64.699 1.00 0.00 H TER 72061 WAT 5595 ATOM 72061 O WAT 5596 97.575 45.896 4.090 1.00 0.00 O ATOM 72062 H1 WAT 5596 96.975 45.238 3.739 1.00 0.00 H ATOM 72063 H2 WAT 5596 98.064 45.435 4.772 1.00 0.00 H TER 72065 WAT 5596 ATOM 72065 O WAT 5597 21.167 107.583 128.028 1.00 0.00 O ATOM 72066 H1 WAT 5597 21.332 107.736 128.959 1.00 0.00 H ATOM 72067 H2 WAT 5597 21.518 106.708 127.864 1.00 0.00 H TER 72069 WAT 5597 ATOM 72069 O WAT 5598 24.013 56.983 95.170 1.00 0.00 O ATOM 72070 H1 WAT 5598 24.429 56.180 94.856 1.00 0.00 H ATOM 72071 H2 WAT 5598 23.134 56.710 95.433 1.00 0.00 H TER 72073 WAT 5598 ATOM 72073 O WAT 5599 51.233 44.764 145.836 1.00 0.00 O ATOM 72074 H1 WAT 5599 50.534 44.237 145.450 1.00 0.00 H ATOM 72075 H2 WAT 5599 51.015 45.665 145.595 1.00 0.00 H TER 72077 WAT 5599 ATOM 72077 O WAT 5600 44.883 53.003 116.533 1.00 0.00 O ATOM 72078 H1 WAT 5600 45.761 53.238 116.230 1.00 0.00 H ATOM 72079 H2 WAT 5600 44.357 52.963 115.734 1.00 0.00 H TER 72081 WAT 5600 ATOM 72081 O WAT 5601 37.660 56.308 146.536 1.00 0.00 O ATOM 72082 H1 WAT 5601 37.528 55.586 147.150 1.00 0.00 H ATOM 72083 H2 WAT 5601 37.466 55.931 145.678 1.00 0.00 H TER 72085 WAT 5601 ATOM 72085 O WAT 5602 18.162 30.532 149.246 1.00 0.00 O ATOM 72086 H1 WAT 5602 17.591 31.297 149.180 1.00 0.00 H ATOM 72087 H2 WAT 5602 17.614 29.858 149.649 1.00 0.00 H TER 72089 WAT 5602 ATOM 72089 O WAT 5603 100.506 91.636 9.119 1.00 0.00 O ATOM 72090 H1 WAT 5603 100.792 91.113 9.868 1.00 0.00 H ATOM 72091 H2 WAT 5603 101.168 91.475 8.447 1.00 0.00 H TER 72093 WAT 5603 ATOM 72093 O WAT 5604 107.727 35.908 67.218 1.00 0.00 O ATOM 72094 H1 WAT 5604 108.498 35.347 67.295 1.00 0.00 H ATOM 72095 H2 WAT 5604 107.030 35.420 67.656 1.00 0.00 H TER 72097 WAT 5604 ATOM 72097 O WAT 5605 64.679 114.961 71.148 1.00 0.00 O ATOM 72098 H1 WAT 5605 65.487 114.558 70.829 1.00 0.00 H ATOM 72099 H2 WAT 5605 64.953 115.814 71.484 1.00 0.00 H TER 72101 WAT 5605 ATOM 72101 O WAT 5606 130.879 93.275 114.093 1.00 0.00 O ATOM 72102 H1 WAT 5606 130.295 93.093 114.828 1.00 0.00 H ATOM 72103 H2 WAT 5606 130.297 93.560 113.389 1.00 0.00 H TER 72105 WAT 5606 ATOM 72105 O WAT 5607 31.781 57.539 143.895 1.00 0.00 O ATOM 72106 H1 WAT 5607 32.550 58.035 144.176 1.00 0.00 H ATOM 72107 H2 WAT 5607 31.944 57.349 142.971 1.00 0.00 H TER 72109 WAT 5607 ATOM 72109 O WAT 5608 105.969 63.412 146.169 1.00 0.00 O ATOM 72110 H1 WAT 5608 106.693 62.801 146.309 1.00 0.00 H ATOM 72111 H2 WAT 5608 105.790 63.360 145.230 1.00 0.00 H TER 72113 WAT 5608 ATOM 72113 O WAT 5609 140.150 10.354 135.510 1.00 0.00 O ATOM 72114 H1 WAT 5609 140.375 9.672 134.876 1.00 0.00 H ATOM 72115 H2 WAT 5609 140.397 9.984 136.357 1.00 0.00 H TER 72117 WAT 5609 ATOM 72117 O WAT 5610 37.346 25.668 16.147 1.00 0.00 O ATOM 72118 H1 WAT 5610 36.916 25.239 15.408 1.00 0.00 H ATOM 72119 H2 WAT 5610 38.024 26.213 15.747 1.00 0.00 H TER 72121 WAT 5610 ATOM 72121 O WAT 5611 54.569 134.847 89.824 1.00 0.00 O ATOM 72122 H1 WAT 5611 53.634 134.702 89.682 1.00 0.00 H ATOM 72123 H2 WAT 5611 54.627 135.179 90.720 1.00 0.00 H TER 72125 WAT 5611 ATOM 72125 O WAT 5612 112.620 20.757 91.532 1.00 0.00 O ATOM 72126 H1 WAT 5612 113.239 20.883 92.251 1.00 0.00 H ATOM 72127 H2 WAT 5612 112.053 20.043 91.826 1.00 0.00 H TER 72129 WAT 5612 ATOM 72129 O WAT 5613 106.835 91.841 5.741 1.00 0.00 O ATOM 72130 H1 WAT 5613 107.473 91.784 6.452 1.00 0.00 H ATOM 72131 H2 WAT 5613 106.241 91.106 5.891 1.00 0.00 H TER 72133 WAT 5613 ATOM 72133 O WAT 5614 6.856 70.571 21.108 1.00 0.00 O ATOM 72134 H1 WAT 5614 7.449 71.308 21.257 1.00 0.00 H ATOM 72135 H2 WAT 5614 6.328 70.523 21.905 1.00 0.00 H TER 72137 WAT 5614 ATOM 72137 O WAT 5615 37.878 51.843 79.271 1.00 0.00 O ATOM 72138 H1 WAT 5615 37.204 52.247 78.724 1.00 0.00 H ATOM 72139 H2 WAT 5615 38.695 52.250 78.982 1.00 0.00 H TER 72141 WAT 5615 ATOM 72141 O WAT 5616 72.162 117.146 147.815 1.00 0.00 O ATOM 72142 H1 WAT 5616 71.723 116.369 147.469 1.00 0.00 H ATOM 72143 H2 WAT 5616 71.608 117.876 147.540 1.00 0.00 H TER 72145 WAT 5616 ATOM 72145 O WAT 5617 -0.125 26.934 142.781 1.00 0.00 O ATOM 72146 H1 WAT 5617 0.202 26.473 143.553 1.00 0.00 H ATOM 72147 H2 WAT 5617 0.036 26.331 142.055 1.00 0.00 H TER 72149 WAT 5617 ATOM 72149 O WAT 5618 34.960 10.519 86.273 1.00 0.00 O ATOM 72150 H1 WAT 5618 34.746 10.552 87.206 1.00 0.00 H ATOM 72151 H2 WAT 5618 34.599 9.684 85.974 1.00 0.00 H TER 72153 WAT 5618 ATOM 72153 O WAT 5619 39.023 69.042 156.105 1.00 0.00 O ATOM 72154 H1 WAT 5619 38.182 69.496 156.151 1.00 0.00 H ATOM 72155 H2 WAT 5619 38.874 68.213 156.559 1.00 0.00 H TER 72157 WAT 5619 ATOM 72157 O WAT 5620 7.215 55.368 152.436 1.00 0.00 O ATOM 72158 H1 WAT 5620 6.278 55.236 152.289 1.00 0.00 H ATOM 72159 H2 WAT 5620 7.263 55.838 153.269 1.00 0.00 H TER 72161 WAT 5620 ATOM 72161 O WAT 5621 31.581 43.073 134.252 1.00 0.00 O ATOM 72162 H1 WAT 5621 30.645 43.184 134.089 1.00 0.00 H ATOM 72163 H2 WAT 5621 31.633 42.771 135.159 1.00 0.00 H TER 72165 WAT 5621 ATOM 72165 O WAT 5622 89.448 40.673 64.742 1.00 0.00 O ATOM 72166 H1 WAT 5622 89.180 40.888 65.635 1.00 0.00 H ATOM 72167 H2 WAT 5622 88.890 41.219 64.187 1.00 0.00 H TER 72169 WAT 5622 ATOM 72169 O WAT 5623 74.750 133.896 87.914 1.00 0.00 O ATOM 72170 H1 WAT 5623 75.357 134.634 87.860 1.00 0.00 H ATOM 72171 H2 WAT 5623 73.990 134.243 88.379 1.00 0.00 H TER 72173 WAT 5623 ATOM 72173 O WAT 5624 91.054 44.837 105.612 1.00 0.00 O ATOM 72174 H1 WAT 5624 91.628 44.949 106.369 1.00 0.00 H ATOM 72175 H2 WAT 5624 91.647 44.830 104.861 1.00 0.00 H TER 72177 WAT 5624 ATOM 72177 O WAT 5625 11.592 92.543 79.398 1.00 0.00 O ATOM 72178 H1 WAT 5625 10.934 93.207 79.192 1.00 0.00 H ATOM 72179 H2 WAT 5625 11.425 92.316 80.313 1.00 0.00 H TER 72181 WAT 5625 ATOM 72181 O WAT 5626 35.514 85.477 139.838 1.00 0.00 O ATOM 72182 H1 WAT 5626 34.978 86.261 139.717 1.00 0.00 H ATOM 72183 H2 WAT 5626 36.414 85.785 139.733 1.00 0.00 H TER 72185 WAT 5626 ATOM 72185 O WAT 5627 64.159 84.153 17.494 1.00 0.00 O ATOM 72186 H1 WAT 5627 63.831 85.048 17.584 1.00 0.00 H ATOM 72187 H2 WAT 5627 64.660 84.000 18.296 1.00 0.00 H TER 72189 WAT 5627 ATOM 72189 O WAT 5628 35.068 131.027 114.800 1.00 0.00 O ATOM 72190 H1 WAT 5628 35.496 131.879 114.885 1.00 0.00 H ATOM 72191 H2 WAT 5628 34.776 130.995 113.889 1.00 0.00 H TER 72193 WAT 5628 ATOM 72193 O WAT 5629 53.521 36.220 1.575 1.00 0.00 O ATOM 72194 H1 WAT 5629 54.186 36.488 0.941 1.00 0.00 H ATOM 72195 H2 WAT 5629 53.128 37.040 1.872 1.00 0.00 H TER 72197 WAT 5629 ATOM 72197 O WAT 5630 39.782 88.303 63.479 1.00 0.00 O ATOM 72198 H1 WAT 5630 39.639 87.447 63.074 1.00 0.00 H ATOM 72199 H2 WAT 5630 38.952 88.765 63.363 1.00 0.00 H TER 72201 WAT 5630 ATOM 72201 O WAT 5631 120.744 14.779 148.386 1.00 0.00 O ATOM 72202 H1 WAT 5631 120.696 14.610 149.327 1.00 0.00 H ATOM 72203 H2 WAT 5631 120.262 14.053 147.988 1.00 0.00 H TER 72205 WAT 5631 ATOM 72205 O WAT 5632 51.320 13.278 121.013 1.00 0.00 O ATOM 72206 H1 WAT 5632 52.130 13.517 121.462 1.00 0.00 H ATOM 72207 H2 WAT 5632 50.675 13.188 121.715 1.00 0.00 H TER 72209 WAT 5632 ATOM 72209 O WAT 5633 11.407 13.864 83.136 1.00 0.00 O ATOM 72210 H1 WAT 5633 10.689 13.363 83.525 1.00 0.00 H ATOM 72211 H2 WAT 5633 11.505 13.498 82.257 1.00 0.00 H TER 72213 WAT 5633 ATOM 72213 O WAT 5634 0.336 121.032 114.936 1.00 0.00 O ATOM 72214 H1 WAT 5634 0.232 120.106 115.156 1.00 0.00 H ATOM 72215 H2 WAT 5634 1.250 121.226 115.142 1.00 0.00 H TER 72217 WAT 5634 ATOM 72217 O WAT 5635 82.515 32.811 108.757 1.00 0.00 O ATOM 72218 H1 WAT 5635 83.336 32.882 108.271 1.00 0.00 H ATOM 72219 H2 WAT 5635 82.781 32.565 109.643 1.00 0.00 H TER 72221 WAT 5635 ATOM 72221 O WAT 5636 91.476 110.484 149.613 1.00 0.00 O ATOM 72222 H1 WAT 5636 90.708 110.899 150.005 1.00 0.00 H ATOM 72223 H2 WAT 5636 91.839 109.942 150.313 1.00 0.00 H TER 72225 WAT 5636 ATOM 72225 O WAT 5637 85.943 85.440 143.296 1.00 0.00 O ATOM 72226 H1 WAT 5637 85.112 85.802 143.602 1.00 0.00 H ATOM 72227 H2 WAT 5637 85.868 84.499 143.452 1.00 0.00 H TER 72229 WAT 5637 ATOM 72229 O WAT 5638 11.900 104.920 142.695 1.00 0.00 O ATOM 72230 H1 WAT 5638 11.970 104.042 143.071 1.00 0.00 H ATOM 72231 H2 WAT 5638 12.321 105.490 143.339 1.00 0.00 H TER 72233 WAT 5638 ATOM 72233 O WAT 5639 6.249 53.773 156.767 1.00 0.00 O ATOM 72234 H1 WAT 5639 6.133 52.965 156.267 1.00 0.00 H ATOM 72235 H2 WAT 5639 7.165 53.754 157.043 1.00 0.00 H TER 72237 WAT 5639 ATOM 72237 O WAT 5640 59.450 38.885 71.669 1.00 0.00 O ATOM 72238 H1 WAT 5640 59.571 38.553 70.780 1.00 0.00 H ATOM 72239 H2 WAT 5640 60.249 39.379 71.852 1.00 0.00 H TER 72241 WAT 5640 ATOM 72241 O WAT 5641 107.592 15.048 20.742 1.00 0.00 O ATOM 72242 H1 WAT 5641 108.348 15.611 20.909 1.00 0.00 H ATOM 72243 H2 WAT 5641 106.845 15.647 20.733 1.00 0.00 H TER 72245 WAT 5641 ATOM 72245 O WAT 5642 85.814 22.739 64.165 1.00 0.00 O ATOM 72246 H1 WAT 5642 85.470 23.368 64.799 1.00 0.00 H ATOM 72247 H2 WAT 5642 85.849 21.911 64.644 1.00 0.00 H TER 72249 WAT 5642 ATOM 72249 O WAT 5643 13.814 138.285 112.896 1.00 0.00 O ATOM 72250 H1 WAT 5643 14.189 139.094 112.549 1.00 0.00 H ATOM 72251 H2 WAT 5643 14.408 137.597 112.598 1.00 0.00 H TER 72253 WAT 5643 ATOM 72253 O WAT 5644 44.644 106.655 55.408 1.00 0.00 O ATOM 72254 H1 WAT 5644 44.983 105.870 55.838 1.00 0.00 H ATOM 72255 H2 WAT 5644 44.184 106.326 54.636 1.00 0.00 H TER 72257 WAT 5644 ATOM 72257 O WAT 5645 20.143 109.880 83.381 1.00 0.00 O ATOM 72258 H1 WAT 5645 20.694 110.173 84.107 1.00 0.00 H ATOM 72259 H2 WAT 5645 19.539 109.253 83.778 1.00 0.00 H TER 72261 WAT 5645 ATOM 72261 O WAT 5646 134.479 59.446 60.914 1.00 0.00 O ATOM 72262 H1 WAT 5646 133.657 59.262 60.459 1.00 0.00 H ATOM 72263 H2 WAT 5646 134.319 60.272 61.372 1.00 0.00 H TER 72265 WAT 5646 ATOM 72265 O WAT 5647 33.231 47.154 94.459 1.00 0.00 O ATOM 72266 H1 WAT 5647 33.986 47.213 93.875 1.00 0.00 H ATOM 72267 H2 WAT 5647 32.473 47.204 93.877 1.00 0.00 H TER 72269 WAT 5647 ATOM 72269 O WAT 5648 56.210 32.483 96.446 1.00 0.00 O ATOM 72270 H1 WAT 5648 56.735 32.252 97.212 1.00 0.00 H ATOM 72271 H2 WAT 5648 56.037 31.647 96.013 1.00 0.00 H TER 72273 WAT 5648 ATOM 72273 O WAT 5649 30.898 133.428 2.077 1.00 0.00 O ATOM 72274 H1 WAT 5649 31.120 133.504 1.149 1.00 0.00 H ATOM 72275 H2 WAT 5649 31.514 132.781 2.419 1.00 0.00 H TER 72277 WAT 5649 ATOM 72277 O WAT 5650 88.398 0.899 140.877 1.00 0.00 O ATOM 72278 H1 WAT 5650 88.076 0.730 141.762 1.00 0.00 H ATOM 72279 H2 WAT 5650 89.102 0.262 140.753 1.00 0.00 H TER 72281 WAT 5650 ATOM 72281 O WAT 5651 38.835 70.545 70.322 1.00 0.00 O ATOM 72282 H1 WAT 5651 38.343 71.366 70.320 1.00 0.00 H ATOM 72283 H2 WAT 5651 39.010 70.373 71.248 1.00 0.00 H TER 72285 WAT 5651 ATOM 72285 O WAT 5652 96.892 9.620 112.376 1.00 0.00 O ATOM 72286 H1 WAT 5652 96.678 10.077 113.190 1.00 0.00 H ATOM 72287 H2 WAT 5652 97.543 10.179 111.952 1.00 0.00 H TER 72289 WAT 5652 ATOM 72289 O WAT 5653 15.854 94.676 123.214 1.00 0.00 O ATOM 72290 H1 WAT 5653 16.315 94.231 123.924 1.00 0.00 H ATOM 72291 H2 WAT 5653 15.400 95.403 123.641 1.00 0.00 H TER 72293 WAT 5653 ATOM 72293 O WAT 5654 97.148 31.254 84.877 1.00 0.00 O ATOM 72294 H1 WAT 5654 96.775 30.438 84.543 1.00 0.00 H ATOM 72295 H2 WAT 5654 97.579 31.649 84.119 1.00 0.00 H TER 72297 WAT 5654 ATOM 72297 O WAT 5655 117.678 121.154 112.250 1.00 0.00 O ATOM 72298 H1 WAT 5655 117.524 120.383 112.796 1.00 0.00 H ATOM 72299 H2 WAT 5655 117.658 120.821 111.353 1.00 0.00 H TER 72301 WAT 5655 ATOM 72301 O WAT 5656 1.234 97.532 83.248 1.00 0.00 O ATOM 72302 H1 WAT 5656 1.535 96.625 83.311 1.00 0.00 H ATOM 72303 H2 WAT 5656 0.542 97.600 83.905 1.00 0.00 H TER 72305 WAT 5656 ATOM 72305 O WAT 5657 136.446 125.807 107.086 1.00 0.00 O ATOM 72306 H1 WAT 5657 136.557 125.051 106.509 1.00 0.00 H ATOM 72307 H2 WAT 5657 136.586 125.459 107.967 1.00 0.00 H TER 72309 WAT 5657 ATOM 72309 O WAT 5658 116.127 81.364 97.613 1.00 0.00 O ATOM 72310 H1 WAT 5658 116.604 82.180 97.762 1.00 0.00 H ATOM 72311 H2 WAT 5658 116.806 80.726 97.393 1.00 0.00 H TER 72313 WAT 5658 ATOM 72313 O WAT 5659 119.547 41.026 65.469 1.00 0.00 O ATOM 72314 H1 WAT 5659 120.188 41.017 66.180 1.00 0.00 H ATOM 72315 H2 WAT 5659 118.957 41.748 65.687 1.00 0.00 H TER 72317 WAT 5659 ATOM 72317 O WAT 5660 67.067 14.919 82.718 1.00 0.00 O ATOM 72318 H1 WAT 5660 66.293 15.386 83.032 1.00 0.00 H ATOM 72319 H2 WAT 5660 67.769 15.199 83.305 1.00 0.00 H TER 72321 WAT 5660 ATOM 72321 O WAT 5661 94.142 111.697 111.363 1.00 0.00 O ATOM 72322 H1 WAT 5661 94.134 112.640 111.195 1.00 0.00 H ATOM 72323 H2 WAT 5661 93.729 111.313 110.590 1.00 0.00 H TER 72325 WAT 5661 ATOM 72325 O WAT 5662 130.569 66.302 25.221 1.00 0.00 O ATOM 72326 H1 WAT 5662 129.988 65.865 24.598 1.00 0.00 H ATOM 72327 H2 WAT 5662 130.943 65.590 25.740 1.00 0.00 H TER 72329 WAT 5662 ATOM 72329 O WAT 5663 141.419 34.088 140.866 1.00 0.00 O ATOM 72330 H1 WAT 5663 141.892 33.959 141.687 1.00 0.00 H ATOM 72331 H2 WAT 5663 140.873 34.859 141.023 1.00 0.00 H TER 72333 WAT 5663 ATOM 72333 O WAT 5664 42.707 22.766 128.975 1.00 0.00 O ATOM 72334 H1 WAT 5664 43.193 23.268 129.629 1.00 0.00 H ATOM 72335 H2 WAT 5664 42.477 21.950 129.420 1.00 0.00 H TER 72337 WAT 5664 ATOM 72337 O WAT 5665 25.881 118.323 129.281 1.00 0.00 O ATOM 72338 H1 WAT 5665 26.726 118.405 128.838 1.00 0.00 H ATOM 72339 H2 WAT 5665 25.240 118.603 128.628 1.00 0.00 H TER 72341 WAT 5665 ATOM 72341 O WAT 5666 45.659 126.484 100.538 1.00 0.00 O ATOM 72342 H1 WAT 5666 45.181 125.677 100.725 1.00 0.00 H ATOM 72343 H2 WAT 5666 46.196 126.273 99.774 1.00 0.00 H TER 72345 WAT 5666 ATOM 72345 O WAT 5667 43.553 6.102 140.240 1.00 0.00 O ATOM 72346 H1 WAT 5667 44.198 6.578 139.717 1.00 0.00 H ATOM 72347 H2 WAT 5667 42.824 5.948 139.639 1.00 0.00 H TER 72349 WAT 5667 ATOM 72349 O WAT 5668 72.324 84.230 15.060 1.00 0.00 O ATOM 72350 H1 WAT 5668 72.252 84.931 14.412 1.00 0.00 H ATOM 72351 H2 WAT 5668 73.226 84.286 15.375 1.00 0.00 H TER 72353 WAT 5668 ATOM 72353 O WAT 5669 60.186 18.040 95.925 1.00 0.00 O ATOM 72354 H1 WAT 5669 59.629 18.056 96.703 1.00 0.00 H ATOM 72355 H2 WAT 5669 60.996 17.623 96.219 1.00 0.00 H TER 72357 WAT 5669 ATOM 72357 O WAT 5670 96.153 137.555 82.330 1.00 0.00 O ATOM 72358 H1 WAT 5670 95.601 136.774 82.289 1.00 0.00 H ATOM 72359 H2 WAT 5670 95.616 138.204 82.784 1.00 0.00 H TER 72361 WAT 5670 ATOM 72361 O WAT 5671 28.122 61.340 104.669 1.00 0.00 O ATOM 72362 H1 WAT 5671 28.616 61.104 103.884 1.00 0.00 H ATOM 72363 H2 WAT 5671 27.653 60.539 104.905 1.00 0.00 H TER 72365 WAT 5671 ATOM 72365 O WAT 5672 124.212 86.224 11.313 1.00 0.00 O ATOM 72366 H1 WAT 5672 124.943 86.339 11.921 1.00 0.00 H ATOM 72367 H2 WAT 5672 123.823 87.095 11.238 1.00 0.00 H TER 72369 WAT 5672 ATOM 72369 O WAT 5673 134.598 83.125 62.126 1.00 0.00 O ATOM 72370 H1 WAT 5673 135.317 83.524 61.636 1.00 0.00 H ATOM 72371 H2 WAT 5673 134.025 83.859 62.350 1.00 0.00 H TER 72373 WAT 5673 ATOM 72373 O WAT 5674 119.474 110.125 65.730 1.00 0.00 O ATOM 72374 H1 WAT 5674 118.636 110.460 65.414 1.00 0.00 H ATOM 72375 H2 WAT 5674 120.122 110.496 65.131 1.00 0.00 H TER 72377 WAT 5674 ATOM 72377 O WAT 5675 6.999 77.337 117.922 1.00 0.00 O ATOM 72378 H1 WAT 5675 6.346 77.798 118.448 1.00 0.00 H ATOM 72379 H2 WAT 5675 6.679 76.436 117.877 1.00 0.00 H TER 72381 WAT 5675 ATOM 72381 O WAT 5676 112.653 30.620 111.043 1.00 0.00 O ATOM 72382 H1 WAT 5676 111.741 30.328 111.028 1.00 0.00 H ATOM 72383 H2 WAT 5676 112.785 30.949 111.932 1.00 0.00 H TER 72385 WAT 5676 ATOM 72385 O WAT 5677 34.730 51.949 1.695 1.00 0.00 O ATOM 72386 H1 WAT 5677 33.819 52.205 1.553 1.00 0.00 H ATOM 72387 H2 WAT 5677 34.929 52.252 2.581 1.00 0.00 H TER 72389 WAT 5677 ATOM 72389 O WAT 5678 139.979 133.536 8.058 1.00 0.00 O ATOM 72390 H1 WAT 5678 140.183 133.214 7.180 1.00 0.00 H ATOM 72391 H2 WAT 5678 139.336 132.913 8.397 1.00 0.00 H TER 72393 WAT 5678 ATOM 72393 O WAT 5679 11.091 51.514 73.662 1.00 0.00 O ATOM 72394 H1 WAT 5679 10.958 52.270 73.090 1.00 0.00 H ATOM 72395 H2 WAT 5679 10.338 50.948 73.489 1.00 0.00 H TER 72397 WAT 5679 ATOM 72397 O WAT 5680 119.265 15.727 132.535 1.00 0.00 O ATOM 72398 H1 WAT 5680 118.407 16.093 132.322 1.00 0.00 H ATOM 72399 H2 WAT 5680 119.329 14.938 131.996 1.00 0.00 H TER 72401 WAT 5680 ATOM 72401 O WAT 5681 102.963 66.941 80.375 1.00 0.00 O ATOM 72402 H1 WAT 5681 103.728 66.367 80.325 1.00 0.00 H ATOM 72403 H2 WAT 5681 102.872 67.137 81.308 1.00 0.00 H TER 72405 WAT 5681 ATOM 72405 O WAT 5682 27.875 112.111 106.374 1.00 0.00 O ATOM 72406 H1 WAT 5682 27.526 112.847 105.872 1.00 0.00 H ATOM 72407 H2 WAT 5682 28.231 111.518 105.712 1.00 0.00 H TER 72409 WAT 5682 ATOM 72409 O WAT 5683 119.548 143.484 105.229 1.00 0.00 O ATOM 72410 H1 WAT 5683 118.920 144.001 105.734 1.00 0.00 H ATOM 72411 H2 WAT 5683 119.877 142.834 105.850 1.00 0.00 H TER 72413 WAT 5683 ATOM 72413 O WAT 5684 117.419 115.152 103.727 1.00 0.00 O ATOM 72414 H1 WAT 5684 117.546 114.674 102.907 1.00 0.00 H ATOM 72415 H2 WAT 5684 118.107 115.817 103.725 1.00 0.00 H TER 72417 WAT 5684 ATOM 72417 O WAT 5685 84.102 42.816 16.565 1.00 0.00 O ATOM 72418 H1 WAT 5685 83.960 43.496 15.906 1.00 0.00 H ATOM 72419 H2 WAT 5685 83.768 42.016 16.159 1.00 0.00 H TER 72421 WAT 5685 ATOM 72421 O WAT 5686 63.228 103.747 8.666 1.00 0.00 O ATOM 72422 H1 WAT 5686 63.032 102.891 8.284 1.00 0.00 H ATOM 72423 H2 WAT 5686 63.137 104.361 7.938 1.00 0.00 H TER 72425 WAT 5686 ATOM 72425 O WAT 5687 54.294 71.629 2.276 1.00 0.00 O ATOM 72426 H1 WAT 5687 53.656 72.337 2.186 1.00 0.00 H ATOM 72427 H2 WAT 5687 55.083 71.962 1.849 1.00 0.00 H TER 72429 WAT 5687 ATOM 72429 O WAT 5688 15.130 25.183 80.267 1.00 0.00 O ATOM 72430 H1 WAT 5688 14.911 24.665 79.493 1.00 0.00 H ATOM 72431 H2 WAT 5688 14.974 24.592 81.003 1.00 0.00 H TER 72433 WAT 5688 ATOM 72433 O WAT 5689 66.265 110.654 125.135 1.00 0.00 O ATOM 72434 H1 WAT 5689 66.496 109.733 125.257 1.00 0.00 H ATOM 72435 H2 WAT 5689 66.619 111.094 125.908 1.00 0.00 H TER 72437 WAT 5689 ATOM 72437 O WAT 5690 42.372 74.727 75.152 1.00 0.00 O ATOM 72438 H1 WAT 5690 42.866 73.923 75.311 1.00 0.00 H ATOM 72439 H2 WAT 5690 42.757 75.368 75.751 1.00 0.00 H TER 72441 WAT 5690 ATOM 72441 O WAT 5691 55.562 29.037 66.166 1.00 0.00 O ATOM 72442 H1 WAT 5691 54.788 28.635 65.771 1.00 0.00 H ATOM 72443 H2 WAT 5691 56.252 28.917 65.514 1.00 0.00 H TER 72445 WAT 5691 ATOM 72445 O WAT 5692 125.364 142.408 94.778 1.00 0.00 O ATOM 72446 H1 WAT 5692 124.458 142.667 94.611 1.00 0.00 H ATOM 72447 H2 WAT 5692 125.712 142.185 93.915 1.00 0.00 H TER 72449 WAT 5692 ATOM 72449 O WAT 5693 83.238 11.683 61.964 1.00 0.00 O ATOM 72450 H1 WAT 5693 83.934 11.918 61.350 1.00 0.00 H ATOM 72451 H2 WAT 5693 82.752 10.988 61.520 1.00 0.00 H TER 72453 WAT 5693 ATOM 72453 O WAT 5694 42.269 127.435 146.146 1.00 0.00 O ATOM 72454 H1 WAT 5694 43.101 127.325 146.607 1.00 0.00 H ATOM 72455 H2 WAT 5694 41.722 126.718 146.467 1.00 0.00 H TER 72457 WAT 5694 ATOM 72457 O WAT 5695 67.428 21.227 51.335 1.00 0.00 O ATOM 72458 H1 WAT 5695 68.212 21.771 51.408 1.00 0.00 H ATOM 72459 H2 WAT 5695 66.998 21.309 52.186 1.00 0.00 H TER 72461 WAT 5695 ATOM 72461 O WAT 5696 137.988 139.264 100.063 1.00 0.00 O ATOM 72462 H1 WAT 5696 138.148 140.187 99.868 1.00 0.00 H ATOM 72463 H2 WAT 5696 138.161 138.811 99.237 1.00 0.00 H TER 72465 WAT 5696 ATOM 72465 O WAT 5697 109.030 144.341 129.751 1.00 0.00 O ATOM 72466 H1 WAT 5697 109.890 144.594 130.089 1.00 0.00 H ATOM 72467 H2 WAT 5697 108.520 145.151 129.765 1.00 0.00 H TER 72469 WAT 5697 ATOM 72469 O WAT 5698 53.474 75.631 113.581 1.00 0.00 O ATOM 72470 H1 WAT 5698 53.735 75.534 114.497 1.00 0.00 H ATOM 72471 H2 WAT 5698 53.689 74.789 113.180 1.00 0.00 H TER 72473 WAT 5698 ATOM 72473 O WAT 5699 114.908 141.297 157.259 1.00 0.00 O ATOM 72474 H1 WAT 5699 114.068 141.122 156.835 1.00 0.00 H ATOM 72475 H2 WAT 5699 114.754 142.086 157.779 1.00 0.00 H TER 72477 WAT 5699 ATOM 72477 O WAT 5700 143.814 131.443 117.928 1.00 0.00 O ATOM 72478 H1 WAT 5700 144.113 130.663 117.461 1.00 0.00 H ATOM 72479 H2 WAT 5700 143.013 131.703 117.473 1.00 0.00 H TER 72481 WAT 5700 ATOM 72481 O WAT 5701 87.784 46.299 120.920 1.00 0.00 O ATOM 72482 H1 WAT 5701 87.999 47.143 120.522 1.00 0.00 H ATOM 72483 H2 WAT 5701 88.360 45.673 120.481 1.00 0.00 H TER 72485 WAT 5701 ATOM 72485 O WAT 5702 89.019 132.947 70.285 1.00 0.00 O ATOM 72486 H1 WAT 5702 88.447 132.215 70.052 1.00 0.00 H ATOM 72487 H2 WAT 5702 89.901 132.636 70.080 1.00 0.00 H TER 72489 WAT 5702 ATOM 72489 O WAT 5703 95.716 58.149 97.601 1.00 0.00 O ATOM 72490 H1 WAT 5703 95.068 58.146 98.305 1.00 0.00 H ATOM 72491 H2 WAT 5703 95.887 57.223 97.429 1.00 0.00 H TER 72493 WAT 5703 ATOM 72493 O WAT 5704 110.454 2.221 111.849 1.00 0.00 O ATOM 72494 H1 WAT 5704 111.086 1.505 111.912 1.00 0.00 H ATOM 72495 H2 WAT 5704 110.224 2.419 112.757 1.00 0.00 H TER 72497 WAT 5704 ATOM 72497 O WAT 5705 1.546 126.306 23.013 1.00 0.00 O ATOM 72498 H1 WAT 5705 2.031 126.818 23.660 1.00 0.00 H ATOM 72499 H2 WAT 5705 1.237 125.539 23.496 1.00 0.00 H TER 72501 WAT 5705 ATOM 72501 O WAT 5706 55.864 91.855 105.644 1.00 0.00 O ATOM 72502 H1 WAT 5706 55.792 92.767 105.362 1.00 0.00 H ATOM 72503 H2 WAT 5706 56.413 91.889 106.427 1.00 0.00 H TER 72505 WAT 5706 ATOM 72505 O WAT 5707 119.632 91.823 89.166 1.00 0.00 O ATOM 72506 H1 WAT 5707 120.162 91.755 88.372 1.00 0.00 H ATOM 72507 H2 WAT 5707 120.103 92.451 89.715 1.00 0.00 H TER 72509 WAT 5707 ATOM 72509 O WAT 5708 111.250 35.177 88.848 1.00 0.00 O ATOM 72510 H1 WAT 5708 111.409 34.900 89.751 1.00 0.00 H ATOM 72511 H2 WAT 5708 111.045 36.109 88.916 1.00 0.00 H TER 72513 WAT 5708 ATOM 72513 O WAT 5709 18.029 36.296 100.694 1.00 0.00 O ATOM 72514 H1 WAT 5709 17.668 36.551 101.543 1.00 0.00 H ATOM 72515 H2 WAT 5709 18.976 36.373 100.804 1.00 0.00 H TER 72517 WAT 5709 ATOM 72517 O WAT 5710 57.160 53.582 93.153 1.00 0.00 O ATOM 72518 H1 WAT 5710 57.126 52.981 93.898 1.00 0.00 H ATOM 72519 H2 WAT 5710 56.827 54.410 93.499 1.00 0.00 H TER 72521 WAT 5710 ATOM 72521 O WAT 5711 62.733 110.869 158.741 1.00 0.00 O ATOM 72522 H1 WAT 5711 63.418 110.825 158.074 1.00 0.00 H ATOM 72523 H2 WAT 5711 62.858 110.078 159.266 1.00 0.00 H TER 72525 WAT 5711 ATOM 72525 O WAT 5712 108.800 127.861 64.085 1.00 0.00 O ATOM 72526 H1 WAT 5712 109.076 127.166 64.682 1.00 0.00 H ATOM 72527 H2 WAT 5712 109.302 128.628 64.361 1.00 0.00 H TER 72529 WAT 5712 ATOM 72529 O WAT 5713 26.832 86.730 93.180 1.00 0.00 O ATOM 72530 H1 WAT 5713 26.216 86.941 93.882 1.00 0.00 H ATOM 72531 H2 WAT 5713 27.621 87.227 93.396 1.00 0.00 H TER 72533 WAT 5713 ATOM 72533 O WAT 5714 14.695 98.814 84.555 1.00 0.00 O ATOM 72534 H1 WAT 5714 14.628 99.344 83.760 1.00 0.00 H ATOM 72535 H2 WAT 5714 13.794 98.740 84.870 1.00 0.00 H TER 72537 WAT 5714 ATOM 72537 O WAT 5715 24.971 143.357 139.169 1.00 0.00 O ATOM 72538 H1 WAT 5715 25.122 144.152 139.681 1.00 0.00 H ATOM 72539 H2 WAT 5715 25.223 142.643 139.755 1.00 0.00 H TER 72541 WAT 5715 ATOM 72541 O WAT 5716 118.572 110.159 21.981 1.00 0.00 O ATOM 72542 H1 WAT 5716 119.065 109.964 21.183 1.00 0.00 H ATOM 72543 H2 WAT 5716 118.906 111.010 22.266 1.00 0.00 H TER 72545 WAT 5716 ATOM 72545 O WAT 5717 93.779 133.316 128.308 1.00 0.00 O ATOM 72546 H1 WAT 5717 94.626 133.761 128.285 1.00 0.00 H ATOM 72547 H2 WAT 5717 93.613 133.069 127.398 1.00 0.00 H TER 72549 WAT 5717 ATOM 72549 O WAT 5718 64.670 83.693 83.398 1.00 0.00 O ATOM 72550 H1 WAT 5718 65.305 83.209 82.870 1.00 0.00 H ATOM 72551 H2 WAT 5718 65.202 84.165 84.039 1.00 0.00 H TER 72553 WAT 5718 ATOM 72553 O WAT 5719 64.767 134.117 74.998 1.00 0.00 O ATOM 72554 H1 WAT 5719 65.046 133.354 74.492 1.00 0.00 H ATOM 72555 H2 WAT 5719 65.375 134.810 74.740 1.00 0.00 H TER 72557 WAT 5719 ATOM 72557 O WAT 5720 51.284 51.444 7.714 1.00 0.00 O ATOM 72558 H1 WAT 5720 51.006 51.300 6.809 1.00 0.00 H ATOM 72559 H2 WAT 5720 50.717 52.148 8.029 1.00 0.00 H TER 72561 WAT 5720 ATOM 72561 O WAT 5721 78.837 17.502 109.059 1.00 0.00 O ATOM 72562 H1 WAT 5721 79.336 16.721 108.817 1.00 0.00 H ATOM 72563 H2 WAT 5721 79.452 18.031 109.567 1.00 0.00 H TER 72565 WAT 5721 ATOM 72565 O WAT 5722 74.073 103.413 95.832 1.00 0.00 O ATOM 72566 H1 WAT 5722 73.183 103.075 95.735 1.00 0.00 H ATOM 72567 H2 WAT 5722 74.427 103.417 94.942 1.00 0.00 H TER 72569 WAT 5722 ATOM 72569 O WAT 5723 22.266 87.780 26.061 1.00 0.00 O ATOM 72570 H1 WAT 5723 21.394 87.724 25.670 1.00 0.00 H ATOM 72571 H2 WAT 5723 22.839 87.345 25.430 1.00 0.00 H TER 72573 WAT 5723 ATOM 72573 O WAT 5724 73.018 50.299 20.920 1.00 0.00 O ATOM 72574 H1 WAT 5724 72.890 49.669 21.628 1.00 0.00 H ATOM 72575 H2 WAT 5724 72.624 49.883 20.154 1.00 0.00 H TER 72577 WAT 5724 ATOM 72577 O WAT 5725 19.502 135.067 79.599 1.00 0.00 O ATOM 72578 H1 WAT 5725 20.219 134.453 79.754 1.00 0.00 H ATOM 72579 H2 WAT 5725 19.520 135.223 78.655 1.00 0.00 H TER 72581 WAT 5725 ATOM 72581 O WAT 5726 97.931 144.459 139.441 1.00 0.00 O ATOM 72582 H1 WAT 5726 97.637 145.287 139.821 1.00 0.00 H ATOM 72583 H2 WAT 5726 97.123 143.982 139.251 1.00 0.00 H TER 72585 WAT 5726 ATOM 72585 O WAT 5727 85.467 123.981 86.080 1.00 0.00 O ATOM 72586 H1 WAT 5727 85.348 124.538 86.849 1.00 0.00 H ATOM 72587 H2 WAT 5727 84.612 123.981 85.650 1.00 0.00 H TER 72589 WAT 5727 ATOM 72589 O WAT 5728 35.152 120.694 143.629 1.00 0.00 O ATOM 72590 H1 WAT 5728 35.027 121.189 144.439 1.00 0.00 H ATOM 72591 H2 WAT 5728 34.368 120.879 143.112 1.00 0.00 H TER 72593 WAT 5728 ATOM 72593 O WAT 5729 28.379 136.498 121.024 1.00 0.00 O ATOM 72594 H1 WAT 5729 28.813 135.662 121.194 1.00 0.00 H ATOM 72595 H2 WAT 5729 27.474 136.260 120.820 1.00 0.00 H TER 72597 WAT 5729 ATOM 72597 O WAT 5730 1.220 37.197 100.471 1.00 0.00 O ATOM 72598 H1 WAT 5730 1.535 36.981 101.349 1.00 0.00 H ATOM 72599 H2 WAT 5730 0.268 37.244 100.564 1.00 0.00 H TER 72601 WAT 5730 ATOM 72601 O WAT 5731 105.578 50.856 126.479 1.00 0.00 O ATOM 72602 H1 WAT 5731 105.275 50.415 125.685 1.00 0.00 H ATOM 72603 H2 WAT 5731 104.850 50.768 127.094 1.00 0.00 H TER 72605 WAT 5731 ATOM 72605 O WAT 5732 119.273 103.192 67.219 1.00 0.00 O ATOM 72606 H1 WAT 5732 119.118 102.480 67.839 1.00 0.00 H ATOM 72607 H2 WAT 5732 119.989 103.695 67.607 1.00 0.00 H TER 72609 WAT 5732 ATOM 72609 O WAT 5733 1.264 53.416 81.450 1.00 0.00 O ATOM 72610 H1 WAT 5733 0.387 53.466 81.833 1.00 0.00 H ATOM 72611 H2 WAT 5733 1.850 53.344 82.204 1.00 0.00 H TER 72613 WAT 5733 ATOM 72613 O WAT 5734 95.067 116.584 116.035 1.00 0.00 O ATOM 72614 H1 WAT 5734 95.358 116.148 115.234 1.00 0.00 H ATOM 72615 H2 WAT 5734 95.054 115.891 116.695 1.00 0.00 H TER 72617 WAT 5734 ATOM 72617 O WAT 5735 88.888 91.709 131.031 1.00 0.00 O ATOM 72618 H1 WAT 5735 89.079 92.020 131.915 1.00 0.00 H ATOM 72619 H2 WAT 5735 89.283 92.365 130.456 1.00 0.00 H TER 72621 WAT 5735 ATOM 72621 O WAT 5736 129.071 115.651 115.862 1.00 0.00 O ATOM 72622 H1 WAT 5736 129.134 114.858 116.393 1.00 0.00 H ATOM 72623 H2 WAT 5736 129.171 115.345 114.960 1.00 0.00 H TER 72625 WAT 5736 ATOM 72625 O WAT 5737 46.291 122.791 96.008 1.00 0.00 O ATOM 72626 H1 WAT 5737 46.727 122.615 96.841 1.00 0.00 H ATOM 72627 H2 WAT 5737 45.397 122.473 96.133 1.00 0.00 H TER 72629 WAT 5737 ATOM 72629 O WAT 5738 96.020 31.883 75.542 1.00 0.00 O ATOM 72630 H1 WAT 5738 95.157 32.048 75.923 1.00 0.00 H ATOM 72631 H2 WAT 5738 96.527 31.497 76.257 1.00 0.00 H TER 72633 WAT 5738 ATOM 72633 O WAT 5739 0.361 8.348 79.803 1.00 0.00 O ATOM 72634 H1 WAT 5739 -0.282 9.055 79.852 1.00 0.00 H ATOM 72635 H2 WAT 5739 1.170 8.736 80.135 1.00 0.00 H TER 72637 WAT 5739 ATOM 72637 O WAT 5740 60.326 18.251 82.318 1.00 0.00 O ATOM 72638 H1 WAT 5740 60.357 18.477 83.248 1.00 0.00 H ATOM 72639 H2 WAT 5740 60.943 17.524 82.228 1.00 0.00 H TER 72641 WAT 5740 ATOM 72641 O WAT 5741 134.031 11.266 152.213 1.00 0.00 O ATOM 72642 H1 WAT 5741 133.128 11.050 151.981 1.00 0.00 H ATOM 72643 H2 WAT 5741 134.557 10.897 151.504 1.00 0.00 H TER 72645 WAT 5741 ATOM 72645 O WAT 5742 121.570 136.342 125.601 1.00 0.00 O ATOM 72646 H1 WAT 5742 121.524 137.224 125.232 1.00 0.00 H ATOM 72647 H2 WAT 5742 122.219 135.891 125.061 1.00 0.00 H TER 72649 WAT 5742 ATOM 72649 O WAT 5743 88.420 52.822 12.530 1.00 0.00 O ATOM 72650 H1 WAT 5743 88.610 52.050 13.062 1.00 0.00 H ATOM 72651 H2 WAT 5743 87.819 53.340 13.067 1.00 0.00 H TER 72653 WAT 5743 ATOM 72653 O WAT 5744 137.912 95.277 71.845 1.00 0.00 O ATOM 72654 H1 WAT 5744 137.632 94.546 71.294 1.00 0.00 H ATOM 72655 H2 WAT 5744 137.477 96.041 71.468 1.00 0.00 H TER 72657 WAT 5744 ATOM 72657 O WAT 5745 141.374 34.566 104.358 1.00 0.00 O ATOM 72658 H1 WAT 5745 141.625 34.677 103.441 1.00 0.00 H ATOM 72659 H2 WAT 5745 141.053 35.428 104.625 1.00 0.00 H TER 72661 WAT 5745 ATOM 72661 O WAT 5746 138.117 80.555 117.321 1.00 0.00 O ATOM 72662 H1 WAT 5746 138.490 80.750 118.181 1.00 0.00 H ATOM 72663 H2 WAT 5746 137.196 80.363 117.499 1.00 0.00 H TER 72665 WAT 5746 ATOM 72665 O WAT 5747 122.325 35.821 140.132 1.00 0.00 O ATOM 72666 H1 WAT 5747 122.629 36.586 140.619 1.00 0.00 H ATOM 72667 H2 WAT 5747 121.370 35.889 140.151 1.00 0.00 H TER 72669 WAT 5747 ATOM 72669 O WAT 5748 22.433 110.010 62.941 1.00 0.00 O ATOM 72670 H1 WAT 5748 21.864 110.160 63.696 1.00 0.00 H ATOM 72671 H2 WAT 5748 21.876 109.555 62.308 1.00 0.00 H TER 72673 WAT 5748 ATOM 72673 O WAT 5749 135.392 37.115 135.207 1.00 0.00 O ATOM 72674 H1 WAT 5749 135.573 38.053 135.261 1.00 0.00 H ATOM 72675 H2 WAT 5749 134.437 37.054 135.234 1.00 0.00 H TER 72677 WAT 5749 ATOM 72677 O WAT 5750 6.095 95.846 97.674 1.00 0.00 O ATOM 72678 H1 WAT 5750 6.435 95.309 98.390 1.00 0.00 H ATOM 72679 H2 WAT 5750 5.146 95.846 97.805 1.00 0.00 H TER 72681 WAT 5750 ATOM 72681 O WAT 5751 7.900 86.961 153.740 1.00 0.00 O ATOM 72682 H1 WAT 5751 6.987 87.246 153.714 1.00 0.00 H ATOM 72683 H2 WAT 5751 8.391 87.751 153.967 1.00 0.00 H TER 72685 WAT 5751 ATOM 72685 O WAT 5752 143.771 144.000 14.215 1.00 0.00 O ATOM 72686 H1 WAT 5752 143.818 143.128 14.607 1.00 0.00 H ATOM 72687 H2 WAT 5752 144.495 144.020 13.589 1.00 0.00 H TER 72689 WAT 5752 ATOM 72689 O WAT 5753 100.694 142.513 143.151 1.00 0.00 O ATOM 72690 H1 WAT 5753 99.978 142.689 143.761 1.00 0.00 H ATOM 72691 H2 WAT 5753 100.262 142.383 142.306 1.00 0.00 H TER 72693 WAT 5753 ATOM 72693 O WAT 5754 20.790 36.338 101.489 1.00 0.00 O ATOM 72694 H1 WAT 5754 21.389 37.026 101.781 1.00 0.00 H ATOM 72695 H2 WAT 5754 20.476 35.935 102.298 1.00 0.00 H TER 72697 WAT 5754 ATOM 72697 O WAT 5755 127.062 57.638 61.407 1.00 0.00 O ATOM 72698 H1 WAT 5755 127.450 58.470 61.679 1.00 0.00 H ATOM 72699 H2 WAT 5755 126.822 57.775 60.490 1.00 0.00 H TER 72701 WAT 5755 ATOM 72701 O WAT 5756 33.085 45.812 143.612 1.00 0.00 O ATOM 72702 H1 WAT 5756 32.328 46.317 143.317 1.00 0.00 H ATOM 72703 H2 WAT 5756 33.579 45.631 142.812 1.00 0.00 H TER 72705 WAT 5756 ATOM 72705 O WAT 5757 79.904 143.128 90.009 1.00 0.00 O ATOM 72706 H1 WAT 5757 80.582 143.663 90.420 1.00 0.00 H ATOM 72707 H2 WAT 5757 80.257 142.238 90.025 1.00 0.00 H TER 72709 WAT 5757 ATOM 72709 O WAT 5758 28.609 28.272 58.963 1.00 0.00 O ATOM 72710 H1 WAT 5758 28.048 28.941 58.571 1.00 0.00 H ATOM 72711 H2 WAT 5758 28.498 28.390 59.907 1.00 0.00 H TER 72713 WAT 5758 ATOM 72713 O WAT 5759 96.810 80.481 119.972 1.00 0.00 O ATOM 72714 H1 WAT 5759 97.469 79.797 120.092 1.00 0.00 H ATOM 72715 H2 WAT 5759 96.713 80.874 120.839 1.00 0.00 H TER 72717 WAT 5759 ATOM 72717 O WAT 5760 133.810 132.709 68.972 1.00 0.00 O ATOM 72718 H1 WAT 5760 133.308 131.894 69.007 1.00 0.00 H ATOM 72719 H2 WAT 5760 134.120 132.761 68.068 1.00 0.00 H TER 72721 WAT 5760 ATOM 72721 O WAT 5761 61.305 126.530 133.992 1.00 0.00 O ATOM 72722 H1 WAT 5761 61.872 127.171 133.564 1.00 0.00 H ATOM 72723 H2 WAT 5761 61.783 126.277 134.782 1.00 0.00 H TER 72725 WAT 5761 ATOM 72725 O WAT 5762 137.424 55.969 7.423 1.00 0.00 O ATOM 72726 H1 WAT 5762 137.490 55.678 8.332 1.00 0.00 H ATOM 72727 H2 WAT 5762 137.451 55.161 6.910 1.00 0.00 H TER 72729 WAT 5762 ATOM 72729 O WAT 5763 33.634 79.954 126.008 1.00 0.00 O ATOM 72730 H1 WAT 5763 33.612 79.766 126.946 1.00 0.00 H ATOM 72731 H2 WAT 5763 32.920 79.432 125.642 1.00 0.00 H TER 72733 WAT 5763 ATOM 72733 O WAT 5764 77.748 146.049 110.245 1.00 0.00 O ATOM 72734 H1 WAT 5764 77.857 145.357 110.897 1.00 0.00 H ATOM 72735 H2 WAT 5764 77.186 145.660 109.575 1.00 0.00 H TER 72737 WAT 5764 ATOM 72737 O WAT 5765 114.375 57.074 109.234 1.00 0.00 O ATOM 72738 H1 WAT 5765 115.187 56.795 109.658 1.00 0.00 H ATOM 72739 H2 WAT 5765 114.353 56.583 108.413 1.00 0.00 H TER 72741 WAT 5765 ATOM 72741 O WAT 5766 115.932 126.457 133.697 1.00 0.00 O ATOM 72742 H1 WAT 5766 116.847 126.175 133.693 1.00 0.00 H ATOM 72743 H2 WAT 5766 115.887 127.134 133.021 1.00 0.00 H TER 72745 WAT 5766 ATOM 72745 O WAT 5767 123.168 137.787 64.112 1.00 0.00 O ATOM 72746 H1 WAT 5767 122.611 137.017 64.219 1.00 0.00 H ATOM 72747 H2 WAT 5767 123.787 137.542 63.425 1.00 0.00 H TER 72749 WAT 5767 ATOM 72749 O WAT 5768 31.121 75.984 5.676 1.00 0.00 O ATOM 72750 H1 WAT 5768 30.704 76.011 4.815 1.00 0.00 H ATOM 72751 H2 WAT 5768 30.398 75.848 6.288 1.00 0.00 H TER 72753 WAT 5768 ATOM 72753 O WAT 5769 28.058 95.915 134.035 1.00 0.00 O ATOM 72754 H1 WAT 5769 27.556 95.533 134.755 1.00 0.00 H ATOM 72755 H2 WAT 5769 27.826 95.385 133.273 1.00 0.00 H TER 72757 WAT 5769 ATOM 72757 O WAT 5770 124.924 52.488 72.690 1.00 0.00 O ATOM 72758 H1 WAT 5770 125.544 52.512 73.418 1.00 0.00 H ATOM 72759 H2 WAT 5770 124.074 52.670 73.092 1.00 0.00 H TER 72761 WAT 5770 ATOM 72761 O WAT 5771 139.774 118.258 103.531 1.00 0.00 O ATOM 72762 H1 WAT 5771 138.938 118.093 103.096 1.00 0.00 H ATOM 72763 H2 WAT 5771 140.250 118.828 102.927 1.00 0.00 H TER 72765 WAT 5771 ATOM 72765 O WAT 5772 69.244 34.108 154.185 1.00 0.00 O ATOM 72766 H1 WAT 5772 69.594 33.635 154.940 1.00 0.00 H ATOM 72767 H2 WAT 5772 68.760 33.446 153.691 1.00 0.00 H TER 72769 WAT 5772 ATOM 72769 O WAT 5773 59.481 67.366 115.133 1.00 0.00 O ATOM 72770 H1 WAT 5773 60.291 67.551 114.658 1.00 0.00 H ATOM 72771 H2 WAT 5773 59.659 66.552 115.603 1.00 0.00 H TER 72773 WAT 5773 ATOM 72773 O WAT 5774 9.440 124.786 117.752 1.00 0.00 O ATOM 72774 H1 WAT 5774 9.804 125.585 118.133 1.00 0.00 H ATOM 72775 H2 WAT 5774 8.928 125.089 117.003 1.00 0.00 H TER 72777 WAT 5774 ATOM 72777 O WAT 5775 117.427 93.083 88.399 1.00 0.00 O ATOM 72778 H1 WAT 5775 118.261 92.695 88.663 1.00 0.00 H ATOM 72779 H2 WAT 5775 117.472 93.986 88.714 1.00 0.00 H TER 72781 WAT 5775 ATOM 72781 O WAT 5776 122.791 48.091 112.475 1.00 0.00 O ATOM 72782 H1 WAT 5776 122.210 47.763 113.161 1.00 0.00 H ATOM 72783 H2 WAT 5776 122.347 48.867 112.134 1.00 0.00 H TER 72785 WAT 5776 ATOM 72785 O WAT 5777 82.157 113.595 69.017 1.00 0.00 O ATOM 72786 H1 WAT 5777 82.511 113.254 68.196 1.00 0.00 H ATOM 72787 H2 WAT 5777 82.756 114.300 69.263 1.00 0.00 H TER 72789 WAT 5777 ATOM 72789 O WAT 5778 31.252 135.935 105.437 1.00 0.00 O ATOM 72790 H1 WAT 5778 30.378 136.325 105.462 1.00 0.00 H ATOM 72791 H2 WAT 5778 31.742 136.485 104.825 1.00 0.00 H TER 72793 WAT 5778 ATOM 72793 O WAT 5779 95.659 58.593 105.868 1.00 0.00 O ATOM 72794 H1 WAT 5779 96.084 59.042 106.598 1.00 0.00 H ATOM 72795 H2 WAT 5779 96.382 58.257 105.339 1.00 0.00 H TER 72797 WAT 5779 ATOM 72797 O WAT 5780 140.312 74.618 139.543 1.00 0.00 O ATOM 72798 H1 WAT 5780 140.253 75.523 139.236 1.00 0.00 H ATOM 72799 H2 WAT 5780 140.883 74.662 140.310 1.00 0.00 H TER 72801 WAT 5780 ATOM 72801 O WAT 5781 13.408 75.556 156.717 1.00 0.00 O ATOM 72802 H1 WAT 5781 13.869 76.222 157.226 1.00 0.00 H ATOM 72803 H2 WAT 5781 13.377 75.912 155.829 1.00 0.00 H TER 72805 WAT 5781 ATOM 72805 O WAT 5782 10.021 17.646 144.488 1.00 0.00 O ATOM 72806 H1 WAT 5782 9.992 16.783 144.075 1.00 0.00 H ATOM 72807 H2 WAT 5782 10.807 17.624 145.034 1.00 0.00 H TER 72809 WAT 5782 ATOM 72809 O WAT 5783 90.670 17.527 74.131 1.00 0.00 O ATOM 72810 H1 WAT 5783 90.165 18.340 74.136 1.00 0.00 H ATOM 72811 H2 WAT 5783 91.499 17.758 74.551 1.00 0.00 H TER 72813 WAT 5783 ATOM 72813 O WAT 5784 1.798 42.105 64.354 1.00 0.00 O ATOM 72814 H1 WAT 5784 2.664 42.278 64.724 1.00 0.00 H ATOM 72815 H2 WAT 5784 1.868 42.382 63.440 1.00 0.00 H TER 72817 WAT 5784 ATOM 72817 O WAT 5785 131.876 56.992 73.640 1.00 0.00 O ATOM 72818 H1 WAT 5785 132.406 57.078 72.847 1.00 0.00 H ATOM 72819 H2 WAT 5785 132.371 57.462 74.311 1.00 0.00 H TER 72821 WAT 5785 ATOM 72821 O WAT 5786 10.519 7.401 112.231 1.00 0.00 O ATOM 72822 H1 WAT 5786 10.281 7.392 113.158 1.00 0.00 H ATOM 72823 H2 WAT 5786 11.406 7.040 112.208 1.00 0.00 H TER 72825 WAT 5786 ATOM 72825 O WAT 5787 36.096 43.853 54.628 1.00 0.00 O ATOM 72826 H1 WAT 5787 36.339 43.492 55.480 1.00 0.00 H ATOM 72827 H2 WAT 5787 35.542 44.605 54.835 1.00 0.00 H TER 72829 WAT 5787 ATOM 72829 O WAT 5788 3.371 59.643 82.335 1.00 0.00 O ATOM 72830 H1 WAT 5788 4.259 59.338 82.519 1.00 0.00 H ATOM 72831 H2 WAT 5788 3.483 60.320 81.668 1.00 0.00 H TER 72833 WAT 5788 ATOM 72833 O WAT 5789 122.207 122.506 3.761 1.00 0.00 O ATOM 72834 H1 WAT 5789 123.017 122.313 3.289 1.00 0.00 H ATOM 72835 H2 WAT 5789 121.872 123.301 3.346 1.00 0.00 H TER 72837 WAT 5789 ATOM 72837 O WAT 5790 73.603 117.823 79.646 1.00 0.00 O ATOM 72838 H1 WAT 5790 74.167 118.366 80.195 1.00 0.00 H ATOM 72839 H2 WAT 5790 72.741 117.879 80.058 1.00 0.00 H TER 72841 WAT 5790 ATOM 72841 O WAT 5791 120.714 125.020 62.704 1.00 0.00 O ATOM 72842 H1 WAT 5791 121.369 124.344 62.878 1.00 0.00 H ATOM 72843 H2 WAT 5791 120.763 125.603 63.461 1.00 0.00 H TER 72845 WAT 5791 ATOM 72845 O WAT 5792 15.366 117.924 8.998 1.00 0.00 O ATOM 72846 H1 WAT 5792 14.675 118.527 8.727 1.00 0.00 H ATOM 72847 H2 WAT 5792 15.454 118.068 9.940 1.00 0.00 H TER 72849 WAT 5792 ATOM 72849 O WAT 5793 96.599 52.719 109.834 1.00 0.00 O ATOM 72850 H1 WAT 5793 96.409 53.094 110.694 1.00 0.00 H ATOM 72851 H2 WAT 5793 95.756 52.719 109.381 1.00 0.00 H TER 72853 WAT 5793 ATOM 72853 O WAT 5794 55.540 8.098 137.056 1.00 0.00 O ATOM 72854 H1 WAT 5794 55.195 8.725 136.421 1.00 0.00 H ATOM 72855 H2 WAT 5794 54.792 7.886 137.615 1.00 0.00 H TER 72857 WAT 5794 ATOM 72857 O WAT 5795 84.738 33.963 9.139 1.00 0.00 O ATOM 72858 H1 WAT 5795 85.246 33.537 8.449 1.00 0.00 H ATOM 72859 H2 WAT 5795 84.838 33.390 9.899 1.00 0.00 H TER 72861 WAT 5795 ATOM 72861 O WAT 5796 110.134 61.063 68.291 1.00 0.00 O ATOM 72862 H1 WAT 5796 110.586 60.380 68.785 1.00 0.00 H ATOM 72863 H2 WAT 5796 109.494 60.591 67.759 1.00 0.00 H TER 72865 WAT 5796 ATOM 72865 O WAT 5797 26.328 14.604 92.490 1.00 0.00 O ATOM 72866 H1 WAT 5797 26.737 13.916 91.965 1.00 0.00 H ATOM 72867 H2 WAT 5797 26.207 15.331 91.880 1.00 0.00 H TER 72869 WAT 5797 ATOM 72869 O WAT 5798 81.994 141.603 67.181 1.00 0.00 O ATOM 72870 H1 WAT 5798 81.458 140.824 67.329 1.00 0.00 H ATOM 72871 H2 WAT 5798 82.519 141.389 66.409 1.00 0.00 H TER 72873 WAT 5798 ATOM 72873 O WAT 5799 145.252 16.508 89.869 1.00 0.00 O ATOM 72874 H1 WAT 5799 144.996 15.952 89.134 1.00 0.00 H ATOM 72875 H2 WAT 5799 146.201 16.597 89.784 1.00 0.00 H TER 72877 WAT 5799 ATOM 72877 O WAT 5800 27.445 121.769 73.885 1.00 0.00 O ATOM 72878 H1 WAT 5800 28.178 121.592 73.295 1.00 0.00 H ATOM 72879 H2 WAT 5800 27.703 122.561 74.356 1.00 0.00 H TER 72881 WAT 5800 ATOM 72881 O WAT 5801 40.788 25.034 65.688 1.00 0.00 O ATOM 72882 H1 WAT 5801 40.623 25.894 65.301 1.00 0.00 H ATOM 72883 H2 WAT 5801 40.342 24.420 65.105 1.00 0.00 H TER 72885 WAT 5801 ATOM 72885 O WAT 5802 126.994 11.468 119.673 1.00 0.00 O ATOM 72886 H1 WAT 5802 127.002 11.995 120.472 1.00 0.00 H ATOM 72887 H2 WAT 5802 126.737 10.594 119.965 1.00 0.00 H TER 72889 WAT 5802 ATOM 72889 O WAT 5803 29.285 14.964 59.461 1.00 0.00 O ATOM 72890 H1 WAT 5803 29.993 15.394 58.981 1.00 0.00 H ATOM 72891 H2 WAT 5803 29.159 15.507 60.239 1.00 0.00 H TER 72893 WAT 5803 ATOM 72893 O WAT 5804 56.825 82.958 27.476 1.00 0.00 O ATOM 72894 H1 WAT 5804 56.391 83.522 26.836 1.00 0.00 H ATOM 72895 H2 WAT 5804 57.507 82.509 26.977 1.00 0.00 H TER 72897 WAT 5804 ATOM 72897 O WAT 5805 13.589 88.868 62.780 1.00 0.00 O ATOM 72898 H1 WAT 5805 13.593 87.983 63.145 1.00 0.00 H ATOM 72899 H2 WAT 5805 12.980 88.821 62.044 1.00 0.00 H TER 72901 WAT 5805 ATOM 72901 O WAT 5806 140.725 97.912 81.430 1.00 0.00 O ATOM 72902 H1 WAT 5806 140.275 98.629 80.984 1.00 0.00 H ATOM 72903 H2 WAT 5806 140.190 97.140 81.244 1.00 0.00 H TER 72905 WAT 5806 ATOM 72905 O WAT 5807 31.900 50.081 125.293 1.00 0.00 O ATOM 72906 H1 WAT 5807 31.820 49.194 125.644 1.00 0.00 H ATOM 72907 H2 WAT 5807 32.509 50.519 125.888 1.00 0.00 H TER 72909 WAT 5807 ATOM 72909 O WAT 5808 88.541 57.577 118.675 1.00 0.00 O ATOM 72910 H1 WAT 5808 89.468 57.791 118.571 1.00 0.00 H ATOM 72911 H2 WAT 5808 88.243 57.363 117.791 1.00 0.00 H TER 72913 WAT 5808 ATOM 72913 O WAT 5809 84.668 122.169 145.926 1.00 0.00 O ATOM 72914 H1 WAT 5809 85.013 122.077 145.038 1.00 0.00 H ATOM 72915 H2 WAT 5809 85.281 122.762 146.361 1.00 0.00 H TER 72917 WAT 5809 ATOM 72917 O WAT 5810 43.533 34.150 146.224 1.00 0.00 O ATOM 72918 H1 WAT 5810 42.763 34.020 145.670 1.00 0.00 H ATOM 72919 H2 WAT 5810 43.443 35.044 146.552 1.00 0.00 H TER 72921 WAT 5810 ATOM 72921 O WAT 5811 74.626 142.235 105.861 1.00 0.00 O ATOM 72922 H1 WAT 5811 74.644 143.007 105.295 1.00 0.00 H ATOM 72923 H2 WAT 5811 73.699 142.108 106.063 1.00 0.00 H TER 72925 WAT 5811 ATOM 72925 O WAT 5812 107.020 92.359 100.627 1.00 0.00 O ATOM 72926 H1 WAT 5812 106.079 92.261 100.775 1.00 0.00 H ATOM 72927 H2 WAT 5812 107.196 93.282 100.810 1.00 0.00 H TER 72929 WAT 5812 ATOM 72929 O WAT 5813 100.987 22.638 68.782 1.00 0.00 O ATOM 72930 H1 WAT 5813 101.101 22.007 68.072 1.00 0.00 H ATOM 72931 H2 WAT 5813 101.689 23.276 68.651 1.00 0.00 H TER 72933 WAT 5813 ATOM 72933 O WAT 5814 97.827 31.774 142.349 1.00 0.00 O ATOM 72934 H1 WAT 5814 97.650 32.657 142.022 1.00 0.00 H ATOM 72935 H2 WAT 5814 97.079 31.255 142.054 1.00 0.00 H TER 72937 WAT 5814 ATOM 72937 O WAT 5815 38.499 31.747 100.659 1.00 0.00 O ATOM 72938 H1 WAT 5815 38.320 30.930 100.192 1.00 0.00 H ATOM 72939 H2 WAT 5815 38.277 32.435 100.032 1.00 0.00 H TER 72941 WAT 5815 ATOM 72941 O WAT 5816 111.183 37.987 16.525 1.00 0.00 O ATOM 72942 H1 WAT 5816 111.179 38.676 15.860 1.00 0.00 H ATOM 72943 H2 WAT 5816 110.294 37.633 16.508 1.00 0.00 H TER 72945 WAT 5816 ATOM 72945 O WAT 5817 17.251 136.917 136.262 1.00 0.00 O ATOM 72946 H1 WAT 5817 17.039 137.796 135.947 1.00 0.00 H ATOM 72947 H2 WAT 5817 17.887 136.583 135.630 1.00 0.00 H TER 72949 WAT 5817 ATOM 72949 O WAT 5818 130.834 44.471 138.387 1.00 0.00 O ATOM 72950 H1 WAT 5818 130.241 43.795 138.060 1.00 0.00 H ATOM 72951 H2 WAT 5818 131.121 44.938 137.602 1.00 0.00 H TER 72953 WAT 5818 ATOM 72953 O WAT 5819 19.899 36.071 141.993 1.00 0.00 O ATOM 72954 H1 WAT 5819 19.721 35.370 142.621 1.00 0.00 H ATOM 72955 H2 WAT 5819 19.485 36.845 142.376 1.00 0.00 H TER 72957 WAT 5819 ATOM 72957 O WAT 5820 61.714 56.515 123.884 1.00 0.00 O ATOM 72958 H1 WAT 5820 62.303 56.249 123.178 1.00 0.00 H ATOM 72959 H2 WAT 5820 61.183 55.738 124.058 1.00 0.00 H TER 72961 WAT 5820 ATOM 72961 O WAT 5821 112.563 48.927 5.554 1.00 0.00 O ATOM 72962 H1 WAT 5821 112.927 48.797 4.678 1.00 0.00 H ATOM 72963 H2 WAT 5821 113.178 49.523 5.983 1.00 0.00 H TER 72965 WAT 5821 ATOM 72965 O WAT 5822 47.401 141.311 148.045 1.00 0.00 O ATOM 72966 H1 WAT 5822 47.613 141.712 147.202 1.00 0.00 H ATOM 72967 H2 WAT 5822 48.159 140.762 148.246 1.00 0.00 H TER 72969 WAT 5822 ATOM 72969 O WAT 5823 94.850 119.012 63.581 1.00 0.00 O ATOM 72970 H1 WAT 5823 95.254 118.184 63.840 1.00 0.00 H ATOM 72971 H2 WAT 5823 94.346 119.283 64.348 1.00 0.00 H TER 72973 WAT 5823 ATOM 72973 O WAT 5824 78.075 50.548 101.026 1.00 0.00 O ATOM 72974 H1 WAT 5824 77.956 51.442 101.347 1.00 0.00 H ATOM 72975 H2 WAT 5824 77.583 50.521 100.206 1.00 0.00 H TER 72977 WAT 5824 ATOM 72977 O WAT 5825 52.577 104.586 130.874 1.00 0.00 O ATOM 72978 H1 WAT 5825 52.146 104.823 130.053 1.00 0.00 H ATOM 72979 H2 WAT 5825 53.195 105.299 131.034 1.00 0.00 H TER 72981 WAT 5825 ATOM 72981 O WAT 5826 80.436 66.165 142.410 1.00 0.00 O ATOM 72982 H1 WAT 5826 80.269 66.293 143.343 1.00 0.00 H ATOM 72983 H2 WAT 5826 81.036 65.419 142.374 1.00 0.00 H TER 72985 WAT 5826 ATOM 72985 O WAT 5827 52.562 87.168 68.573 1.00 0.00 O ATOM 72986 H1 WAT 5827 53.506 87.033 68.489 1.00 0.00 H ATOM 72987 H2 WAT 5827 52.402 88.011 68.148 1.00 0.00 H TER 72989 WAT 5827 ATOM 72989 O WAT 5828 74.782 112.344 8.733 1.00 0.00 O ATOM 72990 H1 WAT 5828 75.450 112.979 8.475 1.00 0.00 H ATOM 72991 H2 WAT 5828 74.395 112.712 9.527 1.00 0.00 H TER 72993 WAT 5828 ATOM 72993 O WAT 5829 20.493 67.182 122.545 1.00 0.00 O ATOM 72994 H1 WAT 5829 20.999 67.861 122.991 1.00 0.00 H ATOM 72995 H2 WAT 5829 20.743 67.264 121.624 1.00 0.00 H TER 72997 WAT 5829 ATOM 72997 O WAT 5830 34.540 130.551 151.611 1.00 0.00 O ATOM 72998 H1 WAT 5830 34.117 131.036 152.320 1.00 0.00 H ATOM 72999 H2 WAT 5830 35.404 130.326 151.957 1.00 0.00 H TER 73001 WAT 5830 ATOM 73001 O WAT 5831 82.596 106.799 99.974 1.00 0.00 O ATOM 73002 H1 WAT 5831 82.706 107.745 99.880 1.00 0.00 H ATOM 73003 H2 WAT 5831 82.830 106.619 100.885 1.00 0.00 H TER 73005 WAT 5831 ATOM 73005 O WAT 5832 122.298 44.675 91.434 1.00 0.00 O ATOM 73006 H1 WAT 5832 122.373 43.952 90.812 1.00 0.00 H ATOM 73007 H2 WAT 5832 123.203 44.888 91.663 1.00 0.00 H TER 73009 WAT 5832 ATOM 73009 O WAT 5833 137.635 4.622 157.980 1.00 0.00 O ATOM 73010 H1 WAT 5833 136.862 4.123 158.242 1.00 0.00 H ATOM 73011 H2 WAT 5833 137.792 5.222 158.709 1.00 0.00 H TER 73013 WAT 5833 ATOM 73013 O WAT 5834 14.260 128.283 67.948 1.00 0.00 O ATOM 73014 H1 WAT 5834 13.663 127.655 68.355 1.00 0.00 H ATOM 73015 H2 WAT 5834 13.967 129.135 68.269 1.00 0.00 H TER 73017 WAT 5834 ATOM 73017 O WAT 5835 44.859 52.810 110.964 1.00 0.00 O ATOM 73018 H1 WAT 5835 44.790 53.764 110.990 1.00 0.00 H ATOM 73019 H2 WAT 5835 45.761 52.628 111.229 1.00 0.00 H TER 73021 WAT 5835 ATOM 73021 O WAT 5836 99.655 103.272 77.321 1.00 0.00 O ATOM 73022 H1 WAT 5836 100.270 103.275 78.054 1.00 0.00 H ATOM 73023 H2 WAT 5836 98.791 103.262 77.733 1.00 0.00 H TER 73025 WAT 5836 ATOM 73025 O WAT 5837 56.981 81.022 136.222 1.00 0.00 O ATOM 73026 H1 WAT 5837 57.461 81.105 137.047 1.00 0.00 H ATOM 73027 H2 WAT 5837 56.282 81.673 136.286 1.00 0.00 H TER 73029 WAT 5837 ATOM 73029 O WAT 5838 115.463 42.140 69.974 1.00 0.00 O ATOM 73030 H1 WAT 5838 115.915 41.327 69.750 1.00 0.00 H ATOM 73031 H2 WAT 5838 114.546 41.973 69.753 1.00 0.00 H TER 73033 WAT 5838 ATOM 73033 O WAT 5839 27.277 17.478 83.705 1.00 0.00 O ATOM 73034 H1 WAT 5839 26.509 18.034 83.838 1.00 0.00 H ATOM 73035 H2 WAT 5839 26.941 16.584 83.779 1.00 0.00 H TER 73037 WAT 5839 ATOM 73037 O WAT 5840 29.619 135.577 148.870 1.00 0.00 O ATOM 73038 H1 WAT 5840 28.904 135.985 148.382 1.00 0.00 H ATOM 73039 H2 WAT 5840 29.392 135.716 149.790 1.00 0.00 H TER 73041 WAT 5840 ATOM 73041 O WAT 5841 51.583 61.934 92.954 1.00 0.00 O ATOM 73042 H1 WAT 5841 51.344 62.624 92.335 1.00 0.00 H ATOM 73043 H2 WAT 5841 52.380 62.256 93.376 1.00 0.00 H TER 73045 WAT 5841 ATOM 73045 O WAT 5842 102.768 113.752 132.960 1.00 0.00 O ATOM 73046 H1 WAT 5842 102.511 114.423 133.592 1.00 0.00 H ATOM 73047 H2 WAT 5842 101.997 113.638 132.405 1.00 0.00 H TER 73049 WAT 5842 ATOM 73049 O WAT 5843 19.029 1.422 99.078 1.00 0.00 O ATOM 73050 H1 WAT 5843 19.697 0.970 98.563 1.00 0.00 H ATOM 73051 H2 WAT 5843 18.999 2.305 98.708 1.00 0.00 H TER 73053 WAT 5843 ATOM 73053 O WAT 5844 12.161 37.403 103.032 1.00 0.00 O ATOM 73054 H1 WAT 5844 11.474 38.060 103.146 1.00 0.00 H ATOM 73055 H2 WAT 5844 11.751 36.717 102.505 1.00 0.00 H TER 73057 WAT 5844 ATOM 73057 O WAT 5845 129.707 14.391 143.949 1.00 0.00 O ATOM 73058 H1 WAT 5845 129.161 15.153 143.754 1.00 0.00 H ATOM 73059 H2 WAT 5845 130.597 14.740 143.998 1.00 0.00 H TER 73061 WAT 5845 ATOM 73061 O WAT 5846 43.562 70.434 139.875 1.00 0.00 O ATOM 73062 H1 WAT 5846 44.024 70.448 139.037 1.00 0.00 H ATOM 73063 H2 WAT 5846 42.878 71.098 139.783 1.00 0.00 H TER 73065 WAT 5846 ATOM 73065 O WAT 5847 38.898 37.271 2.564 1.00 0.00 O ATOM 73066 H1 WAT 5847 39.437 38.035 2.361 1.00 0.00 H ATOM 73067 H2 WAT 5847 38.110 37.634 2.968 1.00 0.00 H TER 73069 WAT 5847 ATOM 73069 O WAT 5848 127.798 33.695 66.580 1.00 0.00 O ATOM 73070 H1 WAT 5848 127.303 33.829 65.772 1.00 0.00 H ATOM 73071 H2 WAT 5848 128.620 33.296 66.294 1.00 0.00 H TER 73073 WAT 5848 ATOM 73073 O WAT 5849 54.378 67.563 8.409 1.00 0.00 O ATOM 73074 H1 WAT 5849 53.990 68.226 8.980 1.00 0.00 H ATOM 73075 H2 WAT 5849 53.745 67.460 7.698 1.00 0.00 H TER 73077 WAT 5849 ATOM 73077 O WAT 5850 39.878 10.739 13.705 1.00 0.00 O ATOM 73078 H1 WAT 5850 39.122 10.243 14.019 1.00 0.00 H ATOM 73079 H2 WAT 5850 40.229 11.162 14.489 1.00 0.00 H TER 73081 WAT 5850 ATOM 73081 O WAT 5851 134.703 51.928 96.283 1.00 0.00 O ATOM 73082 H1 WAT 5851 134.441 52.659 96.843 1.00 0.00 H ATOM 73083 H2 WAT 5851 134.966 52.340 95.460 1.00 0.00 H TER 73085 WAT 5851 ATOM 73085 O WAT 5852 34.484 3.475 3.948 1.00 0.00 O ATOM 73086 H1 WAT 5852 34.308 4.224 4.517 1.00 0.00 H ATOM 73087 H2 WAT 5852 33.619 3.193 3.650 1.00 0.00 H TER 73089 WAT 5852 ATOM 73089 O WAT 5853 101.808 29.306 63.463 1.00 0.00 O ATOM 73090 H1 WAT 5853 102.617 28.895 63.158 1.00 0.00 H ATOM 73091 H2 WAT 5853 101.574 28.817 64.252 1.00 0.00 H TER 73093 WAT 5853 ATOM 73093 O WAT 5854 39.898 70.732 116.276 1.00 0.00 O ATOM 73094 H1 WAT 5854 40.137 70.376 117.131 1.00 0.00 H ATOM 73095 H2 WAT 5854 39.429 71.542 116.475 1.00 0.00 H TER 73097 WAT 5854 ATOM 73097 O WAT 5855 94.715 52.188 10.848 1.00 0.00 O ATOM 73098 H1 WAT 5855 94.635 52.072 9.901 1.00 0.00 H ATOM 73099 H2 WAT 5855 93.953 51.737 11.211 1.00 0.00 H TER 73101 WAT 5855 ATOM 73101 O WAT 5856 72.289 86.016 149.113 1.00 0.00 O ATOM 73102 H1 WAT 5856 71.405 85.669 149.232 1.00 0.00 H ATOM 73103 H2 WAT 5856 72.707 85.905 149.967 1.00 0.00 H TER 73105 WAT 5856 ATOM 73105 O WAT 5857 101.265 9.701 87.385 1.00 0.00 O ATOM 73106 H1 WAT 5857 100.699 8.979 87.111 1.00 0.00 H ATOM 73107 H2 WAT 5857 101.253 10.309 86.646 1.00 0.00 H TER 73109 WAT 5857 ATOM 73109 O WAT 5858 88.070 135.408 86.140 1.00 0.00 O ATOM 73110 H1 WAT 5858 88.562 134.993 86.849 1.00 0.00 H ATOM 73111 H2 WAT 5858 87.210 135.587 86.520 1.00 0.00 H TER 73113 WAT 5858 ATOM 73113 O WAT 5859 144.836 139.816 72.757 1.00 0.00 O ATOM 73114 H1 WAT 5859 144.992 139.415 73.612 1.00 0.00 H ATOM 73115 H2 WAT 5859 144.121 139.304 72.379 1.00 0.00 H TER 73117 WAT 5859 ATOM 73117 O WAT 5860 84.873 117.487 102.771 1.00 0.00 O ATOM 73118 H1 WAT 5860 84.783 117.587 101.824 1.00 0.00 H ATOM 73119 H2 WAT 5860 84.839 116.541 102.916 1.00 0.00 H TER 73121 WAT 5860 ATOM 73121 O WAT 5861 145.292 116.509 73.651 1.00 0.00 O ATOM 73122 H1 WAT 5861 145.724 117.323 73.910 1.00 0.00 H ATOM 73123 H2 WAT 5861 144.447 116.788 73.299 1.00 0.00 H TER 73125 WAT 5861 ATOM 73125 O WAT 5862 138.378 143.844 69.123 1.00 0.00 O ATOM 73126 H1 WAT 5862 138.453 143.440 68.259 1.00 0.00 H ATOM 73127 H2 WAT 5862 137.742 143.300 69.587 1.00 0.00 H TER 73129 WAT 5862 ATOM 73129 O WAT 5863 94.018 11.563 134.057 1.00 0.00 O ATOM 73130 H1 WAT 5863 93.088 11.414 134.226 1.00 0.00 H ATOM 73131 H2 WAT 5863 94.446 10.757 134.346 1.00 0.00 H TER 73133 WAT 5863 ATOM 73133 O WAT 5864 112.660 65.196 126.514 1.00 0.00 O ATOM 73134 H1 WAT 5864 111.928 65.168 125.897 1.00 0.00 H ATOM 73135 H2 WAT 5864 112.473 65.949 127.073 1.00 0.00 H TER 73137 WAT 5864 ATOM 73137 O WAT 5865 73.541 67.724 84.405 1.00 0.00 O ATOM 73138 H1 WAT 5865 73.008 67.812 83.615 1.00 0.00 H ATOM 73139 H2 WAT 5865 74.155 67.018 84.202 1.00 0.00 H TER 73141 WAT 5865 ATOM 73141 O WAT 5866 93.776 103.114 5.942 1.00 0.00 O ATOM 73142 H1 WAT 5866 93.319 102.279 5.837 1.00 0.00 H ATOM 73143 H2 WAT 5866 93.856 103.457 5.052 1.00 0.00 H TER 73145 WAT 5866 ATOM 73145 O WAT 5867 120.982 62.103 150.538 1.00 0.00 O ATOM 73146 H1 WAT 5867 121.358 62.805 150.007 1.00 0.00 H ATOM 73147 H2 WAT 5867 120.037 62.245 150.487 1.00 0.00 H TER 73149 WAT 5867 ATOM 73149 O WAT 5868 67.074 49.199 12.512 1.00 0.00 O ATOM 73150 H1 WAT 5868 67.299 48.714 13.306 1.00 0.00 H ATOM 73151 H2 WAT 5868 67.729 49.896 12.463 1.00 0.00 H TER 73153 WAT 5868 ATOM 73153 O WAT 5869 98.870 114.189 120.220 1.00 0.00 O ATOM 73154 H1 WAT 5869 99.236 113.617 120.895 1.00 0.00 H ATOM 73155 H2 WAT 5869 99.626 114.451 119.693 1.00 0.00 H TER 73157 WAT 5869 ATOM 73157 O WAT 5870 109.044 54.790 95.984 1.00 0.00 O ATOM 73158 H1 WAT 5870 108.960 55.161 96.862 1.00 0.00 H ATOM 73159 H2 WAT 5870 109.605 55.408 95.515 1.00 0.00 H TER 73161 WAT 5870 ATOM 73161 O WAT 5871 36.779 12.527 132.182 1.00 0.00 O ATOM 73162 H1 WAT 5871 35.903 12.489 131.798 1.00 0.00 H ATOM 73163 H2 WAT 5871 36.954 13.462 132.289 1.00 0.00 H TER 73165 WAT 5871 ATOM 73165 O WAT 5872 67.628 129.038 54.293 1.00 0.00 O ATOM 73166 H1 WAT 5872 67.152 128.254 54.019 1.00 0.00 H ATOM 73167 H2 WAT 5872 67.026 129.760 54.113 1.00 0.00 H TER 73169 WAT 5872 ATOM 73169 O WAT 5873 64.073 56.995 22.677 1.00 0.00 O ATOM 73170 H1 WAT 5873 63.469 56.430 23.159 1.00 0.00 H ATOM 73171 H2 WAT 5873 63.942 56.759 21.759 1.00 0.00 H TER 73173 WAT 5873 ATOM 73173 O WAT 5874 36.114 75.502 6.642 1.00 0.00 O ATOM 73174 H1 WAT 5874 35.543 74.762 6.847 1.00 0.00 H ATOM 73175 H2 WAT 5874 36.714 75.164 5.976 1.00 0.00 H TER 73177 WAT 5874 ATOM 73177 O WAT 5875 30.844 5.659 83.337 1.00 0.00 O ATOM 73178 H1 WAT 5875 30.370 4.858 83.563 1.00 0.00 H ATOM 73179 H2 WAT 5875 30.591 6.286 84.014 1.00 0.00 H TER 73181 WAT 5875 ATOM 73181 O WAT 5876 86.541 60.265 127.265 1.00 0.00 O ATOM 73182 H1 WAT 5876 87.306 60.725 127.612 1.00 0.00 H ATOM 73183 H2 WAT 5876 86.574 59.401 127.675 1.00 0.00 H TER 73185 WAT 5876 ATOM 73185 O WAT 5877 119.311 102.038 111.741 1.00 0.00 O ATOM 73186 H1 WAT 5877 119.029 101.986 110.828 1.00 0.00 H ATOM 73187 H2 WAT 5877 119.028 101.209 112.127 1.00 0.00 H TER 73189 WAT 5877 ATOM 73189 O WAT 5878 38.109 144.568 81.982 1.00 0.00 O ATOM 73190 H1 WAT 5878 38.613 143.984 82.549 1.00 0.00 H ATOM 73191 H2 WAT 5878 37.413 144.015 81.627 1.00 0.00 H TER 73193 WAT 5878 ATOM 73193 O WAT 5879 94.706 116.095 20.412 1.00 0.00 O ATOM 73194 H1 WAT 5879 95.245 116.443 21.123 1.00 0.00 H ATOM 73195 H2 WAT 5879 95.191 115.334 20.094 1.00 0.00 H TER 73197 WAT 5879 ATOM 73197 O WAT 5880 19.206 130.184 67.494 1.00 0.00 O ATOM 73198 H1 WAT 5880 18.953 130.214 68.416 1.00 0.00 H ATOM 73199 H2 WAT 5880 19.538 131.062 67.308 1.00 0.00 H TER 73201 WAT 5880 ATOM 73201 O WAT 5881 16.511 94.687 84.405 1.00 0.00 O ATOM 73202 H1 WAT 5881 16.573 94.718 83.450 1.00 0.00 H ATOM 73203 H2 WAT 5881 15.588 94.502 84.578 1.00 0.00 H TER 73205 WAT 5881 ATOM 73205 O WAT 5882 26.759 34.260 98.841 1.00 0.00 O ATOM 73206 H1 WAT 5882 26.942 35.167 98.599 1.00 0.00 H ATOM 73207 H2 WAT 5882 26.160 34.327 99.585 1.00 0.00 H TER 73209 WAT 5882 ATOM 73209 O WAT 5883 87.978 5.384 142.843 1.00 0.00 O ATOM 73210 H1 WAT 5883 88.772 4.848 142.842 1.00 0.00 H ATOM 73211 H2 WAT 5883 87.735 5.450 143.766 1.00 0.00 H TER 73213 WAT 5883 ATOM 73213 O WAT 5884 64.028 108.332 123.336 1.00 0.00 O ATOM 73214 H1 WAT 5884 63.325 108.829 122.917 1.00 0.00 H ATOM 73215 H2 WAT 5884 63.605 107.897 124.077 1.00 0.00 H TER 73217 WAT 5884 ATOM 73217 O WAT 5885 65.162 95.869 139.048 1.00 0.00 O ATOM 73218 H1 WAT 5885 64.423 96.005 139.641 1.00 0.00 H ATOM 73219 H2 WAT 5885 65.935 95.948 139.606 1.00 0.00 H TER 73221 WAT 5885 ATOM 73221 O WAT 5886 127.334 28.107 149.604 1.00 0.00 O ATOM 73222 H1 WAT 5886 128.124 28.622 149.766 1.00 0.00 H ATOM 73223 H2 WAT 5886 126.686 28.747 149.311 1.00 0.00 H TER 73225 WAT 5886 ATOM 73225 O WAT 5887 102.192 54.422 80.918 1.00 0.00 O ATOM 73226 H1 WAT 5887 101.634 55.200 80.903 1.00 0.00 H ATOM 73227 H2 WAT 5887 102.375 54.241 79.996 1.00 0.00 H TER 73229 WAT 5887 ATOM 73229 O WAT 5888 102.378 55.542 144.272 1.00 0.00 O ATOM 73230 H1 WAT 5888 102.753 55.078 143.523 1.00 0.00 H ATOM 73231 H2 WAT 5888 102.037 54.848 144.837 1.00 0.00 H TER 73233 WAT 5888 ATOM 73233 O WAT 5889 122.320 70.269 3.267 1.00 0.00 O ATOM 73234 H1 WAT 5889 121.760 70.505 4.006 1.00 0.00 H ATOM 73235 H2 WAT 5889 121.783 69.681 2.737 1.00 0.00 H TER 73237 WAT 5889 ATOM 73237 O WAT 5890 55.850 59.287 106.945 1.00 0.00 O ATOM 73238 H1 WAT 5890 56.432 59.772 106.358 1.00 0.00 H ATOM 73239 H2 WAT 5890 56.050 59.629 107.816 1.00 0.00 H TER 73241 WAT 5890 ATOM 73241 O WAT 5891 111.045 10.166 119.969 1.00 0.00 O ATOM 73242 H1 WAT 5891 111.133 9.465 119.323 1.00 0.00 H ATOM 73243 H2 WAT 5891 111.246 9.747 120.806 1.00 0.00 H TER 73245 WAT 5891 ATOM 73245 O WAT 5892 76.583 136.651 67.797 1.00 0.00 O ATOM 73246 H1 WAT 5892 76.622 137.600 67.681 1.00 0.00 H ATOM 73247 H2 WAT 5892 75.657 136.466 67.953 1.00 0.00 H TER 73249 WAT 5892 ATOM 73249 O WAT 5893 101.646 73.441 122.664 1.00 0.00 O ATOM 73250 H1 WAT 5893 101.109 73.568 121.882 1.00 0.00 H ATOM 73251 H2 WAT 5893 101.047 73.064 123.308 1.00 0.00 H TER 73253 WAT 5893 ATOM 73253 O WAT 5894 129.649 15.875 116.570 1.00 0.00 O ATOM 73254 H1 WAT 5894 129.245 15.068 116.252 1.00 0.00 H ATOM 73255 H2 WAT 5894 128.919 16.488 116.662 1.00 0.00 H TER 73257 WAT 5894 ATOM 73257 O WAT 5895 138.349 26.843 145.030 1.00 0.00 O ATOM 73258 H1 WAT 5895 138.792 26.718 144.191 1.00 0.00 H ATOM 73259 H2 WAT 5895 137.651 26.188 145.031 1.00 0.00 H TER 73261 WAT 5895 ATOM 73261 O WAT 5896 105.363 111.365 85.382 1.00 0.00 O ATOM 73262 H1 WAT 5896 105.257 112.309 85.268 1.00 0.00 H ATOM 73263 H2 WAT 5896 104.713 111.129 86.043 1.00 0.00 H TER 73265 WAT 5896 ATOM 73265 O WAT 5897 139.389 36.237 7.009 1.00 0.00 O ATOM 73266 H1 WAT 5897 139.383 36.428 6.072 1.00 0.00 H ATOM 73267 H2 WAT 5897 138.473 36.317 7.276 1.00 0.00 H TER 73269 WAT 5897 ATOM 73269 O WAT 5898 88.683 53.451 8.827 1.00 0.00 O ATOM 73270 H1 WAT 5898 88.962 54.176 8.267 1.00 0.00 H ATOM 73271 H2 WAT 5898 88.710 53.810 9.714 1.00 0.00 H TER 73273 WAT 5898 ATOM 73273 O WAT 5899 28.245 5.981 76.398 1.00 0.00 O ATOM 73274 H1 WAT 5899 27.973 6.362 75.563 1.00 0.00 H ATOM 73275 H2 WAT 5899 27.605 5.290 76.566 1.00 0.00 H TER 73277 WAT 5899 ATOM 73277 O WAT 5900 55.898 92.497 68.203 1.00 0.00 O ATOM 73278 H1 WAT 5900 55.358 92.202 67.470 1.00 0.00 H ATOM 73279 H2 WAT 5900 55.271 92.695 68.898 1.00 0.00 H TER 73281 WAT 5900 ATOM 73281 O WAT 5901 48.929 68.305 27.283 1.00 0.00 O ATOM 73282 H1 WAT 5901 48.602 67.421 27.116 1.00 0.00 H ATOM 73283 H2 WAT 5901 49.809 68.310 26.907 1.00 0.00 H TER 73285 WAT 5901 ATOM 73285 O WAT 5902 142.684 71.563 116.459 1.00 0.00 O ATOM 73286 H1 WAT 5902 142.910 71.640 115.532 1.00 0.00 H ATOM 73287 H2 WAT 5902 142.488 70.634 116.582 1.00 0.00 H TER 73289 WAT 5902 ATOM 73289 O WAT 5903 112.854 1.904 74.491 1.00 0.00 O ATOM 73290 H1 WAT 5903 113.778 1.752 74.294 1.00 0.00 H ATOM 73291 H2 WAT 5903 112.695 2.807 74.217 1.00 0.00 H TER 73293 WAT 5903 ATOM 73293 O WAT 5904 103.897 29.791 6.669 1.00 0.00 O ATOM 73294 H1 WAT 5904 103.873 30.739 6.798 1.00 0.00 H ATOM 73295 H2 WAT 5904 104.483 29.470 7.355 1.00 0.00 H TER 73297 WAT 5904 ATOM 73297 O WAT 5905 12.801 34.104 21.601 1.00 0.00 O ATOM 73298 H1 WAT 5905 13.491 34.024 22.260 1.00 0.00 H ATOM 73299 H2 WAT 5905 11.993 33.908 22.076 1.00 0.00 H TER 73301 WAT 5905 ATOM 73301 O WAT 5906 22.324 87.327 84.781 1.00 0.00 O ATOM 73302 H1 WAT 5906 21.565 86.873 85.145 1.00 0.00 H ATOM 73303 H2 WAT 5906 22.166 88.251 84.973 1.00 0.00 H TER 73305 WAT 5906 ATOM 73305 O WAT 5907 16.097 12.094 13.509 1.00 0.00 O ATOM 73306 H1 WAT 5907 16.222 11.361 14.112 1.00 0.00 H ATOM 73307 H2 WAT 5907 16.830 12.028 12.897 1.00 0.00 H TER 73309 WAT 5907 ATOM 73309 O WAT 5908 0.454 129.969 112.546 1.00 0.00 O ATOM 73310 H1 WAT 5908 1.016 130.098 111.782 1.00 0.00 H ATOM 73311 H2 WAT 5908 0.469 129.024 112.698 1.00 0.00 H TER 73313 WAT 5908 ATOM 73313 O WAT 5909 76.224 124.597 136.450 1.00 0.00 O ATOM 73314 H1 WAT 5909 76.721 124.269 135.700 1.00 0.00 H ATOM 73315 H2 WAT 5909 76.743 124.341 137.212 1.00 0.00 H TER 73317 WAT 5909 ATOM 73317 O WAT 5910 15.956 122.817 137.932 1.00 0.00 O ATOM 73318 H1 WAT 5910 15.401 123.571 137.730 1.00 0.00 H ATOM 73319 H2 WAT 5910 16.685 122.886 137.316 1.00 0.00 H TER 73321 WAT 5910 ATOM 73321 O WAT 5911 6.172 109.690 126.075 1.00 0.00 O ATOM 73322 H1 WAT 5911 6.706 109.760 126.866 1.00 0.00 H ATOM 73323 H2 WAT 5911 5.538 110.404 126.151 1.00 0.00 H TER 73325 WAT 5911 ATOM 73325 O WAT 5912 127.742 131.065 11.342 1.00 0.00 O ATOM 73326 H1 WAT 5912 128.588 131.422 11.075 1.00 0.00 H ATOM 73327 H2 WAT 5912 127.324 130.799 10.523 1.00 0.00 H TER 73329 WAT 5912 ATOM 73329 O WAT 5913 26.592 119.108 58.532 1.00 0.00 O ATOM 73330 H1 WAT 5913 26.197 119.562 59.276 1.00 0.00 H ATOM 73331 H2 WAT 5913 26.091 118.296 58.454 1.00 0.00 H TER 73333 WAT 5913 ATOM 73333 O WAT 5914 95.924 54.611 93.419 1.00 0.00 O ATOM 73334 H1 WAT 5914 96.128 54.478 92.493 1.00 0.00 H ATOM 73335 H2 WAT 5914 95.040 54.258 93.522 1.00 0.00 H TER 73337 WAT 5914 ATOM 73337 O WAT 5915 111.443 107.712 118.773 1.00 0.00 O ATOM 73338 H1 WAT 5915 111.309 108.454 118.184 1.00 0.00 H ATOM 73339 H2 WAT 5915 112.241 107.928 119.254 1.00 0.00 H TER 73341 WAT 5915 ATOM 73341 O WAT 5916 93.943 140.279 107.528 1.00 0.00 O ATOM 73342 H1 WAT 5916 93.614 140.261 106.629 1.00 0.00 H ATOM 73343 H2 WAT 5916 94.888 140.398 107.435 1.00 0.00 H TER 73345 WAT 5916 ATOM 73345 O WAT 5917 42.542 24.121 147.273 1.00 0.00 O ATOM 73346 H1 WAT 5917 42.660 25.070 147.283 1.00 0.00 H ATOM 73347 H2 WAT 5917 43.351 23.783 146.890 1.00 0.00 H TER 73349 WAT 5917 ATOM 73349 O WAT 5918 141.595 98.336 101.132 1.00 0.00 O ATOM 73350 H1 WAT 5918 141.675 97.560 101.687 1.00 0.00 H ATOM 73351 H2 WAT 5918 141.689 99.073 101.737 1.00 0.00 H TER 73353 WAT 5918 ATOM 73353 O WAT 5919 47.030 15.134 79.120 1.00 0.00 O ATOM 73354 H1 WAT 5919 47.962 15.034 78.928 1.00 0.00 H ATOM 73355 H2 WAT 5919 46.895 16.081 79.164 1.00 0.00 H TER 73357 WAT 5919 ATOM 73357 O WAT 5920 11.004 15.040 86.267 1.00 0.00 O ATOM 73358 H1 WAT 5920 11.901 14.736 86.131 1.00 0.00 H ATOM 73359 H2 WAT 5920 10.857 14.941 87.208 1.00 0.00 H TER 73361 WAT 5920 ATOM 73361 O WAT 5921 102.919 29.770 118.259 1.00 0.00 O ATOM 73362 H1 WAT 5921 103.602 29.167 118.553 1.00 0.00 H ATOM 73363 H2 WAT 5921 103.017 29.795 117.307 1.00 0.00 H TER 73365 WAT 5921 ATOM 73365 O WAT 5922 25.446 69.522 132.737 1.00 0.00 O ATOM 73366 H1 WAT 5922 25.063 69.768 131.894 1.00 0.00 H ATOM 73367 H2 WAT 5922 25.400 70.321 133.263 1.00 0.00 H TER 73369 WAT 5922 ATOM 73369 O WAT 5923 128.728 139.438 81.697 1.00 0.00 O ATOM 73370 H1 WAT 5923 129.618 139.562 81.366 1.00 0.00 H ATOM 73371 H2 WAT 5923 128.705 139.935 82.515 1.00 0.00 H TER 73373 WAT 5923 ATOM 73373 O WAT 5924 141.165 133.378 135.495 1.00 0.00 O ATOM 73374 H1 WAT 5924 141.120 132.423 135.440 1.00 0.00 H ATOM 73375 H2 WAT 5924 142.067 133.561 135.756 1.00 0.00 H TER 73377 WAT 5924 ATOM 73377 O WAT 5925 45.586 63.787 84.135 1.00 0.00 O ATOM 73378 H1 WAT 5925 46.278 63.220 84.475 1.00 0.00 H ATOM 73379 H2 WAT 5925 45.096 64.059 84.911 1.00 0.00 H TER 73381 WAT 5925 ATOM 73381 O WAT 5926 63.587 44.817 85.993 1.00 0.00 O ATOM 73382 H1 WAT 5926 63.898 45.710 85.845 1.00 0.00 H ATOM 73383 H2 WAT 5926 64.036 44.294 85.330 1.00 0.00 H TER 73385 WAT 5926 ATOM 73385 O WAT 5927 65.223 5.311 138.736 1.00 0.00 O ATOM 73386 H1 WAT 5927 65.403 4.506 139.221 1.00 0.00 H ATOM 73387 H2 WAT 5927 64.479 5.092 138.176 1.00 0.00 H TER 73389 WAT 5927 ATOM 73389 O WAT 5928 97.699 31.516 111.542 1.00 0.00 O ATOM 73390 H1 WAT 5928 97.643 32.469 111.470 1.00 0.00 H ATOM 73391 H2 WAT 5928 97.224 31.190 110.777 1.00 0.00 H TER 73393 WAT 5928 ATOM 73393 O WAT 5929 41.651 85.820 108.505 1.00 0.00 O ATOM 73394 H1 WAT 5929 41.384 85.050 108.003 1.00 0.00 H ATOM 73395 H2 WAT 5929 41.023 86.498 108.254 1.00 0.00 H TER 73397 WAT 5929 ATOM 73397 O WAT 5930 82.522 24.519 76.267 1.00 0.00 O ATOM 73398 H1 WAT 5930 82.883 23.835 76.831 1.00 0.00 H ATOM 73399 H2 WAT 5930 81.838 24.929 76.796 1.00 0.00 H TER 73401 WAT 5930 ATOM 73401 O WAT 5931 30.482 6.760 89.194 1.00 0.00 O ATOM 73402 H1 WAT 5931 30.571 7.710 89.127 1.00 0.00 H ATOM 73403 H2 WAT 5931 30.647 6.567 90.117 1.00 0.00 H TER 73405 WAT 5931 ATOM 73405 O WAT 5932 51.500 48.793 93.866 1.00 0.00 O ATOM 73406 H1 WAT 5932 50.899 48.141 93.504 1.00 0.00 H ATOM 73407 H2 WAT 5932 51.711 49.361 93.125 1.00 0.00 H TER 73409 WAT 5932 ATOM 73409 O WAT 5933 115.380 92.036 113.164 1.00 0.00 O ATOM 73410 H1 WAT 5933 115.970 92.517 112.583 1.00 0.00 H ATOM 73411 H2 WAT 5933 115.221 91.208 112.711 1.00 0.00 H TER 73413 WAT 5933 ATOM 73413 O WAT 5934 76.678 133.243 114.153 1.00 0.00 O ATOM 73414 H1 WAT 5934 76.906 133.706 114.960 1.00 0.00 H ATOM 73415 H2 WAT 5934 77.378 132.600 114.040 1.00 0.00 H TER 73417 WAT 5934 ATOM 73417 O WAT 5935 101.879 48.380 88.062 1.00 0.00 O ATOM 73418 H1 WAT 5935 101.782 49.318 87.902 1.00 0.00 H ATOM 73419 H2 WAT 5935 102.554 48.100 87.443 1.00 0.00 H TER 73421 WAT 5935 ATOM 73421 O WAT 5936 144.212 116.660 107.848 1.00 0.00 O ATOM 73422 H1 WAT 5936 144.147 115.797 108.258 1.00 0.00 H ATOM 73423 H2 WAT 5936 143.638 117.218 108.373 1.00 0.00 H TER 73425 WAT 5936 ATOM 73425 O WAT 5937 24.653 107.992 129.341 1.00 0.00 O ATOM 73426 H1 WAT 5937 24.761 107.555 128.496 1.00 0.00 H ATOM 73427 H2 WAT 5937 24.082 107.409 129.841 1.00 0.00 H TER 73429 WAT 5937 ATOM 73429 O WAT 5938 89.684 138.232 123.833 1.00 0.00 O ATOM 73430 H1 WAT 5938 89.547 137.867 122.959 1.00 0.00 H ATOM 73431 H2 WAT 5938 90.591 138.537 123.826 1.00 0.00 H TER 73433 WAT 5938 ATOM 73433 O WAT 5939 103.333 93.716 116.933 1.00 0.00 O ATOM 73434 H1 WAT 5939 102.619 94.352 116.899 1.00 0.00 H ATOM 73435 H2 WAT 5939 102.894 92.866 116.974 1.00 0.00 H TER 73437 WAT 5939 ATOM 73437 O WAT 5940 20.447 99.666 136.479 1.00 0.00 O ATOM 73438 H1 WAT 5940 19.629 99.765 136.966 1.00 0.00 H ATOM 73439 H2 WAT 5940 20.171 99.458 135.586 1.00 0.00 H TER 73441 WAT 5940 ATOM 73441 O WAT 5941 136.725 54.995 131.004 1.00 0.00 O ATOM 73442 H1 WAT 5941 137.103 55.030 131.883 1.00 0.00 H ATOM 73443 H2 WAT 5941 136.946 54.121 130.684 1.00 0.00 H TER 73445 WAT 5941 ATOM 73445 O WAT 5942 76.727 23.802 154.133 1.00 0.00 O ATOM 73446 H1 WAT 5942 76.276 24.588 153.824 1.00 0.00 H ATOM 73447 H2 WAT 5942 76.985 23.344 153.333 1.00 0.00 H TER 73449 WAT 5942 ATOM 73449 O WAT 5943 81.782 13.246 148.055 1.00 0.00 O ATOM 73450 H1 WAT 5943 81.763 12.522 148.681 1.00 0.00 H ATOM 73451 H2 WAT 5943 80.966 13.158 147.562 1.00 0.00 H TER 73453 WAT 5943 ATOM 73453 O WAT 5944 129.911 48.444 12.523 1.00 0.00 O ATOM 73454 H1 WAT 5944 129.968 49.232 13.062 1.00 0.00 H ATOM 73455 H2 WAT 5944 129.549 48.749 11.691 1.00 0.00 H TER 73457 WAT 5944 ATOM 73457 O WAT 5945 42.237 107.862 5.906 1.00 0.00 O ATOM 73458 H1 WAT 5945 41.644 108.607 5.808 1.00 0.00 H ATOM 73459 H2 WAT 5945 42.518 107.661 5.014 1.00 0.00 H TER 73461 WAT 5945 ATOM 73461 O WAT 5946 13.157 98.589 94.406 1.00 0.00 O ATOM 73462 H1 WAT 5946 12.211 98.521 94.533 1.00 0.00 H ATOM 73463 H2 WAT 5946 13.527 98.423 95.273 1.00 0.00 H TER 73465 WAT 5946 ATOM 73465 O WAT 5947 94.201 72.981 147.016 1.00 0.00 O ATOM 73466 H1 WAT 5947 94.832 73.529 146.550 1.00 0.00 H ATOM 73467 H2 WAT 5947 93.386 73.482 146.994 1.00 0.00 H TER 73469 WAT 5947 ATOM 73469 O WAT 5948 20.079 41.954 10.285 1.00 0.00 O ATOM 73470 H1 WAT 5948 19.190 41.668 10.078 1.00 0.00 H ATOM 73471 H2 WAT 5948 20.524 41.160 10.581 1.00 0.00 H TER 73473 WAT 5948 ATOM 73473 O WAT 5949 112.076 71.833 72.241 1.00 0.00 O ATOM 73474 H1 WAT 5949 111.426 72.156 72.866 1.00 0.00 H ATOM 73475 H2 WAT 5949 111.558 71.436 71.541 1.00 0.00 H TER 73477 WAT 5949 ATOM 73477 O WAT 5950 135.662 129.143 99.646 1.00 0.00 O ATOM 73478 H1 WAT 5950 136.123 128.642 100.319 1.00 0.00 H ATOM 73479 H2 WAT 5950 136.235 129.101 98.881 1.00 0.00 H TER 73481 WAT 5950 ATOM 73481 O WAT 5951 77.313 133.966 137.970 1.00 0.00 O ATOM 73482 H1 WAT 5951 78.242 133.851 137.769 1.00 0.00 H ATOM 73483 H2 WAT 5951 77.148 134.896 137.816 1.00 0.00 H TER 73485 WAT 5951 ATOM 73485 O WAT 5952 124.532 100.377 155.493 1.00 0.00 O ATOM 73486 H1 WAT 5952 124.363 100.745 154.626 1.00 0.00 H ATOM 73487 H2 WAT 5952 124.304 99.451 155.409 1.00 0.00 H TER 73489 WAT 5952 ATOM 73489 O WAT 5953 61.636 18.563 158.373 1.00 0.00 O ATOM 73490 H1 WAT 5953 60.879 19.106 158.595 1.00 0.00 H ATOM 73491 H2 WAT 5953 61.264 17.706 158.167 1.00 0.00 H TER 73493 WAT 5953 ATOM 73493 O WAT 5954 77.382 43.049 13.650 1.00 0.00 O ATOM 73494 H1 WAT 5954 78.211 43.484 13.449 1.00 0.00 H ATOM 73495 H2 WAT 5954 76.851 43.727 14.068 1.00 0.00 H TER 73497 WAT 5954 ATOM 73497 O WAT 5955 85.217 127.541 11.138 1.00 0.00 O ATOM 73498 H1 WAT 5955 84.357 127.155 11.305 1.00 0.00 H ATOM 73499 H2 WAT 5955 85.725 127.344 11.925 1.00 0.00 H TER 73501 WAT 5955 ATOM 73501 O WAT 5956 70.570 5.203 98.918 1.00 0.00 O ATOM 73502 H1 WAT 5956 71.425 5.416 98.545 1.00 0.00 H ATOM 73503 H2 WAT 5956 70.766 4.609 99.642 1.00 0.00 H TER 73505 WAT 5956 ATOM 73505 O WAT 5957 10.648 127.530 158.413 1.00 0.00 O ATOM 73506 H1 WAT 5957 9.702 127.671 158.450 1.00 0.00 H ATOM 73507 H2 WAT 5957 10.745 126.642 158.070 1.00 0.00 H TER 73509 WAT 5957 ATOM 73509 O WAT 5958 139.505 133.142 73.425 1.00 0.00 O ATOM 73510 H1 WAT 5958 139.838 133.815 72.831 1.00 0.00 H ATOM 73511 H2 WAT 5958 140.229 132.522 73.516 1.00 0.00 H TER 73513 WAT 5958 ATOM 73513 O WAT 5959 26.719 125.019 22.565 1.00 0.00 O ATOM 73514 H1 WAT 5959 26.098 124.803 23.261 1.00 0.00 H ATOM 73515 H2 WAT 5959 27.502 124.510 22.776 1.00 0.00 H TER 73517 WAT 5959 ATOM 73517 O WAT 5960 29.164 82.499 99.750 1.00 0.00 O ATOM 73518 H1 WAT 5960 28.387 83.056 99.713 1.00 0.00 H ATOM 73519 H2 WAT 5960 29.607 82.758 100.557 1.00 0.00 H TER 73521 WAT 5960 ATOM 73521 O WAT 5961 13.909 23.972 71.439 1.00 0.00 O ATOM 73522 H1 WAT 5961 13.057 23.903 71.871 1.00 0.00 H ATOM 73523 H2 WAT 5961 13.741 23.708 70.534 1.00 0.00 H TER 73525 WAT 5961 ATOM 73525 O WAT 5962 106.115 130.449 139.590 1.00 0.00 O ATOM 73526 H1 WAT 5962 107.001 130.105 139.468 1.00 0.00 H ATOM 73527 H2 WAT 5962 106.183 131.017 140.357 1.00 0.00 H TER 73529 WAT 5962 ATOM 73529 O WAT 5963 79.551 97.876 108.315 1.00 0.00 O ATOM 73530 H1 WAT 5963 79.927 98.715 108.046 1.00 0.00 H ATOM 73531 H2 WAT 5963 79.431 97.959 109.261 1.00 0.00 H TER 73533 WAT 5963 ATOM 73533 O WAT 5964 78.064 41.540 11.007 1.00 0.00 O ATOM 73534 H1 WAT 5964 77.643 41.004 10.334 1.00 0.00 H ATOM 73535 H2 WAT 5964 78.500 42.238 10.519 1.00 0.00 H TER 73537 WAT 5964 ATOM 73537 O WAT 5965 55.046 144.962 73.882 1.00 0.00 O ATOM 73538 H1 WAT 5965 54.477 144.857 73.120 1.00 0.00 H ATOM 73539 H2 WAT 5965 55.088 145.908 74.021 1.00 0.00 H TER 73541 WAT 5965 ATOM 73541 O WAT 5966 23.739 11.761 10.025 1.00 0.00 O ATOM 73542 H1 WAT 5966 24.472 12.374 9.962 1.00 0.00 H ATOM 73543 H2 WAT 5966 23.080 12.113 9.427 1.00 0.00 H TER 73545 WAT 5966 ATOM 73545 O WAT 5967 144.713 141.790 6.591 1.00 0.00 O ATOM 73546 H1 WAT 5967 144.373 141.009 7.026 1.00 0.00 H ATOM 73547 H2 WAT 5967 143.958 142.156 6.130 1.00 0.00 H TER 73549 WAT 5967 ATOM 73549 O WAT 5968 44.966 83.917 127.171 1.00 0.00 O ATOM 73550 H1 WAT 5968 44.255 84.513 127.405 1.00 0.00 H ATOM 73551 H2 WAT 5968 45.717 84.490 127.016 1.00 0.00 H TER 73553 WAT 5968 ATOM 73553 O WAT 5969 140.846 77.203 13.068 1.00 0.00 O ATOM 73554 H1 WAT 5969 140.444 77.041 13.922 1.00 0.00 H ATOM 73555 H2 WAT 5969 141.232 76.363 12.822 1.00 0.00 H TER 73557 WAT 5969 ATOM 73557 O WAT 5970 61.659 14.338 69.376 1.00 0.00 O ATOM 73558 H1 WAT 5970 62.486 14.020 69.015 1.00 0.00 H ATOM 73559 H2 WAT 5970 61.129 14.554 68.609 1.00 0.00 H TER 73561 WAT 5970 ATOM 73561 O WAT 5971 144.988 99.688 110.751 1.00 0.00 O ATOM 73562 H1 WAT 5971 144.431 99.701 109.973 1.00 0.00 H ATOM 73563 H2 WAT 5971 144.642 100.386 111.306 1.00 0.00 H TER 73565 WAT 5971 ATOM 73565 O WAT 5972 72.410 99.535 135.935 1.00 0.00 O ATOM 73566 H1 WAT 5972 73.224 99.126 136.230 1.00 0.00 H ATOM 73567 H2 WAT 5972 72.617 100.468 135.879 1.00 0.00 H TER 73569 WAT 5972 ATOM 73569 O WAT 5973 125.580 68.552 106.765 1.00 0.00 O ATOM 73570 H1 WAT 5973 125.144 67.886 106.233 1.00 0.00 H ATOM 73571 H2 WAT 5973 126.479 68.236 106.855 1.00 0.00 H TER 73573 WAT 5973 ATOM 73573 O WAT 5974 126.280 144.305 61.464 1.00 0.00 O ATOM 73574 H1 WAT 5974 126.041 144.702 60.627 1.00 0.00 H ATOM 73575 H2 WAT 5974 127.003 144.843 61.786 1.00 0.00 H TER 73577 WAT 5974 ATOM 73577 O WAT 5975 12.107 25.684 0.998 1.00 0.00 O ATOM 73578 H1 WAT 5975 11.303 25.167 0.940 1.00 0.00 H ATOM 73579 H2 WAT 5975 12.013 26.350 0.317 1.00 0.00 H TER 73581 WAT 5975 ATOM 73581 O WAT 5976 124.438 134.603 102.868 1.00 0.00 O ATOM 73582 H1 WAT 5976 125.193 134.337 102.343 1.00 0.00 H ATOM 73583 H2 WAT 5976 124.576 135.536 103.030 1.00 0.00 H TER 73585 WAT 5976 ATOM 73585 O WAT 5977 132.324 73.904 5.608 1.00 0.00 O ATOM 73586 H1 WAT 5977 132.477 74.510 4.883 1.00 0.00 H ATOM 73587 H2 WAT 5977 131.869 73.163 5.210 1.00 0.00 H TER 73589 WAT 5977 ATOM 73589 O WAT 5978 79.754 67.572 136.667 1.00 0.00 O ATOM 73590 H1 WAT 5978 79.356 68.294 136.180 1.00 0.00 H ATOM 73591 H2 WAT 5978 80.454 67.982 137.174 1.00 0.00 H TER 73593 WAT 5978 ATOM 73593 O WAT 5979 85.046 51.750 121.077 1.00 0.00 O ATOM 73594 H1 WAT 5979 85.439 52.381 121.680 1.00 0.00 H ATOM 73595 H2 WAT 5979 84.716 51.052 121.643 1.00 0.00 H TER 73597 WAT 5979 ATOM 73597 O WAT 5980 135.672 120.592 89.937 1.00 0.00 O ATOM 73598 H1 WAT 5980 135.119 120.944 89.240 1.00 0.00 H ATOM 73599 H2 WAT 5980 135.076 120.463 90.674 1.00 0.00 H TER 73601 WAT 5980 ATOM 73601 O WAT 5981 119.251 127.084 139.276 1.00 0.00 O ATOM 73602 H1 WAT 5981 119.101 127.871 139.799 1.00 0.00 H ATOM 73603 H2 WAT 5981 120.121 127.210 138.897 1.00 0.00 H TER 73605 WAT 5981 ATOM 73605 O WAT 5982 136.509 114.291 73.340 1.00 0.00 O ATOM 73606 H1 WAT 5982 137.076 114.087 74.084 1.00 0.00 H ATOM 73607 H2 WAT 5982 135.779 113.677 73.420 1.00 0.00 H TER 73609 WAT 5982 ATOM 73609 O WAT 5983 92.894 113.713 84.261 1.00 0.00 O ATOM 73610 H1 WAT 5983 93.300 112.866 84.076 1.00 0.00 H ATOM 73611 H2 WAT 5983 92.118 113.733 83.701 1.00 0.00 H TER 73613 WAT 5983 ATOM 73613 O WAT 5984 78.100 103.778 155.766 1.00 0.00 O ATOM 73614 H1 WAT 5984 78.388 103.817 156.678 1.00 0.00 H ATOM 73615 H2 WAT 5984 77.351 104.372 155.726 1.00 0.00 H TER 73617 WAT 5984 ATOM 73617 O WAT 5985 126.129 61.203 76.857 1.00 0.00 O ATOM 73618 H1 WAT 5985 126.584 62.013 76.628 1.00 0.00 H ATOM 73619 H2 WAT 5985 125.919 61.301 77.786 1.00 0.00 H TER 73621 WAT 5985 ATOM 73621 O WAT 5986 18.587 75.218 22.961 1.00 0.00 O ATOM 73622 H1 WAT 5986 17.838 74.832 22.507 1.00 0.00 H ATOM 73623 H2 WAT 5986 19.305 74.605 22.802 1.00 0.00 H TER 73625 WAT 5986 ATOM 73625 O WAT 5987 83.953 14.964 90.626 1.00 0.00 O ATOM 73626 H1 WAT 5987 84.871 15.030 90.363 1.00 0.00 H ATOM 73627 H2 WAT 5987 83.703 15.861 90.848 1.00 0.00 H TER 73629 WAT 5987 ATOM 73629 O WAT 5988 12.718 87.259 151.903 1.00 0.00 O ATOM 73630 H1 WAT 5988 12.180 87.132 152.685 1.00 0.00 H ATOM 73631 H2 WAT 5988 13.023 86.381 151.676 1.00 0.00 H TER 73633 WAT 5988 ATOM 73633 O WAT 5989 75.531 6.442 115.815 1.00 0.00 O ATOM 73634 H1 WAT 5989 74.760 5.935 116.070 1.00 0.00 H ATOM 73635 H2 WAT 5989 75.248 7.354 115.874 1.00 0.00 H TER 73637 WAT 5989 ATOM 73637 O WAT 5990 106.281 94.691 116.925 1.00 0.00 O ATOM 73638 H1 WAT 5990 105.376 94.387 116.861 1.00 0.00 H ATOM 73639 H2 WAT 5990 106.547 94.842 116.018 1.00 0.00 H TER 73641 WAT 5990 ATOM 73641 O WAT 5991 10.387 15.724 141.381 1.00 0.00 O ATOM 73642 H1 WAT 5991 9.988 15.496 142.221 1.00 0.00 H ATOM 73643 H2 WAT 5991 10.175 16.650 141.259 1.00 0.00 H TER 73645 WAT 5991 ATOM 73645 O WAT 5992 119.693 18.351 117.597 1.00 0.00 O ATOM 73646 H1 WAT 5992 119.446 18.269 116.675 1.00 0.00 H ATOM 73647 H2 WAT 5992 119.476 19.255 117.824 1.00 0.00 H TER 73649 WAT 5992 ATOM 73649 O WAT 5993 127.534 94.993 10.414 1.00 0.00 O ATOM 73650 H1 WAT 5993 128.353 95.163 10.881 1.00 0.00 H ATOM 73651 H2 WAT 5993 127.159 94.232 10.858 1.00 0.00 H TER 73653 WAT 5993 ATOM 73653 O WAT 5994 126.254 51.952 5.620 1.00 0.00 O ATOM 73654 H1 WAT 5994 126.971 52.551 5.412 1.00 0.00 H ATOM 73655 H2 WAT 5994 125.939 51.650 4.768 1.00 0.00 H TER 73657 WAT 5994 ATOM 73657 O WAT 5995 13.723 78.239 147.713 1.00 0.00 O ATOM 73658 H1 WAT 5995 14.601 77.871 147.619 1.00 0.00 H ATOM 73659 H2 WAT 5995 13.640 78.428 148.648 1.00 0.00 H TER 73661 WAT 5995 ATOM 73661 O WAT 5996 83.081 0.545 67.035 1.00 0.00 O ATOM 73662 H1 WAT 5996 82.268 0.045 66.971 1.00 0.00 H ATOM 73663 H2 WAT 5996 83.749 -0.035 66.670 1.00 0.00 H TER 73665 WAT 5996 ATOM 73665 O WAT 5997 101.672 0.687 98.065 1.00 0.00 O ATOM 73666 H1 WAT 5997 101.551 1.585 97.755 1.00 0.00 H ATOM 73667 H2 WAT 5997 102.186 0.264 97.377 1.00 0.00 H TER 73669 WAT 5997 ATOM 73669 O WAT 5998 82.492 98.333 76.213 1.00 0.00 O ATOM 73670 H1 WAT 5998 81.810 97.981 76.785 1.00 0.00 H ATOM 73671 H2 WAT 5998 83.026 98.882 76.788 1.00 0.00 H TER 73673 WAT 5998 ATOM 73673 O WAT 5999 102.923 99.068 112.805 1.00 0.00 O ATOM 73674 H1 WAT 5999 102.155 98.649 112.416 1.00 0.00 H ATOM 73675 H2 WAT 5999 102.830 98.913 113.745 1.00 0.00 H TER 73677 WAT 5999 ATOM 73677 O WAT 6000 89.071 30.286 123.367 1.00 0.00 O ATOM 73678 H1 WAT 6000 88.280 29.766 123.225 1.00 0.00 H ATOM 73679 H2 WAT 6000 89.753 29.640 123.547 1.00 0.00 H TER 73681 WAT 6000 ATOM 73681 O WAT 6001 77.159 87.026 104.887 1.00 0.00 O ATOM 73682 H1 WAT 6001 77.837 87.660 105.118 1.00 0.00 H ATOM 73683 H2 WAT 6001 77.557 86.487 104.203 1.00 0.00 H TER 73685 WAT 6001 ATOM 73685 O WAT 6002 49.634 59.508 142.119 1.00 0.00 O ATOM 73686 H1 WAT 6002 50.005 58.661 142.368 1.00 0.00 H ATOM 73687 H2 WAT 6002 49.855 59.603 141.192 1.00 0.00 H TER 73689 WAT 6002 ATOM 73689 O WAT 6003 71.993 34.680 158.428 1.00 0.00 O ATOM 73690 H1 WAT 6003 72.627 34.720 159.145 1.00 0.00 H ATOM 73691 H2 WAT 6003 72.528 34.711 157.634 1.00 0.00 H TER 73693 WAT 6003 ATOM 73693 O WAT 6004 131.014 133.091 0.282 1.00 0.00 O ATOM 73694 H1 WAT 6004 130.792 133.245 1.201 1.00 0.00 H ATOM 73695 H2 WAT 6004 131.850 133.541 0.160 1.00 0.00 H TER 73697 WAT 6004 ATOM 73697 O WAT 6005 72.579 27.946 80.490 1.00 0.00 O ATOM 73698 H1 WAT 6005 72.646 28.867 80.741 1.00 0.00 H ATOM 73699 H2 WAT 6005 73.057 27.476 81.174 1.00 0.00 H TER 73701 WAT 6005 ATOM 73701 O WAT 6006 87.346 137.519 1.765 1.00 0.00 O ATOM 73702 H1 WAT 6006 88.119 137.292 1.248 1.00 0.00 H ATOM 73703 H2 WAT 6006 86.710 136.836 1.557 1.00 0.00 H TER 73705 WAT 6006 ATOM 73705 O WAT 6007 116.737 109.836 4.913 1.00 0.00 O ATOM 73706 H1 WAT 6007 116.279 110.418 4.306 1.00 0.00 H ATOM 73707 H2 WAT 6007 116.271 109.003 4.843 1.00 0.00 H TER 73709 WAT 6007 ATOM 73709 O WAT 6008 115.073 82.942 100.525 1.00 0.00 O ATOM 73710 H1 WAT 6008 115.902 83.143 100.959 1.00 0.00 H ATOM 73711 H2 WAT 6008 115.059 81.986 100.468 1.00 0.00 H TER 73713 WAT 6008 ATOM 73713 O WAT 6009 74.362 119.379 12.830 1.00 0.00 O ATOM 73714 H1 WAT 6009 74.534 119.183 13.751 1.00 0.00 H ATOM 73715 H2 WAT 6009 73.910 118.602 12.500 1.00 0.00 H TER 73717 WAT 6009 ATOM 73717 O WAT 6010 99.588 12.054 154.138 1.00 0.00 O ATOM 73718 H1 WAT 6010 100.181 12.566 154.688 1.00 0.00 H ATOM 73719 H2 WAT 6010 99.894 12.210 153.245 1.00 0.00 H TER 73721 WAT 6010 ATOM 73721 O WAT 6011 28.642 49.330 17.292 1.00 0.00 O ATOM 73722 H1 WAT 6011 29.006 48.836 18.027 1.00 0.00 H ATOM 73723 H2 WAT 6011 29.034 48.928 16.516 1.00 0.00 H TER 73725 WAT 6011 ATOM 73725 O WAT 6012 86.380 91.916 7.206 1.00 0.00 O ATOM 73726 H1 WAT 6012 87.320 92.093 7.202 1.00 0.00 H ATOM 73727 H2 WAT 6012 86.061 92.333 8.006 1.00 0.00 H TER 73729 WAT 6012 ATOM 73729 O WAT 6013 143.195 102.244 21.087 1.00 0.00 O ATOM 73730 H1 WAT 6013 142.487 102.626 21.605 1.00 0.00 H ATOM 73731 H2 WAT 6013 143.765 102.984 20.877 1.00 0.00 H TER 73733 WAT 6013 ATOM 73733 O WAT 6014 33.102 110.921 151.191 1.00 0.00 O ATOM 73734 H1 WAT 6014 33.658 111.586 151.598 1.00 0.00 H ATOM 73735 H2 WAT 6014 32.790 110.389 151.923 1.00 0.00 H TER 73737 WAT 6014 ATOM 73737 O WAT 6015 3.300 21.655 73.631 1.00 0.00 O ATOM 73738 H1 WAT 6015 3.430 21.296 72.753 1.00 0.00 H ATOM 73739 H2 WAT 6015 2.799 20.983 74.093 1.00 0.00 H TER 73741 WAT 6015 ATOM 73741 O WAT 6016 12.091 144.211 157.382 1.00 0.00 O ATOM 73742 H1 WAT 6016 12.162 144.320 156.433 1.00 0.00 H ATOM 73743 H2 WAT 6016 11.304 143.679 157.503 1.00 0.00 H TER 73745 WAT 6016 ATOM 73745 O WAT 6017 22.907 51.759 79.857 1.00 0.00 O ATOM 73746 H1 WAT 6017 22.876 50.816 79.693 1.00 0.00 H ATOM 73747 H2 WAT 6017 23.516 52.097 79.200 1.00 0.00 H TER 73749 WAT 6017 ATOM 73749 O WAT 6018 30.160 34.441 63.313 1.00 0.00 O ATOM 73750 H1 WAT 6018 30.304 33.497 63.388 1.00 0.00 H ATOM 73751 H2 WAT 6018 29.255 34.522 63.012 1.00 0.00 H TER 73753 WAT 6018 ATOM 73753 O WAT 6019 103.315 135.462 98.262 1.00 0.00 O ATOM 73754 H1 WAT 6019 103.287 135.484 99.218 1.00 0.00 H ATOM 73755 H2 WAT 6019 103.779 134.651 98.055 1.00 0.00 H TER 73757 WAT 6019 ATOM 73757 O WAT 6020 93.274 97.731 65.866 1.00 0.00 O ATOM 73758 H1 WAT 6020 92.899 98.365 65.254 1.00 0.00 H ATOM 73759 H2 WAT 6020 93.113 96.880 65.458 1.00 0.00 H TER 73761 WAT 6020 ATOM 73761 O WAT 6021 135.014 77.976 146.345 1.00 0.00 O ATOM 73762 H1 WAT 6021 135.168 77.933 147.288 1.00 0.00 H ATOM 73763 H2 WAT 6021 134.127 77.634 146.231 1.00 0.00 H TER 73765 WAT 6021 ATOM 73765 O WAT 6022 48.324 29.127 101.190 1.00 0.00 O ATOM 73766 H1 WAT 6022 47.560 29.509 100.758 1.00 0.00 H ATOM 73767 H2 WAT 6022 47.961 28.629 101.922 1.00 0.00 H TER 73769 WAT 6022 ATOM 73769 O WAT 6023 40.310 61.768 19.224 1.00 0.00 O ATOM 73770 H1 WAT 6023 39.961 61.223 18.519 1.00 0.00 H ATOM 73771 H2 WAT 6023 41.251 61.810 19.051 1.00 0.00 H TER 73773 WAT 6023 ATOM 73773 O WAT 6024 22.903 64.177 132.519 1.00 0.00 O ATOM 73774 H1 WAT 6024 22.642 64.368 133.420 1.00 0.00 H ATOM 73775 H2 WAT 6024 22.464 63.352 132.312 1.00 0.00 H TER 73777 WAT 6024 ATOM 73777 O WAT 6025 118.901 61.635 9.972 1.00 0.00 O ATOM 73778 H1 WAT 6025 119.664 61.899 10.487 1.00 0.00 H ATOM 73779 H2 WAT 6025 118.457 62.457 9.762 1.00 0.00 H TER 73781 WAT 6025 ATOM 73781 O WAT 6026 86.324 13.006 154.308 1.00 0.00 O ATOM 73782 H1 WAT 6026 86.278 12.142 154.719 1.00 0.00 H ATOM 73783 H2 WAT 6026 86.276 13.622 155.039 1.00 0.00 H TER 73785 WAT 6026 ATOM 73785 O WAT 6027 50.081 34.781 114.152 1.00 0.00 O ATOM 73786 H1 WAT 6027 50.804 34.974 113.555 1.00 0.00 H ATOM 73787 H2 WAT 6027 49.297 34.846 113.607 1.00 0.00 H TER 73789 WAT 6027 ATOM 73789 O WAT 6028 93.662 38.219 70.283 1.00 0.00 O ATOM 73790 H1 WAT 6028 94.154 38.273 69.464 1.00 0.00 H ATOM 73791 H2 WAT 6028 93.234 39.072 70.363 1.00 0.00 H TER 73793 WAT 6028 ATOM 73793 O WAT 6029 74.376 99.782 121.714 1.00 0.00 O ATOM 73794 H1 WAT 6029 74.955 99.554 120.986 1.00 0.00 H ATOM 73795 H2 WAT 6029 73.920 100.570 121.420 1.00 0.00 H TER 73797 WAT 6029 ATOM 73797 O WAT 6030 29.866 53.603 5.165 1.00 0.00 O ATOM 73798 H1 WAT 6030 29.864 54.555 5.272 1.00 0.00 H ATOM 73799 H2 WAT 6030 29.122 53.302 5.687 1.00 0.00 H TER 73801 WAT 6030 ATOM 73801 O WAT 6031 46.294 85.099 66.923 1.00 0.00 O ATOM 73802 H1 WAT 6031 45.959 84.477 67.569 1.00 0.00 H ATOM 73803 H2 WAT 6031 47.189 84.807 66.751 1.00 0.00 H TER 73805 WAT 6031 ATOM 73805 O WAT 6032 142.083 20.355 63.298 1.00 0.00 O ATOM 73806 H1 WAT 6032 142.120 19.747 62.559 1.00 0.00 H ATOM 73807 H2 WAT 6032 141.179 20.298 63.609 1.00 0.00 H TER 73809 WAT 6032 ATOM 73809 O WAT 6033 80.126 6.728 142.012 1.00 0.00 O ATOM 73810 H1 WAT 6033 80.544 6.461 141.193 1.00 0.00 H ATOM 73811 H2 WAT 6033 79.480 7.384 141.748 1.00 0.00 H TER 73813 WAT 6033 ATOM 73813 O WAT 6034 33.644 110.779 129.416 1.00 0.00 O ATOM 73814 H1 WAT 6034 34.015 110.777 130.298 1.00 0.00 H ATOM 73815 H2 WAT 6034 34.315 111.194 128.875 1.00 0.00 H TER 73817 WAT 6034 ATOM 73817 O WAT 6035 131.091 113.049 102.336 1.00 0.00 O ATOM 73818 H1 WAT 6035 131.305 113.495 103.156 1.00 0.00 H ATOM 73819 H2 WAT 6035 130.230 113.392 102.095 1.00 0.00 H TER 73821 WAT 6035 ATOM 73821 O WAT 6036 134.308 32.116 99.487 1.00 0.00 O ATOM 73822 H1 WAT 6036 134.499 31.327 98.981 1.00 0.00 H ATOM 73823 H2 WAT 6036 134.783 31.994 100.309 1.00 0.00 H TER 73825 WAT 6036 ATOM 73825 O WAT 6037 111.939 103.037 139.090 1.00 0.00 O ATOM 73826 H1 WAT 6037 112.447 103.702 139.554 1.00 0.00 H ATOM 73827 H2 WAT 6037 111.228 102.816 139.692 1.00 0.00 H TER 73829 WAT 6037 ATOM 73829 O WAT 6038 49.973 46.295 93.812 1.00 0.00 O ATOM 73830 H1 WAT 6038 49.646 46.309 92.912 1.00 0.00 H ATOM 73831 H2 WAT 6038 50.732 45.712 93.782 1.00 0.00 H TER 73833 WAT 6038 ATOM 73833 O WAT 6039 1.345 95.797 129.544 1.00 0.00 O ATOM 73834 H1 WAT 6039 0.437 95.881 129.834 1.00 0.00 H ATOM 73835 H2 WAT 6039 1.520 94.856 129.574 1.00 0.00 H TER 73837 WAT 6039 ATOM 73837 O WAT 6040 24.583 87.884 100.936 1.00 0.00 O ATOM 73838 H1 WAT 6040 24.148 88.736 100.973 1.00 0.00 H ATOM 73839 H2 WAT 6040 23.883 87.267 100.724 1.00 0.00 H TER 73841 WAT 6040 ATOM 73841 O WAT 6041 74.104 108.754 71.945 1.00 0.00 O ATOM 73842 H1 WAT 6041 74.691 108.660 71.195 1.00 0.00 H ATOM 73843 H2 WAT 6041 73.522 107.996 71.890 1.00 0.00 H TER 73845 WAT 6041 ATOM 73845 O WAT 6042 27.718 77.242 99.686 1.00 0.00 O ATOM 73846 H1 WAT 6042 27.209 77.046 98.900 1.00 0.00 H ATOM 73847 H2 WAT 6042 28.174 78.057 99.480 1.00 0.00 H TER 73849 WAT 6042 ATOM 73849 O WAT 6043 112.032 14.315 110.375 1.00 0.00 O ATOM 73850 H1 WAT 6043 112.805 14.073 110.885 1.00 0.00 H ATOM 73851 H2 WAT 6043 112.100 13.794 109.575 1.00 0.00 H TER 73853 WAT 6043 ATOM 73853 O WAT 6044 75.215 85.597 137.332 1.00 0.00 O ATOM 73854 H1 WAT 6044 75.857 85.358 136.663 1.00 0.00 H ATOM 73855 H2 WAT 6044 75.309 86.545 137.425 1.00 0.00 H TER 73857 WAT 6044 ATOM 73857 O WAT 6045 4.952 96.175 83.882 1.00 0.00 O ATOM 73858 H1 WAT 6045 5.667 95.544 83.799 1.00 0.00 H ATOM 73859 H2 WAT 6045 5.092 96.584 84.736 1.00 0.00 H TER 73861 WAT 6045 ATOM 73861 O WAT 6046 79.660 131.860 2.921 1.00 0.00 O ATOM 73862 H1 WAT 6046 78.804 131.466 2.754 1.00 0.00 H ATOM 73863 H2 WAT 6046 80.011 131.366 3.662 1.00 0.00 H TER 73865 WAT 6046 ATOM 73865 O WAT 6047 64.100 139.827 55.197 1.00 0.00 O ATOM 73866 H1 WAT 6047 63.341 140.384 55.026 1.00 0.00 H ATOM 73867 H2 WAT 6047 63.813 138.948 54.950 1.00 0.00 H TER 73869 WAT 6047 ATOM 73869 O WAT 6048 112.359 68.485 114.372 1.00 0.00 O ATOM 73870 H1 WAT 6048 112.246 69.060 115.129 1.00 0.00 H ATOM 73871 H2 WAT 6048 111.893 68.927 113.663 1.00 0.00 H TER 73873 WAT 6048 ATOM 73873 O WAT 6049 98.286 51.713 121.328 1.00 0.00 O ATOM 73874 H1 WAT 6049 98.289 50.759 121.405 1.00 0.00 H ATOM 73875 H2 WAT 6049 98.775 51.889 120.524 1.00 0.00 H TER 73877 WAT 6049 ATOM 73877 O WAT 6050 20.644 32.210 108.921 1.00 0.00 O ATOM 73878 H1 WAT 6050 21.123 33.028 109.053 1.00 0.00 H ATOM 73879 H2 WAT 6050 21.322 31.563 108.726 1.00 0.00 H TER 73881 WAT 6050 ATOM 73881 O WAT 6051 78.283 8.129 119.542 1.00 0.00 O ATOM 73882 H1 WAT 6051 78.894 7.434 119.785 1.00 0.00 H ATOM 73883 H2 WAT 6051 78.725 8.938 119.800 1.00 0.00 H TER 73885 WAT 6051 ATOM 73885 O WAT 6052 93.259 4.382 61.465 1.00 0.00 O ATOM 73886 H1 WAT 6052 93.054 4.444 60.532 1.00 0.00 H ATOM 73887 H2 WAT 6052 92.423 4.541 61.904 1.00 0.00 H TER 73889 WAT 6052 ATOM 73889 O WAT 6053 57.930 55.331 97.782 1.00 0.00 O ATOM 73890 H1 WAT 6053 57.302 55.938 97.389 1.00 0.00 H ATOM 73891 H2 WAT 6053 57.466 54.494 97.814 1.00 0.00 H TER 73893 WAT 6053 ATOM 73893 O WAT 6054 100.932 74.948 132.671 1.00 0.00 O ATOM 73894 H1 WAT 6054 100.192 75.510 132.440 1.00 0.00 H ATOM 73895 H2 WAT 6054 100.591 74.058 132.588 1.00 0.00 H TER 73897 WAT 6054 ATOM 73897 O WAT 6055 115.789 43.725 67.817 1.00 0.00 O ATOM 73898 H1 WAT 6055 116.291 44.514 68.022 1.00 0.00 H ATOM 73899 H2 WAT 6055 115.762 43.239 68.641 1.00 0.00 H TER 73901 WAT 6055 ATOM 73901 O WAT 6056 10.988 78.524 102.560 1.00 0.00 O ATOM 73902 H1 WAT 6056 11.435 78.995 103.263 1.00 0.00 H ATOM 73903 H2 WAT 6056 10.616 79.213 102.009 1.00 0.00 H TER 73905 WAT 6056 ATOM 73905 O WAT 6057 143.973 135.611 85.814 1.00 0.00 O ATOM 73906 H1 WAT 6057 144.059 136.246 86.525 1.00 0.00 H ATOM 73907 H2 WAT 6057 144.274 134.785 86.194 1.00 0.00 H TER 73909 WAT 6057 ATOM 73909 O WAT 6058 18.577 23.935 16.247 1.00 0.00 O ATOM 73910 H1 WAT 6058 17.752 23.451 16.227 1.00 0.00 H ATOM 73911 H2 WAT 6058 18.620 24.299 17.131 1.00 0.00 H TER 73913 WAT 6058 ATOM 73913 O WAT 6059 116.731 54.036 101.763 1.00 0.00 O ATOM 73914 H1 WAT 6059 116.672 54.756 102.390 1.00 0.00 H ATOM 73915 H2 WAT 6059 116.283 53.307 102.192 1.00 0.00 H TER 73917 WAT 6059 ATOM 73917 O WAT 6060 69.168 107.971 131.121 1.00 0.00 O ATOM 73918 H1 WAT 6060 68.759 107.260 131.614 1.00 0.00 H ATOM 73919 H2 WAT 6060 69.968 107.585 130.763 1.00 0.00 H TER 73921 WAT 6060 ATOM 73921 O WAT 6061 107.774 46.710 142.613 1.00 0.00 O ATOM 73922 H1 WAT 6061 108.320 47.041 143.326 1.00 0.00 H ATOM 73923 H2 WAT 6061 106.910 47.085 142.779 1.00 0.00 H TER 73925 WAT 6061 ATOM 73925 O WAT 6062 64.395 114.691 148.677 1.00 0.00 O ATOM 73926 H1 WAT 6062 65.132 114.253 149.101 1.00 0.00 H ATOM 73927 H2 WAT 6062 63.628 114.406 149.174 1.00 0.00 H TER 73929 WAT 6062 ATOM 73929 O WAT 6063 108.300 59.355 104.081 1.00 0.00 O ATOM 73930 H1 WAT 6063 108.910 58.712 104.442 1.00 0.00 H ATOM 73931 H2 WAT 6063 108.860 60.025 103.689 1.00 0.00 H TER 73933 WAT 6063 ATOM 73933 O WAT 6064 27.024 65.826 10.420 1.00 0.00 O ATOM 73934 H1 WAT 6064 26.497 65.327 9.796 1.00 0.00 H ATOM 73935 H2 WAT 6064 27.171 66.669 9.991 1.00 0.00 H TER 73937 WAT 6064 ATOM 73937 O WAT 6065 134.023 83.608 111.466 1.00 0.00 O ATOM 73938 H1 WAT 6065 133.161 83.917 111.184 1.00 0.00 H ATOM 73939 H2 WAT 6065 134.137 82.772 111.014 1.00 0.00 H TER 73941 WAT 6065 ATOM 73941 O WAT 6066 39.496 16.603 63.382 1.00 0.00 O ATOM 73942 H1 WAT 6066 38.899 16.986 62.740 1.00 0.00 H ATOM 73943 H2 WAT 6066 39.305 15.666 63.359 1.00 0.00 H TER 73945 WAT 6066 ATOM 73945 O WAT 6067 93.829 45.035 140.952 1.00 0.00 O ATOM 73946 H1 WAT 6067 93.846 45.746 141.592 1.00 0.00 H ATOM 73947 H2 WAT 6067 94.575 44.483 141.186 1.00 0.00 H TER 73949 WAT 6067 ATOM 73949 O WAT 6068 61.987 88.746 69.893 1.00 0.00 O ATOM 73950 H1 WAT 6068 62.672 88.262 69.433 1.00 0.00 H ATOM 73951 H2 WAT 6068 61.193 88.578 69.387 1.00 0.00 H TER 73953 WAT 6068 ATOM 73953 O WAT 6069 81.645 125.389 22.874 1.00 0.00 O ATOM 73954 H1 WAT 6069 80.717 125.154 22.893 1.00 0.00 H ATOM 73955 H2 WAT 6069 82.100 124.558 22.745 1.00 0.00 H TER 73957 WAT 6069 ATOM 73957 O WAT 6070 67.803 121.650 153.765 1.00 0.00 O ATOM 73958 H1 WAT 6070 68.697 121.849 153.488 1.00 0.00 H ATOM 73959 H2 WAT 6070 67.276 121.764 152.974 1.00 0.00 H TER 73961 WAT 6070 ATOM 73961 O WAT 6071 73.333 47.041 65.023 1.00 0.00 O ATOM 73962 H1 WAT 6071 73.726 47.542 64.309 1.00 0.00 H ATOM 73963 H2 WAT 6071 72.395 47.047 64.831 1.00 0.00 H TER 73965 WAT 6071 ATOM 73965 O WAT 6072 52.761 66.706 6.092 1.00 0.00 O ATOM 73966 H1 WAT 6072 52.350 67.008 5.282 1.00 0.00 H ATOM 73967 H2 WAT 6072 53.604 66.348 5.814 1.00 0.00 H TER 73969 WAT 6072 ATOM 73969 O WAT 6073 73.556 18.732 132.646 1.00 0.00 O ATOM 73970 H1 WAT 6073 73.218 19.610 132.465 1.00 0.00 H ATOM 73971 H2 WAT 6073 73.972 18.809 133.505 1.00 0.00 H TER 73973 WAT 6073 ATOM 73973 O WAT 6074 47.531 94.742 132.496 1.00 0.00 O ATOM 73974 H1 WAT 6074 47.952 95.401 133.047 1.00 0.00 H ATOM 73975 H2 WAT 6074 47.025 94.206 133.106 1.00 0.00 H TER 73977 WAT 6074 ATOM 73977 O WAT 6075 83.829 57.629 139.157 1.00 0.00 O ATOM 73978 H1 WAT 6075 84.402 58.002 139.826 1.00 0.00 H ATOM 73979 H2 WAT 6075 84.265 56.819 138.891 1.00 0.00 H TER 73981 WAT 6075 ATOM 73981 O WAT 6076 26.697 1.493 67.962 1.00 0.00 O ATOM 73982 H1 WAT 6076 26.690 1.922 68.818 1.00 0.00 H ATOM 73983 H2 WAT 6076 25.831 1.093 67.888 1.00 0.00 H TER 73985 WAT 6076 ATOM 73985 O WAT 6077 30.869 69.643 24.942 1.00 0.00 O ATOM 73986 H1 WAT 6077 31.418 69.483 25.710 1.00 0.00 H ATOM 73987 H2 WAT 6077 31.480 69.943 24.269 1.00 0.00 H TER 73989 WAT 6077 ATOM 73989 O WAT 6078 74.963 115.500 141.171 1.00 0.00 O ATOM 73990 H1 WAT 6078 75.317 114.656 140.890 1.00 0.00 H ATOM 73991 H2 WAT 6078 74.836 115.989 140.358 1.00 0.00 H TER 73993 WAT 6078 ATOM 73993 O WAT 6079 113.794 15.403 135.862 1.00 0.00 O ATOM 73994 H1 WAT 6079 112.905 15.468 136.211 1.00 0.00 H ATOM 73995 H2 WAT 6079 114.321 15.103 136.603 1.00 0.00 H TER 73997 WAT 6079 ATOM 73997 O WAT 6080 13.495 71.581 67.474 1.00 0.00 O ATOM 73998 H1 WAT 6080 13.346 71.927 66.593 1.00 0.00 H ATOM 73999 H2 WAT 6080 14.143 70.888 67.353 1.00 0.00 H TER 74001 WAT 6080 ATOM 74001 O WAT 6081 56.917 109.392 65.573 1.00 0.00 O ATOM 74002 H1 WAT 6081 56.473 108.939 64.856 1.00 0.00 H ATOM 74003 H2 WAT 6081 56.620 108.940 66.362 1.00 0.00 H TER 74005 WAT 6081 ATOM 74005 O WAT 6082 101.089 15.790 141.878 1.00 0.00 O ATOM 74006 H1 WAT 6082 100.918 14.860 142.030 1.00 0.00 H ATOM 74007 H2 WAT 6082 101.857 15.983 142.415 1.00 0.00 H TER 74009 WAT 6082 ATOM 74009 O WAT 6083 50.194 143.304 73.031 1.00 0.00 O ATOM 74010 H1 WAT 6083 50.148 144.185 73.402 1.00 0.00 H ATOM 74011 H2 WAT 6083 50.407 142.741 73.776 1.00 0.00 H TER 74013 WAT 6083 ATOM 74013 O WAT 6084 0.640 82.217 82.849 1.00 0.00 O ATOM 74014 H1 WAT 6084 -0.152 81.846 82.461 1.00 0.00 H ATOM 74015 H2 WAT 6084 0.448 83.151 82.939 1.00 0.00 H TER 74017 WAT 6084 ATOM 74017 O WAT 6085 119.447 135.915 91.430 1.00 0.00 O ATOM 74018 H1 WAT 6085 119.512 134.960 91.418 1.00 0.00 H ATOM 74019 H2 WAT 6085 119.613 136.178 90.525 1.00 0.00 H TER 74021 WAT 6085 ATOM 74021 O WAT 6086 56.628 0.957 95.147 1.00 0.00 O ATOM 74022 H1 WAT 6086 56.371 0.951 94.225 1.00 0.00 H ATOM 74023 H2 WAT 6086 56.397 1.834 95.455 1.00 0.00 H TER 74025 WAT 6086 ATOM 74025 O WAT 6087 38.377 104.288 60.211 1.00 0.00 O ATOM 74026 H1 WAT 6087 37.923 103.527 59.848 1.00 0.00 H ATOM 74027 H2 WAT 6087 38.878 104.641 59.476 1.00 0.00 H TER 74029 WAT 6087 ATOM 74029 O WAT 6088 11.364 64.808 94.382 1.00 0.00 O ATOM 74030 H1 WAT 6088 11.525 63.968 94.813 1.00 0.00 H ATOM 74031 H2 WAT 6088 12.235 65.124 94.143 1.00 0.00 H TER 74033 WAT 6088 ATOM 74033 O WAT 6089 41.378 70.511 155.637 1.00 0.00 O ATOM 74034 H1 WAT 6089 41.384 70.881 154.754 1.00 0.00 H ATOM 74035 H2 WAT 6089 40.488 70.176 155.750 1.00 0.00 H TER 74037 WAT 6089 ATOM 74037 O WAT 6090 62.670 77.568 125.294 1.00 0.00 O ATOM 74038 H1 WAT 6090 63.206 77.481 126.082 1.00 0.00 H ATOM 74039 H2 WAT 6090 63.284 77.849 124.616 1.00 0.00 H TER 74041 WAT 6090 ATOM 74041 O WAT 6091 52.082 39.823 92.383 1.00 0.00 O ATOM 74042 H1 WAT 6091 51.289 39.348 92.633 1.00 0.00 H ATOM 74043 H2 WAT 6091 52.573 39.915 93.199 1.00 0.00 H TER 74045 WAT 6091 ATOM 74045 O WAT 6092 5.001 72.499 88.839 1.00 0.00 O ATOM 74046 H1 WAT 6092 4.704 72.270 87.959 1.00 0.00 H ATOM 74047 H2 WAT 6092 5.524 73.292 88.717 1.00 0.00 H TER 74049 WAT 6092 ATOM 74049 O WAT 6093 96.398 20.719 9.379 1.00 0.00 O ATOM 74050 H1 WAT 6093 95.646 20.565 8.807 1.00 0.00 H ATOM 74051 H2 WAT 6093 96.891 21.414 8.944 1.00 0.00 H TER 74053 WAT 6093 ATOM 74053 O WAT 6094 80.710 127.315 5.268 1.00 0.00 O ATOM 74054 H1 WAT 6094 81.251 126.968 5.978 1.00 0.00 H ATOM 74055 H2 WAT 6094 79.822 127.031 5.483 1.00 0.00 H TER 74057 WAT 6094 ATOM 74057 O WAT 6095 32.106 21.434 149.124 1.00 0.00 O ATOM 74058 H1 WAT 6095 33.018 21.148 149.073 1.00 0.00 H ATOM 74059 H2 WAT 6095 31.808 21.448 148.215 1.00 0.00 H TER 74061 WAT 6095 ATOM 74061 O WAT 6096 5.523 135.292 1.307 1.00 0.00 O ATOM 74062 H1 WAT 6096 6.150 135.998 1.148 1.00 0.00 H ATOM 74063 H2 WAT 6096 5.530 135.174 2.256 1.00 0.00 H TER 74065 WAT 6096 ATOM 74065 O WAT 6097 125.094 17.210 79.464 1.00 0.00 O ATOM 74066 H1 WAT 6097 125.319 16.596 80.162 1.00 0.00 H ATOM 74067 H2 WAT 6097 125.036 18.060 79.901 1.00 0.00 H TER 74069 WAT 6097 ATOM 74069 O WAT 6098 69.578 8.659 73.978 1.00 0.00 O ATOM 74070 H1 WAT 6098 69.183 7.986 73.423 1.00 0.00 H ATOM 74071 H2 WAT 6098 68.880 9.301 74.108 1.00 0.00 H TER 74073 WAT 6098 ATOM 74073 O WAT 6099 112.058 6.784 100.121 1.00 0.00 O ATOM 74074 H1 WAT 6099 112.489 6.926 99.277 1.00 0.00 H ATOM 74075 H2 WAT 6099 112.454 7.431 100.704 1.00 0.00 H TER 74077 WAT 6099 ATOM 74077 O WAT 6100 128.424 51.610 118.430 1.00 0.00 O ATOM 74078 H1 WAT 6100 128.341 51.431 117.494 1.00 0.00 H ATOM 74079 H2 WAT 6100 127.644 52.122 118.645 1.00 0.00 H TER 74081 WAT 6100 ATOM 74081 O WAT 6101 40.300 59.399 103.438 1.00 0.00 O ATOM 74082 H1 WAT 6101 41.215 59.278 103.689 1.00 0.00 H ATOM 74083 H2 WAT 6101 40.189 60.349 103.386 1.00 0.00 H TER 74085 WAT 6101 ATOM 74085 O WAT 6102 31.253 125.709 105.788 1.00 0.00 O ATOM 74086 H1 WAT 6102 30.353 126.017 105.686 1.00 0.00 H ATOM 74087 H2 WAT 6102 31.238 125.187 106.591 1.00 0.00 H TER 74089 WAT 6102 ATOM 74089 O WAT 6103 102.650 117.917 94.085 1.00 0.00 O ATOM 74090 H1 WAT 6103 101.734 117.874 94.358 1.00 0.00 H ATOM 74091 H2 WAT 6103 103.006 118.668 94.559 1.00 0.00 H TER 74093 WAT 6103 ATOM 74093 O WAT 6104 101.109 104.061 109.800 1.00 0.00 O ATOM 74094 H1 WAT 6104 100.542 104.170 109.036 1.00 0.00 H ATOM 74095 H2 WAT 6104 100.592 104.397 110.532 1.00 0.00 H TER 74097 WAT 6104 ATOM 74097 O WAT 6105 61.744 43.252 82.481 1.00 0.00 O ATOM 74098 H1 WAT 6105 61.936 42.622 83.176 1.00 0.00 H ATOM 74099 H2 WAT 6105 60.791 43.231 82.395 1.00 0.00 H TER 74101 WAT 6105 ATOM 74101 O WAT 6106 31.179 51.922 58.780 1.00 0.00 O ATOM 74102 H1 WAT 6106 31.313 52.858 58.932 1.00 0.00 H ATOM 74103 H2 WAT 6106 30.792 51.875 57.906 1.00 0.00 H TER 74105 WAT 6106 ATOM 74105 O WAT 6107 74.065 36.885 97.726 1.00 0.00 O ATOM 74106 H1 WAT 6107 73.515 37.136 96.984 1.00 0.00 H ATOM 74107 H2 WAT 6107 74.162 37.688 98.236 1.00 0.00 H TER 74109 WAT 6107 ATOM 74109 O WAT 6108 88.568 138.374 156.574 1.00 0.00 O ATOM 74110 H1 WAT 6108 87.877 137.746 156.363 1.00 0.00 H ATOM 74111 H2 WAT 6108 89.308 138.109 156.027 1.00 0.00 H TER 74113 WAT 6108 ATOM 74113 O WAT 6109 12.592 49.182 109.036 1.00 0.00 O ATOM 74114 H1 WAT 6109 12.475 48.239 108.919 1.00 0.00 H ATOM 74115 H2 WAT 6109 11.733 49.497 109.316 1.00 0.00 H TER 74117 WAT 6109 ATOM 74117 O WAT 6110 44.527 27.747 101.378 1.00 0.00 O ATOM 74118 H1 WAT 6110 44.335 28.140 100.526 1.00 0.00 H ATOM 74119 H2 WAT 6110 45.087 26.998 101.175 1.00 0.00 H TER 74121 WAT 6110 ATOM 74121 O WAT 6111 91.164 69.662 103.767 1.00 0.00 O ATOM 74122 H1 WAT 6111 91.738 70.082 103.126 1.00 0.00 H ATOM 74123 H2 WAT 6111 90.685 69.003 103.264 1.00 0.00 H TER 74125 WAT 6111 ATOM 74125 O WAT 6112 140.616 81.139 98.316 1.00 0.00 O ATOM 74126 H1 WAT 6112 139.793 81.588 98.121 1.00 0.00 H ATOM 74127 H2 WAT 6112 140.399 80.542 99.032 1.00 0.00 H TER 74129 WAT 6112 ATOM 74129 O WAT 6113 103.026 119.522 1.352 1.00 0.00 O ATOM 74130 H1 WAT 6113 102.428 120.058 0.832 1.00 0.00 H ATOM 74131 H2 WAT 6113 103.880 119.938 1.240 1.00 0.00 H TER 74133 WAT 6113 ATOM 74133 O WAT 6114 85.488 36.374 134.137 1.00 0.00 O ATOM 74134 H1 WAT 6114 86.200 35.938 133.669 1.00 0.00 H ATOM 74135 H2 WAT 6114 84.888 36.659 133.448 1.00 0.00 H TER 74137 WAT 6114 ATOM 74137 O WAT 6115 77.824 38.506 67.436 1.00 0.00 O ATOM 74138 H1 WAT 6115 78.440 38.657 68.153 1.00 0.00 H ATOM 74139 H2 WAT 6115 77.136 37.964 67.823 1.00 0.00 H TER 74141 WAT 6115 ATOM 74141 O WAT 6116 64.840 140.073 156.757 1.00 0.00 O ATOM 74142 H1 WAT 6116 65.751 140.311 156.928 1.00 0.00 H ATOM 74143 H2 WAT 6116 64.712 139.255 157.238 1.00 0.00 H TER 74145 WAT 6116 ATOM 74145 O WAT 6117 47.126 82.022 85.007 1.00 0.00 O ATOM 74146 H1 WAT 6117 47.017 81.924 84.061 1.00 0.00 H ATOM 74147 H2 WAT 6117 47.973 81.617 85.194 1.00 0.00 H TER 74149 WAT 6117 ATOM 74149 O WAT 6118 68.691 21.022 85.481 1.00 0.00 O ATOM 74150 H1 WAT 6118 69.418 21.331 86.021 1.00 0.00 H ATOM 74151 H2 WAT 6118 68.882 21.359 84.606 1.00 0.00 H TER 74153 WAT 6118 ATOM 74153 O WAT 6119 130.074 73.807 115.608 1.00 0.00 O ATOM 74154 H1 WAT 6119 129.512 74.503 115.270 1.00 0.00 H ATOM 74155 H2 WAT 6119 130.309 73.292 114.836 1.00 0.00 H TER 74157 WAT 6119 ATOM 74157 O WAT 6120 28.469 34.525 76.364 1.00 0.00 O ATOM 74158 H1 WAT 6120 28.997 35.251 76.694 1.00 0.00 H ATOM 74159 H2 WAT 6120 27.580 34.722 76.660 1.00 0.00 H TER 74161 WAT 6120 ATOM 74161 O WAT 6121 25.670 52.832 149.435 1.00 0.00 O ATOM 74162 H1 WAT 6121 26.206 53.616 149.563 1.00 0.00 H ATOM 74163 H2 WAT 6121 25.680 52.394 150.286 1.00 0.00 H TER 74165 WAT 6121 ATOM 74165 O WAT 6122 78.292 54.008 146.100 1.00 0.00 O ATOM 74166 H1 WAT 6122 77.599 54.663 146.012 1.00 0.00 H ATOM 74167 H2 WAT 6122 79.052 54.503 146.407 1.00 0.00 H TER 74169 WAT 6122 ATOM 74169 O WAT 6123 86.792 102.109 0.443 1.00 0.00 O ATOM 74170 H1 WAT 6123 86.205 102.269 1.182 1.00 0.00 H ATOM 74171 H2 WAT 6123 87.457 102.794 0.513 1.00 0.00 H TER 74173 WAT 6123 ATOM 74173 O WAT 6124 75.174 67.736 93.012 1.00 0.00 O ATOM 74174 H1 WAT 6124 75.137 66.889 92.568 1.00 0.00 H ATOM 74175 H2 WAT 6124 75.773 68.259 92.480 1.00 0.00 H TER 74177 WAT 6124 ATOM 74177 O WAT 6125 98.602 94.313 9.436 1.00 0.00 O ATOM 74178 H1 WAT 6125 98.534 93.359 9.460 1.00 0.00 H ATOM 74179 H2 WAT 6125 99.336 94.487 8.847 1.00 0.00 H TER 74181 WAT 6125 ATOM 74181 O WAT 6126 11.524 121.382 116.040 1.00 0.00 O ATOM 74182 H1 WAT 6126 12.358 120.944 115.871 1.00 0.00 H ATOM 74183 H2 WAT 6126 10.955 120.692 116.379 1.00 0.00 H TER 74185 WAT 6126 ATOM 74185 O WAT 6127 121.959 106.759 111.675 1.00 0.00 O ATOM 74186 H1 WAT 6127 122.856 106.426 111.684 1.00 0.00 H ATOM 74187 H2 WAT 6127 121.464 106.130 112.200 1.00 0.00 H TER 74189 WAT 6127 ATOM 74189 O WAT 6128 75.696 54.251 81.785 1.00 0.00 O ATOM 74190 H1 WAT 6128 74.925 54.621 82.215 1.00 0.00 H ATOM 74191 H2 WAT 6128 75.374 53.945 80.937 1.00 0.00 H TER 74193 WAT 6128 ATOM 74193 O WAT 6129 79.335 112.263 71.973 1.00 0.00 O ATOM 74194 H1 WAT 6129 80.259 112.142 72.194 1.00 0.00 H ATOM 74195 H2 WAT 6129 79.283 112.057 71.040 1.00 0.00 H TER 74197 WAT 6129 ATOM 74197 O WAT 6130 23.941 20.949 154.121 1.00 0.00 O ATOM 74198 H1 WAT 6130 23.005 21.083 154.265 1.00 0.00 H ATOM 74199 H2 WAT 6130 24.016 20.769 153.184 1.00 0.00 H TER 74201 WAT 6130 ATOM 74201 O WAT 6131 20.515 24.198 108.385 1.00 0.00 O ATOM 74202 H1 WAT 6131 20.818 24.702 107.629 1.00 0.00 H ATOM 74203 H2 WAT 6131 20.005 24.823 108.900 1.00 0.00 H TER 74205 WAT 6131 ATOM 74205 O WAT 6132 8.124 10.410 20.200 1.00 0.00 O ATOM 74206 H1 WAT 6132 7.679 9.618 19.899 1.00 0.00 H ATOM 74207 H2 WAT 6132 9.053 10.233 20.053 1.00 0.00 H TER 74209 WAT 6132 ATOM 74209 O WAT 6133 46.041 3.346 84.476 1.00 0.00 O ATOM 74210 H1 WAT 6133 46.138 2.581 83.910 1.00 0.00 H ATOM 74211 H2 WAT 6133 46.732 3.248 85.131 1.00 0.00 H TER 74213 WAT 6133 ATOM 74213 O WAT 6134 19.970 100.770 120.973 1.00 0.00 O ATOM 74214 H1 WAT 6134 19.983 100.490 120.057 1.00 0.00 H ATOM 74215 H2 WAT 6134 19.123 100.470 121.302 1.00 0.00 H TER 74217 WAT 6134 ATOM 74217 O WAT 6135 102.260 110.441 130.883 1.00 0.00 O ATOM 74218 H1 WAT 6135 101.804 111.231 130.591 1.00 0.00 H ATOM 74219 H2 WAT 6135 101.892 109.740 130.345 1.00 0.00 H TER 74221 WAT 6135 ATOM 74221 O WAT 6136 72.836 15.315 148.223 1.00 0.00 O ATOM 74222 H1 WAT 6136 73.203 15.388 147.343 1.00 0.00 H ATOM 74223 H2 WAT 6136 73.500 15.704 148.793 1.00 0.00 H TER 74225 WAT 6136 ATOM 74225 O WAT 6137 43.932 28.299 149.077 1.00 0.00 O ATOM 74226 H1 WAT 6137 44.528 28.786 148.508 1.00 0.00 H ATOM 74227 H2 WAT 6137 43.270 27.945 148.483 1.00 0.00 H TER 74229 WAT 6137 ATOM 74229 O WAT 6138 120.600 124.696 102.968 1.00 0.00 O ATOM 74230 H1 WAT 6138 121.012 125.292 102.343 1.00 0.00 H ATOM 74231 H2 WAT 6138 120.710 125.125 103.816 1.00 0.00 H TER 74233 WAT 6138 ATOM 74233 O WAT 6139 101.487 42.242 128.880 1.00 0.00 O ATOM 74234 H1 WAT 6139 101.510 42.277 129.836 1.00 0.00 H ATOM 74235 H2 WAT 6139 101.998 43.001 128.600 1.00 0.00 H TER 74237 WAT 6139 ATOM 74237 O WAT 6140 120.823 126.205 127.473 1.00 0.00 O ATOM 74238 H1 WAT 6140 121.421 126.490 128.164 1.00 0.00 H ATOM 74239 H2 WAT 6140 120.338 125.477 127.861 1.00 0.00 H TER 74241 WAT 6140 ATOM 74241 O WAT 6141 102.570 4.806 10.253 1.00 0.00 O ATOM 74242 H1 WAT 6141 101.831 5.414 10.233 1.00 0.00 H ATOM 74243 H2 WAT 6141 102.871 4.824 11.161 1.00 0.00 H TER 74245 WAT 6141 ATOM 74245 O WAT 6142 12.566 45.081 63.340 1.00 0.00 O ATOM 74246 H1 WAT 6142 12.503 45.561 62.514 1.00 0.00 H ATOM 74247 H2 WAT 6142 12.490 44.161 63.088 1.00 0.00 H TER 74249 WAT 6142 ATOM 74249 O WAT 6143 119.408 91.550 120.571 1.00 0.00 O ATOM 74250 H1 WAT 6143 119.664 91.776 121.465 1.00 0.00 H ATOM 74251 H2 WAT 6143 120.023 90.865 120.311 1.00 0.00 H TER 74253 WAT 6143 ATOM 74253 O WAT 6144 116.663 73.025 63.268 1.00 0.00 O ATOM 74254 H1 WAT 6144 115.837 73.261 63.691 1.00 0.00 H ATOM 74255 H2 WAT 6144 116.682 72.068 63.298 1.00 0.00 H TER 74257 WAT 6144 ATOM 74257 O WAT 6145 13.595 94.683 85.149 1.00 0.00 O ATOM 74258 H1 WAT 6145 13.375 95.080 85.991 1.00 0.00 H ATOM 74259 H2 WAT 6145 12.749 94.479 84.752 1.00 0.00 H TER 74261 WAT 6145 ATOM 74261 O WAT 6146 13.770 52.709 156.568 1.00 0.00 O ATOM 74262 H1 WAT 6146 13.653 52.265 155.728 1.00 0.00 H ATOM 74263 H2 WAT 6146 14.000 53.608 156.334 1.00 0.00 H TER 74265 WAT 6146 ATOM 74265 O WAT 6147 41.111 89.509 10.033 1.00 0.00 O ATOM 74266 H1 WAT 6147 41.664 88.776 9.761 1.00 0.00 H ATOM 74267 H2 WAT 6147 40.251 89.311 9.661 1.00 0.00 H TER 74269 WAT 6147 ATOM 74269 O WAT 6148 140.047 70.126 85.661 1.00 0.00 O ATOM 74270 H1 WAT 6148 140.088 69.451 84.984 1.00 0.00 H ATOM 74271 H2 WAT 6148 139.830 69.650 86.462 1.00 0.00 H TER 74273 WAT 6148 ATOM 74273 O WAT 6149 78.140 54.901 97.906 1.00 0.00 O ATOM 74274 H1 WAT 6149 77.842 54.821 98.812 1.00 0.00 H ATOM 74275 H2 WAT 6149 79.087 55.019 97.975 1.00 0.00 H TER 74277 WAT 6149 ATOM 74277 O WAT 6150 126.682 54.184 146.526 1.00 0.00 O ATOM 74278 H1 WAT 6150 127.581 54.132 146.202 1.00 0.00 H ATOM 74279 H2 WAT 6150 126.526 53.336 146.940 1.00 0.00 H TER 74281 WAT 6150 ATOM 74281 O WAT 6151 10.627 118.546 129.807 1.00 0.00 O ATOM 74282 H1 WAT 6151 10.464 119.482 129.918 1.00 0.00 H ATOM 74283 H2 WAT 6151 10.848 118.236 130.685 1.00 0.00 H TER 74285 WAT 6151 ATOM 74285 O WAT 6152 31.932 24.069 138.921 1.00 0.00 O ATOM 74286 H1 WAT 6152 31.644 23.714 139.762 1.00 0.00 H ATOM 74287 H2 WAT 6152 31.370 23.640 138.276 1.00 0.00 H TER 74289 WAT 6152 ATOM 74289 O WAT 6153 75.215 129.665 62.979 1.00 0.00 O ATOM 74290 H1 WAT 6153 74.642 129.349 62.281 1.00 0.00 H ATOM 74291 H2 WAT 6153 76.090 129.662 62.591 1.00 0.00 H TER 74293 WAT 6153 ATOM 74293 O WAT 6154 100.687 65.752 139.164 1.00 0.00 O ATOM 74294 H1 WAT 6154 101.508 65.327 138.918 1.00 0.00 H ATOM 74295 H2 WAT 6154 100.824 66.676 138.956 1.00 0.00 H TER 74297 WAT 6154 ATOM 74297 O WAT 6155 113.014 138.571 87.373 1.00 0.00 O ATOM 74298 H1 WAT 6155 112.958 137.646 87.611 1.00 0.00 H ATOM 74299 H2 WAT 6155 112.117 138.814 87.144 1.00 0.00 H TER 74301 WAT 6155 ATOM 74301 O WAT 6156 104.609 122.658 94.233 1.00 0.00 O ATOM 74302 H1 WAT 6156 104.570 123.358 94.885 1.00 0.00 H ATOM 74303 H2 WAT 6156 104.526 123.109 93.392 1.00 0.00 H TER 74305 WAT 6156 ATOM 74305 O WAT 6157 134.230 136.892 81.593 1.00 0.00 O ATOM 74306 H1 WAT 6157 134.990 137.393 81.297 1.00 0.00 H ATOM 74307 H2 WAT 6157 134.119 136.212 80.929 1.00 0.00 H TER 74309 WAT 6157 ATOM 74309 O WAT 6158 115.944 91.125 85.323 1.00 0.00 O ATOM 74310 H1 WAT 6158 115.563 92.003 85.326 1.00 0.00 H ATOM 74311 H2 WAT 6158 115.325 90.593 85.823 1.00 0.00 H TER 74313 WAT 6158 ATOM 74313 O WAT 6159 71.881 34.144 107.100 1.00 0.00 O ATOM 74314 H1 WAT 6159 71.794 34.362 108.028 1.00 0.00 H ATOM 74315 H2 WAT 6159 72.466 33.387 107.085 1.00 0.00 H TER 74317 WAT 6159 ATOM 74317 O WAT 6160 41.630 123.789 18.252 1.00 0.00 O ATOM 74318 H1 WAT 6160 41.281 123.165 18.888 1.00 0.00 H ATOM 74319 H2 WAT 6160 42.294 123.295 17.771 1.00 0.00 H TER 74321 WAT 6160 ATOM 74321 O WAT 6161 16.360 41.036 129.722 1.00 0.00 O ATOM 74322 H1 WAT 6161 15.634 41.478 129.282 1.00 0.00 H ATOM 74323 H2 WAT 6161 16.206 40.105 129.563 1.00 0.00 H TER 74325 WAT 6161 ATOM 74325 O WAT 6162 78.274 110.077 123.833 1.00 0.00 O ATOM 74326 H1 WAT 6162 78.294 109.341 124.444 1.00 0.00 H ATOM 74327 H2 WAT 6162 77.683 109.794 123.136 1.00 0.00 H TER 74329 WAT 6162 ATOM 74329 O WAT 6163 117.375 50.341 83.212 1.00 0.00 O ATOM 74330 H1 WAT 6163 117.840 49.828 82.551 1.00 0.00 H ATOM 74331 H2 WAT 6163 118.004 51.009 83.484 1.00 0.00 H TER 74333 WAT 6163 ATOM 74333 O WAT 6164 33.654 41.939 89.370 1.00 0.00 O ATOM 74334 H1 WAT 6164 34.257 42.644 89.134 1.00 0.00 H ATOM 74335 H2 WAT 6164 32.821 42.193 88.972 1.00 0.00 H TER 74337 WAT 6164 ATOM 74337 O WAT 6165 19.341 21.311 109.167 1.00 0.00 O ATOM 74338 H1 WAT 6165 19.465 20.460 108.746 1.00 0.00 H ATOM 74339 H2 WAT 6165 20.018 21.869 108.784 1.00 0.00 H TER 74341 WAT 6165 ATOM 74341 O WAT 6166 144.138 108.703 136.822 1.00 0.00 O ATOM 74342 H1 WAT 6166 143.969 109.569 136.452 1.00 0.00 H ATOM 74343 H2 WAT 6166 143.991 108.098 136.095 1.00 0.00 H TER 74345 WAT 6166 ATOM 74345 O WAT 6167 34.333 48.973 64.390 1.00 0.00 O ATOM 74346 H1 WAT 6167 34.995 49.138 65.061 1.00 0.00 H ATOM 74347 H2 WAT 6167 33.917 48.154 64.661 1.00 0.00 H TER 74349 WAT 6167 ATOM 74349 O WAT 6168 128.700 117.946 62.533 1.00 0.00 O ATOM 74350 H1 WAT 6168 128.566 118.462 61.738 1.00 0.00 H ATOM 74351 H2 WAT 6168 129.167 118.536 63.125 1.00 0.00 H TER 74353 WAT 6168 ATOM 74353 O WAT 6169 117.991 93.275 119.018 1.00 0.00 O ATOM 74354 H1 WAT 6169 118.685 93.934 119.001 1.00 0.00 H ATOM 74355 H2 WAT 6169 118.349 92.563 119.548 1.00 0.00 H TER 74357 WAT 6169 ATOM 74357 O WAT 6170 44.640 14.118 136.392 1.00 0.00 O ATOM 74358 H1 WAT 6170 45.439 13.953 136.893 1.00 0.00 H ATOM 74359 H2 WAT 6170 44.951 14.431 135.542 1.00 0.00 H TER 74361 WAT 6170 ATOM 74361 O WAT 6171 8.264 101.624 133.002 1.00 0.00 O ATOM 74362 H1 WAT 6171 8.903 101.429 133.689 1.00 0.00 H ATOM 74363 H2 WAT 6171 7.523 102.011 133.468 1.00 0.00 H TER 74365 WAT 6171 ATOM 74365 O WAT 6172 136.501 45.662 9.090 1.00 0.00 O ATOM 74366 H1 WAT 6172 136.600 45.383 10.000 1.00 0.00 H ATOM 74367 H2 WAT 6172 135.704 46.193 9.088 1.00 0.00 H TER 74369 WAT 6172 ATOM 74369 O WAT 6173 93.223 73.970 95.966 1.00 0.00 O ATOM 74370 H1 WAT 6173 92.365 74.026 96.386 1.00 0.00 H ATOM 74371 H2 WAT 6173 93.839 73.868 96.691 1.00 0.00 H TER 74373 WAT 6173 ATOM 74373 O WAT 6174 22.437 120.701 97.080 1.00 0.00 O ATOM 74374 H1 WAT 6174 21.783 120.030 97.279 1.00 0.00 H ATOM 74375 H2 WAT 6174 22.079 121.504 97.460 1.00 0.00 H TER 74377 WAT 6174 ATOM 74377 O WAT 6175 68.117 74.486 12.952 1.00 0.00 O ATOM 74378 H1 WAT 6175 67.909 74.507 12.018 1.00 0.00 H ATOM 74379 H2 WAT 6175 69.065 74.613 12.990 1.00 0.00 H TER 74381 WAT 6175 ATOM 74381 O WAT 6176 32.422 115.525 1.345 1.00 0.00 O ATOM 74382 H1 WAT 6176 32.409 116.273 0.749 1.00 0.00 H ATOM 74383 H2 WAT 6176 32.826 115.863 2.145 1.00 0.00 H TER 74385 WAT 6176 ATOM 74385 O WAT 6177 78.766 54.687 137.636 1.00 0.00 O ATOM 74386 H1 WAT 6177 79.526 55.269 137.627 1.00 0.00 H ATOM 74387 H2 WAT 6177 78.023 55.266 137.807 1.00 0.00 H TER 74389 WAT 6177 ATOM 74389 O WAT 6178 1.590 94.398 68.739 1.00 0.00 O ATOM 74390 H1 WAT 6178 2.414 94.169 68.308 1.00 0.00 H ATOM 74391 H2 WAT 6178 1.830 94.539 69.655 1.00 0.00 H TER 74393 WAT 6178 ATOM 74393 O WAT 6179 126.636 34.907 133.904 1.00 0.00 O ATOM 74394 H1 WAT 6179 125.978 34.621 134.537 1.00 0.00 H ATOM 74395 H2 WAT 6179 127.435 35.015 134.421 1.00 0.00 H TER 74397 WAT 6179 ATOM 74397 O WAT 6180 104.399 125.249 143.973 1.00 0.00 O ATOM 74398 H1 WAT 6180 103.983 125.400 144.822 1.00 0.00 H ATOM 74399 H2 WAT 6180 105.155 125.836 143.969 1.00 0.00 H TER 74401 WAT 6180 ATOM 74401 O WAT 6181 141.934 136.535 125.090 1.00 0.00 O ATOM 74402 H1 WAT 6181 141.168 136.061 124.767 1.00 0.00 H ATOM 74403 H2 WAT 6181 142.609 135.864 125.186 1.00 0.00 H TER 74405 WAT 6181 ATOM 74405 O WAT 6182 95.152 74.188 67.228 1.00 0.00 O ATOM 74406 H1 WAT 6182 95.199 74.643 68.070 1.00 0.00 H ATOM 74407 H2 WAT 6182 95.134 74.890 66.578 1.00 0.00 H TER 74409 WAT 6182 ATOM 74409 O WAT 6183 115.007 129.206 3.252 1.00 0.00 O ATOM 74410 H1 WAT 6183 114.414 128.472 3.089 1.00 0.00 H ATOM 74411 H2 WAT 6183 114.561 129.962 2.870 1.00 0.00 H TER 74413 WAT 6183 ATOM 74413 O WAT 6184 29.270 95.138 8.485 1.00 0.00 O ATOM 74414 H1 WAT 6184 29.986 95.759 8.346 1.00 0.00 H ATOM 74415 H2 WAT 6184 28.587 95.422 7.877 1.00 0.00 H TER 74417 WAT 6184 ATOM 74417 O WAT 6185 140.734 69.517 133.055 1.00 0.00 O ATOM 74418 H1 WAT 6185 141.036 70.246 132.512 1.00 0.00 H ATOM 74419 H2 WAT 6185 141.535 69.143 133.420 1.00 0.00 H TER 74421 WAT 6185 ATOM 74421 O WAT 6186 116.071 21.298 6.741 1.00 0.00 O ATOM 74422 H1 WAT 6186 115.744 21.197 7.635 1.00 0.00 H ATOM 74423 H2 WAT 6186 116.979 21.583 6.848 1.00 0.00 H TER 74425 WAT 6186 ATOM 74425 O WAT 6187 17.611 32.292 138.970 1.00 0.00 O ATOM 74426 H1 WAT 6187 16.737 31.919 138.855 1.00 0.00 H ATOM 74427 H2 WAT 6187 17.599 33.096 138.451 1.00 0.00 H TER 74429 WAT 6187 ATOM 74429 O WAT 6188 138.705 9.194 112.838 1.00 0.00 O ATOM 74430 H1 WAT 6188 138.019 8.689 112.402 1.00 0.00 H ATOM 74431 H2 WAT 6188 138.925 9.887 112.215 1.00 0.00 H TER 74433 WAT 6188 ATOM 74433 O WAT 6189 91.522 27.543 126.790 1.00 0.00 O ATOM 74434 H1 WAT 6189 92.393 27.505 127.185 1.00 0.00 H ATOM 74435 H2 WAT 6189 90.966 27.041 127.386 1.00 0.00 H TER 74437 WAT 6189 ATOM 74437 O WAT 6190 119.698 105.982 158.738 1.00 0.00 O ATOM 74438 H1 WAT 6190 120.112 105.144 158.533 1.00 0.00 H ATOM 74439 H2 WAT 6190 119.866 106.527 157.969 1.00 0.00 H TER 74441 WAT 6190 ATOM 74441 O WAT 6191 81.991 60.767 134.585 1.00 0.00 O ATOM 74442 H1 WAT 6191 82.124 59.913 134.174 1.00 0.00 H ATOM 74443 H2 WAT 6191 82.167 61.399 133.888 1.00 0.00 H TER 74445 WAT 6191 ATOM 74445 O WAT 6192 41.225 145.315 5.178 1.00 0.00 O ATOM 74446 H1 WAT 6192 41.154 145.091 4.250 1.00 0.00 H ATOM 74447 H2 WAT 6192 40.332 145.229 5.514 1.00 0.00 H TER 74449 WAT 6192 ATOM 74449 O WAT 6193 73.199 41.496 123.807 1.00 0.00 O ATOM 74450 H1 WAT 6193 73.030 41.776 124.707 1.00 0.00 H ATOM 74451 H2 WAT 6193 73.078 40.547 123.825 1.00 0.00 H TER 74453 WAT 6193 ATOM 74453 O WAT 6194 90.562 140.673 139.264 1.00 0.00 O ATOM 74454 H1 WAT 6194 91.326 140.659 138.688 1.00 0.00 H ATOM 74455 H2 WAT 6194 90.175 139.803 139.169 1.00 0.00 H TER 74457 WAT 6194 ATOM 74457 O WAT 6195 31.025 33.862 67.427 1.00 0.00 O ATOM 74458 H1 WAT 6195 31.651 34.575 67.305 1.00 0.00 H ATOM 74459 H2 WAT 6195 31.183 33.275 66.688 1.00 0.00 H TER 74461 WAT 6195 ATOM 74461 O WAT 6196 94.586 74.684 89.030 1.00 0.00 O ATOM 74462 H1 WAT 6196 95.072 74.677 88.206 1.00 0.00 H ATOM 74463 H2 WAT 6196 94.973 75.402 89.530 1.00 0.00 H TER 74465 WAT 6196 ATOM 74465 O WAT 6197 129.605 16.193 74.812 1.00 0.00 O ATOM 74466 H1 WAT 6197 129.957 16.682 75.556 1.00 0.00 H ATOM 74467 H2 WAT 6197 130.322 15.619 74.542 1.00 0.00 H TER 74469 WAT 6197 ATOM 74469 O WAT 6198 93.366 84.238 122.062 1.00 0.00 O ATOM 74470 H1 WAT 6198 93.665 84.283 121.154 1.00 0.00 H ATOM 74471 H2 WAT 6198 92.702 84.924 122.130 1.00 0.00 H TER 74473 WAT 6198 ATOM 74473 O WAT 6199 0.903 97.451 151.272 1.00 0.00 O ATOM 74474 H1 WAT 6199 1.853 97.556 151.216 1.00 0.00 H ATOM 74475 H2 WAT 6199 0.759 96.512 151.157 1.00 0.00 H TER 74477 WAT 6199 ATOM 74477 O WAT 6200 142.934 120.737 154.106 1.00 0.00 O ATOM 74478 H1 WAT 6200 142.524 121.371 154.695 1.00 0.00 H ATOM 74479 H2 WAT 6200 143.614 121.235 153.653 1.00 0.00 H TER 74481 WAT 6200 ATOM 74481 O WAT 6201 101.559 54.409 137.079 1.00 0.00 O ATOM 74482 H1 WAT 6201 101.367 53.600 136.606 1.00 0.00 H ATOM 74483 H2 WAT 6201 102.476 54.593 136.878 1.00 0.00 H TER 74485 WAT 6201 ATOM 74485 O WAT 6202 141.699 127.678 86.210 1.00 0.00 O ATOM 74486 H1 WAT 6202 142.081 127.048 86.821 1.00 0.00 H ATOM 74487 H2 WAT 6202 142.306 128.418 86.218 1.00 0.00 H TER 74489 WAT 6202 ATOM 74489 O WAT 6203 113.809 94.049 91.598 1.00 0.00 O ATOM 74490 H1 WAT 6203 114.518 94.691 91.567 1.00 0.00 H ATOM 74491 H2 WAT 6203 114.032 93.413 90.917 1.00 0.00 H TER 74493 WAT 6203 ATOM 74493 O WAT 6204 6.229 111.087 123.056 1.00 0.00 O ATOM 74494 H1 WAT 6204 6.986 110.800 123.567 1.00 0.00 H ATOM 74495 H2 WAT 6204 5.527 110.488 123.309 1.00 0.00 H TER 74497 WAT 6204 ATOM 74497 O WAT 6205 84.732 36.902 74.800 1.00 0.00 O ATOM 74498 H1 WAT 6205 83.925 36.633 75.238 1.00 0.00 H ATOM 74499 H2 WAT 6205 85.400 36.866 75.485 1.00 0.00 H TER 74501 WAT 6205 ATOM 74501 O WAT 6206 117.417 139.797 101.384 1.00 0.00 O ATOM 74502 H1 WAT 6206 116.724 139.157 101.226 1.00 0.00 H ATOM 74503 H2 WAT 6206 116.953 140.615 101.560 1.00 0.00 H TER 74505 WAT 6206 ATOM 74505 O WAT 6207 139.280 61.708 144.610 1.00 0.00 O ATOM 74506 H1 WAT 6207 138.783 60.916 144.403 1.00 0.00 H ATOM 74507 H2 WAT 6207 139.643 61.989 143.771 1.00 0.00 H TER 74509 WAT 6207 ATOM 74509 O WAT 6208 58.983 121.265 148.901 1.00 0.00 O ATOM 74510 H1 WAT 6208 58.952 122.157 149.246 1.00 0.00 H ATOM 74511 H2 WAT 6208 59.566 121.320 148.144 1.00 0.00 H TER 74513 WAT 6208 ATOM 74513 O WAT 6209 103.988 34.236 146.247 1.00 0.00 O ATOM 74514 H1 WAT 6209 104.167 34.260 145.307 1.00 0.00 H ATOM 74515 H2 WAT 6209 104.659 33.654 146.603 1.00 0.00 H TER 74517 WAT 6209 ATOM 74517 O WAT 6210 30.988 65.625 61.670 1.00 0.00 O ATOM 74518 H1 WAT 6210 31.132 66.030 60.815 1.00 0.00 H ATOM 74519 H2 WAT 6210 30.550 64.797 61.472 1.00 0.00 H TER 74521 WAT 6210 ATOM 74521 O WAT 6211 113.574 50.470 85.403 1.00 0.00 O ATOM 74522 H1 WAT 6211 114.130 50.884 84.743 1.00 0.00 H ATOM 74523 H2 WAT 6211 113.363 51.176 86.015 1.00 0.00 H TER 74525 WAT 6211 ATOM 74525 O WAT 6212 122.309 134.156 16.149 1.00 0.00 O ATOM 74526 H1 WAT 6212 122.907 134.252 16.890 1.00 0.00 H ATOM 74527 H2 WAT 6212 122.504 133.289 15.793 1.00 0.00 H TER 74529 WAT 6212 ATOM 74529 O WAT 6213 49.459 66.918 77.247 1.00 0.00 O ATOM 74530 H1 WAT 6213 49.267 66.139 77.769 1.00 0.00 H ATOM 74531 H2 WAT 6213 48.639 67.109 76.792 1.00 0.00 H TER 74533 WAT 6213 ATOM 74533 O WAT 6214 123.046 127.700 144.635 1.00 0.00 O ATOM 74534 H1 WAT 6214 122.570 127.013 145.102 1.00 0.00 H ATOM 74535 H2 WAT 6214 123.471 128.209 145.326 1.00 0.00 H TER 74537 WAT 6214 ATOM 74537 O WAT 6215 103.120 52.663 16.812 1.00 0.00 O ATOM 74538 H1 WAT 6215 102.229 52.834 16.505 1.00 0.00 H ATOM 74539 H2 WAT 6215 103.681 52.971 16.101 1.00 0.00 H TER 74541 WAT 6215 ATOM 74541 O WAT 6216 123.741 28.888 26.513 1.00 0.00 O ATOM 74542 H1 WAT 6216 123.559 29.658 27.052 1.00 0.00 H ATOM 74543 H2 WAT 6216 124.047 28.228 27.135 1.00 0.00 H TER 74545 WAT 6216 ATOM 74545 O WAT 6217 8.012 20.791 126.092 1.00 0.00 O ATOM 74546 H1 WAT 6217 8.232 21.387 126.808 1.00 0.00 H ATOM 74547 H2 WAT 6217 7.145 21.072 125.802 1.00 0.00 H TER 74549 WAT 6217 ATOM 74549 O WAT 6218 29.799 40.675 84.599 1.00 0.00 O ATOM 74550 H1 WAT 6218 29.872 40.610 83.647 1.00 0.00 H ATOM 74551 H2 WAT 6218 29.193 41.402 84.744 1.00 0.00 H TER 74553 WAT 6218 ATOM 74553 O WAT 6219 99.775 7.569 86.728 1.00 0.00 O ATOM 74554 H1 WAT 6219 100.089 6.683 86.547 1.00 0.00 H ATOM 74555 H2 WAT 6219 99.219 7.473 87.502 1.00 0.00 H TER 74557 WAT 6219 ATOM 74557 O WAT 6220 57.476 60.598 59.184 1.00 0.00 O ATOM 74558 H1 WAT 6220 56.804 61.030 59.711 1.00 0.00 H ATOM 74559 H2 WAT 6220 57.041 60.404 58.354 1.00 0.00 H TER 74561 WAT 6220 ATOM 74561 O WAT 6221 47.738 105.849 103.014 1.00 0.00 O ATOM 74562 H1 WAT 6221 46.949 105.316 102.918 1.00 0.00 H ATOM 74563 H2 WAT 6221 47.601 106.336 103.826 1.00 0.00 H TER 74565 WAT 6221 ATOM 74565 O WAT 6222 11.398 8.970 10.361 1.00 0.00 O ATOM 74566 H1 WAT 6222 11.605 8.294 9.715 1.00 0.00 H ATOM 74567 H2 WAT 6222 11.994 8.795 11.089 1.00 0.00 H TER 74569 WAT 6222 ATOM 74569 O WAT 6223 43.850 109.167 130.266 1.00 0.00 O ATOM 74570 H1 WAT 6223 44.553 109.769 130.508 1.00 0.00 H ATOM 74571 H2 WAT 6223 43.199 109.268 130.960 1.00 0.00 H TER 74573 WAT 6223 ATOM 74573 O WAT 6224 105.952 22.428 75.778 1.00 0.00 O ATOM 74574 H1 WAT 6224 105.413 21.637 75.805 1.00 0.00 H ATOM 74575 H2 WAT 6224 105.388 23.089 75.377 1.00 0.00 H TER 74577 WAT 6224 ATOM 74577 O WAT 6225 132.825 14.742 54.399 1.00 0.00 O ATOM 74578 H1 WAT 6225 133.477 15.395 54.146 1.00 0.00 H ATOM 74579 H2 WAT 6225 133.291 13.907 54.350 1.00 0.00 H TER 74581 WAT 6225 ATOM 74581 O WAT 6226 96.960 124.662 8.409 1.00 0.00 O ATOM 74582 H1 WAT 6226 96.564 123.948 7.910 1.00 0.00 H ATOM 74583 H2 WAT 6226 96.978 124.341 9.311 1.00 0.00 H TER 74585 WAT 6226 ATOM 74585 O WAT 6227 20.604 10.225 13.979 1.00 0.00 O ATOM 74586 H1 WAT 6227 21.422 9.859 13.645 1.00 0.00 H ATOM 74587 H2 WAT 6227 20.730 11.173 13.934 1.00 0.00 H TER 74589 WAT 6227 ATOM 74589 O WAT 6228 86.813 141.037 74.153 1.00 0.00 O ATOM 74590 H1 WAT 6228 85.879 141.216 74.263 1.00 0.00 H ATOM 74591 H2 WAT 6228 86.951 140.203 74.604 1.00 0.00 H TER 74593 WAT 6228 ATOM 74593 O WAT 6229 83.733 81.637 66.461 1.00 0.00 O ATOM 74594 H1 WAT 6229 83.158 81.082 66.988 1.00 0.00 H ATOM 74595 H2 WAT 6229 83.487 81.444 65.556 1.00 0.00 H TER 74597 WAT 6229 ATOM 74597 O WAT 6230 82.553 78.404 140.428 1.00 0.00 O ATOM 74598 H1 WAT 6230 83.200 78.511 139.732 1.00 0.00 H ATOM 74599 H2 WAT 6230 82.091 77.596 140.203 1.00 0.00 H TER 74601 WAT 6230 ATOM 74601 O WAT 6231 79.407 10.699 120.414 1.00 0.00 O ATOM 74602 H1 WAT 6231 79.294 11.197 119.605 1.00 0.00 H ATOM 74603 H2 WAT 6231 78.799 11.103 121.032 1.00 0.00 H TER 74605 WAT 6231 ATOM 74605 O WAT 6232 14.743 12.968 130.366 1.00 0.00 O ATOM 74606 H1 WAT 6232 14.326 12.278 130.881 1.00 0.00 H ATOM 74607 H2 WAT 6232 15.669 12.727 130.347 1.00 0.00 H TER 74609 WAT 6232 ATOM 74609 O WAT 6233 66.140 68.240 83.460 1.00 0.00 O ATOM 74610 H1 WAT 6233 66.568 68.968 83.911 1.00 0.00 H ATOM 74611 H2 WAT 6233 66.818 67.878 82.890 1.00 0.00 H TER 74613 WAT 6233 ATOM 74613 O WAT 6234 137.486 29.244 62.210 1.00 0.00 O ATOM 74614 H1 WAT 6234 137.653 29.860 62.923 1.00 0.00 H ATOM 74615 H2 WAT 6234 136.853 29.692 61.649 1.00 0.00 H TER 74617 WAT 6234 ATOM 74617 O WAT 6235 17.630 32.679 156.337 1.00 0.00 O ATOM 74618 H1 WAT 6235 18.136 32.334 155.601 1.00 0.00 H ATOM 74619 H2 WAT 6235 17.832 32.090 157.064 1.00 0.00 H TER 74621 WAT 6235 ATOM 74621 O WAT 6236 43.467 73.666 144.474 1.00 0.00 O ATOM 74622 H1 WAT 6236 43.374 72.739 144.695 1.00 0.00 H ATOM 74623 H2 WAT 6236 42.950 73.775 143.676 1.00 0.00 H TER 74625 WAT 6236 ATOM 74625 O WAT 6237 62.859 50.983 87.882 1.00 0.00 O ATOM 74626 H1 WAT 6237 62.761 50.140 88.324 1.00 0.00 H ATOM 74627 H2 WAT 6237 62.949 51.617 88.594 1.00 0.00 H TER 74629 WAT 6237 ATOM 74629 O WAT 6238 77.963 52.573 148.332 1.00 0.00 O ATOM 74630 H1 WAT 6238 78.801 52.125 148.219 1.00 0.00 H ATOM 74631 H2 WAT 6238 77.944 53.227 147.633 1.00 0.00 H TER 74633 WAT 6238 ATOM 74633 O WAT 6239 42.304 77.338 17.258 1.00 0.00 O ATOM 74634 H1 WAT 6239 43.183 77.053 17.005 1.00 0.00 H ATOM 74635 H2 WAT 6239 41.923 76.577 17.696 1.00 0.00 H TER 74637 WAT 6239 ATOM 74637 O WAT 6240 143.178 105.373 13.802 1.00 0.00 O ATOM 74638 H1 WAT 6240 143.307 105.774 12.942 1.00 0.00 H ATOM 74639 H2 WAT 6240 142.435 104.783 13.682 1.00 0.00 H TER 74641 WAT 6240 ATOM 74641 O WAT 6241 56.436 103.832 104.694 1.00 0.00 O ATOM 74642 H1 WAT 6241 57.206 104.176 104.242 1.00 0.00 H ATOM 74643 H2 WAT 6241 56.007 103.274 104.046 1.00 0.00 H TER 74645 WAT 6241 ATOM 74645 O WAT 6242 8.599 52.998 111.799 1.00 0.00 O ATOM 74646 H1 WAT 6242 8.151 53.241 112.609 1.00 0.00 H ATOM 74647 H2 WAT 6242 9.405 52.572 112.090 1.00 0.00 H TER 74649 WAT 6242 ATOM 74649 O WAT 6243 139.195 53.258 147.543 1.00 0.00 O ATOM 74650 H1 WAT 6243 138.793 52.449 147.861 1.00 0.00 H ATOM 74651 H2 WAT 6243 139.836 53.487 148.216 1.00 0.00 H TER 74653 WAT 6243 ATOM 74653 O WAT 6244 10.382 17.603 86.740 1.00 0.00 O ATOM 74654 H1 WAT 6244 10.171 17.846 85.838 1.00 0.00 H ATOM 74655 H2 WAT 6244 10.790 16.740 86.667 1.00 0.00 H TER 74657 WAT 6244 ATOM 74657 O WAT 6245 57.825 134.746 92.015 1.00 0.00 O ATOM 74658 H1 WAT 6245 57.167 135.147 91.447 1.00 0.00 H ATOM 74659 H2 WAT 6245 58.631 135.226 91.826 1.00 0.00 H TER 74661 WAT 6245 ATOM 74661 O WAT 6246 17.573 11.981 86.233 1.00 0.00 O ATOM 74662 H1 WAT 6246 18.427 11.548 86.223 1.00 0.00 H ATOM 74663 H2 WAT 6246 17.012 11.394 86.739 1.00 0.00 H TER 74665 WAT 6246 ATOM 74665 O WAT 6247 16.419 55.044 134.099 1.00 0.00 O ATOM 74666 H1 WAT 6247 17.228 55.185 134.591 1.00 0.00 H ATOM 74667 H2 WAT 6247 16.713 54.800 133.221 1.00 0.00 H TER 74669 WAT 6247 ATOM 74669 O WAT 6248 86.964 27.163 116.822 1.00 0.00 O ATOM 74670 H1 WAT 6248 87.720 27.411 116.290 1.00 0.00 H ATOM 74671 H2 WAT 6248 86.212 27.290 116.243 1.00 0.00 H TER 74673 WAT 6248 ATOM 74673 O WAT 6249 88.776 135.123 74.924 1.00 0.00 O ATOM 74674 H1 WAT 6249 88.538 135.871 74.375 1.00 0.00 H ATOM 74675 H2 WAT 6249 89.500 134.705 74.457 1.00 0.00 H TER 74677 WAT 6249 ATOM 74677 O WAT 6250 4.101 10.772 89.440 1.00 0.00 O ATOM 74678 H1 WAT 6250 4.507 10.632 88.584 1.00 0.00 H ATOM 74679 H2 WAT 6250 3.551 11.546 89.321 1.00 0.00 H TER 74681 WAT 6250 ATOM 74681 O WAT 6251 111.571 54.325 60.415 1.00 0.00 O ATOM 74682 H1 WAT 6251 110.816 54.738 60.835 1.00 0.00 H ATOM 74683 H2 WAT 6251 112.199 54.194 61.126 1.00 0.00 H TER 74685 WAT 6251 ATOM 74685 O WAT 6252 14.360 108.379 69.724 1.00 0.00 O ATOM 74686 H1 WAT 6252 13.418 108.386 69.893 1.00 0.00 H ATOM 74687 H2 WAT 6252 14.629 109.292 69.831 1.00 0.00 H TER 74689 WAT 6252 ATOM 74689 O WAT 6253 113.003 92.813 20.171 1.00 0.00 O ATOM 74690 H1 WAT 6253 113.609 93.484 20.484 1.00 0.00 H ATOM 74691 H2 WAT 6253 113.448 91.985 20.352 1.00 0.00 H TER 74693 WAT 6253 ATOM 74693 O WAT 6254 50.966 4.244 140.091 1.00 0.00 O ATOM 74694 H1 WAT 6254 51.037 5.178 139.891 1.00 0.00 H ATOM 74695 H2 WAT 6254 51.255 3.805 139.291 1.00 0.00 H TER 74697 WAT 6254 ATOM 74697 O WAT 6255 106.866 9.309 62.396 1.00 0.00 O ATOM 74698 H1 WAT 6255 107.409 8.654 61.959 1.00 0.00 H ATOM 74699 H2 WAT 6255 106.295 9.647 61.706 1.00 0.00 H TER 74701 WAT 6255 ATOM 74701 O WAT 6256 65.497 51.950 129.638 1.00 0.00 O ATOM 74702 H1 WAT 6256 66.058 52.465 129.058 1.00 0.00 H ATOM 74703 H2 WAT 6256 65.442 51.092 129.217 1.00 0.00 H TER 74705 WAT 6256 ATOM 74705 O WAT 6257 64.204 105.033 82.665 1.00 0.00 O ATOM 74706 H1 WAT 6257 64.024 104.583 81.839 1.00 0.00 H ATOM 74707 H2 WAT 6257 63.573 104.662 83.282 1.00 0.00 H TER 74709 WAT 6257 ATOM 74709 O WAT 6258 35.139 24.377 139.749 1.00 0.00 O ATOM 74710 H1 WAT 6258 35.154 23.902 138.919 1.00 0.00 H ATOM 74711 H2 WAT 6258 34.670 25.188 139.553 1.00 0.00 H TER 74713 WAT 6258 ATOM 74713 O WAT 6259 13.140 42.324 87.648 1.00 0.00 O ATOM 74714 H1 WAT 6259 12.973 41.547 88.182 1.00 0.00 H ATOM 74715 H2 WAT 6259 13.865 42.071 87.077 1.00 0.00 H TER 74717 WAT 6259 ATOM 74717 O WAT 6260 25.660 60.540 52.641 1.00 0.00 O ATOM 74718 H1 WAT 6260 24.919 60.903 52.155 1.00 0.00 H ATOM 74719 H2 WAT 6260 25.312 60.371 53.517 1.00 0.00 H TER 74721 WAT 6260 ATOM 74721 O WAT 6261 64.513 28.569 83.992 1.00 0.00 O ATOM 74722 H1 WAT 6261 64.776 28.778 84.889 1.00 0.00 H ATOM 74723 H2 WAT 6261 64.715 29.361 83.493 1.00 0.00 H TER 74725 WAT 6261 ATOM 74725 O WAT 6262 134.407 56.416 133.767 1.00 0.00 O ATOM 74726 H1 WAT 6262 134.411 57.310 134.109 1.00 0.00 H ATOM 74727 H2 WAT 6262 133.567 56.336 133.315 1.00 0.00 H TER 74729 WAT 6262 ATOM 74729 O WAT 6263 128.465 9.329 67.757 1.00 0.00 O ATOM 74730 H1 WAT 6263 129.252 9.822 67.526 1.00 0.00 H ATOM 74731 H2 WAT 6263 128.643 8.438 67.454 1.00 0.00 H TER 74733 WAT 6263 ATOM 74733 O WAT 6264 22.250 22.947 3.924 1.00 0.00 O ATOM 74734 H1 WAT 6264 21.295 22.889 3.959 1.00 0.00 H ATOM 74735 H2 WAT 6264 22.484 23.500 4.670 1.00 0.00 H TER 74737 WAT 6264 ATOM 74737 O WAT 6265 70.529 43.131 146.436 1.00 0.00 O ATOM 74738 H1 WAT 6265 69.734 43.164 146.968 1.00 0.00 H ATOM 74739 H2 WAT 6265 71.106 43.788 146.826 1.00 0.00 H TER 74741 WAT 6265 ATOM 74741 O WAT 6266 125.900 70.204 104.159 1.00 0.00 O ATOM 74742 H1 WAT 6266 125.746 69.756 104.991 1.00 0.00 H ATOM 74743 H2 WAT 6266 126.394 70.989 104.398 1.00 0.00 H TER 74745 WAT 6266 ATOM 74745 O WAT 6267 32.508 29.632 153.809 1.00 0.00 O ATOM 74746 H1 WAT 6267 32.101 28.821 153.506 1.00 0.00 H ATOM 74747 H2 WAT 6267 31.773 30.223 153.971 1.00 0.00 H TER 74749 WAT 6267 ATOM 74749 O WAT 6268 132.415 100.458 101.874 1.00 0.00 O ATOM 74750 H1 WAT 6268 132.957 101.175 102.203 1.00 0.00 H ATOM 74751 H2 WAT 6268 133.004 99.703 101.852 1.00 0.00 H TER 74753 WAT 6268 ATOM 74753 O WAT 6269 40.932 118.772 155.095 1.00 0.00 O ATOM 74754 H1 WAT 6269 40.261 118.623 155.761 1.00 0.00 H ATOM 74755 H2 WAT 6269 41.626 118.150 155.311 1.00 0.00 H TER 74757 WAT 6269 ATOM 74757 O WAT 6270 47.657 140.310 133.854 1.00 0.00 O ATOM 74758 H1 WAT 6270 47.172 140.806 134.514 1.00 0.00 H ATOM 74759 H2 WAT 6270 47.566 139.397 134.126 1.00 0.00 H TER 74761 WAT 6270 ATOM 74761 O WAT 6271 108.108 24.090 88.531 1.00 0.00 O ATOM 74762 H1 WAT 6271 107.637 23.774 89.302 1.00 0.00 H ATOM 74763 H2 WAT 6271 108.517 23.308 88.163 1.00 0.00 H TER 74765 WAT 6271 ATOM 74765 O WAT 6272 45.523 119.749 116.126 1.00 0.00 O ATOM 74766 H1 WAT 6272 46.417 119.792 115.788 1.00 0.00 H ATOM 74767 H2 WAT 6272 45.617 119.876 117.070 1.00 0.00 H TER 74769 WAT 6272 ATOM 74769 O WAT 6273 53.419 31.324 107.150 1.00 0.00 O ATOM 74770 H1 WAT 6273 53.523 32.070 107.741 1.00 0.00 H ATOM 74771 H2 WAT 6273 52.576 31.472 106.723 1.00 0.00 H TER 74773 WAT 6273 ATOM 74773 O WAT 6274 16.223 120.575 126.534 1.00 0.00 O ATOM 74774 H1 WAT 6274 15.724 121.388 126.614 1.00 0.00 H ATOM 74775 H2 WAT 6274 16.930 120.664 127.173 1.00 0.00 H TER 74777 WAT 6274 ATOM 74777 O WAT 6275 43.349 130.856 94.915 1.00 0.00 O ATOM 74778 H1 WAT 6275 43.378 131.724 95.317 1.00 0.00 H ATOM 74779 H2 WAT 6275 43.441 131.023 93.977 1.00 0.00 H TER 74781 WAT 6275 ATOM 74781 O WAT 6276 123.809 7.827 20.035 1.00 0.00 O ATOM 74782 H1 WAT 6276 123.163 8.160 20.658 1.00 0.00 H ATOM 74783 H2 WAT 6276 124.191 7.065 20.469 1.00 0.00 H TER 74785 WAT 6276 ATOM 74785 O WAT 6277 118.746 46.116 63.868 1.00 0.00 O ATOM 74786 H1 WAT 6277 118.063 46.157 64.538 1.00 0.00 H ATOM 74787 H2 WAT 6277 118.388 46.611 63.131 1.00 0.00 H TER 74789 WAT 6277 ATOM 74789 O WAT 6278 98.583 130.426 5.643 1.00 0.00 O ATOM 74790 H1 WAT 6278 99.467 130.744 5.458 1.00 0.00 H ATOM 74791 H2 WAT 6278 98.260 130.110 4.799 1.00 0.00 H TER 74793 WAT 6278 ATOM 74793 O WAT 6279 135.566 0.193 96.789 1.00 0.00 O ATOM 74794 H1 WAT 6279 135.180 0.669 97.524 1.00 0.00 H ATOM 74795 H2 WAT 6279 136.043 0.860 96.295 1.00 0.00 H TER 74797 WAT 6279 ATOM 74797 O WAT 6280 41.000 117.022 61.689 1.00 0.00 O ATOM 74798 H1 WAT 6280 41.311 117.554 60.956 1.00 0.00 H ATOM 74799 H2 WAT 6280 41.031 117.611 62.443 1.00 0.00 H TER 74801 WAT 6280 ATOM 74801 O WAT 6281 66.398 65.352 109.046 1.00 0.00 O ATOM 74802 H1 WAT 6281 66.625 65.363 109.976 1.00 0.00 H ATOM 74803 H2 WAT 6281 65.441 65.362 109.034 1.00 0.00 H TER 74805 WAT 6281 ATOM 74805 O WAT 6282 44.065 53.359 0.314 1.00 0.00 O ATOM 74806 H1 WAT 6282 43.673 54.200 0.076 1.00 0.00 H ATOM 74807 H2 WAT 6282 43.405 52.934 0.860 1.00 0.00 H TER 74809 WAT 6282 ATOM 74809 O WAT 6283 108.622 17.083 92.170 1.00 0.00 O ATOM 74810 H1 WAT 6283 109.156 16.454 92.655 1.00 0.00 H ATOM 74811 H2 WAT 6283 108.386 16.624 91.363 1.00 0.00 H TER 74813 WAT 6283 ATOM 74813 O WAT 6284 144.918 76.332 1.923 1.00 0.00 O ATOM 74814 H1 WAT 6284 144.838 77.055 1.302 1.00 0.00 H ATOM 74815 H2 WAT 6284 144.180 75.757 1.719 1.00 0.00 H TER 74817 WAT 6284 ATOM 74817 O WAT 6285 99.273 117.542 117.097 1.00 0.00 O ATOM 74818 H1 WAT 6285 99.930 116.962 117.483 1.00 0.00 H ATOM 74819 H2 WAT 6285 98.446 117.075 117.208 1.00 0.00 H TER 74821 WAT 6285 ATOM 74821 O WAT 6286 6.246 37.907 120.821 1.00 0.00 O ATOM 74822 H1 WAT 6286 5.652 37.331 120.341 1.00 0.00 H ATOM 74823 H2 WAT 6286 5.777 38.116 121.629 1.00 0.00 H TER 74825 WAT 6286 ATOM 74825 O WAT 6287 61.381 112.091 11.420 1.00 0.00 O ATOM 74826 H1 WAT 6287 61.717 112.021 12.314 1.00 0.00 H ATOM 74827 H2 WAT 6287 61.606 112.981 11.149 1.00 0.00 H TER 74829 WAT 6287 ATOM 74829 O WAT 6288 134.160 40.872 85.724 1.00 0.00 O ATOM 74830 H1 WAT 6288 134.383 40.372 84.939 1.00 0.00 H ATOM 74831 H2 WAT 6288 133.222 41.045 85.640 1.00 0.00 H TER 74833 WAT 6288 ATOM 74833 O WAT 6289 15.281 71.125 92.215 1.00 0.00 O ATOM 74834 H1 WAT 6289 16.056 71.677 92.317 1.00 0.00 H ATOM 74835 H2 WAT 6289 15.584 70.244 92.433 1.00 0.00 H TER 74837 WAT 6289 ATOM 74837 O WAT 6290 37.544 17.705 88.676 1.00 0.00 O ATOM 74838 H1 WAT 6290 38.295 17.969 88.145 1.00 0.00 H ATOM 74839 H2 WAT 6290 37.927 17.225 89.411 1.00 0.00 H TER 74841 WAT 6290 ATOM 74841 O WAT 6291 81.084 25.510 64.115 1.00 0.00 O ATOM 74842 H1 WAT 6291 81.424 25.157 63.293 1.00 0.00 H ATOM 74843 H2 WAT 6291 80.164 25.245 64.127 1.00 0.00 H TER 74845 WAT 6291 ATOM 74845 O WAT 6292 73.318 99.007 89.032 1.00 0.00 O ATOM 74846 H1 WAT 6292 72.812 98.858 88.233 1.00 0.00 H ATOM 74847 H2 WAT 6292 73.339 99.959 89.127 1.00 0.00 H TER 74849 WAT 6292 ATOM 74849 O WAT 6293 31.649 74.478 151.340 1.00 0.00 O ATOM 74850 H1 WAT 6293 31.485 74.644 150.412 1.00 0.00 H ATOM 74851 H2 WAT 6293 31.041 73.774 151.569 1.00 0.00 H TER 74853 WAT 6293 ATOM 74853 O WAT 6294 48.964 142.093 132.238 1.00 0.00 O ATOM 74854 H1 WAT 6294 49.551 142.576 132.819 1.00 0.00 H ATOM 74855 H2 WAT 6294 48.537 141.453 132.807 1.00 0.00 H TER 74857 WAT 6294 ATOM 74857 O WAT 6295 145.930 141.680 108.473 1.00 0.00 O ATOM 74858 H1 WAT 6295 144.980 141.658 108.356 1.00 0.00 H ATOM 74859 H2 WAT 6295 146.182 142.567 108.217 1.00 0.00 H TER 74861 WAT 6295 ATOM 74861 O WAT 6296 114.194 100.635 148.306 1.00 0.00 O ATOM 74862 H1 WAT 6296 114.548 101.516 148.185 1.00 0.00 H ATOM 74863 H2 WAT 6296 113.522 100.738 148.980 1.00 0.00 H TER 74865 WAT 6296 ATOM 74865 O WAT 6297 93.476 41.214 109.122 1.00 0.00 O ATOM 74866 H1 WAT 6297 94.169 41.873 109.080 1.00 0.00 H ATOM 74867 H2 WAT 6297 92.900 41.425 108.388 1.00 0.00 H TER 74869 WAT 6297 ATOM 74869 O WAT 6298 133.078 81.542 143.091 1.00 0.00 O ATOM 74870 H1 WAT 6298 132.286 81.147 142.726 1.00 0.00 H ATOM 74871 H2 WAT 6298 133.297 82.246 142.481 1.00 0.00 H TER 74873 WAT 6298 ATOM 74873 O WAT 6299 9.635 78.828 95.174 1.00 0.00 O ATOM 74874 H1 WAT 6299 10.548 79.117 95.178 1.00 0.00 H ATOM 74875 H2 WAT 6299 9.683 77.879 95.294 1.00 0.00 H TER 74877 WAT 6299 ATOM 74877 O WAT 6300 46.472 99.568 156.371 1.00 0.00 O ATOM 74878 H1 WAT 6300 46.114 99.520 155.484 1.00 0.00 H ATOM 74879 H2 WAT 6300 47.276 100.079 156.278 1.00 0.00 H TER 74881 WAT 6300 ATOM 74881 O WAT 6301 119.880 56.067 90.760 1.00 0.00 O ATOM 74882 H1 WAT 6301 119.179 55.899 91.389 1.00 0.00 H ATOM 74883 H2 WAT 6301 119.855 55.316 90.166 1.00 0.00 H TER 74885 WAT 6301 ATOM 74885 O WAT 6302 48.458 65.183 111.631 1.00 0.00 O ATOM 74886 H1 WAT 6302 47.631 65.627 111.446 1.00 0.00 H ATOM 74887 H2 WAT 6302 48.953 65.808 112.161 1.00 0.00 H TER 74889 WAT 6302 ATOM 74889 O WAT 6303 109.523 106.836 130.231 1.00 0.00 O ATOM 74890 H1 WAT 6303 109.098 106.146 130.740 1.00 0.00 H ATOM 74891 H2 WAT 6303 108.807 107.411 129.961 1.00 0.00 H TER 74893 WAT 6303 ATOM 74893 O WAT 6304 116.415 5.339 110.443 1.00 0.00 O ATOM 74894 H1 WAT 6304 115.673 5.612 110.983 1.00 0.00 H ATOM 74895 H2 WAT 6304 117.008 6.090 110.454 1.00 0.00 H TER 74897 WAT 6304 ATOM 74897 O WAT 6305 21.028 94.523 5.937 1.00 0.00 O ATOM 74898 H1 WAT 6305 21.050 95.372 6.379 1.00 0.00 H ATOM 74899 H2 WAT 6305 20.976 93.884 6.648 1.00 0.00 H TER 74901 WAT 6305 ATOM 74901 O WAT 6306 64.068 95.940 67.878 1.00 0.00 O ATOM 74902 H1 WAT 6306 64.160 96.019 66.929 1.00 0.00 H ATOM 74903 H2 WAT 6306 63.658 95.085 68.009 1.00 0.00 H TER 74905 WAT 6306 ATOM 74905 O WAT 6307 8.195 50.332 146.613 1.00 0.00 O ATOM 74906 H1 WAT 6307 7.821 49.502 146.909 1.00 0.00 H ATOM 74907 H2 WAT 6307 8.814 50.086 145.926 1.00 0.00 H TER 74909 WAT 6307 ATOM 74909 O WAT 6308 18.310 58.943 96.021 1.00 0.00 O ATOM 74910 H1 WAT 6308 18.563 58.043 95.814 1.00 0.00 H ATOM 74911 H2 WAT 6308 18.193 58.947 96.970 1.00 0.00 H TER 74913 WAT 6308 ATOM 74913 O WAT 6309 62.350 138.152 124.062 1.00 0.00 O ATOM 74914 H1 WAT 6309 61.815 137.788 123.357 1.00 0.00 H ATOM 74915 H2 WAT 6309 62.668 138.986 123.715 1.00 0.00 H TER 74917 WAT 6309 ATOM 74917 O WAT 6310 136.865 19.040 55.688 1.00 0.00 O ATOM 74918 H1 WAT 6310 136.080 18.555 55.944 1.00 0.00 H ATOM 74919 H2 WAT 6310 137.590 18.453 55.903 1.00 0.00 H TER 74921 WAT 6310 ATOM 74921 O WAT 6311 108.239 65.850 106.734 1.00 0.00 O ATOM 74922 H1 WAT 6311 108.874 65.273 106.310 1.00 0.00 H ATOM 74923 H2 WAT 6311 107.390 65.557 106.403 1.00 0.00 H TER 74925 WAT 6311 ATOM 74925 O WAT 6312 41.461 53.772 94.647 1.00 0.00 O ATOM 74926 H1 WAT 6312 41.335 53.189 93.898 1.00 0.00 H ATOM 74927 H2 WAT 6312 40.930 53.386 95.343 1.00 0.00 H TER 74929 WAT 6312 ATOM 74929 O WAT 6313 30.211 144.955 80.586 1.00 0.00 O ATOM 74930 H1 WAT 6313 31.142 145.175 80.549 1.00 0.00 H ATOM 74931 H2 WAT 6313 30.179 144.129 81.068 1.00 0.00 H TER 74933 WAT 6313 ATOM 74933 O WAT 6314 65.344 137.694 119.657 1.00 0.00 O ATOM 74934 H1 WAT 6314 65.172 137.526 118.731 1.00 0.00 H ATOM 74935 H2 WAT 6314 66.293 137.610 119.744 1.00 0.00 H TER 74937 WAT 6314 ATOM 74937 O WAT 6315 28.341 54.114 134.932 1.00 0.00 O ATOM 74938 H1 WAT 6315 28.859 54.918 134.960 1.00 0.00 H ATOM 74939 H2 WAT 6315 27.442 54.403 135.090 1.00 0.00 H TER 74941 WAT 6315 ATOM 74941 O WAT 6316 134.482 41.107 154.138 1.00 0.00 O ATOM 74942 H1 WAT 6316 134.851 41.598 154.872 1.00 0.00 H ATOM 74943 H2 WAT 6316 134.085 41.774 153.578 1.00 0.00 H TER 74945 WAT 6316 ATOM 74945 O WAT 6317 113.359 66.672 146.477 1.00 0.00 O ATOM 74946 H1 WAT 6317 112.618 66.376 145.949 1.00 0.00 H ATOM 74947 H2 WAT 6317 112.957 67.106 147.230 1.00 0.00 H TER 74949 WAT 6317 ATOM 74949 O WAT 6318 119.957 68.284 157.387 1.00 0.00 O ATOM 74950 H1 WAT 6318 120.778 68.188 156.904 1.00 0.00 H ATOM 74951 H2 WAT 6318 119.450 67.507 157.153 1.00 0.00 H TER 74953 WAT 6318 ATOM 74953 O WAT 6319 95.179 26.260 118.852 1.00 0.00 O ATOM 74954 H1 WAT 6319 94.822 25.373 118.808 1.00 0.00 H ATOM 74955 H2 WAT 6319 96.120 26.133 118.974 1.00 0.00 H TER 74957 WAT 6319 ATOM 74957 O WAT 6320 1.531 143.774 20.236 1.00 0.00 O ATOM 74958 H1 WAT 6320 1.519 144.586 20.742 1.00 0.00 H ATOM 74959 H2 WAT 6320 2.374 143.372 20.448 1.00 0.00 H TER 74961 WAT 6320 ATOM 74961 O WAT 6321 92.485 76.146 77.708 1.00 0.00 O ATOM 74962 H1 WAT 6321 92.088 76.589 78.458 1.00 0.00 H ATOM 74963 H2 WAT 6321 93.087 75.511 78.096 1.00 0.00 H TER 74965 WAT 6321 ATOM 74965 O WAT 6322 144.021 25.300 70.863 1.00 0.00 O ATOM 74966 H1 WAT 6322 143.667 26.169 70.670 1.00 0.00 H ATOM 74967 H2 WAT 6322 143.963 25.225 71.815 1.00 0.00 H TER 74969 WAT 6322 ATOM 74969 O WAT 6323 127.020 123.792 87.604 1.00 0.00 O ATOM 74970 H1 WAT 6323 126.733 124.630 87.967 1.00 0.00 H ATOM 74971 H2 WAT 6323 127.976 123.839 87.622 1.00 0.00 H TER 74973 WAT 6323 ATOM 74973 O WAT 6324 85.169 63.267 109.508 1.00 0.00 O ATOM 74974 H1 WAT 6324 84.936 63.199 110.434 1.00 0.00 H ATOM 74975 H2 WAT 6324 84.344 63.128 109.042 1.00 0.00 H TER 74977 WAT 6324 ATOM 74977 O WAT 6325 113.386 64.059 87.980 1.00 0.00 O ATOM 74978 H1 WAT 6325 113.077 64.956 88.110 1.00 0.00 H ATOM 74979 H2 WAT 6325 114.231 64.158 87.542 1.00 0.00 H TER 74981 WAT 6325 ATOM 74981 O WAT 6326 126.067 11.770 66.580 1.00 0.00 O ATOM 74982 H1 WAT 6326 125.999 10.918 67.010 1.00 0.00 H ATOM 74983 H2 WAT 6326 125.272 11.835 66.051 1.00 0.00 H TER 74985 WAT 6326 ATOM 74985 O WAT 6327 70.852 141.376 94.805 1.00 0.00 O ATOM 74986 H1 WAT 6327 71.655 141.728 95.189 1.00 0.00 H ATOM 74987 H2 WAT 6327 70.152 141.714 95.364 1.00 0.00 H TER 74989 WAT 6327 ATOM 74989 O WAT 6328 139.422 133.837 60.235 1.00 0.00 O ATOM 74990 H1 WAT 6328 139.552 132.930 60.513 1.00 0.00 H ATOM 74991 H2 WAT 6328 138.511 134.028 60.460 1.00 0.00 H TER 74993 WAT 6328 ATOM 74993 O WAT 6329 144.731 71.435 70.129 1.00 0.00 O ATOM 74994 H1 WAT 6329 144.292 71.998 70.766 1.00 0.00 H ATOM 74995 H2 WAT 6329 145.326 70.899 70.652 1.00 0.00 H TER 74997 WAT 6329 ATOM 74997 O WAT 6330 145.577 59.264 123.490 1.00 0.00 O ATOM 74998 H1 WAT 6330 145.396 58.354 123.723 1.00 0.00 H ATOM 74999 H2 WAT 6330 146.527 59.350 123.579 1.00 0.00 H TER 75001 WAT 6330 ATOM 75001 O WAT 6331 4.720 141.487 82.263 1.00 0.00 O ATOM 75002 H1 WAT 6331 4.331 141.143 83.067 1.00 0.00 H ATOM 75003 H2 WAT 6331 4.851 140.716 81.711 1.00 0.00 H TER 75005 WAT 6331 ATOM 75005 O WAT 6332 66.486 2.880 90.986 1.00 0.00 O ATOM 75006 H1 WAT 6332 65.636 2.802 91.419 1.00 0.00 H ATOM 75007 H2 WAT 6332 67.069 3.224 91.662 1.00 0.00 H TER 75009 WAT 6332 ATOM 75009 O WAT 6333 68.577 100.729 130.959 1.00 0.00 O ATOM 75010 H1 WAT 6333 68.253 100.944 131.834 1.00 0.00 H ATOM 75011 H2 WAT 6333 69.309 100.132 131.113 1.00 0.00 H TER 75013 WAT 6333 ATOM 75013 O WAT 6334 93.476 74.555 102.920 1.00 0.00 O ATOM 75014 H1 WAT 6334 92.873 74.938 103.558 1.00 0.00 H ATOM 75015 H2 WAT 6334 94.162 75.214 102.814 1.00 0.00 H TER 75017 WAT 6334 ATOM 75017 O WAT 6335 67.965 50.841 20.674 1.00 0.00 O ATOM 75018 H1 WAT 6335 67.744 50.071 20.151 1.00 0.00 H ATOM 75019 H2 WAT 6335 67.703 50.609 21.565 1.00 0.00 H TER 75021 WAT 6335 ATOM 75021 O WAT 6336 40.336 89.852 12.643 1.00 0.00 O ATOM 75022 H1 WAT 6336 40.716 89.848 11.765 1.00 0.00 H ATOM 75023 H2 WAT 6336 41.091 89.913 13.230 1.00 0.00 H TER 75025 WAT 6336 ATOM 75025 O WAT 6337 128.958 14.469 1.336 1.00 0.00 O ATOM 75026 H1 WAT 6337 129.601 14.722 1.999 1.00 0.00 H ATOM 75027 H2 WAT 6337 129.440 14.504 0.510 1.00 0.00 H TER 75029 WAT 6337 ATOM 75029 O WAT 6338 63.874 45.523 105.773 1.00 0.00 O ATOM 75030 H1 WAT 6338 64.624 45.366 105.199 1.00 0.00 H ATOM 75031 H2 WAT 6338 63.234 45.965 105.216 1.00 0.00 H TER 75033 WAT 6338 ATOM 75033 O WAT 6339 130.551 112.912 128.777 1.00 0.00 O ATOM 75034 H1 WAT 6339 130.888 113.695 129.212 1.00 0.00 H ATOM 75035 H2 WAT 6339 129.874 113.239 128.184 1.00 0.00 H TER 75037 WAT 6339 ATOM 75037 O WAT 6340 9.459 24.179 126.790 1.00 0.00 O ATOM 75038 H1 WAT 6340 8.925 24.372 126.019 1.00 0.00 H ATOM 75039 H2 WAT 6340 8.841 24.196 127.520 1.00 0.00 H TER 75041 WAT 6340 ATOM 75041 O WAT 6341 71.911 69.383 129.344 1.00 0.00 O ATOM 75042 H1 WAT 6341 72.756 69.250 128.915 1.00 0.00 H ATOM 75043 H2 WAT 6341 71.642 68.507 129.621 1.00 0.00 H TER 75045 WAT 6341 ATOM 75045 O WAT 6342 89.800 61.858 5.806 1.00 0.00 O ATOM 75046 H1 WAT 6342 90.369 62.559 6.123 1.00 0.00 H ATOM 75047 H2 WAT 6342 89.823 61.943 4.853 1.00 0.00 H TER 75049 WAT 6342 ATOM 75049 O WAT 6343 98.489 82.420 75.933 1.00 0.00 O ATOM 75050 H1 WAT 6343 98.597 83.334 75.672 1.00 0.00 H ATOM 75051 H2 WAT 6343 98.368 81.947 75.110 1.00 0.00 H TER 75053 WAT 6343 ATOM 75053 O WAT 6344 137.755 125.959 135.976 1.00 0.00 O ATOM 75054 H1 WAT 6344 138.160 125.216 135.529 1.00 0.00 H ATOM 75055 H2 WAT 6344 138.436 126.631 135.990 1.00 0.00 H TER 75057 WAT 6344 ATOM 75057 O WAT 6345 134.882 143.920 78.843 1.00 0.00 O ATOM 75058 H1 WAT 6345 135.457 143.181 78.644 1.00 0.00 H ATOM 75059 H2 WAT 6345 135.297 144.353 79.589 1.00 0.00 H TER 75061 WAT 6345 ATOM 75061 O WAT 6346 100.159 73.267 69.608 1.00 0.00 O ATOM 75062 H1 WAT 6346 100.247 73.884 70.335 1.00 0.00 H ATOM 75063 H2 WAT 6346 100.011 72.420 70.029 1.00 0.00 H TER 75065 WAT 6346 ATOM 75065 O WAT 6347 119.739 41.039 104.952 1.00 0.00 O ATOM 75066 H1 WAT 6347 119.700 41.158 105.901 1.00 0.00 H ATOM 75067 H2 WAT 6347 120.358 41.705 104.652 1.00 0.00 H TER 75069 WAT 6347 ATOM 75069 O WAT 6348 25.585 62.478 79.351 1.00 0.00 O ATOM 75070 H1 WAT 6348 24.906 61.804 79.345 1.00 0.00 H ATOM 75071 H2 WAT 6348 25.926 62.468 80.245 1.00 0.00 H TER 75073 WAT 6348 ATOM 75073 O WAT 6349 37.646 29.824 151.139 1.00 0.00 O ATOM 75074 H1 WAT 6349 36.717 29.649 151.287 1.00 0.00 H ATOM 75075 H2 WAT 6349 37.857 29.339 150.341 1.00 0.00 H TER 75077 WAT 6349 ATOM 75077 O WAT 6350 110.560 67.253 18.673 1.00 0.00 O ATOM 75078 H1 WAT 6350 110.526 68.189 18.473 1.00 0.00 H ATOM 75079 H2 WAT 6350 110.792 67.216 19.601 1.00 0.00 H TER 75081 WAT 6350 ATOM 75081 O WAT 6351 103.617 10.307 155.511 1.00 0.00 O ATOM 75082 H1 WAT 6351 104.216 10.079 156.222 1.00 0.00 H ATOM 75083 H2 WAT 6351 102.912 9.663 155.576 1.00 0.00 H TER 75085 WAT 6351 ATOM 75085 O WAT 6352 85.498 124.971 134.499 1.00 0.00 O ATOM 75086 H1 WAT 6352 85.381 124.551 135.351 1.00 0.00 H ATOM 75087 H2 WAT 6352 85.824 124.274 133.931 1.00 0.00 H TER 75089 WAT 6352 ATOM 75089 O WAT 6353 3.973 132.050 85.688 1.00 0.00 O ATOM 75090 H1 WAT 6353 3.159 131.800 86.126 1.00 0.00 H ATOM 75091 H2 WAT 6353 4.585 131.345 85.900 1.00 0.00 H TER 75093 WAT 6353 ATOM 75093 O WAT 6354 141.445 89.380 1.665 1.00 0.00 O ATOM 75094 H1 WAT 6354 140.917 88.670 1.298 1.00 0.00 H ATOM 75095 H2 WAT 6354 142.332 89.024 1.703 1.00 0.00 H TER 75097 WAT 6354 ATOM 75097 O WAT 6355 70.506 10.348 52.907 1.00 0.00 O ATOM 75098 H1 WAT 6355 70.534 9.706 52.197 1.00 0.00 H ATOM 75099 H2 WAT 6355 70.270 11.170 52.478 1.00 0.00 H TER 75101 WAT 6355 ATOM 75101 O WAT 6356 64.918 140.352 65.311 1.00 0.00 O ATOM 75102 H1 WAT 6356 64.974 140.084 64.394 1.00 0.00 H ATOM 75103 H2 WAT 6356 63.981 140.466 65.470 1.00 0.00 H TER 75105 WAT 6356 ATOM 75105 O WAT 6357 91.494 43.416 125.014 1.00 0.00 O ATOM 75106 H1 WAT 6357 91.071 43.882 124.293 1.00 0.00 H ATOM 75107 H2 WAT 6357 91.710 44.100 125.648 1.00 0.00 H TER 75109 WAT 6357 ATOM 75109 O WAT 6358 85.673 127.905 65.726 1.00 0.00 O ATOM 75110 H1 WAT 6358 86.018 128.684 66.163 1.00 0.00 H ATOM 75111 H2 WAT 6358 86.439 127.347 65.592 1.00 0.00 H TER 75113 WAT 6358 ATOM 75113 O WAT 6359 77.094 29.570 80.242 1.00 0.00 O ATOM 75114 H1 WAT 6359 78.032 29.506 80.423 1.00 0.00 H ATOM 75115 H2 WAT 6359 76.798 30.311 80.772 1.00 0.00 H TER 75117 WAT 6359 ATOM 75117 O WAT 6360 4.819 86.067 93.059 1.00 0.00 O ATOM 75118 H1 WAT 6360 5.437 85.782 92.386 1.00 0.00 H ATOM 75119 H2 WAT 6360 4.825 87.023 92.999 1.00 0.00 H TER 75121 WAT 6360 ATOM 75121 O WAT 6361 6.591 120.428 152.571 1.00 0.00 O ATOM 75122 H1 WAT 6361 6.095 120.806 151.845 1.00 0.00 H ATOM 75123 H2 WAT 6361 6.536 121.083 153.266 1.00 0.00 H TER 75125 WAT 6361 ATOM 75125 O WAT 6362 58.075 51.323 99.502 1.00 0.00 O ATOM 75126 H1 WAT 6362 57.779 51.880 98.782 1.00 0.00 H ATOM 75127 H2 WAT 6362 58.945 51.657 99.721 1.00 0.00 H TER 75129 WAT 6362 ATOM 75129 O WAT 6363 93.027 94.600 96.400 1.00 0.00 O ATOM 75130 H1 WAT 6363 92.622 94.979 95.620 1.00 0.00 H ATOM 75131 H2 WAT 6363 92.822 93.667 96.347 1.00 0.00 H TER 75133 WAT 6363 ATOM 75133 O WAT 6364 5.306 41.432 1.160 1.00 0.00 O ATOM 75134 H1 WAT 6364 5.251 41.564 0.214 1.00 0.00 H ATOM 75135 H2 WAT 6364 5.248 40.483 1.273 1.00 0.00 H TER 75137 WAT 6364 ATOM 75137 O WAT 6365 49.681 26.637 115.142 1.00 0.00 O ATOM 75138 H1 WAT 6365 50.389 27.246 114.931 1.00 0.00 H ATOM 75139 H2 WAT 6365 49.916 25.830 114.684 1.00 0.00 H TER 75141 WAT 6365 ATOM 75141 O WAT 6366 42.559 107.158 119.514 1.00 0.00 O ATOM 75142 H1 WAT 6366 41.735 107.556 119.796 1.00 0.00 H ATOM 75143 H2 WAT 6366 43.107 107.899 119.255 1.00 0.00 H TER 75145 WAT 6366 ATOM 75145 O WAT 6367 108.910 73.090 94.457 1.00 0.00 O ATOM 75146 H1 WAT 6367 108.022 73.151 94.810 1.00 0.00 H ATOM 75147 H2 WAT 6367 108.787 73.006 93.511 1.00 0.00 H TER 75149 WAT 6367 ATOM 75149 O WAT 6368 51.011 50.549 139.044 1.00 0.00 O ATOM 75150 H1 WAT 6368 50.944 51.007 139.882 1.00 0.00 H ATOM 75151 H2 WAT 6368 51.940 50.334 138.963 1.00 0.00 H TER 75153 WAT 6368 ATOM 75153 O WAT 6369 25.917 70.562 155.194 1.00 0.00 O ATOM 75154 H1 WAT 6369 26.228 70.953 156.010 1.00 0.00 H ATOM 75155 H2 WAT 6369 26.554 69.875 155.000 1.00 0.00 H TER 75157 WAT 6369 ATOM 75157 O WAT 6370 144.923 35.515 9.625 1.00 0.00 O ATOM 75158 H1 WAT 6370 145.811 35.725 9.913 1.00 0.00 H ATOM 75159 H2 WAT 6370 144.376 35.684 10.392 1.00 0.00 H TER 75161 WAT 6370 ATOM 75161 O WAT 6371 13.571 50.150 117.707 1.00 0.00 O ATOM 75162 H1 WAT 6371 12.800 50.702 117.838 1.00 0.00 H ATOM 75163 H2 WAT 6371 13.306 49.524 117.034 1.00 0.00 H TER 75165 WAT 6371 ATOM 75165 O WAT 6372 25.042 20.376 81.386 1.00 0.00 O ATOM 75166 H1 WAT 6372 25.898 20.759 81.193 1.00 0.00 H ATOM 75167 H2 WAT 6372 24.416 20.966 80.967 1.00 0.00 H TER 75169 WAT 6372 ATOM 75169 O WAT 6373 95.926 2.998 73.086 1.00 0.00 O ATOM 75170 H1 WAT 6373 95.654 2.397 73.780 1.00 0.00 H ATOM 75171 H2 WAT 6373 96.625 2.532 72.627 1.00 0.00 H TER 75173 WAT 6373 ATOM 75173 O WAT 6374 36.881 18.724 96.517 1.00 0.00 O ATOM 75174 H1 WAT 6374 37.588 18.107 96.706 1.00 0.00 H ATOM 75175 H2 WAT 6374 36.972 19.404 97.184 1.00 0.00 H TER 75177 WAT 6374 ATOM 75177 O WAT 6375 78.128 81.380 99.782 1.00 0.00 O ATOM 75178 H1 WAT 6375 78.383 80.713 99.145 1.00 0.00 H ATOM 75179 H2 WAT 6375 78.165 82.203 99.294 1.00 0.00 H TER 75181 WAT 6375 ATOM 75181 O WAT 6376 83.352 124.488 55.960 1.00 0.00 O ATOM 75182 H1 WAT 6376 83.808 123.869 55.389 1.00 0.00 H ATOM 75183 H2 WAT 6376 82.655 123.972 56.365 1.00 0.00 H TER 75185 WAT 6376 ATOM 75185 O WAT 6377 19.577 13.977 114.950 1.00 0.00 O ATOM 75186 H1 WAT 6377 20.454 13.947 114.567 1.00 0.00 H ATOM 75187 H2 WAT 6377 19.384 13.068 115.177 1.00 0.00 H TER 75189 WAT 6377 ATOM 75189 O WAT 6378 139.175 48.011 151.199 1.00 0.00 O ATOM 75190 H1 WAT 6378 139.031 48.871 150.803 1.00 0.00 H ATOM 75191 H2 WAT 6378 138.676 47.408 150.648 1.00 0.00 H TER 75193 WAT 6378 ATOM 75193 O WAT 6379 6.170 21.797 23.960 1.00 0.00 O ATOM 75194 H1 WAT 6379 7.121 21.795 24.070 1.00 0.00 H ATOM 75195 H2 WAT 6379 6.013 21.205 23.225 1.00 0.00 H TER 75197 WAT 6379 ATOM 75197 O WAT 6380 13.987 9.530 62.348 1.00 0.00 O ATOM 75198 H1 WAT 6380 14.906 9.632 62.102 1.00 0.00 H ATOM 75199 H2 WAT 6380 13.895 8.599 62.551 1.00 0.00 H TER 75201 WAT 6380 ATOM 75201 O WAT 6381 14.227 12.175 75.891 1.00 0.00 O ATOM 75202 H1 WAT 6381 15.156 12.348 75.738 1.00 0.00 H ATOM 75203 H2 WAT 6381 13.805 13.029 75.795 1.00 0.00 H TER 75205 WAT 6381 ATOM 75205 O WAT 6382 56.293 64.908 109.945 1.00 0.00 O ATOM 75206 H1 WAT 6382 55.781 64.163 109.629 1.00 0.00 H ATOM 75207 H2 WAT 6382 55.729 65.667 109.795 1.00 0.00 H TER 75209 WAT 6382 ATOM 75209 O WAT 6383 82.842 109.606 61.928 1.00 0.00 O ATOM 75210 H1 WAT 6383 83.321 110.334 61.533 1.00 0.00 H ATOM 75211 H2 WAT 6383 83.368 109.358 62.689 1.00 0.00 H TER 75213 WAT 6383 ATOM 75213 O WAT 6384 50.939 77.467 96.765 1.00 0.00 O ATOM 75214 H1 WAT 6384 50.076 77.161 96.487 1.00 0.00 H ATOM 75215 H2 WAT 6384 51.511 77.277 96.021 1.00 0.00 H TER 75217 WAT 6384 ATOM 75217 O WAT 6385 106.007 94.927 97.990 1.00 0.00 O ATOM 75218 H1 WAT 6385 106.187 95.315 98.846 1.00 0.00 H ATOM 75219 H2 WAT 6385 105.222 95.380 97.682 1.00 0.00 H TER 75221 WAT 6385 ATOM 75221 O WAT 6386 68.482 121.252 87.690 1.00 0.00 O ATOM 75222 H1 WAT 6386 68.630 121.783 86.908 1.00 0.00 H ATOM 75223 H2 WAT 6386 68.368 121.889 88.395 1.00 0.00 H TER 75225 WAT 6386 ATOM 75225 O WAT 6387 120.225 136.619 88.833 1.00 0.00 O ATOM 75226 H1 WAT 6387 119.951 136.805 87.935 1.00 0.00 H ATOM 75227 H2 WAT 6387 120.933 137.242 89.000 1.00 0.00 H TER 75229 WAT 6387 ATOM 75229 O WAT 6388 123.235 6.357 75.216 1.00 0.00 O ATOM 75230 H1 WAT 6388 123.535 5.898 74.432 1.00 0.00 H ATOM 75231 H2 WAT 6388 122.294 6.184 75.250 1.00 0.00 H TER 75233 WAT 6388 ATOM 75233 O WAT 6389 23.709 60.424 58.478 1.00 0.00 O ATOM 75234 H1 WAT 6389 23.393 61.318 58.345 1.00 0.00 H ATOM 75235 H2 WAT 6389 24.639 60.463 58.257 1.00 0.00 H TER 75237 WAT 6389 ATOM 75237 O WAT 6390 39.151 30.000 128.845 1.00 0.00 O ATOM 75238 H1 WAT 6390 39.990 30.332 129.163 1.00 0.00 H ATOM 75239 H2 WAT 6390 39.213 30.064 127.892 1.00 0.00 H TER 75241 WAT 6390 ATOM 75241 O WAT 6391 15.629 3.620 11.157 1.00 0.00 O ATOM 75242 H1 WAT 6391 15.402 2.690 11.152 1.00 0.00 H ATOM 75243 H2 WAT 6391 16.178 3.737 10.381 1.00 0.00 H TER 75245 WAT 6391 ATOM 75245 O WAT 6392 87.716 107.200 5.800 1.00 0.00 O ATOM 75246 H1 WAT 6392 87.115 106.459 5.877 1.00 0.00 H ATOM 75247 H2 WAT 6392 88.586 106.800 5.771 1.00 0.00 H TER 75249 WAT 6392 ATOM 75249 O WAT 6393 94.096 84.671 6.372 1.00 0.00 O ATOM 75250 H1 WAT 6393 94.854 85.128 6.736 1.00 0.00 H ATOM 75251 H2 WAT 6393 93.355 85.248 6.558 1.00 0.00 H TER 75253 WAT 6393 ATOM 75253 O WAT 6394 70.838 63.296 141.192 1.00 0.00 O ATOM 75254 H1 WAT 6394 70.152 63.366 140.528 1.00 0.00 H ATOM 75255 H2 WAT 6394 70.580 62.542 141.723 1.00 0.00 H TER 75257 WAT 6394 ATOM 75257 O WAT 6395 97.668 48.747 68.709 1.00 0.00 O ATOM 75258 H1 WAT 6395 97.153 47.990 68.428 1.00 0.00 H ATOM 75259 H2 WAT 6395 97.862 48.576 69.630 1.00 0.00 H TER 75261 WAT 6395 ATOM 75261 O WAT 6396 142.920 115.368 75.033 1.00 0.00 O ATOM 75262 H1 WAT 6396 143.170 114.451 74.924 1.00 0.00 H ATOM 75263 H2 WAT 6396 143.724 115.803 75.318 1.00 0.00 H TER 75265 WAT 6396 ATOM 75265 O WAT 6397 120.430 5.910 75.153 1.00 0.00 O ATOM 75266 H1 WAT 6397 119.964 6.117 75.963 1.00 0.00 H ATOM 75267 H2 WAT 6397 119.833 6.183 74.457 1.00 0.00 H TER 75269 WAT 6397 ATOM 75269 O WAT 6398 66.393 91.819 18.277 1.00 0.00 O ATOM 75270 H1 WAT 6398 66.236 91.543 17.374 1.00 0.00 H ATOM 75271 H2 WAT 6398 66.345 91.009 18.786 1.00 0.00 H TER 75273 WAT 6398 ATOM 75273 O WAT 6399 112.348 41.482 75.916 1.00 0.00 O ATOM 75274 H1 WAT 6399 112.755 41.667 76.763 1.00 0.00 H ATOM 75275 H2 WAT 6399 111.590 42.065 75.882 1.00 0.00 H TER 75277 WAT 6399 ATOM 75277 O WAT 6400 95.956 57.038 77.090 1.00 0.00 O ATOM 75278 H1 WAT 6400 96.711 56.457 76.998 1.00 0.00 H ATOM 75279 H2 WAT 6400 95.245 56.463 77.375 1.00 0.00 H TER 75281 WAT 6400 ATOM 75281 O WAT 6401 20.156 5.142 11.336 1.00 0.00 O ATOM 75282 H1 WAT 6401 20.415 6.063 11.301 1.00 0.00 H ATOM 75283 H2 WAT 6401 20.640 4.729 10.621 1.00 0.00 H TER 75285 WAT 6401 ATOM 75285 O WAT 6402 87.659 117.237 28.169 1.00 0.00 O ATOM 75286 H1 WAT 6402 87.423 118.134 28.408 1.00 0.00 H ATOM 75287 H2 WAT 6402 86.932 116.705 28.492 1.00 0.00 H TER 75289 WAT 6402 ATOM 75289 O WAT 6403 23.557 40.965 154.337 1.00 0.00 O ATOM 75290 H1 WAT 6403 24.271 40.904 154.973 1.00 0.00 H ATOM 75291 H2 WAT 6403 23.863 40.459 153.584 1.00 0.00 H TER 75293 WAT 6403 ATOM 75293 O WAT 6404 61.565 58.603 126.823 1.00 0.00 O ATOM 75294 H1 WAT 6404 61.587 59.498 127.161 1.00 0.00 H ATOM 75295 H2 WAT 6404 60.981 58.647 126.066 1.00 0.00 H TER 75297 WAT 6404 ATOM 75297 O WAT 6405 51.402 94.241 27.479 1.00 0.00 O ATOM 75298 H1 WAT 6405 50.857 93.712 26.896 1.00 0.00 H ATOM 75299 H2 WAT 6405 50.776 94.708 28.033 1.00 0.00 H TER 75301 WAT 6405 ATOM 75301 O WAT 6406 91.714 7.990 88.166 1.00 0.00 O ATOM 75302 H1 WAT 6406 91.077 7.282 88.072 1.00 0.00 H ATOM 75303 H2 WAT 6406 91.274 8.636 88.718 1.00 0.00 H TER 75305 WAT 6406 ATOM 75305 O WAT 6407 132.189 120.362 129.539 1.00 0.00 O ATOM 75306 H1 WAT 6407 131.526 121.014 129.313 1.00 0.00 H ATOM 75307 H2 WAT 6407 132.852 120.447 128.854 1.00 0.00 H TER 75309 WAT 6407 ATOM 75309 O WAT 6408 66.262 93.314 128.931 1.00 0.00 O ATOM 75310 H1 WAT 6408 67.108 92.880 128.818 1.00 0.00 H ATOM 75311 H2 WAT 6408 65.694 92.905 128.279 1.00 0.00 H TER 75313 WAT 6408 ATOM 75313 O WAT 6409 101.379 46.126 104.298 1.00 0.00 O ATOM 75314 H1 WAT 6409 102.008 45.425 104.128 1.00 0.00 H ATOM 75315 H2 WAT 6409 100.731 45.731 104.881 1.00 0.00 H TER 75317 WAT 6409 ATOM 75317 O WAT 6410 11.555 117.984 98.668 1.00 0.00 O ATOM 75318 H1 WAT 6410 11.570 118.938 98.588 1.00 0.00 H ATOM 75319 H2 WAT 6410 10.988 117.692 97.954 1.00 0.00 H TER 75321 WAT 6410 ATOM 75321 O WAT 6411 135.812 12.669 146.446 1.00 0.00 O ATOM 75322 H1 WAT 6411 136.334 13.331 145.993 1.00 0.00 H ATOM 75323 H2 WAT 6411 134.993 12.630 145.951 1.00 0.00 H TER 75325 WAT 6411 ATOM 75325 O WAT 6412 40.521 20.982 133.036 1.00 0.00 O ATOM 75326 H1 WAT 6412 39.822 21.315 133.599 1.00 0.00 H ATOM 75327 H2 WAT 6412 41.278 21.529 133.245 1.00 0.00 H TER 75329 WAT 6412 ATOM 75329 O WAT 6413 36.979 14.215 158.955 1.00 0.00 O ATOM 75330 H1 WAT 6413 36.472 14.078 158.155 1.00 0.00 H ATOM 75331 H2 WAT 6413 37.891 14.207 158.665 1.00 0.00 H TER 75333 WAT 6413 ATOM 75333 O WAT 6414 97.082 6.229 103.193 1.00 0.00 O ATOM 75334 H1 WAT 6414 97.119 6.023 104.127 1.00 0.00 H ATOM 75335 H2 WAT 6414 96.768 7.133 103.160 1.00 0.00 H TER 75337 WAT 6414 ATOM 75337 O WAT 6415 63.997 79.736 129.243 1.00 0.00 O ATOM 75338 H1 WAT 6415 63.686 79.881 128.350 1.00 0.00 H ATOM 75339 H2 WAT 6415 63.807 78.814 129.416 1.00 0.00 H TER 75341 WAT 6415 ATOM 75341 O WAT 6416 138.851 1.093 148.253 1.00 0.00 O ATOM 75342 H1 WAT 6416 138.916 1.873 147.702 1.00 0.00 H ATOM 75343 H2 WAT 6416 139.705 1.030 148.682 1.00 0.00 H TER 75345 WAT 6416 ATOM 75345 O WAT 6417 48.898 31.903 142.893 1.00 0.00 O ATOM 75346 H1 WAT 6417 49.634 31.366 143.186 1.00 0.00 H ATOM 75347 H2 WAT 6417 48.217 31.271 142.662 1.00 0.00 H TER 75349 WAT 6417 ATOM 75349 O WAT 6418 81.944 87.982 139.982 1.00 0.00 O ATOM 75350 H1 WAT 6418 81.692 87.337 139.321 1.00 0.00 H ATOM 75351 H2 WAT 6418 82.206 87.459 140.739 1.00 0.00 H TER 75353 WAT 6418 ATOM 75353 O WAT 6419 51.236 145.382 91.496 1.00 0.00 O ATOM 75354 H1 WAT 6419 51.931 145.035 92.055 1.00 0.00 H ATOM 75355 H2 WAT 6419 50.441 145.300 92.024 1.00 0.00 H TER 75357 WAT 6419 ATOM 75357 O WAT 6420 116.853 60.872 83.340 1.00 0.00 O ATOM 75358 H1 WAT 6420 117.534 61.384 83.776 1.00 0.00 H ATOM 75359 H2 WAT 6420 116.180 61.513 83.110 1.00 0.00 H TER 75361 WAT 6420 ATOM 75361 O WAT 6421 85.730 27.636 100.752 1.00 0.00 O ATOM 75362 H1 WAT 6421 86.396 27.953 101.361 1.00 0.00 H ATOM 75363 H2 WAT 6421 85.959 28.040 99.915 1.00 0.00 H TER 75365 WAT 6421 ATOM 75365 O WAT 6422 98.529 84.693 104.027 1.00 0.00 O ATOM 75366 H1 WAT 6422 98.976 85.397 104.497 1.00 0.00 H ATOM 75367 H2 WAT 6422 98.369 85.052 103.154 1.00 0.00 H TER 75369 WAT 6422 ATOM 75369 O WAT 6423 113.027 34.237 56.018 1.00 0.00 O ATOM 75370 H1 WAT 6423 112.337 34.617 56.562 1.00 0.00 H ATOM 75371 H2 WAT 6423 113.451 34.991 55.608 1.00 0.00 H TER 75373 WAT 6423 ATOM 75373 O WAT 6424 131.404 16.182 93.995 1.00 0.00 O ATOM 75374 H1 WAT 6424 132.210 16.288 94.500 1.00 0.00 H ATOM 75375 H2 WAT 6424 131.698 16.114 93.086 1.00 0.00 H TER 75377 WAT 6424 ATOM 75377 O WAT 6425 6.934 130.100 59.525 1.00 0.00 O ATOM 75378 H1 WAT 6425 7.239 129.210 59.350 1.00 0.00 H ATOM 75379 H2 WAT 6425 7.737 130.616 59.607 1.00 0.00 H TER 75381 WAT 6425 ATOM 75381 O WAT 6426 41.746 18.162 127.859 1.00 0.00 O ATOM 75382 H1 WAT 6426 41.811 18.683 127.059 1.00 0.00 H ATOM 75383 H2 WAT 6426 41.916 18.785 128.566 1.00 0.00 H TER 75385 WAT 6426 ATOM 75385 O WAT 6427 28.775 136.057 108.063 1.00 0.00 O ATOM 75386 H1 WAT 6427 28.850 136.283 107.136 1.00 0.00 H ATOM 75387 H2 WAT 6427 29.674 135.884 108.341 1.00 0.00 H TER 75389 WAT 6427 ATOM 75389 O WAT 6428 89.264 14.409 60.266 1.00 0.00 O ATOM 75390 H1 WAT 6428 88.996 14.512 59.353 1.00 0.00 H ATOM 75391 H2 WAT 6428 89.811 15.174 60.443 1.00 0.00 H TER 75393 WAT 6428 ATOM 75393 O WAT 6429 16.238 8.780 94.898 1.00 0.00 O ATOM 75394 H1 WAT 6429 17.001 9.266 94.586 1.00 0.00 H ATOM 75395 H2 WAT 6429 15.706 8.640 94.115 1.00 0.00 H TER 75397 WAT 6429 ATOM 75397 O WAT 6430 41.939 131.801 88.551 1.00 0.00 O ATOM 75398 H1 WAT 6430 41.382 132.074 87.821 1.00 0.00 H ATOM 75399 H2 WAT 6430 41.338 131.383 89.167 1.00 0.00 H TER 75401 WAT 6430 ATOM 75401 O WAT 6431 94.545 82.160 13.751 1.00 0.00 O ATOM 75402 H1 WAT 6431 93.856 82.364 14.384 1.00 0.00 H ATOM 75403 H2 WAT 6431 94.085 82.068 12.917 1.00 0.00 H TER 75405 WAT 6431 ATOM 75405 O WAT 6432 57.655 92.193 117.773 1.00 0.00 O ATOM 75406 H1 WAT 6432 58.248 91.549 118.161 1.00 0.00 H ATOM 75407 H2 WAT 6432 57.476 92.811 118.481 1.00 0.00 H TER 75409 WAT 6432 ATOM 75409 O WAT 6433 66.316 125.364 146.859 1.00 0.00 O ATOM 75410 H1 WAT 6433 65.529 125.895 146.984 1.00 0.00 H ATOM 75411 H2 WAT 6433 66.750 125.374 147.712 1.00 0.00 H TER 75413 WAT 6433 ATOM 75413 O WAT 6434 81.755 85.676 12.569 1.00 0.00 O ATOM 75414 H1 WAT 6434 82.474 85.756 13.196 1.00 0.00 H ATOM 75415 H2 WAT 6434 82.141 85.925 11.729 1.00 0.00 H TER 75417 WAT 6434 ATOM 75417 O WAT 6435 22.581 69.476 5.783 1.00 0.00 O ATOM 75418 H1 WAT 6435 22.332 69.862 4.943 1.00 0.00 H ATOM 75419 H2 WAT 6435 23.530 69.599 5.830 1.00 0.00 H TER 75421 WAT 6435 ATOM 75421 O WAT 6436 135.868 38.141 59.600 1.00 0.00 O ATOM 75422 H1 WAT 6436 136.353 38.846 60.028 1.00 0.00 H ATOM 75423 H2 WAT 6436 136.287 37.339 59.912 1.00 0.00 H TER 75425 WAT 6436 ATOM 75425 O WAT 6437 17.735 16.907 103.861 1.00 0.00 O ATOM 75426 H1 WAT 6437 18.405 17.307 103.307 1.00 0.00 H ATOM 75427 H2 WAT 6437 17.403 16.173 103.343 1.00 0.00 H TER 75429 WAT 6437 ATOM 75429 O WAT 6438 106.724 24.061 135.498 1.00 0.00 O ATOM 75430 H1 WAT 6438 107.115 24.909 135.710 1.00 0.00 H ATOM 75431 H2 WAT 6438 107.326 23.672 134.864 1.00 0.00 H TER 75433 WAT 6438 ATOM 75433 O WAT 6439 127.563 69.130 153.673 1.00 0.00 O ATOM 75434 H1 WAT 6439 126.640 69.313 153.853 1.00 0.00 H ATOM 75435 H2 WAT 6439 127.976 69.993 153.639 1.00 0.00 H TER 75437 WAT 6439 ATOM 75437 O WAT 6440 85.392 43.094 86.139 1.00 0.00 O ATOM 75438 H1 WAT 6440 85.948 42.764 85.433 1.00 0.00 H ATOM 75439 H2 WAT 6440 84.502 42.864 85.871 1.00 0.00 H TER 75441 WAT 6440 ATOM 75441 O WAT 6441 125.657 138.201 144.939 1.00 0.00 O ATOM 75442 H1 WAT 6441 125.517 138.261 145.884 1.00 0.00 H ATOM 75443 H2 WAT 6441 125.770 137.265 144.773 1.00 0.00 H TER 75445 WAT 6441 ATOM 75445 O WAT 6442 72.968 36.798 121.887 1.00 0.00 O ATOM 75446 H1 WAT 6442 72.993 36.720 120.934 1.00 0.00 H ATOM 75447 H2 WAT 6442 73.558 37.526 122.084 1.00 0.00 H TER 75449 WAT 6442 ATOM 75449 O WAT 6443 17.617 9.310 21.662 1.00 0.00 O ATOM 75450 H1 WAT 6443 18.380 9.614 22.154 1.00 0.00 H ATOM 75451 H2 WAT 6443 17.887 8.468 21.297 1.00 0.00 H TER 75453 WAT 6443 ATOM 75453 O WAT 6444 116.522 60.073 93.076 1.00 0.00 O ATOM 75454 H1 WAT 6444 116.342 59.146 92.919 1.00 0.00 H ATOM 75455 H2 WAT 6444 116.440 60.482 92.215 1.00 0.00 H TER 75457 WAT 6444 ATOM 75457 O WAT 6445 22.181 39.479 80.801 1.00 0.00 O ATOM 75458 H1 WAT 6445 21.443 39.252 81.367 1.00 0.00 H ATOM 75459 H2 WAT 6445 21.836 39.394 79.913 1.00 0.00 H TER 75461 WAT 6445 ATOM 75461 O WAT 6446 57.163 105.545 70.430 1.00 0.00 O ATOM 75462 H1 WAT 6446 56.313 105.984 70.411 1.00 0.00 H ATOM 75463 H2 WAT 6446 57.780 106.229 70.691 1.00 0.00 H TER 75465 WAT 6446 ATOM 75465 O WAT 6447 4.882 114.361 87.610 1.00 0.00 O ATOM 75466 H1 WAT 6447 4.035 114.655 87.276 1.00 0.00 H ATOM 75467 H2 WAT 6447 4.895 113.420 87.437 1.00 0.00 H TER 75469 WAT 6447 ATOM 75469 O WAT 6448 120.243 43.451 108.960 1.00 0.00 O ATOM 75470 H1 WAT 6448 119.859 42.622 108.673 1.00 0.00 H ATOM 75471 H2 WAT 6448 121.155 43.405 108.674 1.00 0.00 H TER 75473 WAT 6448 ATOM 75473 O WAT 6449 25.912 120.691 87.533 1.00 0.00 O ATOM 75474 H1 WAT 6449 25.863 121.052 88.418 1.00 0.00 H ATOM 75475 H2 WAT 6449 26.749 121.007 87.192 1.00 0.00 H TER 75477 WAT 6449 ATOM 75477 O WAT 6450 43.588 21.939 117.768 1.00 0.00 O ATOM 75478 H1 WAT 6450 43.551 21.317 117.041 1.00 0.00 H ATOM 75479 H2 WAT 6450 44.092 22.677 117.426 1.00 0.00 H TER 75481 WAT 6450 ATOM 75481 O WAT 6451 104.353 106.319 110.076 1.00 0.00 O ATOM 75482 H1 WAT 6451 104.994 107.010 109.909 1.00 0.00 H ATOM 75483 H2 WAT 6451 103.521 106.688 109.779 1.00 0.00 H TER 75485 WAT 6451 ATOM 75485 O WAT 6452 23.001 9.584 137.465 1.00 0.00 O ATOM 75486 H1 WAT 6452 23.617 9.386 136.759 1.00 0.00 H ATOM 75487 H2 WAT 6452 22.490 8.781 137.568 1.00 0.00 H TER 75489 WAT 6452 ATOM 75489 O WAT 6453 120.355 13.570 22.301 1.00 0.00 O ATOM 75490 H1 WAT 6453 120.254 13.269 23.204 1.00 0.00 H ATOM 75491 H2 WAT 6453 121.298 13.698 22.195 1.00 0.00 H TER 75493 WAT 6453 ATOM 75493 O WAT 6454 12.108 125.007 155.345 1.00 0.00 O ATOM 75494 H1 WAT 6454 11.903 125.400 154.497 1.00 0.00 H ATOM 75495 H2 WAT 6454 12.227 124.076 155.155 1.00 0.00 H TER 75497 WAT 6454 ATOM 75497 O WAT 6455 34.252 55.710 144.651 1.00 0.00 O ATOM 75498 H1 WAT 6455 33.689 56.331 144.189 1.00 0.00 H ATOM 75499 H2 WAT 6455 35.143 56.004 144.459 1.00 0.00 H TER 75501 WAT 6455 ATOM 75501 O WAT 6456 103.591 29.872 115.304 1.00 0.00 O ATOM 75502 H1 WAT 6456 104.397 29.359 115.233 1.00 0.00 H ATOM 75503 H2 WAT 6456 103.873 30.778 115.183 1.00 0.00 H TER 75505 WAT 6456 ATOM 75505 O WAT 6457 141.500 27.247 112.698 1.00 0.00 O ATOM 75506 H1 WAT 6457 140.931 27.750 112.116 1.00 0.00 H ATOM 75507 H2 WAT 6457 141.816 27.887 113.336 1.00 0.00 H TER 75509 WAT 6457 ATOM 75509 O WAT 6458 21.324 30.178 23.115 1.00 0.00 O ATOM 75510 H1 WAT 6458 21.447 29.830 22.232 1.00 0.00 H ATOM 75511 H2 WAT 6458 20.401 30.430 23.147 1.00 0.00 H TER 75513 WAT 6458 ATOM 75513 O WAT 6459 84.494 145.472 128.664 1.00 0.00 O ATOM 75514 H1 WAT 6459 84.022 145.252 129.467 1.00 0.00 H ATOM 75515 H2 WAT 6459 83.911 146.074 128.201 1.00 0.00 H TER 75517 WAT 6459 ATOM 75517 O WAT 6460 124.598 113.276 149.267 1.00 0.00 O ATOM 75518 H1 WAT 6460 125.153 112.549 149.552 1.00 0.00 H ATOM 75519 H2 WAT 6460 124.699 113.293 148.315 1.00 0.00 H TER 75521 WAT 6460 ATOM 75521 O WAT 6461 112.657 63.639 0.180 1.00 0.00 O ATOM 75522 H1 WAT 6461 112.868 62.785 0.559 1.00 0.00 H ATOM 75523 H2 WAT 6461 111.850 63.904 0.621 1.00 0.00 H TER 75525 WAT 6461 ATOM 75525 O WAT 6462 65.710 54.526 15.764 1.00 0.00 O ATOM 75526 H1 WAT 6462 65.574 54.231 16.664 1.00 0.00 H ATOM 75527 H2 WAT 6462 64.923 54.246 15.298 1.00 0.00 H TER 75529 WAT 6462 ATOM 75529 O WAT 6463 17.264 73.281 92.420 1.00 0.00 O ATOM 75530 H1 WAT 6463 17.871 73.700 93.031 1.00 0.00 H ATOM 75531 H2 WAT 6463 17.184 73.904 91.698 1.00 0.00 H TER 75533 WAT 6463 ATOM 75533 O WAT 6464 119.985 49.084 153.132 1.00 0.00 O ATOM 75534 H1 WAT 6464 119.771 49.098 154.065 1.00 0.00 H ATOM 75535 H2 WAT 6464 119.177 49.353 152.696 1.00 0.00 H TER 75537 WAT 6464 ATOM 75537 O WAT 6465 115.143 145.326 13.340 1.00 0.00 O ATOM 75538 H1 WAT 6465 116.029 145.014 13.524 1.00 0.00 H ATOM 75539 H2 WAT 6465 114.851 145.717 14.164 1.00 0.00 H TER 75541 WAT 6465 ATOM 75541 O WAT 6466 16.811 111.759 79.913 1.00 0.00 O ATOM 75542 H1 WAT 6466 17.085 110.853 80.057 1.00 0.00 H ATOM 75543 H2 WAT 6466 16.331 111.993 80.707 1.00 0.00 H TER 75545 WAT 6466 ATOM 75545 O WAT 6467 59.447 83.594 86.192 1.00 0.00 O ATOM 75546 H1 WAT 6467 59.019 84.328 86.634 1.00 0.00 H ATOM 75547 H2 WAT 6467 60.352 83.624 86.500 1.00 0.00 H TER 75549 WAT 6467 ATOM 75549 O WAT 6468 99.733 47.211 111.257 1.00 0.00 O ATOM 75550 H1 WAT 6468 99.616 47.278 112.205 1.00 0.00 H ATOM 75551 H2 WAT 6468 100.628 46.891 111.148 1.00 0.00 H TER 75553 WAT 6468 ATOM 75553 O WAT 6469 60.881 6.188 104.123 1.00 0.00 O ATOM 75554 H1 WAT 6469 60.263 6.405 104.821 1.00 0.00 H ATOM 75555 H2 WAT 6469 61.701 6.601 104.393 1.00 0.00 H TER 75557 WAT 6469 ATOM 75557 O WAT 6470 63.709 87.037 107.881 1.00 0.00 O ATOM 75558 H1 WAT 6470 63.588 87.713 107.214 1.00 0.00 H ATOM 75559 H2 WAT 6470 62.922 87.093 108.423 1.00 0.00 H TER 75561 WAT 6470 ATOM 75561 O WAT 6471 52.979 26.147 7.031 1.00 0.00 O ATOM 75562 H1 WAT 6471 53.064 25.252 6.704 1.00 0.00 H ATOM 75563 H2 WAT 6471 53.838 26.350 7.401 1.00 0.00 H TER 75565 WAT 6471 ATOM 75565 O WAT 6472 94.764 57.849 90.738 1.00 0.00 O ATOM 75566 H1 WAT 6472 94.160 57.495 90.085 1.00 0.00 H ATOM 75567 H2 WAT 6472 95.423 58.316 90.225 1.00 0.00 H TER 75569 WAT 6472 ATOM 75569 O WAT 6473 10.761 87.272 103.329 1.00 0.00 O ATOM 75570 H1 WAT 6473 9.931 87.334 103.802 1.00 0.00 H ATOM 75571 H2 WAT 6473 11.320 86.740 103.897 1.00 0.00 H TER 75573 WAT 6473 ATOM 75573 O WAT 6474 13.207 140.241 17.624 1.00 0.00 O ATOM 75574 H1 WAT 6474 12.518 140.863 17.860 1.00 0.00 H ATOM 75575 H2 WAT 6474 12.802 139.673 16.969 1.00 0.00 H TER 75577 WAT 6474 ATOM 75577 O WAT 6475 137.184 64.200 84.363 1.00 0.00 O ATOM 75578 H1 WAT 6475 136.526 64.888 84.463 1.00 0.00 H ATOM 75579 H2 WAT 6475 136.678 63.389 84.314 1.00 0.00 H TER 75581 WAT 6475 ATOM 75581 O WAT 6476 60.828 124.332 104.484 1.00 0.00 O ATOM 75582 H1 WAT 6476 61.725 124.666 104.485 1.00 0.00 H ATOM 75583 H2 WAT 6476 60.343 124.949 105.033 1.00 0.00 H TER 75585 WAT 6476 ATOM 75585 O WAT 6477 0.783 21.891 69.695 1.00 0.00 O ATOM 75586 H1 WAT 6477 0.942 22.493 70.422 1.00 0.00 H ATOM 75587 H2 WAT 6477 1.377 22.187 69.005 1.00 0.00 H TER 75589 WAT 6477 ATOM 75589 O WAT 6478 29.720 87.962 142.943 1.00 0.00 O ATOM 75590 H1 WAT 6478 29.240 87.195 142.631 1.00 0.00 H ATOM 75591 H2 WAT 6478 30.448 87.600 143.448 1.00 0.00 H TER 75593 WAT 6478 ATOM 75593 O WAT 6479 3.725 143.549 66.411 1.00 0.00 O ATOM 75594 H1 WAT 6479 3.878 144.350 65.910 1.00 0.00 H ATOM 75595 H2 WAT 6479 4.463 143.501 67.018 1.00 0.00 H TER 75597 WAT 6479 ATOM 75597 O WAT 6480 91.033 57.644 105.725 1.00 0.00 O ATOM 75598 H1 WAT 6480 91.405 57.402 106.573 1.00 0.00 H ATOM 75599 H2 WAT 6480 90.192 58.048 105.939 1.00 0.00 H TER 75601 WAT 6480 ATOM 75601 O WAT 6481 59.896 70.382 127.820 1.00 0.00 O ATOM 75602 H1 WAT 6481 60.002 70.088 128.725 1.00 0.00 H ATOM 75603 H2 WAT 6481 60.754 70.729 127.578 1.00 0.00 H TER 75605 WAT 6481 ATOM 75605 O WAT 6482 109.380 106.983 0.388 1.00 0.00 O ATOM 75606 H1 WAT 6482 110.231 107.246 0.038 1.00 0.00 H ATOM 75607 H2 WAT 6482 108.861 107.788 0.386 1.00 0.00 H TER 75609 WAT 6482 ATOM 75609 O WAT 6483 40.979 115.741 103.397 1.00 0.00 O ATOM 75610 H1 WAT 6483 40.449 116.326 102.855 1.00 0.00 H ATOM 75611 H2 WAT 6483 41.303 115.078 102.787 1.00 0.00 H TER 75613 WAT 6483 ATOM 75613 O WAT 6484 28.939 60.320 8.787 1.00 0.00 O ATOM 75614 H1 WAT 6484 28.450 59.808 9.431 1.00 0.00 H ATOM 75615 H2 WAT 6484 29.608 60.773 9.300 1.00 0.00 H TER 75617 WAT 6484 ATOM 75617 O WAT 6485 95.945 41.391 51.404 1.00 0.00 O ATOM 75618 H1 WAT 6485 96.004 42.334 51.556 1.00 0.00 H ATOM 75619 H2 WAT 6485 95.789 41.019 52.272 1.00 0.00 H TER 75621 WAT 6485 ATOM 75621 O WAT 6486 1.349 142.189 75.139 1.00 0.00 O ATOM 75622 H1 WAT 6486 1.558 142.173 74.205 1.00 0.00 H ATOM 75623 H2 WAT 6486 2.056 142.700 75.534 1.00 0.00 H TER 75625 WAT 6486 ATOM 75625 O WAT 6487 11.310 36.791 152.355 1.00 0.00 O ATOM 75626 H1 WAT 6487 11.214 37.561 152.916 1.00 0.00 H ATOM 75627 H2 WAT 6487 12.034 37.011 151.768 1.00 0.00 H TER 75629 WAT 6487 ATOM 75629 O WAT 6488 119.187 139.418 88.894 1.00 0.00 O ATOM 75630 H1 WAT 6488 118.858 138.592 88.540 1.00 0.00 H ATOM 75631 H2 WAT 6488 119.571 139.181 89.737 1.00 0.00 H TER 75633 WAT 6488 ATOM 75633 O WAT 6489 97.102 61.018 93.839 1.00 0.00 O ATOM 75634 H1 WAT 6489 97.276 60.334 94.485 1.00 0.00 H ATOM 75635 H2 WAT 6489 96.559 60.589 93.177 1.00 0.00 H TER 75637 WAT 6489 ATOM 75637 O WAT 6490 79.542 79.550 128.419 1.00 0.00 O ATOM 75638 H1 WAT 6490 80.020 79.546 129.248 1.00 0.00 H ATOM 75639 H2 WAT 6490 80.078 79.019 127.830 1.00 0.00 H TER 75641 WAT 6490 ATOM 75641 O WAT 6491 64.232 115.572 49.933 1.00 0.00 O ATOM 75642 H1 WAT 6491 64.815 115.696 49.184 1.00 0.00 H ATOM 75643 H2 WAT 6491 63.495 116.158 49.761 1.00 0.00 H TER 75645 WAT 6491 ATOM 75645 O WAT 6492 22.223 130.836 6.254 1.00 0.00 O ATOM 75646 H1 WAT 6492 22.209 131.786 6.372 1.00 0.00 H ATOM 75647 H2 WAT 6492 22.033 130.707 5.325 1.00 0.00 H TER 75649 WAT 6492 ATOM 75649 O WAT 6493 118.199 103.658 78.276 1.00 0.00 O ATOM 75650 H1 WAT 6493 118.093 103.534 79.219 1.00 0.00 H ATOM 75651 H2 WAT 6493 118.437 102.791 77.946 1.00 0.00 H TER 75653 WAT 6493 ATOM 75653 O WAT 6494 134.763 20.871 11.362 1.00 0.00 O ATOM 75654 H1 WAT 6494 134.300 20.432 10.648 1.00 0.00 H ATOM 75655 H2 WAT 6494 134.175 20.792 12.113 1.00 0.00 H TER 75657 WAT 6494 ATOM 75657 O WAT 6495 51.523 90.877 78.654 1.00 0.00 O ATOM 75658 H1 WAT 6495 51.667 90.551 77.766 1.00 0.00 H ATOM 75659 H2 WAT 6495 52.403 91.009 79.006 1.00 0.00 H TER 75661 WAT 6495 ATOM 75661 O WAT 6496 127.511 22.728 55.121 1.00 0.00 O ATOM 75662 H1 WAT 6496 127.712 21.792 55.150 1.00 0.00 H ATOM 75663 H2 WAT 6496 127.361 22.969 56.035 1.00 0.00 H TER 75665 WAT 6496 ATOM 75665 O WAT 6497 36.995 10.467 103.827 1.00 0.00 O ATOM 75666 H1 WAT 6497 37.877 10.751 103.588 1.00 0.00 H ATOM 75667 H2 WAT 6497 36.503 11.280 103.941 1.00 0.00 H TER 75669 WAT 6497 ATOM 75669 O WAT 6498 8.421 26.969 18.942 1.00 0.00 O ATOM 75670 H1 WAT 6498 7.899 26.854 18.148 1.00 0.00 H ATOM 75671 H2 WAT 6498 7.808 26.800 19.658 1.00 0.00 H TER 75673 WAT 6498 ATOM 75673 O WAT 6499 129.322 35.539 109.256 1.00 0.00 O ATOM 75674 H1 WAT 6499 128.449 35.915 109.370 1.00 0.00 H ATOM 75675 H2 WAT 6499 129.163 34.669 108.891 1.00 0.00 H TER 75677 WAT 6499 ATOM 75677 O WAT 6500 38.549 82.903 115.716 1.00 0.00 O ATOM 75678 H1 WAT 6500 38.334 83.625 115.126 1.00 0.00 H ATOM 75679 H2 WAT 6500 39.360 82.538 115.362 1.00 0.00 H TER 75681 WAT 6500 ATOM 75681 O WAT 6501 52.660 117.507 135.359 1.00 0.00 O ATOM 75682 H1 WAT 6501 53.506 117.602 135.796 1.00 0.00 H ATOM 75683 H2 WAT 6501 52.292 118.390 135.353 1.00 0.00 H TER 75685 WAT 6501 ATOM 75685 O WAT 6502 115.009 42.222 13.058 1.00 0.00 O ATOM 75686 H1 WAT 6502 114.076 42.406 13.169 1.00 0.00 H ATOM 75687 H2 WAT 6502 115.446 43.034 13.316 1.00 0.00 H TER 75689 WAT 6502 ATOM 75689 O WAT 6503 78.575 53.201 135.398 1.00 0.00 O ATOM 75690 H1 WAT 6503 78.609 53.869 134.713 1.00 0.00 H ATOM 75691 H2 WAT 6503 78.793 53.671 136.202 1.00 0.00 H TER 75693 WAT 6503 ATOM 75693 O WAT 6504 114.895 132.210 146.840 1.00 0.00 O ATOM 75694 H1 WAT 6504 114.946 132.935 147.463 1.00 0.00 H ATOM 75695 H2 WAT 6504 115.679 131.689 147.014 1.00 0.00 H TER 75697 WAT 6504 ATOM 75697 O WAT 6505 23.395 64.856 149.849 1.00 0.00 O ATOM 75698 H1 WAT 6505 23.718 65.198 149.015 1.00 0.00 H ATOM 75699 H2 WAT 6505 23.986 64.131 150.055 1.00 0.00 H TER 75701 WAT 6505 ATOM 75701 O WAT 6506 91.127 77.519 110.542 1.00 0.00 O ATOM 75702 H1 WAT 6506 90.197 77.634 110.739 1.00 0.00 H ATOM 75703 H2 WAT 6506 91.580 77.972 111.253 1.00 0.00 H TER 75705 WAT 6506 ATOM 75705 O WAT 6507 124.810 143.912 102.894 1.00 0.00 O ATOM 75706 H1 WAT 6507 124.684 143.069 102.458 1.00 0.00 H ATOM 75707 H2 WAT 6507 125.672 144.207 102.600 1.00 0.00 H TER 75709 WAT 6507 ATOM 75709 O WAT 6508 118.688 130.881 121.643 1.00 0.00 O ATOM 75710 H1 WAT 6508 119.482 131.395 121.493 1.00 0.00 H ATOM 75711 H2 WAT 6508 118.428 130.583 120.771 1.00 0.00 H TER 75713 WAT 6508 ATOM 75713 O WAT 6509 142.834 21.732 120.302 1.00 0.00 O ATOM 75714 H1 WAT 6509 142.505 21.791 121.199 1.00 0.00 H ATOM 75715 H2 WAT 6509 142.108 22.038 119.760 1.00 0.00 H TER 75717 WAT 6509 ATOM 75717 O WAT 6510 77.033 58.713 100.551 1.00 0.00 O ATOM 75718 H1 WAT 6510 77.818 58.828 100.017 1.00 0.00 H ATOM 75719 H2 WAT 6510 76.320 58.640 99.917 1.00 0.00 H TER 75721 WAT 6510 ATOM 75721 O WAT 6511 82.255 77.345 63.556 1.00 0.00 O ATOM 75722 H1 WAT 6511 82.678 77.914 62.913 1.00 0.00 H ATOM 75723 H2 WAT 6511 82.746 76.524 63.509 1.00 0.00 H TER 75725 WAT 6511 ATOM 75725 O WAT 6512 126.280 113.822 97.979 1.00 0.00 O ATOM 75726 H1 WAT 6512 126.321 114.735 98.263 1.00 0.00 H ATOM 75727 H2 WAT 6512 127.087 113.431 98.313 1.00 0.00 H TER 75729 WAT 6512 ATOM 75729 O WAT 6513 29.381 102.787 134.354 1.00 0.00 O ATOM 75730 H1 WAT 6513 29.323 101.835 134.282 1.00 0.00 H ATOM 75731 H2 WAT 6513 30.240 102.945 134.747 1.00 0.00 H TER 75733 WAT 6513 ATOM 75733 O WAT 6514 54.002 9.060 9.192 1.00 0.00 O ATOM 75734 H1 WAT 6514 54.230 9.989 9.168 1.00 0.00 H ATOM 75735 H2 WAT 6514 53.307 8.967 8.540 1.00 0.00 H TER 75737 WAT 6514 ATOM 75737 O WAT 6515 108.881 63.106 153.388 1.00 0.00 O ATOM 75738 H1 WAT 6515 108.242 63.203 154.094 1.00 0.00 H ATOM 75739 H2 WAT 6515 109.107 64.004 153.145 1.00 0.00 H TER 75741 WAT 6515 ATOM 75741 O WAT 6516 76.309 87.154 123.377 1.00 0.00 O ATOM 75742 H1 WAT 6516 76.912 87.774 122.968 1.00 0.00 H ATOM 75743 H2 WAT 6516 76.872 86.452 123.704 1.00 0.00 H TER 75745 WAT 6516 ATOM 75745 O WAT 6517 26.711 88.996 157.064 1.00 0.00 O ATOM 75746 H1 WAT 6517 26.900 88.645 157.933 1.00 0.00 H ATOM 75747 H2 WAT 6517 27.572 89.159 156.678 1.00 0.00 H TER 75749 WAT 6517 ATOM 75749 O WAT 6518 27.458 115.195 78.190 1.00 0.00 O ATOM 75750 H1 WAT 6518 27.495 115.793 78.937 1.00 0.00 H ATOM 75751 H2 WAT 6518 27.528 115.764 77.424 1.00 0.00 H TER 75753 WAT 6518 ATOM 75753 O WAT 6519 33.330 53.248 158.248 1.00 0.00 O ATOM 75754 H1 WAT 6519 32.975 53.851 158.902 1.00 0.00 H ATOM 75755 H2 WAT 6519 32.654 52.579 158.146 1.00 0.00 H TER 75757 WAT 6519 ATOM 75757 O WAT 6520 63.655 57.428 79.633 1.00 0.00 O ATOM 75758 H1 WAT 6520 64.075 58.209 79.992 1.00 0.00 H ATOM 75759 H2 WAT 6520 64.203 56.702 79.931 1.00 0.00 H TER 75761 WAT 6520 ATOM 75761 O WAT 6521 52.804 112.027 80.846 1.00 0.00 O ATOM 75762 H1 WAT 6521 51.895 112.188 81.101 1.00 0.00 H ATOM 75763 H2 WAT 6521 52.893 112.457 79.995 1.00 0.00 H TER 75765 WAT 6521 ATOM 75765 O WAT 6522 137.967 5.237 79.698 1.00 0.00 O ATOM 75766 H1 WAT 6522 137.202 5.362 80.259 1.00 0.00 H ATOM 75767 H2 WAT 6522 137.604 5.134 78.818 1.00 0.00 H TER 75769 WAT 6522 ATOM 75769 O WAT 6523 109.475 142.891 65.888 1.00 0.00 O ATOM 75770 H1 WAT 6523 109.306 143.211 66.775 1.00 0.00 H ATOM 75771 H2 WAT 6523 110.396 143.098 65.729 1.00 0.00 H TER 75773 WAT 6523 ATOM 75773 O WAT 6524 116.235 111.771 144.587 1.00 0.00 O ATOM 75774 H1 WAT 6524 117.155 112.005 144.461 1.00 0.00 H ATOM 75775 H2 WAT 6524 115.910 112.411 145.221 1.00 0.00 H TER 75777 WAT 6524 ATOM 75777 O WAT 6525 85.104 37.863 9.193 1.00 0.00 O ATOM 75778 H1 WAT 6525 84.237 37.527 8.966 1.00 0.00 H ATOM 75779 H2 WAT 6525 85.550 37.962 8.352 1.00 0.00 H TER 75781 WAT 6525 ATOM 75781 O WAT 6526 50.302 90.292 155.979 1.00 0.00 O ATOM 75782 H1 WAT 6526 49.497 90.811 155.968 1.00 0.00 H ATOM 75783 H2 WAT 6526 50.003 89.386 155.900 1.00 0.00 H TER 75785 WAT 6526 ATOM 75785 O WAT 6527 99.080 101.131 61.808 1.00 0.00 O ATOM 75786 H1 WAT 6527 98.285 100.601 61.764 1.00 0.00 H ATOM 75787 H2 WAT 6527 99.356 101.226 60.896 1.00 0.00 H TER 75789 WAT 6527 ATOM 75789 O WAT 6528 32.273 128.162 106.073 1.00 0.00 O ATOM 75790 H1 WAT 6528 32.009 127.243 106.016 1.00 0.00 H ATOM 75791 H2 WAT 6528 32.338 128.335 107.012 1.00 0.00 H TER 75793 WAT 6528 ATOM 75793 O WAT 6529 112.666 22.464 7.017 1.00 0.00 O ATOM 75794 H1 WAT 6529 111.921 22.497 7.617 1.00 0.00 H ATOM 75795 H2 WAT 6529 112.350 21.954 6.271 1.00 0.00 H TER 75797 WAT 6529 ATOM 75797 O WAT 6530 118.871 0.425 99.211 1.00 0.00 O ATOM 75798 H1 WAT 6530 118.508 -0.090 98.491 1.00 0.00 H ATOM 75799 H2 WAT 6530 118.818 -0.154 99.972 1.00 0.00 H TER 75801 WAT 6530 ATOM 75801 O WAT 6531 96.030 103.816 138.113 1.00 0.00 O ATOM 75802 H1 WAT 6531 96.022 104.133 139.016 1.00 0.00 H ATOM 75803 H2 WAT 6531 95.109 103.660 137.905 1.00 0.00 H TER 75805 WAT 6531 ATOM 75805 O WAT 6532 126.530 123.589 108.283 1.00 0.00 O ATOM 75806 H1 WAT 6532 126.680 122.717 108.649 1.00 0.00 H ATOM 75807 H2 WAT 6532 125.981 123.435 107.514 1.00 0.00 H TER 75809 WAT 6532 ATOM 75809 O WAT 6533 54.521 130.149 98.263 1.00 0.00 O ATOM 75810 H1 WAT 6533 54.576 129.494 97.567 1.00 0.00 H ATOM 75811 H2 WAT 6533 53.830 130.746 97.976 1.00 0.00 H TER 75813 WAT 6533 ATOM 75813 O WAT 6534 64.068 65.038 76.694 1.00 0.00 O ATOM 75814 H1 WAT 6534 63.871 65.825 76.185 1.00 0.00 H ATOM 75815 H2 WAT 6534 64.584 64.493 76.100 1.00 0.00 H TER 75817 WAT 6534 ATOM 75817 O WAT 6535 122.682 35.872 109.965 1.00 0.00 O ATOM 75818 H1 WAT 6535 122.304 36.294 110.736 1.00 0.00 H ATOM 75819 H2 WAT 6535 122.162 35.076 109.849 1.00 0.00 H TER 75821 WAT 6535 ATOM 75821 O WAT 6536 81.132 61.881 150.239 1.00 0.00 O ATOM 75822 H1 WAT 6536 80.893 62.768 149.972 1.00 0.00 H ATOM 75823 H2 WAT 6536 81.505 61.986 151.114 1.00 0.00 H TER 75825 WAT 6536 ATOM 75825 O WAT 6537 28.300 64.876 139.597 1.00 0.00 O ATOM 75826 H1 WAT 6537 28.054 64.959 140.518 1.00 0.00 H ATOM 75827 H2 WAT 6537 28.629 65.742 139.357 1.00 0.00 H TER 75829 WAT 6537 ATOM 75829 O WAT 6538 22.561 3.992 17.080 1.00 0.00 O ATOM 75830 H1 WAT 6538 22.508 4.897 17.387 1.00 0.00 H ATOM 75831 H2 WAT 6538 23.331 3.634 17.520 1.00 0.00 H TER 75833 WAT 6538 ATOM 75833 O WAT 6539 91.013 85.330 4.242 1.00 0.00 O ATOM 75834 H1 WAT 6539 91.277 85.945 4.927 1.00 0.00 H ATOM 75835 H2 WAT 6539 91.800 84.812 4.070 1.00 0.00 H TER 75837 WAT 6539 ATOM 75837 O WAT 6540 120.557 143.522 14.593 1.00 0.00 O ATOM 75838 H1 WAT 6540 121.346 143.286 14.105 1.00 0.00 H ATOM 75839 H2 WAT 6540 120.616 143.016 15.403 1.00 0.00 H TER 75841 WAT 6540 ATOM 75841 O WAT 6541 83.560 89.015 71.910 1.00 0.00 O ATOM 75842 H1 WAT 6541 83.039 88.212 71.909 1.00 0.00 H ATOM 75843 H2 WAT 6541 83.187 89.544 71.205 1.00 0.00 H TER 75845 WAT 6541 ATOM 75845 O WAT 6542 129.104 134.217 108.586 1.00 0.00 O ATOM 75846 H1 WAT 6542 129.842 133.910 108.060 1.00 0.00 H ATOM 75847 H2 WAT 6542 128.828 135.029 108.160 1.00 0.00 H TER 75849 WAT 6542 ATOM 75849 O WAT 6543 121.664 66.634 146.684 1.00 0.00 O ATOM 75850 H1 WAT 6543 121.094 65.905 146.440 1.00 0.00 H ATOM 75851 H2 WAT 6543 121.868 66.479 147.607 1.00 0.00 H TER 75853 WAT 6543 ATOM 75853 O WAT 6544 4.451 138.272 136.519 1.00 0.00 O ATOM 75854 H1 WAT 6544 3.905 137.922 137.223 1.00 0.00 H ATOM 75855 H2 WAT 6544 4.623 137.520 135.952 1.00 0.00 H TER 75857 WAT 6544 ATOM 75857 O WAT 6545 143.861 36.674 11.951 1.00 0.00 O ATOM 75858 H1 WAT 6545 142.916 36.599 12.087 1.00 0.00 H ATOM 75859 H2 WAT 6545 143.998 37.595 11.728 1.00 0.00 H TER 75861 WAT 6545 ATOM 75861 O WAT 6546 69.431 121.555 3.779 1.00 0.00 O ATOM 75862 H1 WAT 6546 68.707 121.317 4.358 1.00 0.00 H ATOM 75863 H2 WAT 6546 70.217 121.296 4.260 1.00 0.00 H TER 75865 WAT 6546 ATOM 75865 O WAT 6547 75.045 117.875 73.802 1.00 0.00 O ATOM 75866 H1 WAT 6547 74.367 118.547 73.872 1.00 0.00 H ATOM 75867 H2 WAT 6547 75.759 118.197 74.352 1.00 0.00 H TER 75869 WAT 6547 ATOM 75869 O WAT 6548 90.834 143.947 14.394 1.00 0.00 O ATOM 75870 H1 WAT 6548 91.346 144.589 14.885 1.00 0.00 H ATOM 75871 H2 WAT 6548 89.982 144.364 14.269 1.00 0.00 H TER 75873 WAT 6548 ATOM 75873 O WAT 6549 121.555 72.194 70.522 1.00 0.00 O ATOM 75874 H1 WAT 6549 120.686 72.080 70.137 1.00 0.00 H ATOM 75875 H2 WAT 6549 121.962 71.331 70.454 1.00 0.00 H TER 75877 WAT 6549 ATOM 75877 O WAT 6550 95.218 50.478 103.740 1.00 0.00 O ATOM 75878 H1 WAT 6550 95.358 50.649 102.809 1.00 0.00 H ATOM 75879 H2 WAT 6550 94.317 50.760 103.902 1.00 0.00 H TER 75881 WAT 6550 ATOM 75881 O WAT 6551 87.734 128.234 10.509 1.00 0.00 O ATOM 75882 H1 WAT 6551 88.167 127.663 11.143 1.00 0.00 H ATOM 75883 H2 WAT 6551 86.804 128.027 10.597 1.00 0.00 H TER 75885 WAT 6551 ATOM 75885 O WAT 6552 96.859 86.560 128.720 1.00 0.00 O ATOM 75886 H1 WAT 6552 96.389 87.267 129.161 1.00 0.00 H ATOM 75887 H2 WAT 6552 96.356 85.772 128.929 1.00 0.00 H TER 75889 WAT 6552 ATOM 75889 O WAT 6553 68.055 24.007 128.012 1.00 0.00 O ATOM 75890 H1 WAT 6553 68.023 23.579 127.157 1.00 0.00 H ATOM 75891 H2 WAT 6553 68.036 23.286 128.642 1.00 0.00 H TER 75893 WAT 6553 ATOM 75893 O WAT 6554 136.359 97.087 103.194 1.00 0.00 O ATOM 75894 H1 WAT 6554 136.409 97.716 103.914 1.00 0.00 H ATOM 75895 H2 WAT 6554 136.897 97.472 102.502 1.00 0.00 H TER 75897 WAT 6554 ATOM 75897 O WAT 6555 78.962 17.346 66.014 1.00 0.00 O ATOM 75898 H1 WAT 6555 78.904 16.975 65.134 1.00 0.00 H ATOM 75899 H2 WAT 6555 78.069 17.294 66.355 1.00 0.00 H TER 75901 WAT 6555 ATOM 75901 O WAT 6556 67.713 46.128 111.185 1.00 0.00 O ATOM 75902 H1 WAT 6556 67.357 45.922 110.321 1.00 0.00 H ATOM 75903 H2 WAT 6556 67.080 45.755 111.799 1.00 0.00 H TER 75905 WAT 6556 ATOM 75905 O WAT 6557 49.889 64.833 72.534 1.00 0.00 O ATOM 75906 H1 WAT 6557 50.248 64.419 73.319 1.00 0.00 H ATOM 75907 H2 WAT 6557 49.270 65.482 72.868 1.00 0.00 H TER 75909 WAT 6557 ATOM 75909 O WAT 6558 75.177 128.246 103.934 1.00 0.00 O ATOM 75910 H1 WAT 6558 74.284 127.907 103.990 1.00 0.00 H ATOM 75911 H2 WAT 6558 75.689 127.666 104.497 1.00 0.00 H TER 75913 WAT 6558 ATOM 75913 O WAT 6559 15.227 44.940 138.654 1.00 0.00 O ATOM 75914 H1 WAT 6559 15.862 44.622 139.295 1.00 0.00 H ATOM 75915 H2 WAT 6559 15.729 45.532 138.093 1.00 0.00 H TER 75917 WAT 6559 ATOM 75917 O WAT 6560 4.281 59.316 109.569 1.00 0.00 O ATOM 75918 H1 WAT 6560 5.124 58.876 109.459 1.00 0.00 H ATOM 75919 H2 WAT 6560 3.892 58.900 110.338 1.00 0.00 H TER 75921 WAT 6560 ATOM 75921 O WAT 6561 56.693 84.431 70.244 1.00 0.00 O ATOM 75922 H1 WAT 6561 56.193 84.647 71.031 1.00 0.00 H ATOM 75923 H2 WAT 6561 56.945 85.279 69.879 1.00 0.00 H TER 75925 WAT 6561 ATOM 75925 O WAT 6562 82.696 59.369 6.057 1.00 0.00 O ATOM 75926 H1 WAT 6562 82.260 59.445 5.208 1.00 0.00 H ATOM 75927 H2 WAT 6562 82.332 60.085 6.578 1.00 0.00 H TER 75929 WAT 6562 ATOM 75929 O WAT 6563 22.188 24.906 84.846 1.00 0.00 O ATOM 75930 H1 WAT 6563 21.871 25.769 84.578 1.00 0.00 H ATOM 75931 H2 WAT 6563 23.022 24.804 84.387 1.00 0.00 H TER 75933 WAT 6563 ATOM 75933 O WAT 6564 122.450 42.870 65.666 1.00 0.00 O ATOM 75934 H1 WAT 6564 122.870 42.578 64.856 1.00 0.00 H ATOM 75935 H2 WAT 6564 122.294 43.805 65.532 1.00 0.00 H TER 75937 WAT 6564 ATOM 75937 O WAT 6565 16.937 29.817 83.011 1.00 0.00 O ATOM 75938 H1 WAT 6565 16.744 29.520 82.121 1.00 0.00 H ATOM 75939 H2 WAT 6565 16.961 29.013 83.531 1.00 0.00 H TER 75941 WAT 6565 ATOM 75941 O WAT 6566 136.467 36.501 140.423 1.00 0.00 O ATOM 75942 H1 WAT 6566 135.866 35.909 140.877 1.00 0.00 H ATOM 75943 H2 WAT 6566 136.153 36.515 139.519 1.00 0.00 H TER 75945 WAT 6566 ATOM 75945 O WAT 6567 73.418 65.548 147.498 1.00 0.00 O ATOM 75946 H1 WAT 6567 72.631 65.237 147.945 1.00 0.00 H ATOM 75947 H2 WAT 6567 74.022 65.775 148.205 1.00 0.00 H TER 75949 WAT 6567 ATOM 75949 O WAT 6568 15.895 103.828 17.908 1.00 0.00 O ATOM 75950 H1 WAT 6568 16.021 104.108 18.814 1.00 0.00 H ATOM 75951 H2 WAT 6568 15.605 102.918 17.976 1.00 0.00 H TER 75953 WAT 6568 ATOM 75953 O WAT 6569 1.856 86.054 92.822 1.00 0.00 O ATOM 75954 H1 WAT 6569 1.917 86.925 93.213 1.00 0.00 H ATOM 75955 H2 WAT 6569 2.763 85.754 92.762 1.00 0.00 H TER 75957 WAT 6569 ATOM 75957 O WAT 6570 132.597 47.543 18.824 1.00 0.00 O ATOM 75958 H1 WAT 6570 131.793 47.897 19.203 1.00 0.00 H ATOM 75959 H2 WAT 6570 133.210 47.502 19.559 1.00 0.00 H TER 75961 WAT 6570 ATOM 75961 O WAT 6571 18.211 38.015 146.745 1.00 0.00 O ATOM 75962 H1 WAT 6571 17.985 38.882 146.406 1.00 0.00 H ATOM 75963 H2 WAT 6571 18.622 38.188 147.591 1.00 0.00 H TER 75965 WAT 6571 ATOM 75965 O WAT 6572 112.263 28.401 84.968 1.00 0.00 O ATOM 75966 H1 WAT 6572 113.055 28.713 84.530 1.00 0.00 H ATOM 75967 H2 WAT 6572 112.290 28.812 85.833 1.00 0.00 H TER 75969 WAT 6572 ATOM 75969 O WAT 6573 30.592 21.114 63.637 1.00 0.00 O ATOM 75970 H1 WAT 6573 31.510 20.966 63.410 1.00 0.00 H ATOM 75971 H2 WAT 6573 30.307 21.807 63.042 1.00 0.00 H TER 75973 WAT 6573 ATOM 75973 O WAT 6574 69.339 37.055 80.027 1.00 0.00 O ATOM 75974 H1 WAT 6574 69.933 37.787 79.863 1.00 0.00 H ATOM 75975 H2 WAT 6574 68.673 37.130 79.343 1.00 0.00 H TER 75977 WAT 6574 ATOM 75977 O WAT 6575 38.663 121.538 17.315 1.00 0.00 O ATOM 75978 H1 WAT 6575 37.870 121.781 17.792 1.00 0.00 H ATOM 75979 H2 WAT 6575 39.272 121.250 17.995 1.00 0.00 H TER 75981 WAT 6575 ATOM 75981 O WAT 6576 68.480 85.307 139.460 1.00 0.00 O ATOM 75982 H1 WAT 6576 68.068 86.103 139.798 1.00 0.00 H ATOM 75983 H2 WAT 6576 67.986 84.593 139.862 1.00 0.00 H TER 75985 WAT 6576 ATOM 75985 O WAT 6577 99.865 43.063 91.519 1.00 0.00 O ATOM 75986 H1 WAT 6577 99.742 42.135 91.318 1.00 0.00 H ATOM 75987 H2 WAT 6577 99.289 43.224 92.267 1.00 0.00 H TER 75989 WAT 6577 ATOM 75989 O WAT 6578 133.421 138.611 112.116 1.00 0.00 O ATOM 75990 H1 WAT 6578 134.343 138.353 112.118 1.00 0.00 H ATOM 75991 H2 WAT 6578 133.389 139.389 112.672 1.00 0.00 H TER 75993 WAT 6578 ATOM 75993 O WAT 6579 135.725 7.649 2.361 1.00 0.00 O ATOM 75994 H1 WAT 6579 135.344 6.788 2.192 1.00 0.00 H ATOM 75995 H2 WAT 6579 135.234 7.985 3.111 1.00 0.00 H TER 75997 WAT 6579 ATOM 75997 O WAT 6580 55.059 88.618 65.114 1.00 0.00 O ATOM 75998 H1 WAT 6580 55.633 88.306 64.415 1.00 0.00 H ATOM 75999 H2 WAT 6580 54.221 88.185 64.949 1.00 0.00 H TER 76001 WAT 6580 ATOM 76001 O WAT 6581 51.747 45.479 86.433 1.00 0.00 O ATOM 76002 H1 WAT 6581 51.084 45.872 85.866 1.00 0.00 H ATOM 76003 H2 WAT 6581 51.283 44.783 86.898 1.00 0.00 H TER 76005 WAT 6581 ATOM 76005 O WAT 6582 89.146 115.530 117.919 1.00 0.00 O ATOM 76006 H1 WAT 6582 89.931 115.770 117.426 1.00 0.00 H ATOM 76007 H2 WAT 6582 88.474 116.136 117.609 1.00 0.00 H TER 76009 WAT 6582 ATOM 76009 O WAT 6583 3.921 89.831 153.543 1.00 0.00 O ATOM 76010 H1 WAT 6583 3.586 89.614 152.673 1.00 0.00 H ATOM 76011 H2 WAT 6583 4.531 90.553 153.391 1.00 0.00 H TER 76013 WAT 6583 ATOM 76013 O WAT 6584 130.636 36.264 17.626 1.00 0.00 O ATOM 76014 H1 WAT 6584 131.221 37.008 17.486 1.00 0.00 H ATOM 76015 H2 WAT 6584 131.100 35.518 17.246 1.00 0.00 H TER 76017 WAT 6584 ATOM 76017 O WAT 6585 4.752 0.538 71.009 1.00 0.00 O ATOM 76018 H1 WAT 6585 4.998 0.876 70.148 1.00 0.00 H ATOM 76019 H2 WAT 6585 3.979 1.047 71.254 1.00 0.00 H TER 76021 WAT 6585 ATOM 76021 O WAT 6586 130.942 25.137 114.309 1.00 0.00 O ATOM 76022 H1 WAT 6586 130.889 24.319 113.814 1.00 0.00 H ATOM 76023 H2 WAT 6586 130.188 25.646 114.011 1.00 0.00 H TER 76025 WAT 6586 ATOM 76025 O WAT 6587 137.859 104.577 87.120 1.00 0.00 O ATOM 76026 H1 WAT 6587 138.593 104.030 87.400 1.00 0.00 H ATOM 76027 H2 WAT 6587 138.246 105.440 86.974 1.00 0.00 H TER 76029 WAT 6587 ATOM 76029 O WAT 6588 92.587 116.234 80.874 1.00 0.00 O ATOM 76030 H1 WAT 6588 93.234 115.614 81.210 1.00 0.00 H ATOM 76031 H2 WAT 6588 92.427 116.833 81.604 1.00 0.00 H TER 76033 WAT 6588 ATOM 76033 O WAT 6589 105.137 41.830 7.988 1.00 0.00 O ATOM 76034 H1 WAT 6589 105.059 40.931 7.669 1.00 0.00 H ATOM 76035 H2 WAT 6589 104.288 42.228 7.794 1.00 0.00 H TER 76037 WAT 6589 ATOM 76037 O WAT 6590 95.158 1.363 53.986 1.00 0.00 O ATOM 76038 H1 WAT 6590 95.487 2.259 54.058 1.00 0.00 H ATOM 76039 H2 WAT 6590 95.823 0.828 54.420 1.00 0.00 H TER 76041 WAT 6590 ATOM 76041 O WAT 6591 71.597 140.127 86.783 1.00 0.00 O ATOM 76042 H1 WAT 6591 72.116 139.667 86.123 1.00 0.00 H ATOM 76043 H2 WAT 6591 71.323 139.442 87.393 1.00 0.00 H TER 76045 WAT 6591 ATOM 76045 O WAT 6592 27.681 55.281 78.275 1.00 0.00 O ATOM 76046 H1 WAT 6592 28.059 55.859 77.612 1.00 0.00 H ATOM 76047 H2 WAT 6592 28.204 54.482 78.222 1.00 0.00 H TER 76049 WAT 6592 ATOM 76049 O WAT 6593 127.878 68.333 137.146 1.00 0.00 O ATOM 76050 H1 WAT 6593 128.520 68.984 136.862 1.00 0.00 H ATOM 76051 H2 WAT 6593 128.121 68.136 138.051 1.00 0.00 H TER 76053 WAT 6593 ATOM 76053 O WAT 6594 39.977 47.888 69.805 1.00 0.00 O ATOM 76054 H1 WAT 6594 39.090 47.693 70.107 1.00 0.00 H ATOM 76055 H2 WAT 6594 40.510 47.170 70.148 1.00 0.00 H TER 76057 WAT 6594 ATOM 76057 O WAT 6595 114.629 52.348 4.192 1.00 0.00 O ATOM 76058 H1 WAT 6595 114.037 52.401 3.441 1.00 0.00 H ATOM 76059 H2 WAT 6595 115.332 51.767 3.901 1.00 0.00 H TER 76061 WAT 6595 ATOM 76061 O WAT 6596 16.716 125.513 122.471 1.00 0.00 O ATOM 76062 H1 WAT 6596 15.823 125.345 122.773 1.00 0.00 H ATOM 76063 H2 WAT 6596 16.641 126.295 121.924 1.00 0.00 H TER 76065 WAT 6596 ATOM 76065 O WAT 6597 68.739 17.872 61.672 1.00 0.00 O ATOM 76066 H1 WAT 6597 69.686 17.905 61.808 1.00 0.00 H ATOM 76067 H2 WAT 6597 68.637 17.599 60.761 1.00 0.00 H TER 76069 WAT 6597 ATOM 76069 O WAT 6598 32.984 97.634 3.259 1.00 0.00 O ATOM 76070 H1 WAT 6598 32.228 97.772 2.688 1.00 0.00 H ATOM 76071 H2 WAT 6598 32.809 98.182 4.024 1.00 0.00 H TER 76073 WAT 6598 ATOM 76073 O WAT 6599 8.362 109.819 86.800 1.00 0.00 O ATOM 76074 H1 WAT 6599 7.415 109.873 86.675 1.00 0.00 H ATOM 76075 H2 WAT 6599 8.467 109.478 87.689 1.00 0.00 H TER 76077 WAT 6599 ATOM 76077 O WAT 6600 15.477 142.536 154.264 1.00 0.00 O ATOM 76078 H1 WAT 6600 15.338 142.071 153.439 1.00 0.00 H ATOM 76079 H2 WAT 6600 16.340 142.246 154.559 1.00 0.00 H TER 76081 WAT 6600 ATOM 76081 O WAT 6601 74.998 42.759 121.970 1.00 0.00 O ATOM 76082 H1 WAT 6601 74.446 43.377 121.490 1.00 0.00 H ATOM 76083 H2 WAT 6601 74.422 42.396 122.643 1.00 0.00 H TER 76085 WAT 6601 ATOM 76085 O WAT 6602 27.998 108.156 115.860 1.00 0.00 O ATOM 76086 H1 WAT 6602 28.121 108.995 115.416 1.00 0.00 H ATOM 76087 H2 WAT 6602 27.724 107.556 115.166 1.00 0.00 H TER 76089 WAT 6602 ATOM 76089 O WAT 6603 48.280 65.913 129.942 1.00 0.00 O ATOM 76090 H1 WAT 6603 47.893 65.171 129.477 1.00 0.00 H ATOM 76091 H2 WAT 6603 48.217 65.676 130.867 1.00 0.00 H TER 76093 WAT 6603 ATOM 76093 O WAT 6604 28.245 94.946 131.242 1.00 0.00 O ATOM 76094 H1 WAT 6604 28.097 94.147 130.737 1.00 0.00 H ATOM 76095 H2 WAT 6604 29.192 95.081 131.207 1.00 0.00 H TER 76097 WAT 6604 ATOM 76097 O WAT 6605 9.284 123.168 124.349 1.00 0.00 O ATOM 76098 H1 WAT 6605 9.734 123.428 123.545 1.00 0.00 H ATOM 76099 H2 WAT 6605 9.795 123.572 125.051 1.00 0.00 H TER 76101 WAT 6605 ATOM 76101 O WAT 6606 138.769 37.166 131.793 1.00 0.00 O ATOM 76102 H1 WAT 6606 139.091 37.246 132.691 1.00 0.00 H ATOM 76103 H2 WAT 6606 139.480 36.733 131.321 1.00 0.00 H TER 76105 WAT 6606 ATOM 76105 O WAT 6607 49.948 31.012 126.545 1.00 0.00 O ATOM 76106 H1 WAT 6607 50.163 31.771 126.004 1.00 0.00 H ATOM 76107 H2 WAT 6607 49.574 30.379 125.933 1.00 0.00 H TER 76109 WAT 6607 ATOM 76109 O WAT 6608 47.224 26.905 114.000 1.00 0.00 O ATOM 76110 H1 WAT 6608 46.602 27.176 114.675 1.00 0.00 H ATOM 76111 H2 WAT 6608 48.013 26.664 114.484 1.00 0.00 H TER 76113 WAT 6608 ATOM 76113 O WAT 6609 83.567 123.994 82.125 1.00 0.00 O ATOM 76114 H1 WAT 6609 83.144 124.440 81.391 1.00 0.00 H ATOM 76115 H2 WAT 6609 83.524 123.065 81.898 1.00 0.00 H TER 76117 WAT 6609 ATOM 76117 O WAT 6610 105.320 40.740 20.942 1.00 0.00 O ATOM 76118 H1 WAT 6610 105.745 40.461 20.130 1.00 0.00 H ATOM 76119 H2 WAT 6610 106.034 41.079 21.482 1.00 0.00 H TER 76121 WAT 6610 ATOM 76121 O WAT 6611 93.351 74.242 130.121 1.00 0.00 O ATOM 76122 H1 WAT 6611 93.526 73.308 130.239 1.00 0.00 H ATOM 76123 H2 WAT 6611 92.825 74.485 130.883 1.00 0.00 H TER 76125 WAT 6611 ATOM 76125 O WAT 6612 118.045 78.565 150.771 1.00 0.00 O ATOM 76126 H1 WAT 6612 118.325 78.600 151.685 1.00 0.00 H ATOM 76127 H2 WAT 6612 117.096 78.684 150.805 1.00 0.00 H TER 76129 WAT 6612 ATOM 76129 O WAT 6613 114.207 122.078 70.535 1.00 0.00 O ATOM 76130 H1 WAT 6613 114.641 122.886 70.808 1.00 0.00 H ATOM 76131 H2 WAT 6613 114.813 121.382 70.792 1.00 0.00 H TER 76133 WAT 6613 ATOM 76133 O WAT 6614 137.044 50.737 95.885 1.00 0.00 O ATOM 76134 H1 WAT 6614 137.400 50.183 96.579 1.00 0.00 H ATOM 76135 H2 WAT 6614 136.231 51.086 96.250 1.00 0.00 H TER 76137 WAT 6614 ATOM 76137 O WAT 6615 90.612 123.998 8.733 1.00 0.00 O ATOM 76138 H1 WAT 6615 90.122 124.807 8.878 1.00 0.00 H ATOM 76139 H2 WAT 6615 91.090 124.150 7.918 1.00 0.00 H TER 76141 WAT 6615 ATOM 76141 O WAT 6616 47.439 100.739 137.327 1.00 0.00 O ATOM 76142 H1 WAT 6616 47.376 101.681 137.483 1.00 0.00 H ATOM 76143 H2 WAT 6616 47.550 100.358 138.198 1.00 0.00 H TER 76145 WAT 6616 ATOM 76145 O WAT 6617 107.420 80.384 137.806 1.00 0.00 O ATOM 76146 H1 WAT 6617 106.764 80.665 138.444 1.00 0.00 H ATOM 76147 H2 WAT 6617 108.175 80.129 138.335 1.00 0.00 H TER 76149 WAT 6617 ATOM 76149 O WAT 6618 10.009 141.853 123.042 1.00 0.00 O ATOM 76150 H1 WAT 6618 9.966 142.625 123.606 1.00 0.00 H ATOM 76151 H2 WAT 6618 10.226 142.199 122.177 1.00 0.00 H TER 76153 WAT 6618 ATOM 76153 O WAT 6619 111.555 23.598 95.920 1.00 0.00 O ATOM 76154 H1 WAT 6619 112.317 24.072 95.587 1.00 0.00 H ATOM 76155 H2 WAT 6619 110.843 24.236 95.888 1.00 0.00 H TER 76157 WAT 6619 ATOM 76157 O WAT 6620 72.856 86.639 123.455 1.00 0.00 O ATOM 76158 H1 WAT 6620 72.449 87.088 124.196 1.00 0.00 H ATOM 76159 H2 WAT 6620 73.334 85.909 123.849 1.00 0.00 H TER 76161 WAT 6620 ATOM 76161 O WAT 6621 140.576 95.501 17.110 1.00 0.00 O ATOM 76162 H1 WAT 6621 139.717 95.665 17.499 1.00 0.00 H ATOM 76163 H2 WAT 6621 141.163 96.107 17.562 1.00 0.00 H TER 76165 WAT 6621 ATOM 76165 O WAT 6622 41.191 25.391 123.427 1.00 0.00 O ATOM 76166 H1 WAT 6622 41.659 24.595 123.176 1.00 0.00 H ATOM 76167 H2 WAT 6622 40.640 25.594 122.672 1.00 0.00 H TER 76169 WAT 6622 ATOM 76169 O WAT 6623 76.300 36.880 120.823 1.00 0.00 O ATOM 76170 H1 WAT 6623 76.247 36.197 121.491 1.00 0.00 H ATOM 76171 H2 WAT 6623 76.842 37.562 121.219 1.00 0.00 H TER 76173 WAT 6623 ATOM 76173 O WAT 6624 142.681 131.777 158.409 1.00 0.00 O ATOM 76174 H1 WAT 6624 142.459 131.513 159.302 1.00 0.00 H ATOM 76175 H2 WAT 6624 142.048 131.316 157.858 1.00 0.00 H TER 76177 WAT 6624 ATOM 76177 O WAT 6625 87.054 57.061 152.929 1.00 0.00 O ATOM 76178 H1 WAT 6625 87.225 56.895 153.856 1.00 0.00 H ATOM 76179 H2 WAT 6625 87.623 56.446 152.467 1.00 0.00 H TER 76181 WAT 6625 ATOM 76181 O WAT 6626 34.689 116.541 14.735 1.00 0.00 O ATOM 76182 H1 WAT 6626 34.224 117.230 14.261 1.00 0.00 H ATOM 76183 H2 WAT 6626 34.403 115.728 14.319 1.00 0.00 H TER 76185 WAT 6626 ATOM 76185 O WAT 6627 140.718 18.095 150.889 1.00 0.00 O ATOM 76186 H1 WAT 6627 141.559 17.925 150.465 1.00 0.00 H ATOM 76187 H2 WAT 6627 140.774 19.006 151.177 1.00 0.00 H TER 76189 WAT 6627 ATOM 76189 O WAT 6628 2.849 13.910 101.554 1.00 0.00 O ATOM 76190 H1 WAT 6628 2.782 13.380 100.760 1.00 0.00 H ATOM 76191 H2 WAT 6628 3.382 13.384 102.149 1.00 0.00 H TER 76193 WAT 6628 ATOM 76193 O WAT 6629 129.282 64.692 135.763 1.00 0.00 O ATOM 76194 H1 WAT 6629 128.907 64.825 136.633 1.00 0.00 H ATOM 76195 H2 WAT 6629 129.023 65.469 135.268 1.00 0.00 H TER 76197 WAT 6629 ATOM 76197 O WAT 6630 89.625 121.326 12.384 1.00 0.00 O ATOM 76198 H1 WAT 6630 90.520 121.523 12.107 1.00 0.00 H ATOM 76199 H2 WAT 6630 89.611 120.375 12.488 1.00 0.00 H TER 76201 WAT 6630 ATOM 76201 O WAT 6631 5.462 18.995 96.946 1.00 0.00 O ATOM 76202 H1 WAT 6631 4.595 18.643 96.745 1.00 0.00 H ATOM 76203 H2 WAT 6631 5.928 18.979 96.110 1.00 0.00 H TER 76205 WAT 6631 ATOM 76205 O WAT 6632 125.692 67.338 144.350 1.00 0.00 O ATOM 76206 H1 WAT 6632 126.568 67.093 144.649 1.00 0.00 H ATOM 76207 H2 WAT 6632 125.793 68.232 144.022 1.00 0.00 H TER 76209 WAT 6632 ATOM 76209 O WAT 6633 56.007 99.587 3.323 1.00 0.00 O ATOM 76210 H1 WAT 6633 56.941 99.534 3.122 1.00 0.00 H ATOM 76211 H2 WAT 6633 55.871 98.928 4.004 1.00 0.00 H TER 76213 WAT 6633 ATOM 76213 O WAT 6634 32.553 53.059 141.886 1.00 0.00 O ATOM 76214 H1 WAT 6634 31.868 52.744 141.296 1.00 0.00 H ATOM 76215 H2 WAT 6634 33.265 53.326 141.305 1.00 0.00 H TER 76217 WAT 6634 ATOM 76217 O WAT 6635 59.564 89.136 15.711 1.00 0.00 O ATOM 76218 H1 WAT 6635 58.825 89.043 15.109 1.00 0.00 H ATOM 76219 H2 WAT 6635 59.203 89.603 16.464 1.00 0.00 H TER 76221 WAT 6635 ATOM 76221 O WAT 6636 11.768 70.551 118.025 1.00 0.00 O ATOM 76222 H1 WAT 6636 11.474 69.851 118.608 1.00 0.00 H ATOM 76223 H2 WAT 6636 11.570 70.228 117.146 1.00 0.00 H TER 76225 WAT 6636 ATOM 76225 O WAT 6637 109.656 92.868 84.158 1.00 0.00 O ATOM 76226 H1 WAT 6637 109.589 91.918 84.061 1.00 0.00 H ATOM 76227 H2 WAT 6637 109.648 93.014 85.104 1.00 0.00 H TER 76229 WAT 6637 ATOM 76229 O WAT 6638 142.869 91.192 104.348 1.00 0.00 O ATOM 76230 H1 WAT 6638 141.977 91.260 104.689 1.00 0.00 H ATOM 76231 H2 WAT 6638 142.835 90.459 103.734 1.00 0.00 H TER 76233 WAT 6638 ATOM 76233 O WAT 6639 63.261 14.875 4.760 1.00 0.00 O ATOM 76234 H1 WAT 6639 63.252 14.123 5.351 1.00 0.00 H ATOM 76235 H2 WAT 6639 62.346 14.992 4.506 1.00 0.00 H TER 76237 WAT 6639 ATOM 76237 O WAT 6640 38.546 137.880 98.086 1.00 0.00 O ATOM 76238 H1 WAT 6640 38.761 137.140 97.518 1.00 0.00 H ATOM 76239 H2 WAT 6640 39.365 138.081 98.538 1.00 0.00 H TER 76241 WAT 6640 ATOM 76241 O WAT 6641 77.333 63.066 134.097 1.00 0.00 O ATOM 76242 H1 WAT 6641 77.190 63.539 133.277 1.00 0.00 H ATOM 76243 H2 WAT 6641 78.078 62.493 133.916 1.00 0.00 H TER 76245 WAT 6641 ATOM 76245 O WAT 6642 17.461 90.977 146.319 1.00 0.00 O ATOM 76246 H1 WAT 6642 17.954 91.322 147.064 1.00 0.00 H ATOM 76247 H2 WAT 6642 17.898 91.347 145.552 1.00 0.00 H TER 76249 WAT 6642 ATOM 76249 O WAT 6643 66.891 94.990 106.221 1.00 0.00 O ATOM 76250 H1 WAT 6643 67.600 94.675 105.660 1.00 0.00 H ATOM 76251 H2 WAT 6643 67.329 95.525 106.883 1.00 0.00 H TER 76253 WAT 6643 ATOM 76253 O WAT 6644 75.558 54.677 142.749 1.00 0.00 O ATOM 76254 H1 WAT 6644 76.440 55.036 142.847 1.00 0.00 H ATOM 76255 H2 WAT 6644 75.080 55.005 143.511 1.00 0.00 H TER 76257 WAT 6644 ATOM 76257 O WAT 6645 68.431 142.258 99.141 1.00 0.00 O ATOM 76258 H1 WAT 6645 69.282 142.468 99.525 1.00 0.00 H ATOM 76259 H2 WAT 6645 68.608 142.151 98.207 1.00 0.00 H TER 76261 WAT 6645 ATOM 76261 O WAT 6646 124.155 34.086 107.400 1.00 0.00 O ATOM 76262 H1 WAT 6646 123.872 34.981 107.214 1.00 0.00 H ATOM 76263 H2 WAT 6646 123.417 33.540 107.129 1.00 0.00 H TER 76265 WAT 6646 ATOM 76265 O WAT 6647 112.025 101.323 133.088 1.00 0.00 O ATOM 76266 H1 WAT 6647 111.647 102.124 132.723 1.00 0.00 H ATOM 76267 H2 WAT 6647 111.546 101.184 133.905 1.00 0.00 H TER 76269 WAT 6647 ATOM 76269 O WAT 6648 18.435 28.792 107.633 1.00 0.00 O ATOM 76270 H1 WAT 6648 17.618 28.365 107.374 1.00 0.00 H ATOM 76271 H2 WAT 6648 18.425 29.629 107.170 1.00 0.00 H TER 76273 WAT 6648 ATOM 76273 O WAT 6649 91.544 112.706 122.073 1.00 0.00 O ATOM 76274 H1 WAT 6649 92.360 112.561 121.595 1.00 0.00 H ATOM 76275 H2 WAT 6649 90.896 112.885 121.391 1.00 0.00 H TER 76277 WAT 6649 ATOM 76277 O WAT 6650 66.747 33.416 112.804 1.00 0.00 O ATOM 76278 H1 WAT 6650 66.931 34.299 112.485 1.00 0.00 H ATOM 76279 H2 WAT 6650 67.176 32.839 112.172 1.00 0.00 H TER 76281 WAT 6650 ATOM 76281 O WAT 6651 73.573 11.354 96.064 1.00 0.00 O ATOM 76282 H1 WAT 6651 73.511 10.430 95.820 1.00 0.00 H ATOM 76283 H2 WAT 6651 73.761 11.806 95.241 1.00 0.00 H TER 76285 WAT 6651 ATOM 76285 O WAT 6652 117.331 93.460 156.537 1.00 0.00 O ATOM 76286 H1 WAT 6652 117.804 93.628 155.722 1.00 0.00 H ATOM 76287 H2 WAT 6652 117.970 93.641 157.226 1.00 0.00 H TER 76289 WAT 6652 ATOM 76289 O WAT 6653 14.558 28.805 13.693 1.00 0.00 O ATOM 76290 H1 WAT 6653 15.019 29.636 13.807 1.00 0.00 H ATOM 76291 H2 WAT 6653 14.243 28.584 14.569 1.00 0.00 H TER 76293 WAT 6653 ATOM 76293 O WAT 6654 102.520 103.673 93.844 1.00 0.00 O ATOM 76294 H1 WAT 6654 102.292 103.165 93.065 1.00 0.00 H ATOM 76295 H2 WAT 6654 101.687 104.031 94.149 1.00 0.00 H TER 76297 WAT 6654 ATOM 76297 O WAT 6655 63.010 145.244 105.776 1.00 0.00 O ATOM 76298 H1 WAT 6655 63.376 144.824 104.997 1.00 0.00 H ATOM 76299 H2 WAT 6655 63.723 145.229 106.414 1.00 0.00 H TER 76301 WAT 6655 ATOM 76301 O WAT 6656 28.772 103.290 76.015 1.00 0.00 O ATOM 76302 H1 WAT 6656 28.253 102.601 76.431 1.00 0.00 H ATOM 76303 H2 WAT 6656 28.362 103.416 75.160 1.00 0.00 H TER 76305 WAT 6656 ATOM 76305 O WAT 6657 85.395 70.549 132.703 1.00 0.00 O ATOM 76306 H1 WAT 6657 85.819 70.954 133.460 1.00 0.00 H ATOM 76307 H2 WAT 6657 85.276 71.268 132.082 1.00 0.00 H TER 76309 WAT 6657 ATOM 76309 O WAT 6658 68.562 7.482 128.750 1.00 0.00 O ATOM 76310 H1 WAT 6658 69.471 7.755 128.627 1.00 0.00 H ATOM 76311 H2 WAT 6658 68.050 8.277 128.602 1.00 0.00 H TER 76313 WAT 6658 ATOM 76313 O WAT 6659 78.990 65.813 14.480 1.00 0.00 O ATOM 76314 H1 WAT 6659 79.312 65.011 14.891 1.00 0.00 H ATOM 76315 H2 WAT 6659 79.568 66.501 14.809 1.00 0.00 H TER 76317 WAT 6659 ATOM 76317 O WAT 6660 136.786 21.928 156.751 1.00 0.00 O ATOM 76318 H1 WAT 6660 136.462 22.828 156.777 1.00 0.00 H ATOM 76319 H2 WAT 6660 136.056 21.421 156.393 1.00 0.00 H TER 76321 WAT 6660 ATOM 76321 O WAT 6661 28.818 39.261 118.942 1.00 0.00 O ATOM 76322 H1 WAT 6661 28.706 39.074 119.874 1.00 0.00 H ATOM 76323 H2 WAT 6661 28.651 40.200 118.865 1.00 0.00 H TER 76325 WAT 6661 ATOM 76325 O WAT 6662 127.227 6.292 7.849 1.00 0.00 O ATOM 76326 H1 WAT 6662 127.461 5.539 8.392 1.00 0.00 H ATOM 76327 H2 WAT 6662 126.368 6.069 7.489 1.00 0.00 H TER 76329 WAT 6662 ATOM 76329 O WAT 6663 12.193 83.031 118.578 1.00 0.00 O ATOM 76330 H1 WAT 6663 12.714 82.846 119.360 1.00 0.00 H ATOM 76331 H2 WAT 6663 11.755 82.202 118.381 1.00 0.00 H TER 76333 WAT 6663 ATOM 76333 O WAT 6664 93.316 90.853 67.648 1.00 0.00 O ATOM 76334 H1 WAT 6664 94.045 91.007 67.047 1.00 0.00 H ATOM 76335 H2 WAT 6664 93.010 91.729 67.882 1.00 0.00 H TER 76337 WAT 6664 ATOM 76337 O WAT 6665 106.338 97.801 11.635 1.00 0.00 O ATOM 76338 H1 WAT 6665 105.569 97.667 12.190 1.00 0.00 H ATOM 76339 H2 WAT 6665 107.038 98.028 12.247 1.00 0.00 H TER 76341 WAT 6665 ATOM 76341 O WAT 6666 95.054 11.214 141.531 1.00 0.00 O ATOM 76342 H1 WAT 6666 95.664 10.754 140.954 1.00 0.00 H ATOM 76343 H2 WAT 6666 95.276 10.905 142.409 1.00 0.00 H TER 76345 WAT 6666 ATOM 76345 O WAT 6667 31.427 111.907 2.686 1.00 0.00 O ATOM 76346 H1 WAT 6667 31.166 112.501 1.983 1.00 0.00 H ATOM 76347 H2 WAT 6667 30.852 112.133 3.417 1.00 0.00 H TER 76349 WAT 6667 ATOM 76349 O WAT 6668 35.629 137.775 150.276 1.00 0.00 O ATOM 76350 H1 WAT 6668 34.680 137.900 150.296 1.00 0.00 H ATOM 76351 H2 WAT 6668 35.972 138.440 150.873 1.00 0.00 H TER 76353 WAT 6668 ATOM 76353 O WAT 6669 92.689 132.835 140.371 1.00 0.00 O ATOM 76354 H1 WAT 6669 92.868 133.765 140.510 1.00 0.00 H ATOM 76355 H2 WAT 6669 92.244 132.800 139.524 1.00 0.00 H TER 76357 WAT 6669 ATOM 76357 O WAT 6670 114.076 45.409 111.138 1.00 0.00 O ATOM 76358 H1 WAT 6670 114.499 44.759 111.698 1.00 0.00 H ATOM 76359 H2 WAT 6670 114.625 45.444 110.355 1.00 0.00 H TER 76361 WAT 6670 ATOM 76361 O WAT 6671 21.227 29.666 9.363 1.00 0.00 O ATOM 76362 H1 WAT 6671 20.590 30.073 9.949 1.00 0.00 H ATOM 76363 H2 WAT 6671 20.696 29.260 8.677 1.00 0.00 H TER 76365 WAT 6671 ATOM 76365 O WAT 6672 99.544 20.279 102.750 1.00 0.00 O ATOM 76366 H1 WAT 6672 99.061 19.597 103.215 1.00 0.00 H ATOM 76367 H2 WAT 6672 100.453 19.978 102.760 1.00 0.00 H TER 76369 WAT 6672 ATOM 76369 O WAT 6673 61.914 128.120 128.790 1.00 0.00 O ATOM 76370 H1 WAT 6673 62.212 127.645 129.566 1.00 0.00 H ATOM 76371 H2 WAT 6673 61.138 127.642 128.499 1.00 0.00 H TER 76373 WAT 6673 ATOM 76373 O WAT 6674 11.857 129.424 98.024 1.00 0.00 O ATOM 76374 H1 WAT 6674 12.118 129.270 97.116 1.00 0.00 H ATOM 76375 H2 WAT 6674 10.916 129.245 98.036 1.00 0.00 H TER 76377 WAT 6674 ATOM 76377 O WAT 6675 74.288 135.630 121.096 1.00 0.00 O ATOM 76378 H1 WAT 6675 74.683 135.956 121.905 1.00 0.00 H ATOM 76379 H2 WAT 6675 73.347 135.740 121.228 1.00 0.00 H TER 76381 WAT 6675 ATOM 76381 O WAT 6676 84.003 61.072 158.369 1.00 0.00 O ATOM 76382 H1 WAT 6676 83.218 60.984 157.829 1.00 0.00 H ATOM 76383 H2 WAT 6676 83.699 60.911 159.262 1.00 0.00 H TER 76385 WAT 6676 ATOM 76385 O WAT 6677 102.798 95.822 103.842 1.00 0.00 O ATOM 76386 H1 WAT 6677 102.463 95.677 102.958 1.00 0.00 H ATOM 76387 H2 WAT 6677 102.042 95.678 104.412 1.00 0.00 H TER 76389 WAT 6677 ATOM 76389 O WAT 6678 27.127 79.085 129.125 1.00 0.00 O ATOM 76390 H1 WAT 6678 27.428 78.919 128.232 1.00 0.00 H ATOM 76391 H2 WAT 6678 26.560 79.853 129.048 1.00 0.00 H TER 76393 WAT 6678 ATOM 76393 O WAT 6679 3.013 89.453 150.834 1.00 0.00 O ATOM 76394 H1 WAT 6679 2.179 89.026 150.639 1.00 0.00 H ATOM 76395 H2 WAT 6679 3.657 88.964 150.322 1.00 0.00 H TER 76397 WAT 6679 ATOM 76397 O WAT 6680 138.985 128.610 121.212 1.00 0.00 O ATOM 76398 H1 WAT 6680 138.079 128.378 121.416 1.00 0.00 H ATOM 76399 H2 WAT 6680 139.039 129.548 121.393 1.00 0.00 H TER 76401 WAT 6680 ATOM 76401 O WAT 6681 65.428 73.642 67.793 1.00 0.00 O ATOM 76402 H1 WAT 6681 64.519 73.359 67.692 1.00 0.00 H ATOM 76403 H2 WAT 6681 65.480 73.963 68.693 1.00 0.00 H TER 76405 WAT 6681 ATOM 76405 O WAT 6682 123.083 54.844 106.792 1.00 0.00 O ATOM 76406 H1 WAT 6682 123.059 55.751 107.099 1.00 0.00 H ATOM 76407 H2 WAT 6682 122.900 54.323 107.573 1.00 0.00 H TER 76409 WAT 6682 ATOM 76409 O WAT 6683 142.937 42.852 89.179 1.00 0.00 O ATOM 76410 H1 WAT 6683 143.519 42.256 88.709 1.00 0.00 H ATOM 76411 H2 WAT 6683 142.979 42.559 90.090 1.00 0.00 H TER 76413 WAT 6683 ATOM 76413 O WAT 6684 75.410 29.616 129.337 1.00 0.00 O ATOM 76414 H1 WAT 6684 74.646 30.085 129.673 1.00 0.00 H ATOM 76415 H2 WAT 6684 75.942 30.293 128.918 1.00 0.00 H TER 76417 WAT 6684 ATOM 76417 O WAT 6685 101.741 70.101 129.379 1.00 0.00 O ATOM 76418 H1 WAT 6685 101.563 70.009 128.443 1.00 0.00 H ATOM 76419 H2 WAT 6685 101.987 69.221 129.664 1.00 0.00 H TER 76421 WAT 6685 ATOM 76421 O WAT 6686 122.081 45.636 145.548 1.00 0.00 O ATOM 76422 H1 WAT 6686 121.465 45.947 146.212 1.00 0.00 H ATOM 76423 H2 WAT 6686 122.368 46.431 145.098 1.00 0.00 H TER 76425 WAT 6686 ATOM 76425 O WAT 6687 50.674 49.497 81.038 1.00 0.00 O ATOM 76426 H1 WAT 6687 49.836 49.738 80.643 1.00 0.00 H ATOM 76427 H2 WAT 6687 50.760 48.560 80.863 1.00 0.00 H TER 76429 WAT 6687 ATOM 76429 O WAT 6688 137.632 135.516 82.025 1.00 0.00 O ATOM 76430 H1 WAT 6688 137.368 136.352 81.641 1.00 0.00 H ATOM 76431 H2 WAT 6688 137.837 135.725 82.936 1.00 0.00 H TER 76433 WAT 6688 ATOM 76433 O WAT 6689 91.700 25.436 136.925 1.00 0.00 O ATOM 76434 H1 WAT 6689 91.545 25.054 137.789 1.00 0.00 H ATOM 76435 H2 WAT 6689 91.412 26.344 137.009 1.00 0.00 H TER 76437 WAT 6689 ATOM 76437 O WAT 6690 17.139 54.520 80.369 1.00 0.00 O ATOM 76438 H1 WAT 6690 16.635 54.724 81.157 1.00 0.00 H ATOM 76439 H2 WAT 6690 16.987 53.586 80.223 1.00 0.00 H TER 76441 WAT 6690 ATOM 76441 O WAT 6691 137.774 52.138 131.383 1.00 0.00 O ATOM 76442 H1 WAT 6691 137.204 51.742 130.723 1.00 0.00 H ATOM 76443 H2 WAT 6691 137.264 52.102 132.192 1.00 0.00 H TER 76445 WAT 6691 ATOM 76445 O WAT 6692 108.853 94.293 17.488 1.00 0.00 O ATOM 76446 H1 WAT 6692 108.726 95.011 18.107 1.00 0.00 H ATOM 76447 H2 WAT 6692 109.184 93.571 18.022 1.00 0.00 H TER 76449 WAT 6692 ATOM 76449 O WAT 6693 65.472 112.334 118.382 1.00 0.00 O ATOM 76450 H1 WAT 6693 65.579 111.535 117.865 1.00 0.00 H ATOM 76451 H2 WAT 6693 66.065 112.219 119.125 1.00 0.00 H TER 76453 WAT 6693 ATOM 76453 O WAT 6694 7.407 59.076 7.949 1.00 0.00 O ATOM 76454 H1 WAT 6694 6.866 59.574 8.562 1.00 0.00 H ATOM 76455 H2 WAT 6694 7.626 58.273 8.420 1.00 0.00 H TER 76457 WAT 6694 ATOM 76457 O WAT 6695 134.372 16.127 68.343 1.00 0.00 O ATOM 76458 H1 WAT 6695 134.533 16.459 67.460 1.00 0.00 H ATOM 76459 H2 WAT 6695 133.766 16.759 68.730 1.00 0.00 H TER 76461 WAT 6695 ATOM 76461 O WAT 6696 133.322 65.300 3.666 1.00 0.00 O ATOM 76462 H1 WAT 6696 133.380 65.697 2.798 1.00 0.00 H ATOM 76463 H2 WAT 6696 134.075 64.711 3.711 1.00 0.00 H TER 76465 WAT 6696 ATOM 76465 O WAT 6697 51.841 24.028 151.997 1.00 0.00 O ATOM 76466 H1 WAT 6697 51.880 23.402 152.721 1.00 0.00 H ATOM 76467 H2 WAT 6697 52.520 24.671 152.200 1.00 0.00 H TER 76469 WAT 6697 ATOM 76469 O WAT 6698 136.599 64.317 79.084 1.00 0.00 O ATOM 76470 H1 WAT 6698 135.856 64.130 78.511 1.00 0.00 H ATOM 76471 H2 WAT 6698 136.674 63.541 79.640 1.00 0.00 H TER 76473 WAT 6698 ATOM 76473 O WAT 6699 49.612 139.432 158.195 1.00 0.00 O ATOM 76474 H1 WAT 6699 50.423 139.894 158.408 1.00 0.00 H ATOM 76475 H2 WAT 6699 49.546 138.745 158.859 1.00 0.00 H TER 76477 WAT 6699 ATOM 76477 O WAT 6700 108.831 92.334 144.176 1.00 0.00 O ATOM 76478 H1 WAT 6700 108.087 92.528 144.745 1.00 0.00 H ATOM 76479 H2 WAT 6700 108.818 91.382 144.080 1.00 0.00 H TER 76481 WAT 6700 ATOM 76481 O WAT 6701 84.797 80.665 23.976 1.00 0.00 O ATOM 76482 H1 WAT 6701 85.498 80.208 23.513 1.00 0.00 H ATOM 76483 H2 WAT 6701 84.094 80.019 24.044 1.00 0.00 H TER 76485 WAT 6701 ATOM 76485 O WAT 6702 11.684 17.304 112.427 1.00 0.00 O ATOM 76486 H1 WAT 6702 11.244 17.929 113.003 1.00 0.00 H ATOM 76487 H2 WAT 6702 11.133 16.522 112.456 1.00 0.00 H TER 76489 WAT 6702 ATOM 76489 O WAT 6703 63.929 7.281 105.056 1.00 0.00 O ATOM 76490 H1 WAT 6703 64.166 7.334 105.982 1.00 0.00 H ATOM 76491 H2 WAT 6703 64.557 6.662 104.684 1.00 0.00 H TER 76493 WAT 6703 ATOM 76493 O WAT 6704 50.942 107.006 144.744 1.00 0.00 O ATOM 76494 H1 WAT 6704 51.652 106.400 144.535 1.00 0.00 H ATOM 76495 H2 WAT 6704 51.091 107.245 145.659 1.00 0.00 H TER 76497 WAT 6704 ATOM 76497 O WAT 6705 58.577 95.016 141.869 1.00 0.00 O ATOM 76498 H1 WAT 6705 59.083 95.144 142.672 1.00 0.00 H ATOM 76499 H2 WAT 6705 58.097 95.836 141.756 1.00 0.00 H TER 76501 WAT 6705 ATOM 76501 O WAT 6706 22.932 80.188 13.602 1.00 0.00 O ATOM 76502 H1 WAT 6706 22.518 80.233 14.464 1.00 0.00 H ATOM 76503 H2 WAT 6706 23.042 79.251 13.438 1.00 0.00 H TER 76505 WAT 6706 ATOM 76505 O WAT 6707 64.625 67.860 118.856 1.00 0.00 O ATOM 76506 H1 WAT 6707 63.980 67.782 118.153 1.00 0.00 H ATOM 76507 H2 WAT 6707 64.115 68.129 119.620 1.00 0.00 H TER 76509 WAT 6707 ATOM 76509 O WAT 6708 16.609 10.611 103.304 1.00 0.00 O ATOM 76510 H1 WAT 6708 16.510 10.517 102.357 1.00 0.00 H ATOM 76511 H2 WAT 6708 17.555 10.645 103.444 1.00 0.00 H TER 76513 WAT 6708 ATOM 76513 O WAT 6709 55.654 61.271 61.294 1.00 0.00 O ATOM 76514 H1 WAT 6709 55.123 60.555 60.946 1.00 0.00 H ATOM 76515 H2 WAT 6709 55.159 62.062 61.078 1.00 0.00 H TER 76517 WAT 6709 ATOM 76517 O WAT 6710 42.414 25.888 22.127 1.00 0.00 O ATOM 76518 H1 WAT 6710 41.506 25.592 22.073 1.00 0.00 H ATOM 76519 H2 WAT 6710 42.931 25.127 21.862 1.00 0.00 H TER 76521 WAT 6710 ATOM 76521 O WAT 6711 40.176 132.609 86.169 1.00 0.00 O ATOM 76522 H1 WAT 6711 39.640 132.089 85.571 1.00 0.00 H ATOM 76523 H2 WAT 6711 40.762 133.104 85.597 1.00 0.00 H TER 76525 WAT 6711 ATOM 76525 O WAT 6712 118.913 135.424 127.584 1.00 0.00 O ATOM 76526 H1 WAT 6712 119.505 134.861 128.082 1.00 0.00 H ATOM 76527 H2 WAT 6712 118.519 135.998 128.241 1.00 0.00 H TER 76529 WAT 6712 ATOM 76529 O WAT 6713 90.772 80.093 94.014 1.00 0.00 O ATOM 76530 H1 WAT 6713 90.681 79.380 94.647 1.00 0.00 H ATOM 76531 H2 WAT 6713 91.368 80.713 94.436 1.00 0.00 H TER 76533 WAT 6713 ATOM 76533 O WAT 6714 8.314 118.850 76.572 1.00 0.00 O ATOM 76534 H1 WAT 6714 8.743 118.304 77.231 1.00 0.00 H ATOM 76535 H2 WAT 6714 9.026 119.354 76.178 1.00 0.00 H TER 76537 WAT 6714 ATOM 76537 O WAT 6715 85.576 90.432 123.171 1.00 0.00 O ATOM 76538 H1 WAT 6715 85.394 91.147 122.561 1.00 0.00 H ATOM 76539 H2 WAT 6715 84.719 90.047 123.352 1.00 0.00 H TER 76541 WAT 6715 ATOM 76541 O WAT 6716 74.176 136.500 129.338 1.00 0.00 O ATOM 76542 H1 WAT 6716 74.565 136.251 130.176 1.00 0.00 H ATOM 76543 H2 WAT 6716 73.857 135.677 128.967 1.00 0.00 H TER 76545 WAT 6716 ATOM 76545 O WAT 6717 89.101 123.498 148.343 1.00 0.00 O ATOM 76546 H1 WAT 6717 89.369 123.799 149.212 1.00 0.00 H ATOM 76547 H2 WAT 6717 89.836 123.726 147.774 1.00 0.00 H TER 76549 WAT 6717 ATOM 76549 O WAT 6718 97.564 89.656 6.764 1.00 0.00 O ATOM 76550 H1 WAT 6718 98.464 89.366 6.618 1.00 0.00 H ATOM 76551 H2 WAT 6718 97.030 88.885 6.572 1.00 0.00 H TER 76553 WAT 6718 ATOM 76553 O WAT 6719 91.608 10.368 118.742 1.00 0.00 O ATOM 76554 H1 WAT 6719 91.776 10.540 119.669 1.00 0.00 H ATOM 76555 H2 WAT 6719 91.284 11.201 118.399 1.00 0.00 H TER 76557 WAT 6719 ATOM 76557 O WAT 6720 42.709 98.139 93.809 1.00 0.00 O ATOM 76558 H1 WAT 6720 42.257 98.686 93.167 1.00 0.00 H ATOM 76559 H2 WAT 6720 42.055 97.492 94.075 1.00 0.00 H TER 76561 WAT 6720 ATOM 76561 O WAT 6721 53.511 11.133 114.655 1.00 0.00 O ATOM 76562 H1 WAT 6721 52.571 11.309 114.675 1.00 0.00 H ATOM 76563 H2 WAT 6721 53.762 11.276 113.742 1.00 0.00 H TER 76565 WAT 6721 ATOM 76565 O WAT 6722 129.877 95.255 20.858 1.00 0.00 O ATOM 76566 H1 WAT 6722 130.379 94.448 20.964 1.00 0.00 H ATOM 76567 H2 WAT 6722 129.494 95.185 19.983 1.00 0.00 H TER 76569 WAT 6722 ATOM 76569 O WAT 6723 92.208 129.764 87.896 1.00 0.00 O ATOM 76570 H1 WAT 6723 92.282 128.884 88.263 1.00 0.00 H ATOM 76571 H2 WAT 6723 93.040 129.907 87.446 1.00 0.00 H TER 76573 WAT 6723 ATOM 76573 O WAT 6724 46.786 11.907 141.943 1.00 0.00 O ATOM 76574 H1 WAT 6724 47.686 11.662 141.731 1.00 0.00 H ATOM 76575 H2 WAT 6724 46.840 12.830 142.191 1.00 0.00 H TER 76577 WAT 6724 ATOM 76577 O WAT 6725 22.057 15.962 138.008 1.00 0.00 O ATOM 76578 H1 WAT 6725 22.564 16.766 138.117 1.00 0.00 H ATOM 76579 H2 WAT 6725 22.716 15.271 137.940 1.00 0.00 H TER 76581 WAT 6725 ATOM 76581 O WAT 6726 45.345 16.271 140.462 1.00 0.00 O ATOM 76582 H1 WAT 6726 45.276 15.489 139.914 1.00 0.00 H ATOM 76583 H2 WAT 6726 44.493 16.698 140.377 1.00 0.00 H TER 76585 WAT 6726 ATOM 76585 O WAT 6727 57.763 138.658 107.759 1.00 0.00 O ATOM 76586 H1 WAT 6727 58.312 139.442 107.765 1.00 0.00 H ATOM 76587 H2 WAT 6727 56.950 138.932 108.184 1.00 0.00 H TER 76589 WAT 6727 ATOM 76589 O WAT 6728 87.903 86.040 154.284 1.00 0.00 O ATOM 76590 H1 WAT 6728 87.939 86.836 153.753 1.00 0.00 H ATOM 76591 H2 WAT 6728 87.375 85.431 153.768 1.00 0.00 H TER 76593 WAT 6728 ATOM 76593 O WAT 6729 30.584 134.761 20.923 1.00 0.00 O ATOM 76594 H1 WAT 6729 29.966 134.249 20.402 1.00 0.00 H ATOM 76595 H2 WAT 6729 30.281 135.665 20.835 1.00 0.00 H TER 76597 WAT 6729 ATOM 76597 O WAT 6730 142.876 6.323 61.252 1.00 0.00 O ATOM 76598 H1 WAT 6730 143.419 5.559 61.446 1.00 0.00 H ATOM 76599 H2 WAT 6730 142.019 5.959 61.032 1.00 0.00 H TER 76601 WAT 6730 ATOM 76601 O WAT 6731 70.805 95.018 17.631 1.00 0.00 O ATOM 76602 H1 WAT 6731 71.069 95.529 18.396 1.00 0.00 H ATOM 76603 H2 WAT 6731 69.919 94.721 17.835 1.00 0.00 H TER 76605 WAT 6731 ATOM 76605 O WAT 6732 136.763 127.546 1.991 1.00 0.00 O ATOM 76606 H1 WAT 6732 136.252 128.198 2.470 1.00 0.00 H ATOM 76607 H2 WAT 6732 136.433 126.704 2.306 1.00 0.00 H TER 76609 WAT 6732 ATOM 76609 O WAT 6733 78.224 95.419 60.554 1.00 0.00 O ATOM 76610 H1 WAT 6733 77.339 95.318 60.903 1.00 0.00 H ATOM 76611 H2 WAT 6733 78.182 95.034 59.678 1.00 0.00 H TER 76613 WAT 6733 ATOM 76613 O WAT 6734 87.815 48.790 130.961 1.00 0.00 O ATOM 76614 H1 WAT 6734 88.626 48.284 130.916 1.00 0.00 H ATOM 76615 H2 WAT 6734 87.325 48.526 130.182 1.00 0.00 H TER 76617 WAT 6734 ATOM 76617 O WAT 6735 42.024 134.412 84.802 1.00 0.00 O ATOM 76618 H1 WAT 6735 42.964 134.585 84.844 1.00 0.00 H ATOM 76619 H2 WAT 6735 41.652 134.940 85.509 1.00 0.00 H TER 76621 WAT 6735 ATOM 76621 O WAT 6736 26.084 89.939 139.333 1.00 0.00 O ATOM 76622 H1 WAT 6736 25.257 89.536 139.070 1.00 0.00 H ATOM 76623 H2 WAT 6736 26.757 89.344 139.002 1.00 0.00 H TER 76625 WAT 6736 ATOM 76625 O WAT 6737 97.014 37.282 102.759 1.00 0.00 O ATOM 76626 H1 WAT 6737 97.883 36.912 102.603 1.00 0.00 H ATOM 76627 H2 WAT 6737 97.121 38.220 102.606 1.00 0.00 H TER 76629 WAT 6737 ATOM 76629 O WAT 6738 74.760 49.879 111.286 1.00 0.00 O ATOM 76630 H1 WAT 6738 75.074 49.120 111.777 1.00 0.00 H ATOM 76631 H2 WAT 6738 74.439 50.482 111.956 1.00 0.00 H TER 76633 WAT 6738 ATOM 76633 O WAT 6739 10.519 58.801 78.692 1.00 0.00 O ATOM 76634 H1 WAT 6739 9.831 58.397 78.163 1.00 0.00 H ATOM 76635 H2 WAT 6739 10.278 59.726 78.732 1.00 0.00 H TER 76637 WAT 6739 ATOM 76637 O WAT 6740 25.738 26.129 76.468 1.00 0.00 O ATOM 76638 H1 WAT 6740 25.565 25.362 77.014 1.00 0.00 H ATOM 76639 H2 WAT 6740 25.313 25.930 75.634 1.00 0.00 H TER 76641 WAT 6740 ATOM 76641 O WAT 6741 2.071 55.183 92.833 1.00 0.00 O ATOM 76642 H1 WAT 6741 1.731 55.075 93.721 1.00 0.00 H ATOM 76643 H2 WAT 6741 3.008 55.339 92.953 1.00 0.00 H TER 76645 WAT 6741 ATOM 76645 O WAT 6742 33.379 10.311 140.534 1.00 0.00 O ATOM 76646 H1 WAT 6742 33.010 9.514 140.153 1.00 0.00 H ATOM 76647 H2 WAT 6742 32.838 11.018 140.181 1.00 0.00 H TER 76649 WAT 6742 ATOM 76649 O WAT 6743 54.086 29.720 157.994 1.00 0.00 O ATOM 76650 H1 WAT 6743 54.407 30.467 158.501 1.00 0.00 H ATOM 76651 H2 WAT 6743 54.622 28.984 158.286 1.00 0.00 H TER 76653 WAT 6743 ATOM 76653 O WAT 6744 142.732 20.518 12.485 1.00 0.00 O ATOM 76654 H1 WAT 6744 143.026 20.834 11.630 1.00 0.00 H ATOM 76655 H2 WAT 6744 141.784 20.645 12.474 1.00 0.00 H TER 76657 WAT 6744 ATOM 76657 O WAT 6745 74.224 17.918 72.774 1.00 0.00 O ATOM 76658 H1 WAT 6745 75.023 18.167 73.239 1.00 0.00 H ATOM 76659 H2 WAT 6745 74.249 18.428 71.965 1.00 0.00 H TER 76661 WAT 6745 ATOM 76661 O WAT 6746 136.475 63.264 60.099 1.00 0.00 O ATOM 76662 H1 WAT 6746 137.309 62.834 60.293 1.00 0.00 H ATOM 76663 H2 WAT 6746 136.498 64.073 60.610 1.00 0.00 H TER 76665 WAT 6746 ATOM 76665 O WAT 6747 130.973 33.288 89.791 1.00 0.00 O ATOM 76666 H1 WAT 6747 131.621 33.913 89.466 1.00 0.00 H ATOM 76667 H2 WAT 6747 130.910 33.473 90.728 1.00 0.00 H TER 76669 WAT 6747 ATOM 76669 O WAT 6748 123.429 69.302 61.727 1.00 0.00 O ATOM 76670 H1 WAT 6748 122.802 70.018 61.827 1.00 0.00 H ATOM 76671 H2 WAT 6748 124.006 69.381 62.487 1.00 0.00 H TER 76673 WAT 6748 ATOM 76673 O WAT 6749 52.439 13.372 82.436 1.00 0.00 O ATOM 76674 H1 WAT 6749 52.872 14.180 82.160 1.00 0.00 H ATOM 76675 H2 WAT 6749 52.994 13.030 83.136 1.00 0.00 H TER 76677 WAT 6749 ATOM 76677 O WAT 6750 77.099 51.666 81.560 1.00 0.00 O ATOM 76678 H1 WAT 6750 77.616 51.236 80.879 1.00 0.00 H ATOM 76679 H2 WAT 6750 77.430 52.564 81.582 1.00 0.00 H TER 76681 WAT 6750 ATOM 76681 O WAT 6751 46.963 114.704 0.578 1.00 0.00 O ATOM 76682 H1 WAT 6751 47.056 114.361 -0.310 1.00 0.00 H ATOM 76683 H2 WAT 6751 46.479 114.024 1.048 1.00 0.00 H TER 76685 WAT 6751 ATOM 76685 O WAT 6752 105.255 19.643 130.183 1.00 0.00 O ATOM 76686 H1 WAT 6752 105.055 20.299 130.851 1.00 0.00 H ATOM 76687 H2 WAT 6752 106.207 19.550 130.217 1.00 0.00 H TER 76689 WAT 6752 ATOM 76689 O WAT 6753 27.780 126.227 94.834 1.00 0.00 O ATOM 76690 H1 WAT 6753 27.717 125.338 95.182 1.00 0.00 H ATOM 76691 H2 WAT 6753 26.871 126.509 94.731 1.00 0.00 H TER 76693 WAT 6753 ATOM 76693 O WAT 6754 109.015 9.051 152.638 1.00 0.00 O ATOM 76694 H1 WAT 6754 109.611 9.359 153.321 1.00 0.00 H ATOM 76695 H2 WAT 6754 108.717 9.850 152.202 1.00 0.00 H TER 76697 WAT 6754 ATOM 76697 O WAT 6755 145.872 120.868 9.560 1.00 0.00 O ATOM 76698 H1 WAT 6755 146.040 121.508 8.868 1.00 0.00 H ATOM 76699 H2 WAT 6755 145.008 120.513 9.353 1.00 0.00 H TER 76701 WAT 6755 ATOM 76701 O WAT 6756 9.628 20.350 64.376 1.00 0.00 O ATOM 76702 H1 WAT 6756 10.208 20.911 63.862 1.00 0.00 H ATOM 76703 H2 WAT 6756 8.868 20.900 64.566 1.00 0.00 H TER 76705 WAT 6756 ATOM 76705 O WAT 6757 141.515 37.117 121.753 1.00 0.00 O ATOM 76706 H1 WAT 6757 141.807 36.474 122.400 1.00 0.00 H ATOM 76707 H2 WAT 6757 141.035 37.769 122.264 1.00 0.00 H TER 76709 WAT 6757 ATOM 76709 O WAT 6758 5.209 113.754 16.705 1.00 0.00 O ATOM 76710 H1 WAT 6758 5.764 112.975 16.743 1.00 0.00 H ATOM 76711 H2 WAT 6758 4.820 113.814 17.578 1.00 0.00 H TER 76713 WAT 6758 ATOM 76713 O WAT 6759 60.782 43.720 100.017 1.00 0.00 O ATOM 76714 H1 WAT 6759 61.736 43.666 100.066 1.00 0.00 H ATOM 76715 H2 WAT 6759 60.560 44.505 100.519 1.00 0.00 H TER 76717 WAT 6759 ATOM 76717 O WAT 6760 94.493 33.041 129.649 1.00 0.00 O ATOM 76718 H1 WAT 6760 94.351 33.866 130.114 1.00 0.00 H ATOM 76719 H2 WAT 6760 94.059 32.382 130.191 1.00 0.00 H TER 76721 WAT 6760 ATOM 76721 O WAT 6761 17.841 57.234 125.883 1.00 0.00 O ATOM 76722 H1 WAT 6761 18.080 57.109 126.802 1.00 0.00 H ATOM 76723 H2 WAT 6761 17.937 58.175 125.737 1.00 0.00 H TER 76725 WAT 6761 ATOM 76725 O WAT 6762 133.689 143.168 146.601 1.00 0.00 O ATOM 76726 H1 WAT 6762 133.966 143.838 147.227 1.00 0.00 H ATOM 76727 H2 WAT 6762 134.093 143.432 145.774 1.00 0.00 H TER 76729 WAT 6762 ATOM 76729 O WAT 6763 54.920 111.193 92.655 1.00 0.00 O ATOM 76730 H1 WAT 6763 54.003 111.439 92.777 1.00 0.00 H ATOM 76731 H2 WAT 6763 55.413 111.867 93.121 1.00 0.00 H TER 76733 WAT 6763 ATOM 76733 O WAT 6764 68.862 48.145 114.946 1.00 0.00 O ATOM 76734 H1 WAT 6764 69.374 47.481 114.485 1.00 0.00 H ATOM 76735 H2 WAT 6764 68.246 48.472 114.289 1.00 0.00 H TER 76737 WAT 6764 ATOM 76737 O WAT 6765 91.106 135.631 104.952 1.00 0.00 O ATOM 76738 H1 WAT 6765 90.527 136.382 104.818 1.00 0.00 H ATOM 76739 H2 WAT 6765 90.637 135.074 105.572 1.00 0.00 H TER 76741 WAT 6765 ATOM 76741 O WAT 6766 65.055 4.352 111.114 1.00 0.00 O ATOM 76742 H1 WAT 6766 65.247 3.977 110.255 1.00 0.00 H ATOM 76743 H2 WAT 6766 65.911 4.601 111.464 1.00 0.00 H TER 76745 WAT 6766 ATOM 76745 O WAT 6767 11.023 142.024 73.425 1.00 0.00 O ATOM 76746 H1 WAT 6767 11.240 141.477 74.180 1.00 0.00 H ATOM 76747 H2 WAT 6767 10.834 142.885 73.800 1.00 0.00 H TER 76749 WAT 6767 ATOM 76749 O WAT 6768 82.781 36.602 128.399 1.00 0.00 O ATOM 76750 H1 WAT 6768 82.580 37.534 128.311 1.00 0.00 H ATOM 76751 H2 WAT 6768 82.684 36.252 127.513 1.00 0.00 H TER 76753 WAT 6768 ATOM 76753 O WAT 6769 3.780 86.368 118.586 1.00 0.00 O ATOM 76754 H1 WAT 6769 3.466 85.495 118.824 1.00 0.00 H ATOM 76755 H2 WAT 6769 4.714 86.249 118.415 1.00 0.00 H TER 76757 WAT 6769 ATOM 76757 O WAT 6770 75.299 45.362 19.664 1.00 0.00 O ATOM 76758 H1 WAT 6770 76.130 44.892 19.587 1.00 0.00 H ATOM 76759 H2 WAT 6770 75.184 45.787 18.814 1.00 0.00 H TER 76761 WAT 6770 ATOM 76761 O WAT 6771 11.173 86.907 80.709 1.00 0.00 O ATOM 76762 H1 WAT 6771 10.405 86.338 80.653 1.00 0.00 H ATOM 76763 H2 WAT 6771 11.622 86.624 81.506 1.00 0.00 H TER 76765 WAT 6771 ATOM 76765 O WAT 6772 21.682 146.134 94.656 1.00 0.00 O ATOM 76766 H1 WAT 6772 21.526 145.333 94.156 1.00 0.00 H ATOM 76767 H2 WAT 6772 21.299 145.959 95.515 1.00 0.00 H TER 76769 WAT 6772 ATOM 76769 O WAT 6773 46.470 123.556 74.191 1.00 0.00 O ATOM 76770 H1 WAT 6773 46.804 122.684 74.403 1.00 0.00 H ATOM 76771 H2 WAT 6773 46.674 123.670 73.262 1.00 0.00 H TER 76773 WAT 6773 ATOM 76773 O WAT 6774 101.488 34.804 92.635 1.00 0.00 O ATOM 76774 H1 WAT 6774 101.314 34.010 92.129 1.00 0.00 H ATOM 76775 H2 WAT 6774 101.544 35.499 91.979 1.00 0.00 H TER 76777 WAT 6774 ATOM 76777 O WAT 6775 61.656 94.299 150.704 1.00 0.00 O ATOM 76778 H1 WAT 6775 61.886 94.901 149.996 1.00 0.00 H ATOM 76779 H2 WAT 6775 60.700 94.265 150.688 1.00 0.00 H TER 76781 WAT 6775 ATOM 76781 O WAT 6776 132.382 87.984 112.869 1.00 0.00 O ATOM 76782 H1 WAT 6776 132.708 87.101 113.041 1.00 0.00 H ATOM 76783 H2 WAT 6776 132.499 88.104 111.927 1.00 0.00 H TER 76785 WAT 6776 ATOM 76785 O WAT 6777 70.278 113.425 97.236 1.00 0.00 O ATOM 76786 H1 WAT 6777 71.035 113.665 96.700 1.00 0.00 H ATOM 76787 H2 WAT 6777 70.295 112.468 97.258 1.00 0.00 H TER 76789 WAT 6777 ATOM 76789 O WAT 6778 90.036 3.395 142.130 1.00 0.00 O ATOM 76790 H1 WAT 6778 89.542 2.966 141.431 1.00 0.00 H ATOM 76791 H2 WAT 6778 90.536 4.079 141.684 1.00 0.00 H TER 76793 WAT 6778 ATOM 76793 O WAT 6779 13.987 87.463 107.224 1.00 0.00 O ATOM 76794 H1 WAT 6779 14.867 87.601 106.874 1.00 0.00 H ATOM 76795 H2 WAT 6779 13.876 88.158 107.873 1.00 0.00 H TER 76797 WAT 6779 ATOM 76797 O WAT 6780 58.791 57.403 140.033 1.00 0.00 O ATOM 76798 H1 WAT 6780 59.077 58.225 139.635 1.00 0.00 H ATOM 76799 H2 WAT 6780 57.838 57.411 139.939 1.00 0.00 H TER 76801 WAT 6780 ATOM 76801 O WAT 6781 18.617 3.978 89.939 1.00 0.00 O ATOM 76802 H1 WAT 6781 19.081 3.270 90.385 1.00 0.00 H ATOM 76803 H2 WAT 6781 19.077 4.773 90.208 1.00 0.00 H TER 76805 WAT 6781 ATOM 76805 O WAT 6782 116.717 49.782 123.688 1.00 0.00 O ATOM 76806 H1 WAT 6782 116.346 49.082 123.150 1.00 0.00 H ATOM 76807 H2 WAT 6782 117.662 49.633 123.656 1.00 0.00 H TER 76809 WAT 6782 ATOM 76809 O WAT 6783 91.958 0.558 158.341 1.00 0.00 O ATOM 76810 H1 WAT 6783 91.648 0.695 157.445 1.00 0.00 H ATOM 76811 H2 WAT 6783 91.189 0.241 158.814 1.00 0.00 H TER 76813 WAT 6783 ATOM 76813 O WAT 6784 38.962 77.454 90.019 1.00 0.00 O ATOM 76814 H1 WAT 6784 39.301 77.396 89.126 1.00 0.00 H ATOM 76815 H2 WAT 6784 38.021 77.304 89.929 1.00 0.00 H TER 76817 WAT 6784 ATOM 76817 O WAT 6785 96.543 143.583 90.376 1.00 0.00 O ATOM 76818 H1 WAT 6785 96.248 143.314 91.246 1.00 0.00 H ATOM 76819 H2 WAT 6785 97.366 143.113 90.247 1.00 0.00 H TER 76821 WAT 6785 ATOM 76821 O WAT 6786 121.162 43.071 153.539 1.00 0.00 O ATOM 76822 H1 WAT 6786 121.482 42.260 153.143 1.00 0.00 H ATOM 76823 H2 WAT 6786 121.011 43.657 152.798 1.00 0.00 H TER 76825 WAT 6786 ATOM 76825 O WAT 6787 70.850 3.097 105.643 1.00 0.00 O ATOM 76826 H1 WAT 6787 71.135 2.281 106.056 1.00 0.00 H ATOM 76827 H2 WAT 6787 71.472 3.753 105.956 1.00 0.00 H TER 76829 WAT 6787 ATOM 76829 O WAT 6788 120.992 37.030 27.084 1.00 0.00 O ATOM 76830 H1 WAT 6788 120.929 36.201 26.610 1.00 0.00 H ATOM 76831 H2 WAT 6788 120.172 37.089 27.574 1.00 0.00 H TER 76833 WAT 6788 ATOM 76833 O WAT 6789 36.655 51.417 134.635 1.00 0.00 O ATOM 76834 H1 WAT 6789 35.836 51.143 134.222 1.00 0.00 H ATOM 76835 H2 WAT 6789 36.936 50.653 135.139 1.00 0.00 H TER 76837 WAT 6789 ATOM 76837 O WAT 6790 43.071 5.339 118.873 1.00 0.00 O ATOM 76838 H1 WAT 6790 42.593 5.727 119.606 1.00 0.00 H ATOM 76839 H2 WAT 6790 43.607 6.055 118.531 1.00 0.00 H TER 76841 WAT 6790 ATOM 76841 O WAT 6791 136.861 77.611 100.076 1.00 0.00 O ATOM 76842 H1 WAT 6791 136.859 77.297 100.981 1.00 0.00 H ATOM 76843 H2 WAT 6791 137.278 76.907 99.580 1.00 0.00 H TER 76845 WAT 6791 ATOM 76845 O WAT 6792 119.448 124.593 129.298 1.00 0.00 O ATOM 76846 H1 WAT 6792 118.582 124.965 129.469 1.00 0.00 H ATOM 76847 H2 WAT 6792 119.317 123.647 129.348 1.00 0.00 H TER 76849 WAT 6792 ATOM 76849 O WAT 6793 103.457 126.007 131.245 1.00 0.00 O ATOM 76850 H1 WAT 6793 103.928 126.296 132.027 1.00 0.00 H ATOM 76851 H2 WAT 6793 103.130 126.816 130.851 1.00 0.00 H TER 76853 WAT 6793 ATOM 76853 O WAT 6794 29.864 64.062 81.628 1.00 0.00 O ATOM 76854 H1 WAT 6794 29.372 64.725 82.112 1.00 0.00 H ATOM 76855 H2 WAT 6794 30.581 63.820 82.215 1.00 0.00 H TER 76857 WAT 6794 ATOM 76857 O WAT 6795 24.252 53.951 120.332 1.00 0.00 O ATOM 76858 H1 WAT 6795 24.981 53.337 120.424 1.00 0.00 H ATOM 76859 H2 WAT 6795 24.657 54.758 120.014 1.00 0.00 H TER 76861 WAT 6795 ATOM 76861 O WAT 6796 136.406 40.909 90.339 1.00 0.00 O ATOM 76862 H1 WAT 6796 136.404 41.637 89.717 1.00 0.00 H ATOM 76863 H2 WAT 6796 136.688 40.154 89.824 1.00 0.00 H TER 76865 WAT 6796 ATOM 76865 O WAT 6797 53.720 6.386 119.486 1.00 0.00 O ATOM 76866 H1 WAT 6797 54.286 7.107 119.764 1.00 0.00 H ATOM 76867 H2 WAT 6797 53.530 5.906 120.292 1.00 0.00 H TER 76869 WAT 6797 ATOM 76869 O WAT 6798 21.592 28.214 15.565 1.00 0.00 O ATOM 76870 H1 WAT 6798 21.173 28.459 16.390 1.00 0.00 H ATOM 76871 H2 WAT 6798 21.796 27.284 15.667 1.00 0.00 H TER 76873 WAT 6798 ATOM 76873 O WAT 6799 101.811 102.946 21.479 1.00 0.00 O ATOM 76874 H1 WAT 6799 102.727 103.024 21.748 1.00 0.00 H ATOM 76875 H2 WAT 6799 101.853 102.712 20.552 1.00 0.00 H TER 76877 WAT 6799 ATOM 76877 O WAT 6800 6.344 39.124 6.719 1.00 0.00 O ATOM 76878 H1 WAT 6800 6.377 40.036 7.007 1.00 0.00 H ATOM 76879 H2 WAT 6800 6.960 38.669 7.294 1.00 0.00 H TER 76881 WAT 6800 ATOM 76881 O WAT 6801 62.061 14.663 133.265 1.00 0.00 O ATOM 76882 H1 WAT 6801 62.837 15.221 133.309 1.00 0.00 H ATOM 76883 H2 WAT 6801 61.770 14.729 132.355 1.00 0.00 H TER 76885 WAT 6801 ATOM 76885 O WAT 6802 23.448 85.051 142.342 1.00 0.00 O ATOM 76886 H1 WAT 6802 23.266 85.987 142.262 1.00 0.00 H ATOM 76887 H2 WAT 6802 22.822 84.740 142.997 1.00 0.00 H TER 76889 WAT 6802 ATOM 76889 O WAT 6803 125.786 110.885 2.884 1.00 0.00 O ATOM 76890 H1 WAT 6803 126.059 111.535 3.531 1.00 0.00 H ATOM 76891 H2 WAT 6803 125.197 111.361 2.299 1.00 0.00 H TER 76893 WAT 6803 ATOM 76893 O WAT 6804 109.160 21.606 87.729 1.00 0.00 O ATOM 76894 H1 WAT 6804 109.676 21.709 88.529 1.00 0.00 H ATOM 76895 H2 WAT 6804 109.608 22.152 87.083 1.00 0.00 H TER 76897 WAT 6804 ATOM 76897 O WAT 6805 55.047 27.480 111.516 1.00 0.00 O ATOM 76898 H1 WAT 6805 55.388 28.308 111.180 1.00 0.00 H ATOM 76899 H2 WAT 6805 54.966 26.922 110.743 1.00 0.00 H TER 76901 WAT 6805 ATOM 76901 O WAT 6806 113.682 66.410 5.906 1.00 0.00 O ATOM 76902 H1 WAT 6806 113.507 65.472 5.840 1.00 0.00 H ATOM 76903 H2 WAT 6806 114.588 66.464 6.211 1.00 0.00 H TER 76905 WAT 6806 ATOM 76905 O WAT 6807 77.840 95.861 91.947 1.00 0.00 O ATOM 76906 H1 WAT 6807 77.150 96.351 91.500 1.00 0.00 H ATOM 76907 H2 WAT 6807 78.441 96.532 92.269 1.00 0.00 H TER 76909 WAT 6807 ATOM 76909 O WAT 6808 113.176 124.341 78.888 1.00 0.00 O ATOM 76910 H1 WAT 6808 113.092 125.120 79.439 1.00 0.00 H ATOM 76911 H2 WAT 6808 112.461 124.416 78.257 1.00 0.00 H TER 76913 WAT 6808 ATOM 76913 O WAT 6809 55.557 117.934 1.108 1.00 0.00 O ATOM 76914 H1 WAT 6809 56.239 117.264 1.146 1.00 0.00 H ATOM 76915 H2 WAT 6809 55.284 117.945 0.190 1.00 0.00 H TER 76917 WAT 6809 ATOM 76917 O WAT 6810 65.671 67.279 72.146 1.00 0.00 O ATOM 76918 H1 WAT 6810 65.108 66.505 72.131 1.00 0.00 H ATOM 76919 H2 WAT 6810 65.284 67.844 72.814 1.00 0.00 H TER 76921 WAT 6810 ATOM 76921 O WAT 6811 17.167 54.759 7.659 1.00 0.00 O ATOM 76922 H1 WAT 6811 17.334 55.606 8.074 1.00 0.00 H ATOM 76923 H2 WAT 6811 17.975 54.263 7.793 1.00 0.00 H TER 76925 WAT 6811 ATOM 76925 O WAT 6812 2.175 43.305 153.114 1.00 0.00 O ATOM 76926 H1 WAT 6812 1.498 43.891 153.450 1.00 0.00 H ATOM 76927 H2 WAT 6812 2.783 43.881 152.651 1.00 0.00 H TER 76929 WAT 6812 ATOM 76929 O WAT 6813 79.717 134.234 96.543 1.00 0.00 O ATOM 76930 H1 WAT 6813 79.843 133.810 97.392 1.00 0.00 H ATOM 76931 H2 WAT 6813 79.539 133.512 95.939 1.00 0.00 H TER 76933 WAT 6813 ATOM 76933 O WAT 6814 106.651 127.028 73.366 1.00 0.00 O ATOM 76934 H1 WAT 6814 105.716 126.970 73.564 1.00 0.00 H ATOM 76935 H2 WAT 6814 106.688 127.465 72.515 1.00 0.00 H TER 76937 WAT 6814 ATOM 76937 O WAT 6815 96.821 32.920 79.201 1.00 0.00 O ATOM 76938 H1 WAT 6815 96.782 32.645 80.117 1.00 0.00 H ATOM 76939 H2 WAT 6815 96.104 32.447 78.778 1.00 0.00 H TER 76941 WAT 6815 ATOM 76941 O WAT 6816 139.504 88.818 35.681 1.00 0.00 O ATOM 76942 H1 WAT 6816 139.788 89.710 35.881 1.00 0.00 H ATOM 76943 H2 WAT 6816 140.297 88.377 35.376 1.00 0.00 H TER 76945 WAT 6816 ATOM 76945 O WAT 6817 89.744 27.170 152.055 1.00 0.00 O ATOM 76946 H1 WAT 6817 89.989 28.093 151.997 1.00 0.00 H ATOM 76947 H2 WAT 6817 90.434 26.772 152.586 1.00 0.00 H TER 76949 WAT 6817 ATOM 76949 O WAT 6818 66.705 127.460 64.722 1.00 0.00 O ATOM 76950 H1 WAT 6818 67.041 127.551 63.831 1.00 0.00 H ATOM 76951 H2 WAT 6818 67.220 126.748 65.101 1.00 0.00 H TER 76953 WAT 6818 ATOM 76953 O WAT 6819 83.705 50.468 7.338 1.00 0.00 O ATOM 76954 H1 WAT 6819 83.399 49.596 7.589 1.00 0.00 H ATOM 76955 H2 WAT 6819 84.107 50.819 8.132 1.00 0.00 H TER 76957 WAT 6819 ATOM 76957 O WAT 6820 91.722 122.087 76.322 1.00 0.00 O ATOM 76958 H1 WAT 6820 92.062 121.710 77.135 1.00 0.00 H ATOM 76959 H2 WAT 6820 91.418 121.332 75.818 1.00 0.00 H TER 76961 WAT 6820 ATOM 76961 O WAT 6821 108.269 40.834 14.204 1.00 0.00 O ATOM 76962 H1 WAT 6821 108.176 40.047 13.668 1.00 0.00 H ATOM 76963 H2 WAT 6821 107.500 40.829 14.773 1.00 0.00 H TER 76965 WAT 6821 ATOM 76965 O WAT 6822 114.329 6.781 103.793 1.00 0.00 O ATOM 76966 H1 WAT 6822 114.570 6.069 103.202 1.00 0.00 H ATOM 76967 H2 WAT 6822 114.038 7.486 103.214 1.00 0.00 H TER 76969 WAT 6822 ATOM 76969 O WAT 6823 2.004 14.816 15.683 1.00 0.00 O ATOM 76970 H1 WAT 6823 1.858 13.996 15.211 1.00 0.00 H ATOM 76971 H2 WAT 6823 2.845 14.692 16.123 1.00 0.00 H TER 76973 WAT 6823 ATOM 76973 O WAT 6824 22.054 104.950 145.772 1.00 0.00 O ATOM 76974 H1 WAT 6824 22.547 105.762 145.658 1.00 0.00 H ATOM 76975 H2 WAT 6824 22.401 104.363 145.100 1.00 0.00 H TER 76977 WAT 6824 ATOM 76977 O WAT 6825 96.093 117.111 144.048 1.00 0.00 O ATOM 76978 H1 WAT 6825 96.450 117.998 144.088 1.00 0.00 H ATOM 76979 H2 WAT 6825 95.589 117.019 144.857 1.00 0.00 H TER 76981 WAT 6825 ATOM 76981 O WAT 6826 36.026 121.255 128.645 1.00 0.00 O ATOM 76982 H1 WAT 6826 35.725 121.447 127.756 1.00 0.00 H ATOM 76983 H2 WAT 6826 35.267 121.439 129.199 1.00 0.00 H TER 76985 WAT 6826 ATOM 76985 O WAT 6827 4.695 78.574 93.078 1.00 0.00 O ATOM 76986 H1 WAT 6827 5.092 77.714 93.214 1.00 0.00 H ATOM 76987 H2 WAT 6827 4.048 78.653 93.780 1.00 0.00 H TER 76989 WAT 6827 ATOM 76989 O WAT 6828 52.879 77.159 61.957 1.00 0.00 O ATOM 76990 H1 WAT 6828 53.585 77.603 61.488 1.00 0.00 H ATOM 76991 H2 WAT 6828 53.006 76.231 61.758 1.00 0.00 H TER 76993 WAT 6828 ATOM 76993 O WAT 6829 60.046 59.196 104.450 1.00 0.00 O ATOM 76994 H1 WAT 6829 60.548 59.819 103.924 1.00 0.00 H ATOM 76995 H2 WAT 6829 59.161 59.561 104.472 1.00 0.00 H TER 76997 WAT 6829 ATOM 76997 O WAT 6830 109.047 78.922 128.307 1.00 0.00 O ATOM 76998 H1 WAT 6830 109.895 78.575 128.030 1.00 0.00 H ATOM 76999 H2 WAT 6830 108.681 78.239 128.869 1.00 0.00 H TER 77001 WAT 6830 ATOM 77001 O WAT 6831 106.566 119.001 123.813 1.00 0.00 O ATOM 77002 H1 WAT 6831 106.883 118.209 124.246 1.00 0.00 H ATOM 77003 H2 WAT 6831 105.831 118.704 123.278 1.00 0.00 H TER 77005 WAT 6831 ATOM 77005 O WAT 6832 84.598 93.209 125.638 1.00 0.00 O ATOM 77006 H1 WAT 6832 85.316 93.312 125.013 1.00 0.00 H ATOM 77007 H2 WAT 6832 84.068 93.998 125.527 1.00 0.00 H TER 77009 WAT 6832 ATOM 77009 O WAT 6833 93.922 52.291 13.694 1.00 0.00 O ATOM 77010 H1 WAT 6833 94.394 51.600 14.158 1.00 0.00 H ATOM 77011 H2 WAT 6833 92.999 52.117 13.881 1.00 0.00 H TER 77013 WAT 6833 ATOM 77013 O WAT 6834 29.161 127.031 119.532 1.00 0.00 O ATOM 77014 H1 WAT 6834 29.818 127.725 119.571 1.00 0.00 H ATOM 77015 H2 WAT 6834 29.597 126.313 119.072 1.00 0.00 H TER 77017 WAT 6834 ATOM 77017 O WAT 6835 9.934 43.630 87.261 1.00 0.00 O ATOM 77018 H1 WAT 6835 9.513 42.839 86.923 1.00 0.00 H ATOM 77019 H2 WAT 6835 10.619 43.828 86.623 1.00 0.00 H TER 77021 WAT 6835 ATOM 77021 O WAT 6836 41.106 57.918 131.049 1.00 0.00 O ATOM 77022 H1 WAT 6836 40.580 57.242 130.621 1.00 0.00 H ATOM 77023 H2 WAT 6836 41.929 57.927 130.561 1.00 0.00 H TER 77025 WAT 6836 ATOM 77025 O WAT 6837 119.582 81.443 145.119 1.00 0.00 O ATOM 77026 H1 WAT 6837 120.149 80.693 145.299 1.00 0.00 H ATOM 77027 H2 WAT 6837 120.166 82.200 145.165 1.00 0.00 H TER 77029 WAT 6837 ATOM 77029 O WAT 6838 10.311 128.953 141.223 1.00 0.00 O ATOM 77030 H1 WAT 6838 9.497 128.464 141.102 1.00 0.00 H ATOM 77031 H2 WAT 6838 10.993 128.282 141.238 1.00 0.00 H TER 77033 WAT 6838 ATOM 77033 O WAT 6839 117.003 86.364 81.507 1.00 0.00 O ATOM 77034 H1 WAT 6839 117.663 86.568 80.844 1.00 0.00 H ATOM 77035 H2 WAT 6839 116.201 86.209 81.008 1.00 0.00 H TER 77037 WAT 6839 ATOM 77037 O WAT 6840 63.154 90.086 20.077 1.00 0.00 O ATOM 77038 H1 WAT 6840 62.742 89.297 20.431 1.00 0.00 H ATOM 77039 H2 WAT 6840 64.094 89.912 20.135 1.00 0.00 H TER 77041 WAT 6840 ATOM 77041 O WAT 6841 13.218 51.375 154.200 1.00 0.00 O ATOM 77042 H1 WAT 6841 12.660 51.751 153.519 1.00 0.00 H ATOM 77043 H2 WAT 6841 13.100 50.429 154.112 1.00 0.00 H TER 77045 WAT 6841 ATOM 77045 O WAT 6842 1.032 58.094 116.746 1.00 0.00 O ATOM 77046 H1 WAT 6842 0.241 58.055 117.283 1.00 0.00 H ATOM 77047 H2 WAT 6842 1.745 58.196 117.377 1.00 0.00 H TER 77049 WAT 6842 ATOM 77049 O WAT 6843 107.565 5.514 101.630 1.00 0.00 O ATOM 77050 H1 WAT 6843 108.460 5.840 101.729 1.00 0.00 H ATOM 77051 H2 WAT 6843 107.586 5.001 100.822 1.00 0.00 H TER 77053 WAT 6843 ATOM 77053 O WAT 6844 19.123 79.389 12.971 1.00 0.00 O ATOM 77054 H1 WAT 6844 18.725 78.603 13.346 1.00 0.00 H ATOM 77055 H2 WAT 6844 19.158 80.010 13.699 1.00 0.00 H TER 77057 WAT 6844 ATOM 77057 O WAT 6845 3.504 116.728 21.087 1.00 0.00 O ATOM 77058 H1 WAT 6845 3.921 116.319 21.845 1.00 0.00 H ATOM 77059 H2 WAT 6845 2.571 116.545 21.199 1.00 0.00 H TER 77061 WAT 6845 ATOM 77061 O WAT 6846 48.747 38.633 11.110 1.00 0.00 O ATOM 77062 H1 WAT 6846 49.330 37.900 10.911 1.00 0.00 H ATOM 77063 H2 WAT 6846 48.057 38.249 11.651 1.00 0.00 H TER 77065 WAT 6846 ATOM 77065 O WAT 6847 23.093 40.524 22.660 1.00 0.00 O ATOM 77066 H1 WAT 6847 22.447 41.198 22.873 1.00 0.00 H ATOM 77067 H2 WAT 6847 22.576 39.800 22.306 1.00 0.00 H TER 77069 WAT 6847 ATOM 77069 O WAT 6848 45.384 134.079 120.725 1.00 0.00 O ATOM 77070 H1 WAT 6848 45.048 134.580 119.982 1.00 0.00 H ATOM 77071 H2 WAT 6848 46.219 133.727 120.418 1.00 0.00 H TER 77073 WAT 6848 ATOM 77073 O WAT 6849 103.651 144.243 125.444 1.00 0.00 O ATOM 77074 H1 WAT 6849 103.533 143.297 125.360 1.00 0.00 H ATOM 77075 H2 WAT 6849 104.222 144.347 126.205 1.00 0.00 H TER 77077 WAT 6849 ATOM 77077 O WAT 6850 31.787 84.387 88.494 1.00 0.00 O ATOM 77078 H1 WAT 6850 32.347 84.953 89.024 1.00 0.00 H ATOM 77079 H2 WAT 6850 31.470 83.722 89.105 1.00 0.00 H TER 77081 WAT 6850 ATOM 77081 O WAT 6851 10.537 128.115 59.879 1.00 0.00 O ATOM 77082 H1 WAT 6851 10.912 128.960 59.630 1.00 0.00 H ATOM 77083 H2 WAT 6851 11.134 127.468 59.502 1.00 0.00 H TER 77085 WAT 6851 ATOM 77085 O WAT 6852 111.536 87.913 103.502 1.00 0.00 O ATOM 77086 H1 WAT 6852 112.340 88.420 103.397 1.00 0.00 H ATOM 77087 H2 WAT 6852 111.036 88.390 104.165 1.00 0.00 H TER 77089 WAT 6852 ATOM 77089 O WAT 6853 49.387 133.313 101.962 1.00 0.00 O ATOM 77090 H1 WAT 6853 48.660 133.238 101.344 1.00 0.00 H ATOM 77091 H2 WAT 6853 50.132 132.926 101.503 1.00 0.00 H TER 77093 WAT 6853 ATOM 77093 O WAT 6854 43.579 25.083 130.382 1.00 0.00 O ATOM 77094 H1 WAT 6854 43.776 25.164 131.315 1.00 0.00 H ATOM 77095 H2 WAT 6854 42.767 25.576 130.264 1.00 0.00 H TER 77097 WAT 6854 ATOM 77097 O WAT 6855 68.299 74.610 72.773 1.00 0.00 O ATOM 77098 H1 WAT 6855 68.099 74.649 71.838 1.00 0.00 H ATOM 77099 H2 WAT 6855 69.031 73.996 72.836 1.00 0.00 H TER 77101 WAT 6855 ATOM 77101 O WAT 6856 105.720 88.380 75.012 1.00 0.00 O ATOM 77102 H1 WAT 6856 105.308 87.738 74.433 1.00 0.00 H ATOM 77103 H2 WAT 6856 104.998 88.725 75.537 1.00 0.00 H TER 77105 WAT 6856 ATOM 77105 O WAT 6857 85.813 136.450 150.402 1.00 0.00 O ATOM 77106 H1 WAT 6857 86.571 136.487 149.819 1.00 0.00 H ATOM 77107 H2 WAT 6857 85.129 136.031 149.879 1.00 0.00 H TER 77109 WAT 6857 ATOM 77109 O WAT 6858 123.112 113.909 82.284 1.00 0.00 O ATOM 77110 H1 WAT 6858 123.188 114.647 82.889 1.00 0.00 H ATOM 77111 H2 WAT 6858 123.381 114.266 81.437 1.00 0.00 H TER 77113 WAT 6858 ATOM 77113 O WAT 6859 45.328 134.911 12.474 1.00 0.00 O ATOM 77114 H1 WAT 6859 44.445 134.789 12.126 1.00 0.00 H ATOM 77115 H2 WAT 6859 45.750 135.504 11.853 1.00 0.00 H TER 77117 WAT 6859 ATOM 77117 O WAT 6860 71.316 111.707 59.408 1.00 0.00 O ATOM 77118 H1 WAT 6860 70.859 111.244 60.110 1.00 0.00 H ATOM 77119 H2 WAT 6860 71.415 111.054 58.716 1.00 0.00 H TER 77121 WAT 6860 ATOM 77121 O WAT 6861 28.828 114.000 8.570 1.00 0.00 O ATOM 77122 H1 WAT 6861 28.652 114.754 8.007 1.00 0.00 H ATOM 77123 H2 WAT 6861 28.392 113.268 8.133 1.00 0.00 H TER 77125 WAT 6861 ATOM 77125 O WAT 6862 53.480 67.328 154.912 1.00 0.00 O ATOM 77126 H1 WAT 6862 54.258 67.211 155.458 1.00 0.00 H ATOM 77127 H2 WAT 6862 53.741 67.000 154.051 1.00 0.00 H TER 77129 WAT 6862 ATOM 77129 O WAT 6863 17.307 51.270 76.483 1.00 0.00 O ATOM 77130 H1 WAT 6863 16.435 50.901 76.339 1.00 0.00 H ATOM 77131 H2 WAT 6863 17.901 50.525 76.393 1.00 0.00 H TER 77133 WAT 6863 ATOM 77133 O WAT 6864 53.046 26.366 118.466 1.00 0.00 O ATOM 77134 H1 WAT 6864 53.362 27.106 117.947 1.00 0.00 H ATOM 77135 H2 WAT 6864 52.096 26.379 118.347 1.00 0.00 H TER 77137 WAT 6864 ATOM 77137 O WAT 6865 141.922 136.561 20.272 1.00 0.00 O ATOM 77138 H1 WAT 6865 141.069 136.927 20.040 1.00 0.00 H ATOM 77139 H2 WAT 6865 141.832 135.622 20.109 1.00 0.00 H TER 77141 WAT 6865 ATOM 77141 O WAT 6866 46.539 107.308 88.541 1.00 0.00 O ATOM 77142 H1 WAT 6866 47.404 107.123 88.907 1.00 0.00 H ATOM 77143 H2 WAT 6866 45.933 107.141 89.263 1.00 0.00 H TER 77145 WAT 6866 ATOM 77145 O WAT 6867 106.128 63.896 117.986 1.00 0.00 O ATOM 77146 H1 WAT 6867 106.354 64.212 117.111 1.00 0.00 H ATOM 77147 H2 WAT 6867 106.497 63.013 118.025 1.00 0.00 H TER 77149 WAT 6867 ATOM 77149 O WAT 6868 13.882 79.793 16.723 1.00 0.00 O ATOM 77150 H1 WAT 6868 12.975 79.525 16.869 1.00 0.00 H ATOM 77151 H2 WAT 6868 13.817 80.692 16.402 1.00 0.00 H TER 77153 WAT 6868 ATOM 77153 O WAT 6869 22.391 27.381 102.222 1.00 0.00 O ATOM 77154 H1 WAT 6869 22.080 28.167 101.772 1.00 0.00 H ATOM 77155 H2 WAT 6869 22.444 26.717 101.534 1.00 0.00 H TER 77157 WAT 6869 ATOM 77157 O WAT 6870 59.774 32.194 95.846 1.00 0.00 O ATOM 77158 H1 WAT 6870 60.645 32.471 96.130 1.00 0.00 H ATOM 77159 H2 WAT 6870 59.922 31.769 95.001 1.00 0.00 H TER 77161 WAT 6870 ATOM 77161 O WAT 6871 19.911 56.739 120.436 1.00 0.00 O ATOM 77162 H1 WAT 6871 18.980 56.958 120.389 1.00 0.00 H ATOM 77163 H2 WAT 6871 20.148 56.895 121.351 1.00 0.00 H TER 77165 WAT 6871 ATOM 77165 O WAT 6872 134.598 104.586 96.941 1.00 0.00 O ATOM 77166 H1 WAT 6872 134.533 103.907 96.269 1.00 0.00 H ATOM 77167 H2 WAT 6872 134.486 104.116 97.767 1.00 0.00 H TER 77169 WAT 6872 ATOM 77169 O WAT 6873 21.058 73.176 133.974 1.00 0.00 O ATOM 77170 H1 WAT 6873 20.150 72.874 133.970 1.00 0.00 H ATOM 77171 H2 WAT 6873 21.024 74.032 134.403 1.00 0.00 H TER 77173 WAT 6873 ATOM 77173 O WAT 6874 50.057 69.020 5.402 1.00 0.00 O ATOM 77174 H1 WAT 6874 49.294 68.499 5.151 1.00 0.00 H ATOM 77175 H2 WAT 6874 50.061 68.992 6.359 1.00 0.00 H TER 77177 WAT 6874 ATOM 77177 O WAT 6875 117.074 46.764 65.967 1.00 0.00 O ATOM 77178 H1 WAT 6875 116.189 46.412 66.055 1.00 0.00 H ATOM 77179 H2 WAT 6875 117.531 46.467 66.754 1.00 0.00 H TER 77181 WAT 6875 ATOM 77181 O WAT 6876 87.980 5.003 86.614 1.00 0.00 O ATOM 77182 H1 WAT 6876 87.085 4.902 86.938 1.00 0.00 H ATOM 77183 H2 WAT 6876 88.324 4.111 86.579 1.00 0.00 H TER 77185 WAT 6876 ATOM 77185 O WAT 6877 22.457 59.525 92.103 1.00 0.00 O ATOM 77186 H1 WAT 6877 23.219 59.213 92.593 1.00 0.00 H ATOM 77187 H2 WAT 6877 21.707 59.136 92.554 1.00 0.00 H TER 77189 WAT 6877 ATOM 77189 O WAT 6878 78.676 61.076 113.578 1.00 0.00 O ATOM 77190 H1 WAT 6878 77.973 60.439 113.448 1.00 0.00 H ATOM 77191 H2 WAT 6878 79.148 61.084 112.745 1.00 0.00 H TER 77193 WAT 6878 ATOM 77193 O WAT 6879 3.513 118.838 2.599 1.00 0.00 O ATOM 77194 H1 WAT 6879 3.927 118.111 2.134 1.00 0.00 H ATOM 77195 H2 WAT 6879 4.050 119.599 2.379 1.00 0.00 H TER 77197 WAT 6879 ATOM 77197 O WAT 6880 42.101 47.644 146.571 1.00 0.00 O ATOM 77198 H1 WAT 6880 42.724 47.964 145.918 1.00 0.00 H ATOM 77199 H2 WAT 6880 41.331 48.201 146.460 1.00 0.00 H TER 77201 WAT 6880 ATOM 77201 O WAT 6881 30.088 125.118 5.580 1.00 0.00 O ATOM 77202 H1 WAT 6881 30.428 125.962 5.283 1.00 0.00 H ATOM 77203 H2 WAT 6881 30.830 124.519 5.499 1.00 0.00 H TER 77205 WAT 6881 ATOM 77205 O WAT 6882 123.529 139.361 97.830 1.00 0.00 O ATOM 77206 H1 WAT 6882 124.186 140.057 97.840 1.00 0.00 H ATOM 77207 H2 WAT 6882 122.993 139.528 98.605 1.00 0.00 H TER 77209 WAT 6882 ATOM 77209 O WAT 6883 65.970 145.175 57.632 1.00 0.00 O ATOM 77210 H1 WAT 6883 66.789 145.659 57.523 1.00 0.00 H ATOM 77211 H2 WAT 6883 65.287 145.842 57.568 1.00 0.00 H TER 77213 WAT 6883 ATOM 77213 O WAT 6884 90.079 49.630 74.091 1.00 0.00 O ATOM 77214 H1 WAT 6884 91.007 49.434 74.225 1.00 0.00 H ATOM 77215 H2 WAT 6884 89.981 49.685 73.141 1.00 0.00 H TER 77217 WAT 6884 ATOM 77217 O WAT 6885 127.202 73.812 120.791 1.00 0.00 O ATOM 77218 H1 WAT 6885 127.767 74.419 120.313 1.00 0.00 H ATOM 77219 H2 WAT 6885 126.317 74.145 120.647 1.00 0.00 H TER 77221 WAT 6885 ATOM 77221 O WAT 6886 33.645 30.887 141.840 1.00 0.00 O ATOM 77222 H1 WAT 6886 33.288 30.163 141.325 1.00 0.00 H ATOM 77223 H2 WAT 6886 33.345 31.675 141.387 1.00 0.00 H TER 77225 WAT 6886 ATOM 77225 O WAT 6887 66.716 21.738 87.502 1.00 0.00 O ATOM 77226 H1 WAT 6887 67.327 21.449 86.824 1.00 0.00 H ATOM 77227 H2 WAT 6887 66.069 21.034 87.556 1.00 0.00 H TER 77229 WAT 6887 ATOM 77229 O WAT 6888 107.272 45.604 98.899 1.00 0.00 O ATOM 77230 H1 WAT 6888 107.518 45.616 99.824 1.00 0.00 H ATOM 77231 H2 WAT 6888 107.816 46.281 98.497 1.00 0.00 H TER 77233 WAT 6888 ATOM 77233 O WAT 6889 19.338 27.468 111.679 1.00 0.00 O ATOM 77234 H1 WAT 6889 19.686 27.058 112.471 1.00 0.00 H ATOM 77235 H2 WAT 6889 19.390 26.783 111.013 1.00 0.00 H TER 77237 WAT 6889 ATOM 77237 O WAT 6890 90.852 130.726 9.725 1.00 0.00 O ATOM 77238 H1 WAT 6890 90.744 130.530 10.656 1.00 0.00 H ATOM 77239 H2 WAT 6890 89.974 130.626 9.356 1.00 0.00 H TER 77241 WAT 6890 ATOM 77241 O WAT 6891 107.037 29.131 114.325 1.00 0.00 O ATOM 77242 H1 WAT 6891 107.177 28.192 114.450 1.00 0.00 H ATOM 77243 H2 WAT 6891 106.324 29.184 113.688 1.00 0.00 H TER 77245 WAT 6891 ATOM 77245 O WAT 6892 128.846 131.482 68.819 1.00 0.00 O ATOM 77246 H1 WAT 6892 128.126 132.007 68.469 1.00 0.00 H ATOM 77247 H2 WAT 6892 129.519 132.123 69.049 1.00 0.00 H TER 77249 WAT 6892 ATOM 77249 O WAT 6893 57.295 102.268 101.600 1.00 0.00 O ATOM 77250 H1 WAT 6893 57.819 102.470 100.825 1.00 0.00 H ATOM 77251 H2 WAT 6893 57.886 101.772 102.167 1.00 0.00 H TER 77253 WAT 6893 ATOM 77253 O WAT 6894 116.817 6.737 64.297 1.00 0.00 O ATOM 77254 H1 WAT 6894 117.592 6.780 64.858 1.00 0.00 H ATOM 77255 H2 WAT 6894 116.167 6.269 64.821 1.00 0.00 H TER 77257 WAT 6894 ATOM 77257 O WAT 6895 78.547 64.889 103.426 1.00 0.00 O ATOM 77258 H1 WAT 6895 77.600 65.001 103.338 1.00 0.00 H ATOM 77259 H2 WAT 6895 78.880 64.954 102.531 1.00 0.00 H TER 77261 WAT 6895 ATOM 77261 O WAT 6896 57.615 49.152 111.716 1.00 0.00 O ATOM 77262 H1 WAT 6896 56.894 48.661 111.322 1.00 0.00 H ATOM 77263 H2 WAT 6896 57.423 49.148 112.654 1.00 0.00 H TER 77265 WAT 6896 ATOM 77265 O WAT 6897 2.665 62.829 16.555 1.00 0.00 O ATOM 77266 H1 WAT 6897 2.333 62.707 17.445 1.00 0.00 H ATOM 77267 H2 WAT 6897 2.808 63.772 16.481 1.00 0.00 H TER 77269 WAT 6897 ATOM 77269 O WAT 6898 57.523 135.983 97.816 1.00 0.00 O ATOM 77270 H1 WAT 6898 57.000 136.713 97.485 1.00 0.00 H ATOM 77271 H2 WAT 6898 57.011 135.204 97.601 1.00 0.00 H TER 77273 WAT 6898 ATOM 77273 O WAT 6899 12.996 70.805 129.149 1.00 0.00 O ATOM 77274 H1 WAT 6899 12.663 71.517 128.602 1.00 0.00 H ATOM 77275 H2 WAT 6899 13.008 71.169 130.034 1.00 0.00 H TER 77277 WAT 6899 ATOM 77277 O WAT 6900 31.722 129.533 20.396 1.00 0.00 O ATOM 77278 H1 WAT 6900 31.417 129.989 21.180 1.00 0.00 H ATOM 77279 H2 WAT 6900 32.551 129.133 20.658 1.00 0.00 H TER 77281 WAT 6900 ATOM 77281 O WAT 6901 21.267 15.206 92.839 1.00 0.00 O ATOM 77282 H1 WAT 6901 20.640 14.978 93.526 1.00 0.00 H ATOM 77283 H2 WAT 6901 22.042 14.682 93.039 1.00 0.00 H TER 77285 WAT 6901 ATOM 77285 O WAT 6902 93.215 53.614 105.038 1.00 0.00 O ATOM 77286 H1 WAT 6902 93.881 53.967 105.628 1.00 0.00 H ATOM 77287 H2 WAT 6902 92.384 53.810 105.471 1.00 0.00 H TER 77289 WAT 6902 ATOM 77289 O WAT 6903 35.456 140.864 109.996 1.00 0.00 O ATOM 77290 H1 WAT 6903 35.096 139.989 109.853 1.00 0.00 H ATOM 77291 H2 WAT 6903 34.688 141.435 110.030 1.00 0.00 H TER 77293 WAT 6903 ATOM 77293 O WAT 6904 74.147 119.204 56.703 1.00 0.00 O ATOM 77294 H1 WAT 6904 73.617 119.811 57.219 1.00 0.00 H ATOM 77295 H2 WAT 6904 74.348 118.489 57.306 1.00 0.00 H TER 77297 WAT 6904 ATOM 77297 O WAT 6905 90.583 10.760 100.790 1.00 0.00 O ATOM 77298 H1 WAT 6905 91.156 11.452 101.122 1.00 0.00 H ATOM 77299 H2 WAT 6905 90.012 11.203 100.162 1.00 0.00 H TER 77301 WAT 6905 ATOM 77301 O WAT 6906 69.578 110.446 61.475 1.00 0.00 O ATOM 77302 H1 WAT 6906 69.947 110.354 62.353 1.00 0.00 H ATOM 77303 H2 WAT 6906 68.644 110.594 61.621 1.00 0.00 H TER 77305 WAT 6906 ATOM 77305 O WAT 6907 50.841 95.254 98.187 1.00 0.00 O ATOM 77306 H1 WAT 6907 50.864 94.805 99.032 1.00 0.00 H ATOM 77307 H2 WAT 6907 50.271 96.009 98.333 1.00 0.00 H TER 77309 WAT 6907 ATOM 77309 O WAT 6908 116.585 41.430 76.173 1.00 0.00 O ATOM 77310 H1 WAT 6908 116.472 42.215 75.637 1.00 0.00 H ATOM 77311 H2 WAT 6908 117.005 40.799 75.588 1.00 0.00 H TER 77313 WAT 6908 ATOM 77313 O WAT 6909 46.975 73.331 65.678 1.00 0.00 O ATOM 77314 H1 WAT 6909 46.368 73.407 66.414 1.00 0.00 H ATOM 77315 H2 WAT 6909 47.530 74.108 65.743 1.00 0.00 H TER 77317 WAT 6909 ATOM 77317 O WAT 6910 141.612 122.145 76.465 1.00 0.00 O ATOM 77318 H1 WAT 6910 141.964 122.603 75.701 1.00 0.00 H ATOM 77319 H2 WAT 6910 140.730 121.882 76.201 1.00 0.00 H TER 77321 WAT 6910 ATOM 77321 O WAT 6911 40.771 3.518 79.389 1.00 0.00 O ATOM 77322 H1 WAT 6911 41.021 3.776 80.276 1.00 0.00 H ATOM 77323 H2 WAT 6911 39.842 3.296 79.458 1.00 0.00 H TER 77325 WAT 6911 ATOM 77325 O WAT 6912 111.948 130.378 11.560 1.00 0.00 O ATOM 77326 H1 WAT 6912 112.179 129.650 10.983 1.00 0.00 H ATOM 77327 H2 WAT 6912 111.932 129.993 12.437 1.00 0.00 H TER 77329 WAT 6912 ATOM 77329 O WAT 6913 6.034 139.938 104.780 1.00 0.00 O ATOM 77330 H1 WAT 6913 5.295 140.542 104.707 1.00 0.00 H ATOM 77331 H2 WAT 6913 5.639 139.105 105.036 1.00 0.00 H TER 77333 WAT 6913 ATOM 77333 O WAT 6914 111.228 92.226 68.845 1.00 0.00 O ATOM 77334 H1 WAT 6914 111.014 92.472 67.946 1.00 0.00 H ATOM 77335 H2 WAT 6914 111.905 92.849 69.110 1.00 0.00 H TER 77337 WAT 6914 ATOM 77337 O WAT 6915 144.692 101.133 72.241 1.00 0.00 O ATOM 77338 H1 WAT 6915 145.358 100.716 71.694 1.00 0.00 H ATOM 77339 H2 WAT 6915 144.294 100.411 72.727 1.00 0.00 H TER 77341 WAT 6915 ATOM 77341 O WAT 6916 28.752 116.089 111.057 1.00 0.00 O ATOM 77342 H1 WAT 6916 28.257 116.105 110.238 1.00 0.00 H ATOM 77343 H2 WAT 6916 29.386 115.381 110.941 1.00 0.00 H TER 77345 WAT 6916 ATOM 77345 O WAT 6917 27.845 30.172 142.919 1.00 0.00 O ATOM 77346 H1 WAT 6917 28.065 30.321 143.838 1.00 0.00 H ATOM 77347 H2 WAT 6917 27.797 29.219 142.835 1.00 0.00 H TER 77349 WAT 6917 ATOM 77349 O WAT 6918 143.342 3.513 94.231 1.00 0.00 O ATOM 77350 H1 WAT 6918 143.736 2.640 94.231 1.00 0.00 H ATOM 77351 H2 WAT 6918 143.632 3.907 93.409 1.00 0.00 H TER 77353 WAT 6918 ATOM 77353 O WAT 6919 33.416 105.971 23.053 1.00 0.00 O ATOM 77354 H1 WAT 6919 33.767 106.354 22.249 1.00 0.00 H ATOM 77355 H2 WAT 6919 33.024 105.144 22.773 1.00 0.00 H TER 77357 WAT 6919 ATOM 77357 O WAT 6920 66.995 115.449 120.533 1.00 0.00 O ATOM 77358 H1 WAT 6920 66.333 116.096 120.289 1.00 0.00 H ATOM 77359 H2 WAT 6920 66.655 115.050 121.334 1.00 0.00 H TER 77361 WAT 6920 ATOM 77361 O WAT 6921 24.097 79.147 119.716 1.00 0.00 O ATOM 77362 H1 WAT 6921 23.601 79.910 120.013 1.00 0.00 H ATOM 77363 H2 WAT 6921 24.926 79.508 119.402 1.00 0.00 H TER 77365 WAT 6921 ATOM 77365 O WAT 6922 140.808 95.029 93.269 1.00 0.00 O ATOM 77366 H1 WAT 6922 141.172 94.398 93.890 1.00 0.00 H ATOM 77367 H2 WAT 6922 140.117 94.546 92.815 1.00 0.00 H TER 77369 WAT 6922 ATOM 77369 O WAT 6923 117.748 98.531 141.269 1.00 0.00 O ATOM 77370 H1 WAT 6923 118.046 99.433 141.381 1.00 0.00 H ATOM 77371 H2 WAT 6923 117.585 98.220 142.160 1.00 0.00 H TER 77373 WAT 6923 ATOM 77373 O WAT 6924 134.747 67.347 126.074 1.00 0.00 O ATOM 77374 H1 WAT 6924 134.563 66.422 125.909 1.00 0.00 H ATOM 77375 H2 WAT 6924 135.208 67.643 125.289 1.00 0.00 H TER 77377 WAT 6924 ATOM 77377 O WAT 6925 9.564 44.424 132.086 1.00 0.00 O ATOM 77378 H1 WAT 6925 9.017 44.039 132.771 1.00 0.00 H ATOM 77379 H2 WAT 6925 10.409 43.983 132.178 1.00 0.00 H TER 77381 WAT 6925 ATOM 77381 O WAT 6926 41.928 22.067 97.376 1.00 0.00 O ATOM 77382 H1 WAT 6926 42.233 21.274 97.816 1.00 0.00 H ATOM 77383 H2 WAT 6926 42.586 22.728 97.592 1.00 0.00 H TER 77385 WAT 6926 ATOM 77385 O WAT 6927 27.801 118.132 0.456 1.00 0.00 O ATOM 77386 H1 WAT 6927 27.124 117.719 0.992 1.00 0.00 H ATOM 77387 H2 WAT 6927 27.406 118.208 -0.413 1.00 0.00 H TER 77389 WAT 6927 ATOM 77389 O WAT 6928 119.662 126.279 120.700 1.00 0.00 O ATOM 77390 H1 WAT 6928 120.124 125.443 120.639 1.00 0.00 H ATOM 77391 H2 WAT 6928 119.405 126.343 121.620 1.00 0.00 H TER 77393 WAT 6928 ATOM 77393 O WAT 6929 65.050 107.822 3.792 1.00 0.00 O ATOM 77394 H1 WAT 6929 64.817 106.926 4.037 1.00 0.00 H ATOM 77395 H2 WAT 6929 65.366 108.218 4.604 1.00 0.00 H TER 77397 WAT 6929 ATOM 77397 O WAT 6930 79.399 45.510 127.349 1.00 0.00 O ATOM 77398 H1 WAT 6930 78.554 45.191 127.665 1.00 0.00 H ATOM 77399 H2 WAT 6930 79.187 46.302 126.855 1.00 0.00 H TER 77401 WAT 6930 ATOM 77401 O WAT 6931 123.105 138.561 124.721 1.00 0.00 O ATOM 77402 H1 WAT 6931 124.003 138.334 124.961 1.00 0.00 H ATOM 77403 H2 WAT 6931 123.085 138.485 123.767 1.00 0.00 H TER 77405 WAT 6931 ATOM 77405 O WAT 6932 89.909 74.302 120.926 1.00 0.00 O ATOM 77406 H1 WAT 6932 90.592 73.854 121.424 1.00 0.00 H ATOM 77407 H2 WAT 6932 89.593 73.644 120.307 1.00 0.00 H TER 77409 WAT 6932 ATOM 77409 O WAT 6933 48.781 137.452 120.519 1.00 0.00 O ATOM 77410 H1 WAT 6933 48.210 138.124 120.892 1.00 0.00 H ATOM 77411 H2 WAT 6933 48.705 137.571 119.573 1.00 0.00 H TER 77413 WAT 6933 ATOM 77413 O WAT 6934 43.595 115.166 107.193 1.00 0.00 O ATOM 77414 H1 WAT 6934 44.449 115.079 107.618 1.00 0.00 H ATOM 77415 H2 WAT 6934 43.747 115.781 106.476 1.00 0.00 H TER 77417 WAT 6934 ATOM 77417 O WAT 6935 101.866 121.141 134.353 1.00 0.00 O ATOM 77418 H1 WAT 6935 101.000 121.057 133.954 1.00 0.00 H ATOM 77419 H2 WAT 6935 101.801 121.921 134.904 1.00 0.00 H TER 77421 WAT 6935 ATOM 77421 O WAT 6936 86.061 139.990 128.550 1.00 0.00 O ATOM 77422 H1 WAT 6936 85.343 140.110 127.929 1.00 0.00 H ATOM 77423 H2 WAT 6936 85.634 139.700 129.357 1.00 0.00 H TER 77425 WAT 6936 ATOM 77425 O WAT 6937 115.524 43.989 72.300 1.00 0.00 O ATOM 77426 H1 WAT 6937 115.204 43.124 72.045 1.00 0.00 H ATOM 77427 H2 WAT 6937 114.758 44.559 72.228 1.00 0.00 H TER 77429 WAT 6937 ATOM 77429 O WAT 6938 25.578 123.555 20.263 1.00 0.00 O ATOM 77430 H1 WAT 6938 25.439 124.481 20.063 1.00 0.00 H ATOM 77431 H2 WAT 6938 25.622 123.521 21.218 1.00 0.00 H TER 77433 WAT 6938 ATOM 77433 O WAT 6939 124.898 72.353 16.092 1.00 0.00 O ATOM 77434 H1 WAT 6939 125.418 71.552 16.157 1.00 0.00 H ATOM 77435 H2 WAT 6939 125.120 72.714 15.234 1.00 0.00 H TER 77437 WAT 6939 ATOM 77437 O WAT 6940 12.093 83.071 139.300 1.00 0.00 O ATOM 77438 H1 WAT 6940 12.389 83.257 138.409 1.00 0.00 H ATOM 77439 H2 WAT 6940 12.652 82.351 139.593 1.00 0.00 H TER 77441 WAT 6940 ATOM 77441 O WAT 6941 63.229 74.570 99.949 1.00 0.00 O ATOM 77442 H1 WAT 6941 62.985 75.082 100.720 1.00 0.00 H ATOM 77443 H2 WAT 6941 64.064 74.944 99.668 1.00 0.00 H TER 77445 WAT 6941 ATOM 77445 O WAT 6942 74.424 106.667 114.357 1.00 0.00 O ATOM 77446 H1 WAT 6942 74.654 107.347 114.991 1.00 0.00 H ATOM 77447 H2 WAT 6942 75.118 106.711 113.698 1.00 0.00 H TER 77449 WAT 6942 ATOM 77449 O WAT 6943 50.265 76.024 18.845 1.00 0.00 O ATOM 77450 H1 WAT 6943 50.328 76.042 17.890 1.00 0.00 H ATOM 77451 H2 WAT 6943 49.378 75.711 19.020 1.00 0.00 H TER 77453 WAT 6943 ATOM 77453 O WAT 6944 103.271 4.652 4.685 1.00 0.00 O ATOM 77454 H1 WAT 6944 104.207 4.849 4.729 1.00 0.00 H ATOM 77455 H2 WAT 6944 102.845 5.443 5.015 1.00 0.00 H TER 77457 WAT 6944 ATOM 77457 O WAT 6945 145.601 27.223 89.639 1.00 0.00 O ATOM 77458 H1 WAT 6945 145.314 26.485 90.176 1.00 0.00 H ATOM 77459 H2 WAT 6945 145.242 27.042 88.771 1.00 0.00 H TER 77461 WAT 6945 ATOM 77461 O WAT 6946 68.743 15.922 56.056 1.00 0.00 O ATOM 77462 H1 WAT 6946 69.144 16.722 55.715 1.00 0.00 H ATOM 77463 H2 WAT 6946 69.162 15.216 55.564 1.00 0.00 H TER 77465 WAT 6946 ATOM 77465 O WAT 6947 36.617 80.260 139.638 1.00 0.00 O ATOM 77466 H1 WAT 6947 36.706 81.020 139.063 1.00 0.00 H ATOM 77467 H2 WAT 6947 37.367 80.318 140.229 1.00 0.00 H TER 77469 WAT 6947 ATOM 77469 O WAT 6948 55.512 101.936 81.347 1.00 0.00 O ATOM 77470 H1 WAT 6948 56.332 101.621 81.727 1.00 0.00 H ATOM 77471 H2 WAT 6948 55.780 102.612 80.725 1.00 0.00 H TER 77473 WAT 6948 ATOM 77473 O WAT 6949 85.925 80.761 13.977 1.00 0.00 O ATOM 77474 H1 WAT 6949 85.914 81.682 13.717 1.00 0.00 H ATOM 77475 H2 WAT 6949 85.004 80.537 14.107 1.00 0.00 H TER 77477 WAT 6949 ATOM 77477 O WAT 6950 105.160 81.529 65.728 1.00 0.00 O ATOM 77478 H1 WAT 6950 104.304 81.101 65.698 1.00 0.00 H ATOM 77479 H2 WAT 6950 104.960 82.461 65.809 1.00 0.00 H TER 77481 WAT 6950 ATOM 77481 O WAT 6951 39.305 108.871 110.793 1.00 0.00 O ATOM 77482 H1 WAT 6951 39.812 108.924 111.603 1.00 0.00 H ATOM 77483 H2 WAT 6951 39.893 109.213 110.120 1.00 0.00 H TER 77485 WAT 6951 ATOM 77485 O WAT 6952 61.988 63.504 151.977 1.00 0.00 O ATOM 77486 H1 WAT 6952 61.123 63.222 152.275 1.00 0.00 H ATOM 77487 H2 WAT 6952 62.000 63.293 151.043 1.00 0.00 H TER 77489 WAT 6952 ATOM 77489 O WAT 6953 10.898 125.145 112.186 1.00 0.00 O ATOM 77490 H1 WAT 6953 10.193 124.499 112.226 1.00 0.00 H ATOM 77491 H2 WAT 6953 10.539 125.858 111.658 1.00 0.00 H TER 77493 WAT 6953 ATOM 77493 O WAT 6954 58.358 82.277 144.667 1.00 0.00 O ATOM 77494 H1 WAT 6954 58.271 82.911 143.955 1.00 0.00 H ATOM 77495 H2 WAT 6954 59.299 82.113 144.728 1.00 0.00 H TER 77497 WAT 6954 ATOM 77497 O WAT 6955 118.830 47.205 144.885 1.00 0.00 O ATOM 77498 H1 WAT 6955 118.418 48.041 145.102 1.00 0.00 H ATOM 77499 H2 WAT 6955 119.506 47.430 144.245 1.00 0.00 H TER 77501 WAT 6955 ATOM 77501 O WAT 6956 110.351 20.906 132.944 1.00 0.00 O ATOM 77502 H1 WAT 6956 110.084 20.104 132.494 1.00 0.00 H ATOM 77503 H2 WAT 6956 111.262 20.749 133.193 1.00 0.00 H TER 77505 WAT 6956 ATOM 77505 O WAT 6957 38.489 91.915 72.576 1.00 0.00 O ATOM 77506 H1 WAT 6957 37.942 92.700 72.538 1.00 0.00 H ATOM 77507 H2 WAT 6957 39.357 92.240 72.817 1.00 0.00 H TER 77509 WAT 6957 ATOM 77509 O WAT 6958 11.375 137.320 91.571 1.00 0.00 O ATOM 77510 H1 WAT 6958 12.280 137.308 91.884 1.00 0.00 H ATOM 77511 H2 WAT 6958 10.983 138.080 92.003 1.00 0.00 H TER 77513 WAT 6958 ATOM 77513 O WAT 6959 123.744 33.026 73.528 1.00 0.00 O ATOM 77514 H1 WAT 6959 124.279 32.451 72.981 1.00 0.00 H ATOM 77515 H2 WAT 6959 122.846 32.727 73.383 1.00 0.00 H TER 77517 WAT 6959 ATOM 77517 O WAT 6960 107.445 59.372 100.055 1.00 0.00 O ATOM 77518 H1 WAT 6960 107.451 58.636 100.666 1.00 0.00 H ATOM 77519 H2 WAT 6960 106.857 59.095 99.352 1.00 0.00 H TER 77521 WAT 6960 ATOM 77521 O WAT 6961 128.492 60.450 -0.157 1.00 0.00 O ATOM 77522 H1 WAT 6961 127.744 60.073 0.306 1.00 0.00 H ATOM 77523 H2 WAT 6961 129.252 60.183 0.360 1.00 0.00 H TER 77525 WAT 6961 ATOM 77525 O WAT 6962 90.345 4.898 158.627 1.00 0.00 O ATOM 77526 H1 WAT 6962 90.785 4.175 159.074 1.00 0.00 H ATOM 77527 H2 WAT 6962 91.013 5.580 158.560 1.00 0.00 H TER 77529 WAT 6962 ATOM 77529 O WAT 6963 128.311 17.935 70.957 1.00 0.00 O ATOM 77530 H1 WAT 6963 128.751 17.096 70.819 1.00 0.00 H ATOM 77531 H2 WAT 6963 129.013 18.584 70.907 1.00 0.00 H TER 77533 WAT 6963 ATOM 77533 O WAT 6964 61.062 93.258 74.093 1.00 0.00 O ATOM 77534 H1 WAT 6964 61.607 94.035 74.219 1.00 0.00 H ATOM 77535 H2 WAT 6964 61.251 92.707 74.853 1.00 0.00 H TER 77537 WAT 6964 ATOM 77537 O WAT 6965 62.599 1.959 79.896 1.00 0.00 O ATOM 77538 H1 WAT 6965 63.068 2.357 79.163 1.00 0.00 H ATOM 77539 H2 WAT 6965 61.861 2.548 80.057 1.00 0.00 H TER 77541 WAT 6965 ATOM 77541 O WAT 6966 5.717 91.927 12.511 1.00 0.00 O ATOM 77542 H1 WAT 6966 5.580 91.077 12.930 1.00 0.00 H ATOM 77543 H2 WAT 6966 5.653 91.745 11.574 1.00 0.00 H TER 77545 WAT 6966 ATOM 77545 O WAT 6967 86.541 112.058 62.784 1.00 0.00 O ATOM 77546 H1 WAT 6967 86.611 112.423 61.902 1.00 0.00 H ATOM 77547 H2 WAT 6967 85.753 112.460 63.149 1.00 0.00 H TER 77549 WAT 6967 ATOM 77549 O WAT 6968 9.116 107.396 104.096 1.00 0.00 O ATOM 77550 H1 WAT 6968 8.526 106.649 103.993 1.00 0.00 H ATOM 77551 H2 WAT 6968 8.610 108.145 103.781 1.00 0.00 H TER 77553 WAT 6968 ATOM 77553 O WAT 6969 121.595 36.789 65.322 1.00 0.00 O ATOM 77554 H1 WAT 6969 120.681 36.774 65.606 1.00 0.00 H ATOM 77555 H2 WAT 6969 121.869 35.872 65.346 1.00 0.00 H TER 77557 WAT 6969 ATOM 77557 O WAT 6970 118.818 141.868 20.740 1.00 0.00 O ATOM 77558 H1 WAT 6970 117.986 141.923 20.270 1.00 0.00 H ATOM 77559 H2 WAT 6970 118.797 142.605 21.350 1.00 0.00 H TER 77561 WAT 6970 ATOM 77561 O WAT 6971 44.870 10.434 154.088 1.00 0.00 O ATOM 77562 H1 WAT 6971 45.679 10.058 153.741 1.00 0.00 H ATOM 77563 H2 WAT 6971 44.198 9.783 153.887 1.00 0.00 H TER 77565 WAT 6971 ATOM 77565 O WAT 6972 7.113 42.869 85.004 1.00 0.00 O ATOM 77566 H1 WAT 6972 6.725 43.378 85.716 1.00 0.00 H ATOM 77567 H2 WAT 6972 7.078 41.963 85.311 1.00 0.00 H TER 77569 WAT 6972 ATOM 77569 O WAT 6973 71.662 72.837 96.535 1.00 0.00 O ATOM 77570 H1 WAT 6973 72.403 73.199 97.021 1.00 0.00 H ATOM 77571 H2 WAT 6973 71.791 73.144 95.638 1.00 0.00 H TER 77573 WAT 6973 ATOM 77573 O WAT 6974 111.965 75.920 66.839 1.00 0.00 O ATOM 77574 H1 WAT 6974 111.922 75.084 67.303 1.00 0.00 H ATOM 77575 H2 WAT 6974 112.167 75.683 65.934 1.00 0.00 H TER 77577 WAT 6974 ATOM 77577 O WAT 6975 7.715 31.573 115.955 1.00 0.00 O ATOM 77578 H1 WAT 6975 8.229 32.167 115.408 1.00 0.00 H ATOM 77579 H2 WAT 6975 6.863 32.001 116.038 1.00 0.00 H TER 77581 WAT 6975 ATOM 77581 O WAT 6976 76.377 12.232 133.440 1.00 0.00 O ATOM 77582 H1 WAT 6976 77.300 12.139 133.203 1.00 0.00 H ATOM 77583 H2 WAT 6976 76.231 11.557 134.103 1.00 0.00 H TER 77585 WAT 6976 ATOM 77585 O WAT 6977 94.481 41.279 123.427 1.00 0.00 O ATOM 77586 H1 WAT 6977 93.624 41.440 123.034 1.00 0.00 H ATOM 77587 H2 WAT 6977 94.513 40.330 123.553 1.00 0.00 H TER 77589 WAT 6977 ATOM 77589 O WAT 6978 82.744 119.637 71.225 1.00 0.00 O ATOM 77590 H1 WAT 6978 82.801 120.256 70.497 1.00 0.00 H ATOM 77591 H2 WAT 6978 81.984 119.093 71.018 1.00 0.00 H TER 77593 WAT 6978 ATOM 77593 O WAT 6979 24.272 83.942 6.281 1.00 0.00 O ATOM 77594 H1 WAT 6979 23.895 83.065 6.207 1.00 0.00 H ATOM 77595 H2 WAT 6979 24.675 84.102 5.428 1.00 0.00 H TER 77597 WAT 6979 ATOM 77597 O WAT 6980 59.119 134.007 118.654 1.00 0.00 O ATOM 77598 H1 WAT 6980 58.257 134.400 118.791 1.00 0.00 H ATOM 77599 H2 WAT 6980 59.431 133.803 119.535 1.00 0.00 H TER 77601 WAT 6980 ATOM 77601 O WAT 6981 130.221 123.170 82.930 1.00 0.00 O ATOM 77602 H1 WAT 6981 130.339 122.791 83.801 1.00 0.00 H ATOM 77603 H2 WAT 6981 129.281 123.099 82.763 1.00 0.00 H TER 77605 WAT 6981 ATOM 77605 O WAT 6982 42.622 26.412 94.840 1.00 0.00 O ATOM 77606 H1 WAT 6982 43.073 26.649 94.030 1.00 0.00 H ATOM 77607 H2 WAT 6982 43.320 26.125 95.428 1.00 0.00 H TER 77609 WAT 6982 ATOM 77609 O WAT 6983 69.947 17.064 135.976 1.00 0.00 O ATOM 77610 H1 WAT 6983 70.448 16.537 136.598 1.00 0.00 H ATOM 77611 H2 WAT 6983 70.387 16.928 135.137 1.00 0.00 H TER 77613 WAT 6983 ATOM 77613 O WAT 6984 40.752 79.768 136.984 1.00 0.00 O ATOM 77614 H1 WAT 6984 40.025 79.984 136.401 1.00 0.00 H ATOM 77615 H2 WAT 6984 41.417 80.430 136.795 1.00 0.00 H TER 77617 WAT 6984 ATOM 77617 O WAT 6985 82.680 74.041 136.770 1.00 0.00 O ATOM 77618 H1 WAT 6985 81.757 73.991 137.019 1.00 0.00 H ATOM 77619 H2 WAT 6985 82.745 73.499 135.983 1.00 0.00 H TER 77621 WAT 6985 ATOM 77621 O WAT 6986 75.194 136.995 7.209 1.00 0.00 O ATOM 77622 H1 WAT 6986 76.109 137.123 6.960 1.00 0.00 H ATOM 77623 H2 WAT 6986 74.957 136.151 6.825 1.00 0.00 H TER 77625 WAT 6986 ATOM 77625 O WAT 6987 120.637 69.543 15.938 1.00 0.00 O ATOM 77626 H1 WAT 6987 120.266 69.070 15.193 1.00 0.00 H ATOM 77627 H2 WAT 6987 119.919 69.597 16.569 1.00 0.00 H TER 77629 WAT 6987 ATOM 77629 O WAT 6988 140.096 0.860 66.721 1.00 0.00 O ATOM 77630 H1 WAT 6988 140.371 1.236 67.557 1.00 0.00 H ATOM 77631 H2 WAT 6988 140.210 1.569 66.090 1.00 0.00 H TER 77633 WAT 6988 ATOM 77633 O WAT 6989 129.046 55.349 135.446 1.00 0.00 O ATOM 77634 H1 WAT 6989 128.326 55.038 135.994 1.00 0.00 H ATOM 77635 H2 WAT 6989 129.717 54.671 135.525 1.00 0.00 H TER 77637 WAT 6989 ATOM 77637 O WAT 6990 48.848 132.257 1.815 1.00 0.00 O ATOM 77638 H1 WAT 6990 48.446 133.084 1.550 1.00 0.00 H ATOM 77639 H2 WAT 6990 48.268 131.583 1.459 1.00 0.00 H TER 77641 WAT 6990 ATOM 77641 O WAT 6991 21.423 139.867 65.124 1.00 0.00 O ATOM 77642 H1 WAT 6991 22.318 140.176 64.983 1.00 0.00 H ATOM 77643 H2 WAT 6991 21.467 138.924 64.969 1.00 0.00 H TER 77645 WAT 6991 ATOM 77645 O WAT 6992 115.429 43.219 145.108 1.00 0.00 O ATOM 77646 H1 WAT 6992 116.006 43.909 144.779 1.00 0.00 H ATOM 77647 H2 WAT 6992 115.111 42.778 144.320 1.00 0.00 H TER 77649 WAT 6992 ATOM 77649 O WAT 6993 105.219 2.805 13.566 1.00 0.00 O ATOM 77650 H1 WAT 6993 106.043 2.897 14.045 1.00 0.00 H ATOM 77651 H2 WAT 6993 104.542 2.986 14.217 1.00 0.00 H TER 77653 WAT 6993 ATOM 77653 O WAT 6994 3.083 134.094 59.662 1.00 0.00 O ATOM 77654 H1 WAT 6994 3.878 134.624 59.712 1.00 0.00 H ATOM 77655 H2 WAT 6994 2.843 133.935 60.575 1.00 0.00 H TER 77657 WAT 6994 ATOM 77657 O WAT 6995 48.218 25.367 58.325 1.00 0.00 O ATOM 77658 H1 WAT 6995 47.353 25.304 58.730 1.00 0.00 H ATOM 77659 H2 WAT 6995 48.225 24.674 57.666 1.00 0.00 H TER 77661 WAT 6995 ATOM 77661 O WAT 6996 122.975 100.580 88.441 1.00 0.00 O ATOM 77662 H1 WAT 6996 122.524 99.867 87.989 1.00 0.00 H ATOM 77663 H2 WAT 6996 122.767 100.447 89.365 1.00 0.00 H TER 77665 WAT 6996 ATOM 77665 O WAT 6997 143.422 18.893 82.013 1.00 0.00 O ATOM 77666 H1 WAT 6997 142.810 18.216 81.725 1.00 0.00 H ATOM 77667 H2 WAT 6997 144.186 18.409 82.325 1.00 0.00 H TER 77669 WAT 6997 ATOM 77669 O WAT 6998 25.186 46.681 121.511 1.00 0.00 O ATOM 77670 H1 WAT 6998 24.740 47.528 121.532 1.00 0.00 H ATOM 77671 H2 WAT 6998 24.559 46.090 121.095 1.00 0.00 H TER 77673 WAT 6998 ATOM 77673 O WAT 6999 82.872 9.289 127.786 1.00 0.00 O ATOM 77674 H1 WAT 6999 82.371 9.755 127.116 1.00 0.00 H ATOM 77675 H2 WAT 6999 82.217 8.788 128.271 1.00 0.00 H TER 77677 WAT 6999 ATOM 77677 O WAT 7000 68.343 71.357 1.622 1.00 0.00 O ATOM 77678 H1 WAT 7000 67.745 72.102 1.558 1.00 0.00 H ATOM 77679 H2 WAT 7000 68.443 71.052 0.721 1.00 0.00 H TER 77681 WAT 7000 ATOM 77681 O WAT 7001 131.659 114.765 91.666 1.00 0.00 O ATOM 77682 H1 WAT 7001 131.970 115.613 91.984 1.00 0.00 H ATOM 77683 H2 WAT 7001 132.282 114.132 92.025 1.00 0.00 H TER 77685 WAT 7001 ATOM 77685 O WAT 7002 8.997 49.765 157.253 1.00 0.00 O ATOM 77686 H1 WAT 7002 8.770 49.362 158.091 1.00 0.00 H ATOM 77687 H2 WAT 7002 9.448 49.073 156.769 1.00 0.00 H TER 77689 WAT 7002 ATOM 77689 O WAT 7003 90.694 1.585 75.933 1.00 0.00 O ATOM 77690 H1 WAT 7003 89.751 1.744 75.990 1.00 0.00 H ATOM 77691 H2 WAT 7003 91.053 2.396 75.575 1.00 0.00 H TER 77693 WAT 7003 ATOM 77693 O WAT 7004 52.301 61.900 119.933 1.00 0.00 O ATOM 77694 H1 WAT 7004 51.618 61.503 119.393 1.00 0.00 H ATOM 77695 H2 WAT 7004 53.016 61.264 119.921 1.00 0.00 H TER 77697 WAT 7004 ATOM 77697 O WAT 7005 0.586 17.263 67.728 1.00 0.00 O ATOM 77698 H1 WAT 7005 0.037 17.490 68.478 1.00 0.00 H ATOM 77699 H2 WAT 7005 0.566 16.306 67.697 1.00 0.00 H TER 77701 WAT 7005 ATOM 77701 O WAT 7006 34.932 24.879 102.422 1.00 0.00 O ATOM 77702 H1 WAT 7006 35.399 24.926 103.257 1.00 0.00 H ATOM 77703 H2 WAT 7006 34.091 25.302 102.594 1.00 0.00 H TER 77705 WAT 7006 ATOM 77705 O WAT 7007 54.611 73.027 114.492 1.00 0.00 O ATOM 77706 H1 WAT 7007 53.708 72.718 114.426 1.00 0.00 H ATOM 77707 H2 WAT 7007 54.806 72.997 115.429 1.00 0.00 H TER 77709 WAT 7007 ATOM 77709 O WAT 7008 91.574 84.784 152.375 1.00 0.00 O ATOM 77710 H1 WAT 7008 90.981 85.357 151.888 1.00 0.00 H ATOM 77711 H2 WAT 7008 91.868 85.317 153.114 1.00 0.00 H TER 77713 WAT 7008 ATOM 77713 O WAT 7009 135.036 25.077 116.269 1.00 0.00 O ATOM 77714 H1 WAT 7009 134.246 25.080 115.728 1.00 0.00 H ATOM 77715 H2 WAT 7009 135.384 25.965 116.189 1.00 0.00 H TER 77717 WAT 7009 ATOM 77717 O WAT 7010 124.211 131.699 103.580 1.00 0.00 O ATOM 77718 H1 WAT 7010 123.462 131.818 104.163 1.00 0.00 H ATOM 77719 H2 WAT 7010 124.652 130.917 103.914 1.00 0.00 H TER 77721 WAT 7010 ATOM 77721 O WAT 7011 106.079 138.375 6.745 1.00 0.00 O ATOM 77722 H1 WAT 7011 105.444 138.841 7.289 1.00 0.00 H ATOM 77723 H2 WAT 7011 105.828 137.454 6.820 1.00 0.00 H TER 77725 WAT 7011 ATOM 77725 O WAT 7012 59.339 7.537 147.065 1.00 0.00 O ATOM 77726 H1 WAT 7012 59.620 6.682 147.391 1.00 0.00 H ATOM 77727 H2 WAT 7012 59.493 7.496 146.121 1.00 0.00 H TER 77729 WAT 7012 ATOM 77729 O WAT 7013 97.042 111.718 138.010 1.00 0.00 O ATOM 77730 H1 WAT 7013 96.750 111.658 137.100 1.00 0.00 H ATOM 77731 H2 WAT 7013 97.747 111.074 138.078 1.00 0.00 H TER 77733 WAT 7013 ATOM 77733 O WAT 7014 37.739 73.402 107.873 1.00 0.00 O ATOM 77734 H1 WAT 7014 38.253 72.808 108.420 1.00 0.00 H ATOM 77735 H2 WAT 7014 38.302 73.582 107.120 1.00 0.00 H TER 77737 WAT 7014 ATOM 77737 O WAT 7015 13.963 32.779 132.433 1.00 0.00 O ATOM 77738 H1 WAT 7015 13.832 33.716 132.289 1.00 0.00 H ATOM 77739 H2 WAT 7015 14.497 32.496 131.691 1.00 0.00 H TER 77741 WAT 7015 ATOM 77741 O WAT 7016 79.151 145.385 1.464 1.00 0.00 O ATOM 77742 H1 WAT 7016 80.084 145.416 1.673 1.00 0.00 H ATOM 77743 H2 WAT 7016 78.788 144.750 2.081 1.00 0.00 H TER 77745 WAT 7016 ATOM 77745 O WAT 7017 115.844 2.963 78.119 1.00 0.00 O ATOM 77746 H1 WAT 7017 116.431 2.207 78.105 1.00 0.00 H ATOM 77747 H2 WAT 7017 115.031 2.643 77.729 1.00 0.00 H TER 77749 WAT 7017 ATOM 77749 O WAT 7018 137.871 104.026 113.306 1.00 0.00 O ATOM 77750 H1 WAT 7018 138.240 103.666 112.499 1.00 0.00 H ATOM 77751 H2 WAT 7018 137.732 104.953 113.113 1.00 0.00 H TER 77753 WAT 7018 ATOM 77753 O WAT 7019 145.388 74.563 116.052 1.00 0.00 O ATOM 77754 H1 WAT 7019 145.131 74.951 116.888 1.00 0.00 H ATOM 77755 H2 WAT 7019 146.239 74.954 115.857 1.00 0.00 H TER 77757 WAT 7019 ATOM 77757 O WAT 7020 49.216 135.631 122.600 1.00 0.00 O ATOM 77758 H1 WAT 7020 50.002 135.663 123.145 1.00 0.00 H ATOM 77759 H2 WAT 7020 49.384 136.263 121.901 1.00 0.00 H TER 77761 WAT 7020 ATOM 77761 O WAT 7021 98.160 8.200 137.876 1.00 0.00 O ATOM 77762 H1 WAT 7021 98.746 7.576 138.303 1.00 0.00 H ATOM 77763 H2 WAT 7021 98.665 8.535 137.135 1.00 0.00 H TER 77765 WAT 7021 ATOM 77765 O WAT 7022 92.524 29.821 141.718 1.00 0.00 O ATOM 77766 H1 WAT 7022 92.109 30.158 142.512 1.00 0.00 H ATOM 77767 H2 WAT 7022 93.400 30.206 141.723 1.00 0.00 H TER 77769 WAT 7022 ATOM 77769 O WAT 7023 51.664 143.570 76.637 1.00 0.00 O ATOM 77770 H1 WAT 7023 52.378 144.190 76.492 1.00 0.00 H ATOM 77771 H2 WAT 7023 51.051 144.038 77.204 1.00 0.00 H TER 77773 WAT 7023 ATOM 77773 O WAT 7024 41.960 140.657 63.139 1.00 0.00 O ATOM 77774 H1 WAT 7024 42.772 141.072 62.848 1.00 0.00 H ATOM 77775 H2 WAT 7024 42.206 139.750 63.320 1.00 0.00 H TER 77777 WAT 7024 ATOM 77777 O WAT 7025 129.622 127.149 72.348 1.00 0.00 O ATOM 77778 H1 WAT 7025 128.830 126.833 71.912 1.00 0.00 H ATOM 77779 H2 WAT 7025 129.584 126.761 73.223 1.00 0.00 H TER 77781 WAT 7025 ATOM 77781 O WAT 7026 21.354 46.016 60.921 1.00 0.00 O ATOM 77782 H1 WAT 7026 21.464 45.193 60.444 1.00 0.00 H ATOM 77783 H2 WAT 7026 20.482 46.322 60.674 1.00 0.00 H TER 77785 WAT 7026 ATOM 77785 O WAT 7027 123.043 134.649 100.155 1.00 0.00 O ATOM 77786 H1 WAT 7027 123.296 133.728 100.213 1.00 0.00 H ATOM 77787 H2 WAT 7027 123.457 135.060 100.914 1.00 0.00 H TER 77789 WAT 7027 ATOM 77789 O WAT 7028 114.461 108.496 62.175 1.00 0.00 O ATOM 77790 H1 WAT 7028 115.164 108.051 61.701 1.00 0.00 H ATOM 77791 H2 WAT 7028 113.672 108.004 61.949 1.00 0.00 H TER 77793 WAT 7028 ATOM 77793 O WAT 7029 25.404 131.962 88.968 1.00 0.00 O ATOM 77794 H1 WAT 7029 24.983 131.139 88.723 1.00 0.00 H ATOM 77795 H2 WAT 7029 25.085 132.596 88.325 1.00 0.00 H TER 77797 WAT 7029 ATOM 77797 O WAT 7030 76.717 110.338 9.573 1.00 0.00 O ATOM 77798 H1 WAT 7030 76.131 110.440 10.323 1.00 0.00 H ATOM 77799 H2 WAT 7030 76.168 110.533 8.813 1.00 0.00 H TER 77801 WAT 7030 ATOM 77801 O WAT 7031 76.782 6.312 8.731 1.00 0.00 O ATOM 77802 H1 WAT 7031 76.832 7.268 8.760 1.00 0.00 H ATOM 77803 H2 WAT 7031 75.895 6.109 9.027 1.00 0.00 H TER 77805 WAT 7031 ATOM 77805 O WAT 7032 48.768 18.658 64.607 1.00 0.00 O ATOM 77806 H1 WAT 7032 49.422 18.606 65.304 1.00 0.00 H ATOM 77807 H2 WAT 7032 49.281 18.738 63.803 1.00 0.00 H TER 77809 WAT 7032 ATOM 77809 O WAT 7033 121.807 47.525 151.435 1.00 0.00 O ATOM 77810 H1 WAT 7033 121.192 48.061 151.937 1.00 0.00 H ATOM 77811 H2 WAT 7033 122.636 47.606 151.906 1.00 0.00 H TER 77813 WAT 7033 ATOM 77813 O WAT 7034 55.252 132.878 81.996 1.00 0.00 O ATOM 77814 H1 WAT 7034 55.637 132.181 81.466 1.00 0.00 H ATOM 77815 H2 WAT 7034 54.576 133.260 81.435 1.00 0.00 H TER 77817 WAT 7034 ATOM 77817 O WAT 7035 8.140 17.658 55.601 1.00 0.00 O ATOM 77818 H1 WAT 7035 7.974 17.575 54.663 1.00 0.00 H ATOM 77819 H2 WAT 7035 7.430 17.168 56.015 1.00 0.00 H TER 77821 WAT 7035 ATOM 77821 O WAT 7036 103.106 22.357 126.569 1.00 0.00 O ATOM 77822 H1 WAT 7036 103.128 21.570 127.113 1.00 0.00 H ATOM 77823 H2 WAT 7036 102.494 22.146 125.865 1.00 0.00 H TER 77825 WAT 7036 ATOM 77825 O WAT 7037 141.243 54.609 65.816 1.00 0.00 O ATOM 77826 H1 WAT 7037 140.681 53.847 65.957 1.00 0.00 H ATOM 77827 H2 WAT 7037 142.070 54.242 65.503 1.00 0.00 H TER 77829 WAT 7037 ATOM 77829 O WAT 7038 145.686 0.894 74.727 1.00 0.00 O ATOM 77830 H1 WAT 7038 146.086 0.439 73.986 1.00 0.00 H ATOM 77831 H2 WAT 7038 144.981 0.313 75.012 1.00 0.00 H TER 77833 WAT 7038 ATOM 77833 O WAT 7039 105.708 123.066 85.693 1.00 0.00 O ATOM 77834 H1 WAT 7039 105.792 123.981 85.426 1.00 0.00 H ATOM 77835 H2 WAT 7039 104.880 123.031 86.172 1.00 0.00 H TER 77837 WAT 7039 ATOM 77837 O WAT 7040 135.740 41.428 146.871 1.00 0.00 O ATOM 77838 H1 WAT 7040 135.017 40.989 147.321 1.00 0.00 H ATOM 77839 H2 WAT 7040 135.352 41.758 146.061 1.00 0.00 H TER 77841 WAT 7040 ATOM 77841 O WAT 7041 106.645 25.419 139.495 1.00 0.00 O ATOM 77842 H1 WAT 7041 105.994 24.892 139.031 1.00 0.00 H ATOM 77843 H2 WAT 7041 107.459 24.924 139.411 1.00 0.00 H TER 77845 WAT 7041 ATOM 77845 O WAT 7042 41.646 45.487 0.520 1.00 0.00 O ATOM 77846 H1 WAT 7042 41.798 46.257 1.068 1.00 0.00 H ATOM 77847 H2 WAT 7042 42.519 45.223 0.229 1.00 0.00 H TER 77849 WAT 7042 ATOM 77849 O WAT 7043 27.100 79.840 24.814 1.00 0.00 O ATOM 77850 H1 WAT 7043 26.175 79.599 24.763 1.00 0.00 H ATOM 77851 H2 WAT 7043 27.114 80.625 25.360 1.00 0.00 H TER 77853 WAT 7043 ATOM 77853 O WAT 7044 35.303 84.048 88.831 1.00 0.00 O ATOM 77854 H1 WAT 7044 35.099 83.836 87.920 1.00 0.00 H ATOM 77855 H2 WAT 7044 36.195 83.725 88.958 1.00 0.00 H TER 77857 WAT 7044 ATOM 77857 O WAT 7045 138.987 66.500 89.972 1.00 0.00 O ATOM 77858 H1 WAT 7045 138.709 65.611 89.752 1.00 0.00 H ATOM 77859 H2 WAT 7045 139.920 66.519 89.759 1.00 0.00 H TER 77861 WAT 7045 ATOM 77861 O WAT 7046 51.512 56.657 108.320 1.00 0.00 O ATOM 77862 H1 WAT 7046 50.875 56.073 107.907 1.00 0.00 H ATOM 77863 H2 WAT 7046 51.985 57.051 107.587 1.00 0.00 H TER 77865 WAT 7046 ATOM 77865 O WAT 7047 134.709 34.449 127.973 1.00 0.00 O ATOM 77866 H1 WAT 7047 134.732 34.457 127.016 1.00 0.00 H ATOM 77867 H2 WAT 7047 134.467 35.344 128.214 1.00 0.00 H TER 77869 WAT 7047 ATOM 77869 O WAT 7048 18.440 106.642 137.492 1.00 0.00 O ATOM 77870 H1 WAT 7048 19.052 106.187 136.914 1.00 0.00 H ATOM 77871 H2 WAT 7048 17.588 106.538 137.069 1.00 0.00 H TER 77873 WAT 7048 ATOM 77873 O WAT 7049 103.465 49.955 115.029 1.00 0.00 O ATOM 77874 H1 WAT 7049 104.419 50.011 114.985 1.00 0.00 H ATOM 77875 H2 WAT 7049 103.291 49.412 115.798 1.00 0.00 H TER 77877 WAT 7049 ATOM 77877 O WAT 7050 97.269 43.960 56.404 1.00 0.00 O ATOM 77878 H1 WAT 7050 97.184 44.803 55.959 1.00 0.00 H ATOM 77879 H2 WAT 7050 97.604 44.180 57.274 1.00 0.00 H TER 77881 WAT 7050 ATOM 77881 O WAT 7051 143.466 116.033 129.385 1.00 0.00 O ATOM 77882 H1 WAT 7051 143.686 116.662 130.073 1.00 0.00 H ATOM 77883 H2 WAT 7051 143.898 115.222 129.655 1.00 0.00 H TER 77885 WAT 7051 ATOM 77885 O WAT 7052 28.807 31.226 147.877 1.00 0.00 O ATOM 77886 H1 WAT 7052 28.152 31.922 147.933 1.00 0.00 H ATOM 77887 H2 WAT 7052 29.220 31.217 148.740 1.00 0.00 H TER 77889 WAT 7052 ATOM 77889 O WAT 7053 103.811 13.109 4.714 1.00 0.00 O ATOM 77890 H1 WAT 7053 104.035 13.654 3.960 1.00 0.00 H ATOM 77891 H2 WAT 7053 103.355 12.355 4.339 1.00 0.00 H TER 77893 WAT 7053 ATOM 77893 O WAT 7054 2.286 77.990 1.759 1.00 0.00 O ATOM 77894 H1 WAT 7054 3.242 78.042 1.784 1.00 0.00 H ATOM 77895 H2 WAT 7054 2.048 77.558 2.579 1.00 0.00 H TER 77897 WAT 7054 ATOM 77897 O WAT 7055 26.558 111.675 130.955 1.00 0.00 O ATOM 77898 H1 WAT 7055 27.149 111.312 130.294 1.00 0.00 H ATOM 77899 H2 WAT 7055 26.032 112.318 130.479 1.00 0.00 H TER 77901 WAT 7055 ATOM 77901 O WAT 7056 89.981 123.208 0.404 1.00 0.00 O ATOM 77902 H1 WAT 7056 89.566 122.646 1.059 1.00 0.00 H ATOM 77903 H2 WAT 7056 90.310 123.955 0.904 1.00 0.00 H TER 77905 WAT 7056 ATOM 77905 O WAT 7057 119.195 34.973 102.448 1.00 0.00 O ATOM 77906 H1 WAT 7057 119.375 34.774 101.530 1.00 0.00 H ATOM 77907 H2 WAT 7057 119.978 34.682 102.915 1.00 0.00 H TER 77909 WAT 7057 ATOM 77909 O WAT 7058 103.314 71.732 104.112 1.00 0.00 O ATOM 77910 H1 WAT 7058 102.727 71.001 104.305 1.00 0.00 H ATOM 77911 H2 WAT 7058 103.803 71.867 104.924 1.00 0.00 H TER 77913 WAT 7058 ATOM 77913 O WAT 7059 96.580 116.061 77.639 1.00 0.00 O ATOM 77914 H1 WAT 7059 96.018 115.548 77.059 1.00 0.00 H ATOM 77915 H2 WAT 7059 97.257 115.446 77.922 1.00 0.00 H TER 77917 WAT 7059 ATOM 77917 O WAT 7060 138.353 8.751 63.074 1.00 0.00 O ATOM 77918 H1 WAT 7060 137.863 8.844 63.892 1.00 0.00 H ATOM 77919 H2 WAT 7060 139.155 8.294 63.327 1.00 0.00 H TER 77921 WAT 7060 ATOM 77921 O WAT 7061 20.039 33.301 146.463 1.00 0.00 O ATOM 77922 H1 WAT 7061 20.699 32.622 146.321 1.00 0.00 H ATOM 77923 H2 WAT 7061 20.528 34.123 146.417 1.00 0.00 H TER 77925 WAT 7061 ATOM 77925 O WAT 7062 90.088 134.822 96.253 1.00 0.00 O ATOM 77926 H1 WAT 7062 89.202 134.850 96.612 1.00 0.00 H ATOM 77927 H2 WAT 7062 90.446 135.692 96.429 1.00 0.00 H TER 77929 WAT 7062 ATOM 77929 O WAT 7063 47.083 17.875 89.241 1.00 0.00 O ATOM 77930 H1 WAT 7063 47.526 17.584 90.038 1.00 0.00 H ATOM 77931 H2 WAT 7063 46.916 17.069 88.752 1.00 0.00 H TER 77933 WAT 7063 ATOM 77933 O WAT 7064 3.418 19.497 136.185 1.00 0.00 O ATOM 77934 H1 WAT 7064 4.065 18.801 136.072 1.00 0.00 H ATOM 77935 H2 WAT 7064 2.574 19.060 136.077 1.00 0.00 H TER 77937 WAT 7064 ATOM 77937 O WAT 7065 119.939 9.693 141.900 1.00 0.00 O ATOM 77938 H1 WAT 7065 119.777 10.613 141.692 1.00 0.00 H ATOM 77939 H2 WAT 7065 120.659 9.714 142.530 1.00 0.00 H TER 77941 WAT 7065 ATOM 77941 O WAT 7066 16.515 18.022 24.617 1.00 0.00 O ATOM 77942 H1 WAT 7066 16.709 18.051 23.680 1.00 0.00 H ATOM 77943 H2 WAT 7066 16.681 18.914 24.923 1.00 0.00 H TER 77945 WAT 7066 ATOM 77945 O WAT 7067 51.969 78.737 91.657 1.00 0.00 O ATOM 77946 H1 WAT 7067 51.382 77.992 91.526 1.00 0.00 H ATOM 77947 H2 WAT 7067 51.679 79.386 91.016 1.00 0.00 H TER 77949 WAT 7067 ATOM 77949 O WAT 7068 98.217 27.886 70.052 1.00 0.00 O ATOM 77950 H1 WAT 7068 98.417 26.954 70.141 1.00 0.00 H ATOM 77951 H2 WAT 7068 98.911 28.328 70.541 1.00 0.00 H TER 77953 WAT 7068 ATOM 77953 O WAT 7069 13.809 104.857 135.185 1.00 0.00 O ATOM 77954 H1 WAT 7069 14.119 104.378 135.954 1.00 0.00 H ATOM 77955 H2 WAT 7069 12.984 105.253 135.466 1.00 0.00 H TER 77957 WAT 7069 ATOM 77957 O WAT 7070 36.715 61.939 138.785 1.00 0.00 O ATOM 77958 H1 WAT 7070 36.066 62.624 138.943 1.00 0.00 H ATOM 77959 H2 WAT 7070 37.515 62.267 139.197 1.00 0.00 H TER 77961 WAT 7070 ATOM 77961 O WAT 7071 9.991 5.682 83.455 1.00 0.00 O ATOM 77962 H1 WAT 7071 9.842 5.377 82.560 1.00 0.00 H ATOM 77963 H2 WAT 7071 9.114 5.827 83.808 1.00 0.00 H TER 77965 WAT 7071 ATOM 77965 O WAT 7072 36.160 117.084 101.188 1.00 0.00 O ATOM 77966 H1 WAT 7072 36.101 117.920 100.727 1.00 0.00 H ATOM 77967 H2 WAT 7072 35.819 117.268 102.064 1.00 0.00 H TER 77969 WAT 7072 ATOM 77969 O WAT 7073 97.057 142.658 78.077 1.00 0.00 O ATOM 77970 H1 WAT 7073 97.520 141.839 78.253 1.00 0.00 H ATOM 77971 H2 WAT 7073 96.889 142.640 77.135 1.00 0.00 H TER 77973 WAT 7073 ATOM 77973 O WAT 7074 57.124 132.386 104.851 1.00 0.00 O ATOM 77974 H1 WAT 7074 57.433 131.744 104.211 1.00 0.00 H ATOM 77975 H2 WAT 7074 57.384 132.024 105.698 1.00 0.00 H TER 77977 WAT 7074 ATOM 77977 O WAT 7075 1.554 4.991 1.125 1.00 0.00 O ATOM 77978 H1 WAT 7075 2.286 5.556 0.879 1.00 0.00 H ATOM 77979 H2 WAT 7075 1.192 5.397 1.913 1.00 0.00 H TER 77981 WAT 7075 ATOM 77981 O WAT 7076 12.578 120.852 139.499 1.00 0.00 O ATOM 77982 H1 WAT 7076 11.928 120.549 140.132 1.00 0.00 H ATOM 77983 H2 WAT 7076 13.361 121.024 140.023 1.00 0.00 H TER 77985 WAT 7076 ATOM 77985 O WAT 7077 145.700 8.701 55.861 1.00 0.00 O ATOM 77986 H1 WAT 7077 146.065 9.436 55.369 1.00 0.00 H ATOM 77987 H2 WAT 7077 144.896 8.475 55.395 1.00 0.00 H TER 77989 WAT 7077 ATOM 77989 O WAT 7078 9.664 52.084 143.387 1.00 0.00 O ATOM 77990 H1 WAT 7078 10.419 51.565 143.667 1.00 0.00 H ATOM 77991 H2 WAT 7078 9.041 51.440 143.052 1.00 0.00 H TER 77993 WAT 7078 ATOM 77993 O WAT 7079 77.560 79.255 115.980 1.00 0.00 O ATOM 77994 H1 WAT 7079 77.883 79.111 116.869 1.00 0.00 H ATOM 77995 H2 WAT 7079 77.804 80.158 115.779 1.00 0.00 H TER 77997 WAT 7079 ATOM 77997 O WAT 7080 29.098 25.918 13.673 1.00 0.00 O ATOM 77998 H1 WAT 7080 29.272 26.857 13.740 1.00 0.00 H ATOM 77999 H2 WAT 7080 29.603 25.634 12.911 1.00 0.00 H TER 78001 WAT 7080 ATOM 78001 O WAT 7081 118.942 69.560 9.328 1.00 0.00 O ATOM 78002 H1 WAT 7081 119.295 70.235 9.908 1.00 0.00 H ATOM 78003 H2 WAT 7081 119.486 68.791 9.497 1.00 0.00 H TER 78005 WAT 7081 ATOM 78005 O WAT 7082 62.863 23.583 80.637 1.00 0.00 O ATOM 78006 H1 WAT 7082 63.757 23.688 80.314 1.00 0.00 H ATOM 78007 H2 WAT 7082 62.363 23.302 79.871 1.00 0.00 H TER 78009 WAT 7082 ATOM 78009 O WAT 7083 84.081 60.289 144.406 1.00 0.00 O ATOM 78010 H1 WAT 7083 84.578 59.941 145.146 1.00 0.00 H ATOM 78011 H2 WAT 7083 83.355 59.676 144.295 1.00 0.00 H TER 78013 WAT 7083 ATOM 78013 O WAT 7084 41.311 11.043 122.870 1.00 0.00 O ATOM 78014 H1 WAT 7084 41.869 10.298 122.646 1.00 0.00 H ATOM 78015 H2 WAT 7084 40.514 10.648 123.225 1.00 0.00 H TER 78017 WAT 7084 ATOM 78017 O WAT 7085 110.927 144.931 82.933 1.00 0.00 O ATOM 78018 H1 WAT 7085 111.544 145.662 82.965 1.00 0.00 H ATOM 78019 H2 WAT 7085 110.545 144.901 83.810 1.00 0.00 H TER 78021 WAT 7085 ATOM 78021 O WAT 7086 64.634 41.828 0.073 1.00 0.00 O ATOM 78022 H1 WAT 7086 65.556 42.052 -0.054 1.00 0.00 H ATOM 78023 H2 WAT 7086 64.180 42.670 0.067 1.00 0.00 H TER 78025 WAT 7086 ATOM 78025 O WAT 7087 50.770 140.915 12.952 1.00 0.00 O ATOM 78026 H1 WAT 7087 49.920 140.617 13.276 1.00 0.00 H ATOM 78027 H2 WAT 7087 50.558 141.509 12.232 1.00 0.00 H TER 78029 WAT 7087 ATOM 78029 O WAT 7088 46.435 70.210 31.062 1.00 0.00 O ATOM 78030 H1 WAT 7088 46.814 69.862 31.870 1.00 0.00 H ATOM 78031 H2 WAT 7088 47.172 70.260 30.454 1.00 0.00 H TER 78033 WAT 7088 ATOM 78033 O WAT 7089 22.498 74.903 99.601 1.00 0.00 O ATOM 78034 H1 WAT 7089 23.358 74.512 99.450 1.00 0.00 H ATOM 78035 H2 WAT 7089 22.440 75.610 98.959 1.00 0.00 H TER 78037 WAT 7089 ATOM 78037 O WAT 7090 13.414 142.444 68.792 1.00 0.00 O ATOM 78038 H1 WAT 7090 14.328 142.199 68.646 1.00 0.00 H ATOM 78039 H2 WAT 7090 13.335 142.518 69.743 1.00 0.00 H TER 78041 WAT 7090 ATOM 78041 O WAT 7091 119.345 116.913 156.566 1.00 0.00 O ATOM 78042 H1 WAT 7091 119.743 117.621 157.072 1.00 0.00 H ATOM 78043 H2 WAT 7091 119.026 117.338 155.769 1.00 0.00 H TER 78045 WAT 7091 ATOM 78045 O WAT 7092 27.316 14.762 67.672 1.00 0.00 O ATOM 78046 H1 WAT 7092 27.620 14.569 68.558 1.00 0.00 H ATOM 78047 H2 WAT 7092 26.683 15.472 67.785 1.00 0.00 H TER 78049 WAT 7092 ATOM 78049 O WAT 7093 64.009 81.335 147.465 1.00 0.00 O ATOM 78050 H1 WAT 7093 64.072 80.733 148.206 1.00 0.00 H ATOM 78051 H2 WAT 7093 64.654 82.017 147.654 1.00 0.00 H TER 78053 WAT 7093 ATOM 78053 O WAT 7094 77.187 141.048 6.565 1.00 0.00 O ATOM 78054 H1 WAT 7094 77.582 140.329 7.058 1.00 0.00 H ATOM 78055 H2 WAT 7094 77.933 141.542 6.224 1.00 0.00 H TER 78057 WAT 7094 ATOM 78057 O WAT 7095 20.556 31.450 111.553 1.00 0.00 O ATOM 78058 H1 WAT 7095 19.931 30.725 111.559 1.00 0.00 H ATOM 78059 H2 WAT 7095 20.605 31.717 110.635 1.00 0.00 H TER 78061 WAT 7095 ATOM 78061 O WAT 7096 89.429 113.076 120.010 1.00 0.00 O ATOM 78062 H1 WAT 7096 89.132 112.176 119.882 1.00 0.00 H ATOM 78063 H2 WAT 7096 88.647 113.549 120.295 1.00 0.00 H TER 78065 WAT 7096 ATOM 78065 O WAT 7097 103.448 35.323 78.242 1.00 0.00 O ATOM 78066 H1 WAT 7097 102.955 35.836 77.601 1.00 0.00 H ATOM 78067 H2 WAT 7097 104.326 35.704 78.229 1.00 0.00 H TER 78069 WAT 7097 ATOM 78069 O WAT 7098 31.825 12.519 19.534 1.00 0.00 O ATOM 78070 H1 WAT 7098 32.738 12.721 19.332 1.00 0.00 H ATOM 78071 H2 WAT 7098 31.796 12.468 20.490 1.00 0.00 H TER 78073 WAT 7098 ATOM 78073 O WAT 7099 113.015 21.145 126.279 1.00 0.00 O ATOM 78074 H1 WAT 7099 112.828 20.207 126.298 1.00 0.00 H ATOM 78075 H2 WAT 7099 112.193 21.547 125.997 1.00 0.00 H TER 78077 WAT 7099 ATOM 78077 O WAT 7100 29.654 66.148 152.454 1.00 0.00 O ATOM 78078 H1 WAT 7100 30.318 65.499 152.687 1.00 0.00 H ATOM 78079 H2 WAT 7100 29.901 66.440 151.577 1.00 0.00 H TER 78081 WAT 7100 ATOM 78081 O WAT 7101 107.208 41.217 110.726 1.00 0.00 O ATOM 78082 H1 WAT 7101 107.163 40.307 110.434 1.00 0.00 H ATOM 78083 H2 WAT 7101 106.329 41.406 111.056 1.00 0.00 H TER 78085 WAT 7101 ATOM 78085 O WAT 7102 124.457 133.856 0.597 1.00 0.00 O ATOM 78086 H1 WAT 7102 124.439 134.716 0.177 1.00 0.00 H ATOM 78087 H2 WAT 7102 124.203 133.246 -0.096 1.00 0.00 H TER 78089 WAT 7102 ATOM 78089 O WAT 7103 4.794 19.858 139.967 1.00 0.00 O ATOM 78090 H1 WAT 7103 4.512 19.836 140.881 1.00 0.00 H ATOM 78091 H2 WAT 7103 4.423 20.670 139.621 1.00 0.00 H TER 78093 WAT 7103 ATOM 78093 O WAT 7104 60.369 7.849 58.462 1.00 0.00 O ATOM 78094 H1 WAT 7104 59.868 8.664 58.455 1.00 0.00 H ATOM 78095 H2 WAT 7104 60.801 7.841 59.316 1.00 0.00 H TER 78097 WAT 7104 ATOM 78097 O WAT 7105 114.583 99.648 17.357 1.00 0.00 O ATOM 78098 H1 WAT 7105 113.760 99.165 17.431 1.00 0.00 H ATOM 78099 H2 WAT 7105 114.336 100.481 16.956 1.00 0.00 H TER 78101 WAT 7105 ATOM 78101 O WAT 7106 11.864 34.071 110.102 1.00 0.00 O ATOM 78102 H1 WAT 7106 12.011 34.392 110.991 1.00 0.00 H ATOM 78103 H2 WAT 7106 11.326 34.747 109.689 1.00 0.00 H TER 78105 WAT 7106 ATOM 78105 O WAT 7107 94.546 103.084 78.353 1.00 0.00 O ATOM 78106 H1 WAT 7107 94.342 102.172 78.562 1.00 0.00 H ATOM 78107 H2 WAT 7107 94.721 103.080 77.412 1.00 0.00 H TER 78109 WAT 7107 ATOM 78109 O WAT 7108 126.333 8.463 100.050 1.00 0.00 O ATOM 78110 H1 WAT 7108 125.462 8.307 99.686 1.00 0.00 H ATOM 78111 H2 WAT 7108 126.516 7.684 100.575 1.00 0.00 H TER 78113 WAT 7108 ATOM 78113 O WAT 7109 128.923 47.902 131.489 1.00 0.00 O ATOM 78114 H1 WAT 7109 128.494 47.074 131.706 1.00 0.00 H ATOM 78115 H2 WAT 7109 128.819 47.984 130.541 1.00 0.00 H TER 78117 WAT 7109 ATOM 78117 O WAT 7110 66.965 61.186 130.049 1.00 0.00 O ATOM 78118 H1 WAT 7110 67.286 62.066 129.854 1.00 0.00 H ATOM 78119 H2 WAT 7110 66.235 61.326 130.652 1.00 0.00 H TER 78121 WAT 7110 ATOM 78121 O WAT 7111 41.762 138.259 86.039 1.00 0.00 O ATOM 78122 H1 WAT 7111 41.518 139.163 85.838 1.00 0.00 H ATOM 78123 H2 WAT 7111 42.235 138.317 86.869 1.00 0.00 H TER 78125 WAT 7111 ATOM 78125 O WAT 7112 140.585 91.913 138.936 1.00 0.00 O ATOM 78126 H1 WAT 7112 140.006 91.178 138.731 1.00 0.00 H ATOM 78127 H2 WAT 7112 140.889 92.223 138.083 1.00 0.00 H TER 78129 WAT 7112 ATOM 78129 O WAT 7113 122.366 55.978 147.288 1.00 0.00 O ATOM 78130 H1 WAT 7113 122.310 56.610 148.004 1.00 0.00 H ATOM 78131 H2 WAT 7113 121.462 55.697 147.145 1.00 0.00 H TER 78133 WAT 7113 ATOM 78133 O WAT 7114 43.815 111.105 121.618 1.00 0.00 O ATOM 78134 H1 WAT 7114 44.107 110.704 120.799 1.00 0.00 H ATOM 78135 H2 WAT 7114 44.013 110.452 122.288 1.00 0.00 H TER 78137 WAT 7114 ATOM 78137 O WAT 7115 97.401 120.892 112.766 1.00 0.00 O ATOM 78138 H1 WAT 7115 98.042 120.657 113.437 1.00 0.00 H ATOM 78139 H2 WAT 7115 97.743 121.699 112.380 1.00 0.00 H TER 78141 WAT 7115 ATOM 78141 O WAT 7116 24.839 4.172 157.642 1.00 0.00 O ATOM 78142 H1 WAT 7116 25.369 4.960 157.763 1.00 0.00 H ATOM 78143 H2 WAT 7116 25.462 3.450 157.721 1.00 0.00 H TER 78145 WAT 7116 ATOM 78145 O WAT 7117 144.613 138.655 75.545 1.00 0.00 O ATOM 78146 H1 WAT 7117 143.836 138.096 75.527 1.00 0.00 H ATOM 78147 H2 WAT 7117 144.860 138.690 76.469 1.00 0.00 H TER 78149 WAT 7117 ATOM 78149 O WAT 7118 96.754 106.655 117.638 1.00 0.00 O ATOM 78150 H1 WAT 7118 96.521 107.574 117.509 1.00 0.00 H ATOM 78151 H2 WAT 7118 96.437 106.214 116.850 1.00 0.00 H TER 78153 WAT 7118 ATOM 78153 O WAT 7119 69.739 105.088 126.118 1.00 0.00 O ATOM 78154 H1 WAT 7119 70.192 105.870 126.434 1.00 0.00 H ATOM 78155 H2 WAT 7119 70.426 104.426 126.045 1.00 0.00 H TER 78157 WAT 7119 ATOM 78157 O WAT 7120 95.197 125.150 66.944 1.00 0.00 O ATOM 78158 H1 WAT 7120 95.038 125.788 66.248 1.00 0.00 H ATOM 78159 H2 WAT 7120 94.650 125.448 67.671 1.00 0.00 H TER 78161 WAT 7120 ATOM 78161 O WAT 7121 68.608 36.816 96.699 1.00 0.00 O ATOM 78162 H1 WAT 7121 68.654 35.885 96.481 1.00 0.00 H ATOM 78163 H2 WAT 7121 69.522 37.085 96.793 1.00 0.00 H TER 78165 WAT 7121 ATOM 78165 O WAT 7122 101.772 79.224 21.483 1.00 0.00 O ATOM 78166 H1 WAT 7122 101.618 80.081 21.086 1.00 0.00 H ATOM 78167 H2 WAT 7122 101.224 78.623 20.978 1.00 0.00 H TER 78169 WAT 7122 ATOM 78169 O WAT 7123 33.080 65.354 150.127 1.00 0.00 O ATOM 78170 H1 WAT 7123 33.641 65.881 150.696 1.00 0.00 H ATOM 78171 H2 WAT 7123 33.046 64.497 150.552 1.00 0.00 H TER 78173 WAT 7123 ATOM 78173 O WAT 7124 123.230 4.062 105.667 1.00 0.00 O ATOM 78174 H1 WAT 7124 123.021 4.990 105.770 1.00 0.00 H ATOM 78175 H2 WAT 7124 122.386 3.645 105.491 1.00 0.00 H TER 78177 WAT 7124 ATOM 78177 O WAT 7125 113.798 101.467 119.476 1.00 0.00 O ATOM 78178 H1 WAT 7125 114.187 102.318 119.274 1.00 0.00 H ATOM 78179 H2 WAT 7125 112.856 101.633 119.500 1.00 0.00 H TER 78181 WAT 7125 ATOM 78181 O WAT 7126 46.926 108.419 55.847 1.00 0.00 O ATOM 78182 H1 WAT 7126 47.612 108.127 56.448 1.00 0.00 H ATOM 78183 H2 WAT 7126 46.323 107.679 55.793 1.00 0.00 H TER 78185 WAT 7126 ATOM 78185 O WAT 7127 88.618 11.364 5.573 1.00 0.00 O ATOM 78186 H1 WAT 7127 88.491 10.416 5.603 1.00 0.00 H ATOM 78187 H2 WAT 7127 89.043 11.575 6.404 1.00 0.00 H TER 78189 WAT 7127 ATOM 78189 O WAT 7128 39.599 54.260 90.071 1.00 0.00 O ATOM 78190 H1 WAT 7128 39.604 54.750 90.894 1.00 0.00 H ATOM 78191 H2 WAT 7128 40.254 54.699 89.528 1.00 0.00 H TER 78193 WAT 7128 ATOM 78193 O WAT 7129 123.120 85.722 81.189 1.00 0.00 O ATOM 78194 H1 WAT 7129 123.532 86.437 80.703 1.00 0.00 H ATOM 78195 H2 WAT 7129 123.606 84.941 80.925 1.00 0.00 H TER 78197 WAT 7129 ATOM 78197 O WAT 7130 42.978 144.090 117.219 1.00 0.00 O ATOM 78198 H1 WAT 7130 42.514 143.333 116.862 1.00 0.00 H ATOM 78199 H2 WAT 7130 42.512 144.847 116.864 1.00 0.00 H TER 78201 WAT 7130 ATOM 78201 O WAT 7131 36.845 140.724 79.803 1.00 0.00 O ATOM 78202 H1 WAT 7131 36.553 141.352 80.464 1.00 0.00 H ATOM 78203 H2 WAT 7131 37.039 141.259 79.033 1.00 0.00 H TER 78205 WAT 7131 ATOM 78205 O WAT 7132 80.258 115.886 97.760 1.00 0.00 O ATOM 78206 H1 WAT 7132 80.040 115.054 98.180 1.00 0.00 H ATOM 78207 H2 WAT 7132 80.485 115.649 96.861 1.00 0.00 H TER 78209 WAT 7132 ATOM 78209 O WAT 7133 120.399 94.424 19.039 1.00 0.00 O ATOM 78210 H1 WAT 7133 121.185 93.983 18.719 1.00 0.00 H ATOM 78211 H2 WAT 7133 120.188 93.975 19.857 1.00 0.00 H TER 78213 WAT 7133 ATOM 78213 O WAT 7134 131.759 10.445 120.220 1.00 0.00 O ATOM 78214 H1 WAT 7134 131.271 11.236 119.991 1.00 0.00 H ATOM 78215 H2 WAT 7134 131.243 9.730 119.848 1.00 0.00 H TER 78217 WAT 7134 ATOM 78217 O WAT 7135 34.969 1.168 149.998 1.00 0.00 O ATOM 78218 H1 WAT 7135 35.760 0.858 150.437 1.00 0.00 H ATOM 78219 H2 WAT 7135 34.342 0.452 150.100 1.00 0.00 H TER 78221 WAT 7135 ATOM 78221 O WAT 7136 23.715 115.543 156.810 1.00 0.00 O ATOM 78222 H1 WAT 7136 22.828 115.734 156.503 1.00 0.00 H ATOM 78223 H2 WAT 7136 23.949 116.297 157.351 1.00 0.00 H TER 78225 WAT 7136 ATOM 78225 O WAT 7137 10.553 -0.063 90.441 1.00 0.00 O ATOM 78226 H1 WAT 7137 9.714 -0.016 90.900 1.00 0.00 H ATOM 78227 H2 WAT 7137 10.691 0.822 90.103 1.00 0.00 H TER 78229 WAT 7137 ATOM 78229 O WAT 7138 17.489 72.945 147.952 1.00 0.00 O ATOM 78230 H1 WAT 7138 17.387 72.585 147.071 1.00 0.00 H ATOM 78231 H2 WAT 7138 18.177 73.604 147.863 1.00 0.00 H TER 78233 WAT 7138 ATOM 78233 O WAT 7139 27.447 108.047 18.926 1.00 0.00 O ATOM 78234 H1 WAT 7139 26.995 107.216 18.781 1.00 0.00 H ATOM 78235 H2 WAT 7139 28.058 107.866 19.640 1.00 0.00 H TER 78237 WAT 7139 ATOM 78237 O WAT 7140 122.321 136.291 116.104 1.00 0.00 O ATOM 78238 H1 WAT 7140 122.678 135.478 115.747 1.00 0.00 H ATOM 78239 H2 WAT 7140 122.702 136.979 115.559 1.00 0.00 H TER 78241 WAT 7140 ATOM 78241 O WAT 7141 81.985 137.232 87.056 1.00 0.00 O ATOM 78242 H1 WAT 7141 82.855 137.584 87.241 1.00 0.00 H ATOM 78243 H2 WAT 7141 82.151 136.376 86.662 1.00 0.00 H TER 78245 WAT 7141 ATOM 78245 O WAT 7142 63.335 58.071 3.330 1.00 0.00 O ATOM 78246 H1 WAT 7142 63.855 58.329 4.091 1.00 0.00 H ATOM 78247 H2 WAT 7142 63.983 57.831 2.668 1.00 0.00 H TER 78249 WAT 7142 ATOM 78249 O WAT 7143 130.838 95.258 9.451 1.00 0.00 O ATOM 78250 H1 WAT 7143 131.114 95.839 10.160 1.00 0.00 H ATOM 78251 H2 WAT 7143 131.329 95.562 8.687 1.00 0.00 H TER 78253 WAT 7143 ATOM 78253 O WAT 7144 89.439 109.645 99.791 1.00 0.00 O ATOM 78254 H1 WAT 7144 88.728 109.024 99.632 1.00 0.00 H ATOM 78255 H2 WAT 7144 89.149 110.454 99.371 1.00 0.00 H TER 78257 WAT 7144 ATOM 78257 O WAT 7145 44.461 58.947 111.785 1.00 0.00 O ATOM 78258 H1 WAT 7145 44.113 58.991 110.894 1.00 0.00 H ATOM 78259 H2 WAT 7145 43.873 59.501 112.299 1.00 0.00 H TER 78261 WAT 7145 ATOM 78261 O WAT 7146 112.017 25.098 136.972 1.00 0.00 O ATOM 78262 H1 WAT 7146 111.486 25.884 136.843 1.00 0.00 H ATOM 78263 H2 WAT 7146 111.938 24.618 136.147 1.00 0.00 H TER 78265 WAT 7146 ATOM 78265 O WAT 7147 63.055 4.295 108.275 1.00 0.00 O ATOM 78266 H1 WAT 7147 62.853 3.938 107.410 1.00 0.00 H ATOM 78267 H2 WAT 7147 62.611 3.708 108.886 1.00 0.00 H TER 78269 WAT 7147 ATOM 78269 O WAT 7148 81.070 130.875 67.689 1.00 0.00 O ATOM 78270 H1 WAT 7148 80.891 129.949 67.856 1.00 0.00 H ATOM 78271 H2 WAT 7148 81.317 130.907 66.765 1.00 0.00 H TER 78273 WAT 7148 ATOM 78273 O WAT 7149 116.127 32.980 155.357 1.00 0.00 O ATOM 78274 H1 WAT 7149 116.297 32.039 155.314 1.00 0.00 H ATOM 78275 H2 WAT 7149 115.890 33.221 154.461 1.00 0.00 H TER 78277 WAT 7149 ATOM 78277 O WAT 7150 130.971 85.294 136.054 1.00 0.00 O ATOM 78278 H1 WAT 7150 131.453 84.486 136.230 1.00 0.00 H ATOM 78279 H2 WAT 7150 130.297 85.324 136.732 1.00 0.00 H TER 78281 WAT 7150 ATOM 78281 O WAT 7151 93.964 101.701 118.849 1.00 0.00 O ATOM 78282 H1 WAT 7151 94.636 101.125 119.214 1.00 0.00 H ATOM 78283 H2 WAT 7151 94.238 102.581 119.107 1.00 0.00 H TER 78285 WAT 7151 ATOM 78285 O WAT 7152 75.649 9.539 150.102 1.00 0.00 O ATOM 78286 H1 WAT 7152 76.511 9.204 149.858 1.00 0.00 H ATOM 78287 H2 WAT 7152 75.097 9.358 149.340 1.00 0.00 H TER 78289 WAT 7152 ATOM 78289 O WAT 7153 123.430 81.800 96.583 1.00 0.00 O ATOM 78290 H1 WAT 7153 122.604 81.339 96.436 1.00 0.00 H ATOM 78291 H2 WAT 7153 123.958 81.189 97.096 1.00 0.00 H TER 78293 WAT 7153 ATOM 78293 O WAT 7154 25.001 37.700 144.649 1.00 0.00 O ATOM 78294 H1 WAT 7154 24.056 37.546 144.632 1.00 0.00 H ATOM 78295 H2 WAT 7154 25.244 37.806 143.729 1.00 0.00 H TER 78297 WAT 7154 ATOM 78297 O WAT 7155 87.713 99.848 22.679 1.00 0.00 O ATOM 78298 H1 WAT 7155 88.161 99.016 22.527 1.00 0.00 H ATOM 78299 H2 WAT 7155 86.866 99.599 23.048 1.00 0.00 H TER 78301 WAT 7155 ATOM 78301 O WAT 7156 123.702 58.245 10.480 1.00 0.00 O ATOM 78302 H1 WAT 7156 122.877 58.662 10.728 1.00 0.00 H ATOM 78303 H2 WAT 7156 123.458 57.620 9.797 1.00 0.00 H TER 78305 WAT 7156 ATOM 78305 O WAT 7157 45.016 108.321 97.434 1.00 0.00 O ATOM 78306 H1 WAT 7157 45.899 108.645 97.257 1.00 0.00 H ATOM 78307 H2 WAT 7157 44.437 108.989 97.066 1.00 0.00 H TER 78309 WAT 7157 ATOM 78309 O WAT 7158 142.016 40.959 66.119 1.00 0.00 O ATOM 78310 H1 WAT 7158 142.100 41.463 66.928 1.00 0.00 H ATOM 78311 H2 WAT 7158 141.129 40.602 66.151 1.00 0.00 H TER 78313 WAT 7158 ATOM 78313 O WAT 7159 121.089 72.580 86.162 1.00 0.00 O ATOM 78314 H1 WAT 7159 120.610 71.751 86.166 1.00 0.00 H ATOM 78315 H2 WAT 7159 122.007 72.325 86.066 1.00 0.00 H TER 78317 WAT 7159 ATOM 78317 O WAT 7160 24.955 85.885 157.656 1.00 0.00 O ATOM 78318 H1 WAT 7160 25.099 86.827 157.750 1.00 0.00 H ATOM 78319 H2 WAT 7160 24.825 85.755 156.717 1.00 0.00 H TER 78321 WAT 7160 ATOM 78321 O WAT 7161 85.697 41.059 57.715 1.00 0.00 O ATOM 78322 H1 WAT 7161 86.310 41.572 58.241 1.00 0.00 H ATOM 78323 H2 WAT 7161 86.204 40.299 57.429 1.00 0.00 H TER 78325 WAT 7161 ATOM 78325 O WAT 7162 33.257 52.122 112.947 1.00 0.00 O ATOM 78326 H1 WAT 7162 33.837 51.371 112.825 1.00 0.00 H ATOM 78327 H2 WAT 7162 33.689 52.837 112.481 1.00 0.00 H TER 78329 WAT 7162 ATOM 78329 O WAT 7163 98.052 33.943 86.809 1.00 0.00 O ATOM 78330 H1 WAT 7163 98.627 33.223 86.549 1.00 0.00 H ATOM 78331 H2 WAT 7163 98.511 34.732 86.520 1.00 0.00 H TER 78333 WAT 7163 ATOM 78333 O WAT 7164 134.328 117.635 150.944 1.00 0.00 O ATOM 78334 H1 WAT 7164 133.393 117.452 150.853 1.00 0.00 H ATOM 78335 H2 WAT 7164 134.401 118.581 150.817 1.00 0.00 H TER 78337 WAT 7164 ATOM 78337 O WAT 7165 90.595 106.448 101.653 1.00 0.00 O ATOM 78338 H1 WAT 7165 90.161 105.637 101.387 1.00 0.00 H ATOM 78339 H2 WAT 7165 89.927 106.927 102.144 1.00 0.00 H TER 78341 WAT 7165 ATOM 78341 O WAT 7166 41.387 95.850 146.938 1.00 0.00 O ATOM 78342 H1 WAT 7166 41.448 94.964 146.581 1.00 0.00 H ATOM 78343 H2 WAT 7166 42.180 96.288 146.629 1.00 0.00 H TER 78345 WAT 7166 ATOM 78345 O WAT 7167 85.983 10.520 147.062 1.00 0.00 O ATOM 78346 H1 WAT 7167 85.960 10.156 146.177 1.00 0.00 H ATOM 78347 H2 WAT 7167 85.228 11.108 147.099 1.00 0.00 H TER 78349 WAT 7167 ATOM 78349 O WAT 7168 12.110 141.528 94.828 1.00 0.00 O ATOM 78350 H1 WAT 7168 12.435 141.779 95.693 1.00 0.00 H ATOM 78351 H2 WAT 7168 12.512 142.158 94.229 1.00 0.00 H TER 78353 WAT 7168 ATOM 78353 O WAT 7169 60.588 128.648 56.262 1.00 0.00 O ATOM 78354 H1 WAT 7169 61.341 128.153 56.584 1.00 0.00 H ATOM 78355 H2 WAT 7169 60.370 128.236 55.426 1.00 0.00 H TER 78357 WAT 7169 ATOM 78357 O WAT 7170 9.117 109.862 117.395 1.00 0.00 O ATOM 78358 H1 WAT 7170 9.075 110.615 116.805 1.00 0.00 H ATOM 78359 H2 WAT 7170 9.444 110.223 118.219 1.00 0.00 H TER 78361 WAT 7170 ATOM 78361 O WAT 7171 65.355 107.170 143.236 1.00 0.00 O ATOM 78362 H1 WAT 7171 65.024 106.847 144.074 1.00 0.00 H ATOM 78363 H2 WAT 7171 66.305 107.203 143.350 1.00 0.00 H TER 78365 WAT 7171 ATOM 78365 O WAT 7172 129.121 86.311 20.378 1.00 0.00 O ATOM 78366 H1 WAT 7172 129.293 87.169 19.990 1.00 0.00 H ATOM 78367 H2 WAT 7172 129.535 85.690 19.779 1.00 0.00 H TER 78369 WAT 7172 ATOM 78369 O WAT 7173 122.400 103.043 79.184 1.00 0.00 O ATOM 78370 H1 WAT 7173 122.919 103.404 79.903 1.00 0.00 H ATOM 78371 H2 WAT 7173 121.710 103.690 79.038 1.00 0.00 H TER 78373 WAT 7173 ATOM 78373 O WAT 7174 78.322 136.725 131.452 1.00 0.00 O ATOM 78374 H1 WAT 7174 78.615 137.603 131.697 1.00 0.00 H ATOM 78375 H2 WAT 7174 79.108 136.296 131.115 1.00 0.00 H TER 78377 WAT 7174 ATOM 78377 O WAT 7175 74.402 96.770 124.791 1.00 0.00 O ATOM 78378 H1 WAT 7175 75.073 97.307 124.369 1.00 0.00 H ATOM 78379 H2 WAT 7175 74.813 96.466 125.600 1.00 0.00 H TER 78381 WAT 7175 ATOM 78381 O WAT 7176 19.949 1.641 113.397 1.00 0.00 O ATOM 78382 H1 WAT 7176 19.242 2.214 113.692 1.00 0.00 H ATOM 78383 H2 WAT 7176 20.632 1.741 114.059 1.00 0.00 H TER 78385 WAT 7176 ATOM 78385 O WAT 7177 121.292 61.908 11.643 1.00 0.00 O ATOM 78386 H1 WAT 7177 121.921 61.843 12.362 1.00 0.00 H ATOM 78387 H2 WAT 7177 121.699 62.512 11.022 1.00 0.00 H TER 78389 WAT 7177 ATOM 78389 O WAT 7178 99.134 109.399 147.869 1.00 0.00 O ATOM 78390 H1 WAT 7178 99.660 108.871 148.470 1.00 0.00 H ATOM 78391 H2 WAT 7178 98.255 109.026 147.929 1.00 0.00 H TER 78393 WAT 7178 ATOM 78393 O WAT 7179 83.131 78.317 2.685 1.00 0.00 O ATOM 78394 H1 WAT 7179 82.749 78.331 1.808 1.00 0.00 H ATOM 78395 H2 WAT 7179 84.017 77.978 2.555 1.00 0.00 H TER 78397 WAT 7179 ATOM 78397 O WAT 7180 98.883 85.840 158.234 1.00 0.00 O ATOM 78398 H1 WAT 7180 98.849 85.126 157.597 1.00 0.00 H ATOM 78399 H2 WAT 7180 99.311 86.557 157.767 1.00 0.00 H TER 78401 WAT 7180 ATOM 78401 O WAT 7181 69.308 7.628 122.747 1.00 0.00 O ATOM 78402 H1 WAT 7181 69.424 8.439 122.250 1.00 0.00 H ATOM 78403 H2 WAT 7181 68.541 7.791 123.295 1.00 0.00 H TER 78405 WAT 7181 ATOM 78405 O WAT 7182 42.827 69.228 83.692 1.00 0.00 O ATOM 78406 H1 WAT 7182 42.954 69.389 84.628 1.00 0.00 H ATOM 78407 H2 WAT 7182 41.877 69.221 83.577 1.00 0.00 H TER 78409 WAT 7182 ATOM 78409 O WAT 7183 2.993 79.275 95.202 1.00 0.00 O ATOM 78410 H1 WAT 7183 2.721 80.191 95.144 1.00 0.00 H ATOM 78411 H2 WAT 7183 2.176 78.778 95.144 1.00 0.00 H TER 78413 WAT 7183 ATOM 78413 O WAT 7184 59.486 29.157 157.572 1.00 0.00 O ATOM 78414 H1 WAT 7184 59.182 28.522 156.923 1.00 0.00 H ATOM 78415 H2 WAT 7184 60.441 29.124 157.510 1.00 0.00 H TER 78417 WAT 7184 ATOM 78417 O WAT 7185 64.615 17.594 122.875 1.00 0.00 O ATOM 78418 H1 WAT 7185 64.255 16.816 122.451 1.00 0.00 H ATOM 78419 H2 WAT 7185 65.444 17.751 122.424 1.00 0.00 H TER 78421 WAT 7185 ATOM 78421 O WAT 7186 16.673 77.104 11.373 1.00 0.00 O ATOM 78422 H1 WAT 7186 17.218 76.913 12.136 1.00 0.00 H ATOM 78423 H2 WAT 7186 15.954 77.634 11.718 1.00 0.00 H TER 78425 WAT 7186 ATOM 78425 O WAT 7187 49.379 4.793 146.590 1.00 0.00 O ATOM 78426 H1 WAT 7187 49.987 5.368 147.055 1.00 0.00 H ATOM 78427 H2 WAT 7187 49.782 4.662 145.732 1.00 0.00 H TER 78429 WAT 7187 ATOM 78429 O WAT 7188 13.440 0.559 147.797 1.00 0.00 O ATOM 78430 H1 WAT 7188 13.534 0.839 148.708 1.00 0.00 H ATOM 78431 H2 WAT 7188 14.105 1.058 147.323 1.00 0.00 H TER 78433 WAT 7188 ATOM 78433 O WAT 7189 33.813 76.590 5.601 1.00 0.00 O ATOM 78434 H1 WAT 7189 33.030 76.187 5.976 1.00 0.00 H ATOM 78435 H2 WAT 7189 34.542 76.131 6.018 1.00 0.00 H TER 78437 WAT 7189 ATOM 78437 O WAT 7190 77.859 42.782 20.087 1.00 0.00 O ATOM 78438 H1 WAT 7190 78.244 43.436 19.503 1.00 0.00 H ATOM 78439 H2 WAT 7190 78.373 41.990 19.930 1.00 0.00 H TER 78441 WAT 7190 ATOM 78441 O WAT 7191 78.600 138.614 61.752 1.00 0.00 O ATOM 78442 H1 WAT 7191 78.056 137.832 61.843 1.00 0.00 H ATOM 78443 H2 WAT 7191 79.423 138.384 62.184 1.00 0.00 H TER 78445 WAT 7191 ATOM 78445 O WAT 7192 3.459 54.941 101.354 1.00 0.00 O ATOM 78446 H1 WAT 7192 3.863 55.511 100.701 1.00 0.00 H ATOM 78447 H2 WAT 7192 2.715 55.446 101.685 1.00 0.00 H TER 78449 WAT 7192 ATOM 78449 O WAT 7193 8.030 72.098 64.034 1.00 0.00 O ATOM 78450 H1 WAT 7193 7.100 72.322 64.040 1.00 0.00 H ATOM 78451 H2 WAT 7193 8.478 72.937 63.925 1.00 0.00 H TER 78453 WAT 7193 ATOM 78453 O WAT 7194 129.135 110.958 83.015 1.00 0.00 O ATOM 78454 H1 WAT 7194 129.032 111.273 83.913 1.00 0.00 H ATOM 78455 H2 WAT 7194 128.441 111.398 82.525 1.00 0.00 H TER 78457 WAT 7194 ATOM 78457 O WAT 7195 33.176 145.293 69.394 1.00 0.00 O ATOM 78458 H1 WAT 7195 33.086 145.593 68.489 1.00 0.00 H ATOM 78459 H2 WAT 7195 32.384 145.605 69.830 1.00 0.00 H TER 78461 WAT 7195 ATOM 78461 O WAT 7196 2.944 120.250 121.911 1.00 0.00 O ATOM 78462 H1 WAT 7196 3.712 119.790 121.572 1.00 0.00 H ATOM 78463 H2 WAT 7196 3.284 120.785 122.628 1.00 0.00 H TER 78465 WAT 7196 ATOM 78465 O WAT 7197 68.591 39.934 89.939 1.00 0.00 O ATOM 78466 H1 WAT 7197 69.266 39.957 90.617 1.00 0.00 H ATOM 78467 H2 WAT 7197 68.880 39.248 89.336 1.00 0.00 H TER 78469 WAT 7197 ATOM 78469 O WAT 7198 24.296 4.096 134.049 1.00 0.00 O ATOM 78470 H1 WAT 7198 24.953 3.530 134.454 1.00 0.00 H ATOM 78471 H2 WAT 7198 24.777 4.888 133.809 1.00 0.00 H TER 78473 WAT 7198 ATOM 78473 O WAT 7199 104.304 132.633 147.592 1.00 0.00 O ATOM 78474 H1 WAT 7199 103.472 132.164 147.658 1.00 0.00 H ATOM 78475 H2 WAT 7199 104.622 132.434 146.712 1.00 0.00 H TER 78477 WAT 7199 ATOM 78477 O WAT 7200 72.394 65.001 94.152 1.00 0.00 O ATOM 78478 H1 WAT 7200 73.161 64.946 93.582 1.00 0.00 H ATOM 78479 H2 WAT 7200 72.385 65.909 94.454 1.00 0.00 H TER 78481 WAT 7200 ATOM 78481 O WAT 7201 81.435 123.754 91.423 1.00 0.00 O ATOM 78482 H1 WAT 7201 81.246 123.101 90.749 1.00 0.00 H ATOM 78483 H2 WAT 7201 80.711 124.377 91.363 1.00 0.00 H TER 78485 WAT 7201 ATOM 78485 O WAT 7202 124.280 89.863 141.336 1.00 0.00 O ATOM 78486 H1 WAT 7202 124.358 90.279 142.194 1.00 0.00 H ATOM 78487 H2 WAT 7202 125.003 89.237 141.305 1.00 0.00 H TER 78489 WAT 7202 ATOM 78489 O WAT 7203 93.694 54.983 6.409 1.00 0.00 O ATOM 78490 H1 WAT 7203 94.364 55.485 5.946 1.00 0.00 H ATOM 78491 H2 WAT 7203 93.246 54.490 5.722 1.00 0.00 H TER 78493 WAT 7203 ATOM 78493 O WAT 7204 134.515 44.921 97.303 1.00 0.00 O ATOM 78494 H1 WAT 7204 134.142 44.986 98.182 1.00 0.00 H ATOM 78495 H2 WAT 7204 135.219 45.570 97.294 1.00 0.00 H TER 78497 WAT 7204 ATOM 78497 O WAT 7205 67.851 59.536 94.299 1.00 0.00 O ATOM 78498 H1 WAT 7205 68.417 59.135 93.640 1.00 0.00 H ATOM 78499 H2 WAT 7205 67.008 59.642 93.857 1.00 0.00 H TER 78501 WAT 7205 ATOM 78501 O WAT 7206 25.070 125.345 101.578 1.00 0.00 O ATOM 78502 H1 WAT 7206 25.708 125.119 100.900 1.00 0.00 H ATOM 78503 H2 WAT 7206 24.465 125.948 101.146 1.00 0.00 H TER 78505 WAT 7206 ATOM 78505 O WAT 7207 91.379 73.617 100.518 1.00 0.00 O ATOM 78506 H1 WAT 7207 90.674 72.970 100.514 1.00 0.00 H ATOM 78507 H2 WAT 7207 91.483 73.863 99.599 1.00 0.00 H TER 78509 WAT 7207 ATOM 78509 O WAT 7208 111.008 16.036 146.298 1.00 0.00 O ATOM 78510 H1 WAT 7208 110.743 15.409 145.626 1.00 0.00 H ATOM 78511 H2 WAT 7208 111.934 16.200 146.121 1.00 0.00 H TER 78513 WAT 7208 ATOM 78513 O WAT 7209 119.150 110.968 123.914 1.00 0.00 O ATOM 78514 H1 WAT 7209 118.478 110.301 123.770 1.00 0.00 H ATOM 78515 H2 WAT 7209 119.977 110.509 123.766 1.00 0.00 H TER 78517 WAT 7209 ATOM 78517 O WAT 7210 115.034 94.658 56.880 1.00 0.00 O ATOM 78518 H1 WAT 7210 115.704 94.415 56.241 1.00 0.00 H ATOM 78519 H2 WAT 7210 115.167 94.052 57.609 1.00 0.00 H TER 78521 WAT 7210 ATOM 78521 O WAT 7211 95.306 90.859 138.042 1.00 0.00 O ATOM 78522 H1 WAT 7211 94.542 91.182 137.563 1.00 0.00 H ATOM 78523 H2 WAT 7211 95.804 90.365 137.391 1.00 0.00 H TER 78525 WAT 7211 ATOM 78525 O WAT 7212 98.906 78.931 126.200 1.00 0.00 O ATOM 78526 H1 WAT 7212 99.767 79.292 125.988 1.00 0.00 H ATOM 78527 H2 WAT 7212 98.534 79.551 126.827 1.00 0.00 H TER 78529 WAT 7212 ATOM 78529 O WAT 7213 59.872 60.333 111.797 1.00 0.00 O ATOM 78530 H1 WAT 7213 59.097 60.480 112.340 1.00 0.00 H ATOM 78531 H2 WAT 7213 60.275 61.197 111.717 1.00 0.00 H TER 78533 WAT 7213 ATOM 78533 O WAT 7214 9.936 107.012 87.855 1.00 0.00 O ATOM 78534 H1 WAT 7214 10.679 106.921 87.260 1.00 0.00 H ATOM 78535 H2 WAT 7214 9.563 106.132 87.910 1.00 0.00 H TER 78537 WAT 7214 ATOM 78537 O WAT 7215 1.540 62.214 132.623 1.00 0.00 O ATOM 78538 H1 WAT 7215 1.525 63.070 132.195 1.00 0.00 H ATOM 78539 H2 WAT 7215 1.133 61.622 131.989 1.00 0.00 H TER 78541 WAT 7215 ATOM 78541 O WAT 7216 47.032 77.013 81.413 1.00 0.00 O ATOM 78542 H1 WAT 7216 47.797 76.454 81.550 1.00 0.00 H ATOM 78543 H2 WAT 7216 46.505 76.544 80.766 1.00 0.00 H TER 78545 WAT 7216 ATOM 78545 O WAT 7217 121.743 31.456 59.855 1.00 0.00 O ATOM 78546 H1 WAT 7217 122.473 31.963 59.499 1.00 0.00 H ATOM 78547 H2 WAT 7217 121.892 31.453 60.800 1.00 0.00 H TER 78549 WAT 7217 ATOM 78549 O WAT 7218 32.653 20.691 140.570 1.00 0.00 O ATOM 78550 H1 WAT 7218 32.965 20.792 139.671 1.00 0.00 H ATOM 78551 H2 WAT 7218 32.425 19.764 140.641 1.00 0.00 H TER 78553 WAT 7218 ATOM 78553 O WAT 7219 28.689 105.887 0.603 1.00 0.00 O ATOM 78554 H1 WAT 7219 28.703 106.255 -0.281 1.00 0.00 H ATOM 78555 H2 WAT 7219 28.114 106.471 1.097 1.00 0.00 H TER 78557 WAT 7219 ATOM 78557 O WAT 7220 57.535 10.415 20.161 1.00 0.00 O ATOM 78558 H1 WAT 7220 58.178 9.762 20.439 1.00 0.00 H ATOM 78559 H2 WAT 7220 56.693 9.967 20.233 1.00 0.00 H TER 78561 WAT 7220 ATOM 78561 O WAT 7221 27.358 2.560 14.782 1.00 0.00 O ATOM 78562 H1 WAT 7221 28.076 3.186 14.689 1.00 0.00 H ATOM 78563 H2 WAT 7221 26.601 3.097 15.017 1.00 0.00 H TER 78565 WAT 7221 ATOM 78565 O WAT 7222 0.713 110.858 101.555 1.00 0.00 O ATOM 78566 H1 WAT 7222 1.595 110.626 101.265 1.00 0.00 H ATOM 78567 H2 WAT 7222 0.137 110.505 100.877 1.00 0.00 H TER 78569 WAT 7222 ATOM 78569 O WAT 7223 99.783 27.854 88.372 1.00 0.00 O ATOM 78570 H1 WAT 7223 99.443 28.349 87.627 1.00 0.00 H ATOM 78571 H2 WAT 7223 100.670 27.605 88.110 1.00 0.00 H TER 78573 WAT 7223 ATOM 78573 O WAT 7224 103.914 50.878 148.462 1.00 0.00 O ATOM 78574 H1 WAT 7224 104.233 49.992 148.636 1.00 0.00 H ATOM 78575 H2 WAT 7224 104.174 51.052 147.557 1.00 0.00 H TER 78577 WAT 7224 ATOM 78577 O WAT 7225 64.080 126.834 74.411 1.00 0.00 O ATOM 78578 H1 WAT 7225 64.406 125.970 74.660 1.00 0.00 H ATOM 78579 H2 WAT 7225 63.672 126.700 73.556 1.00 0.00 H TER 78581 WAT 7225 ATOM 78581 O WAT 7226 121.125 69.678 130.622 1.00 0.00 O ATOM 78582 H1 WAT 7226 121.043 68.735 130.479 1.00 0.00 H ATOM 78583 H2 WAT 7226 120.389 70.058 130.142 1.00 0.00 H TER 78585 WAT 7226 ATOM 78585 O WAT 7227 61.803 34.116 57.522 1.00 0.00 O ATOM 78586 H1 WAT 7227 62.512 34.691 57.812 1.00 0.00 H ATOM 78587 H2 WAT 7227 62.111 33.234 57.728 1.00 0.00 H TER 78589 WAT 7227 ATOM 78589 O WAT 7228 114.604 14.239 111.718 1.00 0.00 O ATOM 78590 H1 WAT 7228 114.985 15.112 111.809 1.00 0.00 H ATOM 78591 H2 WAT 7228 115.147 13.808 111.058 1.00 0.00 H TER 78593 WAT 7228 ATOM 78593 O WAT 7229 54.046 75.651 123.225 1.00 0.00 O ATOM 78594 H1 WAT 7229 54.244 76.030 122.369 1.00 0.00 H ATOM 78595 H2 WAT 7229 54.172 76.372 123.842 1.00 0.00 H TER 78597 WAT 7229 ATOM 78597 O WAT 7230 54.344 3.938 87.214 1.00 0.00 O ATOM 78598 H1 WAT 7230 54.751 3.840 86.353 1.00 0.00 H ATOM 78599 H2 WAT 7230 53.404 3.901 87.040 1.00 0.00 H TER 78601 WAT 7230 ATOM 78601 O WAT 7231 81.755 77.653 148.109 1.00 0.00 O ATOM 78602 H1 WAT 7231 81.463 77.437 148.995 1.00 0.00 H ATOM 78603 H2 WAT 7231 82.112 78.537 148.184 1.00 0.00 H TER 78605 WAT 7231 ATOM 78605 O WAT 7232 40.546 41.444 13.263 1.00 0.00 O ATOM 78606 H1 WAT 7232 39.819 41.448 13.885 1.00 0.00 H ATOM 78607 H2 WAT 7232 41.329 41.515 13.809 1.00 0.00 H TER 78609 WAT 7232 ATOM 78609 O WAT 7233 79.567 135.000 134.896 1.00 0.00 O ATOM 78610 H1 WAT 7233 78.874 135.621 134.673 1.00 0.00 H ATOM 78611 H2 WAT 7233 79.796 134.587 134.064 1.00 0.00 H TER 78613 WAT 7233 ATOM 78613 O WAT 7234 18.818 52.927 125.559 1.00 0.00 O ATOM 78614 H1 WAT 7234 19.754 52.929 125.357 1.00 0.00 H ATOM 78615 H2 WAT 7234 18.773 53.159 126.486 1.00 0.00 H TER 78617 WAT 7234 ATOM 78617 O WAT 7235 87.733 63.798 125.531 1.00 0.00 O ATOM 78618 H1 WAT 7235 87.956 63.363 124.708 1.00 0.00 H ATOM 78619 H2 WAT 7235 88.388 64.491 125.620 1.00 0.00 H TER 78621 WAT 7235 ATOM 78621 O WAT 7236 27.242 88.472 136.163 1.00 0.00 O ATOM 78622 H1 WAT 7236 28.042 88.997 136.193 1.00 0.00 H ATOM 78623 H2 WAT 7236 27.069 88.247 137.077 1.00 0.00 H TER 78625 WAT 7236 ATOM 78625 O WAT 7237 89.866 7.260 113.829 1.00 0.00 O ATOM 78626 H1 WAT 7237 89.208 7.904 113.566 1.00 0.00 H ATOM 78627 H2 WAT 7237 89.425 6.416 113.736 1.00 0.00 H TER 78629 WAT 7237 ATOM 78629 O WAT 7238 130.338 39.630 118.581 1.00 0.00 O ATOM 78630 H1 WAT 7238 129.847 39.872 119.366 1.00 0.00 H ATOM 78631 H2 WAT 7238 130.733 40.449 118.283 1.00 0.00 H TER 78633 WAT 7238 ATOM 78633 O WAT 7239 116.119 14.329 97.258 1.00 0.00 O ATOM 78634 H1 WAT 7239 116.821 14.955 97.081 1.00 0.00 H ATOM 78635 H2 WAT 7239 116.509 13.474 97.076 1.00 0.00 H TER 78637 WAT 7239 ATOM 78637 O WAT 7240 83.224 32.117 145.035 1.00 0.00 O ATOM 78638 H1 WAT 7240 82.418 31.958 144.544 1.00 0.00 H ATOM 78639 H2 WAT 7240 82.936 32.219 145.942 1.00 0.00 H TER 78641 WAT 7240 ATOM 78641 O WAT 7241 87.454 131.254 95.620 1.00 0.00 O ATOM 78642 H1 WAT 7241 87.256 132.173 95.799 1.00 0.00 H ATOM 78643 H2 WAT 7241 86.811 130.995 94.960 1.00 0.00 H TER 78645 WAT 7241 ATOM 78645 O WAT 7242 59.161 98.760 131.337 1.00 0.00 O ATOM 78646 H1 WAT 7242 59.450 97.984 130.857 1.00 0.00 H ATOM 78647 H2 WAT 7242 58.836 98.418 132.170 1.00 0.00 H TER 78649 WAT 7242 ATOM 78649 O WAT 7243 83.167 12.203 116.417 1.00 0.00 O ATOM 78650 H1 WAT 7243 83.175 11.303 116.092 1.00 0.00 H ATOM 78651 H2 WAT 7243 84.092 12.439 116.491 1.00 0.00 H TER 78653 WAT 7243 ATOM 78653 O WAT 7244 120.206 49.781 57.121 1.00 0.00 O ATOM 78654 H1 WAT 7244 119.621 49.080 56.833 1.00 0.00 H ATOM 78655 H2 WAT 7244 119.772 50.155 57.888 1.00 0.00 H TER 78657 WAT 7244 ATOM 78657 O WAT 7245 60.488 114.611 132.037 1.00 0.00 O ATOM 78658 H1 WAT 7245 61.302 114.976 131.691 1.00 0.00 H ATOM 78659 H2 WAT 7245 59.798 115.136 131.631 1.00 0.00 H TER 78661 WAT 7245 ATOM 78661 O WAT 7246 64.289 78.684 1.932 1.00 0.00 O ATOM 78662 H1 WAT 7246 64.167 79.548 1.537 1.00 0.00 H ATOM 78663 H2 WAT 7246 63.946 78.072 1.280 1.00 0.00 H TER 78665 WAT 7246 ATOM 78665 O WAT 7247 132.814 87.189 96.871 1.00 0.00 O ATOM 78666 H1 WAT 7247 133.640 86.993 96.430 1.00 0.00 H ATOM 78667 H2 WAT 7247 132.141 86.990 96.220 1.00 0.00 H TER 78669 WAT 7247 ATOM 78669 O WAT 7248 120.368 71.781 122.773 1.00 0.00 O ATOM 78670 H1 WAT 7248 120.103 72.698 122.847 1.00 0.00 H ATOM 78671 H2 WAT 7248 119.899 71.339 123.481 1.00 0.00 H TER 78673 WAT 7248 ATOM 78673 O WAT 7249 79.465 137.423 64.768 1.00 0.00 O ATOM 78674 H1 WAT 7249 80.036 137.455 64.000 1.00 0.00 H ATOM 78675 H2 WAT 7249 78.954 136.622 64.653 1.00 0.00 H TER 78677 WAT 7249 ATOM 78677 O WAT 7250 90.046 65.445 125.584 1.00 0.00 O ATOM 78678 H1 WAT 7250 90.112 66.338 125.246 1.00 0.00 H ATOM 78679 H2 WAT 7250 90.474 64.905 124.920 1.00 0.00 H TER 78681 WAT 7250 ATOM 78681 O WAT 7251 84.719 138.029 130.431 1.00 0.00 O ATOM 78682 H1 WAT 7251 84.617 137.097 130.623 1.00 0.00 H ATOM 78683 H2 WAT 7251 84.082 138.463 130.999 1.00 0.00 H TER 78685 WAT 7251 ATOM 78685 O WAT 7252 125.760 1.816 17.211 1.00 0.00 O ATOM 78686 H1 WAT 7252 125.513 1.562 18.101 1.00 0.00 H ATOM 78687 H2 WAT 7252 126.636 2.191 17.303 1.00 0.00 H TER 78689 WAT 7252 ATOM 78689 O WAT 7253 105.746 52.790 113.120 1.00 0.00 O ATOM 78690 H1 WAT 7253 104.792 52.854 113.067 1.00 0.00 H ATOM 78691 H2 WAT 7253 106.064 53.384 112.440 1.00 0.00 H TER 78693 WAT 7253 ATOM 78693 O WAT 7254 94.124 9.072 106.976 1.00 0.00 O ATOM 78694 H1 WAT 7254 94.509 8.292 107.377 1.00 0.00 H ATOM 78695 H2 WAT 7254 94.527 9.804 107.443 1.00 0.00 H TER 78697 WAT 7254 ATOM 78697 O WAT 7255 66.748 61.998 77.107 1.00 0.00 O ATOM 78698 H1 WAT 7255 66.510 62.754 76.571 1.00 0.00 H ATOM 78699 H2 WAT 7255 67.613 62.213 77.454 1.00 0.00 H TER 78701 WAT 7255 ATOM 78701 O WAT 7256 11.924 104.109 21.875 1.00 0.00 O ATOM 78702 H1 WAT 7256 11.298 103.667 22.449 1.00 0.00 H ATOM 78703 H2 WAT 7256 12.583 103.444 21.681 1.00 0.00 H TER 78705 WAT 7256 ATOM 78705 O WAT 7257 69.710 42.345 149.794 1.00 0.00 O ATOM 78706 H1 WAT 7257 69.919 42.749 150.636 1.00 0.00 H ATOM 78707 H2 WAT 7257 70.481 41.818 149.584 1.00 0.00 H TER 78709 WAT 7257 ATOM 78709 O WAT 7258 7.534 60.946 86.282 1.00 0.00 O ATOM 78710 H1 WAT 7258 6.779 61.373 86.686 1.00 0.00 H ATOM 78711 H2 WAT 7258 7.954 61.636 85.768 1.00 0.00 H TER 78713 WAT 7258 ATOM 78713 O WAT 7259 117.759 128.851 70.896 1.00 0.00 O ATOM 78714 H1 WAT 7259 117.795 128.753 69.944 1.00 0.00 H ATOM 78715 H2 WAT 7259 116.852 128.647 71.123 1.00 0.00 H TER 78717 WAT 7259 ATOM 78717 O WAT 7260 9.487 38.615 76.571 1.00 0.00 O ATOM 78718 H1 WAT 7260 9.888 39.468 76.404 1.00 0.00 H ATOM 78719 H2 WAT 7260 10.226 38.009 76.620 1.00 0.00 H TER 78721 WAT 7260 ATOM 78721 O WAT 7261 86.835 78.840 127.172 1.00 0.00 O ATOM 78722 H1 WAT 7261 87.467 78.954 126.462 1.00 0.00 H ATOM 78723 H2 WAT 7261 86.822 77.897 127.331 1.00 0.00 H TER 78725 WAT 7261 ATOM 78725 O WAT 7262 8.657 137.026 124.010 1.00 0.00 O ATOM 78726 H1 WAT 7262 9.254 137.723 123.737 1.00 0.00 H ATOM 78727 H2 WAT 7262 8.468 137.220 124.928 1.00 0.00 H TER 78729 WAT 7262 ATOM 78729 O WAT 7263 2.427 70.517 58.619 1.00 0.00 O ATOM 78730 H1 WAT 7263 2.007 69.874 59.189 1.00 0.00 H ATOM 78731 H2 WAT 7263 1.942 70.461 57.796 1.00 0.00 H TER 78733 WAT 7263 ATOM 78733 O WAT 7264 86.222 33.355 134.005 1.00 0.00 O ATOM 78734 H1 WAT 7264 86.232 32.398 134.027 1.00 0.00 H ATOM 78735 H2 WAT 7264 87.143 33.602 133.931 1.00 0.00 H TER 78737 WAT 7264 ATOM 78737 O WAT 7265 135.388 24.410 71.155 1.00 0.00 O ATOM 78738 H1 WAT 7265 136.258 24.136 71.447 1.00 0.00 H ATOM 78739 H2 WAT 7265 134.845 23.628 71.250 1.00 0.00 H TER 78741 WAT 7265 ATOM 78741 O WAT 7266 33.509 63.854 111.030 1.00 0.00 O ATOM 78742 H1 WAT 7266 33.744 64.361 111.808 1.00 0.00 H ATOM 78743 H2 WAT 7266 33.417 62.956 111.348 1.00 0.00 H TER 78745 WAT 7266 ATOM 78745 O WAT 7267 7.488 124.145 121.421 1.00 0.00 O ATOM 78746 H1 WAT 7267 7.085 124.083 120.555 1.00 0.00 H ATOM 78747 H2 WAT 7267 8.270 123.596 121.362 1.00 0.00 H TER 78749 WAT 7267 ATOM 78749 O WAT 7268 117.746 77.933 12.702 1.00 0.00 O ATOM 78750 H1 WAT 7268 118.404 77.821 13.388 1.00 0.00 H ATOM 78751 H2 WAT 7268 117.360 77.063 12.596 1.00 0.00 H TER 78753 WAT 7268 ATOM 78753 O WAT 7269 97.425 3.894 137.371 1.00 0.00 O ATOM 78754 H1 WAT 7269 97.696 2.977 137.335 1.00 0.00 H ATOM 78755 H2 WAT 7269 98.055 4.353 136.816 1.00 0.00 H TER 78757 WAT 7269 ATOM 78757 O WAT 7270 75.929 76.606 72.228 1.00 0.00 O ATOM 78758 H1 WAT 7270 75.298 75.987 71.861 1.00 0.00 H ATOM 78759 H2 WAT 7270 75.403 77.368 72.471 1.00 0.00 H TER 78761 WAT 7270 ATOM 78761 O WAT 7271 112.040 48.393 155.732 1.00 0.00 O ATOM 78762 H1 WAT 7271 112.529 48.996 155.171 1.00 0.00 H ATOM 78763 H2 WAT 7271 111.470 47.916 155.129 1.00 0.00 H TER 78765 WAT 7271 ATOM 78765 O WAT 7272 68.904 14.824 119.123 1.00 0.00 O ATOM 78766 H1 WAT 7272 69.677 14.334 119.402 1.00 0.00 H ATOM 78767 H2 WAT 7272 68.241 14.621 119.783 1.00 0.00 H TER 78769 WAT 7272 ATOM 78769 O WAT 7273 0.405 100.462 21.477 1.00 0.00 O ATOM 78770 H1 WAT 7273 1.010 100.257 22.189 1.00 0.00 H ATOM 78771 H2 WAT 7273 -0.443 100.570 21.906 1.00 0.00 H TER 78773 WAT 7273 ATOM 78773 O WAT 7274 34.665 110.947 138.730 1.00 0.00 O ATOM 78774 H1 WAT 7274 33.887 110.621 138.278 1.00 0.00 H ATOM 78775 H2 WAT 7274 35.333 110.281 138.567 1.00 0.00 H TER 78777 WAT 7274 ATOM 78777 O WAT 7275 32.806 27.892 101.516 1.00 0.00 O ATOM 78778 H1 WAT 7275 32.186 27.485 100.910 1.00 0.00 H ATOM 78779 H2 WAT 7275 32.785 27.332 102.292 1.00 0.00 H TER 78781 WAT 7275 ATOM 78781 O WAT 7276 2.288 38.773 152.307 1.00 0.00 O ATOM 78782 H1 WAT 7276 2.292 39.649 151.921 1.00 0.00 H ATOM 78783 H2 WAT 7276 3.022 38.323 151.887 1.00 0.00 H TER 78785 WAT 7276 ATOM 78785 O WAT 7277 9.352 39.451 144.026 1.00 0.00 O ATOM 78786 H1 WAT 7277 9.054 39.027 144.831 1.00 0.00 H ATOM 78787 H2 WAT 7277 10.266 39.179 143.938 1.00 0.00 H TER 78789 WAT 7277 ATOM 78789 O WAT 7278 92.502 8.816 129.407 1.00 0.00 O ATOM 78790 H1 WAT 7278 93.049 8.295 129.995 1.00 0.00 H ATOM 78791 H2 WAT 7278 91.630 8.784 129.801 1.00 0.00 H TER 78793 WAT 7278 ATOM 78793 O WAT 7279 13.433 66.319 62.193 1.00 0.00 O ATOM 78794 H1 WAT 7279 13.978 66.983 62.614 1.00 0.00 H ATOM 78795 H2 WAT 7279 13.635 66.399 61.261 1.00 0.00 H TER 78797 WAT 7279 ATOM 78797 O WAT 7280 138.712 102.187 100.384 1.00 0.00 O ATOM 78798 H1 WAT 7280 139.172 101.438 100.004 1.00 0.00 H ATOM 78799 H2 WAT 7280 138.628 102.809 99.662 1.00 0.00 H TER 78801 WAT 7280 ATOM 78801 O WAT 7281 67.793 107.493 105.051 1.00 0.00 O ATOM 78802 H1 WAT 7281 68.626 107.721 105.464 1.00 0.00 H ATOM 78803 H2 WAT 7281 67.348 106.943 105.696 1.00 0.00 H TER 78805 WAT 7281 ATOM 78805 O WAT 7282 86.723 115.997 100.869 1.00 0.00 O ATOM 78806 H1 WAT 7282 87.374 115.356 101.151 1.00 0.00 H ATOM 78807 H2 WAT 7282 86.357 115.628 100.065 1.00 0.00 H TER 78809 WAT 7282 ATOM 78809 O WAT 7283 26.062 143.924 5.459 1.00 0.00 O ATOM 78810 H1 WAT 7283 25.227 143.687 5.056 1.00 0.00 H ATOM 78811 H2 WAT 7283 26.689 143.296 5.101 1.00 0.00 H TER 78813 WAT 7283 ATOM 78813 O WAT 7284 73.930 103.301 11.030 1.00 0.00 O ATOM 78814 H1 WAT 7284 73.116 103.772 10.852 1.00 0.00 H ATOM 78815 H2 WAT 7284 74.534 103.601 10.351 1.00 0.00 H TER 78817 WAT 7284 ATOM 78817 O WAT 7285 50.990 66.287 8.428 1.00 0.00 O ATOM 78818 H1 WAT 7285 50.257 65.944 7.917 1.00 0.00 H ATOM 78819 H2 WAT 7285 51.688 66.421 7.786 1.00 0.00 H TER 78821 WAT 7285 ATOM 78821 O WAT 7286 135.658 82.737 13.375 1.00 0.00 O ATOM 78822 H1 WAT 7286 136.569 82.839 13.651 1.00 0.00 H ATOM 78823 H2 WAT 7286 135.330 83.632 13.295 1.00 0.00 H TER 78825 WAT 7286 ATOM 78825 O WAT 7287 25.065 57.571 97.725 1.00 0.00 O ATOM 78826 H1 WAT 7287 25.091 56.665 98.031 1.00 0.00 H ATOM 78827 H2 WAT 7287 24.901 57.502 96.785 1.00 0.00 H TER 78829 WAT 7287 ATOM 78829 O WAT 7288 41.203 48.416 114.877 1.00 0.00 O ATOM 78830 H1 WAT 7288 41.884 48.833 114.348 1.00 0.00 H ATOM 78831 H2 WAT 7288 41.103 47.545 114.495 1.00 0.00 H TER 78833 WAT 7288 ATOM 78833 O WAT 7289 18.360 30.569 75.821 1.00 0.00 O ATOM 78834 H1 WAT 7289 18.459 29.635 76.005 1.00 0.00 H ATOM 78835 H2 WAT 7289 18.835 30.703 75.001 1.00 0.00 H TER 78837 WAT 7289 ATOM 78837 O WAT 7290 112.109 56.028 125.738 1.00 0.00 O ATOM 78838 H1 WAT 7290 112.331 56.959 125.753 1.00 0.00 H ATOM 78839 H2 WAT 7290 111.199 55.994 126.034 1.00 0.00 H TER 78841 WAT 7290 ATOM 78841 O WAT 7291 9.426 7.325 94.082 1.00 0.00 O ATOM 78842 H1 WAT 7291 8.654 7.688 93.647 1.00 0.00 H ATOM 78843 H2 WAT 7291 10.029 8.064 94.156 1.00 0.00 H TER 78845 WAT 7291 ATOM 78845 O WAT 7292 100.707 110.949 13.135 1.00 0.00 O ATOM 78846 H1 WAT 7292 101.468 111.256 12.642 1.00 0.00 H ATOM 78847 H2 WAT 7292 100.861 110.012 13.255 1.00 0.00 H TER 78849 WAT 7292 ATOM 78849 O WAT 7293 98.695 43.356 66.359 1.00 0.00 O ATOM 78850 H1 WAT 7293 98.954 43.687 65.499 1.00 0.00 H ATOM 78851 H2 WAT 7293 98.213 42.551 66.170 1.00 0.00 H TER 78853 WAT 7293 ATOM 78853 O WAT 7294 36.739 1.833 70.109 1.00 0.00 O ATOM 78854 H1 WAT 7294 35.820 1.866 69.845 1.00 0.00 H ATOM 78855 H2 WAT 7294 36.848 0.962 70.490 1.00 0.00 H TER 78857 WAT 7294 ATOM 78857 O WAT 7295 32.250 112.332 112.440 1.00 0.00 O ATOM 78858 H1 WAT 7295 31.673 111.722 112.900 1.00 0.00 H ATOM 78859 H2 WAT 7295 32.648 112.856 113.135 1.00 0.00 H TER 78861 WAT 7295 ATOM 78861 O WAT 7296 114.583 97.811 61.474 1.00 0.00 O ATOM 78862 H1 WAT 7296 114.130 97.822 62.317 1.00 0.00 H ATOM 78863 H2 WAT 7296 115.372 97.293 61.633 1.00 0.00 H TER 78865 WAT 7296 ATOM 78865 O WAT 7297 25.405 32.510 7.702 1.00 0.00 O ATOM 78866 H1 WAT 7297 25.296 32.586 6.754 1.00 0.00 H ATOM 78867 H2 WAT 7297 24.833 31.785 7.952 1.00 0.00 H TER 78869 WAT 7297 ATOM 78869 O WAT 7298 78.769 18.403 114.879 1.00 0.00 O ATOM 78870 H1 WAT 7298 79.054 19.243 115.240 1.00 0.00 H ATOM 78871 H2 WAT 7298 77.899 18.580 114.521 1.00 0.00 H TER 78873 WAT 7298 ATOM 78873 O WAT 7299 16.180 94.152 15.494 1.00 0.00 O ATOM 78874 H1 WAT 7299 17.081 94.006 15.782 1.00 0.00 H ATOM 78875 H2 WAT 7299 16.263 94.708 14.719 1.00 0.00 H TER 78877 WAT 7299 ATOM 78877 O WAT 7300 71.798 49.171 18.708 1.00 0.00 O ATOM 78878 H1 WAT 7300 72.201 48.562 18.089 1.00 0.00 H ATOM 78879 H2 WAT 7300 70.948 49.380 18.321 1.00 0.00 H TER 78881 WAT 7300 ATOM 78881 O WAT 7301 60.741 56.708 144.997 1.00 0.00 O ATOM 78882 H1 WAT 7301 60.802 55.830 145.372 1.00 0.00 H ATOM 78883 H2 WAT 7301 61.621 57.072 145.095 1.00 0.00 H TER 78885 WAT 7301 ATOM 78885 O WAT 7302 30.750 12.987 114.774 1.00 0.00 O ATOM 78886 H1 WAT 7302 29.954 12.880 115.295 1.00 0.00 H ATOM 78887 H2 WAT 7302 30.576 13.751 114.224 1.00 0.00 H TER 78889 WAT 7302 ATOM 78889 O WAT 7303 7.647 40.279 72.393 1.00 0.00 O ATOM 78890 H1 WAT 7303 6.986 40.074 71.732 1.00 0.00 H ATOM 78891 H2 WAT 7303 7.439 39.702 73.128 1.00 0.00 H TER 78893 WAT 7303 ATOM 78893 O WAT 7304 26.286 141.579 109.143 1.00 0.00 O ATOM 78894 H1 WAT 7304 26.023 140.776 109.593 1.00 0.00 H ATOM 78895 H2 WAT 7304 25.548 141.785 108.570 1.00 0.00 H TER 78897 WAT 7304 ATOM 78897 O WAT 7305 56.578 58.306 74.230 1.00 0.00 O ATOM 78898 H1 WAT 7305 55.973 59.046 74.271 1.00 0.00 H ATOM 78899 H2 WAT 7305 56.207 57.730 73.562 1.00 0.00 H TER 78901 WAT 7305 ATOM 78901 O WAT 7306 6.618 93.273 79.086 1.00 0.00 O ATOM 78902 H1 WAT 7306 6.932 92.543 78.551 1.00 0.00 H ATOM 78903 H2 WAT 7306 7.308 93.933 79.018 1.00 0.00 H TER 78905 WAT 7306 ATOM 78905 O WAT 7307 61.324 50.815 25.319 1.00 0.00 O ATOM 78906 H1 WAT 7307 60.411 51.094 25.390 1.00 0.00 H ATOM 78907 H2 WAT 7307 61.548 50.962 24.400 1.00 0.00 H TER 78909 WAT 7307 ATOM 78909 O WAT 7308 114.028 21.328 75.892 1.00 0.00 O ATOM 78910 H1 WAT 7308 114.060 22.247 75.628 1.00 0.00 H ATOM 78911 H2 WAT 7308 113.657 20.873 75.136 1.00 0.00 H TER 78913 WAT 7308 ATOM 78913 O WAT 7309 5.123 68.142 118.498 1.00 0.00 O ATOM 78914 H1 WAT 7309 4.177 68.265 118.579 1.00 0.00 H ATOM 78915 H2 WAT 7309 5.399 67.831 119.360 1.00 0.00 H TER 78917 WAT 7309 ATOM 78917 O WAT 7310 1.818 134.359 149.930 1.00 0.00 O ATOM 78918 H1 WAT 7310 2.590 133.825 149.743 1.00 0.00 H ATOM 78919 H2 WAT 7310 2.154 135.254 149.986 1.00 0.00 H TER 78921 WAT 7310 ATOM 78921 O WAT 7311 73.976 38.831 75.160 1.00 0.00 O ATOM 78922 H1 WAT 7311 74.579 39.055 75.869 1.00 0.00 H ATOM 78923 H2 WAT 7311 74.533 38.441 74.486 1.00 0.00 H TER 78925 WAT 7311 ATOM 78925 O WAT 7312 86.739 40.645 152.141 1.00 0.00 O ATOM 78926 H1 WAT 7312 86.268 39.947 151.686 1.00 0.00 H ATOM 78927 H2 WAT 7312 86.749 40.369 153.057 1.00 0.00 H TER 78929 WAT 7312 ATOM 78929 O WAT 7313 25.424 15.216 104.296 1.00 0.00 O ATOM 78930 H1 WAT 7313 25.991 15.615 104.956 1.00 0.00 H ATOM 78931 H2 WAT 7313 26.021 14.717 103.738 1.00 0.00 H TER 78933 WAT 7313 ATOM 78933 O WAT 7314 8.571 36.904 102.095 1.00 0.00 O ATOM 78934 H1 WAT 7314 8.913 37.733 101.760 1.00 0.00 H ATOM 78935 H2 WAT 7314 8.988 36.801 102.951 1.00 0.00 H TER 78937 WAT 7314 ATOM 78937 O WAT 7315 123.403 16.714 83.723 1.00 0.00 O ATOM 78938 H1 WAT 7315 124.138 16.362 84.225 1.00 0.00 H ATOM 78939 H2 WAT 7315 122.713 16.057 83.816 1.00 0.00 H TER 78941 WAT 7315 ATOM 78941 O WAT 7316 112.114 37.556 3.724 1.00 0.00 O ATOM 78942 H1 WAT 7316 112.962 37.411 4.144 1.00 0.00 H ATOM 78943 H2 WAT 7316 111.504 37.011 4.221 1.00 0.00 H TER 78945 WAT 7316 ATOM 78945 O WAT 7317 144.875 136.689 127.389 1.00 0.00 O ATOM 78946 H1 WAT 7317 145.571 136.731 128.044 1.00 0.00 H ATOM 78947 H2 WAT 7317 144.316 135.968 127.680 1.00 0.00 H TER 78949 WAT 7317 ATOM 78949 O WAT 7318 109.858 3.924 128.379 1.00 0.00 O ATOM 78950 H1 WAT 7318 108.902 3.910 128.422 1.00 0.00 H ATOM 78951 H2 WAT 7318 110.130 4.315 129.209 1.00 0.00 H TER 78953 WAT 7318 ATOM 78953 O WAT 7319 77.663 54.258 14.691 1.00 0.00 O ATOM 78954 H1 WAT 7319 78.010 54.608 13.871 1.00 0.00 H ATOM 78955 H2 WAT 7319 77.288 55.018 15.136 1.00 0.00 H TER 78957 WAT 7319 ATOM 78957 O WAT 7320 37.499 96.939 87.733 1.00 0.00 O ATOM 78958 H1 WAT 7320 37.253 96.034 87.540 1.00 0.00 H ATOM 78959 H2 WAT 7320 37.009 97.157 88.526 1.00 0.00 H TER 78961 WAT 7320 ATOM 78961 O WAT 7321 92.898 70.884 94.081 1.00 0.00 O ATOM 78962 H1 WAT 7321 91.964 71.043 94.223 1.00 0.00 H ATOM 78963 H2 WAT 7321 93.327 71.677 94.403 1.00 0.00 H TER 78965 WAT 7321 ATOM 78965 O WAT 7322 84.868 81.304 146.671 1.00 0.00 O ATOM 78966 H1 WAT 7322 84.500 82.136 146.375 1.00 0.00 H ATOM 78967 H2 WAT 7322 85.281 80.933 145.891 1.00 0.00 H TER 78969 WAT 7322 ATOM 78969 O WAT 7323 89.185 6.240 66.989 1.00 0.00 O ATOM 78970 H1 WAT 7323 88.311 6.627 66.937 1.00 0.00 H ATOM 78971 H2 WAT 7323 89.676 6.661 66.283 1.00 0.00 H TER 78973 WAT 7323 ATOM 78973 O WAT 7324 142.857 123.757 122.821 1.00 0.00 O ATOM 78974 H1 WAT 7324 142.426 123.431 122.031 1.00 0.00 H ATOM 78975 H2 WAT 7324 142.952 124.697 122.671 1.00 0.00 H TER 78977 WAT 7324 ATOM 78977 O WAT 7325 84.376 124.791 63.244 1.00 0.00 O ATOM 78978 H1 WAT 7325 84.436 125.535 62.645 1.00 0.00 H ATOM 78979 H2 WAT 7325 83.758 125.075 63.918 1.00 0.00 H TER 78981 WAT 7325 ATOM 78981 O WAT 7326 75.385 41.876 93.501 1.00 0.00 O ATOM 78982 H1 WAT 7326 74.714 42.448 93.129 1.00 0.00 H ATOM 78983 H2 WAT 7326 75.472 41.164 92.868 1.00 0.00 H TER 78985 WAT 7326 ATOM 78985 O WAT 7327 134.486 10.557 63.635 1.00 0.00 O ATOM 78986 H1 WAT 7327 134.225 11.265 63.046 1.00 0.00 H ATOM 78987 H2 WAT 7327 133.663 10.136 63.884 1.00 0.00 H TER 78989 WAT 7327 ATOM 78989 O WAT 7328 5.262 133.351 122.095 1.00 0.00 O ATOM 78990 H1 WAT 7328 4.708 133.947 121.590 1.00 0.00 H ATOM 78991 H2 WAT 7328 6.126 133.425 121.689 1.00 0.00 H TER 78993 WAT 7328 ATOM 78993 O WAT 7329 19.052 49.475 117.852 1.00 0.00 O ATOM 78994 H1 WAT 7329 18.888 49.906 118.691 1.00 0.00 H ATOM 78995 H2 WAT 7329 19.767 49.977 117.461 1.00 0.00 H TER 78997 WAT 7329 ATOM 78997 O WAT 7330 61.219 7.264 129.900 1.00 0.00 O ATOM 78998 H1 WAT 7330 61.959 7.848 129.731 1.00 0.00 H ATOM 78999 H2 WAT 7330 60.496 7.644 129.401 1.00 0.00 H TER 79001 WAT 7330 ATOM 79001 O WAT 7331 132.026 129.770 137.580 1.00 0.00 O ATOM 79002 H1 WAT 7331 131.192 129.930 138.022 1.00 0.00 H ATOM 79003 H2 WAT 7331 131.910 128.924 137.148 1.00 0.00 H TER 79005 WAT 7331 ATOM 79005 O WAT 7332 65.120 117.300 119.514 1.00 0.00 O ATOM 79006 H1 WAT 7332 64.702 118.160 119.563 1.00 0.00 H ATOM 79007 H2 WAT 7332 65.610 117.318 118.691 1.00 0.00 H TER 79009 WAT 7332 ATOM 79009 O WAT 7333 106.748 49.510 106.348 1.00 0.00 O ATOM 79010 H1 WAT 7333 107.670 49.585 106.595 1.00 0.00 H ATOM 79011 H2 WAT 7333 106.280 50.019 107.010 1.00 0.00 H TER 79013 WAT 7333 ATOM 79013 O WAT 7334 36.865 54.400 148.424 1.00 0.00 O ATOM 79014 H1 WAT 7334 37.424 54.242 149.185 1.00 0.00 H ATOM 79015 H2 WAT 7334 35.995 54.549 148.793 1.00 0.00 H TER 79017 WAT 7334 ATOM 79017 O WAT 7335 80.832 53.963 109.564 1.00 0.00 O ATOM 79018 H1 WAT 7335 81.278 54.385 110.297 1.00 0.00 H ATOM 79019 H2 WAT 7335 81.390 54.143 108.807 1.00 0.00 H TER 79021 WAT 7335 ATOM 79021 O WAT 7336 43.162 65.393 62.160 1.00 0.00 O ATOM 79022 H1 WAT 7336 42.381 65.799 62.534 1.00 0.00 H ATOM 79023 H2 WAT 7336 42.826 64.812 61.477 1.00 0.00 H TER 79025 WAT 7336 ATOM 79025 O WAT 7337 141.425 113.413 146.755 1.00 0.00 O ATOM 79026 H1 WAT 7337 141.355 112.486 146.984 1.00 0.00 H ATOM 79027 H2 WAT 7337 141.902 113.419 145.925 1.00 0.00 H TER 79029 WAT 7337 ATOM 79029 O WAT 7338 132.564 62.764 68.957 1.00 0.00 O ATOM 79030 H1 WAT 7338 133.339 63.311 69.085 1.00 0.00 H ATOM 79031 H2 WAT 7338 132.722 61.994 69.503 1.00 0.00 H TER 79033 WAT 7338 ATOM 79033 O WAT 7339 115.110 133.309 155.004 1.00 0.00 O ATOM 79034 H1 WAT 7339 115.452 133.921 154.353 1.00 0.00 H ATOM 79035 H2 WAT 7339 115.874 132.808 155.288 1.00 0.00 H TER 79037 WAT 7339 ATOM 79037 O WAT 7340 60.245 108.280 132.582 1.00 0.00 O ATOM 79038 H1 WAT 7340 59.874 109.153 132.712 1.00 0.00 H ATOM 79039 H2 WAT 7340 59.726 107.902 131.873 1.00 0.00 H TER 79041 WAT 7340 ATOM 79041 O WAT 7341 80.444 121.210 147.817 1.00 0.00 O ATOM 79042 H1 WAT 7341 80.810 120.437 147.386 1.00 0.00 H ATOM 79043 H2 WAT 7341 81.209 121.718 148.087 1.00 0.00 H TER 79045 WAT 7341 ATOM 79045 O WAT 7342 77.609 108.638 19.057 1.00 0.00 O ATOM 79046 H1 WAT 7342 76.672 108.483 18.944 1.00 0.00 H ATOM 79047 H2 WAT 7342 77.721 108.756 20.000 1.00 0.00 H TER 79049 WAT 7342 ATOM 79049 O WAT 7343 82.628 124.337 9.309 1.00 0.00 O ATOM 79050 H1 WAT 7343 82.019 123.708 9.697 1.00 0.00 H ATOM 79051 H2 WAT 7343 82.754 124.998 9.990 1.00 0.00 H TER 79053 WAT 7343 ATOM 79053 O WAT 7344 72.266 8.013 87.705 1.00 0.00 O ATOM 79054 H1 WAT 7344 71.529 7.512 87.358 1.00 0.00 H ATOM 79055 H2 WAT 7344 71.862 8.682 88.258 1.00 0.00 H TER 79057 WAT 7344 ATOM 79057 O WAT 7345 132.275 70.408 13.398 1.00 0.00 O ATOM 79058 H1 WAT 7345 131.964 71.053 14.033 1.00 0.00 H ATOM 79059 H2 WAT 7345 132.724 69.748 13.926 1.00 0.00 H TER 79061 WAT 7345 ATOM 79061 O WAT 7346 2.046 103.521 102.411 1.00 0.00 O ATOM 79062 H1 WAT 7346 2.673 104.227 102.253 1.00 0.00 H ATOM 79063 H2 WAT 7346 2.080 103.378 103.357 1.00 0.00 H TER 79065 WAT 7346 ATOM 79065 O WAT 7347 74.258 36.786 110.910 1.00 0.00 O ATOM 79066 H1 WAT 7347 73.903 36.935 110.034 1.00 0.00 H ATOM 79067 H2 WAT 7347 73.633 36.189 111.323 1.00 0.00 H TER 79069 WAT 7347 ATOM 79069 O WAT 7348 141.951 35.168 151.768 1.00 0.00 O ATOM 79070 H1 WAT 7348 142.277 35.821 152.388 1.00 0.00 H ATOM 79071 H2 WAT 7348 142.635 34.499 151.743 1.00 0.00 H TER 79073 WAT 7348 ATOM 79073 O WAT 7349 120.232 139.919 11.232 1.00 0.00 O ATOM 79074 H1 WAT 7349 120.503 139.005 11.310 1.00 0.00 H ATOM 79075 H2 WAT 7349 121.026 140.383 10.965 1.00 0.00 H TER 79077 WAT 7349 ATOM 79077 O WAT 7350 106.871 8.214 92.989 1.00 0.00 O ATOM 79078 H1 WAT 7350 107.043 8.855 92.299 1.00 0.00 H ATOM 79079 H2 WAT 7350 107.651 8.243 93.543 1.00 0.00 H TER 79081 WAT 7350 ATOM 79081 O WAT 7351 63.421 141.666 129.720 1.00 0.00 O ATOM 79082 H1 WAT 7351 64.068 142.351 129.887 1.00 0.00 H ATOM 79083 H2 WAT 7351 63.488 141.497 128.780 1.00 0.00 H TER 79085 WAT 7351 ATOM 79085 O WAT 7352 51.434 53.738 59.773 1.00 0.00 O ATOM 79086 H1 WAT 7352 51.076 52.851 59.737 1.00 0.00 H ATOM 79087 H2 WAT 7352 50.761 54.249 60.224 1.00 0.00 H TER 79089 WAT 7352 ATOM 79089 O WAT 7353 106.803 99.463 30.446 1.00 0.00 O ATOM 79090 H1 WAT 7353 106.764 98.775 29.781 1.00 0.00 H ATOM 79091 H2 WAT 7353 106.805 98.992 31.279 1.00 0.00 H TER 79093 WAT 7353 ATOM 79093 O WAT 7354 32.682 109.682 63.067 1.00 0.00 O ATOM 79094 H1 WAT 7354 33.373 110.241 63.422 1.00 0.00 H ATOM 79095 H2 WAT 7354 32.168 109.423 63.832 1.00 0.00 H TER 79097 WAT 7354 ATOM 79097 O WAT 7355 125.987 76.497 119.204 1.00 0.00 O ATOM 79098 H1 WAT 7355 125.606 75.800 118.669 1.00 0.00 H ATOM 79099 H2 WAT 7355 126.903 76.240 119.315 1.00 0.00 H TER 79101 WAT 7355 ATOM 79101 O WAT 7356 79.358 99.978 65.481 1.00 0.00 O ATOM 79102 H1 WAT 7356 78.906 100.519 66.128 1.00 0.00 H ATOM 79103 H2 WAT 7356 78.810 99.198 65.396 1.00 0.00 H TER 79105 WAT 7356 ATOM 79105 O WAT 7357 119.089 40.455 149.953 1.00 0.00 O ATOM 79106 H1 WAT 7357 120.035 40.338 150.047 1.00 0.00 H ATOM 79107 H2 WAT 7357 118.911 41.302 150.360 1.00 0.00 H TER 79109 WAT 7357 ATOM 79109 O WAT 7358 87.017 122.650 133.656 1.00 0.00 O ATOM 79110 H1 WAT 7358 87.847 123.039 133.383 1.00 0.00 H ATOM 79111 H2 WAT 7358 87.027 121.771 133.275 1.00 0.00 H TER 79113 WAT 7358 ATOM 79113 O WAT 7359 48.322 121.697 57.066 1.00 0.00 O ATOM 79114 H1 WAT 7359 48.648 121.836 56.177 1.00 0.00 H ATOM 79115 H2 WAT 7359 47.530 122.232 57.117 1.00 0.00 H TER 79117 WAT 7359 ATOM 79117 O WAT 7360 99.354 62.248 88.475 1.00 0.00 O ATOM 79118 H1 WAT 7360 99.948 62.986 88.340 1.00 0.00 H ATOM 79119 H2 WAT 7360 99.076 62.327 89.387 1.00 0.00 H TER 79121 WAT 7360 ATOM 79121 O WAT 7361 42.577 114.776 65.482 1.00 0.00 O ATOM 79122 H1 WAT 7361 42.832 115.689 65.614 1.00 0.00 H ATOM 79123 H2 WAT 7361 42.680 114.372 66.344 1.00 0.00 H TER 79125 WAT 7361 ATOM 79125 O WAT 7362 123.297 77.057 120.538 1.00 0.00 O ATOM 79126 H1 WAT 7362 124.216 77.175 120.299 1.00 0.00 H ATOM 79127 H2 WAT 7362 123.153 77.677 121.253 1.00 0.00 H TER 79129 WAT 7362 ATOM 79129 O WAT 7363 109.184 8.509 10.507 1.00 0.00 O ATOM 79130 H1 WAT 7363 109.318 9.256 9.923 1.00 0.00 H ATOM 79131 H2 WAT 7363 109.210 8.885 11.387 1.00 0.00 H TER 79133 WAT 7363 ATOM 79133 O WAT 7364 23.990 40.013 5.899 1.00 0.00 O ATOM 79134 H1 WAT 7364 23.695 39.892 6.801 1.00 0.00 H ATOM 79135 H2 WAT 7364 24.337 40.905 5.878 1.00 0.00 H TER 79137 WAT 7364 ATOM 79137 O WAT 7365 2.909 87.979 100.313 1.00 0.00 O ATOM 79138 H1 WAT 7365 2.440 87.662 101.085 1.00 0.00 H ATOM 79139 H2 WAT 7365 2.564 88.860 100.169 1.00 0.00 H TER 79141 WAT 7365 ATOM 79141 O WAT 7366 35.829 59.990 134.601 1.00 0.00 O ATOM 79142 H1 WAT 7366 35.009 60.114 134.124 1.00 0.00 H ATOM 79143 H2 WAT 7366 36.504 59.993 133.922 1.00 0.00 H TER 79145 WAT 7366 ATOM 79145 O WAT 7367 78.458 33.688 106.240 1.00 0.00 O ATOM 79146 H1 WAT 7367 78.954 34.305 105.701 1.00 0.00 H ATOM 79147 H2 WAT 7367 78.954 32.871 106.186 1.00 0.00 H TER 79149 WAT 7367 ATOM 79149 O WAT 7368 115.272 31.984 23.306 1.00 0.00 O ATOM 79150 H1 WAT 7368 115.519 32.823 23.694 1.00 0.00 H ATOM 79151 H2 WAT 7368 114.561 31.663 23.861 1.00 0.00 H TER 79153 WAT 7368 ATOM 79153 O WAT 7369 68.512 54.355 99.382 1.00 0.00 O ATOM 79154 H1 WAT 7369 67.650 54.693 99.623 1.00 0.00 H ATOM 79155 H2 WAT 7369 68.399 54.022 98.492 1.00 0.00 H TER 79157 WAT 7369 ATOM 79157 O WAT 7370 72.612 127.079 104.313 1.00 0.00 O ATOM 79158 H1 WAT 7370 71.973 127.319 103.642 1.00 0.00 H ATOM 79159 H2 WAT 7370 72.350 127.581 105.084 1.00 0.00 H TER 79161 WAT 7370 ATOM 79161 O WAT 7371 116.248 107.334 22.695 1.00 0.00 O ATOM 79162 H1 WAT 7371 116.729 107.665 23.453 1.00 0.00 H ATOM 79163 H2 WAT 7371 115.590 108.005 22.515 1.00 0.00 H TER 79165 WAT 7371 ATOM 79165 O WAT 7372 48.429 100.732 97.888 1.00 0.00 O ATOM 79166 H1 WAT 7372 47.658 100.394 98.344 1.00 0.00 H ATOM 79167 H2 WAT 7372 48.809 99.965 97.460 1.00 0.00 H TER 79169 WAT 7372 ATOM 79169 O WAT 7373 71.675 5.362 74.893 1.00 0.00 O ATOM 79170 H1 WAT 7373 72.181 4.892 75.557 1.00 0.00 H ATOM 79171 H2 WAT 7373 71.455 6.196 75.306 1.00 0.00 H TER 79173 WAT 7373 ATOM 79173 O WAT 7374 132.504 97.677 94.337 1.00 0.00 O ATOM 79174 H1 WAT 7374 133.191 97.544 94.990 1.00 0.00 H ATOM 79175 H2 WAT 7374 132.033 96.844 94.313 1.00 0.00 H TER 79177 WAT 7374 ATOM 79177 O WAT 7375 57.845 38.593 158.649 1.00 0.00 O ATOM 79178 H1 WAT 7375 57.741 39.544 158.625 1.00 0.00 H ATOM 79179 H2 WAT 7375 56.971 38.251 158.463 1.00 0.00 H TER 79181 WAT 7375 ATOM 79181 O WAT 7376 12.516 18.925 22.768 1.00 0.00 O ATOM 79182 H1 WAT 7376 13.201 19.571 22.940 1.00 0.00 H ATOM 79183 H2 WAT 7376 12.765 18.528 21.934 1.00 0.00 H TER 79185 WAT 7376 ATOM 79185 O WAT 7377 122.314 141.708 145.684 1.00 0.00 O ATOM 79186 H1 WAT 7377 121.389 141.676 145.438 1.00 0.00 H ATOM 79187 H2 WAT 7377 122.421 142.561 146.103 1.00 0.00 H TER 79189 WAT 7377 ATOM 79189 O WAT 7378 114.311 10.061 106.502 1.00 0.00 O ATOM 79190 H1 WAT 7378 113.590 9.480 106.261 1.00 0.00 H ATOM 79191 H2 WAT 7378 114.839 10.130 105.706 1.00 0.00 H TER 79193 WAT 7378 ATOM 79193 O WAT 7379 99.231 16.016 77.965 1.00 0.00 O ATOM 79194 H1 WAT 7379 100.006 16.535 77.753 1.00 0.00 H ATOM 79195 H2 WAT 7379 98.651 16.133 77.212 1.00 0.00 H TER 79197 WAT 7379 ATOM 79197 O WAT 7380 80.378 78.250 7.780 1.00 0.00 O ATOM 79198 H1 WAT 7380 80.575 78.987 8.358 1.00 0.00 H ATOM 79199 H2 WAT 7380 79.459 78.046 7.957 1.00 0.00 H TER 79201 WAT 7380 ATOM 79201 O WAT 7381 5.496 122.909 70.514 1.00 0.00 O ATOM 79202 H1 WAT 7381 5.826 122.811 69.621 1.00 0.00 H ATOM 79203 H2 WAT 7381 5.838 122.147 70.981 1.00 0.00 H TER 79205 WAT 7381 ATOM 79205 O WAT 7382 87.408 145.526 107.927 1.00 0.00 O ATOM 79206 H1 WAT 7382 87.476 144.862 107.241 1.00 0.00 H ATOM 79207 H2 WAT 7382 86.531 145.894 107.819 1.00 0.00 H TER 79209 WAT 7382 ATOM 79209 O WAT 7383 87.902 42.996 129.927 1.00 0.00 O ATOM 79210 H1 WAT 7383 88.149 42.373 130.611 1.00 0.00 H ATOM 79211 H2 WAT 7383 87.203 42.555 129.443 1.00 0.00 H TER 79213 WAT 7383 ATOM 79213 O WAT 7384 13.420 138.110 58.940 1.00 0.00 O ATOM 79214 H1 WAT 7384 12.612 138.622 58.972 1.00 0.00 H ATOM 79215 H2 WAT 7384 13.281 137.488 58.225 1.00 0.00 H TER 79217 WAT 7384 ATOM 79217 O WAT 7385 35.968 23.332 128.198 1.00 0.00 O ATOM 79218 H1 WAT 7385 36.256 23.645 127.340 1.00 0.00 H ATOM 79219 H2 WAT 7385 35.012 23.366 128.156 1.00 0.00 H TER 79221 WAT 7385 ATOM 79221 O WAT 7386 45.158 80.090 86.033 1.00 0.00 O ATOM 79222 H1 WAT 7386 44.506 80.684 86.405 1.00 0.00 H ATOM 79223 H2 WAT 7386 45.724 80.655 85.507 1.00 0.00 H TER 79225 WAT 7386 ATOM 79225 O WAT 7387 103.290 52.335 110.424 1.00 0.00 O ATOM 79226 H1 WAT 7387 104.079 52.292 109.883 1.00 0.00 H ATOM 79227 H2 WAT 7387 102.570 52.360 109.795 1.00 0.00 H TER 79229 WAT 7387 ATOM 79229 O WAT 7388 61.979 143.477 66.703 1.00 0.00 O ATOM 79230 H1 WAT 7388 61.292 143.941 66.225 1.00 0.00 H ATOM 79231 H2 WAT 7388 62.056 142.634 66.255 1.00 0.00 H TER 79233 WAT 7388 ATOM 79233 O WAT 7389 10.719 10.986 137.812 1.00 0.00 O ATOM 79234 H1 WAT 7389 11.242 11.092 137.017 1.00 0.00 H ATOM 79235 H2 WAT 7389 9.863 11.349 137.585 1.00 0.00 H TER 79237 WAT 7389 ATOM 79237 O WAT 7390 57.201 129.041 74.682 1.00 0.00 O ATOM 79238 H1 WAT 7390 57.891 129.540 74.246 1.00 0.00 H ATOM 79239 H2 WAT 7390 57.117 129.451 75.544 1.00 0.00 H TER 79241 WAT 7390 ATOM 79241 O WAT 7391 139.560 73.959 91.698 1.00 0.00 O ATOM 79242 H1 WAT 7391 140.465 74.035 92.002 1.00 0.00 H ATOM 79243 H2 WAT 7391 139.314 74.852 91.453 1.00 0.00 H TER 79245 WAT 7391 ATOM 79245 O WAT 7392 16.216 112.597 2.139 1.00 0.00 O ATOM 79246 H1 WAT 7392 15.446 113.148 2.000 1.00 0.00 H ATOM 79247 H2 WAT 7392 16.390 112.660 3.078 1.00 0.00 H TER 79249 WAT 7392 ATOM 79249 O WAT 7393 118.543 65.034 110.197 1.00 0.00 O ATOM 79250 H1 WAT 7393 118.868 65.339 109.350 1.00 0.00 H ATOM 79251 H2 WAT 7393 117.593 64.993 110.089 1.00 0.00 H TER 79253 WAT 7393 ATOM 79253 O WAT 7394 50.965 63.317 13.325 1.00 0.00 O ATOM 79254 H1 WAT 7394 51.469 63.008 14.077 1.00 0.00 H ATOM 79255 H2 WAT 7394 51.597 63.343 12.607 1.00 0.00 H TER 79257 WAT 7394 ATOM 79257 O WAT 7395 100.178 137.998 118.356 1.00 0.00 O ATOM 79258 H1 WAT 7395 99.224 137.944 118.410 1.00 0.00 H ATOM 79259 H2 WAT 7395 100.490 137.460 119.083 1.00 0.00 H TER 79261 WAT 7395 ATOM 79261 O WAT 7396 8.285 105.855 16.600 1.00 0.00 O ATOM 79262 H1 WAT 7396 8.142 105.176 15.942 1.00 0.00 H ATOM 79263 H2 WAT 7396 8.445 105.373 17.411 1.00 0.00 H TER 79265 WAT 7396 ATOM 79265 O WAT 7397 27.321 123.951 15.913 1.00 0.00 O ATOM 79266 H1 WAT 7397 27.033 124.217 15.040 1.00 0.00 H ATOM 79267 H2 WAT 7397 27.909 123.212 15.755 1.00 0.00 H TER 79269 WAT 7397 ATOM 79269 O WAT 7398 78.556 67.599 126.516 1.00 0.00 O ATOM 79270 H1 WAT 7398 79.457 67.280 126.462 1.00 0.00 H ATOM 79271 H2 WAT 7398 78.380 67.663 127.455 1.00 0.00 H TER 79273 WAT 7398 ATOM 79273 O WAT 7399 106.826 127.234 99.843 1.00 0.00 O ATOM 79274 H1 WAT 7399 107.303 127.125 99.021 1.00 0.00 H ATOM 79275 H2 WAT 7399 106.340 128.051 99.731 1.00 0.00 H TER 79277 WAT 7399 ATOM 79277 O WAT 7400 86.610 79.671 28.817 1.00 0.00 O ATOM 79278 H1 WAT 7400 85.837 79.557 29.370 1.00 0.00 H ATOM 79279 H2 WAT 7400 86.380 80.393 28.232 1.00 0.00 H TER 79281 WAT 7400 ATOM 79281 O WAT 7401 134.516 121.667 73.667 1.00 0.00 O ATOM 79282 H1 WAT 7401 134.045 122.472 73.453 1.00 0.00 H ATOM 79283 H2 WAT 7401 134.313 121.071 72.946 1.00 0.00 H TER 79285 WAT 7401 ATOM 79285 O WAT 7402 65.527 50.821 71.906 1.00 0.00 O ATOM 79286 H1 WAT 7402 65.235 49.918 72.033 1.00 0.00 H ATOM 79287 H2 WAT 7402 65.695 50.888 70.966 1.00 0.00 H TER 79289 WAT 7402 ATOM 79289 O WAT 7403 128.117 32.305 90.295 1.00 0.00 O ATOM 79290 H1 WAT 7403 128.983 32.102 89.942 1.00 0.00 H ATOM 79291 H2 WAT 7403 127.536 32.282 89.534 1.00 0.00 H TER 79293 WAT 7403 ATOM 79293 O WAT 7404 79.881 103.743 150.780 1.00 0.00 O ATOM 79294 H1 WAT 7404 79.961 104.569 150.302 1.00 0.00 H ATOM 79295 H2 WAT 7404 80.362 103.110 150.246 1.00 0.00 H TER 79297 WAT 7404 ATOM 79297 O WAT 7405 20.720 90.779 121.085 1.00 0.00 O ATOM 79298 H1 WAT 7405 21.094 91.570 121.475 1.00 0.00 H ATOM 79299 H2 WAT 7405 21.316 90.561 120.368 1.00 0.00 H TER 79301 WAT 7405 ATOM 79301 O WAT 7406 20.480 66.501 102.910 1.00 0.00 O ATOM 79302 H1 WAT 7406 21.020 65.948 103.475 1.00 0.00 H ATOM 79303 H2 WAT 7406 21.005 66.622 102.119 1.00 0.00 H TER 79305 WAT 7406 ATOM 79305 O WAT 7407 114.699 110.389 106.968 1.00 0.00 O ATOM 79306 H1 WAT 7407 113.848 110.047 107.240 1.00 0.00 H ATOM 79307 H2 WAT 7407 115.289 110.162 107.688 1.00 0.00 H TER 79309 WAT 7407 ATOM 79309 O WAT 7408 67.537 5.801 136.895 1.00 0.00 O ATOM 79310 H1 WAT 7408 66.809 5.621 137.490 1.00 0.00 H ATOM 79311 H2 WAT 7408 67.273 6.593 136.427 1.00 0.00 H TER 79313 WAT 7408 ATOM 79313 O WAT 7409 142.724 93.500 99.939 1.00 0.00 O ATOM 79314 H1 WAT 7409 143.512 94.034 99.842 1.00 0.00 H ATOM 79315 H2 WAT 7409 142.384 93.729 100.804 1.00 0.00 H TER 79317 WAT 7409 ATOM 79317 O WAT 7410 40.424 53.575 13.612 1.00 0.00 O ATOM 79318 H1 WAT 7410 41.071 53.874 12.972 1.00 0.00 H ATOM 79319 H2 WAT 7410 39.856 54.332 13.750 1.00 0.00 H TER 79321 WAT 7410 ATOM 79321 O WAT 7411 94.698 135.735 69.986 1.00 0.00 O ATOM 79322 H1 WAT 7411 95.322 135.124 69.594 1.00 0.00 H ATOM 79323 H2 WAT 7411 94.384 136.262 69.252 1.00 0.00 H TER 79325 WAT 7411 ATOM 79325 O WAT 7412 26.926 82.295 102.163 1.00 0.00 O ATOM 79326 H1 WAT 7412 26.242 82.727 102.675 1.00 0.00 H ATOM 79327 H2 WAT 7412 27.745 82.652 102.508 1.00 0.00 H TER 79329 WAT 7412 ATOM 79329 O WAT 7413 1.493 142.818 63.919 1.00 0.00 O ATOM 79330 H1 WAT 7413 2.231 143.411 63.775 1.00 0.00 H ATOM 79331 H2 WAT 7413 1.023 142.814 63.086 1.00 0.00 H TER 79333 WAT 7413 ATOM 79333 O WAT 7414 45.130 1.557 3.876 1.00 0.00 O ATOM 79334 H1 WAT 7414 44.834 2.230 3.263 1.00 0.00 H ATOM 79335 H2 WAT 7414 44.500 1.595 4.595 1.00 0.00 H TER 79337 WAT 7414 ATOM 79337 O WAT 7415 30.758 94.326 135.101 1.00 0.00 O ATOM 79338 H1 WAT 7415 30.776 94.236 134.148 1.00 0.00 H ATOM 79339 H2 WAT 7415 29.854 94.126 135.344 1.00 0.00 H TER 79341 WAT 7415 ATOM 79341 O WAT 7416 54.839 39.991 88.071 1.00 0.00 O ATOM 79342 H1 WAT 7416 55.761 40.152 88.269 1.00 0.00 H ATOM 79343 H2 WAT 7416 54.850 39.254 87.460 1.00 0.00 H TER 79345 WAT 7416 ATOM 79345 O WAT 7417 71.686 139.030 158.223 1.00 0.00 O ATOM 79346 H1 WAT 7417 70.905 139.414 158.621 1.00 0.00 H ATOM 79347 H2 WAT 7417 72.185 139.781 157.901 1.00 0.00 H TER 79349 WAT 7417 ATOM 79349 O WAT 7418 15.277 17.621 102.019 1.00 0.00 O ATOM 79350 H1 WAT 7418 15.209 18.048 102.873 1.00 0.00 H ATOM 79351 H2 WAT 7418 14.424 17.208 101.889 1.00 0.00 H TER 79353 WAT 7418 ATOM 79353 O WAT 7419 21.924 45.274 83.818 1.00 0.00 O ATOM 79354 H1 WAT 7419 21.222 44.624 83.795 1.00 0.00 H ATOM 79355 H2 WAT 7419 22.440 45.097 83.031 1.00 0.00 H TER 79357 WAT 7419 ATOM 79357 O WAT 7420 91.139 9.332 75.901 1.00 0.00 O ATOM 79358 H1 WAT 7420 90.714 9.931 76.516 1.00 0.00 H ATOM 79359 H2 WAT 7420 92.075 9.452 76.059 1.00 0.00 H TER 79361 WAT 7420 ATOM 79361 O WAT 7421 81.412 130.993 105.942 1.00 0.00 O ATOM 79362 H1 WAT 7421 81.109 130.086 105.917 1.00 0.00 H ATOM 79363 H2 WAT 7421 80.635 131.511 105.730 1.00 0.00 H TER 79365 WAT 7421 ATOM 79365 O WAT 7422 23.316 24.163 133.870 1.00 0.00 O ATOM 79366 H1 WAT 7422 24.060 24.239 133.273 1.00 0.00 H ATOM 79367 H2 WAT 7422 22.593 23.867 133.316 1.00 0.00 H TER 79369 WAT 7422 ATOM 79369 O WAT 7423 136.234 50.868 158.161 1.00 0.00 O ATOM 79370 H1 WAT 7423 136.339 50.227 158.864 1.00 0.00 H ATOM 79371 H2 WAT 7423 137.029 50.780 157.636 1.00 0.00 H TER 79373 WAT 7423 ATOM 79373 O WAT 7424 126.259 0.683 115.586 1.00 0.00 O ATOM 79374 H1 WAT 7424 126.352 0.526 116.525 1.00 0.00 H ATOM 79375 H2 WAT 7424 125.589 0.059 115.304 1.00 0.00 H TER 79377 WAT 7424 ATOM 79377 O WAT 7425 24.976 96.084 117.592 1.00 0.00 O ATOM 79378 H1 WAT 7425 24.779 95.147 117.608 1.00 0.00 H ATOM 79379 H2 WAT 7425 25.319 96.242 116.713 1.00 0.00 H TER 79381 WAT 7425 ATOM 79381 O WAT 7426 30.554 113.546 62.453 1.00 0.00 O ATOM 79382 H1 WAT 7426 30.586 113.000 61.667 1.00 0.00 H ATOM 79383 H2 WAT 7426 31.450 113.865 62.559 1.00 0.00 H TER 79385 WAT 7426 ATOM 79385 O WAT 7427 133.510 112.531 25.069 1.00 0.00 O ATOM 79386 H1 WAT 7427 133.561 111.695 25.533 1.00 0.00 H ATOM 79387 H2 WAT 7427 133.651 113.191 25.748 1.00 0.00 H TER 79389 WAT 7427 ATOM 79389 O WAT 7428 67.113 123.348 145.222 1.00 0.00 O ATOM 79390 H1 WAT 7428 66.694 124.027 145.750 1.00 0.00 H ATOM 79391 H2 WAT 7428 66.474 122.636 145.196 1.00 0.00 H TER 79393 WAT 7428 ATOM 79393 O WAT 7429 146.128 77.751 65.997 1.00 0.00 O ATOM 79394 H1 WAT 7429 145.578 77.003 65.764 1.00 0.00 H ATOM 79395 H2 WAT 7429 145.509 78.466 66.145 1.00 0.00 H TER 79397 WAT 7429 ATOM 79397 O WAT 7430 82.104 122.628 113.741 1.00 0.00 O ATOM 79398 H1 WAT 7430 82.161 121.994 113.026 1.00 0.00 H ATOM 79399 H2 WAT 7430 81.353 123.177 113.516 1.00 0.00 H TER 79401 WAT 7430 ATOM 79401 O WAT 7431 58.371 120.923 124.887 1.00 0.00 O ATOM 79402 H1 WAT 7431 58.269 121.796 124.509 1.00 0.00 H ATOM 79403 H2 WAT 7431 58.898 120.444 124.247 1.00 0.00 H TER 79405 WAT 7431 ATOM 79405 O WAT 7432 51.813 119.548 125.410 1.00 0.00 O ATOM 79406 H1 WAT 7432 52.658 119.125 125.260 1.00 0.00 H ATOM 79407 H2 WAT 7432 52.034 120.387 125.815 1.00 0.00 H TER 79409 WAT 7432 ATOM 79409 O WAT 7433 91.785 121.385 8.740 1.00 0.00 O ATOM 79410 H1 WAT 7433 92.528 121.924 8.467 1.00 0.00 H ATOM 79411 H2 WAT 7433 91.096 122.015 8.950 1.00 0.00 H TER 79413 WAT 7433 ATOM 79413 O WAT 7434 14.358 9.616 19.715 1.00 0.00 O ATOM 79414 H1 WAT 7434 13.845 9.990 20.430 1.00 0.00 H ATOM 79415 H2 WAT 7434 13.741 9.549 18.986 1.00 0.00 H TER 79417 WAT 7434 ATOM 79417 O WAT 7435 70.478 84.718 71.156 1.00 0.00 O ATOM 79418 H1 WAT 7435 70.442 84.023 70.500 1.00 0.00 H ATOM 79419 H2 WAT 7435 71.272 84.534 71.657 1.00 0.00 H TER 79421 WAT 7435 ATOM 79421 O WAT 7436 58.083 84.691 4.577 1.00 0.00 O ATOM 79422 H1 WAT 7436 57.403 84.077 4.856 1.00 0.00 H ATOM 79423 H2 WAT 7436 58.198 85.277 5.324 1.00 0.00 H TER 79425 WAT 7436 ATOM 79425 O WAT 7437 51.478 140.078 77.601 1.00 0.00 O ATOM 79426 H1 WAT 7437 52.419 140.251 77.638 1.00 0.00 H ATOM 79427 H2 WAT 7437 51.208 140.403 76.742 1.00 0.00 H TER 79429 WAT 7437 ATOM 79429 O WAT 7438 84.294 143.890 133.195 1.00 0.00 O ATOM 79430 H1 WAT 7438 83.904 144.077 132.341 1.00 0.00 H ATOM 79431 H2 WAT 7438 83.556 143.910 133.804 1.00 0.00 H TER 79433 WAT 7438 ATOM 79433 O WAT 7439 84.130 72.520 27.506 1.00 0.00 O ATOM 79434 H1 WAT 7439 84.689 72.307 26.759 1.00 0.00 H ATOM 79435 H2 WAT 7439 83.857 71.669 27.850 1.00 0.00 H TER 79437 WAT 7439 ATOM 79437 O WAT 7440 73.635 12.200 137.617 1.00 0.00 O ATOM 79438 H1 WAT 7440 73.101 11.869 138.339 1.00 0.00 H ATOM 79439 H2 WAT 7440 74.510 11.850 137.786 1.00 0.00 H TER 79441 WAT 7440 ATOM 79441 O WAT 7441 141.324 2.638 111.282 1.00 0.00 O ATOM 79442 H1 WAT 7441 140.802 2.132 110.659 1.00 0.00 H ATOM 79443 H2 WAT 7441 141.077 2.290 112.139 1.00 0.00 H TER 79445 WAT 7441 ATOM 79445 O WAT 7442 92.476 9.152 143.844 1.00 0.00 O ATOM 79446 H1 WAT 7442 92.388 8.202 143.759 1.00 0.00 H ATOM 79447 H2 WAT 7442 93.335 9.277 144.247 1.00 0.00 H TER 79449 WAT 7442 ATOM 79449 O WAT 7443 24.350 141.470 23.524 1.00 0.00 O ATOM 79450 H1 WAT 7443 24.585 141.825 24.381 1.00 0.00 H ATOM 79451 H2 WAT 7443 23.468 141.118 23.643 1.00 0.00 H TER 79453 WAT 7443 ATOM 79453 O WAT 7444 3.981 73.751 109.274 1.00 0.00 O ATOM 79454 H1 WAT 7444 4.252 74.041 110.145 1.00 0.00 H ATOM 79455 H2 WAT 7444 3.103 73.391 109.404 1.00 0.00 H TER 79457 WAT 7444 ATOM 79457 O WAT 7445 96.790 20.222 75.380 1.00 0.00 O ATOM 79458 H1 WAT 7445 96.708 19.923 74.475 1.00 0.00 H ATOM 79459 H2 WAT 7445 97.548 19.748 75.722 1.00 0.00 H TER 79461 WAT 7445 ATOM 79461 O WAT 7446 3.231 57.329 80.678 1.00 0.00 O ATOM 79462 H1 WAT 7446 3.297 57.681 79.791 1.00 0.00 H ATOM 79463 H2 WAT 7446 3.208 58.102 81.242 1.00 0.00 H TER 79465 WAT 7446 ATOM 79465 O WAT 7447 34.419 109.774 155.710 1.00 0.00 O ATOM 79466 H1 WAT 7447 34.068 110.596 156.051 1.00 0.00 H ATOM 79467 H2 WAT 7447 35.269 109.679 156.140 1.00 0.00 H TER 79469 WAT 7447 ATOM 79469 O WAT 7448 134.201 7.261 145.162 1.00 0.00 O ATOM 79470 H1 WAT 7448 133.783 6.859 144.400 1.00 0.00 H ATOM 79471 H2 WAT 7448 134.851 7.858 144.791 1.00 0.00 H TER 79473 WAT 7448 ATOM 79473 O WAT 7449 145.194 79.639 122.646 1.00 0.00 O ATOM 79474 H1 WAT 7449 145.824 79.467 123.346 1.00 0.00 H ATOM 79475 H2 WAT 7449 145.405 80.523 122.346 1.00 0.00 H TER 79477 WAT 7449 ATOM 79477 O WAT 7450 42.250 13.498 67.958 1.00 0.00 O ATOM 79478 H1 WAT 7450 42.589 12.693 67.567 1.00 0.00 H ATOM 79479 H2 WAT 7450 41.303 13.365 67.997 1.00 0.00 H TER 79481 WAT 7450 ATOM 79481 O WAT 7451 119.161 134.491 1.124 1.00 0.00 O ATOM 79482 H1 WAT 7451 120.031 134.731 0.807 1.00 0.00 H ATOM 79483 H2 WAT 7451 118.573 134.715 0.402 1.00 0.00 H TER 79485 WAT 7451 ATOM 79485 O WAT 7452 26.701 60.157 152.168 1.00 0.00 O ATOM 79486 H1 WAT 7452 27.628 60.332 152.005 1.00 0.00 H ATOM 79487 H2 WAT 7452 26.404 59.692 151.386 1.00 0.00 H TER 79489 WAT 7452 ATOM 79489 O WAT 7453 141.434 118.644 130.474 1.00 0.00 O ATOM 79490 H1 WAT 7453 142.327 118.330 130.617 1.00 0.00 H ATOM 79491 H2 WAT 7453 140.883 118.028 130.956 1.00 0.00 H TER 79493 WAT 7453 ATOM 79493 O WAT 7454 99.298 39.062 94.073 1.00 0.00 O ATOM 79494 H1 WAT 7454 99.373 38.125 94.255 1.00 0.00 H ATOM 79495 H2 WAT 7454 99.845 39.480 94.738 1.00 0.00 H TER 79497 WAT 7454 ATOM 79497 O WAT 7455 65.306 123.617 86.372 1.00 0.00 O ATOM 79498 H1 WAT 7455 65.129 124.528 86.137 1.00 0.00 H ATOM 79499 H2 WAT 7455 65.234 123.598 87.327 1.00 0.00 H TER 79501 WAT 7455 ATOM 79501 O WAT 7456 125.744 9.490 3.877 1.00 0.00 O ATOM 79502 H1 WAT 7456 126.206 9.938 3.168 1.00 0.00 H ATOM 79503 H2 WAT 7456 126.416 9.336 4.541 1.00 0.00 H TER 79505 WAT 7456 ATOM 79505 O WAT 7457 25.510 1.266 130.775 1.00 0.00 O ATOM 79506 H1 WAT 7457 25.569 1.490 129.846 1.00 0.00 H ATOM 79507 H2 WAT 7457 26.302 1.638 131.163 1.00 0.00 H TER 79509 WAT 7457 ATOM 79509 O WAT 7458 72.233 23.121 128.022 1.00 0.00 O ATOM 79510 H1 WAT 7458 71.417 23.371 128.456 1.00 0.00 H ATOM 79511 H2 WAT 7458 72.333 22.189 128.219 1.00 0.00 H TER 79513 WAT 7458 ATOM 79513 O WAT 7459 24.277 135.563 93.556 1.00 0.00 O ATOM 79514 H1 WAT 7459 24.053 134.661 93.786 1.00 0.00 H ATOM 79515 H2 WAT 7459 23.595 136.092 93.969 1.00 0.00 H TER 79517 WAT 7459 ATOM 79517 O WAT 7460 33.232 134.926 126.802 1.00 0.00 O ATOM 79518 H1 WAT 7460 32.597 134.874 127.517 1.00 0.00 H ATOM 79519 H2 WAT 7460 33.437 135.859 126.730 1.00 0.00 H TER 79521 WAT 7460 ATOM 79521 O WAT 7461 15.190 118.128 140.454 1.00 0.00 O ATOM 79522 H1 WAT 7461 14.926 119.040 140.570 1.00 0.00 H ATOM 79523 H2 WAT 7461 16.144 118.142 140.535 1.00 0.00 H TER 79525 WAT 7461 ATOM 79525 O WAT 7462 20.374 19.076 65.379 1.00 0.00 O ATOM 79526 H1 WAT 7462 20.624 19.962 65.116 1.00 0.00 H ATOM 79527 H2 WAT 7462 19.563 18.904 64.900 1.00 0.00 H TER 79529 WAT 7462 ATOM 79529 O WAT 7463 89.619 14.236 126.135 1.00 0.00 O ATOM 79530 H1 WAT 7463 89.749 13.412 126.605 1.00 0.00 H ATOM 79531 H2 WAT 7463 90.469 14.674 126.182 1.00 0.00 H TER 79533 WAT 7463 ATOM 79533 O WAT 7464 66.335 81.876 138.733 1.00 0.00 O ATOM 79534 H1 WAT 7464 66.670 82.017 137.847 1.00 0.00 H ATOM 79535 H2 WAT 7464 67.045 81.423 139.188 1.00 0.00 H TER 79537 WAT 7464 ATOM 79537 O WAT 7465 145.105 53.298 121.058 1.00 0.00 O ATOM 79538 H1 WAT 7465 144.827 52.404 121.261 1.00 0.00 H ATOM 79539 H2 WAT 7465 145.535 53.228 120.206 1.00 0.00 H TER 79541 WAT 7465 ATOM 79541 O WAT 7466 101.469 9.461 143.997 1.00 0.00 O ATOM 79542 H1 WAT 7466 102.027 10.231 144.107 1.00 0.00 H ATOM 79543 H2 WAT 7466 100.627 9.815 143.712 1.00 0.00 H TER 79545 WAT 7466 ATOM 79545 O WAT 7467 37.429 115.059 82.690 1.00 0.00 O ATOM 79546 H1 WAT 7467 37.549 114.284 82.141 1.00 0.00 H ATOM 79547 H2 WAT 7467 36.494 115.066 82.892 1.00 0.00 H TER 79549 WAT 7467 ATOM 79549 O WAT 7468 76.585 6.813 109.607 1.00 0.00 O ATOM 79550 H1 WAT 7468 77.187 7.044 108.900 1.00 0.00 H ATOM 79551 H2 WAT 7468 75.792 7.315 109.420 1.00 0.00 H TER 79553 WAT 7468 ATOM 79553 O WAT 7469 34.366 65.900 9.903 1.00 0.00 O ATOM 79554 H1 WAT 7469 34.587 64.969 9.865 1.00 0.00 H ATOM 79555 H2 WAT 7469 34.841 66.229 10.666 1.00 0.00 H TER 79557 WAT 7469 ATOM 79557 O WAT 7470 92.925 63.584 10.842 1.00 0.00 O ATOM 79558 H1 WAT 7470 93.022 63.164 11.696 1.00 0.00 H ATOM 79559 H2 WAT 7470 92.012 63.428 10.600 1.00 0.00 H TER 79561 WAT 7470 ATOM 79561 O WAT 7471 114.935 143.272 0.322 1.00 0.00 O ATOM 79562 H1 WAT 7471 114.786 144.132 -0.071 1.00 0.00 H ATOM 79563 H2 WAT 7471 115.154 143.461 1.235 1.00 0.00 H TER 79565 WAT 7471 ATOM 79565 O WAT 7472 14.044 22.647 107.403 1.00 0.00 O ATOM 79566 H1 WAT 7472 14.825 23.080 107.748 1.00 0.00 H ATOM 79567 H2 WAT 7472 14.377 22.049 106.734 1.00 0.00 H TER 79569 WAT 7472 ATOM 79569 O WAT 7473 98.415 11.708 111.128 1.00 0.00 O ATOM 79570 H1 WAT 7473 99.229 11.361 110.762 1.00 0.00 H ATOM 79571 H2 WAT 7473 98.696 12.392 111.735 1.00 0.00 H TER 79573 WAT 7473 ATOM 79573 O WAT 7474 82.013 107.538 60.207 1.00 0.00 O ATOM 79574 H1 WAT 7474 82.147 107.833 59.306 1.00 0.00 H ATOM 79575 H2 WAT 7474 82.464 108.190 60.742 1.00 0.00 H TER 79577 WAT 7474 ATOM 79577 O WAT 7475 59.488 10.800 110.083 1.00 0.00 O ATOM 79578 H1 WAT 7475 58.979 11.389 110.640 1.00 0.00 H ATOM 79579 H2 WAT 7475 58.972 9.994 110.054 1.00 0.00 H TER 79581 WAT 7475 ATOM 79581 O WAT 7476 20.929 143.224 133.964 1.00 0.00 O ATOM 79582 H1 WAT 7476 20.488 143.901 133.450 1.00 0.00 H ATOM 79583 H2 WAT 7476 20.334 143.052 134.694 1.00 0.00 H TER 79585 WAT 7476 ATOM 79585 O WAT 7477 142.603 107.331 85.986 1.00 0.00 O ATOM 79586 H1 WAT 7477 143.215 107.822 85.439 1.00 0.00 H ATOM 79587 H2 WAT 7477 141.935 107.971 86.233 1.00 0.00 H TER 79589 WAT 7477 ATOM 79589 O WAT 7478 48.287 112.699 142.235 1.00 0.00 O ATOM 79590 H1 WAT 7478 49.185 112.581 142.545 1.00 0.00 H ATOM 79591 H2 WAT 7478 48.343 113.421 141.609 1.00 0.00 H TER 79593 WAT 7478 ATOM 79593 O WAT 7479 127.794 59.436 137.030 1.00 0.00 O ATOM 79594 H1 WAT 7479 128.546 59.111 136.536 1.00 0.00 H ATOM 79595 H2 WAT 7479 127.999 59.228 137.942 1.00 0.00 H TER 79597 WAT 7479 ATOM 79597 O WAT 7480 17.066 145.143 79.656 1.00 0.00 O ATOM 79598 H1 WAT 7480 16.355 145.482 79.113 1.00 0.00 H ATOM 79599 H2 WAT 7480 17.796 145.027 79.048 1.00 0.00 H TER 79601 WAT 7480 ATOM 79601 O WAT 7481 75.196 100.775 144.623 1.00 0.00 O ATOM 79602 H1 WAT 7481 75.133 101.243 143.790 1.00 0.00 H ATOM 79603 H2 WAT 7481 74.300 100.498 144.811 1.00 0.00 H TER 79605 WAT 7481 ATOM 79605 O WAT 7482 34.840 111.982 147.231 1.00 0.00 O ATOM 79606 H1 WAT 7482 35.198 112.065 148.115 1.00 0.00 H ATOM 79607 H2 WAT 7482 35.516 112.353 146.663 1.00 0.00 H TER 79609 WAT 7482 ATOM 79609 O WAT 7483 17.839 126.612 79.215 1.00 0.00 O ATOM 79610 H1 WAT 7483 17.656 126.204 80.061 1.00 0.00 H ATOM 79611 H2 WAT 7483 17.001 126.593 78.753 1.00 0.00 H TER 79613 WAT 7483 ATOM 79613 O WAT 7484 88.926 7.587 121.066 1.00 0.00 O ATOM 79614 H1 WAT 7484 89.769 7.762 120.648 1.00 0.00 H ATOM 79615 H2 WAT 7484 88.276 7.874 120.425 1.00 0.00 H TER 79617 WAT 7484 ATOM 79617 O WAT 7485 124.583 27.173 100.106 1.00 0.00 O ATOM 79618 H1 WAT 7485 124.094 26.350 100.081 1.00 0.00 H ATOM 79619 H2 WAT 7485 124.803 27.349 99.191 1.00 0.00 H TER 79621 WAT 7485 ATOM 79621 O WAT 7486 38.964 62.757 71.677 1.00 0.00 O ATOM 79622 H1 WAT 7486 39.788 63.195 71.463 1.00 0.00 H ATOM 79623 H2 WAT 7486 38.363 63.470 71.890 1.00 0.00 H TER 79625 WAT 7486 ATOM 79625 O WAT 7487 80.238 30.441 130.343 1.00 0.00 O ATOM 79626 H1 WAT 7487 80.239 30.000 129.494 1.00 0.00 H ATOM 79627 H2 WAT 7487 80.360 31.367 130.132 1.00 0.00 H TER 79629 WAT 7487 ATOM 79629 O WAT 7488 7.861 34.615 14.228 1.00 0.00 O ATOM 79630 H1 WAT 7488 7.368 34.167 13.542 1.00 0.00 H ATOM 79631 H2 WAT 7488 8.188 33.911 14.788 1.00 0.00 H TER 79633 WAT 7488 ATOM 79633 O WAT 7489 86.151 101.508 81.689 1.00 0.00 O ATOM 79634 H1 WAT 7489 85.368 100.960 81.737 1.00 0.00 H ATOM 79635 H2 WAT 7489 86.717 101.064 81.057 1.00 0.00 H TER 79637 WAT 7489 ATOM 79637 O WAT 7490 115.624 19.088 84.487 1.00 0.00 O ATOM 79638 H1 WAT 7490 116.130 19.894 84.591 1.00 0.00 H ATOM 79639 H2 WAT 7490 116.154 18.546 83.902 1.00 0.00 H TER 79641 WAT 7490 ATOM 79641 O WAT 7491 134.832 141.664 124.788 1.00 0.00 O ATOM 79642 H1 WAT 7491 135.614 141.418 125.282 1.00 0.00 H ATOM 79643 H2 WAT 7491 134.811 142.620 124.835 1.00 0.00 H TER 79645 WAT 7491 ATOM 79645 O WAT 7492 1.303 130.281 21.613 1.00 0.00 O ATOM 79646 H1 WAT 7492 1.586 131.158 21.871 1.00 0.00 H ATOM 79647 H2 WAT 7492 0.976 129.887 22.422 1.00 0.00 H TER 79649 WAT 7492 ATOM 79649 O WAT 7493 100.620 124.734 103.972 1.00 0.00 O ATOM 79650 H1 WAT 7493 100.595 124.966 104.901 1.00 0.00 H ATOM 79651 H2 WAT 7493 99.779 125.035 103.628 1.00 0.00 H TER 79653 WAT 7493 ATOM 79653 O WAT 7494 106.177 124.954 23.959 1.00 0.00 O ATOM 79654 H1 WAT 7494 106.950 125.457 24.215 1.00 0.00 H ATOM 79655 H2 WAT 7494 106.302 124.783 23.025 1.00 0.00 H TER 79657 WAT 7494 ATOM 79657 O WAT 7495 95.735 20.502 92.682 1.00 0.00 O ATOM 79658 H1 WAT 7495 95.601 19.584 92.919 1.00 0.00 H ATOM 79659 H2 WAT 7495 96.686 20.610 92.673 1.00 0.00 H TER 79661 WAT 7495 ATOM 79661 O WAT 7496 139.708 104.034 77.174 1.00 0.00 O ATOM 79662 H1 WAT 7496 138.938 104.199 77.718 1.00 0.00 H ATOM 79663 H2 WAT 7496 139.507 103.218 76.715 1.00 0.00 H TER 79665 WAT 7496 ATOM 79665 O WAT 7497 29.163 54.066 101.844 1.00 0.00 O ATOM 79666 H1 WAT 7497 28.233 54.207 102.020 1.00 0.00 H ATOM 79667 H2 WAT 7497 29.195 53.795 100.927 1.00 0.00 H TER 79669 WAT 7497 ATOM 79669 O WAT 7498 62.393 67.007 95.022 1.00 0.00 O ATOM 79670 H1 WAT 7498 63.175 66.557 95.343 1.00 0.00 H ATOM 79671 H2 WAT 7498 61.694 66.722 95.611 1.00 0.00 H TER 79673 WAT 7498 ATOM 79673 O WAT 7499 42.161 47.577 85.661 1.00 0.00 O ATOM 79674 H1 WAT 7499 41.876 48.427 85.996 1.00 0.00 H ATOM 79675 H2 WAT 7499 41.693 47.477 84.832 1.00 0.00 H TER 79677 WAT 7499 ATOM 79677 O WAT 7500 95.947 64.220 125.964 1.00 0.00 O ATOM 79678 H1 WAT 7500 96.535 63.607 126.406 1.00 0.00 H ATOM 79679 H2 WAT 7500 96.521 64.739 125.402 1.00 0.00 H TER 79681 WAT 7500 ATOM 79681 O WAT 7501 113.841 112.636 87.909 1.00 0.00 O ATOM 79682 H1 WAT 7501 113.297 112.002 87.442 1.00 0.00 H ATOM 79683 H2 WAT 7501 114.491 112.913 87.264 1.00 0.00 H TER 79685 WAT 7501 ATOM 79685 O WAT 7502 61.350 113.929 74.076 1.00 0.00 O ATOM 79686 H1 WAT 7502 62.014 113.629 73.456 1.00 0.00 H ATOM 79687 H2 WAT 7502 61.758 113.820 74.935 1.00 0.00 H TER 79689 WAT 7502 ATOM 79689 O WAT 7503 93.913 101.699 10.426 1.00 0.00 O ATOM 79690 H1 WAT 7503 94.244 102.230 9.702 1.00 0.00 H ATOM 79691 H2 WAT 7503 94.514 100.956 10.472 1.00 0.00 H TER 79693 WAT 7503 ATOM 79693 O WAT 7504 20.929 44.705 111.534 1.00 0.00 O ATOM 79694 H1 WAT 7504 20.693 45.161 110.726 1.00 0.00 H ATOM 79695 H2 WAT 7504 21.796 44.339 111.358 1.00 0.00 H TER 79697 WAT 7504 ATOM 79697 O WAT 7505 18.618 57.080 102.280 1.00 0.00 O ATOM 79698 H1 WAT 7505 18.747 56.592 101.466 1.00 0.00 H ATOM 79699 H2 WAT 7505 19.495 57.149 102.659 1.00 0.00 H TER 79701 WAT 7505 ATOM 79701 O WAT 7506 17.669 53.036 150.114 1.00 0.00 O ATOM 79702 H1 WAT 7506 18.590 52.910 149.884 1.00 0.00 H ATOM 79703 H2 WAT 7506 17.236 53.217 149.280 1.00 0.00 H TER 79705 WAT 7506 ATOM 79705 O WAT 7507 61.360 118.661 94.290 1.00 0.00 O ATOM 79706 H1 WAT 7507 62.183 119.049 94.586 1.00 0.00 H ATOM 79707 H2 WAT 7507 61.095 119.199 93.545 1.00 0.00 H TER 79709 WAT 7507 ATOM 79709 O WAT 7508 69.037 131.961 127.012 1.00 0.00 O ATOM 79710 H1 WAT 7508 69.830 132.493 126.951 1.00 0.00 H ATOM 79711 H2 WAT 7508 69.068 131.393 126.242 1.00 0.00 H TER 79713 WAT 7508 ATOM 79713 O WAT 7509 74.886 108.208 155.916 1.00 0.00 O ATOM 79714 H1 WAT 7509 75.705 108.694 155.824 1.00 0.00 H ATOM 79715 H2 WAT 7509 74.636 108.332 156.832 1.00 0.00 H TER 79717 WAT 7509 ATOM 79717 O WAT 7510 144.135 30.309 73.274 1.00 0.00 O ATOM 79718 H1 WAT 7510 143.681 29.541 73.620 1.00 0.00 H ATOM 79719 H2 WAT 7510 144.657 30.630 74.009 1.00 0.00 H TER 79721 WAT 7510 ATOM 79721 O WAT 7511 13.187 82.370 157.553 1.00 0.00 O ATOM 79722 H1 WAT 7511 13.558 83.248 157.640 1.00 0.00 H ATOM 79723 H2 WAT 7511 12.274 82.468 157.824 1.00 0.00 H TER 79725 WAT 7511 ATOM 79725 O WAT 7512 33.549 63.472 133.717 1.00 0.00 O ATOM 79726 H1 WAT 7512 33.922 64.079 133.077 1.00 0.00 H ATOM 79727 H2 WAT 7512 33.999 63.680 134.536 1.00 0.00 H TER 79729 WAT 7512 ATOM 79729 O WAT 7513 87.769 49.110 66.436 1.00 0.00 O ATOM 79730 H1 WAT 7513 87.629 49.094 65.489 1.00 0.00 H ATOM 79731 H2 WAT 7513 86.912 49.331 66.800 1.00 0.00 H TER 79733 WAT 7513 ATOM 79733 O WAT 7514 12.770 21.118 147.634 1.00 0.00 O ATOM 79734 H1 WAT 7514 11.889 21.490 147.590 1.00 0.00 H ATOM 79735 H2 WAT 7514 13.291 21.666 147.047 1.00 0.00 H TER 79737 WAT 7514 ATOM 79737 O WAT 7515 29.359 136.186 56.571 1.00 0.00 O ATOM 79738 H1 WAT 7515 29.812 136.029 55.742 1.00 0.00 H ATOM 79739 H2 WAT 7515 28.490 135.805 56.445 1.00 0.00 H TER 79741 WAT 7515 ATOM 79741 O WAT 7516 133.431 71.438 86.056 1.00 0.00 O ATOM 79742 H1 WAT 7516 133.959 72.217 85.881 1.00 0.00 H ATOM 79743 H2 WAT 7516 134.043 70.708 85.963 1.00 0.00 H TER 79745 WAT 7516 ATOM 79745 O WAT 7517 117.128 133.475 63.750 1.00 0.00 O ATOM 79746 H1 WAT 7517 117.405 134.181 63.167 1.00 0.00 H ATOM 79747 H2 WAT 7517 117.489 132.682 63.355 1.00 0.00 H TER 79749 WAT 7517 ATOM 79749 O WAT 7518 13.738 92.406 108.445 1.00 0.00 O ATOM 79750 H1 WAT 7518 13.786 91.485 108.702 1.00 0.00 H ATOM 79751 H2 WAT 7518 13.686 92.387 107.490 1.00 0.00 H TER 79753 WAT 7518 ATOM 79753 O WAT 7519 35.703 76.552 1.175 1.00 0.00 O ATOM 79754 H1 WAT 7519 35.116 76.134 1.805 1.00 0.00 H ATOM 79755 H2 WAT 7519 35.132 76.816 0.454 1.00 0.00 H TER 79757 WAT 7519 ATOM 79757 O WAT 7520 68.263 141.144 87.059 1.00 0.00 O ATOM 79758 H1 WAT 7520 68.947 141.527 86.510 1.00 0.00 H ATOM 79759 H2 WAT 7520 67.444 141.378 86.621 1.00 0.00 H TER 79761 WAT 7520 ATOM 79761 O WAT 7521 94.259 65.374 0.128 1.00 0.00 O ATOM 79762 H1 WAT 7521 93.826 64.535 0.279 1.00 0.00 H ATOM 79763 H2 WAT 7521 95.166 65.228 0.396 1.00 0.00 H TER 79765 WAT 7521 ATOM 79765 O WAT 7522 27.356 136.031 75.518 1.00 0.00 O ATOM 79766 H1 WAT 7522 26.629 135.476 75.800 1.00 0.00 H ATOM 79767 H2 WAT 7522 27.219 136.859 75.978 1.00 0.00 H TER 79769 WAT 7522 ATOM 79769 O WAT 7523 102.168 70.338 83.544 1.00 0.00 O ATOM 79770 H1 WAT 7523 101.405 70.273 82.970 1.00 0.00 H ATOM 79771 H2 WAT 7523 102.502 69.443 83.600 1.00 0.00 H TER 79773 WAT 7523 ATOM 79773 O WAT 7524 85.375 21.222 11.928 1.00 0.00 O ATOM 79774 H1 WAT 7524 84.999 21.958 11.445 1.00 0.00 H ATOM 79775 H2 WAT 7524 86.041 21.619 12.489 1.00 0.00 H TER 79777 WAT 7524 ATOM 79777 O WAT 7525 78.658 133.764 116.593 1.00 0.00 O ATOM 79778 H1 WAT 7525 78.265 133.527 117.433 1.00 0.00 H ATOM 79779 H2 WAT 7525 78.769 132.930 116.137 1.00 0.00 H TER 79781 WAT 7525 ATOM 79781 O WAT 7526 83.746 136.199 120.868 1.00 0.00 O ATOM 79782 H1 WAT 7526 83.155 135.545 120.496 1.00 0.00 H ATOM 79783 H2 WAT 7526 84.443 135.686 121.277 1.00 0.00 H TER 79785 WAT 7526 ATOM 79785 O WAT 7527 122.974 95.260 1.522 1.00 0.00 O ATOM 79786 H1 WAT 7527 123.471 95.726 2.195 1.00 0.00 H ATOM 79787 H2 WAT 7527 122.636 94.484 1.968 1.00 0.00 H TER 79789 WAT 7527 ATOM 79789 O WAT 7528 68.136 64.624 74.327 1.00 0.00 O ATOM 79790 H1 WAT 7528 69.019 64.452 74.653 1.00 0.00 H ATOM 79791 H2 WAT 7528 68.185 65.503 73.952 1.00 0.00 H TER 79793 WAT 7528 ATOM 79793 O WAT 7529 82.459 100.144 2.144 1.00 0.00 O ATOM 79794 H1 WAT 7529 83.050 99.413 2.325 1.00 0.00 H ATOM 79795 H2 WAT 7529 82.440 100.645 2.959 1.00 0.00 H TER 79797 WAT 7529 ATOM 79797 O WAT 7530 141.646 49.511 124.977 1.00 0.00 O ATOM 79798 H1 WAT 7530 140.811 49.422 125.437 1.00 0.00 H ATOM 79799 H2 WAT 7530 141.411 49.868 124.120 1.00 0.00 H TER 79801 WAT 7530 ATOM 79801 O WAT 7531 101.567 57.009 77.920 1.00 0.00 O ATOM 79802 H1 WAT 7531 101.919 57.899 77.957 1.00 0.00 H ATOM 79803 H2 WAT 7531 102.206 56.520 77.402 1.00 0.00 H TER 79805 WAT 7531 ATOM 79805 O WAT 7532 98.176 29.737 8.317 1.00 0.00 O ATOM 79806 H1 WAT 7532 98.982 29.253 8.133 1.00 0.00 H ATOM 79807 H2 WAT 7532 98.086 29.697 9.269 1.00 0.00 H TER 79809 WAT 7532 ATOM 79809 O WAT 7533 90.346 10.381 3.316 1.00 0.00 O ATOM 79810 H1 WAT 7533 91.110 10.948 3.425 1.00 0.00 H ATOM 79811 H2 WAT 7533 89.683 10.759 3.894 1.00 0.00 H TER 79813 WAT 7533 ATOM 79813 O WAT 7534 19.762 43.486 2.264 1.00 0.00 O ATOM 79814 H1 WAT 7534 20.544 42.957 2.421 1.00 0.00 H ATOM 79815 H2 WAT 7534 19.843 44.220 2.873 1.00 0.00 H TER 79817 WAT 7534 ATOM 79817 O WAT 7535 94.907 27.208 115.680 1.00 0.00 O ATOM 79818 H1 WAT 7535 94.681 27.958 116.231 1.00 0.00 H ATOM 79819 H2 WAT 7535 95.047 27.583 114.811 1.00 0.00 H TER 79821 WAT 7535 ATOM 79821 O WAT 7536 129.007 102.432 11.843 1.00 0.00 O ATOM 79822 H1 WAT 7536 128.997 103.361 11.611 1.00 0.00 H ATOM 79823 H2 WAT 7536 128.733 101.983 11.044 1.00 0.00 H TER 79825 WAT 7536 ATOM 79825 O WAT 7537 10.939 88.195 145.540 1.00 0.00 O ATOM 79826 H1 WAT 7537 10.733 87.270 145.675 1.00 0.00 H ATOM 79827 H2 WAT 7537 10.127 88.654 145.756 1.00 0.00 H TER 79829 WAT 7537 ATOM 79829 O WAT 7538 62.125 88.582 151.950 1.00 0.00 O ATOM 79830 H1 WAT 7538 61.581 89.330 152.196 1.00 0.00 H ATOM 79831 H2 WAT 7538 62.204 88.068 152.754 1.00 0.00 H TER 79833 WAT 7538 ATOM 79833 O WAT 7539 37.513 121.972 158.491 1.00 0.00 O ATOM 79834 H1 WAT 7539 38.250 122.495 158.805 1.00 0.00 H ATOM 79835 H2 WAT 7539 37.532 122.077 157.540 1.00 0.00 H TER 79837 WAT 7539 ATOM 79837 O WAT 7540 105.907 142.933 112.867 1.00 0.00 O ATOM 79838 H1 WAT 7540 105.134 142.598 113.321 1.00 0.00 H ATOM 79839 H2 WAT 7540 105.649 143.806 112.569 1.00 0.00 H TER 79841 WAT 7540 ATOM 79841 O WAT 7541 66.898 31.102 22.475 1.00 0.00 O ATOM 79842 H1 WAT 7541 66.798 30.459 21.773 1.00 0.00 H ATOM 79843 H2 WAT 7541 66.358 31.842 22.200 1.00 0.00 H TER 79845 WAT 7541 ATOM 79845 O WAT 7542 19.606 48.190 68.626 1.00 0.00 O ATOM 79846 H1 WAT 7542 19.077 48.727 69.216 1.00 0.00 H ATOM 79847 H2 WAT 7542 20.074 48.823 68.081 1.00 0.00 H TER 79849 WAT 7542 ATOM 79849 O WAT 7543 61.613 115.840 101.508 1.00 0.00 O ATOM 79850 H1 WAT 7543 61.229 115.067 101.094 1.00 0.00 H ATOM 79851 H2 WAT 7543 61.437 115.724 102.442 1.00 0.00 H TER 79853 WAT 7543 ATOM 79853 O WAT 7544 61.135 53.375 90.233 1.00 0.00 O ATOM 79854 H1 WAT 7544 60.581 53.138 89.489 1.00 0.00 H ATOM 79855 H2 WAT 7544 61.769 52.661 90.296 1.00 0.00 H TER 79857 WAT 7544 ATOM 79857 O WAT 7545 55.345 127.596 73.022 1.00 0.00 O ATOM 79858 H1 WAT 7545 56.056 128.054 73.469 1.00 0.00 H ATOM 79859 H2 WAT 7545 55.027 128.224 72.372 1.00 0.00 H TER 79861 WAT 7545 ATOM 79861 O WAT 7546 112.531 79.583 11.956 1.00 0.00 O ATOM 79862 H1 WAT 7546 112.202 79.957 11.139 1.00 0.00 H ATOM 79863 H2 WAT 7546 112.396 80.273 12.606 1.00 0.00 H TER 79865 WAT 7546 ATOM 79865 O WAT 7547 61.751 36.035 141.771 1.00 0.00 O ATOM 79866 H1 WAT 7547 61.803 36.378 140.879 1.00 0.00 H ATOM 79867 H2 WAT 7547 60.818 36.066 141.985 1.00 0.00 H TER 79869 WAT 7547 ATOM 79869 O WAT 7548 82.180 69.757 81.227 1.00 0.00 O ATOM 79870 H1 WAT 7548 82.250 69.183 81.990 1.00 0.00 H ATOM 79871 H2 WAT 7548 82.510 70.602 81.532 1.00 0.00 H TER 79873 WAT 7548 ATOM 79873 O WAT 7549 83.028 91.180 9.318 1.00 0.00 O ATOM 79874 H1 WAT 7549 82.320 91.395 9.925 1.00 0.00 H ATOM 79875 H2 WAT 7549 82.793 91.631 8.507 1.00 0.00 H TER 79877 WAT 7549 ATOM 79877 O WAT 7550 135.704 68.251 98.671 1.00 0.00 O ATOM 79878 H1 WAT 7550 136.650 68.113 98.611 1.00 0.00 H ATOM 79879 H2 WAT 7550 135.495 68.809 97.922 1.00 0.00 H TER 79881 WAT 7550 ATOM 79881 O WAT 7551 15.827 51.613 118.507 1.00 0.00 O ATOM 79882 H1 WAT 7551 15.317 50.997 117.981 1.00 0.00 H ATOM 79883 H2 WAT 7551 15.198 52.288 118.762 1.00 0.00 H TER 79885 WAT 7551 ATOM 79885 O WAT 7552 94.862 123.909 73.049 1.00 0.00 O ATOM 79886 H1 WAT 7552 94.485 123.555 73.854 1.00 0.00 H ATOM 79887 H2 WAT 7552 94.175 124.470 72.688 1.00 0.00 H TER 79889 WAT 7552 ATOM 79889 O WAT 7553 117.994 44.432 70.915 1.00 0.00 O ATOM 79890 H1 WAT 7553 117.166 44.135 71.292 1.00 0.00 H ATOM 79891 H2 WAT 7553 117.739 45.081 70.259 1.00 0.00 H TER 79893 WAT 7553 ATOM 79893 O WAT 7554 62.128 47.163 96.400 1.00 0.00 O ATOM 79894 H1 WAT 7554 61.295 46.710 96.534 1.00 0.00 H ATOM 79895 H2 WAT 7554 62.786 46.563 96.751 1.00 0.00 H TER 79897 WAT 7554 ATOM 79897 O WAT 7555 11.349 86.852 85.878 1.00 0.00 O ATOM 79898 H1 WAT 7555 10.454 86.673 85.592 1.00 0.00 H ATOM 79899 H2 WAT 7555 11.626 86.047 86.316 1.00 0.00 H TER 79901 WAT 7555 ATOM 79901 O WAT 7556 85.615 114.153 133.713 1.00 0.00 O ATOM 79902 H1 WAT 7556 86.466 113.993 133.307 1.00 0.00 H ATOM 79903 H2 WAT 7556 85.743 114.946 134.234 1.00 0.00 H TER 79905 WAT 7556 ATOM 79905 O WAT 7557 23.515 78.466 79.890 1.00 0.00 O ATOM 79906 H1 WAT 7557 22.651 78.825 80.091 1.00 0.00 H ATOM 79907 H2 WAT 7557 23.534 78.407 78.935 1.00 0.00 H TER 79909 WAT 7557 ATOM 79909 O WAT 7558 120.228 40.892 75.060 1.00 0.00 O ATOM 79910 H1 WAT 7558 120.329 40.612 74.151 1.00 0.00 H ATOM 79911 H2 WAT 7558 120.362 40.094 75.573 1.00 0.00 H TER 79913 WAT 7558 ATOM 79913 O WAT 7559 120.792 40.648 157.115 1.00 0.00 O ATOM 79914 H1 WAT 7559 120.549 39.807 157.502 1.00 0.00 H ATOM 79915 H2 WAT 7559 120.125 41.259 157.429 1.00 0.00 H TER 79917 WAT 7559 ATOM 79917 O WAT 7560 75.457 142.980 135.373 1.00 0.00 O ATOM 79918 H1 WAT 7560 75.415 142.871 134.423 1.00 0.00 H ATOM 79919 H2 WAT 7560 76.346 143.295 135.539 1.00 0.00 H TER 79921 WAT 7560 ATOM 79921 O WAT 7561 37.986 34.080 109.233 1.00 0.00 O ATOM 79922 H1 WAT 7561 38.869 34.339 108.968 1.00 0.00 H ATOM 79923 H2 WAT 7561 37.630 33.627 108.468 1.00 0.00 H TER 79925 WAT 7561 ATOM 79925 O WAT 7562 40.655 99.176 124.030 1.00 0.00 O ATOM 79926 H1 WAT 7562 40.331 98.368 123.632 1.00 0.00 H ATOM 79927 H2 WAT 7562 41.324 99.490 123.422 1.00 0.00 H TER 79929 WAT 7562 ATOM 79929 O WAT 7563 51.064 79.921 0.761 1.00 0.00 O ATOM 79930 H1 WAT 7563 51.701 79.469 0.208 1.00 0.00 H ATOM 79931 H2 WAT 7563 50.238 79.850 0.282 1.00 0.00 H TER 79933 WAT 7563 ATOM 79933 O WAT 7564 92.694 30.512 11.473 1.00 0.00 O ATOM 79934 H1 WAT 7564 93.111 29.735 11.846 1.00 0.00 H ATOM 79935 H2 WAT 7564 92.198 30.890 12.199 1.00 0.00 H TER 79937 WAT 7564 ATOM 79937 O WAT 7565 83.492 13.878 154.836 1.00 0.00 O ATOM 79938 H1 WAT 7565 83.052 14.380 154.150 1.00 0.00 H ATOM 79939 H2 WAT 7565 84.346 13.661 154.463 1.00 0.00 H TER 79941 WAT 7565 ATOM 79941 O WAT 7566 17.888 138.631 11.722 1.00 0.00 O ATOM 79942 H1 WAT 7566 17.639 139.538 11.896 1.00 0.00 H ATOM 79943 H2 WAT 7566 18.503 138.412 12.421 1.00 0.00 H TER 79945 WAT 7566 ATOM 79945 O WAT 7567 40.557 103.096 154.056 1.00 0.00 O ATOM 79946 H1 WAT 7567 41.279 102.967 154.671 1.00 0.00 H ATOM 79947 H2 WAT 7567 40.890 102.764 153.222 1.00 0.00 H TER 79949 WAT 7567 ATOM 79949 O WAT 7568 82.967 32.551 100.339 1.00 0.00 O ATOM 79950 H1 WAT 7568 82.830 33.242 100.987 1.00 0.00 H ATOM 79951 H2 WAT 7568 83.608 32.917 99.731 1.00 0.00 H TER 79953 WAT 7568 ATOM 79953 O WAT 7569 31.431 8.046 76.403 1.00 0.00 O ATOM 79954 H1 WAT 7569 31.504 7.279 75.835 1.00 0.00 H ATOM 79955 H2 WAT 7569 30.834 7.772 77.100 1.00 0.00 H TER 79957 WAT 7569 ATOM 79957 O WAT 7570 74.884 7.624 74.569 1.00 0.00 O ATOM 79958 H1 WAT 7570 74.660 7.082 73.813 1.00 0.00 H ATOM 79959 H2 WAT 7570 75.636 8.141 74.279 1.00 0.00 H TER 79961 WAT 7570 ATOM 79961 O WAT 7571 49.202 116.404 0.310 1.00 0.00 O ATOM 79962 H1 WAT 7571 49.739 116.825 0.982 1.00 0.00 H ATOM 79963 H2 WAT 7571 48.726 115.719 0.779 1.00 0.00 H TER 79965 WAT 7571 ATOM 79965 O WAT 7572 138.640 106.399 69.430 1.00 0.00 O ATOM 79966 H1 WAT 7572 139.026 105.523 69.440 1.00 0.00 H ATOM 79967 H2 WAT 7572 138.421 106.575 70.345 1.00 0.00 H TER 79969 WAT 7572 ATOM 79969 O WAT 7573 50.782 127.332 146.406 1.00 0.00 O ATOM 79970 H1 WAT 7573 50.231 127.941 145.914 1.00 0.00 H ATOM 79971 H2 WAT 7573 50.839 127.714 147.282 1.00 0.00 H TER 79973 WAT 7573 ATOM 79973 O WAT 7574 36.211 43.695 84.757 1.00 0.00 O ATOM 79974 H1 WAT 7574 36.584 44.347 84.163 1.00 0.00 H ATOM 79975 H2 WAT 7574 35.436 44.121 85.124 1.00 0.00 H TER 79977 WAT 7574 ATOM 79977 O WAT 7575 97.871 134.188 63.500 1.00 0.00 O ATOM 79978 H1 WAT 7575 97.082 134.193 62.958 1.00 0.00 H ATOM 79979 H2 WAT 7575 97.683 134.812 64.202 1.00 0.00 H TER 79981 WAT 7575 ATOM 79981 O WAT 7576 74.225 52.436 112.207 1.00 0.00 O ATOM 79982 H1 WAT 7576 74.064 53.331 112.507 1.00 0.00 H ATOM 79983 H2 WAT 7576 73.833 52.401 111.335 1.00 0.00 H TER 79985 WAT 7576 ATOM 79985 O WAT 7577 80.966 58.468 67.939 1.00 0.00 O ATOM 79986 H1 WAT 7577 80.251 58.859 67.437 1.00 0.00 H ATOM 79987 H2 WAT 7577 81.761 58.798 67.520 1.00 0.00 H TER 79989 WAT 7577 ATOM 79989 O WAT 7578 10.795 95.785 144.410 1.00 0.00 O ATOM 79990 H1 WAT 7578 11.261 95.142 143.876 1.00 0.00 H ATOM 79991 H2 WAT 7578 10.184 95.265 144.932 1.00 0.00 H TER 79993 WAT 7578 ATOM 79993 O WAT 7579 125.093 58.252 135.634 1.00 0.00 O ATOM 79994 H1 WAT 7579 124.976 57.616 136.341 1.00 0.00 H ATOM 79995 H2 WAT 7579 126.034 58.246 135.460 1.00 0.00 H TER 79997 WAT 7579 ATOM 79997 O WAT 7580 37.276 12.952 27.064 1.00 0.00 O ATOM 79998 H1 WAT 7580 37.981 13.521 26.753 1.00 0.00 H ATOM 79999 H2 WAT 7580 36.485 13.484 26.979 1.00 0.00 H TER 80001 WAT 7580 ATOM 80001 O WAT 7581 55.945 134.496 3.762 1.00 0.00 O ATOM 80002 H1 WAT 7581 56.418 134.974 4.443 1.00 0.00 H ATOM 80003 H2 WAT 7581 55.040 134.471 4.072 1.00 0.00 H TER 80005 WAT 7581 ATOM 80005 O WAT 7582 71.101 124.209 83.556 1.00 0.00 O ATOM 80006 H1 WAT 7582 70.207 124.235 83.214 1.00 0.00 H ATOM 80007 H2 WAT 7582 71.655 124.224 82.776 1.00 0.00 H TER 80009 WAT 7582 ATOM 80009 O WAT 7583 2.038 104.443 58.828 1.00 0.00 O ATOM 80010 H1 WAT 7583 1.342 104.955 58.418 1.00 0.00 H ATOM 80011 H2 WAT 7583 2.381 103.896 58.122 1.00 0.00 H TER 80013 WAT 7583 ATOM 80013 O WAT 7584 117.019 51.812 66.337 1.00 0.00 O ATOM 80014 H1 WAT 7584 116.970 51.734 65.384 1.00 0.00 H ATOM 80015 H2 WAT 7584 117.452 51.007 66.621 1.00 0.00 H TER 80017 WAT 7584 ATOM 80017 O WAT 7585 82.328 51.715 119.805 1.00 0.00 O ATOM 80018 H1 WAT 7585 82.484 52.011 118.908 1.00 0.00 H ATOM 80019 H2 WAT 7585 83.154 51.879 120.259 1.00 0.00 H TER 80021 WAT 7585 ATOM 80021 O WAT 7586 144.306 77.173 13.818 1.00 0.00 O ATOM 80022 H1 WAT 7586 143.870 78.021 13.905 1.00 0.00 H ATOM 80023 H2 WAT 7586 143.605 76.567 13.577 1.00 0.00 H TER 80025 WAT 7586 ATOM 80025 O WAT 7587 112.470 42.115 1.432 1.00 0.00 O ATOM 80026 H1 WAT 7587 111.931 42.832 1.767 1.00 0.00 H ATOM 80027 H2 WAT 7587 111.924 41.336 1.539 1.00 0.00 H TER 80029 WAT 7587 ATOM 80029 O WAT 7588 134.209 26.930 55.861 1.00 0.00 O ATOM 80030 H1 WAT 7588 133.608 26.185 55.851 1.00 0.00 H ATOM 80031 H2 WAT 7588 135.073 26.543 55.721 1.00 0.00 H TER 80033 WAT 7588 ATOM 80033 O WAT 7589 97.945 73.507 115.468 1.00 0.00 O ATOM 80034 H1 WAT 7589 97.114 73.682 115.909 1.00 0.00 H ATOM 80035 H2 WAT 7589 98.611 73.836 116.071 1.00 0.00 H TER 80037 WAT 7589 ATOM 80037 O WAT 7590 140.557 65.706 116.120 1.00 0.00 O ATOM 80038 H1 WAT 7590 140.106 64.927 116.445 1.00 0.00 H ATOM 80039 H2 WAT 7590 141.078 65.390 115.381 1.00 0.00 H TER 80041 WAT 7590 ATOM 80041 O WAT 7591 116.672 127.086 4.857 1.00 0.00 O ATOM 80042 H1 WAT 7591 115.963 127.726 4.788 1.00 0.00 H ATOM 80043 H2 WAT 7591 117.382 127.457 4.333 1.00 0.00 H TER 80045 WAT 7591 ATOM 80045 O WAT 7592 30.397 16.294 143.848 1.00 0.00 O ATOM 80046 H1 WAT 7592 30.904 17.067 144.097 1.00 0.00 H ATOM 80047 H2 WAT 7592 30.953 15.554 144.093 1.00 0.00 H TER 80049 WAT 7592 ATOM 80049 O WAT 7593 17.589 54.039 56.753 1.00 0.00 O ATOM 80050 H1 WAT 7593 16.898 53.611 57.260 1.00 0.00 H ATOM 80051 H2 WAT 7593 18.112 54.503 57.407 1.00 0.00 H TER 80053 WAT 7593 ATOM 80053 O WAT 7594 105.565 51.546 58.851 1.00 0.00 O ATOM 80054 H1 WAT 7594 105.969 52.394 58.665 1.00 0.00 H ATOM 80055 H2 WAT 7594 104.986 51.715 59.594 1.00 0.00 H TER 80057 WAT 7594 ATOM 80057 O WAT 7595 97.580 51.918 93.764 1.00 0.00 O ATOM 80058 H1 WAT 7595 97.204 52.667 93.302 1.00 0.00 H ATOM 80059 H2 WAT 7595 98.492 52.165 93.919 1.00 0.00 H TER 80061 WAT 7595 ATOM 80061 O WAT 7596 118.511 12.739 106.718 1.00 0.00 O ATOM 80062 H1 WAT 7596 118.288 11.813 106.630 1.00 0.00 H ATOM 80063 H2 WAT 7596 118.552 13.062 105.818 1.00 0.00 H TER 80065 WAT 7596 ATOM 80065 O WAT 7597 72.718 93.723 79.602 1.00 0.00 O ATOM 80066 H1 WAT 7597 72.220 94.257 80.221 1.00 0.00 H ATOM 80067 H2 WAT 7597 72.191 93.728 78.803 1.00 0.00 H TER 80069 WAT 7597 ATOM 80069 O WAT 7598 70.596 15.357 146.060 1.00 0.00 O ATOM 80070 H1 WAT 7598 71.017 14.832 145.380 1.00 0.00 H ATOM 80071 H2 WAT 7598 70.621 16.252 145.721 1.00 0.00 H TER 80073 WAT 7598 ATOM 80073 O WAT 7599 141.732 48.705 18.054 1.00 0.00 O ATOM 80074 H1 WAT 7599 141.902 48.885 18.978 1.00 0.00 H ATOM 80075 H2 WAT 7599 142.142 47.854 17.897 1.00 0.00 H TER 80077 WAT 7599 ATOM 80077 O WAT 7600 106.013 129.523 10.599 1.00 0.00 O ATOM 80078 H1 WAT 7600 106.009 130.473 10.719 1.00 0.00 H ATOM 80079 H2 WAT 7600 106.507 129.385 9.791 1.00 0.00 H TER 80081 WAT 7600 ATOM 80081 O WAT 7601 53.936 7.936 88.819 1.00 0.00 O ATOM 80082 H1 WAT 7601 54.136 8.868 88.736 1.00 0.00 H ATOM 80083 H2 WAT 7601 54.772 7.496 88.664 1.00 0.00 H TER 80085 WAT 7601 ATOM 80085 O WAT 7602 30.734 18.942 19.098 1.00 0.00 O ATOM 80086 H1 WAT 7602 29.819 19.189 18.960 1.00 0.00 H ATOM 80087 H2 WAT 7602 30.846 18.963 20.049 1.00 0.00 H TER 80089 WAT 7602 ATOM 80089 O WAT 7603 83.887 47.607 4.402 1.00 0.00 O ATOM 80090 H1 WAT 7603 83.421 48.060 3.699 1.00 0.00 H ATOM 80091 H2 WAT 7603 83.390 47.818 5.193 1.00 0.00 H TER 80093 WAT 7603 ATOM 80093 O WAT 7604 103.540 85.422 102.466 1.00 0.00 O ATOM 80094 H1 WAT 7604 103.463 84.810 103.198 1.00 0.00 H ATOM 80095 H2 WAT 7604 103.038 86.189 102.741 1.00 0.00 H TER 80097 WAT 7604 ATOM 80097 O WAT 7605 44.392 56.635 12.040 1.00 0.00 O ATOM 80098 H1 WAT 7605 44.814 55.978 11.487 1.00 0.00 H ATOM 80099 H2 WAT 7605 45.032 56.814 12.729 1.00 0.00 H TER 80101 WAT 7605 ATOM 80101 O WAT 7606 85.557 108.625 128.340 1.00 0.00 O ATOM 80102 H1 WAT 7606 85.405 108.592 127.395 1.00 0.00 H ATOM 80103 H2 WAT 7606 86.467 108.347 128.446 1.00 0.00 H TER 80105 WAT 7606 ATOM 80105 O WAT 7607 133.901 6.518 65.796 1.00 0.00 O ATOM 80106 H1 WAT 7607 134.561 6.926 65.237 1.00 0.00 H ATOM 80107 H2 WAT 7607 134.133 5.589 65.803 1.00 0.00 H TER 80109 WAT 7607 ATOM 80109 O WAT 7608 1.365 141.438 123.639 1.00 0.00 O ATOM 80110 H1 WAT 7608 1.307 141.417 122.684 1.00 0.00 H ATOM 80111 H2 WAT 7608 0.617 141.968 123.914 1.00 0.00 H TER 80113 WAT 7608 ATOM 80113 O WAT 7609 30.375 86.330 73.532 1.00 0.00 O ATOM 80114 H1 WAT 7609 31.191 85.927 73.232 1.00 0.00 H ATOM 80115 H2 WAT 7609 29.967 85.662 74.083 1.00 0.00 H TER 80117 WAT 7609 ATOM 80117 O WAT 7610 38.090 127.662 102.758 1.00 0.00 O ATOM 80118 H1 WAT 7610 38.416 127.097 103.460 1.00 0.00 H ATOM 80119 H2 WAT 7610 38.865 127.868 102.237 1.00 0.00 H TER 80121 WAT 7610 ATOM 80121 O WAT 7611 17.970 57.700 17.563 1.00 0.00 O ATOM 80122 H1 WAT 7611 18.063 56.761 17.402 1.00 0.00 H ATOM 80123 H2 WAT 7611 17.730 58.066 16.712 1.00 0.00 H TER 80125 WAT 7611 ATOM 80125 O WAT 7612 129.691 6.513 90.144 1.00 0.00 O ATOM 80126 H1 WAT 7612 129.465 6.899 89.298 1.00 0.00 H ATOM 80127 H2 WAT 7612 130.398 5.899 89.946 1.00 0.00 H TER 80129 WAT 7612 ATOM 80129 O WAT 7613 14.469 126.318 155.291 1.00 0.00 O ATOM 80130 H1 WAT 7613 13.704 125.822 155.583 1.00 0.00 H ATOM 80131 H2 WAT 7613 14.641 126.934 156.003 1.00 0.00 H TER 80133 WAT 7613 ATOM 80133 O WAT 7614 22.753 51.602 58.370 1.00 0.00 O ATOM 80134 H1 WAT 7614 21.954 52.120 58.471 1.00 0.00 H ATOM 80135 H2 WAT 7614 23.316 52.137 57.811 1.00 0.00 H TER 80137 WAT 7614 ATOM 80137 O WAT 7615 40.540 82.293 3.224 1.00 0.00 O ATOM 80138 H1 WAT 7615 40.117 82.898 3.833 1.00 0.00 H ATOM 80139 H2 WAT 7615 39.948 81.542 3.183 1.00 0.00 H TER 80141 WAT 7615 ATOM 80141 O WAT 7616 62.368 127.709 68.865 1.00 0.00 O ATOM 80142 H1 WAT 7616 62.440 127.808 69.815 1.00 0.00 H ATOM 80143 H2 WAT 7616 63.273 127.647 68.561 1.00 0.00 H TER 80145 WAT 7616 ATOM 80145 O WAT 7617 138.485 56.327 69.445 1.00 0.00 O ATOM 80146 H1 WAT 7617 139.288 56.708 69.089 1.00 0.00 H ATOM 80147 H2 WAT 7617 138.633 55.382 69.411 1.00 0.00 H TER 80149 WAT 7617 ATOM 80149 O WAT 7618 116.018 63.190 132.809 1.00 0.00 O ATOM 80150 H1 WAT 7618 115.469 63.065 133.583 1.00 0.00 H ATOM 80151 H2 WAT 7618 116.151 62.308 132.464 1.00 0.00 H TER 80153 WAT 7618 ATOM 80153 O WAT 7619 29.605 46.321 138.891 1.00 0.00 O ATOM 80154 H1 WAT 7619 30.326 46.532 138.297 1.00 0.00 H ATOM 80155 H2 WAT 7619 28.826 46.330 138.335 1.00 0.00 H TER 80157 WAT 7619 ATOM 80157 O WAT 7620 80.524 4.276 2.498 1.00 0.00 O ATOM 80158 H1 WAT 7620 80.353 4.222 1.558 1.00 0.00 H ATOM 80159 H2 WAT 7620 80.141 5.113 2.763 1.00 0.00 H TER 80161 WAT 7620 ATOM 80161 O WAT 7621 128.134 90.686 117.136 1.00 0.00 O ATOM 80162 H1 WAT 7621 128.827 90.085 116.863 1.00 0.00 H ATOM 80163 H2 WAT 7621 127.352 90.371 116.684 1.00 0.00 H TER 80165 WAT 7621 ATOM 80165 O WAT 7622 61.437 72.043 100.898 1.00 0.00 O ATOM 80166 H1 WAT 7622 60.570 72.031 100.492 1.00 0.00 H ATOM 80167 H2 WAT 7622 62.034 72.262 100.182 1.00 0.00 H TER 80169 WAT 7622 ATOM 80169 O WAT 7623 27.114 27.973 72.319 1.00 0.00 O ATOM 80170 H1 WAT 7623 27.811 28.375 72.838 1.00 0.00 H ATOM 80171 H2 WAT 7623 26.312 28.167 72.805 1.00 0.00 H TER 80173 WAT 7623 ATOM 80173 O WAT 7624 21.387 128.929 117.123 1.00 0.00 O ATOM 80174 H1 WAT 7624 20.863 128.152 117.317 1.00 0.00 H ATOM 80175 H2 WAT 7624 21.675 129.243 117.980 1.00 0.00 H TER 80177 WAT 7624 ATOM 80177 O WAT 7625 67.209 93.295 8.569 1.00 0.00 O ATOM 80178 H1 WAT 7625 66.357 92.897 8.394 1.00 0.00 H ATOM 80179 H2 WAT 7625 67.716 93.135 7.773 1.00 0.00 H TER 80181 WAT 7625 ATOM 80181 O WAT 7626 86.779 140.959 56.771 1.00 0.00 O ATOM 80182 H1 WAT 7626 87.594 141.394 57.021 1.00 0.00 H ATOM 80183 H2 WAT 7626 87.049 140.081 56.501 1.00 0.00 H TER 80185 WAT 7626 ATOM 80185 O WAT 7627 11.725 5.349 94.095 1.00 0.00 O ATOM 80186 H1 WAT 7627 12.099 6.040 94.642 1.00 0.00 H ATOM 80187 H2 WAT 7627 10.947 5.748 93.704 1.00 0.00 H TER 80189 WAT 7627 ATOM 80189 O WAT 7628 79.353 145.003 133.801 1.00 0.00 O ATOM 80190 H1 WAT 7628 80.255 144.842 134.077 1.00 0.00 H ATOM 80191 H2 WAT 7628 79.409 145.779 133.243 1.00 0.00 H TER 80193 WAT 7628 ATOM 80193 O WAT 7629 66.067 31.077 129.075 1.00 0.00 O ATOM 80194 H1 WAT 7629 66.621 31.629 128.522 1.00 0.00 H ATOM 80195 H2 WAT 7629 65.471 30.647 128.462 1.00 0.00 H TER 80197 WAT 7629 ATOM 80197 O WAT 7630 93.299 10.970 65.974 1.00 0.00 O ATOM 80198 H1 WAT 7630 93.829 11.540 65.417 1.00 0.00 H ATOM 80199 H2 WAT 7630 92.395 11.222 65.783 1.00 0.00 H TER 80201 WAT 7630 ATOM 80201 O WAT 7631 11.304 111.290 125.843 1.00 0.00 O ATOM 80202 H1 WAT 7631 11.783 112.115 125.773 1.00 0.00 H ATOM 80203 H2 WAT 7631 11.048 111.084 124.943 1.00 0.00 H TER 80205 WAT 7631 ATOM 80205 O WAT 7632 49.114 5.529 76.032 1.00 0.00 O ATOM 80206 H1 WAT 7632 50.005 5.570 75.686 1.00 0.00 H ATOM 80207 H2 WAT 7632 49.196 5.818 76.941 1.00 0.00 H TER 80209 WAT 7632 ATOM 80209 O WAT 7633 92.630 5.072 135.962 1.00 0.00 O ATOM 80210 H1 WAT 7633 92.974 5.741 135.370 1.00 0.00 H ATOM 80211 H2 WAT 7633 91.831 5.458 136.322 1.00 0.00 H TER 80213 WAT 7633 ATOM 80213 O WAT 7634 121.960 115.456 146.657 1.00 0.00 O ATOM 80214 H1 WAT 7634 122.239 114.561 146.463 1.00 0.00 H ATOM 80215 H2 WAT 7634 122.188 115.953 145.872 1.00 0.00 H TER 80217 WAT 7634 ATOM 80217 O WAT 7635 5.148 46.285 13.522 1.00 0.00 O ATOM 80218 H1 WAT 7635 4.543 45.607 13.823 1.00 0.00 H ATOM 80219 H2 WAT 7635 5.776 46.381 14.237 1.00 0.00 H TER 80221 WAT 7635 ATOM 80221 O WAT 7636 72.994 31.445 96.287 1.00 0.00 O ATOM 80222 H1 WAT 7636 72.100 31.578 95.972 1.00 0.00 H ATOM 80223 H2 WAT 7636 73.543 31.905 95.652 1.00 0.00 H TER 80225 WAT 7636 ATOM 80225 O WAT 7637 64.418 120.193 125.257 1.00 0.00 O ATOM 80226 H1 WAT 7637 63.550 120.571 125.400 1.00 0.00 H ATOM 80227 H2 WAT 7637 65.015 120.786 125.713 1.00 0.00 H TER 80229 WAT 7637 ATOM 80229 O WAT 7638 13.315 118.556 66.250 1.00 0.00 O ATOM 80230 H1 WAT 7638 13.453 117.770 65.722 1.00 0.00 H ATOM 80231 H2 WAT 7638 12.597 118.326 66.840 1.00 0.00 H TER 80233 WAT 7638 ATOM 80233 O WAT 7639 65.846 56.558 110.268 1.00 0.00 O ATOM 80234 H1 WAT 7639 65.516 55.683 110.064 1.00 0.00 H ATOM 80235 H2 WAT 7639 66.347 56.442 111.076 1.00 0.00 H TER 80237 WAT 7639 ATOM 80237 O WAT 7640 112.466 69.471 84.288 1.00 0.00 O ATOM 80238 H1 WAT 7640 111.902 68.866 83.805 1.00 0.00 H ATOM 80239 H2 WAT 7640 112.233 69.333 85.207 1.00 0.00 H TER 80241 WAT 7640 ATOM 80241 O WAT 7641 67.209 12.244 104.741 1.00 0.00 O ATOM 80242 H1 WAT 7641 67.072 12.132 103.800 1.00 0.00 H ATOM 80243 H2 WAT 7641 68.074 11.867 104.903 1.00 0.00 H TER 80245 WAT 7641 ATOM 80245 O WAT 7642 105.496 93.090 19.819 1.00 0.00 O ATOM 80246 H1 WAT 7642 105.333 92.153 19.708 1.00 0.00 H ATOM 80247 H2 WAT 7642 106.255 93.133 20.401 1.00 0.00 H TER 80249 WAT 7642 ATOM 80249 O WAT 7643 105.440 27.930 85.056 1.00 0.00 O ATOM 80250 H1 WAT 7643 105.813 27.054 84.955 1.00 0.00 H ATOM 80251 H2 WAT 7643 105.332 28.036 86.001 1.00 0.00 H TER 80253 WAT 7643 ATOM 80253 O WAT 7644 93.884 69.829 19.945 1.00 0.00 O ATOM 80254 H1 WAT 7644 94.440 70.581 20.149 1.00 0.00 H ATOM 80255 H2 WAT 7644 93.387 69.674 20.749 1.00 0.00 H TER 80257 WAT 7644 ATOM 80257 O WAT 7645 32.356 63.984 157.216 1.00 0.00 O ATOM 80258 H1 WAT 7645 32.131 64.895 157.407 1.00 0.00 H ATOM 80259 H2 WAT 7645 32.379 63.558 158.073 1.00 0.00 H TER 80261 WAT 7645 ATOM 80261 O WAT 7646 64.092 7.206 49.325 1.00 0.00 O ATOM 80262 H1 WAT 7646 64.483 7.386 50.180 1.00 0.00 H ATOM 80263 H2 WAT 7646 64.703 7.591 48.696 1.00 0.00 H TER 80265 WAT 7646 ATOM 80265 O WAT 7647 118.663 81.683 114.891 1.00 0.00 O ATOM 80266 H1 WAT 7647 119.162 81.362 115.642 1.00 0.00 H ATOM 80267 H2 WAT 7647 118.474 82.597 115.102 1.00 0.00 H TER 80269 WAT 7647 ATOM 80269 O WAT 7648 63.551 107.855 90.422 1.00 0.00 O ATOM 80270 H1 WAT 7648 63.837 107.603 89.544 1.00 0.00 H ATOM 80271 H2 WAT 7648 62.850 108.489 90.273 1.00 0.00 H TER 80273 WAT 7648 ATOM 80273 O WAT 7649 55.407 133.295 68.334 1.00 0.00 O ATOM 80274 H1 WAT 7649 55.351 132.770 69.132 1.00 0.00 H ATOM 80275 H2 WAT 7649 54.502 133.366 68.030 1.00 0.00 H TER 80277 WAT 7649 ATOM 80277 O WAT 7650 17.696 70.644 158.771 1.00 0.00 O ATOM 80278 H1 WAT 7650 17.034 71.041 158.205 1.00 0.00 H ATOM 80279 H2 WAT 7650 18.447 71.235 158.712 1.00 0.00 H TER 80281 WAT 7650 ATOM 80281 O WAT 7651 111.364 72.661 126.801 1.00 0.00 O ATOM 80282 H1 WAT 7651 111.492 73.050 127.666 1.00 0.00 H ATOM 80283 H2 WAT 7651 112.142 72.917 126.305 1.00 0.00 H TER 80285 WAT 7651 ATOM 80285 O WAT 7652 63.317 35.633 66.289 1.00 0.00 O ATOM 80286 H1 WAT 7652 62.692 34.931 66.473 1.00 0.00 H ATOM 80287 H2 WAT 7652 64.154 35.183 66.170 1.00 0.00 H TER 80289 WAT 7652 ATOM 80289 O WAT 7653 105.256 9.202 136.757 1.00 0.00 O ATOM 80290 H1 WAT 7653 104.766 10.009 136.914 1.00 0.00 H ATOM 80291 H2 WAT 7653 104.590 8.563 136.503 1.00 0.00 H TER 80293 WAT 7653 ATOM 80293 O WAT 7654 25.263 59.194 137.368 1.00 0.00 O ATOM 80294 H1 WAT 7654 25.843 58.550 136.961 1.00 0.00 H ATOM 80295 H2 WAT 7654 24.412 59.044 136.957 1.00 0.00 H TER 80297 WAT 7654 ATOM 80297 O WAT 7655 138.229 52.305 93.704 1.00 0.00 O ATOM 80298 H1 WAT 7655 138.326 51.869 94.551 1.00 0.00 H ATOM 80299 H2 WAT 7655 138.614 53.171 93.835 1.00 0.00 H TER 80301 WAT 7655 ATOM 80301 O WAT 7656 101.786 76.724 63.541 1.00 0.00 O ATOM 80302 H1 WAT 7656 101.102 76.057 63.477 1.00 0.00 H ATOM 80303 H2 WAT 7656 101.352 77.537 63.284 1.00 0.00 H TER 80305 WAT 7656 ATOM 80305 O WAT 7657 61.068 19.207 93.179 1.00 0.00 O ATOM 80306 H1 WAT 7657 60.668 20.003 92.829 1.00 0.00 H ATOM 80307 H2 WAT 7657 60.406 18.845 93.768 1.00 0.00 H TER 80309 WAT 7657 ATOM 80309 O WAT 7658 95.727 141.519 81.889 1.00 0.00 O ATOM 80310 H1 WAT 7658 94.845 141.149 81.887 1.00 0.00 H ATOM 80311 H2 WAT 7658 96.306 140.758 81.933 1.00 0.00 H TER 80313 WAT 7658 ATOM 80313 O WAT 7659 67.285 140.186 12.699 1.00 0.00 O ATOM 80314 H1 WAT 7659 68.160 139.888 12.947 1.00 0.00 H ATOM 80315 H2 WAT 7659 66.906 139.447 12.223 1.00 0.00 H TER 80317 WAT 7659 ATOM 80317 O WAT 7660 123.650 127.232 64.072 1.00 0.00 O ATOM 80318 H1 WAT 7660 123.996 126.550 63.497 1.00 0.00 H ATOM 80319 H2 WAT 7660 124.237 127.228 64.828 1.00 0.00 H TER 80321 WAT 7660 ATOM 80321 O WAT 7661 64.313 78.541 87.947 1.00 0.00 O ATOM 80322 H1 WAT 7661 64.587 79.439 88.136 1.00 0.00 H ATOM 80323 H2 WAT 7661 64.701 78.020 88.650 1.00 0.00 H TER 80325 WAT 7661 ATOM 80325 O WAT 7662 116.431 130.616 5.322 1.00 0.00 O ATOM 80326 H1 WAT 7662 116.066 130.115 4.593 1.00 0.00 H ATOM 80327 H2 WAT 7662 117.373 130.630 5.155 1.00 0.00 H TER 80329 WAT 7662 ATOM 80329 O WAT 7663 8.847 35.550 5.399 1.00 0.00 O ATOM 80330 H1 WAT 7663 7.970 35.676 5.038 1.00 0.00 H ATOM 80331 H2 WAT 7663 8.753 34.813 6.003 1.00 0.00 H TER 80333 WAT 7663 ATOM 80333 O WAT 7664 143.481 109.985 150.948 1.00 0.00 O ATOM 80334 H1 WAT 7664 143.255 109.727 151.842 1.00 0.00 H ATOM 80335 H2 WAT 7664 144.348 109.606 150.801 1.00 0.00 H TER 80337 WAT 7664 ATOM 80337 O WAT 7665 80.137 5.799 132.606 1.00 0.00 O ATOM 80338 H1 WAT 7665 79.700 6.640 132.740 1.00 0.00 H ATOM 80339 H2 WAT 7665 80.523 5.591 133.457 1.00 0.00 H TER 80341 WAT 7665 ATOM 80341 O WAT 7666 92.664 9.548 55.097 1.00 0.00 O ATOM 80342 H1 WAT 7666 92.875 8.831 55.695 1.00 0.00 H ATOM 80343 H2 WAT 7666 93.503 9.980 54.935 1.00 0.00 H TER 80345 WAT 7666 ATOM 80345 O WAT 7667 83.188 64.389 79.979 1.00 0.00 O ATOM 80346 H1 WAT 7667 82.331 64.047 79.723 1.00 0.00 H ATOM 80347 H2 WAT 7667 83.072 65.339 79.994 1.00 0.00 H TER 80349 WAT 7667 ATOM 80349 O WAT 7668 74.439 9.234 99.373 1.00 0.00 O ATOM 80350 H1 WAT 7668 74.486 9.999 98.799 1.00 0.00 H ATOM 80351 H2 WAT 7668 73.693 9.410 99.946 1.00 0.00 H TER 80353 WAT 7668 ATOM 80353 O WAT 7669 76.151 1.724 107.202 1.00 0.00 O ATOM 80354 H1 WAT 7669 75.463 1.920 107.838 1.00 0.00 H ATOM 80355 H2 WAT 7669 76.744 2.473 107.251 1.00 0.00 H TER 80357 WAT 7669 ATOM 80357 O WAT 7670 141.736 107.128 103.947 1.00 0.00 O ATOM 80358 H1 WAT 7670 140.845 106.976 104.264 1.00 0.00 H ATOM 80359 H2 WAT 7670 141.644 107.825 103.298 1.00 0.00 H TER 80361 WAT 7670 ATOM 80361 O WAT 7671 34.837 138.557 102.174 1.00 0.00 O ATOM 80362 H1 WAT 7671 35.703 138.965 102.174 1.00 0.00 H ATOM 80363 H2 WAT 7671 34.958 137.740 101.691 1.00 0.00 H TER 80365 WAT 7671 ATOM 80365 O WAT 7672 37.505 21.460 9.035 1.00 0.00 O ATOM 80366 H1 WAT 7672 37.952 21.191 8.233 1.00 0.00 H ATOM 80367 H2 WAT 7672 36.861 22.107 8.745 1.00 0.00 H TER 80369 WAT 7672 ATOM 80369 O WAT 7673 52.297 119.451 143.714 1.00 0.00 O ATOM 80370 H1 WAT 7673 53.072 118.968 143.999 1.00 0.00 H ATOM 80371 H2 WAT 7673 52.644 120.258 143.333 1.00 0.00 H TER 80373 WAT 7673 ATOM 80373 O WAT 7674 136.112 95.772 106.218 1.00 0.00 O ATOM 80374 H1 WAT 7674 136.440 95.455 107.060 1.00 0.00 H ATOM 80375 H2 WAT 7674 135.921 96.698 106.368 1.00 0.00 H TER 80377 WAT 7674 ATOM 80377 O WAT 7675 85.243 41.721 88.455 1.00 0.00 O ATOM 80378 H1 WAT 7675 84.529 41.090 88.365 1.00 0.00 H ATOM 80379 H2 WAT 7675 85.209 42.237 87.649 1.00 0.00 H TER 80381 WAT 7675 ATOM 80381 O WAT 7676 123.628 72.777 88.933 1.00 0.00 O ATOM 80382 H1 WAT 7676 123.285 71.952 89.278 1.00 0.00 H ATOM 80383 H2 WAT 7676 123.873 72.575 88.030 1.00 0.00 H TER 80385 WAT 7676 ATOM 80385 O WAT 7677 58.048 103.696 16.997 1.00 0.00 O ATOM 80386 H1 WAT 7677 57.371 104.360 16.861 1.00 0.00 H ATOM 80387 H2 WAT 7677 58.043 103.181 16.190 1.00 0.00 H TER 80389 WAT 7677 ATOM 80389 O WAT 7678 7.971 17.134 88.306 1.00 0.00 O ATOM 80390 H1 WAT 7678 7.808 17.954 88.772 1.00 0.00 H ATOM 80391 H2 WAT 7678 8.827 17.259 87.895 1.00 0.00 H TER 80393 WAT 7678 ATOM 80393 O WAT 7679 56.127 81.908 96.701 1.00 0.00 O ATOM 80394 H1 WAT 7679 55.233 81.674 96.452 1.00 0.00 H ATOM 80395 H2 WAT 7679 56.129 82.865 96.716 1.00 0.00 H TER 80397 WAT 7679 ATOM 80397 O WAT 7680 86.851 79.453 101.162 1.00 0.00 O ATOM 80398 H1 WAT 7680 87.585 80.027 101.382 1.00 0.00 H ATOM 80399 H2 WAT 7680 87.016 79.187 100.258 1.00 0.00 H TER 80401 WAT 7680 ATOM 80401 O WAT 7681 49.122 75.364 81.926 1.00 0.00 O ATOM 80402 H1 WAT 7681 48.633 74.547 81.827 1.00 0.00 H ATOM 80403 H2 WAT 7681 49.499 75.313 82.804 1.00 0.00 H TER 80405 WAT 7681 ATOM 80405 O WAT 7682 73.551 8.639 13.108 1.00 0.00 O ATOM 80406 H1 WAT 7682 74.197 8.948 13.743 1.00 0.00 H ATOM 80407 H2 WAT 7682 72.899 8.177 13.635 1.00 0.00 H TER 80409 WAT 7682 ATOM 80409 O WAT 7683 2.890 98.159 71.821 1.00 0.00 O ATOM 80410 H1 WAT 7683 2.160 98.605 71.392 1.00 0.00 H ATOM 80411 H2 WAT 7683 3.424 97.825 71.101 1.00 0.00 H TER 80413 WAT 7683 ATOM 80413 O WAT 7684 37.575 86.558 10.566 1.00 0.00 O ATOM 80414 H1 WAT 7684 37.456 86.140 11.419 1.00 0.00 H ATOM 80415 H2 WAT 7684 36.695 86.830 10.308 1.00 0.00 H TER 80417 WAT 7684 ATOM 80417 O WAT 7685 96.257 104.955 140.974 1.00 0.00 O ATOM 80418 H1 WAT 7685 97.174 105.223 141.044 1.00 0.00 H ATOM 80419 H2 WAT 7685 96.136 104.329 141.688 1.00 0.00 H TER 80421 WAT 7685 ATOM 80421 O WAT 7686 84.877 68.634 151.476 1.00 0.00 O ATOM 80422 H1 WAT 7686 85.369 67.817 151.393 1.00 0.00 H ATOM 80423 H2 WAT 7686 84.054 68.376 151.892 1.00 0.00 H TER 80425 WAT 7686 ATOM 80425 O WAT 7687 100.894 21.954 85.029 1.00 0.00 O ATOM 80426 H1 WAT 7687 100.877 22.681 85.652 1.00 0.00 H ATOM 80427 H2 WAT 7687 101.583 21.375 85.355 1.00 0.00 H TER 80429 WAT 7687 ATOM 80429 O WAT 7688 30.399 38.029 108.659 1.00 0.00 O ATOM 80430 H1 WAT 7688 30.651 38.021 107.735 1.00 0.00 H ATOM 80431 H2 WAT 7688 31.127 37.600 109.109 1.00 0.00 H TER 80433 WAT 7688 ATOM 80433 O WAT 7689 16.822 118.128 115.591 1.00 0.00 O ATOM 80434 H1 WAT 7689 16.126 117.696 115.097 1.00 0.00 H ATOM 80435 H2 WAT 7689 17.632 117.809 115.192 1.00 0.00 H TER 80437 WAT 7689 ATOM 80437 O WAT 7690 38.184 4.499 27.818 1.00 0.00 O ATOM 80438 H1 WAT 7690 38.608 5.330 28.032 1.00 0.00 H ATOM 80439 H2 WAT 7690 37.679 4.685 27.027 1.00 0.00 H TER 80441 WAT 7690 ATOM 80441 O WAT 7691 126.813 106.808 -0.099 1.00 0.00 O ATOM 80442 H1 WAT 7691 125.878 107.010 -0.128 1.00 0.00 H ATOM 80443 H2 WAT 7691 126.930 106.337 0.726 1.00 0.00 H TER 80445 WAT 7691 ATOM 80445 O WAT 7692 83.080 67.879 76.534 1.00 0.00 O ATOM 80446 H1 WAT 7692 82.703 68.046 75.670 1.00 0.00 H ATOM 80447 H2 WAT 7692 83.113 68.740 76.951 1.00 0.00 H TER 80449 WAT 7692 ATOM 80449 O WAT 7693 103.121 50.902 131.132 1.00 0.00 O ATOM 80450 H1 WAT 7693 102.611 50.234 131.591 1.00 0.00 H ATOM 80451 H2 WAT 7693 103.221 50.560 130.244 1.00 0.00 H TER 80453 WAT 7693 ATOM 80453 O WAT 7694 28.975 134.920 103.043 1.00 0.00 O ATOM 80454 H1 WAT 7694 28.577 135.224 102.228 1.00 0.00 H ATOM 80455 H2 WAT 7694 29.911 134.868 102.848 1.00 0.00 H TER 80457 WAT 7694 ATOM 80457 O WAT 7695 15.585 145.936 128.678 1.00 0.00 O ATOM 80458 H1 WAT 7695 15.343 145.032 128.476 1.00 0.00 H ATOM 80459 H2 WAT 7695 15.311 146.435 127.908 1.00 0.00 H TER 80461 WAT 7695 ATOM 80461 O WAT 7696 13.881 63.325 136.778 1.00 0.00 O ATOM 80462 H1 WAT 7696 13.159 62.804 137.128 1.00 0.00 H ATOM 80463 H2 WAT 7696 13.539 64.219 136.749 1.00 0.00 H TER 80465 WAT 7696 ATOM 80465 O WAT 7697 66.373 29.486 135.941 1.00 0.00 O ATOM 80466 H1 WAT 7697 65.702 28.912 136.313 1.00 0.00 H ATOM 80467 H2 WAT 7697 66.936 28.900 135.436 1.00 0.00 H TER 80469 WAT 7697 ATOM 80469 O WAT 7698 114.957 6.086 134.864 1.00 0.00 O ATOM 80470 H1 WAT 7698 115.504 6.861 134.739 1.00 0.00 H ATOM 80471 H2 WAT 7698 114.686 5.838 133.980 1.00 0.00 H TER 80473 WAT 7698 ATOM 80473 O WAT 7699 123.642 0.981 156.412 1.00 0.00 O ATOM 80474 H1 WAT 7699 122.712 0.771 156.331 1.00 0.00 H ATOM 80475 H2 WAT 7699 123.683 1.621 157.122 1.00 0.00 H TER 80477 WAT 7699 ATOM 80477 O WAT 7700 77.685 66.306 139.298 1.00 0.00 O ATOM 80478 H1 WAT 7700 77.939 65.650 139.948 1.00 0.00 H ATOM 80479 H2 WAT 7700 78.311 67.019 139.420 1.00 0.00 H TER 80481 WAT 7700 ATOM 80481 O WAT 7701 18.951 63.543 107.223 1.00 0.00 O ATOM 80482 H1 WAT 7701 19.283 64.386 107.531 1.00 0.00 H ATOM 80483 H2 WAT 7701 19.434 63.377 106.413 1.00 0.00 H TER 80485 WAT 7701 ATOM 80485 O WAT 7702 49.553 2.675 57.133 1.00 0.00 O ATOM 80486 H1 WAT 7702 49.683 3.067 57.996 1.00 0.00 H ATOM 80487 H2 WAT 7702 50.303 2.090 57.021 1.00 0.00 H TER 80489 WAT 7702 ATOM 80489 O WAT 7703 74.708 43.405 89.203 1.00 0.00 O ATOM 80490 H1 WAT 7703 74.034 42.886 88.764 1.00 0.00 H ATOM 80491 H2 WAT 7703 75.447 42.804 89.300 1.00 0.00 H TER 80493 WAT 7703 ATOM 80493 O WAT 7704 113.186 59.008 119.639 1.00 0.00 O ATOM 80494 H1 WAT 7704 113.013 59.243 120.551 1.00 0.00 H ATOM 80495 H2 WAT 7704 114.140 58.947 119.584 1.00 0.00 H TER 80497 WAT 7704 ATOM 80497 O WAT 7705 81.184 81.092 145.821 1.00 0.00 O ATOM 80498 H1 WAT 7705 81.432 81.136 146.745 1.00 0.00 H ATOM 80499 H2 WAT 7705 81.465 80.221 145.539 1.00 0.00 H TER 80501 WAT 7705 ATOM 80501 O WAT 7706 89.008 111.756 149.579 1.00 0.00 O ATOM 80502 H1 WAT 7706 88.308 112.071 149.006 1.00 0.00 H ATOM 80503 H2 WAT 7706 89.035 112.390 150.295 1.00 0.00 H TER 80505 WAT 7706 ATOM 80505 O WAT 7707 8.761 23.542 84.766 1.00 0.00 O ATOM 80506 H1 WAT 7707 9.067 24.387 85.096 1.00 0.00 H ATOM 80507 H2 WAT 7707 8.857 22.945 85.508 1.00 0.00 H TER 80509 WAT 7707 ATOM 80509 O WAT 7708 69.879 18.333 55.732 1.00 0.00 O ATOM 80510 H1 WAT 7708 69.292 19.072 55.574 1.00 0.00 H ATOM 80511 H2 WAT 7708 70.330 18.203 54.897 1.00 0.00 H TER 80513 WAT 7708 ATOM 80513 O WAT 7709 39.661 7.779 138.899 1.00 0.00 O ATOM 80514 H1 WAT 7709 39.524 8.349 138.141 1.00 0.00 H ATOM 80515 H2 WAT 7709 40.347 8.214 139.405 1.00 0.00 H TER 80517 WAT 7709 ATOM 80517 O WAT 7710 2.417 23.216 124.815 1.00 0.00 O ATOM 80518 H1 WAT 7710 2.053 22.396 125.148 1.00 0.00 H ATOM 80519 H2 WAT 7710 1.679 23.825 124.819 1.00 0.00 H TER 80521 WAT 7710 ATOM 80521 O WAT 7711 4.411 48.416 84.214 1.00 0.00 O ATOM 80522 H1 WAT 7711 4.405 47.517 83.885 1.00 0.00 H ATOM 80523 H2 WAT 7711 3.998 48.928 83.519 1.00 0.00 H TER 80525 WAT 7711 ATOM 80525 O WAT 7712 65.464 93.888 73.354 1.00 0.00 O ATOM 80526 H1 WAT 7712 64.696 94.160 73.855 1.00 0.00 H ATOM 80527 H2 WAT 7712 65.116 93.638 72.498 1.00 0.00 H TER 80529 WAT 7712 ATOM 80529 O WAT 7713 115.543 35.308 5.789 1.00 0.00 O ATOM 80530 H1 WAT 7713 115.714 36.174 6.158 1.00 0.00 H ATOM 80531 H2 WAT 7713 115.100 34.832 6.491 1.00 0.00 H TER 80533 WAT 7713 ATOM 80533 O WAT 7714 66.205 58.784 20.549 1.00 0.00 O ATOM 80534 H1 WAT 7714 66.610 58.628 21.401 1.00 0.00 H ATOM 80535 H2 WAT 7714 66.090 57.911 20.174 1.00 0.00 H TER 80537 WAT 7714 ATOM 80537 O WAT 7715 108.998 43.105 115.313 1.00 0.00 O ATOM 80538 H1 WAT 7715 109.811 43.137 114.808 1.00 0.00 H ATOM 80539 H2 WAT 7715 108.459 42.457 114.860 1.00 0.00 H TER 80541 WAT 7715 ATOM 80541 O WAT 7716 1.593 73.247 140.426 1.00 0.00 O ATOM 80542 H1 WAT 7716 1.266 74.103 140.702 1.00 0.00 H ATOM 80543 H2 WAT 7716 0.993 72.620 140.831 1.00 0.00 H TER 80545 WAT 7716 ATOM 80545 O WAT 7717 112.473 63.623 135.828 1.00 0.00 O ATOM 80546 H1 WAT 7717 113.311 63.163 135.782 1.00 0.00 H ATOM 80547 H2 WAT 7717 112.705 64.550 135.770 1.00 0.00 H TER 80549 WAT 7717 ATOM 80549 O WAT 7718 92.708 102.331 64.098 1.00 0.00 O ATOM 80550 H1 WAT 7718 92.832 102.550 63.174 1.00 0.00 H ATOM 80551 H2 WAT 7718 92.637 101.377 64.111 1.00 0.00 H TER 80553 WAT 7718 ATOM 80553 O WAT 7719 126.548 114.997 125.480 1.00 0.00 O ATOM 80554 H1 WAT 7719 127.085 115.206 124.716 1.00 0.00 H ATOM 80555 H2 WAT 7719 125.647 115.084 125.170 1.00 0.00 H TER 80557 WAT 7719 ATOM 80557 O WAT 7720 99.293 124.889 91.623 1.00 0.00 O ATOM 80558 H1 WAT 7720 98.698 124.141 91.681 1.00 0.00 H ATOM 80559 H2 WAT 7720 99.224 125.180 90.714 1.00 0.00 H TER 80561 WAT 7720 ATOM 80561 O WAT 7721 142.275 63.428 152.943 1.00 0.00 O ATOM 80562 H1 WAT 7721 141.979 62.539 153.138 1.00 0.00 H ATOM 80563 H2 WAT 7721 142.722 63.352 152.100 1.00 0.00 H TER 80565 WAT 7721 ATOM 80565 O WAT 7722 121.771 35.773 93.050 1.00 0.00 O ATOM 80566 H1 WAT 7722 120.976 35.379 92.691 1.00 0.00 H ATOM 80567 H2 WAT 7722 121.565 36.705 93.124 1.00 0.00 H TER 80569 WAT 7722 ATOM 80569 O WAT 7723 88.626 116.792 7.881 1.00 0.00 O ATOM 80570 H1 WAT 7723 88.368 116.736 6.961 1.00 0.00 H ATOM 80571 H2 WAT 7723 87.800 116.884 8.357 1.00 0.00 H TER 80573 WAT 7723 ATOM 80573 O WAT 7724 25.014 41.113 101.908 1.00 0.00 O ATOM 80574 H1 WAT 7724 25.490 41.667 102.527 1.00 0.00 H ATOM 80575 H2 WAT 7724 24.637 41.727 101.279 1.00 0.00 H TER 80577 WAT 7724 ATOM 80577 O WAT 7725 129.560 61.856 103.948 1.00 0.00 O ATOM 80578 H1 WAT 7725 128.722 61.532 104.279 1.00 0.00 H ATOM 80579 H2 WAT 7725 130.084 61.066 103.811 1.00 0.00 H TER 80581 WAT 7725 ATOM 80581 O WAT 7726 97.457 77.393 21.470 1.00 0.00 O ATOM 80582 H1 WAT 7726 96.877 78.059 21.101 1.00 0.00 H ATOM 80583 H2 WAT 7726 97.038 76.561 21.251 1.00 0.00 H TER 80585 WAT 7726 ATOM 80585 O WAT 7727 145.020 93.286 139.455 1.00 0.00 O ATOM 80586 H1 WAT 7727 144.305 92.846 139.917 1.00 0.00 H ATOM 80587 H2 WAT 7727 144.854 94.219 139.591 1.00 0.00 H TER 80589 WAT 7727 ATOM 80589 O WAT 7728 9.910 121.125 102.379 1.00 0.00 O ATOM 80590 H1 WAT 7728 9.682 122.024 102.612 1.00 0.00 H ATOM 80591 H2 WAT 7728 10.036 120.684 103.219 1.00 0.00 H TER 80593 WAT 7728 ATOM 80593 O WAT 7729 131.485 12.521 22.588 1.00 0.00 O ATOM 80594 H1 WAT 7729 131.344 12.081 23.427 1.00 0.00 H ATOM 80595 H2 WAT 7729 132.325 12.184 22.278 1.00 0.00 H TER 80597 WAT 7729 ATOM 80597 O WAT 7730 53.175 48.671 151.329 1.00 0.00 O ATOM 80598 H1 WAT 7730 54.116 48.808 151.437 1.00 0.00 H ATOM 80599 H2 WAT 7730 53.041 48.666 150.381 1.00 0.00 H TER 80601 WAT 7730 ATOM 80601 O WAT 7731 90.914 18.863 118.232 1.00 0.00 O ATOM 80602 H1 WAT 7731 91.539 18.952 117.513 1.00 0.00 H ATOM 80603 H2 WAT 7731 90.971 19.695 118.703 1.00 0.00 H TER 80605 WAT 7731 ATOM 80605 O WAT 7732 67.807 140.237 134.125 1.00 0.00 O ATOM 80606 H1 WAT 7732 68.596 140.776 134.071 1.00 0.00 H ATOM 80607 H2 WAT 7732 67.367 140.371 133.286 1.00 0.00 H TER 80609 WAT 7732 ATOM 80609 O WAT 7733 19.126 69.574 76.803 1.00 0.00 O ATOM 80610 H1 WAT 7733 19.830 69.154 76.308 1.00 0.00 H ATOM 80611 H2 WAT 7733 18.973 68.988 77.545 1.00 0.00 H TER 80613 WAT 7733 ATOM 80613 O WAT 7734 70.577 78.260 152.103 1.00 0.00 O ATOM 80614 H1 WAT 7734 71.029 79.101 152.152 1.00 0.00 H ATOM 80615 H2 WAT 7734 70.844 77.797 152.897 1.00 0.00 H TER 80617 WAT 7734 ATOM 80617 O WAT 7735 92.859 26.215 75.964 1.00 0.00 O ATOM 80618 H1 WAT 7735 92.350 26.336 76.765 1.00 0.00 H ATOM 80619 H2 WAT 7735 93.000 25.269 75.910 1.00 0.00 H TER 80621 WAT 7735 ATOM 80621 O WAT 7736 29.521 61.539 68.785 1.00 0.00 O ATOM 80622 H1 WAT 7736 30.256 62.139 68.658 1.00 0.00 H ATOM 80623 H2 WAT 7736 29.772 61.011 69.544 1.00 0.00 H TER 80625 WAT 7736 ATOM 80625 O WAT 7737 0.932 39.833 103.026 1.00 0.00 O ATOM 80626 H1 WAT 7737 0.803 38.988 103.456 1.00 0.00 H ATOM 80627 H2 WAT 7737 1.418 39.624 102.228 1.00 0.00 H TER 80629 WAT 7737 ATOM 80629 O WAT 7738 78.467 89.628 67.798 1.00 0.00 O ATOM 80630 H1 WAT 7738 78.891 90.106 67.086 1.00 0.00 H ATOM 80631 H2 WAT 7738 77.576 89.977 67.824 1.00 0.00 H TER 80633 WAT 7738 ATOM 80633 O WAT 7739 68.355 128.274 0.605 1.00 0.00 O ATOM 80634 H1 WAT 7739 67.911 127.528 1.007 1.00 0.00 H ATOM 80635 H2 WAT 7739 67.650 128.882 0.384 1.00 0.00 H TER 80637 WAT 7739 ATOM 80637 O WAT 7740 67.416 71.310 148.120 1.00 0.00 O ATOM 80638 H1 WAT 7740 66.866 72.093 148.103 1.00 0.00 H ATOM 80639 H2 WAT 7740 66.909 70.673 148.624 1.00 0.00 H TER 80641 WAT 7740 ATOM 80641 O WAT 7741 142.110 32.264 118.625 1.00 0.00 O ATOM 80642 H1 WAT 7741 141.541 31.556 118.927 1.00 0.00 H ATOM 80643 H2 WAT 7741 142.989 31.887 118.636 1.00 0.00 H TER 80645 WAT 7741 ATOM 80645 O WAT 7742 69.905 25.881 58.001 1.00 0.00 O ATOM 80646 H1 WAT 7742 70.634 26.439 58.273 1.00 0.00 H ATOM 80647 H2 WAT 7742 70.202 24.991 58.190 1.00 0.00 H TER 80649 WAT 7742 ATOM 80649 O WAT 7743 107.855 55.318 7.256 1.00 0.00 O ATOM 80650 H1 WAT 7743 107.723 54.810 8.056 1.00 0.00 H ATOM 80651 H2 WAT 7743 107.020 55.767 7.117 1.00 0.00 H TER 80653 WAT 7743 ATOM 80653 O WAT 7744 73.047 116.820 86.364 1.00 0.00 O ATOM 80654 H1 WAT 7744 73.589 117.578 86.585 1.00 0.00 H ATOM 80655 H2 WAT 7744 73.409 116.106 86.888 1.00 0.00 H TER 80657 WAT 7744 ATOM 80657 O WAT 7745 137.425 32.139 13.727 1.00 0.00 O ATOM 80658 H1 WAT 7745 136.532 32.412 13.940 1.00 0.00 H ATOM 80659 H2 WAT 7745 137.329 31.591 12.948 1.00 0.00 H TER 80661 WAT 7745 ATOM 80661 O WAT 7746 100.765 1.716 122.417 1.00 0.00 O ATOM 80662 H1 WAT 7746 101.189 1.073 122.984 1.00 0.00 H ATOM 80663 H2 WAT 7746 100.548 1.229 121.621 1.00 0.00 H TER 80665 WAT 7746 ATOM 80665 O WAT 7747 107.157 47.127 154.527 1.00 0.00 O ATOM 80666 H1 WAT 7747 107.131 47.527 155.396 1.00 0.00 H ATOM 80667 H2 WAT 7747 107.585 46.282 154.664 1.00 0.00 H TER 80669 WAT 7747 ATOM 80669 O WAT 7748 2.250 101.068 52.642 1.00 0.00 O ATOM 80670 H1 WAT 7748 2.384 101.711 51.946 1.00 0.00 H ATOM 80671 H2 WAT 7748 2.953 101.242 53.268 1.00 0.00 H TER 80673 WAT 7748 ATOM 80673 O WAT 7749 21.418 95.337 13.605 1.00 0.00 O ATOM 80674 H1 WAT 7749 20.467 95.249 13.540 1.00 0.00 H ATOM 80675 H2 WAT 7749 21.611 96.175 13.186 1.00 0.00 H TER 80677 WAT 7749 ATOM 80677 O WAT 7750 24.053 15.325 95.914 1.00 0.00 O ATOM 80678 H1 WAT 7750 23.929 15.049 95.006 1.00 0.00 H ATOM 80679 H2 WAT 7750 23.365 14.869 96.399 1.00 0.00 H TER 80681 WAT 7750 ATOM 80681 O WAT 7751 114.459 67.869 130.008 1.00 0.00 O ATOM 80682 H1 WAT 7751 113.778 67.534 129.425 1.00 0.00 H ATOM 80683 H2 WAT 7751 114.408 67.308 130.782 1.00 0.00 H TER 80685 WAT 7751 ATOM 80685 O WAT 7752 17.827 137.169 16.852 1.00 0.00 O ATOM 80686 H1 WAT 7752 18.036 136.343 17.287 1.00 0.00 H ATOM 80687 H2 WAT 7752 17.079 137.514 17.340 1.00 0.00 H TER 80689 WAT 7752 ATOM 80689 O WAT 7753 126.477 20.714 124.908 1.00 0.00 O ATOM 80690 H1 WAT 7753 127.086 21.396 124.624 1.00 0.00 H ATOM 80691 H2 WAT 7753 126.085 21.061 125.709 1.00 0.00 H TER 80693 WAT 7753 ATOM 80693 O WAT 7754 108.136 114.395 26.569 1.00 0.00 O ATOM 80694 H1 WAT 7754 107.682 114.983 25.965 1.00 0.00 H ATOM 80695 H2 WAT 7754 107.677 114.505 27.401 1.00 0.00 H TER 80697 WAT 7754 ATOM 80697 O WAT 7755 131.374 106.155 62.206 1.00 0.00 O ATOM 80698 H1 WAT 7755 130.457 106.358 62.390 1.00 0.00 H ATOM 80699 H2 WAT 7755 131.842 106.970 62.390 1.00 0.00 H TER 80701 WAT 7755 ATOM 80701 O WAT 7756 76.566 79.991 157.157 1.00 0.00 O ATOM 80702 H1 WAT 7756 76.510 80.111 158.105 1.00 0.00 H ATOM 80703 H2 WAT 7756 77.191 79.275 157.042 1.00 0.00 H TER 80705 WAT 7756 ATOM 80705 O WAT 7757 138.408 12.823 62.925 1.00 0.00 O ATOM 80706 H1 WAT 7757 138.191 12.153 62.277 1.00 0.00 H ATOM 80707 H2 WAT 7757 138.617 12.330 63.718 1.00 0.00 H TER 80709 WAT 7757 ATOM 80709 O WAT 7758 31.947 70.273 126.727 1.00 0.00 O ATOM 80710 H1 WAT 7758 32.604 70.957 126.602 1.00 0.00 H ATOM 80711 H2 WAT 7758 31.225 70.714 127.174 1.00 0.00 H TER 80713 WAT 7758 ATOM 80713 O WAT 7759 139.239 137.387 15.488 1.00 0.00 O ATOM 80714 H1 WAT 7759 138.498 137.688 14.962 1.00 0.00 H ATOM 80715 H2 WAT 7759 139.760 138.175 15.642 1.00 0.00 H TER 80717 WAT 7759 ATOM 80717 O WAT 7760 76.509 41.772 137.615 1.00 0.00 O ATOM 80718 H1 WAT 7760 77.257 42.070 138.132 1.00 0.00 H ATOM 80719 H2 WAT 7760 76.769 40.908 137.294 1.00 0.00 H TER 80721 WAT 7760 ATOM 80721 O WAT 7761 139.106 110.772 61.504 1.00 0.00 O ATOM 80722 H1 WAT 7761 138.198 111.034 61.347 1.00 0.00 H ATOM 80723 H2 WAT 7761 139.362 110.307 60.708 1.00 0.00 H TER 80725 WAT 7761 ATOM 80725 O WAT 7762 54.394 113.074 4.310 1.00 0.00 O ATOM 80726 H1 WAT 7762 53.820 112.323 4.165 1.00 0.00 H ATOM 80727 H2 WAT 7762 54.482 113.478 3.446 1.00 0.00 H TER 80729 WAT 7762 ATOM 80729 O WAT 7763 40.179 84.985 121.357 1.00 0.00 O ATOM 80730 H1 WAT 7763 40.385 84.052 121.401 1.00 0.00 H ATOM 80731 H2 WAT 7763 40.760 85.389 122.001 1.00 0.00 H TER 80733 WAT 7763 ATOM 80733 O WAT 7764 142.765 135.342 100.923 1.00 0.00 O ATOM 80734 H1 WAT 7764 141.854 135.174 101.162 1.00 0.00 H ATOM 80735 H2 WAT 7764 143.272 134.757 101.485 1.00 0.00 H TER 80737 WAT 7764 ATOM 80737 O WAT 7765 57.340 47.359 20.191 1.00 0.00 O ATOM 80738 H1 WAT 7765 57.512 47.244 21.125 1.00 0.00 H ATOM 80739 H2 WAT 7765 56.496 47.810 20.157 1.00 0.00 H TER 80741 WAT 7765 ATOM 80741 O WAT 7766 86.419 92.947 82.140 1.00 0.00 O ATOM 80742 H1 WAT 7766 87.002 92.340 81.685 1.00 0.00 H ATOM 80743 H2 WAT 7766 85.717 92.393 82.482 1.00 0.00 H TER 80745 WAT 7766 ATOM 80745 O WAT 7767 138.331 12.485 17.627 1.00 0.00 O ATOM 80746 H1 WAT 7767 138.170 13.425 17.541 1.00 0.00 H ATOM 80747 H2 WAT 7767 138.953 12.414 18.351 1.00 0.00 H TER 80749 WAT 7767 ATOM 80749 O WAT 7768 134.327 143.968 81.859 1.00 0.00 O ATOM 80750 H1 WAT 7768 133.934 144.482 82.564 1.00 0.00 H ATOM 80751 H2 WAT 7768 133.719 144.063 81.125 1.00 0.00 H TER 80753 WAT 7768 ATOM 80753 O WAT 7769 49.090 113.827 124.969 1.00 0.00 O ATOM 80754 H1 WAT 7769 49.260 114.512 124.322 1.00 0.00 H ATOM 80755 H2 WAT 7769 48.776 114.299 125.741 1.00 0.00 H TER 80757 WAT 7769 ATOM 80757 O WAT 7770 77.286 124.187 133.485 1.00 0.00 O ATOM 80758 H1 WAT 7770 77.416 124.720 132.700 1.00 0.00 H ATOM 80759 H2 WAT 7770 78.126 124.225 133.942 1.00 0.00 H TER 80761 WAT 7770 ATOM 80761 O WAT 7771 67.303 141.776 18.944 1.00 0.00 O ATOM 80762 H1 WAT 7771 68.232 142.002 18.905 1.00 0.00 H ATOM 80763 H2 WAT 7771 67.118 141.682 19.878 1.00 0.00 H TER 80765 WAT 7771 ATOM 80765 O WAT 7772 12.005 73.098 100.537 1.00 0.00 O ATOM 80766 H1 WAT 7772 11.532 72.274 100.655 1.00 0.00 H ATOM 80767 H2 WAT 7772 11.401 73.769 100.857 1.00 0.00 H TER 80769 WAT 7772 ATOM 80769 O WAT 7773 66.812 133.733 126.010 1.00 0.00 O ATOM 80770 H1 WAT 7773 67.610 133.210 126.084 1.00 0.00 H ATOM 80771 H2 WAT 7773 66.946 134.264 125.224 1.00 0.00 H TER 80773 WAT 7773 ATOM 80773 O WAT 7774 31.664 20.682 128.591 1.00 0.00 O ATOM 80774 H1 WAT 7774 32.223 20.983 127.875 1.00 0.00 H ATOM 80775 H2 WAT 7774 31.170 19.951 128.218 1.00 0.00 H TER 80777 WAT 7774 ATOM 80777 O WAT 7775 143.212 142.027 107.835 1.00 0.00 O ATOM 80778 H1 WAT 7775 142.968 142.616 107.121 1.00 0.00 H ATOM 80779 H2 WAT 7775 142.614 142.254 108.547 1.00 0.00 H TER 80781 WAT 7775 ATOM 80781 O WAT 7776 45.126 44.032 77.217 1.00 0.00 O ATOM 80782 H1 WAT 7776 45.604 44.667 76.684 1.00 0.00 H ATOM 80783 H2 WAT 7776 44.883 43.338 76.604 1.00 0.00 H TER 80785 WAT 7776 ATOM 80785 O WAT 7777 74.054 35.801 6.213 1.00 0.00 O ATOM 80786 H1 WAT 7777 73.184 35.722 5.823 1.00 0.00 H ATOM 80787 H2 WAT 7777 74.655 35.763 5.469 1.00 0.00 H TER 80789 WAT 7777 ATOM 80789 O WAT 7778 129.030 8.630 0.228 1.00 0.00 O ATOM 80790 H1 WAT 7778 128.311 9.256 0.310 1.00 0.00 H ATOM 80791 H2 WAT 7778 129.642 9.045 -0.381 1.00 0.00 H TER 80793 WAT 7778 ATOM 80793 O WAT 7779 43.470 25.221 135.966 1.00 0.00 O ATOM 80794 H1 WAT 7779 43.365 25.252 136.917 1.00 0.00 H ATOM 80795 H2 WAT 7779 42.578 25.138 135.629 1.00 0.00 H TER 80797 WAT 7779 ATOM 80797 O WAT 7780 7.055 61.555 73.446 1.00 0.00 O ATOM 80798 H1 WAT 7780 6.768 60.658 73.272 1.00 0.00 H ATOM 80799 H2 WAT 7780 7.980 61.470 73.676 1.00 0.00 H TER 80801 WAT 7780 ATOM 80801 O WAT 7781 121.169 25.014 -0.095 1.00 0.00 O ATOM 80802 H1 WAT 7781 120.386 24.468 -0.156 1.00 0.00 H ATOM 80803 H2 WAT 7781 121.389 25.014 0.837 1.00 0.00 H TER 80805 WAT 7781 ATOM 80805 O WAT 7782 85.315 87.168 18.092 1.00 0.00 O ATOM 80806 H1 WAT 7782 86.008 87.174 17.431 1.00 0.00 H ATOM 80807 H2 WAT 7782 85.174 88.092 18.299 1.00 0.00 H TER 80809 WAT 7782 ATOM 80809 O WAT 7783 116.955 140.871 88.470 1.00 0.00 O ATOM 80810 H1 WAT 7783 117.091 141.220 87.589 1.00 0.00 H ATOM 80811 H2 WAT 7783 117.717 140.313 88.627 1.00 0.00 H TER 80813 WAT 7783 ATOM 80813 O WAT 7784 14.010 69.062 131.632 1.00 0.00 O ATOM 80814 H1 WAT 7784 14.557 69.393 130.919 1.00 0.00 H ATOM 80815 H2 WAT 7784 13.950 68.120 131.471 1.00 0.00 H TER 80817 WAT 7784 ATOM 80817 O WAT 7785 76.490 84.798 10.275 1.00 0.00 O ATOM 80818 H1 WAT 7785 77.241 84.281 9.983 1.00 0.00 H ATOM 80819 H2 WAT 7785 76.875 85.532 10.752 1.00 0.00 H TER 80821 WAT 7785 ATOM 80821 O WAT 7786 63.206 79.653 139.522 1.00 0.00 O ATOM 80822 H1 WAT 7786 62.514 79.673 140.184 1.00 0.00 H ATOM 80823 H2 WAT 7786 63.137 78.782 139.130 1.00 0.00 H TER 80825 WAT 7786 ATOM 80825 O WAT 7787 136.743 101.076 28.957 1.00 0.00 O ATOM 80826 H1 WAT 7787 136.890 101.263 28.030 1.00 0.00 H ATOM 80827 H2 WAT 7787 135.899 100.625 28.979 1.00 0.00 H TER 80829 WAT 7787 ATOM 80829 O WAT 7788 112.932 51.779 79.445 1.00 0.00 O ATOM 80830 H1 WAT 7788 112.064 51.789 79.847 1.00 0.00 H ATOM 80831 H2 WAT 7788 112.763 51.875 78.507 1.00 0.00 H TER 80833 WAT 7788 ATOM 80833 O WAT 7789 80.352 72.644 154.322 1.00 0.00 O ATOM 80834 H1 WAT 7789 79.736 72.904 153.637 1.00 0.00 H ATOM 80835 H2 WAT 7789 79.805 72.501 155.094 1.00 0.00 H TER 80837 WAT 7789 ATOM 80837 O WAT 7790 107.469 3.396 8.748 1.00 0.00 O ATOM 80838 H1 WAT 7790 107.043 3.855 8.024 1.00 0.00 H ATOM 80839 H2 WAT 7790 106.822 3.409 9.453 1.00 0.00 H TER 80841 WAT 7790 ATOM 80841 O WAT 7791 132.992 138.625 13.745 1.00 0.00 O ATOM 80842 H1 WAT 7791 133.244 137.978 14.404 1.00 0.00 H ATOM 80843 H2 WAT 7791 133.114 139.469 14.179 1.00 0.00 H TER 80845 WAT 7791 ATOM 80845 O WAT 7792 61.561 118.156 154.037 1.00 0.00 O ATOM 80846 H1 WAT 7792 60.656 117.843 154.057 1.00 0.00 H ATOM 80847 H2 WAT 7792 62.053 117.440 153.636 1.00 0.00 H TER 80849 WAT 7792 ATOM 80849 O WAT 7793 117.458 102.075 114.685 1.00 0.00 O ATOM 80850 H1 WAT 7793 117.593 101.446 113.977 1.00 0.00 H ATOM 80851 H2 WAT 7793 117.760 102.909 114.325 1.00 0.00 H TER 80853 WAT 7793 ATOM 80853 O WAT 7794 105.482 22.997 6.280 1.00 0.00 O ATOM 80854 H1 WAT 7794 105.696 22.322 5.636 1.00 0.00 H ATOM 80855 H2 WAT 7794 104.613 22.754 6.600 1.00 0.00 H TER 80857 WAT 7794 ATOM 80857 O WAT 7795 120.488 14.635 81.170 1.00 0.00 O ATOM 80858 H1 WAT 7795 121.040 14.331 81.890 1.00 0.00 H ATOM 80859 H2 WAT 7795 119.597 14.593 81.517 1.00 0.00 H TER 80861 WAT 7795 ATOM 80861 O WAT 7796 77.763 35.365 74.786 1.00 0.00 O ATOM 80862 H1 WAT 7796 78.596 35.265 74.327 1.00 0.00 H ATOM 80863 H2 WAT 7796 77.940 36.019 75.463 1.00 0.00 H TER 80865 WAT 7796 ATOM 80865 O WAT 7797 36.703 43.256 8.291 1.00 0.00 O ATOM 80866 H1 WAT 7797 37.335 43.421 7.591 1.00 0.00 H ATOM 80867 H2 WAT 7797 35.855 43.472 7.903 1.00 0.00 H TER 80869 WAT 7797 ATOM 80869 O WAT 7798 48.764 61.368 103.589 1.00 0.00 O ATOM 80870 H1 WAT 7798 47.954 60.930 103.328 1.00 0.00 H ATOM 80871 H2 WAT 7798 48.573 61.730 104.455 1.00 0.00 H TER 80873 WAT 7798 ATOM 80873 O WAT 7799 58.023 81.357 68.817 1.00 0.00 O ATOM 80874 H1 WAT 7799 57.090 81.524 68.686 1.00 0.00 H ATOM 80875 H2 WAT 7799 58.154 80.465 68.494 1.00 0.00 H TER 80877 WAT 7799 ATOM 80877 O WAT 7800 67.771 136.847 153.869 1.00 0.00 O ATOM 80878 H1 WAT 7800 67.905 137.595 154.450 1.00 0.00 H ATOM 80879 H2 WAT 7800 66.941 136.466 154.156 1.00 0.00 H TER 80881 WAT 7800 ATOM 80881 O WAT 7801 39.255 101.681 141.742 1.00 0.00 O ATOM 80882 H1 WAT 7801 38.451 101.771 141.230 1.00 0.00 H ATOM 80883 H2 WAT 7801 39.950 101.959 141.146 1.00 0.00 H TER 80885 WAT 7801 ATOM 80885 O WAT 7802 135.220 142.069 94.592 1.00 0.00 O ATOM 80886 H1 WAT 7802 135.012 142.953 94.290 1.00 0.00 H ATOM 80887 H2 WAT 7802 135.179 141.529 93.803 1.00 0.00 H TER 80889 WAT 7802 ATOM 80889 O WAT 7803 98.080 15.524 67.849 1.00 0.00 O ATOM 80890 H1 WAT 7803 98.481 14.657 67.915 1.00 0.00 H ATOM 80891 H2 WAT 7803 98.120 15.874 68.740 1.00 0.00 H TER 80893 WAT 7803 ATOM 80893 O WAT 7804 118.812 121.678 155.947 1.00 0.00 O ATOM 80894 H1 WAT 7804 118.805 122.582 155.634 1.00 0.00 H ATOM 80895 H2 WAT 7804 117.888 121.433 155.990 1.00 0.00 H TER 80897 WAT 7804 ATOM 80897 O WAT 7805 10.427 39.046 127.258 1.00 0.00 O ATOM 80898 H1 WAT 7805 11.070 39.483 127.816 1.00 0.00 H ATOM 80899 H2 WAT 7805 9.584 39.402 127.540 1.00 0.00 H TER 80901 WAT 7805 ATOM 80901 O WAT 7806 87.563 143.726 113.679 1.00 0.00 O ATOM 80902 H1 WAT 7806 87.739 143.247 112.869 1.00 0.00 H ATOM 80903 H2 WAT 7806 87.771 143.102 114.375 1.00 0.00 H TER 80905 WAT 7806 ATOM 80905 O WAT 7807 103.997 128.796 154.162 1.00 0.00 O ATOM 80906 H1 WAT 7807 103.849 127.932 153.777 1.00 0.00 H ATOM 80907 H2 WAT 7807 104.332 128.613 155.040 1.00 0.00 H TER 80909 WAT 7807 ATOM 80909 O WAT 7808 2.891 62.186 2.898 1.00 0.00 O ATOM 80910 H1 WAT 7808 2.972 61.350 2.439 1.00 0.00 H ATOM 80911 H2 WAT 7808 3.254 62.017 3.767 1.00 0.00 H TER 80913 WAT 7808 ATOM 80913 O WAT 7809 12.080 7.721 105.884 1.00 0.00 O ATOM 80914 H1 WAT 7809 11.881 8.563 105.476 1.00 0.00 H ATOM 80915 H2 WAT 7809 11.870 7.847 106.810 1.00 0.00 H TER 80917 WAT 7809 ATOM 80917 O WAT 7810 38.793 77.135 132.958 1.00 0.00 O ATOM 80918 H1 WAT 7810 39.626 77.082 133.427 1.00 0.00 H ATOM 80919 H2 WAT 7810 38.640 76.245 132.641 1.00 0.00 H TER 80921 WAT 7810 ATOM 80921 O WAT 7811 48.786 138.916 24.287 1.00 0.00 O ATOM 80922 H1 WAT 7811 48.347 138.194 23.837 1.00 0.00 H ATOM 80923 H2 WAT 7811 48.350 139.702 23.960 1.00 0.00 H TER 80925 WAT 7811 ATOM 80925 O WAT 7812 122.202 30.125 111.431 1.00 0.00 O ATOM 80926 H1 WAT 7812 121.782 30.370 112.256 1.00 0.00 H ATOM 80927 H2 WAT 7812 122.938 29.572 111.692 1.00 0.00 H TER 80929 WAT 7812 ATOM 80929 O WAT 7813 72.753 73.755 21.695 1.00 0.00 O ATOM 80930 H1 WAT 7813 72.523 73.365 22.538 1.00 0.00 H ATOM 80931 H2 WAT 7813 72.917 74.676 21.894 1.00 0.00 H TER 80933 WAT 7813 ATOM 80933 O WAT 7814 25.582 108.286 86.264 1.00 0.00 O ATOM 80934 H1 WAT 7814 25.939 109.050 86.716 1.00 0.00 H ATOM 80935 H2 WAT 7814 24.851 108.002 86.813 1.00 0.00 H TER 80937 WAT 7814 ATOM 80937 O WAT 7815 47.012 67.511 118.185 1.00 0.00 O ATOM 80938 H1 WAT 7815 46.492 68.278 118.424 1.00 0.00 H ATOM 80939 H2 WAT 7815 47.429 67.240 119.003 1.00 0.00 H TER 80941 WAT 7815 ATOM 80941 O WAT 7816 1.929 122.473 119.762 1.00 0.00 O ATOM 80942 H1 WAT 7816 2.374 122.077 120.511 1.00 0.00 H ATOM 80943 H2 WAT 7816 2.345 123.329 119.661 1.00 0.00 H TER 80945 WAT 7816 ATOM 80945 O WAT 7817 49.397 144.092 111.365 1.00 0.00 O ATOM 80946 H1 WAT 7817 48.531 144.091 111.773 1.00 0.00 H ATOM 80947 H2 WAT 7817 49.925 144.661 111.925 1.00 0.00 H TER 80949 WAT 7817 ATOM 80949 O WAT 7818 58.178 36.421 110.117 1.00 0.00 O ATOM 80950 H1 WAT 7818 57.886 35.970 109.325 1.00 0.00 H ATOM 80951 H2 WAT 7818 57.451 37.000 110.345 1.00 0.00 H TER 80953 WAT 7818 ATOM 80953 O WAT 7819 109.658 101.639 108.129 1.00 0.00 O ATOM 80954 H1 WAT 7819 110.448 102.026 107.751 1.00 0.00 H ATOM 80955 H2 WAT 7819 108.937 102.100 107.701 1.00 0.00 H TER 80957 WAT 7819 ATOM 80957 O WAT 7820 116.773 61.045 143.539 1.00 0.00 O ATOM 80958 H1 WAT 7820 117.366 61.134 144.285 1.00 0.00 H ATOM 80959 H2 WAT 7820 116.624 61.943 143.243 1.00 0.00 H TER 80961 WAT 7820 ATOM 80961 O WAT 7821 131.175 80.437 132.389 1.00 0.00 O ATOM 80962 H1 WAT 7821 131.281 79.692 131.796 1.00 0.00 H ATOM 80963 H2 WAT 7821 131.401 80.090 133.252 1.00 0.00 H TER 80965 WAT 7821 ATOM 80965 O WAT 7822 28.570 132.833 8.610 1.00 0.00 O ATOM 80966 H1 WAT 7822 29.427 133.086 8.266 1.00 0.00 H ATOM 80967 H2 WAT 7822 27.954 133.420 8.172 1.00 0.00 H TER 80969 WAT 7822 ATOM 80969 O WAT 7823 6.597 41.083 139.434 1.00 0.00 O ATOM 80970 H1 WAT 7823 7.522 41.003 139.669 1.00 0.00 H ATOM 80971 H2 WAT 7823 6.126 40.800 140.218 1.00 0.00 H TER 80973 WAT 7823 ATOM 80973 O WAT 7824 100.222 77.781 111.149 1.00 0.00 O ATOM 80974 H1 WAT 7824 99.288 77.804 110.941 1.00 0.00 H ATOM 80975 H2 WAT 7824 100.324 77.006 111.702 1.00 0.00 H TER 80977 WAT 7824 ATOM 80977 O WAT 7825 25.733 24.873 89.356 1.00 0.00 O ATOM 80978 H1 WAT 7825 25.969 25.770 89.119 1.00 0.00 H ATOM 80979 H2 WAT 7825 26.109 24.334 88.660 1.00 0.00 H TER 80981 WAT 7825 ATOM 80981 O WAT 7826 35.038 47.098 135.678 1.00 0.00 O ATOM 80982 H1 WAT 7826 34.523 46.502 136.223 1.00 0.00 H ATOM 80983 H2 WAT 7826 34.405 47.463 135.059 1.00 0.00 H TER 80985 WAT 7826 ATOM 80985 O WAT 7827 67.192 53.282 0.712 1.00 0.00 O ATOM 80986 H1 WAT 7827 67.161 53.524 1.637 1.00 0.00 H ATOM 80987 H2 WAT 7827 67.877 53.839 0.341 1.00 0.00 H TER 80989 WAT 7827 ATOM 80989 O WAT 7828 38.188 145.406 25.336 1.00 0.00 O ATOM 80990 H1 WAT 7828 37.402 144.933 25.062 1.00 0.00 H ATOM 80991 H2 WAT 7828 38.023 146.313 25.078 1.00 0.00 H TER 80993 WAT 7828 ATOM 80993 O WAT 7829 52.834 42.993 117.953 1.00 0.00 O ATOM 80994 H1 WAT 7829 53.527 42.340 117.858 1.00 0.00 H ATOM 80995 H2 WAT 7829 53.290 43.834 117.916 1.00 0.00 H TER 80997 WAT 7829 ATOM 80997 O WAT 7830 107.329 115.630 74.257 1.00 0.00 O ATOM 80998 H1 WAT 7830 106.598 116.224 74.087 1.00 0.00 H ATOM 80999 H2 WAT 7830 108.028 115.941 73.682 1.00 0.00 H TER 81001 WAT 7830 ATOM 81001 O WAT 7831 62.440 42.658 2.133 1.00 0.00 O ATOM 81002 H1 WAT 7831 62.062 41.789 2.003 1.00 0.00 H ATOM 81003 H2 WAT 7831 61.884 43.242 1.617 1.00 0.00 H TER 81005 WAT 7831 ATOM 81005 O WAT 7832 35.313 102.611 22.434 1.00 0.00 O ATOM 81006 H1 WAT 7832 35.722 103.449 22.219 1.00 0.00 H ATOM 81007 H2 WAT 7832 35.272 102.603 23.390 1.00 0.00 H TER 81009 WAT 7832 ATOM 81009 O WAT 7833 0.329 7.060 103.980 1.00 0.00 O ATOM 81010 H1 WAT 7833 0.683 7.909 104.243 1.00 0.00 H ATOM 81011 H2 WAT 7833 -0.610 7.127 104.153 1.00 0.00 H TER 81013 WAT 7833 ATOM 81013 O WAT 7834 85.201 139.193 81.684 1.00 0.00 O ATOM 81014 H1 WAT 7834 86.087 139.370 82.001 1.00 0.00 H ATOM 81015 H2 WAT 7834 85.282 138.379 81.188 1.00 0.00 H TER 81017 WAT 7834 ATOM 81017 O WAT 7835 112.253 61.028 78.464 1.00 0.00 O ATOM 81018 H1 WAT 7835 112.846 60.298 78.283 1.00 0.00 H ATOM 81019 H2 WAT 7835 111.417 60.758 78.085 1.00 0.00 H TER 81021 WAT 7835 ATOM 81021 O WAT 7836 67.795 124.125 142.561 1.00 0.00 O ATOM 81022 H1 WAT 7836 67.603 124.151 143.498 1.00 0.00 H ATOM 81023 H2 WAT 7836 67.908 123.195 142.365 1.00 0.00 H TER 81025 WAT 7836 ATOM 81025 O WAT 7837 69.271 129.741 68.172 1.00 0.00 O ATOM 81026 H1 WAT 7837 69.353 129.134 67.435 1.00 0.00 H ATOM 81027 H2 WAT 7837 68.592 129.355 68.726 1.00 0.00 H TER 81029 WAT 7837 ATOM 81029 O WAT 7838 59.691 91.816 109.069 1.00 0.00 O ATOM 81030 H1 WAT 7838 58.909 92.333 109.264 1.00 0.00 H ATOM 81031 H2 WAT 7838 59.633 91.639 108.130 1.00 0.00 H TER 81033 WAT 7838 ATOM 81033 O WAT 7839 119.588 73.695 130.360 1.00 0.00 O ATOM 81034 H1 WAT 7839 118.995 73.489 129.637 1.00 0.00 H ATOM 81035 H2 WAT 7839 119.115 73.415 131.144 1.00 0.00 H TER 81037 WAT 7839 ATOM 81037 O WAT 7840 18.194 81.792 99.543 1.00 0.00 O ATOM 81038 H1 WAT 7840 17.408 81.791 100.089 1.00 0.00 H ATOM 81039 H2 WAT 7840 18.902 81.559 100.143 1.00 0.00 H TER 81041 WAT 7840 ATOM 81041 O WAT 7841 21.874 27.176 5.697 1.00 0.00 O ATOM 81042 H1 WAT 7841 22.665 27.696 5.834 1.00 0.00 H ATOM 81043 H2 WAT 7841 21.425 27.608 4.971 1.00 0.00 H TER 81045 WAT 7841 ATOM 81045 O WAT 7842 15.922 79.993 141.566 1.00 0.00 O ATOM 81046 H1 WAT 7842 16.737 79.568 141.301 1.00 0.00 H ATOM 81047 H2 WAT 7842 15.535 79.392 142.203 1.00 0.00 H TER 81049 WAT 7842 ATOM 81049 O WAT 7843 30.530 73.631 93.045 1.00 0.00 O ATOM 81050 H1 WAT 7843 31.464 73.545 93.235 1.00 0.00 H ATOM 81051 H2 WAT 7843 30.160 72.778 93.272 1.00 0.00 H TER 81053 WAT 7843 ATOM 81053 O WAT 7844 6.249 76.153 93.243 1.00 0.00 O ATOM 81054 H1 WAT 7844 6.766 75.408 93.549 1.00 0.00 H ATOM 81055 H2 WAT 7844 6.755 76.513 92.515 1.00 0.00 H TER 81057 WAT 7844 ATOM 81057 O WAT 7845 110.055 121.758 1.656 1.00 0.00 O ATOM 81058 H1 WAT 7845 110.901 121.977 1.265 1.00 0.00 H ATOM 81059 H2 WAT 7845 110.248 121.036 2.255 1.00 0.00 H TER 81061 WAT 7845 ATOM 81061 O WAT 7846 68.201 86.769 110.230 1.00 0.00 O ATOM 81062 H1 WAT 7846 68.617 86.001 109.840 1.00 0.00 H ATOM 81063 H2 WAT 7846 67.271 86.665 110.031 1.00 0.00 H TER 81065 WAT 7846 ATOM 81065 O WAT 7847 17.206 8.438 69.011 1.00 0.00 O ATOM 81066 H1 WAT 7847 16.824 7.765 68.448 1.00 0.00 H ATOM 81067 H2 WAT 7847 18.118 8.169 69.120 1.00 0.00 H TER 81069 WAT 7847 ATOM 81069 O WAT 7848 70.523 119.541 97.863 1.00 0.00 O ATOM 81070 H1 WAT 7848 71.012 119.381 98.670 1.00 0.00 H ATOM 81071 H2 WAT 7848 69.995 120.317 98.052 1.00 0.00 H TER 81073 WAT 7848 ATOM 81073 O WAT 7849 11.527 87.119 77.455 1.00 0.00 O ATOM 81074 H1 WAT 7849 12.093 87.472 78.141 1.00 0.00 H ATOM 81075 H2 WAT 7849 11.535 86.173 77.600 1.00 0.00 H TER 81077 WAT 7849 ATOM 81077 O WAT 7850 25.832 20.061 78.134 1.00 0.00 O ATOM 81078 H1 WAT 7850 25.711 20.665 78.867 1.00 0.00 H ATOM 81079 H2 WAT 7850 26.152 19.255 78.539 1.00 0.00 H TER 81081 WAT 7850 ATOM 81081 O WAT 7851 30.371 25.372 119.071 1.00 0.00 O ATOM 81082 H1 WAT 7851 29.447 25.457 119.303 1.00 0.00 H ATOM 81083 H2 WAT 7851 30.483 24.444 118.868 1.00 0.00 H TER 81085 WAT 7851 ATOM 81085 O WAT 7852 2.632 53.627 123.544 1.00 0.00 O ATOM 81086 H1 WAT 7852 3.517 53.879 123.279 1.00 0.00 H ATOM 81087 H2 WAT 7852 2.065 54.284 123.141 1.00 0.00 H TER 81089 WAT 7852 ATOM 81089 O WAT 7853 46.851 23.362 154.146 1.00 0.00 O ATOM 81090 H1 WAT 7853 47.367 23.322 153.341 1.00 0.00 H ATOM 81091 H2 WAT 7853 46.305 22.576 154.121 1.00 0.00 H TER 81093 WAT 7853 ATOM 81093 O WAT 7854 65.165 129.630 65.949 1.00 0.00 O ATOM 81094 H1 WAT 7854 65.527 130.495 65.757 1.00 0.00 H ATOM 81095 H2 WAT 7854 65.836 129.018 65.647 1.00 0.00 H TER 81097 WAT 7854 ATOM 81097 O WAT 7855 144.882 65.413 128.868 1.00 0.00 O ATOM 81098 H1 WAT 7855 145.089 65.022 129.716 1.00 0.00 H ATOM 81099 H2 WAT 7855 145.309 64.841 128.230 1.00 0.00 H TER 81101 WAT 7855 ATOM 81101 O WAT 7856 32.980 24.425 124.275 1.00 0.00 O ATOM 81102 H1 WAT 7856 32.487 25.216 124.496 1.00 0.00 H ATOM 81103 H2 WAT 7856 33.559 24.287 125.025 1.00 0.00 H TER 81105 WAT 7856 ATOM 81105 O WAT 7857 69.454 91.667 107.957 1.00 0.00 O ATOM 81106 H1 WAT 7857 68.613 91.654 107.501 1.00 0.00 H ATOM 81107 H2 WAT 7857 70.054 91.211 107.366 1.00 0.00 H TER 81109 WAT 7857 ATOM 81109 O WAT 7858 17.514 58.987 98.780 1.00 0.00 O ATOM 81110 H1 WAT 7858 17.788 59.193 99.673 1.00 0.00 H ATOM 81111 H2 WAT 7858 16.600 58.716 98.866 1.00 0.00 H TER 81113 WAT 7858 ATOM 81113 O WAT 7859 54.586 109.550 135.201 1.00 0.00 O ATOM 81114 H1 WAT 7859 55.025 109.966 134.459 1.00 0.00 H ATOM 81115 H2 WAT 7859 55.284 109.090 135.666 1.00 0.00 H TER 81117 WAT 7859 ATOM 81117 O WAT 7860 80.822 113.150 60.471 1.00 0.00 O ATOM 81118 H1 WAT 7860 81.232 112.576 59.824 1.00 0.00 H ATOM 81119 H2 WAT 7860 81.555 113.612 60.879 1.00 0.00 H TER 81121 WAT 7860 ATOM 81121 O WAT 7861 28.510 96.795 128.012 1.00 0.00 O ATOM 81122 H1 WAT 7861 28.039 97.628 128.033 1.00 0.00 H ATOM 81123 H2 WAT 7861 29.097 96.833 128.768 1.00 0.00 H TER 81125 WAT 7861 ATOM 81125 O WAT 7862 23.180 108.447 69.233 1.00 0.00 O ATOM 81126 H1 WAT 7862 22.616 107.675 69.278 1.00 0.00 H ATOM 81127 H2 WAT 7862 22.719 109.047 68.647 1.00 0.00 H TER 81129 WAT 7862 ATOM 81129 O WAT 7863 74.428 25.116 144.159 1.00 0.00 O ATOM 81130 H1 WAT 7863 73.934 25.418 143.397 1.00 0.00 H ATOM 81131 H2 WAT 7863 74.964 25.869 144.410 1.00 0.00 H TER 81133 WAT 7863 ATOM 81133 O WAT 7864 51.404 58.219 9.792 1.00 0.00 O ATOM 81134 H1 WAT 7864 52.001 58.179 9.045 1.00 0.00 H ATOM 81135 H2 WAT 7864 51.473 59.120 10.107 1.00 0.00 H TER 81137 WAT 7864 ATOM 81137 O WAT 7865 55.555 104.528 13.535 1.00 0.00 O ATOM 81138 H1 WAT 7865 55.725 104.455 14.474 1.00 0.00 H ATOM 81139 H2 WAT 7865 54.891 105.214 13.464 1.00 0.00 H TER 81141 WAT 7865 ATOM 81141 O WAT 7866 17.729 142.629 74.259 1.00 0.00 O ATOM 81142 H1 WAT 7866 18.555 143.112 74.262 1.00 0.00 H ATOM 81143 H2 WAT 7866 17.782 142.058 75.025 1.00 0.00 H TER 81145 WAT 7866 ATOM 81145 O WAT 7867 14.012 66.978 123.803 1.00 0.00 O ATOM 81146 H1 WAT 7867 13.586 67.401 123.057 1.00 0.00 H ATOM 81147 H2 WAT 7867 13.548 67.320 124.568 1.00 0.00 H TER 81149 WAT 7867 ATOM 81149 O WAT 7868 8.170 106.255 83.321 1.00 0.00 O ATOM 81150 H1 WAT 7868 8.743 106.666 83.969 1.00 0.00 H ATOM 81151 H2 WAT 7868 7.453 105.885 83.837 1.00 0.00 H TER 81153 WAT 7868 ATOM 81153 O WAT 7869 69.415 145.381 126.515 1.00 0.00 O ATOM 81154 H1 WAT 7869 68.955 145.939 125.888 1.00 0.00 H ATOM 81155 H2 WAT 7869 69.487 144.534 126.075 1.00 0.00 H TER 81157 WAT 7869 ATOM 81157 O WAT 7870 75.318 44.344 65.293 1.00 0.00 O ATOM 81158 H1 WAT 7870 74.481 44.430 65.749 1.00 0.00 H ATOM 81159 H2 WAT 7870 75.218 44.881 64.507 1.00 0.00 H TER 81161 WAT 7870 ATOM 81161 O WAT 7871 40.999 126.489 19.311 1.00 0.00 O ATOM 81162 H1 WAT 7871 41.138 125.607 18.965 1.00 0.00 H ATOM 81163 H2 WAT 7871 40.098 126.481 19.633 1.00 0.00 H TER 81165 WAT 7871 ATOM 81165 O WAT 7872 128.696 45.703 11.645 1.00 0.00 O ATOM 81166 H1 WAT 7872 129.385 45.645 12.307 1.00 0.00 H ATOM 81167 H2 WAT 7872 128.760 44.880 11.160 1.00 0.00 H TER 81169 WAT 7872 ATOM 81169 O WAT 7873 6.794 28.421 150.466 1.00 0.00 O ATOM 81170 H1 WAT 7873 7.140 27.984 149.688 1.00 0.00 H ATOM 81171 H2 WAT 7873 7.558 28.833 150.870 1.00 0.00 H TER 81173 WAT 7873 ATOM 81173 O WAT 7874 130.433 73.006 144.004 1.00 0.00 O ATOM 81174 H1 WAT 7874 130.891 72.648 144.765 1.00 0.00 H ATOM 81175 H2 WAT 7874 129.841 73.664 144.368 1.00 0.00 H TER 81177 WAT 7874 ATOM 81177 O WAT 7875 75.187 123.317 83.162 1.00 0.00 O ATOM 81178 H1 WAT 7875 75.800 122.587 83.082 1.00 0.00 H ATOM 81179 H2 WAT 7875 75.551 123.861 83.861 1.00 0.00 H TER 81181 WAT 7875 ATOM 81181 O WAT 7876 8.258 27.538 111.557 1.00 0.00 O ATOM 81182 H1 WAT 7876 7.334 27.309 111.650 1.00 0.00 H ATOM 81183 H2 WAT 7876 8.329 27.893 110.670 1.00 0.00 H TER 81185 WAT 7876 ATOM 81185 O WAT 7877 43.658 34.812 131.684 1.00 0.00 O ATOM 81186 H1 WAT 7877 43.821 35.729 131.462 1.00 0.00 H ATOM 81187 H2 WAT 7877 43.724 34.347 130.850 1.00 0.00 H TER 81189 WAT 7877 ATOM 81189 O WAT 7878 67.180 7.648 124.689 1.00 0.00 O ATOM 81190 H1 WAT 7878 67.735 7.024 125.155 1.00 0.00 H ATOM 81191 H2 WAT 7878 66.299 7.485 125.026 1.00 0.00 H TER 81193 WAT 7878 ATOM 81193 O WAT 7879 78.199 126.331 100.080 1.00 0.00 O ATOM 81194 H1 WAT 7879 78.064 125.875 99.250 1.00 0.00 H ATOM 81195 H2 WAT 7879 77.337 126.331 100.497 1.00 0.00 H TER 81197 WAT 7879 ATOM 81197 O WAT 7880 132.402 145.556 140.633 1.00 0.00 O ATOM 81198 H1 WAT 7880 131.883 146.359 140.590 1.00 0.00 H ATOM 81199 H2 WAT 7880 131.786 144.890 140.940 1.00 0.00 H TER 81201 WAT 7880 ATOM 81201 O WAT 7881 133.688 6.853 7.142 1.00 0.00 O ATOM 81202 H1 WAT 7881 133.703 6.762 8.094 1.00 0.00 H ATOM 81203 H2 WAT 7881 133.894 5.978 6.814 1.00 0.00 H TER 81205 WAT 7881 ATOM 81205 O WAT 7882 49.453 136.895 12.059 1.00 0.00 O ATOM 81206 H1 WAT 7882 49.864 137.629 11.601 1.00 0.00 H ATOM 81207 H2 WAT 7882 48.605 136.789 11.628 1.00 0.00 H TER 81209 WAT 7882 ATOM 81209 O WAT 7883 92.283 3.532 11.864 1.00 0.00 O ATOM 81210 H1 WAT 7883 93.078 3.062 11.615 1.00 0.00 H ATOM 81211 H2 WAT 7883 92.443 4.435 11.591 1.00 0.00 H TER 81213 WAT 7883 ATOM 81213 O WAT 7884 52.053 32.850 127.863 1.00 0.00 O ATOM 81214 H1 WAT 7884 51.257 32.808 127.333 1.00 0.00 H ATOM 81215 H2 WAT 7884 52.116 31.986 128.270 1.00 0.00 H TER 81217 WAT 7884 ATOM 81217 O WAT 7885 110.324 41.002 117.055 1.00 0.00 O ATOM 81218 H1 WAT 7885 110.868 40.452 116.491 1.00 0.00 H ATOM 81219 H2 WAT 7885 110.203 41.810 116.556 1.00 0.00 H TER 81221 WAT 7885 ATOM 81221 O WAT 7886 31.873 105.956 25.903 1.00 0.00 O ATOM 81222 H1 WAT 7886 31.614 106.187 26.795 1.00 0.00 H ATOM 81223 H2 WAT 7886 32.209 105.063 25.975 1.00 0.00 H TER 81225 WAT 7886 ATOM 81225 O WAT 7887 125.442 101.048 105.101 1.00 0.00 O ATOM 81226 H1 WAT 7887 125.898 101.221 105.924 1.00 0.00 H ATOM 81227 H2 WAT 7887 124.539 101.319 105.266 1.00 0.00 H TER 81229 WAT 7887 ATOM 81229 O WAT 7888 131.841 91.924 111.974 1.00 0.00 O ATOM 81230 H1 WAT 7888 132.468 91.364 112.432 1.00 0.00 H ATOM 81231 H2 WAT 7888 131.323 92.326 112.673 1.00 0.00 H TER 81233 WAT 7888 ATOM 81233 O WAT 7889 96.348 129.426 142.998 1.00 0.00 O ATOM 81234 H1 WAT 7889 95.562 129.726 142.543 1.00 0.00 H ATOM 81235 H2 WAT 7889 97.038 129.464 142.335 1.00 0.00 H TER 81237 WAT 7889 ATOM 81237 O WAT 7890 125.039 43.346 95.521 1.00 0.00 O ATOM 81238 H1 WAT 7890 124.860 44.195 95.925 1.00 0.00 H ATOM 81239 H2 WAT 7890 124.310 43.210 94.916 1.00 0.00 H TER 81241 WAT 7890 ATOM 81241 O WAT 7891 43.570 8.924 76.500 1.00 0.00 O ATOM 81242 H1 WAT 7891 44.271 9.512 76.221 1.00 0.00 H ATOM 81243 H2 WAT 7891 43.915 8.046 76.340 1.00 0.00 H TER 81245 WAT 7891 ATOM 81245 O WAT 7892 56.195 123.056 141.521 1.00 0.00 O ATOM 81246 H1 WAT 7892 56.803 122.440 141.113 1.00 0.00 H ATOM 81247 H2 WAT 7892 55.428 123.050 140.948 1.00 0.00 H TER 81249 WAT 7892 ATOM 81249 O WAT 7893 70.498 142.148 142.129 1.00 0.00 O ATOM 81250 H1 WAT 7893 69.545 142.081 142.184 1.00 0.00 H ATOM 81251 H2 WAT 7893 70.653 142.962 141.649 1.00 0.00 H TER 81253 WAT 7893 ATOM 81253 O WAT 7894 4.262 44.692 151.172 1.00 0.00 O ATOM 81254 H1 WAT 7894 3.878 44.683 150.295 1.00 0.00 H ATOM 81255 H2 WAT 7894 4.121 45.585 151.486 1.00 0.00 H TER 81257 WAT 7894 ATOM 81257 O WAT 7895 2.888 109.277 153.159 1.00 0.00 O ATOM 81258 H1 WAT 7895 3.132 109.164 154.077 1.00 0.00 H ATOM 81259 H2 WAT 7895 2.915 108.393 152.793 1.00 0.00 H TER 81261 WAT 7895 ATOM 81261 O WAT 7896 138.823 140.910 80.193 1.00 0.00 O ATOM 81262 H1 WAT 7896 139.456 141.332 79.611 1.00 0.00 H ATOM 81263 H2 WAT 7896 137.970 141.131 79.819 1.00 0.00 H TER 81265 WAT 7896 ATOM 81265 O WAT 7897 77.136 115.090 113.196 1.00 0.00 O ATOM 81266 H1 WAT 7897 76.999 114.527 113.959 1.00 0.00 H ATOM 81267 H2 WAT 7897 78.026 115.425 113.303 1.00 0.00 H TER 81269 WAT 7897 ATOM 81269 O WAT 7898 17.426 73.509 126.477 1.00 0.00 O ATOM 81270 H1 WAT 7898 17.144 72.666 126.120 1.00 0.00 H ATOM 81271 H2 WAT 7898 16.793 73.700 127.169 1.00 0.00 H TER 81273 WAT 7898 ATOM 81273 O WAT 7899 4.748 91.440 157.897 1.00 0.00 O ATOM 81274 H1 WAT 7899 5.031 90.761 157.286 1.00 0.00 H ATOM 81275 H2 WAT 7899 4.688 92.233 157.364 1.00 0.00 H TER 81277 WAT 7899 ATOM 81277 O WAT 7900 126.779 69.322 98.408 1.00 0.00 O ATOM 81278 H1 WAT 7900 126.974 70.111 98.913 1.00 0.00 H ATOM 81279 H2 WAT 7900 127.364 68.656 98.769 1.00 0.00 H TER 81281 WAT 7900 ATOM 81281 O WAT 7901 141.963 25.643 106.645 1.00 0.00 O ATOM 81282 H1 WAT 7901 142.818 25.964 106.360 1.00 0.00 H ATOM 81283 H2 WAT 7901 141.334 26.218 106.208 1.00 0.00 H TER 81285 WAT 7901 ATOM 81285 O WAT 7902 83.756 120.736 126.466 1.00 0.00 O ATOM 81286 H1 WAT 7902 84.052 120.528 125.580 1.00 0.00 H ATOM 81287 H2 WAT 7902 84.351 120.251 127.038 1.00 0.00 H TER 81289 WAT 7902 ATOM 81289 O WAT 7903 134.604 104.928 4.178 1.00 0.00 O ATOM 81290 H1 WAT 7903 134.891 104.161 3.682 1.00 0.00 H ATOM 81291 H2 WAT 7903 134.647 104.650 5.094 1.00 0.00 H TER 81293 WAT 7903 ATOM 81293 O WAT 7904 41.219 51.026 132.207 1.00 0.00 O ATOM 81294 H1 WAT 7904 40.608 50.290 132.251 1.00 0.00 H ATOM 81295 H2 WAT 7904 40.667 51.801 132.316 1.00 0.00 H TER 81297 WAT 7904 ATOM 81297 O WAT 7905 22.228 123.517 156.537 1.00 0.00 O ATOM 81298 H1 WAT 7905 21.696 124.297 156.380 1.00 0.00 H ATOM 81299 H2 WAT 7905 22.277 123.085 155.685 1.00 0.00 H TER 81301 WAT 7905 ATOM 81301 O WAT 7906 47.436 69.790 157.155 1.00 0.00 O ATOM 81302 H1 WAT 7906 48.340 69.482 157.081 1.00 0.00 H ATOM 81303 H2 WAT 7906 46.920 69.131 156.692 1.00 0.00 H TER 81305 WAT 7906 ATOM 81305 O WAT 7907 112.595 138.662 14.391 1.00 0.00 O ATOM 81306 H1 WAT 7907 113.351 139.223 14.565 1.00 0.00 H ATOM 81307 H2 WAT 7907 112.778 137.858 14.878 1.00 0.00 H TER 81309 WAT 7907 ATOM 81309 O WAT 7908 119.475 44.391 61.090 1.00 0.00 O ATOM 81310 H1 WAT 7908 118.753 44.111 60.528 1.00 0.00 H ATOM 81311 H2 WAT 7908 119.305 45.318 61.255 1.00 0.00 H TER 81313 WAT 7908 ATOM 81313 O WAT 7909 129.464 41.511 142.200 1.00 0.00 O ATOM 81314 H1 WAT 7909 128.863 41.541 141.456 1.00 0.00 H ATOM 81315 H2 WAT 7909 129.325 42.342 142.654 1.00 0.00 H TER 81317 WAT 7909 ATOM 81317 O WAT 7910 71.301 56.120 68.788 1.00 0.00 O ATOM 81318 H1 WAT 7910 71.668 56.384 67.945 1.00 0.00 H ATOM 81319 H2 WAT 7910 71.317 55.163 68.767 1.00 0.00 H TER 81321 WAT 7910 ATOM 81321 O WAT 7911 110.503 43.641 75.404 1.00 0.00 O ATOM 81322 H1 WAT 7911 109.666 43.227 75.615 1.00 0.00 H ATOM 81323 H2 WAT 7911 110.271 44.533 75.145 1.00 0.00 H TER 81325 WAT 7911 ATOM 81325 O WAT 7912 42.690 136.903 96.226 1.00 0.00 O ATOM 81326 H1 WAT 7912 43.221 137.540 95.748 1.00 0.00 H ATOM 81327 H2 WAT 7912 42.064 136.579 95.578 1.00 0.00 H TER 81329 WAT 7912 ATOM 81329 O WAT 7913 42.063 88.551 111.340 1.00 0.00 O ATOM 81330 H1 WAT 7913 42.975 88.362 111.119 1.00 0.00 H ATOM 81331 H2 WAT 7913 41.996 88.349 112.273 1.00 0.00 H TER 81333 WAT 7913 ATOM 81333 O WAT 7914 60.292 137.420 64.344 1.00 0.00 O ATOM 81334 H1 WAT 7914 59.999 137.119 63.485 1.00 0.00 H ATOM 81335 H2 WAT 7914 61.247 137.391 64.296 1.00 0.00 H TER 81337 WAT 7914 ATOM 81337 O WAT 7915 130.885 143.556 118.928 1.00 0.00 O ATOM 81338 H1 WAT 7915 131.367 144.305 119.278 1.00 0.00 H ATOM 81339 H2 WAT 7915 131.563 142.969 118.594 1.00 0.00 H TER 81341 WAT 7915 ATOM 81341 O WAT 7916 71.524 101.179 24.021 1.00 0.00 O ATOM 81342 H1 WAT 7916 70.597 101.408 23.948 1.00 0.00 H ATOM 81343 H2 WAT 7916 71.959 102.007 24.224 1.00 0.00 H TER 81345 WAT 7916 ATOM 81345 O WAT 7917 4.860 34.491 147.381 1.00 0.00 O ATOM 81346 H1 WAT 7917 4.485 35.348 147.583 1.00 0.00 H ATOM 81347 H2 WAT 7917 5.173 34.162 148.224 1.00 0.00 H TER 81349 WAT 7917 ATOM 81349 O WAT 7918 128.685 25.717 86.718 1.00 0.00 O ATOM 81350 H1 WAT 7918 128.674 25.937 85.786 1.00 0.00 H ATOM 81351 H2 WAT 7918 128.963 26.524 87.151 1.00 0.00 H TER 81353 WAT 7918 ATOM 81353 O WAT 7919 95.832 39.725 22.950 1.00 0.00 O ATOM 81354 H1 WAT 7919 96.748 39.960 23.097 1.00 0.00 H ATOM 81355 H2 WAT 7919 95.460 39.653 23.829 1.00 0.00 H TER 81357 WAT 7919 ATOM 81357 O WAT 7920 2.483 1.794 112.240 1.00 0.00 O ATOM 81358 H1 WAT 7920 2.141 0.978 111.875 1.00 0.00 H ATOM 81359 H2 WAT 7920 2.829 1.546 113.098 1.00 0.00 H TER 81361 WAT 7920 ATOM 81361 O WAT 7921 113.893 111.622 8.427 1.00 0.00 O ATOM 81362 H1 WAT 7921 113.874 111.092 7.630 1.00 0.00 H ATOM 81363 H2 WAT 7921 114.514 112.325 8.231 1.00 0.00 H TER 81365 WAT 7921 ATOM 81365 O WAT 7922 63.065 30.793 116.771 1.00 0.00 O ATOM 81366 H1 WAT 7922 62.862 31.084 115.882 1.00 0.00 H ATOM 81367 H2 WAT 7922 63.993 30.999 116.884 1.00 0.00 H TER 81369 WAT 7922 ATOM 81369 O WAT 7923 50.981 112.368 75.551 1.00 0.00 O ATOM 81370 H1 WAT 7923 50.326 113.049 75.706 1.00 0.00 H ATOM 81371 H2 WAT 7923 51.034 111.894 76.381 1.00 0.00 H TER 81373 WAT 7923 ATOM 81373 O WAT 7924 84.257 37.391 111.859 1.00 0.00 O ATOM 81374 H1 WAT 7924 84.342 37.544 112.800 1.00 0.00 H ATOM 81375 H2 WAT 7924 85.105 37.032 111.597 1.00 0.00 H TER 81377 WAT 7924 ATOM 81377 O WAT 7925 9.984 45.302 157.838 1.00 0.00 O ATOM 81378 H1 WAT 7925 10.573 45.230 157.088 1.00 0.00 H ATOM 81379 H2 WAT 7925 10.307 44.651 158.461 1.00 0.00 H TER 81381 WAT 7925 ATOM 81381 O WAT 7926 45.036 40.112 110.177 1.00 0.00 O ATOM 81382 H1 WAT 7926 44.511 40.081 109.377 1.00 0.00 H ATOM 81383 H2 WAT 7926 45.142 41.046 110.357 1.00 0.00 H TER 81385 WAT 7926 ATOM 81385 O WAT 7927 133.046 93.892 71.769 1.00 0.00 O ATOM 81386 H1 WAT 7927 133.367 94.249 72.597 1.00 0.00 H ATOM 81387 H2 WAT 7927 132.269 93.389 72.009 1.00 0.00 H TER 81389 WAT 7927 ATOM 81389 O WAT 7928 36.925 78.048 59.469 1.00 0.00 O ATOM 81390 H1 WAT 7928 37.109 78.520 60.281 1.00 0.00 H ATOM 81391 H2 WAT 7928 37.406 78.531 58.797 1.00 0.00 H TER 81393 WAT 7928 ATOM 81393 O WAT 7929 67.607 136.979 71.627 1.00 0.00 O ATOM 81394 H1 WAT 7929 67.580 136.151 71.147 1.00 0.00 H ATOM 81395 H2 WAT 7929 67.162 136.790 72.454 1.00 0.00 H TER 81397 WAT 7929 ATOM 81397 O WAT 7930 5.768 55.805 10.122 1.00 0.00 O ATOM 81398 H1 WAT 7930 5.517 56.625 10.548 1.00 0.00 H ATOM 81399 H2 WAT 7930 6.636 55.980 9.758 1.00 0.00 H TER 81401 WAT 7930 ATOM 81401 O WAT 7931 134.134 0.136 17.956 1.00 0.00 O ATOM 81402 H1 WAT 7931 135.080 -0.010 17.984 1.00 0.00 H ATOM 81403 H2 WAT 7931 134.041 1.084 17.857 1.00 0.00 H TER 81405 WAT 7931 ATOM 81405 O WAT 7932 74.466 28.250 78.464 1.00 0.00 O ATOM 81406 H1 WAT 7932 74.064 28.147 79.327 1.00 0.00 H ATOM 81407 H2 WAT 7932 75.146 28.911 78.594 1.00 0.00 H TER 81409 WAT 7932 ATOM 81409 O WAT 7933 15.773 61.766 77.310 1.00 0.00 O ATOM 81410 H1 WAT 7933 16.593 61.361 77.026 1.00 0.00 H ATOM 81411 H2 WAT 7933 15.096 61.139 77.057 1.00 0.00 H TER 81413 WAT 7933 ATOM 81413 O WAT 7934 28.246 48.354 6.356 1.00 0.00 O ATOM 81414 H1 WAT 7934 27.357 48.035 6.201 1.00 0.00 H ATOM 81415 H2 WAT 7934 28.349 49.086 5.748 1.00 0.00 H TER 81417 WAT 7934 ATOM 81417 O WAT 7935 127.666 27.519 129.256 1.00 0.00 O ATOM 81418 H1 WAT 7935 127.922 27.071 128.450 1.00 0.00 H ATOM 81419 H2 WAT 7935 128.479 27.595 129.756 1.00 0.00 H TER 81421 WAT 7935 ATOM 81421 O WAT 7936 139.066 82.133 114.995 1.00 0.00 O ATOM 81422 H1 WAT 7936 138.493 81.699 115.627 1.00 0.00 H ATOM 81423 H2 WAT 7936 138.499 82.318 114.246 1.00 0.00 H TER 81425 WAT 7936 ATOM 81425 O WAT 7937 21.704 100.377 68.582 1.00 0.00 O ATOM 81426 H1 WAT 7937 22.357 101.050 68.393 1.00 0.00 H ATOM 81427 H2 WAT 7937 22.012 99.963 69.388 1.00 0.00 H TER 81429 WAT 7937 ATOM 81429 O WAT 7938 85.488 111.420 91.697 1.00 0.00 O ATOM 81430 H1 WAT 7938 85.480 110.544 91.311 1.00 0.00 H ATOM 81431 H2 WAT 7938 85.873 111.976 91.019 1.00 0.00 H TER 81433 WAT 7938 ATOM 81433 O WAT 7939 11.003 82.214 65.285 1.00 0.00 O ATOM 81434 H1 WAT 7939 10.933 81.552 65.973 1.00 0.00 H ATOM 81435 H2 WAT 7939 11.847 82.038 64.869 1.00 0.00 H TER 81437 WAT 7939 ATOM 81437 O WAT 7940 107.240 45.550 20.597 1.00 0.00 O ATOM 81438 H1 WAT 7940 107.343 46.485 20.776 1.00 0.00 H ATOM 81439 H2 WAT 7940 106.341 45.353 20.858 1.00 0.00 H TER 81441 WAT 7940 ATOM 81441 O WAT 7941 97.606 99.207 14.809 1.00 0.00 O ATOM 81442 H1 WAT 7941 97.332 98.559 14.159 1.00 0.00 H ATOM 81443 H2 WAT 7941 96.804 99.681 15.027 1.00 0.00 H TER 81445 WAT 7941 ATOM 81445 O WAT 7942 74.847 128.170 100.684 1.00 0.00 O ATOM 81446 H1 WAT 7942 74.409 129.021 100.671 1.00 0.00 H ATOM 81447 H2 WAT 7942 75.108 128.021 99.775 1.00 0.00 H TER 81449 WAT 7942 ATOM 81449 O WAT 7943 97.086 82.568 132.147 1.00 0.00 O ATOM 81450 H1 WAT 7943 96.307 82.551 131.591 1.00 0.00 H ATOM 81451 H2 WAT 7943 97.114 81.698 132.546 1.00 0.00 H TER 81453 WAT 7943 ATOM 81453 O WAT 7944 74.764 115.914 148.974 1.00 0.00 O ATOM 81454 H1 WAT 7944 74.768 116.867 149.057 1.00 0.00 H ATOM 81455 H2 WAT 7944 75.072 115.598 149.824 1.00 0.00 H TER 81457 WAT 7944 ATOM 81457 O WAT 7945 110.735 94.250 95.410 1.00 0.00 O ATOM 81458 H1 WAT 7945 111.301 94.348 96.176 1.00 0.00 H ATOM 81459 H2 WAT 7945 109.994 94.830 95.585 1.00 0.00 H TER 81461 WAT 7945 ATOM 81461 O WAT 7946 69.959 102.554 17.856 1.00 0.00 O ATOM 81462 H1 WAT 7946 70.253 103.463 17.803 1.00 0.00 H ATOM 81463 H2 WAT 7946 70.370 102.125 17.106 1.00 0.00 H TER 81465 WAT 7946 ATOM 81465 O WAT 7947 39.217 135.866 147.697 1.00 0.00 O ATOM 81466 H1 WAT 7947 39.851 135.660 147.009 1.00 0.00 H ATOM 81467 H2 WAT 7947 38.508 136.319 147.241 1.00 0.00 H TER 81469 WAT 7947 ATOM 81469 O WAT 7948 138.575 24.947 108.371 1.00 0.00 O ATOM 81470 H1 WAT 7948 137.961 24.947 107.636 1.00 0.00 H ATOM 81471 H2 WAT 7948 139.017 24.100 108.312 1.00 0.00 H TER 81473 WAT 7948 ATOM 81473 O WAT 7949 43.313 10.791 67.592 1.00 0.00 O ATOM 81474 H1 WAT 7949 44.266 10.879 67.574 1.00 0.00 H ATOM 81475 H2 WAT 7949 43.114 10.194 66.871 1.00 0.00 H TER 81477 WAT 7949 ATOM 81477 O WAT 7950 6.094 110.627 152.807 1.00 0.00 O ATOM 81478 H1 WAT 7950 5.353 110.923 153.337 1.00 0.00 H ATOM 81479 H2 WAT 7950 6.812 110.530 153.433 1.00 0.00 H TER 81481 WAT 7950 ATOM 81481 O WAT 7951 50.750 65.707 139.172 1.00 0.00 O ATOM 81482 H1 WAT 7951 51.672 65.670 138.916 1.00 0.00 H ATOM 81483 H2 WAT 7951 50.525 64.802 139.388 1.00 0.00 H TER 81485 WAT 7951 ATOM 81485 O WAT 7952 113.041 127.944 10.626 1.00 0.00 O ATOM 81486 H1 WAT 7952 112.611 127.482 11.345 1.00 0.00 H ATOM 81487 H2 WAT 7952 113.977 127.836 10.797 1.00 0.00 H TER 81489 WAT 7952 ATOM 81489 O WAT 7953 140.594 2.783 64.985 1.00 0.00 O ATOM 81490 H1 WAT 7953 140.806 2.159 64.291 1.00 0.00 H ATOM 81491 H2 WAT 7953 141.443 3.032 65.351 1.00 0.00 H TER 81493 WAT 7953 ATOM 81493 O WAT 7954 4.511 90.892 84.967 1.00 0.00 O ATOM 81494 H1 WAT 7954 4.320 91.082 85.886 1.00 0.00 H ATOM 81495 H2 WAT 7954 5.467 90.883 84.918 1.00 0.00 H TER 81497 WAT 7954 ATOM 81497 O WAT 7955 29.834 54.033 115.858 1.00 0.00 O ATOM 81498 H1 WAT 7955 30.726 53.919 115.531 1.00 0.00 H ATOM 81499 H2 WAT 7955 29.457 54.709 115.295 1.00 0.00 H TER 81501 WAT 7955 ATOM 81501 O WAT 7956 12.957 0.622 98.673 1.00 0.00 O ATOM 81502 H1 WAT 7956 13.524 -0.143 98.768 1.00 0.00 H ATOM 81503 H2 WAT 7956 13.363 1.137 97.976 1.00 0.00 H TER 81505 WAT 7956 ATOM 81505 O WAT 7957 13.209 89.874 113.992 1.00 0.00 O ATOM 81506 H1 WAT 7957 13.499 89.086 113.533 1.00 0.00 H ATOM 81507 H2 WAT 7957 13.484 89.739 114.898 1.00 0.00 H TER 81509 WAT 7957 ATOM 81509 O WAT 7958 78.215 2.078 118.201 1.00 0.00 O ATOM 81510 H1 WAT 7958 77.894 1.385 118.779 1.00 0.00 H ATOM 81511 H2 WAT 7958 79.158 1.926 118.144 1.00 0.00 H TER 81513 WAT 7958 ATOM 81513 O WAT 7959 12.866 109.785 12.378 1.00 0.00 O ATOM 81514 H1 WAT 7959 13.818 109.688 12.389 1.00 0.00 H ATOM 81515 H2 WAT 7959 12.673 110.158 11.518 1.00 0.00 H TER 81517 WAT 7959 ATOM 81517 O WAT 7960 15.308 46.799 11.947 1.00 0.00 O ATOM 81518 H1 WAT 7960 16.256 46.672 11.907 1.00 0.00 H ATOM 81519 H2 WAT 7960 15.163 47.652 11.537 1.00 0.00 H TER 81521 WAT 7960 ATOM 81521 O WAT 7961 5.670 50.448 80.600 1.00 0.00 O ATOM 81522 H1 WAT 7961 6.272 50.317 79.867 1.00 0.00 H ATOM 81523 H2 WAT 7961 5.351 49.570 80.808 1.00 0.00 H TER 81525 WAT 7961 ATOM 81525 O WAT 7962 78.382 94.357 153.881 1.00 0.00 O ATOM 81526 H1 WAT 7962 78.688 94.621 154.748 1.00 0.00 H ATOM 81527 H2 WAT 7962 79.167 94.039 153.436 1.00 0.00 H TER 81529 WAT 7962 ATOM 81529 O WAT 7963 85.641 3.033 126.514 1.00 0.00 O ATOM 81530 H1 WAT 7963 86.516 2.647 126.469 1.00 0.00 H ATOM 81531 H2 WAT 7963 85.777 3.959 126.313 1.00 0.00 H TER 81533 WAT 7963 ATOM 81533 O WAT 7964 38.686 16.019 135.389 1.00 0.00 O ATOM 81534 H1 WAT 7964 39.144 16.418 134.649 1.00 0.00 H ATOM 81535 H2 WAT 7964 38.465 15.138 135.086 1.00 0.00 H TER 81537 WAT 7964 ATOM 81537 O WAT 7965 11.158 135.052 27.148 1.00 0.00 O ATOM 81538 H1 WAT 7965 11.957 135.123 27.671 1.00 0.00 H ATOM 81539 H2 WAT 7965 11.342 135.561 26.358 1.00 0.00 H TER 81541 WAT 7965 ATOM 81541 O WAT 7966 76.849 45.851 109.055 1.00 0.00 O ATOM 81542 H1 WAT 7966 76.360 45.876 108.233 1.00 0.00 H ATOM 81543 H2 WAT 7966 76.921 46.768 109.319 1.00 0.00 H TER 81545 WAT 7966 ATOM 81545 O WAT 7967 13.232 39.734 131.579 1.00 0.00 O ATOM 81546 H1 WAT 7967 12.581 39.075 131.819 1.00 0.00 H ATOM 81547 H2 WAT 7967 12.852 40.563 131.871 1.00 0.00 H TER 81549 WAT 7967 ATOM 81549 O WAT 7968 140.067 111.536 106.360 1.00 0.00 O ATOM 81550 H1 WAT 7968 139.638 110.718 106.107 1.00 0.00 H ATOM 81551 H2 WAT 7968 139.464 112.222 106.072 1.00 0.00 H TER 81553 WAT 7968 ATOM 81553 O WAT 7969 42.521 19.232 2.356 1.00 0.00 O ATOM 81554 H1 WAT 7969 43.177 19.435 1.689 1.00 0.00 H ATOM 81555 H2 WAT 7969 42.857 18.449 2.792 1.00 0.00 H TER 81557 WAT 7969 ATOM 81557 O WAT 7970 136.562 0.717 1.189 1.00 0.00 O ATOM 81558 H1 WAT 7970 135.735 0.407 0.820 1.00 0.00 H ATOM 81559 H2 WAT 7970 136.483 1.671 1.186 1.00 0.00 H TER 81561 WAT 7970 ATOM 81561 O WAT 7971 119.679 92.916 14.763 1.00 0.00 O ATOM 81562 H1 WAT 7971 118.993 92.505 14.236 1.00 0.00 H ATOM 81563 H2 WAT 7971 119.560 93.855 14.621 1.00 0.00 H TER 81565 WAT 7971 ATOM 81565 O WAT 7972 33.771 84.370 137.779 1.00 0.00 O ATOM 81566 H1 WAT 7972 34.254 83.599 137.483 1.00 0.00 H ATOM 81567 H2 WAT 7972 34.377 84.822 138.367 1.00 0.00 H TER 81569 WAT 7972 ATOM 81569 O WAT 7973 135.025 96.160 17.008 1.00 0.00 O ATOM 81570 H1 WAT 7973 135.213 96.638 17.816 1.00 0.00 H ATOM 81571 H2 WAT 7973 135.843 96.198 16.512 1.00 0.00 H TER 81573 WAT 7973 ATOM 81573 O WAT 7974 124.317 133.934 77.107 1.00 0.00 O ATOM 81574 H1 WAT 7974 125.209 133.671 77.334 1.00 0.00 H ATOM 81575 H2 WAT 7974 123.846 133.927 77.940 1.00 0.00 H TER 81577 WAT 7974 ATOM 81577 O WAT 7975 115.755 82.544 10.531 1.00 0.00 O ATOM 81578 H1 WAT 7975 115.463 82.969 11.337 1.00 0.00 H ATOM 81579 H2 WAT 7975 115.356 81.674 10.560 1.00 0.00 H TER 81581 WAT 7975 ATOM 81581 O WAT 7976 128.854 9.374 59.848 1.00 0.00 O ATOM 81582 H1 WAT 7976 128.279 9.108 60.564 1.00 0.00 H ATOM 81583 H2 WAT 7976 128.390 9.105 59.055 1.00 0.00 H TER 81585 WAT 7976 ATOM 81585 O WAT 7977 62.521 47.023 78.062 1.00 0.00 O ATOM 81586 H1 WAT 7977 62.138 46.621 78.842 1.00 0.00 H ATOM 81587 H2 WAT 7977 62.363 47.960 78.174 1.00 0.00 H TER 81589 WAT 7977 ATOM 81589 O WAT 7978 68.067 138.225 58.021 1.00 0.00 O ATOM 81590 H1 WAT 7978 68.257 139.042 58.483 1.00 0.00 H ATOM 81591 H2 WAT 7978 68.719 138.188 57.321 1.00 0.00 H TER 81593 WAT 7978 ATOM 81593 O WAT 7979 144.422 120.654 144.847 1.00 0.00 O ATOM 81594 H1 WAT 7979 145.086 120.315 145.446 1.00 0.00 H ATOM 81595 H2 WAT 7979 143.680 120.058 144.948 1.00 0.00 H TER 81597 WAT 7979 ATOM 81597 O WAT 7980 93.262 99.659 86.510 1.00 0.00 O ATOM 81598 H1 WAT 7980 92.583 99.054 86.212 1.00 0.00 H ATOM 81599 H2 WAT 7980 93.998 99.504 85.918 1.00 0.00 H TER 81601 WAT 7980 ATOM 81601 O WAT 7981 31.778 100.359 136.120 1.00 0.00 O ATOM 81602 H1 WAT 7981 31.411 100.433 137.002 1.00 0.00 H ATOM 81603 H2 WAT 7981 31.866 101.264 135.821 1.00 0.00 H TER 81605 WAT 7981 ATOM 81605 O WAT 7982 90.861 90.703 94.387 1.00 0.00 O ATOM 81606 H1 WAT 7982 91.513 90.004 94.332 1.00 0.00 H ATOM 81607 H2 WAT 7982 91.049 91.266 93.636 1.00 0.00 H TER 81609 WAT 7982 ATOM 81609 O WAT 7983 43.999 128.724 129.417 1.00 0.00 O ATOM 81610 H1 WAT 7983 43.181 128.310 129.144 1.00 0.00 H ATOM 81611 H2 WAT 7983 44.017 129.556 128.943 1.00 0.00 H TER 81613 WAT 7983 ATOM 81613 O WAT 7984 43.056 117.821 98.164 1.00 0.00 O ATOM 81614 H1 WAT 7984 43.030 117.133 97.499 1.00 0.00 H ATOM 81615 H2 WAT 7984 43.979 118.072 98.212 1.00 0.00 H TER 81617 WAT 7984 ATOM 81617 O WAT 7985 11.674 145.241 136.135 1.00 0.00 O ATOM 81618 H1 WAT 7985 11.372 144.397 136.469 1.00 0.00 H ATOM 81619 H2 WAT 7985 12.178 145.618 136.856 1.00 0.00 H TER 81621 WAT 7985 ATOM 81621 O WAT 7986 133.407 56.597 104.017 1.00 0.00 O ATOM 81622 H1 WAT 7986 132.847 55.851 103.804 1.00 0.00 H ATOM 81623 H2 WAT 7986 133.232 56.772 104.942 1.00 0.00 H TER 81625 WAT 7986 ATOM 81625 O WAT 7987 15.661 14.021 68.074 1.00 0.00 O ATOM 81626 H1 WAT 7987 14.929 14.639 68.082 1.00 0.00 H ATOM 81627 H2 WAT 7987 16.403 14.533 67.754 1.00 0.00 H TER 81629 WAT 7987 ATOM 81629 O WAT 7988 46.040 7.479 17.880 1.00 0.00 O ATOM 81630 H1 WAT 7988 46.854 7.836 18.234 1.00 0.00 H ATOM 81631 H2 WAT 7988 45.910 6.660 18.360 1.00 0.00 H TER 81633 WAT 7988 ATOM 81633 O WAT 7989 21.431 24.346 93.063 1.00 0.00 O ATOM 81634 H1 WAT 7989 22.051 24.618 92.386 1.00 0.00 H ATOM 81635 H2 WAT 7989 20.750 25.018 93.047 1.00 0.00 H TER 81637 WAT 7989 ATOM 81637 O WAT 7990 112.635 64.799 111.625 1.00 0.00 O ATOM 81638 H1 WAT 7990 112.960 63.998 111.215 1.00 0.00 H ATOM 81639 H2 WAT 7990 112.005 64.495 112.278 1.00 0.00 H TER 81641 WAT 7990 ATOM 81641 O WAT 7991 129.812 59.298 153.384 1.00 0.00 O ATOM 81642 H1 WAT 7991 129.663 59.876 152.636 1.00 0.00 H ATOM 81643 H2 WAT 7991 128.940 58.978 153.617 1.00 0.00 H TER 81645 WAT 7991 ATOM 81645 O WAT 7992 138.581 59.481 93.921 1.00 0.00 O ATOM 81646 H1 WAT 7992 138.359 59.867 94.769 1.00 0.00 H ATOM 81647 H2 WAT 7992 138.139 60.039 93.281 1.00 0.00 H TER 81649 WAT 7992 ATOM 81649 O WAT 7993 61.074 127.723 74.742 1.00 0.00 O ATOM 81650 H1 WAT 7993 61.750 127.091 74.501 1.00 0.00 H ATOM 81651 H2 WAT 7993 60.825 128.135 73.915 1.00 0.00 H TER 81653 WAT 7993 ATOM 81653 O WAT 7994 124.082 31.160 147.061 1.00 0.00 O ATOM 81654 H1 WAT 7994 123.391 31.814 147.166 1.00 0.00 H ATOM 81655 H2 WAT 7994 124.599 31.474 146.319 1.00 0.00 H TER 81657 WAT 7994 ATOM 81657 O WAT 7995 139.949 67.851 83.880 1.00 0.00 O ATOM 81658 H1 WAT 7995 139.870 67.454 84.748 1.00 0.00 H ATOM 81659 H2 WAT 7995 139.049 68.066 83.633 1.00 0.00 H TER 81661 WAT 7995 ATOM 81661 O WAT 7996 120.420 73.510 94.935 1.00 0.00 O ATOM 81662 H1 WAT 7996 119.675 73.021 95.283 1.00 0.00 H ATOM 81663 H2 WAT 7996 120.305 74.397 95.276 1.00 0.00 H TER 81665 WAT 7996 ATOM 81665 O WAT 7997 30.300 27.705 123.307 1.00 0.00 O ATOM 81666 H1 WAT 7997 30.651 27.615 122.421 1.00 0.00 H ATOM 81667 H2 WAT 7997 30.065 26.813 123.563 1.00 0.00 H TER 81669 WAT 7997 ATOM 81669 O WAT 7998 129.545 129.492 151.502 1.00 0.00 O ATOM 81670 H1 WAT 7998 128.629 129.225 151.577 1.00 0.00 H ATOM 81671 H2 WAT 7998 129.969 129.113 152.272 1.00 0.00 H TER 81673 WAT 7998 ATOM 81673 O WAT 7999 38.517 76.899 79.532 1.00 0.00 O ATOM 81674 H1 WAT 7999 38.353 76.054 79.950 1.00 0.00 H ATOM 81675 H2 WAT 7999 37.655 77.311 79.479 1.00 0.00 H TER 81677 WAT 7999 ATOM 81677 O WAT 8000 118.244 81.140 142.570 1.00 0.00 O ATOM 81678 H1 WAT 8000 118.534 81.673 141.829 1.00 0.00 H ATOM 81679 H2 WAT 8000 118.758 81.460 143.311 1.00 0.00 H TER 81681 WAT 8000 ATOM 81681 O WAT 8001 19.226 23.981 97.829 1.00 0.00 O ATOM 81682 H1 WAT 8001 18.403 23.524 97.654 1.00 0.00 H ATOM 81683 H2 WAT 8001 19.397 24.478 97.029 1.00 0.00 H TER 81685 WAT 8001 ATOM 81685 O WAT 8002 126.680 113.875 92.193 1.00 0.00 O ATOM 81686 H1 WAT 8002 126.467 113.852 93.126 1.00 0.00 H ATOM 81687 H2 WAT 8002 127.198 113.084 92.046 1.00 0.00 H TER 81689 WAT 8002 ATOM 81689 O WAT 8003 44.172 2.665 67.823 1.00 0.00 O ATOM 81690 H1 WAT 8003 44.269 1.951 68.453 1.00 0.00 H ATOM 81691 H2 WAT 8003 44.380 2.268 66.977 1.00 0.00 H TER 81693 WAT 8003 ATOM 81693 O WAT 8004 121.773 144.673 144.644 1.00 0.00 O ATOM 81694 H1 WAT 8004 121.967 144.609 145.579 1.00 0.00 H ATOM 81695 H2 WAT 8004 121.732 145.614 144.472 1.00 0.00 H TER 81697 WAT 8004 ATOM 81697 O WAT 8005 11.047 2.358 1.690 1.00 0.00 O ATOM 81698 H1 WAT 8005 10.121 2.231 1.893 1.00 0.00 H ATOM 81699 H2 WAT 8005 11.119 2.153 0.758 1.00 0.00 H TER 81701 WAT 8005 ATOM 81701 O WAT 8006 3.208 57.628 138.579 1.00 0.00 O ATOM 81702 H1 WAT 8006 3.271 56.706 138.828 1.00 0.00 H ATOM 81703 H2 WAT 8006 2.530 57.648 137.904 1.00 0.00 H TER 81705 WAT 8006 ATOM 81705 O WAT 8007 127.552 2.574 96.283 1.00 0.00 O ATOM 81706 H1 WAT 8007 127.861 1.708 96.015 1.00 0.00 H ATOM 81707 H2 WAT 8007 127.305 3.003 95.464 1.00 0.00 H TER 81709 WAT 8007 ATOM 81709 O WAT 8008 63.052 128.059 82.937 1.00 0.00 O ATOM 81710 H1 WAT 8008 62.622 127.279 82.588 1.00 0.00 H ATOM 81711 H2 WAT 8008 62.815 128.069 83.864 1.00 0.00 H TER 81713 WAT 8008 ATOM 81713 O WAT 8009 98.639 22.648 131.597 1.00 0.00 O ATOM 81714 H1 WAT 8009 98.672 21.708 131.421 1.00 0.00 H ATOM 81715 H2 WAT 8009 97.739 22.808 131.879 1.00 0.00 H TER 81717 WAT 8009 ATOM 81717 O WAT 8010 44.579 135.817 118.535 1.00 0.00 O ATOM 81718 H1 WAT 8010 45.186 136.138 117.868 1.00 0.00 H ATOM 81719 H2 WAT 8010 44.021 136.569 118.732 1.00 0.00 H TER 81721 WAT 8010 ATOM 81721 O WAT 8011 44.946 85.706 130.570 1.00 0.00 O ATOM 81722 H1 WAT 8011 45.102 84.780 130.756 1.00 0.00 H ATOM 81723 H2 WAT 8011 44.247 85.705 129.916 1.00 0.00 H TER 81725 WAT 8011 ATOM 81725 O WAT 8012 35.453 143.141 19.004 1.00 0.00 O ATOM 81726 H1 WAT 8012 35.466 143.192 19.960 1.00 0.00 H ATOM 81727 H2 WAT 8012 34.609 142.741 18.797 1.00 0.00 H TER 81729 WAT 8012 ATOM 81729 O WAT 8013 127.538 23.976 149.687 1.00 0.00 O ATOM 81730 H1 WAT 8013 126.942 24.522 149.174 1.00 0.00 H ATOM 81731 H2 WAT 8013 126.967 23.499 150.290 1.00 0.00 H TER 81733 WAT 8013 ATOM 81733 O WAT 8014 23.032 126.931 100.840 1.00 0.00 O ATOM 81734 H1 WAT 8014 22.596 127.323 101.597 1.00 0.00 H ATOM 81735 H2 WAT 8014 23.580 127.633 100.489 1.00 0.00 H TER 81737 WAT 8014 ATOM 81737 O WAT 8015 28.559 91.113 83.670 1.00 0.00 O ATOM 81738 H1 WAT 8015 27.665 90.836 83.870 1.00 0.00 H ATOM 81739 H2 WAT 8015 28.754 91.783 84.325 1.00 0.00 H TER 81741 WAT 8015 ATOM 81741 O WAT 8016 15.169 144.268 156.402 1.00 0.00 O ATOM 81742 H1 WAT 8016 15.164 143.577 155.741 1.00 0.00 H ATOM 81743 H2 WAT 8016 14.946 143.820 157.218 1.00 0.00 H TER 81745 WAT 8016 ATOM 81745 O WAT 8017 128.015 18.192 68.307 1.00 0.00 O ATOM 81746 H1 WAT 8017 127.701 18.183 69.212 1.00 0.00 H ATOM 81747 H2 WAT 8017 127.428 17.594 67.844 1.00 0.00 H TER 81749 WAT 8017 ATOM 81749 O WAT 8018 118.246 53.716 88.419 1.00 0.00 O ATOM 81750 H1 WAT 8018 118.178 53.149 87.650 1.00 0.00 H ATOM 81751 H2 WAT 8018 117.687 54.465 88.215 1.00 0.00 H TER 81753 WAT 8018 ATOM 81753 O WAT 8019 99.153 73.080 75.668 1.00 0.00 O ATOM 81754 H1 WAT 8019 99.361 72.796 74.778 1.00 0.00 H ATOM 81755 H2 WAT 8019 98.925 74.005 75.577 1.00 0.00 H TER 81757 WAT 8019 ATOM 81757 O WAT 8020 127.303 91.318 15.303 1.00 0.00 O ATOM 81758 H1 WAT 8020 127.842 92.109 15.329 1.00 0.00 H ATOM 81759 H2 WAT 8020 127.567 90.823 16.079 1.00 0.00 H TER 81761 WAT 8020 ATOM 81761 O WAT 8021 82.050 111.907 16.624 1.00 0.00 O ATOM 81762 H1 WAT 8021 81.517 111.232 17.044 1.00 0.00 H ATOM 81763 H2 WAT 8021 82.874 111.467 16.416 1.00 0.00 H TER 81765 WAT 8021 ATOM 81765 O WAT 8022 80.965 103.117 77.782 1.00 0.00 O ATOM 81766 H1 WAT 8022 80.017 103.232 77.713 1.00 0.00 H ATOM 81767 H2 WAT 8022 81.190 103.492 78.633 1.00 0.00 H TER 81769 WAT 8022 ATOM 81769 O WAT 8023 52.954 139.430 13.493 1.00 0.00 O ATOM 81770 H1 WAT 8023 52.162 139.881 13.198 1.00 0.00 H ATOM 81771 H2 WAT 8023 53.207 138.881 12.750 1.00 0.00 H TER 81773 WAT 8023 ATOM 81773 O WAT 8024 25.189 126.641 126.921 1.00 0.00 O ATOM 81774 H1 WAT 8024 25.115 125.714 127.148 1.00 0.00 H ATOM 81775 H2 WAT 8024 24.294 126.909 126.714 1.00 0.00 H TER 81777 WAT 8024 ATOM 81777 O WAT 8025 91.098 13.902 113.921 1.00 0.00 O ATOM 81778 H1 WAT 8025 90.923 14.803 113.647 1.00 0.00 H ATOM 81779 H2 WAT 8025 90.283 13.615 114.333 1.00 0.00 H TER 81781 WAT 8025 ATOM 81781 O WAT 8026 79.867 138.887 90.562 1.00 0.00 O ATOM 81782 H1 WAT 8026 80.808 138.952 90.396 1.00 0.00 H ATOM 81783 H2 WAT 8026 79.761 138.048 91.010 1.00 0.00 H TER 81785 WAT 8026 ATOM 81785 O WAT 8027 106.376 135.120 153.821 1.00 0.00 O ATOM 81786 H1 WAT 8027 105.846 134.737 153.122 1.00 0.00 H ATOM 81787 H2 WAT 8027 106.199 136.059 153.770 1.00 0.00 H TER 81789 WAT 8027 ATOM 81789 O WAT 8028 15.339 61.728 92.220 1.00 0.00 O ATOM 81790 H1 WAT 8028 14.546 61.202 92.110 1.00 0.00 H ATOM 81791 H2 WAT 8028 15.029 62.552 92.595 1.00 0.00 H TER 81793 WAT 8028 ATOM 81793 O WAT 8029 137.131 110.677 99.372 1.00 0.00 O ATOM 81794 H1 WAT 8029 137.742 110.664 98.635 1.00 0.00 H ATOM 81795 H2 WAT 8029 136.303 110.371 99.002 1.00 0.00 H TER 81797 WAT 8029 ATOM 81797 O WAT 8030 132.813 1.877 0.391 1.00 0.00 O ATOM 81798 H1 WAT 8030 132.612 2.806 0.505 1.00 0.00 H ATOM 81799 H2 WAT 8030 132.987 1.559 1.277 1.00 0.00 H TER 81801 WAT 8030 ATOM 81801 O WAT 8031 127.017 90.324 155.421 1.00 0.00 O ATOM 81802 H1 WAT 8031 126.216 90.834 155.540 1.00 0.00 H ATOM 81803 H2 WAT 8031 127.029 89.721 156.165 1.00 0.00 H TER 81805 WAT 8031 ATOM 81805 O WAT 8032 65.814 127.779 156.711 1.00 0.00 O ATOM 81806 H1 WAT 8032 65.372 128.006 155.893 1.00 0.00 H ATOM 81807 H2 WAT 8032 66.677 127.466 156.437 1.00 0.00 H TER 81809 WAT 8032 ATOM 81809 O WAT 8033 130.578 123.559 155.406 1.00 0.00 O ATOM 81810 H1 WAT 8033 129.915 123.385 156.074 1.00 0.00 H ATOM 81811 H2 WAT 8033 130.463 122.859 154.765 1.00 0.00 H TER 81813 WAT 8033 ATOM 81813 O WAT 8034 126.560 28.286 72.404 1.00 0.00 O ATOM 81814 H1 WAT 8034 126.026 27.906 73.101 1.00 0.00 H ATOM 81815 H2 WAT 8034 125.929 28.551 71.735 1.00 0.00 H TER 81817 WAT 8034 ATOM 81817 O WAT 8035 106.909 7.542 58.324 1.00 0.00 O ATOM 81818 H1 WAT 8035 106.270 7.971 57.755 1.00 0.00 H ATOM 81819 H2 WAT 8035 107.282 6.846 57.783 1.00 0.00 H TER 81821 WAT 8035 ATOM 81821 O WAT 8036 32.697 120.512 102.326 1.00 0.00 O ATOM 81822 H1 WAT 8036 31.924 121.019 102.076 1.00 0.00 H ATOM 81823 H2 WAT 8036 33.365 120.765 101.689 1.00 0.00 H TER 81825 WAT 8036 ATOM 81825 O WAT 8037 45.472 18.530 53.857 1.00 0.00 O ATOM 81826 H1 WAT 8037 46.293 18.099 54.094 1.00 0.00 H ATOM 81827 H2 WAT 8037 44.926 18.452 54.639 1.00 0.00 H TER 81829 WAT 8037 ATOM 81829 O WAT 8038 1.413 132.596 3.556 1.00 0.00 O ATOM 81830 H1 WAT 8038 0.755 132.729 4.239 1.00 0.00 H ATOM 81831 H2 WAT 8038 1.423 133.421 3.070 1.00 0.00 H TER 81833 WAT 8038 ATOM 81833 O WAT 8039 54.291 71.517 157.581 1.00 0.00 O ATOM 81834 H1 WAT 8039 54.225 72.155 158.291 1.00 0.00 H ATOM 81835 H2 WAT 8039 54.861 71.934 156.936 1.00 0.00 H TER 81837 WAT 8039 ATOM 81837 O WAT 8040 55.456 52.045 29.002 1.00 0.00 O ATOM 81838 H1 WAT 8040 56.136 51.416 29.243 1.00 0.00 H ATOM 81839 H2 WAT 8040 54.634 51.578 29.151 1.00 0.00 H TER 81841 WAT 8040 ATOM 81841 O WAT 8041 101.158 144.151 82.499 1.00 0.00 O ATOM 81842 H1 WAT 8041 101.400 144.390 81.604 1.00 0.00 H ATOM 81843 H2 WAT 8041 100.291 144.537 82.622 1.00 0.00 H TER 81845 WAT 8041 ATOM 81845 O WAT 8042 11.241 55.601 1.629 1.00 0.00 O ATOM 81846 H1 WAT 8042 10.355 55.727 1.289 1.00 0.00 H ATOM 81847 H2 WAT 8042 11.562 54.821 1.176 1.00 0.00 H TER 81849 WAT 8042 ATOM 81849 O WAT 8043 116.273 110.338 123.694 1.00 0.00 O ATOM 81850 H1 WAT 8043 116.124 110.402 122.751 1.00 0.00 H ATOM 81851 H2 WAT 8043 115.485 109.915 124.033 1.00 0.00 H TER 81853 WAT 8043 ATOM 81853 O WAT 8044 28.576 47.712 129.184 1.00 0.00 O ATOM 81854 H1 WAT 8044 28.501 47.042 129.863 1.00 0.00 H ATOM 81855 H2 WAT 8044 29.445 48.092 129.318 1.00 0.00 H TER 81857 WAT 8044 ATOM 81857 O WAT 8045 114.992 32.815 116.688 1.00 0.00 O ATOM 81858 H1 WAT 8045 114.894 33.158 117.577 1.00 0.00 H ATOM 81859 H2 WAT 8045 114.503 31.992 116.694 1.00 0.00 H TER 81861 WAT 8045 ATOM 81861 O WAT 8046 109.281 125.241 127.739 1.00 0.00 O ATOM 81862 H1 WAT 8046 109.094 125.565 128.620 1.00 0.00 H ATOM 81863 H2 WAT 8046 108.419 125.058 127.363 1.00 0.00 H TER 81865 WAT 8046 ATOM 81865 O WAT 8047 102.534 133.705 127.383 1.00 0.00 O ATOM 81866 H1 WAT 8047 103.420 134.067 127.394 1.00 0.00 H ATOM 81867 H2 WAT 8047 102.256 133.782 126.470 1.00 0.00 H TER 81869 WAT 8047 ATOM 81869 O WAT 8048 39.242 62.345 74.961 1.00 0.00 O ATOM 81870 H1 WAT 8048 39.241 62.052 75.873 1.00 0.00 H ATOM 81871 H2 WAT 8048 39.511 61.574 74.462 1.00 0.00 H TER 81873 WAT 8048 ATOM 81873 O WAT 8049 93.580 132.459 80.101 1.00 0.00 O ATOM 81874 H1 WAT 8049 93.215 132.341 79.224 1.00 0.00 H ATOM 81875 H2 WAT 8049 93.073 133.178 80.478 1.00 0.00 H TER 81877 WAT 8049 ATOM 81877 O WAT 8050 29.367 37.571 138.057 1.00 0.00 O ATOM 81878 H1 WAT 8050 29.783 38.205 138.640 1.00 0.00 H ATOM 81879 H2 WAT 8050 28.497 37.935 137.889 1.00 0.00 H TER 81881 WAT 8050 ATOM 81881 O WAT 8051 23.115 117.912 84.606 1.00 0.00 O ATOM 81882 H1 WAT 8051 22.764 118.735 84.267 1.00 0.00 H ATOM 81883 H2 WAT 8051 23.809 117.675 83.991 1.00 0.00 H TER 81885 WAT 8051 ATOM 81885 O WAT 8052 19.215 117.541 114.062 1.00 0.00 O ATOM 81886 H1 WAT 8052 19.506 117.692 113.163 1.00 0.00 H ATOM 81887 H2 WAT 8052 20.024 117.517 114.574 1.00 0.00 H TER 81889 WAT 8052 ATOM 81889 O WAT 8053 52.820 54.958 132.323 1.00 0.00 O ATOM 81890 H1 WAT 8053 53.535 55.506 132.645 1.00 0.00 H ATOM 81891 H2 WAT 8053 52.286 54.781 133.097 1.00 0.00 H TER 81893 WAT 8053 ATOM 81893 O WAT 8054 93.723 12.526 92.796 1.00 0.00 O ATOM 81894 H1 WAT 8054 94.668 12.527 92.949 1.00 0.00 H ATOM 81895 H2 WAT 8054 93.634 12.641 91.850 1.00 0.00 H TER 81897 WAT 8054 ATOM 81897 O WAT 8055 75.214 77.859 85.167 1.00 0.00 O ATOM 81898 H1 WAT 8055 74.367 77.547 84.848 1.00 0.00 H ATOM 81899 H2 WAT 8055 75.247 77.573 86.080 1.00 0.00 H TER 81901 WAT 8055 ATOM 81901 O WAT 8056 118.885 21.974 1.650 1.00 0.00 O ATOM 81902 H1 WAT 8056 118.146 21.648 1.137 1.00 0.00 H ATOM 81903 H2 WAT 8056 119.346 21.184 1.933 1.00 0.00 H TER 81905 WAT 8056 ATOM 81905 O WAT 8057 110.474 55.136 119.532 1.00 0.00 O ATOM 81906 H1 WAT 8057 110.392 54.222 119.803 1.00 0.00 H ATOM 81907 H2 WAT 8057 109.595 55.382 119.246 1.00 0.00 H TER 81909 WAT 8057 ATOM 81909 O WAT 8058 19.179 31.686 19.468 1.00 0.00 O ATOM 81910 H1 WAT 8058 19.753 31.706 18.702 1.00 0.00 H ATOM 81911 H2 WAT 8058 19.138 32.597 19.759 1.00 0.00 H TER 81913 WAT 8058 ATOM 81913 O WAT 8059 136.391 97.558 90.429 1.00 0.00 O ATOM 81914 H1 WAT 8059 135.777 97.616 91.160 1.00 0.00 H ATOM 81915 H2 WAT 8059 137.034 98.246 90.600 1.00 0.00 H TER 81917 WAT 8059 ATOM 81917 O WAT 8060 39.679 78.136 82.020 1.00 0.00 O ATOM 81918 H1 WAT 8060 39.397 79.051 82.021 1.00 0.00 H ATOM 81919 H2 WAT 8060 39.227 77.748 81.271 1.00 0.00 H TER 81921 WAT 8060 ATOM 81921 O WAT 8061 32.323 24.665 65.847 1.00 0.00 O ATOM 81922 H1 WAT 8061 32.442 23.725 65.982 1.00 0.00 H ATOM 81923 H2 WAT 8061 31.792 24.728 65.053 1.00 0.00 H TER 81925 WAT 8061 ATOM 81925 O WAT 8062 84.277 141.725 73.938 1.00 0.00 O ATOM 81926 H1 WAT 8062 84.004 142.627 73.770 1.00 0.00 H ATOM 81927 H2 WAT 8062 84.034 141.567 74.850 1.00 0.00 H TER 81929 WAT 8062 ATOM 81929 O WAT 8063 55.295 119.022 88.982 1.00 0.00 O ATOM 81930 H1 WAT 8063 55.094 119.323 88.096 1.00 0.00 H ATOM 81931 H2 WAT 8063 54.857 118.174 89.053 1.00 0.00 H TER 81933 WAT 8063 ATOM 81933 O WAT 8064 69.808 103.523 4.587 1.00 0.00 O ATOM 81934 H1 WAT 8064 70.750 103.365 4.532 1.00 0.00 H ATOM 81935 H2 WAT 8064 69.416 102.650 4.548 1.00 0.00 H TER 81937 WAT 8064 ATOM 81937 O WAT 8065 62.923 94.836 99.078 1.00 0.00 O ATOM 81938 H1 WAT 8065 62.244 95.414 98.730 1.00 0.00 H ATOM 81939 H2 WAT 8065 63.736 95.161 98.690 1.00 0.00 H TER 81941 WAT 8065 ATOM 81941 O WAT 8066 108.965 131.230 84.920 1.00 0.00 O ATOM 81942 H1 WAT 8066 109.336 131.938 84.393 1.00 0.00 H ATOM 81943 H2 WAT 8066 108.375 130.771 84.322 1.00 0.00 H TER 81945 WAT 8066 ATOM 81945 O WAT 8067 17.427 22.791 69.974 1.00 0.00 O ATOM 81946 H1 WAT 8067 18.300 22.563 69.653 1.00 0.00 H ATOM 81947 H2 WAT 8067 16.941 23.044 69.189 1.00 0.00 H TER 81949 WAT 8067 ATOM 81949 O WAT 8068 55.535 84.364 141.532 1.00 0.00 O ATOM 81950 H1 WAT 8068 54.772 84.926 141.666 1.00 0.00 H ATOM 81951 H2 WAT 8068 56.174 84.670 142.177 1.00 0.00 H TER 81953 WAT 8068 ATOM 81953 O WAT 8069 92.094 73.776 15.138 1.00 0.00 O ATOM 81954 H1 WAT 8069 91.610 73.013 15.455 1.00 0.00 H ATOM 81955 H2 WAT 8069 92.885 73.799 15.677 1.00 0.00 H TER 81957 WAT 8069 ATOM 81957 O WAT 8070 14.434 143.223 88.299 1.00 0.00 O ATOM 81958 H1 WAT 8070 14.650 143.883 87.641 1.00 0.00 H ATOM 81959 H2 WAT 8070 13.875 143.683 88.926 1.00 0.00 H TER 81961 WAT 8070 ATOM 81961 O WAT 8071 14.272 116.974 124.595 1.00 0.00 O ATOM 81962 H1 WAT 8071 14.116 116.785 125.520 1.00 0.00 H ATOM 81963 H2 WAT 8071 14.699 117.831 124.594 1.00 0.00 H TER 81965 WAT 8071 ATOM 81965 O WAT 8072 37.408 113.587 65.521 1.00 0.00 O ATOM 81966 H1 WAT 8072 38.187 114.123 65.374 1.00 0.00 H ATOM 81967 H2 WAT 8072 37.501 113.271 66.420 1.00 0.00 H TER 81969 WAT 8072 ATOM 81969 O WAT 8073 102.456 90.495 100.020 1.00 0.00 O ATOM 81970 H1 WAT 8073 102.135 89.816 99.427 1.00 0.00 H ATOM 81971 H2 WAT 8073 102.733 91.206 99.442 1.00 0.00 H TER 81973 WAT 8073 ATOM 81973 O WAT 8074 26.729 88.977 77.845 1.00 0.00 O ATOM 81974 H1 WAT 8074 27.329 88.779 77.126 1.00 0.00 H ATOM 81975 H2 WAT 8074 27.212 89.592 78.398 1.00 0.00 H TER 81977 WAT 8074 ATOM 81977 O WAT 8075 135.149 64.801 13.005 1.00 0.00 O ATOM 81978 H1 WAT 8075 135.776 65.421 13.377 1.00 0.00 H ATOM 81979 H2 WAT 8075 134.393 64.844 13.591 1.00 0.00 H TER 81981 WAT 8075 ATOM 81981 O WAT 8076 50.780 47.213 144.943 1.00 0.00 O ATOM 81982 H1 WAT 8076 50.452 48.011 145.358 1.00 0.00 H ATOM 81983 H2 WAT 8076 50.352 47.195 144.087 1.00 0.00 H TER 81985 WAT 8076 ATOM 81985 O WAT 8077 25.325 9.446 7.091 1.00 0.00 O ATOM 81986 H1 WAT 8077 25.821 8.746 6.668 1.00 0.00 H ATOM 81987 H2 WAT 8077 25.161 10.079 6.392 1.00 0.00 H TER 81989 WAT 8077 ATOM 81989 O WAT 8078 30.120 49.015 58.919 1.00 0.00 O ATOM 81990 H1 WAT 8078 30.087 49.067 57.964 1.00 0.00 H ATOM 81991 H2 WAT 8078 29.501 48.320 59.142 1.00 0.00 H TER 81993 WAT 8078 ATOM 81993 O WAT 8079 38.136 46.461 116.805 1.00 0.00 O ATOM 81994 H1 WAT 8079 37.398 46.256 116.232 1.00 0.00 H ATOM 81995 H2 WAT 8079 38.900 46.110 116.347 1.00 0.00 H TER 81997 WAT 8079 ATOM 81997 O WAT 8080 27.794 76.081 86.393 1.00 0.00 O ATOM 81998 H1 WAT 8080 28.438 75.672 85.817 1.00 0.00 H ATOM 81999 H2 WAT 8080 27.117 75.414 86.509 1.00 0.00 H TER 82001 WAT 8080 ATOM 82001 O WAT 8081 19.417 103.881 106.174 1.00 0.00 O ATOM 82002 H1 WAT 8081 19.627 103.651 105.269 1.00 0.00 H ATOM 82003 H2 WAT 8081 18.527 104.232 106.132 1.00 0.00 H TER 82005 WAT 8081 ATOM 82005 O WAT 8082 25.445 56.229 9.867 1.00 0.00 O ATOM 82006 H1 WAT 8082 24.939 55.423 9.969 1.00 0.00 H ATOM 82007 H2 WAT 8082 25.127 56.801 10.565 1.00 0.00 H TER 82009 WAT 8082 ATOM 82009 O WAT 8083 60.396 96.546 90.430 1.00 0.00 O ATOM 82010 H1 WAT 8083 60.644 97.469 90.484 1.00 0.00 H ATOM 82011 H2 WAT 8083 60.942 96.192 89.727 1.00 0.00 H TER 82013 WAT 8083 ATOM 82013 O WAT 8084 25.670 100.669 68.904 1.00 0.00 O ATOM 82014 H1 WAT 8084 26.353 101.201 68.496 1.00 0.00 H ATOM 82015 H2 WAT 8084 25.504 99.968 68.274 1.00 0.00 H TER 82017 WAT 8084 ATOM 82017 O WAT 8085 117.754 56.514 74.727 1.00 0.00 O ATOM 82018 H1 WAT 8085 118.683 56.622 74.932 1.00 0.00 H ATOM 82019 H2 WAT 8085 117.739 55.874 74.015 1.00 0.00 H TER 82021 WAT 8085 ATOM 82021 O WAT 8086 41.778 63.657 101.988 1.00 0.00 O ATOM 82022 H1 WAT 8086 41.870 64.025 101.109 1.00 0.00 H ATOM 82023 H2 WAT 8086 42.571 63.136 102.113 1.00 0.00 H TER 82025 WAT 8086 ATOM 82025 O WAT 8087 145.200 127.287 137.839 1.00 0.00 O ATOM 82026 H1 WAT 8087 145.273 126.335 137.894 1.00 0.00 H ATOM 82027 H2 WAT 8087 144.992 127.460 136.921 1.00 0.00 H TER 82029 WAT 8087 ATOM 82029 O WAT 8088 14.730 127.547 60.275 1.00 0.00 O ATOM 82030 H1 WAT 8088 15.132 127.784 59.439 1.00 0.00 H ATOM 82031 H2 WAT 8088 14.599 128.383 60.723 1.00 0.00 H TER 82033 WAT 8088 ATOM 82033 O WAT 8089 119.719 15.904 113.393 1.00 0.00 O ATOM 82034 H1 WAT 8089 120.433 15.848 114.027 1.00 0.00 H ATOM 82035 H2 WAT 8089 120.108 16.335 112.632 1.00 0.00 H TER 82037 WAT 8089 ATOM 82037 O WAT 8090 21.995 110.661 111.393 1.00 0.00 O ATOM 82038 H1 WAT 8090 22.580 110.142 110.841 1.00 0.00 H ATOM 82039 H2 WAT 8090 22.500 111.445 111.608 1.00 0.00 H TER 82041 WAT 8090 ATOM 82041 O WAT 8091 139.649 113.933 144.203 1.00 0.00 O ATOM 82042 H1 WAT 8091 139.331 114.698 143.723 1.00 0.00 H ATOM 82043 H2 WAT 8091 139.269 113.186 143.742 1.00 0.00 H TER 82045 WAT 8091 ATOM 82045 O WAT 8092 103.527 9.555 103.016 1.00 0.00 O ATOM 82046 H1 WAT 8092 103.751 9.474 103.943 1.00 0.00 H ATOM 82047 H2 WAT 8092 103.790 10.445 102.782 1.00 0.00 H TER 82049 WAT 8092 ATOM 82049 O WAT 8093 9.000 29.805 17.163 1.00 0.00 O ATOM 82050 H1 WAT 8093 8.242 29.349 16.799 1.00 0.00 H ATOM 82051 H2 WAT 8093 9.105 30.577 16.607 1.00 0.00 H TER 82053 WAT 8093 ATOM 82053 O WAT 8094 65.487 136.853 129.775 1.00 0.00 O ATOM 82054 H1 WAT 8094 65.993 136.132 130.149 1.00 0.00 H ATOM 82055 H2 WAT 8094 65.142 137.324 130.533 1.00 0.00 H TER 82057 WAT 8094 ATOM 82057 O WAT 8095 133.370 57.240 109.622 1.00 0.00 O ATOM 82058 H1 WAT 8095 133.404 56.701 110.413 1.00 0.00 H ATOM 82059 H2 WAT 8095 133.515 58.133 109.934 1.00 0.00 H TER 82061 WAT 8095 ATOM 82061 O WAT 8096 77.534 63.549 105.696 1.00 0.00 O ATOM 82062 H1 WAT 8096 78.024 64.021 105.023 1.00 0.00 H ATOM 82063 H2 WAT 8096 77.468 62.654 105.361 1.00 0.00 H TER 82065 WAT 8096 ATOM 82065 O WAT 8097 94.366 107.187 67.351 1.00 0.00 O ATOM 82066 H1 WAT 8097 94.695 107.937 66.855 1.00 0.00 H ATOM 82067 H2 WAT 8097 94.242 107.523 68.239 1.00 0.00 H TER 82069 WAT 8097 ATOM 82069 O WAT 8098 92.937 35.794 120.390 1.00 0.00 O ATOM 82070 H1 WAT 8098 92.962 35.240 119.610 1.00 0.00 H ATOM 82071 H2 WAT 8098 92.533 36.609 120.091 1.00 0.00 H TER 82073 WAT 8098 ATOM 82073 O WAT 8099 112.636 129.942 77.390 1.00 0.00 O ATOM 82074 H1 WAT 8099 112.156 130.347 76.667 1.00 0.00 H ATOM 82075 H2 WAT 8099 113.390 129.525 76.974 1.00 0.00 H TER 82077 WAT 8099 ATOM 82077 O WAT 8100 4.635 111.739 86.000 1.00 0.00 O ATOM 82078 H1 WAT 8100 3.938 112.092 85.447 1.00 0.00 H ATOM 82079 H2 WAT 8100 5.400 111.700 85.426 1.00 0.00 H TER 82081 WAT 8100 ATOM 82081 O WAT 8101 138.267 56.225 104.076 1.00 0.00 O ATOM 82082 H1 WAT 8101 138.088 56.867 103.388 1.00 0.00 H ATOM 82083 H2 WAT 8101 137.467 55.702 104.128 1.00 0.00 H TER 82085 WAT 8101 ATOM 82085 O WAT 8102 132.994 145.055 133.509 1.00 0.00 O ATOM 82086 H1 WAT 8102 132.845 144.110 133.491 1.00 0.00 H ATOM 82087 H2 WAT 8102 133.149 145.256 134.433 1.00 0.00 H TER 82089 WAT 8102 ATOM 82089 O WAT 8103 143.974 114.495 85.437 1.00 0.00 O ATOM 82090 H1 WAT 8103 143.518 114.154 86.207 1.00 0.00 H ATOM 82091 H2 WAT 8103 143.386 114.303 84.707 1.00 0.00 H TER 82093 WAT 8103 ATOM 82093 O WAT 8104 107.459 136.869 129.362 1.00 0.00 O ATOM 82094 H1 WAT 8104 106.973 137.228 130.104 1.00 0.00 H ATOM 82095 H2 WAT 8104 108.296 136.591 129.735 1.00 0.00 H TER 82097 WAT 8104 ATOM 82097 O WAT 8105 92.225 40.942 135.522 1.00 0.00 O ATOM 82098 H1 WAT 8105 91.730 40.816 136.331 1.00 0.00 H ATOM 82099 H2 WAT 8105 93.077 41.269 135.811 1.00 0.00 H TER 82101 WAT 8105 ATOM 82101 O WAT 8106 29.361 11.246 19.397 1.00 0.00 O ATOM 82102 H1 WAT 8106 30.111 11.827 19.269 1.00 0.00 H ATOM 82103 H2 WAT 8106 29.573 10.752 20.189 1.00 0.00 H TER 82105 WAT 8106 ATOM 82105 O WAT 8107 53.382 65.194 138.452 1.00 0.00 O ATOM 82106 H1 WAT 8107 53.975 65.018 139.183 1.00 0.00 H ATOM 82107 H2 WAT 8107 53.945 65.566 137.772 1.00 0.00 H TER 82109 WAT 8107 ATOM 82109 O WAT 8108 89.768 32.723 86.142 1.00 0.00 O ATOM 82110 H1 WAT 8108 90.284 33.522 86.249 1.00 0.00 H ATOM 82111 H2 WAT 8108 90.387 32.085 85.788 1.00 0.00 H TER 82113 WAT 8108 ATOM 82113 O WAT 8109 38.579 95.615 12.719 1.00 0.00 O ATOM 82114 H1 WAT 8109 38.532 96.069 13.561 1.00 0.00 H ATOM 82115 H2 WAT 8109 39.176 94.883 12.875 1.00 0.00 H TER 82117 WAT 8109 ATOM 82117 O WAT 8110 55.519 46.744 105.865 1.00 0.00 O ATOM 82118 H1 WAT 8110 55.098 46.386 106.647 1.00 0.00 H ATOM 82119 H2 WAT 8110 56.452 46.753 106.079 1.00 0.00 H TER 82121 WAT 8110 ATOM 82121 O WAT 8111 96.485 39.981 1.792 1.00 0.00 O ATOM 82122 H1 WAT 8111 97.241 39.544 2.186 1.00 0.00 H ATOM 82123 H2 WAT 8111 96.475 39.671 0.886 1.00 0.00 H TER 82125 WAT 8111 ATOM 82125 O WAT 8112 19.365 30.945 132.514 1.00 0.00 O ATOM 82126 H1 WAT 8112 18.766 30.692 133.217 1.00 0.00 H ATOM 82127 H2 WAT 8112 18.875 30.775 131.710 1.00 0.00 H TER 82129 WAT 8112 ATOM 82129 O WAT 8113 26.550 30.729 77.423 1.00 0.00 O ATOM 82130 H1 WAT 8113 27.485 30.569 77.557 1.00 0.00 H ATOM 82131 H2 WAT 8113 26.127 29.915 77.694 1.00 0.00 H TER 82133 WAT 8113 ATOM 82133 O WAT 8114 34.105 78.054 137.729 1.00 0.00 O ATOM 82134 H1 WAT 8114 34.369 77.527 138.483 1.00 0.00 H ATOM 82135 H2 WAT 8114 33.636 78.797 138.108 1.00 0.00 H TER 82137 WAT 8114 ATOM 82137 O WAT 8115 137.706 136.281 19.700 1.00 0.00 O ATOM 82138 H1 WAT 8115 138.209 136.949 20.165 1.00 0.00 H ATOM 82139 H2 WAT 8115 136.853 136.687 19.545 1.00 0.00 H TER 82141 WAT 8115 ATOM 82141 O WAT 8116 21.653 67.512 99.777 1.00 0.00 O ATOM 82142 H1 WAT 8116 22.563 67.261 99.937 1.00 0.00 H ATOM 82143 H2 WAT 8116 21.609 67.664 98.833 1.00 0.00 H TER 82145 WAT 8116 ATOM 82145 O WAT 8117 79.511 15.528 129.289 1.00 0.00 O ATOM 82146 H1 WAT 8117 78.854 14.940 129.661 1.00 0.00 H ATOM 82147 H2 WAT 8117 79.746 16.112 130.010 1.00 0.00 H TER 82149 WAT 8117 ATOM 82149 O WAT 8118 38.829 55.367 157.099 1.00 0.00 O ATOM 82150 H1 WAT 8118 38.409 54.920 156.365 1.00 0.00 H ATOM 82151 H2 WAT 8118 39.631 54.868 157.256 1.00 0.00 H TER 82153 WAT 8118 ATOM 82153 O WAT 8119 42.105 93.474 12.875 1.00 0.00 O ATOM 82154 H1 WAT 8119 42.851 92.977 13.209 1.00 0.00 H ATOM 82155 H2 WAT 8119 41.365 93.183 13.408 1.00 0.00 H TER 82157 WAT 8119 ATOM 82157 O WAT 8120 83.770 142.708 89.826 1.00 0.00 O ATOM 82158 H1 WAT 8120 83.158 143.443 89.883 1.00 0.00 H ATOM 82159 H2 WAT 8120 83.497 142.230 89.044 1.00 0.00 H TER 82161 WAT 8120 ATOM 82161 O WAT 8121 1.200 96.124 2.665 1.00 0.00 O ATOM 82162 H1 WAT 8121 0.863 95.803 1.829 1.00 0.00 H ATOM 82163 H2 WAT 8121 1.984 95.599 2.825 1.00 0.00 H TER 82165 WAT 8121 ATOM 82165 O WAT 8122 66.536 17.183 57.262 1.00 0.00 O ATOM 82166 H1 WAT 8122 67.168 16.729 56.706 1.00 0.00 H ATOM 82167 H2 WAT 8122 66.263 17.941 56.745 1.00 0.00 H TER 82169 WAT 8122 ATOM 82169 O WAT 8123 60.690 67.314 103.396 1.00 0.00 O ATOM 82170 H1 WAT 8123 61.188 68.007 102.962 1.00 0.00 H ATOM 82171 H2 WAT 8123 60.358 66.773 102.679 1.00 0.00 H TER 82173 WAT 8123 ATOM 82173 O WAT 8124 53.811 71.677 62.895 1.00 0.00 O ATOM 82174 H1 WAT 8124 54.757 71.537 62.902 1.00 0.00 H ATOM 82175 H2 WAT 8124 53.531 71.382 62.028 1.00 0.00 H TER 82177 WAT 8124 ATOM 82177 O WAT 8125 29.819 23.835 102.396 1.00 0.00 O ATOM 82178 H1 WAT 8125 29.713 24.776 102.255 1.00 0.00 H ATOM 82179 H2 WAT 8125 30.395 23.549 101.687 1.00 0.00 H TER 82181 WAT 8125 ATOM 82181 O WAT 8126 60.652 17.730 68.342 1.00 0.00 O ATOM 82182 H1 WAT 8126 61.516 17.625 68.742 1.00 0.00 H ATOM 82183 H2 WAT 8126 60.440 18.655 68.470 1.00 0.00 H TER 82185 WAT 8126 ATOM 82185 O WAT 8127 96.643 10.714 73.590 1.00 0.00 O ATOM 82186 H1 WAT 8127 96.045 11.403 73.879 1.00 0.00 H ATOM 82187 H2 WAT 8127 96.219 9.900 73.862 1.00 0.00 H TER 82189 WAT 8127 ATOM 82189 O WAT 8128 143.831 7.089 143.540 1.00 0.00 O ATOM 82190 H1 WAT 8128 143.020 7.526 143.280 1.00 0.00 H ATOM 82191 H2 WAT 8128 144.089 7.528 144.351 1.00 0.00 H TER 82193 WAT 8128 ATOM 82193 O WAT 8129 62.304 87.897 21.446 1.00 0.00 O ATOM 82194 H1 WAT 8129 61.387 87.936 21.718 1.00 0.00 H ATOM 82195 H2 WAT 8129 62.799 87.966 22.262 1.00 0.00 H TER 82197 WAT 8129 ATOM 82197 O WAT 8130 132.338 65.302 129.861 1.00 0.00 O ATOM 82198 H1 WAT 8130 132.622 64.668 129.203 1.00 0.00 H ATOM 82199 H2 WAT 8130 132.813 66.104 129.643 1.00 0.00 H TER 82201 WAT 8130 ATOM 82201 O WAT 8131 85.476 10.812 63.056 1.00 0.00 O ATOM 82202 H1 WAT 8131 85.574 11.048 63.979 1.00 0.00 H ATOM 82203 H2 WAT 8131 84.671 11.250 62.781 1.00 0.00 H TER 82205 WAT 8131 ATOM 82205 O WAT 8132 10.435 12.610 66.433 1.00 0.00 O ATOM 82206 H1 WAT 8132 10.643 12.560 65.500 1.00 0.00 H ATOM 82207 H2 WAT 8132 10.605 11.728 66.764 1.00 0.00 H TER 82209 WAT 8132 ATOM 82209 O WAT 8133 18.071 39.170 3.813 1.00 0.00 O ATOM 82210 H1 WAT 8133 18.093 40.090 4.076 1.00 0.00 H ATOM 82211 H2 WAT 8133 17.261 38.831 4.196 1.00 0.00 H TER 82213 WAT 8133 ATOM 82213 O WAT 8134 8.122 87.753 103.928 1.00 0.00 O ATOM 82214 H1 WAT 8134 8.299 88.410 103.255 1.00 0.00 H ATOM 82215 H2 WAT 8134 8.273 88.210 104.755 1.00 0.00 H TER 82217 WAT 8134 ATOM 82217 O WAT 8135 127.569 92.053 130.774 1.00 0.00 O ATOM 82218 H1 WAT 8135 128.053 91.228 130.802 1.00 0.00 H ATOM 82219 H2 WAT 8135 127.553 92.291 129.847 1.00 0.00 H TER 82221 WAT 8135 ATOM 82221 O WAT 8136 60.831 59.075 155.040 1.00 0.00 O ATOM 82222 H1 WAT 8136 61.487 58.554 154.578 1.00 0.00 H ATOM 82223 H2 WAT 8136 60.597 58.545 155.802 1.00 0.00 H TER 82225 WAT 8136 ATOM 82225 O WAT 8137 132.607 80.560 70.897 1.00 0.00 O ATOM 82226 H1 WAT 8137 132.365 80.357 69.993 1.00 0.00 H ATOM 82227 H2 WAT 8137 131.906 81.131 71.210 1.00 0.00 H TER 82229 WAT 8137 ATOM 82229 O WAT 8138 73.131 137.016 14.310 1.00 0.00 O ATOM 82230 H1 WAT 8138 74.079 136.945 14.201 1.00 0.00 H ATOM 82231 H2 WAT 8138 72.822 136.110 14.311 1.00 0.00 H TER 82233 WAT 8138 ATOM 82233 O WAT 8139 8.083 31.390 157.504 1.00 0.00 O ATOM 82234 H1 WAT 8139 8.654 30.730 157.897 1.00 0.00 H ATOM 82235 H2 WAT 8139 8.118 31.208 156.565 1.00 0.00 H TER 82237 WAT 8139 ATOM 82237 O WAT 8140 118.021 0.561 12.347 1.00 0.00 O ATOM 82238 H1 WAT 8140 118.069 -0.053 13.081 1.00 0.00 H ATOM 82239 H2 WAT 8140 117.577 0.071 11.654 1.00 0.00 H TER 82241 WAT 8140 ATOM 82241 O WAT 8141 27.863 16.772 107.997 1.00 0.00 O ATOM 82242 H1 WAT 8141 27.687 17.305 108.773 1.00 0.00 H ATOM 82243 H2 WAT 8141 28.807 16.856 107.859 1.00 0.00 H TER 82245 WAT 8141 ATOM 82245 O WAT 8142 79.411 67.451 93.810 1.00 0.00 O ATOM 82246 H1 WAT 8142 79.836 68.274 93.572 1.00 0.00 H ATOM 82247 H2 WAT 8142 80.118 66.806 93.810 1.00 0.00 H TER 82249 WAT 8142 ATOM 82249 O WAT 8143 19.408 65.155 126.552 1.00 0.00 O ATOM 82250 H1 WAT 8143 20.278 65.193 126.154 1.00 0.00 H ATOM 82251 H2 WAT 8143 19.423 65.832 127.228 1.00 0.00 H TER 82253 WAT 8143 ATOM 82253 O WAT 8144 145.938 13.537 146.145 1.00 0.00 O ATOM 82254 H1 WAT 8144 145.202 13.863 146.663 1.00 0.00 H ATOM 82255 H2 WAT 8144 145.532 13.005 145.461 1.00 0.00 H TER 82257 WAT 8144 ATOM 82257 O WAT 8145 133.450 77.126 154.042 1.00 0.00 O ATOM 82258 H1 WAT 8145 134.270 76.695 153.801 1.00 0.00 H ATOM 82259 H2 WAT 8145 132.896 77.040 153.266 1.00 0.00 H TER 82261 WAT 8145 ATOM 82261 O WAT 8146 114.723 73.135 70.098 1.00 0.00 O ATOM 82262 H1 WAT 8146 113.857 73.528 69.990 1.00 0.00 H ATOM 82263 H2 WAT 8146 114.833 73.053 71.045 1.00 0.00 H TER 82265 WAT 8146 ATOM 82265 O WAT 8147 23.748 2.181 75.053 1.00 0.00 O ATOM 82266 H1 WAT 8147 23.055 2.748 74.718 1.00 0.00 H ATOM 82267 H2 WAT 8147 24.542 2.490 74.617 1.00 0.00 H TER 82269 WAT 8147 ATOM 82269 O WAT 8148 48.511 93.337 76.025 1.00 0.00 O ATOM 82270 H1 WAT 8148 49.302 93.472 76.547 1.00 0.00 H ATOM 82271 H2 WAT 8148 48.834 93.140 75.146 1.00 0.00 H TER 82273 WAT 8148 ATOM 82273 O WAT 8149 65.740 11.481 136.181 1.00 0.00 O ATOM 82274 H1 WAT 8149 65.161 11.611 135.430 1.00 0.00 H ATOM 82275 H2 WAT 8149 66.231 12.300 136.250 1.00 0.00 H TER 82277 WAT 8149 ATOM 82277 O WAT 8150 51.668 137.733 147.922 1.00 0.00 O ATOM 82278 H1 WAT 8150 52.595 137.777 147.685 1.00 0.00 H ATOM 82279 H2 WAT 8150 51.463 136.798 147.912 1.00 0.00 H TER 82281 WAT 8150 ATOM 82281 O WAT 8151 18.932 104.843 94.861 1.00 0.00 O ATOM 82282 H1 WAT 8151 18.084 105.202 95.122 1.00 0.00 H ATOM 82283 H2 WAT 8151 18.922 104.875 93.904 1.00 0.00 H TER 82285 WAT 8151 ATOM 82285 O WAT 8152 53.740 80.736 59.334 1.00 0.00 O ATOM 82286 H1 WAT 8152 53.522 81.399 59.989 1.00 0.00 H ATOM 82287 H2 WAT 8152 54.007 79.973 59.845 1.00 0.00 H TER 82289 WAT 8152 ATOM 82289 O WAT 8153 113.549 126.616 87.831 1.00 0.00 O ATOM 82290 H1 WAT 8153 112.809 126.011 87.769 1.00 0.00 H ATOM 82291 H2 WAT 8153 113.252 127.405 87.379 1.00 0.00 H TER 82293 WAT 8153 ATOM 82293 O WAT 8154 30.864 59.574 67.006 1.00 0.00 O ATOM 82294 H1 WAT 8154 30.275 59.742 66.270 1.00 0.00 H ATOM 82295 H2 WAT 8154 31.142 60.443 67.294 1.00 0.00 H TER 82297 WAT 8154 ATOM 82297 O WAT 8155 4.037 19.030 66.350 1.00 0.00 O ATOM 82298 H1 WAT 8155 3.329 18.959 65.709 1.00 0.00 H ATOM 82299 H2 WAT 8155 4.469 19.857 66.138 1.00 0.00 H TER 82301 WAT 8155 ATOM 82301 O WAT 8156 66.842 133.418 133.938 1.00 0.00 O ATOM 82302 H1 WAT 8156 66.741 133.419 134.890 1.00 0.00 H ATOM 82303 H2 WAT 8156 67.571 134.016 133.774 1.00 0.00 H TER 82305 WAT 8156 ATOM 82305 O WAT 8157 133.671 80.383 151.016 1.00 0.00 O ATOM 82306 H1 WAT 8157 133.311 81.266 150.928 1.00 0.00 H ATOM 82307 H2 WAT 8157 133.815 80.276 151.957 1.00 0.00 H TER 82309 WAT 8157 ATOM 82309 O WAT 8158 140.557 50.838 87.563 1.00 0.00 O ATOM 82310 H1 WAT 8158 140.878 50.148 88.144 1.00 0.00 H ATOM 82311 H2 WAT 8158 141.337 51.349 87.344 1.00 0.00 H TER 82313 WAT 8158 ATOM 82313 O WAT 8159 92.861 12.145 104.894 1.00 0.00 O ATOM 82314 H1 WAT 8159 93.400 12.677 105.479 1.00 0.00 H ATOM 82315 H2 WAT 8159 93.438 11.434 104.616 1.00 0.00 H TER 82317 WAT 8159 ATOM 82317 O WAT 8160 61.203 98.430 142.776 1.00 0.00 O ATOM 82318 H1 WAT 8160 61.541 99.238 143.164 1.00 0.00 H ATOM 82319 H2 WAT 8160 61.922 97.805 142.860 1.00 0.00 H TER 82321 WAT 8160 ATOM 82321 O WAT 8161 22.093 8.152 153.668 1.00 0.00 O ATOM 82322 H1 WAT 8161 22.864 7.761 153.258 1.00 0.00 H ATOM 82323 H2 WAT 8161 21.718 7.447 154.196 1.00 0.00 H TER 82325 WAT 8161 ATOM 82325 O WAT 8162 109.588 85.646 108.262 1.00 0.00 O ATOM 82326 H1 WAT 8162 109.639 84.696 108.366 1.00 0.00 H ATOM 82327 H2 WAT 8162 109.450 85.977 109.149 1.00 0.00 H TER 82329 WAT 8162 ATOM 82329 O WAT 8163 26.576 52.507 120.453 1.00 0.00 O ATOM 82330 H1 WAT 8163 27.226 53.093 120.065 1.00 0.00 H ATOM 82331 H2 WAT 8163 26.646 52.662 121.395 1.00 0.00 H TER 82333 WAT 8163 ATOM 82333 O WAT 8164 55.591 34.380 83.457 1.00 0.00 O ATOM 82334 H1 WAT 8164 55.331 33.893 84.239 1.00 0.00 H ATOM 82335 H2 WAT 8164 56.036 33.733 82.909 1.00 0.00 H TER 82337 WAT 8164 ATOM 82337 O WAT 8165 86.982 6.202 111.645 1.00 0.00 O ATOM 82338 H1 WAT 8165 86.489 6.508 110.884 1.00 0.00 H ATOM 82339 H2 WAT 8165 87.214 7.002 112.118 1.00 0.00 H TER 82341 WAT 8165 ATOM 82341 O WAT 8166 80.610 36.463 2.773 1.00 0.00 O ATOM 82342 H1 WAT 8166 79.774 36.246 2.361 1.00 0.00 H ATOM 82343 H2 WAT 8166 80.378 36.717 3.666 1.00 0.00 H TER 82345 WAT 8166 ATOM 82345 O WAT 8167 25.173 140.065 67.517 1.00 0.00 O ATOM 82346 H1 WAT 8167 25.440 139.162 67.688 1.00 0.00 H ATOM 82347 H2 WAT 8167 24.332 140.154 67.964 1.00 0.00 H TER 82349 WAT 8167 ATOM 82349 O WAT 8168 76.054 84.838 89.307 1.00 0.00 O ATOM 82350 H1 WAT 8168 75.550 85.625 89.103 1.00 0.00 H ATOM 82351 H2 WAT 8168 75.592 84.442 90.046 1.00 0.00 H TER 82353 WAT 8168 ATOM 82353 O WAT 8169 133.000 63.039 86.766 1.00 0.00 O ATOM 82354 H1 WAT 8169 133.364 62.582 86.008 1.00 0.00 H ATOM 82355 H2 WAT 8169 132.498 62.370 87.231 1.00 0.00 H TER 82357 WAT 8169 ATOM 82357 O WAT 8170 94.734 86.195 80.606 1.00 0.00 O ATOM 82358 H1 WAT 8170 94.737 85.275 80.871 1.00 0.00 H ATOM 82359 H2 WAT 8170 95.468 86.271 79.995 1.00 0.00 H TER 82361 WAT 8170 ATOM 82361 O WAT 8171 12.326 67.883 142.411 1.00 0.00 O ATOM 82362 H1 WAT 8171 12.134 68.587 143.031 1.00 0.00 H ATOM 82363 H2 WAT 8171 11.944 67.102 142.811 1.00 0.00 H TER 82365 WAT 8171 ATOM 82365 O WAT 8172 122.348 25.764 122.693 1.00 0.00 O ATOM 82366 H1 WAT 8172 122.524 26.377 121.979 1.00 0.00 H ATOM 82367 H2 WAT 8172 122.339 26.309 123.480 1.00 0.00 H TER 82369 WAT 8172 ATOM 82369 O WAT 8173 45.565 72.939 103.991 1.00 0.00 O ATOM 82370 H1 WAT 8173 46.486 72.744 103.820 1.00 0.00 H ATOM 82371 H2 WAT 8173 45.585 73.687 104.588 1.00 0.00 H TER 82373 WAT 8173 ATOM 82373 O WAT 8174 106.990 66.304 156.787 1.00 0.00 O ATOM 82374 H1 WAT 8174 106.681 66.288 155.881 1.00 0.00 H ATOM 82375 H2 WAT 8174 107.468 65.482 156.893 1.00 0.00 H TER 82377 WAT 8174 ATOM 82377 O WAT 8175 43.982 124.451 97.366 1.00 0.00 O ATOM 82378 H1 WAT 8175 44.893 124.679 97.186 1.00 0.00 H ATOM 82379 H2 WAT 8175 43.497 124.784 96.612 1.00 0.00 H TER 82381 WAT 8175 ATOM 82381 O WAT 8176 115.944 113.689 153.713 1.00 0.00 O ATOM 82382 H1 WAT 8176 115.572 114.130 154.477 1.00 0.00 H ATOM 82383 H2 WAT 8176 116.798 113.374 154.011 1.00 0.00 H TER 82385 WAT 8176 ATOM 82385 O WAT 8177 91.419 54.348 158.618 1.00 0.00 O ATOM 82386 H1 WAT 8177 92.149 54.497 159.218 1.00 0.00 H ATOM 82387 H2 WAT 8177 91.465 55.077 157.999 1.00 0.00 H TER 82389 WAT 8177 ATOM 82389 O WAT 8178 71.701 117.280 137.887 1.00 0.00 O ATOM 82390 H1 WAT 8178 71.507 117.563 138.780 1.00 0.00 H ATOM 82391 H2 WAT 8178 71.120 116.533 137.740 1.00 0.00 H TER 82393 WAT 8178 ATOM 82393 O WAT 8179 117.159 142.508 115.312 1.00 0.00 O ATOM 82394 H1 WAT 8179 117.653 143.290 115.558 1.00 0.00 H ATOM 82395 H2 WAT 8179 117.809 141.806 115.310 1.00 0.00 H TER 82397 WAT 8179 ATOM 82397 O WAT 8180 17.993 14.933 112.983 1.00 0.00 O ATOM 82398 H1 WAT 8180 17.133 14.586 113.223 1.00 0.00 H ATOM 82399 H2 WAT 8180 18.546 14.747 113.741 1.00 0.00 H TER 82401 WAT 8180 ATOM 82401 O WAT 8181 57.658 85.754 122.866 1.00 0.00 O ATOM 82402 H1 WAT 8181 58.228 86.213 123.483 1.00 0.00 H ATOM 82403 H2 WAT 8181 56.898 86.327 122.769 1.00 0.00 H TER 82405 WAT 8181 ATOM 82405 O WAT 8182 144.102 122.033 128.956 1.00 0.00 O ATOM 82406 H1 WAT 8182 143.433 121.941 128.278 1.00 0.00 H ATOM 82407 H2 WAT 8182 144.521 122.872 128.767 1.00 0.00 H TER 82409 WAT 8182 ATOM 82409 O WAT 8183 84.321 92.530 75.729 1.00 0.00 O ATOM 82410 H1 WAT 8183 83.751 93.175 76.147 1.00 0.00 H ATOM 82411 H2 WAT 8183 85.134 92.567 76.232 1.00 0.00 H TER 82413 WAT 8183 ATOM 82413 O WAT 8184 60.170 124.496 70.541 1.00 0.00 O ATOM 82414 H1 WAT 8184 61.039 124.632 70.163 1.00 0.00 H ATOM 82415 H2 WAT 8184 59.565 124.677 69.821 1.00 0.00 H TER 82417 WAT 8184 ATOM 82417 O WAT 8185 130.298 101.941 85.539 1.00 0.00 O ATOM 82418 H1 WAT 8185 129.951 101.164 85.102 1.00 0.00 H ATOM 82419 H2 WAT 8185 130.933 101.599 86.168 1.00 0.00 H TER 82421 WAT 8185 ATOM 82421 O WAT 8186 121.479 38.504 95.924 1.00 0.00 O ATOM 82422 H1 WAT 8186 121.201 39.055 96.656 1.00 0.00 H ATOM 82423 H2 WAT 8186 122.163 37.945 96.291 1.00 0.00 H TER 82425 WAT 8186 ATOM 82425 O WAT 8187 81.508 65.021 19.710 1.00 0.00 O ATOM 82426 H1 WAT 8187 80.827 64.719 20.310 1.00 0.00 H ATOM 82427 H2 WAT 8187 82.138 64.301 19.682 1.00 0.00 H TER 82429 WAT 8187 ATOM 82429 O WAT 8188 116.819 96.189 61.955 1.00 0.00 O ATOM 82430 H1 WAT 8188 116.811 95.302 62.314 1.00 0.00 H ATOM 82431 H2 WAT 8188 117.267 96.103 61.113 1.00 0.00 H TER 82433 WAT 8188 ATOM 82433 O WAT 8189 125.115 77.743 95.592 1.00 0.00 O ATOM 82434 H1 WAT 8189 125.061 77.989 94.669 1.00 0.00 H ATOM 82435 H2 WAT 8189 125.927 77.240 95.658 1.00 0.00 H TER 82437 WAT 8189 ATOM 82437 O WAT 8190 13.954 89.646 108.929 1.00 0.00 O ATOM 82438 H1 WAT 8190 14.789 89.391 109.322 1.00 0.00 H ATOM 82439 H2 WAT 8190 13.335 89.643 109.659 1.00 0.00 H TER 82441 WAT 8190 ATOM 82441 O WAT 8191 110.260 131.219 143.516 1.00 0.00 O ATOM 82442 H1 WAT 8191 109.716 130.877 142.806 1.00 0.00 H ATOM 82443 H2 WAT 8191 109.646 131.373 144.234 1.00 0.00 H TER 82445 WAT 8191 ATOM 82445 O WAT 8192 141.893 129.747 125.352 1.00 0.00 O ATOM 82446 H1 WAT 8192 142.015 129.150 124.613 1.00 0.00 H ATOM 82447 H2 WAT 8192 142.771 129.857 125.719 1.00 0.00 H TER 82449 WAT 8192 ATOM 82449 O WAT 8193 126.366 47.530 81.632 1.00 0.00 O ATOM 82450 H1 WAT 8193 126.467 48.445 81.893 1.00 0.00 H ATOM 82451 H2 WAT 8193 126.940 47.433 80.872 1.00 0.00 H TER 82453 WAT 8193 ATOM 82453 O WAT 8194 6.359 79.421 135.965 1.00 0.00 O ATOM 82454 H1 WAT 8194 5.432 79.503 136.189 1.00 0.00 H ATOM 82455 H2 WAT 8194 6.742 80.262 136.214 1.00 0.00 H TER 82457 WAT 8194 ATOM 82457 O WAT 8195 43.180 130.558 72.489 1.00 0.00 O ATOM 82458 H1 WAT 8195 43.894 131.179 72.632 1.00 0.00 H ATOM 82459 H2 WAT 8195 43.121 130.068 73.309 1.00 0.00 H TER 82461 WAT 8195 ATOM 82461 O WAT 8196 43.288 40.259 149.653 1.00 0.00 O ATOM 82462 H1 WAT 8196 44.226 40.214 149.469 1.00 0.00 H ATOM 82463 H2 WAT 8196 43.083 39.417 150.061 1.00 0.00 H TER 82465 WAT 8196 ATOM 82465 O WAT 8197 122.242 81.150 90.430 1.00 0.00 O ATOM 82466 H1 WAT 8197 122.840 81.094 89.684 1.00 0.00 H ATOM 82467 H2 WAT 8197 122.455 80.386 90.965 1.00 0.00 H TER 82469 WAT 8197 ATOM 82469 O WAT 8198 86.510 145.567 98.515 1.00 0.00 O ATOM 82470 H1 WAT 8198 87.305 146.088 98.401 1.00 0.00 H ATOM 82471 H2 WAT 8198 86.350 145.579 99.459 1.00 0.00 H TER 82473 WAT 8198 ATOM 82473 O WAT 8199 114.476 22.345 11.778 1.00 0.00 O ATOM 82474 H1 WAT 8199 114.283 21.562 12.295 1.00 0.00 H ATOM 82475 H2 WAT 8199 113.737 22.930 11.944 1.00 0.00 H TER 82477 WAT 8199 ATOM 82477 O WAT 8200 113.378 52.767 100.775 1.00 0.00 O ATOM 82478 H1 WAT 8200 113.906 52.281 101.408 1.00 0.00 H ATOM 82479 H2 WAT 8200 112.553 52.936 101.231 1.00 0.00 H TER 82481 WAT 8200 ATOM 82481 O WAT 8201 108.812 76.663 112.541 1.00 0.00 O ATOM 82482 H1 WAT 8201 108.555 77.500 112.929 1.00 0.00 H ATOM 82483 H2 WAT 8201 108.591 76.751 111.614 1.00 0.00 H TER 82485 WAT 8201 ATOM 82485 O WAT 8202 81.618 86.217 96.814 1.00 0.00 O ATOM 82486 H1 WAT 8202 80.830 86.552 96.386 1.00 0.00 H ATOM 82487 H2 WAT 8202 82.242 86.941 96.766 1.00 0.00 H TER 82489 WAT 8202 ATOM 82489 O WAT 8203 25.919 123.297 157.942 1.00 0.00 O ATOM 82490 H1 WAT 8203 25.970 124.253 157.965 1.00 0.00 H ATOM 82491 H2 WAT 8203 26.570 123.007 158.582 1.00 0.00 H TER 82493 WAT 8203 ATOM 82493 O WAT 8204 122.555 75.933 114.646 1.00 0.00 O ATOM 82494 H1 WAT 8204 122.761 76.697 115.185 1.00 0.00 H ATOM 82495 H2 WAT 8204 123.408 75.589 114.382 1.00 0.00 H TER 82497 WAT 8204 ATOM 82497 O WAT 8205 111.544 60.481 112.241 1.00 0.00 O ATOM 82498 H1 WAT 8205 111.837 60.861 111.413 1.00 0.00 H ATOM 82499 H2 WAT 8205 110.810 61.033 112.511 1.00 0.00 H TER 82501 WAT 8205 ATOM 82501 O WAT 8206 25.533 91.759 95.628 1.00 0.00 O ATOM 82502 H1 WAT 8206 25.656 91.009 95.046 1.00 0.00 H ATOM 82503 H2 WAT 8206 25.413 91.373 96.495 1.00 0.00 H TER 82505 WAT 8206 ATOM 82505 O WAT 8207 111.072 105.475 91.330 1.00 0.00 O ATOM 82506 H1 WAT 8207 111.710 105.147 90.696 1.00 0.00 H ATOM 82507 H2 WAT 8207 110.461 105.995 90.808 1.00 0.00 H TER 82509 WAT 8207 ATOM 82509 O WAT 8208 87.460 129.194 116.148 1.00 0.00 O ATOM 82510 H1 WAT 8208 87.537 128.556 115.439 1.00 0.00 H ATOM 82511 H2 WAT 8208 87.188 128.677 116.907 1.00 0.00 H TER 82513 WAT 8208 ATOM 82513 O WAT 8209 23.191 11.444 99.508 1.00 0.00 O ATOM 82514 H1 WAT 8209 22.976 12.025 98.779 1.00 0.00 H ATOM 82515 H2 WAT 8209 23.439 12.034 100.220 1.00 0.00 H TER 82517 WAT 8209 ATOM 82517 O WAT 8210 99.872 2.416 83.566 1.00 0.00 O ATOM 82518 H1 WAT 8210 100.510 1.842 83.990 1.00 0.00 H ATOM 82519 H2 WAT 8210 99.042 1.946 83.639 1.00 0.00 H TER 82521 WAT 8210 ATOM 82521 O WAT 8211 44.211 114.394 144.012 1.00 0.00 O ATOM 82522 H1 WAT 8211 43.262 114.374 143.886 1.00 0.00 H ATOM 82523 H2 WAT 8211 44.487 113.485 143.895 1.00 0.00 H TER 82525 WAT 8211 ATOM 82525 O WAT 8212 14.064 58.127 150.720 1.00 0.00 O ATOM 82526 H1 WAT 8212 13.965 58.996 150.330 1.00 0.00 H ATOM 82527 H2 WAT 8212 14.375 57.576 150.002 1.00 0.00 H TER 82529 WAT 8212 ATOM 82529 O WAT 8213 90.404 79.772 132.147 1.00 0.00 O ATOM 82530 H1 WAT 8213 90.735 80.279 131.405 1.00 0.00 H ATOM 82531 H2 WAT 8213 89.618 79.342 131.811 1.00 0.00 H TER 82533 WAT 8213 ATOM 82533 O WAT 8214 97.438 123.686 85.074 1.00 0.00 O ATOM 82534 H1 WAT 8214 97.263 124.424 85.658 1.00 0.00 H ATOM 82535 H2 WAT 8214 96.589 123.255 84.972 1.00 0.00 H TER 82537 WAT 8214 ATOM 82537 O WAT 8215 45.193 86.970 15.873 1.00 0.00 O ATOM 82538 H1 WAT 8215 44.972 87.891 15.732 1.00 0.00 H ATOM 82539 H2 WAT 8215 44.868 86.777 16.752 1.00 0.00 H TER 82541 WAT 8215 ATOM 82541 O WAT 8216 3.282 19.400 116.964 1.00 0.00 O ATOM 82542 H1 WAT 8216 3.890 19.758 116.317 1.00 0.00 H ATOM 82543 H2 WAT 8216 3.311 20.023 117.690 1.00 0.00 H TER 82545 WAT 8216 ATOM 82545 O WAT 8217 34.379 76.890 74.296 1.00 0.00 O ATOM 82546 H1 WAT 8217 34.268 77.765 73.925 1.00 0.00 H ATOM 82547 H2 WAT 8217 35.126 76.522 73.824 1.00 0.00 H TER 82549 WAT 8217 ATOM 82549 O WAT 8218 104.960 33.028 62.061 1.00 0.00 O ATOM 82550 H1 WAT 8218 105.730 32.687 62.516 1.00 0.00 H ATOM 82551 H2 WAT 8218 105.186 32.968 61.132 1.00 0.00 H TER 82553 WAT 8218 ATOM 82553 O WAT 8219 15.088 136.196 129.087 1.00 0.00 O ATOM 82554 H1 WAT 8219 15.453 136.331 129.961 1.00 0.00 H ATOM 82555 H2 WAT 8219 15.837 135.932 128.552 1.00 0.00 H TER 82557 WAT 8219 ATOM 82557 O WAT 8220 81.416 46.484 132.769 1.00 0.00 O ATOM 82558 H1 WAT 8220 82.296 46.169 132.976 1.00 0.00 H ATOM 82559 H2 WAT 8220 81.121 45.919 132.055 1.00 0.00 H TER 82561 WAT 8220 ATOM 82561 O WAT 8221 17.022 144.864 92.201 1.00 0.00 O ATOM 82562 H1 WAT 8221 16.640 143.997 92.067 1.00 0.00 H ATOM 82563 H2 WAT 8221 16.495 145.253 92.899 1.00 0.00 H TER 82565 WAT 8221 ATOM 82565 O WAT 8222 118.477 130.180 118.421 1.00 0.00 O ATOM 82566 H1 WAT 8222 117.731 129.587 118.329 1.00 0.00 H ATOM 82567 H2 WAT 8222 118.665 130.469 117.528 1.00 0.00 H TER 82569 WAT 8222 ATOM 82569 O WAT 8223 95.504 85.172 125.958 1.00 0.00 O ATOM 82570 H1 WAT 8223 96.349 85.497 126.270 1.00 0.00 H ATOM 82571 H2 WAT 8223 95.538 85.290 125.009 1.00 0.00 H TER 82573 WAT 8223 ATOM 82573 O WAT 8224 99.702 59.160 73.164 1.00 0.00 O ATOM 82574 H1 WAT 8224 99.155 59.262 72.384 1.00 0.00 H ATOM 82575 H2 WAT 8224 100.230 59.958 73.192 1.00 0.00 H TER 82577 WAT 8224 ATOM 82577 O WAT 8225 37.692 33.008 95.908 1.00 0.00 O ATOM 82578 H1 WAT 8225 37.293 32.711 95.090 1.00 0.00 H ATOM 82579 H2 WAT 8225 38.635 32.940 95.753 1.00 0.00 H TER 82581 WAT 8225 ATOM 82581 O WAT 8226 68.553 58.045 85.888 1.00 0.00 O ATOM 82582 H1 WAT 8226 68.468 58.765 86.514 1.00 0.00 H ATOM 82583 H2 WAT 8226 68.386 58.448 85.036 1.00 0.00 H TER 82585 WAT 8226 ATOM 82585 O WAT 8227 19.595 0.331 144.016 1.00 0.00 O ATOM 82586 H1 WAT 8227 18.748 0.691 144.279 1.00 0.00 H ATOM 82587 H2 WAT 8227 19.540 -0.599 144.237 1.00 0.00 H TER 82589 WAT 8227 ATOM 82589 O WAT 8228 103.758 56.772 153.804 1.00 0.00 O ATOM 82590 H1 WAT 8228 103.641 56.711 152.856 1.00 0.00 H ATOM 82591 H2 WAT 8228 104.100 55.915 154.059 1.00 0.00 H TER 82593 WAT 8228 ATOM 82593 O WAT 8229 95.269 138.684 150.429 1.00 0.00 O ATOM 82594 H1 WAT 8229 94.674 139.316 150.026 1.00 0.00 H ATOM 82595 H2 WAT 8229 94.846 138.449 151.254 1.00 0.00 H TER 82597 WAT 8229 ATOM 82597 O WAT 8230 29.318 127.898 56.885 1.00 0.00 O ATOM 82598 H1 WAT 8230 28.954 128.164 56.041 1.00 0.00 H ATOM 82599 H2 WAT 8230 29.107 126.967 56.954 1.00 0.00 H TER 82601 WAT 8230 ATOM 82601 O WAT 8231 121.115 124.544 152.909 1.00 0.00 O ATOM 82602 H1 WAT 8231 121.270 123.741 153.406 1.00 0.00 H ATOM 82603 H2 WAT 8231 120.205 124.474 152.618 1.00 0.00 H TER 82605 WAT 8231 ATOM 82605 O WAT 8232 22.565 115.912 11.112 1.00 0.00 O ATOM 82606 H1 WAT 8232 23.466 115.673 11.333 1.00 0.00 H ATOM 82607 H2 WAT 8232 22.081 115.087 11.155 1.00 0.00 H TER 82609 WAT 8232 ATOM 82609 O WAT 8233 118.030 131.723 71.512 1.00 0.00 O ATOM 82610 H1 WAT 8233 118.159 130.864 71.111 1.00 0.00 H ATOM 82611 H2 WAT 8233 118.311 131.609 72.420 1.00 0.00 H TER 82613 WAT 8233 ATOM 82613 O WAT 8234 49.600 97.757 82.984 1.00 0.00 O ATOM 82614 H1 WAT 8234 50.349 97.838 83.575 1.00 0.00 H ATOM 82615 H2 WAT 8234 49.598 96.836 82.725 1.00 0.00 H TER 82617 WAT 8234 ATOM 82617 O WAT 8235 39.209 51.634 114.826 1.00 0.00 O ATOM 82618 H1 WAT 8235 38.856 51.268 114.015 1.00 0.00 H ATOM 82619 H2 WAT 8235 39.250 50.889 115.426 1.00 0.00 H TER 82621 WAT 8235 ATOM 82621 O WAT 8236 91.799 124.422 16.156 1.00 0.00 O ATOM 82622 H1 WAT 8236 91.148 124.835 15.589 1.00 0.00 H ATOM 82623 H2 WAT 8236 92.185 123.733 15.616 1.00 0.00 H TER 82625 WAT 8236 ATOM 82625 O WAT 8237 11.644 89.561 72.056 1.00 0.00 O ATOM 82626 H1 WAT 8237 10.847 89.912 71.661 1.00 0.00 H ATOM 82627 H2 WAT 8237 11.349 89.159 72.873 1.00 0.00 H TER 82629 WAT 8237 ATOM 82629 O WAT 8238 73.852 7.276 83.677 1.00 0.00 O ATOM 82630 H1 WAT 8238 73.238 7.790 84.200 1.00 0.00 H ATOM 82631 H2 WAT 8238 73.565 7.407 82.773 1.00 0.00 H TER 82633 WAT 8238 ATOM 82633 O WAT 8239 44.243 79.792 121.405 1.00 0.00 O ATOM 82634 H1 WAT 8239 44.852 80.521 121.290 1.00 0.00 H ATOM 82635 H2 WAT 8239 44.654 79.062 120.942 1.00 0.00 H TER 82637 WAT 8239 ATOM 82637 O WAT 8240 125.628 24.995 70.670 1.00 0.00 O ATOM 82638 H1 WAT 8240 124.763 24.679 70.930 1.00 0.00 H ATOM 82639 H2 WAT 8240 125.709 25.849 71.094 1.00 0.00 H TER 82641 WAT 8240 ATOM 82641 O WAT 8241 52.247 82.466 0.079 1.00 0.00 O ATOM 82642 H1 WAT 8241 52.660 82.933 0.806 1.00 0.00 H ATOM 82643 H2 WAT 8241 51.671 81.828 0.501 1.00 0.00 H TER 82645 WAT 8241 ATOM 82645 O WAT 8242 13.765 51.782 123.091 1.00 0.00 O ATOM 82646 H1 WAT 8242 13.209 51.511 122.361 1.00 0.00 H ATOM 82647 H2 WAT 8242 14.100 50.962 123.455 1.00 0.00 H TER 82649 WAT 8242 ATOM 82649 O WAT 8243 117.251 20.785 13.118 1.00 0.00 O ATOM 82650 H1 WAT 8243 117.081 20.167 13.829 1.00 0.00 H ATOM 82651 H2 WAT 8243 117.030 21.640 13.487 1.00 0.00 H TER 82653 WAT 8243 ATOM 82653 O WAT 8244 110.991 96.696 67.968 1.00 0.00 O ATOM 82654 H1 WAT 8244 111.443 96.776 68.808 1.00 0.00 H ATOM 82655 H2 WAT 8244 110.859 95.754 67.855 1.00 0.00 H TER 82657 WAT 8244 ATOM 82657 O WAT 8245 51.110 116.191 126.869 1.00 0.00 O ATOM 82658 H1 WAT 8245 50.322 115.680 127.052 1.00 0.00 H ATOM 82659 H2 WAT 8245 51.469 115.800 126.073 1.00 0.00 H TER 82661 WAT 8245 ATOM 82661 O WAT 8246 52.183 109.044 81.533 1.00 0.00 O ATOM 82662 H1 WAT 8246 52.291 109.950 81.246 1.00 0.00 H ATOM 82663 H2 WAT 8246 52.546 108.521 80.818 1.00 0.00 H TER 82665 WAT 8246 ATOM 82665 O WAT 8247 9.225 90.072 117.095 1.00 0.00 O ATOM 82666 H1 WAT 8247 8.812 90.610 116.419 1.00 0.00 H ATOM 82667 H2 WAT 8247 9.802 89.481 116.611 1.00 0.00 H TER 82669 WAT 8247 ATOM 82669 O WAT 8248 66.833 77.814 122.499 1.00 0.00 O ATOM 82670 H1 WAT 8248 65.960 77.451 122.647 1.00 0.00 H ATOM 82671 H2 WAT 8248 67.132 78.080 123.369 1.00 0.00 H TER 82673 WAT 8248 ATOM 82673 O WAT 8249 91.704 102.989 104.212 1.00 0.00 O ATOM 82674 H1 WAT 8249 92.587 102.638 104.096 1.00 0.00 H ATOM 82675 H2 WAT 8249 91.198 102.254 104.561 1.00 0.00 H TER 82677 WAT 8249 ATOM 82677 O WAT 8250 31.072 67.147 149.927 1.00 0.00 O ATOM 82678 H1 WAT 8250 31.327 67.702 150.663 1.00 0.00 H ATOM 82679 H2 WAT 8250 31.677 66.406 149.965 1.00 0.00 H TER 82681 WAT 8250 ATOM 82681 O WAT 8251 123.379 62.640 146.216 1.00 0.00 O ATOM 82682 H1 WAT 8251 123.778 63.510 146.233 1.00 0.00 H ATOM 82683 H2 WAT 8251 122.694 62.703 145.551 1.00 0.00 H TER 82685 WAT 8251 ATOM 82685 O WAT 8252 38.527 103.173 69.301 1.00 0.00 O ATOM 82686 H1 WAT 8252 37.768 103.055 69.872 1.00 0.00 H ATOM 82687 H2 WAT 8252 38.900 102.296 69.213 1.00 0.00 H TER 82689 WAT 8252 ATOM 82689 O WAT 8253 138.042 57.215 126.599 1.00 0.00 O ATOM 82690 H1 WAT 8253 137.330 57.245 125.960 1.00 0.00 H ATOM 82691 H2 WAT 8253 137.622 56.940 127.414 1.00 0.00 H TER 82693 WAT 8253 ATOM 82693 O WAT 8254 102.854 94.817 128.735 1.00 0.00 O ATOM 82694 H1 WAT 8254 103.049 95.445 128.039 1.00 0.00 H ATOM 82695 H2 WAT 8254 102.330 95.312 129.365 1.00 0.00 H TER 82697 WAT 8254 ATOM 82697 O WAT 8255 37.528 18.679 132.211 1.00 0.00 O ATOM 82698 H1 WAT 8255 37.779 19.501 131.788 1.00 0.00 H ATOM 82699 H2 WAT 8255 36.982 18.234 131.563 1.00 0.00 H TER 82701 WAT 8255 ATOM 82701 O WAT 8256 64.403 3.582 1.402 1.00 0.00 O ATOM 82702 H1 WAT 8256 65.216 3.976 1.085 1.00 0.00 H ATOM 82703 H2 WAT 8256 64.670 2.732 1.752 1.00 0.00 H TER 82705 WAT 8256 ATOM 82705 O WAT 8257 15.318 20.066 62.077 1.00 0.00 O ATOM 82706 H1 WAT 8257 14.699 20.712 62.420 1.00 0.00 H ATOM 82707 H2 WAT 8257 16.076 20.583 61.804 1.00 0.00 H TER 82709 WAT 8257 ATOM 82709 O WAT 8258 74.274 37.307 81.548 1.00 0.00 O ATOM 82710 H1 WAT 8258 74.540 36.770 82.294 1.00 0.00 H ATOM 82711 H2 WAT 8258 74.377 38.209 81.853 1.00 0.00 H TER 82713 WAT 8258 ATOM 82713 O WAT 8259 55.771 134.403 121.479 1.00 0.00 O ATOM 82714 H1 WAT 8259 56.066 133.504 121.623 1.00 0.00 H ATOM 82715 H2 WAT 8259 56.187 134.907 122.179 1.00 0.00 H TER 82717 WAT 8259 ATOM 82717 O WAT 8260 40.911 0.361 142.840 1.00 0.00 O ATOM 82718 H1 WAT 8260 40.912 0.653 143.751 1.00 0.00 H ATOM 82719 H2 WAT 8260 40.719 -0.575 142.889 1.00 0.00 H TER 82721 WAT 8260 ATOM 82721 O WAT 8261 124.444 29.158 85.826 1.00 0.00 O ATOM 82722 H1 WAT 8261 124.484 28.218 85.649 1.00 0.00 H ATOM 82723 H2 WAT 8261 124.831 29.564 85.050 1.00 0.00 H TER 82725 WAT 8261 ATOM 82725 O WAT 8262 124.063 72.890 148.557 1.00 0.00 O ATOM 82726 H1 WAT 8262 124.047 72.881 149.514 1.00 0.00 H ATOM 82727 H2 WAT 8262 123.979 71.970 148.307 1.00 0.00 H TER 82729 WAT 8262 ATOM 82729 O WAT 8263 104.458 46.880 0.644 1.00 0.00 O ATOM 82730 H1 WAT 8263 104.088 46.808 1.524 1.00 0.00 H ATOM 82731 H2 WAT 8263 105.402 46.785 0.772 1.00 0.00 H TER 82733 WAT 8263 ATOM 82733 O WAT 8264 64.423 85.330 80.124 1.00 0.00 O ATOM 82734 H1 WAT 8264 63.498 85.316 80.369 1.00 0.00 H ATOM 82735 H2 WAT 8264 64.839 84.710 80.723 1.00 0.00 H TER 82737 WAT 8264 ATOM 82737 O WAT 8265 136.465 18.578 4.009 1.00 0.00 O ATOM 82738 H1 WAT 8265 136.059 17.711 4.022 1.00 0.00 H ATOM 82739 H2 WAT 8265 137.405 18.402 3.972 1.00 0.00 H TER 82741 WAT 8265 ATOM 82741 O WAT 8266 48.432 130.209 53.537 1.00 0.00 O ATOM 82742 H1 WAT 8266 48.005 129.481 53.989 1.00 0.00 H ATOM 82743 H2 WAT 8266 48.566 130.869 54.218 1.00 0.00 H TER 82745 WAT 8266 ATOM 82745 O WAT 8267 116.416 133.956 8.191 1.00 0.00 O ATOM 82746 H1 WAT 8267 116.861 133.297 7.658 1.00 0.00 H ATOM 82747 H2 WAT 8267 116.675 134.792 7.804 1.00 0.00 H TER 82749 WAT 8267 ATOM 82749 O WAT 8268 59.453 66.104 126.167 1.00 0.00 O ATOM 82750 H1 WAT 8268 60.403 66.069 126.284 1.00 0.00 H ATOM 82751 H2 WAT 8268 59.255 65.362 125.596 1.00 0.00 H TER 82753 WAT 8268 ATOM 82753 O WAT 8269 46.566 7.854 143.109 1.00 0.00 O ATOM 82754 H1 WAT 8269 45.649 7.587 143.041 1.00 0.00 H ATOM 82755 H2 WAT 8269 46.529 8.761 143.411 1.00 0.00 H TER 82757 WAT 8269 ATOM 82757 O WAT 8270 81.736 61.397 70.380 1.00 0.00 O ATOM 82758 H1 WAT 8270 80.909 61.020 70.679 1.00 0.00 H ATOM 82759 H2 WAT 8270 82.384 60.711 70.537 1.00 0.00 H TER 82761 WAT 8270 ATOM 82761 O WAT 8271 141.963 58.388 113.194 1.00 0.00 O ATOM 82762 H1 WAT 8271 142.732 58.511 113.750 1.00 0.00 H ATOM 82763 H2 WAT 8271 141.264 58.863 113.644 1.00 0.00 H TER 82765 WAT 8271 ATOM 82765 O WAT 8272 99.463 52.135 142.976 1.00 0.00 O ATOM 82766 H1 WAT 8272 99.636 52.722 143.711 1.00 0.00 H ATOM 82767 H2 WAT 8272 98.841 52.613 142.427 1.00 0.00 H TER 82769 WAT 8272 ATOM 82769 O WAT 8273 118.601 61.169 129.876 1.00 0.00 O ATOM 82770 H1 WAT 8273 119.208 60.870 130.553 1.00 0.00 H ATOM 82771 H2 WAT 8273 118.945 60.796 129.065 1.00 0.00 H TER 82773 WAT 8273 ATOM 82773 O WAT 8274 54.758 129.552 126.621 1.00 0.00 O ATOM 82774 H1 WAT 8274 55.457 129.470 125.973 1.00 0.00 H ATOM 82775 H2 WAT 8274 53.954 129.597 126.103 1.00 0.00 H TER 82777 WAT 8274 ATOM 82777 O WAT 8275 96.128 70.389 131.463 1.00 0.00 O ATOM 82778 H1 WAT 8275 96.144 70.041 132.355 1.00 0.00 H ATOM 82779 H2 WAT 8275 96.972 70.134 131.092 1.00 0.00 H TER 82781 WAT 8275 ATOM 82781 O WAT 8276 116.237 95.717 92.100 1.00 0.00 O ATOM 82782 H1 WAT 8276 116.815 95.542 91.358 1.00 0.00 H ATOM 82783 H2 WAT 8276 116.605 95.200 92.817 1.00 0.00 H TER 82785 WAT 8276 ATOM 82785 O WAT 8277 119.132 22.458 153.116 1.00 0.00 O ATOM 82786 H1 WAT 8277 119.531 23.325 153.055 1.00 0.00 H ATOM 82787 H2 WAT 8277 119.013 22.315 154.055 1.00 0.00 H TER 82789 WAT 8277 ATOM 82789 O WAT 8278 40.959 60.556 21.750 1.00 0.00 O ATOM 82790 H1 WAT 8278 40.549 60.852 20.937 1.00 0.00 H ATOM 82791 H2 WAT 8278 40.262 60.609 22.403 1.00 0.00 H TER 82793 WAT 8278 ATOM 82793 O WAT 8279 107.980 62.826 94.515 1.00 0.00 O ATOM 82794 H1 WAT 8279 108.858 63.191 94.626 1.00 0.00 H ATOM 82795 H2 WAT 8279 107.857 62.263 95.279 1.00 0.00 H TER 82797 WAT 8279 ATOM 82797 O WAT 8280 61.696 45.708 117.608 1.00 0.00 O ATOM 82798 H1 WAT 8280 62.014 45.718 116.705 1.00 0.00 H ATOM 82799 H2 WAT 8280 61.841 44.809 117.903 1.00 0.00 H TER 82801 WAT 8280 ATOM 82801 O WAT 8281 58.719 91.147 130.903 1.00 0.00 O ATOM 82802 H1 WAT 8281 58.376 90.334 130.533 1.00 0.00 H ATOM 82803 H2 WAT 8281 58.503 91.096 131.834 1.00 0.00 H TER 82805 WAT 8281 ATOM 82805 O WAT 8282 135.484 73.089 90.173 1.00 0.00 O ATOM 82806 H1 WAT 8282 135.195 73.134 91.084 1.00 0.00 H ATOM 82807 H2 WAT 8282 134.969 72.378 89.793 1.00 0.00 H TER 82809 WAT 8282 ATOM 82809 O WAT 8283 53.165 86.668 3.581 1.00 0.00 O ATOM 82810 H1 WAT 8283 54.120 86.744 3.564 1.00 0.00 H ATOM 82811 H2 WAT 8283 52.852 87.567 3.480 1.00 0.00 H TER 82813 WAT 8283 ATOM 82813 O WAT 8284 58.490 20.563 51.610 1.00 0.00 O ATOM 82814 H1 WAT 8284 58.830 20.611 50.716 1.00 0.00 H ATOM 82815 H2 WAT 8284 59.019 19.884 52.030 1.00 0.00 H TER 82817 WAT 8284 ATOM 82817 O WAT 8285 0.419 107.601 158.012 1.00 0.00 O ATOM 82818 H1 WAT 8285 0.813 108.472 157.959 1.00 0.00 H ATOM 82819 H2 WAT 8285 -0.438 107.700 157.597 1.00 0.00 H TER 82821 WAT 8285 ATOM 82821 O WAT 8286 44.126 35.088 77.061 1.00 0.00 O ATOM 82822 H1 WAT 8286 45.043 35.297 76.883 1.00 0.00 H ATOM 82823 H2 WAT 8286 44.050 34.155 76.860 1.00 0.00 H TER 82825 WAT 8286 ATOM 82825 O WAT 8287 42.316 73.489 86.315 1.00 0.00 O ATOM 82826 H1 WAT 8287 41.605 73.620 86.942 1.00 0.00 H ATOM 82827 H2 WAT 8287 42.336 72.543 86.170 1.00 0.00 H TER 82829 WAT 8287 ATOM 82829 O WAT 8288 3.502 85.839 146.130 1.00 0.00 O ATOM 82830 H1 WAT 8288 2.751 85.771 146.720 1.00 0.00 H ATOM 82831 H2 WAT 8288 3.144 85.647 145.264 1.00 0.00 H TER 82833 WAT 8288 ATOM 82833 O WAT 8289 12.263 8.515 80.593 1.00 0.00 O ATOM 82834 H1 WAT 8289 12.055 8.770 81.492 1.00 0.00 H ATOM 82835 H2 WAT 8289 12.464 9.339 80.151 1.00 0.00 H TER 82837 WAT 8289 ATOM 82837 O WAT 8290 60.097 65.609 0.382 1.00 0.00 O ATOM 82838 H1 WAT 8290 60.441 66.448 0.076 1.00 0.00 H ATOM 82839 H2 WAT 8290 59.713 65.805 1.237 1.00 0.00 H TER 82841 WAT 8290 ATOM 82841 O WAT 8291 106.919 38.785 119.314 1.00 0.00 O ATOM 82842 H1 WAT 8291 106.183 39.374 119.483 1.00 0.00 H ATOM 82843 H2 WAT 8291 107.399 39.201 118.598 1.00 0.00 H TER 82845 WAT 8291 ATOM 82845 O WAT 8292 30.913 24.214 105.126 1.00 0.00 O ATOM 82846 H1 WAT 8292 30.595 24.012 104.246 1.00 0.00 H ATOM 82847 H2 WAT 8292 30.126 24.220 105.670 1.00 0.00 H TER 82849 WAT 8292 ATOM 82849 O WAT 8293 108.788 61.725 -0.106 1.00 0.00 O ATOM 82850 H1 WAT 8293 108.147 61.015 -0.135 1.00 0.00 H ATOM 82851 H2 WAT 8293 109.203 61.638 0.752 1.00 0.00 H TER 82853 WAT 8293 ATOM 82853 O WAT 8294 22.206 27.389 10.612 1.00 0.00 O ATOM 82854 H1 WAT 8294 21.516 27.131 11.224 1.00 0.00 H ATOM 82855 H2 WAT 8294 21.792 28.039 10.044 1.00 0.00 H TER 82857 WAT 8294 ATOM 82857 O WAT 8295 76.773 116.940 1.925 1.00 0.00 O ATOM 82858 H1 WAT 8295 76.565 116.840 2.854 1.00 0.00 H ATOM 82859 H2 WAT 8295 76.848 117.886 1.798 1.00 0.00 H TER 82861 WAT 8295 ATOM 82861 O WAT 8296 75.680 65.326 132.249 1.00 0.00 O ATOM 82862 H1 WAT 8296 75.694 66.273 132.105 1.00 0.00 H ATOM 82863 H2 WAT 8296 75.198 65.217 133.069 1.00 0.00 H TER 82865 WAT 8296 ATOM 82865 O WAT 8297 0.394 51.820 156.495 1.00 0.00 O ATOM 82866 H1 WAT 8297 0.680 52.101 157.364 1.00 0.00 H ATOM 82867 H2 WAT 8297 1.200 51.772 155.981 1.00 0.00 H TER 82869 WAT 8297 ATOM 82869 O WAT 8298 68.620 38.486 147.645 1.00 0.00 O ATOM 82870 H1 WAT 8298 68.540 38.933 148.487 1.00 0.00 H ATOM 82871 H2 WAT 8298 68.315 37.595 147.816 1.00 0.00 H TER 82873 WAT 8298 ATOM 82873 O WAT 8299 84.136 83.199 107.719 1.00 0.00 O ATOM 82874 H1 WAT 8299 83.622 83.975 107.942 1.00 0.00 H ATOM 82875 H2 WAT 8299 84.671 83.473 106.973 1.00 0.00 H TER 82877 WAT 8299 ATOM 82877 O WAT 8300 64.050 72.255 5.262 1.00 0.00 O ATOM 82878 H1 WAT 8300 63.397 72.390 5.949 1.00 0.00 H ATOM 82879 H2 WAT 8300 64.739 71.741 5.684 1.00 0.00 H TER 82881 WAT 8300 ATOM 82881 O WAT 8301 123.494 83.142 119.190 1.00 0.00 O ATOM 82882 H1 WAT 8301 124.419 82.942 119.044 1.00 0.00 H ATOM 82883 H2 WAT 8301 123.406 84.061 118.935 1.00 0.00 H TER 82885 WAT 8301 ATOM 82885 O WAT 8302 127.968 83.194 0.831 1.00 0.00 O ATOM 82886 H1 WAT 8302 127.878 82.387 1.338 1.00 0.00 H ATOM 82887 H2 WAT 8302 128.852 83.504 1.030 1.00 0.00 H TER 82889 WAT 8302 ATOM 82889 O WAT 8303 13.253 0.481 84.983 1.00 0.00 O ATOM 82890 H1 WAT 8303 14.061 0.182 85.400 1.00 0.00 H ATOM 82891 H2 WAT 8303 13.082 1.336 85.378 1.00 0.00 H TER 82893 WAT 8303 ATOM 82893 O WAT 8304 101.548 61.961 138.975 1.00 0.00 O ATOM 82894 H1 WAT 8304 100.591 61.987 138.955 1.00 0.00 H ATOM 82895 H2 WAT 8304 101.816 62.861 138.791 1.00 0.00 H TER 82897 WAT 8304 ATOM 82897 O WAT 8305 100.040 9.397 117.003 1.00 0.00 O ATOM 82898 H1 WAT 8305 100.150 9.407 117.953 1.00 0.00 H ATOM 82899 H2 WAT 8305 99.307 8.800 116.853 1.00 0.00 H TER 82901 WAT 8305 ATOM 82901 O WAT 8306 80.045 135.645 7.330 1.00 0.00 O ATOM 82902 H1 WAT 8306 80.265 134.727 7.490 1.00 0.00 H ATOM 82903 H2 WAT 8306 80.607 135.901 6.598 1.00 0.00 H TER 82905 WAT 8306 ATOM 82905 O WAT 8307 38.096 94.470 74.839 1.00 0.00 O ATOM 82906 H1 WAT 8307 37.470 93.921 75.311 1.00 0.00 H ATOM 82907 H2 WAT 8307 38.952 94.111 75.072 1.00 0.00 H TER 82909 WAT 8307 ATOM 82909 O WAT 8308 29.176 40.896 152.341 1.00 0.00 O ATOM 82910 H1 WAT 8308 28.733 40.679 153.162 1.00 0.00 H ATOM 82911 H2 WAT 8308 28.607 41.544 151.926 1.00 0.00 H TER 82913 WAT 8308 ATOM 82913 O WAT 8309 27.907 133.721 155.278 1.00 0.00 O ATOM 82914 H1 WAT 8309 27.005 133.826 155.582 1.00 0.00 H ATOM 82915 H2 WAT 8309 28.231 132.954 155.750 1.00 0.00 H TER 82917 WAT 8309 ATOM 82917 O WAT 8310 134.617 54.986 152.356 1.00 0.00 O ATOM 82918 H1 WAT 8310 134.092 54.338 152.826 1.00 0.00 H ATOM 82919 H2 WAT 8310 135.200 55.350 153.021 1.00 0.00 H TER 82921 WAT 8310 ATOM 82921 O WAT 8311 12.526 79.146 108.902 1.00 0.00 O ATOM 82922 H1 WAT 8311 11.938 79.883 108.738 1.00 0.00 H ATOM 82923 H2 WAT 8311 11.948 78.436 109.181 1.00 0.00 H TER 82925 WAT 8311 ATOM 82925 O WAT 8312 118.865 104.013 97.054 1.00 0.00 O ATOM 82926 H1 WAT 8312 118.515 104.107 96.168 1.00 0.00 H ATOM 82927 H2 WAT 8312 119.248 104.868 97.253 1.00 0.00 H TER 82929 WAT 8312 ATOM 82929 O WAT 8313 130.968 44.784 76.184 1.00 0.00 O ATOM 82930 H1 WAT 8313 131.121 45.620 75.744 1.00 0.00 H ATOM 82931 H2 WAT 8313 131.726 44.673 76.759 1.00 0.00 H TER 82933 WAT 8313 ATOM 82933 O WAT 8314 56.021 81.008 17.237 1.00 0.00 O ATOM 82934 H1 WAT 8314 56.139 80.130 16.872 1.00 0.00 H ATOM 82935 H2 WAT 8314 56.793 81.143 17.787 1.00 0.00 H TER 82937 WAT 8314 ATOM 82937 O WAT 8315 141.761 116.493 24.199 1.00 0.00 O ATOM 82938 H1 WAT 8315 140.922 116.855 23.915 1.00 0.00 H ATOM 82939 H2 WAT 8315 142.272 117.256 24.470 1.00 0.00 H TER 82941 WAT 8315 ATOM 82941 O WAT 8316 77.871 43.258 101.304 1.00 0.00 O ATOM 82942 H1 WAT 8316 77.334 42.792 101.945 1.00 0.00 H ATOM 82943 H2 WAT 8316 78.652 42.714 101.204 1.00 0.00 H TER 82945 WAT 8316 ATOM 82945 O WAT 8317 30.076 10.496 8.460 1.00 0.00 O ATOM 82946 H1 WAT 8317 29.154 10.622 8.236 1.00 0.00 H ATOM 82947 H2 WAT 8317 30.265 11.189 9.093 1.00 0.00 H TER 82949 WAT 8317 ATOM 82949 O WAT 8318 88.372 77.394 149.482 1.00 0.00 O ATOM 82950 H1 WAT 8318 88.275 76.981 148.624 1.00 0.00 H ATOM 82951 H2 WAT 8318 87.558 77.186 149.942 1.00 0.00 H TER 82953 WAT 8318 ATOM 82953 O WAT 8319 71.719 19.166 82.272 1.00 0.00 O ATOM 82954 H1 WAT 8319 72.320 18.516 81.908 1.00 0.00 H ATOM 82955 H2 WAT 8319 72.228 19.977 82.294 1.00 0.00 H TER 82957 WAT 8319 ATOM 82957 O WAT 8320 7.963 141.828 106.507 1.00 0.00 O ATOM 82958 H1 WAT 8320 8.586 141.221 106.906 1.00 0.00 H ATOM 82959 H2 WAT 8320 8.033 141.661 105.568 1.00 0.00 H TER 82961 WAT 8320 ATOM 82961 O WAT 8321 23.357 93.299 149.685 1.00 0.00 O ATOM 82962 H1 WAT 8321 24.096 93.822 149.373 1.00 0.00 H ATOM 82963 H2 WAT 8321 23.762 92.543 150.111 1.00 0.00 H TER 82965 WAT 8321 ATOM 82965 O WAT 8322 44.803 33.855 100.782 1.00 0.00 O ATOM 82966 H1 WAT 8322 44.564 34.673 101.217 1.00 0.00 H ATOM 82967 H2 WAT 8322 45.588 33.559 101.245 1.00 0.00 H TER 82969 WAT 8322 ATOM 82969 O WAT 8323 84.232 70.307 83.282 1.00 0.00 O ATOM 82970 H1 WAT 8323 84.281 69.516 82.745 1.00 0.00 H ATOM 82971 H2 WAT 8323 85.066 70.328 83.752 1.00 0.00 H TER 82973 WAT 8323 ATOM 82973 O WAT 8324 17.576 53.044 60.684 1.00 0.00 O ATOM 82974 H1 WAT 8324 17.548 53.087 61.640 1.00 0.00 H ATOM 82975 H2 WAT 8324 17.211 52.185 60.471 1.00 0.00 H TER 82977 WAT 8324 ATOM 82977 O WAT 8325 59.593 70.831 139.190 1.00 0.00 O ATOM 82978 H1 WAT 8325 60.541 70.796 139.060 1.00 0.00 H ATOM 82979 H2 WAT 8325 59.226 70.663 138.323 1.00 0.00 H TER 82981 WAT 8325 ATOM 82981 O WAT 8326 73.791 60.390 86.104 1.00 0.00 O ATOM 82982 H1 WAT 8326 73.429 59.705 86.665 1.00 0.00 H ATOM 82983 H2 WAT 8326 74.705 60.467 86.378 1.00 0.00 H TER 82985 WAT 8326 ATOM 82985 O WAT 8327 23.517 117.478 20.471 1.00 0.00 O ATOM 82986 H1 WAT 8327 23.842 117.470 19.571 1.00 0.00 H ATOM 82987 H2 WAT 8327 23.734 116.610 20.812 1.00 0.00 H TER 82989 WAT 8327 ATOM 82989 O WAT 8328 114.744 88.724 18.757 1.00 0.00 O ATOM 82990 H1 WAT 8328 115.152 89.263 19.435 1.00 0.00 H ATOM 82991 H2 WAT 8328 114.832 87.827 19.079 1.00 0.00 H TER 82993 WAT 8328 ATOM 82993 O WAT 8329 108.229 34.981 112.449 1.00 0.00 O ATOM 82994 H1 WAT 8329 108.782 34.845 111.679 1.00 0.00 H ATOM 82995 H2 WAT 8329 108.846 35.154 113.160 1.00 0.00 H TER 82997 WAT 8329 ATOM 82997 O WAT 8330 31.759 131.691 133.464 1.00 0.00 O ATOM 82998 H1 WAT 8330 32.267 130.917 133.707 1.00 0.00 H ATOM 82999 H2 WAT 8330 31.910 132.310 134.178 1.00 0.00 H TER 83001 WAT 8330 ATOM 83001 O WAT 8331 94.748 29.800 134.906 1.00 0.00 O ATOM 83002 H1 WAT 8331 95.233 29.027 135.196 1.00 0.00 H ATOM 83003 H2 WAT 8331 94.804 30.409 135.642 1.00 0.00 H TER 83005 WAT 8331 ATOM 83005 O WAT 8332 117.419 113.460 139.408 1.00 0.00 O ATOM 83006 H1 WAT 8332 117.012 112.600 139.515 1.00 0.00 H ATOM 83007 H2 WAT 8332 117.926 113.586 140.210 1.00 0.00 H TER 83009 WAT 8332 ATOM 83009 O WAT 8333 77.235 137.419 20.194 1.00 0.00 O ATOM 83010 H1 WAT 8333 77.080 137.342 21.136 1.00 0.00 H ATOM 83011 H2 WAT 8333 78.044 137.926 20.126 1.00 0.00 H TER 83013 WAT 8333 ATOM 83013 O WAT 8334 77.302 120.093 72.298 1.00 0.00 O ATOM 83014 H1 WAT 8334 78.174 120.354 72.594 1.00 0.00 H ATOM 83015 H2 WAT 8334 77.277 119.145 72.431 1.00 0.00 H TER 83017 WAT 8334 ATOM 83017 O WAT 8335 88.991 114.763 154.255 1.00 0.00 O ATOM 83018 H1 WAT 8335 89.408 115.498 154.703 1.00 0.00 H ATOM 83019 H2 WAT 8335 88.183 114.610 154.745 1.00 0.00 H TER 83021 WAT 8335 ATOM 83021 O WAT 8336 35.510 106.650 143.144 1.00 0.00 O ATOM 83022 H1 WAT 8336 36.352 107.086 143.012 1.00 0.00 H ATOM 83023 H2 WAT 8336 34.864 107.354 143.083 1.00 0.00 H TER 83025 WAT 8336 ATOM 83025 O WAT 8337 52.816 72.813 138.477 1.00 0.00 O ATOM 83026 H1 WAT 8337 53.010 73.615 138.963 1.00 0.00 H ATOM 83027 H2 WAT 8337 53.671 72.409 138.332 1.00 0.00 H TER 83029 WAT 8337 ATOM 83029 O WAT 8338 57.176 82.736 114.870 1.00 0.00 O ATOM 83030 H1 WAT 8338 57.654 81.919 115.015 1.00 0.00 H ATOM 83031 H2 WAT 8338 57.799 83.301 114.415 1.00 0.00 H TER 83033 WAT 8338 ATOM 83033 O WAT 8339 50.105 47.126 110.513 1.00 0.00 O ATOM 83034 H1 WAT 8339 49.373 47.203 109.902 1.00 0.00 H ATOM 83035 H2 WAT 8339 49.757 47.447 111.346 1.00 0.00 H TER 83037 WAT 8339 ATOM 83037 O WAT 8340 94.957 53.396 74.231 1.00 0.00 O ATOM 83038 H1 WAT 8340 94.289 53.842 73.710 1.00 0.00 H ATOM 83039 H2 WAT 8340 94.752 53.632 75.135 1.00 0.00 H TER 83041 WAT 8340 ATOM 83041 O WAT 8341 97.872 72.918 64.840 1.00 0.00 O ATOM 83042 H1 WAT 8341 98.034 73.389 65.657 1.00 0.00 H ATOM 83043 H2 WAT 8341 96.984 73.172 64.589 1.00 0.00 H TER 83045 WAT 8341 ATOM 83045 O WAT 8342 74.622 108.549 96.174 1.00 0.00 O ATOM 83046 H1 WAT 8342 74.902 109.260 96.750 1.00 0.00 H ATOM 83047 H2 WAT 8342 74.409 108.981 95.347 1.00 0.00 H TER 83049 WAT 8342 ATOM 83049 O WAT 8343 76.431 143.141 71.181 1.00 0.00 O ATOM 83050 H1 WAT 8343 75.697 143.121 70.566 1.00 0.00 H ATOM 83051 H2 WAT 8343 76.932 142.350 70.980 1.00 0.00 H TER 83053 WAT 8343 ATOM 83053 O WAT 8344 69.855 30.152 78.098 1.00 0.00 O ATOM 83054 H1 WAT 8344 69.115 30.317 77.514 1.00 0.00 H ATOM 83055 H2 WAT 8344 69.474 29.689 78.843 1.00 0.00 H TER 83057 WAT 8344 ATOM 83057 O WAT 8345 131.114 78.866 130.114 1.00 0.00 O ATOM 83058 H1 WAT 8345 131.809 78.957 129.462 1.00 0.00 H ATOM 83059 H2 WAT 8345 130.943 77.925 130.151 1.00 0.00 H TER 83061 WAT 8345 ATOM 83061 O WAT 8346 49.840 109.237 107.998 1.00 0.00 O ATOM 83062 H1 WAT 8346 49.896 108.993 108.921 1.00 0.00 H ATOM 83063 H2 WAT 8346 50.478 109.943 107.897 1.00 0.00 H TER 83065 WAT 8346 ATOM 83065 O WAT 8347 105.780 119.670 150.061 1.00 0.00 O ATOM 83066 H1 WAT 8347 105.261 120.376 149.675 1.00 0.00 H ATOM 83067 H2 WAT 8347 106.614 119.702 149.593 1.00 0.00 H TER 83069 WAT 8347 ATOM 83069 O WAT 8348 139.700 73.943 77.821 1.00 0.00 O ATOM 83070 H1 WAT 8348 139.030 74.606 77.653 1.00 0.00 H ATOM 83071 H2 WAT 8348 139.290 73.341 78.442 1.00 0.00 H TER 83073 WAT 8348 ATOM 83073 O WAT 8349 131.614 130.453 103.163 1.00 0.00 O ATOM 83074 H1 WAT 8349 131.730 130.589 102.223 1.00 0.00 H ATOM 83075 H2 WAT 8349 131.130 129.630 103.227 1.00 0.00 H TER 83077 WAT 8349 ATOM 83077 O WAT 8350 137.004 4.950 114.025 1.00 0.00 O ATOM 83078 H1 WAT 8350 137.934 4.918 114.250 1.00 0.00 H ATOM 83079 H2 WAT 8350 136.952 4.534 113.164 1.00 0.00 H TER 83081 WAT 8350 ATOM 83081 O WAT 8351 84.125 117.663 153.046 1.00 0.00 O ATOM 83082 H1 WAT 8351 83.921 117.008 153.714 1.00 0.00 H ATOM 83083 H2 WAT 8351 83.916 118.500 153.459 1.00 0.00 H TER 83085 WAT 8351 ATOM 83085 O WAT 8352 81.725 61.822 4.661 1.00 0.00 O ATOM 83086 H1 WAT 8352 81.635 62.719 4.338 1.00 0.00 H ATOM 83087 H2 WAT 8352 80.848 61.448 4.575 1.00 0.00 H TER 83089 WAT 8352 ATOM 83089 O WAT 8353 129.999 44.026 98.908 1.00 0.00 O ATOM 83090 H1 WAT 8353 130.878 43.707 99.110 1.00 0.00 H ATOM 83091 H2 WAT 8353 130.067 44.978 98.979 1.00 0.00 H TER 83093 WAT 8353 ATOM 83093 O WAT 8354 75.079 96.235 143.148 1.00 0.00 O ATOM 83094 H1 WAT 8354 75.898 95.765 143.305 1.00 0.00 H ATOM 83095 H2 WAT 8354 74.634 96.230 143.995 1.00 0.00 H TER 83097 WAT 8354 ATOM 83097 O WAT 8355 136.872 62.167 68.329 1.00 0.00 O ATOM 83098 H1 WAT 8355 136.823 61.610 69.106 1.00 0.00 H ATOM 83099 H2 WAT 8355 137.802 62.376 68.242 1.00 0.00 H TER 83101 WAT 8355 ATOM 83101 O WAT 8356 119.167 83.601 83.501 1.00 0.00 O ATOM 83102 H1 WAT 8356 119.676 84.305 83.097 1.00 0.00 H ATOM 83103 H2 WAT 8356 118.319 83.634 83.059 1.00 0.00 H TER 83105 WAT 8356 ATOM 83105 O WAT 8357 8.770 8.361 71.224 1.00 0.00 O ATOM 83106 H1 WAT 8357 8.363 8.986 71.823 1.00 0.00 H ATOM 83107 H2 WAT 8357 9.257 8.904 70.605 1.00 0.00 H TER 83109 WAT 8357 ATOM 83109 O WAT 8358 7.414 138.372 154.741 1.00 0.00 O ATOM 83110 H1 WAT 8358 7.584 137.461 154.498 1.00 0.00 H ATOM 83111 H2 WAT 8358 8.014 138.543 155.466 1.00 0.00 H TER 83113 WAT 8358 ATOM 83113 O WAT 8359 83.919 14.917 157.619 1.00 0.00 O ATOM 83114 H1 WAT 8359 83.439 14.792 156.800 1.00 0.00 H ATOM 83115 H2 WAT 8359 83.427 15.594 158.083 1.00 0.00 H TER 83117 WAT 8359 ATOM 83117 O WAT 8360 116.872 40.456 23.897 1.00 0.00 O ATOM 83118 H1 WAT 8360 117.820 40.444 23.764 1.00 0.00 H ATOM 83119 H2 WAT 8360 116.760 40.748 24.802 1.00 0.00 H TER 83121 WAT 8360 ATOM 83121 O WAT 8361 108.053 138.570 66.073 1.00 0.00 O ATOM 83122 H1 WAT 8361 107.278 139.085 65.845 1.00 0.00 H ATOM 83123 H2 WAT 8361 107.751 137.974 66.758 1.00 0.00 H TER 83125 WAT 8361 ATOM 83125 O WAT 8362 16.676 24.365 1.854 1.00 0.00 O ATOM 83126 H1 WAT 8362 15.921 24.031 1.370 1.00 0.00 H ATOM 83127 H2 WAT 8362 16.678 25.306 1.676 1.00 0.00 H TER 83129 WAT 8362 ATOM 83129 O WAT 8363 59.421 15.355 15.712 1.00 0.00 O ATOM 83130 H1 WAT 8363 59.353 16.118 15.138 1.00 0.00 H ATOM 83131 H2 WAT 8363 59.273 14.606 15.134 1.00 0.00 H TER 83133 WAT 8363 ATOM 83133 O WAT 8364 115.768 30.946 100.385 1.00 0.00 O ATOM 83134 H1 WAT 8364 115.343 31.344 101.144 1.00 0.00 H ATOM 83135 H2 WAT 8364 115.100 30.963 99.700 1.00 0.00 H TER 83137 WAT 8364 ATOM 83137 O WAT 8365 108.356 7.642 14.568 1.00 0.00 O ATOM 83138 H1 WAT 8365 109.054 7.233 15.080 1.00 0.00 H ATOM 83139 H2 WAT 8365 107.747 7.983 15.224 1.00 0.00 H TER 83141 WAT 8365 ATOM 83141 O WAT 8366 64.832 144.146 3.538 1.00 0.00 O ATOM 83142 H1 WAT 8366 64.723 143.308 3.088 1.00 0.00 H ATOM 83143 H2 WAT 8366 64.369 144.034 4.369 1.00 0.00 H TER 83145 WAT 8366 ATOM 83145 O WAT 8367 52.565 61.728 6.515 1.00 0.00 O ATOM 83146 H1 WAT 8367 51.679 62.091 6.524 1.00 0.00 H ATOM 83147 H2 WAT 8367 52.981 62.094 7.295 1.00 0.00 H TER 83149 WAT 8367 ATOM 83149 O WAT 8368 13.300 101.610 1.325 1.00 0.00 O ATOM 83150 H1 WAT 8368 12.513 102.138 1.189 1.00 0.00 H ATOM 83151 H2 WAT 8368 13.848 101.797 0.563 1.00 0.00 H TER 83153 WAT 8368 ATOM 83153 O WAT 8369 22.372 106.631 25.843 1.00 0.00 O ATOM 83154 H1 WAT 8369 23.251 106.832 26.163 1.00 0.00 H ATOM 83155 H2 WAT 8369 21.804 107.255 26.294 1.00 0.00 H TER 83157 WAT 8369 ATOM 83157 O WAT 8370 16.165 76.659 142.699 1.00 0.00 O ATOM 83158 H1 WAT 8370 16.618 75.816 142.679 1.00 0.00 H ATOM 83159 H2 WAT 8370 16.817 77.273 143.038 1.00 0.00 H TER 83161 WAT 8370 ATOM 83161 O WAT 8371 2.512 59.717 1.647 1.00 0.00 O ATOM 83162 H1 WAT 8371 2.386 59.357 0.769 1.00 0.00 H ATOM 83163 H2 WAT 8371 2.914 59.004 2.143 1.00 0.00 H TER 83165 WAT 8371 ATOM 83165 O WAT 8372 141.197 121.213 99.223 1.00 0.00 O ATOM 83166 H1 WAT 8372 141.732 121.046 98.447 1.00 0.00 H ATOM 83167 H2 WAT 8372 141.784 121.669 99.825 1.00 0.00 H TER 83169 WAT 8372 ATOM 83169 O WAT 8373 61.235 77.962 129.895 1.00 0.00 O ATOM 83170 H1 WAT 8373 60.688 77.350 130.387 1.00 0.00 H ATOM 83171 H2 WAT 8373 61.469 78.638 130.530 1.00 0.00 H TER 83173 WAT 8373 ATOM 83173 O WAT 8374 90.881 131.688 83.518 1.00 0.00 O ATOM 83174 H1 WAT 8374 90.613 130.867 83.106 1.00 0.00 H ATOM 83175 H2 WAT 8374 90.116 131.964 84.023 1.00 0.00 H TER 83177 WAT 8374 ATOM 83177 O WAT 8375 19.978 10.570 86.483 1.00 0.00 O ATOM 83178 H1 WAT 8375 20.903 10.812 86.513 1.00 0.00 H ATOM 83179 H2 WAT 8375 19.968 9.712 86.059 1.00 0.00 H TER 83181 WAT 8375 ATOM 83181 O WAT 8376 104.460 126.365 116.985 1.00 0.00 O ATOM 83182 H1 WAT 8376 104.042 127.176 116.696 1.00 0.00 H ATOM 83183 H2 WAT 8376 105.398 126.553 116.951 1.00 0.00 H TER 83185 WAT 8376 ATOM 83185 O WAT 8377 62.384 111.060 78.088 1.00 0.00 O ATOM 83186 H1 WAT 8377 62.121 111.388 78.949 1.00 0.00 H ATOM 83187 H2 WAT 8377 62.736 110.187 78.262 1.00 0.00 H TER 83189 WAT 8377 ATOM 83189 O WAT 8378 78.090 137.459 134.451 1.00 0.00 O ATOM 83190 H1 WAT 8378 78.734 138.161 134.365 1.00 0.00 H ATOM 83191 H2 WAT 8378 77.269 137.848 134.149 1.00 0.00 H TER 83193 WAT 8378 ATOM 83193 O WAT 8379 143.633 88.254 144.671 1.00 0.00 O ATOM 83194 H1 WAT 8379 144.375 88.131 144.079 1.00 0.00 H ATOM 83195 H2 WAT 8379 143.098 87.469 144.550 1.00 0.00 H TER 83197 WAT 8379 ATOM 83197 O WAT 8380 15.947 1.248 137.954 1.00 0.00 O ATOM 83198 H1 WAT 8380 15.494 1.032 138.769 1.00 0.00 H ATOM 83199 H2 WAT 8380 16.876 1.240 138.187 1.00 0.00 H TER 83201 WAT 8380 ATOM 83201 O WAT 8381 41.161 137.444 125.141 1.00 0.00 O ATOM 83202 H1 WAT 8381 42.038 137.083 125.007 1.00 0.00 H ATOM 83203 H2 WAT 8381 41.197 138.314 124.743 1.00 0.00 H TER 83205 WAT 8381 ATOM 83205 O WAT 8382 98.582 97.964 58.059 1.00 0.00 O ATOM 83206 H1 WAT 8382 98.372 97.407 57.310 1.00 0.00 H ATOM 83207 H2 WAT 8382 99.315 97.521 58.488 1.00 0.00 H TER 83209 WAT 8382 ATOM 83209 O WAT 8383 47.774 75.290 19.716 1.00 0.00 O ATOM 83210 H1 WAT 8383 46.920 75.531 20.073 1.00 0.00 H ATOM 83211 H2 WAT 8383 47.911 74.389 20.010 1.00 0.00 H TER 83213 WAT 8383 ATOM 83213 O WAT 8384 18.614 94.088 16.985 1.00 0.00 O ATOM 83214 H1 WAT 8384 19.105 94.910 16.982 1.00 0.00 H ATOM 83215 H2 WAT 8384 18.452 93.911 17.912 1.00 0.00 H TER 83217 WAT 8384 ATOM 83217 O WAT 8385 39.705 44.180 153.923 1.00 0.00 O ATOM 83218 H1 WAT 8385 40.301 43.807 154.572 1.00 0.00 H ATOM 83219 H2 WAT 8385 40.206 44.177 153.108 1.00 0.00 H TER 83221 WAT 8385 ATOM 83221 O WAT 8386 11.253 32.712 82.557 1.00 0.00 O ATOM 83222 H1 WAT 8386 11.970 33.342 82.484 1.00 0.00 H ATOM 83223 H2 WAT 8386 11.100 32.631 83.499 1.00 0.00 H TER 83225 WAT 8386 ATOM 83225 O WAT 8387 127.678 57.116 126.845 1.00 0.00 O ATOM 83226 H1 WAT 8387 127.769 57.237 125.900 1.00 0.00 H ATOM 83227 H2 WAT 8387 128.209 56.344 127.039 1.00 0.00 H TER 83229 WAT 8387 ATOM 83229 O WAT 8388 36.749 96.224 17.792 1.00 0.00 O ATOM 83230 H1 WAT 8388 37.258 95.429 17.949 1.00 0.00 H ATOM 83231 H2 WAT 8388 35.843 95.966 17.962 1.00 0.00 H TER 83233 WAT 8388 ATOM 83233 O WAT 8389 76.737 140.514 24.303 1.00 0.00 O ATOM 83234 H1 WAT 8389 75.848 140.189 24.161 1.00 0.00 H ATOM 83235 H2 WAT 8389 76.778 141.326 23.798 1.00 0.00 H TER 83237 WAT 8389 ATOM 83237 O WAT 8390 67.768 76.383 2.690 1.00 0.00 O ATOM 83238 H1 WAT 8390 67.601 76.094 1.793 1.00 0.00 H ATOM 83239 H2 WAT 8390 67.630 75.601 3.224 1.00 0.00 H TER 83241 WAT 8390 ATOM 83241 O WAT 8391 65.566 76.823 89.901 1.00 0.00 O ATOM 83242 H1 WAT 8391 66.291 77.412 90.112 1.00 0.00 H ATOM 83243 H2 WAT 8391 64.896 77.024 90.554 1.00 0.00 H TER 83245 WAT 8391 ATOM 83245 O WAT 8392 137.263 52.960 76.397 1.00 0.00 O ATOM 83246 H1 WAT 8392 137.897 53.036 77.111 1.00 0.00 H ATOM 83247 H2 WAT 8392 136.815 53.806 76.384 1.00 0.00 H TER 83249 WAT 8392 ATOM 83249 O WAT 8393 64.551 63.246 119.907 1.00 0.00 O ATOM 83250 H1 WAT 8393 65.170 62.995 119.221 1.00 0.00 H ATOM 83251 H2 WAT 8393 64.633 62.558 120.567 1.00 0.00 H TER 83253 WAT 8393 ATOM 83253 O WAT 8394 64.034 54.044 112.030 1.00 0.00 O ATOM 83254 H1 WAT 8394 63.325 53.426 112.205 1.00 0.00 H ATOM 83255 H2 WAT 8394 64.814 53.496 111.942 1.00 0.00 H TER 83257 WAT 8394 ATOM 83257 O WAT 8395 101.277 30.943 57.126 1.00 0.00 O ATOM 83258 H1 WAT 8395 101.863 30.261 56.798 1.00 0.00 H ATOM 83259 H2 WAT 8395 101.860 31.660 57.376 1.00 0.00 H TER 83261 WAT 8395 ATOM 83261 O WAT 8396 78.013 111.582 134.734 1.00 0.00 O ATOM 83262 H1 WAT 8396 78.284 110.789 134.272 1.00 0.00 H ATOM 83263 H2 WAT 8396 78.576 112.270 134.380 1.00 0.00 H TER 83265 WAT 8396 ATOM 83265 O WAT 8397 40.288 104.582 83.836 1.00 0.00 O ATOM 83266 H1 WAT 8397 40.507 103.998 83.110 1.00 0.00 H ATOM 83267 H2 WAT 8397 40.110 105.425 83.420 1.00 0.00 H TER 83269 WAT 8397 ATOM 83269 O WAT 8398 84.595 7.130 128.139 1.00 0.00 O ATOM 83270 H1 WAT 8398 84.226 6.282 127.893 1.00 0.00 H ATOM 83271 H2 WAT 8398 83.844 7.725 128.147 1.00 0.00 H TER 83273 WAT 8398 ATOM 83273 O WAT 8399 78.556 22.231 71.133 1.00 0.00 O ATOM 83274 H1 WAT 8399 77.769 21.946 71.597 1.00 0.00 H ATOM 83275 H2 WAT 8399 79.217 21.575 71.357 1.00 0.00 H TER 83277 WAT 8399 ATOM 83277 O WAT 8400 16.492 95.912 154.808 1.00 0.00 O ATOM 83278 H1 WAT 8400 16.725 95.775 155.726 1.00 0.00 H ATOM 83279 H2 WAT 8400 17.191 95.480 154.316 1.00 0.00 H TER 83281 WAT 8400 ATOM 83281 O WAT 8401 82.055 20.175 113.178 1.00 0.00 O ATOM 83282 H1 WAT 8401 81.481 20.442 113.897 1.00 0.00 H ATOM 83283 H2 WAT 8401 82.193 20.976 112.673 1.00 0.00 H TER 83285 WAT 8401 ATOM 83285 O WAT 8402 72.664 96.842 9.960 1.00 0.00 O ATOM 83286 H1 WAT 8402 73.468 96.345 10.111 1.00 0.00 H ATOM 83287 H2 WAT 8402 72.439 97.200 10.818 1.00 0.00 H TER 83289 WAT 8402 ATOM 83289 O WAT 8403 42.214 112.668 4.789 1.00 0.00 O ATOM 83290 H1 WAT 8403 42.451 113.190 4.023 1.00 0.00 H ATOM 83291 H2 WAT 8403 42.981 112.118 4.951 1.00 0.00 H TER 83293 WAT 8403 ATOM 83293 O WAT 8404 40.035 28.221 85.255 1.00 0.00 O ATOM 83294 H1 WAT 8404 39.105 28.248 85.032 1.00 0.00 H ATOM 83295 H2 WAT 8404 40.131 27.432 85.789 1.00 0.00 H TER 83297 WAT 8404 ATOM 83297 O WAT 8405 117.063 9.646 142.357 1.00 0.00 O ATOM 83298 H1 WAT 8405 118.012 9.519 142.380 1.00 0.00 H ATOM 83299 H2 WAT 8405 116.922 10.484 142.797 1.00 0.00 H TER 83301 WAT 8405 ATOM 83301 O WAT 8406 134.581 0.417 128.364 1.00 0.00 O ATOM 83302 H1 WAT 8406 135.488 0.724 128.378 1.00 0.00 H ATOM 83303 H2 WAT 8406 134.400 0.163 129.269 1.00 0.00 H TER 83305 WAT 8406 ATOM 83305 O WAT 8407 25.302 4.571 14.726 1.00 0.00 O ATOM 83306 H1 WAT 8407 25.215 5.137 15.493 1.00 0.00 H ATOM 83307 H2 WAT 8407 24.432 4.191 14.608 1.00 0.00 H TER 83309 WAT 8407 ATOM 83309 O WAT 8408 4.920 125.118 97.458 1.00 0.00 O ATOM 83310 H1 WAT 8408 4.974 125.696 96.697 1.00 0.00 H ATOM 83311 H2 WAT 8408 4.862 124.237 97.087 1.00 0.00 H TER 83313 WAT 8408 ATOM 83313 O WAT 8409 29.689 45.458 96.228 1.00 0.00 O ATOM 83314 H1 WAT 8409 30.237 45.903 96.874 1.00 0.00 H ATOM 83315 H2 WAT 8409 29.161 44.847 96.742 1.00 0.00 H TER 83317 WAT 8409 ATOM 83317 O WAT 8410 44.781 75.304 7.619 1.00 0.00 O ATOM 83318 H1 WAT 8410 44.616 74.853 8.446 1.00 0.00 H ATOM 83319 H2 WAT 8410 45.698 75.114 7.421 1.00 0.00 H TER 83321 WAT 8410 ATOM 83321 O WAT 8411 69.179 63.197 26.250 1.00 0.00 O ATOM 83322 H1 WAT 8411 69.555 63.914 25.739 1.00 0.00 H ATOM 83323 H2 WAT 8411 68.237 63.259 26.090 1.00 0.00 H TER 83325 WAT 8411 ATOM 83325 O WAT 8412 9.863 78.325 76.572 1.00 0.00 O ATOM 83326 H1 WAT 8412 8.979 78.277 76.937 1.00 0.00 H ATOM 83327 H2 WAT 8412 10.152 77.413 76.525 1.00 0.00 H TER 83329 WAT 8412 ATOM 83329 O WAT 8413 39.799 142.431 78.276 1.00 0.00 O ATOM 83330 H1 WAT 8413 40.692 142.315 78.599 1.00 0.00 H ATOM 83331 H2 WAT 8413 39.703 143.377 78.168 1.00 0.00 H TER 83333 WAT 8413 ATOM 83333 O WAT 8414 32.285 15.902 104.065 1.00 0.00 O ATOM 83334 H1 WAT 8414 33.222 16.057 103.945 1.00 0.00 H ATOM 83335 H2 WAT 8414 32.013 15.452 103.265 1.00 0.00 H TER 83337 WAT 8414 ATOM 83337 O WAT 8415 28.053 33.796 137.674 1.00 0.00 O ATOM 83338 H1 WAT 8415 27.397 33.110 137.549 1.00 0.00 H ATOM 83339 H2 WAT 8415 28.423 33.934 136.802 1.00 0.00 H TER 83341 WAT 8415 ATOM 83341 O WAT 8416 24.315 5.761 113.152 1.00 0.00 O ATOM 83342 H1 WAT 8416 23.828 4.966 112.933 1.00 0.00 H ATOM 83343 H2 WAT 8416 24.885 5.908 112.398 1.00 0.00 H TER 83345 WAT 8416 ATOM 83345 O WAT 8417 66.827 118.217 51.270 1.00 0.00 O ATOM 83346 H1 WAT 8417 67.555 117.920 51.815 1.00 0.00 H ATOM 83347 H2 WAT 8417 66.796 119.164 51.407 1.00 0.00 H TER 83349 WAT 8417 ATOM 83349 O WAT 8418 99.561 93.113 15.144 1.00 0.00 O ATOM 83350 H1 WAT 8418 98.785 93.176 14.586 1.00 0.00 H ATOM 83351 H2 WAT 8418 100.077 92.406 14.756 1.00 0.00 H TER 83353 WAT 8418 ATOM 83353 O WAT 8419 134.902 39.869 138.734 1.00 0.00 O ATOM 83354 H1 WAT 8419 135.700 39.669 139.223 1.00 0.00 H ATOM 83355 H2 WAT 8419 134.845 40.824 138.749 1.00 0.00 H TER 83357 WAT 8419 ATOM 83357 O WAT 8420 123.230 65.746 93.115 1.00 0.00 O ATOM 83358 H1 WAT 8420 122.376 65.415 93.393 1.00 0.00 H ATOM 83359 H2 WAT 8420 123.747 64.959 92.942 1.00 0.00 H TER 83361 WAT 8420 ATOM 83361 O WAT 8421 63.019 72.513 67.633 1.00 0.00 O ATOM 83362 H1 WAT 8421 62.129 72.627 67.965 1.00 0.00 H ATOM 83363 H2 WAT 8421 63.005 72.920 66.766 1.00 0.00 H TER 83365 WAT 8421 ATOM 83365 O WAT 8422 66.473 68.979 69.933 1.00 0.00 O ATOM 83366 H1 WAT 8422 65.743 69.329 69.422 1.00 0.00 H ATOM 83367 H2 WAT 8422 66.056 68.484 70.639 1.00 0.00 H TER 83369 WAT 8422 ATOM 83369 O WAT 8423 40.058 6.534 133.366 1.00 0.00 O ATOM 83370 H1 WAT 8423 39.908 6.328 134.288 1.00 0.00 H ATOM 83371 H2 WAT 8423 40.840 7.086 133.368 1.00 0.00 H TER 83373 WAT 8423 ATOM 83373 O WAT 8424 80.013 115.903 74.950 1.00 0.00 O ATOM 83374 H1 WAT 8424 79.859 116.166 75.858 1.00 0.00 H ATOM 83375 H2 WAT 8424 80.230 116.718 74.498 1.00 0.00 H TER 83377 WAT 8424 ATOM 83377 O WAT 8425 103.668 84.248 85.637 1.00 0.00 O ATOM 83378 H1 WAT 8425 104.067 84.457 84.793 1.00 0.00 H ATOM 83379 H2 WAT 8425 103.368 83.344 85.543 1.00 0.00 H TER 83381 WAT 8425 ATOM 83381 O WAT 8426 4.873 116.956 123.498 1.00 0.00 O ATOM 83382 H1 WAT 8426 4.268 116.559 122.871 1.00 0.00 H ATOM 83383 H2 WAT 8426 5.636 116.378 123.493 1.00 0.00 H TER 83385 WAT 8426 ATOM 83385 O WAT 8427 10.548 84.988 152.683 1.00 0.00 O ATOM 83386 H1 WAT 8427 10.756 85.897 152.900 1.00 0.00 H ATOM 83387 H2 WAT 8427 10.923 84.479 153.401 1.00 0.00 H TER 83389 WAT 8427 ATOM 83389 O WAT 8428 29.239 62.366 5.572 1.00 0.00 O ATOM 83390 H1 WAT 8428 28.639 62.672 6.252 1.00 0.00 H ATOM 83391 H2 WAT 8428 29.273 61.417 5.692 1.00 0.00 H TER 83393 WAT 8428 ATOM 83393 O WAT 8429 76.066 73.464 24.230 1.00 0.00 O ATOM 83394 H1 WAT 8429 75.117 73.589 24.213 1.00 0.00 H ATOM 83395 H2 WAT 8429 76.183 72.556 24.507 1.00 0.00 H TER 83397 WAT 8429 ATOM 83397 O WAT 8430 111.874 46.657 143.438 1.00 0.00 O ATOM 83398 H1 WAT 8430 111.744 46.909 142.524 1.00 0.00 H ATOM 83399 H2 WAT 8430 112.816 46.756 143.581 1.00 0.00 H TER 83401 WAT 8430 ATOM 83401 O WAT 8431 29.955 65.426 111.600 1.00 0.00 O ATOM 83402 H1 WAT 8431 29.036 65.626 111.778 1.00 0.00 H ATOM 83403 H2 WAT 8431 29.984 64.472 111.531 1.00 0.00 H TER 83405 WAT 8431 ATOM 83405 O WAT 8432 95.598 43.906 71.373 1.00 0.00 O ATOM 83406 H1 WAT 8432 94.695 43.593 71.436 1.00 0.00 H ATOM 83407 H2 WAT 8432 95.909 43.572 70.532 1.00 0.00 H TER 83409 WAT 8432 ATOM 83409 O WAT 8433 24.980 20.889 18.155 1.00 0.00 O ATOM 83410 H1 WAT 8433 24.675 20.481 18.966 1.00 0.00 H ATOM 83411 H2 WAT 8433 25.915 20.688 18.122 1.00 0.00 H TER 83413 WAT 8433 ATOM 83413 O WAT 8434 136.458 125.517 89.088 1.00 0.00 O ATOM 83414 H1 WAT 8434 136.458 124.937 89.850 1.00 0.00 H ATOM 83415 H2 WAT 8434 136.233 124.947 88.353 1.00 0.00 H TER 83417 WAT 8434 ATOM 83417 O WAT 8435 65.345 98.630 101.538 1.00 0.00 O ATOM 83418 H1 WAT 8435 64.704 97.943 101.721 1.00 0.00 H ATOM 83419 H2 WAT 8435 65.950 98.232 100.911 1.00 0.00 H TER 83421 WAT 8435 ATOM 83421 O WAT 8436 121.971 134.401 88.258 1.00 0.00 O ATOM 83422 H1 WAT 8436 122.494 133.884 88.870 1.00 0.00 H ATOM 83423 H2 WAT 8436 121.658 135.142 88.777 1.00 0.00 H TER 83425 WAT 8436 ATOM 83425 O WAT 8437 82.256 10.801 57.702 1.00 0.00 O ATOM 83426 H1 WAT 8437 82.719 10.065 57.301 1.00 0.00 H ATOM 83427 H2 WAT 8437 82.106 11.411 56.980 1.00 0.00 H TER 83429 WAT 8437 ATOM 83429 O WAT 8438 86.575 100.608 121.767 1.00 0.00 O ATOM 83430 H1 WAT 8438 85.709 100.740 122.154 1.00 0.00 H ATOM 83431 H2 WAT 8438 87.178 100.653 122.509 1.00 0.00 H TER 83433 WAT 8438 ATOM 83433 O WAT 8439 99.060 19.875 134.891 1.00 0.00 O ATOM 83434 H1 WAT 8439 99.473 20.613 135.339 1.00 0.00 H ATOM 83435 H2 WAT 8439 99.511 19.104 135.234 1.00 0.00 H TER 83437 WAT 8439 ATOM 83437 O WAT 8440 0.356 124.355 135.273 1.00 0.00 O ATOM 83438 H1 WAT 8440 0.200 124.297 136.216 1.00 0.00 H ATOM 83439 H2 WAT 8440 -0.082 123.585 134.910 1.00 0.00 H TER 83441 WAT 8440 ATOM 83441 O WAT 8441 141.830 52.213 109.879 1.00 0.00 O ATOM 83442 H1 WAT 8441 141.966 51.276 109.745 1.00 0.00 H ATOM 83443 H2 WAT 8441 142.018 52.352 110.808 1.00 0.00 H TER 83445 WAT 8441 ATOM 83445 O WAT 8442 129.477 66.632 120.897 1.00 0.00 O ATOM 83446 H1 WAT 8442 130.384 66.359 121.032 1.00 0.00 H ATOM 83447 H2 WAT 8442 129.506 67.588 120.927 1.00 0.00 H TER 83449 WAT 8442 ATOM 83449 O WAT 8443 49.454 110.445 6.348 1.00 0.00 O ATOM 83450 H1 WAT 8443 50.378 110.618 6.528 1.00 0.00 H ATOM 83451 H2 WAT 8443 49.169 109.886 7.071 1.00 0.00 H TER 83453 WAT 8443 ATOM 83453 O WAT 8444 119.099 83.561 124.374 1.00 0.00 O ATOM 83454 H1 WAT 8444 118.483 84.257 124.602 1.00 0.00 H ATOM 83455 H2 WAT 8444 119.353 83.181 125.215 1.00 0.00 H TER 83457 WAT 8444 ATOM 83457 O WAT 8445 60.762 131.370 88.894 1.00 0.00 O ATOM 83458 H1 WAT 8445 61.547 131.664 89.355 1.00 0.00 H ATOM 83459 H2 WAT 8445 60.063 131.929 89.231 1.00 0.00 H TER 83461 WAT 8445 ATOM 83461 O WAT 8446 23.886 68.203 87.465 1.00 0.00 O ATOM 83462 H1 WAT 8446 24.377 67.430 87.187 1.00 0.00 H ATOM 83463 H2 WAT 8446 24.163 68.892 86.861 1.00 0.00 H TER 83465 WAT 8446 ATOM 83465 O WAT 8447 115.747 48.440 16.455 1.00 0.00 O ATOM 83466 H1 WAT 8447 116.488 47.837 16.514 1.00 0.00 H ATOM 83467 H2 WAT 8447 114.975 47.880 16.531 1.00 0.00 H TER 83469 WAT 8447 ATOM 83469 O WAT 8448 119.302 125.426 3.117 1.00 0.00 O ATOM 83470 H1 WAT 8448 120.054 125.297 2.538 1.00 0.00 H ATOM 83471 H2 WAT 8448 119.230 124.604 3.601 1.00 0.00 H TER 83473 WAT 8448 ATOM 83473 O WAT 8449 81.583 117.872 52.700 1.00 0.00 O ATOM 83474 H1 WAT 8449 80.737 117.429 52.630 1.00 0.00 H ATOM 83475 H2 WAT 8449 81.436 118.732 52.306 1.00 0.00 H TER 83477 WAT 8449 ATOM 83477 O WAT 8450 40.107 107.137 8.149 1.00 0.00 O ATOM 83478 H1 WAT 8450 40.339 108.064 8.215 1.00 0.00 H ATOM 83479 H2 WAT 8450 40.573 106.721 8.874 1.00 0.00 H TER 83481 WAT 8450 ATOM 83481 O WAT 8451 94.795 36.408 108.796 1.00 0.00 O ATOM 83482 H1 WAT 8451 94.210 37.159 108.899 1.00 0.00 H ATOM 83483 H2 WAT 8451 94.560 36.036 107.946 1.00 0.00 H TER 83485 WAT 8451 ATOM 83485 O WAT 8452 43.390 5.010 53.077 1.00 0.00 O ATOM 83486 H1 WAT 8452 42.474 5.238 52.918 1.00 0.00 H ATOM 83487 H2 WAT 8452 43.355 4.347 53.767 1.00 0.00 H TER 83489 WAT 8452 ATOM 83489 O WAT 8453 101.946 21.738 3.512 1.00 0.00 O ATOM 83490 H1 WAT 8453 101.014 21.726 3.296 1.00 0.00 H ATOM 83491 H2 WAT 8453 102.150 20.831 3.742 1.00 0.00 H TER 83493 WAT 8453 ATOM 83493 O WAT 8454 29.424 29.753 145.467 1.00 0.00 O ATOM 83494 H1 WAT 8454 30.280 30.143 145.289 1.00 0.00 H ATOM 83495 H2 WAT 8454 29.207 30.047 146.352 1.00 0.00 H TER 83497 WAT 8454 ATOM 83497 O WAT 8455 107.694 106.045 16.784 1.00 0.00 O ATOM 83498 H1 WAT 8455 107.545 105.750 15.886 1.00 0.00 H ATOM 83499 H2 WAT 8455 108.040 106.933 16.690 1.00 0.00 H TER 83501 WAT 8455 ATOM 83501 O WAT 8456 95.315 41.945 87.486 1.00 0.00 O ATOM 83502 H1 WAT 8456 96.115 42.175 87.013 1.00 0.00 H ATOM 83503 H2 WAT 8456 94.641 41.895 86.809 1.00 0.00 H TER 83505 WAT 8456 ATOM 83505 O WAT 8457 33.127 63.942 121.467 1.00 0.00 O ATOM 83506 H1 WAT 8457 33.916 64.054 121.998 1.00 0.00 H ATOM 83507 H2 WAT 8457 32.946 64.816 121.121 1.00 0.00 H TER 83509 WAT 8457 ATOM 83509 O WAT 8458 145.641 139.573 4.457 1.00 0.00 O ATOM 83510 H1 WAT 8458 145.373 139.608 5.375 1.00 0.00 H ATOM 83511 H2 WAT 8458 145.893 138.660 4.316 1.00 0.00 H TER 83513 WAT 8458 ATOM 83513 O WAT 8459 78.547 70.933 140.902 1.00 0.00 O ATOM 83514 H1 WAT 8459 78.983 70.081 140.919 1.00 0.00 H ATOM 83515 H2 WAT 8459 78.108 70.961 140.052 1.00 0.00 H TER 83517 WAT 8459 ATOM 83517 O WAT 8460 34.615 68.342 5.426 1.00 0.00 O ATOM 83518 H1 WAT 8460 34.403 67.522 5.872 1.00 0.00 H ATOM 83519 H2 WAT 8460 33.775 68.791 5.336 1.00 0.00 H TER 83521 WAT 8460 ATOM 83521 O WAT 8461 28.045 5.881 105.793 1.00 0.00 O ATOM 83522 H1 WAT 8461 28.122 4.993 105.444 1.00 0.00 H ATOM 83523 H2 WAT 8461 27.358 6.288 105.264 1.00 0.00 H TER 83525 WAT 8461 ATOM 83525 O WAT 8462 119.946 101.659 97.870 1.00 0.00 O ATOM 83526 H1 WAT 8462 120.676 102.055 98.347 1.00 0.00 H ATOM 83527 H2 WAT 8462 119.423 102.403 97.572 1.00 0.00 H TER 83529 WAT 8462 ATOM 83529 O WAT 8463 71.476 103.424 98.724 1.00 0.00 O ATOM 83530 H1 WAT 8463 70.761 103.944 98.357 1.00 0.00 H ATOM 83531 H2 WAT 8463 71.806 102.915 97.984 1.00 0.00 H TER 83533 WAT 8463 ATOM 83533 O WAT 8464 17.097 69.466 143.438 1.00 0.00 O ATOM 83534 H1 WAT 8464 17.947 69.562 143.868 1.00 0.00 H ATOM 83535 H2 WAT 8464 16.735 68.658 143.802 1.00 0.00 H TER 83537 WAT 8464 ATOM 83537 O WAT 8465 104.184 58.804 23.868 1.00 0.00 O ATOM 83538 H1 WAT 8465 104.827 58.315 23.355 1.00 0.00 H ATOM 83539 H2 WAT 8465 104.376 58.572 24.777 1.00 0.00 H TER 83541 WAT 8465 ATOM 83541 O WAT 8466 142.300 95.001 140.601 1.00 0.00 O ATOM 83542 H1 WAT 8466 141.939 95.295 141.437 1.00 0.00 H ATOM 83543 H2 WAT 8466 142.020 95.668 139.973 1.00 0.00 H TER 83545 WAT 8466 ATOM 83545 O WAT 8467 47.366 29.127 67.676 1.00 0.00 O ATOM 83546 H1 WAT 8467 47.767 29.266 66.817 1.00 0.00 H ATOM 83547 H2 WAT 8467 47.277 28.176 67.747 1.00 0.00 H TER 83549 WAT 8467 ATOM 83549 O WAT 8468 110.081 2.826 7.844 1.00 0.00 O ATOM 83550 H1 WAT 8468 110.621 3.460 7.371 1.00 0.00 H ATOM 83551 H2 WAT 8468 109.223 2.881 7.423 1.00 0.00 H TER 83553 WAT 8468 ATOM 83553 O WAT 8469 13.539 89.249 145.738 1.00 0.00 O ATOM 83554 H1 WAT 8469 12.722 88.810 145.500 1.00 0.00 H ATOM 83555 H2 WAT 8469 13.360 90.179 145.600 1.00 0.00 H TER 83557 WAT 8469 ATOM 83557 O WAT 8470 61.820 122.617 88.225 1.00 0.00 O ATOM 83558 H1 WAT 8470 61.866 122.510 87.275 1.00 0.00 H ATOM 83559 H2 WAT 8470 62.713 122.456 88.528 1.00 0.00 H TER 83561 WAT 8470 ATOM 83561 O WAT 8471 23.371 78.546 106.853 1.00 0.00 O ATOM 83562 H1 WAT 8471 23.320 78.424 107.801 1.00 0.00 H ATOM 83563 H2 WAT 8471 23.057 77.719 106.487 1.00 0.00 H TER 83565 WAT 8471 ATOM 83565 O WAT 8472 38.423 36.351 135.029 1.00 0.00 O ATOM 83566 H1 WAT 8472 38.286 36.999 135.720 1.00 0.00 H ATOM 83567 H2 WAT 8472 37.963 35.571 135.338 1.00 0.00 H TER 83569 WAT 8472 ATOM 83569 O WAT 8473 45.636 6.657 118.212 1.00 0.00 O ATOM 83570 H1 WAT 8473 45.584 7.483 118.692 1.00 0.00 H ATOM 83571 H2 WAT 8473 45.125 6.810 117.417 1.00 0.00 H TER 83573 WAT 8473 ATOM 83573 O WAT 8474 46.034 119.733 103.913 1.00 0.00 O ATOM 83574 H1 WAT 8474 45.879 119.683 104.856 1.00 0.00 H ATOM 83575 H2 WAT 8474 46.901 120.130 103.833 1.00 0.00 H TER 83577 WAT 8474 ATOM 83577 O WAT 8475 59.610 141.990 73.149 1.00 0.00 O ATOM 83578 H1 WAT 8475 60.002 142.692 72.629 1.00 0.00 H ATOM 83579 H2 WAT 8475 60.283 141.310 73.180 1.00 0.00 H TER 83581 WAT 8475 ATOM 83581 O WAT 8476 74.458 14.418 87.600 1.00 0.00 O ATOM 83582 H1 WAT 8476 74.698 14.472 88.526 1.00 0.00 H ATOM 83583 H2 WAT 8476 75.143 14.910 87.147 1.00 0.00 H TER 83585 WAT 8476 ATOM 83585 O WAT 8477 59.313 39.452 104.301 1.00 0.00 O ATOM 83586 H1 WAT 8477 60.054 39.959 104.634 1.00 0.00 H ATOM 83587 H2 WAT 8477 58.558 39.786 104.785 1.00 0.00 H TER 83589 WAT 8477 ATOM 83589 O WAT 8478 27.789 10.684 88.930 1.00 0.00 O ATOM 83590 H1 WAT 8478 27.157 10.028 89.225 1.00 0.00 H ATOM 83591 H2 WAT 8478 27.315 11.196 88.275 1.00 0.00 H TER 83593 WAT 8478 ATOM 83593 O WAT 8479 67.529 92.512 22.658 1.00 0.00 O ATOM 83594 H1 WAT 8479 66.613 92.658 22.896 1.00 0.00 H ATOM 83595 H2 WAT 8479 67.562 91.597 22.380 1.00 0.00 H TER 83597 WAT 8479 ATOM 83597 O WAT 8480 143.071 65.846 62.344 1.00 0.00 O ATOM 83598 H1 WAT 8480 143.605 66.612 62.133 1.00 0.00 H ATOM 83599 H2 WAT 8480 142.225 66.023 61.932 1.00 0.00 H TER 83601 WAT 8480 ATOM 83601 O WAT 8481 14.027 139.487 97.764 1.00 0.00 O ATOM 83602 H1 WAT 8481 14.440 138.920 98.416 1.00 0.00 H ATOM 83603 H2 WAT 8481 14.214 139.063 96.926 1.00 0.00 H TER 83605 WAT 8481 ATOM 83605 O WAT 8482 77.304 15.884 83.877 1.00 0.00 O ATOM 83606 H1 WAT 8482 77.655 15.072 83.512 1.00 0.00 H ATOM 83607 H2 WAT 8482 77.983 16.537 83.704 1.00 0.00 H TER 83609 WAT 8482 ATOM 83609 O WAT 8483 29.522 6.965 122.815 1.00 0.00 O ATOM 83610 H1 WAT 8483 29.369 7.672 123.443 1.00 0.00 H ATOM 83611 H2 WAT 8483 28.646 6.660 122.581 1.00 0.00 H TER 83613 WAT 8483 ATOM 83613 O WAT 8484 60.114 66.426 96.535 1.00 0.00 O ATOM 83614 H1 WAT 8484 59.649 67.245 96.369 1.00 0.00 H ATOM 83615 H2 WAT 8484 60.203 66.389 97.487 1.00 0.00 H TER 83617 WAT 8484 ATOM 83617 O WAT 8485 85.251 115.523 115.031 1.00 0.00 O ATOM 83618 H1 WAT 8485 84.799 114.691 115.173 1.00 0.00 H ATOM 83619 H2 WAT 8485 84.723 115.973 114.372 1.00 0.00 H TER 83621 WAT 8485 ATOM 83621 O WAT 8486 15.823 34.050 20.598 1.00 0.00 O ATOM 83622 H1 WAT 8486 16.775 34.149 20.596 1.00 0.00 H ATOM 83623 H2 WAT 8486 15.595 33.944 21.522 1.00 0.00 H TER 83625 WAT 8486 ATOM 83625 O WAT 8487 92.002 61.202 141.873 1.00 0.00 O ATOM 83626 H1 WAT 8487 92.580 60.869 141.186 1.00 0.00 H ATOM 83627 H2 WAT 8487 92.589 61.412 142.599 1.00 0.00 H TER 83629 WAT 8487 ATOM 83629 O WAT 8488 2.412 96.216 60.781 1.00 0.00 O ATOM 83630 H1 WAT 8488 2.251 97.078 60.398 1.00 0.00 H ATOM 83631 H2 WAT 8488 2.242 95.602 60.067 1.00 0.00 H TER 83633 WAT 8488 ATOM 83633 O WAT 8489 0.417 70.126 4.291 1.00 0.00 O ATOM 83634 H1 WAT 8489 0.653 70.970 4.677 1.00 0.00 H ATOM 83635 H2 WAT 8489 0.923 69.485 4.791 1.00 0.00 H TER 83637 WAT 8489 ATOM 83637 O WAT 8490 129.684 111.545 143.360 1.00 0.00 O ATOM 83638 H1 WAT 8490 128.832 111.981 143.368 1.00 0.00 H ATOM 83639 H2 WAT 8490 130.174 111.989 142.668 1.00 0.00 H TER 83641 WAT 8490 ATOM 83641 O WAT 8491 15.423 37.321 147.797 1.00 0.00 O ATOM 83642 H1 WAT 8491 15.817 37.542 146.953 1.00 0.00 H ATOM 83643 H2 WAT 8491 16.169 37.136 148.367 1.00 0.00 H TER 83645 WAT 8491 ATOM 83645 O WAT 8492 97.402 119.685 16.915 1.00 0.00 O ATOM 83646 H1 WAT 8492 96.701 119.962 16.326 1.00 0.00 H ATOM 83647 H2 WAT 8492 97.295 118.737 16.986 1.00 0.00 H TER 83649 WAT 8492 ATOM 83649 O WAT 8493 90.682 93.986 145.569 1.00 0.00 O ATOM 83650 H1 WAT 8493 91.102 93.247 146.009 1.00 0.00 H ATOM 83651 H2 WAT 8493 91.374 94.371 145.032 1.00 0.00 H TER 83653 WAT 8493 ATOM 83653 O WAT 8494 42.944 35.337 2.516 1.00 0.00 O ATOM 83654 H1 WAT 8494 42.894 36.226 2.868 1.00 0.00 H ATOM 83655 H2 WAT 8494 43.758 34.983 2.873 1.00 0.00 H TER 83657 WAT 8494 ATOM 83657 O WAT 8495 27.973 21.427 115.818 1.00 0.00 O ATOM 83658 H1 WAT 8495 27.653 20.686 115.305 1.00 0.00 H ATOM 83659 H2 WAT 8495 27.742 22.197 115.297 1.00 0.00 H TER 83661 WAT 8495 ATOM 83661 O WAT 8496 94.365 15.480 108.136 1.00 0.00 O ATOM 83662 H1 WAT 8496 94.937 15.613 108.892 1.00 0.00 H ATOM 83663 H2 WAT 8496 93.481 15.471 108.504 1.00 0.00 H TER 83665 WAT 8496 ATOM 83665 O WAT 8497 42.601 122.623 87.415 1.00 0.00 O ATOM 83666 H1 WAT 8497 41.950 122.491 88.104 1.00 0.00 H ATOM 83667 H2 WAT 8497 43.023 123.452 87.640 1.00 0.00 H TER 83669 WAT 8497 ATOM 83669 O WAT 8498 127.158 134.249 70.576 1.00 0.00 O ATOM 83670 H1 WAT 8498 126.240 134.050 70.760 1.00 0.00 H ATOM 83671 H2 WAT 8498 127.293 133.949 69.677 1.00 0.00 H TER 83673 WAT 8498 ATOM 83673 O WAT 8499 17.654 115.147 138.718 1.00 0.00 O ATOM 83674 H1 WAT 8499 17.407 115.250 137.799 1.00 0.00 H ATOM 83675 H2 WAT 8499 16.830 114.962 139.169 1.00 0.00 H TER 83677 WAT 8499 ATOM 83677 O WAT 8500 115.272 135.339 4.787 1.00 0.00 O ATOM 83678 H1 WAT 8500 115.852 135.669 5.473 1.00 0.00 H ATOM 83679 H2 WAT 8500 114.803 134.613 5.198 1.00 0.00 H TER 83681 WAT 8500 ATOM 83681 O WAT 8501 26.724 99.288 21.401 1.00 0.00 O ATOM 83682 H1 WAT 8501 26.397 99.328 22.300 1.00 0.00 H ATOM 83683 H2 WAT 8501 27.639 99.562 21.467 1.00 0.00 H TER 83685 WAT 8501 ATOM 83685 O WAT 8502 116.670 5.191 130.780 1.00 0.00 O ATOM 83686 H1 WAT 8502 115.954 5.389 131.384 1.00 0.00 H ATOM 83687 H2 WAT 8502 117.464 5.340 131.292 1.00 0.00 H TER 83689 WAT 8502 ATOM 83689 O WAT 8503 65.528 31.443 116.951 1.00 0.00 O ATOM 83690 H1 WAT 8503 66.087 31.003 116.311 1.00 0.00 H ATOM 83691 H2 WAT 8503 65.934 31.251 117.796 1.00 0.00 H TER 83693 WAT 8503 ATOM 83693 O WAT 8504 109.763 101.208 12.975 1.00 0.00 O ATOM 83694 H1 WAT 8504 109.131 101.902 13.160 1.00 0.00 H ATOM 83695 H2 WAT 8504 109.828 100.718 13.795 1.00 0.00 H TER 83697 WAT 8504 ATOM 83697 O WAT 8505 33.056 58.260 13.158 1.00 0.00 O ATOM 83698 H1 WAT 8505 33.237 57.435 12.707 1.00 0.00 H ATOM 83699 H2 WAT 8505 32.549 58.005 13.928 1.00 0.00 H TER 83701 WAT 8505 ATOM 83701 O WAT 8506 131.940 96.287 6.517 1.00 0.00 O ATOM 83702 H1 WAT 8506 131.255 95.674 6.250 1.00 0.00 H ATOM 83703 H2 WAT 8506 131.576 97.151 6.326 1.00 0.00 H TER 83705 WAT 8506 ATOM 83705 O WAT 8507 130.912 109.461 25.262 1.00 0.00 O ATOM 83706 H1 WAT 8507 131.623 108.864 25.491 1.00 0.00 H ATOM 83707 H2 WAT 8507 130.863 110.070 25.998 1.00 0.00 H TER 83709 WAT 8507 ATOM 83709 O WAT 8508 102.307 19.424 102.582 1.00 0.00 O ATOM 83710 H1 WAT 8508 103.000 18.980 103.070 1.00 0.00 H ATOM 83711 H2 WAT 8508 101.903 18.733 102.057 1.00 0.00 H TER 83713 WAT 8508 ATOM 83713 O WAT 8509 109.471 26.062 67.200 1.00 0.00 O ATOM 83714 H1 WAT 8509 108.777 25.487 66.874 1.00 0.00 H ATOM 83715 H2 WAT 8509 109.998 25.502 67.769 1.00 0.00 H TER 83717 WAT 8509 ATOM 83717 O WAT 8510 122.418 111.784 99.254 1.00 0.00 O ATOM 83718 H1 WAT 8510 122.984 111.775 98.483 1.00 0.00 H ATOM 83719 H2 WAT 8510 122.959 112.168 99.944 1.00 0.00 H TER 83721 WAT 8510 ATOM 83721 O WAT 8511 136.068 78.755 7.771 1.00 0.00 O ATOM 83722 H1 WAT 8511 135.602 79.340 8.369 1.00 0.00 H ATOM 83723 H2 WAT 8511 136.783 79.289 7.423 1.00 0.00 H TER 83725 WAT 8511 ATOM 83725 O WAT 8512 139.222 87.503 131.078 1.00 0.00 O ATOM 83726 H1 WAT 8512 139.370 86.743 131.641 1.00 0.00 H ATOM 83727 H2 WAT 8512 138.437 87.917 131.436 1.00 0.00 H TER 83729 WAT 8512 ATOM 83729 O WAT 8513 78.015 0.660 53.993 1.00 0.00 O ATOM 83730 H1 WAT 8513 78.666 0.656 54.695 1.00 0.00 H ATOM 83731 H2 WAT 8513 78.227 -0.111 53.466 1.00 0.00 H TER 83733 WAT 8513 ATOM 83733 O WAT 8514 53.397 144.127 140.197 1.00 0.00 O ATOM 83734 H1 WAT 8514 52.652 144.029 140.790 1.00 0.00 H ATOM 83735 H2 WAT 8514 53.212 143.522 139.478 1.00 0.00 H TER 83737 WAT 8514 ATOM 83737 O WAT 8515 52.729 21.450 145.823 1.00 0.00 O ATOM 83738 H1 WAT 8515 53.337 20.723 145.686 1.00 0.00 H ATOM 83739 H2 WAT 8515 52.654 21.524 146.774 1.00 0.00 H TER 83741 WAT 8515 ATOM 83741 O WAT 8516 23.855 101.067 132.427 1.00 0.00 O ATOM 83742 H1 WAT 8516 23.671 101.392 131.546 1.00 0.00 H ATOM 83743 H2 WAT 8516 24.376 101.759 132.834 1.00 0.00 H TER 83745 WAT 8516 ATOM 83745 O WAT 8517 67.043 46.873 0.902 1.00 0.00 O ATOM 83746 H1 WAT 8517 67.534 47.334 1.582 1.00 0.00 H ATOM 83747 H2 WAT 8517 66.259 46.553 1.348 1.00 0.00 H TER 83749 WAT 8517 ATOM 83749 O WAT 8518 15.070 36.780 138.039 1.00 0.00 O ATOM 83750 H1 WAT 8518 14.655 37.288 138.737 1.00 0.00 H ATOM 83751 H2 WAT 8518 14.745 37.175 137.230 1.00 0.00 H TER 83753 WAT 8518 ATOM 83753 O WAT 8519 137.358 93.941 144.379 1.00 0.00 O ATOM 83754 H1 WAT 8519 137.409 94.209 143.462 1.00 0.00 H ATOM 83755 H2 WAT 8519 137.501 94.748 144.873 1.00 0.00 H TER 83757 WAT 8519 ATOM 83757 O WAT 8520 59.917 127.733 143.889 1.00 0.00 O ATOM 83758 H1 WAT 8520 59.433 128.391 144.388 1.00 0.00 H ATOM 83759 H2 WAT 8520 59.590 127.822 142.994 1.00 0.00 H TER 83761 WAT 8520 ATOM 83761 O WAT 8521 15.368 68.056 63.355 1.00 0.00 O ATOM 83762 H1 WAT 8521 15.328 68.913 63.781 1.00 0.00 H ATOM 83763 H2 WAT 8521 16.259 68.001 63.010 1.00 0.00 H TER 83765 WAT 8521 ATOM 83765 O WAT 8522 61.734 136.585 109.136 1.00 0.00 O ATOM 83766 H1 WAT 8522 61.567 137.211 108.431 1.00 0.00 H ATOM 83767 H2 WAT 8522 62.072 137.119 109.855 1.00 0.00 H TER 83769 WAT 8522 ATOM 83769 O WAT 8523 127.094 94.325 141.521 1.00 0.00 O ATOM 83770 H1 WAT 8523 126.561 94.310 140.726 1.00 0.00 H ATOM 83771 H2 WAT 8523 127.997 94.318 141.203 1.00 0.00 H TER 83773 WAT 8523 ATOM 83773 O WAT 8524 43.993 66.245 13.324 1.00 0.00 O ATOM 83774 H1 WAT 8524 44.855 66.417 12.945 1.00 0.00 H ATOM 83775 H2 WAT 8524 43.427 66.089 12.568 1.00 0.00 H TER 83777 WAT 8524 ATOM 83777 O WAT 8525 84.780 23.662 80.608 1.00 0.00 O ATOM 83778 H1 WAT 8525 84.398 23.078 79.954 1.00 0.00 H ATOM 83779 H2 WAT 8525 85.724 23.525 80.529 1.00 0.00 H TER 83781 WAT 8525 ATOM 83781 O WAT 8526 25.960 138.470 3.230 1.00 0.00 O ATOM 83782 H1 WAT 8526 25.368 137.785 3.539 1.00 0.00 H ATOM 83783 H2 WAT 8526 25.414 139.255 3.182 1.00 0.00 H TER 83785 WAT 8526 ATOM 83785 O WAT 8527 35.208 94.962 73.692 1.00 0.00 O ATOM 83786 H1 WAT 8527 35.429 95.270 74.571 1.00 0.00 H ATOM 83787 H2 WAT 8527 34.932 94.055 73.819 1.00 0.00 H TER 83789 WAT 8527 ATOM 83789 O WAT 8528 87.163 59.867 59.215 1.00 0.00 O ATOM 83790 H1 WAT 8528 86.492 60.544 59.127 1.00 0.00 H ATOM 83791 H2 WAT 8528 86.724 59.058 58.954 1.00 0.00 H TER 83793 WAT 8528 ATOM 83793 O WAT 8529 1.755 96.619 113.123 1.00 0.00 O ATOM 83794 H1 WAT 8529 2.172 97.219 113.741 1.00 0.00 H ATOM 83795 H2 WAT 8529 1.212 96.051 113.670 1.00 0.00 H TER 83797 WAT 8529 ATOM 83797 O WAT 8530 66.769 33.676 115.979 1.00 0.00 O ATOM 83798 H1 WAT 8530 66.207 33.049 116.434 1.00 0.00 H ATOM 83799 H2 WAT 8530 66.638 33.485 115.050 1.00 0.00 H TER 83801 WAT 8530 ATOM 83801 O WAT 8531 55.308 72.170 66.729 1.00 0.00 O ATOM 83802 H1 WAT 8531 54.390 71.988 66.929 1.00 0.00 H ATOM 83803 H2 WAT 8531 55.576 71.448 66.160 1.00 0.00 H TER 83805 WAT 8531 ATOM 83805 O WAT 8532 119.246 117.725 153.909 1.00 0.00 O ATOM 83806 H1 WAT 8532 119.262 117.474 152.985 1.00 0.00 H ATOM 83807 H2 WAT 8532 119.765 118.529 153.948 1.00 0.00 H TER 83809 WAT 8532 ATOM 83809 O WAT 8533 76.867 72.932 12.896 1.00 0.00 O ATOM 83810 H1 WAT 8533 76.534 73.738 12.503 1.00 0.00 H ATOM 83811 H2 WAT 8533 76.110 72.555 13.346 1.00 0.00 H TER 83813 WAT 8533 ATOM 83813 O WAT 8534 7.241 45.908 96.114 1.00 0.00 O ATOM 83814 H1 WAT 8534 7.133 45.251 96.801 1.00 0.00 H ATOM 83815 H2 WAT 8534 7.150 46.746 96.568 1.00 0.00 H TER 83817 WAT 8534 ATOM 83817 O WAT 8535 68.097 98.853 112.363 1.00 0.00 O ATOM 83818 H1 WAT 8535 67.595 98.506 113.101 1.00 0.00 H ATOM 83819 H2 WAT 8535 68.228 99.777 112.575 1.00 0.00 H TER 83821 WAT 8535 ATOM 83821 O WAT 8536 36.678 48.023 112.913 1.00 0.00 O ATOM 83822 H1 WAT 8536 37.143 47.529 112.237 1.00 0.00 H ATOM 83823 H2 WAT 8536 36.022 48.526 112.432 1.00 0.00 H TER 83825 WAT 8536 ATOM 83825 O WAT 8537 61.370 133.894 58.710 1.00 0.00 O ATOM 83826 H1 WAT 8537 61.886 133.474 59.398 1.00 0.00 H ATOM 83827 H2 WAT 8537 60.467 133.842 59.023 1.00 0.00 H TER 83829 WAT 8537 ATOM 83829 O WAT 8538 128.191 32.059 55.056 1.00 0.00 O ATOM 83830 H1 WAT 8538 127.997 31.499 55.808 1.00 0.00 H ATOM 83831 H2 WAT 8538 127.866 32.922 55.311 1.00 0.00 H TER 83833 WAT 8538 ATOM 83833 O WAT 8539 135.279 29.273 10.334 1.00 0.00 O ATOM 83834 H1 WAT 8539 134.838 29.265 9.484 1.00 0.00 H ATOM 83835 H2 WAT 8539 135.589 28.375 10.451 1.00 0.00 H TER 83837 WAT 8539 ATOM 83837 O WAT 8540 133.798 135.743 66.902 1.00 0.00 O ATOM 83838 H1 WAT 8540 132.925 135.618 67.272 1.00 0.00 H ATOM 83839 H2 WAT 8540 134.076 134.865 66.641 1.00 0.00 H TER 83841 WAT 8540 ATOM 83841 O WAT 8541 61.897 33.184 74.048 1.00 0.00 O ATOM 83842 H1 WAT 8541 61.627 32.979 73.153 1.00 0.00 H ATOM 83843 H2 WAT 8541 62.672 32.643 74.195 1.00 0.00 H TER 83845 WAT 8541 ATOM 83845 O WAT 8542 145.229 119.824 88.550 1.00 0.00 O ATOM 83846 H1 WAT 8542 145.609 119.027 88.181 1.00 0.00 H ATOM 83847 H2 WAT 8542 144.628 120.138 87.874 1.00 0.00 H TER 83849 WAT 8542 ATOM 83849 O WAT 8543 98.030 50.668 131.071 1.00 0.00 O ATOM 83850 H1 WAT 8543 98.500 49.927 130.690 1.00 0.00 H ATOM 83851 H2 WAT 8543 97.694 51.152 130.316 1.00 0.00 H TER 83853 WAT 8543 ATOM 83853 O WAT 8544 44.957 61.390 123.288 1.00 0.00 O ATOM 83854 H1 WAT 8544 45.261 61.359 124.195 1.00 0.00 H ATOM 83855 H2 WAT 8544 45.655 60.970 122.786 1.00 0.00 H TER 83857 WAT 8544 ATOM 83857 O WAT 8545 66.545 19.766 98.554 1.00 0.00 O ATOM 83858 H1 WAT 8545 66.787 19.238 97.792 1.00 0.00 H ATOM 83859 H2 WAT 8545 67.185 19.527 99.224 1.00 0.00 H TER 83861 WAT 8545 ATOM 83861 O WAT 8546 121.827 53.180 90.775 1.00 0.00 O ATOM 83862 H1 WAT 8546 121.465 53.384 91.638 1.00 0.00 H ATOM 83863 H2 WAT 8546 121.462 53.850 90.198 1.00 0.00 H TER 83865 WAT 8546 ATOM 83865 O WAT 8547 24.470 24.173 83.556 1.00 0.00 O ATOM 83866 H1 WAT 8547 25.270 24.447 84.004 1.00 0.00 H ATOM 83867 H2 WAT 8547 24.440 24.716 82.768 1.00 0.00 H TER 83869 WAT 8547 ATOM 83869 O WAT 8548 87.374 74.235 143.144 1.00 0.00 O ATOM 83870 H1 WAT 8548 86.592 73.897 143.580 1.00 0.00 H ATOM 83871 H2 WAT 8548 87.059 74.976 142.627 1.00 0.00 H TER 83873 WAT 8548 ATOM 83873 O WAT 8549 139.888 126.517 123.676 1.00 0.00 O ATOM 83874 H1 WAT 8549 139.433 127.143 124.239 1.00 0.00 H ATOM 83875 H2 WAT 8549 139.634 126.766 122.788 1.00 0.00 H TER 83877 WAT 8549 ATOM 83877 O WAT 8550 11.025 135.916 14.842 1.00 0.00 O ATOM 83878 H1 WAT 8550 10.140 135.876 15.205 1.00 0.00 H ATOM 83879 H2 WAT 8550 10.905 136.243 13.951 1.00 0.00 H TER 83881 WAT 8550 ATOM 83881 O WAT 8551 82.352 95.828 11.416 1.00 0.00 O ATOM 83882 H1 WAT 8551 81.800 95.437 12.094 1.00 0.00 H ATOM 83883 H2 WAT 8551 82.304 96.769 11.581 1.00 0.00 H TER 83885 WAT 8551 ATOM 83885 O WAT 8552 116.876 25.029 53.576 1.00 0.00 O ATOM 83886 H1 WAT 8552 116.397 25.815 53.840 1.00 0.00 H ATOM 83887 H2 WAT 8552 117.673 25.046 54.105 1.00 0.00 H TER 83889 WAT 8552 ATOM 83889 O WAT 8553 15.769 36.451 151.946 1.00 0.00 O ATOM 83890 H1 WAT 8553 16.003 37.067 152.640 1.00 0.00 H ATOM 83891 H2 WAT 8553 15.140 36.927 151.404 1.00 0.00 H TER 83893 WAT 8553 ATOM 83893 O WAT 8554 114.251 136.513 114.649 1.00 0.00 O ATOM 83894 H1 WAT 8554 113.689 136.229 113.928 1.00 0.00 H ATOM 83895 H2 WAT 8554 115.019 135.945 114.592 1.00 0.00 H TER 83897 WAT 8554 ATOM 83897 O WAT 8555 109.019 57.459 141.247 1.00 0.00 O ATOM 83898 H1 WAT 8555 109.910 57.189 141.470 1.00 0.00 H ATOM 83899 H2 WAT 8555 109.135 58.201 140.653 1.00 0.00 H TER 83901 WAT 8555 ATOM 83901 O WAT 8556 74.882 40.864 147.718 1.00 0.00 O ATOM 83902 H1 WAT 8556 74.175 40.793 148.359 1.00 0.00 H ATOM 83903 H2 WAT 8556 74.439 41.057 146.892 1.00 0.00 H TER 83905 WAT 8556 ATOM 83905 O WAT 8557 6.000 10.304 108.830 1.00 0.00 O ATOM 83906 H1 WAT 8557 5.192 10.600 108.412 1.00 0.00 H ATOM 83907 H2 WAT 8557 6.084 9.387 108.567 1.00 0.00 H TER 83909 WAT 8557 ATOM 83909 O WAT 8558 15.700 3.559 150.296 1.00 0.00 O ATOM 83910 H1 WAT 8558 16.393 3.382 150.931 1.00 0.00 H ATOM 83911 H2 WAT 8558 15.069 2.850 150.425 1.00 0.00 H TER 83913 WAT 8558 ATOM 83913 O WAT 8559 68.433 28.206 4.398 1.00 0.00 O ATOM 83914 H1 WAT 8559 67.637 28.412 3.909 1.00 0.00 H ATOM 83915 H2 WAT 8559 68.130 27.684 5.141 1.00 0.00 H TER 83917 WAT 8559 ATOM 83917 O WAT 8560 38.363 23.598 106.191 1.00 0.00 O ATOM 83918 H1 WAT 8560 38.555 23.674 107.125 1.00 0.00 H ATOM 83919 H2 WAT 8560 39.061 23.041 105.847 1.00 0.00 H TER 83921 WAT 8560 ATOM 83921 O WAT 8561 45.031 26.882 80.936 1.00 0.00 O ATOM 83922 H1 WAT 8561 44.580 27.133 81.743 1.00 0.00 H ATOM 83923 H2 WAT 8561 45.854 27.369 80.960 1.00 0.00 H TER 83925 WAT 8561 ATOM 83925 O WAT 8562 22.443 20.985 129.446 1.00 0.00 O ATOM 83926 H1 WAT 8562 22.427 21.772 128.901 1.00 0.00 H ATOM 83927 H2 WAT 8562 22.227 20.273 128.845 1.00 0.00 H TER 83929 WAT 8562 ATOM 83929 O WAT 8563 143.514 90.191 93.336 1.00 0.00 O ATOM 83930 H1 WAT 8563 143.073 89.654 93.994 1.00 0.00 H ATOM 83931 H2 WAT 8563 143.813 89.566 92.677 1.00 0.00 H TER 83933 WAT 8563 ATOM 83933 O WAT 8564 132.492 12.204 109.234 1.00 0.00 O ATOM 83934 H1 WAT 8564 132.400 11.266 109.402 1.00 0.00 H ATOM 83935 H2 WAT 8564 131.885 12.618 109.848 1.00 0.00 H TER 83937 WAT 8564 ATOM 83937 O WAT 8565 1.587 55.382 140.683 1.00 0.00 O ATOM 83938 H1 WAT 8565 1.383 56.299 140.870 1.00 0.00 H ATOM 83939 H2 WAT 8565 2.099 55.092 141.439 1.00 0.00 H TER 83941 WAT 8565 ATOM 83941 O WAT 8566 74.854 123.693 58.287 1.00 0.00 O ATOM 83942 H1 WAT 8566 74.391 123.428 57.493 1.00 0.00 H ATOM 83943 H2 WAT 8566 75.770 123.474 58.115 1.00 0.00 H TER 83945 WAT 8566 ATOM 83945 O WAT 8567 15.890 113.578 17.256 1.00 0.00 O ATOM 83946 H1 WAT 8567 16.076 113.276 18.145 1.00 0.00 H ATOM 83947 H2 WAT 8567 14.962 113.812 17.272 1.00 0.00 H TER 83949 WAT 8567 ATOM 83949 O WAT 8568 37.567 58.402 13.566 1.00 0.00 O ATOM 83950 H1 WAT 8568 37.724 58.535 14.501 1.00 0.00 H ATOM 83951 H2 WAT 8568 36.801 58.941 13.372 1.00 0.00 H TER 83953 WAT 8568 ATOM 83953 O WAT 8569 113.845 124.493 152.238 1.00 0.00 O ATOM 83954 H1 WAT 8569 113.766 125.046 151.461 1.00 0.00 H ATOM 83955 H2 WAT 8569 113.531 123.634 151.955 1.00 0.00 H TER 83957 WAT 8569 ATOM 83957 O WAT 8570 90.985 85.848 76.842 1.00 0.00 O ATOM 83958 H1 WAT 8570 90.924 86.699 77.276 1.00 0.00 H ATOM 83959 H2 WAT 8570 90.184 85.391 77.098 1.00 0.00 H TER 83961 WAT 8570 ATOM 83961 O WAT 8571 105.315 44.469 156.370 1.00 0.00 O ATOM 83962 H1 WAT 8571 104.738 45.177 156.657 1.00 0.00 H ATOM 83963 H2 WAT 8571 104.939 43.681 156.763 1.00 0.00 H TER 83965 WAT 8571 ATOM 83965 O WAT 8572 4.894 4.540 145.222 1.00 0.00 O ATOM 83966 H1 WAT 8572 4.544 3.654 145.127 1.00 0.00 H ATOM 83967 H2 WAT 8572 5.262 4.745 144.363 1.00 0.00 H TER 83969 WAT 8572 ATOM 83969 O WAT 8573 94.679 8.781 57.883 1.00 0.00 O ATOM 83970 H1 WAT 8573 94.086 8.277 57.324 1.00 0.00 H ATOM 83971 H2 WAT 8573 95.505 8.800 57.399 1.00 0.00 H TER 83973 WAT 8573 ATOM 83973 O WAT 8574 63.611 50.137 149.331 1.00 0.00 O ATOM 83974 H1 WAT 8574 62.904 50.173 148.687 1.00 0.00 H ATOM 83975 H2 WAT 8574 64.304 50.680 148.958 1.00 0.00 H TER 83977 WAT 8574 ATOM 83977 O WAT 8575 69.950 109.631 120.536 1.00 0.00 O ATOM 83978 H1 WAT 8575 70.337 110.313 121.086 1.00 0.00 H ATOM 83979 H2 WAT 8575 69.006 109.777 120.603 1.00 0.00 H TER 83981 WAT 8575 ATOM 83981 O WAT 8576 144.085 77.919 7.413 1.00 0.00 O ATOM 83982 H1 WAT 8576 144.503 77.144 7.786 1.00 0.00 H ATOM 83983 H2 WAT 8576 143.469 77.571 6.768 1.00 0.00 H TER 83985 WAT 8576 ATOM 83985 O WAT 8577 107.487 45.635 122.318 1.00 0.00 O ATOM 83986 H1 WAT 8577 108.132 45.133 121.819 1.00 0.00 H ATOM 83987 H2 WAT 8577 107.041 44.983 122.858 1.00 0.00 H TER 83989 WAT 8577 ATOM 83989 O WAT 8578 47.939 77.895 157.919 1.00 0.00 O ATOM 83990 H1 WAT 8578 48.457 78.650 157.640 1.00 0.00 H ATOM 83991 H2 WAT 8578 48.582 77.281 158.273 1.00 0.00 H TER 83993 WAT 8578 ATOM 83993 O WAT 8579 61.181 67.914 148.399 1.00 0.00 O ATOM 83994 H1 WAT 8579 61.706 68.618 148.018 1.00 0.00 H ATOM 83995 H2 WAT 8579 60.354 68.335 148.635 1.00 0.00 H TER 83997 WAT 8579 ATOM 83997 O WAT 8580 137.219 112.479 113.815 1.00 0.00 O ATOM 83998 H1 WAT 8580 137.219 112.683 114.750 1.00 0.00 H ATOM 83999 H2 WAT 8580 136.292 112.413 113.585 1.00 0.00 H TER 84001 WAT 8580 ATOM 84001 O WAT 8581 63.257 70.843 62.416 1.00 0.00 O ATOM 84002 H1 WAT 8581 63.185 71.533 61.757 1.00 0.00 H ATOM 84003 H2 WAT 8581 63.927 71.159 63.022 1.00 0.00 H TER 84005 WAT 8581 ATOM 84005 O WAT 8582 66.173 22.435 57.418 1.00 0.00 O ATOM 84006 H1 WAT 8582 66.601 21.579 57.389 1.00 0.00 H ATOM 84007 H2 WAT 8582 65.950 22.622 56.506 1.00 0.00 H TER 84009 WAT 8582 ATOM 84009 O WAT 8583 112.580 9.006 54.000 1.00 0.00 O ATOM 84010 H1 WAT 8583 113.343 8.577 53.613 1.00 0.00 H ATOM 84011 H2 WAT 8583 111.994 9.167 53.261 1.00 0.00 H TER 84013 WAT 8583 ATOM 84013 O WAT 8584 58.596 145.366 156.634 1.00 0.00 O ATOM 84014 H1 WAT 8584 59.047 144.668 156.158 1.00 0.00 H ATOM 84015 H2 WAT 8584 58.957 145.325 157.519 1.00 0.00 H TER 84017 WAT 8584 ATOM 84017 O WAT 8585 95.134 103.793 -0.154 1.00 0.00 O ATOM 84018 H1 WAT 8585 95.875 104.391 -0.250 1.00 0.00 H ATOM 84019 H2 WAT 8585 94.769 104.000 0.706 1.00 0.00 H TER 84021 WAT 8585 ATOM 84021 O WAT 8586 76.993 80.465 81.785 1.00 0.00 O ATOM 84022 H1 WAT 8586 77.447 79.696 82.128 1.00 0.00 H ATOM 84023 H2 WAT 8586 76.942 81.066 82.528 1.00 0.00 H TER 84025 WAT 8586 ATOM 84025 O WAT 8587 114.450 112.516 74.412 1.00 0.00 O ATOM 84026 H1 WAT 8587 114.690 112.922 75.244 1.00 0.00 H ATOM 84027 H2 WAT 8587 114.444 113.239 73.785 1.00 0.00 H TER 84029 WAT 8587 ATOM 84029 O WAT 8588 116.011 63.630 95.714 1.00 0.00 O ATOM 84030 H1 WAT 8588 115.788 64.219 94.993 1.00 0.00 H ATOM 84031 H2 WAT 8588 116.968 63.602 95.713 1.00 0.00 H TER 84033 WAT 8588 ATOM 84033 O WAT 8589 134.999 143.163 68.554 1.00 0.00 O ATOM 84034 H1 WAT 8589 134.518 142.544 69.103 1.00 0.00 H ATOM 84035 H2 WAT 8589 135.437 142.614 67.903 1.00 0.00 H TER 84037 WAT 8589 ATOM 84037 O WAT 8590 60.155 91.709 157.633 1.00 0.00 O ATOM 84038 H1 WAT 8590 59.377 91.327 157.227 1.00 0.00 H ATOM 84039 H2 WAT 8590 60.649 92.079 156.902 1.00 0.00 H TER 84041 WAT 8590 ATOM 84041 O WAT 8591 145.382 0.961 94.741 1.00 0.00 O ATOM 84042 H1 WAT 8591 145.921 0.304 94.300 1.00 0.00 H ATOM 84043 H2 WAT 8591 145.834 1.789 94.581 1.00 0.00 H TER 84045 WAT 8591 ATOM 84045 O WAT 8592 142.784 12.090 81.314 1.00 0.00 O ATOM 84046 H1 WAT 8592 143.581 12.578 81.106 1.00 0.00 H ATOM 84047 H2 WAT 8592 142.131 12.424 80.698 1.00 0.00 H TER 84049 WAT 8592 ATOM 84049 O WAT 8593 67.670 100.269 154.486 1.00 0.00 O ATOM 84050 H1 WAT 8593 66.973 100.728 154.015 1.00 0.00 H ATOM 84051 H2 WAT 8593 67.208 99.691 155.093 1.00 0.00 H TER 84053 WAT 8593 ATOM 84053 O WAT 8594 20.950 117.559 87.209 1.00 0.00 O ATOM 84054 H1 WAT 8594 20.209 116.976 87.047 1.00 0.00 H ATOM 84055 H2 WAT 8594 20.894 117.764 88.142 1.00 0.00 H TER 84057 WAT 8594 ATOM 84057 O WAT 8595 81.992 16.237 123.612 1.00 0.00 O ATOM 84058 H1 WAT 8595 81.416 15.945 122.906 1.00 0.00 H ATOM 84059 H2 WAT 8595 81.699 15.745 124.379 1.00 0.00 H TER 84061 WAT 8595 ATOM 84061 O WAT 8596 34.474 36.948 77.073 1.00 0.00 O ATOM 84062 H1 WAT 8596 34.107 37.451 77.800 1.00 0.00 H ATOM 84063 H2 WAT 8596 34.028 37.288 76.298 1.00 0.00 H TER 84065 WAT 8596 ATOM 84065 O WAT 8597 65.236 97.627 147.866 1.00 0.00 O ATOM 84066 H1 WAT 8597 65.341 98.524 147.547 1.00 0.00 H ATOM 84067 H2 WAT 8597 66.000 97.481 148.425 1.00 0.00 H TER 84069 WAT 8597 ATOM 84069 O WAT 8598 70.050 62.152 19.726 1.00 0.00 O ATOM 84070 H1 WAT 8598 69.772 62.608 18.931 1.00 0.00 H ATOM 84071 H2 WAT 8598 69.233 61.944 20.180 1.00 0.00 H TER 84073 WAT 8598 ATOM 84073 O WAT 8599 103.811 113.713 146.194 1.00 0.00 O ATOM 84074 H1 WAT 8599 103.945 113.755 147.141 1.00 0.00 H ATOM 84075 H2 WAT 8599 103.588 114.610 145.944 1.00 0.00 H TER 84077 WAT 8599 ATOM 84077 O WAT 8600 131.806 14.927 56.988 1.00 0.00 O ATOM 84078 H1 WAT 8600 130.874 14.832 56.791 1.00 0.00 H ATOM 84079 H2 WAT 8600 132.250 14.619 56.198 1.00 0.00 H TER 84081 WAT 8600 ATOM 84081 O WAT 8601 17.732 48.137 3.510 1.00 0.00 O ATOM 84082 H1 WAT 8601 18.450 48.709 3.237 1.00 0.00 H ATOM 84083 H2 WAT 8601 17.355 47.819 2.690 1.00 0.00 H TER 84085 WAT 8601 ATOM 84085 O WAT 8602 62.322 7.751 96.108 1.00 0.00 O ATOM 84086 H1 WAT 8602 62.591 8.669 96.062 1.00 0.00 H ATOM 84087 H2 WAT 8602 62.954 7.289 95.558 1.00 0.00 H TER 84089 WAT 8602 ATOM 84089 O WAT 8603 99.328 132.313 115.587 1.00 0.00 O ATOM 84090 H1 WAT 8603 98.613 132.149 116.202 1.00 0.00 H ATOM 84091 H2 WAT 8603 99.545 131.449 115.237 1.00 0.00 H TER 84093 WAT 8603 ATOM 84093 O WAT 8604 102.242 54.826 18.449 1.00 0.00 O ATOM 84094 H1 WAT 8604 102.558 53.932 18.322 1.00 0.00 H ATOM 84095 H2 WAT 8604 101.387 54.722 18.866 1.00 0.00 H TER 84097 WAT 8604 ATOM 84097 O WAT 8605 112.864 122.764 72.953 1.00 0.00 O ATOM 84098 H1 WAT 8605 112.224 123.452 72.769 1.00 0.00 H ATOM 84099 H2 WAT 8605 113.211 122.523 72.094 1.00 0.00 H TER 84101 WAT 8605 ATOM 84101 O WAT 8606 49.412 104.753 71.090 1.00 0.00 O ATOM 84102 H1 WAT 8606 49.153 105.578 70.679 1.00 0.00 H ATOM 84103 H2 WAT 8606 50.307 104.907 71.392 1.00 0.00 H TER 84105 WAT 8606 ATOM 84105 O WAT 8607 3.425 129.282 102.126 1.00 0.00 O ATOM 84106 H1 WAT 8607 2.653 129.774 101.847 1.00 0.00 H ATOM 84107 H2 WAT 8607 3.911 129.892 102.680 1.00 0.00 H TER 84109 WAT 8607 ATOM 84109 O WAT 8608 48.181 142.221 89.537 1.00 0.00 O ATOM 84110 H1 WAT 8608 48.587 141.827 90.309 1.00 0.00 H ATOM 84111 H2 WAT 8608 48.804 142.891 89.255 1.00 0.00 H TER 84113 WAT 8608 ATOM 84113 O WAT 8609 11.125 3.143 116.889 1.00 0.00 O ATOM 84114 H1 WAT 8609 12.055 2.932 116.806 1.00 0.00 H ATOM 84115 H2 WAT 8609 10.819 2.598 117.613 1.00 0.00 H TER 84117 WAT 8609 ATOM 84117 O WAT 8610 51.805 16.910 10.096 1.00 0.00 O ATOM 84118 H1 WAT 8610 52.006 16.064 10.496 1.00 0.00 H ATOM 84119 H2 WAT 8610 52.156 17.555 10.710 1.00 0.00 H TER 84121 WAT 8610 ATOM 84121 O WAT 8611 80.387 102.001 93.465 1.00 0.00 O ATOM 84122 H1 WAT 8611 79.442 102.110 93.351 1.00 0.00 H ATOM 84123 H2 WAT 8611 80.743 102.062 92.578 1.00 0.00 H TER 84125 WAT 8611 ATOM 84125 O WAT 8612 139.343 39.947 131.163 1.00 0.00 O ATOM 84126 H1 WAT 8612 138.986 39.075 131.331 1.00 0.00 H ATOM 84127 H2 WAT 8612 138.888 40.244 130.375 1.00 0.00 H TER 84129 WAT 8612 ATOM 84129 O WAT 8613 122.739 93.733 146.370 1.00 0.00 O ATOM 84130 H1 WAT 8613 123.306 94.084 147.056 1.00 0.00 H ATOM 84131 H2 WAT 8613 121.917 94.213 146.468 1.00 0.00 H TER 84133 WAT 8613 ATOM 84133 O WAT 8614 27.676 35.238 11.261 1.00 0.00 O ATOM 84134 H1 WAT 8614 27.031 34.594 11.550 1.00 0.00 H ATOM 84135 H2 WAT 8614 27.786 35.822 12.011 1.00 0.00 H TER 84137 WAT 8614 ATOM 84137 O WAT 8615 106.564 4.774 55.173 1.00 0.00 O ATOM 84138 H1 WAT 8615 107.161 5.278 55.726 1.00 0.00 H ATOM 84139 H2 WAT 8615 105.704 5.160 55.336 1.00 0.00 H TER 84141 WAT 8615 ATOM 84141 O WAT 8616 139.518 57.756 122.300 1.00 0.00 O ATOM 84142 H1 WAT 8616 139.625 57.686 121.351 1.00 0.00 H ATOM 84143 H2 WAT 8616 139.142 56.915 122.561 1.00 0.00 H TER 84145 WAT 8616 ATOM 84145 O WAT 8617 118.669 4.953 82.669 1.00 0.00 O ATOM 84146 H1 WAT 8617 117.927 5.559 82.673 1.00 0.00 H ATOM 84147 H2 WAT 8617 118.426 4.282 82.031 1.00 0.00 H TER 84149 WAT 8617 ATOM 84149 O WAT 8618 48.692 120.774 103.686 1.00 0.00 O ATOM 84150 H1 WAT 8618 48.960 121.235 102.891 1.00 0.00 H ATOM 84151 H2 WAT 8618 49.056 121.297 104.401 1.00 0.00 H TER 84153 WAT 8618 ATOM 84153 O WAT 8619 75.424 101.196 97.617 1.00 0.00 O ATOM 84154 H1 WAT 8619 75.129 101.735 96.883 1.00 0.00 H ATOM 84155 H2 WAT 8619 75.920 101.797 98.172 1.00 0.00 H TER 84157 WAT 8619 ATOM 84157 O WAT 8620 125.779 123.853 133.155 1.00 0.00 O ATOM 84158 H1 WAT 8620 126.678 123.584 132.965 1.00 0.00 H ATOM 84159 H2 WAT 8620 125.422 123.139 133.683 1.00 0.00 H TER 84161 WAT 8620 ATOM 84161 O WAT 8621 108.112 74.910 87.603 1.00 0.00 O ATOM 84162 H1 WAT 8621 107.210 74.665 87.808 1.00 0.00 H ATOM 84163 H2 WAT 8621 108.055 75.828 87.334 1.00 0.00 H TER 84165 WAT 8621 ATOM 84165 O WAT 8622 89.143 27.196 104.186 1.00 0.00 O ATOM 84166 H1 WAT 8622 89.812 27.604 103.636 1.00 0.00 H ATOM 84167 H2 WAT 8622 89.567 27.085 105.036 1.00 0.00 H TER 84169 WAT 8622 ATOM 84169 O WAT 8623 111.929 22.368 83.164 1.00 0.00 O ATOM 84170 H1 WAT 8623 111.906 21.411 83.191 1.00 0.00 H ATOM 84171 H2 WAT 8623 112.861 22.585 83.154 1.00 0.00 H TER 84173 WAT 8623 ATOM 84173 O WAT 8624 0.795 93.688 125.365 1.00 0.00 O ATOM 84174 H1 WAT 8624 1.345 93.648 124.583 1.00 0.00 H ATOM 84175 H2 WAT 8624 1.033 94.515 125.784 1.00 0.00 H TER 84177 WAT 8624 ATOM 84177 O WAT 8625 107.314 48.078 157.081 1.00 0.00 O ATOM 84178 H1 WAT 8625 107.037 47.559 157.837 1.00 0.00 H ATOM 84179 H2 WAT 8625 108.189 48.390 157.313 1.00 0.00 H TER 84181 WAT 8625 ATOM 84181 O WAT 8626 65.620 42.765 97.518 1.00 0.00 O ATOM 84182 H1 WAT 8626 66.078 42.117 98.053 1.00 0.00 H ATOM 84183 H2 WAT 8626 66.319 43.269 97.101 1.00 0.00 H TER 84185 WAT 8626 ATOM 84185 O WAT 8627 78.337 128.396 131.599 1.00 0.00 O ATOM 84186 H1 WAT 8627 77.751 128.599 132.328 1.00 0.00 H ATOM 84187 H2 WAT 8627 78.058 127.529 131.302 1.00 0.00 H TER 84189 WAT 8627 ATOM 84189 O WAT 8628 114.489 104.146 119.151 1.00 0.00 O ATOM 84190 H1 WAT 8628 114.120 104.816 119.728 1.00 0.00 H ATOM 84191 H2 WAT 8628 114.090 104.319 118.298 1.00 0.00 H TER 84193 WAT 8628 ATOM 84193 O WAT 8629 36.085 118.736 118.644 1.00 0.00 O ATOM 84194 H1 WAT 8629 36.799 119.197 118.204 1.00 0.00 H ATOM 84195 H2 WAT 8629 35.392 119.391 118.726 1.00 0.00 H TER 84197 WAT 8629 ATOM 84197 O WAT 8630 57.226 67.227 137.098 1.00 0.00 O ATOM 84198 H1 WAT 8630 57.345 66.307 137.333 1.00 0.00 H ATOM 84199 H2 WAT 8630 57.971 67.428 136.532 1.00 0.00 H TER 84201 WAT 8630 ATOM 84201 O WAT 8631 91.743 124.870 144.878 1.00 0.00 O ATOM 84202 H1 WAT 8631 92.085 123.986 145.010 1.00 0.00 H ATOM 84203 H2 WAT 8631 92.504 125.384 144.609 1.00 0.00 H TER 84205 WAT 8631 ATOM 84205 O WAT 8632 72.641 75.669 89.719 1.00 0.00 O ATOM 84206 H1 WAT 8632 71.698 75.772 89.844 1.00 0.00 H ATOM 84207 H2 WAT 8632 72.823 74.770 89.990 1.00 0.00 H TER 84209 WAT 8632 ATOM 84209 O WAT 8633 36.829 102.337 152.626 1.00 0.00 O ATOM 84210 H1 WAT 8633 35.915 102.598 152.515 1.00 0.00 H ATOM 84211 H2 WAT 8633 37.138 102.161 151.737 1.00 0.00 H TER 84213 WAT 8633 ATOM 84213 O WAT 8634 131.307 105.093 143.583 1.00 0.00 O ATOM 84214 H1 WAT 8634 132.203 105.145 143.250 1.00 0.00 H ATOM 84215 H2 WAT 8634 131.076 105.998 143.790 1.00 0.00 H TER 84217 WAT 8634 ATOM 84217 O WAT 8635 105.038 44.751 86.242 1.00 0.00 O ATOM 84218 H1 WAT 8635 104.820 45.679 86.149 1.00 0.00 H ATOM 84219 H2 WAT 8635 104.305 44.291 85.833 1.00 0.00 H TER 84221 WAT 8635 ATOM 84221 O WAT 8636 138.695 35.115 70.505 1.00 0.00 O ATOM 84222 H1 WAT 8636 138.303 34.820 69.683 1.00 0.00 H ATOM 84223 H2 WAT 8636 138.392 34.482 71.156 1.00 0.00 H TER 84225 WAT 8636 ATOM 84225 O WAT 8637 3.134 64.118 10.647 1.00 0.00 O ATOM 84226 H1 WAT 8637 2.979 65.055 10.524 1.00 0.00 H ATOM 84227 H2 WAT 8637 2.297 63.776 10.961 1.00 0.00 H TER 84229 WAT 8637 ATOM 84229 O WAT 8638 1.565 91.435 9.051 1.00 0.00 O ATOM 84230 H1 WAT 8638 2.079 91.491 9.856 1.00 0.00 H ATOM 84231 H2 WAT 8638 1.478 90.496 8.887 1.00 0.00 H TER 84233 WAT 8638 ATOM 84233 O WAT 8639 123.955 35.645 98.753 1.00 0.00 O ATOM 84234 H1 WAT 8639 123.967 35.972 97.853 1.00 0.00 H ATOM 84235 H2 WAT 8639 124.810 35.233 98.871 1.00 0.00 H TER 84237 WAT 8639 ATOM 84237 O WAT 8640 131.301 19.455 9.237 1.00 0.00 O ATOM 84238 H1 WAT 8640 130.940 19.725 10.081 1.00 0.00 H ATOM 84239 H2 WAT 8640 130.620 18.905 8.850 1.00 0.00 H TER 84241 WAT 8640 ATOM 84241 O WAT 8641 59.244 71.816 150.372 1.00 0.00 O ATOM 84242 H1 WAT 8641 59.807 72.377 150.904 1.00 0.00 H ATOM 84243 H2 WAT 8641 58.605 72.415 149.985 1.00 0.00 H TER 84245 WAT 8641 ATOM 84245 O WAT 8642 103.225 52.261 91.515 1.00 0.00 O ATOM 84246 H1 WAT 8642 102.464 51.802 91.159 1.00 0.00 H ATOM 84247 H2 WAT 8642 103.976 51.751 91.211 1.00 0.00 H TER 84249 WAT 8642 ATOM 84249 O WAT 8643 127.107 145.732 2.212 1.00 0.00 O ATOM 84250 H1 WAT 8643 126.962 144.837 1.906 1.00 0.00 H ATOM 84251 H2 WAT 8643 127.970 145.965 1.870 1.00 0.00 H TER 84253 WAT 8643 ATOM 84253 O WAT 8644 129.455 134.145 72.215 1.00 0.00 O ATOM 84254 H1 WAT 8644 130.176 133.657 71.816 1.00 0.00 H ATOM 84255 H2 WAT 8644 128.779 134.169 71.538 1.00 0.00 H TER 84257 WAT 8644 ATOM 84257 O WAT 8645 17.048 30.879 127.177 1.00 0.00 O ATOM 84258 H1 WAT 8645 16.143 31.124 126.987 1.00 0.00 H ATOM 84259 H2 WAT 8645 17.061 29.925 127.094 1.00 0.00 H TER 84261 WAT 8645 ATOM 84261 O WAT 8646 53.493 12.022 20.149 1.00 0.00 O ATOM 84262 H1 WAT 8646 53.172 12.071 19.249 1.00 0.00 H ATOM 84263 H2 WAT 8646 54.050 11.243 20.163 1.00 0.00 H TER 84265 WAT 8646 ATOM 84265 O WAT 8647 123.301 62.464 17.903 1.00 0.00 O ATOM 84266 H1 WAT 8647 122.936 63.222 17.445 1.00 0.00 H ATOM 84267 H2 WAT 8647 122.541 62.027 18.287 1.00 0.00 H TER 84269 WAT 8647 ATOM 84269 O WAT 8648 20.796 65.021 149.276 1.00 0.00 O ATOM 84270 H1 WAT 8648 20.434 64.204 149.618 1.00 0.00 H ATOM 84271 H2 WAT 8648 21.680 65.063 149.642 1.00 0.00 H TER 84273 WAT 8648 ATOM 84273 O WAT 8649 50.329 115.052 155.271 1.00 0.00 O ATOM 84274 H1 WAT 8649 50.974 114.893 154.582 1.00 0.00 H ATOM 84275 H2 WAT 8649 49.824 114.241 155.318 1.00 0.00 H TER 84277 WAT 8649 ATOM 84277 O WAT 8650 124.617 78.760 92.934 1.00 0.00 O ATOM 84278 H1 WAT 8650 123.716 78.559 92.680 1.00 0.00 H ATOM 84279 H2 WAT 8650 125.155 78.321 92.275 1.00 0.00 H TER 84281 WAT 8650 ATOM 84281 O WAT 8651 33.821 55.621 65.996 1.00 0.00 O ATOM 84282 H1 WAT 8651 33.207 54.887 66.037 1.00 0.00 H ATOM 84283 H2 WAT 8651 34.262 55.611 66.845 1.00 0.00 H TER 84285 WAT 8651 ATOM 84285 O WAT 8652 32.128 136.855 6.515 1.00 0.00 O ATOM 84286 H1 WAT 8652 32.824 137.494 6.363 1.00 0.00 H ATOM 84287 H2 WAT 8652 31.730 137.126 7.341 1.00 0.00 H TER 84289 WAT 8652 ATOM 84289 O WAT 8653 91.994 68.540 10.307 1.00 0.00 O ATOM 84290 H1 WAT 8653 91.940 69.494 10.251 1.00 0.00 H ATOM 84291 H2 WAT 8653 92.260 68.264 9.430 1.00 0.00 H TER 84293 WAT 8653 ATOM 84293 O WAT 8654 94.317 108.121 115.145 1.00 0.00 O ATOM 84294 H1 WAT 8654 94.401 108.437 116.045 1.00 0.00 H ATOM 84295 H2 WAT 8654 94.966 108.624 114.653 1.00 0.00 H TER 84297 WAT 8654 ATOM 84297 O WAT 8655 0.358 125.552 148.481 1.00 0.00 O ATOM 84298 H1 WAT 8655 1.061 125.515 147.833 1.00 0.00 H ATOM 84299 H2 WAT 8655 -0.158 124.762 148.321 1.00 0.00 H TER 84301 WAT 8655 ATOM 84301 O WAT 8656 18.658 2.541 117.023 1.00 0.00 O ATOM 84302 H1 WAT 8656 18.254 2.142 116.252 1.00 0.00 H ATOM 84303 H2 WAT 8656 18.128 2.233 117.758 1.00 0.00 H TER 84305 WAT 8656 ATOM 84305 O WAT 8657 137.822 85.798 14.807 1.00 0.00 O ATOM 84306 H1 WAT 8657 137.931 84.855 14.684 1.00 0.00 H ATOM 84307 H2 WAT 8657 138.267 85.984 15.634 1.00 0.00 H TER 84309 WAT 8657 ATOM 84309 O WAT 8658 68.011 104.721 120.027 1.00 0.00 O ATOM 84310 H1 WAT 8658 67.638 105.079 120.833 1.00 0.00 H ATOM 84311 H2 WAT 8658 68.465 105.460 119.623 1.00 0.00 H TER 84313 WAT 8658 ATOM 84313 O WAT 8659 37.724 58.174 122.040 1.00 0.00 O ATOM 84314 H1 WAT 8659 38.419 57.516 122.060 1.00 0.00 H ATOM 84315 H2 WAT 8659 37.394 58.200 122.938 1.00 0.00 H TER 84317 WAT 8659 ATOM 84317 O WAT 8660 46.502 135.171 78.893 1.00 0.00 O ATOM 84318 H1 WAT 8660 47.247 135.042 78.306 1.00 0.00 H ATOM 84319 H2 WAT 8660 46.028 135.914 78.519 1.00 0.00 H TER 84321 WAT 8660 ATOM 84321 O WAT 8661 53.341 111.847 137.276 1.00 0.00 O ATOM 84322 H1 WAT 8661 52.418 112.068 137.147 1.00 0.00 H ATOM 84323 H2 WAT 8661 53.617 111.475 136.439 1.00 0.00 H TER 84325 WAT 8661 ATOM 84325 O WAT 8662 51.358 23.743 124.872 1.00 0.00 O ATOM 84326 H1 WAT 8662 51.425 23.121 125.596 1.00 0.00 H ATOM 84327 H2 WAT 8662 50.570 24.251 125.064 1.00 0.00 H TER 84329 WAT 8662 ATOM 84329 O WAT 8663 132.353 39.667 75.956 1.00 0.00 O ATOM 84330 H1 WAT 8663 131.617 39.321 76.461 1.00 0.00 H ATOM 84331 H2 WAT 8663 132.582 38.959 75.353 1.00 0.00 H TER 84333 WAT 8663 ATOM 84333 O WAT 8664 35.702 35.545 101.592 1.00 0.00 O ATOM 84334 H1 WAT 8664 35.663 34.603 101.754 1.00 0.00 H ATOM 84335 H2 WAT 8664 36.147 35.625 100.748 1.00 0.00 H TER 84337 WAT 8664 ATOM 84337 O WAT 8665 42.963 35.473 158.473 1.00 0.00 O ATOM 84338 H1 WAT 8665 42.733 35.429 159.401 1.00 0.00 H ATOM 84339 H2 WAT 8665 42.289 34.955 158.034 1.00 0.00 H TER 84341 WAT 8665 ATOM 84341 O WAT 8666 37.064 48.163 93.909 1.00 0.00 O ATOM 84342 H1 WAT 8666 37.002 49.100 94.095 1.00 0.00 H ATOM 84343 H2 WAT 8666 38.003 47.979 93.916 1.00 0.00 H TER 84345 WAT 8666 ATOM 84345 O WAT 8667 142.489 128.810 93.445 1.00 0.00 O ATOM 84346 H1 WAT 8667 142.307 128.498 94.331 1.00 0.00 H ATOM 84347 H2 WAT 8667 141.809 129.462 93.276 1.00 0.00 H TER 84349 WAT 8667 ATOM 84349 O WAT 8668 101.176 109.231 135.994 1.00 0.00 O ATOM 84350 H1 WAT 8668 101.828 108.973 136.646 1.00 0.00 H ATOM 84351 H2 WAT 8668 101.689 109.446 135.215 1.00 0.00 H TER 84353 WAT 8668 ATOM 84353 O WAT 8669 59.680 90.838 115.525 1.00 0.00 O ATOM 84354 H1 WAT 8669 59.871 89.909 115.658 1.00 0.00 H ATOM 84355 H2 WAT 8669 59.721 91.219 116.402 1.00 0.00 H TER 84357 WAT 8669 ATOM 84357 O WAT 8670 40.613 33.298 136.214 1.00 0.00 O ATOM 84358 H1 WAT 8670 41.348 32.684 136.196 1.00 0.00 H ATOM 84359 H2 WAT 8670 40.604 33.634 137.110 1.00 0.00 H TER 84361 WAT 8670 ATOM 84361 O WAT 8671 63.728 142.493 124.520 1.00 0.00 O ATOM 84362 H1 WAT 8671 63.679 143.405 124.804 1.00 0.00 H ATOM 84363 H2 WAT 8671 63.539 141.986 125.310 1.00 0.00 H TER 84365 WAT 8671 ATOM 84365 O WAT 8672 134.994 65.131 81.965 1.00 0.00 O ATOM 84366 H1 WAT 8672 135.813 65.309 81.503 1.00 0.00 H ATOM 84367 H2 WAT 8672 134.487 64.594 81.355 1.00 0.00 H TER 84369 WAT 8672 ATOM 84369 O WAT 8673 23.305 79.062 87.289 1.00 0.00 O ATOM 84370 H1 WAT 8673 22.490 79.508 87.058 1.00 0.00 H ATOM 84371 H2 WAT 8673 23.994 79.627 86.940 1.00 0.00 H TER 84373 WAT 8673 ATOM 84373 O WAT 8674 1.607 15.276 94.766 1.00 0.00 O ATOM 84374 H1 WAT 8674 1.417 16.106 95.204 1.00 0.00 H ATOM 84375 H2 WAT 8674 0.748 14.938 94.511 1.00 0.00 H TER 84377 WAT 8674 ATOM 84377 O WAT 8675 101.105 11.948 74.147 1.00 0.00 O ATOM 84378 H1 WAT 8675 101.108 12.423 74.978 1.00 0.00 H ATOM 84379 H2 WAT 8675 101.819 12.340 73.645 1.00 0.00 H TER 84381 WAT 8675 ATOM 84381 O WAT 8676 40.086 31.496 8.555 1.00 0.00 O ATOM 84382 H1 WAT 8676 39.134 31.426 8.477 1.00 0.00 H ATOM 84383 H2 WAT 8676 40.245 32.425 8.720 1.00 0.00 H TER 84385 WAT 8676 ATOM 84385 O WAT 8677 136.624 108.105 110.015 1.00 0.00 O ATOM 84386 H1 WAT 8677 137.225 108.359 109.314 1.00 0.00 H ATOM 84387 H2 WAT 8677 135.801 108.540 109.794 1.00 0.00 H TER 84389 WAT 8677 ATOM 84389 O WAT 8678 58.330 94.921 64.148 1.00 0.00 O ATOM 84390 H1 WAT 8678 57.472 94.587 63.886 1.00 0.00 H ATOM 84391 H2 WAT 8678 58.277 94.993 65.101 1.00 0.00 H TER 84393 WAT 8678 ATOM 84393 O WAT 8679 76.193 118.314 86.673 1.00 0.00 O ATOM 84394 H1 WAT 8679 76.009 118.666 85.803 1.00 0.00 H ATOM 84395 H2 WAT 8679 75.844 118.970 87.276 1.00 0.00 H TER 84397 WAT 8679 ATOM 84397 O WAT 8680 133.674 15.616 95.604 1.00 0.00 O ATOM 84398 H1 WAT 8680 133.632 15.061 96.383 1.00 0.00 H ATOM 84399 H2 WAT 8680 134.015 16.452 95.924 1.00 0.00 H TER 84401 WAT 8680 ATOM 84401 O WAT 8681 136.145 72.489 153.053 1.00 0.00 O ATOM 84402 H1 WAT 8681 136.122 71.536 153.141 1.00 0.00 H ATOM 84403 H2 WAT 8681 135.766 72.814 153.870 1.00 0.00 H TER 84405 WAT 8681 ATOM 84405 O WAT 8682 10.087 1.579 71.838 1.00 0.00 O ATOM 84406 H1 WAT 8682 10.038 2.113 71.045 1.00 0.00 H ATOM 84407 H2 WAT 8682 9.199 1.239 71.953 1.00 0.00 H TER 84409 WAT 8682 ATOM 84409 O WAT 8683 77.129 67.288 86.446 1.00 0.00 O ATOM 84410 H1 WAT 8683 77.563 67.839 87.097 1.00 0.00 H ATOM 84411 H2 WAT 8683 76.302 67.038 86.857 1.00 0.00 H TER 84413 WAT 8683 ATOM 84413 O WAT 8684 134.200 37.216 3.537 1.00 0.00 O ATOM 84414 H1 WAT 8684 133.900 36.755 4.321 1.00 0.00 H ATOM 84415 H2 WAT 8684 133.471 37.140 2.921 1.00 0.00 H TER 84417 WAT 8684 ATOM 84417 O WAT 8685 42.646 35.448 120.261 1.00 0.00 O ATOM 84418 H1 WAT 8685 42.078 35.947 119.673 1.00 0.00 H ATOM 84419 H2 WAT 8685 43.417 36.003 120.376 1.00 0.00 H TER 84421 WAT 8685 ATOM 84421 O WAT 8686 100.437 69.594 156.188 1.00 0.00 O ATOM 84422 H1 WAT 8686 100.539 70.320 155.572 1.00 0.00 H ATOM 84423 H2 WAT 8686 99.586 69.214 155.972 1.00 0.00 H TER 84425 WAT 8686 ATOM 84425 O WAT 8687 104.968 48.650 63.273 1.00 0.00 O ATOM 84426 H1 WAT 8687 104.431 49.426 63.433 1.00 0.00 H ATOM 84427 H2 WAT 8687 104.646 48.303 62.441 1.00 0.00 H TER 84429 WAT 8687 ATOM 84429 O WAT 8688 136.339 2.473 145.243 1.00 0.00 O ATOM 84430 H1 WAT 8688 137.292 2.507 145.324 1.00 0.00 H ATOM 84431 H2 WAT 8688 136.059 1.894 145.952 1.00 0.00 H TER 84433 WAT 8688 ATOM 84433 O WAT 8689 135.526 114.248 158.794 1.00 0.00 O ATOM 84434 H1 WAT 8689 134.945 113.661 159.277 1.00 0.00 H ATOM 84435 H2 WAT 8689 135.114 114.340 157.934 1.00 0.00 H TER 84437 WAT 8689 ATOM 84437 O WAT 8690 140.820 138.807 126.862 1.00 0.00 O ATOM 84438 H1 WAT 8690 141.065 138.087 126.280 1.00 0.00 H ATOM 84439 H2 WAT 8690 139.866 138.755 126.920 1.00 0.00 H TER 84441 WAT 8690 ATOM 84441 O WAT 8691 19.509 18.316 107.848 1.00 0.00 O ATOM 84442 H1 WAT 8691 19.097 18.184 108.701 1.00 0.00 H ATOM 84443 H2 WAT 8691 18.802 18.185 107.217 1.00 0.00 H TER 84445 WAT 8691 ATOM 84445 O WAT 8692 77.281 139.378 115.211 1.00 0.00 O ATOM 84446 H1 WAT 8692 77.184 140.310 115.405 1.00 0.00 H ATOM 84447 H2 WAT 8692 77.660 139.005 116.007 1.00 0.00 H TER 84449 WAT 8692 ATOM 84449 O WAT 8693 53.036 101.945 110.129 1.00 0.00 O ATOM 84450 H1 WAT 8693 52.357 101.755 109.482 1.00 0.00 H ATOM 84451 H2 WAT 8693 52.779 102.788 110.504 1.00 0.00 H TER 84453 WAT 8693 ATOM 84453 O WAT 8694 125.822 9.850 11.513 1.00 0.00 O ATOM 84454 H1 WAT 8694 125.693 9.202 12.206 1.00 0.00 H ATOM 84455 H2 WAT 8694 125.172 9.624 10.848 1.00 0.00 H TER 84457 WAT 8694 ATOM 84457 O WAT 8695 103.436 120.041 111.970 1.00 0.00 O ATOM 84458 H1 WAT 8695 103.190 120.910 111.650 1.00 0.00 H ATOM 84459 H2 WAT 8695 104.392 120.033 111.929 1.00 0.00 H TER 84461 WAT 8695 ATOM 84461 O WAT 8696 130.775 50.779 76.971 1.00 0.00 O ATOM 84462 H1 WAT 8696 131.257 50.067 77.393 1.00 0.00 H ATOM 84463 H2 WAT 8696 131.328 51.550 77.097 1.00 0.00 H TER 84465 WAT 8696 ATOM 84465 O WAT 8697 40.587 142.536 119.482 1.00 0.00 O ATOM 84466 H1 WAT 8697 41.493 142.517 119.792 1.00 0.00 H ATOM 84467 H2 WAT 8697 40.342 143.461 119.517 1.00 0.00 H TER 84469 WAT 8697 ATOM 84469 O WAT 8698 55.883 104.233 146.670 1.00 0.00 O ATOM 84470 H1 WAT 8698 55.565 104.606 147.492 1.00 0.00 H ATOM 84471 H2 WAT 8698 55.564 103.331 146.678 1.00 0.00 H TER 84473 WAT 8698 ATOM 84473 O WAT 8699 124.279 132.560 156.883 1.00 0.00 O ATOM 84474 H1 WAT 8699 124.597 133.158 156.207 1.00 0.00 H ATOM 84475 H2 WAT 8699 123.325 132.614 156.820 1.00 0.00 H TER 84477 WAT 8699 ATOM 84477 O WAT 8700 83.308 30.878 10.851 1.00 0.00 O ATOM 84478 H1 WAT 8700 82.829 31.488 10.289 1.00 0.00 H ATOM 84479 H2 WAT 8700 82.717 30.715 11.586 1.00 0.00 H TER 84481 WAT 8700 ATOM 84481 O WAT 8701 21.036 27.135 76.417 1.00 0.00 O ATOM 84482 H1 WAT 8701 20.635 26.739 75.643 1.00 0.00 H ATOM 84483 H2 WAT 8701 20.330 27.640 76.821 1.00 0.00 H TER 84485 WAT 8701 ATOM 84485 O WAT 8702 67.803 26.013 111.173 1.00 0.00 O ATOM 84486 H1 WAT 8702 67.987 26.383 112.036 1.00 0.00 H ATOM 84487 H2 WAT 8702 67.765 25.068 111.321 1.00 0.00 H TER 84489 WAT 8702 ATOM 84489 O WAT 8703 133.641 50.656 117.561 1.00 0.00 O ATOM 84490 H1 WAT 8703 134.591 50.551 117.595 1.00 0.00 H ATOM 84491 H2 WAT 8703 133.308 49.776 117.387 1.00 0.00 H TER 84493 WAT 8703 ATOM 84493 O WAT 8704 87.558 99.835 4.602 1.00 0.00 O ATOM 84494 H1 WAT 8704 87.280 98.931 4.460 1.00 0.00 H ATOM 84495 H2 WAT 8704 87.026 100.136 5.339 1.00 0.00 H TER 84497 WAT 8704 ATOM 84497 O WAT 8705 102.443 34.913 132.541 1.00 0.00 O ATOM 84498 H1 WAT 8705 103.285 34.751 132.116 1.00 0.00 H ATOM 84499 H2 WAT 8705 102.615 34.780 133.473 1.00 0.00 H TER 84501 WAT 8705 ATOM 84501 O WAT 8706 41.276 23.569 108.520 1.00 0.00 O ATOM 84502 H1 WAT 8706 41.216 22.762 109.031 1.00 0.00 H ATOM 84503 H2 WAT 8706 41.609 24.220 109.138 1.00 0.00 H TER 84505 WAT 8706 ATOM 84505 O WAT 8707 3.935 3.929 13.951 1.00 0.00 O ATOM 84506 H1 WAT 8707 3.070 3.543 14.083 1.00 0.00 H ATOM 84507 H2 WAT 8707 3.828 4.848 14.196 1.00 0.00 H TER 84509 WAT 8707 ATOM 84509 O WAT 8708 48.016 97.714 146.220 1.00 0.00 O ATOM 84510 H1 WAT 8708 47.498 98.220 145.594 1.00 0.00 H ATOM 84511 H2 WAT 8708 48.799 98.245 146.367 1.00 0.00 H TER 84513 WAT 8708 ATOM 84513 O WAT 8709 98.489 65.764 12.264 1.00 0.00 O ATOM 84514 H1 WAT 8709 98.079 65.215 12.933 1.00 0.00 H ATOM 84515 H2 WAT 8709 98.153 65.424 11.435 1.00 0.00 H TER 84517 WAT 8709 ATOM 84517 O WAT 8710 48.513 79.178 94.355 1.00 0.00 O ATOM 84518 H1 WAT 8710 48.235 80.094 94.351 1.00 0.00 H ATOM 84519 H2 WAT 8710 48.550 78.934 93.430 1.00 0.00 H TER 84521 WAT 8710 ATOM 84521 O WAT 8711 66.579 33.580 97.727 1.00 0.00 O ATOM 84522 H1 WAT 8711 66.272 33.898 96.878 1.00 0.00 H ATOM 84523 H2 WAT 8711 66.324 32.658 97.744 1.00 0.00 H TER 84525 WAT 8711 ATOM 84525 O WAT 8712 63.343 66.540 63.472 1.00 0.00 O ATOM 84526 H1 WAT 8712 62.435 66.630 63.183 1.00 0.00 H ATOM 84527 H2 WAT 8712 63.830 67.159 62.927 1.00 0.00 H TER 84529 WAT 8712 ATOM 84529 O WAT 8713 130.228 11.981 125.358 1.00 0.00 O ATOM 84530 H1 WAT 8713 130.955 12.488 125.720 1.00 0.00 H ATOM 84531 H2 WAT 8713 129.494 12.164 125.944 1.00 0.00 H TER 84533 WAT 8713 ATOM 84533 O WAT 8714 92.303 119.893 158.417 1.00 0.00 O ATOM 84534 H1 WAT 8714 91.432 119.504 158.345 1.00 0.00 H ATOM 84535 H2 WAT 8714 92.151 120.835 158.338 1.00 0.00 H TER 84537 WAT 8714 ATOM 84537 O WAT 8715 84.595 29.119 132.210 1.00 0.00 O ATOM 84538 H1 WAT 8715 85.210 28.470 131.868 1.00 0.00 H ATOM 84539 H2 WAT 8715 83.737 28.819 131.908 1.00 0.00 H TER 84541 WAT 8715 ATOM 84541 O WAT 8716 139.481 83.356 121.232 1.00 0.00 O ATOM 84542 H1 WAT 8716 139.181 84.208 121.550 1.00 0.00 H ATOM 84543 H2 WAT 8716 139.512 82.806 122.015 1.00 0.00 H TER 84545 WAT 8716 ATOM 84545 O WAT 8717 127.135 23.284 155.388 1.00 0.00 O ATOM 84546 H1 WAT 8717 126.669 22.602 155.872 1.00 0.00 H ATOM 84547 H2 WAT 8717 126.898 24.098 155.833 1.00 0.00 H TER 84549 WAT 8717 ATOM 84549 O WAT 8718 96.422 84.376 60.414 1.00 0.00 O ATOM 84550 H1 WAT 8718 95.769 84.679 61.045 1.00 0.00 H ATOM 84551 H2 WAT 8718 96.070 83.550 60.083 1.00 0.00 H TER 84553 WAT 8718 ATOM 84553 O WAT 8719 102.960 66.274 3.736 1.00 0.00 O ATOM 84554 H1 WAT 8719 102.612 65.589 3.165 1.00 0.00 H ATOM 84555 H2 WAT 8719 103.641 65.836 4.248 1.00 0.00 H TER 84557 WAT 8719 ATOM 84557 O WAT 8720 116.358 23.830 79.916 1.00 0.00 O ATOM 84558 H1 WAT 8720 115.675 23.228 79.623 1.00 0.00 H ATOM 84559 H2 WAT 8720 115.886 24.519 80.384 1.00 0.00 H TER 84561 WAT 8720 ATOM 84561 O WAT 8721 84.421 82.445 59.490 1.00 0.00 O ATOM 84562 H1 WAT 8721 83.624 81.926 59.601 1.00 0.00 H ATOM 84563 H2 WAT 8721 85.118 81.795 59.395 1.00 0.00 H TER 84565 WAT 8721 ATOM 84565 O WAT 8722 9.791 128.520 87.135 1.00 0.00 O ATOM 84566 H1 WAT 8722 10.496 128.240 86.552 1.00 0.00 H ATOM 84567 H2 WAT 8722 9.844 129.476 87.132 1.00 0.00 H TER 84569 WAT 8722 ATOM 84569 O WAT 8723 33.815 5.436 72.464 1.00 0.00 O ATOM 84570 H1 WAT 8723 33.781 5.857 71.605 1.00 0.00 H ATOM 84571 H2 WAT 8723 34.361 4.661 72.329 1.00 0.00 H TER 84573 WAT 8723 ATOM 84573 O WAT 8724 87.481 50.238 21.783 1.00 0.00 O ATOM 84574 H1 WAT 8724 86.859 50.688 22.355 1.00 0.00 H ATOM 84575 H2 WAT 8724 87.419 49.318 22.039 1.00 0.00 H TER 84577 WAT 8724 ATOM 84577 O WAT 8725 42.188 75.117 132.862 1.00 0.00 O ATOM 84578 H1 WAT 8725 41.723 75.827 133.303 1.00 0.00 H ATOM 84579 H2 WAT 8725 42.061 75.290 131.929 1.00 0.00 H TER 84581 WAT 8725 ATOM 84581 O WAT 8726 76.801 27.855 12.613 1.00 0.00 O ATOM 84582 H1 WAT 8726 76.397 27.594 13.441 1.00 0.00 H ATOM 84583 H2 WAT 8726 77.546 27.262 12.513 1.00 0.00 H TER 84585 WAT 8726 ATOM 84585 O WAT 8727 73.182 82.485 8.365 1.00 0.00 O ATOM 84586 H1 WAT 8727 72.952 82.578 7.440 1.00 0.00 H ATOM 84587 H2 WAT 8727 74.035 82.050 8.357 1.00 0.00 H TER 84589 WAT 8727 ATOM 84589 O WAT 8728 130.739 89.780 101.353 1.00 0.00 O ATOM 84590 H1 WAT 8728 131.153 89.801 100.490 1.00 0.00 H ATOM 84591 H2 WAT 8728 129.842 89.493 101.181 1.00 0.00 H TER 84593 WAT 8728 ATOM 84593 O WAT 8729 23.187 83.830 118.130 1.00 0.00 O ATOM 84594 H1 WAT 8729 22.859 83.892 117.233 1.00 0.00 H ATOM 84595 H2 WAT 8729 22.469 84.160 118.671 1.00 0.00 H TER 84597 WAT 8729 ATOM 84597 O WAT 8730 119.754 108.634 78.242 1.00 0.00 O ATOM 84598 H1 WAT 8730 119.842 108.091 77.459 1.00 0.00 H ATOM 84599 H2 WAT 8730 120.642 108.948 78.416 1.00 0.00 H TER 84601 WAT 8730 ATOM 84601 O WAT 8731 16.492 127.696 120.365 1.00 0.00 O ATOM 84602 H1 WAT 8731 17.034 128.302 119.860 1.00 0.00 H ATOM 84603 H2 WAT 8731 15.938 127.269 119.712 1.00 0.00 H TER 84605 WAT 8731 ATOM 84605 O WAT 8732 30.749 125.396 99.977 1.00 0.00 O ATOM 84606 H1 WAT 8732 30.050 125.157 100.585 1.00 0.00 H ATOM 84607 H2 WAT 8732 30.831 126.345 100.068 1.00 0.00 H TER 84609 WAT 8732 ATOM 84609 O WAT 8733 78.313 22.236 88.528 1.00 0.00 O ATOM 84610 H1 WAT 8733 77.492 22.328 89.012 1.00 0.00 H ATOM 84611 H2 WAT 8733 78.663 21.390 88.808 1.00 0.00 H TER 84613 WAT 8733 ATOM 84613 O WAT 8734 44.656 10.077 87.332 1.00 0.00 O ATOM 84614 H1 WAT 8734 44.251 10.842 87.740 1.00 0.00 H ATOM 84615 H2 WAT 8734 45.485 10.403 86.983 1.00 0.00 H TER 84617 WAT 8734 ATOM 84617 O WAT 8735 40.470 133.700 71.224 1.00 0.00 O ATOM 84618 H1 WAT 8735 40.653 134.069 72.088 1.00 0.00 H ATOM 84619 H2 WAT 8735 39.586 133.340 71.299 1.00 0.00 H TER 84621 WAT 8735 ATOM 84621 O WAT 8736 106.860 101.936 113.642 1.00 0.00 O ATOM 84622 H1 WAT 8736 106.176 102.576 113.841 1.00 0.00 H ATOM 84623 H2 WAT 8736 107.627 102.250 114.120 1.00 0.00 H TER 84625 WAT 8736 ATOM 84625 O WAT 8737 3.439 133.050 155.929 1.00 0.00 O ATOM 84626 H1 WAT 8737 3.887 132.204 155.919 1.00 0.00 H ATOM 84627 H2 WAT 8737 2.760 132.953 156.597 1.00 0.00 H TER 84629 WAT 8737 ATOM 84629 O WAT 8738 65.164 116.666 53.634 1.00 0.00 O ATOM 84630 H1 WAT 8738 65.574 117.209 52.961 1.00 0.00 H ATOM 84631 H2 WAT 8738 64.718 117.290 54.207 1.00 0.00 H TER 84633 WAT 8738 ATOM 84633 O WAT 8739 131.998 73.568 129.578 1.00 0.00 O ATOM 84634 H1 WAT 8739 131.615 74.441 129.495 1.00 0.00 H ATOM 84635 H2 WAT 8739 131.324 73.052 130.019 1.00 0.00 H TER 84637 WAT 8739 ATOM 84637 O WAT 8740 38.026 3.135 80.375 1.00 0.00 O ATOM 84638 H1 WAT 8740 38.570 3.150 81.162 1.00 0.00 H ATOM 84639 H2 WAT 8740 37.178 2.810 80.676 1.00 0.00 H TER 84641 WAT 8740 ATOM 84641 O WAT 8741 23.280 34.316 111.220 1.00 0.00 O ATOM 84642 H1 WAT 8741 23.421 34.617 112.118 1.00 0.00 H ATOM 84643 H2 WAT 8741 22.405 34.634 110.997 1.00 0.00 H TER 84645 WAT 8741 ATOM 84645 O WAT 8742 141.599 109.866 64.370 1.00 0.00 O ATOM 84646 H1 WAT 8742 142.508 109.967 64.653 1.00 0.00 H ATOM 84647 H2 WAT 8742 141.383 110.701 63.955 1.00 0.00 H TER 84649 WAT 8742 ATOM 84649 O WAT 8743 53.932 120.636 66.058 1.00 0.00 O ATOM 84650 H1 WAT 8743 53.623 120.701 65.154 1.00 0.00 H ATOM 84651 H2 WAT 8743 54.886 120.679 65.988 1.00 0.00 H TER 84653 WAT 8743 ATOM 84653 O WAT 8744 115.936 28.211 128.588 1.00 0.00 O ATOM 84654 H1 WAT 8744 115.226 28.791 128.863 1.00 0.00 H ATOM 84655 H2 WAT 8744 116.529 28.185 129.339 1.00 0.00 H TER 84657 WAT 8744 ATOM 84657 O WAT 8745 132.598 97.478 77.496 1.00 0.00 O ATOM 84658 H1 WAT 8745 132.641 97.791 76.592 1.00 0.00 H ATOM 84659 H2 WAT 8745 133.506 97.498 77.799 1.00 0.00 H TER 84661 WAT 8745 ATOM 84661 O WAT 8746 127.818 121.367 78.739 1.00 0.00 O ATOM 84662 H1 WAT 8746 127.766 120.806 77.965 1.00 0.00 H ATOM 84663 H2 WAT 8746 126.907 121.501 79.000 1.00 0.00 H TER 84665 WAT 8746 ATOM 84665 O WAT 8747 91.215 73.542 116.715 1.00 0.00 O ATOM 84666 H1 WAT 8747 90.388 73.663 116.249 1.00 0.00 H ATOM 84667 H2 WAT 8747 91.876 73.918 116.134 1.00 0.00 H TER 84669 WAT 8747 ATOM 84669 O WAT 8748 19.828 122.401 140.017 1.00 0.00 O ATOM 84670 H1 WAT 8748 20.121 121.531 139.747 1.00 0.00 H ATOM 84671 H2 WAT 8748 19.881 122.386 140.973 1.00 0.00 H TER 84673 WAT 8748 ATOM 84673 O WAT 8749 0.884 43.329 146.429 1.00 0.00 O ATOM 84674 H1 WAT 8749 1.240 43.303 147.317 1.00 0.00 H ATOM 84675 H2 WAT 8749 1.654 43.373 145.863 1.00 0.00 H TER 84677 WAT 8749 ATOM 84677 O WAT 8750 116.881 105.893 132.003 1.00 0.00 O ATOM 84678 H1 WAT 8750 117.287 105.069 132.269 1.00 0.00 H ATOM 84679 H2 WAT 8750 115.989 105.652 131.754 1.00 0.00 H TER 84681 WAT 8750 ATOM 84681 O WAT 8751 14.853 144.528 110.359 1.00 0.00 O ATOM 84682 H1 WAT 8751 15.162 144.338 109.473 1.00 0.00 H ATOM 84683 H2 WAT 8751 13.986 144.125 110.401 1.00 0.00 H TER 84685 WAT 8751 ATOM 84685 O WAT 8752 119.264 71.495 69.269 1.00 0.00 O ATOM 84686 H1 WAT 8752 118.669 71.260 69.981 1.00 0.00 H ATOM 84687 H2 WAT 8752 118.690 71.664 68.522 1.00 0.00 H TER 84689 WAT 8752 ATOM 84689 O WAT 8753 87.577 76.143 83.889 1.00 0.00 O ATOM 84690 H1 WAT 8753 88.111 75.494 83.432 1.00 0.00 H ATOM 84691 H2 WAT 8753 87.736 75.974 84.818 1.00 0.00 H TER 84693 WAT 8753 ATOM 84693 O WAT 8754 83.605 140.158 76.305 1.00 0.00 O ATOM 84694 H1 WAT 8754 84.126 140.514 77.024 1.00 0.00 H ATOM 84695 H2 WAT 8754 84.058 139.353 76.057 1.00 0.00 H TER 84697 WAT 8754 ATOM 84697 O WAT 8755 124.936 50.411 109.546 1.00 0.00 O ATOM 84698 H1 WAT 8755 124.933 51.042 110.266 1.00 0.00 H ATOM 84699 H2 WAT 8755 125.821 50.463 109.185 1.00 0.00 H TER 84701 WAT 8755 ATOM 84701 O WAT 8756 73.887 105.854 139.021 1.00 0.00 O ATOM 84702 H1 WAT 8756 74.039 105.580 139.925 1.00 0.00 H ATOM 84703 H2 WAT 8756 74.559 105.397 138.515 1.00 0.00 H TER 84705 WAT 8756 ATOM 84705 O WAT 8757 100.116 93.136 71.981 1.00 0.00 O ATOM 84706 H1 WAT 8757 100.843 93.193 71.361 1.00 0.00 H ATOM 84707 H2 WAT 8757 100.538 93.052 72.837 1.00 0.00 H TER 84709 WAT 8757 ATOM 84709 O WAT 8758 52.216 89.690 67.402 1.00 0.00 O ATOM 84710 H1 WAT 8758 52.810 90.187 66.840 1.00 0.00 H ATOM 84711 H2 WAT 8758 52.071 90.258 68.159 1.00 0.00 H TER 84713 WAT 8758 ATOM 84713 O WAT 8759 44.796 93.579 66.932 1.00 0.00 O ATOM 84714 H1 WAT 8759 44.061 94.017 67.362 1.00 0.00 H ATOM 84715 H2 WAT 8759 44.417 93.200 66.138 1.00 0.00 H TER 84717 WAT 8759 ATOM 84717 O WAT 8760 84.522 116.529 149.221 1.00 0.00 O ATOM 84718 H1 WAT 8760 84.878 117.306 149.653 1.00 0.00 H ATOM 84719 H2 WAT 8760 85.114 116.371 148.486 1.00 0.00 H TER 84721 WAT 8760 ATOM 84721 O WAT 8761 13.062 130.053 60.994 1.00 0.00 O ATOM 84722 H1 WAT 8761 13.010 130.905 61.427 1.00 0.00 H ATOM 84723 H2 WAT 8761 12.477 130.132 60.240 1.00 0.00 H TER 84725 WAT 8761 ATOM 84725 O WAT 8762 70.083 111.599 64.224 1.00 0.00 O ATOM 84726 H1 WAT 8762 70.504 110.743 64.303 1.00 0.00 H ATOM 84727 H2 WAT 8762 69.408 111.598 64.902 1.00 0.00 H TER 84729 WAT 8762 ATOM 84729 O WAT 8763 119.663 52.363 139.326 1.00 0.00 O ATOM 84730 H1 WAT 8763 120.176 51.618 139.014 1.00 0.00 H ATOM 84731 H2 WAT 8763 120.305 52.937 139.744 1.00 0.00 H TER 84733 WAT 8763 ATOM 84733 O WAT 8764 44.725 16.028 95.446 1.00 0.00 O ATOM 84734 H1 WAT 8764 45.513 16.018 95.988 1.00 0.00 H ATOM 84735 H2 WAT 8764 44.740 16.883 95.015 1.00 0.00 H TER 84737 WAT 8764 ATOM 84737 O WAT 8765 134.625 115.202 125.391 1.00 0.00 O ATOM 84738 H1 WAT 8765 134.707 116.117 125.120 1.00 0.00 H ATOM 84739 H2 WAT 8765 135.191 114.722 124.786 1.00 0.00 H TER 84741 WAT 8765 ATOM 84741 O WAT 8766 102.436 4.716 128.121 1.00 0.00 O ATOM 84742 H1 WAT 8766 102.335 5.667 128.154 1.00 0.00 H ATOM 84743 H2 WAT 8766 103.267 4.578 127.666 1.00 0.00 H TER 84745 WAT 8766 ATOM 84745 O WAT 8767 57.765 120.419 63.642 1.00 0.00 O ATOM 84746 H1 WAT 8767 57.399 120.335 64.523 1.00 0.00 H ATOM 84747 H2 WAT 8767 58.708 120.502 63.782 1.00 0.00 H TER 84749 WAT 8767 ATOM 84749 O WAT 8768 29.439 91.133 152.066 1.00 0.00 O ATOM 84750 H1 WAT 8768 29.015 91.666 151.393 1.00 0.00 H ATOM 84751 H2 WAT 8768 29.190 91.547 152.892 1.00 0.00 H TER 84753 WAT 8768 ATOM 84753 O WAT 8769 73.435 120.545 120.307 1.00 0.00 O ATOM 84754 H1 WAT 8769 72.722 120.079 120.744 1.00 0.00 H ATOM 84755 H2 WAT 8769 73.210 120.509 119.377 1.00 0.00 H TER 84757 WAT 8769 ATOM 84757 O WAT 8770 71.083 78.658 130.428 1.00 0.00 O ATOM 84758 H1 WAT 8770 70.933 78.833 129.499 1.00 0.00 H ATOM 84759 H2 WAT 8770 70.884 77.727 130.531 1.00 0.00 H TER 84761 WAT 8770 ATOM 84761 O WAT 8771 84.380 107.302 135.193 1.00 0.00 O ATOM 84762 H1 WAT 8771 83.762 107.927 135.574 1.00 0.00 H ATOM 84763 H2 WAT 8771 84.800 107.785 134.481 1.00 0.00 H TER 84765 WAT 8771 ATOM 84765 O WAT 8772 120.954 95.814 71.858 1.00 0.00 O ATOM 84766 H1 WAT 8772 120.588 95.101 72.382 1.00 0.00 H ATOM 84767 H2 WAT 8772 121.410 95.373 71.141 1.00 0.00 H TER 84769 WAT 8772 ATOM 84769 O WAT 8773 36.165 53.057 77.680 1.00 0.00 O ATOM 84770 H1 WAT 8773 35.373 53.173 77.155 1.00 0.00 H ATOM 84771 H2 WAT 8773 36.819 53.609 77.251 1.00 0.00 H TER 84773 WAT 8773 ATOM 84773 O WAT 8774 112.151 82.243 144.368 1.00 0.00 O ATOM 84774 H1 WAT 8774 112.901 82.820 144.516 1.00 0.00 H ATOM 84775 H2 WAT 8774 112.503 81.360 144.479 1.00 0.00 H TER 84777 WAT 8774 ATOM 84777 O WAT 8775 8.043 38.335 141.569 1.00 0.00 O ATOM 84778 H1 WAT 8775 8.547 38.915 140.998 1.00 0.00 H ATOM 84779 H2 WAT 8775 8.169 38.695 142.447 1.00 0.00 H TER 84781 WAT 8775 ATOM 84781 O WAT 8776 95.764 92.270 113.410 1.00 0.00 O ATOM 84782 H1 WAT 8776 96.138 91.825 112.649 1.00 0.00 H ATOM 84783 H2 WAT 8776 96.493 92.344 114.025 1.00 0.00 H TER 84785 WAT 8776 ATOM 84785 O WAT 8777 113.055 53.662 72.074 1.00 0.00 O ATOM 84786 H1 WAT 8777 113.816 53.223 72.454 1.00 0.00 H ATOM 84787 H2 WAT 8777 113.041 54.523 72.493 1.00 0.00 H TER 84789 WAT 8777 ATOM 84789 O WAT 8778 74.312 79.050 111.846 1.00 0.00 O ATOM 84790 H1 WAT 8778 74.635 79.804 111.353 1.00 0.00 H ATOM 84791 H2 WAT 8778 73.368 79.193 111.911 1.00 0.00 H TER 84793 WAT 8778 ATOM 84793 O WAT 8779 19.327 11.659 103.735 1.00 0.00 O ATOM 84794 H1 WAT 8779 20.233 11.384 103.876 1.00 0.00 H ATOM 84795 H2 WAT 8779 19.082 12.105 104.546 1.00 0.00 H TER 84797 WAT 8779 ATOM 84797 O WAT 8780 8.888 16.990 119.743 1.00 0.00 O ATOM 84798 H1 WAT 8780 8.935 17.929 119.562 1.00 0.00 H ATOM 84799 H2 WAT 8780 7.977 16.757 119.565 1.00 0.00 H TER 84801 WAT 8780 ATOM 84801 O WAT 8781 82.945 125.698 4.288 1.00 0.00 O ATOM 84802 H1 WAT 8781 83.603 125.977 3.651 1.00 0.00 H ATOM 84803 H2 WAT 8781 82.212 126.299 4.154 1.00 0.00 H TER 84805 WAT 8781 ATOM 84805 O WAT 8782 62.967 96.461 108.858 1.00 0.00 O ATOM 84806 H1 WAT 8782 62.729 95.563 108.627 1.00 0.00 H ATOM 84807 H2 WAT 8782 63.678 96.682 108.257 1.00 0.00 H TER 84809 WAT 8782 ATOM 84809 O WAT 8783 6.726 4.909 1.026 1.00 0.00 O ATOM 84810 H1 WAT 8783 7.459 5.522 1.091 1.00 0.00 H ATOM 84811 H2 WAT 8783 7.102 4.129 0.617 1.00 0.00 H TER 84813 WAT 8783 ATOM 84813 O WAT 8784 76.422 92.727 99.351 1.00 0.00 O ATOM 84814 H1 WAT 8784 76.424 92.459 98.432 1.00 0.00 H ATOM 84815 H2 WAT 8784 75.771 93.428 99.394 1.00 0.00 H TER 84817 WAT 8784 ATOM 84817 O WAT 8785 105.919 99.457 18.758 1.00 0.00 O ATOM 84818 H1 WAT 8785 106.092 99.164 19.652 1.00 0.00 H ATOM 84819 H2 WAT 8785 104.964 99.472 18.691 1.00 0.00 H TER 84821 WAT 8785 ATOM 84821 O WAT 8786 73.899 56.467 144.571 1.00 0.00 O ATOM 84822 H1 WAT 8786 73.836 57.291 145.056 1.00 0.00 H ATOM 84823 H2 WAT 8786 73.055 56.039 144.716 1.00 0.00 H TER 84825 WAT 8786 ATOM 84825 O WAT 8787 23.627 51.907 49.882 1.00 0.00 O ATOM 84826 H1 WAT 8787 24.558 51.795 50.074 1.00 0.00 H ATOM 84827 H2 WAT 8787 23.460 52.836 50.039 1.00 0.00 H TER 84829 WAT 8787 ATOM 84829 O WAT 8788 25.396 30.708 113.424 1.00 0.00 O ATOM 84830 H1 WAT 8788 25.423 29.987 112.795 1.00 0.00 H ATOM 84831 H2 WAT 8788 26.098 31.296 113.144 1.00 0.00 H TER 84833 WAT 8788 ATOM 84833 O WAT 8789 54.461 19.332 17.073 1.00 0.00 O ATOM 84834 H1 WAT 8789 54.040 20.111 17.437 1.00 0.00 H ATOM 84835 H2 WAT 8789 54.835 18.885 17.832 1.00 0.00 H TER 84837 WAT 8789 ATOM 84837 O WAT 8790 44.352 56.485 140.884 1.00 0.00 O ATOM 84838 H1 WAT 8790 43.426 56.582 141.109 1.00 0.00 H ATOM 84839 H2 WAT 8790 44.757 56.143 141.681 1.00 0.00 H TER 84841 WAT 8790 ATOM 84841 O WAT 8791 20.241 135.774 118.343 1.00 0.00 O ATOM 84842 H1 WAT 8791 20.367 134.856 118.582 1.00 0.00 H ATOM 84843 H2 WAT 8791 20.026 135.751 117.410 1.00 0.00 H TER 84845 WAT 8791 ATOM 84845 O WAT 8792 129.375 27.295 155.905 1.00 0.00 O ATOM 84846 H1 WAT 8792 128.564 27.061 156.357 1.00 0.00 H ATOM 84847 H2 WAT 8792 129.986 26.593 156.131 1.00 0.00 H TER 84849 WAT 8792 ATOM 84849 O WAT 8793 110.894 42.835 126.805 1.00 0.00 O ATOM 84850 H1 WAT 8793 110.077 42.342 126.883 1.00 0.00 H ATOM 84851 H2 WAT 8793 111.480 42.253 126.323 1.00 0.00 H TER 84853 WAT 8793 ATOM 84853 O WAT 8794 18.114 11.832 6.195 1.00 0.00 O ATOM 84854 H1 WAT 8794 17.631 12.659 6.179 1.00 0.00 H ATOM 84855 H2 WAT 8794 17.932 11.433 5.344 1.00 0.00 H TER 84857 WAT 8794 ATOM 84857 O WAT 8795 57.249 7.656 22.472 1.00 0.00 O ATOM 84858 H1 WAT 8795 58.026 8.042 22.068 1.00 0.00 H ATOM 84859 H2 WAT 8795 56.642 7.521 21.745 1.00 0.00 H TER 84861 WAT 8795 ATOM 84861 O WAT 8796 113.465 101.714 155.819 1.00 0.00 O ATOM 84862 H1 WAT 8796 112.526 101.643 155.646 1.00 0.00 H ATOM 84863 H2 WAT 8796 113.645 101.019 156.451 1.00 0.00 H TER 84865 WAT 8796 ATOM 84865 O WAT 8797 145.113 79.730 9.358 1.00 0.00 O ATOM 84866 H1 WAT 8797 144.539 79.071 8.968 1.00 0.00 H ATOM 84867 H2 WAT 8797 145.389 80.274 8.621 1.00 0.00 H TER 84869 WAT 8797 ATOM 84869 O WAT 8798 113.590 76.328 103.127 1.00 0.00 O ATOM 84870 H1 WAT 8798 113.474 77.153 102.655 1.00 0.00 H ATOM 84871 H2 WAT 8798 113.610 75.661 102.441 1.00 0.00 H TER 84873 WAT 8798 ATOM 84873 O WAT 8799 18.225 110.056 87.185 1.00 0.00 O ATOM 84874 H1 WAT 8799 17.390 109.930 87.635 1.00 0.00 H ATOM 84875 H2 WAT 8799 18.870 110.117 87.889 1.00 0.00 H TER 84877 WAT 8799 ATOM 84877 O WAT 8800 35.889 1.097 66.348 1.00 0.00 O ATOM 84878 H1 WAT 8800 36.074 1.938 66.766 1.00 0.00 H ATOM 84879 H2 WAT 8800 36.522 1.041 65.632 1.00 0.00 H TER 84881 WAT 8800 ATOM 84881 O WAT 8801 105.122 29.544 130.537 1.00 0.00 O ATOM 84882 H1 WAT 8801 105.738 28.851 130.776 1.00 0.00 H ATOM 84883 H2 WAT 8801 105.677 30.286 130.297 1.00 0.00 H TER 84885 WAT 8801 ATOM 84885 O WAT 8802 38.485 24.350 152.828 1.00 0.00 O ATOM 84886 H1 WAT 8802 38.053 23.889 152.109 1.00 0.00 H ATOM 84887 H2 WAT 8802 39.407 24.103 152.751 1.00 0.00 H TER 84889 WAT 8802 ATOM 84889 O WAT 8803 109.800 74.196 145.439 1.00 0.00 O ATOM 84890 H1 WAT 8803 109.965 73.336 145.825 1.00 0.00 H ATOM 84891 H2 WAT 8803 108.901 74.405 145.694 1.00 0.00 H TER 84893 WAT 8803 ATOM 84893 O WAT 8804 7.045 49.430 103.942 1.00 0.00 O ATOM 84894 H1 WAT 8804 7.028 48.911 104.746 1.00 0.00 H ATOM 84895 H2 WAT 8804 7.176 48.788 103.245 1.00 0.00 H TER 84897 WAT 8804 ATOM 84897 O WAT 8805 91.866 133.650 1.887 1.00 0.00 O ATOM 84898 H1 WAT 8805 91.498 133.871 1.032 1.00 0.00 H ATOM 84899 H2 WAT 8805 91.503 132.787 2.089 1.00 0.00 H TER 84901 WAT 8805 ATOM 84901 O WAT 8806 15.811 108.050 98.220 1.00 0.00 O ATOM 84902 H1 WAT 8806 16.532 107.822 97.633 1.00 0.00 H ATOM 84903 H2 WAT 8806 16.239 108.329 99.029 1.00 0.00 H TER 84905 WAT 8806 ATOM 84905 O WAT 8807 44.356 9.200 91.257 1.00 0.00 O ATOM 84906 H1 WAT 8807 45.092 8.838 90.763 1.00 0.00 H ATOM 84907 H2 WAT 8807 43.599 8.692 90.964 1.00 0.00 H TER 84909 WAT 8807 ATOM 84909 O WAT 8808 117.461 136.694 58.778 1.00 0.00 O ATOM 84910 H1 WAT 8808 117.095 135.987 59.310 1.00 0.00 H ATOM 84911 H2 WAT 8808 116.732 136.980 58.227 1.00 0.00 H TER 84913 WAT 8808 ATOM 84913 O WAT 8809 71.123 117.405 64.394 1.00 0.00 O ATOM 84914 H1 WAT 8809 71.714 116.867 63.867 1.00 0.00 H ATOM 84915 H2 WAT 8809 71.571 118.248 64.471 1.00 0.00 H TER 84917 WAT 8809 ATOM 84917 O WAT 8810 41.894 60.856 69.515 1.00 0.00 O ATOM 84918 H1 WAT 8810 41.777 60.165 68.863 1.00 0.00 H ATOM 84919 H2 WAT 8810 41.524 61.637 69.106 1.00 0.00 H TER 84921 WAT 8810 ATOM 84921 O WAT 8811 36.874 32.398 18.655 1.00 0.00 O ATOM 84922 H1 WAT 8811 37.769 32.696 18.820 1.00 0.00 H ATOM 84923 H2 WAT 8811 36.825 31.541 19.079 1.00 0.00 H TER 84925 WAT 8811 ATOM 84925 O WAT 8812 145.654 39.769 1.566 1.00 0.00 O ATOM 84926 H1 WAT 8812 146.118 40.444 1.071 1.00 0.00 H ATOM 84927 H2 WAT 8812 145.848 39.968 2.482 1.00 0.00 H TER 84929 WAT 8812 ATOM 84929 O WAT 8813 91.515 27.745 119.532 1.00 0.00 O ATOM 84930 H1 WAT 8813 91.677 27.918 118.604 1.00 0.00 H ATOM 84931 H2 WAT 8813 90.624 28.058 119.682 1.00 0.00 H TER 84933 WAT 8813 ATOM 84933 O WAT 8814 38.825 54.663 134.326 1.00 0.00 O ATOM 84934 H1 WAT 8814 39.737 54.897 134.497 1.00 0.00 H ATOM 84935 H2 WAT 8814 38.491 55.378 133.785 1.00 0.00 H TER 84937 WAT 8814 ATOM 84937 O WAT 8815 16.438 93.053 109.212 1.00 0.00 O ATOM 84938 H1 WAT 8815 16.339 93.164 110.158 1.00 0.00 H ATOM 84939 H2 WAT 8815 15.543 92.972 108.885 1.00 0.00 H TER 84941 WAT 8815 ATOM 84941 O WAT 8816 6.297 119.700 78.405 1.00 0.00 O ATOM 84942 H1 WAT 8816 5.778 118.897 78.451 1.00 0.00 H ATOM 84943 H2 WAT 8816 7.002 119.495 77.790 1.00 0.00 H TER 84945 WAT 8816 ATOM 84945 O WAT 8817 14.716 59.800 138.873 1.00 0.00 O ATOM 84946 H1 WAT 8817 15.074 60.549 138.397 1.00 0.00 H ATOM 84947 H2 WAT 8817 15.297 59.073 138.647 1.00 0.00 H TER 84949 WAT 8817 ATOM 84949 O WAT 8818 106.503 56.090 144.304 1.00 0.00 O ATOM 84950 H1 WAT 8818 105.783 56.694 144.125 1.00 0.00 H ATOM 84951 H2 WAT 8818 106.634 55.622 143.479 1.00 0.00 H TER 84953 WAT 8818 ATOM 84953 O WAT 8819 131.634 101.698 0.379 1.00 0.00 O ATOM 84954 H1 WAT 8819 131.631 100.876 -0.111 1.00 0.00 H ATOM 84955 H2 WAT 8819 132.561 101.879 0.536 1.00 0.00 H TER 84957 WAT 8819 ATOM 84957 O WAT 8820 34.779 98.897 9.632 1.00 0.00 O ATOM 84958 H1 WAT 8820 34.451 98.916 10.531 1.00 0.00 H ATOM 84959 H2 WAT 8820 35.290 98.089 9.581 1.00 0.00 H TER 84961 WAT 8820 ATOM 84961 O WAT 8821 130.216 18.857 105.548 1.00 0.00 O ATOM 84962 H1 WAT 8821 130.480 19.394 104.800 1.00 0.00 H ATOM 84963 H2 WAT 8821 129.589 18.232 105.184 1.00 0.00 H TER 84965 WAT 8821 ATOM 84965 O WAT 8822 56.668 109.734 130.414 1.00 0.00 O ATOM 84966 H1 WAT 8822 56.315 109.832 131.298 1.00 0.00 H ATOM 84967 H2 WAT 8822 57.400 110.349 130.379 1.00 0.00 H TER 84969 WAT 8822 ATOM 84969 O WAT 8823 56.467 144.679 145.879 1.00 0.00 O ATOM 84970 H1 WAT 8823 57.320 144.304 145.661 1.00 0.00 H ATOM 84971 H2 WAT 8823 56.236 144.277 146.716 1.00 0.00 H TER 84973 WAT 8823 ATOM 84973 O WAT 8824 135.699 34.396 1.276 1.00 0.00 O ATOM 84974 H1 WAT 8824 136.089 33.531 1.399 1.00 0.00 H ATOM 84975 H2 WAT 8824 136.067 34.928 1.981 1.00 0.00 H TER 84977 WAT 8824 ATOM 84977 O WAT 8825 9.637 74.654 64.070 1.00 0.00 O ATOM 84978 H1 WAT 8825 9.193 75.157 63.386 1.00 0.00 H ATOM 84979 H2 WAT 8825 10.396 74.271 63.631 1.00 0.00 H TER 84981 WAT 8825 ATOM 84981 O WAT 8826 53.545 138.838 63.195 1.00 0.00 O ATOM 84982 H1 WAT 8826 53.583 139.191 64.084 1.00 0.00 H ATOM 84983 H2 WAT 8826 52.644 138.529 63.098 1.00 0.00 H TER 84985 WAT 8826 ATOM 84985 O WAT 8827 74.111 43.573 144.577 1.00 0.00 O ATOM 84986 H1 WAT 8827 74.995 43.922 144.690 1.00 0.00 H ATOM 84987 H2 WAT 8827 73.630 44.275 144.139 1.00 0.00 H TER 84989 WAT 8827 ATOM 84989 O WAT 8828 51.401 60.889 15.825 1.00 0.00 O ATOM 84990 H1 WAT 8828 52.137 60.397 15.460 1.00 0.00 H ATOM 84991 H2 WAT 8828 51.729 61.784 15.908 1.00 0.00 H TER 84993 WAT 8828 ATOM 84993 O WAT 8829 124.068 117.622 148.535 1.00 0.00 O ATOM 84994 H1 WAT 8829 123.117 117.545 148.616 1.00 0.00 H ATOM 84995 H2 WAT 8829 124.407 117.275 149.360 1.00 0.00 H TER 84997 WAT 8829 ATOM 84997 O WAT 8830 76.391 32.749 108.120 1.00 0.00 O ATOM 84998 H1 WAT 8830 76.366 33.472 108.746 1.00 0.00 H ATOM 84999 H2 WAT 8830 77.041 33.017 107.470 1.00 0.00 H TER 85001 WAT 8830 ATOM 85001 O WAT 8831 57.658 27.387 156.299 1.00 0.00 O ATOM 85002 H1 WAT 8831 57.505 27.435 155.355 1.00 0.00 H ATOM 85003 H2 WAT 8831 57.251 26.562 156.565 1.00 0.00 H TER 85005 WAT 8831 ATOM 85005 O WAT 8832 138.264 41.664 2.502 1.00 0.00 O ATOM 85006 H1 WAT 8832 138.303 40.710 2.567 1.00 0.00 H ATOM 85007 H2 WAT 8832 138.800 41.976 3.231 1.00 0.00 H TER 85009 WAT 8832 ATOM 85009 O WAT 8833 142.120 53.726 117.471 1.00 0.00 O ATOM 85010 H1 WAT 8833 141.627 53.812 116.655 1.00 0.00 H ATOM 85011 H2 WAT 8833 141.665 54.301 118.087 1.00 0.00 H TER 85013 WAT 8833 ATOM 85013 O WAT 8834 32.245 143.932 148.021 1.00 0.00 O ATOM 85014 H1 WAT 8834 32.446 144.528 147.299 1.00 0.00 H ATOM 85015 H2 WAT 8834 32.367 143.058 147.651 1.00 0.00 H TER 85017 WAT 8834 ATOM 85017 O WAT 8835 112.482 60.457 105.673 1.00 0.00 O ATOM 85018 H1 WAT 8835 113.244 60.018 106.049 1.00 0.00 H ATOM 85019 H2 WAT 8835 111.750 60.182 106.225 1.00 0.00 H TER 85021 WAT 8835 ATOM 85021 O WAT 8836 68.986 49.030 139.048 1.00 0.00 O ATOM 85022 H1 WAT 8836 69.316 49.468 139.832 1.00 0.00 H ATOM 85023 H2 WAT 8836 69.007 48.099 139.267 1.00 0.00 H TER 85025 WAT 8836 ATOM 85025 O WAT 8837 64.384 52.483 4.531 1.00 0.00 O ATOM 85026 H1 WAT 8837 64.057 53.375 4.645 1.00 0.00 H ATOM 85027 H2 WAT 8837 64.744 52.249 5.387 1.00 0.00 H TER 85029 WAT 8837 ATOM 85029 O WAT 8838 109.665 6.565 114.318 1.00 0.00 O ATOM 85030 H1 WAT 8838 108.711 6.597 114.241 1.00 0.00 H ATOM 85031 H2 WAT 8838 109.948 7.467 114.171 1.00 0.00 H TER 85033 WAT 8838 ATOM 85033 O WAT 8839 123.626 73.742 4.592 1.00 0.00 O ATOM 85034 H1 WAT 8839 124.527 74.015 4.416 1.00 0.00 H ATOM 85035 H2 WAT 8839 123.097 74.261 3.987 1.00 0.00 H TER 85037 WAT 8839 ATOM 85037 O WAT 8840 30.518 77.555 81.539 1.00 0.00 O ATOM 85038 H1 WAT 8840 30.325 78.483 81.406 1.00 0.00 H ATOM 85039 H2 WAT 8840 29.667 77.159 81.727 1.00 0.00 H TER 85041 WAT 8840 ATOM 85041 O WAT 8841 90.487 141.842 118.358 1.00 0.00 O ATOM 85042 H1 WAT 8841 90.756 141.830 119.277 1.00 0.00 H ATOM 85043 H2 WAT 8841 89.550 141.647 118.381 1.00 0.00 H TER 85045 WAT 8841 ATOM 85045 O WAT 8842 57.292 112.858 14.682 1.00 0.00 O ATOM 85046 H1 WAT 8842 58.184 113.205 14.669 1.00 0.00 H ATOM 85047 H2 WAT 8842 56.965 113.071 15.557 1.00 0.00 H TER 85049 WAT 8842 ATOM 85049 O WAT 8843 93.242 80.528 64.018 1.00 0.00 O ATOM 85050 H1 WAT 8843 93.956 81.151 64.157 1.00 0.00 H ATOM 85051 H2 WAT 8843 93.184 80.439 63.067 1.00 0.00 H TER 85053 WAT 8843 ATOM 85053 O WAT 8844 24.754 142.434 26.326 1.00 0.00 O ATOM 85054 H1 WAT 8844 24.274 141.842 26.906 1.00 0.00 H ATOM 85055 H2 WAT 8844 24.243 143.243 26.334 1.00 0.00 H TER 85057 WAT 8844 ATOM 85057 O WAT 8845 26.773 127.264 11.310 1.00 0.00 O ATOM 85058 H1 WAT 8845 26.002 127.283 10.744 1.00 0.00 H ATOM 85059 H2 WAT 8845 27.511 127.170 10.707 1.00 0.00 H TER 85061 WAT 8845 ATOM 85061 O WAT 8846 2.117 129.197 14.566 1.00 0.00 O ATOM 85062 H1 WAT 8846 2.178 128.423 14.007 1.00 0.00 H ATOM 85063 H2 WAT 8846 2.501 129.901 14.043 1.00 0.00 H TER 85065 WAT 8846 ATOM 85065 O WAT 8847 0.340 81.937 144.460 1.00 0.00 O ATOM 85066 H1 WAT 8847 1.188 81.904 144.903 1.00 0.00 H ATOM 85067 H2 WAT 8847 0.350 82.769 143.987 1.00 0.00 H TER 85069 WAT 8847 ATOM 85069 O WAT 8848 2.486 139.834 11.985 1.00 0.00 O ATOM 85070 H1 WAT 8848 1.588 140.060 11.740 1.00 0.00 H ATOM 85071 H2 WAT 8848 2.392 139.072 12.558 1.00 0.00 H TER 85073 WAT 8848 ATOM 85073 O WAT 8849 106.021 106.510 60.960 1.00 0.00 O ATOM 85074 H1 WAT 8849 106.270 106.010 60.182 1.00 0.00 H ATOM 85075 H2 WAT 8849 106.729 107.143 61.076 1.00 0.00 H TER 85077 WAT 8849 ATOM 85077 O WAT 8850 112.799 70.357 21.593 1.00 0.00 O ATOM 85078 H1 WAT 8850 112.715 70.542 22.529 1.00 0.00 H ATOM 85079 H2 WAT 8850 112.577 69.430 21.512 1.00 0.00 H TER 85081 WAT 8850 ATOM 85081 O WAT 8851 97.324 128.150 76.861 1.00 0.00 O ATOM 85082 H1 WAT 8851 96.917 128.583 77.611 1.00 0.00 H ATOM 85083 H2 WAT 8851 97.874 128.825 76.463 1.00 0.00 H TER 85085 WAT 8851 ATOM 85085 O WAT 8852 135.249 43.463 85.035 1.00 0.00 O ATOM 85086 H1 WAT 8852 134.798 42.690 85.374 1.00 0.00 H ATOM 85087 H2 WAT 8852 134.674 43.794 84.346 1.00 0.00 H TER 85089 WAT 8852 ATOM 85089 O WAT 8853 106.894 108.801 103.310 1.00 0.00 O ATOM 85090 H1 WAT 8853 107.521 108.659 104.019 1.00 0.00 H ATOM 85091 H2 WAT 8853 106.151 109.234 103.730 1.00 0.00 H TER 85093 WAT 8853 ATOM 85093 O WAT 8854 9.276 139.800 16.736 1.00 0.00 O ATOM 85094 H1 WAT 8854 9.535 140.722 16.747 1.00 0.00 H ATOM 85095 H2 WAT 8854 9.060 139.600 17.647 1.00 0.00 H TER 85097 WAT 8854 ATOM 85097 O WAT 8855 128.618 75.747 89.872 1.00 0.00 O ATOM 85098 H1 WAT 8855 128.582 74.793 89.809 1.00 0.00 H ATOM 85099 H2 WAT 8855 128.705 75.923 90.809 1.00 0.00 H TER 85101 WAT 8855 ATOM 85101 O WAT 8856 134.339 0.891 113.433 1.00 0.00 O ATOM 85102 H1 WAT 8856 134.718 1.636 113.900 1.00 0.00 H ATOM 85103 H2 WAT 8856 133.475 0.775 113.829 1.00 0.00 H TER 85105 WAT 8856 ATOM 85105 O WAT 8857 75.073 4.332 4.178 1.00 0.00 O ATOM 85106 H1 WAT 8857 75.329 4.607 3.297 1.00 0.00 H ATOM 85107 H2 WAT 8857 75.851 3.899 4.529 1.00 0.00 H TER 85109 WAT 8857 ATOM 85109 O WAT 8858 45.075 34.837 116.347 1.00 0.00 O ATOM 85110 H1 WAT 8858 44.874 35.058 115.437 1.00 0.00 H ATOM 85111 H2 WAT 8858 46.003 34.603 116.336 1.00 0.00 H TER 85113 WAT 8858 ATOM 85113 O WAT 8859 144.233 36.862 103.228 1.00 0.00 O ATOM 85114 H1 WAT 8859 144.059 37.656 102.722 1.00 0.00 H ATOM 85115 H2 WAT 8859 144.299 37.164 104.133 1.00 0.00 H TER 85117 WAT 8859 ATOM 85117 O WAT 8860 7.211 85.168 94.814 1.00 0.00 O ATOM 85118 H1 WAT 8860 6.822 84.294 94.830 1.00 0.00 H ATOM 85119 H2 WAT 8860 7.575 85.284 95.692 1.00 0.00 H TER 85121 WAT 8860 ATOM 85121 O WAT 8861 106.687 37.070 83.636 1.00 0.00 O ATOM 85122 H1 WAT 8861 106.251 37.042 84.487 1.00 0.00 H ATOM 85123 H2 WAT 8861 106.267 36.375 83.129 1.00 0.00 H TER 85125 WAT 8861 ATOM 85125 O WAT 8862 125.123 133.420 151.086 1.00 0.00 O ATOM 85126 H1 WAT 8862 124.757 132.645 150.660 1.00 0.00 H ATOM 85127 H2 WAT 8862 124.422 134.071 151.043 1.00 0.00 H TER 85129 WAT 8862 ATOM 85129 O WAT 8863 98.482 130.867 136.267 1.00 0.00 O ATOM 85130 H1 WAT 8863 98.285 131.278 137.109 1.00 0.00 H ATOM 85131 H2 WAT 8863 98.104 131.461 135.617 1.00 0.00 H TER 85133 WAT 8863 ATOM 85133 O WAT 8864 121.366 17.250 131.321 1.00 0.00 O ATOM 85134 H1 WAT 8864 120.728 16.711 131.788 1.00 0.00 H ATOM 85135 H2 WAT 8864 120.866 17.649 130.608 1.00 0.00 H TER 85137 WAT 8864 ATOM 85137 O WAT 8865 7.988 30.231 20.252 1.00 0.00 O ATOM 85138 H1 WAT 8865 7.075 30.485 20.122 1.00 0.00 H ATOM 85139 H2 WAT 8865 8.051 30.032 21.186 1.00 0.00 H TER 85141 WAT 8865 ATOM 85141 O WAT 8866 73.624 29.170 120.340 1.00 0.00 O ATOM 85142 H1 WAT 8866 72.739 29.107 119.981 1.00 0.00 H ATOM 85143 H2 WAT 8866 73.615 29.974 120.859 1.00 0.00 H TER 85145 WAT 8866 ATOM 85145 O WAT 8867 37.584 8.734 109.842 1.00 0.00 O ATOM 85146 H1 WAT 8867 36.661 8.664 110.088 1.00 0.00 H ATOM 85147 H2 WAT 8867 37.630 8.334 108.973 1.00 0.00 H TER 85149 WAT 8867 ATOM 85149 O WAT 8868 29.057 118.812 142.360 1.00 0.00 O ATOM 85150 H1 WAT 8868 29.896 118.351 142.387 1.00 0.00 H ATOM 85151 H2 WAT 8868 28.614 118.549 143.167 1.00 0.00 H TER 85153 WAT 8868 ATOM 85153 O WAT 8869 54.607 42.971 127.353 1.00 0.00 O ATOM 85154 H1 WAT 8869 53.807 42.907 126.831 1.00 0.00 H ATOM 85155 H2 WAT 8869 54.833 42.064 127.558 1.00 0.00 H TER 85157 WAT 8869 ATOM 85157 O WAT 8870 79.704 31.661 67.411 1.00 0.00 O ATOM 85158 H1 WAT 8870 80.497 31.966 66.971 1.00 0.00 H ATOM 85159 H2 WAT 8870 79.816 30.713 67.477 1.00 0.00 H TER 85161 WAT 8870 ATOM 85161 O WAT 8871 97.644 92.662 66.987 1.00 0.00 O ATOM 85162 H1 WAT 8871 97.802 93.594 67.135 1.00 0.00 H ATOM 85163 H2 WAT 8871 98.028 92.229 67.750 1.00 0.00 H TER 85165 WAT 8871 ATOM 85165 O WAT 8872 106.656 55.033 81.833 1.00 0.00 O ATOM 85166 H1 WAT 8872 106.790 55.507 82.654 1.00 0.00 H ATOM 85167 H2 WAT 8872 107.468 55.168 81.344 1.00 0.00 H TER 85169 WAT 8872 ATOM 85169 O WAT 8873 81.527 63.784 106.543 1.00 0.00 O ATOM 85170 H1 WAT 8873 81.265 63.396 105.709 1.00 0.00 H ATOM 85171 H2 WAT 8873 81.028 64.600 106.595 1.00 0.00 H TER 85173 WAT 8873 ATOM 85173 O WAT 8874 49.515 15.640 5.712 1.00 0.00 O ATOM 85174 H1 WAT 8874 50.010 14.822 5.756 1.00 0.00 H ATOM 85175 H2 WAT 8874 48.703 15.454 6.184 1.00 0.00 H TER 85177 WAT 8874 ATOM 85177 O WAT 8875 3.120 87.663 66.245 1.00 0.00 O ATOM 85178 H1 WAT 8875 4.052 87.789 66.425 1.00 0.00 H ATOM 85179 H2 WAT 8875 2.870 86.915 66.787 1.00 0.00 H TER 85181 WAT 8875 ATOM 85181 O WAT 8876 89.131 88.956 62.676 1.00 0.00 O ATOM 85182 H1 WAT 8876 88.565 89.082 61.914 1.00 0.00 H ATOM 85183 H2 WAT 8876 89.643 88.174 62.467 1.00 0.00 H TER 85185 WAT 8876 ATOM 85185 O WAT 8877 139.668 106.588 116.289 1.00 0.00 O ATOM 85186 H1 WAT 8877 139.670 107.289 116.941 1.00 0.00 H ATOM 85187 H2 WAT 8877 140.232 105.912 116.664 1.00 0.00 H TER 85189 WAT 8877 ATOM 85189 O WAT 8878 144.527 86.702 23.947 1.00 0.00 O ATOM 85190 H1 WAT 8878 144.473 87.155 23.106 1.00 0.00 H ATOM 85191 H2 WAT 8878 145.281 87.097 24.385 1.00 0.00 H TER 85193 WAT 8878 ATOM 85193 O WAT 8879 130.365 130.655 74.938 1.00 0.00 O ATOM 85194 H1 WAT 8879 129.740 131.044 74.327 1.00 0.00 H ATOM 85195 H2 WAT 8879 130.899 131.392 75.236 1.00 0.00 H TER 85197 WAT 8879 ATOM 85197 O WAT 8880 100.612 5.247 149.185 1.00 0.00 O ATOM 85198 H1 WAT 8880 101.218 5.096 148.459 1.00 0.00 H ATOM 85199 H2 WAT 8880 99.758 4.987 148.841 1.00 0.00 H TER 85201 WAT 8880 ATOM 85201 O WAT 8881 31.773 48.099 113.696 1.00 0.00 O ATOM 85202 H1 WAT 8881 32.305 48.482 114.393 1.00 0.00 H ATOM 85203 H2 WAT 8881 32.367 48.036 112.948 1.00 0.00 H TER 85205 WAT 8881 ATOM 85205 O WAT 8882 128.132 123.045 116.364 1.00 0.00 O ATOM 85206 H1 WAT 8882 127.835 122.622 117.169 1.00 0.00 H ATOM 85207 H2 WAT 8882 128.985 122.648 116.186 1.00 0.00 H TER 85209 WAT 8882 ATOM 85209 O WAT 8883 12.139 33.872 127.845 1.00 0.00 O ATOM 85210 H1 WAT 8883 12.045 34.355 127.023 1.00 0.00 H ATOM 85211 H2 WAT 8883 12.328 34.546 128.498 1.00 0.00 H TER 85213 WAT 8883 ATOM 85213 O WAT 8884 136.069 23.127 11.019 1.00 0.00 O ATOM 85214 H1 WAT 8884 135.675 22.265 11.155 1.00 0.00 H ATOM 85215 H2 WAT 8884 135.549 23.717 11.565 1.00 0.00 H TER 85217 WAT 8884 ATOM 85217 O WAT 8885 40.090 120.558 138.772 1.00 0.00 O ATOM 85218 H1 WAT 8885 41.004 120.528 139.055 1.00 0.00 H ATOM 85219 H2 WAT 8885 40.129 120.428 137.824 1.00 0.00 H TER 85221 WAT 8885 ATOM 85221 O WAT 8886 42.748 18.930 132.662 1.00 0.00 O ATOM 85222 H1 WAT 8886 42.046 19.516 132.946 1.00 0.00 H ATOM 85223 H2 WAT 8886 42.649 18.153 133.212 1.00 0.00 H TER 85225 WAT 8886 ATOM 85225 O WAT 8887 108.367 71.278 13.839 1.00 0.00 O ATOM 85226 H1 WAT 8887 108.276 72.185 13.545 1.00 0.00 H ATOM 85227 H2 WAT 8887 109.256 71.032 13.585 1.00 0.00 H TER 85229 WAT 8887 ATOM 85229 O WAT 8888 0.681 62.357 8.810 1.00 0.00 O ATOM 85230 H1 WAT 8888 0.301 62.386 7.932 1.00 0.00 H ATOM 85231 H2 WAT 8888 1.594 62.108 8.667 1.00 0.00 H TER 85233 WAT 8888 ATOM 85233 O WAT 8889 93.048 48.345 96.964 1.00 0.00 O ATOM 85234 H1 WAT 8889 93.334 49.256 97.030 1.00 0.00 H ATOM 85235 H2 WAT 8889 92.391 48.249 97.654 1.00 0.00 H TER 85237 WAT 8889 ATOM 85237 O WAT 8890 63.671 48.190 19.840 1.00 0.00 O ATOM 85238 H1 WAT 8890 62.767 47.910 19.693 1.00 0.00 H ATOM 85239 H2 WAT 8890 63.685 48.486 20.750 1.00 0.00 H TER 85241 WAT 8890 ATOM 85241 O WAT 8891 113.851 13.886 152.189 1.00 0.00 O ATOM 85242 H1 WAT 8891 114.274 14.725 152.007 1.00 0.00 H ATOM 85243 H2 WAT 8891 113.386 14.027 153.014 1.00 0.00 H TER 85245 WAT 8891 ATOM 85245 O WAT 8892 143.152 77.979 80.699 1.00 0.00 O ATOM 85246 H1 WAT 8892 143.577 78.467 81.404 1.00 0.00 H ATOM 85247 H2 WAT 8892 143.778 78.007 79.976 1.00 0.00 H TER 85249 WAT 8892 ATOM 85249 O WAT 8893 90.002 128.719 97.248 1.00 0.00 O ATOM 85250 H1 WAT 8893 90.783 129.273 97.281 1.00 0.00 H ATOM 85251 H2 WAT 8893 90.292 127.876 97.596 1.00 0.00 H TER 85253 WAT 8893 ATOM 85253 O WAT 8894 115.899 49.208 130.615 1.00 0.00 O ATOM 85254 H1 WAT 8894 115.390 49.108 131.419 1.00 0.00 H ATOM 85255 H2 WAT 8894 115.874 48.342 130.206 1.00 0.00 H TER 85257 WAT 8894 ATOM 85257 O WAT 8895 113.986 88.765 69.743 1.00 0.00 O ATOM 85258 H1 WAT 8895 113.523 89.062 68.960 1.00 0.00 H ATOM 85259 H2 WAT 8895 114.558 89.496 69.975 1.00 0.00 H TER 85261 WAT 8895 ATOM 85261 O WAT 8896 27.310 73.537 106.613 1.00 0.00 O ATOM 85262 H1 WAT 8896 27.202 72.718 107.096 1.00 0.00 H ATOM 85263 H2 WAT 8896 26.525 74.044 106.822 1.00 0.00 H TER 85265 WAT 8896 ATOM 85265 O WAT 8897 37.059 25.539 75.215 1.00 0.00 O ATOM 85266 H1 WAT 8897 37.533 24.803 74.829 1.00 0.00 H ATOM 85267 H2 WAT 8897 36.930 25.289 76.130 1.00 0.00 H TER 85269 WAT 8897 ATOM 85269 O WAT 8898 90.890 52.738 139.668 1.00 0.00 O ATOM 85270 H1 WAT 8898 91.565 53.242 140.121 1.00 0.00 H ATOM 85271 H2 WAT 8898 91.250 52.585 138.794 1.00 0.00 H TER 85273 WAT 8898 ATOM 85273 O WAT 8899 44.238 64.279 75.004 1.00 0.00 O ATOM 85274 H1 WAT 8899 43.837 63.448 74.749 1.00 0.00 H ATOM 85275 H2 WAT 8899 45.125 64.044 75.277 1.00 0.00 H TER 85277 WAT 8899 ATOM 85277 O WAT 8900 48.863 39.303 127.620 1.00 0.00 O ATOM 85278 H1 WAT 8900 48.658 38.452 127.234 1.00 0.00 H ATOM 85279 H2 WAT 8900 49.816 39.367 127.570 1.00 0.00 H TER 85281 WAT 8900 ATOM 85281 O WAT 8901 117.132 43.828 90.840 1.00 0.00 O ATOM 85282 H1 WAT 8901 117.992 43.918 91.250 1.00 0.00 H ATOM 85283 H2 WAT 8901 116.696 44.663 91.010 1.00 0.00 H TER 85285 WAT 8901 ATOM 85285 O WAT 8902 86.816 118.193 139.285 1.00 0.00 O ATOM 85286 H1 WAT 8902 87.473 117.878 138.663 1.00 0.00 H ATOM 85287 H2 WAT 8902 87.315 118.704 139.922 1.00 0.00 H TER 85289 WAT 8902 ATOM 85289 O WAT 8903 85.216 30.070 104.671 1.00 0.00 O ATOM 85290 H1 WAT 8903 85.940 29.596 105.081 1.00 0.00 H ATOM 85291 H2 WAT 8903 84.839 29.444 104.053 1.00 0.00 H TER 85293 WAT 8903 ATOM 85293 O WAT 8904 74.790 44.804 103.322 1.00 0.00 O ATOM 85294 H1 WAT 8904 75.251 44.809 104.161 1.00 0.00 H ATOM 85295 H2 WAT 8904 74.536 45.716 103.183 1.00 0.00 H TER 85297 WAT 8904 ATOM 85297 O WAT 8905 58.508 18.192 19.300 1.00 0.00 O ATOM 85298 H1 WAT 8905 57.695 18.630 19.551 1.00 0.00 H ATOM 85299 H2 WAT 8905 59.059 18.245 20.081 1.00 0.00 H TER 85301 WAT 8905 ATOM 85301 O WAT 8906 40.853 23.413 149.226 1.00 0.00 O ATOM 85302 H1 WAT 8906 40.775 24.164 149.815 1.00 0.00 H ATOM 85303 H2 WAT 8906 41.546 23.660 148.614 1.00 0.00 H TER 85305 WAT 8906 ATOM 85305 O WAT 8907 135.825 108.215 61.291 1.00 0.00 O ATOM 85306 H1 WAT 8907 135.289 107.776 61.951 1.00 0.00 H ATOM 85307 H2 WAT 8907 136.489 107.569 61.052 1.00 0.00 H TER 85309 WAT 8907 ATOM 85309 O WAT 8908 84.541 78.001 113.666 1.00 0.00 O ATOM 85310 H1 WAT 8908 85.452 77.942 113.954 1.00 0.00 H ATOM 85311 H2 WAT 8908 84.207 78.794 114.085 1.00 0.00 H TER 85313 WAT 8908 ATOM 85313 O WAT 8909 130.977 42.624 118.465 1.00 0.00 O ATOM 85314 H1 WAT 8909 131.599 42.799 119.172 1.00 0.00 H ATOM 85315 H2 WAT 8909 131.527 42.475 117.696 1.00 0.00 H TER 85317 WAT 8909 ATOM 85317 O WAT 8910 130.512 74.784 7.595 1.00 0.00 O ATOM 85318 H1 WAT 8910 131.047 74.224 7.033 1.00 0.00 H ATOM 85319 H2 WAT 8910 130.659 74.447 8.479 1.00 0.00 H TER 85321 WAT 8910 ATOM 85321 O WAT 8911 105.787 74.709 107.834 1.00 0.00 O ATOM 85322 H1 WAT 8911 105.581 74.065 107.157 1.00 0.00 H ATOM 85323 H2 WAT 8911 105.708 74.226 108.657 1.00 0.00 H TER 85325 WAT 8911 ATOM 85325 O WAT 8912 7.452 56.450 147.989 1.00 0.00 O ATOM 85326 H1 WAT 8912 7.949 56.628 148.787 1.00 0.00 H ATOM 85327 H2 WAT 8912 7.878 56.982 147.317 1.00 0.00 H TER 85329 WAT 8912 ATOM 85329 O WAT 8913 22.085 102.942 125.965 1.00 0.00 O ATOM 85330 H1 WAT 8913 22.083 102.147 126.498 1.00 0.00 H ATOM 85331 H2 WAT 8913 22.708 102.758 125.262 1.00 0.00 H TER 85333 WAT 8913 ATOM 85333 O WAT 8914 15.930 93.966 71.587 1.00 0.00 O ATOM 85334 H1 WAT 8914 16.245 93.066 71.504 1.00 0.00 H ATOM 85335 H2 WAT 8914 16.156 94.217 72.482 1.00 0.00 H TER 85337 WAT 8914 ATOM 85337 O WAT 8915 33.369 81.496 100.584 1.00 0.00 O ATOM 85338 H1 WAT 8915 33.083 81.056 101.385 1.00 0.00 H ATOM 85339 H2 WAT 8915 32.816 82.274 100.528 1.00 0.00 H TER 85341 WAT 8915 ATOM 85341 O WAT 8916 3.081 137.073 154.098 1.00 0.00 O ATOM 85342 H1 WAT 8916 3.696 137.174 153.371 1.00 0.00 H ATOM 85343 H2 WAT 8916 3.580 137.335 154.872 1.00 0.00 H TER 85345 WAT 8916 ATOM 85345 O WAT 8917 75.487 98.726 86.548 1.00 0.00 O ATOM 85346 H1 WAT 8917 76.200 98.360 87.073 1.00 0.00 H ATOM 85347 H2 WAT 8917 74.752 98.795 87.158 1.00 0.00 H TER 85349 WAT 8917 ATOM 85349 O WAT 8918 95.958 90.056 82.758 1.00 0.00 O ATOM 85350 H1 WAT 8918 95.146 90.307 82.317 1.00 0.00 H ATOM 85351 H2 WAT 8918 95.874 89.112 82.894 1.00 0.00 H TER 85353 WAT 8918 ATOM 85353 O WAT 8919 49.214 11.966 138.898 1.00 0.00 O ATOM 85354 H1 WAT 8919 48.692 11.173 138.776 1.00 0.00 H ATOM 85355 H2 WAT 8919 49.251 12.085 139.847 1.00 0.00 H TER 85357 WAT 8919 ATOM 85357 O WAT 8920 127.908 47.462 146.482 1.00 0.00 O ATOM 85358 H1 WAT 8920 127.391 48.255 146.338 1.00 0.00 H ATOM 85359 H2 WAT 8920 127.308 46.745 146.279 1.00 0.00 H TER 85361 WAT 8920 ATOM 85361 O WAT 8921 136.355 68.759 137.914 1.00 0.00 O ATOM 85362 H1 WAT 8921 136.875 68.220 138.509 1.00 0.00 H ATOM 85363 H2 WAT 8921 135.918 69.392 138.484 1.00 0.00 H TER 85365 WAT 8921 ATOM 85365 O WAT 8922 68.005 6.624 18.957 1.00 0.00 O ATOM 85366 H1 WAT 8922 67.787 6.137 18.162 1.00 0.00 H ATOM 85367 H2 WAT 8922 67.913 7.543 18.708 1.00 0.00 H TER 85369 WAT 8922 ATOM 85369 O WAT 8923 132.012 100.191 82.810 1.00 0.00 O ATOM 85370 H1 WAT 8923 131.675 99.368 82.454 1.00 0.00 H ATOM 85371 H2 WAT 8923 132.928 100.214 82.532 1.00 0.00 H TER 85373 WAT 8923 ATOM 85373 O WAT 8924 12.137 46.579 13.994 1.00 0.00 O ATOM 85374 H1 WAT 8924 12.267 46.167 13.140 1.00 0.00 H ATOM 85375 H2 WAT 8924 11.650 47.380 13.801 1.00 0.00 H TER 85377 WAT 8924 ATOM 85377 O WAT 8925 57.038 90.622 20.708 1.00 0.00 O ATOM 85378 H1 WAT 8925 57.644 91.320 20.458 1.00 0.00 H ATOM 85379 H2 WAT 8925 57.014 90.657 21.664 1.00 0.00 H TER 85381 WAT 8925 ATOM 85381 O WAT 8926 39.127 55.969 130.310 1.00 0.00 O ATOM 85382 H1 WAT 8926 38.565 55.630 129.613 1.00 0.00 H ATOM 85383 H2 WAT 8926 38.523 56.401 130.914 1.00 0.00 H TER 85385 WAT 8926 ATOM 85385 O WAT 8927 115.565 47.014 0.891 1.00 0.00 O ATOM 85386 H1 WAT 8927 114.943 46.689 0.241 1.00 0.00 H ATOM 85387 H2 WAT 8927 116.311 46.417 0.829 1.00 0.00 H TER 85389 WAT 8927 ATOM 85389 O WAT 8928 45.285 135.095 73.819 1.00 0.00 O ATOM 85390 H1 WAT 8928 44.982 135.517 74.623 1.00 0.00 H ATOM 85391 H2 WAT 8928 45.585 135.818 73.268 1.00 0.00 H TER 85393 WAT 8928 ATOM 85393 O WAT 8929 107.378 12.645 153.866 1.00 0.00 O ATOM 85394 H1 WAT 8929 108.046 13.194 153.455 1.00 0.00 H ATOM 85395 H2 WAT 8929 107.842 11.843 154.107 1.00 0.00 H TER 85397 WAT 8929 ATOM 85397 O WAT 8930 61.328 62.951 129.799 1.00 0.00 O ATOM 85398 H1 WAT 8930 61.289 63.899 129.673 1.00 0.00 H ATOM 85399 H2 WAT 8930 60.917 62.587 129.015 1.00 0.00 H TER 85401 WAT 8930 ATOM 85401 O WAT 8931 70.182 27.650 88.998 1.00 0.00 O ATOM 85402 H1 WAT 8931 69.329 27.218 89.025 1.00 0.00 H ATOM 85403 H2 WAT 8931 70.286 28.028 89.872 1.00 0.00 H TER 85405 WAT 8931 ATOM 85405 O WAT 8932 85.529 14.933 108.211 1.00 0.00 O ATOM 85406 H1 WAT 8932 85.425 14.592 109.099 1.00 0.00 H ATOM 85407 H2 WAT 8932 86.277 14.453 107.856 1.00 0.00 H TER 85409 WAT 8932 ATOM 85409 O WAT 8933 142.380 51.060 135.550 1.00 0.00 O ATOM 85410 H1 WAT 8933 141.423 51.019 135.533 1.00 0.00 H ATOM 85411 H2 WAT 8933 142.610 50.884 136.463 1.00 0.00 H TER 85413 WAT 8933 ATOM 85413 O WAT 8934 94.055 3.210 82.501 1.00 0.00 O ATOM 85414 H1 WAT 8934 94.480 3.707 81.802 1.00 0.00 H ATOM 85415 H2 WAT 8934 94.149 2.295 82.237 1.00 0.00 H TER 85417 WAT 8934 ATOM 85417 O WAT 8935 112.451 96.010 8.387 1.00 0.00 O ATOM 85418 H1 WAT 8935 112.651 95.184 8.826 1.00 0.00 H ATOM 85419 H2 WAT 8935 113.124 96.616 8.698 1.00 0.00 H TER 85421 WAT 8935 ATOM 85421 O WAT 8936 10.753 6.728 115.104 1.00 0.00 O ATOM 85422 H1 WAT 8936 10.629 7.576 115.532 1.00 0.00 H ATOM 85423 H2 WAT 8936 11.682 6.532 115.225 1.00 0.00 H TER 85425 WAT 8936 ATOM 85425 O WAT 8937 9.329 85.470 112.889 1.00 0.00 O ATOM 85426 H1 WAT 8937 10.150 85.789 113.264 1.00 0.00 H ATOM 85427 H2 WAT 8937 9.440 84.521 112.843 1.00 0.00 H TER 85429 WAT 8937 ATOM 85429 O WAT 8938 126.296 43.365 74.492 1.00 0.00 O ATOM 85430 H1 WAT 8938 126.482 42.818 73.729 1.00 0.00 H ATOM 85431 H2 WAT 8938 126.429 42.785 75.242 1.00 0.00 H TER 85433 WAT 8938 ATOM 85433 O WAT 8939 102.377 39.433 10.657 1.00 0.00 O ATOM 85434 H1 WAT 8939 103.121 38.856 10.481 1.00 0.00 H ATOM 85435 H2 WAT 8939 102.268 39.400 11.607 1.00 0.00 H TER 85437 WAT 8939 ATOM 85437 O WAT 8940 110.153 73.410 74.142 1.00 0.00 O ATOM 85438 H1 WAT 8940 109.368 72.894 73.960 1.00 0.00 H ATOM 85439 H2 WAT 8940 110.047 74.202 73.615 1.00 0.00 H TER 85441 WAT 8940 ATOM 85441 O WAT 8941 90.764 96.841 63.424 1.00 0.00 O ATOM 85442 H1 WAT 8941 91.622 96.547 63.728 1.00 0.00 H ATOM 85443 H2 WAT 8941 90.952 97.365 62.645 1.00 0.00 H TER 85445 WAT 8941 ATOM 85445 O WAT 8942 70.988 63.649 68.499 1.00 0.00 O ATOM 85446 H1 WAT 8942 70.256 63.053 68.341 1.00 0.00 H ATOM 85447 H2 WAT 8942 70.698 64.486 68.135 1.00 0.00 H TER 85449 WAT 8942 ATOM 85449 O WAT 8943 34.638 21.409 119.733 1.00 0.00 O ATOM 85450 H1 WAT 8943 34.039 20.903 119.184 1.00 0.00 H ATOM 85451 H2 WAT 8943 34.723 22.249 119.282 1.00 0.00 H TER 85453 WAT 8943 ATOM 85453 O WAT 8944 66.184 65.021 7.617 1.00 0.00 O ATOM 85454 H1 WAT 8944 65.945 65.136 6.697 1.00 0.00 H ATOM 85455 H2 WAT 8944 66.498 65.882 7.892 1.00 0.00 H TER 85457 WAT 8944 ATOM 85457 O WAT 8945 43.547 140.684 137.057 1.00 0.00 O ATOM 85458 H1 WAT 8945 44.376 141.048 137.368 1.00 0.00 H ATOM 85459 H2 WAT 8945 43.068 140.463 137.855 1.00 0.00 H TER 85461 WAT 8945 ATOM 85461 O WAT 8946 0.721 105.114 99.845 1.00 0.00 O ATOM 85462 H1 WAT 8946 -0.101 104.636 99.740 1.00 0.00 H ATOM 85463 H2 WAT 8946 0.852 105.553 99.005 1.00 0.00 H TER 85465 WAT 8946 ATOM 85465 O WAT 8947 132.461 123.477 149.187 1.00 0.00 O ATOM 85466 H1 WAT 8947 132.633 124.295 149.653 1.00 0.00 H ATOM 85467 H2 WAT 8947 133.283 122.990 149.245 1.00 0.00 H TER 85469 WAT 8947 ATOM 85469 O WAT 8948 107.034 125.692 91.257 1.00 0.00 O ATOM 85470 H1 WAT 8948 107.613 126.386 90.943 1.00 0.00 H ATOM 85471 H2 WAT 8948 106.583 126.078 92.008 1.00 0.00 H TER 85473 WAT 8948 ATOM 85473 O WAT 8949 99.770 1.480 76.246 1.00 0.00 O ATOM 85474 H1 WAT 8949 100.514 1.942 76.633 1.00 0.00 H ATOM 85475 H2 WAT 8949 99.768 1.754 75.329 1.00 0.00 H TER 85477 WAT 8949 ATOM 85477 O WAT 8950 137.631 137.456 79.906 1.00 0.00 O ATOM 85478 H1 WAT 8950 138.327 137.443 79.249 1.00 0.00 H ATOM 85479 H2 WAT 8950 137.977 138.003 80.611 1.00 0.00 H TER 85481 WAT 8950 ATOM 85481 O WAT 8951 86.480 67.386 93.255 1.00 0.00 O ATOM 85482 H1 WAT 8951 85.959 67.338 94.056 1.00 0.00 H ATOM 85483 H2 WAT 8951 86.271 66.579 92.784 1.00 0.00 H TER 85485 WAT 8951 ATOM 85485 O WAT 8952 38.058 43.202 60.439 1.00 0.00 O ATOM 85486 H1 WAT 8952 38.187 43.853 59.749 1.00 0.00 H ATOM 85487 H2 WAT 8952 37.314 42.680 60.139 1.00 0.00 H TER 85489 WAT 8952 ATOM 85489 O WAT 8953 5.657 42.619 123.723 1.00 0.00 O ATOM 85490 H1 WAT 8953 6.496 42.169 123.630 1.00 0.00 H ATOM 85491 H2 WAT 8953 5.561 43.117 122.911 1.00 0.00 H TER 85493 WAT 8953 ATOM 85493 O WAT 8954 27.506 144.276 97.958 1.00 0.00 O ATOM 85494 H1 WAT 8954 27.718 144.793 98.735 1.00 0.00 H ATOM 85495 H2 WAT 8954 26.591 144.025 98.080 1.00 0.00 H TER 85497 WAT 8954 ATOM 85497 O WAT 8955 114.374 85.261 148.575 1.00 0.00 O ATOM 85498 H1 WAT 8955 113.465 84.988 148.450 1.00 0.00 H ATOM 85499 H2 WAT 8955 114.356 85.800 149.366 1.00 0.00 H TER 85501 WAT 8955 ATOM 85501 O WAT 8956 31.332 74.402 117.419 1.00 0.00 O ATOM 85502 H1 WAT 8956 31.782 73.829 118.040 1.00 0.00 H ATOM 85503 H2 WAT 8956 30.947 75.089 117.963 1.00 0.00 H TER 85505 WAT 8956 ATOM 85505 O WAT 8957 20.421 5.218 149.125 1.00 0.00 O ATOM 85506 H1 WAT 8957 20.489 5.501 150.037 1.00 0.00 H ATOM 85507 H2 WAT 8957 20.038 5.967 148.669 1.00 0.00 H TER 85509 WAT 8957 ATOM 85509 O WAT 8958 128.872 57.155 130.164 1.00 0.00 O ATOM 85510 H1 WAT 8958 128.256 57.452 129.494 1.00 0.00 H ATOM 85511 H2 WAT 8958 129.601 57.773 130.111 1.00 0.00 H TER 85513 WAT 8958 ATOM 85513 O WAT 8959 27.276 143.875 104.685 1.00 0.00 O ATOM 85514 H1 WAT 8959 26.767 143.971 105.490 1.00 0.00 H ATOM 85515 H2 WAT 8959 28.034 143.350 104.942 1.00 0.00 H TER 85517 WAT 8959 ATOM 85517 O WAT 8960 122.778 34.047 4.799 1.00 0.00 O ATOM 85518 H1 WAT 8960 122.308 33.316 4.397 1.00 0.00 H ATOM 85519 H2 WAT 8960 123.638 33.688 5.016 1.00 0.00 H TER 85521 WAT 8960 ATOM 85521 O WAT 8961 28.396 86.986 18.124 1.00 0.00 O ATOM 85522 H1 WAT 8961 27.605 86.832 17.608 1.00 0.00 H ATOM 85523 H2 WAT 8961 28.129 86.814 19.028 1.00 0.00 H TER 85525 WAT 8961 ATOM 85525 O WAT 8962 42.573 34.792 15.163 1.00 0.00 O ATOM 85526 H1 WAT 8962 42.639 35.583 14.629 1.00 0.00 H ATOM 85527 H2 WAT 8962 42.299 35.107 16.025 1.00 0.00 H TER 85529 WAT 8962 ATOM 85529 O WAT 8963 10.357 139.049 122.875 1.00 0.00 O ATOM 85530 H1 WAT 8963 11.249 138.989 122.534 1.00 0.00 H ATOM 85531 H2 WAT 8963 10.277 139.954 123.179 1.00 0.00 H TER 85533 WAT 8963 ATOM 85533 O WAT 8964 23.905 45.493 63.793 1.00 0.00 O ATOM 85534 H1 WAT 8964 24.333 44.662 63.586 1.00 0.00 H ATOM 85535 H2 WAT 8964 24.168 46.081 63.085 1.00 0.00 H TER 85537 WAT 8964 ATOM 85537 O WAT 8965 112.654 0.090 147.661 1.00 0.00 O ATOM 85538 H1 WAT 8965 113.158 -0.616 148.066 1.00 0.00 H ATOM 85539 H2 WAT 8965 113.315 0.705 147.344 1.00 0.00 H TER 85541 WAT 8965 ATOM 85541 O WAT 8966 71.445 30.170 146.793 1.00 0.00 O ATOM 85542 H1 WAT 8966 72.183 30.701 147.090 1.00 0.00 H ATOM 85543 H2 WAT 8966 71.498 29.371 147.318 1.00 0.00 H TER 85545 WAT 8966 ATOM 85545 O WAT 8967 19.174 86.828 88.528 1.00 0.00 O ATOM 85546 H1 WAT 8967 18.350 86.380 88.339 1.00 0.00 H ATOM 85547 H2 WAT 8967 19.419 86.521 89.401 1.00 0.00 H TER 85549 WAT 8967 ATOM 85549 O WAT 8968 141.307 121.033 93.604 1.00 0.00 O ATOM 85550 H1 WAT 8968 142.020 120.394 93.629 1.00 0.00 H ATOM 85551 H2 WAT 8968 141.700 121.815 93.217 1.00 0.00 H TER 85553 WAT 8968 ATOM 85553 O WAT 8969 69.435 31.944 146.534 1.00 0.00 O ATOM 85554 H1 WAT 8969 70.259 31.462 146.595 1.00 0.00 H ATOM 85555 H2 WAT 8969 69.408 32.475 147.330 1.00 0.00 H TER 85557 WAT 8969 ATOM 85557 O WAT 8970 85.766 51.237 135.775 1.00 0.00 O ATOM 85558 H1 WAT 8970 84.821 51.193 135.918 1.00 0.00 H ATOM 85559 H2 WAT 8970 85.894 50.871 134.900 1.00 0.00 H TER 85561 WAT 8970 ATOM 85561 O WAT 8971 27.026 41.296 98.164 1.00 0.00 O ATOM 85562 H1 WAT 8971 27.197 40.556 98.746 1.00 0.00 H ATOM 85563 H2 WAT 8971 27.236 40.967 97.290 1.00 0.00 H TER 85565 WAT 8971 ATOM 85565 O WAT 8972 54.148 57.686 130.025 1.00 0.00 O ATOM 85566 H1 WAT 8972 53.284 57.980 130.313 1.00 0.00 H ATOM 85567 H2 WAT 8972 54.731 57.910 130.751 1.00 0.00 H TER 85569 WAT 8972 ATOM 85569 O WAT 8973 145.537 139.379 10.844 1.00 0.00 O ATOM 85570 H1 WAT 8973 145.591 140.335 10.832 1.00 0.00 H ATOM 85571 H2 WAT 8973 145.172 139.171 11.704 1.00 0.00 H TER 85573 WAT 8973 ATOM 85573 O WAT 8974 48.935 55.064 134.275 1.00 0.00 O ATOM 85574 H1 WAT 8974 48.359 55.791 134.511 1.00 0.00 H ATOM 85575 H2 WAT 8974 49.458 55.398 133.547 1.00 0.00 H TER 85577 WAT 8974 ATOM 85577 O WAT 8975 129.732 1.456 143.203 1.00 0.00 O ATOM 85578 H1 WAT 8975 129.527 0.733 142.610 1.00 0.00 H ATOM 85579 H2 WAT 8975 130.278 1.062 143.882 1.00 0.00 H TER 85581 WAT 8975 ATOM 85581 O WAT 8976 8.704 129.348 136.611 1.00 0.00 O ATOM 85582 H1 WAT 8976 9.489 129.207 137.140 1.00 0.00 H ATOM 85583 H2 WAT 8976 8.447 128.472 136.325 1.00 0.00 H TER 85585 WAT 8976 ATOM 85585 O WAT 8977 112.655 58.653 13.612 1.00 0.00 O ATOM 85586 H1 WAT 8977 112.476 59.101 12.786 1.00 0.00 H ATOM 85587 H2 WAT 8977 111.879 58.820 14.148 1.00 0.00 H TER 85589 WAT 8977 ATOM 85589 O WAT 8978 22.026 124.902 14.767 1.00 0.00 O ATOM 85590 H1 WAT 8978 22.234 124.035 14.418 1.00 0.00 H ATOM 85591 H2 WAT 8978 21.084 124.872 14.936 1.00 0.00 H TER 85593 WAT 8978 ATOM 85593 O WAT 8979 121.275 140.487 123.848 1.00 0.00 O ATOM 85594 H1 WAT 8979 122.130 140.376 124.265 1.00 0.00 H ATOM 85595 H2 WAT 8979 121.126 139.663 123.384 1.00 0.00 H TER 85597 WAT 8979 ATOM 85597 O WAT 8980 44.152 3.291 116.082 1.00 0.00 O ATOM 85598 H1 WAT 8980 44.096 4.198 116.383 1.00 0.00 H ATOM 85599 H2 WAT 8980 44.154 3.354 115.127 1.00 0.00 H TER 85601 WAT 8980 ATOM 85601 O WAT 8981 54.353 28.939 151.880 1.00 0.00 O ATOM 85602 H1 WAT 8981 54.560 28.076 152.238 1.00 0.00 H ATOM 85603 H2 WAT 8981 54.317 29.513 152.645 1.00 0.00 H TER 85605 WAT 8981 ATOM 85605 O WAT 8982 115.391 83.610 68.013 1.00 0.00 O ATOM 85606 H1 WAT 8982 114.807 82.852 68.024 1.00 0.00 H ATOM 85607 H2 WAT 8982 115.544 83.808 68.937 1.00 0.00 H TER 85609 WAT 8982 ATOM 85609 O WAT 8983 79.156 107.670 121.906 1.00 0.00 O ATOM 85610 H1 WAT 8983 79.532 106.966 122.434 1.00 0.00 H ATOM 85611 H2 WAT 8983 78.354 107.295 121.542 1.00 0.00 H TER 85613 WAT 8983 ATOM 85613 O WAT 8984 109.141 129.845 16.293 1.00 0.00 O ATOM 85614 H1 WAT 8984 108.600 129.234 15.793 1.00 0.00 H ATOM 85615 H2 WAT 8984 108.664 129.971 17.113 1.00 0.00 H TER 85617 WAT 8984 ATOM 85617 O WAT 8985 89.186 122.899 14.632 1.00 0.00 O ATOM 85618 H1 WAT 8985 89.466 122.414 13.856 1.00 0.00 H ATOM 85619 H2 WAT 8985 88.269 122.652 14.751 1.00 0.00 H TER 85621 WAT 8985 ATOM 85621 O WAT 8986 45.869 55.647 78.233 1.00 0.00 O ATOM 85622 H1 WAT 8986 44.926 55.637 78.396 1.00 0.00 H ATOM 85623 H2 WAT 8986 46.005 56.400 77.658 1.00 0.00 H TER 85625 WAT 8986 ATOM 85625 O WAT 8987 50.953 75.922 148.300 1.00 0.00 O ATOM 85626 H1 WAT 8987 50.035 76.020 148.552 1.00 0.00 H ATOM 85627 H2 WAT 8987 50.922 75.492 147.445 1.00 0.00 H TER 85629 WAT 8987 ATOM 85629 O WAT 8988 109.190 6.616 120.005 1.00 0.00 O ATOM 85630 H1 WAT 8988 109.947 6.944 119.519 1.00 0.00 H ATOM 85631 H2 WAT 8988 108.606 6.267 119.332 1.00 0.00 H TER 85633 WAT 8988 ATOM 85633 O WAT 8989 66.689 105.694 158.623 1.00 0.00 O ATOM 85634 H1 WAT 8989 66.912 106.582 158.904 1.00 0.00 H ATOM 85635 H2 WAT 8989 65.732 105.679 158.614 1.00 0.00 H TER 85637 WAT 8989 ATOM 85637 O WAT 8990 92.573 40.889 70.503 1.00 0.00 O ATOM 85638 H1 WAT 8990 92.696 41.051 71.439 1.00 0.00 H ATOM 85639 H2 WAT 8990 92.854 41.700 70.080 1.00 0.00 H TER 85641 WAT 8990 ATOM 85641 O WAT 8991 40.710 53.047 28.113 1.00 0.00 O ATOM 85642 H1 WAT 8991 40.970 53.512 27.318 1.00 0.00 H ATOM 85643 H2 WAT 8991 41.470 52.509 28.335 1.00 0.00 H TER 85645 WAT 8991 ATOM 85645 O WAT 8992 32.458 126.807 103.186 1.00 0.00 O ATOM 85646 H1 WAT 8992 31.515 126.907 103.058 1.00 0.00 H ATOM 85647 H2 WAT 8992 32.777 127.699 103.322 1.00 0.00 H TER 85649 WAT 8992 ATOM 85649 O WAT 8993 121.418 3.150 126.526 1.00 0.00 O ATOM 85650 H1 WAT 8993 120.973 3.189 127.373 1.00 0.00 H ATOM 85651 H2 WAT 8993 120.797 3.543 125.912 1.00 0.00 H TER 85653 WAT 8993 ATOM 85653 O WAT 8994 69.640 2.006 155.205 1.00 0.00 O ATOM 85654 H1 WAT 8994 70.191 2.722 155.522 1.00 0.00 H ATOM 85655 H2 WAT 8994 69.064 1.804 155.943 1.00 0.00 H TER 85657 WAT 8994 ATOM 85657 O WAT 8995 129.366 144.792 61.965 1.00 0.00 O ATOM 85658 H1 WAT 8995 129.068 145.473 62.567 1.00 0.00 H ATOM 85659 H2 WAT 8995 129.541 145.255 61.146 1.00 0.00 H TER 85661 WAT 8995 ATOM 85661 O WAT 8996 133.465 7.975 126.905 1.00 0.00 O ATOM 85662 H1 WAT 8996 132.883 8.111 126.157 1.00 0.00 H ATOM 85663 H2 WAT 8996 133.081 7.235 127.375 1.00 0.00 H TER 85665 WAT 8996 ATOM 85665 O WAT 8997 95.734 31.576 12.906 1.00 0.00 O ATOM 85666 H1 WAT 8997 95.588 31.686 11.966 1.00 0.00 H ATOM 85667 H2 WAT 8997 95.111 30.897 13.166 1.00 0.00 H TER 85669 WAT 8997 ATOM 85669 O WAT 8998 10.378 33.363 117.726 1.00 0.00 O ATOM 85670 H1 WAT 8998 10.519 32.417 117.678 1.00 0.00 H ATOM 85671 H2 WAT 8998 10.055 33.511 118.615 1.00 0.00 H TER 85673 WAT 8998 ATOM 85673 O WAT 8999 77.029 126.751 113.464 1.00 0.00 O ATOM 85674 H1 WAT 8999 77.261 127.191 112.646 1.00 0.00 H ATOM 85675 H2 WAT 8999 76.072 126.741 113.468 1.00 0.00 H TER 85677 WAT 8999 ATOM 85677 O WAT 9000 43.423 23.170 144.230 1.00 0.00 O ATOM 85678 H1 WAT 9000 42.910 23.977 144.275 1.00 0.00 H ATOM 85679 H2 WAT 9000 43.855 23.208 143.377 1.00 0.00 H TER 85681 WAT 9000 ATOM 85681 O WAT 9001 66.264 53.264 156.900 1.00 0.00 O ATOM 85682 H1 WAT 9001 67.092 52.964 156.524 1.00 0.00 H ATOM 85683 H2 WAT 9001 66.434 53.317 157.841 1.00 0.00 H TER 85685 WAT 9001 ATOM 85685 O WAT 9002 98.814 90.283 97.884 1.00 0.00 O ATOM 85686 H1 WAT 9002 99.057 90.513 96.987 1.00 0.00 H ATOM 85687 H2 WAT 9002 98.047 89.719 97.787 1.00 0.00 H TER 85689 WAT 9002 ATOM 85689 O WAT 9003 92.752 137.529 126.477 1.00 0.00 O ATOM 85690 H1 WAT 9003 92.298 136.776 126.855 1.00 0.00 H ATOM 85691 H2 WAT 9003 92.342 138.289 126.892 1.00 0.00 H TER 85693 WAT 9003 ATOM 85693 O WAT 9004 129.586 126.139 114.363 1.00 0.00 O ATOM 85694 H1 WAT 9004 129.204 125.860 115.195 1.00 0.00 H ATOM 85695 H2 WAT 9004 130.499 125.854 114.410 1.00 0.00 H TER 85697 WAT 9004 ATOM 85697 O WAT 9005 92.186 30.189 88.182 1.00 0.00 O ATOM 85698 H1 WAT 9005 92.986 29.671 88.088 1.00 0.00 H ATOM 85699 H2 WAT 9005 92.452 30.947 88.702 1.00 0.00 H TER 85701 WAT 9005 ATOM 85701 O WAT 9006 18.213 120.476 29.435 1.00 0.00 O ATOM 85702 H1 WAT 9006 17.442 119.910 29.389 1.00 0.00 H ATOM 85703 H2 WAT 9006 17.960 121.175 30.038 1.00 0.00 H TER 85705 WAT 9006 ATOM 85705 O WAT 9007 102.394 140.195 79.546 1.00 0.00 O ATOM 85706 H1 WAT 9007 103.072 140.725 79.966 1.00 0.00 H ATOM 85707 H2 WAT 9007 102.166 139.535 80.201 1.00 0.00 H TER 85709 WAT 9007 ATOM 85709 O WAT 9008 120.700 21.707 131.644 1.00 0.00 O ATOM 85710 H1 WAT 9008 121.206 20.929 131.879 1.00 0.00 H ATOM 85711 H2 WAT 9008 120.469 22.105 132.484 1.00 0.00 H TER 85713 WAT 9008 ATOM 85713 O WAT 9009 90.030 118.214 63.062 1.00 0.00 O ATOM 85714 H1 WAT 9009 90.966 118.414 63.028 1.00 0.00 H ATOM 85715 H2 WAT 9009 89.700 118.740 63.791 1.00 0.00 H TER 85717 WAT 9009 ATOM 85717 O WAT 9010 143.581 79.537 71.939 1.00 0.00 O ATOM 85718 H1 WAT 9010 143.873 79.315 71.054 1.00 0.00 H ATOM 85719 H2 WAT 9010 142.753 79.999 71.809 1.00 0.00 H TER 85721 WAT 9010 ATOM 85721 O WAT 9011 107.486 103.226 74.294 1.00 0.00 O ATOM 85722 H1 WAT 9011 106.768 103.045 73.687 1.00 0.00 H ATOM 85723 H2 WAT 9011 107.434 102.523 74.942 1.00 0.00 H TER 85725 WAT 9011 ATOM 85725 O WAT 9012 71.477 26.307 118.770 1.00 0.00 O ATOM 85726 H1 WAT 9012 71.106 26.756 119.529 1.00 0.00 H ATOM 85727 H2 WAT 9012 71.019 26.685 118.020 1.00 0.00 H TER 85729 WAT 9012 ATOM 85729 O WAT 9013 134.341 60.045 14.268 1.00 0.00 O ATOM 85730 H1 WAT 9013 134.901 60.575 13.701 1.00 0.00 H ATOM 85731 H2 WAT 9013 133.453 60.217 13.955 1.00 0.00 H TER 85733 WAT 9013 ATOM 85733 O WAT 9014 82.033 102.404 130.474 1.00 0.00 O ATOM 85734 H1 WAT 9014 82.621 102.583 129.741 1.00 0.00 H ATOM 85735 H2 WAT 9014 82.081 103.191 131.018 1.00 0.00 H TER 85737 WAT 9014 ATOM 85737 O WAT 9015 79.199 124.324 146.688 1.00 0.00 O ATOM 85738 H1 WAT 9015 78.762 123.475 146.757 1.00 0.00 H ATOM 85739 H2 WAT 9015 79.225 124.503 145.748 1.00 0.00 H TER 85741 WAT 9015 ATOM 85741 O WAT 9016 99.978 35.373 67.263 1.00 0.00 O ATOM 85742 H1 WAT 9016 99.789 34.474 66.995 1.00 0.00 H ATOM 85743 H2 WAT 9016 99.219 35.633 67.784 1.00 0.00 H TER 85745 WAT 9016 ATOM 85745 O WAT 9017 83.939 4.433 134.224 1.00 0.00 O ATOM 85746 H1 WAT 9017 83.229 4.994 133.913 1.00 0.00 H ATOM 85747 H2 WAT 9017 84.004 3.742 133.565 1.00 0.00 H TER 85749 WAT 9017 ATOM 85749 O WAT 9018 69.899 139.154 101.275 1.00 0.00 O ATOM 85750 H1 WAT 9018 69.347 139.539 101.955 1.00 0.00 H ATOM 85751 H2 WAT 9018 69.734 138.213 101.336 1.00 0.00 H TER 85753 WAT 9018 ATOM 85753 O WAT 9019 122.251 62.936 95.290 1.00 0.00 O ATOM 85754 H1 WAT 9019 122.193 62.435 94.477 1.00 0.00 H ATOM 85755 H2 WAT 9019 122.062 63.837 95.030 1.00 0.00 H TER 85757 WAT 9019 ATOM 85757 O WAT 9020 47.504 76.313 141.509 1.00 0.00 O ATOM 85758 H1 WAT 9020 47.371 77.231 141.276 1.00 0.00 H ATOM 85759 H2 WAT 9020 47.987 75.945 140.769 1.00 0.00 H TER 85761 WAT 9020 ATOM 85761 O WAT 9021 123.576 63.906 65.056 1.00 0.00 O ATOM 85762 H1 WAT 9021 122.636 63.992 64.901 1.00 0.00 H ATOM 85763 H2 WAT 9021 123.929 63.591 64.224 1.00 0.00 H TER 85765 WAT 9021 ATOM 85765 O WAT 9022 51.404 78.862 114.026 1.00 0.00 O ATOM 85766 H1 WAT 9022 51.662 78.518 114.881 1.00 0.00 H ATOM 85767 H2 WAT 9022 51.081 78.098 113.549 1.00 0.00 H TER 85769 WAT 9022 ATOM 85769 O WAT 9023 83.646 100.734 137.225 1.00 0.00 O ATOM 85770 H1 WAT 9023 83.570 101.686 137.171 1.00 0.00 H ATOM 85771 H2 WAT 9023 83.929 100.567 138.124 1.00 0.00 H TER 85773 WAT 9023 ATOM 85773 O WAT 9024 3.453 12.432 134.858 1.00 0.00 O ATOM 85774 H1 WAT 9024 3.709 12.081 134.005 1.00 0.00 H ATOM 85775 H2 WAT 9024 3.946 11.909 135.491 1.00 0.00 H TER 85777 WAT 9024 ATOM 85777 O WAT 9025 11.093 139.557 58.984 1.00 0.00 O ATOM 85778 H1 WAT 9025 10.369 139.143 58.515 1.00 0.00 H ATOM 85779 H2 WAT 9025 10.882 139.432 59.909 1.00 0.00 H TER 85781 WAT 9025 ATOM 85781 O WAT 9026 89.473 112.577 67.734 1.00 0.00 O ATOM 85782 H1 WAT 9026 89.251 113.223 67.063 1.00 0.00 H ATOM 85783 H2 WAT 9026 90.325 112.861 68.066 1.00 0.00 H TER 85785 WAT 9026 ATOM 85785 O WAT 9027 77.721 78.759 142.438 1.00 0.00 O ATOM 85786 H1 WAT 9027 78.382 79.012 141.793 1.00 0.00 H ATOM 85787 H2 WAT 9027 77.775 77.804 142.475 1.00 0.00 H TER 85789 WAT 9027 ATOM 85789 O WAT 9028 55.081 91.849 90.752 1.00 0.00 O ATOM 85790 H1 WAT 9028 54.974 92.103 89.835 1.00 0.00 H ATOM 85791 H2 WAT 9028 54.339 91.271 90.928 1.00 0.00 H TER 85793 WAT 9028 ATOM 85793 O WAT 9029 133.643 10.604 14.231 1.00 0.00 O ATOM 85794 H1 WAT 9029 133.966 9.703 14.223 1.00 0.00 H ATOM 85795 H2 WAT 9029 132.939 10.613 13.583 1.00 0.00 H TER 85797 WAT 9029 ATOM 85797 O WAT 9030 102.755 48.129 90.683 1.00 0.00 O ATOM 85798 H1 WAT 9030 102.171 48.725 91.151 1.00 0.00 H ATOM 85799 H2 WAT 9030 102.583 48.302 89.757 1.00 0.00 H TER 85801 WAT 9030 ATOM 85801 O WAT 9031 31.299 116.212 154.099 1.00 0.00 O ATOM 85802 H1 WAT 9031 30.355 116.123 154.229 1.00 0.00 H ATOM 85803 H2 WAT 9031 31.674 115.446 154.534 1.00 0.00 H TER 85805 WAT 9031 ATOM 85805 O WAT 9032 26.445 138.767 81.030 1.00 0.00 O ATOM 85806 H1 WAT 9032 26.802 138.495 81.876 1.00 0.00 H ATOM 85807 H2 WAT 9032 26.820 139.634 80.879 1.00 0.00 H TER 85809 WAT 9032 ATOM 85809 O WAT 9033 137.736 132.500 153.349 1.00 0.00 O ATOM 85810 H1 WAT 9033 137.805 133.112 152.617 1.00 0.00 H ATOM 85811 H2 WAT 9033 137.538 133.052 154.105 1.00 0.00 H TER 85813 WAT 9033 ATOM 85813 O WAT 9034 78.003 33.578 4.219 1.00 0.00 O ATOM 85814 H1 WAT 9034 78.635 32.892 4.006 1.00 0.00 H ATOM 85815 H2 WAT 9034 78.343 33.976 5.020 1.00 0.00 H TER 85817 WAT 9034 ATOM 85817 O WAT 9035 8.127 68.494 95.202 1.00 0.00 O ATOM 85818 H1 WAT 9035 8.788 68.635 94.524 1.00 0.00 H ATOM 85819 H2 WAT 9035 8.303 69.172 95.853 1.00 0.00 H TER 85821 WAT 9035 ATOM 85821 O WAT 9036 39.094 23.029 71.344 1.00 0.00 O ATOM 85822 H1 WAT 9036 38.317 23.129 70.794 1.00 0.00 H ATOM 85823 H2 WAT 9036 39.428 23.920 71.449 1.00 0.00 H TER 85825 WAT 9036 ATOM 85825 O WAT 9037 2.401 78.519 7.196 1.00 0.00 O ATOM 85826 H1 WAT 9037 3.263 78.455 6.786 1.00 0.00 H ATOM 85827 H2 WAT 9037 1.788 78.551 6.462 1.00 0.00 H TER 85829 WAT 9037 ATOM 85829 O WAT 9038 51.260 115.503 60.094 1.00 0.00 O ATOM 85830 H1 WAT 9038 52.102 115.069 59.953 1.00 0.00 H ATOM 85831 H2 WAT 9038 50.701 115.177 59.389 1.00 0.00 H TER 85833 WAT 9038 ATOM 85833 O WAT 9039 87.147 47.458 21.490 1.00 0.00 O ATOM 85834 H1 WAT 9039 87.782 47.181 22.150 1.00 0.00 H ATOM 85835 H2 WAT 9039 87.335 46.906 20.730 1.00 0.00 H TER 85837 WAT 9039 ATOM 85837 O WAT 9040 40.623 124.743 150.610 1.00 0.00 O ATOM 85838 H1 WAT 9040 39.994 124.612 151.319 1.00 0.00 H ATOM 85839 H2 WAT 9040 40.850 123.857 150.325 1.00 0.00 H TER 85841 WAT 9040 ATOM 85841 O WAT 9041 95.660 86.254 148.451 1.00 0.00 O ATOM 85842 H1 WAT 9041 96.322 86.516 149.091 1.00 0.00 H ATOM 85843 H2 WAT 9041 95.185 87.062 148.254 1.00 0.00 H TER 85845 WAT 9041 ATOM 85845 O WAT 9042 6.553 0.215 133.608 1.00 0.00 O ATOM 85846 H1 WAT 9042 5.662 0.517 133.432 1.00 0.00 H ATOM 85847 H2 WAT 9042 7.039 1.013 133.818 1.00 0.00 H TER 85849 WAT 9042 ATOM 85849 O WAT 9043 9.756 44.185 71.706 1.00 0.00 O ATOM 85850 H1 WAT 9043 9.845 43.885 70.801 1.00 0.00 H ATOM 85851 H2 WAT 9043 10.606 44.573 71.914 1.00 0.00 H TER 85853 WAT 9043 ATOM 85853 O WAT 9044 60.817 28.466 18.946 1.00 0.00 O ATOM 85854 H1 WAT 9044 61.065 27.664 18.486 1.00 0.00 H ATOM 85855 H2 WAT 9044 60.609 28.178 19.835 1.00 0.00 H TER 85857 WAT 9044 ATOM 85857 O WAT 9045 49.109 3.815 116.335 1.00 0.00 O ATOM 85858 H1 WAT 9045 48.635 4.644 116.272 1.00 0.00 H ATOM 85859 H2 WAT 9045 49.617 3.767 115.525 1.00 0.00 H TER 85861 WAT 9045 ATOM 85861 O WAT 9046 37.640 105.189 152.132 1.00 0.00 O ATOM 85862 H1 WAT 9046 37.158 104.366 152.218 1.00 0.00 H ATOM 85863 H2 WAT 9046 37.899 105.409 153.027 1.00 0.00 H TER 85865 WAT 9046 ATOM 85865 O WAT 9047 141.692 105.353 91.010 1.00 0.00 O ATOM 85866 H1 WAT 9047 142.570 105.563 90.691 1.00 0.00 H ATOM 85867 H2 WAT 9047 141.609 105.847 91.826 1.00 0.00 H TER 85869 WAT 9047 ATOM 85869 O WAT 9048 143.391 87.063 122.189 1.00 0.00 O ATOM 85870 H1 WAT 9048 143.393 86.506 121.410 1.00 0.00 H ATOM 85871 H2 WAT 9048 144.316 87.158 122.417 1.00 0.00 H TER 85873 WAT 9048 ATOM 85873 O WAT 9049 60.551 23.382 21.754 1.00 0.00 O ATOM 85874 H1 WAT 9049 60.517 22.565 21.256 1.00 0.00 H ATOM 85875 H2 WAT 9049 59.679 23.464 22.140 1.00 0.00 H TER 85877 WAT 9049 ATOM 85877 O WAT 9050 145.336 8.269 150.729 1.00 0.00 O ATOM 85878 H1 WAT 9050 145.901 7.559 151.033 1.00 0.00 H ATOM 85879 H2 WAT 9050 144.568 8.224 151.298 1.00 0.00 H TER 85881 WAT 9050 ATOM 85881 O WAT 9051 102.375 129.904 83.940 1.00 0.00 O ATOM 85882 H1 WAT 9051 102.196 130.829 83.774 1.00 0.00 H ATOM 85883 H2 WAT 9051 102.601 129.546 83.082 1.00 0.00 H TER 85885 WAT 9051 ATOM 85885 O WAT 9052 44.678 19.720 0.562 1.00 0.00 O ATOM 85886 H1 WAT 9052 45.409 19.767 1.179 1.00 0.00 H ATOM 85887 H2 WAT 9052 44.533 20.627 0.292 1.00 0.00 H TER 85889 WAT 9052 ATOM 85889 O WAT 9053 139.806 5.925 109.479 1.00 0.00 O ATOM 85890 H1 WAT 9053 140.292 5.739 110.283 1.00 0.00 H ATOM 85891 H2 WAT 9053 139.955 5.157 108.927 1.00 0.00 H TER 85893 WAT 9053 ATOM 85893 O WAT 9054 48.792 110.843 87.672 1.00 0.00 O ATOM 85894 H1 WAT 9054 49.070 110.762 88.584 1.00 0.00 H ATOM 85895 H2 WAT 9054 47.850 111.008 87.722 1.00 0.00 H TER 85897 WAT 9054 ATOM 85897 O WAT 9055 114.879 90.266 146.612 1.00 0.00 O ATOM 85898 H1 WAT 9055 115.720 90.128 146.175 1.00 0.00 H ATOM 85899 H2 WAT 9055 114.612 89.392 146.898 1.00 0.00 H TER 85901 WAT 9055 ATOM 85901 O WAT 9056 35.714 88.971 127.806 1.00 0.00 O ATOM 85902 H1 WAT 9056 35.306 89.734 128.215 1.00 0.00 H ATOM 85903 H2 WAT 9056 36.065 89.301 126.979 1.00 0.00 H TER 85905 WAT 9056 ATOM 85905 O WAT 9057 51.727 95.385 143.023 1.00 0.00 O ATOM 85906 H1 WAT 9057 52.632 95.699 142.998 1.00 0.00 H ATOM 85907 H2 WAT 9057 51.370 95.748 143.834 1.00 0.00 H TER 85909 WAT 9057 ATOM 85909 O WAT 9058 67.646 33.699 11.916 1.00 0.00 O ATOM 85910 H1 WAT 9058 67.702 34.414 11.282 1.00 0.00 H ATOM 85911 H2 WAT 9058 66.743 33.388 11.849 1.00 0.00 H TER 85913 WAT 9058 ATOM 85913 O WAT 9059 99.527 0.490 120.163 1.00 0.00 O ATOM 85914 H1 WAT 9059 100.030 0.289 119.374 1.00 0.00 H ATOM 85915 H2 WAT 9059 98.701 0.020 120.048 1.00 0.00 H TER 85917 WAT 9059 ATOM 85917 O WAT 9060 114.406 71.562 157.860 1.00 0.00 O ATOM 85918 H1 WAT 9060 113.670 71.072 157.496 1.00 0.00 H ATOM 85919 H2 WAT 9060 114.035 72.413 158.095 1.00 0.00 H TER 85921 WAT 9060 ATOM 85921 O WAT 9061 17.771 78.498 146.371 1.00 0.00 O ATOM 85922 H1 WAT 9061 17.564 77.946 145.617 1.00 0.00 H ATOM 85923 H2 WAT 9061 18.041 79.333 145.989 1.00 0.00 H TER 85925 WAT 9061 ATOM 85925 O WAT 9062 3.173 46.894 0.666 1.00 0.00 O ATOM 85926 H1 WAT 9062 3.646 46.209 1.138 1.00 0.00 H ATOM 85927 H2 WAT 9062 3.111 46.568 -0.231 1.00 0.00 H TER 85929 WAT 9062 ATOM 85929 O WAT 9063 69.239 73.965 107.329 1.00 0.00 O ATOM 85930 H1 WAT 9063 68.457 74.503 107.449 1.00 0.00 H ATOM 85931 H2 WAT 9063 69.813 74.211 108.054 1.00 0.00 H TER 85933 WAT 9063 ATOM 85933 O WAT 9064 42.743 75.412 2.477 1.00 0.00 O ATOM 85934 H1 WAT 9064 43.122 74.554 2.665 1.00 0.00 H ATOM 85935 H2 WAT 9064 41.862 75.372 2.848 1.00 0.00 H TER 85937 WAT 9064 ATOM 85937 O WAT 9065 28.855 62.366 133.498 1.00 0.00 O ATOM 85938 H1 WAT 9065 29.438 62.667 134.196 1.00 0.00 H ATOM 85939 H2 WAT 9065 29.023 62.966 132.772 1.00 0.00 H TER 85941 WAT 9065 ATOM 85941 O WAT 9066 92.597 122.025 141.649 1.00 0.00 O ATOM 85942 H1 WAT 9066 92.761 122.640 142.364 1.00 0.00 H ATOM 85943 H2 WAT 9066 92.736 122.540 140.854 1.00 0.00 H TER 85945 WAT 9066 ATOM 85945 O WAT 9067 50.579 78.445 23.198 1.00 0.00 O ATOM 85946 H1 WAT 9067 50.544 78.233 22.265 1.00 0.00 H ATOM 85947 H2 WAT 9067 51.033 79.287 23.235 1.00 0.00 H TER 85949 WAT 9067 ATOM 85949 O WAT 9068 25.691 3.143 118.419 1.00 0.00 O ATOM 85950 H1 WAT 9068 25.708 2.384 117.836 1.00 0.00 H ATOM 85951 H2 WAT 9068 25.756 2.771 119.299 1.00 0.00 H TER 85953 WAT 9068 ATOM 85953 O WAT 9069 143.960 120.784 82.398 1.00 0.00 O ATOM 85954 H1 WAT 9069 144.245 120.110 81.781 1.00 0.00 H ATOM 85955 H2 WAT 9069 144.458 121.562 82.149 1.00 0.00 H TER 85957 WAT 9069 ATOM 85957 O WAT 9070 103.066 55.652 121.944 1.00 0.00 O ATOM 85958 H1 WAT 9070 103.990 55.661 122.194 1.00 0.00 H ATOM 85959 H2 WAT 9070 103.061 55.289 121.058 1.00 0.00 H TER 85961 WAT 9070 ATOM 85961 O WAT 9071 101.612 15.957 74.698 1.00 0.00 O ATOM 85962 H1 WAT 9071 101.037 16.442 74.106 1.00 0.00 H ATOM 85963 H2 WAT 9071 101.613 16.473 75.505 1.00 0.00 H TER 85965 WAT 9071 ATOM 85965 O WAT 9072 28.273 16.890 139.421 1.00 0.00 O ATOM 85966 H1 WAT 9072 27.647 17.334 139.993 1.00 0.00 H ATOM 85967 H2 WAT 9072 28.854 16.420 140.020 1.00 0.00 H TER 85969 WAT 9072 ATOM 85969 O WAT 9073 144.931 58.344 14.600 1.00 0.00 O ATOM 85970 H1 WAT 9073 144.403 58.812 13.954 1.00 0.00 H ATOM 85971 H2 WAT 9073 145.828 58.634 14.432 1.00 0.00 H TER 85973 WAT 9073 ATOM 85973 O WAT 9074 66.658 133.300 104.692 1.00 0.00 O ATOM 85974 H1 WAT 9074 66.591 133.656 103.805 1.00 0.00 H ATOM 85975 H2 WAT 9074 65.760 133.061 104.922 1.00 0.00 H TER 85977 WAT 9074 ATOM 85977 O WAT 9075 121.176 23.068 13.140 1.00 0.00 O ATOM 85978 H1 WAT 9075 121.297 23.888 12.661 1.00 0.00 H ATOM 85979 H2 WAT 9075 121.911 23.038 13.752 1.00 0.00 H TER 85981 WAT 9075 ATOM 85981 O WAT 9076 40.700 138.207 102.601 1.00 0.00 O ATOM 85982 H1 WAT 9076 40.538 137.778 101.761 1.00 0.00 H ATOM 85983 H2 WAT 9076 40.755 139.139 102.388 1.00 0.00 H TER 85985 WAT 9076 ATOM 85985 O WAT 9077 114.777 46.945 146.962 1.00 0.00 O ATOM 85986 H1 WAT 9077 114.048 46.694 147.529 1.00 0.00 H ATOM 85987 H2 WAT 9077 115.487 46.353 147.207 1.00 0.00 H TER 85989 WAT 9077 ATOM 85989 O WAT 9078 13.564 60.926 57.728 1.00 0.00 O ATOM 85990 H1 WAT 9078 14.421 61.352 57.706 1.00 0.00 H ATOM 85991 H2 WAT 9078 13.190 61.094 56.863 1.00 0.00 H TER 85993 WAT 9078 ATOM 85993 O WAT 9079 25.667 136.937 145.524 1.00 0.00 O ATOM 85994 H1 WAT 9079 25.585 136.996 144.572 1.00 0.00 H ATOM 85995 H2 WAT 9079 24.981 137.514 145.860 1.00 0.00 H TER 85997 WAT 9079 ATOM 85997 O WAT 9080 110.670 21.359 104.854 1.00 0.00 O ATOM 85998 H1 WAT 9080 109.950 21.854 104.463 1.00 0.00 H ATOM 85999 H2 WAT 9080 111.221 22.024 105.267 1.00 0.00 H TER 86001 WAT 9080 ATOM 86001 O WAT 9081 124.270 132.707 107.490 1.00 0.00 O ATOM 86002 H1 WAT 9081 125.082 132.909 107.955 1.00 0.00 H ATOM 86003 H2 WAT 9081 124.255 131.751 107.439 1.00 0.00 H TER 86005 WAT 9081 ATOM 86005 O WAT 9082 82.001 119.299 132.197 1.00 0.00 O ATOM 86006 H1 WAT 9082 81.199 119.010 132.633 1.00 0.00 H ATOM 86007 H2 WAT 9082 81.989 118.851 131.352 1.00 0.00 H TER 86009 WAT 9082 ATOM 86009 O WAT 9083 11.695 8.981 97.004 1.00 0.00 O ATOM 86010 H1 WAT 9083 12.252 8.418 96.465 1.00 0.00 H ATOM 86011 H2 WAT 9083 11.108 9.406 96.379 1.00 0.00 H TER 86013 WAT 9083 ATOM 86013 O WAT 9084 2.329 95.128 83.332 1.00 0.00 O ATOM 86014 H1 WAT 9084 2.400 94.397 82.718 1.00 0.00 H ATOM 86015 H2 WAT 9084 3.224 95.272 83.638 1.00 0.00 H TER 86017 WAT 9084 ATOM 86017 O WAT 9085 75.487 97.011 81.234 1.00 0.00 O ATOM 86018 H1 WAT 9085 75.238 96.535 80.442 1.00 0.00 H ATOM 86019 H2 WAT 9085 75.941 97.790 80.913 1.00 0.00 H TER 86021 WAT 9085 ATOM 86021 O WAT 9086 63.490 15.174 121.988 1.00 0.00 O ATOM 86022 H1 WAT 9086 63.923 14.321 121.975 1.00 0.00 H ATOM 86023 H2 WAT 9086 63.033 15.197 122.829 1.00 0.00 H TER 86025 WAT 9086 ATOM 86025 O WAT 9087 111.018 72.003 20.131 1.00 0.00 O ATOM 86026 H1 WAT 9087 110.834 72.744 20.708 1.00 0.00 H ATOM 86027 H2 WAT 9087 111.566 71.420 20.656 1.00 0.00 H TER 86029 WAT 9087 ATOM 86029 O WAT 9088 80.546 56.816 74.400 1.00 0.00 O ATOM 86030 H1 WAT 9088 81.026 57.623 74.214 1.00 0.00 H ATOM 86031 H2 WAT 9088 79.893 56.759 73.702 1.00 0.00 H TER 86033 WAT 9088 ATOM 86033 O WAT 9089 104.718 23.460 143.511 1.00 0.00 O ATOM 86034 H1 WAT 9089 105.256 22.764 143.889 1.00 0.00 H ATOM 86035 H2 WAT 9089 104.360 23.077 142.710 1.00 0.00 H TER 86037 WAT 9089 ATOM 86037 O WAT 9090 9.718 138.838 113.589 1.00 0.00 O ATOM 86038 H1 WAT 9090 10.291 138.198 113.167 1.00 0.00 H ATOM 86039 H2 WAT 9090 8.833 138.545 113.374 1.00 0.00 H TER 86041 WAT 9090 ATOM 86041 O WAT 9091 146.038 20.146 92.850 1.00 0.00 O ATOM 86042 H1 WAT 9091 146.120 20.712 92.082 1.00 0.00 H ATOM 86043 H2 WAT 9091 145.199 19.702 92.732 1.00 0.00 H TER 86045 WAT 9091 ATOM 86045 O WAT 9092 19.252 116.325 108.023 1.00 0.00 O ATOM 86046 H1 WAT 9092 19.826 115.569 108.147 1.00 0.00 H ATOM 86047 H2 WAT 9092 19.010 116.590 108.910 1.00 0.00 H TER 86049 WAT 9092 ATOM 86049 O WAT 9093 56.695 100.998 131.256 1.00 0.00 O ATOM 86050 H1 WAT 9093 57.181 100.308 131.706 1.00 0.00 H ATOM 86051 H2 WAT 9093 57.109 101.061 130.395 1.00 0.00 H TER 86053 WAT 9093 ATOM 86053 O WAT 9094 31.450 56.930 15.445 1.00 0.00 O ATOM 86054 H1 WAT 9094 31.898 56.174 15.825 1.00 0.00 H ATOM 86055 H2 WAT 9094 31.032 57.360 16.191 1.00 0.00 H TER 86057 WAT 9094 ATOM 86057 O WAT 9095 139.826 101.673 139.481 1.00 0.00 O ATOM 86058 H1 WAT 9095 139.122 101.028 139.546 1.00 0.00 H ATOM 86059 H2 WAT 9095 140.619 101.187 139.706 1.00 0.00 H TER 86061 WAT 9095 ATOM 86061 O WAT 9096 20.198 122.407 101.117 1.00 0.00 O ATOM 86062 H1 WAT 9096 19.644 121.706 101.461 1.00 0.00 H ATOM 86063 H2 WAT 9096 21.070 122.015 101.057 1.00 0.00 H TER 86065 WAT 9096 ATOM 86065 O WAT 9097 6.650 25.136 87.365 1.00 0.00 O ATOM 86066 H1 WAT 9097 6.900 26.047 87.517 1.00 0.00 H ATOM 86067 H2 WAT 9097 6.516 25.079 86.419 1.00 0.00 H TER 86069 WAT 9097 ATOM 86069 O WAT 9098 39.095 40.452 80.704 1.00 0.00 O ATOM 86070 H1 WAT 9098 38.443 40.758 81.334 1.00 0.00 H ATOM 86071 H2 WAT 9098 39.386 39.609 81.050 1.00 0.00 H TER 86073 WAT 9098 ATOM 86073 O WAT 9099 100.660 24.159 109.376 1.00 0.00 O ATOM 86074 H1 WAT 9099 100.750 24.085 108.426 1.00 0.00 H ATOM 86075 H2 WAT 9099 99.739 23.960 109.546 1.00 0.00 H TER 86077 WAT 9099 ATOM 86077 O WAT 9100 65.188 42.412 3.061 1.00 0.00 O ATOM 86078 H1 WAT 9100 65.677 41.901 2.417 1.00 0.00 H ATOM 86079 H2 WAT 9100 64.271 42.297 2.812 1.00 0.00 H TER 86081 WAT 9100 ATOM 86081 O WAT 9101 136.715 104.615 11.849 1.00 0.00 O ATOM 86082 H1 WAT 9101 136.430 104.424 10.956 1.00 0.00 H ATOM 86083 H2 WAT 9101 137.429 105.244 11.744 1.00 0.00 H TER 86085 WAT 9101 ATOM 86085 O WAT 9102 29.919 54.315 17.486 1.00 0.00 O ATOM 86086 H1 WAT 9102 29.163 54.861 17.704 1.00 0.00 H ATOM 86087 H2 WAT 9102 30.046 53.764 18.259 1.00 0.00 H TER 86089 WAT 9102 ATOM 86089 O WAT 9103 108.015 30.904 141.908 1.00 0.00 O ATOM 86090 H1 WAT 9103 107.232 31.029 141.371 1.00 0.00 H ATOM 86091 H2 WAT 9103 108.285 30.003 141.730 1.00 0.00 H TER 86093 WAT 9103 ATOM 86093 O WAT 9104 62.082 130.642 81.166 1.00 0.00 O ATOM 86094 H1 WAT 9104 61.511 129.948 81.496 1.00 0.00 H ATOM 86095 H2 WAT 9104 62.217 130.423 80.244 1.00 0.00 H TER 86097 WAT 9104 ATOM 86097 O WAT 9105 145.551 29.762 151.380 1.00 0.00 O ATOM 86098 H1 WAT 9105 145.281 29.532 152.269 1.00 0.00 H ATOM 86099 H2 WAT 9105 146.471 29.500 151.333 1.00 0.00 H TER 86101 WAT 9105 ATOM 86101 O WAT 9106 97.886 12.591 61.033 1.00 0.00 O ATOM 86102 H1 WAT 9106 98.721 13.052 61.114 1.00 0.00 H ATOM 86103 H2 WAT 9106 97.267 13.264 60.750 1.00 0.00 H TER 86105 WAT 9106 ATOM 86105 O WAT 9107 111.348 58.248 128.898 1.00 0.00 O ATOM 86106 H1 WAT 9107 111.026 57.741 128.153 1.00 0.00 H ATOM 86107 H2 WAT 9107 112.099 58.731 128.553 1.00 0.00 H TER 86109 WAT 9107 ATOM 86109 O WAT 9108 88.597 62.230 15.112 1.00 0.00 O ATOM 86110 H1 WAT 9108 88.468 62.215 16.060 1.00 0.00 H ATOM 86111 H2 WAT 9108 87.781 61.880 14.754 1.00 0.00 H TER 86113 WAT 9108 ATOM 86113 O WAT 9109 127.039 144.207 69.708 1.00 0.00 O ATOM 86114 H1 WAT 9109 127.170 144.159 70.655 1.00 0.00 H ATOM 86115 H2 WAT 9109 127.653 144.880 69.414 1.00 0.00 H TER 86117 WAT 9109 ATOM 86117 O WAT 9110 121.934 83.332 110.482 1.00 0.00 O ATOM 86118 H1 WAT 9110 121.204 83.199 111.086 1.00 0.00 H ATOM 86119 H2 WAT 9110 121.589 83.927 109.816 1.00 0.00 H TER 86121 WAT 9110 ATOM 86121 O WAT 9111 131.902 115.539 132.649 1.00 0.00 O ATOM 86122 H1 WAT 9111 131.747 115.135 131.796 1.00 0.00 H ATOM 86123 H2 WAT 9111 132.835 115.401 132.814 1.00 0.00 H TER 86125 WAT 9111 ATOM 86125 O WAT 9112 139.107 54.392 87.132 1.00 0.00 O ATOM 86126 H1 WAT 9112 138.927 53.804 87.866 1.00 0.00 H ATOM 86127 H2 WAT 9112 138.798 53.915 86.362 1.00 0.00 H TER 86129 WAT 9112 ATOM 86129 O WAT 9113 61.927 121.357 10.460 1.00 0.00 O ATOM 86130 H1 WAT 9113 62.103 122.195 10.888 1.00 0.00 H ATOM 86131 H2 WAT 9113 61.104 121.496 9.992 1.00 0.00 H TER 86133 WAT 9113 ATOM 86133 O WAT 9114 23.448 134.650 90.909 1.00 0.00 O ATOM 86134 H1 WAT 9114 23.585 135.086 91.750 1.00 0.00 H ATOM 86135 H2 WAT 9114 23.215 133.751 91.140 1.00 0.00 H TER 86137 WAT 9114 ATOM 86137 O WAT 9115 29.437 145.057 7.356 1.00 0.00 O ATOM 86138 H1 WAT 9115 29.605 145.007 6.415 1.00 0.00 H ATOM 86139 H2 WAT 9115 29.535 144.156 7.665 1.00 0.00 H TER 86141 WAT 9115 ATOM 86141 O WAT 9116 17.877 130.837 13.719 1.00 0.00 O ATOM 86142 H1 WAT 9116 18.035 129.904 13.859 1.00 0.00 H ATOM 86143 H2 WAT 9116 16.942 130.895 13.521 1.00 0.00 H TER 86145 WAT 9116 ATOM 86145 O WAT 9117 3.535 16.143 141.967 1.00 0.00 O ATOM 86146 H1 WAT 9117 3.205 16.776 141.330 1.00 0.00 H ATOM 86147 H2 WAT 9117 3.589 16.633 142.787 1.00 0.00 H TER 86149 WAT 9117 ATOM 86149 O WAT 9118 88.720 14.179 72.931 1.00 0.00 O ATOM 86150 H1 WAT 9118 89.357 13.507 72.691 1.00 0.00 H ATOM 86151 H2 WAT 9118 88.348 14.465 72.097 1.00 0.00 H TER 86153 WAT 9118 ATOM 86153 O WAT 9119 66.802 117.479 107.736 1.00 0.00 O ATOM 86154 H1 WAT 9119 67.067 116.921 107.004 1.00 0.00 H ATOM 86155 H2 WAT 9119 66.990 116.957 108.515 1.00 0.00 H TER 86157 WAT 9119 ATOM 86157 O WAT 9120 8.108 84.268 149.545 1.00 0.00 O ATOM 86158 H1 WAT 9120 7.828 84.779 148.786 1.00 0.00 H ATOM 86159 H2 WAT 9120 7.496 84.514 150.239 1.00 0.00 H TER 86161 WAT 9120 ATOM 86161 O WAT 9121 10.843 32.625 14.210 1.00 0.00 O ATOM 86162 H1 WAT 9121 11.417 32.196 14.844 1.00 0.00 H ATOM 86163 H2 WAT 9121 9.987 32.648 14.638 1.00 0.00 H TER 86165 WAT 9121 ATOM 86165 O WAT 9122 99.281 82.220 25.839 1.00 0.00 O ATOM 86166 H1 WAT 9122 99.274 83.039 26.335 1.00 0.00 H ATOM 86167 H2 WAT 9122 98.368 82.089 25.582 1.00 0.00 H TER 86169 WAT 9122 ATOM 86169 O WAT 9123 23.671 68.226 97.576 1.00 0.00 O ATOM 86170 H1 WAT 9123 24.608 68.097 97.431 1.00 0.00 H ATOM 86171 H2 WAT 9123 23.435 68.948 96.993 1.00 0.00 H TER 86173 WAT 9123 ATOM 86173 O WAT 9124 124.869 126.112 61.885 1.00 0.00 O ATOM 86174 H1 WAT 9124 124.732 125.352 61.320 1.00 0.00 H ATOM 86175 H2 WAT 9124 124.418 126.828 61.437 1.00 0.00 H TER 86177 WAT 9124 ATOM 86177 O WAT 9125 97.035 67.534 126.865 1.00 0.00 O ATOM 86178 H1 WAT 9125 96.216 67.119 127.133 1.00 0.00 H ATOM 86179 H2 WAT 9125 97.154 67.264 125.954 1.00 0.00 H TER 86181 WAT 9125 ATOM 86181 O WAT 9126 91.415 59.018 135.618 1.00 0.00 O ATOM 86182 H1 WAT 9126 91.054 59.270 136.468 1.00 0.00 H ATOM 86183 H2 WAT 9126 90.841 59.441 134.979 1.00 0.00 H TER 86185 WAT 9126 ATOM 86185 O WAT 9127 117.466 131.843 156.131 1.00 0.00 O ATOM 86186 H1 WAT 9127 118.171 132.121 156.716 1.00 0.00 H ATOM 86187 H2 WAT 9127 117.002 131.164 156.620 1.00 0.00 H TER 86189 WAT 9127 ATOM 86189 O WAT 9128 64.801 73.859 145.885 1.00 0.00 O ATOM 86190 H1 WAT 9128 64.819 73.919 146.841 1.00 0.00 H ATOM 86191 H2 WAT 9128 63.875 73.949 145.657 1.00 0.00 H TER 86193 WAT 9128 ATOM 86193 O WAT 9129 105.365 56.929 128.524 1.00 0.00 O ATOM 86194 H1 WAT 9129 104.474 56.748 128.227 1.00 0.00 H ATOM 86195 H2 WAT 9129 105.496 56.338 129.265 1.00 0.00 H TER 86197 WAT 9129 ATOM 86197 O WAT 9130 49.211 74.254 78.969 1.00 0.00 O ATOM 86198 H1 WAT 9130 48.842 73.820 79.739 1.00 0.00 H ATOM 86199 H2 WAT 9130 48.480 74.315 78.355 1.00 0.00 H TER 86201 WAT 9130 ATOM 86201 O WAT 9131 6.061 126.215 104.029 1.00 0.00 O ATOM 86202 H1 WAT 9131 5.738 126.939 103.494 1.00 0.00 H ATOM 86203 H2 WAT 9131 6.736 126.608 104.582 1.00 0.00 H TER 86205 WAT 9131 ATOM 86205 O WAT 9132 113.775 138.433 91.518 1.00 0.00 O ATOM 86206 H1 WAT 9132 114.022 138.972 90.767 1.00 0.00 H ATOM 86207 H2 WAT 9132 113.270 137.713 91.140 1.00 0.00 H TER 86209 WAT 9132 ATOM 86209 O WAT 9133 88.522 32.697 88.789 1.00 0.00 O ATOM 86210 H1 WAT 9133 88.794 32.649 87.873 1.00 0.00 H ATOM 86211 H2 WAT 9133 88.042 31.883 88.939 1.00 0.00 H TER 86213 WAT 9133 ATOM 86213 O WAT 9134 110.725 111.464 69.529 1.00 0.00 O ATOM 86214 H1 WAT 9134 110.495 111.853 68.685 1.00 0.00 H ATOM 86215 H2 WAT 9134 110.215 110.655 69.566 1.00 0.00 H TER 86217 WAT 9134 ATOM 86217 O WAT 9135 93.413 118.078 58.842 1.00 0.00 O ATOM 86218 H1 WAT 9135 94.156 117.476 58.889 1.00 0.00 H ATOM 86219 H2 WAT 9135 93.805 118.927 58.636 1.00 0.00 H TER 86221 WAT 9135 ATOM 86221 O WAT 9136 43.834 70.194 108.169 1.00 0.00 O ATOM 86222 H1 WAT 9136 44.097 70.208 107.248 1.00 0.00 H ATOM 86223 H2 WAT 9136 44.293 70.937 108.560 1.00 0.00 H TER 86225 WAT 9136 ATOM 86225 O WAT 9137 97.311 18.505 81.993 1.00 0.00 O ATOM 86226 H1 WAT 9137 97.466 19.340 82.435 1.00 0.00 H ATOM 86227 H2 WAT 9137 96.514 18.164 82.398 1.00 0.00 H TER 86229 WAT 9137 ATOM 86229 O WAT 9138 52.371 16.066 51.928 1.00 0.00 O ATOM 86230 H1 WAT 9138 52.560 16.511 52.755 1.00 0.00 H ATOM 86231 H2 WAT 9138 51.685 16.595 51.522 1.00 0.00 H TER 86233 WAT 9138 ATOM 86233 O WAT 9139 65.135 31.767 124.557 1.00 0.00 O ATOM 86234 H1 WAT 9139 64.590 31.426 123.848 1.00 0.00 H ATOM 86235 H2 WAT 9139 64.929 32.701 124.589 1.00 0.00 H TER 86237 WAT 9139 ATOM 86237 O WAT 9140 139.159 139.277 3.644 1.00 0.00 O ATOM 86238 H1 WAT 9140 139.203 140.055 4.200 1.00 0.00 H ATOM 86239 H2 WAT 9140 139.910 138.748 3.912 1.00 0.00 H TER 86241 WAT 9140 ATOM 86241 O WAT 9141 39.474 142.623 69.950 1.00 0.00 O ATOM 86242 H1 WAT 9141 39.835 143.383 69.494 1.00 0.00 H ATOM 86243 H2 WAT 9141 39.915 141.873 69.551 1.00 0.00 H TER 86245 WAT 9141 ATOM 86245 O WAT 9142 2.054 125.779 146.258 1.00 0.00 O ATOM 86246 H1 WAT 9142 2.175 126.664 146.603 1.00 0.00 H ATOM 86247 H2 WAT 9142 1.274 125.843 145.705 1.00 0.00 H TER 86249 WAT 9142 ATOM 86249 O WAT 9143 34.861 35.218 8.838 1.00 0.00 O ATOM 86250 H1 WAT 9143 34.364 35.808 9.405 1.00 0.00 H ATOM 86251 H2 WAT 9143 35.733 35.185 9.231 1.00 0.00 H TER 86253 WAT 9143 ATOM 86253 O WAT 9144 75.574 47.688 66.588 1.00 0.00 O ATOM 86254 H1 WAT 9144 74.743 47.463 66.169 1.00 0.00 H ATOM 86255 H2 WAT 9144 75.690 47.020 67.263 1.00 0.00 H TER 86257 WAT 9144 ATOM 86257 O WAT 9145 41.407 14.802 123.297 1.00 0.00 O ATOM 86258 H1 WAT 9145 41.731 15.649 122.992 1.00 0.00 H ATOM 86259 H2 WAT 9145 42.155 14.405 123.742 1.00 0.00 H TER 86261 WAT 9145 ATOM 86261 O WAT 9146 3.024 125.534 130.902 1.00 0.00 O ATOM 86262 H1 WAT 9146 2.544 126.181 131.418 1.00 0.00 H ATOM 86263 H2 WAT 9146 2.405 125.259 130.226 1.00 0.00 H TER 86265 WAT 9146 ATOM 86265 O WAT 9147 20.980 48.247 97.616 1.00 0.00 O ATOM 86266 H1 WAT 9147 20.501 47.641 97.051 1.00 0.00 H ATOM 86267 H2 WAT 9147 20.734 47.991 98.505 1.00 0.00 H TER 86269 WAT 9147 ATOM 86269 O WAT 9148 127.538 19.776 55.792 1.00 0.00 O ATOM 86270 H1 WAT 9148 128.330 19.245 55.714 1.00 0.00 H ATOM 86271 H2 WAT 9148 127.574 20.131 56.680 1.00 0.00 H TER 86273 WAT 9148 ATOM 86273 O WAT 9149 8.280 45.819 146.067 1.00 0.00 O ATOM 86274 H1 WAT 9149 9.003 46.424 145.901 1.00 0.00 H ATOM 86275 H2 WAT 9149 8.642 45.172 146.673 1.00 0.00 H TER 86277 WAT 9149 ATOM 86277 O WAT 9150 74.650 75.528 115.219 1.00 0.00 O ATOM 86278 H1 WAT 9150 74.628 76.434 114.913 1.00 0.00 H ATOM 86279 H2 WAT 9150 73.818 75.409 115.677 1.00 0.00 H TER 86281 WAT 9150 ATOM 86281 O WAT 9151 26.642 8.331 143.045 1.00 0.00 O ATOM 86282 H1 WAT 9151 26.466 8.190 143.975 1.00 0.00 H ATOM 86283 H2 WAT 9151 25.811 8.644 142.689 1.00 0.00 H TER 86285 WAT 9151 ATOM 86285 O WAT 9152 44.455 34.228 139.807 1.00 0.00 O ATOM 86286 H1 WAT 9152 44.291 34.003 138.891 1.00 0.00 H ATOM 86287 H2 WAT 9152 45.180 34.851 139.775 1.00 0.00 H TER 86289 WAT 9152 ATOM 86289 O WAT 9153 7.485 48.026 82.117 1.00 0.00 O ATOM 86290 H1 WAT 9153 7.839 47.738 82.958 1.00 0.00 H ATOM 86291 H2 WAT 9153 8.169 47.809 81.483 1.00 0.00 H TER 86293 WAT 9153 ATOM 86293 O WAT 9154 61.803 118.141 60.058 1.00 0.00 O ATOM 86294 H1 WAT 9154 61.302 117.614 59.435 1.00 0.00 H ATOM 86295 H2 WAT 9154 61.852 119.007 59.653 1.00 0.00 H TER 86297 WAT 9154 ATOM 86297 O WAT 9155 94.096 104.681 20.877 1.00 0.00 O ATOM 86298 H1 WAT 9155 95.045 104.784 20.951 1.00 0.00 H ATOM 86299 H2 WAT 9155 93.760 105.577 20.840 1.00 0.00 H TER 86301 WAT 9155 ATOM 86301 O WAT 9156 1.624 102.662 25.715 1.00 0.00 O ATOM 86302 H1 WAT 9156 2.241 102.545 26.438 1.00 0.00 H ATOM 86303 H2 WAT 9156 1.282 103.548 25.833 1.00 0.00 H TER 86305 WAT 9156 ATOM 86305 O WAT 9157 3.412 118.201 149.552 1.00 0.00 O ATOM 86306 H1 WAT 9157 3.826 118.332 148.699 1.00 0.00 H ATOM 86307 H2 WAT 9157 2.492 118.031 149.348 1.00 0.00 H TER 86309 WAT 9157 ATOM 86309 O WAT 9158 2.408 94.139 138.514 1.00 0.00 O ATOM 86310 H1 WAT 9158 2.718 95.043 138.566 1.00 0.00 H ATOM 86311 H2 WAT 9158 1.628 94.121 139.068 1.00 0.00 H TER 86313 WAT 9158 ATOM 86313 O WAT 9159 93.718 83.173 22.233 1.00 0.00 O ATOM 86314 H1 WAT 9159 94.152 82.994 23.067 1.00 0.00 H ATOM 86315 H2 WAT 9159 94.316 83.761 21.773 1.00 0.00 H TER 86317 WAT 9159 ATOM 86317 O WAT 9160 26.789 53.671 112.162 1.00 0.00 O ATOM 86318 H1 WAT 9160 27.565 53.941 112.654 1.00 0.00 H ATOM 86319 H2 WAT 9160 27.007 52.799 111.832 1.00 0.00 H TER 86321 WAT 9160 ATOM 86321 O WAT 9161 23.313 50.919 10.051 1.00 0.00 O ATOM 86322 H1 WAT 9161 22.658 50.303 10.378 1.00 0.00 H ATOM 86323 H2 WAT 9161 24.094 50.384 9.906 1.00 0.00 H TER 86325 WAT 9161 ATOM 86325 O WAT 9162 8.071 144.324 12.007 1.00 0.00 O ATOM 86326 H1 WAT 9162 7.222 144.142 11.604 1.00 0.00 H ATOM 86327 H2 WAT 9162 7.925 144.189 12.944 1.00 0.00 H TER 86329 WAT 9162 ATOM 86329 O WAT 9163 80.586 130.396 100.600 1.00 0.00 O ATOM 86330 H1 WAT 9163 79.897 129.826 100.259 1.00 0.00 H ATOM 86331 H2 WAT 9163 81.395 129.902 100.465 1.00 0.00 H TER 86333 WAT 9163 ATOM 86333 O WAT 9164 48.179 33.241 139.205 1.00 0.00 O ATOM 86334 H1 WAT 9164 48.833 33.588 139.812 1.00 0.00 H ATOM 86335 H2 WAT 9164 48.692 32.875 138.484 1.00 0.00 H TER 86337 WAT 9164 ATOM 86337 O WAT 9165 101.297 62.312 155.917 1.00 0.00 O ATOM 86338 H1 WAT 9165 102.088 62.809 155.708 1.00 0.00 H ATOM 86339 H2 WAT 9165 101.613 61.428 156.108 1.00 0.00 H TER 86341 WAT 9165 ATOM 86341 O WAT 9166 61.830 98.879 61.083 1.00 0.00 O ATOM 86342 H1 WAT 9166 62.584 99.258 60.632 1.00 0.00 H ATOM 86343 H2 WAT 9166 61.692 98.036 60.651 1.00 0.00 H TER 86345 WAT 9166 ATOM 86345 O WAT 9167 86.704 134.623 139.268 1.00 0.00 O ATOM 86346 H1 WAT 9167 87.582 134.781 139.614 1.00 0.00 H ATOM 86347 H2 WAT 9167 86.735 133.725 138.938 1.00 0.00 H TER 86349 WAT 9167 ATOM 86349 O WAT 9168 26.074 42.265 81.272 1.00 0.00 O ATOM 86350 H1 WAT 9168 25.658 42.310 80.412 1.00 0.00 H ATOM 86351 H2 WAT 9168 25.731 41.462 81.664 1.00 0.00 H TER 86353 WAT 9168 ATOM 86353 O WAT 9169 44.820 30.248 116.114 1.00 0.00 O ATOM 86354 H1 WAT 9169 44.862 29.329 116.377 1.00 0.00 H ATOM 86355 H2 WAT 9169 45.398 30.700 116.728 1.00 0.00 H TER 86357 WAT 9169 ATOM 86357 O WAT 9170 142.457 32.232 74.597 1.00 0.00 O ATOM 86358 H1 WAT 9170 142.815 31.476 74.132 1.00 0.00 H ATOM 86359 H2 WAT 9170 143.226 32.700 74.923 1.00 0.00 H TER 86361 WAT 9170 ATOM 86361 O WAT 9171 86.829 96.535 144.755 1.00 0.00 O ATOM 86362 H1 WAT 9171 86.593 97.385 144.384 1.00 0.00 H ATOM 86363 H2 WAT 9171 87.333 96.104 144.065 1.00 0.00 H TER 86365 WAT 9171 ATOM 86365 O WAT 9172 75.860 95.845 72.314 1.00 0.00 O ATOM 86366 H1 WAT 9172 75.253 96.490 71.949 1.00 0.00 H ATOM 86367 H2 WAT 9172 75.298 95.138 72.629 1.00 0.00 H TER 86369 WAT 9172 ATOM 86369 O WAT 9173 111.427 28.615 73.628 1.00 0.00 O ATOM 86370 H1 WAT 9173 110.493 28.692 73.824 1.00 0.00 H ATOM 86371 H2 WAT 9173 111.723 27.875 74.158 1.00 0.00 H TER 86373 WAT 9173 ATOM 86373 O WAT 9174 53.890 67.436 132.077 1.00 0.00 O ATOM 86374 H1 WAT 9174 53.853 67.420 131.121 1.00 0.00 H ATOM 86375 H2 WAT 9174 53.048 67.806 132.343 1.00 0.00 H TER 86377 WAT 9174 ATOM 86377 O WAT 9175 27.557 77.440 142.007 1.00 0.00 O ATOM 86378 H1 WAT 9175 27.783 78.342 141.784 1.00 0.00 H ATOM 86379 H2 WAT 9175 27.329 77.036 141.170 1.00 0.00 H TER 86381 WAT 9175 ATOM 86381 O WAT 9176 75.380 18.651 19.946 1.00 0.00 O ATOM 86382 H1 WAT 9176 74.907 19.106 20.643 1.00 0.00 H ATOM 86383 H2 WAT 9176 76.284 18.605 20.261 1.00 0.00 H TER 86385 WAT 9176 ATOM 86385 O WAT 9177 99.137 77.048 27.483 1.00 0.00 O ATOM 86386 H1 WAT 9177 98.647 76.539 26.837 1.00 0.00 H ATOM 86387 H2 WAT 9177 99.891 77.385 26.999 1.00 0.00 H TER 86389 WAT 9177 ATOM 86389 O WAT 9178 125.980 41.211 14.654 1.00 0.00 O ATOM 86390 H1 WAT 9178 126.697 41.845 14.635 1.00 0.00 H ATOM 86391 H2 WAT 9178 125.678 41.163 13.747 1.00 0.00 H TER 86393 WAT 9178 ATOM 86393 O WAT 9179 87.542 50.157 151.083 1.00 0.00 O ATOM 86394 H1 WAT 9179 87.487 50.675 150.280 1.00 0.00 H ATOM 86395 H2 WAT 9179 88.397 50.378 151.453 1.00 0.00 H TER 86397 WAT 9179 ATOM 86397 O WAT 9180 127.158 137.701 93.014 1.00 0.00 O ATOM 86398 H1 WAT 9180 127.757 137.995 92.328 1.00 0.00 H ATOM 86399 H2 WAT 9180 127.001 138.482 93.545 1.00 0.00 H TER 86401 WAT 9180 ATOM 86401 O WAT 9181 37.708 58.172 153.496 1.00 0.00 O ATOM 86402 H1 WAT 9181 37.235 58.591 152.777 1.00 0.00 H ATOM 86403 H2 WAT 9181 37.845 57.272 153.201 1.00 0.00 H TER 86405 WAT 9181 ATOM 86405 O WAT 9182 9.056 102.718 128.830 1.00 0.00 O ATOM 86406 H1 WAT 9182 9.957 102.842 128.532 1.00 0.00 H ATOM 86407 H2 WAT 9182 8.770 103.591 129.100 1.00 0.00 H TER 86409 WAT 9182 ATOM 86409 O WAT 9183 123.109 14.887 94.792 1.00 0.00 O ATOM 86410 H1 WAT 9183 123.403 15.788 94.922 1.00 0.00 H ATOM 86411 H2 WAT 9183 123.836 14.462 94.337 1.00 0.00 H TER 86413 WAT 9183 ATOM 86413 O WAT 9184 95.490 121.328 79.068 1.00 0.00 O ATOM 86414 H1 WAT 9184 95.893 122.008 78.528 1.00 0.00 H ATOM 86415 H2 WAT 9184 95.858 120.509 78.736 1.00 0.00 H TER 86417 WAT 9184 ATOM 86417 O WAT 9185 82.664 130.169 75.031 1.00 0.00 O ATOM 86418 H1 WAT 9185 83.455 130.627 74.744 1.00 0.00 H ATOM 86419 H2 WAT 9185 82.162 130.831 75.506 1.00 0.00 H TER 86421 WAT 9185 ATOM 86421 O WAT 9186 117.343 19.977 63.226 1.00 0.00 O ATOM 86422 H1 WAT 9186 117.765 19.123 63.325 1.00 0.00 H ATOM 86423 H2 WAT 9186 116.744 19.864 62.489 1.00 0.00 H TER 86425 WAT 9186 ATOM 86425 O WAT 9187 120.183 69.807 97.437 1.00 0.00 O ATOM 86426 H1 WAT 9187 120.077 70.496 98.093 1.00 0.00 H ATOM 86427 H2 WAT 9187 121.127 69.651 97.405 1.00 0.00 H TER 86429 WAT 9187 ATOM 86429 O WAT 9188 0.069 81.633 69.414 1.00 0.00 O ATOM 86430 H1 WAT 9188 0.376 82.078 70.204 1.00 0.00 H ATOM 86431 H2 WAT 9188 -0.376 82.316 68.912 1.00 0.00 H TER 86433 WAT 9188 ATOM 86433 O WAT 9189 82.676 80.292 70.999 1.00 0.00 O ATOM 86434 H1 WAT 9189 83.080 81.139 71.189 1.00 0.00 H ATOM 86435 H2 WAT 9189 82.240 80.046 71.815 1.00 0.00 H TER 86437 WAT 9189 ATOM 86437 O WAT 9190 90.167 91.059 19.531 1.00 0.00 O ATOM 86438 H1 WAT 9190 91.070 90.763 19.651 1.00 0.00 H ATOM 86439 H2 WAT 9190 89.929 91.451 20.371 1.00 0.00 H TER 86441 WAT 9190 ATOM 86441 O WAT 9191 6.007 105.911 69.370 1.00 0.00 O ATOM 86442 H1 WAT 9191 6.957 105.972 69.469 1.00 0.00 H ATOM 86443 H2 WAT 9191 5.880 105.300 68.643 1.00 0.00 H TER 86445 WAT 9191 ATOM 86445 O WAT 9192 138.141 137.172 152.352 1.00 0.00 O ATOM 86446 H1 WAT 9192 137.890 136.353 151.925 1.00 0.00 H ATOM 86447 H2 WAT 9192 137.488 137.295 153.040 1.00 0.00 H TER 86449 WAT 9192 ATOM 86449 O WAT 9193 14.832 20.540 90.767 1.00 0.00 O ATOM 86450 H1 WAT 9193 14.167 21.064 91.214 1.00 0.00 H ATOM 86451 H2 WAT 9193 15.159 21.112 90.072 1.00 0.00 H TER 86453 WAT 9193 ATOM 86453 O WAT 9194 47.918 66.041 81.063 1.00 0.00 O ATOM 86454 H1 WAT 9194 47.956 66.964 80.814 1.00 0.00 H ATOM 86455 H2 WAT 9194 47.001 65.894 81.295 1.00 0.00 H TER 86457 WAT 9194 ATOM 86457 O WAT 9195 142.689 82.103 125.263 1.00 0.00 O ATOM 86458 H1 WAT 9195 142.642 81.164 125.084 1.00 0.00 H ATOM 86459 H2 WAT 9195 141.814 82.332 125.576 1.00 0.00 H TER 86461 WAT 9195 ATOM 86461 O WAT 9196 88.560 87.552 97.906 1.00 0.00 O ATOM 86462 H1 WAT 9196 88.948 87.675 98.772 1.00 0.00 H ATOM 86463 H2 WAT 9196 88.307 88.433 97.629 1.00 0.00 H TER 86465 WAT 9196 ATOM 86465 O WAT 9197 57.043 42.119 85.617 1.00 0.00 O ATOM 86466 H1 WAT 9197 57.740 41.502 85.838 1.00 0.00 H ATOM 86467 H2 WAT 9197 56.733 42.443 86.462 1.00 0.00 H TER 86469 WAT 9197 ATOM 86469 O WAT 9198 96.957 131.969 65.088 1.00 0.00 O ATOM 86470 H1 WAT 9198 97.023 132.408 64.239 1.00 0.00 H ATOM 86471 H2 WAT 9198 97.829 131.604 65.238 1.00 0.00 H TER 86473 WAT 9198 ATOM 86473 O WAT 9199 109.811 114.334 153.979 1.00 0.00 O ATOM 86474 H1 WAT 9199 109.575 113.422 153.810 1.00 0.00 H ATOM 86475 H2 WAT 9199 108.972 114.792 154.033 1.00 0.00 H TER 86477 WAT 9199 ATOM 86477 O WAT 9200 116.011 8.700 139.862 1.00 0.00 O ATOM 86478 H1 WAT 9200 115.086 8.923 139.972 1.00 0.00 H ATOM 86479 H2 WAT 9200 116.423 8.981 140.679 1.00 0.00 H TER 86481 WAT 9200 ATOM 86481 O WAT 9201 16.036 15.898 157.416 1.00 0.00 O ATOM 86482 H1 WAT 9201 15.575 15.419 156.727 1.00 0.00 H ATOM 86483 H2 WAT 9201 16.902 15.491 157.452 1.00 0.00 H TER 86485 WAT 9201 ATOM 86485 O WAT 9202 49.182 129.200 65.934 1.00 0.00 O ATOM 86486 H1 WAT 9202 49.029 130.109 66.195 1.00 0.00 H ATOM 86487 H2 WAT 9202 48.310 128.858 65.737 1.00 0.00 H TER 86489 WAT 9202 ATOM 86489 O WAT 9203 128.492 42.689 70.256 1.00 0.00 O ATOM 86490 H1 WAT 9203 129.055 42.862 71.010 1.00 0.00 H ATOM 86491 H2 WAT 9203 127.652 42.437 70.637 1.00 0.00 H TER 86493 WAT 9203 ATOM 86493 O WAT 9204 51.018 59.519 83.373 1.00 0.00 O ATOM 86494 H1 WAT 9204 50.309 60.052 83.013 1.00 0.00 H ATOM 86495 H2 WAT 9204 50.912 58.665 82.954 1.00 0.00 H TER 86497 WAT 9204 ATOM 86497 O WAT 9205 76.694 90.257 138.539 1.00 0.00 O ATOM 86498 H1 WAT 9205 77.567 90.433 138.189 1.00 0.00 H ATOM 86499 H2 WAT 9205 76.401 91.100 138.886 1.00 0.00 H TER 86501 WAT 9205 ATOM 86501 O WAT 9206 136.336 47.133 97.240 1.00 0.00 O ATOM 86502 H1 WAT 9206 136.992 46.794 96.631 1.00 0.00 H ATOM 86503 H2 WAT 9206 136.695 47.969 97.537 1.00 0.00 H TER 86505 WAT 9206 ATOM 86505 O WAT 9207 82.597 83.409 152.128 1.00 0.00 O ATOM 86506 H1 WAT 9207 81.742 83.606 151.745 1.00 0.00 H ATOM 86507 H2 WAT 9207 83.223 83.607 151.431 1.00 0.00 H TER 86509 WAT 9207 ATOM 86509 O WAT 9208 4.250 87.755 79.787 1.00 0.00 O ATOM 86510 H1 WAT 9208 4.657 88.515 80.205 1.00 0.00 H ATOM 86511 H2 WAT 9208 4.587 87.004 80.276 1.00 0.00 H TER 86513 WAT 9208 ATOM 86513 O WAT 9209 94.699 44.257 4.359 1.00 0.00 O ATOM 86514 H1 WAT 9209 95.126 43.557 4.851 1.00 0.00 H ATOM 86515 H2 WAT 9209 94.244 44.774 5.024 1.00 0.00 H TER 86517 WAT 9209 ATOM 86517 O WAT 9210 106.402 117.521 21.000 1.00 0.00 O ATOM 86518 H1 WAT 9210 106.684 117.088 21.805 1.00 0.00 H ATOM 86519 H2 WAT 9210 105.619 118.010 21.253 1.00 0.00 H TER 86521 WAT 9210 ATOM 86521 O WAT 9211 55.858 111.145 157.614 1.00 0.00 O ATOM 86522 H1 WAT 9211 55.343 111.648 156.983 1.00 0.00 H ATOM 86523 H2 WAT 9211 56.558 110.752 157.093 1.00 0.00 H TER 86525 WAT 9211 ATOM 86525 O WAT 9212 73.293 109.386 78.638 1.00 0.00 O ATOM 86526 H1 WAT 9212 72.733 110.118 78.897 1.00 0.00 H ATOM 86527 H2 WAT 9212 73.317 108.818 79.408 1.00 0.00 H TER 86529 WAT 9212 ATOM 86529 O WAT 9213 10.795 128.737 117.289 1.00 0.00 O ATOM 86530 H1 WAT 9213 10.035 129.205 116.943 1.00 0.00 H ATOM 86531 H2 WAT 9213 11.117 128.224 116.549 1.00 0.00 H TER 86533 WAT 9213 ATOM 86533 O WAT 9214 112.862 57.639 96.903 1.00 0.00 O ATOM 86534 H1 WAT 9214 112.338 57.490 96.116 1.00 0.00 H ATOM 86535 H2 WAT 9214 112.744 58.569 97.096 1.00 0.00 H TER 86537 WAT 9214 ATOM 86537 O WAT 9215 62.890 141.110 90.217 1.00 0.00 O ATOM 86538 H1 WAT 9215 62.806 140.647 91.051 1.00 0.00 H ATOM 86539 H2 WAT 9215 63.833 141.226 90.101 1.00 0.00 H TER 86541 WAT 9215 ATOM 86541 O WAT 9216 115.157 24.124 69.400 1.00 0.00 O ATOM 86542 H1 WAT 9216 114.398 23.683 69.018 1.00 0.00 H ATOM 86543 H2 WAT 9216 114.791 24.892 69.838 1.00 0.00 H TER 86545 WAT 9216 ATOM 86545 O WAT 9217 1.951 39.716 76.074 1.00 0.00 O ATOM 86546 H1 WAT 9217 1.576 39.251 75.326 1.00 0.00 H ATOM 86547 H2 WAT 9217 2.284 39.024 76.645 1.00 0.00 H TER 86549 WAT 9217 ATOM 86549 O WAT 9218 44.490 81.488 116.588 1.00 0.00 O ATOM 86550 H1 WAT 9218 43.988 80.965 117.213 1.00 0.00 H ATOM 86551 H2 WAT 9218 43.879 82.166 116.299 1.00 0.00 H TER 86553 WAT 9218 ATOM 86553 O WAT 9219 97.304 44.398 135.106 1.00 0.00 O ATOM 86554 H1 WAT 9219 97.483 45.268 134.749 1.00 0.00 H ATOM 86555 H2 WAT 9219 97.099 44.554 136.028 1.00 0.00 H TER 86557 WAT 9219 ATOM 86557 O WAT 9220 132.226 134.267 111.253 1.00 0.00 O ATOM 86558 H1 WAT 9220 132.567 133.631 110.623 1.00 0.00 H ATOM 86559 H2 WAT 9220 131.291 134.321 111.056 1.00 0.00 H TER 86561 WAT 9220 ATOM 86561 O WAT 9221 25.613 48.781 4.378 1.00 0.00 O ATOM 86562 H1 WAT 9221 25.525 49.307 5.173 1.00 0.00 H ATOM 86563 H2 WAT 9221 25.892 47.920 4.690 1.00 0.00 H TER 86565 WAT 9221 ATOM 86565 O WAT 9222 6.943 136.071 68.938 1.00 0.00 O ATOM 86566 H1 WAT 9222 7.775 135.947 69.396 1.00 0.00 H ATOM 86567 H2 WAT 9222 6.298 136.175 69.638 1.00 0.00 H TER 86569 WAT 9222 ATOM 86569 O WAT 9223 141.284 125.036 79.675 1.00 0.00 O ATOM 86570 H1 WAT 9223 141.978 125.628 79.383 1.00 0.00 H ATOM 86571 H2 WAT 9223 140.596 125.616 80.001 1.00 0.00 H TER 86573 WAT 9223 ATOM 86573 O WAT 9224 103.307 67.934 140.776 1.00 0.00 O ATOM 86574 H1 WAT 9224 103.036 68.101 141.679 1.00 0.00 H ATOM 86575 H2 WAT 9224 104.189 68.301 140.719 1.00 0.00 H TER 86577 WAT 9224 ATOM 86577 O WAT 9225 74.045 8.571 94.963 1.00 0.00 O ATOM 86578 H1 WAT 9225 73.255 8.945 94.574 1.00 0.00 H ATOM 86579 H2 WAT 9225 74.732 9.209 94.769 1.00 0.00 H TER 86581 WAT 9225 ATOM 86581 O WAT 9226 2.364 55.433 107.492 1.00 0.00 O ATOM 86582 H1 WAT 9226 2.442 55.634 106.560 1.00 0.00 H ATOM 86583 H2 WAT 9226 3.145 54.917 107.692 1.00 0.00 H TER 86585 WAT 9226 ATOM 86585 O WAT 9227 60.040 64.392 11.944 1.00 0.00 O ATOM 86586 H1 WAT 9227 60.751 64.444 11.305 1.00 0.00 H ATOM 86587 H2 WAT 9227 60.482 64.367 12.793 1.00 0.00 H TER 86589 WAT 9227 ATOM 86589 O WAT 9228 7.673 29.391 13.498 1.00 0.00 O ATOM 86590 H1 WAT 9228 7.787 28.618 12.945 1.00 0.00 H ATOM 86591 H2 WAT 9228 7.310 29.050 14.315 1.00 0.00 H TER 86593 WAT 9228 ATOM 86593 O WAT 9229 77.085 41.486 74.085 1.00 0.00 O ATOM 86594 H1 WAT 9229 77.636 41.024 74.717 1.00 0.00 H ATOM 86595 H2 WAT 9229 77.336 42.405 74.175 1.00 0.00 H TER 86597 WAT 9229 ATOM 86597 O WAT 9230 144.616 135.955 89.325 1.00 0.00 O ATOM 86598 H1 WAT 9230 144.382 136.661 88.722 1.00 0.00 H ATOM 86599 H2 WAT 9230 145.503 135.705 89.068 1.00 0.00 H TER 86601 WAT 9230 ATOM 86601 O WAT 9231 16.222 88.820 8.480 1.00 0.00 O ATOM 86602 H1 WAT 9231 17.023 88.620 8.965 1.00 0.00 H ATOM 86603 H2 WAT 9231 16.102 89.763 8.594 1.00 0.00 H TER 86605 WAT 9231 ATOM 86605 O WAT 9232 141.902 13.509 158.535 1.00 0.00 O ATOM 86606 H1 WAT 9232 141.353 13.002 157.937 1.00 0.00 H ATOM 86607 H2 WAT 9232 141.457 13.447 159.380 1.00 0.00 H TER 86609 WAT 9232 ATOM 86609 O WAT 9233 70.866 57.039 84.322 1.00 0.00 O ATOM 86610 H1 WAT 9233 70.334 57.260 85.086 1.00 0.00 H ATOM 86611 H2 WAT 9233 70.318 57.274 83.573 1.00 0.00 H TER 86613 WAT 9233 ATOM 86613 O WAT 9234 84.702 81.153 92.026 1.00 0.00 O ATOM 86614 H1 WAT 9234 84.112 81.351 91.298 1.00 0.00 H ATOM 86615 H2 WAT 9234 85.520 81.594 91.798 1.00 0.00 H TER 86617 WAT 9234 ATOM 86617 O WAT 9235 65.202 77.297 148.667 1.00 0.00 O ATOM 86618 H1 WAT 9235 64.531 77.084 148.018 1.00 0.00 H ATOM 86619 H2 WAT 9235 64.923 78.137 149.032 1.00 0.00 H TER 86621 WAT 9235 ATOM 86621 O WAT 9236 109.982 74.691 20.888 1.00 0.00 O ATOM 86622 H1 WAT 9236 109.723 75.425 21.446 1.00 0.00 H ATOM 86623 H2 WAT 9236 110.468 75.096 20.170 1.00 0.00 H TER 86625 WAT 9236 ATOM 86625 O WAT 9237 83.259 50.603 84.598 1.00 0.00 O ATOM 86626 H1 WAT 9237 83.078 49.770 85.035 1.00 0.00 H ATOM 86627 H2 WAT 9237 82.621 51.212 84.971 1.00 0.00 H TER 86629 WAT 9237 ATOM 86629 O WAT 9238 26.862 88.350 1.091 1.00 0.00 O ATOM 86630 H1 WAT 9238 26.884 89.095 1.692 1.00 0.00 H ATOM 86631 H2 WAT 9238 27.679 87.881 1.262 1.00 0.00 H TER 86633 WAT 9238 ATOM 86633 O WAT 9239 83.442 83.475 27.392 1.00 0.00 O ATOM 86634 H1 WAT 9239 83.528 84.354 27.023 1.00 0.00 H ATOM 86635 H2 WAT 9239 82.892 83.593 28.167 1.00 0.00 H TER 86637 WAT 9239 ATOM 86637 O WAT 9240 106.724 99.987 84.267 1.00 0.00 O ATOM 86638 H1 WAT 9240 107.244 100.757 84.500 1.00 0.00 H ATOM 86639 H2 WAT 9240 106.715 99.984 83.310 1.00 0.00 H TER 86641 WAT 9240 ATOM 86641 O WAT 9241 28.539 91.042 58.123 1.00 0.00 O ATOM 86642 H1 WAT 9241 28.545 91.753 57.482 1.00 0.00 H ATOM 86643 H2 WAT 9241 27.628 90.987 58.413 1.00 0.00 H TER 86645 WAT 9241 ATOM 86645 O WAT 9242 131.139 118.813 77.209 1.00 0.00 O ATOM 86646 H1 WAT 9242 131.666 119.468 76.751 1.00 0.00 H ATOM 86647 H2 WAT 9242 130.241 119.136 77.137 1.00 0.00 H TER 86649 WAT 9242 ATOM 86649 O WAT 9243 143.470 82.087 150.411 1.00 0.00 O ATOM 86650 H1 WAT 9243 142.830 82.357 151.069 1.00 0.00 H ATOM 86651 H2 WAT 9243 143.064 82.314 149.574 1.00 0.00 H TER 86653 WAT 9243 ATOM 86653 O WAT 9244 13.301 107.627 81.756 1.00 0.00 O ATOM 86654 H1 WAT 9244 12.539 107.082 81.560 1.00 0.00 H ATOM 86655 H2 WAT 9244 13.574 107.971 80.905 1.00 0.00 H TER 86657 WAT 9244 ATOM 86657 O WAT 9245 140.001 6.548 83.224 1.00 0.00 O ATOM 86658 H1 WAT 9245 139.629 6.804 82.380 1.00 0.00 H ATOM 86659 H2 WAT 9245 139.611 7.157 83.852 1.00 0.00 H TER 86661 WAT 9245 ATOM 86661 O WAT 9246 111.189 113.951 5.214 1.00 0.00 O ATOM 86662 H1 WAT 9246 111.003 113.530 4.375 1.00 0.00 H ATOM 86663 H2 WAT 9246 110.695 114.771 5.186 1.00 0.00 H TER 86665 WAT 9246 ATOM 86665 O WAT 9247 10.010 10.073 154.632 1.00 0.00 O ATOM 86666 H1 WAT 9247 10.149 9.628 155.468 1.00 0.00 H ATOM 86667 H2 WAT 9247 10.597 9.627 154.022 1.00 0.00 H TER 86669 WAT 9247 ATOM 86669 O WAT 9248 6.375 0.226 107.425 1.00 0.00 O ATOM 86670 H1 WAT 9248 5.895 -0.436 107.924 1.00 0.00 H ATOM 86671 H2 WAT 9248 5.907 0.285 106.593 1.00 0.00 H TER 86673 WAT 9248 ATOM 86673 O WAT 9249 130.068 39.632 20.775 1.00 0.00 O ATOM 86674 H1 WAT 9249 130.107 40.555 20.526 1.00 0.00 H ATOM 86675 H2 WAT 9249 130.830 39.504 21.339 1.00 0.00 H TER 86677 WAT 9249 ATOM 86677 O WAT 9250 63.288 94.164 142.820 1.00 0.00 O ATOM 86678 H1 WAT 9250 63.042 93.771 141.983 1.00 0.00 H ATOM 86679 H2 WAT 9250 63.258 93.438 143.443 1.00 0.00 H TER 86681 WAT 9250 ATOM 86681 O WAT 9251 112.257 115.723 108.258 1.00 0.00 O ATOM 86682 H1 WAT 9251 111.843 114.919 107.943 1.00 0.00 H ATOM 86683 H2 WAT 9251 112.216 116.321 107.512 1.00 0.00 H TER 86685 WAT 9251 ATOM 86685 O WAT 9252 60.349 83.484 150.266 1.00 0.00 O ATOM 86686 H1 WAT 9252 60.751 83.912 151.022 1.00 0.00 H ATOM 86687 H2 WAT 9252 59.408 83.602 150.396 1.00 0.00 H TER 86689 WAT 9252 ATOM 86689 O WAT 9253 41.851 94.757 130.338 1.00 0.00 O ATOM 86690 H1 WAT 9253 42.209 95.635 130.205 1.00 0.00 H ATOM 86691 H2 WAT 9253 40.905 94.891 130.397 1.00 0.00 H TER 86693 WAT 9253 ATOM 86693 O WAT 9254 44.642 32.829 88.077 1.00 0.00 O ATOM 86694 H1 WAT 9254 45.045 33.415 88.717 1.00 0.00 H ATOM 86695 H2 WAT 9254 43.722 32.784 88.339 1.00 0.00 H TER 86697 WAT 9254 ATOM 86697 O WAT 9255 87.118 25.890 14.701 1.00 0.00 O ATOM 86698 H1 WAT 9255 87.422 25.671 15.582 1.00 0.00 H ATOM 86699 H2 WAT 9255 87.465 25.190 14.147 1.00 0.00 H TER 86701 WAT 9255 ATOM 86701 O WAT 9256 8.882 45.682 2.952 1.00 0.00 O ATOM 86702 H1 WAT 9256 8.542 46.019 3.780 1.00 0.00 H ATOM 86703 H2 WAT 9256 8.767 46.403 2.334 1.00 0.00 H TER 86705 WAT 9256 ATOM 86705 O WAT 9257 27.520 25.208 119.609 1.00 0.00 O ATOM 86706 H1 WAT 9257 26.763 25.203 120.195 1.00 0.00 H ATOM 86707 H2 WAT 9257 27.197 24.818 118.797 1.00 0.00 H TER 86709 WAT 9257 ATOM 86709 O WAT 9258 120.688 81.594 112.592 1.00 0.00 O ATOM 86710 H1 WAT 9258 119.984 81.667 113.237 1.00 0.00 H ATOM 86711 H2 WAT 9258 121.048 80.718 112.729 1.00 0.00 H TER 86713 WAT 9258 ATOM 86713 O WAT 9259 145.075 18.109 5.359 1.00 0.00 O ATOM 86714 H1 WAT 9259 145.538 18.813 4.906 1.00 0.00 H ATOM 86715 H2 WAT 9259 145.385 17.308 4.936 1.00 0.00 H TER 86717 WAT 9259 ATOM 86717 O WAT 9260 104.146 112.526 136.719 1.00 0.00 O ATOM 86718 H1 WAT 9260 105.071 112.318 136.851 1.00 0.00 H ATOM 86719 H2 WAT 9260 104.153 113.300 136.155 1.00 0.00 H TER 86721 WAT 9260 ATOM 86721 O WAT 9261 89.252 20.909 -0.174 1.00 0.00 O ATOM 86722 H1 WAT 9261 89.776 21.145 0.591 1.00 0.00 H ATOM 86723 H2 WAT 9261 88.416 21.355 -0.039 1.00 0.00 H TER 86725 WAT 9261 ATOM 86725 O WAT 9262 67.144 74.784 97.154 1.00 0.00 O ATOM 86726 H1 WAT 9262 67.919 74.389 97.552 1.00 0.00 H ATOM 86727 H2 WAT 9262 67.488 75.488 96.604 1.00 0.00 H TER 86729 WAT 9262 ATOM 86729 O WAT 9263 14.639 86.585 92.672 1.00 0.00 O ATOM 86730 H1 WAT 9263 14.671 87.513 92.905 1.00 0.00 H ATOM 86731 H2 WAT 9263 14.654 86.126 93.512 1.00 0.00 H TER 86733 WAT 9263 ATOM 86733 O WAT 9264 88.492 135.681 63.994 1.00 0.00 O ATOM 86734 H1 WAT 9264 88.146 134.820 63.760 1.00 0.00 H ATOM 86735 H2 WAT 9264 87.812 136.295 63.720 1.00 0.00 H TER 86737 WAT 9264 ATOM 86737 O WAT 9265 71.522 54.462 135.656 1.00 0.00 O ATOM 86738 H1 WAT 9265 71.488 55.116 134.958 1.00 0.00 H ATOM 86739 H2 WAT 9265 70.631 54.113 135.701 1.00 0.00 H TER 86741 WAT 9265 ATOM 86741 O WAT 9266 97.640 117.286 106.830 1.00 0.00 O ATOM 86742 H1 WAT 9266 96.997 117.126 106.139 1.00 0.00 H ATOM 86743 H2 WAT 9266 97.535 118.213 107.044 1.00 0.00 H TER 86745 WAT 9266 ATOM 86745 O WAT 9267 9.103 60.747 106.506 1.00 0.00 O ATOM 86746 H1 WAT 9267 9.431 60.184 107.207 1.00 0.00 H ATOM 86747 H2 WAT 9267 8.486 60.195 106.025 1.00 0.00 H TER 86749 WAT 9267 ATOM 86749 O WAT 9268 126.914 99.715 133.017 1.00 0.00 O ATOM 86750 H1 WAT 9268 127.860 99.631 133.143 1.00 0.00 H ATOM 86751 H2 WAT 9268 126.785 99.577 132.079 1.00 0.00 H TER 86753 WAT 9268 ATOM 86753 O WAT 9269 15.281 123.739 4.136 1.00 0.00 O ATOM 86754 H1 WAT 9269 15.247 124.083 5.029 1.00 0.00 H ATOM 86755 H2 WAT 9269 16.128 123.296 4.082 1.00 0.00 H TER 86757 WAT 9269 ATOM 86757 O WAT 9270 9.066 34.180 57.186 1.00 0.00 O ATOM 86758 H1 WAT 9270 8.661 34.944 56.775 1.00 0.00 H ATOM 86759 H2 WAT 9270 9.114 33.529 56.485 1.00 0.00 H TER 86761 WAT 9270 ATOM 86761 O WAT 9271 21.804 94.606 24.519 1.00 0.00 O ATOM 86762 H1 WAT 9271 22.555 95.096 24.184 1.00 0.00 H ATOM 86763 H2 WAT 9271 21.370 95.213 25.118 1.00 0.00 H TER 86765 WAT 9271 ATOM 86765 O WAT 9272 43.192 81.542 93.621 1.00 0.00 O ATOM 86766 H1 WAT 9272 44.088 81.864 93.518 1.00 0.00 H ATOM 86767 H2 WAT 9272 42.831 81.551 92.735 1.00 0.00 H TER 86769 WAT 9272 ATOM 86769 O WAT 9273 66.420 3.280 133.133 1.00 0.00 O ATOM 86770 H1 WAT 9273 67.143 3.731 132.698 1.00 0.00 H ATOM 86771 H2 WAT 9273 66.763 3.054 133.998 1.00 0.00 H TER 86773 WAT 9273 ATOM 86773 O WAT 9274 136.353 95.126 93.261 1.00 0.00 O ATOM 86774 H1 WAT 9274 136.478 94.482 93.958 1.00 0.00 H ATOM 86775 H2 WAT 9274 136.503 95.971 93.684 1.00 0.00 H TER 86777 WAT 9274 ATOM 86777 O WAT 9275 21.686 26.154 135.177 1.00 0.00 O ATOM 86778 H1 WAT 9275 21.924 27.077 135.094 1.00 0.00 H ATOM 86779 H2 WAT 9275 22.323 25.692 134.632 1.00 0.00 H TER 86781 WAT 9275 ATOM 86781 O WAT 9276 78.705 97.184 119.753 1.00 0.00 O ATOM 86782 H1 WAT 9276 79.090 97.979 119.384 1.00 0.00 H ATOM 86783 H2 WAT 9276 78.721 96.554 119.033 1.00 0.00 H TER 86785 WAT 9276 ATOM 86785 O WAT 9277 64.111 91.907 67.221 1.00 0.00 O ATOM 86786 H1 WAT 9277 64.591 91.710 68.026 1.00 0.00 H ATOM 86787 H2 WAT 9277 63.549 92.647 67.452 1.00 0.00 H TER 86789 WAT 9277 ATOM 86789 O WAT 9278 138.734 52.282 89.012 1.00 0.00 O ATOM 86790 H1 WAT 9278 138.311 51.722 89.663 1.00 0.00 H ATOM 86791 H2 WAT 9278 139.342 51.702 88.555 1.00 0.00 H TER 86793 WAT 9278 ATOM 86793 O WAT 9279 102.374 10.539 11.693 1.00 0.00 O ATOM 86794 H1 WAT 9279 102.321 10.615 10.741 1.00 0.00 H ATOM 86795 H2 WAT 9279 101.472 10.653 11.993 1.00 0.00 H TER 86797 WAT 9279 ATOM 86797 O WAT 9280 55.235 126.319 122.960 1.00 0.00 O ATOM 86798 H1 WAT 9280 54.371 126.680 123.159 1.00 0.00 H ATOM 86799 H2 WAT 9280 55.060 125.422 122.675 1.00 0.00 H TER 86801 WAT 9280 ATOM 86801 O WAT 9281 135.196 31.631 137.438 1.00 0.00 O ATOM 86802 H1 WAT 9281 134.822 31.804 136.574 1.00 0.00 H ATOM 86803 H2 WAT 9281 135.687 30.817 137.328 1.00 0.00 H TER 86805 WAT 9281 ATOM 86805 O WAT 9282 52.152 114.935 104.480 1.00 0.00 O ATOM 86806 H1 WAT 9282 51.896 114.016 104.403 1.00 0.00 H ATOM 86807 H2 WAT 9282 51.598 115.279 105.180 1.00 0.00 H TER 86809 WAT 9282 ATOM 86809 O WAT 9283 120.120 115.257 6.067 1.00 0.00 O ATOM 86810 H1 WAT 9283 120.282 115.697 6.901 1.00 0.00 H ATOM 86811 H2 WAT 9283 120.175 114.324 6.274 1.00 0.00 H TER 86813 WAT 9283 ATOM 86813 O WAT 9284 54.971 123.921 66.851 1.00 0.00 O ATOM 86814 H1 WAT 9284 55.458 123.254 67.335 1.00 0.00 H ATOM 86815 H2 WAT 9284 55.610 124.614 66.689 1.00 0.00 H TER 86817 WAT 9284 ATOM 86817 O WAT 9285 141.815 56.015 74.642 1.00 0.00 O ATOM 86818 H1 WAT 9285 142.051 56.914 74.414 1.00 0.00 H ATOM 86819 H2 WAT 9285 142.597 55.662 75.066 1.00 0.00 H TER 86821 WAT 9285 ATOM 86821 O WAT 9286 41.406 127.455 90.001 1.00 0.00 O ATOM 86822 H1 WAT 9286 41.382 126.507 89.867 1.00 0.00 H ATOM 86823 H2 WAT 9286 40.936 127.592 90.824 1.00 0.00 H TER 86825 WAT 9286 ATOM 86825 O WAT 9287 44.636 46.146 6.111 1.00 0.00 O ATOM 86826 H1 WAT 9287 43.897 45.621 5.804 1.00 0.00 H ATOM 86827 H2 WAT 9287 45.410 45.664 5.818 1.00 0.00 H TER 86829 WAT 9287 ATOM 86829 O WAT 9288 131.804 99.250 58.602 1.00 0.00 O ATOM 86830 H1 WAT 9288 132.217 98.386 58.612 1.00 0.00 H ATOM 86831 H2 WAT 9288 131.010 99.130 58.082 1.00 0.00 H TER 86833 WAT 9288 ATOM 86833 O WAT 9289 66.357 23.786 115.907 1.00 0.00 O ATOM 86834 H1 WAT 9289 66.684 23.047 116.421 1.00 0.00 H ATOM 86835 H2 WAT 9289 65.431 23.850 116.141 1.00 0.00 H TER 86837 WAT 9289 ATOM 86837 O WAT 9290 98.333 25.753 17.627 1.00 0.00 O ATOM 86838 H1 WAT 9290 97.851 26.072 16.864 1.00 0.00 H ATOM 86839 H2 WAT 9290 98.066 24.838 17.714 1.00 0.00 H TER 86841 WAT 9290 ATOM 86841 O WAT 9291 18.391 28.228 61.701 1.00 0.00 O ATOM 86842 H1 WAT 9291 18.323 27.300 61.926 1.00 0.00 H ATOM 86843 H2 WAT 9291 19.168 28.532 62.171 1.00 0.00 H TER 86845 WAT 9291 ATOM 86845 O WAT 9292 65.577 62.607 111.842 1.00 0.00 O ATOM 86846 H1 WAT 9292 65.549 62.332 110.926 1.00 0.00 H ATOM 86847 H2 WAT 9292 64.931 62.051 112.279 1.00 0.00 H TER 86849 WAT 9292 ATOM 86849 O WAT 9293 125.217 58.393 140.035 1.00 0.00 O ATOM 86850 H1 WAT 9293 124.673 58.127 140.777 1.00 0.00 H ATOM 86851 H2 WAT 9293 124.604 58.803 139.425 1.00 0.00 H TER 86853 WAT 9293 ATOM 86853 O WAT 9294 76.070 25.583 90.925 1.00 0.00 O ATOM 86854 H1 WAT 9294 75.335 26.127 91.209 1.00 0.00 H ATOM 86855 H2 WAT 9294 76.721 25.678 91.619 1.00 0.00 H TER 86857 WAT 9294 ATOM 86857 O WAT 9295 96.390 101.639 23.856 1.00 0.00 O ATOM 86858 H1 WAT 9295 97.083 100.979 23.885 1.00 0.00 H ATOM 86859 H2 WAT 9295 95.578 101.136 23.918 1.00 0.00 H TER 86861 WAT 9295 ATOM 86861 O WAT 9296 138.271 38.892 87.002 1.00 0.00 O ATOM 86862 H1 WAT 9296 138.338 38.964 86.050 1.00 0.00 H ATOM 86863 H2 WAT 9296 138.698 39.683 87.332 1.00 0.00 H TER 86865 WAT 9296 ATOM 86865 O WAT 9297 80.051 140.013 126.450 1.00 0.00 O ATOM 86866 H1 WAT 9297 80.807 139.733 125.935 1.00 0.00 H ATOM 86867 H2 WAT 9297 80.387 140.715 127.007 1.00 0.00 H TER 86869 WAT 9297 ATOM 86869 O WAT 9298 112.330 89.292 120.149 1.00 0.00 O ATOM 86870 H1 WAT 9298 111.497 89.611 120.496 1.00 0.00 H ATOM 86871 H2 WAT 9298 112.992 89.839 120.573 1.00 0.00 H TER 86873 WAT 9298 ATOM 86873 O WAT 9299 0.111 49.645 68.199 1.00 0.00 O ATOM 86874 H1 WAT 9299 0.463 50.439 68.599 1.00 0.00 H ATOM 86875 H2 WAT 9299 -0.304 49.947 67.391 1.00 0.00 H TER 86877 WAT 9299 ATOM 86877 O WAT 9300 57.404 110.841 19.389 1.00 0.00 O ATOM 86878 H1 WAT 9300 57.715 110.207 20.036 1.00 0.00 H ATOM 86879 H2 WAT 9300 57.881 110.621 18.589 1.00 0.00 H TER 86881 WAT 9300 ATOM 86881 O WAT 9301 12.464 105.363 71.227 1.00 0.00 O ATOM 86882 H1 WAT 9301 12.141 106.241 71.023 1.00 0.00 H ATOM 86883 H2 WAT 9301 13.345 105.339 70.852 1.00 0.00 H TER 86885 WAT 9301 ATOM 86885 O WAT 9302 117.130 89.918 154.453 1.00 0.00 O ATOM 86886 H1 WAT 9302 117.015 90.199 155.361 1.00 0.00 H ATOM 86887 H2 WAT 9302 117.098 88.963 154.492 1.00 0.00 H TER 86889 WAT 9302 ATOM 86889 O WAT 9303 30.681 142.460 55.330 1.00 0.00 O ATOM 86890 H1 WAT 9303 30.636 143.220 54.749 1.00 0.00 H ATOM 86891 H2 WAT 9303 30.782 142.835 56.206 1.00 0.00 H TER 86893 WAT 9303 ATOM 86893 O WAT 9304 65.172 3.621 22.459 1.00 0.00 O ATOM 86894 H1 WAT 9304 64.840 4.442 22.823 1.00 0.00 H ATOM 86895 H2 WAT 9304 64.699 3.517 21.633 1.00 0.00 H TER 86897 WAT 9304 ATOM 86897 O WAT 9305 97.950 42.038 151.161 1.00 0.00 O ATOM 86898 H1 WAT 9305 97.484 42.830 150.896 1.00 0.00 H ATOM 86899 H2 WAT 9305 97.303 41.338 151.075 1.00 0.00 H TER 86901 WAT 9305 ATOM 86901 O WAT 9306 14.275 64.804 119.273 1.00 0.00 O ATOM 86902 H1 WAT 9306 14.310 63.936 118.871 1.00 0.00 H ATOM 86903 H2 WAT 9306 15.184 64.999 119.502 1.00 0.00 H TER 86905 WAT 9306 ATOM 86905 O WAT 9307 108.412 100.892 62.734 1.00 0.00 O ATOM 86906 H1 WAT 9307 108.104 100.863 63.640 1.00 0.00 H ATOM 86907 H2 WAT 9307 107.802 100.330 62.256 1.00 0.00 H TER 86909 WAT 9307 ATOM 86909 O WAT 9308 83.419 75.062 96.955 1.00 0.00 O ATOM 86910 H1 WAT 9308 84.048 74.822 96.274 1.00 0.00 H ATOM 86911 H2 WAT 9308 83.636 74.493 97.693 1.00 0.00 H TER 86913 WAT 9308 ATOM 86913 O WAT 9309 35.001 141.606 6.664 1.00 0.00 O ATOM 86914 H1 WAT 9309 35.386 141.751 7.528 1.00 0.00 H ATOM 86915 H2 WAT 9309 35.287 142.358 6.145 1.00 0.00 H TER 86917 WAT 9309 ATOM 86917 O WAT 9310 54.206 89.818 122.750 1.00 0.00 O ATOM 86918 H1 WAT 9310 53.282 89.848 122.501 1.00 0.00 H ATOM 86919 H2 WAT 9310 54.279 90.435 123.478 1.00 0.00 H TER 86921 WAT 9310 ATOM 86921 O WAT 9311 126.770 97.586 113.022 1.00 0.00 O ATOM 86922 H1 WAT 9311 125.971 97.144 113.310 1.00 0.00 H ATOM 86923 H2 WAT 9311 126.678 97.654 112.072 1.00 0.00 H TER 86925 WAT 9311 ATOM 86925 O WAT 9312 141.479 138.260 4.344 1.00 0.00 O ATOM 86926 H1 WAT 9312 141.915 139.075 4.097 1.00 0.00 H ATOM 86927 H2 WAT 9312 141.166 138.416 5.235 1.00 0.00 H TER 86929 WAT 9312 ATOM 86929 O WAT 9313 40.266 118.394 152.423 1.00 0.00 O ATOM 86930 H1 WAT 9313 40.356 119.292 152.105 1.00 0.00 H ATOM 86931 H2 WAT 9313 40.510 118.442 153.347 1.00 0.00 H TER 86933 WAT 9313 ATOM 86933 O WAT 9314 103.526 124.448 58.128 1.00 0.00 O ATOM 86934 H1 WAT 9314 103.937 123.881 58.780 1.00 0.00 H ATOM 86935 H2 WAT 9314 104.258 124.898 57.706 1.00 0.00 H TER 86937 WAT 9314 ATOM 86937 O WAT 9315 85.795 42.924 5.085 1.00 0.00 O ATOM 86938 H1 WAT 9315 85.412 42.502 4.316 1.00 0.00 H ATOM 86939 H2 WAT 9315 85.628 43.857 4.954 1.00 0.00 H TER 86941 WAT 9315 ATOM 86941 O WAT 9316 145.115 121.996 0.262 1.00 0.00 O ATOM 86942 H1 WAT 9316 145.720 121.254 0.241 1.00 0.00 H ATOM 86943 H2 WAT 9316 144.693 121.986 -0.597 1.00 0.00 H TER 86945 WAT 9316 ATOM 86945 O WAT 9317 33.955 25.461 126.745 1.00 0.00 O ATOM 86946 H1 WAT 9317 34.316 25.696 127.599 1.00 0.00 H ATOM 86947 H2 WAT 9317 33.580 26.276 126.411 1.00 0.00 H TER 86949 WAT 9317 ATOM 86949 O WAT 9318 24.678 5.669 74.184 1.00 0.00 O ATOM 86950 H1 WAT 9318 25.545 5.293 74.340 1.00 0.00 H ATOM 86951 H2 WAT 9318 24.561 5.615 73.236 1.00 0.00 H TER 86953 WAT 9318 ATOM 86953 O WAT 9319 77.454 136.703 105.648 1.00 0.00 O ATOM 86954 H1 WAT 9319 76.576 136.378 105.450 1.00 0.00 H ATOM 86955 H2 WAT 9319 78.038 135.991 105.387 1.00 0.00 H TER 86957 WAT 9319 ATOM 86957 O WAT 9320 112.451 37.481 101.201 1.00 0.00 O ATOM 86958 H1 WAT 9320 112.976 37.142 100.475 1.00 0.00 H ATOM 86959 H2 WAT 9320 113.014 37.386 101.969 1.00 0.00 H TER 86961 WAT 9320 ATOM 86961 O WAT 9321 48.639 66.252 6.794 1.00 0.00 O ATOM 86962 H1 WAT 9321 48.450 66.465 5.880 1.00 0.00 H ATOM 86963 H2 WAT 9321 48.265 66.979 7.292 1.00 0.00 H TER 86965 WAT 9321 ATOM 86965 O WAT 9322 32.781 95.801 109.400 1.00 0.00 O ATOM 86966 H1 WAT 9322 33.577 96.332 109.429 1.00 0.00 H ATOM 86967 H2 WAT 9322 32.991 95.027 109.922 1.00 0.00 H TER 86969 WAT 9322 ATOM 86969 O WAT 9323 145.678 82.297 0.927 1.00 0.00 O ATOM 86970 H1 WAT 9323 145.389 83.116 0.525 1.00 0.00 H ATOM 86971 H2 WAT 9323 145.024 82.118 1.603 1.00 0.00 H TER 86973 WAT 9323 ATOM 86973 O WAT 9324 132.817 62.418 77.359 1.00 0.00 O ATOM 86974 H1 WAT 9324 131.938 62.764 77.509 1.00 0.00 H ATOM 86975 H2 WAT 9324 132.954 61.795 78.073 1.00 0.00 H TER 86977 WAT 9324 ATOM 86977 O WAT 9325 95.621 78.355 75.808 1.00 0.00 O ATOM 86978 H1 WAT 9325 96.078 78.021 75.036 1.00 0.00 H ATOM 86979 H2 WAT 9325 95.921 79.260 75.891 1.00 0.00 H TER 86981 WAT 9325 ATOM 86981 O WAT 9326 134.405 134.354 25.074 1.00 0.00 O ATOM 86982 H1 WAT 9326 134.156 134.873 24.309 1.00 0.00 H ATOM 86983 H2 WAT 9326 133.572 134.075 25.455 1.00 0.00 H TER 86985 WAT 9326 ATOM 86985 O WAT 9327 4.858 125.811 14.267 1.00 0.00 O ATOM 86986 H1 WAT 9327 5.136 126.049 13.383 1.00 0.00 H ATOM 86987 H2 WAT 9327 5.483 125.140 14.542 1.00 0.00 H TER 86989 WAT 9327 ATOM 86989 O WAT 9328 21.251 86.393 61.234 1.00 0.00 O ATOM 86990 H1 WAT 9328 21.171 85.674 60.607 1.00 0.00 H ATOM 86991 H2 WAT 9328 20.885 87.151 60.778 1.00 0.00 H TER 86993 WAT 9328 ATOM 86993 O WAT 9329 88.304 16.694 117.935 1.00 0.00 O ATOM 86994 H1 WAT 9329 89.002 16.464 118.548 1.00 0.00 H ATOM 86995 H2 WAT 9329 87.696 17.222 118.452 1.00 0.00 H TER 86997 WAT 9329 ATOM 86997 O WAT 9330 24.107 79.769 144.088 1.00 0.00 O ATOM 86998 H1 WAT 9330 23.875 78.863 143.884 1.00 0.00 H ATOM 86999 H2 WAT 9330 24.156 80.202 143.236 1.00 0.00 H TER 87001 WAT 9330 ATOM 87001 O WAT 9331 89.314 94.465 130.200 1.00 0.00 O ATOM 87002 H1 WAT 9331 88.383 94.316 130.032 1.00 0.00 H ATOM 87003 H2 WAT 9331 89.332 95.201 130.813 1.00 0.00 H TER 87005 WAT 9331 ATOM 87005 O WAT 9332 126.151 41.241 61.204 1.00 0.00 O ATOM 87006 H1 WAT 9332 126.586 40.392 61.131 1.00 0.00 H ATOM 87007 H2 WAT 9332 125.356 41.149 60.679 1.00 0.00 H TER 87009 WAT 9332 ATOM 87009 O WAT 9333 140.562 57.758 17.566 1.00 0.00 O ATOM 87010 H1 WAT 9333 140.723 57.256 18.365 1.00 0.00 H ATOM 87011 H2 WAT 9333 141.338 57.607 17.027 1.00 0.00 H TER 87013 WAT 9333 ATOM 87013 O WAT 9334 17.943 112.579 151.579 1.00 0.00 O ATOM 87014 H1 WAT 9334 18.136 113.413 152.007 1.00 0.00 H ATOM 87015 H2 WAT 9334 17.466 112.822 150.785 1.00 0.00 H TER 87017 WAT 9334 ATOM 87017 O WAT 9335 117.788 66.334 129.475 1.00 0.00 O ATOM 87018 H1 WAT 9335 118.132 66.624 128.630 1.00 0.00 H ATOM 87019 H2 WAT 9335 118.002 65.401 129.513 1.00 0.00 H TER 87021 WAT 9335 ATOM 87021 O WAT 9336 65.070 24.861 105.642 1.00 0.00 O ATOM 87022 H1 WAT 9336 64.566 24.292 105.060 1.00 0.00 H ATOM 87023 H2 WAT 9336 64.838 25.748 105.368 1.00 0.00 H TER 87025 WAT 9336 ATOM 87025 O WAT 9337 43.268 102.067 84.894 1.00 0.00 O ATOM 87026 H1 WAT 9337 43.659 102.621 84.219 1.00 0.00 H ATOM 87027 H2 WAT 9337 43.932 101.401 85.072 1.00 0.00 H TER 87029 WAT 9337 ATOM 87029 O WAT 9338 68.119 89.114 154.300 1.00 0.00 O ATOM 87030 H1 WAT 9338 68.549 89.761 153.741 1.00 0.00 H ATOM 87031 H2 WAT 9338 67.438 88.734 153.745 1.00 0.00 H TER 87033 WAT 9338 ATOM 87033 O WAT 9339 139.298 129.086 85.789 1.00 0.00 O ATOM 87034 H1 WAT 9339 139.687 129.910 85.495 1.00 0.00 H ATOM 87035 H2 WAT 9339 139.987 128.667 86.305 1.00 0.00 H TER 87037 WAT 9339 ATOM 87037 O WAT 9340 55.473 96.577 145.703 1.00 0.00 O ATOM 87038 H1 WAT 9340 56.422 96.555 145.583 1.00 0.00 H ATOM 87039 H2 WAT 9340 55.145 97.046 144.936 1.00 0.00 H TER 87041 WAT 9340 ATOM 87041 O WAT 9341 94.214 93.518 68.130 1.00 0.00 O ATOM 87042 H1 WAT 9341 94.712 93.766 67.350 1.00 0.00 H ATOM 87043 H2 WAT 9341 93.369 93.955 68.024 1.00 0.00 H TER 87045 WAT 9341 ATOM 87045 O WAT 9342 30.811 75.257 98.181 1.00 0.00 O ATOM 87046 H1 WAT 9342 31.489 74.737 97.750 1.00 0.00 H ATOM 87047 H2 WAT 9342 30.513 75.867 97.506 1.00 0.00 H TER 87049 WAT 9342 ATOM 87049 O WAT 9343 116.597 21.803 84.905 1.00 0.00 O ATOM 87050 H1 WAT 9343 117.469 21.470 84.690 1.00 0.00 H ATOM 87051 H2 WAT 9343 116.473 21.571 85.825 1.00 0.00 H TER 87053 WAT 9343 ATOM 87053 O WAT 9344 64.677 40.550 85.061 1.00 0.00 O ATOM 87054 H1 WAT 9344 64.508 39.804 84.486 1.00 0.00 H ATOM 87055 H2 WAT 9344 64.595 41.315 84.492 1.00 0.00 H TER 87057 WAT 9344 ATOM 87057 O WAT 9345 131.539 100.601 104.667 1.00 0.00 O ATOM 87058 H1 WAT 9345 131.793 100.504 103.750 1.00 0.00 H ATOM 87059 H2 WAT 9345 131.972 101.406 104.951 1.00 0.00 H TER 87061 WAT 9345 ATOM 87061 O WAT 9346 63.253 121.487 109.325 1.00 0.00 O ATOM 87062 H1 WAT 9346 63.593 122.055 108.633 1.00 0.00 H ATOM 87063 H2 WAT 9346 63.715 120.658 109.203 1.00 0.00 H TER 87065 WAT 9346 ATOM 87065 O WAT 9347 38.244 131.248 7.959 1.00 0.00 O ATOM 87066 H1 WAT 9347 37.730 131.453 7.178 1.00 0.00 H ATOM 87067 H2 WAT 9347 39.000 131.833 7.908 1.00 0.00 H TER 87069 WAT 9347 ATOM 87069 O WAT 9348 9.456 67.213 89.573 1.00 0.00 O ATOM 87070 H1 WAT 9348 10.159 66.757 89.110 1.00 0.00 H ATOM 87071 H2 WAT 9348 9.637 67.054 90.500 1.00 0.00 H TER 87073 WAT 9348 ATOM 87073 O WAT 9349 100.931 15.140 81.623 1.00 0.00 O ATOM 87074 H1 WAT 9349 100.200 15.702 81.364 1.00 0.00 H ATOM 87075 H2 WAT 9349 101.707 15.583 81.277 1.00 0.00 H TER 87077 WAT 9349 ATOM 87077 O WAT 9350 5.918 16.329 56.511 1.00 0.00 O ATOM 87078 H1 WAT 9350 5.459 15.670 55.991 1.00 0.00 H ATOM 87079 H2 WAT 9350 5.585 16.208 57.400 1.00 0.00 H TER 87081 WAT 9350 ATOM 87081 O WAT 9351 80.727 37.626 93.246 1.00 0.00 O ATOM 87082 H1 WAT 9351 80.880 37.991 94.117 1.00 0.00 H ATOM 87083 H2 WAT 9351 80.560 36.696 93.402 1.00 0.00 H TER 87085 WAT 9351 ATOM 87085 O WAT 9352 127.854 19.181 144.204 1.00 0.00 O ATOM 87086 H1 WAT 9352 128.480 19.633 143.639 1.00 0.00 H ATOM 87087 H2 WAT 9352 128.195 19.307 145.090 1.00 0.00 H TER 87089 WAT 9352 ATOM 87089 O WAT 9353 114.952 18.040 135.581 1.00 0.00 O ATOM 87090 H1 WAT 9353 114.439 17.249 135.413 1.00 0.00 H ATOM 87091 H2 WAT 9353 115.673 17.994 134.953 1.00 0.00 H TER 87093 WAT 9353 ATOM 87093 O WAT 9354 3.453 54.028 134.117 1.00 0.00 O ATOM 87094 H1 WAT 9354 3.015 54.865 133.968 1.00 0.00 H ATOM 87095 H2 WAT 9354 4.112 53.976 133.425 1.00 0.00 H TER 87097 WAT 9354 ATOM 87097 O WAT 9355 44.084 65.903 16.147 1.00 0.00 O ATOM 87098 H1 WAT 9355 43.240 66.176 16.506 1.00 0.00 H ATOM 87099 H2 WAT 9355 43.989 66.013 15.201 1.00 0.00 H TER 87101 WAT 9355 ATOM 87101 O WAT 9356 79.033 89.425 61.645 1.00 0.00 O ATOM 87102 H1 WAT 9356 78.718 90.275 61.336 1.00 0.00 H ATOM 87103 H2 WAT 9356 78.419 88.792 61.273 1.00 0.00 H TER 87105 WAT 9356 ATOM 87105 O WAT 9357 6.651 14.788 97.334 1.00 0.00 O ATOM 87106 H1 WAT 9357 6.204 15.355 97.962 1.00 0.00 H ATOM 87107 H2 WAT 9357 5.981 14.576 96.684 1.00 0.00 H TER 87109 WAT 9357 ATOM 87109 O WAT 9358 123.495 114.570 1.711 1.00 0.00 O ATOM 87110 H1 WAT 9358 122.606 114.624 1.361 1.00 0.00 H ATOM 87111 H2 WAT 9358 123.986 115.230 1.221 1.00 0.00 H TER 87113 WAT 9358 ATOM 87113 O WAT 9359 4.028 7.466 106.561 1.00 0.00 O ATOM 87114 H1 WAT 9359 3.434 6.772 106.847 1.00 0.00 H ATOM 87115 H2 WAT 9359 4.895 7.165 106.831 1.00 0.00 H TER 87117 WAT 9359 ATOM 87117 O WAT 9360 120.754 2.052 153.700 1.00 0.00 O ATOM 87118 H1 WAT 9360 121.461 2.165 153.065 1.00 0.00 H ATOM 87119 H2 WAT 9360 120.295 2.892 153.699 1.00 0.00 H TER 87121 WAT 9360 ATOM 87121 O WAT 9361 117.842 40.860 82.609 1.00 0.00 O ATOM 87122 H1 WAT 9361 117.889 40.831 81.654 1.00 0.00 H ATOM 87123 H2 WAT 9361 117.856 41.794 82.821 1.00 0.00 H TER 87125 WAT 9361 ATOM 87125 O WAT 9362 93.948 52.238 8.028 1.00 0.00 O ATOM 87126 H1 WAT 9362 93.942 53.050 7.522 1.00 0.00 H ATOM 87127 H2 WAT 9362 93.087 52.210 8.447 1.00 0.00 H TER 87129 WAT 9362 ATOM 87129 O WAT 9363 19.340 26.663 150.386 1.00 0.00 O ATOM 87130 H1 WAT 9363 19.460 27.164 149.580 1.00 0.00 H ATOM 87131 H2 WAT 9363 18.479 26.931 150.708 1.00 0.00 H TER 87133 WAT 9363 ATOM 87133 O WAT 9364 134.645 47.480 76.369 1.00 0.00 O ATOM 87134 H1 WAT 9364 134.209 47.512 75.517 1.00 0.00 H ATOM 87135 H2 WAT 9364 135.478 47.041 76.195 1.00 0.00 H TER 87137 WAT 9364 ATOM 87137 O WAT 9365 53.181 82.324 127.074 1.00 0.00 O ATOM 87138 H1 WAT 9365 53.917 82.617 126.535 1.00 0.00 H ATOM 87139 H2 WAT 9365 52.452 82.242 126.460 1.00 0.00 H TER 87141 WAT 9365 ATOM 87141 O WAT 9366 17.138 25.943 114.237 1.00 0.00 O ATOM 87142 H1 WAT 9366 16.754 25.189 114.685 1.00 0.00 H ATOM 87143 H2 WAT 9366 16.388 26.494 114.012 1.00 0.00 H TER 87145 WAT 9366 ATOM 87145 O WAT 9367 75.477 76.074 126.891 1.00 0.00 O ATOM 87146 H1 WAT 9367 75.826 76.124 126.001 1.00 0.00 H ATOM 87147 H2 WAT 9367 74.539 76.232 126.789 1.00 0.00 H TER 87149 WAT 9367 ATOM 87149 O WAT 9368 144.188 50.498 121.644 1.00 0.00 O ATOM 87150 H1 WAT 9368 143.334 50.437 122.071 1.00 0.00 H ATOM 87151 H2 WAT 9368 144.806 50.161 122.293 1.00 0.00 H TER 87153 WAT 9368 ATOM 87153 O WAT 9369 13.635 135.785 153.618 1.00 0.00 O ATOM 87154 H1 WAT 9369 13.478 136.679 153.922 1.00 0.00 H ATOM 87155 H2 WAT 9369 12.870 135.292 153.917 1.00 0.00 H TER 87157 WAT 9369 ATOM 87157 O WAT 9370 133.872 2.976 96.239 1.00 0.00 O ATOM 87158 H1 WAT 9370 133.158 2.338 96.252 1.00 0.00 H ATOM 87159 H2 WAT 9370 134.474 2.648 95.571 1.00 0.00 H TER 87161 WAT 9370 ATOM 87161 O WAT 9371 63.534 78.009 64.521 1.00 0.00 O ATOM 87162 H1 WAT 9371 62.820 77.842 63.905 1.00 0.00 H ATOM 87163 H2 WAT 9371 64.095 77.237 64.451 1.00 0.00 H TER 87165 WAT 9371 ATOM 87165 O WAT 9372 56.345 42.952 154.152 1.00 0.00 O ATOM 87166 H1 WAT 9372 55.773 43.297 153.467 1.00 0.00 H ATOM 87167 H2 WAT 9372 56.868 42.282 153.712 1.00 0.00 H TER 87169 WAT 9372 ATOM 87169 O WAT 9373 105.248 73.647 151.590 1.00 0.00 O ATOM 87170 H1 WAT 9373 104.311 73.725 151.410 1.00 0.00 H ATOM 87171 H2 WAT 9373 105.638 73.436 150.741 1.00 0.00 H TER 87173 WAT 9373 ATOM 87173 O WAT 9374 29.503 70.071 72.717 1.00 0.00 O ATOM 87174 H1 WAT 9374 29.314 70.176 71.785 1.00 0.00 H ATOM 87175 H2 WAT 9374 30.433 69.847 72.749 1.00 0.00 H TER 87177 WAT 9374 ATOM 87177 O WAT 9375 54.938 17.710 22.272 1.00 0.00 O ATOM 87178 H1 WAT 9375 55.152 18.322 22.976 1.00 0.00 H ATOM 87179 H2 WAT 9375 54.787 16.876 22.717 1.00 0.00 H TER 87181 WAT 9375 ATOM 87181 O WAT 9376 122.009 92.441 13.251 1.00 0.00 O ATOM 87182 H1 WAT 9376 121.306 92.664 13.862 1.00 0.00 H ATOM 87183 H2 WAT 9376 122.579 93.210 13.250 1.00 0.00 H TER 87185 WAT 9376 ATOM 87185 O WAT 9377 9.051 13.022 158.385 1.00 0.00 O ATOM 87186 H1 WAT 9377 8.127 12.792 158.288 1.00 0.00 H ATOM 87187 H2 WAT 9377 9.279 13.452 157.561 1.00 0.00 H TER 87189 WAT 9377 ATOM 87189 O WAT 9378 118.418 139.892 147.995 1.00 0.00 O ATOM 87190 H1 WAT 9378 119.299 139.639 148.270 1.00 0.00 H ATOM 87191 H2 WAT 9378 117.847 139.565 148.690 1.00 0.00 H TER 87193 WAT 9378 ATOM 87193 O WAT 9379 117.158 68.143 122.648 1.00 0.00 O ATOM 87194 H1 WAT 9379 117.908 67.934 123.205 1.00 0.00 H ATOM 87195 H2 WAT 9379 117.474 67.998 121.756 1.00 0.00 H TER 87197 WAT 9379 ATOM 87197 O WAT 9380 141.521 86.131 93.465 1.00 0.00 O ATOM 87198 H1 WAT 9380 142.028 85.637 92.820 1.00 0.00 H ATOM 87199 H2 WAT 9380 141.443 87.007 93.089 1.00 0.00 H TER 87201 WAT 9380 ATOM 87201 O WAT 9381 105.770 59.054 110.189 1.00 0.00 O ATOM 87202 H1 WAT 9381 105.716 59.720 110.875 1.00 0.00 H ATOM 87203 H2 WAT 9381 106.415 58.427 110.515 1.00 0.00 H TER 87205 WAT 9381 ATOM 87205 O WAT 9382 133.188 54.400 96.567 1.00 0.00 O ATOM 87206 H1 WAT 9382 132.594 54.215 97.294 1.00 0.00 H ATOM 87207 H2 WAT 9382 132.812 53.926 95.825 1.00 0.00 H TER 87209 WAT 9382 ATOM 87209 O WAT 9383 3.486 92.353 64.828 1.00 0.00 O ATOM 87210 H1 WAT 9383 2.848 91.926 65.400 1.00 0.00 H ATOM 87211 H2 WAT 9383 3.030 92.451 63.992 1.00 0.00 H TER 87213 WAT 9383 ATOM 87213 O WAT 9384 108.783 142.332 80.179 1.00 0.00 O ATOM 87214 H1 WAT 9384 109.657 142.439 80.555 1.00 0.00 H ATOM 87215 H2 WAT 9384 108.301 141.826 80.832 1.00 0.00 H TER 87217 WAT 9384 ATOM 87217 O WAT 9385 104.106 115.010 73.186 1.00 0.00 O ATOM 87218 H1 WAT 9385 104.604 115.366 72.450 1.00 0.00 H ATOM 87219 H2 WAT 9385 103.490 114.397 72.784 1.00 0.00 H TER 87221 WAT 9385 ATOM 87221 O WAT 9386 49.787 28.340 70.863 1.00 0.00 O ATOM 87222 H1 WAT 9386 49.599 28.303 71.801 1.00 0.00 H ATOM 87223 H2 WAT 9386 50.736 28.459 70.814 1.00 0.00 H TER 87225 WAT 9386 ATOM 87225 O WAT 9387 57.251 30.285 7.069 1.00 0.00 O ATOM 87226 H1 WAT 9387 56.502 30.812 7.345 1.00 0.00 H ATOM 87227 H2 WAT 9387 56.990 29.923 6.222 1.00 0.00 H TER 87229 WAT 9387 ATOM 87229 O WAT 9388 1.637 39.869 85.106 1.00 0.00 O ATOM 87230 H1 WAT 9388 0.885 39.710 85.677 1.00 0.00 H ATOM 87231 H2 WAT 9388 1.476 40.736 84.734 1.00 0.00 H TER 87233 WAT 9388 ATOM 87233 O WAT 9389 54.753 131.060 106.574 1.00 0.00 O ATOM 87234 H1 WAT 9389 54.303 130.915 107.407 1.00 0.00 H ATOM 87235 H2 WAT 9389 54.445 131.918 106.282 1.00 0.00 H TER 87237 WAT 9389 ATOM 87237 O WAT 9390 61.992 37.795 120.998 1.00 0.00 O ATOM 87238 H1 WAT 9390 61.732 37.054 121.545 1.00 0.00 H ATOM 87239 H2 WAT 9390 62.948 37.808 121.052 1.00 0.00 H TER 87241 WAT 9390 ATOM 87241 O WAT 9391 79.621 55.224 124.302 1.00 0.00 O ATOM 87242 H1 WAT 9391 80.501 55.575 124.164 1.00 0.00 H ATOM 87243 H2 WAT 9391 79.253 55.149 123.421 1.00 0.00 H TER 87245 WAT 9391 ATOM 87245 O WAT 9392 47.502 100.572 0.291 1.00 0.00 O ATOM 87246 H1 WAT 9392 48.141 99.914 0.018 1.00 0.00 H ATOM 87247 H2 WAT 9392 46.829 100.549 -0.389 1.00 0.00 H TER 87249 WAT 9392 ATOM 87249 O WAT 9393 17.340 35.026 92.533 1.00 0.00 O ATOM 87250 H1 WAT 9393 17.502 35.479 93.361 1.00 0.00 H ATOM 87251 H2 WAT 9393 16.448 35.277 92.293 1.00 0.00 H TER 87253 WAT 9393 ATOM 87253 O WAT 9394 85.205 95.645 81.323 1.00 0.00 O ATOM 87254 H1 WAT 9394 85.583 94.888 81.771 1.00 0.00 H ATOM 87255 H2 WAT 9394 85.296 96.363 81.949 1.00 0.00 H TER 87257 WAT 9394 ATOM 87257 O WAT 9395 79.597 123.158 124.836 1.00 0.00 O ATOM 87258 H1 WAT 9395 79.766 123.334 125.761 1.00 0.00 H ATOM 87259 H2 WAT 9395 78.673 122.913 124.803 1.00 0.00 H TER 87261 WAT 9395 ATOM 87261 O WAT 9396 45.483 94.375 21.513 1.00 0.00 O ATOM 87262 H1 WAT 9396 46.153 95.027 21.307 1.00 0.00 H ATOM 87263 H2 WAT 9396 45.698 93.627 20.957 1.00 0.00 H TER 87265 WAT 9396 ATOM 87265 O WAT 9397 118.594 49.085 98.075 1.00 0.00 O ATOM 87266 H1 WAT 9397 118.363 49.876 97.586 1.00 0.00 H ATOM 87267 H2 WAT 9397 119.195 48.614 97.498 1.00 0.00 H TER 87269 WAT 9397 ATOM 87269 O WAT 9398 15.823 38.451 84.376 1.00 0.00 O ATOM 87270 H1 WAT 9398 15.302 37.878 84.938 1.00 0.00 H ATOM 87271 H2 WAT 9398 16.338 38.980 84.985 1.00 0.00 H TER 87273 WAT 9398 ATOM 87273 O WAT 9399 95.803 46.247 126.919 1.00 0.00 O ATOM 87274 H1 WAT 9399 95.739 46.108 125.974 1.00 0.00 H ATOM 87275 H2 WAT 9399 96.723 46.467 127.067 1.00 0.00 H TER 87277 WAT 9399 ATOM 87277 O WAT 9400 28.475 88.897 56.273 1.00 0.00 O ATOM 87278 H1 WAT 9400 28.785 89.306 55.465 1.00 0.00 H ATOM 87279 H2 WAT 9400 28.469 89.607 56.914 1.00 0.00 H TER 87281 WAT 9400 ATOM 87281 O WAT 9401 136.792 22.685 93.641 1.00 0.00 O ATOM 87282 H1 WAT 9401 137.729 22.625 93.452 1.00 0.00 H ATOM 87283 H2 WAT 9401 136.609 23.624 93.648 1.00 0.00 H TER 87285 WAT 9401 ATOM 87285 O WAT 9402 23.724 21.410 144.812 1.00 0.00 O ATOM 87286 H1 WAT 9402 24.576 21.810 144.985 1.00 0.00 H ATOM 87287 H2 WAT 9402 23.187 22.126 144.474 1.00 0.00 H TER 87289 WAT 9402 ATOM 87289 O WAT 9403 124.019 137.994 86.967 1.00 0.00 O ATOM 87290 H1 WAT 9403 123.664 138.018 87.856 1.00 0.00 H ATOM 87291 H2 WAT 9403 124.868 137.561 87.060 1.00 0.00 H TER 87293 WAT 9403 ATOM 87293 O WAT 9404 138.287 58.601 96.905 1.00 0.00 O ATOM 87294 H1 WAT 9404 137.956 57.930 97.502 1.00 0.00 H ATOM 87295 H2 WAT 9404 137.563 59.219 96.815 1.00 0.00 H TER 87297 WAT 9404 ATOM 87297 O WAT 9405 119.133 83.025 12.267 1.00 0.00 O ATOM 87298 H1 WAT 9405 118.905 83.262 11.368 1.00 0.00 H ATOM 87299 H2 WAT 9405 119.848 82.396 12.175 1.00 0.00 H TER 87301 WAT 9405 ATOM 87301 O WAT 9406 93.386 28.522 131.243 1.00 0.00 O ATOM 87302 H1 WAT 9406 92.639 28.232 131.766 1.00 0.00 H ATOM 87303 H2 WAT 9406 93.194 29.437 131.038 1.00 0.00 H TER 87305 WAT 9406 ATOM 87305 O WAT 9407 82.982 25.164 15.623 1.00 0.00 O ATOM 87306 H1 WAT 9407 82.236 24.922 16.172 1.00 0.00 H ATOM 87307 H2 WAT 9407 83.409 24.332 15.418 1.00 0.00 H TER 87309 WAT 9407 ATOM 87309 O WAT 9408 145.007 17.582 73.889 1.00 0.00 O ATOM 87310 H1 WAT 9408 144.307 17.983 73.373 1.00 0.00 H ATOM 87311 H2 WAT 9408 145.771 18.134 73.726 1.00 0.00 H TER 87313 WAT 9408 ATOM 87313 O WAT 9409 124.729 131.472 132.959 1.00 0.00 O ATOM 87314 H1 WAT 9409 125.178 132.031 133.593 1.00 0.00 H ATOM 87315 H2 WAT 9409 125.403 130.864 132.655 1.00 0.00 H TER 87317 WAT 9409 ATOM 87317 O WAT 9410 5.322 57.761 15.002 1.00 0.00 O ATOM 87318 H1 WAT 9410 5.986 58.347 14.639 1.00 0.00 H ATOM 87319 H2 WAT 9410 5.749 56.905 15.032 1.00 0.00 H TER 87321 WAT 9410 ATOM 87321 O WAT 9411 120.511 71.067 158.478 1.00 0.00 O ATOM 87322 H1 WAT 9411 120.467 70.117 158.364 1.00 0.00 H ATOM 87323 H2 WAT 9411 120.904 71.387 157.666 1.00 0.00 H TER 87325 WAT 9411 ATOM 87325 O WAT 9412 140.539 77.222 57.048 1.00 0.00 O ATOM 87326 H1 WAT 9412 140.854 77.720 56.294 1.00 0.00 H ATOM 87327 H2 WAT 9412 140.207 77.886 57.653 1.00 0.00 H TER 87329 WAT 9412 ATOM 87329 O WAT 9413 13.538 77.534 141.790 1.00 0.00 O ATOM 87330 H1 WAT 9413 14.045 76.921 142.323 1.00 0.00 H ATOM 87331 H2 WAT 9413 12.849 76.998 141.398 1.00 0.00 H TER 87333 WAT 9413 ATOM 87333 O WAT 9414 57.269 130.127 116.714 1.00 0.00 O ATOM 87334 H1 WAT 9414 56.544 129.606 116.367 1.00 0.00 H ATOM 87335 H2 WAT 9414 58.007 129.922 116.140 1.00 0.00 H TER 87337 WAT 9414 ATOM 87337 O WAT 9415 133.946 67.536 114.117 1.00 0.00 O ATOM 87338 H1 WAT 9415 133.060 67.888 114.213 1.00 0.00 H ATOM 87339 H2 WAT 9415 134.496 68.308 113.982 1.00 0.00 H TER 87341 WAT 9415 ATOM 87341 O WAT 9416 66.569 69.558 2.465 1.00 0.00 O ATOM 87342 H1 WAT 9416 65.717 69.713 2.056 1.00 0.00 H ATOM 87343 H2 WAT 9416 67.070 70.352 2.282 1.00 0.00 H TER 87345 WAT 9416 ATOM 87345 O WAT 9417 48.927 64.675 152.619 1.00 0.00 O ATOM 87346 H1 WAT 9417 48.461 64.850 153.437 1.00 0.00 H ATOM 87347 H2 WAT 9417 48.620 63.809 152.349 1.00 0.00 H TER 87349 WAT 9417 ATOM 87349 O WAT 9418 135.865 108.461 127.666 1.00 0.00 O ATOM 87350 H1 WAT 9418 135.572 108.940 128.441 1.00 0.00 H ATOM 87351 H2 WAT 9418 136.728 108.827 127.471 1.00 0.00 H TER 87353 WAT 9418 ATOM 87353 O WAT 9419 66.185 134.551 84.924 1.00 0.00 O ATOM 87354 H1 WAT 9419 66.309 135.499 84.891 1.00 0.00 H ATOM 87355 H2 WAT 9419 66.926 134.231 85.440 1.00 0.00 H TER 87357 WAT 9419 ATOM 87357 O WAT 9420 132.198 120.059 67.963 1.00 0.00 O ATOM 87358 H1 WAT 9420 132.583 119.228 67.684 1.00 0.00 H ATOM 87359 H2 WAT 9420 132.143 120.578 67.161 1.00 0.00 H TER 87361 WAT 9420 ATOM 87361 O WAT 9421 15.558 100.804 16.141 1.00 0.00 O ATOM 87362 H1 WAT 9421 14.834 101.403 15.959 1.00 0.00 H ATOM 87363 H2 WAT 9421 15.589 100.749 17.096 1.00 0.00 H TER 87365 WAT 9421 ATOM 87365 O WAT 9422 110.089 16.824 57.547 1.00 0.00 O ATOM 87366 H1 WAT 9422 109.905 15.994 57.107 1.00 0.00 H ATOM 87367 H2 WAT 9422 111.029 16.956 57.424 1.00 0.00 H TER 87369 WAT 9422 ATOM 87369 O WAT 9423 119.179 86.892 93.396 1.00 0.00 O ATOM 87370 H1 WAT 9423 118.550 86.565 92.753 1.00 0.00 H ATOM 87371 H2 WAT 9423 118.973 86.411 94.198 1.00 0.00 H TER 87373 WAT 9423 ATOM 87373 O WAT 9424 72.282 114.940 95.697 1.00 0.00 O ATOM 87374 H1 WAT 9424 72.868 114.280 95.327 1.00 0.00 H ATOM 87375 H2 WAT 9424 71.802 115.284 94.943 1.00 0.00 H TER 87377 WAT 9424 ATOM 87377 O WAT 9425 81.779 90.958 97.941 1.00 0.00 O ATOM 87378 H1 WAT 9425 81.963 90.433 97.162 1.00 0.00 H ATOM 87379 H2 WAT 9425 82.035 91.847 97.696 1.00 0.00 H TER 87381 WAT 9425 ATOM 87381 O WAT 9426 73.716 78.388 131.646 1.00 0.00 O ATOM 87382 H1 WAT 9426 72.781 78.590 131.608 1.00 0.00 H ATOM 87383 H2 WAT 9426 73.919 78.368 132.582 1.00 0.00 H TER 87385 WAT 9426 ATOM 87385 O WAT 9427 85.614 11.302 89.256 1.00 0.00 O ATOM 87386 H1 WAT 9427 85.156 11.746 88.542 1.00 0.00 H ATOM 87387 H2 WAT 9427 86.296 10.790 88.821 1.00 0.00 H TER 87389 WAT 9427 ATOM 87389 O WAT 9428 140.481 140.227 109.464 1.00 0.00 O ATOM 87390 H1 WAT 9428 141.389 140.278 109.763 1.00 0.00 H ATOM 87391 H2 WAT 9428 140.523 140.444 108.533 1.00 0.00 H TER 87393 WAT 9428 ATOM 87393 O WAT 9429 105.087 117.106 10.033 1.00 0.00 O ATOM 87394 H1 WAT 9429 105.547 116.533 10.647 1.00 0.00 H ATOM 87395 H2 WAT 9429 105.764 117.695 9.702 1.00 0.00 H TER 87397 WAT 9429 ATOM 87397 O WAT 9430 70.188 126.578 124.078 1.00 0.00 O ATOM 87398 H1 WAT 9430 69.981 126.074 123.290 1.00 0.00 H ATOM 87399 H2 WAT 9430 69.335 126.830 124.431 1.00 0.00 H TER 87401 WAT 9430 ATOM 87401 O WAT 9431 79.605 36.667 13.312 1.00 0.00 O ATOM 87402 H1 WAT 9431 79.861 35.823 12.942 1.00 0.00 H ATOM 87403 H2 WAT 9431 80.080 37.312 12.788 1.00 0.00 H TER 87405 WAT 9431 ATOM 87405 O WAT 9432 122.165 49.369 98.781 1.00 0.00 O ATOM 87406 H1 WAT 9432 122.523 48.970 99.574 1.00 0.00 H ATOM 87407 H2 WAT 9432 121.434 48.801 98.535 1.00 0.00 H TER 87409 WAT 9432 ATOM 87409 O WAT 9433 24.168 105.315 61.614 1.00 0.00 O ATOM 87410 H1 WAT 9433 23.568 105.450 60.881 1.00 0.00 H ATOM 87411 H2 WAT 9433 23.983 106.039 62.213 1.00 0.00 H TER 87413 WAT 9433 ATOM 87413 O WAT 9434 95.374 102.518 66.180 1.00 0.00 O ATOM 87414 H1 WAT 9434 95.554 102.278 65.271 1.00 0.00 H ATOM 87415 H2 WAT 9434 95.481 103.469 66.202 1.00 0.00 H TER 87417 WAT 9434 ATOM 87417 O WAT 9435 13.588 49.078 99.226 1.00 0.00 O ATOM 87418 H1 WAT 9435 13.897 48.291 98.777 1.00 0.00 H ATOM 87419 H2 WAT 9435 14.387 49.547 99.465 1.00 0.00 H TER 87421 WAT 9435 ATOM 87421 O WAT 9436 144.722 23.738 17.703 1.00 0.00 O ATOM 87422 H1 WAT 9436 145.342 23.109 18.071 1.00 0.00 H ATOM 87423 H2 WAT 9436 144.626 24.406 18.382 1.00 0.00 H TER 87425 WAT 9436 ATOM 87425 O WAT 9437 109.643 20.902 25.641 1.00 0.00 O ATOM 87426 H1 WAT 9437 110.079 21.536 26.211 1.00 0.00 H ATOM 87427 H2 WAT 9437 109.238 21.435 24.956 1.00 0.00 H TER 87429 WAT 9437 ATOM 87429 O WAT 9438 25.621 6.538 128.351 1.00 0.00 O ATOM 87430 H1 WAT 9438 24.826 6.087 128.637 1.00 0.00 H ATOM 87431 H2 WAT 9438 25.885 6.077 127.555 1.00 0.00 H TER 87433 WAT 9438 ATOM 87433 O WAT 9439 108.243 37.806 139.709 1.00 0.00 O ATOM 87434 H1 WAT 9439 107.849 38.628 140.003 1.00 0.00 H ATOM 87435 H2 WAT 9439 109.107 37.794 140.121 1.00 0.00 H TER 87437 WAT 9439 ATOM 87437 O WAT 9440 82.704 133.880 101.400 1.00 0.00 O ATOM 87438 H1 WAT 9440 82.079 133.683 100.702 1.00 0.00 H ATOM 87439 H2 WAT 9440 83.555 133.634 101.037 1.00 0.00 H TER 87441 WAT 9440 ATOM 87441 O WAT 9441 65.026 90.563 74.670 1.00 0.00 O ATOM 87442 H1 WAT 9441 64.377 91.218 74.927 1.00 0.00 H ATOM 87443 H2 WAT 9441 64.751 90.283 73.797 1.00 0.00 H TER 87445 WAT 9441 ATOM 87445 O WAT 9442 81.154 97.303 24.813 1.00 0.00 O ATOM 87446 H1 WAT 9442 81.692 97.499 24.046 1.00 0.00 H ATOM 87447 H2 WAT 9442 81.781 97.013 25.476 1.00 0.00 H TER 87449 WAT 9442 ATOM 87449 O WAT 9443 7.355 110.858 72.642 1.00 0.00 O ATOM 87450 H1 WAT 9443 6.694 110.809 71.952 1.00 0.00 H ATOM 87451 H2 WAT 9443 7.161 110.113 73.212 1.00 0.00 H TER 87453 WAT 9443 ATOM 87453 O WAT 9444 59.710 23.531 115.769 1.00 0.00 O ATOM 87454 H1 WAT 9444 59.799 23.323 116.699 1.00 0.00 H ATOM 87455 H2 WAT 9444 60.569 23.870 115.517 1.00 0.00 H TER 87457 WAT 9444 ATOM 87457 O WAT 9445 86.597 4.758 134.934 1.00 0.00 O ATOM 87458 H1 WAT 9445 85.695 4.592 134.659 1.00 0.00 H ATOM 87459 H2 WAT 9445 87.040 5.048 134.136 1.00 0.00 H TER 87461 WAT 9445 ATOM 87461 O WAT 9446 16.929 41.429 1.039 1.00 0.00 O ATOM 87462 H1 WAT 9446 17.273 40.591 0.729 1.00 0.00 H ATOM 87463 H2 WAT 9446 17.406 41.597 1.852 1.00 0.00 H TER 87465 WAT 9446 ATOM 87465 O WAT 9447 81.373 33.063 10.045 1.00 0.00 O ATOM 87466 H1 WAT 9447 81.013 32.210 9.801 1.00 0.00 H ATOM 87467 H2 WAT 9447 81.665 33.444 9.217 1.00 0.00 H TER 87469 WAT 9447 ATOM 87469 O WAT 9448 2.229 32.932 15.081 1.00 0.00 O ATOM 87470 H1 WAT 9448 2.467 33.805 15.394 1.00 0.00 H ATOM 87471 H2 WAT 9448 2.006 32.446 15.875 1.00 0.00 H TER 87473 WAT 9448 ATOM 87473 O WAT 9449 138.384 100.350 105.880 1.00 0.00 O ATOM 87474 H1 WAT 9449 137.704 100.990 106.092 1.00 0.00 H ATOM 87475 H2 WAT 9449 139.016 100.426 106.595 1.00 0.00 H TER 87477 WAT 9449 ATOM 87477 O WAT 9450 12.204 116.325 112.332 1.00 0.00 O ATOM 87478 H1 WAT 9450 13.058 116.439 111.913 1.00 0.00 H ATOM 87479 H2 WAT 9450 11.676 117.051 111.999 1.00 0.00 H TER 87481 WAT 9450 ATOM 87481 O WAT 9451 67.406 145.709 62.922 1.00 0.00 O ATOM 87482 H1 WAT 9451 67.699 145.157 63.647 1.00 0.00 H ATOM 87483 H2 WAT 9451 66.722 145.196 62.491 1.00 0.00 H TER 87485 WAT 9451 ATOM 87485 O WAT 9452 11.706 9.770 27.164 1.00 0.00 O ATOM 87486 H1 WAT 9452 11.152 10.396 26.698 1.00 0.00 H ATOM 87487 H2 WAT 9452 11.693 8.985 26.617 1.00 0.00 H TER 87489 WAT 9452 ATOM 87489 O WAT 9453 106.645 20.124 20.005 1.00 0.00 O ATOM 87490 H1 WAT 9453 106.616 19.461 19.315 1.00 0.00 H ATOM 87491 H2 WAT 9453 107.334 19.822 20.597 1.00 0.00 H TER 87493 WAT 9453 ATOM 87493 O WAT 9454 65.040 128.963 131.565 1.00 0.00 O ATOM 87494 H1 WAT 9454 65.340 128.114 131.241 1.00 0.00 H ATOM 87495 H2 WAT 9454 64.779 129.441 130.778 1.00 0.00 H TER 87497 WAT 9454 ATOM 87497 O WAT 9455 95.330 78.798 12.427 1.00 0.00 O ATOM 87498 H1 WAT 9455 96.241 78.578 12.237 1.00 0.00 H ATOM 87499 H2 WAT 9455 95.377 79.372 13.192 1.00 0.00 H TER 87501 WAT 9455 ATOM 87501 O WAT 9456 1.827 42.858 122.752 1.00 0.00 O ATOM 87502 H1 WAT 9456 1.364 43.487 122.198 1.00 0.00 H ATOM 87503 H2 WAT 9456 1.468 43.001 123.628 1.00 0.00 H TER 87505 WAT 9456 ATOM 87505 O WAT 9457 24.810 8.499 135.711 1.00 0.00 O ATOM 87506 H1 WAT 9457 24.789 7.542 135.702 1.00 0.00 H ATOM 87507 H2 WAT 9457 24.528 8.753 134.832 1.00 0.00 H TER 87509 WAT 9457 ATOM 87509 O WAT 9458 99.571 7.667 128.812 1.00 0.00 O ATOM 87510 H1 WAT 9458 99.211 8.251 129.479 1.00 0.00 H ATOM 87511 H2 WAT 9458 98.855 7.543 128.189 1.00 0.00 H TER 87513 WAT 9458 ATOM 87513 O WAT 9459 111.500 122.920 115.004 1.00 0.00 O ATOM 87514 H1 WAT 9459 111.993 122.673 114.221 1.00 0.00 H ATOM 87515 H2 WAT 9459 110.892 123.594 114.701 1.00 0.00 H TER 87517 WAT 9459 ATOM 87517 O WAT 9460 145.231 19.577 136.176 1.00 0.00 O ATOM 87518 H1 WAT 9460 144.359 19.280 135.914 1.00 0.00 H ATOM 87519 H2 WAT 9460 145.767 18.784 136.169 1.00 0.00 H TER 87521 WAT 9460 ATOM 87521 O WAT 9461 113.672 116.426 127.658 1.00 0.00 O ATOM 87522 H1 WAT 9461 114.104 117.210 127.319 1.00 0.00 H ATOM 87523 H2 WAT 9461 113.283 116.014 126.886 1.00 0.00 H TER 87525 WAT 9461 ATOM 87525 O WAT 9462 80.985 117.964 15.260 1.00 0.00 O ATOM 87526 H1 WAT 9462 81.293 118.601 15.905 1.00 0.00 H ATOM 87527 H2 WAT 9462 81.644 117.270 15.275 1.00 0.00 H TER 87529 WAT 9462 ATOM 87529 O WAT 9463 11.795 85.970 1.647 1.00 0.00 O ATOM 87530 H1 WAT 9463 12.421 86.608 1.989 1.00 0.00 H ATOM 87531 H2 WAT 9463 11.599 85.404 2.393 1.00 0.00 H TER 87533 WAT 9463 ATOM 87533 O WAT 9464 92.526 128.891 153.161 1.00 0.00 O ATOM 87534 H1 WAT 9464 92.775 129.512 152.477 1.00 0.00 H ATOM 87535 H2 WAT 9464 91.765 128.433 152.804 1.00 0.00 H TER 87537 WAT 9464 ATOM 87537 O WAT 9465 95.747 90.978 151.343 1.00 0.00 O ATOM 87538 H1 WAT 9465 96.163 90.346 151.929 1.00 0.00 H ATOM 87539 H2 WAT 9465 94.863 90.636 151.211 1.00 0.00 H TER 87541 WAT 9465 ATOM 87541 O WAT 9466 145.006 78.809 21.975 1.00 0.00 O ATOM 87542 H1 WAT 9466 145.237 78.609 22.882 1.00 0.00 H ATOM 87543 H2 WAT 9466 144.352 79.505 22.043 1.00 0.00 H TER 87545 WAT 9466 ATOM 87545 O WAT 9467 115.431 143.239 104.047 1.00 0.00 O ATOM 87546 H1 WAT 9467 116.026 142.885 104.709 1.00 0.00 H ATOM 87547 H2 WAT 9467 114.557 143.008 104.363 1.00 0.00 H TER 87549 WAT 9467 ATOM 87549 O WAT 9468 145.779 56.975 71.990 1.00 0.00 O ATOM 87550 H1 WAT 9468 145.330 57.691 71.541 1.00 0.00 H ATOM 87551 H2 WAT 9468 145.171 56.238 71.936 1.00 0.00 H TER 87553 WAT 9468 ATOM 87553 O WAT 9469 106.086 55.627 10.809 1.00 0.00 O ATOM 87554 H1 WAT 9469 105.620 56.082 11.510 1.00 0.00 H ATOM 87555 H2 WAT 9469 105.510 54.902 10.569 1.00 0.00 H TER 87557 WAT 9469 ATOM 87557 O WAT 9470 15.191 99.297 137.555 1.00 0.00 O ATOM 87558 H1 WAT 9470 15.256 98.343 137.542 1.00 0.00 H ATOM 87559 H2 WAT 9470 15.159 99.548 136.632 1.00 0.00 H TER 87561 WAT 9470 ATOM 87561 O WAT 9471 113.785 45.913 69.599 1.00 0.00 O ATOM 87562 H1 WAT 9471 113.152 45.218 69.780 1.00 0.00 H ATOM 87563 H2 WAT 9471 114.278 45.596 68.842 1.00 0.00 H TER 87565 WAT 9471 ATOM 87565 O WAT 9472 29.323 19.025 150.525 1.00 0.00 O ATOM 87566 H1 WAT 9472 29.518 18.804 149.614 1.00 0.00 H ATOM 87567 H2 WAT 9472 29.095 18.188 150.931 1.00 0.00 H TER 87569 WAT 9472 ATOM 87569 O WAT 9473 132.465 101.344 76.024 1.00 0.00 O ATOM 87570 H1 WAT 9473 132.259 102.139 75.532 1.00 0.00 H ATOM 87571 H2 WAT 9473 132.110 101.505 76.898 1.00 0.00 H TER 87573 WAT 9473 ATOM 87573 O WAT 9474 59.854 20.508 149.325 1.00 0.00 O ATOM 87574 H1 WAT 9474 60.767 20.511 149.040 1.00 0.00 H ATOM 87575 H2 WAT 9474 59.349 20.546 148.512 1.00 0.00 H TER 87577 WAT 9474 ATOM 87577 O WAT 9475 5.623 143.393 142.967 1.00 0.00 O ATOM 87578 H1 WAT 9475 5.426 142.456 142.981 1.00 0.00 H ATOM 87579 H2 WAT 9475 5.994 143.572 143.831 1.00 0.00 H TER 87581 WAT 9475 ATOM 87581 O WAT 9476 139.359 45.018 105.336 1.00 0.00 O ATOM 87582 H1 WAT 9476 139.069 45.604 104.637 1.00 0.00 H ATOM 87583 H2 WAT 9476 138.806 44.243 105.244 1.00 0.00 H TER 87585 WAT 9476 ATOM 87585 O WAT 9477 95.799 40.120 17.263 1.00 0.00 O ATOM 87586 H1 WAT 9477 96.356 40.773 16.841 1.00 0.00 H ATOM 87587 H2 WAT 9477 95.153 40.634 17.748 1.00 0.00 H TER 87589 WAT 9477 ATOM 87589 O WAT 9478 144.870 16.741 102.266 1.00 0.00 O ATOM 87590 H1 WAT 9478 144.143 16.119 102.237 1.00 0.00 H ATOM 87591 H2 WAT 9478 145.223 16.737 101.376 1.00 0.00 H TER 87593 WAT 9478 ATOM 87593 O WAT 9479 106.650 92.401 91.209 1.00 0.00 O ATOM 87594 H1 WAT 9479 106.650 91.451 91.093 1.00 0.00 H ATOM 87595 H2 WAT 9479 105.955 92.713 90.630 1.00 0.00 H TER 87597 WAT 9479 ATOM 87597 O WAT 9480 140.261 70.785 17.848 1.00 0.00 O ATOM 87598 H1 WAT 9480 140.104 71.719 17.987 1.00 0.00 H ATOM 87599 H2 WAT 9480 139.578 70.517 17.234 1.00 0.00 H TER 87601 WAT 9480 ATOM 87601 O WAT 9481 116.509 106.340 135.520 1.00 0.00 O ATOM 87602 H1 WAT 9481 116.261 105.513 135.106 1.00 0.00 H ATOM 87603 H2 WAT 9481 117.440 106.439 135.318 1.00 0.00 H TER 87605 WAT 9481 ATOM 87605 O WAT 9482 116.429 79.856 107.619 1.00 0.00 O ATOM 87606 H1 WAT 9482 116.173 79.429 106.802 1.00 0.00 H ATOM 87607 H2 WAT 9482 115.972 80.697 107.603 1.00 0.00 H TER 87609 WAT 9482 ATOM 87609 O WAT 9483 49.234 112.196 17.923 1.00 0.00 O ATOM 87610 H1 WAT 9483 49.823 112.950 17.964 1.00 0.00 H ATOM 87611 H2 WAT 9483 48.383 112.570 17.696 1.00 0.00 H TER 87613 WAT 9483 ATOM 87613 O WAT 9484 142.084 141.273 15.124 1.00 0.00 O ATOM 87614 H1 WAT 9484 141.374 141.913 15.079 1.00 0.00 H ATOM 87615 H2 WAT 9484 141.731 140.561 15.657 1.00 0.00 H TER 87617 WAT 9484 ATOM 87617 O WAT 9485 62.147 142.120 104.119 1.00 0.00 O ATOM 87618 H1 WAT 9485 62.504 141.667 103.355 1.00 0.00 H ATOM 87619 H2 WAT 9485 62.792 141.970 104.809 1.00 0.00 H TER 87621 WAT 9485 ATOM 87621 O WAT 9486 120.881 104.051 121.739 1.00 0.00 O ATOM 87622 H1 WAT 9486 121.356 103.446 121.169 1.00 0.00 H ATOM 87623 H2 WAT 9486 121.567 104.527 122.207 1.00 0.00 H TER 87625 WAT 9486 ATOM 87625 O WAT 9487 78.094 40.449 106.267 1.00 0.00 O ATOM 87626 H1 WAT 9487 78.837 40.840 106.726 1.00 0.00 H ATOM 87627 H2 WAT 9487 77.901 41.063 105.558 1.00 0.00 H TER 87629 WAT 9487 ATOM 87629 O WAT 9488 3.413 104.599 66.703 1.00 0.00 O ATOM 87630 H1 WAT 9488 3.837 105.373 66.332 1.00 0.00 H ATOM 87631 H2 WAT 9488 4.124 104.111 67.117 1.00 0.00 H TER 87633 WAT 9488 ATOM 87633 O WAT 9489 32.747 87.701 88.199 1.00 0.00 O ATOM 87634 H1 WAT 9489 33.273 88.495 88.291 1.00 0.00 H ATOM 87635 H2 WAT 9489 32.816 87.267 89.049 1.00 0.00 H TER 87637 WAT 9489 ATOM 87637 O WAT 9490 30.816 37.449 86.464 1.00 0.00 O ATOM 87638 H1 WAT 9490 29.910 37.518 86.165 1.00 0.00 H ATOM 87639 H2 WAT 9490 30.746 37.300 87.407 1.00 0.00 H TER 87641 WAT 9490 ATOM 87641 O WAT 9491 100.607 47.208 149.162 1.00 0.00 O ATOM 87642 H1 WAT 9491 100.117 47.962 149.491 1.00 0.00 H ATOM 87643 H2 WAT 9491 100.104 46.907 148.406 1.00 0.00 H TER 87645 WAT 9491 ATOM 87645 O WAT 9492 113.304 122.518 13.164 1.00 0.00 O ATOM 87646 H1 WAT 9492 112.774 121.948 12.608 1.00 0.00 H ATOM 87647 H2 WAT 9492 114.153 122.559 12.725 1.00 0.00 H TER 87649 WAT 9492 ATOM 87649 O WAT 9493 92.801 0.341 117.279 1.00 0.00 O ATOM 87650 H1 WAT 9493 92.435 -0.543 117.263 1.00 0.00 H ATOM 87651 H2 WAT 9493 93.431 0.327 118.000 1.00 0.00 H TER 87653 WAT 9493 ATOM 87653 O WAT 9494 88.839 139.411 114.615 1.00 0.00 O ATOM 87654 H1 WAT 9494 89.680 139.868 114.604 1.00 0.00 H ATOM 87655 H2 WAT 9494 88.846 138.916 115.434 1.00 0.00 H TER 87657 WAT 9494 ATOM 87657 O WAT 9495 65.065 29.679 0.879 1.00 0.00 O ATOM 87658 H1 WAT 9495 64.122 29.525 0.814 1.00 0.00 H ATOM 87659 H2 WAT 9495 65.443 29.148 0.178 1.00 0.00 H TER 87661 WAT 9495 ATOM 87661 O WAT 9496 64.465 66.698 79.792 1.00 0.00 O ATOM 87662 H1 WAT 9496 64.395 67.653 79.763 1.00 0.00 H ATOM 87663 H2 WAT 9496 65.206 66.495 79.221 1.00 0.00 H TER 87665 WAT 9496 ATOM 87665 O WAT 9497 24.490 58.277 73.544 1.00 0.00 O ATOM 87666 H1 WAT 9497 23.599 58.172 73.877 1.00 0.00 H ATOM 87667 H2 WAT 9497 25.038 58.301 74.329 1.00 0.00 H TER 87669 WAT 9497 ATOM 87669 O WAT 9498 42.295 111.454 64.467 1.00 0.00 O ATOM 87670 H1 WAT 9498 41.823 110.707 64.833 1.00 0.00 H ATOM 87671 H2 WAT 9498 43.126 111.469 64.943 1.00 0.00 H TER 87673 WAT 9498 ATOM 87673 O WAT 9499 76.423 50.408 155.457 1.00 0.00 O ATOM 87674 H1 WAT 9499 76.893 50.502 154.628 1.00 0.00 H ATOM 87675 H2 WAT 9499 77.111 50.273 156.108 1.00 0.00 H TER 87677 WAT 9499 ATOM 87677 O WAT 9500 54.912 137.087 125.411 1.00 0.00 O ATOM 87678 H1 WAT 9500 54.690 136.317 124.888 1.00 0.00 H ATOM 87679 H2 WAT 9500 55.141 136.735 126.271 1.00 0.00 H TER 87681 WAT 9500 ATOM 87681 O WAT 9501 1.360 89.607 136.476 1.00 0.00 O ATOM 87682 H1 WAT 9501 0.907 88.830 136.804 1.00 0.00 H ATOM 87683 H2 WAT 9501 1.750 89.326 135.649 1.00 0.00 H TER 87685 WAT 9501 ATOM 87685 O WAT 9502 91.608 66.194 138.365 1.00 0.00 O ATOM 87686 H1 WAT 9502 90.669 66.024 138.296 1.00 0.00 H ATOM 87687 H2 WAT 9502 91.801 66.097 139.298 1.00 0.00 H TER 87689 WAT 9502 ATOM 87689 O WAT 9503 99.253 131.265 10.431 1.00 0.00 O ATOM 87690 H1 WAT 9503 99.053 130.940 11.308 1.00 0.00 H ATOM 87691 H2 WAT 9503 100.034 130.778 10.168 1.00 0.00 H TER 87693 WAT 9503 ATOM 87693 O WAT 9504 79.414 27.939 3.162 1.00 0.00 O ATOM 87694 H1 WAT 9504 80.045 27.282 3.459 1.00 0.00 H ATOM 87695 H2 WAT 9504 78.831 27.462 2.572 1.00 0.00 H TER 87697 WAT 9504 ATOM 87697 O WAT 9505 99.505 62.608 97.667 1.00 0.00 O ATOM 87698 H1 WAT 9505 98.891 61.916 97.911 1.00 0.00 H ATOM 87699 H2 WAT 9505 100.153 62.169 97.116 1.00 0.00 H TER 87701 WAT 9505 ATOM 87701 O WAT 9506 138.990 51.710 78.951 1.00 0.00 O ATOM 87702 H1 WAT 9506 139.764 52.245 79.130 1.00 0.00 H ATOM 87703 H2 WAT 9506 139.308 51.013 78.378 1.00 0.00 H TER 87705 WAT 9506 ATOM 87705 O WAT 9507 110.476 106.362 86.892 1.00 0.00 O ATOM 87706 H1 WAT 9507 110.225 106.011 86.038 1.00 0.00 H ATOM 87707 H2 WAT 9507 111.412 106.545 86.810 1.00 0.00 H TER 87709 WAT 9507 ATOM 87709 O WAT 9508 136.476 145.284 139.299 1.00 0.00 O ATOM 87710 H1 WAT 9508 136.129 145.907 138.661 1.00 0.00 H ATOM 87711 H2 WAT 9508 135.700 144.898 139.704 1.00 0.00 H TER 87713 WAT 9508 ATOM 87713 O WAT 9509 92.159 47.470 55.779 1.00 0.00 O ATOM 87714 H1 WAT 9509 93.062 47.548 56.085 1.00 0.00 H ATOM 87715 H2 WAT 9509 91.951 46.541 55.880 1.00 0.00 H TER 87717 WAT 9509 ATOM 87717 O WAT 9510 1.138 6.980 98.356 1.00 0.00 O ATOM 87718 H1 WAT 9510 2.059 6.824 98.566 1.00 0.00 H ATOM 87719 H2 WAT 9510 0.890 6.240 97.801 1.00 0.00 H TER 87721 WAT 9510 ATOM 87721 O WAT 9511 96.840 28.317 19.608 1.00 0.00 O ATOM 87722 H1 WAT 9511 97.347 27.898 20.303 1.00 0.00 H ATOM 87723 H2 WAT 9511 96.746 29.226 19.896 1.00 0.00 H TER 87725 WAT 9511 ATOM 87725 O WAT 9512 139.684 137.954 103.633 1.00 0.00 O ATOM 87726 H1 WAT 9512 139.780 137.004 103.696 1.00 0.00 H ATOM 87727 H2 WAT 9512 138.863 138.143 104.089 1.00 0.00 H TER 87729 WAT 9512 ATOM 87729 O WAT 9513 131.097 34.347 114.170 1.00 0.00 O ATOM 87730 H1 WAT 9513 131.697 33.608 114.066 1.00 0.00 H ATOM 87731 H2 WAT 9513 131.000 34.702 113.286 1.00 0.00 H TER 87733 WAT 9513 ATOM 87733 O WAT 9514 84.364 73.625 121.436 1.00 0.00 O ATOM 87734 H1 WAT 9514 83.570 74.159 121.397 1.00 0.00 H ATOM 87735 H2 WAT 9514 84.054 72.726 121.321 1.00 0.00 H TER 87737 WAT 9514 ATOM 87737 O WAT 9515 26.301 109.040 98.346 1.00 0.00 O ATOM 87738 H1 WAT 9515 26.414 108.216 97.873 1.00 0.00 H ATOM 87739 H2 WAT 9515 25.363 109.221 98.292 1.00 0.00 H TER 87741 WAT 9515 ATOM 87741 O WAT 9516 13.631 106.377 98.617 1.00 0.00 O ATOM 87742 H1 WAT 9516 14.278 107.046 98.397 1.00 0.00 H ATOM 87743 H2 WAT 9516 13.836 105.645 98.035 1.00 0.00 H TER 87745 WAT 9516 ATOM 87745 O WAT 9517 22.535 64.177 78.385 1.00 0.00 O ATOM 87746 H1 WAT 9517 23.152 64.067 79.108 1.00 0.00 H ATOM 87747 H2 WAT 9517 22.634 65.092 78.122 1.00 0.00 H TER 87749 WAT 9517 ATOM 87749 O WAT 9518 90.408 26.322 2.865 1.00 0.00 O ATOM 87750 H1 WAT 9518 90.706 25.525 3.305 1.00 0.00 H ATOM 87751 H2 WAT 9518 89.746 26.686 3.453 1.00 0.00 H TER 87753 WAT 9518 ATOM 87753 O WAT 9519 22.871 52.329 3.960 1.00 0.00 O ATOM 87754 H1 WAT 9519 23.417 52.846 3.368 1.00 0.00 H ATOM 87755 H2 WAT 9519 23.113 51.421 3.779 1.00 0.00 H TER 87757 WAT 9519 ATOM 87757 O WAT 9520 74.692 5.267 76.193 1.00 0.00 O ATOM 87758 H1 WAT 9520 74.685 5.486 77.125 1.00 0.00 H ATOM 87759 H2 WAT 9520 74.597 6.109 75.748 1.00 0.00 H TER 87761 WAT 9520 ATOM 87761 O WAT 9521 61.042 122.156 106.207 1.00 0.00 O ATOM 87762 H1 WAT 9521 61.085 122.906 105.614 1.00 0.00 H ATOM 87763 H2 WAT 9521 61.787 121.610 105.957 1.00 0.00 H TER 87765 WAT 9521 ATOM 87765 O WAT 9522 115.555 54.761 158.461 1.00 0.00 O ATOM 87766 H1 WAT 9522 115.900 54.582 157.586 1.00 0.00 H ATOM 87767 H2 WAT 9522 114.925 55.470 158.328 1.00 0.00 H TER 87769 WAT 9522 ATOM 87769 O WAT 9523 99.572 93.048 151.907 1.00 0.00 O ATOM 87770 H1 WAT 9523 98.642 92.952 151.701 1.00 0.00 H ATOM 87771 H2 WAT 9523 99.889 93.702 151.284 1.00 0.00 H TER 87773 WAT 9523 ATOM 87773 O WAT 9524 30.022 29.041 19.159 1.00 0.00 O ATOM 87774 H1 WAT 9524 30.665 29.732 19.001 1.00 0.00 H ATOM 87775 H2 WAT 9524 29.515 28.996 18.348 1.00 0.00 H TER 87777 WAT 9524 ATOM 87777 O WAT 9525 95.126 53.642 146.613 1.00 0.00 O ATOM 87778 H1 WAT 9525 95.060 54.126 147.436 1.00 0.00 H ATOM 87779 H2 WAT 9525 94.220 53.533 146.325 1.00 0.00 H TER 87781 WAT 9525 ATOM 87781 O WAT 9526 32.586 27.931 125.042 1.00 0.00 O ATOM 87782 H1 WAT 9526 33.143 28.580 124.611 1.00 0.00 H ATOM 87783 H2 WAT 9526 31.836 27.833 124.456 1.00 0.00 H TER 87785 WAT 9526 ATOM 87785 O WAT 9527 3.644 125.400 70.969 1.00 0.00 O ATOM 87786 H1 WAT 9527 2.761 125.616 71.269 1.00 0.00 H ATOM 87787 H2 WAT 9527 3.616 125.539 70.022 1.00 0.00 H TER 87789 WAT 9527 ATOM 87789 O WAT 9528 38.866 27.671 130.399 1.00 0.00 O ATOM 87790 H1 WAT 9528 38.954 28.583 130.123 1.00 0.00 H ATOM 87791 H2 WAT 9528 38.282 27.280 129.749 1.00 0.00 H TER 87793 WAT 9528 ATOM 87793 O WAT 9529 90.189 144.247 142.241 1.00 0.00 O ATOM 87794 H1 WAT 9529 90.759 143.612 142.675 1.00 0.00 H ATOM 87795 H2 WAT 9529 89.344 144.150 142.681 1.00 0.00 H TER 87797 WAT 9529 ATOM 87797 O WAT 9530 24.885 75.154 115.076 1.00 0.00 O ATOM 87798 H1 WAT 9530 24.913 75.684 115.872 1.00 0.00 H ATOM 87799 H2 WAT 9530 25.800 74.934 114.902 1.00 0.00 H TER 87801 WAT 9530 ATOM 87801 O WAT 9531 92.979 11.452 128.703 1.00 0.00 O ATOM 87802 H1 WAT 9531 93.082 10.500 128.682 1.00 0.00 H ATOM 87803 H2 WAT 9531 92.390 11.613 129.440 1.00 0.00 H TER 87805 WAT 9531 ATOM 87805 O WAT 9532 9.130 8.443 143.634 1.00 0.00 O ATOM 87806 H1 WAT 9532 8.992 9.276 143.183 1.00 0.00 H ATOM 87807 H2 WAT 9532 10.047 8.468 143.907 1.00 0.00 H TER 87809 WAT 9532 ATOM 87809 O WAT 9533 12.285 29.736 157.520 1.00 0.00 O ATOM 87810 H1 WAT 9533 11.371 29.820 157.789 1.00 0.00 H ATOM 87811 H2 WAT 9533 12.779 30.197 158.198 1.00 0.00 H TER 87813 WAT 9533 ATOM 87813 O WAT 9534 16.157 25.570 93.934 1.00 0.00 O ATOM 87814 H1 WAT 9534 16.237 24.634 94.121 1.00 0.00 H ATOM 87815 H2 WAT 9534 16.437 25.656 93.022 1.00 0.00 H TER 87817 WAT 9534 ATOM 87817 O WAT 9535 26.925 33.321 106.034 1.00 0.00 O ATOM 87818 H1 WAT 9535 27.098 33.654 105.153 1.00 0.00 H ATOM 87819 H2 WAT 9535 27.745 33.463 106.508 1.00 0.00 H TER 87821 WAT 9535 ATOM 87821 O WAT 9536 101.323 29.144 149.777 1.00 0.00 O ATOM 87822 H1 WAT 9536 101.627 28.416 150.319 1.00 0.00 H ATOM 87823 H2 WAT 9536 100.937 28.725 149.007 1.00 0.00 H TER 87825 WAT 9536 ATOM 87825 O WAT 9537 105.833 87.993 21.189 1.00 0.00 O ATOM 87826 H1 WAT 9537 104.952 87.728 20.926 1.00 0.00 H ATOM 87827 H2 WAT 9537 106.414 87.400 20.712 1.00 0.00 H TER 87829 WAT 9537 ATOM 87829 O WAT 9538 17.614 32.357 91.840 1.00 0.00 O ATOM 87830 H1 WAT 9538 18.313 32.152 92.461 1.00 0.00 H ATOM 87831 H2 WAT 9538 17.462 33.295 91.951 1.00 0.00 H TER 87833 WAT 9538 ATOM 87833 O WAT 9539 15.988 121.419 83.864 1.00 0.00 O ATOM 87834 H1 WAT 9539 16.142 120.675 83.282 1.00 0.00 H ATOM 87835 H2 WAT 9539 15.145 121.229 84.277 1.00 0.00 H TER 87837 WAT 9539 ATOM 87837 O WAT 9540 80.276 52.320 59.865 1.00 0.00 O ATOM 87838 H1 WAT 9540 80.508 52.026 60.747 1.00 0.00 H ATOM 87839 H2 WAT 9540 80.065 53.248 59.970 1.00 0.00 H TER 87841 WAT 9540 ATOM 87841 O WAT 9541 64.553 44.797 60.222 1.00 0.00 O ATOM 87842 H1 WAT 9541 65.319 44.864 59.653 1.00 0.00 H ATOM 87843 H2 WAT 9541 64.583 45.589 60.759 1.00 0.00 H TER 87845 WAT 9541 ATOM 87845 O WAT 9542 69.419 88.214 115.593 1.00 0.00 O ATOM 87846 H1 WAT 9542 69.335 87.307 115.297 1.00 0.00 H ATOM 87847 H2 WAT 9542 69.545 88.718 114.789 1.00 0.00 H TER 87849 WAT 9542 ATOM 87849 O WAT 9543 22.100 13.466 16.769 1.00 0.00 O ATOM 87850 H1 WAT 9543 21.871 12.560 16.976 1.00 0.00 H ATOM 87851 H2 WAT 9543 22.662 13.742 17.493 1.00 0.00 H TER 87853 WAT 9543 ATOM 87853 O WAT 9544 111.970 40.214 93.332 1.00 0.00 O ATOM 87854 H1 WAT 9544 112.608 39.793 92.756 1.00 0.00 H ATOM 87855 H2 WAT 9544 112.405 41.015 93.626 1.00 0.00 H TER 87857 WAT 9544 ATOM 87857 O WAT 9545 138.410 107.139 103.334 1.00 0.00 O ATOM 87858 H1 WAT 9545 138.001 106.336 103.657 1.00 0.00 H ATOM 87859 H2 WAT 9545 137.688 107.636 102.949 1.00 0.00 H TER 87861 WAT 9545 ATOM 87861 O WAT 9546 35.573 142.054 91.403 1.00 0.00 O ATOM 87862 H1 WAT 9546 35.044 141.741 90.669 1.00 0.00 H ATOM 87863 H2 WAT 9546 36.297 141.431 91.459 1.00 0.00 H TER 87865 WAT 9546 ATOM 87865 O WAT 9547 53.532 24.858 78.182 1.00 0.00 O ATOM 87866 H1 WAT 9547 53.432 24.332 78.975 1.00 0.00 H ATOM 87867 H2 WAT 9547 54.281 25.425 78.364 1.00 0.00 H TER 87869 WAT 9547 ATOM 87869 O WAT 9548 105.054 62.084 10.695 1.00 0.00 O ATOM 87870 H1 WAT 9548 104.616 62.934 10.726 1.00 0.00 H ATOM 87871 H2 WAT 9548 104.821 61.664 11.524 1.00 0.00 H TER 87873 WAT 9548 ATOM 87873 O WAT 9549 44.841 43.731 128.090 1.00 0.00 O ATOM 87874 H1 WAT 9549 45.104 43.338 127.257 1.00 0.00 H ATOM 87875 H2 WAT 9549 44.111 44.307 127.863 1.00 0.00 H TER 87877 WAT 9549 ATOM 87877 O WAT 9550 64.436 0.915 115.402 1.00 0.00 O ATOM 87878 H1 WAT 9550 63.755 1.399 115.871 1.00 0.00 H ATOM 87879 H2 WAT 9550 64.868 0.393 116.078 1.00 0.00 H TER 87881 WAT 9550 ATOM 87881 O WAT 9551 145.291 48.158 141.964 1.00 0.00 O ATOM 87882 H1 WAT 9551 146.105 47.986 142.439 1.00 0.00 H ATOM 87883 H2 WAT 9551 145.131 47.357 141.465 1.00 0.00 H TER 87885 WAT 9551 ATOM 87885 O WAT 9552 70.602 20.590 2.829 1.00 0.00 O ATOM 87886 H1 WAT 9552 70.348 19.958 3.501 1.00 0.00 H ATOM 87887 H2 WAT 9552 71.455 20.282 2.521 1.00 0.00 H TER 87889 WAT 9552 ATOM 87889 O WAT 9553 53.113 129.055 66.532 1.00 0.00 O ATOM 87890 H1 WAT 9553 52.761 129.607 65.833 1.00 0.00 H ATOM 87891 H2 WAT 9553 52.851 129.497 67.340 1.00 0.00 H TER 87893 WAT 9553 ATOM 87893 O WAT 9554 9.713 77.652 12.610 1.00 0.00 O ATOM 87894 H1 WAT 9554 9.455 78.031 13.450 1.00 0.00 H ATOM 87895 H2 WAT 9554 9.652 76.706 12.745 1.00 0.00 H TER 87897 WAT 9554 ATOM 87897 O WAT 9555 97.640 34.148 140.292 1.00 0.00 O ATOM 87898 H1 WAT 9555 97.731 34.878 139.679 1.00 0.00 H ATOM 87899 H2 WAT 9555 96.793 34.293 140.714 1.00 0.00 H TER 87901 WAT 9555 ATOM 87901 O WAT 9556 139.228 24.187 23.705 1.00 0.00 O ATOM 87902 H1 WAT 9556 138.433 24.517 23.285 1.00 0.00 H ATOM 87903 H2 WAT 9556 139.739 24.972 23.901 1.00 0.00 H TER 87905 WAT 9556 ATOM 87905 O WAT 9557 50.743 -0.071 113.438 1.00 0.00 O ATOM 87906 H1 WAT 9557 50.968 -0.515 114.256 1.00 0.00 H ATOM 87907 H2 WAT 9557 51.329 0.685 113.407 1.00 0.00 H TER 87909 WAT 9557 ATOM 87909 O WAT 9558 141.771 25.971 67.947 1.00 0.00 O ATOM 87910 H1 WAT 9558 141.981 26.414 68.769 1.00 0.00 H ATOM 87911 H2 WAT 9558 142.622 25.784 67.551 1.00 0.00 H TER 87913 WAT 9558 ATOM 87913 O WAT 9559 122.292 94.807 69.617 1.00 0.00 O ATOM 87914 H1 WAT 9559 122.868 95.215 68.970 1.00 0.00 H ATOM 87915 H2 WAT 9559 121.792 94.161 69.120 1.00 0.00 H TER 87917 WAT 9559 ATOM 87917 O WAT 9560 126.379 124.753 84.879 1.00 0.00 O ATOM 87918 H1 WAT 9560 126.208 124.471 85.777 1.00 0.00 H ATOM 87919 H2 WAT 9560 126.903 125.548 84.973 1.00 0.00 H TER 87921 WAT 9560 ATOM 87921 O WAT 9561 33.322 96.722 151.719 1.00 0.00 O ATOM 87922 H1 WAT 9561 33.044 97.563 152.082 1.00 0.00 H ATOM 87923 H2 WAT 9561 33.646 96.935 150.844 1.00 0.00 H TER 87925 WAT 9561 ATOM 87925 O WAT 9562 24.816 94.590 88.403 1.00 0.00 O ATOM 87926 H1 WAT 9562 24.585 94.978 89.247 1.00 0.00 H ATOM 87927 H2 WAT 9562 24.870 93.650 88.579 1.00 0.00 H TER 87929 WAT 9562 ATOM 87929 O WAT 9563 135.101 131.781 122.262 1.00 0.00 O ATOM 87930 H1 WAT 9563 134.452 131.082 122.184 1.00 0.00 H ATOM 87931 H2 WAT 9563 135.395 131.936 121.364 1.00 0.00 H TER 87933 WAT 9563 ATOM 87933 O WAT 9564 80.325 67.489 23.648 1.00 0.00 O ATOM 87934 H1 WAT 9564 79.768 67.064 22.996 1.00 0.00 H ATOM 87935 H2 WAT 9564 79.720 68.005 24.180 1.00 0.00 H TER 87937 WAT 9564 ATOM 87937 O WAT 9565 98.830 79.291 23.104 1.00 0.00 O ATOM 87938 H1 WAT 9565 98.179 79.540 23.760 1.00 0.00 H ATOM 87939 H2 WAT 9565 98.388 78.634 22.565 1.00 0.00 H TER 87941 WAT 9565 ATOM 87941 O WAT 9566 99.452 138.219 87.281 1.00 0.00 O ATOM 87942 H1 WAT 9566 98.617 138.655 87.107 1.00 0.00 H ATOM 87943 H2 WAT 9566 99.484 137.502 86.648 1.00 0.00 H TER 87945 WAT 9566 ATOM 87945 O WAT 9567 60.913 1.605 105.666 1.00 0.00 O ATOM 87946 H1 WAT 9567 61.476 0.840 105.546 1.00 0.00 H ATOM 87947 H2 WAT 9567 60.029 1.244 105.731 1.00 0.00 H TER 87949 WAT 9567 ATOM 87949 O WAT 9568 80.826 122.042 136.970 1.00 0.00 O ATOM 87950 H1 WAT 9568 80.496 122.519 136.209 1.00 0.00 H ATOM 87951 H2 WAT 9568 81.435 121.400 136.604 1.00 0.00 H TER 87953 WAT 9568 ATOM 87953 O WAT 9569 96.243 1.860 151.487 1.00 0.00 O ATOM 87954 H1 WAT 9569 95.996 1.401 150.684 1.00 0.00 H ATOM 87955 H2 WAT 9569 95.549 2.506 151.617 1.00 0.00 H TER 87957 WAT 9569 ATOM 87957 O WAT 9570 41.172 121.788 82.749 1.00 0.00 O ATOM 87958 H1 WAT 9570 41.871 122.079 82.163 1.00 0.00 H ATOM 87959 H2 WAT 9570 41.185 120.833 82.681 1.00 0.00 H TER 87961 WAT 9570 ATOM 87961 O WAT 9571 69.267 10.348 105.597 1.00 0.00 O ATOM 87962 H1 WAT 9571 68.465 9.851 105.431 1.00 0.00 H ATOM 87963 H2 WAT 9571 69.808 10.193 104.823 1.00 0.00 H TER 87965 WAT 9571 ATOM 87965 O WAT 9572 76.394 109.128 148.976 1.00 0.00 O ATOM 87966 H1 WAT 9572 77.117 108.627 149.355 1.00 0.00 H ATOM 87967 H2 WAT 9572 76.821 109.834 148.491 1.00 0.00 H TER 87969 WAT 9572 ATOM 87969 O WAT 9573 35.174 101.287 135.912 1.00 0.00 O ATOM 87970 H1 WAT 9573 34.752 100.428 135.940 1.00 0.00 H ATOM 87971 H2 WAT 9573 34.925 101.703 136.737 1.00 0.00 H TER 87973 WAT 9573 ATOM 87973 O WAT 9574 62.678 82.474 133.221 1.00 0.00 O ATOM 87974 H1 WAT 9574 63.518 82.386 133.671 1.00 0.00 H ATOM 87975 H2 WAT 9574 62.102 82.883 133.867 1.00 0.00 H TER 87977 WAT 9574 ATOM 87977 O WAT 9575 61.293 1.115 3.738 1.00 0.00 O ATOM 87978 H1 WAT 9575 61.790 1.783 4.211 1.00 0.00 H ATOM 87979 H2 WAT 9575 60.503 1.569 3.444 1.00 0.00 H TER 87981 WAT 9575 ATOM 87981 O WAT 9576 31.876 12.191 149.921 1.00 0.00 O ATOM 87982 H1 WAT 9576 31.065 12.403 150.384 1.00 0.00 H ATOM 87983 H2 WAT 9576 31.666 11.404 149.419 1.00 0.00 H TER 87985 WAT 9576 ATOM 87985 O WAT 9577 143.756 105.104 130.752 1.00 0.00 O ATOM 87986 H1 WAT 9577 143.933 104.169 130.649 1.00 0.00 H ATOM 87987 H2 WAT 9577 144.608 105.524 130.635 1.00 0.00 H TER 87989 WAT 9577 ATOM 87989 O WAT 9578 58.710 36.865 7.338 1.00 0.00 O ATOM 87990 H1 WAT 9578 57.901 37.270 7.652 1.00 0.00 H ATOM 87991 H2 WAT 9578 58.452 35.978 7.086 1.00 0.00 H TER 87993 WAT 9578 ATOM 87993 O WAT 9579 9.133 12.832 71.419 1.00 0.00 O ATOM 87994 H1 WAT 9579 8.861 12.660 70.517 1.00 0.00 H ATOM 87995 H2 WAT 9579 9.174 13.787 71.478 1.00 0.00 H TER 87997 WAT 9579 ATOM 87997 O WAT 9580 52.133 131.094 134.530 1.00 0.00 O ATOM 87998 H1 WAT 9580 53.029 131.008 134.206 1.00 0.00 H ATOM 87999 H2 WAT 9580 52.094 131.976 134.898 1.00 0.00 H TER 88001 WAT 9580 ATOM 88001 O WAT 9581 33.531 1.362 101.524 1.00 0.00 O ATOM 88002 H1 WAT 9581 33.470 1.944 102.282 1.00 0.00 H ATOM 88003 H2 WAT 9581 32.996 1.786 100.853 1.00 0.00 H TER 88005 WAT 9581 ATOM 88005 O WAT 9582 49.726 57.954 98.007 1.00 0.00 O ATOM 88006 H1 WAT 9582 50.667 58.124 98.045 1.00 0.00 H ATOM 88007 H2 WAT 9582 49.652 57.119 97.546 1.00 0.00 H TER 88009 WAT 9582 ATOM 88009 O WAT 9583 129.827 134.185 127.336 1.00 0.00 O ATOM 88010 H1 WAT 9583 129.080 134.258 127.929 1.00 0.00 H ATOM 88011 H2 WAT 9583 129.542 134.626 126.536 1.00 0.00 H TER 88013 WAT 9583 ATOM 88013 O WAT 9584 79.325 22.253 13.382 1.00 0.00 O ATOM 88014 H1 WAT 9584 79.506 23.190 13.307 1.00 0.00 H ATOM 88015 H2 WAT 9584 79.787 21.983 14.176 1.00 0.00 H TER 88017 WAT 9584 ATOM 88017 O WAT 9585 27.399 55.709 17.749 1.00 0.00 O ATOM 88018 H1 WAT 9585 27.365 55.607 18.701 1.00 0.00 H ATOM 88019 H2 WAT 9585 26.802 55.040 17.415 1.00 0.00 H TER 88021 WAT 9585 ATOM 88021 O WAT 9586 109.538 136.595 1.101 1.00 0.00 O ATOM 88022 H1 WAT 9586 109.828 137.436 0.747 1.00 0.00 H ATOM 88023 H2 WAT 9586 110.136 135.955 0.715 1.00 0.00 H TER 88025 WAT 9586 ATOM 88025 O WAT 9587 135.507 45.240 129.424 1.00 0.00 O ATOM 88026 H1 WAT 9587 136.258 45.644 128.991 1.00 0.00 H ATOM 88027 H2 WAT 9587 134.852 45.936 129.468 1.00 0.00 H TER 88029 WAT 9587 ATOM 88029 O WAT 9588 33.747 75.922 95.749 1.00 0.00 O ATOM 88030 H1 WAT 9588 33.529 76.637 95.150 1.00 0.00 H ATOM 88031 H2 WAT 9588 33.419 75.136 95.312 1.00 0.00 H TER 88033 WAT 9588 ATOM 88033 O WAT 9589 108.286 39.180 151.341 1.00 0.00 O ATOM 88034 H1 WAT 9589 107.884 38.384 151.688 1.00 0.00 H ATOM 88035 H2 WAT 9589 109.227 39.033 151.434 1.00 0.00 H TER 88037 WAT 9589 ATOM 88037 O WAT 9590 25.494 129.569 8.130 1.00 0.00 O ATOM 88038 H1 WAT 9590 24.714 129.016 8.101 1.00 0.00 H ATOM 88039 H2 WAT 9590 26.154 129.078 7.640 1.00 0.00 H TER 88041 WAT 9590 ATOM 88041 O WAT 9591 70.022 85.688 -0.136 1.00 0.00 O ATOM 88042 H1 WAT 9591 69.870 85.727 0.809 1.00 0.00 H ATOM 88043 H2 WAT 9591 70.966 85.548 -0.221 1.00 0.00 H TER 88045 WAT 9591 ATOM 88045 O WAT 9592 95.536 56.460 10.207 1.00 0.00 O ATOM 88046 H1 WAT 9592 95.152 55.893 10.876 1.00 0.00 H ATOM 88047 H2 WAT 9592 95.151 57.321 10.374 1.00 0.00 H TER 88049 WAT 9592 ATOM 88049 O WAT 9593 23.189 98.253 91.101 1.00 0.00 O ATOM 88050 H1 WAT 9593 23.145 98.454 90.166 1.00 0.00 H ATOM 88051 H2 WAT 9593 22.275 98.198 91.378 1.00 0.00 H TER 88053 WAT 9593 ATOM 88053 O WAT 9594 107.413 34.806 132.702 1.00 0.00 O ATOM 88054 H1 WAT 9594 108.346 34.612 132.793 1.00 0.00 H ATOM 88055 H2 WAT 9594 107.192 34.513 131.819 1.00 0.00 H TER 88057 WAT 9594 ATOM 88057 O WAT 9595 78.788 24.581 52.618 1.00 0.00 O ATOM 88058 H1 WAT 9595 78.961 23.842 52.035 1.00 0.00 H ATOM 88059 H2 WAT 9595 79.391 25.264 52.325 1.00 0.00 H TER 88061 WAT 9595 ATOM 88061 O WAT 9596 123.821 42.956 62.534 1.00 0.00 O ATOM 88062 H1 WAT 9596 124.664 43.384 62.386 1.00 0.00 H ATOM 88063 H2 WAT 9596 123.198 43.469 62.019 1.00 0.00 H TER 88065 WAT 9596 ATOM 88065 O WAT 9597 58.998 107.863 84.015 1.00 0.00 O ATOM 88066 H1 WAT 9597 58.642 108.669 84.391 1.00 0.00 H ATOM 88067 H2 WAT 9597 58.266 107.248 84.032 1.00 0.00 H TER 88069 WAT 9597 ATOM 88069 O WAT 9598 136.435 37.139 148.341 1.00 0.00 O ATOM 88070 H1 WAT 9598 136.450 37.630 147.520 1.00 0.00 H ATOM 88071 H2 WAT 9598 135.889 37.666 148.925 1.00 0.00 H TER 88073 WAT 9598 ATOM 88073 O WAT 9599 101.866 125.806 88.793 1.00 0.00 O ATOM 88074 H1 WAT 9599 101.534 126.626 88.427 1.00 0.00 H ATOM 88075 H2 WAT 9599 102.555 125.535 88.186 1.00 0.00 H TER 88077 WAT 9599 ATOM 88077 O WAT 9600 22.372 39.985 16.244 1.00 0.00 O ATOM 88078 H1 WAT 9600 21.853 39.387 15.707 1.00 0.00 H ATOM 88079 H2 WAT 9600 22.637 39.461 17.000 1.00 0.00 H TER 88081 WAT 9600 ATOM 88081 O WAT 9601 143.122 2.848 120.668 1.00 0.00 O ATOM 88082 H1 WAT 9601 143.336 3.742 120.936 1.00 0.00 H ATOM 88083 H2 WAT 9601 143.969 2.449 120.467 1.00 0.00 H TER 88085 WAT 9601 ATOM 88085 O WAT 9602 92.458 30.337 150.258 1.00 0.00 O ATOM 88086 H1 WAT 9602 92.365 30.160 151.194 1.00 0.00 H ATOM 88087 H2 WAT 9602 93.321 29.988 150.033 1.00 0.00 H TER 88089 WAT 9602 ATOM 88089 O WAT 9603 37.311 85.059 114.643 1.00 0.00 O ATOM 88090 H1 WAT 9603 37.920 85.779 114.807 1.00 0.00 H ATOM 88091 H2 WAT 9603 36.493 85.340 115.053 1.00 0.00 H TER 88093 WAT 9603 ATOM 88093 O WAT 9604 87.638 106.423 76.773 1.00 0.00 O ATOM 88094 H1 WAT 9604 87.225 106.690 75.952 1.00 0.00 H ATOM 88095 H2 WAT 9604 88.490 106.076 76.511 1.00 0.00 H TER 88097 WAT 9604 ATOM 88097 O WAT 9605 85.178 131.321 69.093 1.00 0.00 O ATOM 88098 H1 WAT 9605 85.164 132.275 69.163 1.00 0.00 H ATOM 88099 H2 WAT 9605 84.420 131.032 69.601 1.00 0.00 H TER 88101 WAT 9605 ATOM 88101 O WAT 9606 74.207 126.102 74.781 1.00 0.00 O ATOM 88102 H1 WAT 9606 73.434 126.214 74.228 1.00 0.00 H ATOM 88103 H2 WAT 9606 74.946 126.164 74.175 1.00 0.00 H TER 88105 WAT 9606 ATOM 88105 O WAT 9607 44.665 61.846 26.910 1.00 0.00 O ATOM 88106 H1 WAT 9607 44.164 62.427 26.338 1.00 0.00 H ATOM 88107 H2 WAT 9607 44.371 62.067 27.794 1.00 0.00 H TER 88109 WAT 9607 ATOM 88109 O WAT 9608 115.031 115.310 84.695 1.00 0.00 O ATOM 88110 H1 WAT 9608 115.906 115.001 84.460 1.00 0.00 H ATOM 88111 H2 WAT 9608 114.913 116.109 84.180 1.00 0.00 H TER 88113 WAT 9608 ATOM 88113 O WAT 9609 59.642 119.765 96.178 1.00 0.00 O ATOM 88114 H1 WAT 9609 59.229 119.008 96.593 1.00 0.00 H ATOM 88115 H2 WAT 9609 60.300 119.388 95.594 1.00 0.00 H TER 88117 WAT 9609 ATOM 88117 O WAT 9610 35.036 136.212 100.878 1.00 0.00 O ATOM 88118 H1 WAT 9610 34.624 135.521 101.396 1.00 0.00 H ATOM 88119 H2 WAT 9610 34.474 136.302 100.108 1.00 0.00 H TER 88121 WAT 9610 ATOM 88121 O WAT 9611 135.989 109.283 106.873 1.00 0.00 O ATOM 88122 H1 WAT 9611 135.365 108.963 107.525 1.00 0.00 H ATOM 88123 H2 WAT 9611 135.482 109.889 106.333 1.00 0.00 H TER 88125 WAT 9611 ATOM 88125 O WAT 9612 16.211 52.554 96.109 1.00 0.00 O ATOM 88126 H1 WAT 9612 17.065 52.608 96.537 1.00 0.00 H ATOM 88127 H2 WAT 9612 15.593 52.869 96.769 1.00 0.00 H TER 88129 WAT 9612 ATOM 88129 O WAT 9613 5.215 130.993 19.605 1.00 0.00 O ATOM 88130 H1 WAT 9613 5.769 130.618 20.290 1.00 0.00 H ATOM 88131 H2 WAT 9613 4.522 131.450 20.081 1.00 0.00 H TER 88133 WAT 9613 ATOM 88133 O WAT 9614 26.616 132.812 124.112 1.00 0.00 O ATOM 88134 H1 WAT 9614 27.480 132.405 124.053 1.00 0.00 H ATOM 88135 H2 WAT 9614 26.786 133.685 124.465 1.00 0.00 H TER 88137 WAT 9614 ATOM 88137 O WAT 9615 39.347 48.779 20.672 1.00 0.00 O ATOM 88138 H1 WAT 9615 40.006 49.188 21.232 1.00 0.00 H ATOM 88139 H2 WAT 9615 39.250 49.384 19.936 1.00 0.00 H TER 88141 WAT 9615 ATOM 88141 O WAT 9616 19.647 5.171 115.825 1.00 0.00 O ATOM 88142 H1 WAT 9616 19.683 5.151 114.868 1.00 0.00 H ATOM 88143 H2 WAT 9616 19.088 4.430 116.059 1.00 0.00 H TER 88145 WAT 9616 ATOM 88145 O WAT 9617 127.420 33.934 71.210 1.00 0.00 O ATOM 88146 H1 WAT 9617 127.868 33.159 70.871 1.00 0.00 H ATOM 88147 H2 WAT 9617 127.449 33.830 72.161 1.00 0.00 H TER 88149 WAT 9617 ATOM 88149 O WAT 9618 62.257 83.903 143.507 1.00 0.00 O ATOM 88150 H1 WAT 9618 63.162 83.820 143.808 1.00 0.00 H ATOM 88151 H2 WAT 9618 61.801 84.330 144.232 1.00 0.00 H TER 88153 WAT 9618 ATOM 88153 O WAT 9619 34.748 139.746 50.393 1.00 0.00 O ATOM 88154 H1 WAT 9619 34.879 138.799 50.358 1.00 0.00 H ATOM 88155 H2 WAT 9619 34.368 139.967 49.543 1.00 0.00 H TER 88157 WAT 9619 ATOM 88157 O WAT 9620 123.584 8.886 99.241 1.00 0.00 O ATOM 88158 H1 WAT 9620 123.234 8.493 98.442 1.00 0.00 H ATOM 88159 H2 WAT 9620 123.444 9.826 99.127 1.00 0.00 H TER 88161 WAT 9620 ATOM 88161 O WAT 9621 47.172 69.912 152.711 1.00 0.00 O ATOM 88162 H1 WAT 9621 47.108 70.770 152.292 1.00 0.00 H ATOM 88163 H2 WAT 9621 47.302 69.301 151.985 1.00 0.00 H TER 88165 WAT 9621 ATOM 88165 O WAT 9622 48.956 19.651 109.897 1.00 0.00 O ATOM 88166 H1 WAT 9622 48.096 19.307 110.141 1.00 0.00 H ATOM 88167 H2 WAT 9622 48.767 20.489 109.473 1.00 0.00 H TER 88169 WAT 9622 ATOM 88169 O WAT 9623 102.298 135.029 23.292 1.00 0.00 O ATOM 88170 H1 WAT 9623 101.745 134.277 23.081 1.00 0.00 H ATOM 88171 H2 WAT 9623 103.167 134.654 23.438 1.00 0.00 H TER 88173 WAT 9623 ATOM 88173 O WAT 9624 66.269 2.384 79.757 1.00 0.00 O ATOM 88174 H1 WAT 9624 66.275 1.487 79.424 1.00 0.00 H ATOM 88175 H2 WAT 9624 65.568 2.816 79.268 1.00 0.00 H TER 88177 WAT 9624 ATOM 88177 O WAT 9625 140.910 9.090 138.223 1.00 0.00 O ATOM 88178 H1 WAT 9625 141.446 8.702 137.531 1.00 0.00 H ATOM 88179 H2 WAT 9625 141.442 9.808 138.563 1.00 0.00 H TER 88181 WAT 9625 ATOM 88181 O WAT 9626 129.132 83.614 23.094 1.00 0.00 O ATOM 88182 H1 WAT 9626 129.370 83.060 23.837 1.00 0.00 H ATOM 88183 H2 WAT 9626 129.711 83.328 22.387 1.00 0.00 H TER 88185 WAT 9626 ATOM 88185 O WAT 9627 19.356 56.305 61.841 1.00 0.00 O ATOM 88186 H1 WAT 9627 18.521 56.363 61.378 1.00 0.00 H ATOM 88187 H2 WAT 9627 19.979 56.008 61.177 1.00 0.00 H TER 88189 WAT 9627 ATOM 88189 O WAT 9628 136.311 9.415 89.495 1.00 0.00 O ATOM 88190 H1 WAT 9628 136.640 9.872 88.721 1.00 0.00 H ATOM 88191 H2 WAT 9628 135.472 9.835 89.683 1.00 0.00 H TER 88193 WAT 9628 ATOM 88193 O WAT 9629 9.284 99.455 97.089 1.00 0.00 O ATOM 88194 H1 WAT 9629 9.474 99.081 96.229 1.00 0.00 H ATOM 88195 H2 WAT 9629 9.576 100.364 97.024 1.00 0.00 H TER 88197 WAT 9629 ATOM 88197 O WAT 9630 30.105 55.888 109.833 1.00 0.00 O ATOM 88198 H1 WAT 9630 30.883 55.621 109.344 1.00 0.00 H ATOM 88199 H2 WAT 9630 30.375 56.678 110.301 1.00 0.00 H TER 88201 WAT 9630 ATOM 88201 O WAT 9631 5.914 64.923 149.015 1.00 0.00 O ATOM 88202 H1 WAT 9631 6.074 64.016 148.752 1.00 0.00 H ATOM 88203 H2 WAT 9631 6.788 65.304 149.106 1.00 0.00 H TER 88205 WAT 9631 ATOM 88205 O WAT 9632 42.835 33.537 106.680 1.00 0.00 O ATOM 88206 H1 WAT 9632 43.188 34.138 107.335 1.00 0.00 H ATOM 88207 H2 WAT 9632 43.487 32.839 106.619 1.00 0.00 H TER 88209 WAT 9632 ATOM 88209 O WAT 9633 66.561 107.173 13.512 1.00 0.00 O ATOM 88210 H1 WAT 9633 65.867 107.572 14.036 1.00 0.00 H ATOM 88211 H2 WAT 9633 66.799 107.848 12.876 1.00 0.00 H TER 88213 WAT 9633 ATOM 88213 O WAT 9634 41.081 16.668 154.773 1.00 0.00 O ATOM 88214 H1 WAT 9634 40.851 17.061 155.615 1.00 0.00 H ATOM 88215 H2 WAT 9634 40.580 15.852 154.745 1.00 0.00 H TER 88217 WAT 9634 ATOM 88217 O WAT 9635 52.948 74.800 73.718 1.00 0.00 O ATOM 88218 H1 WAT 9635 53.243 74.043 73.211 1.00 0.00 H ATOM 88219 H2 WAT 9635 53.545 75.504 73.466 1.00 0.00 H TER 88221 WAT 9635 ATOM 88221 O WAT 9636 55.962 70.140 99.894 1.00 0.00 O ATOM 88222 H1 WAT 9636 56.692 69.664 99.499 1.00 0.00 H ATOM 88223 H2 WAT 9636 55.201 69.890 99.369 1.00 0.00 H TER 88225 WAT 9636 ATOM 88225 O WAT 9637 106.351 76.149 5.471 1.00 0.00 O ATOM 88226 H1 WAT 9637 105.547 76.647 5.620 1.00 0.00 H ATOM 88227 H2 WAT 9637 106.449 76.131 4.519 1.00 0.00 H TER 88229 WAT 9637 ATOM 88229 O WAT 9638 10.800 60.144 0.381 1.00 0.00 O ATOM 88230 H1 WAT 9638 10.024 59.687 0.703 1.00 0.00 H ATOM 88231 H2 WAT 9638 10.680 61.050 0.663 1.00 0.00 H TER 88233 WAT 9638 ATOM 88233 O WAT 9639 31.873 56.027 84.158 1.00 0.00 O ATOM 88234 H1 WAT 9639 31.932 55.316 84.796 1.00 0.00 H ATOM 88235 H2 WAT 9639 30.991 55.950 83.795 1.00 0.00 H TER 88237 WAT 9639 ATOM 88237 O WAT 9640 45.324 27.380 105.181 1.00 0.00 O ATOM 88238 H1 WAT 9640 45.209 26.732 105.876 1.00 0.00 H ATOM 88239 H2 WAT 9640 45.099 28.215 105.592 1.00 0.00 H TER 88241 WAT 9640 ATOM 88241 O WAT 9641 44.194 32.546 144.237 1.00 0.00 O ATOM 88242 H1 WAT 9641 44.226 33.044 145.054 1.00 0.00 H ATOM 88243 H2 WAT 9641 43.260 32.452 144.050 1.00 0.00 H TER 88245 WAT 9641 ATOM 88245 O WAT 9642 128.667 129.644 17.326 1.00 0.00 O ATOM 88246 H1 WAT 9642 129.318 129.722 18.023 1.00 0.00 H ATOM 88247 H2 WAT 9642 128.748 128.739 17.022 1.00 0.00 H TER 88249 WAT 9642 ATOM 88249 O WAT 9643 16.696 44.368 75.257 1.00 0.00 O ATOM 88250 H1 WAT 9643 17.101 44.645 76.079 1.00 0.00 H ATOM 88251 H2 WAT 9643 16.144 43.625 75.501 1.00 0.00 H TER 88253 WAT 9643 ATOM 88253 O WAT 9644 143.622 4.725 149.138 1.00 0.00 O ATOM 88254 H1 WAT 9644 143.570 4.239 148.315 1.00 0.00 H ATOM 88255 H2 WAT 9644 143.909 5.602 148.881 1.00 0.00 H TER 88257 WAT 9644 ATOM 88257 O WAT 9645 133.429 140.045 109.526 1.00 0.00 O ATOM 88258 H1 WAT 9645 133.411 139.630 110.388 1.00 0.00 H ATOM 88259 H2 WAT 9645 132.515 140.267 109.348 1.00 0.00 H TER 88261 WAT 9645 ATOM 88261 O WAT 9646 28.346 90.855 110.692 1.00 0.00 O ATOM 88262 H1 WAT 9646 28.428 91.789 110.498 1.00 0.00 H ATOM 88263 H2 WAT 9646 28.185 90.447 109.842 1.00 0.00 H TER 88265 WAT 9646 ATOM 88265 O WAT 9647 25.322 109.353 132.054 1.00 0.00 O ATOM 88266 H1 WAT 9647 25.514 110.249 131.777 1.00 0.00 H ATOM 88267 H2 WAT 9647 25.289 108.852 131.240 1.00 0.00 H TER 88269 WAT 9647 ATOM 88269 O WAT 9648 6.236 75.060 61.530 1.00 0.00 O ATOM 88270 H1 WAT 9648 5.939 74.770 62.392 1.00 0.00 H ATOM 88271 H2 WAT 9648 6.651 74.288 61.146 1.00 0.00 H TER 88273 WAT 9648 ATOM 88273 O WAT 9649 96.997 71.754 61.666 1.00 0.00 O ATOM 88274 H1 WAT 9649 96.783 71.209 60.909 1.00 0.00 H ATOM 88275 H2 WAT 9649 97.836 72.157 61.442 1.00 0.00 H TER 88277 WAT 9649 ATOM 88277 O WAT 9650 43.469 37.907 76.225 1.00 0.00 O ATOM 88278 H1 WAT 9650 43.853 37.057 76.441 1.00 0.00 H ATOM 88279 H2 WAT 9650 44.068 38.283 75.580 1.00 0.00 H TER 88281 WAT 9650 ATOM 88281 O WAT 9651 59.460 134.208 73.865 1.00 0.00 O ATOM 88282 H1 WAT 9651 59.075 134.691 74.596 1.00 0.00 H ATOM 88283 H2 WAT 9651 60.274 133.849 74.217 1.00 0.00 H TER 88285 WAT 9651 ATOM 88285 O WAT 9652 9.512 26.281 158.294 1.00 0.00 O ATOM 88286 H1 WAT 9652 10.043 26.168 157.506 1.00 0.00 H ATOM 88287 H2 WAT 9652 9.123 25.420 158.446 1.00 0.00 H TER 88289 WAT 9652 ATOM 88289 O WAT 9653 20.225 101.837 100.948 1.00 0.00 O ATOM 88290 H1 WAT 9653 20.995 101.615 100.424 1.00 0.00 H ATOM 88291 H2 WAT 9653 20.173 101.142 101.603 1.00 0.00 H TER 88293 WAT 9653 ATOM 88293 O WAT 9654 67.892 58.865 113.670 1.00 0.00 O ATOM 88294 H1 WAT 9654 68.542 59.403 113.217 1.00 0.00 H ATOM 88295 H2 WAT 9654 67.160 59.460 113.831 1.00 0.00 H TER 88297 WAT 9654 ATOM 88297 O WAT 9655 89.571 71.989 86.697 1.00 0.00 O ATOM 88298 H1 WAT 9655 88.832 71.535 87.104 1.00 0.00 H ATOM 88299 H2 WAT 9655 90.255 71.980 87.366 1.00 0.00 H TER 88301 WAT 9655 ATOM 88301 O WAT 9656 90.227 105.678 148.392 1.00 0.00 O ATOM 88302 H1 WAT 9656 89.707 106.304 147.888 1.00 0.00 H ATOM 88303 H2 WAT 9656 90.210 106.017 149.287 1.00 0.00 H TER 88305 WAT 9656 ATOM 88305 O WAT 9657 122.982 82.590 79.710 1.00 0.00 O ATOM 88306 H1 WAT 9657 123.550 82.015 79.197 1.00 0.00 H ATOM 88307 H2 WAT 9657 122.863 82.129 80.540 1.00 0.00 H TER 88309 WAT 9657 ATOM 88309 O WAT 9658 107.270 31.193 130.016 1.00 0.00 O ATOM 88310 H1 WAT 9658 107.580 30.970 129.138 1.00 0.00 H ATOM 88311 H2 WAT 9658 107.915 30.800 130.604 1.00 0.00 H TER 88313 WAT 9658 ATOM 88313 O WAT 9659 49.351 81.696 12.255 1.00 0.00 O ATOM 88314 H1 WAT 9659 49.621 82.123 11.442 1.00 0.00 H ATOM 88315 H2 WAT 9659 49.105 82.418 12.834 1.00 0.00 H TER 88317 WAT 9659 ATOM 88317 O WAT 9660 71.586 78.714 141.666 1.00 0.00 O ATOM 88318 H1 WAT 9660 70.816 78.251 141.996 1.00 0.00 H ATOM 88319 H2 WAT 9660 72.330 78.213 142.000 1.00 0.00 H TER 88321 WAT 9660 ATOM 88321 O WAT 9661 106.589 5.201 123.246 1.00 0.00 O ATOM 88322 H1 WAT 9661 105.794 5.333 123.762 1.00 0.00 H ATOM 88323 H2 WAT 9661 106.504 4.314 122.896 1.00 0.00 H TER 88325 WAT 9661 ATOM 88325 O WAT 9662 27.272 21.185 86.992 1.00 0.00 O ATOM 88326 H1 WAT 9662 27.297 20.997 87.930 1.00 0.00 H ATOM 88327 H2 WAT 9662 26.340 21.194 86.774 1.00 0.00 H TER 88329 WAT 9662 ATOM 88329 O WAT 9663 42.924 25.342 18.700 1.00 0.00 O ATOM 88330 H1 WAT 9663 43.150 24.781 19.442 1.00 0.00 H ATOM 88331 H2 WAT 9663 42.715 24.731 17.993 1.00 0.00 H TER 88333 WAT 9663 ATOM 88333 O WAT 9664 28.132 42.317 149.930 1.00 0.00 O ATOM 88334 H1 WAT 9664 28.095 41.977 149.036 1.00 0.00 H ATOM 88335 H2 WAT 9664 28.846 42.955 149.915 1.00 0.00 H TER 88337 WAT 9664 ATOM 88337 O WAT 9665 58.074 115.010 115.992 1.00 0.00 O ATOM 88338 H1 WAT 9665 58.382 115.403 115.175 1.00 0.00 H ATOM 88339 H2 WAT 9665 58.139 114.066 115.843 1.00 0.00 H TER 88341 WAT 9665 ATOM 88341 O WAT 9666 126.069 126.882 132.020 1.00 0.00 O ATOM 88342 H1 WAT 9666 126.341 127.789 132.161 1.00 0.00 H ATOM 88343 H2 WAT 9666 125.192 126.833 132.402 1.00 0.00 H TER 88345 WAT 9666 ATOM 88345 O WAT 9667 9.978 128.362 82.507 1.00 0.00 O ATOM 88346 H1 WAT 9667 10.310 128.491 83.395 1.00 0.00 H ATOM 88347 H2 WAT 9667 10.764 128.246 81.972 1.00 0.00 H TER 88349 WAT 9667 ATOM 88349 O WAT 9668 70.083 11.897 133.227 1.00 0.00 O ATOM 88350 H1 WAT 9668 70.949 11.549 133.439 1.00 0.00 H ATOM 88351 H2 WAT 9668 69.951 11.667 132.307 1.00 0.00 H TER 88353 WAT 9668 ATOM 88353 O WAT 9669 124.032 30.603 22.471 1.00 0.00 O ATOM 88354 H1 WAT 9669 124.947 30.377 22.642 1.00 0.00 H ATOM 88355 H2 WAT 9669 123.575 30.379 23.282 1.00 0.00 H TER 88357 WAT 9669 ATOM 88357 O WAT 9670 79.310 99.741 118.572 1.00 0.00 O ATOM 88358 H1 WAT 9670 78.665 100.308 118.149 1.00 0.00 H ATOM 88359 H2 WAT 9670 80.084 99.799 118.012 1.00 0.00 H TER 88361 WAT 9670 ATOM 88361 O WAT 9671 22.048 13.929 112.996 1.00 0.00 O ATOM 88362 H1 WAT 9671 21.372 13.944 112.319 1.00 0.00 H ATOM 88363 H2 WAT 9671 22.128 13.005 113.234 1.00 0.00 H TER 88365 WAT 9671 ATOM 88365 O WAT 9672 51.045 31.621 62.142 1.00 0.00 O ATOM 88366 H1 WAT 9672 51.253 32.554 62.193 1.00 0.00 H ATOM 88367 H2 WAT 9672 51.788 31.187 62.561 1.00 0.00 H TER 88369 WAT 9672 ATOM 88369 O WAT 9673 54.979 126.654 59.356 1.00 0.00 O ATOM 88370 H1 WAT 9673 55.831 126.397 59.708 1.00 0.00 H ATOM 88371 H2 WAT 9673 54.368 126.516 60.080 1.00 0.00 H TER 88373 WAT 9673 ATOM 88373 O WAT 9674 102.288 42.257 10.423 1.00 0.00 O ATOM 88374 H1 WAT 9674 102.425 41.314 10.513 1.00 0.00 H ATOM 88375 H2 WAT 9674 101.976 42.537 11.284 1.00 0.00 H TER 88377 WAT 9674 ATOM 88377 O WAT 9675 117.771 95.675 89.606 1.00 0.00 O ATOM 88378 H1 WAT 9675 118.657 95.377 89.811 1.00 0.00 H ATOM 88379 H2 WAT 9675 117.847 96.075 88.740 1.00 0.00 H TER 88381 WAT 9675 ATOM 88381 O WAT 9676 123.203 127.918 114.265 1.00 0.00 O ATOM 88382 H1 WAT 9676 123.595 128.788 114.337 1.00 0.00 H ATOM 88383 H2 WAT 9676 123.876 127.324 114.599 1.00 0.00 H TER 88385 WAT 9676 ATOM 88385 O WAT 9677 145.595 130.542 24.053 1.00 0.00 O ATOM 88386 H1 WAT 9677 145.733 131.172 24.760 1.00 0.00 H ATOM 88387 H2 WAT 9677 144.725 130.750 23.714 1.00 0.00 H TER 88389 WAT 9677 ATOM 88389 O WAT 9678 133.731 32.436 53.555 1.00 0.00 O ATOM 88390 H1 WAT 9678 133.364 32.923 52.817 1.00 0.00 H ATOM 88391 H2 WAT 9678 133.608 31.516 53.319 1.00 0.00 H TER 88393 WAT 9678 ATOM 88393 O WAT 9679 54.505 95.430 61.175 1.00 0.00 O ATOM 88394 H1 WAT 9679 55.058 94.830 60.675 1.00 0.00 H ATOM 88395 H2 WAT 9679 55.074 96.175 61.369 1.00 0.00 H TER 88397 WAT 9679 ATOM 88397 O WAT 9680 114.659 15.114 60.881 1.00 0.00 O ATOM 88398 H1 WAT 9680 113.909 14.912 60.323 1.00 0.00 H ATOM 88399 H2 WAT 9680 115.003 14.259 61.140 1.00 0.00 H TER 88401 WAT 9680 ATOM 88401 O WAT 9681 34.213 103.309 117.745 1.00 0.00 O ATOM 88402 H1 WAT 9681 34.020 102.471 118.164 1.00 0.00 H ATOM 88403 H2 WAT 9681 33.468 103.867 117.969 1.00 0.00 H TER 88405 WAT 9681 ATOM 88405 O WAT 9682 49.734 59.337 27.805 1.00 0.00 O ATOM 88406 H1 WAT 9682 49.096 60.048 27.737 1.00 0.00 H ATOM 88407 H2 WAT 9682 49.204 58.553 27.946 1.00 0.00 H TER 88409 WAT 9682 ATOM 88409 O WAT 9683 41.937 76.447 79.450 1.00 0.00 O ATOM 88410 H1 WAT 9683 41.630 77.348 79.553 1.00 0.00 H ATOM 88411 H2 WAT 9683 42.287 76.214 80.310 1.00 0.00 H TER 88413 WAT 9683 ATOM 88413 O WAT 9684 109.996 96.023 102.323 1.00 0.00 O ATOM 88414 H1 WAT 9684 110.619 96.166 101.610 1.00 0.00 H ATOM 88415 H2 WAT 9684 109.942 95.071 102.405 1.00 0.00 H TER 88417 WAT 9684 ATOM 88417 O WAT 9685 23.909 118.189 71.635 1.00 0.00 O ATOM 88418 H1 WAT 9685 23.198 117.944 71.042 1.00 0.00 H ATOM 88419 H2 WAT 9685 23.844 117.564 72.357 1.00 0.00 H TER 88421 WAT 9685 ATOM 88421 O WAT 9686 102.645 59.630 77.950 1.00 0.00 O ATOM 88422 H1 WAT 9686 102.557 59.972 77.061 1.00 0.00 H ATOM 88423 H2 WAT 9686 102.054 60.171 78.475 1.00 0.00 H TER 88425 WAT 9686 ATOM 88425 O WAT 9687 82.363 111.525 3.465 1.00 0.00 O ATOM 88426 H1 WAT 9687 81.990 112.048 4.175 1.00 0.00 H ATOM 88427 H2 WAT 9687 82.829 110.816 3.908 1.00 0.00 H TER 88429 WAT 9687 ATOM 88429 O WAT 9688 71.739 29.643 151.577 1.00 0.00 O ATOM 88430 H1 WAT 9688 71.657 28.746 151.900 1.00 0.00 H ATOM 88431 H2 WAT 9688 72.443 30.024 152.103 1.00 0.00 H TER 88433 WAT 9688 ATOM 88433 O WAT 9689 79.053 107.708 63.040 1.00 0.00 O ATOM 88434 H1 WAT 9689 78.854 107.620 63.972 1.00 0.00 H ATOM 88435 H2 WAT 9689 79.246 108.639 62.924 1.00 0.00 H TER 88437 WAT 9689 ATOM 88437 O WAT 9690 98.081 111.406 12.087 1.00 0.00 O ATOM 88438 H1 WAT 9690 98.942 111.144 12.411 1.00 0.00 H ATOM 88439 H2 WAT 9690 97.591 110.587 12.019 1.00 0.00 H TER 88441 WAT 9690 ATOM 88441 O WAT 9691 74.718 97.572 133.478 1.00 0.00 O ATOM 88442 H1 WAT 9691 74.224 98.391 133.532 1.00 0.00 H ATOM 88443 H2 WAT 9691 74.056 96.887 133.559 1.00 0.00 H TER 88445 WAT 9691 ATOM 88445 O WAT 9692 85.463 73.964 4.544 1.00 0.00 O ATOM 88446 H1 WAT 9692 86.041 74.156 3.805 1.00 0.00 H ATOM 88447 H2 WAT 9692 85.740 74.573 5.229 1.00 0.00 H TER 88449 WAT 9692 ATOM 88449 O WAT 9693 59.233 8.732 128.388 1.00 0.00 O ATOM 88450 H1 WAT 9693 59.859 9.347 128.005 1.00 0.00 H ATOM 88451 H2 WAT 9693 58.384 9.165 128.294 1.00 0.00 H TER 88453 WAT 9693 ATOM 88453 O WAT 9694 90.193 95.975 111.641 1.00 0.00 O ATOM 88454 H1 WAT 9694 89.437 95.991 111.054 1.00 0.00 H ATOM 88455 H2 WAT 9694 90.563 96.856 111.579 1.00 0.00 H TER 88457 WAT 9694 ATOM 88457 O WAT 9695 44.214 78.785 99.189 1.00 0.00 O ATOM 88458 H1 WAT 9695 43.745 77.973 99.000 1.00 0.00 H ATOM 88459 H2 WAT 9695 44.654 79.005 98.368 1.00 0.00 H TER 88461 WAT 9695 ATOM 88461 O WAT 9696 131.391 64.598 27.120 1.00 0.00 O ATOM 88462 H1 WAT 9696 131.538 63.673 26.920 1.00 0.00 H ATOM 88463 H2 WAT 9696 130.967 64.592 27.978 1.00 0.00 H TER 88465 WAT 9696 ATOM 88465 O WAT 9697 82.332 42.820 76.104 1.00 0.00 O ATOM 88466 H1 WAT 9697 82.348 41.863 76.081 1.00 0.00 H ATOM 88467 H2 WAT 9697 81.417 43.040 76.281 1.00 0.00 H TER 88469 WAT 9697 ATOM 88469 O WAT 9698 52.614 64.521 79.010 1.00 0.00 O ATOM 88470 H1 WAT 9698 53.108 65.337 78.927 1.00 0.00 H ATOM 88471 H2 WAT 9698 51.785 64.783 79.411 1.00 0.00 H TER 88473 WAT 9698 ATOM 88473 O WAT 9699 46.668 87.748 131.592 1.00 0.00 O ATOM 88474 H1 WAT 9699 46.029 87.164 131.181 1.00 0.00 H ATOM 88475 H2 WAT 9699 47.053 87.224 132.294 1.00 0.00 H TER 88477 WAT 9699 ATOM 88477 O WAT 9700 25.617 112.030 110.514 1.00 0.00 O ATOM 88478 H1 WAT 9700 25.659 112.984 110.450 1.00 0.00 H ATOM 88479 H2 WAT 9700 25.928 111.718 109.664 1.00 0.00 H TER 88481 WAT 9700 ATOM 88481 O WAT 9701 19.958 106.257 85.853 1.00 0.00 O ATOM 88482 H1 WAT 9701 19.308 106.773 85.376 1.00 0.00 H ATOM 88483 H2 WAT 9701 20.801 106.576 85.530 1.00 0.00 H TER 88485 WAT 9701 ATOM 88485 O WAT 9702 18.666 145.492 102.182 1.00 0.00 O ATOM 88486 H1 WAT 9702 19.471 145.883 102.523 1.00 0.00 H ATOM 88487 H2 WAT 9702 18.212 145.164 102.958 1.00 0.00 H TER 88489 WAT 9702 ATOM 88489 O WAT 9703 74.114 52.784 99.756 1.00 0.00 O ATOM 88490 H1 WAT 9703 74.246 52.419 98.881 1.00 0.00 H ATOM 88491 H2 WAT 9703 73.524 52.166 100.187 1.00 0.00 H TER 88493 WAT 9703 ATOM 88493 O WAT 9704 24.157 28.247 80.836 1.00 0.00 O ATOM 88494 H1 WAT 9704 24.274 28.155 79.891 1.00 0.00 H ATOM 88495 H2 WAT 9704 23.849 29.145 80.954 1.00 0.00 H TER 88497 WAT 9704 ATOM 88497 O WAT 9705 91.926 87.353 106.317 1.00 0.00 O ATOM 88498 H1 WAT 9705 91.492 87.277 107.167 1.00 0.00 H ATOM 88499 H2 WAT 9705 91.254 87.108 105.681 1.00 0.00 H TER 88501 WAT 9705 ATOM 88501 O WAT 9706 136.214 69.479 153.619 1.00 0.00 O ATOM 88502 H1 WAT 9706 136.058 69.239 152.705 1.00 0.00 H ATOM 88503 H2 WAT 9706 135.656 68.885 154.121 1.00 0.00 H TER 88505 WAT 9706 ATOM 88505 O WAT 9707 43.055 118.428 126.578 1.00 0.00 O ATOM 88506 H1 WAT 9707 42.311 118.000 127.002 1.00 0.00 H ATOM 88507 H2 WAT 9707 43.297 117.836 125.865 1.00 0.00 H TER 88509 WAT 9707 ATOM 88509 O WAT 9708 38.637 80.761 107.680 1.00 0.00 O ATOM 88510 H1 WAT 9708 39.271 80.144 108.046 1.00 0.00 H ATOM 88511 H2 WAT 9708 37.805 80.521 108.088 1.00 0.00 H TER 88513 WAT 9708 ATOM 88513 O WAT 9709 67.541 10.949 122.692 1.00 0.00 O ATOM 88514 H1 WAT 9709 67.069 11.496 122.064 1.00 0.00 H ATOM 88515 H2 WAT 9709 68.274 10.588 122.192 1.00 0.00 H TER 88517 WAT 9709 ATOM 88517 O WAT 9710 2.097 45.253 5.254 1.00 0.00 O ATOM 88518 H1 WAT 9710 2.893 44.979 4.797 1.00 0.00 H ATOM 88519 H2 WAT 9710 1.864 46.088 4.849 1.00 0.00 H TER 88521 WAT 9710 ATOM 88521 O WAT 9711 74.210 38.015 10.423 1.00 0.00 O ATOM 88522 H1 WAT 9711 74.084 38.926 10.160 1.00 0.00 H ATOM 88523 H2 WAT 9711 73.943 37.992 11.342 1.00 0.00 H TER 88525 WAT 9711 ATOM 88525 O WAT 9712 74.433 74.329 63.827 1.00 0.00 O ATOM 88526 H1 WAT 9712 73.540 74.001 63.713 1.00 0.00 H ATOM 88527 H2 WAT 9712 74.320 75.230 64.130 1.00 0.00 H TER 88529 WAT 9712 ATOM 88529 O WAT 9713 40.457 34.727 58.044 1.00 0.00 O ATOM 88530 H1 WAT 9713 39.743 35.246 57.673 1.00 0.00 H ATOM 88531 H2 WAT 9713 40.042 34.205 58.730 1.00 0.00 H TER 88533 WAT 9713 ATOM 88533 O WAT 9714 22.442 23.271 104.419 1.00 0.00 O ATOM 88534 H1 WAT 9714 23.162 23.558 103.857 1.00 0.00 H ATOM 88535 H2 WAT 9714 21.722 23.095 103.814 1.00 0.00 H TER 88537 WAT 9714 ATOM 88537 O WAT 9715 138.746 17.912 107.276 1.00 0.00 O ATOM 88538 H1 WAT 9715 138.052 17.647 106.673 1.00 0.00 H ATOM 88539 H2 WAT 9715 139.163 18.660 106.848 1.00 0.00 H TER 88541 WAT 9715 ATOM 88541 O WAT 9716 124.656 143.403 21.536 1.00 0.00 O ATOM 88542 H1 WAT 9716 124.259 143.175 22.377 1.00 0.00 H ATOM 88543 H2 WAT 9716 124.280 144.255 21.317 1.00 0.00 H TER 88545 WAT 9716 ATOM 88545 O WAT 9717 132.521 26.358 134.186 1.00 0.00 O ATOM 88546 H1 WAT 9717 133.446 26.110 134.182 1.00 0.00 H ATOM 88547 H2 WAT 9717 132.053 25.535 134.044 1.00 0.00 H TER 88549 WAT 9717 ATOM 88549 O WAT 9718 134.948 139.284 61.082 1.00 0.00 O ATOM 88550 H1 WAT 9718 135.695 138.897 60.626 1.00 0.00 H ATOM 88551 H2 WAT 9718 135.240 139.372 61.989 1.00 0.00 H TER 88553 WAT 9718 ATOM 88553 O WAT 9719 39.408 127.393 62.504 1.00 0.00 O ATOM 88554 H1 WAT 9719 39.839 127.855 61.785 1.00 0.00 H ATOM 88555 H2 WAT 9719 38.486 127.357 62.247 1.00 0.00 H TER 88557 WAT 9719 ATOM 88557 O WAT 9720 39.432 133.312 133.717 1.00 0.00 O ATOM 88558 H1 WAT 9720 39.354 133.372 134.669 1.00 0.00 H ATOM 88559 H2 WAT 9720 39.134 134.164 133.399 1.00 0.00 H TER 88561 WAT 9720 ATOM 88561 O WAT 9721 81.250 57.658 91.839 1.00 0.00 O ATOM 88562 H1 WAT 9721 81.533 57.745 92.749 1.00 0.00 H ATOM 88563 H2 WAT 9721 80.326 57.908 91.851 1.00 0.00 H TER 88565 WAT 9721 ATOM 88565 O WAT 9722 144.997 112.805 67.819 1.00 0.00 O ATOM 88566 H1 WAT 9722 144.647 112.975 66.944 1.00 0.00 H ATOM 88567 H2 WAT 9722 145.230 113.670 68.156 1.00 0.00 H TER 88569 WAT 9722 ATOM 88569 O WAT 9723 106.539 40.135 85.480 1.00 0.00 O ATOM 88570 H1 WAT 9723 106.918 39.334 85.841 1.00 0.00 H ATOM 88571 H2 WAT 9723 107.251 40.773 85.514 1.00 0.00 H TER 88573 WAT 9723 ATOM 88573 O WAT 9724 111.642 121.512 56.834 1.00 0.00 O ATOM 88574 H1 WAT 9724 110.812 121.806 57.209 1.00 0.00 H ATOM 88575 H2 WAT 9724 112.043 122.308 56.484 1.00 0.00 H TER 88577 WAT 9724 ATOM 88577 O WAT 9725 104.304 23.390 61.905 1.00 0.00 O ATOM 88578 H1 WAT 9725 105.154 23.207 61.504 1.00 0.00 H ATOM 88579 H2 WAT 9725 103.668 22.986 61.314 1.00 0.00 H TER 88581 WAT 9725 ATOM 88581 O WAT 9726 18.521 108.431 85.087 1.00 0.00 O ATOM 88582 H1 WAT 9726 18.485 108.990 85.863 1.00 0.00 H ATOM 88583 H2 WAT 9726 17.634 108.083 85.001 1.00 0.00 H TER 88585 WAT 9726 ATOM 88585 O WAT 9727 28.729 138.560 102.767 1.00 0.00 O ATOM 88586 H1 WAT 9727 28.610 137.717 103.205 1.00 0.00 H ATOM 88587 H2 WAT 9727 29.218 139.090 103.396 1.00 0.00 H TER 88589 WAT 9727 ATOM 88589 O WAT 9728 128.057 80.083 156.323 1.00 0.00 O ATOM 88590 H1 WAT 9728 127.668 79.726 157.122 1.00 0.00 H ATOM 88591 H2 WAT 9728 128.997 79.931 156.426 1.00 0.00 H TER 88593 WAT 9728 ATOM 88593 O WAT 9729 112.031 20.531 110.477 1.00 0.00 O ATOM 88594 H1 WAT 9729 111.135 20.821 110.302 1.00 0.00 H ATOM 88595 H2 WAT 9729 111.927 19.715 110.967 1.00 0.00 H TER 88597 WAT 9729 ATOM 88597 O WAT 9730 54.091 106.320 2.166 1.00 0.00 O ATOM 88598 H1 WAT 9730 54.039 105.415 1.858 1.00 0.00 H ATOM 88599 H2 WAT 9730 54.744 106.298 2.866 1.00 0.00 H TER 88601 WAT 9730 ATOM 88601 O WAT 9731 142.456 99.869 135.439 1.00 0.00 O ATOM 88602 H1 WAT 9731 142.419 99.761 136.389 1.00 0.00 H ATOM 88603 H2 WAT 9731 142.592 100.807 135.309 1.00 0.00 H TER 88605 WAT 9731 ATOM 88605 O WAT 9732 97.792 65.826 138.459 1.00 0.00 O ATOM 88606 H1 WAT 9732 98.689 65.600 138.705 1.00 0.00 H ATOM 88607 H2 WAT 9732 97.601 65.264 137.707 1.00 0.00 H TER 88609 WAT 9732 ATOM 88609 O WAT 9733 55.703 20.451 96.476 1.00 0.00 O ATOM 88610 H1 WAT 9733 55.905 20.844 95.627 1.00 0.00 H ATOM 88611 H2 WAT 9733 55.106 19.731 96.270 1.00 0.00 H TER 88613 WAT 9733 ATOM 88613 O WAT 9734 7.134 17.928 126.600 1.00 0.00 O ATOM 88614 H1 WAT 9734 6.949 17.751 125.677 1.00 0.00 H ATOM 88615 H2 WAT 9734 7.002 18.871 126.693 1.00 0.00 H TER 88617 WAT 9734 ATOM 88617 O WAT 9735 51.389 90.232 114.740 1.00 0.00 O ATOM 88618 H1 WAT 9735 51.678 90.966 114.198 1.00 0.00 H ATOM 88619 H2 WAT 9735 50.454 90.151 114.553 1.00 0.00 H TER 88621 WAT 9735 ATOM 88621 O WAT 9736 109.552 43.603 83.183 1.00 0.00 O ATOM 88622 H1 WAT 9736 108.990 43.033 82.658 1.00 0.00 H ATOM 88623 H2 WAT 9736 110.377 43.123 83.258 1.00 0.00 H TER 88625 WAT 9736 ATOM 88625 O WAT 9737 5.106 88.624 70.143 1.00 0.00 O ATOM 88626 H1 WAT 9737 5.959 88.548 69.716 1.00 0.00 H ATOM 88627 H2 WAT 9737 4.674 89.347 69.688 1.00 0.00 H TER 88629 WAT 9737 ATOM 88629 O WAT 9738 119.934 96.941 115.264 1.00 0.00 O ATOM 88630 H1 WAT 9738 119.896 97.000 114.309 1.00 0.00 H ATOM 88631 H2 WAT 9738 120.829 96.661 115.451 1.00 0.00 H TER 88633 WAT 9738 ATOM 88633 O WAT 9739 29.865 126.133 59.415 1.00 0.00 O ATOM 88634 H1 WAT 9739 29.681 125.895 58.506 1.00 0.00 H ATOM 88635 H2 WAT 9739 29.868 125.300 59.885 1.00 0.00 H TER 88637 WAT 9739 ATOM 88637 O WAT 9740 15.840 80.099 60.831 1.00 0.00 O ATOM 88638 H1 WAT 9740 15.905 80.943 61.277 1.00 0.00 H ATOM 88639 H2 WAT 9740 15.555 79.489 61.512 1.00 0.00 H TER 88641 WAT 9740 ATOM 88641 O WAT 9741 101.842 48.020 72.026 1.00 0.00 O ATOM 88642 H1 WAT 9741 102.326 48.372 71.279 1.00 0.00 H ATOM 88643 H2 WAT 9741 102.378 47.290 72.337 1.00 0.00 H TER 88645 WAT 9741 ATOM 88645 O WAT 9742 3.109 109.889 126.322 1.00 0.00 O ATOM 88646 H1 WAT 9742 2.224 110.207 126.501 1.00 0.00 H ATOM 88647 H2 WAT 9742 3.324 109.339 127.075 1.00 0.00 H TER 88649 WAT 9742 ATOM 88649 O WAT 9743 114.499 103.258 10.301 1.00 0.00 O ATOM 88650 H1 WAT 9743 114.621 103.229 9.352 1.00 0.00 H ATOM 88651 H2 WAT 9743 114.194 102.380 10.530 1.00 0.00 H TER 88653 WAT 9743 ATOM 88653 O WAT 9744 60.945 66.476 110.694 1.00 0.00 O ATOM 88654 H1 WAT 9744 61.508 67.225 110.499 1.00 0.00 H ATOM 88655 H2 WAT 9744 60.262 66.831 111.263 1.00 0.00 H TER 88657 WAT 9744 ATOM 88657 O WAT 9745 111.408 99.411 109.152 1.00 0.00 O ATOM 88658 H1 WAT 9745 110.660 99.878 108.779 1.00 0.00 H ATOM 88659 H2 WAT 9745 111.042 98.923 109.890 1.00 0.00 H TER 88661 WAT 9745 ATOM 88661 O WAT 9746 88.590 100.988 68.270 1.00 0.00 O ATOM 88662 H1 WAT 9746 87.795 101.518 68.211 1.00 0.00 H ATOM 88663 H2 WAT 9746 89.290 101.573 67.980 1.00 0.00 H TER 88665 WAT 9746 ATOM 88665 O WAT 9747 83.714 20.058 15.112 1.00 0.00 O ATOM 88666 H1 WAT 9747 83.510 20.859 14.629 1.00 0.00 H ATOM 88667 H2 WAT 9747 82.942 19.504 14.995 1.00 0.00 H TER 88669 WAT 9747 ATOM 88669 O WAT 9748 19.822 144.268 82.884 1.00 0.00 O ATOM 88670 H1 WAT 9748 20.097 143.516 82.358 1.00 0.00 H ATOM 88671 H2 WAT 9748 20.092 145.030 82.371 1.00 0.00 H TER 88673 WAT 9748 ATOM 88673 O WAT 9749 64.237 130.740 12.842 1.00 0.00 O ATOM 88674 H1 WAT 9749 63.410 130.601 12.381 1.00 0.00 H ATOM 88675 H2 WAT 9749 64.411 129.907 13.280 1.00 0.00 H TER 88677 WAT 9749 ATOM 88677 O WAT 9750 141.443 105.127 22.157 1.00 0.00 O ATOM 88678 H1 WAT 9750 140.622 104.643 22.075 1.00 0.00 H ATOM 88679 H2 WAT 9750 141.791 104.866 23.010 1.00 0.00 H TER 88681 WAT 9750 ATOM 88681 O WAT 9751 112.801 116.437 20.666 1.00 0.00 O ATOM 88682 H1 WAT 9751 112.784 117.393 20.613 1.00 0.00 H ATOM 88683 H2 WAT 9751 112.109 116.219 21.290 1.00 0.00 H TER 88685 WAT 9751 ATOM 88685 O WAT 9752 102.916 5.330 140.727 1.00 0.00 O ATOM 88686 H1 WAT 9752 103.850 5.121 140.694 1.00 0.00 H ATOM 88687 H2 WAT 9752 102.813 5.840 141.531 1.00 0.00 H TER 88689 WAT 9752 ATOM 88689 O WAT 9753 125.070 142.379 151.004 1.00 0.00 O ATOM 88690 H1 WAT 9753 124.784 141.857 150.255 1.00 0.00 H ATOM 88691 H2 WAT 9753 125.076 143.280 150.681 1.00 0.00 H TER 88693 WAT 9753 ATOM 88693 O WAT 9754 135.243 49.755 89.286 1.00 0.00 O ATOM 88694 H1 WAT 9754 134.990 49.146 89.979 1.00 0.00 H ATOM 88695 H2 WAT 9754 136.159 49.547 89.106 1.00 0.00 H TER 88697 WAT 9754 ATOM 88697 O WAT 9755 44.711 97.024 90.951 1.00 0.00 O ATOM 88698 H1 WAT 9755 44.723 97.942 91.222 1.00 0.00 H ATOM 88699 H2 WAT 9755 45.629 96.812 90.782 1.00 0.00 H TER 88701 WAT 9755 ATOM 88701 O WAT 9756 19.764 73.820 119.417 1.00 0.00 O ATOM 88702 H1 WAT 9756 20.471 74.466 119.412 1.00 0.00 H ATOM 88703 H2 WAT 9756 19.922 73.285 118.640 1.00 0.00 H TER 88705 WAT 9756 ATOM 88705 O WAT 9757 63.182 18.074 110.102 1.00 0.00 O ATOM 88706 H1 WAT 9757 63.349 18.902 110.551 1.00 0.00 H ATOM 88707 H2 WAT 9757 63.839 18.042 109.406 1.00 0.00 H TER 88709 WAT 9757 ATOM 88709 O WAT 9758 29.620 35.962 4.267 1.00 0.00 O ATOM 88710 H1 WAT 9758 28.976 36.583 3.927 1.00 0.00 H ATOM 88711 H2 WAT 9758 29.110 35.361 4.810 1.00 0.00 H TER 88713 WAT 9758 ATOM 88713 O WAT 9759 71.241 36.857 140.953 1.00 0.00 O ATOM 88714 H1 WAT 9759 71.513 36.213 140.299 1.00 0.00 H ATOM 88715 H2 WAT 9759 70.393 36.540 141.264 1.00 0.00 H TER 88717 WAT 9759 ATOM 88717 O WAT 9760 43.061 98.618 9.561 1.00 0.00 O ATOM 88718 H1 WAT 9760 42.460 97.874 9.520 1.00 0.00 H ATOM 88719 H2 WAT 9760 42.519 99.375 9.336 1.00 0.00 H TER 88721 WAT 9760 ATOM 88721 O WAT 9761 129.472 82.613 84.395 1.00 0.00 O ATOM 88722 H1 WAT 9761 129.398 83.338 85.016 1.00 0.00 H ATOM 88723 H2 WAT 9761 130.394 82.358 84.434 1.00 0.00 H TER 88725 WAT 9761 ATOM 88725 O WAT 9762 2.579 62.703 127.120 1.00 0.00 O ATOM 88726 H1 WAT 9762 1.883 63.262 126.774 1.00 0.00 H ATOM 88727 H2 WAT 9762 2.117 62.002 127.580 1.00 0.00 H TER 88729 WAT 9762 ATOM 88729 O WAT 9763 47.497 103.163 4.803 1.00 0.00 O ATOM 88730 H1 WAT 9763 47.210 102.904 3.927 1.00 0.00 H ATOM 88731 H2 WAT 9763 47.450 102.358 5.318 1.00 0.00 H TER 88733 WAT 9763 ATOM 88733 O WAT 9764 82.086 37.107 134.367 1.00 0.00 O ATOM 88734 H1 WAT 9764 81.806 37.826 134.934 1.00 0.00 H ATOM 88735 H2 WAT 9764 81.358 36.485 134.392 1.00 0.00 H TER 88737 WAT 9764 ATOM 88737 O WAT 9765 22.976 139.670 121.890 1.00 0.00 O ATOM 88738 H1 WAT 9765 22.650 138.791 121.700 1.00 0.00 H ATOM 88739 H2 WAT 9765 23.911 139.627 121.687 1.00 0.00 H TER 88741 WAT 9765 ATOM 88741 O WAT 9766 30.503 26.417 18.784 1.00 0.00 O ATOM 88742 H1 WAT 9766 30.475 27.368 18.885 1.00 0.00 H ATOM 88743 H2 WAT 9766 31.270 26.256 18.234 1.00 0.00 H TER 88745 WAT 9766 ATOM 88745 O WAT 9767 5.560 60.197 128.928 1.00 0.00 O ATOM 88746 H1 WAT 9767 6.272 59.873 128.376 1.00 0.00 H ATOM 88747 H2 WAT 9767 5.611 61.150 128.850 1.00 0.00 H TER 88749 WAT 9767 ATOM 88749 O WAT 9768 42.487 134.337 6.705 1.00 0.00 O ATOM 88750 H1 WAT 9768 42.207 133.587 6.179 1.00 0.00 H ATOM 88751 H2 WAT 9768 41.917 134.315 7.474 1.00 0.00 H TER 88753 WAT 9768 ATOM 88753 O WAT 9769 98.146 46.066 142.695 1.00 0.00 O ATOM 88754 H1 WAT 9769 97.621 46.835 142.917 1.00 0.00 H ATOM 88755 H2 WAT 9769 98.276 46.130 141.749 1.00 0.00 H TER 88757 WAT 9769 ATOM 88757 O WAT 9770 57.411 106.182 94.344 1.00 0.00 O ATOM 88758 H1 WAT 9770 58.185 106.282 94.898 1.00 0.00 H ATOM 88759 H2 WAT 9770 56.715 106.632 94.822 1.00 0.00 H TER 88761 WAT 9770 ATOM 88761 O WAT 9771 9.979 134.856 158.092 1.00 0.00 O ATOM 88762 H1 WAT 9771 9.882 135.694 157.640 1.00 0.00 H ATOM 88763 H2 WAT 9771 9.568 134.995 158.946 1.00 0.00 H TER 88765 WAT 9771 ATOM 88765 O WAT 9772 66.041 31.784 13.936 1.00 0.00 O ATOM 88766 H1 WAT 9772 65.958 32.387 14.674 1.00 0.00 H ATOM 88767 H2 WAT 9772 66.942 31.464 13.988 1.00 0.00 H TER 88769 WAT 9772 ATOM 88769 O WAT 9773 75.228 122.423 157.382 1.00 0.00 O ATOM 88770 H1 WAT 9773 75.385 122.930 158.179 1.00 0.00 H ATOM 88771 H2 WAT 9773 75.848 121.696 157.434 1.00 0.00 H TER 88773 WAT 9773 ATOM 88773 O WAT 9774 28.669 39.431 93.452 1.00 0.00 O ATOM 88774 H1 WAT 9774 29.285 38.775 93.778 1.00 0.00 H ATOM 88775 H2 WAT 9774 27.906 39.348 94.023 1.00 0.00 H TER 88777 WAT 9774 ATOM 88777 O WAT 9775 139.256 129.304 137.199 1.00 0.00 O ATOM 88778 H1 WAT 9775 139.429 128.413 137.504 1.00 0.00 H ATOM 88779 H2 WAT 9775 138.306 129.400 137.266 1.00 0.00 H TER 88781 WAT 9775 ATOM 88781 O WAT 9776 7.889 103.603 80.737 1.00 0.00 O ATOM 88782 H1 WAT 9776 8.422 103.184 81.412 1.00 0.00 H ATOM 88783 H2 WAT 9776 7.249 104.122 81.224 1.00 0.00 H TER 88785 WAT 9776 ATOM 88785 O WAT 9777 139.004 98.178 129.988 1.00 0.00 O ATOM 88786 H1 WAT 9777 139.247 98.602 129.165 1.00 0.00 H ATOM 88787 H2 WAT 9777 139.303 98.783 130.667 1.00 0.00 H TER 88789 WAT 9777 ATOM 88789 O WAT 9778 90.072 8.403 130.411 1.00 0.00 O ATOM 88790 H1 WAT 9778 89.427 8.460 129.706 1.00 0.00 H ATOM 88791 H2 WAT 9778 90.072 7.480 130.662 1.00 0.00 H TER 88793 WAT 9778 ATOM 88793 O WAT 9779 75.506 65.396 129.073 1.00 0.00 O ATOM 88794 H1 WAT 9779 74.870 64.800 129.469 1.00 0.00 H ATOM 88795 H2 WAT 9779 75.148 65.589 128.207 1.00 0.00 H TER 88797 WAT 9779 ATOM 88797 O WAT 9780 112.331 95.666 134.549 1.00 0.00 O ATOM 88798 H1 WAT 9780 112.907 96.317 134.148 1.00 0.00 H ATOM 88799 H2 WAT 9780 111.867 96.147 135.234 1.00 0.00 H TER 88801 WAT 9780 ATOM 88801 O WAT 9781 141.502 119.668 147.115 1.00 0.00 O ATOM 88802 H1 WAT 9781 140.696 119.281 147.455 1.00 0.00 H ATOM 88803 H2 WAT 9781 141.626 119.254 146.261 1.00 0.00 H TER 88805 WAT 9781 ATOM 88805 O WAT 9782 48.082 56.683 84.282 1.00 0.00 O ATOM 88806 H1 WAT 9782 47.302 56.835 84.815 1.00 0.00 H ATOM 88807 H2 WAT 9782 47.797 56.856 83.385 1.00 0.00 H TER 88809 WAT 9782 ATOM 88809 O WAT 9783 77.036 50.979 106.128 1.00 0.00 O ATOM 88810 H1 WAT 9783 76.454 50.807 105.387 1.00 0.00 H ATOM 88811 H2 WAT 9783 76.845 50.278 106.751 1.00 0.00 H TER 88813 WAT 9783 ATOM 88813 O WAT 9784 134.301 70.196 93.308 1.00 0.00 O ATOM 88814 H1 WAT 9784 134.707 70.047 94.163 1.00 0.00 H ATOM 88815 H2 WAT 9784 133.378 70.354 93.506 1.00 0.00 H TER 88817 WAT 9784 ATOM 88817 O WAT 9785 140.954 5.309 111.802 1.00 0.00 O ATOM 88818 H1 WAT 9785 140.546 5.240 112.665 1.00 0.00 H ATOM 88819 H2 WAT 9785 141.140 4.405 111.551 1.00 0.00 H TER 88821 WAT 9785 ATOM 88821 O WAT 9786 145.527 31.770 133.799 1.00 0.00 O ATOM 88822 H1 WAT 9786 145.654 32.391 134.516 1.00 0.00 H ATOM 88823 H2 WAT 9786 144.803 31.215 134.089 1.00 0.00 H TER 88825 WAT 9786 ATOM 88825 O WAT 9787 87.578 24.671 95.032 1.00 0.00 O ATOM 88826 H1 WAT 9787 87.040 23.952 94.700 1.00 0.00 H ATOM 88827 H2 WAT 9787 86.988 25.424 95.049 1.00 0.00 H TER 88829 WAT 9787 ATOM 88829 O WAT 9788 37.222 71.512 112.065 1.00 0.00 O ATOM 88830 H1 WAT 9788 36.987 70.749 112.593 1.00 0.00 H ATOM 88831 H2 WAT 9788 37.651 71.146 111.292 1.00 0.00 H TER 88833 WAT 9788 ATOM 88833 O WAT 9789 110.223 136.704 69.143 1.00 0.00 O ATOM 88834 H1 WAT 9789 109.360 136.918 68.789 1.00 0.00 H ATOM 88835 H2 WAT 9789 110.287 137.220 69.946 1.00 0.00 H TER 88837 WAT 9789 ATOM 88837 O WAT 9790 83.495 98.842 16.185 1.00 0.00 O ATOM 88838 H1 WAT 9790 82.795 98.385 16.651 1.00 0.00 H ATOM 88839 H2 WAT 9790 84.136 99.053 16.863 1.00 0.00 H TER 88841 WAT 9790 ATOM 88841 O WAT 9791 30.451 96.868 130.055 1.00 0.00 O ATOM 88842 H1 WAT 9791 31.243 97.358 129.835 1.00 0.00 H ATOM 88843 H2 WAT 9791 30.245 97.134 130.951 1.00 0.00 H TER 88845 WAT 9791 ATOM 88845 O WAT 9792 31.860 134.528 118.147 1.00 0.00 O ATOM 88846 H1 WAT 9792 32.474 135.194 117.836 1.00 0.00 H ATOM 88847 H2 WAT 9792 30.997 134.926 118.036 1.00 0.00 H TER 88849 WAT 9792 ATOM 88849 O WAT 9793 118.832 103.477 127.244 1.00 0.00 O ATOM 88850 H1 WAT 9793 118.579 102.813 126.602 1.00 0.00 H ATOM 88851 H2 WAT 9793 119.738 103.690 127.023 1.00 0.00 H TER 88853 WAT 9793 ATOM 88853 O WAT 9794 26.992 35.322 113.761 1.00 0.00 O ATOM 88854 H1 WAT 9794 27.348 35.665 112.941 1.00 0.00 H ATOM 88855 H2 WAT 9794 26.051 35.485 113.701 1.00 0.00 H TER 88857 WAT 9794 ATOM 88857 O WAT 9795 105.439 14.131 102.648 1.00 0.00 O ATOM 88858 H1 WAT 9795 105.300 14.404 103.555 1.00 0.00 H ATOM 88859 H2 WAT 9795 105.139 14.875 102.125 1.00 0.00 H TER 88861 WAT 9795 ATOM 88861 O WAT 9796 78.529 6.256 13.536 1.00 0.00 O ATOM 88862 H1 WAT 9796 79.133 5.566 13.810 1.00 0.00 H ATOM 88863 H2 WAT 9796 77.664 5.847 13.575 1.00 0.00 H TER 88865 WAT 9796 ATOM 88865 O WAT 9797 125.310 30.377 153.179 1.00 0.00 O ATOM 88866 H1 WAT 9797 126.004 29.768 152.928 1.00 0.00 H ATOM 88867 H2 WAT 9797 125.422 31.123 152.589 1.00 0.00 H TER 88869 WAT 9797 ATOM 88869 O WAT 9798 95.387 41.548 112.559 1.00 0.00 O ATOM 88870 H1 WAT 9798 94.523 41.961 112.548 1.00 0.00 H ATOM 88871 H2 WAT 9798 95.708 41.689 113.449 1.00 0.00 H TER 88873 WAT 9798 ATOM 88873 O WAT 9799 18.820 89.515 105.233 1.00 0.00 O ATOM 88874 H1 WAT 9799 18.561 89.713 104.333 1.00 0.00 H ATOM 88875 H2 WAT 9799 18.476 90.246 105.748 1.00 0.00 H TER 88877 WAT 9799 ATOM 88877 O WAT 9800 69.233 2.307 117.660 1.00 0.00 O ATOM 88878 H1 WAT 9800 70.123 1.967 117.759 1.00 0.00 H ATOM 88879 H2 WAT 9800 69.152 2.499 116.726 1.00 0.00 H TER 88881 WAT 9800 ATOM 88881 O WAT 9801 98.868 108.341 133.854 1.00 0.00 O ATOM 88882 H1 WAT 9801 99.637 107.906 133.484 1.00 0.00 H ATOM 88883 H2 WAT 9801 98.169 108.169 133.224 1.00 0.00 H TER 88885 WAT 9801 ATOM 88885 O WAT 9802 76.442 28.678 54.460 1.00 0.00 O ATOM 88886 H1 WAT 9802 75.856 29.394 54.217 1.00 0.00 H ATOM 88887 H2 WAT 9802 76.747 28.905 55.339 1.00 0.00 H TER 88889 WAT 9802 ATOM 88889 O WAT 9803 45.330 24.086 89.958 1.00 0.00 O ATOM 88890 H1 WAT 9803 45.588 24.164 90.877 1.00 0.00 H ATOM 88891 H2 WAT 9803 45.438 24.969 89.604 1.00 0.00 H TER 88893 WAT 9803 ATOM 88893 O WAT 9804 52.645 80.450 19.884 1.00 0.00 O ATOM 88894 H1 WAT 9804 52.166 79.630 20.006 1.00 0.00 H ATOM 88895 H2 WAT 9804 53.001 80.390 18.998 1.00 0.00 H TER 88897 WAT 9804 ATOM 88897 O WAT 9805 9.749 1.904 67.119 1.00 0.00 O ATOM 88898 H1 WAT 9805 9.952 0.981 67.275 1.00 0.00 H ATOM 88899 H2 WAT 9805 8.802 1.921 66.983 1.00 0.00 H TER 88901 WAT 9805 ATOM 88901 O WAT 9806 142.725 3.721 69.417 1.00 0.00 O ATOM 88902 H1 WAT 9806 143.245 4.400 69.847 1.00 0.00 H ATOM 88903 H2 WAT 9806 142.889 2.932 69.932 1.00 0.00 H TER 88905 WAT 9806 ATOM 88905 O WAT 9807 111.344 134.885 153.058 1.00 0.00 O ATOM 88906 H1 WAT 9807 111.269 134.533 152.171 1.00 0.00 H ATOM 88907 H2 WAT 9807 111.919 134.270 153.512 1.00 0.00 H TER 88909 WAT 9807 ATOM 88909 O WAT 9808 136.630 73.218 82.519 1.00 0.00 O ATOM 88910 H1 WAT 9808 137.120 72.543 82.987 1.00 0.00 H ATOM 88911 H2 WAT 9808 135.867 73.387 83.072 1.00 0.00 H TER 88913 WAT 9808 ATOM 88913 O WAT 9809 39.329 63.911 105.001 1.00 0.00 O ATOM 88914 H1 WAT 9809 39.460 63.445 105.827 1.00 0.00 H ATOM 88915 H2 WAT 9809 39.390 63.231 104.331 1.00 0.00 H TER 88917 WAT 9809 ATOM 88917 O WAT 9810 135.038 37.381 55.511 1.00 0.00 O ATOM 88918 H1 WAT 9810 134.905 36.492 55.183 1.00 0.00 H ATOM 88919 H2 WAT 9810 134.587 37.940 54.877 1.00 0.00 H TER 88921 WAT 9810 ATOM 88921 O WAT 9811 98.739 0.835 58.074 1.00 0.00 O ATOM 88922 H1 WAT 9811 99.598 1.254 58.024 1.00 0.00 H ATOM 88923 H2 WAT 9811 98.919 -0.040 58.417 1.00 0.00 H TER 88925 WAT 9811 ATOM 88925 O WAT 9812 44.619 126.846 72.961 1.00 0.00 O ATOM 88926 H1 WAT 9812 44.093 126.137 73.331 1.00 0.00 H ATOM 88927 H2 WAT 9812 44.376 126.867 72.035 1.00 0.00 H TER 88929 WAT 9812 ATOM 88929 O WAT 9813 111.509 141.730 132.403 1.00 0.00 O ATOM 88930 H1 WAT 9813 111.407 140.986 132.996 1.00 0.00 H ATOM 88931 H2 WAT 9813 110.688 142.216 132.487 1.00 0.00 H TER 88933 WAT 9813 ATOM 88933 O WAT 9814 69.270 136.215 101.513 1.00 0.00 O ATOM 88934 H1 WAT 9814 69.136 136.183 100.566 1.00 0.00 H ATOM 88935 H2 WAT 9814 70.177 135.934 101.636 1.00 0.00 H TER 88937 WAT 9814 ATOM 88937 O WAT 9815 115.550 18.747 76.101 1.00 0.00 O ATOM 88938 H1 WAT 9815 115.351 19.665 75.914 1.00 0.00 H ATOM 88939 H2 WAT 9815 116.506 18.701 76.082 1.00 0.00 H TER 88941 WAT 9815 ATOM 88941 O WAT 9816 91.083 33.390 142.254 1.00 0.00 O ATOM 88942 H1 WAT 9816 91.189 33.822 143.101 1.00 0.00 H ATOM 88943 H2 WAT 9816 90.624 32.575 142.457 1.00 0.00 H TER 88945 WAT 9816 ATOM 88945 O WAT 9817 69.770 46.775 104.291 1.00 0.00 O ATOM 88946 H1 WAT 9817 70.675 46.817 104.601 1.00 0.00 H ATOM 88947 H2 WAT 9817 69.334 46.185 104.905 1.00 0.00 H TER 88949 WAT 9817 ATOM 88949 O WAT 9818 39.052 100.805 94.712 1.00 0.00 O ATOM 88950 H1 WAT 9818 38.665 100.071 95.188 1.00 0.00 H ATOM 88951 H2 WAT 9818 39.978 100.786 94.953 1.00 0.00 H TER 88953 WAT 9818 ATOM 88953 O WAT 9819 3.085 110.739 120.255 1.00 0.00 O ATOM 88954 H1 WAT 9819 3.067 110.558 121.195 1.00 0.00 H ATOM 88955 H2 WAT 9819 3.277 109.893 119.851 1.00 0.00 H TER 88957 WAT 9819 ATOM 88957 O WAT 9820 143.355 80.547 105.772 1.00 0.00 O ATOM 88958 H1 WAT 9820 143.890 80.466 106.562 1.00 0.00 H ATOM 88959 H2 WAT 9820 142.962 81.417 105.838 1.00 0.00 H TER 88961 WAT 9820 ATOM 88961 O WAT 9821 106.636 87.767 119.510 1.00 0.00 O ATOM 88962 H1 WAT 9821 106.012 87.875 120.227 1.00 0.00 H ATOM 88963 H2 WAT 9821 106.951 88.653 119.330 1.00 0.00 H TER 88965 WAT 9821 ATOM 88965 O WAT 9822 123.412 116.338 83.399 1.00 0.00 O ATOM 88966 H1 WAT 9822 122.532 116.668 83.578 1.00 0.00 H ATOM 88967 H2 WAT 9822 123.933 116.625 84.149 1.00 0.00 H TER 88969 WAT 9822 ATOM 88969 O WAT 9823 7.412 46.074 157.075 1.00 0.00 O ATOM 88970 H1 WAT 9823 6.839 46.389 157.773 1.00 0.00 H ATOM 88971 H2 WAT 9823 8.163 45.697 157.534 1.00 0.00 H TER 88973 WAT 9823 ATOM 88973 O WAT 9824 61.633 141.212 137.621 1.00 0.00 O ATOM 88974 H1 WAT 9824 61.027 141.363 138.347 1.00 0.00 H ATOM 88975 H2 WAT 9824 62.263 140.579 137.964 1.00 0.00 H TER 88977 WAT 9824 ATOM 88977 O WAT 9825 107.644 57.737 64.892 1.00 0.00 O ATOM 88978 H1 WAT 9825 107.740 56.886 65.320 1.00 0.00 H ATOM 88979 H2 WAT 9825 107.743 57.549 63.959 1.00 0.00 H TER 88981 WAT 9825 ATOM 88981 O WAT 9826 69.874 141.296 64.161 1.00 0.00 O ATOM 88982 H1 WAT 9826 70.745 141.444 63.794 1.00 0.00 H ATOM 88983 H2 WAT 9826 69.317 141.136 63.399 1.00 0.00 H TER 88985 WAT 9826 ATOM 88985 O WAT 9827 47.100 50.808 98.074 1.00 0.00 O ATOM 88986 H1 WAT 9827 46.288 51.314 98.047 1.00 0.00 H ATOM 88987 H2 WAT 9827 47.709 51.302 97.525 1.00 0.00 H TER 88989 WAT 9827 ATOM 88989 O WAT 9828 141.364 138.077 116.087 1.00 0.00 O ATOM 88990 H1 WAT 9828 140.594 137.562 115.847 1.00 0.00 H ATOM 88991 H2 WAT 9828 141.897 138.094 115.292 1.00 0.00 H TER 88993 WAT 9828 ATOM 88993 O WAT 9829 118.787 37.326 11.715 1.00 0.00 O ATOM 88994 H1 WAT 9829 118.556 38.254 11.683 1.00 0.00 H ATOM 88995 H2 WAT 9829 118.663 37.080 12.632 1.00 0.00 H TER 88997 WAT 9829 ATOM 88997 O WAT 9830 82.066 2.906 78.402 1.00 0.00 O ATOM 88998 H1 WAT 9830 81.723 2.018 78.507 1.00 0.00 H ATOM 88999 H2 WAT 9830 82.618 3.043 79.172 1.00 0.00 H TER 89001 WAT 9830 ATOM 89001 O WAT 9831 69.488 38.092 88.163 1.00 0.00 O ATOM 89002 H1 WAT 9831 69.344 38.234 87.228 1.00 0.00 H ATOM 89003 H2 WAT 9831 70.416 37.866 88.231 1.00 0.00 H TER 89005 WAT 9831 ATOM 89005 O WAT 9832 131.883 31.129 105.487 1.00 0.00 O ATOM 89006 H1 WAT 9832 132.336 30.287 105.442 1.00 0.00 H ATOM 89007 H2 WAT 9832 130.954 30.899 105.527 1.00 0.00 H TER 89009 WAT 9832 ATOM 89009 O WAT 9833 74.296 54.600 121.951 1.00 0.00 O ATOM 89010 H1 WAT 9833 73.354 54.768 121.947 1.00 0.00 H ATOM 89011 H2 WAT 9833 74.675 55.374 122.368 1.00 0.00 H TER 89013 WAT 9833 ATOM 89013 O WAT 9834 77.588 23.494 110.654 1.00 0.00 O ATOM 89014 H1 WAT 9834 77.031 23.010 110.044 1.00 0.00 H ATOM 89015 H2 WAT 9834 77.585 24.391 110.320 1.00 0.00 H TER 89017 WAT 9834 ATOM 89017 O WAT 9835 111.395 119.578 151.697 1.00 0.00 O ATOM 89018 H1 WAT 9835 111.223 119.671 150.760 1.00 0.00 H ATOM 89019 H2 WAT 9835 110.602 119.172 152.047 1.00 0.00 H TER 89021 WAT 9835 ATOM 89021 O WAT 9836 34.953 46.177 55.686 1.00 0.00 O ATOM 89022 H1 WAT 9836 34.923 47.110 55.474 1.00 0.00 H ATOM 89023 H2 WAT 9836 35.215 46.149 56.606 1.00 0.00 H TER 89025 WAT 9836 ATOM 89025 O WAT 9837 118.023 85.134 85.709 1.00 0.00 O ATOM 89026 H1 WAT 9837 118.510 84.721 84.996 1.00 0.00 H ATOM 89027 H2 WAT 9837 117.135 85.234 85.365 1.00 0.00 H TER 89029 WAT 9837 ATOM 89029 O WAT 9838 17.381 82.625 93.140 1.00 0.00 O ATOM 89030 H1 WAT 9838 17.681 81.730 93.295 1.00 0.00 H ATOM 89031 H2 WAT 9838 16.487 82.525 92.814 1.00 0.00 H TER 89033 WAT 9838 ATOM 89033 O WAT 9839 18.419 95.164 5.898 1.00 0.00 O ATOM 89034 H1 WAT 9839 19.325 94.861 5.846 1.00 0.00 H ATOM 89035 H2 WAT 9839 18.423 96.013 5.457 1.00 0.00 H TER 89037 WAT 9839 ATOM 89037 O WAT 9840 15.369 12.560 89.974 1.00 0.00 O ATOM 89038 H1 WAT 9840 16.175 12.696 89.475 1.00 0.00 H ATOM 89039 H2 WAT 9840 14.984 13.433 90.049 1.00 0.00 H TER 89041 WAT 9840 ATOM 89041 O WAT 9841 138.930 43.193 119.207 1.00 0.00 O ATOM 89042 H1 WAT 9841 139.817 43.423 119.485 1.00 0.00 H ATOM 89043 H2 WAT 9841 138.966 42.250 119.048 1.00 0.00 H TER 89045 WAT 9841 ATOM 89045 O WAT 9842 76.680 81.341 95.230 1.00 0.00 O ATOM 89046 H1 WAT 9842 76.746 80.446 94.898 1.00 0.00 H ATOM 89047 H2 WAT 9842 76.396 81.240 96.138 1.00 0.00 H TER 89049 WAT 9842 ATOM 89049 O WAT 9843 116.124 4.309 68.243 1.00 0.00 O ATOM 89050 H1 WAT 9843 116.145 4.091 69.175 1.00 0.00 H ATOM 89051 H2 WAT 9843 116.747 3.703 67.842 1.00 0.00 H TER 89053 WAT 9843 ATOM 89053 O WAT 9844 17.055 76.421 122.911 1.00 0.00 O ATOM 89054 H1 WAT 9844 16.800 75.606 123.343 1.00 0.00 H ATOM 89055 H2 WAT 9844 17.784 76.173 122.343 1.00 0.00 H TER 89057 WAT 9844 ATOM 89057 O WAT 9845 23.045 51.078 62.810 1.00 0.00 O ATOM 89058 H1 WAT 9845 23.945 51.388 62.708 1.00 0.00 H ATOM 89059 H2 WAT 9845 22.974 50.846 63.735 1.00 0.00 H TER 89061 WAT 9845 ATOM 89061 O WAT 9846 26.387 120.281 131.312 1.00 0.00 O ATOM 89062 H1 WAT 9846 25.974 119.649 130.724 1.00 0.00 H ATOM 89063 H2 WAT 9846 26.114 121.135 130.976 1.00 0.00 H TER 89065 WAT 9846 ATOM 89065 O WAT 9847 135.907 107.132 14.430 1.00 0.00 O ATOM 89066 H1 WAT 9847 136.223 107.257 13.535 1.00 0.00 H ATOM 89067 H2 WAT 9847 136.466 106.443 14.788 1.00 0.00 H TER 89069 WAT 9847 ATOM 89069 O WAT 9848 87.907 92.324 12.954 1.00 0.00 O ATOM 89070 H1 WAT 9848 87.807 93.234 12.673 1.00 0.00 H ATOM 89071 H2 WAT 9848 87.284 91.837 12.414 1.00 0.00 H TER 89073 WAT 9848 ATOM 89073 O WAT 9849 82.792 140.377 118.543 1.00 0.00 O ATOM 89074 H1 WAT 9849 82.241 140.128 117.801 1.00 0.00 H ATOM 89075 H2 WAT 9849 82.222 140.278 119.307 1.00 0.00 H TER 89077 WAT 9849 ATOM 89077 O WAT 9850 10.574 132.473 27.314 1.00 0.00 O ATOM 89078 H1 WAT 9850 11.360 131.954 27.484 1.00 0.00 H ATOM 89079 H2 WAT 9850 10.899 133.362 27.172 1.00 0.00 H TER 89081 WAT 9850 ATOM 89081 O WAT 9851 76.058 42.708 111.446 1.00 0.00 O ATOM 89082 H1 WAT 9851 75.115 42.573 111.356 1.00 0.00 H ATOM 89083 H2 WAT 9851 76.256 42.427 112.340 1.00 0.00 H TER 89085 WAT 9851 ATOM 89085 O WAT 9852 21.092 120.149 77.700 1.00 0.00 O ATOM 89086 H1 WAT 9852 21.304 120.735 76.974 1.00 0.00 H ATOM 89087 H2 WAT 9852 20.178 120.347 77.908 1.00 0.00 H TER 89089 WAT 9852 ATOM 89089 O WAT 9853 89.869 128.484 65.215 1.00 0.00 O ATOM 89090 H1 WAT 9853 90.580 128.009 64.786 1.00 0.00 H ATOM 89091 H2 WAT 9853 89.824 129.320 64.751 1.00 0.00 H TER 89093 WAT 9853 ATOM 89093 O WAT 9854 101.128 141.272 75.429 1.00 0.00 O ATOM 89094 H1 WAT 9854 101.850 140.649 75.510 1.00 0.00 H ATOM 89095 H2 WAT 9854 101.172 141.797 76.228 1.00 0.00 H TER 89097 WAT 9854 ATOM 89097 O WAT 9855 135.647 82.450 74.360 1.00 0.00 O ATOM 89098 H1 WAT 9855 134.787 82.055 74.500 1.00 0.00 H ATOM 89099 H2 WAT 9855 135.900 82.170 73.480 1.00 0.00 H TER 89101 WAT 9855 ATOM 89101 O WAT 9856 94.203 140.572 131.488 1.00 0.00 O ATOM 89102 H1 WAT 9856 94.758 139.801 131.370 1.00 0.00 H ATOM 89103 H2 WAT 9856 94.814 141.310 131.480 1.00 0.00 H TER 89105 WAT 9856 ATOM 89105 O WAT 9857 13.180 21.098 150.248 1.00 0.00 O ATOM 89106 H1 WAT 9857 12.688 20.296 150.425 1.00 0.00 H ATOM 89107 H2 WAT 9857 13.147 21.194 149.297 1.00 0.00 H TER 89109 WAT 9857 ATOM 89109 O WAT 9858 129.801 103.961 108.598 1.00 0.00 O ATOM 89110 H1 WAT 9858 128.951 103.904 108.163 1.00 0.00 H ATOM 89111 H2 WAT 9858 129.732 103.357 109.338 1.00 0.00 H TER 89113 WAT 9858 ATOM 89113 O WAT 9859 50.745 138.231 63.046 1.00 0.00 O ATOM 89114 H1 WAT 9859 50.226 139.026 63.170 1.00 0.00 H ATOM 89115 H2 WAT 9859 50.239 137.709 62.423 1.00 0.00 H TER 89117 WAT 9859 ATOM 89117 O WAT 9860 142.100 129.441 70.624 1.00 0.00 O ATOM 89118 H1 WAT 9860 141.550 130.220 70.539 1.00 0.00 H ATOM 89119 H2 WAT 9860 142.629 129.606 71.405 1.00 0.00 H TER 89121 WAT 9860 ATOM 89121 O WAT 9861 140.943 80.489 71.656 1.00 0.00 O ATOM 89122 H1 WAT 9861 140.888 81.444 71.650 1.00 0.00 H ATOM 89123 H2 WAT 9861 140.924 80.243 70.731 1.00 0.00 H TER 89125 WAT 9861 ATOM 89125 O WAT 9862 42.880 80.160 11.999 1.00 0.00 O ATOM 89126 H1 WAT 9862 42.344 80.950 11.921 1.00 0.00 H ATOM 89127 H2 WAT 9862 42.759 79.878 12.905 1.00 0.00 H TER 89129 WAT 9862 ATOM 89129 O WAT 9863 3.841 36.429 151.166 1.00 0.00 O ATOM 89130 H1 WAT 9863 4.175 35.577 150.888 1.00 0.00 H ATOM 89131 H2 WAT 9863 3.744 36.350 152.115 1.00 0.00 H TER 89133 WAT 9863 ATOM 89133 O WAT 9864 110.503 135.896 110.128 1.00 0.00 O ATOM 89134 H1 WAT 9864 109.872 135.710 110.824 1.00 0.00 H ATOM 89135 H2 WAT 9864 110.658 136.838 110.190 1.00 0.00 H TER 89137 WAT 9864 ATOM 89137 O WAT 9865 106.697 122.259 67.123 1.00 0.00 O ATOM 89138 H1 WAT 9865 106.887 122.838 67.861 1.00 0.00 H ATOM 89139 H2 WAT 9865 105.920 122.639 66.713 1.00 0.00 H TER 89141 WAT 9865 ATOM 89141 O WAT 9866 9.703 119.535 116.490 1.00 0.00 O ATOM 89142 H1 WAT 9866 9.175 119.890 117.205 1.00 0.00 H ATOM 89143 H2 WAT 9866 9.062 119.220 115.852 1.00 0.00 H TER 89145 WAT 9866 ATOM 89145 O WAT 9867 2.061 80.513 63.322 1.00 0.00 O ATOM 89146 H1 WAT 9867 2.920 80.306 63.689 1.00 0.00 H ATOM 89147 H2 WAT 9867 1.553 80.834 64.068 1.00 0.00 H TER 89149 WAT 9867 ATOM 89149 O WAT 9868 133.386 81.678 75.965 1.00 0.00 O ATOM 89150 H1 WAT 9868 133.242 80.745 76.124 1.00 0.00 H ATOM 89151 H2 WAT 9868 133.482 82.057 76.839 1.00 0.00 H TER 89153 WAT 9868 ATOM 89153 O WAT 9869 124.442 56.317 89.668 1.00 0.00 O ATOM 89154 H1 WAT 9869 124.090 55.704 89.022 1.00 0.00 H ATOM 89155 H2 WAT 9869 124.432 57.165 89.224 1.00 0.00 H TER 89157 WAT 9869 ATOM 89157 O WAT 9870 126.457 33.225 93.146 1.00 0.00 O ATOM 89158 H1 WAT 9870 125.798 32.660 92.743 1.00 0.00 H ATOM 89159 H2 WAT 9870 126.759 33.787 92.433 1.00 0.00 H TER 89161 WAT 9870 ATOM 89161 O WAT 9871 93.073 67.481 23.130 1.00 0.00 O ATOM 89162 H1 WAT 9871 92.464 66.744 23.186 1.00 0.00 H ATOM 89163 H2 WAT 9871 93.337 67.642 24.035 1.00 0.00 H TER 89165 WAT 9871 ATOM 89165 O WAT 9872 34.829 103.651 76.399 1.00 0.00 O ATOM 89166 H1 WAT 9872 34.574 104.535 76.664 1.00 0.00 H ATOM 89167 H2 WAT 9872 34.991 103.191 77.223 1.00 0.00 H TER 89169 WAT 9872 ATOM 89169 O WAT 9873 76.395 59.555 115.687 1.00 0.00 O ATOM 89170 H1 WAT 9873 76.768 58.702 115.462 1.00 0.00 H ATOM 89171 H2 WAT 9873 76.159 59.476 116.612 1.00 0.00 H TER 89173 WAT 9873 ATOM 89173 O WAT 9874 41.204 93.854 65.927 1.00 0.00 O ATOM 89174 H1 WAT 9874 40.436 93.307 66.095 1.00 0.00 H ATOM 89175 H2 WAT 9874 41.926 93.388 66.348 1.00 0.00 H TER 89177 WAT 9874 ATOM 89177 O WAT 9875 123.482 83.859 18.983 1.00 0.00 O ATOM 89178 H1 WAT 9875 123.460 84.273 19.846 1.00 0.00 H ATOM 89179 H2 WAT 9875 123.447 84.589 18.366 1.00 0.00 H TER 89181 WAT 9875 ATOM 89181 O WAT 9876 102.239 20.065 142.371 1.00 0.00 O ATOM 89182 H1 WAT 9876 101.476 20.288 141.838 1.00 0.00 H ATOM 89183 H2 WAT 9876 102.549 19.234 142.009 1.00 0.00 H TER 89185 WAT 9876 ATOM 89185 O WAT 9877 124.998 100.545 11.389 1.00 0.00 O ATOM 89186 H1 WAT 9877 125.390 101.190 10.800 1.00 0.00 H ATOM 89187 H2 WAT 9877 125.699 100.324 12.002 1.00 0.00 H TER 89189 WAT 9877 ATOM 89189 O WAT 9878 72.395 29.069 112.626 1.00 0.00 O ATOM 89190 H1 WAT 9878 72.909 29.877 112.626 1.00 0.00 H ATOM 89191 H2 WAT 9878 71.643 29.263 112.066 1.00 0.00 H TER 89193 WAT 9878 ATOM 89193 O WAT 9879 12.617 25.727 119.896 1.00 0.00 O ATOM 89194 H1 WAT 9879 12.943 26.004 119.040 1.00 0.00 H ATOM 89195 H2 WAT 9879 13.059 26.304 120.519 1.00 0.00 H TER 89197 WAT 9879 ATOM 89197 O WAT 9880 85.880 42.610 21.751 1.00 0.00 O ATOM 89198 H1 WAT 9880 86.193 42.809 22.634 1.00 0.00 H ATOM 89199 H2 WAT 9880 85.003 42.249 21.883 1.00 0.00 H TER 89201 WAT 9880 ATOM 89201 O WAT 9881 137.842 125.560 121.517 1.00 0.00 O ATOM 89202 H1 WAT 9881 138.264 125.381 120.677 1.00 0.00 H ATOM 89203 H2 WAT 9881 137.548 124.703 121.826 1.00 0.00 H TER 89205 WAT 9881 ATOM 89205 O WAT 9882 15.331 14.783 81.874 1.00 0.00 O ATOM 89206 H1 WAT 9882 15.835 13.971 81.913 1.00 0.00 H ATOM 89207 H2 WAT 9882 14.760 14.747 82.642 1.00 0.00 H TER 89209 WAT 9882 ATOM 89209 O WAT 9883 117.079 8.469 14.490 1.00 0.00 O ATOM 89210 H1 WAT 9883 117.883 8.010 14.248 1.00 0.00 H ATOM 89211 H2 WAT 9883 116.632 8.624 13.658 1.00 0.00 H TER 89213 WAT 9883 ATOM 89213 O WAT 9884 66.581 78.287 18.630 1.00 0.00 O ATOM 89214 H1 WAT 9884 66.368 79.145 18.999 1.00 0.00 H ATOM 89215 H2 WAT 9884 66.713 77.725 19.394 1.00 0.00 H TER 89217 WAT 9884 ATOM 89217 O WAT 9885 8.827 105.855 69.720 1.00 0.00 O ATOM 89218 H1 WAT 9885 8.861 105.511 70.613 1.00 0.00 H ATOM 89219 H2 WAT 9885 9.439 106.591 69.724 1.00 0.00 H TER 89221 WAT 9885 ATOM 89221 O WAT 9886 96.826 57.982 1.056 1.00 0.00 O ATOM 89222 H1 WAT 9886 97.409 57.340 1.463 1.00 0.00 H ATOM 89223 H2 WAT 9886 97.303 58.810 1.115 1.00 0.00 H TER 89225 WAT 9886 ATOM 89225 O WAT 9887 82.269 112.068 71.916 1.00 0.00 O ATOM 89226 H1 WAT 9887 83.040 111.749 72.386 1.00 0.00 H ATOM 89227 H2 WAT 9887 82.485 112.972 71.687 1.00 0.00 H TER 89229 WAT 9887 ATOM 89229 O WAT 9888 82.553 94.490 101.129 1.00 0.00 O ATOM 89230 H1 WAT 9888 82.000 93.859 100.668 1.00 0.00 H ATOM 89231 H2 WAT 9888 83.444 94.162 101.006 1.00 0.00 H TER 89233 WAT 9888 ATOM 89233 O WAT 9889 19.650 74.784 148.098 1.00 0.00 O ATOM 89234 H1 WAT 9889 20.395 75.012 147.542 1.00 0.00 H ATOM 89235 H2 WAT 9889 20.045 74.478 148.914 1.00 0.00 H TER 89237 WAT 9889 ATOM 89237 O WAT 9890 88.982 13.850 92.595 1.00 0.00 O ATOM 89238 H1 WAT 9890 88.572 14.555 93.095 1.00 0.00 H ATOM 89239 H2 WAT 9890 89.508 14.299 91.933 1.00 0.00 H TER 89241 WAT 9890 ATOM 89241 O WAT 9891 24.749 67.838 103.134 1.00 0.00 O ATOM 89242 H1 WAT 9891 24.066 68.499 103.247 1.00 0.00 H ATOM 89243 H2 WAT 9891 25.356 67.996 103.856 1.00 0.00 H TER 89245 WAT 9891 ATOM 89245 O WAT 9892 82.573 2.902 141.948 1.00 0.00 O ATOM 89246 H1 WAT 9892 83.431 2.684 141.585 1.00 0.00 H ATOM 89247 H2 WAT 9892 82.765 3.476 142.689 1.00 0.00 H TER 89249 WAT 9892 ATOM 89249 O WAT 9893 85.459 69.898 105.525 1.00 0.00 O ATOM 89250 H1 WAT 9893 86.213 69.525 105.068 1.00 0.00 H ATOM 89251 H2 WAT 9893 85.514 69.539 106.410 1.00 0.00 H TER 89253 WAT 9893 ATOM 89253 O WAT 9894 5.048 34.966 112.476 1.00 0.00 O ATOM 89254 H1 WAT 9894 5.411 35.403 113.246 1.00 0.00 H ATOM 89255 H2 WAT 9894 4.215 35.411 112.318 1.00 0.00 H TER 89257 WAT 9894 ATOM 89257 O WAT 9895 71.435 104.891 141.239 1.00 0.00 O ATOM 89258 H1 WAT 9895 71.656 105.823 141.236 1.00 0.00 H ATOM 89259 H2 WAT 9895 70.519 104.863 141.514 1.00 0.00 H TER 89261 WAT 9895 ATOM 89261 O WAT 9896 134.370 128.442 9.780 1.00 0.00 O ATOM 89262 H1 WAT 9896 134.056 127.613 9.419 1.00 0.00 H ATOM 89263 H2 WAT 9896 134.497 129.003 9.015 1.00 0.00 H TER 89265 WAT 9896 ATOM 89265 O WAT 9897 43.782 129.459 68.105 1.00 0.00 O ATOM 89266 H1 WAT 9897 43.041 129.999 68.379 1.00 0.00 H ATOM 89267 H2 WAT 9897 44.554 129.969 68.350 1.00 0.00 H TER 89269 WAT 9897 ATOM 89269 O WAT 9898 37.836 15.343 116.963 1.00 0.00 O ATOM 89270 H1 WAT 9898 38.054 15.019 117.837 1.00 0.00 H ATOM 89271 H2 WAT 9898 36.921 15.091 116.836 1.00 0.00 H TER 89273 WAT 9898 ATOM 89273 O WAT 9899 48.243 41.799 138.526 1.00 0.00 O ATOM 89274 H1 WAT 9899 47.818 41.006 138.853 1.00 0.00 H ATOM 89275 H2 WAT 9899 48.161 41.740 137.574 1.00 0.00 H TER 89277 WAT 9899 ATOM 89277 O WAT 9900 24.832 115.990 120.676 1.00 0.00 O ATOM 89278 H1 WAT 9900 24.240 115.675 121.359 1.00 0.00 H ATOM 89279 H2 WAT 9900 25.562 116.383 121.156 1.00 0.00 H TER 89281 WAT 9900 ATOM 89281 O WAT 9901 51.692 105.602 113.111 1.00 0.00 O ATOM 89282 H1 WAT 9901 52.517 105.119 113.164 1.00 0.00 H ATOM 89283 H2 WAT 9901 51.608 105.831 112.185 1.00 0.00 H TER 89285 WAT 9901 ATOM 89285 O WAT 9902 140.477 32.758 12.613 1.00 0.00 O ATOM 89286 H1 WAT 9902 141.104 33.243 12.077 1.00 0.00 H ATOM 89287 H2 WAT 9902 139.971 32.244 11.985 1.00 0.00 H TER 89289 WAT 9902 ATOM 89289 O WAT 9903 87.759 96.206 109.748 1.00 0.00 O ATOM 89290 H1 WAT 9903 86.895 96.480 110.057 1.00 0.00 H ATOM 89291 H2 WAT 9903 87.867 96.655 108.909 1.00 0.00 H TER 89293 WAT 9903 ATOM 89293 O WAT 9904 100.632 54.636 72.224 1.00 0.00 O ATOM 89294 H1 WAT 9904 99.694 54.476 72.325 1.00 0.00 H ATOM 89295 H2 WAT 9904 101.033 54.195 72.973 1.00 0.00 H TER 89297 WAT 9904 ATOM 89297 O WAT 9905 67.177 114.158 6.613 1.00 0.00 O ATOM 89298 H1 WAT 9905 67.793 113.909 5.924 1.00 0.00 H ATOM 89299 H2 WAT 9905 67.096 115.108 6.531 1.00 0.00 H TER 89301 WAT 9905 ATOM 89301 O WAT 9906 135.964 83.048 26.571 1.00 0.00 O ATOM 89302 H1 WAT 9906 135.954 82.307 25.965 1.00 0.00 H ATOM 89303 H2 WAT 9906 135.157 83.525 26.380 1.00 0.00 H TER 89305 WAT 9906 ATOM 89305 O WAT 9907 100.461 65.627 154.093 1.00 0.00 O ATOM 89306 H1 WAT 9907 100.709 66.380 153.557 1.00 0.00 H ATOM 89307 H2 WAT 9907 100.880 64.880 153.665 1.00 0.00 H TER 89309 WAT 9907 ATOM 89309 O WAT 9908 75.530 107.347 21.957 1.00 0.00 O ATOM 89310 H1 WAT 9908 74.839 107.863 22.373 1.00 0.00 H ATOM 89311 H2 WAT 9908 75.301 106.439 22.152 1.00 0.00 H TER 89313 WAT 9908 ATOM 89313 O WAT 9909 7.207 106.903 100.945 1.00 0.00 O ATOM 89314 H1 WAT 9909 7.554 107.498 100.280 1.00 0.00 H ATOM 89315 H2 WAT 9909 7.899 106.254 101.069 1.00 0.00 H TER 89317 WAT 9909 ATOM 89317 O WAT 9910 104.428 76.836 116.605 1.00 0.00 O ATOM 89318 H1 WAT 9910 104.621 76.968 115.676 1.00 0.00 H ATOM 89319 H2 WAT 9910 103.917 76.026 116.630 1.00 0.00 H TER 89321 WAT 9910 ATOM 89321 O WAT 9911 118.364 140.211 70.942 1.00 0.00 O ATOM 89322 H1 WAT 9911 119.133 139.672 70.755 1.00 0.00 H ATOM 89323 H2 WAT 9911 118.713 140.973 71.403 1.00 0.00 H TER 89325 WAT 9911 ATOM 89325 O WAT 9912 120.680 26.324 148.417 1.00 0.00 O ATOM 89326 H1 WAT 9912 120.058 26.474 149.130 1.00 0.00 H ATOM 89327 H2 WAT 9912 121.485 26.753 148.707 1.00 0.00 H TER 89329 WAT 9912 ATOM 89329 O WAT 9913 82.975 123.053 127.444 1.00 0.00 O ATOM 89330 H1 WAT 9913 83.184 122.207 127.048 1.00 0.00 H ATOM 89331 H2 WAT 9913 83.421 123.037 128.291 1.00 0.00 H TER 89333 WAT 9913 ATOM 89333 O WAT 9914 11.373 60.197 89.869 1.00 0.00 O ATOM 89334 H1 WAT 9914 11.056 59.892 90.719 1.00 0.00 H ATOM 89335 H2 WAT 9914 11.769 59.423 89.469 1.00 0.00 H TER 89337 WAT 9914 ATOM 89337 O WAT 9915 17.220 54.174 52.968 1.00 0.00 O ATOM 89338 H1 WAT 9915 18.023 54.035 53.470 1.00 0.00 H ATOM 89339 H2 WAT 9915 17.067 55.118 53.017 1.00 0.00 H TER 89341 WAT 9915 ATOM 89341 O WAT 9916 91.402 69.241 147.257 1.00 0.00 O ATOM 89342 H1 WAT 9916 91.308 69.381 148.199 1.00 0.00 H ATOM 89343 H2 WAT 9916 91.960 69.961 146.962 1.00 0.00 H TER 89345 WAT 9916 ATOM 89345 O WAT 9917 126.806 11.338 146.658 1.00 0.00 O ATOM 89346 H1 WAT 9917 127.380 10.865 146.055 1.00 0.00 H ATOM 89347 H2 WAT 9917 126.502 12.094 146.155 1.00 0.00 H TER 89349 WAT 9917 ATOM 89349 O WAT 9918 108.643 27.316 79.487 1.00 0.00 O ATOM 89350 H1 WAT 9918 108.856 27.446 78.563 1.00 0.00 H ATOM 89351 H2 WAT 9918 108.747 26.375 79.627 1.00 0.00 H TER 89353 WAT 9918 ATOM 89353 O WAT 9919 75.901 16.120 22.144 1.00 0.00 O ATOM 89354 H1 WAT 9919 76.626 16.616 21.764 1.00 0.00 H ATOM 89355 H2 WAT 9919 75.232 16.778 22.332 1.00 0.00 H TER 89357 WAT 9919 ATOM 89357 O WAT 9920 109.416 99.223 131.473 1.00 0.00 O ATOM 89358 H1 WAT 9920 109.880 100.059 131.442 1.00 0.00 H ATOM 89359 H2 WAT 9920 108.800 99.264 130.741 1.00 0.00 H TER 89361 WAT 9920 ATOM 89361 O WAT 9921 6.190 15.866 66.887 1.00 0.00 O ATOM 89362 H1 WAT 9921 6.796 15.157 66.671 1.00 0.00 H ATOM 89363 H2 WAT 9921 6.626 16.658 66.573 1.00 0.00 H TER 89365 WAT 9921 ATOM 89365 O WAT 9922 92.573 5.606 124.021 1.00 0.00 O ATOM 89366 H1 WAT 9922 92.765 5.034 123.278 1.00 0.00 H ATOM 89367 H2 WAT 9922 91.704 5.333 124.315 1.00 0.00 H TER 89369 WAT 9922 ATOM 89369 O WAT 9923 16.115 88.161 145.475 1.00 0.00 O ATOM 89370 H1 WAT 9923 16.422 89.066 145.525 1.00 0.00 H ATOM 89371 H2 WAT 9923 15.175 88.218 145.651 1.00 0.00 H TER 89373 WAT 9923 ATOM 89373 O WAT 9924 34.591 88.450 119.610 1.00 0.00 O ATOM 89374 H1 WAT 9924 34.141 87.615 119.478 1.00 0.00 H ATOM 89375 H2 WAT 9924 33.889 89.100 119.622 1.00 0.00 H TER 89377 WAT 9924 ATOM 89377 O WAT 9925 82.446 24.855 86.535 1.00 0.00 O ATOM 89378 H1 WAT 9925 82.664 25.337 87.332 1.00 0.00 H ATOM 89379 H2 WAT 9925 81.568 24.511 86.695 1.00 0.00 H TER 89381 WAT 9925 ATOM 89381 O WAT 9926 17.083 8.371 6.085 1.00 0.00 O ATOM 89382 H1 WAT 9926 16.504 9.123 6.208 1.00 0.00 H ATOM 89383 H2 WAT 9926 17.815 8.533 6.680 1.00 0.00 H TER 89385 WAT 9926 ATOM 89385 O WAT 9927 12.861 48.142 115.822 1.00 0.00 O ATOM 89386 H1 WAT 9927 12.863 48.772 115.102 1.00 0.00 H ATOM 89387 H2 WAT 9927 12.066 47.626 115.688 1.00 0.00 H TER 89389 WAT 9927 ATOM 89389 O WAT 9928 106.729 78.756 26.222 1.00 0.00 O ATOM 89390 H1 WAT 9928 106.589 78.361 27.082 1.00 0.00 H ATOM 89391 H2 WAT 9928 105.853 79.005 25.927 1.00 0.00 H TER 89393 WAT 9928 ATOM 89393 O WAT 9929 101.481 15.742 116.475 1.00 0.00 O ATOM 89394 H1 WAT 9929 102.006 16.539 116.550 1.00 0.00 H ATOM 89395 H2 WAT 9929 101.349 15.456 117.379 1.00 0.00 H TER 89397 WAT 9929 ATOM 89397 O WAT 9930 93.708 140.556 121.590 1.00 0.00 O ATOM 89398 H1 WAT 9930 93.575 141.422 121.206 1.00 0.00 H ATOM 89399 H2 WAT 9930 94.653 140.501 121.734 1.00 0.00 H TER 89401 WAT 9930 ATOM 89401 O WAT 9931 56.781 10.353 12.029 1.00 0.00 O ATOM 89402 H1 WAT 9931 56.107 10.674 12.628 1.00 0.00 H ATOM 89403 H2 WAT 9931 57.606 10.641 12.420 1.00 0.00 H TER 89405 WAT 9931 ATOM 89405 O WAT 9932 66.299 24.930 151.916 1.00 0.00 O ATOM 89406 H1 WAT 9932 67.010 24.315 151.735 1.00 0.00 H ATOM 89407 H2 WAT 9932 66.266 25.493 151.143 1.00 0.00 H TER 89409 WAT 9932 ATOM 89409 O WAT 9933 97.213 93.449 14.097 1.00 0.00 O ATOM 89410 H1 WAT 9933 97.261 93.965 13.292 1.00 0.00 H ATOM 89411 H2 WAT 9933 97.103 92.547 13.797 1.00 0.00 H TER 89413 WAT 9933 ATOM 89413 O WAT 9934 72.371 74.042 116.621 1.00 0.00 O ATOM 89414 H1 WAT 9934 72.052 73.962 117.520 1.00 0.00 H ATOM 89415 H2 WAT 9934 71.711 74.576 116.179 1.00 0.00 H TER 89417 WAT 9934 ATOM 89417 O WAT 9935 58.253 1.740 81.164 1.00 0.00 O ATOM 89418 H1 WAT 9935 57.600 2.361 81.487 1.00 0.00 H ATOM 89419 H2 WAT 9935 57.739 1.031 80.779 1.00 0.00 H TER 89421 WAT 9935 ATOM 89421 O WAT 9936 32.033 145.015 83.655 1.00 0.00 O ATOM 89422 H1 WAT 9936 31.171 144.601 83.613 1.00 0.00 H ATOM 89423 H2 WAT 9936 32.356 144.808 84.533 1.00 0.00 H TER 89425 WAT 9936 ATOM 89425 O WAT 9937 30.133 32.932 17.974 1.00 0.00 O ATOM 89426 H1 WAT 9937 30.130 32.565 18.858 1.00 0.00 H ATOM 89427 H2 WAT 9937 30.713 32.356 17.477 1.00 0.00 H TER 89429 WAT 9937 ATOM 89429 O WAT 9938 116.752 139.153 64.694 1.00 0.00 O ATOM 89430 H1 WAT 9938 116.857 139.888 65.299 1.00 0.00 H ATOM 89431 H2 WAT 9938 117.384 139.325 63.996 1.00 0.00 H TER 89433 WAT 9938 ATOM 89433 O WAT 9939 130.881 20.320 137.964 1.00 0.00 O ATOM 89434 H1 WAT 9939 130.328 20.586 137.229 1.00 0.00 H ATOM 89435 H2 WAT 9939 131.341 21.120 138.219 1.00 0.00 H TER 89437 WAT 9939 ATOM 89437 O WAT 9940 26.897 145.478 77.950 1.00 0.00 O ATOM 89438 H1 WAT 9940 27.804 145.334 77.681 1.00 0.00 H ATOM 89439 H2 WAT 9940 26.914 145.399 78.904 1.00 0.00 H TER 89441 WAT 9940 ATOM 89441 O WAT 9941 128.956 63.266 152.523 1.00 0.00 O ATOM 89442 H1 WAT 9941 128.474 62.508 152.193 1.00 0.00 H ATOM 89443 H2 WAT 9941 129.776 63.263 152.028 1.00 0.00 H TER 89445 WAT 9941 ATOM 89445 O WAT 9942 15.433 4.040 119.097 1.00 0.00 O ATOM 89446 H1 WAT 9942 15.587 4.454 119.946 1.00 0.00 H ATOM 89447 H2 WAT 9942 15.741 4.681 118.457 1.00 0.00 H TER 89449 WAT 9942 ATOM 89449 O WAT 9943 115.109 120.857 75.561 1.00 0.00 O ATOM 89450 H1 WAT 9943 114.744 121.011 76.432 1.00 0.00 H ATOM 89451 H2 WAT 9943 114.376 120.511 75.052 1.00 0.00 H TER 89453 WAT 9943 ATOM 89453 O WAT 9944 46.885 57.212 71.589 1.00 0.00 O ATOM 89454 H1 WAT 9944 47.635 56.749 71.962 1.00 0.00 H ATOM 89455 H2 WAT 9944 46.929 58.088 71.975 1.00 0.00 H TER 89457 WAT 9944 ATOM 89457 O WAT 9945 98.015 100.310 131.935 1.00 0.00 O ATOM 89458 H1 WAT 9945 98.732 100.932 131.814 1.00 0.00 H ATOM 89459 H2 WAT 9945 98.001 99.799 131.125 1.00 0.00 H TER 89461 WAT 9945 ATOM 89461 O WAT 9946 21.264 55.028 59.930 1.00 0.00 O ATOM 89462 H1 WAT 9946 22.110 55.109 59.490 1.00 0.00 H ATOM 89463 H2 WAT 9946 21.442 54.479 60.693 1.00 0.00 H TER 89465 WAT 9946 ATOM 89465 O WAT 9947 118.901 82.199 7.825 1.00 0.00 O ATOM 89466 H1 WAT 9947 119.574 81.615 8.177 1.00 0.00 H ATOM 89467 H2 WAT 9947 118.144 81.632 7.681 1.00 0.00 H TER 89469 WAT 9947 ATOM 89469 O WAT 9948 28.013 100.495 131.686 1.00 0.00 O ATOM 89470 H1 WAT 9948 27.993 99.582 131.973 1.00 0.00 H ATOM 89471 H2 WAT 9948 28.901 100.620 131.351 1.00 0.00 H TER 89473 WAT 9948 ATOM 89473 O WAT 9949 118.254 12.166 65.867 1.00 0.00 O ATOM 89474 H1 WAT 9949 117.838 12.978 66.157 1.00 0.00 H ATOM 89475 H2 WAT 9949 119.192 12.356 65.890 1.00 0.00 H TER 89477 WAT 9949 ATOM 89477 O WAT 9950 79.627 115.187 82.149 1.00 0.00 O ATOM 89478 H1 WAT 9950 79.824 115.278 83.081 1.00 0.00 H ATOM 89479 H2 WAT 9950 79.055 115.929 81.952 1.00 0.00 H TER 89481 WAT 9950 ATOM 89481 O WAT 9951 107.078 125.973 118.472 1.00 0.00 O ATOM 89482 H1 WAT 9951 107.218 126.875 118.760 1.00 0.00 H ATOM 89483 H2 WAT 9951 106.589 125.566 119.187 1.00 0.00 H TER 89485 WAT 9951 ATOM 89485 O WAT 9952 133.140 93.870 11.945 1.00 0.00 O ATOM 89486 H1 WAT 9952 133.577 93.036 11.776 1.00 0.00 H ATOM 89487 H2 WAT 9952 132.271 93.768 11.559 1.00 0.00 H TER 89489 WAT 9952 ATOM 89489 O WAT 9953 98.273 118.911 2.119 1.00 0.00 O ATOM 89490 H1 WAT 9953 99.215 118.915 1.948 1.00 0.00 H ATOM 89491 H2 WAT 9953 98.192 118.570 3.010 1.00 0.00 H TER 89493 WAT 9953 ATOM 89493 O WAT 9954 84.216 62.693 149.541 1.00 0.00 O ATOM 89494 H1 WAT 9954 83.645 63.114 150.184 1.00 0.00 H ATOM 89495 H2 WAT 9954 84.288 63.331 148.831 1.00 0.00 H TER 89497 WAT 9954 ATOM 89497 O WAT 9955 57.121 24.523 75.928 1.00 0.00 O ATOM 89498 H1 WAT 9955 56.831 23.750 75.444 1.00 0.00 H ATOM 89499 H2 WAT 9955 56.490 25.203 75.691 1.00 0.00 H TER 89501 WAT 9955 ATOM 89501 O WAT 9956 25.562 83.708 125.301 1.00 0.00 O ATOM 89502 H1 WAT 9956 25.786 84.376 124.653 1.00 0.00 H ATOM 89503 H2 WAT 9956 25.799 84.100 126.142 1.00 0.00 H TER 89505 WAT 9956 ATOM 89505 O WAT 9957 31.632 134.478 150.665 1.00 0.00 O ATOM 89506 H1 WAT 9957 32.395 134.299 150.116 1.00 0.00 H ATOM 89507 H2 WAT 9957 30.954 134.755 150.049 1.00 0.00 H TER 89509 WAT 9957 ATOM 89509 O WAT 9958 31.928 70.434 98.318 1.00 0.00 O ATOM 89510 H1 WAT 9958 31.225 69.785 98.308 1.00 0.00 H ATOM 89511 H2 WAT 9958 32.173 70.508 99.240 1.00 0.00 H TER 89513 WAT 9958 ATOM 89513 O WAT 9959 79.869 31.640 98.626 1.00 0.00 O ATOM 89514 H1 WAT 9959 78.973 31.610 98.289 1.00 0.00 H ATOM 89515 H2 WAT 9959 80.086 30.725 98.808 1.00 0.00 H TER 89517 WAT 9959 ATOM 89517 O WAT 9960 2.969 86.937 72.743 1.00 0.00 O ATOM 89518 H1 WAT 9960 3.885 87.146 72.562 1.00 0.00 H ATOM 89519 H2 WAT 9960 3.005 86.139 73.271 1.00 0.00 H TER 89521 WAT 9960 ATOM 89521 O WAT 9961 25.152 48.459 136.288 1.00 0.00 O ATOM 89522 H1 WAT 9961 25.104 49.393 136.085 1.00 0.00 H ATOM 89523 H2 WAT 9961 24.676 48.034 135.574 1.00 0.00 H TER 89525 WAT 9961 ATOM 89525 O WAT 9962 88.901 120.868 68.326 1.00 0.00 O ATOM 89526 H1 WAT 9962 88.476 121.653 68.672 1.00 0.00 H ATOM 89527 H2 WAT 9962 89.478 121.193 67.635 1.00 0.00 H TER 89529 WAT 9962 ATOM 89529 O WAT 9963 114.894 137.775 57.992 1.00 0.00 O ATOM 89530 H1 WAT 9963 114.496 137.619 58.849 1.00 0.00 H ATOM 89531 H2 WAT 9963 114.375 138.484 57.613 1.00 0.00 H TER 89533 WAT 9963 ATOM 89533 O WAT 9964 46.612 78.649 108.188 1.00 0.00 O ATOM 89534 H1 WAT 9964 46.677 79.591 108.029 1.00 0.00 H ATOM 89535 H2 WAT 9964 45.741 78.530 108.566 1.00 0.00 H TER 89537 WAT 9964 ATOM 89537 O WAT 9965 92.193 47.846 107.352 1.00 0.00 O ATOM 89538 H1 WAT 9965 92.586 47.379 106.614 1.00 0.00 H ATOM 89539 H2 WAT 9965 91.735 47.168 107.848 1.00 0.00 H TER 89541 WAT 9965 ATOM 89541 O WAT 9966 127.403 2.445 74.265 1.00 0.00 O ATOM 89542 H1 WAT 9966 128.008 3.187 74.278 1.00 0.00 H ATOM 89543 H2 WAT 9966 127.576 2.010 73.430 1.00 0.00 H TER 89545 WAT 9966 ATOM 89545 O WAT 9967 95.373 40.946 73.421 1.00 0.00 O ATOM 89546 H1 WAT 9967 95.987 40.645 74.090 1.00 0.00 H ATOM 89547 H2 WAT 9967 95.897 41.000 72.622 1.00 0.00 H TER 89549 WAT 9967 ATOM 89549 O WAT 9968 31.530 72.235 83.750 1.00 0.00 O ATOM 89550 H1 WAT 9968 32.130 72.597 84.401 1.00 0.00 H ATOM 89551 H2 WAT 9968 31.985 71.466 83.407 1.00 0.00 H TER 89553 WAT 9968 ATOM 89553 O WAT 9969 92.881 39.404 132.864 1.00 0.00 O ATOM 89554 H1 WAT 9969 92.484 39.829 133.625 1.00 0.00 H ATOM 89555 H2 WAT 9969 92.762 40.031 132.150 1.00 0.00 H TER 89557 WAT 9969 ATOM 89557 O WAT 9970 102.048 113.039 22.583 1.00 0.00 O ATOM 89558 H1 WAT 9970 101.201 113.454 22.419 1.00 0.00 H ATOM 89559 H2 WAT 9970 102.415 113.528 23.319 1.00 0.00 H TER 89561 WAT 9970 ATOM 89561 O WAT 9971 98.112 28.074 126.270 1.00 0.00 O ATOM 89562 H1 WAT 9971 99.029 27.935 126.037 1.00 0.00 H ATOM 89563 H2 WAT 9971 98.083 27.946 127.218 1.00 0.00 H TER 89565 WAT 9971 ATOM 89565 O WAT 9972 91.606 27.323 113.817 1.00 0.00 O ATOM 89566 H1 WAT 9972 91.235 26.442 113.763 1.00 0.00 H ATOM 89567 H2 WAT 9972 90.916 27.894 113.479 1.00 0.00 H TER 89569 WAT 9972 ATOM 89569 O WAT 9973 87.181 106.419 1.687 1.00 0.00 O ATOM 89570 H1 WAT 9973 88.107 106.552 1.891 1.00 0.00 H ATOM 89571 H2 WAT 9973 87.184 105.860 0.911 1.00 0.00 H TER 89573 WAT 9973 ATOM 89573 O WAT 9974 78.082 145.030 98.849 1.00 0.00 O ATOM 89574 H1 WAT 9974 78.389 145.749 99.401 1.00 0.00 H ATOM 89575 H2 WAT 9974 77.136 145.005 98.991 1.00 0.00 H TER 89577 WAT 9974 ATOM 89577 O WAT 9975 62.749 126.531 139.713 1.00 0.00 O ATOM 89578 H1 WAT 9975 61.898 126.836 139.397 1.00 0.00 H ATOM 89579 H2 WAT 9975 62.753 125.593 139.522 1.00 0.00 H TER 89581 WAT 9975 ATOM 89581 O WAT 9976 93.310 25.823 134.419 1.00 0.00 O ATOM 89582 H1 WAT 9976 92.865 25.572 135.229 1.00 0.00 H ATOM 89583 H2 WAT 9976 92.740 25.498 133.722 1.00 0.00 H TER 89585 WAT 9976 ATOM 89585 O WAT 9977 54.389 144.931 68.671 1.00 0.00 O ATOM 89586 H1 WAT 9977 55.315 144.752 68.837 1.00 0.00 H ATOM 89587 H2 WAT 9977 54.385 145.439 67.860 1.00 0.00 H TER 89589 WAT 9977 ATOM 89589 O WAT 9978 117.855 113.561 106.071 1.00 0.00 O ATOM 89590 H1 WAT 9978 117.848 114.210 105.368 1.00 0.00 H ATOM 89591 H2 WAT 9978 118.266 112.789 105.681 1.00 0.00 H TER 89593 WAT 9978 ATOM 89593 O WAT 9979 114.576 119.110 56.843 1.00 0.00 O ATOM 89594 H1 WAT 9979 115.029 118.357 56.464 1.00 0.00 H ATOM 89595 H2 WAT 9979 113.667 118.822 56.934 1.00 0.00 H TER 89597 WAT 9979 ATOM 89597 O WAT 9980 71.854 102.068 117.572 1.00 0.00 O ATOM 89598 H1 WAT 9980 71.613 102.899 117.981 1.00 0.00 H ATOM 89599 H2 WAT 9980 71.999 102.287 116.652 1.00 0.00 H TER 89601 WAT 9980 ATOM 89601 O WAT 9981 37.350 26.775 102.234 1.00 0.00 O ATOM 89602 H1 WAT 9981 38.069 26.189 102.471 1.00 0.00 H ATOM 89603 H2 WAT 9981 36.586 26.410 102.682 1.00 0.00 H TER 89605 WAT 9981 ATOM 89605 O WAT 9982 39.095 86.030 100.888 1.00 0.00 O ATOM 89606 H1 WAT 9982 39.735 86.741 100.855 1.00 0.00 H ATOM 89607 H2 WAT 9982 38.271 86.438 100.622 1.00 0.00 H TER 89609 WAT 9982 ATOM 89609 O WAT 9983 102.163 75.447 71.474 1.00 0.00 O ATOM 89610 H1 WAT 9983 101.923 76.367 71.370 1.00 0.00 H ATOM 89611 H2 WAT 9983 101.356 75.018 71.757 1.00 0.00 H TER 89613 WAT 9983 ATOM 89613 O WAT 9984 88.505 40.141 105.486 1.00 0.00 O ATOM 89614 H1 WAT 9984 89.405 40.360 105.243 1.00 0.00 H ATOM 89615 H2 WAT 9984 88.080 39.921 104.657 1.00 0.00 H TER 89617 WAT 9984 ATOM 89617 O WAT 9985 78.539 120.133 19.804 1.00 0.00 O ATOM 89618 H1 WAT 9985 79.000 120.968 19.726 1.00 0.00 H ATOM 89619 H2 WAT 9985 78.488 119.974 20.746 1.00 0.00 H TER 89621 WAT 9985 ATOM 89621 O WAT 9986 120.587 57.630 138.119 1.00 0.00 O ATOM 89622 H1 WAT 9986 121.166 56.907 137.876 1.00 0.00 H ATOM 89623 H2 WAT 9986 121.122 58.183 138.689 1.00 0.00 H TER 89625 WAT 9986 ATOM 89625 O WAT 9987 68.046 87.324 22.968 1.00 0.00 O ATOM 89626 H1 WAT 9987 67.091 87.373 23.017 1.00 0.00 H ATOM 89627 H2 WAT 9987 68.219 86.552 22.430 1.00 0.00 H TER 89629 WAT 9987 ATOM 89629 O WAT 9988 109.038 38.348 82.619 1.00 0.00 O ATOM 89630 H1 WAT 9988 108.995 37.976 81.738 1.00 0.00 H ATOM 89631 H2 WAT 9988 108.271 37.991 83.068 1.00 0.00 H TER 89633 WAT 9988 ATOM 89633 O WAT 9989 13.444 124.283 91.219 1.00 0.00 O ATOM 89634 H1 WAT 9989 13.447 123.784 92.036 1.00 0.00 H ATOM 89635 H2 WAT 9989 14.366 124.335 90.967 1.00 0.00 H TER 89637 WAT 9989 ATOM 89637 O WAT 9990 109.329 20.114 136.121 1.00 0.00 O ATOM 89638 H1 WAT 9990 108.924 20.787 136.668 1.00 0.00 H ATOM 89639 H2 WAT 9990 109.496 20.552 135.287 1.00 0.00 H TER 89641 WAT 9990 ATOM 89641 O WAT 9991 57.570 95.932 16.010 1.00 0.00 O ATOM 89642 H1 WAT 9991 57.692 95.973 16.959 1.00 0.00 H ATOM 89643 H2 WAT 9991 57.835 96.796 15.697 1.00 0.00 H TER 89645 WAT 9991 ATOM 89645 O WAT 9992 64.667 139.230 104.708 1.00 0.00 O ATOM 89646 H1 WAT 9992 65.453 139.143 105.246 1.00 0.00 H ATOM 89647 H2 WAT 9992 64.998 139.322 103.814 1.00 0.00 H TER 89649 WAT 9992 ATOM 89649 O WAT 9993 84.178 46.618 70.081 1.00 0.00 O ATOM 89650 H1 WAT 9993 83.966 46.007 69.375 1.00 0.00 H ATOM 89651 H2 WAT 9993 83.671 46.303 70.829 1.00 0.00 H TER 89653 WAT 9993 ATOM 89653 O WAT 9994 114.633 75.594 98.488 1.00 0.00 O ATOM 89654 H1 WAT 9994 115.095 76.404 98.273 1.00 0.00 H ATOM 89655 H2 WAT 9994 113.753 75.878 98.736 1.00 0.00 H TER 89657 WAT 9994 ATOM 89657 O WAT 9995 101.978 129.587 110.185 1.00 0.00 O ATOM 89658 H1 WAT 9995 102.476 129.641 109.370 1.00 0.00 H ATOM 89659 H2 WAT 9995 101.918 130.492 110.490 1.00 0.00 H TER 89661 WAT 9995 ATOM 89661 O WAT 9996 122.486 36.576 60.434 1.00 0.00 O ATOM 89662 H1 WAT 9996 122.713 37.502 60.514 1.00 0.00 H ATOM 89663 H2 WAT 9996 122.637 36.371 59.512 1.00 0.00 H TER 89665 WAT 9996 ATOM 89665 O WAT 9997 53.708 80.045 22.367 1.00 0.00 O ATOM 89666 H1 WAT 9997 53.053 80.177 23.053 1.00 0.00 H ATOM 89667 H2 WAT 9997 53.262 80.299 21.559 1.00 0.00 H TER 89669 WAT 9997 ATOM 89669 O WAT 9998 92.928 24.704 71.716 1.00 0.00 O ATOM 89670 H1 WAT 9998 92.817 23.827 72.083 1.00 0.00 H ATOM 89671 H2 WAT 9998 92.319 24.734 70.978 1.00 0.00 H TER 89673 WAT 9998 ATOM 89673 O WAT 9999 124.668 132.954 94.041 1.00 0.00 O ATOM 89674 H1 WAT 9999 124.371 133.555 93.358 1.00 0.00 H ATOM 89675 H2 WAT 9999 125.420 133.394 94.437 1.00 0.00 H TER 89677 WAT 9999 ATOM 89677 O WAT 0 109.226 24.089 120.085 1.00 0.00 O ATOM 89678 H1 WAT 0 108.828 24.523 120.840 1.00 0.00 H ATOM 89679 H2 WAT 0 109.306 24.779 119.427 1.00 0.00 H TER 89681 WAT 0 ATOM 89681 O WAT 1 62.330 145.121 20.619 1.00 0.00 O ATOM 89682 H1 WAT 1 61.522 145.610 20.774 1.00 0.00 H ATOM 89683 H2 WAT 1 62.071 144.202 20.692 1.00 0.00 H TER 89685 WAT 1 ATOM 89685 O WAT 2 99.905 118.124 112.704 1.00 0.00 O ATOM 89686 H1 WAT 2 100.653 117.705 113.131 1.00 0.00 H ATOM 89687 H2 WAT 2 99.366 117.395 112.396 1.00 0.00 H TER 89689 WAT 2 ATOM 89689 O WAT 3 35.794 79.349 136.193 1.00 0.00 O ATOM 89690 H1 WAT 3 36.555 78.769 136.207 1.00 0.00 H ATOM 89691 H2 WAT 3 35.150 78.913 136.750 1.00 0.00 H TER 89693 WAT 3 ATOM 89693 O WAT 4 133.114 28.800 108.258 1.00 0.00 O ATOM 89694 H1 WAT 4 133.190 27.924 108.636 1.00 0.00 H ATOM 89695 H2 WAT 4 133.433 28.703 107.361 1.00 0.00 H TER 89697 WAT 4 ATOM 89697 O WAT 5 19.859 70.606 98.403 1.00 0.00 O ATOM 89698 H1 WAT 5 19.847 70.543 99.358 1.00 0.00 H ATOM 89699 H2 WAT 5 20.194 69.758 98.112 1.00 0.00 H TER 89701 WAT 5 ATOM 89701 O WAT 6 143.090 10.527 55.801 1.00 0.00 O ATOM 89702 H1 WAT 6 142.676 9.665 55.783 1.00 0.00 H ATOM 89703 H2 WAT 6 142.585 11.023 56.445 1.00 0.00 H TER 89705 WAT 6 ATOM 89705 O WAT 7 85.427 121.372 72.815 1.00 0.00 O ATOM 89706 H1 WAT 7 85.894 120.591 72.518 1.00 0.00 H ATOM 89707 H2 WAT 7 85.609 122.030 72.144 1.00 0.00 H TER 89709 WAT 7 ATOM 89709 O WAT 8 15.534 49.622 132.045 1.00 0.00 O ATOM 89710 H1 WAT 8 15.947 48.901 132.521 1.00 0.00 H ATOM 89711 H2 WAT 8 15.233 50.219 132.729 1.00 0.00 H TER 89713 WAT 8 ATOM 89713 O WAT 9 64.502 110.549 99.203 1.00 0.00 O ATOM 89714 H1 WAT 9 64.029 109.798 99.563 1.00 0.00 H ATOM 89715 H2 WAT 9 65.399 110.439 99.518 1.00 0.00 H TER 89717 WAT 9 ATOM 89717 O WAT 10 81.691 86.687 84.258 1.00 0.00 O ATOM 89718 H1 WAT 10 82.542 87.124 84.232 1.00 0.00 H ATOM 89719 H2 WAT 10 81.880 85.815 84.603 1.00 0.00 H TER 89721 WAT 10 ATOM 89721 O WAT 11 33.252 106.084 123.286 1.00 0.00 O ATOM 89722 H1 WAT 11 32.725 106.425 124.008 1.00 0.00 H ATOM 89723 H2 WAT 11 34.157 106.248 123.552 1.00 0.00 H TER 89725 WAT 11 ATOM 89725 O WAT 12 26.090 74.704 134.197 1.00 0.00 O ATOM 89726 H1 WAT 12 25.772 73.843 134.469 1.00 0.00 H ATOM 89727 H2 WAT 12 26.332 74.590 133.278 1.00 0.00 H TER 89729 WAT 12 ATOM 89729 O WAT 13 144.016 137.553 123.024 1.00 0.00 O ATOM 89730 H1 WAT 13 144.600 137.418 123.770 1.00 0.00 H ATOM 89731 H2 WAT 13 143.138 137.419 123.379 1.00 0.00 H TER 89733 WAT 13 ATOM 89733 O WAT 14 46.507 93.027 88.064 1.00 0.00 O ATOM 89734 H1 WAT 14 46.092 92.206 87.798 1.00 0.00 H ATOM 89735 H2 WAT 14 47.418 92.790 88.239 1.00 0.00 H TER 89737 WAT 14 ATOM 89737 O WAT 15 139.084 81.966 75.172 1.00 0.00 O ATOM 89738 H1 WAT 15 139.500 81.131 74.960 1.00 0.00 H ATOM 89739 H2 WAT 15 138.514 82.146 74.424 1.00 0.00 H TER 89741 WAT 15 ATOM 89741 O WAT 16 137.509 71.720 14.543 1.00 0.00 O ATOM 89742 H1 WAT 16 138.440 71.541 14.413 1.00 0.00 H ATOM 89743 H2 WAT 16 137.265 71.186 15.299 1.00 0.00 H TER 89745 WAT 16 ATOM 89745 O WAT 17 89.276 40.562 91.856 1.00 0.00 O ATOM 89746 H1 WAT 17 88.749 41.234 92.287 1.00 0.00 H ATOM 89747 H2 WAT 17 90.145 40.651 92.248 1.00 0.00 H TER 89749 WAT 17 ATOM 89749 O WAT 18 136.888 60.672 9.988 1.00 0.00 O ATOM 89750 H1 WAT 18 136.321 61.131 9.369 1.00 0.00 H ATOM 89751 H2 WAT 18 137.651 60.416 9.470 1.00 0.00 H TER 89753 WAT 18 ATOM 89753 O WAT 19 41.913 83.077 80.061 1.00 0.00 O ATOM 89754 H1 WAT 19 42.489 83.055 80.825 1.00 0.00 H ATOM 89755 H2 WAT 19 42.415 83.547 79.395 1.00 0.00 H TER 89757 WAT 19 ATOM 89757 O WAT 20 82.459 114.940 72.270 1.00 0.00 O ATOM 89758 H1 WAT 20 81.641 115.183 71.836 1.00 0.00 H ATOM 89759 H2 WAT 20 82.267 115.016 73.205 1.00 0.00 H TER 89761 WAT 20 ATOM 89761 O WAT 21 28.626 9.128 104.854 1.00 0.00 O ATOM 89762 H1 WAT 21 27.771 8.907 104.482 1.00 0.00 H ATOM 89763 H2 WAT 21 28.635 8.693 105.706 1.00 0.00 H TER 89765 WAT 21 ATOM 89765 O WAT 22 73.170 120.280 117.307 1.00 0.00 O ATOM 89766 H1 WAT 22 72.924 120.736 116.502 1.00 0.00 H ATOM 89767 H2 WAT 22 72.509 119.595 117.405 1.00 0.00 H TER 89769 WAT 22 ATOM 89769 O WAT 23 81.623 102.491 114.530 1.00 0.00 O ATOM 89770 H1 WAT 23 82.376 102.146 114.051 1.00 0.00 H ATOM 89771 H2 WAT 23 81.316 103.225 113.998 1.00 0.00 H TER 89773 WAT 23 ATOM 89773 O WAT 24 58.957 28.289 102.795 1.00 0.00 O ATOM 89774 H1 WAT 24 58.466 29.015 102.410 1.00 0.00 H ATOM 89775 H2 WAT 24 58.869 28.414 103.740 1.00 0.00 H TER 89777 WAT 24 ATOM 89777 O WAT 25 16.136 50.283 99.067 1.00 0.00 O ATOM 89778 H1 WAT 25 16.682 49.564 99.386 1.00 0.00 H ATOM 89779 H2 WAT 25 16.194 50.222 98.114 1.00 0.00 H TER 89781 WAT 25 ATOM 89781 O WAT 26 11.231 41.222 157.230 1.00 0.00 O ATOM 89782 H1 WAT 26 12.099 41.576 157.040 1.00 0.00 H ATOM 89783 H2 WAT 26 11.339 40.273 157.165 1.00 0.00 H TER 89785 WAT 26 ATOM 89785 O WAT 27 78.080 40.319 22.229 1.00 0.00 O ATOM 89786 H1 WAT 27 78.744 40.281 22.917 1.00 0.00 H ATOM 89787 H2 WAT 27 78.242 39.540 21.697 1.00 0.00 H TER 89789 WAT 27 ATOM 89789 O WAT 28 33.488 110.322 105.470 1.00 0.00 O ATOM 89790 H1 WAT 28 34.054 109.800 106.038 1.00 0.00 H ATOM 89791 H2 WAT 28 32.955 110.840 106.073 1.00 0.00 H TER 89793 WAT 28 ATOM 89793 O WAT 29 120.361 44.768 151.576 1.00 0.00 O ATOM 89794 H1 WAT 29 119.586 44.891 151.029 1.00 0.00 H ATOM 89795 H2 WAT 29 120.678 45.655 151.745 1.00 0.00 H TER 89797 WAT 29 ATOM 89797 O WAT 30 128.474 95.821 127.358 1.00 0.00 O ATOM 89798 H1 WAT 30 128.082 96.618 126.999 1.00 0.00 H ATOM 89799 H2 WAT 30 128.700 96.051 128.259 1.00 0.00 H TER 89801 WAT 30 ATOM 89801 O WAT 31 117.609 131.266 103.160 1.00 0.00 O ATOM 89802 H1 WAT 31 117.774 132.046 103.690 1.00 0.00 H ATOM 89803 H2 WAT 31 118.186 130.599 103.530 1.00 0.00 H TER 89805 WAT 31 ATOM 89805 O WAT 32 84.971 75.413 88.247 1.00 0.00 O ATOM 89806 H1 WAT 32 84.945 76.361 88.118 1.00 0.00 H ATOM 89807 H2 WAT 32 84.470 75.058 87.513 1.00 0.00 H TER 89809 WAT 32 ATOM 89809 O WAT 33 20.174 42.737 148.566 1.00 0.00 O ATOM 89810 H1 WAT 33 20.851 42.969 149.200 1.00 0.00 H ATOM 89811 H2 WAT 33 20.034 43.537 148.060 1.00 0.00 H TER 89813 WAT 33 ATOM 89813 O WAT 34 57.838 1.726 77.225 1.00 0.00 O ATOM 89814 H1 WAT 34 57.943 1.190 76.439 1.00 0.00 H ATOM 89815 H2 WAT 34 57.218 1.237 77.766 1.00 0.00 H TER 89817 WAT 34 ATOM 89817 O WAT 35 11.944 99.269 102.676 1.00 0.00 O ATOM 89818 H1 WAT 35 12.261 98.567 103.244 1.00 0.00 H ATOM 89819 H2 WAT 35 11.019 99.065 102.537 1.00 0.00 H TER 89821 WAT 35 ATOM 89821 O WAT 36 108.451 67.737 15.241 1.00 0.00 O ATOM 89822 H1 WAT 36 108.183 67.403 16.096 1.00 0.00 H ATOM 89823 H2 WAT 36 108.531 68.683 15.367 1.00 0.00 H TER 89825 WAT 36 ATOM 89825 O WAT 37 67.732 51.407 85.392 1.00 0.00 O ATOM 89826 H1 WAT 37 67.168 51.463 84.621 1.00 0.00 H ATOM 89827 H2 WAT 37 67.681 52.276 85.790 1.00 0.00 H TER 89829 WAT 37 ATOM 89829 O WAT 38 22.708 86.513 133.302 1.00 0.00 O ATOM 89830 H1 WAT 38 23.201 87.332 133.267 1.00 0.00 H ATOM 89831 H2 WAT 38 23.097 85.970 132.616 1.00 0.00 H TER 89833 WAT 38 ATOM 89833 O WAT 39 108.746 121.075 13.202 1.00 0.00 O ATOM 89834 H1 WAT 39 108.893 122.020 13.240 1.00 0.00 H ATOM 89835 H2 WAT 39 108.275 120.874 14.010 1.00 0.00 H TER 89837 WAT 39 ATOM 89837 O WAT 40 49.407 82.878 69.998 1.00 0.00 O ATOM 89838 H1 WAT 40 50.286 82.727 70.347 1.00 0.00 H ATOM 89839 H2 WAT 40 48.838 82.864 70.767 1.00 0.00 H TER 89841 WAT 40 ATOM 89841 O WAT 41 22.787 140.044 143.386 1.00 0.00 O ATOM 89842 H1 WAT 41 21.975 139.650 143.705 1.00 0.00 H ATOM 89843 H2 WAT 41 22.500 140.784 142.850 1.00 0.00 H TER 89845 WAT 41 ATOM 89845 O WAT 42 18.799 9.925 153.729 1.00 0.00 O ATOM 89846 H1 WAT 42 19.693 10.248 153.618 1.00 0.00 H ATOM 89847 H2 WAT 42 18.906 9.030 154.051 1.00 0.00 H TER 89849 WAT 42 ATOM 89849 O WAT 43 87.181 108.107 152.164 1.00 0.00 O ATOM 89850 H1 WAT 43 86.326 108.236 152.574 1.00 0.00 H ATOM 89851 H2 WAT 43 86.979 107.827 151.271 1.00 0.00 H TER 89853 WAT 43 ATOM 89853 O WAT 44 32.044 99.330 59.490 1.00 0.00 O ATOM 89854 H1 WAT 44 32.784 98.795 59.775 1.00 0.00 H ATOM 89855 H2 WAT 44 31.641 98.825 58.783 1.00 0.00 H TER 89857 WAT 44 ATOM 89857 O WAT 45 45.936 119.553 106.775 1.00 0.00 O ATOM 89858 H1 WAT 45 46.750 120.046 106.873 1.00 0.00 H ATOM 89859 H2 WAT 45 45.553 119.547 107.653 1.00 0.00 H TER 89861 WAT 45 ATOM 89861 O WAT 46 30.554 47.146 123.485 1.00 0.00 O ATOM 89862 H1 WAT 46 30.123 46.721 124.227 1.00 0.00 H ATOM 89863 H2 WAT 46 31.355 46.641 123.351 1.00 0.00 H TER 89865 WAT 46 ATOM 89865 O WAT 47 71.810 134.734 12.383 1.00 0.00 O ATOM 89866 H1 WAT 47 71.582 134.461 13.271 1.00 0.00 H ATOM 89867 H2 WAT 47 71.004 135.117 12.036 1.00 0.00 H TER 89869 WAT 47 ATOM 89869 O WAT 48 114.501 34.716 60.994 1.00 0.00 O ATOM 89870 H1 WAT 48 113.648 34.726 60.558 1.00 0.00 H ATOM 89871 H2 WAT 48 115.136 34.719 60.277 1.00 0.00 H TER 89873 WAT 48 ATOM 89873 O WAT 49 96.581 107.189 76.809 1.00 0.00 O ATOM 89874 H1 WAT 49 97.182 106.513 76.495 1.00 0.00 H ATOM 89875 H2 WAT 49 97.058 107.624 77.516 1.00 0.00 H TER 89877 WAT 49 ATOM 89877 O WAT 50 128.710 13.700 74.206 1.00 0.00 O ATOM 89878 H1 WAT 50 127.914 13.762 73.678 1.00 0.00 H ATOM 89879 H2 WAT 50 128.868 14.595 74.506 1.00 0.00 H TER 89881 WAT 50 ATOM 89881 O WAT 51 20.772 143.445 9.865 1.00 0.00 O ATOM 89882 H1 WAT 51 20.856 144.374 9.652 1.00 0.00 H ATOM 89883 H2 WAT 51 21.500 143.027 9.404 1.00 0.00 H TER 89885 WAT 51 ATOM 89885 O WAT 52 71.713 20.684 129.113 1.00 0.00 O ATOM 89886 H1 WAT 52 72.067 19.808 128.959 1.00 0.00 H ATOM 89887 H2 WAT 52 70.787 20.538 129.307 1.00 0.00 H TER 89889 WAT 52 ATOM 89889 O WAT 53 36.627 79.340 83.180 1.00 0.00 O ATOM 89890 H1 WAT 53 36.440 78.497 82.765 1.00 0.00 H ATOM 89891 H2 WAT 53 36.662 79.962 82.453 1.00 0.00 H TER 89893 WAT 53 ATOM 89893 O WAT 54 35.783 123.024 3.331 1.00 0.00 O ATOM 89894 H1 WAT 54 35.660 123.908 2.983 1.00 0.00 H ATOM 89895 H2 WAT 54 36.724 122.960 3.494 1.00 0.00 H TER 89897 WAT 54 ATOM 89897 O WAT 55 102.640 36.690 90.715 1.00 0.00 O ATOM 89898 H1 WAT 55 102.331 37.592 90.798 1.00 0.00 H ATOM 89899 H2 WAT 55 103.536 36.712 91.051 1.00 0.00 H TER 89901 WAT 55 ATOM 89901 O WAT 56 32.297 54.884 1.304 1.00 0.00 O ATOM 89902 H1 WAT 56 32.541 54.535 2.161 1.00 0.00 H ATOM 89903 H2 WAT 56 31.341 54.934 1.330 1.00 0.00 H TER 89905 WAT 56 ATOM 89905 O WAT 57 85.698 73.320 116.808 1.00 0.00 O ATOM 89906 H1 WAT 57 85.778 74.032 116.173 1.00 0.00 H ATOM 89907 H2 WAT 57 84.891 72.869 116.562 1.00 0.00 H TER 89909 WAT 57 ATOM 89909 O WAT 58 83.544 36.153 94.182 1.00 0.00 O ATOM 89910 H1 WAT 58 82.681 35.830 93.920 1.00 0.00 H ATOM 89911 H2 WAT 58 83.403 36.538 95.047 1.00 0.00 H TER 89913 WAT 58 ATOM 89913 O WAT 59 94.783 13.274 106.674 1.00 0.00 O ATOM 89914 H1 WAT 59 94.588 13.944 107.329 1.00 0.00 H ATOM 89915 H2 WAT 59 95.219 13.750 105.967 1.00 0.00 H TER 89917 WAT 59 ATOM 89917 O WAT 60 54.292 21.625 130.258 1.00 0.00 O ATOM 89918 H1 WAT 60 54.238 20.681 130.110 1.00 0.00 H ATOM 89919 H2 WAT 60 53.381 21.908 130.336 1.00 0.00 H TER 89921 WAT 60 ATOM 89921 O WAT 61 93.650 41.273 21.609 1.00 0.00 O ATOM 89922 H1 WAT 61 92.936 41.208 22.243 1.00 0.00 H ATOM 89923 H2 WAT 61 94.437 41.061 22.111 1.00 0.00 H TER 89925 WAT 61 ATOM 89925 O WAT 62 122.277 123.369 77.866 1.00 0.00 O ATOM 89926 H1 WAT 62 122.462 122.435 77.966 1.00 0.00 H ATOM 89927 H2 WAT 62 122.318 123.718 78.756 1.00 0.00 H TER 89929 WAT 62 ATOM 89929 O WAT 63 66.151 79.098 111.428 1.00 0.00 O ATOM 89930 H1 WAT 63 65.773 79.904 111.780 1.00 0.00 H ATOM 89931 H2 WAT 63 66.032 79.172 110.481 1.00 0.00 H TER 89933 WAT 63 ATOM 89933 O WAT 64 39.718 117.523 140.854 1.00 0.00 O ATOM 89934 H1 WAT 64 39.149 118.246 140.591 1.00 0.00 H ATOM 89935 H2 WAT 64 40.585 117.920 140.943 1.00 0.00 H TER 89937 WAT 64 ATOM 89937 O WAT 65 74.583 26.602 54.410 1.00 0.00 O ATOM 89938 H1 WAT 65 74.033 26.601 55.194 1.00 0.00 H ATOM 89939 H2 WAT 65 75.145 27.370 54.513 1.00 0.00 H TER 89941 WAT 65 ATOM 89941 O WAT 66 66.377 45.238 17.517 1.00 0.00 O ATOM 89942 H1 WAT 66 66.796 45.331 16.661 1.00 0.00 H ATOM 89943 H2 WAT 66 66.442 44.303 17.714 1.00 0.00 H TER 89945 WAT 66 ATOM 89945 O WAT 67 69.212 48.423 110.362 1.00 0.00 O ATOM 89946 H1 WAT 67 69.885 48.871 110.875 1.00 0.00 H ATOM 89947 H2 WAT 67 69.065 47.600 110.827 1.00 0.00 H TER 89949 WAT 67 ATOM 89949 O WAT 68 125.159 74.344 117.760 1.00 0.00 O ATOM 89950 H1 WAT 68 125.232 74.091 116.840 1.00 0.00 H ATOM 89951 H2 WAT 68 125.133 73.514 118.235 1.00 0.00 H TER 89953 WAT 68 ATOM 89953 O WAT 69 50.796 133.093 157.111 1.00 0.00 O ATOM 89954 H1 WAT 69 50.712 133.985 157.447 1.00 0.00 H ATOM 89955 H2 WAT 69 50.631 133.173 156.172 1.00 0.00 H TER 89957 WAT 69 ATOM 89957 O WAT 70 8.927 102.814 102.660 1.00 0.00 O ATOM 89958 H1 WAT 70 9.113 103.457 101.975 1.00 0.00 H ATOM 89959 H2 WAT 70 9.781 102.626 103.049 1.00 0.00 H TER 89961 WAT 70 ATOM 89961 O WAT 71 140.058 42.267 100.253 1.00 0.00 O ATOM 89962 H1 WAT 71 139.160 42.091 100.534 1.00 0.00 H ATOM 89963 H2 WAT 71 140.517 42.510 101.057 1.00 0.00 H TER 89965 WAT 71 ATOM 89965 O WAT 72 88.962 144.564 147.860 1.00 0.00 O ATOM 89966 H1 WAT 72 89.318 144.434 148.740 1.00 0.00 H ATOM 89967 H2 WAT 72 89.346 143.857 147.341 1.00 0.00 H TER 89969 WAT 72 ATOM 89969 O WAT 73 89.930 71.779 150.112 1.00 0.00 O ATOM 89970 H1 WAT 73 90.040 71.994 149.186 1.00 0.00 H ATOM 89971 H2 WAT 73 89.151 71.223 150.138 1.00 0.00 H TER 89973 WAT 73 ATOM 89973 O WAT 74 2.437 122.265 15.791 1.00 0.00 O ATOM 89974 H1 WAT 74 2.690 122.692 14.973 1.00 0.00 H ATOM 89975 H2 WAT 74 1.551 122.582 15.963 1.00 0.00 H TER 89977 WAT 74 ATOM 89977 O WAT 75 99.943 6.193 125.568 1.00 0.00 O ATOM 89978 H1 WAT 75 99.188 6.565 126.024 1.00 0.00 H ATOM 89979 H2 WAT 75 99.920 5.261 125.787 1.00 0.00 H TER 89981 WAT 75 ATOM 89981 O WAT 76 1.892 120.850 80.063 1.00 0.00 O ATOM 89982 H1 WAT 76 2.588 121.467 80.290 1.00 0.00 H ATOM 89983 H2 WAT 76 1.102 121.226 80.452 1.00 0.00 H TER 89985 WAT 76 ATOM 89985 O WAT 77 55.953 76.409 13.232 1.00 0.00 O ATOM 89986 H1 WAT 77 55.187 76.039 12.792 1.00 0.00 H ATOM 89987 H2 WAT 77 55.613 76.751 14.058 1.00 0.00 H TER 89989 WAT 77 ATOM 89989 O WAT 78 16.898 144.768 16.000 1.00 0.00 O ATOM 89990 H1 WAT 78 17.784 144.669 15.651 1.00 0.00 H ATOM 89991 H2 WAT 78 17.023 144.882 16.942 1.00 0.00 H TER 89993 WAT 78 ATOM 89993 O WAT 79 48.615 110.719 75.231 1.00 0.00 O ATOM 89994 H1 WAT 79 47.993 111.015 74.567 1.00 0.00 H ATOM 89995 H2 WAT 79 49.360 111.313 75.143 1.00 0.00 H TER 89997 WAT 79 ATOM 89997 O WAT 80 77.374 26.122 109.491 1.00 0.00 O ATOM 89998 H1 WAT 80 77.418 26.664 110.278 1.00 0.00 H ATOM 89999 H2 WAT 80 78.283 26.040 109.205 1.00 0.00 H TER 90001 WAT 80 ATOM 90001 O WAT 81 54.695 52.585 138.881 1.00 0.00 O ATOM 90002 H1 WAT 81 55.497 52.434 139.381 1.00 0.00 H ATOM 90003 H2 WAT 81 54.998 52.910 138.033 1.00 0.00 H TER 90005 WAT 81 ATOM 90005 O WAT 82 17.686 81.165 78.789 1.00 0.00 O ATOM 90006 H1 WAT 82 16.860 81.647 78.736 1.00 0.00 H ATOM 90007 H2 WAT 82 17.425 80.245 78.813 1.00 0.00 H TER 90009 WAT 82 ATOM 90009 O WAT 83 78.405 115.766 150.471 1.00 0.00 O ATOM 90010 H1 WAT 83 79.016 116.502 150.488 1.00 0.00 H ATOM 90011 H2 WAT 83 78.870 115.059 150.918 1.00 0.00 H TER 90013 WAT 83 ATOM 90013 O WAT 84 118.832 134.342 84.540 1.00 0.00 O ATOM 90014 H1 WAT 84 118.304 134.256 83.746 1.00 0.00 H ATOM 90015 H2 WAT 84 119.360 133.544 84.564 1.00 0.00 H TER 90017 WAT 84 ATOM 90017 O WAT 85 33.998 145.517 135.454 1.00 0.00 O ATOM 90018 H1 WAT 85 34.338 145.890 136.268 1.00 0.00 H ATOM 90019 H2 WAT 85 33.645 144.665 135.710 1.00 0.00 H TER 90021 WAT 85 ATOM 90021 O WAT 86 109.010 47.779 145.034 1.00 0.00 O ATOM 90022 H1 WAT 86 109.878 48.045 144.730 1.00 0.00 H ATOM 90023 H2 WAT 86 109.162 46.960 145.506 1.00 0.00 H TER 90025 WAT 86 ATOM 90025 O WAT 87 42.241 134.850 67.191 1.00 0.00 O ATOM 90026 H1 WAT 87 42.104 133.903 67.214 1.00 0.00 H ATOM 90027 H2 WAT 87 41.710 135.187 67.912 1.00 0.00 H TER 90029 WAT 87 ATOM 90029 O WAT 88 17.773 88.214 157.777 1.00 0.00 O ATOM 90030 H1 WAT 88 18.560 87.982 158.270 1.00 0.00 H ATOM 90031 H2 WAT 88 17.721 87.555 157.085 1.00 0.00 H TER 90033 WAT 88 ATOM 90033 O WAT 89 30.818 132.019 86.563 1.00 0.00 O ATOM 90034 H1 WAT 89 31.607 131.985 86.023 1.00 0.00 H ATOM 90035 H2 WAT 89 30.183 132.499 86.031 1.00 0.00 H TER 90037 WAT 89 ATOM 90037 O WAT 90 26.796 44.483 74.450 1.00 0.00 O ATOM 90038 H1 WAT 90 26.152 43.774 74.432 1.00 0.00 H ATOM 90039 H2 WAT 90 27.609 44.060 74.727 1.00 0.00 H TER 90041 WAT 90 ATOM 90041 O WAT 91 12.769 110.849 123.133 1.00 0.00 O ATOM 90042 H1 WAT 91 13.040 110.408 123.938 1.00 0.00 H ATOM 90043 H2 WAT 91 12.446 110.145 122.571 1.00 0.00 H TER 90045 WAT 91 ATOM 90045 O WAT 92 99.178 5.973 70.326 1.00 0.00 O ATOM 90046 H1 WAT 92 99.468 5.079 70.512 1.00 0.00 H ATOM 90047 H2 WAT 92 99.949 6.401 69.954 1.00 0.00 H TER 90049 WAT 92 ATOM 90049 O WAT 93 28.151 1.367 127.122 1.00 0.00 O ATOM 90050 H1 WAT 93 28.202 0.422 126.977 1.00 0.00 H ATOM 90051 H2 WAT 93 27.460 1.473 127.776 1.00 0.00 H TER 90053 WAT 93 ATOM 90053 O WAT 94 94.611 0.578 81.995 1.00 0.00 O ATOM 90054 H1 WAT 94 95.095 0.158 81.283 1.00 0.00 H ATOM 90055 H2 WAT 94 94.296 -0.149 82.532 1.00 0.00 H TER 90057 WAT 94 ATOM 90057 O WAT 95 99.874 77.546 140.230 1.00 0.00 O ATOM 90058 H1 WAT 95 99.051 77.952 139.959 1.00 0.00 H ATOM 90059 H2 WAT 95 100.522 77.883 139.612 1.00 0.00 H TER 90061 WAT 95 ATOM 90061 O WAT 96 40.568 57.235 6.705 1.00 0.00 O ATOM 90062 H1 WAT 96 41.226 56.568 6.902 1.00 0.00 H ATOM 90063 H2 WAT 96 40.321 57.587 7.559 1.00 0.00 H TER 90065 WAT 96 ATOM 90065 O WAT 97 78.783 97.322 122.567 1.00 0.00 O ATOM 90066 H1 WAT 97 78.891 97.361 121.617 1.00 0.00 H ATOM 90067 H2 WAT 97 78.134 97.998 122.762 1.00 0.00 H TER 90069 WAT 97 ATOM 90069 O WAT 98 15.492 30.613 138.694 1.00 0.00 O ATOM 90070 H1 WAT 98 15.600 29.799 139.187 1.00 0.00 H ATOM 90071 H2 WAT 98 15.327 30.329 137.795 1.00 0.00 H TER 90073 WAT 98 ATOM 90073 O WAT 99 137.966 82.667 97.893 1.00 0.00 O ATOM 90074 H1 WAT 99 137.737 82.817 98.811 1.00 0.00 H ATOM 90075 H2 WAT 99 137.154 82.832 97.414 1.00 0.00 H TER 90077 WAT 99 ATOM 90077 O WAT 100 16.442 51.304 13.830 1.00 0.00 O ATOM 90078 H1 WAT 100 15.659 51.655 14.253 1.00 0.00 H ATOM 90079 H2 WAT 100 16.582 50.455 14.251 1.00 0.00 H TER 90081 WAT 100 ATOM 90081 O WAT 101 51.705 37.237 104.786 1.00 0.00 O ATOM 90082 H1 WAT 101 52.217 36.882 105.512 1.00 0.00 H ATOM 90083 H2 WAT 101 51.777 36.578 104.096 1.00 0.00 H TER 90085 WAT 101 ATOM 90085 O WAT 102 64.005 120.418 16.994 1.00 0.00 O ATOM 90086 H1 WAT 102 64.102 119.575 16.551 1.00 0.00 H ATOM 90087 H2 WAT 102 64.077 120.209 17.925 1.00 0.00 H TER 90089 WAT 102 ATOM 90089 O WAT 103 145.446 34.250 123.321 1.00 0.00 O ATOM 90090 H1 WAT 103 145.696 33.463 123.805 1.00 0.00 H ATOM 90091 H2 WAT 103 144.511 34.352 123.498 1.00 0.00 H TER 90093 WAT 103 ATOM 90093 O WAT 104 136.950 102.226 93.552 1.00 0.00 O ATOM 90094 H1 WAT 104 137.143 102.544 92.670 1.00 0.00 H ATOM 90095 H2 WAT 104 136.154 102.694 93.807 1.00 0.00 H TER 90097 WAT 104 ATOM 90097 O WAT 105 31.044 1.272 7.143 1.00 0.00 O ATOM 90098 H1 WAT 105 30.376 0.587 7.161 1.00 0.00 H ATOM 90099 H2 WAT 105 31.645 1.039 7.851 1.00 0.00 H TER 90101 WAT 105 ATOM 90101 O WAT 106 66.972 112.873 147.928 1.00 0.00 O ATOM 90102 H1 WAT 106 66.479 112.967 147.113 1.00 0.00 H ATOM 90103 H2 WAT 106 67.357 113.737 148.076 1.00 0.00 H TER 90105 WAT 106 ATOM 90105 O WAT 107 40.954 104.819 69.428 1.00 0.00 O ATOM 90106 H1 WAT 107 40.175 104.268 69.502 1.00 0.00 H ATOM 90107 H2 WAT 107 40.712 105.492 68.792 1.00 0.00 H TER 90109 WAT 107 ATOM 90109 O WAT 108 72.105 83.192 151.685 1.00 0.00 O ATOM 90110 H1 WAT 108 71.735 82.310 151.658 1.00 0.00 H ATOM 90111 H2 WAT 108 71.365 83.768 151.491 1.00 0.00 H TER 90113 WAT 108 ATOM 90113 O WAT 109 138.849 120.351 129.148 1.00 0.00 O ATOM 90114 H1 WAT 109 138.824 120.937 129.905 1.00 0.00 H ATOM 90115 H2 WAT 109 139.275 120.864 128.462 1.00 0.00 H TER 90117 WAT 109 ATOM 90117 O WAT 110 104.954 50.385 98.933 1.00 0.00 O ATOM 90118 H1 WAT 110 104.317 50.800 98.351 1.00 0.00 H ATOM 90119 H2 WAT 110 105.144 49.543 98.519 1.00 0.00 H TER 90121 WAT 110 ATOM 90121 O WAT 111 92.623 15.366 102.542 1.00 0.00 O ATOM 90122 H1 WAT 111 93.149 15.839 103.187 1.00 0.00 H ATOM 90123 H2 WAT 111 92.861 15.762 101.703 1.00 0.00 H TER 90125 WAT 111 ATOM 90125 O WAT 112 11.739 59.066 146.784 1.00 0.00 O ATOM 90126 H1 WAT 112 11.463 58.150 146.795 1.00 0.00 H ATOM 90127 H2 WAT 112 11.528 59.390 147.660 1.00 0.00 H TER 90129 WAT 112 ATOM 90129 O WAT 113 76.399 106.973 121.050 1.00 0.00 O ATOM 90130 H1 WAT 113 76.169 106.960 121.979 1.00 0.00 H ATOM 90131 H2 WAT 113 75.908 106.245 120.671 1.00 0.00 H TER 90133 WAT 113 ATOM 90133 O WAT 114 34.904 116.503 55.789 1.00 0.00 O ATOM 90134 H1 WAT 114 34.158 116.154 55.300 1.00 0.00 H ATOM 90135 H2 WAT 114 35.293 115.738 56.212 1.00 0.00 H TER 90137 WAT 114 ATOM 90137 O WAT 115 47.315 19.036 10.213 1.00 0.00 O ATOM 90138 H1 WAT 115 47.506 18.101 10.139 1.00 0.00 H ATOM 90139 H2 WAT 115 47.459 19.238 11.137 1.00 0.00 H TER 90141 WAT 115 ATOM 90141 O WAT 116 96.147 33.188 71.863 1.00 0.00 O ATOM 90142 H1 WAT 116 96.066 32.335 72.290 1.00 0.00 H ATOM 90143 H2 WAT 116 97.063 33.232 71.588 1.00 0.00 H TER 90145 WAT 116 ATOM 90145 O WAT 117 138.606 83.669 87.955 1.00 0.00 O ATOM 90146 H1 WAT 117 138.557 84.624 87.902 1.00 0.00 H ATOM 90147 H2 WAT 117 138.034 83.361 87.251 1.00 0.00 H TER 90149 WAT 117 ATOM 90149 O WAT 118 140.705 95.525 29.535 1.00 0.00 O ATOM 90150 H1 WAT 118 140.547 95.319 28.614 1.00 0.00 H ATOM 90151 H2 WAT 118 140.152 94.911 30.017 1.00 0.00 H TER 90153 WAT 118 ATOM 90153 O WAT 119 6.646 86.845 144.331 1.00 0.00 O ATOM 90154 H1 WAT 119 6.970 87.084 143.463 1.00 0.00 H ATOM 90155 H2 WAT 119 7.180 86.094 144.589 1.00 0.00 H TER 90157 WAT 119 ATOM 90157 O WAT 120 7.209 53.846 93.789 1.00 0.00 O ATOM 90158 H1 WAT 120 7.956 54.393 93.544 1.00 0.00 H ATOM 90159 H2 WAT 120 7.382 53.598 94.697 1.00 0.00 H TER 90161 WAT 120 ATOM 90161 O WAT 121 108.575 33.981 100.174 1.00 0.00 O ATOM 90162 H1 WAT 121 108.496 34.875 99.840 1.00 0.00 H ATOM 90163 H2 WAT 121 109.508 33.876 100.360 1.00 0.00 H TER 90165 WAT 121 ATOM 90165 O WAT 122 53.094 80.171 122.602 1.00 0.00 O ATOM 90166 H1 WAT 122 52.814 81.060 122.384 1.00 0.00 H ATOM 90167 H2 WAT 122 53.946 80.285 123.023 1.00 0.00 H TER 90169 WAT 122 ATOM 90169 O WAT 123 124.660 38.546 113.649 1.00 0.00 O ATOM 90170 H1 WAT 123 124.665 38.923 114.529 1.00 0.00 H ATOM 90171 H2 WAT 123 124.745 37.603 113.792 1.00 0.00 H TER 90173 WAT 123 ATOM 90173 O WAT 124 28.921 23.637 110.832 1.00 0.00 O ATOM 90174 H1 WAT 124 28.150 23.581 110.268 1.00 0.00 H ATOM 90175 H2 WAT 124 29.662 23.629 110.227 1.00 0.00 H TER 90177 WAT 124 ATOM 90177 O WAT 125 97.383 94.310 5.912 1.00 0.00 O ATOM 90178 H1 WAT 125 97.992 93.572 5.916 1.00 0.00 H ATOM 90179 H2 WAT 125 96.749 94.102 6.597 1.00 0.00 H TER 90181 WAT 125 ATOM 90181 O WAT 126 72.016 105.800 152.177 1.00 0.00 O ATOM 90182 H1 WAT 126 71.269 105.647 152.755 1.00 0.00 H ATOM 90183 H2 WAT 126 71.690 106.417 151.522 1.00 0.00 H TER 90185 WAT 126 ATOM 90185 O WAT 127 58.333 21.233 131.747 1.00 0.00 O ATOM 90186 H1 WAT 127 58.011 21.747 131.007 1.00 0.00 H ATOM 90187 H2 WAT 127 59.224 21.552 131.891 1.00 0.00 H TER 90189 WAT 127 ATOM 90189 O WAT 128 46.030 81.038 133.912 1.00 0.00 O ATOM 90190 H1 WAT 128 45.859 81.880 133.490 1.00 0.00 H ATOM 90191 H2 WAT 128 46.388 81.268 134.769 1.00 0.00 H TER 90193 WAT 128 ATOM 90193 O WAT 129 32.772 63.768 80.726 1.00 0.00 O ATOM 90194 H1 WAT 129 32.968 62.851 80.533 1.00 0.00 H ATOM 90195 H2 WAT 129 32.117 64.015 80.073 1.00 0.00 H TER 90197 WAT 129 ATOM 90197 O WAT 130 102.656 36.753 98.207 1.00 0.00 O ATOM 90198 H1 WAT 130 102.654 36.371 99.085 1.00 0.00 H ATOM 90199 H2 WAT 130 102.697 37.698 98.358 1.00 0.00 H TER 90201 WAT 130 ATOM 90201 O WAT 131 68.113 19.142 100.886 1.00 0.00 O ATOM 90202 H1 WAT 131 68.137 19.828 101.553 1.00 0.00 H ATOM 90203 H2 WAT 131 68.998 19.131 100.522 1.00 0.00 H TER 90205 WAT 131 ATOM 90205 O WAT 132 111.846 127.548 144.974 1.00 0.00 O ATOM 90206 H1 WAT 132 110.979 127.372 144.608 1.00 0.00 H ATOM 90207 H2 WAT 132 111.693 128.220 145.639 1.00 0.00 H TER 90209 WAT 132 ATOM 90209 O WAT 133 57.063 138.504 2.371 1.00 0.00 O ATOM 90210 H1 WAT 133 57.427 138.894 3.166 1.00 0.00 H ATOM 90211 H2 WAT 133 57.637 137.762 2.183 1.00 0.00 H TER 90213 WAT 133 ATOM 90213 O WAT 134 32.739 36.727 109.742 1.00 0.00 O ATOM 90214 H1 WAT 134 33.088 35.967 110.208 1.00 0.00 H ATOM 90215 H2 WAT 134 33.218 37.472 110.105 1.00 0.00 H TER 90217 WAT 134 ATOM 90217 O WAT 135 93.514 34.381 3.779 1.00 0.00 O ATOM 90218 H1 WAT 135 93.425 35.324 3.911 1.00 0.00 H ATOM 90219 H2 WAT 135 93.480 34.011 4.661 1.00 0.00 H TER 90221 WAT 135 ATOM 90221 O WAT 136 82.342 143.464 117.799 1.00 0.00 O ATOM 90222 H1 WAT 136 82.650 142.657 118.212 1.00 0.00 H ATOM 90223 H2 WAT 136 81.945 143.177 116.977 1.00 0.00 H TER 90225 WAT 136 ATOM 90225 O WAT 137 4.704 58.401 64.282 1.00 0.00 O ATOM 90226 H1 WAT 137 3.992 57.975 63.806 1.00 0.00 H ATOM 90227 H2 WAT 137 4.913 57.794 64.992 1.00 0.00 H TER 90229 WAT 137 ATOM 90229 O WAT 138 110.415 58.061 147.194 1.00 0.00 O ATOM 90230 H1 WAT 138 111.210 57.598 146.931 1.00 0.00 H ATOM 90231 H2 WAT 138 109.863 58.054 146.412 1.00 0.00 H TER 90233 WAT 138 ATOM 90233 O WAT 139 47.712 28.231 80.997 1.00 0.00 O ATOM 90234 H1 WAT 139 47.986 28.634 81.821 1.00 0.00 H ATOM 90235 H2 WAT 139 48.225 27.425 80.943 1.00 0.00 H TER 90237 WAT 139 ATOM 90237 O WAT 140 84.224 63.360 112.408 1.00 0.00 O ATOM 90238 H1 WAT 140 85.118 63.594 112.659 1.00 0.00 H ATOM 90239 H2 WAT 140 84.112 62.465 112.729 1.00 0.00 H TER 90241 WAT 140 ATOM 90241 O WAT 141 30.505 112.755 146.850 1.00 0.00 O ATOM 90242 H1 WAT 141 30.716 113.283 147.621 1.00 0.00 H ATOM 90243 H2 WAT 141 29.649 113.076 146.568 1.00 0.00 H TER 90245 WAT 141 ATOM 90245 O WAT 142 75.966 58.041 71.608 1.00 0.00 O ATOM 90246 H1 WAT 142 75.587 57.173 71.744 1.00 0.00 H ATOM 90247 H2 WAT 142 76.421 57.976 70.768 1.00 0.00 H TER 90249 WAT 142 ATOM 90249 O WAT 143 25.270 62.402 127.568 1.00 0.00 O ATOM 90250 H1 WAT 143 25.317 63.218 128.066 1.00 0.00 H ATOM 90251 H2 WAT 143 26.122 61.988 127.706 1.00 0.00 H TER 90253 WAT 143 ATOM 90253 O WAT 144 112.888 91.007 7.854 1.00 0.00 O ATOM 90254 H1 WAT 144 113.332 91.302 7.059 1.00 0.00 H ATOM 90255 H2 WAT 144 112.394 91.771 8.151 1.00 0.00 H TER 90257 WAT 144 ATOM 90257 O WAT 145 35.348 118.527 84.004 1.00 0.00 O ATOM 90258 H1 WAT 145 35.047 117.893 83.354 1.00 0.00 H ATOM 90259 H2 WAT 145 35.650 119.274 83.488 1.00 0.00 H TER 90261 WAT 145 ATOM 90261 O WAT 146 97.753 31.638 17.928 1.00 0.00 O ATOM 90262 H1 WAT 146 97.768 32.016 17.048 1.00 0.00 H ATOM 90263 H2 WAT 146 98.638 31.296 18.056 1.00 0.00 H TER 90265 WAT 146 ATOM 90265 O WAT 147 116.121 69.929 59.766 1.00 0.00 O ATOM 90266 H1 WAT 147 116.538 70.191 60.586 1.00 0.00 H ATOM 90267 H2 WAT 147 116.849 69.801 59.157 1.00 0.00 H TER 90269 WAT 147 ATOM 90269 O WAT 148 73.809 53.483 117.825 1.00 0.00 O ATOM 90270 H1 WAT 148 73.169 53.035 117.272 1.00 0.00 H ATOM 90271 H2 WAT 148 74.492 52.831 117.978 1.00 0.00 H TER 90273 WAT 148 ATOM 90273 O WAT 149 25.013 29.827 149.323 1.00 0.00 O ATOM 90274 H1 WAT 149 24.982 30.106 150.238 1.00 0.00 H ATOM 90275 H2 WAT 149 24.146 29.458 149.155 1.00 0.00 H TER 90277 WAT 149 ATOM 90277 O WAT 150 36.410 18.464 72.047 1.00 0.00 O ATOM 90278 H1 WAT 150 35.467 18.626 72.075 1.00 0.00 H ATOM 90279 H2 WAT 150 36.721 18.992 71.312 1.00 0.00 H TER 90281 WAT 150 ATOM 90281 O WAT 151 111.918 105.387 129.984 1.00 0.00 O ATOM 90282 H1 WAT 151 111.748 104.562 130.439 1.00 0.00 H ATOM 90283 H2 WAT 151 111.096 105.872 130.051 1.00 0.00 H TER 90285 WAT 151 ATOM 90285 O WAT 152 78.335 107.208 82.916 1.00 0.00 O ATOM 90286 H1 WAT 152 78.296 106.884 82.016 1.00 0.00 H ATOM 90287 H2 WAT 152 79.264 107.385 83.066 1.00 0.00 H TER 90289 WAT 152 ATOM 90289 O WAT 153 95.950 63.349 94.581 1.00 0.00 O ATOM 90290 H1 WAT 153 96.058 62.399 94.542 1.00 0.00 H ATOM 90291 H2 WAT 153 95.636 63.590 93.709 1.00 0.00 H TER 90293 WAT 153 ATOM 90293 O WAT 154 46.359 128.830 108.863 1.00 0.00 O ATOM 90294 H1 WAT 154 45.684 128.484 109.448 1.00 0.00 H ATOM 90295 H2 WAT 154 46.225 128.361 108.039 1.00 0.00 H TER 90297 WAT 154 ATOM 90297 O WAT 155 62.141 -0.101 71.231 1.00 0.00 O ATOM 90298 H1 WAT 155 62.511 0.014 70.355 1.00 0.00 H ATOM 90299 H2 WAT 155 62.849 0.149 71.824 1.00 0.00 H TER 90301 WAT 155 ATOM 90301 O WAT 156 105.101 113.462 119.199 1.00 0.00 O ATOM 90302 H1 WAT 156 105.182 112.731 119.812 1.00 0.00 H ATOM 90303 H2 WAT 156 105.208 113.063 118.335 1.00 0.00 H TER 90305 WAT 156 ATOM 90305 O WAT 157 52.823 98.366 68.708 1.00 0.00 O ATOM 90306 H1 WAT 157 53.644 98.280 69.193 1.00 0.00 H ATOM 90307 H2 WAT 157 52.226 97.752 69.135 1.00 0.00 H TER 90309 WAT 157 ATOM 90309 O WAT 158 82.456 122.412 130.331 1.00 0.00 O ATOM 90310 H1 WAT 158 83.209 121.822 130.294 1.00 0.00 H ATOM 90311 H2 WAT 158 81.743 121.916 129.929 1.00 0.00 H TER 90313 WAT 158 ATOM 90313 O WAT 159 105.505 41.729 72.141 1.00 0.00 O ATOM 90314 H1 WAT 159 104.579 41.501 72.060 1.00 0.00 H ATOM 90315 H2 WAT 159 105.904 40.966 72.558 1.00 0.00 H TER 90317 WAT 159 ATOM 90317 O WAT 160 142.090 136.160 143.371 1.00 0.00 O ATOM 90318 H1 WAT 160 141.786 136.726 142.661 1.00 0.00 H ATOM 90319 H2 WAT 160 142.976 135.907 143.112 1.00 0.00 H TER 90321 WAT 160 ATOM 90321 O WAT 161 75.628 50.038 91.922 1.00 0.00 O ATOM 90322 H1 WAT 161 76.083 50.743 91.461 1.00 0.00 H ATOM 90323 H2 WAT 161 76.329 49.468 92.240 1.00 0.00 H TER 90325 WAT 161 ATOM 90325 O WAT 162 27.528 18.454 81.038 1.00 0.00 O ATOM 90326 H1 WAT 162 28.235 19.097 80.989 1.00 0.00 H ATOM 90327 H2 WAT 162 27.531 18.162 81.950 1.00 0.00 H TER 90329 WAT 162 ATOM 90329 O WAT 163 34.400 101.829 138.540 1.00 0.00 O ATOM 90330 H1 WAT 163 33.771 101.430 139.142 1.00 0.00 H ATOM 90331 H2 WAT 163 35.201 101.918 139.056 1.00 0.00 H TER 90333 WAT 163 ATOM 90333 O WAT 164 107.577 43.903 142.738 1.00 0.00 O ATOM 90334 H1 WAT 164 107.681 44.854 142.772 1.00 0.00 H ATOM 90335 H2 WAT 164 108.342 43.561 143.200 1.00 0.00 H TER 90337 WAT 164 ATOM 90337 O WAT 165 121.724 27.984 124.274 1.00 0.00 O ATOM 90338 H1 WAT 165 121.397 27.359 124.922 1.00 0.00 H ATOM 90339 H2 WAT 165 122.487 28.384 124.691 1.00 0.00 H TER 90341 WAT 165 ATOM 90341 O WAT 166 127.352 14.887 111.548 1.00 0.00 O ATOM 90342 H1 WAT 166 128.179 15.050 112.002 1.00 0.00 H ATOM 90343 H2 WAT 166 127.595 14.352 110.792 1.00 0.00 H TER 90345 WAT 166 ATOM 90345 O WAT 167 17.383 2.375 104.773 1.00 0.00 O ATOM 90346 H1 WAT 167 18.175 2.862 104.999 1.00 0.00 H ATOM 90347 H2 WAT 167 17.411 2.302 103.819 1.00 0.00 H TER 90349 WAT 167 ATOM 90349 O WAT 168 68.935 111.764 116.491 1.00 0.00 O ATOM 90350 H1 WAT 168 68.506 112.215 117.218 1.00 0.00 H ATOM 90351 H2 WAT 168 68.223 111.318 116.033 1.00 0.00 H TER 90353 WAT 168 ATOM 90353 O WAT 169 71.794 115.724 83.594 1.00 0.00 O ATOM 90354 H1 WAT 169 72.681 116.028 83.788 1.00 0.00 H ATOM 90355 H2 WAT 169 71.357 116.487 83.216 1.00 0.00 H TER 90357 WAT 169 ATOM 90357 O WAT 170 118.647 67.673 127.224 1.00 0.00 O ATOM 90358 H1 WAT 170 117.976 68.064 126.664 1.00 0.00 H ATOM 90359 H2 WAT 170 119.131 68.421 127.574 1.00 0.00 H TER 90361 WAT 170 ATOM 90361 O WAT 171 47.392 110.298 159.056 1.00 0.00 O ATOM 90362 H1 WAT 171 47.821 110.149 158.213 1.00 0.00 H ATOM 90363 H2 WAT 171 46.536 110.661 158.829 1.00 0.00 H TER 90365 WAT 171 ATOM 90365 O WAT 172 11.226 94.131 83.872 1.00 0.00 O ATOM 90366 H1 WAT 172 11.314 93.444 83.211 1.00 0.00 H ATOM 90367 H2 WAT 172 10.957 94.905 83.378 1.00 0.00 H TER 90369 WAT 172 ATOM 90369 O WAT 173 44.505 57.163 59.432 1.00 0.00 O ATOM 90370 H1 WAT 173 43.749 56.863 58.928 1.00 0.00 H ATOM 90371 H2 WAT 173 44.892 57.855 58.895 1.00 0.00 H TER 90373 WAT 173 ATOM 90373 O WAT 174 118.203 77.078 65.622 1.00 0.00 O ATOM 90374 H1 WAT 174 118.353 76.199 65.273 1.00 0.00 H ATOM 90375 H2 WAT 174 117.251 77.169 65.642 1.00 0.00 H TER 90377 WAT 174 ATOM 90377 O WAT 175 5.670 69.111 93.925 1.00 0.00 O ATOM 90378 H1 WAT 175 6.608 68.918 93.904 1.00 0.00 H ATOM 90379 H2 WAT 175 5.252 68.292 93.658 1.00 0.00 H TER 90381 WAT 175 ATOM 90381 O WAT 176 108.695 144.570 91.073 1.00 0.00 O ATOM 90382 H1 WAT 176 109.001 144.707 90.176 1.00 0.00 H ATOM 90383 H2 WAT 176 109.287 143.908 91.430 1.00 0.00 H TER 90385 WAT 176 ATOM 90385 O WAT 177 95.015 28.358 11.018 1.00 0.00 O ATOM 90386 H1 WAT 177 94.676 27.640 11.553 1.00 0.00 H ATOM 90387 H2 WAT 177 95.288 27.940 10.201 1.00 0.00 H TER 90389 WAT 177 ATOM 90389 O WAT 178 1.367 100.241 129.042 1.00 0.00 O ATOM 90390 H1 WAT 178 0.620 99.910 128.543 1.00 0.00 H ATOM 90391 H2 WAT 178 2.133 99.927 128.563 1.00 0.00 H TER 90393 WAT 178 ATOM 90393 O WAT 179 37.468 60.089 131.966 1.00 0.00 O ATOM 90394 H1 WAT 179 36.829 60.585 131.454 1.00 0.00 H ATOM 90395 H2 WAT 179 37.941 60.753 132.468 1.00 0.00 H TER 90397 WAT 179 ATOM 90397 O WAT 180 97.725 0.495 90.216 1.00 0.00 O ATOM 90398 H1 WAT 180 98.070 0.330 89.339 1.00 0.00 H ATOM 90399 H2 WAT 180 97.189 -0.274 90.411 1.00 0.00 H TER 90401 WAT 180 ATOM 90401 O WAT 181 106.542 53.532 98.685 1.00 0.00 O ATOM 90402 H1 WAT 181 106.586 53.089 97.837 1.00 0.00 H ATOM 90403 H2 WAT 181 107.378 53.330 99.104 1.00 0.00 H TER 90405 WAT 181 ATOM 90405 O WAT 182 124.260 27.471 121.001 1.00 0.00 O ATOM 90406 H1 WAT 182 124.104 28.390 121.218 1.00 0.00 H ATOM 90407 H2 WAT 182 124.609 27.491 120.110 1.00 0.00 H TER 90409 WAT 182 ATOM 90409 O WAT 183 50.823 11.564 91.267 1.00 0.00 O ATOM 90410 H1 WAT 183 50.325 12.381 91.273 1.00 0.00 H ATOM 90411 H2 WAT 183 50.177 10.892 91.048 1.00 0.00 H TER 90413 WAT 183 ATOM 90413 O WAT 184 121.175 128.576 102.657 1.00 0.00 O ATOM 90414 H1 WAT 184 120.258 128.462 102.907 1.00 0.00 H ATOM 90415 H2 WAT 184 121.584 128.977 103.424 1.00 0.00 H TER 90417 WAT 184 ATOM 90417 O WAT 185 9.676 7.483 77.302 1.00 0.00 O ATOM 90418 H1 WAT 185 9.142 6.768 76.954 1.00 0.00 H ATOM 90419 H2 WAT 185 10.073 7.883 76.528 1.00 0.00 H TER 90421 WAT 185 ATOM 90421 O WAT 186 109.724 11.171 93.638 1.00 0.00 O ATOM 90422 H1 WAT 186 109.370 11.005 94.512 1.00 0.00 H ATOM 90423 H2 WAT 186 110.617 11.477 93.795 1.00 0.00 H TER 90425 WAT 186 ATOM 90425 O WAT 187 96.058 96.922 131.372 1.00 0.00 O ATOM 90426 H1 WAT 187 95.663 97.744 131.661 1.00 0.00 H ATOM 90427 H2 WAT 187 95.904 96.315 132.096 1.00 0.00 H TER 90429 WAT 187 ATOM 90429 O WAT 188 86.935 19.524 112.594 1.00 0.00 O ATOM 90430 H1 WAT 188 86.000 19.324 112.633 1.00 0.00 H ATOM 90431 H2 WAT 188 87.300 18.853 112.017 1.00 0.00 H TER 90433 WAT 188 ATOM 90433 O WAT 189 34.544 34.310 129.071 1.00 0.00 O ATOM 90434 H1 WAT 189 34.545 33.357 129.160 1.00 0.00 H ATOM 90435 H2 WAT 189 33.965 34.480 128.327 1.00 0.00 H TER 90437 WAT 189 ATOM 90437 O WAT 190 7.131 111.695 91.730 1.00 0.00 O ATOM 90438 H1 WAT 190 7.879 111.161 91.995 1.00 0.00 H ATOM 90439 H2 WAT 190 7.519 112.443 91.277 1.00 0.00 H TER 90441 WAT 190 ATOM 90441 O WAT 191 125.363 69.913 89.215 1.00 0.00 O ATOM 90442 H1 WAT 191 125.720 69.640 90.060 1.00 0.00 H ATOM 90443 H2 WAT 191 126.125 70.214 88.720 1.00 0.00 H TER 90445 WAT 191 ATOM 90445 O WAT 192 1.859 102.953 139.415 1.00 0.00 O ATOM 90446 H1 WAT 192 1.647 102.894 138.483 1.00 0.00 H ATOM 90447 H2 WAT 192 1.758 102.059 139.741 1.00 0.00 H TER 90449 WAT 192 ATOM 90449 O WAT 193 125.611 141.838 145.233 1.00 0.00 O ATOM 90450 H1 WAT 193 126.162 141.206 144.772 1.00 0.00 H ATOM 90451 H2 WAT 193 125.804 141.694 146.159 1.00 0.00 H TER 90453 WAT 193 ATOM 90453 O WAT 194 130.515 82.573 108.565 1.00 0.00 O ATOM 90454 H1 WAT 194 130.900 83.126 109.245 1.00 0.00 H ATOM 90455 H2 WAT 194 130.861 82.925 107.746 1.00 0.00 H TER 90457 WAT 194 ATOM 90457 O WAT 195 140.777 30.749 97.514 1.00 0.00 O ATOM 90458 H1 WAT 195 141.154 31.363 98.144 1.00 0.00 H ATOM 90459 H2 WAT 195 140.091 30.294 98.003 1.00 0.00 H TER 90461 WAT 195 ATOM 90461 O WAT 196 114.807 87.549 84.195 1.00 0.00 O ATOM 90462 H1 WAT 196 115.108 86.643 84.268 1.00 0.00 H ATOM 90463 H2 WAT 196 114.733 87.850 85.101 1.00 0.00 H TER 90465 WAT 196 ATOM 90465 O WAT 197 137.307 77.700 20.847 1.00 0.00 O ATOM 90466 H1 WAT 197 136.789 78.046 21.574 1.00 0.00 H ATOM 90467 H2 WAT 197 137.688 78.474 20.434 1.00 0.00 H TER 90469 WAT 197 ATOM 90469 O WAT 198 60.595 10.569 126.852 1.00 0.00 O ATOM 90470 H1 WAT 198 59.641 10.636 126.826 1.00 0.00 H ATOM 90471 H2 WAT 198 60.831 10.179 126.010 1.00 0.00 H TER 90473 WAT 198 ATOM 90473 O WAT 199 22.633 83.923 154.709 1.00 0.00 O ATOM 90474 H1 WAT 199 23.508 84.043 154.341 1.00 0.00 H ATOM 90475 H2 WAT 199 22.153 84.710 154.450 1.00 0.00 H TER 90477 WAT 199 ATOM 90477 O WAT 200 79.092 53.879 8.062 1.00 0.00 O ATOM 90478 H1 WAT 200 79.959 53.612 8.368 1.00 0.00 H ATOM 90479 H2 WAT 200 79.164 54.824 7.929 1.00 0.00 H TER 90481 WAT 200 ATOM 90481 O WAT 201 20.719 118.279 64.872 1.00 0.00 O ATOM 90482 H1 WAT 201 20.540 119.218 64.933 1.00 0.00 H ATOM 90483 H2 WAT 201 21.310 118.100 65.604 1.00 0.00 H TER 90485 WAT 201 ATOM 90485 O WAT 202 33.993 72.326 131.444 1.00 0.00 O ATOM 90486 H1 WAT 202 33.200 72.631 131.004 1.00 0.00 H ATOM 90487 H2 WAT 202 34.410 73.125 131.766 1.00 0.00 H TER 90489 WAT 202 ATOM 90489 O WAT 203 99.890 15.372 119.014 1.00 0.00 O ATOM 90490 H1 WAT 203 100.111 15.348 119.945 1.00 0.00 H ATOM 90491 H2 WAT 203 99.887 16.304 118.793 1.00 0.00 H TER 90493 WAT 203 ATOM 90493 O WAT 204 107.459 13.169 118.216 1.00 0.00 O ATOM 90494 H1 WAT 204 107.480 14.112 118.377 1.00 0.00 H ATOM 90495 H2 WAT 204 107.543 12.776 119.085 1.00 0.00 H TER 90497 WAT 204 ATOM 90497 O WAT 205 136.044 70.588 0.864 1.00 0.00 O ATOM 90498 H1 WAT 205 135.787 71.273 1.481 1.00 0.00 H ATOM 90499 H2 WAT 205 136.966 70.423 1.061 1.00 0.00 H TER 90501 WAT 205 ATOM 90501 O WAT 206 132.169 118.871 117.527 1.00 0.00 O ATOM 90502 H1 WAT 206 132.080 117.970 117.216 1.00 0.00 H ATOM 90503 H2 WAT 206 131.843 119.407 116.805 1.00 0.00 H TER 90505 WAT 206 ATOM 90505 O WAT 207 69.432 62.865 151.707 1.00 0.00 O ATOM 90506 H1 WAT 207 69.958 62.104 151.954 1.00 0.00 H ATOM 90507 H2 WAT 207 69.350 62.801 150.755 1.00 0.00 H TER 90509 WAT 207 ATOM 90509 O WAT 208 68.844 119.846 54.942 1.00 0.00 O ATOM 90510 H1 WAT 208 69.109 120.466 55.621 1.00 0.00 H ATOM 90511 H2 WAT 208 68.925 120.338 54.124 1.00 0.00 H TER 90513 WAT 208 ATOM 90513 O WAT 209 75.591 67.115 8.895 1.00 0.00 O ATOM 90514 H1 WAT 209 75.631 68.061 9.035 1.00 0.00 H ATOM 90515 H2 WAT 209 76.261 66.942 8.233 1.00 0.00 H TER 90517 WAT 209 ATOM 90517 O WAT 210 83.734 130.883 141.498 1.00 0.00 O ATOM 90518 H1 WAT 210 84.635 130.843 141.175 1.00 0.00 H ATOM 90519 H2 WAT 210 83.448 131.774 141.299 1.00 0.00 H TER 90521 WAT 210 ATOM 90521 O WAT 211 118.719 131.108 153.693 1.00 0.00 O ATOM 90522 H1 WAT 211 118.942 130.200 153.898 1.00 0.00 H ATOM 90523 H2 WAT 211 118.387 131.465 154.517 1.00 0.00 H TER 90525 WAT 211 ATOM 90525 O WAT 212 16.017 106.624 63.943 1.00 0.00 O ATOM 90526 H1 WAT 212 16.169 105.770 64.347 1.00 0.00 H ATOM 90527 H2 WAT 212 16.006 107.238 64.677 1.00 0.00 H TER 90529 WAT 212 ATOM 90529 O WAT 213 87.431 114.296 87.658 1.00 0.00 O ATOM 90530 H1 WAT 213 87.239 115.092 88.152 1.00 0.00 H ATOM 90531 H2 WAT 213 86.735 114.246 87.003 1.00 0.00 H TER 90533 WAT 213 ATOM 90533 O WAT 214 25.998 128.244 132.324 1.00 0.00 O ATOM 90534 H1 WAT 214 25.496 127.702 132.933 1.00 0.00 H ATOM 90535 H2 WAT 214 26.847 127.808 132.259 1.00 0.00 H TER 90537 WAT 214 ATOM 90537 O WAT 215 78.458 133.677 145.975 1.00 0.00 O ATOM 90538 H1 WAT 215 79.390 133.803 146.155 1.00 0.00 H ATOM 90539 H2 WAT 215 78.062 133.551 146.838 1.00 0.00 H TER 90541 WAT 215 ATOM 90541 O WAT 216 121.145 48.663 74.065 1.00 0.00 O ATOM 90542 H1 WAT 216 120.576 49.430 74.135 1.00 0.00 H ATOM 90543 H2 WAT 216 121.692 48.700 74.850 1.00 0.00 H TER 90545 WAT 216 ATOM 90545 O WAT 217 76.266 58.136 87.407 1.00 0.00 O ATOM 90546 H1 WAT 217 76.415 58.407 86.501 1.00 0.00 H ATOM 90547 H2 WAT 217 77.072 57.684 87.657 1.00 0.00 H TER 90549 WAT 217 ATOM 90549 O WAT 218 98.645 17.013 138.598 1.00 0.00 O ATOM 90550 H1 WAT 218 98.646 17.166 139.542 1.00 0.00 H ATOM 90551 H2 WAT 218 98.004 17.636 138.255 1.00 0.00 H TER 90553 WAT 218 ATOM 90553 O WAT 219 140.444 89.106 5.307 1.00 0.00 O ATOM 90554 H1 WAT 219 140.352 88.537 4.542 1.00 0.00 H ATOM 90555 H2 WAT 219 139.694 89.698 5.256 1.00 0.00 H TER 90557 WAT 219 ATOM 90557 O WAT 220 99.429 54.830 121.182 1.00 0.00 O ATOM 90558 H1 WAT 220 98.549 54.462 121.101 1.00 0.00 H ATOM 90559 H2 WAT 220 99.869 54.262 121.815 1.00 0.00 H TER 90561 WAT 220 ATOM 90561 O WAT 221 17.357 140.469 101.889 1.00 0.00 O ATOM 90562 H1 WAT 221 16.814 140.841 101.194 1.00 0.00 H ATOM 90563 H2 WAT 221 18.229 140.830 101.730 1.00 0.00 H TER 90565 WAT 221 ATOM 90565 O WAT 222 109.218 103.985 8.565 1.00 0.00 O ATOM 90566 H1 WAT 222 108.437 103.679 8.104 1.00 0.00 H ATOM 90567 H2 WAT 222 109.729 103.191 8.722 1.00 0.00 H TER 90569 WAT 222 ATOM 90569 O WAT 223 83.826 0.265 8.574 1.00 0.00 O ATOM 90570 H1 WAT 223 83.453 0.412 7.705 1.00 0.00 H ATOM 90571 H2 WAT 223 84.300 1.073 8.771 1.00 0.00 H TER 90573 WAT 223 ATOM 90573 O WAT 224 138.900 89.071 11.979 1.00 0.00 O ATOM 90574 H1 WAT 224 139.490 88.564 12.536 1.00 0.00 H ATOM 90575 H2 WAT 224 138.122 88.521 11.891 1.00 0.00 H TER 90577 WAT 224 ATOM 90577 O WAT 225 46.879 13.605 156.113 1.00 0.00 O ATOM 90578 H1 WAT 225 46.123 13.023 156.199 1.00 0.00 H ATOM 90579 H2 WAT 225 46.613 14.410 156.558 1.00 0.00 H TER 90581 WAT 225 ATOM 90581 O WAT 226 87.385 97.397 141.106 1.00 0.00 O ATOM 90582 H1 WAT 226 86.977 97.749 141.897 1.00 0.00 H ATOM 90583 H2 WAT 226 87.148 98.018 140.418 1.00 0.00 H TER 90585 WAT 226 ATOM 90585 O WAT 227 45.833 63.997 156.119 1.00 0.00 O ATOM 90586 H1 WAT 227 46.504 64.654 155.930 1.00 0.00 H ATOM 90587 H2 WAT 227 45.272 63.997 155.343 1.00 0.00 H TER 90589 WAT 227 ATOM 90589 O WAT 228 125.291 87.352 107.820 1.00 0.00 O ATOM 90590 H1 WAT 228 125.507 86.422 107.891 1.00 0.00 H ATOM 90591 H2 WAT 228 125.072 87.476 106.896 1.00 0.00 H TER 90593 WAT 228 ATOM 90593 O WAT 229 112.568 97.206 70.282 1.00 0.00 O ATOM 90594 H1 WAT 229 112.356 97.892 70.914 1.00 0.00 H ATOM 90595 H2 WAT 229 113.509 97.064 70.390 1.00 0.00 H TER 90597 WAT 229 ATOM 90597 O WAT 230 62.319 69.121 110.770 1.00 0.00 O ATOM 90598 H1 WAT 230 63.036 69.724 110.574 1.00 0.00 H ATOM 90599 H2 WAT 230 61.857 69.020 109.938 1.00 0.00 H TER 90601 WAT 230 ATOM 90601 O WAT 231 136.746 34.183 136.417 1.00 0.00 O ATOM 90602 H1 WAT 231 137.312 33.724 135.797 1.00 0.00 H ATOM 90603 H2 WAT 231 136.343 33.486 136.935 1.00 0.00 H TER 90605 WAT 231 ATOM 90605 O WAT 232 38.938 137.300 74.575 1.00 0.00 O ATOM 90606 H1 WAT 232 39.423 136.652 74.063 1.00 0.00 H ATOM 90607 H2 WAT 232 38.479 137.827 73.921 1.00 0.00 H TER 90609 WAT 232 ATOM 90609 O WAT 233 2.078 75.120 85.227 1.00 0.00 O ATOM 90610 H1 WAT 233 1.839 75.040 86.150 1.00 0.00 H ATOM 90611 H2 WAT 233 2.531 74.302 85.025 1.00 0.00 H TER 90613 WAT 233 ATOM 90613 O WAT 234 3.796 68.466 82.798 1.00 0.00 O ATOM 90614 H1 WAT 234 2.862 68.640 82.681 1.00 0.00 H ATOM 90615 H2 WAT 234 4.228 69.061 82.185 1.00 0.00 H TER 90617 WAT 234 ATOM 90617 O WAT 235 73.925 143.198 69.105 1.00 0.00 O ATOM 90618 H1 WAT 235 74.576 142.704 68.606 1.00 0.00 H ATOM 90619 H2 WAT 235 73.343 142.530 69.467 1.00 0.00 H TER 90621 WAT 235 ATOM 90621 O WAT 236 133.168 26.750 76.254 1.00 0.00 O ATOM 90622 H1 WAT 236 133.588 27.041 75.444 1.00 0.00 H ATOM 90623 H2 WAT 236 132.773 25.908 76.029 1.00 0.00 H TER 90625 WAT 236 ATOM 90625 O WAT 237 111.395 85.667 15.172 1.00 0.00 O ATOM 90626 H1 WAT 237 111.927 86.406 15.467 1.00 0.00 H ATOM 90627 H2 WAT 237 110.746 86.058 14.588 1.00 0.00 H TER 90629 WAT 237 ATOM 90629 O WAT 238 77.371 48.158 28.958 1.00 0.00 O ATOM 90630 H1 WAT 238 77.881 48.589 29.643 1.00 0.00 H ATOM 90631 H2 WAT 238 76.640 48.753 28.793 1.00 0.00 H TER 90633 WAT 238 ATOM 90633 O WAT 239 2.726 52.393 64.176 1.00 0.00 O ATOM 90634 H1 WAT 239 2.001 51.770 64.229 1.00 0.00 H ATOM 90635 H2 WAT 239 2.548 52.901 63.384 1.00 0.00 H TER 90637 WAT 239 ATOM 90637 O WAT 240 24.664 114.370 86.535 1.00 0.00 O ATOM 90638 H1 WAT 240 25.318 114.311 87.232 1.00 0.00 H ATOM 90639 H2 WAT 240 23.899 114.761 86.957 1.00 0.00 H TER 90641 WAT 240 ATOM 90641 O WAT 241 14.181 138.973 128.148 1.00 0.00 O ATOM 90642 H1 WAT 241 14.853 138.292 128.135 1.00 0.00 H ATOM 90643 H2 WAT 241 13.368 138.513 127.941 1.00 0.00 H TER 90645 WAT 241 ATOM 90645 O WAT 242 32.860 44.133 138.970 1.00 0.00 O ATOM 90646 H1 WAT 242 32.346 43.881 139.737 1.00 0.00 H ATOM 90647 H2 WAT 242 33.029 45.068 139.090 1.00 0.00 H TER 90649 WAT 242 ATOM 90649 O WAT 243 60.515 54.331 78.298 1.00 0.00 O ATOM 90650 H1 WAT 243 59.627 54.016 78.130 1.00 0.00 H ATOM 90651 H2 WAT 243 61.079 53.597 78.052 1.00 0.00 H TER 90653 WAT 243 ATOM 90653 O WAT 244 117.319 104.063 105.288 1.00 0.00 O ATOM 90654 H1 WAT 244 118.120 104.182 105.799 1.00 0.00 H ATOM 90655 H2 WAT 244 116.611 104.246 105.906 1.00 0.00 H TER 90657 WAT 244 ATOM 90657 O WAT 245 29.274 1.138 68.115 1.00 0.00 O ATOM 90658 H1 WAT 245 28.340 1.290 67.971 1.00 0.00 H ATOM 90659 H2 WAT 245 29.700 1.926 67.777 1.00 0.00 H TER 90661 WAT 245 ATOM 90661 O WAT 246 17.060 84.358 15.211 1.00 0.00 O ATOM 90662 H1 WAT 246 17.154 85.181 15.690 1.00 0.00 H ATOM 90663 H2 WAT 246 17.888 84.257 14.742 1.00 0.00 H TER 90665 WAT 246 ATOM 90665 O WAT 247 55.214 117.252 71.232 1.00 0.00 O ATOM 90666 H1 WAT 247 55.891 117.805 70.841 1.00 0.00 H ATOM 90667 H2 WAT 247 54.641 117.021 70.500 1.00 0.00 H TER 90669 WAT 247 ATOM 90669 O WAT 248 59.083 7.742 91.500 1.00 0.00 O ATOM 90670 H1 WAT 248 58.464 8.228 92.045 1.00 0.00 H ATOM 90671 H2 WAT 248 59.448 7.080 92.087 1.00 0.00 H TER 90673 WAT 248 ATOM 90673 O WAT 249 56.722 142.311 90.425 1.00 0.00 O ATOM 90674 H1 WAT 249 56.838 141.362 90.477 1.00 0.00 H ATOM 90675 H2 WAT 249 56.161 142.525 91.170 1.00 0.00 H TER 90677 WAT 249 ATOM 90677 O WAT 250 68.890 97.021 73.178 1.00 0.00 O ATOM 90678 H1 WAT 250 67.962 97.246 73.239 1.00 0.00 H ATOM 90679 H2 WAT 250 69.340 97.866 73.154 1.00 0.00 H TER 90681 WAT 250 ATOM 90681 O WAT 251 65.741 51.408 147.812 1.00 0.00 O ATOM 90682 H1 WAT 251 65.863 50.776 147.103 1.00 0.00 H ATOM 90683 H2 WAT 251 65.350 52.172 147.388 1.00 0.00 H TER 90685 WAT 251 ATOM 90685 O WAT 252 91.729 122.985 152.762 1.00 0.00 O ATOM 90686 H1 WAT 252 92.082 122.288 152.209 1.00 0.00 H ATOM 90687 H2 WAT 252 91.741 122.619 153.647 1.00 0.00 H TER 90689 WAT 252 ATOM 90689 O WAT 253 83.417 101.569 147.899 1.00 0.00 O ATOM 90690 H1 WAT 253 83.768 101.199 148.708 1.00 0.00 H ATOM 90691 H2 WAT 253 83.266 100.811 147.334 1.00 0.00 H TER 90693 WAT 253 ATOM 90693 O WAT 254 61.285 126.523 112.016 1.00 0.00 O ATOM 90694 H1 WAT 254 61.709 126.611 112.870 1.00 0.00 H ATOM 90695 H2 WAT 254 60.768 127.324 111.923 1.00 0.00 H TER 90697 WAT 254 ATOM 90697 O WAT 255 124.609 135.581 147.448 1.00 0.00 O ATOM 90698 H1 WAT 255 123.731 135.611 147.827 1.00 0.00 H ATOM 90699 H2 WAT 255 124.535 134.966 146.719 1.00 0.00 H TER 90701 WAT 255 ATOM 90701 O WAT 256 13.373 66.508 2.838 1.00 0.00 O ATOM 90702 H1 WAT 256 12.473 66.421 2.524 1.00 0.00 H ATOM 90703 H2 WAT 256 13.349 66.166 3.732 1.00 0.00 H TER 90705 WAT 256 ATOM 90705 O WAT 257 2.468 137.650 121.817 1.00 0.00 O ATOM 90706 H1 WAT 257 3.409 137.720 121.982 1.00 0.00 H ATOM 90707 H2 WAT 257 2.062 138.117 122.548 1.00 0.00 H TER 90709 WAT 257 ATOM 90709 O WAT 258 94.343 5.626 78.663 1.00 0.00 O ATOM 90710 H1 WAT 258 93.515 5.146 78.644 1.00 0.00 H ATOM 90711 H2 WAT 258 94.813 5.264 79.415 1.00 0.00 H TER 90713 WAT 258 ATOM 90713 O WAT 259 7.049 131.464 74.563 1.00 0.00 O ATOM 90714 H1 WAT 259 6.390 131.840 73.979 1.00 0.00 H ATOM 90715 H2 WAT 259 7.872 131.551 74.082 1.00 0.00 H TER 90717 WAT 259 ATOM 90717 O WAT 260 145.763 65.552 71.302 1.00 0.00 O ATOM 90718 H1 WAT 260 145.183 64.827 71.071 1.00 0.00 H ATOM 90719 H2 WAT 260 146.284 65.703 70.513 1.00 0.00 H TER 90721 WAT 260 ATOM 90721 O WAT 261 52.308 91.710 111.272 1.00 0.00 O ATOM 90722 H1 WAT 261 53.074 92.276 111.367 1.00 0.00 H ATOM 90723 H2 WAT 261 51.671 92.062 111.892 1.00 0.00 H TER 90725 WAT 261 ATOM 90725 O WAT 262 121.730 101.011 124.118 1.00 0.00 O ATOM 90726 H1 WAT 262 120.807 101.186 123.939 1.00 0.00 H ATOM 90727 H2 WAT 262 122.119 100.871 123.254 1.00 0.00 H TER 90729 WAT 262 ATOM 90729 O WAT 263 5.699 116.568 119.103 1.00 0.00 O ATOM 90730 H1 WAT 263 6.184 115.762 118.926 1.00 0.00 H ATOM 90731 H2 WAT 263 5.372 116.844 118.246 1.00 0.00 H TER 90733 WAT 263 ATOM 90733 O WAT 264 102.471 45.758 61.070 1.00 0.00 O ATOM 90734 H1 WAT 264 101.600 46.155 61.056 1.00 0.00 H ATOM 90735 H2 WAT 264 102.413 45.077 61.740 1.00 0.00 H TER 90737 WAT 264 ATOM 90737 O WAT 265 69.521 4.285 70.685 1.00 0.00 O ATOM 90738 H1 WAT 265 70.460 4.282 70.496 1.00 0.00 H ATOM 90739 H2 WAT 265 69.449 3.879 71.548 1.00 0.00 H TER 90741 WAT 265 ATOM 90741 O WAT 266 48.245 96.616 134.239 1.00 0.00 O ATOM 90742 H1 WAT 266 48.380 96.769 135.174 1.00 0.00 H ATOM 90743 H2 WAT 266 47.457 97.115 134.026 1.00 0.00 H TER 90745 WAT 266 ATOM 90745 O WAT 267 131.536 70.552 151.744 1.00 0.00 O ATOM 90746 H1 WAT 267 132.120 69.952 151.280 1.00 0.00 H ATOM 90747 H2 WAT 267 131.758 70.435 152.668 1.00 0.00 H TER 90749 WAT 267 ATOM 90749 O WAT 268 11.282 140.479 158.207 1.00 0.00 O ATOM 90750 H1 WAT 268 11.534 139.671 158.653 1.00 0.00 H ATOM 90751 H2 WAT 268 11.815 140.491 157.412 1.00 0.00 H TER 90753 WAT 268 ATOM 90753 O WAT 269 142.337 122.982 1.728 1.00 0.00 O ATOM 90754 H1 WAT 269 141.563 123.389 2.117 1.00 0.00 H ATOM 90755 H2 WAT 269 142.003 122.194 1.300 1.00 0.00 H TER 90757 WAT 269 ATOM 90757 O WAT 270 65.221 121.365 141.869 1.00 0.00 O ATOM 90758 H1 WAT 270 64.399 121.511 142.337 1.00 0.00 H ATOM 90759 H2 WAT 270 65.774 120.899 142.496 1.00 0.00 H TER 90761 WAT 270 ATOM 90761 O WAT 271 73.087 48.735 7.817 1.00 0.00 O ATOM 90762 H1 WAT 271 72.227 48.334 7.943 1.00 0.00 H ATOM 90763 H2 WAT 271 73.005 49.226 6.999 1.00 0.00 H TER 90765 WAT 271 ATOM 90765 O WAT 272 25.633 53.205 17.475 1.00 0.00 O ATOM 90766 H1 WAT 272 26.386 52.691 17.183 1.00 0.00 H ATOM 90767 H2 WAT 272 24.952 53.022 16.826 1.00 0.00 H TER 90769 WAT 272 ATOM 90769 O WAT 273 110.405 22.629 80.802 1.00 0.00 O ATOM 90770 H1 WAT 273 111.010 22.444 81.520 1.00 0.00 H ATOM 90771 H2 WAT 273 109.669 22.035 80.950 1.00 0.00 H TER 90773 WAT 273 ATOM 90773 O WAT 274 132.866 64.249 139.018 1.00 0.00 O ATOM 90774 H1 WAT 274 133.174 63.911 138.177 1.00 0.00 H ATOM 90775 H2 WAT 274 132.046 64.697 138.810 1.00 0.00 H TER 90777 WAT 274 ATOM 90777 O WAT 275 109.002 105.559 64.782 1.00 0.00 O ATOM 90778 H1 WAT 275 108.317 105.227 64.202 1.00 0.00 H ATOM 90779 H2 WAT 275 108.905 106.510 64.746 1.00 0.00 H TER 90781 WAT 275 ATOM 90781 O WAT 276 78.005 128.514 102.318 1.00 0.00 O ATOM 90782 H1 WAT 276 77.276 127.906 102.199 1.00 0.00 H ATOM 90783 H2 WAT 276 78.045 129.004 101.497 1.00 0.00 H TER 90785 WAT 276 ATOM 90785 O WAT 277 15.117 55.411 109.052 1.00 0.00 O ATOM 90786 H1 WAT 277 14.266 55.123 108.724 1.00 0.00 H ATOM 90787 H2 WAT 277 15.709 54.686 108.853 1.00 0.00 H TER 90789 WAT 277 ATOM 90789 O WAT 278 76.422 105.979 156.007 1.00 0.00 O ATOM 90790 H1 WAT 278 75.719 106.552 155.702 1.00 0.00 H ATOM 90791 H2 WAT 278 77.199 106.539 156.023 1.00 0.00 H TER 90793 WAT 278 ATOM 90793 O WAT 279 77.085 125.638 89.854 1.00 0.00 O ATOM 90794 H1 WAT 279 76.523 126.413 89.847 1.00 0.00 H ATOM 90795 H2 WAT 279 76.922 125.231 90.705 1.00 0.00 H TER 90797 WAT 279 ATOM 90797 O WAT 280 42.678 44.684 134.314 1.00 0.00 O ATOM 90798 H1 WAT 280 43.155 45.326 134.840 1.00 0.00 H ATOM 90799 H2 WAT 280 42.417 44.009 134.940 1.00 0.00 H TER 90801 WAT 280 ATOM 90801 O WAT 281 70.659 71.635 112.910 1.00 0.00 O ATOM 90802 H1 WAT 281 70.257 72.499 112.825 1.00 0.00 H ATOM 90803 H2 WAT 281 70.146 71.197 113.589 1.00 0.00 H TER 90805 WAT 281 ATOM 90805 O WAT 282 130.111 140.741 133.156 1.00 0.00 O ATOM 90806 H1 WAT 282 130.788 141.373 132.915 1.00 0.00 H ATOM 90807 H2 WAT 282 130.169 140.680 134.109 1.00 0.00 H TER 90809 WAT 282 ATOM 90809 O WAT 283 43.166 58.243 119.029 1.00 0.00 O ATOM 90810 H1 WAT 283 43.051 59.105 118.629 1.00 0.00 H ATOM 90811 H2 WAT 283 42.522 58.220 119.737 1.00 0.00 H TER 90813 WAT 283 ATOM 90813 O WAT 284 126.089 3.034 52.867 1.00 0.00 O ATOM 90814 H1 WAT 284 126.366 3.406 53.704 1.00 0.00 H ATOM 90815 H2 WAT 284 125.866 3.793 52.329 1.00 0.00 H TER 90817 WAT 284 ATOM 90817 O WAT 285 96.484 21.888 65.223 1.00 0.00 O ATOM 90818 H1 WAT 285 95.910 21.587 64.519 1.00 0.00 H ATOM 90819 H2 WAT 285 96.525 22.838 65.110 1.00 0.00 H TER 90821 WAT 285 ATOM 90821 O WAT 286 40.211 52.544 127.927 1.00 0.00 O ATOM 90822 H1 WAT 286 40.337 53.169 127.213 1.00 0.00 H ATOM 90823 H2 WAT 286 39.920 51.742 127.494 1.00 0.00 H TER 90825 WAT 286 ATOM 90825 O WAT 287 38.436 145.754 121.230 1.00 0.00 O ATOM 90826 H1 WAT 287 38.013 144.944 121.515 1.00 0.00 H ATOM 90827 H2 WAT 287 38.687 145.587 120.321 1.00 0.00 H TER 90829 WAT 287 ATOM 90829 O WAT 288 130.059 33.540 81.021 1.00 0.00 O ATOM 90830 H1 WAT 288 129.685 34.182 80.417 1.00 0.00 H ATOM 90831 H2 WAT 288 130.935 33.876 81.214 1.00 0.00 H TER 90833 WAT 288 ATOM 90833 O WAT 289 92.186 12.065 95.244 1.00 0.00 O ATOM 90834 H1 WAT 289 92.444 12.822 95.770 1.00 0.00 H ATOM 90835 H2 WAT 289 92.674 12.163 94.426 1.00 0.00 H TER 90837 WAT 289 ATOM 90837 O WAT 290 62.133 12.092 11.516 1.00 0.00 O ATOM 90838 H1 WAT 290 62.359 11.281 11.061 1.00 0.00 H ATOM 90839 H2 WAT 290 61.327 12.388 11.092 1.00 0.00 H TER 90841 WAT 290 ATOM 90841 O WAT 291 68.687 4.150 158.179 1.00 0.00 O ATOM 90842 H1 WAT 291 69.569 4.159 157.808 1.00 0.00 H ATOM 90843 H2 WAT 291 68.131 3.832 157.468 1.00 0.00 H TER 90845 WAT 291 ATOM 90845 O WAT 292 119.530 65.913 107.723 1.00 0.00 O ATOM 90846 H1 WAT 292 120.209 66.535 107.463 1.00 0.00 H ATOM 90847 H2 WAT 292 118.712 66.404 107.640 1.00 0.00 H TER 90849 WAT 292 ATOM 90849 O WAT 293 6.870 100.494 65.612 1.00 0.00 O ATOM 90850 H1 WAT 293 5.959 100.650 65.366 1.00 0.00 H ATOM 90851 H2 WAT 293 6.965 100.922 66.463 1.00 0.00 H TER 90853 WAT 293 ATOM 90853 O WAT 294 89.026 84.056 87.971 1.00 0.00 O ATOM 90854 H1 WAT 294 89.522 84.696 88.481 1.00 0.00 H ATOM 90855 H2 WAT 294 89.409 83.212 88.206 1.00 0.00 H TER 90857 WAT 294 ATOM 90857 O WAT 295 5.282 116.527 110.661 1.00 0.00 O ATOM 90858 H1 WAT 295 5.126 116.292 109.746 1.00 0.00 H ATOM 90859 H2 WAT 295 6.132 116.968 110.653 1.00 0.00 H TER 90861 WAT 295 ATOM 90861 O WAT 296 52.575 83.111 156.091 1.00 0.00 O ATOM 90862 H1 WAT 296 52.466 82.386 155.476 1.00 0.00 H ATOM 90863 H2 WAT 296 52.452 82.714 156.953 1.00 0.00 H TER 90865 WAT 296 ATOM 90865 O WAT 297 64.077 60.832 5.286 1.00 0.00 O ATOM 90866 H1 WAT 297 63.654 61.607 5.655 1.00 0.00 H ATOM 90867 H2 WAT 297 64.598 61.167 4.556 1.00 0.00 H TER 90869 WAT 297 ATOM 90869 O WAT 298 13.273 136.444 139.024 1.00 0.00 O ATOM 90870 H1 WAT 298 14.003 137.009 139.278 1.00 0.00 H ATOM 90871 H2 WAT 298 13.347 135.684 139.601 1.00 0.00 H TER 90873 WAT 298 ATOM 90873 O WAT 299 101.923 119.289 4.497 1.00 0.00 O ATOM 90874 H1 WAT 299 102.440 120.092 4.572 1.00 0.00 H ATOM 90875 H2 WAT 299 102.031 119.019 3.585 1.00 0.00 H TER 90877 WAT 299 ATOM 90877 O WAT 300 143.201 135.933 96.707 1.00 0.00 O ATOM 90878 H1 WAT 300 143.028 136.510 95.963 1.00 0.00 H ATOM 90879 H2 WAT 300 142.517 136.147 97.341 1.00 0.00 H TER 90881 WAT 300 ATOM 90881 O WAT 301 12.128 120.265 147.708 1.00 0.00 O ATOM 90882 H1 WAT 301 11.477 120.789 148.174 1.00 0.00 H ATOM 90883 H2 WAT 301 12.734 120.908 147.340 1.00 0.00 H TER 90885 WAT 301 ATOM 90885 O WAT 302 28.481 122.768 104.150 1.00 0.00 O ATOM 90886 H1 WAT 302 28.374 123.596 103.682 1.00 0.00 H ATOM 90887 H2 WAT 302 29.079 122.259 103.601 1.00 0.00 H TER 90889 WAT 302 ATOM 90889 O WAT 303 0.369 80.187 157.855 1.00 0.00 O ATOM 90890 H1 WAT 303 0.475 80.987 158.370 1.00 0.00 H ATOM 90891 H2 WAT 303 -0.090 79.584 158.441 1.00 0.00 H TER 90893 WAT 303 ATOM 90893 O WAT 304 140.740 66.882 61.318 1.00 0.00 O ATOM 90894 H1 WAT 304 140.327 67.660 60.944 1.00 0.00 H ATOM 90895 H2 WAT 304 140.218 66.151 60.986 1.00 0.00 H TER 90897 WAT 304 ATOM 90897 O WAT 305 87.506 97.609 55.439 1.00 0.00 O ATOM 90898 H1 WAT 305 87.563 98.536 55.206 1.00 0.00 H ATOM 90899 H2 WAT 305 87.144 97.188 54.659 1.00 0.00 H TER 90901 WAT 305 ATOM 90901 O WAT 306 45.091 18.564 59.991 1.00 0.00 O ATOM 90902 H1 WAT 306 45.094 19.140 59.226 1.00 0.00 H ATOM 90903 H2 WAT 306 44.832 17.709 59.646 1.00 0.00 H TER 90905 WAT 306 ATOM 90905 O WAT 307 74.579 137.006 90.874 1.00 0.00 O ATOM 90906 H1 WAT 307 73.949 137.095 91.590 1.00 0.00 H ATOM 90907 H2 WAT 307 74.955 136.134 90.992 1.00 0.00 H TER 90909 WAT 307 ATOM 90909 O WAT 308 124.630 3.213 148.420 1.00 0.00 O ATOM 90910 H1 WAT 308 124.864 3.498 149.303 1.00 0.00 H ATOM 90911 H2 WAT 308 125.383 3.459 147.882 1.00 0.00 H TER 90913 WAT 308 ATOM 90913 O WAT 309 8.912 2.688 144.301 1.00 0.00 O ATOM 90914 H1 WAT 309 8.528 3.349 144.877 1.00 0.00 H ATOM 90915 H2 WAT 309 9.245 2.017 144.896 1.00 0.00 H TER 90917 WAT 309 ATOM 90917 O WAT 310 133.213 14.468 118.317 1.00 0.00 O ATOM 90918 H1 WAT 310 134.123 14.650 118.553 1.00 0.00 H ATOM 90919 H2 WAT 310 132.720 14.634 119.120 1.00 0.00 H TER 90921 WAT 310 ATOM 90921 O WAT 311 98.229 138.281 147.479 1.00 0.00 O ATOM 90922 H1 WAT 311 98.515 139.184 147.618 1.00 0.00 H ATOM 90923 H2 WAT 311 98.931 137.884 146.963 1.00 0.00 H TER 90925 WAT 311 ATOM 90925 O WAT 312 113.605 9.076 94.860 1.00 0.00 O ATOM 90926 H1 WAT 312 113.228 9.953 94.787 1.00 0.00 H ATOM 90927 H2 WAT 312 114.535 9.199 94.667 1.00 0.00 H TER 90929 WAT 312 ATOM 90929 O WAT 313 31.960 91.326 118.149 1.00 0.00 O ATOM 90930 H1 WAT 313 32.564 91.988 117.811 1.00 0.00 H ATOM 90931 H2 WAT 313 31.252 91.830 118.551 1.00 0.00 H TER 90933 WAT 313 ATOM 90933 O WAT 314 37.189 122.507 73.332 1.00 0.00 O ATOM 90934 H1 WAT 314 36.951 123.335 72.915 1.00 0.00 H ATOM 90935 H2 WAT 314 36.564 121.873 72.981 1.00 0.00 H TER 90937 WAT 314 ATOM 90937 O WAT 315 142.898 74.519 1.326 1.00 0.00 O ATOM 90938 H1 WAT 315 142.088 74.610 0.823 1.00 0.00 H ATOM 90939 H2 WAT 315 142.871 73.623 1.661 1.00 0.00 H TER 90941 WAT 315 ATOM 90941 O WAT 316 89.155 95.173 28.755 1.00 0.00 O ATOM 90942 H1 WAT 316 89.511 94.798 27.949 1.00 0.00 H ATOM 90943 H2 WAT 316 88.642 94.465 29.143 1.00 0.00 H TER 90945 WAT 316 ATOM 90945 O WAT 317 55.124 90.394 4.857 1.00 0.00 O ATOM 90946 H1 WAT 317 54.633 91.189 4.650 1.00 0.00 H ATOM 90947 H2 WAT 317 54.568 89.681 4.542 1.00 0.00 H TER 90949 WAT 317 ATOM 90949 O WAT 318 101.856 101.030 99.596 1.00 0.00 O ATOM 90950 H1 WAT 318 102.644 100.794 99.106 1.00 0.00 H ATOM 90951 H2 WAT 318 102.119 100.968 100.515 1.00 0.00 H TER 90953 WAT 318 ATOM 90953 O WAT 319 138.674 127.575 83.333 1.00 0.00 O ATOM 90954 H1 WAT 319 139.052 128.129 84.017 1.00 0.00 H ATOM 90955 H2 WAT 319 138.395 126.784 83.794 1.00 0.00 H TER 90957 WAT 319 ATOM 90957 O WAT 320 115.200 65.708 82.086 1.00 0.00 O ATOM 90958 H1 WAT 320 114.678 66.500 81.959 1.00 0.00 H ATOM 90959 H2 WAT 320 115.506 65.765 82.991 1.00 0.00 H TER 90961 WAT 320 ATOM 90961 O WAT 321 110.923 7.252 7.121 1.00 0.00 O ATOM 90962 H1 WAT 321 111.201 8.133 7.371 1.00 0.00 H ATOM 90963 H2 WAT 321 109.973 7.258 7.240 1.00 0.00 H TER 90965 WAT 321 ATOM 90965 O WAT 322 16.729 35.384 154.925 1.00 0.00 O ATOM 90966 H1 WAT 322 16.935 35.492 155.853 1.00 0.00 H ATOM 90967 H2 WAT 322 15.777 35.472 154.879 1.00 0.00 H TER 90969 WAT 322 ATOM 90969 O WAT 323 125.957 62.504 84.739 1.00 0.00 O ATOM 90970 H1 WAT 323 126.253 61.998 83.982 1.00 0.00 H ATOM 90971 H2 WAT 323 125.543 63.280 84.362 1.00 0.00 H TER 90973 WAT 323 ATOM 90973 O WAT 324 43.913 4.597 8.441 1.00 0.00 O ATOM 90974 H1 WAT 324 44.495 4.252 7.764 1.00 0.00 H ATOM 90975 H2 WAT 324 44.459 5.207 8.938 1.00 0.00 H TER 90977 WAT 324 ATOM 90977 O WAT 325 12.451 118.963 23.516 1.00 0.00 O ATOM 90978 H1 WAT 325 12.195 119.096 22.603 1.00 0.00 H ATOM 90979 H2 WAT 325 12.766 118.060 23.547 1.00 0.00 H TER 90981 WAT 325 ATOM 90981 O WAT 326 141.044 115.765 115.901 1.00 0.00 O ATOM 90982 H1 WAT 326 140.971 116.682 115.635 1.00 0.00 H ATOM 90983 H2 WAT 326 141.366 115.314 115.120 1.00 0.00 H TER 90985 WAT 326 ATOM 90985 O WAT 327 34.594 53.306 63.213 1.00 0.00 O ATOM 90986 H1 WAT 327 34.971 54.165 63.402 1.00 0.00 H ATOM 90987 H2 WAT 327 35.337 52.776 62.924 1.00 0.00 H TER 90989 WAT 327 ATOM 90989 O WAT 328 111.832 23.785 18.224 1.00 0.00 O ATOM 90990 H1 WAT 328 111.811 23.788 19.181 1.00 0.00 H ATOM 90991 H2 WAT 328 112.539 23.180 18.001 1.00 0.00 H TER 90993 WAT 328 ATOM 90993 O WAT 329 68.119 137.218 5.591 1.00 0.00 O ATOM 90994 H1 WAT 329 68.755 136.653 5.152 1.00 0.00 H ATOM 90995 H2 WAT 329 68.222 137.016 6.521 1.00 0.00 H TER 90997 WAT 329 ATOM 90997 O WAT 330 106.779 2.320 56.781 1.00 0.00 O ATOM 90998 H1 WAT 330 107.235 2.633 57.562 1.00 0.00 H ATOM 90999 H2 WAT 330 106.726 3.088 56.211 1.00 0.00 H TER 91001 WAT 330 ATOM 91001 O WAT 331 106.844 14.137 62.916 1.00 0.00 O ATOM 91002 H1 WAT 331 106.345 13.563 63.496 1.00 0.00 H ATOM 91003 H2 WAT 331 107.465 13.555 62.478 1.00 0.00 H TER 91005 WAT 331 ATOM 91005 O WAT 332 74.071 61.068 81.534 1.00 0.00 O ATOM 91006 H1 WAT 332 75.014 61.169 81.666 1.00 0.00 H ATOM 91007 H2 WAT 332 73.883 61.578 80.747 1.00 0.00 H TER 91009 WAT 332 ATOM 91009 O WAT 333 130.247 130.784 108.246 1.00 0.00 O ATOM 91010 H1 WAT 333 130.779 130.024 108.007 1.00 0.00 H ATOM 91011 H2 WAT 333 130.134 130.709 109.193 1.00 0.00 H TER 91013 WAT 333 ATOM 91013 O WAT 334 142.751 126.495 133.361 1.00 0.00 O ATOM 91014 H1 WAT 334 142.863 125.545 133.400 1.00 0.00 H ATOM 91015 H2 WAT 334 141.955 126.663 133.864 1.00 0.00 H TER 91017 WAT 334 ATOM 91017 O WAT 335 128.994 29.411 132.297 1.00 0.00 O ATOM 91018 H1 WAT 335 128.232 28.835 132.229 1.00 0.00 H ATOM 91019 H2 WAT 335 129.324 29.479 131.401 1.00 0.00 H TER 91021 WAT 335 ATOM 91021 O WAT 336 87.662 23.269 17.186 1.00 0.00 O ATOM 91022 H1 WAT 336 88.578 23.008 17.282 1.00 0.00 H ATOM 91023 H2 WAT 336 87.191 22.722 17.815 1.00 0.00 H TER 91025 WAT 336 ATOM 91025 O WAT 337 111.179 114.204 86.528 1.00 0.00 O ATOM 91026 H1 WAT 337 111.601 114.919 87.004 1.00 0.00 H ATOM 91027 H2 WAT 337 111.892 113.780 86.051 1.00 0.00 H TER 91029 WAT 337 ATOM 91029 O WAT 338 50.522 98.060 154.804 1.00 0.00 O ATOM 91030 H1 WAT 338 51.450 98.280 154.886 1.00 0.00 H ATOM 91031 H2 WAT 338 50.226 98.554 154.040 1.00 0.00 H TER 91033 WAT 338 ATOM 91033 O WAT 339 129.390 89.704 96.754 1.00 0.00 O ATOM 91034 H1 WAT 339 128.463 89.867 96.582 1.00 0.00 H ATOM 91035 H2 WAT 339 129.394 88.994 97.396 1.00 0.00 H TER 91037 WAT 339 ATOM 91037 O WAT 340 126.341 107.694 149.157 1.00 0.00 O ATOM 91038 H1 WAT 340 125.757 107.674 148.399 1.00 0.00 H ATOM 91039 H2 WAT 340 126.452 108.625 149.349 1.00 0.00 H TER 91041 WAT 340 ATOM 91041 O WAT 341 2.844 25.286 92.462 1.00 0.00 O ATOM 91042 H1 WAT 341 1.935 25.128 92.716 1.00 0.00 H ATOM 91043 H2 WAT 341 2.875 26.219 92.251 1.00 0.00 H TER 91045 WAT 341 ATOM 91045 O WAT 342 39.158 81.976 148.769 1.00 0.00 O ATOM 91046 H1 WAT 342 38.413 81.611 148.292 1.00 0.00 H ATOM 91047 H2 WAT 342 39.479 82.683 148.209 1.00 0.00 H TER 91049 WAT 342 ATOM 91049 O WAT 343 139.815 119.167 117.811 1.00 0.00 O ATOM 91050 H1 WAT 343 139.323 118.764 118.526 1.00 0.00 H ATOM 91051 H2 WAT 343 140.488 119.689 118.249 1.00 0.00 H TER 91053 WAT 343 ATOM 91053 O WAT 344 5.509 109.503 87.742 1.00 0.00 O ATOM 91054 H1 WAT 344 4.991 110.016 87.122 1.00 0.00 H ATOM 91055 H2 WAT 344 4.908 109.321 88.465 1.00 0.00 H TER 91057 WAT 344 ATOM 91057 O WAT 345 90.799 122.884 96.678 1.00 0.00 O ATOM 91058 H1 WAT 345 90.593 122.146 96.104 1.00 0.00 H ATOM 91059 H2 WAT 345 91.708 122.737 96.939 1.00 0.00 H TER 91061 WAT 345 ATOM 91061 O WAT 346 140.010 101.777 113.448 1.00 0.00 O ATOM 91062 H1 WAT 346 139.183 101.625 113.903 1.00 0.00 H ATOM 91063 H2 WAT 346 139.758 101.935 112.538 1.00 0.00 H TER 91065 WAT 346 ATOM 91065 O WAT 347 40.407 114.804 8.373 1.00 0.00 O ATOM 91066 H1 WAT 347 40.923 115.245 9.048 1.00 0.00 H ATOM 91067 H2 WAT 347 39.499 114.912 8.657 1.00 0.00 H TER 91069 WAT 347 ATOM 91069 O WAT 348 67.186 126.381 84.538 1.00 0.00 O ATOM 91070 H1 WAT 348 67.978 126.483 85.066 1.00 0.00 H ATOM 91071 H2 WAT 348 66.472 126.375 85.176 1.00 0.00 H TER 91073 WAT 348 ATOM 91073 O WAT 349 114.853 22.434 142.240 1.00 0.00 O ATOM 91074 H1 WAT 349 115.746 22.236 141.955 1.00 0.00 H ATOM 91075 H2 WAT 349 114.384 21.605 142.146 1.00 0.00 H TER 91077 WAT 349 ATOM 91077 O WAT 350 114.611 20.256 55.915 1.00 0.00 O ATOM 91078 H1 WAT 350 114.449 20.386 56.849 1.00 0.00 H ATOM 91079 H2 WAT 350 115.506 20.568 55.781 1.00 0.00 H TER 91081 WAT 350 ATOM 91081 O WAT 351 19.685 74.284 85.089 1.00 0.00 O ATOM 91082 H1 WAT 351 19.694 75.242 85.090 1.00 0.00 H ATOM 91083 H2 WAT 351 19.996 74.041 85.961 1.00 0.00 H TER 91085 WAT 351 ATOM 91085 O WAT 352 91.543 99.398 134.883 1.00 0.00 O ATOM 91086 H1 WAT 352 91.541 98.893 134.070 1.00 0.00 H ATOM 91087 H2 WAT 352 92.218 100.064 134.749 1.00 0.00 H TER 91089 WAT 352 ATOM 91089 O WAT 353 20.719 143.278 105.118 1.00 0.00 O ATOM 91090 H1 WAT 353 20.524 142.900 105.976 1.00 0.00 H ATOM 91091 H2 WAT 353 21.292 142.636 104.699 1.00 0.00 H TER 91093 WAT 353 ATOM 91093 O WAT 354 32.710 19.405 9.277 1.00 0.00 O ATOM 91094 H1 WAT 354 33.256 19.168 8.527 1.00 0.00 H ATOM 91095 H2 WAT 354 32.346 18.574 9.581 1.00 0.00 H TER 91097 WAT 354 ATOM 91097 O WAT 355 37.511 50.703 95.054 1.00 0.00 O ATOM 91098 H1 WAT 355 36.944 50.834 95.814 1.00 0.00 H ATOM 91099 H2 WAT 355 37.502 51.547 94.601 1.00 0.00 H TER 91101 WAT 355 ATOM 91101 O WAT 356 46.338 68.081 63.756 1.00 0.00 O ATOM 91102 H1 WAT 356 46.819 67.390 64.213 1.00 0.00 H ATOM 91103 H2 WAT 356 45.433 67.978 64.051 1.00 0.00 H TER 91105 WAT 356 ATOM 91105 O WAT 357 94.706 119.553 152.764 1.00 0.00 O ATOM 91106 H1 WAT 357 94.687 118.596 152.766 1.00 0.00 H ATOM 91107 H2 WAT 357 94.169 119.804 153.516 1.00 0.00 H TER 91109 WAT 357 ATOM 91109 O WAT 358 77.588 110.538 84.144 1.00 0.00 O ATOM 91110 H1 WAT 358 77.791 111.474 84.147 1.00 0.00 H ATOM 91111 H2 WAT 358 78.409 110.117 83.889 1.00 0.00 H TER 91113 WAT 358 ATOM 91113 O WAT 359 25.717 45.757 157.421 1.00 0.00 O ATOM 91114 H1 WAT 359 25.444 46.655 157.230 1.00 0.00 H ATOM 91115 H2 WAT 359 25.866 45.749 158.367 1.00 0.00 H TER 91117 WAT 359 ATOM 91117 O WAT 360 43.262 23.017 92.360 1.00 0.00 O ATOM 91118 H1 WAT 360 44.010 23.465 92.756 1.00 0.00 H ATOM 91119 H2 WAT 360 42.993 23.589 91.642 1.00 0.00 H TER 91121 WAT 360 ATOM 91121 O WAT 361 34.712 134.918 6.969 1.00 0.00 O ATOM 91122 H1 WAT 361 35.538 135.400 6.958 1.00 0.00 H ATOM 91123 H2 WAT 361 34.047 135.586 7.135 1.00 0.00 H TER 91125 WAT 361 ATOM 91125 O WAT 362 64.652 99.346 1.913 1.00 0.00 O ATOM 91126 H1 WAT 362 63.766 99.155 1.605 1.00 0.00 H ATOM 91127 H2 WAT 362 65.224 98.893 1.293 1.00 0.00 H TER 91129 WAT 362 ATOM 91129 O WAT 363 73.067 9.952 113.878 1.00 0.00 O ATOM 91130 H1 WAT 363 73.200 10.900 113.885 1.00 0.00 H ATOM 91131 H2 WAT 363 72.649 9.775 113.035 1.00 0.00 H TER 91133 WAT 363 ATOM 91133 O WAT 364 140.408 35.662 92.904 1.00 0.00 O ATOM 91134 H1 WAT 364 140.936 34.971 93.305 1.00 0.00 H ATOM 91135 H2 WAT 364 140.015 36.123 93.645 1.00 0.00 H TER 91137 WAT 364 ATOM 91137 O WAT 365 0.014 3.060 68.717 1.00 0.00 O ATOM 91138 H1 WAT 365 0.769 3.448 69.160 1.00 0.00 H ATOM 91139 H2 WAT 365 -0.745 3.427 69.170 1.00 0.00 H TER 91141 WAT 365 ATOM 91141 O WAT 366 13.610 62.197 0.915 1.00 0.00 O ATOM 91142 H1 WAT 366 14.031 62.839 1.487 1.00 0.00 H ATOM 91143 H2 WAT 366 12.681 62.425 0.943 1.00 0.00 H TER 91145 WAT 366 ATOM 91145 O WAT 367 140.310 137.277 93.276 1.00 0.00 O ATOM 91146 H1 WAT 367 139.985 138.173 93.363 1.00 0.00 H ATOM 91147 H2 WAT 367 139.653 136.739 93.716 1.00 0.00 H TER 91149 WAT 367 ATOM 91149 O WAT 368 95.273 94.901 66.110 1.00 0.00 O ATOM 91150 H1 WAT 368 94.531 95.217 65.594 1.00 0.00 H ATOM 91151 H2 WAT 368 95.855 94.494 65.468 1.00 0.00 H TER 91153 WAT 368 ATOM 91153 O WAT 369 19.560 97.097 101.647 1.00 0.00 O ATOM 91154 H1 WAT 369 20.184 97.799 101.827 1.00 0.00 H ATOM 91155 H2 WAT 369 19.042 97.421 100.909 1.00 0.00 H TER 91157 WAT 369 ATOM 91157 O WAT 370 142.805 38.831 115.645 1.00 0.00 O ATOM 91158 H1 WAT 370 143.651 39.115 115.991 1.00 0.00 H ATOM 91159 H2 WAT 370 142.514 39.559 115.096 1.00 0.00 H TER 91161 WAT 370 ATOM 91161 O WAT 371 23.994 99.387 22.964 1.00 0.00 O ATOM 91162 H1 WAT 371 24.267 100.225 23.336 1.00 0.00 H ATOM 91163 H2 WAT 371 23.157 99.197 23.388 1.00 0.00 H TER 91165 WAT 371 ATOM 91165 O WAT 372 87.196 3.900 82.247 1.00 0.00 O ATOM 91166 H1 WAT 372 87.406 4.655 81.697 1.00 0.00 H ATOM 91167 H2 WAT 372 86.283 4.036 82.502 1.00 0.00 H TER 91169 WAT 372 ATOM 91169 O WAT 373 40.118 11.818 57.286 1.00 0.00 O ATOM 91170 H1 WAT 373 40.334 11.319 56.498 1.00 0.00 H ATOM 91171 H2 WAT 373 39.501 12.486 56.984 1.00 0.00 H TER 91173 WAT 373 ATOM 91173 O WAT 374 75.077 108.175 7.472 1.00 0.00 O ATOM 91174 H1 WAT 374 74.301 108.639 7.786 1.00 0.00 H ATOM 91175 H2 WAT 374 75.087 108.336 6.529 1.00 0.00 H TER 91177 WAT 374 ATOM 91177 O WAT 375 134.660 90.750 91.736 1.00 0.00 O ATOM 91178 H1 WAT 375 134.614 91.613 92.148 1.00 0.00 H ATOM 91179 H2 WAT 375 134.220 90.863 90.893 1.00 0.00 H TER 91181 WAT 375 ATOM 91181 O WAT 376 119.425 26.104 85.318 1.00 0.00 O ATOM 91182 H1 WAT 376 119.028 26.300 84.470 1.00 0.00 H ATOM 91183 H2 WAT 376 118.773 25.567 85.769 1.00 0.00 H TER 91185 WAT 376 ATOM 91185 O WAT 377 53.448 83.615 129.525 1.00 0.00 O ATOM 91186 H1 WAT 377 53.434 83.353 128.605 1.00 0.00 H ATOM 91187 H2 WAT 377 53.074 82.868 129.993 1.00 0.00 H TER 91189 WAT 377 ATOM 91189 O WAT 378 115.985 2.874 58.714 1.00 0.00 O ATOM 91190 H1 WAT 378 116.300 1.984 58.871 1.00 0.00 H ATOM 91191 H2 WAT 378 115.127 2.755 58.307 1.00 0.00 H TER 91193 WAT 378 ATOM 91193 O WAT 379 80.722 86.739 104.898 1.00 0.00 O ATOM 91194 H1 WAT 379 80.848 86.628 103.956 1.00 0.00 H ATOM 91195 H2 WAT 379 81.605 86.857 105.246 1.00 0.00 H TER 91197 WAT 379 ATOM 91197 O WAT 380 45.244 7.176 82.369 1.00 0.00 O ATOM 91198 H1 WAT 380 44.941 6.301 82.609 1.00 0.00 H ATOM 91199 H2 WAT 380 44.451 7.713 82.370 1.00 0.00 H TER 91201 WAT 380 ATOM 91201 O WAT 381 53.243 113.404 129.104 1.00 0.00 O ATOM 91202 H1 WAT 381 53.657 114.219 128.818 1.00 0.00 H ATOM 91203 H2 WAT 381 52.445 113.344 128.580 1.00 0.00 H TER 91205 WAT 381 ATOM 91205 O WAT 382 140.008 141.127 9.273 1.00 0.00 O ATOM 91206 H1 WAT 382 140.630 140.637 9.809 1.00 0.00 H ATOM 91207 H2 WAT 382 140.539 141.495 8.566 1.00 0.00 H TER 91209 WAT 382 ATOM 91209 O WAT 383 144.025 90.439 12.728 1.00 0.00 O ATOM 91210 H1 WAT 383 143.107 90.706 12.760 1.00 0.00 H ATOM 91211 H2 WAT 383 144.055 89.760 12.054 1.00 0.00 H TER 91213 WAT 383 ATOM 91213 O WAT 384 45.684 122.935 57.696 1.00 0.00 O ATOM 91214 H1 WAT 384 45.886 123.828 57.417 1.00 0.00 H ATOM 91215 H2 WAT 384 45.109 122.594 57.011 1.00 0.00 H TER 91217 WAT 384 ATOM 91217 O WAT 385 88.380 20.403 140.995 1.00 0.00 O ATOM 91218 H1 WAT 385 88.687 21.111 141.560 1.00 0.00 H ATOM 91219 H2 WAT 385 87.470 20.630 140.799 1.00 0.00 H TER 91221 WAT 385 ATOM 91221 O WAT 386 18.249 96.882 67.033 1.00 0.00 O ATOM 91222 H1 WAT 386 18.439 97.108 66.122 1.00 0.00 H ATOM 91223 H2 WAT 386 17.324 97.097 67.145 1.00 0.00 H TER 91225 WAT 386 ATOM 91225 O WAT 387 31.831 131.113 10.336 1.00 0.00 O ATOM 91226 H1 WAT 387 31.022 130.603 10.341 1.00 0.00 H ATOM 91227 H2 WAT 387 32.208 130.975 11.205 1.00 0.00 H TER 91229 WAT 387 ATOM 91229 O WAT 388 15.607 33.574 17.167 1.00 0.00 O ATOM 91230 H1 WAT 388 16.551 33.603 17.013 1.00 0.00 H ATOM 91231 H2 WAT 388 15.405 34.417 17.573 1.00 0.00 H TER 91233 WAT 388 ATOM 91233 O WAT 389 63.699 100.327 105.923 1.00 0.00 O ATOM 91234 H1 WAT 389 63.183 100.863 106.525 1.00 0.00 H ATOM 91235 H2 WAT 389 63.139 99.573 105.734 1.00 0.00 H TER 91237 WAT 389 ATOM 91237 O WAT 390 86.165 111.716 156.959 1.00 0.00 O ATOM 91238 H1 WAT 390 85.703 112.486 157.288 1.00 0.00 H ATOM 91239 H2 WAT 390 86.014 111.044 157.623 1.00 0.00 H TER 91241 WAT 390 ATOM 91241 O WAT 391 18.204 28.507 71.055 1.00 0.00 O ATOM 91242 H1 WAT 391 18.969 28.377 71.616 1.00 0.00 H ATOM 91243 H2 WAT 391 18.350 27.921 70.312 1.00 0.00 H TER 91245 WAT 391 ATOM 91245 O WAT 392 44.468 28.897 156.728 1.00 0.00 O ATOM 91246 H1 WAT 392 45.355 28.542 156.787 1.00 0.00 H ATOM 91247 H2 WAT 392 44.362 29.409 157.530 1.00 0.00 H TER 91249 WAT 392 ATOM 91249 O WAT 393 28.760 31.292 135.127 1.00 0.00 O ATOM 91250 H1 WAT 393 28.910 30.347 135.104 1.00 0.00 H ATOM 91251 H2 WAT 393 28.184 31.425 135.880 1.00 0.00 H TER 91253 WAT 393 ATOM 91253 O WAT 394 109.027 76.520 23.105 1.00 0.00 O ATOM 91254 H1 WAT 394 109.015 77.007 23.929 1.00 0.00 H ATOM 91255 H2 WAT 394 108.144 76.159 23.027 1.00 0.00 H TER 91257 WAT 394 ATOM 91257 O WAT 395 59.884 34.181 108.436 1.00 0.00 O ATOM 91258 H1 WAT 395 59.907 35.113 108.220 1.00 0.00 H ATOM 91259 H2 WAT 395 59.469 33.769 107.679 1.00 0.00 H TER 91261 WAT 395 ATOM 91261 O WAT 396 34.964 16.382 104.248 1.00 0.00 O ATOM 91262 H1 WAT 396 35.420 17.219 104.156 1.00 0.00 H ATOM 91263 H2 WAT 396 35.663 15.742 104.383 1.00 0.00 H TER 91265 WAT 396 ATOM 91265 O WAT 397 141.810 56.031 132.132 1.00 0.00 O ATOM 91266 H1 WAT 397 141.092 55.414 132.269 1.00 0.00 H ATOM 91267 H2 WAT 397 141.587 56.482 131.318 1.00 0.00 H TER 91269 WAT 397 ATOM 91269 O WAT 398 65.034 138.217 112.207 1.00 0.00 O ATOM 91270 H1 WAT 398 65.241 138.906 112.838 1.00 0.00 H ATOM 91271 H2 WAT 398 65.258 138.595 111.356 1.00 0.00 H TER 91273 WAT 398 ATOM 91273 O WAT 399 73.615 5.576 88.825 1.00 0.00 O ATOM 91274 H1 WAT 399 73.441 6.396 88.363 1.00 0.00 H ATOM 91275 H2 WAT 399 73.765 4.936 88.130 1.00 0.00 H TER 91277 WAT 399 ATOM 91277 O WAT 400 137.820 26.769 83.799 1.00 0.00 O ATOM 91278 H1 WAT 400 137.044 27.170 83.408 1.00 0.00 H ATOM 91279 H2 WAT 400 137.553 25.870 83.991 1.00 0.00 H TER 91281 WAT 400 ATOM 91281 O WAT 401 104.836 129.793 74.526 1.00 0.00 O ATOM 91282 H1 WAT 401 104.576 128.946 74.164 1.00 0.00 H ATOM 91283 H2 WAT 401 105.662 129.998 74.088 1.00 0.00 H TER 91285 WAT 401 ATOM 91285 O WAT 402 54.055 14.969 20.482 1.00 0.00 O ATOM 91286 H1 WAT 402 53.721 14.087 20.318 1.00 0.00 H ATOM 91287 H2 WAT 402 53.312 15.440 20.860 1.00 0.00 H TER 91289 WAT 402 ATOM 91289 O WAT 403 110.382 109.184 155.972 1.00 0.00 O ATOM 91290 H1 WAT 403 110.018 108.528 155.378 1.00 0.00 H ATOM 91291 H2 WAT 403 111.043 109.639 155.450 1.00 0.00 H TER 91293 WAT 403 ATOM 91293 O WAT 404 75.207 89.245 62.119 1.00 0.00 O ATOM 91294 H1 WAT 404 74.643 89.988 61.906 1.00 0.00 H ATOM 91295 H2 WAT 404 75.696 89.076 61.314 1.00 0.00 H TER 91297 WAT 404 ATOM 91297 O WAT 405 82.857 108.384 131.544 1.00 0.00 O ATOM 91298 H1 WAT 405 82.876 109.307 131.293 1.00 0.00 H ATOM 91299 H2 WAT 405 83.607 108.278 132.129 1.00 0.00 H TER 91301 WAT 405 ATOM 91301 O WAT 406 1.731 60.532 115.536 1.00 0.00 O ATOM 91302 H1 WAT 406 1.498 60.457 114.610 1.00 0.00 H ATOM 91303 H2 WAT 406 1.407 59.722 115.931 1.00 0.00 H TER 91305 WAT 406 ATOM 91305 O WAT 407 54.336 51.377 91.109 1.00 0.00 O ATOM 91306 H1 WAT 407 55.267 51.506 90.927 1.00 0.00 H ATOM 91307 H2 WAT 407 54.058 52.192 91.527 1.00 0.00 H TER 91309 WAT 407 ATOM 91309 O WAT 408 55.294 41.804 1.455 1.00 0.00 O ATOM 91310 H1 WAT 408 56.142 42.037 1.833 1.00 0.00 H ATOM 91311 H2 WAT 408 54.903 41.208 2.093 1.00 0.00 H TER 91313 WAT 408 ATOM 91313 O WAT 409 98.001 59.509 10.243 1.00 0.00 O ATOM 91314 H1 WAT 409 98.147 58.892 9.526 1.00 0.00 H ATOM 91315 H2 WAT 409 98.454 60.307 9.969 1.00 0.00 H TER 91317 WAT 409 ATOM 91317 O WAT 410 2.113 145.835 147.012 1.00 0.00 O ATOM 91318 H1 WAT 410 1.189 146.020 146.848 1.00 0.00 H ATOM 91319 H2 WAT 410 2.196 144.890 146.880 1.00 0.00 H TER 91321 WAT 410 ATOM 91321 O WAT 411 78.180 70.249 56.562 1.00 0.00 O ATOM 91322 H1 WAT 411 77.714 71.079 56.665 1.00 0.00 H ATOM 91323 H2 WAT 411 78.437 70.230 55.640 1.00 0.00 H TER 91325 WAT 411 ATOM 91325 O WAT 412 138.737 136.268 2.052 1.00 0.00 O ATOM 91326 H1 WAT 412 138.263 136.047 2.853 1.00 0.00 H ATOM 91327 H2 WAT 412 138.960 135.422 1.664 1.00 0.00 H TER 91329 WAT 412 ATOM 91329 O WAT 413 14.130 18.952 70.219 1.00 0.00 O ATOM 91330 H1 WAT 413 14.165 18.006 70.081 1.00 0.00 H ATOM 91331 H2 WAT 413 13.345 19.087 70.751 1.00 0.00 H TER 91333 WAT 413 ATOM 91333 O WAT 414 42.440 2.343 125.806 1.00 0.00 O ATOM 91334 H1 WAT 414 42.185 2.243 124.889 1.00 0.00 H ATOM 91335 H2 WAT 414 42.399 1.456 126.165 1.00 0.00 H TER 91337 WAT 414 ATOM 91337 O WAT 415 86.619 85.834 151.091 1.00 0.00 O ATOM 91338 H1 WAT 415 86.931 85.915 150.190 1.00 0.00 H ATOM 91339 H2 WAT 415 87.031 85.034 151.416 1.00 0.00 H TER 91341 WAT 415 ATOM 91341 O WAT 416 117.431 64.150 91.536 1.00 0.00 O ATOM 91342 H1 WAT 416 116.829 64.790 91.916 1.00 0.00 H ATOM 91343 H2 WAT 416 117.675 63.586 92.270 1.00 0.00 H TER 91345 WAT 416 ATOM 91345 O WAT 417 61.895 57.225 106.007 1.00 0.00 O ATOM 91346 H1 WAT 417 61.614 56.491 105.461 1.00 0.00 H ATOM 91347 H2 WAT 417 61.279 57.928 105.799 1.00 0.00 H TER 91349 WAT 417 ATOM 91349 O WAT 418 72.549 80.043 151.942 1.00 0.00 O ATOM 91350 H1 WAT 418 73.356 80.120 152.450 1.00 0.00 H ATOM 91351 H2 WAT 418 72.823 79.650 151.114 1.00 0.00 H TER 91353 WAT 418 ATOM 91353 O WAT 419 51.439 115.711 77.507 1.00 0.00 O ATOM 91354 H1 WAT 419 51.551 116.660 77.568 1.00 0.00 H ATOM 91355 H2 WAT 419 50.733 115.514 78.123 1.00 0.00 H TER 91357 WAT 419 ATOM 91357 O WAT 420 0.570 1.103 153.301 1.00 0.00 O ATOM 91358 H1 WAT 420 0.864 2.013 153.338 1.00 0.00 H ATOM 91359 H2 WAT 420 -0.240 1.091 153.811 1.00 0.00 H TER 91361 WAT 420 ATOM 91361 O WAT 421 32.490 66.709 77.495 1.00 0.00 O ATOM 91362 H1 WAT 421 32.748 67.600 77.260 1.00 0.00 H ATOM 91363 H2 WAT 421 31.555 66.775 77.692 1.00 0.00 H TER 91365 WAT 421 ATOM 91365 O WAT 422 28.315 127.334 86.052 1.00 0.00 O ATOM 91366 H1 WAT 422 28.971 127.806 86.566 1.00 0.00 H ATOM 91367 H2 WAT 422 27.547 127.294 86.623 1.00 0.00 H TER 91369 WAT 422 ATOM 91369 O WAT 423 75.902 70.372 135.291 1.00 0.00 O ATOM 91370 H1 WAT 423 76.103 70.915 134.529 1.00 0.00 H ATOM 91371 H2 WAT 423 75.001 70.601 135.518 1.00 0.00 H TER 91373 WAT 423 ATOM 91373 O WAT 424 -0.039 78.773 63.536 1.00 0.00 O ATOM 91374 H1 WAT 424 0.139 78.299 64.348 1.00 0.00 H ATOM 91375 H2 WAT 424 0.711 79.358 63.430 1.00 0.00 H TER 91377 WAT 424 ATOM 91377 O WAT 425 16.565 134.826 86.504 1.00 0.00 O ATOM 91378 H1 WAT 425 17.503 134.637 86.532 1.00 0.00 H ATOM 91379 H2 WAT 425 16.415 135.404 87.252 1.00 0.00 H TER 91381 WAT 425 ATOM 91381 O WAT 426 143.982 126.691 128.729 1.00 0.00 O ATOM 91382 H1 WAT 426 143.788 127.028 129.603 1.00 0.00 H ATOM 91383 H2 WAT 426 143.207 126.184 128.490 1.00 0.00 H TER 91385 WAT 426 ATOM 91385 O WAT 427 141.385 100.044 14.155 1.00 0.00 O ATOM 91386 H1 WAT 427 141.682 99.495 14.881 1.00 0.00 H ATOM 91387 H2 WAT 427 140.666 100.558 14.521 1.00 0.00 H TER 91389 WAT 427 ATOM 91389 O WAT 428 138.693 83.722 61.790 1.00 0.00 O ATOM 91390 H1 WAT 428 139.498 83.532 61.308 1.00 0.00 H ATOM 91391 H2 WAT 428 138.025 83.819 61.112 1.00 0.00 H TER 91393 WAT 428 ATOM 91393 O WAT 429 83.224 86.746 130.754 1.00 0.00 O ATOM 91394 H1 WAT 429 82.814 87.570 131.016 1.00 0.00 H ATOM 91395 H2 WAT 429 82.850 86.094 131.347 1.00 0.00 H TER 91397 WAT 429 ATOM 91397 O WAT 430 110.814 71.726 68.334 1.00 0.00 O ATOM 91398 H1 WAT 430 110.626 71.313 69.177 1.00 0.00 H ATOM 91399 H2 WAT 430 109.979 71.706 67.866 1.00 0.00 H TER 91401 WAT 430 ATOM 91401 O WAT 431 97.191 125.284 123.918 1.00 0.00 O ATOM 91402 H1 WAT 431 96.801 124.421 123.778 1.00 0.00 H ATOM 91403 H2 WAT 431 97.355 125.619 123.036 1.00 0.00 H TER 91405 WAT 431 ATOM 91405 O WAT 432 134.599 132.851 140.449 1.00 0.00 O ATOM 91406 H1 WAT 432 133.814 133.164 140.898 1.00 0.00 H ATOM 91407 H2 WAT 432 134.380 131.961 140.175 1.00 0.00 H TER 91409 WAT 432 ATOM 91409 O WAT 433 13.632 66.066 134.311 1.00 0.00 O ATOM 91410 H1 WAT 433 14.586 66.144 134.307 1.00 0.00 H ATOM 91411 H2 WAT 433 13.355 66.478 133.493 1.00 0.00 H TER 91413 WAT 433 ATOM 91413 O WAT 434 36.231 3.790 72.013 1.00 0.00 O ATOM 91414 H1 WAT 434 36.536 3.202 71.322 1.00 0.00 H ATOM 91415 H2 WAT 434 36.156 3.232 72.786 1.00 0.00 H TER 91417 WAT 434 ATOM 91417 O WAT 435 4.779 117.494 133.397 1.00 0.00 O ATOM 91418 H1 WAT 435 4.862 118.089 132.652 1.00 0.00 H ATOM 91419 H2 WAT 435 4.237 117.971 134.025 1.00 0.00 H TER 91421 WAT 435 ATOM 91421 O WAT 436 98.712 114.882 101.569 1.00 0.00 O ATOM 91422 H1 WAT 436 99.082 115.324 102.333 1.00 0.00 H ATOM 91423 H2 WAT 436 99.200 115.240 100.827 1.00 0.00 H TER 91425 WAT 436 ATOM 91425 O WAT 437 78.632 30.100 62.864 1.00 0.00 O ATOM 91426 H1 WAT 437 79.529 30.391 63.030 1.00 0.00 H ATOM 91427 H2 WAT 437 78.372 30.567 62.070 1.00 0.00 H TER 91429 WAT 437 ATOM 91429 O WAT 438 144.706 77.520 120.462 1.00 0.00 O ATOM 91430 H1 WAT 438 144.292 78.272 120.039 1.00 0.00 H ATOM 91431 H2 WAT 438 145.264 77.903 121.139 1.00 0.00 H TER 91433 WAT 438 ATOM 91433 O WAT 439 51.815 31.683 20.492 1.00 0.00 O ATOM 91434 H1 WAT 439 51.054 32.127 20.865 1.00 0.00 H ATOM 91435 H2 WAT 439 51.545 31.449 19.604 1.00 0.00 H TER 91437 WAT 439 ATOM 91437 O WAT 440 17.650 46.010 68.896 1.00 0.00 O ATOM 91438 H1 WAT 440 18.136 45.189 68.974 1.00 0.00 H ATOM 91439 H2 WAT 440 18.321 46.669 68.719 1.00 0.00 H TER 91441 WAT 440 ATOM 91441 O WAT 441 65.849 33.646 16.076 1.00 0.00 O ATOM 91442 H1 WAT 441 66.650 34.096 16.343 1.00 0.00 H ATOM 91443 H2 WAT 441 65.427 33.400 16.900 1.00 0.00 H TER 91445 WAT 441 ATOM 91445 O WAT 442 15.590 97.189 118.608 1.00 0.00 O ATOM 91446 H1 WAT 442 16.191 96.904 117.920 1.00 0.00 H ATOM 91447 H2 WAT 442 16.105 97.132 119.413 1.00 0.00 H TER 91449 WAT 442 ATOM 91449 O WAT 443 87.028 90.832 15.267 1.00 0.00 O ATOM 91450 H1 WAT 443 86.849 91.507 15.922 1.00 0.00 H ATOM 91451 H2 WAT 443 87.347 91.315 14.505 1.00 0.00 H TER 91453 WAT 443 ATOM 91453 O WAT 444 52.832 53.541 144.635 1.00 0.00 O ATOM 91454 H1 WAT 444 52.694 54.112 143.879 1.00 0.00 H ATOM 91455 H2 WAT 444 52.964 52.671 144.257 1.00 0.00 H TER 91457 WAT 444 ATOM 91457 O WAT 445 140.475 60.182 136.970 1.00 0.00 O ATOM 91458 H1 WAT 445 139.637 59.770 136.759 1.00 0.00 H ATOM 91459 H2 WAT 445 140.513 60.171 137.927 1.00 0.00 H TER 91461 WAT 445 ATOM 91461 O WAT 446 16.758 100.716 7.326 1.00 0.00 O ATOM 91462 H1 WAT 446 16.070 100.363 6.762 1.00 0.00 H ATOM 91463 H2 WAT 446 16.427 100.589 8.215 1.00 0.00 H TER 91465 WAT 446 ATOM 91465 O WAT 447 125.877 49.620 58.055 1.00 0.00 O ATOM 91466 H1 WAT 447 126.033 49.851 57.140 1.00 0.00 H ATOM 91467 H2 WAT 447 126.129 50.403 58.546 1.00 0.00 H TER 91469 WAT 447 ATOM 91469 O WAT 448 76.519 123.803 149.639 1.00 0.00 O ATOM 91470 H1 WAT 448 76.687 124.470 148.972 1.00 0.00 H ATOM 91471 H2 WAT 448 77.353 123.342 149.730 1.00 0.00 H TER 91473 WAT 448 ATOM 91473 O WAT 449 8.840 14.763 125.531 1.00 0.00 O ATOM 91474 H1 WAT 449 8.982 14.531 126.448 1.00 0.00 H ATOM 91475 H2 WAT 449 8.411 15.618 125.563 1.00 0.00 H TER 91477 WAT 449 ATOM 91477 O WAT 450 85.036 33.818 154.898 1.00 0.00 O ATOM 91478 H1 WAT 450 85.852 33.321 154.946 1.00 0.00 H ATOM 91479 H2 WAT 450 85.069 34.252 154.045 1.00 0.00 H TER 91481 WAT 450 ATOM 91481 O WAT 451 138.830 54.393 17.199 1.00 0.00 O ATOM 91482 H1 WAT 451 138.502 54.359 18.097 1.00 0.00 H ATOM 91483 H2 WAT 451 138.367 53.688 16.747 1.00 0.00 H TER 91485 WAT 451 ATOM 91485 O WAT 452 75.912 23.712 10.778 1.00 0.00 O ATOM 91486 H1 WAT 452 75.258 23.230 11.284 1.00 0.00 H ATOM 91487 H2 WAT 452 76.681 23.142 10.777 1.00 0.00 H TER 91489 WAT 452 ATOM 91489 O WAT 453 99.388 104.957 153.875 1.00 0.00 O ATOM 91490 H1 WAT 453 99.746 104.121 154.173 1.00 0.00 H ATOM 91491 H2 WAT 453 100.156 105.514 153.745 1.00 0.00 H TER 91493 WAT 453 ATOM 91493 O WAT 454 141.878 104.915 135.869 1.00 0.00 O ATOM 91494 H1 WAT 454 142.341 105.117 136.682 1.00 0.00 H ATOM 91495 H2 WAT 454 142.389 104.210 135.471 1.00 0.00 H TER 91497 WAT 454 ATOM 91497 O WAT 455 41.238 68.092 86.587 1.00 0.00 O ATOM 91498 H1 WAT 455 41.624 67.267 86.291 1.00 0.00 H ATOM 91499 H2 WAT 455 40.678 67.844 87.323 1.00 0.00 H TER 91501 WAT 455 ATOM 91501 O WAT 456 111.265 117.462 1.759 1.00 0.00 O ATOM 91502 H1 WAT 456 110.552 116.847 1.585 1.00 0.00 H ATOM 91503 H2 WAT 456 110.861 118.154 2.283 1.00 0.00 H TER 91505 WAT 456 ATOM 91505 O WAT 457 42.870 83.783 14.186 1.00 0.00 O ATOM 91506 H1 WAT 457 42.419 83.823 13.342 1.00 0.00 H ATOM 91507 H2 WAT 457 43.675 84.282 14.050 1.00 0.00 H TER 91509 WAT 457 ATOM 91509 O WAT 458 5.325 121.376 9.107 1.00 0.00 O ATOM 91510 H1 WAT 458 5.784 121.265 9.940 1.00 0.00 H ATOM 91511 H2 WAT 458 5.126 122.311 9.066 1.00 0.00 H TER 91513 WAT 458 ATOM 91513 O WAT 459 48.176 126.559 154.660 1.00 0.00 O ATOM 91514 H1 WAT 459 47.230 126.692 154.600 1.00 0.00 H ATOM 91515 H2 WAT 459 48.299 125.625 154.491 1.00 0.00 H TER 91517 WAT 459 ATOM 91517 O WAT 460 138.295 74.993 72.196 1.00 0.00 O ATOM 91518 H1 WAT 460 137.840 75.797 72.449 1.00 0.00 H ATOM 91519 H2 WAT 460 139.141 75.048 72.640 1.00 0.00 H TER 91521 WAT 460 ATOM 91521 O WAT 461 31.852 39.353 16.629 1.00 0.00 O ATOM 91522 H1 WAT 461 32.024 39.817 15.810 1.00 0.00 H ATOM 91523 H2 WAT 461 32.356 39.832 17.287 1.00 0.00 H TER 91525 WAT 461 ATOM 91525 O WAT 462 66.466 24.242 139.989 1.00 0.00 O ATOM 91526 H1 WAT 462 67.041 24.576 140.678 1.00 0.00 H ATOM 91527 H2 WAT 462 66.962 23.528 139.588 1.00 0.00 H TER 91529 WAT 462 ATOM 91529 O WAT 463 113.759 42.422 93.826 1.00 0.00 O ATOM 91530 H1 WAT 463 114.455 41.871 93.468 1.00 0.00 H ATOM 91531 H2 WAT 463 113.622 42.089 94.713 1.00 0.00 H TER 91533 WAT 463 ATOM 91533 O WAT 464 87.796 29.097 102.218 1.00 0.00 O ATOM 91534 H1 WAT 464 88.364 28.620 102.823 1.00 0.00 H ATOM 91535 H2 WAT 464 87.173 29.553 102.784 1.00 0.00 H TER 91537 WAT 464 ATOM 91537 O WAT 465 118.230 43.821 120.338 1.00 0.00 O ATOM 91538 H1 WAT 465 118.926 43.165 120.382 1.00 0.00 H ATOM 91539 H2 WAT 465 117.791 43.761 121.187 1.00 0.00 H TER 91541 WAT 465 ATOM 91541 O WAT 466 114.777 27.015 122.702 1.00 0.00 O ATOM 91542 H1 WAT 466 115.700 27.249 122.597 1.00 0.00 H ATOM 91543 H2 WAT 466 114.462 26.877 121.808 1.00 0.00 H TER 91545 WAT 466 ATOM 91545 O WAT 467 17.944 129.681 126.628 1.00 0.00 O ATOM 91546 H1 WAT 467 17.100 130.043 126.897 1.00 0.00 H ATOM 91547 H2 WAT 467 17.931 129.727 125.672 1.00 0.00 H TER 91549 WAT 467 ATOM 91549 O WAT 468 26.128 63.370 52.970 1.00 0.00 O ATOM 91550 H1 WAT 468 25.358 63.008 52.532 1.00 0.00 H ATOM 91551 H2 WAT 468 25.987 63.181 53.897 1.00 0.00 H TER 91553 WAT 468 ATOM 91553 O WAT 469 111.063 5.253 145.904 1.00 0.00 O ATOM 91554 H1 WAT 469 111.858 5.387 146.421 1.00 0.00 H ATOM 91555 H2 WAT 469 111.163 4.375 145.535 1.00 0.00 H TER 91557 WAT 469 ATOM 91557 O WAT 470 59.108 34.515 153.053 1.00 0.00 O ATOM 91558 H1 WAT 470 60.042 34.723 153.022 1.00 0.00 H ATOM 91559 H2 WAT 470 58.808 34.629 152.151 1.00 0.00 H TER 91561 WAT 470 ATOM 91561 O WAT 471 117.262 70.200 99.949 1.00 0.00 O ATOM 91562 H1 WAT 471 117.901 70.912 99.922 1.00 0.00 H ATOM 91563 H2 WAT 471 117.750 69.454 100.298 1.00 0.00 H TER 91565 WAT 471 ATOM 91565 O WAT 472 9.252 73.145 111.661 1.00 0.00 O ATOM 91566 H1 WAT 472 8.751 72.461 112.105 1.00 0.00 H ATOM 91567 H2 WAT 472 10.113 72.753 111.513 1.00 0.00 H TER 91569 WAT 472 ATOM 91569 O WAT 473 134.559 72.420 5.326 1.00 0.00 O ATOM 91570 H1 WAT 473 135.288 72.711 5.874 1.00 0.00 H ATOM 91571 H2 WAT 473 133.827 72.979 5.585 1.00 0.00 H TER 91573 WAT 473 ATOM 91573 O WAT 474 109.742 77.428 139.789 1.00 0.00 O ATOM 91574 H1 WAT 474 109.743 77.326 140.741 1.00 0.00 H ATOM 91575 H2 WAT 474 109.826 78.371 139.649 1.00 0.00 H TER 91577 WAT 474 ATOM 91577 O WAT 475 65.871 144.992 116.793 1.00 0.00 O ATOM 91578 H1 WAT 475 65.714 144.345 117.481 1.00 0.00 H ATOM 91579 H2 WAT 475 66.813 145.155 116.829 1.00 0.00 H TER 91581 WAT 475 ATOM 91581 O WAT 476 65.709 53.647 18.459 1.00 0.00 O ATOM 91582 H1 WAT 476 64.849 53.451 18.830 1.00 0.00 H ATOM 91583 H2 WAT 476 66.326 53.437 19.160 1.00 0.00 H TER 91585 WAT 476 ATOM 91585 O WAT 477 61.058 104.975 79.951 1.00 0.00 O ATOM 91586 H1 WAT 477 60.306 104.908 80.539 1.00 0.00 H ATOM 91587 H2 WAT 477 61.467 104.110 79.986 1.00 0.00 H TER 91589 WAT 477 ATOM 91589 O WAT 478 52.768 45.155 157.410 1.00 0.00 O ATOM 91590 H1 WAT 478 52.054 44.520 157.355 1.00 0.00 H ATOM 91591 H2 WAT 478 53.556 44.620 157.507 1.00 0.00 H TER 91593 WAT 478 ATOM 91593 O WAT 479 143.997 46.683 2.597 1.00 0.00 O ATOM 91594 H1 WAT 479 144.476 46.930 1.806 1.00 0.00 H ATOM 91595 H2 WAT 479 144.487 47.092 3.311 1.00 0.00 H TER 91597 WAT 479 ATOM 91597 O WAT 480 7.189 60.686 152.151 1.00 0.00 O ATOM 91598 H1 WAT 480 6.656 60.008 151.737 1.00 0.00 H ATOM 91599 H2 WAT 480 7.229 60.430 153.073 1.00 0.00 H TER 91601 WAT 480 ATOM 91601 O WAT 481 122.708 3.461 67.733 1.00 0.00 O ATOM 91602 H1 WAT 481 122.217 2.801 67.244 1.00 0.00 H ATOM 91603 H2 WAT 481 122.036 3.983 68.172 1.00 0.00 H TER 91605 WAT 481 ATOM 91605 O WAT 482 109.521 95.786 145.578 1.00 0.00 O ATOM 91606 H1 WAT 482 109.474 94.936 145.141 1.00 0.00 H ATOM 91607 H2 WAT 482 110.451 96.014 145.559 1.00 0.00 H TER 91609 WAT 482 ATOM 91609 O WAT 483 101.167 82.698 6.916 1.00 0.00 O ATOM 91610 H1 WAT 483 101.007 83.238 6.141 1.00 0.00 H ATOM 91611 H2 WAT 483 100.669 83.126 7.612 1.00 0.00 H TER 91613 WAT 483 ATOM 91613 O WAT 484 29.852 78.424 85.507 1.00 0.00 O ATOM 91614 H1 WAT 484 29.289 78.501 84.737 1.00 0.00 H ATOM 91615 H2 WAT 484 29.244 78.318 86.239 1.00 0.00 H TER 91617 WAT 484 ATOM 91617 O WAT 485 30.198 122.184 7.755 1.00 0.00 O ATOM 91618 H1 WAT 485 29.553 121.805 7.158 1.00 0.00 H ATOM 91619 H2 WAT 485 30.778 121.455 7.975 1.00 0.00 H TER 91621 WAT 485 ATOM 91621 O WAT 486 93.306 48.963 153.362 1.00 0.00 O ATOM 91622 H1 WAT 486 93.488 49.900 153.290 1.00 0.00 H ATOM 91623 H2 WAT 486 93.639 48.720 154.226 1.00 0.00 H TER 91625 WAT 486 ATOM 91625 O WAT 487 129.656 37.263 60.018 1.00 0.00 O ATOM 91626 H1 WAT 487 129.936 36.469 59.563 1.00 0.00 H ATOM 91627 H2 WAT 487 129.168 36.945 60.777 1.00 0.00 H TER 91629 WAT 487 ATOM 91629 O WAT 488 42.166 92.305 148.259 1.00 0.00 O ATOM 91630 H1 WAT 488 43.096 92.081 148.229 1.00 0.00 H ATOM 91631 H2 WAT 488 41.731 91.487 148.503 1.00 0.00 H TER 91633 WAT 488 ATOM 91633 O WAT 489 87.502 124.176 63.577 1.00 0.00 O ATOM 91634 H1 WAT 489 86.563 124.136 63.763 1.00 0.00 H ATOM 91635 H2 WAT 489 87.763 125.055 63.852 1.00 0.00 H TER 91637 WAT 489 ATOM 91637 O WAT 490 21.931 107.118 105.306 1.00 0.00 O ATOM 91638 H1 WAT 490 21.082 107.560 105.320 1.00 0.00 H ATOM 91639 H2 WAT 490 22.454 107.622 104.682 1.00 0.00 H TER 91641 WAT 490 ATOM 91641 O WAT 491 77.028 39.195 0.880 1.00 0.00 O ATOM 91642 H1 WAT 491 77.980 39.101 0.909 1.00 0.00 H ATOM 91643 H2 WAT 491 76.825 39.289 -0.051 1.00 0.00 H TER 91645 WAT 491 ATOM 91645 O WAT 492 122.751 78.887 15.126 1.00 0.00 O ATOM 91646 H1 WAT 492 123.214 79.116 15.933 1.00 0.00 H ATOM 91647 H2 WAT 492 123.332 79.182 14.425 1.00 0.00 H TER 91649 WAT 492 ATOM 91649 O WAT 493 48.882 62.935 113.769 1.00 0.00 O ATOM 91650 H1 WAT 493 48.445 63.623 113.267 1.00 0.00 H ATOM 91651 H2 WAT 493 49.172 62.305 113.109 1.00 0.00 H TER 91653 WAT 493 ATOM 91653 O WAT 494 76.155 140.030 152.394 1.00 0.00 O ATOM 91654 H1 WAT 494 76.777 139.875 151.683 1.00 0.00 H ATOM 91655 H2 WAT 494 76.698 140.070 153.181 1.00 0.00 H TER 91657 WAT 494 ATOM 91657 O WAT 495 1.404 57.833 108.884 1.00 0.00 O ATOM 91658 H1 WAT 495 2.236 58.273 108.704 1.00 0.00 H ATOM 91659 H2 WAT 495 1.573 56.912 108.688 1.00 0.00 H TER 91661 WAT 495 ATOM 91661 O WAT 496 124.837 122.605 83.449 1.00 0.00 O ATOM 91662 H1 WAT 496 124.131 122.923 84.012 1.00 0.00 H ATOM 91663 H2 WAT 496 125.631 122.990 83.821 1.00 0.00 H TER 91665 WAT 496 ATOM 91665 O WAT 497 36.640 55.900 84.026 1.00 0.00 O ATOM 91666 H1 WAT 497 36.830 54.962 84.021 1.00 0.00 H ATOM 91667 H2 WAT 497 35.785 55.973 83.602 1.00 0.00 H TER 91669 WAT 497 ATOM 91669 O WAT 498 7.178 103.327 15.786 1.00 0.00 O ATOM 91670 H1 WAT 498 6.320 103.043 15.471 1.00 0.00 H ATOM 91671 H2 WAT 498 7.229 102.988 16.680 1.00 0.00 H TER 91673 WAT 498 ATOM 91673 O WAT 499 77.090 60.043 157.941 1.00 0.00 O ATOM 91674 H1 WAT 499 77.538 59.215 157.768 1.00 0.00 H ATOM 91675 H2 WAT 499 77.104 60.129 158.895 1.00 0.00 H TER 91677 WAT 499 ATOM 91677 O WAT 500 40.852 52.347 86.508 1.00 0.00 O ATOM 91678 H1 WAT 500 39.922 52.331 86.283 1.00 0.00 H ATOM 91679 H2 WAT 500 41.266 52.818 85.785 1.00 0.00 H TER 91681 WAT 500 ATOM 91681 O WAT 501 73.484 102.595 57.280 1.00 0.00 O ATOM 91682 H1 WAT 501 74.289 102.584 57.798 1.00 0.00 H ATOM 91683 H2 WAT 501 72.846 103.038 57.838 1.00 0.00 H TER 91685 WAT 501 ATOM 91685 O WAT 502 59.450 49.911 118.544 1.00 0.00 O ATOM 91686 H1 WAT 502 58.520 50.060 118.373 1.00 0.00 H ATOM 91687 H2 WAT 502 59.496 49.729 119.482 1.00 0.00 H TER 91689 WAT 502 ATOM 91689 O WAT 503 7.272 59.411 124.463 1.00 0.00 O ATOM 91690 H1 WAT 503 8.105 59.181 124.053 1.00 0.00 H ATOM 91691 H2 WAT 503 7.423 59.285 125.400 1.00 0.00 H TER 91693 WAT 503 ATOM 91693 O WAT 504 42.709 55.243 18.938 1.00 0.00 O ATOM 91694 H1 WAT 504 41.820 55.518 19.161 1.00 0.00 H ATOM 91695 H2 WAT 504 42.854 54.454 19.461 1.00 0.00 H TER 91697 WAT 504 ATOM 91697 O WAT 505 25.767 109.907 150.965 1.00 0.00 O ATOM 91698 H1 WAT 505 25.915 110.813 151.236 1.00 0.00 H ATOM 91699 H2 WAT 505 24.871 109.901 150.628 1.00 0.00 H TER 91701 WAT 505 ATOM 91701 O WAT 506 69.749 91.571 61.876 1.00 0.00 O ATOM 91702 H1 WAT 506 70.418 92.055 62.360 1.00 0.00 H ATOM 91703 H2 WAT 506 69.818 90.674 62.204 1.00 0.00 H TER 91705 WAT 506 ATOM 91705 O WAT 507 86.371 10.619 104.532 1.00 0.00 O ATOM 91706 H1 WAT 507 87.245 11.007 104.571 1.00 0.00 H ATOM 91707 H2 WAT 507 86.522 9.679 104.630 1.00 0.00 H TER 91709 WAT 507 ATOM 91709 O WAT 508 40.904 78.543 2.795 1.00 0.00 O ATOM 91710 H1 WAT 508 40.880 79.208 2.106 1.00 0.00 H ATOM 91711 H2 WAT 508 41.593 78.839 3.389 1.00 0.00 H TER 91713 WAT 508 ATOM 91713 O WAT 509 0.098 120.816 92.717 1.00 0.00 O ATOM 91714 H1 WAT 509 0.898 120.523 92.282 1.00 0.00 H ATOM 91715 H2 WAT 509 0.398 121.182 93.549 1.00 0.00 H TER 91717 WAT 509 ATOM 91717 O WAT 510 100.010 20.526 140.974 1.00 0.00 O ATOM 91718 H1 WAT 510 99.509 21.180 141.461 1.00 0.00 H ATOM 91719 H2 WAT 510 99.754 20.659 140.061 1.00 0.00 H TER 91721 WAT 510 ATOM 91721 O WAT 511 16.046 126.711 98.353 1.00 0.00 O ATOM 91722 H1 WAT 511 15.363 126.663 97.684 1.00 0.00 H ATOM 91723 H2 WAT 511 15.653 126.307 99.126 1.00 0.00 H TER 91725 WAT 511 ATOM 91725 O WAT 512 36.850 2.105 144.712 1.00 0.00 O ATOM 91726 H1 WAT 512 36.319 1.405 144.332 1.00 0.00 H ATOM 91727 H2 WAT 512 36.935 1.867 145.635 1.00 0.00 H TER 91729 WAT 512 ATOM 91729 O WAT 513 81.642 125.490 72.870 1.00 0.00 O ATOM 91730 H1 WAT 513 82.103 124.963 72.217 1.00 0.00 H ATOM 91731 H2 WAT 513 82.326 126.026 73.272 1.00 0.00 H TER 91733 WAT 513 ATOM 91733 O WAT 514 66.698 124.485 132.604 1.00 0.00 O ATOM 91734 H1 WAT 514 66.871 123.607 132.267 1.00 0.00 H ATOM 91735 H2 WAT 514 67.525 124.954 132.487 1.00 0.00 H TER 91737 WAT 514 ATOM 91737 O WAT 515 69.238 27.624 71.002 1.00 0.00 O ATOM 91738 H1 WAT 515 68.811 26.801 70.765 1.00 0.00 H ATOM 91739 H2 WAT 515 69.216 27.637 71.959 1.00 0.00 H TER 91741 WAT 515 ATOM 91741 O WAT 516 64.761 18.745 85.341 1.00 0.00 O ATOM 91742 H1 WAT 516 64.450 19.551 84.930 1.00 0.00 H ATOM 91743 H2 WAT 516 65.679 18.680 85.076 1.00 0.00 H TER 91745 WAT 516 ATOM 91745 O WAT 517 48.846 138.256 68.583 1.00 0.00 O ATOM 91746 H1 WAT 517 49.708 138.673 68.569 1.00 0.00 H ATOM 91747 H2 WAT 517 49.005 137.390 68.958 1.00 0.00 H TER 91749 WAT 517 ATOM 91749 O WAT 518 143.361 85.108 111.576 1.00 0.00 O ATOM 91750 H1 WAT 518 143.023 84.413 112.141 1.00 0.00 H ATOM 91751 H2 WAT 518 144.136 85.433 112.034 1.00 0.00 H TER 91753 WAT 518 ATOM 91753 O WAT 519 77.720 63.860 114.399 1.00 0.00 O ATOM 91754 H1 WAT 519 77.897 63.003 114.012 1.00 0.00 H ATOM 91755 H2 WAT 519 76.825 64.064 114.131 1.00 0.00 H TER 91757 WAT 519 ATOM 91757 O WAT 520 66.887 119.052 128.899 1.00 0.00 O ATOM 91758 H1 WAT 520 67.143 118.502 129.639 1.00 0.00 H ATOM 91759 H2 WAT 520 66.546 118.437 128.250 1.00 0.00 H TER 91761 WAT 520 ATOM 91761 O WAT 521 99.770 44.253 63.866 1.00 0.00 O ATOM 91762 H1 WAT 521 100.337 43.868 63.198 1.00 0.00 H ATOM 91763 H2 WAT 521 98.991 44.533 63.386 1.00 0.00 H TER 91765 WAT 521 ATOM 91765 O WAT 522 38.130 39.637 128.698 1.00 0.00 O ATOM 91766 H1 WAT 522 37.623 38.886 128.389 1.00 0.00 H ATOM 91767 H2 WAT 522 37.487 40.195 129.136 1.00 0.00 H TER 91769 WAT 522 ATOM 91769 O WAT 523 117.002 24.695 60.706 1.00 0.00 O ATOM 91770 H1 WAT 523 117.528 25.173 60.065 1.00 0.00 H ATOM 91771 H2 WAT 523 116.153 24.578 60.279 1.00 0.00 H TER 91773 WAT 523 ATOM 91773 O WAT 524 109.787 124.802 113.233 1.00 0.00 O ATOM 91774 H1 WAT 524 109.932 125.324 112.443 1.00 0.00 H ATOM 91775 H2 WAT 524 108.842 124.845 113.377 1.00 0.00 H TER 91777 WAT 524 ATOM 91777 O WAT 525 81.705 89.533 118.499 1.00 0.00 O ATOM 91778 H1 WAT 525 82.450 89.068 118.118 1.00 0.00 H ATOM 91779 H2 WAT 525 82.040 90.410 118.685 1.00 0.00 H TER 91781 WAT 525 ATOM 91781 O WAT 526 121.495 125.111 112.681 1.00 0.00 O ATOM 91782 H1 WAT 526 121.691 124.279 112.250 1.00 0.00 H ATOM 91783 H2 WAT 526 121.774 125.778 112.054 1.00 0.00 H TER 91785 WAT 526 ATOM 91785 O WAT 527 139.762 118.491 155.053 1.00 0.00 O ATOM 91786 H1 WAT 527 139.992 118.557 154.126 1.00 0.00 H ATOM 91787 H2 WAT 527 140.544 118.128 155.468 1.00 0.00 H TER 91789 WAT 527 ATOM 91789 O WAT 528 55.142 27.986 95.917 1.00 0.00 O ATOM 91790 H1 WAT 528 55.162 28.888 95.598 1.00 0.00 H ATOM 91791 H2 WAT 528 54.231 27.713 95.808 1.00 0.00 H TER 91793 WAT 528 ATOM 91793 O WAT 529 2.475 116.140 139.233 1.00 0.00 O ATOM 91794 H1 WAT 529 2.569 115.401 138.632 1.00 0.00 H ATOM 91795 H2 WAT 529 1.534 116.198 139.397 1.00 0.00 H TER 91797 WAT 529 ATOM 91797 O WAT 530 51.084 28.283 108.556 1.00 0.00 O ATOM 91798 H1 WAT 530 50.713 28.994 108.034 1.00 0.00 H ATOM 91799 H2 WAT 530 51.999 28.233 108.278 1.00 0.00 H TER 91801 WAT 530 ATOM 91801 O WAT 531 27.182 57.595 15.564 1.00 0.00 O ATOM 91802 H1 WAT 531 27.065 56.932 14.884 1.00 0.00 H ATOM 91803 H2 WAT 531 27.426 57.096 16.344 1.00 0.00 H TER 91805 WAT 531 ATOM 91805 O WAT 532 123.134 18.717 18.276 1.00 0.00 O ATOM 91806 H1 WAT 532 123.477 19.117 17.476 1.00 0.00 H ATOM 91807 H2 WAT 532 123.638 19.123 18.982 1.00 0.00 H TER 91809 WAT 532 ATOM 91809 O WAT 533 116.789 90.799 157.100 1.00 0.00 O ATOM 91810 H1 WAT 533 117.065 91.697 156.912 1.00 0.00 H ATOM 91811 H2 WAT 533 115.843 90.804 156.955 1.00 0.00 H TER 91813 WAT 533 ATOM 91813 O WAT 534 13.099 135.485 62.332 1.00 0.00 O ATOM 91814 H1 WAT 534 13.123 134.569 62.607 1.00 0.00 H ATOM 91815 H2 WAT 534 13.717 135.533 61.602 1.00 0.00 H TER 91817 WAT 534 ATOM 91817 O WAT 535 29.366 91.796 96.204 1.00 0.00 O ATOM 91818 H1 WAT 535 29.578 90.977 95.755 1.00 0.00 H ATOM 91819 H2 WAT 535 30.215 92.154 96.463 1.00 0.00 H TER 91821 WAT 535 ATOM 91821 O WAT 536 122.900 24.767 100.762 1.00 0.00 O ATOM 91822 H1 WAT 536 123.551 24.067 100.803 1.00 0.00 H ATOM 91823 H2 WAT 536 122.309 24.504 100.056 1.00 0.00 H TER 91825 WAT 536 ATOM 91825 O WAT 537 69.391 128.499 51.875 1.00 0.00 O ATOM 91826 H1 WAT 537 68.789 127.768 51.733 1.00 0.00 H ATOM 91827 H2 WAT 537 68.921 129.263 51.543 1.00 0.00 H TER 91829 WAT 537 ATOM 91829 O WAT 538 88.550 104.094 158.909 1.00 0.00 O ATOM 91830 H1 WAT 538 88.027 104.416 158.176 1.00 0.00 H ATOM 91831 H2 WAT 538 89.136 103.445 158.519 1.00 0.00 H TER 91833 WAT 538 ATOM 91833 O WAT 539 17.484 133.261 84.466 1.00 0.00 O ATOM 91834 H1 WAT 539 17.763 132.549 85.041 1.00 0.00 H ATOM 91835 H2 WAT 539 17.006 133.859 85.040 1.00 0.00 H TER 91837 WAT 539 ATOM 91837 O WAT 540 139.506 127.003 138.642 1.00 0.00 O ATOM 91838 H1 WAT 540 139.684 126.105 138.362 1.00 0.00 H ATOM 91839 H2 WAT 540 139.183 126.915 139.539 1.00 0.00 H TER 91841 WAT 540 ATOM 91841 O WAT 541 72.396 43.613 66.190 1.00 0.00 O ATOM 91842 H1 WAT 541 72.491 43.439 65.253 1.00 0.00 H ATOM 91843 H2 WAT 541 72.577 42.772 66.609 1.00 0.00 H TER 91845 WAT 541 ATOM 91845 O WAT 542 85.311 63.713 153.357 1.00 0.00 O ATOM 91846 H1 WAT 542 84.816 62.935 153.618 1.00 0.00 H ATOM 91847 H2 WAT 542 84.767 64.129 152.688 1.00 0.00 H TER 91849 WAT 542 ATOM 91849 O WAT 543 144.153 112.935 97.580 1.00 0.00 O ATOM 91850 H1 WAT 543 145.017 113.336 97.486 1.00 0.00 H ATOM 91851 H2 WAT 543 143.701 113.485 98.220 1.00 0.00 H TER 91853 WAT 543 ATOM 91853 O WAT 544 36.726 33.428 67.646 1.00 0.00 O ATOM 91854 H1 WAT 544 36.110 32.738 67.398 1.00 0.00 H ATOM 91855 H2 WAT 544 36.810 33.967 66.860 1.00 0.00 H TER 91857 WAT 544 ATOM 91857 O WAT 545 75.787 71.503 87.969 1.00 0.00 O ATOM 91858 H1 WAT 545 76.531 71.435 88.568 1.00 0.00 H ATOM 91859 H2 WAT 545 76.146 71.270 87.113 1.00 0.00 H TER 91861 WAT 545 ATOM 91861 O WAT 546 81.620 20.969 97.202 1.00 0.00 O ATOM 91862 H1 WAT 546 82.399 20.598 96.787 1.00 0.00 H ATOM 91863 H2 WAT 546 81.463 20.406 97.961 1.00 0.00 H TER 91865 WAT 546 ATOM 91865 O WAT 547 50.561 25.311 147.114 1.00 0.00 O ATOM 91866 H1 WAT 547 50.742 25.567 148.018 1.00 0.00 H ATOM 91867 H2 WAT 547 51.048 25.942 146.584 1.00 0.00 H TER 91869 WAT 547 ATOM 91869 O WAT 548 102.964 62.320 86.873 1.00 0.00 O ATOM 91870 H1 WAT 548 102.410 63.050 87.150 1.00 0.00 H ATOM 91871 H2 WAT 548 103.858 62.641 86.988 1.00 0.00 H TER 91873 WAT 548 ATOM 91873 O WAT 549 41.594 69.196 75.014 1.00 0.00 O ATOM 91874 H1 WAT 549 42.250 69.751 74.592 1.00 0.00 H ATOM 91875 H2 WAT 549 42.082 68.424 75.301 1.00 0.00 H TER 91877 WAT 549 ATOM 91877 O WAT 550 19.465 21.631 119.284 1.00 0.00 O ATOM 91878 H1 WAT 550 20.137 21.509 118.614 1.00 0.00 H ATOM 91879 H2 WAT 550 19.685 20.994 119.964 1.00 0.00 H TER 91881 WAT 550 ATOM 91881 O WAT 551 24.414 88.123 79.160 1.00 0.00 O ATOM 91882 H1 WAT 551 24.184 88.351 80.060 1.00 0.00 H ATOM 91883 H2 WAT 551 25.065 88.777 78.905 1.00 0.00 H TER 91885 WAT 551 ATOM 91885 O WAT 552 34.167 43.507 72.072 1.00 0.00 O ATOM 91886 H1 WAT 552 34.360 42.694 71.605 1.00 0.00 H ATOM 91887 H2 WAT 552 34.176 44.181 71.393 1.00 0.00 H TER 91889 WAT 552 ATOM 91889 O WAT 553 34.847 129.525 78.691 1.00 0.00 O ATOM 91890 H1 WAT 553 35.240 128.723 78.346 1.00 0.00 H ATOM 91891 H2 WAT 553 35.020 129.491 79.632 1.00 0.00 H TER 91893 WAT 553 ATOM 91893 O WAT 554 120.426 118.165 70.155 1.00 0.00 O ATOM 91894 H1 WAT 554 120.295 117.778 71.021 1.00 0.00 H ATOM 91895 H2 WAT 554 119.834 118.917 70.136 1.00 0.00 H TER 91897 WAT 554 ATOM 91897 O WAT 555 48.461 30.394 26.157 1.00 0.00 O ATOM 91898 H1 WAT 555 48.773 31.283 26.324 1.00 0.00 H ATOM 91899 H2 WAT 555 49.228 29.840 26.302 1.00 0.00 H TER 91901 WAT 555 ATOM 91901 O WAT 556 10.224 39.215 103.053 1.00 0.00 O ATOM 91902 H1 WAT 556 9.854 39.992 103.473 1.00 0.00 H ATOM 91903 H2 WAT 556 10.335 39.469 102.137 1.00 0.00 H TER 91905 WAT 556 ATOM 91905 O WAT 557 38.038 74.434 132.089 1.00 0.00 O ATOM 91906 H1 WAT 557 38.378 73.667 132.550 1.00 0.00 H ATOM 91907 H2 WAT 557 37.099 74.431 132.278 1.00 0.00 H TER 91909 WAT 557 ATOM 91909 O WAT 558 133.579 56.681 15.194 1.00 0.00 O ATOM 91910 H1 WAT 558 133.946 55.966 15.714 1.00 0.00 H ATOM 91911 H2 WAT 558 134.032 56.622 14.352 1.00 0.00 H TER 91913 WAT 558 ATOM 91913 O WAT 559 12.009 12.978 113.226 1.00 0.00 O ATOM 91914 H1 WAT 559 12.485 12.555 112.512 1.00 0.00 H ATOM 91915 H2 WAT 559 11.373 12.322 113.512 1.00 0.00 H TER 91917 WAT 559 ATOM 91917 O WAT 560 55.146 115.635 82.016 1.00 0.00 O ATOM 91918 H1 WAT 560 56.011 115.229 82.062 1.00 0.00 H ATOM 91919 H2 WAT 560 54.875 115.520 81.105 1.00 0.00 H TER 91921 WAT 560 ATOM 91921 O WAT 561 72.920 29.086 144.340 1.00 0.00 O ATOM 91922 H1 WAT 561 72.203 28.617 143.913 1.00 0.00 H ATOM 91923 H2 WAT 561 73.546 29.257 143.638 1.00 0.00 H TER 91925 WAT 561 ATOM 91925 O WAT 562 57.232 28.952 25.673 1.00 0.00 O ATOM 91926 H1 WAT 562 57.932 28.302 25.729 1.00 0.00 H ATOM 91927 H2 WAT 562 57.204 29.350 26.543 1.00 0.00 H TER 91929 WAT 562 ATOM 91929 O WAT 563 128.065 94.361 15.409 1.00 0.00 O ATOM 91930 H1 WAT 563 127.688 95.072 14.891 1.00 0.00 H ATOM 91931 H2 WAT 563 127.964 94.646 16.317 1.00 0.00 H TER 91933 WAT 563 ATOM 91933 O WAT 564 95.960 51.809 139.757 1.00 0.00 O ATOM 91934 H1 WAT 564 95.643 50.994 140.147 1.00 0.00 H ATOM 91935 H2 WAT 564 96.152 51.581 138.848 1.00 0.00 H TER 91937 WAT 564 ATOM 91937 O WAT 565 134.670 69.981 100.612 1.00 0.00 O ATOM 91938 H1 WAT 565 135.055 69.276 100.091 1.00 0.00 H ATOM 91939 H2 WAT 565 133.951 70.312 100.075 1.00 0.00 H TER 91941 WAT 565 ATOM 91941 O WAT 566 23.009 126.158 110.657 1.00 0.00 O ATOM 91942 H1 WAT 566 23.328 126.983 110.291 1.00 0.00 H ATOM 91943 H2 WAT 566 22.058 126.260 110.684 1.00 0.00 H TER 91945 WAT 566 ATOM 91945 O WAT 567 132.891 108.704 62.417 1.00 0.00 O ATOM 91946 H1 WAT 567 133.689 109.210 62.568 1.00 0.00 H ATOM 91947 H2 WAT 567 132.646 108.907 61.515 1.00 0.00 H TER 91949 WAT 567 ATOM 91949 O WAT 568 55.419 61.605 117.475 1.00 0.00 O ATOM 91950 H1 WAT 568 56.287 61.430 117.112 1.00 0.00 H ATOM 91951 H2 WAT 568 54.816 61.171 116.873 1.00 0.00 H TER 91953 WAT 568 ATOM 91953 O WAT 569 49.704 142.012 136.443 1.00 0.00 O ATOM 91954 H1 WAT 569 49.955 141.097 136.318 1.00 0.00 H ATOM 91955 H2 WAT 569 50.397 142.378 136.993 1.00 0.00 H TER 91957 WAT 569 ATOM 91957 O WAT 570 81.253 126.557 95.810 1.00 0.00 O ATOM 91958 H1 WAT 570 81.363 127.446 96.149 1.00 0.00 H ATOM 91959 H2 WAT 570 81.034 126.033 96.581 1.00 0.00 H TER 91961 WAT 570 ATOM 91961 O WAT 571 72.417 68.493 89.759 1.00 0.00 O ATOM 91962 H1 WAT 571 71.849 69.034 90.308 1.00 0.00 H ATOM 91963 H2 WAT 571 73.277 68.908 89.822 1.00 0.00 H TER 91965 WAT 571 ATOM 91965 O WAT 572 124.765 52.271 111.687 1.00 0.00 O ATOM 91966 H1 WAT 572 124.550 51.737 112.451 1.00 0.00 H ATOM 91967 H2 WAT 572 125.402 52.907 112.011 1.00 0.00 H TER 91969 WAT 572 ATOM 91969 O WAT 573 15.184 97.885 72.960 1.00 0.00 O ATOM 91970 H1 WAT 573 15.852 98.481 73.299 1.00 0.00 H ATOM 91971 H2 WAT 573 15.494 97.014 73.204 1.00 0.00 H TER 91973 WAT 573 ATOM 91973 O WAT 574 19.757 38.371 149.491 1.00 0.00 O ATOM 91974 H1 WAT 574 19.261 39.117 149.829 1.00 0.00 H ATOM 91975 H2 WAT 574 20.553 38.759 149.128 1.00 0.00 H TER 91977 WAT 574 ATOM 91977 O WAT 575 25.024 85.166 113.477 1.00 0.00 O ATOM 91978 H1 WAT 575 25.183 85.049 114.414 1.00 0.00 H ATOM 91979 H2 WAT 575 24.076 85.066 113.381 1.00 0.00 H TER 91981 WAT 575 ATOM 91981 O WAT 576 132.373 34.227 69.074 1.00 0.00 O ATOM 91982 H1 WAT 576 132.005 33.446 68.660 1.00 0.00 H ATOM 91983 H2 WAT 576 131.986 34.238 69.950 1.00 0.00 H TER 91985 WAT 576 ATOM 91985 O WAT 577 124.640 68.111 121.005 1.00 0.00 O ATOM 91986 H1 WAT 577 124.028 68.282 120.290 1.00 0.00 H ATOM 91987 H2 WAT 577 125.480 67.963 120.571 1.00 0.00 H TER 91989 WAT 577 ATOM 91989 O WAT 578 122.928 70.720 74.178 1.00 0.00 O ATOM 91990 H1 WAT 578 123.521 70.425 73.488 1.00 0.00 H ATOM 91991 H2 WAT 578 122.054 70.501 73.854 1.00 0.00 H TER 91993 WAT 578 ATOM 91993 O WAT 579 82.598 31.919 59.844 1.00 0.00 O ATOM 91994 H1 WAT 579 82.219 31.429 59.115 1.00 0.00 H ATOM 91995 H2 WAT 579 81.976 32.629 60.006 1.00 0.00 H TER 91997 WAT 579 ATOM 91997 O WAT 580 8.219 114.173 4.359 1.00 0.00 O ATOM 91998 H1 WAT 580 8.132 115.071 4.679 1.00 0.00 H ATOM 91999 H2 WAT 580 9.134 114.104 4.084 1.00 0.00 H TER 92001 WAT 580 ATOM 92001 O WAT 581 101.002 136.784 150.699 1.00 0.00 O ATOM 92002 H1 WAT 581 100.742 135.937 150.338 1.00 0.00 H ATOM 92003 H2 WAT 581 101.883 136.637 151.044 1.00 0.00 H TER 92005 WAT 581 ATOM 92005 O WAT 582 85.973 87.920 9.646 1.00 0.00 O ATOM 92006 H1 WAT 582 86.191 88.093 8.730 1.00 0.00 H ATOM 92007 H2 WAT 582 86.253 87.017 9.792 1.00 0.00 H TER 92009 WAT 582 ATOM 92009 O WAT 583 55.957 126.546 118.175 1.00 0.00 O ATOM 92010 H1 WAT 583 55.140 126.106 118.410 1.00 0.00 H ATOM 92011 H2 WAT 583 56.588 126.243 118.828 1.00 0.00 H TER 92013 WAT 583 ATOM 92013 O WAT 584 135.800 105.246 109.893 1.00 0.00 O ATOM 92014 H1 WAT 584 136.253 105.807 110.523 1.00 0.00 H ATOM 92015 H2 WAT 584 135.728 105.783 109.103 1.00 0.00 H TER 92017 WAT 584 ATOM 92017 O WAT 585 106.982 95.913 19.535 1.00 0.00 O ATOM 92018 H1 WAT 585 106.983 96.386 18.703 1.00 0.00 H ATOM 92019 H2 WAT 585 106.135 96.124 19.929 1.00 0.00 H TER 92021 WAT 585 ATOM 92021 O WAT 586 134.797 0.923 15.130 1.00 0.00 O ATOM 92022 H1 WAT 586 133.991 1.056 15.629 1.00 0.00 H ATOM 92023 H2 WAT 586 134.849 -0.025 15.008 1.00 0.00 H TER 92025 WAT 586 ATOM 92025 O WAT 587 71.648 48.390 86.853 1.00 0.00 O ATOM 92026 H1 WAT 587 71.945 48.229 85.958 1.00 0.00 H ATOM 92027 H2 WAT 587 70.943 47.757 86.990 1.00 0.00 H TER 92029 WAT 587 ATOM 92029 O WAT 588 120.693 9.226 14.443 1.00 0.00 O ATOM 92030 H1 WAT 588 120.361 8.396 14.099 1.00 0.00 H ATOM 92031 H2 WAT 588 120.812 9.776 13.669 1.00 0.00 H TER 92033 WAT 588 ATOM 92033 O WAT 589 61.854 145.483 54.822 1.00 0.00 O ATOM 92034 H1 WAT 589 62.372 146.199 55.192 1.00 0.00 H ATOM 92035 H2 WAT 589 60.945 145.739 54.979 1.00 0.00 H TER 92037 WAT 589 ATOM 92037 O WAT 590 68.862 95.380 111.287 1.00 0.00 O ATOM 92038 H1 WAT 590 69.405 96.146 111.473 1.00 0.00 H ATOM 92039 H2 WAT 590 68.868 94.879 112.102 1.00 0.00 H TER 92041 WAT 590 ATOM 92041 O WAT 591 126.105 97.849 91.563 1.00 0.00 O ATOM 92042 H1 WAT 591 127.014 97.859 91.865 1.00 0.00 H ATOM 92043 H2 WAT 591 126.157 97.536 90.659 1.00 0.00 H TER 92045 WAT 591 ATOM 92045 O WAT 592 121.999 138.227 157.339 1.00 0.00 O ATOM 92046 H1 WAT 592 122.784 137.740 157.589 1.00 0.00 H ATOM 92047 H2 WAT 592 121.656 138.567 158.165 1.00 0.00 H TER 92049 WAT 592 ATOM 92049 O WAT 593 125.014 68.371 109.644 1.00 0.00 O ATOM 92050 H1 WAT 593 124.641 67.495 109.747 1.00 0.00 H ATOM 92051 H2 WAT 593 125.379 68.373 108.759 1.00 0.00 H TER 92053 WAT 593 ATOM 92053 O WAT 594 97.761 42.115 137.386 1.00 0.00 O ATOM 92054 H1 WAT 594 97.639 41.556 136.618 1.00 0.00 H ATOM 92055 H2 WAT 594 96.895 42.490 137.549 1.00 0.00 H TER 92057 WAT 594 ATOM 92057 O WAT 595 26.186 125.141 115.655 1.00 0.00 O ATOM 92058 H1 WAT 595 27.111 125.360 115.771 1.00 0.00 H ATOM 92059 H2 WAT 595 26.031 124.424 116.270 1.00 0.00 H TER 92061 WAT 595 ATOM 92061 O WAT 596 38.159 89.623 70.203 1.00 0.00 O ATOM 92062 H1 WAT 596 38.690 88.855 70.415 1.00 0.00 H ATOM 92063 H2 WAT 596 38.242 90.190 70.970 1.00 0.00 H TER 92065 WAT 596 ATOM 92065 O WAT 597 54.755 16.726 68.201 1.00 0.00 O ATOM 92066 H1 WAT 597 53.848 16.829 67.914 1.00 0.00 H ATOM 92067 H2 WAT 597 54.757 15.912 68.705 1.00 0.00 H TER 92069 WAT 597 ATOM 92069 O WAT 598 1.673 117.495 110.201 1.00 0.00 O ATOM 92070 H1 WAT 598 2.124 116.681 110.425 1.00 0.00 H ATOM 92071 H2 WAT 598 1.557 117.452 109.252 1.00 0.00 H TER 92073 WAT 598 ATOM 92073 O WAT 599 80.742 80.414 102.052 1.00 0.00 O ATOM 92074 H1 WAT 599 80.754 79.625 102.594 1.00 0.00 H ATOM 92075 H2 WAT 599 80.970 80.105 101.175 1.00 0.00 H TER 92077 WAT 599 ATOM 92077 O WAT 600 97.893 77.915 12.723 1.00 0.00 O ATOM 92078 H1 WAT 600 98.283 78.626 13.231 1.00 0.00 H ATOM 92079 H2 WAT 600 98.553 77.702 12.063 1.00 0.00 H TER 92081 WAT 600 ATOM 92081 O WAT 601 130.712 59.210 79.767 1.00 0.00 O ATOM 92082 H1 WAT 601 130.631 59.566 78.882 1.00 0.00 H ATOM 92083 H2 WAT 601 131.444 59.692 80.152 1.00 0.00 H TER 92085 WAT 601 ATOM 92085 O WAT 602 31.469 136.997 63.528 1.00 0.00 O ATOM 92086 H1 WAT 602 30.910 137.380 62.853 1.00 0.00 H ATOM 92087 H2 WAT 602 31.473 136.060 63.332 1.00 0.00 H TER 92089 WAT 602 ATOM 92089 O WAT 603 36.411 6.912 85.417 1.00 0.00 O ATOM 92090 H1 WAT 603 36.100 7.018 84.518 1.00 0.00 H ATOM 92091 H2 WAT 603 37.096 6.247 85.357 1.00 0.00 H TER 92093 WAT 603 ATOM 92093 O WAT 604 136.698 79.077 107.233 1.00 0.00 O ATOM 92094 H1 WAT 604 136.672 79.480 106.365 1.00 0.00 H ATOM 92095 H2 WAT 604 135.784 78.871 107.428 1.00 0.00 H TER 92097 WAT 604 ATOM 92097 O WAT 605 111.910 88.862 108.997 1.00 0.00 O ATOM 92098 H1 WAT 605 112.289 88.028 108.719 1.00 0.00 H ATOM 92099 H2 WAT 605 111.140 88.972 108.439 1.00 0.00 H TER 92101 WAT 605 ATOM 92101 O WAT 606 62.152 110.828 151.087 1.00 0.00 O ATOM 92102 H1 WAT 606 62.144 111.579 151.681 1.00 0.00 H ATOM 92103 H2 WAT 606 61.255 110.774 150.758 1.00 0.00 H TER 92105 WAT 606 ATOM 92105 O WAT 607 18.188 18.941 63.699 1.00 0.00 O ATOM 92106 H1 WAT 607 17.973 18.078 63.345 1.00 0.00 H ATOM 92107 H2 WAT 607 18.540 19.425 62.952 1.00 0.00 H TER 92109 WAT 607 ATOM 92109 O WAT 608 129.074 3.077 55.009 1.00 0.00 O ATOM 92110 H1 WAT 608 128.999 2.245 55.477 1.00 0.00 H ATOM 92111 H2 WAT 608 128.222 3.496 55.127 1.00 0.00 H TER 92113 WAT 608 ATOM 92113 O WAT 609 46.904 90.475 6.587 1.00 0.00 O ATOM 92114 H1 WAT 609 46.585 90.487 5.684 1.00 0.00 H ATOM 92115 H2 WAT 609 47.752 90.916 6.547 1.00 0.00 H TER 92117 WAT 609 ATOM 92117 O WAT 610 26.175 118.634 70.002 1.00 0.00 O ATOM 92118 H1 WAT 610 26.879 117.993 70.099 1.00 0.00 H ATOM 92119 H2 WAT 610 25.563 118.426 70.709 1.00 0.00 H TER 92121 WAT 610 ATOM 92121 O WAT 611 111.596 14.670 98.784 1.00 0.00 O ATOM 92122 H1 WAT 611 110.647 14.759 98.874 1.00 0.00 H ATOM 92123 H2 WAT 611 111.919 14.625 99.684 1.00 0.00 H TER 92125 WAT 611 ATOM 92125 O WAT 612 29.083 41.741 58.337 1.00 0.00 O ATOM 92126 H1 WAT 612 29.250 42.140 57.483 1.00 0.00 H ATOM 92127 H2 WAT 612 28.636 42.423 58.837 1.00 0.00 H TER 92129 WAT 612 ATOM 92129 O WAT 613 34.719 51.941 71.204 1.00 0.00 O ATOM 92130 H1 WAT 613 34.094 52.105 70.498 1.00 0.00 H ATOM 92131 H2 WAT 613 34.619 52.690 71.792 1.00 0.00 H TER 92133 WAT 613 ATOM 92133 O WAT 614 5.432 100.129 102.760 1.00 0.00 O ATOM 92134 H1 WAT 614 5.851 99.642 103.470 1.00 0.00 H ATOM 92135 H2 WAT 614 5.205 100.973 103.150 1.00 0.00 H TER 92137 WAT 614 ATOM 92137 O WAT 615 5.693 13.153 149.149 1.00 0.00 O ATOM 92138 H1 WAT 615 6.625 13.225 149.354 1.00 0.00 H ATOM 92139 H2 WAT 615 5.267 13.062 150.002 1.00 0.00 H TER 92141 WAT 615 ATOM 92141 O WAT 616 86.418 36.588 76.950 1.00 0.00 O ATOM 92142 H1 WAT 616 86.529 35.691 76.635 1.00 0.00 H ATOM 92143 H2 WAT 616 86.258 36.495 77.889 1.00 0.00 H TER 92145 WAT 616 ATOM 92145 O WAT 617 48.579 15.655 63.365 1.00 0.00 O ATOM 92146 H1 WAT 617 48.030 14.879 63.256 1.00 0.00 H ATOM 92147 H2 WAT 617 48.333 16.227 62.638 1.00 0.00 H TER 92149 WAT 617 ATOM 92149 O WAT 618 69.760 29.709 134.265 1.00 0.00 O ATOM 92150 H1 WAT 618 69.031 29.938 133.689 1.00 0.00 H ATOM 92151 H2 WAT 618 69.921 30.502 134.776 1.00 0.00 H TER 92153 WAT 618 ATOM 92153 O WAT 619 93.657 45.019 110.882 1.00 0.00 O ATOM 92154 H1 WAT 619 93.073 44.285 111.074 1.00 0.00 H ATOM 92155 H2 WAT 619 94.384 44.913 111.497 1.00 0.00 H TER 92157 WAT 619 ATOM 92157 O WAT 620 49.616 73.530 153.015 1.00 0.00 O ATOM 92158 H1 WAT 620 49.426 73.431 152.082 1.00 0.00 H ATOM 92159 H2 WAT 620 48.880 73.105 153.455 1.00 0.00 H TER 92161 WAT 620 ATOM 92161 O WAT 621 89.336 29.668 100.015 1.00 0.00 O ATOM 92162 H1 WAT 621 88.922 29.389 100.832 1.00 0.00 H ATOM 92163 H2 WAT 621 90.266 29.482 100.142 1.00 0.00 H TER 92165 WAT 621 ATOM 92165 O WAT 622 146.026 81.689 118.831 1.00 0.00 O ATOM 92166 H1 WAT 622 145.978 81.801 119.780 1.00 0.00 H ATOM 92167 H2 WAT 622 145.458 80.940 118.649 1.00 0.00 H TER 92169 WAT 622 ATOM 92169 O WAT 623 61.820 6.521 6.161 1.00 0.00 O ATOM 92170 H1 WAT 623 61.567 5.845 5.532 1.00 0.00 H ATOM 92171 H2 WAT 623 61.509 7.338 5.773 1.00 0.00 H TER 92173 WAT 623 ATOM 92173 O WAT 624 129.504 130.332 20.043 1.00 0.00 O ATOM 92174 H1 WAT 624 128.619 130.540 20.344 1.00 0.00 H ATOM 92175 H2 WAT 624 130.075 130.644 20.746 1.00 0.00 H TER 92177 WAT 624 ATOM 92177 O WAT 625 122.114 66.959 141.243 1.00 0.00 O ATOM 92178 H1 WAT 625 122.478 67.347 142.038 1.00 0.00 H ATOM 92179 H2 WAT 625 122.175 67.655 140.588 1.00 0.00 H TER 92181 WAT 625 ATOM 92181 O WAT 626 118.370 101.209 142.031 1.00 0.00 O ATOM 92182 H1 WAT 626 119.085 101.280 141.399 1.00 0.00 H ATOM 92183 H2 WAT 626 118.401 102.031 142.521 1.00 0.00 H TER 92185 WAT 626 ATOM 92185 O WAT 627 84.693 51.021 158.323 1.00 0.00 O ATOM 92186 H1 WAT 627 84.187 50.483 157.714 1.00 0.00 H ATOM 92187 H2 WAT 627 84.389 50.753 159.190 1.00 0.00 H TER 92189 WAT 627 ATOM 92189 O WAT 628 146.038 39.058 127.578 1.00 0.00 O ATOM 92190 H1 WAT 628 145.795 39.963 127.381 1.00 0.00 H ATOM 92191 H2 WAT 628 145.202 38.600 127.666 1.00 0.00 H TER 92193 WAT 628 ATOM 92193 O WAT 629 29.720 121.936 124.391 1.00 0.00 O ATOM 92194 H1 WAT 629 28.871 122.320 124.612 1.00 0.00 H ATOM 92195 H2 WAT 629 29.526 121.317 123.687 1.00 0.00 H TER 92197 WAT 629 ATOM 92197 O WAT 630 77.261 1.165 6.916 1.00 0.00 O ATOM 92198 H1 WAT 630 77.319 1.838 6.238 1.00 0.00 H ATOM 92199 H2 WAT 630 77.725 1.539 7.665 1.00 0.00 H TER 92201 WAT 630 ATOM 92201 O WAT 631 139.009 111.519 149.592 1.00 0.00 O ATOM 92202 H1 WAT 631 139.360 112.396 149.743 1.00 0.00 H ATOM 92203 H2 WAT 631 138.178 111.508 150.068 1.00 0.00 H TER 92205 WAT 631 ATOM 92205 O WAT 632 6.387 115.527 0.868 1.00 0.00 O ATOM 92206 H1 WAT 632 5.708 116.197 0.939 1.00 0.00 H ATOM 92207 H2 WAT 632 6.161 114.884 1.540 1.00 0.00 H TER 92209 WAT 632 ATOM 92209 O WAT 633 0.869 47.213 84.291 1.00 0.00 O ATOM 92210 H1 WAT 633 1.066 48.096 84.604 1.00 0.00 H ATOM 92211 H2 WAT 633 -0.081 47.206 84.176 1.00 0.00 H TER 92213 WAT 633 ATOM 92213 O WAT 634 13.982 24.451 154.212 1.00 0.00 O ATOM 92214 H1 WAT 634 13.537 24.188 153.407 1.00 0.00 H ATOM 92215 H2 WAT 634 13.633 23.864 154.883 1.00 0.00 H TER 92217 WAT 634 ATOM 92217 O WAT 635 45.666 53.043 28.747 1.00 0.00 O ATOM 92218 H1 WAT 635 44.907 52.598 28.369 1.00 0.00 H ATOM 92219 H2 WAT 635 46.199 53.291 27.992 1.00 0.00 H TER 92221 WAT 635 ATOM 92221 O WAT 636 10.526 83.594 147.019 1.00 0.00 O ATOM 92222 H1 WAT 636 11.142 84.162 146.555 1.00 0.00 H ATOM 92223 H2 WAT 636 10.869 83.549 147.911 1.00 0.00 H TER 92225 WAT 636 ATOM 92225 O WAT 637 19.311 98.212 70.909 1.00 0.00 O ATOM 92226 H1 WAT 637 19.507 99.136 71.067 1.00 0.00 H ATOM 92227 H2 WAT 637 18.378 98.199 70.696 1.00 0.00 H TER 92229 WAT 637 ATOM 92229 O WAT 638 108.450 124.398 101.883 1.00 0.00 O ATOM 92230 H1 WAT 638 108.875 124.548 102.727 1.00 0.00 H ATOM 92231 H2 WAT 638 107.514 124.486 102.066 1.00 0.00 H TER 92233 WAT 638 ATOM 92233 O WAT 639 130.646 102.662 2.809 1.00 0.00 O ATOM 92234 H1 WAT 639 130.843 103.598 2.763 1.00 0.00 H ATOM 92235 H2 WAT 639 130.832 102.335 1.928 1.00 0.00 H TER 92237 WAT 639 ATOM 92237 O WAT 640 76.783 59.078 11.594 1.00 0.00 O ATOM 92238 H1 WAT 640 77.438 58.387 11.506 1.00 0.00 H ATOM 92239 H2 WAT 640 77.134 59.808 11.083 1.00 0.00 H TER 92241 WAT 640 ATOM 92241 O WAT 641 7.964 0.699 96.647 1.00 0.00 O ATOM 92242 H1 WAT 641 7.511 1.290 97.249 1.00 0.00 H ATOM 92243 H2 WAT 641 8.891 0.796 96.868 1.00 0.00 H TER 92245 WAT 641 ATOM 92245 O WAT 642 67.187 42.418 65.601 1.00 0.00 O ATOM 92246 H1 WAT 642 66.827 43.104 66.164 1.00 0.00 H ATOM 92247 H2 WAT 642 68.063 42.256 65.951 1.00 0.00 H TER 92249 WAT 642 ATOM 92249 O WAT 643 115.715 68.927 68.743 1.00 0.00 O ATOM 92250 H1 WAT 643 115.760 68.392 67.950 1.00 0.00 H ATOM 92251 H2 WAT 643 116.047 68.357 69.436 1.00 0.00 H TER 92253 WAT 643 ATOM 92253 O WAT 644 144.479 105.894 17.892 1.00 0.00 O ATOM 92254 H1 WAT 644 144.008 105.489 18.619 1.00 0.00 H ATOM 92255 H2 WAT 644 143.841 106.484 17.491 1.00 0.00 H TER 92257 WAT 644 ATOM 92257 O WAT 645 58.560 126.934 155.352 1.00 0.00 O ATOM 92258 H1 WAT 645 58.429 126.362 154.595 1.00 0.00 H ATOM 92259 H2 WAT 645 57.705 127.337 155.499 1.00 0.00 H TER 92261 WAT 645 ATOM 92261 O WAT 646 25.999 11.277 16.930 1.00 0.00 O ATOM 92262 H1 WAT 646 25.127 10.910 17.073 1.00 0.00 H ATOM 92263 H2 WAT 646 26.125 11.887 17.656 1.00 0.00 H TER 92265 WAT 646 ATOM 92265 O WAT 647 3.329 109.230 70.247 1.00 0.00 O ATOM 92266 H1 WAT 647 2.887 109.769 69.589 1.00 0.00 H ATOM 92267 H2 WAT 647 4.053 109.775 70.555 1.00 0.00 H TER 92269 WAT 647 ATOM 92269 O WAT 648 14.830 123.855 123.973 1.00 0.00 O ATOM 92270 H1 WAT 648 15.674 124.204 124.259 1.00 0.00 H ATOM 92271 H2 WAT 648 14.214 124.575 124.110 1.00 0.00 H TER 92273 WAT 648 ATOM 92273 O WAT 649 36.870 58.747 80.010 1.00 0.00 O ATOM 92274 H1 WAT 649 37.456 59.487 79.850 1.00 0.00 H ATOM 92275 H2 WAT 649 36.594 58.467 79.138 1.00 0.00 H TER 92277 WAT 649 ATOM 92277 O WAT 650 140.396 89.416 17.214 1.00 0.00 O ATOM 92278 H1 WAT 650 140.845 89.198 16.397 1.00 0.00 H ATOM 92279 H2 WAT 650 140.031 90.288 17.061 1.00 0.00 H TER 92281 WAT 650 ATOM 92281 O WAT 651 64.405 120.301 4.663 1.00 0.00 O ATOM 92282 H1 WAT 651 64.464 119.358 4.815 1.00 0.00 H ATOM 92283 H2 WAT 651 63.477 120.457 4.488 1.00 0.00 H TER 92285 WAT 651 ATOM 92285 O WAT 652 102.479 48.532 144.462 1.00 0.00 O ATOM 92286 H1 WAT 652 101.928 48.152 143.778 1.00 0.00 H ATOM 92287 H2 WAT 652 102.606 47.821 145.090 1.00 0.00 H TER 92289 WAT 652 ATOM 92289 O WAT 653 12.899 64.450 100.826 1.00 0.00 O ATOM 92290 H1 WAT 653 13.680 64.890 101.163 1.00 0.00 H ATOM 92291 H2 WAT 653 12.957 64.552 99.876 1.00 0.00 H TER 92293 WAT 653 ATOM 92293 O WAT 654 139.360 86.800 17.139 1.00 0.00 O ATOM 92294 H1 WAT 654 139.646 87.680 17.383 1.00 0.00 H ATOM 92295 H2 WAT 654 139.630 86.248 17.873 1.00 0.00 H TER 92297 WAT 654 ATOM 92297 O WAT 655 89.036 28.561 113.182 1.00 0.00 O ATOM 92298 H1 WAT 655 88.690 28.487 114.072 1.00 0.00 H ATOM 92299 H2 WAT 655 88.706 29.403 112.867 1.00 0.00 H TER 92301 WAT 655 ATOM 92301 O WAT 656 4.337 17.893 152.442 1.00 0.00 O ATOM 92302 H1 WAT 656 3.806 18.301 151.758 1.00 0.00 H ATOM 92303 H2 WAT 656 4.838 18.616 152.820 1.00 0.00 H TER 92305 WAT 656 ATOM 92305 O WAT 657 144.340 132.848 120.283 1.00 0.00 O ATOM 92306 H1 WAT 657 144.097 132.431 119.457 1.00 0.00 H ATOM 92307 H2 WAT 657 144.873 133.600 120.025 1.00 0.00 H TER 92309 WAT 657 ATOM 92309 O WAT 658 76.442 45.844 156.725 1.00 0.00 O ATOM 92310 H1 WAT 658 76.522 46.528 157.390 1.00 0.00 H ATOM 92311 H2 WAT 658 76.341 45.034 157.224 1.00 0.00 H TER 92313 WAT 658 ATOM 92313 O WAT 659 7.058 141.404 85.356 1.00 0.00 O ATOM 92314 H1 WAT 659 7.908 141.063 85.078 1.00 0.00 H ATOM 92315 H2 WAT 659 6.952 142.216 84.861 1.00 0.00 H TER 92317 WAT 659 ATOM 92317 O WAT 660 11.811 119.289 6.254 1.00 0.00 O ATOM 92318 H1 WAT 660 11.582 118.649 6.928 1.00 0.00 H ATOM 92319 H2 WAT 660 12.574 118.912 5.816 1.00 0.00 H TER 92321 WAT 660 ATOM 92321 O WAT 661 128.770 71.048 65.211 1.00 0.00 O ATOM 92322 H1 WAT 661 128.348 71.884 65.015 1.00 0.00 H ATOM 92323 H2 WAT 661 128.581 70.499 64.450 1.00 0.00 H TER 92325 WAT 661 ATOM 92325 O WAT 662 50.264 101.460 13.912 1.00 0.00 O ATOM 92326 H1 WAT 662 51.063 100.990 14.149 1.00 0.00 H ATOM 92327 H2 WAT 662 49.912 100.972 13.167 1.00 0.00 H TER 92329 WAT 662 ATOM 92329 O WAT 663 32.675 1.077 95.887 1.00 0.00 O ATOM 92330 H1 WAT 663 31.911 1.028 96.462 1.00 0.00 H ATOM 92331 H2 WAT 663 33.421 1.134 96.483 1.00 0.00 H TER 92333 WAT 663 ATOM 92333 O WAT 664 65.744 0.434 25.152 1.00 0.00 O ATOM 92334 H1 WAT 664 64.916 0.558 24.687 1.00 0.00 H ATOM 92335 H2 WAT 664 65.957 -0.489 25.020 1.00 0.00 H TER 92337 WAT 664 ATOM 92337 O WAT 665 128.017 94.236 77.331 1.00 0.00 O ATOM 92338 H1 WAT 665 127.416 93.863 76.686 1.00 0.00 H ATOM 92339 H2 WAT 665 127.679 93.938 78.175 1.00 0.00 H TER 92341 WAT 665 ATOM 92341 O WAT 666 126.145 100.226 99.323 1.00 0.00 O ATOM 92342 H1 WAT 666 126.326 99.813 98.478 1.00 0.00 H ATOM 92343 H2 WAT 666 125.254 99.951 99.538 1.00 0.00 H TER 92345 WAT 666 ATOM 92345 O WAT 667 96.885 87.421 66.274 1.00 0.00 O ATOM 92346 H1 WAT 667 97.674 87.595 66.789 1.00 0.00 H ATOM 92347 H2 WAT 667 96.497 86.648 66.685 1.00 0.00 H TER 92349 WAT 667 ATOM 92349 O WAT 668 114.855 97.944 145.808 1.00 0.00 O ATOM 92350 H1 WAT 668 115.172 97.042 145.771 1.00 0.00 H ATOM 92351 H2 WAT 668 114.682 98.175 144.895 1.00 0.00 H TER 92353 WAT 668 ATOM 92353 O WAT 669 145.354 130.811 150.774 1.00 0.00 O ATOM 92354 H1 WAT 669 144.479 130.425 150.724 1.00 0.00 H ATOM 92355 H2 WAT 669 145.229 131.722 150.505 1.00 0.00 H TER 92357 WAT 669 ATOM 92357 O WAT 670 132.518 49.566 8.230 1.00 0.00 O ATOM 92358 H1 WAT 670 133.222 49.735 7.604 1.00 0.00 H ATOM 92359 H2 WAT 670 132.796 48.777 8.696 1.00 0.00 H TER 92361 WAT 670 ATOM 92361 O WAT 671 12.201 81.222 81.792 1.00 0.00 O ATOM 92362 H1 WAT 671 11.720 81.883 82.289 1.00 0.00 H ATOM 92363 H2 WAT 671 13.107 81.530 81.797 1.00 0.00 H TER 92365 WAT 671 ATOM 92365 O WAT 672 129.293 79.347 76.859 1.00 0.00 O ATOM 92366 H1 WAT 672 130.050 79.169 77.416 1.00 0.00 H ATOM 92367 H2 WAT 672 128.561 78.920 77.305 1.00 0.00 H TER 92369 WAT 672 ATOM 92369 O WAT 673 119.328 49.949 148.788 1.00 0.00 O ATOM 92370 H1 WAT 673 118.654 50.544 148.461 1.00 0.00 H ATOM 92371 H2 WAT 673 120.055 50.522 149.034 1.00 0.00 H TER 92373 WAT 673 ATOM 92373 O WAT 674 109.933 63.315 108.697 1.00 0.00 O ATOM 92374 H1 WAT 674 109.681 64.055 109.249 1.00 0.00 H ATOM 92375 H2 WAT 674 109.701 63.588 107.810 1.00 0.00 H TER 92377 WAT 674 ATOM 92377 O WAT 675 126.107 64.360 120.633 1.00 0.00 O ATOM 92378 H1 WAT 675 126.322 64.361 121.566 1.00 0.00 H ATOM 92379 H2 WAT 675 125.348 63.781 120.564 1.00 0.00 H TER 92381 WAT 675 ATOM 92381 O WAT 676 107.498 131.623 104.559 1.00 0.00 O ATOM 92382 H1 WAT 676 108.305 131.251 104.202 1.00 0.00 H ATOM 92383 H2 WAT 676 107.780 132.419 105.010 1.00 0.00 H TER 92385 WAT 676 ATOM 92385 O WAT 677 116.044 134.950 152.650 1.00 0.00 O ATOM 92386 H1 WAT 677 116.980 135.149 152.625 1.00 0.00 H ATOM 92387 H2 WAT 677 115.999 133.997 152.567 1.00 0.00 H TER 92389 WAT 677 ATOM 92389 O WAT 678 89.499 136.602 130.678 1.00 0.00 O ATOM 92390 H1 WAT 678 89.282 136.813 129.770 1.00 0.00 H ATOM 92391 H2 WAT 678 88.745 136.908 131.182 1.00 0.00 H TER 92393 WAT 678 ATOM 92393 O WAT 679 48.998 29.339 112.986 1.00 0.00 O ATOM 92394 H1 WAT 679 48.441 28.598 113.225 1.00 0.00 H ATOM 92395 H2 WAT 679 49.728 29.298 113.604 1.00 0.00 H TER 92397 WAT 679 ATOM 92397 O WAT 680 28.950 88.757 93.234 1.00 0.00 O ATOM 92398 H1 WAT 680 29.458 88.350 92.533 1.00 0.00 H ATOM 92399 H2 WAT 680 29.564 88.826 93.965 1.00 0.00 H TER 92401 WAT 680 ATOM 92401 O WAT 681 23.384 47.921 101.632 1.00 0.00 O ATOM 92402 H1 WAT 681 23.308 48.873 101.577 1.00 0.00 H ATOM 92403 H2 WAT 681 24.287 47.738 101.371 1.00 0.00 H TER 92405 WAT 681 ATOM 92405 O WAT 682 144.156 95.692 113.976 1.00 0.00 O ATOM 92406 H1 WAT 682 143.896 96.456 113.461 1.00 0.00 H ATOM 92407 H2 WAT 682 143.774 95.845 114.840 1.00 0.00 H TER 92409 WAT 682 ATOM 92409 O WAT 683 1.461 21.357 5.362 1.00 0.00 O ATOM 92410 H1 WAT 683 1.917 21.984 5.924 1.00 0.00 H ATOM 92411 H2 WAT 683 1.497 20.532 5.847 1.00 0.00 H TER 92413 WAT 683 ATOM 92413 O WAT 684 31.857 112.482 128.387 1.00 0.00 O ATOM 92414 H1 WAT 684 31.108 112.037 127.991 1.00 0.00 H ATOM 92415 H2 WAT 684 32.412 111.773 128.715 1.00 0.00 H TER 92417 WAT 684 ATOM 92417 O WAT 685 135.439 81.099 140.814 1.00 0.00 O ATOM 92418 H1 WAT 685 135.970 81.308 140.045 1.00 0.00 H ATOM 92419 H2 WAT 685 136.076 80.957 141.513 1.00 0.00 H TER 92421 WAT 685 ATOM 92421 O WAT 686 51.304 26.606 110.556 1.00 0.00 O ATOM 92422 H1 WAT 686 50.384 26.420 110.743 1.00 0.00 H ATOM 92423 H2 WAT 686 51.280 27.215 109.818 1.00 0.00 H TER 92425 WAT 686 ATOM 92425 O WAT 687 12.949 132.800 92.449 1.00 0.00 O ATOM 92426 H1 WAT 687 12.922 132.352 93.294 1.00 0.00 H ATOM 92427 H2 WAT 687 13.757 133.314 92.476 1.00 0.00 H TER 92429 WAT 687 ATOM 92429 O WAT 688 123.553 62.736 121.410 1.00 0.00 O ATOM 92430 H1 WAT 688 123.942 62.308 120.648 1.00 0.00 H ATOM 92431 H2 WAT 688 122.955 63.386 121.041 1.00 0.00 H TER 92433 WAT 688 ATOM 92433 O WAT 689 31.566 142.582 114.986 1.00 0.00 O ATOM 92434 H1 WAT 689 32.223 142.701 115.671 1.00 0.00 H ATOM 92435 H2 WAT 689 30.885 143.223 115.193 1.00 0.00 H TER 92437 WAT 689 ATOM 92437 O WAT 690 73.922 68.986 140.502 1.00 0.00 O ATOM 92438 H1 WAT 690 74.321 68.122 140.604 1.00 0.00 H ATOM 92439 H2 WAT 690 73.014 68.865 140.783 1.00 0.00 H TER 92441 WAT 690 ATOM 92441 O WAT 691 60.237 82.619 124.041 1.00 0.00 O ATOM 92442 H1 WAT 691 60.551 82.813 124.925 1.00 0.00 H ATOM 92443 H2 WAT 691 59.322 82.900 124.045 1.00 0.00 H TER 92445 WAT 691 ATOM 92445 O WAT 692 107.140 19.149 23.326 1.00 0.00 O ATOM 92446 H1 WAT 692 106.871 19.797 23.978 1.00 0.00 H ATOM 92447 H2 WAT 692 107.932 19.518 22.934 1.00 0.00 H TER 92449 WAT 692 ATOM 92449 O WAT 693 78.275 128.671 115.472 1.00 0.00 O ATOM 92450 H1 WAT 693 77.904 128.007 114.892 1.00 0.00 H ATOM 92451 H2 WAT 693 78.331 128.240 116.325 1.00 0.00 H TER 92453 WAT 693 ATOM 92453 O WAT 694 125.290 8.992 153.150 1.00 0.00 O ATOM 92454 H1 WAT 694 124.657 9.131 153.854 1.00 0.00 H ATOM 92455 H2 WAT 694 125.976 9.640 153.314 1.00 0.00 H TER 92457 WAT 694 ATOM 92457 O WAT 695 145.007 99.491 4.804 1.00 0.00 O ATOM 92458 H1 WAT 695 144.548 99.600 5.636 1.00 0.00 H ATOM 92459 H2 WAT 695 145.414 98.626 4.867 1.00 0.00 H TER 92461 WAT 695 ATOM 92461 O WAT 696 0.465 117.256 64.777 1.00 0.00 O ATOM 92462 H1 WAT 696 0.829 118.141 64.809 1.00 0.00 H ATOM 92463 H2 WAT 696 -0.481 117.383 64.844 1.00 0.00 H TER 92465 WAT 696 ATOM 92465 O WAT 697 48.228 16.826 154.680 1.00 0.00 O ATOM 92466 H1 WAT 697 47.853 17.690 154.850 1.00 0.00 H ATOM 92467 H2 WAT 697 47.733 16.494 153.931 1.00 0.00 H TER 92469 WAT 697 ATOM 92469 O WAT 698 72.996 136.494 71.491 1.00 0.00 O ATOM 92470 H1 WAT 698 72.728 137.252 70.970 1.00 0.00 H ATOM 92471 H2 WAT 698 73.543 135.979 70.898 1.00 0.00 H TER 92473 WAT 698 ATOM 92473 O WAT 699 18.343 132.336 73.588 1.00 0.00 O ATOM 92474 H1 WAT 699 18.023 131.437 73.664 1.00 0.00 H ATOM 92475 H2 WAT 699 18.789 132.361 72.741 1.00 0.00 H TER 92477 WAT 699 ATOM 92477 O WAT 700 134.522 130.687 150.532 1.00 0.00 O ATOM 92478 H1 WAT 700 134.285 131.046 149.676 1.00 0.00 H ATOM 92479 H2 WAT 700 133.952 131.146 151.149 1.00 0.00 H TER 92481 WAT 700 ATOM 92481 O WAT 701 140.452 140.100 131.728 1.00 0.00 O ATOM 92482 H1 WAT 701 139.888 140.857 131.564 1.00 0.00 H ATOM 92483 H2 WAT 701 140.014 139.623 132.432 1.00 0.00 H TER 92485 WAT 701 ATOM 92485 O WAT 702 144.280 134.010 82.732 1.00 0.00 O ATOM 92486 H1 WAT 702 144.758 133.838 83.543 1.00 0.00 H ATOM 92487 H2 WAT 702 143.590 134.623 82.986 1.00 0.00 H TER 92489 WAT 702 ATOM 92489 O WAT 703 30.462 52.302 124.683 1.00 0.00 O ATOM 92490 H1 WAT 703 30.926 51.491 124.890 1.00 0.00 H ATOM 92491 H2 WAT 703 31.036 52.755 124.065 1.00 0.00 H TER 92493 WAT 703 ATOM 92493 O WAT 704 75.367 120.895 94.972 1.00 0.00 O ATOM 92494 H1 WAT 704 76.317 120.890 94.860 1.00 0.00 H ATOM 92495 H2 WAT 704 75.158 120.014 95.283 1.00 0.00 H TER 92497 WAT 704 ATOM 92497 O WAT 705 33.997 7.042 19.846 1.00 0.00 O ATOM 92498 H1 WAT 705 34.848 6.628 19.984 1.00 0.00 H ATOM 92499 H2 WAT 705 33.433 6.333 19.537 1.00 0.00 H TER 92501 WAT 705 ATOM 92501 O WAT 706 75.580 22.694 142.922 1.00 0.00 O ATOM 92502 H1 WAT 706 75.285 21.804 143.115 1.00 0.00 H ATOM 92503 H2 WAT 706 74.994 23.256 143.430 1.00 0.00 H TER 92505 WAT 706 ATOM 92505 O WAT 707 69.048 19.987 156.580 1.00 0.00 O ATOM 92506 H1 WAT 707 68.374 20.350 156.004 1.00 0.00 H ATOM 92507 H2 WAT 707 68.980 19.040 156.460 1.00 0.00 H TER 92509 WAT 707 ATOM 92509 O WAT 708 11.435 90.542 133.446 1.00 0.00 O ATOM 92510 H1 WAT 708 10.752 90.666 134.105 1.00 0.00 H ATOM 92511 H2 WAT 708 11.033 89.976 132.787 1.00 0.00 H TER 92513 WAT 708 ATOM 92513 O WAT 709 144.995 75.708 153.785 1.00 0.00 O ATOM 92514 H1 WAT 709 144.615 76.131 154.555 1.00 0.00 H ATOM 92515 H2 WAT 709 144.489 74.902 153.680 1.00 0.00 H TER 92517 WAT 709 ATOM 92517 O WAT 710 61.986 58.691 22.616 1.00 0.00 O ATOM 92518 H1 WAT 710 62.637 57.988 22.610 1.00 0.00 H ATOM 92519 H2 WAT 710 61.354 58.426 23.284 1.00 0.00 H TER 92521 WAT 710 ATOM 92521 O WAT 711 91.204 138.494 131.440 1.00 0.00 O ATOM 92522 H1 WAT 711 90.757 137.668 131.256 1.00 0.00 H ATOM 92523 H2 WAT 711 92.035 138.233 131.838 1.00 0.00 H TER 92525 WAT 711 ATOM 92525 O WAT 712 57.990 17.905 14.563 1.00 0.00 O ATOM 92526 H1 WAT 712 57.106 17.564 14.693 1.00 0.00 H ATOM 92527 H2 WAT 712 57.868 18.846 14.435 1.00 0.00 H TER 92529 WAT 712 ATOM 92529 O WAT 713 60.064 128.337 81.079 1.00 0.00 O ATOM 92530 H1 WAT 713 59.480 128.314 81.837 1.00 0.00 H ATOM 92531 H2 WAT 713 60.564 127.523 81.137 1.00 0.00 H TER 92533 WAT 713 ATOM 92533 O WAT 714 19.260 53.992 128.244 1.00 0.00 O ATOM 92534 H1 WAT 714 18.435 53.731 128.654 1.00 0.00 H ATOM 92535 H2 WAT 714 19.898 53.354 128.561 1.00 0.00 H TER 92537 WAT 714 ATOM 92537 O WAT 715 87.033 91.226 63.942 1.00 0.00 O ATOM 92538 H1 WAT 715 86.099 91.423 64.011 1.00 0.00 H ATOM 92539 H2 WAT 715 87.330 91.732 63.186 1.00 0.00 H TER 92541 WAT 715 ATOM 92541 O WAT 716 118.830 33.040 95.559 1.00 0.00 O ATOM 92542 H1 WAT 716 119.169 32.627 94.764 1.00 0.00 H ATOM 92543 H2 WAT 716 119.305 32.612 96.272 1.00 0.00 H TER 92545 WAT 716 ATOM 92545 O WAT 717 50.379 37.698 6.279 1.00 0.00 O ATOM 92546 H1 WAT 717 50.635 37.288 7.106 1.00 0.00 H ATOM 92547 H2 WAT 717 51.206 37.967 5.879 1.00 0.00 H TER 92549 WAT 717 ATOM 92549 O WAT 718 22.315 57.824 117.095 1.00 0.00 O ATOM 92550 H1 WAT 718 22.770 58.650 116.931 1.00 0.00 H ATOM 92551 H2 WAT 718 21.836 57.972 117.911 1.00 0.00 H TER 92553 WAT 718 ATOM 92553 O WAT 719 87.103 17.590 61.058 1.00 0.00 O ATOM 92554 H1 WAT 719 86.470 18.045 61.613 1.00 0.00 H ATOM 92555 H2 WAT 719 87.121 18.100 60.248 1.00 0.00 H TER 92557 WAT 719 ATOM 92557 O WAT 720 52.392 98.504 10.610 1.00 0.00 O ATOM 92558 H1 WAT 720 52.240 97.639 10.989 1.00 0.00 H ATOM 92559 H2 WAT 720 52.922 98.962 11.262 1.00 0.00 H TER 92561 WAT 720 ATOM 92561 O WAT 721 98.818 28.894 108.143 1.00 0.00 O ATOM 92562 H1 WAT 721 98.762 28.323 108.909 1.00 0.00 H ATOM 92563 H2 WAT 721 99.730 28.829 107.861 1.00 0.00 H TER 92565 WAT 721 ATOM 92565 O WAT 722 45.019 92.515 18.565 1.00 0.00 O ATOM 92566 H1 WAT 722 45.476 92.767 17.763 1.00 0.00 H ATOM 92567 H2 WAT 722 44.187 92.988 18.526 1.00 0.00 H TER 92569 WAT 722 ATOM 92569 O WAT 723 103.612 15.347 69.661 1.00 0.00 O ATOM 92570 H1 WAT 723 103.429 14.757 70.393 1.00 0.00 H ATOM 92571 H2 WAT 723 104.228 15.987 70.018 1.00 0.00 H TER 92573 WAT 723 ATOM 92573 O WAT 724 22.447 110.713 67.218 1.00 0.00 O ATOM 92574 H1 WAT 724 21.942 110.733 66.405 1.00 0.00 H ATOM 92575 H2 WAT 724 22.026 111.366 67.777 1.00 0.00 H TER 92577 WAT 724 ATOM 92577 O WAT 725 117.942 49.323 113.684 1.00 0.00 O ATOM 92578 H1 WAT 725 118.380 49.223 112.839 1.00 0.00 H ATOM 92579 H2 WAT 725 118.390 50.059 114.100 1.00 0.00 H TER 92581 WAT 725 ATOM 92581 O WAT 726 128.876 107.686 101.107 1.00 0.00 O ATOM 92582 H1 WAT 726 128.491 106.872 100.781 1.00 0.00 H ATOM 92583 H2 WAT 726 128.796 107.624 102.059 1.00 0.00 H TER 92585 WAT 726 ATOM 92585 O WAT 727 102.265 132.636 158.248 1.00 0.00 O ATOM 92586 H1 WAT 727 102.291 132.698 157.293 1.00 0.00 H ATOM 92587 H2 WAT 727 103.040 133.116 158.540 1.00 0.00 H TER 92589 WAT 727 ATOM 92589 O WAT 728 48.422 23.704 9.293 1.00 0.00 O ATOM 92590 H1 WAT 728 48.892 24.123 8.571 1.00 0.00 H ATOM 92591 H2 WAT 728 49.072 23.134 9.703 1.00 0.00 H TER 92593 WAT 728 ATOM 92593 O WAT 729 46.263 65.920 90.643 1.00 0.00 O ATOM 92594 H1 WAT 729 46.634 65.897 89.760 1.00 0.00 H ATOM 92595 H2 WAT 729 46.919 65.487 91.189 1.00 0.00 H TER 92597 WAT 729 ATOM 92597 O WAT 730 111.961 21.510 145.028 1.00 0.00 O ATOM 92598 H1 WAT 730 111.230 21.374 144.425 1.00 0.00 H ATOM 92599 H2 WAT 730 111.691 21.071 145.835 1.00 0.00 H TER 92601 WAT 730 ATOM 92601 O WAT 731 7.861 90.463 95.207 1.00 0.00 O ATOM 92602 H1 WAT 731 7.908 90.295 96.148 1.00 0.00 H ATOM 92603 H2 WAT 731 8.362 89.751 94.810 1.00 0.00 H TER 92605 WAT 731 ATOM 92605 O WAT 732 99.375 103.412 70.396 1.00 0.00 O ATOM 92606 H1 WAT 732 100.100 102.914 70.017 1.00 0.00 H ATOM 92607 H2 WAT 732 98.937 102.791 70.978 1.00 0.00 H TER 92609 WAT 732 ATOM 92609 O WAT 733 57.560 111.639 108.474 1.00 0.00 O ATOM 92610 H1 WAT 733 58.307 111.042 108.465 1.00 0.00 H ATOM 92611 H2 WAT 733 57.493 111.954 107.573 1.00 0.00 H TER 92613 WAT 733 ATOM 92613 O WAT 734 52.304 134.675 116.286 1.00 0.00 O ATOM 92614 H1 WAT 734 51.787 134.388 115.533 1.00 0.00 H ATOM 92615 H2 WAT 734 53.208 134.467 116.049 1.00 0.00 H TER 92617 WAT 734 ATOM 92617 O WAT 735 109.704 84.933 17.099 1.00 0.00 O ATOM 92618 H1 WAT 735 109.001 85.573 16.982 1.00 0.00 H ATOM 92619 H2 WAT 735 110.363 85.180 16.451 1.00 0.00 H TER 92621 WAT 735 ATOM 92621 O WAT 736 45.826 73.074 122.987 1.00 0.00 O ATOM 92622 H1 WAT 736 45.578 72.329 122.440 1.00 0.00 H ATOM 92623 H2 WAT 736 46.691 72.843 123.327 1.00 0.00 H TER 92625 WAT 736 ATOM 92625 O WAT 737 132.563 133.146 87.902 1.00 0.00 O ATOM 92626 H1 WAT 737 131.717 132.721 87.764 1.00 0.00 H ATOM 92627 H2 WAT 737 133.038 133.006 87.083 1.00 0.00 H TER 92629 WAT 737 ATOM 92629 O WAT 738 123.534 27.907 97.543 1.00 0.00 O ATOM 92630 H1 WAT 738 123.818 28.426 96.790 1.00 0.00 H ATOM 92631 H2 WAT 738 122.578 27.959 97.523 1.00 0.00 H TER 92633 WAT 738 ATOM 92633 O WAT 739 10.900 91.924 118.294 1.00 0.00 O ATOM 92634 H1 WAT 739 10.949 91.440 119.118 1.00 0.00 H ATOM 92635 H2 WAT 739 10.438 91.335 117.697 1.00 0.00 H TER 92637 WAT 739 ATOM 92637 O WAT 740 116.682 141.935 122.629 1.00 0.00 O ATOM 92638 H1 WAT 740 117.520 142.035 122.176 1.00 0.00 H ATOM 92639 H2 WAT 740 116.473 141.005 122.542 1.00 0.00 H TER 92641 WAT 740 ATOM 92641 O WAT 741 38.436 56.717 0.844 1.00 0.00 O ATOM 92642 H1 WAT 741 38.508 56.162 0.068 1.00 0.00 H ATOM 92643 H2 WAT 741 37.576 56.509 1.209 1.00 0.00 H TER 92645 WAT 741 ATOM 92645 O WAT 742 102.779 122.697 111.748 1.00 0.00 O ATOM 92646 H1 WAT 742 103.524 123.296 111.690 1.00 0.00 H ATOM 92647 H2 WAT 742 102.342 122.777 110.900 1.00 0.00 H TER 92649 WAT 742 ATOM 92649 O WAT 743 40.070 65.422 113.742 1.00 0.00 O ATOM 92650 H1 WAT 743 40.987 65.695 113.758 1.00 0.00 H ATOM 92651 H2 WAT 743 40.079 64.578 113.292 1.00 0.00 H TER 92653 WAT 743 ATOM 92653 O WAT 744 134.791 112.288 110.522 1.00 0.00 O ATOM 92654 H1 WAT 744 135.568 111.752 110.363 1.00 0.00 H ATOM 92655 H2 WAT 744 134.284 112.220 109.713 1.00 0.00 H TER 92657 WAT 744 ATOM 92657 O WAT 745 13.660 128.807 14.186 1.00 0.00 O ATOM 92658 H1 WAT 745 12.963 129.197 13.659 1.00 0.00 H ATOM 92659 H2 WAT 745 14.136 128.244 13.575 1.00 0.00 H TER 92661 WAT 745 ATOM 92661 O WAT 746 66.009 38.336 64.972 1.00 0.00 O ATOM 92662 H1 WAT 746 65.139 38.401 64.579 1.00 0.00 H ATOM 92663 H2 WAT 746 66.068 39.095 65.552 1.00 0.00 H TER 92665 WAT 746 ATOM 92665 O WAT 747 64.440 126.313 94.056 1.00 0.00 O ATOM 92666 H1 WAT 747 64.765 125.448 93.805 1.00 0.00 H ATOM 92667 H2 WAT 747 64.331 126.261 95.006 1.00 0.00 H TER 92669 WAT 747 ATOM 92669 O WAT 748 51.262 32.862 4.258 1.00 0.00 O ATOM 92670 H1 WAT 748 51.245 33.565 3.609 1.00 0.00 H ATOM 92671 H2 WAT 748 52.193 32.693 4.404 1.00 0.00 H TER 92673 WAT 748 ATOM 92673 O WAT 749 118.273 137.864 78.610 1.00 0.00 O ATOM 92674 H1 WAT 749 117.521 137.296 78.446 1.00 0.00 H ATOM 92675 H2 WAT 749 118.968 137.267 78.888 1.00 0.00 H TER 92677 WAT 749 ATOM 92677 O WAT 750 82.059 115.655 3.356 1.00 0.00 O ATOM 92678 H1 WAT 750 81.125 115.817 3.493 1.00 0.00 H ATOM 92679 H2 WAT 750 82.497 116.265 3.950 1.00 0.00 H TER 92681 WAT 750 ATOM 92681 O WAT 751 54.086 56.487 87.673 1.00 0.00 O ATOM 92682 H1 WAT 751 54.749 56.963 88.173 1.00 0.00 H ATOM 92683 H2 WAT 751 53.254 56.866 87.955 1.00 0.00 H TER 92685 WAT 751 ATOM 92685 O WAT 752 127.604 111.551 147.046 1.00 0.00 O ATOM 92686 H1 WAT 752 128.438 111.793 147.448 1.00 0.00 H ATOM 92687 H2 WAT 752 127.040 111.321 147.785 1.00 0.00 H TER 92689 WAT 752 ATOM 92689 O WAT 753 143.626 25.557 73.575 1.00 0.00 O ATOM 92690 H1 WAT 753 143.764 24.727 74.032 1.00 0.00 H ATOM 92691 H2 WAT 753 144.458 26.022 73.667 1.00 0.00 H TER 92693 WAT 753 ATOM 92693 O WAT 754 68.202 102.175 147.545 1.00 0.00 O ATOM 92694 H1 WAT 754 67.418 101.808 147.952 1.00 0.00 H ATOM 92695 H2 WAT 754 68.077 102.025 146.608 1.00 0.00 H TER 92697 WAT 754 ATOM 92697 O WAT 755 40.737 121.970 89.675 1.00 0.00 O ATOM 92698 H1 WAT 755 39.839 121.640 89.719 1.00 0.00 H ATOM 92699 H2 WAT 755 41.141 121.674 90.490 1.00 0.00 H TER 92701 WAT 755 ATOM 92701 O WAT 756 58.044 84.184 0.409 1.00 0.00 O ATOM 92702 H1 WAT 756 57.437 83.765 -0.201 1.00 0.00 H ATOM 92703 H2 WAT 756 58.116 83.566 1.137 1.00 0.00 H TER 92705 WAT 756 ATOM 92705 O WAT 757 89.617 137.814 104.204 1.00 0.00 O ATOM 92706 H1 WAT 757 90.194 138.394 104.700 1.00 0.00 H ATOM 92707 H2 WAT 757 88.755 137.935 104.604 1.00 0.00 H TER 92709 WAT 757 ATOM 92709 O WAT 758 76.628 84.131 101.011 1.00 0.00 O ATOM 92710 H1 WAT 758 76.388 83.376 101.548 1.00 0.00 H ATOM 92711 H2 WAT 758 75.811 84.619 100.905 1.00 0.00 H TER 92713 WAT 758 ATOM 92713 O WAT 759 73.157 30.903 11.444 1.00 0.00 O ATOM 92714 H1 WAT 759 74.101 30.824 11.581 1.00 0.00 H ATOM 92715 H2 WAT 759 73.023 31.826 11.226 1.00 0.00 H TER 92717 WAT 759 ATOM 92717 O WAT 760 95.408 60.072 123.481 1.00 0.00 O ATOM 92718 H1 WAT 760 94.714 59.414 123.521 1.00 0.00 H ATOM 92719 H2 WAT 760 95.922 59.925 124.274 1.00 0.00 H TER 92721 WAT 760 ATOM 92721 O WAT 761 38.654 29.560 5.692 1.00 0.00 O ATOM 92722 H1 WAT 761 38.764 30.506 5.787 1.00 0.00 H ATOM 92723 H2 WAT 761 39.522 29.199 5.869 1.00 0.00 H TER 92725 WAT 761 ATOM 92725 O WAT 762 103.543 67.140 15.571 1.00 0.00 O ATOM 92726 H1 WAT 762 102.914 66.419 15.544 1.00 0.00 H ATOM 92727 H2 WAT 762 103.357 67.590 16.395 1.00 0.00 H TER 92729 WAT 762 ATOM 92729 O WAT 763 133.445 28.092 118.094 1.00 0.00 O ATOM 92730 H1 WAT 763 133.977 27.747 118.810 1.00 0.00 H ATOM 92731 H2 WAT 763 133.260 27.331 117.544 1.00 0.00 H TER 92733 WAT 763 ATOM 92733 O WAT 764 126.053 32.416 108.166 1.00 0.00 O ATOM 92734 H1 WAT 764 125.998 31.771 107.461 1.00 0.00 H ATOM 92735 H2 WAT 764 125.427 33.096 107.919 1.00 0.00 H TER 92737 WAT 764 ATOM 92737 O WAT 765 78.389 26.478 137.492 1.00 0.00 O ATOM 92738 H1 WAT 765 77.580 26.361 136.996 1.00 0.00 H ATOM 92739 H2 WAT 765 78.140 26.308 138.401 1.00 0.00 H TER 92741 WAT 765 ATOM 92741 O WAT 766 113.352 75.975 75.791 1.00 0.00 O ATOM 92742 H1 WAT 766 112.723 75.377 76.195 1.00 0.00 H ATOM 92743 H2 WAT 766 112.906 76.822 75.781 1.00 0.00 H TER 92745 WAT 766 ATOM 92745 O WAT 767 56.755 23.121 150.492 1.00 0.00 O ATOM 92746 H1 WAT 767 55.854 22.830 150.636 1.00 0.00 H ATOM 92747 H2 WAT 767 56.936 23.709 151.225 1.00 0.00 H TER 92749 WAT 767 ATOM 92749 O WAT 768 144.503 46.526 90.318 1.00 0.00 O ATOM 92750 H1 WAT 768 143.787 46.177 90.849 1.00 0.00 H ATOM 92751 H2 WAT 768 144.091 46.765 89.488 1.00 0.00 H TER 92753 WAT 768 ATOM 92753 O WAT 769 40.718 122.079 85.380 1.00 0.00 O ATOM 92754 H1 WAT 769 41.353 122.509 85.953 1.00 0.00 H ATOM 92755 H2 WAT 769 41.206 121.893 84.578 1.00 0.00 H TER 92757 WAT 769 ATOM 92757 O WAT 770 9.994 85.070 94.012 1.00 0.00 O ATOM 92758 H1 WAT 770 9.097 85.403 93.973 1.00 0.00 H ATOM 92759 H2 WAT 770 10.102 84.778 94.917 1.00 0.00 H TER 92761 WAT 770 ATOM 92761 O WAT 771 88.817 130.832 156.858 1.00 0.00 O ATOM 92762 H1 WAT 771 89.763 130.704 156.783 1.00 0.00 H ATOM 92763 H2 WAT 771 88.611 131.494 156.198 1.00 0.00 H TER 92765 WAT 771 ATOM 92765 O WAT 772 117.621 54.881 76.920 1.00 0.00 O ATOM 92766 H1 WAT 772 118.014 55.414 77.611 1.00 0.00 H ATOM 92767 H2 WAT 772 117.448 55.499 76.210 1.00 0.00 H TER 92769 WAT 772 ATOM 92769 O WAT 773 19.500 102.706 96.638 1.00 0.00 O ATOM 92770 H1 WAT 773 19.180 103.289 95.949 1.00 0.00 H ATOM 92771 H2 WAT 773 20.418 102.555 96.416 1.00 0.00 H TER 92773 WAT 773 ATOM 92773 O WAT 774 130.638 78.736 139.740 1.00 0.00 O ATOM 92774 H1 WAT 774 131.377 79.311 139.941 1.00 0.00 H ATOM 92775 H2 WAT 774 130.592 78.730 138.784 1.00 0.00 H TER 92777 WAT 774 ATOM 92777 O WAT 775 10.873 49.220 64.710 1.00 0.00 O ATOM 92778 H1 WAT 775 11.182 49.154 63.807 1.00 0.00 H ATOM 92779 H2 WAT 775 11.452 49.866 65.115 1.00 0.00 H TER 92781 WAT 775 ATOM 92781 O WAT 776 52.300 11.861 13.493 1.00 0.00 O ATOM 92782 H1 WAT 776 52.118 11.441 12.653 1.00 0.00 H ATOM 92783 H2 WAT 776 53.169 11.542 13.737 1.00 0.00 H TER 92785 WAT 776 ATOM 92785 O WAT 777 65.661 30.288 17.736 1.00 0.00 O ATOM 92786 H1 WAT 777 64.927 29.948 18.246 1.00 0.00 H ATOM 92787 H2 WAT 777 65.575 29.866 16.881 1.00 0.00 H TER 92789 WAT 777 ATOM 92789 O WAT 778 103.094 80.114 110.038 1.00 0.00 O ATOM 92790 H1 WAT 778 103.605 80.758 109.547 1.00 0.00 H ATOM 92791 H2 WAT 778 102.535 79.700 109.381 1.00 0.00 H TER 92793 WAT 778 ATOM 92793 O WAT 779 39.725 10.075 93.741 1.00 0.00 O ATOM 92794 H1 WAT 779 40.483 9.897 94.298 1.00 0.00 H ATOM 92795 H2 WAT 779 39.162 10.635 94.276 1.00 0.00 H TER 92797 WAT 779 ATOM 92797 O WAT 780 123.639 116.620 3.706 1.00 0.00 O ATOM 92798 H1 WAT 780 123.788 115.816 3.208 1.00 0.00 H ATOM 92799 H2 WAT 780 122.687 116.724 3.714 1.00 0.00 H TER 92801 WAT 780 ATOM 92801 O WAT 781 45.091 132.529 112.484 1.00 0.00 O ATOM 92802 H1 WAT 781 45.299 132.327 113.396 1.00 0.00 H ATOM 92803 H2 WAT 781 44.558 133.323 112.530 1.00 0.00 H TER 92805 WAT 781 ATOM 92805 O WAT 782 132.774 96.649 115.546 1.00 0.00 O ATOM 92806 H1 WAT 782 133.270 97.467 115.558 1.00 0.00 H ATOM 92807 H2 WAT 782 131.918 96.883 115.905 1.00 0.00 H TER 92809 WAT 782 ATOM 92809 O WAT 783 15.523 97.501 81.451 1.00 0.00 O ATOM 92810 H1 WAT 783 14.959 96.784 81.742 1.00 0.00 H ATOM 92811 H2 WAT 783 15.109 98.289 81.804 1.00 0.00 H TER 92813 WAT 783 ATOM 92813 O WAT 784 1.371 113.265 148.965 1.00 0.00 O ATOM 92814 H1 WAT 784 0.499 113.642 148.849 1.00 0.00 H ATOM 92815 H2 WAT 784 1.247 112.569 149.611 1.00 0.00 H TER 92817 WAT 784 ATOM 92817 O WAT 785 127.476 118.548 142.474 1.00 0.00 O ATOM 92818 H1 WAT 785 128.002 117.762 142.324 1.00 0.00 H ATOM 92819 H2 WAT 785 126.664 118.388 141.995 1.00 0.00 H TER 92821 WAT 785 ATOM 92821 O WAT 786 57.792 44.622 111.965 1.00 0.00 O ATOM 92822 H1 WAT 786 56.863 44.392 111.956 1.00 0.00 H ATOM 92823 H2 WAT 786 57.873 45.266 112.669 1.00 0.00 H TER 92825 WAT 786 ATOM 92825 O WAT 787 44.777 95.380 121.758 1.00 0.00 O ATOM 92826 H1 WAT 787 45.685 95.095 121.647 1.00 0.00 H ATOM 92827 H2 WAT 787 44.666 95.459 122.706 1.00 0.00 H TER 92829 WAT 787 ATOM 92829 O WAT 788 128.618 18.084 3.067 1.00 0.00 O ATOM 92830 H1 WAT 788 127.848 17.584 2.794 1.00 0.00 H ATOM 92831 H2 WAT 788 128.750 18.722 2.366 1.00 0.00 H TER 92833 WAT 788 ATOM 92833 O WAT 789 83.658 0.501 148.402 1.00 0.00 O ATOM 92834 H1 WAT 789 84.273 0.503 147.668 1.00 0.00 H ATOM 92835 H2 WAT 789 83.349 -0.404 148.452 1.00 0.00 H TER 92837 WAT 789 ATOM 92837 O WAT 790 80.149 118.694 12.611 1.00 0.00 O ATOM 92838 H1 WAT 790 80.516 118.528 13.480 1.00 0.00 H ATOM 92839 H2 WAT 790 79.600 117.931 12.433 1.00 0.00 H TER 92841 WAT 790 ATOM 92841 O WAT 791 83.902 129.567 4.803 1.00 0.00 O ATOM 92842 H1 WAT 791 84.320 129.106 5.531 1.00 0.00 H ATOM 92843 H2 WAT 791 84.572 130.174 4.488 1.00 0.00 H TER 92845 WAT 791 ATOM 92845 O WAT 792 96.593 136.827 77.591 1.00 0.00 O ATOM 92846 H1 WAT 792 96.060 136.812 76.796 1.00 0.00 H ATOM 92847 H2 WAT 792 96.458 137.703 77.953 1.00 0.00 H TER 92849 WAT 792 ATOM 92849 O WAT 793 61.306 63.336 106.273 1.00 0.00 O ATOM 92850 H1 WAT 793 61.949 62.632 106.191 1.00 0.00 H ATOM 92851 H2 WAT 793 61.429 63.866 105.486 1.00 0.00 H TER 92853 WAT 793 ATOM 92853 O WAT 794 122.608 102.093 12.079 1.00 0.00 O ATOM 92854 H1 WAT 794 123.366 101.540 11.889 1.00 0.00 H ATOM 92855 H2 WAT 794 121.905 101.730 11.540 1.00 0.00 H TER 92857 WAT 794 ATOM 92857 O WAT 795 79.296 58.971 98.882 1.00 0.00 O ATOM 92858 H1 WAT 795 79.732 58.422 99.533 1.00 0.00 H ATOM 92859 H2 WAT 795 79.387 58.488 98.061 1.00 0.00 H TER 92861 WAT 795 ATOM 92861 O WAT 796 99.000 65.450 97.611 1.00 0.00 O ATOM 92862 H1 WAT 796 99.116 64.522 97.405 1.00 0.00 H ATOM 92863 H2 WAT 796 99.493 65.578 98.421 1.00 0.00 H TER 92865 WAT 796 ATOM 92865 O WAT 797 119.789 131.196 111.563 1.00 0.00 O ATOM 92866 H1 WAT 797 119.492 130.582 110.892 1.00 0.00 H ATOM 92867 H2 WAT 797 120.038 131.982 111.076 1.00 0.00 H TER 92869 WAT 797 ATOM 92869 O WAT 798 128.689 62.040 58.383 1.00 0.00 O ATOM 92870 H1 WAT 798 128.903 61.142 58.635 1.00 0.00 H ATOM 92871 H2 WAT 798 128.621 62.512 59.213 1.00 0.00 H TER 92873 WAT 798 ATOM 92873 O WAT 799 59.658 92.860 62.716 1.00 0.00 O ATOM 92874 H1 WAT 799 59.098 93.386 63.287 1.00 0.00 H ATOM 92875 H2 WAT 799 59.279 91.981 62.753 1.00 0.00 H TER 92877 WAT 799 ATOM 92877 O WAT 800 99.420 68.668 108.780 1.00 0.00 O ATOM 92878 H1 WAT 800 99.562 69.581 108.531 1.00 0.00 H ATOM 92879 H2 WAT 800 98.473 68.597 108.903 1.00 0.00 H TER 92881 WAT 800 ATOM 92881 O WAT 801 95.981 44.667 144.595 1.00 0.00 O ATOM 92882 H1 WAT 801 95.500 44.518 143.781 1.00 0.00 H ATOM 92883 H2 WAT 801 96.798 45.081 144.318 1.00 0.00 H TER 92885 WAT 801 ATOM 92885 O WAT 802 17.450 17.962 142.995 1.00 0.00 O ATOM 92886 H1 WAT 802 17.055 18.463 142.281 1.00 0.00 H ATOM 92887 H2 WAT 802 17.460 17.059 142.676 1.00 0.00 H TER 92889 WAT 802 ATOM 92889 O WAT 803 126.270 19.750 11.282 1.00 0.00 O ATOM 92890 H1 WAT 803 126.473 19.064 11.918 1.00 0.00 H ATOM 92891 H2 WAT 803 125.462 19.455 10.862 1.00 0.00 H TER 92893 WAT 803 ATOM 92893 O WAT 804 91.767 20.217 74.933 1.00 0.00 O ATOM 92894 H1 WAT 804 92.635 20.036 75.292 1.00 0.00 H ATOM 92895 H2 WAT 804 91.164 20.006 75.646 1.00 0.00 H TER 92897 WAT 804 ATOM 92897 O WAT 805 144.338 72.587 128.717 1.00 0.00 O ATOM 92898 H1 WAT 805 143.499 72.546 128.258 1.00 0.00 H ATOM 92899 H2 WAT 805 144.750 71.741 128.540 1.00 0.00 H TER 92901 WAT 805 ATOM 92901 O WAT 806 67.148 27.922 91.259 1.00 0.00 O ATOM 92902 H1 WAT 806 66.956 27.321 91.979 1.00 0.00 H ATOM 92903 H2 WAT 806 67.218 28.781 91.676 1.00 0.00 H TER 92905 WAT 806 ATOM 92905 O WAT 807 28.157 55.476 52.950 1.00 0.00 O ATOM 92906 H1 WAT 807 27.864 56.073 52.262 1.00 0.00 H ATOM 92907 H2 WAT 807 28.240 56.028 53.727 1.00 0.00 H TER 92909 WAT 807 ATOM 92909 O WAT 808 19.630 55.925 11.037 1.00 0.00 O ATOM 92910 H1 WAT 808 19.260 55.108 11.371 1.00 0.00 H ATOM 92911 H2 WAT 808 18.987 56.593 11.274 1.00 0.00 H TER 92913 WAT 808 ATOM 92913 O WAT 809 116.251 61.352 104.468 1.00 0.00 O ATOM 92914 H1 WAT 809 116.169 60.513 104.015 1.00 0.00 H ATOM 92915 H2 WAT 809 116.424 61.117 105.379 1.00 0.00 H TER 92917 WAT 809 ATOM 92917 O WAT 810 78.295 128.204 83.510 1.00 0.00 O ATOM 92918 H1 WAT 810 78.563 127.341 83.195 1.00 0.00 H ATOM 92919 H2 WAT 810 78.307 128.759 82.730 1.00 0.00 H TER 92921 WAT 810 ATOM 92921 O WAT 811 85.101 8.284 6.646 1.00 0.00 O ATOM 92922 H1 WAT 811 84.920 7.640 5.962 1.00 0.00 H ATOM 92923 H2 WAT 811 84.344 8.232 7.230 1.00 0.00 H TER 92925 WAT 811 ATOM 92925 O WAT 812 26.138 81.232 148.895 1.00 0.00 O ATOM 92926 H1 WAT 812 26.345 80.647 148.166 1.00 0.00 H ATOM 92927 H2 WAT 812 26.784 81.936 148.828 1.00 0.00 H TER 92929 WAT 812 ATOM 92929 O WAT 813 98.832 74.625 19.760 1.00 0.00 O ATOM 92930 H1 WAT 813 99.324 73.810 19.858 1.00 0.00 H ATOM 92931 H2 WAT 813 99.339 75.136 19.129 1.00 0.00 H TER 92933 WAT 813 ATOM 92933 O WAT 814 134.876 101.267 140.255 1.00 0.00 O ATOM 92934 H1 WAT 814 133.922 101.213 140.193 1.00 0.00 H ATOM 92935 H2 WAT 814 135.104 102.056 139.764 1.00 0.00 H TER 92937 WAT 814 ATOM 92937 O WAT 815 113.472 133.621 120.925 1.00 0.00 O ATOM 92938 H1 WAT 815 112.791 133.894 121.540 1.00 0.00 H ATOM 92939 H2 WAT 815 114.293 133.793 121.385 1.00 0.00 H TER 92941 WAT 815 ATOM 92941 O WAT 816 67.691 12.666 6.842 1.00 0.00 O ATOM 92942 H1 WAT 816 67.225 11.833 6.767 1.00 0.00 H ATOM 92943 H2 WAT 816 68.583 12.421 7.088 1.00 0.00 H TER 92945 WAT 816 ATOM 92945 O WAT 817 38.364 1.608 89.558 1.00 0.00 O ATOM 92946 H1 WAT 817 37.560 1.425 90.044 1.00 0.00 H ATOM 92947 H2 WAT 817 38.811 0.764 89.507 1.00 0.00 H TER 92949 WAT 817 ATOM 92949 O WAT 818 119.372 138.457 127.974 1.00 0.00 O ATOM 92950 H1 WAT 818 118.592 138.214 128.472 1.00 0.00 H ATOM 92951 H2 WAT 818 120.029 137.808 128.227 1.00 0.00 H TER 92953 WAT 818 ATOM 92953 O WAT 819 19.118 15.721 12.202 1.00 0.00 O ATOM 92954 H1 WAT 819 20.047 15.491 12.173 1.00 0.00 H ATOM 92955 H2 WAT 819 18.910 15.994 11.308 1.00 0.00 H TER 92957 WAT 819 ATOM 92957 O WAT 820 100.191 48.740 19.327 1.00 0.00 O ATOM 92958 H1 WAT 820 99.249 48.631 19.454 1.00 0.00 H ATOM 92959 H2 WAT 820 100.424 49.481 19.886 1.00 0.00 H TER 92961 WAT 820 ATOM 92961 O WAT 821 60.684 116.703 74.156 1.00 0.00 O ATOM 92962 H1 WAT 821 60.648 115.772 74.376 1.00 0.00 H ATOM 92963 H2 WAT 821 60.403 116.744 73.242 1.00 0.00 H TER 92965 WAT 821 ATOM 92965 O WAT 822 27.080 36.625 18.485 1.00 0.00 O ATOM 92966 H1 WAT 822 27.987 36.861 18.291 1.00 0.00 H ATOM 92967 H2 WAT 822 27.126 36.157 19.318 1.00 0.00 H TER 92969 WAT 822 ATOM 92969 O WAT 823 91.070 11.128 145.338 1.00 0.00 O ATOM 92970 H1 WAT 823 90.589 10.764 146.081 1.00 0.00 H ATOM 92971 H2 WAT 823 91.418 10.363 144.880 1.00 0.00 H TER 92973 WAT 823 ATOM 92973 O WAT 824 23.884 103.804 6.070 1.00 0.00 O ATOM 92974 H1 WAT 824 23.107 104.092 5.590 1.00 0.00 H ATOM 92975 H2 WAT 824 23.634 103.872 6.992 1.00 0.00 H TER 92977 WAT 824 ATOM 92977 O WAT 825 44.487 50.971 84.364 1.00 0.00 O ATOM 92978 H1 WAT 825 44.213 50.373 83.669 1.00 0.00 H ATOM 92979 H2 WAT 825 44.067 51.803 84.143 1.00 0.00 H TER 92981 WAT 825 ATOM 92981 O WAT 826 77.369 20.244 65.742 1.00 0.00 O ATOM 92982 H1 WAT 826 77.268 20.012 64.818 1.00 0.00 H ATOM 92983 H2 WAT 826 78.105 20.856 65.755 1.00 0.00 H TER 92985 WAT 826 ATOM 92985 O WAT 827 48.584 136.547 62.177 1.00 0.00 O ATOM 92986 H1 WAT 827 48.225 135.885 61.585 1.00 0.00 H ATOM 92987 H2 WAT 827 47.979 136.558 62.919 1.00 0.00 H TER 92989 WAT 827 ATOM 92989 O WAT 828 29.164 84.416 13.497 1.00 0.00 O ATOM 92990 H1 WAT 828 29.772 85.128 13.695 1.00 0.00 H ATOM 92991 H2 WAT 828 28.566 84.786 12.847 1.00 0.00 H TER 92993 WAT 828 ATOM 92993 O WAT 829 104.254 137.379 107.998 1.00 0.00 O ATOM 92994 H1 WAT 829 104.586 138.019 108.627 1.00 0.00 H ATOM 92995 H2 WAT 829 104.839 136.627 108.090 1.00 0.00 H TER 92997 WAT 829 ATOM 92997 O WAT 830 69.435 59.318 116.115 1.00 0.00 O ATOM 92998 H1 WAT 830 69.216 60.224 116.334 1.00 0.00 H ATOM 92999 H2 WAT 830 69.116 59.205 115.219 1.00 0.00 H TER 93001 WAT 830 ATOM 93001 O WAT 831 70.022 92.929 93.845 1.00 0.00 O ATOM 93002 H1 WAT 831 70.102 92.233 94.497 1.00 0.00 H ATOM 93003 H2 WAT 831 69.187 93.351 94.048 1.00 0.00 H TER 93005 WAT 831 ATOM 93005 O WAT 832 52.618 80.521 68.054 1.00 0.00 O ATOM 93006 H1 WAT 832 52.249 79.693 68.362 1.00 0.00 H ATOM 93007 H2 WAT 832 52.556 81.107 68.808 1.00 0.00 H TER 93009 WAT 832 ATOM 93009 O WAT 833 7.782 141.432 61.352 1.00 0.00 O ATOM 93010 H1 WAT 833 7.992 140.803 60.662 1.00 0.00 H ATOM 93011 H2 WAT 833 8.614 141.581 61.801 1.00 0.00 H TER 93013 WAT 833 ATOM 93013 O WAT 834 123.161 14.484 136.896 1.00 0.00 O ATOM 93014 H1 WAT 834 122.563 13.785 136.629 1.00 0.00 H ATOM 93015 H2 WAT 834 124.024 14.071 136.902 1.00 0.00 H TER 93017 WAT 834 ATOM 93017 O WAT 835 21.580 123.817 58.403 1.00 0.00 O ATOM 93018 H1 WAT 835 22.267 123.248 58.056 1.00 0.00 H ATOM 93019 H2 WAT 835 22.042 124.424 58.981 1.00 0.00 H TER 93021 WAT 835 ATOM 93021 O WAT 836 3.672 98.516 63.708 1.00 0.00 O ATOM 93022 H1 WAT 836 2.905 98.084 64.083 1.00 0.00 H ATOM 93023 H2 WAT 836 4.181 97.804 63.319 1.00 0.00 H TER 93025 WAT 836 ATOM 93025 O WAT 837 58.860 63.865 90.712 1.00 0.00 O ATOM 93026 H1 WAT 837 58.129 63.873 90.093 1.00 0.00 H ATOM 93027 H2 WAT 837 58.765 64.680 91.205 1.00 0.00 H TER 93029 WAT 837 ATOM 93029 O WAT 838 112.353 66.728 96.418 1.00 0.00 O ATOM 93030 H1 WAT 838 111.856 66.034 96.852 1.00 0.00 H ATOM 93031 H2 WAT 838 112.432 67.415 97.080 1.00 0.00 H TER 93033 WAT 838 ATOM 93033 O WAT 839 131.002 81.754 87.708 1.00 0.00 O ATOM 93034 H1 WAT 839 131.044 80.824 87.485 1.00 0.00 H ATOM 93035 H2 WAT 839 131.252 82.205 86.902 1.00 0.00 H TER 93037 WAT 839 ATOM 93037 O WAT 840 109.389 32.362 118.281 1.00 0.00 O ATOM 93038 H1 WAT 840 110.132 31.764 118.199 1.00 0.00 H ATOM 93039 H2 WAT 840 109.551 32.834 119.098 1.00 0.00 H TER 93041 WAT 840 ATOM 93041 O WAT 841 90.398 39.626 69.485 1.00 0.00 O ATOM 93042 H1 WAT 841 90.270 39.048 70.238 1.00 0.00 H ATOM 93043 H2 WAT 841 91.198 40.110 69.688 1.00 0.00 H TER 93045 WAT 841 ATOM 93045 O WAT 842 38.233 32.625 6.251 1.00 0.00 O ATOM 93046 H1 WAT 842 37.314 32.822 6.072 1.00 0.00 H ATOM 93047 H2 WAT 842 38.719 33.153 5.617 1.00 0.00 H TER 93049 WAT 842 ATOM 93049 O WAT 843 74.781 1.168 60.267 1.00 0.00 O ATOM 93050 H1 WAT 843 74.677 0.222 60.169 1.00 0.00 H ATOM 93051 H2 WAT 843 74.154 1.544 59.650 1.00 0.00 H TER 93053 WAT 843 ATOM 93053 O WAT 844 138.634 124.250 68.277 1.00 0.00 O ATOM 93054 H1 WAT 844 138.922 123.347 68.411 1.00 0.00 H ATOM 93055 H2 WAT 844 137.720 124.254 68.561 1.00 0.00 H TER 93057 WAT 844 ATOM 93057 O WAT 845 62.993 27.231 1.573 1.00 0.00 O ATOM 93058 H1 WAT 845 62.082 27.439 1.368 1.00 0.00 H ATOM 93059 H2 WAT 845 63.106 27.513 2.480 1.00 0.00 H TER 93061 WAT 845 ATOM 93061 O WAT 846 102.078 112.924 93.075 1.00 0.00 O ATOM 93062 H1 WAT 846 102.581 113.710 93.287 1.00 0.00 H ATOM 93063 H2 WAT 846 102.637 112.199 93.353 1.00 0.00 H TER 93065 WAT 846 ATOM 93065 O WAT 847 73.484 20.334 78.849 1.00 0.00 O ATOM 93066 H1 WAT 847 74.177 20.542 78.222 1.00 0.00 H ATOM 93067 H2 WAT 847 72.722 20.820 78.535 1.00 0.00 H TER 93069 WAT 847 ATOM 93069 O WAT 848 21.986 45.615 74.258 1.00 0.00 O ATOM 93070 H1 WAT 848 21.789 46.297 73.615 1.00 0.00 H ATOM 93071 H2 WAT 848 22.643 46.011 74.832 1.00 0.00 H TER 93073 WAT 848 ATOM 93073 O WAT 849 137.497 55.360 146.370 1.00 0.00 O ATOM 93074 H1 WAT 849 137.655 56.116 146.934 1.00 0.00 H ATOM 93075 H2 WAT 849 138.201 54.748 146.586 1.00 0.00 H TER 93077 WAT 849 ATOM 93077 O WAT 850 84.825 27.439 122.364 1.00 0.00 O ATOM 93078 H1 WAT 850 84.618 26.527 122.573 1.00 0.00 H ATOM 93079 H2 WAT 850 85.091 27.419 121.445 1.00 0.00 H TER 93081 WAT 850 ATOM 93081 O WAT 851 145.289 73.169 107.270 1.00 0.00 O ATOM 93082 H1 WAT 851 144.496 72.789 107.647 1.00 0.00 H ATOM 93083 H2 WAT 851 145.987 72.913 107.872 1.00 0.00 H TER 93085 WAT 851 ATOM 93085 O WAT 852 130.542 128.320 70.175 1.00 0.00 O ATOM 93086 H1 WAT 852 129.753 128.542 69.680 1.00 0.00 H ATOM 93087 H2 WAT 852 130.219 127.827 70.930 1.00 0.00 H TER 93089 WAT 852 ATOM 93089 O WAT 853 138.410 137.142 137.544 1.00 0.00 O ATOM 93090 H1 WAT 853 137.815 137.061 136.798 1.00 0.00 H ATOM 93091 H2 WAT 853 138.903 136.322 137.547 1.00 0.00 H TER 93093 WAT 853 ATOM 93093 O WAT 854 110.258 111.380 141.150 1.00 0.00 O ATOM 93094 H1 WAT 854 110.369 110.464 141.406 1.00 0.00 H ATOM 93095 H2 WAT 854 111.129 111.765 141.254 1.00 0.00 H TER 93097 WAT 854 ATOM 93097 O WAT 855 36.302 28.134 136.547 1.00 0.00 O ATOM 93098 H1 WAT 855 36.592 27.292 136.898 1.00 0.00 H ATOM 93099 H2 WAT 855 35.461 27.943 136.131 1.00 0.00 H TER 93101 WAT 855 ATOM 93101 O WAT 856 37.768 73.399 141.431 1.00 0.00 O ATOM 93102 H1 WAT 856 38.338 73.805 142.083 1.00 0.00 H ATOM 93103 H2 WAT 856 36.908 73.370 141.850 1.00 0.00 H TER 93105 WAT 856 ATOM 93105 O WAT 857 92.987 94.849 10.789 1.00 0.00 O ATOM 93106 H1 WAT 857 92.167 95.325 10.922 1.00 0.00 H ATOM 93107 H2 WAT 857 92.754 93.929 10.914 1.00 0.00 H TER 93109 WAT 857 ATOM 93109 O WAT 858 37.547 40.442 5.220 1.00 0.00 O ATOM 93110 H1 WAT 858 38.359 40.890 5.456 1.00 0.00 H ATOM 93111 H2 WAT 858 37.231 40.069 6.043 1.00 0.00 H TER 93113 WAT 858 ATOM 93113 O WAT 859 114.182 12.000 154.848 1.00 0.00 O ATOM 93114 H1 WAT 859 114.183 11.339 155.540 1.00 0.00 H ATOM 93115 H2 WAT 859 113.831 11.544 154.083 1.00 0.00 H TER 93117 WAT 859 ATOM 93117 O WAT 860 7.358 50.402 112.534 1.00 0.00 O ATOM 93118 H1 WAT 860 7.399 51.177 111.973 1.00 0.00 H ATOM 93119 H2 WAT 860 7.490 50.741 113.419 1.00 0.00 H TER 93121 WAT 860 ATOM 93121 O WAT 861 116.133 74.328 5.928 1.00 0.00 O ATOM 93122 H1 WAT 861 115.383 73.749 5.790 1.00 0.00 H ATOM 93123 H2 WAT 861 116.293 74.722 5.071 1.00 0.00 H TER 93125 WAT 861 ATOM 93125 O WAT 862 104.901 14.341 111.571 1.00 0.00 O ATOM 93126 H1 WAT 862 104.078 13.930 111.307 1.00 0.00 H ATOM 93127 H2 WAT 862 104.801 15.260 111.321 1.00 0.00 H TER 93129 WAT 862 ATOM 93129 O WAT 863 70.300 71.468 119.523 1.00 0.00 O ATOM 93130 H1 WAT 863 69.948 71.120 118.704 1.00 0.00 H ATOM 93131 H2 WAT 863 70.087 72.401 119.498 1.00 0.00 H TER 93133 WAT 863 ATOM 93133 O WAT 864 45.695 46.992 62.562 1.00 0.00 O ATOM 93134 H1 WAT 864 46.305 46.256 62.514 1.00 0.00 H ATOM 93135 H2 WAT 864 46.242 47.765 62.421 1.00 0.00 H TER 93137 WAT 864 ATOM 93137 O WAT 865 105.652 42.341 151.987 1.00 0.00 O ATOM 93138 H1 WAT 865 105.264 43.008 152.554 1.00 0.00 H ATOM 93139 H2 WAT 865 104.970 41.676 151.898 1.00 0.00 H TER 93141 WAT 865 ATOM 93141 O WAT 866 33.469 42.610 155.271 1.00 0.00 O ATOM 93142 H1 WAT 866 33.896 42.840 154.446 1.00 0.00 H ATOM 93143 H2 WAT 866 32.533 42.663 155.079 1.00 0.00 H TER 93145 WAT 866 ATOM 93145 O WAT 867 16.529 76.281 100.983 1.00 0.00 O ATOM 93146 H1 WAT 867 15.757 76.381 101.539 1.00 0.00 H ATOM 93147 H2 WAT 867 16.266 76.644 100.137 1.00 0.00 H TER 93149 WAT 867 ATOM 93149 O WAT 868 139.635 27.763 100.291 1.00 0.00 O ATOM 93150 H1 WAT 868 139.833 28.454 100.923 1.00 0.00 H ATOM 93151 H2 WAT 868 138.825 27.368 100.614 1.00 0.00 H TER 93153 WAT 868 ATOM 93153 O WAT 869 63.414 145.597 64.105 1.00 0.00 O ATOM 93154 H1 WAT 869 64.033 144.929 63.812 1.00 0.00 H ATOM 93155 H2 WAT 869 63.959 146.254 64.538 1.00 0.00 H TER 93157 WAT 869 ATOM 93157 O WAT 870 111.299 82.915 25.881 1.00 0.00 O ATOM 93158 H1 WAT 870 111.365 83.623 25.240 1.00 0.00 H ATOM 93159 H2 WAT 870 112.114 82.969 26.381 1.00 0.00 H TER 93161 WAT 870 ATOM 93161 O WAT 871 136.344 82.616 113.790 1.00 0.00 O ATOM 93162 H1 WAT 871 135.613 82.937 114.319 1.00 0.00 H ATOM 93163 H2 WAT 871 136.622 83.376 113.280 1.00 0.00 H TER 93165 WAT 871 ATOM 93165 O WAT 872 129.372 69.548 69.184 1.00 0.00 O ATOM 93166 H1 WAT 872 129.039 68.654 69.109 1.00 0.00 H ATOM 93167 H2 WAT 872 130.324 69.454 69.147 1.00 0.00 H TER 93169 WAT 872 ATOM 93169 O WAT 873 135.180 103.447 115.836 1.00 0.00 O ATOM 93170 H1 WAT 873 134.754 103.303 116.681 1.00 0.00 H ATOM 93171 H2 WAT 873 135.678 104.257 115.954 1.00 0.00 H TER 93173 WAT 873 ATOM 93173 O WAT 874 131.007 126.236 147.685 1.00 0.00 O ATOM 93174 H1 WAT 874 130.457 126.954 147.996 1.00 0.00 H ATOM 93175 H2 WAT 874 130.387 125.571 147.385 1.00 0.00 H TER 93177 WAT 874 ATOM 93177 O WAT 875 104.905 112.320 68.904 1.00 0.00 O ATOM 93178 H1 WAT 875 104.310 113.055 68.751 1.00 0.00 H ATOM 93179 H2 WAT 875 105.208 112.441 69.803 1.00 0.00 H TER 93181 WAT 875 ATOM 93181 O WAT 876 47.547 12.505 134.591 1.00 0.00 O ATOM 93182 H1 WAT 876 48.391 12.154 134.306 1.00 0.00 H ATOM 93183 H2 WAT 876 47.767 13.321 135.040 1.00 0.00 H TER 93185 WAT 876 ATOM 93185 O WAT 877 140.729 66.597 13.388 1.00 0.00 O ATOM 93186 H1 WAT 877 141.395 66.020 13.012 1.00 0.00 H ATOM 93187 H2 WAT 877 140.183 66.018 13.919 1.00 0.00 H TER 93189 WAT 877 ATOM 93189 O WAT 878 33.223 33.323 5.466 1.00 0.00 O ATOM 93190 H1 WAT 878 33.805 34.016 5.776 1.00 0.00 H ATOM 93191 H2 WAT 878 32.381 33.515 5.880 1.00 0.00 H TER 93193 WAT 878 ATOM 93193 O WAT 879 113.978 122.891 116.023 1.00 0.00 O ATOM 93194 H1 WAT 879 114.072 123.062 116.960 1.00 0.00 H ATOM 93195 H2 WAT 879 113.041 122.738 115.900 1.00 0.00 H TER 93197 WAT 879 ATOM 93197 O WAT 880 105.471 1.177 116.166 1.00 0.00 O ATOM 93198 H1 WAT 880 105.875 0.368 115.852 1.00 0.00 H ATOM 93199 H2 WAT 880 106.105 1.535 116.788 1.00 0.00 H TER 93201 WAT 880 ATOM 93201 O WAT 881 80.893 10.493 130.505 1.00 0.00 O ATOM 93202 H1 WAT 881 80.992 9.702 129.976 1.00 0.00 H ATOM 93203 H2 WAT 881 80.261 11.026 130.023 1.00 0.00 H TER 93205 WAT 881 ATOM 93205 O WAT 882 95.360 45.521 113.107 1.00 0.00 O ATOM 93206 H1 WAT 882 95.536 46.371 112.704 1.00 0.00 H ATOM 93207 H2 WAT 882 96.113 45.366 113.677 1.00 0.00 H TER 93209 WAT 882 ATOM 93209 O WAT 883 64.975 134.332 8.159 1.00 0.00 O ATOM 93210 H1 WAT 883 64.557 134.148 7.318 1.00 0.00 H ATOM 93211 H2 WAT 883 65.894 134.099 8.026 1.00 0.00 H TER 93213 WAT 883 ATOM 93213 O WAT 884 36.173 24.970 104.731 1.00 0.00 O ATOM 93214 H1 WAT 884 35.894 24.060 104.831 1.00 0.00 H ATOM 93215 H2 WAT 884 37.107 24.959 104.944 1.00 0.00 H TER 93217 WAT 884 ATOM 93217 O WAT 885 105.578 125.823 132.787 1.00 0.00 O ATOM 93218 H1 WAT 885 105.605 125.688 133.735 1.00 0.00 H ATOM 93219 H2 WAT 885 105.564 124.939 132.420 1.00 0.00 H TER 93221 WAT 885 ATOM 93221 O WAT 886 31.890 86.916 128.952 1.00 0.00 O ATOM 93222 H1 WAT 886 32.028 87.526 129.678 1.00 0.00 H ATOM 93223 H2 WAT 886 31.056 87.186 128.569 1.00 0.00 H TER 93225 WAT 886 ATOM 93225 O WAT 887 123.687 144.084 82.180 1.00 0.00 O ATOM 93226 H1 WAT 887 124.583 143.817 81.978 1.00 0.00 H ATOM 93227 H2 WAT 887 123.484 144.755 81.529 1.00 0.00 H TER 93229 WAT 887 ATOM 93229 O WAT 888 22.537 101.264 148.594 1.00 0.00 O ATOM 93230 H1 WAT 888 23.118 101.038 147.868 1.00 0.00 H ATOM 93231 H2 WAT 888 23.103 101.256 149.366 1.00 0.00 H TER 93233 WAT 888 ATOM 93233 O WAT 889 56.086 98.794 129.390 1.00 0.00 O ATOM 93234 H1 WAT 889 56.553 99.616 129.241 1.00 0.00 H ATOM 93235 H2 WAT 889 55.384 98.796 128.739 1.00 0.00 H TER 93237 WAT 889 ATOM 93237 O WAT 890 115.470 97.429 86.522 1.00 0.00 O ATOM 93238 H1 WAT 890 116.355 97.065 86.489 1.00 0.00 H ATOM 93239 H2 WAT 890 115.007 97.001 85.802 1.00 0.00 H TER 93241 WAT 890 ATOM 93241 O WAT 891 87.358 130.521 62.321 1.00 0.00 O ATOM 93242 H1 WAT 891 87.318 130.852 61.423 1.00 0.00 H ATOM 93243 H2 WAT 891 86.479 130.184 62.491 1.00 0.00 H TER 93245 WAT 891 ATOM 93245 O WAT 892 93.331 60.055 105.795 1.00 0.00 O ATOM 93246 H1 WAT 892 94.102 59.534 105.571 1.00 0.00 H ATOM 93247 H2 WAT 892 92.611 59.424 105.809 1.00 0.00 H TER 93249 WAT 892 ATOM 93249 O WAT 893 15.827 100.642 130.217 1.00 0.00 O ATOM 93250 H1 WAT 893 15.434 99.848 130.580 1.00 0.00 H ATOM 93251 H2 WAT 893 15.850 100.487 129.273 1.00 0.00 H TER 93253 WAT 893 ATOM 93253 O WAT 894 4.298 102.695 95.192 1.00 0.00 O ATOM 93254 H1 WAT 894 4.439 101.791 95.472 1.00 0.00 H ATOM 93255 H2 WAT 894 5.005 103.188 95.609 1.00 0.00 H TER 93257 WAT 894 ATOM 93257 O WAT 895 145.603 111.566 84.814 1.00 0.00 O ATOM 93258 H1 WAT 895 144.743 111.336 85.168 1.00 0.00 H ATOM 93259 H2 WAT 895 145.682 111.042 84.017 1.00 0.00 H TER 93261 WAT 895 ATOM 93261 O WAT 896 2.857 52.847 3.742 1.00 0.00 O ATOM 93262 H1 WAT 896 2.947 53.651 3.231 1.00 0.00 H ATOM 93263 H2 WAT 896 1.983 52.521 3.523 1.00 0.00 H TER 93265 WAT 896 ATOM 93265 O WAT 897 44.963 40.106 119.632 1.00 0.00 O ATOM 93266 H1 WAT 897 45.441 39.548 119.018 1.00 0.00 H ATOM 93267 H2 WAT 897 44.070 39.761 119.624 1.00 0.00 H TER 93269 WAT 897 ATOM 93269 O WAT 898 114.569 124.735 131.702 1.00 0.00 O ATOM 93270 H1 WAT 898 114.379 123.994 131.126 1.00 0.00 H ATOM 93271 H2 WAT 898 114.942 124.336 132.488 1.00 0.00 H TER 93273 WAT 898 ATOM 93273 O WAT 899 98.904 28.051 128.830 1.00 0.00 O ATOM 93274 H1 WAT 899 98.313 28.589 129.356 1.00 0.00 H ATOM 93275 H2 WAT 899 98.946 27.216 129.296 1.00 0.00 H TER 93277 WAT 899 ATOM 93277 O WAT 900 51.255 82.850 88.771 1.00 0.00 O ATOM 93278 H1 WAT 900 51.846 83.120 88.068 1.00 0.00 H ATOM 93279 H2 WAT 900 51.375 83.511 89.452 1.00 0.00 H TER 93281 WAT 900 ATOM 93281 O WAT 901 120.840 128.536 91.072 1.00 0.00 O ATOM 93282 H1 WAT 901 120.413 129.259 90.612 1.00 0.00 H ATOM 93283 H2 WAT 901 120.385 127.753 90.761 1.00 0.00 H TER 93285 WAT 901 ATOM 93285 O WAT 902 62.789 57.191 154.298 1.00 0.00 O ATOM 93286 H1 WAT 902 62.896 56.338 153.876 1.00 0.00 H ATOM 93287 H2 WAT 902 63.369 57.156 155.058 1.00 0.00 H TER 93289 WAT 902 ATOM 93289 O WAT 903 32.935 110.956 81.081 1.00 0.00 O ATOM 93290 H1 WAT 903 33.332 110.528 81.840 1.00 0.00 H ATOM 93291 H2 WAT 903 33.366 111.810 81.035 1.00 0.00 H TER 93293 WAT 903 ATOM 93293 O WAT 904 140.961 48.869 148.068 1.00 0.00 O ATOM 93294 H1 WAT 904 141.241 49.529 147.434 1.00 0.00 H ATOM 93295 H2 WAT 904 140.522 48.202 147.541 1.00 0.00 H TER 93297 WAT 904 ATOM 93297 O WAT 905 103.729 141.204 8.776 1.00 0.00 O ATOM 93298 H1 WAT 905 104.504 141.751 8.645 1.00 0.00 H ATOM 93299 H2 WAT 905 103.576 141.228 9.721 1.00 0.00 H TER 93301 WAT 905 ATOM 93301 O WAT 906 140.441 142.860 149.999 1.00 0.00 O ATOM 93302 H1 WAT 906 140.297 141.928 149.836 1.00 0.00 H ATOM 93303 H2 WAT 906 139.993 143.301 149.277 1.00 0.00 H TER 93305 WAT 906 ATOM 93305 O WAT 907 144.480 78.382 158.877 1.00 0.00 O ATOM 93306 H1 WAT 907 144.656 77.908 158.064 1.00 0.00 H ATOM 93307 H2 WAT 907 143.699 78.901 158.688 1.00 0.00 H TER 93309 WAT 907 ATOM 93309 O WAT 908 51.311 131.009 75.027 1.00 0.00 O ATOM 93310 H1 WAT 908 50.701 130.722 75.706 1.00 0.00 H ATOM 93311 H2 WAT 908 52.160 131.044 75.467 1.00 0.00 H TER 93313 WAT 908 ATOM 93313 O WAT 909 78.200 95.760 117.252 1.00 0.00 O ATOM 93314 H1 WAT 909 77.620 95.030 117.470 1.00 0.00 H ATOM 93315 H2 WAT 909 77.629 96.402 116.831 1.00 0.00 H TER 93317 WAT 909 ATOM 93317 O WAT 910 107.065 32.337 53.922 1.00 0.00 O ATOM 93318 H1 WAT 910 106.618 32.367 54.768 1.00 0.00 H ATOM 93319 H2 WAT 910 107.574 33.147 53.890 1.00 0.00 H TER 93321 WAT 910 ATOM 93321 O WAT 911 125.350 21.625 140.667 1.00 0.00 O ATOM 93322 H1 WAT 911 125.763 21.458 141.514 1.00 0.00 H ATOM 93323 H2 WAT 911 126.082 21.714 140.057 1.00 0.00 H TER 93325 WAT 911 ATOM 93325 O WAT 912 43.419 54.921 53.952 1.00 0.00 O ATOM 93326 H1 WAT 912 43.463 53.974 54.086 1.00 0.00 H ATOM 93327 H2 WAT 912 43.138 55.021 53.042 1.00 0.00 H TER 93329 WAT 912 ATOM 93329 O WAT 913 91.677 95.097 98.646 1.00 0.00 O ATOM 93330 H1 WAT 913 92.316 94.993 97.941 1.00 0.00 H ATOM 93331 H2 WAT 913 91.219 94.258 98.680 1.00 0.00 H TER 93333 WAT 913 ATOM 93333 O WAT 914 135.985 33.194 90.746 1.00 0.00 O ATOM 93334 H1 WAT 914 135.568 33.920 91.211 1.00 0.00 H ATOM 93335 H2 WAT 914 136.923 33.377 90.809 1.00 0.00 H TER 93337 WAT 914 ATOM 93337 O WAT 915 30.494 128.610 116.035 1.00 0.00 O ATOM 93338 H1 WAT 915 29.742 128.019 116.072 1.00 0.00 H ATOM 93339 H2 WAT 915 30.212 129.387 116.517 1.00 0.00 H TER 93341 WAT 915 ATOM 93341 O WAT 916 110.651 50.369 126.639 1.00 0.00 O ATOM 93342 H1 WAT 916 109.879 50.614 127.148 1.00 0.00 H ATOM 93343 H2 WAT 916 110.814 49.456 126.873 1.00 0.00 H TER 93345 WAT 916 ATOM 93345 O WAT 917 92.759 126.939 13.110 1.00 0.00 O ATOM 93346 H1 WAT 917 93.037 126.102 13.480 1.00 0.00 H ATOM 93347 H2 WAT 917 92.630 126.758 12.179 1.00 0.00 H TER 93349 WAT 917 ATOM 93349 O WAT 918 140.212 18.615 115.517 1.00 0.00 O ATOM 93350 H1 WAT 918 139.429 19.151 115.648 1.00 0.00 H ATOM 93351 H2 WAT 918 139.988 18.039 114.786 1.00 0.00 H TER 93353 WAT 918 ATOM 93353 O WAT 919 15.692 65.885 107.130 1.00 0.00 O ATOM 93354 H1 WAT 919 15.201 66.648 107.437 1.00 0.00 H ATOM 93355 H2 WAT 919 15.161 65.530 106.417 1.00 0.00 H TER 93357 WAT 919 ATOM 93357 O WAT 920 67.091 11.806 82.079 1.00 0.00 O ATOM 93358 H1 WAT 920 66.600 12.496 81.633 1.00 0.00 H ATOM 93359 H2 WAT 920 66.741 11.801 82.970 1.00 0.00 H TER 93361 WAT 920 ATOM 93361 O WAT 921 84.946 7.708 88.695 1.00 0.00 O ATOM 93362 H1 WAT 921 85.401 7.108 89.286 1.00 0.00 H ATOM 93363 H2 WAT 921 84.375 7.143 88.175 1.00 0.00 H TER 93365 WAT 921 ATOM 93365 O WAT 922 43.198 41.619 63.729 1.00 0.00 O ATOM 93366 H1 WAT 922 43.235 41.331 64.641 1.00 0.00 H ATOM 93367 H2 WAT 922 44.114 41.672 63.457 1.00 0.00 H TER 93369 WAT 922 ATOM 93369 O WAT 923 19.788 80.021 7.850 1.00 0.00 O ATOM 93370 H1 WAT 923 19.161 79.334 8.075 1.00 0.00 H ATOM 93371 H2 WAT 923 20.429 80.002 8.560 1.00 0.00 H TER 93373 WAT 923 ATOM 93373 O WAT 924 10.535 120.846 153.268 1.00 0.00 O ATOM 93374 H1 WAT 924 10.654 119.996 153.691 1.00 0.00 H ATOM 93375 H2 WAT 924 11.263 121.378 153.588 1.00 0.00 H TER 93377 WAT 924 ATOM 93377 O WAT 925 48.391 83.274 113.564 1.00 0.00 O ATOM 93378 H1 WAT 925 48.657 82.375 113.755 1.00 0.00 H ATOM 93379 H2 WAT 925 47.684 83.452 114.184 1.00 0.00 H TER 93381 WAT 925 ATOM 93381 O WAT 926 83.072 112.651 90.858 1.00 0.00 O ATOM 93382 H1 WAT 926 82.355 112.312 90.322 1.00 0.00 H ATOM 93383 H2 WAT 926 83.394 111.888 91.338 1.00 0.00 H TER 93385 WAT 926 ATOM 93385 O WAT 927 18.653 42.949 150.969 1.00 0.00 O ATOM 93386 H1 WAT 927 19.240 43.248 151.663 1.00 0.00 H ATOM 93387 H2 WAT 927 19.174 43.015 150.169 1.00 0.00 H TER 93389 WAT 927 ATOM 93389 O WAT 928 25.713 84.344 3.957 1.00 0.00 O ATOM 93390 H1 WAT 928 26.419 83.699 3.998 1.00 0.00 H ATOM 93391 H2 WAT 928 25.745 84.678 3.061 1.00 0.00 H TER 93393 WAT 928 ATOM 93393 O WAT 929 143.577 5.181 106.480 1.00 0.00 O ATOM 93394 H1 WAT 929 143.475 6.112 106.677 1.00 0.00 H ATOM 93395 H2 WAT 929 143.377 5.110 105.547 1.00 0.00 H TER 93397 WAT 929 ATOM 93397 O WAT 930 67.204 80.028 148.489 1.00 0.00 O ATOM 93398 H1 WAT 930 67.507 79.234 148.929 1.00 0.00 H ATOM 93399 H2 WAT 930 66.652 79.711 147.774 1.00 0.00 H TER 93401 WAT 930 ATOM 93401 O WAT 931 32.072 59.025 5.512 1.00 0.00 O ATOM 93402 H1 WAT 931 32.180 58.088 5.346 1.00 0.00 H ATOM 93403 H2 WAT 931 32.182 59.434 4.654 1.00 0.00 H TER 93405 WAT 931 ATOM 93405 O WAT 932 84.008 133.724 94.312 1.00 0.00 O ATOM 93406 H1 WAT 932 83.361 133.998 94.963 1.00 0.00 H ATOM 93407 H2 WAT 932 84.337 134.542 93.942 1.00 0.00 H TER 93409 WAT 932 ATOM 93409 O WAT 933 113.355 128.472 124.162 1.00 0.00 O ATOM 93410 H1 WAT 933 113.175 129.244 124.698 1.00 0.00 H ATOM 93411 H2 WAT 933 113.715 127.832 124.777 1.00 0.00 H TER 93413 WAT 933 ATOM 93413 O WAT 934 83.433 14.538 95.649 1.00 0.00 O ATOM 93414 H1 WAT 934 82.652 14.151 95.253 1.00 0.00 H ATOM 93415 H2 WAT 934 83.972 14.804 94.904 1.00 0.00 H TER 93417 WAT 934 ATOM 93417 O WAT 935 98.229 103.371 104.225 1.00 0.00 O ATOM 93418 H1 WAT 935 98.766 103.762 103.537 1.00 0.00 H ATOM 93419 H2 WAT 935 97.474 103.955 104.300 1.00 0.00 H TER 93421 WAT 935 ATOM 93421 O WAT 936 86.630 74.751 65.837 1.00 0.00 O ATOM 93422 H1 WAT 936 85.720 74.804 66.128 1.00 0.00 H ATOM 93423 H2 WAT 936 87.043 75.537 66.194 1.00 0.00 H TER 93425 WAT 936 ATOM 93425 O WAT 937 7.047 16.130 5.229 1.00 0.00 O ATOM 93426 H1 WAT 937 7.133 15.243 4.880 1.00 0.00 H ATOM 93427 H2 WAT 937 6.135 16.189 5.513 1.00 0.00 H TER 93429 WAT 937 ATOM 93429 O WAT 938 57.891 30.481 147.769 1.00 0.00 O ATOM 93430 H1 WAT 938 57.903 31.433 147.675 1.00 0.00 H ATOM 93431 H2 WAT 938 58.815 30.233 147.810 1.00 0.00 H TER 93433 WAT 938 ATOM 93433 O WAT 939 120.737 128.497 12.297 1.00 0.00 O ATOM 93434 H1 WAT 939 120.648 128.552 13.249 1.00 0.00 H ATOM 93435 H2 WAT 939 120.350 127.652 12.069 1.00 0.00 H TER 93437 WAT 939 ATOM 93437 O WAT 940 37.273 31.173 26.707 1.00 0.00 O ATOM 93438 H1 WAT 940 38.073 31.569 27.052 1.00 0.00 H ATOM 93439 H2 WAT 940 36.703 31.916 26.509 1.00 0.00 H TER 93441 WAT 940 ATOM 93441 O WAT 941 116.840 12.356 134.545 1.00 0.00 O ATOM 93442 H1 WAT 941 116.087 11.832 134.817 1.00 0.00 H ATOM 93443 H2 WAT 941 116.745 12.436 133.596 1.00 0.00 H TER 93445 WAT 941 ATOM 93445 O WAT 942 27.175 116.091 13.879 1.00 0.00 O ATOM 93446 H1 WAT 942 26.710 116.001 13.048 1.00 0.00 H ATOM 93447 H2 WAT 942 28.087 116.241 13.628 1.00 0.00 H TER 93449 WAT 942 ATOM 93449 O WAT 943 57.075 50.671 76.917 1.00 0.00 O ATOM 93450 H1 WAT 943 56.538 50.712 77.707 1.00 0.00 H ATOM 93451 H2 WAT 943 56.616 50.054 76.347 1.00 0.00 H TER 93453 WAT 943 ATOM 93453 O WAT 944 2.180 66.473 3.553 1.00 0.00 O ATOM 93454 H1 WAT 944 2.146 66.991 4.358 1.00 0.00 H ATOM 93455 H2 WAT 944 2.057 67.112 2.852 1.00 0.00 H TER 93457 WAT 944 ATOM 93457 O WAT 945 59.077 28.131 6.601 1.00 0.00 O ATOM 93458 H1 WAT 945 59.603 27.936 7.377 1.00 0.00 H ATOM 93459 H2 WAT 945 59.103 29.085 6.526 1.00 0.00 H TER 93461 WAT 945 ATOM 93461 O WAT 946 84.705 98.443 128.333 1.00 0.00 O ATOM 93462 H1 WAT 946 85.637 98.259 128.214 1.00 0.00 H ATOM 93463 H2 WAT 946 84.551 99.239 127.825 1.00 0.00 H TER 93465 WAT 946 ATOM 93465 O WAT 947 112.159 85.161 155.471 1.00 0.00 O ATOM 93466 H1 WAT 947 111.573 85.916 155.416 1.00 0.00 H ATOM 93467 H2 WAT 947 113.036 85.542 155.516 1.00 0.00 H TER 93469 WAT 947 ATOM 93469 O WAT 948 96.373 131.272 80.500 1.00 0.00 O ATOM 93470 H1 WAT 948 96.770 131.781 79.793 1.00 0.00 H ATOM 93471 H2 WAT 948 95.449 131.521 80.485 1.00 0.00 H TER 93473 WAT 948 ATOM 93473 O WAT 949 48.578 41.856 111.629 1.00 0.00 O ATOM 93474 H1 WAT 949 49.461 41.662 111.315 1.00 0.00 H ATOM 93475 H2 WAT 949 48.233 41.009 111.912 1.00 0.00 H TER 93477 WAT 949 ATOM 93477 O WAT 950 116.843 131.744 27.165 1.00 0.00 O ATOM 93478 H1 WAT 950 117.617 131.944 27.692 1.00 0.00 H ATOM 93479 H2 WAT 950 116.168 132.336 27.497 1.00 0.00 H TER 93481 WAT 950 ATOM 93481 O WAT 951 143.123 78.282 3.002 1.00 0.00 O ATOM 93482 H1 WAT 951 143.086 78.893 2.266 1.00 0.00 H ATOM 93483 H2 WAT 951 143.790 77.643 2.750 1.00 0.00 H TER 93485 WAT 951 ATOM 93485 O WAT 952 65.459 87.574 133.903 1.00 0.00 O ATOM 93486 H1 WAT 952 66.200 87.647 134.505 1.00 0.00 H ATOM 93487 H2 WAT 952 65.751 86.948 133.240 1.00 0.00 H TER 93489 WAT 952 ATOM 93489 O WAT 953 58.735 104.219 149.724 1.00 0.00 O ATOM 93490 H1 WAT 953 57.858 104.007 150.046 1.00 0.00 H ATOM 93491 H2 WAT 953 59.181 103.373 149.670 1.00 0.00 H TER 93493 WAT 953 ATOM 93493 O WAT 954 79.727 65.477 145.181 1.00 0.00 O ATOM 93494 H1 WAT 954 79.436 64.797 144.573 1.00 0.00 H ATOM 93495 H2 WAT 954 78.955 65.668 145.715 1.00 0.00 H TER 93497 WAT 954 ATOM 93497 O WAT 955 85.163 27.988 14.450 1.00 0.00 O ATOM 93498 H1 WAT 955 84.419 27.862 15.039 1.00 0.00 H ATOM 93499 H2 WAT 955 85.759 27.269 14.661 1.00 0.00 H TER 93501 WAT 955 ATOM 93501 O WAT 956 30.849 56.145 139.756 1.00 0.00 O ATOM 93502 H1 WAT 956 30.035 56.112 139.252 1.00 0.00 H ATOM 93503 H2 WAT 956 31.429 56.703 139.239 1.00 0.00 H TER 93505 WAT 956 ATOM 93505 O WAT 957 91.971 80.564 77.235 1.00 0.00 O ATOM 93506 H1 WAT 957 92.697 80.008 77.517 1.00 0.00 H ATOM 93507 H2 WAT 957 91.650 80.967 78.043 1.00 0.00 H TER 93509 WAT 957 ATOM 93509 O WAT 958 110.093 28.763 128.344 1.00 0.00 O ATOM 93510 H1 WAT 958 109.886 29.653 128.060 1.00 0.00 H ATOM 93511 H2 WAT 958 110.841 28.508 127.805 1.00 0.00 H TER 93513 WAT 958 ATOM 93513 O WAT 959 106.641 107.850 66.913 1.00 0.00 O ATOM 93514 H1 WAT 959 107.007 108.003 66.042 1.00 0.00 H ATOM 93515 H2 WAT 959 106.888 106.948 67.122 1.00 0.00 H TER 93517 WAT 959 ATOM 93517 O WAT 960 119.516 41.706 7.265 1.00 0.00 O ATOM 93518 H1 WAT 960 119.624 40.924 7.805 1.00 0.00 H ATOM 93519 H2 WAT 960 118.907 41.440 6.576 1.00 0.00 H TER 93521 WAT 960 ATOM 93521 O WAT 961 65.661 15.215 90.160 1.00 0.00 O ATOM 93522 H1 WAT 961 65.297 15.739 90.873 1.00 0.00 H ATOM 93523 H2 WAT 961 64.894 14.879 89.695 1.00 0.00 H TER 93525 WAT 961 ATOM 93525 O WAT 962 132.265 57.806 11.940 1.00 0.00 O ATOM 93526 H1 WAT 962 131.818 57.822 11.093 1.00 0.00 H ATOM 93527 H2 WAT 962 131.839 58.496 12.448 1.00 0.00 H TER 93529 WAT 962 ATOM 93529 O WAT 963 86.418 64.813 133.943 1.00 0.00 O ATOM 93530 H1 WAT 963 86.233 64.051 133.394 1.00 0.00 H ATOM 93531 H2 WAT 963 85.709 64.822 134.586 1.00 0.00 H TER 93533 WAT 963 ATOM 93533 O WAT 964 86.688 34.501 110.924 1.00 0.00 O ATOM 93534 H1 WAT 964 86.447 34.921 110.099 1.00 0.00 H ATOM 93535 H2 WAT 964 87.102 33.678 110.662 1.00 0.00 H TER 93537 WAT 964 ATOM 93537 O WAT 965 106.774 73.386 148.693 1.00 0.00 O ATOM 93538 H1 WAT 965 107.718 73.230 148.683 1.00 0.00 H ATOM 93539 H2 WAT 965 106.687 74.336 148.611 1.00 0.00 H TER 93541 WAT 965 ATOM 93541 O WAT 966 33.038 118.092 128.631 1.00 0.00 O ATOM 93542 H1 WAT 966 33.001 118.806 127.995 1.00 0.00 H ATOM 93543 H2 WAT 966 33.820 117.596 128.389 1.00 0.00 H TER 93545 WAT 966 ATOM 93545 O WAT 967 144.522 127.612 5.340 1.00 0.00 O ATOM 93546 H1 WAT 967 144.669 126.956 4.659 1.00 0.00 H ATOM 93547 H2 WAT 967 145.079 128.349 5.087 1.00 0.00 H TER 93549 WAT 967 ATOM 93549 O WAT 968 107.105 142.471 6.018 1.00 0.00 O ATOM 93550 H1 WAT 968 107.743 142.925 6.568 1.00 0.00 H ATOM 93551 H2 WAT 968 107.574 141.705 5.688 1.00 0.00 H TER 93553 WAT 968 ATOM 93553 O WAT 969 111.438 13.918 107.301 1.00 0.00 O ATOM 93554 H1 WAT 969 111.012 14.545 107.886 1.00 0.00 H ATOM 93555 H2 WAT 969 110.762 13.266 107.116 1.00 0.00 H TER 93557 WAT 969 ATOM 93557 O WAT 970 21.311 105.335 21.571 1.00 0.00 O ATOM 93558 H1 WAT 970 21.466 106.103 22.120 1.00 0.00 H ATOM 93559 H2 WAT 970 20.733 104.779 22.095 1.00 0.00 H TER 93561 WAT 970 ATOM 93561 O WAT 971 8.186 20.299 14.459 1.00 0.00 O ATOM 93562 H1 WAT 971 7.516 20.982 14.453 1.00 0.00 H ATOM 93563 H2 WAT 971 8.766 20.539 15.182 1.00 0.00 H TER 93565 WAT 971 ATOM 93565 O WAT 972 137.916 116.749 98.551 1.00 0.00 O ATOM 93566 H1 WAT 972 138.809 116.752 98.896 1.00 0.00 H ATOM 93567 H2 WAT 972 137.882 115.979 97.983 1.00 0.00 H TER 93569 WAT 972 ATOM 93569 O WAT 973 53.885 17.228 135.987 1.00 0.00 O ATOM 93570 H1 WAT 973 53.279 16.703 136.510 1.00 0.00 H ATOM 93571 H2 WAT 973 54.751 16.884 136.206 1.00 0.00 H TER 93573 WAT 973 ATOM 93573 O WAT 974 17.325 111.857 84.797 1.00 0.00 O ATOM 93574 H1 WAT 974 17.648 111.039 85.174 1.00 0.00 H ATOM 93575 H2 WAT 974 17.878 112.002 84.029 1.00 0.00 H TER 93577 WAT 974 ATOM 93577 O WAT 975 143.692 143.348 81.459 1.00 0.00 O ATOM 93578 H1 WAT 975 142.740 143.314 81.552 1.00 0.00 H ATOM 93579 H2 WAT 975 144.006 142.576 81.930 1.00 0.00 H TER 93581 WAT 975 ATOM 93581 O WAT 976 110.634 59.837 85.282 1.00 0.00 O ATOM 93582 H1 WAT 976 110.717 59.040 84.757 1.00 0.00 H ATOM 93583 H2 WAT 976 109.824 60.243 84.973 1.00 0.00 H TER 93585 WAT 976 ATOM 93585 O WAT 977 23.090 13.657 116.612 1.00 0.00 O ATOM 93586 H1 WAT 977 22.233 14.051 116.777 1.00 0.00 H ATOM 93587 H2 WAT 977 23.492 13.587 117.478 1.00 0.00 H TER 93589 WAT 977 ATOM 93589 O WAT 978 145.251 132.743 69.629 1.00 0.00 O ATOM 93590 H1 WAT 978 145.837 132.027 69.385 1.00 0.00 H ATOM 93591 H2 WAT 978 144.716 132.385 70.337 1.00 0.00 H TER 93593 WAT 978 ATOM 93593 O WAT 979 92.747 115.283 114.217 1.00 0.00 O ATOM 93594 H1 WAT 979 93.028 115.524 113.335 1.00 0.00 H ATOM 93595 H2 WAT 979 93.515 114.867 114.608 1.00 0.00 H TER 93597 WAT 979 ATOM 93597 O WAT 980 72.991 27.176 2.382 1.00 0.00 O ATOM 93598 H1 WAT 980 72.460 27.948 2.579 1.00 0.00 H ATOM 93599 H2 WAT 980 72.738 26.536 3.047 1.00 0.00 H TER 93601 WAT 980 ATOM 93601 O WAT 981 136.535 94.521 155.593 1.00 0.00 O ATOM 93602 H1 WAT 981 137.263 94.611 154.979 1.00 0.00 H ATOM 93603 H2 WAT 981 136.659 95.237 156.217 1.00 0.00 H TER 93605 WAT 981 ATOM 93605 O WAT 982 39.466 132.170 56.794 1.00 0.00 O ATOM 93606 H1 WAT 982 38.680 131.881 56.331 1.00 0.00 H ATOM 93607 H2 WAT 982 40.181 131.696 56.370 1.00 0.00 H TER 93609 WAT 982 ATOM 93609 O WAT 983 94.404 80.571 132.814 1.00 0.00 O ATOM 93610 H1 WAT 983 94.150 79.979 132.106 1.00 0.00 H ATOM 93611 H2 WAT 983 94.775 79.998 133.484 1.00 0.00 H TER 93613 WAT 983 ATOM 93613 O WAT 984 110.971 10.194 79.942 1.00 0.00 O ATOM 93614 H1 WAT 984 110.330 10.346 80.636 1.00 0.00 H ATOM 93615 H2 WAT 984 111.771 9.944 80.406 1.00 0.00 H TER 93617 WAT 984 ATOM 93617 O WAT 985 95.713 92.109 99.620 1.00 0.00 O ATOM 93618 H1 WAT 985 96.634 92.267 99.414 1.00 0.00 H ATOM 93619 H2 WAT 985 95.267 92.156 98.775 1.00 0.00 H TER 93621 WAT 985 ATOM 93621 O WAT 986 66.591 62.008 146.582 1.00 0.00 O ATOM 93622 H1 WAT 986 66.323 62.866 146.911 1.00 0.00 H ATOM 93623 H2 WAT 986 67.289 62.198 145.956 1.00 0.00 H TER 93625 WAT 986 ATOM 93625 O WAT 987 77.882 56.793 89.435 1.00 0.00 O ATOM 93626 H1 WAT 987 77.173 56.305 89.853 1.00 0.00 H ATOM 93627 H2 WAT 987 78.003 56.362 88.589 1.00 0.00 H TER 93629 WAT 987 ATOM 93629 O WAT 988 77.865 69.380 124.586 1.00 0.00 O ATOM 93630 H1 WAT 988 78.150 68.867 125.342 1.00 0.00 H ATOM 93631 H2 WAT 988 77.134 68.883 124.220 1.00 0.00 H TER 93633 WAT 988 ATOM 93633 O WAT 989 51.995 106.691 152.072 1.00 0.00 O ATOM 93634 H1 WAT 989 51.602 106.975 152.897 1.00 0.00 H ATOM 93635 H2 WAT 989 51.368 106.963 151.402 1.00 0.00 H TER 93637 WAT 989 ATOM 93637 O WAT 990 97.896 17.734 104.162 1.00 0.00 O ATOM 93638 H1 WAT 990 98.502 17.199 103.650 1.00 0.00 H ATOM 93639 H2 WAT 990 97.028 17.482 103.846 1.00 0.00 H TER 93641 WAT 990 ATOM 93641 O WAT 991 69.433 33.113 97.867 1.00 0.00 O ATOM 93642 H1 WAT 991 69.608 32.268 97.451 1.00 0.00 H ATOM 93643 H2 WAT 991 68.521 33.304 97.646 1.00 0.00 H TER 93645 WAT 991 ATOM 93645 O WAT 992 131.905 102.260 136.655 1.00 0.00 O ATOM 93646 H1 WAT 992 130.957 102.351 136.561 1.00 0.00 H ATOM 93647 H2 WAT 992 132.115 101.449 136.192 1.00 0.00 H TER 93649 WAT 992 ATOM 93649 O WAT 993 99.001 49.602 75.396 1.00 0.00 O ATOM 93650 H1 WAT 993 99.310 49.050 74.677 1.00 0.00 H ATOM 93651 H2 WAT 993 98.650 50.382 74.965 1.00 0.00 H TER 93653 WAT 993 ATOM 93653 O WAT 994 55.104 74.988 9.430 1.00 0.00 O ATOM 93654 H1 WAT 994 55.265 74.207 8.901 1.00 0.00 H ATOM 93655 H2 WAT 994 55.496 75.702 8.927 1.00 0.00 H TER 93657 WAT 994 ATOM 93657 O WAT 995 140.690 63.270 99.293 1.00 0.00 O ATOM 93658 H1 WAT 995 139.963 62.732 99.609 1.00 0.00 H ATOM 93659 H2 WAT 995 140.790 63.952 99.957 1.00 0.00 H TER 93661 WAT 995 ATOM 93661 O WAT 996 2.966 32.205 155.221 1.00 0.00 O ATOM 93662 H1 WAT 996 2.881 32.949 154.624 1.00 0.00 H ATOM 93663 H2 WAT 996 3.652 31.663 154.832 1.00 0.00 H TER 93665 WAT 996 ATOM 93665 O WAT 997 103.383 40.911 146.572 1.00 0.00 O ATOM 93666 H1 WAT 997 103.851 41.733 146.715 1.00 0.00 H ATOM 93667 H2 WAT 997 104.020 40.345 146.137 1.00 0.00 H TER 93669 WAT 997 ATOM 93669 O WAT 998 114.661 116.135 90.910 1.00 0.00 O ATOM 93670 H1 WAT 998 115.330 116.770 90.654 1.00 0.00 H ATOM 93671 H2 WAT 998 114.088 116.618 91.506 1.00 0.00 H TER 93673 WAT 998 ATOM 93673 O WAT 999 81.662 105.181 131.277 1.00 0.00 O ATOM 93674 H1 WAT 999 81.122 105.662 130.649 1.00 0.00 H ATOM 93675 H2 WAT 999 82.446 105.720 131.380 1.00 0.00 H TER 93677 WAT 999 ATOM 93677 O WAT 1000 139.829 32.033 80.779 1.00 0.00 O ATOM 93678 H1 WAT 1000 140.191 32.198 81.650 1.00 0.00 H ATOM 93679 H2 WAT 1000 139.567 31.113 80.799 1.00 0.00 H TER 93681 WAT 1000 ATOM 93681 O WAT 1001 143.496 109.778 153.862 1.00 0.00 O ATOM 93682 H1 WAT 1001 143.278 110.694 154.038 1.00 0.00 H ATOM 93683 H2 WAT 1001 144.446 109.776 153.744 1.00 0.00 H TER 93685 WAT 1001 ATOM 93685 O WAT 1002 127.456 118.401 88.890 1.00 0.00 O ATOM 93686 H1 WAT 1002 127.068 117.569 89.161 1.00 0.00 H ATOM 93687 H2 WAT 1002 127.219 118.486 87.966 1.00 0.00 H TER 93689 WAT 1002 ATOM 93689 O WAT 1003 29.272 99.697 87.909 1.00 0.00 O ATOM 93690 H1 WAT 1003 29.796 99.265 88.583 1.00 0.00 H ATOM 93691 H2 WAT 1003 29.760 99.553 87.098 1.00 0.00 H TER 93693 WAT 1003 ATOM 93693 O WAT 1004 110.937 52.751 18.218 1.00 0.00 O ATOM 93694 H1 WAT 1004 110.211 53.298 18.519 1.00 0.00 H ATOM 93695 H2 WAT 1004 111.456 53.328 17.657 1.00 0.00 H TER 93697 WAT 1004 ATOM 93697 O WAT 1005 83.689 6.331 10.252 1.00 0.00 O ATOM 93698 H1 WAT 1005 84.616 6.475 10.445 1.00 0.00 H ATOM 93699 H2 WAT 1005 83.272 6.271 11.111 1.00 0.00 H TER 93701 WAT 1005 ATOM 93701 O WAT 1006 6.974 11.378 111.268 1.00 0.00 O ATOM 93702 H1 WAT 1006 7.922 11.463 111.170 1.00 0.00 H ATOM 93703 H2 WAT 1006 6.704 10.839 110.524 1.00 0.00 H TER 93705 WAT 1006 ATOM 93705 O WAT 1007 53.205 134.451 79.569 1.00 0.00 O ATOM 93706 H1 WAT 1007 53.713 135.088 79.067 1.00 0.00 H ATOM 93707 H2 WAT 1007 53.534 133.600 79.280 1.00 0.00 H TER 93709 WAT 1007 ATOM 93709 O WAT 1008 134.424 81.259 66.405 1.00 0.00 O ATOM 93710 H1 WAT 1008 133.584 80.978 66.768 1.00 0.00 H ATOM 93711 H2 WAT 1008 134.572 80.672 65.663 1.00 0.00 H TER 93713 WAT 1008 ATOM 93713 O WAT 1009 132.017 8.323 137.700 1.00 0.00 O ATOM 93714 H1 WAT 1009 132.459 7.638 137.198 1.00 0.00 H ATOM 93715 H2 WAT 1009 132.532 9.112 137.534 1.00 0.00 H TER 93717 WAT 1009 ATOM 93717 O WAT 1010 26.160 68.471 92.443 1.00 0.00 O ATOM 93718 H1 WAT 1010 26.653 69.287 92.361 1.00 0.00 H ATOM 93719 H2 WAT 1010 25.489 68.527 91.763 1.00 0.00 H TER 93721 WAT 1010 ATOM 93721 O WAT 1011 39.771 97.726 77.611 1.00 0.00 O ATOM 93722 H1 WAT 1011 38.979 97.506 77.121 1.00 0.00 H ATOM 93723 H2 WAT 1011 39.450 98.157 78.403 1.00 0.00 H TER 93725 WAT 1011 ATOM 93725 O WAT 1012 99.233 142.427 131.951 1.00 0.00 O ATOM 93726 H1 WAT 1012 99.727 143.178 132.282 1.00 0.00 H ATOM 93727 H2 WAT 1012 99.649 142.216 131.116 1.00 0.00 H TER 93729 WAT 1012 ATOM 93729 O WAT 1013 136.236 81.971 10.111 1.00 0.00 O ATOM 93730 H1 WAT 1013 136.073 82.912 10.181 1.00 0.00 H ATOM 93731 H2 WAT 1013 136.588 81.724 10.966 1.00 0.00 H TER 93733 WAT 1013 ATOM 93733 O WAT 1014 102.813 88.741 156.091 1.00 0.00 O ATOM 93734 H1 WAT 1014 102.649 89.543 156.587 1.00 0.00 H ATOM 93735 H2 WAT 1014 103.763 88.722 155.974 1.00 0.00 H TER 93737 WAT 1014 ATOM 93737 O WAT 1015 95.413 133.126 12.282 1.00 0.00 O ATOM 93738 H1 WAT 1015 96.288 133.014 12.654 1.00 0.00 H ATOM 93739 H2 WAT 1015 95.022 132.254 12.322 1.00 0.00 H TER 93741 WAT 1015 ATOM 93741 O WAT 1016 93.412 105.460 97.044 1.00 0.00 O ATOM 93742 H1 WAT 1016 93.207 104.716 96.478 1.00 0.00 H ATOM 93743 H2 WAT 1016 93.988 106.012 96.515 1.00 0.00 H TER 93745 WAT 1016 ATOM 93745 O WAT 1017 17.489 88.623 91.650 1.00 0.00 O ATOM 93746 H1 WAT 1017 17.542 89.029 90.785 1.00 0.00 H ATOM 93747 H2 WAT 1017 17.810 89.295 92.251 1.00 0.00 H TER 93749 WAT 1017 ATOM 93749 O WAT 1018 84.783 89.898 18.228 1.00 0.00 O ATOM 93750 H1 WAT 1018 84.539 90.303 19.060 1.00 0.00 H ATOM 93751 H2 WAT 1018 85.367 90.534 17.814 1.00 0.00 H TER 93753 WAT 1018 ATOM 93753 O WAT 1019 57.635 37.413 127.580 1.00 0.00 O ATOM 93754 H1 WAT 1019 57.906 38.277 127.272 1.00 0.00 H ATOM 93755 H2 WAT 1019 57.714 37.463 128.533 1.00 0.00 H TER 93757 WAT 1019 ATOM 93757 O WAT 1020 82.798 89.687 123.325 1.00 0.00 O ATOM 93758 H1 WAT 1020 81.925 89.816 122.955 1.00 0.00 H ATOM 93759 H2 WAT 1020 82.785 90.176 124.147 1.00 0.00 H TER 93761 WAT 1020 ATOM 93761 O WAT 1021 51.485 50.284 120.071 1.00 0.00 O ATOM 93762 H1 WAT 1021 51.879 51.002 120.567 1.00 0.00 H ATOM 93763 H2 WAT 1021 50.838 50.708 119.507 1.00 0.00 H TER 93765 WAT 1021 ATOM 93765 O WAT 1022 32.928 140.418 52.464 1.00 0.00 O ATOM 93766 H1 WAT 1022 33.432 140.280 51.662 1.00 0.00 H ATOM 93767 H2 WAT 1022 32.191 140.965 52.192 1.00 0.00 H TER 93769 WAT 1022 ATOM 93769 O WAT 1023 48.825 114.865 103.384 1.00 0.00 O ATOM 93770 H1 WAT 1023 49.154 114.117 102.884 1.00 0.00 H ATOM 93771 H2 WAT 1023 48.186 114.486 103.988 1.00 0.00 H TER 93773 WAT 1023 ATOM 93773 O WAT 1024 31.384 110.871 118.733 1.00 0.00 O ATOM 93774 H1 WAT 1024 30.523 110.969 118.326 1.00 0.00 H ATOM 93775 H2 WAT 1024 31.952 110.568 118.025 1.00 0.00 H TER 93777 WAT 1024 ATOM 93777 O WAT 1025 135.991 117.145 123.443 1.00 0.00 O ATOM 93778 H1 WAT 1025 136.333 117.975 123.109 1.00 0.00 H ATOM 93779 H2 WAT 1025 136.762 116.583 123.522 1.00 0.00 H TER 93781 WAT 1025 ATOM 93781 O WAT 1026 47.586 54.156 143.696 1.00 0.00 O ATOM 93782 H1 WAT 1026 48.421 54.325 144.134 1.00 0.00 H ATOM 93783 H2 WAT 1026 47.831 53.804 142.841 1.00 0.00 H TER 93785 WAT 1026 ATOM 93785 O WAT 1027 64.704 63.804 86.756 1.00 0.00 O ATOM 93786 H1 WAT 1027 63.747 63.779 86.766 1.00 0.00 H ATOM 93787 H2 WAT 1027 64.933 64.452 87.422 1.00 0.00 H TER 93789 WAT 1027 ATOM 93789 O WAT 1028 34.659 20.018 131.683 1.00 0.00 O ATOM 93790 H1 WAT 1028 35.302 20.722 131.595 1.00 0.00 H ATOM 93791 H2 WAT 1028 34.777 19.487 130.895 1.00 0.00 H TER 93793 WAT 1028 ATOM 93793 O WAT 1029 8.883 113.225 126.827 1.00 0.00 O ATOM 93794 H1 WAT 1029 9.415 112.536 127.225 1.00 0.00 H ATOM 93795 H2 WAT 1029 9.480 113.968 126.738 1.00 0.00 H TER 93797 WAT 1029 ATOM 93797 O WAT 1030 87.846 24.997 0.745 1.00 0.00 O ATOM 93798 H1 WAT 1030 88.748 25.294 0.630 1.00 0.00 H ATOM 93799 H2 WAT 1030 87.558 25.412 1.558 1.00 0.00 H TER 93801 WAT 1030 ATOM 93801 O WAT 1031 48.806 5.610 19.749 1.00 0.00 O ATOM 93802 H1 WAT 1031 49.404 6.324 19.967 1.00 0.00 H ATOM 93803 H2 WAT 1031 49.349 4.822 19.788 1.00 0.00 H TER 93805 WAT 1031 ATOM 93805 O WAT 1032 22.427 78.186 126.797 1.00 0.00 O ATOM 93806 H1 WAT 1032 22.488 77.501 126.131 1.00 0.00 H ATOM 93807 H2 WAT 1032 21.617 78.652 126.587 1.00 0.00 H TER 93809 WAT 1032 ATOM 93809 O WAT 1033 104.448 104.614 91.048 1.00 0.00 O ATOM 93810 H1 WAT 1033 104.944 105.090 90.383 1.00 0.00 H ATOM 93811 H2 WAT 1033 104.665 105.054 91.870 1.00 0.00 H TER 93813 WAT 1033 ATOM 93813 O WAT 1034 43.018 80.593 96.408 1.00 0.00 O ATOM 93814 H1 WAT 1034 42.130 80.274 96.574 1.00 0.00 H ATOM 93815 H2 WAT 1034 42.958 81.036 95.562 1.00 0.00 H TER 93817 WAT 1034 ATOM 93817 O WAT 1035 29.558 82.513 126.540 1.00 0.00 O ATOM 93818 H1 WAT 1035 29.401 83.437 126.344 1.00 0.00 H ATOM 93819 H2 WAT 1035 28.981 82.039 125.942 1.00 0.00 H TER 93821 WAT 1035 ATOM 93821 O WAT 1036 23.194 93.903 128.904 1.00 0.00 O ATOM 93822 H1 WAT 1036 23.044 93.000 128.624 1.00 0.00 H ATOM 93823 H2 WAT 1036 24.108 94.076 128.676 1.00 0.00 H TER 93825 WAT 1036 ATOM 93825 O WAT 1037 77.614 122.784 24.015 1.00 0.00 O ATOM 93826 H1 WAT 1037 77.458 122.310 24.832 1.00 0.00 H ATOM 93827 H2 WAT 1037 77.233 122.225 23.338 1.00 0.00 H TER 93829 WAT 1037 ATOM 93829 O WAT 1038 122.179 16.989 62.981 1.00 0.00 O ATOM 93830 H1 WAT 1038 122.807 17.682 63.186 1.00 0.00 H ATOM 93831 H2 WAT 1038 122.272 16.854 62.038 1.00 0.00 H TER 93833 WAT 1038 ATOM 93833 O WAT 1039 142.124 87.647 118.824 1.00 0.00 O ATOM 93834 H1 WAT 1039 142.794 86.979 118.968 1.00 0.00 H ATOM 93835 H2 WAT 1039 142.617 88.458 118.698 1.00 0.00 H TER 93837 WAT 1039 ATOM 93837 O WAT 1040 128.608 128.966 67.792 1.00 0.00 O ATOM 93838 H1 WAT 1040 127.661 128.828 67.777 1.00 0.00 H ATOM 93839 H2 WAT 1040 128.715 129.850 68.144 1.00 0.00 H TER 93841 WAT 1040 ATOM 93841 O WAT 1041 88.694 16.313 3.505 1.00 0.00 O ATOM 93842 H1 WAT 1041 88.466 16.695 2.657 1.00 0.00 H ATOM 93843 H2 WAT 1041 87.888 16.369 4.017 1.00 0.00 H TER 93845 WAT 1041 ATOM 93845 O WAT 1042 119.294 33.056 22.505 1.00 0.00 O ATOM 93846 H1 WAT 1042 120.103 33.560 22.597 1.00 0.00 H ATOM 93847 H2 WAT 1042 118.737 33.364 23.220 1.00 0.00 H TER 93849 WAT 1042 ATOM 93849 O WAT 1043 32.854 53.530 132.662 1.00 0.00 O ATOM 93850 H1 WAT 1043 33.367 54.245 132.284 1.00 0.00 H ATOM 93851 H2 WAT 1043 33.444 52.777 132.645 1.00 0.00 H TER 93853 WAT 1043 ATOM 93853 O WAT 1044 111.346 33.021 15.483 1.00 0.00 O ATOM 93854 H1 WAT 1044 111.775 32.646 14.714 1.00 0.00 H ATOM 93855 H2 WAT 1044 111.837 33.823 15.663 1.00 0.00 H TER 93857 WAT 1044 ATOM 93857 O WAT 1045 118.039 67.872 89.704 1.00 0.00 O ATOM 93858 H1 WAT 1045 118.030 68.763 90.054 1.00 0.00 H ATOM 93859 H2 WAT 1045 118.676 67.408 90.246 1.00 0.00 H TER 93861 WAT 1045 ATOM 93861 O WAT 1046 113.744 56.522 12.364 1.00 0.00 O ATOM 93862 H1 WAT 1046 113.398 57.378 12.618 1.00 0.00 H ATOM 93863 H2 WAT 1046 113.684 55.994 13.159 1.00 0.00 H TER 93865 WAT 1046 ATOM 93865 O WAT 1047 59.211 127.674 141.293 1.00 0.00 O ATOM 93866 H1 WAT 1047 59.796 127.795 140.545 1.00 0.00 H ATOM 93867 H2 WAT 1047 59.072 126.728 141.338 1.00 0.00 H TER 93869 WAT 1047 ATOM 93869 O WAT 1048 142.590 111.731 8.404 1.00 0.00 O ATOM 93870 H1 WAT 1048 143.250 111.048 8.289 1.00 0.00 H ATOM 93871 H2 WAT 1048 142.904 112.246 9.147 1.00 0.00 H TER 93873 WAT 1048 ATOM 93873 O WAT 1049 51.339 45.821 77.904 1.00 0.00 O ATOM 93874 H1 WAT 1049 51.192 46.202 77.038 1.00 0.00 H ATOM 93875 H2 WAT 1049 51.182 44.885 77.785 1.00 0.00 H TER 93877 WAT 1049 ATOM 93877 O WAT 1050 30.831 0.803 116.377 1.00 0.00 O ATOM 93878 H1 WAT 1050 31.326 0.339 117.052 1.00 0.00 H ATOM 93879 H2 WAT 1050 31.033 0.335 115.567 1.00 0.00 H TER 93881 WAT 1050 ATOM 93881 O WAT 1051 22.802 141.426 49.810 1.00 0.00 O ATOM 93882 H1 WAT 1051 23.253 141.563 50.644 1.00 0.00 H ATOM 93883 H2 WAT 1051 23.503 141.237 49.187 1.00 0.00 H TER 93885 WAT 1051 ATOM 93885 O WAT 1052 69.351 20.016 11.439 1.00 0.00 O ATOM 93886 H1 WAT 1052 69.887 19.646 12.140 1.00 0.00 H ATOM 93887 H2 WAT 1052 69.831 19.810 10.637 1.00 0.00 H TER 93889 WAT 1052 ATOM 93889 O WAT 1053 49.852 60.576 139.586 1.00 0.00 O ATOM 93890 H1 WAT 1053 49.394 60.599 138.746 1.00 0.00 H ATOM 93891 H2 WAT 1053 50.778 60.511 139.352 1.00 0.00 H TER 93893 WAT 1053 ATOM 93893 O WAT 1054 120.224 28.405 66.467 1.00 0.00 O ATOM 93894 H1 WAT 1054 119.765 28.707 67.251 1.00 0.00 H ATOM 93895 H2 WAT 1054 121.145 28.603 66.637 1.00 0.00 H TER 93897 WAT 1054 ATOM 93897 O WAT 1055 22.067 98.657 97.713 1.00 0.00 O ATOM 93898 H1 WAT 1055 22.308 98.222 98.531 1.00 0.00 H ATOM 93899 H2 WAT 1055 22.739 98.382 97.089 1.00 0.00 H TER 93901 WAT 1055 ATOM 93901 O WAT 1056 22.631 63.780 129.316 1.00 0.00 O ATOM 93902 H1 WAT 1056 22.614 63.143 130.031 1.00 0.00 H ATOM 93903 H2 WAT 1056 22.568 63.250 128.522 1.00 0.00 H TER 93905 WAT 1056 ATOM 93905 O WAT 1057 122.001 46.564 128.015 1.00 0.00 O ATOM 93906 H1 WAT 1057 121.696 47.084 128.759 1.00 0.00 H ATOM 93907 H2 WAT 1057 122.159 45.694 128.381 1.00 0.00 H TER 93909 WAT 1057 ATOM 93909 O WAT 1058 125.165 65.070 145.994 1.00 0.00 O ATOM 93910 H1 WAT 1058 125.429 65.695 145.319 1.00 0.00 H ATOM 93911 H2 WAT 1058 125.945 64.536 146.144 1.00 0.00 H TER 93913 WAT 1058 ATOM 93913 O WAT 1059 17.082 122.552 140.461 1.00 0.00 O ATOM 93914 H1 WAT 1059 17.991 122.339 140.251 1.00 0.00 H ATOM 93915 H2 WAT 1059 16.654 122.643 139.610 1.00 0.00 H TER 93917 WAT 1059 ATOM 93917 O WAT 1060 145.820 130.469 84.692 1.00 0.00 O ATOM 93918 H1 WAT 1060 146.124 129.618 85.007 1.00 0.00 H ATOM 93919 H2 WAT 1060 144.886 130.481 84.899 1.00 0.00 H TER 93921 WAT 1060 ATOM 93921 O WAT 1061 13.454 80.395 146.042 1.00 0.00 O ATOM 93922 H1 WAT 1061 13.416 79.671 146.667 1.00 0.00 H ATOM 93923 H2 WAT 1061 12.538 80.589 145.844 1.00 0.00 H TER 93925 WAT 1061 ATOM 93925 O WAT 1062 5.993 143.673 151.859 1.00 0.00 O ATOM 93926 H1 WAT 1062 5.409 143.677 151.100 1.00 0.00 H ATOM 93927 H2 WAT 1062 5.567 144.252 152.491 1.00 0.00 H TER 93929 WAT 1062 ATOM 93929 O WAT 1063 137.165 64.384 22.639 1.00 0.00 O ATOM 93930 H1 WAT 1063 137.731 63.955 23.281 1.00 0.00 H ATOM 93931 H2 WAT 1063 137.589 65.225 22.470 1.00 0.00 H TER 93933 WAT 1063 ATOM 93933 O WAT 1064 63.376 19.875 62.761 1.00 0.00 O ATOM 93934 H1 WAT 1064 63.576 20.355 61.957 1.00 0.00 H ATOM 93935 H2 WAT 1064 62.621 19.332 62.533 1.00 0.00 H TER 93937 WAT 1064 ATOM 93937 O WAT 1065 104.336 56.482 81.161 1.00 0.00 O ATOM 93938 H1 WAT 1065 105.172 56.146 81.483 1.00 0.00 H ATOM 93939 H2 WAT 1065 103.777 55.707 81.094 1.00 0.00 H TER 93941 WAT 1065 ATOM 93941 O WAT 1066 110.680 74.321 128.952 1.00 0.00 O ATOM 93942 H1 WAT 1066 110.206 74.834 129.607 1.00 0.00 H ATOM 93943 H2 WAT 1066 111.260 73.757 129.463 1.00 0.00 H TER 93945 WAT 1066 ATOM 93945 O WAT 1067 104.193 79.026 140.522 1.00 0.00 O ATOM 93946 H1 WAT 1067 103.743 78.536 141.210 1.00 0.00 H ATOM 93947 H2 WAT 1067 104.346 78.382 139.831 1.00 0.00 H TER 93949 WAT 1067 ATOM 93949 O WAT 1068 39.652 80.833 98.726 1.00 0.00 O ATOM 93950 H1 WAT 1068 38.921 80.390 99.158 1.00 0.00 H ATOM 93951 H2 WAT 1068 39.742 81.661 99.196 1.00 0.00 H TER 93953 WAT 1068 ATOM 93953 O WAT 1069 33.666 58.105 111.747 1.00 0.00 O ATOM 93954 H1 WAT 1069 34.066 58.623 111.048 1.00 0.00 H ATOM 93955 H2 WAT 1069 32.743 58.044 111.502 1.00 0.00 H TER 93957 WAT 1069 ATOM 93957 O WAT 1070 51.540 58.344 66.632 1.00 0.00 O ATOM 93958 H1 WAT 1070 51.547 58.615 67.550 1.00 0.00 H ATOM 93959 H2 WAT 1070 51.179 59.097 66.163 1.00 0.00 H TER 93961 WAT 1070 ATOM 93961 O WAT 1071 122.207 105.214 141.143 1.00 0.00 O ATOM 93962 H1 WAT 1071 122.173 104.327 141.501 1.00 0.00 H ATOM 93963 H2 WAT 1071 122.234 105.089 140.195 1.00 0.00 H TER 93965 WAT 1071 ATOM 93965 O WAT 1072 38.253 47.338 17.406 1.00 0.00 O ATOM 93966 H1 WAT 1072 38.165 46.456 17.046 1.00 0.00 H ATOM 93967 H2 WAT 1072 38.429 47.200 18.337 1.00 0.00 H TER 93969 WAT 1072 ATOM 93969 O WAT 1073 71.184 24.214 19.609 1.00 0.00 O ATOM 93970 H1 WAT 1073 71.776 24.157 20.359 1.00 0.00 H ATOM 93971 H2 WAT 1073 70.824 23.332 19.520 1.00 0.00 H TER 93973 WAT 1073 ATOM 93973 O WAT 1074 93.092 95.215 64.204 1.00 0.00 O ATOM 93974 H1 WAT 1074 93.627 95.056 63.426 1.00 0.00 H ATOM 93975 H2 WAT 1074 92.584 94.411 64.313 1.00 0.00 H TER 93977 WAT 1074 ATOM 93977 O WAT 1075 85.781 44.075 122.547 1.00 0.00 O ATOM 93978 H1 WAT 1075 86.255 44.352 123.331 1.00 0.00 H ATOM 93979 H2 WAT 1075 86.360 43.439 122.128 1.00 0.00 H TER 93981 WAT 1075 ATOM 93981 O WAT 1076 31.062 47.650 92.221 1.00 0.00 O ATOM 93982 H1 WAT 1076 31.432 47.319 91.403 1.00 0.00 H ATOM 93983 H2 WAT 1076 30.891 48.576 92.050 1.00 0.00 H TER 93985 WAT 1076 ATOM 93985 O WAT 1077 54.244 108.777 89.937 1.00 0.00 O ATOM 93986 H1 WAT 1077 53.637 109.511 90.034 1.00 0.00 H ATOM 93987 H2 WAT 1077 54.975 108.993 90.516 1.00 0.00 H TER 93989 WAT 1077 ATOM 93989 O WAT 1078 106.845 22.241 78.341 1.00 0.00 O ATOM 93990 H1 WAT 1078 107.030 21.306 78.253 1.00 0.00 H ATOM 93991 H2 WAT 1078 106.595 22.519 77.461 1.00 0.00 H TER 93993 WAT 1078 ATOM 93993 O WAT 1079 116.604 28.913 82.003 1.00 0.00 O ATOM 93994 H1 WAT 1079 115.813 28.712 81.504 1.00 0.00 H ATOM 93995 H2 WAT 1079 116.481 29.817 82.294 1.00 0.00 H TER 93997 WAT 1079 ATOM 93997 O WAT 1080 37.903 11.871 90.740 1.00 0.00 O ATOM 93998 H1 WAT 1080 38.030 10.940 90.558 1.00 0.00 H ATOM 93999 H2 WAT 1080 38.749 12.167 91.077 1.00 0.00 H TER 94001 WAT 1080 ATOM 94001 O WAT 1081 97.364 106.813 12.419 1.00 0.00 O ATOM 94002 H1 WAT 1081 98.136 106.260 12.299 1.00 0.00 H ATOM 94003 H2 WAT 1081 97.193 106.784 13.360 1.00 0.00 H TER 94005 WAT 1081 ATOM 94005 O WAT 1082 92.674 122.006 124.628 1.00 0.00 O ATOM 94006 H1 WAT 1082 93.194 122.787 124.815 1.00 0.00 H ATOM 94007 H2 WAT 1082 91.766 122.292 124.731 1.00 0.00 H TER 94009 WAT 1082 ATOM 94009 O WAT 1083 46.364 120.914 148.784 1.00 0.00 O ATOM 94010 H1 WAT 1083 46.660 120.003 148.775 1.00 0.00 H ATOM 94011 H2 WAT 1083 47.131 121.417 148.511 1.00 0.00 H TER 94013 WAT 1083 ATOM 94013 O WAT 1084 112.203 11.349 22.861 1.00 0.00 O ATOM 94014 H1 WAT 1084 111.592 12.058 23.058 1.00 0.00 H ATOM 94015 H2 WAT 1084 111.676 10.553 22.929 1.00 0.00 H TER 94017 WAT 1084 ATOM 94017 O WAT 1085 78.648 12.800 70.828 1.00 0.00 O ATOM 94018 H1 WAT 1085 78.542 12.185 70.103 1.00 0.00 H ATOM 94019 H2 WAT 1085 79.342 13.393 70.540 1.00 0.00 H TER 94021 WAT 1085 ATOM 94021 O WAT 1086 42.410 102.852 120.839 1.00 0.00 O ATOM 94022 H1 WAT 1086 42.978 103.105 121.566 1.00 0.00 H ATOM 94023 H2 WAT 1086 42.969 102.920 120.064 1.00 0.00 H TER 94025 WAT 1086 ATOM 94025 O WAT 1087 113.344 81.901 123.872 1.00 0.00 O ATOM 94026 H1 WAT 1087 113.442 82.483 124.626 1.00 0.00 H ATOM 94027 H2 WAT 1087 112.746 82.365 123.286 1.00 0.00 H TER 94029 WAT 1087 ATOM 94029 O WAT 1088 104.395 69.430 7.645 1.00 0.00 O ATOM 94030 H1 WAT 1088 104.309 70.381 7.714 1.00 0.00 H ATOM 94031 H2 WAT 1088 103.881 69.090 8.377 1.00 0.00 H TER 94033 WAT 1088 ATOM 94033 O WAT 1089 86.559 35.157 79.483 1.00 0.00 O ATOM 94034 H1 WAT 1089 85.919 34.516 79.791 1.00 0.00 H ATOM 94035 H2 WAT 1089 87.408 34.765 79.688 1.00 0.00 H TER 94037 WAT 1089 ATOM 94037 O WAT 1090 17.310 18.357 138.540 1.00 0.00 O ATOM 94038 H1 WAT 1090 17.104 19.094 139.116 1.00 0.00 H ATOM 94039 H2 WAT 1090 18.219 18.505 138.279 1.00 0.00 H TER 94041 WAT 1090 ATOM 94041 O WAT 1091 108.758 86.001 25.980 1.00 0.00 O ATOM 94042 H1 WAT 1091 109.681 86.179 25.802 1.00 0.00 H ATOM 94043 H2 WAT 1091 108.760 85.532 26.815 1.00 0.00 H TER 94045 WAT 1091 ATOM 94045 O WAT 1092 2.172 40.087 158.013 1.00 0.00 O ATOM 94046 H1 WAT 1092 1.713 40.362 157.219 1.00 0.00 H ATOM 94047 H2 WAT 1092 2.037 40.807 158.629 1.00 0.00 H TER 94049 WAT 1092 ATOM 94049 O WAT 1093 43.186 11.357 14.479 1.00 0.00 O ATOM 94050 H1 WAT 1093 43.226 12.282 14.238 1.00 0.00 H ATOM 94051 H2 WAT 1093 43.888 11.246 15.121 1.00 0.00 H TER 94053 WAT 1093 ATOM 94053 O WAT 1094 45.515 100.398 87.001 1.00 0.00 O ATOM 94054 H1 WAT 1094 44.944 99.749 86.589 1.00 0.00 H ATOM 94055 H2 WAT 1094 45.967 100.817 86.269 1.00 0.00 H TER 94057 WAT 1094 ATOM 94057 O WAT 1095 137.473 95.440 141.905 1.00 0.00 O ATOM 94058 H1 WAT 1095 137.560 94.631 141.401 1.00 0.00 H ATOM 94059 H2 WAT 1095 136.664 95.837 141.584 1.00 0.00 H TER 94061 WAT 1095 ATOM 94061 O WAT 1096 126.910 119.550 59.257 1.00 0.00 O ATOM 94062 H1 WAT 1096 126.972 119.766 58.326 1.00 0.00 H ATOM 94063 H2 WAT 1096 127.793 119.696 59.596 1.00 0.00 H TER 94065 WAT 1096 ATOM 94065 O WAT 1097 122.644 127.988 8.301 1.00 0.00 O ATOM 94066 H1 WAT 1097 122.952 127.789 7.417 1.00 0.00 H ATOM 94067 H2 WAT 1097 121.921 128.602 8.171 1.00 0.00 H TER 94069 WAT 1097 ATOM 94069 O WAT 1098 130.666 26.629 7.492 1.00 0.00 O ATOM 94070 H1 WAT 1098 131.582 26.358 7.545 1.00 0.00 H ATOM 94071 H2 WAT 1098 130.486 27.034 8.341 1.00 0.00 H TER 94073 WAT 1098 ATOM 94073 O WAT 1099 107.043 77.686 89.871 1.00 0.00 O ATOM 94074 H1 WAT 1099 107.555 77.783 90.674 1.00 0.00 H ATOM 94075 H2 WAT 1099 107.697 77.628 89.175 1.00 0.00 H TER 94077 WAT 1099 ATOM 94077 O WAT 1100 107.586 67.525 97.480 1.00 0.00 O ATOM 94078 H1 WAT 1100 108.108 68.257 97.809 1.00 0.00 H ATOM 94079 H2 WAT 1100 107.716 66.829 98.125 1.00 0.00 H TER 94081 WAT 1100 ATOM 94081 O WAT 1101 123.706 38.562 149.496 1.00 0.00 O ATOM 94082 H1 WAT 1101 124.561 38.600 149.925 1.00 0.00 H ATOM 94083 H2 WAT 1101 123.163 38.042 150.088 1.00 0.00 H TER 94085 WAT 1101 ATOM 94085 O WAT 1102 5.582 22.197 102.128 1.00 0.00 O ATOM 94086 H1 WAT 1102 6.238 21.612 102.509 1.00 0.00 H ATOM 94087 H2 WAT 1102 5.671 23.011 102.625 1.00 0.00 H TER 94089 WAT 1102 ATOM 94089 O WAT 1103 112.092 4.317 96.926 1.00 0.00 O ATOM 94090 H1 WAT 1103 111.635 3.685 96.370 1.00 0.00 H ATOM 94091 H2 WAT 1103 111.702 5.161 96.700 1.00 0.00 H TER 94093 WAT 1103 ATOM 94093 O WAT 1104 102.240 93.493 156.221 1.00 0.00 O ATOM 94094 H1 WAT 1104 102.017 94.419 156.322 1.00 0.00 H ATOM 94095 H2 WAT 1104 102.511 93.411 155.307 1.00 0.00 H TER 94097 WAT 1104 ATOM 94097 O WAT 1105 51.040 126.004 135.627 1.00 0.00 O ATOM 94098 H1 WAT 1105 50.832 126.934 135.545 1.00 0.00 H ATOM 94099 H2 WAT 1105 51.094 125.853 136.571 1.00 0.00 H TER 94101 WAT 1105 ATOM 94101 O WAT 1106 56.533 3.780 134.959 1.00 0.00 O ATOM 94102 H1 WAT 1106 56.268 4.680 134.768 1.00 0.00 H ATOM 94103 H2 WAT 1106 57.488 3.815 134.996 1.00 0.00 H TER 94105 WAT 1106 ATOM 94105 O WAT 1107 74.590 103.798 5.496 1.00 0.00 O ATOM 94106 H1 WAT 1107 74.361 104.457 6.152 1.00 0.00 H ATOM 94107 H2 WAT 1107 75.155 104.261 4.878 1.00 0.00 H TER 94109 WAT 1107 ATOM 94109 O WAT 1108 19.361 35.250 128.147 1.00 0.00 O ATOM 94110 H1 WAT 1108 19.563 35.948 127.525 1.00 0.00 H ATOM 94111 H2 WAT 1108 19.426 35.668 129.006 1.00 0.00 H TER 94113 WAT 1108 ATOM 94113 O WAT 1109 85.636 145.114 153.983 1.00 0.00 O ATOM 94114 H1 WAT 1109 85.613 144.855 154.904 1.00 0.00 H ATOM 94115 H2 WAT 1109 86.257 145.841 153.953 1.00 0.00 H TER 94117 WAT 1109 ATOM 94117 O WAT 1110 120.626 49.133 91.227 1.00 0.00 O ATOM 94118 H1 WAT 1110 121.383 48.619 90.946 1.00 0.00 H ATOM 94119 H2 WAT 1110 120.460 49.733 90.501 1.00 0.00 H TER 94121 WAT 1110 ATOM 94121 O WAT 1111 97.824 51.631 113.472 1.00 0.00 O ATOM 94122 H1 WAT 1111 98.777 51.671 113.389 1.00 0.00 H ATOM 94123 H2 WAT 1111 97.557 50.960 112.844 1.00 0.00 H TER 94125 WAT 1111 ATOM 94125 O WAT 1112 58.468 135.262 127.277 1.00 0.00 O ATOM 94126 H1 WAT 1112 59.082 135.295 128.011 1.00 0.00 H ATOM 94127 H2 WAT 1112 58.653 136.055 126.774 1.00 0.00 H TER 94129 WAT 1112 ATOM 94129 O WAT 1113 14.517 99.089 150.078 1.00 0.00 O ATOM 94130 H1 WAT 1113 14.626 98.188 149.775 1.00 0.00 H ATOM 94131 H2 WAT 1113 13.639 99.335 149.786 1.00 0.00 H TER 94133 WAT 1113 ATOM 94133 O WAT 1114 105.384 7.579 6.389 1.00 0.00 O ATOM 94134 H1 WAT 1114 105.163 7.221 7.249 1.00 0.00 H ATOM 94135 H2 WAT 1114 105.164 8.508 6.453 1.00 0.00 H TER 94137 WAT 1114 ATOM 94137 O WAT 1115 4.520 56.318 22.542 1.00 0.00 O ATOM 94138 H1 WAT 1115 5.388 56.723 22.536 1.00 0.00 H ATOM 94139 H2 WAT 1115 3.979 56.919 23.053 1.00 0.00 H TER 94141 WAT 1115 ATOM 94141 O WAT 1116 9.777 37.813 107.297 1.00 0.00 O ATOM 94142 H1 WAT 1116 9.639 37.611 106.371 1.00 0.00 H ATOM 94143 H2 WAT 1116 8.931 38.143 107.599 1.00 0.00 H TER 94145 WAT 1116 ATOM 94145 O WAT 1117 95.706 40.737 140.750 1.00 0.00 O ATOM 94146 H1 WAT 1117 95.022 40.082 140.888 1.00 0.00 H ATOM 94147 H2 WAT 1117 96.271 40.659 141.519 1.00 0.00 H TER 94149 WAT 1117 ATOM 94149 O WAT 1118 92.478 139.669 103.674 1.00 0.00 O ATOM 94150 H1 WAT 1118 92.035 139.472 104.499 1.00 0.00 H ATOM 94151 H2 WAT 1118 92.642 138.812 103.279 1.00 0.00 H TER 94153 WAT 1118 ATOM 94153 O WAT 1119 90.058 58.724 142.438 1.00 0.00 O ATOM 94154 H1 WAT 1119 89.132 58.960 142.493 1.00 0.00 H ATOM 94155 H2 WAT 1119 90.523 59.558 142.514 1.00 0.00 H TER 94157 WAT 1119 ATOM 94157 O WAT 1120 82.443 78.767 158.752 1.00 0.00 O ATOM 94158 H1 WAT 1120 83.163 79.380 158.603 1.00 0.00 H ATOM 94159 H2 WAT 1120 82.617 78.044 158.149 1.00 0.00 H TER 94161 WAT 1120 ATOM 94161 O WAT 1121 134.543 88.206 139.287 1.00 0.00 O ATOM 94162 H1 WAT 1121 134.890 87.419 139.707 1.00 0.00 H ATOM 94163 H2 WAT 1121 135.190 88.885 139.480 1.00 0.00 H TER 94165 WAT 1121 ATOM 94165 O WAT 1122 19.438 46.058 96.574 1.00 0.00 O ATOM 94166 H1 WAT 1122 19.717 45.675 97.405 1.00 0.00 H ATOM 94167 H2 WAT 1122 18.539 45.748 96.458 1.00 0.00 H TER 94169 WAT 1122 ATOM 94169 O WAT 1123 106.860 91.824 67.873 1.00 0.00 O ATOM 94170 H1 WAT 1123 107.220 90.945 67.992 1.00 0.00 H ATOM 94171 H2 WAT 1123 107.021 92.025 66.951 1.00 0.00 H TER 94173 WAT 1123 ATOM 94173 O WAT 1124 134.734 118.723 114.048 1.00 0.00 O ATOM 94174 H1 WAT 1124 133.883 118.290 114.120 1.00 0.00 H ATOM 94175 H2 WAT 1124 135.368 118.046 114.288 1.00 0.00 H TER 94177 WAT 1124 ATOM 94177 O WAT 1125 1.306 75.433 114.271 1.00 0.00 O ATOM 94178 H1 WAT 1125 2.143 75.661 114.676 1.00 0.00 H ATOM 94179 H2 WAT 1125 1.532 74.797 113.593 1.00 0.00 H TER 94181 WAT 1125 ATOM 94181 O WAT 1126 77.752 140.377 73.872 1.00 0.00 O ATOM 94182 H1 WAT 1126 77.495 141.193 74.302 1.00 0.00 H ATOM 94183 H2 WAT 1126 77.586 139.698 74.526 1.00 0.00 H TER 94185 WAT 1126 ATOM 94185 O WAT 1127 97.335 72.743 155.990 1.00 0.00 O ATOM 94186 H1 WAT 1127 96.910 71.939 155.691 1.00 0.00 H ATOM 94187 H2 WAT 1127 97.178 72.759 156.934 1.00 0.00 H TER 94189 WAT 1127 ATOM 94189 O WAT 1128 107.693 58.224 127.681 1.00 0.00 O ATOM 94190 H1 WAT 1128 108.178 58.231 128.506 1.00 0.00 H ATOM 94191 H2 WAT 1128 106.924 57.683 127.860 1.00 0.00 H TER 94193 WAT 1128 ATOM 94193 O WAT 1129 46.581 84.735 86.539 1.00 0.00 O ATOM 94194 H1 WAT 1129 46.630 85.469 85.928 1.00 0.00 H ATOM 94195 H2 WAT 1129 46.859 83.977 86.026 1.00 0.00 H TER 94197 WAT 1129 ATOM 94197 O WAT 1130 56.548 43.859 134.589 1.00 0.00 O ATOM 94198 H1 WAT 1130 55.963 44.493 134.172 1.00 0.00 H ATOM 94199 H2 WAT 1130 56.902 43.346 133.863 1.00 0.00 H TER 94201 WAT 1130 ATOM 94201 O WAT 1131 96.039 117.251 1.371 1.00 0.00 O ATOM 94202 H1 WAT 1131 96.728 117.899 1.518 1.00 0.00 H ATOM 94203 H2 WAT 1131 96.466 116.408 1.528 1.00 0.00 H TER 94205 WAT 1131 ATOM 94205 O WAT 1132 96.826 58.979 64.050 1.00 0.00 O ATOM 94206 H1 WAT 1132 96.838 58.501 63.221 1.00 0.00 H ATOM 94207 H2 WAT 1132 97.547 59.604 63.977 1.00 0.00 H TER 94209 WAT 1132 ATOM 94209 O WAT 1133 33.917 34.790 86.881 1.00 0.00 O ATOM 94210 H1 WAT 1133 34.222 34.080 86.317 1.00 0.00 H ATOM 94211 H2 WAT 1133 33.039 34.993 86.556 1.00 0.00 H TER 94213 WAT 1133 ATOM 94213 O WAT 1134 49.578 84.548 18.362 1.00 0.00 O ATOM 94214 H1 WAT 1134 49.017 83.899 18.788 1.00 0.00 H ATOM 94215 H2 WAT 1134 49.280 84.562 17.453 1.00 0.00 H TER 94217 WAT 1134 ATOM 94217 O WAT 1135 29.517 20.221 80.570 1.00 0.00 O ATOM 94218 H1 WAT 1135 29.962 20.120 81.412 1.00 0.00 H ATOM 94219 H2 WAT 1135 30.065 19.740 79.950 1.00 0.00 H TER 94221 WAT 1135 ATOM 94221 O WAT 1136 134.748 48.491 92.258 1.00 0.00 O ATOM 94222 H1 WAT 1136 135.451 48.720 92.865 1.00 0.00 H ATOM 94223 H2 WAT 1136 133.968 48.424 92.809 1.00 0.00 H TER 94225 WAT 1136 ATOM 94225 O WAT 1137 111.129 53.061 102.353 1.00 0.00 O ATOM 94226 H1 WAT 1137 111.272 53.623 103.115 1.00 0.00 H ATOM 94227 H2 WAT 1137 110.955 52.195 102.724 1.00 0.00 H TER 94229 WAT 1137 ATOM 94229 O WAT 1138 50.634 6.995 139.426 1.00 0.00 O ATOM 94230 H1 WAT 1138 51.534 7.283 139.270 1.00 0.00 H ATOM 94231 H2 WAT 1138 50.156 7.268 138.644 1.00 0.00 H TER 94233 WAT 1138 ATOM 94233 O WAT 1139 91.615 17.094 57.674 1.00 0.00 O ATOM 94234 H1 WAT 1139 92.348 17.377 57.128 1.00 0.00 H ATOM 94235 H2 WAT 1139 90.975 17.803 57.602 1.00 0.00 H TER 94237 WAT 1139 ATOM 94237 O WAT 1140 125.915 139.664 72.651 1.00 0.00 O ATOM 94238 H1 WAT 1140 126.407 139.111 73.257 1.00 0.00 H ATOM 94239 H2 WAT 1140 125.017 139.336 72.702 1.00 0.00 H TER 94241 WAT 1140 ATOM 94241 O WAT 1141 65.009 110.451 87.642 1.00 0.00 O ATOM 94242 H1 WAT 1141 65.905 110.116 87.606 1.00 0.00 H ATOM 94243 H2 WAT 1141 64.861 110.640 88.568 1.00 0.00 H TER 94245 WAT 1141 ATOM 94245 O WAT 1142 138.481 71.353 66.573 1.00 0.00 O ATOM 94246 H1 WAT 1142 138.279 72.061 67.185 1.00 0.00 H ATOM 94247 H2 WAT 1142 138.546 70.573 67.123 1.00 0.00 H TER 94249 WAT 1142 ATOM 94249 O WAT 1143 52.127 50.772 12.108 1.00 0.00 O ATOM 94250 H1 WAT 1143 52.686 50.540 12.849 1.00 0.00 H ATOM 94251 H2 WAT 1143 52.679 51.324 11.554 1.00 0.00 H TER 94253 WAT 1143 ATOM 94253 O WAT 1144 45.973 77.471 101.210 1.00 0.00 O ATOM 94254 H1 WAT 1144 45.528 77.813 100.435 1.00 0.00 H ATOM 94255 H2 WAT 1144 45.923 76.520 101.116 1.00 0.00 H TER 94257 WAT 1144 ATOM 94257 O WAT 1145 130.382 4.309 11.774 1.00 0.00 O ATOM 94258 H1 WAT 1145 130.227 4.631 12.662 1.00 0.00 H ATOM 94259 H2 WAT 1145 130.321 5.090 11.223 1.00 0.00 H TER 94261 WAT 1145 ATOM 94261 O WAT 1146 87.250 101.482 149.783 1.00 0.00 O ATOM 94262 H1 WAT 1146 87.427 102.055 150.529 1.00 0.00 H ATOM 94263 H2 WAT 1146 86.376 101.131 149.952 1.00 0.00 H TER 94265 WAT 1146 ATOM 94265 O WAT 1147 95.704 122.905 123.647 1.00 0.00 O ATOM 94266 H1 WAT 1147 95.529 122.787 122.713 1.00 0.00 H ATOM 94267 H2 WAT 1147 95.909 122.026 123.965 1.00 0.00 H TER 94269 WAT 1147 ATOM 94269 O WAT 1148 13.535 3.243 123.193 1.00 0.00 O ATOM 94270 H1 WAT 1148 12.922 3.977 123.233 1.00 0.00 H ATOM 94271 H2 WAT 1148 14.380 3.623 123.435 1.00 0.00 H TER 94273 WAT 1148 ATOM 94273 O WAT 1149 107.347 0.764 2.056 1.00 0.00 O ATOM 94274 H1 WAT 1149 107.437 0.251 1.253 1.00 0.00 H ATOM 94275 H2 WAT 1149 107.018 0.140 2.703 1.00 0.00 H TER 94277 WAT 1149 ATOM 94277 O WAT 1150 87.288 21.299 67.727 1.00 0.00 O ATOM 94278 H1 WAT 1150 87.915 21.747 67.159 1.00 0.00 H ATOM 94279 H2 WAT 1150 86.724 21.998 68.059 1.00 0.00 H TER 94281 WAT 1150 ATOM 94281 O WAT 1151 127.675 54.037 15.809 1.00 0.00 O ATOM 94282 H1 WAT 1151 126.811 54.162 16.201 1.00 0.00 H ATOM 94283 H2 WAT 1151 127.496 53.648 14.953 1.00 0.00 H TER 94285 WAT 1151 ATOM 94285 O WAT 1152 33.176 63.955 14.601 1.00 0.00 O ATOM 94286 H1 WAT 1152 33.603 64.793 14.779 1.00 0.00 H ATOM 94287 H2 WAT 1152 33.176 63.502 15.444 1.00 0.00 H TER 94289 WAT 1152 ATOM 94289 O WAT 1153 87.394 15.880 88.494 1.00 0.00 O ATOM 94290 H1 WAT 1153 86.960 15.440 89.225 1.00 0.00 H ATOM 94291 H2 WAT 1153 87.356 16.810 88.718 1.00 0.00 H TER 94293 WAT 1153 ATOM 94293 O WAT 1154 144.927 45.735 73.960 1.00 0.00 O ATOM 94294 H1 WAT 1154 145.609 45.273 73.473 1.00 0.00 H ATOM 94295 H2 WAT 1154 144.783 45.198 74.739 1.00 0.00 H TER 94297 WAT 1154 ATOM 94297 O WAT 1155 36.505 51.559 155.713 1.00 0.00 O ATOM 94298 H1 WAT 1155 36.524 51.728 156.655 1.00 0.00 H ATOM 94299 H2 WAT 1155 35.595 51.713 155.460 1.00 0.00 H TER 94301 WAT 1155 ATOM 94301 O WAT 1156 24.197 70.688 106.223 1.00 0.00 O ATOM 94302 H1 WAT 1156 24.219 71.571 105.853 1.00 0.00 H ATOM 94303 H2 WAT 1156 23.967 70.820 107.143 1.00 0.00 H TER 94305 WAT 1156 ATOM 94305 O WAT 1157 75.669 123.861 139.972 1.00 0.00 O ATOM 94306 H1 WAT 1157 75.625 123.054 139.458 1.00 0.00 H ATOM 94307 H2 WAT 1157 76.379 124.362 139.571 1.00 0.00 H TER 94309 WAT 1157 ATOM 94309 O WAT 1158 104.731 56.595 108.811 1.00 0.00 O ATOM 94310 H1 WAT 1158 104.942 57.294 109.430 1.00 0.00 H ATOM 94311 H2 WAT 1158 103.973 56.923 108.328 1.00 0.00 H TER 94313 WAT 1158 ATOM 94313 O WAT 1159 42.997 63.978 9.904 1.00 0.00 O ATOM 94314 H1 WAT 1159 43.302 63.529 10.692 1.00 0.00 H ATOM 94315 H2 WAT 1159 43.741 64.515 9.631 1.00 0.00 H TER 94317 WAT 1159 ATOM 94317 O WAT 1160 108.793 124.612 144.494 1.00 0.00 O ATOM 94318 H1 WAT 1160 108.999 125.537 144.357 1.00 0.00 H ATOM 94319 H2 WAT 1160 108.608 124.544 145.431 1.00 0.00 H TER 94321 WAT 1160 ATOM 94321 O WAT 1161 116.396 82.768 2.828 1.00 0.00 O ATOM 94322 H1 WAT 1161 115.815 82.842 3.585 1.00 0.00 H ATOM 94323 H2 WAT 1161 116.235 83.565 2.323 1.00 0.00 H TER 94325 WAT 1161 ATOM 94325 O WAT 1162 71.902 98.062 12.229 1.00 0.00 O ATOM 94326 H1 WAT 1162 72.420 98.857 12.354 1.00 0.00 H ATOM 94327 H2 WAT 1162 71.084 98.233 12.696 1.00 0.00 H TER 94329 WAT 1162 ATOM 94329 O WAT 1163 57.554 48.564 95.274 1.00 0.00 O ATOM 94330 H1 WAT 1163 56.642 48.272 95.281 1.00 0.00 H ATOM 94331 H2 WAT 1163 57.746 48.767 96.190 1.00 0.00 H TER 94333 WAT 1163 ATOM 94333 O WAT 1164 90.194 56.692 98.480 1.00 0.00 O ATOM 94334 H1 WAT 1164 89.627 56.962 99.202 1.00 0.00 H ATOM 94335 H2 WAT 1164 89.740 55.948 98.084 1.00 0.00 H TER 94337 WAT 1164 ATOM 94337 O WAT 1165 17.185 122.630 112.112 1.00 0.00 O ATOM 94338 H1 WAT 1165 17.365 122.414 111.197 1.00 0.00 H ATOM 94339 H2 WAT 1165 17.561 121.904 112.609 1.00 0.00 H TER 94341 WAT 1165 ATOM 94341 O WAT 1166 99.052 124.539 97.965 1.00 0.00 O ATOM 94342 H1 WAT 1166 99.455 123.673 97.897 1.00 0.00 H ATOM 94343 H2 WAT 1166 98.629 124.539 98.824 1.00 0.00 H TER 94345 WAT 1166 ATOM 94345 O WAT 1167 70.485 89.287 106.611 1.00 0.00 O ATOM 94346 H1 WAT 1167 70.595 89.186 105.665 1.00 0.00 H ATOM 94347 H2 WAT 1167 71.367 89.465 106.937 1.00 0.00 H TER 94349 WAT 1167 ATOM 94349 O WAT 1168 81.687 36.337 125.825 1.00 0.00 O ATOM 94350 H1 WAT 1168 81.925 35.991 124.965 1.00 0.00 H ATOM 94351 H2 WAT 1168 81.507 37.264 125.669 1.00 0.00 H TER 94353 WAT 1168 ATOM 94353 O WAT 1169 31.877 57.145 71.002 1.00 0.00 O ATOM 94354 H1 WAT 1169 32.053 57.818 71.659 1.00 0.00 H ATOM 94355 H2 WAT 1169 31.929 57.607 70.165 1.00 0.00 H TER 94357 WAT 1169 ATOM 94357 O WAT 1170 85.995 22.618 91.527 1.00 0.00 O ATOM 94358 H1 WAT 1170 86.750 23.126 91.229 1.00 0.00 H ATOM 94359 H2 WAT 1170 85.802 22.027 90.799 1.00 0.00 H TER 94361 WAT 1170 ATOM 94361 O WAT 1171 140.800 99.763 94.043 1.00 0.00 O ATOM 94362 H1 WAT 1171 141.370 100.472 93.745 1.00 0.00 H ATOM 94363 H2 WAT 1171 141.137 98.983 93.601 1.00 0.00 H TER 94365 WAT 1171 ATOM 94365 O WAT 1172 12.774 20.317 114.731 1.00 0.00 O ATOM 94366 H1 WAT 1172 12.754 20.756 113.880 1.00 0.00 H ATOM 94367 H2 WAT 1172 12.986 21.013 115.354 1.00 0.00 H TER 94369 WAT 1172 ATOM 94369 O WAT 1173 30.854 104.778 105.744 1.00 0.00 O ATOM 94370 H1 WAT 1173 29.954 105.079 105.623 1.00 0.00 H ATOM 94371 H2 WAT 1173 30.991 104.143 105.040 1.00 0.00 H TER 94373 WAT 1173 ATOM 94373 O WAT 1174 7.128 133.524 59.771 1.00 0.00 O ATOM 94374 H1 WAT 1174 7.713 132.767 59.786 1.00 0.00 H ATOM 94375 H2 WAT 1174 6.394 133.271 60.331 1.00 0.00 H TER 94377 WAT 1174 ATOM 94377 O WAT 1175 96.767 59.204 141.856 1.00 0.00 O ATOM 94378 H1 WAT 1175 97.577 59.441 142.309 1.00 0.00 H ATOM 94379 H2 WAT 1175 97.059 58.827 141.026 1.00 0.00 H TER 94381 WAT 1175 ATOM 94381 O WAT 1176 0.583 12.988 156.105 1.00 0.00 O ATOM 94382 H1 WAT 1176 -0.286 12.587 156.143 1.00 0.00 H ATOM 94383 H2 WAT 1176 0.576 13.498 155.295 1.00 0.00 H TER 94385 WAT 1176 ATOM 94385 O WAT 1177 120.133 62.521 72.568 1.00 0.00 O ATOM 94386 H1 WAT 1177 120.815 62.705 71.922 1.00 0.00 H ATOM 94387 H2 WAT 1177 120.276 61.607 72.814 1.00 0.00 H TER 94389 WAT 1177 ATOM 94389 O WAT 1178 124.235 71.937 9.005 1.00 0.00 O ATOM 94390 H1 WAT 1178 123.701 71.676 8.255 1.00 0.00 H ATOM 94391 H2 WAT 1178 123.606 72.287 9.636 1.00 0.00 H TER 94393 WAT 1178 ATOM 94393 O WAT 1179 139.430 122.421 127.113 1.00 0.00 O ATOM 94394 H1 WAT 1179 140.327 122.337 126.790 1.00 0.00 H ATOM 94395 H2 WAT 1179 139.517 122.895 127.940 1.00 0.00 H TER 94397 WAT 1179 ATOM 94397 O WAT 1180 116.900 64.933 11.729 1.00 0.00 O ATOM 94398 H1 WAT 1180 117.817 64.676 11.829 1.00 0.00 H ATOM 94399 H2 WAT 1180 116.744 64.900 10.785 1.00 0.00 H TER 94401 WAT 1180 ATOM 94401 O WAT 1181 72.684 0.713 147.172 1.00 0.00 O ATOM 94402 H1 WAT 1181 72.637 -0.069 147.722 1.00 0.00 H ATOM 94403 H2 WAT 1181 73.218 0.447 146.423 1.00 0.00 H TER 94405 WAT 1181 ATOM 94405 O WAT 1182 95.678 56.853 86.083 1.00 0.00 O ATOM 94406 H1 WAT 1182 94.994 56.902 86.750 1.00 0.00 H ATOM 94407 H2 WAT 1182 95.204 56.879 85.251 1.00 0.00 H TER 94409 WAT 1182 ATOM 94409 O WAT 1183 85.169 84.287 18.891 1.00 0.00 O ATOM 94410 H1 WAT 1183 85.326 85.215 19.065 1.00 0.00 H ATOM 94411 H2 WAT 1183 86.035 83.931 18.693 1.00 0.00 H TER 94413 WAT 1183 ATOM 94413 O WAT 1184 130.196 17.720 60.210 1.00 0.00 O ATOM 94414 H1 WAT 1184 130.360 18.207 59.402 1.00 0.00 H ATOM 94415 H2 WAT 1184 129.519 17.086 59.974 1.00 0.00 H TER 94417 WAT 1184 ATOM 94417 O WAT 1185 84.099 16.090 118.326 1.00 0.00 O ATOM 94418 H1 WAT 1185 83.996 15.499 119.072 1.00 0.00 H ATOM 94419 H2 WAT 1185 83.208 16.369 118.117 1.00 0.00 H TER 94421 WAT 1185 ATOM 94421 O WAT 1186 81.120 30.796 64.215 1.00 0.00 O ATOM 94422 H1 WAT 1186 81.712 30.357 63.604 1.00 0.00 H ATOM 94423 H2 WAT 1186 81.144 30.253 65.004 1.00 0.00 H TER 94425 WAT 1186 ATOM 94425 O WAT 1187 70.217 41.662 4.649 1.00 0.00 O ATOM 94426 H1 WAT 1187 69.861 42.376 5.178 1.00 0.00 H ATOM 94427 H2 WAT 1187 69.522 41.456 4.025 1.00 0.00 H TER 94429 WAT 1187 ATOM 94429 O WAT 1188 65.185 109.428 67.113 1.00 0.00 O ATOM 94430 H1 WAT 1188 65.289 108.985 67.955 1.00 0.00 H ATOM 94431 H2 WAT 1188 66.053 109.781 66.919 1.00 0.00 H TER 94433 WAT 1188 ATOM 94433 O WAT 1189 65.783 60.486 114.285 1.00 0.00 O ATOM 94434 H1 WAT 1189 65.858 61.431 114.419 1.00 0.00 H ATOM 94435 H2 WAT 1189 65.037 60.387 113.693 1.00 0.00 H TER 94437 WAT 1189 ATOM 94437 O WAT 1190 9.720 21.458 4.063 1.00 0.00 O ATOM 94438 H1 WAT 1190 9.026 21.868 3.547 1.00 0.00 H ATOM 94439 H2 WAT 1190 9.256 20.905 4.692 1.00 0.00 H TER 94441 WAT 1190 ATOM 94441 O WAT 1191 124.171 71.621 128.375 1.00 0.00 O ATOM 94442 H1 WAT 1191 124.006 71.213 129.225 1.00 0.00 H ATOM 94443 H2 WAT 1191 124.691 72.398 128.579 1.00 0.00 H TER 94445 WAT 1191 ATOM 94445 O WAT 1192 126.872 110.349 98.221 1.00 0.00 O ATOM 94446 H1 WAT 1192 127.035 109.416 98.358 1.00 0.00 H ATOM 94447 H2 WAT 1192 126.935 110.466 97.273 1.00 0.00 H TER 94449 WAT 1192 ATOM 94449 O WAT 1193 134.292 31.327 66.731 1.00 0.00 O ATOM 94450 H1 WAT 1193 134.169 31.942 66.007 1.00 0.00 H ATOM 94451 H2 WAT 1193 135.212 31.070 66.673 1.00 0.00 H TER 94453 WAT 1193 ATOM 94453 O WAT 1194 27.578 100.524 124.217 1.00 0.00 O ATOM 94454 H1 WAT 1194 27.772 100.816 123.326 1.00 0.00 H ATOM 94455 H2 WAT 1194 27.920 101.220 124.777 1.00 0.00 H TER 94457 WAT 1194 ATOM 94457 O WAT 1195 142.665 7.117 86.884 1.00 0.00 O ATOM 94458 H1 WAT 1195 142.314 7.813 86.328 1.00 0.00 H ATOM 94459 H2 WAT 1195 143.364 6.723 86.362 1.00 0.00 H TER 94461 WAT 1195 ATOM 94461 O WAT 1196 122.519 14.055 123.944 1.00 0.00 O ATOM 94462 H1 WAT 1196 121.570 13.930 123.942 1.00 0.00 H ATOM 94463 H2 WAT 1196 122.807 13.689 124.780 1.00 0.00 H TER 94465 WAT 1196 ATOM 94465 O WAT 1197 6.914 112.012 13.083 1.00 0.00 O ATOM 94466 H1 WAT 1197 6.318 112.760 13.031 1.00 0.00 H ATOM 94467 H2 WAT 1197 6.724 111.500 12.297 1.00 0.00 H TER 94469 WAT 1197 ATOM 94469 O WAT 1198 139.307 115.609 156.210 1.00 0.00 O ATOM 94470 H1 WAT 1198 140.127 116.103 156.222 1.00 0.00 H ATOM 94471 H2 WAT 1198 138.808 115.955 156.950 1.00 0.00 H TER 94473 WAT 1198 ATOM 94473 O WAT 1199 136.708 40.939 21.976 1.00 0.00 O ATOM 94474 H1 WAT 1199 137.277 41.052 21.214 1.00 0.00 H ATOM 94475 H2 WAT 1199 135.945 40.470 21.638 1.00 0.00 H TER 94477 WAT 1199 ATOM 94477 O WAT 1200 4.677 72.926 150.155 1.00 0.00 O ATOM 94478 H1 WAT 1200 5.363 72.294 150.369 1.00 0.00 H ATOM 94479 H2 WAT 1200 4.090 72.907 150.911 1.00 0.00 H TER 94481 WAT 1200 ATOM 94481 O WAT 1201 21.049 22.324 116.324 1.00 0.00 O ATOM 94482 H1 WAT 1201 21.411 21.561 116.774 1.00 0.00 H ATOM 94483 H2 WAT 1201 21.798 22.905 116.195 1.00 0.00 H TER 94485 WAT 1201 ATOM 94485 O WAT 1202 138.752 25.389 134.618 1.00 0.00 O ATOM 94486 H1 WAT 1202 138.459 24.815 133.910 1.00 0.00 H ATOM 94487 H2 WAT 1202 139.428 24.884 135.071 1.00 0.00 H TER 94489 WAT 1202 ATOM 94489 O WAT 1203 95.307 125.929 56.248 1.00 0.00 O ATOM 94490 H1 WAT 1203 95.985 126.271 56.831 1.00 0.00 H ATOM 94491 H2 WAT 1203 95.668 125.106 55.919 1.00 0.00 H TER 94493 WAT 1203 ATOM 94493 O WAT 1204 3.675 96.605 92.334 1.00 0.00 O ATOM 94494 H1 WAT 1204 2.975 95.980 92.143 1.00 0.00 H ATOM 94495 H2 WAT 1204 4.480 96.092 92.257 1.00 0.00 H TER 94497 WAT 1204 ATOM 94497 O WAT 1205 116.491 105.338 9.007 1.00 0.00 O ATOM 94498 H1 WAT 1205 115.692 105.127 8.524 1.00 0.00 H ATOM 94499 H2 WAT 1205 116.272 105.162 9.922 1.00 0.00 H TER 94501 WAT 1205 ATOM 94501 O WAT 1206 4.772 2.847 128.811 1.00 0.00 O ATOM 94502 H1 WAT 1206 5.274 3.634 129.022 1.00 0.00 H ATOM 94503 H2 WAT 1206 4.103 2.799 129.494 1.00 0.00 H TER 94505 WAT 1206 ATOM 94505 O WAT 1207 61.482 51.719 65.980 1.00 0.00 O ATOM 94506 H1 WAT 1207 61.874 52.359 66.574 1.00 0.00 H ATOM 94507 H2 WAT 1207 62.005 51.782 65.181 1.00 0.00 H TER 94509 WAT 1207 ATOM 94509 O WAT 1208 126.063 100.298 73.001 1.00 0.00 O ATOM 94510 H1 WAT 1208 125.233 100.107 72.564 1.00 0.00 H ATOM 94511 H2 WAT 1208 125.823 100.864 73.735 1.00 0.00 H TER 94513 WAT 1208 ATOM 94513 O WAT 1209 117.356 108.833 115.302 1.00 0.00 O ATOM 94514 H1 WAT 1209 116.608 109.355 115.591 1.00 0.00 H ATOM 94515 H2 WAT 1209 117.190 107.959 115.655 1.00 0.00 H TER 94517 WAT 1209 ATOM 94517 O WAT 1210 17.630 100.304 122.396 1.00 0.00 O ATOM 94518 H1 WAT 1210 16.833 99.844 122.133 1.00 0.00 H ATOM 94519 H2 WAT 1210 17.431 101.229 122.253 1.00 0.00 H TER 94521 WAT 1210 ATOM 94521 O WAT 1211 72.668 142.184 127.157 1.00 0.00 O ATOM 94522 H1 WAT 1211 71.852 142.357 127.626 1.00 0.00 H ATOM 94523 H2 WAT 1211 73.346 142.223 127.832 1.00 0.00 H TER 94525 WAT 1211 ATOM 94525 O WAT 1212 60.237 114.200 124.665 1.00 0.00 O ATOM 94526 H1 WAT 1212 60.321 114.108 125.614 1.00 0.00 H ATOM 94527 H2 WAT 1212 59.842 113.376 124.379 1.00 0.00 H TER 94529 WAT 1212 ATOM 94529 O WAT 1213 95.737 102.928 132.227 1.00 0.00 O ATOM 94530 H1 WAT 1213 95.930 103.840 132.005 1.00 0.00 H ATOM 94531 H2 WAT 1213 96.359 102.715 132.923 1.00 0.00 H TER 94533 WAT 1213 ATOM 94533 O WAT 1214 52.648 45.344 132.128 1.00 0.00 O ATOM 94534 H1 WAT 1214 52.921 45.215 131.219 1.00 0.00 H ATOM 94535 H2 WAT 1214 52.594 44.459 132.489 1.00 0.00 H TER 94537 WAT 1214 ATOM 94537 O WAT 1215 50.463 143.103 14.792 1.00 0.00 O ATOM 94538 H1 WAT 1215 50.865 142.304 14.450 1.00 0.00 H ATOM 94539 H2 WAT 1215 50.429 142.967 15.739 1.00 0.00 H TER 94541 WAT 1215 ATOM 94541 O WAT 1216 113.769 18.792 53.487 1.00 0.00 O ATOM 94542 H1 WAT 1216 113.008 19.121 53.965 1.00 0.00 H ATOM 94543 H2 WAT 1216 114.453 18.710 54.151 1.00 0.00 H TER 94545 WAT 1216 ATOM 94545 O WAT 1217 118.669 10.072 133.691 1.00 0.00 O ATOM 94546 H1 WAT 1217 119.596 10.311 133.699 1.00 0.00 H ATOM 94547 H2 WAT 1217 118.207 10.905 133.785 1.00 0.00 H TER 94549 WAT 1217 ATOM 94549 O WAT 1218 97.438 43.411 9.355 1.00 0.00 O ATOM 94550 H1 WAT 1218 97.850 43.115 10.166 1.00 0.00 H ATOM 94551 H2 WAT 1218 96.615 42.924 9.313 1.00 0.00 H TER 94553 WAT 1218 ATOM 94553 O WAT 1219 119.403 130.068 142.909 1.00 0.00 O ATOM 94554 H1 WAT 1219 120.284 129.693 142.923 1.00 0.00 H ATOM 94555 H2 WAT 1219 118.946 129.633 143.629 1.00 0.00 H TER 94557 WAT 1219 ATOM 94557 O WAT 1220 121.040 48.885 94.067 1.00 0.00 O ATOM 94558 H1 WAT 1220 120.730 48.937 93.163 1.00 0.00 H ATOM 94559 H2 WAT 1220 121.990 48.801 93.991 1.00 0.00 H TER 94561 WAT 1220 ATOM 94561 O WAT 1221 19.800 132.661 15.440 1.00 0.00 O ATOM 94562 H1 WAT 1221 20.127 131.785 15.238 1.00 0.00 H ATOM 94563 H2 WAT 1221 19.169 132.847 14.744 1.00 0.00 H TER 94565 WAT 1221 ATOM 94565 O WAT 1222 61.785 47.614 112.377 1.00 0.00 O ATOM 94566 H1 WAT 1222 62.556 47.654 112.944 1.00 0.00 H ATOM 94567 H2 WAT 1222 62.083 47.976 111.543 1.00 0.00 H TER 94569 WAT 1222 ATOM 94569 O WAT 1223 9.341 143.193 141.295 1.00 0.00 O ATOM 94570 H1 WAT 1223 8.765 143.939 141.461 1.00 0.00 H ATOM 94571 H2 WAT 1223 8.792 142.567 140.822 1.00 0.00 H TER 94573 WAT 1223 ATOM 94573 O WAT 1224 21.144 127.128 120.533 1.00 0.00 O ATOM 94574 H1 WAT 1224 20.979 126.304 120.993 1.00 0.00 H ATOM 94575 H2 WAT 1224 20.811 126.978 119.648 1.00 0.00 H TER 94577 WAT 1224 ATOM 94577 O WAT 1225 37.184 97.898 153.664 1.00 0.00 O ATOM 94578 H1 WAT 1225 36.714 98.697 153.903 1.00 0.00 H ATOM 94579 H2 WAT 1225 36.495 97.250 153.516 1.00 0.00 H TER 94581 WAT 1225 ATOM 94581 O WAT 1226 91.318 82.900 58.207 1.00 0.00 O ATOM 94582 H1 WAT 1226 90.923 82.030 58.140 1.00 0.00 H ATOM 94583 H2 WAT 1226 90.717 83.472 57.729 1.00 0.00 H TER 94585 WAT 1226 ATOM 94585 O WAT 1227 49.221 140.533 63.696 1.00 0.00 O ATOM 94586 H1 WAT 1227 48.500 140.800 63.126 1.00 0.00 H ATOM 94587 H2 WAT 1227 48.793 140.216 64.491 1.00 0.00 H TER 94589 WAT 1227 ATOM 94589 O WAT 1228 105.744 135.939 125.959 1.00 0.00 O ATOM 94590 H1 WAT 1228 105.704 136.891 126.049 1.00 0.00 H ATOM 94591 H2 WAT 1228 104.879 135.692 125.632 1.00 0.00 H TER 94593 WAT 1228 ATOM 94593 O WAT 1229 111.797 7.431 93.924 1.00 0.00 O ATOM 94594 H1 WAT 1229 112.431 8.036 94.308 1.00 0.00 H ATOM 94595 H2 WAT 1229 111.438 7.904 93.173 1.00 0.00 H TER 94597 WAT 1229 ATOM 94597 O WAT 1230 86.113 94.735 58.351 1.00 0.00 O ATOM 94598 H1 WAT 1230 86.558 95.469 57.927 1.00 0.00 H ATOM 94599 H2 WAT 1230 85.427 95.143 58.879 1.00 0.00 H TER 94601 WAT 1230 ATOM 94601 O WAT 1231 111.810 27.453 70.800 1.00 0.00 O ATOM 94602 H1 WAT 1231 111.858 27.943 71.620 1.00 0.00 H ATOM 94603 H2 WAT 1231 111.298 28.013 70.216 1.00 0.00 H TER 94605 WAT 1231 ATOM 94605 O WAT 1232 57.079 95.568 150.358 1.00 0.00 O ATOM 94606 H1 WAT 1232 57.199 96.326 149.786 1.00 0.00 H ATOM 94607 H2 WAT 1232 56.239 95.723 150.789 1.00 0.00 H TER 94609 WAT 1232 ATOM 94609 O WAT 1233 18.057 60.900 123.885 1.00 0.00 O ATOM 94610 H1 WAT 1233 17.282 60.372 123.694 1.00 0.00 H ATOM 94611 H2 WAT 1233 18.742 60.531 123.328 1.00 0.00 H TER 94613 WAT 1233 ATOM 94613 O WAT 1234 96.395 35.349 117.162 1.00 0.00 O ATOM 94614 H1 WAT 1234 96.064 34.580 117.627 1.00 0.00 H ATOM 94615 H2 WAT 1234 96.384 36.047 117.816 1.00 0.00 H TER 94617 WAT 1234 ATOM 94617 O WAT 1235 60.102 132.919 110.430 1.00 0.00 O ATOM 94618 H1 WAT 1235 59.851 132.955 109.507 1.00 0.00 H ATOM 94619 H2 WAT 1235 60.774 133.594 110.523 1.00 0.00 H TER 94621 WAT 1235 ATOM 94621 O WAT 1236 138.917 102.960 126.154 1.00 0.00 O ATOM 94622 H1 WAT 1236 139.862 103.031 126.017 1.00 0.00 H ATOM 94623 H2 WAT 1236 138.573 103.818 125.903 1.00 0.00 H TER 94625 WAT 1236 ATOM 94625 O WAT 1237 62.907 2.932 5.366 1.00 0.00 O ATOM 94626 H1 WAT 1237 63.079 2.752 6.291 1.00 0.00 H ATOM 94627 H2 WAT 1237 63.639 3.482 5.089 1.00 0.00 H TER 94629 WAT 1237 ATOM 94629 O WAT 1238 70.023 91.145 158.137 1.00 0.00 O ATOM 94630 H1 WAT 1238 69.481 91.636 158.754 1.00 0.00 H ATOM 94631 H2 WAT 1238 70.364 90.412 158.650 1.00 0.00 H TER 94633 WAT 1238 ATOM 94633 O WAT 1239 5.887 130.308 140.768 1.00 0.00 O ATOM 94634 H1 WAT 1239 5.778 129.360 140.847 1.00 0.00 H ATOM 94635 H2 WAT 1239 6.246 130.435 139.890 1.00 0.00 H TER 94637 WAT 1239 ATOM 94637 O WAT 1240 129.678 7.860 87.686 1.00 0.00 O ATOM 94638 H1 WAT 1240 130.161 8.559 87.245 1.00 0.00 H ATOM 94639 H2 WAT 1240 129.479 7.232 86.991 1.00 0.00 H TER 94641 WAT 1240 ATOM 94641 O WAT 1241 58.869 33.396 55.610 1.00 0.00 O ATOM 94642 H1 WAT 1241 59.253 33.334 54.735 1.00 0.00 H ATOM 94643 H2 WAT 1241 57.946 33.179 55.482 1.00 0.00 H TER 94645 WAT 1241 ATOM 94645 O WAT 1242 95.469 16.025 156.726 1.00 0.00 O ATOM 94646 H1 WAT 1242 95.298 16.036 155.784 1.00 0.00 H ATOM 94647 H2 WAT 1242 95.740 15.125 156.910 1.00 0.00 H TER 94649 WAT 1242 ATOM 94649 O WAT 1243 107.250 88.975 17.841 1.00 0.00 O ATOM 94650 H1 WAT 1243 108.051 89.300 18.253 1.00 0.00 H ATOM 94651 H2 WAT 1243 106.543 89.340 18.374 1.00 0.00 H TER 94653 WAT 1243 ATOM 94653 O WAT 1244 20.795 37.683 151.968 1.00 0.00 O ATOM 94654 H1 WAT 1244 20.600 37.968 151.075 1.00 0.00 H ATOM 94655 H2 WAT 1244 20.564 38.433 152.515 1.00 0.00 H TER 94657 WAT 1244 ATOM 94657 O WAT 1245 94.892 139.315 84.154 1.00 0.00 O ATOM 94658 H1 WAT 1245 94.464 138.544 84.527 1.00 0.00 H ATOM 94659 H2 WAT 1245 94.192 139.778 83.694 1.00 0.00 H TER 94661 WAT 1245 ATOM 94661 O WAT 1246 30.876 94.350 112.285 1.00 0.00 O ATOM 94662 H1 WAT 1246 31.027 93.689 111.610 1.00 0.00 H ATOM 94663 H2 WAT 1246 30.840 93.854 113.103 1.00 0.00 H TER 94665 WAT 1246 ATOM 94665 O WAT 1247 82.347 110.751 150.928 1.00 0.00 O ATOM 94666 H1 WAT 1247 82.653 111.619 151.194 1.00 0.00 H ATOM 94667 H2 WAT 1247 83.109 110.345 150.514 1.00 0.00 H TER 94669 WAT 1247 ATOM 94669 O WAT 1248 113.647 101.922 4.722 1.00 0.00 O ATOM 94670 H1 WAT 1248 112.999 102.622 4.642 1.00 0.00 H ATOM 94671 H2 WAT 1248 113.288 101.338 5.390 1.00 0.00 H TER 94673 WAT 1248 ATOM 94673 O WAT 1249 131.487 127.099 121.183 1.00 0.00 O ATOM 94674 H1 WAT 1249 131.331 127.932 121.628 1.00 0.00 H ATOM 94675 H2 WAT 1249 132.379 126.857 121.432 1.00 0.00 H TER 94677 WAT 1249 ATOM 94677 O WAT 1250 122.594 84.348 15.300 1.00 0.00 O ATOM 94678 H1 WAT 1250 122.075 84.652 14.555 1.00 0.00 H ATOM 94679 H2 WAT 1250 123.077 83.593 14.963 1.00 0.00 H TER 94681 WAT 1250 ATOM 94681 O WAT 1251 41.114 71.739 69.210 1.00 0.00 O ATOM 94682 H1 WAT 1251 40.312 71.344 69.552 1.00 0.00 H ATOM 94683 H2 WAT 1251 41.700 71.783 69.966 1.00 0.00 H TER 94685 WAT 1251 ATOM 94685 O WAT 1252 38.850 140.490 5.406 1.00 0.00 O ATOM 94686 H1 WAT 1252 38.850 139.637 5.839 1.00 0.00 H ATOM 94687 H2 WAT 1252 38.226 140.393 4.687 1.00 0.00 H TER 94689 WAT 1252 ATOM 94689 O WAT 1253 68.387 95.788 117.332 1.00 0.00 O ATOM 94690 H1 WAT 1253 68.003 95.831 116.456 1.00 0.00 H ATOM 94691 H2 WAT 1253 69.269 96.144 117.225 1.00 0.00 H TER 94693 WAT 1253 ATOM 94693 O WAT 1254 47.982 36.789 141.359 1.00 0.00 O ATOM 94694 H1 WAT 1254 47.342 36.735 142.069 1.00 0.00 H ATOM 94695 H2 WAT 1254 48.551 36.031 141.492 1.00 0.00 H TER 94697 WAT 1254 ATOM 94697 O WAT 1255 38.640 114.921 132.092 1.00 0.00 O ATOM 94698 H1 WAT 1255 38.804 114.028 132.394 1.00 0.00 H ATOM 94699 H2 WAT 1255 38.737 115.461 132.877 1.00 0.00 H TER 94701 WAT 1255 ATOM 94701 O WAT 1256 145.149 107.151 119.743 1.00 0.00 O ATOM 94702 H1 WAT 1256 145.385 106.995 120.658 1.00 0.00 H ATOM 94703 H2 WAT 1256 144.223 107.388 119.772 1.00 0.00 H TER 94705 WAT 1256 ATOM 94705 O WAT 1257 84.427 125.059 156.317 1.00 0.00 O ATOM 94706 H1 WAT 1257 84.324 125.998 156.475 1.00 0.00 H ATOM 94707 H2 WAT 1257 85.028 124.766 157.002 1.00 0.00 H TER 94709 WAT 1257 ATOM 94709 O WAT 1258 21.656 53.643 107.517 1.00 0.00 O ATOM 94710 H1 WAT 1258 21.824 54.369 108.118 1.00 0.00 H ATOM 94711 H2 WAT 1258 22.245 52.949 107.811 1.00 0.00 H TER 94713 WAT 1258 ATOM 94713 O WAT 1259 117.572 16.732 95.928 1.00 0.00 O ATOM 94714 H1 WAT 1259 117.216 17.537 96.303 1.00 0.00 H ATOM 94715 H2 WAT 1259 117.830 16.976 95.039 1.00 0.00 H TER 94717 WAT 1259 ATOM 94717 O WAT 1260 44.267 64.003 90.628 1.00 0.00 O ATOM 94718 H1 WAT 1260 44.633 63.121 90.572 1.00 0.00 H ATOM 94719 H2 WAT 1260 45.021 64.565 90.806 1.00 0.00 H TER 94721 WAT 1260 ATOM 94721 O WAT 1261 112.995 9.301 140.491 1.00 0.00 O ATOM 94722 H1 WAT 1261 113.226 9.505 141.398 1.00 0.00 H ATOM 94723 H2 WAT 1261 112.313 9.934 140.269 1.00 0.00 H TER 94725 WAT 1261 ATOM 94725 O WAT 1262 29.515 130.089 14.401 1.00 0.00 O ATOM 94726 H1 WAT 1262 29.306 130.548 15.215 1.00 0.00 H ATOM 94727 H2 WAT 1262 30.152 129.423 14.659 1.00 0.00 H TER 94729 WAT 1262 ATOM 94729 O WAT 1263 73.631 131.724 63.492 1.00 0.00 O ATOM 94730 H1 WAT 1263 74.170 130.945 63.359 1.00 0.00 H ATOM 94731 H2 WAT 1263 73.380 131.995 62.609 1.00 0.00 H TER 94733 WAT 1263 ATOM 94733 O WAT 1264 80.944 44.055 20.230 1.00 0.00 O ATOM 94734 H1 WAT 1264 80.116 44.464 19.980 1.00 0.00 H ATOM 94735 H2 WAT 1264 80.739 43.564 21.025 1.00 0.00 H TER 94737 WAT 1264 ATOM 94737 O WAT 1265 5.021 141.866 61.400 1.00 0.00 O ATOM 94738 H1 WAT 1265 4.788 142.755 61.133 1.00 0.00 H ATOM 94739 H2 WAT 1265 5.931 141.763 61.120 1.00 0.00 H TER 94741 WAT 1265 ATOM 94741 O WAT 1266 30.680 64.702 117.833 1.00 0.00 O ATOM 94742 H1 WAT 1266 31.616 64.899 117.800 1.00 0.00 H ATOM 94743 H2 WAT 1266 30.638 63.784 118.101 1.00 0.00 H TER 94745 WAT 1266 ATOM 94745 O WAT 1267 6.461 71.836 132.682 1.00 0.00 O ATOM 94746 H1 WAT 1267 6.261 70.910 132.820 1.00 0.00 H ATOM 94747 H2 WAT 1267 6.158 72.017 131.793 1.00 0.00 H TER 94749 WAT 1267 ATOM 94749 O WAT 1268 64.792 132.817 98.878 1.00 0.00 O ATOM 94750 H1 WAT 1268 64.539 131.896 98.827 1.00 0.00 H ATOM 94751 H2 WAT 1268 65.703 132.800 99.170 1.00 0.00 H TER 94753 WAT 1268 ATOM 94753 O WAT 1269 112.007 41.308 111.155 1.00 0.00 O ATOM 94754 H1 WAT 1269 112.409 41.985 110.612 1.00 0.00 H ATOM 94755 H2 WAT 1269 112.694 41.058 111.774 1.00 0.00 H TER 94757 WAT 1269 ATOM 94757 O WAT 1270 19.962 26.159 141.811 1.00 0.00 O ATOM 94758 H1 WAT 1270 19.048 25.886 141.891 1.00 0.00 H ATOM 94759 H2 WAT 1270 20.206 26.441 142.692 1.00 0.00 H TER 94761 WAT 1270 ATOM 94761 O WAT 1271 108.259 96.226 127.074 1.00 0.00 O ATOM 94762 H1 WAT 1271 108.242 96.539 126.169 1.00 0.00 H ATOM 94763 H2 WAT 1271 109.184 96.248 127.317 1.00 0.00 H TER 94765 WAT 1271 ATOM 94765 O WAT 1272 126.458 28.605 124.440 1.00 0.00 O ATOM 94766 H1 WAT 1272 126.748 28.481 123.536 1.00 0.00 H ATOM 94767 H2 WAT 1272 127.027 29.293 124.783 1.00 0.00 H TER 94769 WAT 1272 ATOM 94769 O WAT 1273 0.820 73.272 133.147 1.00 0.00 O ATOM 94770 H1 WAT 1273 1.086 74.010 132.600 1.00 0.00 H ATOM 94771 H2 WAT 1273 0.175 72.801 132.618 1.00 0.00 H TER 94773 WAT 1273 ATOM 94773 O WAT 1274 27.353 53.391 123.193 1.00 0.00 O ATOM 94774 H1 WAT 1274 27.642 54.294 123.324 1.00 0.00 H ATOM 94775 H2 WAT 1274 27.719 52.912 123.938 1.00 0.00 H TER 94777 WAT 1274 ATOM 94777 O WAT 1275 59.238 100.595 123.629 1.00 0.00 O ATOM 94778 H1 WAT 1275 59.306 99.685 123.340 1.00 0.00 H ATOM 94779 H2 WAT 1275 58.943 101.071 122.853 1.00 0.00 H TER 94781 WAT 1275 ATOM 94781 O WAT 1276 142.931 82.355 13.559 1.00 0.00 O ATOM 94782 H1 WAT 1276 142.399 81.701 13.107 1.00 0.00 H ATOM 94783 H2 WAT 1276 143.162 82.989 12.880 1.00 0.00 H TER 94785 WAT 1276 ATOM 94785 O WAT 1277 48.586 85.027 83.727 1.00 0.00 O ATOM 94786 H1 WAT 1277 48.812 85.546 82.955 1.00 0.00 H ATOM 94787 H2 WAT 1277 48.056 84.307 83.385 1.00 0.00 H TER 94789 WAT 1277 ATOM 94789 O WAT 1278 36.191 49.308 81.894 1.00 0.00 O ATOM 94790 H1 WAT 1278 36.468 49.308 80.978 1.00 0.00 H ATOM 94791 H2 WAT 1278 35.237 49.240 81.856 1.00 0.00 H TER 94793 WAT 1278 ATOM 94793 O WAT 1279 114.136 36.710 10.244 1.00 0.00 O ATOM 94794 H1 WAT 1279 114.996 36.315 10.099 1.00 0.00 H ATOM 94795 H2 WAT 1279 113.727 36.719 9.379 1.00 0.00 H TER 94797 WAT 1279 ATOM 94797 O WAT 1280 101.537 50.263 80.728 1.00 0.00 O ATOM 94798 H1 WAT 1280 101.931 50.952 81.263 1.00 0.00 H ATOM 94799 H2 WAT 1280 101.958 50.354 79.873 1.00 0.00 H TER 94801 WAT 1280 ATOM 94801 O WAT 1281 77.519 52.443 96.784 1.00 0.00 O ATOM 94802 H1 WAT 1281 76.585 52.297 96.636 1.00 0.00 H ATOM 94803 H2 WAT 1281 77.588 53.378 96.980 1.00 0.00 H TER 94805 WAT 1281 ATOM 94805 O WAT 1282 96.443 4.012 146.955 1.00 0.00 O ATOM 94806 H1 WAT 1282 96.763 3.269 146.442 1.00 0.00 H ATOM 94807 H2 WAT 1282 96.289 4.700 146.308 1.00 0.00 H TER 94809 WAT 1282 ATOM 94809 O WAT 1283 22.161 48.573 107.452 1.00 0.00 O ATOM 94810 H1 WAT 1283 21.375 49.016 107.132 1.00 0.00 H ATOM 94811 H2 WAT 1283 22.020 47.650 107.238 1.00 0.00 H TER 94813 WAT 1283 ATOM 94813 O WAT 1284 90.897 50.661 1.126 1.00 0.00 O ATOM 94814 H1 WAT 1284 90.671 51.081 0.296 1.00 0.00 H ATOM 94815 H2 WAT 1284 90.773 49.726 0.963 1.00 0.00 H TER 94817 WAT 1284 ATOM 94817 O WAT 1285 136.497 68.200 23.001 1.00 0.00 O ATOM 94818 H1 WAT 1285 136.134 68.646 22.236 1.00 0.00 H ATOM 94819 H2 WAT 1285 137.233 67.694 22.656 1.00 0.00 H TER 94821 WAT 1285 ATOM 94821 O WAT 1286 113.918 104.456 116.467 1.00 0.00 O ATOM 94822 H1 WAT 1286 112.988 104.654 116.571 1.00 0.00 H ATOM 94823 H2 WAT 1286 113.952 103.848 115.729 1.00 0.00 H TER 94825 WAT 1286 ATOM 94825 O WAT 1287 120.143 119.350 74.496 1.00 0.00 O ATOM 94826 H1 WAT 1287 120.284 119.987 73.795 1.00 0.00 H ATOM 94827 H2 WAT 1287 119.205 119.402 74.682 1.00 0.00 H TER 94829 WAT 1287 ATOM 94829 O WAT 1288 11.373 117.573 8.411 1.00 0.00 O ATOM 94830 H1 WAT 1288 10.621 117.247 8.905 1.00 0.00 H ATOM 94831 H2 WAT 1288 11.550 116.890 7.765 1.00 0.00 H TER 94833 WAT 1288 ATOM 94833 O WAT 1289 8.352 81.244 17.645 1.00 0.00 O ATOM 94834 H1 WAT 1289 8.894 81.741 17.032 1.00 0.00 H ATOM 94835 H2 WAT 1289 8.786 81.353 18.491 1.00 0.00 H TER 94837 WAT 1289 ATOM 94837 O WAT 1290 128.115 113.287 24.231 1.00 0.00 O ATOM 94838 H1 WAT 1290 127.637 112.803 24.904 1.00 0.00 H ATOM 94839 H2 WAT 1290 128.848 112.717 24.000 1.00 0.00 H TER 94841 WAT 1290 ATOM 94841 O WAT 1291 14.713 145.647 78.171 1.00 0.00 O ATOM 94842 H1 WAT 1291 14.163 145.025 77.694 1.00 0.00 H ATOM 94843 H2 WAT 1291 14.093 146.208 78.636 1.00 0.00 H TER 94845 WAT 1291 ATOM 94845 O WAT 1292 93.803 85.321 61.392 1.00 0.00 O ATOM 94846 H1 WAT 1292 93.381 85.771 60.661 1.00 0.00 H ATOM 94847 H2 WAT 1292 93.982 86.013 62.029 1.00 0.00 H TER 94849 WAT 1292 ATOM 94849 O WAT 1293 142.531 94.232 24.051 1.00 0.00 O ATOM 94850 H1 WAT 1293 141.902 93.765 23.501 1.00 0.00 H ATOM 94851 H2 WAT 1293 142.403 93.866 24.926 1.00 0.00 H TER 94853 WAT 1293 ATOM 94853 O WAT 1294 58.514 87.984 108.453 1.00 0.00 O ATOM 94854 H1 WAT 1294 58.177 87.132 108.730 1.00 0.00 H ATOM 94855 H2 WAT 1294 58.309 88.571 109.182 1.00 0.00 H TER 94857 WAT 1294 ATOM 94857 O WAT 1295 126.036 41.120 76.091 1.00 0.00 O ATOM 94858 H1 WAT 1295 125.896 40.855 77.000 1.00 0.00 H ATOM 94859 H2 WAT 1295 125.199 41.497 75.819 1.00 0.00 H TER 94861 WAT 1295 ATOM 94861 O WAT 1296 116.891 82.130 80.020 1.00 0.00 O ATOM 94862 H1 WAT 1296 116.996 81.209 79.782 1.00 0.00 H ATOM 94863 H2 WAT 1296 116.703 82.571 79.192 1.00 0.00 H TER 94865 WAT 1296 ATOM 94865 O WAT 1297 140.745 28.016 63.468 1.00 0.00 O ATOM 94866 H1 WAT 1297 140.288 27.972 62.628 1.00 0.00 H ATOM 94867 H2 WAT 1297 140.235 27.450 64.048 1.00 0.00 H TER 94869 WAT 1297 ATOM 94869 O WAT 1298 12.944 5.989 132.829 1.00 0.00 O ATOM 94870 H1 WAT 1298 12.512 5.332 132.283 1.00 0.00 H ATOM 94871 H2 WAT 1298 13.688 6.285 132.304 1.00 0.00 H TER 94873 WAT 1298 ATOM 94873 O WAT 1299 17.342 113.272 143.579 1.00 0.00 O ATOM 94874 H1 WAT 1299 17.873 114.068 143.534 1.00 0.00 H ATOM 94875 H2 WAT 1299 17.977 112.558 143.525 1.00 0.00 H TER 94877 WAT 1299 ATOM 94877 O WAT 1300 10.123 67.577 83.546 1.00 0.00 O ATOM 94878 H1 WAT 1300 9.823 67.838 84.417 1.00 0.00 H ATOM 94879 H2 WAT 1300 9.447 66.978 83.229 1.00 0.00 H TER 94881 WAT 1300 ATOM 94881 O WAT 1301 70.616 141.658 68.486 1.00 0.00 O ATOM 94882 H1 WAT 1301 70.709 141.006 67.792 1.00 0.00 H ATOM 94883 H2 WAT 1301 70.355 141.153 69.256 1.00 0.00 H TER 94885 WAT 1301 ATOM 94885 O WAT 1302 133.999 100.650 89.217 1.00 0.00 O ATOM 94886 H1 WAT 1302 134.049 99.755 88.881 1.00 0.00 H ATOM 94887 H2 WAT 1302 134.024 100.550 90.169 1.00 0.00 H TER 94889 WAT 1302 ATOM 94889 O WAT 1303 42.754 85.462 128.231 1.00 0.00 O ATOM 94890 H1 WAT 1303 42.083 86.139 128.142 1.00 0.00 H ATOM 94891 H2 WAT 1303 42.263 84.641 128.271 1.00 0.00 H TER 94893 WAT 1303 ATOM 94893 O WAT 1304 62.218 3.812 144.444 1.00 0.00 O ATOM 94894 H1 WAT 1304 62.086 4.549 145.040 1.00 0.00 H ATOM 94895 H2 WAT 1304 61.490 3.872 143.825 1.00 0.00 H TER 94897 WAT 1304 ATOM 94897 O WAT 1305 141.270 106.093 132.055 1.00 0.00 O ATOM 94898 H1 WAT 1305 142.148 106.099 131.675 1.00 0.00 H ATOM 94899 H2 WAT 1305 140.740 105.605 131.425 1.00 0.00 H TER 94901 WAT 1305 ATOM 94901 O WAT 1306 116.874 31.165 96.824 1.00 0.00 O ATOM 94902 H1 WAT 1306 117.678 31.024 97.324 1.00 0.00 H ATOM 94903 H2 WAT 1306 117.129 31.768 96.125 1.00 0.00 H TER 94905 WAT 1306 ATOM 94905 O WAT 1307 48.050 117.477 104.208 1.00 0.00 O ATOM 94906 H1 WAT 1307 47.220 117.272 104.638 1.00 0.00 H ATOM 94907 H2 WAT 1307 48.257 116.692 103.700 1.00 0.00 H TER 94909 WAT 1307 ATOM 94909 O WAT 1308 131.756 135.651 130.457 1.00 0.00 O ATOM 94910 H1 WAT 1308 132.142 134.952 130.984 1.00 0.00 H ATOM 94911 H2 WAT 1308 131.989 135.429 129.556 1.00 0.00 H TER 94913 WAT 1308 ATOM 94913 O WAT 1309 117.525 133.759 76.685 1.00 0.00 O ATOM 94914 H1 WAT 1309 118.365 133.980 76.282 1.00 0.00 H ATOM 94915 H2 WAT 1309 117.760 133.286 77.484 1.00 0.00 H TER 94917 WAT 1309 ATOM 94917 O WAT 1310 64.156 42.689 16.075 1.00 0.00 O ATOM 94918 H1 WAT 1310 64.887 42.692 16.693 1.00 0.00 H ATOM 94919 H2 WAT 1310 64.566 42.557 15.220 1.00 0.00 H TER 94921 WAT 1310 ATOM 94921 O WAT 1311 110.105 118.969 98.266 1.00 0.00 O ATOM 94922 H1 WAT 1311 109.817 118.061 98.177 1.00 0.00 H ATOM 94923 H2 WAT 1311 109.575 119.320 98.982 1.00 0.00 H TER 94925 WAT 1311 ATOM 94925 O WAT 1312 50.789 129.578 59.685 1.00 0.00 O ATOM 94926 H1 WAT 1312 50.961 128.959 60.394 1.00 0.00 H ATOM 94927 H2 WAT 1312 51.528 130.186 59.712 1.00 0.00 H TER 94929 WAT 1312 ATOM 94929 O WAT 1313 26.035 118.491 62.700 1.00 0.00 O ATOM 94930 H1 WAT 1313 25.425 118.159 62.041 1.00 0.00 H ATOM 94931 H2 WAT 1313 26.553 119.149 62.236 1.00 0.00 H TER 94933 WAT 1313 ATOM 94933 O WAT 1314 25.361 83.369 152.666 1.00 0.00 O ATOM 94934 H1 WAT 1314 25.169 84.260 152.371 1.00 0.00 H ATOM 94935 H2 WAT 1314 24.965 82.806 152.001 1.00 0.00 H TER 94937 WAT 1314 ATOM 94937 O WAT 1315 27.905 80.097 121.597 1.00 0.00 O ATOM 94938 H1 WAT 1315 27.768 81.003 121.873 1.00 0.00 H ATOM 94939 H2 WAT 1315 28.856 79.997 121.564 1.00 0.00 H TER 94941 WAT 1315 ATOM 94941 O WAT 1316 16.397 138.982 155.154 1.00 0.00 O ATOM 94942 H1 WAT 1316 16.883 139.797 155.280 1.00 0.00 H ATOM 94943 H2 WAT 1316 17.046 138.367 154.810 1.00 0.00 H TER 94945 WAT 1316 ATOM 94945 O WAT 1317 45.472 2.677 130.061 1.00 0.00 O ATOM 94946 H1 WAT 1317 46.090 2.755 129.335 1.00 0.00 H ATOM 94947 H2 WAT 1317 44.985 3.501 130.051 1.00 0.00 H TER 94949 WAT 1317 ATOM 94949 O WAT 1318 90.655 144.713 86.878 1.00 0.00 O ATOM 94950 H1 WAT 1318 90.772 145.523 86.382 1.00 0.00 H ATOM 94951 H2 WAT 1318 90.056 144.190 86.344 1.00 0.00 H TER 94953 WAT 1318 ATOM 94953 O WAT 1319 5.632 63.924 98.639 1.00 0.00 O ATOM 94954 H1 WAT 1319 5.111 64.151 97.868 1.00 0.00 H ATOM 94955 H2 WAT 1319 6.481 63.661 98.284 1.00 0.00 H TER 94957 WAT 1319 ATOM 94957 O WAT 1320 25.961 29.676 88.759 1.00 0.00 O ATOM 94958 H1 WAT 1320 25.648 29.670 89.664 1.00 0.00 H ATOM 94959 H2 WAT 1320 26.453 28.860 88.671 1.00 0.00 H TER 94961 WAT 1320 ATOM 94961 O WAT 1321 81.336 142.319 115.567 1.00 0.00 O ATOM 94962 H1 WAT 1321 81.118 141.420 115.816 1.00 0.00 H ATOM 94963 H2 WAT 1321 80.649 142.570 114.950 1.00 0.00 H TER 94965 WAT 1321 ATOM 94965 O WAT 1322 57.179 130.974 148.465 1.00 0.00 O ATOM 94966 H1 WAT 1322 56.659 130.771 149.242 1.00 0.00 H ATOM 94967 H2 WAT 1322 56.557 131.379 147.860 1.00 0.00 H TER 94969 WAT 1322 ATOM 94969 O WAT 1323 88.647 88.517 87.571 1.00 0.00 O ATOM 94970 H1 WAT 1323 88.371 89.276 88.086 1.00 0.00 H ATOM 94971 H2 WAT 1323 88.144 88.584 86.759 1.00 0.00 H TER 94973 WAT 1323 ATOM 94973 O WAT 1324 96.149 27.695 142.322 1.00 0.00 O ATOM 94974 H1 WAT 1324 97.011 27.856 142.704 1.00 0.00 H ATOM 94975 H2 WAT 1324 95.640 27.307 143.034 1.00 0.00 H TER 94977 WAT 1324 ATOM 94977 O WAT 1325 8.803 82.679 75.619 1.00 0.00 O ATOM 94978 H1 WAT 1325 9.690 82.337 75.506 1.00 0.00 H ATOM 94979 H2 WAT 1325 8.257 82.112 75.074 1.00 0.00 H TER 94981 WAT 1325 ATOM 94981 O WAT 1326 125.643 52.918 53.095 1.00 0.00 O ATOM 94982 H1 WAT 1326 124.812 52.446 53.161 1.00 0.00 H ATOM 94983 H2 WAT 1326 125.406 53.768 52.725 1.00 0.00 H TER 94985 WAT 1326 ATOM 94985 O WAT 1327 139.634 97.530 105.103 1.00 0.00 O ATOM 94986 H1 WAT 1327 139.286 97.574 105.994 1.00 0.00 H ATOM 94987 H2 WAT 1327 139.244 98.282 104.656 1.00 0.00 H TER 94989 WAT 1327 ATOM 94989 O WAT 1328 48.157 90.974 22.157 1.00 0.00 O ATOM 94990 H1 WAT 1328 48.905 91.521 22.396 1.00 0.00 H ATOM 94991 H2 WAT 1328 47.933 91.249 21.268 1.00 0.00 H TER 94993 WAT 1328 ATOM 94993 O WAT 1329 63.841 144.529 97.692 1.00 0.00 O ATOM 94994 H1 WAT 1329 63.674 143.732 97.189 1.00 0.00 H ATOM 94995 H2 WAT 1329 63.204 144.501 98.405 1.00 0.00 H TER 94997 WAT 1329 ATOM 94997 O WAT 1330 129.207 64.680 23.505 1.00 0.00 O ATOM 94998 H1 WAT 1330 129.978 64.142 23.325 1.00 0.00 H ATOM 94999 H2 WAT 1330 128.556 64.062 23.838 1.00 0.00 H TER 95001 WAT 1330 ATOM 95001 O WAT 1331 99.833 94.618 85.173 1.00 0.00 O ATOM 95002 H1 WAT 1331 99.198 94.210 85.762 1.00 0.00 H ATOM 95003 H2 WAT 1331 99.493 95.502 85.030 1.00 0.00 H TER 95005 WAT 1331 ATOM 95005 O WAT 1332 116.183 107.244 154.702 1.00 0.00 O ATOM 95006 H1 WAT 1332 116.511 106.447 154.285 1.00 0.00 H ATOM 95007 H2 WAT 1332 116.296 107.925 154.040 1.00 0.00 H TER 95009 WAT 1332 ATOM 95009 O WAT 1333 23.308 93.796 114.931 1.00 0.00 O ATOM 95010 H1 WAT 1333 23.406 92.981 114.439 1.00 0.00 H ATOM 95011 H2 WAT 1333 23.920 94.402 114.513 1.00 0.00 H TER 95013 WAT 1333 ATOM 95013 O WAT 1334 96.625 8.175 69.011 1.00 0.00 O ATOM 95014 H1 WAT 1334 97.536 8.123 69.301 1.00 0.00 H ATOM 95015 H2 WAT 1334 96.678 8.189 68.056 1.00 0.00 H TER 95017 WAT 1334 ATOM 95017 O WAT 1335 52.190 29.810 153.861 1.00 0.00 O ATOM 95018 H1 WAT 1335 51.904 28.990 153.461 1.00 0.00 H ATOM 95019 H2 WAT 1335 51.905 30.488 153.249 1.00 0.00 H TER 95021 WAT 1335 ATOM 95021 O WAT 1336 13.866 33.439 73.922 1.00 0.00 O ATOM 95022 H1 WAT 1336 14.546 32.979 74.414 1.00 0.00 H ATOM 95023 H2 WAT 1336 13.892 34.335 74.259 1.00 0.00 H TER 95025 WAT 1336 ATOM 95025 O WAT 1337 9.030 74.397 145.238 1.00 0.00 O ATOM 95026 H1 WAT 1337 9.244 74.268 146.163 1.00 0.00 H ATOM 95027 H2 WAT 1337 8.385 73.717 145.045 1.00 0.00 H TER 95029 WAT 1337 ATOM 95029 O WAT 1338 61.684 90.778 129.555 1.00 0.00 O ATOM 95030 H1 WAT 1338 62.202 90.405 130.269 1.00 0.00 H ATOM 95031 H2 WAT 1338 60.822 90.933 129.940 1.00 0.00 H TER 95033 WAT 1338 ATOM 95033 O WAT 1339 22.673 31.190 85.234 1.00 0.00 O ATOM 95034 H1 WAT 1339 22.467 31.638 84.414 1.00 0.00 H ATOM 95035 H2 WAT 1339 21.852 30.770 85.490 1.00 0.00 H TER 95037 WAT 1339 ATOM 95037 O WAT 1340 23.030 51.025 52.994 1.00 0.00 O ATOM 95038 H1 WAT 1340 23.007 51.219 52.057 1.00 0.00 H ATOM 95039 H2 WAT 1340 23.958 50.902 53.190 1.00 0.00 H TER 95041 WAT 1340 ATOM 95041 O WAT 1341 92.010 49.724 77.891 1.00 0.00 O ATOM 95042 H1 WAT 1341 91.251 49.286 77.505 1.00 0.00 H ATOM 95043 H2 WAT 1341 92.745 49.459 77.338 1.00 0.00 H TER 95045 WAT 1341 ATOM 95045 O WAT 1342 54.839 38.326 143.354 1.00 0.00 O ATOM 95046 H1 WAT 1342 54.071 37.755 143.335 1.00 0.00 H ATOM 95047 H2 WAT 1342 54.795 38.816 142.533 1.00 0.00 H TER 95049 WAT 1342 ATOM 95049 O WAT 1343 71.283 86.441 20.126 1.00 0.00 O ATOM 95050 H1 WAT 1343 71.695 86.924 20.841 1.00 0.00 H ATOM 95051 H2 WAT 1343 70.812 87.107 19.626 1.00 0.00 H TER 95053 WAT 1343 ATOM 95053 O WAT 1344 53.842 4.865 81.642 1.00 0.00 O ATOM 95054 H1 WAT 1344 53.124 4.636 81.051 1.00 0.00 H ATOM 95055 H2 WAT 1344 53.431 5.397 82.323 1.00 0.00 H TER 95057 WAT 1344 ATOM 95057 O WAT 1345 80.206 93.033 133.790 1.00 0.00 O ATOM 95058 H1 WAT 1345 79.793 92.463 134.438 1.00 0.00 H ATOM 95059 H2 WAT 1345 81.135 93.025 134.021 1.00 0.00 H TER 95061 WAT 1345 ATOM 95061 O WAT 1346 31.843 67.368 2.014 1.00 0.00 O ATOM 95062 H1 WAT 1346 31.014 67.462 1.544 1.00 0.00 H ATOM 95063 H2 WAT 1346 32.492 67.217 1.327 1.00 0.00 H TER 95065 WAT 1346 ATOM 95065 O WAT 1347 72.420 69.876 99.189 1.00 0.00 O ATOM 95066 H1 WAT 1347 72.402 70.102 100.119 1.00 0.00 H ATOM 95067 H2 WAT 1347 71.627 69.357 99.054 1.00 0.00 H TER 95069 WAT 1347 ATOM 95069 O WAT 1348 109.385 47.488 19.303 1.00 0.00 O ATOM 95070 H1 WAT 1348 108.571 47.057 19.044 1.00 0.00 H ATOM 95071 H2 WAT 1348 109.121 48.379 19.535 1.00 0.00 H TER 95073 WAT 1348 ATOM 95073 O WAT 1349 38.567 29.367 73.157 1.00 0.00 O ATOM 95074 H1 WAT 1349 39.046 29.837 72.475 1.00 0.00 H ATOM 95075 H2 WAT 1349 38.316 30.046 73.784 1.00 0.00 H TER 95077 WAT 1349 ATOM 95077 O WAT 1350 136.558 42.067 155.756 1.00 0.00 O ATOM 95078 H1 WAT 1350 136.438 42.343 156.665 1.00 0.00 H ATOM 95079 H2 WAT 1350 137.239 42.648 155.417 1.00 0.00 H TER 95081 WAT 1350 ATOM 95081 O WAT 1351 81.392 44.838 114.253 1.00 0.00 O ATOM 95082 H1 WAT 1351 80.451 44.990 114.170 1.00 0.00 H ATOM 95083 H2 WAT 1351 81.461 44.038 114.775 1.00 0.00 H TER 95085 WAT 1351 ATOM 95085 O WAT 1352 25.475 83.383 145.846 1.00 0.00 O ATOM 95086 H1 WAT 1352 25.395 83.261 144.900 1.00 0.00 H ATOM 95087 H2 WAT 1352 26.415 83.321 146.016 1.00 0.00 H TER 95089 WAT 1352 ATOM 95089 O WAT 1353 141.307 31.789 115.867 1.00 0.00 O ATOM 95090 H1 WAT 1353 141.676 32.653 115.682 1.00 0.00 H ATOM 95091 H2 WAT 1353 141.446 31.665 116.806 1.00 0.00 H TER 95093 WAT 1353 ATOM 95093 O WAT 1354 18.174 1.236 6.456 1.00 0.00 O ATOM 95094 H1 WAT 1354 17.856 2.127 6.595 1.00 0.00 H ATOM 95095 H2 WAT 1354 18.923 1.337 5.869 1.00 0.00 H TER 95097 WAT 1354 ATOM 95097 O WAT 1355 102.390 115.048 83.775 1.00 0.00 O ATOM 95098 H1 WAT 1355 102.003 114.214 83.509 1.00 0.00 H ATOM 95099 H2 WAT 1355 102.617 115.480 82.952 1.00 0.00 H TER 95101 WAT 1355 ATOM 95101 O WAT 1356 7.271 39.577 14.305 1.00 0.00 O ATOM 95102 H1 WAT 1356 8.172 39.631 14.624 1.00 0.00 H ATOM 95103 H2 WAT 1356 6.732 39.732 15.081 1.00 0.00 H TER 95105 WAT 1356 ATOM 95105 O WAT 1357 134.989 78.369 115.233 1.00 0.00 O ATOM 95106 H1 WAT 1357 135.031 78.922 114.453 1.00 0.00 H ATOM 95107 H2 WAT 1357 135.232 77.497 114.923 1.00 0.00 H TER 95109 WAT 1357 ATOM 95109 O WAT 1358 51.781 94.291 19.263 1.00 0.00 O ATOM 95110 H1 WAT 1358 51.919 95.074 18.732 1.00 0.00 H ATOM 95111 H2 WAT 1358 50.897 94.394 19.616 1.00 0.00 H TER 95113 WAT 1358 ATOM 95113 O WAT 1359 115.705 84.896 157.355 1.00 0.00 O ATOM 95114 H1 WAT 1359 116.617 84.809 157.076 1.00 0.00 H ATOM 95115 H2 WAT 1359 115.330 85.536 156.751 1.00 0.00 H TER 95117 WAT 1359 ATOM 95117 O WAT 1360 1.169 111.478 11.358 1.00 0.00 O ATOM 95118 H1 WAT 1360 1.487 112.293 11.747 1.00 0.00 H ATOM 95119 H2 WAT 1360 1.163 111.649 10.416 1.00 0.00 H TER 95121 WAT 1360 ATOM 95121 O WAT 1361 8.073 115.777 80.527 1.00 0.00 O ATOM 95122 H1 WAT 1361 8.681 116.130 79.878 1.00 0.00 H ATOM 95123 H2 WAT 1361 7.230 115.747 80.074 1.00 0.00 H TER 95125 WAT 1361 ATOM 95125 O WAT 1362 101.675 95.052 16.765 1.00 0.00 O ATOM 95126 H1 WAT 1362 102.161 94.443 16.209 1.00 0.00 H ATOM 95127 H2 WAT 1362 100.856 95.205 16.294 1.00 0.00 H TER 95129 WAT 1362 ATOM 95129 O WAT 1363 10.963 139.091 94.341 1.00 0.00 O ATOM 95130 H1 WAT 1363 10.806 138.683 95.193 1.00 0.00 H ATOM 95131 H2 WAT 1363 11.438 139.896 94.545 1.00 0.00 H TER 95133 WAT 1363 ATOM 95133 O WAT 1364 27.482 70.681 88.369 1.00 0.00 O ATOM 95134 H1 WAT 1364 27.169 71.049 87.542 1.00 0.00 H ATOM 95135 H2 WAT 1364 26.751 70.798 88.975 1.00 0.00 H TER 95137 WAT 1364 ATOM 95137 O WAT 1365 57.269 23.775 62.919 1.00 0.00 O ATOM 95138 H1 WAT 1365 57.367 24.586 63.419 1.00 0.00 H ATOM 95139 H2 WAT 1365 58.137 23.373 62.943 1.00 0.00 H TER 95141 WAT 1365 ATOM 95141 O WAT 1366 60.636 15.090 112.583 1.00 0.00 O ATOM 95142 H1 WAT 1366 59.997 15.305 113.262 1.00 0.00 H ATOM 95143 H2 WAT 1366 60.564 15.806 111.951 1.00 0.00 H TER 95145 WAT 1366 ATOM 95145 O WAT 1367 81.903 86.605 147.456 1.00 0.00 O ATOM 95146 H1 WAT 1367 81.172 87.150 147.167 1.00 0.00 H ATOM 95147 H2 WAT 1367 81.591 85.707 147.346 1.00 0.00 H TER 95149 WAT 1367 ATOM 95149 O WAT 1368 11.183 124.739 80.072 1.00 0.00 O ATOM 95150 H1 WAT 1368 11.748 124.814 80.841 1.00 0.00 H ATOM 95151 H2 WAT 1368 11.167 125.621 79.700 1.00 0.00 H TER 95153 WAT 1368 ATOM 95153 O WAT 1369 45.854 66.328 69.203 1.00 0.00 O ATOM 95154 H1 WAT 1369 46.633 66.125 68.685 1.00 0.00 H ATOM 95155 H2 WAT 1369 45.207 66.616 68.558 1.00 0.00 H TER 95157 WAT 1369 ATOM 95157 O WAT 1370 116.195 92.225 97.335 1.00 0.00 O ATOM 95158 H1 WAT 1370 116.428 91.793 96.514 1.00 0.00 H ATOM 95159 H2 WAT 1370 116.483 91.616 98.016 1.00 0.00 H TER 95161 WAT 1370 ATOM 95161 O WAT 1371 85.828 111.408 68.689 1.00 0.00 O ATOM 95162 H1 WAT 1371 85.026 111.041 68.318 1.00 0.00 H ATOM 95163 H2 WAT 1371 86.477 111.317 67.991 1.00 0.00 H TER 95165 WAT 1371 ATOM 95165 O WAT 1372 92.563 41.483 151.104 1.00 0.00 O ATOM 95166 H1 WAT 1372 92.312 42.141 151.751 1.00 0.00 H ATOM 95167 H2 WAT 1372 93.186 40.920 151.564 1.00 0.00 H TER 95169 WAT 1372 ATOM 95169 O WAT 1373 91.633 0.371 105.355 1.00 0.00 O ATOM 95170 H1 WAT 1373 91.875 0.096 106.239 1.00 0.00 H ATOM 95171 H2 WAT 1373 92.354 0.066 104.803 1.00 0.00 H TER 95173 WAT 1373 ATOM 95173 O WAT 1374 107.242 7.201 148.578 1.00 0.00 O ATOM 95174 H1 WAT 1374 107.821 6.586 148.128 1.00 0.00 H ATOM 95175 H2 WAT 1374 107.089 6.803 149.435 1.00 0.00 H TER 95177 WAT 1374 ATOM 95177 O WAT 1375 108.069 105.349 20.157 1.00 0.00 O ATOM 95178 H1 WAT 1375 108.615 105.736 19.472 1.00 0.00 H ATOM 95179 H2 WAT 1375 108.423 105.701 20.973 1.00 0.00 H TER 95181 WAT 1375 ATOM 95181 O WAT 1376 48.874 91.482 3.427 1.00 0.00 O ATOM 95182 H1 WAT 1376 49.449 91.647 2.679 1.00 0.00 H ATOM 95183 H2 WAT 1376 48.306 92.251 3.467 1.00 0.00 H TER 95185 WAT 1376 ATOM 95185 O WAT 1377 48.027 73.723 120.529 1.00 0.00 O ATOM 95186 H1 WAT 1377 48.299 73.402 121.388 1.00 0.00 H ATOM 95187 H2 WAT 1377 47.902 72.931 120.006 1.00 0.00 H TER 95189 WAT 1377 ATOM 95189 O WAT 1378 33.611 2.554 158.289 1.00 0.00 O ATOM 95190 H1 WAT 1378 33.075 1.992 158.848 1.00 0.00 H ATOM 95191 H2 WAT 1378 33.026 2.814 157.578 1.00 0.00 H TER 95193 WAT 1378 ATOM 95193 O WAT 1379 10.633 29.050 7.749 1.00 0.00 O ATOM 95194 H1 WAT 1379 9.696 29.044 7.555 1.00 0.00 H ATOM 95195 H2 WAT 1379 11.022 28.499 7.070 1.00 0.00 H TER 95197 WAT 1379 ATOM 95197 O WAT 1380 26.456 21.166 156.016 1.00 0.00 O ATOM 95198 H1 WAT 1380 26.123 21.912 156.515 1.00 0.00 H ATOM 95199 H2 WAT 1380 25.746 20.945 155.413 1.00 0.00 H TER 95201 WAT 1380 ATOM 95201 O WAT 1381 74.133 85.299 80.787 1.00 0.00 O ATOM 95202 H1 WAT 1381 73.884 86.003 81.387 1.00 0.00 H ATOM 95203 H2 WAT 1381 75.085 85.369 80.719 1.00 0.00 H TER 95205 WAT 1381 ATOM 95205 O WAT 1382 106.695 58.577 123.403 1.00 0.00 O ATOM 95206 H1 WAT 1382 105.927 59.074 123.684 1.00 0.00 H ATOM 95207 H2 WAT 1382 107.347 58.739 124.085 1.00 0.00 H TER 95209 WAT 1382 ATOM 95209 O WAT 1383 118.925 3.089 55.560 1.00 0.00 O ATOM 95210 H1 WAT 1383 118.857 2.187 55.874 1.00 0.00 H ATOM 95211 H2 WAT 1383 118.204 3.180 54.937 1.00 0.00 H TER 95213 WAT 1383 ATOM 95213 O WAT 1384 63.252 17.257 72.384 1.00 0.00 O ATOM 95214 H1 WAT 1384 63.927 16.593 72.236 1.00 0.00 H ATOM 95215 H2 WAT 1384 62.429 16.768 72.369 1.00 0.00 H TER 95217 WAT 1384 ATOM 95217 O WAT 1385 124.657 87.471 116.072 1.00 0.00 O ATOM 95218 H1 WAT 1385 124.831 88.411 116.037 1.00 0.00 H ATOM 95219 H2 WAT 1385 124.663 87.260 117.006 1.00 0.00 H TER 95221 WAT 1385 ATOM 95221 O WAT 1386 24.356 25.208 74.208 1.00 0.00 O ATOM 95222 H1 WAT 1386 23.584 25.395 73.675 1.00 0.00 H ATOM 95223 H2 WAT 1386 24.216 24.316 74.527 1.00 0.00 H TER 95225 WAT 1386 ATOM 95225 O WAT 1387 31.439 64.127 114.540 1.00 0.00 O ATOM 95226 H1 WAT 1387 31.621 65.047 114.350 1.00 0.00 H ATOM 95227 H2 WAT 1387 32.250 63.798 114.929 1.00 0.00 H TER 95229 WAT 1387 ATOM 95229 O WAT 1388 141.194 17.486 84.370 1.00 0.00 O ATOM 95230 H1 WAT 1388 140.560 18.119 84.035 1.00 0.00 H ATOM 95231 H2 WAT 1388 141.917 18.021 84.697 1.00 0.00 H TER 95233 WAT 1388 ATOM 95233 O WAT 1389 123.547 74.054 10.878 1.00 0.00 O ATOM 95234 H1 WAT 1389 123.109 74.325 10.070 1.00 0.00 H ATOM 95235 H2 WAT 1389 124.476 74.214 10.712 1.00 0.00 H TER 95237 WAT 1389 ATOM 95237 O WAT 1390 24.017 96.155 85.843 1.00 0.00 O ATOM 95238 H1 WAT 1390 23.929 95.437 86.471 1.00 0.00 H ATOM 95239 H2 WAT 1390 23.814 95.759 84.996 1.00 0.00 H TER 95241 WAT 1390 ATOM 95241 O WAT 1391 19.083 142.322 140.989 1.00 0.00 O ATOM 95242 H1 WAT 1391 18.318 141.984 141.455 1.00 0.00 H ATOM 95243 H2 WAT 1391 18.744 143.050 140.469 1.00 0.00 H TER 95245 WAT 1391 ATOM 95245 O WAT 1392 142.676 59.166 81.917 1.00 0.00 O ATOM 95246 H1 WAT 1392 142.832 59.802 81.219 1.00 0.00 H ATOM 95247 H2 WAT 1392 141.992 58.593 81.570 1.00 0.00 H TER 95249 WAT 1392 ATOM 95249 O WAT 1393 20.057 103.693 7.807 1.00 0.00 O ATOM 95250 H1 WAT 1393 20.056 104.643 7.689 1.00 0.00 H ATOM 95251 H2 WAT 1393 19.805 103.345 6.952 1.00 0.00 H TER 95253 WAT 1393 ATOM 95253 O WAT 1394 88.968 118.295 86.812 1.00 0.00 O ATOM 95254 H1 WAT 1394 88.049 118.269 86.545 1.00 0.00 H ATOM 95255 H2 WAT 1394 89.394 118.838 86.149 1.00 0.00 H TER 95257 WAT 1394 ATOM 95257 O WAT 1395 136.053 58.597 54.682 1.00 0.00 O ATOM 95258 H1 WAT 1395 135.865 59.454 55.065 1.00 0.00 H ATOM 95259 H2 WAT 1395 135.422 58.510 53.968 1.00 0.00 H TER 95261 WAT 1395 ATOM 95261 O WAT 1396 127.616 112.984 115.116 1.00 0.00 O ATOM 95262 H1 WAT 1396 127.234 112.210 114.703 1.00 0.00 H ATOM 95263 H2 WAT 1396 127.858 113.551 114.383 1.00 0.00 H TER 95265 WAT 1396 ATOM 95265 O WAT 1397 61.603 137.942 13.696 1.00 0.00 O ATOM 95266 H1 WAT 1397 62.430 137.534 13.952 1.00 0.00 H ATOM 95267 H2 WAT 1397 60.933 137.429 14.147 1.00 0.00 H TER 95269 WAT 1397 ATOM 95269 O WAT 1398 71.117 55.347 144.135 1.00 0.00 O ATOM 95270 H1 WAT 1398 70.490 56.068 144.191 1.00 0.00 H ATOM 95271 H2 WAT 1398 71.030 55.022 143.239 1.00 0.00 H TER 95273 WAT 1398 ATOM 95273 O WAT 1399 127.118 99.900 154.569 1.00 0.00 O ATOM 95274 H1 WAT 1399 126.345 100.045 155.114 1.00 0.00 H ATOM 95275 H2 WAT 1399 127.567 99.162 154.980 1.00 0.00 H TER 95277 WAT 1399 ATOM 95277 O WAT 1400 140.051 73.928 152.971 1.00 0.00 O ATOM 95278 H1 WAT 1400 140.778 74.053 152.361 1.00 0.00 H ATOM 95279 H2 WAT 1400 139.385 73.468 152.459 1.00 0.00 H TER 95281 WAT 1400 ATOM 95281 O WAT 1401 63.294 14.599 8.320 1.00 0.00 O ATOM 95282 H1 WAT 1401 62.366 14.768 8.157 1.00 0.00 H ATOM 95283 H2 WAT 1401 63.740 15.386 8.006 1.00 0.00 H TER 95285 WAT 1401 ATOM 95285 O WAT 1402 73.304 124.494 131.081 1.00 0.00 O ATOM 95286 H1 WAT 1402 73.697 124.432 131.952 1.00 0.00 H ATOM 95287 H2 WAT 1402 73.662 125.302 130.714 1.00 0.00 H TER 95289 WAT 1402 ATOM 95289 O WAT 1403 45.084 124.581 104.885 1.00 0.00 O ATOM 95290 H1 WAT 1403 44.836 123.803 104.385 1.00 0.00 H ATOM 95291 H2 WAT 1403 44.256 124.919 105.227 1.00 0.00 H TER 95293 WAT 1403 ATOM 95293 O WAT 1404 119.557 91.751 126.337 1.00 0.00 O ATOM 95294 H1 WAT 1404 118.869 92.404 126.208 1.00 0.00 H ATOM 95295 H2 WAT 1404 120.216 92.198 126.868 1.00 0.00 H TER 95297 WAT 1404 ATOM 95297 O WAT 1405 107.354 63.851 1.751 1.00 0.00 O ATOM 95298 H1 WAT 1405 107.669 63.663 2.634 1.00 0.00 H ATOM 95299 H2 WAT 1405 107.960 63.385 1.175 1.00 0.00 H TER 95301 WAT 1405 ATOM 95301 O WAT 1406 10.490 65.438 102.108 1.00 0.00 O ATOM 95302 H1 WAT 1406 10.146 65.880 101.332 1.00 0.00 H ATOM 95303 H2 WAT 1406 11.336 65.087 101.828 1.00 0.00 H TER 95305 WAT 1406 ATOM 95305 O WAT 1407 114.422 112.918 94.151 1.00 0.00 O ATOM 95306 H1 WAT 1407 114.478 112.616 95.058 1.00 0.00 H ATOM 95307 H2 WAT 1407 113.636 112.495 93.806 1.00 0.00 H TER 95309 WAT 1407 ATOM 95309 O WAT 1408 56.774 41.900 132.247 1.00 0.00 O ATOM 95310 H1 WAT 1408 57.685 42.019 131.977 1.00 0.00 H ATOM 95311 H2 WAT 1408 56.261 42.182 131.491 1.00 0.00 H TER 95313 WAT 1408 ATOM 95313 O WAT 1409 140.364 137.974 0.024 1.00 0.00 O ATOM 95314 H1 WAT 1409 140.375 137.341 0.741 1.00 0.00 H ATOM 95315 H2 WAT 1409 139.882 137.534 -0.676 1.00 0.00 H TER 95317 WAT 1409 ATOM 95317 O WAT 1410 6.932 27.754 83.132 1.00 0.00 O ATOM 95318 H1 WAT 1410 7.573 27.258 82.623 1.00 0.00 H ATOM 95319 H2 WAT 1410 7.323 27.829 84.002 1.00 0.00 H TER 95321 WAT 1410 ATOM 95321 O WAT 1411 60.104 102.384 54.805 1.00 0.00 O ATOM 95322 H1 WAT 1411 60.122 102.278 53.853 1.00 0.00 H ATOM 95323 H2 WAT 1411 61.025 102.474 55.052 1.00 0.00 H TER 95325 WAT 1411 ATOM 95325 O WAT 1412 36.164 30.248 85.520 1.00 0.00 O ATOM 95326 H1 WAT 1412 36.718 29.734 84.933 1.00 0.00 H ATOM 95327 H2 WAT 1412 35.329 29.781 85.532 1.00 0.00 H TER 95329 WAT 1412 ATOM 95329 O WAT 1413 144.331 30.198 4.293 1.00 0.00 O ATOM 95330 H1 WAT 1413 145.178 30.586 4.071 1.00 0.00 H ATOM 95331 H2 WAT 1413 143.703 30.911 4.174 1.00 0.00 H TER 95333 WAT 1413 ATOM 95333 O WAT 1414 3.253 120.575 62.684 1.00 0.00 O ATOM 95334 H1 WAT 1414 3.824 120.012 63.206 1.00 0.00 H ATOM 95335 H2 WAT 1414 3.347 120.247 61.790 1.00 0.00 H TER 95337 WAT 1414 ATOM 95337 O WAT 1415 60.474 81.371 113.538 1.00 0.00 O ATOM 95338 H1 WAT 1415 60.463 81.322 112.582 1.00 0.00 H ATOM 95339 H2 WAT 1415 60.094 82.227 113.739 1.00 0.00 H TER 95341 WAT 1415 ATOM 95341 O WAT 1416 20.422 33.811 100.086 1.00 0.00 O ATOM 95342 H1 WAT 1416 20.209 34.481 100.736 1.00 0.00 H ATOM 95343 H2 WAT 1416 19.632 33.735 99.552 1.00 0.00 H TER 95345 WAT 1416 ATOM 95345 O WAT 1417 74.167 13.510 94.013 1.00 0.00 O ATOM 95346 H1 WAT 1417 74.216 14.290 94.566 1.00 0.00 H ATOM 95347 H2 WAT 1417 73.234 13.410 93.822 1.00 0.00 H TER 95349 WAT 1417 ATOM 95349 O WAT 1418 2.763 142.722 10.799 1.00 0.00 O ATOM 95350 H1 WAT 1418 3.039 142.102 10.123 1.00 0.00 H ATOM 95351 H2 WAT 1418 2.948 142.275 11.624 1.00 0.00 H TER 95353 WAT 1418 ATOM 95353 O WAT 1419 30.774 70.083 149.808 1.00 0.00 O ATOM 95354 H1 WAT 1419 30.505 69.437 149.155 1.00 0.00 H ATOM 95355 H2 WAT 1419 30.057 70.717 149.828 1.00 0.00 H TER 95357 WAT 1419 ATOM 95357 O WAT 1420 135.399 127.252 7.181 1.00 0.00 O ATOM 95358 H1 WAT 1420 134.780 126.524 7.112 1.00 0.00 H ATOM 95359 H2 WAT 1420 136.258 126.832 7.228 1.00 0.00 H TER 95361 WAT 1420 ATOM 95361 O WAT 1421 79.151 94.458 150.216 1.00 0.00 O ATOM 95362 H1 WAT 1421 80.009 94.855 150.065 1.00 0.00 H ATOM 95363 H2 WAT 1421 78.528 95.172 150.078 1.00 0.00 H TER 95365 WAT 1421 ATOM 95365 O WAT 1422 23.440 4.451 80.773 1.00 0.00 O ATOM 95366 H1 WAT 1422 22.901 3.756 80.398 1.00 0.00 H ATOM 95367 H2 WAT 1422 22.855 4.910 81.376 1.00 0.00 H TER 95369 WAT 1422 ATOM 95369 O WAT 1423 128.769 65.880 3.087 1.00 0.00 O ATOM 95370 H1 WAT 1423 128.052 65.926 3.718 1.00 0.00 H ATOM 95371 H2 WAT 1423 129.245 65.084 3.322 1.00 0.00 H TER 95373 WAT 1423 ATOM 95373 O WAT 1424 95.125 135.088 146.037 1.00 0.00 O ATOM 95374 H1 WAT 1424 94.270 135.336 145.684 1.00 0.00 H ATOM 95375 H2 WAT 1424 95.535 135.920 146.276 1.00 0.00 H TER 95377 WAT 1424 ATOM 95377 O WAT 1425 128.151 134.485 136.333 1.00 0.00 O ATOM 95378 H1 WAT 1425 128.924 134.136 136.777 1.00 0.00 H ATOM 95379 H2 WAT 1425 128.222 135.434 136.440 1.00 0.00 H TER 95381 WAT 1425 ATOM 95381 O WAT 1426 1.390 134.237 57.395 1.00 0.00 O ATOM 95382 H1 WAT 1426 1.961 134.143 58.157 1.00 0.00 H ATOM 95383 H2 WAT 1426 0.638 133.677 57.588 1.00 0.00 H TER 95385 WAT 1426 ATOM 95385 O WAT 1427 89.786 16.058 106.859 1.00 0.00 O ATOM 95386 H1 WAT 1427 90.325 16.226 106.087 1.00 0.00 H ATOM 95387 H2 WAT 1427 90.413 15.827 107.544 1.00 0.00 H TER 95389 WAT 1427 ATOM 95389 O WAT 1428 10.651 18.693 13.655 1.00 0.00 O ATOM 95390 H1 WAT 1428 11.117 18.014 13.166 1.00 0.00 H ATOM 95391 H2 WAT 1428 10.203 19.208 12.984 1.00 0.00 H TER 95393 WAT 1428 ATOM 95393 O WAT 1429 45.868 51.104 147.518 1.00 0.00 O ATOM 95394 H1 WAT 1429 46.481 50.999 146.790 1.00 0.00 H ATOM 95395 H2 WAT 1429 45.386 50.278 147.546 1.00 0.00 H TER 95397 WAT 1429 ATOM 95397 O WAT 1430 13.265 82.034 130.505 1.00 0.00 O ATOM 95398 H1 WAT 1430 12.841 81.811 131.334 1.00 0.00 H ATOM 95399 H2 WAT 1430 13.832 82.775 130.718 1.00 0.00 H TER 95401 WAT 1430 ATOM 95401 O WAT 1431 67.057 18.747 140.651 1.00 0.00 O ATOM 95402 H1 WAT 1431 67.827 18.198 140.502 1.00 0.00 H ATOM 95403 H2 WAT 1431 67.398 19.521 141.099 1.00 0.00 H TER 95405 WAT 1431 ATOM 95405 O WAT 1432 98.076 56.466 148.123 1.00 0.00 O ATOM 95406 H1 WAT 1432 98.375 55.559 148.190 1.00 0.00 H ATOM 95407 H2 WAT 1432 97.319 56.427 147.540 1.00 0.00 H TER 95409 WAT 1432 ATOM 95409 O WAT 1433 68.293 15.052 89.397 1.00 0.00 O ATOM 95410 H1 WAT 1433 68.196 15.914 88.991 1.00 0.00 H ATOM 95411 H2 WAT 1433 67.408 14.689 89.402 1.00 0.00 H TER 95413 WAT 1433 ATOM 95413 O WAT 1434 103.096 137.016 54.387 1.00 0.00 O ATOM 95414 H1 WAT 1434 102.846 137.167 55.299 1.00 0.00 H ATOM 95415 H2 WAT 1434 103.235 137.893 54.029 1.00 0.00 H TER 95417 WAT 1434 ATOM 95417 O WAT 1435 19.497 59.083 2.870 1.00 0.00 O ATOM 95418 H1 WAT 1435 18.595 59.049 2.551 1.00 0.00 H ATOM 95419 H2 WAT 1435 19.480 59.739 3.567 1.00 0.00 H TER 95421 WAT 1435 ATOM 95421 O WAT 1436 108.246 66.242 88.574 1.00 0.00 O ATOM 95422 H1 WAT 1436 107.411 66.709 88.581 1.00 0.00 H ATOM 95423 H2 WAT 1436 108.716 66.579 89.337 1.00 0.00 H TER 95425 WAT 1436 ATOM 95425 O WAT 1437 22.952 0.752 60.964 1.00 0.00 O ATOM 95426 H1 WAT 1437 22.378 -0.008 61.062 1.00 0.00 H ATOM 95427 H2 WAT 1437 22.367 1.506 61.043 1.00 0.00 H TER 95429 WAT 1437 ATOM 95429 O WAT 1438 105.542 7.647 64.561 1.00 0.00 O ATOM 95430 H1 WAT 1438 105.897 8.028 65.364 1.00 0.00 H ATOM 95431 H2 WAT 1438 105.638 8.336 63.905 1.00 0.00 H TER 95433 WAT 1438 ATOM 95433 O WAT 1439 81.078 31.940 19.526 1.00 0.00 O ATOM 95434 H1 WAT 1439 81.874 32.054 20.044 1.00 0.00 H ATOM 95435 H2 WAT 1439 80.729 32.826 19.424 1.00 0.00 H TER 95437 WAT 1439 ATOM 95437 O WAT 1440 43.579 86.377 102.855 1.00 0.00 O ATOM 95438 H1 WAT 1440 43.151 85.533 102.710 1.00 0.00 H ATOM 95439 H2 WAT 1440 44.461 86.261 102.502 1.00 0.00 H TER 95441 WAT 1440 ATOM 95441 O WAT 1441 120.167 44.186 19.153 1.00 0.00 O ATOM 95442 H1 WAT 1441 119.571 43.675 19.700 1.00 0.00 H ATOM 95443 H2 WAT 1441 121.041 43.918 19.437 1.00 0.00 H TER 95445 WAT 1441 ATOM 95445 O WAT 1442 100.271 138.522 13.878 1.00 0.00 O ATOM 95446 H1 WAT 1442 100.877 138.846 14.544 1.00 0.00 H ATOM 95447 H2 WAT 1442 100.079 137.623 14.147 1.00 0.00 H TER 95449 WAT 1442 ATOM 95449 O WAT 1443 92.292 55.066 147.274 1.00 0.00 O ATOM 95450 H1 WAT 1443 91.849 55.052 148.122 1.00 0.00 H ATOM 95451 H2 WAT 1443 92.241 54.162 146.963 1.00 0.00 H TER 95453 WAT 1443 ATOM 95453 O WAT 1444 98.735 42.212 11.476 1.00 0.00 O ATOM 95454 H1 WAT 1444 98.971 41.623 10.759 1.00 0.00 H ATOM 95455 H2 WAT 1444 98.383 41.634 12.153 1.00 0.00 H TER 95457 WAT 1444 ATOM 95457 O WAT 1445 106.581 27.214 110.281 1.00 0.00 O ATOM 95458 H1 WAT 1445 106.841 28.078 110.599 1.00 0.00 H ATOM 95459 H2 WAT 1445 107.395 26.710 110.262 1.00 0.00 H TER 95461 WAT 1445 ATOM 95461 O WAT 1446 64.727 94.746 0.133 1.00 0.00 O ATOM 95462 H1 WAT 1446 65.091 95.198 0.894 1.00 0.00 H ATOM 95463 H2 WAT 1446 65.489 94.369 -0.308 1.00 0.00 H TER 95465 WAT 1446 ATOM 95465 O WAT 1447 75.988 37.370 69.349 1.00 0.00 O ATOM 95466 H1 WAT 1447 76.284 36.705 69.971 1.00 0.00 H ATOM 95467 H2 WAT 1447 75.928 38.172 69.867 1.00 0.00 H TER 95469 WAT 1447 ATOM 95469 O WAT 1448 62.974 71.361 108.469 1.00 0.00 O ATOM 95470 H1 WAT 1448 62.875 72.214 108.047 1.00 0.00 H ATOM 95471 H2 WAT 1448 63.612 71.510 109.166 1.00 0.00 H TER 95473 WAT 1448 ATOM 95473 O WAT 1449 99.076 68.520 143.952 1.00 0.00 O ATOM 95474 H1 WAT 1449 99.571 67.708 144.058 1.00 0.00 H ATOM 95475 H2 WAT 1449 99.083 68.920 144.822 1.00 0.00 H TER 95477 WAT 1449 ATOM 95477 O WAT 1450 51.771 127.869 72.899 1.00 0.00 O ATOM 95478 H1 WAT 1450 51.309 127.084 73.196 1.00 0.00 H ATOM 95479 H2 WAT 1450 52.407 128.049 73.590 1.00 0.00 H TER 95481 WAT 1450 ATOM 95481 O WAT 1451 36.410 38.664 109.906 1.00 0.00 O ATOM 95482 H1 WAT 1451 36.524 37.716 109.836 1.00 0.00 H ATOM 95483 H2 WAT 1451 37.186 38.965 110.378 1.00 0.00 H TER 95485 WAT 1451 ATOM 95485 O WAT 1452 126.050 68.628 70.139 1.00 0.00 O ATOM 95486 H1 WAT 1452 126.005 69.093 69.304 1.00 0.00 H ATOM 95487 H2 WAT 1452 126.813 68.056 70.053 1.00 0.00 H TER 95489 WAT 1452 ATOM 95489 O WAT 1453 69.019 39.709 158.059 1.00 0.00 O ATOM 95490 H1 WAT 1453 69.624 40.278 158.535 1.00 0.00 H ATOM 95491 H2 WAT 1453 69.463 38.861 158.029 1.00 0.00 H TER 95493 WAT 1453 ATOM 95493 O WAT 1454 115.401 40.025 106.069 1.00 0.00 O ATOM 95494 H1 WAT 1454 114.662 40.622 105.951 1.00 0.00 H ATOM 95495 H2 WAT 1454 115.997 40.237 105.350 1.00 0.00 H TER 95497 WAT 1454 ATOM 95497 O WAT 1455 33.235 127.505 138.883 1.00 0.00 O ATOM 95498 H1 WAT 1455 33.654 127.349 139.730 1.00 0.00 H ATOM 95499 H2 WAT 1455 32.521 126.869 138.849 1.00 0.00 H TER 95501 WAT 1455 ATOM 95501 O WAT 1456 116.566 59.485 79.101 1.00 0.00 O ATOM 95502 H1 WAT 1456 115.813 59.306 78.537 1.00 0.00 H ATOM 95503 H2 WAT 1456 116.321 59.118 79.951 1.00 0.00 H TER 95505 WAT 1456 ATOM 95505 O WAT 1457 110.201 143.530 140.253 1.00 0.00 O ATOM 95506 H1 WAT 1457 111.105 143.217 140.227 1.00 0.00 H ATOM 95507 H2 WAT 1457 109.926 143.396 141.160 1.00 0.00 H TER 95509 WAT 1457 ATOM 95509 O WAT 1458 41.769 89.086 17.781 1.00 0.00 O ATOM 95510 H1 WAT 1458 41.807 90.011 18.027 1.00 0.00 H ATOM 95511 H2 WAT 1458 41.069 88.723 18.323 1.00 0.00 H TER 95513 WAT 1458 ATOM 95513 O WAT 1459 41.974 2.136 109.204 1.00 0.00 O ATOM 95514 H1 WAT 1459 41.367 1.887 108.507 1.00 0.00 H ATOM 95515 H2 WAT 1459 41.409 2.439 109.916 1.00 0.00 H TER 95517 WAT 1459 ATOM 95517 O WAT 1460 141.682 29.658 107.791 1.00 0.00 O ATOM 95518 H1 WAT 1460 141.198 30.455 107.575 1.00 0.00 H ATOM 95519 H2 WAT 1460 142.278 29.922 108.492 1.00 0.00 H TER 95521 WAT 1460 ATOM 95521 O WAT 1461 130.844 45.012 72.136 1.00 0.00 O ATOM 95522 H1 WAT 1461 130.430 45.686 72.676 1.00 0.00 H ATOM 95523 H2 WAT 1461 131.273 44.432 72.765 1.00 0.00 H TER 95525 WAT 1461 ATOM 95525 O WAT 1462 76.157 48.472 151.808 1.00 0.00 O ATOM 95526 H1 WAT 1462 76.135 47.992 152.636 1.00 0.00 H ATOM 95527 H2 WAT 1462 75.463 49.125 151.892 1.00 0.00 H TER 95529 WAT 1462 ATOM 95529 O WAT 1463 73.767 50.779 80.984 1.00 0.00 O ATOM 95530 H1 WAT 1463 73.944 50.630 80.055 1.00 0.00 H ATOM 95531 H2 WAT 1463 74.633 50.813 81.391 1.00 0.00 H TER 95533 WAT 1463 ATOM 95533 O WAT 1464 77.669 37.493 76.807 1.00 0.00 O ATOM 95534 H1 WAT 1464 77.954 38.304 76.386 1.00 0.00 H ATOM 95535 H2 WAT 1464 76.984 37.767 77.416 1.00 0.00 H TER 95537 WAT 1464 ATOM 95537 O WAT 1465 26.836 92.278 118.245 1.00 0.00 O ATOM 95538 H1 WAT 1465 27.478 92.901 117.902 1.00 0.00 H ATOM 95539 H2 WAT 1465 26.779 91.599 117.573 1.00 0.00 H TER 95541 WAT 1465 ATOM 95541 O WAT 1466 10.936 13.838 117.670 1.00 0.00 O ATOM 95542 H1 WAT 1466 10.705 14.680 118.063 1.00 0.00 H ATOM 95543 H2 WAT 1466 10.152 13.299 117.780 1.00 0.00 H TER 95545 WAT 1466 ATOM 95545 O WAT 1467 32.905 102.860 122.206 1.00 0.00 O ATOM 95546 H1 WAT 1467 33.389 103.340 121.535 1.00 0.00 H ATOM 95547 H2 WAT 1467 32.092 103.353 122.314 1.00 0.00 H TER 95549 WAT 1467 ATOM 95549 O WAT 1468 113.110 26.309 17.579 1.00 0.00 O ATOM 95550 H1 WAT 1468 112.515 25.562 17.639 1.00 0.00 H ATOM 95551 H2 WAT 1468 113.983 25.928 17.677 1.00 0.00 H TER 95553 WAT 1468 ATOM 95553 O WAT 1469 81.989 45.608 71.514 1.00 0.00 O ATOM 95554 H1 WAT 1469 81.553 46.458 71.578 1.00 0.00 H ATOM 95555 H2 WAT 1469 81.732 45.270 70.656 1.00 0.00 H TER 95557 WAT 1469 ATOM 95557 O WAT 1470 15.208 49.695 124.451 1.00 0.00 O ATOM 95558 H1 WAT 1470 15.991 50.188 124.206 1.00 0.00 H ATOM 95559 H2 WAT 1470 15.281 49.586 125.399 1.00 0.00 H TER 95561 WAT 1470 ATOM 95561 O WAT 1471 134.302 77.506 102.131 1.00 0.00 O ATOM 95562 H1 WAT 1471 133.443 77.085 102.147 1.00 0.00 H ATOM 95563 H2 WAT 1471 134.267 78.091 101.374 1.00 0.00 H TER 95565 WAT 1471 ATOM 95565 O WAT 1472 91.660 64.099 5.711 1.00 0.00 O ATOM 95566 H1 WAT 1472 92.531 64.366 6.002 1.00 0.00 H ATOM 95567 H2 WAT 1472 91.235 64.915 5.445 1.00 0.00 H TER 95569 WAT 1472 ATOM 95569 O WAT 1473 35.705 82.782 72.820 1.00 0.00 O ATOM 95570 H1 WAT 1473 36.585 82.425 72.944 1.00 0.00 H ATOM 95571 H2 WAT 1473 35.313 82.762 73.692 1.00 0.00 H TER 95573 WAT 1473 ATOM 95573 O WAT 1474 121.924 42.828 1.490 1.00 0.00 O ATOM 95574 H1 WAT 1474 122.832 42.877 1.788 1.00 0.00 H ATOM 95575 H2 WAT 1474 121.919 43.304 0.660 1.00 0.00 H TER 95577 WAT 1474 ATOM 95577 O WAT 1475 78.982 111.621 145.023 1.00 0.00 O ATOM 95578 H1 WAT 1475 78.207 112.022 144.628 1.00 0.00 H ATOM 95579 H2 WAT 1475 79.643 112.313 145.009 1.00 0.00 H TER 95581 WAT 1475 ATOM 95581 O WAT 1476 29.009 56.154 58.601 1.00 0.00 O ATOM 95582 H1 WAT 1476 29.706 55.609 58.967 1.00 0.00 H ATOM 95583 H2 WAT 1476 29.311 57.052 58.736 1.00 0.00 H TER 95585 WAT 1476 ATOM 95585 O WAT 1477 20.650 130.065 72.736 1.00 0.00 O ATOM 95586 H1 WAT 1477 20.536 129.385 72.071 1.00 0.00 H ATOM 95587 H2 WAT 1477 19.906 129.950 73.326 1.00 0.00 H TER 95589 WAT 1477 ATOM 95589 O WAT 1478 61.995 35.448 104.882 1.00 0.00 O ATOM 95590 H1 WAT 1478 61.985 34.907 104.093 1.00 0.00 H ATOM 95591 H2 WAT 1478 62.040 34.820 105.603 1.00 0.00 H TER 95593 WAT 1478 ATOM 95593 O WAT 1479 49.088 44.211 14.329 1.00 0.00 O ATOM 95594 H1 WAT 1479 49.937 44.434 13.946 1.00 0.00 H ATOM 95595 H2 WAT 1479 48.749 43.513 13.769 1.00 0.00 H TER 95597 WAT 1479 ATOM 95597 O WAT 1480 4.177 144.471 149.800 1.00 0.00 O ATOM 95598 H1 WAT 1480 3.264 144.273 150.010 1.00 0.00 H ATOM 95599 H2 WAT 1480 4.228 144.387 148.848 1.00 0.00 H TER 95601 WAT 1480 ATOM 95601 O WAT 1481 108.416 75.825 127.023 1.00 0.00 O ATOM 95602 H1 WAT 1481 108.721 74.920 127.081 1.00 0.00 H ATOM 95603 H2 WAT 1481 108.213 76.067 127.927 1.00 0.00 H TER 95605 WAT 1481 ATOM 95605 O WAT 1482 72.371 109.184 8.393 1.00 0.00 O ATOM 95606 H1 WAT 1482 72.540 110.098 8.166 1.00 0.00 H ATOM 95607 H2 WAT 1482 71.417 109.105 8.376 1.00 0.00 H TER 95609 WAT 1482 ATOM 95609 O WAT 1483 77.812 37.096 125.372 1.00 0.00 O ATOM 95610 H1 WAT 1483 78.348 36.812 126.113 1.00 0.00 H ATOM 95611 H2 WAT 1483 76.910 36.990 125.674 1.00 0.00 H TER 95613 WAT 1483 ATOM 95613 O WAT 1484 72.083 60.852 5.730 1.00 0.00 O ATOM 95614 H1 WAT 1484 72.581 61.517 5.255 1.00 0.00 H ATOM 95615 H2 WAT 1484 71.428 60.549 5.101 1.00 0.00 H TER 95617 WAT 1484 ATOM 95617 O WAT 1485 11.146 33.481 16.985 1.00 0.00 O ATOM 95618 H1 WAT 1485 11.699 33.126 17.680 1.00 0.00 H ATOM 95619 H2 WAT 1485 10.282 33.571 17.388 1.00 0.00 H TER 95621 WAT 1485 ATOM 95621 O WAT 1486 112.250 66.905 107.940 1.00 0.00 O ATOM 95622 H1 WAT 1486 112.184 67.854 107.828 1.00 0.00 H ATOM 95623 H2 WAT 1486 112.257 66.559 107.047 1.00 0.00 H TER 95625 WAT 1486 ATOM 95625 O WAT 1487 55.899 62.486 98.910 1.00 0.00 O ATOM 95626 H1 WAT 1487 55.351 63.102 99.396 1.00 0.00 H ATOM 95627 H2 WAT 1487 56.792 62.690 99.189 1.00 0.00 H TER 95629 WAT 1487 ATOM 95629 O WAT 1488 138.525 38.794 154.255 1.00 0.00 O ATOM 95630 H1 WAT 1488 139.216 39.442 154.387 1.00 0.00 H ATOM 95631 H2 WAT 1488 138.992 37.984 154.049 1.00 0.00 H TER 95633 WAT 1488 ATOM 95633 O WAT 1489 51.097 85.175 6.763 1.00 0.00 O ATOM 95634 H1 WAT 1489 50.998 84.225 6.824 1.00 0.00 H ATOM 95635 H2 WAT 1489 50.377 85.525 7.287 1.00 0.00 H TER 95637 WAT 1489 ATOM 95637 O WAT 1490 139.234 69.109 88.369 1.00 0.00 O ATOM 95638 H1 WAT 1490 138.914 68.398 88.925 1.00 0.00 H ATOM 95639 H2 WAT 1490 139.429 69.820 88.978 1.00 0.00 H TER 95641 WAT 1490 ATOM 95641 O WAT 1491 119.634 98.703 7.472 1.00 0.00 O ATOM 95642 H1 WAT 1491 119.732 97.842 7.878 1.00 0.00 H ATOM 95643 H2 WAT 1491 120.427 99.177 7.724 1.00 0.00 H TER 95645 WAT 1491 ATOM 95645 O WAT 1492 138.634 109.016 135.578 1.00 0.00 O ATOM 95646 H1 WAT 1492 138.983 109.886 135.385 1.00 0.00 H ATOM 95647 H2 WAT 1492 137.745 109.030 135.224 1.00 0.00 H TER 95649 WAT 1492 ATOM 95649 O WAT 1493 43.205 19.817 98.422 1.00 0.00 O ATOM 95650 H1 WAT 1493 43.442 20.066 99.316 1.00 0.00 H ATOM 95651 H2 WAT 1493 44.011 19.935 97.920 1.00 0.00 H TER 95653 WAT 1493 ATOM 95653 O WAT 1494 139.996 91.375 141.797 1.00 0.00 O ATOM 95654 H1 WAT 1494 140.523 91.667 141.052 1.00 0.00 H ATOM 95655 H2 WAT 1494 140.117 92.056 142.458 1.00 0.00 H TER 95657 WAT 1494 ATOM 95657 O WAT 1495 91.178 95.747 147.664 1.00 0.00 O ATOM 95658 H1 WAT 1495 91.840 95.120 147.959 1.00 0.00 H ATOM 95659 H2 WAT 1495 90.788 95.338 146.892 1.00 0.00 H TER 95661 WAT 1495 ATOM 95661 O WAT 1496 0.595 61.471 62.998 1.00 0.00 O ATOM 95662 H1 WAT 1496 1.146 61.266 63.754 1.00 0.00 H ATOM 95663 H2 WAT 1496 1.147 62.020 62.441 1.00 0.00 H TER 95665 WAT 1496 ATOM 95665 O WAT 1497 21.738 16.807 123.316 1.00 0.00 O ATOM 95666 H1 WAT 1497 21.685 16.271 122.525 1.00 0.00 H ATOM 95667 H2 WAT 1497 22.654 16.743 123.588 1.00 0.00 H TER 95669 WAT 1497 ATOM 95669 O WAT 1498 20.124 129.307 109.877 1.00 0.00 O ATOM 95670 H1 WAT 1498 20.677 129.501 110.635 1.00 0.00 H ATOM 95671 H2 WAT 1498 20.167 128.355 109.787 1.00 0.00 H TER 95673 WAT 1498 ATOM 95673 O WAT 1499 56.521 145.514 101.600 1.00 0.00 O ATOM 95674 H1 WAT 1499 57.348 145.601 102.073 1.00 0.00 H ATOM 95675 H2 WAT 1499 56.425 144.572 101.458 1.00 0.00 H TER 95677 WAT 1499 ATOM 95677 O WAT 1500 91.941 80.453 9.269 1.00 0.00 O ATOM 95678 H1 WAT 1500 92.139 79.525 9.144 1.00 0.00 H ATOM 95679 H2 WAT 1500 92.534 80.908 8.670 1.00 0.00 H TER 95681 WAT 1500 ATOM 95681 O WAT 1501 118.065 78.654 76.549 1.00 0.00 O ATOM 95682 H1 WAT 1501 118.935 78.262 76.623 1.00 0.00 H ATOM 95683 H2 WAT 1501 117.526 77.969 76.154 1.00 0.00 H TER 95685 WAT 1501 ATOM 95685 O WAT 1502 116.682 25.743 113.710 1.00 0.00 O ATOM 95686 H1 WAT 1502 115.828 25.761 113.277 1.00 0.00 H ATOM 95687 H2 WAT 1502 116.639 26.450 114.353 1.00 0.00 H TER 95689 WAT 1502 ATOM 95689 O WAT 1503 32.465 67.432 141.394 1.00 0.00 O ATOM 95690 H1 WAT 1503 33.043 67.588 140.647 1.00 0.00 H ATOM 95691 H2 WAT 1503 31.705 67.991 141.230 1.00 0.00 H TER 95693 WAT 1503 ATOM 95693 O WAT 1504 9.851 21.261 131.824 1.00 0.00 O ATOM 95694 H1 WAT 1504 9.293 20.676 131.312 1.00 0.00 H ATOM 95695 H2 WAT 1504 10.432 21.665 131.178 1.00 0.00 H TER 95697 WAT 1504 ATOM 95697 O WAT 1505 129.141 142.407 72.295 1.00 0.00 O ATOM 95698 H1 WAT 1505 129.129 142.122 71.381 1.00 0.00 H ATOM 95699 H2 WAT 1505 129.147 141.593 72.799 1.00 0.00 H TER 95701 WAT 1505 ATOM 95701 O WAT 1506 101.502 68.651 123.589 1.00 0.00 O ATOM 95702 H1 WAT 1506 101.336 67.805 123.174 1.00 0.00 H ATOM 95703 H2 WAT 1506 101.307 69.295 122.908 1.00 0.00 H TER 95705 WAT 1506 ATOM 95705 O WAT 1507 21.683 71.045 15.551 1.00 0.00 O ATOM 95706 H1 WAT 1507 21.835 71.198 14.619 1.00 0.00 H ATOM 95707 H2 WAT 1507 20.855 70.566 15.584 1.00 0.00 H TER 95709 WAT 1507 ATOM 95709 O WAT 1508 96.668 63.626 6.686 1.00 0.00 O ATOM 95710 H1 WAT 1508 97.204 63.399 5.926 1.00 0.00 H ATOM 95711 H2 WAT 1508 96.655 64.583 6.692 1.00 0.00 H TER 95713 WAT 1508 ATOM 95713 O WAT 1509 3.065 92.156 117.790 1.00 0.00 O ATOM 95714 H1 WAT 1509 3.986 92.017 117.568 1.00 0.00 H ATOM 95715 H2 WAT 1509 2.706 91.274 117.883 1.00 0.00 H TER 95717 WAT 1509 ATOM 95717 O WAT 1510 113.150 17.120 149.048 1.00 0.00 O ATOM 95718 H1 WAT 1510 113.327 17.056 148.110 1.00 0.00 H ATOM 95719 H2 WAT 1510 113.943 17.511 149.415 1.00 0.00 H TER 95721 WAT 1510 ATOM 95721 O WAT 1511 94.848 134.051 157.755 1.00 0.00 O ATOM 95722 H1 WAT 1511 95.702 134.473 157.661 1.00 0.00 H ATOM 95723 H2 WAT 1511 94.964 133.435 158.478 1.00 0.00 H TER 95725 WAT 1511 ATOM 95725 O WAT 1512 67.824 136.691 103.796 1.00 0.00 O ATOM 95726 H1 WAT 1512 68.528 137.158 104.247 1.00 0.00 H ATOM 95727 H2 WAT 1512 68.265 136.213 103.094 1.00 0.00 H TER 95729 WAT 1512 ATOM 95729 O WAT 1513 111.178 94.496 1.828 1.00 0.00 O ATOM 95730 H1 WAT 1513 111.576 93.646 1.641 1.00 0.00 H ATOM 95731 H2 WAT 1513 111.807 95.134 1.490 1.00 0.00 H TER 95733 WAT 1513 ATOM 95733 O WAT 1514 75.715 129.030 155.425 1.00 0.00 O ATOM 95734 H1 WAT 1514 74.835 128.718 155.215 1.00 0.00 H ATOM 95735 H2 WAT 1514 75.680 129.238 156.358 1.00 0.00 H TER 95737 WAT 1514 ATOM 95737 O WAT 1515 142.487 8.231 151.764 1.00 0.00 O ATOM 95738 H1 WAT 1515 141.868 7.566 151.464 1.00 0.00 H ATOM 95739 H2 WAT 1515 142.271 8.360 152.688 1.00 0.00 H TER 95741 WAT 1515 ATOM 95741 O WAT 1516 145.933 144.644 65.517 1.00 0.00 O ATOM 95742 H1 WAT 1516 145.027 144.661 65.208 1.00 0.00 H ATOM 95743 H2 WAT 1516 146.308 143.860 65.115 1.00 0.00 H TER 95745 WAT 1516 ATOM 95745 O WAT 1517 125.907 35.314 153.262 1.00 0.00 O ATOM 95746 H1 WAT 1517 125.038 34.971 153.472 1.00 0.00 H ATOM 95747 H2 WAT 1517 125.744 36.205 152.952 1.00 0.00 H TER 95749 WAT 1517 ATOM 95749 O WAT 1518 20.937 130.008 151.637 1.00 0.00 O ATOM 95750 H1 WAT 1518 20.644 130.053 150.727 1.00 0.00 H ATOM 95751 H2 WAT 1518 20.298 129.442 152.068 1.00 0.00 H TER 95753 WAT 1518 ATOM 95753 O WAT 1519 98.934 124.844 88.786 1.00 0.00 O ATOM 95754 H1 WAT 1519 99.794 124.769 88.373 1.00 0.00 H ATOM 95755 H2 WAT 1519 98.567 123.961 88.737 1.00 0.00 H TER 95757 WAT 1519 ATOM 95757 O WAT 1520 88.161 43.116 17.609 1.00 0.00 O ATOM 95758 H1 WAT 1520 87.808 43.964 17.878 1.00 0.00 H ATOM 95759 H2 WAT 1520 87.671 42.477 18.127 1.00 0.00 H TER 95761 WAT 1520 ATOM 95761 O WAT 1521 1.203 145.513 108.752 1.00 0.00 O ATOM 95762 H1 WAT 1521 0.981 145.677 109.668 1.00 0.00 H ATOM 95763 H2 WAT 1521 1.879 146.160 108.550 1.00 0.00 H TER 95765 WAT 1521 ATOM 95765 O WAT 1522 91.335 132.196 75.198 1.00 0.00 O ATOM 95766 H1 WAT 1522 91.485 132.261 76.141 1.00 0.00 H ATOM 95767 H2 WAT 1522 91.914 131.490 74.912 1.00 0.00 H TER 95769 WAT 1522 ATOM 95769 O WAT 1523 67.445 96.286 140.894 1.00 0.00 O ATOM 95770 H1 WAT 1523 66.919 97.052 141.121 1.00 0.00 H ATOM 95771 H2 WAT 1523 67.237 95.643 141.572 1.00 0.00 H TER 95773 WAT 1523 ATOM 95773 O WAT 1524 84.860 56.486 18.403 1.00 0.00 O ATOM 95774 H1 WAT 1524 83.968 56.183 18.574 1.00 0.00 H ATOM 95775 H2 WAT 1524 84.831 57.427 18.574 1.00 0.00 H TER 95777 WAT 1524 ATOM 95777 O WAT 1525 102.803 53.321 145.938 1.00 0.00 O ATOM 95778 H1 WAT 1525 102.766 52.368 145.859 1.00 0.00 H ATOM 95779 H2 WAT 1525 103.659 53.558 145.581 1.00 0.00 H TER 95781 WAT 1525 ATOM 95781 O WAT 1526 135.432 7.874 106.978 1.00 0.00 O ATOM 95782 H1 WAT 1526 135.501 8.701 106.501 1.00 0.00 H ATOM 95783 H2 WAT 1526 136.290 7.759 107.385 1.00 0.00 H TER 95785 WAT 1526 ATOM 95785 O WAT 1527 1.313 31.143 148.716 1.00 0.00 O ATOM 95786 H1 WAT 1527 1.132 32.034 148.417 1.00 0.00 H ATOM 95787 H2 WAT 1527 1.783 31.257 149.541 1.00 0.00 H TER 95789 WAT 1527 ATOM 95789 O WAT 1528 134.635 119.952 23.398 1.00 0.00 O ATOM 95790 H1 WAT 1528 134.103 120.746 23.354 1.00 0.00 H ATOM 95791 H2 WAT 1528 134.897 119.789 22.492 1.00 0.00 H TER 95793 WAT 1528 ATOM 95793 O WAT 1529 80.732 48.281 58.741 1.00 0.00 O ATOM 95794 H1 WAT 1529 80.656 48.485 59.673 1.00 0.00 H ATOM 95795 H2 WAT 1529 80.905 47.340 58.716 1.00 0.00 H TER 95797 WAT 1529 ATOM 95797 O WAT 1530 38.872 138.252 90.158 1.00 0.00 O ATOM 95798 H1 WAT 1530 38.509 137.608 89.550 1.00 0.00 H ATOM 95799 H2 WAT 1530 38.868 139.074 89.667 1.00 0.00 H TER 95801 WAT 1530 ATOM 95801 O WAT 1531 84.102 23.502 2.957 1.00 0.00 O ATOM 95802 H1 WAT 1531 83.437 23.716 2.303 1.00 0.00 H ATOM 95803 H2 WAT 1531 83.936 22.585 3.176 1.00 0.00 H TER 95805 WAT 1531 ATOM 95805 O WAT 1532 127.583 123.159 82.884 1.00 0.00 O ATOM 95806 H1 WAT 1532 127.436 123.874 83.503 1.00 0.00 H ATOM 95807 H2 WAT 1532 127.330 123.522 82.035 1.00 0.00 H TER 95809 WAT 1532 ATOM 95809 O WAT 1533 116.609 41.524 126.614 1.00 0.00 O ATOM 95810 H1 WAT 1533 115.976 42.227 126.757 1.00 0.00 H ATOM 95811 H2 WAT 1533 116.081 40.725 126.600 1.00 0.00 H TER 95813 WAT 1533 ATOM 95813 O WAT 1534 124.685 117.092 0.433 1.00 0.00 O ATOM 95814 H1 WAT 1534 124.675 116.749 -0.461 1.00 0.00 H ATOM 95815 H2 WAT 1534 125.613 117.129 0.665 1.00 0.00 H TER 95817 WAT 1534 ATOM 95817 O WAT 1535 122.168 20.994 3.921 1.00 0.00 O ATOM 95818 H1 WAT 1535 121.914 21.834 4.302 1.00 0.00 H ATOM 95819 H2 WAT 1535 123.109 20.931 4.085 1.00 0.00 H TER 95821 WAT 1535 ATOM 95821 O WAT 1536 67.229 53.648 128.475 1.00 0.00 O ATOM 95822 H1 WAT 1536 68.170 53.613 128.645 1.00 0.00 H ATOM 95823 H2 WAT 1536 67.121 54.389 127.879 1.00 0.00 H TER 95825 WAT 1536 ATOM 95825 O WAT 1537 2.783 112.287 146.443 1.00 0.00 O ATOM 95826 H1 WAT 1537 2.533 113.160 146.746 1.00 0.00 H ATOM 95827 H2 WAT 1537 1.963 111.891 146.149 1.00 0.00 H TER 95829 WAT 1537 ATOM 95829 O WAT 1538 44.198 88.970 131.385 1.00 0.00 O ATOM 95830 H1 WAT 1538 45.102 88.691 131.532 1.00 0.00 H ATOM 95831 H2 WAT 1538 44.185 89.269 130.476 1.00 0.00 H TER 95833 WAT 1538 ATOM 95833 O WAT 1539 113.251 95.329 18.110 1.00 0.00 O ATOM 95834 H1 WAT 1539 113.731 94.720 17.549 1.00 0.00 H ATOM 95835 H2 WAT 1539 113.748 95.344 18.928 1.00 0.00 H TER 95837 WAT 1539 ATOM 95837 O WAT 1540 71.090 97.337 21.898 1.00 0.00 O ATOM 95838 H1 WAT 1540 71.699 97.820 21.340 1.00 0.00 H ATOM 95839 H2 WAT 1540 71.433 97.454 22.784 1.00 0.00 H TER 95841 WAT 1540 ATOM 95841 O WAT 1541 46.381 15.881 102.728 1.00 0.00 O ATOM 95842 H1 WAT 1541 45.490 15.885 102.376 1.00 0.00 H ATOM 95843 H2 WAT 1541 46.288 15.524 103.611 1.00 0.00 H TER 95845 WAT 1541 ATOM 95845 O WAT 1542 44.899 86.787 116.729 1.00 0.00 O ATOM 95846 H1 WAT 1542 43.950 86.751 116.847 1.00 0.00 H ATOM 95847 H2 WAT 1542 45.256 86.449 117.550 1.00 0.00 H TER 95849 WAT 1542 ATOM 95849 O WAT 1543 74.756 98.327 70.707 1.00 0.00 O ATOM 95850 H1 WAT 1543 73.918 97.887 70.568 1.00 0.00 H ATOM 95851 H2 WAT 1543 74.828 98.941 69.976 1.00 0.00 H TER 95853 WAT 1543 ATOM 95853 O WAT 1544 3.366 55.803 126.283 1.00 0.00 O ATOM 95854 H1 WAT 1544 3.859 56.580 126.017 1.00 0.00 H ATOM 95855 H2 WAT 1544 3.915 55.387 126.948 1.00 0.00 H TER 95857 WAT 1544 ATOM 95857 O WAT 1545 109.509 69.841 124.001 1.00 0.00 O ATOM 95858 H1 WAT 1545 109.496 69.077 123.426 1.00 0.00 H ATOM 95859 H2 WAT 1545 108.586 70.071 124.116 1.00 0.00 H TER 95861 WAT 1545 ATOM 95861 O WAT 1546 38.254 69.785 135.870 1.00 0.00 O ATOM 95862 H1 WAT 1546 37.467 70.250 135.584 1.00 0.00 H ATOM 95863 H2 WAT 1546 38.702 70.405 136.446 1.00 0.00 H TER 95865 WAT 1546 ATOM 95865 O WAT 1547 30.025 19.474 10.828 1.00 0.00 O ATOM 95866 H1 WAT 1547 30.331 20.313 11.173 1.00 0.00 H ATOM 95867 H2 WAT 1547 29.864 19.640 9.900 1.00 0.00 H TER 95869 WAT 1547 ATOM 95869 O WAT 1548 2.120 35.487 77.424 1.00 0.00 O ATOM 95870 H1 WAT 1548 2.660 35.375 76.642 1.00 0.00 H ATOM 95871 H2 WAT 1548 2.585 36.142 77.945 1.00 0.00 H TER 95873 WAT 1548 ATOM 95873 O WAT 1549 116.344 34.804 96.668 1.00 0.00 O ATOM 95874 H1 WAT 1549 116.877 35.517 96.317 1.00 0.00 H ATOM 95875 H2 WAT 1549 116.410 34.110 96.012 1.00 0.00 H TER 95877 WAT 1549 ATOM 95877 O WAT 1550 120.598 17.110 102.899 1.00 0.00 O ATOM 95878 H1 WAT 1550 120.359 17.088 103.826 1.00 0.00 H ATOM 95879 H2 WAT 1550 121.087 16.299 102.759 1.00 0.00 H TER 95881 WAT 1550 ATOM 95881 O WAT 1551 129.758 49.558 97.929 1.00 0.00 O ATOM 95882 H1 WAT 1551 129.922 49.853 98.825 1.00 0.00 H ATOM 95883 H2 WAT 1551 129.732 50.364 97.413 1.00 0.00 H TER 95885 WAT 1551 ATOM 95885 O WAT 1552 130.897 48.119 83.887 1.00 0.00 O ATOM 95886 H1 WAT 1552 131.075 49.053 83.996 1.00 0.00 H ATOM 95887 H2 WAT 1552 130.037 47.991 84.289 1.00 0.00 H TER 95889 WAT 1552 ATOM 95889 O WAT 1553 130.670 92.715 10.843 1.00 0.00 O ATOM 95890 H1 WAT 1553 130.619 93.442 10.222 1.00 0.00 H ATOM 95891 H2 WAT 1553 130.763 91.937 10.294 1.00 0.00 H TER 95893 WAT 1553 ATOM 95893 O WAT 1554 62.039 46.035 124.451 1.00 0.00 O ATOM 95894 H1 WAT 1554 62.382 45.762 125.301 1.00 0.00 H ATOM 95895 H2 WAT 1554 62.584 45.575 123.813 1.00 0.00 H TER 95897 WAT 1554 ATOM 95897 O WAT 1555 40.766 133.121 99.363 1.00 0.00 O ATOM 95898 H1 WAT 1555 40.827 132.494 98.642 1.00 0.00 H ATOM 95899 H2 WAT 1555 41.675 133.287 99.613 1.00 0.00 H TER 95901 WAT 1555 ATOM 95901 O WAT 1556 11.323 30.135 12.084 1.00 0.00 O ATOM 95902 H1 WAT 1556 11.934 29.519 11.680 1.00 0.00 H ATOM 95903 H2 WAT 1556 11.193 29.797 12.970 1.00 0.00 H TER 95905 WAT 1556 ATOM 95905 O WAT 1557 24.660 8.163 65.422 1.00 0.00 O ATOM 95906 H1 WAT 1557 25.597 8.283 65.576 1.00 0.00 H ATOM 95907 H2 WAT 1557 24.477 8.691 64.644 1.00 0.00 H TER 95909 WAT 1557 ATOM 95909 O WAT 1558 50.340 10.950 52.761 1.00 0.00 O ATOM 95910 H1 WAT 1558 50.577 11.872 52.662 1.00 0.00 H ATOM 95911 H2 WAT 1558 50.904 10.632 53.466 1.00 0.00 H TER 95913 WAT 1558 ATOM 95913 O WAT 1559 21.906 59.896 133.124 1.00 0.00 O ATOM 95914 H1 WAT 1559 22.594 59.535 132.566 1.00 0.00 H ATOM 95915 H2 WAT 1559 21.249 59.202 133.174 1.00 0.00 H TER 95917 WAT 1559 ATOM 95917 O WAT 1560 12.557 18.957 9.031 1.00 0.00 O ATOM 95918 H1 WAT 1560 12.086 19.005 9.863 1.00 0.00 H ATOM 95919 H2 WAT 1560 11.900 18.660 8.401 1.00 0.00 H TER 95921 WAT 1560 ATOM 95921 O WAT 1561 96.128 126.949 111.507 1.00 0.00 O ATOM 95922 H1 WAT 1561 96.547 127.573 112.099 1.00 0.00 H ATOM 95923 H2 WAT 1561 95.746 126.289 112.087 1.00 0.00 H TER 95925 WAT 1561 ATOM 95925 O WAT 1562 10.465 16.579 82.903 1.00 0.00 O ATOM 95926 H1 WAT 1562 10.592 15.642 83.053 1.00 0.00 H ATOM 95927 H2 WAT 1562 9.693 16.803 83.423 1.00 0.00 H TER 95929 WAT 1562 ATOM 95929 O WAT 1563 14.239 15.209 89.963 1.00 0.00 O ATOM 95930 H1 WAT 1563 13.376 15.026 90.333 1.00 0.00 H ATOM 95931 H2 WAT 1563 14.606 15.885 90.533 1.00 0.00 H TER 95933 WAT 1563 ATOM 95933 O WAT 1564 141.471 36.650 77.492 1.00 0.00 O ATOM 95934 H1 WAT 1564 141.032 35.809 77.365 1.00 0.00 H ATOM 95935 H2 WAT 1564 141.658 36.959 76.605 1.00 0.00 H TER 95937 WAT 1564 ATOM 95937 O WAT 1565 111.167 3.507 80.097 1.00 0.00 O ATOM 95938 H1 WAT 1565 110.867 4.415 80.062 1.00 0.00 H ATOM 95939 H2 WAT 1565 110.457 3.037 80.536 1.00 0.00 H TER 95941 WAT 1565 ATOM 95941 O WAT 1566 51.999 116.880 15.925 1.00 0.00 O ATOM 95942 H1 WAT 1566 52.286 116.096 16.392 1.00 0.00 H ATOM 95943 H2 WAT 1566 51.140 117.080 16.298 1.00 0.00 H TER 95945 WAT 1566 ATOM 95945 O WAT 1567 92.516 124.182 106.035 1.00 0.00 O ATOM 95946 H1 WAT 1567 92.931 123.403 105.665 1.00 0.00 H ATOM 95947 H2 WAT 1567 92.750 124.888 105.432 1.00 0.00 H TER 95949 WAT 1567 ATOM 95949 O WAT 1568 104.153 145.424 54.114 1.00 0.00 O ATOM 95950 H1 WAT 1568 104.388 144.498 54.049 1.00 0.00 H ATOM 95951 H2 WAT 1568 103.202 145.438 54.008 1.00 0.00 H TER 95953 WAT 1568 ATOM 95953 O WAT 1569 121.260 32.951 153.954 1.00 0.00 O ATOM 95954 H1 WAT 1569 121.316 32.278 153.274 1.00 0.00 H ATOM 95955 H2 WAT 1569 120.410 33.366 153.810 1.00 0.00 H TER 95957 WAT 1569 ATOM 95957 O WAT 1570 5.041 54.080 91.980 1.00 0.00 O ATOM 95958 H1 WAT 1570 5.528 53.704 91.247 1.00 0.00 H ATOM 95959 H2 WAT 1570 5.611 53.949 92.738 1.00 0.00 H TER 95961 WAT 1570 ATOM 95961 O WAT 1571 53.509 66.483 65.673 1.00 0.00 O ATOM 95962 H1 WAT 1571 53.905 66.507 64.802 1.00 0.00 H ATOM 95963 H2 WAT 1571 53.299 67.397 65.866 1.00 0.00 H TER 95965 WAT 1571 ATOM 95965 O WAT 1572 135.605 62.539 140.705 1.00 0.00 O ATOM 95966 H1 WAT 1572 135.291 63.292 141.205 1.00 0.00 H ATOM 95967 H2 WAT 1572 135.167 61.787 141.103 1.00 0.00 H TER 95969 WAT 1572 ATOM 95969 O WAT 1573 110.592 68.495 111.948 1.00 0.00 O ATOM 95970 H1 WAT 1573 110.529 69.156 111.259 1.00 0.00 H ATOM 95971 H2 WAT 1573 110.201 67.711 111.564 1.00 0.00 H TER 95973 WAT 1573 ATOM 95973 O WAT 1574 73.660 52.776 64.411 1.00 0.00 O ATOM 95974 H1 WAT 1574 73.767 53.713 64.576 1.00 0.00 H ATOM 95975 H2 WAT 1574 73.959 52.656 63.510 1.00 0.00 H TER 95977 WAT 1574 ATOM 95977 O WAT 1575 11.154 71.966 83.595 1.00 0.00 O ATOM 95978 H1 WAT 1575 10.310 71.824 83.166 1.00 0.00 H ATOM 95979 H2 WAT 1575 11.024 71.649 84.489 1.00 0.00 H TER 95981 WAT 1575 ATOM 95981 O WAT 1576 86.573 27.932 130.432 1.00 0.00 O ATOM 95982 H1 WAT 1576 86.808 27.005 130.397 1.00 0.00 H ATOM 95983 H2 WAT 1576 87.398 28.394 130.283 1.00 0.00 H TER 95985 WAT 1576 ATOM 95985 O WAT 1577 115.670 11.163 19.921 1.00 0.00 O ATOM 95986 H1 WAT 1577 114.716 11.238 19.886 1.00 0.00 H ATOM 95987 H2 WAT 1577 115.894 11.386 20.824 1.00 0.00 H TER 95989 WAT 1577 ATOM 95989 O WAT 1578 125.642 10.601 74.474 1.00 0.00 O ATOM 95990 H1 WAT 1578 125.738 11.378 73.924 1.00 0.00 H ATOM 95991 H2 WAT 1578 124.705 10.555 74.663 1.00 0.00 H TER 95993 WAT 1578 ATOM 95993 O WAT 1579 125.939 129.814 9.584 1.00 0.00 O ATOM 95994 H1 WAT 1579 125.978 128.882 9.797 1.00 0.00 H ATOM 95995 H2 WAT 1579 125.629 130.231 10.387 1.00 0.00 H TER 95997 WAT 1579 ATOM 95997 O WAT 1580 27.760 82.089 3.851 1.00 0.00 O ATOM 95998 H1 WAT 1580 27.805 81.337 3.260 1.00 0.00 H ATOM 95999 H2 WAT 1580 28.674 82.295 4.046 1.00 0.00 H TER 96001 WAT 1580 ATOM 96001 O WAT 1581 56.320 81.935 24.190 1.00 0.00 O ATOM 96002 H1 WAT 1581 56.775 81.324 23.611 1.00 0.00 H ATOM 96003 H2 WAT 1581 55.916 81.379 24.856 1.00 0.00 H TER 96005 WAT 1581 ATOM 96005 O WAT 1582 39.381 106.965 15.908 1.00 0.00 O ATOM 96006 H1 WAT 1582 38.502 106.595 15.995 1.00 0.00 H ATOM 96007 H2 WAT 1582 39.243 107.913 15.909 1.00 0.00 H TER 96009 WAT 1582 ATOM 96009 O WAT 1583 125.817 109.580 88.416 1.00 0.00 O ATOM 96010 H1 WAT 1583 125.852 108.639 88.588 1.00 0.00 H ATOM 96011 H2 WAT 1583 125.010 109.871 88.840 1.00 0.00 H TER 96013 WAT 1583 ATOM 96013 O WAT 1584 139.750 63.445 122.254 1.00 0.00 O ATOM 96014 H1 WAT 1584 139.836 62.747 122.904 1.00 0.00 H ATOM 96015 H2 WAT 1584 139.096 64.038 122.624 1.00 0.00 H TER 96017 WAT 1584 ATOM 96017 O WAT 1585 47.602 41.300 63.502 1.00 0.00 O ATOM 96018 H1 WAT 1585 47.955 42.006 64.044 1.00 0.00 H ATOM 96019 H2 WAT 1585 48.293 41.120 62.864 1.00 0.00 H TER 96021 WAT 1585 ATOM 96021 O WAT 1586 68.593 145.627 74.596 1.00 0.00 O ATOM 96022 H1 WAT 1586 68.837 144.923 73.995 1.00 0.00 H ATOM 96023 H2 WAT 1586 69.427 145.983 74.901 1.00 0.00 H TER 96025 WAT 1586 ATOM 96025 O WAT 1587 131.924 120.102 6.517 1.00 0.00 O ATOM 96026 H1 WAT 1587 131.872 119.359 7.119 1.00 0.00 H ATOM 96027 H2 WAT 1587 131.059 120.142 6.110 1.00 0.00 H TER 96029 WAT 1587 ATOM 96029 O WAT 1588 3.375 117.147 141.715 1.00 0.00 O ATOM 96030 H1 WAT 1588 3.392 116.914 140.787 1.00 0.00 H ATOM 96031 H2 WAT 1588 3.571 118.084 141.731 1.00 0.00 H TER 96033 WAT 1588 ATOM 96033 O WAT 1589 27.556 48.559 92.567 1.00 0.00 O ATOM 96034 H1 WAT 1589 28.035 48.021 91.937 1.00 0.00 H ATOM 96035 H2 WAT 1589 26.660 48.580 92.231 1.00 0.00 H TER 96037 WAT 1589 ATOM 96037 O WAT 1590 131.075 36.848 115.290 1.00 0.00 O ATOM 96038 H1 WAT 1590 131.928 37.248 115.122 1.00 0.00 H ATOM 96039 H2 WAT 1590 131.166 35.948 114.977 1.00 0.00 H TER 96041 WAT 1590 ATOM 96041 O WAT 1591 123.955 104.662 12.024 1.00 0.00 O ATOM 96042 H1 WAT 1591 123.697 105.191 12.779 1.00 0.00 H ATOM 96043 H2 WAT 1591 123.333 103.935 12.018 1.00 0.00 H TER 96045 WAT 1591 ATOM 96045 O WAT 1592 64.348 69.974 13.257 1.00 0.00 O ATOM 96046 H1 WAT 1592 64.649 69.229 12.737 1.00 0.00 H ATOM 96047 H2 WAT 1592 64.278 69.632 14.148 1.00 0.00 H TER 96049 WAT 1592 ATOM 96049 O WAT 1593 70.651 45.364 26.575 1.00 0.00 O ATOM 96050 H1 WAT 1593 70.522 44.906 27.406 1.00 0.00 H ATOM 96051 H2 WAT 1593 69.858 45.176 26.073 1.00 0.00 H TER 96053 WAT 1593 ATOM 96053 O WAT 1594 139.958 26.729 12.781 1.00 0.00 O ATOM 96054 H1 WAT 1594 140.859 26.863 12.488 1.00 0.00 H ATOM 96055 H2 WAT 1594 140.027 26.628 13.731 1.00 0.00 H TER 96057 WAT 1594 ATOM 96057 O WAT 1595 122.612 41.988 118.721 1.00 0.00 O ATOM 96058 H1 WAT 1595 122.059 41.216 118.844 1.00 0.00 H ATOM 96059 H2 WAT 1595 123.389 41.813 119.253 1.00 0.00 H TER 96061 WAT 1595 ATOM 96061 O WAT 1596 63.392 8.212 57.807 1.00 0.00 O ATOM 96062 H1 WAT 1596 63.908 7.441 57.569 1.00 0.00 H ATOM 96063 H2 WAT 1596 62.535 7.861 58.049 1.00 0.00 H TER 96065 WAT 1596 ATOM 96065 O WAT 1597 139.104 47.197 134.895 1.00 0.00 O ATOM 96066 H1 WAT 1597 138.726 47.665 135.639 1.00 0.00 H ATOM 96067 H2 WAT 1597 139.815 47.762 134.592 1.00 0.00 H TER 96069 WAT 1597 ATOM 96069 O WAT 1598 107.608 10.578 64.644 1.00 0.00 O ATOM 96070 H1 WAT 1598 107.571 9.943 63.928 1.00 0.00 H ATOM 96071 H2 WAT 1598 108.542 10.669 64.834 1.00 0.00 H TER 96073 WAT 1598 ATOM 96073 O WAT 1599 77.195 21.899 96.321 1.00 0.00 O ATOM 96074 H1 WAT 1599 78.010 22.383 96.454 1.00 0.00 H ATOM 96075 H2 WAT 1599 77.314 21.458 95.480 1.00 0.00 H TER 96077 WAT 1599 ATOM 96077 O WAT 1600 17.865 100.887 64.922 1.00 0.00 O ATOM 96078 H1 WAT 1600 18.324 100.048 64.971 1.00 0.00 H ATOM 96079 H2 WAT 1600 18.561 101.535 64.811 1.00 0.00 H TER 96081 WAT 1600 ATOM 96081 O WAT 1601 140.542 80.313 104.226 1.00 0.00 O ATOM 96082 H1 WAT 1601 140.246 81.027 103.661 1.00 0.00 H ATOM 96083 H2 WAT 1601 141.443 80.147 103.949 1.00 0.00 H TER 96085 WAT 1601 ATOM 96085 O WAT 1602 139.347 140.144 12.215 1.00 0.00 O ATOM 96086 H1 WAT 1602 139.767 140.992 12.075 1.00 0.00 H ATOM 96087 H2 WAT 1602 139.711 139.580 11.533 1.00 0.00 H TER 96089 WAT 1602 ATOM 96089 O WAT 1603 30.853 62.154 137.272 1.00 0.00 O ATOM 96090 H1 WAT 1603 30.607 62.697 138.021 1.00 0.00 H ATOM 96091 H2 WAT 1603 30.096 61.586 137.129 1.00 0.00 H TER 96093 WAT 1603 ATOM 96093 O WAT 1604 9.507 14.952 146.391 1.00 0.00 O ATOM 96094 H1 WAT 1604 8.599 15.245 146.465 1.00 0.00 H ATOM 96095 H2 WAT 1604 10.025 15.693 146.707 1.00 0.00 H TER 96097 WAT 1604 ATOM 96097 O WAT 1605 13.808 81.682 96.606 1.00 0.00 O ATOM 96098 H1 WAT 1605 13.257 82.097 95.942 1.00 0.00 H ATOM 96099 H2 WAT 1605 14.619 81.468 96.144 1.00 0.00 H TER 96101 WAT 1605 ATOM 96101 O WAT 1606 20.959 111.099 9.278 1.00 0.00 O ATOM 96102 H1 WAT 1606 20.289 110.588 9.732 1.00 0.00 H ATOM 96103 H2 WAT 1606 20.758 112.008 9.498 1.00 0.00 H TER 96105 WAT 1606 ATOM 96105 O WAT 1607 76.210 113.715 96.447 1.00 0.00 O ATOM 96106 H1 WAT 1607 76.176 114.667 96.533 1.00 0.00 H ATOM 96107 H2 WAT 1607 76.954 113.553 95.866 1.00 0.00 H TER 96109 WAT 1607 ATOM 96109 O WAT 1608 80.579 80.446 4.271 1.00 0.00 O ATOM 96110 H1 WAT 1608 81.402 80.721 4.674 1.00 0.00 H ATOM 96111 H2 WAT 1608 80.373 79.611 4.692 1.00 0.00 H TER 96113 WAT 1608 ATOM 96113 O WAT 1609 141.890 79.563 114.845 1.00 0.00 O ATOM 96114 H1 WAT 1609 141.730 79.536 115.788 1.00 0.00 H ATOM 96115 H2 WAT 1609 141.472 78.770 114.509 1.00 0.00 H TER 96117 WAT 1609 ATOM 96117 O WAT 1610 53.949 84.388 63.174 1.00 0.00 O ATOM 96118 H1 WAT 1610 53.032 84.125 63.245 1.00 0.00 H ATOM 96119 H2 WAT 1610 53.972 84.979 62.422 1.00 0.00 H TER 96121 WAT 1610 ATOM 96121 O WAT 1611 105.210 28.979 105.541 1.00 0.00 O ATOM 96122 H1 WAT 1611 106.035 28.577 105.811 1.00 0.00 H ATOM 96123 H2 WAT 1611 105.402 29.370 104.688 1.00 0.00 H TER 96125 WAT 1611 ATOM 96125 O WAT 1612 37.149 9.540 18.390 1.00 0.00 O ATOM 96126 H1 WAT 1612 38.066 9.584 18.118 1.00 0.00 H ATOM 96127 H2 WAT 1612 37.167 9.052 19.213 1.00 0.00 H TER 96129 WAT 1612 ATOM 96129 O WAT 1613 106.716 18.031 132.983 1.00 0.00 O ATOM 96130 H1 WAT 1613 107.077 17.479 132.289 1.00 0.00 H ATOM 96131 H2 WAT 1613 105.767 17.967 132.871 1.00 0.00 H TER 96133 WAT 1613 ATOM 96133 O WAT 1614 64.671 3.201 55.521 1.00 0.00 O ATOM 96134 H1 WAT 1614 64.752 3.851 56.218 1.00 0.00 H ATOM 96135 H2 WAT 1614 63.827 3.393 55.112 1.00 0.00 H TER 96137 WAT 1614 ATOM 96137 O WAT 1615 73.324 105.975 109.995 1.00 0.00 O ATOM 96138 H1 WAT 1615 73.029 106.360 110.820 1.00 0.00 H ATOM 96139 H2 WAT 1615 74.271 105.881 110.099 1.00 0.00 H TER 96141 WAT 1615 ATOM 96141 O WAT 1616 71.159 109.691 112.345 1.00 0.00 O ATOM 96142 H1 WAT 1616 70.846 109.297 113.160 1.00 0.00 H ATOM 96143 H2 WAT 1616 71.942 110.179 112.601 1.00 0.00 H TER 96145 WAT 1616 ATOM 96145 O WAT 1617 82.016 116.429 150.456 1.00 0.00 O ATOM 96146 H1 WAT 1617 82.895 116.614 150.124 1.00 0.00 H ATOM 96147 H2 WAT 1617 81.484 116.311 149.669 1.00 0.00 H TER 96149 WAT 1617 ATOM 96149 O WAT 1618 81.707 21.727 105.018 1.00 0.00 O ATOM 96150 H1 WAT 1618 80.952 21.693 105.604 1.00 0.00 H ATOM 96151 H2 WAT 1618 82.461 21.806 105.602 1.00 0.00 H TER 96153 WAT 1618 ATOM 96153 O WAT 1619 93.373 125.397 69.362 1.00 0.00 O ATOM 96154 H1 WAT 1619 93.645 125.395 70.280 1.00 0.00 H ATOM 96155 H2 WAT 1619 92.907 124.568 69.248 1.00 0.00 H TER 96157 WAT 1619 ATOM 96157 O WAT 1620 61.613 102.225 79.667 1.00 0.00 O ATOM 96158 H1 WAT 1620 62.151 101.900 78.946 1.00 0.00 H ATOM 96159 H2 WAT 1620 62.178 102.159 80.437 1.00 0.00 H TER 96161 WAT 1620 ATOM 96161 O WAT 1621 128.067 16.681 147.832 1.00 0.00 O ATOM 96162 H1 WAT 1621 129.004 16.640 148.024 1.00 0.00 H ATOM 96163 H2 WAT 1621 127.788 17.528 148.178 1.00 0.00 H TER 96165 WAT 1621 ATOM 96165 O WAT 1622 101.436 18.104 2.471 1.00 0.00 O ATOM 96166 H1 WAT 1622 101.275 17.163 2.537 1.00 0.00 H ATOM 96167 H2 WAT 1622 100.671 18.446 2.009 1.00 0.00 H TER 96169 WAT 1622 ATOM 96169 O WAT 1623 68.912 95.008 128.022 1.00 0.00 O ATOM 96170 H1 WAT 1623 69.097 95.881 128.370 1.00 0.00 H ATOM 96171 H2 WAT 1623 68.567 95.168 127.144 1.00 0.00 H TER 96173 WAT 1623 ATOM 96173 O WAT 1624 87.737 42.125 147.751 1.00 0.00 O ATOM 96174 H1 WAT 1624 87.792 41.454 148.432 1.00 0.00 H ATOM 96175 H2 WAT 1624 87.696 42.951 148.231 1.00 0.00 H TER 96177 WAT 1624 ATOM 96177 O WAT 1625 143.172 134.459 93.199 1.00 0.00 O ATOM 96178 H1 WAT 1625 143.161 135.402 93.361 1.00 0.00 H ATOM 96179 H2 WAT 1625 143.058 134.377 92.252 1.00 0.00 H TER 96181 WAT 1625 ATOM 96181 O WAT 1626 88.772 1.759 147.768 1.00 0.00 O ATOM 96182 H1 WAT 1626 89.685 2.018 147.894 1.00 0.00 H ATOM 96183 H2 WAT 1626 88.796 0.802 147.747 1.00 0.00 H TER 96185 WAT 1626 ATOM 96185 O WAT 1627 139.589 74.779 11.770 1.00 0.00 O ATOM 96186 H1 WAT 1627 140.299 74.139 11.722 1.00 0.00 H ATOM 96187 H2 WAT 1627 138.867 74.374 11.289 1.00 0.00 H TER 96189 WAT 1627 ATOM 96189 O WAT 1628 32.901 92.291 88.493 1.00 0.00 O ATOM 96190 H1 WAT 1628 32.001 92.466 88.768 1.00 0.00 H ATOM 96191 H2 WAT 1628 33.276 91.784 89.213 1.00 0.00 H TER 96193 WAT 1628 ATOM 96193 O WAT 1629 70.904 98.921 72.887 1.00 0.00 O ATOM 96194 H1 WAT 1629 71.791 98.587 73.019 1.00 0.00 H ATOM 96195 H2 WAT 1629 70.883 99.191 71.969 1.00 0.00 H TER 96197 WAT 1629 ATOM 96197 O WAT 1630 93.291 31.885 136.323 1.00 0.00 O ATOM 96198 H1 WAT 1630 93.020 31.338 137.061 1.00 0.00 H ATOM 96199 H2 WAT 1630 92.628 32.574 136.279 1.00 0.00 H TER 96201 WAT 1630 ATOM 96201 O WAT 1631 41.140 102.498 73.279 1.00 0.00 O ATOM 96202 H1 WAT 1631 41.422 101.664 73.654 1.00 0.00 H ATOM 96203 H2 WAT 1631 40.316 102.295 72.836 1.00 0.00 H TER 96205 WAT 1631 ATOM 96205 O WAT 1632 37.941 25.503 62.801 1.00 0.00 O ATOM 96206 H1 WAT 1632 37.990 26.458 62.757 1.00 0.00 H ATOM 96207 H2 WAT 1632 38.812 25.207 62.537 1.00 0.00 H TER 96209 WAT 1632 ATOM 96209 O WAT 1633 57.076 50.042 122.490 1.00 0.00 O ATOM 96210 H1 WAT 1633 56.733 50.924 122.345 1.00 0.00 H ATOM 96211 H2 WAT 1633 57.061 49.932 123.440 1.00 0.00 H TER 96213 WAT 1633 ATOM 96213 O WAT 1634 20.810 77.640 3.513 1.00 0.00 O ATOM 96214 H1 WAT 1634 21.172 77.911 4.357 1.00 0.00 H ATOM 96215 H2 WAT 1634 19.939 77.304 3.723 1.00 0.00 H TER 96217 WAT 1634 ATOM 96217 O WAT 1635 28.241 38.798 128.593 1.00 0.00 O ATOM 96218 H1 WAT 1635 27.821 38.790 129.453 1.00 0.00 H ATOM 96219 H2 WAT 1635 28.299 37.874 128.347 1.00 0.00 H TER 96221 WAT 1635 ATOM 96221 O WAT 1636 94.717 127.579 109.122 1.00 0.00 O ATOM 96222 H1 WAT 1636 95.369 127.330 109.777 1.00 0.00 H ATOM 96223 H2 WAT 1636 94.581 126.785 108.605 1.00 0.00 H TER 96225 WAT 1636 ATOM 96225 O WAT 1637 136.365 116.451 143.919 1.00 0.00 O ATOM 96226 H1 WAT 1637 136.747 116.809 144.720 1.00 0.00 H ATOM 96227 H2 WAT 1637 135.628 115.920 144.221 1.00 0.00 H TER 96229 WAT 1637 ATOM 96229 O WAT 1638 85.392 93.570 100.410 1.00 0.00 O ATOM 96230 H1 WAT 1638 85.376 93.076 99.590 1.00 0.00 H ATOM 96231 H2 WAT 1638 86.081 94.222 100.284 1.00 0.00 H TER 96233 WAT 1638 ATOM 96233 O WAT 1639 0.420 128.371 128.382 1.00 0.00 O ATOM 96234 H1 WAT 1639 0.899 127.723 127.865 1.00 0.00 H ATOM 96235 H2 WAT 1639 -0.500 128.126 128.281 1.00 0.00 H TER 96237 WAT 1639 ATOM 96237 O WAT 1640 65.362 127.932 98.686 1.00 0.00 O ATOM 96238 H1 WAT 1640 66.251 128.268 98.576 1.00 0.00 H ATOM 96239 H2 WAT 1640 65.303 127.710 99.615 1.00 0.00 H TER 96241 WAT 1640 ATOM 96241 O WAT 1641 14.511 97.398 124.079 1.00 0.00 O ATOM 96242 H1 WAT 1641 14.273 97.573 123.168 1.00 0.00 H ATOM 96243 H2 WAT 1641 15.073 98.132 124.325 1.00 0.00 H TER 96245 WAT 1641 ATOM 96245 O WAT 1642 84.783 17.674 140.586 1.00 0.00 O ATOM 96246 H1 WAT 1642 85.098 18.528 140.291 1.00 0.00 H ATOM 96247 H2 WAT 1642 84.599 17.195 139.778 1.00 0.00 H TER 96249 WAT 1642 ATOM 96249 O WAT 1643 141.189 62.739 130.927 1.00 0.00 O ATOM 96250 H1 WAT 1643 140.449 62.149 130.780 1.00 0.00 H ATOM 96251 H2 WAT 1643 141.674 62.725 130.101 1.00 0.00 H TER 96253 WAT 1643 ATOM 96253 O WAT 1644 5.022 126.057 88.614 1.00 0.00 O ATOM 96254 H1 WAT 1644 4.360 126.600 89.042 1.00 0.00 H ATOM 96255 H2 WAT 1644 5.834 126.557 88.699 1.00 0.00 H TER 96257 WAT 1644 ATOM 96257 O WAT 1645 58.405 21.783 69.098 1.00 0.00 O ATOM 96258 H1 WAT 1645 57.480 21.829 68.855 1.00 0.00 H ATOM 96259 H2 WAT 1645 58.476 22.337 69.876 1.00 0.00 H TER 96261 WAT 1645 ATOM 96261 O WAT 1646 95.482 9.796 89.911 1.00 0.00 O ATOM 96262 H1 WAT 1646 95.225 8.956 89.530 1.00 0.00 H ATOM 96263 H2 WAT 1646 95.697 9.591 90.821 1.00 0.00 H TER 96265 WAT 1646 ATOM 96265 O WAT 1647 106.894 29.163 136.403 1.00 0.00 O ATOM 96266 H1 WAT 1647 106.483 29.697 135.723 1.00 0.00 H ATOM 96267 H2 WAT 1647 107.771 29.534 136.501 1.00 0.00 H TER 96269 WAT 1647 ATOM 96269 O WAT 1648 82.756 140.783 156.921 1.00 0.00 O ATOM 96270 H1 WAT 1648 82.781 140.577 155.987 1.00 0.00 H ATOM 96271 H2 WAT 1648 81.836 140.679 157.165 1.00 0.00 H TER 96273 WAT 1648 ATOM 96273 O WAT 1649 66.321 3.178 114.629 1.00 0.00 O ATOM 96274 H1 WAT 1649 65.551 2.668 114.377 1.00 0.00 H ATOM 96275 H2 WAT 1649 66.129 4.066 114.326 1.00 0.00 H TER 96277 WAT 1649 ATOM 96277 O WAT 1650 9.553 78.557 156.263 1.00 0.00 O ATOM 96278 H1 WAT 1650 8.990 77.819 156.495 1.00 0.00 H ATOM 96279 H2 WAT 1650 10.281 78.508 156.882 1.00 0.00 H TER 96281 WAT 1650 ATOM 96281 O WAT 1651 126.060 133.676 86.692 1.00 0.00 O ATOM 96282 H1 WAT 1651 126.629 132.937 86.908 1.00 0.00 H ATOM 96283 H2 WAT 1651 126.435 134.040 85.890 1.00 0.00 H TER 96285 WAT 1651 ATOM 96285 O WAT 1652 136.699 134.507 141.138 1.00 0.00 O ATOM 96286 H1 WAT 1652 137.197 134.334 141.938 1.00 0.00 H ATOM 96287 H2 WAT 1652 136.122 133.749 141.047 1.00 0.00 H TER 96289 WAT 1652 ATOM 96289 O WAT 1653 54.797 101.038 137.748 1.00 0.00 O ATOM 96290 H1 WAT 1653 54.036 101.235 137.202 1.00 0.00 H ATOM 96291 H2 WAT 1653 55.430 101.723 137.534 1.00 0.00 H TER 96293 WAT 1653 ATOM 96293 O WAT 1654 97.014 118.907 78.381 1.00 0.00 O ATOM 96294 H1 WAT 1654 97.342 119.026 77.490 1.00 0.00 H ATOM 96295 H2 WAT 1654 96.636 118.027 78.381 1.00 0.00 H TER 96297 WAT 1654 ATOM 96297 O WAT 1655 8.264 36.143 66.519 1.00 0.00 O ATOM 96298 H1 WAT 1655 8.782 35.844 65.771 1.00 0.00 H ATOM 96299 H2 WAT 1655 7.492 35.578 66.517 1.00 0.00 H TER 96301 WAT 1655 ATOM 96301 O WAT 1656 68.472 100.436 69.731 1.00 0.00 O ATOM 96302 H1 WAT 1656 68.014 101.057 69.164 1.00 0.00 H ATOM 96303 H2 WAT 1656 68.150 100.633 70.611 1.00 0.00 H TER 96305 WAT 1656 ATOM 96305 O WAT 1657 138.817 3.292 105.052 1.00 0.00 O ATOM 96306 H1 WAT 1657 139.494 2.841 104.547 1.00 0.00 H ATOM 96307 H2 WAT 1657 138.302 3.762 104.396 1.00 0.00 H TER 96309 WAT 1657 ATOM 96309 O WAT 1658 81.239 68.639 4.152 1.00 0.00 O ATOM 96310 H1 WAT 1658 82.033 69.168 4.082 1.00 0.00 H ATOM 96311 H2 WAT 1658 80.533 69.229 3.889 1.00 0.00 H TER 96313 WAT 1658 ATOM 96313 O WAT 1659 20.225 101.510 2.747 1.00 0.00 O ATOM 96314 H1 WAT 1659 19.666 100.782 2.475 1.00 0.00 H ATOM 96315 H2 WAT 1659 21.078 101.109 2.911 1.00 0.00 H TER 96317 WAT 1659 ATOM 96317 O WAT 1660 81.229 104.678 66.099 1.00 0.00 O ATOM 96318 H1 WAT 1660 81.817 104.552 65.354 1.00 0.00 H ATOM 96319 H2 WAT 1660 81.665 104.233 66.826 1.00 0.00 H TER 96321 WAT 1660 ATOM 96321 O WAT 1661 55.593 104.319 77.312 1.00 0.00 O ATOM 96322 H1 WAT 1661 56.245 103.652 77.524 1.00 0.00 H ATOM 96323 H2 WAT 1661 56.048 104.919 76.721 1.00 0.00 H TER 96325 WAT 1661 ATOM 96325 O WAT 1662 122.929 33.597 132.833 1.00 0.00 O ATOM 96326 H1 WAT 1662 122.195 33.836 132.268 1.00 0.00 H ATOM 96327 H2 WAT 1662 123.241 34.430 133.186 1.00 0.00 H TER 96329 WAT 1662 ATOM 96329 O WAT 1663 18.668 16.099 154.682 1.00 0.00 O ATOM 96330 H1 WAT 1663 19.598 15.881 154.614 1.00 0.00 H ATOM 96331 H2 WAT 1663 18.228 15.439 154.147 1.00 0.00 H TER 96333 WAT 1663 ATOM 96333 O WAT 1664 118.674 120.319 70.478 1.00 0.00 O ATOM 96334 H1 WAT 1664 119.370 120.554 71.091 1.00 0.00 H ATOM 96335 H2 WAT 1664 118.807 120.901 69.730 1.00 0.00 H TER 96337 WAT 1664 ATOM 96337 O WAT 1665 95.349 33.485 82.662 1.00 0.00 O ATOM 96338 H1 WAT 1665 96.136 33.906 83.010 1.00 0.00 H ATOM 96339 H2 WAT 1665 94.793 33.347 83.428 1.00 0.00 H TER 96341 WAT 1665 ATOM 96341 O WAT 1666 95.867 34.661 97.836 1.00 0.00 O ATOM 96342 H1 WAT 1666 96.424 34.088 97.309 1.00 0.00 H ATOM 96343 H2 WAT 1666 95.683 35.407 97.265 1.00 0.00 H TER 96345 WAT 1666 ATOM 96345 O WAT 1667 17.147 117.694 67.377 1.00 0.00 O ATOM 96346 H1 WAT 1667 17.577 117.510 66.542 1.00 0.00 H ATOM 96347 H2 WAT 1667 16.867 116.836 67.695 1.00 0.00 H TER 96349 WAT 1667 ATOM 96349 O WAT 1668 31.035 48.555 145.998 1.00 0.00 O ATOM 96350 H1 WAT 1668 31.069 49.497 145.831 1.00 0.00 H ATOM 96351 H2 WAT 1668 30.686 48.180 145.189 1.00 0.00 H TER 96353 WAT 1668 ATOM 96353 O WAT 1669 1.233 112.034 73.577 1.00 0.00 O ATOM 96354 H1 WAT 1669 1.006 112.120 72.651 1.00 0.00 H ATOM 96355 H2 WAT 1669 1.094 112.908 73.940 1.00 0.00 H TER 96357 WAT 1669 ATOM 96357 O WAT 1670 115.381 47.249 112.666 1.00 0.00 O ATOM 96358 H1 WAT 1670 115.044 48.083 112.994 1.00 0.00 H ATOM 96359 H2 WAT 1670 114.600 46.713 112.528 1.00 0.00 H TER 96361 WAT 1670 ATOM 96361 O WAT 1671 51.226 34.266 61.542 1.00 0.00 O ATOM 96362 H1 WAT 1671 51.947 34.369 60.921 1.00 0.00 H ATOM 96363 H2 WAT 1671 51.321 35.005 62.144 1.00 0.00 H TER 96365 WAT 1671 ATOM 96365 O WAT 1672 21.476 49.379 109.954 1.00 0.00 O ATOM 96366 H1 WAT 1672 21.645 49.219 109.026 1.00 0.00 H ATOM 96367 H2 WAT 1672 22.179 48.914 110.409 1.00 0.00 H TER 96369 WAT 1672 ATOM 96369 O WAT 1673 30.349 73.780 128.504 1.00 0.00 O ATOM 96370 H1 WAT 1673 29.490 73.369 128.599 1.00 0.00 H ATOM 96371 H2 WAT 1673 30.157 74.671 128.212 1.00 0.00 H TER 96373 WAT 1673 ATOM 96373 O WAT 1674 137.998 136.244 106.011 1.00 0.00 O ATOM 96374 H1 WAT 1674 138.669 136.654 106.557 1.00 0.00 H ATOM 96375 H2 WAT 1674 137.611 135.571 106.571 1.00 0.00 H TER 96377 WAT 1674 ATOM 96377 O WAT 1675 43.797 107.445 57.910 1.00 0.00 O ATOM 96378 H1 WAT 1675 43.373 106.733 58.390 1.00 0.00 H ATOM 96379 H2 WAT 1675 44.013 107.065 57.059 1.00 0.00 H TER 96381 WAT 1675 ATOM 96381 O WAT 1676 125.571 126.347 114.764 1.00 0.00 O ATOM 96382 H1 WAT 1676 125.426 125.618 114.160 1.00 0.00 H ATOM 96383 H2 WAT 1676 126.141 125.985 115.443 1.00 0.00 H TER 96385 WAT 1676 ATOM 96385 O WAT 1677 88.449 23.861 151.302 1.00 0.00 O ATOM 96386 H1 WAT 1677 87.862 23.575 152.002 1.00 0.00 H ATOM 96387 H2 WAT 1677 88.851 23.054 150.981 1.00 0.00 H TER 96389 WAT 1677 ATOM 96389 O WAT 1678 37.579 55.498 152.752 1.00 0.00 O ATOM 96390 H1 WAT 1678 37.964 55.085 151.979 1.00 0.00 H ATOM 96391 H2 WAT 1678 37.514 54.791 153.394 1.00 0.00 H TER 96393 WAT 1678 ATOM 96393 O WAT 1679 76.612 54.381 154.316 1.00 0.00 O ATOM 96394 H1 WAT 1679 76.119 53.708 153.846 1.00 0.00 H ATOM 96395 H2 WAT 1679 76.267 54.352 155.208 1.00 0.00 H TER 96397 WAT 1679 ATOM 96397 O WAT 1680 18.673 75.809 3.814 1.00 0.00 O ATOM 96398 H1 WAT 1680 17.747 76.013 3.945 1.00 0.00 H ATOM 96399 H2 WAT 1680 18.745 75.608 2.881 1.00 0.00 H TER 96401 WAT 1680 ATOM 96401 O WAT 1681 109.267 41.563 157.188 1.00 0.00 O ATOM 96402 H1 WAT 1681 110.172 41.865 157.116 1.00 0.00 H ATOM 96403 H2 WAT 1681 109.115 41.067 156.383 1.00 0.00 H TER 96405 WAT 1681 ATOM 96405 O WAT 1682 52.180 98.372 130.527 1.00 0.00 O ATOM 96406 H1 WAT 1682 51.571 97.963 131.142 1.00 0.00 H ATOM 96407 H2 WAT 1682 51.783 98.232 129.668 1.00 0.00 H TER 96409 WAT 1682 ATOM 96409 O WAT 1683 57.623 5.214 131.306 1.00 0.00 O ATOM 96410 H1 WAT 1683 57.605 6.045 131.781 1.00 0.00 H ATOM 96411 H2 WAT 1683 57.795 5.462 130.398 1.00 0.00 H TER 96413 WAT 1683 ATOM 96413 O WAT 1684 36.824 30.272 64.277 1.00 0.00 O ATOM 96414 H1 WAT 1684 36.415 30.773 64.982 1.00 0.00 H ATOM 96415 H2 WAT 1684 37.020 30.922 63.603 1.00 0.00 H TER 96417 WAT 1684 ATOM 96417 O WAT 1685 140.447 13.885 149.003 1.00 0.00 O ATOM 96418 H1 WAT 1685 140.981 13.338 148.426 1.00 0.00 H ATOM 96419 H2 WAT 1685 140.650 13.572 149.885 1.00 0.00 H TER 96421 WAT 1685 ATOM 96421 O WAT 1686 118.190 33.292 87.993 1.00 0.00 O ATOM 96422 H1 WAT 1686 117.462 33.203 87.378 1.00 0.00 H ATOM 96423 H2 WAT 1686 118.846 32.670 87.679 1.00 0.00 H TER 96425 WAT 1686 ATOM 96425 O WAT 1687 21.270 0.943 89.349 1.00 0.00 O ATOM 96426 H1 WAT 1687 20.965 0.113 89.715 1.00 0.00 H ATOM 96427 H2 WAT 1687 21.708 0.699 88.533 1.00 0.00 H TER 96429 WAT 1687 ATOM 96429 O WAT 1688 102.033 104.574 138.802 1.00 0.00 O ATOM 96430 H1 WAT 1688 102.328 104.733 137.905 1.00 0.00 H ATOM 96431 H2 WAT 1688 102.274 103.664 138.975 1.00 0.00 H TER 96433 WAT 1688 ATOM 96433 O WAT 1689 102.478 111.792 62.816 1.00 0.00 O ATOM 96434 H1 WAT 1689 101.694 111.352 62.486 1.00 0.00 H ATOM 96435 H2 WAT 1689 102.509 111.562 63.744 1.00 0.00 H TER 96437 WAT 1689 ATOM 96437 O WAT 1690 62.507 96.029 157.918 1.00 0.00 O ATOM 96438 H1 WAT 1690 62.752 96.873 157.540 1.00 0.00 H ATOM 96439 H2 WAT 1690 63.317 95.696 158.306 1.00 0.00 H TER 96441 WAT 1690 ATOM 96441 O WAT 1691 37.118 145.028 71.136 1.00 0.00 O ATOM 96442 H1 WAT 1691 38.004 145.257 70.857 1.00 0.00 H ATOM 96443 H2 WAT 1691 37.160 145.029 72.093 1.00 0.00 H TER 96445 WAT 1691 ATOM 96445 O WAT 1692 52.558 120.358 116.698 1.00 0.00 O ATOM 96446 H1 WAT 1692 53.083 120.423 117.496 1.00 0.00 H ATOM 96447 H2 WAT 1692 51.917 119.673 116.888 1.00 0.00 H TER 96449 WAT 1692 ATOM 96449 O WAT 1693 60.518 137.675 146.586 1.00 0.00 O ATOM 96450 H1 WAT 1693 60.948 138.524 146.691 1.00 0.00 H ATOM 96451 H2 WAT 1693 60.863 137.142 147.303 1.00 0.00 H TER 96453 WAT 1693 ATOM 96453 O WAT 1694 18.066 79.136 118.933 1.00 0.00 O ATOM 96454 H1 WAT 1694 18.563 79.196 118.117 1.00 0.00 H ATOM 96455 H2 WAT 1694 17.843 78.208 119.009 1.00 0.00 H TER 96457 WAT 1694 ATOM 96457 O WAT 1695 38.646 83.842 150.882 1.00 0.00 O ATOM 96458 H1 WAT 1695 38.805 83.112 150.284 1.00 0.00 H ATOM 96459 H2 WAT 1695 38.204 84.499 150.345 1.00 0.00 H TER 96461 WAT 1695 ATOM 96461 O WAT 1696 34.117 17.968 95.729 1.00 0.00 O ATOM 96462 H1 WAT 1696 33.485 18.590 95.371 1.00 0.00 H ATOM 96463 H2 WAT 1696 34.947 18.445 95.733 1.00 0.00 H TER 96465 WAT 1696 ATOM 96465 O WAT 1697 130.912 114.458 65.909 1.00 0.00 O ATOM 96466 H1 WAT 1697 131.120 113.981 65.106 1.00 0.00 H ATOM 96467 H2 WAT 1697 129.963 114.373 65.999 1.00 0.00 H TER 96469 WAT 1697 ATOM 96469 O WAT 1698 131.722 29.044 127.045 1.00 0.00 O ATOM 96470 H1 WAT 1698 132.586 28.870 126.672 1.00 0.00 H ATOM 96471 H2 WAT 1698 131.737 29.977 127.261 1.00 0.00 H TER 96473 WAT 1698 ATOM 96473 O WAT 1699 111.399 71.552 93.727 1.00 0.00 O ATOM 96474 H1 WAT 1699 112.081 72.205 93.573 1.00 0.00 H ATOM 96475 H2 WAT 1699 110.607 72.065 93.888 1.00 0.00 H TER 96477 WAT 1699 ATOM 96477 O WAT 1700 54.661 111.552 19.733 1.00 0.00 O ATOM 96478 H1 WAT 1700 55.590 111.473 19.515 1.00 0.00 H ATOM 96479 H2 WAT 1700 54.395 110.664 19.973 1.00 0.00 H TER 96481 WAT 1700 ATOM 96481 O WAT 1701 123.355 71.895 114.853 1.00 0.00 O ATOM 96482 H1 WAT 1701 123.414 71.454 114.006 1.00 0.00 H ATOM 96483 H2 WAT 1701 123.207 71.188 115.481 1.00 0.00 H TER 96485 WAT 1701 ATOM 96485 O WAT 1702 60.789 92.543 113.058 1.00 0.00 O ATOM 96486 H1 WAT 1702 60.477 92.407 113.953 1.00 0.00 H ATOM 96487 H2 WAT 1702 61.166 91.700 112.805 1.00 0.00 H TER 96489 WAT 1702 ATOM 96489 O WAT 1703 26.999 2.372 106.617 1.00 0.00 O ATOM 96490 H1 WAT 1703 27.321 2.541 105.732 1.00 0.00 H ATOM 96491 H2 WAT 1703 27.439 3.026 107.161 1.00 0.00 H TER 96493 WAT 1703 ATOM 96493 O WAT 1704 21.706 121.106 80.378 1.00 0.00 O ATOM 96494 H1 WAT 1704 22.631 121.130 80.621 1.00 0.00 H ATOM 96495 H2 WAT 1704 21.707 121.176 79.423 1.00 0.00 H TER 96497 WAT 1704 ATOM 96497 O WAT 1705 87.498 11.941 127.007 1.00 0.00 O ATOM 96498 H1 WAT 1705 88.017 11.138 126.980 1.00 0.00 H ATOM 96499 H2 WAT 1705 87.559 12.235 127.916 1.00 0.00 H TER 96501 WAT 1705 ATOM 96501 O WAT 1706 24.616 39.254 82.110 1.00 0.00 O ATOM 96502 H1 WAT 1706 23.861 39.136 81.534 1.00 0.00 H ATOM 96503 H2 WAT 1706 24.343 39.932 82.728 1.00 0.00 H TER 96505 WAT 1706 ATOM 96505 O WAT 1707 104.055 35.384 88.629 1.00 0.00 O ATOM 96506 H1 WAT 1707 103.389 35.969 88.991 1.00 0.00 H ATOM 96507 H2 WAT 1707 103.648 34.518 88.647 1.00 0.00 H TER 96509 WAT 1707 ATOM 96509 O WAT 1708 136.899 58.180 75.698 1.00 0.00 O ATOM 96510 H1 WAT 1708 137.690 57.645 75.626 1.00 0.00 H ATOM 96511 H2 WAT 1708 137.221 59.080 75.734 1.00 0.00 H TER 96513 WAT 1708 ATOM 96513 O WAT 1709 44.318 118.608 139.560 1.00 0.00 O ATOM 96514 H1 WAT 1709 43.706 118.225 140.189 1.00 0.00 H ATOM 96515 H2 WAT 1709 43.932 119.455 139.336 1.00 0.00 H TER 96517 WAT 1709 ATOM 96517 O WAT 1710 124.689 4.772 153.528 1.00 0.00 O ATOM 96518 H1 WAT 1710 125.331 4.748 154.237 1.00 0.00 H ATOM 96519 H2 WAT 1710 125.215 4.773 152.728 1.00 0.00 H TER 96521 WAT 1710 ATOM 96521 O WAT 1711 137.360 8.227 140.198 1.00 0.00 O ATOM 96522 H1 WAT 1711 137.335 7.980 139.274 1.00 0.00 H ATOM 96523 H2 WAT 1711 137.046 7.450 140.662 1.00 0.00 H TER 96525 WAT 1711 ATOM 96525 O WAT 1712 144.956 40.530 119.404 1.00 0.00 O ATOM 96526 H1 WAT 1712 144.881 41.031 120.216 1.00 0.00 H ATOM 96527 H2 WAT 1712 145.884 40.307 119.345 1.00 0.00 H TER 96529 WAT 1712 ATOM 96529 O WAT 1713 13.818 104.002 124.226 1.00 0.00 O ATOM 96530 H1 WAT 1713 14.761 104.163 124.195 1.00 0.00 H ATOM 96531 H2 WAT 1713 13.732 103.173 124.696 1.00 0.00 H TER 96533 WAT 1713 ATOM 96533 O WAT 1714 23.120 20.282 132.428 1.00 0.00 O ATOM 96534 H1 WAT 1714 22.949 20.526 131.518 1.00 0.00 H ATOM 96535 H2 WAT 1714 22.257 20.078 132.788 1.00 0.00 H TER 96537 WAT 1714 ATOM 96537 O WAT 1715 60.550 63.724 102.891 1.00 0.00 O ATOM 96538 H1 WAT 1715 61.275 64.324 103.069 1.00 0.00 H ATOM 96539 H2 WAT 1715 59.843 64.028 103.461 1.00 0.00 H TER 96541 WAT 1715 ATOM 96541 O WAT 1716 102.890 122.427 63.697 1.00 0.00 O ATOM 96542 H1 WAT 1716 102.810 121.518 63.408 1.00 0.00 H ATOM 96543 H2 WAT 1716 102.782 122.943 62.898 1.00 0.00 H TER 96545 WAT 1716 ATOM 96545 O WAT 1717 21.647 39.327 133.324 1.00 0.00 O ATOM 96546 H1 WAT 1717 21.740 38.962 132.444 1.00 0.00 H ATOM 96547 H2 WAT 1717 22.347 39.977 133.389 1.00 0.00 H TER 96549 WAT 1717 ATOM 96549 O WAT 1718 28.212 84.837 112.787 1.00 0.00 O ATOM 96550 H1 WAT 1718 28.221 85.788 112.896 1.00 0.00 H ATOM 96551 H2 WAT 1718 28.291 84.493 113.677 1.00 0.00 H TER 96553 WAT 1718 ATOM 96553 O WAT 1719 113.628 109.116 93.543 1.00 0.00 O ATOM 96554 H1 WAT 1719 113.537 109.591 94.369 1.00 0.00 H ATOM 96555 H2 WAT 1719 113.029 108.374 93.626 1.00 0.00 H TER 96557 WAT 1719 ATOM 96557 O WAT 1720 105.237 88.346 82.627 1.00 0.00 O ATOM 96558 H1 WAT 1720 105.372 89.268 82.405 1.00 0.00 H ATOM 96559 H2 WAT 1720 106.065 88.071 83.019 1.00 0.00 H TER 96561 WAT 1720 ATOM 96561 O WAT 1721 78.924 84.711 61.148 1.00 0.00 O ATOM 96562 H1 WAT 1721 79.822 84.723 60.816 1.00 0.00 H ATOM 96563 H2 WAT 1721 78.480 85.406 60.663 1.00 0.00 H TER 96565 WAT 1721 ATOM 96565 O WAT 1722 23.794 130.695 78.170 1.00 0.00 O ATOM 96566 H1 WAT 1722 23.195 131.354 77.819 1.00 0.00 H ATOM 96567 H2 WAT 1722 23.991 130.129 77.424 1.00 0.00 H TER 96569 WAT 1722 ATOM 96569 O WAT 1723 95.217 3.154 8.713 1.00 0.00 O ATOM 96570 H1 WAT 1723 94.643 2.902 7.989 1.00 0.00 H ATOM 96571 H2 WAT 1723 94.875 3.998 9.007 1.00 0.00 H TER 96573 WAT 1723 ATOM 96573 O WAT 1724 29.512 134.256 76.004 1.00 0.00 O ATOM 96574 H1 WAT 1724 28.752 134.811 75.830 1.00 0.00 H ATOM 96575 H2 WAT 1724 29.151 133.491 76.452 1.00 0.00 H TER 96577 WAT 1724 ATOM 96577 O WAT 1725 34.206 6.771 97.753 1.00 0.00 O ATOM 96578 H1 WAT 1725 34.597 7.547 97.352 1.00 0.00 H ATOM 96579 H2 WAT 1725 33.723 7.109 98.508 1.00 0.00 H TER 96581 WAT 1725 ATOM 96581 O WAT 1726 19.021 11.560 67.752 1.00 0.00 O ATOM 96582 H1 WAT 1726 19.968 11.457 67.850 1.00 0.00 H ATOM 96583 H2 WAT 1726 18.920 12.131 66.990 1.00 0.00 H TER 96585 WAT 1726 ATOM 96585 O WAT 1727 13.100 34.247 91.582 1.00 0.00 O ATOM 96586 H1 WAT 1727 13.721 34.961 91.437 1.00 0.00 H ATOM 96587 H2 WAT 1727 12.802 34.369 92.483 1.00 0.00 H TER 96589 WAT 1727 ATOM 96589 O WAT 1728 32.759 80.648 138.117 1.00 0.00 O ATOM 96590 H1 WAT 1728 32.427 81.072 138.908 1.00 0.00 H ATOM 96591 H2 WAT 1728 33.477 81.211 137.826 1.00 0.00 H TER 96593 WAT 1728 ATOM 96593 O WAT 1729 140.507 53.686 155.689 1.00 0.00 O ATOM 96594 H1 WAT 1729 141.029 53.423 156.447 1.00 0.00 H ATOM 96595 H2 WAT 1729 140.942 53.273 154.943 1.00 0.00 H TER 96597 WAT 1729 ATOM 96597 O WAT 1730 141.750 131.175 15.473 1.00 0.00 O ATOM 96598 H1 WAT 1730 142.071 132.019 15.790 1.00 0.00 H ATOM 96599 H2 WAT 1730 140.949 131.021 15.973 1.00 0.00 H TER 96601 WAT 1730 ATOM 96601 O WAT 1731 67.213 35.251 59.742 1.00 0.00 O ATOM 96602 H1 WAT 1731 66.612 35.089 59.015 1.00 0.00 H ATOM 96603 H2 WAT 1731 67.473 34.378 60.038 1.00 0.00 H TER 96605 WAT 1731 ATOM 96605 O WAT 1732 46.105 55.998 122.646 1.00 0.00 O ATOM 96606 H1 WAT 1732 46.314 55.801 123.559 1.00 0.00 H ATOM 96607 H2 WAT 1732 45.229 56.382 122.679 1.00 0.00 H TER 96609 WAT 1732 ATOM 96609 O WAT 1733 11.121 3.003 5.322 1.00 0.00 O ATOM 96610 H1 WAT 1733 11.652 3.199 6.094 1.00 0.00 H ATOM 96611 H2 WAT 1733 11.755 2.917 4.610 1.00 0.00 H TER 96613 WAT 1733 ATOM 96613 O WAT 1734 137.414 95.039 74.579 1.00 0.00 O ATOM 96614 H1 WAT 1734 137.752 95.261 73.711 1.00 0.00 H ATOM 96615 H2 WAT 1734 138.004 95.485 75.186 1.00 0.00 H TER 96617 WAT 1734 ATOM 96617 O WAT 1735 95.092 94.444 132.447 1.00 0.00 O ATOM 96618 H1 WAT 1735 95.566 94.051 131.714 1.00 0.00 H ATOM 96619 H2 WAT 1735 94.662 93.705 132.878 1.00 0.00 H TER 96621 WAT 1735 ATOM 96621 O WAT 1736 140.554 9.786 101.560 1.00 0.00 O ATOM 96622 H1 WAT 1736 141.399 9.912 101.128 1.00 0.00 H ATOM 96623 H2 WAT 1736 140.211 8.975 101.184 1.00 0.00 H TER 96625 WAT 1736 ATOM 96625 O WAT 1737 145.034 96.955 74.820 1.00 0.00 O ATOM 96626 H1 WAT 1737 145.658 97.679 74.876 1.00 0.00 H ATOM 96627 H2 WAT 1737 144.881 96.701 75.730 1.00 0.00 H TER 96629 WAT 1737 ATOM 96629 O WAT 1738 83.609 33.412 126.134 1.00 0.00 O ATOM 96630 H1 WAT 1738 82.681 33.179 126.152 1.00 0.00 H ATOM 96631 H2 WAT 1738 84.047 32.685 126.577 1.00 0.00 H TER 96633 WAT 1738 ATOM 96633 O WAT 1739 64.560 28.218 141.120 1.00 0.00 O ATOM 96634 H1 WAT 1739 64.916 29.092 141.274 1.00 0.00 H ATOM 96635 H2 WAT 1739 63.808 28.364 140.544 1.00 0.00 H TER 96637 WAT 1739 ATOM 96637 O WAT 1740 65.008 145.829 10.270 1.00 0.00 O ATOM 96638 H1 WAT 1740 64.534 144.998 10.303 1.00 0.00 H ATOM 96639 H2 WAT 1740 65.061 146.111 11.183 1.00 0.00 H TER 96641 WAT 1740 ATOM 96641 O WAT 1741 17.059 110.573 153.272 1.00 0.00 O ATOM 96642 H1 WAT 1741 17.478 111.183 152.665 1.00 0.00 H ATOM 96643 H2 WAT 1741 17.126 111.001 154.126 1.00 0.00 H TER 96645 WAT 1741 ATOM 96645 O WAT 1742 65.840 84.062 63.300 1.00 0.00 O ATOM 96646 H1 WAT 1742 65.742 84.919 63.715 1.00 0.00 H ATOM 96647 H2 WAT 1742 64.948 83.720 63.241 1.00 0.00 H TER 96649 WAT 1742 ATOM 96649 O WAT 1743 82.744 69.911 132.619 1.00 0.00 O ATOM 96650 H1 WAT 1743 82.308 70.376 131.904 1.00 0.00 H ATOM 96651 H2 WAT 1743 83.638 70.253 132.618 1.00 0.00 H TER 96653 WAT 1743 ATOM 96653 O WAT 1744 105.131 70.100 89.067 1.00 0.00 O ATOM 96654 H1 WAT 1744 104.673 70.940 89.087 1.00 0.00 H ATOM 96655 H2 WAT 1744 105.888 70.226 89.639 1.00 0.00 H TER 96657 WAT 1744 ATOM 96657 O WAT 1745 64.131 56.835 5.903 1.00 0.00 O ATOM 96658 H1 WAT 1745 64.631 56.601 6.685 1.00 0.00 H ATOM 96659 H2 WAT 1745 63.298 57.164 6.241 1.00 0.00 H TER 96661 WAT 1745 ATOM 96661 O WAT 1746 36.672 104.043 142.893 1.00 0.00 O ATOM 96662 H1 WAT 1746 36.456 104.915 143.222 1.00 0.00 H ATOM 96663 H2 WAT 1746 37.629 104.012 142.906 1.00 0.00 H TER 96665 WAT 1746 ATOM 96665 O WAT 1747 143.321 93.138 117.955 1.00 0.00 O ATOM 96666 H1 WAT 1747 142.514 92.923 118.422 1.00 0.00 H ATOM 96667 H2 WAT 1747 143.249 92.668 117.124 1.00 0.00 H TER 96669 WAT 1747 ATOM 96669 O WAT 1748 73.600 75.120 81.926 1.00 0.00 O ATOM 96670 H1 WAT 1748 74.412 74.622 81.838 1.00 0.00 H ATOM 96671 H2 WAT 1748 73.619 75.741 81.198 1.00 0.00 H TER 96673 WAT 1748 ATOM 96673 O WAT 1749 124.248 29.608 74.835 1.00 0.00 O ATOM 96674 H1 WAT 1749 123.730 29.737 74.041 1.00 0.00 H ATOM 96675 H2 WAT 1749 123.908 30.258 75.451 1.00 0.00 H TER 96677 WAT 1749 ATOM 96677 O WAT 1750 107.506 1.758 65.509 1.00 0.00 O ATOM 96678 H1 WAT 1750 107.135 1.300 64.754 1.00 0.00 H ATOM 96679 H2 WAT 1750 107.835 2.582 65.150 1.00 0.00 H TER 96681 WAT 1750 ATOM 96681 O WAT 1751 138.065 8.904 104.160 1.00 0.00 O ATOM 96682 H1 WAT 1751 137.551 8.469 103.480 1.00 0.00 H ATOM 96683 H2 WAT 1751 138.024 9.833 103.934 1.00 0.00 H TER 96685 WAT 1751 ATOM 96685 O WAT 1752 136.407 90.100 139.931 1.00 0.00 O ATOM 96686 H1 WAT 1752 136.261 90.915 139.451 1.00 0.00 H ATOM 96687 H2 WAT 1752 137.253 89.784 139.615 1.00 0.00 H TER 96689 WAT 1752 ATOM 96689 O WAT 1753 1.429 133.530 12.049 1.00 0.00 O ATOM 96690 H1 WAT 1753 1.122 134.126 12.733 1.00 0.00 H ATOM 96691 H2 WAT 1753 0.633 133.260 11.592 1.00 0.00 H TER 96693 WAT 1753 ATOM 96693 O WAT 1754 58.710 61.736 157.567 1.00 0.00 O ATOM 96694 H1 WAT 1754 59.283 61.656 158.330 1.00 0.00 H ATOM 96695 H2 WAT 1754 58.559 62.677 157.478 1.00 0.00 H TER 96697 WAT 1754 ATOM 96697 O WAT 1755 42.820 9.355 18.281 1.00 0.00 O ATOM 96698 H1 WAT 1755 42.364 8.849 17.608 1.00 0.00 H ATOM 96699 H2 WAT 1755 43.579 9.724 17.830 1.00 0.00 H TER 96701 WAT 1755 ATOM 96701 O WAT 1756 89.959 43.128 61.851 1.00 0.00 O ATOM 96702 H1 WAT 1756 90.433 42.316 61.669 1.00 0.00 H ATOM 96703 H2 WAT 1756 89.121 42.840 62.212 1.00 0.00 H TER 96705 WAT 1756 ATOM 96705 O WAT 1757 102.505 128.076 107.075 1.00 0.00 O ATOM 96706 H1 WAT 1757 102.928 128.914 107.266 1.00 0.00 H ATOM 96707 H2 WAT 1757 102.450 128.048 106.120 1.00 0.00 H TER 96709 WAT 1757 ATOM 96709 O WAT 1758 52.465 7.647 113.155 1.00 0.00 O ATOM 96710 H1 WAT 1758 52.457 7.357 112.243 1.00 0.00 H ATOM 96711 H2 WAT 1758 52.019 8.494 113.141 1.00 0.00 H TER 96713 WAT 1758 ATOM 96713 O WAT 1759 44.761 119.564 109.612 1.00 0.00 O ATOM 96714 H1 WAT 1759 44.901 118.874 110.260 1.00 0.00 H ATOM 96715 H2 WAT 1759 45.127 120.351 110.016 1.00 0.00 H TER 96717 WAT 1759 ATOM 96717 O WAT 1760 12.870 74.749 98.372 1.00 0.00 O ATOM 96718 H1 WAT 1760 12.853 74.034 99.008 1.00 0.00 H ATOM 96719 H2 WAT 1760 12.812 75.543 98.904 1.00 0.00 H TER 96721 WAT 1760 ATOM 96721 O WAT 1761 72.551 136.308 66.482 1.00 0.00 O ATOM 96722 H1 WAT 1761 73.063 137.011 66.882 1.00 0.00 H ATOM 96723 H2 WAT 1761 72.018 136.747 65.819 1.00 0.00 H TER 96725 WAT 1761 ATOM 96725 O WAT 1762 51.479 131.363 1.313 1.00 0.00 O ATOM 96726 H1 WAT 1762 51.750 131.006 0.467 1.00 0.00 H ATOM 96727 H2 WAT 1762 50.546 131.550 1.206 1.00 0.00 H TER 96729 WAT 1762 ATOM 96729 O WAT 1763 133.549 90.399 113.813 1.00 0.00 O ATOM 96730 H1 WAT 1763 133.134 89.538 113.758 1.00 0.00 H ATOM 96731 H2 WAT 1763 133.292 90.734 114.672 1.00 0.00 H TER 96733 WAT 1763 ATOM 96733 O WAT 1764 142.974 10.505 100.103 1.00 0.00 O ATOM 96734 H1 WAT 1764 143.333 9.701 99.725 1.00 0.00 H ATOM 96735 H2 WAT 1764 143.586 11.190 99.835 1.00 0.00 H TER 96737 WAT 1764 ATOM 96737 O WAT 1765 96.604 135.122 59.402 1.00 0.00 O ATOM 96738 H1 WAT 1765 95.734 134.877 59.717 1.00 0.00 H ATOM 96739 H2 WAT 1765 96.664 136.062 59.571 1.00 0.00 H TER 96741 WAT 1765 ATOM 96741 O WAT 1766 3.290 69.478 108.072 1.00 0.00 O ATOM 96742 H1 WAT 1766 2.510 69.556 108.622 1.00 0.00 H ATOM 96743 H2 WAT 1766 3.087 68.764 107.468 1.00 0.00 H TER 96745 WAT 1766 ATOM 96745 O WAT 1767 86.029 59.637 65.163 1.00 0.00 O ATOM 96746 H1 WAT 1767 85.368 59.606 65.854 1.00 0.00 H ATOM 96747 H2 WAT 1767 85.722 60.322 64.568 1.00 0.00 H TER 96749 WAT 1767 ATOM 96749 O WAT 1768 128.356 127.098 3.507 1.00 0.00 O ATOM 96750 H1 WAT 1768 128.199 126.192 3.773 1.00 0.00 H ATOM 96751 H2 WAT 1768 127.998 127.623 4.224 1.00 0.00 H TER 96753 WAT 1768 ATOM 96753 O WAT 1769 18.755 105.600 115.928 1.00 0.00 O ATOM 96754 H1 WAT 1769 19.561 105.972 116.287 1.00 0.00 H ATOM 96755 H2 WAT 1769 18.121 105.669 116.641 1.00 0.00 H TER 96757 WAT 1769 ATOM 96757 O WAT 1770 44.402 29.916 119.520 1.00 0.00 O ATOM 96758 H1 WAT 1770 44.261 30.040 120.458 1.00 0.00 H ATOM 96759 H2 WAT 1770 44.989 30.630 119.269 1.00 0.00 H TER 96761 WAT 1770 ATOM 96761 O WAT 1771 12.456 128.503 25.130 1.00 0.00 O ATOM 96762 H1 WAT 1771 11.893 128.147 24.443 1.00 0.00 H ATOM 96763 H2 WAT 1771 12.007 129.298 25.420 1.00 0.00 H TER 96765 WAT 1771 ATOM 96765 O WAT 1772 87.698 4.389 157.842 1.00 0.00 O ATOM 96766 H1 WAT 1772 87.723 3.451 157.654 1.00 0.00 H ATOM 96767 H2 WAT 1772 88.557 4.581 158.219 1.00 0.00 H TER 96769 WAT 1772 ATOM 96769 O WAT 1773 20.878 44.059 57.236 1.00 0.00 O ATOM 96770 H1 WAT 1773 21.443 43.708 57.924 1.00 0.00 H ATOM 96771 H2 WAT 1773 20.246 43.360 57.066 1.00 0.00 H TER 96773 WAT 1773 ATOM 96773 O WAT 1774 128.380 55.144 119.666 1.00 0.00 O ATOM 96774 H1 WAT 1774 127.709 54.573 119.292 1.00 0.00 H ATOM 96775 H2 WAT 1774 129.075 54.548 119.944 1.00 0.00 H TER 96777 WAT 1774 ATOM 96777 O WAT 1775 24.869 15.070 14.050 1.00 0.00 O ATOM 96778 H1 WAT 1775 25.103 15.064 14.979 1.00 0.00 H ATOM 96779 H2 WAT 1775 25.587 14.607 13.619 1.00 0.00 H TER 96781 WAT 1775 ATOM 96781 O WAT 1776 55.232 135.100 155.337 1.00 0.00 O ATOM 96782 H1 WAT 1776 54.937 135.361 156.210 1.00 0.00 H ATOM 96783 H2 WAT 1776 54.947 135.813 154.765 1.00 0.00 H TER 96785 WAT 1776 ATOM 96785 O WAT 1777 129.051 54.892 139.276 1.00 0.00 O ATOM 96786 H1 WAT 1777 129.960 54.606 139.370 1.00 0.00 H ATOM 96787 H2 WAT 1777 128.942 55.567 139.946 1.00 0.00 H TER 96789 WAT 1777 ATOM 96789 O WAT 1778 6.033 73.547 98.699 1.00 0.00 O ATOM 96790 H1 WAT 1778 6.960 73.565 98.460 1.00 0.00 H ATOM 96791 H2 WAT 1778 5.569 73.657 97.869 1.00 0.00 H TER 96793 WAT 1778 ATOM 96793 O WAT 1779 61.815 60.157 8.078 1.00 0.00 O ATOM 96794 H1 WAT 1779 62.299 60.949 7.844 1.00 0.00 H ATOM 96795 H2 WAT 1779 61.486 60.330 8.960 1.00 0.00 H TER 96797 WAT 1779 ATOM 96797 O WAT 1780 95.349 24.034 60.500 1.00 0.00 O ATOM 96798 H1 WAT 1780 95.339 23.394 59.788 1.00 0.00 H ATOM 96799 H2 WAT 1780 94.873 24.787 60.151 1.00 0.00 H TER 96801 WAT 1780 ATOM 96801 O WAT 1781 4.873 144.880 110.181 1.00 0.00 O ATOM 96802 H1 WAT 1781 4.776 144.657 111.107 1.00 0.00 H ATOM 96803 H2 WAT 1781 5.048 145.821 110.178 1.00 0.00 H TER 96805 WAT 1781 ATOM 96805 O WAT 1782 5.683 51.862 109.876 1.00 0.00 O ATOM 96806 H1 WAT 1782 5.539 50.951 109.619 1.00 0.00 H ATOM 96807 H2 WAT 1782 6.543 52.078 109.514 1.00 0.00 H TER 96809 WAT 1782 ATOM 96809 O WAT 1783 46.774 60.337 95.348 1.00 0.00 O ATOM 96810 H1 WAT 1783 47.451 59.746 95.020 1.00 0.00 H ATOM 96811 H2 WAT 1783 47.157 61.211 95.264 1.00 0.00 H TER 96813 WAT 1783 ATOM 96813 O WAT 1784 12.568 143.511 126.574 1.00 0.00 O ATOM 96814 H1 WAT 1784 13.197 143.244 127.245 1.00 0.00 H ATOM 96815 H2 WAT 1784 12.787 144.424 126.389 1.00 0.00 H TER 96817 WAT 1784 ATOM 96817 O WAT 1785 136.163 10.141 142.025 1.00 0.00 O ATOM 96818 H1 WAT 1785 136.570 9.658 141.306 1.00 0.00 H ATOM 96819 H2 WAT 1785 136.315 11.062 141.811 1.00 0.00 H TER 96821 WAT 1785 ATOM 96821 O WAT 1786 23.936 70.131 100.237 1.00 0.00 O ATOM 96822 H1 WAT 1786 23.362 69.700 99.604 1.00 0.00 H ATOM 96823 H2 WAT 1786 23.855 69.603 101.032 1.00 0.00 H TER 96825 WAT 1786 ATOM 96825 O WAT 1787 129.468 6.946 6.122 1.00 0.00 O ATOM 96826 H1 WAT 1787 128.600 6.864 6.517 1.00 0.00 H ATOM 96827 H2 WAT 1787 130.063 7.030 6.867 1.00 0.00 H TER 96829 WAT 1787 ATOM 96829 O WAT 1788 46.992 110.400 4.484 1.00 0.00 O ATOM 96830 H1 WAT 1788 47.667 110.881 4.963 1.00 0.00 H ATOM 96831 H2 WAT 1788 46.167 110.707 4.859 1.00 0.00 H TER 96833 WAT 1788 ATOM 96833 O WAT 1789 138.472 114.756 146.905 1.00 0.00 O ATOM 96834 H1 WAT 1789 138.692 114.283 146.102 1.00 0.00 H ATOM 96835 H2 WAT 1789 139.244 114.654 147.462 1.00 0.00 H TER 96837 WAT 1789 ATOM 96837 O WAT 1790 111.924 30.956 100.619 1.00 0.00 O ATOM 96838 H1 WAT 1790 111.881 30.998 99.664 1.00 0.00 H ATOM 96839 H2 WAT 1790 111.499 30.128 100.842 1.00 0.00 H TER 96841 WAT 1790 ATOM 96841 O WAT 1791 16.183 87.440 130.301 1.00 0.00 O ATOM 96842 H1 WAT 1791 16.268 88.247 130.810 1.00 0.00 H ATOM 96843 H2 WAT 1791 16.949 87.438 129.727 1.00 0.00 H TER 96845 WAT 1791 ATOM 96845 O WAT 1792 52.156 66.453 22.615 1.00 0.00 O ATOM 96846 H1 WAT 1792 52.917 66.331 23.183 1.00 0.00 H ATOM 96847 H2 WAT 1792 51.446 66.689 23.212 1.00 0.00 H TER 96849 WAT 1792 ATOM 96849 O WAT 1793 106.722 140.969 67.824 1.00 0.00 O ATOM 96850 H1 WAT 1793 105.997 140.957 68.450 1.00 0.00 H ATOM 96851 H2 WAT 1793 106.702 140.103 67.418 1.00 0.00 H TER 96853 WAT 1793 ATOM 96853 O WAT 1794 68.920 4.433 83.694 1.00 0.00 O ATOM 96854 H1 WAT 1794 69.664 4.304 84.282 1.00 0.00 H ATOM 96855 H2 WAT 1794 69.283 4.913 82.950 1.00 0.00 H TER 96857 WAT 1794 ATOM 96857 O WAT 1795 76.481 65.900 99.656 1.00 0.00 O ATOM 96858 H1 WAT 1795 75.962 66.649 99.365 1.00 0.00 H ATOM 96859 H2 WAT 1795 77.189 66.285 100.172 1.00 0.00 H TER 96861 WAT 1795 ATOM 96861 O WAT 1796 45.364 20.803 142.346 1.00 0.00 O ATOM 96862 H1 WAT 1796 46.028 20.603 141.686 1.00 0.00 H ATOM 96863 H2 WAT 1796 45.853 20.863 143.167 1.00 0.00 H TER 96865 WAT 1796 ATOM 96865 O WAT 1797 7.090 131.731 6.840 1.00 0.00 O ATOM 96866 H1 WAT 1797 7.004 132.464 7.450 1.00 0.00 H ATOM 96867 H2 WAT 1797 6.808 130.967 7.343 1.00 0.00 H TER 96869 WAT 1797 ATOM 96869 O WAT 1798 68.467 86.071 133.609 1.00 0.00 O ATOM 96870 H1 WAT 1798 69.089 85.530 134.097 1.00 0.00 H ATOM 96871 H2 WAT 1798 69.010 86.560 132.990 1.00 0.00 H TER 96873 WAT 1798 ATOM 96873 O WAT 1799 108.874 14.246 137.446 1.00 0.00 O ATOM 96874 H1 WAT 1799 108.180 14.767 137.043 1.00 0.00 H ATOM 96875 H2 WAT 1799 108.499 13.369 137.527 1.00 0.00 H TER 96877 WAT 1799 ATOM 96877 O WAT 1800 120.337 58.920 150.193 1.00 0.00 O ATOM 96878 H1 WAT 1800 120.386 59.835 150.470 1.00 0.00 H ATOM 96879 H2 WAT 1800 120.521 58.419 150.988 1.00 0.00 H TER 96881 WAT 1800 ATOM 96881 O WAT 1801 145.250 7.111 59.904 1.00 0.00 O ATOM 96882 H1 WAT 1801 145.427 7.896 59.386 1.00 0.00 H ATOM 96883 H2 WAT 1801 144.349 7.224 60.208 1.00 0.00 H TER 96885 WAT 1801 ATOM 96885 O WAT 1802 27.486 78.406 126.508 1.00 0.00 O ATOM 96886 H1 WAT 1802 27.893 78.895 125.793 1.00 0.00 H ATOM 96887 H2 WAT 1802 26.582 78.719 126.529 1.00 0.00 H TER 96889 WAT 1802 ATOM 96889 O WAT 1803 64.434 117.588 85.991 1.00 0.00 O ATOM 96890 H1 WAT 1803 64.483 117.307 85.077 1.00 0.00 H ATOM 96891 H2 WAT 1803 64.001 116.864 86.442 1.00 0.00 H TER 96893 WAT 1803 ATOM 96893 O WAT 1804 45.875 21.841 129.554 1.00 0.00 O ATOM 96894 H1 WAT 1804 45.765 22.073 130.477 1.00 0.00 H ATOM 96895 H2 WAT 1804 46.542 21.155 129.557 1.00 0.00 H TER 96897 WAT 1804 ATOM 96897 O WAT 1805 89.078 81.975 133.379 1.00 0.00 O ATOM 96898 H1 WAT 1805 88.161 81.823 133.152 1.00 0.00 H ATOM 96899 H2 WAT 1805 89.548 81.246 132.975 1.00 0.00 H TER 96901 WAT 1805 ATOM 96901 O WAT 1806 12.802 52.122 125.604 1.00 0.00 O ATOM 96902 H1 WAT 1806 13.166 51.969 124.731 1.00 0.00 H ATOM 96903 H2 WAT 1806 12.546 51.253 125.912 1.00 0.00 H TER 96905 WAT 1806 ATOM 96905 O WAT 1807 91.102 109.896 119.466 1.00 0.00 O ATOM 96906 H1 WAT 1807 91.769 110.583 119.485 1.00 0.00 H ATOM 96907 H2 WAT 1807 90.396 110.232 120.018 1.00 0.00 H TER 96909 WAT 1807 ATOM 96909 O WAT 1808 10.358 118.094 90.945 1.00 0.00 O ATOM 96910 H1 WAT 1808 10.797 117.272 91.162 1.00 0.00 H ATOM 96911 H2 WAT 1808 11.061 118.666 90.636 1.00 0.00 H TER 96913 WAT 1808 ATOM 96913 O WAT 1809 117.029 27.140 106.326 1.00 0.00 O ATOM 96914 H1 WAT 1809 117.962 26.954 106.222 1.00 0.00 H ATOM 96915 H2 WAT 1809 116.959 28.088 106.216 1.00 0.00 H TER 96917 WAT 1809 ATOM 96917 O WAT 1810 105.896 139.923 75.019 1.00 0.00 O ATOM 96918 H1 WAT 1810 106.212 139.497 75.815 1.00 0.00 H ATOM 96919 H2 WAT 1810 106.289 140.796 75.042 1.00 0.00 H TER 96921 WAT 1810 ATOM 96921 O WAT 1811 103.261 72.432 10.715 1.00 0.00 O ATOM 96922 H1 WAT 1811 102.947 73.214 11.169 1.00 0.00 H ATOM 96923 H2 WAT 1811 102.555 71.794 10.822 1.00 0.00 H TER 96925 WAT 1811 ATOM 96925 O WAT 1812 103.402 69.547 110.571 1.00 0.00 O ATOM 96926 H1 WAT 1812 103.451 69.178 111.453 1.00 0.00 H ATOM 96927 H2 WAT 1812 104.312 69.732 110.339 1.00 0.00 H TER 96929 WAT 1812 ATOM 96929 O WAT 1813 65.896 87.260 150.013 1.00 0.00 O ATOM 96930 H1 WAT 1813 65.885 86.324 150.213 1.00 0.00 H ATOM 96931 H2 WAT 1813 66.473 87.336 149.254 1.00 0.00 H TER 96933 WAT 1813 ATOM 96933 O WAT 1814 35.692 101.967 106.396 1.00 0.00 O ATOM 96934 H1 WAT 1814 35.405 101.373 107.089 1.00 0.00 H ATOM 96935 H2 WAT 1814 35.098 102.715 106.461 1.00 0.00 H TER 96937 WAT 1814 ATOM 96937 O WAT 1815 79.885 73.612 140.899 1.00 0.00 O ATOM 96938 H1 WAT 1815 79.883 72.655 140.888 1.00 0.00 H ATOM 96939 H2 WAT 1815 79.187 73.860 140.293 1.00 0.00 H TER 96941 WAT 1815 ATOM 96941 O WAT 1816 58.903 81.731 127.456 1.00 0.00 O ATOM 96942 H1 WAT 1816 59.555 81.157 127.055 1.00 0.00 H ATOM 96943 H2 WAT 1816 59.103 81.704 128.392 1.00 0.00 H TER 96945 WAT 1816 ATOM 96945 O WAT 1817 82.776 90.512 16.217 1.00 0.00 O ATOM 96946 H1 WAT 1817 83.489 90.253 16.802 1.00 0.00 H ATOM 96947 H2 WAT 1817 83.067 91.341 15.837 1.00 0.00 H TER 96949 WAT 1817 ATOM 96949 O WAT 1818 119.424 76.313 151.302 1.00 0.00 O ATOM 96950 H1 WAT 1818 120.379 76.340 151.360 1.00 0.00 H ATOM 96951 H2 WAT 1818 119.185 77.142 150.887 1.00 0.00 H TER 96953 WAT 1818 ATOM 96953 O WAT 1819 22.803 60.666 76.428 1.00 0.00 O ATOM 96954 H1 WAT 1819 21.863 60.834 76.369 1.00 0.00 H ATOM 96955 H2 WAT 1819 23.210 61.510 76.235 1.00 0.00 H TER 96957 WAT 1819 ATOM 96957 O WAT 1820 80.287 66.441 106.409 1.00 0.00 O ATOM 96958 H1 WAT 1820 79.388 66.707 106.215 1.00 0.00 H ATOM 96959 H2 WAT 1820 80.829 67.013 105.865 1.00 0.00 H TER 96961 WAT 1820 ATOM 96961 O WAT 1821 117.303 103.573 65.464 1.00 0.00 O ATOM 96962 H1 WAT 1821 117.665 103.062 64.740 1.00 0.00 H ATOM 96963 H2 WAT 1821 117.973 103.529 66.146 1.00 0.00 H TER 96965 WAT 1821 ATOM 96965 O WAT 1822 138.944 100.015 155.758 1.00 0.00 O ATOM 96966 H1 WAT 1822 139.440 100.435 155.055 1.00 0.00 H ATOM 96967 H2 WAT 1822 138.904 99.093 155.504 1.00 0.00 H TER 96969 WAT 1822 ATOM 96969 O WAT 1823 29.286 72.553 104.339 1.00 0.00 O ATOM 96970 H1 WAT 1823 28.367 72.741 104.147 1.00 0.00 H ATOM 96971 H2 WAT 1823 29.541 73.225 104.970 1.00 0.00 H TER 96973 WAT 1823 ATOM 96973 O WAT 1824 73.301 133.109 142.919 1.00 0.00 O ATOM 96974 H1 WAT 1824 72.407 132.907 142.640 1.00 0.00 H ATOM 96975 H2 WAT 1824 73.191 133.662 143.692 1.00 0.00 H TER 96977 WAT 1824 ATOM 96977 O WAT 1825 141.458 59.115 58.452 1.00 0.00 O ATOM 96978 H1 WAT 1825 140.837 58.388 58.413 1.00 0.00 H ATOM 96979 H2 WAT 1825 140.956 59.875 58.156 1.00 0.00 H TER 96981 WAT 1825 ATOM 96981 O WAT 1826 110.407 44.088 152.833 1.00 0.00 O ATOM 96982 H1 WAT 1826 110.124 44.212 151.927 1.00 0.00 H ATOM 96983 H2 WAT 1826 109.621 44.251 153.354 1.00 0.00 H TER 96985 WAT 1826 ATOM 96985 O WAT 1827 86.305 18.586 145.717 1.00 0.00 O ATOM 96986 H1 WAT 1827 86.799 17.887 145.290 1.00 0.00 H ATOM 96987 H2 WAT 1827 85.403 18.456 145.424 1.00 0.00 H TER 96989 WAT 1827 ATOM 96989 O WAT 1828 17.652 91.893 153.015 1.00 0.00 O ATOM 96990 H1 WAT 1828 16.950 91.902 153.665 1.00 0.00 H ATOM 96991 H2 WAT 1828 17.211 91.689 152.190 1.00 0.00 H TER 96993 WAT 1828 ATOM 96993 O WAT 1829 108.816 3.782 64.303 1.00 0.00 O ATOM 96994 H1 WAT 1829 109.648 4.218 64.488 1.00 0.00 H ATOM 96995 H2 WAT 1829 108.269 4.466 63.917 1.00 0.00 H TER 96997 WAT 1829 ATOM 96997 O WAT 1830 132.894 79.413 148.543 1.00 0.00 O ATOM 96998 H1 WAT 1830 131.947 79.522 148.629 1.00 0.00 H ATOM 96999 H2 WAT 1830 133.247 79.702 149.384 1.00 0.00 H TER 97001 WAT 1830 ATOM 97001 O WAT 1831 10.253 69.618 81.555 1.00 0.00 O ATOM 97002 H1 WAT 1831 9.840 69.066 82.219 1.00 0.00 H ATOM 97003 H2 WAT 1831 10.550 69.004 80.883 1.00 0.00 H TER 97005 WAT 1831 ATOM 97005 O WAT 1832 75.636 118.235 125.778 1.00 0.00 O ATOM 97006 H1 WAT 1832 75.293 119.111 125.601 1.00 0.00 H ATOM 97007 H2 WAT 1832 75.355 118.043 126.672 1.00 0.00 H TER 97009 WAT 1832 ATOM 97009 O WAT 1833 96.748 31.870 66.551 1.00 0.00 O ATOM 97010 H1 WAT 1833 96.915 32.404 65.775 1.00 0.00 H ATOM 97011 H2 WAT 1833 95.937 32.224 66.916 1.00 0.00 H TER 97013 WAT 1833 ATOM 97013 O WAT 1834 112.604 130.411 80.096 1.00 0.00 O ATOM 97014 H1 WAT 1834 112.336 131.328 80.159 1.00 0.00 H ATOM 97015 H2 WAT 1834 112.383 130.159 79.200 1.00 0.00 H TER 97017 WAT 1834 ATOM 97017 O WAT 1835 121.899 92.827 3.486 1.00 0.00 O ATOM 97018 H1 WAT 1835 121.447 92.034 3.774 1.00 0.00 H ATOM 97019 H2 WAT 1835 121.534 93.523 4.033 1.00 0.00 H TER 97021 WAT 1835 ATOM 97021 O WAT 1836 104.754 142.857 96.391 1.00 0.00 O ATOM 97022 H1 WAT 1836 105.327 142.200 95.994 1.00 0.00 H ATOM 97023 H2 WAT 1836 105.354 143.511 96.749 1.00 0.00 H TER 97025 WAT 1836 ATOM 97025 O WAT 1837 93.901 28.301 62.001 1.00 0.00 O ATOM 97026 H1 WAT 1837 94.100 27.844 61.184 1.00 0.00 H ATOM 97027 H2 WAT 1837 94.315 29.158 61.904 1.00 0.00 H TER 97029 WAT 1837 ATOM 97029 O WAT 1838 83.954 88.025 90.683 1.00 0.00 O ATOM 97030 H1 WAT 1838 84.584 88.183 91.387 1.00 0.00 H ATOM 97031 H2 WAT 1838 84.369 87.357 90.136 1.00 0.00 H TER 97033 WAT 1838 ATOM 97033 O WAT 1839 143.588 132.418 79.201 1.00 0.00 O ATOM 97034 H1 WAT 1839 143.250 131.537 79.358 1.00 0.00 H ATOM 97035 H2 WAT 1839 144.029 132.359 78.354 1.00 0.00 H TER 97037 WAT 1839 ATOM 97037 O WAT 1840 29.414 1.079 75.130 1.00 0.00 O ATOM 97038 H1 WAT 1840 29.624 1.835 74.582 1.00 0.00 H ATOM 97039 H2 WAT 1840 30.246 0.843 75.541 1.00 0.00 H TER 97041 WAT 1840 ATOM 97041 O WAT 1841 70.660 91.588 7.893 1.00 0.00 O ATOM 97042 H1 WAT 1841 71.081 90.887 7.396 1.00 0.00 H ATOM 97043 H2 WAT 1841 71.365 92.207 8.078 1.00 0.00 H TER 97045 WAT 1841 ATOM 97045 O WAT 1842 23.537 1.169 148.886 1.00 0.00 O ATOM 97046 H1 WAT 1842 24.249 0.639 148.526 1.00 0.00 H ATOM 97047 H2 WAT 1842 23.975 1.929 149.269 1.00 0.00 H TER 97049 WAT 1842 ATOM 97049 O WAT 1843 85.371 9.366 126.152 1.00 0.00 O ATOM 97050 H1 WAT 1843 85.598 10.149 126.654 1.00 0.00 H ATOM 97051 H2 WAT 1843 84.538 9.076 126.525 1.00 0.00 H TER 97053 WAT 1843 ATOM 97053 O WAT 1844 31.814 136.170 82.921 1.00 0.00 O ATOM 97054 H1 WAT 1844 31.352 136.413 83.723 1.00 0.00 H ATOM 97055 H2 WAT 1844 31.247 135.520 82.506 1.00 0.00 H TER 97057 WAT 1844 ATOM 97057 O WAT 1845 25.139 105.511 14.792 1.00 0.00 O ATOM 97058 H1 WAT 1845 24.943 105.184 13.914 1.00 0.00 H ATOM 97059 H2 WAT 1845 25.776 104.888 15.142 1.00 0.00 H TER 97061 WAT 1845 ATOM 97061 O WAT 1846 111.419 55.661 138.668 1.00 0.00 O ATOM 97062 H1 WAT 1846 111.544 55.652 139.617 1.00 0.00 H ATOM 97063 H2 WAT 1846 110.871 54.897 138.491 1.00 0.00 H TER 97065 WAT 1846 ATOM 97065 O WAT 1847 68.973 31.988 65.172 1.00 0.00 O ATOM 97066 H1 WAT 1847 69.416 31.783 64.348 1.00 0.00 H ATOM 97067 H2 WAT 1847 69.296 32.857 65.408 1.00 0.00 H TER 97069 WAT 1847 ATOM 97069 O WAT 1848 50.897 69.892 95.638 1.00 0.00 O ATOM 97070 H1 WAT 1848 51.281 70.428 96.332 1.00 0.00 H ATOM 97071 H2 WAT 1848 50.529 70.527 95.022 1.00 0.00 H TER 97073 WAT 1848 ATOM 97073 O WAT 1849 91.606 91.180 112.201 1.00 0.00 O ATOM 97074 H1 WAT 1849 91.876 91.435 111.319 1.00 0.00 H ATOM 97075 H2 WAT 1849 91.314 90.273 112.109 1.00 0.00 H TER 97077 WAT 1849 ATOM 97077 O WAT 1850 40.277 118.423 147.475 1.00 0.00 O ATOM 97078 H1 WAT 1850 40.363 117.574 147.043 1.00 0.00 H ATOM 97079 H2 WAT 1850 40.128 118.210 148.396 1.00 0.00 H TER 97081 WAT 1850 ATOM 97081 O WAT 1851 6.330 119.656 109.666 1.00 0.00 O ATOM 97082 H1 WAT 1851 6.849 119.904 108.901 1.00 0.00 H ATOM 97083 H2 WAT 1851 6.879 119.027 110.134 1.00 0.00 H TER 97085 WAT 1851 ATOM 97085 O WAT 1852 15.417 141.418 146.863 1.00 0.00 O ATOM 97086 H1 WAT 1852 16.028 142.135 146.693 1.00 0.00 H ATOM 97087 H2 WAT 1852 14.552 141.825 146.824 1.00 0.00 H TER 97089 WAT 1852 ATOM 97089 O WAT 1853 34.811 29.184 109.574 1.00 0.00 O ATOM 97090 H1 WAT 1853 34.918 30.106 109.806 1.00 0.00 H ATOM 97091 H2 WAT 1853 35.158 28.706 110.327 1.00 0.00 H TER 97093 WAT 1853 ATOM 97093 O WAT 1854 71.293 36.167 131.441 1.00 0.00 O ATOM 97094 H1 WAT 1854 70.377 36.092 131.173 1.00 0.00 H ATOM 97095 H2 WAT 1854 71.603 35.263 131.491 1.00 0.00 H TER 97097 WAT 1854 ATOM 97097 O WAT 1855 85.349 92.090 121.176 1.00 0.00 O ATOM 97098 H1 WAT 1855 85.734 91.533 120.500 1.00 0.00 H ATOM 97099 H2 WAT 1855 86.003 92.773 121.326 1.00 0.00 H TER 97101 WAT 1855 ATOM 97101 O WAT 1856 74.476 110.824 102.500 1.00 0.00 O ATOM 97102 H1 WAT 1856 74.605 110.847 103.448 1.00 0.00 H ATOM 97103 H2 WAT 1856 74.310 109.902 102.303 1.00 0.00 H TER 97105 WAT 1856 ATOM 97105 O WAT 1857 115.896 104.640 97.232 1.00 0.00 O ATOM 97106 H1 WAT 1857 116.352 105.361 96.798 1.00 0.00 H ATOM 97107 H2 WAT 1857 116.593 104.131 97.646 1.00 0.00 H TER 97109 WAT 1857 ATOM 97109 O WAT 1858 47.977 22.223 85.388 1.00 0.00 O ATOM 97110 H1 WAT 1858 48.379 21.390 85.142 1.00 0.00 H ATOM 97111 H2 WAT 1858 47.558 22.047 86.230 1.00 0.00 H TER 97113 WAT 1858 ATOM 97113 O WAT 1859 6.821 35.179 105.049 1.00 0.00 O ATOM 97114 H1 WAT 1859 6.016 35.697 105.042 1.00 0.00 H ATOM 97115 H2 WAT 1859 6.629 34.448 105.636 1.00 0.00 H TER 97117 WAT 1859 ATOM 97117 O WAT 1860 56.134 19.924 149.260 1.00 0.00 O ATOM 97118 H1 WAT 1860 56.508 20.268 150.071 1.00 0.00 H ATOM 97119 H2 WAT 1860 56.702 19.190 149.026 1.00 0.00 H TER 97121 WAT 1860 ATOM 97121 O WAT 1861 55.217 60.908 120.177 1.00 0.00 O ATOM 97122 H1 WAT 1861 55.383 60.912 119.235 1.00 0.00 H ATOM 97123 H2 WAT 1861 54.721 60.104 120.330 1.00 0.00 H TER 97125 WAT 1861 ATOM 97125 O WAT 1862 32.060 100.926 111.770 1.00 0.00 O ATOM 97126 H1 WAT 1862 31.884 101.340 110.925 1.00 0.00 H ATOM 97127 H2 WAT 1862 31.397 100.238 111.842 1.00 0.00 H TER 97129 WAT 1862 ATOM 97129 O WAT 1863 97.409 66.755 109.567 1.00 0.00 O ATOM 97130 H1 WAT 1863 97.910 66.167 110.132 1.00 0.00 H ATOM 97131 H2 WAT 1863 96.609 66.270 109.366 1.00 0.00 H TER 97133 WAT 1863 ATOM 97133 O WAT 1864 139.162 96.847 10.227 1.00 0.00 O ATOM 97134 H1 WAT 1864 139.488 96.042 10.630 1.00 0.00 H ATOM 97135 H2 WAT 1864 139.263 97.513 10.908 1.00 0.00 H TER 97137 WAT 1864 ATOM 97137 O WAT 1865 105.831 53.654 145.434 1.00 0.00 O ATOM 97138 H1 WAT 1865 106.031 54.494 145.020 1.00 0.00 H ATOM 97139 H2 WAT 1865 106.074 53.000 144.779 1.00 0.00 H TER 97141 WAT 1865 ATOM 97141 O WAT 1866 69.058 45.582 63.965 1.00 0.00 O ATOM 97142 H1 WAT 1866 69.544 44.838 63.610 1.00 0.00 H ATOM 97143 H2 WAT 1866 69.541 46.350 63.660 1.00 0.00 H TER 97145 WAT 1866 ATOM 97145 O WAT 1867 77.245 100.499 157.086 1.00 0.00 O ATOM 97146 H1 WAT 1867 77.471 99.580 156.941 1.00 0.00 H ATOM 97147 H2 WAT 1867 76.653 100.484 157.838 1.00 0.00 H TER 97149 WAT 1867 ATOM 97149 O WAT 1868 89.987 88.787 24.284 1.00 0.00 O ATOM 97150 H1 WAT 1868 89.478 88.937 25.080 1.00 0.00 H ATOM 97151 H2 WAT 1868 90.578 89.539 24.231 1.00 0.00 H TER 97153 WAT 1868 ATOM 97153 O WAT 1869 44.937 127.358 14.180 1.00 0.00 O ATOM 97154 H1 WAT 1869 45.431 126.545 14.283 1.00 0.00 H ATOM 97155 H2 WAT 1869 44.129 127.211 14.670 1.00 0.00 H TER 97157 WAT 1869 ATOM 97157 O WAT 1870 38.150 33.693 64.761 1.00 0.00 O ATOM 97158 H1 WAT 1870 38.819 34.071 65.332 1.00 0.00 H ATOM 97159 H2 WAT 1870 37.635 34.444 64.466 1.00 0.00 H TER 97161 WAT 1870 ATOM 97161 O WAT 1871 44.678 75.098 129.693 1.00 0.00 O ATOM 97162 H1 WAT 1871 44.489 74.440 130.362 1.00 0.00 H ATOM 97163 H2 WAT 1871 44.459 75.932 130.108 1.00 0.00 H TER 97165 WAT 1871 ATOM 97165 O WAT 1872 33.935 19.733 151.463 1.00 0.00 O ATOM 97166 H1 WAT 1872 34.048 18.788 151.366 1.00 0.00 H ATOM 97167 H2 WAT 1872 34.670 20.113 150.983 1.00 0.00 H TER 97169 WAT 1872 ATOM 97169 O WAT 1873 75.743 89.404 97.389 1.00 0.00 O ATOM 97170 H1 WAT 1873 75.780 89.158 98.313 1.00 0.00 H ATOM 97171 H2 WAT 1873 76.407 88.857 96.969 1.00 0.00 H TER 97173 WAT 1873 ATOM 97173 O WAT 1874 52.982 20.906 80.097 1.00 0.00 O ATOM 97174 H1 WAT 1874 52.083 20.585 80.029 1.00 0.00 H ATOM 97175 H2 WAT 1874 53.309 20.896 79.197 1.00 0.00 H TER 97177 WAT 1874 ATOM 97177 O WAT 1875 10.955 85.288 69.503 1.00 0.00 O ATOM 97178 H1 WAT 1875 10.742 84.955 68.631 1.00 0.00 H ATOM 97179 H2 WAT 1875 11.217 86.196 69.356 1.00 0.00 H TER 97181 WAT 1875 ATOM 97181 O WAT 1876 47.854 138.687 109.995 1.00 0.00 O ATOM 97182 H1 WAT 1876 47.031 138.263 109.752 1.00 0.00 H ATOM 97183 H2 WAT 1876 48.291 138.053 110.564 1.00 0.00 H TER 97185 WAT 1876 ATOM 97185 O WAT 1877 115.706 9.641 115.482 1.00 0.00 O ATOM 97186 H1 WAT 1877 115.435 8.994 114.831 1.00 0.00 H ATOM 97187 H2 WAT 1877 115.133 9.480 116.232 1.00 0.00 H TER 97189 WAT 1877 ATOM 97189 O WAT 1878 65.934 137.695 16.941 1.00 0.00 O ATOM 97190 H1 WAT 1878 65.029 137.395 16.853 1.00 0.00 H ATOM 97191 H2 WAT 1878 66.446 136.891 17.024 1.00 0.00 H TER 97193 WAT 1878 ATOM 97193 O WAT 1879 110.677 8.287 108.899 1.00 0.00 O ATOM 97194 H1 WAT 1879 109.965 8.073 109.502 1.00 0.00 H ATOM 97195 H2 WAT 1879 111.399 7.719 109.170 1.00 0.00 H TER 97197 WAT 1879 ATOM 97197 O WAT 1880 75.046 137.936 143.217 1.00 0.00 O ATOM 97198 H1 WAT 1880 75.839 138.472 143.226 1.00 0.00 H ATOM 97199 H2 WAT 1880 75.016 137.567 142.334 1.00 0.00 H TER 97201 WAT 1880 ATOM 97201 O WAT 1881 77.608 49.429 14.845 1.00 0.00 O ATOM 97202 H1 WAT 1881 76.860 50.020 14.759 1.00 0.00 H ATOM 97203 H2 WAT 1881 77.302 48.600 14.478 1.00 0.00 H TER 97205 WAT 1881 ATOM 97205 O WAT 1882 73.770 17.888 22.587 1.00 0.00 O ATOM 97206 H1 WAT 1882 73.077 17.676 23.211 1.00 0.00 H ATOM 97207 H2 WAT 1882 73.433 18.639 22.100 1.00 0.00 H TER 97209 WAT 1882 ATOM 97209 O WAT 1883 130.662 134.044 137.438 1.00 0.00 O ATOM 97210 H1 WAT 1883 131.461 133.790 136.976 1.00 0.00 H ATOM 97211 H2 WAT 1883 130.953 134.683 138.088 1.00 0.00 H TER 97213 WAT 1883 ATOM 97213 O WAT 1884 96.619 61.975 137.007 1.00 0.00 O ATOM 97214 H1 WAT 1884 95.934 61.545 136.495 1.00 0.00 H ATOM 97215 H2 WAT 1884 97.403 61.908 136.462 1.00 0.00 H TER 97217 WAT 1884 ATOM 97217 O WAT 1885 38.152 105.545 139.658 1.00 0.00 O ATOM 97218 H1 WAT 1885 38.304 105.818 138.753 1.00 0.00 H ATOM 97219 H2 WAT 1885 38.488 106.269 140.186 1.00 0.00 H TER 97221 WAT 1885 ATOM 97221 O WAT 1886 135.808 57.753 131.322 1.00 0.00 O ATOM 97222 H1 WAT 1886 136.272 57.923 132.142 1.00 0.00 H ATOM 97223 H2 WAT 1886 135.685 56.803 131.310 1.00 0.00 H TER 97225 WAT 1886 ATOM 97225 O WAT 1887 71.504 114.907 99.650 1.00 0.00 O ATOM 97226 H1 WAT 1887 71.743 114.101 100.108 1.00 0.00 H ATOM 97227 H2 WAT 1887 71.276 114.622 98.766 1.00 0.00 H TER 97229 WAT 1887 ATOM 97229 O WAT 1888 53.417 94.908 57.234 1.00 0.00 O ATOM 97230 H1 WAT 1888 52.521 94.774 56.924 1.00 0.00 H ATOM 97231 H2 WAT 1888 53.644 94.089 57.673 1.00 0.00 H TER 97233 WAT 1888 ATOM 97233 O WAT 1889 3.753 2.176 92.933 1.00 0.00 O ATOM 97234 H1 WAT 1889 3.318 1.646 93.601 1.00 0.00 H ATOM 97235 H2 WAT 1889 3.136 2.885 92.751 1.00 0.00 H TER 97237 WAT 1889 ATOM 97237 O WAT 1890 28.937 8.486 127.901 1.00 0.00 O ATOM 97238 H1 WAT 1890 28.753 7.756 128.492 1.00 0.00 H ATOM 97239 H2 WAT 1890 29.860 8.690 128.054 1.00 0.00 H TER 97241 WAT 1890 ATOM 97241 O WAT 1891 94.737 26.503 6.611 1.00 0.00 O ATOM 97242 H1 WAT 1891 93.880 26.185 6.897 1.00 0.00 H ATOM 97243 H2 WAT 1891 95.066 25.816 6.031 1.00 0.00 H TER 97245 WAT 1891 ATOM 97245 O WAT 1892 22.700 35.511 15.241 1.00 0.00 O ATOM 97246 H1 WAT 1892 23.546 35.697 15.649 1.00 0.00 H ATOM 97247 H2 WAT 1892 22.244 34.959 15.876 1.00 0.00 H TER 97249 WAT 1892 ATOM 97249 O WAT 1893 26.589 24.836 14.354 1.00 0.00 O ATOM 97250 H1 WAT 1893 27.468 25.097 14.077 1.00 0.00 H ATOM 97251 H2 WAT 1893 26.575 25.009 15.296 1.00 0.00 H TER 97253 WAT 1893 ATOM 97253 O WAT 1894 6.872 109.219 136.855 1.00 0.00 O ATOM 97254 H1 WAT 1894 6.167 109.459 136.253 1.00 0.00 H ATOM 97255 H2 WAT 1894 6.809 109.860 137.564 1.00 0.00 H TER 97257 WAT 1894 ATOM 97257 O WAT 1895 35.504 131.788 146.165 1.00 0.00 O ATOM 97258 H1 WAT 1895 35.720 131.369 146.998 1.00 0.00 H ATOM 97259 H2 WAT 1895 35.181 131.074 145.615 1.00 0.00 H TER 97261 WAT 1895 ATOM 97261 O WAT 1896 20.427 140.845 124.043 1.00 0.00 O ATOM 97262 H1 WAT 1896 19.783 141.362 123.559 1.00 0.00 H ATOM 97263 H2 WAT 1896 19.921 140.415 124.732 1.00 0.00 H TER 97265 WAT 1896 ATOM 97265 O WAT 1897 105.031 87.200 117.031 1.00 0.00 O ATOM 97266 H1 WAT 1897 105.073 88.055 116.604 1.00 0.00 H ATOM 97267 H2 WAT 1897 105.388 87.353 117.907 1.00 0.00 H TER 97269 WAT 1897 ATOM 97269 O WAT 1898 105.103 125.981 11.557 1.00 0.00 O ATOM 97270 H1 WAT 1898 105.769 126.644 11.375 1.00 0.00 H ATOM 97271 H2 WAT 1898 104.831 125.670 10.694 1.00 0.00 H TER 97273 WAT 1898 ATOM 97273 O WAT 1899 101.527 69.931 148.204 1.00 0.00 O ATOM 97274 H1 WAT 1899 101.551 69.135 148.735 1.00 0.00 H ATOM 97275 H2 WAT 1899 102.340 69.907 147.699 1.00 0.00 H TER 97277 WAT 1899 ATOM 97277 O WAT 1900 101.573 106.846 109.805 1.00 0.00 O ATOM 97278 H1 WAT 1900 101.634 105.891 109.805 1.00 0.00 H ATOM 97279 H2 WAT 1900 100.691 107.029 109.482 1.00 0.00 H TER 97281 WAT 1900 ATOM 97281 O WAT 1901 86.654 88.183 2.747 1.00 0.00 O ATOM 97282 H1 WAT 1901 87.586 87.965 2.749 1.00 0.00 H ATOM 97283 H2 WAT 1901 86.307 87.761 3.533 1.00 0.00 H TER 97285 WAT 1901 ATOM 97285 O WAT 1902 19.763 37.617 114.656 1.00 0.00 O ATOM 97286 H1 WAT 1902 20.239 37.983 115.402 1.00 0.00 H ATOM 97287 H2 WAT 1902 19.607 38.366 114.081 1.00 0.00 H TER 97289 WAT 1902 ATOM 97289 O WAT 1903 92.942 49.223 17.400 1.00 0.00 O ATOM 97290 H1 WAT 1903 92.144 49.221 16.870 1.00 0.00 H ATOM 97291 H2 WAT 1903 93.018 50.124 17.714 1.00 0.00 H TER 97293 WAT 1903 ATOM 97293 O WAT 1904 112.968 45.315 21.117 1.00 0.00 O ATOM 97294 H1 WAT 1904 112.041 45.417 21.331 1.00 0.00 H ATOM 97295 H2 WAT 1904 113.034 44.432 20.753 1.00 0.00 H TER 97297 WAT 1904 ATOM 97297 O WAT 1905 85.875 96.445 53.586 1.00 0.00 O ATOM 97298 H1 WAT 1905 85.206 96.948 53.121 1.00 0.00 H ATOM 97299 H2 WAT 1905 85.387 95.950 54.245 1.00 0.00 H TER 97301 WAT 1905 ATOM 97301 O WAT 1906 119.906 141.030 141.841 1.00 0.00 O ATOM 97302 H1 WAT 1906 119.886 140.090 141.661 1.00 0.00 H ATOM 97303 H2 WAT 1906 120.287 141.417 141.054 1.00 0.00 H TER 97305 WAT 1906 ATOM 97305 O WAT 1907 24.125 139.758 -0.075 1.00 0.00 O ATOM 97306 H1 WAT 1907 23.871 139.359 0.757 1.00 0.00 H ATOM 97307 H2 WAT 1907 24.529 139.045 -0.569 1.00 0.00 H TER 97309 WAT 1907 ATOM 97309 O WAT 1908 127.449 83.614 141.601 1.00 0.00 O ATOM 97310 H1 WAT 1908 126.511 83.433 141.545 1.00 0.00 H ATOM 97311 H2 WAT 1908 127.782 83.426 140.724 1.00 0.00 H TER 97313 WAT 1908 ATOM 97313 O WAT 1909 117.398 30.346 22.592 1.00 0.00 O ATOM 97314 H1 WAT 1909 117.236 30.596 21.682 1.00 0.00 H ATOM 97315 H2 WAT 1909 116.688 30.760 23.084 1.00 0.00 H TER 97317 WAT 1909 ATOM 97317 O WAT 1910 64.499 16.395 22.864 1.00 0.00 O ATOM 97318 H1 WAT 1910 63.643 16.656 22.523 1.00 0.00 H ATOM 97319 H2 WAT 1910 64.733 17.091 23.478 1.00 0.00 H TER 97321 WAT 1910 ATOM 97321 O WAT 1911 120.874 86.210 113.745 1.00 0.00 O ATOM 97322 H1 WAT 1911 121.200 86.987 113.291 1.00 0.00 H ATOM 97323 H2 WAT 1911 120.706 86.507 114.639 1.00 0.00 H TER 97325 WAT 1911 ATOM 97325 O WAT 1912 52.517 12.479 100.639 1.00 0.00 O ATOM 97326 H1 WAT 1912 52.656 11.834 99.946 1.00 0.00 H ATOM 97327 H2 WAT 1912 52.271 13.279 100.175 1.00 0.00 H TER 97329 WAT 1912 ATOM 97329 O WAT 1913 18.541 41.375 84.478 1.00 0.00 O ATOM 97330 H1 WAT 1913 17.896 41.493 83.781 1.00 0.00 H ATOM 97331 H2 WAT 1913 18.940 40.525 84.294 1.00 0.00 H TER 97333 WAT 1913 ATOM 97333 O WAT 1914 78.409 93.501 8.050 1.00 0.00 O ATOM 97334 H1 WAT 1914 77.695 94.139 8.020 1.00 0.00 H ATOM 97335 H2 WAT 1914 78.870 93.697 8.866 1.00 0.00 H TER 97337 WAT 1914 ATOM 97337 O WAT 1915 77.456 16.886 135.787 1.00 0.00 O ATOM 97338 H1 WAT 1915 76.780 16.265 135.514 1.00 0.00 H ATOM 97339 H2 WAT 1915 78.148 16.338 136.157 1.00 0.00 H TER 97341 WAT 1915 ATOM 97341 O WAT 1916 56.169 114.576 96.007 1.00 0.00 O ATOM 97342 H1 WAT 1916 55.570 114.235 96.671 1.00 0.00 H ATOM 97343 H2 WAT 1916 55.777 115.405 95.733 1.00 0.00 H TER 97345 WAT 1916 ATOM 97345 O WAT 1917 127.866 0.901 156.084 1.00 0.00 O ATOM 97346 H1 WAT 1917 127.821 0.015 156.444 1.00 0.00 H ATOM 97347 H2 WAT 1917 127.424 1.447 156.734 1.00 0.00 H TER 97349 WAT 1917 ATOM 97349 O WAT 1918 117.200 60.284 96.075 1.00 0.00 O ATOM 97350 H1 WAT 1918 116.870 60.017 95.216 1.00 0.00 H ATOM 97351 H2 WAT 1918 118.136 60.430 95.937 1.00 0.00 H TER 97353 WAT 1918 ATOM 97353 O WAT 1919 19.303 25.320 116.695 1.00 0.00 O ATOM 97354 H1 WAT 1919 18.704 24.577 116.624 1.00 0.00 H ATOM 97355 H2 WAT 1919 20.174 24.937 116.594 1.00 0.00 H TER 97357 WAT 1919 ATOM 97357 O WAT 1920 65.613 47.803 116.134 1.00 0.00 O ATOM 97358 H1 WAT 1920 66.048 48.639 116.303 1.00 0.00 H ATOM 97359 H2 WAT 1920 66.327 47.202 115.917 1.00 0.00 H TER 97361 WAT 1920 ATOM 97361 O WAT 1921 52.237 47.551 120.056 1.00 0.00 O ATOM 97362 H1 WAT 1921 51.970 48.461 120.186 1.00 0.00 H ATOM 97363 H2 WAT 1921 52.805 47.359 120.802 1.00 0.00 H TER 97365 WAT 1921 ATOM 97365 O WAT 1922 38.369 62.568 82.948 1.00 0.00 O ATOM 97366 H1 WAT 1922 37.934 63.068 83.639 1.00 0.00 H ATOM 97367 H2 WAT 1922 37.754 61.865 82.738 1.00 0.00 H TER 97369 WAT 1922 ATOM 97369 O WAT 1923 85.178 122.332 11.543 1.00 0.00 O ATOM 97370 H1 WAT 1923 85.207 121.812 10.740 1.00 0.00 H ATOM 97371 H2 WAT 1923 85.804 121.904 12.128 1.00 0.00 H TER 97373 WAT 1923 ATOM 97373 O WAT 1924 68.664 98.724 1.194 1.00 0.00 O ATOM 97374 H1 WAT 1924 67.943 98.482 0.613 1.00 0.00 H ATOM 97375 H2 WAT 1924 69.446 98.382 0.762 1.00 0.00 H TER 97377 WAT 1924 ATOM 97377 O WAT 1925 5.325 122.624 78.466 1.00 0.00 O ATOM 97378 H1 WAT 1925 6.115 122.739 78.994 1.00 0.00 H ATOM 97379 H2 WAT 1925 5.548 121.925 77.851 1.00 0.00 H TER 97381 WAT 1925 ATOM 97381 O WAT 1926 95.976 33.363 52.015 1.00 0.00 O ATOM 97382 H1 WAT 1926 96.224 34.079 51.431 1.00 0.00 H ATOM 97383 H2 WAT 1926 95.350 32.846 51.509 1.00 0.00 H TER 97385 WAT 1926 ATOM 97385 O WAT 1927 107.163 87.371 107.059 1.00 0.00 O ATOM 97386 H1 WAT 1927 106.951 86.912 106.245 1.00 0.00 H ATOM 97387 H2 WAT 1927 107.985 86.975 107.349 1.00 0.00 H TER 97389 WAT 1927 ATOM 97389 O WAT 1928 126.647 104.579 75.233 1.00 0.00 O ATOM 97390 H1 WAT 1928 127.219 103.824 75.367 1.00 0.00 H ATOM 97391 H2 WAT 1928 125.906 104.425 75.818 1.00 0.00 H TER 97393 WAT 1928 ATOM 97393 O WAT 1929 140.065 45.777 153.486 1.00 0.00 O ATOM 97394 H1 WAT 1929 139.654 44.916 153.563 1.00 0.00 H ATOM 97395 H2 WAT 1929 139.360 46.396 153.674 1.00 0.00 H TER 97397 WAT 1929 ATOM 97397 O WAT 1930 12.801 36.900 77.358 1.00 0.00 O ATOM 97398 H1 WAT 1930 13.586 36.623 76.887 1.00 0.00 H ATOM 97399 H2 WAT 1930 12.936 37.834 77.522 1.00 0.00 H TER 97401 WAT 1930 ATOM 97401 O WAT 1931 126.322 36.870 80.042 1.00 0.00 O ATOM 97402 H1 WAT 1931 126.832 36.812 80.850 1.00 0.00 H ATOM 97403 H2 WAT 1931 125.569 37.414 80.273 1.00 0.00 H TER 97405 WAT 1931 ATOM 97405 O WAT 1932 49.366 53.044 88.752 1.00 0.00 O ATOM 97406 H1 WAT 1932 50.317 52.988 88.838 1.00 0.00 H ATOM 97407 H2 WAT 1932 49.197 53.965 88.551 1.00 0.00 H TER 97409 WAT 1932 ATOM 97409 O WAT 1933 62.468 10.403 154.989 1.00 0.00 O ATOM 97410 H1 WAT 1933 63.020 11.124 154.687 1.00 0.00 H ATOM 97411 H2 WAT 1933 61.717 10.412 154.396 1.00 0.00 H TER 97413 WAT 1933 ATOM 97413 O WAT 1934 78.455 13.989 99.653 1.00 0.00 O ATOM 97414 H1 WAT 1934 77.731 13.369 99.746 1.00 0.00 H ATOM 97415 H2 WAT 1934 78.078 14.835 99.896 1.00 0.00 H TER 97417 WAT 1934 ATOM 97417 O WAT 1935 51.402 54.548 124.871 1.00 0.00 O ATOM 97418 H1 WAT 1935 50.719 54.893 125.448 1.00 0.00 H ATOM 97419 H2 WAT 1935 51.552 55.247 124.234 1.00 0.00 H TER 97421 WAT 1935 ATOM 97421 O WAT 1936 119.629 101.468 0.439 1.00 0.00 O ATOM 97422 H1 WAT 1936 119.981 100.605 0.224 1.00 0.00 H ATOM 97423 H2 WAT 1936 119.046 101.311 1.182 1.00 0.00 H TER 97425 WAT 1936 ATOM 97425 O WAT 1937 34.391 67.216 101.355 1.00 0.00 O ATOM 97426 H1 WAT 1937 35.300 67.511 101.397 1.00 0.00 H ATOM 97427 H2 WAT 1937 34.050 67.606 100.550 1.00 0.00 H TER 97429 WAT 1937 ATOM 97429 O WAT 1938 63.832 115.342 115.349 1.00 0.00 O ATOM 97430 H1 WAT 1938 64.756 115.529 115.182 1.00 0.00 H ATOM 97431 H2 WAT 1938 63.486 116.156 115.716 1.00 0.00 H TER 97433 WAT 1938 ATOM 97433 O WAT 1939 70.310 108.493 115.235 1.00 0.00 O ATOM 97434 H1 WAT 1939 70.248 109.054 116.008 1.00 0.00 H ATOM 97435 H2 WAT 1939 70.674 107.671 115.565 1.00 0.00 H TER 97437 WAT 1939 ATOM 97437 O WAT 1940 106.063 107.303 147.577 1.00 0.00 O ATOM 97438 H1 WAT 1940 107.002 107.195 147.427 1.00 0.00 H ATOM 97439 H2 WAT 1940 105.815 108.042 147.021 1.00 0.00 H TER 97441 WAT 1940 ATOM 97441 O WAT 1941 130.318 28.963 129.783 1.00 0.00 O ATOM 97442 H1 WAT 1941 130.703 29.005 128.908 1.00 0.00 H ATOM 97443 H2 WAT 1941 130.976 29.361 130.354 1.00 0.00 H TER 97445 WAT 1941 ATOM 97445 O WAT 1942 52.186 63.407 16.061 1.00 0.00 O ATOM 97446 H1 WAT 1942 52.224 64.248 15.605 1.00 0.00 H ATOM 97447 H2 WAT 1942 53.078 63.265 16.377 1.00 0.00 H TER 97449 WAT 1942 ATOM 97449 O WAT 1943 36.209 72.329 24.161 1.00 0.00 O ATOM 97450 H1 WAT 1943 36.591 73.196 24.027 1.00 0.00 H ATOM 97451 H2 WAT 1943 35.267 72.489 24.221 1.00 0.00 H TER 97453 WAT 1943 ATOM 97453 O WAT 1944 70.098 55.801 2.632 1.00 0.00 O ATOM 97454 H1 WAT 1944 69.212 55.996 2.937 1.00 0.00 H ATOM 97455 H2 WAT 1944 70.305 56.514 2.028 1.00 0.00 H TER 97457 WAT 1944 ATOM 97457 O WAT 1945 145.271 63.455 144.902 1.00 0.00 O ATOM 97458 H1 WAT 1945 145.436 62.998 144.078 1.00 0.00 H ATOM 97459 H2 WAT 1945 144.403 63.843 144.792 1.00 0.00 H TER 97461 WAT 1945 ATOM 97461 O WAT 1946 19.687 40.309 153.112 1.00 0.00 O ATOM 97462 H1 WAT 1946 20.007 41.199 152.967 1.00 0.00 H ATOM 97463 H2 WAT 1946 19.011 40.185 152.445 1.00 0.00 H TER 97465 WAT 1946 ATOM 97465 O WAT 1947 138.076 126.618 75.422 1.00 0.00 O ATOM 97466 H1 WAT 1947 137.660 126.167 76.156 1.00 0.00 H ATOM 97467 H2 WAT 1947 137.733 126.177 74.644 1.00 0.00 H TER 97469 WAT 1947 ATOM 97469 O WAT 1948 34.999 92.258 4.071 1.00 0.00 O ATOM 97470 H1 WAT 1948 34.579 92.491 3.244 1.00 0.00 H ATOM 97471 H2 WAT 1948 35.909 92.538 3.965 1.00 0.00 H TER 97473 WAT 1948 ATOM 97473 O WAT 1949 67.901 106.103 85.818 1.00 0.00 O ATOM 97474 H1 WAT 1949 67.477 106.360 86.637 1.00 0.00 H ATOM 97475 H2 WAT 1949 68.573 105.475 86.083 1.00 0.00 H TER 97477 WAT 1949 ATOM 97477 O WAT 1950 102.365 52.591 67.196 1.00 0.00 O ATOM 97478 H1 WAT 1950 101.765 51.895 66.925 1.00 0.00 H ATOM 97479 H2 WAT 1950 101.897 53.053 67.891 1.00 0.00 H TER 97481 WAT 1950 ATOM 97481 O WAT 1951 128.674 114.622 82.152 1.00 0.00 O ATOM 97482 H1 WAT 1951 128.288 113.820 82.506 1.00 0.00 H ATOM 97483 H2 WAT 1951 129.567 114.374 81.916 1.00 0.00 H TER 97485 WAT 1951 ATOM 97485 O WAT 1952 92.825 126.706 93.079 1.00 0.00 O ATOM 97486 H1 WAT 1952 93.640 126.425 92.663 1.00 0.00 H ATOM 97487 H2 WAT 1952 92.297 127.052 92.360 1.00 0.00 H TER 97489 WAT 1952 ATOM 97489 O WAT 1953 38.291 143.233 73.401 1.00 0.00 O ATOM 97490 H1 WAT 1953 38.803 142.515 73.772 1.00 0.00 H ATOM 97491 H2 WAT 1953 37.817 142.838 72.670 1.00 0.00 H TER 97493 WAT 1953 ATOM 97493 O WAT 1954 94.525 48.212 56.954 1.00 0.00 O ATOM 97494 H1 WAT 1954 94.963 47.852 57.726 1.00 0.00 H ATOM 97495 H2 WAT 1954 94.353 49.126 57.181 1.00 0.00 H TER 97497 WAT 1954 ATOM 97497 O WAT 1955 30.393 55.658 131.604 1.00 0.00 O ATOM 97498 H1 WAT 1955 30.622 56.106 132.419 1.00 0.00 H ATOM 97499 H2 WAT 1955 30.785 56.196 130.916 1.00 0.00 H TER 97501 WAT 1955 ATOM 97501 O WAT 1956 117.101 54.730 91.717 1.00 0.00 O ATOM 97502 H1 WAT 1956 117.324 54.230 92.503 1.00 0.00 H ATOM 97503 H2 WAT 1956 116.578 54.126 91.190 1.00 0.00 H TER 97505 WAT 1956 ATOM 97505 O WAT 1957 29.472 9.449 75.129 1.00 0.00 O ATOM 97506 H1 WAT 1957 30.142 9.045 75.680 1.00 0.00 H ATOM 97507 H2 WAT 1957 28.952 8.713 74.806 1.00 0.00 H TER 97509 WAT 1957 ATOM 97509 O WAT 1958 70.593 47.911 126.786 1.00 0.00 O ATOM 97510 H1 WAT 1958 70.067 47.196 127.144 1.00 0.00 H ATOM 97511 H2 WAT 1958 70.294 48.688 127.257 1.00 0.00 H TER 97513 WAT 1958 ATOM 97513 O WAT 1959 7.694 56.782 95.232 1.00 0.00 O ATOM 97514 H1 WAT 1959 7.911 56.767 96.164 1.00 0.00 H ATOM 97515 H2 WAT 1959 8.496 56.496 94.794 1.00 0.00 H TER 97517 WAT 1959 ATOM 97517 O WAT 1960 125.614 117.400 96.786 1.00 0.00 O ATOM 97518 H1 WAT 1960 125.701 118.344 96.653 1.00 0.00 H ATOM 97519 H2 WAT 1960 125.244 117.316 97.664 1.00 0.00 H TER 97521 WAT 1960 ATOM 97521 O WAT 1961 144.065 35.279 72.973 1.00 0.00 O ATOM 97522 H1 WAT 1961 144.325 34.918 73.821 1.00 0.00 H ATOM 97523 H2 WAT 1961 143.757 34.522 72.475 1.00 0.00 H TER 97525 WAT 1961 ATOM 97525 O WAT 1962 145.079 18.008 129.260 1.00 0.00 O ATOM 97526 H1 WAT 1962 144.937 18.854 129.685 1.00 0.00 H ATOM 97527 H2 WAT 1962 145.949 18.081 128.867 1.00 0.00 H TER 97529 WAT 1962 ATOM 97529 O WAT 1963 144.225 67.771 70.910 1.00 0.00 O ATOM 97530 H1 WAT 1963 144.134 67.812 69.958 1.00 0.00 H ATOM 97531 H2 WAT 1963 144.631 66.921 71.076 1.00 0.00 H TER 97533 WAT 1963 ATOM 97533 O WAT 1964 46.040 142.559 115.368 1.00 0.00 O ATOM 97534 H1 WAT 1964 46.026 142.000 114.591 1.00 0.00 H ATOM 97535 H2 WAT 1964 46.907 142.417 115.749 1.00 0.00 H TER 97537 WAT 1964 ATOM 97537 O WAT 1965 63.310 95.776 81.390 1.00 0.00 O ATOM 97538 H1 WAT 1965 62.668 95.591 80.704 1.00 0.00 H ATOM 97539 H2 WAT 1965 63.172 95.085 82.039 1.00 0.00 H TER 97541 WAT 1965 ATOM 97541 O WAT 1966 12.645 80.061 91.298 1.00 0.00 O ATOM 97542 H1 WAT 1966 11.746 79.809 91.510 1.00 0.00 H ATOM 97543 H2 WAT 1966 12.556 80.877 90.807 1.00 0.00 H TER 97545 WAT 1966 ATOM 97545 O WAT 1967 46.068 89.520 140.698 1.00 0.00 O ATOM 97546 H1 WAT 1967 46.717 89.326 141.374 1.00 0.00 H ATOM 97547 H2 WAT 1967 46.587 89.760 139.930 1.00 0.00 H TER 97549 WAT 1967 ATOM 97549 O WAT 1968 53.542 137.923 11.338 1.00 0.00 O ATOM 97550 H1 WAT 1968 53.725 137.027 11.053 1.00 0.00 H ATOM 97551 H2 WAT 1968 52.754 138.171 10.855 1.00 0.00 H TER 97553 WAT 1968 ATOM 97553 O WAT 1969 116.931 68.426 112.642 1.00 0.00 O ATOM 97554 H1 WAT 1969 117.453 67.655 112.862 1.00 0.00 H ATOM 97555 H2 WAT 1969 116.327 68.524 113.378 1.00 0.00 H TER 97557 WAT 1969 ATOM 97557 O WAT 1970 83.157 43.335 104.081 1.00 0.00 O ATOM 97558 H1 WAT 1970 82.823 42.842 104.831 1.00 0.00 H ATOM 97559 H2 WAT 1970 83.963 43.740 104.400 1.00 0.00 H TER 97561 WAT 1970 ATOM 97561 O WAT 1971 51.567 141.360 85.335 1.00 0.00 O ATOM 97562 H1 WAT 1971 50.675 141.406 85.677 1.00 0.00 H ATOM 97563 H2 WAT 1971 51.457 141.200 84.398 1.00 0.00 H TER 97565 WAT 1971 ATOM 97565 O WAT 1972 142.979 32.073 85.879 1.00 0.00 O ATOM 97566 H1 WAT 1972 143.696 31.973 86.506 1.00 0.00 H ATOM 97567 H2 WAT 1972 143.051 32.977 85.575 1.00 0.00 H TER 97569 WAT 1972 ATOM 97569 O WAT 1973 27.676 140.008 86.371 1.00 0.00 O ATOM 97570 H1 WAT 1973 28.473 140.296 85.927 1.00 0.00 H ATOM 97571 H2 WAT 1973 27.713 140.430 87.229 1.00 0.00 H TER 97573 WAT 1973 ATOM 97573 O WAT 1974 20.023 102.907 151.813 1.00 0.00 O ATOM 97574 H1 WAT 1974 19.143 103.019 151.453 1.00 0.00 H ATOM 97575 H2 WAT 1974 20.336 103.799 151.964 1.00 0.00 H TER 97577 WAT 1974 ATOM 97577 O WAT 1975 138.947 111.885 95.148 1.00 0.00 O ATOM 97578 H1 WAT 1975 138.968 111.653 96.077 1.00 0.00 H ATOM 97579 H2 WAT 1975 139.015 111.047 94.691 1.00 0.00 H TER 97581 WAT 1975 ATOM 97581 O WAT 1976 64.604 10.919 142.851 1.00 0.00 O ATOM 97582 H1 WAT 1976 64.713 11.237 143.747 1.00 0.00 H ATOM 97583 H2 WAT 1976 64.951 10.027 142.869 1.00 0.00 H TER 97585 WAT 1976 ATOM 97585 O WAT 1977 140.399 104.418 98.417 1.00 0.00 O ATOM 97586 H1 WAT 1977 140.924 104.774 99.134 1.00 0.00 H ATOM 97587 H2 WAT 1977 139.588 104.926 98.440 1.00 0.00 H TER 97589 WAT 1977 ATOM 97589 O WAT 1978 76.208 22.503 2.299 1.00 0.00 O ATOM 97590 H1 WAT 1978 76.248 22.895 3.171 1.00 0.00 H ATOM 97591 H2 WAT 1978 75.275 22.493 2.084 1.00 0.00 H TER 97593 WAT 1978 ATOM 97593 O WAT 1979 16.392 19.927 93.598 1.00 0.00 O ATOM 97594 H1 WAT 1979 16.645 19.006 93.674 1.00 0.00 H ATOM 97595 H2 WAT 1979 16.179 20.042 92.672 1.00 0.00 H TER 97597 WAT 1979 ATOM 97597 O WAT 1980 110.579 110.811 122.469 1.00 0.00 O ATOM 97598 H1 WAT 1980 109.637 110.952 122.370 1.00 0.00 H ATOM 97599 H2 WAT 1980 110.745 109.980 122.024 1.00 0.00 H TER 97601 WAT 1980 ATOM 97601 O WAT 1981 90.274 139.795 68.867 1.00 0.00 O ATOM 97602 H1 WAT 1981 90.633 140.495 68.322 1.00 0.00 H ATOM 97603 H2 WAT 1981 89.328 139.938 68.849 1.00 0.00 H TER 97605 WAT 1981 ATOM 97605 O WAT 1982 37.419 90.093 96.036 1.00 0.00 O ATOM 97606 H1 WAT 1982 36.928 90.808 96.439 1.00 0.00 H ATOM 97607 H2 WAT 1982 37.090 90.053 95.138 1.00 0.00 H TER 97609 WAT 1982 ATOM 97609 O WAT 1983 2.231 14.825 105.003 1.00 0.00 O ATOM 97610 H1 WAT 1983 2.295 14.781 104.049 1.00 0.00 H ATOM 97611 H2 WAT 1983 1.305 14.668 105.189 1.00 0.00 H TER 97613 WAT 1983 ATOM 97613 O WAT 1984 66.207 120.035 86.753 1.00 0.00 O ATOM 97614 H1 WAT 1984 66.321 119.097 86.905 1.00 0.00 H ATOM 97615 H2 WAT 1984 66.921 120.445 87.240 1.00 0.00 H TER 97617 WAT 1984 ATOM 97617 O WAT 1985 106.769 34.247 137.514 1.00 0.00 O ATOM 97618 H1 WAT 1985 107.032 34.536 138.388 1.00 0.00 H ATOM 97619 H2 WAT 1985 105.946 33.779 137.654 1.00 0.00 H TER 97621 WAT 1985 ATOM 97621 O WAT 1986 94.431 67.203 25.577 1.00 0.00 O ATOM 97622 H1 WAT 1986 95.188 66.883 26.068 1.00 0.00 H ATOM 97623 H2 WAT 1986 93.675 66.879 26.066 1.00 0.00 H TER 97625 WAT 1986 ATOM 97625 O WAT 1987 21.560 89.771 72.646 1.00 0.00 O ATOM 97626 H1 WAT 1987 21.447 90.404 73.355 1.00 0.00 H ATOM 97627 H2 WAT 1987 22.491 89.820 72.428 1.00 0.00 H TER 97629 WAT 1987 ATOM 97629 O WAT 1988 24.053 141.213 56.416 1.00 0.00 O ATOM 97630 H1 WAT 1988 24.024 140.691 55.614 1.00 0.00 H ATOM 97631 H2 WAT 1988 23.481 140.747 57.026 1.00 0.00 H TER 97633 WAT 1988 ATOM 97633 O WAT 1989 96.208 98.123 147.547 1.00 0.00 O ATOM 97634 H1 WAT 1989 95.335 97.810 147.312 1.00 0.00 H ATOM 97635 H2 WAT 1989 96.148 98.323 148.481 1.00 0.00 H TER 97637 WAT 1989 ATOM 97637 O WAT 1990 97.518 3.589 128.257 1.00 0.00 O ATOM 97638 H1 WAT 1990 97.421 2.673 128.515 1.00 0.00 H ATOM 97639 H2 WAT 1990 98.079 3.971 128.932 1.00 0.00 H TER 97641 WAT 1990 ATOM 97641 O WAT 1991 59.225 48.870 80.352 1.00 0.00 O ATOM 97642 H1 WAT 1991 58.729 48.485 79.629 1.00 0.00 H ATOM 97643 H2 WAT 1991 59.103 49.814 80.250 1.00 0.00 H TER 97645 WAT 1991 ATOM 97645 O WAT 1992 8.568 5.839 96.204 1.00 0.00 O ATOM 97646 H1 WAT 1992 8.075 6.381 96.821 1.00 0.00 H ATOM 97647 H2 WAT 1992 8.874 6.455 95.538 1.00 0.00 H TER 97649 WAT 1992 ATOM 97649 O WAT 1993 99.936 75.641 113.245 1.00 0.00 O ATOM 97650 H1 WAT 1993 99.060 75.999 113.389 1.00 0.00 H ATOM 97651 H2 WAT 1993 99.809 74.955 112.589 1.00 0.00 H TER 97653 WAT 1993 ATOM 97653 O WAT 1994 29.412 79.837 69.130 1.00 0.00 O ATOM 97654 H1 WAT 1994 29.001 78.974 69.178 1.00 0.00 H ATOM 97655 H2 WAT 1994 30.088 79.744 68.460 1.00 0.00 H TER 97657 WAT 1994 ATOM 97657 O WAT 1995 81.318 14.696 125.910 1.00 0.00 O ATOM 97658 H1 WAT 1995 81.803 13.931 125.598 1.00 0.00 H ATOM 97659 H2 WAT 1995 80.419 14.384 126.013 1.00 0.00 H TER 97661 WAT 1995 ATOM 97661 O WAT 1996 114.548 105.278 102.867 1.00 0.00 O ATOM 97662 H1 WAT 1996 114.000 106.060 102.929 1.00 0.00 H ATOM 97663 H2 WAT 1996 114.939 105.327 101.995 1.00 0.00 H TER 97665 WAT 1996 ATOM 97665 O WAT 1997 107.363 63.162 11.738 1.00 0.00 O ATOM 97666 H1 WAT 1997 106.886 63.316 12.553 1.00 0.00 H ATOM 97667 H2 WAT 1997 106.759 62.650 11.200 1.00 0.00 H TER 97669 WAT 1997 ATOM 97669 O WAT 1998 9.913 132.488 114.591 1.00 0.00 O ATOM 97670 H1 WAT 1998 9.966 133.443 114.568 1.00 0.00 H ATOM 97671 H2 WAT 1998 9.871 132.228 113.671 1.00 0.00 H TER 97673 WAT 1998 ATOM 97673 O WAT 1999 43.791 9.448 136.178 1.00 0.00 O ATOM 97674 H1 WAT 1999 44.635 9.757 135.850 1.00 0.00 H ATOM 97675 H2 WAT 1999 44.016 8.779 136.824 1.00 0.00 H TER 97677 WAT 1999 ATOM 97677 O WAT 2000 100.093 57.316 142.828 1.00 0.00 O ATOM 97678 H1 WAT 2000 100.541 58.077 142.461 1.00 0.00 H ATOM 97679 H2 WAT 2000 100.779 56.831 143.286 1.00 0.00 H TER 97681 WAT 2000 ATOM 97681 O WAT 2001 98.174 55.019 109.478 1.00 0.00 O ATOM 97682 H1 WAT 2001 98.616 54.929 110.322 1.00 0.00 H ATOM 97683 H2 WAT 2001 97.424 54.427 109.536 1.00 0.00 H TER 97685 WAT 2001 ATOM 97685 O WAT 2002 127.156 102.265 5.347 1.00 0.00 O ATOM 97686 H1 WAT 2002 127.325 102.392 4.414 1.00 0.00 H ATOM 97687 H2 WAT 2002 127.101 103.152 5.704 1.00 0.00 H TER 97689 WAT 2002 ATOM 97689 O WAT 2003 57.790 112.317 115.550 1.00 0.00 O ATOM 97690 H1 WAT 2003 57.294 112.363 114.733 1.00 0.00 H ATOM 97691 H2 WAT 2003 57.817 111.383 115.761 1.00 0.00 H TER 97693 WAT 2003 ATOM 97693 O WAT 2004 95.670 4.493 80.696 1.00 0.00 O ATOM 97694 H1 WAT 2004 96.292 4.975 81.242 1.00 0.00 H ATOM 97695 H2 WAT 2004 96.201 3.830 80.256 1.00 0.00 H TER 97697 WAT 2004 ATOM 97697 O WAT 2005 139.754 109.705 0.201 1.00 0.00 O ATOM 97698 H1 WAT 2005 139.103 109.247 0.733 1.00 0.00 H ATOM 97699 H2 WAT 2005 139.741 109.246 -0.639 1.00 0.00 H TER 97701 WAT 2005 ATOM 97701 O WAT 2006 84.642 24.112 55.565 1.00 0.00 O ATOM 97702 H1 WAT 2006 85.448 24.584 55.774 1.00 0.00 H ATOM 97703 H2 WAT 2006 84.120 24.738 55.065 1.00 0.00 H TER 97705 WAT 2006 ATOM 97705 O WAT 2007 109.184 139.676 138.273 1.00 0.00 O ATOM 97706 H1 WAT 2007 110.031 139.251 138.405 1.00 0.00 H ATOM 97707 H2 WAT 2007 108.879 139.883 139.156 1.00 0.00 H TER 97709 WAT 2007 ATOM 97709 O WAT 2008 107.091 133.994 129.445 1.00 0.00 O ATOM 97710 H1 WAT 2008 107.095 134.939 129.289 1.00 0.00 H ATOM 97711 H2 WAT 2008 108.000 133.781 129.653 1.00 0.00 H TER 97713 WAT 2008 ATOM 97713 O WAT 2009 50.585 57.961 120.289 1.00 0.00 O ATOM 97714 H1 WAT 2009 50.185 57.773 121.138 1.00 0.00 H ATOM 97715 H2 WAT 2009 49.887 58.377 119.782 1.00 0.00 H TER 97717 WAT 2009 ATOM 97717 O WAT 2010 86.708 122.819 123.139 1.00 0.00 O ATOM 97718 H1 WAT 2010 87.546 122.507 123.481 1.00 0.00 H ATOM 97719 H2 WAT 2010 86.884 123.716 122.855 1.00 0.00 H TER 97721 WAT 2010 ATOM 97721 O WAT 2011 50.797 7.424 132.034 1.00 0.00 O ATOM 97722 H1 WAT 2011 50.927 7.447 131.086 1.00 0.00 H ATOM 97723 H2 WAT 2011 51.161 6.581 132.305 1.00 0.00 H TER 97725 WAT 2011 ATOM 97725 O WAT 2012 28.808 136.909 143.206 1.00 0.00 O ATOM 97726 H1 WAT 2012 27.899 137.080 142.958 1.00 0.00 H ATOM 97727 H2 WAT 2012 29.321 137.219 142.460 1.00 0.00 H TER 97729 WAT 2012 ATOM 97729 O WAT 2013 104.285 77.029 107.059 1.00 0.00 O ATOM 97730 H1 WAT 2013 104.212 77.553 107.856 1.00 0.00 H ATOM 97731 H2 WAT 2013 104.898 76.330 107.286 1.00 0.00 H TER 97733 WAT 2013 ATOM 97733 O WAT 2014 41.230 131.758 13.577 1.00 0.00 O ATOM 97734 H1 WAT 2014 42.160 131.912 13.746 1.00 0.00 H ATOM 97735 H2 WAT 2014 40.811 131.868 14.430 1.00 0.00 H TER 97737 WAT 2014 ATOM 97737 O WAT 2015 15.198 114.758 84.770 1.00 0.00 O ATOM 97738 H1 WAT 2015 14.500 115.021 84.170 1.00 0.00 H ATOM 97739 H2 WAT 2015 15.927 115.341 84.559 1.00 0.00 H TER 97741 WAT 2015 ATOM 97741 O WAT 2016 63.553 36.580 77.910 1.00 0.00 O ATOM 97742 H1 WAT 2016 63.952 36.794 77.066 1.00 0.00 H ATOM 97743 H2 WAT 2016 63.375 37.430 78.312 1.00 0.00 H TER 97745 WAT 2016 ATOM 97745 O WAT 2017 86.055 53.703 107.239 1.00 0.00 O ATOM 97746 H1 WAT 2017 86.141 54.451 106.649 1.00 0.00 H ATOM 97747 H2 WAT 2017 85.963 52.948 106.657 1.00 0.00 H TER 97749 WAT 2017 ATOM 97749 O WAT 2018 55.869 145.754 119.188 1.00 0.00 O ATOM 97750 H1 WAT 2018 56.524 146.050 118.556 1.00 0.00 H ATOM 97751 H2 WAT 2018 55.845 144.803 119.081 1.00 0.00 H TER 97753 WAT 2018 ATOM 97753 O WAT 2019 95.042 101.415 141.942 1.00 0.00 O ATOM 97754 H1 WAT 2019 95.318 102.193 142.428 1.00 0.00 H ATOM 97755 H2 WAT 2019 95.860 101.013 141.649 1.00 0.00 H TER 97757 WAT 2019 ATOM 97757 O WAT 2020 11.759 61.851 123.447 1.00 0.00 O ATOM 97758 H1 WAT 2020 12.062 62.732 123.667 1.00 0.00 H ATOM 97759 H2 WAT 2020 11.199 61.600 124.182 1.00 0.00 H TER 97761 WAT 2020 ATOM 97761 O WAT 2021 127.424 84.168 116.457 1.00 0.00 O ATOM 97762 H1 WAT 2021 127.811 83.328 116.213 1.00 0.00 H ATOM 97763 H2 WAT 2021 127.718 84.316 117.356 1.00 0.00 H TER 97765 WAT 2021 ATOM 97765 O WAT 2022 103.777 66.079 22.639 1.00 0.00 O ATOM 97766 H1 WAT 2022 103.667 66.405 23.532 1.00 0.00 H ATOM 97767 H2 WAT 2022 104.644 66.390 22.376 1.00 0.00 H TER 97769 WAT 2022 ATOM 97769 O WAT 2023 95.099 73.801 63.965 1.00 0.00 O ATOM 97770 H1 WAT 2023 95.356 73.771 63.043 1.00 0.00 H ATOM 97771 H2 WAT 2023 94.144 73.726 63.950 1.00 0.00 H TER 97773 WAT 2023 ATOM 97773 O WAT 2024 90.500 126.588 151.073 1.00 0.00 O ATOM 97774 H1 WAT 2024 90.247 125.676 151.216 1.00 0.00 H ATOM 97775 H2 WAT 2024 90.230 127.039 151.873 1.00 0.00 H TER 97777 WAT 2024 ATOM 97777 O WAT 2025 91.941 143.729 101.156 1.00 0.00 O ATOM 97778 H1 WAT 2025 91.533 143.459 101.978 1.00 0.00 H ATOM 97779 H2 WAT 2025 92.653 144.312 101.422 1.00 0.00 H TER 97781 WAT 2025 ATOM 97781 O WAT 2026 38.398 1.498 97.437 1.00 0.00 O ATOM 97782 H1 WAT 2026 37.975 2.175 96.908 1.00 0.00 H ATOM 97783 H2 WAT 2026 37.739 0.808 97.514 1.00 0.00 H TER 97785 WAT 2026 ATOM 97785 O WAT 2027 122.022 28.728 100.006 1.00 0.00 O ATOM 97786 H1 WAT 2027 122.123 29.545 99.519 1.00 0.00 H ATOM 97787 H2 WAT 2027 122.742 28.176 99.701 1.00 0.00 H TER 97789 WAT 2027 ATOM 97789 O WAT 2028 127.532 4.173 108.609 1.00 0.00 O ATOM 97790 H1 WAT 2028 127.202 3.281 108.716 1.00 0.00 H ATOM 97791 H2 WAT 2028 127.103 4.493 107.815 1.00 0.00 H TER 97793 WAT 2028 ATOM 97793 O WAT 2029 31.007 67.539 126.150 1.00 0.00 O ATOM 97794 H1 WAT 2029 30.257 67.492 125.557 1.00 0.00 H ATOM 97795 H2 WAT 2029 31.273 68.458 126.128 1.00 0.00 H TER 97797 WAT 2029 ATOM 97797 O WAT 2030 48.777 39.363 69.443 1.00 0.00 O ATOM 97798 H1 WAT 2030 49.499 38.861 69.821 1.00 0.00 H ATOM 97799 H2 WAT 2030 48.208 38.703 69.047 1.00 0.00 H TER 97801 WAT 2030 ATOM 97801 O WAT 2031 86.781 89.719 100.039 1.00 0.00 O ATOM 97802 H1 WAT 2031 86.369 90.385 99.488 1.00 0.00 H ATOM 97803 H2 WAT 2031 86.778 90.101 100.917 1.00 0.00 H TER 97805 WAT 2031 ATOM 97805 O WAT 2032 121.982 142.184 18.323 1.00 0.00 O ATOM 97806 H1 WAT 2032 122.043 143.125 18.486 1.00 0.00 H ATOM 97807 H2 WAT 2032 122.654 141.799 18.885 1.00 0.00 H TER 97809 WAT 2032 ATOM 97809 O WAT 2033 35.472 112.622 105.731 1.00 0.00 O ATOM 97810 H1 WAT 2033 36.246 112.508 105.179 1.00 0.00 H ATOM 97811 H2 WAT 2033 34.805 112.066 105.327 1.00 0.00 H TER 97813 WAT 2033 ATOM 97813 O WAT 2034 128.909 59.583 90.977 1.00 0.00 O ATOM 97814 H1 WAT 2034 129.275 59.809 91.832 1.00 0.00 H ATOM 97815 H2 WAT 2034 127.962 59.576 91.116 1.00 0.00 H TER 97817 WAT 2034 ATOM 97817 O WAT 2035 42.225 70.355 158.301 1.00 0.00 O ATOM 97818 H1 WAT 2035 41.862 70.317 157.416 1.00 0.00 H ATOM 97819 H2 WAT 2035 42.983 70.935 158.223 1.00 0.00 H TER 97821 WAT 2035 ATOM 97821 O WAT 2036 118.758 62.512 63.930 1.00 0.00 O ATOM 97822 H1 WAT 2036 118.763 62.359 62.985 1.00 0.00 H ATOM 97823 H2 WAT 2036 117.831 62.530 64.165 1.00 0.00 H TER 97825 WAT 2036 ATOM 97825 O WAT 2037 63.747 83.048 124.905 1.00 0.00 O ATOM 97826 H1 WAT 2037 63.588 83.991 124.920 1.00 0.00 H ATOM 97827 H2 WAT 2037 64.690 82.966 124.760 1.00 0.00 H TER 97829 WAT 2037 ATOM 97829 O WAT 2038 141.571 114.846 69.284 1.00 0.00 O ATOM 97830 H1 WAT 2038 140.623 114.757 69.179 1.00 0.00 H ATOM 97831 H2 WAT 2038 141.906 113.954 69.197 1.00 0.00 H TER 97833 WAT 2038 ATOM 97833 O WAT 2039 85.906 104.993 12.931 1.00 0.00 O ATOM 97834 H1 WAT 2039 85.285 105.192 12.231 1.00 0.00 H ATOM 97835 H2 WAT 2039 86.102 104.062 12.820 1.00 0.00 H TER 97837 WAT 2039 ATOM 97837 O WAT 2040 62.423 7.987 90.375 1.00 0.00 O ATOM 97838 H1 WAT 2040 63.164 7.544 89.963 1.00 0.00 H ATOM 97839 H2 WAT 2040 61.690 7.836 89.778 1.00 0.00 H TER 97841 WAT 2040 ATOM 97841 O WAT 2041 19.945 24.311 136.675 1.00 0.00 O ATOM 97842 H1 WAT 2041 19.980 24.151 137.618 1.00 0.00 H ATOM 97843 H2 WAT 2041 20.717 24.847 136.494 1.00 0.00 H TER 97845 WAT 2041 ATOM 97845 O WAT 2042 111.515 76.634 91.998 1.00 0.00 O ATOM 97846 H1 WAT 2042 111.116 77.054 91.236 1.00 0.00 H ATOM 97847 H2 WAT 2042 112.296 77.157 92.178 1.00 0.00 H TER 97849 WAT 2042 ATOM 97849 O WAT 2043 94.402 101.760 103.170 1.00 0.00 O ATOM 97850 H1 WAT 2043 94.570 101.925 102.242 1.00 0.00 H ATOM 97851 H2 WAT 2043 95.191 102.068 103.614 1.00 0.00 H TER 97853 WAT 2043 ATOM 97853 O WAT 2044 117.635 93.533 72.246 1.00 0.00 O ATOM 97854 H1 WAT 2044 118.198 92.778 72.418 1.00 0.00 H ATOM 97855 H2 WAT 2044 117.630 93.615 71.292 1.00 0.00 H TER 97857 WAT 2044 ATOM 97857 O WAT 2045 34.335 23.197 64.000 1.00 0.00 O ATOM 97858 H1 WAT 2045 35.033 23.318 63.356 1.00 0.00 H ATOM 97859 H2 WAT 2045 33.907 22.381 63.738 1.00 0.00 H TER 97861 WAT 2045 ATOM 97861 O WAT 2046 46.665 110.978 153.207 1.00 0.00 O ATOM 97862 H1 WAT 2046 47.256 110.614 153.866 1.00 0.00 H ATOM 97863 H2 WAT 2046 47.063 110.739 152.370 1.00 0.00 H TER 97865 WAT 2046 ATOM 97865 O WAT 2047 106.209 130.433 88.565 1.00 0.00 O ATOM 97866 H1 WAT 2047 107.049 130.575 88.129 1.00 0.00 H ATOM 97867 H2 WAT 2047 105.641 131.122 88.220 1.00 0.00 H TER 97869 WAT 2047 ATOM 97869 O WAT 2048 113.310 15.775 154.733 1.00 0.00 O ATOM 97870 H1 WAT 2048 112.727 15.019 154.808 1.00 0.00 H ATOM 97871 H2 WAT 2048 114.190 15.405 154.803 1.00 0.00 H TER 97873 WAT 2048 ATOM 97873 O WAT 2049 61.325 13.687 18.639 1.00 0.00 O ATOM 97874 H1 WAT 2049 61.531 13.847 19.560 1.00 0.00 H ATOM 97875 H2 WAT 2049 60.846 12.858 18.640 1.00 0.00 H TER 97877 WAT 2049 ATOM 97877 O WAT 2050 140.016 1.700 69.510 1.00 0.00 O ATOM 97878 H1 WAT 2050 140.534 2.435 69.837 1.00 0.00 H ATOM 97879 H2 WAT 2050 140.261 0.964 70.072 1.00 0.00 H TER 97881 WAT 2050 ATOM 97881 O WAT 2051 46.078 90.876 96.800 1.00 0.00 O ATOM 97882 H1 WAT 2051 46.727 90.233 97.085 1.00 0.00 H ATOM 97883 H2 WAT 2051 46.294 91.668 97.292 1.00 0.00 H TER 97885 WAT 2051 ATOM 97885 O WAT 2052 105.094 5.660 77.798 1.00 0.00 O ATOM 97886 H1 WAT 2052 104.358 5.676 78.410 1.00 0.00 H ATOM 97887 H2 WAT 2052 105.498 4.803 77.933 1.00 0.00 H TER 97889 WAT 2052 ATOM 97889 O WAT 2053 2.221 45.921 125.842 1.00 0.00 O ATOM 97890 H1 WAT 2053 2.870 46.445 126.312 1.00 0.00 H ATOM 97891 H2 WAT 2053 1.844 45.349 126.510 1.00 0.00 H TER 97893 WAT 2053 ATOM 97893 O WAT 2054 84.011 114.153 29.194 1.00 0.00 O ATOM 97894 H1 WAT 2054 83.529 114.976 29.280 1.00 0.00 H ATOM 97895 H2 WAT 2054 84.929 114.419 29.134 1.00 0.00 H TER 97897 WAT 2054 ATOM 97897 O WAT 2055 141.600 58.476 99.759 1.00 0.00 O ATOM 97898 H1 WAT 2055 141.142 59.098 99.194 1.00 0.00 H ATOM 97899 H2 WAT 2055 141.799 57.735 99.186 1.00 0.00 H TER 97901 WAT 2055 ATOM 97901 O WAT 2056 36.652 33.909 72.258 1.00 0.00 O ATOM 97902 H1 WAT 2056 36.957 34.446 71.526 1.00 0.00 H ATOM 97903 H2 WAT 2056 36.170 33.193 71.845 1.00 0.00 H TER 97905 WAT 2056 ATOM 97905 O WAT 2057 109.481 90.634 56.911 1.00 0.00 O ATOM 97906 H1 WAT 2057 108.806 90.202 57.434 1.00 0.00 H ATOM 97907 H2 WAT 2057 109.223 90.469 56.004 1.00 0.00 H TER 97909 WAT 2057 ATOM 97909 O WAT 2058 15.780 114.961 115.979 1.00 0.00 O ATOM 97910 H1 WAT 2058 16.021 114.452 115.205 1.00 0.00 H ATOM 97911 H2 WAT 2058 16.611 115.304 116.308 1.00 0.00 H TER 97913 WAT 2058 ATOM 97913 O WAT 2059 59.647 109.018 92.662 1.00 0.00 O ATOM 97914 H1 WAT 2059 59.991 109.842 93.007 1.00 0.00 H ATOM 97915 H2 WAT 2059 58.771 109.239 92.344 1.00 0.00 H TER 97917 WAT 2059 ATOM 97917 O WAT 2060 40.108 87.760 142.122 1.00 0.00 O ATOM 97918 H1 WAT 2060 40.389 87.968 141.231 1.00 0.00 H ATOM 97919 H2 WAT 2060 40.474 88.463 142.659 1.00 0.00 H TER 97921 WAT 2060 ATOM 97921 O WAT 2061 53.992 46.431 108.281 1.00 0.00 O ATOM 97922 H1 WAT 2061 53.255 46.964 107.982 1.00 0.00 H ATOM 97923 H2 WAT 2061 54.202 46.776 109.149 1.00 0.00 H TER 97925 WAT 2061 ATOM 97925 O WAT 2062 57.736 131.207 107.210 1.00 0.00 O ATOM 97926 H1 WAT 2062 56.790 131.331 107.293 1.00 0.00 H ATOM 97927 H2 WAT 2062 57.886 130.309 107.505 1.00 0.00 H TER 97929 WAT 2062 ATOM 97929 O WAT 2063 50.246 86.547 61.052 1.00 0.00 O ATOM 97930 H1 WAT 2063 51.017 87.111 61.113 1.00 0.00 H ATOM 97931 H2 WAT 2063 50.427 85.972 60.308 1.00 0.00 H TER 97933 WAT 2063 ATOM 97933 O WAT 2064 81.403 18.469 21.766 1.00 0.00 O ATOM 97934 H1 WAT 2064 81.117 19.352 21.534 1.00 0.00 H ATOM 97935 H2 WAT 2064 82.315 18.575 22.035 1.00 0.00 H TER 97937 WAT 2064 ATOM 97937 O WAT 2065 4.971 20.387 76.083 1.00 0.00 O ATOM 97938 H1 WAT 2065 5.198 21.241 75.716 1.00 0.00 H ATOM 97939 H2 WAT 2065 5.711 19.824 75.857 1.00 0.00 H TER 97941 WAT 2065 ATOM 97941 O WAT 2066 57.056 108.166 125.894 1.00 0.00 O ATOM 97942 H1 WAT 2066 56.531 108.962 125.808 1.00 0.00 H ATOM 97943 H2 WAT 2066 56.776 107.614 125.164 1.00 0.00 H TER 97945 WAT 2066 ATOM 97945 O WAT 2067 84.238 6.471 62.703 1.00 0.00 O ATOM 97946 H1 WAT 2067 85.126 6.174 62.897 1.00 0.00 H ATOM 97947 H2 WAT 2067 84.319 6.948 61.877 1.00 0.00 H TER 97949 WAT 2067 ATOM 97949 O WAT 2068 0.999 55.749 79.861 1.00 0.00 O ATOM 97950 H1 WAT 2068 1.003 54.935 80.366 1.00 0.00 H ATOM 97951 H2 WAT 2068 1.899 56.069 79.917 1.00 0.00 H TER 97953 WAT 2068 ATOM 97953 O WAT 2069 82.720 20.948 143.332 1.00 0.00 O ATOM 97954 H1 WAT 2069 82.891 20.020 143.170 1.00 0.00 H ATOM 97955 H2 WAT 2069 83.588 21.337 143.438 1.00 0.00 H TER 97957 WAT 2069 ATOM 97957 O WAT 2070 10.428 110.129 83.271 1.00 0.00 O ATOM 97958 H1 WAT 2070 11.369 110.169 83.102 1.00 0.00 H ATOM 97959 H2 WAT 2070 10.296 109.280 83.692 1.00 0.00 H TER 97961 WAT 2070 ATOM 97961 O WAT 2071 47.068 10.509 144.264 1.00 0.00 O ATOM 97962 H1 WAT 2071 46.917 11.073 143.505 1.00 0.00 H ATOM 97963 H2 WAT 2071 46.222 10.476 144.710 1.00 0.00 H TER 97965 WAT 2071 ATOM 97965 O WAT 2072 115.743 43.970 75.224 1.00 0.00 O ATOM 97966 H1 WAT 2072 116.213 44.788 75.387 1.00 0.00 H ATOM 97967 H2 WAT 2072 115.827 43.829 74.281 1.00 0.00 H TER 97969 WAT 2072 ATOM 97969 O WAT 2073 51.085 60.539 144.287 1.00 0.00 O ATOM 97970 H1 WAT 2073 51.950 60.468 143.883 1.00 0.00 H ATOM 97971 H2 WAT 2073 50.503 60.066 143.692 1.00 0.00 H TER 97973 WAT 2073 ATOM 97973 O WAT 2074 138.857 70.902 138.495 1.00 0.00 O ATOM 97974 H1 WAT 2074 138.107 70.769 137.916 1.00 0.00 H ATOM 97975 H2 WAT 2074 138.486 70.875 139.377 1.00 0.00 H TER 97977 WAT 2074 ATOM 97977 O WAT 2075 33.184 127.930 81.845 1.00 0.00 O ATOM 97978 H1 WAT 2075 33.450 127.830 80.931 1.00 0.00 H ATOM 97979 H2 WAT 2075 33.424 128.829 82.067 1.00 0.00 H TER 97981 WAT 2075 ATOM 97981 O WAT 2076 71.997 34.630 94.240 1.00 0.00 O ATOM 97982 H1 WAT 2076 72.179 34.604 95.180 1.00 0.00 H ATOM 97983 H2 WAT 2076 71.845 35.556 94.051 1.00 0.00 H TER 97985 WAT 2076 ATOM 97985 O WAT 2077 74.387 56.410 118.781 1.00 0.00 O ATOM 97986 H1 WAT 2077 74.141 55.510 118.568 1.00 0.00 H ATOM 97987 H2 WAT 2077 75.252 56.333 119.184 1.00 0.00 H TER 97989 WAT 2077 ATOM 97989 O WAT 2078 29.325 52.197 104.092 1.00 0.00 O ATOM 97990 H1 WAT 2078 29.323 52.612 103.230 1.00 0.00 H ATOM 97991 H2 WAT 2078 28.531 51.662 104.102 1.00 0.00 H TER 97993 WAT 2078 ATOM 97993 O WAT 2079 133.886 55.426 141.239 1.00 0.00 O ATOM 97994 H1 WAT 2079 134.622 55.980 140.980 1.00 0.00 H ATOM 97995 H2 WAT 2079 133.457 55.911 141.944 1.00 0.00 H TER 97997 WAT 2079 ATOM 97997 O WAT 2080 26.962 100.942 98.501 1.00 0.00 O ATOM 97998 H1 WAT 2080 26.817 100.817 99.438 1.00 0.00 H ATOM 97999 H2 WAT 2080 27.400 100.140 98.217 1.00 0.00 H TER 98001 WAT 2080 ATOM 98001 O WAT 2081 23.142 99.112 101.455 1.00 0.00 O ATOM 98002 H1 WAT 2081 22.776 98.324 101.054 1.00 0.00 H ATOM 98003 H2 WAT 2081 22.893 99.821 100.862 1.00 0.00 H TER 98005 WAT 2081 ATOM 98005 O WAT 2082 104.805 18.891 145.847 1.00 0.00 O ATOM 98006 H1 WAT 2082 104.145 18.771 145.163 1.00 0.00 H ATOM 98007 H2 WAT 2082 104.356 19.394 146.526 1.00 0.00 H TER 98009 WAT 2082 ATOM 98009 O WAT 2083 30.972 140.337 156.937 1.00 0.00 O ATOM 98010 H1 WAT 2083 30.356 139.733 157.351 1.00 0.00 H ATOM 98011 H2 WAT 2083 31.815 139.885 156.977 1.00 0.00 H TER 98013 WAT 2083 ATOM 98013 O WAT 2084 50.012 125.794 68.643 1.00 0.00 O ATOM 98014 H1 WAT 2084 49.632 125.366 67.875 1.00 0.00 H ATOM 98015 H2 WAT 2084 50.931 125.527 68.636 1.00 0.00 H TER 98017 WAT 2084 ATOM 98017 O WAT 2085 127.924 21.292 139.189 1.00 0.00 O ATOM 98018 H1 WAT 2085 128.692 21.757 139.522 1.00 0.00 H ATOM 98019 H2 WAT 2085 128.265 20.743 138.483 1.00 0.00 H TER 98021 WAT 2085 ATOM 98021 O WAT 2086 80.741 36.607 58.962 1.00 0.00 O ATOM 98022 H1 WAT 2086 80.401 36.706 58.072 1.00 0.00 H ATOM 98023 H2 WAT 2086 80.381 37.354 59.440 1.00 0.00 H TER 98025 WAT 2086 ATOM 98025 O WAT 2087 34.127 13.020 0.302 1.00 0.00 O ATOM 98026 H1 WAT 2087 34.641 12.617 1.001 1.00 0.00 H ATOM 98027 H2 WAT 2087 34.441 13.923 0.263 1.00 0.00 H TER 98029 WAT 2087 ATOM 98029 O WAT 2088 17.342 42.520 107.915 1.00 0.00 O ATOM 98030 H1 WAT 2088 16.456 42.722 108.215 1.00 0.00 H ATOM 98031 H2 WAT 2088 17.909 42.803 108.633 1.00 0.00 H TER 98033 WAT 2088 ATOM 98033 O WAT 2089 44.078 93.602 119.755 1.00 0.00 O ATOM 98034 H1 WAT 2089 44.028 94.146 120.541 1.00 0.00 H ATOM 98035 H2 WAT 2089 44.020 94.223 119.029 1.00 0.00 H TER 98037 WAT 2089 ATOM 98037 O WAT 2090 18.192 68.530 62.439 1.00 0.00 O ATOM 98038 H1 WAT 2090 18.985 69.033 62.253 1.00 0.00 H ATOM 98039 H2 WAT 2090 18.280 68.274 63.357 1.00 0.00 H TER 98041 WAT 2090 ATOM 98041 O WAT 2091 33.155 102.368 158.369 1.00 0.00 O ATOM 98042 H1 WAT 2091 33.598 101.811 159.009 1.00 0.00 H ATOM 98043 H2 WAT 2091 32.232 102.127 158.439 1.00 0.00 H TER 98045 WAT 2091 ATOM 98045 O WAT 2092 126.754 70.252 150.770 1.00 0.00 O ATOM 98046 H1 WAT 2092 126.292 69.731 151.426 1.00 0.00 H ATOM 98047 H2 WAT 2092 126.368 69.985 149.936 1.00 0.00 H TER 98049 WAT 2092 ATOM 98049 O WAT 2093 59.765 41.510 21.648 1.00 0.00 O ATOM 98050 H1 WAT 2093 59.165 41.833 20.976 1.00 0.00 H ATOM 98051 H2 WAT 2093 60.420 41.007 21.164 1.00 0.00 H TER 98053 WAT 2093 ATOM 98053 O WAT 2094 86.855 130.340 126.641 1.00 0.00 O ATOM 98054 H1 WAT 2094 87.444 129.835 127.202 1.00 0.00 H ATOM 98055 H2 WAT 2094 86.203 130.700 127.242 1.00 0.00 H TER 98057 WAT 2094 ATOM 98057 O WAT 2095 26.555 51.115 24.827 1.00 0.00 O ATOM 98058 H1 WAT 2095 27.428 51.506 24.866 1.00 0.00 H ATOM 98059 H2 WAT 2095 26.345 51.089 23.894 1.00 0.00 H TER 98061 WAT 2095 ATOM 98061 O WAT 2096 23.036 48.146 119.914 1.00 0.00 O ATOM 98062 H1 WAT 2096 22.862 49.082 120.011 1.00 0.00 H ATOM 98063 H2 WAT 2096 22.249 47.797 119.496 1.00 0.00 H TER 98065 WAT 2096 ATOM 98065 O WAT 2097 84.073 16.892 153.707 1.00 0.00 O ATOM 98066 H1 WAT 2097 83.490 17.621 153.495 1.00 0.00 H ATOM 98067 H2 WAT 2097 84.953 17.239 153.562 1.00 0.00 H TER 98069 WAT 2097 ATOM 98069 O WAT 2098 91.310 145.544 152.980 1.00 0.00 O ATOM 98070 H1 WAT 2098 90.670 145.043 153.486 1.00 0.00 H ATOM 98071 H2 WAT 2098 91.860 145.966 153.640 1.00 0.00 H TER 98073 WAT 2098 ATOM 98073 O WAT 2099 104.441 145.904 137.048 1.00 0.00 O ATOM 98074 H1 WAT 2099 103.910 145.123 136.893 1.00 0.00 H ATOM 98075 H2 WAT 2099 105.316 145.664 136.744 1.00 0.00 H TER 98077 WAT 2099 ATOM 98077 O WAT 2100 25.772 87.971 120.132 1.00 0.00 O ATOM 98078 H1 WAT 2100 26.447 87.895 120.806 1.00 0.00 H ATOM 98079 H2 WAT 2100 25.510 88.891 120.157 1.00 0.00 H TER 98081 WAT 2100 ATOM 98081 O WAT 2101 128.530 46.621 23.515 1.00 0.00 O ATOM 98082 H1 WAT 2101 128.055 46.774 22.698 1.00 0.00 H ATOM 98083 H2 WAT 2101 128.172 47.268 24.124 1.00 0.00 H TER 98085 WAT 2101 ATOM 98085 O WAT 2102 58.347 49.173 114.580 1.00 0.00 O ATOM 98086 H1 WAT 2102 59.132 49.585 114.939 1.00 0.00 H ATOM 98087 H2 WAT 2102 57.752 49.100 115.327 1.00 0.00 H TER 98089 WAT 2102 ATOM 98089 O WAT 2103 27.906 14.494 102.880 1.00 0.00 O ATOM 98090 H1 WAT 2103 28.110 13.562 102.800 1.00 0.00 H ATOM 98091 H2 WAT 2103 28.452 14.797 103.605 1.00 0.00 H TER 98093 WAT 2103 ATOM 98093 O WAT 2104 127.355 7.223 19.496 1.00 0.00 O ATOM 98094 H1 WAT 2104 126.780 7.934 19.211 1.00 0.00 H ATOM 98095 H2 WAT 2104 126.789 6.652 20.016 1.00 0.00 H TER 98097 WAT 2104 ATOM 98097 O WAT 2105 87.401 140.584 142.012 1.00 0.00 O ATOM 98098 H1 WAT 2105 87.435 139.768 142.511 1.00 0.00 H ATOM 98099 H2 WAT 2105 86.911 140.359 141.220 1.00 0.00 H TER 98101 WAT 2105 ATOM 98101 O WAT 2106 134.147 85.442 125.508 1.00 0.00 O ATOM 98102 H1 WAT 2106 134.047 86.306 125.907 1.00 0.00 H ATOM 98103 H2 WAT 2106 133.429 84.925 125.872 1.00 0.00 H TER 98105 WAT 2106 ATOM 98105 O WAT 2107 118.976 137.861 125.047 1.00 0.00 O ATOM 98106 H1 WAT 2107 118.148 137.535 124.695 1.00 0.00 H ATOM 98107 H2 WAT 2107 118.812 137.972 125.983 1.00 0.00 H TER 98109 WAT 2107 ATOM 98109 O WAT 2108 20.174 6.109 142.560 1.00 0.00 O ATOM 98110 H1 WAT 2108 20.751 6.622 141.994 1.00 0.00 H ATOM 98111 H2 WAT 2108 19.379 6.638 142.634 1.00 0.00 H TER 98113 WAT 2108 ATOM 98113 O WAT 2109 115.605 51.511 116.683 1.00 0.00 O ATOM 98114 H1 WAT 2109 116.392 51.716 117.188 1.00 0.00 H ATOM 98115 H2 WAT 2109 115.591 50.555 116.639 1.00 0.00 H TER 98117 WAT 2109 ATOM 98117 O WAT 2110 72.868 31.961 113.267 1.00 0.00 O ATOM 98118 H1 WAT 2110 73.569 32.600 113.139 1.00 0.00 H ATOM 98119 H2 WAT 2110 72.097 32.490 113.470 1.00 0.00 H TER 98121 WAT 2110 ATOM 98121 O WAT 2111 51.558 9.453 62.461 1.00 0.00 O ATOM 98122 H1 WAT 2111 51.789 10.270 62.020 1.00 0.00 H ATOM 98123 H2 WAT 2111 51.331 8.853 61.751 1.00 0.00 H TER 98125 WAT 2111 ATOM 98125 O WAT 2112 105.434 78.485 72.766 1.00 0.00 O ATOM 98126 H1 WAT 2112 105.433 77.549 72.966 1.00 0.00 H ATOM 98127 H2 WAT 2112 105.089 78.899 73.558 1.00 0.00 H TER 98129 WAT 2112 ATOM 98129 O WAT 2113 103.464 30.401 123.992 1.00 0.00 O ATOM 98130 H1 WAT 2113 103.336 31.263 124.389 1.00 0.00 H ATOM 98131 H2 WAT 2113 104.039 30.564 123.244 1.00 0.00 H TER 98133 WAT 2113 ATOM 98133 O WAT 2114 6.087 118.749 82.944 1.00 0.00 O ATOM 98134 H1 WAT 2114 6.596 119.378 82.432 1.00 0.00 H ATOM 98135 H2 WAT 2114 5.616 119.285 83.582 1.00 0.00 H TER 98137 WAT 2114 ATOM 98137 O WAT 2115 24.699 142.285 122.251 1.00 0.00 O ATOM 98138 H1 WAT 2115 25.265 142.690 122.908 1.00 0.00 H ATOM 98139 H2 WAT 2115 25.254 142.198 121.477 1.00 0.00 H TER 98141 WAT 2115 ATOM 98141 O WAT 2116 38.179 44.917 16.161 1.00 0.00 O ATOM 98142 H1 WAT 2116 38.008 44.322 16.891 1.00 0.00 H ATOM 98143 H2 WAT 2116 37.432 44.797 15.575 1.00 0.00 H TER 98145 WAT 2116 ATOM 98145 O WAT 2117 118.237 10.223 87.795 1.00 0.00 O ATOM 98146 H1 WAT 2117 117.742 10.794 88.383 1.00 0.00 H ATOM 98147 H2 WAT 2117 118.471 10.785 87.056 1.00 0.00 H TER 98149 WAT 2117 ATOM 98149 O WAT 2118 88.842 112.792 116.601 1.00 0.00 O ATOM 98150 H1 WAT 2118 88.820 113.589 117.131 1.00 0.00 H ATOM 98151 H2 WAT 2118 89.283 113.055 115.793 1.00 0.00 H TER 98153 WAT 2118 ATOM 98153 O WAT 2119 96.057 25.385 134.417 1.00 0.00 O ATOM 98154 H1 WAT 2119 96.288 24.883 135.199 1.00 0.00 H ATOM 98155 H2 WAT 2119 95.119 25.552 134.508 1.00 0.00 H TER 98157 WAT 2119 ATOM 98157 O WAT 2120 0.225 144.180 12.458 1.00 0.00 O ATOM 98158 H1 WAT 2120 1.137 144.473 12.466 1.00 0.00 H ATOM 98159 H2 WAT 2120 0.123 143.739 11.614 1.00 0.00 H TER 98161 WAT 2120 ATOM 98161 O WAT 2121 7.509 59.569 90.538 1.00 0.00 O ATOM 98162 H1 WAT 2121 7.871 60.419 90.289 1.00 0.00 H ATOM 98163 H2 WAT 2121 6.726 59.782 91.046 1.00 0.00 H TER 98165 WAT 2121 ATOM 98165 O WAT 2122 69.777 41.777 18.535 1.00 0.00 O ATOM 98166 H1 WAT 2122 69.544 41.007 18.016 1.00 0.00 H ATOM 98167 H2 WAT 2122 70.441 41.461 19.148 1.00 0.00 H TER 98169 WAT 2122 ATOM 98169 O WAT 2123 59.695 89.002 101.580 1.00 0.00 O ATOM 98170 H1 WAT 2123 59.139 89.722 101.876 1.00 0.00 H ATOM 98171 H2 WAT 2123 59.735 88.406 102.328 1.00 0.00 H TER 98173 WAT 2123 ATOM 98173 O WAT 2124 69.977 21.447 121.174 1.00 0.00 O ATOM 98174 H1 WAT 2124 69.570 20.698 120.739 1.00 0.00 H ATOM 98175 H2 WAT 2124 70.239 21.112 122.032 1.00 0.00 H TER 98177 WAT 2124 ATOM 98177 O WAT 2125 62.720 108.240 148.329 1.00 0.00 O ATOM 98178 H1 WAT 2125 62.910 109.177 148.283 1.00 0.00 H ATOM 98179 H2 WAT 2125 63.495 107.858 148.741 1.00 0.00 H TER 98181 WAT 2125 ATOM 98181 O WAT 2126 28.433 107.253 90.012 1.00 0.00 O ATOM 98182 H1 WAT 2126 28.654 106.699 89.264 1.00 0.00 H ATOM 98183 H2 WAT 2126 29.179 107.847 90.099 1.00 0.00 H TER 98185 WAT 2126 ATOM 98185 O WAT 2127 48.152 53.064 86.169 1.00 0.00 O ATOM 98186 H1 WAT 2127 48.982 53.073 85.694 1.00 0.00 H ATOM 98187 H2 WAT 2127 48.393 52.842 87.069 1.00 0.00 H TER 98189 WAT 2127 ATOM 98189 O WAT 2128 47.662 6.335 116.516 1.00 0.00 O ATOM 98190 H1 WAT 2128 47.193 6.256 115.686 1.00 0.00 H ATOM 98191 H2 WAT 2128 47.009 6.119 117.182 1.00 0.00 H TER 98193 WAT 2128 ATOM 98193 O WAT 2129 29.938 26.815 88.729 1.00 0.00 O ATOM 98194 H1 WAT 2129 29.504 27.251 89.462 1.00 0.00 H ATOM 98195 H2 WAT 2129 30.808 27.212 88.695 1.00 0.00 H TER 98197 WAT 2129 ATOM 98197 O WAT 2130 132.603 53.216 153.197 1.00 0.00 O ATOM 98198 H1 WAT 2130 132.226 52.638 152.534 1.00 0.00 H ATOM 98199 H2 WAT 2130 132.050 53.088 153.968 1.00 0.00 H TER 98201 WAT 2130 ATOM 98201 O WAT 2131 37.966 13.521 101.933 1.00 0.00 O ATOM 98202 H1 WAT 2131 38.901 13.657 101.776 1.00 0.00 H ATOM 98203 H2 WAT 2131 37.804 13.933 102.782 1.00 0.00 H TER 98205 WAT 2131 ATOM 98205 O WAT 2132 96.231 122.853 70.653 1.00 0.00 O ATOM 98206 H1 WAT 2132 95.769 122.886 71.491 1.00 0.00 H ATOM 98207 H2 WAT 2132 96.913 122.194 70.781 1.00 0.00 H TER 98209 WAT 2132 ATOM 98209 O WAT 2133 46.048 121.584 128.742 1.00 0.00 O ATOM 98210 H1 WAT 2133 46.861 121.900 128.346 1.00 0.00 H ATOM 98211 H2 WAT 2133 46.147 121.772 129.675 1.00 0.00 H TER 98213 WAT 2133 ATOM 98213 O WAT 2134 100.704 2.080 5.782 1.00 0.00 O ATOM 98214 H1 WAT 2134 100.319 1.303 6.188 1.00 0.00 H ATOM 98215 H2 WAT 2134 99.962 2.668 5.640 1.00 0.00 H TER 98217 WAT 2134 ATOM 98217 O WAT 2135 87.897 17.775 110.613 1.00 0.00 O ATOM 98218 H1 WAT 2135 87.503 17.639 109.752 1.00 0.00 H ATOM 98219 H2 WAT 2135 88.004 16.893 110.969 1.00 0.00 H TER 98221 WAT 2135 ATOM 98221 O WAT 2136 118.731 120.268 116.347 1.00 0.00 O ATOM 98222 H1 WAT 2136 118.707 121.208 116.172 1.00 0.00 H ATOM 98223 H2 WAT 2136 118.445 120.187 117.257 1.00 0.00 H TER 98225 WAT 2136 ATOM 98225 O WAT 2137 26.882 91.048 133.270 1.00 0.00 O ATOM 98226 H1 WAT 2137 26.232 90.775 133.917 1.00 0.00 H ATOM 98227 H2 WAT 2137 27.634 90.479 133.431 1.00 0.00 H TER 98229 WAT 2137 ATOM 98229 O WAT 2138 79.781 27.323 146.345 1.00 0.00 O ATOM 98230 H1 WAT 2138 79.853 28.239 146.077 1.00 0.00 H ATOM 98231 H2 WAT 2138 80.686 27.031 146.446 1.00 0.00 H TER 98233 WAT 2138 ATOM 98233 O WAT 2139 144.084 85.385 57.355 1.00 0.00 O ATOM 98234 H1 WAT 2139 144.245 85.314 56.414 1.00 0.00 H ATOM 98235 H2 WAT 2139 143.956 84.481 57.645 1.00 0.00 H TER 98237 WAT 2139 ATOM 98237 O WAT 2140 126.505 99.208 158.072 1.00 0.00 O ATOM 98238 H1 WAT 2140 126.292 98.291 157.899 1.00 0.00 H ATOM 98239 H2 WAT 2140 126.645 99.247 159.018 1.00 0.00 H TER 98241 WAT 2140 ATOM 98241 O WAT 2141 119.621 82.293 99.022 1.00 0.00 O ATOM 98242 H1 WAT 2141 118.802 82.660 98.687 1.00 0.00 H ATOM 98243 H2 WAT 2141 119.520 82.312 99.974 1.00 0.00 H TER 98245 WAT 2141 ATOM 98245 O WAT 2142 78.598 61.329 122.106 1.00 0.00 O ATOM 98246 H1 WAT 2142 79.375 61.495 121.572 1.00 0.00 H ATOM 98247 H2 WAT 2142 78.935 60.901 122.893 1.00 0.00 H TER 98249 WAT 2142 ATOM 98249 O WAT 2143 59.723 129.572 123.053 1.00 0.00 O ATOM 98250 H1 WAT 2143 59.017 129.246 122.494 1.00 0.00 H ATOM 98251 H2 WAT 2143 60.189 130.205 122.507 1.00 0.00 H TER 98253 WAT 2143 ATOM 98253 O WAT 2144 124.210 101.024 68.616 1.00 0.00 O ATOM 98254 H1 WAT 2144 124.687 101.833 68.433 1.00 0.00 H ATOM 98255 H2 WAT 2144 123.516 101.001 67.957 1.00 0.00 H TER 98257 WAT 2144 ATOM 98257 O WAT 2145 131.774 31.165 119.631 1.00 0.00 O ATOM 98258 H1 WAT 2145 131.902 30.798 118.756 1.00 0.00 H ATOM 98259 H2 WAT 2145 131.059 31.793 119.525 1.00 0.00 H TER 98261 WAT 2145 ATOM 98261 O WAT 2146 34.189 14.224 137.925 1.00 0.00 O ATOM 98262 H1 WAT 2146 33.567 13.589 138.281 1.00 0.00 H ATOM 98263 H2 WAT 2146 34.285 13.977 137.006 1.00 0.00 H TER 98265 WAT 2146 ATOM 98265 O WAT 2147 95.495 41.830 98.063 1.00 0.00 O ATOM 98266 H1 WAT 2147 94.630 42.155 97.814 1.00 0.00 H ATOM 98267 H2 WAT 2147 95.493 41.853 99.020 1.00 0.00 H TER 98269 WAT 2147 ATOM 98269 O WAT 2148 6.956 93.404 88.990 1.00 0.00 O ATOM 98270 H1 WAT 2148 6.418 94.077 88.572 1.00 0.00 H ATOM 98271 H2 WAT 2148 7.806 93.824 89.120 1.00 0.00 H TER 98273 WAT 2148 ATOM 98273 O WAT 2149 4.834 1.432 145.578 1.00 0.00 O ATOM 98274 H1 WAT 2149 5.236 0.937 146.291 1.00 0.00 H ATOM 98275 H2 WAT 2149 5.427 1.309 144.836 1.00 0.00 H TER 98277 WAT 2149 ATOM 98277 O WAT 2150 48.842 60.695 79.536 1.00 0.00 O ATOM 98278 H1 WAT 2150 49.623 61.011 79.991 1.00 0.00 H ATOM 98279 H2 WAT 2150 49.064 59.803 79.270 1.00 0.00 H TER 98281 WAT 2150 ATOM 98281 O WAT 2151 93.617 106.301 6.303 1.00 0.00 O ATOM 98282 H1 WAT 2151 94.046 105.458 6.448 1.00 0.00 H ATOM 98283 H2 WAT 2151 93.151 106.193 5.474 1.00 0.00 H TER 98285 WAT 2151 ATOM 98285 O WAT 2152 144.911 102.118 116.055 1.00 0.00 O ATOM 98286 H1 WAT 2152 144.910 102.934 115.554 1.00 0.00 H ATOM 98287 H2 WAT 2152 144.879 101.430 115.390 1.00 0.00 H TER 98289 WAT 2152 ATOM 98289 O WAT 2153 118.717 36.602 65.786 1.00 0.00 O ATOM 98290 H1 WAT 2153 118.458 37.020 64.965 1.00 0.00 H ATOM 98291 H2 WAT 2153 118.557 37.268 66.455 1.00 0.00 H TER 98293 WAT 2153 ATOM 98293 O WAT 2154 6.866 86.866 13.188 1.00 0.00 O ATOM 98294 H1 WAT 2154 6.558 85.970 13.321 1.00 0.00 H ATOM 98295 H2 WAT 2154 7.006 86.933 12.244 1.00 0.00 H TER 98297 WAT 2154 ATOM 98297 O WAT 2155 67.378 12.505 115.355 1.00 0.00 O ATOM 98298 H1 WAT 2155 67.449 12.183 114.456 1.00 0.00 H ATOM 98299 H2 WAT 2155 66.487 12.850 115.415 1.00 0.00 H TER 98301 WAT 2155 ATOM 98301 O WAT 2156 94.332 31.058 80.142 1.00 0.00 O ATOM 98302 H1 WAT 2156 94.245 31.190 79.198 1.00 0.00 H ATOM 98303 H2 WAT 2156 93.632 31.589 80.524 1.00 0.00 H TER 98305 WAT 2156 ATOM 98305 O WAT 2157 129.502 117.704 73.833 1.00 0.00 O ATOM 98306 H1 WAT 2157 130.169 117.179 74.275 1.00 0.00 H ATOM 98307 H2 WAT 2157 129.030 118.139 74.543 1.00 0.00 H TER 98309 WAT 2157 ATOM 98309 O WAT 2158 1.908 32.640 118.778 1.00 0.00 O ATOM 98310 H1 WAT 2158 1.639 33.312 119.404 1.00 0.00 H ATOM 98311 H2 WAT 2158 1.541 31.827 119.127 1.00 0.00 H TER 98313 WAT 2158 ATOM 98313 O WAT 2159 38.676 14.906 25.179 1.00 0.00 O ATOM 98314 H1 WAT 2159 38.890 14.223 24.544 1.00 0.00 H ATOM 98315 H2 WAT 2159 37.980 15.413 24.760 1.00 0.00 H TER 98317 WAT 2159 ATOM 98317 O WAT 2160 37.452 33.932 154.610 1.00 0.00 O ATOM 98318 H1 WAT 2160 38.185 34.501 154.844 1.00 0.00 H ATOM 98319 H2 WAT 2160 37.315 33.387 155.385 1.00 0.00 H TER 98321 WAT 2160 ATOM 98321 O WAT 2161 93.319 21.107 67.155 1.00 0.00 O ATOM 98322 H1 WAT 2161 93.024 20.205 67.032 1.00 0.00 H ATOM 98323 H2 WAT 2161 93.850 21.079 67.951 1.00 0.00 H TER 98325 WAT 2161 ATOM 98325 O WAT 2162 122.804 25.146 5.168 1.00 0.00 O ATOM 98326 H1 WAT 2162 122.626 25.599 5.993 1.00 0.00 H ATOM 98327 H2 WAT 2162 123.514 24.539 5.377 1.00 0.00 H TER 98329 WAT 2162 ATOM 98329 O WAT 2163 105.853 56.658 5.833 1.00 0.00 O ATOM 98330 H1 WAT 2163 106.139 57.419 5.327 1.00 0.00 H ATOM 98331 H2 WAT 2163 105.439 56.084 5.190 1.00 0.00 H TER 98333 WAT 2163 ATOM 98333 O WAT 2164 103.952 110.276 2.850 1.00 0.00 O ATOM 98334 H1 WAT 2164 103.374 111.022 2.694 1.00 0.00 H ATOM 98335 H2 WAT 2164 104.667 110.391 2.224 1.00 0.00 H TER 98337 WAT 2164 ATOM 98337 O WAT 2165 39.172 8.479 115.766 1.00 0.00 O ATOM 98338 H1 WAT 2165 39.118 9.273 116.298 1.00 0.00 H ATOM 98339 H2 WAT 2165 39.415 8.791 114.894 1.00 0.00 H TER 98341 WAT 2165 ATOM 98341 O WAT 2166 61.679 121.929 130.639 1.00 0.00 O ATOM 98342 H1 WAT 2166 62.248 121.958 129.869 1.00 0.00 H ATOM 98343 H2 WAT 2166 61.875 122.738 131.111 1.00 0.00 H TER 98345 WAT 2166 ATOM 98345 O WAT 2167 42.407 89.504 14.781 1.00 0.00 O ATOM 98346 H1 WAT 2167 43.362 89.463 14.728 1.00 0.00 H ATOM 98347 H2 WAT 2167 42.198 89.122 15.633 1.00 0.00 H TER 98349 WAT 2167 ATOM 98349 O WAT 2168 95.147 136.996 95.996 1.00 0.00 O ATOM 98350 H1 WAT 2168 95.272 137.724 96.604 1.00 0.00 H ATOM 98351 H2 WAT 2168 94.530 137.331 95.345 1.00 0.00 H TER 98353 WAT 2168 ATOM 98353 O WAT 2169 11.945 96.818 147.162 1.00 0.00 O ATOM 98354 H1 WAT 2169 12.265 96.153 147.771 1.00 0.00 H ATOM 98355 H2 WAT 2169 11.144 97.149 147.568 1.00 0.00 H TER 98357 WAT 2169 ATOM 98357 O WAT 2170 96.275 32.401 10.239 1.00 0.00 O ATOM 98358 H1 WAT 2170 96.209 33.318 9.973 1.00 0.00 H ATOM 98359 H2 WAT 2170 95.435 32.017 9.988 1.00 0.00 H TER 98361 WAT 2170 ATOM 98361 O WAT 2171 50.039 68.121 130.732 1.00 0.00 O ATOM 98362 H1 WAT 2171 50.577 67.930 131.500 1.00 0.00 H ATOM 98363 H2 WAT 2171 49.291 67.529 130.810 1.00 0.00 H TER 98365 WAT 2171 ATOM 98365 O WAT 2172 71.747 136.252 121.467 1.00 0.00 O ATOM 98366 H1 WAT 2172 71.061 135.629 121.706 1.00 0.00 H ATOM 98367 H2 WAT 2172 71.486 136.577 120.605 1.00 0.00 H TER 98369 WAT 2172 ATOM 98369 O WAT 2173 121.774 128.760 105.684 1.00 0.00 O ATOM 98370 H1 WAT 2173 122.420 129.302 106.137 1.00 0.00 H ATOM 98371 H2 WAT 2173 121.118 128.560 106.352 1.00 0.00 H TER 98373 WAT 2173 ATOM 98373 O WAT 2174 28.835 68.689 66.814 1.00 0.00 O ATOM 98374 H1 WAT 2174 28.310 69.046 66.098 1.00 0.00 H ATOM 98375 H2 WAT 2174 29.738 68.899 66.578 1.00 0.00 H TER 98377 WAT 2174 ATOM 98377 O WAT 2175 57.771 119.917 155.131 1.00 0.00 O ATOM 98378 H1 WAT 2175 58.397 120.625 154.981 1.00 0.00 H ATOM 98379 H2 WAT 2175 57.844 119.727 156.066 1.00 0.00 H TER 98381 WAT 2175 ATOM 98381 O WAT 2176 128.542 5.595 81.454 1.00 0.00 O ATOM 98382 H1 WAT 2176 128.542 4.858 80.843 1.00 0.00 H ATOM 98383 H2 WAT 2176 129.383 5.530 81.907 1.00 0.00 H TER 98385 WAT 2176 ATOM 98385 O WAT 2177 67.484 6.410 86.950 1.00 0.00 O ATOM 98386 H1 WAT 2177 68.395 6.560 86.700 1.00 0.00 H ATOM 98387 H2 WAT 2177 67.527 5.718 87.610 1.00 0.00 H TER 98389 WAT 2177 ATOM 98389 O WAT 2178 119.473 129.629 57.559 1.00 0.00 O ATOM 98390 H1 WAT 2178 118.727 129.823 58.127 1.00 0.00 H ATOM 98391 H2 WAT 2178 119.599 128.684 57.643 1.00 0.00 H TER 98393 WAT 2178 ATOM 98393 O WAT 2179 4.226 109.356 84.066 1.00 0.00 O ATOM 98394 H1 WAT 2179 4.609 110.192 84.334 1.00 0.00 H ATOM 98395 H2 WAT 2179 4.402 109.303 83.126 1.00 0.00 H TER 98397 WAT 2179 ATOM 98397 O WAT 2180 120.416 73.812 5.087 1.00 0.00 O ATOM 98398 H1 WAT 2180 120.535 74.717 5.376 1.00 0.00 H ATOM 98399 H2 WAT 2180 119.928 73.885 4.267 1.00 0.00 H TER 98401 WAT 2180 ATOM 98401 O WAT 2181 121.421 18.646 152.575 1.00 0.00 O ATOM 98402 H1 WAT 2181 120.892 18.228 153.255 1.00 0.00 H ATOM 98403 H2 WAT 2181 120.785 18.927 151.917 1.00 0.00 H TER 98405 WAT 2181 ATOM 98405 O WAT 2182 42.580 101.539 108.505 1.00 0.00 O ATOM 98406 H1 WAT 2182 41.910 102.222 108.521 1.00 0.00 H ATOM 98407 H2 WAT 2182 42.195 100.839 107.979 1.00 0.00 H TER 98409 WAT 2182 ATOM 98409 O WAT 2183 70.245 78.812 92.336 1.00 0.00 O ATOM 98410 H1 WAT 2183 70.420 79.548 91.749 1.00 0.00 H ATOM 98411 H2 WAT 2183 69.439 79.056 92.793 1.00 0.00 H TER 98413 WAT 2183 ATOM 98413 O WAT 2184 119.536 46.933 7.908 1.00 0.00 O ATOM 98414 H1 WAT 2184 119.663 46.897 8.857 1.00 0.00 H ATOM 98415 H2 WAT 2184 119.658 47.855 7.685 1.00 0.00 H TER 98417 WAT 2184 ATOM 98417 O WAT 2185 80.749 73.662 147.673 1.00 0.00 O ATOM 98418 H1 WAT 2185 79.795 73.732 147.697 1.00 0.00 H ATOM 98419 H2 WAT 2185 81.028 73.889 148.560 1.00 0.00 H TER 98421 WAT 2185 ATOM 98421 O WAT 2186 67.731 56.011 66.356 1.00 0.00 O ATOM 98422 H1 WAT 2186 67.797 56.569 67.131 1.00 0.00 H ATOM 98423 H2 WAT 2186 68.104 55.174 66.632 1.00 0.00 H TER 98425 WAT 2186 ATOM 98425 O WAT 2187 71.480 80.114 87.089 1.00 0.00 O ATOM 98426 H1 WAT 2187 72.342 80.049 86.679 1.00 0.00 H ATOM 98427 H2 WAT 2187 71.080 80.885 86.686 1.00 0.00 H TER 98429 WAT 2187 ATOM 98429 O WAT 2188 63.678 61.619 17.408 1.00 0.00 O ATOM 98430 H1 WAT 2188 64.410 62.203 17.605 1.00 0.00 H ATOM 98431 H2 WAT 2188 63.592 61.072 18.188 1.00 0.00 H TER 98433 WAT 2188 ATOM 98433 O WAT 2189 74.133 32.831 149.420 1.00 0.00 O ATOM 98434 H1 WAT 2189 73.253 32.706 149.776 1.00 0.00 H ATOM 98435 H2 WAT 2189 74.064 32.550 148.508 1.00 0.00 H TER 98437 WAT 2189 ATOM 98437 O WAT 2190 104.190 54.684 92.221 1.00 0.00 O ATOM 98438 H1 WAT 2190 103.782 53.881 91.898 1.00 0.00 H ATOM 98439 H2 WAT 2190 105.083 54.425 92.447 1.00 0.00 H TER 98441 WAT 2190 ATOM 98441 O WAT 2191 30.837 70.295 78.747 1.00 0.00 O ATOM 98442 H1 WAT 2191 30.984 71.125 79.201 1.00 0.00 H ATOM 98443 H2 WAT 2191 30.676 69.664 79.448 1.00 0.00 H TER 98445 WAT 2191 ATOM 98445 O WAT 2192 46.487 83.410 145.708 1.00 0.00 O ATOM 98446 H1 WAT 2192 46.795 83.392 144.802 1.00 0.00 H ATOM 98447 H2 WAT 2192 46.413 84.341 145.917 1.00 0.00 H TER 98449 WAT 2192 ATOM 98449 O WAT 2193 52.330 26.433 98.370 1.00 0.00 O ATOM 98450 H1 WAT 2193 52.842 25.631 98.269 1.00 0.00 H ATOM 98451 H2 WAT 2193 51.782 26.271 99.138 1.00 0.00 H TER 98453 WAT 2193 ATOM 98453 O WAT 2194 112.523 72.914 139.249 1.00 0.00 O ATOM 98454 H1 WAT 2194 113.396 72.780 138.878 1.00 0.00 H ATOM 98455 H2 WAT 2194 112.493 73.847 139.458 1.00 0.00 H TER 98457 WAT 2194 ATOM 98457 O WAT 2195 53.737 13.059 85.427 1.00 0.00 O ATOM 98458 H1 WAT 2195 54.510 13.017 85.990 1.00 0.00 H ATOM 98459 H2 WAT 2195 53.237 12.273 85.648 1.00 0.00 H TER 98461 WAT 2195 ATOM 98461 O WAT 2196 122.698 62.260 20.918 1.00 0.00 O ATOM 98462 H1 WAT 2196 123.521 61.788 21.044 1.00 0.00 H ATOM 98463 H2 WAT 2196 122.238 62.166 21.752 1.00 0.00 H TER 98465 WAT 2196 ATOM 98465 O WAT 2197 110.926 97.450 153.732 1.00 0.00 O ATOM 98466 H1 WAT 2197 111.106 96.510 153.758 1.00 0.00 H ATOM 98467 H2 WAT 2197 111.717 97.835 153.356 1.00 0.00 H TER 98469 WAT 2197 ATOM 98469 O WAT 2198 24.186 131.587 125.140 1.00 0.00 O ATOM 98470 H1 WAT 2198 24.858 132.080 124.668 1.00 0.00 H ATOM 98471 H2 WAT 2198 23.358 131.941 124.817 1.00 0.00 H TER 98473 WAT 2198 ATOM 98473 O WAT 2199 50.787 14.644 99.458 1.00 0.00 O ATOM 98474 H1 WAT 2199 51.028 15.570 99.466 1.00 0.00 H ATOM 98475 H2 WAT 2199 49.950 14.610 99.922 1.00 0.00 H TER 98477 WAT 2199 ATOM 98477 O WAT 2200 94.908 38.319 77.477 1.00 0.00 O ATOM 98478 H1 WAT 2200 95.827 38.143 77.276 1.00 0.00 H ATOM 98479 H2 WAT 2200 94.487 38.405 76.622 1.00 0.00 H TER 98481 WAT 2200 ATOM 98481 O WAT 2201 109.165 25.774 15.926 1.00 0.00 O ATOM 98482 H1 WAT 2201 109.276 24.835 16.075 1.00 0.00 H ATOM 98483 H2 WAT 2201 109.102 26.150 16.804 1.00 0.00 H TER 98485 WAT 2201 ATOM 98485 O WAT 2202 135.574 139.100 97.528 1.00 0.00 O ATOM 98486 H1 WAT 2202 135.288 139.042 98.439 1.00 0.00 H ATOM 98487 H2 WAT 2202 135.660 140.039 97.363 1.00 0.00 H TER 98489 WAT 2202 ATOM 98489 O WAT 2203 43.967 39.085 116.024 1.00 0.00 O ATOM 98490 H1 WAT 2203 44.497 38.660 115.351 1.00 0.00 H ATOM 98491 H2 WAT 2203 44.451 39.881 116.243 1.00 0.00 H TER 98493 WAT 2203 ATOM 98493 O WAT 2204 67.343 5.323 16.550 1.00 0.00 O ATOM 98494 H1 WAT 2204 67.942 5.093 15.840 1.00 0.00 H ATOM 98495 H2 WAT 2204 66.571 5.676 16.107 1.00 0.00 H TER 98497 WAT 2204 ATOM 98497 O WAT 2205 44.605 135.324 85.045 1.00 0.00 O ATOM 98498 H1 WAT 2205 44.736 135.182 85.982 1.00 0.00 H ATOM 98499 H2 WAT 2205 45.380 134.940 84.634 1.00 0.00 H TER 98501 WAT 2205 ATOM 98501 O WAT 2206 102.456 84.365 28.070 1.00 0.00 O ATOM 98502 H1 WAT 2206 102.681 83.434 28.089 1.00 0.00 H ATOM 98503 H2 WAT 2206 103.276 84.813 28.279 1.00 0.00 H TER 98505 WAT 2206 ATOM 98505 O WAT 2207 69.164 50.843 12.337 1.00 0.00 O ATOM 98506 H1 WAT 2207 69.916 50.727 12.918 1.00 0.00 H ATOM 98507 H2 WAT 2207 69.479 51.431 11.651 1.00 0.00 H TER 98509 WAT 2207 ATOM 98509 O WAT 2208 90.676 53.687 68.413 1.00 0.00 O ATOM 98510 H1 WAT 2208 91.163 53.319 67.676 1.00 0.00 H ATOM 98511 H2 WAT 2208 91.271 54.332 68.795 1.00 0.00 H TER 98513 WAT 2208 ATOM 98513 O WAT 2209 98.777 105.245 90.652 1.00 0.00 O ATOM 98514 H1 WAT 2209 99.183 105.058 89.806 1.00 0.00 H ATOM 98515 H2 WAT 2209 98.886 104.437 91.154 1.00 0.00 H TER 98517 WAT 2209 ATOM 98517 O WAT 2210 131.547 75.900 88.779 1.00 0.00 O ATOM 98518 H1 WAT 2210 132.382 76.119 89.193 1.00 0.00 H ATOM 98519 H2 WAT 2210 131.777 75.682 87.876 1.00 0.00 H TER 98521 WAT 2210 ATOM 98521 O WAT 2211 8.246 5.787 7.905 1.00 0.00 O ATOM 98522 H1 WAT 2211 7.772 6.612 7.800 1.00 0.00 H ATOM 98523 H2 WAT 2211 8.591 5.821 8.797 1.00 0.00 H TER 98525 WAT 2211 ATOM 98525 O WAT 2212 0.236 135.160 14.196 1.00 0.00 O ATOM 98526 H1 WAT 2212 0.803 135.931 14.187 1.00 0.00 H ATOM 98527 H2 WAT 2212 -0.113 135.128 15.087 1.00 0.00 H TER 98529 WAT 2212 ATOM 98529 O WAT 2213 105.475 80.064 134.425 1.00 0.00 O ATOM 98530 H1 WAT 2213 104.713 80.640 134.489 1.00 0.00 H ATOM 98531 H2 WAT 2213 105.324 79.556 133.628 1.00 0.00 H TER 98533 WAT 2213 ATOM 98533 O WAT 2214 63.709 30.749 70.117 1.00 0.00 O ATOM 98534 H1 WAT 2214 64.645 30.950 70.106 1.00 0.00 H ATOM 98535 H2 WAT 2214 63.655 29.885 70.525 1.00 0.00 H TER 98537 WAT 2214 ATOM 98537 O WAT 2215 111.366 5.840 106.759 1.00 0.00 O ATOM 98538 H1 WAT 2215 111.820 6.644 106.507 1.00 0.00 H ATOM 98539 H2 WAT 2215 110.927 6.061 107.581 1.00 0.00 H TER 98541 WAT 2215 ATOM 98541 O WAT 2216 64.613 27.526 89.858 1.00 0.00 O ATOM 98542 H1 WAT 2216 65.361 28.021 90.193 1.00 0.00 H ATOM 98543 H2 WAT 2216 64.023 28.192 89.506 1.00 0.00 H TER 98545 WAT 2216 ATOM 98545 O WAT 2217 78.573 8.017 135.209 1.00 0.00 O ATOM 98546 H1 WAT 2217 78.638 7.990 134.254 1.00 0.00 H ATOM 98547 H2 WAT 2217 78.088 7.224 135.438 1.00 0.00 H TER 98549 WAT 2217 ATOM 98549 O WAT 2218 17.883 40.742 76.356 1.00 0.00 O ATOM 98550 H1 WAT 2218 18.740 41.095 76.117 1.00 0.00 H ATOM 98551 H2 WAT 2218 17.811 40.903 77.296 1.00 0.00 H TER 98553 WAT 2218 ATOM 98553 O WAT 2219 87.103 78.833 141.354 1.00 0.00 O ATOM 98554 H1 WAT 2219 87.420 77.957 141.574 1.00 0.00 H ATOM 98555 H2 WAT 2219 87.223 78.900 140.406 1.00 0.00 H TER 98557 WAT 2219 ATOM 98557 O WAT 2220 132.296 101.648 93.108 1.00 0.00 O ATOM 98558 H1 WAT 2220 132.358 102.183 93.899 1.00 0.00 H ATOM 98559 H2 WAT 2220 131.940 102.241 92.446 1.00 0.00 H TER 98561 WAT 2220 ATOM 98561 O WAT 2221 65.140 109.085 127.620 1.00 0.00 O ATOM 98562 H1 WAT 2221 64.966 110.026 127.605 1.00 0.00 H ATOM 98563 H2 WAT 2221 64.682 108.745 126.852 1.00 0.00 H TER 98565 WAT 2221 ATOM 98565 O WAT 2222 84.872 98.340 119.142 1.00 0.00 O ATOM 98566 H1 WAT 2222 84.702 97.403 119.039 1.00 0.00 H ATOM 98567 H2 WAT 2222 85.826 98.408 119.172 1.00 0.00 H TER 98569 WAT 2222 ATOM 98569 O WAT 2223 137.982 64.000 129.529 1.00 0.00 O ATOM 98570 H1 WAT 2223 137.439 64.491 130.145 1.00 0.00 H ATOM 98571 H2 WAT 2223 138.698 64.597 129.312 1.00 0.00 H TER 98573 WAT 2223 ATOM 98573 O WAT 2224 23.811 54.130 111.376 1.00 0.00 O ATOM 98574 H1 WAT 2224 24.728 54.287 111.601 1.00 0.00 H ATOM 98575 H2 WAT 2224 23.602 54.810 110.735 1.00 0.00 H TER 98577 WAT 2224 ATOM 98577 O WAT 2225 30.756 4.351 107.346 1.00 0.00 O ATOM 98578 H1 WAT 2225 30.803 3.420 107.129 1.00 0.00 H ATOM 98579 H2 WAT 2225 30.938 4.799 106.520 1.00 0.00 H TER 98581 WAT 2225 ATOM 98581 O WAT 2226 44.885 6.077 12.603 1.00 0.00 O ATOM 98582 H1 WAT 2226 43.943 6.172 12.748 1.00 0.00 H ATOM 98583 H2 WAT 2226 45.164 5.435 13.256 1.00 0.00 H TER 98585 WAT 2226 ATOM 98585 O WAT 2227 68.671 105.059 145.428 1.00 0.00 O ATOM 98586 H1 WAT 2227 69.342 105.402 144.838 1.00 0.00 H ATOM 98587 H2 WAT 2227 68.737 104.108 145.340 1.00 0.00 H TER 98589 WAT 2227 ATOM 98589 O WAT 2228 24.766 70.581 142.393 1.00 0.00 O ATOM 98590 H1 WAT 2228 24.358 71.261 142.929 1.00 0.00 H ATOM 98591 H2 WAT 2228 25.707 70.709 142.518 1.00 0.00 H TER 98593 WAT 2228 ATOM 98593 O WAT 2229 15.034 137.014 56.042 1.00 0.00 O ATOM 98594 H1 WAT 2229 15.270 136.344 56.683 1.00 0.00 H ATOM 98595 H2 WAT 2229 15.423 137.820 56.382 1.00 0.00 H TER 98597 WAT 2229 ATOM 98597 O WAT 2230 37.359 139.054 152.092 1.00 0.00 O ATOM 98598 H1 WAT 2230 37.973 138.958 152.820 1.00 0.00 H ATOM 98599 H2 WAT 2230 37.179 139.993 152.052 1.00 0.00 H TER 98601 WAT 2230 ATOM 98601 O WAT 2231 103.365 125.676 71.265 1.00 0.00 O ATOM 98602 H1 WAT 2231 103.171 126.469 70.765 1.00 0.00 H ATOM 98603 H2 WAT 2231 102.538 125.451 71.690 1.00 0.00 H TER 98605 WAT 2231 ATOM 98605 O WAT 2232 93.758 27.320 0.475 1.00 0.00 O ATOM 98606 H1 WAT 2232 92.915 27.154 0.053 1.00 0.00 H ATOM 98607 H2 WAT 2232 94.381 26.788 -0.019 1.00 0.00 H TER 98609 WAT 2232 ATOM 98609 O WAT 2233 40.850 88.486 146.225 1.00 0.00 O ATOM 98610 H1 WAT 2233 40.227 87.765 146.313 1.00 0.00 H ATOM 98611 H2 WAT 2233 40.541 88.977 145.464 1.00 0.00 H TER 98613 WAT 2233 ATOM 98613 O WAT 2234 61.284 124.178 1.260 1.00 0.00 O ATOM 98614 H1 WAT 2234 61.739 124.993 1.474 1.00 0.00 H ATOM 98615 H2 WAT 2234 60.586 124.443 0.661 1.00 0.00 H TER 98617 WAT 2234 ATOM 98617 O WAT 2235 37.883 128.399 6.158 1.00 0.00 O ATOM 98618 H1 WAT 2235 38.826 128.236 6.194 1.00 0.00 H ATOM 98619 H2 WAT 2235 37.500 127.544 5.960 1.00 0.00 H TER 98621 WAT 2235 ATOM 98621 O WAT 2236 122.703 110.648 119.840 1.00 0.00 O ATOM 98622 H1 WAT 2236 122.032 111.151 120.301 1.00 0.00 H ATOM 98623 H2 WAT 2236 123.382 111.289 119.630 1.00 0.00 H TER 98625 WAT 2236 ATOM 98625 O WAT 2237 56.937 79.753 13.178 1.00 0.00 O ATOM 98626 H1 WAT 2237 56.728 80.617 12.824 1.00 0.00 H ATOM 98627 H2 WAT 2237 56.330 79.160 12.735 1.00 0.00 H TER 98629 WAT 2237 ATOM 98629 O WAT 2238 87.293 142.056 108.543 1.00 0.00 O ATOM 98630 H1 WAT 2238 86.470 142.530 108.421 1.00 0.00 H ATOM 98631 H2 WAT 2238 87.443 142.075 109.489 1.00 0.00 H TER 98633 WAT 2238 ATOM 98633 O WAT 2239 74.717 7.354 5.569 1.00 0.00 O ATOM 98634 H1 WAT 2239 74.557 7.948 4.836 1.00 0.00 H ATOM 98635 H2 WAT 2239 73.906 6.852 5.651 1.00 0.00 H TER 98637 WAT 2239 ATOM 98637 O WAT 2240 87.426 125.852 149.806 1.00 0.00 O ATOM 98638 H1 WAT 2240 87.168 125.144 149.215 1.00 0.00 H ATOM 98639 H2 WAT 2240 87.235 126.652 149.317 1.00 0.00 H TER 98641 WAT 2240 ATOM 98641 O WAT 2241 93.338 141.026 128.856 1.00 0.00 O ATOM 98642 H1 WAT 2241 93.515 140.814 129.773 1.00 0.00 H ATOM 98643 H2 WAT 2241 92.708 140.362 128.574 1.00 0.00 H TER 98645 WAT 2241 ATOM 98645 O WAT 2242 116.516 30.938 83.992 1.00 0.00 O ATOM 98646 H1 WAT 2242 116.500 31.416 84.821 1.00 0.00 H ATOM 98647 H2 WAT 2242 116.843 30.068 84.223 1.00 0.00 H TER 98649 WAT 2242 ATOM 98649 O WAT 2243 30.117 46.857 55.371 1.00 0.00 O ATOM 98650 H1 WAT 2243 29.414 46.362 55.792 1.00 0.00 H ATOM 98651 H2 WAT 2243 30.017 47.747 55.706 1.00 0.00 H TER 98653 WAT 2243 ATOM 98653 O WAT 2244 57.910 104.647 2.307 1.00 0.00 O ATOM 98654 H1 WAT 2244 57.303 104.008 2.681 1.00 0.00 H ATOM 98655 H2 WAT 2244 57.526 105.497 2.523 1.00 0.00 H TER 98657 WAT 2244 ATOM 98657 O WAT 2245 6.979 91.937 0.992 1.00 0.00 O ATOM 98658 H1 WAT 2245 6.260 91.521 0.516 1.00 0.00 H ATOM 98659 H2 WAT 2245 7.768 91.655 0.530 1.00 0.00 H TER 98661 WAT 2245 ATOM 98661 O WAT 2246 105.622 111.144 120.697 1.00 0.00 O ATOM 98662 H1 WAT 2246 105.341 110.439 120.113 1.00 0.00 H ATOM 98663 H2 WAT 2246 105.100 111.022 121.490 1.00 0.00 H TER 98665 WAT 2246 ATOM 98665 O WAT 2247 68.791 4.816 132.377 1.00 0.00 O ATOM 98666 H1 WAT 2247 68.460 5.625 132.767 1.00 0.00 H ATOM 98667 H2 WAT 2247 69.235 4.368 133.097 1.00 0.00 H TER 98669 WAT 2247 ATOM 98669 O WAT 2248 122.531 104.488 71.160 1.00 0.00 O ATOM 98670 H1 WAT 2248 122.090 103.973 71.836 1.00 0.00 H ATOM 98671 H2 WAT 2248 123.377 104.055 71.044 1.00 0.00 H TER 98673 WAT 2248 ATOM 98673 O WAT 2249 97.541 37.711 84.065 1.00 0.00 O ATOM 98674 H1 WAT 2249 96.864 37.192 84.500 1.00 0.00 H ATOM 98675 H2 WAT 2249 97.868 37.141 83.368 1.00 0.00 H TER 98677 WAT 2249 ATOM 98677 O WAT 2250 141.674 145.019 94.935 1.00 0.00 O ATOM 98678 H1 WAT 2250 141.952 145.040 95.850 1.00 0.00 H ATOM 98679 H2 WAT 2250 140.863 144.511 94.943 1.00 0.00 H TER 98681 WAT 2250 ATOM 98681 O WAT 2251 112.261 142.494 89.116 1.00 0.00 O ATOM 98682 H1 WAT 2251 112.919 141.819 89.279 1.00 0.00 H ATOM 98683 H2 WAT 2251 111.648 142.088 88.503 1.00 0.00 H TER 98685 WAT 2251 ATOM 98685 O WAT 2252 37.258 58.818 142.451 1.00 0.00 O ATOM 98686 H1 WAT 2252 36.559 59.165 141.897 1.00 0.00 H ATOM 98687 H2 WAT 2252 37.659 59.592 142.846 1.00 0.00 H TER 98689 WAT 2252 ATOM 98689 O WAT 2253 48.169 60.858 137.114 1.00 0.00 O ATOM 98690 H1 WAT 2253 47.411 60.346 136.830 1.00 0.00 H ATOM 98691 H2 WAT 2253 48.846 60.662 136.467 1.00 0.00 H TER 98693 WAT 2253 ATOM 98693 O WAT 2254 13.251 50.152 141.377 1.00 0.00 O ATOM 98694 H1 WAT 2254 12.734 49.425 141.725 1.00 0.00 H ATOM 98695 H2 WAT 2254 12.955 50.245 140.472 1.00 0.00 H TER 98697 WAT 2254 ATOM 98697 O WAT 2255 108.861 130.061 139.535 1.00 0.00 O ATOM 98698 H1 WAT 2255 109.282 129.982 138.679 1.00 0.00 H ATOM 98699 H2 WAT 2255 109.396 129.521 140.116 1.00 0.00 H TER 98701 WAT 2255 ATOM 98701 O WAT 2256 142.572 141.240 156.931 1.00 0.00 O ATOM 98702 H1 WAT 2256 141.867 140.777 156.478 1.00 0.00 H ATOM 98703 H2 WAT 2256 142.214 142.110 157.107 1.00 0.00 H TER 98705 WAT 2256 ATOM 98705 O WAT 2257 82.837 67.652 141.242 1.00 0.00 O ATOM 98706 H1 WAT 2257 83.037 66.923 141.830 1.00 0.00 H ATOM 98707 H2 WAT 2257 83.689 68.040 141.044 1.00 0.00 H TER 98709 WAT 2257 ATOM 98709 O WAT 2258 75.501 113.142 133.605 1.00 0.00 O ATOM 98710 H1 WAT 2258 75.848 114.026 133.484 1.00 0.00 H ATOM 98711 H2 WAT 2258 76.226 112.651 133.991 1.00 0.00 H TER 98713 WAT 2258 ATOM 98713 O WAT 2259 107.757 41.093 82.012 1.00 0.00 O ATOM 98714 H1 WAT 2259 106.869 41.292 82.308 1.00 0.00 H ATOM 98715 H2 WAT 2259 107.841 40.147 82.125 1.00 0.00 H TER 98717 WAT 2259 ATOM 98717 O WAT 2260 140.899 56.714 82.363 1.00 0.00 O ATOM 98718 H1 WAT 2260 140.136 57.152 81.984 1.00 0.00 H ATOM 98719 H2 WAT 2260 140.675 55.783 82.342 1.00 0.00 H TER 98721 WAT 2260 ATOM 98721 O WAT 2261 3.430 122.324 18.306 1.00 0.00 O ATOM 98722 H1 WAT 2261 4.013 121.602 18.540 1.00 0.00 H ATOM 98723 H2 WAT 2261 3.329 122.252 17.357 1.00 0.00 H TER 98725 WAT 2261 ATOM 98725 O WAT 2262 98.494 134.006 66.722 1.00 0.00 O ATOM 98726 H1 WAT 2262 97.842 133.591 66.156 1.00 0.00 H ATOM 98727 H2 WAT 2262 99.029 133.280 67.043 1.00 0.00 H TER 98729 WAT 2262 ATOM 98729 O WAT 2263 137.907 92.877 7.336 1.00 0.00 O ATOM 98730 H1 WAT 2263 138.010 92.275 6.598 1.00 0.00 H ATOM 98731 H2 WAT 2263 137.481 92.354 8.014 1.00 0.00 H TER 98733 WAT 2263 ATOM 98733 O WAT 2264 38.673 94.287 16.604 1.00 0.00 O ATOM 98734 H1 WAT 2264 38.278 93.472 16.914 1.00 0.00 H ATOM 98735 H2 WAT 2264 39.138 94.633 17.366 1.00 0.00 H TER 98737 WAT 2264 ATOM 98737 O WAT 2265 51.330 128.699 148.697 1.00 0.00 O ATOM 98738 H1 WAT 2265 51.841 129.331 148.191 1.00 0.00 H ATOM 98739 H2 WAT 2265 51.975 128.062 149.005 1.00 0.00 H TER 98741 WAT 2265 ATOM 98741 O WAT 2266 9.240 82.493 105.949 1.00 0.00 O ATOM 98742 H1 WAT 2266 9.547 82.350 105.053 1.00 0.00 H ATOM 98743 H2 WAT 2266 8.364 82.107 105.967 1.00 0.00 H TER 98745 WAT 2266 ATOM 98745 O WAT 2267 6.583 18.551 15.737 1.00 0.00 O ATOM 98746 H1 WAT 2267 7.212 19.171 15.367 1.00 0.00 H ATOM 98747 H2 WAT 2267 5.743 19.007 15.693 1.00 0.00 H TER 98749 WAT 2267 ATOM 98749 O WAT 2268 57.549 74.322 103.801 1.00 0.00 O ATOM 98750 H1 WAT 2268 57.645 73.370 103.767 1.00 0.00 H ATOM 98751 H2 WAT 2268 57.808 74.621 102.930 1.00 0.00 H TER 98753 WAT 2268 ATOM 98753 O WAT 2269 34.978 11.969 121.909 1.00 0.00 O ATOM 98754 H1 WAT 2269 34.118 12.049 121.497 1.00 0.00 H ATOM 98755 H2 WAT 2269 35.482 11.422 121.307 1.00 0.00 H TER 98757 WAT 2269 ATOM 98757 O WAT 2270 96.450 85.439 7.660 1.00 0.00 O ATOM 98758 H1 WAT 2270 96.100 86.323 7.552 1.00 0.00 H ATOM 98759 H2 WAT 2270 97.029 85.317 6.907 1.00 0.00 H TER 98761 WAT 2270 ATOM 98761 O WAT 2271 129.224 138.711 59.052 1.00 0.00 O ATOM 98762 H1 WAT 2271 129.824 139.408 59.316 1.00 0.00 H ATOM 98763 H2 WAT 2271 129.240 138.092 59.782 1.00 0.00 H TER 98765 WAT 2271 ATOM 98765 O WAT 2272 47.958 0.116 89.686 1.00 0.00 O ATOM 98766 H1 WAT 2272 48.588 0.543 90.267 1.00 0.00 H ATOM 98767 H2 WAT 2272 47.551 -0.559 90.229 1.00 0.00 H TER 98769 WAT 2272 ATOM 98769 O WAT 2273 23.821 98.307 139.712 1.00 0.00 O ATOM 98770 H1 WAT 2273 24.486 98.592 139.085 1.00 0.00 H ATOM 98771 H2 WAT 2273 23.828 97.352 139.650 1.00 0.00 H TER 98773 WAT 2273 ATOM 98773 O WAT 2274 25.517 8.087 145.447 1.00 0.00 O ATOM 98774 H1 WAT 2274 25.735 7.159 145.360 1.00 0.00 H ATOM 98775 H2 WAT 2274 24.716 8.194 144.935 1.00 0.00 H TER 98777 WAT 2274 ATOM 98777 O WAT 2275 51.205 61.692 88.961 1.00 0.00 O ATOM 98778 H1 WAT 2275 50.379 61.221 88.846 1.00 0.00 H ATOM 98779 H2 WAT 2275 51.786 61.058 89.380 1.00 0.00 H TER 98781 WAT 2275 ATOM 98781 O WAT 2276 78.787 67.949 156.694 1.00 0.00 O ATOM 98782 H1 WAT 2276 79.456 67.267 156.749 1.00 0.00 H ATOM 98783 H2 WAT 2276 79.058 68.603 157.339 1.00 0.00 H TER 98785 WAT 2276 ATOM 98785 O WAT 2277 34.675 15.609 133.251 1.00 0.00 O ATOM 98786 H1 WAT 2277 33.917 16.186 133.160 1.00 0.00 H ATOM 98787 H2 WAT 2277 34.443 14.827 132.750 1.00 0.00 H TER 98789 WAT 2277 ATOM 98789 O WAT 2278 42.978 102.983 19.937 1.00 0.00 O ATOM 98790 H1 WAT 2278 42.805 102.393 20.671 1.00 0.00 H ATOM 98791 H2 WAT 2278 43.508 103.685 20.314 1.00 0.00 H TER 98793 WAT 2278 ATOM 98793 O WAT 2279 107.670 94.865 56.220 1.00 0.00 O ATOM 98794 H1 WAT 2279 107.415 94.582 55.341 1.00 0.00 H ATOM 98795 H2 WAT 2279 108.543 95.239 56.106 1.00 0.00 H TER 98797 WAT 2279 ATOM 98797 O WAT 2280 107.419 17.871 101.448 1.00 0.00 O ATOM 98798 H1 WAT 2280 106.775 18.565 101.590 1.00 0.00 H ATOM 98799 H2 WAT 2280 107.792 18.063 100.587 1.00 0.00 H TER 98801 WAT 2280 ATOM 98801 O WAT 2281 56.649 100.049 86.292 1.00 0.00 O ATOM 98802 H1 WAT 2281 56.102 100.588 85.721 1.00 0.00 H ATOM 98803 H2 WAT 2281 56.028 99.500 86.770 1.00 0.00 H TER 98805 WAT 2281 ATOM 98805 O WAT 2282 111.616 109.115 81.310 1.00 0.00 O ATOM 98806 H1 WAT 2282 111.004 108.870 80.616 1.00 0.00 H ATOM 98807 H2 WAT 2282 111.774 110.049 81.171 1.00 0.00 H TER 98809 WAT 2282 ATOM 98809 O WAT 2283 30.784 95.119 65.718 1.00 0.00 O ATOM 98810 H1 WAT 2283 31.414 94.837 65.055 1.00 0.00 H ATOM 98811 H2 WAT 2283 31.322 95.493 66.416 1.00 0.00 H TER 98813 WAT 2283 ATOM 98813 O WAT 2284 66.890 126.116 90.948 1.00 0.00 O ATOM 98814 H1 WAT 2284 67.311 125.512 90.336 1.00 0.00 H ATOM 98815 H2 WAT 2284 66.314 125.561 91.474 1.00 0.00 H TER 98817 WAT 2284 ATOM 98817 O WAT 2285 117.899 64.229 148.739 1.00 0.00 O ATOM 98818 H1 WAT 2285 117.272 63.878 148.106 1.00 0.00 H ATOM 98819 H2 WAT 2285 117.647 65.147 148.841 1.00 0.00 H TER 98821 WAT 2285 ATOM 98821 O WAT 2286 145.939 45.046 154.235 1.00 0.00 O ATOM 98822 H1 WAT 2286 145.682 45.955 154.082 1.00 0.00 H ATOM 98823 H2 WAT 2286 145.124 44.603 154.470 1.00 0.00 H TER 98825 WAT 2286 ATOM 98825 O WAT 2287 86.157 4.349 129.653 1.00 0.00 O ATOM 98826 H1 WAT 2287 86.619 3.551 129.907 1.00 0.00 H ATOM 98827 H2 WAT 2287 85.920 4.207 128.736 1.00 0.00 H TER 98829 WAT 2287 ATOM 98829 O WAT 2288 76.765 37.369 79.918 1.00 0.00 O ATOM 98830 H1 WAT 2288 75.851 37.422 80.198 1.00 0.00 H ATOM 98831 H2 WAT 2288 77.102 38.257 80.029 1.00 0.00 H TER 98833 WAT 2288 ATOM 98833 O WAT 2289 104.220 74.863 96.355 1.00 0.00 O ATOM 98834 H1 WAT 2289 103.504 75.437 96.084 1.00 0.00 H ATOM 98835 H2 WAT 2289 103.841 74.316 97.043 1.00 0.00 H TER 98837 WAT 2289 ATOM 98837 O WAT 2290 83.420 7.549 131.856 1.00 0.00 O ATOM 98838 H1 WAT 2290 84.258 7.485 131.399 1.00 0.00 H ATOM 98839 H2 WAT 2290 83.654 7.795 132.751 1.00 0.00 H TER 98841 WAT 2290 ATOM 98841 O WAT 2291 125.051 64.717 77.175 1.00 0.00 O ATOM 98842 H1 WAT 2291 125.085 65.364 76.470 1.00 0.00 H ATOM 98843 H2 WAT 2291 124.957 63.878 76.724 1.00 0.00 H TER 98845 WAT 2291 ATOM 98845 O WAT 2292 34.926 39.401 22.919 1.00 0.00 O ATOM 98846 H1 WAT 2292 34.414 38.718 22.486 1.00 0.00 H ATOM 98847 H2 WAT 2292 35.764 39.402 22.457 1.00 0.00 H TER 98849 WAT 2292 ATOM 98849 O WAT 2293 94.128 96.345 154.918 1.00 0.00 O ATOM 98850 H1 WAT 2293 94.243 97.051 155.553 1.00 0.00 H ATOM 98851 H2 WAT 2293 93.669 95.659 155.402 1.00 0.00 H TER 98853 WAT 2293 ATOM 98853 O WAT 2294 137.777 52.033 140.289 1.00 0.00 O ATOM 98854 H1 WAT 2294 138.024 51.725 139.417 1.00 0.00 H ATOM 98855 H2 WAT 2294 136.888 52.370 140.182 1.00 0.00 H TER 98857 WAT 2294 ATOM 98857 O WAT 2295 81.925 8.626 75.038 1.00 0.00 O ATOM 98858 H1 WAT 2295 82.087 8.765 74.105 1.00 0.00 H ATOM 98859 H2 WAT 2295 82.529 9.223 75.478 1.00 0.00 H TER 98861 WAT 2295 ATOM 98861 O WAT 2296 41.289 49.478 22.532 1.00 0.00 O ATOM 98862 H1 WAT 2296 42.072 49.995 22.344 1.00 0.00 H ATOM 98863 H2 WAT 2296 41.044 49.729 23.423 1.00 0.00 H TER 98865 WAT 2296 ATOM 98865 O WAT 2297 88.026 29.785 65.397 1.00 0.00 O ATOM 98866 H1 WAT 2297 87.992 29.277 64.586 1.00 0.00 H ATOM 98867 H2 WAT 2297 88.959 29.948 65.539 1.00 0.00 H TER 98869 WAT 2297 ATOM 98869 O WAT 2298 36.238 18.765 103.585 1.00 0.00 O ATOM 98870 H1 WAT 2298 35.957 18.677 102.674 1.00 0.00 H ATOM 98871 H2 WAT 2298 36.062 19.681 103.802 1.00 0.00 H TER 98873 WAT 2298 ATOM 98873 O WAT 2299 104.289 78.265 5.315 1.00 0.00 O ATOM 98874 H1 WAT 2299 103.913 77.760 4.595 1.00 0.00 H ATOM 98875 H2 WAT 2299 104.330 79.162 4.983 1.00 0.00 H TER 98877 WAT 2299 ATOM 98877 O WAT 2300 134.591 120.707 111.668 1.00 0.00 O ATOM 98878 H1 WAT 2300 134.718 119.897 112.162 1.00 0.00 H ATOM 98879 H2 WAT 2300 134.553 120.427 110.754 1.00 0.00 H TER 98881 WAT 2300 ATOM 98881 O WAT 2301 68.999 41.372 69.373 1.00 0.00 O ATOM 98882 H1 WAT 2301 69.494 40.718 68.879 1.00 0.00 H ATOM 98883 H2 WAT 2301 68.943 41.011 70.258 1.00 0.00 H TER 98885 WAT 2301 ATOM 98885 O WAT 2302 72.217 93.604 99.672 1.00 0.00 O ATOM 98886 H1 WAT 2302 73.020 93.985 100.026 1.00 0.00 H ATOM 98887 H2 WAT 2302 72.077 92.814 100.195 1.00 0.00 H TER 98889 WAT 2302 ATOM 98889 O WAT 2303 140.367 41.422 138.720 1.00 0.00 O ATOM 98890 H1 WAT 2303 141.134 41.989 138.799 1.00 0.00 H ATOM 98891 H2 WAT 2303 139.622 42.004 138.868 1.00 0.00 H TER 98893 WAT 2303 ATOM 98893 O WAT 2304 18.839 82.496 118.383 1.00 0.00 O ATOM 98894 H1 WAT 2304 18.003 82.943 118.516 1.00 0.00 H ATOM 98895 H2 WAT 2304 19.486 83.074 118.788 1.00 0.00 H TER 98897 WAT 2304 ATOM 98897 O WAT 2305 5.615 72.242 56.360 1.00 0.00 O ATOM 98898 H1 WAT 2305 6.275 72.931 56.284 1.00 0.00 H ATOM 98899 H2 WAT 2305 4.952 72.609 56.944 1.00 0.00 H TER 98901 WAT 2305 ATOM 98901 O WAT 2306 40.853 1.893 153.544 1.00 0.00 O ATOM 98902 H1 WAT 2306 41.787 1.741 153.404 1.00 0.00 H ATOM 98903 H2 WAT 2306 40.772 2.844 153.611 1.00 0.00 H TER 98905 WAT 2306 ATOM 98905 O WAT 2307 67.265 65.138 11.600 1.00 0.00 O ATOM 98906 H1 WAT 2307 67.140 64.190 11.552 1.00 0.00 H ATOM 98907 H2 WAT 2307 67.216 65.339 12.534 1.00 0.00 H TER 98909 WAT 2307 ATOM 98909 O WAT 2308 122.289 82.099 72.421 1.00 0.00 O ATOM 98910 H1 WAT 2308 122.297 82.806 73.067 1.00 0.00 H ATOM 98911 H2 WAT 2308 123.175 81.738 72.450 1.00 0.00 H TER 98913 WAT 2308 ATOM 98913 O WAT 2309 128.933 124.080 14.346 1.00 0.00 O ATOM 98914 H1 WAT 2309 129.586 124.735 14.594 1.00 0.00 H ATOM 98915 H2 WAT 2309 129.055 123.370 14.976 1.00 0.00 H TER 98917 WAT 2309 ATOM 98917 O WAT 2310 34.872 136.272 80.699 1.00 0.00 O ATOM 98918 H1 WAT 2310 34.726 136.369 81.639 1.00 0.00 H ATOM 98919 H2 WAT 2310 35.476 135.532 80.625 1.00 0.00 H TER 98921 WAT 2310 ATOM 98921 O WAT 2311 96.586 109.424 120.846 1.00 0.00 O ATOM 98922 H1 WAT 2311 95.675 109.710 120.781 1.00 0.00 H ATOM 98923 H2 WAT 2311 96.534 108.546 121.225 1.00 0.00 H TER 98925 WAT 2311 ATOM 98925 O WAT 2312 96.826 48.877 86.419 1.00 0.00 O ATOM 98926 H1 WAT 2312 97.533 48.885 85.775 1.00 0.00 H ATOM 98927 H2 WAT 2312 97.239 49.169 87.232 1.00 0.00 H TER 98929 WAT 2312 ATOM 98929 O WAT 2313 128.202 124.382 151.793 1.00 0.00 O ATOM 98930 H1 WAT 2313 127.827 123.532 152.021 1.00 0.00 H ATOM 98931 H2 WAT 2313 127.471 124.995 151.867 1.00 0.00 H TER 98933 WAT 2313 ATOM 98933 O WAT 2314 107.947 21.815 112.139 1.00 0.00 O ATOM 98934 H1 WAT 2314 107.443 21.916 112.947 1.00 0.00 H ATOM 98935 H2 WAT 2314 108.842 22.051 112.384 1.00 0.00 H TER 98937 WAT 2314 ATOM 98937 O WAT 2315 60.060 113.515 128.718 1.00 0.00 O ATOM 98938 H1 WAT 2315 59.296 113.607 128.148 1.00 0.00 H ATOM 98939 H2 WAT 2315 60.798 113.420 128.116 1.00 0.00 H TER 98941 WAT 2315 ATOM 98941 O WAT 2316 86.519 1.170 69.423 1.00 0.00 O ATOM 98942 H1 WAT 2316 86.129 1.999 69.145 1.00 0.00 H ATOM 98943 H2 WAT 2316 87.067 1.403 70.172 1.00 0.00 H TER 98945 WAT 2316 ATOM 98945 O WAT 2317 46.601 4.255 147.327 1.00 0.00 O ATOM 98946 H1 WAT 2317 47.517 4.498 147.188 1.00 0.00 H ATOM 98947 H2 WAT 2317 46.102 5.003 146.998 1.00 0.00 H TER 98949 WAT 2317 ATOM 98949 O WAT 2318 86.345 132.062 137.908 1.00 0.00 O ATOM 98950 H1 WAT 2318 86.287 131.248 138.407 1.00 0.00 H ATOM 98951 H2 WAT 2318 86.237 131.792 136.996 1.00 0.00 H TER 98953 WAT 2318 ATOM 98953 O WAT 2319 51.617 63.795 18.752 1.00 0.00 O ATOM 98954 H1 WAT 2319 51.890 63.068 19.312 1.00 0.00 H ATOM 98955 H2 WAT 2319 51.816 63.500 17.863 1.00 0.00 H TER 98957 WAT 2319 ATOM 98957 O WAT 2320 12.755 12.987 148.062 1.00 0.00 O ATOM 98958 H1 WAT 2320 12.019 12.545 147.639 1.00 0.00 H ATOM 98959 H2 WAT 2320 12.368 13.418 148.825 1.00 0.00 H TER 98961 WAT 2320 ATOM 98961 O WAT 2321 130.489 1.328 103.801 1.00 0.00 O ATOM 98962 H1 WAT 2321 131.041 0.643 104.178 1.00 0.00 H ATOM 98963 H2 WAT 2321 130.657 1.279 102.860 1.00 0.00 H TER 98965 WAT 2321 ATOM 98965 O WAT 2322 17.917 120.575 78.222 1.00 0.00 O ATOM 98966 H1 WAT 2322 18.454 121.197 78.714 1.00 0.00 H ATOM 98967 H2 WAT 2322 17.424 120.102 78.891 1.00 0.00 H TER 98969 WAT 2322 ATOM 98969 O WAT 2323 34.719 84.207 11.472 1.00 0.00 O ATOM 98970 H1 WAT 2323 34.649 84.074 10.527 1.00 0.00 H ATOM 98971 H2 WAT 2323 34.226 83.480 11.853 1.00 0.00 H TER 98973 WAT 2323 ATOM 98973 O WAT 2324 43.168 79.854 7.476 1.00 0.00 O ATOM 98974 H1 WAT 2324 42.677 79.044 7.614 1.00 0.00 H ATOM 98975 H2 WAT 2324 44.044 79.662 7.809 1.00 0.00 H TER 98977 WAT 2324 ATOM 98977 O WAT 2325 45.904 63.753 16.759 1.00 0.00 O ATOM 98978 H1 WAT 2325 45.266 64.404 16.464 1.00 0.00 H ATOM 98979 H2 WAT 2325 45.505 63.362 17.536 1.00 0.00 H TER 98981 WAT 2325 ATOM 98981 O WAT 2326 55.580 90.690 13.286 1.00 0.00 O ATOM 98982 H1 WAT 2326 55.258 90.490 12.407 1.00 0.00 H ATOM 98983 H2 WAT 2326 56.288 91.319 13.145 1.00 0.00 H TER 98985 WAT 2326 ATOM 98985 O WAT 2327 96.817 40.374 143.297 1.00 0.00 O ATOM 98986 H1 WAT 2327 96.079 40.356 143.907 1.00 0.00 H ATOM 98987 H2 WAT 2327 97.387 39.664 143.590 1.00 0.00 H TER 98989 WAT 2327 ATOM 98989 O WAT 2328 14.848 138.717 61.399 1.00 0.00 O ATOM 98990 H1 WAT 2328 15.059 137.934 61.906 1.00 0.00 H ATOM 98991 H2 WAT 2328 14.301 138.398 60.681 1.00 0.00 H TER 98993 WAT 2328 ATOM 98993 O WAT 2329 113.228 91.793 65.702 1.00 0.00 O ATOM 98994 H1 WAT 2329 113.216 90.935 66.126 1.00 0.00 H ATOM 98995 H2 WAT 2329 114.054 92.187 65.982 1.00 0.00 H TER 98997 WAT 2329 ATOM 98997 O WAT 2330 51.855 50.582 109.763 1.00 0.00 O ATOM 98998 H1 WAT 2330 52.434 50.169 109.122 1.00 0.00 H ATOM 98999 H2 WAT 2330 52.075 51.512 109.721 1.00 0.00 H TER 99001 WAT 2330 ATOM 99001 O WAT 2331 82.452 45.989 74.659 1.00 0.00 O ATOM 99002 H1 WAT 2331 82.738 45.719 73.786 1.00 0.00 H ATOM 99003 H2 WAT 2331 81.503 46.081 74.582 1.00 0.00 H TER 99005 WAT 2331 ATOM 99005 O WAT 2332 57.444 92.507 13.051 1.00 0.00 O ATOM 99006 H1 WAT 2332 57.600 92.760 13.961 1.00 0.00 H ATOM 99007 H2 WAT 2332 58.286 92.164 12.750 1.00 0.00 H TER 99009 WAT 2332 ATOM 99009 O WAT 2333 110.283 140.750 21.103 1.00 0.00 O ATOM 99010 H1 WAT 2333 110.305 140.273 21.933 1.00 0.00 H ATOM 99011 H2 WAT 2333 111.203 140.845 20.857 1.00 0.00 H TER 99013 WAT 2333 ATOM 99013 O WAT 2334 139.399 144.611 4.357 1.00 0.00 O ATOM 99014 H1 WAT 2334 139.426 143.665 4.505 1.00 0.00 H ATOM 99015 H2 WAT 2334 140.016 144.759 3.641 1.00 0.00 H TER 99017 WAT 2334 ATOM 99017 O WAT 2335 46.001 40.490 148.693 1.00 0.00 O ATOM 99018 H1 WAT 2335 46.715 40.249 148.103 1.00 0.00 H ATOM 99019 H2 WAT 2335 46.264 41.338 149.052 1.00 0.00 H TER 99021 WAT 2335 ATOM 99021 O WAT 2336 44.252 68.230 59.255 1.00 0.00 O ATOM 99022 H1 WAT 2336 44.337 67.300 59.462 1.00 0.00 H ATOM 99023 H2 WAT 2336 44.710 68.332 58.421 1.00 0.00 H TER 99025 WAT 2336 ATOM 99025 O WAT 2337 126.062 31.253 52.911 1.00 0.00 O ATOM 99026 H1 WAT 2337 126.896 31.327 53.373 1.00 0.00 H ATOM 99027 H2 WAT 2337 125.416 31.107 53.603 1.00 0.00 H TER 99029 WAT 2337 ATOM 99029 O WAT 2338 55.439 56.413 107.691 1.00 0.00 O ATOM 99030 H1 WAT 2338 54.958 57.149 107.312 1.00 0.00 H ATOM 99031 H2 WAT 2338 56.349 56.708 107.716 1.00 0.00 H TER 99033 WAT 2338 ATOM 99033 O WAT 2339 144.041 104.813 99.267 1.00 0.00 O ATOM 99034 H1 WAT 2339 144.052 104.470 98.374 1.00 0.00 H ATOM 99035 H2 WAT 2339 144.180 105.754 99.165 1.00 0.00 H TER 99037 WAT 2339 ATOM 99037 O WAT 2340 132.641 118.342 153.447 1.00 0.00 O ATOM 99038 H1 WAT 2340 132.216 118.392 154.303 1.00 0.00 H ATOM 99039 H2 WAT 2340 133.571 118.236 153.648 1.00 0.00 H TER 99041 WAT 2340 ATOM 99041 O WAT 2341 21.386 142.173 19.303 1.00 0.00 O ATOM 99042 H1 WAT 2341 21.942 142.938 19.446 1.00 0.00 H ATOM 99043 H2 WAT 2341 21.014 141.982 20.164 1.00 0.00 H TER 99045 WAT 2341 ATOM 99045 O WAT 2342 130.087 81.109 142.531 1.00 0.00 O ATOM 99046 H1 WAT 2342 129.535 81.607 143.134 1.00 0.00 H ATOM 99047 H2 WAT 2342 129.611 81.126 141.701 1.00 0.00 H TER 99049 WAT 2342 ATOM 99049 O WAT 2343 112.997 145.545 128.920 1.00 0.00 O ATOM 99050 H1 WAT 2343 112.153 145.986 128.823 1.00 0.00 H ATOM 99051 H2 WAT 2343 113.019 144.910 128.205 1.00 0.00 H TER 99053 WAT 2343 ATOM 99053 O WAT 2344 86.003 0.354 130.867 1.00 0.00 O ATOM 99054 H1 WAT 2344 85.698 0.350 129.960 1.00 0.00 H ATOM 99055 H2 WAT 2344 85.413 0.959 131.316 1.00 0.00 H TER 99057 WAT 2344 ATOM 99057 O WAT 2345 123.787 51.290 6.711 1.00 0.00 O ATOM 99058 H1 WAT 2345 124.485 51.578 6.123 1.00 0.00 H ATOM 99059 H2 WAT 2345 122.993 51.329 6.178 1.00 0.00 H TER 99061 WAT 2345 ATOM 99061 O WAT 2346 132.365 77.678 12.779 1.00 0.00 O ATOM 99062 H1 WAT 2346 132.123 76.957 12.197 1.00 0.00 H ATOM 99063 H2 WAT 2346 131.531 78.085 13.015 1.00 0.00 H TER 99065 WAT 2346 ATOM 99065 O WAT 2347 104.028 119.729 147.131 1.00 0.00 O ATOM 99066 H1 WAT 2347 104.190 118.896 147.575 1.00 0.00 H ATOM 99067 H2 WAT 2347 104.778 119.838 146.547 1.00 0.00 H TER 99069 WAT 2347 ATOM 99069 O WAT 2348 101.008 100.387 15.966 1.00 0.00 O ATOM 99070 H1 WAT 2348 100.923 101.324 16.143 1.00 0.00 H ATOM 99071 H2 WAT 2348 100.351 99.977 16.529 1.00 0.00 H TER 99073 WAT 2348 ATOM 99073 O WAT 2349 3.954 126.428 9.421 1.00 0.00 O ATOM 99074 H1 WAT 2349 3.828 127.078 8.729 1.00 0.00 H ATOM 99075 H2 WAT 2349 4.483 125.744 9.012 1.00 0.00 H TER 99077 WAT 2349 ATOM 99077 O WAT 2350 31.052 97.167 111.557 1.00 0.00 O ATOM 99078 H1 WAT 2350 31.621 97.160 110.787 1.00 0.00 H ATOM 99079 H2 WAT 2350 30.883 96.242 111.738 1.00 0.00 H TER 99081 WAT 2350 ATOM 99081 O WAT 2351 90.013 131.247 2.537 1.00 0.00 O ATOM 99082 H1 WAT 2351 90.198 130.353 2.250 1.00 0.00 H ATOM 99083 H2 WAT 2351 89.442 131.603 1.856 1.00 0.00 H TER 99085 WAT 2351 ATOM 99085 O WAT 2352 65.798 49.474 145.918 1.00 0.00 O ATOM 99086 H1 WAT 2352 64.955 49.024 145.856 1.00 0.00 H ATOM 99087 H2 WAT 2352 65.984 49.758 145.023 1.00 0.00 H TER 99089 WAT 2352 ATOM 99089 O WAT 2353 81.330 43.166 139.781 1.00 0.00 O ATOM 99090 H1 WAT 2353 81.204 43.878 140.409 1.00 0.00 H ATOM 99091 H2 WAT 2353 80.443 42.897 139.543 1.00 0.00 H TER 99093 WAT 2353 ATOM 99093 O WAT 2354 94.784 99.038 83.981 1.00 0.00 O ATOM 99094 H1 WAT 2354 95.662 99.131 83.610 1.00 0.00 H ATOM 99095 H2 WAT 2354 94.703 98.103 84.170 1.00 0.00 H TER 99097 WAT 2354 ATOM 99097 O WAT 2355 15.535 75.472 152.034 1.00 0.00 O ATOM 99098 H1 WAT 2355 16.398 75.095 152.207 1.00 0.00 H ATOM 99099 H2 WAT 2355 15.342 75.223 151.130 1.00 0.00 H TER 99101 WAT 2355 ATOM 99101 O WAT 2356 145.668 12.107 59.077 1.00 0.00 O ATOM 99102 H1 WAT 2356 145.769 12.121 60.029 1.00 0.00 H ATOM 99103 H2 WAT 2356 144.724 12.171 58.936 1.00 0.00 H TER 99105 WAT 2356 ATOM 99105 O WAT 2357 80.816 86.385 126.598 1.00 0.00 O ATOM 99106 H1 WAT 2357 81.057 87.105 127.180 1.00 0.00 H ATOM 99107 H2 WAT 2357 79.858 86.380 126.608 1.00 0.00 H TER 99109 WAT 2357 ATOM 99109 O WAT 2358 49.161 108.442 8.292 1.00 0.00 O ATOM 99110 H1 WAT 2358 49.242 108.694 9.212 1.00 0.00 H ATOM 99111 H2 WAT 2358 48.250 108.162 8.200 1.00 0.00 H TER 99113 WAT 2358 ATOM 99113 O WAT 2359 84.715 1.664 113.578 1.00 0.00 O ATOM 99114 H1 WAT 2359 85.166 0.831 113.437 1.00 0.00 H ATOM 99115 H2 WAT 2359 85.147 2.274 112.979 1.00 0.00 H TER 99117 WAT 2359 ATOM 99117 O WAT 2360 81.393 102.339 75.072 1.00 0.00 O ATOM 99118 H1 WAT 2360 82.303 102.543 74.854 1.00 0.00 H ATOM 99119 H2 WAT 2360 81.325 102.522 76.010 1.00 0.00 H TER 99121 WAT 2360 ATOM 99121 O WAT 2361 52.135 71.893 114.188 1.00 0.00 O ATOM 99122 H1 WAT 2361 51.471 72.524 113.912 1.00 0.00 H ATOM 99123 H2 WAT 2361 51.675 71.310 114.792 1.00 0.00 H TER 99125 WAT 2361 ATOM 99125 O WAT 2362 109.528 132.099 14.517 1.00 0.00 O ATOM 99126 H1 WAT 2362 108.847 132.738 14.725 1.00 0.00 H ATOM 99127 H2 WAT 2362 109.364 131.369 15.114 1.00 0.00 H TER 99129 WAT 2362 ATOM 99129 O WAT 2363 10.346 66.583 118.110 1.00 0.00 O ATOM 99130 H1 WAT 2363 9.762 66.779 117.378 1.00 0.00 H ATOM 99131 H2 WAT 2363 11.049 66.061 117.723 1.00 0.00 H TER 99133 WAT 2363 ATOM 99133 O WAT 2364 37.002 142.398 147.982 1.00 0.00 O ATOM 99134 H1 WAT 2364 36.262 141.853 147.714 1.00 0.00 H ATOM 99135 H2 WAT 2364 37.720 142.123 147.413 1.00 0.00 H TER 99137 WAT 2364 ATOM 99137 O WAT 2365 -0.023 38.645 68.418 1.00 0.00 O ATOM 99138 H1 WAT 2365 0.008 39.573 68.183 1.00 0.00 H ATOM 99139 H2 WAT 2365 0.892 38.406 68.567 1.00 0.00 H TER 99141 WAT 2365 ATOM 99141 O WAT 2366 55.946 110.001 96.237 1.00 0.00 O ATOM 99142 H1 WAT 2366 55.567 109.405 95.590 1.00 0.00 H ATOM 99143 H2 WAT 2366 55.249 110.631 96.419 1.00 0.00 H TER 99145 WAT 2366 ATOM 99145 O WAT 2367 135.424 84.394 145.894 1.00 0.00 O ATOM 99146 H1 WAT 2367 135.105 85.188 145.465 1.00 0.00 H ATOM 99147 H2 WAT 2367 135.815 83.880 145.186 1.00 0.00 H TER 99149 WAT 2367 ATOM 99149 O WAT 2368 130.311 101.537 28.162 1.00 0.00 O ATOM 99150 H1 WAT 2368 129.461 101.955 28.023 1.00 0.00 H ATOM 99151 H2 WAT 2368 130.329 101.336 29.097 1.00 0.00 H TER 99153 WAT 2368 ATOM 99153 O WAT 2369 53.783 79.348 83.873 1.00 0.00 O ATOM 99154 H1 WAT 2369 52.970 79.354 84.378 1.00 0.00 H ATOM 99155 H2 WAT 2369 54.417 78.914 84.444 1.00 0.00 H TER 99157 WAT 2369 ATOM 99157 O WAT 2370 98.586 127.394 98.380 1.00 0.00 O ATOM 99158 H1 WAT 2370 98.685 127.737 99.269 1.00 0.00 H ATOM 99159 H2 WAT 2370 99.249 126.707 98.314 1.00 0.00 H TER 99161 WAT 2370 ATOM 99161 O WAT 2371 15.892 118.589 86.069 1.00 0.00 O ATOM 99162 H1 WAT 2371 16.702 118.901 85.664 1.00 0.00 H ATOM 99163 H2 WAT 2371 16.184 118.006 86.769 1.00 0.00 H TER 99165 WAT 2371 ATOM 99165 O WAT 2372 79.464 18.111 70.314 1.00 0.00 O ATOM 99166 H1 WAT 2372 79.653 18.522 69.471 1.00 0.00 H ATOM 99167 H2 WAT 2372 79.817 17.225 70.233 1.00 0.00 H TER 99169 WAT 2372 ATOM 99169 O WAT 2373 55.189 83.711 94.075 1.00 0.00 O ATOM 99170 H1 WAT 2373 55.180 84.433 93.447 1.00 0.00 H ATOM 99171 H2 WAT 2373 54.270 83.588 94.312 1.00 0.00 H TER 99173 WAT 2373 ATOM 99173 O WAT 2374 75.972 64.729 107.919 1.00 0.00 O ATOM 99174 H1 WAT 2374 76.613 64.606 107.218 1.00 0.00 H ATOM 99175 H2 WAT 2374 76.491 64.714 108.723 1.00 0.00 H TER 99177 WAT 2374 ATOM 99177 O WAT 2375 57.360 42.289 3.378 1.00 0.00 O ATOM 99178 H1 WAT 2375 57.400 42.452 4.321 1.00 0.00 H ATOM 99179 H2 WAT 2375 58.220 42.555 3.052 1.00 0.00 H TER 99181 WAT 2375 ATOM 99181 O WAT 2376 14.649 58.013 66.753 1.00 0.00 O ATOM 99182 H1 WAT 2376 14.236 57.150 66.727 1.00 0.00 H ATOM 99183 H2 WAT 2376 14.895 58.132 67.670 1.00 0.00 H TER 99185 WAT 2376 ATOM 99185 O WAT 2377 27.752 22.867 25.406 1.00 0.00 O ATOM 99186 H1 WAT 2377 27.738 22.406 26.244 1.00 0.00 H ATOM 99187 H2 WAT 2377 27.821 22.172 24.751 1.00 0.00 H TER 99189 WAT 2377 ATOM 99189 O WAT 2378 117.538 16.598 137.777 1.00 0.00 O ATOM 99190 H1 WAT 2378 117.482 17.456 138.199 1.00 0.00 H ATOM 99191 H2 WAT 2378 117.613 16.795 136.843 1.00 0.00 H TER 99193 WAT 2378 ATOM 99193 O WAT 2379 96.415 37.652 19.656 1.00 0.00 O ATOM 99194 H1 WAT 2379 96.716 38.560 19.613 1.00 0.00 H ATOM 99195 H2 WAT 2379 96.603 37.380 20.555 1.00 0.00 H TER 99197 WAT 2379 ATOM 99197 O WAT 2380 96.484 106.788 91.324 1.00 0.00 O ATOM 99198 H1 WAT 2380 96.738 107.257 90.529 1.00 0.00 H ATOM 99199 H2 WAT 2380 96.989 105.975 91.294 1.00 0.00 H TER 99201 WAT 2380 ATOM 99201 O WAT 2381 20.953 82.132 124.848 1.00 0.00 O ATOM 99202 H1 WAT 2381 20.926 82.737 125.589 1.00 0.00 H ATOM 99203 H2 WAT 2381 21.857 81.816 124.830 1.00 0.00 H TER 99205 WAT 2381 ATOM 99205 O WAT 2382 44.437 95.191 84.682 1.00 0.00 O ATOM 99206 H1 WAT 2382 45.269 95.230 85.154 1.00 0.00 H ATOM 99207 H2 WAT 2382 44.578 94.534 84.001 1.00 0.00 H TER 99209 WAT 2382 ATOM 99209 O WAT 2383 62.120 124.445 150.080 1.00 0.00 O ATOM 99210 H1 WAT 2383 62.529 124.546 150.939 1.00 0.00 H ATOM 99211 H2 WAT 2383 62.772 123.977 149.558 1.00 0.00 H TER 99213 WAT 2383 ATOM 99213 O WAT 2384 122.220 75.579 137.631 1.00 0.00 O ATOM 99214 H1 WAT 2384 122.260 76.197 136.901 1.00 0.00 H ATOM 99215 H2 WAT 2384 121.284 75.435 137.771 1.00 0.00 H TER 99217 WAT 2384 ATOM 99217 O WAT 2385 135.257 64.589 118.208 1.00 0.00 O ATOM 99218 H1 WAT 2385 134.640 63.941 118.548 1.00 0.00 H ATOM 99219 H2 WAT 2385 135.024 64.680 117.284 1.00 0.00 H TER 99221 WAT 2385 ATOM 99221 O WAT 2386 144.368 129.726 9.639 1.00 0.00 O ATOM 99222 H1 WAT 2386 144.769 129.305 10.399 1.00 0.00 H ATOM 99223 H2 WAT 2386 143.911 130.486 9.999 1.00 0.00 H TER 99225 WAT 2386 ATOM 99225 O WAT 2387 122.241 129.902 153.989 1.00 0.00 O ATOM 99226 H1 WAT 2387 123.139 130.226 154.063 1.00 0.00 H ATOM 99227 H2 WAT 2387 122.243 129.372 153.192 1.00 0.00 H TER 99229 WAT 2387 ATOM 99229 O WAT 2388 55.745 36.999 69.322 1.00 0.00 O ATOM 99230 H1 WAT 2388 56.077 37.876 69.513 1.00 0.00 H ATOM 99231 H2 WAT 2388 56.209 36.735 68.527 1.00 0.00 H TER 99233 WAT 2388 ATOM 99233 O WAT 2389 25.737 45.301 23.078 1.00 0.00 O ATOM 99234 H1 WAT 2389 26.549 45.339 22.573 1.00 0.00 H ATOM 99235 H2 WAT 2389 25.398 46.196 23.055 1.00 0.00 H TER 99237 WAT 2389 ATOM 99237 O WAT 2390 48.174 55.332 107.074 1.00 0.00 O ATOM 99238 H1 WAT 2390 48.808 54.651 107.297 1.00 0.00 H ATOM 99239 H2 WAT 2390 47.472 54.865 106.620 1.00 0.00 H TER 99241 WAT 2390 ATOM 99241 O WAT 2391 143.206 12.208 69.111 1.00 0.00 O ATOM 99242 H1 WAT 2391 142.628 11.736 69.710 1.00 0.00 H ATOM 99243 H2 WAT 2391 143.846 12.633 69.681 1.00 0.00 H TER 99245 WAT 2391 ATOM 99245 O WAT 2392 98.961 62.428 139.513 1.00 0.00 O ATOM 99246 H1 WAT 2392 98.792 63.093 140.180 1.00 0.00 H ATOM 99247 H2 WAT 2392 98.093 62.188 139.189 1.00 0.00 H TER 99249 WAT 2392 ATOM 99249 O WAT 2393 30.701 122.136 147.452 1.00 0.00 O ATOM 99250 H1 WAT 2393 30.177 121.839 146.708 1.00 0.00 H ATOM 99251 H2 WAT 2393 31.461 122.561 147.056 1.00 0.00 H TER 99253 WAT 2393 ATOM 99253 O WAT 2394 87.816 31.298 95.140 1.00 0.00 O ATOM 99254 H1 WAT 2394 87.883 30.419 94.768 1.00 0.00 H ATOM 99255 H2 WAT 2394 88.583 31.378 95.707 1.00 0.00 H TER 99257 WAT 2394 ATOM 99257 O WAT 2395 31.344 50.578 131.419 1.00 0.00 O ATOM 99258 H1 WAT 2395 31.909 50.418 132.174 1.00 0.00 H ATOM 99259 H2 WAT 2395 31.387 51.524 131.282 1.00 0.00 H TER 99261 WAT 2395 ATOM 99261 O WAT 2396 44.662 34.919 86.112 1.00 0.00 O ATOM 99262 H1 WAT 2396 45.505 35.359 86.002 1.00 0.00 H ATOM 99263 H2 WAT 2396 44.876 34.100 86.560 1.00 0.00 H TER 99265 WAT 2396 ATOM 99265 O WAT 2397 49.676 128.387 120.912 1.00 0.00 O ATOM 99266 H1 WAT 2397 50.457 128.005 120.511 1.00 0.00 H ATOM 99267 H2 WAT 2397 49.730 129.319 120.700 1.00 0.00 H TER 99269 WAT 2397 ATOM 99269 O WAT 2398 31.115 59.560 97.186 1.00 0.00 O ATOM 99270 H1 WAT 2398 31.315 60.405 96.784 1.00 0.00 H ATOM 99271 H2 WAT 2398 31.029 59.754 98.120 1.00 0.00 H TER 99273 WAT 2398 ATOM 99273 O WAT 2399 65.114 95.969 129.454 1.00 0.00 O ATOM 99274 H1 WAT 2399 65.575 95.131 129.427 1.00 0.00 H ATOM 99275 H2 WAT 2399 64.863 96.075 130.372 1.00 0.00 H TER 99277 WAT 2399 ATOM 99277 O WAT 2400 106.488 63.609 135.713 1.00 0.00 O ATOM 99278 H1 WAT 2400 106.158 62.732 135.520 1.00 0.00 H ATOM 99279 H2 WAT 2400 107.144 63.473 136.397 1.00 0.00 H TER 99281 WAT 2400 ATOM 99281 O WAT 2401 69.731 96.904 70.581 1.00 0.00 O ATOM 99282 H1 WAT 2401 69.564 96.803 71.518 1.00 0.00 H ATOM 99283 H2 WAT 2401 69.747 96.009 70.242 1.00 0.00 H TER 99285 WAT 2401 ATOM 99285 O WAT 2402 139.271 48.831 58.666 1.00 0.00 O ATOM 99286 H1 WAT 2402 139.420 49.746 58.428 1.00 0.00 H ATOM 99287 H2 WAT 2402 138.915 48.432 57.872 1.00 0.00 H TER 99289 WAT 2402 ATOM 99289 O WAT 2403 121.017 24.870 102.808 1.00 0.00 O ATOM 99290 H1 WAT 2403 120.231 24.516 102.393 1.00 0.00 H ATOM 99291 H2 WAT 2403 121.656 24.931 102.098 1.00 0.00 H TER 99293 WAT 2403 ATOM 99293 O WAT 2404 58.971 24.049 80.566 1.00 0.00 O ATOM 99294 H1 WAT 2404 58.380 23.513 80.037 1.00 0.00 H ATOM 99295 H2 WAT 2404 59.431 23.421 81.122 1.00 0.00 H TER 99297 WAT 2404 ATOM 99297 O WAT 2405 143.253 113.771 28.136 1.00 0.00 O ATOM 99298 H1 WAT 2405 142.587 114.304 27.702 1.00 0.00 H ATOM 99299 H2 WAT 2405 144.070 114.001 27.692 1.00 0.00 H TER 99301 WAT 2405 ATOM 99301 O WAT 2406 102.951 87.660 8.568 1.00 0.00 O ATOM 99302 H1 WAT 2406 103.740 87.119 8.587 1.00 0.00 H ATOM 99303 H2 WAT 2406 102.234 87.034 8.467 1.00 0.00 H TER 99305 WAT 2406 ATOM 99305 O WAT 2407 12.286 123.519 86.203 1.00 0.00 O ATOM 99306 H1 WAT 2407 11.808 123.314 87.007 1.00 0.00 H ATOM 99307 H2 WAT 2407 11.604 123.739 85.568 1.00 0.00 H TER 99309 WAT 2407 ATOM 99309 O WAT 2408 105.210 25.234 16.024 1.00 0.00 O ATOM 99310 H1 WAT 2408 104.452 24.828 15.605 1.00 0.00 H ATOM 99311 H2 WAT 2408 104.835 25.835 16.668 1.00 0.00 H TER 99313 WAT 2408 ATOM 99313 O WAT 2409 104.544 74.933 85.710 1.00 0.00 O ATOM 99314 H1 WAT 2409 105.065 74.361 86.273 1.00 0.00 H ATOM 99315 H2 WAT 2409 103.940 74.342 85.261 1.00 0.00 H TER 99317 WAT 2409 ATOM 99317 O WAT 2410 56.746 50.885 118.200 1.00 0.00 O ATOM 99318 H1 WAT 2410 57.185 51.620 117.772 1.00 0.00 H ATOM 99319 H2 WAT 2410 56.346 50.394 117.483 1.00 0.00 H TER 99321 WAT 2410 ATOM 99321 O WAT 2411 104.189 54.965 4.388 1.00 0.00 O ATOM 99322 H1 WAT 2411 103.273 55.242 4.410 1.00 0.00 H ATOM 99323 H2 WAT 2411 104.290 54.405 5.157 1.00 0.00 H TER 99325 WAT 2411 ATOM 99325 O WAT 2412 100.847 98.574 143.050 1.00 0.00 O ATOM 99326 H1 WAT 2412 100.250 98.337 142.340 1.00 0.00 H ATOM 99327 H2 WAT 2412 101.193 99.430 142.797 1.00 0.00 H TER 99329 WAT 2412 ATOM 99329 O WAT 2413 27.258 140.803 51.553 1.00 0.00 O ATOM 99330 H1 WAT 2413 28.046 140.485 51.113 1.00 0.00 H ATOM 99331 H2 WAT 2413 27.487 140.810 52.482 1.00 0.00 H TER 99333 WAT 2413 ATOM 99333 O WAT 2414 120.075 39.440 83.467 1.00 0.00 O ATOM 99334 H1 WAT 2414 119.393 39.921 82.998 1.00 0.00 H ATOM 99335 H2 WAT 2414 120.892 39.713 83.049 1.00 0.00 H TER 99337 WAT 2414 ATOM 99337 O WAT 2415 86.318 79.010 22.224 1.00 0.00 O ATOM 99338 H1 WAT 2415 87.006 79.283 21.617 1.00 0.00 H ATOM 99339 H2 WAT 2415 86.683 78.247 22.672 1.00 0.00 H TER 99341 WAT 2415 ATOM 99341 O WAT 2416 57.224 6.711 59.730 1.00 0.00 O ATOM 99342 H1 WAT 2416 56.923 5.802 59.737 1.00 0.00 H ATOM 99343 H2 WAT 2416 56.991 7.034 58.859 1.00 0.00 H TER 99345 WAT 2416 ATOM 99345 O WAT 2417 119.202 136.446 56.731 1.00 0.00 O ATOM 99346 H1 WAT 2417 118.675 136.075 56.024 1.00 0.00 H ATOM 99347 H2 WAT 2417 118.584 136.564 57.453 1.00 0.00 H TER 99349 WAT 2417 ATOM 99349 O WAT 2418 94.630 144.064 111.077 1.00 0.00 O ATOM 99350 H1 WAT 2418 93.936 144.123 111.734 1.00 0.00 H ATOM 99351 H2 WAT 2418 95.228 144.780 111.295 1.00 0.00 H TER 99353 WAT 2418 ATOM 99353 O WAT 2419 75.977 144.912 108.191 1.00 0.00 O ATOM 99354 H1 WAT 2419 76.768 144.540 107.800 1.00 0.00 H ATOM 99355 H2 WAT 2419 75.844 145.737 107.726 1.00 0.00 H TER 99357 WAT 2419 ATOM 99357 O WAT 2420 29.558 73.768 77.094 1.00 0.00 O ATOM 99358 H1 WAT 2420 28.793 74.336 77.004 1.00 0.00 H ATOM 99359 H2 WAT 2420 29.211 72.954 77.457 1.00 0.00 H TER 99361 WAT 2420 ATOM 99361 O WAT 2421 17.823 139.120 25.167 1.00 0.00 O ATOM 99362 H1 WAT 2421 18.237 139.834 24.682 1.00 0.00 H ATOM 99363 H2 WAT 2421 18.546 138.537 25.397 1.00 0.00 H TER 99365 WAT 2421 ATOM 99365 O WAT 2422 19.366 46.885 93.556 1.00 0.00 O ATOM 99366 H1 WAT 2422 19.368 45.941 93.713 1.00 0.00 H ATOM 99367 H2 WAT 2422 18.733 47.009 92.848 1.00 0.00 H TER 99369 WAT 2422 ATOM 99369 O WAT 2423 5.600 24.075 2.784 1.00 0.00 O ATOM 99370 H1 WAT 2423 5.355 24.985 2.955 1.00 0.00 H ATOM 99371 H2 WAT 2423 4.919 23.559 3.214 1.00 0.00 H TER 99373 WAT 2423 ATOM 99373 O WAT 2424 56.742 34.599 131.056 1.00 0.00 O ATOM 99374 H1 WAT 2424 56.541 34.532 131.990 1.00 0.00 H ATOM 99375 H2 WAT 2424 55.891 34.730 130.637 1.00 0.00 H TER 99377 WAT 2424 ATOM 99377 O WAT 2425 50.694 20.781 131.547 1.00 0.00 O ATOM 99378 H1 WAT 2425 50.761 21.039 132.467 1.00 0.00 H ATOM 99379 H2 WAT 2425 50.791 19.829 131.558 1.00 0.00 H TER 99381 WAT 2425 ATOM 99381 O WAT 2426 16.957 141.524 79.205 1.00 0.00 O ATOM 99382 H1 WAT 2426 17.532 141.417 79.963 1.00 0.00 H ATOM 99383 H2 WAT 2426 16.175 141.950 79.556 1.00 0.00 H TER 99385 WAT 2426 ATOM 99385 O WAT 2427 113.906 116.371 63.074 1.00 0.00 O ATOM 99386 H1 WAT 2427 113.310 116.826 62.478 1.00 0.00 H ATOM 99387 H2 WAT 2427 114.255 115.646 62.557 1.00 0.00 H TER 99389 WAT 2427 ATOM 99389 O WAT 2428 118.595 82.250 95.339 1.00 0.00 O ATOM 99390 H1 WAT 2428 117.652 82.095 95.287 1.00 0.00 H ATOM 99391 H2 WAT 2428 118.876 82.325 94.427 1.00 0.00 H TER 99393 WAT 2428 ATOM 99393 O WAT 2429 36.287 138.240 11.872 1.00 0.00 O ATOM 99394 H1 WAT 2429 37.037 138.463 11.320 1.00 0.00 H ATOM 99395 H2 WAT 2429 36.571 138.452 12.760 1.00 0.00 H TER 99397 WAT 2429 ATOM 99397 O WAT 2430 117.083 125.708 152.749 1.00 0.00 O ATOM 99398 H1 WAT 2430 117.017 125.179 153.544 1.00 0.00 H ATOM 99399 H2 WAT 2430 117.742 126.370 152.956 1.00 0.00 H TER 99401 WAT 2430 ATOM 99401 O WAT 2431 13.931 2.506 96.904 1.00 0.00 O ATOM 99402 H1 WAT 2431 14.229 3.415 96.899 1.00 0.00 H ATOM 99403 H2 WAT 2431 13.345 2.441 96.150 1.00 0.00 H TER 99405 WAT 2431 ATOM 99405 O WAT 2432 2.058 71.818 98.932 1.00 0.00 O ATOM 99406 H1 WAT 2432 1.915 71.178 99.630 1.00 0.00 H ATOM 99407 H2 WAT 2432 1.793 71.363 98.133 1.00 0.00 H TER 99409 WAT 2432 ATOM 99409 O WAT 2433 99.200 44.681 121.867 1.00 0.00 O ATOM 99410 H1 WAT 2433 99.753 43.928 121.661 1.00 0.00 H ATOM 99411 H2 WAT 2433 98.586 44.736 121.134 1.00 0.00 H TER 99413 WAT 2433 ATOM 99413 O WAT 2434 91.573 45.574 22.586 1.00 0.00 O ATOM 99414 H1 WAT 2434 91.323 46.408 22.984 1.00 0.00 H ATOM 99415 H2 WAT 2434 92.269 45.802 21.970 1.00 0.00 H TER 99417 WAT 2434 ATOM 99417 O WAT 2435 140.643 33.963 73.350 1.00 0.00 O ATOM 99418 H1 WAT 2435 141.364 33.454 73.722 1.00 0.00 H ATOM 99419 H2 WAT 2435 140.423 33.508 72.537 1.00 0.00 H TER 99421 WAT 2435 ATOM 99421 O WAT 2436 96.404 143.614 152.941 1.00 0.00 O ATOM 99422 H1 WAT 2436 96.455 144.472 153.362 1.00 0.00 H ATOM 99423 H2 WAT 2436 96.148 143.804 152.038 1.00 0.00 H TER 99425 WAT 2436 ATOM 99425 O WAT 2437 72.593 38.534 132.671 1.00 0.00 O ATOM 99426 H1 WAT 2437 73.501 38.579 132.370 1.00 0.00 H ATOM 99427 H2 WAT 2437 72.274 37.692 132.346 1.00 0.00 H TER 99429 WAT 2437 ATOM 99429 O WAT 2438 39.294 28.203 24.633 1.00 0.00 O ATOM 99430 H1 WAT 2438 39.002 29.096 24.448 1.00 0.00 H ATOM 99431 H2 WAT 2438 39.096 27.716 23.833 1.00 0.00 H TER 99433 WAT 2438 ATOM 99433 O WAT 2439 23.203 98.522 88.465 1.00 0.00 O ATOM 99434 H1 WAT 2439 23.599 98.342 87.613 1.00 0.00 H ATOM 99435 H2 WAT 2439 22.828 99.398 88.375 1.00 0.00 H TER 99437 WAT 2439 ATOM 99437 O WAT 2440 62.448 73.962 154.499 1.00 0.00 O ATOM 99438 H1 WAT 2440 63.034 73.481 155.084 1.00 0.00 H ATOM 99439 H2 WAT 2440 61.632 74.045 154.992 1.00 0.00 H TER 99441 WAT 2440 ATOM 99441 O WAT 2441 120.991 131.162 114.024 1.00 0.00 O ATOM 99442 H1 WAT 2441 120.727 131.398 113.135 1.00 0.00 H ATOM 99443 H2 WAT 2441 120.207 131.308 114.554 1.00 0.00 H TER 99445 WAT 2441 ATOM 99445 O WAT 2442 125.475 88.023 88.046 1.00 0.00 O ATOM 99446 H1 WAT 2442 125.606 87.082 87.931 1.00 0.00 H ATOM 99447 H2 WAT 2442 124.548 88.161 87.851 1.00 0.00 H TER 99449 WAT 2442 ATOM 99449 O WAT 2443 81.951 1.349 131.490 1.00 0.00 O ATOM 99450 H1 WAT 2443 82.086 1.824 130.671 1.00 0.00 H ATOM 99451 H2 WAT 2443 81.345 1.897 131.989 1.00 0.00 H TER 99453 WAT 2443 ATOM 99453 O WAT 2444 36.008 73.534 93.831 1.00 0.00 O ATOM 99454 H1 WAT 2444 36.237 73.607 92.905 1.00 0.00 H ATOM 99455 H2 WAT 2444 36.850 73.518 94.285 1.00 0.00 H TER 99457 WAT 2444 ATOM 99457 O WAT 2445 46.640 49.919 5.832 1.00 0.00 O ATOM 99458 H1 WAT 2445 47.241 50.545 5.427 1.00 0.00 H ATOM 99459 H2 WAT 2445 46.425 50.307 6.680 1.00 0.00 H TER 99461 WAT 2445 ATOM 99461 O WAT 2446 137.458 4.300 96.496 1.00 0.00 O ATOM 99462 H1 WAT 2446 138.144 4.095 97.131 1.00 0.00 H ATOM 99463 H2 WAT 2446 137.476 5.254 96.423 1.00 0.00 H TER 99465 WAT 2446 ATOM 99465 O WAT 2447 126.479 129.440 132.672 1.00 0.00 O ATOM 99466 H1 WAT 2447 127.330 129.878 132.711 1.00 0.00 H ATOM 99467 H2 WAT 2447 126.314 129.157 133.572 1.00 0.00 H TER 99469 WAT 2447 ATOM 99469 O WAT 2448 11.497 140.688 137.296 1.00 0.00 O ATOM 99470 H1 WAT 2448 11.226 140.568 138.206 1.00 0.00 H ATOM 99471 H2 WAT 2448 11.425 139.815 136.908 1.00 0.00 H TER 99473 WAT 2448 ATOM 99473 O WAT 2449 83.280 35.819 60.013 1.00 0.00 O ATOM 99474 H1 WAT 2449 82.573 36.208 59.498 1.00 0.00 H ATOM 99475 H2 WAT 2449 83.389 36.412 60.757 1.00 0.00 H TER 99477 WAT 2449 ATOM 99477 O WAT 2450 88.471 65.213 85.868 1.00 0.00 O ATOM 99478 H1 WAT 2450 89.088 65.206 85.136 1.00 0.00 H ATOM 99479 H2 WAT 2450 87.907 65.967 85.697 1.00 0.00 H TER 99481 WAT 2450 ATOM 99481 O WAT 2451 101.854 107.653 30.082 1.00 0.00 O ATOM 99482 H1 WAT 2451 102.045 108.391 30.662 1.00 0.00 H ATOM 99483 H2 WAT 2451 101.890 108.024 29.201 1.00 0.00 H TER 99485 WAT 2451 ATOM 99485 O WAT 2452 123.550 70.147 76.768 1.00 0.00 O ATOM 99486 H1 WAT 2452 122.818 69.837 77.302 1.00 0.00 H ATOM 99487 H2 WAT 2452 123.179 70.253 75.892 1.00 0.00 H TER 99489 WAT 2452 ATOM 99489 O WAT 2453 95.145 137.020 99.827 1.00 0.00 O ATOM 99490 H1 WAT 2453 95.347 136.162 99.452 1.00 0.00 H ATOM 99491 H2 WAT 2453 95.795 137.608 99.443 1.00 0.00 H TER 99493 WAT 2453 ATOM 99493 O WAT 2454 65.691 91.340 115.181 1.00 0.00 O ATOM 99494 H1 WAT 2454 66.617 91.412 114.953 1.00 0.00 H ATOM 99495 H2 WAT 2454 65.237 91.844 114.505 1.00 0.00 H TER 99497 WAT 2454 ATOM 99497 O WAT 2455 98.799 107.869 103.088 1.00 0.00 O ATOM 99498 H1 WAT 2455 99.616 108.150 102.676 1.00 0.00 H ATOM 99499 H2 WAT 2455 98.235 107.620 102.356 1.00 0.00 H TER 99501 WAT 2455 ATOM 99501 O WAT 2456 55.930 71.415 127.129 1.00 0.00 O ATOM 99502 H1 WAT 2456 55.337 71.144 126.428 1.00 0.00 H ATOM 99503 H2 WAT 2456 55.707 72.331 127.291 1.00 0.00 H TER 99505 WAT 2456 ATOM 99505 O WAT 2457 29.763 107.827 142.478 1.00 0.00 O ATOM 99506 H1 WAT 2457 30.553 108.203 142.089 1.00 0.00 H ATOM 99507 H2 WAT 2457 29.668 108.282 143.315 1.00 0.00 H TER 99509 WAT 2457 ATOM 99509 O WAT 2458 102.402 5.385 100.286 1.00 0.00 O ATOM 99510 H1 WAT 2458 102.209 6.077 100.918 1.00 0.00 H ATOM 99511 H2 WAT 2458 103.289 5.578 99.983 1.00 0.00 H TER 99513 WAT 2458 ATOM 99513 O WAT 2459 132.744 65.766 72.776 1.00 0.00 O ATOM 99514 H1 WAT 2459 132.959 65.906 71.854 1.00 0.00 H ATOM 99515 H2 WAT 2459 133.523 66.057 73.250 1.00 0.00 H TER 99517 WAT 2459 ATOM 99517 O WAT 2460 105.745 117.778 90.344 1.00 0.00 O ATOM 99518 H1 WAT 2460 106.285 118.420 90.806 1.00 0.00 H ATOM 99519 H2 WAT 2460 105.325 118.277 89.644 1.00 0.00 H TER 99521 WAT 2460 ATOM 99521 O WAT 2461 71.004 25.505 50.532 1.00 0.00 O ATOM 99522 H1 WAT 2461 71.048 25.312 51.468 1.00 0.00 H ATOM 99523 H2 WAT 2461 71.536 26.293 50.425 1.00 0.00 H TER 99525 WAT 2461 ATOM 99525 O WAT 2462 56.602 42.727 141.468 1.00 0.00 O ATOM 99526 H1 WAT 2462 57.058 43.111 142.218 1.00 0.00 H ATOM 99527 H2 WAT 2462 56.796 43.319 140.742 1.00 0.00 H TER 99529 WAT 2462 ATOM 99529 O WAT 2463 111.474 78.584 119.986 1.00 0.00 O ATOM 99530 H1 WAT 2463 111.199 77.770 119.565 1.00 0.00 H ATOM 99531 H2 WAT 2463 112.053 79.000 119.347 1.00 0.00 H TER 99533 WAT 2463 ATOM 99533 O WAT 2464 88.170 44.750 6.698 1.00 0.00 O ATOM 99534 H1 WAT 2464 88.350 45.575 7.150 1.00 0.00 H ATOM 99535 H2 WAT 2464 87.227 44.765 6.539 1.00 0.00 H TER 99537 WAT 2464 ATOM 99537 O WAT 2465 58.031 11.031 155.488 1.00 0.00 O ATOM 99538 H1 WAT 2465 57.693 11.791 155.014 1.00 0.00 H ATOM 99539 H2 WAT 2465 57.260 10.487 155.649 1.00 0.00 H TER 99541 WAT 2465 ATOM 99541 O WAT 2466 120.129 6.642 63.452 1.00 0.00 O ATOM 99542 H1 WAT 2466 121.052 6.750 63.226 1.00 0.00 H ATOM 99543 H2 WAT 2466 119.725 6.297 62.656 1.00 0.00 H TER 99545 WAT 2466 ATOM 99545 O WAT 2467 83.584 42.038 7.559 1.00 0.00 O ATOM 99546 H1 WAT 2467 83.642 42.153 6.610 1.00 0.00 H ATOM 99547 H2 WAT 2467 82.875 41.406 7.681 1.00 0.00 H TER 99549 WAT 2467 ATOM 99549 O WAT 2468 123.226 13.346 129.435 1.00 0.00 O ATOM 99550 H1 WAT 2468 123.388 14.158 129.915 1.00 0.00 H ATOM 99551 H2 WAT 2468 124.099 13.023 129.209 1.00 0.00 H TER 99553 WAT 2468 ATOM 99553 O WAT 2469 91.400 23.643 143.503 1.00 0.00 O ATOM 99554 H1 WAT 2469 91.837 24.411 143.871 1.00 0.00 H ATOM 99555 H2 WAT 2469 91.867 22.898 143.882 1.00 0.00 H TER 99557 WAT 2469 ATOM 99557 O WAT 2470 104.747 0.439 130.512 1.00 0.00 O ATOM 99558 H1 WAT 2470 105.354 -0.002 131.106 1.00 0.00 H ATOM 99559 H2 WAT 2470 104.376 1.151 131.033 1.00 0.00 H TER 99561 WAT 2470 ATOM 99561 O WAT 2471 75.716 14.129 124.485 1.00 0.00 O ATOM 99562 H1 WAT 2471 74.964 14.654 124.211 1.00 0.00 H ATOM 99563 H2 WAT 2471 75.339 13.434 125.024 1.00 0.00 H TER 99565 WAT 2471 ATOM 99565 O WAT 2472 32.778 98.701 119.079 1.00 0.00 O ATOM 99566 H1 WAT 2472 33.134 98.588 118.197 1.00 0.00 H ATOM 99567 H2 WAT 2472 32.782 99.647 119.220 1.00 0.00 H TER 99569 WAT 2472 ATOM 99569 O WAT 2473 122.246 45.763 124.215 1.00 0.00 O ATOM 99570 H1 WAT 2473 122.125 45.690 123.268 1.00 0.00 H ATOM 99571 H2 WAT 2473 121.954 44.918 124.558 1.00 0.00 H TER 99573 WAT 2473 ATOM 99573 O WAT 2474 76.016 95.194 140.451 1.00 0.00 O ATOM 99574 H1 WAT 2474 75.818 95.918 141.045 1.00 0.00 H ATOM 99575 H2 WAT 2474 75.518 95.392 139.658 1.00 0.00 H TER 99577 WAT 2474 ATOM 99577 O WAT 2475 27.109 8.863 80.506 1.00 0.00 O ATOM 99578 H1 WAT 2475 27.432 9.511 79.879 1.00 0.00 H ATOM 99579 H2 WAT 2475 27.890 8.382 80.778 1.00 0.00 H TER 99581 WAT 2475 ATOM 99581 O WAT 2476 63.464 99.629 99.391 1.00 0.00 O ATOM 99582 H1 WAT 2476 63.525 99.193 98.541 1.00 0.00 H ATOM 99583 H2 WAT 2476 64.310 99.463 99.806 1.00 0.00 H TER 99585 WAT 2476 ATOM 99585 O WAT 2477 137.064 95.690 111.589 1.00 0.00 O ATOM 99586 H1 WAT 2477 136.617 96.162 112.291 1.00 0.00 H ATOM 99587 H2 WAT 2477 137.892 95.410 111.978 1.00 0.00 H TER 99589 WAT 2477 ATOM 99589 O WAT 2478 50.924 63.667 9.371 1.00 0.00 O ATOM 99590 H1 WAT 2478 51.162 64.591 9.455 1.00 0.00 H ATOM 99591 H2 WAT 2478 49.976 63.674 9.243 1.00 0.00 H TER 99593 WAT 2478 ATOM 99593 O WAT 2479 26.176 5.343 131.012 1.00 0.00 O ATOM 99594 H1 WAT 2479 26.817 5.955 130.648 1.00 0.00 H ATOM 99595 H2 WAT 2479 25.394 5.469 130.475 1.00 0.00 H TER 99597 WAT 2479 ATOM 99597 O WAT 2480 35.834 133.470 155.942 1.00 0.00 O ATOM 99598 H1 WAT 2480 36.011 132.538 156.068 1.00 0.00 H ATOM 99599 H2 WAT 2480 36.190 133.889 156.726 1.00 0.00 H TER 99601 WAT 2480 ATOM 99601 O WAT 2481 59.040 68.844 125.681 1.00 0.00 O ATOM 99602 H1 WAT 2481 59.230 69.473 126.376 1.00 0.00 H ATOM 99603 H2 WAT 2481 59.315 68.000 126.039 1.00 0.00 H TER 99605 WAT 2481 ATOM 99605 O WAT 2482 54.941 89.682 84.824 1.00 0.00 O ATOM 99606 H1 WAT 2482 54.338 89.262 84.210 1.00 0.00 H ATOM 99607 H2 WAT 2482 55.088 90.553 84.455 1.00 0.00 H TER 99609 WAT 2482 ATOM 99609 O WAT 2483 13.696 93.810 98.278 1.00 0.00 O ATOM 99610 H1 WAT 2483 14.187 94.617 98.435 1.00 0.00 H ATOM 99611 H2 WAT 2483 14.337 93.211 97.894 1.00 0.00 H TER 99613 WAT 2483 ATOM 99613 O WAT 2484 96.497 116.433 69.862 1.00 0.00 O ATOM 99614 H1 WAT 2484 96.679 116.357 70.799 1.00 0.00 H ATOM 99615 H2 WAT 2484 97.294 116.114 69.437 1.00 0.00 H TER 99617 WAT 2484 ATOM 99617 O WAT 2485 3.139 52.200 91.773 1.00 0.00 O ATOM 99618 H1 WAT 2485 2.570 52.048 91.018 1.00 0.00 H ATOM 99619 H2 WAT 2485 3.359 53.130 91.724 1.00 0.00 H TER 99621 WAT 2485 ATOM 99621 O WAT 2486 30.225 3.206 152.462 1.00 0.00 O ATOM 99622 H1 WAT 2486 30.583 3.963 151.998 1.00 0.00 H ATOM 99623 H2 WAT 2486 30.758 2.469 152.166 1.00 0.00 H TER 99625 WAT 2486 ATOM 99625 O WAT 2487 140.931 126.687 120.483 1.00 0.00 O ATOM 99626 H1 WAT 2487 140.250 127.301 120.758 1.00 0.00 H ATOM 99627 H2 WAT 2487 141.624 126.789 121.136 1.00 0.00 H TER 99629 WAT 2487 ATOM 99629 O WAT 2488 25.917 78.293 5.502 1.00 0.00 O ATOM 99630 H1 WAT 2488 26.138 79.143 5.883 1.00 0.00 H ATOM 99631 H2 WAT 2488 25.323 77.893 6.138 1.00 0.00 H TER 99633 WAT 2488 ATOM 99633 O WAT 2489 142.590 49.429 89.470 1.00 0.00 O ATOM 99634 H1 WAT 2489 142.311 50.338 89.580 1.00 0.00 H ATOM 99635 H2 WAT 2489 142.075 48.941 90.113 1.00 0.00 H TER 99637 WAT 2489 ATOM 99637 O WAT 2490 126.711 86.968 65.266 1.00 0.00 O ATOM 99638 H1 WAT 2490 126.987 87.096 64.358 1.00 0.00 H ATOM 99639 H2 WAT 2490 125.794 86.700 65.201 1.00 0.00 H TER 99641 WAT 2490 ATOM 99641 O WAT 2491 17.226 20.709 115.657 1.00 0.00 O ATOM 99642 H1 WAT 2491 17.429 20.250 116.472 1.00 0.00 H ATOM 99643 H2 WAT 2491 16.513 20.202 115.269 1.00 0.00 H TER 99645 WAT 2491 ATOM 99645 O WAT 2492 72.257 0.763 106.527 1.00 0.00 O ATOM 99646 H1 WAT 2492 72.633 1.038 107.364 1.00 0.00 H ATOM 99647 H2 WAT 2492 72.980 0.839 105.904 1.00 0.00 H TER 99649 WAT 2492 ATOM 99649 O WAT 2493 0.255 28.504 8.503 1.00 0.00 O ATOM 99650 H1 WAT 2493 -0.616 28.209 8.236 1.00 0.00 H ATOM 99651 H2 WAT 2493 0.288 29.423 8.236 1.00 0.00 H TER 99653 WAT 2493 ATOM 99653 O WAT 2494 54.946 97.732 94.201 1.00 0.00 O ATOM 99654 H1 WAT 2494 54.726 98.243 93.423 1.00 0.00 H ATOM 99655 H2 WAT 2494 54.114 97.625 94.661 1.00 0.00 H TER 99657 WAT 2494 ATOM 99657 O WAT 2495 101.115 3.180 134.657 1.00 0.00 O ATOM 99658 H1 WAT 2495 101.683 2.720 135.275 1.00 0.00 H ATOM 99659 H2 WAT 2495 100.736 2.487 134.116 1.00 0.00 H TER 99661 WAT 2495 ATOM 99661 O WAT 2496 107.194 44.713 134.226 1.00 0.00 O ATOM 99662 H1 WAT 2496 106.744 43.873 134.318 1.00 0.00 H ATOM 99663 H2 WAT 2496 106.605 45.242 133.689 1.00 0.00 H TER 99665 WAT 2496 ATOM 99665 O WAT 2497 19.287 131.300 136.396 1.00 0.00 O ATOM 99666 H1 WAT 2497 18.528 130.997 136.895 1.00 0.00 H ATOM 99667 H2 WAT 2497 20.041 130.955 136.874 1.00 0.00 H TER 99669 WAT 2497 ATOM 99669 O WAT 2498 100.845 34.188 118.399 1.00 0.00 O ATOM 99670 H1 WAT 2498 100.114 34.391 117.815 1.00 0.00 H ATOM 99671 H2 WAT 2498 101.419 34.952 118.337 1.00 0.00 H TER 99673 WAT 2498 ATOM 99673 O WAT 2499 33.323 56.914 138.104 1.00 0.00 O ATOM 99674 H1 WAT 2499 33.821 56.165 137.774 1.00 0.00 H ATOM 99675 H2 WAT 2499 33.923 57.353 138.707 1.00 0.00 H TER 99677 WAT 2499 ATOM 99677 O WAT 2500 74.477 41.232 7.207 1.00 0.00 O ATOM 99678 H1 WAT 2500 73.958 40.547 6.785 1.00 0.00 H ATOM 99679 H2 WAT 2500 74.049 42.049 6.952 1.00 0.00 H TER 99681 WAT 2500 ATOM 99681 O WAT 2501 30.435 92.957 114.706 1.00 0.00 O ATOM 99682 H1 WAT 2501 31.323 92.980 115.060 1.00 0.00 H ATOM 99683 H2 WAT 2501 30.380 92.116 114.252 1.00 0.00 H TER 99685 WAT 2501 ATOM 99685 O WAT 2502 22.771 77.310 123.953 1.00 0.00 O ATOM 99686 H1 WAT 2502 23.438 77.684 123.377 1.00 0.00 H ATOM 99687 H2 WAT 2502 21.940 77.578 123.561 1.00 0.00 H TER 99689 WAT 2502 ATOM 99689 O WAT 2503 1.262 49.530 153.837 1.00 0.00 O ATOM 99690 H1 WAT 2503 1.875 48.797 153.898 1.00 0.00 H ATOM 99691 H2 WAT 2503 1.631 50.094 153.157 1.00 0.00 H TER 99693 WAT 2503 ATOM 99693 O WAT 2504 58.687 99.941 64.955 1.00 0.00 O ATOM 99694 H1 WAT 2504 58.220 99.173 64.625 1.00 0.00 H ATOM 99695 H2 WAT 2504 59.093 99.643 65.769 1.00 0.00 H TER 99697 WAT 2504 ATOM 99697 O WAT 2505 47.963 137.483 124.025 1.00 0.00 O ATOM 99698 H1 WAT 2505 48.238 136.899 123.318 1.00 0.00 H ATOM 99699 H2 WAT 2505 47.010 137.523 123.946 1.00 0.00 H TER 99701 WAT 2505 ATOM 99701 O WAT 2506 19.747 116.725 71.066 1.00 0.00 O ATOM 99702 H1 WAT 2506 20.352 116.409 71.737 1.00 0.00 H ATOM 99703 H2 WAT 2506 18.974 116.169 71.161 1.00 0.00 H TER 99705 WAT 2506 ATOM 99705 O WAT 2507 138.416 69.553 55.048 1.00 0.00 O ATOM 99706 H1 WAT 2507 139.239 69.381 54.590 1.00 0.00 H ATOM 99707 H2 WAT 2507 137.898 68.759 54.917 1.00 0.00 H TER 99709 WAT 2507 ATOM 99709 O WAT 2508 6.725 52.624 129.511 1.00 0.00 O ATOM 99710 H1 WAT 2508 6.184 52.613 130.300 1.00 0.00 H ATOM 99711 H2 WAT 2508 7.176 53.468 129.541 1.00 0.00 H TER 99713 WAT 2508 ATOM 99713 O WAT 2509 103.747 63.754 78.043 1.00 0.00 O ATOM 99714 H1 WAT 2509 104.131 62.907 77.814 1.00 0.00 H ATOM 99715 H2 WAT 2509 104.500 64.317 78.224 1.00 0.00 H TER 99717 WAT 2509 ATOM 99717 O WAT 2510 70.583 66.491 129.397 1.00 0.00 O ATOM 99718 H1 WAT 2510 70.957 66.079 130.176 1.00 0.00 H ATOM 99719 H2 WAT 2510 69.637 66.451 129.536 1.00 0.00 H TER 99721 WAT 2510 ATOM 99721 O WAT 2511 99.319 28.438 83.277 1.00 0.00 O ATOM 99722 H1 WAT 2511 99.948 27.880 82.818 1.00 0.00 H ATOM 99723 H2 WAT 2511 98.465 28.152 82.953 1.00 0.00 H TER 99725 WAT 2511 ATOM 99725 O WAT 2512 140.049 93.171 10.244 1.00 0.00 O ATOM 99726 H1 WAT 2512 140.407 92.286 10.308 1.00 0.00 H ATOM 99727 H2 WAT 2512 139.795 93.261 9.325 1.00 0.00 H TER 99729 WAT 2512 ATOM 99729 O WAT 2513 118.876 127.115 106.435 1.00 0.00 O ATOM 99730 H1 WAT 2513 118.687 126.214 106.170 1.00 0.00 H ATOM 99731 H2 WAT 2513 119.410 127.026 107.224 1.00 0.00 H TER 99733 WAT 2513 ATOM 99733 O WAT 2514 68.979 127.770 156.768 1.00 0.00 O ATOM 99734 H1 WAT 2514 69.927 127.901 156.775 1.00 0.00 H ATOM 99735 H2 WAT 2514 68.704 127.971 157.663 1.00 0.00 H TER 99737 WAT 2514 ATOM 99737 O WAT 2515 91.525 93.532 115.297 1.00 0.00 O ATOM 99738 H1 WAT 2515 91.008 93.529 114.492 1.00 0.00 H ATOM 99739 H2 WAT 2515 92.390 93.839 115.025 1.00 0.00 H TER 99741 WAT 2515 ATOM 99741 O WAT 2516 101.301 62.942 13.679 1.00 0.00 O ATOM 99742 H1 WAT 2516 101.363 62.578 12.796 1.00 0.00 H ATOM 99743 H2 WAT 2516 100.520 62.532 14.053 1.00 0.00 H TER 99745 WAT 2516 ATOM 99745 O WAT 2517 64.730 16.173 150.483 1.00 0.00 O ATOM 99746 H1 WAT 2517 64.645 15.973 149.551 1.00 0.00 H ATOM 99747 H2 WAT 2517 64.980 17.096 150.509 1.00 0.00 H TER 99749 WAT 2517 ATOM 99749 O WAT 2518 69.111 121.140 109.780 1.00 0.00 O ATOM 99750 H1 WAT 2518 69.121 120.259 110.154 1.00 0.00 H ATOM 99751 H2 WAT 2518 68.194 121.293 109.552 1.00 0.00 H TER 99753 WAT 2518 ATOM 99753 O WAT 2519 27.771 43.697 59.865 1.00 0.00 O ATOM 99754 H1 WAT 2519 27.435 44.244 59.154 1.00 0.00 H ATOM 99755 H2 WAT 2519 28.531 44.176 60.196 1.00 0.00 H TER 99757 WAT 2519 ATOM 99757 O WAT 2520 99.859 83.666 9.479 1.00 0.00 O ATOM 99758 H1 WAT 2520 100.791 83.593 9.681 1.00 0.00 H ATOM 99759 H2 WAT 2520 99.450 82.956 9.974 1.00 0.00 H TER 99761 WAT 2520 ATOM 99761 O WAT 2521 57.426 110.137 76.365 1.00 0.00 O ATOM 99762 H1 WAT 2521 56.649 110.156 76.924 1.00 0.00 H ATOM 99763 H2 WAT 2521 57.199 110.694 75.621 1.00 0.00 H TER 99765 WAT 2521 ATOM 99765 O WAT 2522 144.238 9.127 139.891 1.00 0.00 O ATOM 99766 H1 WAT 2522 143.955 9.032 140.800 1.00 0.00 H ATOM 99767 H2 WAT 2522 144.084 8.266 139.501 1.00 0.00 H TER 99769 WAT 2522 ATOM 99769 O WAT 2523 45.887 51.504 123.092 1.00 0.00 O ATOM 99770 H1 WAT 2523 45.439 51.723 122.275 1.00 0.00 H ATOM 99771 H2 WAT 2523 46.780 51.827 122.970 1.00 0.00 H TER 99773 WAT 2523 ATOM 99773 O WAT 2524 57.073 30.056 102.486 1.00 0.00 O ATOM 99774 H1 WAT 2524 56.790 29.235 102.889 1.00 0.00 H ATOM 99775 H2 WAT 2524 57.152 30.668 103.218 1.00 0.00 H TER 99777 WAT 2524 ATOM 99777 O WAT 2525 100.512 110.370 113.819 1.00 0.00 O ATOM 99778 H1 WAT 2525 100.084 110.865 113.121 1.00 0.00 H ATOM 99779 H2 WAT 2525 101.237 110.929 114.099 1.00 0.00 H TER 99781 WAT 2525 ATOM 99781 O WAT 2526 65.683 116.118 12.828 1.00 0.00 O ATOM 99782 H1 WAT 2526 64.912 116.637 12.598 1.00 0.00 H ATOM 99783 H2 WAT 2526 65.729 115.445 12.149 1.00 0.00 H TER 99785 WAT 2526 ATOM 99785 O WAT 2527 17.470 50.747 90.188 1.00 0.00 O ATOM 99786 H1 WAT 2527 16.715 51.335 90.198 1.00 0.00 H ATOM 99787 H2 WAT 2527 17.271 50.113 89.499 1.00 0.00 H TER 99789 WAT 2527 ATOM 99789 O WAT 2528 55.581 87.018 82.400 1.00 0.00 O ATOM 99790 H1 WAT 2528 55.150 87.775 82.796 1.00 0.00 H ATOM 99791 H2 WAT 2528 54.934 86.667 81.788 1.00 0.00 H TER 99793 WAT 2528 ATOM 99793 O WAT 2529 69.859 64.904 10.912 1.00 0.00 O ATOM 99794 H1 WAT 2529 70.048 64.047 10.531 1.00 0.00 H ATOM 99795 H2 WAT 2529 68.904 64.937 10.964 1.00 0.00 H TER 99797 WAT 2529 ATOM 99797 O WAT 2530 75.814 73.585 78.383 1.00 0.00 O ATOM 99798 H1 WAT 2530 76.309 72.851 78.017 1.00 0.00 H ATOM 99799 H2 WAT 2530 76.233 74.363 78.015 1.00 0.00 H TER 99801 WAT 2530 ATOM 99801 O WAT 2531 66.574 30.289 140.349 1.00 0.00 O ATOM 99802 H1 WAT 2531 67.088 29.790 139.714 1.00 0.00 H ATOM 99803 H2 WAT 2531 66.882 31.190 140.251 1.00 0.00 H TER 99805 WAT 2531 ATOM 99805 O WAT 2532 64.974 96.031 90.102 1.00 0.00 O ATOM 99806 H1 WAT 2532 64.212 96.546 89.837 1.00 0.00 H ATOM 99807 H2 WAT 2532 65.030 96.157 91.049 1.00 0.00 H TER 99809 WAT 2532 ATOM 99809 O WAT 2533 16.862 50.482 9.317 1.00 0.00 O ATOM 99810 H1 WAT 2533 17.479 51.065 9.761 1.00 0.00 H ATOM 99811 H2 WAT 2533 16.595 50.966 8.536 1.00 0.00 H TER 99813 WAT 2533 ATOM 99813 O WAT 2534 56.803 55.405 25.978 1.00 0.00 O ATOM 99814 H1 WAT 2534 55.867 55.542 26.128 1.00 0.00 H ATOM 99815 H2 WAT 2534 56.957 55.748 25.098 1.00 0.00 H TER 99817 WAT 2534 ATOM 99817 O WAT 2535 13.316 117.213 70.331 1.00 0.00 O ATOM 99818 H1 WAT 2535 12.769 117.755 69.761 1.00 0.00 H ATOM 99819 H2 WAT 2535 12.831 116.392 70.416 1.00 0.00 H TER 99821 WAT 2535 ATOM 99821 O WAT 2536 122.402 65.435 155.158 1.00 0.00 O ATOM 99822 H1 WAT 2536 123.018 65.000 155.747 1.00 0.00 H ATOM 99823 H2 WAT 2536 122.416 66.352 155.430 1.00 0.00 H TER 99825 WAT 2536 ATOM 99825 O WAT 2537 123.705 42.704 125.360 1.00 0.00 O ATOM 99826 H1 WAT 2537 124.544 42.460 124.968 1.00 0.00 H ATOM 99827 H2 WAT 2537 123.089 42.704 124.628 1.00 0.00 H TER 99829 WAT 2537 ATOM 99829 O WAT 2538 42.347 87.286 151.080 1.00 0.00 O ATOM 99830 H1 WAT 2538 41.844 87.936 150.590 1.00 0.00 H ATOM 99831 H2 WAT 2538 42.023 86.443 150.763 1.00 0.00 H TER 99833 WAT 2538 ATOM 99833 O WAT 2539 5.412 96.568 7.746 1.00 0.00 O ATOM 99834 H1 WAT 2539 4.967 96.713 8.581 1.00 0.00 H ATOM 99835 H2 WAT 2539 6.339 96.505 7.976 1.00 0.00 H TER 99837 WAT 2539 ATOM 99837 O WAT 2540 94.466 26.186 122.136 1.00 0.00 O ATOM 99838 H1 WAT 2540 94.825 25.523 122.727 1.00 0.00 H ATOM 99839 H2 WAT 2540 94.939 26.056 121.314 1.00 0.00 H TER 99841 WAT 2540 ATOM 99841 O WAT 2541 109.898 23.116 15.790 1.00 0.00 O ATOM 99842 H1 WAT 2541 109.312 22.367 15.897 1.00 0.00 H ATOM 99843 H2 WAT 2541 110.620 22.944 16.395 1.00 0.00 H TER 99845 WAT 2541 ATOM 99845 O WAT 2542 3.965 139.692 4.129 1.00 0.00 O ATOM 99846 H1 WAT 2542 4.731 139.967 4.632 1.00 0.00 H ATOM 99847 H2 WAT 2542 3.430 140.482 4.055 1.00 0.00 H TER 99849 WAT 2542 ATOM 99849 O WAT 2543 86.064 133.640 60.270 1.00 0.00 O ATOM 99850 H1 WAT 2543 86.239 134.170 59.492 1.00 0.00 H ATOM 99851 H2 WAT 2543 86.761 132.984 60.275 1.00 0.00 H TER 99853 WAT 2543 ATOM 99853 O WAT 2544 48.733 78.335 120.157 1.00 0.00 O ATOM 99854 H1 WAT 2544 49.498 77.852 120.467 1.00 0.00 H ATOM 99855 H2 WAT 2544 48.780 79.176 120.611 1.00 0.00 H TER 99857 WAT 2544 ATOM 99857 O WAT 2545 123.915 32.521 7.001 1.00 0.00 O ATOM 99858 H1 WAT 2545 124.625 32.618 6.368 1.00 0.00 H ATOM 99859 H2 WAT 2545 123.444 31.738 6.715 1.00 0.00 H TER 99861 WAT 2545 ATOM 99861 O WAT 2546 120.790 89.211 119.722 1.00 0.00 O ATOM 99862 H1 WAT 2546 121.479 88.845 120.277 1.00 0.00 H ATOM 99863 H2 WAT 2546 121.074 89.017 118.829 1.00 0.00 H TER 99865 WAT 2546 ATOM 99865 O WAT 2547 73.500 29.661 72.561 1.00 0.00 O ATOM 99866 H1 WAT 2547 73.661 30.015 71.687 1.00 0.00 H ATOM 99867 H2 WAT 2547 73.528 30.425 73.138 1.00 0.00 H TER 99869 WAT 2547 ATOM 99869 O WAT 2548 124.590 15.358 23.569 1.00 0.00 O ATOM 99870 H1 WAT 2548 123.766 14.952 23.298 1.00 0.00 H ATOM 99871 H2 WAT 2548 124.346 15.935 24.292 1.00 0.00 H TER 99873 WAT 2548 ATOM 99873 O WAT 2549 88.393 84.177 15.397 1.00 0.00 O ATOM 99874 H1 WAT 2549 88.089 83.950 14.518 1.00 0.00 H ATOM 99875 H2 WAT 2549 89.338 84.029 15.369 1.00 0.00 H TER 99877 WAT 2549 ATOM 99877 O WAT 2550 38.256 69.156 126.169 1.00 0.00 O ATOM 99878 H1 WAT 2550 38.019 69.898 125.611 1.00 0.00 H ATOM 99879 H2 WAT 2550 37.962 69.411 127.044 1.00 0.00 H TER 99881 WAT 2550 ATOM 99881 O WAT 2551 120.813 118.960 140.018 1.00 0.00 O ATOM 99882 H1 WAT 2551 121.706 119.073 139.692 1.00 0.00 H ATOM 99883 H2 WAT 2551 120.907 118.928 140.970 1.00 0.00 H TER 99885 WAT 2551 ATOM 99885 O WAT 2552 145.306 96.822 58.260 1.00 0.00 O ATOM 99886 H1 WAT 2552 145.079 96.005 58.705 1.00 0.00 H ATOM 99887 H2 WAT 2552 146.055 96.594 57.709 1.00 0.00 H TER 99889 WAT 2552 ATOM 99889 O WAT 2553 34.804 109.793 132.210 1.00 0.00 O ATOM 99890 H1 WAT 2553 34.715 109.789 133.163 1.00 0.00 H ATOM 99891 H2 WAT 2553 34.279 109.048 131.918 1.00 0.00 H TER 99893 WAT 2553 ATOM 99893 O WAT 2554 43.883 80.351 81.948 1.00 0.00 O ATOM 99894 H1 WAT 2554 44.358 79.584 82.268 1.00 0.00 H ATOM 99895 H2 WAT 2554 43.303 80.008 81.269 1.00 0.00 H TER 99897 WAT 2554 ATOM 99897 O WAT 2555 75.411 36.805 118.065 1.00 0.00 O ATOM 99898 H1 WAT 2555 74.525 36.577 118.348 1.00 0.00 H ATOM 99899 H2 WAT 2555 75.914 36.864 118.877 1.00 0.00 H TER 99901 WAT 2555 ATOM 99901 O WAT 2556 51.277 138.262 82.862 1.00 0.00 O ATOM 99902 H1 WAT 2556 51.568 139.169 82.957 1.00 0.00 H ATOM 99903 H2 WAT 2556 50.666 138.283 82.125 1.00 0.00 H TER 99905 WAT 2556 ATOM 99905 O WAT 2557 40.068 34.821 106.450 1.00 0.00 O ATOM 99906 H1 WAT 2557 40.186 35.730 106.725 1.00 0.00 H ATOM 99907 H2 WAT 2557 40.955 34.464 106.412 1.00 0.00 H TER 99909 WAT 2557 ATOM 99909 O WAT 2558 16.242 127.196 8.632 1.00 0.00 O ATOM 99910 H1 WAT 2558 15.697 126.410 8.597 1.00 0.00 H ATOM 99911 H2 WAT 2558 15.752 127.849 8.133 1.00 0.00 H TER 99913 WAT 2558 ATOM 99913 O WAT 2559 44.114 56.680 71.867 1.00 0.00 O ATOM 99914 H1 WAT 2559 45.036 56.594 71.625 1.00 0.00 H ATOM 99915 H2 WAT 2559 43.691 55.917 71.474 1.00 0.00 H TER 99917 WAT 2559 ATOM 99917 O WAT 2560 20.167 124.084 93.712 1.00 0.00 O ATOM 99918 H1 WAT 2560 20.501 124.900 94.085 1.00 0.00 H ATOM 99919 H2 WAT 2560 19.960 123.540 94.473 1.00 0.00 H TER 99921 WAT 2560 ATOM 99921 O WAT 2561 58.993 2.640 2.421 1.00 0.00 O ATOM 99922 H1 WAT 2561 58.802 3.297 1.751 1.00 0.00 H ATOM 99923 H2 WAT 2561 58.648 1.823 2.061 1.00 0.00 H TER 99925 WAT 2561 ATOM 99925 O WAT 2562 51.954 45.082 8.983 1.00 0.00 O ATOM 99926 H1 WAT 2562 51.599 45.733 9.588 1.00 0.00 H ATOM 99927 H2 WAT 2562 52.900 45.223 9.006 1.00 0.00 H TER 99929 WAT 2562 ATOM 99929 O WAT 2563 131.672 43.405 74.015 1.00 0.00 O ATOM 99930 H1 WAT 2563 132.448 43.021 74.423 1.00 0.00 H ATOM 99931 H2 WAT 2563 131.263 43.916 74.713 1.00 0.00 H TER 99933 WAT 2563 ATOM 99933 O WAT 2564 4.838 50.484 72.859 1.00 0.00 O ATOM 99934 H1 WAT 2564 4.294 50.609 72.082 1.00 0.00 H ATOM 99935 H2 WAT 2564 4.348 49.863 73.398 1.00 0.00 H TER 99937 WAT 2564 ATOM 99937 O WAT 2565 38.707 52.341 132.797 1.00 0.00 O ATOM 99938 H1 WAT 2565 38.891 53.144 133.284 1.00 0.00 H ATOM 99939 H2 WAT 2565 38.225 51.791 133.416 1.00 0.00 H TER 99941 WAT 2565 ATOM 99941 O WAT 2566 1.133 130.869 68.483 1.00 0.00 O ATOM 99942 H1 WAT 2566 0.286 130.586 68.137 1.00 0.00 H ATOM 99943 H2 WAT 2566 1.483 130.093 68.921 1.00 0.00 H TER 99945 WAT 2566 ATOM 99945 O WAT 2567 99.441 107.112 122.670 1.00 0.00 O ATOM 99946 H1 WAT 2567 99.564 107.599 123.485 1.00 0.00 H ATOM 99947 H2 WAT 2567 100.004 106.343 122.763 1.00 0.00 H TER 99949 WAT 2567 ATOM 99949 O WAT 2568 60.142 121.555 155.348 1.00 0.00 O ATOM 99950 H1 WAT 2568 60.966 121.151 155.617 1.00 0.00 H ATOM 99951 H2 WAT 2568 59.949 122.189 156.038 1.00 0.00 H TER 99953 WAT 2568 ATOM 99953 O WAT 2569 83.945 127.954 156.377 1.00 0.00 O ATOM 99954 H1 WAT 2569 83.233 127.613 155.835 1.00 0.00 H ATOM 99955 H2 WAT 2569 84.303 128.684 155.872 1.00 0.00 H TER 99957 WAT 2569 ATOM 99957 O WAT 2570 131.351 74.127 105.553 1.00 0.00 O ATOM 99958 H1 WAT 2570 131.576 74.636 106.331 1.00 0.00 H ATOM 99959 H2 WAT 2570 132.099 74.242 104.967 1.00 0.00 H TER 99961 WAT 2570 ATOM 99961 O WAT 2571 99.001 44.995 89.304 1.00 0.00 O ATOM 99962 H1 WAT 2571 98.104 45.295 89.454 1.00 0.00 H ATOM 99963 H2 WAT 2571 99.210 44.469 90.076 1.00 0.00 H TER 99965 WAT 2571 ATOM 99965 O WAT 2572 27.668 100.568 55.840 1.00 0.00 O ATOM 99966 H1 WAT 2572 27.282 99.692 55.851 1.00 0.00 H ATOM 99967 H2 WAT 2572 28.500 100.457 55.380 1.00 0.00 H TER 99969 WAT 2572 ATOM 99969 O WAT 2573 34.081 106.412 76.724 1.00 0.00 O ATOM 99970 H1 WAT 2573 33.199 106.700 76.489 1.00 0.00 H ATOM 99971 H2 WAT 2573 34.385 107.063 77.357 1.00 0.00 H TER 99973 WAT 2573 ATOM 99973 O WAT 2574 90.017 93.191 84.089 1.00 0.00 O ATOM 99974 H1 WAT 2574 90.817 93.130 83.567 1.00 0.00 H ATOM 99975 H2 WAT 2574 90.257 93.750 84.829 1.00 0.00 H TER 99977 WAT 2574 ATOM 99977 O WAT 2575 13.652 72.390 19.224 1.00 0.00 O ATOM 99978 H1 WAT 2575 13.752 71.442 19.142 1.00 0.00 H ATOM 99979 H2 WAT 2575 13.834 72.571 20.146 1.00 0.00 H TER 99981 WAT 2575 ATOM 99981 O WAT 2576 23.255 138.742 154.844 1.00 0.00 O ATOM 99982 H1 WAT 2576 23.700 138.128 155.429 1.00 0.00 H ATOM 99983 H2 WAT 2576 22.832 139.368 155.431 1.00 0.00 H TER 99985 WAT 2576 ATOM 99985 O WAT 2577 31.456 27.364 145.141 1.00 0.00 O ATOM 99986 H1 WAT 2577 31.329 27.144 146.064 1.00 0.00 H ATOM 99987 H2 WAT 2577 31.407 28.320 145.114 1.00 0.00 H TER 99989 WAT 2577 ATOM 99989 O WAT 2578 134.594 121.765 148.273 1.00 0.00 O ATOM 99990 H1 WAT 2578 135.550 121.784 148.306 1.00 0.00 H ATOM 99991 H2 WAT 2578 134.390 121.103 147.612 1.00 0.00 H TER 99993 WAT 2578 ATOM 99993 O WAT 2579 51.593 133.665 135.654 1.00 0.00 O ATOM 99994 H1 WAT 2579 51.749 133.815 136.587 1.00 0.00 H ATOM 99995 H2 WAT 2579 52.344 134.066 135.218 1.00 0.00 H TER 99997 WAT 2579 ATOM 99997 O WAT 2580 103.091 139.671 62.116 1.00 0.00 O ATOM 99998 H1 WAT 2580 103.490 140.288 62.730 1.00 0.00 H ATOM 99999 H2 WAT 2580 103.563 138.851 62.261 1.00 0.00 H TER 1 WAT 2580 ATOM 1 O WAT 2581 25.331 97.476 156.122 1.00 0.00 O ATOM 2 H1 WAT 2581 25.655 96.928 155.407 1.00 0.00 H ATOM 3 H2 WAT 2581 24.703 98.066 155.706 1.00 0.00 H TER 5 WAT 2581 ATOM 5 O WAT 2582 67.860 118.044 9.995 1.00 0.00 O ATOM 6 H1 WAT 2582 68.458 117.297 10.038 1.00 0.00 H ATOM 7 H2 WAT 2582 68.201 118.661 10.643 1.00 0.00 H TER 9 WAT 2582 ATOM 9 O WAT 2583 45.179 131.909 135.179 1.00 0.00 O ATOM 10 H1 WAT 2583 45.174 132.385 134.348 1.00 0.00 H ATOM 11 H2 WAT 2583 45.715 132.449 135.760 1.00 0.00 H TER 13 WAT 2583 ATOM 13 O WAT 2584 28.068 66.418 2.515 1.00 0.00 O ATOM 14 H1 WAT 2584 27.932 66.409 3.462 1.00 0.00 H ATOM 15 H2 WAT 2584 27.277 66.016 2.156 1.00 0.00 H TER 17 WAT 2584 ATOM 17 O WAT 2585 140.464 91.087 127.629 1.00 0.00 O ATOM 18 H1 WAT 2585 140.833 91.711 127.005 1.00 0.00 H ATOM 19 H2 WAT 2585 140.431 90.259 127.149 1.00 0.00 H TER 21 WAT 2585 ATOM 21 O WAT 2586 92.514 60.843 93.645 1.00 0.00 O ATOM 22 H1 WAT 2586 92.995 60.457 92.913 1.00 0.00 H ATOM 23 H2 WAT 2586 92.676 61.783 93.569 1.00 0.00 H TER 25 WAT 2586 ATOM 25 O WAT 2587 68.905 59.442 131.464 1.00 0.00 O ATOM 26 H1 WAT 2587 68.607 60.069 130.806 1.00 0.00 H ATOM 27 H2 WAT 2587 69.861 59.478 131.415 1.00 0.00 H TER 29 WAT 2587 ATOM 29 O WAT 2588 33.725 107.550 68.664 1.00 0.00 O ATOM 30 H1 WAT 2588 33.375 107.760 69.530 1.00 0.00 H ATOM 31 H2 WAT 2588 34.525 107.056 68.843 1.00 0.00 H TER 33 WAT 2588 ATOM 33 O WAT 2589 141.828 25.733 99.700 1.00 0.00 O ATOM 34 H1 WAT 2589 142.544 25.825 100.329 1.00 0.00 H ATOM 35 H2 WAT 2589 141.205 26.417 99.946 1.00 0.00 H TER 37 WAT 2589 ATOM 37 O WAT 2590 48.581 9.193 15.297 1.00 0.00 O ATOM 38 H1 WAT 2590 47.844 8.930 14.745 1.00 0.00 H ATOM 39 H2 WAT 2590 49.356 8.999 14.769 1.00 0.00 H TER 41 WAT 2590 ATOM 41 O WAT 2591 132.576 124.945 156.488 1.00 0.00 O ATOM 42 H1 WAT 2591 131.850 124.616 155.958 1.00 0.00 H ATOM 43 H2 WAT 2591 132.295 125.816 156.766 1.00 0.00 H TER 45 WAT 2591 ATOM 45 O WAT 2592 29.254 74.545 17.120 1.00 0.00 O ATOM 46 H1 WAT 2592 29.151 75.234 16.465 1.00 0.00 H ATOM 47 H2 WAT 2592 28.573 74.726 17.768 1.00 0.00 H TER 49 WAT 2592 ATOM 49 O WAT 2593 129.446 49.978 94.842 1.00 0.00 O ATOM 50 H1 WAT 2593 128.856 49.225 94.842 1.00 0.00 H ATOM 51 H2 WAT 2593 129.006 50.628 94.295 1.00 0.00 H TER 53 WAT 2593 ATOM 53 O WAT 2594 58.644 36.784 104.911 1.00 0.00 O ATOM 54 H1 WAT 2594 59.120 36.137 104.390 1.00 0.00 H ATOM 55 H2 WAT 2594 58.860 37.623 104.506 1.00 0.00 H TER 57 WAT 2594 ATOM 57 O WAT 2595 44.516 31.370 98.213 1.00 0.00 O ATOM 58 H1 WAT 2595 45.097 31.057 97.520 1.00 0.00 H ATOM 59 H2 WAT 2595 44.972 31.151 99.025 1.00 0.00 H TER 61 WAT 2595 ATOM 61 O WAT 2596 62.717 20.364 70.399 1.00 0.00 O ATOM 62 H1 WAT 2596 61.850 20.097 70.705 1.00 0.00 H ATOM 63 H2 WAT 2596 63.010 21.010 71.041 1.00 0.00 H TER 65 WAT 2596 ATOM 65 O WAT 2597 130.502 72.220 138.883 1.00 0.00 O ATOM 66 H1 WAT 2597 130.846 72.969 138.397 1.00 0.00 H ATOM 67 H2 WAT 2597 130.534 72.494 139.800 1.00 0.00 H TER 69 WAT 2597 ATOM 69 O WAT 2598 36.985 91.079 9.493 1.00 0.00 O ATOM 70 H1 WAT 2598 36.235 91.060 10.087 1.00 0.00 H ATOM 71 H2 WAT 2598 36.899 91.910 9.026 1.00 0.00 H TER 73 WAT 2598 ATOM 73 O WAT 2599 21.724 83.407 71.021 1.00 0.00 O ATOM 74 H1 WAT 2599 22.592 83.004 71.037 1.00 0.00 H ATOM 75 H2 WAT 2599 21.328 83.090 70.209 1.00 0.00 H TER 77 WAT 2599 ATOM 77 O WAT 2600 8.286 71.250 15.872 1.00 0.00 O ATOM 78 H1 WAT 2600 8.747 71.007 16.675 1.00 0.00 H ATOM 79 H2 WAT 2600 7.919 72.113 16.059 1.00 0.00 H TER 81 WAT 2600 ATOM 81 O WAT 2601 12.011 144.192 152.060 1.00 0.00 O ATOM 82 H1 WAT 2601 11.989 144.530 152.955 1.00 0.00 H ATOM 83 H2 WAT 2601 11.092 144.159 151.794 1.00 0.00 H TER 85 WAT 2601 ATOM 85 O WAT 2602 79.741 128.574 68.588 1.00 0.00 O ATOM 86 H1 WAT 2602 79.873 127.832 67.998 1.00 0.00 H ATOM 87 H2 WAT 2602 78.803 128.563 68.780 1.00 0.00 H TER 89 WAT 2602 ATOM 89 O WAT 2603 142.914 39.744 102.263 1.00 0.00 O ATOM 90 H1 WAT 2603 142.546 40.355 102.902 1.00 0.00 H ATOM 91 H2 WAT 2603 142.864 40.211 101.429 1.00 0.00 H TER 93 WAT 2603 ATOM 93 O WAT 2604 12.480 60.138 99.409 1.00 0.00 O ATOM 94 H1 WAT 2604 12.627 60.399 100.318 1.00 0.00 H ATOM 95 H2 WAT 2604 12.959 60.786 98.893 1.00 0.00 H TER 97 WAT 2604 ATOM 97 O WAT 2605 103.016 80.786 91.011 1.00 0.00 O ATOM 98 H1 WAT 2605 103.716 80.792 90.359 1.00 0.00 H ATOM 99 H2 WAT 2605 102.402 81.456 90.710 1.00 0.00 H TER 101 WAT 2605 ATOM 101 O WAT 2606 46.138 89.027 88.594 1.00 0.00 O ATOM 102 H1 WAT 2606 47.005 89.124 88.200 1.00 0.00 H ATOM 103 H2 WAT 2606 46.306 88.980 89.535 1.00 0.00 H TER 105 WAT 2606 ATOM 105 O WAT 2607 118.712 93.434 76.436 1.00 0.00 O ATOM 106 H1 WAT 2607 118.594 94.382 76.376 1.00 0.00 H ATOM 107 H2 WAT 2607 117.826 93.077 76.375 1.00 0.00 H TER 109 WAT 2607 ATOM 109 O WAT 2608 77.432 76.051 142.214 1.00 0.00 O ATOM 110 H1 WAT 2608 77.618 75.627 141.376 1.00 0.00 H ATOM 111 H2 WAT 2608 76.536 75.786 142.423 1.00 0.00 H TER 113 WAT 2608 ATOM 113 O WAT 2609 132.903 64.640 62.345 1.00 0.00 O ATOM 114 H1 WAT 2609 133.418 65.331 61.929 1.00 0.00 H ATOM 115 H2 WAT 2609 131.994 64.877 62.162 1.00 0.00 H TER 117 WAT 2609 ATOM 117 O WAT 2610 71.005 119.888 147.331 1.00 0.00 O ATOM 118 H1 WAT 2610 70.706 120.085 148.218 1.00 0.00 H ATOM 119 H2 WAT 2610 70.220 119.969 146.789 1.00 0.00 H TER 121 WAT 2610 ATOM 121 O WAT 2611 126.423 70.521 10.202 1.00 0.00 O ATOM 122 H1 WAT 2611 126.784 69.951 9.523 1.00 0.00 H ATOM 123 H2 WAT 2611 125.760 71.043 9.749 1.00 0.00 H TER 125 WAT 2611 ATOM 125 O WAT 2612 4.561 112.826 64.114 1.00 0.00 O ATOM 126 H1 WAT 2612 4.457 112.077 63.528 1.00 0.00 H ATOM 127 H2 WAT 2612 4.097 113.539 63.675 1.00 0.00 H TER 129 WAT 2612 ATOM 129 O WAT 2613 24.311 81.349 84.331 1.00 0.00 O ATOM 130 H1 WAT 2613 23.513 80.821 84.319 1.00 0.00 H ATOM 131 H2 WAT 2613 24.415 81.605 85.247 1.00 0.00 H TER 133 WAT 2613 ATOM 133 O WAT 2614 12.411 15.215 92.340 1.00 0.00 O ATOM 134 H1 WAT 2614 11.875 16.000 92.229 1.00 0.00 H ATOM 135 H2 WAT 2614 11.820 14.576 92.740 1.00 0.00 H TER 137 WAT 2614 ATOM 137 O WAT 2615 114.973 7.203 148.542 1.00 0.00 O ATOM 138 H1 WAT 2615 115.100 7.711 149.343 1.00 0.00 H ATOM 139 H2 WAT 2615 114.509 6.417 148.828 1.00 0.00 H TER 141 WAT 2615 ATOM 141 O WAT 2616 5.660 126.640 73.030 1.00 0.00 O ATOM 142 H1 WAT 2616 5.370 127.549 72.957 1.00 0.00 H ATOM 143 H2 WAT 2616 6.607 126.699 73.152 1.00 0.00 H TER 145 WAT 2616 ATOM 145 O WAT 2617 40.095 1.782 107.016 1.00 0.00 O ATOM 146 H1 WAT 2617 40.777 1.207 106.668 1.00 0.00 H ATOM 147 H2 WAT 2617 40.180 2.588 106.506 1.00 0.00 H TER 149 WAT 2617 ATOM 149 O WAT 2618 13.010 12.462 115.964 1.00 0.00 O ATOM 150 H1 WAT 2618 13.294 13.087 115.297 1.00 0.00 H ATOM 151 H2 WAT 2618 12.222 12.854 116.340 1.00 0.00 H TER 153 WAT 2618 ATOM 153 O WAT 2619 35.197 0.080 143.868 1.00 0.00 O ATOM 154 H1 WAT 2619 34.341 0.485 143.731 1.00 0.00 H ATOM 155 H2 WAT 2619 35.086 -0.453 144.655 1.00 0.00 H TER 157 WAT 2619 ATOM 157 O WAT 2620 48.262 7.085 69.489 1.00 0.00 O ATOM 158 H1 WAT 2620 48.823 7.821 69.737 1.00 0.00 H ATOM 159 H2 WAT 2620 47.581 7.476 68.943 1.00 0.00 H TER 161 WAT 2620 ATOM 161 O WAT 2621 78.945 75.460 56.535 1.00 0.00 O ATOM 162 H1 WAT 2621 78.051 75.224 56.785 1.00 0.00 H ATOM 163 H2 WAT 2621 79.325 74.645 56.207 1.00 0.00 H TER 165 WAT 2621 ATOM 165 O WAT 2622 46.717 118.953 86.906 1.00 0.00 O ATOM 166 H1 WAT 2622 46.116 118.346 87.340 1.00 0.00 H ATOM 167 H2 WAT 2622 47.560 118.500 86.912 1.00 0.00 H TER 169 WAT 2622 ATOM 169 O WAT 2623 32.978 117.111 22.093 1.00 0.00 O ATOM 170 H1 WAT 2623 32.178 117.615 22.244 1.00 0.00 H ATOM 171 H2 WAT 2623 32.670 116.264 21.770 1.00 0.00 H TER 173 WAT 2623 ATOM 173 O WAT 2624 27.366 139.072 73.615 1.00 0.00 O ATOM 174 H1 WAT 2624 28.169 138.567 73.738 1.00 0.00 H ATOM 175 H2 WAT 2624 27.414 139.764 74.275 1.00 0.00 H TER 177 WAT 2624 ATOM 177 O WAT 2625 126.199 133.887 89.783 1.00 0.00 O ATOM 178 H1 WAT 2625 127.100 133.808 89.471 1.00 0.00 H ATOM 179 H2 WAT 2625 126.182 133.383 90.597 1.00 0.00 H TER 181 WAT 2625 ATOM 181 O WAT 2626 145.624 7.979 92.263 1.00 0.00 O ATOM 182 H1 WAT 2626 144.980 8.657 92.059 1.00 0.00 H ATOM 183 H2 WAT 2626 146.291 8.429 92.781 1.00 0.00 H TER 185 WAT 2626 ATOM 185 O WAT 2627 118.784 49.458 156.632 1.00 0.00 O ATOM 186 H1 WAT 2627 119.526 49.145 157.149 1.00 0.00 H ATOM 187 H2 WAT 2627 118.076 49.561 157.267 1.00 0.00 H TER 189 WAT 2627 ATOM 189 O WAT 2628 63.673 42.673 64.221 1.00 0.00 O ATOM 190 H1 WAT 2628 63.743 42.008 64.906 1.00 0.00 H ATOM 191 H2 WAT 2628 62.980 42.351 63.645 1.00 0.00 H TER 193 WAT 2628 ATOM 193 O WAT 2629 68.732 62.660 144.976 1.00 0.00 O ATOM 194 H1 WAT 2629 69.307 61.897 145.029 1.00 0.00 H ATOM 195 H2 WAT 2629 69.261 63.382 145.317 1.00 0.00 H TER 197 WAT 2629 ATOM 197 O WAT 2630 63.211 124.753 8.935 1.00 0.00 O ATOM 198 H1 WAT 2630 62.788 124.198 8.280 1.00 0.00 H ATOM 199 H2 WAT 2630 62.821 125.617 8.804 1.00 0.00 H TER 201 WAT 2630 ATOM 201 O WAT 2631 26.638 52.967 88.252 1.00 0.00 O ATOM 202 H1 WAT 2631 26.655 53.461 89.072 1.00 0.00 H ATOM 203 H2 WAT 2631 27.335 53.356 87.723 1.00 0.00 H TER 205 WAT 2631 ATOM 205 O WAT 2632 21.264 126.621 94.618 1.00 0.00 O ATOM 206 H1 WAT 2632 21.775 127.365 94.302 1.00 0.00 H ATOM 207 H2 WAT 2632 20.887 126.923 95.444 1.00 0.00 H TER 209 WAT 2632 ATOM 209 O WAT 2633 116.543 46.562 90.749 1.00 0.00 O ATOM 210 H1 WAT 2633 117.294 46.664 90.164 1.00 0.00 H ATOM 211 H2 WAT 2633 115.825 47.005 90.297 1.00 0.00 H TER 213 WAT 2633 ATOM 213 O WAT 2634 138.970 145.933 62.685 1.00 0.00 O ATOM 214 H1 WAT 2634 139.124 145.017 62.451 1.00 0.00 H ATOM 215 H2 WAT 2634 139.819 146.357 62.564 1.00 0.00 H TER 217 WAT 2634 ATOM 217 O WAT 2635 106.842 76.290 118.381 1.00 0.00 O ATOM 218 H1 WAT 2635 105.972 76.585 118.111 1.00 0.00 H ATOM 219 H2 WAT 2635 107.435 76.974 118.069 1.00 0.00 H TER 221 WAT 2635 ATOM 221 O WAT 2636 43.822 75.798 149.303 1.00 0.00 O ATOM 222 H1 WAT 2636 43.210 76.129 148.645 1.00 0.00 H ATOM 223 H2 WAT 2636 43.341 75.100 149.747 1.00 0.00 H TER 225 WAT 2636 ATOM 225 O WAT 2637 76.018 131.978 66.558 1.00 0.00 O ATOM 226 H1 WAT 2637 76.402 131.909 65.683 1.00 0.00 H ATOM 227 H2 WAT 2637 75.140 132.330 66.407 1.00 0.00 H TER 229 WAT 2637 ATOM 229 O WAT 2638 1.150 36.764 154.850 1.00 0.00 O ATOM 230 H1 WAT 2638 1.419 36.840 155.766 1.00 0.00 H ATOM 231 H2 WAT 2638 1.216 37.655 154.507 1.00 0.00 H TER 233 WAT 2638 ATOM 233 O WAT 2639 127.279 78.562 78.886 1.00 0.00 O ATOM 234 H1 WAT 2639 126.495 78.053 78.682 1.00 0.00 H ATOM 235 H2 WAT 2639 127.367 78.495 79.837 1.00 0.00 H TER 237 WAT 2639 ATOM 237 O WAT 2640 74.387 72.268 65.806 1.00 0.00 O ATOM 238 H1 WAT 2640 75.021 71.686 65.387 1.00 0.00 H ATOM 239 H2 WAT 2640 74.354 73.036 65.237 1.00 0.00 H TER 241 WAT 2640 ATOM 241 O WAT 2641 99.772 37.031 148.463 1.00 0.00 O ATOM 242 H1 WAT 2641 99.065 37.072 149.107 1.00 0.00 H ATOM 243 H2 WAT 2641 99.339 36.779 147.648 1.00 0.00 H TER 245 WAT 2641 ATOM 245 O WAT 2642 66.348 60.504 7.051 1.00 0.00 O ATOM 246 H1 WAT 2642 66.504 61.340 7.490 1.00 0.00 H ATOM 247 H2 WAT 2642 65.699 60.705 6.377 1.00 0.00 H TER 249 WAT 2642 ATOM 249 O WAT 2643 138.382 24.476 9.943 1.00 0.00 O ATOM 250 H1 WAT 2643 138.259 25.360 10.287 1.00 0.00 H ATOM 251 H2 WAT 2643 137.807 23.928 10.477 1.00 0.00 H TER 253 WAT 2643 ATOM 253 O WAT 2644 19.949 129.778 130.152 1.00 0.00 O ATOM 254 H1 WAT 2644 20.259 130.173 129.337 1.00 0.00 H ATOM 255 H2 WAT 2644 20.010 128.835 129.999 1.00 0.00 H TER 257 WAT 2644 ATOM 257 O WAT 2645 126.961 33.011 148.102 1.00 0.00 O ATOM 258 H1 WAT 2645 126.998 33.585 148.867 1.00 0.00 H ATOM 259 H2 WAT 2645 126.469 32.246 148.399 1.00 0.00 H TER 261 WAT 2645 ATOM 261 O WAT 2646 139.858 44.307 95.845 1.00 0.00 O ATOM 262 H1 WAT 2646 139.206 43.659 95.580 1.00 0.00 H ATOM 263 H2 WAT 2646 139.840 44.288 96.802 1.00 0.00 H TER 265 WAT 2646 ATOM 265 O WAT 2647 34.947 111.797 127.196 1.00 0.00 O ATOM 266 H1 WAT 2647 34.521 111.443 126.415 1.00 0.00 H ATOM 267 H2 WAT 2647 35.377 112.596 126.892 1.00 0.00 H TER 269 WAT 2647 ATOM 269 O WAT 2648 6.713 110.941 142.192 1.00 0.00 O ATOM 270 H1 WAT 2648 7.554 111.345 141.977 1.00 0.00 H ATOM 271 H2 WAT 2648 6.863 110.509 143.032 1.00 0.00 H TER 273 WAT 2648 ATOM 273 O WAT 2649 117.409 81.519 13.918 1.00 0.00 O ATOM 274 H1 WAT 2649 117.718 82.048 14.653 1.00 0.00 H ATOM 275 H2 WAT 2649 118.005 81.735 13.200 1.00 0.00 H TER 277 WAT 2649 ATOM 277 O WAT 2650 4.575 93.304 19.540 1.00 0.00 O ATOM 278 H1 WAT 2650 5.029 92.769 20.191 1.00 0.00 H ATOM 279 H2 WAT 2650 5.275 93.663 18.995 1.00 0.00 H TER 281 WAT 2650 ATOM 281 O WAT 2651 82.012 22.066 89.560 1.00 0.00 O ATOM 282 H1 WAT 2651 82.298 21.991 90.470 1.00 0.00 H ATOM 283 H2 WAT 2651 81.766 22.986 89.462 1.00 0.00 H TER 285 WAT 2651 ATOM 285 O WAT 2652 118.619 28.950 64.063 1.00 0.00 O ATOM 286 H1 WAT 2652 119.224 28.804 64.791 1.00 0.00 H ATOM 287 H2 WAT 2652 118.796 29.848 63.782 1.00 0.00 H TER 289 WAT 2652 ATOM 289 O WAT 2653 68.884 72.149 104.231 1.00 0.00 O ATOM 290 H1 WAT 2653 68.331 71.378 104.357 1.00 0.00 H ATOM 291 H2 WAT 2653 69.164 72.096 103.317 1.00 0.00 H TER 293 WAT 2653 ATOM 293 O WAT 2654 132.750 36.804 153.664 1.00 0.00 O ATOM 294 H1 WAT 2654 132.693 37.664 154.081 1.00 0.00 H ATOM 295 H2 WAT 2654 132.613 36.182 154.378 1.00 0.00 H TER 297 WAT 2654 ATOM 297 O WAT 2655 85.543 110.863 144.678 1.00 0.00 O ATOM 298 H1 WAT 2655 84.717 111.346 144.676 1.00 0.00 H ATOM 299 H2 WAT 2655 85.911 111.014 143.807 1.00 0.00 H TER 301 WAT 2655 ATOM 301 O WAT 2656 79.763 6.772 69.366 1.00 0.00 O ATOM 302 H1 WAT 2656 80.555 6.235 69.369 1.00 0.00 H ATOM 303 H2 WAT 2656 79.734 7.161 70.240 1.00 0.00 H TER 305 WAT 2656 ATOM 305 O WAT 2657 18.786 12.650 158.336 1.00 0.00 O ATOM 306 H1 WAT 2657 18.307 12.122 157.698 1.00 0.00 H ATOM 307 H2 WAT 2657 18.808 13.527 157.954 1.00 0.00 H TER 309 WAT 2657 ATOM 309 O WAT 2658 48.558 13.495 85.167 1.00 0.00 O ATOM 310 H1 WAT 2658 49.219 14.083 84.801 1.00 0.00 H ATOM 311 H2 WAT 2658 48.896 12.616 84.993 1.00 0.00 H TER 313 WAT 2658 ATOM 313 O WAT 2659 64.698 39.521 126.118 1.00 0.00 O ATOM 314 H1 WAT 2659 65.608 39.231 126.056 1.00 0.00 H ATOM 315 H2 WAT 2659 64.756 40.444 126.364 1.00 0.00 H TER 317 WAT 2659 ATOM 317 O WAT 2660 34.053 113.799 5.731 1.00 0.00 O ATOM 318 H1 WAT 2660 33.347 113.154 5.720 1.00 0.00 H ATOM 319 H2 WAT 2660 34.816 113.326 5.398 1.00 0.00 H TER 321 WAT 2660 ATOM 321 O WAT 2661 125.891 83.068 95.414 1.00 0.00 O ATOM 322 H1 WAT 2661 125.133 82.572 95.724 1.00 0.00 H ATOM 323 H2 WAT 2661 125.527 83.699 94.794 1.00 0.00 H TER 325 WAT 2661 ATOM 325 O WAT 2662 65.148 93.778 107.990 1.00 0.00 O ATOM 326 H1 WAT 2662 65.539 94.245 108.729 1.00 0.00 H ATOM 327 H2 WAT 2662 65.564 94.162 107.218 1.00 0.00 H TER 329 WAT 2662 ATOM 329 O WAT 2663 42.882 23.066 106.440 1.00 0.00 O ATOM 330 H1 WAT 2663 43.443 22.352 106.743 1.00 0.00 H ATOM 331 H2 WAT 2663 42.345 23.288 107.201 1.00 0.00 H TER 333 WAT 2663 ATOM 333 O WAT 2664 131.751 98.222 129.451 1.00 0.00 O ATOM 334 H1 WAT 2664 132.069 97.378 129.131 1.00 0.00 H ATOM 335 H2 WAT 2664 131.908 98.828 128.727 1.00 0.00 H TER 337 WAT 2664 ATOM 337 O WAT 2665 24.278 136.714 74.245 1.00 0.00 O ATOM 338 H1 WAT 2665 25.194 136.450 74.331 1.00 0.00 H ATOM 339 H2 WAT 2665 24.305 137.496 73.694 1.00 0.00 H TER 341 WAT 2665 ATOM 341 O WAT 2666 144.200 82.583 56.855 1.00 0.00 O ATOM 342 H1 WAT 2666 143.604 81.834 56.880 1.00 0.00 H ATOM 343 H2 WAT 2666 144.378 82.715 55.924 1.00 0.00 H TER 345 WAT 2666 ATOM 345 O WAT 2667 40.091 71.655 107.164 1.00 0.00 O ATOM 346 H1 WAT 2667 39.558 70.875 107.011 1.00 0.00 H ATOM 347 H2 WAT 2667 40.203 72.043 106.296 1.00 0.00 H TER 349 WAT 2667 ATOM 349 O WAT 2668 98.567 88.415 147.336 1.00 0.00 O ATOM 350 H1 WAT 2668 98.961 87.786 147.940 1.00 0.00 H ATOM 351 H2 WAT 2668 97.942 88.903 147.873 1.00 0.00 H TER 353 WAT 2668 ATOM 353 O WAT 2669 48.083 145.171 137.580 1.00 0.00 O ATOM 354 H1 WAT 2669 48.742 144.838 138.188 1.00 0.00 H ATOM 355 H2 WAT 2669 47.354 145.438 138.140 1.00 0.00 H TER 357 WAT 2669 ATOM 357 O WAT 2670 66.525 128.457 111.282 1.00 0.00 O ATOM 358 H1 WAT 2670 67.192 127.798 111.475 1.00 0.00 H ATOM 359 H2 WAT 2670 65.718 128.096 111.650 1.00 0.00 H TER 361 WAT 2670 ATOM 361 O WAT 2671 40.922 117.431 88.409 1.00 0.00 O ATOM 362 H1 WAT 2671 40.502 117.417 89.269 1.00 0.00 H ATOM 363 H2 WAT 2671 41.569 118.134 88.469 1.00 0.00 H TER 365 WAT 2671 ATOM 365 O WAT 2672 120.506 62.028 121.179 1.00 0.00 O ATOM 366 H1 WAT 2672 120.681 62.092 122.118 1.00 0.00 H ATOM 367 H2 WAT 2672 121.306 61.653 120.811 1.00 0.00 H TER 369 WAT 2672 ATOM 369 O WAT 2673 7.861 87.375 136.410 1.00 0.00 O ATOM 370 H1 WAT 2673 6.926 87.242 136.567 1.00 0.00 H ATOM 371 H2 WAT 2673 8.276 86.588 136.763 1.00 0.00 H TER 373 WAT 2673 ATOM 373 O WAT 2674 118.152 95.537 59.626 1.00 0.00 O ATOM 374 H1 WAT 2674 119.094 95.409 59.744 1.00 0.00 H ATOM 375 H2 WAT 2674 117.795 94.650 59.570 1.00 0.00 H TER 377 WAT 2674 ATOM 377 O WAT 2675 17.430 124.411 119.606 1.00 0.00 O ATOM 378 H1 WAT 2675 17.133 124.710 118.747 1.00 0.00 H ATOM 379 H2 WAT 2675 17.096 125.068 120.217 1.00 0.00 H TER 381 WAT 2675 ATOM 381 O WAT 2676 86.687 30.209 155.535 1.00 0.00 O ATOM 382 H1 WAT 2676 87.025 30.830 154.889 1.00 0.00 H ATOM 383 H2 WAT 2676 85.770 30.083 155.289 1.00 0.00 H TER 385 WAT 2676 ATOM 385 O WAT 2677 12.276 11.036 135.097 1.00 0.00 O ATOM 386 H1 WAT 2677 11.762 11.517 134.449 1.00 0.00 H ATOM 387 H2 WAT 2677 13.045 11.585 135.250 1.00 0.00 H TER 389 WAT 2677 ATOM 389 O WAT 2678 134.944 107.185 136.247 1.00 0.00 O ATOM 390 H1 WAT 2678 135.857 107.469 136.302 1.00 0.00 H ATOM 391 H2 WAT 2678 134.990 106.304 135.875 1.00 0.00 H TER 393 WAT 2678 ATOM 393 O WAT 2679 26.280 114.177 15.479 1.00 0.00 O ATOM 394 H1 WAT 2679 26.782 114.918 15.141 1.00 0.00 H ATOM 395 H2 WAT 2679 26.408 114.212 16.427 1.00 0.00 H TER 397 WAT 2679 ATOM 397 O WAT 2680 102.373 77.091 0.583 1.00 0.00 O ATOM 398 H1 WAT 2680 102.293 76.160 0.372 1.00 0.00 H ATOM 399 H2 WAT 2680 103.253 77.328 0.288 1.00 0.00 H TER 401 WAT 2680 ATOM 401 O WAT 2681 71.679 4.912 17.084 1.00 0.00 O ATOM 402 H1 WAT 2681 72.605 4.994 16.858 1.00 0.00 H ATOM 403 H2 WAT 2681 71.296 4.426 16.353 1.00 0.00 H TER 405 WAT 2681 ATOM 405 O WAT 2682 120.020 74.603 122.995 1.00 0.00 O ATOM 406 H1 WAT 2682 120.121 75.182 123.751 1.00 0.00 H ATOM 407 H2 WAT 2682 119.121 74.747 122.701 1.00 0.00 H TER 409 WAT 2682 ATOM 409 O WAT 2683 21.867 96.277 69.202 1.00 0.00 O ATOM 410 H1 WAT 2683 22.722 96.003 68.870 1.00 0.00 H ATOM 411 H2 WAT 2683 21.709 97.125 68.787 1.00 0.00 H TER 413 WAT 2683 ATOM 413 O WAT 2684 33.795 14.502 90.600 1.00 0.00 O ATOM 414 H1 WAT 2684 33.616 15.350 90.193 1.00 0.00 H ATOM 415 H2 WAT 2684 34.620 14.217 90.208 1.00 0.00 H TER 417 WAT 2684 ATOM 417 O WAT 2685 54.016 18.185 95.902 1.00 0.00 O ATOM 418 H1 WAT 2685 53.501 18.345 95.111 1.00 0.00 H ATOM 419 H2 WAT 2685 54.626 17.491 95.654 1.00 0.00 H TER 421 WAT 2685 ATOM 421 O WAT 2686 121.083 72.463 101.154 1.00 0.00 O ATOM 422 H1 WAT 2686 121.831 73.051 101.266 1.00 0.00 H ATOM 423 H2 WAT 2686 121.474 71.618 100.933 1.00 0.00 H TER 425 WAT 2686 ATOM 425 O WAT 2687 13.489 82.630 121.176 1.00 0.00 O ATOM 426 H1 WAT 2687 13.856 81.750 121.091 1.00 0.00 H ATOM 427 H2 WAT 2687 14.029 83.051 121.845 1.00 0.00 H TER 429 WAT 2687 ATOM 429 O WAT 2688 58.722 107.790 130.256 1.00 0.00 O ATOM 430 H1 WAT 2688 58.761 107.563 129.327 1.00 0.00 H ATOM 431 H2 WAT 2688 58.096 108.513 130.301 1.00 0.00 H TER 433 WAT 2688 ATOM 433 O WAT 2689 75.074 139.101 122.908 1.00 0.00 O ATOM 434 H1 WAT 2689 74.652 139.255 123.753 1.00 0.00 H ATOM 435 H2 WAT 2689 75.960 138.817 123.131 1.00 0.00 H TER 437 WAT 2689 ATOM 437 O WAT 2690 14.648 84.376 118.122 1.00 0.00 O ATOM 438 H1 WAT 2690 13.904 83.775 118.087 1.00 0.00 H ATOM 439 H2 WAT 2690 14.264 85.219 118.364 1.00 0.00 H TER 441 WAT 2690 ATOM 441 O WAT 2691 124.998 80.219 114.677 1.00 0.00 O ATOM 442 H1 WAT 2691 125.039 79.882 113.782 1.00 0.00 H ATOM 443 H2 WAT 2691 124.781 81.145 114.574 1.00 0.00 H TER 445 WAT 2691 ATOM 445 O WAT 2692 101.498 110.558 86.033 1.00 0.00 O ATOM 446 H1 WAT 2692 101.379 110.024 86.819 1.00 0.00 H ATOM 447 H2 WAT 2692 102.138 110.075 85.510 1.00 0.00 H TER 449 WAT 2692 ATOM 449 O WAT 2693 129.000 28.208 62.328 1.00 0.00 O ATOM 450 H1 WAT 2693 129.019 27.251 62.324 1.00 0.00 H ATOM 451 H2 WAT 2693 129.638 28.464 61.663 1.00 0.00 H TER 453 WAT 2693 ATOM 453 O WAT 2694 13.828 85.381 95.183 1.00 0.00 O ATOM 454 H1 WAT 2694 13.930 85.114 96.097 1.00 0.00 H ATOM 455 H2 WAT 2694 13.303 84.686 94.787 1.00 0.00 H TER 457 WAT 2694 ATOM 457 O WAT 2695 79.518 123.732 61.400 1.00 0.00 O ATOM 458 H1 WAT 2695 78.597 123.993 61.389 1.00 0.00 H ATOM 459 H2 WAT 2695 79.865 124.045 60.564 1.00 0.00 H TER 461 WAT 2695 ATOM 461 O WAT 2696 117.076 55.337 99.346 1.00 0.00 O ATOM 462 H1 WAT 2696 116.921 54.897 100.182 1.00 0.00 H ATOM 463 H2 WAT 2696 117.618 56.093 99.571 1.00 0.00 H TER 465 WAT 2696 ATOM 465 O WAT 2697 142.671 135.418 7.193 1.00 0.00 O ATOM 466 H1 WAT 2697 142.153 136.137 7.556 1.00 0.00 H ATOM 467 H2 WAT 2697 142.407 135.373 6.274 1.00 0.00 H TER 469 WAT 2697 ATOM 469 O WAT 2698 11.353 131.676 19.574 1.00 0.00 O ATOM 470 H1 WAT 2698 11.193 132.127 18.745 1.00 0.00 H ATOM 471 H2 WAT 2698 11.099 132.310 20.244 1.00 0.00 H TER 473 WAT 2698 ATOM 473 O WAT 2699 40.033 52.563 6.706 1.00 0.00 O ATOM 474 H1 WAT 2699 39.931 53.269 7.344 1.00 0.00 H ATOM 475 H2 WAT 2699 39.878 51.763 7.208 1.00 0.00 H TER 477 WAT 2699 ATOM 477 O WAT 2700 11.570 13.923 99.053 1.00 0.00 O ATOM 478 H1 WAT 2700 12.426 14.105 99.441 1.00 0.00 H ATOM 479 H2 WAT 2700 11.150 13.322 99.669 1.00 0.00 H TER 481 WAT 2700 ATOM 481 O WAT 2701 87.740 70.224 93.315 1.00 0.00 O ATOM 482 H1 WAT 2701 88.231 69.888 92.565 1.00 0.00 H ATOM 483 H2 WAT 2701 87.197 69.488 93.595 1.00 0.00 H TER 485 WAT 2701 ATOM 485 O WAT 2702 115.179 21.305 21.532 1.00 0.00 O ATOM 486 H1 WAT 2702 115.119 20.462 21.082 1.00 0.00 H ATOM 487 H2 WAT 2702 115.483 21.914 20.859 1.00 0.00 H TER 489 WAT 2702 ATOM 489 O WAT 2703 98.160 31.723 100.280 1.00 0.00 O ATOM 490 H1 WAT 2703 97.887 32.619 100.477 1.00 0.00 H ATOM 491 H2 WAT 2703 97.709 31.187 100.931 1.00 0.00 H TER 493 WAT 2703 ATOM 493 O WAT 2704 48.711 97.338 78.342 1.00 0.00 O ATOM 494 H1 WAT 2704 48.712 98.083 78.943 1.00 0.00 H ATOM 495 H2 WAT 2704 47.818 96.997 78.385 1.00 0.00 H TER 497 WAT 2704 ATOM 497 O WAT 2705 41.685 83.695 11.514 1.00 0.00 O ATOM 498 H1 WAT 2705 41.295 84.372 10.960 1.00 0.00 H ATOM 499 H2 WAT 2705 42.548 83.539 11.129 1.00 0.00 H TER 501 WAT 2705 ATOM 501 O WAT 2706 145.079 7.586 122.303 1.00 0.00 O ATOM 502 H1 WAT 2706 144.159 7.849 122.290 1.00 0.00 H ATOM 503 H2 WAT 2706 145.373 7.784 123.192 1.00 0.00 H TER 505 WAT 2706 ATOM 505 O WAT 2707 133.044 16.385 114.069 1.00 0.00 O ATOM 506 H1 WAT 2707 133.084 16.460 115.023 1.00 0.00 H ATOM 507 H2 WAT 2707 132.853 17.273 113.767 1.00 0.00 H TER 509 WAT 2707 ATOM 509 O WAT 2708 33.154 69.204 113.557 1.00 0.00 O ATOM 510 H1 WAT 2708 32.907 69.274 112.634 1.00 0.00 H ATOM 511 H2 WAT 2708 34.111 69.200 113.549 1.00 0.00 H TER 513 WAT 2708 ATOM 513 O WAT 2709 82.687 28.299 68.915 1.00 0.00 O ATOM 514 H1 WAT 2709 82.357 28.213 69.810 1.00 0.00 H ATOM 515 H2 WAT 2709 83.227 29.089 68.934 1.00 0.00 H TER 517 WAT 2709 ATOM 517 O WAT 2710 126.185 137.008 116.715 1.00 0.00 O ATOM 518 H1 WAT 2710 125.967 136.695 117.593 1.00 0.00 H ATOM 519 H2 WAT 2710 126.740 137.773 116.865 1.00 0.00 H TER 521 WAT 2710 ATOM 521 O WAT 2711 91.455 122.939 109.477 1.00 0.00 O ATOM 522 H1 WAT 2711 92.407 123.004 109.552 1.00 0.00 H ATOM 523 H2 WAT 2711 91.313 122.382 108.712 1.00 0.00 H TER 525 WAT 2711 ATOM 525 O WAT 2712 54.858 67.112 18.933 1.00 0.00 O ATOM 526 H1 WAT 2712 55.552 67.555 19.422 1.00 0.00 H ATOM 527 H2 WAT 2712 54.646 67.715 18.220 1.00 0.00 H TER 529 WAT 2712 ATOM 529 O WAT 2713 22.414 144.125 2.568 1.00 0.00 O ATOM 530 H1 WAT 2713 21.485 143.896 2.534 1.00 0.00 H ATOM 531 H2 WAT 2713 22.695 143.856 3.443 1.00 0.00 H TER 533 WAT 2713 ATOM 533 O WAT 2714 132.182 4.251 112.376 1.00 0.00 O ATOM 534 H1 WAT 2714 131.936 3.362 112.121 1.00 0.00 H ATOM 535 H2 WAT 2714 131.950 4.307 113.303 1.00 0.00 H TER 537 WAT 2714 ATOM 537 O WAT 2715 123.099 38.418 90.396 1.00 0.00 O ATOM 538 H1 WAT 2715 123.004 38.276 91.338 1.00 0.00 H ATOM 539 H2 WAT 2715 122.211 38.605 90.091 1.00 0.00 H TER 541 WAT 2715 ATOM 541 O WAT 2716 110.870 8.851 113.148 1.00 0.00 O ATOM 542 H1 WAT 2716 111.369 9.149 113.909 1.00 0.00 H ATOM 543 H2 WAT 2716 111.535 8.540 112.534 1.00 0.00 H TER 545 WAT 2716 ATOM 545 O WAT 2717 57.381 19.008 102.626 1.00 0.00 O ATOM 546 H1 WAT 2717 58.245 19.396 102.486 1.00 0.00 H ATOM 547 H2 WAT 2717 56.766 19.677 102.323 1.00 0.00 H TER 549 WAT 2717 ATOM 549 O WAT 2718 21.052 50.274 67.307 1.00 0.00 O ATOM 550 H1 WAT 2718 21.798 49.737 67.041 1.00 0.00 H ATOM 551 H2 WAT 2718 20.711 50.634 66.488 1.00 0.00 H TER 553 WAT 2718 ATOM 553 O WAT 2719 30.720 136.666 124.742 1.00 0.00 O ATOM 554 H1 WAT 2719 31.330 136.049 124.339 1.00 0.00 H ATOM 555 H2 WAT 2719 31.262 137.419 124.979 1.00 0.00 H TER 557 WAT 2719 ATOM 557 O WAT 2720 68.915 16.887 139.893 1.00 0.00 O ATOM 558 H1 WAT 2720 68.240 16.698 139.241 1.00 0.00 H ATOM 559 H2 WAT 2720 68.595 16.475 140.695 1.00 0.00 H TER 561 WAT 2720 ATOM 561 O WAT 2721 13.182 111.107 115.547 1.00 0.00 O ATOM 562 H1 WAT 2721 13.469 111.352 116.426 1.00 0.00 H ATOM 563 H2 WAT 2721 12.838 111.918 115.172 1.00 0.00 H TER 565 WAT 2721 ATOM 565 O WAT 2722 126.907 145.595 129.717 1.00 0.00 O ATOM 566 H1 WAT 2722 126.868 145.594 130.674 1.00 0.00 H ATOM 567 H2 WAT 2722 127.681 146.118 129.510 1.00 0.00 H TER 569 WAT 2722 ATOM 569 O WAT 2723 119.561 88.296 140.232 1.00 0.00 O ATOM 570 H1 WAT 2723 118.841 88.690 140.725 1.00 0.00 H ATOM 571 H2 WAT 2723 120.229 88.981 140.194 1.00 0.00 H TER 573 WAT 2723 ATOM 573 O WAT 2724 117.894 126.512 83.246 1.00 0.00 O ATOM 574 H1 WAT 2724 117.891 126.065 82.400 1.00 0.00 H ATOM 575 H2 WAT 2724 118.111 127.420 83.035 1.00 0.00 H TER 577 WAT 2724 ATOM 577 O WAT 2725 143.809 70.431 104.894 1.00 0.00 O ATOM 578 H1 WAT 2725 144.619 70.066 104.537 1.00 0.00 H ATOM 579 H2 WAT 2725 143.667 71.234 104.394 1.00 0.00 H TER 581 WAT 2725 ATOM 581 O WAT 2726 40.301 40.085 127.242 1.00 0.00 O ATOM 582 H1 WAT 2726 40.443 39.340 126.658 1.00 0.00 H ATOM 583 H2 WAT 2726 39.437 39.928 127.624 1.00 0.00 H TER 585 WAT 2726 ATOM 585 O WAT 2727 143.042 79.557 103.384 1.00 0.00 O ATOM 586 H1 WAT 2727 143.455 79.913 104.171 1.00 0.00 H ATOM 587 H2 WAT 2727 143.302 80.158 102.686 1.00 0.00 H TER 589 WAT 2727 ATOM 589 O WAT 2728 66.533 140.304 9.458 1.00 0.00 O ATOM 590 H1 WAT 2728 66.331 139.894 8.618 1.00 0.00 H ATOM 591 H2 WAT 2728 67.201 140.958 9.252 1.00 0.00 H TER 593 WAT 2728 ATOM 593 O WAT 2729 56.986 76.449 116.309 1.00 0.00 O ATOM 594 H1 WAT 2729 56.172 76.013 116.562 1.00 0.00 H ATOM 595 H2 WAT 2729 57.443 75.807 115.766 1.00 0.00 H TER 597 WAT 2729 ATOM 597 O WAT 2730 96.174 120.211 5.129 1.00 0.00 O ATOM 598 H1 WAT 2730 96.926 120.655 4.737 1.00 0.00 H ATOM 599 H2 WAT 2730 95.490 120.265 4.461 1.00 0.00 H TER 601 WAT 2730 ATOM 601 O WAT 2731 111.874 46.877 135.882 1.00 0.00 O ATOM 602 H1 WAT 2731 112.516 46.347 135.410 1.00 0.00 H ATOM 603 H2 WAT 2731 111.662 46.360 136.660 1.00 0.00 H TER 605 WAT 2731 ATOM 605 O WAT 2732 135.458 25.313 16.735 1.00 0.00 O ATOM 606 H1 WAT 2732 135.240 25.238 17.664 1.00 0.00 H ATOM 607 H2 WAT 2732 135.666 26.239 16.611 1.00 0.00 H TER 609 WAT 2732 ATOM 609 O WAT 2733 58.492 59.853 79.787 1.00 0.00 O ATOM 610 H1 WAT 2733 59.427 59.678 79.679 1.00 0.00 H ATOM 611 H2 WAT 2733 58.456 60.724 80.182 1.00 0.00 H TER 613 WAT 2733 ATOM 613 O WAT 2734 115.468 121.965 8.514 1.00 0.00 O ATOM 614 H1 WAT 2734 115.738 122.607 7.858 1.00 0.00 H ATOM 615 H2 WAT 2734 115.576 122.418 9.351 1.00 0.00 H TER 617 WAT 2734 ATOM 617 O WAT 2735 20.459 34.393 125.583 1.00 0.00 O ATOM 618 H1 WAT 2735 19.755 33.787 125.352 1.00 0.00 H ATOM 619 H2 WAT 2735 20.399 35.090 124.930 1.00 0.00 H TER 621 WAT 2735 ATOM 621 O WAT 2736 129.755 11.835 2.622 1.00 0.00 O ATOM 622 H1 WAT 2736 130.663 12.138 2.636 1.00 0.00 H ATOM 623 H2 WAT 2736 129.317 12.421 2.004 1.00 0.00 H TER 625 WAT 2736 ATOM 625 O WAT 2737 118.297 1.686 73.755 1.00 0.00 O ATOM 626 H1 WAT 2737 118.601 2.081 72.938 1.00 0.00 H ATOM 627 H2 WAT 2737 118.507 2.334 74.427 1.00 0.00 H TER 629 WAT 2737 ATOM 629 O WAT 2738 47.613 33.642 21.438 1.00 0.00 O ATOM 630 H1 WAT 2738 47.657 34.595 21.364 1.00 0.00 H ATOM 631 H2 WAT 2738 47.039 33.373 20.720 1.00 0.00 H TER 633 WAT 2738 ATOM 633 O WAT 2739 82.379 132.116 12.329 1.00 0.00 O ATOM 634 H1 WAT 2739 82.075 132.012 11.427 1.00 0.00 H ATOM 635 H2 WAT 2739 81.756 132.726 12.724 1.00 0.00 H TER 637 WAT 2739 ATOM 637 O WAT 2740 70.613 36.881 27.091 1.00 0.00 O ATOM 638 H1 WAT 2740 70.849 37.809 27.087 1.00 0.00 H ATOM 639 H2 WAT 2740 69.938 36.808 27.765 1.00 0.00 H TER 641 WAT 2740 ATOM 641 O WAT 2741 68.969 19.582 26.355 1.00 0.00 O ATOM 642 H1 WAT 2741 69.265 19.582 25.445 1.00 0.00 H ATOM 643 H2 WAT 2741 68.796 20.503 26.550 1.00 0.00 H TER 645 WAT 2741 ATOM 645 O WAT 2742 89.325 1.565 5.561 1.00 0.00 O ATOM 646 H1 WAT 2742 88.666 0.876 5.644 1.00 0.00 H ATOM 647 H2 WAT 2742 88.880 2.359 5.859 1.00 0.00 H TER 649 WAT 2742 ATOM 649 O WAT 2743 57.440 106.011 98.496 1.00 0.00 O ATOM 650 H1 WAT 2743 57.649 106.783 97.970 1.00 0.00 H ATOM 651 H2 WAT 2743 58.147 105.394 98.307 1.00 0.00 H TER 653 WAT 2743 ATOM 653 O WAT 2744 123.077 6.353 136.695 1.00 0.00 O ATOM 654 H1 WAT 2744 122.872 7.117 136.156 1.00 0.00 H ATOM 655 H2 WAT 2744 122.230 6.063 137.032 1.00 0.00 H TER 657 WAT 2744 ATOM 657 O WAT 2745 44.758 27.312 63.362 1.00 0.00 O ATOM 658 H1 WAT 2745 45.011 28.110 62.899 1.00 0.00 H ATOM 659 H2 WAT 2745 45.118 26.602 62.829 1.00 0.00 H TER 661 WAT 2745 ATOM 661 O WAT 2746 115.564 115.929 95.534 1.00 0.00 O ATOM 662 H1 WAT 2746 115.922 116.760 95.221 1.00 0.00 H ATOM 663 H2 WAT 2746 115.644 115.978 96.487 1.00 0.00 H TER 665 WAT 2746 ATOM 665 O WAT 2747 44.826 136.924 62.976 1.00 0.00 O ATOM 666 H1 WAT 2747 45.472 137.062 63.669 1.00 0.00 H ATOM 667 H2 WAT 2747 44.815 137.749 62.491 1.00 0.00 H TER 669 WAT 2747 ATOM 669 O WAT 2748 40.045 17.773 141.957 1.00 0.00 O ATOM 670 H1 WAT 2748 39.245 18.210 142.248 1.00 0.00 H ATOM 671 H2 WAT 2748 40.254 18.188 141.120 1.00 0.00 H TER 673 WAT 2748 ATOM 673 O WAT 2749 109.172 90.615 82.301 1.00 0.00 O ATOM 674 H1 WAT 2749 109.362 91.146 81.528 1.00 0.00 H ATOM 675 H2 WAT 2749 109.886 89.978 82.336 1.00 0.00 H TER 677 WAT 2749 ATOM 677 O WAT 2750 51.681 105.091 68.660 1.00 0.00 O ATOM 678 H1 WAT 2750 52.381 104.661 69.151 1.00 0.00 H ATOM 679 H2 WAT 2750 50.874 104.754 69.048 1.00 0.00 H TER 681 WAT 2750 ATOM 681 O WAT 2751 138.172 14.714 117.014 1.00 0.00 O ATOM 682 H1 WAT 2751 138.572 15.564 116.828 1.00 0.00 H ATOM 683 H2 WAT 2751 137.914 14.767 117.934 1.00 0.00 H TER 685 WAT 2751 ATOM 685 O WAT 2752 70.462 145.527 119.982 1.00 0.00 O ATOM 686 H1 WAT 2752 70.612 144.589 119.865 1.00 0.00 H ATOM 687 H2 WAT 2752 69.562 145.587 120.303 1.00 0.00 H TER 689 WAT 2752 ATOM 689 O WAT 2753 140.277 128.817 15.920 1.00 0.00 O ATOM 690 H1 WAT 2753 140.600 128.445 16.741 1.00 0.00 H ATOM 691 H2 WAT 2753 140.802 128.392 15.242 1.00 0.00 H TER 693 WAT 2753 ATOM 693 O WAT 2754 57.027 44.448 68.775 1.00 0.00 O ATOM 694 H1 WAT 2754 56.550 44.901 69.470 1.00 0.00 H ATOM 695 H2 WAT 2754 57.174 45.119 68.108 1.00 0.00 H TER 697 WAT 2754 ATOM 697 O WAT 2755 47.701 41.967 13.228 1.00 0.00 O ATOM 698 H1 WAT 2755 47.534 41.655 14.117 1.00 0.00 H ATOM 699 H2 WAT 2755 48.554 41.597 13.001 1.00 0.00 H TER 701 WAT 2755 ATOM 701 O WAT 2756 120.997 136.065 93.593 1.00 0.00 O ATOM 702 H1 WAT 2756 120.430 135.834 94.328 1.00 0.00 H ATOM 703 H2 WAT 2756 120.420 136.048 92.830 1.00 0.00 H TER 705 WAT 2756 ATOM 705 O WAT 2757 53.979 15.524 82.038 1.00 0.00 O ATOM 706 H1 WAT 2757 54.548 15.703 81.289 1.00 0.00 H ATOM 707 H2 WAT 2757 53.991 16.334 82.547 1.00 0.00 H TER 709 WAT 2757 ATOM 709 O WAT 2758 113.987 28.149 56.982 1.00 0.00 O ATOM 710 H1 WAT 2758 114.289 27.671 56.210 1.00 0.00 H ATOM 711 H2 WAT 2758 114.653 28.822 57.122 1.00 0.00 H TER 713 WAT 2758 ATOM 713 O WAT 2759 82.837 109.682 158.123 1.00 0.00 O ATOM 714 H1 WAT 2759 82.701 110.555 158.490 1.00 0.00 H ATOM 715 H2 WAT 2759 82.065 109.185 158.395 1.00 0.00 H TER 717 WAT 2759 ATOM 717 O WAT 2760 116.369 98.902 147.925 1.00 0.00 O ATOM 718 H1 WAT 2760 116.119 98.431 147.131 1.00 0.00 H ATOM 719 H2 WAT 2760 115.598 99.423 148.148 1.00 0.00 H TER 721 WAT 2760 ATOM 721 O WAT 2761 19.281 6.327 69.719 1.00 0.00 O ATOM 722 H1 WAT 2761 18.940 6.482 70.599 1.00 0.00 H ATOM 723 H2 WAT 2761 18.829 5.537 69.423 1.00 0.00 H TER 725 WAT 2761 ATOM 725 O WAT 2762 4.997 88.620 140.042 1.00 0.00 O ATOM 726 H1 WAT 2762 4.754 89.268 140.703 1.00 0.00 H ATOM 727 H2 WAT 2762 4.843 87.776 140.466 1.00 0.00 H TER 729 WAT 2762 ATOM 729 O WAT 2763 112.032 70.881 153.761 1.00 0.00 O ATOM 730 H1 WAT 2763 112.612 71.625 153.926 1.00 0.00 H ATOM 731 H2 WAT 2763 111.388 71.214 153.137 1.00 0.00 H TER 733 WAT 2763 ATOM 733 O WAT 2764 90.278 113.124 23.018 1.00 0.00 O ATOM 734 H1 WAT 2764 89.630 113.753 22.701 1.00 0.00 H ATOM 735 H2 WAT 2764 89.910 112.268 22.796 1.00 0.00 H TER 737 WAT 2764 ATOM 737 O WAT 2765 83.787 58.896 146.784 1.00 0.00 O ATOM 738 H1 WAT 2765 84.380 59.580 147.094 1.00 0.00 H ATOM 739 H2 WAT 2765 83.001 59.368 146.507 1.00 0.00 H TER 741 WAT 2765 ATOM 741 O WAT 2766 112.710 17.153 97.859 1.00 0.00 O ATOM 742 H1 WAT 2766 113.141 16.906 97.041 1.00 0.00 H ATOM 743 H2 WAT 2766 112.072 16.457 98.014 1.00 0.00 H TER 745 WAT 2766 ATOM 745 O WAT 2767 71.808 35.621 85.403 1.00 0.00 O ATOM 746 H1 WAT 2767 71.627 34.812 85.883 1.00 0.00 H ATOM 747 H2 WAT 2767 71.021 36.152 85.524 1.00 0.00 H TER 749 WAT 2767 ATOM 749 O WAT 2768 140.164 73.342 87.872 1.00 0.00 O ATOM 750 H1 WAT 2768 140.619 74.104 88.231 1.00 0.00 H ATOM 751 H2 WAT 2768 139.939 73.596 86.978 1.00 0.00 H TER 753 WAT 2768 ATOM 753 O WAT 2769 140.156 9.056 73.687 1.00 0.00 O ATOM 754 H1 WAT 2769 140.053 9.225 74.624 1.00 0.00 H ATOM 755 H2 WAT 2769 140.779 8.331 73.642 1.00 0.00 H TER 757 WAT 2769 ATOM 757 O WAT 2770 132.397 24.636 125.235 1.00 0.00 O ATOM 758 H1 WAT 2770 132.271 24.027 125.962 1.00 0.00 H ATOM 759 H2 WAT 2770 132.783 24.103 124.540 1.00 0.00 H TER 761 WAT 2770 ATOM 761 O WAT 2771 3.651 143.488 135.138 1.00 0.00 O ATOM 762 H1 WAT 2771 3.139 143.143 135.870 1.00 0.00 H ATOM 763 H2 WAT 2771 4.428 143.869 135.547 1.00 0.00 H TER 765 WAT 2771 ATOM 765 O WAT 2772 85.289 105.121 142.650 1.00 0.00 O ATOM 766 H1 WAT 2772 85.137 104.595 141.865 1.00 0.00 H ATOM 767 H2 WAT 2772 85.163 106.025 142.361 1.00 0.00 H TER 769 WAT 2772 ATOM 769 O WAT 2773 121.473 93.627 116.745 1.00 0.00 O ATOM 770 H1 WAT 2773 121.349 92.685 116.623 1.00 0.00 H ATOM 771 H2 WAT 2773 121.002 93.828 117.553 1.00 0.00 H TER 773 WAT 2773 ATOM 773 O WAT 2774 84.802 121.347 117.641 1.00 0.00 O ATOM 774 H1 WAT 2774 84.825 122.304 117.622 1.00 0.00 H ATOM 775 H2 WAT 2774 84.309 121.104 116.857 1.00 0.00 H TER 777 WAT 2774 ATOM 777 O WAT 2775 85.047 63.427 62.264 1.00 0.00 O ATOM 778 H1 WAT 2775 84.875 62.925 63.061 1.00 0.00 H ATOM 779 H2 WAT 2775 84.637 62.915 61.566 1.00 0.00 H TER 781 WAT 2775 ATOM 781 O WAT 2776 31.396 54.674 59.165 1.00 0.00 O ATOM 782 H1 WAT 2776 31.845 54.673 60.011 1.00 0.00 H ATOM 783 H2 WAT 2776 31.892 55.296 58.632 1.00 0.00 H TER 785 WAT 2776 ATOM 785 O WAT 2777 59.061 117.032 140.557 1.00 0.00 O ATOM 786 H1 WAT 2777 59.981 117.294 140.550 1.00 0.00 H ATOM 787 H2 WAT 2777 58.909 116.666 139.686 1.00 0.00 H TER 789 WAT 2777 ATOM 789 O WAT 2778 108.170 45.482 101.467 1.00 0.00 O ATOM 790 H1 WAT 2778 108.049 46.301 101.947 1.00 0.00 H ATOM 791 H2 WAT 2778 108.424 44.847 102.136 1.00 0.00 H TER 793 WAT 2778 ATOM 793 O WAT 2779 119.296 0.635 151.740 1.00 0.00 O ATOM 794 H1 WAT 2779 119.746 1.155 152.406 1.00 0.00 H ATOM 795 H2 WAT 2779 120.001 0.252 151.219 1.00 0.00 H TER 797 WAT 2779 ATOM 797 O WAT 2780 100.739 95.672 3.574 1.00 0.00 O ATOM 798 H1 WAT 2780 101.617 95.319 3.429 1.00 0.00 H ATOM 799 H2 WAT 2780 100.161 94.912 3.501 1.00 0.00 H TER 801 WAT 2780 ATOM 801 O WAT 2781 3.536 61.718 79.917 1.00 0.00 O ATOM 802 H1 WAT 2781 3.172 61.564 79.045 1.00 0.00 H ATOM 803 H2 WAT 2781 4.349 61.213 79.930 1.00 0.00 H TER 805 WAT 2781 ATOM 805 O WAT 2782 133.576 73.727 97.068 1.00 0.00 O ATOM 806 H1 WAT 2782 134.084 73.837 96.264 1.00 0.00 H ATOM 807 H2 WAT 2782 133.936 74.378 97.670 1.00 0.00 H TER 809 WAT 2782 ATOM 809 O WAT 2783 79.614 115.898 60.183 1.00 0.00 O ATOM 810 H1 WAT 2783 78.931 115.618 59.575 1.00 0.00 H ATOM 811 H2 WAT 2783 80.238 115.173 60.193 1.00 0.00 H TER 813 WAT 2783 ATOM 813 O WAT 2784 73.992 77.426 79.587 1.00 0.00 O ATOM 814 H1 WAT 2784 73.785 76.640 79.082 1.00 0.00 H ATOM 815 H2 WAT 2784 73.266 78.024 79.407 1.00 0.00 H TER 817 WAT 2784 ATOM 817 O WAT 2785 82.822 131.974 84.929 1.00 0.00 O ATOM 818 H1 WAT 2785 82.584 131.668 84.054 1.00 0.00 H ATOM 819 H2 WAT 2785 82.852 131.179 85.462 1.00 0.00 H TER 821 WAT 2785 ATOM 821 O WAT 2786 93.139 85.706 94.715 1.00 0.00 O ATOM 822 H1 WAT 2786 93.867 86.318 94.609 1.00 0.00 H ATOM 823 H2 WAT 2786 92.525 86.162 95.291 1.00 0.00 H TER 825 WAT 2786 ATOM 825 O WAT 2787 59.242 110.306 118.557 1.00 0.00 O ATOM 826 H1 WAT 2787 58.575 110.124 117.895 1.00 0.00 H ATOM 827 H2 WAT 2787 59.886 110.852 118.106 1.00 0.00 H TER 829 WAT 2787 ATOM 829 O WAT 2788 21.717 110.365 131.287 1.00 0.00 O ATOM 830 H1 WAT 2788 20.799 110.098 131.239 1.00 0.00 H ATOM 831 H2 WAT 2788 22.183 109.573 131.556 1.00 0.00 H TER 833 WAT 2788 ATOM 833 O WAT 2789 34.332 37.456 129.404 1.00 0.00 O ATOM 834 H1 WAT 2789 33.931 36.676 129.788 1.00 0.00 H ATOM 835 H2 WAT 2789 34.392 38.077 130.129 1.00 0.00 H TER 837 WAT 2789 ATOM 837 O WAT 2790 7.799 1.126 12.890 1.00 0.00 O ATOM 838 H1 WAT 2790 8.657 1.188 13.310 1.00 0.00 H ATOM 839 H2 WAT 2790 7.835 0.307 12.394 1.00 0.00 H TER 841 WAT 2790 ATOM 841 O WAT 2791 115.707 145.440 145.127 1.00 0.00 O ATOM 842 H1 WAT 2791 116.328 145.399 144.399 1.00 0.00 H ATOM 843 H2 WAT 2791 115.814 144.605 145.581 1.00 0.00 H TER 845 WAT 2791 ATOM 845 O WAT 2792 85.312 135.040 71.915 1.00 0.00 O ATOM 846 H1 WAT 2792 84.428 134.697 72.045 1.00 0.00 H ATOM 847 H2 WAT 2792 85.457 134.977 70.971 1.00 0.00 H TER 849 WAT 2792 ATOM 849 O WAT 2793 107.172 68.309 102.240 1.00 0.00 O ATOM 850 H1 WAT 2793 106.593 68.306 101.478 1.00 0.00 H ATOM 851 H2 WAT 2793 106.581 68.389 102.989 1.00 0.00 H TER 853 WAT 2793 ATOM 853 O WAT 2794 122.269 44.481 155.586 1.00 0.00 O ATOM 854 H1 WAT 2794 121.903 44.104 154.786 1.00 0.00 H ATOM 855 H2 WAT 2794 123.116 44.049 155.688 1.00 0.00 H TER 857 WAT 2794 ATOM 857 O WAT 2795 113.571 37.689 113.482 1.00 0.00 O ATOM 858 H1 WAT 2795 114.195 36.965 113.532 1.00 0.00 H ATOM 859 H2 WAT 2795 113.895 38.236 112.766 1.00 0.00 H TER 861 WAT 2795 ATOM 861 O WAT 2796 53.188 2.906 18.174 1.00 0.00 O ATOM 862 H1 WAT 2796 52.809 3.763 18.371 1.00 0.00 H ATOM 863 H2 WAT 2796 52.470 2.289 18.313 1.00 0.00 H TER 865 WAT 2796 ATOM 865 O WAT 2797 89.317 36.611 82.914 1.00 0.00 O ATOM 866 H1 WAT 2797 88.366 36.677 82.831 1.00 0.00 H ATOM 867 H2 WAT 2797 89.604 37.506 83.100 1.00 0.00 H TER 869 WAT 2797 ATOM 869 O WAT 2798 143.091 71.734 62.321 1.00 0.00 O ATOM 870 H1 WAT 2798 142.773 72.554 61.943 1.00 0.00 H ATOM 871 H2 WAT 2798 143.888 71.981 62.791 1.00 0.00 H TER 873 WAT 2798 ATOM 873 O WAT 2799 85.686 3.736 68.313 1.00 0.00 O ATOM 874 H1 WAT 2799 86.157 4.146 69.039 1.00 0.00 H ATOM 875 H2 WAT 2799 84.780 3.682 68.616 1.00 0.00 H TER 877 WAT 2799 ATOM 877 O WAT 2800 88.224 138.320 56.357 1.00 0.00 O ATOM 878 H1 WAT 2800 89.105 138.691 56.402 1.00 0.00 H ATOM 879 H2 WAT 2800 87.983 138.161 57.269 1.00 0.00 H TER 881 WAT 2800 ATOM 881 O WAT 2801 52.120 133.294 122.688 1.00 0.00 O ATOM 882 H1 WAT 2801 51.611 133.431 121.889 1.00 0.00 H ATOM 883 H2 WAT 2801 52.866 132.763 122.409 1.00 0.00 H TER 885 WAT 2801 ATOM 885 O WAT 2802 29.515 83.033 103.281 1.00 0.00 O ATOM 886 H1 WAT 2802 29.741 82.525 104.060 1.00 0.00 H ATOM 887 H2 WAT 2802 29.447 83.935 103.594 1.00 0.00 H TER 889 WAT 2802 ATOM 889 O WAT 2803 83.786 119.935 66.451 1.00 0.00 O ATOM 890 H1 WAT 2803 84.740 119.863 66.464 1.00 0.00 H ATOM 891 H2 WAT 2803 83.476 119.031 66.505 1.00 0.00 H TER 893 WAT 2803 ATOM 893 O WAT 2804 111.383 56.933 77.440 1.00 0.00 O ATOM 894 H1 WAT 2804 111.255 56.928 78.388 1.00 0.00 H ATOM 895 H2 WAT 2804 112.186 56.429 77.304 1.00 0.00 H TER 897 WAT 2804 ATOM 897 O WAT 2805 59.243 115.859 137.215 1.00 0.00 O ATOM 898 H1 WAT 2805 59.639 115.032 137.488 1.00 0.00 H ATOM 899 H2 WAT 2805 58.683 115.624 136.475 1.00 0.00 H TER 901 WAT 2805 ATOM 901 O WAT 2806 39.722 14.878 127.813 1.00 0.00 O ATOM 902 H1 WAT 2806 40.458 15.249 127.326 1.00 0.00 H ATOM 903 H2 WAT 2806 39.368 14.203 127.234 1.00 0.00 H TER 905 WAT 2806 ATOM 905 O WAT 2807 20.589 103.689 131.781 1.00 0.00 O ATOM 906 H1 WAT 2807 19.863 104.300 131.656 1.00 0.00 H ATOM 907 H2 WAT 2807 20.683 103.253 130.933 1.00 0.00 H TER 909 WAT 2807 ATOM 909 O WAT 2808 88.245 51.310 137.040 1.00 0.00 O ATOM 910 H1 WAT 2808 87.877 51.676 137.845 1.00 0.00 H ATOM 911 H2 WAT 2808 87.499 51.250 136.442 1.00 0.00 H TER 913 WAT 2808 ATOM 913 O WAT 2809 24.966 98.617 109.099 1.00 0.00 O ATOM 914 H1 WAT 2809 24.224 98.457 109.682 1.00 0.00 H ATOM 915 H2 WAT 2809 24.710 99.387 108.591 1.00 0.00 H TER 917 WAT 2809 ATOM 917 O WAT 2810 36.593 117.966 57.469 1.00 0.00 O ATOM 918 H1 WAT 2810 37.528 118.058 57.289 1.00 0.00 H ATOM 919 H2 WAT 2810 36.244 117.515 56.700 1.00 0.00 H TER 921 WAT 2810 ATOM 921 O WAT 2811 9.436 117.429 124.597 1.00 0.00 O ATOM 922 H1 WAT 2811 8.744 117.299 125.246 1.00 0.00 H ATOM 923 H2 WAT 2811 9.395 118.362 124.387 1.00 0.00 H TER 925 WAT 2811 ATOM 925 O WAT 2812 76.617 114.503 129.257 1.00 0.00 O ATOM 926 H1 WAT 2812 75.930 113.992 128.829 1.00 0.00 H ATOM 927 H2 WAT 2812 76.385 115.414 129.076 1.00 0.00 H TER 929 WAT 2812 ATOM 929 O WAT 2813 90.570 143.897 121.031 1.00 0.00 O ATOM 930 H1 WAT 2813 90.251 143.689 121.909 1.00 0.00 H ATOM 931 H2 WAT 2813 90.801 144.825 121.074 1.00 0.00 H TER 933 WAT 2813 ATOM 933 O WAT 2814 23.324 3.107 131.680 1.00 0.00 O ATOM 934 H1 WAT 2814 24.025 2.561 131.326 1.00 0.00 H ATOM 935 H2 WAT 2814 23.718 3.542 132.437 1.00 0.00 H TER 937 WAT 2814 ATOM 937 O WAT 2815 58.670 109.314 3.520 1.00 0.00 O ATOM 938 H1 WAT 2815 57.788 109.660 3.383 1.00 0.00 H ATOM 939 H2 WAT 2815 58.834 108.765 2.753 1.00 0.00 H TER 941 WAT 2815 ATOM 941 O WAT 2816 110.955 3.911 154.017 1.00 0.00 O ATOM 942 H1 WAT 2816 110.746 3.309 154.731 1.00 0.00 H ATOM 943 H2 WAT 2816 110.538 4.735 154.269 1.00 0.00 H TER 945 WAT 2816 ATOM 945 O WAT 2817 34.769 72.996 67.634 1.00 0.00 O ATOM 946 H1 WAT 2817 35.663 72.870 67.952 1.00 0.00 H ATOM 947 H2 WAT 2817 34.805 73.811 67.133 1.00 0.00 H TER 949 WAT 2817 ATOM 949 O WAT 2818 17.304 85.566 80.009 1.00 0.00 O ATOM 950 H1 WAT 2818 16.888 86.042 79.290 1.00 0.00 H ATOM 951 H2 WAT 2818 16.889 85.913 80.799 1.00 0.00 H TER 953 WAT 2818 ATOM 953 O WAT 2819 59.521 122.349 94.208 1.00 0.00 O ATOM 954 H1 WAT 2819 58.677 121.902 94.133 1.00 0.00 H ATOM 955 H2 WAT 2819 59.390 122.992 94.904 1.00 0.00 H TER 957 WAT 2819 ATOM 957 O WAT 2820 54.821 50.766 108.228 1.00 0.00 O ATOM 958 H1 WAT 2820 55.001 51.666 108.499 1.00 0.00 H ATOM 959 H2 WAT 2820 54.531 50.842 107.319 1.00 0.00 H TER 961 WAT 2820 ATOM 961 O WAT 2821 28.399 72.437 154.674 1.00 0.00 O ATOM 962 H1 WAT 2821 28.675 71.668 154.176 1.00 0.00 H ATOM 963 H2 WAT 2821 29.106 72.582 155.303 1.00 0.00 H TER 965 WAT 2821 ATOM 965 O WAT 2822 15.244 79.127 12.656 1.00 0.00 O ATOM 966 H1 WAT 2822 14.296 79.055 12.541 1.00 0.00 H ATOM 967 H2 WAT 2822 15.404 78.792 13.539 1.00 0.00 H TER 969 WAT 2822 ATOM 969 O WAT 2823 122.768 123.095 145.403 1.00 0.00 O ATOM 970 H1 WAT 2823 122.642 122.632 146.231 1.00 0.00 H ATOM 971 H2 WAT 2823 121.971 122.916 144.905 1.00 0.00 H TER 973 WAT 2823 ATOM 973 O WAT 2824 124.486 91.392 156.112 1.00 0.00 O ATOM 974 H1 WAT 2824 124.416 90.445 155.989 1.00 0.00 H ATOM 975 H2 WAT 2824 124.561 91.505 157.060 1.00 0.00 H TER 977 WAT 2824 ATOM 977 O WAT 2825 111.506 129.906 8.393 1.00 0.00 O ATOM 978 H1 WAT 2825 111.134 129.061 8.648 1.00 0.00 H ATOM 979 H2 WAT 2825 111.776 129.784 7.483 1.00 0.00 H TER 981 WAT 2825 ATOM 981 O WAT 2826 142.834 68.210 19.923 1.00 0.00 O ATOM 982 H1 WAT 2826 143.384 67.543 20.334 1.00 0.00 H ATOM 983 H2 WAT 2826 141.992 68.136 20.372 1.00 0.00 H TER 985 WAT 2826 ATOM 985 O WAT 2827 76.252 27.339 144.921 1.00 0.00 O ATOM 986 H1 WAT 2827 76.846 26.936 145.555 1.00 0.00 H ATOM 987 H2 WAT 2827 76.768 28.038 144.520 1.00 0.00 H TER 989 WAT 2827 ATOM 989 O WAT 2828 141.010 9.183 66.196 1.00 0.00 O ATOM 990 H1 WAT 2828 141.193 9.096 67.131 1.00 0.00 H ATOM 991 H2 WAT 2828 140.258 8.610 66.044 1.00 0.00 H TER 993 WAT 2828 ATOM 993 O WAT 2829 9.602 65.953 92.456 1.00 0.00 O ATOM 994 H1 WAT 2829 8.945 65.267 92.334 1.00 0.00 H ATOM 995 H2 WAT 2829 10.354 65.499 92.836 1.00 0.00 H TER 997 WAT 2829 ATOM 997 O WAT 2830 95.377 79.224 104.237 1.00 0.00 O ATOM 998 H1 WAT 2830 94.564 79.649 104.507 1.00 0.00 H ATOM 999 H2 WAT 2830 95.111 78.343 103.974 1.00 0.00 H TER 1001 WAT 2830 ATOM 1001 O WAT 2831 37.340 138.875 86.295 1.00 0.00 O ATOM 1002 H1 WAT 2831 37.462 138.741 85.355 1.00 0.00 H ATOM 1003 H2 WAT 2831 36.456 139.234 86.373 1.00 0.00 H TER 1005 WAT 2831 ATOM 1005 O WAT 2832 121.187 130.977 100.983 1.00 0.00 O ATOM 1006 H1 WAT 2832 120.575 130.735 100.288 1.00 0.00 H ATOM 1007 H2 WAT 2832 121.200 130.218 101.566 1.00 0.00 H TER 1009 WAT 2832 ATOM 1009 O WAT 2833 129.103 62.187 138.994 1.00 0.00 O ATOM 1010 H1 WAT 2833 129.640 62.312 138.212 1.00 0.00 H ATOM 1011 H2 WAT 2833 128.237 61.959 138.656 1.00 0.00 H TER 1013 WAT 2833 ATOM 1013 O WAT 2834 82.126 125.880 65.041 1.00 0.00 O ATOM 1014 H1 WAT 2834 81.264 126.244 65.241 1.00 0.00 H ATOM 1015 H2 WAT 2834 82.581 125.865 65.883 1.00 0.00 H TER 1017 WAT 2834 ATOM 1017 O WAT 2835 101.567 40.326 137.715 1.00 0.00 O ATOM 1018 H1 WAT 2835 101.105 40.663 138.483 1.00 0.00 H ATOM 1019 H2 WAT 2835 101.220 39.442 137.595 1.00 0.00 H TER 1021 WAT 2835 ATOM 1021 O WAT 2836 8.409 145.145 154.142 1.00 0.00 O ATOM 1022 H1 WAT 2836 8.634 144.409 154.710 1.00 0.00 H ATOM 1023 H2 WAT 2836 7.455 145.205 154.194 1.00 0.00 H TER 1025 WAT 2836 ATOM 1025 O WAT 2837 29.515 106.794 15.055 1.00 0.00 O ATOM 1026 H1 WAT 2837 28.873 107.401 14.685 1.00 0.00 H ATOM 1027 H2 WAT 2837 29.603 107.068 15.968 1.00 0.00 H TER 1029 WAT 2837 ATOM 1029 O WAT 2838 128.584 123.377 18.999 1.00 0.00 O ATOM 1030 H1 WAT 2838 128.393 123.006 19.861 1.00 0.00 H ATOM 1031 H2 WAT 2838 128.307 124.290 19.065 1.00 0.00 H TER 1033 WAT 2838 ATOM 1033 O WAT 2839 58.275 33.273 123.404 1.00 0.00 O ATOM 1034 H1 WAT 2839 58.193 34.068 122.877 1.00 0.00 H ATOM 1035 H2 WAT 2839 57.719 32.633 122.959 1.00 0.00 H TER 1037 WAT 2839 ATOM 1037 O WAT 2840 6.940 44.896 0.925 1.00 0.00 O ATOM 1038 H1 WAT 2840 7.728 44.947 1.466 1.00 0.00 H ATOM 1039 H2 WAT 2840 7.050 44.093 0.417 1.00 0.00 H TER 1041 WAT 2840 ATOM 1041 O WAT 2841 103.805 3.027 55.689 1.00 0.00 O ATOM 1042 H1 WAT 2841 103.918 3.332 56.589 1.00 0.00 H ATOM 1043 H2 WAT 2841 103.411 3.770 55.232 1.00 0.00 H TER 1045 WAT 2841 ATOM 1045 O WAT 2842 1.588 54.727 18.599 1.00 0.00 O ATOM 1046 H1 WAT 2842 0.917 55.369 18.367 1.00 0.00 H ATOM 1047 H2 WAT 2842 2.217 55.219 19.127 1.00 0.00 H TER 1049 WAT 2842 ATOM 1049 O WAT 2843 128.935 89.737 70.075 1.00 0.00 O ATOM 1050 H1 WAT 2843 129.521 89.277 70.676 1.00 0.00 H ATOM 1051 H2 WAT 2843 128.730 89.091 69.400 1.00 0.00 H TER 1053 WAT 2843 ATOM 1053 O WAT 2844 30.905 43.768 106.469 1.00 0.00 O ATOM 1054 H1 WAT 2844 31.593 43.700 105.807 1.00 0.00 H ATOM 1055 H2 WAT 2844 31.343 43.555 107.293 1.00 0.00 H TER 1057 WAT 2844 ATOM 1057 O WAT 2845 145.697 98.489 105.789 1.00 0.00 O ATOM 1058 H1 WAT 2845 145.970 97.761 105.230 1.00 0.00 H ATOM 1059 H2 WAT 2845 145.970 98.229 106.669 1.00 0.00 H TER 1061 WAT 2845 ATOM 1061 O WAT 2846 22.480 107.734 13.752 1.00 0.00 O ATOM 1062 H1 WAT 2846 22.381 107.772 14.703 1.00 0.00 H ATOM 1063 H2 WAT 2846 23.021 108.494 13.537 1.00 0.00 H TER 1065 WAT 2846 ATOM 1065 O WAT 2847 139.202 28.683 108.237 1.00 0.00 O ATOM 1066 H1 WAT 2847 138.686 29.481 108.346 1.00 0.00 H ATOM 1067 H2 WAT 2847 140.110 28.968 108.340 1.00 0.00 H TER 1069 WAT 2847 ATOM 1069 O WAT 2848 79.386 50.355 80.288 1.00 0.00 O ATOM 1070 H1 WAT 2848 79.695 50.567 81.169 1.00 0.00 H ATOM 1071 H2 WAT 2848 80.045 50.731 79.706 1.00 0.00 H TER 1073 WAT 2848 ATOM 1073 O WAT 2849 42.958 116.903 104.884 1.00 0.00 O ATOM 1074 H1 WAT 2849 43.269 117.518 104.220 1.00 0.00 H ATOM 1075 H2 WAT 2849 42.245 116.429 104.456 1.00 0.00 H TER 1077 WAT 2849 ATOM 1077 O WAT 2850 73.857 101.877 135.820 1.00 0.00 O ATOM 1078 H1 WAT 2850 74.662 101.883 136.338 1.00 0.00 H ATOM 1079 H2 WAT 2850 73.636 102.802 135.709 1.00 0.00 H TER 1081 WAT 2850 ATOM 1081 O WAT 2851 6.583 66.446 96.615 1.00 0.00 O ATOM 1082 H1 WAT 2851 5.931 66.941 97.111 1.00 0.00 H ATOM 1083 H2 WAT 2851 7.058 67.111 96.115 1.00 0.00 H TER 1085 WAT 2851 ATOM 1085 O WAT 2852 10.641 141.651 5.445 1.00 0.00 O ATOM 1086 H1 WAT 2852 11.382 141.115 5.729 1.00 0.00 H ATOM 1087 H2 WAT 2852 10.356 141.249 4.625 1.00 0.00 H TER 1089 WAT 2852 ATOM 1089 O WAT 2853 118.822 65.903 156.642 1.00 0.00 O ATOM 1090 H1 WAT 2853 117.955 65.859 157.046 1.00 0.00 H ATOM 1091 H2 WAT 2853 119.227 65.062 156.851 1.00 0.00 H TER 1093 WAT 2853 ATOM 1093 O WAT 2854 22.399 41.355 99.771 1.00 0.00 O ATOM 1094 H1 WAT 2854 23.128 41.859 99.410 1.00 0.00 H ATOM 1095 H2 WAT 2854 22.807 40.570 100.135 1.00 0.00 H TER 1097 WAT 2854 ATOM 1097 O WAT 2855 93.624 104.213 68.087 1.00 0.00 O ATOM 1098 H1 WAT 2855 94.073 104.326 68.924 1.00 0.00 H ATOM 1099 H2 WAT 2855 93.823 103.313 67.828 1.00 0.00 H TER 1101 WAT 2855 ATOM 1101 O WAT 2856 95.789 56.390 102.117 1.00 0.00 O ATOM 1102 H1 WAT 2856 95.279 57.142 101.815 1.00 0.00 H ATOM 1103 H2 WAT 2856 96.235 56.703 102.904 1.00 0.00 H TER 1105 WAT 2856 ATOM 1105 O WAT 2857 51.789 121.863 153.298 1.00 0.00 O ATOM 1106 H1 WAT 2857 50.956 121.962 152.838 1.00 0.00 H ATOM 1107 H2 WAT 2857 52.283 121.238 152.766 1.00 0.00 H TER 1109 WAT 2857 ATOM 1109 O WAT 2858 132.749 106.728 89.708 1.00 0.00 O ATOM 1110 H1 WAT 2858 132.858 106.637 88.761 1.00 0.00 H ATOM 1111 H2 WAT 2858 133.526 107.209 89.993 1.00 0.00 H TER 1113 WAT 2858 ATOM 1113 O WAT 2859 90.325 102.458 157.698 1.00 0.00 O ATOM 1114 H1 WAT 2859 90.835 101.806 158.179 1.00 0.00 H ATOM 1115 H2 WAT 2859 89.870 101.956 157.022 1.00 0.00 H TER 1117 WAT 2859 ATOM 1117 O WAT 2860 32.811 92.314 152.464 1.00 0.00 O ATOM 1118 H1 WAT 2860 33.739 92.547 152.488 1.00 0.00 H ATOM 1119 H2 WAT 2860 32.758 91.491 152.951 1.00 0.00 H TER 1121 WAT 2860 ATOM 1121 O WAT 2861 134.179 112.908 74.240 1.00 0.00 O ATOM 1122 H1 WAT 2861 133.474 113.478 73.932 1.00 0.00 H ATOM 1123 H2 WAT 2861 134.485 113.321 75.047 1.00 0.00 H TER 1125 WAT 2861 ATOM 1125 O WAT 2862 24.559 111.777 154.390 1.00 0.00 O ATOM 1126 H1 WAT 2862 25.508 111.669 154.460 1.00 0.00 H ATOM 1127 H2 WAT 2862 24.264 111.892 155.293 1.00 0.00 H TER 1129 WAT 2862 ATOM 1129 O WAT 2863 49.308 117.443 86.374 1.00 0.00 O ATOM 1130 H1 WAT 2863 49.146 117.049 85.516 1.00 0.00 H ATOM 1131 H2 WAT 2863 50.006 118.078 86.218 1.00 0.00 H TER 1133 WAT 2863 ATOM 1133 O WAT 2864 22.198 62.698 142.972 1.00 0.00 O ATOM 1134 H1 WAT 2864 22.441 61.848 142.604 1.00 0.00 H ATOM 1135 H2 WAT 2864 21.351 62.545 143.390 1.00 0.00 H TER 1137 WAT 2864 ATOM 1137 O WAT 2865 75.500 139.596 77.830 1.00 0.00 O ATOM 1138 H1 WAT 2865 74.561 139.555 78.012 1.00 0.00 H ATOM 1139 H2 WAT 2865 75.913 139.538 78.691 1.00 0.00 H TER 1141 WAT 2865 ATOM 1141 O WAT 2866 19.535 119.560 20.489 1.00 0.00 O ATOM 1142 H1 WAT 2866 19.406 120.436 20.853 1.00 0.00 H ATOM 1143 H2 WAT 2866 18.846 119.470 19.831 1.00 0.00 H TER 1145 WAT 2866 ATOM 1145 O WAT 2867 47.214 17.639 3.688 1.00 0.00 O ATOM 1146 H1 WAT 2867 47.270 16.684 3.698 1.00 0.00 H ATOM 1147 H2 WAT 2867 47.491 17.904 4.565 1.00 0.00 H TER 1149 WAT 2867 ATOM 1149 O WAT 2868 98.376 56.321 60.189 1.00 0.00 O ATOM 1150 H1 WAT 2868 98.687 55.584 60.716 1.00 0.00 H ATOM 1151 H2 WAT 2868 99.057 56.987 60.284 1.00 0.00 H TER 1153 WAT 2868 ATOM 1153 O WAT 2869 44.566 80.142 19.860 1.00 0.00 O ATOM 1154 H1 WAT 2869 44.353 80.119 20.793 1.00 0.00 H ATOM 1155 H2 WAT 2869 44.465 81.062 19.614 1.00 0.00 H TER 1157 WAT 2869 ATOM 1157 O WAT 2870 4.746 90.071 5.478 1.00 0.00 O ATOM 1158 H1 WAT 2870 5.647 90.370 5.598 1.00 0.00 H ATOM 1159 H2 WAT 2870 4.208 90.799 5.792 1.00 0.00 H TER 1161 WAT 2870 ATOM 1161 O WAT 2871 99.635 61.827 143.304 1.00 0.00 O ATOM 1162 H1 WAT 2871 98.771 62.237 143.358 1.00 0.00 H ATOM 1163 H2 WAT 2871 99.509 60.954 143.677 1.00 0.00 H TER 1165 WAT 2871 ATOM 1165 O WAT 2872 117.478 122.990 17.800 1.00 0.00 O ATOM 1166 H1 WAT 2872 117.469 123.682 18.461 1.00 0.00 H ATOM 1167 H2 WAT 2872 116.729 123.188 17.237 1.00 0.00 H TER 1169 WAT 2872 ATOM 1169 O WAT 2873 67.338 121.292 121.707 1.00 0.00 O ATOM 1170 H1 WAT 2873 67.753 120.911 122.481 1.00 0.00 H ATOM 1171 H2 WAT 2873 67.445 120.628 121.027 1.00 0.00 H TER 1173 WAT 2873 ATOM 1173 O WAT 2874 23.584 10.142 17.662 1.00 0.00 O ATOM 1174 H1 WAT 2874 22.685 10.459 17.749 1.00 0.00 H ATOM 1175 H2 WAT 2874 23.879 10.007 18.563 1.00 0.00 H TER 1177 WAT 2874 ATOM 1177 O WAT 2875 23.465 51.873 154.908 1.00 0.00 O ATOM 1178 H1 WAT 2875 23.795 52.555 154.323 1.00 0.00 H ATOM 1179 H2 WAT 2875 24.250 51.426 155.222 1.00 0.00 H TER 1181 WAT 2875 ATOM 1181 O WAT 2876 7.432 61.882 131.536 1.00 0.00 O ATOM 1182 H1 WAT 2876 6.955 62.466 130.947 1.00 0.00 H ATOM 1183 H2 WAT 2876 8.345 61.956 131.260 1.00 0.00 H TER 1185 WAT 2876 ATOM 1185 O WAT 2877 28.940 108.379 70.876 1.00 0.00 O ATOM 1186 H1 WAT 2877 29.650 107.762 70.696 1.00 0.00 H ATOM 1187 H2 WAT 2877 28.824 108.858 70.055 1.00 0.00 H TER 1189 WAT 2877 ATOM 1189 O WAT 2878 125.263 23.996 18.669 1.00 0.00 O ATOM 1190 H1 WAT 2878 124.502 23.538 19.024 1.00 0.00 H ATOM 1191 H2 WAT 2878 125.950 23.863 19.322 1.00 0.00 H TER 1193 WAT 2878 ATOM 1193 O WAT 2879 67.556 126.415 51.565 1.00 0.00 O ATOM 1194 H1 WAT 2879 66.730 126.898 51.582 1.00 0.00 H ATOM 1195 H2 WAT 2879 67.724 126.193 52.480 1.00 0.00 H TER 1197 WAT 2879 ATOM 1197 O WAT 2880 105.141 2.830 141.922 1.00 0.00 O ATOM 1198 H1 WAT 2880 105.334 2.040 141.418 1.00 0.00 H ATOM 1199 H2 WAT 2880 105.362 3.551 141.331 1.00 0.00 H TER 1201 WAT 2880 ATOM 1201 O WAT 2881 112.686 92.374 143.008 1.00 0.00 O ATOM 1202 H1 WAT 2881 113.595 92.199 142.765 1.00 0.00 H ATOM 1203 H2 WAT 2881 112.664 93.313 143.194 1.00 0.00 H TER 1205 WAT 2881 ATOM 1205 O WAT 2882 138.227 27.105 78.278 1.00 0.00 O ATOM 1206 H1 WAT 2882 138.229 27.159 77.322 1.00 0.00 H ATOM 1207 H2 WAT 2882 138.738 26.320 78.475 1.00 0.00 H TER 1209 WAT 2882 ATOM 1209 O WAT 2883 27.039 118.281 140.541 1.00 0.00 O ATOM 1210 H1 WAT 2883 27.069 118.791 139.732 1.00 0.00 H ATOM 1211 H2 WAT 2883 27.831 118.537 141.015 1.00 0.00 H TER 1213 WAT 2883 ATOM 1213 O WAT 2884 43.405 107.284 149.210 1.00 0.00 O ATOM 1214 H1 WAT 2884 43.090 107.722 150.001 1.00 0.00 H ATOM 1215 H2 WAT 2884 44.355 107.397 149.235 1.00 0.00 H TER 1217 WAT 2884 ATOM 1217 O WAT 2885 55.552 91.188 7.720 1.00 0.00 O ATOM 1218 H1 WAT 2885 55.673 90.896 6.816 1.00 0.00 H ATOM 1219 H2 WAT 2885 55.641 92.140 7.677 1.00 0.00 H TER 1221 WAT 2885 ATOM 1221 O WAT 2886 122.629 144.807 84.653 1.00 0.00 O ATOM 1222 H1 WAT 2886 123.091 144.619 83.835 1.00 0.00 H ATOM 1223 H2 WAT 2886 123.032 145.613 84.976 1.00 0.00 H TER 1225 WAT 2886 ATOM 1225 O WAT 2887 68.107 3.849 22.298 1.00 0.00 O ATOM 1226 H1 WAT 2887 67.379 4.324 21.897 1.00 0.00 H ATOM 1227 H2 WAT 2887 67.736 3.472 23.097 1.00 0.00 H TER 1229 WAT 2887 ATOM 1229 O WAT 2888 133.387 137.788 131.110 1.00 0.00 O ATOM 1230 H1 WAT 2888 132.696 137.126 131.088 1.00 0.00 H ATOM 1231 H2 WAT 2888 133.064 138.451 131.720 1.00 0.00 H TER 1233 WAT 2888 ATOM 1233 O WAT 2889 116.336 80.224 114.205 1.00 0.00 O ATOM 1234 H1 WAT 2889 117.225 80.386 114.523 1.00 0.00 H ATOM 1235 H2 WAT 2889 116.324 80.600 113.325 1.00 0.00 H TER 1237 WAT 2889 ATOM 1237 O WAT 2890 113.892 135.930 150.575 1.00 0.00 O ATOM 1238 H1 WAT 2890 114.020 136.834 150.864 1.00 0.00 H ATOM 1239 H2 WAT 2890 113.664 135.453 151.372 1.00 0.00 H TER 1241 WAT 2890 ATOM 1241 O WAT 2891 130.028 86.190 81.594 1.00 0.00 O ATOM 1242 H1 WAT 2891 129.392 85.483 81.701 1.00 0.00 H ATOM 1243 H2 WAT 2891 129.567 86.974 81.894 1.00 0.00 H TER 1245 WAT 2891 ATOM 1245 O WAT 2892 136.114 77.383 91.201 1.00 0.00 O ATOM 1246 H1 WAT 2892 135.346 76.849 91.402 1.00 0.00 H ATOM 1247 H2 WAT 2892 135.802 78.020 90.558 1.00 0.00 H TER 1249 WAT 2892 ATOM 1249 O WAT 2893 95.023 132.189 67.377 1.00 0.00 O ATOM 1250 H1 WAT 2893 94.451 132.948 67.264 1.00 0.00 H ATOM 1251 H2 WAT 2893 95.406 132.046 66.511 1.00 0.00 H TER 1253 WAT 2893 ATOM 1253 O WAT 2894 95.881 86.548 77.808 1.00 0.00 O ATOM 1254 H1 WAT 2894 95.985 87.498 77.858 1.00 0.00 H ATOM 1255 H2 WAT 2894 96.776 86.208 77.834 1.00 0.00 H TER 1257 WAT 2894 ATOM 1257 O WAT 2895 142.832 41.674 91.835 1.00 0.00 O ATOM 1258 H1 WAT 2895 142.300 42.259 92.375 1.00 0.00 H ATOM 1259 H2 WAT 2895 143.728 41.992 91.950 1.00 0.00 H TER 1261 WAT 2895 ATOM 1261 O WAT 2896 89.205 53.801 135.148 1.00 0.00 O ATOM 1262 H1 WAT 2896 89.752 53.300 135.754 1.00 0.00 H ATOM 1263 H2 WAT 2896 89.516 54.702 135.234 1.00 0.00 H TER 1265 WAT 2896 ATOM 1265 O WAT 2897 131.549 6.860 92.942 1.00 0.00 O ATOM 1266 H1 WAT 2897 132.466 7.102 93.069 1.00 0.00 H ATOM 1267 H2 WAT 2897 131.173 7.592 92.453 1.00 0.00 H TER 1269 WAT 2897 ATOM 1269 O WAT 2898 68.800 82.534 118.971 1.00 0.00 O ATOM 1270 H1 WAT 2898 69.339 82.402 118.192 1.00 0.00 H ATOM 1271 H2 WAT 2898 68.170 81.814 118.952 1.00 0.00 H TER 1273 WAT 2898 ATOM 1273 O WAT 2899 84.681 58.481 2.741 1.00 0.00 O ATOM 1274 H1 WAT 2899 84.720 58.192 3.653 1.00 0.00 H ATOM 1275 H2 WAT 2899 84.378 59.388 2.790 1.00 0.00 H TER 1277 WAT 2899 ATOM 1277 O WAT 2900 86.854 62.858 89.285 1.00 0.00 O ATOM 1278 H1 WAT 2900 87.661 63.259 88.962 1.00 0.00 H ATOM 1279 H2 WAT 2900 86.756 62.063 88.761 1.00 0.00 H TER 1281 WAT 2900 ATOM 1281 O WAT 2901 126.770 24.310 119.629 1.00 0.00 O ATOM 1282 H1 WAT 2901 125.970 24.323 120.155 1.00 0.00 H ATOM 1283 H2 WAT 2901 126.617 24.961 118.944 1.00 0.00 H TER 1285 WAT 2901 ATOM 1285 O WAT 2902 128.885 44.024 119.850 1.00 0.00 O ATOM 1286 H1 WAT 2902 127.952 43.895 119.679 1.00 0.00 H ATOM 1287 H2 WAT 2902 129.325 43.494 119.185 1.00 0.00 H TER 1289 WAT 2902 ATOM 1289 O WAT 2903 137.960 2.377 81.433 1.00 0.00 O ATOM 1290 H1 WAT 2903 138.697 2.104 80.887 1.00 0.00 H ATOM 1291 H2 WAT 2903 137.297 2.674 80.809 1.00 0.00 H TER 1293 WAT 2903 ATOM 1293 O WAT 2904 113.273 97.410 111.835 1.00 0.00 O ATOM 1294 H1 WAT 2904 112.479 97.413 112.369 1.00 0.00 H ATOM 1295 H2 WAT 2904 112.979 97.126 110.970 1.00 0.00 H TER 1297 WAT 2904 ATOM 1297 O WAT 2905 139.723 138.291 20.183 1.00 0.00 O ATOM 1298 H1 WAT 2905 139.955 138.980 19.560 1.00 0.00 H ATOM 1299 H2 WAT 2905 139.208 138.738 20.854 1.00 0.00 H TER 1301 WAT 2905 ATOM 1301 O WAT 2906 19.858 116.000 145.409 1.00 0.00 O ATOM 1302 H1 WAT 2906 19.958 116.871 145.024 1.00 0.00 H ATOM 1303 H2 WAT 2906 20.455 115.446 144.906 1.00 0.00 H TER 1305 WAT 2906 ATOM 1305 O WAT 2907 117.434 138.552 73.353 1.00 0.00 O ATOM 1306 H1 WAT 2907 116.968 138.526 74.189 1.00 0.00 H ATOM 1307 H2 WAT 2907 116.967 139.212 72.840 1.00 0.00 H TER 1309 WAT 2907 ATOM 1309 O WAT 2908 32.423 64.764 141.520 1.00 0.00 O ATOM 1310 H1 WAT 2908 31.755 64.523 142.161 1.00 0.00 H ATOM 1311 H2 WAT 2908 32.386 65.719 141.482 1.00 0.00 H TER 1313 WAT 2908 ATOM 1313 O WAT 2909 57.631 99.464 59.607 1.00 0.00 O ATOM 1314 H1 WAT 2909 57.681 100.000 58.816 1.00 0.00 H ATOM 1315 H2 WAT 2909 58.252 99.870 60.211 1.00 0.00 H TER 1317 WAT 2909 ATOM 1317 O WAT 2910 57.648 82.596 21.070 1.00 0.00 O ATOM 1318 H1 WAT 2910 58.146 83.410 21.147 1.00 0.00 H ATOM 1319 H2 WAT 2910 57.904 82.238 20.220 1.00 0.00 H TER 1321 WAT 2910 ATOM 1321 O WAT 2911 51.422 33.330 106.076 1.00 0.00 O ATOM 1322 H1 WAT 2911 51.771 33.228 105.191 1.00 0.00 H ATOM 1323 H2 WAT 2911 50.821 34.072 106.013 1.00 0.00 H TER 1325 WAT 2911 ATOM 1325 O WAT 2912 61.559 1.776 75.545 1.00 0.00 O ATOM 1326 H1 WAT 2912 62.491 1.956 75.663 1.00 0.00 H ATOM 1327 H2 WAT 2912 61.452 0.867 75.825 1.00 0.00 H TER 1329 WAT 2912 ATOM 1329 O WAT 2913 133.286 34.273 80.737 1.00 0.00 O ATOM 1330 H1 WAT 2913 133.771 33.669 80.176 1.00 0.00 H ATOM 1331 H2 WAT 2913 133.261 35.092 80.242 1.00 0.00 H TER 1333 WAT 2913 ATOM 1333 O WAT 2914 139.170 125.861 16.523 1.00 0.00 O ATOM 1334 H1 WAT 2914 139.949 125.353 16.297 1.00 0.00 H ATOM 1335 H2 WAT 2914 139.227 126.644 15.975 1.00 0.00 H TER 1337 WAT 2914 ATOM 1337 O WAT 2915 49.554 56.609 122.699 1.00 0.00 O ATOM 1338 H1 WAT 2915 49.225 55.767 122.387 1.00 0.00 H ATOM 1339 H2 WAT 2915 48.791 57.035 123.090 1.00 0.00 H TER 1341 WAT 2915 ATOM 1341 O WAT 2916 2.075 129.978 110.354 1.00 0.00 O ATOM 1342 H1 WAT 2916 2.778 129.349 110.193 1.00 0.00 H ATOM 1343 H2 WAT 2916 2.508 130.832 110.337 1.00 0.00 H TER 1345 WAT 2916 ATOM 1345 O WAT 2917 33.920 89.932 157.190 1.00 0.00 O ATOM 1346 H1 WAT 2917 34.403 90.635 156.755 1.00 0.00 H ATOM 1347 H2 WAT 2917 33.402 90.376 157.861 1.00 0.00 H TER 1349 WAT 2917 ATOM 1349 O WAT 2918 110.686 59.768 22.127 1.00 0.00 O ATOM 1350 H1 WAT 2918 111.359 59.090 22.067 1.00 0.00 H ATOM 1351 H2 WAT 2918 109.872 59.318 21.901 1.00 0.00 H TER 1353 WAT 2918 ATOM 1353 O WAT 2919 103.565 24.985 135.428 1.00 0.00 O ATOM 1354 H1 WAT 2919 104.510 24.945 135.572 1.00 0.00 H ATOM 1355 H2 WAT 2919 103.429 24.520 134.601 1.00 0.00 H TER 1357 WAT 2919 ATOM 1357 O WAT 2920 127.707 91.638 79.429 1.00 0.00 O ATOM 1358 H1 WAT 2920 126.990 91.621 78.795 1.00 0.00 H ATOM 1359 H2 WAT 2920 127.311 91.984 80.229 1.00 0.00 H TER 1361 WAT 2920 ATOM 1361 O WAT 2921 64.354 6.758 107.670 1.00 0.00 O ATOM 1362 H1 WAT 2921 65.291 6.687 107.854 1.00 0.00 H ATOM 1363 H2 WAT 2921 63.996 5.907 107.924 1.00 0.00 H TER 1365 WAT 2921 ATOM 1365 O WAT 2922 136.944 23.118 120.899 1.00 0.00 O ATOM 1366 H1 WAT 2922 137.219 22.305 120.476 1.00 0.00 H ATOM 1367 H2 WAT 2922 136.443 23.581 120.227 1.00 0.00 H TER 1369 WAT 2922 ATOM 1369 O WAT 2923 57.730 60.535 100.800 1.00 0.00 O ATOM 1370 H1 WAT 2923 57.261 59.829 100.354 1.00 0.00 H ATOM 1371 H2 WAT 2923 57.043 61.042 101.234 1.00 0.00 H TER 1373 WAT 2923 ATOM 1373 O WAT 2924 42.061 22.597 125.838 1.00 0.00 O ATOM 1374 H1 WAT 2924 41.688 22.317 126.674 1.00 0.00 H ATOM 1375 H2 WAT 2924 42.991 22.727 126.023 1.00 0.00 H TER 1377 WAT 2924 ATOM 1377 O WAT 2925 27.563 55.214 132.202 1.00 0.00 O ATOM 1378 H1 WAT 2925 28.377 55.040 131.729 1.00 0.00 H ATOM 1379 H2 WAT 2925 27.687 54.796 133.054 1.00 0.00 H TER 1381 WAT 2925 ATOM 1381 O WAT 2926 41.215 66.216 21.239 1.00 0.00 O ATOM 1382 H1 WAT 2926 41.608 67.073 21.399 1.00 0.00 H ATOM 1383 H2 WAT 2926 41.815 65.787 20.629 1.00 0.00 H TER 1385 WAT 2926 ATOM 1385 O WAT 2927 68.756 72.742 65.090 1.00 0.00 O ATOM 1386 H1 WAT 2927 69.037 72.562 64.193 1.00 0.00 H ATOM 1387 H2 WAT 2927 69.516 73.155 65.501 1.00 0.00 H TER 1389 WAT 2927 ATOM 1389 O WAT 2928 4.140 59.280 86.144 1.00 0.00 O ATOM 1390 H1 WAT 2928 4.138 58.512 86.715 1.00 0.00 H ATOM 1391 H2 WAT 2928 3.260 59.301 85.767 1.00 0.00 H TER 1393 WAT 2928 ATOM 1393 O WAT 2929 103.050 109.605 83.856 1.00 0.00 O ATOM 1394 H1 WAT 2929 102.378 109.445 83.193 1.00 0.00 H ATOM 1395 H2 WAT 2929 103.757 110.041 83.380 1.00 0.00 H TER 1397 WAT 2929 ATOM 1397 O WAT 2930 90.240 38.119 89.687 1.00 0.00 O ATOM 1398 H1 WAT 2930 90.840 38.842 89.500 1.00 0.00 H ATOM 1399 H2 WAT 2930 89.919 38.296 90.571 1.00 0.00 H TER 1401 WAT 2930 ATOM 1401 O WAT 2931 12.665 73.484 76.519 1.00 0.00 O ATOM 1402 H1 WAT 2931 12.054 74.220 76.483 1.00 0.00 H ATOM 1403 H2 WAT 2931 13.415 73.819 77.011 1.00 0.00 H TER 1405 WAT 2931 ATOM 1405 O WAT 2932 145.658 58.967 120.425 1.00 0.00 O ATOM 1406 H1 WAT 2932 145.826 58.123 120.005 1.00 0.00 H ATOM 1407 H2 WAT 2932 145.765 58.795 121.360 1.00 0.00 H TER 1409 WAT 2932 ATOM 1409 O WAT 2933 42.764 20.072 62.230 1.00 0.00 O ATOM 1410 H1 WAT 2933 43.412 20.757 62.067 1.00 0.00 H ATOM 1411 H2 WAT 2933 42.476 20.224 63.131 1.00 0.00 H TER 1413 WAT 2933 ATOM 1413 O WAT 2934 51.851 65.580 85.656 1.00 0.00 O ATOM 1414 H1 WAT 2934 51.308 66.367 85.695 1.00 0.00 H ATOM 1415 H2 WAT 2934 51.312 64.897 86.055 1.00 0.00 H TER 1417 WAT 2934 ATOM 1417 O WAT 2935 90.757 142.204 103.277 1.00 0.00 O ATOM 1418 H1 WAT 2935 89.954 141.699 103.147 1.00 0.00 H ATOM 1419 H2 WAT 2935 91.462 141.566 103.166 1.00 0.00 H TER 1421 WAT 2935 ATOM 1421 O WAT 2936 39.051 141.063 142.605 1.00 0.00 O ATOM 1422 H1 WAT 2936 38.411 140.882 143.294 1.00 0.00 H ATOM 1423 H2 WAT 2936 39.642 141.709 142.991 1.00 0.00 H TER 1425 WAT 2936 ATOM 1425 O WAT 2937 77.824 45.620 96.015 1.00 0.00 O ATOM 1426 H1 WAT 2937 77.507 44.892 95.481 1.00 0.00 H ATOM 1427 H2 WAT 2937 78.575 45.964 95.530 1.00 0.00 H TER 1429 WAT 2937 ATOM 1429 O WAT 2938 90.934 24.337 106.085 1.00 0.00 O ATOM 1430 H1 WAT 2938 90.305 24.344 105.364 1.00 0.00 H ATOM 1431 H2 WAT 2938 91.771 24.554 105.675 1.00 0.00 H TER 1433 WAT 2938 ATOM 1433 O WAT 2939 104.974 134.452 83.521 1.00 0.00 O ATOM 1434 H1 WAT 2939 104.291 135.028 83.864 1.00 0.00 H ATOM 1435 H2 WAT 2939 104.768 133.592 83.887 1.00 0.00 H TER 1437 WAT 2939 ATOM 1437 O WAT 2940 136.711 59.381 158.465 1.00 0.00 O ATOM 1438 H1 WAT 2940 137.630 59.632 158.564 1.00 0.00 H ATOM 1439 H2 WAT 2940 136.561 59.396 157.519 1.00 0.00 H TER 1441 WAT 2940 ATOM 1441 O WAT 2941 83.303 108.571 70.787 1.00 0.00 O ATOM 1442 H1 WAT 2941 83.498 108.931 71.653 1.00 0.00 H ATOM 1443 H2 WAT 2941 82.349 108.609 70.721 1.00 0.00 H TER 1445 WAT 2941 ATOM 1445 O WAT 2942 100.090 136.535 9.358 1.00 0.00 O ATOM 1446 H1 WAT 2942 99.503 137.216 9.030 1.00 0.00 H ATOM 1447 H2 WAT 2942 99.585 136.092 10.040 1.00 0.00 H TER 1449 WAT 2942 ATOM 1449 O WAT 2943 30.644 32.412 20.647 1.00 0.00 O ATOM 1450 H1 WAT 2943 30.257 32.980 21.314 1.00 0.00 H ATOM 1451 H2 WAT 2943 31.555 32.305 20.923 1.00 0.00 H TER 1453 WAT 2943 ATOM 1453 O WAT 2944 44.759 106.291 157.921 1.00 0.00 O ATOM 1454 H1 WAT 2944 44.259 106.153 157.116 1.00 0.00 H ATOM 1455 H2 WAT 2944 45.654 106.043 157.693 1.00 0.00 H TER 1457 WAT 2944 ATOM 1457 O WAT 2945 71.961 41.363 20.491 1.00 0.00 O ATOM 1458 H1 WAT 2945 72.645 42.031 20.447 1.00 0.00 H ATOM 1459 H2 WAT 2945 72.391 40.605 20.887 1.00 0.00 H TER 1461 WAT 2945 ATOM 1461 O WAT 2946 100.034 116.295 99.485 1.00 0.00 O ATOM 1462 H1 WAT 2946 99.921 117.242 99.397 1.00 0.00 H ATOM 1463 H2 WAT 2946 100.914 116.192 99.848 1.00 0.00 H TER 1465 WAT 2946 ATOM 1465 O WAT 2947 87.686 120.749 7.325 1.00 0.00 O ATOM 1466 H1 WAT 2947 87.951 120.965 8.219 1.00 0.00 H ATOM 1467 H2 WAT 2947 88.145 121.387 6.779 1.00 0.00 H TER 1469 WAT 2947 ATOM 1469 O WAT 2948 104.951 99.581 5.767 1.00 0.00 O ATOM 1470 H1 WAT 2948 105.846 99.257 5.871 1.00 0.00 H ATOM 1471 H2 WAT 2948 104.876 100.287 6.408 1.00 0.00 H TER 1473 WAT 2948 ATOM 1473 O WAT 2949 75.498 110.987 17.544 1.00 0.00 O ATOM 1474 H1 WAT 2949 76.401 110.758 17.764 1.00 0.00 H ATOM 1475 H2 WAT 2949 75.216 110.298 16.943 1.00 0.00 H TER 1477 WAT 2949 ATOM 1477 O WAT 2950 92.637 112.366 118.746 1.00 0.00 O ATOM 1478 H1 WAT 2950 92.385 113.205 119.133 1.00 0.00 H ATOM 1479 H2 WAT 2950 92.381 112.440 117.826 1.00 0.00 H TER 1481 WAT 2950 ATOM 1481 O WAT 2951 110.064 74.003 114.193 1.00 0.00 O ATOM 1482 H1 WAT 2951 109.826 74.149 115.109 1.00 0.00 H ATOM 1483 H2 WAT 2951 109.543 74.640 113.705 1.00 0.00 H TER 1485 WAT 2951 ATOM 1485 O WAT 2952 92.460 46.245 157.453 1.00 0.00 O ATOM 1486 H1 WAT 2952 91.942 45.491 157.735 1.00 0.00 H ATOM 1487 H2 WAT 2952 91.837 46.971 157.437 1.00 0.00 H TER 1489 WAT 2952 ATOM 1489 O WAT 2953 120.090 74.262 135.933 1.00 0.00 O ATOM 1490 H1 WAT 2953 119.501 73.508 135.912 1.00 0.00 H ATOM 1491 H2 WAT 2953 120.813 74.017 135.356 1.00 0.00 H TER 1493 WAT 2953 ATOM 1493 O WAT 2954 10.732 141.666 111.194 1.00 0.00 O ATOM 1494 H1 WAT 2954 10.241 142.418 111.527 1.00 0.00 H ATOM 1495 H2 WAT 2954 10.062 141.012 110.994 1.00 0.00 H TER 1497 WAT 2954 ATOM 1497 O WAT 2955 28.672 101.161 17.889 1.00 0.00 O ATOM 1498 H1 WAT 2955 27.976 101.342 17.256 1.00 0.00 H ATOM 1499 H2 WAT 2955 29.481 101.365 17.420 1.00 0.00 H TER 1501 WAT 2955 ATOM 1501 O WAT 2956 33.171 3.756 64.650 1.00 0.00 O ATOM 1502 H1 WAT 2956 33.688 4.548 64.799 1.00 0.00 H ATOM 1503 H2 WAT 2956 32.726 3.914 63.818 1.00 0.00 H TER 1505 WAT 2956 ATOM 1505 O WAT 2957 21.324 140.737 7.694 1.00 0.00 O ATOM 1506 H1 WAT 2957 20.794 141.498 7.455 1.00 0.00 H ATOM 1507 H2 WAT 2957 21.018 140.498 8.569 1.00 0.00 H TER 1509 WAT 2957 ATOM 1509 O WAT 2958 48.546 60.351 125.685 1.00 0.00 O ATOM 1510 H1 WAT 2958 48.213 60.259 126.578 1.00 0.00 H ATOM 1511 H2 WAT 2958 49.435 59.999 125.724 1.00 0.00 H TER 1513 WAT 2958 ATOM 1513 O WAT 2959 73.234 27.368 6.464 1.00 0.00 O ATOM 1514 H1 WAT 2959 72.847 27.129 7.306 1.00 0.00 H ATOM 1515 H2 WAT 2959 73.923 27.994 6.686 1.00 0.00 H TER 1517 WAT 2959 ATOM 1517 O WAT 2960 90.828 104.683 129.113 1.00 0.00 O ATOM 1518 H1 WAT 2960 90.936 104.546 130.054 1.00 0.00 H ATOM 1519 H2 WAT 2960 91.293 105.501 128.936 1.00 0.00 H TER 1521 WAT 2960 ATOM 1521 O WAT 2961 4.547 55.383 61.494 1.00 0.00 O ATOM 1522 H1 WAT 2961 3.764 55.642 61.980 1.00 0.00 H ATOM 1523 H2 WAT 2961 4.350 55.612 60.585 1.00 0.00 H TER 1525 WAT 2961 ATOM 1525 O WAT 2962 85.399 80.126 63.877 1.00 0.00 O ATOM 1526 H1 WAT 2962 85.387 79.193 63.665 1.00 0.00 H ATOM 1527 H2 WAT 2962 86.017 80.506 63.253 1.00 0.00 H TER 1529 WAT 2962 ATOM 1529 O WAT 2963 79.683 100.168 14.503 1.00 0.00 O ATOM 1530 H1 WAT 2963 79.326 100.891 15.018 1.00 0.00 H ATOM 1531 H2 WAT 2963 79.404 100.352 13.605 1.00 0.00 H TER 1533 WAT 2963 ATOM 1533 O WAT 2964 137.549 50.841 91.208 1.00 0.00 O ATOM 1534 H1 WAT 2964 137.583 49.895 91.346 1.00 0.00 H ATOM 1535 H2 WAT 2964 137.615 51.214 92.088 1.00 0.00 H TER 1537 WAT 2964 ATOM 1537 O WAT 2965 59.212 56.182 135.528 1.00 0.00 O ATOM 1538 H1 WAT 2965 59.823 56.407 136.229 1.00 0.00 H ATOM 1539 H2 WAT 2965 58.685 56.972 135.406 1.00 0.00 H TER 1541 WAT 2965 ATOM 1541 O WAT 2966 88.544 42.230 81.358 1.00 0.00 O ATOM 1542 H1 WAT 2966 88.265 42.479 82.240 1.00 0.00 H ATOM 1543 H2 WAT 2966 88.071 41.417 81.178 1.00 0.00 H TER 1545 WAT 2966 ATOM 1545 O WAT 2967 73.517 79.625 102.909 1.00 0.00 O ATOM 1546 H1 WAT 2967 73.096 78.810 102.636 1.00 0.00 H ATOM 1547 H2 WAT 2967 72.789 80.218 103.100 1.00 0.00 H TER 1549 WAT 2967 ATOM 1549 O WAT 2968 114.938 54.672 94.903 1.00 0.00 O ATOM 1550 H1 WAT 2968 115.150 55.468 95.390 1.00 0.00 H ATOM 1551 H2 WAT 2968 115.681 54.090 95.061 1.00 0.00 H TER 1553 WAT 2968 ATOM 1553 O WAT 2969 105.271 93.755 130.178 1.00 0.00 O ATOM 1554 H1 WAT 2969 104.403 93.771 129.774 1.00 0.00 H ATOM 1555 H2 WAT 2969 105.859 94.075 129.494 1.00 0.00 H TER 1557 WAT 2969 ATOM 1557 O WAT 2970 1.613 107.204 104.499 1.00 0.00 O ATOM 1558 H1 WAT 2970 1.282 108.087 104.335 1.00 0.00 H ATOM 1559 H2 WAT 2970 0.942 106.626 104.136 1.00 0.00 H TER 1561 WAT 2970 ATOM 1561 O WAT 2971 83.062 87.772 106.354 1.00 0.00 O ATOM 1562 H1 WAT 2971 83.113 87.260 107.160 1.00 0.00 H ATOM 1563 H2 WAT 2971 83.075 88.683 106.648 1.00 0.00 H TER 1565 WAT 2971 ATOM 1565 O WAT 2972 75.151 107.206 60.170 1.00 0.00 O ATOM 1566 H1 WAT 2972 75.017 107.941 60.768 1.00 0.00 H ATOM 1567 H2 WAT 2972 75.304 106.455 60.744 1.00 0.00 H TER 1569 WAT 2972 ATOM 1569 O WAT 2973 120.829 71.167 106.763 1.00 0.00 O ATOM 1570 H1 WAT 2973 120.569 71.849 107.383 1.00 0.00 H ATOM 1571 H2 WAT 2973 121.419 71.611 106.153 1.00 0.00 H TER 1573 WAT 2973 ATOM 1573 O WAT 2974 30.601 12.365 67.116 1.00 0.00 O ATOM 1574 H1 WAT 2974 29.856 12.692 66.612 1.00 0.00 H ATOM 1575 H2 WAT 2974 30.749 11.482 66.778 1.00 0.00 H TER 1577 WAT 2974 ATOM 1577 O WAT 2975 84.558 56.484 11.966 1.00 0.00 O ATOM 1578 H1 WAT 2975 85.488 56.695 11.891 1.00 0.00 H ATOM 1579 H2 WAT 2975 84.156 56.895 11.201 1.00 0.00 H TER 1581 WAT 2975 ATOM 1581 O WAT 2976 54.398 85.602 19.289 1.00 0.00 O ATOM 1582 H1 WAT 2976 55.040 85.928 19.920 1.00 0.00 H ATOM 1583 H2 WAT 2976 53.902 84.941 19.771 1.00 0.00 H TER 1585 WAT 2976 ATOM 1585 O WAT 2977 5.449 77.340 98.542 1.00 0.00 O ATOM 1586 H1 WAT 2977 5.293 77.040 97.647 1.00 0.00 H ATOM 1587 H2 WAT 2977 5.299 76.566 99.084 1.00 0.00 H TER 1589 WAT 2977 ATOM 1589 O WAT 2978 121.333 85.816 13.129 1.00 0.00 O ATOM 1590 H1 WAT 2978 121.130 85.981 12.209 1.00 0.00 H ATOM 1591 H2 WAT 2978 120.539 85.415 13.482 1.00 0.00 H TER 1593 WAT 2978 ATOM 1593 O WAT 2979 61.435 66.483 122.333 1.00 0.00 O ATOM 1594 H1 WAT 2979 61.359 65.597 122.687 1.00 0.00 H ATOM 1595 H2 WAT 2979 61.133 67.051 123.041 1.00 0.00 H TER 1597 WAT 2979 ATOM 1597 O WAT 2980 10.188 106.788 59.367 1.00 0.00 O ATOM 1598 H1 WAT 2980 9.929 106.373 60.189 1.00 0.00 H ATOM 1599 H2 WAT 2980 9.403 107.252 59.075 1.00 0.00 H TER 1601 WAT 2980 ATOM 1601 O WAT 2981 121.126 130.215 72.518 1.00 0.00 O ATOM 1602 H1 WAT 2981 121.975 130.071 72.936 1.00 0.00 H ATOM 1603 H2 WAT 2981 121.335 130.663 71.699 1.00 0.00 H TER 1605 WAT 2981 ATOM 1605 O WAT 2982 50.709 135.805 109.710 1.00 0.00 O ATOM 1606 H1 WAT 2982 51.335 136.517 109.840 1.00 0.00 H ATOM 1607 H2 WAT 2982 50.082 136.150 109.075 1.00 0.00 H TER 1609 WAT 2982 ATOM 1609 O WAT 2983 56.802 15.066 0.519 1.00 0.00 O ATOM 1610 H1 WAT 2983 55.929 15.032 0.910 1.00 0.00 H ATOM 1611 H2 WAT 2983 57.073 14.151 0.456 1.00 0.00 H TER 1613 WAT 2983 ATOM 1613 O WAT 2984 126.138 59.428 90.838 1.00 0.00 O ATOM 1614 H1 WAT 2984 125.553 60.150 91.067 1.00 0.00 H ATOM 1615 H2 WAT 2984 125.971 59.270 89.909 1.00 0.00 H TER 1617 WAT 2984 ATOM 1617 O WAT 2985 40.176 95.861 89.128 1.00 0.00 O ATOM 1618 H1 WAT 2985 39.226 95.877 89.010 1.00 0.00 H ATOM 1619 H2 WAT 2985 40.348 96.540 89.780 1.00 0.00 H TER 1621 WAT 2985 ATOM 1621 O WAT 2986 32.998 5.089 59.884 1.00 0.00 O ATOM 1622 H1 WAT 2986 33.555 5.862 59.786 1.00 0.00 H ATOM 1623 H2 WAT 2986 33.396 4.433 59.311 1.00 0.00 H TER 1625 WAT 2986 ATOM 1625 O WAT 2987 23.817 70.457 158.859 1.00 0.00 O ATOM 1626 H1 WAT 2987 23.194 70.454 158.132 1.00 0.00 H ATOM 1627 H2 WAT 2987 24.676 70.429 158.437 1.00 0.00 H TER 1629 WAT 2987 ATOM 1629 O WAT 2988 5.334 13.016 5.587 1.00 0.00 O ATOM 1630 H1 WAT 2988 5.054 13.923 5.711 1.00 0.00 H ATOM 1631 H2 WAT 2988 4.867 12.527 6.264 1.00 0.00 H TER 1633 WAT 2988 ATOM 1633 O WAT 2989 50.494 96.934 106.212 1.00 0.00 O ATOM 1634 H1 WAT 2989 49.839 96.543 105.633 1.00 0.00 H ATOM 1635 H2 WAT 2989 51.285 96.988 105.677 1.00 0.00 H TER 1637 WAT 2989 ATOM 1637 O WAT 2990 24.874 130.875 148.063 1.00 0.00 O ATOM 1638 H1 WAT 2990 24.099 131.415 147.912 1.00 0.00 H ATOM 1639 H2 WAT 2990 25.410 131.388 148.668 1.00 0.00 H TER 1641 WAT 2990 ATOM 1641 O WAT 2991 58.951 112.931 73.550 1.00 0.00 O ATOM 1642 H1 WAT 2991 59.830 113.287 73.676 1.00 0.00 H ATOM 1643 H2 WAT 2991 58.813 112.963 72.603 1.00 0.00 H TER 1645 WAT 2991 ATOM 1645 O WAT 2992 122.481 49.136 58.676 1.00 0.00 O ATOM 1646 H1 WAT 2992 121.734 49.346 58.116 1.00 0.00 H ATOM 1647 H2 WAT 2992 123.246 49.284 58.119 1.00 0.00 H TER 1649 WAT 2992 ATOM 1649 O WAT 2993 117.551 114.891 88.078 1.00 0.00 O ATOM 1650 H1 WAT 2993 117.470 114.075 87.583 1.00 0.00 H ATOM 1651 H2 WAT 2993 117.180 114.689 88.936 1.00 0.00 H TER 1653 WAT 2993 ATOM 1653 O WAT 2994 141.376 90.119 75.993 1.00 0.00 O ATOM 1654 H1 WAT 2994 140.879 89.333 75.767 1.00 0.00 H ATOM 1655 H2 WAT 2994 140.745 90.834 75.911 1.00 0.00 H TER 1657 WAT 2994 ATOM 1657 O WAT 2995 106.401 6.593 144.826 1.00 0.00 O ATOM 1658 H1 WAT 2995 106.161 6.867 143.940 1.00 0.00 H ATOM 1659 H2 WAT 2995 106.744 7.386 145.237 1.00 0.00 H TER 1661 WAT 2995 ATOM 1661 O WAT 2996 96.578 100.139 18.275 1.00 0.00 O ATOM 1662 H1 WAT 2996 95.645 100.110 18.488 1.00 0.00 H ATOM 1663 H2 WAT 2996 96.634 100.730 17.523 1.00 0.00 H TER 1665 WAT 2996 ATOM 1665 O WAT 2997 43.335 144.569 137.290 1.00 0.00 O ATOM 1666 H1 WAT 2997 43.292 144.270 138.199 1.00 0.00 H ATOM 1667 H2 WAT 2997 42.665 145.250 137.230 1.00 0.00 H TER 1669 WAT 2997 ATOM 1669 O WAT 2998 77.376 116.079 154.514 1.00 0.00 O ATOM 1670 H1 WAT 2998 78.179 115.662 154.202 1.00 0.00 H ATOM 1671 H2 WAT 2998 77.561 116.299 155.427 1.00 0.00 H TER 1673 WAT 2998 ATOM 1673 O WAT 2999 92.980 107.460 90.553 1.00 0.00 O ATOM 1674 H1 WAT 2999 92.136 107.267 90.143 1.00 0.00 H ATOM 1675 H2 WAT 2999 93.465 107.946 89.886 1.00 0.00 H TER 1677 WAT 2999 ATOM 1677 O WAT 3000 41.420 89.161 131.083 1.00 0.00 O ATOM 1678 H1 WAT 3000 42.222 89.231 131.601 1.00 0.00 H ATOM 1679 H2 WAT 3000 41.474 89.884 130.458 1.00 0.00 H TER 1681 WAT 3000 ATOM 1681 O WAT 3001 123.968 114.311 5.086 1.00 0.00 O ATOM 1682 H1 WAT 3001 124.753 113.886 4.742 1.00 0.00 H ATOM 1683 H2 WAT 3001 123.922 115.145 4.618 1.00 0.00 H TER 1685 WAT 3001 ATOM 1685 O WAT 3002 105.982 32.984 116.518 1.00 0.00 O ATOM 1686 H1 WAT 3002 106.276 33.354 117.351 1.00 0.00 H ATOM 1687 H2 WAT 3002 106.755 33.015 115.955 1.00 0.00 H TER 1689 WAT 3002 ATOM 1689 O WAT 3003 27.336 81.620 155.824 1.00 0.00 O ATOM 1690 H1 WAT 3003 26.918 81.848 156.655 1.00 0.00 H ATOM 1691 H2 WAT 3003 27.202 82.389 155.270 1.00 0.00 H TER 1693 WAT 3003 ATOM 1693 O WAT 3004 2.504 3.925 109.161 1.00 0.00 O ATOM 1694 H1 WAT 3004 2.462 4.717 108.625 1.00 0.00 H ATOM 1695 H2 WAT 3004 2.368 4.235 110.057 1.00 0.00 H TER 1697 WAT 3004 ATOM 1697 O WAT 3005 4.334 14.309 55.696 1.00 0.00 O ATOM 1698 H1 WAT 3005 4.224 13.493 55.208 1.00 0.00 H ATOM 1699 H2 WAT 3005 3.566 14.355 56.264 1.00 0.00 H TER 1701 WAT 3005 ATOM 1701 O WAT 3006 65.433 60.198 93.360 1.00 0.00 O ATOM 1702 H1 WAT 3006 64.790 60.503 92.721 1.00 0.00 H ATOM 1703 H2 WAT 3006 65.102 60.512 94.202 1.00 0.00 H TER 1705 WAT 3006 ATOM 1705 O WAT 3007 114.986 127.691 141.841 1.00 0.00 O ATOM 1706 H1 WAT 3007 115.111 127.089 142.574 1.00 0.00 H ATOM 1707 H2 WAT 3007 114.289 127.293 141.320 1.00 0.00 H TER 1709 WAT 3007 ATOM 1709 O WAT 3008 85.891 137.346 127.036 1.00 0.00 O ATOM 1710 H1 WAT 3008 85.854 138.111 127.610 1.00 0.00 H ATOM 1711 H2 WAT 3008 85.398 136.672 127.503 1.00 0.00 H TER 1713 WAT 3008 ATOM 1713 O WAT 3009 53.471 137.034 4.638 1.00 0.00 O ATOM 1714 H1 WAT 3009 53.491 136.078 4.610 1.00 0.00 H ATOM 1715 H2 WAT 3009 52.556 137.260 4.474 1.00 0.00 H TER 1717 WAT 3009 ATOM 1717 O WAT 3010 52.056 37.531 73.516 1.00 0.00 O ATOM 1718 H1 WAT 3010 52.870 37.032 73.585 1.00 0.00 H ATOM 1719 H2 WAT 3010 51.518 37.214 74.241 1.00 0.00 H TER 1721 WAT 3010 ATOM 1721 O WAT 3011 112.483 17.316 51.545 1.00 0.00 O ATOM 1722 H1 WAT 3011 113.221 17.015 51.016 1.00 0.00 H ATOM 1723 H2 WAT 3011 112.851 18.002 52.101 1.00 0.00 H TER 1725 WAT 3011 ATOM 1725 O WAT 3012 57.462 1.304 146.871 1.00 0.00 O ATOM 1726 H1 WAT 3012 58.237 1.423 146.323 1.00 0.00 H ATOM 1727 H2 WAT 3012 57.039 0.520 146.521 1.00 0.00 H TER 1729 WAT 3012 ATOM 1729 O WAT 3013 107.343 52.103 9.257 1.00 0.00 O ATOM 1730 H1 WAT 3013 106.899 51.579 9.923 1.00 0.00 H ATOM 1731 H2 WAT 3013 108.100 51.576 9.003 1.00 0.00 H TER 1733 WAT 3013 ATOM 1733 O WAT 3014 37.908 33.738 120.224 1.00 0.00 O ATOM 1734 H1 WAT 3014 37.936 32.856 120.595 1.00 0.00 H ATOM 1735 H2 WAT 3014 38.455 33.685 119.440 1.00 0.00 H TER 1737 WAT 3014 ATOM 1737 O WAT 3015 8.832 95.997 74.125 1.00 0.00 O ATOM 1738 H1 WAT 3015 8.695 95.504 73.316 1.00 0.00 H ATOM 1739 H2 WAT 3015 8.153 96.672 74.112 1.00 0.00 H TER 1741 WAT 3015 ATOM 1741 O WAT 3016 83.631 131.174 15.782 1.00 0.00 O ATOM 1742 H1 WAT 3016 83.573 131.032 16.727 1.00 0.00 H ATOM 1743 H2 WAT 3016 84.458 131.642 15.661 1.00 0.00 H TER 1745 WAT 3016 ATOM 1745 O WAT 3017 97.439 18.335 53.623 1.00 0.00 O ATOM 1746 H1 WAT 3017 96.679 17.963 54.070 1.00 0.00 H ATOM 1747 H2 WAT 3017 97.101 19.115 53.184 1.00 0.00 H TER 1749 WAT 3017 ATOM 1749 O WAT 3018 48.332 20.656 95.163 1.00 0.00 O ATOM 1750 H1 WAT 3018 47.481 20.597 95.598 1.00 0.00 H ATOM 1751 H2 WAT 3018 48.969 20.636 95.878 1.00 0.00 H TER 1753 WAT 3018 ATOM 1753 O WAT 3019 105.126 77.269 113.811 1.00 0.00 O ATOM 1754 H1 WAT 3019 104.287 77.227 113.351 1.00 0.00 H ATOM 1755 H2 WAT 3019 105.494 78.116 113.561 1.00 0.00 H TER 1757 WAT 3019 ATOM 1757 O WAT 3020 41.162 80.603 74.673 1.00 0.00 O ATOM 1758 H1 WAT 3020 40.295 80.939 74.905 1.00 0.00 H ATOM 1759 H2 WAT 3020 41.378 81.045 73.852 1.00 0.00 H TER 1761 WAT 3020 ATOM 1761 O WAT 3021 10.891 113.717 155.768 1.00 0.00 O ATOM 1762 H1 WAT 3021 10.462 113.056 156.312 1.00 0.00 H ATOM 1763 H2 WAT 3021 10.534 114.550 156.077 1.00 0.00 H TER 1765 WAT 3021 ATOM 1765 O WAT 3022 59.945 32.396 10.206 1.00 0.00 O ATOM 1766 H1 WAT 3022 59.488 31.773 10.773 1.00 0.00 H ATOM 1767 H2 WAT 3022 60.475 31.848 9.627 1.00 0.00 H TER 1769 WAT 3022 ATOM 1769 O WAT 3023 74.496 123.735 101.037 1.00 0.00 O ATOM 1770 H1 WAT 3023 75.105 122.998 101.090 1.00 0.00 H ATOM 1771 H2 WAT 3023 73.705 123.424 101.478 1.00 0.00 H TER 1773 WAT 3023 ATOM 1773 O WAT 3024 3.116 137.879 110.595 1.00 0.00 O ATOM 1774 H1 WAT 3024 4.053 137.721 110.712 1.00 0.00 H ATOM 1775 H2 WAT 3024 2.922 137.535 109.723 1.00 0.00 H TER 1777 WAT 3024 ATOM 1777 O WAT 3025 19.468 70.532 131.652 1.00 0.00 O ATOM 1778 H1 WAT 3025 19.002 71.304 131.974 1.00 0.00 H ATOM 1779 H2 WAT 3025 19.961 70.849 130.896 1.00 0.00 H TER 1781 WAT 3025 ATOM 1781 O WAT 3026 32.048 133.381 101.364 1.00 0.00 O ATOM 1782 H1 WAT 3026 31.505 133.966 100.836 1.00 0.00 H ATOM 1783 H2 WAT 3026 31.477 132.641 101.566 1.00 0.00 H TER 1785 WAT 3026 ATOM 1785 O WAT 3027 8.595 82.240 103.155 1.00 0.00 O ATOM 1786 H1 WAT 3027 7.757 81.794 103.276 1.00 0.00 H ATOM 1787 H2 WAT 3027 8.356 83.140 102.931 1.00 0.00 H TER 1789 WAT 3027 ATOM 1789 O WAT 3028 141.536 83.659 113.581 1.00 0.00 O ATOM 1790 H1 WAT 3028 140.955 84.052 114.232 1.00 0.00 H ATOM 1791 H2 WAT 3028 140.987 83.024 113.121 1.00 0.00 H TER 1793 WAT 3028 ATOM 1793 O WAT 3029 115.936 90.279 16.991 1.00 0.00 O ATOM 1794 H1 WAT 3029 116.036 89.835 16.149 1.00 0.00 H ATOM 1795 H2 WAT 3029 115.441 89.661 17.529 1.00 0.00 H TER 1797 WAT 3029 ATOM 1797 O WAT 3030 87.977 124.920 4.694 1.00 0.00 O ATOM 1798 H1 WAT 3030 87.806 125.138 5.610 1.00 0.00 H ATOM 1799 H2 WAT 3030 88.785 125.387 4.483 1.00 0.00 H TER 1801 WAT 3030 ATOM 1801 O WAT 3031 83.182 133.424 129.332 1.00 0.00 O ATOM 1802 H1 WAT 3031 83.348 134.045 130.041 1.00 0.00 H ATOM 1803 H2 WAT 3031 82.678 132.721 129.742 1.00 0.00 H TER 1805 WAT 3031 ATOM 1805 O WAT 3032 95.798 13.112 125.951 1.00 0.00 O ATOM 1806 H1 WAT 3032 96.123 12.296 125.572 1.00 0.00 H ATOM 1807 H2 WAT 3032 94.862 13.114 125.750 1.00 0.00 H TER 1809 WAT 3032 ATOM 1809 O WAT 3033 28.626 12.002 104.899 1.00 0.00 O ATOM 1810 H1 WAT 3033 27.812 12.117 105.390 1.00 0.00 H ATOM 1811 H2 WAT 3033 28.621 11.081 104.639 1.00 0.00 H TER 1813 WAT 3033 ATOM 1813 O WAT 3034 143.748 99.043 108.416 1.00 0.00 O ATOM 1814 H1 WAT 3034 143.489 98.122 108.397 1.00 0.00 H ATOM 1815 H2 WAT 3034 143.021 99.505 107.999 1.00 0.00 H TER 1817 WAT 3034 ATOM 1817 O WAT 3035 101.218 39.026 103.464 1.00 0.00 O ATOM 1818 H1 WAT 3035 101.536 39.362 102.626 1.00 0.00 H ATOM 1819 H2 WAT 3035 100.626 38.312 103.227 1.00 0.00 H TER 1821 WAT 3035 ATOM 1821 O WAT 3036 23.821 91.704 113.301 1.00 0.00 O ATOM 1822 H1 WAT 3036 24.622 91.342 112.921 1.00 0.00 H ATOM 1823 H2 WAT 3036 23.113 91.286 112.810 1.00 0.00 H TER 1825 WAT 3036 ATOM 1825 O WAT 3037 3.303 15.343 0.145 1.00 0.00 O ATOM 1826 H1 WAT 3037 3.507 16.079 0.722 1.00 0.00 H ATOM 1827 H2 WAT 3037 2.423 15.531 -0.181 1.00 0.00 H TER 1829 WAT 3037 ATOM 1829 O WAT 3038 81.307 103.306 146.624 1.00 0.00 O ATOM 1830 H1 WAT 3038 81.573 104.085 147.112 1.00 0.00 H ATOM 1831 H2 WAT 3038 82.128 102.930 146.307 1.00 0.00 H TER 1833 WAT 3038 ATOM 1833 O WAT 3039 141.850 69.661 126.874 1.00 0.00 O ATOM 1834 H1 WAT 3039 141.775 68.955 126.232 1.00 0.00 H ATOM 1835 H2 WAT 3039 142.793 69.759 127.012 1.00 0.00 H TER 1837 WAT 3039 ATOM 1837 O WAT 3040 129.125 97.125 78.264 1.00 0.00 O ATOM 1838 H1 WAT 3040 129.531 97.459 79.065 1.00 0.00 H ATOM 1839 H2 WAT 3040 128.323 97.640 78.171 1.00 0.00 H TER 1841 WAT 3040 ATOM 1841 O WAT 3041 31.898 89.194 115.956 1.00 0.00 O ATOM 1842 H1 WAT 3041 32.718 88.843 116.302 1.00 0.00 H ATOM 1843 H2 WAT 3041 31.543 89.723 116.671 1.00 0.00 H TER 1845 WAT 3041 ATOM 1845 O WAT 3042 107.866 139.979 121.918 1.00 0.00 O ATOM 1846 H1 WAT 3042 108.644 140.452 122.215 1.00 0.00 H ATOM 1847 H2 WAT 3042 107.710 139.323 122.598 1.00 0.00 H TER 1849 WAT 3042 ATOM 1849 O WAT 3043 123.023 18.650 14.417 1.00 0.00 O ATOM 1850 H1 WAT 3043 123.546 19.450 14.469 1.00 0.00 H ATOM 1851 H2 WAT 3043 123.041 18.412 13.490 1.00 0.00 H TER 1853 WAT 3043 ATOM 1853 O WAT 3044 138.534 38.435 73.560 1.00 0.00 O ATOM 1854 H1 WAT 3044 138.985 38.124 72.774 1.00 0.00 H ATOM 1855 H2 WAT 3044 139.220 38.856 74.079 1.00 0.00 H TER 1857 WAT 3044 ATOM 1857 O WAT 3045 143.471 31.709 121.522 1.00 0.00 O ATOM 1858 H1 WAT 3045 143.414 32.536 121.043 1.00 0.00 H ATOM 1859 H2 WAT 3045 143.833 31.089 120.889 1.00 0.00 H TER 1861 WAT 3045 ATOM 1861 O WAT 3046 101.319 120.288 82.344 1.00 0.00 O ATOM 1862 H1 WAT 3046 100.711 119.869 82.953 1.00 0.00 H ATOM 1863 H2 WAT 3046 101.557 121.111 82.770 1.00 0.00 H TER 1865 WAT 3046 ATOM 1865 O WAT 3047 16.244 48.030 63.832 1.00 0.00 O ATOM 1866 H1 WAT 3047 16.735 47.524 63.184 1.00 0.00 H ATOM 1867 H2 WAT 3047 15.650 47.395 64.232 1.00 0.00 H TER 1869 WAT 3047 ATOM 1869 O WAT 3048 30.315 30.365 90.097 1.00 0.00 O ATOM 1870 H1 WAT 3048 30.153 31.172 89.609 1.00 0.00 H ATOM 1871 H2 WAT 3048 31.175 30.071 89.794 1.00 0.00 H TER 1873 WAT 3048 ATOM 1873 O WAT 3049 2.541 121.134 77.198 1.00 0.00 O ATOM 1874 H1 WAT 3049 3.484 121.086 77.354 1.00 0.00 H ATOM 1875 H2 WAT 3049 2.152 121.106 78.072 1.00 0.00 H TER 1877 WAT 3049 ATOM 1877 O WAT 3050 65.211 83.631 121.139 1.00 0.00 O ATOM 1878 H1 WAT 3050 65.932 84.135 120.761 1.00 0.00 H ATOM 1879 H2 WAT 3050 64.508 84.270 121.256 1.00 0.00 H TER 1881 WAT 3050 ATOM 1881 O WAT 3051 145.934 97.845 19.595 1.00 0.00 O ATOM 1882 H1 WAT 3051 146.433 97.679 20.395 1.00 0.00 H ATOM 1883 H2 WAT 3051 145.030 97.943 19.894 1.00 0.00 H TER 1885 WAT 3051 ATOM 1885 O WAT 3052 131.787 19.088 156.709 1.00 0.00 O ATOM 1886 H1 WAT 3052 131.066 18.787 157.262 1.00 0.00 H ATOM 1887 H2 WAT 3052 132.526 19.185 157.309 1.00 0.00 H TER 1889 WAT 3052 ATOM 1889 O WAT 3053 48.324 93.806 136.593 1.00 0.00 O ATOM 1890 H1 WAT 3053 47.540 93.325 136.856 1.00 0.00 H ATOM 1891 H2 WAT 3053 48.990 93.129 136.468 1.00 0.00 H TER 1893 WAT 3053 ATOM 1893 O WAT 3054 38.661 42.110 142.308 1.00 0.00 O ATOM 1894 H1 WAT 3054 38.306 42.219 143.190 1.00 0.00 H ATOM 1895 H2 WAT 3054 39.528 41.728 142.445 1.00 0.00 H TER 1897 WAT 3054 ATOM 1897 O WAT 3055 92.083 33.185 71.436 1.00 0.00 O ATOM 1898 H1 WAT 3055 91.299 33.029 70.910 1.00 0.00 H ATOM 1899 H2 WAT 3055 92.779 32.720 70.972 1.00 0.00 H TER 1901 WAT 3055 ATOM 1901 O WAT 3056 63.185 34.727 20.096 1.00 0.00 O ATOM 1902 H1 WAT 3056 63.439 34.999 20.979 1.00 0.00 H ATOM 1903 H2 WAT 3056 62.478 34.097 20.234 1.00 0.00 H TER 1905 WAT 3056 ATOM 1905 O WAT 3057 51.280 133.256 108.227 1.00 0.00 O ATOM 1906 H1 WAT 3057 51.109 134.146 108.533 1.00 0.00 H ATOM 1907 H2 WAT 3057 51.792 133.371 107.427 1.00 0.00 H TER 1909 WAT 3057 ATOM 1909 O WAT 3058 101.618 101.244 2.902 1.00 0.00 O ATOM 1910 H1 WAT 3058 101.844 101.853 3.606 1.00 0.00 H ATOM 1911 H2 WAT 3058 102.136 100.461 3.087 1.00 0.00 H TER 1913 WAT 3058 ATOM 1913 O WAT 3059 77.563 74.306 99.984 1.00 0.00 O ATOM 1914 H1 WAT 3059 76.940 74.187 100.701 1.00 0.00 H ATOM 1915 H2 WAT 3059 78.367 74.602 100.412 1.00 0.00 H TER 1917 WAT 3059 ATOM 1917 O WAT 3060 117.495 48.784 87.823 1.00 0.00 O ATOM 1918 H1 WAT 3060 116.731 49.279 88.118 1.00 0.00 H ATOM 1919 H2 WAT 3060 117.392 48.726 86.873 1.00 0.00 H TER 1921 WAT 3060 ATOM 1921 O WAT 3061 59.914 7.154 63.202 1.00 0.00 O ATOM 1922 H1 WAT 3061 59.044 7.267 62.818 1.00 0.00 H ATOM 1923 H2 WAT 3061 60.233 6.331 62.833 1.00 0.00 H TER 1925 WAT 3061 ATOM 1925 O WAT 3062 26.770 44.723 106.988 1.00 0.00 O ATOM 1926 H1 WAT 3062 26.349 45.540 106.721 1.00 0.00 H ATOM 1927 H2 WAT 3062 27.020 44.871 107.901 1.00 0.00 H TER 1929 WAT 3062 ATOM 1929 O WAT 3063 31.073 5.216 73.144 1.00 0.00 O ATOM 1930 H1 WAT 3063 30.638 5.967 72.740 1.00 0.00 H ATOM 1931 H2 WAT 3063 31.981 5.277 72.847 1.00 0.00 H TER 1933 WAT 3063 ATOM 1933 O WAT 3064 55.606 1.593 2.850 1.00 0.00 O ATOM 1934 H1 WAT 3064 55.765 1.940 3.728 1.00 0.00 H ATOM 1935 H2 WAT 3064 55.650 0.642 2.957 1.00 0.00 H TER 1937 WAT 3064 ATOM 1937 O WAT 3065 6.595 62.960 113.943 1.00 0.00 O ATOM 1938 H1 WAT 3065 6.863 62.631 113.085 1.00 0.00 H ATOM 1939 H2 WAT 3065 5.724 62.589 114.081 1.00 0.00 H TER 1941 WAT 3065 ATOM 1941 O WAT 3066 129.625 34.698 128.803 1.00 0.00 O ATOM 1942 H1 WAT 3066 130.404 34.587 129.349 1.00 0.00 H ATOM 1943 H2 WAT 3066 128.907 34.795 129.429 1.00 0.00 H TER 1945 WAT 3066 ATOM 1945 O WAT 3067 141.070 121.979 66.481 1.00 0.00 O ATOM 1946 H1 WAT 3067 140.670 122.342 65.690 1.00 0.00 H ATOM 1947 H2 WAT 3067 141.714 122.636 66.746 1.00 0.00 H TER 1949 WAT 3067 ATOM 1949 O WAT 3068 100.086 37.230 51.930 1.00 0.00 O ATOM 1950 H1 WAT 3068 100.311 37.533 52.810 1.00 0.00 H ATOM 1951 H2 WAT 3068 99.590 37.954 51.547 1.00 0.00 H TER 1953 WAT 3068 ATOM 1953 O WAT 3069 63.717 40.009 154.309 1.00 0.00 O ATOM 1954 H1 WAT 3069 64.039 39.333 154.905 1.00 0.00 H ATOM 1955 H2 WAT 3069 64.502 40.491 154.048 1.00 0.00 H TER 1957 WAT 3069 ATOM 1957 O WAT 3070 67.192 145.803 78.948 1.00 0.00 O ATOM 1958 H1 WAT 3070 67.916 146.065 78.379 1.00 0.00 H ATOM 1959 H2 WAT 3070 66.592 145.331 78.370 1.00 0.00 H TER 1961 WAT 3070 ATOM 1961 O WAT 3071 18.091 50.738 124.331 1.00 0.00 O ATOM 1962 H1 WAT 3071 18.196 51.504 124.895 1.00 0.00 H ATOM 1963 H2 WAT 3071 18.238 51.071 123.446 1.00 0.00 H TER 1965 WAT 3071 ATOM 1965 O WAT 3072 69.381 104.384 130.368 1.00 0.00 O ATOM 1966 H1 WAT 3072 69.918 105.168 130.253 1.00 0.00 H ATOM 1967 H2 WAT 3072 69.979 103.735 130.738 1.00 0.00 H TER 1969 WAT 3072 ATOM 1969 O WAT 3073 58.797 41.860 11.058 1.00 0.00 O ATOM 1970 H1 WAT 3073 59.217 41.037 10.806 1.00 0.00 H ATOM 1971 H2 WAT 3073 58.324 41.651 11.863 1.00 0.00 H TER 1973 WAT 3073 ATOM 1973 O WAT 3074 139.627 77.509 133.705 1.00 0.00 O ATOM 1974 H1 WAT 3074 139.829 78.429 133.872 1.00 0.00 H ATOM 1975 H2 WAT 3074 139.182 77.511 132.858 1.00 0.00 H TER 1977 WAT 3074 ATOM 1977 O WAT 3075 36.305 101.216 129.115 1.00 0.00 O ATOM 1978 H1 WAT 3075 36.513 101.888 128.465 1.00 0.00 H ATOM 1979 H2 WAT 3075 37.067 100.637 129.112 1.00 0.00 H TER 1981 WAT 3075 ATOM 1981 O WAT 3076 1.537 8.322 153.128 1.00 0.00 O ATOM 1982 H1 WAT 3076 0.705 7.857 153.211 1.00 0.00 H ATOM 1983 H2 WAT 3076 2.031 8.072 153.909 1.00 0.00 H TER 1985 WAT 3076 ATOM 1985 O WAT 3077 47.183 30.394 23.741 1.00 0.00 O ATOM 1986 H1 WAT 3077 47.655 30.288 24.567 1.00 0.00 H ATOM 1987 H2 WAT 3077 46.868 31.298 23.760 1.00 0.00 H TER 1989 WAT 3077 ATOM 1989 O WAT 3078 74.252 8.265 123.690 1.00 0.00 O ATOM 1990 H1 WAT 3078 73.579 7.790 124.177 1.00 0.00 H ATOM 1991 H2 WAT 3078 74.366 7.760 122.884 1.00 0.00 H TER 1993 WAT 3078 ATOM 1993 O WAT 3079 3.313 97.567 102.640 1.00 0.00 O ATOM 1994 H1 WAT 3079 3.527 96.931 103.322 1.00 0.00 H ATOM 1995 H2 WAT 3079 3.316 98.412 103.091 1.00 0.00 H TER 1997 WAT 3079 ATOM 1997 O WAT 3080 142.031 122.245 79.656 1.00 0.00 O ATOM 1998 H1 WAT 3080 141.956 123.196 79.575 1.00 0.00 H ATOM 1999 H2 WAT 3080 142.043 121.927 78.754 1.00 0.00 H TER 2001 WAT 3080 ATOM 2001 O WAT 3081 18.788 50.019 62.272 1.00 0.00 O ATOM 2002 H1 WAT 3081 19.499 49.404 62.453 1.00 0.00 H ATOM 2003 H2 WAT 3081 18.868 50.211 61.338 1.00 0.00 H TER 2005 WAT 3081 ATOM 2005 O WAT 3082 78.521 24.651 134.494 1.00 0.00 O ATOM 2006 H1 WAT 3082 79.082 25.364 134.798 1.00 0.00 H ATOM 2007 H2 WAT 3082 78.373 24.114 135.272 1.00 0.00 H TER 2009 WAT 3082 ATOM 2009 O WAT 3083 141.712 13.633 78.703 1.00 0.00 O ATOM 2010 H1 WAT 3083 141.038 14.216 78.353 1.00 0.00 H ATOM 2011 H2 WAT 3083 142.450 14.211 78.898 1.00 0.00 H TER 2013 WAT 3083 ATOM 2013 O WAT 3084 4.078 18.258 156.214 1.00 0.00 O ATOM 2014 H1 WAT 3084 4.710 17.539 156.234 1.00 0.00 H ATOM 2015 H2 WAT 3084 3.276 17.863 155.874 1.00 0.00 H TER 2017 WAT 3084 ATOM 2017 O WAT 3085 67.404 140.695 157.208 1.00 0.00 O ATOM 2018 H1 WAT 3085 67.761 140.530 158.081 1.00 0.00 H ATOM 2019 H2 WAT 3085 67.566 141.626 157.055 1.00 0.00 H TER 2021 WAT 3085 ATOM 2021 O WAT 3086 130.365 117.326 66.594 1.00 0.00 O ATOM 2022 H1 WAT 3086 130.622 116.444 66.326 1.00 0.00 H ATOM 2023 H2 WAT 3086 130.519 117.866 65.819 1.00 0.00 H TER 2025 WAT 3086 ATOM 2025 O WAT 3087 49.963 112.519 152.358 1.00 0.00 O ATOM 2026 H1 WAT 3087 50.543 111.838 152.018 1.00 0.00 H ATOM 2027 H2 WAT 3087 49.477 112.090 153.062 1.00 0.00 H TER 2029 WAT 3087 ATOM 2029 O WAT 3088 65.846 63.424 17.863 1.00 0.00 O ATOM 2030 H1 WAT 3088 65.766 63.788 18.744 1.00 0.00 H ATOM 2031 H2 WAT 3088 65.513 64.113 17.288 1.00 0.00 H TER 2033 WAT 3088 ATOM 2033 O WAT 3089 61.888 22.300 157.203 1.00 0.00 O ATOM 2034 H1 WAT 3089 62.007 21.395 156.915 1.00 0.00 H ATOM 2035 H2 WAT 3089 62.434 22.814 156.609 1.00 0.00 H TER 2037 WAT 3089 ATOM 2037 O WAT 3090 120.959 2.742 104.981 1.00 0.00 O ATOM 2038 H1 WAT 3090 120.615 2.366 104.170 1.00 0.00 H ATOM 2039 H2 WAT 3090 120.185 2.893 105.523 1.00 0.00 H TER 2041 WAT 3090 ATOM 2041 O WAT 3091 47.919 58.155 144.750 1.00 0.00 O ATOM 2042 H1 WAT 3091 48.048 57.975 143.819 1.00 0.00 H ATOM 2043 H2 WAT 3091 47.984 57.298 145.171 1.00 0.00 H TER 2045 WAT 3091 ATOM 2045 O WAT 3092 113.299 100.845 2.084 1.00 0.00 O ATOM 2046 H1 WAT 3092 113.886 100.089 2.063 1.00 0.00 H ATOM 2047 H2 WAT 3092 113.478 101.264 2.926 1.00 0.00 H TER 2049 WAT 3092 ATOM 2049 O WAT 3093 93.251 21.601 92.980 1.00 0.00 O ATOM 2050 H1 WAT 3093 93.923 21.023 92.618 1.00 0.00 H ATOM 2051 H2 WAT 3093 93.690 22.446 93.079 1.00 0.00 H TER 2053 WAT 3093 ATOM 2053 O WAT 3094 143.218 88.115 108.794 1.00 0.00 O ATOM 2054 H1 WAT 3094 144.097 88.324 108.478 1.00 0.00 H ATOM 2055 H2 WAT 3094 142.769 87.753 108.031 1.00 0.00 H TER 2057 WAT 3094 ATOM 2057 O WAT 3095 89.126 33.384 10.919 1.00 0.00 O ATOM 2058 H1 WAT 3095 88.800 34.249 10.672 1.00 0.00 H ATOM 2059 H2 WAT 3095 88.715 32.786 10.295 1.00 0.00 H TER 2061 WAT 3095 ATOM 2061 O WAT 3096 27.625 20.580 3.237 1.00 0.00 O ATOM 2062 H1 WAT 3096 28.027 21.028 3.981 1.00 0.00 H ATOM 2063 H2 WAT 3096 27.063 21.241 2.834 1.00 0.00 H TER 2065 WAT 3096 ATOM 2065 O WAT 3097 137.750 20.089 95.171 1.00 0.00 O ATOM 2066 H1 WAT 3097 137.509 19.303 94.681 1.00 0.00 H ATOM 2067 H2 WAT 3097 138.692 20.004 95.312 1.00 0.00 H TER 2069 WAT 3097 ATOM 2069 O WAT 3098 51.958 26.876 57.325 1.00 0.00 O ATOM 2070 H1 WAT 3098 52.574 27.560 57.062 1.00 0.00 H ATOM 2071 H2 WAT 3098 51.338 26.819 56.598 1.00 0.00 H TER 2073 WAT 3098 ATOM 2073 O WAT 3099 30.739 94.756 122.709 1.00 0.00 O ATOM 2074 H1 WAT 3099 30.424 94.466 121.853 1.00 0.00 H ATOM 2075 H2 WAT 3099 30.920 95.689 122.594 1.00 0.00 H TER 2077 WAT 3099 ATOM 2077 O WAT 3100 93.942 143.778 2.012 1.00 0.00 O ATOM 2078 H1 WAT 3100 93.057 144.125 1.899 1.00 0.00 H ATOM 2079 H2 WAT 3100 93.908 143.298 2.840 1.00 0.00 H TER 2081 WAT 3100 ATOM 2081 O WAT 3101 40.962 131.927 158.536 1.00 0.00 O ATOM 2082 H1 WAT 3101 40.651 132.612 157.944 1.00 0.00 H ATOM 2083 H2 WAT 3101 40.826 131.112 158.052 1.00 0.00 H TER 2085 WAT 3101 ATOM 2085 O WAT 3102 55.564 58.199 12.543 1.00 0.00 O ATOM 2086 H1 WAT 3102 56.086 58.882 12.964 1.00 0.00 H ATOM 2087 H2 WAT 3102 54.752 58.638 12.292 1.00 0.00 H TER 2089 WAT 3102 ATOM 2089 O WAT 3103 26.542 40.936 114.057 1.00 0.00 O ATOM 2090 H1 WAT 3103 26.787 41.348 113.229 1.00 0.00 H ATOM 2091 H2 WAT 3103 26.401 41.670 114.656 1.00 0.00 H TER 2093 WAT 3103 ATOM 2093 O WAT 3104 88.430 44.758 67.865 1.00 0.00 O ATOM 2094 H1 WAT 3104 88.661 45.677 68.004 1.00 0.00 H ATOM 2095 H2 WAT 3104 88.373 44.667 66.914 1.00 0.00 H TER 2097 WAT 3104 ATOM 2097 O WAT 3105 54.021 19.603 102.412 1.00 0.00 O ATOM 2098 H1 WAT 3105 53.781 19.739 103.329 1.00 0.00 H ATOM 2099 H2 WAT 3105 54.554 20.366 102.188 1.00 0.00 H TER 2101 WAT 3105 ATOM 2101 O WAT 3106 134.705 134.009 98.908 1.00 0.00 O ATOM 2102 H1 WAT 3106 134.377 134.806 99.325 1.00 0.00 H ATOM 2103 H2 WAT 3106 134.758 133.371 99.620 1.00 0.00 H TER 2105 WAT 3106 ATOM 2105 O WAT 3107 78.968 120.880 138.684 1.00 0.00 O ATOM 2106 H1 WAT 3107 79.299 119.989 138.792 1.00 0.00 H ATOM 2107 H2 WAT 3107 79.663 121.339 138.212 1.00 0.00 H TER 2109 WAT 3107 ATOM 2109 O WAT 3108 133.397 85.780 19.357 1.00 0.00 O ATOM 2110 H1 WAT 3108 134.135 86.339 19.116 1.00 0.00 H ATOM 2111 H2 WAT 3108 133.793 84.930 19.550 1.00 0.00 H TER 2113 WAT 3108 ATOM 2113 O WAT 3109 111.469 65.986 88.910 1.00 0.00 O ATOM 2114 H1 WAT 3109 110.925 66.147 88.139 1.00 0.00 H ATOM 2115 H2 WAT 3109 111.066 66.511 89.601 1.00 0.00 H TER 2117 WAT 3109 ATOM 2117 O WAT 3110 44.579 104.241 129.071 1.00 0.00 O ATOM 2118 H1 WAT 3110 44.514 104.129 128.122 1.00 0.00 H ATOM 2119 H2 WAT 3110 45.453 103.920 129.291 1.00 0.00 H TER 2121 WAT 3110 ATOM 2121 O WAT 3111 44.068 50.557 117.376 1.00 0.00 O ATOM 2122 H1 WAT 3111 44.296 51.479 117.264 1.00 0.00 H ATOM 2123 H2 WAT 3111 44.091 50.195 116.490 1.00 0.00 H TER 2125 WAT 3111 ATOM 2125 O WAT 3112 26.191 96.642 130.468 1.00 0.00 O ATOM 2126 H1 WAT 3112 25.655 96.542 131.255 1.00 0.00 H ATOM 2127 H2 WAT 3112 26.973 96.118 130.642 1.00 0.00 H TER 2129 WAT 3112 ATOM 2129 O WAT 3113 4.872 25.998 77.517 1.00 0.00 O ATOM 2130 H1 WAT 3113 4.970 25.598 78.381 1.00 0.00 H ATOM 2131 H2 WAT 3113 3.926 26.095 77.404 1.00 0.00 H TER 2133 WAT 3113 ATOM 2133 O WAT 3114 109.115 54.682 19.255 1.00 0.00 O ATOM 2134 H1 WAT 3114 109.086 55.628 19.111 1.00 0.00 H ATOM 2135 H2 WAT 3114 109.286 54.587 20.192 1.00 0.00 H TER 2137 WAT 3114 ATOM 2137 O WAT 3115 133.852 36.769 122.276 1.00 0.00 O ATOM 2138 H1 WAT 3115 134.225 35.999 121.847 1.00 0.00 H ATOM 2139 H2 WAT 3115 133.559 36.450 123.130 1.00 0.00 H TER 2141 WAT 3115 ATOM 2141 O WAT 3116 40.349 16.584 72.251 1.00 0.00 O ATOM 2142 H1 WAT 3116 40.050 16.021 72.965 1.00 0.00 H ATOM 2143 H2 WAT 3116 39.871 16.272 71.483 1.00 0.00 H TER 2145 WAT 3116 ATOM 2145 O WAT 3117 85.288 78.457 129.727 1.00 0.00 O ATOM 2146 H1 WAT 3117 85.067 77.838 130.423 1.00 0.00 H ATOM 2147 H2 WAT 3117 86.156 78.785 129.965 1.00 0.00 H TER 2149 WAT 3117 ATOM 2149 O WAT 3118 126.121 16.071 89.391 1.00 0.00 O ATOM 2150 H1 WAT 3118 126.856 16.333 88.837 1.00 0.00 H ATOM 2151 H2 WAT 3118 125.715 16.896 89.658 1.00 0.00 H TER 2153 WAT 3118 ATOM 2153 O WAT 3119 71.155 70.604 75.303 1.00 0.00 O ATOM 2154 H1 WAT 3119 70.822 69.854 74.811 1.00 0.00 H ATOM 2155 H2 WAT 3119 72.098 70.454 75.361 1.00 0.00 H TER 2157 WAT 3119 ATOM 2157 O WAT 3120 132.658 107.012 86.741 1.00 0.00 O ATOM 2158 H1 WAT 3120 132.019 106.961 86.031 1.00 0.00 H ATOM 2159 H2 WAT 3120 133.502 107.096 86.298 1.00 0.00 H TER 2161 WAT 3120 ATOM 2161 O WAT 3121 14.320 99.976 81.923 1.00 0.00 O ATOM 2162 H1 WAT 3121 13.634 99.887 81.262 1.00 0.00 H ATOM 2163 H2 WAT 3121 14.599 100.889 81.858 1.00 0.00 H TER 2165 WAT 3121 ATOM 2165 O WAT 3122 138.567 18.252 77.643 1.00 0.00 O ATOM 2166 H1 WAT 3122 139.302 18.487 78.210 1.00 0.00 H ATOM 2167 H2 WAT 3122 138.486 17.303 77.738 1.00 0.00 H TER 2169 WAT 3122 ATOM 2169 O WAT 3123 91.626 25.361 62.200 1.00 0.00 O ATOM 2170 H1 WAT 3123 92.577 25.256 62.242 1.00 0.00 H ATOM 2171 H2 WAT 3123 91.485 25.970 61.475 1.00 0.00 H TER 2173 WAT 3123 ATOM 2173 O WAT 3124 41.537 106.315 152.660 1.00 0.00 O ATOM 2174 H1 WAT 3124 41.174 106.575 153.507 1.00 0.00 H ATOM 2175 H2 WAT 3124 41.203 106.968 152.045 1.00 0.00 H TER 2177 WAT 3124 ATOM 2177 O WAT 3125 111.361 145.509 158.930 1.00 0.00 O ATOM 2178 H1 WAT 3125 111.210 144.615 158.626 1.00 0.00 H ATOM 2179 H2 WAT 3125 111.801 145.941 158.198 1.00 0.00 H TER 2181 WAT 3125 ATOM 2181 O WAT 3126 82.586 129.795 124.488 1.00 0.00 O ATOM 2182 H1 WAT 3126 82.422 130.734 124.575 1.00 0.00 H ATOM 2183 H2 WAT 3126 82.059 129.528 123.735 1.00 0.00 H TER 2185 WAT 3126 ATOM 2185 O WAT 3127 107.773 57.565 101.934 1.00 0.00 O ATOM 2186 H1 WAT 3127 106.818 57.504 101.912 1.00 0.00 H ATOM 2187 H2 WAT 3127 107.960 58.119 102.692 1.00 0.00 H TER 2189 WAT 3127 ATOM 2189 O WAT 3128 87.722 124.588 0.024 1.00 0.00 O ATOM 2190 H1 WAT 3128 87.669 124.770 0.963 1.00 0.00 H ATOM 2191 H2 WAT 3128 88.535 124.094 -0.078 1.00 0.00 H TER 2193 WAT 3128 ATOM 2193 O WAT 3129 73.616 9.791 131.198 1.00 0.00 O ATOM 2194 H1 WAT 3129 73.884 10.709 131.225 1.00 0.00 H ATOM 2195 H2 WAT 3129 74.357 9.336 130.798 1.00 0.00 H TER 2197 WAT 3129 ATOM 2197 O WAT 3130 11.964 65.236 7.644 1.00 0.00 O ATOM 2198 H1 WAT 3130 12.197 65.583 8.505 1.00 0.00 H ATOM 2199 H2 WAT 3130 11.788 64.308 7.799 1.00 0.00 H TER 2201 WAT 3130 ATOM 2201 O WAT 3131 52.061 39.535 107.644 1.00 0.00 O ATOM 2202 H1 WAT 3131 51.184 39.691 107.995 1.00 0.00 H ATOM 2203 H2 WAT 3131 52.400 38.806 108.162 1.00 0.00 H TER 2205 WAT 3131 ATOM 2205 O WAT 3132 135.777 25.890 97.102 1.00 0.00 O ATOM 2206 H1 WAT 3132 135.196 25.519 96.438 1.00 0.00 H ATOM 2207 H2 WAT 3132 136.501 25.267 97.162 1.00 0.00 H TER 2209 WAT 3132 ATOM 2209 O WAT 3133 143.269 105.608 138.171 1.00 0.00 O ATOM 2210 H1 WAT 3133 144.109 106.065 138.131 1.00 0.00 H ATOM 2211 H2 WAT 3133 142.647 106.275 138.461 1.00 0.00 H TER 2213 WAT 3133 ATOM 2213 O WAT 3134 81.194 20.276 115.812 1.00 0.00 O ATOM 2214 H1 WAT 3134 80.706 20.089 116.614 1.00 0.00 H ATOM 2215 H2 WAT 3134 81.861 19.590 115.772 1.00 0.00 H TER 2217 WAT 3134 ATOM 2217 O WAT 3135 99.005 106.600 138.694 1.00 0.00 O ATOM 2218 H1 WAT 3135 98.281 107.218 138.801 1.00 0.00 H ATOM 2219 H2 WAT 3135 99.054 106.141 139.532 1.00 0.00 H TER 2221 WAT 3135 ATOM 2221 O WAT 3136 68.121 131.374 149.988 1.00 0.00 O ATOM 2222 H1 WAT 3136 67.925 131.235 149.062 1.00 0.00 H ATOM 2223 H2 WAT 3136 67.467 132.009 150.279 1.00 0.00 H TER 2225 WAT 3136 ATOM 2225 O WAT 3137 27.294 27.636 148.632 1.00 0.00 O ATOM 2226 H1 WAT 3137 26.851 26.804 148.798 1.00 0.00 H ATOM 2227 H2 WAT 3137 26.655 28.302 148.884 1.00 0.00 H TER 2229 WAT 3137 ATOM 2229 O WAT 3138 46.670 115.360 64.290 1.00 0.00 O ATOM 2230 H1 WAT 3138 46.240 114.764 63.677 1.00 0.00 H ATOM 2231 H2 WAT 3138 46.533 114.959 65.149 1.00 0.00 H TER 2233 WAT 3138 ATOM 2233 O WAT 3139 75.461 7.536 80.259 1.00 0.00 O ATOM 2234 H1 WAT 3139 74.513 7.650 80.327 1.00 0.00 H ATOM 2235 H2 WAT 3139 75.812 7.993 81.024 1.00 0.00 H TER 2237 WAT 3139 ATOM 2237 O WAT 3140 21.794 92.323 22.753 1.00 0.00 O ATOM 2238 H1 WAT 3140 22.688 92.401 22.419 1.00 0.00 H ATOM 2239 H2 WAT 3140 21.815 92.767 23.600 1.00 0.00 H TER 2241 WAT 3140 ATOM 2241 O WAT 3141 68.688 87.784 68.057 1.00 0.00 O ATOM 2242 H1 WAT 3141 68.935 88.518 68.619 1.00 0.00 H ATOM 2243 H2 WAT 3141 69.428 87.679 67.459 1.00 0.00 H TER 2245 WAT 3141 ATOM 2245 O WAT 3142 125.074 1.476 110.973 1.00 0.00 O ATOM 2246 H1 WAT 3142 125.671 0.866 111.407 1.00 0.00 H ATOM 2247 H2 WAT 3142 124.270 1.433 111.491 1.00 0.00 H TER 2249 WAT 3142 ATOM 2249 O WAT 3143 24.207 18.756 96.135 1.00 0.00 O ATOM 2250 H1 WAT 3143 24.740 19.501 96.415 1.00 0.00 H ATOM 2251 H2 WAT 3143 23.341 19.130 95.975 1.00 0.00 H TER 2253 WAT 3143 ATOM 2253 O WAT 3144 59.354 87.854 24.502 1.00 0.00 O ATOM 2254 H1 WAT 3144 60.101 87.258 24.456 1.00 0.00 H ATOM 2255 H2 WAT 3144 59.656 88.575 25.055 1.00 0.00 H TER 2257 WAT 3144 ATOM 2257 O WAT 3145 135.304 9.599 70.778 1.00 0.00 O ATOM 2258 H1 WAT 3145 135.078 9.418 71.691 1.00 0.00 H ATOM 2259 H2 WAT 3145 136.025 9.000 70.586 1.00 0.00 H TER 2261 WAT 3145 ATOM 2261 O WAT 3146 113.881 69.464 119.566 1.00 0.00 O ATOM 2262 H1 WAT 3146 114.149 68.603 119.887 1.00 0.00 H ATOM 2263 H2 WAT 3146 113.536 69.295 118.689 1.00 0.00 H TER 2265 WAT 3146 ATOM 2265 O WAT 3147 49.064 79.868 18.827 1.00 0.00 O ATOM 2266 H1 WAT 3147 48.396 79.612 19.464 1.00 0.00 H ATOM 2267 H2 WAT 3147 48.881 80.790 18.646 1.00 0.00 H TER 2269 WAT 3147 ATOM 2269 O WAT 3148 18.275 113.092 68.869 1.00 0.00 O ATOM 2270 H1 WAT 3148 18.363 113.953 69.278 1.00 0.00 H ATOM 2271 H2 WAT 3148 18.068 112.502 69.595 1.00 0.00 H TER 2273 WAT 3148 ATOM 2273 O WAT 3149 121.218 137.271 131.373 1.00 0.00 O ATOM 2274 H1 WAT 3149 122.015 137.000 131.828 1.00 0.00 H ATOM 2275 H2 WAT 3149 121.309 136.908 130.492 1.00 0.00 H TER 2277 WAT 3149 ATOM 2277 O WAT 3150 137.244 23.343 68.375 1.00 0.00 O ATOM 2278 H1 WAT 3150 136.736 24.134 68.557 1.00 0.00 H ATOM 2279 H2 WAT 3150 138.157 23.623 68.447 1.00 0.00 H TER 2281 WAT 3150 ATOM 2281 O WAT 3151 143.612 41.680 85.174 1.00 0.00 O ATOM 2282 H1 WAT 3151 142.836 41.197 85.458 1.00 0.00 H ATOM 2283 H2 WAT 3151 143.322 42.591 85.122 1.00 0.00 H TER 2285 WAT 3151 ATOM 2285 O WAT 3152 122.202 67.772 86.896 1.00 0.00 O ATOM 2286 H1 WAT 3152 122.097 68.025 85.979 1.00 0.00 H ATOM 2287 H2 WAT 3152 121.921 66.857 86.926 1.00 0.00 H TER 2289 WAT 3152 ATOM 2289 O WAT 3153 124.500 125.147 82.391 1.00 0.00 O ATOM 2290 H1 WAT 3153 124.446 124.207 82.220 1.00 0.00 H ATOM 2291 H2 WAT 3153 124.761 125.208 83.310 1.00 0.00 H TER 2293 WAT 3153 ATOM 2293 O WAT 3154 75.448 58.824 95.965 1.00 0.00 O ATOM 2294 H1 WAT 3154 74.600 59.141 95.654 1.00 0.00 H ATOM 2295 H2 WAT 3154 75.248 58.369 96.783 1.00 0.00 H TER 2297 WAT 3154 ATOM 2297 O WAT 3155 12.089 13.490 1.719 1.00 0.00 O ATOM 2298 H1 WAT 3155 11.730 12.775 1.193 1.00 0.00 H ATOM 2299 H2 WAT 3155 11.677 14.278 1.365 1.00 0.00 H TER 2301 WAT 3155 ATOM 2301 O WAT 3156 138.823 131.116 91.221 1.00 0.00 O ATOM 2302 H1 WAT 3156 138.080 130.920 91.792 1.00 0.00 H ATOM 2303 H2 WAT 3156 138.841 130.392 90.595 1.00 0.00 H TER 2305 WAT 3156 ATOM 2305 O WAT 3157 30.656 12.569 156.259 1.00 0.00 O ATOM 2306 H1 WAT 3157 31.243 12.103 156.855 1.00 0.00 H ATOM 2307 H2 WAT 3157 29.990 12.952 156.831 1.00 0.00 H TER 2309 WAT 3157 ATOM 2309 O WAT 3158 44.701 138.870 92.067 1.00 0.00 O ATOM 2310 H1 WAT 3158 44.802 138.830 93.018 1.00 0.00 H ATOM 2311 H2 WAT 3158 43.879 139.341 91.933 1.00 0.00 H TER 2313 WAT 3158 ATOM 2313 O WAT 3159 107.083 136.945 111.378 1.00 0.00 O ATOM 2314 H1 WAT 3159 107.065 137.619 112.057 1.00 0.00 H ATOM 2315 H2 WAT 3159 107.346 137.411 110.584 1.00 0.00 H TER 2317 WAT 3159 ATOM 2317 O WAT 3160 124.727 127.072 66.909 1.00 0.00 O ATOM 2318 H1 WAT 3160 125.098 126.454 67.538 1.00 0.00 H ATOM 2319 H2 WAT 3160 123.872 127.301 67.273 1.00 0.00 H TER 2321 WAT 3160 ATOM 2321 O WAT 3161 107.410 33.622 106.555 1.00 0.00 O ATOM 2322 H1 WAT 3161 107.413 34.424 107.077 1.00 0.00 H ATOM 2323 H2 WAT 3161 106.889 33.840 105.782 1.00 0.00 H TER 2325 WAT 3161 ATOM 2325 O WAT 3162 34.861 63.195 9.666 1.00 0.00 O ATOM 2326 H1 WAT 3162 34.836 62.800 10.538 1.00 0.00 H ATOM 2327 H2 WAT 3162 35.790 63.203 9.434 1.00 0.00 H TER 2329 WAT 3162 ATOM 2329 O WAT 3163 17.208 57.948 141.017 1.00 0.00 O ATOM 2330 H1 WAT 3163 17.763 57.254 141.373 1.00 0.00 H ATOM 2331 H2 WAT 3163 17.089 57.710 140.097 1.00 0.00 H TER 2333 WAT 3163 ATOM 2333 O WAT 3164 113.736 106.995 115.082 1.00 0.00 O ATOM 2334 H1 WAT 3164 114.018 106.114 115.330 1.00 0.00 H ATOM 2335 H2 WAT 3164 112.852 107.073 115.440 1.00 0.00 H TER 2337 WAT 3164 ATOM 2337 O WAT 3165 100.376 101.941 112.890 1.00 0.00 O ATOM 2338 H1 WAT 3165 101.299 102.156 112.757 1.00 0.00 H ATOM 2339 H2 WAT 3165 100.193 102.218 113.788 1.00 0.00 H TER 2341 WAT 3165 ATOM 2341 O WAT 3166 81.122 74.649 106.393 1.00 0.00 O ATOM 2342 H1 WAT 3166 81.293 74.840 107.315 1.00 0.00 H ATOM 2343 H2 WAT 3166 80.347 75.168 106.180 1.00 0.00 H TER 2345 WAT 3166 ATOM 2345 O WAT 3167 66.206 125.974 104.923 1.00 0.00 O ATOM 2346 H1 WAT 3167 66.628 126.163 104.085 1.00 0.00 H ATOM 2347 H2 WAT 3167 66.840 126.261 105.581 1.00 0.00 H TER 2349 WAT 3167 ATOM 2349 O WAT 3168 7.221 120.681 64.107 1.00 0.00 O ATOM 2350 H1 WAT 3168 7.118 120.882 65.037 1.00 0.00 H ATOM 2351 H2 WAT 3168 6.687 121.338 63.660 1.00 0.00 H TER 2353 WAT 3168 ATOM 2353 O WAT 3169 44.482 23.999 110.929 1.00 0.00 O ATOM 2354 H1 WAT 3169 44.641 23.062 111.046 1.00 0.00 H ATOM 2355 H2 WAT 3169 44.659 24.158 110.002 1.00 0.00 H TER 2357 WAT 3169 ATOM 2357 O WAT 3170 20.780 135.018 61.825 1.00 0.00 O ATOM 2358 H1 WAT 3170 21.385 135.326 61.150 1.00 0.00 H ATOM 2359 H2 WAT 3170 20.034 135.614 61.769 1.00 0.00 H TER 2361 WAT 3170 ATOM 2361 O WAT 3171 130.643 37.799 8.100 1.00 0.00 O ATOM 2362 H1 WAT 3171 131.468 38.042 7.680 1.00 0.00 H ATOM 2363 H2 WAT 3171 130.459 38.520 8.702 1.00 0.00 H TER 2365 WAT 3171 ATOM 2365 O WAT 3172 38.170 50.332 72.280 1.00 0.00 O ATOM 2366 H1 WAT 3172 37.656 50.659 73.018 1.00 0.00 H ATOM 2367 H2 WAT 3172 39.002 50.063 72.669 1.00 0.00 H TER 2369 WAT 3172 ATOM 2369 O WAT 3173 14.878 42.608 56.712 1.00 0.00 O ATOM 2370 H1 WAT 3173 14.072 43.098 56.548 1.00 0.00 H ATOM 2371 H2 WAT 3173 15.570 43.268 56.684 1.00 0.00 H TER 2373 WAT 3173 ATOM 2373 O WAT 3174 95.758 128.700 132.084 1.00 0.00 O ATOM 2374 H1 WAT 3174 96.067 128.159 132.811 1.00 0.00 H ATOM 2375 H2 WAT 3174 96.130 129.565 132.255 1.00 0.00 H TER 2377 WAT 3174 ATOM 2377 O WAT 3175 116.295 10.020 98.246 1.00 0.00 O ATOM 2378 H1 WAT 3175 116.721 9.368 97.689 1.00 0.00 H ATOM 2379 H2 WAT 3175 117.011 10.574 98.556 1.00 0.00 H TER 2381 WAT 3175 ATOM 2381 O WAT 3176 128.943 115.176 70.787 1.00 0.00 O ATOM 2382 H1 WAT 3176 128.755 114.258 70.596 1.00 0.00 H ATOM 2383 H2 WAT 3176 129.171 115.186 71.717 1.00 0.00 H TER 2385 WAT 3176 ATOM 2385 O WAT 3177 108.916 24.378 142.837 1.00 0.00 O ATOM 2386 H1 WAT 3177 108.280 25.092 142.791 1.00 0.00 H ATOM 2387 H2 WAT 3177 108.787 23.998 143.706 1.00 0.00 H TER 2389 WAT 3177 ATOM 2389 O WAT 3178 57.822 137.918 6.788 1.00 0.00 O ATOM 2390 H1 WAT 3178 57.131 138.377 6.311 1.00 0.00 H ATOM 2391 H2 WAT 3178 57.797 138.293 7.668 1.00 0.00 H TER 2393 WAT 3178 ATOM 2393 O WAT 3179 108.855 133.623 153.652 1.00 0.00 O ATOM 2394 H1 WAT 3179 108.082 134.174 153.777 1.00 0.00 H ATOM 2395 H2 WAT 3179 109.560 134.240 153.456 1.00 0.00 H TER 2397 WAT 3179 ATOM 2397 O WAT 3180 5.944 76.705 83.819 1.00 0.00 O ATOM 2398 H1 WAT 3180 6.758 76.459 83.380 1.00 0.00 H ATOM 2399 H2 WAT 3180 5.612 77.445 83.312 1.00 0.00 H TER 2401 WAT 3180 ATOM 2401 O WAT 3181 26.984 50.811 106.968 1.00 0.00 O ATOM 2402 H1 WAT 3181 27.852 50.409 106.978 1.00 0.00 H ATOM 2403 H2 WAT 3181 27.123 51.692 107.313 1.00 0.00 H TER 2405 WAT 3181 ATOM 2405 O WAT 3182 42.921 112.762 71.274 1.00 0.00 O ATOM 2406 H1 WAT 3182 43.293 112.242 71.987 1.00 0.00 H ATOM 2407 H2 WAT 3182 43.041 113.670 71.553 1.00 0.00 H TER 2409 WAT 3182 ATOM 2409 O WAT 3183 137.788 80.806 127.498 1.00 0.00 O ATOM 2410 H1 WAT 3183 137.275 81.205 128.201 1.00 0.00 H ATOM 2411 H2 WAT 3183 138.686 80.802 127.829 1.00 0.00 H TER 2413 WAT 3183 ATOM 2413 O WAT 3184 107.435 60.161 137.374 1.00 0.00 O ATOM 2414 H1 WAT 3184 106.548 60.147 137.734 1.00 0.00 H ATOM 2415 H2 WAT 3184 107.643 59.241 137.213 1.00 0.00 H TER 2417 WAT 3184 ATOM 2417 O WAT 3185 82.588 45.720 136.259 1.00 0.00 O ATOM 2418 H1 WAT 3185 81.698 45.972 136.503 1.00 0.00 H ATOM 2419 H2 WAT 3185 83.045 46.551 136.131 1.00 0.00 H TER 2421 WAT 3185 ATOM 2421 O WAT 3186 82.245 41.272 152.317 1.00 0.00 O ATOM 2422 H1 WAT 3186 82.901 41.885 151.985 1.00 0.00 H ATOM 2423 H2 WAT 3186 82.600 40.971 153.153 1.00 0.00 H TER 2425 WAT 3186 ATOM 2425 O WAT 3187 23.798 62.474 84.754 1.00 0.00 O ATOM 2426 H1 WAT 3187 23.568 61.593 85.048 1.00 0.00 H ATOM 2427 H2 WAT 3187 24.743 62.535 84.897 1.00 0.00 H TER 2429 WAT 3187 ATOM 2429 O WAT 3188 56.369 112.574 68.829 1.00 0.00 O ATOM 2430 H1 WAT 3188 56.908 113.278 68.467 1.00 0.00 H ATOM 2431 H2 WAT 3188 56.912 111.790 68.747 1.00 0.00 H TER 2433 WAT 3188 ATOM 2433 O WAT 3189 56.503 80.271 71.048 1.00 0.00 O ATOM 2434 H1 WAT 3189 57.384 80.476 70.735 1.00 0.00 H ATOM 2435 H2 WAT 3189 56.127 79.720 70.361 1.00 0.00 H TER 2437 WAT 3189 ATOM 2437 O WAT 3190 22.008 104.988 157.398 1.00 0.00 O ATOM 2438 H1 WAT 3190 21.894 104.574 156.543 1.00 0.00 H ATOM 2439 H2 WAT 3190 21.401 104.521 157.973 1.00 0.00 H TER 2441 WAT 3190 ATOM 2441 O WAT 3191 83.676 22.751 14.478 1.00 0.00 O ATOM 2442 H1 WAT 3191 84.592 22.480 14.417 1.00 0.00 H ATOM 2443 H2 WAT 3191 83.292 22.484 13.643 1.00 0.00 H TER 2445 WAT 3191 ATOM 2445 O WAT 3192 87.102 122.534 151.369 1.00 0.00 O ATOM 2446 H1 WAT 3192 86.397 122.355 150.746 1.00 0.00 H ATOM 2447 H2 WAT 3192 86.836 122.079 152.168 1.00 0.00 H TER 2449 WAT 3192 ATOM 2449 O WAT 3193 122.418 93.231 17.361 1.00 0.00 O ATOM 2450 H1 WAT 3193 121.745 92.637 17.026 1.00 0.00 H ATOM 2451 H2 WAT 3193 123.222 92.711 17.351 1.00 0.00 H TER 2453 WAT 3193 ATOM 2453 O WAT 3194 62.250 133.268 64.504 1.00 0.00 O ATOM 2454 H1 WAT 3194 62.088 133.265 65.448 1.00 0.00 H ATOM 2455 H2 WAT 3194 63.070 132.786 64.401 1.00 0.00 H TER 2457 WAT 3194 ATOM 2457 O WAT 3195 38.417 100.937 123.785 1.00 0.00 O ATOM 2458 H1 WAT 3195 39.228 100.489 123.544 1.00 0.00 H ATOM 2459 H2 WAT 3195 38.700 101.652 124.356 1.00 0.00 H TER 2461 WAT 3195 ATOM 2461 O WAT 3196 72.519 9.300 22.531 1.00 0.00 O ATOM 2462 H1 WAT 3196 73.431 9.488 22.753 1.00 0.00 H ATOM 2463 H2 WAT 3196 72.013 9.935 23.038 1.00 0.00 H TER 2465 WAT 3196 ATOM 2465 O WAT 3197 112.252 31.600 70.299 1.00 0.00 O ATOM 2466 H1 WAT 3197 112.682 31.769 69.460 1.00 0.00 H ATOM 2467 H2 WAT 3197 112.949 31.265 70.863 1.00 0.00 H TER 2469 WAT 3197 ATOM 2469 O WAT 3198 52.313 144.489 119.588 1.00 0.00 O ATOM 2470 H1 WAT 3198 52.886 143.972 120.155 1.00 0.00 H ATOM 2471 H2 WAT 3198 52.644 145.384 119.666 1.00 0.00 H TER 2473 WAT 3198 ATOM 2473 O WAT 3199 45.117 132.160 58.369 1.00 0.00 O ATOM 2474 H1 WAT 3199 45.537 131.300 58.381 1.00 0.00 H ATOM 2475 H2 WAT 3199 45.843 132.782 58.404 1.00 0.00 H TER 2477 WAT 3199 ATOM 2477 O WAT 3200 47.210 96.171 10.618 1.00 0.00 O ATOM 2478 H1 WAT 3200 46.703 96.774 10.075 1.00 0.00 H ATOM 2479 H2 WAT 3200 46.672 95.381 10.666 1.00 0.00 H TER 2481 WAT 3200 ATOM 2481 O WAT 3201 92.776 114.099 155.698 1.00 0.00 O ATOM 2482 H1 WAT 3201 92.259 113.831 156.458 1.00 0.00 H ATOM 2483 H2 WAT 3201 93.684 114.052 155.997 1.00 0.00 H TER 2485 WAT 3201 ATOM 2485 O WAT 3202 67.599 101.312 106.530 1.00 0.00 O ATOM 2486 H1 WAT 3202 66.962 100.931 107.135 1.00 0.00 H ATOM 2487 H2 WAT 3202 67.709 100.649 105.849 1.00 0.00 H TER 2489 WAT 3202 ATOM 2489 O WAT 3203 26.922 28.139 101.851 1.00 0.00 O ATOM 2490 H1 WAT 3203 26.196 27.782 102.362 1.00 0.00 H ATOM 2491 H2 WAT 3203 26.917 29.076 102.049 1.00 0.00 H TER 2493 WAT 3203 ATOM 2493 O WAT 3204 57.803 92.984 148.696 1.00 0.00 O ATOM 2494 H1 WAT 3204 56.897 92.718 148.535 1.00 0.00 H ATOM 2495 H2 WAT 3204 57.730 93.734 149.286 1.00 0.00 H TER 2497 WAT 3204 ATOM 2497 O WAT 3205 18.523 4.370 57.750 1.00 0.00 O ATOM 2498 H1 WAT 3205 19.046 5.166 57.660 1.00 0.00 H ATOM 2499 H2 WAT 3205 18.965 3.868 58.435 1.00 0.00 H TER 2501 WAT 3205 ATOM 2501 O WAT 3206 72.602 2.300 58.741 1.00 0.00 O ATOM 2502 H1 WAT 3206 71.763 1.972 58.416 1.00 0.00 H ATOM 2503 H2 WAT 3206 72.737 3.122 58.270 1.00 0.00 H TER 2505 WAT 3206 ATOM 2505 O WAT 3207 127.637 2.768 68.757 1.00 0.00 O ATOM 2506 H1 WAT 3207 126.750 2.519 68.497 1.00 0.00 H ATOM 2507 H2 WAT 3207 128.077 1.937 68.932 1.00 0.00 H TER 2509 WAT 3207 ATOM 2509 O WAT 3208 41.271 27.541 0.362 1.00 0.00 O ATOM 2510 H1 WAT 3208 40.695 26.778 0.394 1.00 0.00 H ATOM 2511 H2 WAT 3208 41.921 27.379 1.046 1.00 0.00 H TER 2513 WAT 3208 ATOM 2513 O WAT 3209 101.403 116.122 55.929 1.00 0.00 O ATOM 2514 H1 WAT 3209 100.649 115.973 55.357 1.00 0.00 H ATOM 2515 H2 WAT 3209 101.963 116.720 55.435 1.00 0.00 H TER 2517 WAT 3209 ATOM 2517 O WAT 3210 101.498 89.779 143.348 1.00 0.00 O ATOM 2518 H1 WAT 3210 101.540 89.802 144.304 1.00 0.00 H ATOM 2519 H2 WAT 3210 101.575 88.851 143.127 1.00 0.00 H TER 2521 WAT 3210 ATOM 2521 O WAT 3211 103.060 108.912 106.874 1.00 0.00 O ATOM 2522 H1 WAT 3211 103.740 108.239 106.871 1.00 0.00 H ATOM 2523 H2 WAT 3211 102.441 108.631 106.200 1.00 0.00 H TER 2525 WAT 3211 ATOM 2525 O WAT 3212 124.385 129.760 106.863 1.00 0.00 O ATOM 2526 H1 WAT 3212 124.983 129.786 106.115 1.00 0.00 H ATOM 2527 H2 WAT 3212 124.346 128.835 107.107 1.00 0.00 H TER 2529 WAT 3212 ATOM 2529 O WAT 3213 38.344 118.657 84.719 1.00 0.00 O ATOM 2530 H1 WAT 3213 38.460 117.854 85.226 1.00 0.00 H ATOM 2531 H2 WAT 3213 37.434 118.909 84.875 1.00 0.00 H TER 2533 WAT 3213 ATOM 2533 O WAT 3214 64.607 65.660 95.678 1.00 0.00 O ATOM 2534 H1 WAT 3214 64.287 65.792 96.570 1.00 0.00 H ATOM 2535 H2 WAT 3214 65.527 65.925 95.712 1.00 0.00 H TER 2537 WAT 3214 ATOM 2537 O WAT 3215 42.767 49.758 96.365 1.00 0.00 O ATOM 2538 H1 WAT 3215 42.814 48.804 96.417 1.00 0.00 H ATOM 2539 H2 WAT 3215 41.919 49.934 95.956 1.00 0.00 H TER 2541 WAT 3215 ATOM 2541 O WAT 3216 21.632 68.594 56.912 1.00 0.00 O ATOM 2542 H1 WAT 3216 22.514 68.810 57.212 1.00 0.00 H ATOM 2543 H2 WAT 3216 21.678 67.667 56.679 1.00 0.00 H TER 2545 WAT 3216 ATOM 2545 O WAT 3217 117.528 24.110 129.951 1.00 0.00 O ATOM 2546 H1 WAT 3217 118.329 24.630 129.882 1.00 0.00 H ATOM 2547 H2 WAT 3217 117.761 23.261 129.575 1.00 0.00 H TER 2549 WAT 3217 ATOM 2549 O WAT 3218 135.234 27.858 65.562 1.00 0.00 O ATOM 2550 H1 WAT 3218 135.944 27.395 66.006 1.00 0.00 H ATOM 2551 H2 WAT 3218 134.456 27.663 66.085 1.00 0.00 H TER 2553 WAT 3218 ATOM 2553 O WAT 3219 58.045 39.163 25.425 1.00 0.00 O ATOM 2554 H1 WAT 3219 57.193 39.488 25.134 1.00 0.00 H ATOM 2555 H2 WAT 3219 58.205 39.617 26.252 1.00 0.00 H TER 2557 WAT 3219 ATOM 2557 O WAT 3220 92.629 4.230 58.813 1.00 0.00 O ATOM 2558 H1 WAT 3220 91.781 4.570 58.526 1.00 0.00 H ATOM 2559 H2 WAT 3220 93.234 4.472 58.112 1.00 0.00 H TER 2561 WAT 3220 ATOM 2561 O WAT 3221 70.667 140.856 155.093 1.00 0.00 O ATOM 2562 H1 WAT 3221 69.988 140.183 155.147 1.00 0.00 H ATOM 2563 H2 WAT 3221 71.409 140.416 154.679 1.00 0.00 H TER 2565 WAT 3221 ATOM 2565 O WAT 3222 37.132 86.723 85.380 1.00 0.00 O ATOM 2566 H1 WAT 3222 36.857 86.836 86.290 1.00 0.00 H ATOM 2567 H2 WAT 3222 36.398 86.273 84.962 1.00 0.00 H TER 2569 WAT 3222 ATOM 2569 O WAT 3223 115.546 62.707 3.498 1.00 0.00 O ATOM 2570 H1 WAT 3223 115.058 62.040 3.016 1.00 0.00 H ATOM 2571 H2 WAT 3223 115.019 62.870 4.280 1.00 0.00 H TER 2573 WAT 3223 ATOM 2573 O WAT 3224 139.300 99.343 96.514 1.00 0.00 O ATOM 2574 H1 WAT 3224 139.037 98.453 96.749 1.00 0.00 H ATOM 2575 H2 WAT 3224 139.969 99.224 95.840 1.00 0.00 H TER 2577 WAT 3224 ATOM 2577 O WAT 3225 21.668 53.798 62.475 1.00 0.00 O ATOM 2578 H1 WAT 3225 21.900 52.880 62.337 1.00 0.00 H ATOM 2579 H2 WAT 3225 20.934 53.769 63.090 1.00 0.00 H TER 2581 WAT 3225 ATOM 2581 O WAT 3226 25.523 107.611 108.766 1.00 0.00 O ATOM 2582 H1 WAT 3226 25.369 107.992 107.901 1.00 0.00 H ATOM 2583 H2 WAT 3226 24.955 108.112 109.352 1.00 0.00 H TER 2585 WAT 3226 ATOM 2585 O WAT 3227 1.751 71.323 113.239 1.00 0.00 O ATOM 2586 H1 WAT 3227 1.665 71.648 114.136 1.00 0.00 H ATOM 2587 H2 WAT 3227 2.228 70.498 113.327 1.00 0.00 H TER 2589 WAT 3227 ATOM 2589 O WAT 3228 92.418 145.019 83.555 1.00 0.00 O ATOM 2590 H1 WAT 3228 92.215 144.543 82.750 1.00 0.00 H ATOM 2591 H2 WAT 3228 92.563 144.333 84.208 1.00 0.00 H TER 2593 WAT 3228 ATOM 2593 O WAT 3229 23.287 133.216 64.246 1.00 0.00 O ATOM 2594 H1 WAT 3229 23.453 133.121 65.184 1.00 0.00 H ATOM 2595 H2 WAT 3229 22.992 134.121 64.146 1.00 0.00 H TER 2597 WAT 3229 ATOM 2597 O WAT 3230 72.173 37.349 89.208 1.00 0.00 O ATOM 2598 H1 WAT 3230 72.404 36.758 89.924 1.00 0.00 H ATOM 2599 H2 WAT 3230 72.888 37.254 88.579 1.00 0.00 H TER 2601 WAT 3230 ATOM 2601 O WAT 3231 137.809 65.012 119.378 1.00 0.00 O ATOM 2602 H1 WAT 3231 137.438 65.205 120.238 1.00 0.00 H ATOM 2603 H2 WAT 3231 137.084 64.631 118.883 1.00 0.00 H TER 2605 WAT 3231 ATOM 2605 O WAT 3232 117.678 96.308 122.162 1.00 0.00 O ATOM 2606 H1 WAT 3232 117.314 96.666 122.971 1.00 0.00 H ATOM 2607 H2 WAT 3232 117.826 97.073 121.606 1.00 0.00 H TER 2609 WAT 3232 ATOM 2609 O WAT 3233 143.115 37.093 138.452 1.00 0.00 O ATOM 2610 H1 WAT 3233 143.340 36.329 138.982 1.00 0.00 H ATOM 2611 H2 WAT 3233 142.316 37.436 138.854 1.00 0.00 H TER 2613 WAT 3233 ATOM 2613 O WAT 3234 52.473 134.397 146.085 1.00 0.00 O ATOM 2614 H1 WAT 3234 52.011 135.202 145.850 1.00 0.00 H ATOM 2615 H2 WAT 3234 52.575 134.448 147.036 1.00 0.00 H TER 2617 WAT 3234 ATOM 2617 O WAT 3235 106.524 7.364 10.126 1.00 0.00 O ATOM 2618 H1 WAT 3235 106.821 6.895 10.906 1.00 0.00 H ATOM 2619 H2 WAT 3235 106.982 8.204 10.164 1.00 0.00 H TER 2621 WAT 3235 ATOM 2621 O WAT 3236 117.699 106.876 103.857 1.00 0.00 O ATOM 2622 H1 WAT 3236 118.614 106.767 103.600 1.00 0.00 H ATOM 2623 H2 WAT 3236 117.471 106.053 104.290 1.00 0.00 H TER 2625 WAT 3236 ATOM 2625 O WAT 3237 25.599 98.296 103.978 1.00 0.00 O ATOM 2626 H1 WAT 3237 24.815 98.572 104.453 1.00 0.00 H ATOM 2627 H2 WAT 3237 25.772 97.410 104.296 1.00 0.00 H TER 2629 WAT 3237 ATOM 2629 O WAT 3238 24.098 10.340 74.105 1.00 0.00 O ATOM 2630 H1 WAT 3238 24.508 11.191 73.949 1.00 0.00 H ATOM 2631 H2 WAT 3238 23.956 9.978 73.230 1.00 0.00 H TER 2633 WAT 3238 ATOM 2633 O WAT 3239 23.813 133.255 95.253 1.00 0.00 O ATOM 2634 H1 WAT 3239 24.601 133.602 95.672 1.00 0.00 H ATOM 2635 H2 WAT 3239 23.839 132.316 95.435 1.00 0.00 H TER 2637 WAT 3239 ATOM 2637 O WAT 3240 46.858 45.616 87.149 1.00 0.00 O ATOM 2638 H1 WAT 3240 46.643 46.534 86.985 1.00 0.00 H ATOM 2639 H2 WAT 3240 47.048 45.256 86.283 1.00 0.00 H TER 2641 WAT 3240 ATOM 2641 O WAT 3241 33.718 62.447 115.513 1.00 0.00 O ATOM 2642 H1 WAT 3241 33.159 61.745 115.181 1.00 0.00 H ATOM 2643 H2 WAT 3241 33.730 62.316 116.461 1.00 0.00 H TER 2645 WAT 3241 ATOM 2645 O WAT 3242 9.107 111.947 70.613 1.00 0.00 O ATOM 2646 H1 WAT 3242 9.977 111.590 70.791 1.00 0.00 H ATOM 2647 H2 WAT 3242 8.690 112.002 71.473 1.00 0.00 H TER 2649 WAT 3242 ATOM 2649 O WAT 3243 6.609 3.086 105.830 1.00 0.00 O ATOM 2650 H1 WAT 3243 5.893 2.517 105.547 1.00 0.00 H ATOM 2651 H2 WAT 3243 6.455 3.219 106.765 1.00 0.00 H TER 2653 WAT 3243 ATOM 2653 O WAT 3244 7.485 7.633 80.392 1.00 0.00 O ATOM 2654 H1 WAT 3244 6.944 8.201 79.844 1.00 0.00 H ATOM 2655 H2 WAT 3244 8.275 8.145 80.563 1.00 0.00 H TER 2657 WAT 3244 ATOM 2657 O WAT 3245 0.575 56.412 60.547 1.00 0.00 O ATOM 2658 H1 WAT 3245 1.221 56.411 59.842 1.00 0.00 H ATOM 2659 H2 WAT 3245 0.966 56.957 61.230 1.00 0.00 H TER 2661 WAT 3245 ATOM 2661 O WAT 3246 64.919 135.903 107.487 1.00 0.00 O ATOM 2662 H1 WAT 3246 65.865 135.828 107.364 1.00 0.00 H ATOM 2663 H2 WAT 3246 64.660 135.065 107.870 1.00 0.00 H TER 2665 WAT 3246 ATOM 2665 O WAT 3247 16.643 85.632 88.134 1.00 0.00 O ATOM 2666 H1 WAT 3247 16.798 85.310 87.245 1.00 0.00 H ATOM 2667 H2 WAT 3247 15.980 86.314 88.030 1.00 0.00 H TER 2669 WAT 3247 ATOM 2669 O WAT 3248 135.715 75.894 117.810 1.00 0.00 O ATOM 2670 H1 WAT 3248 134.998 76.026 117.191 1.00 0.00 H ATOM 2671 H2 WAT 3248 136.322 75.312 117.353 1.00 0.00 H TER 2673 WAT 3248 ATOM 2673 O WAT 3249 58.649 90.721 126.905 1.00 0.00 O ATOM 2674 H1 WAT 3249 58.333 91.165 126.118 1.00 0.00 H ATOM 2675 H2 WAT 3249 57.907 90.190 127.195 1.00 0.00 H TER 2677 WAT 3249 ATOM 2677 O WAT 3250 6.843 119.784 57.649 1.00 0.00 O ATOM 2678 H1 WAT 3250 7.021 119.917 56.718 1.00 0.00 H ATOM 2679 H2 WAT 3250 6.369 118.952 57.685 1.00 0.00 H TER 2681 WAT 3250 ATOM 2681 O WAT 3251 45.147 126.662 121.202 1.00 0.00 O ATOM 2682 H1 WAT 3251 44.826 126.028 120.561 1.00 0.00 H ATOM 2683 H2 WAT 3251 46.045 126.385 121.385 1.00 0.00 H TER 2685 WAT 3251 ATOM 2685 O WAT 3252 139.053 134.205 127.426 1.00 0.00 O ATOM 2686 H1 WAT 3252 139.137 134.427 128.354 1.00 0.00 H ATOM 2687 H2 WAT 3252 139.638 133.457 127.305 1.00 0.00 H TER 2689 WAT 3252 ATOM 2689 O WAT 3253 71.549 145.103 15.545 1.00 0.00 O ATOM 2690 H1 WAT 3253 70.847 144.793 16.118 1.00 0.00 H ATOM 2691 H2 WAT 3253 72.355 144.845 15.992 1.00 0.00 H TER 2693 WAT 3253 ATOM 2693 O WAT 3254 17.210 136.577 54.323 1.00 0.00 O ATOM 2694 H1 WAT 3254 16.442 136.732 54.871 1.00 0.00 H ATOM 2695 H2 WAT 3254 17.245 137.334 53.739 1.00 0.00 H TER 2697 WAT 3254 ATOM 2697 O WAT 3255 145.292 36.206 59.980 1.00 0.00 O ATOM 2698 H1 WAT 3255 144.750 36.718 59.380 1.00 0.00 H ATOM 2699 H2 WAT 3255 145.421 36.780 60.735 1.00 0.00 H TER 2701 WAT 3255 ATOM 2701 O WAT 3256 8.622 78.502 65.332 1.00 0.00 O ATOM 2702 H1 WAT 3256 8.140 77.850 65.839 1.00 0.00 H ATOM 2703 H2 WAT 3256 9.438 78.064 65.092 1.00 0.00 H TER 2705 WAT 3256 ATOM 2705 O WAT 3257 142.212 104.723 10.110 1.00 0.00 O ATOM 2706 H1 WAT 3257 142.698 105.327 10.672 1.00 0.00 H ATOM 2707 H2 WAT 3257 142.151 105.175 9.269 1.00 0.00 H TER 2709 WAT 3257 ATOM 2709 O WAT 3258 50.017 89.951 65.665 1.00 0.00 O ATOM 2710 H1 WAT 3258 50.383 89.759 64.802 1.00 0.00 H ATOM 2711 H2 WAT 3258 50.717 89.727 66.279 1.00 0.00 H TER 2713 WAT 3258 ATOM 2713 O WAT 3259 112.355 86.997 79.503 1.00 0.00 O ATOM 2714 H1 WAT 3259 112.732 87.844 79.264 1.00 0.00 H ATOM 2715 H2 WAT 3259 113.028 86.359 79.261 1.00 0.00 H TER 2717 WAT 3259 ATOM 2717 O WAT 3260 21.370 104.646 73.634 1.00 0.00 O ATOM 2718 H1 WAT 3260 21.418 105.381 73.022 1.00 0.00 H ATOM 2719 H2 WAT 3260 21.371 105.054 74.499 1.00 0.00 H TER 2721 WAT 3260 ATOM 2721 O WAT 3261 43.595 18.756 120.717 1.00 0.00 O ATOM 2722 H1 WAT 3261 42.733 19.166 120.791 1.00 0.00 H ATOM 2723 H2 WAT 3261 44.213 19.465 120.895 1.00 0.00 H TER 2725 WAT 3261 ATOM 2725 O WAT 3262 23.879 138.650 60.158 1.00 0.00 O ATOM 2726 H1 WAT 3262 23.632 139.385 59.596 1.00 0.00 H ATOM 2727 H2 WAT 3262 24.836 138.644 60.138 1.00 0.00 H TER 2729 WAT 3262 ATOM 2729 O WAT 3263 95.644 14.470 53.776 1.00 0.00 O ATOM 2730 H1 WAT 3263 94.941 14.037 54.260 1.00 0.00 H ATOM 2731 H2 WAT 3263 95.733 15.325 54.197 1.00 0.00 H TER 2733 WAT 3263 ATOM 2733 O WAT 3264 138.928 110.224 97.357 1.00 0.00 O ATOM 2734 H1 WAT 3264 139.745 109.733 97.444 1.00 0.00 H ATOM 2735 H2 WAT 3264 138.353 109.644 96.858 1.00 0.00 H TER 2737 WAT 3264 ATOM 2737 O WAT 3265 66.455 83.108 124.714 1.00 0.00 O ATOM 2738 H1 WAT 3265 66.854 83.434 125.520 1.00 0.00 H ATOM 2739 H2 WAT 3265 66.877 82.263 124.561 1.00 0.00 H TER 2741 WAT 3265 ATOM 2741 O WAT 3266 72.815 122.598 151.442 1.00 0.00 O ATOM 2742 H1 WAT 3266 72.534 122.450 152.345 1.00 0.00 H ATOM 2743 H2 WAT 3266 72.161 123.198 151.083 1.00 0.00 H TER 2745 WAT 3266 ATOM 2745 O WAT 3267 43.857 19.828 82.300 1.00 0.00 O ATOM 2746 H1 WAT 3267 44.081 19.825 81.370 1.00 0.00 H ATOM 2747 H2 WAT 3267 44.140 18.970 82.617 1.00 0.00 H TER 2749 WAT 3267 ATOM 2749 O WAT 3268 71.488 7.222 5.274 1.00 0.00 O ATOM 2750 H1 WAT 3268 71.764 8.139 5.272 1.00 0.00 H ATOM 2751 H2 WAT 3268 70.865 7.158 4.550 1.00 0.00 H TER 2753 WAT 3268 ATOM 2753 O WAT 3269 13.037 17.270 107.090 1.00 0.00 O ATOM 2754 H1 WAT 3269 13.825 16.845 107.429 1.00 0.00 H ATOM 2755 H2 WAT 3269 12.450 16.547 106.872 1.00 0.00 H TER 2757 WAT 3269 ATOM 2757 O WAT 3270 19.484 132.755 97.816 1.00 0.00 O ATOM 2758 H1 WAT 3270 19.362 133.431 98.483 1.00 0.00 H ATOM 2759 H2 WAT 3270 20.191 133.089 97.264 1.00 0.00 H TER 2761 WAT 3270 ATOM 2761 O WAT 3271 19.742 63.675 88.727 1.00 0.00 O ATOM 2762 H1 WAT 3271 19.224 63.339 89.458 1.00 0.00 H ATOM 2763 H2 WAT 3271 19.134 63.687 87.988 1.00 0.00 H TER 2765 WAT 3271 ATOM 2765 O WAT 3272 138.871 141.766 84.231 1.00 0.00 O ATOM 2766 H1 WAT 3272 139.438 142.339 84.746 1.00 0.00 H ATOM 2767 H2 WAT 3272 139.383 140.966 84.113 1.00 0.00 H TER 2769 WAT 3272 ATOM 2769 O WAT 3273 143.260 74.192 67.896 1.00 0.00 O ATOM 2770 H1 WAT 3273 143.723 74.788 68.485 1.00 0.00 H ATOM 2771 H2 WAT 3273 142.655 74.756 67.413 1.00 0.00 H TER 2773 WAT 3273 ATOM 2773 O WAT 3274 48.159 39.407 72.696 1.00 0.00 O ATOM 2774 H1 WAT 3274 47.606 39.540 71.926 1.00 0.00 H ATOM 2775 H2 WAT 3274 49.042 39.628 72.399 1.00 0.00 H TER 2777 WAT 3274 ATOM 2777 O WAT 3275 1.837 70.336 140.977 1.00 0.00 O ATOM 2778 H1 WAT 3275 2.696 70.758 140.948 1.00 0.00 H ATOM 2779 H2 WAT 3275 1.945 69.537 140.461 1.00 0.00 H TER 2781 WAT 3275 ATOM 2781 O WAT 3276 115.822 72.018 141.870 1.00 0.00 O ATOM 2782 H1 WAT 3276 115.047 72.449 142.232 1.00 0.00 H ATOM 2783 H2 WAT 3276 115.499 71.556 141.097 1.00 0.00 H TER 2785 WAT 3276 ATOM 2785 O WAT 3277 17.357 19.156 87.484 1.00 0.00 O ATOM 2786 H1 WAT 3277 17.687 19.717 88.186 1.00 0.00 H ATOM 2787 H2 WAT 3277 16.441 19.000 87.714 1.00 0.00 H TER 2789 WAT 3277 ATOM 2789 O WAT 3278 99.935 12.773 117.766 1.00 0.00 O ATOM 2790 H1 WAT 3278 99.721 13.525 118.319 1.00 0.00 H ATOM 2791 H2 WAT 3278 100.512 12.235 118.307 1.00 0.00 H TER 2793 WAT 3278 ATOM 2793 O WAT 3279 34.015 58.785 144.237 1.00 0.00 O ATOM 2794 H1 WAT 3279 34.613 58.820 144.984 1.00 0.00 H ATOM 2795 H2 WAT 3279 34.058 59.662 143.855 1.00 0.00 H TER 2797 WAT 3279 ATOM 2797 O WAT 3280 30.086 4.379 0.389 1.00 0.00 O ATOM 2798 H1 WAT 3280 29.731 5.266 0.437 1.00 0.00 H ATOM 2799 H2 WAT 3280 29.599 3.964 -0.323 1.00 0.00 H TER 2801 WAT 3280 ATOM 2801 O WAT 3281 31.394 15.535 134.792 1.00 0.00 O ATOM 2802 H1 WAT 3281 31.349 16.184 134.090 1.00 0.00 H ATOM 2803 H2 WAT 3281 30.488 15.253 134.918 1.00 0.00 H TER 2805 WAT 3281 ATOM 2805 O WAT 3282 127.742 35.097 155.452 1.00 0.00 O ATOM 2806 H1 WAT 3282 127.291 34.824 154.653 1.00 0.00 H ATOM 2807 H2 WAT 3282 128.512 34.531 155.499 1.00 0.00 H TER 2809 WAT 3282 ATOM 2809 O WAT 3283 110.167 80.017 91.127 1.00 0.00 O ATOM 2810 H1 WAT 3283 110.698 79.916 91.917 1.00 0.00 H ATOM 2811 H2 WAT 3283 109.486 80.643 91.374 1.00 0.00 H TER 2813 WAT 3283 ATOM 2813 O WAT 3284 133.938 18.327 103.648 1.00 0.00 O ATOM 2814 H1 WAT 3284 133.242 18.605 103.053 1.00 0.00 H ATOM 2815 H2 WAT 3284 133.896 17.370 103.635 1.00 0.00 H TER 2817 WAT 3284 ATOM 2817 O WAT 3285 31.281 1.706 16.555 1.00 0.00 O ATOM 2818 H1 WAT 3285 31.233 1.767 17.508 1.00 0.00 H ATOM 2819 H2 WAT 3285 32.216 1.618 16.367 1.00 0.00 H TER 2821 WAT 3285 ATOM 2821 O WAT 3286 99.035 134.063 98.550 1.00 0.00 O ATOM 2822 H1 WAT 3286 99.612 133.976 99.309 1.00 0.00 H ATOM 2823 H2 WAT 3286 98.443 133.313 98.613 1.00 0.00 H TER 2825 WAT 3286 ATOM 2825 O WAT 3287 96.860 102.035 21.231 1.00 0.00 O ATOM 2826 H1 WAT 3287 96.962 102.966 21.029 1.00 0.00 H ATOM 2827 H2 WAT 3287 96.712 102.010 22.176 1.00 0.00 H TER 2829 WAT 3287 ATOM 2829 O WAT 3288 103.405 24.579 69.318 1.00 0.00 O ATOM 2830 H1 WAT 3288 103.113 24.934 68.479 1.00 0.00 H ATOM 2831 H2 WAT 3288 104.211 25.057 69.513 1.00 0.00 H TER 2833 WAT 3288 ATOM 2833 O WAT 3289 56.835 61.435 124.209 1.00 0.00 O ATOM 2834 H1 WAT 3289 57.321 60.943 124.872 1.00 0.00 H ATOM 2835 H2 WAT 3289 55.923 61.177 124.341 1.00 0.00 H TER 2837 WAT 3289 ATOM 2837 O WAT 3290 138.219 137.507 6.288 1.00 0.00 O ATOM 2838 H1 WAT 3290 138.706 137.184 7.046 1.00 0.00 H ATOM 2839 H2 WAT 3290 138.094 136.735 5.736 1.00 0.00 H TER 2841 WAT 3290 ATOM 2841 O WAT 3291 5.842 45.191 140.831 1.00 0.00 O ATOM 2842 H1 WAT 3291 6.488 44.637 141.269 1.00 0.00 H ATOM 2843 H2 WAT 3291 5.720 44.783 139.973 1.00 0.00 H TER 2845 WAT 3291 ATOM 2845 O WAT 3292 122.053 126.915 157.751 1.00 0.00 O ATOM 2846 H1 WAT 3292 121.816 126.092 157.324 1.00 0.00 H ATOM 2847 H2 WAT 3292 122.719 126.669 158.394 1.00 0.00 H TER 2849 WAT 3292 ATOM 2849 O WAT 3293 119.139 1.574 142.349 1.00 0.00 O ATOM 2850 H1 WAT 3293 118.375 2.028 141.994 1.00 0.00 H ATOM 2851 H2 WAT 3293 119.757 2.274 142.561 1.00 0.00 H TER 2853 WAT 3293 ATOM 2853 O WAT 3294 110.199 120.781 135.754 1.00 0.00 O ATOM 2854 H1 WAT 3294 109.790 121.330 136.423 1.00 0.00 H ATOM 2855 H2 WAT 3294 110.950 121.293 135.451 1.00 0.00 H TER 2857 WAT 3294 ATOM 2857 O WAT 3295 102.374 65.688 148.572 1.00 0.00 O ATOM 2858 H1 WAT 3295 103.262 65.719 148.216 1.00 0.00 H ATOM 2859 H2 WAT 3295 102.276 66.515 149.044 1.00 0.00 H TER 2861 WAT 3295 ATOM 2861 O WAT 3296 99.732 144.561 75.811 1.00 0.00 O ATOM 2862 H1 WAT 3296 99.613 145.501 75.946 1.00 0.00 H ATOM 2863 H2 WAT 3296 100.310 144.288 76.523 1.00 0.00 H TER 2865 WAT 3296 ATOM 2865 O WAT 3297 31.015 23.654 109.038 1.00 0.00 O ATOM 2866 H1 WAT 3297 31.069 23.482 108.098 1.00 0.00 H ATOM 2867 H2 WAT 3297 31.448 22.904 109.444 1.00 0.00 H TER 2869 WAT 3297 ATOM 2869 O WAT 3298 17.590 10.987 156.158 1.00 0.00 O ATOM 2870 H1 WAT 3298 17.682 10.568 155.302 1.00 0.00 H ATOM 2871 H2 WAT 3298 16.646 11.107 156.266 1.00 0.00 H TER 2873 WAT 3298 ATOM 2873 O WAT 3299 98.159 107.404 67.563 1.00 0.00 O ATOM 2874 H1 WAT 3299 97.717 106.585 67.336 1.00 0.00 H ATOM 2875 H2 WAT 3299 99.091 107.190 67.526 1.00 0.00 H TER 2877 WAT 3299 ATOM 2877 O WAT 3300 72.695 139.445 63.281 1.00 0.00 O ATOM 2878 H1 WAT 3300 73.307 139.113 62.624 1.00 0.00 H ATOM 2879 H2 WAT 3300 73.242 139.638 64.042 1.00 0.00 H TER 2881 WAT 3300 ATOM 2881 O WAT 3301 50.950 105.411 140.699 1.00 0.00 O ATOM 2882 H1 WAT 3301 51.090 105.087 139.809 1.00 0.00 H ATOM 2883 H2 WAT 3301 50.125 105.011 140.973 1.00 0.00 H TER 2885 WAT 3301 ATOM 2885 O WAT 3302 30.103 25.154 144.063 1.00 0.00 O ATOM 2886 H1 WAT 3302 30.989 24.967 143.751 1.00 0.00 H ATOM 2887 H2 WAT 3302 30.219 25.852 144.708 1.00 0.00 H TER 2889 WAT 3302 ATOM 2889 O WAT 3303 145.412 60.235 59.754 1.00 0.00 O ATOM 2890 H1 WAT 3303 144.845 60.673 60.389 1.00 0.00 H ATOM 2891 H2 WAT 3303 146.095 59.825 60.286 1.00 0.00 H TER 2893 WAT 3303 ATOM 2893 O WAT 3304 112.005 49.727 83.269 1.00 0.00 O ATOM 2894 H1 WAT 3304 111.101 49.602 83.560 1.00 0.00 H ATOM 2895 H2 WAT 3304 112.516 49.745 84.077 1.00 0.00 H TER 2897 WAT 3304 ATOM 2897 O WAT 3305 5.143 68.054 85.097 1.00 0.00 O ATOM 2898 H1 WAT 3305 5.066 68.931 85.472 1.00 0.00 H ATOM 2899 H2 WAT 3305 4.703 68.116 84.249 1.00 0.00 H TER 2901 WAT 3305 ATOM 2901 O WAT 3306 34.541 36.188 64.999 1.00 0.00 O ATOM 2902 H1 WAT 3306 34.471 37.088 65.318 1.00 0.00 H ATOM 2903 H2 WAT 3306 35.437 36.119 64.670 1.00 0.00 H TER 2905 WAT 3306 ATOM 2905 O WAT 3307 71.039 110.041 83.243 1.00 0.00 O ATOM 2906 H1 WAT 3307 70.548 109.640 82.527 1.00 0.00 H ATOM 2907 H2 WAT 3307 71.330 110.883 82.893 1.00 0.00 H TER 2909 WAT 3307 ATOM 2909 O WAT 3308 118.067 38.037 150.674 1.00 0.00 O ATOM 2910 H1 WAT 3308 118.467 38.874 150.437 1.00 0.00 H ATOM 2911 H2 WAT 3308 117.974 38.077 151.625 1.00 0.00 H TER 2913 WAT 3308 ATOM 2913 O WAT 3309 23.173 118.859 142.994 1.00 0.00 O ATOM 2914 H1 WAT 3309 23.158 118.133 142.370 1.00 0.00 H ATOM 2915 H2 WAT 3309 23.815 118.594 143.653 1.00 0.00 H TER 2917 WAT 3309 ATOM 2917 O WAT 3310 76.794 119.387 77.924 1.00 0.00 O ATOM 2918 H1 WAT 3310 77.102 118.554 78.280 1.00 0.00 H ATOM 2919 H2 WAT 3310 76.928 119.308 76.980 1.00 0.00 H TER 2921 WAT 3310 ATOM 2921 O WAT 3311 55.266 96.637 119.187 1.00 0.00 O ATOM 2922 H1 WAT 3311 54.715 96.293 118.484 1.00 0.00 H ATOM 2923 H2 WAT 3311 55.389 97.560 118.965 1.00 0.00 H TER 2925 WAT 3311 ATOM 2925 O WAT 3312 63.350 128.341 158.198 1.00 0.00 O ATOM 2926 H1 WAT 3312 63.381 129.232 158.548 1.00 0.00 H ATOM 2927 H2 WAT 3312 64.242 128.172 157.895 1.00 0.00 H TER 2929 WAT 3312 ATOM 2929 O WAT 3313 20.286 19.806 91.478 1.00 0.00 O ATOM 2930 H1 WAT 3313 20.062 20.734 91.544 1.00 0.00 H ATOM 2931 H2 WAT 3313 21.235 19.780 91.595 1.00 0.00 H TER 2933 WAT 3313 ATOM 2933 O WAT 3314 89.721 131.653 153.758 1.00 0.00 O ATOM 2934 H1 WAT 3314 89.939 131.330 152.883 1.00 0.00 H ATOM 2935 H2 WAT 3314 90.530 131.552 154.259 1.00 0.00 H TER 2937 WAT 3314 ATOM 2937 O WAT 3315 81.462 3.885 119.342 1.00 0.00 O ATOM 2938 H1 WAT 3315 81.193 3.644 118.455 1.00 0.00 H ATOM 2939 H2 WAT 3315 80.895 4.621 119.572 1.00 0.00 H TER 2941 WAT 3315 ATOM 2941 O WAT 3316 44.367 119.027 129.161 1.00 0.00 O ATOM 2942 H1 WAT 3316 45.039 119.688 128.999 1.00 0.00 H ATOM 2943 H2 WAT 3316 43.896 118.955 128.331 1.00 0.00 H TER 2945 WAT 3316 ATOM 2945 O WAT 3317 134.269 141.397 65.909 1.00 0.00 O ATOM 2946 H1 WAT 3317 134.369 140.862 65.121 1.00 0.00 H ATOM 2947 H2 WAT 3317 134.269 142.299 65.588 1.00 0.00 H TER 2949 WAT 3317 ATOM 2949 O WAT 3318 134.250 23.305 113.780 1.00 0.00 O ATOM 2950 H1 WAT 3318 134.366 23.513 112.853 1.00 0.00 H ATOM 2951 H2 WAT 3318 134.950 22.683 113.976 1.00 0.00 H TER 2953 WAT 3318 ATOM 2953 O WAT 3319 96.897 136.393 106.457 1.00 0.00 O ATOM 2954 H1 WAT 3319 96.117 136.598 105.941 1.00 0.00 H ATOM 2955 H2 WAT 3319 96.618 136.496 107.366 1.00 0.00 H TER 2957 WAT 3319 ATOM 2957 O WAT 3320 116.728 58.610 148.893 1.00 0.00 O ATOM 2958 H1 WAT 3320 116.172 58.651 148.115 1.00 0.00 H ATOM 2959 H2 WAT 3320 116.743 57.682 149.129 1.00 0.00 H TER 2961 WAT 3320 ATOM 2961 O WAT 3321 109.651 38.125 108.941 1.00 0.00 O ATOM 2962 H1 WAT 3321 108.893 38.572 109.317 1.00 0.00 H ATOM 2963 H2 WAT 3321 109.497 38.145 107.996 1.00 0.00 H TER 2965 WAT 3321 ATOM 2965 O WAT 3322 4.189 65.737 86.132 1.00 0.00 O ATOM 2966 H1 WAT 3322 4.346 66.627 85.820 1.00 0.00 H ATOM 2967 H2 WAT 3322 3.283 65.747 86.440 1.00 0.00 H TER 2969 WAT 3322 ATOM 2969 O WAT 3323 103.728 143.224 17.975 1.00 0.00 O ATOM 2970 H1 WAT 3323 103.877 142.308 18.209 1.00 0.00 H ATOM 2971 H2 WAT 3323 104.601 143.617 17.975 1.00 0.00 H TER 2973 WAT 3323 ATOM 2973 O WAT 3324 55.012 95.975 90.881 1.00 0.00 O ATOM 2974 H1 WAT 3324 54.906 95.438 91.667 1.00 0.00 H ATOM 2975 H2 WAT 3324 54.258 95.751 90.335 1.00 0.00 H TER 2977 WAT 3324 ATOM 2977 O WAT 3325 67.510 82.493 136.168 1.00 0.00 O ATOM 2978 H1 WAT 3325 67.662 83.437 136.211 1.00 0.00 H ATOM 2979 H2 WAT 3325 68.385 82.113 136.093 1.00 0.00 H TER 2981 WAT 3325 ATOM 2981 O WAT 3326 7.418 138.088 64.138 1.00 0.00 O ATOM 2982 H1 WAT 3326 8.081 138.326 64.787 1.00 0.00 H ATOM 2983 H2 WAT 3326 7.510 137.140 64.039 1.00 0.00 H TER 2985 WAT 3326 ATOM 2985 O WAT 3327 92.344 127.144 64.105 1.00 0.00 O ATOM 2986 H1 WAT 3327 92.666 127.457 63.259 1.00 0.00 H ATOM 2987 H2 WAT 3327 93.079 127.274 64.704 1.00 0.00 H TER 2989 WAT 3327 ATOM 2989 O WAT 3328 57.886 96.905 128.284 1.00 0.00 O ATOM 2990 H1 WAT 3328 58.402 96.541 129.004 1.00 0.00 H ATOM 2991 H2 WAT 3328 57.285 97.518 128.706 1.00 0.00 H TER 2993 WAT 3328 ATOM 2993 O WAT 3329 126.050 50.279 82.001 1.00 0.00 O ATOM 2994 H1 WAT 3329 125.257 50.688 82.348 1.00 0.00 H ATOM 2995 H2 WAT 3329 126.653 51.009 81.860 1.00 0.00 H TER 2997 WAT 3329 ATOM 2997 O WAT 3330 100.425 56.346 140.176 1.00 0.00 O ATOM 2998 H1 WAT 3330 100.836 57.188 139.980 1.00 0.00 H ATOM 2999 H2 WAT 3330 100.100 56.440 141.071 1.00 0.00 H TER 3001 WAT 3330 ATOM 3001 O WAT 3331 96.798 105.406 58.558 1.00 0.00 O ATOM 3002 H1 WAT 3331 96.793 104.467 58.745 1.00 0.00 H ATOM 3003 H2 WAT 3331 97.725 105.626 58.463 1.00 0.00 H TER 3005 WAT 3331 ATOM 3005 O WAT 3332 63.352 33.291 143.921 1.00 0.00 O ATOM 3006 H1 WAT 3332 64.120 33.836 143.751 1.00 0.00 H ATOM 3007 H2 WAT 3332 63.658 32.634 144.546 1.00 0.00 H TER 3009 WAT 3332 ATOM 3009 O WAT 3333 88.646 95.938 136.173 1.00 0.00 O ATOM 3010 H1 WAT 3333 89.098 96.771 136.305 1.00 0.00 H ATOM 3011 H2 WAT 3333 88.041 95.875 136.912 1.00 0.00 H TER 3013 WAT 3333 ATOM 3013 O WAT 3334 88.438 131.930 66.410 1.00 0.00 O ATOM 3014 H1 WAT 3334 88.671 132.858 66.411 1.00 0.00 H ATOM 3015 H2 WAT 3334 89.158 131.502 66.875 1.00 0.00 H TER 3017 WAT 3334 ATOM 3017 O WAT 3335 85.451 91.755 70.492 1.00 0.00 O ATOM 3018 H1 WAT 3335 85.091 91.815 71.377 1.00 0.00 H ATOM 3019 H2 WAT 3335 85.847 92.612 70.336 1.00 0.00 H TER 3021 WAT 3335 ATOM 3021 O WAT 3336 105.556 29.457 2.513 1.00 0.00 O ATOM 3022 H1 WAT 3336 105.048 28.772 2.947 1.00 0.00 H ATOM 3023 H2 WAT 3336 105.878 30.006 3.228 1.00 0.00 H TER 3025 WAT 3336 ATOM 3025 O WAT 3337 47.098 133.409 110.922 1.00 0.00 O ATOM 3026 H1 WAT 3337 46.490 133.040 111.563 1.00 0.00 H ATOM 3027 H2 WAT 3337 46.660 133.289 110.080 1.00 0.00 H TER 3029 WAT 3337 ATOM 3029 O WAT 3338 121.538 130.940 118.912 1.00 0.00 O ATOM 3030 H1 WAT 3338 120.674 130.531 118.870 1.00 0.00 H ATOM 3031 H2 WAT 3338 122.032 130.530 118.202 1.00 0.00 H TER 3033 WAT 3338 ATOM 3033 O WAT 3339 69.983 15.044 112.540 1.00 0.00 O ATOM 3034 H1 WAT 3339 69.247 15.496 112.952 1.00 0.00 H ATOM 3035 H2 WAT 3339 69.765 15.031 111.608 1.00 0.00 H TER 3037 WAT 3339 ATOM 3037 O WAT 3340 111.578 109.325 91.446 1.00 0.00 O ATOM 3038 H1 WAT 3340 112.183 109.518 92.162 1.00 0.00 H ATOM 3039 H2 WAT 3340 111.022 110.103 91.386 1.00 0.00 H TER 3041 WAT 3340 ATOM 3041 O WAT 3341 31.874 0.501 133.153 1.00 0.00 O ATOM 3042 H1 WAT 3341 31.385 -0.259 133.467 1.00 0.00 H ATOM 3043 H2 WAT 3341 31.223 1.201 133.102 1.00 0.00 H TER 3045 WAT 3341 ATOM 3045 O WAT 3342 106.927 63.346 122.873 1.00 0.00 O ATOM 3046 H1 WAT 3342 106.937 64.095 122.276 1.00 0.00 H ATOM 3047 H2 WAT 3342 106.956 62.582 122.297 1.00 0.00 H TER 3049 WAT 3342 ATOM 3049 O WAT 3343 51.547 103.578 120.621 1.00 0.00 O ATOM 3050 H1 WAT 3343 51.774 103.703 119.699 1.00 0.00 H ATOM 3051 H2 WAT 3343 51.304 102.654 120.684 1.00 0.00 H TER 3053 WAT 3343 ATOM 3053 O WAT 3344 62.254 70.456 105.169 1.00 0.00 O ATOM 3054 H1 WAT 3344 62.072 70.263 104.250 1.00 0.00 H ATOM 3055 H2 WAT 3344 61.587 71.097 105.416 1.00 0.00 H TER 3057 WAT 3344 ATOM 3057 O WAT 3345 95.384 130.818 115.570 1.00 0.00 O ATOM 3058 H1 WAT 3345 94.604 131.225 115.947 1.00 0.00 H ATOM 3059 H2 WAT 3345 95.488 131.243 114.718 1.00 0.00 H TER 3061 WAT 3345 ATOM 3061 O WAT 3346 47.642 99.304 112.212 1.00 0.00 O ATOM 3062 H1 WAT 3346 46.703 99.245 112.388 1.00 0.00 H ATOM 3063 H2 WAT 3346 47.726 100.035 111.600 1.00 0.00 H TER 3065 WAT 3346 ATOM 3065 O WAT 3347 126.912 119.614 101.796 1.00 0.00 O ATOM 3066 H1 WAT 3347 126.475 119.461 100.958 1.00 0.00 H ATOM 3067 H2 WAT 3347 126.753 120.540 101.983 1.00 0.00 H TER 3069 WAT 3347 ATOM 3069 O WAT 3348 32.383 1.304 137.521 1.00 0.00 O ATOM 3070 H1 WAT 3348 32.927 0.878 138.184 1.00 0.00 H ATOM 3071 H2 WAT 3348 32.851 1.161 136.699 1.00 0.00 H TER 3073 WAT 3348 ATOM 3073 O WAT 3349 3.280 99.211 108.077 1.00 0.00 O ATOM 3074 H1 WAT 3349 3.564 99.859 107.433 1.00 0.00 H ATOM 3075 H2 WAT 3349 2.569 99.640 108.552 1.00 0.00 H TER 3077 WAT 3349 ATOM 3077 O WAT 3350 141.342 88.037 137.147 1.00 0.00 O ATOM 3078 H1 WAT 3350 141.669 88.349 137.990 1.00 0.00 H ATOM 3079 H2 WAT 3350 141.966 87.361 136.883 1.00 0.00 H TER 3081 WAT 3350 ATOM 3081 O WAT 3351 92.577 112.563 101.369 1.00 0.00 O ATOM 3082 H1 WAT 3351 92.440 113.036 100.548 1.00 0.00 H ATOM 3083 H2 WAT 3351 92.583 113.245 102.041 1.00 0.00 H TER 3085 WAT 3351 ATOM 3085 O WAT 3352 61.677 110.309 122.207 1.00 0.00 O ATOM 3086 H1 WAT 3352 61.958 110.958 121.561 1.00 0.00 H ATOM 3087 H2 WAT 3352 61.268 109.616 121.689 1.00 0.00 H TER 3089 WAT 3352 ATOM 3089 O WAT 3353 58.468 21.243 73.839 1.00 0.00 O ATOM 3090 H1 WAT 3353 58.128 20.628 73.190 1.00 0.00 H ATOM 3091 H2 WAT 3353 59.205 20.784 74.241 1.00 0.00 H TER 3093 WAT 3353 ATOM 3093 O WAT 3354 81.930 82.392 114.653 1.00 0.00 O ATOM 3094 H1 WAT 3354 81.855 82.326 115.605 1.00 0.00 H ATOM 3095 H2 WAT 3354 82.456 83.178 114.509 1.00 0.00 H TER 3097 WAT 3354 ATOM 3097 O WAT 3355 0.334 83.537 107.362 1.00 0.00 O ATOM 3098 H1 WAT 3355 0.849 84.292 107.647 1.00 0.00 H ATOM 3099 H2 WAT 3355 0.383 83.560 106.407 1.00 0.00 H TER 3101 WAT 3355 ATOM 3101 O WAT 3356 28.839 88.689 155.330 1.00 0.00 O ATOM 3102 H1 WAT 3356 29.709 88.377 155.082 1.00 0.00 H ATOM 3103 H2 WAT 3356 28.869 89.632 155.171 1.00 0.00 H TER 3105 WAT 3356 ATOM 3105 O WAT 3357 36.121 13.935 152.118 1.00 0.00 O ATOM 3106 H1 WAT 3357 36.461 14.464 151.396 1.00 0.00 H ATOM 3107 H2 WAT 3357 35.603 13.252 151.691 1.00 0.00 H TER 3109 WAT 3357 ATOM 3109 O WAT 3358 144.310 138.601 69.542 1.00 0.00 O ATOM 3110 H1 WAT 3358 143.695 138.536 68.811 1.00 0.00 H ATOM 3111 H2 WAT 3358 144.879 139.336 69.311 1.00 0.00 H TER 3113 WAT 3358 ATOM 3113 O WAT 3359 63.600 78.518 98.187 1.00 0.00 O ATOM 3114 H1 WAT 3359 63.228 79.214 98.728 1.00 0.00 H ATOM 3115 H2 WAT 3359 62.850 78.152 97.719 1.00 0.00 H TER 3117 WAT 3359 ATOM 3117 O WAT 3360 129.401 95.516 2.635 1.00 0.00 O ATOM 3118 H1 WAT 3360 130.105 94.981 3.002 1.00 0.00 H ATOM 3119 H2 WAT 3360 129.556 96.391 2.989 1.00 0.00 H TER 3121 WAT 3360 ATOM 3121 O WAT 3361 135.319 100.877 110.083 1.00 0.00 O ATOM 3122 H1 WAT 3361 134.722 100.634 110.790 1.00 0.00 H ATOM 3123 H2 WAT 3361 135.790 100.069 109.879 1.00 0.00 H TER 3125 WAT 3361 ATOM 3125 O WAT 3362 36.457 118.827 149.939 1.00 0.00 O ATOM 3126 H1 WAT 3362 37.162 119.399 150.245 1.00 0.00 H ATOM 3127 H2 WAT 3362 36.232 119.167 149.073 1.00 0.00 H TER 3129 WAT 3362 ATOM 3129 O WAT 3363 17.757 18.553 154.731 1.00 0.00 O ATOM 3130 H1 WAT 3363 18.146 17.679 154.747 1.00 0.00 H ATOM 3131 H2 WAT 3363 17.115 18.517 154.023 1.00 0.00 H TER 3133 WAT 3363 ATOM 3133 O WAT 3364 61.679 111.805 109.014 1.00 0.00 O ATOM 3134 H1 WAT 3364 60.913 112.086 108.515 1.00 0.00 H ATOM 3135 H2 WAT 3364 61.821 112.506 109.650 1.00 0.00 H TER 3137 WAT 3364 ATOM 3137 O WAT 3365 59.960 142.125 20.640 1.00 0.00 O ATOM 3138 H1 WAT 3365 59.537 141.388 21.080 1.00 0.00 H ATOM 3139 H2 WAT 3365 60.897 141.957 20.737 1.00 0.00 H TER 3141 WAT 3365 ATOM 3141 O WAT 3366 13.920 47.013 61.009 1.00 0.00 O ATOM 3142 H1 WAT 3366 13.638 47.864 61.345 1.00 0.00 H ATOM 3143 H2 WAT 3366 13.112 46.506 60.932 1.00 0.00 H TER 3145 WAT 3366 ATOM 3145 O WAT 3367 62.025 115.387 70.450 1.00 0.00 O ATOM 3146 H1 WAT 3367 62.969 115.303 70.582 1.00 0.00 H ATOM 3147 H2 WAT 3367 61.914 115.382 69.499 1.00 0.00 H TER 3149 WAT 3367 ATOM 3149 O WAT 3368 20.987 37.323 135.182 1.00 0.00 O ATOM 3150 H1 WAT 3368 21.187 37.720 136.030 1.00 0.00 H ATOM 3151 H2 WAT 3368 21.378 37.916 134.541 1.00 0.00 H TER 3153 WAT 3368 ATOM 3153 O WAT 3369 137.974 46.083 128.061 1.00 0.00 O ATOM 3154 H1 WAT 3369 138.250 45.168 128.016 1.00 0.00 H ATOM 3155 H2 WAT 3369 138.468 46.447 128.795 1.00 0.00 H TER 3157 WAT 3369 ATOM 3157 O WAT 3370 36.350 45.018 20.348 1.00 0.00 O ATOM 3158 H1 WAT 3370 36.766 44.566 19.614 1.00 0.00 H ATOM 3159 H2 WAT 3370 35.718 44.386 20.691 1.00 0.00 H TER 3161 WAT 3370 ATOM 3161 O WAT 3371 120.940 17.059 110.863 1.00 0.00 O ATOM 3162 H1 WAT 3371 120.418 17.580 110.253 1.00 0.00 H ATOM 3163 H2 WAT 3371 121.136 16.254 110.384 1.00 0.00 H TER 3165 WAT 3371 ATOM 3165 O WAT 3372 86.964 126.862 91.764 1.00 0.00 O ATOM 3166 H1 WAT 3372 86.955 127.328 92.601 1.00 0.00 H ATOM 3167 H2 WAT 3372 86.052 126.875 91.474 1.00 0.00 H TER 3169 WAT 3372 ATOM 3169 O WAT 3373 99.821 89.492 62.378 1.00 0.00 O ATOM 3170 H1 WAT 3373 99.916 89.246 61.458 1.00 0.00 H ATOM 3171 H2 WAT 3373 100.093 88.712 62.863 1.00 0.00 H TER 3173 WAT 3373 ATOM 3173 O WAT 3374 4.800 72.711 105.333 1.00 0.00 O ATOM 3174 H1 WAT 3374 5.674 72.321 105.373 1.00 0.00 H ATOM 3175 H2 WAT 3374 4.919 73.598 105.674 1.00 0.00 H TER 3177 WAT 3374 ATOM 3177 O WAT 3375 65.420 108.209 69.591 1.00 0.00 O ATOM 3178 H1 WAT 3375 65.188 108.675 70.394 1.00 0.00 H ATOM 3179 H2 WAT 3375 65.905 107.440 69.893 1.00 0.00 H TER 3181 WAT 3375 ATOM 3181 O WAT 3376 42.863 112.699 102.585 1.00 0.00 O ATOM 3182 H1 WAT 3376 43.132 113.525 102.181 1.00 0.00 H ATOM 3183 H2 WAT 3376 43.162 112.768 103.492 1.00 0.00 H TER 3185 WAT 3376 ATOM 3185 O WAT 3377 33.862 86.872 126.952 1.00 0.00 O ATOM 3186 H1 WAT 3377 34.489 87.382 127.465 1.00 0.00 H ATOM 3187 H2 WAT 3377 33.102 86.779 127.526 1.00 0.00 H TER 3189 WAT 3377 ATOM 3189 O WAT 3378 44.445 75.650 156.390 1.00 0.00 O ATOM 3190 H1 WAT 3378 44.332 76.342 155.739 1.00 0.00 H ATOM 3191 H2 WAT 3378 44.650 76.116 157.201 1.00 0.00 H TER 3193 WAT 3378 ATOM 3193 O WAT 3379 38.665 20.590 84.845 1.00 0.00 O ATOM 3194 H1 WAT 3379 39.491 20.109 84.897 1.00 0.00 H ATOM 3195 H2 WAT 3379 37.991 19.923 84.980 1.00 0.00 H TER 3197 WAT 3379 ATOM 3197 O WAT 3380 15.778 138.795 134.747 1.00 0.00 O ATOM 3198 H1 WAT 3380 16.541 138.802 134.168 1.00 0.00 H ATOM 3199 H2 WAT 3380 15.648 139.714 134.982 1.00 0.00 H TER 3201 WAT 3380 ATOM 3201 O WAT 3381 47.357 43.539 90.799 1.00 0.00 O ATOM 3202 H1 WAT 3381 46.636 43.028 90.432 1.00 0.00 H ATOM 3203 H2 WAT 3381 48.142 43.039 90.577 1.00 0.00 H TER 3205 WAT 3381 ATOM 3205 O WAT 3382 115.978 49.066 143.491 1.00 0.00 O ATOM 3206 H1 WAT 3382 116.195 49.553 142.696 1.00 0.00 H ATOM 3207 H2 WAT 3382 116.606 49.380 144.142 1.00 0.00 H TER 3209 WAT 3382 ATOM 3209 O WAT 3383 129.934 83.941 70.296 1.00 0.00 O ATOM 3210 H1 WAT 3383 130.203 84.640 70.893 1.00 0.00 H ATOM 3211 H2 WAT 3383 130.034 83.138 70.807 1.00 0.00 H TER 3213 WAT 3383 ATOM 3213 O WAT 3384 62.676 85.305 132.252 1.00 0.00 O ATOM 3214 H1 WAT 3384 62.515 85.866 133.011 1.00 0.00 H ATOM 3215 H2 WAT 3384 62.842 84.439 132.624 1.00 0.00 H TER 3217 WAT 3384 ATOM 3217 O WAT 3385 3.472 118.114 14.189 1.00 0.00 O ATOM 3218 H1 WAT 3385 2.545 117.883 14.136 1.00 0.00 H ATOM 3219 H2 WAT 3385 3.581 118.467 15.072 1.00 0.00 H TER 3221 WAT 3385 ATOM 3221 O WAT 3386 65.496 143.049 112.358 1.00 0.00 O ATOM 3222 H1 WAT 3386 65.384 143.393 113.245 1.00 0.00 H ATOM 3223 H2 WAT 3386 66.149 142.356 112.451 1.00 0.00 H TER 3225 WAT 3386 ATOM 3225 O WAT 3387 80.535 72.509 2.947 1.00 0.00 O ATOM 3226 H1 WAT 3387 80.162 71.821 3.498 1.00 0.00 H ATOM 3227 H2 WAT 3387 81.204 72.919 3.496 1.00 0.00 H TER 3229 WAT 3387 ATOM 3229 O WAT 3388 122.269 34.163 114.202 1.00 0.00 O ATOM 3230 H1 WAT 3388 121.594 33.989 113.546 1.00 0.00 H ATOM 3231 H2 WAT 3388 122.510 33.298 114.533 1.00 0.00 H TER 3233 WAT 3388 ATOM 3233 O WAT 3389 31.784 45.695 67.627 1.00 0.00 O ATOM 3234 H1 WAT 3389 31.169 45.199 67.086 1.00 0.00 H ATOM 3235 H2 WAT 3389 31.246 46.054 68.333 1.00 0.00 H TER 3237 WAT 3389 ATOM 3237 O WAT 3390 31.507 130.712 0.830 1.00 0.00 O ATOM 3238 H1 WAT 3390 31.488 131.575 0.415 1.00 0.00 H ATOM 3239 H2 WAT 3390 32.318 130.313 0.516 1.00 0.00 H TER 3241 WAT 3390 ATOM 3241 O WAT 3391 123.617 21.783 98.974 1.00 0.00 O ATOM 3242 H1 WAT 3391 124.102 22.056 99.752 1.00 0.00 H ATOM 3243 H2 WAT 3391 123.996 20.935 98.740 1.00 0.00 H TER 3245 WAT 3391 ATOM 3245 O WAT 3392 17.804 141.945 62.158 1.00 0.00 O ATOM 3246 H1 WAT 3392 18.015 142.233 61.269 1.00 0.00 H ATOM 3247 H2 WAT 3392 18.612 142.083 62.652 1.00 0.00 H TER 3249 WAT 3392 ATOM 3249 O WAT 3393 87.023 101.932 145.797 1.00 0.00 O ATOM 3250 H1 WAT 3393 87.168 101.049 146.137 1.00 0.00 H ATOM 3251 H2 WAT 3393 86.632 102.408 146.530 1.00 0.00 H TER 3253 WAT 3393 ATOM 3253 O WAT 3394 135.696 142.849 5.473 1.00 0.00 O ATOM 3254 H1 WAT 3394 136.475 142.394 5.791 1.00 0.00 H ATOM 3255 H2 WAT 3394 136.037 143.617 5.014 1.00 0.00 H TER 3257 WAT 3394 ATOM 3257 O WAT 3395 4.213 102.796 54.143 1.00 0.00 O ATOM 3258 H1 WAT 3395 3.844 102.613 55.007 1.00 0.00 H ATOM 3259 H2 WAT 3395 4.956 103.373 54.317 1.00 0.00 H TER 3261 WAT 3395 ATOM 3261 O WAT 3396 90.256 33.738 148.944 1.00 0.00 O ATOM 3262 H1 WAT 3396 89.612 34.446 148.983 1.00 0.00 H ATOM 3263 H2 WAT 3396 89.871 33.097 148.347 1.00 0.00 H TER 3265 WAT 3396 ATOM 3265 O WAT 3397 125.215 136.906 4.881 1.00 0.00 O ATOM 3266 H1 WAT 3397 125.191 136.996 3.928 1.00 0.00 H ATOM 3267 H2 WAT 3397 124.773 137.689 5.207 1.00 0.00 H TER 3269 WAT 3397 ATOM 3269 O WAT 3398 111.618 64.015 15.406 1.00 0.00 O ATOM 3270 H1 WAT 3398 112.384 64.538 15.645 1.00 0.00 H ATOM 3271 H2 WAT 3398 111.048 64.626 14.938 1.00 0.00 H TER 3273 WAT 3398 ATOM 3273 O WAT 3399 121.166 120.020 117.954 1.00 0.00 O ATOM 3274 H1 WAT 3399 120.430 120.156 117.359 1.00 0.00 H ATOM 3275 H2 WAT 3399 121.447 120.903 118.195 1.00 0.00 H TER 3277 WAT 3399 ATOM 3277 O WAT 3400 108.614 109.702 68.996 1.00 0.00 O ATOM 3278 H1 WAT 3400 107.863 110.266 68.812 1.00 0.00 H ATOM 3279 H2 WAT 3400 108.247 108.965 69.483 1.00 0.00 H TER 3281 WAT 3400 ATOM 3281 O WAT 3401 42.517 87.887 78.457 1.00 0.00 O ATOM 3282 H1 WAT 3401 42.593 88.731 78.903 1.00 0.00 H ATOM 3283 H2 WAT 3401 43.266 87.862 77.862 1.00 0.00 H TER 3285 WAT 3401 ATOM 3285 O WAT 3402 87.507 14.839 121.333 1.00 0.00 O ATOM 3286 H1 WAT 3402 88.381 14.681 120.977 1.00 0.00 H ATOM 3287 H2 WAT 3402 87.551 14.509 122.231 1.00 0.00 H TER 3289 WAT 3402 ATOM 3289 O WAT 3403 39.254 51.812 147.023 1.00 0.00 O ATOM 3290 H1 WAT 3403 38.587 51.400 147.573 1.00 0.00 H ATOM 3291 H2 WAT 3403 39.410 52.663 147.434 1.00 0.00 H TER 3293 WAT 3403 ATOM 3293 O WAT 3404 48.190 138.334 117.975 1.00 0.00 O ATOM 3294 H1 WAT 3404 48.003 139.093 118.527 1.00 0.00 H ATOM 3295 H2 WAT 3404 48.776 138.669 117.296 1.00 0.00 H TER 3297 WAT 3404 ATOM 3297 O WAT 3405 39.910 44.338 123.570 1.00 0.00 O ATOM 3298 H1 WAT 3405 40.794 43.993 123.444 1.00 0.00 H ATOM 3299 H2 WAT 3405 39.667 44.057 124.452 1.00 0.00 H TER 3301 WAT 3405 ATOM 3301 O WAT 3406 43.664 129.981 84.381 1.00 0.00 O ATOM 3302 H1 WAT 3406 43.952 129.463 83.629 1.00 0.00 H ATOM 3303 H2 WAT 3406 42.983 130.555 84.031 1.00 0.00 H TER 3305 WAT 3406 ATOM 3305 O WAT 3407 32.032 61.279 122.170 1.00 0.00 O ATOM 3306 H1 WAT 3407 31.299 61.692 122.627 1.00 0.00 H ATOM 3307 H2 WAT 3407 32.584 62.010 121.892 1.00 0.00 H TER 3309 WAT 3407 ATOM 3309 O WAT 3408 130.860 97.358 90.150 1.00 0.00 O ATOM 3310 H1 WAT 3408 131.567 96.878 90.582 1.00 0.00 H ATOM 3311 H2 WAT 3408 130.165 96.711 90.036 1.00 0.00 H TER 3313 WAT 3408 ATOM 3313 O WAT 3409 80.299 36.756 112.397 1.00 0.00 O ATOM 3314 H1 WAT 3409 79.523 36.245 112.167 1.00 0.00 H ATOM 3315 H2 WAT 3409 80.995 36.105 112.487 1.00 0.00 H TER 3317 WAT 3409 ATOM 3317 O WAT 3410 55.561 19.161 75.908 1.00 0.00 O ATOM 3318 H1 WAT 3410 56.058 18.438 75.527 1.00 0.00 H ATOM 3319 H2 WAT 3410 54.780 19.231 75.358 1.00 0.00 H TER 3321 WAT 3410 ATOM 3321 O WAT 3411 102.043 18.817 81.987 1.00 0.00 O ATOM 3322 H1 WAT 3411 102.767 19.441 82.032 1.00 0.00 H ATOM 3323 H2 WAT 3411 102.461 17.980 81.783 1.00 0.00 H TER 3325 WAT 3411 ATOM 3325 O WAT 3412 51.715 65.100 29.469 1.00 0.00 O ATOM 3326 H1 WAT 3412 51.144 65.123 28.701 1.00 0.00 H ATOM 3327 H2 WAT 3412 51.384 65.798 30.034 1.00 0.00 H TER 3329 WAT 3412 ATOM 3329 O WAT 3413 19.228 60.573 146.716 1.00 0.00 O ATOM 3330 H1 WAT 3413 18.381 60.913 147.003 1.00 0.00 H ATOM 3331 H2 WAT 3413 19.012 59.927 146.044 1.00 0.00 H TER 3333 WAT 3413 ATOM 3333 O WAT 3414 65.383 30.173 52.160 1.00 0.00 O ATOM 3334 H1 WAT 3414 64.698 29.669 52.600 1.00 0.00 H ATOM 3335 H2 WAT 3414 65.630 29.635 51.407 1.00 0.00 H TER 3337 WAT 3414 ATOM 3337 O WAT 3415 105.203 13.291 74.527 1.00 0.00 O ATOM 3338 H1 WAT 3415 104.919 12.469 74.925 1.00 0.00 H ATOM 3339 H2 WAT 3415 105.303 13.085 73.597 1.00 0.00 H TER 3341 WAT 3415 ATOM 3341 O WAT 3416 52.050 34.325 7.371 1.00 0.00 O ATOM 3342 H1 WAT 3416 52.605 34.532 6.620 1.00 0.00 H ATOM 3343 H2 WAT 3416 51.497 33.604 7.069 1.00 0.00 H TER 3345 WAT 3416 ATOM 3345 O WAT 3417 98.385 138.667 125.617 1.00 0.00 O ATOM 3346 H1 WAT 3417 99.132 138.759 126.209 1.00 0.00 H ATOM 3347 H2 WAT 3417 98.151 137.741 125.669 1.00 0.00 H TER 3349 WAT 3417 ATOM 3349 O WAT 3418 133.883 116.133 129.931 1.00 0.00 O ATOM 3350 H1 WAT 3418 134.000 115.222 130.199 1.00 0.00 H ATOM 3351 H2 WAT 3418 134.232 116.167 129.040 1.00 0.00 H TER 3353 WAT 3418 ATOM 3353 O WAT 3419 82.717 18.706 66.071 1.00 0.00 O ATOM 3354 H1 WAT 3419 82.987 18.071 65.407 1.00 0.00 H ATOM 3355 H2 WAT 3419 81.876 19.038 65.757 1.00 0.00 H TER 3357 WAT 3419 ATOM 3357 O WAT 3420 125.197 144.364 111.815 1.00 0.00 O ATOM 3358 H1 WAT 3420 124.772 144.371 110.958 1.00 0.00 H ATOM 3359 H2 WAT 3420 126.117 144.549 111.628 1.00 0.00 H TER 3361 WAT 3420 ATOM 3361 O WAT 3421 141.934 101.099 2.595 1.00 0.00 O ATOM 3362 H1 WAT 3421 142.835 100.781 2.647 1.00 0.00 H ATOM 3363 H2 WAT 3421 142.019 102.024 2.367 1.00 0.00 H TER 3365 WAT 3421 ATOM 3365 O WAT 3422 38.346 7.517 148.571 1.00 0.00 O ATOM 3366 H1 WAT 3422 37.760 8.272 148.618 1.00 0.00 H ATOM 3367 H2 WAT 3422 37.766 6.773 148.406 1.00 0.00 H TER 3369 WAT 3422 ATOM 3369 O WAT 3423 42.889 28.685 64.896 1.00 0.00 O ATOM 3370 H1 WAT 3423 43.313 27.974 64.415 1.00 0.00 H ATOM 3371 H2 WAT 3423 43.254 28.628 65.778 1.00 0.00 H TER 3373 WAT 3423 ATOM 3373 O WAT 3424 31.765 56.848 90.089 1.00 0.00 O ATOM 3374 H1 WAT 3424 32.010 57.572 89.513 1.00 0.00 H ATOM 3375 H2 WAT 3424 32.599 56.462 90.357 1.00 0.00 H TER 3377 WAT 3424 ATOM 3377 O WAT 3425 116.124 120.341 17.798 1.00 0.00 O ATOM 3378 H1 WAT 3425 116.585 121.174 17.894 1.00 0.00 H ATOM 3379 H2 WAT 3425 115.835 120.331 16.886 1.00 0.00 H TER 3381 WAT 3425 ATOM 3381 O WAT 3426 80.224 80.412 109.922 1.00 0.00 O ATOM 3382 H1 WAT 3426 79.293 80.428 109.703 1.00 0.00 H ATOM 3383 H2 WAT 3426 80.670 80.488 109.079 1.00 0.00 H TER 3385 WAT 3426 ATOM 3385 O WAT 3427 128.133 114.532 66.193 1.00 0.00 O ATOM 3386 H1 WAT 3427 127.430 115.063 66.567 1.00 0.00 H ATOM 3387 H2 WAT 3427 127.681 113.829 65.727 1.00 0.00 H TER 3389 WAT 3427 ATOM 3389 O WAT 3428 73.382 96.299 67.439 1.00 0.00 O ATOM 3390 H1 WAT 3428 73.505 95.995 66.540 1.00 0.00 H ATOM 3391 H2 WAT 3428 74.141 95.957 67.913 1.00 0.00 H TER 3393 WAT 3428 ATOM 3393 O WAT 3429 110.423 29.446 69.487 1.00 0.00 O ATOM 3394 H1 WAT 3429 109.526 29.524 69.810 1.00 0.00 H ATOM 3395 H2 WAT 3429 110.840 30.272 69.735 1.00 0.00 H TER 3397 WAT 3429 ATOM 3397 O WAT 3430 36.719 105.793 87.011 1.00 0.00 O ATOM 3398 H1 WAT 3430 37.041 105.017 86.552 1.00 0.00 H ATOM 3399 H2 WAT 3430 35.768 105.693 87.013 1.00 0.00 H TER 3401 WAT 3430 ATOM 3401 O WAT 3431 39.766 90.636 86.038 1.00 0.00 O ATOM 3402 H1 WAT 3431 39.830 91.384 86.631 1.00 0.00 H ATOM 3403 H2 WAT 3431 40.471 90.770 85.405 1.00 0.00 H TER 3405 WAT 3431 ATOM 3405 O WAT 3432 106.344 20.127 105.035 1.00 0.00 O ATOM 3406 H1 WAT 3432 106.798 20.053 104.196 1.00 0.00 H ATOM 3407 H2 WAT 3432 106.363 21.063 105.236 1.00 0.00 H TER 3409 WAT 3432 ATOM 3409 O WAT 3433 0.015 74.038 18.711 1.00 0.00 O ATOM 3410 H1 WAT 3433 0.921 74.280 18.521 1.00 0.00 H ATOM 3411 H2 WAT 3433 0.048 73.095 18.875 1.00 0.00 H TER 3413 WAT 3433 ATOM 3413 O WAT 3434 98.526 134.824 119.303 1.00 0.00 O ATOM 3414 H1 WAT 3434 98.830 134.950 118.404 1.00 0.00 H ATOM 3415 H2 WAT 3434 99.287 134.476 119.766 1.00 0.00 H TER 3417 WAT 3434 ATOM 3417 O WAT 3435 35.811 26.281 2.042 1.00 0.00 O ATOM 3418 H1 WAT 3435 35.315 25.468 2.134 1.00 0.00 H ATOM 3419 H2 WAT 3435 36.428 26.269 2.773 1.00 0.00 H TER 3421 WAT 3435 ATOM 3421 O WAT 3436 8.036 46.506 70.847 1.00 0.00 O ATOM 3422 H1 WAT 3436 8.742 45.873 70.973 1.00 0.00 H ATOM 3423 H2 WAT 3436 8.336 47.059 70.126 1.00 0.00 H TER 3425 WAT 3436 ATOM 3425 O WAT 3437 86.174 36.074 60.996 1.00 0.00 O ATOM 3426 H1 WAT 3437 85.779 36.859 61.378 1.00 0.00 H ATOM 3427 H2 WAT 3437 87.088 36.314 60.849 1.00 0.00 H TER 3429 WAT 3437 ATOM 3429 O WAT 3438 129.792 27.113 99.242 1.00 0.00 O ATOM 3430 H1 WAT 3438 129.039 27.100 98.650 1.00 0.00 H ATOM 3431 H2 WAT 3438 129.443 27.456 100.065 1.00 0.00 H TER 3433 WAT 3438 ATOM 3433 O WAT 3439 141.061 120.891 58.153 1.00 0.00 O ATOM 3434 H1 WAT 3439 140.334 121.494 57.998 1.00 0.00 H ATOM 3435 H2 WAT 3439 140.981 120.236 57.461 1.00 0.00 H TER 3437 WAT 3439 ATOM 3437 O WAT 3440 73.624 34.595 134.418 1.00 0.00 O ATOM 3438 H1 WAT 3440 72.806 34.388 133.967 1.00 0.00 H ATOM 3439 H2 WAT 3440 74.297 34.517 133.742 1.00 0.00 H TER 3441 WAT 3440 ATOM 3441 O WAT 3441 126.197 142.456 10.610 1.00 0.00 O ATOM 3442 H1 WAT 3441 125.571 142.855 10.005 1.00 0.00 H ATOM 3443 H2 WAT 3441 125.664 141.886 11.165 1.00 0.00 H TER 3445 WAT 3441 ATOM 3445 O WAT 3442 3.596 104.554 140.917 1.00 0.00 O ATOM 3446 H1 WAT 3442 4.159 104.907 140.227 1.00 0.00 H ATOM 3447 H2 WAT 3442 3.019 103.940 140.463 1.00 0.00 H TER 3449 WAT 3442 ATOM 3449 O WAT 3443 4.161 99.137 1.270 1.00 0.00 O ATOM 3450 H1 WAT 3443 3.277 98.989 0.934 1.00 0.00 H ATOM 3451 H2 WAT 3443 4.409 99.994 0.923 1.00 0.00 H TER 3453 WAT 3443 ATOM 3453 O WAT 3444 94.664 61.737 133.169 1.00 0.00 O ATOM 3454 H1 WAT 3444 93.827 61.688 132.706 1.00 0.00 H ATOM 3455 H2 WAT 3444 94.445 61.543 134.080 1.00 0.00 H TER 3457 WAT 3444 ATOM 3457 O WAT 3445 18.291 73.701 5.552 1.00 0.00 O ATOM 3458 H1 WAT 3445 18.359 74.439 4.946 1.00 0.00 H ATOM 3459 H2 WAT 3445 17.404 73.366 5.423 1.00 0.00 H TER 3461 WAT 3445 ATOM 3461 O WAT 3446 111.955 20.942 20.175 1.00 0.00 O ATOM 3462 H1 WAT 3446 112.048 21.880 20.343 1.00 0.00 H ATOM 3463 H2 WAT 3446 112.853 20.610 20.168 1.00 0.00 H TER 3465 WAT 3446 ATOM 3465 O WAT 3447 10.140 78.144 23.666 1.00 0.00 O ATOM 3466 H1 WAT 3447 10.065 78.090 22.713 1.00 0.00 H ATOM 3467 H2 WAT 3447 10.595 78.972 23.824 1.00 0.00 H TER 3469 WAT 3447 ATOM 3469 O WAT 3448 14.071 40.415 91.497 1.00 0.00 O ATOM 3470 H1 WAT 3448 14.471 40.053 92.288 1.00 0.00 H ATOM 3471 H2 WAT 3448 14.404 41.311 91.449 1.00 0.00 H TER 3473 WAT 3448 ATOM 3473 O WAT 3449 27.704 7.597 6.914 1.00 0.00 O ATOM 3474 H1 WAT 3449 28.565 7.360 7.257 1.00 0.00 H ATOM 3475 H2 WAT 3449 27.094 7.357 7.612 1.00 0.00 H TER 3477 WAT 3449 ATOM 3477 O WAT 3450 25.670 57.364 3.145 1.00 0.00 O ATOM 3478 H1 WAT 3450 26.260 57.823 3.744 1.00 0.00 H ATOM 3479 H2 WAT 3450 25.904 56.440 3.241 1.00 0.00 H TER 3481 WAT 3450 ATOM 3481 O WAT 3451 134.162 54.449 16.943 1.00 0.00 O ATOM 3482 H1 WAT 3451 133.391 54.614 17.486 1.00 0.00 H ATOM 3483 H2 WAT 3451 134.904 54.621 17.522 1.00 0.00 H TER 3485 WAT 3451 ATOM 3485 O WAT 3452 53.788 52.870 97.197 1.00 0.00 O ATOM 3486 H1 WAT 3452 53.555 52.559 98.072 1.00 0.00 H ATOM 3487 H2 WAT 3452 53.973 52.073 96.701 1.00 0.00 H TER 3489 WAT 3452 ATOM 3489 O WAT 3453 6.508 106.618 95.310 1.00 0.00 O ATOM 3490 H1 WAT 3453 6.348 105.675 95.348 1.00 0.00 H ATOM 3491 H2 WAT 3453 7.389 106.726 95.668 1.00 0.00 H TER 3493 WAT 3453 ATOM 3493 O WAT 3454 61.584 21.116 119.138 1.00 0.00 O ATOM 3494 H1 WAT 3454 61.027 20.479 119.584 1.00 0.00 H ATOM 3495 H2 WAT 3454 61.007 21.861 118.966 1.00 0.00 H TER 3497 WAT 3454 ATOM 3497 O WAT 3455 14.628 134.581 18.801 1.00 0.00 O ATOM 3498 H1 WAT 3455 14.267 134.786 19.664 1.00 0.00 H ATOM 3499 H2 WAT 3455 14.132 135.134 18.197 1.00 0.00 H TER 3501 WAT 3455 ATOM 3501 O WAT 3456 118.764 128.956 68.346 1.00 0.00 O ATOM 3502 H1 WAT 3456 117.938 129.345 68.059 1.00 0.00 H ATOM 3503 H2 WAT 3456 118.896 128.213 67.757 1.00 0.00 H TER 3505 WAT 3456 ATOM 3505 O WAT 3457 96.955 73.174 18.148 1.00 0.00 O ATOM 3506 H1 WAT 3457 96.431 73.750 17.591 1.00 0.00 H ATOM 3507 H2 WAT 3457 97.544 73.765 18.617 1.00 0.00 H TER 3509 WAT 3457 ATOM 3509 O WAT 3458 105.962 17.288 21.457 1.00 0.00 O ATOM 3510 H1 WAT 3458 106.453 17.619 22.210 1.00 0.00 H ATOM 3511 H2 WAT 3458 105.363 18.000 21.231 1.00 0.00 H TER 3513 WAT 3458 ATOM 3513 O WAT 3459 8.529 89.258 119.723 1.00 0.00 O ATOM 3514 H1 WAT 3459 8.336 90.184 119.869 1.00 0.00 H ATOM 3515 H2 WAT 3459 8.856 89.221 118.824 1.00 0.00 H TER 3517 WAT 3459 ATOM 3517 O WAT 3460 70.831 48.367 123.868 1.00 0.00 O ATOM 3518 H1 WAT 3460 70.539 48.807 124.666 1.00 0.00 H ATOM 3519 H2 WAT 3460 71.364 49.020 123.416 1.00 0.00 H TER 3521 WAT 3460 ATOM 3521 O WAT 3461 25.725 94.421 127.966 1.00 0.00 O ATOM 3522 H1 WAT 3461 26.398 93.780 127.739 1.00 0.00 H ATOM 3523 H2 WAT 3461 26.207 95.142 128.371 1.00 0.00 H TER 3525 WAT 3461 ATOM 3525 O WAT 3462 112.744 134.396 124.071 1.00 0.00 O ATOM 3526 H1 WAT 3462 112.975 135.272 123.763 1.00 0.00 H ATOM 3527 H2 WAT 3462 111.787 134.394 124.092 1.00 0.00 H TER 3529 WAT 3462 ATOM 3529 O WAT 3463 108.798 36.353 16.919 1.00 0.00 O ATOM 3530 H1 WAT 3463 108.844 36.120 17.846 1.00 0.00 H ATOM 3531 H2 WAT 3463 108.803 35.514 16.459 1.00 0.00 H TER 3533 WAT 3463 ATOM 3533 O WAT 3464 116.786 39.377 98.344 1.00 0.00 O ATOM 3534 H1 WAT 3464 116.827 38.428 98.225 1.00 0.00 H ATOM 3535 H2 WAT 3464 117.122 39.522 99.229 1.00 0.00 H TER 3537 WAT 3464 ATOM 3537 O WAT 3465 127.554 70.277 12.833 1.00 0.00 O ATOM 3538 H1 WAT 3465 128.243 69.615 12.777 1.00 0.00 H ATOM 3539 H2 WAT 3465 127.107 70.229 11.988 1.00 0.00 H TER 3541 WAT 3465 ATOM 3541 O WAT 3466 145.331 132.982 114.195 1.00 0.00 O ATOM 3542 H1 WAT 3466 145.372 133.800 113.701 1.00 0.00 H ATOM 3543 H2 WAT 3466 144.437 132.666 114.061 1.00 0.00 H TER 3545 WAT 3466 ATOM 3545 O WAT 3467 79.899 57.852 64.695 1.00 0.00 O ATOM 3546 H1 WAT 3467 79.186 57.676 64.081 1.00 0.00 H ATOM 3547 H2 WAT 3467 79.458 58.100 65.508 1.00 0.00 H TER 3549 WAT 3467 ATOM 3549 O WAT 3468 27.686 117.205 98.969 1.00 0.00 O ATOM 3550 H1 WAT 3468 27.540 117.682 98.153 1.00 0.00 H ATOM 3551 H2 WAT 3468 28.367 117.706 99.420 1.00 0.00 H TER 3553 WAT 3468 ATOM 3553 O WAT 3469 116.018 124.535 93.537 1.00 0.00 O ATOM 3554 H1 WAT 3469 116.132 125.283 92.951 1.00 0.00 H ATOM 3555 H2 WAT 3469 115.963 123.779 92.953 1.00 0.00 H TER 3557 WAT 3469 ATOM 3557 O WAT 3470 39.677 98.596 108.331 1.00 0.00 O ATOM 3558 H1 WAT 3470 38.909 98.178 108.720 1.00 0.00 H ATOM 3559 H2 WAT 3470 39.356 99.444 108.023 1.00 0.00 H TER 3561 WAT 3470 ATOM 3561 O WAT 3471 18.069 33.067 125.346 1.00 0.00 O ATOM 3562 H1 WAT 3471 17.825 32.480 126.062 1.00 0.00 H ATOM 3563 H2 WAT 3471 17.531 33.847 125.481 1.00 0.00 H TER 3565 WAT 3471 ATOM 3565 O WAT 3472 63.524 18.397 99.065 1.00 0.00 O ATOM 3566 H1 WAT 3472 63.583 19.352 99.046 1.00 0.00 H ATOM 3567 H2 WAT 3472 63.863 18.153 99.926 1.00 0.00 H TER 3569 WAT 3472 ATOM 3569 O WAT 3473 106.070 101.204 26.025 1.00 0.00 O ATOM 3570 H1 WAT 3473 106.812 101.348 25.437 1.00 0.00 H ATOM 3571 H2 WAT 3473 106.469 101.048 26.881 1.00 0.00 H TER 3573 WAT 3473 ATOM 3573 O WAT 3474 126.581 89.805 85.774 1.00 0.00 O ATOM 3574 H1 WAT 3474 126.472 89.290 86.573 1.00 0.00 H ATOM 3575 H2 WAT 3474 127.375 90.317 85.925 1.00 0.00 H TER 3577 WAT 3474 ATOM 3577 O WAT 3475 91.178 97.658 132.938 1.00 0.00 O ATOM 3578 H1 WAT 3475 91.720 96.876 133.042 1.00 0.00 H ATOM 3579 H2 WAT 3475 90.292 97.320 132.807 1.00 0.00 H TER 3581 WAT 3475 ATOM 3581 O WAT 3476 7.042 128.044 116.586 1.00 0.00 O ATOM 3582 H1 WAT 3476 7.548 128.771 116.224 1.00 0.00 H ATOM 3583 H2 WAT 3476 7.062 128.186 117.533 1.00 0.00 H TER 3585 WAT 3476 ATOM 3585 O WAT 3477 30.487 140.488 117.923 1.00 0.00 O ATOM 3586 H1 WAT 3477 30.767 141.352 118.222 1.00 0.00 H ATOM 3587 H2 WAT 3477 29.885 140.668 117.200 1.00 0.00 H TER 3589 WAT 3477 ATOM 3589 O WAT 3478 13.808 109.055 108.489 1.00 0.00 O ATOM 3590 H1 WAT 3478 13.119 109.272 107.861 1.00 0.00 H ATOM 3591 H2 WAT 3478 13.343 108.917 109.315 1.00 0.00 H TER 3593 WAT 3478 ATOM 3593 O WAT 3479 139.667 5.257 125.179 1.00 0.00 O ATOM 3594 H1 WAT 3479 139.108 6.023 125.314 1.00 0.00 H ATOM 3595 H2 WAT 3479 139.781 4.887 126.054 1.00 0.00 H TER 3597 WAT 3479 ATOM 3597 O WAT 3480 61.943 66.234 66.652 1.00 0.00 O ATOM 3598 H1 WAT 3480 61.731 66.719 65.855 1.00 0.00 H ATOM 3599 H2 WAT 3480 62.690 66.701 67.025 1.00 0.00 H TER 3601 WAT 3480 ATOM 3601 O WAT 3481 126.566 139.534 0.876 1.00 0.00 O ATOM 3602 H1 WAT 3481 126.486 140.056 0.078 1.00 0.00 H ATOM 3603 H2 WAT 3481 127.342 139.885 1.314 1.00 0.00 H TER 3605 WAT 3481 ATOM 3605 O WAT 3482 48.165 15.558 105.255 1.00 0.00 O ATOM 3606 H1 WAT 3482 49.022 15.976 105.167 1.00 0.00 H ATOM 3607 H2 WAT 3482 47.574 16.272 105.493 1.00 0.00 H TER 3609 WAT 3482 ATOM 3609 O WAT 3483 103.720 1.484 155.855 1.00 0.00 O ATOM 3610 H1 WAT 3483 104.274 2.264 155.895 1.00 0.00 H ATOM 3611 H2 WAT 3483 102.903 1.791 155.462 1.00 0.00 H TER 3613 WAT 3483 ATOM 3613 O WAT 3484 83.022 90.178 107.658 1.00 0.00 O ATOM 3614 H1 WAT 3484 82.355 90.817 107.406 1.00 0.00 H ATOM 3615 H2 WAT 3484 82.797 89.940 108.557 1.00 0.00 H TER 3617 WAT 3484 ATOM 3617 O WAT 3485 14.182 39.757 1.086 1.00 0.00 O ATOM 3618 H1 WAT 3485 13.829 40.646 1.097 1.00 0.00 H ATOM 3619 H2 WAT 3485 15.102 39.867 0.846 1.00 0.00 H TER 3621 WAT 3485 ATOM 3621 O WAT 3486 132.841 131.378 2.842 1.00 0.00 O ATOM 3622 H1 WAT 3486 132.241 132.124 2.852 1.00 0.00 H ATOM 3623 H2 WAT 3486 132.395 130.720 2.310 1.00 0.00 H TER 3625 WAT 3486 ATOM 3625 O WAT 3487 12.668 76.022 87.196 1.00 0.00 O ATOM 3626 H1 WAT 3487 12.367 76.665 87.839 1.00 0.00 H ATOM 3627 H2 WAT 3487 13.571 75.833 87.451 1.00 0.00 H TER 3629 WAT 3487 ATOM 3629 O WAT 3488 47.134 1.627 14.412 1.00 0.00 O ATOM 3630 H1 WAT 3488 46.745 2.372 14.872 1.00 0.00 H ATOM 3631 H2 WAT 3488 46.551 0.894 14.609 1.00 0.00 H TER 3633 WAT 3488 ATOM 3633 O WAT 3489 42.610 130.838 123.397 1.00 0.00 O ATOM 3634 H1 WAT 3489 43.322 131.436 123.173 1.00 0.00 H ATOM 3635 H2 WAT 3489 42.704 130.111 122.781 1.00 0.00 H TER 3637 WAT 3489 ATOM 3637 O WAT 3490 112.726 144.268 100.450 1.00 0.00 O ATOM 3638 H1 WAT 3490 113.551 144.737 100.572 1.00 0.00 H ATOM 3639 H2 WAT 3490 112.645 144.167 99.501 1.00 0.00 H TER 3641 WAT 3490 ATOM 3641 O WAT 3491 138.884 126.813 94.124 1.00 0.00 O ATOM 3642 H1 WAT 3491 139.618 127.232 94.573 1.00 0.00 H ATOM 3643 H2 WAT 3491 138.106 127.230 94.495 1.00 0.00 H TER 3645 WAT 3491 ATOM 3645 O WAT 3492 138.670 94.427 153.427 1.00 0.00 O ATOM 3646 H1 WAT 3492 138.077 94.362 152.679 1.00 0.00 H ATOM 3647 H2 WAT 3492 139.194 95.208 153.250 1.00 0.00 H TER 3649 WAT 3492 ATOM 3649 O WAT 3493 122.318 64.032 148.653 1.00 0.00 O ATOM 3650 H1 WAT 3493 122.661 64.924 148.715 1.00 0.00 H ATOM 3651 H2 WAT 3493 123.091 63.473 148.736 1.00 0.00 H TER 3653 WAT 3493 ATOM 3653 O WAT 3494 45.010 55.426 74.461 1.00 0.00 O ATOM 3654 H1 WAT 3494 44.713 55.657 73.580 1.00 0.00 H ATOM 3655 H2 WAT 3494 45.933 55.197 74.350 1.00 0.00 H TER 3657 WAT 3494 ATOM 3657 O WAT 3495 130.241 22.575 108.345 1.00 0.00 O ATOM 3658 H1 WAT 3495 130.712 22.022 107.723 1.00 0.00 H ATOM 3659 H2 WAT 3495 130.676 22.419 109.183 1.00 0.00 H TER 3661 WAT 3495 ATOM 3661 O WAT 3496 70.515 74.821 7.175 1.00 0.00 O ATOM 3662 H1 WAT 3496 70.317 75.245 8.010 1.00 0.00 H ATOM 3663 H2 WAT 3496 69.818 74.175 7.064 1.00 0.00 H TER 3665 WAT 3496 ATOM 3665 O WAT 3497 71.279 33.666 121.436 1.00 0.00 O ATOM 3666 H1 WAT 3497 70.565 33.040 121.317 1.00 0.00 H ATOM 3667 H2 WAT 3497 71.852 33.256 122.083 1.00 0.00 H TER 3669 WAT 3497 ATOM 3669 O WAT 3498 10.268 111.733 108.572 1.00 0.00 O ATOM 3670 H1 WAT 3498 9.384 111.450 108.336 1.00 0.00 H ATOM 3671 H2 WAT 3498 10.362 111.484 109.491 1.00 0.00 H TER 3673 WAT 3498 ATOM 3673 O WAT 3499 100.731 89.489 108.269 1.00 0.00 O ATOM 3674 H1 WAT 3499 101.098 89.934 109.033 1.00 0.00 H ATOM 3675 H2 WAT 3499 99.785 89.506 108.414 1.00 0.00 H TER 3677 WAT 3499 ATOM 3677 O WAT 3500 34.036 70.223 158.492 1.00 0.00 O ATOM 3678 H1 WAT 3500 34.121 70.189 159.445 1.00 0.00 H ATOM 3679 H2 WAT 3500 33.530 71.018 158.325 1.00 0.00 H TER 3681 WAT 3500 ATOM 3681 O WAT 3501 5.613 34.617 66.588 1.00 0.00 O ATOM 3682 H1 WAT 3501 5.209 35.118 65.880 1.00 0.00 H ATOM 3683 H2 WAT 3501 5.829 33.773 66.191 1.00 0.00 H TER 3685 WAT 3501 ATOM 3685 O WAT 3502 49.021 125.933 108.592 1.00 0.00 O ATOM 3686 H1 WAT 3502 48.753 126.568 109.255 1.00 0.00 H ATOM 3687 H2 WAT 3502 48.867 126.377 107.758 1.00 0.00 H TER 3689 WAT 3502 ATOM 3689 O WAT 3503 69.449 12.495 71.304 1.00 0.00 O ATOM 3690 H1 WAT 3503 70.041 11.772 71.512 1.00 0.00 H ATOM 3691 H2 WAT 3503 69.333 12.445 70.355 1.00 0.00 H TER 3693 WAT 3503 ATOM 3693 O WAT 3504 91.058 43.650 77.397 1.00 0.00 O ATOM 3694 H1 WAT 3504 91.418 42.887 76.944 1.00 0.00 H ATOM 3695 H2 WAT 3504 91.133 43.433 78.327 1.00 0.00 H TER 3697 WAT 3504 ATOM 3697 O WAT 3505 16.274 112.199 14.733 1.00 0.00 O ATOM 3698 H1 WAT 3505 16.034 112.617 15.560 1.00 0.00 H ATOM 3699 H2 WAT 3505 16.385 111.274 14.955 1.00 0.00 H TER 3701 WAT 3505 ATOM 3701 O WAT 3506 31.624 43.337 10.794 1.00 0.00 O ATOM 3702 H1 WAT 3506 30.762 43.164 11.174 1.00 0.00 H ATOM 3703 H2 WAT 3506 31.539 44.201 10.391 1.00 0.00 H TER 3705 WAT 3506 ATOM 3705 O WAT 3507 107.807 23.036 63.199 1.00 0.00 O ATOM 3706 H1 WAT 3507 108.018 23.659 62.503 1.00 0.00 H ATOM 3707 H2 WAT 3507 107.118 23.466 63.705 1.00 0.00 H TER 3709 WAT 3507 ATOM 3709 O WAT 3508 26.022 112.778 80.613 1.00 0.00 O ATOM 3710 H1 WAT 3508 26.867 113.155 80.858 1.00 0.00 H ATOM 3711 H2 WAT 3508 25.590 112.596 81.447 1.00 0.00 H TER 3713 WAT 3508 ATOM 3713 O WAT 3509 129.861 54.650 86.268 1.00 0.00 O ATOM 3714 H1 WAT 3509 130.461 54.933 86.958 1.00 0.00 H ATOM 3715 H2 WAT 3509 129.577 55.463 85.850 1.00 0.00 H TER 3717 WAT 3509 ATOM 3717 O WAT 3510 132.173 134.999 78.021 1.00 0.00 O ATOM 3718 H1 WAT 3510 133.016 134.693 78.355 1.00 0.00 H ATOM 3719 H2 WAT 3510 132.199 134.800 77.085 1.00 0.00 H TER 3721 WAT 3510 ATOM 3721 O WAT 3511 69.236 134.191 137.304 1.00 0.00 O ATOM 3722 H1 WAT 3511 69.061 135.123 137.175 1.00 0.00 H ATOM 3723 H2 WAT 3511 69.783 134.156 138.089 1.00 0.00 H TER 3725 WAT 3511 ATOM 3725 O WAT 3512 130.484 11.602 102.661 1.00 0.00 O ATOM 3726 H1 WAT 3512 131.059 12.181 102.162 1.00 0.00 H ATOM 3727 H2 WAT 3512 130.458 10.792 102.150 1.00 0.00 H TER 3729 WAT 3512 ATOM 3729 O WAT 3513 129.814 77.656 2.867 1.00 0.00 O ATOM 3730 H1 WAT 3513 129.757 76.961 3.522 1.00 0.00 H ATOM 3731 H2 WAT 3513 129.506 77.249 2.057 1.00 0.00 H TER 3733 WAT 3513 ATOM 3733 O WAT 3514 2.924 64.699 97.893 1.00 0.00 O ATOM 3734 H1 WAT 3514 2.772 64.121 98.641 1.00 0.00 H ATOM 3735 H2 WAT 3514 2.912 65.581 98.264 1.00 0.00 H TER 3737 WAT 3514 ATOM 3737 O WAT 3515 74.492 7.632 137.113 1.00 0.00 O ATOM 3738 H1 WAT 3515 74.537 7.794 138.055 1.00 0.00 H ATOM 3739 H2 WAT 3515 75.301 7.160 136.912 1.00 0.00 H TER 3741 WAT 3515 ATOM 3741 O WAT 3516 21.807 32.599 122.466 1.00 0.00 O ATOM 3742 H1 WAT 3516 22.298 31.792 122.315 1.00 0.00 H ATOM 3743 H2 WAT 3516 21.522 32.539 123.378 1.00 0.00 H TER 3745 WAT 3516 ATOM 3745 O WAT 3517 138.986 86.514 139.834 1.00 0.00 O ATOM 3746 H1 WAT 3517 138.345 86.811 139.188 1.00 0.00 H ATOM 3747 H2 WAT 3517 138.471 86.029 140.478 1.00 0.00 H TER 3749 WAT 3517 ATOM 3749 O WAT 3518 112.767 121.737 152.340 1.00 0.00 O ATOM 3750 H1 WAT 3518 112.321 121.010 151.905 1.00 0.00 H ATOM 3751 H2 WAT 3518 112.578 121.610 153.270 1.00 0.00 H TER 3753 WAT 3518 ATOM 3753 O WAT 3519 93.966 83.775 68.574 1.00 0.00 O ATOM 3754 H1 WAT 3519 93.704 83.992 67.679 1.00 0.00 H ATOM 3755 H2 WAT 3519 93.141 83.695 69.053 1.00 0.00 H TER 3757 WAT 3519 ATOM 3757 O WAT 3520 58.749 62.838 15.532 1.00 0.00 O ATOM 3758 H1 WAT 3520 58.708 63.004 14.590 1.00 0.00 H ATOM 3759 H2 WAT 3520 59.638 62.517 15.681 1.00 0.00 H TER 3761 WAT 3520 ATOM 3761 O WAT 3521 10.104 34.002 120.662 1.00 0.00 O ATOM 3762 H1 WAT 3521 9.596 34.811 120.599 1.00 0.00 H ATOM 3763 H2 WAT 3521 9.636 33.476 121.311 1.00 0.00 H TER 3765 WAT 3521 ATOM 3765 O WAT 3522 85.350 10.645 94.174 1.00 0.00 O ATOM 3766 H1 WAT 3522 85.195 10.414 93.258 1.00 0.00 H ATOM 3767 H2 WAT 3522 84.510 10.986 94.481 1.00 0.00 H TER 3769 WAT 3522 ATOM 3769 O WAT 3523 59.518 63.192 120.433 1.00 0.00 O ATOM 3770 H1 WAT 3523 58.656 63.109 120.840 1.00 0.00 H ATOM 3771 H2 WAT 3523 59.383 63.803 119.708 1.00 0.00 H TER 3773 WAT 3523 ATOM 3773 O WAT 3524 0.990 93.452 0.577 1.00 0.00 O ATOM 3774 H1 WAT 3524 1.100 92.605 0.144 1.00 0.00 H ATOM 3775 H2 WAT 3524 0.265 93.868 0.110 1.00 0.00 H TER 3777 WAT 3524 ATOM 3777 O WAT 3525 77.567 101.998 134.691 1.00 0.00 O ATOM 3778 H1 WAT 3525 77.572 101.065 134.478 1.00 0.00 H ATOM 3779 H2 WAT 3525 77.632 102.437 133.843 1.00 0.00 H TER 3781 WAT 3525 ATOM 3781 O WAT 3526 9.096 99.459 5.402 1.00 0.00 O ATOM 3782 H1 WAT 3526 9.290 98.849 4.690 1.00 0.00 H ATOM 3783 H2 WAT 3526 9.699 100.189 5.263 1.00 0.00 H TER 3785 WAT 3526 ATOM 3785 O WAT 3527 129.167 88.711 82.864 1.00 0.00 O ATOM 3786 H1 WAT 3527 129.969 89.050 82.468 1.00 0.00 H ATOM 3787 H2 WAT 3527 128.513 89.390 82.699 1.00 0.00 H TER 3789 WAT 3527 ATOM 3789 O WAT 3528 143.709 113.607 10.523 1.00 0.00 O ATOM 3790 H1 WAT 3528 144.489 114.142 10.669 1.00 0.00 H ATOM 3791 H2 WAT 3528 143.636 113.070 11.312 1.00 0.00 H TER 3793 WAT 3528 ATOM 3793 O WAT 3529 0.826 67.397 93.525 1.00 0.00 O ATOM 3794 H1 WAT 3529 -0.113 67.324 93.356 1.00 0.00 H ATOM 3795 H2 WAT 3529 1.239 67.035 92.741 1.00 0.00 H TER 3797 WAT 3529 ATOM 3797 O WAT 3530 96.735 118.487 100.303 1.00 0.00 O ATOM 3798 H1 WAT 3530 97.624 118.639 100.625 1.00 0.00 H ATOM 3799 H2 WAT 3530 96.216 118.340 101.094 1.00 0.00 H TER 3801 WAT 3530 ATOM 3801 O WAT 3531 74.518 70.858 61.681 1.00 0.00 O ATOM 3802 H1 WAT 3531 74.944 71.355 60.983 1.00 0.00 H ATOM 3803 H2 WAT 3531 74.337 70.003 61.290 1.00 0.00 H TER 3805 WAT 3531 ATOM 3805 O WAT 3532 111.976 89.158 0.420 1.00 0.00 O ATOM 3806 H1 WAT 3532 111.243 89.658 0.781 1.00 0.00 H ATOM 3807 H2 WAT 3532 111.728 88.243 0.551 1.00 0.00 H TER 3809 WAT 3532 ATOM 3809 O WAT 3533 98.471 3.682 87.828 1.00 0.00 O ATOM 3810 H1 WAT 3533 97.860 4.384 88.050 1.00 0.00 H ATOM 3811 H2 WAT 3533 97.913 2.967 87.521 1.00 0.00 H TER 3813 WAT 3533 ATOM 3813 O WAT 3534 60.252 105.996 75.241 1.00 0.00 O ATOM 3814 H1 WAT 3534 59.764 106.787 75.013 1.00 0.00 H ATOM 3815 H2 WAT 3534 59.974 105.792 76.134 1.00 0.00 H TER 3817 WAT 3534 ATOM 3817 O WAT 3535 84.548 67.099 119.364 1.00 0.00 O ATOM 3818 H1 WAT 3535 84.231 66.729 118.540 1.00 0.00 H ATOM 3819 H2 WAT 3535 84.977 67.916 119.110 1.00 0.00 H TER 3821 WAT 3535 ATOM 3821 O WAT 3536 95.909 33.291 2.319 1.00 0.00 O ATOM 3822 H1 WAT 3536 95.224 33.751 2.804 1.00 0.00 H ATOM 3823 H2 WAT 3536 95.715 32.363 2.451 1.00 0.00 H TER 3825 WAT 3536 ATOM 3825 O WAT 3537 88.184 75.233 110.843 1.00 0.00 O ATOM 3826 H1 WAT 3537 88.281 76.163 111.049 1.00 0.00 H ATOM 3827 H2 WAT 3537 88.639 74.782 111.555 1.00 0.00 H TER 3829 WAT 3537 ATOM 3829 O WAT 3538 30.649 72.430 65.144 1.00 0.00 O ATOM 3830 H1 WAT 3538 29.735 72.661 64.982 1.00 0.00 H ATOM 3831 H2 WAT 3538 31.014 72.270 64.274 1.00 0.00 H TER 3833 WAT 3538 ATOM 3833 O WAT 3539 67.665 67.138 86.910 1.00 0.00 O ATOM 3834 H1 WAT 3539 68.226 67.672 86.348 1.00 0.00 H ATOM 3835 H2 WAT 3539 67.006 66.777 86.318 1.00 0.00 H TER 3837 WAT 3539 ATOM 3837 O WAT 3540 97.803 59.817 87.973 1.00 0.00 O ATOM 3838 H1 WAT 3540 98.395 60.508 87.678 1.00 0.00 H ATOM 3839 H2 WAT 3540 97.676 59.992 88.906 1.00 0.00 H TER 3841 WAT 3540 ATOM 3841 O WAT 3541 33.613 123.742 79.326 1.00 0.00 O ATOM 3842 H1 WAT 3541 34.354 123.702 79.931 1.00 0.00 H ATOM 3843 H2 WAT 3541 32.842 123.637 79.884 1.00 0.00 H TER 3845 WAT 3541 ATOM 3845 O WAT 3542 136.481 57.797 106.748 1.00 0.00 O ATOM 3846 H1 WAT 3542 136.877 57.879 105.881 1.00 0.00 H ATOM 3847 H2 WAT 3542 136.053 58.641 106.897 1.00 0.00 H TER 3849 WAT 3542 ATOM 3849 O WAT 3543 111.868 10.432 136.267 1.00 0.00 O ATOM 3850 H1 WAT 3543 111.791 10.771 137.159 1.00 0.00 H ATOM 3851 H2 WAT 3543 112.807 10.452 136.083 1.00 0.00 H TER 3853 WAT 3543 ATOM 3853 O WAT 3544 100.880 29.499 138.753 1.00 0.00 O ATOM 3854 H1 WAT 3544 101.503 28.905 139.171 1.00 0.00 H ATOM 3855 H2 WAT 3544 100.653 30.128 139.438 1.00 0.00 H TER 3857 WAT 3544 ATOM 3857 O WAT 3545 101.433 68.479 139.000 1.00 0.00 O ATOM 3858 H1 WAT 3545 100.964 69.250 139.317 1.00 0.00 H ATOM 3859 H2 WAT 3545 102.143 68.355 139.630 1.00 0.00 H TER 3861 WAT 3545 ATOM 3861 O WAT 3546 1.155 2.058 1.614 1.00 0.00 O ATOM 3862 H1 WAT 3546 0.602 2.787 1.332 1.00 0.00 H ATOM 3863 H2 WAT 3546 0.924 1.924 2.533 1.00 0.00 H TER 3865 WAT 3546 ATOM 3865 O WAT 3547 21.441 125.603 98.696 1.00 0.00 O ATOM 3866 H1 WAT 3547 21.828 126.040 99.455 1.00 0.00 H ATOM 3867 H2 WAT 3547 20.568 125.986 98.619 1.00 0.00 H TER 3869 WAT 3547 ATOM 3869 O WAT 3548 102.395 77.526 66.317 1.00 0.00 O ATOM 3870 H1 WAT 3548 103.313 77.258 66.342 1.00 0.00 H ATOM 3871 H2 WAT 3548 102.063 77.169 65.493 1.00 0.00 H TER 3873 WAT 3548 ATOM 3873 O WAT 3549 31.622 56.436 122.790 1.00 0.00 O ATOM 3874 H1 WAT 3549 31.732 56.251 121.858 1.00 0.00 H ATOM 3875 H2 WAT 3549 30.736 56.134 122.991 1.00 0.00 H TER 3877 WAT 3549 ATOM 3877 O WAT 3550 11.576 106.435 135.761 1.00 0.00 O ATOM 3878 H1 WAT 3550 11.272 107.146 135.198 1.00 0.00 H ATOM 3879 H2 WAT 3550 12.067 106.873 136.457 1.00 0.00 H TER 3881 WAT 3550 ATOM 3881 O WAT 3551 108.732 114.055 101.504 1.00 0.00 O ATOM 3882 H1 WAT 3551 109.337 114.169 100.771 1.00 0.00 H ATOM 3883 H2 WAT 3551 108.938 113.187 101.852 1.00 0.00 H TER 3885 WAT 3551 ATOM 3885 O WAT 3552 67.891 38.926 25.373 1.00 0.00 O ATOM 3886 H1 WAT 3552 67.616 39.492 24.652 1.00 0.00 H ATOM 3887 H2 WAT 3552 67.230 38.234 25.400 1.00 0.00 H TER 3889 WAT 3552 ATOM 3889 O WAT 3553 49.520 78.608 16.280 1.00 0.00 O ATOM 3890 H1 WAT 3553 48.781 78.858 15.725 1.00 0.00 H ATOM 3891 H2 WAT 3553 49.257 78.872 17.161 1.00 0.00 H TER 3893 WAT 3553 ATOM 3893 O WAT 3554 54.640 3.908 56.761 1.00 0.00 O ATOM 3894 H1 WAT 3554 53.982 4.602 56.710 1.00 0.00 H ATOM 3895 H2 WAT 3554 54.846 3.706 55.849 1.00 0.00 H TER 3897 WAT 3554 ATOM 3897 O WAT 3555 121.099 112.867 68.548 1.00 0.00 O ATOM 3898 H1 WAT 3555 120.619 113.609 68.915 1.00 0.00 H ATOM 3899 H2 WAT 3555 121.790 112.690 69.186 1.00 0.00 H TER 3901 WAT 3555 ATOM 3901 O WAT 3556 35.484 53.657 13.149 1.00 0.00 O ATOM 3902 H1 WAT 3556 36.219 54.061 12.687 1.00 0.00 H ATOM 3903 H2 WAT 3556 35.660 53.829 14.075 1.00 0.00 H TER 3905 WAT 3556 ATOM 3905 O WAT 3557 118.618 10.829 151.280 1.00 0.00 O ATOM 3906 H1 WAT 3557 118.959 11.616 150.854 1.00 0.00 H ATOM 3907 H2 WAT 3557 117.701 11.034 151.463 1.00 0.00 H TER 3909 WAT 3557 ATOM 3909 O WAT 3558 18.268 58.032 80.845 1.00 0.00 O ATOM 3910 H1 WAT 3558 18.630 58.481 81.608 1.00 0.00 H ATOM 3911 H2 WAT 3558 18.882 58.228 80.137 1.00 0.00 H TER 3913 WAT 3558 ATOM 3913 O WAT 3559 138.728 31.552 88.448 1.00 0.00 O ATOM 3914 H1 WAT 3559 138.392 31.031 87.718 1.00 0.00 H ATOM 3915 H2 WAT 3559 138.808 30.928 89.169 1.00 0.00 H TER 3917 WAT 3559 ATOM 3917 O WAT 3560 4.869 103.387 129.092 1.00 0.00 O ATOM 3918 H1 WAT 3560 4.267 103.742 128.438 1.00 0.00 H ATOM 3919 H2 WAT 3560 4.908 104.059 129.772 1.00 0.00 H TER 3921 WAT 3560 ATOM 3921 O WAT 3561 90.692 30.904 143.928 1.00 0.00 O ATOM 3922 H1 WAT 3561 89.888 31.051 144.426 1.00 0.00 H ATOM 3923 H2 WAT 3561 91.392 30.982 144.575 1.00 0.00 H TER 3925 WAT 3561 ATOM 3925 O WAT 3562 96.988 25.132 148.591 1.00 0.00 O ATOM 3926 H1 WAT 3562 96.429 24.726 149.254 1.00 0.00 H ATOM 3927 H2 WAT 3562 97.544 25.735 149.085 1.00 0.00 H TER 3929 WAT 3562 ATOM 3929 O WAT 3563 67.574 30.180 76.300 1.00 0.00 O ATOM 3930 H1 WAT 3563 66.774 30.264 76.820 1.00 0.00 H ATOM 3931 H2 WAT 3563 67.790 29.248 76.343 1.00 0.00 H TER 3933 WAT 3563 ATOM 3933 O WAT 3564 76.782 3.528 130.490 1.00 0.00 O ATOM 3934 H1 WAT 3564 76.300 2.708 130.594 1.00 0.00 H ATOM 3935 H2 WAT 3564 76.807 3.904 131.370 1.00 0.00 H TER 3937 WAT 3564 ATOM 3937 O WAT 3565 78.709 7.012 84.562 1.00 0.00 O ATOM 3938 H1 WAT 3565 78.729 6.060 84.655 1.00 0.00 H ATOM 3939 H2 WAT 3565 79.469 7.217 84.018 1.00 0.00 H TER 3941 WAT 3565 ATOM 3941 O WAT 3566 107.073 13.689 128.275 1.00 0.00 O ATOM 3942 H1 WAT 3566 107.936 14.023 128.028 1.00 0.00 H ATOM 3943 H2 WAT 3566 107.250 13.071 128.984 1.00 0.00 H TER 3945 WAT 3566 ATOM 3945 O WAT 3567 39.964 44.614 73.527 1.00 0.00 O ATOM 3946 H1 WAT 3567 39.301 43.971 73.274 1.00 0.00 H ATOM 3947 H2 WAT 3567 39.496 45.231 74.089 1.00 0.00 H TER 3949 WAT 3567 ATOM 3949 O WAT 3568 60.558 123.733 121.936 1.00 0.00 O ATOM 3950 H1 WAT 3568 60.687 123.844 120.994 1.00 0.00 H ATOM 3951 H2 WAT 3568 59.818 123.130 122.007 1.00 0.00 H TER 3953 WAT 3568 ATOM 3953 O WAT 3569 98.181 139.495 64.647 1.00 0.00 O ATOM 3954 H1 WAT 3569 98.202 140.450 64.702 1.00 0.00 H ATOM 3955 H2 WAT 3569 97.949 139.312 63.737 1.00 0.00 H TER 3957 WAT 3569 ATOM 3957 O WAT 3570 52.573 122.366 6.781 1.00 0.00 O ATOM 3958 H1 WAT 3570 52.482 123.311 6.664 1.00 0.00 H ATOM 3959 H2 WAT 3570 52.241 121.991 5.965 1.00 0.00 H TER 3961 WAT 3570 ATOM 3961 O WAT 3571 3.910 15.585 129.003 1.00 0.00 O ATOM 3962 H1 WAT 3571 3.375 14.851 129.305 1.00 0.00 H ATOM 3963 H2 WAT 3571 4.112 15.375 128.091 1.00 0.00 H TER 3965 WAT 3571 ATOM 3965 O WAT 3572 16.921 6.211 62.496 1.00 0.00 O ATOM 3966 H1 WAT 3572 17.515 6.740 61.964 1.00 0.00 H ATOM 3967 H2 WAT 3572 17.238 6.324 63.392 1.00 0.00 H TER 3969 WAT 3572 ATOM 3969 O WAT 3573 75.525 2.767 99.780 1.00 0.00 O ATOM 3970 H1 WAT 3573 75.423 2.620 98.840 1.00 0.00 H ATOM 3971 H2 WAT 3573 75.328 3.696 99.900 1.00 0.00 H TER 3973 WAT 3573 ATOM 3973 O WAT 3574 143.733 79.535 146.407 1.00 0.00 O ATOM 3974 H1 WAT 3574 144.669 79.340 146.446 1.00 0.00 H ATOM 3975 H2 WAT 3574 143.653 80.184 145.708 1.00 0.00 H TER 3977 WAT 3574 ATOM 3977 O WAT 3575 112.702 46.999 82.226 1.00 0.00 O ATOM 3978 H1 WAT 3575 112.777 47.932 82.425 1.00 0.00 H ATOM 3979 H2 WAT 3575 113.409 46.829 81.604 1.00 0.00 H TER 3981 WAT 3575 ATOM 3981 O WAT 3576 99.802 30.176 16.225 1.00 0.00 O ATOM 3982 H1 WAT 3576 100.297 29.358 16.184 1.00 0.00 H ATOM 3983 H2 WAT 3576 99.449 30.287 15.342 1.00 0.00 H TER 3985 WAT 3576 ATOM 3985 O WAT 3577 91.153 104.012 65.879 1.00 0.00 O ATOM 3986 H1 WAT 3577 90.907 103.423 66.592 1.00 0.00 H ATOM 3987 H2 WAT 3577 91.456 103.429 65.182 1.00 0.00 H TER 3989 WAT 3577 ATOM 3989 O WAT 3578 29.572 48.009 15.090 1.00 0.00 O ATOM 3990 H1 WAT 3578 30.474 48.288 15.250 1.00 0.00 H ATOM 3991 H2 WAT 3578 29.489 48.006 14.136 1.00 0.00 H TER 3993 WAT 3578 ATOM 3993 O WAT 3579 100.834 44.907 70.198 1.00 0.00 O ATOM 3994 H1 WAT 3579 101.643 45.370 69.982 1.00 0.00 H ATOM 3995 H2 WAT 3579 100.222 45.158 69.505 1.00 0.00 H TER 3997 WAT 3579 ATOM 3997 O WAT 3580 17.182 142.192 96.876 1.00 0.00 O ATOM 3998 H1 WAT 3580 16.782 141.961 97.715 1.00 0.00 H ATOM 3999 H2 WAT 3580 16.583 142.833 96.493 1.00 0.00 H TER 4001 WAT 3580 ATOM 4001 O WAT 3581 69.827 11.155 82.507 1.00 0.00 O ATOM 4002 H1 WAT 3581 70.485 11.752 82.152 1.00 0.00 H ATOM 4003 H2 WAT 3581 68.992 11.507 82.199 1.00 0.00 H TER 4005 WAT 3581 ATOM 4005 O WAT 3582 87.116 29.033 106.035 1.00 0.00 O ATOM 4006 H1 WAT 3582 88.018 29.231 105.784 1.00 0.00 H ATOM 4007 H2 WAT 3582 87.119 28.094 106.221 1.00 0.00 H TER 4009 WAT 3582 ATOM 4009 O WAT 3583 23.399 69.447 110.956 1.00 0.00 O ATOM 4010 H1 WAT 3583 23.004 69.069 111.741 1.00 0.00 H ATOM 4011 H2 WAT 3583 24.340 69.310 111.071 1.00 0.00 H TER 4013 WAT 3583 ATOM 4013 O WAT 3584 127.467 142.224 76.544 1.00 0.00 O ATOM 4014 H1 WAT 3584 127.353 141.276 76.607 1.00 0.00 H ATOM 4015 H2 WAT 3584 127.167 142.443 75.661 1.00 0.00 H TER 4017 WAT 3584 ATOM 4017 O WAT 3585 25.107 119.404 4.436 1.00 0.00 O ATOM 4018 H1 WAT 3585 25.798 118.753 4.557 1.00 0.00 H ATOM 4019 H2 WAT 3585 24.941 119.744 5.315 1.00 0.00 H TER 4021 WAT 3585 ATOM 4021 O WAT 3586 23.404 87.820 141.234 1.00 0.00 O ATOM 4022 H1 WAT 3586 22.654 88.400 141.364 1.00 0.00 H ATOM 4023 H2 WAT 3586 23.544 87.820 140.287 1.00 0.00 H TER 4025 WAT 3586 ATOM 4025 O WAT 3587 34.655 140.394 117.086 1.00 0.00 O ATOM 4026 H1 WAT 3587 35.586 140.522 116.903 1.00 0.00 H ATOM 4027 H2 WAT 3587 34.410 139.633 116.559 1.00 0.00 H TER 4029 WAT 3587 ATOM 4029 O WAT 3588 70.281 28.683 106.727 1.00 0.00 O ATOM 4030 H1 WAT 3588 69.477 29.202 106.722 1.00 0.00 H ATOM 4031 H2 WAT 3588 70.928 29.246 107.152 1.00 0.00 H TER 4033 WAT 3588 ATOM 4033 O WAT 3589 22.541 63.486 158.498 1.00 0.00 O ATOM 4034 H1 WAT 3589 22.267 62.917 157.779 1.00 0.00 H ATOM 4035 H2 WAT 3589 23.472 63.298 158.612 1.00 0.00 H TER 4037 WAT 3589 ATOM 4037 O WAT 3590 120.283 75.482 20.881 1.00 0.00 O ATOM 4038 H1 WAT 3590 119.780 74.758 21.254 1.00 0.00 H ATOM 4039 H2 WAT 3590 119.833 76.269 21.188 1.00 0.00 H TER 4041 WAT 3590 ATOM 4041 O WAT 3591 23.753 79.357 97.051 1.00 0.00 O ATOM 4042 H1 WAT 3591 24.390 79.263 96.342 1.00 0.00 H ATOM 4043 H2 WAT 3591 23.427 78.469 97.199 1.00 0.00 H TER 4045 WAT 3591 ATOM 4045 O WAT 3592 19.447 3.474 2.062 1.00 0.00 O ATOM 4046 H1 WAT 3592 20.050 3.233 1.359 1.00 0.00 H ATOM 4047 H2 WAT 3592 19.053 2.645 2.334 1.00 0.00 H TER 4049 WAT 3592 ATOM 4049 O WAT 3593 69.101 132.175 58.248 1.00 0.00 O ATOM 4050 H1 WAT 3593 69.696 132.723 57.737 1.00 0.00 H ATOM 4051 H2 WAT 3593 69.440 132.223 59.142 1.00 0.00 H TER 4053 WAT 3593 ATOM 4053 O WAT 3594 17.250 104.723 139.806 1.00 0.00 O ATOM 4054 H1 WAT 3594 17.622 105.401 139.242 1.00 0.00 H ATOM 4055 H2 WAT 3594 16.316 104.927 139.843 1.00 0.00 H TER 4057 WAT 3594 ATOM 4057 O WAT 3595 68.494 134.262 156.188 1.00 0.00 O ATOM 4058 H1 WAT 3595 68.299 134.343 155.254 1.00 0.00 H ATOM 4059 H2 WAT 3595 69.413 134.516 156.264 1.00 0.00 H TER 4061 WAT 3595 ATOM 4061 O WAT 3596 32.171 21.045 18.093 1.00 0.00 O ATOM 4062 H1 WAT 3596 32.018 20.222 18.557 1.00 0.00 H ATOM 4063 H2 WAT 3596 32.173 20.802 17.168 1.00 0.00 H TER 4065 WAT 3596 ATOM 4065 O WAT 3597 26.362 73.213 20.713 1.00 0.00 O ATOM 4066 H1 WAT 3597 26.137 72.563 21.378 1.00 0.00 H ATOM 4067 H2 WAT 3597 25.599 73.789 20.673 1.00 0.00 H TER 4069 WAT 3597 ATOM 4069 O WAT 3598 41.163 40.180 62.317 1.00 0.00 O ATOM 4070 H1 WAT 3598 41.733 40.821 62.742 1.00 0.00 H ATOM 4071 H2 WAT 3598 40.517 39.954 62.987 1.00 0.00 H TER 4073 WAT 3598 ATOM 4073 O WAT 3599 50.426 64.684 81.011 1.00 0.00 O ATOM 4074 H1 WAT 3599 49.595 65.044 80.700 1.00 0.00 H ATOM 4075 H2 WAT 3599 50.354 64.707 81.965 1.00 0.00 H TER 4077 WAT 3599 ATOM 4077 O WAT 3600 115.664 73.898 83.130 1.00 0.00 O ATOM 4078 H1 WAT 3600 116.496 73.652 82.724 1.00 0.00 H ATOM 4079 H2 WAT 3600 115.172 73.079 83.182 1.00 0.00 H TER 4081 WAT 3600 ATOM 4081 O WAT 3601 50.766 130.893 72.227 1.00 0.00 O ATOM 4082 H1 WAT 3601 51.121 130.723 73.099 1.00 0.00 H ATOM 4083 H2 WAT 3601 49.914 130.455 72.225 1.00 0.00 H TER 4085 WAT 3601 ATOM 4085 O WAT 3602 140.472 88.603 79.968 1.00 0.00 O ATOM 4086 H1 WAT 3602 140.228 88.064 79.215 1.00 0.00 H ATOM 4087 H2 WAT 3602 139.992 89.421 79.842 1.00 0.00 H TER 4089 WAT 3602 ATOM 4089 O WAT 3603 66.733 140.493 117.472 1.00 0.00 O ATOM 4090 H1 WAT 3603 66.558 140.816 116.588 1.00 0.00 H ATOM 4091 H2 WAT 3603 67.679 140.350 117.492 1.00 0.00 H TER 4093 WAT 3603 ATOM 4093 O WAT 3604 94.660 78.419 67.000 1.00 0.00 O ATOM 4094 H1 WAT 3604 95.046 77.776 67.595 1.00 0.00 H ATOM 4095 H2 WAT 3604 94.708 79.247 67.478 1.00 0.00 H TER 4097 WAT 3604 ATOM 4097 O WAT 3605 109.989 138.474 10.245 1.00 0.00 O ATOM 4098 H1 WAT 3605 109.889 138.925 11.084 1.00 0.00 H ATOM 4099 H2 WAT 3605 109.099 138.410 9.900 1.00 0.00 H TER 4101 WAT 3605 ATOM 4101 O WAT 3606 126.480 9.066 132.679 1.00 0.00 O ATOM 4102 H1 WAT 3606 125.883 9.766 132.417 1.00 0.00 H ATOM 4103 H2 WAT 3606 125.921 8.294 132.765 1.00 0.00 H TER 4105 WAT 3606 ATOM 4105 O WAT 3607 51.629 40.490 62.896 1.00 0.00 O ATOM 4106 H1 WAT 3607 52.451 40.288 63.343 1.00 0.00 H ATOM 4107 H2 WAT 3607 51.848 41.213 62.308 1.00 0.00 H TER 4109 WAT 3607 ATOM 4109 O WAT 3608 123.438 47.673 120.602 1.00 0.00 O ATOM 4110 H1 WAT 3608 122.852 47.133 120.072 1.00 0.00 H ATOM 4111 H2 WAT 3608 123.721 47.094 121.310 1.00 0.00 H TER 4113 WAT 3608 ATOM 4113 O WAT 3609 32.059 12.520 139.155 1.00 0.00 O ATOM 4114 H1 WAT 3609 31.889 12.097 138.313 1.00 0.00 H ATOM 4115 H2 WAT 3609 31.237 12.434 139.637 1.00 0.00 H TER 4117 WAT 3609 ATOM 4117 O WAT 3610 88.348 121.545 92.414 1.00 0.00 O ATOM 4118 H1 WAT 3610 88.513 121.471 91.474 1.00 0.00 H ATOM 4119 H2 WAT 3610 88.520 120.668 92.757 1.00 0.00 H TER 4121 WAT 3610 ATOM 4121 O WAT 3611 27.198 57.785 51.337 1.00 0.00 O ATOM 4122 H1 WAT 3611 27.887 58.450 51.328 1.00 0.00 H ATOM 4123 H2 WAT 3611 26.452 58.218 51.751 1.00 0.00 H TER 4125 WAT 3611 ATOM 4125 O WAT 3612 66.445 3.344 8.676 1.00 0.00 O ATOM 4126 H1 WAT 3612 66.494 4.299 8.685 1.00 0.00 H ATOM 4127 H2 WAT 3612 66.012 3.119 9.500 1.00 0.00 H TER 4129 WAT 3612 ATOM 4129 O WAT 3613 65.890 130.753 95.937 1.00 0.00 O ATOM 4130 H1 WAT 3613 65.385 130.337 95.238 1.00 0.00 H ATOM 4131 H2 WAT 3613 65.895 131.682 95.708 1.00 0.00 H TER 4133 WAT 3613 ATOM 4133 O WAT 3614 46.477 61.146 139.461 1.00 0.00 O ATOM 4134 H1 WAT 3614 47.072 60.737 138.833 1.00 0.00 H ATOM 4135 H2 WAT 3614 47.053 61.601 140.076 1.00 0.00 H TER 4137 WAT 3614 ATOM 4137 O WAT 3615 25.493 143.590 90.247 1.00 0.00 O ATOM 4138 H1 WAT 3615 25.747 144.451 89.913 1.00 0.00 H ATOM 4139 H2 WAT 3615 26.020 142.972 89.741 1.00 0.00 H TER 4141 WAT 3615 ATOM 4141 O WAT 3616 111.755 106.345 96.762 1.00 0.00 O ATOM 4142 H1 WAT 3616 112.471 105.731 96.925 1.00 0.00 H ATOM 4143 H2 WAT 3616 111.705 106.406 95.808 1.00 0.00 H TER 4145 WAT 3616 ATOM 4145 O WAT 3617 24.151 15.795 156.323 1.00 0.00 O ATOM 4146 H1 WAT 3617 24.852 15.280 155.923 1.00 0.00 H ATOM 4147 H2 WAT 3617 24.372 16.703 156.115 1.00 0.00 H TER 4149 WAT 3617 ATOM 4149 O WAT 3618 90.859 102.181 141.759 1.00 0.00 O ATOM 4150 H1 WAT 3618 90.891 101.334 141.314 1.00 0.00 H ATOM 4151 H2 WAT 3618 91.084 101.983 142.668 1.00 0.00 H TER 4153 WAT 3618 ATOM 4153 O WAT 3619 20.528 97.462 80.555 1.00 0.00 O ATOM 4154 H1 WAT 3619 19.818 97.404 81.194 1.00 0.00 H ATOM 4155 H2 WAT 3619 20.134 97.174 79.732 1.00 0.00 H TER 4157 WAT 3619 ATOM 4157 O WAT 3620 11.417 32.388 70.331 1.00 0.00 O ATOM 4158 H1 WAT 3620 11.414 33.269 69.957 1.00 0.00 H ATOM 4159 H2 WAT 3620 10.744 31.916 69.841 1.00 0.00 H TER 4161 WAT 3620 ATOM 4161 O WAT 3621 110.986 11.129 14.081 1.00 0.00 O ATOM 4162 H1 WAT 3621 110.197 10.654 13.821 1.00 0.00 H ATOM 4163 H2 WAT 3621 111.198 10.784 14.949 1.00 0.00 H TER 4165 WAT 3621 ATOM 4165 O WAT 3622 44.165 71.734 149.898 1.00 0.00 O ATOM 4166 H1 WAT 3622 44.978 71.804 150.398 1.00 0.00 H ATOM 4167 H2 WAT 3622 44.027 70.792 149.795 1.00 0.00 H TER 4169 WAT 3622 ATOM 4169 O WAT 3623 143.678 128.170 131.274 1.00 0.00 O ATOM 4170 H1 WAT 3623 143.065 128.870 131.050 1.00 0.00 H ATOM 4171 H2 WAT 3623 143.265 127.716 132.009 1.00 0.00 H TER 4173 WAT 3623 ATOM 4173 O WAT 3624 18.750 49.105 6.719 1.00 0.00 O ATOM 4174 H1 WAT 3624 19.659 49.290 6.480 1.00 0.00 H ATOM 4175 H2 WAT 3624 18.682 48.151 6.679 1.00 0.00 H TER 4177 WAT 3624 ATOM 4177 O WAT 3625 23.976 60.529 5.901 1.00 0.00 O ATOM 4178 H1 WAT 3625 24.731 60.594 6.485 1.00 0.00 H ATOM 4179 H2 WAT 3625 24.288 60.882 5.067 1.00 0.00 H TER 4181 WAT 3625 ATOM 4181 O WAT 3626 19.642 0.616 66.218 1.00 0.00 O ATOM 4182 H1 WAT 3626 19.177 1.452 66.242 1.00 0.00 H ATOM 4183 H2 WAT 3626 20.094 0.569 67.061 1.00 0.00 H TER 4185 WAT 3626 ATOM 4185 O WAT 3627 21.060 135.902 103.424 1.00 0.00 O ATOM 4186 H1 WAT 3627 21.999 135.958 103.600 1.00 0.00 H ATOM 4187 H2 WAT 3627 20.965 135.121 102.878 1.00 0.00 H TER 4189 WAT 3627 ATOM 4189 O WAT 3628 39.712 13.072 85.333 1.00 0.00 O ATOM 4190 H1 WAT 3628 40.479 13.641 85.269 1.00 0.00 H ATOM 4191 H2 WAT 3628 40.016 12.316 85.835 1.00 0.00 H TER 4193 WAT 3628 ATOM 4193 O WAT 3629 96.090 89.327 78.116 1.00 0.00 O ATOM 4194 H1 WAT 3629 95.259 89.801 78.076 1.00 0.00 H ATOM 4195 H2 WAT 3629 96.518 89.659 78.904 1.00 0.00 H TER 4197 WAT 3629 ATOM 4197 O WAT 3630 22.180 25.355 100.422 1.00 0.00 O ATOM 4198 H1 WAT 3630 21.301 25.057 100.657 1.00 0.00 H ATOM 4199 H2 WAT 3630 22.762 24.679 100.767 1.00 0.00 H TER 4201 WAT 3630 ATOM 4201 O WAT 3631 58.708 5.277 23.258 1.00 0.00 O ATOM 4202 H1 WAT 3631 58.033 5.953 23.196 1.00 0.00 H ATOM 4203 H2 WAT 3631 58.510 4.813 24.071 1.00 0.00 H TER 4205 WAT 3631 ATOM 4205 O WAT 3632 83.435 29.482 123.956 1.00 0.00 O ATOM 4206 H1 WAT 3632 83.591 28.727 123.389 1.00 0.00 H ATOM 4207 H2 WAT 3632 84.300 29.873 124.079 1.00 0.00 H TER 4209 WAT 3632 ATOM 4209 O WAT 3633 17.008 93.799 10.050 1.00 0.00 O ATOM 4210 H1 WAT 3633 17.341 94.588 9.622 1.00 0.00 H ATOM 4211 H2 WAT 3633 16.585 94.120 10.847 1.00 0.00 H TER 4213 WAT 3633 ATOM 4213 O WAT 3634 120.752 130.600 87.221 1.00 0.00 O ATOM 4214 H1 WAT 3634 120.117 131.315 87.185 1.00 0.00 H ATOM 4215 H2 WAT 3634 120.340 129.889 86.730 1.00 0.00 H TER 4217 WAT 3634 ATOM 4217 O WAT 3635 140.097 114.629 4.545 1.00 0.00 O ATOM 4218 H1 WAT 3635 139.297 115.155 4.526 1.00 0.00 H ATOM 4219 H2 WAT 3635 140.796 115.261 4.708 1.00 0.00 H TER 4221 WAT 3635 ATOM 4221 O WAT 3636 40.604 67.122 60.332 1.00 0.00 O ATOM 4222 H1 WAT 3636 40.872 66.297 59.928 1.00 0.00 H ATOM 4223 H2 WAT 3636 40.327 67.670 59.598 1.00 0.00 H TER 4225 WAT 3636 ATOM 4225 O WAT 3637 5.081 94.007 102.161 1.00 0.00 O ATOM 4226 H1 WAT 3637 5.490 94.791 102.530 1.00 0.00 H ATOM 4227 H2 WAT 3637 5.526 93.279 102.594 1.00 0.00 H TER 4229 WAT 3637 ATOM 4229 O WAT 3638 17.977 136.888 154.108 1.00 0.00 O ATOM 4230 H1 WAT 3638 18.571 136.927 153.359 1.00 0.00 H ATOM 4231 H2 WAT 3638 18.493 136.473 154.801 1.00 0.00 H TER 4233 WAT 3638 ATOM 4233 O WAT 3639 106.762 111.683 137.323 1.00 0.00 O ATOM 4234 H1 WAT 3639 106.738 110.853 136.848 1.00 0.00 H ATOM 4235 H2 WAT 3639 107.404 112.212 136.850 1.00 0.00 H TER 4237 WAT 3639 ATOM 4237 O WAT 3640 1.184 100.787 121.356 1.00 0.00 O ATOM 4238 H1 WAT 3640 1.738 100.785 122.136 1.00 0.00 H ATOM 4239 H2 WAT 3640 1.792 100.650 120.630 1.00 0.00 H TER 4241 WAT 3640 ATOM 4241 O WAT 3641 50.853 105.718 110.604 1.00 0.00 O ATOM 4242 H1 WAT 3641 50.467 106.588 110.706 1.00 0.00 H ATOM 4243 H2 WAT 3641 50.214 105.125 110.999 1.00 0.00 H TER 4245 WAT 3641 ATOM 4245 O WAT 3642 96.734 77.479 152.037 1.00 0.00 O ATOM 4246 H1 WAT 3642 96.604 76.533 151.973 1.00 0.00 H ATOM 4247 H2 WAT 3642 97.586 77.631 151.628 1.00 0.00 H TER 4249 WAT 3642 ATOM 4249 O WAT 3643 42.531 88.447 88.745 1.00 0.00 O ATOM 4250 H1 WAT 3643 41.606 88.650 88.608 1.00 0.00 H ATOM 4251 H2 WAT 3643 42.960 88.724 87.935 1.00 0.00 H TER 4253 WAT 3643 ATOM 4253 O WAT 3644 7.107 67.905 108.802 1.00 0.00 O ATOM 4254 H1 WAT 3644 6.341 67.793 108.241 1.00 0.00 H ATOM 4255 H2 WAT 3644 7.594 67.085 108.710 1.00 0.00 H TER 4257 WAT 3644 ATOM 4257 O WAT 3645 20.684 81.254 156.277 1.00 0.00 O ATOM 4258 H1 WAT 3645 20.792 81.246 155.326 1.00 0.00 H ATOM 4259 H2 WAT 3645 21.269 81.949 156.579 1.00 0.00 H TER 4261 WAT 3645 ATOM 4261 O WAT 3646 10.223 0.109 148.389 1.00 0.00 O ATOM 4262 H1 WAT 3646 11.087 0.395 148.092 1.00 0.00 H ATOM 4263 H2 WAT 3646 9.999 0.718 149.093 1.00 0.00 H TER 4265 WAT 3646 ATOM 4265 O WAT 3647 67.189 113.579 70.170 1.00 0.00 O ATOM 4266 H1 WAT 3647 67.872 113.829 70.792 1.00 0.00 H ATOM 4267 H2 WAT 3647 66.945 114.398 69.740 1.00 0.00 H TER 4269 WAT 3647 ATOM 4269 O WAT 3648 138.393 96.989 97.553 1.00 0.00 O ATOM 4270 H1 WAT 3648 139.102 96.849 98.181 1.00 0.00 H ATOM 4271 H2 WAT 3648 137.674 97.338 98.079 1.00 0.00 H TER 4273 WAT 3648 ATOM 4273 O WAT 3649 50.890 102.332 154.292 1.00 0.00 O ATOM 4274 H1 WAT 3649 51.786 102.669 154.267 1.00 0.00 H ATOM 4275 H2 WAT 3649 50.390 103.015 154.739 1.00 0.00 H TER 4277 WAT 3649 ATOM 4277 O WAT 3650 103.271 63.030 68.701 1.00 0.00 O ATOM 4278 H1 WAT 3650 103.934 63.466 68.165 1.00 0.00 H ATOM 4279 H2 WAT 3650 103.315 63.478 69.546 1.00 0.00 H TER 4281 WAT 3650 ATOM 4281 O WAT 3651 42.757 12.393 120.770 1.00 0.00 O ATOM 4282 H1 WAT 3651 42.438 12.268 119.877 1.00 0.00 H ATOM 4283 H2 WAT 3651 42.117 11.939 121.319 1.00 0.00 H TER 4285 WAT 3651 ATOM 4285 O WAT 3652 42.702 87.172 83.871 1.00 0.00 O ATOM 4286 H1 WAT 3652 42.238 86.350 83.711 1.00 0.00 H ATOM 4287 H2 WAT 3652 43.158 87.353 83.049 1.00 0.00 H TER 4289 WAT 3652 ATOM 4289 O WAT 3653 25.960 60.527 7.807 1.00 0.00 O ATOM 4290 H1 WAT 3653 26.748 61.067 7.748 1.00 0.00 H ATOM 4291 H2 WAT 3653 26.021 60.107 8.665 1.00 0.00 H TER 4293 WAT 3653 ATOM 4293 O WAT 3654 31.972 84.820 17.486 1.00 0.00 O ATOM 4294 H1 WAT 3654 32.637 84.912 16.803 1.00 0.00 H ATOM 4295 H2 WAT 3654 32.469 84.811 18.304 1.00 0.00 H TER 4297 WAT 3654 ATOM 4297 O WAT 3655 136.281 92.739 25.332 1.00 0.00 O ATOM 4298 H1 WAT 3655 136.175 93.225 26.150 1.00 0.00 H ATOM 4299 H2 WAT 3655 137.219 92.555 25.282 1.00 0.00 H TER 4301 WAT 3655 ATOM 4301 O WAT 3656 24.307 142.609 149.717 1.00 0.00 O ATOM 4302 H1 WAT 3656 24.612 142.699 148.814 1.00 0.00 H ATOM 4303 H2 WAT 3656 23.502 142.096 149.648 1.00 0.00 H TER 4305 WAT 3656 ATOM 4305 O WAT 3657 137.730 37.660 0.354 1.00 0.00 O ATOM 4306 H1 WAT 3657 136.817 37.608 0.072 1.00 0.00 H ATOM 4307 H2 WAT 3657 138.034 36.752 0.347 1.00 0.00 H TER 4309 WAT 3657 ATOM 4309 O WAT 3658 6.717 51.106 132.167 1.00 0.00 O ATOM 4310 H1 WAT 3658 7.506 51.020 131.632 1.00 0.00 H ATOM 4311 H2 WAT 3658 6.980 50.793 133.033 1.00 0.00 H TER 4313 WAT 3658 ATOM 4313 O WAT 3659 84.233 128.669 108.194 1.00 0.00 O ATOM 4314 H1 WAT 3659 84.374 128.592 109.137 1.00 0.00 H ATOM 4315 H2 WAT 3659 84.758 127.964 107.815 1.00 0.00 H TER 4317 WAT 3659 ATOM 4317 O WAT 3660 74.645 68.709 154.657 1.00 0.00 O ATOM 4318 H1 WAT 3660 75.480 68.300 154.884 1.00 0.00 H ATOM 4319 H2 WAT 3660 74.281 68.147 153.973 1.00 0.00 H TER 4321 WAT 3660 ATOM 4321 O WAT 3661 47.346 0.954 67.552 1.00 0.00 O ATOM 4322 H1 WAT 3661 47.056 0.887 68.462 1.00 0.00 H ATOM 4323 H2 WAT 3661 46.584 0.691 67.037 1.00 0.00 H TER 4325 WAT 3661 ATOM 4325 O WAT 3662 44.490 113.736 59.849 1.00 0.00 O ATOM 4326 H1 WAT 3662 45.111 113.159 59.403 1.00 0.00 H ATOM 4327 H2 WAT 3662 44.052 113.171 60.485 1.00 0.00 H TER 4329 WAT 3662 ATOM 4329 O WAT 3663 20.768 91.965 19.079 1.00 0.00 O ATOM 4330 H1 WAT 3663 20.919 91.299 19.750 1.00 0.00 H ATOM 4331 H2 WAT 3663 19.990 92.435 19.378 1.00 0.00 H TER 4333 WAT 3663 ATOM 4333 O WAT 3664 53.480 72.638 28.063 1.00 0.00 O ATOM 4334 H1 WAT 3664 52.676 72.170 28.288 1.00 0.00 H ATOM 4335 H2 WAT 3664 53.979 72.014 27.536 1.00 0.00 H TER 4337 WAT 3664 ATOM 4337 O WAT 3665 36.897 98.368 26.725 1.00 0.00 O ATOM 4338 H1 WAT 3665 36.098 97.862 26.575 1.00 0.00 H ATOM 4339 H2 WAT 3665 36.929 98.490 27.674 1.00 0.00 H TER 4341 WAT 3665 ATOM 4341 O WAT 3666 68.738 94.598 136.952 1.00 0.00 O ATOM 4342 H1 WAT 3666 69.619 94.282 136.749 1.00 0.00 H ATOM 4343 H2 WAT 3666 68.877 95.460 137.345 1.00 0.00 H TER 4345 WAT 3666 ATOM 4345 O WAT 3667 10.061 39.913 71.133 1.00 0.00 O ATOM 4346 H1 WAT 3667 10.793 40.229 71.663 1.00 0.00 H ATOM 4347 H2 WAT 3667 9.284 40.278 71.556 1.00 0.00 H TER 4349 WAT 3667 ATOM 4349 O WAT 3668 31.491 79.122 134.643 1.00 0.00 O ATOM 4350 H1 WAT 3668 31.294 78.671 135.463 1.00 0.00 H ATOM 4351 H2 WAT 3668 32.313 78.732 134.346 1.00 0.00 H TER 4353 WAT 3668 ATOM 4353 O WAT 3669 65.861 103.133 99.982 1.00 0.00 O ATOM 4354 H1 WAT 3669 65.658 102.732 100.827 1.00 0.00 H ATOM 4355 H2 WAT 3669 65.025 103.143 99.515 1.00 0.00 H TER 4357 WAT 3669 ATOM 4357 O WAT 3670 83.165 106.151 0.519 1.00 0.00 O ATOM 4358 H1 WAT 3670 83.823 106.547 -0.052 1.00 0.00 H ATOM 4359 H2 WAT 3670 83.604 106.061 1.364 1.00 0.00 H TER 4361 WAT 3670 ATOM 4361 O WAT 3671 87.648 24.522 121.928 1.00 0.00 O ATOM 4362 H1 WAT 3671 87.873 23.629 122.190 1.00 0.00 H ATOM 4363 H2 WAT 3671 88.221 25.078 122.456 1.00 0.00 H TER 4365 WAT 3671 ATOM 4365 O WAT 3672 101.201 124.783 115.439 1.00 0.00 O ATOM 4366 H1 WAT 3672 101.591 124.755 116.313 1.00 0.00 H ATOM 4367 H2 WAT 3672 101.140 123.865 115.175 1.00 0.00 H TER 4369 WAT 3672 ATOM 4369 O WAT 3673 16.562 21.726 109.087 1.00 0.00 O ATOM 4370 H1 WAT 3673 17.476 21.450 109.163 1.00 0.00 H ATOM 4371 H2 WAT 3673 16.312 21.974 109.977 1.00 0.00 H TER 4373 WAT 3673 ATOM 4373 O WAT 3674 77.608 28.800 72.135 1.00 0.00 O ATOM 4374 H1 WAT 3674 77.053 28.412 71.459 1.00 0.00 H ATOM 4375 H2 WAT 3674 77.704 28.109 72.791 1.00 0.00 H TER 4377 WAT 3674 ATOM 4377 O WAT 3675 121.626 83.854 97.519 1.00 0.00 O ATOM 4378 H1 WAT 3675 121.076 83.203 97.955 1.00 0.00 H ATOM 4379 H2 WAT 3675 122.341 83.346 97.136 1.00 0.00 H TER 4381 WAT 3675 ATOM 4381 O WAT 3676 141.956 87.057 60.945 1.00 0.00 O ATOM 4382 H1 WAT 3676 141.390 86.535 61.513 1.00 0.00 H ATOM 4383 H2 WAT 3676 141.493 87.889 60.845 1.00 0.00 H TER 4385 WAT 3676 ATOM 4385 O WAT 3677 31.424 2.504 110.962 1.00 0.00 O ATOM 4386 H1 WAT 3677 32.011 2.457 111.716 1.00 0.00 H ATOM 4387 H2 WAT 3677 31.701 1.783 110.396 1.00 0.00 H TER 4389 WAT 3677 ATOM 4389 O WAT 3678 75.979 93.582 92.215 1.00 0.00 O ATOM 4390 H1 WAT 3678 76.240 93.524 91.296 1.00 0.00 H ATOM 4391 H2 WAT 3678 76.207 94.475 92.472 1.00 0.00 H TER 4393 WAT 3678 ATOM 4393 O WAT 3679 99.970 116.110 84.967 1.00 0.00 O ATOM 4394 H1 WAT 3679 99.463 115.582 85.584 1.00 0.00 H ATOM 4395 H2 WAT 3679 100.668 115.526 84.670 1.00 0.00 H TER 4397 WAT 3679 ATOM 4397 O WAT 3680 93.604 23.842 95.685 1.00 0.00 O ATOM 4398 H1 WAT 3680 94.026 24.194 94.901 1.00 0.00 H ATOM 4399 H2 WAT 3680 92.889 24.452 95.865 1.00 0.00 H TER 4401 WAT 3680 ATOM 4401 O WAT 3681 141.371 61.730 116.256 1.00 0.00 O ATOM 4402 H1 WAT 3681 142.037 61.503 115.606 1.00 0.00 H ATOM 4403 H2 WAT 3681 141.742 61.441 117.090 1.00 0.00 H TER 4405 WAT 3681 ATOM 4405 O WAT 3682 23.250 112.635 112.919 1.00 0.00 O ATOM 4406 H1 WAT 3682 22.778 112.366 113.708 1.00 0.00 H ATOM 4407 H2 WAT 3682 22.728 113.352 112.561 1.00 0.00 H TER 4409 WAT 3682 ATOM 4409 O WAT 3683 63.247 12.734 92.054 1.00 0.00 O ATOM 4410 H1 WAT 3683 63.864 13.190 92.627 1.00 0.00 H ATOM 4411 H2 WAT 3683 63.500 11.813 92.115 1.00 0.00 H TER 4413 WAT 3683 ATOM 4413 O WAT 3684 130.986 61.477 82.855 1.00 0.00 O ATOM 4414 H1 WAT 3684 130.227 61.931 82.489 1.00 0.00 H ATOM 4415 H2 WAT 3684 130.832 61.474 83.799 1.00 0.00 H TER 4417 WAT 3684 ATOM 4417 O WAT 3685 36.930 28.649 89.534 1.00 0.00 O ATOM 4418 H1 WAT 3685 36.951 29.442 88.999 1.00 0.00 H ATOM 4419 H2 WAT 3685 36.163 28.169 89.221 1.00 0.00 H TER 4421 WAT 3685 ATOM 4421 O WAT 3686 2.822 112.879 55.847 1.00 0.00 O ATOM 4422 H1 WAT 3686 2.122 112.241 55.711 1.00 0.00 H ATOM 4423 H2 WAT 3686 2.406 113.728 55.696 1.00 0.00 H TER 4425 WAT 3686 ATOM 4425 O WAT 3687 55.319 108.509 106.858 1.00 0.00 O ATOM 4426 H1 WAT 3687 55.310 109.012 106.044 1.00 0.00 H ATOM 4427 H2 WAT 3687 55.252 107.596 106.577 1.00 0.00 H TER 4429 WAT 3687 ATOM 4429 O WAT 3688 64.607 11.238 145.831 1.00 0.00 O ATOM 4430 H1 WAT 3688 65.561 11.289 145.881 1.00 0.00 H ATOM 4431 H2 WAT 3688 64.316 11.296 146.741 1.00 0.00 H TER 4433 WAT 3688 ATOM 4433 O WAT 3689 56.392 57.294 58.991 1.00 0.00 O ATOM 4434 H1 WAT 3689 56.619 58.072 58.483 1.00 0.00 H ATOM 4435 H2 WAT 3689 57.074 57.238 59.661 1.00 0.00 H TER 4437 WAT 3689 ATOM 4437 O WAT 3690 140.016 13.187 88.793 1.00 0.00 O ATOM 4438 H1 WAT 3690 140.722 12.542 88.820 1.00 0.00 H ATOM 4439 H2 WAT 3690 140.222 13.798 89.499 1.00 0.00 H TER 4441 WAT 3690 ATOM 4441 O WAT 3691 105.622 54.130 101.282 1.00 0.00 O ATOM 4442 H1 WAT 3691 105.242 55.009 101.281 1.00 0.00 H ATOM 4443 H2 WAT 3691 105.998 54.030 100.408 1.00 0.00 H TER 4445 WAT 3691 ATOM 4445 O WAT 3692 123.740 0.354 75.476 1.00 0.00 O ATOM 4446 H1 WAT 3692 123.763 -0.158 74.668 1.00 0.00 H ATOM 4447 H2 WAT 3692 124.627 0.286 75.829 1.00 0.00 H TER 4449 WAT 3692 ATOM 4449 O WAT 3693 64.588 73.538 14.281 1.00 0.00 O ATOM 4450 H1 WAT 3693 64.849 73.174 13.435 1.00 0.00 H ATOM 4451 H2 WAT 3693 65.403 73.591 14.780 1.00 0.00 H TER 4453 WAT 3693 ATOM 4453 O WAT 3694 11.801 123.540 117.724 1.00 0.00 O ATOM 4454 H1 WAT 3694 11.773 122.792 117.127 1.00 0.00 H ATOM 4455 H2 WAT 3694 10.971 123.994 117.577 1.00 0.00 H TER 4457 WAT 3694 ATOM 4457 O WAT 3695 142.392 54.902 121.185 1.00 0.00 O ATOM 4458 H1 WAT 3695 143.315 54.654 121.145 1.00 0.00 H ATOM 4459 H2 WAT 3695 142.195 55.236 120.310 1.00 0.00 H TER 4461 WAT 3695 ATOM 4461 O WAT 3696 16.921 51.218 68.293 1.00 0.00 O ATOM 4462 H1 WAT 3696 16.058 51.516 68.579 1.00 0.00 H ATOM 4463 H2 WAT 3696 16.745 50.429 67.780 1.00 0.00 H TER 4465 WAT 3696 ATOM 4465 O WAT 3697 34.398 131.899 138.163 1.00 0.00 O ATOM 4466 H1 WAT 3697 34.403 131.018 137.789 1.00 0.00 H ATOM 4467 H2 WAT 3697 33.497 132.028 138.461 1.00 0.00 H TER 4469 WAT 3697 ATOM 4469 O WAT 3698 4.030 65.605 71.194 1.00 0.00 O ATOM 4470 H1 WAT 3698 4.085 65.288 70.293 1.00 0.00 H ATOM 4471 H2 WAT 3698 4.788 65.217 71.631 1.00 0.00 H TER 4473 WAT 3698 ATOM 4473 O WAT 3699 141.853 141.813 139.757 1.00 0.00 O ATOM 4474 H1 WAT 3699 141.958 141.833 138.806 1.00 0.00 H ATOM 4475 H2 WAT 3699 140.926 141.614 139.892 1.00 0.00 H TER 4477 WAT 3699 ATOM 4477 O WAT 3700 14.902 75.280 65.525 1.00 0.00 O ATOM 4478 H1 WAT 3700 15.569 74.657 65.236 1.00 0.00 H ATOM 4479 H2 WAT 3700 14.240 74.739 65.956 1.00 0.00 H TER 4481 WAT 3700 ATOM 4481 O WAT 3701 126.835 90.229 95.849 1.00 0.00 O ATOM 4482 H1 WAT 3701 126.817 90.786 95.070 1.00 0.00 H ATOM 4483 H2 WAT 3701 125.919 89.992 95.995 1.00 0.00 H TER 4485 WAT 3701 ATOM 4485 O WAT 3702 115.011 17.268 78.420 1.00 0.00 O ATOM 4486 H1 WAT 3702 115.259 17.987 77.839 1.00 0.00 H ATOM 4487 H2 WAT 3702 115.628 17.327 79.150 1.00 0.00 H TER 4489 WAT 3702 ATOM 4489 O WAT 3703 10.394 41.217 2.710 1.00 0.00 O ATOM 4490 H1 WAT 3703 9.494 40.914 2.828 1.00 0.00 H ATOM 4491 H2 WAT 3703 10.905 40.414 2.605 1.00 0.00 H TER 4493 WAT 3703 ATOM 4493 O WAT 3704 72.028 89.009 2.715 1.00 0.00 O ATOM 4494 H1 WAT 3704 71.478 88.718 1.988 1.00 0.00 H ATOM 4495 H2 WAT 3704 72.487 88.219 3.000 1.00 0.00 H TER 4497 WAT 3704 ATOM 4497 O WAT 3705 27.840 130.516 68.816 1.00 0.00 O ATOM 4498 H1 WAT 3705 27.142 130.017 69.240 1.00 0.00 H ATOM 4499 H2 WAT 3705 28.563 130.497 69.444 1.00 0.00 H TER 4501 WAT 3705 ATOM 4501 O WAT 3706 66.204 5.033 84.680 1.00 0.00 O ATOM 4502 H1 WAT 3706 66.246 4.261 84.116 1.00 0.00 H ATOM 4503 H2 WAT 3706 67.111 5.329 84.750 1.00 0.00 H TER 4505 WAT 3706 ATOM 4505 O WAT 3707 56.949 116.780 124.066 1.00 0.00 O ATOM 4506 H1 WAT 3707 56.893 115.826 124.116 1.00 0.00 H ATOM 4507 H2 WAT 3707 57.526 116.948 123.321 1.00 0.00 H TER 4509 WAT 3707 ATOM 4509 O WAT 3708 89.914 52.069 132.809 1.00 0.00 O ATOM 4510 H1 WAT 3708 89.704 52.690 133.506 1.00 0.00 H ATOM 4511 H2 WAT 3708 90.849 51.895 132.918 1.00 0.00 H TER 4513 WAT 3708 ATOM 4513 O WAT 3709 62.777 51.184 82.055 1.00 0.00 O ATOM 4514 H1 WAT 3709 62.033 51.744 82.275 1.00 0.00 H ATOM 4515 H2 WAT 3709 63.262 51.680 81.395 1.00 0.00 H TER 4517 WAT 3709 ATOM 4517 O WAT 3710 48.806 88.011 59.111 1.00 0.00 O ATOM 4518 H1 WAT 3710 47.905 87.688 59.096 1.00 0.00 H ATOM 4519 H2 WAT 3710 49.219 87.536 59.832 1.00 0.00 H TER 4521 WAT 3710 ATOM 4521 O WAT 3711 97.641 73.812 103.999 1.00 0.00 O ATOM 4522 H1 WAT 3711 97.062 73.933 104.752 1.00 0.00 H ATOM 4523 H2 WAT 3711 98.285 73.167 104.293 1.00 0.00 H TER 4525 WAT 3711 ATOM 4525 O WAT 3712 95.029 60.767 152.993 1.00 0.00 O ATOM 4526 H1 WAT 3712 94.591 60.862 153.839 1.00 0.00 H ATOM 4527 H2 WAT 3712 95.645 61.499 152.960 1.00 0.00 H TER 4529 WAT 3712 ATOM 4529 O WAT 3713 21.161 112.789 79.927 1.00 0.00 O ATOM 4530 H1 WAT 3713 21.868 112.898 79.290 1.00 0.00 H ATOM 4531 H2 WAT 3713 20.773 111.942 79.710 1.00 0.00 H TER 4533 WAT 3713 ATOM 4533 O WAT 3714 17.058 4.540 77.416 1.00 0.00 O ATOM 4534 H1 WAT 3714 16.707 5.422 77.295 1.00 0.00 H ATOM 4535 H2 WAT 3714 16.384 4.080 77.915 1.00 0.00 H TER 4537 WAT 3714 ATOM 4537 O WAT 3715 82.228 109.615 66.465 1.00 0.00 O ATOM 4538 H1 WAT 3715 82.802 109.977 67.140 1.00 0.00 H ATOM 4539 H2 WAT 3715 82.749 109.650 65.663 1.00 0.00 H TER 4541 WAT 3715 ATOM 4541 O WAT 3716 115.271 56.111 77.689 1.00 0.00 O ATOM 4542 H1 WAT 3716 114.566 55.615 77.273 1.00 0.00 H ATOM 4543 H2 WAT 3716 116.056 55.585 77.537 1.00 0.00 H TER 4545 WAT 3716 ATOM 4545 O WAT 3717 29.415 56.294 5.211 1.00 0.00 O ATOM 4546 H1 WAT 3717 29.481 56.687 6.081 1.00 0.00 H ATOM 4547 H2 WAT 3717 29.002 56.970 4.674 1.00 0.00 H TER 4549 WAT 3717 ATOM 4549 O WAT 3718 136.443 132.671 78.081 1.00 0.00 O ATOM 4550 H1 WAT 3718 136.973 132.674 77.284 1.00 0.00 H ATOM 4551 H2 WAT 3718 135.868 131.912 77.985 1.00 0.00 H TER 4553 WAT 3718 ATOM 4553 O WAT 3719 142.227 80.225 86.677 1.00 0.00 O ATOM 4554 H1 WAT 3719 141.783 80.856 87.244 1.00 0.00 H ATOM 4555 H2 WAT 3719 141.545 79.918 86.080 1.00 0.00 H TER 4557 WAT 3719 ATOM 4557 O WAT 3720 124.246 31.918 139.657 1.00 0.00 O ATOM 4558 H1 WAT 3720 124.649 32.708 139.297 1.00 0.00 H ATOM 4559 H2 WAT 3720 123.404 32.214 140.003 1.00 0.00 H TER 4561 WAT 3720 ATOM 4561 O WAT 3721 18.868 92.260 63.449 1.00 0.00 O ATOM 4562 H1 WAT 3721 19.787 92.089 63.243 1.00 0.00 H ATOM 4563 H2 WAT 3721 18.452 92.388 62.596 1.00 0.00 H TER 4565 WAT 3721 ATOM 4565 O WAT 3722 113.205 94.287 150.296 1.00 0.00 O ATOM 4566 H1 WAT 3722 112.316 93.933 150.296 1.00 0.00 H ATOM 4567 H2 WAT 3722 113.085 95.236 150.296 1.00 0.00 H TER 4569 WAT 3722 ATOM 4569 O WAT 3723 57.016 51.390 94.929 1.00 0.00 O ATOM 4570 H1 WAT 3723 56.122 51.060 94.835 1.00 0.00 H ATOM 4571 H2 WAT 3723 57.547 50.607 95.072 1.00 0.00 H TER 4573 WAT 3723 ATOM 4573 O WAT 3724 107.715 131.875 0.110 1.00 0.00 O ATOM 4574 H1 WAT 3724 108.400 132.286 0.636 1.00 0.00 H ATOM 4575 H2 WAT 3724 107.409 132.572 -0.471 1.00 0.00 H TER 4577 WAT 3724 ATOM 4577 O WAT 3725 104.129 46.780 136.189 1.00 0.00 O ATOM 4578 H1 WAT 3725 104.106 45.841 136.004 1.00 0.00 H ATOM 4579 H2 WAT 3725 104.521 46.844 137.060 1.00 0.00 H TER 4581 WAT 3725 ATOM 4581 O WAT 3726 73.597 143.566 124.843 1.00 0.00 O ATOM 4582 H1 WAT 3726 73.177 143.209 125.625 1.00 0.00 H ATOM 4583 H2 WAT 3726 73.195 143.090 124.117 1.00 0.00 H TER 4585 WAT 3726 ATOM 4585 O WAT 3727 18.660 95.852 92.852 1.00 0.00 O ATOM 4586 H1 WAT 3727 17.843 96.263 93.135 1.00 0.00 H ATOM 4587 H2 WAT 3727 19.191 95.802 93.647 1.00 0.00 H TER 4589 WAT 3727 ATOM 4589 O WAT 3728 56.433 144.759 20.117 1.00 0.00 O ATOM 4590 H1 WAT 3728 57.309 144.460 19.873 1.00 0.00 H ATOM 4591 H2 WAT 3728 55.861 144.023 19.898 1.00 0.00 H TER 4593 WAT 3728 ATOM 4593 O WAT 3729 69.422 86.021 80.450 1.00 0.00 O ATOM 4594 H1 WAT 3729 69.696 85.287 79.899 1.00 0.00 H ATOM 4595 H2 WAT 3729 68.530 86.215 80.163 1.00 0.00 H TER 4597 WAT 3729 ATOM 4597 O WAT 3730 87.400 123.761 93.917 1.00 0.00 O ATOM 4598 H1 WAT 3730 87.530 122.920 93.479 1.00 0.00 H ATOM 4599 H2 WAT 3730 86.603 124.116 93.522 1.00 0.00 H TER 4601 WAT 3730 ATOM 4601 O WAT 3731 127.937 8.904 108.122 1.00 0.00 O ATOM 4602 H1 WAT 3731 128.245 8.047 108.417 1.00 0.00 H ATOM 4603 H2 WAT 3731 127.152 9.069 108.645 1.00 0.00 H TER 4605 WAT 3731 ATOM 4605 O WAT 3732 84.719 135.513 76.777 1.00 0.00 O ATOM 4606 H1 WAT 3732 84.544 134.615 76.498 1.00 0.00 H ATOM 4607 H2 WAT 3732 84.032 135.704 77.416 1.00 0.00 H TER 4609 WAT 3732 ATOM 4609 O WAT 3733 54.498 78.671 95.002 1.00 0.00 O ATOM 4610 H1 WAT 3733 53.938 79.427 95.178 1.00 0.00 H ATOM 4611 H2 WAT 3733 55.354 78.920 95.351 1.00 0.00 H TER 4613 WAT 3733 ATOM 4613 O WAT 3734 82.289 93.283 71.585 1.00 0.00 O ATOM 4614 H1 WAT 3734 82.845 94.058 71.502 1.00 0.00 H ATOM 4615 H2 WAT 3734 82.661 92.799 72.322 1.00 0.00 H TER 4617 WAT 3734 ATOM 4617 O WAT 3735 105.953 116.286 6.028 1.00 0.00 O ATOM 4618 H1 WAT 3735 106.497 115.815 5.397 1.00 0.00 H ATOM 4619 H2 WAT 3735 105.760 115.641 6.707 1.00 0.00 H TER 4621 WAT 3735 ATOM 4621 O WAT 3736 7.997 10.989 11.454 1.00 0.00 O ATOM 4622 H1 WAT 3736 7.297 10.559 11.945 1.00 0.00 H ATOM 4623 H2 WAT 3736 8.276 10.337 10.812 1.00 0.00 H TER 4625 WAT 3736 ATOM 4625 O WAT 3737 66.387 15.420 101.548 1.00 0.00 O ATOM 4626 H1 WAT 3737 65.671 15.088 102.089 1.00 0.00 H ATOM 4627 H2 WAT 3737 67.163 14.958 101.867 1.00 0.00 H TER 4629 WAT 3737 ATOM 4629 O WAT 3738 55.357 86.861 67.407 1.00 0.00 O ATOM 4630 H1 WAT 3738 55.980 86.184 67.142 1.00 0.00 H ATOM 4631 H2 WAT 3738 55.162 87.336 66.599 1.00 0.00 H TER 4633 WAT 3738 ATOM 4633 O WAT 3739 97.220 103.052 59.783 1.00 0.00 O ATOM 4634 H1 WAT 3739 97.155 103.601 60.565 1.00 0.00 H ATOM 4635 H2 WAT 3739 97.864 102.382 60.014 1.00 0.00 H TER 4637 WAT 3739 ATOM 4637 O WAT 3740 105.343 16.095 148.146 1.00 0.00 O ATOM 4638 H1 WAT 3740 106.223 16.457 148.041 1.00 0.00 H ATOM 4639 H2 WAT 3740 105.109 16.295 149.053 1.00 0.00 H TER 4641 WAT 3740 ATOM 4641 O WAT 3741 131.014 56.475 59.563 1.00 0.00 O ATOM 4642 H1 WAT 3741 130.930 55.773 58.917 1.00 0.00 H ATOM 4643 H2 WAT 3741 130.441 56.208 60.282 1.00 0.00 H TER 4645 WAT 3741 ATOM 4645 O WAT 3742 45.920 65.217 95.013 1.00 0.00 O ATOM 4646 H1 WAT 3742 45.295 65.145 94.291 1.00 0.00 H ATOM 4647 H2 WAT 3742 46.277 66.101 94.933 1.00 0.00 H TER 4649 WAT 3742 ATOM 4649 O WAT 3743 0.577 27.973 116.481 1.00 0.00 O ATOM 4650 H1 WAT 3743 0.458 28.921 116.411 1.00 0.00 H ATOM 4651 H2 WAT 3743 -0.282 27.608 116.267 1.00 0.00 H TER 4653 WAT 3743 ATOM 4653 O WAT 3744 57.814 40.966 120.493 1.00 0.00 O ATOM 4654 H1 WAT 3744 58.302 41.545 119.908 1.00 0.00 H ATOM 4655 H2 WAT 3744 57.653 41.495 121.274 1.00 0.00 H TER 4657 WAT 3744 ATOM 4657 O WAT 3745 96.200 22.501 112.763 1.00 0.00 O ATOM 4658 H1 WAT 3745 96.295 21.553 112.671 1.00 0.00 H ATOM 4659 H2 WAT 3745 95.269 22.632 112.945 1.00 0.00 H TER 4661 WAT 3745 ATOM 4661 O WAT 3746 78.166 10.882 69.079 1.00 0.00 O ATOM 4662 H1 WAT 3746 78.907 10.385 68.734 1.00 0.00 H ATOM 4663 H2 WAT 3746 77.849 11.389 68.332 1.00 0.00 H TER 4665 WAT 3746 ATOM 4665 O WAT 3747 42.242 8.224 127.245 1.00 0.00 O ATOM 4666 H1 WAT 3747 42.237 8.385 128.188 1.00 0.00 H ATOM 4667 H2 WAT 3747 41.367 7.885 127.055 1.00 0.00 H TER 4669 WAT 3747 ATOM 4669 O WAT 3748 101.967 121.770 147.162 1.00 0.00 O ATOM 4670 H1 WAT 3748 102.806 121.312 147.207 1.00 0.00 H ATOM 4671 H2 WAT 3748 101.732 121.929 148.076 1.00 0.00 H TER 4673 WAT 3748 ATOM 4673 O WAT 3749 58.293 118.215 74.677 1.00 0.00 O ATOM 4674 H1 WAT 3749 57.555 117.651 74.910 1.00 0.00 H ATOM 4675 H2 WAT 3749 59.033 117.615 74.583 1.00 0.00 H TER 4677 WAT 3749 ATOM 4677 O WAT 3750 103.688 59.193 62.382 1.00 0.00 O ATOM 4678 H1 WAT 3750 103.902 60.057 62.733 1.00 0.00 H ATOM 4679 H2 WAT 3750 104.520 58.859 62.045 1.00 0.00 H TER 4681 WAT 3750 ATOM 4681 O WAT 3751 29.820 99.384 94.313 1.00 0.00 O ATOM 4682 H1 WAT 3751 30.468 99.252 95.005 1.00 0.00 H ATOM 4683 H2 WAT 3751 29.358 98.548 94.256 1.00 0.00 H TER 4685 WAT 3751 ATOM 4685 O WAT 3752 43.747 69.582 94.491 1.00 0.00 O ATOM 4686 H1 WAT 3752 43.274 70.297 94.067 1.00 0.00 H ATOM 4687 H2 WAT 3752 44.164 69.989 95.251 1.00 0.00 H TER 4689 WAT 3752 ATOM 4689 O WAT 3753 5.343 96.461 73.234 1.00 0.00 O ATOM 4690 H1 WAT 3753 4.387 96.479 73.284 1.00 0.00 H ATOM 4691 H2 WAT 3753 5.614 95.993 74.023 1.00 0.00 H TER 4693 WAT 3753 ATOM 4693 O WAT 3754 121.894 91.104 158.709 1.00 0.00 O ATOM 4694 H1 WAT 3754 122.810 90.858 158.835 1.00 0.00 H ATOM 4695 H2 WAT 3754 121.626 90.633 157.920 1.00 0.00 H TER 4697 WAT 3754 ATOM 4697 O WAT 3755 135.563 112.984 18.732 1.00 0.00 O ATOM 4698 H1 WAT 3755 136.178 113.553 18.269 1.00 0.00 H ATOM 4699 H2 WAT 3755 136.109 112.292 19.103 1.00 0.00 H TER 4701 WAT 3755 ATOM 4701 O WAT 3756 93.190 60.709 108.554 1.00 0.00 O ATOM 4702 H1 WAT 3756 93.739 60.008 108.908 1.00 0.00 H ATOM 4703 H2 WAT 3756 93.259 60.611 107.604 1.00 0.00 H TER 4705 WAT 3756 ATOM 4705 O WAT 3757 119.369 51.076 63.213 1.00 0.00 O ATOM 4706 H1 WAT 3757 120.171 50.721 62.830 1.00 0.00 H ATOM 4707 H2 WAT 3757 118.718 51.009 62.514 1.00 0.00 H TER 4709 WAT 3757 ATOM 4709 O WAT 3758 142.111 6.688 124.991 1.00 0.00 O ATOM 4710 H1 WAT 3758 142.896 6.237 125.302 1.00 0.00 H ATOM 4711 H2 WAT 3758 141.408 6.049 125.100 1.00 0.00 H TER 4713 WAT 3758 ATOM 4713 O WAT 3759 40.926 110.767 23.415 1.00 0.00 O ATOM 4714 H1 WAT 3759 41.144 110.217 24.168 1.00 0.00 H ATOM 4715 H2 WAT 3759 40.094 111.177 23.650 1.00 0.00 H TER 4717 WAT 3759 ATOM 4717 O WAT 3760 20.908 13.684 99.637 1.00 0.00 O ATOM 4718 H1 WAT 3760 20.372 13.133 100.207 1.00 0.00 H ATOM 4719 H2 WAT 3760 20.302 13.994 98.964 1.00 0.00 H TER 4721 WAT 3760 ATOM 4721 O WAT 3761 111.379 86.530 0.823 1.00 0.00 O ATOM 4722 H1 WAT 3761 111.841 86.396 1.650 1.00 0.00 H ATOM 4723 H2 WAT 3761 111.495 85.707 0.348 1.00 0.00 H TER 4725 WAT 3761 ATOM 4725 O WAT 3762 32.938 117.987 96.536 1.00 0.00 O ATOM 4726 H1 WAT 3762 32.286 118.633 96.808 1.00 0.00 H ATOM 4727 H2 WAT 3762 32.925 118.022 95.580 1.00 0.00 H TER 4729 WAT 3762 ATOM 4729 O WAT 3763 137.189 63.597 93.114 1.00 0.00 O ATOM 4730 H1 WAT 3763 136.990 62.745 92.727 1.00 0.00 H ATOM 4731 H2 WAT 3763 138.030 63.845 92.729 1.00 0.00 H TER 4733 WAT 3763 ATOM 4733 O WAT 3764 96.159 83.875 97.508 1.00 0.00 O ATOM 4734 H1 WAT 3764 96.684 83.214 97.959 1.00 0.00 H ATOM 4735 H2 WAT 3764 95.487 83.374 97.046 1.00 0.00 H TER 4737 WAT 3764 ATOM 4737 O WAT 3765 67.656 8.191 147.998 1.00 0.00 O ATOM 4738 H1 WAT 3765 67.496 7.341 147.588 1.00 0.00 H ATOM 4739 H2 WAT 3765 67.313 8.828 147.371 1.00 0.00 H TER 4741 WAT 3765 ATOM 4741 O WAT 3766 27.546 98.996 135.508 1.00 0.00 O ATOM 4742 H1 WAT 3766 28.302 99.457 135.145 1.00 0.00 H ATOM 4743 H2 WAT 3766 26.970 98.852 134.758 1.00 0.00 H TER 4745 WAT 3766 ATOM 4745 O WAT 3767 106.125 11.901 92.106 1.00 0.00 O ATOM 4746 H1 WAT 3767 106.942 11.405 92.151 1.00 0.00 H ATOM 4747 H2 WAT 3767 105.954 11.998 91.170 1.00 0.00 H TER 4749 WAT 3767 ATOM 4749 O WAT 3768 136.843 2.831 133.836 1.00 0.00 O ATOM 4750 H1 WAT 3768 136.342 2.257 133.256 1.00 0.00 H ATOM 4751 H2 WAT 3768 137.265 2.235 134.456 1.00 0.00 H TER 4753 WAT 3768 ATOM 4753 O WAT 3769 138.592 25.392 111.571 1.00 0.00 O ATOM 4754 H1 WAT 3769 139.294 24.740 111.567 1.00 0.00 H ATOM 4755 H2 WAT 3769 137.882 24.981 111.079 1.00 0.00 H TER 4757 WAT 3769 ATOM 4757 O WAT 3770 24.698 18.538 88.390 1.00 0.00 O ATOM 4758 H1 WAT 3770 24.985 19.025 89.163 1.00 0.00 H ATOM 4759 H2 WAT 3770 23.765 18.383 88.537 1.00 0.00 H TER 4761 WAT 3770 ATOM 4761 O WAT 3771 25.258 37.949 68.402 1.00 0.00 O ATOM 4762 H1 WAT 3771 25.713 38.666 68.843 1.00 0.00 H ATOM 4763 H2 WAT 3771 24.330 38.165 68.488 1.00 0.00 H TER 4765 WAT 3771 ATOM 4765 O WAT 3772 110.570 88.787 133.165 1.00 0.00 O ATOM 4766 H1 WAT 3772 110.303 88.123 133.802 1.00 0.00 H ATOM 4767 H2 WAT 3772 111.381 89.149 133.522 1.00 0.00 H TER 4769 WAT 3772 ATOM 4769 O WAT 3773 37.221 43.914 91.094 1.00 0.00 O ATOM 4770 H1 WAT 3773 36.324 44.245 91.134 1.00 0.00 H ATOM 4771 H2 WAT 3773 37.239 43.192 91.722 1.00 0.00 H TER 4773 WAT 3773 ATOM 4773 O WAT 3774 93.746 16.148 121.314 1.00 0.00 O ATOM 4774 H1 WAT 3774 94.681 15.951 121.381 1.00 0.00 H ATOM 4775 H2 WAT 3774 93.311 15.354 121.625 1.00 0.00 H TER 4777 WAT 3774 ATOM 4777 O WAT 3775 42.184 16.318 15.294 1.00 0.00 O ATOM 4778 H1 WAT 3775 41.409 15.781 15.459 1.00 0.00 H ATOM 4779 H2 WAT 3775 42.654 16.322 16.128 1.00 0.00 H TER 4781 WAT 3775 ATOM 4781 O WAT 3776 129.894 11.310 89.660 1.00 0.00 O ATOM 4782 H1 WAT 3776 129.144 11.165 90.238 1.00 0.00 H ATOM 4783 H2 WAT 3776 129.544 11.835 88.940 1.00 0.00 H TER 4785 WAT 3776 ATOM 4785 O WAT 3777 137.628 111.183 8.233 1.00 0.00 O ATOM 4786 H1 WAT 3777 137.660 111.134 7.278 1.00 0.00 H ATOM 4787 H2 WAT 3777 137.048 110.466 8.490 1.00 0.00 H TER 4789 WAT 3777 ATOM 4789 O WAT 3778 22.002 77.417 129.463 1.00 0.00 O ATOM 4790 H1 WAT 3778 22.259 77.448 128.541 1.00 0.00 H ATOM 4791 H2 WAT 3778 21.528 78.236 129.607 1.00 0.00 H TER 4793 WAT 3778 ATOM 4793 O WAT 3779 140.881 109.447 102.325 1.00 0.00 O ATOM 4794 H1 WAT 3779 141.158 110.182 102.871 1.00 0.00 H ATOM 4795 H2 WAT 3779 139.948 109.598 102.176 1.00 0.00 H TER 4797 WAT 3779 ATOM 4797 O WAT 3780 41.922 24.401 12.801 1.00 0.00 O ATOM 4798 H1 WAT 3780 41.640 23.610 12.342 1.00 0.00 H ATOM 4799 H2 WAT 3780 41.610 24.282 13.698 1.00 0.00 H TER 4801 WAT 3780 ATOM 4801 O WAT 3781 24.838 134.768 13.770 1.00 0.00 O ATOM 4802 H1 WAT 3781 24.618 135.392 13.079 1.00 0.00 H ATOM 4803 H2 WAT 3781 25.585 134.280 13.423 1.00 0.00 H TER 4805 WAT 3781 ATOM 4805 O WAT 3782 65.759 99.117 20.253 1.00 0.00 O ATOM 4806 H1 WAT 3782 66.317 98.355 20.409 1.00 0.00 H ATOM 4807 H2 WAT 3782 65.571 99.459 21.127 1.00 0.00 H TER 4809 WAT 3782 ATOM 4809 O WAT 3783 100.284 83.541 99.998 1.00 0.00 O ATOM 4810 H1 WAT 3783 100.911 82.859 99.756 1.00 0.00 H ATOM 4811 H2 WAT 3783 99.470 83.281 99.568 1.00 0.00 H TER 4813 WAT 3783 ATOM 4813 O WAT 3784 111.887 39.431 12.290 1.00 0.00 O ATOM 4814 H1 WAT 3784 111.572 39.562 13.184 1.00 0.00 H ATOM 4815 H2 WAT 3784 111.902 38.480 12.178 1.00 0.00 H TER 4817 WAT 3784 ATOM 4817 O WAT 3785 77.127 2.754 11.331 1.00 0.00 O ATOM 4818 H1 WAT 3785 76.283 2.605 10.905 1.00 0.00 H ATOM 4819 H2 WAT 3785 76.925 3.329 12.069 1.00 0.00 H TER 4821 WAT 3785 ATOM 4821 O WAT 3786 86.391 29.495 19.381 1.00 0.00 O ATOM 4822 H1 WAT 3786 86.138 29.171 20.245 1.00 0.00 H ATOM 4823 H2 WAT 3786 87.184 29.005 19.164 1.00 0.00 H TER 4825 WAT 3786 ATOM 4825 O WAT 3787 62.806 92.930 0.939 1.00 0.00 O ATOM 4826 H1 WAT 3787 61.927 93.302 0.869 1.00 0.00 H ATOM 4827 H2 WAT 3787 63.386 93.625 0.628 1.00 0.00 H TER 4829 WAT 3787 ATOM 4829 O WAT 3788 14.547 78.579 63.039 1.00 0.00 O ATOM 4830 H1 WAT 3788 14.273 79.496 63.041 1.00 0.00 H ATOM 4831 H2 WAT 3788 14.220 78.230 63.868 1.00 0.00 H TER 4833 WAT 3788 ATOM 4833 O WAT 3789 113.829 53.690 19.603 1.00 0.00 O ATOM 4834 H1 WAT 3789 114.209 52.863 19.307 1.00 0.00 H ATOM 4835 H2 WAT 3789 113.061 53.432 20.112 1.00 0.00 H TER 4837 WAT 3789 ATOM 4837 O WAT 3790 67.425 15.676 17.794 1.00 0.00 O ATOM 4838 H1 WAT 3790 68.195 15.982 18.273 1.00 0.00 H ATOM 4839 H2 WAT 3790 66.777 15.494 18.474 1.00 0.00 H TER 4841 WAT 3790 ATOM 4841 O WAT 3791 76.807 20.985 93.539 1.00 0.00 O ATOM 4842 H1 WAT 3791 77.615 21.180 93.064 1.00 0.00 H ATOM 4843 H2 WAT 3791 76.982 20.153 93.979 1.00 0.00 H TER 4845 WAT 3791 ATOM 4845 O WAT 3792 9.136 24.079 101.535 1.00 0.00 O ATOM 4846 H1 WAT 3792 8.642 24.883 101.375 1.00 0.00 H ATOM 4847 H2 WAT 3792 10.035 24.296 101.288 1.00 0.00 H TER 4849 WAT 3792 ATOM 4849 O WAT 3793 55.015 39.429 125.621 1.00 0.00 O ATOM 4850 H1 WAT 3793 55.088 39.901 126.451 1.00 0.00 H ATOM 4851 H2 WAT 3793 54.961 38.507 125.874 1.00 0.00 H TER 4853 WAT 3793 ATOM 4853 O WAT 3794 10.063 72.331 86.036 1.00 0.00 O ATOM 4854 H1 WAT 3794 10.375 72.447 86.933 1.00 0.00 H ATOM 4855 H2 WAT 3794 9.655 73.168 85.814 1.00 0.00 H TER 4857 WAT 3794 ATOM 4857 O WAT 3795 104.179 28.439 128.120 1.00 0.00 O ATOM 4858 H1 WAT 3795 104.670 28.606 128.925 1.00 0.00 H ATOM 4859 H2 WAT 3795 103.406 29.000 128.191 1.00 0.00 H TER 4861 WAT 3795 ATOM 4861 O WAT 3796 124.689 98.339 75.084 1.00 0.00 O ATOM 4862 H1 WAT 3796 124.907 99.239 74.842 1.00 0.00 H ATOM 4863 H2 WAT 3796 123.818 98.400 75.475 1.00 0.00 H TER 4865 WAT 3796 ATOM 4865 O WAT 3797 12.706 84.980 125.607 1.00 0.00 O ATOM 4866 H1 WAT 3797 13.616 84.875 125.330 1.00 0.00 H ATOM 4867 H2 WAT 3797 12.193 84.600 124.894 1.00 0.00 H TER 4869 WAT 3797 ATOM 4869 O WAT 3798 6.283 131.508 93.320 1.00 0.00 O ATOM 4870 H1 WAT 3798 6.002 131.315 92.425 1.00 0.00 H ATOM 4871 H2 WAT 3798 7.062 132.054 93.213 1.00 0.00 H TER 4873 WAT 3798 ATOM 4873 O WAT 3799 51.725 102.501 61.101 1.00 0.00 O ATOM 4874 H1 WAT 3799 51.686 103.415 60.819 1.00 0.00 H ATOM 4875 H2 WAT 3799 52.395 102.107 60.543 1.00 0.00 H TER 4877 WAT 3799 ATOM 4877 O WAT 3800 75.160 66.583 88.518 1.00 0.00 O ATOM 4878 H1 WAT 3800 75.149 67.376 89.054 1.00 0.00 H ATOM 4879 H2 WAT 3800 74.239 66.419 88.315 1.00 0.00 H TER 4881 WAT 3800 ATOM 4881 O WAT 3801 81.576 103.438 123.800 1.00 0.00 O ATOM 4882 H1 WAT 3801 80.903 104.078 123.571 1.00 0.00 H ATOM 4883 H2 WAT 3801 82.278 103.593 123.168 1.00 0.00 H TER 4885 WAT 3801 ATOM 4885 O WAT 3802 19.525 136.997 105.707 1.00 0.00 O ATOM 4886 H1 WAT 3802 20.117 136.794 104.983 1.00 0.00 H ATOM 4887 H2 WAT 3802 19.642 136.273 106.322 1.00 0.00 H TER 4889 WAT 3802 ATOM 4889 O WAT 3803 128.399 52.364 141.102 1.00 0.00 O ATOM 4890 H1 WAT 3803 129.140 52.924 141.335 1.00 0.00 H ATOM 4891 H2 WAT 3803 128.652 51.492 141.405 1.00 0.00 H TER 4893 WAT 3803 ATOM 4893 O WAT 3804 110.391 114.882 128.628 1.00 0.00 O ATOM 4894 H1 WAT 3804 111.260 114.687 128.977 1.00 0.00 H ATOM 4895 H2 WAT 3804 109.857 114.128 128.880 1.00 0.00 H TER 4897 WAT 3804 ATOM 4897 O WAT 3805 137.924 81.366 141.979 1.00 0.00 O ATOM 4898 H1 WAT 3805 137.884 81.810 142.826 1.00 0.00 H ATOM 4899 H2 WAT 3805 138.015 80.439 142.199 1.00 0.00 H TER 4901 WAT 3805 ATOM 4901 O WAT 3806 137.687 28.722 1.459 1.00 0.00 O ATOM 4902 H1 WAT 3806 137.893 27.792 1.360 1.00 0.00 H ATOM 4903 H2 WAT 3806 137.160 28.767 2.257 1.00 0.00 H TER 4905 WAT 3806 ATOM 4905 O WAT 3807 102.911 89.420 68.763 1.00 0.00 O ATOM 4906 H1 WAT 3807 103.533 88.740 68.503 1.00 0.00 H ATOM 4907 H2 WAT 3807 102.921 90.044 68.038 1.00 0.00 H TER 4909 WAT 3807 ATOM 4909 O WAT 3808 111.161 26.698 65.146 1.00 0.00 O ATOM 4910 H1 WAT 3808 111.647 25.877 65.230 1.00 0.00 H ATOM 4911 H2 WAT 3808 110.458 26.626 65.791 1.00 0.00 H TER 4913 WAT 3808 ATOM 4913 O WAT 3809 76.303 138.891 97.117 1.00 0.00 O ATOM 4914 H1 WAT 3809 76.958 139.408 96.647 1.00 0.00 H ATOM 4915 H2 WAT 3809 75.973 139.481 97.794 1.00 0.00 H TER 4917 WAT 3809 ATOM 4917 O WAT 3810 68.762 19.141 132.786 1.00 0.00 O ATOM 4918 H1 WAT 3810 68.870 19.243 133.732 1.00 0.00 H ATOM 4919 H2 WAT 3810 69.580 18.740 132.494 1.00 0.00 H TER 4921 WAT 3810 ATOM 4921 O WAT 3811 49.304 106.813 100.651 1.00 0.00 O ATOM 4922 H1 WAT 3811 48.674 106.203 101.036 1.00 0.00 H ATOM 4923 H2 WAT 3811 48.779 107.370 100.077 1.00 0.00 H TER 4925 WAT 3811 ATOM 4925 O WAT 3812 83.135 98.252 97.027 1.00 0.00 O ATOM 4926 H1 WAT 3812 82.964 97.974 96.127 1.00 0.00 H ATOM 4927 H2 WAT 3812 84.054 98.519 97.025 1.00 0.00 H TER 4929 WAT 3812 ATOM 4929 O WAT 3813 141.670 59.004 4.375 1.00 0.00 O ATOM 4930 H1 WAT 3813 141.728 58.082 4.625 1.00 0.00 H ATOM 4931 H2 WAT 3813 142.009 59.480 5.134 1.00 0.00 H TER 4933 WAT 3813 ATOM 4933 O WAT 3814 34.693 76.796 126.066 1.00 0.00 O ATOM 4934 H1 WAT 3814 34.494 76.205 125.340 1.00 0.00 H ATOM 4935 H2 WAT 3814 33.903 77.326 126.168 1.00 0.00 H TER 4937 WAT 3814 ATOM 4937 O WAT 3815 41.290 39.484 153.590 1.00 0.00 O ATOM 4938 H1 WAT 3815 41.358 38.549 153.399 1.00 0.00 H ATOM 4939 H2 WAT 3815 41.329 39.907 152.732 1.00 0.00 H TER 4941 WAT 3815 ATOM 4941 O WAT 3816 29.842 64.493 120.965 1.00 0.00 O ATOM 4942 H1 WAT 3816 30.373 65.251 120.722 1.00 0.00 H ATOM 4943 H2 WAT 3816 30.468 63.867 121.328 1.00 0.00 H TER 4945 WAT 3816 ATOM 4945 O WAT 3817 88.632 49.539 11.362 1.00 0.00 O ATOM 4946 H1 WAT 3817 88.513 49.712 12.296 1.00 0.00 H ATOM 4947 H2 WAT 3817 89.224 48.788 11.331 1.00 0.00 H TER 4949 WAT 3817 ATOM 4949 O WAT 3818 121.136 61.263 61.504 1.00 0.00 O ATOM 4950 H1 WAT 3818 121.005 60.635 62.214 1.00 0.00 H ATOM 4951 H2 WAT 3818 120.264 61.621 61.336 1.00 0.00 H TER 4953 WAT 3818 ATOM 4953 O WAT 3819 14.003 123.517 149.894 1.00 0.00 O ATOM 4954 H1 WAT 3819 13.186 123.074 150.124 1.00 0.00 H ATOM 4955 H2 WAT 3819 14.602 123.299 150.608 1.00 0.00 H TER 4957 WAT 3819 ATOM 4957 O WAT 3820 123.612 11.683 99.478 1.00 0.00 O ATOM 4958 H1 WAT 3820 124.318 11.584 100.115 1.00 0.00 H ATOM 4959 H2 WAT 3820 124.031 12.085 98.717 1.00 0.00 H TER 4961 WAT 3820 ATOM 4961 O WAT 3821 83.422 128.587 128.719 1.00 0.00 O ATOM 4962 H1 WAT 3821 84.370 128.456 128.745 1.00 0.00 H ATOM 4963 H2 WAT 3821 83.302 129.512 128.931 1.00 0.00 H TER 4965 WAT 3821 ATOM 4965 O WAT 3822 136.945 35.410 77.556 1.00 0.00 O ATOM 4966 H1 WAT 3822 137.571 35.511 76.839 1.00 0.00 H ATOM 4967 H2 WAT 3822 136.933 36.266 77.985 1.00 0.00 H TER 4969 WAT 3822 ATOM 4969 O WAT 3823 31.227 65.742 20.611 1.00 0.00 O ATOM 4970 H1 WAT 3823 30.744 66.003 21.395 1.00 0.00 H ATOM 4971 H2 WAT 3823 30.562 65.370 20.033 1.00 0.00 H TER 4973 WAT 3823 ATOM 4973 O WAT 3824 37.283 4.621 16.570 1.00 0.00 O ATOM 4974 H1 WAT 3824 37.891 4.185 17.167 1.00 0.00 H ATOM 4975 H2 WAT 3824 37.534 5.544 16.605 1.00 0.00 H TER 4977 WAT 3824 ATOM 4977 O WAT 3825 111.057 18.418 137.726 1.00 0.00 O ATOM 4978 H1 WAT 3825 110.491 18.652 138.462 1.00 0.00 H ATOM 4979 H2 WAT 3825 110.680 18.881 136.978 1.00 0.00 H TER 4981 WAT 3825 ATOM 4981 O WAT 3826 14.840 105.315 101.191 1.00 0.00 O ATOM 4982 H1 WAT 3826 15.382 105.017 101.922 1.00 0.00 H ATOM 4983 H2 WAT 3826 14.289 104.561 100.979 1.00 0.00 H TER 4985 WAT 3826 ATOM 4985 O WAT 3827 109.673 89.711 9.234 1.00 0.00 O ATOM 4986 H1 WAT 3827 108.909 89.164 9.415 1.00 0.00 H ATOM 4987 H2 WAT 3827 110.348 89.094 8.952 1.00 0.00 H TER 4989 WAT 3827 ATOM 4989 O WAT 3828 26.921 131.892 136.948 1.00 0.00 O ATOM 4990 H1 WAT 3828 26.559 131.731 137.820 1.00 0.00 H ATOM 4991 H2 WAT 3828 26.917 131.034 136.525 1.00 0.00 H TER 4993 WAT 3828 ATOM 4993 O WAT 3829 131.053 61.905 134.259 1.00 0.00 O ATOM 4994 H1 WAT 3829 130.943 62.589 133.599 1.00 0.00 H ATOM 4995 H2 WAT 3829 131.873 61.472 134.021 1.00 0.00 H TER 4997 WAT 3829 ATOM 4997 O WAT 3830 25.655 77.301 108.823 1.00 0.00 O ATOM 4998 H1 WAT 3830 25.896 77.053 109.716 1.00 0.00 H ATOM 4999 H2 WAT 3830 25.888 78.227 108.761 1.00 0.00 H TER 5001 WAT 3830 ATOM 5001 O WAT 3831 129.394 119.437 129.551 1.00 0.00 O ATOM 5002 H1 WAT 3831 130.321 119.339 129.768 1.00 0.00 H ATOM 5003 H2 WAT 3831 129.018 119.891 130.304 1.00 0.00 H TER 5005 WAT 3831 ATOM 5005 O WAT 3832 76.816 81.606 72.887 1.00 0.00 O ATOM 5006 H1 WAT 3832 77.670 81.249 72.644 1.00 0.00 H ATOM 5007 H2 WAT 3832 76.833 82.508 72.566 1.00 0.00 H TER 5009 WAT 3832 ATOM 5009 O WAT 3833 116.988 20.843 17.678 1.00 0.00 O ATOM 5010 H1 WAT 3833 117.501 21.517 17.232 1.00 0.00 H ATOM 5011 H2 WAT 3833 117.634 20.335 18.169 1.00 0.00 H TER 5013 WAT 3833 ATOM 5013 O WAT 3834 101.150 124.732 72.451 1.00 0.00 O ATOM 5014 H1 WAT 3834 100.584 125.485 72.280 1.00 0.00 H ATOM 5015 H2 WAT 3834 100.819 124.366 73.272 1.00 0.00 H TER 5017 WAT 3834 ATOM 5017 O WAT 3835 15.059 17.805 87.890 1.00 0.00 O ATOM 5018 H1 WAT 3835 15.270 17.292 88.670 1.00 0.00 H ATOM 5019 H2 WAT 3835 15.453 17.315 87.168 1.00 0.00 H TER 5021 WAT 3835 ATOM 5021 O WAT 3836 46.035 108.994 110.200 1.00 0.00 O ATOM 5022 H1 WAT 3836 46.578 108.750 110.949 1.00 0.00 H ATOM 5023 H2 WAT 3836 45.506 108.217 110.023 1.00 0.00 H TER 5025 WAT 3836 ATOM 5025 O WAT 3837 123.127 81.651 82.568 1.00 0.00 O ATOM 5026 H1 WAT 3837 122.537 80.905 82.681 1.00 0.00 H ATOM 5027 H2 WAT 3837 123.947 81.264 82.262 1.00 0.00 H TER 5029 WAT 3837 ATOM 5029 O WAT 3838 119.339 121.980 158.789 1.00 0.00 O ATOM 5030 H1 WAT 3838 119.153 121.762 157.876 1.00 0.00 H ATOM 5031 H2 WAT 3838 118.723 122.683 158.998 1.00 0.00 H TER 5033 WAT 3838 ATOM 5033 O WAT 3839 48.173 15.594 12.482 1.00 0.00 O ATOM 5034 H1 WAT 3839 48.392 16.107 11.704 1.00 0.00 H ATOM 5035 H2 WAT 3839 48.988 15.556 12.982 1.00 0.00 H TER 5037 WAT 3839 ATOM 5037 O WAT 3840 115.431 107.963 73.266 1.00 0.00 O ATOM 5038 H1 WAT 3840 115.484 108.211 72.344 1.00 0.00 H ATOM 5039 H2 WAT 3840 115.120 107.057 73.253 1.00 0.00 H TER 5041 WAT 3840 ATOM 5041 O WAT 3841 119.510 82.506 20.917 1.00 0.00 O ATOM 5042 H1 WAT 3841 119.560 83.246 20.312 1.00 0.00 H ATOM 5043 H2 WAT 3841 120.279 82.605 21.479 1.00 0.00 H TER 5045 WAT 3841 ATOM 5045 O WAT 3842 49.675 122.908 141.301 1.00 0.00 O ATOM 5046 H1 WAT 3842 49.890 122.978 140.371 1.00 0.00 H ATOM 5047 H2 WAT 3842 48.771 123.217 141.361 1.00 0.00 H TER 5049 WAT 3842 ATOM 5049 O WAT 3843 50.551 96.299 8.706 1.00 0.00 O ATOM 5050 H1 WAT 3843 50.120 95.482 8.455 1.00 0.00 H ATOM 5051 H2 WAT 3843 50.897 96.128 9.583 1.00 0.00 H TER 5053 WAT 3843 ATOM 5053 O WAT 3844 12.685 55.507 80.850 1.00 0.00 O ATOM 5054 H1 WAT 3844 12.896 56.380 81.179 1.00 0.00 H ATOM 5055 H2 WAT 3844 13.365 55.325 80.201 1.00 0.00 H TER 5057 WAT 3844 ATOM 5057 O WAT 3845 123.121 138.544 25.826 1.00 0.00 O ATOM 5058 H1 WAT 3845 123.212 139.116 26.589 1.00 0.00 H ATOM 5059 H2 WAT 3845 123.152 139.139 25.077 1.00 0.00 H TER 5061 WAT 3845 ATOM 5061 O WAT 3846 140.238 81.576 82.234 1.00 0.00 O ATOM 5062 H1 WAT 3846 139.444 81.095 82.000 1.00 0.00 H ATOM 5063 H2 WAT 3846 140.858 81.370 81.534 1.00 0.00 H TER 5065 WAT 3846 ATOM 5065 O WAT 3847 18.218 124.775 136.504 1.00 0.00 O ATOM 5066 H1 WAT 3847 18.976 124.233 136.284 1.00 0.00 H ATOM 5067 H2 WAT 3847 17.653 124.720 135.733 1.00 0.00 H TER 5069 WAT 3847 ATOM 5069 O WAT 3848 98.029 77.603 107.575 1.00 0.00 O ATOM 5070 H1 WAT 3848 97.210 77.747 107.099 1.00 0.00 H ATOM 5071 H2 WAT 3848 98.263 78.466 107.915 1.00 0.00 H TER 5073 WAT 3848 ATOM 5073 O WAT 3849 85.868 42.738 65.186 1.00 0.00 O ATOM 5074 H1 WAT 3849 85.390 42.004 65.574 1.00 0.00 H ATOM 5075 H2 WAT 3849 85.185 43.312 64.839 1.00 0.00 H TER 5077 WAT 3849 ATOM 5077 O WAT 3850 27.729 131.356 109.809 1.00 0.00 O ATOM 5078 H1 WAT 3850 28.042 131.320 108.906 1.00 0.00 H ATOM 5079 H2 WAT 3850 27.398 130.475 109.983 1.00 0.00 H TER 5081 WAT 3850 ATOM 5081 O WAT 3851 39.275 77.969 67.884 1.00 0.00 O ATOM 5082 H1 WAT 3851 38.466 78.172 68.353 1.00 0.00 H ATOM 5083 H2 WAT 3851 39.039 78.036 66.959 1.00 0.00 H TER 5085 WAT 3851 ATOM 5085 O WAT 3852 88.309 72.050 80.259 1.00 0.00 O ATOM 5086 H1 WAT 3852 87.644 72.648 80.601 1.00 0.00 H ATOM 5087 H2 WAT 3852 88.992 72.624 79.912 1.00 0.00 H TER 5089 WAT 3852 ATOM 5089 O WAT 3853 67.156 34.594 133.407 1.00 0.00 O ATOM 5090 H1 WAT 3853 67.120 33.856 132.799 1.00 0.00 H ATOM 5091 H2 WAT 3853 66.271 34.650 133.768 1.00 0.00 H TER 5093 WAT 3853 ATOM 5093 O WAT 3854 5.369 38.257 1.484 1.00 0.00 O ATOM 5094 H1 WAT 3854 5.925 37.689 0.951 1.00 0.00 H ATOM 5095 H2 WAT 3854 4.476 38.011 1.245 1.00 0.00 H TER 5097 WAT 3854 ATOM 5097 O WAT 3855 136.432 84.783 133.205 1.00 0.00 O ATOM 5098 H1 WAT 3855 137.276 84.932 132.781 1.00 0.00 H ATOM 5099 H2 WAT 3855 135.850 85.437 132.819 1.00 0.00 H TER 5101 WAT 3855 ATOM 5101 O WAT 3856 112.472 132.262 148.958 1.00 0.00 O ATOM 5102 H1 WAT 3856 113.315 131.838 149.121 1.00 0.00 H ATOM 5103 H2 WAT 3856 112.691 133.040 148.445 1.00 0.00 H TER 5105 WAT 3856 ATOM 5105 O WAT 3857 36.215 93.646 61.808 1.00 0.00 O ATOM 5106 H1 WAT 3857 35.381 94.115 61.835 1.00 0.00 H ATOM 5107 H2 WAT 3857 36.341 93.435 60.883 1.00 0.00 H TER 5109 WAT 3857 ATOM 5109 O WAT 3858 49.680 79.580 156.905 1.00 0.00 O ATOM 5110 H1 WAT 3858 49.589 79.847 155.990 1.00 0.00 H ATOM 5111 H2 WAT 3858 50.549 79.180 156.952 1.00 0.00 H TER 5113 WAT 3858 ATOM 5113 O WAT 3859 43.841 1.003 76.137 1.00 0.00 O ATOM 5114 H1 WAT 3859 43.026 1.264 75.707 1.00 0.00 H ATOM 5115 H2 WAT 3859 44.420 1.757 76.028 1.00 0.00 H TER 5117 WAT 3859 ATOM 5117 O WAT 3860 79.034 60.467 72.937 1.00 0.00 O ATOM 5118 H1 WAT 3860 79.077 60.153 72.033 1.00 0.00 H ATOM 5119 H2 WAT 3860 78.185 60.161 73.256 1.00 0.00 H TER 5121 WAT 3860 ATOM 5121 O WAT 3861 15.548 108.092 153.519 1.00 0.00 O ATOM 5122 H1 WAT 3861 16.104 108.858 153.656 1.00 0.00 H ATOM 5123 H2 WAT 3861 16.038 107.367 153.908 1.00 0.00 H TER 5125 WAT 3861 ATOM 5125 O WAT 3862 62.264 74.169 148.056 1.00 0.00 O ATOM 5126 H1 WAT 3862 61.337 74.035 147.858 1.00 0.00 H ATOM 5127 H2 WAT 3862 62.452 73.543 148.756 1.00 0.00 H TER 5129 WAT 3862 ATOM 5129 O WAT 3863 117.818 122.927 136.347 1.00 0.00 O ATOM 5130 H1 WAT 3863 118.285 123.024 137.177 1.00 0.00 H ATOM 5131 H2 WAT 3863 117.670 121.985 136.265 1.00 0.00 H TER 5133 WAT 3863 ATOM 5133 O WAT 3864 134.293 117.582 142.499 1.00 0.00 O ATOM 5134 H1 WAT 3864 134.397 117.012 141.737 1.00 0.00 H ATOM 5135 H2 WAT 3864 135.118 117.496 142.976 1.00 0.00 H TER 5137 WAT 3864 ATOM 5137 O WAT 3865 31.620 1.183 120.023 1.00 0.00 O ATOM 5138 H1 WAT 3865 32.068 1.662 120.720 1.00 0.00 H ATOM 5139 H2 WAT 3865 30.689 1.339 120.184 1.00 0.00 H TER 5141 WAT 3865 ATOM 5141 O WAT 3866 71.834 140.066 99.458 1.00 0.00 O ATOM 5142 H1 WAT 3866 71.748 140.967 99.770 1.00 0.00 H ATOM 5143 H2 WAT 3866 71.249 139.561 100.023 1.00 0.00 H TER 5145 WAT 3866 ATOM 5145 O WAT 3867 90.667 9.818 124.870 1.00 0.00 O ATOM 5146 H1 WAT 3867 91.488 9.553 124.456 1.00 0.00 H ATOM 5147 H2 WAT 3867 89.985 9.466 124.298 1.00 0.00 H TER 5149 WAT 3867 ATOM 5149 O WAT 3868 12.859 3.210 152.658 1.00 0.00 O ATOM 5150 H1 WAT 3868 13.047 3.859 153.336 1.00 0.00 H ATOM 5151 H2 WAT 3868 11.942 2.975 152.799 1.00 0.00 H TER 5153 WAT 3868 ATOM 5153 O WAT 3869 13.611 126.102 30.654 1.00 0.00 O ATOM 5154 H1 WAT 3869 13.818 127.009 30.431 1.00 0.00 H ATOM 5155 H2 WAT 3869 13.801 126.035 31.589 1.00 0.00 H TER 5157 WAT 3869 ATOM 5157 O WAT 3870 5.650 88.531 19.540 1.00 0.00 O ATOM 5158 H1 WAT 3870 5.274 89.411 19.511 1.00 0.00 H ATOM 5159 H2 WAT 3870 6.485 88.642 19.994 1.00 0.00 H TER 5161 WAT 3870 ATOM 5161 O WAT 3871 9.743 139.742 12.590 1.00 0.00 O ATOM 5162 H1 WAT 3871 9.506 139.867 11.672 1.00 0.00 H ATOM 5163 H2 WAT 3871 8.935 139.445 13.008 1.00 0.00 H TER 5165 WAT 3871 ATOM 5165 O WAT 3872 76.843 130.819 2.534 1.00 0.00 O ATOM 5166 H1 WAT 3872 76.135 130.856 1.890 1.00 0.00 H ATOM 5167 H2 WAT 3872 77.061 129.890 2.597 1.00 0.00 H TER 5169 WAT 3872 ATOM 5169 O WAT 3873 132.173 104.516 119.384 1.00 0.00 O ATOM 5170 H1 WAT 3873 131.749 104.388 118.536 1.00 0.00 H ATOM 5171 H2 WAT 3873 133.032 104.106 119.288 1.00 0.00 H TER 5173 WAT 3873 ATOM 5173 O WAT 3874 54.194 74.309 87.512 1.00 0.00 O ATOM 5174 H1 WAT 3874 54.328 73.555 88.086 1.00 0.00 H ATOM 5175 H2 WAT 3874 54.846 74.948 87.800 1.00 0.00 H TER 5177 WAT 3874 ATOM 5177 O WAT 3875 12.780 125.365 119.914 1.00 0.00 O ATOM 5178 H1 WAT 3875 12.747 124.511 119.484 1.00 0.00 H ATOM 5179 H2 WAT 3875 12.002 125.823 119.598 1.00 0.00 H TER 5181 WAT 3875 ATOM 5181 O WAT 3876 120.961 102.929 72.930 1.00 0.00 O ATOM 5182 H1 WAT 3876 120.178 102.600 72.488 1.00 0.00 H ATOM 5183 H2 WAT 3876 120.663 103.149 73.812 1.00 0.00 H TER 5185 WAT 3876 ATOM 5185 O WAT 3877 120.915 84.355 144.994 1.00 0.00 O ATOM 5186 H1 WAT 3877 121.449 84.925 145.547 1.00 0.00 H ATOM 5187 H2 WAT 3877 120.141 84.878 144.787 1.00 0.00 H TER 5189 WAT 3877 ATOM 5189 O WAT 3878 74.842 123.249 55.361 1.00 0.00 O ATOM 5190 H1 WAT 3878 75.171 122.354 55.285 1.00 0.00 H ATOM 5191 H2 WAT 3878 75.563 123.797 55.050 1.00 0.00 H TER 5193 WAT 3878 ATOM 5193 O WAT 3879 82.583 85.707 64.363 1.00 0.00 O ATOM 5194 H1 WAT 3879 82.829 86.482 64.868 1.00 0.00 H ATOM 5195 H2 WAT 3879 81.810 85.365 64.812 1.00 0.00 H TER 5197 WAT 3879 ATOM 5197 O WAT 3880 119.146 39.355 114.144 1.00 0.00 O ATOM 5198 H1 WAT 3880 118.493 38.684 114.340 1.00 0.00 H ATOM 5199 H2 WAT 3880 119.939 39.055 114.588 1.00 0.00 H TER 5201 WAT 3880 ATOM 5201 O WAT 3881 39.182 97.530 122.407 1.00 0.00 O ATOM 5202 H1 WAT 3881 38.596 96.778 122.485 1.00 0.00 H ATOM 5203 H2 WAT 3881 38.624 98.236 122.080 1.00 0.00 H TER 5205 WAT 3881 ATOM 5205 O WAT 3882 84.500 44.170 77.657 1.00 0.00 O ATOM 5206 H1 WAT 3882 83.672 44.019 77.201 1.00 0.00 H ATOM 5207 H2 WAT 3882 85.100 44.466 76.972 1.00 0.00 H TER 5209 WAT 3882 ATOM 5209 O WAT 3883 69.866 76.647 23.365 1.00 0.00 O ATOM 5210 H1 WAT 3883 70.451 77.318 23.014 1.00 0.00 H ATOM 5211 H2 WAT 3883 69.947 75.915 22.754 1.00 0.00 H TER 5213 WAT 3883 ATOM 5213 O WAT 3884 37.867 68.193 110.671 1.00 0.00 O ATOM 5214 H1 WAT 3884 38.212 67.649 111.379 1.00 0.00 H ATOM 5215 H2 WAT 3884 38.354 67.913 109.895 1.00 0.00 H TER 5217 WAT 3884 ATOM 5217 O WAT 3885 85.969 90.578 84.355 1.00 0.00 O ATOM 5218 H1 WAT 3885 85.112 90.537 83.932 1.00 0.00 H ATOM 5219 H2 WAT 3885 85.773 90.714 85.282 1.00 0.00 H TER 5221 WAT 3885 ATOM 5221 O WAT 3886 55.189 113.067 141.921 1.00 0.00 O ATOM 5222 H1 WAT 3886 54.418 113.459 142.330 1.00 0.00 H ATOM 5223 H2 WAT 3886 55.645 112.629 142.640 1.00 0.00 H TER 5225 WAT 3886 ATOM 5225 O WAT 3887 49.792 99.343 70.797 1.00 0.00 O ATOM 5226 H1 WAT 3887 50.165 99.637 71.628 1.00 0.00 H ATOM 5227 H2 WAT 3887 50.050 98.423 70.731 1.00 0.00 H TER 5229 WAT 3887 ATOM 5229 O WAT 3888 125.239 136.728 99.223 1.00 0.00 O ATOM 5230 H1 WAT 3888 125.204 136.917 98.285 1.00 0.00 H ATOM 5231 H2 WAT 3888 124.700 135.944 99.330 1.00 0.00 H TER 5233 WAT 3888 ATOM 5233 O WAT 3889 88.296 93.095 109.664 1.00 0.00 O ATOM 5234 H1 WAT 3889 87.497 93.621 109.686 1.00 0.00 H ATOM 5235 H2 WAT 3889 88.406 92.865 108.741 1.00 0.00 H TER 5237 WAT 3889 ATOM 5237 O WAT 3890 104.103 103.271 146.581 1.00 0.00 O ATOM 5238 H1 WAT 3890 104.630 102.578 146.183 1.00 0.00 H ATOM 5239 H2 WAT 3890 103.515 102.811 147.180 1.00 0.00 H TER 5241 WAT 3890 ATOM 5241 O WAT 3891 57.268 20.911 16.714 1.00 0.00 O ATOM 5242 H1 WAT 3891 57.527 21.319 17.540 1.00 0.00 H ATOM 5243 H2 WAT 3891 56.463 20.437 16.923 1.00 0.00 H TER 5245 WAT 3891 ATOM 5245 O WAT 3892 91.302 27.410 158.059 1.00 0.00 O ATOM 5246 H1 WAT 3892 90.601 28.060 158.103 1.00 0.00 H ATOM 5247 H2 WAT 3892 90.850 26.567 158.097 1.00 0.00 H TER 5249 WAT 3892 ATOM 5249 O WAT 3893 131.340 1.615 11.453 1.00 0.00 O ATOM 5250 H1 WAT 3893 132.219 1.737 11.813 1.00 0.00 H ATOM 5251 H2 WAT 3893 130.924 2.473 11.543 1.00 0.00 H TER 5253 WAT 3893 ATOM 5253 O WAT 3894 106.449 37.788 18.083 1.00 0.00 O ATOM 5254 H1 WAT 3894 107.036 37.254 17.549 1.00 0.00 H ATOM 5255 H2 WAT 3894 106.629 37.515 18.983 1.00 0.00 H TER 5257 WAT 3894 ATOM 5257 O WAT 3895 63.777 105.778 97.912 1.00 0.00 O ATOM 5258 H1 WAT 3895 64.209 105.165 97.317 1.00 0.00 H ATOM 5259 H2 WAT 3895 63.347 106.409 97.335 1.00 0.00 H TER 5261 WAT 3895 ATOM 5261 O WAT 3896 5.866 125.540 154.983 1.00 0.00 O ATOM 5262 H1 WAT 3896 5.241 124.915 154.615 1.00 0.00 H ATOM 5263 H2 WAT 3896 5.557 125.689 155.877 1.00 0.00 H TER 5265 WAT 3896 ATOM 5265 O WAT 3897 141.540 28.661 91.615 1.00 0.00 O ATOM 5266 H1 WAT 3897 141.952 29.223 92.272 1.00 0.00 H ATOM 5267 H2 WAT 3897 141.499 27.799 92.029 1.00 0.00 H TER 5269 WAT 3897 ATOM 5269 O WAT 3898 86.080 42.775 114.773 1.00 0.00 O ATOM 5270 H1 WAT 3898 86.164 42.973 115.706 1.00 0.00 H ATOM 5271 H2 WAT 3898 85.222 42.358 114.694 1.00 0.00 H TER 5273 WAT 3898 ATOM 5273 O WAT 3899 115.064 100.977 29.513 1.00 0.00 O ATOM 5274 H1 WAT 3899 115.626 100.560 28.860 1.00 0.00 H ATOM 5275 H2 WAT 3899 115.205 101.915 29.386 1.00 0.00 H TER 5277 WAT 3899 ATOM 5277 O WAT 3900 120.902 137.872 1.200 1.00 0.00 O ATOM 5278 H1 WAT 3900 120.054 138.273 1.390 1.00 0.00 H ATOM 5279 H2 WAT 3900 120.897 137.055 1.699 1.00 0.00 H TER 5281 WAT 3900 ATOM 5281 O WAT 3901 18.574 142.663 122.767 1.00 0.00 O ATOM 5282 H1 WAT 3901 18.374 142.236 121.934 1.00 0.00 H ATOM 5283 H2 WAT 3901 17.749 143.071 123.031 1.00 0.00 H TER 5285 WAT 3901 ATOM 5285 O WAT 3902 3.499 61.209 9.018 1.00 0.00 O ATOM 5286 H1 WAT 3902 4.324 60.904 9.394 1.00 0.00 H ATOM 5287 H2 WAT 3902 2.882 60.496 9.182 1.00 0.00 H TER 5289 WAT 3902 ATOM 5289 O WAT 3903 59.248 43.238 54.515 1.00 0.00 O ATOM 5290 H1 WAT 3903 58.786 42.623 53.945 1.00 0.00 H ATOM 5291 H2 WAT 3903 58.564 43.609 55.073 1.00 0.00 H TER 5293 WAT 3903 ATOM 5293 O WAT 3904 78.636 145.547 84.496 1.00 0.00 O ATOM 5294 H1 WAT 3904 79.184 145.335 83.741 1.00 0.00 H ATOM 5295 H2 WAT 3904 78.174 144.732 84.693 1.00 0.00 H TER 5297 WAT 3904 ATOM 5297 O WAT 3905 126.558 105.718 70.197 1.00 0.00 O ATOM 5298 H1 WAT 3905 126.883 105.164 70.907 1.00 0.00 H ATOM 5299 H2 WAT 3905 127.203 106.421 70.127 1.00 0.00 H TER 5301 WAT 3905 ATOM 5301 O WAT 3906 67.794 43.828 143.603 1.00 0.00 O ATOM 5302 H1 WAT 3906 68.509 43.923 144.233 1.00 0.00 H ATOM 5303 H2 WAT 3906 67.049 44.263 144.019 1.00 0.00 H TER 5305 WAT 3906 ATOM 5305 O WAT 3907 54.235 40.902 157.758 1.00 0.00 O ATOM 5306 H1 WAT 3907 54.347 41.720 157.273 1.00 0.00 H ATOM 5307 H2 WAT 3907 54.585 41.090 158.629 1.00 0.00 H TER 5309 WAT 3907 ATOM 5309 O WAT 3908 117.649 63.465 5.146 1.00 0.00 O ATOM 5310 H1 WAT 3908 117.212 63.520 4.297 1.00 0.00 H ATOM 5311 H2 WAT 3908 117.056 62.942 5.687 1.00 0.00 H TER 5313 WAT 3908 ATOM 5313 O WAT 3909 62.026 69.961 146.247 1.00 0.00 O ATOM 5314 H1 WAT 3909 62.147 69.368 145.506 1.00 0.00 H ATOM 5315 H2 WAT 3909 62.821 70.494 146.260 1.00 0.00 H TER 5317 WAT 3909 ATOM 5317 O WAT 3910 141.142 89.199 66.869 1.00 0.00 O ATOM 5318 H1 WAT 3910 141.631 89.489 67.639 1.00 0.00 H ATOM 5319 H2 WAT 3910 141.814 88.895 66.259 1.00 0.00 H TER 5321 WAT 3910 ATOM 5321 O WAT 3911 109.272 117.131 127.201 1.00 0.00 O ATOM 5322 H1 WAT 3911 109.927 117.602 126.685 1.00 0.00 H ATOM 5323 H2 WAT 3911 109.783 116.544 127.758 1.00 0.00 H TER 5325 WAT 3911 ATOM 5325 O WAT 3912 29.729 68.178 115.858 1.00 0.00 O ATOM 5326 H1 WAT 3912 29.103 67.609 116.305 1.00 0.00 H ATOM 5327 H2 WAT 3912 29.523 69.057 116.174 1.00 0.00 H TER 5329 WAT 3912 ATOM 5329 O WAT 3913 142.959 57.219 151.322 1.00 0.00 O ATOM 5330 H1 WAT 3913 142.989 58.156 151.515 1.00 0.00 H ATOM 5331 H2 WAT 3913 142.453 57.158 150.512 1.00 0.00 H TER 5333 WAT 3913 ATOM 5333 O WAT 3914 61.730 34.758 145.669 1.00 0.00 O ATOM 5334 H1 WAT 3914 62.278 34.371 144.986 1.00 0.00 H ATOM 5335 H2 WAT 3914 60.979 34.168 145.736 1.00 0.00 H TER 5337 WAT 3914 ATOM 5337 O WAT 3915 28.161 141.495 75.168 1.00 0.00 O ATOM 5338 H1 WAT 3915 28.807 141.184 75.803 1.00 0.00 H ATOM 5339 H2 WAT 3915 27.482 141.909 75.701 1.00 0.00 H TER 5341 WAT 3915 ATOM 5341 O WAT 3916 137.568 111.843 20.317 1.00 0.00 O ATOM 5342 H1 WAT 3916 137.025 111.628 21.076 1.00 0.00 H ATOM 5343 H2 WAT 3916 138.383 112.177 20.693 1.00 0.00 H TER 5345 WAT 3916 ATOM 5345 O WAT 3917 82.880 35.144 144.178 1.00 0.00 O ATOM 5346 H1 WAT 3917 82.522 35.613 144.932 1.00 0.00 H ATOM 5347 H2 WAT 3917 82.500 34.268 144.238 1.00 0.00 H TER 5349 WAT 3917 ATOM 5349 O WAT 3918 27.565 138.273 136.079 1.00 0.00 O ATOM 5350 H1 WAT 3918 27.577 138.186 135.126 1.00 0.00 H ATOM 5351 H2 WAT 3918 27.622 137.373 136.402 1.00 0.00 H TER 5353 WAT 3918 ATOM 5353 O WAT 3919 39.686 24.005 111.523 1.00 0.00 O ATOM 5354 H1 WAT 3919 39.035 23.757 110.866 1.00 0.00 H ATOM 5355 H2 WAT 3919 39.283 24.734 111.994 1.00 0.00 H TER 5357 WAT 3919 ATOM 5357 O WAT 3920 35.948 1.594 73.724 1.00 0.00 O ATOM 5358 H1 WAT 3920 35.317 1.278 73.076 1.00 0.00 H ATOM 5359 H2 WAT 3920 36.789 1.246 73.428 1.00 0.00 H TER 5361 WAT 3920 ATOM 5361 O WAT 3921 32.384 135.630 143.830 1.00 0.00 O ATOM 5362 H1 WAT 3921 31.989 135.169 143.090 1.00 0.00 H ATOM 5363 H2 WAT 3921 32.972 134.988 144.227 1.00 0.00 H TER 5365 WAT 3921 ATOM 5365 O WAT 3922 68.106 72.758 117.803 1.00 0.00 O ATOM 5366 H1 WAT 3922 67.332 72.991 118.316 1.00 0.00 H ATOM 5367 H2 WAT 3922 67.797 72.086 117.196 1.00 0.00 H TER 5369 WAT 3922 ATOM 5369 O WAT 3923 124.653 42.646 8.431 1.00 0.00 O ATOM 5370 H1 WAT 3923 124.798 41.992 9.115 1.00 0.00 H ATOM 5371 H2 WAT 3923 124.510 42.133 7.636 1.00 0.00 H TER 5373 WAT 3923 ATOM 5373 O WAT 3924 87.819 20.812 3.352 1.00 0.00 O ATOM 5374 H1 WAT 3924 87.530 20.990 2.457 1.00 0.00 H ATOM 5375 H2 WAT 3924 88.376 21.558 3.576 1.00 0.00 H TER 5377 WAT 3924 ATOM 5377 O WAT 3925 22.714 45.756 100.058 1.00 0.00 O ATOM 5378 H1 WAT 3925 23.140 45.124 100.637 1.00 0.00 H ATOM 5379 H2 WAT 3925 22.789 46.592 100.518 1.00 0.00 H TER 5381 WAT 3925 ATOM 5381 O WAT 3926 69.244 19.156 65.295 1.00 0.00 O ATOM 5382 H1 WAT 3926 68.571 19.073 65.970 1.00 0.00 H ATOM 5383 H2 WAT 3926 69.404 20.097 65.229 1.00 0.00 H TER 5385 WAT 3926 ATOM 5385 O WAT 3927 53.593 113.407 100.334 1.00 0.00 O ATOM 5386 H1 WAT 3927 53.513 114.351 100.467 1.00 0.00 H ATOM 5387 H2 WAT 3927 54.260 113.133 100.964 1.00 0.00 H TER 5389 WAT 3927 ATOM 5389 O WAT 3928 11.348 80.699 67.805 1.00 0.00 O ATOM 5390 H1 WAT 3928 10.911 79.864 67.640 1.00 0.00 H ATOM 5391 H2 WAT 3928 10.767 81.157 68.413 1.00 0.00 H TER 5393 WAT 3928 ATOM 5393 O WAT 3929 102.947 16.263 146.244 1.00 0.00 O ATOM 5394 H1 WAT 3929 103.811 16.366 146.645 1.00 0.00 H ATOM 5395 H2 WAT 3929 102.661 17.157 146.060 1.00 0.00 H TER 5397 WAT 3929 ATOM 5397 O WAT 3930 81.536 18.249 14.684 1.00 0.00 O ATOM 5398 H1 WAT 3930 82.148 17.813 14.091 1.00 0.00 H ATOM 5399 H2 WAT 3930 80.681 18.141 14.268 1.00 0.00 H TER 5401 WAT 3930 ATOM 5401 O WAT 3931 13.387 81.443 103.977 1.00 0.00 O ATOM 5402 H1 WAT 3931 12.810 80.863 104.474 1.00 0.00 H ATOM 5403 H2 WAT 3931 12.911 81.613 103.163 1.00 0.00 H TER 5405 WAT 3931 ATOM 5405 O WAT 3932 67.985 28.318 113.167 1.00 0.00 O ATOM 5406 H1 WAT 3932 68.573 28.951 113.578 1.00 0.00 H ATOM 5407 H2 WAT 3932 68.048 27.538 113.719 1.00 0.00 H TER 5409 WAT 3932 ATOM 5409 O WAT 3933 25.669 79.596 154.924 1.00 0.00 O ATOM 5410 H1 WAT 3933 26.257 80.235 155.325 1.00 0.00 H ATOM 5411 H2 WAT 3933 26.080 78.749 155.099 1.00 0.00 H TER 5413 WAT 3933 ATOM 5413 O WAT 3934 65.243 137.509 116.735 1.00 0.00 O ATOM 5414 H1 WAT 3934 64.294 137.392 116.704 1.00 0.00 H ATOM 5415 H2 WAT 3934 65.392 138.361 116.326 1.00 0.00 H TER 5417 WAT 3934 ATOM 5417 O WAT 3935 10.073 93.469 4.811 1.00 0.00 O ATOM 5418 H1 WAT 3935 10.255 92.716 5.373 1.00 0.00 H ATOM 5419 H2 WAT 3935 10.629 94.167 5.158 1.00 0.00 H TER 5421 WAT 3935 ATOM 5421 O WAT 3936 144.647 83.558 67.589 1.00 0.00 O ATOM 5422 H1 WAT 3936 144.324 84.448 67.442 1.00 0.00 H ATOM 5423 H2 WAT 3936 143.961 82.993 67.233 1.00 0.00 H TER 5425 WAT 3936 ATOM 5425 O WAT 3937 7.446 13.436 15.662 1.00 0.00 O ATOM 5426 H1 WAT 3937 6.739 12.791 15.675 1.00 0.00 H ATOM 5427 H2 WAT 3937 7.069 14.213 16.075 1.00 0.00 H TER 5429 WAT 3937 ATOM 5429 O WAT 3938 30.042 9.920 91.957 1.00 0.00 O ATOM 5430 H1 WAT 3938 29.766 10.720 92.404 1.00 0.00 H ATOM 5431 H2 WAT 3938 30.054 10.157 91.029 1.00 0.00 H TER 5433 WAT 3938 ATOM 5433 O WAT 3939 9.093 117.142 69.947 1.00 0.00 O ATOM 5434 H1 WAT 3939 9.354 116.223 70.009 1.00 0.00 H ATOM 5435 H2 WAT 3939 9.584 117.577 70.643 1.00 0.00 H TER 5437 WAT 3939 ATOM 5437 O WAT 3940 69.956 71.858 101.744 1.00 0.00 O ATOM 5438 H1 WAT 3940 70.352 72.439 101.094 1.00 0.00 H ATOM 5439 H2 WAT 3940 69.329 71.334 101.246 1.00 0.00 H TER 5441 WAT 3940 ATOM 5441 O WAT 3941 109.435 72.037 11.031 1.00 0.00 O ATOM 5442 H1 WAT 3941 110.009 71.554 11.626 1.00 0.00 H ATOM 5443 H2 WAT 3941 109.899 72.032 10.194 1.00 0.00 H TER 5445 WAT 3941 ATOM 5445 O WAT 3942 19.817 71.185 65.518 1.00 0.00 O ATOM 5446 H1 WAT 3942 20.094 70.822 64.676 1.00 0.00 H ATOM 5447 H2 WAT 3942 20.435 71.896 65.687 1.00 0.00 H TER 5449 WAT 3942 ATOM 5449 O WAT 3943 85.998 110.024 28.414 1.00 0.00 O ATOM 5450 H1 WAT 3943 86.936 109.905 28.565 1.00 0.00 H ATOM 5451 H2 WAT 3943 85.705 110.564 29.148 1.00 0.00 H TER 5453 WAT 3943 ATOM 5453 O WAT 3944 63.985 126.260 64.878 1.00 0.00 O ATOM 5454 H1 WAT 3944 64.824 126.709 64.775 1.00 0.00 H ATOM 5455 H2 WAT 3944 64.204 125.445 65.330 1.00 0.00 H TER 5457 WAT 3944 ATOM 5457 O WAT 3945 44.063 130.697 147.031 1.00 0.00 O ATOM 5458 H1 WAT 3945 45.018 130.755 147.024 1.00 0.00 H ATOM 5459 H2 WAT 3945 43.806 130.860 146.124 1.00 0.00 H TER 5461 WAT 3945 ATOM 5461 O WAT 3946 82.104 141.142 99.563 1.00 0.00 O ATOM 5462 H1 WAT 3946 82.036 141.339 100.497 1.00 0.00 H ATOM 5463 H2 WAT 3946 82.272 141.990 99.151 1.00 0.00 H TER 5465 WAT 3946 ATOM 5465 O WAT 3947 121.375 72.760 111.488 1.00 0.00 O ATOM 5466 H1 WAT 3947 122.203 72.311 111.663 1.00 0.00 H ATOM 5467 H2 WAT 3947 121.347 73.469 112.131 1.00 0.00 H TER 5469 WAT 3947 ATOM 5469 O WAT 3948 60.237 111.306 124.580 1.00 0.00 O ATOM 5470 H1 WAT 3948 60.464 110.674 125.262 1.00 0.00 H ATOM 5471 H2 WAT 3948 60.794 111.070 123.839 1.00 0.00 H TER 5473 WAT 3948 ATOM 5473 O WAT 3949 11.583 10.137 120.460 1.00 0.00 O ATOM 5474 H1 WAT 3949 12.131 10.238 119.682 1.00 0.00 H ATOM 5475 H2 WAT 3949 12.051 10.614 121.146 1.00 0.00 H TER 5477 WAT 3949 ATOM 5477 O WAT 3950 119.699 40.061 133.546 1.00 0.00 O ATOM 5478 H1 WAT 3950 119.637 39.115 133.675 1.00 0.00 H ATOM 5479 H2 WAT 3950 119.722 40.173 132.596 1.00 0.00 H TER 5481 WAT 3950 ATOM 5481 O WAT 3951 62.710 107.247 69.334 1.00 0.00 O ATOM 5482 H1 WAT 3951 62.362 107.502 68.479 1.00 0.00 H ATOM 5483 H2 WAT 3951 63.590 107.622 69.355 1.00 0.00 H TER 5485 WAT 3951 ATOM 5485 O WAT 3952 96.972 120.741 147.824 1.00 0.00 O ATOM 5486 H1 WAT 3952 96.753 120.442 148.707 1.00 0.00 H ATOM 5487 H2 WAT 3952 96.667 120.038 147.250 1.00 0.00 H TER 5489 WAT 3952 ATOM 5489 O WAT 3953 116.091 30.552 114.091 1.00 0.00 O ATOM 5490 H1 WAT 3953 116.612 30.793 114.858 1.00 0.00 H ATOM 5491 H2 WAT 3953 116.585 29.842 113.680 1.00 0.00 H TER 5493 WAT 3953 ATOM 5493 O WAT 3954 128.120 73.230 8.730 1.00 0.00 O ATOM 5494 H1 WAT 3954 127.371 72.637 8.678 1.00 0.00 H ATOM 5495 H2 WAT 3954 127.760 74.090 8.516 1.00 0.00 H TER 5497 WAT 3954 ATOM 5497 O WAT 3955 28.482 43.820 97.932 1.00 0.00 O ATOM 5498 H1 WAT 3955 28.072 42.988 98.170 1.00 0.00 H ATOM 5499 H2 WAT 3955 29.156 43.954 98.598 1.00 0.00 H TER 5501 WAT 3955 ATOM 5501 O WAT 3956 16.877 77.231 74.375 1.00 0.00 O ATOM 5502 H1 WAT 3956 17.711 77.656 74.574 1.00 0.00 H ATOM 5503 H2 WAT 3956 16.926 76.385 74.820 1.00 0.00 H TER 5505 WAT 3956 ATOM 5505 O WAT 3957 138.897 48.695 11.314 1.00 0.00 O ATOM 5506 H1 WAT 3957 139.271 47.921 10.893 1.00 0.00 H ATOM 5507 H2 WAT 3957 138.460 48.356 12.095 1.00 0.00 H TER 5509 WAT 3957 ATOM 5509 O WAT 3958 110.863 70.889 116.517 1.00 0.00 O ATOM 5510 H1 WAT 3958 111.544 71.506 116.248 1.00 0.00 H ATOM 5511 H2 WAT 3958 110.311 70.789 115.741 1.00 0.00 H TER 5513 WAT 3958 ATOM 5513 O WAT 3959 26.788 7.326 149.476 1.00 0.00 O ATOM 5514 H1 WAT 3959 25.934 7.753 149.412 1.00 0.00 H ATOM 5515 H2 WAT 3959 27.406 7.974 149.136 1.00 0.00 H TER 5517 WAT 3959 ATOM 5517 O WAT 3960 103.301 112.593 124.920 1.00 0.00 O ATOM 5518 H1 WAT 3960 104.141 112.523 125.373 1.00 0.00 H ATOM 5519 H2 WAT 3960 102.692 112.094 125.465 1.00 0.00 H TER 5521 WAT 3960 ATOM 5521 O WAT 3961 98.520 56.815 6.480 1.00 0.00 O ATOM 5522 H1 WAT 3961 98.317 57.716 6.732 1.00 0.00 H ATOM 5523 H2 WAT 3961 97.986 56.277 7.065 1.00 0.00 H TER 5525 WAT 3961 ATOM 5525 O WAT 3962 120.943 118.584 142.766 1.00 0.00 O ATOM 5526 H1 WAT 3962 121.172 119.253 143.412 1.00 0.00 H ATOM 5527 H2 WAT 3962 120.011 118.423 142.907 1.00 0.00 H TER 5529 WAT 3962 ATOM 5529 O WAT 3963 50.230 11.163 124.855 1.00 0.00 O ATOM 5530 H1 WAT 3963 49.985 10.717 124.044 1.00 0.00 H ATOM 5531 H2 WAT 3963 51.060 10.760 125.109 1.00 0.00 H TER 5533 WAT 3963 ATOM 5533 O WAT 3964 63.194 78.612 68.977 1.00 0.00 O ATOM 5534 H1 WAT 3964 62.722 78.242 68.231 1.00 0.00 H ATOM 5535 H2 WAT 3964 62.901 79.523 69.017 1.00 0.00 H TER 5537 WAT 3964 ATOM 5537 O WAT 3965 96.318 9.931 148.459 1.00 0.00 O ATOM 5538 H1 WAT 3965 97.171 9.961 148.892 1.00 0.00 H ATOM 5539 H2 WAT 3965 95.934 9.102 148.742 1.00 0.00 H TER 5541 WAT 3965 ATOM 5541 O WAT 3966 86.672 61.171 80.384 1.00 0.00 O ATOM 5542 H1 WAT 3966 86.140 60.873 79.646 1.00 0.00 H ATOM 5543 H2 WAT 3966 86.393 62.074 80.532 1.00 0.00 H TER 5545 WAT 3966 ATOM 5545 O WAT 3967 28.715 31.810 82.186 1.00 0.00 O ATOM 5546 H1 WAT 3967 29.244 31.017 82.263 1.00 0.00 H ATOM 5547 H2 WAT 3967 29.279 32.508 82.518 1.00 0.00 H TER 5549 WAT 3967 ATOM 5549 O WAT 3968 127.930 73.415 78.131 1.00 0.00 O ATOM 5550 H1 WAT 3968 127.876 73.824 77.267 1.00 0.00 H ATOM 5551 H2 WAT 3968 128.858 73.204 78.238 1.00 0.00 H TER 5553 WAT 3968 ATOM 5553 O WAT 3969 16.439 143.953 123.919 1.00 0.00 O ATOM 5554 H1 WAT 3969 15.666 143.459 123.645 1.00 0.00 H ATOM 5555 H2 WAT 3969 16.196 144.870 123.789 1.00 0.00 H TER 5557 WAT 3969 ATOM 5557 O WAT 3970 96.312 122.945 21.870 1.00 0.00 O ATOM 5558 H1 WAT 3970 95.996 122.874 22.770 1.00 0.00 H ATOM 5559 H2 WAT 3970 97.240 122.715 21.922 1.00 0.00 H TER 5561 WAT 3970 ATOM 5561 O WAT 3971 118.323 37.229 90.981 1.00 0.00 O ATOM 5562 H1 WAT 3971 118.073 36.744 90.194 1.00 0.00 H ATOM 5563 H2 WAT 3971 118.929 36.646 91.439 1.00 0.00 H TER 5565 WAT 3971 ATOM 5565 O WAT 3972 31.460 99.733 99.235 1.00 0.00 O ATOM 5566 H1 WAT 3972 30.959 99.821 100.046 1.00 0.00 H ATOM 5567 H2 WAT 3972 31.967 98.929 99.352 1.00 0.00 H TER 5569 WAT 3972 ATOM 5569 O WAT 3973 43.626 136.537 65.592 1.00 0.00 O ATOM 5570 H1 WAT 3973 43.043 135.923 66.037 1.00 0.00 H ATOM 5571 H2 WAT 3973 44.364 136.001 65.303 1.00 0.00 H TER 5573 WAT 3973 ATOM 5573 O WAT 3974 3.198 51.371 113.094 1.00 0.00 O ATOM 5574 H1 WAT 3974 3.902 51.933 112.772 1.00 0.00 H ATOM 5575 H2 WAT 3974 3.596 50.503 113.162 1.00 0.00 H TER 5577 WAT 3974 ATOM 5577 O WAT 3975 84.320 80.524 115.178 1.00 0.00 O ATOM 5578 H1 WAT 3975 83.487 80.943 114.961 1.00 0.00 H ATOM 5579 H2 WAT 3975 84.175 80.134 116.040 1.00 0.00 H TER 5581 WAT 3975 ATOM 5581 O WAT 3976 133.265 77.098 105.535 1.00 0.00 O ATOM 5582 H1 WAT 3976 132.676 77.108 104.780 1.00 0.00 H ATOM 5583 H2 WAT 3976 133.101 77.931 105.977 1.00 0.00 H TER 5585 WAT 3976 ATOM 5585 O WAT 3977 27.873 79.646 2.379 1.00 0.00 O ATOM 5586 H1 WAT 3977 26.996 79.287 2.507 1.00 0.00 H ATOM 5587 H2 WAT 3977 27.930 79.809 1.437 1.00 0.00 H TER 5589 WAT 3977 ATOM 5589 O WAT 3978 20.688 84.975 125.856 1.00 0.00 O ATOM 5590 H1 WAT 3978 20.559 85.066 126.800 1.00 0.00 H ATOM 5591 H2 WAT 3978 21.609 85.196 125.718 1.00 0.00 H TER 5593 WAT 3978 ATOM 5593 O WAT 3979 145.171 112.732 1.782 1.00 0.00 O ATOM 5594 H1 WAT 3979 145.760 112.808 2.533 1.00 0.00 H ATOM 5595 H2 WAT 3979 144.391 113.224 2.039 1.00 0.00 H TER 5597 WAT 3979 ATOM 5597 O WAT 3980 10.120 76.422 18.580 1.00 0.00 O ATOM 5598 H1 WAT 3980 10.419 75.518 18.476 1.00 0.00 H ATOM 5599 H2 WAT 3980 9.802 76.467 19.482 1.00 0.00 H TER 5601 WAT 3980 ATOM 5601 O WAT 3981 132.058 53.105 81.950 1.00 0.00 O ATOM 5602 H1 WAT 3981 131.709 53.552 81.180 1.00 0.00 H ATOM 5603 H2 WAT 3981 132.898 52.748 81.660 1.00 0.00 H TER 5605 WAT 3981 ATOM 5605 O WAT 3982 123.059 66.666 149.282 1.00 0.00 O ATOM 5606 H1 WAT 3982 123.885 66.806 148.818 1.00 0.00 H ATOM 5607 H2 WAT 3982 123.304 66.652 150.207 1.00 0.00 H TER 5609 WAT 3982 ATOM 5609 O WAT 3983 110.000 78.579 21.225 1.00 0.00 O ATOM 5610 H1 WAT 3983 109.799 79.233 21.895 1.00 0.00 H ATOM 5611 H2 WAT 3983 110.045 77.751 21.704 1.00 0.00 H TER 5613 WAT 3983 ATOM 5613 O WAT 3984 136.564 101.427 128.868 1.00 0.00 O ATOM 5614 H1 WAT 3984 137.447 101.738 128.666 1.00 0.00 H ATOM 5615 H2 WAT 3984 136.492 101.510 129.818 1.00 0.00 H TER 5617 WAT 3984 ATOM 5617 O WAT 3985 59.876 54.622 115.482 1.00 0.00 O ATOM 5618 H1 WAT 3985 59.941 54.972 114.593 1.00 0.00 H ATOM 5619 H2 WAT 3985 60.564 53.958 115.529 1.00 0.00 H TER 5621 WAT 3985 ATOM 5621 O WAT 3986 29.941 54.909 95.499 1.00 0.00 O ATOM 5622 H1 WAT 3986 29.795 55.849 95.605 1.00 0.00 H ATOM 5623 H2 WAT 3986 30.864 54.784 95.720 1.00 0.00 H TER 5625 WAT 3986 ATOM 5625 O WAT 3987 63.858 121.238 138.365 1.00 0.00 O ATOM 5626 H1 WAT 3987 64.127 120.322 138.426 1.00 0.00 H ATOM 5627 H2 WAT 3987 63.337 121.282 137.564 1.00 0.00 H TER 5629 WAT 3987 ATOM 5629 O WAT 3988 31.385 113.109 94.852 1.00 0.00 O ATOM 5630 H1 WAT 3988 31.091 113.554 95.647 1.00 0.00 H ATOM 5631 H2 WAT 3988 32.295 113.386 94.746 1.00 0.00 H TER 5633 WAT 3988 ATOM 5633 O WAT 3989 105.073 137.616 92.465 1.00 0.00 O ATOM 5634 H1 WAT 3989 104.302 137.277 92.011 1.00 0.00 H ATOM 5635 H2 WAT 3989 105.803 137.419 91.879 1.00 0.00 H TER 5637 WAT 3989 ATOM 5637 O WAT 3990 36.684 62.388 126.224 1.00 0.00 O ATOM 5638 H1 WAT 3990 37.479 62.323 125.695 1.00 0.00 H ATOM 5639 H2 WAT 3990 36.705 61.613 126.785 1.00 0.00 H TER 5641 WAT 3990 ATOM 5641 O WAT 3991 111.287 126.907 103.864 1.00 0.00 O ATOM 5642 H1 WAT 3991 112.042 127.262 103.394 1.00 0.00 H ATOM 5643 H2 WAT 3991 110.531 127.317 103.444 1.00 0.00 H TER 5645 WAT 3991 ATOM 5645 O WAT 3992 84.312 128.224 142.833 1.00 0.00 O ATOM 5646 H1 WAT 3992 84.597 129.003 142.354 1.00 0.00 H ATOM 5647 H2 WAT 3992 83.410 128.417 143.089 1.00 0.00 H TER 5649 WAT 3992 ATOM 5649 O WAT 3993 59.873 119.734 131.399 1.00 0.00 O ATOM 5650 H1 WAT 3993 59.150 119.850 132.017 1.00 0.00 H ATOM 5651 H2 WAT 3993 60.219 120.616 131.268 1.00 0.00 H TER 5653 WAT 3993 ATOM 5653 O WAT 3994 77.078 38.868 123.076 1.00 0.00 O ATOM 5654 H1 WAT 3994 77.182 38.497 123.953 1.00 0.00 H ATOM 5655 H2 WAT 3994 76.969 39.807 123.225 1.00 0.00 H TER 5657 WAT 3994 ATOM 5657 O WAT 3995 100.380 35.397 127.266 1.00 0.00 O ATOM 5658 H1 WAT 3995 100.019 35.826 128.042 1.00 0.00 H ATOM 5659 H2 WAT 3995 101.279 35.179 127.510 1.00 0.00 H TER 5661 WAT 3995 ATOM 5661 O WAT 3996 15.491 91.609 8.607 1.00 0.00 O ATOM 5662 H1 WAT 3996 16.196 91.994 9.128 1.00 0.00 H ATOM 5663 H2 WAT 3996 15.091 92.353 8.157 1.00 0.00 H TER 5665 WAT 3996 ATOM 5665 O WAT 3997 74.052 69.043 105.930 1.00 0.00 O ATOM 5666 H1 WAT 3997 74.608 68.828 106.680 1.00 0.00 H ATOM 5667 H2 WAT 3997 73.697 68.201 105.646 1.00 0.00 H TER 5669 WAT 3997 ATOM 5669 O WAT 3998 72.070 50.346 134.423 1.00 0.00 O ATOM 5670 H1 WAT 3998 72.390 51.215 134.182 1.00 0.00 H ATOM 5671 H2 WAT 3998 72.508 49.751 133.814 1.00 0.00 H TER 5673 WAT 3998 ATOM 5673 O WAT 3999 91.479 101.149 18.414 1.00 0.00 O ATOM 5674 H1 WAT 3999 91.591 101.893 17.822 1.00 0.00 H ATOM 5675 H2 WAT 3999 92.365 100.809 18.540 1.00 0.00 H TER 5677 WAT 3999 ATOM 5677 O WAT 4000 73.694 80.379 107.613 1.00 0.00 O ATOM 5678 H1 WAT 4000 72.777 80.102 107.605 1.00 0.00 H ATOM 5679 H2 WAT 4000 74.104 79.871 106.913 1.00 0.00 H TER 5681 WAT 4000 ATOM 5681 O WAT 4001 133.169 54.171 101.060 1.00 0.00 O ATOM 5682 H1 WAT 4001 132.805 54.606 101.831 1.00 0.00 H ATOM 5683 H2 WAT 4001 133.781 53.526 101.414 1.00 0.00 H TER 5685 WAT 4001 ATOM 5685 O WAT 4002 45.918 37.737 133.725 1.00 0.00 O ATOM 5686 H1 WAT 4002 45.190 38.114 133.232 1.00 0.00 H ATOM 5687 H2 WAT 4002 46.566 37.508 133.059 1.00 0.00 H TER 5689 WAT 4002 ATOM 5689 O WAT 4003 6.358 28.844 62.846 1.00 0.00 O ATOM 5690 H1 WAT 4003 6.676 29.125 61.988 1.00 0.00 H ATOM 5691 H2 WAT 4003 6.806 28.014 63.007 1.00 0.00 H TER 5693 WAT 4003 ATOM 5693 O WAT 4004 79.319 32.030 111.065 1.00 0.00 O ATOM 5694 H1 WAT 4004 78.471 31.587 111.022 1.00 0.00 H ATOM 5695 H2 WAT 4004 79.752 31.799 110.243 1.00 0.00 H TER 5697 WAT 4004 ATOM 5697 O WAT 4005 79.622 104.953 94.304 1.00 0.00 O ATOM 5698 H1 WAT 4005 79.772 104.046 94.569 1.00 0.00 H ATOM 5699 H2 WAT 4005 79.146 105.342 95.037 1.00 0.00 H TER 5701 WAT 4005 ATOM 5701 O WAT 4006 2.404 140.503 61.018 1.00 0.00 O ATOM 5702 H1 WAT 4006 3.252 140.775 61.371 1.00 0.00 H ATOM 5703 H2 WAT 4006 2.564 139.631 60.657 1.00 0.00 H TER 5705 WAT 4006 ATOM 5705 O WAT 4007 78.217 12.219 6.172 1.00 0.00 O ATOM 5706 H1 WAT 4007 77.626 12.449 6.889 1.00 0.00 H ATOM 5707 H2 WAT 4007 77.652 11.804 5.520 1.00 0.00 H TER 5709 WAT 4007 ATOM 5709 O WAT 4008 21.538 114.391 -0.238 1.00 0.00 O ATOM 5710 H1 WAT 4008 20.639 114.314 0.082 1.00 0.00 H ATOM 5711 H2 WAT 4008 21.943 115.036 0.342 1.00 0.00 H TER 5713 WAT 4008 ATOM 5713 O WAT 4009 131.088 34.343 71.584 1.00 0.00 O ATOM 5714 H1 WAT 4009 131.740 33.907 72.133 1.00 0.00 H ATOM 5715 H2 WAT 4009 130.420 33.675 71.430 1.00 0.00 H TER 5717 WAT 4009 ATOM 5717 O WAT 4010 136.328 19.005 130.794 1.00 0.00 O ATOM 5718 H1 WAT 4010 136.619 19.160 129.895 1.00 0.00 H ATOM 5719 H2 WAT 4010 135.377 18.920 130.727 1.00 0.00 H TER 5721 WAT 4010 ATOM 5721 O WAT 4011 88.420 107.159 106.992 1.00 0.00 O ATOM 5722 H1 WAT 4011 87.567 107.592 107.038 1.00 0.00 H ATOM 5723 H2 WAT 4011 88.312 106.362 107.509 1.00 0.00 H TER 5725 WAT 4011 ATOM 5725 O WAT 4012 30.972 28.739 63.899 1.00 0.00 O ATOM 5726 H1 WAT 4012 31.036 28.184 63.121 1.00 0.00 H ATOM 5727 H2 WAT 4012 30.832 29.620 63.554 1.00 0.00 H TER 5729 WAT 4012 ATOM 5729 O WAT 4013 42.426 129.108 148.628 1.00 0.00 O ATOM 5730 H1 WAT 4013 43.009 129.409 147.931 1.00 0.00 H ATOM 5731 H2 WAT 4013 41.650 128.787 148.169 1.00 0.00 H TER 5733 WAT 4013 ATOM 5733 O WAT 4014 32.272 73.683 5.140 1.00 0.00 O ATOM 5734 H1 WAT 4014 31.713 73.011 5.532 1.00 0.00 H ATOM 5735 H2 WAT 4014 31.828 74.508 5.338 1.00 0.00 H TER 5737 WAT 4014 ATOM 5737 O WAT 4015 120.505 58.866 68.501 1.00 0.00 O ATOM 5738 H1 WAT 4015 120.739 58.724 69.418 1.00 0.00 H ATOM 5739 H2 WAT 4015 120.645 58.016 68.084 1.00 0.00 H TER 5741 WAT 4015 ATOM 5741 O WAT 4016 72.030 64.335 153.011 1.00 0.00 O ATOM 5742 H1 WAT 4016 71.077 64.368 152.928 1.00 0.00 H ATOM 5743 H2 WAT 4016 72.196 63.569 153.561 1.00 0.00 H TER 5745 WAT 4016 ATOM 5745 O WAT 4017 63.975 65.354 124.560 1.00 0.00 O ATOM 5746 H1 WAT 4017 64.358 64.525 124.844 1.00 0.00 H ATOM 5747 H2 WAT 4017 63.205 65.466 125.118 1.00 0.00 H TER 5749 WAT 4017 ATOM 5749 O WAT 4018 57.342 62.025 75.835 1.00 0.00 O ATOM 5750 H1 WAT 4018 57.894 61.497 75.258 1.00 0.00 H ATOM 5751 H2 WAT 4018 56.502 61.566 75.849 1.00 0.00 H TER 5753 WAT 4018 ATOM 5753 O WAT 4019 19.059 78.569 75.622 1.00 0.00 O ATOM 5754 H1 WAT 4019 18.934 79.471 75.326 1.00 0.00 H ATOM 5755 H2 WAT 4019 19.714 78.209 75.024 1.00 0.00 H TER 5757 WAT 4019 ATOM 5757 O WAT 4020 32.175 130.840 88.938 1.00 0.00 O ATOM 5758 H1 WAT 4020 32.343 131.641 89.434 1.00 0.00 H ATOM 5759 H2 WAT 4020 31.522 131.095 88.285 1.00 0.00 H TER 5761 WAT 4020 ATOM 5761 O WAT 4021 18.582 64.878 76.380 1.00 0.00 O ATOM 5762 H1 WAT 4021 17.651 64.724 76.220 1.00 0.00 H ATOM 5763 H2 WAT 4021 18.615 65.740 76.795 1.00 0.00 H TER 5765 WAT 4021 ATOM 5765 O WAT 4022 69.189 91.661 142.496 1.00 0.00 O ATOM 5766 H1 WAT 4022 69.827 92.245 142.086 1.00 0.00 H ATOM 5767 H2 WAT 4022 68.369 91.842 142.036 1.00 0.00 H TER 5769 WAT 4022 ATOM 5769 O WAT 4023 103.365 3.076 124.499 1.00 0.00 O ATOM 5770 H1 WAT 4023 103.902 2.372 124.135 1.00 0.00 H ATOM 5771 H2 WAT 4023 102.796 2.641 125.133 1.00 0.00 H TER 5773 WAT 4023 ATOM 5773 O WAT 4024 134.010 75.202 74.017 1.00 0.00 O ATOM 5774 H1 WAT 4024 134.365 76.047 73.740 1.00 0.00 H ATOM 5775 H2 WAT 4024 134.103 74.639 73.249 1.00 0.00 H TER 5777 WAT 4024 ATOM 5777 O WAT 4025 84.737 113.232 2.891 1.00 0.00 O ATOM 5778 H1 WAT 4025 84.224 112.442 2.722 1.00 0.00 H ATOM 5779 H2 WAT 4025 84.122 113.830 3.317 1.00 0.00 H TER 5781 WAT 4025 ATOM 5781 O WAT 4026 29.142 116.696 138.768 1.00 0.00 O ATOM 5782 H1 WAT 4026 28.576 116.597 138.002 1.00 0.00 H ATOM 5783 H2 WAT 4026 28.614 117.191 139.394 1.00 0.00 H TER 5785 WAT 4026 ATOM 5785 O WAT 4027 44.757 77.817 82.561 1.00 0.00 O ATOM 5786 H1 WAT 4027 45.533 77.665 82.021 1.00 0.00 H ATOM 5787 H2 WAT 4027 44.218 77.036 82.431 1.00 0.00 H TER 5789 WAT 4027 ATOM 5789 O WAT 4028 13.657 52.389 105.730 1.00 0.00 O ATOM 5790 H1 WAT 4028 13.753 51.441 105.634 1.00 0.00 H ATOM 5791 H2 WAT 4028 13.396 52.692 104.861 1.00 0.00 H TER 5793 WAT 4028 ATOM 5793 O WAT 4029 87.524 89.088 146.332 1.00 0.00 O ATOM 5794 H1 WAT 4029 87.209 88.822 145.468 1.00 0.00 H ATOM 5795 H2 WAT 4029 87.779 90.004 146.222 1.00 0.00 H TER 5797 WAT 4029 ATOM 5797 O WAT 4030 37.389 111.959 155.029 1.00 0.00 O ATOM 5798 H1 WAT 4030 38.285 111.715 155.264 1.00 0.00 H ATOM 5799 H2 WAT 4030 37.058 112.425 155.797 1.00 0.00 H TER 5801 WAT 4030 ATOM 5801 O WAT 4031 69.392 26.575 116.728 1.00 0.00 O ATOM 5802 H1 WAT 4031 69.810 27.390 116.449 1.00 0.00 H ATOM 5803 H2 WAT 4031 68.518 26.841 117.015 1.00 0.00 H TER 5805 WAT 4031 ATOM 5805 O WAT 4032 90.057 71.043 2.999 1.00 0.00 O ATOM 5806 H1 WAT 4032 90.334 70.718 2.142 1.00 0.00 H ATOM 5807 H2 WAT 4032 89.129 70.812 3.054 1.00 0.00 H TER 5809 WAT 4032 ATOM 5809 O WAT 4033 83.129 17.051 3.284 1.00 0.00 O ATOM 5810 H1 WAT 4033 83.084 17.269 4.215 1.00 0.00 H ATOM 5811 H2 WAT 4033 83.588 17.792 2.888 1.00 0.00 H TER 5813 WAT 4033 ATOM 5813 O WAT 4034 8.914 30.474 95.609 1.00 0.00 O ATOM 5814 H1 WAT 4034 8.788 31.280 95.107 1.00 0.00 H ATOM 5815 H2 WAT 4034 9.813 30.530 95.931 1.00 0.00 H TER 5817 WAT 4034 ATOM 5817 O WAT 4035 0.122 67.605 101.667 1.00 0.00 O ATOM 5818 H1 WAT 4035 0.829 67.085 102.049 1.00 0.00 H ATOM 5819 H2 WAT 4035 -0.125 68.218 102.359 1.00 0.00 H TER 5821 WAT 4035 ATOM 5821 O WAT 4036 54.954 71.911 148.732 1.00 0.00 O ATOM 5822 H1 WAT 4036 55.556 72.094 149.454 1.00 0.00 H ATOM 5823 H2 WAT 4036 55.497 71.486 148.069 1.00 0.00 H TER 5825 WAT 4036 ATOM 5825 O WAT 4037 97.877 29.263 11.064 1.00 0.00 O ATOM 5826 H1 WAT 4037 98.247 28.436 11.372 1.00 0.00 H ATOM 5827 H2 WAT 4037 96.929 29.136 11.118 1.00 0.00 H TER 5829 WAT 4037 ATOM 5829 O WAT 4038 79.163 113.453 151.820 1.00 0.00 O ATOM 5830 H1 WAT 4038 78.502 112.903 152.240 1.00 0.00 H ATOM 5831 H2 WAT 4038 79.535 112.899 151.133 1.00 0.00 H TER 5833 WAT 4038 ATOM 5833 O WAT 4039 130.449 91.912 146.230 1.00 0.00 O ATOM 5834 H1 WAT 4039 130.781 91.035 146.036 1.00 0.00 H ATOM 5835 H2 WAT 4039 130.658 92.425 145.449 1.00 0.00 H TER 5837 WAT 4039 ATOM 5837 O WAT 4040 84.890 57.764 5.506 1.00 0.00 O ATOM 5838 H1 WAT 4040 84.262 58.437 5.768 1.00 0.00 H ATOM 5839 H2 WAT 4040 84.776 57.067 6.152 1.00 0.00 H TER 5841 WAT 4040 ATOM 5841 O WAT 4041 29.075 72.678 8.667 1.00 0.00 O ATOM 5842 H1 WAT 4041 29.108 71.971 9.311 1.00 0.00 H ATOM 5843 H2 WAT 4041 29.599 72.358 7.933 1.00 0.00 H TER 5845 WAT 4041 ATOM 5845 O WAT 4042 77.630 88.562 140.383 1.00 0.00 O ATOM 5846 H1 WAT 4042 78.393 89.118 140.538 1.00 0.00 H ATOM 5847 H2 WAT 4042 77.292 88.850 139.535 1.00 0.00 H TER 5849 WAT 4042 ATOM 5849 O WAT 4043 22.774 33.737 155.779 1.00 0.00 O ATOM 5850 H1 WAT 4043 23.184 33.110 156.375 1.00 0.00 H ATOM 5851 H2 WAT 4043 22.558 34.487 156.332 1.00 0.00 H TER 5853 WAT 4043 ATOM 5853 O WAT 4044 52.096 13.681 15.842 1.00 0.00 O ATOM 5854 H1 WAT 4044 52.051 14.610 16.071 1.00 0.00 H ATOM 5855 H2 WAT 4044 52.424 13.672 14.943 1.00 0.00 H TER 5857 WAT 4044 ATOM 5857 O WAT 4045 9.729 88.524 83.393 1.00 0.00 O ATOM 5858 H1 WAT 4045 10.191 87.888 82.847 1.00 0.00 H ATOM 5859 H2 WAT 4045 8.851 88.157 83.497 1.00 0.00 H TER 5861 WAT 4045 ATOM 5861 O WAT 4046 18.306 2.760 151.143 1.00 0.00 O ATOM 5862 H1 WAT 4046 18.962 3.445 151.018 1.00 0.00 H ATOM 5863 H2 WAT 4046 18.307 2.274 150.318 1.00 0.00 H TER 5865 WAT 4046 ATOM 5865 O WAT 4047 116.364 52.130 63.525 1.00 0.00 O ATOM 5866 H1 WAT 4047 116.880 51.625 62.897 1.00 0.00 H ATOM 5867 H2 WAT 4047 115.525 51.671 63.570 1.00 0.00 H TER 5869 WAT 4047 ATOM 5869 O WAT 4048 122.258 1.840 141.080 1.00 0.00 O ATOM 5870 H1 WAT 4048 123.172 2.112 140.989 1.00 0.00 H ATOM 5871 H2 WAT 4048 122.139 1.711 142.021 1.00 0.00 H TER 5873 WAT 4048 ATOM 5873 O WAT 4049 115.132 58.299 124.420 1.00 0.00 O ATOM 5874 H1 WAT 4049 114.336 58.623 123.998 1.00 0.00 H ATOM 5875 H2 WAT 4049 115.721 58.094 123.694 1.00 0.00 H TER 5877 WAT 4049 ATOM 5877 O WAT 4050 98.429 106.151 99.155 1.00 0.00 O ATOM 5878 H1 WAT 4050 99.366 106.205 98.966 1.00 0.00 H ATOM 5879 H2 WAT 4050 98.327 106.603 99.992 1.00 0.00 H TER 5881 WAT 4050 ATOM 5881 O WAT 4051 14.623 32.652 105.224 1.00 0.00 O ATOM 5882 H1 WAT 4051 14.365 32.264 104.387 1.00 0.00 H ATOM 5883 H2 WAT 4051 15.563 32.808 105.136 1.00 0.00 H TER 5885 WAT 4051 ATOM 5885 O WAT 4052 124.001 144.888 1.908 1.00 0.00 O ATOM 5886 H1 WAT 4052 124.625 144.570 2.561 1.00 0.00 H ATOM 5887 H2 WAT 4052 123.239 144.317 2.006 1.00 0.00 H TER 5889 WAT 4052 ATOM 5889 O WAT 4053 79.612 41.065 152.928 1.00 0.00 O ATOM 5890 H1 WAT 4053 80.563 41.031 152.830 1.00 0.00 H ATOM 5891 H2 WAT 4053 79.473 41.533 153.752 1.00 0.00 H TER 5893 WAT 4053 ATOM 5893 O WAT 4054 27.487 143.369 54.697 1.00 0.00 O ATOM 5894 H1 WAT 4054 26.799 143.465 54.037 1.00 0.00 H ATOM 5895 H2 WAT 4054 28.303 143.464 54.207 1.00 0.00 H TER 5897 WAT 4054 ATOM 5897 O WAT 4055 119.052 41.143 107.733 1.00 0.00 O ATOM 5898 H1 WAT 4055 118.150 41.457 107.800 1.00 0.00 H ATOM 5899 H2 WAT 4055 119.078 40.367 108.292 1.00 0.00 H TER 5901 WAT 4055 ATOM 5901 O WAT 4056 78.687 0.279 90.340 1.00 0.00 O ATOM 5902 H1 WAT 4056 78.097 -0.475 90.345 1.00 0.00 H ATOM 5903 H2 WAT 4056 78.105 1.039 90.338 1.00 0.00 H TER 5905 WAT 4056 ATOM 5905 O WAT 4057 142.197 44.065 85.173 1.00 0.00 O ATOM 5906 H1 WAT 4057 141.347 44.092 85.613 1.00 0.00 H ATOM 5907 H2 WAT 4057 142.059 44.546 84.357 1.00 0.00 H TER 5909 WAT 4057 ATOM 5909 O WAT 4058 119.728 37.259 138.966 1.00 0.00 O ATOM 5910 H1 WAT 4058 119.734 37.679 138.106 1.00 0.00 H ATOM 5911 H2 WAT 4058 119.034 36.602 138.907 1.00 0.00 H TER 5913 WAT 4058 ATOM 5913 O WAT 4059 29.276 119.489 152.982 1.00 0.00 O ATOM 5914 H1 WAT 4059 28.847 119.396 152.131 1.00 0.00 H ATOM 5915 H2 WAT 4059 30.183 119.230 152.822 1.00 0.00 H TER 5917 WAT 4059 ATOM 5917 O WAT 4060 99.943 40.125 83.109 1.00 0.00 O ATOM 5918 H1 WAT 4060 99.500 39.465 83.643 1.00 0.00 H ATOM 5919 H2 WAT 4060 99.318 40.328 82.414 1.00 0.00 H TER 5921 WAT 4060 ATOM 5921 O WAT 4061 121.357 121.549 84.355 1.00 0.00 O ATOM 5922 H1 WAT 4061 121.882 122.271 84.700 1.00 0.00 H ATOM 5923 H2 WAT 4061 120.452 121.848 84.444 1.00 0.00 H TER 5925 WAT 4061 ATOM 5925 O WAT 4062 26.494 89.025 124.904 1.00 0.00 O ATOM 5926 H1 WAT 4062 27.372 89.065 125.283 1.00 0.00 H ATOM 5927 H2 WAT 4062 26.485 89.722 124.247 1.00 0.00 H TER 5929 WAT 4062 ATOM 5929 O WAT 4063 26.250 126.396 118.922 1.00 0.00 O ATOM 5930 H1 WAT 4063 27.148 126.298 119.241 1.00 0.00 H ATOM 5931 H2 WAT 4063 26.345 126.554 117.983 1.00 0.00 H TER 5933 WAT 4063 ATOM 5933 O WAT 4064 42.498 123.363 135.936 1.00 0.00 O ATOM 5934 H1 WAT 4064 42.948 124.206 135.886 1.00 0.00 H ATOM 5935 H2 WAT 4064 42.322 123.130 135.025 1.00 0.00 H TER 5937 WAT 4064 ATOM 5937 O WAT 4065 9.796 126.529 73.244 1.00 0.00 O ATOM 5938 H1 WAT 4065 9.238 125.953 73.765 1.00 0.00 H ATOM 5939 H2 WAT 4065 9.188 127.137 72.824 1.00 0.00 H TER 5941 WAT 4065 ATOM 5941 O WAT 4066 13.944 62.745 126.584 1.00 0.00 O ATOM 5942 H1 WAT 4066 14.468 62.474 127.338 1.00 0.00 H ATOM 5943 H2 WAT 4066 13.610 61.927 126.218 1.00 0.00 H TER 5945 WAT 4066 ATOM 5945 O WAT 4067 51.406 141.917 121.514 1.00 0.00 O ATOM 5946 H1 WAT 4067 51.245 141.941 120.571 1.00 0.00 H ATOM 5947 H2 WAT 4067 50.711 142.458 121.890 1.00 0.00 H TER 5949 WAT 4067 ATOM 5949 O WAT 4068 115.724 120.142 12.164 1.00 0.00 O ATOM 5950 H1 WAT 4068 115.819 120.105 11.212 1.00 0.00 H ATOM 5951 H2 WAT 4068 116.558 119.815 12.501 1.00 0.00 H TER 5953 WAT 4068 ATOM 5953 O WAT 4069 109.759 84.190 23.143 1.00 0.00 O ATOM 5954 H1 WAT 4069 109.920 84.474 22.244 1.00 0.00 H ATOM 5955 H2 WAT 4069 110.537 84.467 23.626 1.00 0.00 H TER 5957 WAT 4069 ATOM 5957 O WAT 4070 72.614 47.518 16.572 1.00 0.00 O ATOM 5958 H1 WAT 4070 72.560 46.565 16.643 1.00 0.00 H ATOM 5959 H2 WAT 4070 73.528 47.722 16.771 1.00 0.00 H TER 5961 WAT 4070 ATOM 5961 O WAT 4071 45.449 68.428 98.565 1.00 0.00 O ATOM 5962 H1 WAT 4071 44.571 68.344 98.938 1.00 0.00 H ATOM 5963 H2 WAT 4071 45.826 69.188 99.008 1.00 0.00 H TER 5965 WAT 4071 ATOM 5965 O WAT 4072 21.642 63.927 13.457 1.00 0.00 O ATOM 5966 H1 WAT 4072 21.271 63.083 13.712 1.00 0.00 H ATOM 5967 H2 WAT 4072 22.584 63.826 13.596 1.00 0.00 H TER 5969 WAT 4072 ATOM 5969 O WAT 4073 108.542 125.610 122.624 1.00 0.00 O ATOM 5970 H1 WAT 4073 107.762 125.082 122.451 1.00 0.00 H ATOM 5971 H2 WAT 4073 109.275 125.026 122.429 1.00 0.00 H TER 5973 WAT 4073 ATOM 5973 O WAT 4074 76.231 104.590 19.514 1.00 0.00 O ATOM 5974 H1 WAT 4074 76.253 103.761 19.993 1.00 0.00 H ATOM 5975 H2 WAT 4074 75.301 104.742 19.343 1.00 0.00 H TER 5977 WAT 4074 ATOM 5977 O WAT 4075 133.402 142.732 11.148 1.00 0.00 O ATOM 5978 H1 WAT 4075 133.301 142.147 10.398 1.00 0.00 H ATOM 5979 H2 WAT 4075 132.602 143.259 11.150 1.00 0.00 H TER 5981 WAT 4075 ATOM 5981 O WAT 4076 6.349 123.213 4.528 1.00 0.00 O ATOM 5982 H1 WAT 4076 6.800 123.870 5.059 1.00 0.00 H ATOM 5983 H2 WAT 4076 6.802 123.235 3.685 1.00 0.00 H TER 5985 WAT 4076 ATOM 5985 O WAT 4077 63.389 60.897 67.082 1.00 0.00 O ATOM 5986 H1 WAT 4077 62.952 60.047 67.137 1.00 0.00 H ATOM 5987 H2 WAT 4077 63.989 60.907 67.829 1.00 0.00 H TER 5989 WAT 4077 ATOM 5989 O WAT 4078 107.997 68.117 138.481 1.00 0.00 O ATOM 5990 H1 WAT 4078 108.469 68.609 137.809 1.00 0.00 H ATOM 5991 H2 WAT 4078 108.549 68.185 139.260 1.00 0.00 H TER 5993 WAT 4078 ATOM 5993 O WAT 4079 108.342 145.141 123.529 1.00 0.00 O ATOM 5994 H1 WAT 4079 108.604 145.497 122.681 1.00 0.00 H ATOM 5995 H2 WAT 4079 108.423 145.879 124.134 1.00 0.00 H TER 5997 WAT 4079 ATOM 5997 O WAT 4080 17.063 138.650 129.874 1.00 0.00 O ATOM 5998 H1 WAT 4080 16.648 139.484 130.097 1.00 0.00 H ATOM 5999 H2 WAT 4080 16.521 137.990 130.307 1.00 0.00 H TER 6001 WAT 4080 ATOM 6001 O WAT 4081 70.435 95.794 3.617 1.00 0.00 O ATOM 6002 H1 WAT 4081 70.594 96.709 3.387 1.00 0.00 H ATOM 6003 H2 WAT 4081 70.749 95.299 2.861 1.00 0.00 H TER 6005 WAT 4081 ATOM 6005 O WAT 4082 43.627 46.683 67.792 1.00 0.00 O ATOM 6006 H1 WAT 4082 43.348 47.395 68.367 1.00 0.00 H ATOM 6007 H2 WAT 4082 44.360 47.048 67.297 1.00 0.00 H TER 6009 WAT 4082 ATOM 6009 O WAT 4083 98.934 125.108 20.134 1.00 0.00 O ATOM 6010 H1 WAT 4083 99.872 125.288 20.061 1.00 0.00 H ATOM 6011 H2 WAT 4083 98.734 124.565 19.372 1.00 0.00 H TER 6013 WAT 4083 ATOM 6013 O WAT 4084 91.197 33.786 17.067 1.00 0.00 O ATOM 6014 H1 WAT 4084 91.736 33.476 17.794 1.00 0.00 H ATOM 6015 H2 WAT 4084 91.674 34.539 16.718 1.00 0.00 H TER 6017 WAT 4084 ATOM 6017 O WAT 4085 7.720 46.406 5.251 1.00 0.00 O ATOM 6018 H1 WAT 4085 6.833 46.720 5.428 1.00 0.00 H ATOM 6019 H2 WAT 4085 8.290 47.102 5.578 1.00 0.00 H TER 6021 WAT 4085 ATOM 6021 O WAT 4086 91.563 22.716 99.501 1.00 0.00 O ATOM 6022 H1 WAT 4086 90.666 23.021 99.638 1.00 0.00 H ATOM 6023 H2 WAT 4086 92.097 23.508 99.561 1.00 0.00 H TER 6025 WAT 4086 ATOM 6025 O WAT 4087 140.830 5.516 152.892 1.00 0.00 O ATOM 6026 H1 WAT 4087 140.764 5.943 152.038 1.00 0.00 H ATOM 6027 H2 WAT 4087 141.770 5.489 153.074 1.00 0.00 H TER 6029 WAT 4087 ATOM 6029 O WAT 4088 6.418 105.007 85.366 1.00 0.00 O ATOM 6030 H1 WAT 4088 5.800 104.701 84.703 1.00 0.00 H ATOM 6031 H2 WAT 4088 6.202 105.932 85.486 1.00 0.00 H TER 6033 WAT 4088 ATOM 6033 O WAT 4089 93.960 41.595 157.218 1.00 0.00 O ATOM 6034 H1 WAT 4089 94.272 42.497 157.290 1.00 0.00 H ATOM 6035 H2 WAT 4089 93.167 41.657 156.687 1.00 0.00 H TER 6037 WAT 4089 ATOM 6037 O WAT 4090 51.207 57.899 102.906 1.00 0.00 O ATOM 6038 H1 WAT 4090 51.232 58.796 103.238 1.00 0.00 H ATOM 6039 H2 WAT 4090 51.501 57.970 101.998 1.00 0.00 H TER 6041 WAT 4090 ATOM 6041 O WAT 4091 112.992 128.650 149.317 1.00 0.00 O ATOM 6042 H1 WAT 4091 112.310 128.852 148.677 1.00 0.00 H ATOM 6043 H2 WAT 4091 112.548 128.697 150.163 1.00 0.00 H TER 6045 WAT 4091 ATOM 6045 O WAT 4092 67.415 74.663 76.328 1.00 0.00 O ATOM 6046 H1 WAT 4092 66.875 74.309 77.035 1.00 0.00 H ATOM 6047 H2 WAT 4092 67.221 74.103 75.576 1.00 0.00 H TER 6049 WAT 4092 ATOM 6049 O WAT 4093 16.203 28.997 120.872 1.00 0.00 O ATOM 6050 H1 WAT 4093 15.462 28.393 120.916 1.00 0.00 H ATOM 6051 H2 WAT 4093 16.928 28.463 120.548 1.00 0.00 H TER 6053 WAT 4093 ATOM 6053 O WAT 4094 141.930 108.400 138.880 1.00 0.00 O ATOM 6054 H1 WAT 4094 142.346 108.793 138.113 1.00 0.00 H ATOM 6055 H2 WAT 4094 142.230 108.933 139.616 1.00 0.00 H TER 6057 WAT 4094 ATOM 6057 O WAT 4095 13.540 104.402 84.617 1.00 0.00 O ATOM 6058 H1 WAT 4095 13.558 103.646 85.204 1.00 0.00 H ATOM 6059 H2 WAT 4095 12.997 105.046 85.072 1.00 0.00 H TER 6061 WAT 4095 ATOM 6061 O WAT 4096 144.819 91.212 128.779 1.00 0.00 O ATOM 6062 H1 WAT 4096 145.300 91.280 129.604 1.00 0.00 H ATOM 6063 H2 WAT 4096 145.489 91.011 128.126 1.00 0.00 H TER 6065 WAT 4096 ATOM 6065 O WAT 4097 12.212 142.009 134.879 1.00 0.00 O ATOM 6066 H1 WAT 4097 11.507 142.632 134.703 1.00 0.00 H ATOM 6067 H2 WAT 4097 12.090 141.761 135.795 1.00 0.00 H TER 6069 WAT 4097 ATOM 6069 O WAT 4098 32.811 42.281 8.759 1.00 0.00 O ATOM 6070 H1 WAT 4098 32.145 42.125 8.089 1.00 0.00 H ATOM 6071 H2 WAT 4098 32.320 42.614 9.511 1.00 0.00 H TER 6073 WAT 4098 ATOM 6073 O WAT 4099 30.054 37.291 60.968 1.00 0.00 O ATOM 6074 H1 WAT 4099 29.233 37.674 61.278 1.00 0.00 H ATOM 6075 H2 WAT 4099 30.245 37.760 60.155 1.00 0.00 H TER 6077 WAT 4099 ATOM 6077 O WAT 4100 30.866 89.305 95.179 1.00 0.00 O ATOM 6078 H1 WAT 4100 31.521 89.112 94.508 1.00 0.00 H ATOM 6079 H2 WAT 4100 31.188 88.861 95.963 1.00 0.00 H TER 6081 WAT 4100 ATOM 6081 O WAT 4101 138.024 27.116 10.786 1.00 0.00 O ATOM 6082 H1 WAT 4101 138.684 27.029 11.474 1.00 0.00 H ATOM 6083 H2 WAT 4101 138.510 27.439 10.027 1.00 0.00 H TER 6085 WAT 4101 ATOM 6085 O WAT 4102 51.084 12.299 114.953 1.00 0.00 O ATOM 6086 H1 WAT 4102 50.304 12.164 115.491 1.00 0.00 H ATOM 6087 H2 WAT 4102 50.750 12.673 114.137 1.00 0.00 H TER 6089 WAT 4102 ATOM 6089 O WAT 4103 89.625 56.026 122.492 1.00 0.00 O ATOM 6090 H1 WAT 4103 89.690 55.952 121.540 1.00 0.00 H ATOM 6091 H2 WAT 4103 88.840 56.556 122.638 1.00 0.00 H TER 6093 WAT 4103 ATOM 6093 O WAT 4104 38.684 121.960 95.185 1.00 0.00 O ATOM 6094 H1 WAT 4104 38.093 122.566 94.738 1.00 0.00 H ATOM 6095 H2 WAT 4104 39.530 122.409 95.188 1.00 0.00 H TER 6097 WAT 4104 ATOM 6097 O WAT 4105 94.833 77.152 156.975 1.00 0.00 O ATOM 6098 H1 WAT 4105 95.315 76.482 156.490 1.00 0.00 H ATOM 6099 H2 WAT 4105 93.925 76.847 156.965 1.00 0.00 H TER 6101 WAT 4105 ATOM 6101 O WAT 4106 16.499 58.830 151.846 1.00 0.00 O ATOM 6102 H1 WAT 4106 15.965 58.269 151.283 1.00 0.00 H ATOM 6103 H2 WAT 4106 16.374 59.712 151.494 1.00 0.00 H TER 6105 WAT 4106 ATOM 6105 O WAT 4107 12.517 8.786 23.102 1.00 0.00 O ATOM 6106 H1 WAT 4107 12.714 9.508 22.505 1.00 0.00 H ATOM 6107 H2 WAT 4107 11.627 8.521 22.870 1.00 0.00 H TER 6109 WAT 4107 ATOM 6109 O WAT 4108 49.547 86.054 72.960 1.00 0.00 O ATOM 6110 H1 WAT 4108 49.992 85.948 72.119 1.00 0.00 H ATOM 6111 H2 WAT 4108 48.990 86.823 72.842 1.00 0.00 H TER 6113 WAT 4108 ATOM 6113 O WAT 4109 107.573 47.925 15.801 1.00 0.00 O ATOM 6114 H1 WAT 4109 107.582 47.106 16.297 1.00 0.00 H ATOM 6115 H2 WAT 4109 107.395 47.657 14.900 1.00 0.00 H TER 6117 WAT 4109 ATOM 6117 O WAT 4110 72.463 133.556 147.631 1.00 0.00 O ATOM 6118 H1 WAT 4110 72.452 134.070 146.824 1.00 0.00 H ATOM 6119 H2 WAT 4110 71.912 132.797 147.439 1.00 0.00 H TER 6121 WAT 4110 ATOM 6121 O WAT 4111 131.561 13.182 131.017 1.00 0.00 O ATOM 6122 H1 WAT 4111 132.019 14.015 130.903 1.00 0.00 H ATOM 6123 H2 WAT 4111 131.699 12.957 131.937 1.00 0.00 H TER 6125 WAT 4111 ATOM 6125 O WAT 4112 139.037 55.512 63.881 1.00 0.00 O ATOM 6126 H1 WAT 4112 139.255 56.355 63.482 1.00 0.00 H ATOM 6127 H2 WAT 4112 139.845 55.235 64.312 1.00 0.00 H TER 6129 WAT 4112 ATOM 6129 O WAT 4113 110.004 126.420 58.195 1.00 0.00 O ATOM 6130 H1 WAT 4113 110.647 125.721 58.308 1.00 0.00 H ATOM 6131 H2 WAT 4113 110.425 127.196 58.565 1.00 0.00 H TER 6133 WAT 4113 ATOM 6133 O WAT 4114 80.276 97.675 147.767 1.00 0.00 O ATOM 6134 H1 WAT 4114 79.439 97.290 147.507 1.00 0.00 H ATOM 6135 H2 WAT 4114 80.443 97.319 148.639 1.00 0.00 H TER 6137 WAT 4114 ATOM 6137 O WAT 4115 13.265 26.841 157.057 1.00 0.00 O ATOM 6138 H1 WAT 4115 13.044 27.766 156.946 1.00 0.00 H ATOM 6139 H2 WAT 4115 12.557 26.371 156.617 1.00 0.00 H TER 6141 WAT 4115 ATOM 6141 O WAT 4116 142.570 52.428 148.505 1.00 0.00 O ATOM 6142 H1 WAT 4116 142.215 53.270 148.791 1.00 0.00 H ATOM 6143 H2 WAT 4116 142.145 51.784 149.072 1.00 0.00 H TER 6145 WAT 4116 ATOM 6145 O WAT 4117 103.253 68.522 18.055 1.00 0.00 O ATOM 6146 H1 WAT 4117 103.275 69.474 17.957 1.00 0.00 H ATOM 6147 H2 WAT 4117 103.301 68.378 19.000 1.00 0.00 H TER 6149 WAT 4117 ATOM 6149 O WAT 4118 38.811 80.078 4.032 1.00 0.00 O ATOM 6150 H1 WAT 4118 38.096 79.446 3.972 1.00 0.00 H ATOM 6151 H2 WAT 4118 39.567 79.622 3.661 1.00 0.00 H TER 6153 WAT 4118 ATOM 6153 O WAT 4119 78.447 101.976 16.246 1.00 0.00 O ATOM 6154 H1 WAT 4119 77.896 101.264 16.572 1.00 0.00 H ATOM 6155 H2 WAT 4119 77.861 102.733 16.206 1.00 0.00 H TER 6157 WAT 4119 ATOM 6157 O WAT 4120 29.615 107.086 20.850 1.00 0.00 O ATOM 6158 H1 WAT 4120 30.023 106.666 20.093 1.00 0.00 H ATOM 6159 H2 WAT 4120 30.320 107.596 21.249 1.00 0.00 H TER 6161 WAT 4120 ATOM 6161 O WAT 4121 7.269 12.724 132.290 1.00 0.00 O ATOM 6162 H1 WAT 4121 6.364 12.515 132.522 1.00 0.00 H ATOM 6163 H2 WAT 4121 7.249 12.853 131.341 1.00 0.00 H TER 6165 WAT 4121 ATOM 6165 O WAT 4122 15.028 134.535 60.263 1.00 0.00 O ATOM 6166 H1 WAT 4122 14.666 133.719 59.918 1.00 0.00 H ATOM 6167 H2 WAT 4122 15.618 134.845 59.576 1.00 0.00 H TER 6169 WAT 4122 ATOM 6169 O WAT 4123 115.077 125.646 123.576 1.00 0.00 O ATOM 6170 H1 WAT 4123 115.148 124.745 123.890 1.00 0.00 H ATOM 6171 H2 WAT 4123 115.958 125.863 123.271 1.00 0.00 H TER 6173 WAT 4123 ATOM 6173 O WAT 4124 135.331 52.901 93.488 1.00 0.00 O ATOM 6174 H1 WAT 4124 134.987 52.590 92.651 1.00 0.00 H ATOM 6175 H2 WAT 4124 136.249 52.630 93.485 1.00 0.00 H TER 6177 WAT 4124 ATOM 6177 O WAT 4125 14.724 132.354 139.052 1.00 0.00 O ATOM 6178 H1 WAT 4125 14.182 131.988 139.751 1.00 0.00 H ATOM 6179 H2 WAT 4125 15.622 132.153 139.315 1.00 0.00 H TER 6181 WAT 4125 ATOM 6181 O WAT 4126 133.629 24.529 95.762 1.00 0.00 O ATOM 6182 H1 WAT 4126 133.544 24.073 94.925 1.00 0.00 H ATOM 6183 H2 WAT 4126 132.757 24.886 95.930 1.00 0.00 H TER 6185 WAT 4126 ATOM 6185 O WAT 4127 88.374 93.745 65.157 1.00 0.00 O ATOM 6186 H1 WAT 4127 88.255 92.801 65.055 1.00 0.00 H ATOM 6187 H2 WAT 4127 87.635 94.132 64.686 1.00 0.00 H TER 6189 WAT 4127 ATOM 6189 O WAT 4128 76.667 59.205 155.263 1.00 0.00 O ATOM 6190 H1 WAT 4128 76.555 58.363 154.822 1.00 0.00 H ATOM 6191 H2 WAT 4128 75.997 59.208 155.947 1.00 0.00 H TER 6193 WAT 4128 ATOM 6193 O WAT 4129 81.294 66.171 5.159 1.00 0.00 O ATOM 6194 H1 WAT 4129 81.422 67.057 4.822 1.00 0.00 H ATOM 6195 H2 WAT 4129 82.120 65.959 5.594 1.00 0.00 H TER 6197 WAT 4129 ATOM 6197 O WAT 4130 21.475 97.396 155.940 1.00 0.00 O ATOM 6198 H1 WAT 4130 21.277 97.544 156.865 1.00 0.00 H ATOM 6199 H2 WAT 4130 20.618 97.332 155.519 1.00 0.00 H TER 6201 WAT 4130 ATOM 6201 O WAT 4131 111.236 60.569 157.488 1.00 0.00 O ATOM 6202 H1 WAT 4131 110.981 60.658 156.570 1.00 0.00 H ATOM 6203 H2 WAT 4131 110.461 60.839 157.979 1.00 0.00 H TER 6205 WAT 4131 ATOM 6205 O WAT 4132 16.855 61.415 7.925 1.00 0.00 O ATOM 6206 H1 WAT 4132 16.549 61.583 7.034 1.00 0.00 H ATOM 6207 H2 WAT 4132 17.243 62.244 8.205 1.00 0.00 H TER 6209 WAT 4132 ATOM 6209 O WAT 4133 20.934 28.274 127.206 1.00 0.00 O ATOM 6210 H1 WAT 4133 20.529 29.034 127.623 1.00 0.00 H ATOM 6211 H2 WAT 4133 21.446 28.641 126.485 1.00 0.00 H TER 6213 WAT 4133 ATOM 6213 O WAT 4134 107.296 4.988 66.915 1.00 0.00 O ATOM 6214 H1 WAT 4134 107.897 5.570 66.451 1.00 0.00 H ATOM 6215 H2 WAT 4134 107.832 4.231 67.154 1.00 0.00 H TER 6217 WAT 4134 ATOM 6217 O WAT 4135 46.336 25.402 7.697 1.00 0.00 O ATOM 6218 H1 WAT 4135 46.298 24.447 7.645 1.00 0.00 H ATOM 6219 H2 WAT 4135 45.442 25.688 7.509 1.00 0.00 H TER 6221 WAT 4135 ATOM 6221 O WAT 4136 139.231 69.247 60.825 1.00 0.00 O ATOM 6222 H1 WAT 4136 138.378 69.143 61.246 1.00 0.00 H ATOM 6223 H2 WAT 4136 139.086 69.909 60.149 1.00 0.00 H TER 6225 WAT 4136 ATOM 6225 O WAT 4137 107.263 81.532 127.645 1.00 0.00 O ATOM 6226 H1 WAT 4137 108.192 81.665 127.460 1.00 0.00 H ATOM 6227 H2 WAT 4137 107.243 81.199 128.543 1.00 0.00 H TER 6229 WAT 4137 ATOM 6229 O WAT 4138 57.680 26.853 112.584 1.00 0.00 O ATOM 6230 H1 WAT 4138 56.832 26.834 112.141 1.00 0.00 H ATOM 6231 H2 WAT 4138 57.845 27.782 112.746 1.00 0.00 H TER 6233 WAT 4138 ATOM 6233 O WAT 4139 45.726 91.683 143.583 1.00 0.00 O ATOM 6234 H1 WAT 4139 46.465 91.160 143.274 1.00 0.00 H ATOM 6235 H2 WAT 4139 46.103 92.543 143.771 1.00 0.00 H TER 6237 WAT 4139 ATOM 6237 O WAT 4140 61.622 121.704 136.640 1.00 0.00 O ATOM 6238 H1 WAT 4140 61.033 121.123 137.121 1.00 0.00 H ATOM 6239 H2 WAT 4140 61.649 121.339 135.756 1.00 0.00 H TER 6241 WAT 4140 ATOM 6241 O WAT 4141 91.184 38.217 119.942 1.00 0.00 O ATOM 6242 H1 WAT 4141 91.266 38.509 120.850 1.00 0.00 H ATOM 6243 H2 WAT 4141 91.925 38.621 119.492 1.00 0.00 H TER 6245 WAT 4141 ATOM 6245 O WAT 4142 67.356 39.649 85.747 1.00 0.00 O ATOM 6246 H1 WAT 4142 67.846 40.457 85.596 1.00 0.00 H ATOM 6247 H2 WAT 4142 66.449 39.877 85.542 1.00 0.00 H TER 6249 WAT 4142 ATOM 6249 O WAT 4143 44.929 71.867 142.089 1.00 0.00 O ATOM 6250 H1 WAT 4143 44.257 71.223 141.864 1.00 0.00 H ATOM 6251 H2 WAT 4143 45.380 71.488 142.843 1.00 0.00 H TER 6253 WAT 4143 ATOM 6253 O WAT 4144 68.595 58.808 126.108 1.00 0.00 O ATOM 6254 H1 WAT 4144 68.322 59.382 125.392 1.00 0.00 H ATOM 6255 H2 WAT 4144 67.782 58.411 126.420 1.00 0.00 H TER 6257 WAT 4144 ATOM 6257 O WAT 4145 107.056 51.559 155.527 1.00 0.00 O ATOM 6258 H1 WAT 4145 106.913 52.054 154.721 1.00 0.00 H ATOM 6259 H2 WAT 4145 107.890 51.110 155.389 1.00 0.00 H TER 6261 WAT 4145 ATOM 6261 O WAT 4146 25.260 76.144 111.485 1.00 0.00 O ATOM 6262 H1 WAT 4146 26.013 76.130 112.076 1.00 0.00 H ATOM 6263 H2 WAT 4146 24.597 76.649 111.955 1.00 0.00 H TER 6265 WAT 4146 ATOM 6265 O WAT 4147 7.625 51.719 153.098 1.00 0.00 O ATOM 6266 H1 WAT 4147 8.395 51.299 153.481 1.00 0.00 H ATOM 6267 H2 WAT 4147 6.956 51.659 153.780 1.00 0.00 H TER 6269 WAT 4147 ATOM 6269 O WAT 4148 110.663 1.680 88.167 1.00 0.00 O ATOM 6270 H1 WAT 4148 111.261 1.894 87.451 1.00 0.00 H ATOM 6271 H2 WAT 4148 111.229 1.586 88.933 1.00 0.00 H TER 6273 WAT 4148 ATOM 6273 O WAT 4149 88.779 60.865 107.182 1.00 0.00 O ATOM 6274 H1 WAT 4149 87.858 61.113 107.266 1.00 0.00 H ATOM 6275 H2 WAT 4149 89.208 61.648 106.839 1.00 0.00 H TER 6277 WAT 4149 ATOM 6277 O WAT 4150 14.246 127.181 144.050 1.00 0.00 O ATOM 6278 H1 WAT 4150 14.570 128.082 144.040 1.00 0.00 H ATOM 6279 H2 WAT 4150 13.450 127.219 144.580 1.00 0.00 H TER 6281 WAT 4150 ATOM 6281 O WAT 4151 116.958 106.915 64.937 1.00 0.00 O ATOM 6282 H1 WAT 4151 117.912 106.871 65.002 1.00 0.00 H ATOM 6283 H2 WAT 4151 116.766 106.629 64.044 1.00 0.00 H TER 6285 WAT 4151 ATOM 6285 O WAT 4152 20.154 47.839 143.400 1.00 0.00 O ATOM 6286 H1 WAT 4152 19.747 46.976 143.485 1.00 0.00 H ATOM 6287 H2 WAT 4152 21.066 47.652 143.176 1.00 0.00 H TER 6289 WAT 4152 ATOM 6289 O WAT 4153 26.060 71.701 152.562 1.00 0.00 O ATOM 6290 H1 WAT 4153 26.058 71.694 153.519 1.00 0.00 H ATOM 6291 H2 WAT 4153 26.043 72.629 152.329 1.00 0.00 H TER 6293 WAT 4153 ATOM 6293 O WAT 4154 34.665 106.674 114.910 1.00 0.00 O ATOM 6294 H1 WAT 4154 34.128 106.093 114.371 1.00 0.00 H ATOM 6295 H2 WAT 4154 34.051 107.048 115.542 1.00 0.00 H TER 6297 WAT 4154 ATOM 6297 O WAT 4155 79.898 55.942 67.621 1.00 0.00 O ATOM 6298 H1 WAT 4155 80.095 55.467 66.813 1.00 0.00 H ATOM 6299 H2 WAT 4155 80.378 56.766 67.538 1.00 0.00 H TER 6301 WAT 4155 ATOM 6301 O WAT 4156 27.636 12.940 23.983 1.00 0.00 O ATOM 6302 H1 WAT 4156 27.848 12.392 24.738 1.00 0.00 H ATOM 6303 H2 WAT 4156 28.475 13.313 23.714 1.00 0.00 H TER 6305 WAT 4156 ATOM 6305 O WAT 4157 110.595 141.581 150.787 1.00 0.00 O ATOM 6306 H1 WAT 4157 110.495 142.530 150.719 1.00 0.00 H ATOM 6307 H2 WAT 4157 109.830 141.226 150.333 1.00 0.00 H TER 6309 WAT 4157 ATOM 6309 O WAT 4158 106.761 100.307 137.719 1.00 0.00 O ATOM 6310 H1 WAT 4158 105.987 100.186 137.169 1.00 0.00 H ATOM 6311 H2 WAT 4158 107.484 99.967 137.193 1.00 0.00 H TER 6313 WAT 4158 ATOM 6313 O WAT 4159 115.508 93.331 67.589 1.00 0.00 O ATOM 6314 H1 WAT 4159 115.619 93.980 66.895 1.00 0.00 H ATOM 6315 H2 WAT 4159 114.789 93.670 68.122 1.00 0.00 H TER 6317 WAT 4159 ATOM 6317 O WAT 4160 55.602 123.114 134.630 1.00 0.00 O ATOM 6318 H1 WAT 4160 55.601 122.925 133.692 1.00 0.00 H ATOM 6319 H2 WAT 4160 54.692 123.334 134.832 1.00 0.00 H TER 6321 WAT 4160 ATOM 6321 O WAT 4161 107.311 11.581 82.922 1.00 0.00 O ATOM 6322 H1 WAT 4161 106.800 12.376 82.770 1.00 0.00 H ATOM 6323 H2 WAT 4161 107.174 11.382 83.848 1.00 0.00 H TER 6325 WAT 4161 ATOM 6325 O WAT 4162 94.326 72.425 139.783 1.00 0.00 O ATOM 6326 H1 WAT 4162 95.001 71.868 139.396 1.00 0.00 H ATOM 6327 H2 WAT 4162 94.795 72.963 140.421 1.00 0.00 H TER 6329 WAT 4162 ATOM 6329 O WAT 4163 101.181 66.175 122.210 1.00 0.00 O ATOM 6330 H1 WAT 4163 101.891 65.624 121.881 1.00 0.00 H ATOM 6331 H2 WAT 4163 100.706 66.447 121.425 1.00 0.00 H TER 6333 WAT 4163 ATOM 6333 O WAT 4164 58.347 136.700 77.881 1.00 0.00 O ATOM 6334 H1 WAT 4164 57.716 136.867 78.581 1.00 0.00 H ATOM 6335 H2 WAT 4164 58.790 135.893 78.144 1.00 0.00 H TER 6337 WAT 4164 ATOM 6337 O WAT 4165 43.642 138.269 102.406 1.00 0.00 O ATOM 6338 H1 WAT 4165 43.782 138.802 101.623 1.00 0.00 H ATOM 6339 H2 WAT 4165 42.694 138.286 102.541 1.00 0.00 H TER 6341 WAT 4165 ATOM 6341 O WAT 4166 89.747 17.361 115.609 1.00 0.00 O ATOM 6342 H1 WAT 4166 89.372 17.499 116.479 1.00 0.00 H ATOM 6343 H2 WAT 4166 89.453 16.485 115.358 1.00 0.00 H TER 6345 WAT 4166 ATOM 6345 O WAT 4167 117.235 31.231 134.166 1.00 0.00 O ATOM 6346 H1 WAT 4167 117.142 30.384 134.603 1.00 0.00 H ATOM 6347 H2 WAT 4167 117.492 31.833 134.865 1.00 0.00 H TER 6349 WAT 4167 ATOM 6349 O WAT 4168 31.292 117.317 142.125 1.00 0.00 O ATOM 6350 H1 WAT 4168 31.793 118.034 141.735 1.00 0.00 H ATOM 6351 H2 WAT 4168 31.270 116.643 141.447 1.00 0.00 H TER 6353 WAT 4168 ATOM 6353 O WAT 4169 88.395 137.528 73.444 1.00 0.00 O ATOM 6354 H1 WAT 4169 87.673 137.548 72.816 1.00 0.00 H ATOM 6355 H2 WAT 4169 88.897 138.322 73.258 1.00 0.00 H TER 6357 WAT 4169 ATOM 6357 O WAT 4170 33.504 114.856 124.200 1.00 0.00 O ATOM 6358 H1 WAT 4170 34.235 114.807 123.585 1.00 0.00 H ATOM 6359 H2 WAT 4170 33.460 115.779 124.447 1.00 0.00 H TER 6361 WAT 4170 ATOM 6361 O WAT 4171 125.773 98.766 141.821 1.00 0.00 O ATOM 6362 H1 WAT 4171 125.850 97.849 142.084 1.00 0.00 H ATOM 6363 H2 WAT 4171 125.140 98.757 141.103 1.00 0.00 H TER 6365 WAT 4171 ATOM 6365 O WAT 4172 127.969 58.796 139.630 1.00 0.00 O ATOM 6366 H1 WAT 4172 127.066 58.489 139.714 1.00 0.00 H ATOM 6367 H2 WAT 4172 128.134 59.282 140.438 1.00 0.00 H TER 6369 WAT 4172 ATOM 6369 O WAT 4173 124.390 38.584 124.110 1.00 0.00 O ATOM 6370 H1 WAT 4173 124.712 38.087 124.862 1.00 0.00 H ATOM 6371 H2 WAT 4173 123.448 38.411 124.094 1.00 0.00 H TER 6373 WAT 4173 ATOM 6373 O WAT 4174 133.590 4.762 103.067 1.00 0.00 O ATOM 6374 H1 WAT 4174 134.086 5.266 103.713 1.00 0.00 H ATOM 6375 H2 WAT 4174 132.679 4.840 103.352 1.00 0.00 H TER 6377 WAT 4174 ATOM 6377 O WAT 4175 96.137 52.126 64.051 1.00 0.00 O ATOM 6378 H1 WAT 4175 95.842 52.091 64.961 1.00 0.00 H ATOM 6379 H2 WAT 4175 95.567 52.775 63.640 1.00 0.00 H TER 6381 WAT 4175 ATOM 6381 O WAT 4176 16.404 84.638 125.978 1.00 0.00 O ATOM 6382 H1 WAT 4176 16.606 85.320 125.338 1.00 0.00 H ATOM 6383 H2 WAT 4176 16.083 85.116 126.744 1.00 0.00 H TER 6385 WAT 4176 ATOM 6385 O WAT 4177 138.073 40.778 128.873 1.00 0.00 O ATOM 6386 H1 WAT 4177 137.376 40.816 129.528 1.00 0.00 H ATOM 6387 H2 WAT 4177 137.659 40.388 128.104 1.00 0.00 H TER 6389 WAT 4177 ATOM 6389 O WAT 4178 60.930 32.196 118.076 1.00 0.00 O ATOM 6390 H1 WAT 4178 60.207 31.569 118.055 1.00 0.00 H ATOM 6391 H2 WAT 4178 61.620 31.783 117.557 1.00 0.00 H TER 6393 WAT 4178 ATOM 6393 O WAT 4179 9.051 13.562 128.154 1.00 0.00 O ATOM 6394 H1 WAT 4179 9.349 14.326 128.648 1.00 0.00 H ATOM 6395 H2 WAT 4179 8.248 13.288 128.598 1.00 0.00 H TER 6397 WAT 4179 ATOM 6397 O WAT 4180 143.387 79.841 128.319 1.00 0.00 O ATOM 6398 H1 WAT 4180 143.013 79.468 129.117 1.00 0.00 H ATOM 6399 H2 WAT 4180 142.784 80.544 128.077 1.00 0.00 H TER 6401 WAT 4180 ATOM 6401 O WAT 4181 46.870 105.502 6.127 1.00 0.00 O ATOM 6402 H1 WAT 4181 47.207 104.782 5.594 1.00 0.00 H ATOM 6403 H2 WAT 4181 46.822 106.244 5.524 1.00 0.00 H TER 6405 WAT 4181 ATOM 6405 O WAT 4182 110.325 123.620 109.296 1.00 0.00 O ATOM 6406 H1 WAT 4182 110.852 124.331 109.662 1.00 0.00 H ATOM 6407 H2 WAT 4182 109.998 123.146 110.061 1.00 0.00 H TER 6409 WAT 4182 ATOM 6409 O WAT 4183 27.932 62.077 82.459 1.00 0.00 O ATOM 6410 H1 WAT 4183 27.107 62.560 82.412 1.00 0.00 H ATOM 6411 H2 WAT 4183 28.602 62.730 82.255 1.00 0.00 H TER 6413 WAT 4183 ATOM 6413 O WAT 4184 80.004 63.531 100.421 1.00 0.00 O ATOM 6414 H1 WAT 4184 80.330 64.030 99.672 1.00 0.00 H ATOM 6415 H2 WAT 4184 79.595 62.757 100.033 1.00 0.00 H TER 6417 WAT 4184 ATOM 6417 O WAT 4185 127.129 104.144 145.831 1.00 0.00 O ATOM 6418 H1 WAT 4185 126.501 104.254 146.546 1.00 0.00 H ATOM 6419 H2 WAT 4185 127.986 104.193 146.255 1.00 0.00 H TER 6421 WAT 4185 ATOM 6421 O WAT 4186 83.970 4.784 7.996 1.00 0.00 O ATOM 6422 H1 WAT 4186 83.832 5.481 8.638 1.00 0.00 H ATOM 6423 H2 WAT 4186 84.687 4.263 8.358 1.00 0.00 H TER 6425 WAT 4186 ATOM 6425 O WAT 4187 125.565 1.169 14.309 1.00 0.00 O ATOM 6426 H1 WAT 4187 125.610 1.146 15.265 1.00 0.00 H ATOM 6427 H2 WAT 4187 125.526 2.100 14.094 1.00 0.00 H TER 6429 WAT 4187 ATOM 6429 O WAT 4188 79.392 36.979 96.499 1.00 0.00 O ATOM 6430 H1 WAT 4188 79.814 37.769 96.162 1.00 0.00 H ATOM 6431 H2 WAT 4188 80.036 36.599 97.097 1.00 0.00 H TER 6433 WAT 4188 ATOM 6433 O WAT 4189 20.392 93.413 141.335 1.00 0.00 O ATOM 6434 H1 WAT 4189 19.644 93.810 141.781 1.00 0.00 H ATOM 6435 H2 WAT 4189 21.031 93.257 142.031 1.00 0.00 H TER 6437 WAT 4189 ATOM 6437 O WAT 4190 118.623 59.268 116.725 1.00 0.00 O ATOM 6438 H1 WAT 4190 118.189 58.611 116.180 1.00 0.00 H ATOM 6439 H2 WAT 4190 118.078 60.050 116.636 1.00 0.00 H TER 6441 WAT 4190 ATOM 6441 O WAT 4191 70.811 40.639 14.869 1.00 0.00 O ATOM 6442 H1 WAT 4191 70.612 39.861 14.348 1.00 0.00 H ATOM 6443 H2 WAT 4191 71.150 40.294 15.695 1.00 0.00 H TER 6445 WAT 4191 ATOM 6445 O WAT 4192 86.058 8.468 64.310 1.00 0.00 O ATOM 6446 H1 WAT 4192 85.589 9.144 63.820 1.00 0.00 H ATOM 6447 H2 WAT 4192 85.370 7.982 64.766 1.00 0.00 H TER 6449 WAT 4192 ATOM 6449 O WAT 4193 62.372 50.890 101.990 1.00 0.00 O ATOM 6450 H1 WAT 4193 62.370 51.255 101.105 1.00 0.00 H ATOM 6451 H2 WAT 4193 61.510 50.485 102.084 1.00 0.00 H TER 6453 WAT 4193 ATOM 6453 O WAT 4194 133.491 87.205 68.401 1.00 0.00 O ATOM 6454 H1 WAT 4194 133.570 86.337 68.797 1.00 0.00 H ATOM 6455 H2 WAT 4194 134.201 87.240 67.760 1.00 0.00 H TER 6457 WAT 4194 ATOM 6457 O WAT 4195 123.015 123.630 85.302 1.00 0.00 O ATOM 6458 H1 WAT 4195 122.993 123.134 86.120 1.00 0.00 H ATOM 6459 H2 WAT 4195 123.104 124.542 85.577 1.00 0.00 H TER 6461 WAT 4195 ATOM 6461 O WAT 4196 5.355 8.220 66.268 1.00 0.00 O ATOM 6462 H1 WAT 4196 5.997 8.901 66.069 1.00 0.00 H ATOM 6463 H2 WAT 4196 5.654 7.457 65.773 1.00 0.00 H TER 6465 WAT 4196 ATOM 6465 O WAT 4197 73.602 145.313 77.566 1.00 0.00 O ATOM 6466 H1 WAT 4197 73.175 145.969 78.117 1.00 0.00 H ATOM 6467 H2 WAT 4197 74.156 145.822 76.974 1.00 0.00 H TER 6469 WAT 4197 ATOM 6469 O WAT 4198 43.926 0.648 120.333 1.00 0.00 O ATOM 6470 H1 WAT 4198 44.542 0.985 119.682 1.00 0.00 H ATOM 6471 H2 WAT 4198 43.080 0.649 119.885 1.00 0.00 H TER 6473 WAT 4198 ATOM 6473 O WAT 4199 34.007 93.411 118.319 1.00 0.00 O ATOM 6474 H1 WAT 4199 34.029 94.049 117.605 1.00 0.00 H ATOM 6475 H2 WAT 4199 34.424 93.861 119.054 1.00 0.00 H TER 6477 WAT 4199 ATOM 6477 O WAT 4200 61.086 22.708 78.598 1.00 0.00 O ATOM 6478 H1 WAT 4200 60.745 23.333 77.958 1.00 0.00 H ATOM 6479 H2 WAT 4200 60.555 21.922 78.471 1.00 0.00 H TER 6481 WAT 4200 ATOM 6481 O WAT 4201 56.775 137.293 60.716 1.00 0.00 O ATOM 6482 H1 WAT 4201 56.230 137.044 59.970 1.00 0.00 H ATOM 6483 H2 WAT 4201 56.201 137.193 61.476 1.00 0.00 H TER 6485 WAT 4201 ATOM 6485 O WAT 4202 13.810 31.012 102.950 1.00 0.00 O ATOM 6486 H1 WAT 4202 13.653 30.357 103.630 1.00 0.00 H ATOM 6487 H2 WAT 4202 13.057 30.933 102.364 1.00 0.00 H TER 6489 WAT 4202 ATOM 6489 O WAT 4203 63.082 117.008 10.354 1.00 0.00 O ATOM 6490 H1 WAT 4203 62.660 117.859 10.470 1.00 0.00 H ATOM 6491 H2 WAT 4203 63.607 117.108 9.559 1.00 0.00 H TER 6493 WAT 4203 ATOM 6493 O WAT 4204 103.139 50.945 142.634 1.00 0.00 O ATOM 6494 H1 WAT 4204 102.528 50.965 141.898 1.00 0.00 H ATOM 6495 H2 WAT 4204 102.638 50.555 143.351 1.00 0.00 H TER 6497 WAT 4204 ATOM 6497 O WAT 4205 63.068 52.642 63.296 1.00 0.00 O ATOM 6498 H1 WAT 4205 63.349 51.783 62.978 1.00 0.00 H ATOM 6499 H2 WAT 4205 62.328 52.874 62.736 1.00 0.00 H TER 6501 WAT 4205 ATOM 6501 O WAT 4206 131.657 42.778 70.258 1.00 0.00 O ATOM 6502 H1 WAT 4206 131.318 42.088 70.828 1.00 0.00 H ATOM 6503 H2 WAT 4206 131.421 43.593 70.702 1.00 0.00 H TER 6505 WAT 4206 ATOM 6505 O WAT 4207 105.894 95.757 1.318 1.00 0.00 O ATOM 6506 H1 WAT 4207 105.073 95.793 1.809 1.00 0.00 H ATOM 6507 H2 WAT 4207 106.006 94.831 1.106 1.00 0.00 H TER 6509 WAT 4207 ATOM 6509 O WAT 4208 67.882 24.099 132.715 1.00 0.00 O ATOM 6510 H1 WAT 4208 68.448 23.385 132.421 1.00 0.00 H ATOM 6511 H2 WAT 4208 67.900 24.730 131.995 1.00 0.00 H TER 6513 WAT 4208 ATOM 6513 O WAT 4209 88.366 142.896 156.561 1.00 0.00 O ATOM 6514 H1 WAT 4209 88.908 142.853 157.349 1.00 0.00 H ATOM 6515 H2 WAT 4209 88.993 142.971 155.842 1.00 0.00 H TER 6517 WAT 4209 ATOM 6517 O WAT 4210 117.319 95.522 132.490 1.00 0.00 O ATOM 6518 H1 WAT 4210 116.911 96.329 132.176 1.00 0.00 H ATOM 6519 H2 WAT 4210 116.754 95.231 133.206 1.00 0.00 H TER 6521 WAT 4210 ATOM 6521 O WAT 4211 106.943 10.030 59.643 1.00 0.00 O ATOM 6522 H1 WAT 4211 106.849 10.406 58.768 1.00 0.00 H ATOM 6523 H2 WAT 4211 107.188 9.118 59.487 1.00 0.00 H TER 6525 WAT 4211 ATOM 6525 O WAT 4212 35.057 109.108 0.445 1.00 0.00 O ATOM 6526 H1 WAT 4212 35.575 108.319 0.605 1.00 0.00 H ATOM 6527 H2 WAT 4212 35.693 109.755 0.141 1.00 0.00 H TER 6529 WAT 4212 ATOM 6529 O WAT 4213 45.554 79.464 96.654 1.00 0.00 O ATOM 6530 H1 WAT 4213 45.707 78.981 95.842 1.00 0.00 H ATOM 6531 H2 WAT 4213 44.757 79.968 96.487 1.00 0.00 H TER 6533 WAT 4213 ATOM 6533 O WAT 4214 132.133 64.665 134.920 1.00 0.00 O ATOM 6534 H1 WAT 4214 132.868 64.228 135.351 1.00 0.00 H ATOM 6535 H2 WAT 4214 131.360 64.356 135.393 1.00 0.00 H TER 6537 WAT 4214 ATOM 6537 O WAT 4215 105.240 84.767 1.596 1.00 0.00 O ATOM 6538 H1 WAT 4215 105.453 84.569 2.508 1.00 0.00 H ATOM 6539 H2 WAT 4215 104.511 84.182 1.387 1.00 0.00 H TER 6541 WAT 4215 ATOM 6541 O WAT 4216 115.845 102.926 147.320 1.00 0.00 O ATOM 6542 H1 WAT 4216 116.694 103.154 147.698 1.00 0.00 H ATOM 6543 H2 WAT 4216 116.055 102.331 146.600 1.00 0.00 H TER 6545 WAT 4216 ATOM 6545 O WAT 4217 50.678 84.697 91.094 1.00 0.00 O ATOM 6546 H1 WAT 4217 50.360 85.600 91.084 1.00 0.00 H ATOM 6547 H2 WAT 4217 49.907 84.168 90.892 1.00 0.00 H TER 6549 WAT 4217 ATOM 6549 O WAT 4218 55.223 96.509 99.807 1.00 0.00 O ATOM 6550 H1 WAT 4218 55.006 95.988 100.580 1.00 0.00 H ATOM 6551 H2 WAT 4218 54.382 96.657 99.374 1.00 0.00 H TER 6553 WAT 4218 ATOM 6553 O WAT 4219 95.262 78.715 150.021 1.00 0.00 O ATOM 6554 H1 WAT 4219 95.376 78.056 149.336 1.00 0.00 H ATOM 6555 H2 WAT 4219 95.689 78.338 150.790 1.00 0.00 H TER 6557 WAT 4219 ATOM 6557 O WAT 4220 6.169 108.458 92.424 1.00 0.00 O ATOM 6558 H1 WAT 4220 6.591 107.759 91.924 1.00 0.00 H ATOM 6559 H2 WAT 4220 5.530 108.834 91.819 1.00 0.00 H TER 6561 WAT 4220 ATOM 6561 O WAT 4221 65.341 83.739 147.693 1.00 0.00 O ATOM 6562 H1 WAT 4221 65.787 83.726 148.540 1.00 0.00 H ATOM 6563 H2 WAT 4221 64.722 84.465 147.760 1.00 0.00 H TER 6565 WAT 4221 ATOM 6565 O WAT 4222 72.894 71.690 151.345 1.00 0.00 O ATOM 6566 H1 WAT 4222 73.608 71.105 151.090 1.00 0.00 H ATOM 6567 H2 WAT 4222 72.161 71.429 150.788 1.00 0.00 H TER 6569 WAT 4222 ATOM 6569 O WAT 4223 129.818 79.555 105.532 1.00 0.00 O ATOM 6570 H1 WAT 4223 129.215 79.987 104.927 1.00 0.00 H ATOM 6571 H2 WAT 4223 129.529 79.838 106.400 1.00 0.00 H TER 6573 WAT 4223 ATOM 6573 O WAT 4224 64.702 10.109 126.941 1.00 0.00 O ATOM 6574 H1 WAT 4224 64.948 10.247 126.026 1.00 0.00 H ATOM 6575 H2 WAT 4224 65.515 10.234 127.429 1.00 0.00 H TER 6577 WAT 4224 ATOM 6577 O WAT 4225 20.249 64.923 99.228 1.00 0.00 O ATOM 6578 H1 WAT 4225 20.476 65.831 99.426 1.00 0.00 H ATOM 6579 H2 WAT 4225 20.044 64.926 98.293 1.00 0.00 H TER 6581 WAT 4225 ATOM 6581 O WAT 4226 38.930 129.910 129.703 1.00 0.00 O ATOM 6582 H1 WAT 4226 38.402 130.329 130.383 1.00 0.00 H ATOM 6583 H2 WAT 4226 39.754 130.397 129.707 1.00 0.00 H TER 6585 WAT 4226 ATOM 6585 O WAT 4227 59.167 126.353 7.792 1.00 0.00 O ATOM 6586 H1 WAT 4227 60.088 126.612 7.762 1.00 0.00 H ATOM 6587 H2 WAT 4227 58.713 127.121 8.139 1.00 0.00 H TER 6589 WAT 4227 ATOM 6589 O WAT 4228 117.515 9.886 130.209 1.00 0.00 O ATOM 6590 H1 WAT 4228 118.170 9.292 130.576 1.00 0.00 H ATOM 6591 H2 WAT 4228 116.689 9.605 130.601 1.00 0.00 H TER 6593 WAT 4228 ATOM 6593 O WAT 4229 82.610 89.542 131.230 1.00 0.00 O ATOM 6594 H1 WAT 4229 82.481 90.197 130.544 1.00 0.00 H ATOM 6595 H2 WAT 4229 83.353 89.868 131.737 1.00 0.00 H TER 6597 WAT 4229 ATOM 6597 O WAT 4230 41.297 72.780 64.759 1.00 0.00 O ATOM 6598 H1 WAT 4230 41.266 72.286 63.940 1.00 0.00 H ATOM 6599 H2 WAT 4230 41.955 72.328 65.287 1.00 0.00 H TER 6601 WAT 4230 ATOM 6601 O WAT 4231 1.694 93.067 19.544 1.00 0.00 O ATOM 6602 H1 WAT 4231 1.642 94.004 19.357 1.00 0.00 H ATOM 6603 H2 WAT 4231 2.631 92.892 19.631 1.00 0.00 H TER 6605 WAT 4231 ATOM 6605 O WAT 4232 90.222 33.851 108.807 1.00 0.00 O ATOM 6606 H1 WAT 4232 89.700 34.349 109.437 1.00 0.00 H ATOM 6607 H2 WAT 4232 90.228 34.395 108.019 1.00 0.00 H TER 6609 WAT 4232 ATOM 6609 O WAT 4233 28.123 97.108 58.076 1.00 0.00 O ATOM 6610 H1 WAT 4233 27.567 97.853 58.308 1.00 0.00 H ATOM 6611 H2 WAT 4233 27.748 96.371 58.557 1.00 0.00 H TER 6613 WAT 4233 ATOM 6613 O WAT 4234 86.349 22.284 94.174 1.00 0.00 O ATOM 6614 H1 WAT 4234 85.444 22.167 94.465 1.00 0.00 H ATOM 6615 H2 WAT 4234 86.295 22.289 93.219 1.00 0.00 H TER 6617 WAT 4234 ATOM 6617 O WAT 4235 135.300 51.572 9.375 1.00 0.00 O ATOM 6618 H1 WAT 4235 135.974 51.730 10.035 1.00 0.00 H ATOM 6619 H2 WAT 4235 134.497 51.442 9.879 1.00 0.00 H TER 6621 WAT 4235 ATOM 6621 O WAT 4236 100.422 72.817 151.510 1.00 0.00 O ATOM 6622 H1 WAT 4236 100.019 73.358 152.190 1.00 0.00 H ATOM 6623 H2 WAT 4236 101.275 73.222 151.357 1.00 0.00 H TER 6625 WAT 4236 ATOM 6625 O WAT 4237 125.507 65.974 0.328 1.00 0.00 O ATOM 6626 H1 WAT 4237 126.141 66.659 0.540 1.00 0.00 H ATOM 6627 H2 WAT 4237 125.859 65.185 0.740 1.00 0.00 H TER 6629 WAT 4237 ATOM 6629 O WAT 4238 104.099 100.751 71.738 1.00 0.00 O ATOM 6630 H1 WAT 4238 105.030 100.876 71.921 1.00 0.00 H ATOM 6631 H2 WAT 4238 104.077 100.098 71.039 1.00 0.00 H TER 6633 WAT 4238 ATOM 6633 O WAT 4239 101.631 135.371 155.977 1.00 0.00 O ATOM 6634 H1 WAT 4239 101.609 136.196 155.493 1.00 0.00 H ATOM 6635 H2 WAT 4239 101.735 135.633 156.892 1.00 0.00 H TER 6637 WAT 4239 ATOM 6637 O WAT 4240 104.204 1.063 5.172 1.00 0.00 O ATOM 6638 H1 WAT 4240 104.674 0.521 5.806 1.00 0.00 H ATOM 6639 H2 WAT 4240 104.886 1.388 4.584 1.00 0.00 H TER 6641 WAT 4240 ATOM 6641 O WAT 4241 139.008 31.108 74.472 1.00 0.00 O ATOM 6642 H1 WAT 4241 138.887 31.258 73.535 1.00 0.00 H ATOM 6643 H2 WAT 4241 138.833 31.958 74.876 1.00 0.00 H TER 6645 WAT 4241 ATOM 6645 O WAT 4242 124.011 134.567 110.891 1.00 0.00 O ATOM 6646 H1 WAT 4242 123.986 134.956 111.765 1.00 0.00 H ATOM 6647 H2 WAT 4242 124.739 135.007 110.453 1.00 0.00 H TER 6649 WAT 4242 ATOM 6649 O WAT 4243 35.000 143.244 139.777 1.00 0.00 O ATOM 6650 H1 WAT 4243 35.750 142.665 139.639 1.00 0.00 H ATOM 6651 H2 WAT 4243 34.299 142.663 140.072 1.00 0.00 H TER 6653 WAT 4243 ATOM 6653 O WAT 4244 86.247 12.856 151.579 1.00 0.00 O ATOM 6654 H1 WAT 4244 85.360 13.140 151.359 1.00 0.00 H ATOM 6655 H2 WAT 4244 86.324 13.016 152.519 1.00 0.00 H TER 6657 WAT 4244 ATOM 6657 O WAT 4245 82.465 54.154 2.285 1.00 0.00 O ATOM 6658 H1 WAT 4245 81.768 53.510 2.409 1.00 0.00 H ATOM 6659 H2 WAT 4245 83.252 53.630 2.133 1.00 0.00 H TER 6661 WAT 4245 ATOM 6661 O WAT 4246 104.347 53.746 10.108 1.00 0.00 O ATOM 6662 H1 WAT 4246 103.928 53.758 9.248 1.00 0.00 H ATOM 6663 H2 WAT 4246 104.173 52.869 10.447 1.00 0.00 H TER 6665 WAT 4246 ATOM 6665 O WAT 4247 98.008 96.827 88.922 1.00 0.00 O ATOM 6666 H1 WAT 4247 97.841 96.157 88.259 1.00 0.00 H ATOM 6667 H2 WAT 4247 97.910 96.369 89.756 1.00 0.00 H TER 6669 WAT 4247 ATOM 6669 O WAT 4248 13.192 114.170 122.686 1.00 0.00 O ATOM 6670 H1 WAT 4248 13.643 113.795 121.930 1.00 0.00 H ATOM 6671 H2 WAT 4248 12.666 114.882 122.323 1.00 0.00 H TER 6673 WAT 4248 ATOM 6673 O WAT 4249 108.849 57.711 19.361 1.00 0.00 O ATOM 6674 H1 WAT 4249 108.641 58.189 20.164 1.00 0.00 H ATOM 6675 H2 WAT 4249 109.797 57.807 19.264 1.00 0.00 H TER 6677 WAT 4249 ATOM 6677 O WAT 4250 125.988 56.762 19.130 1.00 0.00 O ATOM 6678 H1 WAT 4250 126.234 56.988 18.232 1.00 0.00 H ATOM 6679 H2 WAT 4250 126.556 56.026 19.356 1.00 0.00 H TER 6681 WAT 4250 ATOM 6681 O WAT 4251 88.295 97.433 82.975 1.00 0.00 O ATOM 6682 H1 WAT 4251 88.967 97.620 82.319 1.00 0.00 H ATOM 6683 H2 WAT 4251 88.266 96.477 83.023 1.00 0.00 H TER 6685 WAT 4251 ATOM 6685 O WAT 4252 78.885 6.774 3.551 1.00 0.00 O ATOM 6686 H1 WAT 4252 78.352 6.530 4.308 1.00 0.00 H ATOM 6687 H2 WAT 4252 79.284 7.608 3.798 1.00 0.00 H TER 6689 WAT 4252 ATOM 6689 O WAT 4253 102.530 104.955 66.121 1.00 0.00 O ATOM 6690 H1 WAT 4253 103.107 104.972 66.885 1.00 0.00 H ATOM 6691 H2 WAT 4253 103.076 105.276 65.403 1.00 0.00 H TER 6693 WAT 4253 ATOM 6693 O WAT 4254 45.321 51.095 11.402 1.00 0.00 O ATOM 6694 H1 WAT 4254 44.793 51.629 11.996 1.00 0.00 H ATOM 6695 H2 WAT 4254 44.690 50.515 10.977 1.00 0.00 H TER 6697 WAT 4254 ATOM 6697 O WAT 4255 67.722 13.802 11.610 1.00 0.00 O ATOM 6698 H1 WAT 4255 67.186 14.299 10.991 1.00 0.00 H ATOM 6699 H2 WAT 4255 68.002 14.448 12.257 1.00 0.00 H TER 6701 WAT 4255 ATOM 6701 O WAT 4256 131.889 7.760 117.232 1.00 0.00 O ATOM 6702 H1 WAT 4256 132.407 7.032 116.888 1.00 0.00 H ATOM 6703 H2 WAT 4256 131.253 7.949 116.542 1.00 0.00 H TER 6705 WAT 4256 ATOM 6705 O WAT 4257 14.303 110.906 113.054 1.00 0.00 O ATOM 6706 H1 WAT 4257 14.089 110.915 113.986 1.00 0.00 H ATOM 6707 H2 WAT 4257 13.572 111.361 112.635 1.00 0.00 H TER 6709 WAT 4257 ATOM 6709 O WAT 4258 116.228 62.210 25.776 1.00 0.00 O ATOM 6710 H1 WAT 4258 116.356 62.410 24.848 1.00 0.00 H ATOM 6711 H2 WAT 4258 115.963 63.043 26.166 1.00 0.00 H TER 6713 WAT 4258 ATOM 6713 O WAT 4259 5.250 136.742 71.024 1.00 0.00 O ATOM 6714 H1 WAT 4259 4.317 136.666 71.222 1.00 0.00 H ATOM 6715 H2 WAT 4259 5.449 137.668 71.159 1.00 0.00 H TER 6717 WAT 4259 ATOM 6717 O WAT 4260 74.526 100.357 133.741 1.00 0.00 O ATOM 6718 H1 WAT 4260 74.302 100.858 134.525 1.00 0.00 H ATOM 6719 H2 WAT 4260 75.448 100.127 133.859 1.00 0.00 H TER 6721 WAT 4260 ATOM 6721 O WAT 4261 88.276 120.092 102.673 1.00 0.00 O ATOM 6722 H1 WAT 4261 89.001 120.047 102.049 1.00 0.00 H ATOM 6723 H2 WAT 4261 88.170 119.192 102.981 1.00 0.00 H TER 6725 WAT 4261 ATOM 6725 O WAT 4262 115.943 16.017 152.398 1.00 0.00 O ATOM 6726 H1 WAT 4262 115.316 16.738 152.447 1.00 0.00 H ATOM 6727 H2 WAT 4262 116.015 15.826 151.462 1.00 0.00 H TER 6729 WAT 4262 ATOM 6729 O WAT 4263 70.925 109.943 76.039 1.00 0.00 O ATOM 6730 H1 WAT 4263 71.526 109.953 75.293 1.00 0.00 H ATOM 6731 H2 WAT 4263 70.873 110.857 76.317 1.00 0.00 H TER 6733 WAT 4263 ATOM 6733 O WAT 4264 81.074 65.264 86.466 1.00 0.00 O ATOM 6734 H1 WAT 4264 81.540 65.209 87.300 1.00 0.00 H ATOM 6735 H2 WAT 4264 80.152 65.348 86.711 1.00 0.00 H TER 6737 WAT 4264 ATOM 6737 O WAT 4265 60.875 97.257 136.080 1.00 0.00 O ATOM 6738 H1 WAT 4265 61.232 97.471 135.218 1.00 0.00 H ATOM 6739 H2 WAT 4265 61.174 96.364 136.249 1.00 0.00 H TER 6741 WAT 4265 ATOM 6741 O WAT 4266 103.446 14.534 59.942 1.00 0.00 O ATOM 6742 H1 WAT 4266 103.385 13.743 59.407 1.00 0.00 H ATOM 6743 H2 WAT 4266 104.370 14.780 59.902 1.00 0.00 H TER 6745 WAT 4266 ATOM 6745 O WAT 4267 57.451 101.342 128.684 1.00 0.00 O ATOM 6746 H1 WAT 4267 57.327 102.254 128.423 1.00 0.00 H ATOM 6747 H2 WAT 4267 57.947 100.952 127.964 1.00 0.00 H TER 6749 WAT 4267 ATOM 6749 O WAT 4268 118.742 24.340 3.594 1.00 0.00 O ATOM 6750 H1 WAT 4268 118.796 23.481 3.174 1.00 0.00 H ATOM 6751 H2 WAT 4268 117.840 24.396 3.910 1.00 0.00 H TER 6753 WAT 4268 ATOM 6753 O WAT 4269 80.041 129.242 92.437 1.00 0.00 O ATOM 6754 H1 WAT 4269 79.419 129.939 92.646 1.00 0.00 H ATOM 6755 H2 WAT 4269 79.672 128.461 92.850 1.00 0.00 H TER 6757 WAT 4269 ATOM 6757 O WAT 4270 2.166 118.924 75.601 1.00 0.00 O ATOM 6758 H1 WAT 4270 2.335 119.609 76.248 1.00 0.00 H ATOM 6759 H2 WAT 4270 2.459 119.301 74.771 1.00 0.00 H TER 6761 WAT 4270 ATOM 6761 O WAT 4271 61.573 80.120 158.790 1.00 0.00 O ATOM 6762 H1 WAT 4271 61.372 81.046 158.927 1.00 0.00 H ATOM 6763 H2 WAT 4271 62.454 80.118 158.417 1.00 0.00 H TER 6765 WAT 4271 ATOM 6765 O WAT 4272 98.089 136.296 80.590 1.00 0.00 O ATOM 6766 H1 WAT 4272 97.345 136.826 80.876 1.00 0.00 H ATOM 6767 H2 WAT 4272 97.869 135.406 80.867 1.00 0.00 H TER 6769 WAT 4272 ATOM 6769 O WAT 4273 10.662 97.577 150.968 1.00 0.00 O ATOM 6770 H1 WAT 4273 10.198 98.311 150.565 1.00 0.00 H ATOM 6771 H2 WAT 4273 10.314 96.802 150.528 1.00 0.00 H TER 6773 WAT 4273 ATOM 6773 O WAT 4274 99.951 141.388 157.689 1.00 0.00 O ATOM 6774 H1 WAT 4274 100.539 141.645 158.399 1.00 0.00 H ATOM 6775 H2 WAT 4274 100.513 140.926 157.068 1.00 0.00 H TER 6777 WAT 4274 ATOM 6777 O WAT 4275 46.646 68.441 91.703 1.00 0.00 O ATOM 6778 H1 WAT 4275 46.518 68.189 92.618 1.00 0.00 H ATOM 6779 H2 WAT 4275 46.519 67.630 91.211 1.00 0.00 H TER 6781 WAT 4275 ATOM 6781 O WAT 4276 138.773 137.371 141.930 1.00 0.00 O ATOM 6782 H1 WAT 4276 139.493 137.993 141.825 1.00 0.00 H ATOM 6783 H2 WAT 4276 138.121 137.648 141.286 1.00 0.00 H TER 6785 WAT 4276 ATOM 6785 O WAT 4277 47.567 0.620 8.833 1.00 0.00 O ATOM 6786 H1 WAT 4277 47.377 1.514 9.116 1.00 0.00 H ATOM 6787 H2 WAT 4277 48.452 0.666 8.472 1.00 0.00 H TER 6789 WAT 4277 ATOM 6789 O WAT 4278 14.272 110.444 72.509 1.00 0.00 O ATOM 6790 H1 WAT 4278 15.020 110.809 72.982 1.00 0.00 H ATOM 6791 H2 WAT 4278 13.855 109.855 73.138 1.00 0.00 H TER 6793 WAT 4278 ATOM 6793 O WAT 4279 22.388 141.611 127.709 1.00 0.00 O ATOM 6794 H1 WAT 4279 21.721 142.288 127.591 1.00 0.00 H ATOM 6795 H2 WAT 4279 22.730 141.763 128.590 1.00 0.00 H TER 6797 WAT 4279 ATOM 6797 O WAT 4280 130.455 82.003 77.194 1.00 0.00 O ATOM 6798 H1 WAT 4280 130.579 82.222 76.270 1.00 0.00 H ATOM 6799 H2 WAT 4280 129.947 81.192 77.182 1.00 0.00 H TER 6801 WAT 4280 ATOM 6801 O WAT 4281 125.107 101.702 75.096 1.00 0.00 O ATOM 6802 H1 WAT 4281 125.995 101.878 75.408 1.00 0.00 H ATOM 6803 H2 WAT 4281 124.539 102.037 75.790 1.00 0.00 H TER 6805 WAT 4281 ATOM 6805 O WAT 4282 141.953 25.377 91.600 1.00 0.00 O ATOM 6806 H1 WAT 4282 141.565 24.843 90.907 1.00 0.00 H ATOM 6807 H2 WAT 4282 142.885 25.406 91.387 1.00 0.00 H TER 6809 WAT 4282 ATOM 6809 O WAT 4283 66.128 105.530 129.736 1.00 0.00 O ATOM 6810 H1 WAT 4283 65.605 104.748 129.911 1.00 0.00 H ATOM 6811 H2 WAT 4283 65.532 106.259 129.907 1.00 0.00 H TER 6813 WAT 4283 ATOM 6813 O WAT 4284 98.311 129.121 89.091 1.00 0.00 O ATOM 6814 H1 WAT 4284 97.880 129.832 88.618 1.00 0.00 H ATOM 6815 H2 WAT 4284 98.467 129.476 89.967 1.00 0.00 H TER 6817 WAT 4284 ATOM 6817 O WAT 4285 32.317 136.225 139.754 1.00 0.00 O ATOM 6818 H1 WAT 4285 32.855 135.484 139.475 1.00 0.00 H ATOM 6819 H2 WAT 4285 32.852 136.678 140.406 1.00 0.00 H TER 6821 WAT 4285 ATOM 6821 O WAT 4286 140.863 112.066 15.802 1.00 0.00 O ATOM 6822 H1 WAT 4286 141.274 112.303 14.971 1.00 0.00 H ATOM 6823 H2 WAT 4286 140.277 111.342 15.582 1.00 0.00 H TER 6825 WAT 4286 ATOM 6825 O WAT 4287 136.547 49.361 22.774 1.00 0.00 O ATOM 6826 H1 WAT 4287 136.374 50.295 22.888 1.00 0.00 H ATOM 6827 H2 WAT 4287 135.710 48.937 22.962 1.00 0.00 H TER 6829 WAT 4287 ATOM 6829 O WAT 4288 95.039 3.491 124.318 1.00 0.00 O ATOM 6830 H1 WAT 4288 94.600 4.123 124.886 1.00 0.00 H ATOM 6831 H2 WAT 4288 94.840 3.788 123.430 1.00 0.00 H TER 6833 WAT 4288 ATOM 6833 O WAT 4289 122.813 77.421 61.933 1.00 0.00 O ATOM 6834 H1 WAT 4289 122.991 78.118 62.565 1.00 0.00 H ATOM 6835 H2 WAT 4289 121.904 77.171 62.103 1.00 0.00 H TER 6837 WAT 4289 ATOM 6837 O WAT 4290 143.311 101.371 126.078 1.00 0.00 O ATOM 6838 H1 WAT 4290 143.788 101.411 126.907 1.00 0.00 H ATOM 6839 H2 WAT 4290 143.992 101.251 125.416 1.00 0.00 H TER 6841 WAT 4290 ATOM 6841 O WAT 4291 40.665 47.433 126.884 1.00 0.00 O ATOM 6842 H1 WAT 4291 40.294 47.433 127.766 1.00 0.00 H ATOM 6843 H2 WAT 4291 39.904 47.385 126.304 1.00 0.00 H TER 6845 WAT 4291 ATOM 6845 O WAT 4292 79.785 15.954 157.561 1.00 0.00 O ATOM 6846 H1 WAT 4292 80.551 16.180 158.089 1.00 0.00 H ATOM 6847 H2 WAT 4292 79.063 16.429 157.971 1.00 0.00 H TER 6849 WAT 4292 ATOM 6849 O WAT 4293 129.467 134.080 104.623 1.00 0.00 O ATOM 6850 H1 WAT 4293 128.583 133.775 104.827 1.00 0.00 H ATOM 6851 H2 WAT 4293 129.719 133.581 103.846 1.00 0.00 H TER 6853 WAT 4293 ATOM 6853 O WAT 4294 66.085 141.777 83.370 1.00 0.00 O ATOM 6854 H1 WAT 4294 65.677 142.081 82.559 1.00 0.00 H ATOM 6855 H2 WAT 4294 66.870 141.311 83.083 1.00 0.00 H TER 6857 WAT 4294 ATOM 6857 O WAT 4295 58.728 106.076 67.409 1.00 0.00 O ATOM 6858 H1 WAT 4295 59.181 105.344 67.828 1.00 0.00 H ATOM 6859 H2 WAT 4295 59.199 106.211 66.587 1.00 0.00 H TER 6861 WAT 4295 ATOM 6861 O WAT 4296 95.307 17.217 85.919 1.00 0.00 O ATOM 6862 H1 WAT 4296 95.505 16.944 85.023 1.00 0.00 H ATOM 6863 H2 WAT 4296 96.013 17.821 86.148 1.00 0.00 H TER 6865 WAT 4296 ATOM 6865 O WAT 4297 28.358 96.935 94.358 1.00 0.00 O ATOM 6866 H1 WAT 4297 28.352 96.089 94.806 1.00 0.00 H ATOM 6867 H2 WAT 4297 27.442 97.214 94.363 1.00 0.00 H TER 6869 WAT 4297 ATOM 6869 O WAT 4298 100.298 21.448 79.205 1.00 0.00 O ATOM 6870 H1 WAT 4298 99.729 22.035 78.706 1.00 0.00 H ATOM 6871 H2 WAT 4298 100.622 21.986 79.927 1.00 0.00 H TER 6873 WAT 4298 ATOM 6873 O WAT 4299 136.242 113.506 147.875 1.00 0.00 O ATOM 6874 H1 WAT 4299 135.561 114.134 148.116 1.00 0.00 H ATOM 6875 H2 WAT 4299 137.033 114.037 147.778 1.00 0.00 H TER 6877 WAT 4299 ATOM 6877 O WAT 4300 23.276 132.836 139.178 1.00 0.00 O ATOM 6878 H1 WAT 4300 22.372 132.874 139.490 1.00 0.00 H ATOM 6879 H2 WAT 4300 23.256 133.287 138.334 1.00 0.00 H TER 6881 WAT 4300 ATOM 6881 O WAT 4301 71.431 64.268 71.093 1.00 0.00 O ATOM 6882 H1 WAT 4301 71.716 64.476 70.203 1.00 0.00 H ATOM 6883 H2 WAT 4301 70.545 63.923 70.986 1.00 0.00 H TER 6885 WAT 4301 ATOM 6885 O WAT 4302 138.273 54.283 154.190 1.00 0.00 O ATOM 6886 H1 WAT 4302 139.042 53.932 154.639 1.00 0.00 H ATOM 6887 H2 WAT 4302 138.468 54.174 153.260 1.00 0.00 H TER 6889 WAT 4302 ATOM 6889 O WAT 4303 17.044 115.234 81.435 1.00 0.00 O ATOM 6890 H1 WAT 4303 17.757 114.922 80.878 1.00 0.00 H ATOM 6891 H2 WAT 4303 16.479 114.470 81.551 1.00 0.00 H TER 6893 WAT 4303 ATOM 6893 O WAT 4304 111.047 44.493 156.578 1.00 0.00 O ATOM 6894 H1 WAT 4304 111.051 44.876 157.455 1.00 0.00 H ATOM 6895 H2 WAT 4304 111.765 44.933 156.122 1.00 0.00 H TER 6897 WAT 4304 ATOM 6897 O WAT 4305 55.314 43.433 14.231 1.00 0.00 O ATOM 6898 H1 WAT 4305 55.581 43.898 15.024 1.00 0.00 H ATOM 6899 H2 WAT 4305 54.387 43.239 14.368 1.00 0.00 H TER 6901 WAT 4305 ATOM 6901 O WAT 4306 96.742 127.179 16.038 1.00 0.00 O ATOM 6902 H1 WAT 4306 95.910 126.722 15.917 1.00 0.00 H ATOM 6903 H2 WAT 4306 97.405 126.493 15.957 1.00 0.00 H TER 6905 WAT 4306 ATOM 6905 O WAT 4307 129.239 83.527 125.214 1.00 0.00 O ATOM 6906 H1 WAT 4307 128.719 82.969 125.793 1.00 0.00 H ATOM 6907 H2 WAT 4307 128.755 84.352 125.179 1.00 0.00 H TER 6909 WAT 4307 ATOM 6909 O WAT 4308 117.095 68.673 157.843 1.00 0.00 O ATOM 6910 H1 WAT 4308 117.888 68.351 158.271 1.00 0.00 H ATOM 6911 H2 WAT 4308 117.415 69.193 157.106 1.00 0.00 H TER 6913 WAT 4308 ATOM 6913 O WAT 4309 139.989 71.246 149.255 1.00 0.00 O ATOM 6914 H1 WAT 4309 139.820 71.982 148.667 1.00 0.00 H ATOM 6915 H2 WAT 4309 139.178 71.146 149.753 1.00 0.00 H TER 6917 WAT 4309 ATOM 6917 O WAT 4310 142.176 145.399 78.923 1.00 0.00 O ATOM 6918 H1 WAT 4310 142.697 144.672 78.582 1.00 0.00 H ATOM 6919 H2 WAT 4310 141.908 145.888 78.144 1.00 0.00 H TER 6921 WAT 4310 ATOM 6921 O WAT 4311 77.404 85.478 0.922 1.00 0.00 O ATOM 6922 H1 WAT 4311 76.641 86.037 0.768 1.00 0.00 H ATOM 6923 H2 WAT 4311 77.716 85.252 0.046 1.00 0.00 H TER 6925 WAT 4311 ATOM 6925 O WAT 4312 119.794 92.256 102.721 1.00 0.00 O ATOM 6926 H1 WAT 4312 119.075 91.703 102.415 1.00 0.00 H ATOM 6927 H2 WAT 4312 119.604 92.405 103.647 1.00 0.00 H TER 6929 WAT 4312 ATOM 6929 O WAT 4313 31.679 133.982 153.397 1.00 0.00 O ATOM 6930 H1 WAT 4313 31.680 134.036 152.441 1.00 0.00 H ATOM 6931 H2 WAT 4313 32.563 134.246 153.653 1.00 0.00 H TER 6933 WAT 4313 ATOM 6933 O WAT 4314 85.333 136.133 87.493 1.00 0.00 O ATOM 6934 H1 WAT 4314 85.721 136.470 88.301 1.00 0.00 H ATOM 6935 H2 WAT 4314 85.061 135.242 87.711 1.00 0.00 H TER 6937 WAT 4314 ATOM 6937 O WAT 4315 35.024 59.216 72.638 1.00 0.00 O ATOM 6938 H1 WAT 4315 35.247 60.143 72.724 1.00 0.00 H ATOM 6939 H2 WAT 4315 34.085 59.212 72.451 1.00 0.00 H TER 6941 WAT 4315 ATOM 6941 O WAT 4316 106.087 48.278 93.297 1.00 0.00 O ATOM 6942 H1 WAT 4316 106.452 48.400 94.174 1.00 0.00 H ATOM 6943 H2 WAT 4316 105.985 47.330 93.211 1.00 0.00 H TER 6945 WAT 4316 ATOM 6945 O WAT 4317 83.179 136.023 145.369 1.00 0.00 O ATOM 6946 H1 WAT 4317 84.051 135.726 145.631 1.00 0.00 H ATOM 6947 H2 WAT 4317 82.594 135.315 145.640 1.00 0.00 H TER 6949 WAT 4317 ATOM 6949 O WAT 4318 98.086 116.219 111.571 1.00 0.00 O ATOM 6950 H1 WAT 4318 97.759 116.929 111.019 1.00 0.00 H ATOM 6951 H2 WAT 4318 97.944 115.427 111.053 1.00 0.00 H TER 6953 WAT 4318 ATOM 6953 O WAT 4319 35.293 17.128 12.245 1.00 0.00 O ATOM 6954 H1 WAT 4319 34.403 17.481 12.259 1.00 0.00 H ATOM 6955 H2 WAT 4319 35.836 17.835 12.591 1.00 0.00 H TER 6957 WAT 4319 ATOM 6957 O WAT 4320 45.010 135.301 7.434 1.00 0.00 O ATOM 6958 H1 WAT 4320 45.204 134.763 8.201 1.00 0.00 H ATOM 6959 H2 WAT 4320 44.125 135.039 7.177 1.00 0.00 H TER 6961 WAT 4320 ATOM 6961 O WAT 4321 74.462 85.318 143.286 1.00 0.00 O ATOM 6962 H1 WAT 4321 73.780 85.318 143.958 1.00 0.00 H ATOM 6963 H2 WAT 4321 75.282 85.275 143.778 1.00 0.00 H TER 6965 WAT 4321 ATOM 6965 O WAT 4322 114.771 123.219 118.798 1.00 0.00 O ATOM 6966 H1 WAT 4322 114.576 123.709 119.597 1.00 0.00 H ATOM 6967 H2 WAT 4322 115.664 123.478 118.571 1.00 0.00 H TER 6969 WAT 4322 ATOM 6969 O WAT 4323 114.186 74.018 101.444 1.00 0.00 O ATOM 6970 H1 WAT 4323 113.413 73.577 101.091 1.00 0.00 H ATOM 6971 H2 WAT 4323 114.506 74.557 100.721 1.00 0.00 H TER 6973 WAT 4323 ATOM 6973 O WAT 4324 52.738 131.302 8.420 1.00 0.00 O ATOM 6974 H1 WAT 4324 52.183 131.823 9.001 1.00 0.00 H ATOM 6975 H2 WAT 4324 53.444 130.985 8.984 1.00 0.00 H TER 6977 WAT 4324 ATOM 6977 O WAT 4325 1.111 67.253 76.466 1.00 0.00 O ATOM 6978 H1 WAT 4325 0.726 67.232 75.590 1.00 0.00 H ATOM 6979 H2 WAT 4325 0.362 67.191 77.058 1.00 0.00 H TER 6981 WAT 4325 ATOM 6981 O WAT 4326 139.303 84.917 132.451 1.00 0.00 O ATOM 6982 H1 WAT 4326 139.435 85.300 133.318 1.00 0.00 H ATOM 6983 H2 WAT 4326 139.735 84.064 132.497 1.00 0.00 H TER 6985 WAT 4326 ATOM 6985 O WAT 4327 98.831 25.414 144.625 1.00 0.00 O ATOM 6986 H1 WAT 4327 99.588 25.135 144.110 1.00 0.00 H ATOM 6987 H2 WAT 4327 98.855 24.859 145.405 1.00 0.00 H TER 6989 WAT 4327 ATOM 6989 O WAT 4328 133.845 78.127 82.394 1.00 0.00 O ATOM 6990 H1 WAT 4328 134.049 78.883 81.843 1.00 0.00 H ATOM 6991 H2 WAT 4328 134.512 77.479 82.168 1.00 0.00 H TER 6993 WAT 4328 ATOM 6993 O WAT 4329 117.720 144.491 14.232 1.00 0.00 O ATOM 6994 H1 WAT 4329 118.632 144.227 14.352 1.00 0.00 H ATOM 6995 H2 WAT 4329 117.319 144.366 15.092 1.00 0.00 H TER 6997 WAT 4329 ATOM 6997 O WAT 4330 50.354 143.391 67.162 1.00 0.00 O ATOM 6998 H1 WAT 4330 50.834 142.951 66.461 1.00 0.00 H ATOM 6999 H2 WAT 4330 49.432 143.245 66.949 1.00 0.00 H TER 7001 WAT 4330 ATOM 7001 O WAT 4331 55.372 87.934 16.699 1.00 0.00 O ATOM 7002 H1 WAT 4331 54.821 87.921 17.482 1.00 0.00 H ATOM 7003 H2 WAT 4331 56.130 87.398 16.930 1.00 0.00 H TER 7005 WAT 4331 ATOM 7005 O WAT 4332 44.197 45.920 136.139 1.00 0.00 O ATOM 7006 H1 WAT 4332 44.935 45.366 136.390 1.00 0.00 H ATOM 7007 H2 WAT 4332 43.560 45.805 136.845 1.00 0.00 H TER 7009 WAT 4332 ATOM 7009 O WAT 4333 140.359 16.509 131.729 1.00 0.00 O ATOM 7010 H1 WAT 4333 140.120 15.647 132.070 1.00 0.00 H ATOM 7011 H2 WAT 4333 139.828 17.122 132.236 1.00 0.00 H TER 7013 WAT 4333 ATOM 7013 O WAT 4334 104.004 70.459 25.578 1.00 0.00 O ATOM 7014 H1 WAT 4334 103.885 71.409 25.604 1.00 0.00 H ATOM 7015 H2 WAT 4334 103.770 70.213 24.683 1.00 0.00 H TER 7017 WAT 4334 ATOM 7017 O WAT 4335 64.574 22.601 75.772 1.00 0.00 O ATOM 7018 H1 WAT 4335 64.009 23.335 76.014 1.00 0.00 H ATOM 7019 H2 WAT 4335 64.907 22.269 76.605 1.00 0.00 H TER 7021 WAT 4335 ATOM 7021 O WAT 4336 34.112 18.664 116.071 1.00 0.00 O ATOM 7022 H1 WAT 4336 33.581 17.966 115.688 1.00 0.00 H ATOM 7023 H2 WAT 4336 34.670 18.218 116.708 1.00 0.00 H TER 7025 WAT 4336 ATOM 7025 O WAT 4337 39.939 73.325 98.896 1.00 0.00 O ATOM 7026 H1 WAT 4337 40.216 74.235 98.788 1.00 0.00 H ATOM 7027 H2 WAT 4337 40.147 73.118 99.807 1.00 0.00 H TER 7029 WAT 4337 ATOM 7029 O WAT 4338 91.768 136.970 94.229 1.00 0.00 O ATOM 7030 H1 WAT 4338 91.179 136.217 94.186 1.00 0.00 H ATOM 7031 H2 WAT 4338 91.636 137.328 95.107 1.00 0.00 H TER 7033 WAT 4338 ATOM 7033 O WAT 4339 43.012 67.521 121.781 1.00 0.00 O ATOM 7034 H1 WAT 4339 42.426 66.928 121.311 1.00 0.00 H ATOM 7035 H2 WAT 4339 43.869 67.097 121.736 1.00 0.00 H TER 7037 WAT 4339 ATOM 7037 O WAT 4340 124.544 6.706 67.774 1.00 0.00 O ATOM 7038 H1 WAT 4340 125.184 6.658 67.064 1.00 0.00 H ATOM 7039 H2 WAT 4340 123.697 6.749 67.330 1.00 0.00 H TER 7041 WAT 4340 ATOM 7041 O WAT 4341 109.300 84.521 150.041 1.00 0.00 O ATOM 7042 H1 WAT 4341 110.128 84.713 150.481 1.00 0.00 H ATOM 7043 H2 WAT 4341 109.018 85.363 149.683 1.00 0.00 H TER 7045 WAT 4341 ATOM 7045 O WAT 4342 43.470 121.676 16.924 1.00 0.00 O ATOM 7046 H1 WAT 4342 43.808 121.103 17.612 1.00 0.00 H ATOM 7047 H2 WAT 4342 44.250 121.975 16.456 1.00 0.00 H TER 7049 WAT 4342 ATOM 7049 O WAT 4343 63.951 111.747 93.348 1.00 0.00 O ATOM 7050 H1 WAT 4343 64.164 111.203 92.590 1.00 0.00 H ATOM 7051 H2 WAT 4343 64.508 111.409 94.049 1.00 0.00 H TER 7053 WAT 4343 ATOM 7053 O WAT 4344 87.981 52.497 5.764 1.00 0.00 O ATOM 7054 H1 WAT 4344 87.962 53.037 4.974 1.00 0.00 H ATOM 7055 H2 WAT 4344 87.515 51.698 5.520 1.00 0.00 H TER 7057 WAT 4344 ATOM 7057 O WAT 4345 15.526 26.597 142.386 1.00 0.00 O ATOM 7058 H1 WAT 4345 16.146 25.874 142.285 1.00 0.00 H ATOM 7059 H2 WAT 4345 15.693 27.163 141.632 1.00 0.00 H TER 7061 WAT 4345 ATOM 7061 O WAT 4346 1.022 75.932 141.491 1.00 0.00 O ATOM 7062 H1 WAT 4346 0.364 76.260 142.104 1.00 0.00 H ATOM 7063 H2 WAT 4346 0.719 76.230 140.633 1.00 0.00 H TER 7065 WAT 4346 ATOM 7065 O WAT 4347 56.095 57.913 139.737 1.00 0.00 O ATOM 7066 H1 WAT 4347 55.769 57.949 140.636 1.00 0.00 H ATOM 7067 H2 WAT 4347 55.581 57.220 139.323 1.00 0.00 H TER 7069 WAT 4347 ATOM 7069 O WAT 4348 89.463 137.585 136.267 1.00 0.00 O ATOM 7070 H1 WAT 4348 90.227 137.009 136.256 1.00 0.00 H ATOM 7071 H2 WAT 4348 89.637 138.226 135.577 1.00 0.00 H TER 7073 WAT 4348 ATOM 7073 O WAT 4349 114.894 84.331 129.687 1.00 0.00 O ATOM 7074 H1 WAT 4349 115.543 84.699 130.288 1.00 0.00 H ATOM 7075 H2 WAT 4349 115.401 84.071 128.918 1.00 0.00 H TER 7077 WAT 4349 ATOM 7077 O WAT 4350 144.253 95.352 65.878 1.00 0.00 O ATOM 7078 H1 WAT 4350 144.184 95.617 64.961 1.00 0.00 H ATOM 7079 H2 WAT 4350 143.722 94.558 65.938 1.00 0.00 H TER 7081 WAT 4350 ATOM 7081 O WAT 4351 117.040 81.781 132.517 1.00 0.00 O ATOM 7082 H1 WAT 4351 117.290 80.927 132.165 1.00 0.00 H ATOM 7083 H2 WAT 4351 116.122 81.676 132.769 1.00 0.00 H TER 7085 WAT 4351 ATOM 7085 O WAT 4352 100.596 17.829 84.163 1.00 0.00 O ATOM 7086 H1 WAT 4352 101.115 17.029 84.248 1.00 0.00 H ATOM 7087 H2 WAT 4352 101.076 18.358 83.526 1.00 0.00 H TER 7089 WAT 4352 ATOM 7089 O WAT 4353 95.042 113.658 148.622 1.00 0.00 O ATOM 7090 H1 WAT 4353 95.294 113.239 147.799 1.00 0.00 H ATOM 7091 H2 WAT 4353 94.770 112.934 149.185 1.00 0.00 H TER 7093 WAT 4353 ATOM 7093 O WAT 4354 42.588 68.785 54.902 1.00 0.00 O ATOM 7094 H1 WAT 4354 43.174 68.135 54.516 1.00 0.00 H ATOM 7095 H2 WAT 4354 42.358 68.422 55.758 1.00 0.00 H TER 7097 WAT 4354 ATOM 7097 O WAT 4355 7.008 16.029 79.604 1.00 0.00 O ATOM 7098 H1 WAT 4355 7.848 16.275 79.217 1.00 0.00 H ATOM 7099 H2 WAT 4355 6.354 16.384 79.003 1.00 0.00 H TER 7101 WAT 4355 ATOM 7101 O WAT 4356 25.043 55.323 151.200 1.00 0.00 O ATOM 7102 H1 WAT 4356 25.689 55.886 151.626 1.00 0.00 H ATOM 7103 H2 WAT 4356 24.955 54.572 151.786 1.00 0.00 H TER 7105 WAT 4356 ATOM 7105 O WAT 4357 116.885 97.758 124.418 1.00 0.00 O ATOM 7106 H1 WAT 4357 116.003 97.390 124.367 1.00 0.00 H ATOM 7107 H2 WAT 4357 116.800 98.636 124.047 1.00 0.00 H TER 7109 WAT 4357 ATOM 7109 O WAT 4358 72.531 121.104 16.761 1.00 0.00 O ATOM 7110 H1 WAT 4358 71.741 121.292 16.255 1.00 0.00 H ATOM 7111 H2 WAT 4358 72.943 121.959 16.887 1.00 0.00 H TER 7113 WAT 4358 ATOM 7113 O WAT 4359 110.311 98.834 74.338 1.00 0.00 O ATOM 7114 H1 WAT 4359 109.989 98.783 73.438 1.00 0.00 H ATOM 7115 H2 WAT 4359 110.052 98.002 74.733 1.00 0.00 H TER 7117 WAT 4359 ATOM 7117 O WAT 4360 48.091 51.045 133.225 1.00 0.00 O ATOM 7118 H1 WAT 4360 48.045 50.176 132.827 1.00 0.00 H ATOM 7119 H2 WAT 4360 49.028 51.233 133.282 1.00 0.00 H TER 7121 WAT 4360 ATOM 7121 O WAT 4361 40.698 33.205 128.154 1.00 0.00 O ATOM 7122 H1 WAT 4361 40.656 32.434 128.720 1.00 0.00 H ATOM 7123 H2 WAT 4361 40.013 33.784 128.488 1.00 0.00 H TER 7125 WAT 4361 ATOM 7125 O WAT 4362 50.538 56.916 21.358 1.00 0.00 O ATOM 7126 H1 WAT 4362 50.463 57.376 22.194 1.00 0.00 H ATOM 7127 H2 WAT 4362 50.205 56.037 21.537 1.00 0.00 H TER 7129 WAT 4362 ATOM 7129 O WAT 4363 125.616 11.345 101.359 1.00 0.00 O ATOM 7130 H1 WAT 4363 126.338 11.692 101.884 1.00 0.00 H ATOM 7131 H2 WAT 4363 125.675 10.396 101.468 1.00 0.00 H TER 7133 WAT 4363 ATOM 7133 O WAT 4364 10.948 107.079 132.477 1.00 0.00 O ATOM 7134 H1 WAT 4364 10.419 106.287 132.382 1.00 0.00 H ATOM 7135 H2 WAT 4364 10.400 107.673 132.990 1.00 0.00 H TER 7137 WAT 4364 ATOM 7137 O WAT 4365 100.281 71.728 63.446 1.00 0.00 O ATOM 7138 H1 WAT 4365 99.373 71.784 63.743 1.00 0.00 H ATOM 7139 H2 WAT 4365 100.565 70.852 63.708 1.00 0.00 H TER 7141 WAT 4365 ATOM 7141 O WAT 4366 68.473 91.393 114.637 1.00 0.00 O ATOM 7142 H1 WAT 4366 68.844 90.709 114.079 1.00 0.00 H ATOM 7143 H2 WAT 4366 69.074 91.449 115.379 1.00 0.00 H TER 7145 WAT 4366 ATOM 7145 O WAT 4367 75.218 34.909 92.186 1.00 0.00 O ATOM 7146 H1 WAT 4367 75.352 34.936 93.134 1.00 0.00 H ATOM 7147 H2 WAT 4367 74.364 35.321 92.053 1.00 0.00 H TER 7149 WAT 4367 ATOM 7149 O WAT 4368 127.459 15.173 11.079 1.00 0.00 O ATOM 7150 H1 WAT 4368 127.173 14.331 11.434 1.00 0.00 H ATOM 7151 H2 WAT 4368 126.935 15.288 10.286 1.00 0.00 H TER 7153 WAT 4368 ATOM 7153 O WAT 4369 26.107 66.227 89.384 1.00 0.00 O ATOM 7154 H1 WAT 4369 25.436 65.600 89.114 1.00 0.00 H ATOM 7155 H2 WAT 4369 25.613 66.979 89.710 1.00 0.00 H TER 7157 WAT 4369 ATOM 7157 O WAT 4370 142.636 37.452 72.242 1.00 0.00 O ATOM 7158 H1 WAT 4370 143.161 38.130 71.816 1.00 0.00 H ATOM 7159 H2 WAT 4370 143.275 36.801 72.531 1.00 0.00 H TER 7161 WAT 4370 ATOM 7161 O WAT 4371 97.567 67.145 9.432 1.00 0.00 O ATOM 7162 H1 WAT 4371 96.689 67.148 9.814 1.00 0.00 H ATOM 7163 H2 WAT 4371 97.434 66.857 8.529 1.00 0.00 H TER 7165 WAT 4371 ATOM 7165 O WAT 4372 73.085 21.712 60.280 1.00 0.00 O ATOM 7166 H1 WAT 4372 73.569 21.722 61.106 1.00 0.00 H ATOM 7167 H2 WAT 4372 72.465 22.438 60.357 1.00 0.00 H TER 7169 WAT 4372 ATOM 7169 O WAT 4373 93.311 79.858 5.762 1.00 0.00 O ATOM 7170 H1 WAT 4373 93.838 79.060 5.719 1.00 0.00 H ATOM 7171 H2 WAT 4373 93.684 80.427 5.089 1.00 0.00 H TER 7173 WAT 4373 ATOM 7173 O WAT 4374 95.000 103.124 89.864 1.00 0.00 O ATOM 7174 H1 WAT 4374 95.129 102.350 90.412 1.00 0.00 H ATOM 7175 H2 WAT 4374 94.491 103.723 90.410 1.00 0.00 H TER 7177 WAT 4374 ATOM 7177 O WAT 4375 40.983 10.999 9.362 1.00 0.00 O ATOM 7178 H1 WAT 4375 41.372 11.609 8.735 1.00 0.00 H ATOM 7179 H2 WAT 4375 41.169 11.383 10.218 1.00 0.00 H TER 7181 WAT 4375 ATOM 7181 O WAT 4376 121.333 97.186 123.072 1.00 0.00 O ATOM 7182 H1 WAT 4376 120.606 97.166 123.695 1.00 0.00 H ATOM 7183 H2 WAT 4376 122.115 97.269 123.619 1.00 0.00 H TER 7185 WAT 4376 ATOM 7185 O WAT 4377 131.395 92.378 18.200 1.00 0.00 O ATOM 7186 H1 WAT 4377 131.970 93.011 17.772 1.00 0.00 H ATOM 7187 H2 WAT 4377 131.583 91.548 17.762 1.00 0.00 H TER 7189 WAT 4377 ATOM 7189 O WAT 4378 93.513 16.390 0.011 1.00 0.00 O ATOM 7190 H1 WAT 4378 93.885 16.857 0.759 1.00 0.00 H ATOM 7191 H2 WAT 4378 94.228 16.349 -0.625 1.00 0.00 H TER 7193 WAT 4378 ATOM 7193 O WAT 4379 116.126 63.279 126.563 1.00 0.00 O ATOM 7194 H1 WAT 4379 115.908 64.169 126.841 1.00 0.00 H ATOM 7195 H2 WAT 4379 115.468 63.068 125.900 1.00 0.00 H TER 7197 WAT 4379 ATOM 7197 O WAT 4380 34.241 49.984 104.353 1.00 0.00 O ATOM 7198 H1 WAT 4380 34.135 49.786 103.422 1.00 0.00 H ATOM 7199 H2 WAT 4380 33.625 50.698 104.518 1.00 0.00 H TER 7201 WAT 4380 ATOM 7201 O WAT 4381 48.844 93.454 127.342 1.00 0.00 O ATOM 7202 H1 WAT 4381 49.203 92.624 127.657 1.00 0.00 H ATOM 7203 H2 WAT 4381 48.414 93.835 128.107 1.00 0.00 H TER 7205 WAT 4381 ATOM 7205 O WAT 4382 64.109 77.281 122.903 1.00 0.00 O ATOM 7206 H1 WAT 4382 63.862 77.969 122.286 1.00 0.00 H ATOM 7207 H2 WAT 4382 63.733 76.482 122.534 1.00 0.00 H TER 7209 WAT 4382 ATOM 7209 O WAT 4383 3.394 108.145 128.525 1.00 0.00 O ATOM 7210 H1 WAT 4383 3.540 108.956 129.012 1.00 0.00 H ATOM 7211 H2 WAT 4383 3.081 107.523 129.182 1.00 0.00 H TER 7213 WAT 4383 ATOM 7213 O WAT 4384 11.637 132.598 125.397 1.00 0.00 O ATOM 7214 H1 WAT 4384 12.091 132.745 124.567 1.00 0.00 H ATOM 7215 H2 WAT 4384 11.462 133.477 125.733 1.00 0.00 H TER 7217 WAT 4384 ATOM 7217 O WAT 4385 128.042 132.179 122.204 1.00 0.00 O ATOM 7218 H1 WAT 4385 128.659 131.612 121.742 1.00 0.00 H ATOM 7219 H2 WAT 4385 127.204 132.027 121.768 1.00 0.00 H TER 7221 WAT 4385 ATOM 7221 O WAT 4386 58.611 63.009 133.644 1.00 0.00 O ATOM 7222 H1 WAT 4386 58.708 62.767 132.723 1.00 0.00 H ATOM 7223 H2 WAT 4386 58.480 63.957 133.630 1.00 0.00 H TER 7225 WAT 4386 ATOM 7225 O WAT 4387 54.640 120.214 114.444 1.00 0.00 O ATOM 7226 H1 WAT 4387 55.246 120.938 114.602 1.00 0.00 H ATOM 7227 H2 WAT 4387 53.863 120.435 114.958 1.00 0.00 H TER 7229 WAT 4387 ATOM 7229 O WAT 4388 105.462 111.023 114.067 1.00 0.00 O ATOM 7230 H1 WAT 4388 104.816 111.622 113.692 1.00 0.00 H ATOM 7231 H2 WAT 4388 105.322 110.198 113.602 1.00 0.00 H TER 7233 WAT 4388 ATOM 7233 O WAT 4389 36.006 75.310 109.076 1.00 0.00 O ATOM 7234 H1 WAT 4389 36.674 74.680 108.807 1.00 0.00 H ATOM 7235 H2 WAT 4389 36.092 76.032 108.453 1.00 0.00 H TER 7237 WAT 4389 ATOM 7237 O WAT 4390 59.443 82.189 12.235 1.00 0.00 O ATOM 7238 H1 WAT 4390 59.472 83.109 12.497 1.00 0.00 H ATOM 7239 H2 WAT 4390 59.957 81.734 12.902 1.00 0.00 H TER 7241 WAT 4390 ATOM 7241 O WAT 4391 88.841 41.500 14.396 1.00 0.00 O ATOM 7242 H1 WAT 4391 89.629 41.464 14.938 1.00 0.00 H ATOM 7243 H2 WAT 4391 88.126 41.623 15.021 1.00 0.00 H TER 7245 WAT 4391 ATOM 7245 O WAT 4392 115.046 93.374 80.480 1.00 0.00 O ATOM 7246 H1 WAT 4392 115.092 93.015 79.594 1.00 0.00 H ATOM 7247 H2 WAT 4392 114.162 93.160 80.780 1.00 0.00 H TER 7249 WAT 4392 ATOM 7249 O WAT 4393 47.508 44.173 84.893 1.00 0.00 O ATOM 7250 H1 WAT 4393 47.351 43.367 84.400 1.00 0.00 H ATOM 7251 H2 WAT 4393 47.798 44.804 84.234 1.00 0.00 H TER 7253 WAT 4393 ATOM 7253 O WAT 4394 56.612 76.475 59.798 1.00 0.00 O ATOM 7254 H1 WAT 4394 56.082 75.784 59.402 1.00 0.00 H ATOM 7255 H2 WAT 4394 57.279 76.007 60.300 1.00 0.00 H TER 7257 WAT 4394 ATOM 7257 O WAT 4395 69.897 62.319 10.010 1.00 0.00 O ATOM 7258 H1 WAT 4395 69.688 61.863 9.195 1.00 0.00 H ATOM 7259 H2 WAT 4395 70.305 61.651 10.561 1.00 0.00 H TER 7261 WAT 4395 ATOM 7261 O WAT 4396 135.176 143.613 116.777 1.00 0.00 O ATOM 7262 H1 WAT 4396 135.859 143.767 117.430 1.00 0.00 H ATOM 7263 H2 WAT 4396 135.600 143.798 115.939 1.00 0.00 H TER 7265 WAT 4396 ATOM 7265 O WAT 4397 118.855 122.372 10.315 1.00 0.00 O ATOM 7266 H1 WAT 4397 119.197 121.526 10.604 1.00 0.00 H ATOM 7267 H2 WAT 4397 118.539 122.789 11.117 1.00 0.00 H TER 7269 WAT 4397 ATOM 7269 O WAT 4398 4.049 53.243 68.721 1.00 0.00 O ATOM 7270 H1 WAT 4398 4.002 52.396 69.165 1.00 0.00 H ATOM 7271 H2 WAT 4398 4.649 53.762 69.257 1.00 0.00 H TER 7273 WAT 4398 ATOM 7273 O WAT 4399 127.575 82.910 91.291 1.00 0.00 O ATOM 7274 H1 WAT 4399 127.086 83.158 90.506 1.00 0.00 H ATOM 7275 H2 WAT 4399 126.979 82.335 91.772 1.00 0.00 H TER 7277 WAT 4399 ATOM 7277 O WAT 4400 88.122 58.392 106.032 1.00 0.00 O ATOM 7278 H1 WAT 4400 87.799 58.560 105.147 1.00 0.00 H ATOM 7279 H2 WAT 4400 88.376 59.253 106.362 1.00 0.00 H TER 7281 WAT 4400 ATOM 7281 O WAT 4401 85.463 121.326 149.109 1.00 0.00 O ATOM 7282 H1 WAT 4401 84.565 121.633 148.979 1.00 0.00 H ATOM 7283 H2 WAT 4401 85.366 120.427 149.422 1.00 0.00 H TER 7285 WAT 4401 ATOM 7285 O WAT 4402 73.262 25.279 4.424 1.00 0.00 O ATOM 7286 H1 WAT 4402 73.191 26.015 5.032 1.00 0.00 H ATOM 7287 H2 WAT 4402 74.174 24.999 4.494 1.00 0.00 H TER 7289 WAT 4402 ATOM 7289 O WAT 4403 61.330 99.234 103.370 1.00 0.00 O ATOM 7290 H1 WAT 4403 61.984 99.933 103.365 1.00 0.00 H ATOM 7291 H2 WAT 4403 61.618 98.642 104.064 1.00 0.00 H TER 7293 WAT 4403 ATOM 7293 O WAT 4404 32.530 2.582 122.441 1.00 0.00 O ATOM 7294 H1 WAT 4404 31.858 2.150 122.968 1.00 0.00 H ATOM 7295 H2 WAT 4404 32.266 3.502 122.424 1.00 0.00 H TER 7297 WAT 4404 ATOM 7297 O WAT 4405 78.252 55.038 74.635 1.00 0.00 O ATOM 7298 H1 WAT 4405 79.094 55.304 75.005 1.00 0.00 H ATOM 7299 H2 WAT 4405 78.463 54.740 73.750 1.00 0.00 H TER 7301 WAT 4405 ATOM 7301 O WAT 4406 31.277 118.778 149.358 1.00 0.00 O ATOM 7302 H1 WAT 4406 31.829 118.142 149.814 1.00 0.00 H ATOM 7303 H2 WAT 4406 31.016 118.332 148.552 1.00 0.00 H TER 7305 WAT 4406 ATOM 7305 O WAT 4407 41.452 54.680 22.678 1.00 0.00 O ATOM 7306 H1 WAT 4407 42.369 54.474 22.499 1.00 0.00 H ATOM 7307 H2 WAT 4407 41.453 55.615 22.886 1.00 0.00 H TER 7309 WAT 4407 ATOM 7309 O WAT 4408 45.648 35.793 120.591 1.00 0.00 O ATOM 7310 H1 WAT 4408 45.539 35.901 119.646 1.00 0.00 H ATOM 7311 H2 WAT 4408 46.174 34.998 120.682 1.00 0.00 H TER 7313 WAT 4408 ATOM 7313 O WAT 4409 74.321 85.800 100.642 1.00 0.00 O ATOM 7314 H1 WAT 4409 73.626 86.243 100.157 1.00 0.00 H ATOM 7315 H2 WAT 4409 73.958 85.673 101.519 1.00 0.00 H TER 7317 WAT 4409 ATOM 7317 O WAT 4410 132.925 40.381 56.547 1.00 0.00 O ATOM 7318 H1 WAT 4410 133.468 40.866 57.169 1.00 0.00 H ATOM 7319 H2 WAT 4410 132.838 39.510 56.935 1.00 0.00 H TER 7321 WAT 4410 ATOM 7321 O WAT 4411 33.337 131.799 85.173 1.00 0.00 O ATOM 7322 H1 WAT 4411 33.703 131.719 86.054 1.00 0.00 H ATOM 7323 H2 WAT 4411 33.665 132.639 84.853 1.00 0.00 H TER 7325 WAT 4411 ATOM 7325 O WAT 4412 133.239 75.837 76.712 1.00 0.00 O ATOM 7326 H1 WAT 4412 132.293 75.792 76.572 1.00 0.00 H ATOM 7327 H2 WAT 4412 133.618 75.564 75.877 1.00 0.00 H TER 7329 WAT 4412 ATOM 7329 O WAT 4413 44.570 110.914 17.507 1.00 0.00 O ATOM 7330 H1 WAT 4413 43.859 110.574 16.964 1.00 0.00 H ATOM 7331 H2 WAT 4413 44.417 110.528 18.370 1.00 0.00 H TER 7333 WAT 4413 ATOM 7333 O WAT 4414 55.825 136.223 127.961 1.00 0.00 O ATOM 7334 H1 WAT 4414 55.699 136.604 128.831 1.00 0.00 H ATOM 7335 H2 WAT 4414 56.775 136.201 127.845 1.00 0.00 H TER 7337 WAT 4414 ATOM 7337 O WAT 4415 35.141 78.820 122.421 1.00 0.00 O ATOM 7338 H1 WAT 4415 35.669 79.122 123.161 1.00 0.00 H ATOM 7339 H2 WAT 4415 35.751 78.803 121.684 1.00 0.00 H TER 7341 WAT 4415 ATOM 7341 O WAT 4416 144.705 67.687 26.686 1.00 0.00 O ATOM 7342 H1 WAT 4416 144.647 66.765 26.434 1.00 0.00 H ATOM 7343 H2 WAT 4416 145.643 67.879 26.673 1.00 0.00 H TER 7345 WAT 4416 ATOM 7345 O WAT 4417 83.523 74.756 85.782 1.00 0.00 O ATOM 7346 H1 WAT 4417 83.054 75.318 85.165 1.00 0.00 H ATOM 7347 H2 WAT 4417 84.315 74.495 85.313 1.00 0.00 H TER 7349 WAT 4417 ATOM 7349 O WAT 4418 138.678 33.099 139.362 1.00 0.00 O ATOM 7350 H1 WAT 4418 139.374 32.773 139.932 1.00 0.00 H ATOM 7351 H2 WAT 4418 137.868 32.851 139.807 1.00 0.00 H TER 7353 WAT 4418 ATOM 7353 O WAT 4419 79.399 1.927 122.680 1.00 0.00 O ATOM 7354 H1 WAT 4419 80.051 1.891 121.980 1.00 0.00 H ATOM 7355 H2 WAT 4419 79.564 1.143 123.203 1.00 0.00 H TER 7357 WAT 4419 ATOM 7357 O WAT 4420 111.852 91.189 59.130 1.00 0.00 O ATOM 7358 H1 WAT 4420 111.751 91.702 59.932 1.00 0.00 H ATOM 7359 H2 WAT 4420 110.984 91.201 58.727 1.00 0.00 H TER 7361 WAT 4420 ATOM 7361 O WAT 4421 102.192 114.207 58.082 1.00 0.00 O ATOM 7362 H1 WAT 4421 101.754 114.589 57.322 1.00 0.00 H ATOM 7363 H2 WAT 4421 101.750 114.598 58.836 1.00 0.00 H TER 7365 WAT 4421 ATOM 7365 O WAT 4422 130.395 36.956 76.059 1.00 0.00 O ATOM 7366 H1 WAT 4422 130.346 37.003 75.105 1.00 0.00 H ATOM 7367 H2 WAT 4422 129.873 36.187 76.288 1.00 0.00 H TER 7369 WAT 4422 ATOM 7369 O WAT 4423 83.761 39.993 146.991 1.00 0.00 O ATOM 7370 H1 WAT 4423 84.438 39.901 147.662 1.00 0.00 H ATOM 7371 H2 WAT 4423 84.243 40.209 146.193 1.00 0.00 H TER 7373 WAT 4423 ATOM 7373 O WAT 4424 18.641 129.648 59.248 1.00 0.00 O ATOM 7374 H1 WAT 4424 18.337 130.556 59.249 1.00 0.00 H ATOM 7375 H2 WAT 4424 18.579 129.375 58.333 1.00 0.00 H TER 7377 WAT 4424 ATOM 7377 O WAT 4425 32.607 22.455 116.121 1.00 0.00 O ATOM 7378 H1 WAT 4425 32.694 23.255 115.602 1.00 0.00 H ATOM 7379 H2 WAT 4425 32.402 22.762 117.004 1.00 0.00 H TER 7381 WAT 4425 ATOM 7381 O WAT 4426 71.001 107.954 134.661 1.00 0.00 O ATOM 7382 H1 WAT 4426 70.742 108.590 133.994 1.00 0.00 H ATOM 7383 H2 WAT 4426 70.914 108.427 135.489 1.00 0.00 H TER 7385 WAT 4426 ATOM 7385 O WAT 4427 10.369 118.457 154.766 1.00 0.00 O ATOM 7386 H1 WAT 4427 9.520 118.769 155.079 1.00 0.00 H ATOM 7387 H2 WAT 4427 10.158 117.713 154.202 1.00 0.00 H TER 7389 WAT 4427 ATOM 7389 O WAT 4428 120.744 103.711 9.708 1.00 0.00 O ATOM 7390 H1 WAT 4428 120.502 104.375 10.354 1.00 0.00 H ATOM 7391 H2 WAT 4428 120.118 103.832 8.994 1.00 0.00 H TER 7393 WAT 4428 ATOM 7393 O WAT 4429 111.321 130.580 130.744 1.00 0.00 O ATOM 7394 H1 WAT 4429 110.589 131.037 130.332 1.00 0.00 H ATOM 7395 H2 WAT 4429 111.362 129.737 130.293 1.00 0.00 H TER 7397 WAT 4429 ATOM 7397 O WAT 4430 78.551 126.129 106.702 1.00 0.00 O ATOM 7398 H1 WAT 4430 78.809 127.050 106.751 1.00 0.00 H ATOM 7399 H2 WAT 4430 77.665 126.148 106.342 1.00 0.00 H TER 7401 WAT 4430 ATOM 7401 O WAT 4431 106.179 100.095 88.776 1.00 0.00 O ATOM 7402 H1 WAT 4431 106.087 99.417 88.107 1.00 0.00 H ATOM 7403 H2 WAT 4431 106.932 100.612 88.491 1.00 0.00 H TER 7405 WAT 4431 ATOM 7405 O WAT 4432 110.630 45.654 95.401 1.00 0.00 O ATOM 7406 H1 WAT 4432 111.508 46.026 95.308 1.00 0.00 H ATOM 7407 H2 WAT 4432 110.383 45.398 94.513 1.00 0.00 H TER 7409 WAT 4432 ATOM 7409 O WAT 4433 123.596 38.699 56.825 1.00 0.00 O ATOM 7410 H1 WAT 4433 122.908 38.753 56.161 1.00 0.00 H ATOM 7411 H2 WAT 4433 123.426 37.872 57.277 1.00 0.00 H TER 7413 WAT 4433 ATOM 7413 O WAT 4434 128.520 107.192 146.775 1.00 0.00 O ATOM 7414 H1 WAT 4434 129.188 107.797 147.097 1.00 0.00 H ATOM 7415 H2 WAT 4434 127.928 107.070 147.517 1.00 0.00 H TER 7417 WAT 4434 ATOM 7417 O WAT 4435 52.234 9.647 102.041 1.00 0.00 O ATOM 7418 H1 WAT 4435 51.628 9.517 102.770 1.00 0.00 H ATOM 7419 H2 WAT 4435 51.729 10.142 101.396 1.00 0.00 H TER 7421 WAT 4435 ATOM 7421 O WAT 4436 120.504 128.709 75.477 1.00 0.00 O ATOM 7422 H1 WAT 4436 119.937 128.222 76.075 1.00 0.00 H ATOM 7423 H2 WAT 4436 120.018 128.732 74.652 1.00 0.00 H TER 7425 WAT 4436 ATOM 7425 O WAT 4437 37.410 104.059 82.288 1.00 0.00 O ATOM 7426 H1 WAT 4437 38.002 104.473 81.660 1.00 0.00 H ATOM 7427 H2 WAT 4437 37.073 104.784 82.814 1.00 0.00 H TER 7429 WAT 4437 ATOM 7429 O WAT 4438 88.126 72.508 65.347 1.00 0.00 O ATOM 7430 H1 WAT 4438 87.766 73.386 65.466 1.00 0.00 H ATOM 7431 H2 WAT 4438 88.704 72.382 66.100 1.00 0.00 H TER 7433 WAT 4438 ATOM 7433 O WAT 4439 117.102 100.252 94.891 1.00 0.00 O ATOM 7434 H1 WAT 4439 116.851 100.240 95.815 1.00 0.00 H ATOM 7435 H2 WAT 4439 117.588 99.437 94.765 1.00 0.00 H TER 7437 WAT 4439 ATOM 7437 O WAT 4440 80.738 13.867 116.441 1.00 0.00 O ATOM 7438 H1 WAT 4440 80.207 13.880 115.644 1.00 0.00 H ATOM 7439 H2 WAT 4440 81.458 13.269 116.239 1.00 0.00 H TER 7441 WAT 4440 ATOM 7441 O WAT 4441 52.956 18.868 12.025 1.00 0.00 O ATOM 7442 H1 WAT 4441 53.257 18.224 12.665 1.00 0.00 H ATOM 7443 H2 WAT 4441 52.761 19.649 12.544 1.00 0.00 H TER 7445 WAT 4441 ATOM 7445 O WAT 4442 109.229 130.988 151.973 1.00 0.00 O ATOM 7446 H1 WAT 4442 109.087 131.264 151.067 1.00 0.00 H ATOM 7447 H2 WAT 4442 109.247 131.805 152.472 1.00 0.00 H TER 7449 WAT 4442 ATOM 7449 O WAT 4443 83.882 34.501 69.561 1.00 0.00 O ATOM 7450 H1 WAT 4443 84.307 33.677 69.799 1.00 0.00 H ATOM 7451 H2 WAT 4443 83.112 34.238 69.057 1.00 0.00 H TER 7453 WAT 4443 ATOM 7453 O WAT 4444 57.981 108.012 89.488 1.00 0.00 O ATOM 7454 H1 WAT 4444 57.748 107.821 88.579 1.00 0.00 H ATOM 7455 H2 WAT 4444 57.422 107.433 90.005 1.00 0.00 H TER 7457 WAT 4444 ATOM 7457 O WAT 4445 64.624 18.500 9.373 1.00 0.00 O ATOM 7458 H1 WAT 4445 63.903 19.114 9.230 1.00 0.00 H ATOM 7459 H2 WAT 4445 64.631 17.953 8.588 1.00 0.00 H TER 7461 WAT 4445 ATOM 7461 O WAT 4446 58.300 71.224 77.297 1.00 0.00 O ATOM 7462 H1 WAT 4446 58.278 71.317 78.249 1.00 0.00 H ATOM 7463 H2 WAT 4446 57.379 71.179 77.039 1.00 0.00 H TER 7465 WAT 4446 ATOM 7465 O WAT 4447 20.919 139.436 73.364 1.00 0.00 O ATOM 7466 H1 WAT 4447 21.583 140.036 73.022 1.00 0.00 H ATOM 7467 H2 WAT 4447 20.087 139.809 73.074 1.00 0.00 H TER 7469 WAT 4447 ATOM 7469 O WAT 4448 84.097 136.714 137.068 1.00 0.00 O ATOM 7470 H1 WAT 4448 85.041 136.772 136.920 1.00 0.00 H ATOM 7471 H2 WAT 4448 83.902 135.779 137.008 1.00 0.00 H TER 7473 WAT 4448 ATOM 7473 O WAT 4449 84.490 2.578 150.163 1.00 0.00 O ATOM 7474 H1 WAT 4449 83.862 2.021 149.703 1.00 0.00 H ATOM 7475 H2 WAT 4449 85.300 2.491 149.660 1.00 0.00 H TER 7477 WAT 4449 ATOM 7477 O WAT 4450 50.047 79.643 64.227 1.00 0.00 O ATOM 7478 H1 WAT 4450 49.550 79.086 63.627 1.00 0.00 H ATOM 7479 H2 WAT 4450 50.890 79.200 64.322 1.00 0.00 H TER 7481 WAT 4450 ATOM 7481 O WAT 4451 32.410 42.994 123.789 1.00 0.00 O ATOM 7482 H1 WAT 4451 32.322 42.355 123.082 1.00 0.00 H ATOM 7483 H2 WAT 4451 33.321 42.912 124.074 1.00 0.00 H TER 7485 WAT 4451 ATOM 7485 O WAT 4452 79.657 2.609 22.721 1.00 0.00 O ATOM 7486 H1 WAT 4452 80.525 2.424 23.080 1.00 0.00 H ATOM 7487 H2 WAT 4452 79.061 2.480 23.458 1.00 0.00 H TER 7489 WAT 4452 ATOM 7489 O WAT 4453 57.368 118.762 113.924 1.00 0.00 O ATOM 7490 H1 WAT 4453 56.457 118.903 114.183 1.00 0.00 H ATOM 7491 H2 WAT 4453 57.708 118.144 114.572 1.00 0.00 H TER 7493 WAT 4453 ATOM 7493 O WAT 4454 37.658 89.713 17.178 1.00 0.00 O ATOM 7494 H1 WAT 4454 36.800 89.288 17.183 1.00 0.00 H ATOM 7495 H2 WAT 4454 38.232 89.099 17.636 1.00 0.00 H TER 7497 WAT 4454 ATOM 7497 O WAT 4455 76.966 13.935 117.231 1.00 0.00 O ATOM 7498 H1 WAT 4455 77.338 14.816 117.287 1.00 0.00 H ATOM 7499 H2 WAT 4455 76.729 13.834 116.310 1.00 0.00 H TER 7501 WAT 4455 ATOM 7501 O WAT 4456 52.258 1.237 126.035 1.00 0.00 O ATOM 7502 H1 WAT 4456 52.482 1.704 126.840 1.00 0.00 H ATOM 7503 H2 WAT 4456 53.043 1.309 125.490 1.00 0.00 H TER 7505 WAT 4456 ATOM 7505 O WAT 4457 75.318 128.142 151.237 1.00 0.00 O ATOM 7506 H1 WAT 4457 74.725 128.819 150.911 1.00 0.00 H ATOM 7507 H2 WAT 4457 74.812 127.332 151.175 1.00 0.00 H TER 7509 WAT 4457 ATOM 7509 O WAT 4458 85.532 19.236 62.549 1.00 0.00 O ATOM 7510 H1 WAT 4458 85.500 19.662 63.406 1.00 0.00 H ATOM 7511 H2 WAT 4458 84.787 19.601 62.073 1.00 0.00 H TER 7513 WAT 4458 ATOM 7513 O WAT 4459 125.310 44.064 66.535 1.00 0.00 O ATOM 7514 H1 WAT 4459 125.296 43.355 65.892 1.00 0.00 H ATOM 7515 H2 WAT 4459 124.992 43.660 67.343 1.00 0.00 H TER 7517 WAT 4459 ATOM 7517 O WAT 4460 0.363 114.138 79.462 1.00 0.00 O ATOM 7518 H1 WAT 4460 0.716 113.430 80.001 1.00 0.00 H ATOM 7519 H2 WAT 4460 -0.584 114.091 79.594 1.00 0.00 H TER 7521 WAT 4460 ATOM 7521 O WAT 4461 87.250 62.884 57.391 1.00 0.00 O ATOM 7522 H1 WAT 4461 86.554 62.395 57.830 1.00 0.00 H ATOM 7523 H2 WAT 4461 88.024 62.327 57.475 1.00 0.00 H TER 7525 WAT 4461 ATOM 7525 O WAT 4462 17.227 43.513 18.692 1.00 0.00 O ATOM 7526 H1 WAT 4462 18.123 43.724 18.953 1.00 0.00 H ATOM 7527 H2 WAT 4462 17.319 43.093 17.837 1.00 0.00 H TER 7529 WAT 4462 ATOM 7529 O WAT 4463 89.200 119.531 70.723 1.00 0.00 O ATOM 7530 H1 WAT 4463 89.121 118.625 70.425 1.00 0.00 H ATOM 7531 H2 WAT 4463 89.229 120.048 69.918 1.00 0.00 H TER 7533 WAT 4463 ATOM 7533 O WAT 4464 79.817 70.639 86.031 1.00 0.00 O ATOM 7534 H1 WAT 4464 78.879 70.555 85.857 1.00 0.00 H ATOM 7535 H2 WAT 4464 80.158 69.749 85.938 1.00 0.00 H TER 7537 WAT 4464 ATOM 7537 O WAT 4465 27.843 80.620 151.389 1.00 0.00 O ATOM 7538 H1 WAT 4465 28.006 79.887 151.982 1.00 0.00 H ATOM 7539 H2 WAT 4465 26.910 80.560 151.185 1.00 0.00 H TER 7541 WAT 4465 ATOM 7541 O WAT 4466 124.532 134.223 17.791 1.00 0.00 O ATOM 7542 H1 WAT 4466 124.560 133.924 18.700 1.00 0.00 H ATOM 7543 H2 WAT 4466 125.028 133.564 17.306 1.00 0.00 H TER 7545 WAT 4466 ATOM 7545 O WAT 4467 43.914 6.331 66.895 1.00 0.00 O ATOM 7546 H1 WAT 4467 44.613 6.382 67.546 1.00 0.00 H ATOM 7547 H2 WAT 4467 43.111 6.485 67.392 1.00 0.00 H TER 7549 WAT 4467 ATOM 7549 O WAT 4468 133.783 3.506 147.444 1.00 0.00 O ATOM 7550 H1 WAT 4468 132.882 3.638 147.741 1.00 0.00 H ATOM 7551 H2 WAT 4468 134.173 4.379 147.466 1.00 0.00 H TER 7553 WAT 4468 ATOM 7553 O WAT 4469 79.635 125.892 90.748 1.00 0.00 O ATOM 7554 H1 WAT 4469 78.760 125.623 90.470 1.00 0.00 H ATOM 7555 H2 WAT 4469 79.518 126.196 91.648 1.00 0.00 H TER 7557 WAT 4469 ATOM 7557 O WAT 4470 13.742 77.364 93.992 1.00 0.00 O ATOM 7558 H1 WAT 4470 13.102 77.039 93.359 1.00 0.00 H ATOM 7559 H2 WAT 4470 14.032 76.582 94.463 1.00 0.00 H TER 7561 WAT 4470 ATOM 7561 O WAT 4471 81.405 75.498 7.616 1.00 0.00 O ATOM 7562 H1 WAT 4471 81.540 76.446 7.621 1.00 0.00 H ATOM 7563 H2 WAT 4471 80.677 75.363 7.009 1.00 0.00 H TER 7565 WAT 4471 ATOM 7565 O WAT 4472 114.920 0.930 84.478 1.00 0.00 O ATOM 7566 H1 WAT 4472 114.927 0.012 84.208 1.00 0.00 H ATOM 7567 H2 WAT 4472 115.395 1.387 83.784 1.00 0.00 H TER 7569 WAT 4472 ATOM 7569 O WAT 4473 142.511 110.267 88.311 1.00 0.00 O ATOM 7570 H1 WAT 4473 143.054 110.618 89.017 1.00 0.00 H ATOM 7571 H2 WAT 4473 143.080 109.645 87.858 1.00 0.00 H TER 7573 WAT 4473 ATOM 7573 O WAT 4474 105.561 144.194 93.820 1.00 0.00 O ATOM 7574 H1 WAT 4474 104.786 144.506 93.353 1.00 0.00 H ATOM 7575 H2 WAT 4474 105.221 143.561 94.452 1.00 0.00 H TER 7577 WAT 4474 ATOM 7577 O WAT 4475 133.935 108.677 153.485 1.00 0.00 O ATOM 7578 H1 WAT 4475 133.064 108.778 153.868 1.00 0.00 H ATOM 7579 H2 WAT 4475 133.807 108.842 152.551 1.00 0.00 H TER 7581 WAT 4475 ATOM 7581 O WAT 4476 30.278 50.516 75.339 1.00 0.00 O ATOM 7582 H1 WAT 4476 30.557 50.949 74.532 1.00 0.00 H ATOM 7583 H2 WAT 4476 30.027 51.233 75.921 1.00 0.00 H TER 7585 WAT 4476 ATOM 7585 O WAT 4477 77.678 1.334 76.035 1.00 0.00 O ATOM 7586 H1 WAT 4477 77.482 1.369 76.971 1.00 0.00 H ATOM 7587 H2 WAT 4477 77.643 2.247 75.749 1.00 0.00 H TER 7589 WAT 4477 ATOM 7589 O WAT 4478 128.271 128.042 122.107 1.00 0.00 O ATOM 7590 H1 WAT 4478 127.404 128.445 122.152 1.00 0.00 H ATOM 7591 H2 WAT 4478 128.203 127.406 121.395 1.00 0.00 H TER 7593 WAT 4478 ATOM 7593 O WAT 4479 83.338 143.587 6.873 1.00 0.00 O ATOM 7594 H1 WAT 4479 83.507 144.015 6.034 1.00 0.00 H ATOM 7595 H2 WAT 4479 84.113 143.779 7.401 1.00 0.00 H TER 7597 WAT 4479 ATOM 7597 O WAT 4480 137.175 26.369 66.939 1.00 0.00 O ATOM 7598 H1 WAT 4480 137.201 26.751 67.816 1.00 0.00 H ATOM 7599 H2 WAT 4480 138.095 26.249 66.703 1.00 0.00 H TER 7601 WAT 4480 ATOM 7601 O WAT 4481 11.263 17.117 5.064 1.00 0.00 O ATOM 7602 H1 WAT 4481 11.703 16.303 5.309 1.00 0.00 H ATOM 7603 H2 WAT 4481 10.939 17.473 5.892 1.00 0.00 H TER 7605 WAT 4481 ATOM 7605 O WAT 4482 41.702 2.418 75.313 1.00 0.00 O ATOM 7606 H1 WAT 4482 41.743 3.188 75.881 1.00 0.00 H ATOM 7607 H2 WAT 4482 41.590 2.777 74.432 1.00 0.00 H TER 7609 WAT 4482 ATOM 7609 O WAT 4483 125.747 56.375 82.847 1.00 0.00 O ATOM 7610 H1 WAT 4483 125.294 57.143 82.499 1.00 0.00 H ATOM 7611 H2 WAT 4483 126.349 56.729 83.502 1.00 0.00 H TER 7613 WAT 4483 ATOM 7613 O WAT 4484 95.810 53.398 98.248 1.00 0.00 O ATOM 7614 H1 WAT 4484 95.853 54.137 97.641 1.00 0.00 H ATOM 7615 H2 WAT 4484 94.978 53.514 98.708 1.00 0.00 H TER 7617 WAT 4484 ATOM 7617 O WAT 4485 75.699 75.251 12.123 1.00 0.00 O ATOM 7618 H1 WAT 4485 76.156 76.091 12.159 1.00 0.00 H ATOM 7619 H2 WAT 4485 74.988 75.337 12.757 1.00 0.00 H TER 7621 WAT 4485 ATOM 7621 O WAT 4486 105.979 22.831 123.035 1.00 0.00 O ATOM 7622 H1 WAT 4486 105.742 22.920 123.958 1.00 0.00 H ATOM 7623 H2 WAT 4486 105.148 22.665 122.589 1.00 0.00 H TER 7625 WAT 4486 ATOM 7625 O WAT 4487 81.746 126.710 0.639 1.00 0.00 O ATOM 7626 H1 WAT 4487 81.788 125.762 0.516 1.00 0.00 H ATOM 7627 H2 WAT 4487 80.845 126.942 0.414 1.00 0.00 H TER 7629 WAT 4487 ATOM 7629 O WAT 4488 1.660 13.202 127.322 1.00 0.00 O ATOM 7630 H1 WAT 4488 1.246 14.063 127.273 1.00 0.00 H ATOM 7631 H2 WAT 4488 1.717 12.911 126.412 1.00 0.00 H TER 7633 WAT 4488 ATOM 7633 O WAT 4489 125.697 144.530 149.000 1.00 0.00 O ATOM 7634 H1 WAT 4489 126.508 145.006 149.178 1.00 0.00 H ATOM 7635 H2 WAT 4489 125.985 143.662 148.717 1.00 0.00 H TER 7637 WAT 4489 ATOM 7637 O WAT 4490 92.020 66.180 13.560 1.00 0.00 O ATOM 7638 H1 WAT 4490 92.884 66.185 13.149 1.00 0.00 H ATOM 7639 H2 WAT 4490 92.038 65.422 14.145 1.00 0.00 H TER 7641 WAT 4490 ATOM 7641 O WAT 4491 116.390 118.067 158.034 1.00 0.00 O ATOM 7642 H1 WAT 4491 116.462 117.948 157.087 1.00 0.00 H ATOM 7643 H2 WAT 4491 115.450 118.016 158.211 1.00 0.00 H TER 7645 WAT 4491 ATOM 7645 O WAT 4492 103.168 27.249 112.443 1.00 0.00 O ATOM 7646 H1 WAT 4492 102.369 27.502 111.980 1.00 0.00 H ATOM 7647 H2 WAT 4492 103.794 27.944 112.239 1.00 0.00 H TER 7649 WAT 4492 ATOM 7649 O WAT 4493 19.780 3.761 79.800 1.00 0.00 O ATOM 7650 H1 WAT 4493 18.939 3.325 79.936 1.00 0.00 H ATOM 7651 H2 WAT 4493 19.665 4.630 80.184 1.00 0.00 H TER 7653 WAT 4493 ATOM 7653 O WAT 4494 127.322 127.627 108.039 1.00 0.00 O ATOM 7654 H1 WAT 4494 127.699 128.370 107.566 1.00 0.00 H ATOM 7655 H2 WAT 4494 126.808 128.026 108.741 1.00 0.00 H TER 7657 WAT 4494 ATOM 7657 O WAT 4495 101.369 79.260 124.871 1.00 0.00 O ATOM 7658 H1 WAT 4495 101.287 78.369 124.529 1.00 0.00 H ATOM 7659 H2 WAT 4495 102.045 79.664 124.328 1.00 0.00 H TER 7661 WAT 4495 ATOM 7661 O WAT 4496 82.441 80.453 148.214 1.00 0.00 O ATOM 7662 H1 WAT 4496 82.638 80.653 149.129 1.00 0.00 H ATOM 7663 H2 WAT 4496 83.234 80.699 147.739 1.00 0.00 H TER 7665 WAT 4496 ATOM 7665 O WAT 4497 36.570 78.117 93.167 1.00 0.00 O ATOM 7666 H1 WAT 4497 35.852 77.519 92.961 1.00 0.00 H ATOM 7667 H2 WAT 4497 36.190 78.746 93.780 1.00 0.00 H TER 7669 WAT 4497 ATOM 7669 O WAT 4498 63.977 39.231 82.576 1.00 0.00 O ATOM 7670 H1 WAT 4498 64.332 39.150 81.691 1.00 0.00 H ATOM 7671 H2 WAT 4498 63.217 39.805 82.477 1.00 0.00 H TER 7673 WAT 4498 ATOM 7673 O WAT 4499 55.757 41.202 18.270 1.00 0.00 O ATOM 7674 H1 WAT 4499 55.293 40.425 17.961 1.00 0.00 H ATOM 7675 H2 WAT 4499 55.102 41.900 18.240 1.00 0.00 H TER 7677 WAT 4499 ATOM 7677 O WAT 4500 138.321 20.946 116.787 1.00 0.00 O ATOM 7678 H1 WAT 4500 138.639 21.624 116.190 1.00 0.00 H ATOM 7679 H2 WAT 4500 138.525 21.282 117.660 1.00 0.00 H TER 7681 WAT 4500 ATOM 7681 O WAT 4501 92.795 2.669 106.735 1.00 0.00 O ATOM 7682 H1 WAT 4501 92.456 1.990 106.151 1.00 0.00 H ATOM 7683 H2 WAT 4501 93.530 3.051 106.256 1.00 0.00 H TER 7685 WAT 4501 ATOM 7685 O WAT 4502 44.540 100.379 80.598 1.00 0.00 O ATOM 7686 H1 WAT 4502 44.373 101.086 79.975 1.00 0.00 H ATOM 7687 H2 WAT 4502 45.381 100.604 80.996 1.00 0.00 H TER 7689 WAT 4502 ATOM 7689 O WAT 4503 117.271 5.473 88.112 1.00 0.00 O ATOM 7690 H1 WAT 4503 118.207 5.411 87.923 1.00 0.00 H ATOM 7691 H2 WAT 4503 117.216 5.427 89.066 1.00 0.00 H TER 7693 WAT 4503 ATOM 7693 O WAT 4504 65.936 48.085 3.997 1.00 0.00 O ATOM 7694 H1 WAT 4504 66.108 49.009 3.813 1.00 0.00 H ATOM 7695 H2 WAT 4504 65.371 48.096 4.769 1.00 0.00 H TER 7697 WAT 4504 ATOM 7697 O WAT 4505 134.232 96.374 67.473 1.00 0.00 O ATOM 7698 H1 WAT 4505 133.595 97.085 67.406 1.00 0.00 H ATOM 7699 H2 WAT 4505 134.353 96.248 68.414 1.00 0.00 H TER 7701 WAT 4505 ATOM 7701 O WAT 4506 62.005 37.496 145.988 1.00 0.00 O ATOM 7702 H1 WAT 4506 61.814 36.599 145.713 1.00 0.00 H ATOM 7703 H2 WAT 4506 61.549 38.044 145.350 1.00 0.00 H TER 7705 WAT 4506 ATOM 7705 O WAT 4507 109.425 30.387 136.540 1.00 0.00 O ATOM 7706 H1 WAT 4507 109.318 31.314 136.330 1.00 0.00 H ATOM 7707 H2 WAT 4507 109.863 30.383 137.391 1.00 0.00 H TER 7709 WAT 4507 ATOM 7709 O WAT 4508 112.387 142.803 98.074 1.00 0.00 O ATOM 7710 H1 WAT 4508 112.460 142.768 97.120 1.00 0.00 H ATOM 7711 H2 WAT 4508 111.453 142.688 98.247 1.00 0.00 H TER 7713 WAT 4508 ATOM 7713 O WAT 4509 96.407 120.514 125.070 1.00 0.00 O ATOM 7714 H1 WAT 4509 96.973 121.090 125.584 1.00 0.00 H ATOM 7715 H2 WAT 4509 96.878 119.681 125.038 1.00 0.00 H TER 7717 WAT 4509 ATOM 7717 O WAT 4510 92.377 125.381 22.034 1.00 0.00 O ATOM 7718 H1 WAT 4510 92.121 124.464 22.138 1.00 0.00 H ATOM 7719 H2 WAT 4510 91.708 125.872 22.509 1.00 0.00 H TER 7721 WAT 4510 ATOM 7721 O WAT 4511 104.229 145.537 112.534 1.00 0.00 O ATOM 7722 H1 WAT 4511 104.647 145.383 111.687 1.00 0.00 H ATOM 7723 H2 WAT 4511 104.691 146.293 112.895 1.00 0.00 H TER 7725 WAT 4511 ATOM 7725 O WAT 4512 93.009 43.266 69.329 1.00 0.00 O ATOM 7726 H1 WAT 4512 92.196 43.022 68.886 1.00 0.00 H ATOM 7727 H2 WAT 4512 92.791 44.066 69.806 1.00 0.00 H TER 7729 WAT 4512 ATOM 7729 O WAT 4513 7.744 74.020 93.951 1.00 0.00 O ATOM 7730 H1 WAT 4513 7.252 73.297 93.561 1.00 0.00 H ATOM 7731 H2 WAT 4513 8.617 73.952 93.563 1.00 0.00 H TER 7733 WAT 4513 ATOM 7733 O WAT 4514 22.073 96.358 65.443 1.00 0.00 O ATOM 7734 H1 WAT 4514 22.204 95.593 66.004 1.00 0.00 H ATOM 7735 H2 WAT 4514 21.537 96.951 65.969 1.00 0.00 H TER 7737 WAT 4514 ATOM 7737 O WAT 4515 116.094 92.325 105.760 1.00 0.00 O ATOM 7738 H1 WAT 4515 117.044 92.420 105.835 1.00 0.00 H ATOM 7739 H2 WAT 4515 115.974 91.611 105.134 1.00 0.00 H TER 7741 WAT 4515 ATOM 7741 O WAT 4516 55.143 11.926 96.487 1.00 0.00 O ATOM 7742 H1 WAT 4516 56.010 12.112 96.847 1.00 0.00 H ATOM 7743 H2 WAT 4516 54.803 12.783 96.227 1.00 0.00 H TER 7745 WAT 4516 ATOM 7745 O WAT 4517 76.659 20.369 126.979 1.00 0.00 O ATOM 7746 H1 WAT 4517 75.821 20.709 126.664 1.00 0.00 H ATOM 7747 H2 WAT 4517 76.819 20.847 127.793 1.00 0.00 H TER 7749 WAT 4517 ATOM 7749 O WAT 4518 15.863 107.927 148.661 1.00 0.00 O ATOM 7750 H1 WAT 4518 16.260 108.592 148.099 1.00 0.00 H ATOM 7751 H2 WAT 4518 14.925 107.991 148.482 1.00 0.00 H TER 7753 WAT 4518 ATOM 7753 O WAT 4519 75.152 103.954 115.030 1.00 0.00 O ATOM 7754 H1 WAT 4519 74.888 104.848 115.247 1.00 0.00 H ATOM 7755 H2 WAT 4519 74.889 103.842 114.117 1.00 0.00 H TER 7757 WAT 4519 ATOM 7757 O WAT 4520 112.734 16.680 66.386 1.00 0.00 O ATOM 7758 H1 WAT 4520 112.457 17.211 67.132 1.00 0.00 H ATOM 7759 H2 WAT 4520 113.479 17.156 66.017 1.00 0.00 H TER 7761 WAT 4520 ATOM 7761 O WAT 4521 27.016 93.023 70.900 1.00 0.00 O ATOM 7762 H1 WAT 4521 26.943 93.903 70.531 1.00 0.00 H ATOM 7763 H2 WAT 4521 26.998 92.442 70.140 1.00 0.00 H TER 7765 WAT 4521 ATOM 7765 O WAT 4522 113.302 96.553 1.500 1.00 0.00 O ATOM 7766 H1 WAT 4522 113.127 97.148 0.771 1.00 0.00 H ATOM 7767 H2 WAT 4522 114.252 96.585 1.613 1.00 0.00 H TER 7769 WAT 4522 ATOM 7769 O WAT 4523 82.453 108.785 147.413 1.00 0.00 O ATOM 7770 H1 WAT 4523 82.911 108.177 147.994 1.00 0.00 H ATOM 7771 H2 WAT 4523 82.400 108.323 146.577 1.00 0.00 H TER 7773 WAT 4523 ATOM 7773 O WAT 4524 58.703 75.133 78.218 1.00 0.00 O ATOM 7774 H1 WAT 4524 57.952 74.831 78.727 1.00 0.00 H ATOM 7775 H2 WAT 4524 58.407 75.948 77.813 1.00 0.00 H TER 7777 WAT 4524 ATOM 7777 O WAT 4525 53.621 31.962 23.472 1.00 0.00 O ATOM 7778 H1 WAT 4525 53.959 32.710 22.979 1.00 0.00 H ATOM 7779 H2 WAT 4525 54.094 31.989 24.303 1.00 0.00 H TER 7781 WAT 4525 ATOM 7781 O WAT 4526 110.335 26.328 99.377 1.00 0.00 O ATOM 7782 H1 WAT 4526 109.794 25.945 100.068 1.00 0.00 H ATOM 7783 H2 WAT 4526 110.661 27.145 99.753 1.00 0.00 H TER 7785 WAT 4526 ATOM 7785 O WAT 4527 94.809 38.692 138.125 1.00 0.00 O ATOM 7786 H1 WAT 4527 94.636 37.992 137.496 1.00 0.00 H ATOM 7787 H2 WAT 4527 95.579 38.394 138.610 1.00 0.00 H TER 7789 WAT 4527 ATOM 7789 O WAT 4528 98.305 145.484 17.836 1.00 0.00 O ATOM 7790 H1 WAT 4528 98.824 146.258 17.618 1.00 0.00 H ATOM 7791 H2 WAT 4528 97.726 145.774 18.541 1.00 0.00 H TER 7793 WAT 4528 ATOM 7793 O WAT 4529 42.902 14.465 106.864 1.00 0.00 O ATOM 7794 H1 WAT 4529 42.586 15.153 106.280 1.00 0.00 H ATOM 7795 H2 WAT 4529 42.129 13.928 107.041 1.00 0.00 H TER 7797 WAT 4529 ATOM 7797 O WAT 4530 23.318 6.963 157.505 1.00 0.00 O ATOM 7798 H1 WAT 4530 22.497 6.718 157.932 1.00 0.00 H ATOM 7799 H2 WAT 4530 23.416 6.331 156.793 1.00 0.00 H TER 7801 WAT 4530 ATOM 7801 O WAT 4531 135.591 99.866 69.750 1.00 0.00 O ATOM 7802 H1 WAT 4531 136.347 100.357 69.428 1.00 0.00 H ATOM 7803 H2 WAT 4531 135.968 99.098 70.179 1.00 0.00 H TER 7805 WAT 4531 ATOM 7805 O WAT 4532 100.372 27.659 18.656 1.00 0.00 O ATOM 7806 H1 WAT 4532 100.561 27.434 19.567 1.00 0.00 H ATOM 7807 H2 WAT 4532 99.498 27.304 18.498 1.00 0.00 H TER 7809 WAT 4532 ATOM 7809 O WAT 4533 62.161 62.018 74.395 1.00 0.00 O ATOM 7810 H1 WAT 4533 61.367 62.370 74.796 1.00 0.00 H ATOM 7811 H2 WAT 4533 61.871 61.671 73.552 1.00 0.00 H TER 7813 WAT 4533 ATOM 7813 O WAT 4534 40.723 102.689 11.151 1.00 0.00 O ATOM 7814 H1 WAT 4534 39.869 102.805 11.566 1.00 0.00 H ATOM 7815 H2 WAT 4534 40.897 103.527 10.722 1.00 0.00 H TER 7817 WAT 4534 ATOM 7817 O WAT 4535 120.966 104.449 93.668 1.00 0.00 O ATOM 7818 H1 WAT 4535 121.586 104.940 94.207 1.00 0.00 H ATOM 7819 H2 WAT 4535 120.106 104.769 93.940 1.00 0.00 H TER 7821 WAT 4535 ATOM 7821 O WAT 4536 13.252 129.274 114.489 1.00 0.00 O ATOM 7822 H1 WAT 4536 13.737 129.140 115.303 1.00 0.00 H ATOM 7823 H2 WAT 4536 12.604 128.570 114.477 1.00 0.00 H TER 7825 WAT 4536 ATOM 7825 O WAT 4537 126.765 65.237 110.077 1.00 0.00 O ATOM 7826 H1 WAT 4537 126.257 65.095 109.278 1.00 0.00 H ATOM 7827 H2 WAT 4537 127.118 66.121 109.982 1.00 0.00 H TER 7829 WAT 4537 ATOM 7829 O WAT 4538 46.797 120.815 11.387 1.00 0.00 O ATOM 7830 H1 WAT 4538 47.183 119.996 11.078 1.00 0.00 H ATOM 7831 H2 WAT 4538 45.914 120.819 11.016 1.00 0.00 H TER 7833 WAT 4538 ATOM 7833 O WAT 4539 91.374 129.515 77.806 1.00 0.00 O ATOM 7834 H1 WAT 4539 90.607 129.873 78.252 1.00 0.00 H ATOM 7835 H2 WAT 4539 91.634 128.765 78.342 1.00 0.00 H TER 7837 WAT 4539 ATOM 7837 O WAT 4540 70.865 98.909 131.464 1.00 0.00 O ATOM 7838 H1 WAT 4540 71.711 99.342 131.348 1.00 0.00 H ATOM 7839 H2 WAT 4540 70.854 98.649 132.386 1.00 0.00 H TER 7841 WAT 4540 ATOM 7841 O WAT 4541 36.408 7.875 68.134 1.00 0.00 O ATOM 7842 H1 WAT 4541 37.285 7.847 67.753 1.00 0.00 H ATOM 7843 H2 WAT 4541 36.283 7.003 68.511 1.00 0.00 H TER 7845 WAT 4541 ATOM 7845 O WAT 4542 52.477 120.397 4.622 1.00 0.00 O ATOM 7846 H1 WAT 4542 53.054 119.696 4.318 1.00 0.00 H ATOM 7847 H2 WAT 4542 52.114 120.068 5.444 1.00 0.00 H TER 7849 WAT 4542 ATOM 7849 O WAT 4543 117.418 29.376 55.109 1.00 0.00 O ATOM 7850 H1 WAT 4543 117.349 30.078 54.462 1.00 0.00 H ATOM 7851 H2 WAT 4543 118.256 28.955 54.916 1.00 0.00 H TER 7853 WAT 4543 ATOM 7853 O WAT 4544 73.884 111.449 70.232 1.00 0.00 O ATOM 7854 H1 WAT 4544 74.367 111.476 71.058 1.00 0.00 H ATOM 7855 H2 WAT 4544 73.140 112.035 70.369 1.00 0.00 H TER 7857 WAT 4544 ATOM 7857 O WAT 4545 49.163 121.841 54.427 1.00 0.00 O ATOM 7858 H1 WAT 4545 49.669 122.569 54.787 1.00 0.00 H ATOM 7859 H2 WAT 4545 49.082 122.042 53.495 1.00 0.00 H TER 7861 WAT 4545 ATOM 7861 O WAT 4546 46.833 43.223 59.682 1.00 0.00 O ATOM 7862 H1 WAT 4546 47.451 42.576 60.022 1.00 0.00 H ATOM 7863 H2 WAT 4546 45.973 42.821 59.806 1.00 0.00 H TER 7865 WAT 4546 ATOM 7865 O WAT 4547 69.502 74.757 157.626 1.00 0.00 O ATOM 7866 H1 WAT 4547 69.356 73.819 157.751 1.00 0.00 H ATOM 7867 H2 WAT 4547 69.364 74.898 156.689 1.00 0.00 H TER 7869 WAT 4547 ATOM 7869 O WAT 4548 77.802 18.256 101.728 1.00 0.00 O ATOM 7870 H1 WAT 4548 78.304 19.054 101.563 1.00 0.00 H ATOM 7871 H2 WAT 4548 77.725 18.215 102.681 1.00 0.00 H TER 7873 WAT 4548 ATOM 7873 O WAT 4549 14.929 115.175 139.937 1.00 0.00 O ATOM 7874 H1 WAT 4549 14.748 115.963 140.450 1.00 0.00 H ATOM 7875 H2 WAT 4549 15.222 114.531 140.582 1.00 0.00 H TER 7877 WAT 4549 ATOM 7877 O WAT 4550 123.824 142.765 121.012 1.00 0.00 O ATOM 7878 H1 WAT 4550 124.227 142.439 121.816 1.00 0.00 H ATOM 7879 H2 WAT 4550 124.457 143.394 120.665 1.00 0.00 H TER 7881 WAT 4550 ATOM 7881 O WAT 4551 45.543 0.395 136.807 1.00 0.00 O ATOM 7882 H1 WAT 4551 46.009 0.079 136.033 1.00 0.00 H ATOM 7883 H2 WAT 4551 44.720 -0.093 136.808 1.00 0.00 H TER 7885 WAT 4551 ATOM 7885 O WAT 4552 8.106 5.522 114.569 1.00 0.00 O ATOM 7886 H1 WAT 4552 8.994 5.409 114.909 1.00 0.00 H ATOM 7887 H2 WAT 4552 7.613 5.887 115.304 1.00 0.00 H TER 7889 WAT 4552 ATOM 7889 O WAT 4553 38.478 51.477 65.178 1.00 0.00 O ATOM 7890 H1 WAT 4553 39.408 51.371 65.381 1.00 0.00 H ATOM 7891 H2 WAT 4553 38.065 51.640 66.025 1.00 0.00 H TER 7893 WAT 4553 ATOM 7893 O WAT 4554 109.688 62.712 80.870 1.00 0.00 O ATOM 7894 H1 WAT 4554 110.351 62.701 81.560 1.00 0.00 H ATOM 7895 H2 WAT 4554 109.459 61.791 80.744 1.00 0.00 H TER 7897 WAT 4554 ATOM 7897 O WAT 4555 23.344 59.627 89.178 1.00 0.00 O ATOM 7898 H1 WAT 4555 24.297 59.685 89.240 1.00 0.00 H ATOM 7899 H2 WAT 4555 23.044 59.622 90.087 1.00 0.00 H TER 7901 WAT 4555 ATOM 7901 O WAT 4556 70.299 8.368 157.685 1.00 0.00 O ATOM 7902 H1 WAT 4556 70.735 8.097 158.493 1.00 0.00 H ATOM 7903 H2 WAT 4556 69.366 8.356 157.901 1.00 0.00 H TER 7905 WAT 4556 ATOM 7905 O WAT 4557 101.056 115.619 59.968 1.00 0.00 O ATOM 7906 H1 WAT 4557 100.155 115.894 59.798 1.00 0.00 H ATOM 7907 H2 WAT 4557 101.581 116.402 59.803 1.00 0.00 H TER 7909 WAT 4557 ATOM 7909 O WAT 4558 26.566 107.616 64.604 1.00 0.00 O ATOM 7910 H1 WAT 4558 27.132 107.712 65.370 1.00 0.00 H ATOM 7911 H2 WAT 4558 26.758 106.738 64.274 1.00 0.00 H TER 7913 WAT 4558 ATOM 7913 O WAT 4559 63.767 64.970 72.544 1.00 0.00 O ATOM 7914 H1 WAT 4559 63.920 64.440 71.761 1.00 0.00 H ATOM 7915 H2 WAT 4559 64.229 64.505 73.242 1.00 0.00 H TER 7917 WAT 4559 ATOM 7917 O WAT 4560 65.770 106.565 113.023 1.00 0.00 O ATOM 7918 H1 WAT 4560 64.948 106.995 113.257 1.00 0.00 H ATOM 7919 H2 WAT 4560 66.372 106.798 113.730 1.00 0.00 H TER 7921 WAT 4560 ATOM 7921 O WAT 4561 56.552 122.083 90.331 1.00 0.00 O ATOM 7922 H1 WAT 4561 55.620 121.901 90.448 1.00 0.00 H ATOM 7923 H2 WAT 4561 56.576 122.876 89.795 1.00 0.00 H TER 7925 WAT 4561 ATOM 7925 O WAT 4562 14.383 108.246 79.228 1.00 0.00 O ATOM 7926 H1 WAT 4562 13.904 108.842 78.652 1.00 0.00 H ATOM 7927 H2 WAT 4562 14.361 107.404 78.773 1.00 0.00 H TER 7929 WAT 4562 ATOM 7929 O WAT 4563 139.826 142.617 155.129 1.00 0.00 O ATOM 7930 H1 WAT 4563 139.306 142.883 154.370 1.00 0.00 H ATOM 7931 H2 WAT 4563 140.691 142.421 154.770 1.00 0.00 H TER 7933 WAT 4563 ATOM 7933 O WAT 4564 10.571 97.723 3.587 1.00 0.00 O ATOM 7934 H1 WAT 4564 10.852 97.050 4.207 1.00 0.00 H ATOM 7935 H2 WAT 4564 11.370 98.210 3.384 1.00 0.00 H TER 7937 WAT 4564 ATOM 7937 O WAT 4565 12.698 11.997 144.459 1.00 0.00 O ATOM 7938 H1 WAT 4565 12.481 12.336 143.590 1.00 0.00 H ATOM 7939 H2 WAT 4565 13.231 11.221 144.288 1.00 0.00 H TER 7941 WAT 4565 ATOM 7941 O WAT 4566 12.347 18.872 88.286 1.00 0.00 O ATOM 7942 H1 WAT 4566 11.741 18.444 87.682 1.00 0.00 H ATOM 7943 H2 WAT 4566 13.194 18.465 88.105 1.00 0.00 H TER 7945 WAT 4566 ATOM 7945 O WAT 4567 15.214 91.891 154.248 1.00 0.00 O ATOM 7946 H1 WAT 4567 15.368 91.124 154.799 1.00 0.00 H ATOM 7947 H2 WAT 4567 14.551 91.605 153.619 1.00 0.00 H TER 7949 WAT 4567 ATOM 7949 O WAT 4568 77.041 72.520 93.932 1.00 0.00 O ATOM 7950 H1 WAT 4568 76.297 73.118 94.003 1.00 0.00 H ATOM 7951 H2 WAT 4568 76.821 71.794 94.516 1.00 0.00 H TER 7953 WAT 4568 ATOM 7953 O WAT 4569 115.760 104.721 93.502 1.00 0.00 O ATOM 7954 H1 WAT 4569 115.379 104.659 92.626 1.00 0.00 H ATOM 7955 H2 WAT 4569 115.691 105.649 93.728 1.00 0.00 H TER 7957 WAT 4569 ATOM 7957 O WAT 4570 39.765 109.784 5.809 1.00 0.00 O ATOM 7958 H1 WAT 4570 39.956 110.671 6.114 1.00 0.00 H ATOM 7959 H2 WAT 4570 39.991 109.797 4.879 1.00 0.00 H TER 7961 WAT 4570 ATOM 7961 O WAT 4571 125.156 49.736 74.770 1.00 0.00 O ATOM 7962 H1 WAT 4571 125.764 49.823 74.036 1.00 0.00 H ATOM 7963 H2 WAT 4571 124.930 48.806 74.784 1.00 0.00 H TER 7965 WAT 4571 ATOM 7965 O WAT 4572 49.062 136.893 17.863 1.00 0.00 O ATOM 7966 H1 WAT 4572 48.678 137.497 18.498 1.00 0.00 H ATOM 7967 H2 WAT 4572 48.661 136.047 18.064 1.00 0.00 H TER 7969 WAT 4572 ATOM 7969 O WAT 4573 112.519 3.964 135.963 1.00 0.00 O ATOM 7970 H1 WAT 4573 112.483 4.920 135.946 1.00 0.00 H ATOM 7971 H2 WAT 4573 111.695 3.700 136.373 1.00 0.00 H TER 7973 WAT 4573 ATOM 7973 O WAT 4574 80.799 16.704 131.505 1.00 0.00 O ATOM 7974 H1 WAT 4574 79.975 17.096 131.792 1.00 0.00 H ATOM 7975 H2 WAT 4574 81.416 17.435 131.478 1.00 0.00 H TER 7977 WAT 4574 ATOM 7977 O WAT 4575 22.265 55.470 4.133 1.00 0.00 O ATOM 7978 H1 WAT 4575 22.533 56.388 4.178 1.00 0.00 H ATOM 7979 H2 WAT 4575 22.633 55.153 3.308 1.00 0.00 H TER 7981 WAT 4575 ATOM 7981 O WAT 4576 74.626 20.968 114.286 1.00 0.00 O ATOM 7982 H1 WAT 4576 74.176 21.076 113.448 1.00 0.00 H ATOM 7983 H2 WAT 4576 75.191 21.738 114.355 1.00 0.00 H TER 7985 WAT 4576 ATOM 7985 O WAT 4577 58.646 74.334 119.805 1.00 0.00 O ATOM 7986 H1 WAT 4577 57.691 74.279 119.758 1.00 0.00 H ATOM 7987 H2 WAT 4577 58.820 75.232 120.087 1.00 0.00 H TER 7989 WAT 4577 ATOM 7989 O WAT 4578 82.281 59.048 149.219 1.00 0.00 O ATOM 7990 H1 WAT 4578 82.854 58.998 148.454 1.00 0.00 H ATOM 7991 H2 WAT 4578 82.219 59.984 149.411 1.00 0.00 H TER 7993 WAT 4578 ATOM 7993 O WAT 4579 10.897 28.681 124.532 1.00 0.00 O ATOM 7994 H1 WAT 4579 10.261 28.717 125.246 1.00 0.00 H ATOM 7995 H2 WAT 4579 11.706 29.023 124.914 1.00 0.00 H TER 7997 WAT 4579 ATOM 7997 O WAT 4580 104.881 38.430 153.428 1.00 0.00 O ATOM 7998 H1 WAT 4580 105.338 39.021 154.026 1.00 0.00 H ATOM 7999 H2 WAT 4580 104.573 38.996 152.720 1.00 0.00 H TER 8001 WAT 4580 ATOM 8001 O WAT 4581 61.149 130.728 67.760 1.00 0.00 O ATOM 8002 H1 WAT 4581 60.473 131.300 67.397 1.00 0.00 H ATOM 8003 H2 WAT 4581 61.936 131.271 67.783 1.00 0.00 H TER 8005 WAT 4581 ATOM 8005 O WAT 4582 69.316 28.924 158.207 1.00 0.00 O ATOM 8006 H1 WAT 4582 69.501 28.421 159.000 1.00 0.00 H ATOM 8007 H2 WAT 4582 69.682 28.395 157.497 1.00 0.00 H TER 8009 WAT 4582 ATOM 8009 O WAT 4583 67.885 113.928 106.553 1.00 0.00 O ATOM 8010 H1 WAT 4583 67.364 113.277 107.023 1.00 0.00 H ATOM 8011 H2 WAT 4583 68.768 113.558 106.531 1.00 0.00 H TER 8013 WAT 4583 ATOM 8013 O WAT 4584 96.100 33.191 105.995 1.00 0.00 O ATOM 8014 H1 WAT 4584 96.815 33.288 106.624 1.00 0.00 H ATOM 8015 H2 WAT 4584 96.521 32.855 105.204 1.00 0.00 H TER 8017 WAT 4584 ATOM 8017 O WAT 4585 80.139 70.991 136.506 1.00 0.00 O ATOM 8018 H1 WAT 4585 79.990 70.367 135.796 1.00 0.00 H ATOM 8019 H2 WAT 4585 79.278 71.108 136.907 1.00 0.00 H TER 8021 WAT 4585 ATOM 8021 O WAT 4586 50.472 9.474 55.077 1.00 0.00 O ATOM 8022 H1 WAT 4586 50.390 8.530 54.943 1.00 0.00 H ATOM 8023 H2 WAT 4586 49.663 9.725 55.522 1.00 0.00 H TER 8025 WAT 4586 ATOM 8025 O WAT 4587 34.304 23.712 108.452 1.00 0.00 O ATOM 8026 H1 WAT 4587 33.995 23.510 109.336 1.00 0.00 H ATOM 8027 H2 WAT 4587 33.832 24.509 108.210 1.00 0.00 H TER 8029 WAT 4587 ATOM 8029 O WAT 4588 43.668 13.711 139.753 1.00 0.00 O ATOM 8030 H1 WAT 4588 43.297 13.938 140.606 1.00 0.00 H ATOM 8031 H2 WAT 4588 43.231 14.300 139.137 1.00 0.00 H TER 8033 WAT 4588 ATOM 8033 O WAT 4589 118.502 42.953 97.361 1.00 0.00 O ATOM 8034 H1 WAT 4589 118.168 43.697 96.859 1.00 0.00 H ATOM 8035 H2 WAT 4589 119.233 43.313 97.864 1.00 0.00 H TER 8037 WAT 4589 ATOM 8037 O WAT 4590 13.983 93.885 13.071 1.00 0.00 O ATOM 8038 H1 WAT 4590 13.412 93.566 13.770 1.00 0.00 H ATOM 8039 H2 WAT 4590 14.723 93.279 13.070 1.00 0.00 H TER 8041 WAT 4590 ATOM 8041 O WAT 4591 120.999 74.389 14.399 1.00 0.00 O ATOM 8042 H1 WAT 4591 121.416 73.547 14.584 1.00 0.00 H ATOM 8043 H2 WAT 4591 120.405 74.207 13.671 1.00 0.00 H TER 8045 WAT 4591 ATOM 8045 O WAT 4592 48.830 24.994 72.671 1.00 0.00 O ATOM 8046 H1 WAT 4592 49.592 25.501 72.951 1.00 0.00 H ATOM 8047 H2 WAT 4592 48.259 25.634 72.246 1.00 0.00 H TER 8049 WAT 4592 ATOM 8049 O WAT 4593 72.127 116.694 9.942 1.00 0.00 O ATOM 8050 H1 WAT 4593 71.316 116.189 9.890 1.00 0.00 H ATOM 8051 H2 WAT 4593 72.630 116.419 9.176 1.00 0.00 H TER 8053 WAT 4593 ATOM 8053 O WAT 4594 36.594 78.609 16.924 1.00 0.00 O ATOM 8054 H1 WAT 4594 35.707 78.950 17.039 1.00 0.00 H ATOM 8055 H2 WAT 4594 36.996 79.199 16.287 1.00 0.00 H TER 8057 WAT 4594 ATOM 8057 O WAT 4595 28.904 8.602 4.471 1.00 0.00 O ATOM 8058 H1 WAT 4595 28.536 8.295 5.300 1.00 0.00 H ATOM 8059 H2 WAT 4595 29.405 7.856 4.141 1.00 0.00 H TER 8061 WAT 4595 ATOM 8061 O WAT 4596 15.412 67.938 6.275 1.00 0.00 O ATOM 8062 H1 WAT 4596 15.546 67.437 7.079 1.00 0.00 H ATOM 8063 H2 WAT 4596 16.139 67.679 5.708 1.00 0.00 H TER 8065 WAT 4596 ATOM 8065 O WAT 4597 81.165 97.151 123.882 1.00 0.00 O ATOM 8066 H1 WAT 4597 80.308 97.266 123.471 1.00 0.00 H ATOM 8067 H2 WAT 4597 81.536 98.033 123.913 1.00 0.00 H TER 8069 WAT 4597 ATOM 8069 O WAT 4598 81.558 57.294 114.742 1.00 0.00 O ATOM 8070 H1 WAT 4598 81.105 58.020 115.170 1.00 0.00 H ATOM 8071 H2 WAT 4598 81.464 56.561 115.350 1.00 0.00 H TER 8073 WAT 4598 ATOM 8073 O WAT 4599 47.760 84.296 12.782 1.00 0.00 O ATOM 8074 H1 WAT 4599 47.850 84.391 11.834 1.00 0.00 H ATOM 8075 H2 WAT 4599 48.595 84.605 13.134 1.00 0.00 H TER 8077 WAT 4599 ATOM 8077 O WAT 4600 54.717 92.367 87.992 1.00 0.00 O ATOM 8078 H1 WAT 4600 54.194 91.611 87.725 1.00 0.00 H ATOM 8079 H2 WAT 4600 55.600 92.170 87.679 1.00 0.00 H TER 8081 WAT 4600 ATOM 8081 O WAT 4601 129.980 46.841 99.009 1.00 0.00 O ATOM 8082 H1 WAT 4601 129.807 47.502 98.338 1.00 0.00 H ATOM 8083 H2 WAT 4601 129.118 46.638 99.373 1.00 0.00 H TER 8085 WAT 4601 ATOM 8085 O WAT 4602 53.553 91.813 97.805 1.00 0.00 O ATOM 8086 H1 WAT 4602 53.985 92.654 97.960 1.00 0.00 H ATOM 8087 H2 WAT 4602 53.965 91.475 97.010 1.00 0.00 H TER 8089 WAT 4602 ATOM 8089 O WAT 4603 41.915 46.029 17.951 1.00 0.00 O ATOM 8090 H1 WAT 4603 41.317 45.924 17.210 1.00 0.00 H ATOM 8091 H2 WAT 4603 42.674 45.492 17.724 1.00 0.00 H TER 8093 WAT 4603 ATOM 8093 O WAT 4604 75.881 43.683 -0.156 1.00 0.00 O ATOM 8094 H1 WAT 4604 76.811 43.563 0.037 1.00 0.00 H ATOM 8095 H2 WAT 4604 75.587 44.337 0.478 1.00 0.00 H TER 8097 WAT 4604 ATOM 8097 O WAT 4605 104.828 102.156 100.309 1.00 0.00 O ATOM 8098 H1 WAT 4605 105.142 103.034 100.092 1.00 0.00 H ATOM 8099 H2 WAT 4605 105.237 101.957 101.151 1.00 0.00 H TER 8101 WAT 4605 ATOM 8101 O WAT 4606 13.999 41.774 133.612 1.00 0.00 O ATOM 8102 H1 WAT 4606 14.588 41.047 133.409 1.00 0.00 H ATOM 8103 H2 WAT 4606 13.716 41.609 134.511 1.00 0.00 H TER 8105 WAT 4606 ATOM 8105 O WAT 4607 144.911 41.029 15.023 1.00 0.00 O ATOM 8106 H1 WAT 4607 145.828 41.058 15.296 1.00 0.00 H ATOM 8107 H2 WAT 4607 144.434 41.443 15.742 1.00 0.00 H TER 8109 WAT 4607 ATOM 8109 O WAT 4608 132.553 57.583 68.278 1.00 0.00 O ATOM 8110 H1 WAT 4608 132.415 57.991 67.423 1.00 0.00 H ATOM 8111 H2 WAT 4608 132.572 56.644 68.094 1.00 0.00 H TER 8113 WAT 4608 ATOM 8113 O WAT 4609 6.208 87.229 128.951 1.00 0.00 O ATOM 8114 H1 WAT 4609 6.572 86.356 128.801 1.00 0.00 H ATOM 8115 H2 WAT 4609 6.776 87.814 128.450 1.00 0.00 H TER 8117 WAT 4609 ATOM 8117 O WAT 4610 89.787 115.702 158.152 1.00 0.00 O ATOM 8118 H1 WAT 4610 88.972 116.195 158.055 1.00 0.00 H ATOM 8119 H2 WAT 4610 90.304 115.942 157.383 1.00 0.00 H TER 8121 WAT 4610 ATOM 8121 O WAT 4611 124.310 76.505 67.114 1.00 0.00 O ATOM 8122 H1 WAT 4611 124.722 75.677 66.869 1.00 0.00 H ATOM 8123 H2 WAT 4611 124.925 77.176 66.816 1.00 0.00 H TER 8125 WAT 4611 ATOM 8125 O WAT 4612 49.089 23.426 16.003 1.00 0.00 O ATOM 8126 H1 WAT 4612 49.776 23.030 16.539 1.00 0.00 H ATOM 8127 H2 WAT 4612 48.326 22.864 16.137 1.00 0.00 H TER 8129 WAT 4612 ATOM 8129 O WAT 4613 111.420 136.387 85.055 1.00 0.00 O ATOM 8130 H1 WAT 4613 111.161 137.308 85.034 1.00 0.00 H ATOM 8131 H2 WAT 4613 111.996 136.283 84.297 1.00 0.00 H TER 8133 WAT 4613 ATOM 8133 O WAT 4614 128.858 21.079 133.645 1.00 0.00 O ATOM 8134 H1 WAT 4614 128.684 20.138 133.666 1.00 0.00 H ATOM 8135 H2 WAT 4614 127.991 21.482 133.593 1.00 0.00 H TER 8137 WAT 4614 ATOM 8137 O WAT 4615 3.711 82.477 124.021 1.00 0.00 O ATOM 8138 H1 WAT 4615 3.524 82.041 123.190 1.00 0.00 H ATOM 8139 H2 WAT 4615 3.060 83.177 124.076 1.00 0.00 H TER 8141 WAT 4615 ATOM 8141 O WAT 4616 136.135 91.978 157.127 1.00 0.00 O ATOM 8142 H1 WAT 4616 136.520 92.748 156.708 1.00 0.00 H ATOM 8143 H2 WAT 4616 135.992 92.245 158.035 1.00 0.00 H TER 8145 WAT 4616 ATOM 8145 O WAT 4617 25.941 122.650 130.071 1.00 0.00 O ATOM 8146 H1 WAT 4617 25.349 123.384 130.236 1.00 0.00 H ATOM 8147 H2 WAT 4617 26.740 122.875 130.548 1.00 0.00 H TER 8149 WAT 4617 ATOM 8149 O WAT 4618 57.403 83.903 150.736 1.00 0.00 O ATOM 8150 H1 WAT 4618 57.653 83.811 151.656 1.00 0.00 H ATOM 8151 H2 WAT 4618 57.661 83.074 150.333 1.00 0.00 H TER 8153 WAT 4618 ATOM 8153 O WAT 4619 59.619 91.629 123.860 1.00 0.00 O ATOM 8154 H1 WAT 4619 59.156 90.841 123.572 1.00 0.00 H ATOM 8155 H2 WAT 4619 59.183 92.345 123.398 1.00 0.00 H TER 8157 WAT 4619 ATOM 8157 O WAT 4620 10.334 29.274 114.653 1.00 0.00 O ATOM 8158 H1 WAT 4620 10.381 29.555 113.739 1.00 0.00 H ATOM 8159 H2 WAT 4620 9.784 28.491 114.636 1.00 0.00 H TER 8161 WAT 4620 ATOM 8161 O WAT 4621 75.839 124.139 125.091 1.00 0.00 O ATOM 8162 H1 WAT 4621 75.265 123.745 124.434 1.00 0.00 H ATOM 8163 H2 WAT 4621 76.514 124.588 124.582 1.00 0.00 H TER 8165 WAT 4621 ATOM 8165 O WAT 4622 29.944 52.260 10.395 1.00 0.00 O ATOM 8166 H1 WAT 4622 30.321 52.278 9.515 1.00 0.00 H ATOM 8167 H2 WAT 4622 29.931 51.333 10.632 1.00 0.00 H TER 8169 WAT 4622 ATOM 8169 O WAT 4623 43.628 104.587 14.604 1.00 0.00 O ATOM 8170 H1 WAT 4623 44.470 104.176 14.797 1.00 0.00 H ATOM 8171 H2 WAT 4623 43.215 104.701 15.460 1.00 0.00 H TER 8173 WAT 4623 ATOM 8173 O WAT 4624 112.613 122.575 135.010 1.00 0.00 O ATOM 8174 H1 WAT 4624 112.586 122.694 134.061 1.00 0.00 H ATOM 8175 H2 WAT 4624 113.196 123.268 135.321 1.00 0.00 H TER 8177 WAT 4624 ATOM 8177 O WAT 4625 2.284 98.925 138.955 1.00 0.00 O ATOM 8178 H1 WAT 4625 1.687 99.149 138.241 1.00 0.00 H ATOM 8179 H2 WAT 4625 3.083 99.416 138.763 1.00 0.00 H TER 8181 WAT 4625 ATOM 8181 O WAT 4626 74.240 106.091 99.121 1.00 0.00 O ATOM 8182 H1 WAT 4626 73.336 105.926 98.856 1.00 0.00 H ATOM 8183 H2 WAT 4626 74.723 106.161 98.297 1.00 0.00 H TER 8185 WAT 4626 ATOM 8185 O WAT 4627 102.535 14.853 133.109 1.00 0.00 O ATOM 8186 H1 WAT 4627 101.988 15.260 132.438 1.00 0.00 H ATOM 8187 H2 WAT 4627 103.423 15.144 132.903 1.00 0.00 H TER 8189 WAT 4627 ATOM 8189 O WAT 4628 70.801 22.549 62.476 1.00 0.00 O ATOM 8190 H1 WAT 4628 71.246 23.272 62.917 1.00 0.00 H ATOM 8191 H2 WAT 4628 70.669 22.859 61.580 1.00 0.00 H TER 8193 WAT 4628 ATOM 8193 O WAT 4629 46.685 12.362 146.403 1.00 0.00 O ATOM 8194 H1 WAT 4629 46.582 11.923 147.248 1.00 0.00 H ATOM 8195 H2 WAT 4629 47.323 11.828 145.931 1.00 0.00 H TER 8197 WAT 4629 ATOM 8197 O WAT 4630 101.651 68.760 69.732 1.00 0.00 O ATOM 8198 H1 WAT 4630 102.093 69.209 69.011 1.00 0.00 H ATOM 8199 H2 WAT 4630 102.362 68.395 70.258 1.00 0.00 H TER 8201 WAT 4630 ATOM 8201 O WAT 4631 36.543 51.326 62.573 1.00 0.00 O ATOM 8202 H1 WAT 4631 37.242 51.534 61.952 1.00 0.00 H ATOM 8203 H2 WAT 4631 37.001 51.116 63.387 1.00 0.00 H TER 8205 WAT 4631 ATOM 8205 O WAT 4632 62.354 28.826 11.228 1.00 0.00 O ATOM 8206 H1 WAT 4632 62.126 27.925 10.998 1.00 0.00 H ATOM 8207 H2 WAT 4632 62.218 29.321 10.421 1.00 0.00 H TER 8209 WAT 4632 ATOM 8209 O WAT 4633 137.138 15.474 139.156 1.00 0.00 O ATOM 8210 H1 WAT 4633 137.790 15.727 138.502 1.00 0.00 H ATOM 8211 H2 WAT 4633 137.309 16.051 139.901 1.00 0.00 H TER 8213 WAT 4633 ATOM 8213 O WAT 4634 23.722 111.502 22.099 1.00 0.00 O ATOM 8214 H1 WAT 4634 24.209 111.945 22.794 1.00 0.00 H ATOM 8215 H2 WAT 4634 22.950 111.145 22.537 1.00 0.00 H TER 8217 WAT 4634 ATOM 8217 O WAT 4635 81.741 125.976 25.586 1.00 0.00 O ATOM 8218 H1 WAT 4635 82.588 126.421 25.584 1.00 0.00 H ATOM 8219 H2 WAT 4635 81.635 125.659 24.689 1.00 0.00 H TER 8221 WAT 4635 ATOM 8221 O WAT 4636 117.333 16.007 126.772 1.00 0.00 O ATOM 8222 H1 WAT 4636 117.649 16.580 126.073 1.00 0.00 H ATOM 8223 H2 WAT 4636 117.412 15.124 126.412 1.00 0.00 H TER 8225 WAT 4636 ATOM 8225 O WAT 4637 49.899 31.214 101.830 1.00 0.00 O ATOM 8226 H1 WAT 4637 49.394 30.519 101.408 1.00 0.00 H ATOM 8227 H2 WAT 4637 50.021 31.871 101.145 1.00 0.00 H TER 8229 WAT 4637 ATOM 8229 O WAT 4638 52.830 24.031 72.121 1.00 0.00 O ATOM 8230 H1 WAT 4638 52.923 23.320 72.755 1.00 0.00 H ATOM 8231 H2 WAT 4638 53.727 24.315 71.946 1.00 0.00 H TER 8233 WAT 4638 ATOM 8233 O WAT 4639 4.488 52.093 101.429 1.00 0.00 O ATOM 8234 H1 WAT 4639 3.811 52.769 101.442 1.00 0.00 H ATOM 8235 H2 WAT 4639 4.686 51.934 102.351 1.00 0.00 H TER 8237 WAT 4639 ATOM 8237 O WAT 4640 36.991 41.863 81.906 1.00 0.00 O ATOM 8238 H1 WAT 4640 36.998 42.423 82.682 1.00 0.00 H ATOM 8239 H2 WAT 4640 36.112 41.485 81.891 1.00 0.00 H TER 8241 WAT 4640 ATOM 8241 O WAT 4641 108.496 8.588 5.040 1.00 0.00 O ATOM 8242 H1 WAT 4641 108.642 7.812 5.582 1.00 0.00 H ATOM 8243 H2 WAT 4641 108.083 9.218 5.630 1.00 0.00 H TER 8245 WAT 4641 ATOM 8245 O WAT 4642 94.312 63.497 67.600 1.00 0.00 O ATOM 8246 H1 WAT 4642 94.146 63.035 68.422 1.00 0.00 H ATOM 8247 H2 WAT 4642 95.051 63.031 67.209 1.00 0.00 H TER 8249 WAT 4642 ATOM 8249 O WAT 4643 124.912 10.378 104.876 1.00 0.00 O ATOM 8250 H1 WAT 4643 125.096 11.064 105.517 1.00 0.00 H ATOM 8251 H2 WAT 4643 125.775 10.060 104.611 1.00 0.00 H TER 8253 WAT 4643 ATOM 8253 O WAT 4644 63.207 55.914 103.528 1.00 0.00 O ATOM 8254 H1 WAT 4644 63.786 56.377 102.922 1.00 0.00 H ATOM 8255 H2 WAT 4644 63.333 54.988 103.319 1.00 0.00 H TER 8257 WAT 4644 ATOM 8257 O WAT 4645 139.839 63.106 4.755 1.00 0.00 O ATOM 8258 H1 WAT 4645 139.504 62.302 4.357 1.00 0.00 H ATOM 8259 H2 WAT 4645 139.501 63.808 4.198 1.00 0.00 H TER 8261 WAT 4645 ATOM 8261 O WAT 4646 26.484 28.617 69.724 1.00 0.00 O ATOM 8262 H1 WAT 4646 26.892 28.388 70.559 1.00 0.00 H ATOM 8263 H2 WAT 4646 26.935 29.416 69.449 1.00 0.00 H TER 8265 WAT 4646 ATOM 8265 O WAT 4647 29.801 56.542 135.226 1.00 0.00 O ATOM 8266 H1 WAT 4647 30.443 57.044 134.724 1.00 0.00 H ATOM 8267 H2 WAT 4647 29.090 57.162 135.392 1.00 0.00 H TER 8269 WAT 4647 ATOM 8269 O WAT 4648 17.666 112.608 122.802 1.00 0.00 O ATOM 8270 H1 WAT 4648 17.143 113.408 122.852 1.00 0.00 H ATOM 8271 H2 WAT 4648 17.120 111.938 123.213 1.00 0.00 H TER 8273 WAT 4648 ATOM 8273 O WAT 4649 63.859 44.009 152.741 1.00 0.00 O ATOM 8274 H1 WAT 4649 64.709 44.256 153.103 1.00 0.00 H ATOM 8275 H2 WAT 4649 63.272 43.992 153.497 1.00 0.00 H TER 8277 WAT 4649 ATOM 8277 O WAT 4650 142.227 145.443 108.272 1.00 0.00 O ATOM 8278 H1 WAT 4650 143.104 145.446 107.889 1.00 0.00 H ATOM 8279 H2 WAT 4650 141.638 145.352 107.523 1.00 0.00 H TER 8281 WAT 4650 ATOM 8281 O WAT 4651 130.533 130.218 14.835 1.00 0.00 O ATOM 8282 H1 WAT 4651 131.101 129.529 15.180 1.00 0.00 H ATOM 8283 H2 WAT 4651 131.125 130.804 14.363 1.00 0.00 H TER 8285 WAT 4651 ATOM 8285 O WAT 4652 122.932 81.235 147.124 1.00 0.00 O ATOM 8286 H1 WAT 4652 122.707 80.474 146.589 1.00 0.00 H ATOM 8287 H2 WAT 4652 123.762 81.545 146.763 1.00 0.00 H TER 8289 WAT 4652 ATOM 8289 O WAT 4653 145.601 16.689 148.034 1.00 0.00 O ATOM 8290 H1 WAT 4653 145.998 17.368 147.488 1.00 0.00 H ATOM 8291 H2 WAT 4653 145.515 15.934 147.453 1.00 0.00 H TER 8293 WAT 4653 ATOM 8293 O WAT 4654 44.478 109.103 6.878 1.00 0.00 O ATOM 8294 H1 WAT 4654 44.236 109.547 7.690 1.00 0.00 H ATOM 8295 H2 WAT 4654 43.761 108.490 6.717 1.00 0.00 H TER 8297 WAT 4654 ATOM 8297 O WAT 4655 109.850 7.526 144.582 1.00 0.00 O ATOM 8298 H1 WAT 4655 109.024 7.678 145.041 1.00 0.00 H ATOM 8299 H2 WAT 4655 110.303 6.872 145.114 1.00 0.00 H TER 8301 WAT 4655 ATOM 8301 O WAT 4656 25.445 38.396 93.215 1.00 0.00 O ATOM 8302 H1 WAT 4656 25.656 37.774 92.519 1.00 0.00 H ATOM 8303 H2 WAT 4656 25.366 39.238 92.767 1.00 0.00 H TER 8305 WAT 4656 ATOM 8305 O WAT 4657 44.570 91.132 103.387 1.00 0.00 O ATOM 8306 H1 WAT 4657 44.038 90.880 104.142 1.00 0.00 H ATOM 8307 H2 WAT 4657 44.334 90.503 102.706 1.00 0.00 H TER 8309 WAT 4657 ATOM 8309 O WAT 4658 105.787 46.352 132.468 1.00 0.00 O ATOM 8310 H1 WAT 4658 106.396 46.474 131.740 1.00 0.00 H ATOM 8311 H2 WAT 4658 106.032 47.027 133.101 1.00 0.00 H TER 8313 WAT 4658 ATOM 8313 O WAT 4659 28.982 1.687 80.719 1.00 0.00 O ATOM 8314 H1 WAT 4659 29.313 2.360 80.124 1.00 0.00 H ATOM 8315 H2 WAT 4659 29.411 0.881 80.432 1.00 0.00 H TER 8317 WAT 4659 ATOM 8317 O WAT 4660 116.073 52.386 123.372 1.00 0.00 O ATOM 8318 H1 WAT 4660 116.736 52.523 122.695 1.00 0.00 H ATOM 8319 H2 WAT 4660 116.134 51.455 123.584 1.00 0.00 H TER 8321 WAT 4660 ATOM 8321 O WAT 4661 126.990 5.730 12.138 1.00 0.00 O ATOM 8322 H1 WAT 4661 127.370 6.567 12.403 1.00 0.00 H ATOM 8323 H2 WAT 4661 127.746 5.176 11.940 1.00 0.00 H TER 8325 WAT 4661 ATOM 8325 O WAT 4662 126.987 70.706 68.195 1.00 0.00 O ATOM 8326 H1 WAT 4662 126.857 71.591 67.854 1.00 0.00 H ATOM 8327 H2 WAT 4662 127.938 70.606 68.244 1.00 0.00 H TER 8329 WAT 4662 ATOM 8329 O WAT 4663 94.957 121.838 137.492 1.00 0.00 O ATOM 8330 H1 WAT 4663 94.333 122.358 136.986 1.00 0.00 H ATOM 8331 H2 WAT 4663 94.793 120.935 137.219 1.00 0.00 H TER 8333 WAT 4663 ATOM 8333 O WAT 4664 54.880 133.521 116.310 1.00 0.00 O ATOM 8334 H1 WAT 4664 54.914 132.729 115.774 1.00 0.00 H ATOM 8335 H2 WAT 4664 54.903 133.201 117.212 1.00 0.00 H TER 8337 WAT 4664 ATOM 8337 O WAT 4665 107.972 2.260 19.446 1.00 0.00 O ATOM 8338 H1 WAT 4665 108.463 2.972 19.035 1.00 0.00 H ATOM 8339 H2 WAT 4665 107.406 2.696 20.083 1.00 0.00 H TER 8341 WAT 4665 ATOM 8341 O WAT 4666 12.432 34.909 94.200 1.00 0.00 O ATOM 8342 H1 WAT 4666 12.222 35.723 94.658 1.00 0.00 H ATOM 8343 H2 WAT 4666 13.321 34.696 94.485 1.00 0.00 H TER 8345 WAT 4666 ATOM 8345 O WAT 4667 103.004 77.544 142.461 1.00 0.00 O ATOM 8346 H1 WAT 4667 102.591 76.695 142.303 1.00 0.00 H ATOM 8347 H2 WAT 4667 102.898 77.690 143.401 1.00 0.00 H TER 8349 WAT 4667 ATOM 8349 O WAT 4668 127.875 0.914 13.061 1.00 0.00 O ATOM 8350 H1 WAT 4668 127.084 0.981 13.595 1.00 0.00 H ATOM 8351 H2 WAT 4668 128.525 1.438 13.528 1.00 0.00 H TER 8353 WAT 4668 ATOM 8353 O WAT 4669 53.734 60.536 132.990 1.00 0.00 O ATOM 8354 H1 WAT 4669 54.474 59.961 132.798 1.00 0.00 H ATOM 8355 H2 WAT 4669 54.099 61.215 133.557 1.00 0.00 H TER 8357 WAT 4669 ATOM 8357 O WAT 4670 98.613 23.922 138.794 1.00 0.00 O ATOM 8358 H1 WAT 4670 97.872 24.187 138.249 1.00 0.00 H ATOM 8359 H2 WAT 4670 99.383 24.094 138.251 1.00 0.00 H TER 8361 WAT 4670 ATOM 8361 O WAT 4671 7.011 32.295 145.332 1.00 0.00 O ATOM 8362 H1 WAT 4671 7.894 32.010 145.099 1.00 0.00 H ATOM 8363 H2 WAT 4671 7.059 33.251 145.329 1.00 0.00 H TER 8365 WAT 4671 ATOM 8365 O WAT 4672 86.189 86.516 140.712 1.00 0.00 O ATOM 8366 H1 WAT 4672 87.038 86.154 140.459 1.00 0.00 H ATOM 8367 H2 WAT 4672 86.033 86.170 141.591 1.00 0.00 H TER 8369 WAT 4672 ATOM 8369 O WAT 4673 74.842 71.742 154.308 1.00 0.00 O ATOM 8370 H1 WAT 4673 74.950 70.832 154.583 1.00 0.00 H ATOM 8371 H2 WAT 4673 74.969 71.722 153.359 1.00 0.00 H TER 8373 WAT 4673 ATOM 8373 O WAT 4674 115.196 97.869 73.310 1.00 0.00 O ATOM 8374 H1 WAT 4674 114.776 98.117 74.134 1.00 0.00 H ATOM 8375 H2 WAT 4674 114.700 98.336 72.638 1.00 0.00 H TER 8377 WAT 4674 ATOM 8377 O WAT 4675 68.293 70.699 98.024 1.00 0.00 O ATOM 8378 H1 WAT 4675 68.217 70.420 97.111 1.00 0.00 H ATOM 8379 H2 WAT 4675 68.583 71.610 97.973 1.00 0.00 H TER 8381 WAT 4675 ATOM 8381 O WAT 4676 128.974 25.958 135.459 1.00 0.00 O ATOM 8382 H1 WAT 4676 128.306 25.641 136.066 1.00 0.00 H ATOM 8383 H2 WAT 4676 128.742 25.562 134.619 1.00 0.00 H TER 8385 WAT 4676 ATOM 8385 O WAT 4677 41.478 14.674 12.078 1.00 0.00 O ATOM 8386 H1 WAT 4677 41.279 14.861 11.161 1.00 0.00 H ATOM 8387 H2 WAT 4677 42.433 14.707 12.128 1.00 0.00 H TER 8389 WAT 4677 ATOM 8389 O WAT 4678 87.116 81.610 140.984 1.00 0.00 O ATOM 8390 H1 WAT 4678 86.224 81.874 140.761 1.00 0.00 H ATOM 8391 H2 WAT 4678 87.060 80.662 141.108 1.00 0.00 H TER 8393 WAT 4678 ATOM 8393 O WAT 4679 131.239 95.164 77.949 1.00 0.00 O ATOM 8394 H1 WAT 4679 131.596 96.004 77.661 1.00 0.00 H ATOM 8395 H2 WAT 4679 130.321 95.349 78.150 1.00 0.00 H TER 8397 WAT 4679 ATOM 8397 O WAT 4680 138.726 34.611 126.271 1.00 0.00 O ATOM 8398 H1 WAT 4680 138.275 33.952 126.798 1.00 0.00 H ATOM 8399 H2 WAT 4680 138.914 35.321 126.885 1.00 0.00 H TER 8401 WAT 4680 ATOM 8401 O WAT 4681 71.911 113.315 127.910 1.00 0.00 O ATOM 8402 H1 WAT 4681 72.000 114.075 128.486 1.00 0.00 H ATOM 8403 H2 WAT 4681 71.559 113.673 127.095 1.00 0.00 H TER 8405 WAT 4681 ATOM 8405 O WAT 4682 21.319 50.186 74.201 1.00 0.00 O ATOM 8406 H1 WAT 4682 21.991 50.865 74.251 1.00 0.00 H ATOM 8407 H2 WAT 4682 20.681 50.525 73.573 1.00 0.00 H TER 8409 WAT 4682 ATOM 8409 O WAT 4683 29.121 12.182 125.880 1.00 0.00 O ATOM 8410 H1 WAT 4683 28.780 12.975 125.466 1.00 0.00 H ATOM 8411 H2 WAT 4683 29.640 12.502 126.617 1.00 0.00 H TER 8413 WAT 4683 ATOM 8413 O WAT 4684 15.702 97.697 88.091 1.00 0.00 O ATOM 8414 H1 WAT 4684 16.080 97.526 87.229 1.00 0.00 H ATOM 8415 H2 WAT 4684 14.832 97.300 88.054 1.00 0.00 H TER 8417 WAT 4684 ATOM 8417 O WAT 4685 115.569 76.931 137.373 1.00 0.00 O ATOM 8418 H1 WAT 4685 115.518 77.496 136.602 1.00 0.00 H ATOM 8419 H2 WAT 4685 115.168 77.445 138.074 1.00 0.00 H TER 8421 WAT 4685 ATOM 8421 O WAT 4686 1.651 73.833 112.034 1.00 0.00 O ATOM 8422 H1 WAT 4686 1.649 72.960 112.429 1.00 0.00 H ATOM 8423 H2 WAT 4686 2.577 74.024 111.881 1.00 0.00 H TER 8425 WAT 4686 ATOM 8425 O WAT 4687 128.928 109.029 158.418 1.00 0.00 O ATOM 8426 H1 WAT 4687 128.196 108.451 158.201 1.00 0.00 H ATOM 8427 H2 WAT 4687 128.520 109.781 158.846 1.00 0.00 H TER 8429 WAT 4687 ATOM 8429 O WAT 4688 129.125 1.055 82.148 1.00 0.00 O ATOM 8430 H1 WAT 4688 128.202 0.841 82.285 1.00 0.00 H ATOM 8431 H2 WAT 4688 129.568 0.207 82.139 1.00 0.00 H TER 8433 WAT 4688 ATOM 8433 O WAT 4689 13.444 27.176 85.702 1.00 0.00 O ATOM 8434 H1 WAT 4689 14.224 26.622 85.688 1.00 0.00 H ATOM 8435 H2 WAT 4689 12.849 26.735 86.309 1.00 0.00 H TER 8437 WAT 4689 ATOM 8437 O WAT 4690 108.411 29.015 19.721 1.00 0.00 O ATOM 8438 H1 WAT 4690 108.048 29.220 18.859 1.00 0.00 H ATOM 8439 H2 WAT 4690 107.645 28.899 20.283 1.00 0.00 H TER 8441 WAT 4690 ATOM 8441 O WAT 4691 59.556 11.764 157.760 1.00 0.00 O ATOM 8442 H1 WAT 4691 60.051 12.535 157.484 1.00 0.00 H ATOM 8443 H2 WAT 4691 59.054 11.511 156.986 1.00 0.00 H TER 8445 WAT 4691 ATOM 8445 O WAT 4692 36.246 52.231 90.531 1.00 0.00 O ATOM 8446 H1 WAT 4692 36.909 52.836 90.197 1.00 0.00 H ATOM 8447 H2 WAT 4692 36.531 51.370 90.222 1.00 0.00 H TER 8449 WAT 4692 ATOM 8449 O WAT 4693 62.625 40.663 132.954 1.00 0.00 O ATOM 8450 H1 WAT 4693 62.390 40.308 132.097 1.00 0.00 H ATOM 8451 H2 WAT 4693 61.865 40.478 133.506 1.00 0.00 H TER 8453 WAT 4693 ATOM 8453 O WAT 4694 56.969 78.353 154.265 1.00 0.00 O ATOM 8454 H1 WAT 4694 57.139 79.022 154.928 1.00 0.00 H ATOM 8455 H2 WAT 4694 56.027 78.196 154.319 1.00 0.00 H TER 8457 WAT 4694 ATOM 8457 O WAT 4695 16.758 28.236 117.450 1.00 0.00 O ATOM 8458 H1 WAT 4695 16.708 29.120 117.814 1.00 0.00 H ATOM 8459 H2 WAT 4695 15.848 28.000 117.268 1.00 0.00 H TER 8461 WAT 4695 ATOM 8461 O WAT 4696 109.399 134.227 78.911 1.00 0.00 O ATOM 8462 H1 WAT 4696 109.637 135.109 79.196 1.00 0.00 H ATOM 8463 H2 WAT 4696 110.064 133.661 79.300 1.00 0.00 H TER 8465 WAT 4696 ATOM 8465 O WAT 4697 14.031 89.733 105.060 1.00 0.00 O ATOM 8466 H1 WAT 4697 13.692 89.304 105.846 1.00 0.00 H ATOM 8467 H2 WAT 4697 13.988 90.668 105.261 1.00 0.00 H TER 8469 WAT 4697 ATOM 8469 O WAT 4698 40.154 20.387 54.635 1.00 0.00 O ATOM 8470 H1 WAT 4698 40.398 20.611 53.737 1.00 0.00 H ATOM 8471 H2 WAT 4698 40.710 19.639 54.855 1.00 0.00 H TER 8473 WAT 4698 ATOM 8473 O WAT 4699 42.807 72.378 28.326 1.00 0.00 O ATOM 8474 H1 WAT 4699 43.637 72.575 28.761 1.00 0.00 H ATOM 8475 H2 WAT 4699 42.577 71.502 28.635 1.00 0.00 H TER 8477 WAT 4699 ATOM 8477 O WAT 4700 27.585 91.491 147.698 1.00 0.00 O ATOM 8478 H1 WAT 4700 28.208 92.057 147.243 1.00 0.00 H ATOM 8479 H2 WAT 4700 26.734 91.725 147.329 1.00 0.00 H TER 8481 WAT 4700 ATOM 8481 O WAT 4701 26.083 127.762 129.354 1.00 0.00 O ATOM 8482 H1 WAT 4701 27.006 127.937 129.537 1.00 0.00 H ATOM 8483 H2 WAT 4701 26.078 127.415 128.462 1.00 0.00 H TER 8485 WAT 4701 ATOM 8485 O WAT 4702 103.759 127.288 73.505 1.00 0.00 O ATOM 8486 H1 WAT 4702 103.752 126.544 74.107 1.00 0.00 H ATOM 8487 H2 WAT 4702 103.583 126.903 72.646 1.00 0.00 H TER 8489 WAT 4702 ATOM 8489 O WAT 4703 103.383 49.401 18.377 1.00 0.00 O ATOM 8490 H1 WAT 4703 102.486 49.724 18.284 1.00 0.00 H ATOM 8491 H2 WAT 4703 103.316 48.459 18.217 1.00 0.00 H TER 8493 WAT 4703 ATOM 8493 O WAT 4704 33.648 17.412 83.685 1.00 0.00 O ATOM 8494 H1 WAT 4704 33.328 18.299 83.523 1.00 0.00 H ATOM 8495 H2 WAT 4704 33.825 17.058 82.813 1.00 0.00 H TER 8497 WAT 4704 ATOM 8497 O WAT 4705 21.773 73.255 94.372 1.00 0.00 O ATOM 8498 H1 WAT 4705 21.792 73.059 95.309 1.00 0.00 H ATOM 8499 H2 WAT 4705 22.076 74.161 94.310 1.00 0.00 H TER 8501 WAT 4705 ATOM 8501 O WAT 4706 69.420 118.319 67.397 1.00 0.00 O ATOM 8502 H1 WAT 4706 69.575 117.510 67.885 1.00 0.00 H ATOM 8503 H2 WAT 4706 70.287 118.586 67.093 1.00 0.00 H TER 8505 WAT 4706 ATOM 8505 O WAT 4707 9.727 109.476 8.800 1.00 0.00 O ATOM 8506 H1 WAT 4707 9.575 108.539 8.681 1.00 0.00 H ATOM 8507 H2 WAT 4707 9.167 109.718 9.538 1.00 0.00 H TER 8509 WAT 4707 ATOM 8509 O WAT 4708 114.891 142.946 81.260 1.00 0.00 O ATOM 8510 H1 WAT 4708 114.994 143.757 80.762 1.00 0.00 H ATOM 8511 H2 WAT 4708 114.765 142.270 80.594 1.00 0.00 H TER 8513 WAT 4708 ATOM 8513 O WAT 4709 35.411 70.075 152.250 1.00 0.00 O ATOM 8514 H1 WAT 4709 35.120 69.244 151.874 1.00 0.00 H ATOM 8515 H2 WAT 4709 35.862 70.518 151.530 1.00 0.00 H TER 8517 WAT 4709 ATOM 8517 O WAT 4710 103.876 26.050 61.387 1.00 0.00 O ATOM 8518 H1 WAT 4710 103.495 26.073 60.510 1.00 0.00 H ATOM 8519 H2 WAT 4710 104.197 25.153 61.486 1.00 0.00 H TER 8521 WAT 4710 ATOM 8521 O WAT 4711 74.173 39.053 122.168 1.00 0.00 O ATOM 8522 H1 WAT 4711 75.060 38.948 122.510 1.00 0.00 H ATOM 8523 H2 WAT 4711 74.290 39.510 121.335 1.00 0.00 H TER 8525 WAT 4711 ATOM 8525 O WAT 4712 98.992 60.146 77.270 1.00 0.00 O ATOM 8526 H1 WAT 4712 99.198 60.948 76.790 1.00 0.00 H ATOM 8527 H2 WAT 4712 99.287 59.440 76.695 1.00 0.00 H TER 8529 WAT 4712 ATOM 8529 O WAT 4713 66.186 28.878 3.079 1.00 0.00 O ATOM 8530 H1 WAT 4713 65.937 27.961 3.194 1.00 0.00 H ATOM 8531 H2 WAT 4713 65.811 29.123 2.233 1.00 0.00 H TER 8533 WAT 4713 ATOM 8533 O WAT 4714 63.581 57.093 145.642 1.00 0.00 O ATOM 8534 H1 WAT 4714 64.241 57.785 145.674 1.00 0.00 H ATOM 8535 H2 WAT 4714 63.889 56.499 144.958 1.00 0.00 H TER 8537 WAT 4714 ATOM 8537 O WAT 4715 82.403 31.913 138.805 1.00 0.00 O ATOM 8538 H1 WAT 4715 83.094 32.262 139.368 1.00 0.00 H ATOM 8539 H2 WAT 4715 82.824 31.801 137.952 1.00 0.00 H TER 8541 WAT 4715 ATOM 8541 O WAT 4716 86.070 140.127 101.690 1.00 0.00 O ATOM 8542 H1 WAT 4716 85.472 139.819 101.009 1.00 0.00 H ATOM 8543 H2 WAT 4716 85.691 140.955 101.984 1.00 0.00 H TER 8545 WAT 4716 ATOM 8545 O WAT 4717 89.523 84.800 132.215 1.00 0.00 O ATOM 8546 H1 WAT 4717 89.513 83.955 132.664 1.00 0.00 H ATOM 8547 H2 WAT 4717 88.612 84.948 131.961 1.00 0.00 H TER 8549 WAT 4717 ATOM 8549 O WAT 4718 73.026 27.102 25.536 1.00 0.00 O ATOM 8550 H1 WAT 4718 72.712 26.470 26.183 1.00 0.00 H ATOM 8551 H2 WAT 4718 72.509 26.919 24.752 1.00 0.00 H TER 8553 WAT 4718 ATOM 8553 O WAT 4719 47.645 50.656 26.145 1.00 0.00 O ATOM 8554 H1 WAT 4719 46.758 50.545 26.486 1.00 0.00 H ATOM 8555 H2 WAT 4719 47.734 51.599 26.010 1.00 0.00 H TER 8557 WAT 4719 ATOM 8557 O WAT 4720 54.249 36.882 62.486 1.00 0.00 O ATOM 8558 H1 WAT 4720 54.202 37.257 61.607 1.00 0.00 H ATOM 8559 H2 WAT 4720 53.338 36.833 62.775 1.00 0.00 H TER 8561 WAT 4720 ATOM 8561 O WAT 4721 50.296 114.415 95.186 1.00 0.00 O ATOM 8562 H1 WAT 4721 50.941 115.106 95.338 1.00 0.00 H ATOM 8563 H2 WAT 4721 50.483 113.762 95.860 1.00 0.00 H TER 8565 WAT 4721 ATOM 8565 O WAT 4722 5.500 107.505 85.659 1.00 0.00 O ATOM 8566 H1 WAT 4722 4.960 108.005 85.046 1.00 0.00 H ATOM 8567 H2 WAT 4722 5.645 108.103 86.392 1.00 0.00 H TER 8569 WAT 4722 ATOM 8569 O WAT 4723 119.799 97.481 77.930 1.00 0.00 O ATOM 8570 H1 WAT 4723 120.599 97.006 77.702 1.00 0.00 H ATOM 8571 H2 WAT 4723 119.107 97.031 77.446 1.00 0.00 H TER 8573 WAT 4723 ATOM 8573 O WAT 4724 85.260 100.628 134.940 1.00 0.00 O ATOM 8574 H1 WAT 4724 84.743 101.169 134.344 1.00 0.00 H ATOM 8575 H2 WAT 4724 84.831 100.731 135.790 1.00 0.00 H TER 8577 WAT 4724 ATOM 8577 O WAT 4725 96.467 20.952 154.136 1.00 0.00 O ATOM 8578 H1 WAT 4725 95.554 20.992 154.423 1.00 0.00 H ATOM 8579 H2 WAT 4725 96.657 21.835 153.819 1.00 0.00 H TER 8581 WAT 4725 ATOM 8581 O WAT 4726 73.804 61.949 15.094 1.00 0.00 O ATOM 8582 H1 WAT 4726 73.141 62.036 15.779 1.00 0.00 H ATOM 8583 H2 WAT 4726 73.324 61.616 14.336 1.00 0.00 H TER 8585 WAT 4726 ATOM 8585 O WAT 4727 75.426 111.378 14.266 1.00 0.00 O ATOM 8586 H1 WAT 4727 74.633 111.283 14.793 1.00 0.00 H ATOM 8587 H2 WAT 4727 76.141 111.180 14.871 1.00 0.00 H TER 8589 WAT 4727 ATOM 8589 O WAT 4728 127.919 75.343 114.809 1.00 0.00 O ATOM 8590 H1 WAT 4728 127.268 75.918 114.407 1.00 0.00 H ATOM 8591 H2 WAT 4728 127.404 74.658 115.235 1.00 0.00 H TER 8593 WAT 4728 ATOM 8593 O WAT 4729 97.482 25.556 9.958 1.00 0.00 O ATOM 8594 H1 WAT 4729 97.414 25.760 10.891 1.00 0.00 H ATOM 8595 H2 WAT 4729 97.089 26.309 9.518 1.00 0.00 H TER 8597 WAT 4729 ATOM 8597 O WAT 4730 82.219 47.532 88.529 1.00 0.00 O ATOM 8598 H1 WAT 4730 82.176 47.677 87.584 1.00 0.00 H ATOM 8599 H2 WAT 4730 83.149 47.610 88.741 1.00 0.00 H TER 8601 WAT 4730 ATOM 8601 O WAT 4731 57.100 115.142 68.005 1.00 0.00 O ATOM 8602 H1 WAT 4731 57.328 115.135 68.935 1.00 0.00 H ATOM 8603 H2 WAT 4731 57.829 114.693 67.577 1.00 0.00 H TER 8605 WAT 4731 ATOM 8605 O WAT 4732 3.196 137.731 101.783 1.00 0.00 O ATOM 8606 H1 WAT 4732 2.646 138.277 102.345 1.00 0.00 H ATOM 8607 H2 WAT 4732 3.878 138.323 101.467 1.00 0.00 H TER 8609 WAT 4732 ATOM 8609 O WAT 4733 56.069 84.984 29.259 1.00 0.00 O ATOM 8610 H1 WAT 4733 56.567 84.243 28.912 1.00 0.00 H ATOM 8611 H2 WAT 4733 55.260 84.595 29.590 1.00 0.00 H TER 8613 WAT 4733 ATOM 8613 O WAT 4734 5.140 31.350 16.015 1.00 0.00 O ATOM 8614 H1 WAT 4734 4.882 32.019 15.381 1.00 0.00 H ATOM 8615 H2 WAT 4734 5.037 31.774 16.866 1.00 0.00 H TER 8617 WAT 4734 ATOM 8617 O WAT 4735 111.634 43.061 113.937 1.00 0.00 O ATOM 8618 H1 WAT 4735 111.439 42.863 113.021 1.00 0.00 H ATOM 8619 H2 WAT 4735 112.163 42.322 114.235 1.00 0.00 H TER 8621 WAT 4735 ATOM 8621 O WAT 4736 115.576 14.667 77.536 1.00 0.00 O ATOM 8622 H1 WAT 4736 115.979 14.487 76.686 1.00 0.00 H ATOM 8623 H2 WAT 4736 115.428 15.613 77.535 1.00 0.00 H TER 8625 WAT 4736 ATOM 8625 O WAT 4737 68.094 128.856 75.481 1.00 0.00 O ATOM 8626 H1 WAT 4737 68.886 128.967 76.006 1.00 0.00 H ATOM 8627 H2 WAT 4737 68.415 128.646 74.604 1.00 0.00 H TER 8629 WAT 4737 ATOM 8629 O WAT 4738 43.570 117.797 116.517 1.00 0.00 O ATOM 8630 H1 WAT 4738 44.100 118.581 116.375 1.00 0.00 H ATOM 8631 H2 WAT 4738 42.683 118.060 116.269 1.00 0.00 H TER 8633 WAT 4738 ATOM 8633 O WAT 4739 142.502 66.575 98.351 1.00 0.00 O ATOM 8634 H1 WAT 4739 142.929 66.541 99.207 1.00 0.00 H ATOM 8635 H2 WAT 4739 142.851 67.367 97.942 1.00 0.00 H TER 8637 WAT 4739 ATOM 8637 O WAT 4740 55.438 92.109 121.135 1.00 0.00 O ATOM 8638 H1 WAT 4740 54.846 91.375 121.298 1.00 0.00 H ATOM 8639 H2 WAT 4740 56.278 91.699 120.931 1.00 0.00 H TER 8641 WAT 4740 ATOM 8641 O WAT 4741 104.537 3.727 7.514 1.00 0.00 O ATOM 8642 H1 WAT 4741 104.479 4.568 7.968 1.00 0.00 H ATOM 8643 H2 WAT 4741 104.331 3.077 8.186 1.00 0.00 H TER 8645 WAT 4741 ATOM 8645 O WAT 4742 8.712 77.425 114.340 1.00 0.00 O ATOM 8646 H1 WAT 4742 7.943 77.800 114.769 1.00 0.00 H ATOM 8647 H2 WAT 4742 9.056 76.794 114.972 1.00 0.00 H TER 8649 WAT 4742 ATOM 8649 O WAT 4743 12.250 63.941 151.389 1.00 0.00 O ATOM 8650 H1 WAT 4743 11.899 63.060 151.514 1.00 0.00 H ATOM 8651 H2 WAT 4743 11.724 64.310 150.679 1.00 0.00 H TER 8653 WAT 4743 ATOM 8653 O WAT 4744 99.072 25.824 78.223 1.00 0.00 O ATOM 8654 H1 WAT 4744 99.940 26.006 78.582 1.00 0.00 H ATOM 8655 H2 WAT 4744 99.068 24.878 78.074 1.00 0.00 H TER 8657 WAT 4744 ATOM 8657 O WAT 4745 66.949 32.960 140.150 1.00 0.00 O ATOM 8658 H1 WAT 4745 66.298 33.546 140.535 1.00 0.00 H ATOM 8659 H2 WAT 4745 67.578 32.804 140.854 1.00 0.00 H TER 8661 WAT 4745 ATOM 8661 O WAT 4746 26.261 126.491 103.720 1.00 0.00 O ATOM 8662 H1 WAT 4746 25.814 126.275 104.539 1.00 0.00 H ATOM 8663 H2 WAT 4746 25.957 125.829 103.099 1.00 0.00 H TER 8665 WAT 4746 ATOM 8665 O WAT 4747 37.181 98.657 7.429 1.00 0.00 O ATOM 8666 H1 WAT 4747 37.126 98.065 8.180 1.00 0.00 H ATOM 8667 H2 WAT 4747 38.118 98.814 7.316 1.00 0.00 H TER 8669 WAT 4747 ATOM 8669 O WAT 4748 62.362 85.227 85.730 1.00 0.00 O ATOM 8670 H1 WAT 4748 63.235 84.880 85.544 1.00 0.00 H ATOM 8671 H2 WAT 4748 62.480 85.766 86.512 1.00 0.00 H TER 8673 WAT 4748 ATOM 8673 O WAT 4749 134.872 103.816 91.129 1.00 0.00 O ATOM 8674 H1 WAT 4749 133.926 103.775 90.988 1.00 0.00 H ATOM 8675 H2 WAT 4749 135.180 104.470 90.502 1.00 0.00 H TER 8677 WAT 4749 ATOM 8677 O WAT 4750 48.415 6.525 133.381 1.00 0.00 O ATOM 8678 H1 WAT 4750 48.693 5.680 133.734 1.00 0.00 H ATOM 8679 H2 WAT 4750 49.185 6.856 132.918 1.00 0.00 H TER 8681 WAT 4750 ATOM 8681 O WAT 4751 85.447 74.690 154.398 1.00 0.00 O ATOM 8682 H1 WAT 4751 85.802 74.169 153.678 1.00 0.00 H ATOM 8683 H2 WAT 4751 85.475 75.592 154.077 1.00 0.00 H TER 8685 WAT 4751 ATOM 8685 O WAT 4752 102.689 68.740 103.000 1.00 0.00 O ATOM 8686 H1 WAT 4752 103.441 69.011 103.525 1.00 0.00 H ATOM 8687 H2 WAT 4752 102.168 68.195 103.590 1.00 0.00 H TER 8689 WAT 4752 ATOM 8689 O WAT 4753 132.437 27.300 70.711 1.00 0.00 O ATOM 8690 H1 WAT 4753 133.373 27.117 70.639 1.00 0.00 H ATOM 8691 H2 WAT 4753 132.253 27.894 69.984 1.00 0.00 H TER 8693 WAT 4753 ATOM 8693 O WAT 4754 10.342 92.778 64.331 1.00 0.00 O ATOM 8694 H1 WAT 4754 10.671 92.482 63.482 1.00 0.00 H ATOM 8695 H2 WAT 4754 11.122 92.838 64.882 1.00 0.00 H TER 8697 WAT 4754 ATOM 8697 O WAT 4755 134.808 50.577 63.309 1.00 0.00 O ATOM 8698 H1 WAT 4755 135.203 49.825 63.751 1.00 0.00 H ATOM 8699 H2 WAT 4755 135.312 50.671 62.501 1.00 0.00 H TER 8701 WAT 4755 ATOM 8701 O WAT 4756 114.511 141.517 111.330 1.00 0.00 O ATOM 8702 H1 WAT 4756 114.989 142.044 111.970 1.00 0.00 H ATOM 8703 H2 WAT 4756 115.062 140.745 111.197 1.00 0.00 H TER 8705 WAT 4756 ATOM 8705 O WAT 4757 109.612 108.046 149.812 1.00 0.00 O ATOM 8706 H1 WAT 4757 109.900 107.643 150.631 1.00 0.00 H ATOM 8707 H2 WAT 4757 109.554 107.318 149.194 1.00 0.00 H TER 8709 WAT 4757 ATOM 8709 O WAT 4758 1.184 64.477 21.815 1.00 0.00 O ATOM 8710 H1 WAT 4758 1.923 63.877 21.915 1.00 0.00 H ATOM 8711 H2 WAT 4758 1.258 64.800 20.916 1.00 0.00 H TER 8713 WAT 4758 ATOM 8713 O WAT 4759 49.318 71.763 93.920 1.00 0.00 O ATOM 8714 H1 WAT 4759 48.600 72.396 93.899 1.00 0.00 H ATOM 8715 H2 WAT 4759 49.176 71.215 93.149 1.00 0.00 H TER 8717 WAT 4759 ATOM 8717 O WAT 4760 114.051 120.046 90.777 1.00 0.00 O ATOM 8718 H1 WAT 4760 113.165 119.817 91.057 1.00 0.00 H ATOM 8719 H2 WAT 4760 113.955 120.297 89.858 1.00 0.00 H TER 8721 WAT 4760 ATOM 8721 O WAT 4761 30.041 140.564 72.280 1.00 0.00 O ATOM 8722 H1 WAT 4761 29.237 141.074 72.377 1.00 0.00 H ATOM 8723 H2 WAT 4761 30.628 140.914 72.950 1.00 0.00 H TER 8725 WAT 4761 ATOM 8725 O WAT 4762 41.023 45.735 71.071 1.00 0.00 O ATOM 8726 H1 WAT 4762 40.601 45.439 71.878 1.00 0.00 H ATOM 8727 H2 WAT 4762 41.733 45.110 70.929 1.00 0.00 H TER 8729 WAT 4762 ATOM 8729 O WAT 4763 39.964 79.207 10.665 1.00 0.00 O ATOM 8730 H1 WAT 4763 40.032 80.128 10.412 1.00 0.00 H ATOM 8731 H2 WAT 4763 39.456 79.220 11.477 1.00 0.00 H TER 8733 WAT 4763 ATOM 8733 O WAT 4764 139.706 129.370 88.955 1.00 0.00 O ATOM 8734 H1 WAT 4764 139.664 128.611 89.536 1.00 0.00 H ATOM 8735 H2 WAT 4764 140.643 129.528 88.836 1.00 0.00 H TER 8737 WAT 4764 ATOM 8737 O WAT 4765 36.493 46.240 101.197 1.00 0.00 O ATOM 8738 H1 WAT 4765 35.866 46.964 101.172 1.00 0.00 H ATOM 8739 H2 WAT 4765 37.326 46.636 100.942 1.00 0.00 H TER 8741 WAT 4765 ATOM 8741 O WAT 4766 66.849 143.575 72.269 1.00 0.00 O ATOM 8742 H1 WAT 4766 67.657 143.731 71.780 1.00 0.00 H ATOM 8743 H2 WAT 4766 66.154 143.664 71.616 1.00 0.00 H TER 8745 WAT 4766 ATOM 8745 O WAT 4767 89.533 33.729 155.766 1.00 0.00 O ATOM 8746 H1 WAT 4767 90.323 34.253 155.898 1.00 0.00 H ATOM 8747 H2 WAT 4767 88.916 34.055 156.421 1.00 0.00 H TER 8749 WAT 4767 ATOM 8749 O WAT 4768 114.954 61.270 75.708 1.00 0.00 O ATOM 8750 H1 WAT 4768 115.268 62.122 76.013 1.00 0.00 H ATOM 8751 H2 WAT 4768 115.729 60.847 75.338 1.00 0.00 H TER 8753 WAT 4768 ATOM 8753 O WAT 4769 69.825 52.749 133.062 1.00 0.00 O ATOM 8754 H1 WAT 4769 69.694 52.124 132.349 1.00 0.00 H ATOM 8755 H2 WAT 4769 69.861 52.209 133.851 1.00 0.00 H TER 8757 WAT 4769 ATOM 8757 O WAT 4770 12.077 57.828 139.583 1.00 0.00 O ATOM 8758 H1 WAT 4770 11.134 57.991 139.589 1.00 0.00 H ATOM 8759 H2 WAT 4770 12.349 58.026 138.687 1.00 0.00 H TER 8761 WAT 4770 ATOM 8761 O WAT 4771 126.441 44.690 138.086 1.00 0.00 O ATOM 8762 H1 WAT 4771 126.205 45.346 138.741 1.00 0.00 H ATOM 8763 H2 WAT 4771 125.669 44.128 138.020 1.00 0.00 H TER 8765 WAT 4771 ATOM 8765 O WAT 4772 77.563 58.752 112.458 1.00 0.00 O ATOM 8766 H1 WAT 4772 77.942 58.498 111.616 1.00 0.00 H ATOM 8767 H2 WAT 4772 76.828 58.152 112.581 1.00 0.00 H TER 8769 WAT 4772 ATOM 8769 O WAT 4773 37.522 42.871 0.451 1.00 0.00 O ATOM 8770 H1 WAT 4773 36.976 43.645 0.308 1.00 0.00 H ATOM 8771 H2 WAT 4773 37.743 42.903 1.382 1.00 0.00 H TER 8773 WAT 4773 ATOM 8773 O WAT 4774 92.500 141.159 1.059 1.00 0.00 O ATOM 8774 H1 WAT 4774 92.689 141.856 0.431 1.00 0.00 H ATOM 8775 H2 WAT 4774 93.249 141.165 1.656 1.00 0.00 H TER 8777 WAT 4774 ATOM 8777 O WAT 4775 48.363 18.845 86.834 1.00 0.00 O ATOM 8778 H1 WAT 4775 47.668 19.149 86.249 1.00 0.00 H ATOM 8779 H2 WAT 4775 48.034 19.032 87.713 1.00 0.00 H TER 8781 WAT 4775 ATOM 8781 O WAT 4776 140.619 7.996 107.768 1.00 0.00 O ATOM 8782 H1 WAT 4776 140.580 7.272 108.394 1.00 0.00 H ATOM 8783 H2 WAT 4776 141.505 7.954 107.408 1.00 0.00 H TER 8785 WAT 4776 ATOM 8785 O WAT 4777 14.071 30.384 21.349 1.00 0.00 O ATOM 8786 H1 WAT 4777 14.397 30.890 22.093 1.00 0.00 H ATOM 8787 H2 WAT 4777 14.723 30.521 20.661 1.00 0.00 H TER 8789 WAT 4777 ATOM 8789 O WAT 4778 118.631 31.482 80.389 1.00 0.00 O ATOM 8790 H1 WAT 4778 118.081 32.228 80.629 1.00 0.00 H ATOM 8791 H2 WAT 4778 118.878 31.088 81.226 1.00 0.00 H TER 8793 WAT 4778 ATOM 8793 O WAT 4779 135.088 139.440 64.082 1.00 0.00 O ATOM 8794 H1 WAT 4779 134.194 139.097 64.071 1.00 0.00 H ATOM 8795 H2 WAT 4779 135.602 138.755 64.508 1.00 0.00 H TER 8797 WAT 4779 ATOM 8797 O WAT 4780 16.385 107.275 13.784 1.00 0.00 O ATOM 8798 H1 WAT 4780 16.220 107.684 12.935 1.00 0.00 H ATOM 8799 H2 WAT 4780 17.299 106.994 13.740 1.00 0.00 H TER 8801 WAT 4780 ATOM 8801 O WAT 4781 62.750 99.153 124.820 1.00 0.00 O ATOM 8802 H1 WAT 4781 62.042 99.073 125.459 1.00 0.00 H ATOM 8803 H2 WAT 4781 62.890 98.260 124.504 1.00 0.00 H TER 8805 WAT 4781 ATOM 8805 O WAT 4782 34.363 92.184 73.563 1.00 0.00 O ATOM 8806 H1 WAT 4782 34.475 91.236 73.622 1.00 0.00 H ATOM 8807 H2 WAT 4782 33.640 92.302 72.946 1.00 0.00 H TER 8809 WAT 4782 ATOM 8809 O WAT 4783 55.029 32.105 2.098 1.00 0.00 O ATOM 8810 H1 WAT 4783 55.746 31.538 2.381 1.00 0.00 H ATOM 8811 H2 WAT 4783 55.204 32.268 1.171 1.00 0.00 H TER 8813 WAT 4783 ATOM 8813 O WAT 4784 4.678 0.207 65.173 1.00 0.00 O ATOM 8814 H1 WAT 4784 4.581 1.045 65.626 1.00 0.00 H ATOM 8815 H2 WAT 4784 5.605 -0.012 65.273 1.00 0.00 H TER 8817 WAT 4784 ATOM 8817 O WAT 4785 60.333 58.260 137.506 1.00 0.00 O ATOM 8818 H1 WAT 4785 60.822 58.646 136.779 1.00 0.00 H ATOM 8819 H2 WAT 4785 60.907 57.571 137.841 1.00 0.00 H TER 8821 WAT 4785 ATOM 8821 O WAT 4786 6.617 137.089 103.371 1.00 0.00 O ATOM 8822 H1 WAT 4786 5.977 136.519 102.945 1.00 0.00 H ATOM 8823 H2 WAT 4786 6.979 137.617 102.659 1.00 0.00 H TER 8825 WAT 4786 ATOM 8825 O WAT 4787 78.864 26.150 104.717 1.00 0.00 O ATOM 8826 H1 WAT 4787 79.462 25.505 105.094 1.00 0.00 H ATOM 8827 H2 WAT 4787 79.233 26.996 104.971 1.00 0.00 H TER 8829 WAT 4787 ATOM 8829 O WAT 4788 12.838 79.723 6.767 1.00 0.00 O ATOM 8830 H1 WAT 4788 12.516 79.482 7.636 1.00 0.00 H ATOM 8831 H2 WAT 4788 12.823 80.680 6.764 1.00 0.00 H TER 8833 WAT 4788 ATOM 8833 O WAT 4789 27.321 103.680 98.331 1.00 0.00 O ATOM 8834 H1 WAT 4789 27.125 104.213 99.102 1.00 0.00 H ATOM 8835 H2 WAT 4789 27.453 102.797 98.678 1.00 0.00 H TER 8837 WAT 4789 ATOM 8837 O WAT 4790 98.123 63.455 20.311 1.00 0.00 O ATOM 8838 H1 WAT 4790 98.490 64.339 20.294 1.00 0.00 H ATOM 8839 H2 WAT 4790 98.356 63.115 21.175 1.00 0.00 H TER 8841 WAT 4790 ATOM 8841 O WAT 4791 131.079 70.384 154.501 1.00 0.00 O ATOM 8842 H1 WAT 4791 130.505 69.618 154.526 1.00 0.00 H ATOM 8843 H2 WAT 4791 131.748 70.204 155.162 1.00 0.00 H TER 8845 WAT 4791 ATOM 8845 O WAT 4792 133.777 93.746 154.540 1.00 0.00 O ATOM 8846 H1 WAT 4792 133.767 93.787 153.584 1.00 0.00 H ATOM 8847 H2 WAT 4792 134.706 93.739 154.770 1.00 0.00 H TER 8849 WAT 4792 ATOM 8849 O WAT 4793 129.317 82.316 157.390 1.00 0.00 O ATOM 8850 H1 WAT 4793 128.756 82.568 158.123 1.00 0.00 H ATOM 8851 H2 WAT 4793 128.808 81.660 156.914 1.00 0.00 H TER 8853 WAT 4793 ATOM 8853 O WAT 4794 104.771 6.738 147.275 1.00 0.00 O ATOM 8854 H1 WAT 4794 105.578 6.932 147.751 1.00 0.00 H ATOM 8855 H2 WAT 4794 105.047 6.644 146.363 1.00 0.00 H TER 8857 WAT 4794 ATOM 8857 O WAT 4795 57.582 129.382 109.980 1.00 0.00 O ATOM 8858 H1 WAT 4795 57.549 129.322 110.935 1.00 0.00 H ATOM 8859 H2 WAT 4795 57.242 130.255 109.783 1.00 0.00 H TER 8861 WAT 4795 ATOM 8861 O WAT 4796 52.451 63.138 136.697 1.00 0.00 O ATOM 8862 H1 WAT 4796 51.628 63.566 136.462 1.00 0.00 H ATOM 8863 H2 WAT 4796 52.921 63.792 137.215 1.00 0.00 H TER 8865 WAT 4796 ATOM 8865 O WAT 4797 69.330 98.543 82.757 1.00 0.00 O ATOM 8866 H1 WAT 4797 70.208 98.375 83.099 1.00 0.00 H ATOM 8867 H2 WAT 4797 69.059 97.709 82.373 1.00 0.00 H TER 8869 WAT 4797 ATOM 8869 O WAT 4798 71.595 29.302 98.820 1.00 0.00 O ATOM 8870 H1 WAT 4798 71.242 28.413 98.781 1.00 0.00 H ATOM 8871 H2 WAT 4798 72.489 29.219 98.487 1.00 0.00 H TER 8873 WAT 4798 ATOM 8873 O WAT 4799 19.684 81.353 21.470 1.00 0.00 O ATOM 8874 H1 WAT 4799 19.895 82.272 21.305 1.00 0.00 H ATOM 8875 H2 WAT 4799 19.021 81.379 22.160 1.00 0.00 H TER 8877 WAT 4799 ATOM 8877 O WAT 4800 92.080 91.517 75.344 1.00 0.00 O ATOM 8878 H1 WAT 4800 92.912 91.189 75.002 1.00 0.00 H ATOM 8879 H2 WAT 4800 91.423 91.190 74.729 1.00 0.00 H TER 8881 WAT 4800 ATOM 8881 O WAT 4801 93.385 1.170 124.287 1.00 0.00 O ATOM 8882 H1 WAT 4801 93.988 0.776 124.917 1.00 0.00 H ATOM 8883 H2 WAT 4801 93.703 2.067 124.181 1.00 0.00 H TER 8885 WAT 4801 ATOM 8885 O WAT 4802 90.666 141.172 111.532 1.00 0.00 O ATOM 8886 H1 WAT 4802 91.448 140.801 111.123 1.00 0.00 H ATOM 8887 H2 WAT 4802 90.808 141.053 112.471 1.00 0.00 H TER 8889 WAT 4802 ATOM 8889 O WAT 4803 82.178 86.733 29.247 1.00 0.00 O ATOM 8890 H1 WAT 4803 82.113 85.778 29.237 1.00 0.00 H ATOM 8891 H2 WAT 4803 82.550 86.957 28.394 1.00 0.00 H TER 8893 WAT 4803 ATOM 8893 O WAT 4804 7.267 67.952 134.804 1.00 0.00 O ATOM 8894 H1 WAT 4804 6.484 68.476 134.636 1.00 0.00 H ATOM 8895 H2 WAT 4804 7.802 68.062 134.019 1.00 0.00 H TER 8897 WAT 4804 ATOM 8897 O WAT 4805 51.926 50.036 131.943 1.00 0.00 O ATOM 8898 H1 WAT 4805 52.080 49.377 131.267 1.00 0.00 H ATOM 8899 H2 WAT 4805 52.262 50.849 131.567 1.00 0.00 H TER 8901 WAT 4805 ATOM 8901 O WAT 4806 142.968 60.282 151.146 1.00 0.00 O ATOM 8902 H1 WAT 4806 143.876 60.536 150.981 1.00 0.00 H ATOM 8903 H2 WAT 4806 142.477 60.655 150.414 1.00 0.00 H TER 8905 WAT 4806 ATOM 8905 O WAT 4807 50.876 54.619 75.843 1.00 0.00 O ATOM 8906 H1 WAT 4807 51.440 54.774 76.601 1.00 0.00 H ATOM 8907 H2 WAT 4807 50.452 53.781 76.027 1.00 0.00 H TER 8909 WAT 4807 ATOM 8909 O WAT 4808 51.772 73.485 129.048 1.00 0.00 O ATOM 8910 H1 WAT 4808 51.747 72.539 129.191 1.00 0.00 H ATOM 8911 H2 WAT 4808 52.510 73.788 129.577 1.00 0.00 H TER 8913 WAT 4808 ATOM 8913 O WAT 4809 104.300 131.508 153.937 1.00 0.00 O ATOM 8914 H1 WAT 4809 104.245 130.564 153.794 1.00 0.00 H ATOM 8915 H2 WAT 4809 105.196 131.652 154.240 1.00 0.00 H TER 8917 WAT 4809 ATOM 8917 O WAT 4810 101.382 51.155 77.990 1.00 0.00 O ATOM 8918 H1 WAT 4810 100.555 51.317 77.537 1.00 0.00 H ATOM 8919 H2 WAT 4810 101.735 50.370 77.570 1.00 0.00 H TER 8921 WAT 4810 ATOM 8921 O WAT 4811 34.188 98.732 136.276 1.00 0.00 O ATOM 8922 H1 WAT 4811 34.408 98.310 135.446 1.00 0.00 H ATOM 8923 H2 WAT 4811 33.270 98.986 136.181 1.00 0.00 H TER 8925 WAT 4811 ATOM 8925 O WAT 4812 77.027 105.715 125.975 1.00 0.00 O ATOM 8926 H1 WAT 4812 76.375 106.020 126.606 1.00 0.00 H ATOM 8927 H2 WAT 4812 77.706 105.305 126.511 1.00 0.00 H TER 8929 WAT 4812 ATOM 8929 O WAT 4813 124.217 22.757 79.982 1.00 0.00 O ATOM 8930 H1 WAT 4813 123.582 23.449 80.164 1.00 0.00 H ATOM 8931 H2 WAT 4813 123.779 21.952 80.258 1.00 0.00 H TER 8933 WAT 4813 ATOM 8933 O WAT 4814 0.778 60.330 140.103 1.00 0.00 O ATOM 8934 H1 WAT 4814 0.324 60.393 139.262 1.00 0.00 H ATOM 8935 H2 WAT 4814 1.698 60.489 139.890 1.00 0.00 H TER 8937 WAT 4814 ATOM 8937 O WAT 4815 138.832 41.634 84.937 1.00 0.00 O ATOM 8938 H1 WAT 4815 138.762 42.308 85.613 1.00 0.00 H ATOM 8939 H2 WAT 4815 138.371 42.002 84.184 1.00 0.00 H TER 8941 WAT 4815 ATOM 8941 O WAT 4816 85.876 53.566 20.300 1.00 0.00 O ATOM 8942 H1 WAT 4816 86.103 54.463 20.545 1.00 0.00 H ATOM 8943 H2 WAT 4816 84.919 53.553 20.299 1.00 0.00 H TER 8945 WAT 4816 ATOM 8945 O WAT 4817 135.378 4.015 74.357 1.00 0.00 O ATOM 8946 H1 WAT 4817 135.749 3.299 73.843 1.00 0.00 H ATOM 8947 H2 WAT 4817 134.999 3.587 75.125 1.00 0.00 H TER 8949 WAT 4817 ATOM 8949 O WAT 4818 45.834 94.239 76.778 1.00 0.00 O ATOM 8950 H1 WAT 4818 45.604 94.918 76.143 1.00 0.00 H ATOM 8951 H2 WAT 4818 46.633 93.845 76.427 1.00 0.00 H TER 8953 WAT 4818 ATOM 8953 O WAT 4819 89.980 126.326 78.683 1.00 0.00 O ATOM 8954 H1 WAT 4819 90.892 126.588 78.556 1.00 0.00 H ATOM 8955 H2 WAT 4819 89.793 126.543 79.596 1.00 0.00 H TER 8957 WAT 4819 ATOM 8957 O WAT 4820 6.250 13.779 119.644 1.00 0.00 O ATOM 8958 H1 WAT 4820 6.187 14.653 119.259 1.00 0.00 H ATOM 8959 H2 WAT 4820 7.120 13.469 119.393 1.00 0.00 H TER 8961 WAT 4820 ATOM 8961 O WAT 4821 98.991 144.880 69.064 1.00 0.00 O ATOM 8962 H1 WAT 4821 99.926 145.054 69.172 1.00 0.00 H ATOM 8963 H2 WAT 4821 98.683 144.674 69.946 1.00 0.00 H TER 8965 WAT 4821 ATOM 8965 O WAT 4822 73.028 106.057 125.014 1.00 0.00 O ATOM 8966 H1 WAT 4822 72.231 106.006 124.486 1.00 0.00 H ATOM 8967 H2 WAT 4822 73.170 105.162 125.321 1.00 0.00 H TER 8969 WAT 4822 ATOM 8969 O WAT 4823 19.874 6.350 123.887 1.00 0.00 O ATOM 8970 H1 WAT 4823 20.053 6.610 122.983 1.00 0.00 H ATOM 8971 H2 WAT 4823 19.909 5.394 123.873 1.00 0.00 H TER 8973 WAT 4823 ATOM 8973 O WAT 4824 17.254 88.125 71.416 1.00 0.00 O ATOM 8974 H1 WAT 4824 17.695 88.158 70.567 1.00 0.00 H ATOM 8975 H2 WAT 4824 16.450 87.633 71.250 1.00 0.00 H TER 8977 WAT 4824 ATOM 8977 O WAT 4825 30.539 57.081 62.762 1.00 0.00 O ATOM 8978 H1 WAT 4825 31.091 57.420 63.466 1.00 0.00 H ATOM 8979 H2 WAT 4825 30.871 57.506 61.971 1.00 0.00 H TER 8981 WAT 4825 ATOM 8981 O WAT 4826 64.210 25.382 135.683 1.00 0.00 O ATOM 8982 H1 WAT 4826 64.823 24.752 135.305 1.00 0.00 H ATOM 8983 H2 WAT 4826 63.872 24.948 136.466 1.00 0.00 H TER 8985 WAT 4826 ATOM 8985 O WAT 4827 141.192 113.318 95.907 1.00 0.00 O ATOM 8986 H1 WAT 4827 141.385 112.949 96.768 1.00 0.00 H ATOM 8987 H2 WAT 4827 140.405 112.856 95.619 1.00 0.00 H TER 8989 WAT 4827 ATOM 8989 O WAT 4828 31.574 10.324 65.065 1.00 0.00 O ATOM 8990 H1 WAT 4828 31.636 11.121 64.538 1.00 0.00 H ATOM 8991 H2 WAT 4828 30.634 10.178 65.168 1.00 0.00 H TER 8993 WAT 4828 ATOM 8993 O WAT 4829 68.584 93.726 58.934 1.00 0.00 O ATOM 8994 H1 WAT 4829 67.692 94.022 58.750 1.00 0.00 H ATOM 8995 H2 WAT 4829 68.960 94.420 59.475 1.00 0.00 H TER 8997 WAT 4829 ATOM 8997 O WAT 4830 23.039 51.854 98.671 1.00 0.00 O ATOM 8998 H1 WAT 4830 22.330 51.448 99.170 1.00 0.00 H ATOM 8999 H2 WAT 4830 23.747 51.210 98.693 1.00 0.00 H TER 9001 WAT 4830 ATOM 9001 O WAT 4831 1.555 26.084 101.258 1.00 0.00 O ATOM 9002 H1 WAT 4831 1.570 25.355 100.638 1.00 0.00 H ATOM 9003 H2 WAT 4831 2.424 26.075 101.658 1.00 0.00 H TER 9005 WAT 4831 ATOM 9005 O WAT 4832 58.107 33.519 126.195 1.00 0.00 O ATOM 9006 H1 WAT 4832 58.760 34.140 126.519 1.00 0.00 H ATOM 9007 H2 WAT 4832 58.115 33.638 125.246 1.00 0.00 H TER 9009 WAT 4832 ATOM 9009 O WAT 4833 140.927 105.159 145.889 1.00 0.00 O ATOM 9010 H1 WAT 4833 140.912 105.748 145.135 1.00 0.00 H ATOM 9011 H2 WAT 4833 140.070 104.732 145.877 1.00 0.00 H TER 9013 WAT 4833 ATOM 9013 O WAT 4834 94.603 51.454 87.984 1.00 0.00 O ATOM 9014 H1 WAT 4834 94.272 51.464 87.086 1.00 0.00 H ATOM 9015 H2 WAT 4834 94.236 52.242 88.384 1.00 0.00 H TER 9017 WAT 4834 ATOM 9017 O WAT 4835 37.980 71.038 140.165 1.00 0.00 O ATOM 9018 H1 WAT 4835 38.842 70.646 140.302 1.00 0.00 H ATOM 9019 H2 WAT 4835 37.963 71.791 140.757 1.00 0.00 H TER 9021 WAT 4835 ATOM 9021 O WAT 4836 6.911 120.457 87.437 1.00 0.00 O ATOM 9022 H1 WAT 4836 7.568 120.742 88.071 1.00 0.00 H ATOM 9023 H2 WAT 4836 7.317 119.714 86.990 1.00 0.00 H TER 9025 WAT 4836 ATOM 9025 O WAT 4837 111.347 99.595 93.026 1.00 0.00 O ATOM 9026 H1 WAT 4837 110.742 98.863 92.907 1.00 0.00 H ATOM 9027 H2 WAT 4837 112.039 99.246 93.586 1.00 0.00 H TER 9029 WAT 4837 ATOM 9029 O WAT 4838 133.012 65.776 14.633 1.00 0.00 O ATOM 9030 H1 WAT 4838 132.118 65.469 14.783 1.00 0.00 H ATOM 9031 H2 WAT 4838 133.429 65.729 15.494 1.00 0.00 H TER 9033 WAT 4838 ATOM 9033 O WAT 4839 141.140 62.245 95.953 1.00 0.00 O ATOM 9034 H1 WAT 4839 141.245 61.709 96.739 1.00 0.00 H ATOM 9035 H2 WAT 4839 141.719 62.994 96.095 1.00 0.00 H TER 9037 WAT 4839 ATOM 9037 O WAT 4840 95.336 105.448 84.005 1.00 0.00 O ATOM 9038 H1 WAT 4840 96.225 105.129 83.851 1.00 0.00 H ATOM 9039 H2 WAT 4840 94.970 105.571 83.130 1.00 0.00 H TER 9041 WAT 4840 ATOM 9041 O WAT 4841 11.774 89.691 151.244 1.00 0.00 O ATOM 9042 H1 WAT 4841 11.805 89.884 150.307 1.00 0.00 H ATOM 9043 H2 WAT 4841 12.158 88.818 151.322 1.00 0.00 H TER 9045 WAT 4841 ATOM 9045 O WAT 4842 42.559 33.829 103.526 1.00 0.00 O ATOM 9046 H1 WAT 4842 41.622 34.007 103.615 1.00 0.00 H ATOM 9047 H2 WAT 4842 42.888 33.824 104.425 1.00 0.00 H TER 9049 WAT 4842 ATOM 9049 O WAT 4843 40.126 30.581 76.980 1.00 0.00 O ATOM 9050 H1 WAT 4843 39.837 31.472 77.177 1.00 0.00 H ATOM 9051 H2 WAT 4843 40.733 30.684 76.246 1.00 0.00 H TER 9053 WAT 4843 ATOM 9053 O WAT 4844 136.925 143.329 118.819 1.00 0.00 O ATOM 9054 H1 WAT 4844 136.258 143.759 119.355 1.00 0.00 H ATOM 9055 H2 WAT 4844 137.707 143.869 118.932 1.00 0.00 H TER 9057 WAT 4844 ATOM 9057 O WAT 4845 117.913 95.521 80.512 1.00 0.00 O ATOM 9058 H1 WAT 4845 117.484 96.150 81.093 1.00 0.00 H ATOM 9059 H2 WAT 4845 117.881 94.693 80.990 1.00 0.00 H TER 9061 WAT 4845 ATOM 9061 O WAT 4846 141.255 23.740 128.500 1.00 0.00 O ATOM 9062 H1 WAT 4846 142.009 23.465 129.021 1.00 0.00 H ATOM 9063 H2 WAT 4846 141.319 24.695 128.471 1.00 0.00 H TER 9065 WAT 4846 ATOM 9065 O WAT 4847 6.203 22.042 0.817 1.00 0.00 O ATOM 9066 H1 WAT 4847 6.286 21.795 1.738 1.00 0.00 H ATOM 9067 H2 WAT 4847 5.271 22.225 0.701 1.00 0.00 H TER 9069 WAT 4847 ATOM 9069 O WAT 4848 35.276 1.661 7.356 1.00 0.00 O ATOM 9070 H1 WAT 4848 35.551 1.512 6.451 1.00 0.00 H ATOM 9071 H2 WAT 4848 36.094 1.767 7.841 1.00 0.00 H TER 9073 WAT 4848 ATOM 9073 O WAT 4849 39.594 99.328 25.280 1.00 0.00 O ATOM 9074 H1 WAT 4849 39.172 98.622 25.770 1.00 0.00 H ATOM 9075 H2 WAT 4849 40.531 99.168 25.389 1.00 0.00 H TER 9077 WAT 4849 ATOM 9077 O WAT 4850 37.729 85.166 2.789 1.00 0.00 O ATOM 9078 H1 WAT 4850 37.791 86.121 2.785 1.00 0.00 H ATOM 9079 H2 WAT 4850 38.175 84.901 3.593 1.00 0.00 H TER 9081 WAT 4850 ATOM 9081 O WAT 4851 123.546 97.210 72.774 1.00 0.00 O ATOM 9082 H1 WAT 4851 124.198 97.539 73.392 1.00 0.00 H ATOM 9083 H2 WAT 4851 123.073 97.991 72.485 1.00 0.00 H TER 9085 WAT 4851 ATOM 9085 O WAT 4852 36.116 141.198 144.321 1.00 0.00 O ATOM 9086 H1 WAT 4852 36.364 140.274 144.359 1.00 0.00 H ATOM 9087 H2 WAT 4852 35.552 141.326 145.083 1.00 0.00 H TER 9089 WAT 4852 ATOM 9089 O WAT 4853 129.326 2.471 79.974 1.00 0.00 O ATOM 9090 H1 WAT 4853 129.284 1.972 80.790 1.00 0.00 H ATOM 9091 H2 WAT 4853 129.395 1.805 79.290 1.00 0.00 H TER 9093 WAT 4853 ATOM 9093 O WAT 4854 113.061 140.835 84.203 1.00 0.00 O ATOM 9094 H1 WAT 4854 113.670 140.741 83.472 1.00 0.00 H ATOM 9095 H2 WAT 4854 113.128 141.756 84.455 1.00 0.00 H TER 9097 WAT 4854 ATOM 9097 O WAT 4855 23.643 119.696 55.346 1.00 0.00 O ATOM 9098 H1 WAT 4855 23.096 119.415 54.613 1.00 0.00 H ATOM 9099 H2 WAT 4855 23.766 118.905 55.870 1.00 0.00 H TER 9101 WAT 4855 ATOM 9101 O WAT 4856 53.095 57.623 147.796 1.00 0.00 O ATOM 9102 H1 WAT 4856 53.334 57.042 148.518 1.00 0.00 H ATOM 9103 H2 WAT 4856 53.920 58.033 147.536 1.00 0.00 H TER 9105 WAT 4856 ATOM 9105 O WAT 4857 44.366 42.677 138.162 1.00 0.00 O ATOM 9106 H1 WAT 4857 44.596 43.442 138.690 1.00 0.00 H ATOM 9107 H2 WAT 4857 43.885 42.108 138.762 1.00 0.00 H TER 9109 WAT 4857 ATOM 9109 O WAT 4858 33.424 19.507 22.050 1.00 0.00 O ATOM 9110 H1 WAT 4858 32.513 19.216 22.095 1.00 0.00 H ATOM 9111 H2 WAT 4858 33.911 18.730 21.777 1.00 0.00 H TER 9113 WAT 4858 ATOM 9113 O WAT 4859 111.187 27.343 109.252 1.00 0.00 O ATOM 9114 H1 WAT 4859 110.794 26.847 109.969 1.00 0.00 H ATOM 9115 H2 WAT 4859 111.064 26.789 108.481 1.00 0.00 H TER 9117 WAT 4859 ATOM 9117 O WAT 4860 45.444 51.328 144.108 1.00 0.00 O ATOM 9118 H1 WAT 4860 45.491 51.007 143.207 1.00 0.00 H ATOM 9119 H2 WAT 4860 46.358 51.448 144.367 1.00 0.00 H TER 9121 WAT 4860 ATOM 9121 O WAT 4861 67.159 6.127 97.227 1.00 0.00 O ATOM 9122 H1 WAT 4861 66.635 6.561 97.901 1.00 0.00 H ATOM 9123 H2 WAT 4861 67.542 6.844 96.723 1.00 0.00 H TER 9125 WAT 4861 ATOM 9125 O WAT 4862 59.734 144.166 71.307 1.00 0.00 O ATOM 9126 H1 WAT 4862 58.969 144.653 71.613 1.00 0.00 H ATOM 9127 H2 WAT 4862 60.437 144.815 71.283 1.00 0.00 H TER 9129 WAT 4862 ATOM 9129 O WAT 4863 32.816 131.525 105.580 1.00 0.00 O ATOM 9130 H1 WAT 4863 33.655 131.976 105.489 1.00 0.00 H ATOM 9131 H2 WAT 4863 32.881 130.776 104.989 1.00 0.00 H TER 9133 WAT 4863 ATOM 9133 O WAT 4864 60.593 41.822 109.997 1.00 0.00 O ATOM 9134 H1 WAT 4864 60.475 41.409 110.853 1.00 0.00 H ATOM 9135 H2 WAT 4864 61.451 42.244 110.052 1.00 0.00 H TER 9137 WAT 4864 ATOM 9137 O WAT 4865 106.559 138.896 119.784 1.00 0.00 O ATOM 9138 H1 WAT 4865 107.179 139.441 120.269 1.00 0.00 H ATOM 9139 H2 WAT 4865 106.494 139.314 118.925 1.00 0.00 H TER 9141 WAT 4865 ATOM 9141 O WAT 4866 54.820 137.343 153.830 1.00 0.00 O ATOM 9142 H1 WAT 4866 55.721 137.619 153.661 1.00 0.00 H ATOM 9143 H2 WAT 4866 54.397 138.119 154.198 1.00 0.00 H TER 9145 WAT 4866 ATOM 9145 O WAT 4867 47.530 76.400 8.255 1.00 0.00 O ATOM 9146 H1 WAT 4867 48.030 76.881 7.596 1.00 0.00 H ATOM 9147 H2 WAT 4867 48.180 76.153 8.914 1.00 0.00 H TER 9149 WAT 4867 ATOM 9149 O WAT 4868 38.039 110.199 144.641 1.00 0.00 O ATOM 9150 H1 WAT 4868 38.643 110.925 144.486 1.00 0.00 H ATOM 9151 H2 WAT 4868 37.529 110.135 143.834 1.00 0.00 H TER 9153 WAT 4868 ATOM 9153 O WAT 4869 88.823 56.369 57.332 1.00 0.00 O ATOM 9154 H1 WAT 4869 88.033 56.898 57.442 1.00 0.00 H ATOM 9155 H2 WAT 4869 89.247 56.391 58.190 1.00 0.00 H TER 9157 WAT 4869 ATOM 9157 O WAT 4870 142.804 80.404 22.476 1.00 0.00 O ATOM 9158 H1 WAT 4870 142.557 81.327 22.530 1.00 0.00 H ATOM 9159 H2 WAT 4870 142.562 80.040 23.328 1.00 0.00 H TER 9161 WAT 4870 ATOM 9161 O WAT 4871 81.871 131.508 94.236 1.00 0.00 O ATOM 9162 H1 WAT 4871 81.309 132.129 93.773 1.00 0.00 H ATOM 9163 H2 WAT 4871 82.750 131.880 94.163 1.00 0.00 H TER 9165 WAT 4871 ATOM 9165 O WAT 4872 20.871 29.621 69.564 1.00 0.00 O ATOM 9166 H1 WAT 4872 21.796 29.848 69.468 1.00 0.00 H ATOM 9167 H2 WAT 4872 20.737 28.898 68.952 1.00 0.00 H TER 9169 WAT 4872 ATOM 9169 O WAT 4873 9.282 48.170 100.168 1.00 0.00 O ATOM 9170 H1 WAT 4873 8.708 48.834 99.785 1.00 0.00 H ATOM 9171 H2 WAT 4873 9.191 47.413 99.590 1.00 0.00 H TER 9173 WAT 4873 ATOM 9173 O WAT 4874 118.820 129.260 135.233 1.00 0.00 O ATOM 9174 H1 WAT 4874 118.135 128.716 135.621 1.00 0.00 H ATOM 9175 H2 WAT 4874 118.777 129.068 134.296 1.00 0.00 H TER 9177 WAT 4874 ATOM 9177 O WAT 4875 46.839 40.271 76.730 1.00 0.00 O ATOM 9178 H1 WAT 4875 45.957 40.268 77.102 1.00 0.00 H ATOM 9179 H2 WAT 4875 46.995 39.361 76.477 1.00 0.00 H TER 9181 WAT 4875 ATOM 9181 O WAT 4876 33.599 18.354 123.183 1.00 0.00 O ATOM 9182 H1 WAT 4876 33.252 18.009 124.007 1.00 0.00 H ATOM 9183 H2 WAT 4876 32.822 18.548 122.659 1.00 0.00 H TER 9185 WAT 4876 ATOM 9185 O WAT 4877 112.846 63.518 118.798 1.00 0.00 O ATOM 9186 H1 WAT 4877 113.613 63.090 119.178 1.00 0.00 H ATOM 9187 H2 WAT 4877 113.158 63.873 117.966 1.00 0.00 H TER 9189 WAT 4877 ATOM 9189 O WAT 4878 32.749 34.572 126.924 1.00 0.00 O ATOM 9190 H1 WAT 4878 32.884 34.260 126.029 1.00 0.00 H ATOM 9191 H2 WAT 4878 31.991 35.153 126.862 1.00 0.00 H TER 9193 WAT 4878 ATOM 9193 O WAT 4879 4.089 12.564 12.984 1.00 0.00 O ATOM 9194 H1 WAT 4879 4.117 12.410 13.928 1.00 0.00 H ATOM 9195 H2 WAT 4879 3.718 11.760 12.621 1.00 0.00 H TER 9197 WAT 4879 ATOM 9197 O WAT 4880 121.553 93.188 72.802 1.00 0.00 O ATOM 9198 H1 WAT 4880 121.256 93.035 71.905 1.00 0.00 H ATOM 9199 H2 WAT 4880 122.413 92.769 72.844 1.00 0.00 H TER 9201 WAT 4880 ATOM 9201 O WAT 4881 26.420 58.138 124.220 1.00 0.00 O ATOM 9202 H1 WAT 4881 26.422 58.918 124.775 1.00 0.00 H ATOM 9203 H2 WAT 4881 25.496 57.988 124.021 1.00 0.00 H TER 9205 WAT 4881 ATOM 9205 O WAT 4882 125.773 96.674 77.106 1.00 0.00 O ATOM 9206 H1 WAT 4882 125.186 97.004 76.425 1.00 0.00 H ATOM 9207 H2 WAT 4882 126.062 95.822 76.781 1.00 0.00 H TER 9209 WAT 4882 ATOM 9209 O WAT 4883 133.560 121.314 100.558 1.00 0.00 O ATOM 9210 H1 WAT 4883 133.866 121.262 99.652 1.00 0.00 H ATOM 9211 H2 WAT 4883 132.626 121.509 100.486 1.00 0.00 H TER 9213 WAT 4883 ATOM 9213 O WAT 4884 9.253 91.734 100.462 1.00 0.00 O ATOM 9214 H1 WAT 4884 9.332 92.567 100.928 1.00 0.00 H ATOM 9215 H2 WAT 4884 10.045 91.251 100.700 1.00 0.00 H TER 9217 WAT 4884 ATOM 9217 O WAT 4885 50.449 94.702 93.085 1.00 0.00 O ATOM 9218 H1 WAT 4885 51.323 94.315 93.124 1.00 0.00 H ATOM 9219 H2 WAT 4885 50.102 94.603 93.971 1.00 0.00 H TER 9221 WAT 4885 ATOM 9221 O WAT 4886 42.816 93.944 22.128 1.00 0.00 O ATOM 9222 H1 WAT 4886 42.649 93.862 23.067 1.00 0.00 H ATOM 9223 H2 WAT 4886 43.750 94.142 22.067 1.00 0.00 H TER 9225 WAT 4886 ATOM 9225 O WAT 4887 135.919 128.339 104.774 1.00 0.00 O ATOM 9226 H1 WAT 4887 136.400 128.565 105.570 1.00 0.00 H ATOM 9227 H2 WAT 4887 136.008 127.389 104.702 1.00 0.00 H TER 9229 WAT 4887 ATOM 9229 O WAT 4888 29.252 124.894 79.608 1.00 0.00 O ATOM 9230 H1 WAT 4888 28.442 124.396 79.718 1.00 0.00 H ATOM 9231 H2 WAT 4888 28.964 125.758 79.313 1.00 0.00 H TER 9233 WAT 4888 ATOM 9233 O WAT 4889 57.738 93.017 15.765 1.00 0.00 O ATOM 9234 H1 WAT 4889 57.618 93.945 15.967 1.00 0.00 H ATOM 9235 H2 WAT 4889 58.685 92.911 15.682 1.00 0.00 H TER 9237 WAT 4889 ATOM 9237 O WAT 4890 84.411 59.507 129.968 1.00 0.00 O ATOM 9238 H1 WAT 4890 84.887 58.814 129.509 1.00 0.00 H ATOM 9239 H2 WAT 4890 85.071 60.179 130.135 1.00 0.00 H TER 9241 WAT 4890 ATOM 9241 O WAT 4891 44.856 27.847 127.189 1.00 0.00 O ATOM 9242 H1 WAT 4891 44.112 27.245 127.215 1.00 0.00 H ATOM 9243 H2 WAT 4891 44.464 28.716 127.271 1.00 0.00 H TER 9245 WAT 4891 ATOM 9245 O WAT 4892 137.722 0.247 65.305 1.00 0.00 O ATOM 9246 H1 WAT 4892 138.274 0.049 64.549 1.00 0.00 H ATOM 9247 H2 WAT 4892 138.317 0.207 66.053 1.00 0.00 H TER 9249 WAT 4892 ATOM 9249 O WAT 4893 59.313 100.250 87.039 1.00 0.00 O ATOM 9250 H1 WAT 4893 59.228 99.906 87.928 1.00 0.00 H ATOM 9251 H2 WAT 4893 58.445 100.132 86.653 1.00 0.00 H TER 9253 WAT 4893 ATOM 9253 O WAT 4894 33.836 57.547 98.222 1.00 0.00 O ATOM 9254 H1 WAT 4894 33.926 56.826 98.846 1.00 0.00 H ATOM 9255 H2 WAT 4894 33.270 57.198 97.533 1.00 0.00 H TER 9257 WAT 4894 ATOM 9257 O WAT 4895 102.897 59.348 67.797 1.00 0.00 O ATOM 9258 H1 WAT 4895 103.052 60.281 67.649 1.00 0.00 H ATOM 9259 H2 WAT 4895 102.727 59.280 68.736 1.00 0.00 H TER 9261 WAT 4895 ATOM 9261 O WAT 4896 32.086 98.059 153.928 1.00 0.00 O ATOM 9262 H1 WAT 4896 31.473 97.892 154.645 1.00 0.00 H ATOM 9263 H2 WAT 4896 32.279 98.994 153.991 1.00 0.00 H TER 9265 WAT 4896 ATOM 9265 O WAT 4897 18.787 25.742 128.586 1.00 0.00 O ATOM 9266 H1 WAT 4897 18.049 25.180 128.821 1.00 0.00 H ATOM 9267 H2 WAT 4897 18.395 26.452 128.078 1.00 0.00 H TER 9269 WAT 4897 ATOM 9269 O WAT 4898 77.993 137.464 6.695 1.00 0.00 O ATOM 9270 H1 WAT 4898 78.476 136.648 6.827 1.00 0.00 H ATOM 9271 H2 WAT 4898 78.003 137.889 7.552 1.00 0.00 H TER 9273 WAT 4898 ATOM 9273 O WAT 4899 31.247 127.050 70.030 1.00 0.00 O ATOM 9274 H1 WAT 4899 31.045 126.293 69.481 1.00 0.00 H ATOM 9275 H2 WAT 4899 32.145 127.285 69.794 1.00 0.00 H TER 9277 WAT 4899 ATOM 9277 O WAT 4900 50.370 71.693 139.178 1.00 0.00 O ATOM 9278 H1 WAT 4900 49.833 71.702 138.386 1.00 0.00 H ATOM 9279 H2 WAT 4900 51.208 72.066 138.903 1.00 0.00 H TER 9281 WAT 4900 ATOM 9281 O WAT 4901 73.459 57.171 87.036 1.00 0.00 O ATOM 9282 H1 WAT 4901 72.841 57.593 87.633 1.00 0.00 H ATOM 9283 H2 WAT 4901 74.319 57.471 87.330 1.00 0.00 H TER 9285 WAT 4901 ATOM 9285 O WAT 4902 116.382 59.447 135.894 1.00 0.00 O ATOM 9286 H1 WAT 4902 117.070 59.053 135.357 1.00 0.00 H ATOM 9287 H2 WAT 4902 115.702 58.775 135.942 1.00 0.00 H TER 9289 WAT 4902 ATOM 9289 O WAT 4903 17.893 43.921 88.325 1.00 0.00 O ATOM 9290 H1 WAT 4903 16.958 43.719 88.306 1.00 0.00 H ATOM 9291 H2 WAT 4903 18.022 44.384 89.153 1.00 0.00 H TER 9293 WAT 4903 ATOM 9293 O WAT 4904 103.254 60.542 75.094 1.00 0.00 O ATOM 9294 H1 WAT 4904 103.867 61.270 75.193 1.00 0.00 H ATOM 9295 H2 WAT 4904 103.793 59.758 75.200 1.00 0.00 H TER 9297 WAT 4904 ATOM 9297 O WAT 4905 72.012 16.294 69.478 1.00 0.00 O ATOM 9298 H1 WAT 4905 72.379 15.775 70.194 1.00 0.00 H ATOM 9299 H2 WAT 4905 72.666 16.236 68.781 1.00 0.00 H TER 9301 WAT 4905 ATOM 9301 O WAT 4906 114.653 102.249 115.039 1.00 0.00 O ATOM 9302 H1 WAT 4906 115.607 102.257 115.125 1.00 0.00 H ATOM 9303 H2 WAT 4906 114.389 101.400 115.393 1.00 0.00 H TER 9305 WAT 4906 ATOM 9305 O WAT 4907 90.279 13.374 14.250 1.00 0.00 O ATOM 9306 H1 WAT 4907 90.201 13.949 15.012 1.00 0.00 H ATOM 9307 H2 WAT 4907 89.429 13.436 13.816 1.00 0.00 H TER 9309 WAT 4907 ATOM 9309 O WAT 4908 41.249 59.777 100.852 1.00 0.00 O ATOM 9310 H1 WAT 4908 40.968 59.405 101.688 1.00 0.00 H ATOM 9311 H2 WAT 4908 40.435 59.922 100.369 1.00 0.00 H TER 9313 WAT 4908 ATOM 9313 O WAT 4909 78.133 78.226 118.590 1.00 0.00 O ATOM 9314 H1 WAT 4909 78.002 77.419 119.089 1.00 0.00 H ATOM 9315 H2 WAT 4909 79.053 78.450 118.735 1.00 0.00 H TER 9317 WAT 4909 ATOM 9317 O WAT 4910 128.484 59.826 62.159 1.00 0.00 O ATOM 9318 H1 WAT 4910 127.862 60.545 62.266 1.00 0.00 H ATOM 9319 H2 WAT 4910 129.197 60.034 62.763 1.00 0.00 H TER 9321 WAT 4910 ATOM 9321 O WAT 4911 73.119 72.471 8.459 1.00 0.00 O ATOM 9322 H1 WAT 4911 74.061 72.411 8.621 1.00 0.00 H ATOM 9323 H2 WAT 4911 72.915 71.691 7.943 1.00 0.00 H TER 9325 WAT 4911 ATOM 9325 O WAT 4912 90.991 83.208 13.268 1.00 0.00 O ATOM 9326 H1 WAT 4912 91.365 82.548 12.684 1.00 0.00 H ATOM 9327 H2 WAT 4912 91.726 83.783 13.482 1.00 0.00 H TER 9329 WAT 4912 ATOM 9329 O WAT 4913 124.441 13.648 102.788 1.00 0.00 O ATOM 9330 H1 WAT 4913 124.809 12.788 102.588 1.00 0.00 H ATOM 9331 H2 WAT 4913 125.102 14.269 102.482 1.00 0.00 H TER 9333 WAT 4913 ATOM 9333 O WAT 4914 56.208 33.017 76.646 1.00 0.00 O ATOM 9334 H1 WAT 4914 56.529 33.658 76.012 1.00 0.00 H ATOM 9335 H2 WAT 4914 56.263 32.178 76.188 1.00 0.00 H TER 9337 WAT 4914 ATOM 9337 O WAT 4915 109.438 111.138 97.205 1.00 0.00 O ATOM 9338 H1 WAT 4915 108.902 111.584 97.860 1.00 0.00 H ATOM 9339 H2 WAT 4915 110.331 111.432 97.385 1.00 0.00 H TER 9341 WAT 4915 ATOM 9341 O WAT 4916 34.222 44.723 151.099 1.00 0.00 O ATOM 9342 H1 WAT 4916 33.535 45.213 151.551 1.00 0.00 H ATOM 9343 H2 WAT 4916 33.766 43.985 150.696 1.00 0.00 H TER 9345 WAT 4916 ATOM 9345 O WAT 4917 139.364 54.781 94.404 1.00 0.00 O ATOM 9346 H1 WAT 4917 139.301 54.911 95.350 1.00 0.00 H ATOM 9347 H2 WAT 4917 140.048 55.389 94.124 1.00 0.00 H TER 9349 WAT 4917 ATOM 9349 O WAT 4918 72.106 46.611 94.844 1.00 0.00 O ATOM 9350 H1 WAT 4918 71.779 46.548 93.946 1.00 0.00 H ATOM 9351 H2 WAT 4918 71.667 45.899 95.309 1.00 0.00 H TER 9353 WAT 4918 ATOM 9353 O WAT 4919 143.348 13.573 8.049 1.00 0.00 O ATOM 9354 H1 WAT 4919 142.691 13.670 7.361 1.00 0.00 H ATOM 9355 H2 WAT 4919 143.184 14.306 8.642 1.00 0.00 H TER 9357 WAT 4919 ATOM 9357 O WAT 4920 40.795 38.135 112.624 1.00 0.00 O ATOM 9358 H1 WAT 4920 41.015 38.942 113.088 1.00 0.00 H ATOM 9359 H2 WAT 4920 39.839 38.097 112.649 1.00 0.00 H TER 9361 WAT 4920 ATOM 9361 O WAT 4921 82.067 143.492 140.126 1.00 0.00 O ATOM 9362 H1 WAT 4921 81.629 143.061 140.859 1.00 0.00 H ATOM 9363 H2 WAT 4921 82.727 144.051 140.535 1.00 0.00 H TER 9365 WAT 4921 ATOM 9365 O WAT 4922 45.664 35.579 110.709 1.00 0.00 O ATOM 9366 H1 WAT 4922 46.100 36.419 110.561 1.00 0.00 H ATOM 9367 H2 WAT 4922 45.317 35.644 111.599 1.00 0.00 H TER 9369 WAT 4922 ATOM 9369 O WAT 4923 11.761 122.755 97.173 1.00 0.00 O ATOM 9370 H1 WAT 4923 11.917 121.967 97.694 1.00 0.00 H ATOM 9371 H2 WAT 4923 11.878 123.477 97.790 1.00 0.00 H TER 9373 WAT 4923 ATOM 9373 O WAT 4924 127.150 131.603 148.220 1.00 0.00 O ATOM 9374 H1 WAT 4924 127.999 131.188 148.065 1.00 0.00 H ATOM 9375 H2 WAT 4924 126.957 131.416 149.139 1.00 0.00 H TER 9377 WAT 4924 ATOM 9377 O WAT 4925 40.075 48.551 131.972 1.00 0.00 O ATOM 9378 H1 WAT 4925 39.389 48.021 132.379 1.00 0.00 H ATOM 9379 H2 WAT 4925 40.861 48.008 132.025 1.00 0.00 H TER 9381 WAT 4925 ATOM 9381 O WAT 4926 34.589 78.158 152.422 1.00 0.00 O ATOM 9382 H1 WAT 4926 34.274 77.594 153.129 1.00 0.00 H ATOM 9383 H2 WAT 4926 35.403 78.532 152.759 1.00 0.00 H TER 9385 WAT 4926 ATOM 9385 O WAT 4927 59.984 50.685 109.248 1.00 0.00 O ATOM 9386 H1 WAT 4927 60.049 50.293 110.119 1.00 0.00 H ATOM 9387 H2 WAT 4927 59.078 50.527 108.981 1.00 0.00 H TER 9389 WAT 4927 ATOM 9389 O WAT 4928 15.518 136.645 110.297 1.00 0.00 O ATOM 9390 H1 WAT 4928 14.793 136.992 109.778 1.00 0.00 H ATOM 9391 H2 WAT 4928 16.034 137.416 110.535 1.00 0.00 H TER 9393 WAT 4928 ATOM 9393 O WAT 4929 114.594 22.616 101.834 1.00 0.00 O ATOM 9394 H1 WAT 4929 114.946 23.450 101.524 1.00 0.00 H ATOM 9395 H2 WAT 4929 114.729 22.635 102.781 1.00 0.00 H TER 9397 WAT 4929 ATOM 9397 O WAT 4930 112.907 105.937 2.542 1.00 0.00 O ATOM 9398 H1 WAT 4930 112.767 105.238 1.903 1.00 0.00 H ATOM 9399 H2 WAT 4930 113.840 106.142 2.472 1.00 0.00 H TER 9401 WAT 4930 ATOM 9401 O WAT 4931 33.963 104.103 55.975 1.00 0.00 O ATOM 9402 H1 WAT 4931 34.052 104.959 55.555 1.00 0.00 H ATOM 9403 H2 WAT 4931 34.864 103.806 56.104 1.00 0.00 H TER 9405 WAT 4931 ATOM 9405 O WAT 4932 8.663 59.566 2.188 1.00 0.00 O ATOM 9406 H1 WAT 4932 9.489 59.443 2.656 1.00 0.00 H ATOM 9407 H2 WAT 4932 8.198 60.232 2.694 1.00 0.00 H TER 9409 WAT 4932 ATOM 9409 O WAT 4933 1.257 6.418 115.493 1.00 0.00 O ATOM 9410 H1 WAT 4933 1.363 6.508 116.440 1.00 0.00 H ATOM 9411 H2 WAT 4933 0.354 6.120 115.380 1.00 0.00 H TER 9413 WAT 4933 ATOM 9413 O WAT 4934 90.310 38.580 95.451 1.00 0.00 O ATOM 9414 H1 WAT 4934 89.542 38.639 96.019 1.00 0.00 H ATOM 9415 H2 WAT 4934 90.985 39.080 95.909 1.00 0.00 H TER 9417 WAT 4934 ATOM 9417 O WAT 4935 117.265 6.181 140.345 1.00 0.00 O ATOM 9418 H1 WAT 4935 116.974 6.965 139.881 1.00 0.00 H ATOM 9419 H2 WAT 4935 117.692 6.514 141.135 1.00 0.00 H TER 9421 WAT 4935 ATOM 9421 O WAT 4936 91.154 78.676 144.926 1.00 0.00 O ATOM 9422 H1 WAT 4936 91.709 78.749 145.702 1.00 0.00 H ATOM 9423 H2 WAT 4936 90.544 77.969 145.134 1.00 0.00 H TER 9425 WAT 4936 ATOM 9425 O WAT 4937 101.618 74.740 92.208 1.00 0.00 O ATOM 9426 H1 WAT 4937 100.811 74.453 91.781 1.00 0.00 H ATOM 9427 H2 WAT 4937 101.429 75.630 92.505 1.00 0.00 H TER 9429 WAT 4937 ATOM 9429 O WAT 4938 30.113 22.009 125.055 1.00 0.00 O ATOM 9430 H1 WAT 4938 31.060 21.990 125.199 1.00 0.00 H ATOM 9431 H2 WAT 4938 30.013 22.360 124.170 1.00 0.00 H TER 9433 WAT 4938 ATOM 9433 O WAT 4939 103.466 49.942 128.422 1.00 0.00 O ATOM 9434 H1 WAT 4939 102.585 50.023 128.058 1.00 0.00 H ATOM 9435 H2 WAT 4939 103.836 49.174 127.986 1.00 0.00 H TER 9437 WAT 4939 ATOM 9437 O WAT 4940 112.008 59.750 17.344 1.00 0.00 O ATOM 9438 H1 WAT 4940 112.820 59.731 16.837 1.00 0.00 H ATOM 9439 H2 WAT 4940 111.320 59.576 16.702 1.00 0.00 H TER 9441 WAT 4940 ATOM 9441 O WAT 4941 144.904 107.852 79.433 1.00 0.00 O ATOM 9442 H1 WAT 4941 145.545 107.210 79.737 1.00 0.00 H ATOM 9443 H2 WAT 4941 145.430 108.545 79.033 1.00 0.00 H TER 9445 WAT 4941 ATOM 9445 O WAT 4942 34.498 54.383 137.295 1.00 0.00 O ATOM 9446 H1 WAT 4942 33.904 54.033 136.631 1.00 0.00 H ATOM 9447 H2 WAT 4942 35.373 54.161 136.975 1.00 0.00 H TER 9449 WAT 4942 ATOM 9449 O WAT 4943 65.564 101.647 134.685 1.00 0.00 O ATOM 9450 H1 WAT 4943 65.465 102.049 135.548 1.00 0.00 H ATOM 9451 H2 WAT 4943 65.141 102.262 134.085 1.00 0.00 H TER 9453 WAT 4943 ATOM 9453 O WAT 4944 39.186 66.742 77.129 1.00 0.00 O ATOM 9454 H1 WAT 4944 39.003 66.689 76.191 1.00 0.00 H ATOM 9455 H2 WAT 4944 39.979 66.219 77.248 1.00 0.00 H TER 9457 WAT 4944 ATOM 9457 O WAT 4945 17.299 3.546 131.447 1.00 0.00 O ATOM 9458 H1 WAT 4945 17.308 3.310 130.519 1.00 0.00 H ATOM 9459 H2 WAT 4945 18.197 3.821 131.633 1.00 0.00 H TER 9461 WAT 4945 ATOM 9461 O WAT 4946 6.651 5.123 4.108 1.00 0.00 O ATOM 9462 H1 WAT 4946 7.515 5.405 4.410 1.00 0.00 H ATOM 9463 H2 WAT 4946 6.802 4.795 3.222 1.00 0.00 H TER 9465 WAT 4946 ATOM 9465 O WAT 4947 68.559 35.313 92.035 1.00 0.00 O ATOM 9466 H1 WAT 4947 67.658 34.996 92.098 1.00 0.00 H ATOM 9467 H2 WAT 4947 69.046 34.579 91.660 1.00 0.00 H TER 9469 WAT 4947 ATOM 9469 O WAT 4948 65.718 33.974 148.726 1.00 0.00 O ATOM 9470 H1 WAT 4948 65.040 34.648 148.697 1.00 0.00 H ATOM 9471 H2 WAT 4948 65.545 33.427 147.960 1.00 0.00 H TER 9473 WAT 4948 ATOM 9473 O WAT 4949 44.600 65.122 143.917 1.00 0.00 O ATOM 9474 H1 WAT 4949 43.880 64.756 144.432 1.00 0.00 H ATOM 9475 H2 WAT 4949 45.056 64.357 143.565 1.00 0.00 H TER 9477 WAT 4949 ATOM 9477 O WAT 4950 113.377 86.677 55.936 1.00 0.00 O ATOM 9478 H1 WAT 4950 114.206 86.872 55.500 1.00 0.00 H ATOM 9479 H2 WAT 4950 112.820 87.430 55.739 1.00 0.00 H TER 9481 WAT 4950 ATOM 9481 O WAT 4951 101.569 0.532 71.627 1.00 0.00 O ATOM 9482 H1 WAT 4951 101.539 -0.092 72.353 1.00 0.00 H ATOM 9483 H2 WAT 4951 101.699 -0.012 70.850 1.00 0.00 H TER 9485 WAT 4951 ATOM 9485 O WAT 4952 32.677 116.440 138.992 1.00 0.00 O ATOM 9486 H1 WAT 4952 33.193 116.427 139.798 1.00 0.00 H ATOM 9487 H2 WAT 4952 33.170 115.891 138.383 1.00 0.00 H TER 9489 WAT 4952 ATOM 9489 O WAT 4953 110.601 132.604 65.240 1.00 0.00 O ATOM 9490 H1 WAT 4953 110.829 132.876 64.351 1.00 0.00 H ATOM 9491 H2 WAT 4953 111.244 133.042 65.797 1.00 0.00 H TER 9493 WAT 4953 ATOM 9493 O WAT 4954 16.053 108.800 75.453 1.00 0.00 O ATOM 9494 H1 WAT 4954 16.526 109.607 75.250 1.00 0.00 H ATOM 9495 H2 WAT 4954 16.680 108.273 75.949 1.00 0.00 H TER 9497 WAT 4954 ATOM 9497 O WAT 4955 24.469 115.540 89.794 1.00 0.00 O ATOM 9498 H1 WAT 4955 23.823 115.468 89.091 1.00 0.00 H ATOM 9499 H2 WAT 4955 24.920 116.367 89.621 1.00 0.00 H TER 9501 WAT 4955 ATOM 9501 O WAT 4956 84.703 59.440 137.268 1.00 0.00 O ATOM 9502 H1 WAT 4956 84.137 60.211 137.250 1.00 0.00 H ATOM 9503 H2 WAT 4956 84.278 58.844 137.885 1.00 0.00 H TER 9505 WAT 4956 ATOM 9505 O WAT 4957 79.580 136.615 112.145 1.00 0.00 O ATOM 9506 H1 WAT 4957 79.230 137.435 112.492 1.00 0.00 H ATOM 9507 H2 WAT 4957 80.020 136.867 111.333 1.00 0.00 H TER 9509 WAT 4957 ATOM 9509 O WAT 4958 108.823 108.953 3.212 1.00 0.00 O ATOM 9510 H1 WAT 4958 108.938 108.402 3.987 1.00 0.00 H ATOM 9511 H2 WAT 4958 109.673 108.929 2.773 1.00 0.00 H TER 9513 WAT 4958 ATOM 9513 O WAT 4959 103.665 20.030 148.113 1.00 0.00 O ATOM 9514 H1 WAT 4959 102.758 20.168 147.841 1.00 0.00 H ATOM 9515 H2 WAT 4959 104.095 20.869 147.950 1.00 0.00 H TER 9517 WAT 4959 ATOM 9517 O WAT 4960 64.502 60.500 77.285 1.00 0.00 O ATOM 9518 H1 WAT 4960 65.269 61.037 77.087 1.00 0.00 H ATOM 9519 H2 WAT 4960 64.580 59.747 76.700 1.00 0.00 H TER 9521 WAT 4960 ATOM 9521 O WAT 4961 31.125 95.996 61.813 1.00 0.00 O ATOM 9522 H1 WAT 4961 30.895 96.897 61.586 1.00 0.00 H ATOM 9523 H2 WAT 4961 31.262 96.015 62.760 1.00 0.00 H TER 9525 WAT 4961 ATOM 9525 O WAT 4962 15.821 106.750 5.144 1.00 0.00 O ATOM 9526 H1 WAT 4962 16.137 107.025 6.005 1.00 0.00 H ATOM 9527 H2 WAT 4962 15.072 106.184 5.333 1.00 0.00 H TER 9529 WAT 4962 ATOM 9529 O WAT 4963 134.118 35.609 65.551 1.00 0.00 O ATOM 9530 H1 WAT 4963 134.910 36.102 65.768 1.00 0.00 H ATOM 9531 H2 WAT 4963 133.469 35.905 66.189 1.00 0.00 H TER 9533 WAT 4963 ATOM 9533 O WAT 4964 50.503 24.733 121.672 1.00 0.00 O ATOM 9534 H1 WAT 4964 49.590 24.597 121.420 1.00 0.00 H ATOM 9535 H2 WAT 4964 50.656 25.666 121.527 1.00 0.00 H TER 9537 WAT 4964 ATOM 9537 O WAT 4965 94.365 91.765 122.733 1.00 0.00 O ATOM 9538 H1 WAT 4965 93.565 91.464 123.165 1.00 0.00 H ATOM 9539 H2 WAT 4965 94.129 91.822 121.807 1.00 0.00 H TER 9541 WAT 4965 ATOM 9541 O WAT 4966 62.835 0.858 12.206 1.00 0.00 O ATOM 9542 H1 WAT 4966 62.290 1.417 12.760 1.00 0.00 H ATOM 9543 H2 WAT 4966 62.935 0.049 12.708 1.00 0.00 H TER 9545 WAT 4966 ATOM 9545 O WAT 4967 129.922 33.312 133.867 1.00 0.00 O ATOM 9546 H1 WAT 4967 129.382 33.973 134.300 1.00 0.00 H ATOM 9547 H2 WAT 4967 130.017 32.617 134.517 1.00 0.00 H TER 9549 WAT 4967 ATOM 9549 O WAT 4968 12.764 34.962 121.103 1.00 0.00 O ATOM 9550 H1 WAT 4968 11.842 34.724 120.998 1.00 0.00 H ATOM 9551 H2 WAT 4968 13.223 34.436 120.449 1.00 0.00 H TER 9553 WAT 4968 ATOM 9553 O WAT 4969 85.877 76.322 2.135 1.00 0.00 O ATOM 9554 H1 WAT 4969 85.227 75.720 1.773 1.00 0.00 H ATOM 9555 H2 WAT 4969 85.913 77.042 1.505 1.00 0.00 H TER 9557 WAT 4969 ATOM 9557 O WAT 4970 124.958 106.140 141.536 1.00 0.00 O ATOM 9558 H1 WAT 4970 124.013 105.992 141.567 1.00 0.00 H ATOM 9559 H2 WAT 4970 125.315 105.554 142.203 1.00 0.00 H TER 9561 WAT 4970 ATOM 9561 O WAT 4971 70.142 64.850 101.964 1.00 0.00 O ATOM 9562 H1 WAT 4971 70.383 64.476 102.812 1.00 0.00 H ATOM 9563 H2 WAT 4971 69.204 64.677 101.884 1.00 0.00 H TER 9565 WAT 4971 ATOM 9565 O WAT 4972 24.595 18.571 156.100 1.00 0.00 O ATOM 9566 H1 WAT 4972 23.702 18.909 156.032 1.00 0.00 H ATOM 9567 H2 WAT 4972 24.957 19.006 156.872 1.00 0.00 H TER 9569 WAT 4972 ATOM 9569 O WAT 4973 106.304 138.213 145.778 1.00 0.00 O ATOM 9570 H1 WAT 4973 105.789 137.629 146.333 1.00 0.00 H ATOM 9571 H2 WAT 4973 107.167 138.239 146.192 1.00 0.00 H TER 9573 WAT 4973 ATOM 9573 O WAT 4974 25.457 65.305 12.929 1.00 0.00 O ATOM 9574 H1 WAT 4974 25.715 65.922 13.615 1.00 0.00 H ATOM 9575 H2 WAT 4974 26.234 65.225 12.375 1.00 0.00 H TER 9577 WAT 4974 ATOM 9577 O WAT 4975 62.772 25.490 73.741 1.00 0.00 O ATOM 9578 H1 WAT 4975 62.674 25.226 74.656 1.00 0.00 H ATOM 9579 H2 WAT 4975 63.717 25.470 73.586 1.00 0.00 H TER 9581 WAT 4975 ATOM 9581 O WAT 4976 143.986 36.324 109.248 1.00 0.00 O ATOM 9582 H1 WAT 4976 143.553 35.477 109.353 1.00 0.00 H ATOM 9583 H2 WAT 4976 144.229 36.581 110.138 1.00 0.00 H TER 9585 WAT 4976 ATOM 9585 O WAT 4977 87.090 85.445 93.867 1.00 0.00 O ATOM 9586 H1 WAT 4977 86.138 85.474 93.778 1.00 0.00 H ATOM 9587 H2 WAT 4977 87.242 84.889 94.631 1.00 0.00 H TER 9589 WAT 4977 ATOM 9589 O WAT 4978 22.703 95.686 108.295 1.00 0.00 O ATOM 9590 H1 WAT 4978 23.164 95.543 107.469 1.00 0.00 H ATOM 9591 H2 WAT 4978 22.166 94.902 108.408 1.00 0.00 H TER 9593 WAT 4978 ATOM 9593 O WAT 4979 19.657 20.114 21.372 1.00 0.00 O ATOM 9594 H1 WAT 4979 20.596 20.271 21.272 1.00 0.00 H ATOM 9595 H2 WAT 4979 19.361 20.801 21.968 1.00 0.00 H TER 9597 WAT 4979 ATOM 9597 O WAT 4980 107.839 113.973 123.496 1.00 0.00 O ATOM 9598 H1 WAT 4980 107.021 114.265 123.092 1.00 0.00 H ATOM 9599 H2 WAT 4980 107.565 113.355 124.173 1.00 0.00 H TER 9601 WAT 4980 ATOM 9601 O WAT 4981 126.284 8.088 73.430 1.00 0.00 O ATOM 9602 H1 WAT 4981 125.982 8.964 73.670 1.00 0.00 H ATOM 9603 H2 WAT 4981 125.516 7.667 73.045 1.00 0.00 H TER 9605 WAT 4981 ATOM 9605 O WAT 4982 19.924 66.044 137.712 1.00 0.00 O ATOM 9606 H1 WAT 4982 20.059 65.105 137.589 1.00 0.00 H ATOM 9607 H2 WAT 4982 19.222 66.103 138.360 1.00 0.00 H TER 9609 WAT 4982 ATOM 9609 O WAT 4983 112.293 10.536 4.715 1.00 0.00 O ATOM 9610 H1 WAT 4983 113.143 10.801 4.364 1.00 0.00 H ATOM 9611 H2 WAT 4983 112.398 10.591 5.665 1.00 0.00 H TER 9613 WAT 4983 ATOM 9613 O WAT 4984 62.838 58.233 139.865 1.00 0.00 O ATOM 9614 H1 WAT 4984 62.180 58.863 139.571 1.00 0.00 H ATOM 9615 H2 WAT 4984 62.653 57.440 139.363 1.00 0.00 H TER 9617 WAT 4984 ATOM 9617 O WAT 4985 14.456 128.276 28.842 1.00 0.00 O ATOM 9618 H1 WAT 4985 14.156 129.184 28.886 1.00 0.00 H ATOM 9619 H2 WAT 4985 15.374 128.340 28.578 1.00 0.00 H TER 9621 WAT 4985 ATOM 9621 O WAT 4986 105.813 42.410 5.299 1.00 0.00 O ATOM 9622 H1 WAT 4986 106.509 42.989 4.989 1.00 0.00 H ATOM 9623 H2 WAT 4986 105.834 42.499 6.252 1.00 0.00 H TER 9625 WAT 4986 ATOM 9625 O WAT 4987 30.410 78.426 2.265 1.00 0.00 O ATOM 9626 H1 WAT 4987 29.549 78.728 2.553 1.00 0.00 H ATOM 9627 H2 WAT 4987 30.466 77.524 2.583 1.00 0.00 H TER 9629 WAT 4987 ATOM 9629 O WAT 4988 104.625 91.884 22.879 1.00 0.00 O ATOM 9630 H1 WAT 4988 104.358 92.632 23.413 1.00 0.00 H ATOM 9631 H2 WAT 4988 104.071 91.164 23.180 1.00 0.00 H TER 9633 WAT 4988 ATOM 9633 O WAT 4989 106.934 41.801 97.132 1.00 0.00 O ATOM 9634 H1 WAT 4989 107.345 41.769 96.268 1.00 0.00 H ATOM 9635 H2 WAT 4989 107.572 42.255 97.683 1.00 0.00 H TER 9637 WAT 4989 ATOM 9637 O WAT 4990 132.762 18.034 69.850 1.00 0.00 O ATOM 9638 H1 WAT 4990 133.148 18.874 69.602 1.00 0.00 H ATOM 9639 H2 WAT 4990 131.955 17.980 69.338 1.00 0.00 H TER 9641 WAT 4990 ATOM 9641 O WAT 4991 49.459 45.467 17.869 1.00 0.00 O ATOM 9642 H1 WAT 4991 50.171 46.087 18.026 1.00 0.00 H ATOM 9643 H2 WAT 4991 49.899 44.637 17.688 1.00 0.00 H TER 9645 WAT 4991 ATOM 9645 O WAT 4992 4.614 134.531 64.853 1.00 0.00 O ATOM 9646 H1 WAT 4992 3.823 134.249 64.394 1.00 0.00 H ATOM 9647 H2 WAT 4992 5.320 134.030 64.444 1.00 0.00 H TER 9649 WAT 4992 ATOM 9649 O WAT 4993 58.762 132.362 1.831 1.00 0.00 O ATOM 9650 H1 WAT 4993 59.412 131.780 1.438 1.00 0.00 H ATOM 9651 H2 WAT 4993 58.643 132.024 2.719 1.00 0.00 H TER 9653 WAT 4993 ATOM 9653 O WAT 4994 1.196 80.289 104.452 1.00 0.00 O ATOM 9654 H1 WAT 4994 1.271 79.897 103.582 1.00 0.00 H ATOM 9655 H2 WAT 4994 0.444 80.877 104.386 1.00 0.00 H TER 9657 WAT 4994 ATOM 9657 O WAT 4995 2.669 75.065 8.743 1.00 0.00 O ATOM 9658 H1 WAT 4995 2.517 74.230 9.187 1.00 0.00 H ATOM 9659 H2 WAT 4995 2.842 75.685 9.451 1.00 0.00 H TER 9661 WAT 4995 ATOM 9661 O WAT 4996 33.972 26.339 132.307 1.00 0.00 O ATOM 9662 H1 WAT 4996 34.033 26.212 131.360 1.00 0.00 H ATOM 9663 H2 WAT 4996 34.315 27.220 132.453 1.00 0.00 H TER 9665 WAT 4996 ATOM 9665 O WAT 4997 138.864 123.153 140.975 1.00 0.00 O ATOM 9666 H1 WAT 4997 138.589 123.606 141.772 1.00 0.00 H ATOM 9667 H2 WAT 4997 138.048 122.959 140.515 1.00 0.00 H TER 9669 WAT 4997 ATOM 9669 O WAT 4998 9.239 124.807 136.654 1.00 0.00 O ATOM 9670 H1 WAT 4998 10.178 124.713 136.813 1.00 0.00 H ATOM 9671 H2 WAT 4998 8.918 123.909 136.573 1.00 0.00 H TER 9673 WAT 4998 ATOM 9673 O WAT 4999 106.337 67.140 65.104 1.00 0.00 O ATOM 9674 H1 WAT 4999 105.775 67.034 64.337 1.00 0.00 H ATOM 9675 H2 WAT 4999 105.817 67.666 65.712 1.00 0.00 H TER 9677 WAT 4999 ATOM 9677 O WAT 5000 109.154 8.435 139.419 1.00 0.00 O ATOM 9678 H1 WAT 5000 108.899 7.516 139.494 1.00 0.00 H ATOM 9679 H2 WAT 5000 109.306 8.566 138.483 1.00 0.00 H TER 9681 WAT 5000 ATOM 9681 O WAT 5001 51.485 32.247 72.532 1.00 0.00 O ATOM 9682 H1 WAT 5001 50.642 32.584 72.226 1.00 0.00 H ATOM 9683 H2 WAT 5001 51.901 31.894 71.745 1.00 0.00 H TER 9685 WAT 5001 ATOM 9685 O WAT 5002 141.127 59.388 14.558 1.00 0.00 O ATOM 9686 H1 WAT 5002 140.955 58.478 14.802 1.00 0.00 H ATOM 9687 H2 WAT 5002 140.397 59.879 14.935 1.00 0.00 H TER 9689 WAT 5002 ATOM 9689 O WAT 5003 61.880 50.816 147.193 1.00 0.00 O ATOM 9690 H1 WAT 5003 61.214 50.138 147.083 1.00 0.00 H ATOM 9691 H2 WAT 5003 61.382 51.621 147.337 1.00 0.00 H TER 9693 WAT 5003 ATOM 9693 O WAT 5004 101.871 140.992 19.355 1.00 0.00 O ATOM 9694 H1 WAT 5004 101.988 141.850 19.763 1.00 0.00 H ATOM 9695 H2 WAT 5004 102.733 140.777 18.999 1.00 0.00 H TER 9697 WAT 5004 ATOM 9697 O WAT 5005 8.894 7.935 148.815 1.00 0.00 O ATOM 9698 H1 WAT 5005 8.863 7.051 149.183 1.00 0.00 H ATOM 9699 H2 WAT 5005 8.679 7.817 147.890 1.00 0.00 H TER 9701 WAT 5005 ATOM 9701 O WAT 5006 42.243 113.777 86.668 1.00 0.00 O ATOM 9702 H1 WAT 5006 41.767 114.174 85.939 1.00 0.00 H ATOM 9703 H2 WAT 5006 43.157 113.775 86.384 1.00 0.00 H TER 9705 WAT 5006 ATOM 9705 O WAT 5007 42.687 115.088 100.714 1.00 0.00 O ATOM 9706 H1 WAT 5007 42.480 114.906 99.797 1.00 0.00 H ATOM 9707 H2 WAT 5007 42.361 115.976 100.862 1.00 0.00 H TER 9709 WAT 5007 ATOM 9709 O WAT 5008 19.804 58.871 63.094 1.00 0.00 O ATOM 9710 H1 WAT 5008 19.465 58.142 62.574 1.00 0.00 H ATOM 9711 H2 WAT 5008 19.078 59.493 63.137 1.00 0.00 H TER 9713 WAT 5008 ATOM 9713 O WAT 5009 69.763 45.033 133.026 1.00 0.00 O ATOM 9714 H1 WAT 5009 70.168 44.543 133.742 1.00 0.00 H ATOM 9715 H2 WAT 5009 68.884 44.662 132.948 1.00 0.00 H TER 9717 WAT 5009 ATOM 9717 O WAT 5010 52.243 29.945 128.025 1.00 0.00 O ATOM 9718 H1 WAT 5010 52.111 29.988 128.973 1.00 0.00 H ATOM 9719 H2 WAT 5010 51.373 29.765 127.670 1.00 0.00 H TER 9721 WAT 5010 ATOM 9721 O WAT 5011 53.308 73.948 76.745 1.00 0.00 O ATOM 9722 H1 WAT 5011 53.416 73.871 75.797 1.00 0.00 H ATOM 9723 H2 WAT 5011 53.739 74.772 76.969 1.00 0.00 H TER 9725 WAT 5011 ATOM 9725 O WAT 5012 3.937 12.695 0.996 1.00 0.00 O ATOM 9726 H1 WAT 5012 3.861 13.626 0.787 1.00 0.00 H ATOM 9727 H2 WAT 5012 4.794 12.441 0.653 1.00 0.00 H TER 9729 WAT 5012 ATOM 9729 O WAT 5013 2.589 37.967 2.247 1.00 0.00 O ATOM 9730 H1 WAT 5013 2.247 37.073 2.228 1.00 0.00 H ATOM 9731 H2 WAT 5013 2.034 38.448 1.634 1.00 0.00 H TER 9733 WAT 5013 ATOM 9733 O WAT 5014 136.913 112.159 3.030 1.00 0.00 O ATOM 9734 H1 WAT 5014 137.768 111.813 3.285 1.00 0.00 H ATOM 9735 H2 WAT 5014 136.440 111.402 2.686 1.00 0.00 H TER 9737 WAT 5014 ATOM 9737 O WAT 5015 43.066 57.585 150.362 1.00 0.00 O ATOM 9738 H1 WAT 5015 43.883 57.810 149.917 1.00 0.00 H ATOM 9739 H2 WAT 5015 42.390 57.697 149.694 1.00 0.00 H TER 9741 WAT 5015 ATOM 9741 O WAT 5016 96.029 125.100 148.245 1.00 0.00 O ATOM 9742 H1 WAT 5016 95.240 125.641 148.235 1.00 0.00 H ATOM 9743 H2 WAT 5016 96.151 124.837 147.333 1.00 0.00 H TER 9745 WAT 5016 ATOM 9745 O WAT 5017 1.530 107.307 84.036 1.00 0.00 O ATOM 9746 H1 WAT 5017 0.737 107.833 83.936 1.00 0.00 H ATOM 9747 H2 WAT 5017 2.049 107.504 83.256 1.00 0.00 H TER 9749 WAT 5017 ATOM 9749 O WAT 5018 142.820 33.342 109.217 1.00 0.00 O ATOM 9750 H1 WAT 5018 143.662 33.338 108.762 1.00 0.00 H ATOM 9751 H2 WAT 5018 142.936 32.727 109.942 1.00 0.00 H TER 9753 WAT 5018 ATOM 9753 O WAT 5019 76.703 50.409 130.988 1.00 0.00 O ATOM 9754 H1 WAT 5019 76.402 50.264 130.090 1.00 0.00 H ATOM 9755 H2 WAT 5019 77.648 50.262 130.950 1.00 0.00 H TER 9757 WAT 5019 ATOM 9757 O WAT 5020 106.601 108.064 109.153 1.00 0.00 O ATOM 9758 H1 WAT 5020 106.135 107.815 108.354 1.00 0.00 H ATOM 9759 H2 WAT 5020 107.527 107.990 108.922 1.00 0.00 H TER 9761 WAT 5020 ATOM 9761 O WAT 5021 32.728 14.309 127.304 1.00 0.00 O ATOM 9762 H1 WAT 5021 33.419 13.849 126.828 1.00 0.00 H ATOM 9763 H2 WAT 5021 33.185 14.766 128.010 1.00 0.00 H TER 9765 WAT 5021 ATOM 9765 O WAT 5022 63.201 127.323 142.549 1.00 0.00 O ATOM 9766 H1 WAT 5022 62.947 127.153 141.642 1.00 0.00 H ATOM 9767 H2 WAT 5022 62.816 128.176 142.750 1.00 0.00 H TER 9769 WAT 5022 ATOM 9769 O WAT 5023 140.764 37.917 117.448 1.00 0.00 O ATOM 9770 H1 WAT 5023 141.478 38.406 117.038 1.00 0.00 H ATOM 9771 H2 WAT 5023 141.087 37.018 117.498 1.00 0.00 H TER 9773 WAT 5023 ATOM 9773 O WAT 5024 142.989 133.973 90.374 1.00 0.00 O ATOM 9774 H1 WAT 5024 143.446 134.764 90.087 1.00 0.00 H ATOM 9775 H2 WAT 5024 142.066 134.227 90.399 1.00 0.00 H TER 9777 WAT 5024 ATOM 9777 O WAT 5025 16.527 78.284 98.961 1.00 0.00 O ATOM 9778 H1 WAT 5025 17.054 78.700 99.644 1.00 0.00 H ATOM 9779 H2 WAT 5025 17.128 77.672 98.535 1.00 0.00 H TER 9781 WAT 5025 ATOM 9781 O WAT 5026 142.157 105.235 128.615 1.00 0.00 O ATOM 9782 H1 WAT 5026 141.217 105.360 128.747 1.00 0.00 H ATOM 9783 H2 WAT 5026 142.522 105.218 129.500 1.00 0.00 H TER 9785 WAT 5026 ATOM 9785 O WAT 5027 121.789 3.392 26.035 1.00 0.00 O ATOM 9786 H1 WAT 5027 121.749 3.424 26.991 1.00 0.00 H ATOM 9787 H2 WAT 5027 121.757 2.459 25.826 1.00 0.00 H TER 9789 WAT 5027 ATOM 9789 O WAT 5028 58.031 50.976 55.865 1.00 0.00 O ATOM 9790 H1 WAT 5028 57.876 50.233 55.282 1.00 0.00 H ATOM 9791 H2 WAT 5028 57.316 51.584 55.673 1.00 0.00 H TER 9793 WAT 5028 ATOM 9793 O WAT 5029 29.050 126.491 82.424 1.00 0.00 O ATOM 9794 H1 WAT 5029 29.546 126.342 83.229 1.00 0.00 H ATOM 9795 H2 WAT 5029 29.540 127.174 81.964 1.00 0.00 H TER 9797 WAT 5029 ATOM 9797 O WAT 5030 52.784 87.073 72.398 1.00 0.00 O ATOM 9798 H1 WAT 5030 52.267 86.455 71.882 1.00 0.00 H ATOM 9799 H2 WAT 5030 53.669 86.706 72.394 1.00 0.00 H TER 9801 WAT 5030 ATOM 9801 O WAT 5031 71.755 60.511 123.696 1.00 0.00 O ATOM 9802 H1 WAT 5031 71.151 61.248 123.787 1.00 0.00 H ATOM 9803 H2 WAT 5031 72.365 60.609 124.426 1.00 0.00 H TER 9805 WAT 5031 ATOM 9805 O WAT 5032 125.597 94.442 110.383 1.00 0.00 O ATOM 9806 H1 WAT 5032 125.265 94.417 109.485 1.00 0.00 H ATOM 9807 H2 WAT 5032 126.012 95.300 110.462 1.00 0.00 H TER 9809 WAT 5032 ATOM 9809 O WAT 5033 144.105 37.486 135.091 1.00 0.00 O ATOM 9810 H1 WAT 5033 143.490 36.952 134.588 1.00 0.00 H ATOM 9811 H2 WAT 5033 143.618 38.286 135.292 1.00 0.00 H TER 9813 WAT 5033 ATOM 9813 O WAT 5034 9.684 9.435 127.513 1.00 0.00 O ATOM 9814 H1 WAT 5034 8.804 9.700 127.783 1.00 0.00 H ATOM 9815 H2 WAT 5034 9.679 8.480 127.586 1.00 0.00 H TER 9817 WAT 5034 ATOM 9817 O WAT 5035 132.819 69.906 102.643 1.00 0.00 O ATOM 9818 H1 WAT 5035 132.072 70.260 102.161 1.00 0.00 H ATOM 9819 H2 WAT 5035 133.509 69.819 101.986 1.00 0.00 H TER 9821 WAT 5035 ATOM 9821 O WAT 5036 52.074 9.087 125.167 1.00 0.00 O ATOM 9822 H1 WAT 5036 52.298 9.200 124.243 1.00 0.00 H ATOM 9823 H2 WAT 5036 52.907 9.184 125.628 1.00 0.00 H TER 9825 WAT 5036 ATOM 9825 O WAT 5037 19.667 92.546 119.027 1.00 0.00 O ATOM 9826 H1 WAT 5037 20.204 92.018 119.618 1.00 0.00 H ATOM 9827 H2 WAT 5037 20.039 92.387 118.160 1.00 0.00 H TER 9829 WAT 5037 ATOM 9829 O WAT 5038 35.319 42.960 111.686 1.00 0.00 O ATOM 9830 H1 WAT 5038 35.422 43.207 112.604 1.00 0.00 H ATOM 9831 H2 WAT 5038 34.929 42.086 111.715 1.00 0.00 H TER 9833 WAT 5038 ATOM 9833 O WAT 5039 31.934 23.195 96.073 1.00 0.00 O ATOM 9834 H1 WAT 5039 32.553 22.466 96.103 1.00 0.00 H ATOM 9835 H2 WAT 5039 31.262 22.914 95.452 1.00 0.00 H TER 9837 WAT 5039 ATOM 9837 O WAT 5040 134.490 104.461 76.582 1.00 0.00 O ATOM 9838 H1 WAT 5040 134.449 103.671 77.120 1.00 0.00 H ATOM 9839 H2 WAT 5040 135.422 104.672 76.536 1.00 0.00 H TER 9841 WAT 5040 ATOM 9841 O WAT 5041 11.979 82.939 19.781 1.00 0.00 O ATOM 9842 H1 WAT 5041 11.734 83.141 20.684 1.00 0.00 H ATOM 9843 H2 WAT 5041 12.472 83.705 19.489 1.00 0.00 H TER 9845 WAT 5041 ATOM 9845 O WAT 5042 101.531 58.967 22.172 1.00 0.00 O ATOM 9846 H1 WAT 5042 102.369 58.663 22.521 1.00 0.00 H ATOM 9847 H2 WAT 5042 101.096 58.171 21.868 1.00 0.00 H TER 9849 WAT 5042 ATOM 9849 O WAT 5043 73.615 99.988 157.935 1.00 0.00 O ATOM 9850 H1 WAT 5043 73.688 99.207 158.484 1.00 0.00 H ATOM 9851 H2 WAT 5043 72.705 100.267 158.034 1.00 0.00 H TER 9853 WAT 5043 ATOM 9853 O WAT 5044 133.071 93.753 101.436 1.00 0.00 O ATOM 9854 H1 WAT 5044 133.845 93.647 100.884 1.00 0.00 H ATOM 9855 H2 WAT 5044 132.416 94.144 100.858 1.00 0.00 H TER 9857 WAT 5044 ATOM 9857 O WAT 5045 61.950 35.586 70.609 1.00 0.00 O ATOM 9858 H1 WAT 5045 61.104 35.764 71.019 1.00 0.00 H ATOM 9859 H2 WAT 5045 61.788 35.682 69.671 1.00 0.00 H TER 9861 WAT 5045 ATOM 9861 O WAT 5046 111.377 94.969 63.012 1.00 0.00 O ATOM 9862 H1 WAT 5046 110.612 95.098 63.573 1.00 0.00 H ATOM 9863 H2 WAT 5046 111.231 94.118 62.598 1.00 0.00 H TER 9865 WAT 5046 ATOM 9865 O WAT 5047 109.345 124.284 104.603 1.00 0.00 O ATOM 9866 H1 WAT 5047 110.185 123.865 104.787 1.00 0.00 H ATOM 9867 H2 WAT 5047 109.176 124.831 105.370 1.00 0.00 H TER 9869 WAT 5047 ATOM 9869 O WAT 5048 118.291 125.816 98.203 1.00 0.00 O ATOM 9870 H1 WAT 5048 117.841 126.032 97.386 1.00 0.00 H ATOM 9871 H2 WAT 5048 117.986 124.934 98.418 1.00 0.00 H TER 9873 WAT 5048 ATOM 9873 O WAT 5049 67.083 34.351 88.531 1.00 0.00 O ATOM 9874 H1 WAT 5049 66.655 34.359 89.387 1.00 0.00 H ATOM 9875 H2 WAT 5049 66.362 34.336 87.902 1.00 0.00 H TER 9877 WAT 5049 ATOM 9877 O WAT 5050 55.798 35.242 3.241 1.00 0.00 O ATOM 9878 H1 WAT 5050 56.538 34.650 3.375 1.00 0.00 H ATOM 9879 H2 WAT 5050 55.176 34.735 2.720 1.00 0.00 H TER 9881 WAT 5050 ATOM 9881 O WAT 5051 89.236 15.990 101.144 1.00 0.00 O ATOM 9882 H1 WAT 5051 88.917 15.220 101.615 1.00 0.00 H ATOM 9883 H2 WAT 5051 89.765 15.632 100.431 1.00 0.00 H TER 9885 WAT 5051 ATOM 9885 O WAT 5052 68.242 64.944 104.709 1.00 0.00 O ATOM 9886 H1 WAT 5052 68.491 64.341 105.409 1.00 0.00 H ATOM 9887 H2 WAT 5052 67.730 64.408 104.103 1.00 0.00 H TER 9889 WAT 5052 ATOM 9889 O WAT 5053 108.821 133.480 102.037 1.00 0.00 O ATOM 9890 H1 WAT 5053 109.767 133.579 102.142 1.00 0.00 H ATOM 9891 H2 WAT 5053 108.457 134.308 102.351 1.00 0.00 H TER 9893 WAT 5053 ATOM 9893 O WAT 5054 124.965 120.468 18.162 1.00 0.00 O ATOM 9894 H1 WAT 5054 125.227 119.728 18.709 1.00 0.00 H ATOM 9895 H2 WAT 5054 124.087 120.240 17.855 1.00 0.00 H TER 9897 WAT 5054 ATOM 9897 O WAT 5055 45.978 41.189 74.157 1.00 0.00 O ATOM 9898 H1 WAT 5055 45.360 40.526 73.847 1.00 0.00 H ATOM 9899 H2 WAT 5055 46.130 40.964 75.075 1.00 0.00 H TER 9901 WAT 5055 ATOM 9901 O WAT 5056 29.380 134.874 93.787 1.00 0.00 O ATOM 9902 H1 WAT 5056 29.745 134.655 92.929 1.00 0.00 H ATOM 9903 H2 WAT 5056 28.555 134.391 93.826 1.00 0.00 H TER 9905 WAT 5056 ATOM 9905 O WAT 5057 19.998 60.095 122.213 1.00 0.00 O ATOM 9906 H1 WAT 5057 19.680 59.755 121.377 1.00 0.00 H ATOM 9907 H2 WAT 5057 20.805 60.560 121.991 1.00 0.00 H TER 9909 WAT 5057 ATOM 9909 O WAT 5058 11.210 125.823 143.497 1.00 0.00 O ATOM 9910 H1 WAT 5058 11.818 125.543 144.181 1.00 0.00 H ATOM 9911 H2 WAT 5058 10.775 126.593 143.863 1.00 0.00 H TER 9913 WAT 5058 ATOM 9913 O WAT 5059 96.788 140.359 141.612 1.00 0.00 O ATOM 9914 H1 WAT 5059 97.349 141.103 141.831 1.00 0.00 H ATOM 9915 H2 WAT 5059 96.675 140.415 140.663 1.00 0.00 H TER 9917 WAT 5059 ATOM 9917 O WAT 5060 145.471 55.122 87.212 1.00 0.00 O ATOM 9918 H1 WAT 5060 144.729 54.927 86.640 1.00 0.00 H ATOM 9919 H2 WAT 5060 146.104 55.560 86.642 1.00 0.00 H TER 9921 WAT 5060 ATOM 9921 O WAT 5061 86.059 67.940 122.744 1.00 0.00 O ATOM 9922 H1 WAT 5061 86.004 67.027 122.461 1.00 0.00 H ATOM 9923 H2 WAT 5061 86.560 67.909 123.558 1.00 0.00 H TER 9925 WAT 5061 ATOM 9925 O WAT 5062 100.484 122.639 2.675 1.00 0.00 O ATOM 9926 H1 WAT 5062 100.303 121.893 2.103 1.00 0.00 H ATOM 9927 H2 WAT 5062 101.327 122.975 2.372 1.00 0.00 H TER 9929 WAT 5062 ATOM 9929 O WAT 5063 123.235 18.270 6.881 1.00 0.00 O ATOM 9930 H1 WAT 5063 122.794 18.307 6.033 1.00 0.00 H ATOM 9931 H2 WAT 5063 124.152 18.458 6.683 1.00 0.00 H TER 9933 WAT 5063 ATOM 9933 O WAT 5064 11.518 59.291 132.516 1.00 0.00 O ATOM 9934 H1 WAT 5064 11.713 58.381 132.293 1.00 0.00 H ATOM 9935 H2 WAT 5064 10.563 59.344 132.492 1.00 0.00 H TER 9937 WAT 5064 ATOM 9937 O WAT 5065 78.031 54.573 71.804 1.00 0.00 O ATOM 9938 H1 WAT 5065 77.142 54.330 71.547 1.00 0.00 H ATOM 9939 H2 WAT 5065 78.587 54.210 71.115 1.00 0.00 H TER 9941 WAT 5065 ATOM 9941 O WAT 5066 122.359 17.775 91.971 1.00 0.00 O ATOM 9942 H1 WAT 5066 122.283 18.320 92.755 1.00 0.00 H ATOM 9943 H2 WAT 5066 123.187 18.043 91.573 1.00 0.00 H TER 9945 WAT 5066 ATOM 9945 O WAT 5067 74.541 105.147 135.408 1.00 0.00 O ATOM 9946 H1 WAT 5067 74.286 106.052 135.586 1.00 0.00 H ATOM 9947 H2 WAT 5067 75.146 105.209 134.669 1.00 0.00 H TER 9949 WAT 5067 ATOM 9949 O WAT 5068 0.881 86.058 154.785 1.00 0.00 O ATOM 9950 H1 WAT 5068 0.839 85.106 154.868 1.00 0.00 H ATOM 9951 H2 WAT 5068 0.007 86.312 154.489 1.00 0.00 H TER 9953 WAT 5068 ATOM 9953 O WAT 5069 90.670 56.811 129.062 1.00 0.00 O ATOM 9954 H1 WAT 5069 90.631 57.735 128.815 1.00 0.00 H ATOM 9955 H2 WAT 5069 90.179 56.760 129.882 1.00 0.00 H TER 9957 WAT 5069 ATOM 9957 O WAT 5070 118.694 124.395 109.738 1.00 0.00 O ATOM 9958 H1 WAT 5070 119.035 125.212 109.375 1.00 0.00 H ATOM 9959 H2 WAT 5070 117.743 124.485 109.678 1.00 0.00 H TER 9961 WAT 5070 ATOM 9961 O WAT 5071 118.818 121.414 140.594 1.00 0.00 O ATOM 9962 H1 WAT 5071 118.459 121.056 139.782 1.00 0.00 H ATOM 9963 H2 WAT 5071 118.571 120.779 141.266 1.00 0.00 H TER 9965 WAT 5071 ATOM 9965 O WAT 5072 17.602 110.885 71.535 1.00 0.00 O ATOM 9966 H1 WAT 5072 18.030 111.286 72.292 1.00 0.00 H ATOM 9967 H2 WAT 5072 18.299 110.395 71.098 1.00 0.00 H TER 9969 WAT 5072 ATOM 9969 O WAT 5073 131.622 129.567 113.021 1.00 0.00 O ATOM 9970 H1 WAT 5073 130.888 129.266 113.556 1.00 0.00 H ATOM 9971 H2 WAT 5073 131.862 130.414 113.397 1.00 0.00 H TER 9973 WAT 5073 ATOM 9973 O WAT 5074 78.155 1.942 71.925 1.00 0.00 O ATOM 9974 H1 WAT 5074 77.617 1.222 71.595 1.00 0.00 H ATOM 9975 H2 WAT 5074 78.389 2.444 71.145 1.00 0.00 H TER 9977 WAT 5074 ATOM 9977 O WAT 5075 14.452 23.088 156.858 1.00 0.00 O ATOM 9978 H1 WAT 5075 15.054 23.832 156.902 1.00 0.00 H ATOM 9979 H2 WAT 5075 14.920 22.376 157.294 1.00 0.00 H TER 9981 WAT 5075 ATOM 9981 O WAT 5076 11.195 91.056 97.988 1.00 0.00 O ATOM 9982 H1 WAT 5076 11.273 90.108 98.100 1.00 0.00 H ATOM 9983 H2 WAT 5076 11.324 91.412 98.866 1.00 0.00 H TER 9985 WAT 5076 ATOM 9985 O WAT 5077 81.320 93.976 144.671 1.00 0.00 O ATOM 9986 H1 WAT 5077 82.109 93.451 144.536 1.00 0.00 H ATOM 9987 H2 WAT 5077 80.779 93.448 145.259 1.00 0.00 H TER 9989 WAT 5077 ATOM 9989 O WAT 5078 124.087 113.667 129.507 1.00 0.00 O ATOM 9990 H1 WAT 5078 123.441 113.859 128.826 1.00 0.00 H ATOM 9991 H2 WAT 5078 124.829 114.236 129.300 1.00 0.00 H TER 9993 WAT 5078 ATOM 9993 O WAT 5079 67.009 41.872 10.038 1.00 0.00 O ATOM 9994 H1 WAT 5079 67.636 42.413 9.559 1.00 0.00 H ATOM 9995 H2 WAT 5079 66.157 42.264 9.845 1.00 0.00 H TER 9997 WAT 5079 ATOM 9997 O WAT 5080 110.268 12.574 135.256 1.00 0.00 O ATOM 9998 H1 WAT 5080 110.938 11.899 135.362 1.00 0.00 H ATOM 9999 H2 WAT 5080 109.920 12.708 136.138 1.00 0.00 H TER 10001 WAT 5080 ATOM 10001 O WAT 5081 133.345 75.150 116.170 1.00 0.00 O ATOM 10002 H1 WAT 5081 133.545 74.238 116.385 1.00 0.00 H ATOM 10003 H2 WAT 5081 133.291 75.165 115.215 1.00 0.00 H TER 10005 WAT 5081 ATOM 10005 O WAT 5082 127.511 68.067 54.876 1.00 0.00 O ATOM 10006 H1 WAT 5082 128.354 68.349 54.522 1.00 0.00 H ATOM 10007 H2 WAT 5082 127.270 68.755 55.497 1.00 0.00 H TER 10009 WAT 5082 ATOM 10009 O WAT 5083 10.088 57.962 153.353 1.00 0.00 O ATOM 10010 H1 WAT 5083 9.260 57.484 153.402 1.00 0.00 H ATOM 10011 H2 WAT 5083 10.538 57.585 152.597 1.00 0.00 H TER 10013 WAT 5083 ATOM 10013 O WAT 5084 30.521 36.898 144.739 1.00 0.00 O ATOM 10014 H1 WAT 5084 29.599 36.642 144.721 1.00 0.00 H ATOM 10015 H2 WAT 5084 30.815 36.669 145.620 1.00 0.00 H TER 10017 WAT 5084 ATOM 10017 O WAT 5085 13.170 132.348 25.304 1.00 0.00 O ATOM 10018 H1 WAT 5085 12.243 132.395 25.069 1.00 0.00 H ATOM 10019 H2 WAT 5085 13.589 133.013 24.758 1.00 0.00 H TER 10021 WAT 5085 ATOM 10021 O WAT 5086 99.453 2.473 73.675 1.00 0.00 O ATOM 10022 H1 WAT 5086 100.020 3.164 73.333 1.00 0.00 H ATOM 10023 H2 WAT 5086 99.009 2.123 72.903 1.00 0.00 H TER 10025 WAT 5086 ATOM 10025 O WAT 5087 87.673 13.340 109.399 1.00 0.00 O ATOM 10026 H1 WAT 5087 88.489 13.223 109.886 1.00 0.00 H ATOM 10027 H2 WAT 5087 87.270 12.472 109.394 1.00 0.00 H TER 10029 WAT 5087 ATOM 10029 O WAT 5088 124.185 80.662 28.094 1.00 0.00 O ATOM 10030 H1 WAT 5088 123.275 80.377 28.007 1.00 0.00 H ATOM 10031 H2 WAT 5088 124.681 79.850 28.199 1.00 0.00 H TER 10033 WAT 5088 ATOM 10033 O WAT 5089 98.224 114.170 10.944 1.00 0.00 O ATOM 10034 H1 WAT 5089 98.176 113.247 11.192 1.00 0.00 H ATOM 10035 H2 WAT 5089 98.433 114.157 10.010 1.00 0.00 H TER 10037 WAT 5089 ATOM 10037 O WAT 5090 25.846 17.141 91.443 1.00 0.00 O ATOM 10038 H1 WAT 5090 25.597 17.789 92.102 1.00 0.00 H ATOM 10039 H2 WAT 5090 26.689 17.448 91.111 1.00 0.00 H TER 10041 WAT 5090 ATOM 10041 O WAT 5091 144.570 101.495 85.852 1.00 0.00 O ATOM 10042 H1 WAT 5091 144.560 102.450 85.794 1.00 0.00 H ATOM 10043 H2 WAT 5091 145.460 101.249 85.599 1.00 0.00 H TER 10045 WAT 5091 ATOM 10045 O WAT 5092 79.766 79.573 158.161 1.00 0.00 O ATOM 10046 H1 WAT 5092 80.705 79.422 158.265 1.00 0.00 H ATOM 10047 H2 WAT 5092 79.535 80.152 158.887 1.00 0.00 H TER 10049 WAT 5092 ATOM 10049 O WAT 5093 28.920 140.434 24.578 1.00 0.00 O ATOM 10050 H1 WAT 5093 29.712 140.798 24.183 1.00 0.00 H ATOM 10051 H2 WAT 5093 28.325 140.299 23.840 1.00 0.00 H TER 10053 WAT 5093 ATOM 10053 O WAT 5094 13.324 45.990 69.617 1.00 0.00 O ATOM 10054 H1 WAT 5094 13.883 45.574 68.961 1.00 0.00 H ATOM 10055 H2 WAT 5094 13.932 46.304 70.286 1.00 0.00 H TER 10057 WAT 5094 ATOM 10057 O WAT 5095 36.285 84.123 146.680 1.00 0.00 O ATOM 10058 H1 WAT 5095 35.342 84.118 146.842 1.00 0.00 H ATOM 10059 H2 WAT 5095 36.390 84.653 145.890 1.00 0.00 H TER 10061 WAT 5095 ATOM 10061 O WAT 5096 38.082 116.555 67.157 1.00 0.00 O ATOM 10062 H1 WAT 5096 38.234 116.086 66.337 1.00 0.00 H ATOM 10063 H2 WAT 5096 37.949 117.465 66.892 1.00 0.00 H TER 10065 WAT 5096 ATOM 10065 O WAT 5097 9.159 15.034 143.575 1.00 0.00 O ATOM 10066 H1 WAT 5097 8.459 14.400 143.423 1.00 0.00 H ATOM 10067 H2 WAT 5097 9.352 14.958 144.510 1.00 0.00 H TER 10069 WAT 5097 ATOM 10069 O WAT 5098 123.519 63.247 81.350 1.00 0.00 O ATOM 10070 H1 WAT 5098 123.280 62.545 81.955 1.00 0.00 H ATOM 10071 H2 WAT 5098 124.388 63.527 81.639 1.00 0.00 H TER 10073 WAT 5098 ATOM 10073 O WAT 5099 32.012 103.004 135.158 1.00 0.00 O ATOM 10074 H1 WAT 5099 32.700 103.421 134.639 1.00 0.00 H ATOM 10075 H2 WAT 5099 32.166 103.312 136.052 1.00 0.00 H TER 10077 WAT 5099 ATOM 10077 O WAT 5100 43.392 89.973 122.813 1.00 0.00 O ATOM 10078 H1 WAT 5100 42.521 89.586 122.902 1.00 0.00 H ATOM 10079 H2 WAT 5100 43.869 89.364 122.250 1.00 0.00 H TER 10081 WAT 5100 ATOM 10081 O WAT 5101 75.199 106.721 127.882 1.00 0.00 O ATOM 10082 H1 WAT 5101 75.818 107.076 128.520 1.00 0.00 H ATOM 10083 H2 WAT 5101 74.861 107.490 127.423 1.00 0.00 H TER 10085 WAT 5101 ATOM 10085 O WAT 5102 112.476 88.755 125.556 1.00 0.00 O ATOM 10086 H1 WAT 5102 111.860 88.723 126.288 1.00 0.00 H ATOM 10087 H2 WAT 5102 112.422 89.656 125.238 1.00 0.00 H TER 10089 WAT 5102 ATOM 10089 O WAT 5103 109.654 25.321 113.993 1.00 0.00 O ATOM 10090 H1 WAT 5103 108.832 25.664 114.342 1.00 0.00 H ATOM 10091 H2 WAT 5103 109.954 24.699 114.655 1.00 0.00 H TER 10093 WAT 5103 ATOM 10093 O WAT 5104 16.720 97.126 85.475 1.00 0.00 O ATOM 10094 H1 WAT 5104 16.068 97.511 84.889 1.00 0.00 H ATOM 10095 H2 WAT 5104 16.659 96.184 85.316 1.00 0.00 H TER 10097 WAT 5104 ATOM 10097 O WAT 5105 43.392 71.029 9.018 1.00 0.00 O ATOM 10098 H1 WAT 5105 42.439 71.119 9.026 1.00 0.00 H ATOM 10099 H2 WAT 5105 43.578 70.522 8.228 1.00 0.00 H TER 10101 WAT 5105 ATOM 10101 O WAT 5106 110.362 9.169 2.992 1.00 0.00 O ATOM 10102 H1 WAT 5106 109.730 9.112 3.708 1.00 0.00 H ATOM 10103 H2 WAT 5106 111.052 9.742 3.326 1.00 0.00 H TER 10105 WAT 5106 ATOM 10105 O WAT 5107 98.821 142.036 118.543 1.00 0.00 O ATOM 10106 H1 WAT 5107 99.154 142.477 117.762 1.00 0.00 H ATOM 10107 H2 WAT 5107 98.091 141.504 118.224 1.00 0.00 H TER 10109 WAT 5107 ATOM 10109 O WAT 5108 116.804 136.225 136.061 1.00 0.00 O ATOM 10110 H1 WAT 5108 116.960 137.169 136.041 1.00 0.00 H ATOM 10111 H2 WAT 5108 116.885 135.950 135.148 1.00 0.00 H TER 10113 WAT 5108 ATOM 10113 O WAT 5109 97.843 65.895 155.228 1.00 0.00 O ATOM 10114 H1 WAT 5109 98.646 65.653 154.767 1.00 0.00 H ATOM 10115 H2 WAT 5109 97.717 65.198 155.872 1.00 0.00 H TER 10117 WAT 5109 ATOM 10117 O WAT 5110 71.940 10.591 79.412 1.00 0.00 O ATOM 10118 H1 WAT 5110 71.052 10.511 79.061 1.00 0.00 H ATOM 10119 H2 WAT 5110 72.505 10.562 78.640 1.00 0.00 H TER 10121 WAT 5110 ATOM 10121 O WAT 5111 96.231 121.022 128.903 1.00 0.00 O ATOM 10122 H1 WAT 5111 97.100 120.984 128.505 1.00 0.00 H ATOM 10123 H2 WAT 5111 96.262 120.375 129.609 1.00 0.00 H TER 10125 WAT 5111 ATOM 10125 O WAT 5112 21.233 84.283 134.871 1.00 0.00 O ATOM 10126 H1 WAT 5112 21.688 83.700 135.479 1.00 0.00 H ATOM 10127 H2 WAT 5112 21.934 84.761 134.428 1.00 0.00 H TER 10129 WAT 5112 ATOM 10129 O WAT 5113 136.861 43.421 125.071 1.00 0.00 O ATOM 10130 H1 WAT 5113 137.175 42.715 124.505 1.00 0.00 H ATOM 10131 H2 WAT 5113 135.973 43.158 125.312 1.00 0.00 H TER 10133 WAT 5113 ATOM 10133 O WAT 5114 122.458 8.475 54.678 1.00 0.00 O ATOM 10134 H1 WAT 5114 123.104 8.758 55.325 1.00 0.00 H ATOM 10135 H2 WAT 5114 121.616 8.570 55.123 1.00 0.00 H TER 10137 WAT 5114 ATOM 10137 O WAT 5115 110.298 73.071 136.775 1.00 0.00 O ATOM 10138 H1 WAT 5115 110.463 73.934 136.394 1.00 0.00 H ATOM 10139 H2 WAT 5115 111.092 72.872 137.270 1.00 0.00 H TER 10141 WAT 5115 ATOM 10141 O WAT 5116 138.347 121.245 136.624 1.00 0.00 O ATOM 10142 H1 WAT 5116 138.942 121.052 137.349 1.00 0.00 H ATOM 10143 H2 WAT 5116 138.157 120.392 136.236 1.00 0.00 H TER 10145 WAT 5116 ATOM 10145 O WAT 5117 127.981 80.004 129.946 1.00 0.00 O ATOM 10146 H1 WAT 5117 128.671 79.763 129.328 1.00 0.00 H ATOM 10147 H2 WAT 5117 128.356 80.722 130.456 1.00 0.00 H TER 10149 WAT 5117 ATOM 10149 O WAT 5118 57.841 84.885 146.095 1.00 0.00 O ATOM 10150 H1 WAT 5118 57.395 85.198 146.882 1.00 0.00 H ATOM 10151 H2 WAT 5118 57.374 84.084 145.858 1.00 0.00 H TER 10153 WAT 5118 ATOM 10153 O WAT 5119 140.522 130.398 140.048 1.00 0.00 O ATOM 10154 H1 WAT 5119 139.837 130.068 139.466 1.00 0.00 H ATOM 10155 H2 WAT 5119 140.104 131.112 140.529 1.00 0.00 H TER 10157 WAT 5119 ATOM 10157 O WAT 5120 19.642 123.529 64.165 1.00 0.00 O ATOM 10158 H1 WAT 5120 18.843 123.961 64.467 1.00 0.00 H ATOM 10159 H2 WAT 5120 19.695 122.730 64.689 1.00 0.00 H TER 10161 WAT 5120 ATOM 10161 O WAT 5121 61.949 113.293 85.167 1.00 0.00 O ATOM 10162 H1 WAT 5121 62.207 112.448 85.536 1.00 0.00 H ATOM 10163 H2 WAT 5121 62.441 113.356 84.348 1.00 0.00 H TER 10165 WAT 5121 ATOM 10165 O WAT 5122 120.445 56.260 142.232 1.00 0.00 O ATOM 10166 H1 WAT 5122 119.665 56.723 141.926 1.00 0.00 H ATOM 10167 H2 WAT 5122 120.409 56.334 143.185 1.00 0.00 H TER 10169 WAT 5122 ATOM 10169 O WAT 5123 97.989 105.227 83.289 1.00 0.00 O ATOM 10170 H1 WAT 5123 98.604 104.509 83.139 1.00 0.00 H ATOM 10171 H2 WAT 5123 98.489 105.870 83.792 1.00 0.00 H TER 10173 WAT 5123 ATOM 10173 O WAT 5124 108.406 3.621 58.718 1.00 0.00 O ATOM 10174 H1 WAT 5124 108.273 4.376 58.145 1.00 0.00 H ATOM 10175 H2 WAT 5124 109.245 3.253 58.440 1.00 0.00 H TER 10177 WAT 5124 ATOM 10177 O WAT 5125 47.757 141.099 0.375 1.00 0.00 O ATOM 10178 H1 WAT 5125 48.155 140.331 -0.035 1.00 0.00 H ATOM 10179 H2 WAT 5125 47.108 140.739 0.979 1.00 0.00 H TER 10181 WAT 5125 ATOM 10181 O WAT 5126 83.057 62.261 136.856 1.00 0.00 O ATOM 10182 H1 WAT 5126 82.299 62.796 137.088 1.00 0.00 H ATOM 10183 H2 WAT 5126 82.791 61.801 136.060 1.00 0.00 H TER 10185 WAT 5126 ATOM 10185 O WAT 5127 106.599 67.341 132.286 1.00 0.00 O ATOM 10186 H1 WAT 5127 107.294 67.745 132.806 1.00 0.00 H ATOM 10187 H2 WAT 5127 106.247 66.653 132.852 1.00 0.00 H TER 10189 WAT 5127 ATOM 10189 O WAT 5128 81.395 123.369 151.575 1.00 0.00 O ATOM 10190 H1 WAT 5128 80.824 123.088 152.290 1.00 0.00 H ATOM 10191 H2 WAT 5128 82.238 122.957 151.766 1.00 0.00 H TER 10193 WAT 5128 ATOM 10193 O WAT 5129 128.886 140.235 84.520 1.00 0.00 O ATOM 10194 H1 WAT 5129 128.276 140.972 84.546 1.00 0.00 H ATOM 10195 H2 WAT 5129 128.889 139.895 85.415 1.00 0.00 H TER 10197 WAT 5129 ATOM 10197 O WAT 5130 58.100 34.947 144.695 1.00 0.00 O ATOM 10198 H1 WAT 5130 58.095 35.651 145.344 1.00 0.00 H ATOM 10199 H2 WAT 5130 58.808 34.368 144.976 1.00 0.00 H TER 10201 WAT 5130 ATOM 10201 O WAT 5131 130.686 56.310 55.621 1.00 0.00 O ATOM 10202 H1 WAT 5131 130.164 57.080 55.846 1.00 0.00 H ATOM 10203 H2 WAT 5131 130.942 55.939 56.465 1.00 0.00 H TER 10205 WAT 5131 ATOM 10205 O WAT 5132 79.737 96.156 96.151 1.00 0.00 O ATOM 10206 H1 WAT 5132 80.473 96.391 95.586 1.00 0.00 H ATOM 10207 H2 WAT 5132 79.199 95.574 95.614 1.00 0.00 H TER 10209 WAT 5132 ATOM 10209 O WAT 5133 2.940 16.500 92.556 1.00 0.00 O ATOM 10210 H1 WAT 5133 2.586 17.375 92.714 1.00 0.00 H ATOM 10211 H2 WAT 5133 2.553 15.958 93.243 1.00 0.00 H TER 10213 WAT 5133 ATOM 10213 O WAT 5134 61.952 139.001 95.133 1.00 0.00 O ATOM 10214 H1 WAT 5134 61.078 138.612 95.162 1.00 0.00 H ATOM 10215 H2 WAT 5134 61.895 139.763 95.710 1.00 0.00 H TER 10217 WAT 5134 ATOM 10217 O WAT 5135 25.422 145.574 136.513 1.00 0.00 O ATOM 10218 H1 WAT 5135 25.351 146.411 136.053 1.00 0.00 H ATOM 10219 H2 WAT 5135 26.203 145.668 137.060 1.00 0.00 H TER 10221 WAT 5135 ATOM 10221 O WAT 5136 23.232 112.673 96.520 1.00 0.00 O ATOM 10222 H1 WAT 5136 24.166 112.681 96.729 1.00 0.00 H ATOM 10223 H2 WAT 5136 22.906 113.511 96.848 1.00 0.00 H TER 10225 WAT 5136 ATOM 10225 O WAT 5137 29.618 110.844 127.675 1.00 0.00 O ATOM 10226 H1 WAT 5137 28.819 111.367 127.743 1.00 0.00 H ATOM 10227 H2 WAT 5137 29.516 110.164 128.340 1.00 0.00 H TER 10229 WAT 5137 ATOM 10229 O WAT 5138 9.037 18.154 140.847 1.00 0.00 O ATOM 10230 H1 WAT 5138 8.450 18.378 141.571 1.00 0.00 H ATOM 10231 H2 WAT 5138 8.534 18.362 140.059 1.00 0.00 H TER 10233 WAT 5138 ATOM 10233 O WAT 5139 118.633 121.849 128.273 1.00 0.00 O ATOM 10234 H1 WAT 5139 119.490 121.447 128.418 1.00 0.00 H ATOM 10235 H2 WAT 5139 118.229 121.312 127.591 1.00 0.00 H TER 10237 WAT 5139 ATOM 10237 O WAT 5140 116.062 2.432 16.908 1.00 0.00 O ATOM 10238 H1 WAT 5140 116.949 2.102 16.765 1.00 0.00 H ATOM 10239 H2 WAT 5140 116.072 2.764 17.805 1.00 0.00 H TER 10241 WAT 5140 ATOM 10241 O WAT 5141 125.620 127.228 10.296 1.00 0.00 O ATOM 10242 H1 WAT 5141 125.052 126.701 9.734 1.00 0.00 H ATOM 10243 H2 WAT 5141 126.248 126.602 10.657 1.00 0.00 H TER 10245 WAT 5141 ATOM 10245 O WAT 5142 122.442 26.753 134.242 1.00 0.00 O ATOM 10246 H1 WAT 5142 122.906 26.092 134.757 1.00 0.00 H ATOM 10247 H2 WAT 5142 121.988 27.288 134.893 1.00 0.00 H TER 10249 WAT 5142 ATOM 10249 O WAT 5143 5.428 57.291 124.869 1.00 0.00 O ATOM 10250 H1 WAT 5143 5.121 57.285 123.962 1.00 0.00 H ATOM 10251 H2 WAT 5143 6.048 58.020 124.907 1.00 0.00 H TER 10253 WAT 5143 ATOM 10253 O WAT 5144 24.866 86.326 146.051 1.00 0.00 O ATOM 10254 H1 WAT 5144 25.175 86.656 145.207 1.00 0.00 H ATOM 10255 H2 WAT 5144 24.880 85.374 145.956 1.00 0.00 H TER 10257 WAT 5144 ATOM 10257 O WAT 5145 65.769 75.855 105.154 1.00 0.00 O ATOM 10258 H1 WAT 5145 65.842 76.149 104.246 1.00 0.00 H ATOM 10259 H2 WAT 5145 65.957 74.917 105.118 1.00 0.00 H TER 10261 WAT 5145 ATOM 10261 O WAT 5146 19.957 24.161 101.273 1.00 0.00 O ATOM 10262 H1 WAT 5146 19.113 23.785 101.025 1.00 0.00 H ATOM 10263 H2 WAT 5146 20.563 23.420 101.260 1.00 0.00 H TER 10265 WAT 5146 ATOM 10265 O WAT 5147 129.890 88.142 107.016 1.00 0.00 O ATOM 10266 H1 WAT 5147 130.004 87.463 106.351 1.00 0.00 H ATOM 10267 H2 WAT 5147 129.053 87.933 107.430 1.00 0.00 H TER 10269 WAT 5147 ATOM 10269 O WAT 5148 71.754 122.405 99.895 1.00 0.00 O ATOM 10270 H1 WAT 5148 71.567 122.949 100.660 1.00 0.00 H ATOM 10271 H2 WAT 5148 71.007 122.543 99.314 1.00 0.00 H TER 10273 WAT 5148 ATOM 10273 O WAT 5149 45.229 75.536 12.236 1.00 0.00 O ATOM 10274 H1 WAT 5149 45.859 75.352 12.933 1.00 0.00 H ATOM 10275 H2 WAT 5149 45.579 76.311 11.796 1.00 0.00 H TER 10277 WAT 5149 ATOM 10277 O WAT 5150 69.941 62.322 130.099 1.00 0.00 O ATOM 10278 H1 WAT 5150 70.857 62.312 130.377 1.00 0.00 H ATOM 10279 H2 WAT 5150 69.445 62.182 130.905 1.00 0.00 H TER 10281 WAT 5150 ATOM 10281 O WAT 5151 75.687 128.430 71.631 1.00 0.00 O ATOM 10282 H1 WAT 5151 76.145 127.721 72.083 1.00 0.00 H ATOM 10283 H2 WAT 5151 75.608 128.126 70.727 1.00 0.00 H TER 10285 WAT 5151 ATOM 10285 O WAT 5152 57.759 6.160 151.485 1.00 0.00 O ATOM 10286 H1 WAT 5152 58.166 6.359 152.328 1.00 0.00 H ATOM 10287 H2 WAT 5152 56.826 6.077 151.684 1.00 0.00 H TER 10289 WAT 5152 ATOM 10289 O WAT 5153 23.156 101.018 87.225 1.00 0.00 O ATOM 10290 H1 WAT 5153 22.911 100.445 86.499 1.00 0.00 H ATOM 10291 H2 WAT 5153 23.825 101.596 86.859 1.00 0.00 H TER 10293 WAT 5153 ATOM 10293 O WAT 5154 14.403 118.546 98.139 1.00 0.00 O ATOM 10294 H1 WAT 5154 14.575 118.096 98.967 1.00 0.00 H ATOM 10295 H2 WAT 5154 15.238 118.956 97.912 1.00 0.00 H TER 10297 WAT 5154 ATOM 10297 O WAT 5155 127.375 18.980 119.458 1.00 0.00 O ATOM 10298 H1 WAT 5155 126.982 19.811 119.725 1.00 0.00 H ATOM 10299 H2 WAT 5155 127.430 18.470 120.266 1.00 0.00 H TER 10301 WAT 5155 ATOM 10301 O WAT 5156 94.537 58.747 109.836 1.00 0.00 O ATOM 10302 H1 WAT 5156 95.135 58.629 110.574 1.00 0.00 H ATOM 10303 H2 WAT 5156 94.365 57.858 109.523 1.00 0.00 H TER 10305 WAT 5156 ATOM 10305 O WAT 5157 139.529 63.435 73.741 1.00 0.00 O ATOM 10306 H1 WAT 5157 139.030 64.226 73.947 1.00 0.00 H ATOM 10307 H2 WAT 5157 140.443 63.690 73.861 1.00 0.00 H TER 10309 WAT 5157 ATOM 10309 O WAT 5158 120.753 136.451 135.346 1.00 0.00 O ATOM 10310 H1 WAT 5158 121.054 135.692 134.848 1.00 0.00 H ATOM 10311 H2 WAT 5158 119.979 136.757 134.873 1.00 0.00 H TER 10313 WAT 5158 ATOM 10313 O WAT 5159 14.593 112.842 144.668 1.00 0.00 O ATOM 10314 H1 WAT 5159 14.608 111.888 144.751 1.00 0.00 H ATOM 10315 H2 WAT 5159 15.500 113.081 144.479 1.00 0.00 H TER 10317 WAT 5159 ATOM 10317 O WAT 5160 14.264 23.983 123.745 1.00 0.00 O ATOM 10318 H1 WAT 5160 14.080 24.923 123.764 1.00 0.00 H ATOM 10319 H2 WAT 5160 14.242 23.716 124.664 1.00 0.00 H TER 10321 WAT 5160 ATOM 10321 O WAT 5161 58.535 137.821 18.001 1.00 0.00 O ATOM 10322 H1 WAT 5161 59.416 137.564 17.731 1.00 0.00 H ATOM 10323 H2 WAT 5161 58.143 137.015 18.339 1.00 0.00 H TER 10325 WAT 5161 ATOM 10325 O WAT 5162 73.680 136.997 156.200 1.00 0.00 O ATOM 10326 H1 WAT 5162 72.840 137.061 155.745 1.00 0.00 H ATOM 10327 H2 WAT 5162 74.150 137.791 155.947 1.00 0.00 H TER 10329 WAT 5162 ATOM 10329 O WAT 5163 50.653 132.035 104.033 1.00 0.00 O ATOM 10330 H1 WAT 5163 50.042 132.473 103.441 1.00 0.00 H ATOM 10331 H2 WAT 5163 50.539 131.102 103.848 1.00 0.00 H TER 10333 WAT 5163 ATOM 10333 O WAT 5164 127.423 46.142 110.804 1.00 0.00 O ATOM 10334 H1 WAT 5164 128.152 46.684 110.501 1.00 0.00 H ATOM 10335 H2 WAT 5164 126.935 46.709 111.401 1.00 0.00 H TER 10337 WAT 5164 ATOM 10337 O WAT 5165 66.548 95.091 6.030 1.00 0.00 O ATOM 10338 H1 WAT 5165 67.357 95.566 6.223 1.00 0.00 H ATOM 10339 H2 WAT 5165 66.247 94.777 6.883 1.00 0.00 H TER 10341 WAT 5165 ATOM 10341 O WAT 5166 112.807 82.670 135.092 1.00 0.00 O ATOM 10342 H1 WAT 5166 113.037 82.080 134.374 1.00 0.00 H ATOM 10343 H2 WAT 5166 113.636 83.081 135.339 1.00 0.00 H TER 10345 WAT 5166 ATOM 10345 O WAT 5167 127.799 140.730 22.496 1.00 0.00 O ATOM 10346 H1 WAT 5167 128.611 140.598 22.986 1.00 0.00 H ATOM 10347 H2 WAT 5167 127.157 140.980 23.160 1.00 0.00 H TER 10349 WAT 5167 ATOM 10349 O WAT 5168 130.781 142.324 98.617 1.00 0.00 O ATOM 10350 H1 WAT 5168 131.180 141.467 98.466 1.00 0.00 H ATOM 10351 H2 WAT 5168 129.962 142.297 98.122 1.00 0.00 H TER 10353 WAT 5168 ATOM 10353 O WAT 5169 3.146 43.358 98.617 1.00 0.00 O ATOM 10354 H1 WAT 5169 2.602 43.820 99.254 1.00 0.00 H ATOM 10355 H2 WAT 5169 2.580 43.248 97.853 1.00 0.00 H TER 10357 WAT 5169 ATOM 10357 O WAT 5170 133.815 93.896 141.152 1.00 0.00 O ATOM 10358 H1 WAT 5170 133.206 93.158 141.141 1.00 0.00 H ATOM 10359 H2 WAT 5170 134.142 93.924 142.052 1.00 0.00 H TER 10361 WAT 5170 ATOM 10361 O WAT 5171 52.794 131.533 59.641 1.00 0.00 O ATOM 10362 H1 WAT 5171 53.749 131.598 59.618 1.00 0.00 H ATOM 10363 H2 WAT 5171 52.488 132.422 59.463 1.00 0.00 H TER 10365 WAT 5171 ATOM 10365 O WAT 5172 73.123 26.663 70.763 1.00 0.00 O ATOM 10366 H1 WAT 5172 73.317 26.821 71.686 1.00 0.00 H ATOM 10367 H2 WAT 5172 72.528 27.372 70.518 1.00 0.00 H TER 10369 WAT 5172 ATOM 10369 O WAT 5173 5.157 93.288 123.429 1.00 0.00 O ATOM 10370 H1 WAT 5173 4.950 92.530 123.975 1.00 0.00 H ATOM 10371 H2 WAT 5173 5.963 93.642 123.805 1.00 0.00 H TER 10373 WAT 5173 ATOM 10373 O WAT 5174 6.322 30.167 3.668 1.00 0.00 O ATOM 10374 H1 WAT 5174 6.414 29.243 3.902 1.00 0.00 H ATOM 10375 H2 WAT 5174 7.198 30.533 3.792 1.00 0.00 H TER 10377 WAT 5174 ATOM 10377 O WAT 5175 1.540 6.172 83.813 1.00 0.00 O ATOM 10378 H1 WAT 5175 2.044 6.915 83.480 1.00 0.00 H ATOM 10379 H2 WAT 5175 1.545 5.538 83.096 1.00 0.00 H TER 10381 WAT 5175 ATOM 10381 O WAT 5176 18.282 20.837 89.500 1.00 0.00 O ATOM 10382 H1 WAT 5176 18.079 21.665 89.936 1.00 0.00 H ATOM 10383 H2 WAT 5176 19.123 20.993 89.070 1.00 0.00 H TER 10385 WAT 5176 ATOM 10385 O WAT 5177 23.333 131.058 70.747 1.00 0.00 O ATOM 10386 H1 WAT 5177 23.451 131.379 71.641 1.00 0.00 H ATOM 10387 H2 WAT 5177 24.219 131.022 70.387 1.00 0.00 H TER 10389 WAT 5177 ATOM 10389 O WAT 5178 24.379 14.891 3.096 1.00 0.00 O ATOM 10390 H1 WAT 5178 24.656 15.017 2.188 1.00 0.00 H ATOM 10391 H2 WAT 5178 23.857 15.667 3.297 1.00 0.00 H TER 10393 WAT 5178 ATOM 10393 O WAT 5179 119.077 107.394 119.174 1.00 0.00 O ATOM 10394 H1 WAT 5179 119.316 108.028 119.851 1.00 0.00 H ATOM 10395 H2 WAT 5179 119.677 107.578 118.451 1.00 0.00 H TER 10397 WAT 5179 ATOM 10397 O WAT 5180 3.006 114.317 117.312 1.00 0.00 O ATOM 10398 H1 WAT 5180 2.519 113.973 118.060 1.00 0.00 H ATOM 10399 H2 WAT 5180 3.768 113.742 117.237 1.00 0.00 H TER 10401 WAT 5180 ATOM 10401 O WAT 5181 107.536 58.058 150.422 1.00 0.00 O ATOM 10402 H1 WAT 5181 108.424 57.806 150.677 1.00 0.00 H ATOM 10403 H2 WAT 5181 107.071 58.168 151.251 1.00 0.00 H TER 10405 WAT 5181 ATOM 10405 O WAT 5182 102.128 91.063 58.605 1.00 0.00 O ATOM 10406 H1 WAT 5182 101.564 91.689 58.151 1.00 0.00 H ATOM 10407 H2 WAT 5182 102.780 91.605 59.048 1.00 0.00 H TER 10409 WAT 5182 ATOM 10409 O WAT 5183 15.622 119.336 124.004 1.00 0.00 O ATOM 10410 H1 WAT 5183 15.824 119.755 124.841 1.00 0.00 H ATOM 10411 H2 WAT 5183 15.243 120.036 123.472 1.00 0.00 H TER 10413 WAT 5183 ATOM 10413 O WAT 5184 86.214 36.762 115.870 1.00 0.00 O ATOM 10414 H1 WAT 5184 86.154 35.944 115.377 1.00 0.00 H ATOM 10415 H2 WAT 5184 85.840 36.553 116.726 1.00 0.00 H TER 10417 WAT 5184 ATOM 10417 O WAT 5185 133.930 55.797 111.829 1.00 0.00 O ATOM 10418 H1 WAT 5185 134.307 55.126 111.260 1.00 0.00 H ATOM 10419 H2 WAT 5185 134.687 56.243 112.208 1.00 0.00 H TER 10421 WAT 5185 ATOM 10421 O WAT 5186 142.613 64.654 96.136 1.00 0.00 O ATOM 10422 H1 WAT 5186 143.549 64.517 95.993 1.00 0.00 H ATOM 10423 H2 WAT 5186 142.569 65.239 96.891 1.00 0.00 H TER 10425 WAT 5186 ATOM 10425 O WAT 5187 4.695 63.520 81.724 1.00 0.00 O ATOM 10426 H1 WAT 5187 4.678 64.465 81.575 1.00 0.00 H ATOM 10427 H2 WAT 5187 4.243 63.150 80.966 1.00 0.00 H TER 10429 WAT 5187 ATOM 10429 O WAT 5188 58.985 14.340 116.735 1.00 0.00 O ATOM 10430 H1 WAT 5188 58.308 13.681 116.885 1.00 0.00 H ATOM 10431 H2 WAT 5188 58.757 14.730 115.891 1.00 0.00 H TER 10433 WAT 5188 ATOM 10433 O WAT 5189 75.164 122.810 116.427 1.00 0.00 O ATOM 10434 H1 WAT 5189 75.289 122.983 117.360 1.00 0.00 H ATOM 10435 H2 WAT 5189 74.219 122.885 116.294 1.00 0.00 H TER 10437 WAT 5189 ATOM 10437 O WAT 5190 35.189 62.118 100.471 1.00 0.00 O ATOM 10438 H1 WAT 5190 35.154 61.184 100.677 1.00 0.00 H ATOM 10439 H2 WAT 5190 34.577 62.227 99.742 1.00 0.00 H TER 10441 WAT 5190 ATOM 10441 O WAT 5191 113.666 92.096 5.427 1.00 0.00 O ATOM 10442 H1 WAT 5191 113.509 92.960 5.809 1.00 0.00 H ATOM 10443 H2 WAT 5191 114.617 92.045 5.336 1.00 0.00 H TER 10445 WAT 5191 ATOM 10445 O WAT 5192 123.212 23.149 124.432 1.00 0.00 O ATOM 10446 H1 WAT 5192 123.748 22.529 123.938 1.00 0.00 H ATOM 10447 H2 WAT 5192 123.200 23.939 123.893 1.00 0.00 H TER 10449 WAT 5192 ATOM 10449 O WAT 5193 29.425 68.235 0.855 1.00 0.00 O ATOM 10450 H1 WAT 5193 28.780 67.783 1.399 1.00 0.00 H ATOM 10451 H2 WAT 5193 29.306 67.861 -0.018 1.00 0.00 H TER 10453 WAT 5193 ATOM 10453 O WAT 5194 3.534 10.039 78.464 1.00 0.00 O ATOM 10454 H1 WAT 5194 3.434 10.035 77.512 1.00 0.00 H ATOM 10455 H2 WAT 5194 4.463 9.861 78.609 1.00 0.00 H TER 10457 WAT 5194 ATOM 10457 O WAT 5195 144.165 100.498 119.420 1.00 0.00 O ATOM 10458 H1 WAT 5195 144.932 100.611 118.858 1.00 0.00 H ATOM 10459 H2 WAT 5195 143.542 101.156 119.110 1.00 0.00 H TER 10461 WAT 5195 ATOM 10461 O WAT 5196 30.650 85.477 7.674 1.00 0.00 O ATOM 10462 H1 WAT 5196 29.699 85.588 7.666 1.00 0.00 H ATOM 10463 H2 WAT 5196 30.834 84.936 6.906 1.00 0.00 H TER 10465 WAT 5196 ATOM 10465 O WAT 5197 96.441 142.832 143.298 1.00 0.00 O ATOM 10466 H1 WAT 5197 96.626 143.751 143.107 1.00 0.00 H ATOM 10467 H2 WAT 5197 97.162 142.555 143.862 1.00 0.00 H TER 10469 WAT 5197 ATOM 10469 O WAT 5198 33.863 51.374 19.624 1.00 0.00 O ATOM 10470 H1 WAT 5198 33.143 50.769 19.449 1.00 0.00 H ATOM 10471 H2 WAT 5198 33.694 51.698 20.509 1.00 0.00 H TER 10473 WAT 5198 ATOM 10473 O WAT 5199 82.863 31.046 92.614 1.00 0.00 O ATOM 10474 H1 WAT 5199 83.503 30.913 91.916 1.00 0.00 H ATOM 10475 H2 WAT 5199 82.693 31.988 92.608 1.00 0.00 H TER 10477 WAT 5199 ATOM 10477 O WAT 5200 81.016 63.374 23.166 1.00 0.00 O ATOM 10478 H1 WAT 5200 80.484 63.872 22.546 1.00 0.00 H ATOM 10479 H2 WAT 5200 81.552 64.034 23.607 1.00 0.00 H TER 10481 WAT 5200 ATOM 10481 O WAT 5201 23.234 2.112 108.898 1.00 0.00 O ATOM 10482 H1 WAT 5201 23.524 1.215 109.063 1.00 0.00 H ATOM 10483 H2 WAT 5201 23.889 2.659 109.332 1.00 0.00 H TER 10485 WAT 5201 ATOM 10485 O WAT 5202 61.867 69.139 137.608 1.00 0.00 O ATOM 10486 H1 WAT 5202 62.636 69.669 137.396 1.00 0.00 H ATOM 10487 H2 WAT 5202 61.956 68.953 138.543 1.00 0.00 H TER 10489 WAT 5202 ATOM 10489 O WAT 5203 6.948 24.306 93.367 1.00 0.00 O ATOM 10490 H1 WAT 5203 6.241 24.474 93.990 1.00 0.00 H ATOM 10491 H2 WAT 5203 7.255 23.426 93.585 1.00 0.00 H TER 10493 WAT 5203 ATOM 10493 O WAT 5204 37.220 45.447 82.820 1.00 0.00 O ATOM 10494 H1 WAT 5204 37.091 46.172 83.432 1.00 0.00 H ATOM 10495 H2 WAT 5204 36.574 45.598 82.130 1.00 0.00 H TER 10497 WAT 5204 ATOM 10497 O WAT 5205 6.795 139.018 0.162 1.00 0.00 O ATOM 10498 H1 WAT 5205 5.878 139.150 -0.081 1.00 0.00 H ATOM 10499 H2 WAT 5205 7.114 139.894 0.378 1.00 0.00 H TER 10501 WAT 5205 ATOM 10501 O WAT 5206 135.393 80.107 144.553 1.00 0.00 O ATOM 10502 H1 WAT 5206 134.539 80.505 144.723 1.00 0.00 H ATOM 10503 H2 WAT 5206 135.450 79.385 145.178 1.00 0.00 H TER 10505 WAT 5206 ATOM 10505 O WAT 5207 58.500 3.163 151.956 1.00 0.00 O ATOM 10506 H1 WAT 5207 57.766 2.550 152.003 1.00 0.00 H ATOM 10507 H2 WAT 5207 58.584 3.364 151.024 1.00 0.00 H TER 10509 WAT 5207 ATOM 10509 O WAT 5208 12.264 43.429 55.980 1.00 0.00 O ATOM 10510 H1 WAT 5208 12.169 44.371 55.845 1.00 0.00 H ATOM 10511 H2 WAT 5208 11.556 43.201 56.583 1.00 0.00 H TER 10513 WAT 5208 ATOM 10513 O WAT 5209 102.309 98.531 136.670 1.00 0.00 O ATOM 10514 H1 WAT 5209 102.958 97.845 136.827 1.00 0.00 H ATOM 10515 H2 WAT 5209 101.887 98.279 135.848 1.00 0.00 H TER 10517 WAT 5209 ATOM 10517 O WAT 5210 43.796 121.477 96.300 1.00 0.00 O ATOM 10518 H1 WAT 5210 43.628 120.701 95.765 1.00 0.00 H ATOM 10519 H2 WAT 5210 44.050 121.128 97.155 1.00 0.00 H TER 10521 WAT 5210 ATOM 10521 O WAT 5211 124.540 130.390 114.654 1.00 0.00 O ATOM 10522 H1 WAT 5211 125.451 130.114 114.554 1.00 0.00 H ATOM 10523 H2 WAT 5211 124.352 130.890 113.860 1.00 0.00 H TER 10525 WAT 5211 ATOM 10525 O WAT 5212 143.723 54.394 151.148 1.00 0.00 O ATOM 10526 H1 WAT 5212 143.883 53.536 151.540 1.00 0.00 H ATOM 10527 H2 WAT 5212 144.523 54.890 151.323 1.00 0.00 H TER 10529 WAT 5212 ATOM 10529 O WAT 5213 35.472 102.379 79.045 1.00 0.00 O ATOM 10530 H1 WAT 5213 35.438 101.561 79.540 1.00 0.00 H ATOM 10531 H2 WAT 5213 36.404 102.595 79.002 1.00 0.00 H TER 10533 WAT 5213 ATOM 10533 O WAT 5214 78.275 96.917 22.068 1.00 0.00 O ATOM 10534 H1 WAT 5214 78.357 97.860 22.206 1.00 0.00 H ATOM 10535 H2 WAT 5214 78.008 96.572 22.921 1.00 0.00 H TER 10537 WAT 5214 ATOM 10537 O WAT 5215 45.153 7.260 95.836 1.00 0.00 O ATOM 10538 H1 WAT 5215 45.514 6.378 95.929 1.00 0.00 H ATOM 10539 H2 WAT 5215 45.632 7.784 96.477 1.00 0.00 H TER 10541 WAT 5215 ATOM 10541 O WAT 5216 78.070 140.106 14.465 1.00 0.00 O ATOM 10542 H1 WAT 5216 78.549 139.288 14.330 1.00 0.00 H ATOM 10543 H2 WAT 5216 78.680 140.789 14.185 1.00 0.00 H TER 10545 WAT 5216 ATOM 10545 O WAT 5217 24.097 38.675 129.233 1.00 0.00 O ATOM 10546 H1 WAT 5217 23.326 38.891 128.708 1.00 0.00 H ATOM 10547 H2 WAT 5217 24.659 38.177 128.638 1.00 0.00 H TER 10549 WAT 5217 ATOM 10549 O WAT 5218 30.956 0.174 101.674 1.00 0.00 O ATOM 10550 H1 WAT 5218 31.831 0.471 101.423 1.00 0.00 H ATOM 10551 H2 WAT 5218 31.074 -0.213 102.541 1.00 0.00 H TER 10553 WAT 5218 ATOM 10553 O WAT 5219 57.455 51.669 3.959 1.00 0.00 O ATOM 10554 H1 WAT 5219 56.511 51.758 4.089 1.00 0.00 H ATOM 10555 H2 WAT 5219 57.692 52.414 3.408 1.00 0.00 H TER 10557 WAT 5219 ATOM 10557 O WAT 5220 112.510 145.952 9.745 1.00 0.00 O ATOM 10558 H1 WAT 5220 112.459 145.035 10.013 1.00 0.00 H ATOM 10559 H2 WAT 5220 113.172 146.334 10.320 1.00 0.00 H TER 10561 WAT 5220 ATOM 10561 O WAT 5221 31.935 52.935 8.406 1.00 0.00 O ATOM 10562 H1 WAT 5221 32.744 52.655 8.835 1.00 0.00 H ATOM 10563 H2 WAT 5221 32.086 53.855 8.188 1.00 0.00 H TER 10565 WAT 5221 ATOM 10565 O WAT 5222 55.181 87.199 97.020 1.00 0.00 O ATOM 10566 H1 WAT 5222 55.580 87.838 97.611 1.00 0.00 H ATOM 10567 H2 WAT 5222 54.263 87.467 96.962 1.00 0.00 H TER 10569 WAT 5222 ATOM 10569 O WAT 5223 95.131 69.476 133.982 1.00 0.00 O ATOM 10570 H1 WAT 5223 94.260 69.161 133.742 1.00 0.00 H ATOM 10571 H2 WAT 5223 95.478 68.801 134.564 1.00 0.00 H TER 10573 WAT 5223 ATOM 10573 O WAT 5224 33.348 15.516 71.262 1.00 0.00 O ATOM 10574 H1 WAT 5224 32.998 14.932 70.590 1.00 0.00 H ATOM 10575 H2 WAT 5224 34.275 15.605 71.043 1.00 0.00 H TER 10577 WAT 5224 ATOM 10577 O WAT 5225 37.143 62.969 62.806 1.00 0.00 O ATOM 10578 H1 WAT 5225 37.944 63.464 62.979 1.00 0.00 H ATOM 10579 H2 WAT 5225 37.369 62.398 62.071 1.00 0.00 H TER 10581 WAT 5225 ATOM 10581 O WAT 5226 9.374 131.134 128.730 1.00 0.00 O ATOM 10582 H1 WAT 5226 8.552 130.765 129.053 1.00 0.00 H ATOM 10583 H2 WAT 5226 9.517 131.910 129.272 1.00 0.00 H TER 10585 WAT 5226 ATOM 10585 O WAT 5227 90.775 137.047 155.402 1.00 0.00 O ATOM 10586 H1 WAT 5227 90.753 136.090 155.403 1.00 0.00 H ATOM 10587 H2 WAT 5227 91.511 137.269 155.973 1.00 0.00 H TER 10589 WAT 5227 ATOM 10589 O WAT 5228 30.155 61.784 106.517 1.00 0.00 O ATOM 10590 H1 WAT 5228 29.978 62.561 107.048 1.00 0.00 H ATOM 10591 H2 WAT 5228 29.450 61.771 105.870 1.00 0.00 H TER 10593 WAT 5228 ATOM 10593 O WAT 5229 119.694 125.300 84.846 1.00 0.00 O ATOM 10594 H1 WAT 5229 119.263 124.460 84.685 1.00 0.00 H ATOM 10595 H2 WAT 5229 119.150 125.940 84.387 1.00 0.00 H TER 10597 WAT 5229 ATOM 10597 O WAT 5230 44.358 98.777 124.631 1.00 0.00 O ATOM 10598 H1 WAT 5230 43.713 98.996 123.959 1.00 0.00 H ATOM 10599 H2 WAT 5230 44.157 97.872 124.870 1.00 0.00 H TER 10601 WAT 5230 ATOM 10601 O WAT 5231 1.612 49.778 6.544 1.00 0.00 O ATOM 10602 H1 WAT 5231 0.989 50.318 7.030 1.00 0.00 H ATOM 10603 H2 WAT 5231 1.900 49.118 7.175 1.00 0.00 H TER 10605 WAT 5231 ATOM 10605 O WAT 5232 82.590 78.534 124.009 1.00 0.00 O ATOM 10606 H1 WAT 5232 83.087 77.717 124.062 1.00 0.00 H ATOM 10607 H2 WAT 5232 83.180 79.145 123.568 1.00 0.00 H TER 10609 WAT 5232 ATOM 10609 O WAT 5233 64.220 23.776 98.322 1.00 0.00 O ATOM 10610 H1 WAT 5233 64.108 24.253 99.144 1.00 0.00 H ATOM 10611 H2 WAT 5233 63.344 23.756 97.936 1.00 0.00 H TER 10613 WAT 5233 ATOM 10613 O WAT 5234 9.107 22.563 61.004 1.00 0.00 O ATOM 10614 H1 WAT 5234 9.686 22.295 61.718 1.00 0.00 H ATOM 10615 H2 WAT 5234 9.489 22.161 60.223 1.00 0.00 H TER 10617 WAT 5234 ATOM 10617 O WAT 5235 95.045 51.581 71.661 1.00 0.00 O ATOM 10618 H1 WAT 5235 95.470 51.239 70.875 1.00 0.00 H ATOM 10619 H2 WAT 5235 94.145 51.760 71.388 1.00 0.00 H TER 10621 WAT 5235 ATOM 10621 O WAT 5236 32.071 143.740 142.922 1.00 0.00 O ATOM 10622 H1 WAT 5236 32.385 144.479 142.401 1.00 0.00 H ATOM 10623 H2 WAT 5236 32.211 142.976 142.363 1.00 0.00 H TER 10625 WAT 5236 ATOM 10625 O WAT 5237 57.479 104.936 143.993 1.00 0.00 O ATOM 10626 H1 WAT 5237 58.329 104.557 144.217 1.00 0.00 H ATOM 10627 H2 WAT 5237 57.038 105.049 144.836 1.00 0.00 H TER 10629 WAT 5237 ATOM 10629 O WAT 5238 11.768 74.181 79.690 1.00 0.00 O ATOM 10630 H1 WAT 5238 12.471 74.052 80.327 1.00 0.00 H ATOM 10631 H2 WAT 5238 11.173 73.446 79.839 1.00 0.00 H TER 10633 WAT 5238 ATOM 10633 O WAT 5239 15.076 89.782 156.206 1.00 0.00 O ATOM 10634 H1 WAT 5239 14.148 89.992 156.106 1.00 0.00 H ATOM 10635 H2 WAT 5239 15.230 89.071 155.584 1.00 0.00 H TER 10637 WAT 5239 ATOM 10637 O WAT 5240 18.465 125.652 54.115 1.00 0.00 O ATOM 10638 H1 WAT 5240 17.573 125.339 53.969 1.00 0.00 H ATOM 10639 H2 WAT 5240 18.576 125.623 55.066 1.00 0.00 H TER 10641 WAT 5240 ATOM 10641 O WAT 5241 78.641 12.969 148.271 1.00 0.00 O ATOM 10642 H1 WAT 5241 78.187 13.772 148.013 1.00 0.00 H ATOM 10643 H2 WAT 5241 77.988 12.279 148.161 1.00 0.00 H TER 10645 WAT 5241 ATOM 10645 O WAT 5242 136.291 91.328 113.732 1.00 0.00 O ATOM 10646 H1 WAT 5242 135.354 91.134 113.763 1.00 0.00 H ATOM 10647 H2 WAT 5242 136.712 90.533 114.059 1.00 0.00 H TER 10649 WAT 5242 ATOM 10649 O WAT 5243 127.368 70.178 123.095 1.00 0.00 O ATOM 10650 H1 WAT 5243 127.330 69.723 123.936 1.00 0.00 H ATOM 10651 H2 WAT 5243 126.453 70.268 122.829 1.00 0.00 H TER 10653 WAT 5243 ATOM 10653 O WAT 5244 72.322 9.635 64.010 1.00 0.00 O ATOM 10654 H1 WAT 5244 72.050 8.982 64.655 1.00 0.00 H ATOM 10655 H2 WAT 5244 72.474 10.429 64.522 1.00 0.00 H TER 10657 WAT 5244 ATOM 10657 O WAT 5245 74.411 122.962 74.607 1.00 0.00 O ATOM 10658 H1 WAT 5245 74.226 123.819 74.224 1.00 0.00 H ATOM 10659 H2 WAT 5245 74.740 122.439 73.876 1.00 0.00 H TER 10661 WAT 5245 ATOM 10661 O WAT 5246 84.259 33.249 74.996 1.00 0.00 O ATOM 10662 H1 WAT 5246 84.600 32.384 74.768 1.00 0.00 H ATOM 10663 H2 WAT 5246 84.819 33.861 74.518 1.00 0.00 H TER 10665 WAT 5246 ATOM 10665 O WAT 5247 67.539 128.466 79.366 1.00 0.00 O ATOM 10666 H1 WAT 5247 67.574 127.565 79.044 1.00 0.00 H ATOM 10667 H2 WAT 5247 66.903 128.899 78.797 1.00 0.00 H TER 10669 WAT 5247 ATOM 10669 O WAT 5248 65.142 73.445 83.709 1.00 0.00 O ATOM 10670 H1 WAT 5248 65.506 72.924 82.993 1.00 0.00 H ATOM 10671 H2 WAT 5248 64.225 73.574 83.469 1.00 0.00 H TER 10673 WAT 5248 ATOM 10673 O WAT 5249 32.414 67.887 81.946 1.00 0.00 O ATOM 10674 H1 WAT 5249 32.877 67.147 82.339 1.00 0.00 H ATOM 10675 H2 WAT 5249 32.809 67.983 81.079 1.00 0.00 H TER 10677 WAT 5249 ATOM 10677 O WAT 5250 144.416 55.174 58.736 1.00 0.00 O ATOM 10678 H1 WAT 5250 144.999 54.528 58.337 1.00 0.00 H ATOM 10679 H2 WAT 5250 144.993 55.718 59.272 1.00 0.00 H TER 10681 WAT 5250 ATOM 10681 O WAT 5251 63.439 54.930 152.633 1.00 0.00 O ATOM 10682 H1 WAT 5251 64.007 54.612 153.335 1.00 0.00 H ATOM 10683 H2 WAT 5251 62.747 54.271 152.569 1.00 0.00 H TER 10685 WAT 5251 ATOM 10685 O WAT 5252 54.155 64.161 134.819 1.00 0.00 O ATOM 10686 H1 WAT 5252 53.414 63.798 135.305 1.00 0.00 H ATOM 10687 H2 WAT 5252 54.319 65.009 135.231 1.00 0.00 H TER 10689 WAT 5252 ATOM 10689 O WAT 5253 67.138 4.018 88.440 1.00 0.00 O ATOM 10690 H1 WAT 5253 66.345 4.070 87.905 1.00 0.00 H ATOM 10691 H2 WAT 5253 66.816 3.894 89.333 1.00 0.00 H TER 10693 WAT 5253 ATOM 10693 O WAT 5254 103.644 9.315 147.845 1.00 0.00 O ATOM 10694 H1 WAT 5254 103.666 8.386 148.075 1.00 0.00 H ATOM 10695 H2 WAT 5254 104.329 9.711 148.384 1.00 0.00 H TER 10697 WAT 5254 ATOM 10697 O WAT 5255 134.890 86.996 95.032 1.00 0.00 O ATOM 10698 H1 WAT 5255 135.193 86.242 94.527 1.00 0.00 H ATOM 10699 H2 WAT 5255 134.501 87.580 94.381 1.00 0.00 H TER 10701 WAT 5255 ATOM 10701 O WAT 5256 134.385 0.708 155.880 1.00 0.00 O ATOM 10702 H1 WAT 5256 134.465 1.646 156.051 1.00 0.00 H ATOM 10703 H2 WAT 5256 133.499 0.602 155.534 1.00 0.00 H TER 10705 WAT 5256 ATOM 10705 O WAT 5257 108.755 142.875 132.149 1.00 0.00 O ATOM 10706 H1 WAT 5257 108.617 143.294 131.299 1.00 0.00 H ATOM 10707 H2 WAT 5257 108.305 142.033 132.076 1.00 0.00 H TER 10709 WAT 5257 ATOM 10709 O WAT 5258 70.312 22.664 7.440 1.00 0.00 O ATOM 10710 H1 WAT 5258 69.847 23.495 7.541 1.00 0.00 H ATOM 10711 H2 WAT 5258 70.919 22.816 6.716 1.00 0.00 H TER 10713 WAT 5258 ATOM 10713 O WAT 5259 113.968 72.565 86.068 1.00 0.00 O ATOM 10714 H1 WAT 5259 113.210 72.551 85.484 1.00 0.00 H ATOM 10715 H2 WAT 5259 114.634 72.055 85.608 1.00 0.00 H TER 10717 WAT 5259 ATOM 10717 O WAT 5260 80.668 90.788 144.438 1.00 0.00 O ATOM 10718 H1 WAT 5260 81.512 91.230 144.533 1.00 0.00 H ATOM 10719 H2 WAT 5260 80.248 90.889 145.292 1.00 0.00 H TER 10721 WAT 5260 ATOM 10721 O WAT 5261 34.429 10.631 21.397 1.00 0.00 O ATOM 10722 H1 WAT 5261 35.023 9.904 21.585 1.00 0.00 H ATOM 10723 H2 WAT 5261 33.616 10.210 21.119 1.00 0.00 H TER 10725 WAT 5261 ATOM 10725 O WAT 5262 69.537 106.046 57.902 1.00 0.00 O ATOM 10726 H1 WAT 5262 70.044 106.813 58.168 1.00 0.00 H ATOM 10727 H2 WAT 5262 69.729 105.943 56.970 1.00 0.00 H TER 10729 WAT 5262 ATOM 10729 O WAT 5263 74.782 19.627 101.055 1.00 0.00 O ATOM 10730 H1 WAT 5263 74.386 20.450 101.341 1.00 0.00 H ATOM 10731 H2 WAT 5263 75.493 19.893 100.472 1.00 0.00 H TER 10733 WAT 5263 ATOM 10733 O WAT 5264 47.948 89.608 129.722 1.00 0.00 O ATOM 10734 H1 WAT 5264 47.422 89.983 129.015 1.00 0.00 H ATOM 10735 H2 WAT 5264 47.521 88.775 129.922 1.00 0.00 H TER 10737 WAT 5264 ATOM 10737 O WAT 5265 11.690 89.845 103.659 1.00 0.00 O ATOM 10738 H1 WAT 5265 12.545 89.849 104.090 1.00 0.00 H ATOM 10739 H2 WAT 5265 11.505 88.919 103.501 1.00 0.00 H TER 10741 WAT 5265 ATOM 10741 O WAT 5266 75.811 2.188 96.828 1.00 0.00 O ATOM 10742 H1 WAT 5266 75.055 2.505 96.334 1.00 0.00 H ATOM 10743 H2 WAT 5266 75.933 1.287 96.528 1.00 0.00 H TER 10745 WAT 5266 ATOM 10745 O WAT 5267 75.292 29.494 83.872 1.00 0.00 O ATOM 10746 H1 WAT 5267 75.319 30.383 83.518 1.00 0.00 H ATOM 10747 H2 WAT 5267 76.184 29.332 84.182 1.00 0.00 H TER 10749 WAT 5267 ATOM 10749 O WAT 5268 51.184 59.316 109.204 1.00 0.00 O ATOM 10750 H1 WAT 5268 52.078 59.427 109.528 1.00 0.00 H ATOM 10751 H2 WAT 5268 51.163 58.421 108.864 1.00 0.00 H TER 10753 WAT 5268 ATOM 10753 O WAT 5269 110.142 77.642 89.900 1.00 0.00 O ATOM 10754 H1 WAT 5269 110.540 77.967 89.093 1.00 0.00 H ATOM 10755 H2 WAT 5269 110.040 78.421 90.448 1.00 0.00 H TER 10757 WAT 5269 ATOM 10757 O WAT 5270 0.284 87.491 112.268 1.00 0.00 O ATOM 10758 H1 WAT 5270 1.120 87.873 112.001 1.00 0.00 H ATOM 10759 H2 WAT 5270 -0.342 88.212 112.199 1.00 0.00 H TER 10761 WAT 5270 ATOM 10761 O WAT 5271 84.903 110.054 149.946 1.00 0.00 O ATOM 10762 H1 WAT 5271 84.776 110.527 149.123 1.00 0.00 H ATOM 10763 H2 WAT 5271 85.376 110.670 150.506 1.00 0.00 H TER 10765 WAT 5271 ATOM 10765 O WAT 5272 139.648 40.645 121.558 1.00 0.00 O ATOM 10766 H1 WAT 5272 139.254 40.374 120.729 1.00 0.00 H ATOM 10767 H2 WAT 5272 140.591 40.575 121.410 1.00 0.00 H TER 10769 WAT 5272 ATOM 10769 O WAT 5273 30.065 104.964 109.587 1.00 0.00 O ATOM 10770 H1 WAT 5273 30.924 104.606 109.366 1.00 0.00 H ATOM 10771 H2 WAT 5273 29.966 104.791 110.523 1.00 0.00 H TER 10773 WAT 5273 ATOM 10773 O WAT 5274 123.749 48.371 80.598 1.00 0.00 O ATOM 10774 H1 WAT 5274 124.012 48.502 79.687 1.00 0.00 H ATOM 10775 H2 WAT 5274 124.527 48.601 81.107 1.00 0.00 H TER 10777 WAT 5274 ATOM 10777 O WAT 5275 34.569 58.872 128.524 1.00 0.00 O ATOM 10778 H1 WAT 5275 33.708 58.778 128.116 1.00 0.00 H ATOM 10779 H2 WAT 5275 34.553 58.261 129.260 1.00 0.00 H TER 10781 WAT 5275 ATOM 10781 O WAT 5276 72.033 61.604 133.971 1.00 0.00 O ATOM 10782 H1 WAT 5276 72.907 61.945 134.157 1.00 0.00 H ATOM 10783 H2 WAT 5276 72.130 60.653 134.027 1.00 0.00 H TER 10785 WAT 5276 ATOM 10785 O WAT 5277 59.538 121.477 9.282 1.00 0.00 O ATOM 10786 H1 WAT 5277 59.459 121.135 8.392 1.00 0.00 H ATOM 10787 H2 WAT 5277 58.864 122.155 9.339 1.00 0.00 H TER 10789 WAT 5277 ATOM 10789 O WAT 5278 4.481 24.436 72.217 1.00 0.00 O ATOM 10790 H1 WAT 5278 3.983 23.619 72.183 1.00 0.00 H ATOM 10791 H2 WAT 5278 4.260 24.884 71.400 1.00 0.00 H TER 10793 WAT 5278 ATOM 10793 O WAT 5279 40.267 64.199 131.989 1.00 0.00 O ATOM 10794 H1 WAT 5279 39.575 64.370 132.627 1.00 0.00 H ATOM 10795 H2 WAT 5279 39.919 63.496 131.441 1.00 0.00 H TER 10797 WAT 5279 ATOM 10797 O WAT 5280 69.263 90.721 10.118 1.00 0.00 O ATOM 10798 H1 WAT 5280 69.925 90.976 9.475 1.00 0.00 H ATOM 10799 H2 WAT 5280 68.925 91.550 10.455 1.00 0.00 H TER 10801 WAT 5280 ATOM 10801 O WAT 5281 52.911 13.548 78.327 1.00 0.00 O ATOM 10802 H1 WAT 5281 52.076 14.007 78.425 1.00 0.00 H ATOM 10803 H2 WAT 5281 52.790 12.727 78.804 1.00 0.00 H TER 10805 WAT 5281 ATOM 10805 O WAT 5282 20.025 88.987 15.766 1.00 0.00 O ATOM 10806 H1 WAT 5282 20.546 88.671 16.505 1.00 0.00 H ATOM 10807 H2 WAT 5282 19.802 89.888 15.998 1.00 0.00 H TER 10809 WAT 5282 ATOM 10809 O WAT 5283 58.625 89.399 91.585 1.00 0.00 O ATOM 10810 H1 WAT 5283 58.652 89.635 92.512 1.00 0.00 H ATOM 10811 H2 WAT 5283 58.699 90.234 91.123 1.00 0.00 H TER 10813 WAT 5283 ATOM 10813 O WAT 5284 0.885 100.283 101.514 1.00 0.00 O ATOM 10814 H1 WAT 5284 0.237 99.590 101.641 1.00 0.00 H ATOM 10815 H2 WAT 5284 0.366 101.069 101.348 1.00 0.00 H TER 10817 WAT 5284 ATOM 10817 O WAT 5285 44.472 89.701 128.736 1.00 0.00 O ATOM 10818 H1 WAT 5285 44.644 89.094 128.017 1.00 0.00 H ATOM 10819 H2 WAT 5285 43.665 90.150 128.483 1.00 0.00 H TER 10821 WAT 5285 ATOM 10821 O WAT 5286 46.489 76.504 135.506 1.00 0.00 O ATOM 10822 H1 WAT 5286 45.948 76.521 134.717 1.00 0.00 H ATOM 10823 H2 WAT 5286 46.454 75.593 135.801 1.00 0.00 H TER 10825 WAT 5286 ATOM 10825 O WAT 5287 32.401 129.731 7.969 1.00 0.00 O ATOM 10826 H1 WAT 5287 32.354 130.288 8.747 1.00 0.00 H ATOM 10827 H2 WAT 5287 33.305 129.817 7.667 1.00 0.00 H TER 10829 WAT 5287 ATOM 10829 O WAT 5288 43.107 142.778 135.137 1.00 0.00 O ATOM 10830 H1 WAT 5288 43.113 143.503 135.761 1.00 0.00 H ATOM 10831 H2 WAT 5288 43.220 141.996 135.677 1.00 0.00 H TER 10833 WAT 5288 ATOM 10833 O WAT 5289 144.958 71.855 94.715 1.00 0.00 O ATOM 10834 H1 WAT 5289 145.813 71.518 94.447 1.00 0.00 H ATOM 10835 H2 WAT 5289 145.059 72.050 95.647 1.00 0.00 H TER 10837 WAT 5289 ATOM 10837 O WAT 5290 107.940 16.243 3.009 1.00 0.00 O ATOM 10838 H1 WAT 5290 108.467 15.828 2.326 1.00 0.00 H ATOM 10839 H2 WAT 5290 108.163 15.763 3.807 1.00 0.00 H TER 10841 WAT 5290 ATOM 10841 O WAT 5291 86.093 127.097 128.734 1.00 0.00 O ATOM 10842 H1 WAT 5291 86.910 127.596 128.764 1.00 0.00 H ATOM 10843 H2 WAT 5291 86.068 126.731 127.850 1.00 0.00 H TER 10845 WAT 5291 ATOM 10845 O WAT 5292 82.256 113.149 154.298 1.00 0.00 O ATOM 10846 H1 WAT 5292 82.165 113.362 153.369 1.00 0.00 H ATOM 10847 H2 WAT 5292 81.580 112.490 154.460 1.00 0.00 H TER 10849 WAT 5292 ATOM 10849 O WAT 5293 82.148 67.855 83.243 1.00 0.00 O ATOM 10850 H1 WAT 5293 81.321 67.761 82.770 1.00 0.00 H ATOM 10851 H2 WAT 5293 82.623 67.045 83.059 1.00 0.00 H TER 10853 WAT 5293 ATOM 10853 O WAT 5294 47.488 88.068 145.360 1.00 0.00 O ATOM 10854 H1 WAT 5294 48.319 87.978 145.825 1.00 0.00 H ATOM 10855 H2 WAT 5294 47.650 88.751 144.709 1.00 0.00 H TER 10857 WAT 5294 ATOM 10857 O WAT 5295 116.727 30.341 154.753 1.00 0.00 O ATOM 10858 H1 WAT 5295 116.091 29.721 154.395 1.00 0.00 H ATOM 10859 H2 WAT 5295 117.429 29.791 155.101 1.00 0.00 H TER 10861 WAT 5295 ATOM 10861 O WAT 5296 95.700 69.974 2.347 1.00 0.00 O ATOM 10862 H1 WAT 5296 94.987 69.896 1.713 1.00 0.00 H ATOM 10863 H2 WAT 5296 95.897 70.910 2.373 1.00 0.00 H TER 10865 WAT 5296 ATOM 10865 O WAT 5297 99.160 129.776 112.452 1.00 0.00 O ATOM 10866 H1 WAT 5297 99.765 130.013 113.156 1.00 0.00 H ATOM 10867 H2 WAT 5297 98.376 129.465 112.905 1.00 0.00 H TER 10869 WAT 5297 ATOM 10869 O WAT 5298 104.358 4.372 58.424 1.00 0.00 O ATOM 10870 H1 WAT 5298 103.859 3.945 59.120 1.00 0.00 H ATOM 10871 H2 WAT 5298 105.168 4.655 58.850 1.00 0.00 H TER 10873 WAT 5298 ATOM 10873 O WAT 5299 84.006 14.665 120.676 1.00 0.00 O ATOM 10874 H1 WAT 5299 84.536 13.927 120.375 1.00 0.00 H ATOM 10875 H2 WAT 5299 84.392 14.910 121.517 1.00 0.00 H TER 10877 WAT 5299 ATOM 10877 O WAT 5300 39.551 12.962 143.674 1.00 0.00 O ATOM 10878 H1 WAT 5300 39.512 12.165 143.145 1.00 0.00 H ATOM 10879 H2 WAT 5300 39.673 13.666 143.037 1.00 0.00 H TER 10881 WAT 5300 ATOM 10881 O WAT 5301 72.237 139.592 102.800 1.00 0.00 O ATOM 10882 H1 WAT 5301 71.740 139.534 101.985 1.00 0.00 H ATOM 10883 H2 WAT 5301 72.683 140.438 102.749 1.00 0.00 H TER 10885 WAT 5301 ATOM 10885 O WAT 5302 42.195 45.760 138.203 1.00 0.00 O ATOM 10886 H1 WAT 5302 41.453 45.157 138.254 1.00 0.00 H ATOM 10887 H2 WAT 5302 42.716 45.564 138.982 1.00 0.00 H TER 10889 WAT 5302 ATOM 10889 O WAT 5303 50.084 6.514 118.204 1.00 0.00 O ATOM 10890 H1 WAT 5303 50.869 6.344 117.683 1.00 0.00 H ATOM 10891 H2 WAT 5303 49.360 6.408 117.586 1.00 0.00 H TER 10893 WAT 5303 ATOM 10893 O WAT 5304 129.543 61.721 11.847 1.00 0.00 O ATOM 10894 H1 WAT 5304 129.356 61.024 11.218 1.00 0.00 H ATOM 10895 H2 WAT 5304 128.692 62.125 12.015 1.00 0.00 H TER 10897 WAT 5304 ATOM 10897 O WAT 5305 116.095 10.606 79.900 1.00 0.00 O ATOM 10898 H1 WAT 5305 116.896 10.172 79.606 1.00 0.00 H ATOM 10899 H2 WAT 5305 116.191 11.511 79.604 1.00 0.00 H TER 10901 WAT 5305 ATOM 10901 O WAT 5306 1.663 114.796 114.901 1.00 0.00 O ATOM 10902 H1 WAT 5306 2.193 114.723 115.695 1.00 0.00 H ATOM 10903 H2 WAT 5306 2.237 115.228 114.269 1.00 0.00 H TER 10905 WAT 5306 ATOM 10905 O WAT 5307 1.968 59.062 101.552 1.00 0.00 O ATOM 10906 H1 WAT 5307 2.822 59.320 101.205 1.00 0.00 H ATOM 10907 H2 WAT 5307 2.157 58.726 102.428 1.00 0.00 H TER 10909 WAT 5307 ATOM 10909 O WAT 5308 6.029 128.894 148.246 1.00 0.00 O ATOM 10910 H1 WAT 5308 6.376 128.675 149.111 1.00 0.00 H ATOM 10911 H2 WAT 5308 6.681 129.485 147.869 1.00 0.00 H TER 10913 WAT 5308 ATOM 10913 O WAT 5309 136.771 60.941 92.203 1.00 0.00 O ATOM 10914 H1 WAT 5309 137.075 61.031 91.300 1.00 0.00 H ATOM 10915 H2 WAT 5309 135.958 60.441 92.134 1.00 0.00 H TER 10917 WAT 5309 ATOM 10917 O WAT 5310 10.288 19.324 114.280 1.00 0.00 O ATOM 10918 H1 WAT 5310 9.956 19.017 115.124 1.00 0.00 H ATOM 10919 H2 WAT 5310 11.166 19.653 114.474 1.00 0.00 H TER 10921 WAT 5310 ATOM 10921 O WAT 5311 109.852 44.842 139.741 1.00 0.00 O ATOM 10922 H1 WAT 5311 109.165 45.461 139.987 1.00 0.00 H ATOM 10923 H2 WAT 5311 109.427 43.985 139.779 1.00 0.00 H TER 10925 WAT 5311 ATOM 10925 O WAT 5312 56.668 0.727 149.829 1.00 0.00 O ATOM 10926 H1 WAT 5312 56.125 0.185 149.255 1.00 0.00 H ATOM 10927 H2 WAT 5312 57.390 1.017 149.271 1.00 0.00 H TER 10929 WAT 5312 ATOM 10929 O WAT 5313 77.463 143.101 84.659 1.00 0.00 O ATOM 10930 H1 WAT 5313 77.275 142.312 85.168 1.00 0.00 H ATOM 10931 H2 WAT 5313 76.682 143.232 84.122 1.00 0.00 H TER 10933 WAT 5313 ATOM 10933 O WAT 5314 0.572 9.760 87.303 1.00 0.00 O ATOM 10934 H1 WAT 5314 0.693 8.958 87.811 1.00 0.00 H ATOM 10935 H2 WAT 5314 0.134 10.361 87.905 1.00 0.00 H TER 10937 WAT 5314 ATOM 10937 O WAT 5315 22.824 104.590 148.381 1.00 0.00 O ATOM 10938 H1 WAT 5315 22.341 104.518 147.557 1.00 0.00 H ATOM 10939 H2 WAT 5315 23.675 104.194 148.195 1.00 0.00 H TER 10941 WAT 5315 ATOM 10941 O WAT 5316 53.335 130.183 14.487 1.00 0.00 O ATOM 10942 H1 WAT 5316 53.963 129.809 15.105 1.00 0.00 H ATOM 10943 H2 WAT 5316 52.683 130.613 15.040 1.00 0.00 H TER 10945 WAT 5316 ATOM 10945 O WAT 5317 136.835 56.873 1.276 1.00 0.00 O ATOM 10946 H1 WAT 5317 136.400 57.358 0.575 1.00 0.00 H ATOM 10947 H2 WAT 5317 137.606 57.399 1.488 1.00 0.00 H TER 10949 WAT 5317 ATOM 10949 O WAT 5318 51.672 52.747 118.506 1.00 0.00 O ATOM 10950 H1 WAT 5318 51.023 52.972 119.172 1.00 0.00 H ATOM 10951 H2 WAT 5318 51.284 53.042 117.682 1.00 0.00 H TER 10953 WAT 5318 ATOM 10953 O WAT 5319 74.574 57.849 126.052 1.00 0.00 O ATOM 10954 H1 WAT 5319 73.896 57.458 125.501 1.00 0.00 H ATOM 10955 H2 WAT 5319 75.397 57.614 125.623 1.00 0.00 H TER 10957 WAT 5319 ATOM 10957 O WAT 5320 18.061 31.158 158.603 1.00 0.00 O ATOM 10958 H1 WAT 5320 17.942 30.340 159.085 1.00 0.00 H ATOM 10959 H2 WAT 5320 19.004 31.319 158.634 1.00 0.00 H TER 10961 WAT 5320 ATOM 10961 O WAT 5321 126.774 12.469 63.421 1.00 0.00 O ATOM 10962 H1 WAT 5321 125.903 12.118 63.603 1.00 0.00 H ATOM 10963 H2 WAT 5321 127.267 12.319 64.228 1.00 0.00 H TER 10965 WAT 5321 ATOM 10965 O WAT 5322 107.894 63.999 91.974 1.00 0.00 O ATOM 10966 H1 WAT 5322 108.850 64.033 92.003 1.00 0.00 H ATOM 10967 H2 WAT 5322 107.640 63.646 92.827 1.00 0.00 H TER 10969 WAT 5322 ATOM 10969 O WAT 5323 99.253 46.537 1.960 1.00 0.00 O ATOM 10970 H1 WAT 5323 98.612 46.518 2.670 1.00 0.00 H ATOM 10971 H2 WAT 5323 100.077 46.769 2.387 1.00 0.00 H TER 10973 WAT 5323 ATOM 10973 O WAT 5324 97.460 26.021 112.119 1.00 0.00 O ATOM 10974 H1 WAT 5324 97.905 26.382 111.352 1.00 0.00 H ATOM 10975 H2 WAT 5324 98.106 25.439 112.520 1.00 0.00 H TER 10977 WAT 5324 ATOM 10977 O WAT 5325 113.538 71.389 143.889 1.00 0.00 O ATOM 10978 H1 WAT 5325 113.125 72.126 143.439 1.00 0.00 H ATOM 10979 H2 WAT 5325 113.575 70.696 143.230 1.00 0.00 H TER 10981 WAT 5325 ATOM 10981 O WAT 5326 79.005 70.475 109.097 1.00 0.00 O ATOM 10982 H1 WAT 5326 78.096 70.379 109.381 1.00 0.00 H ATOM 10983 H2 WAT 5326 79.150 71.421 109.074 1.00 0.00 H TER 10985 WAT 5326 ATOM 10985 O WAT 5327 14.715 12.096 157.437 1.00 0.00 O ATOM 10986 H1 WAT 5327 14.398 11.332 157.918 1.00 0.00 H ATOM 10987 H2 WAT 5327 14.037 12.759 157.565 1.00 0.00 H TER 10989 WAT 5327 ATOM 10989 O WAT 5328 92.759 94.255 19.444 1.00 0.00 O ATOM 10990 H1 WAT 5328 92.107 94.469 20.111 1.00 0.00 H ATOM 10991 H2 WAT 5328 93.161 95.096 19.224 1.00 0.00 H TER 10993 WAT 5328 ATOM 10993 O WAT 5329 19.375 82.665 84.367 1.00 0.00 O ATOM 10994 H1 WAT 5329 18.807 83.152 83.769 1.00 0.00 H ATOM 10995 H2 WAT 5329 20.186 82.536 83.875 1.00 0.00 H TER 10997 WAT 5329 ATOM 10997 O WAT 5330 63.102 82.220 109.976 1.00 0.00 O ATOM 10998 H1 WAT 5330 62.193 81.923 109.934 1.00 0.00 H ATOM 10999 H2 WAT 5330 63.439 81.847 110.790 1.00 0.00 H TER 11001 WAT 5330 ATOM 11001 O WAT 5331 68.195 112.509 89.113 1.00 0.00 O ATOM 11002 H1 WAT 5331 68.618 111.944 89.759 1.00 0.00 H ATOM 11003 H2 WAT 5331 67.641 113.092 89.632 1.00 0.00 H TER 11005 WAT 5331 ATOM 11005 O WAT 5332 110.346 116.549 94.515 1.00 0.00 O ATOM 11006 H1 WAT 5332 110.714 117.301 94.979 1.00 0.00 H ATOM 11007 H2 WAT 5332 111.072 116.213 93.990 1.00 0.00 H TER 11009 WAT 5332 ATOM 11009 O WAT 5333 118.624 91.195 109.871 1.00 0.00 O ATOM 11010 H1 WAT 5333 118.987 90.933 109.025 1.00 0.00 H ATOM 11011 H2 WAT 5333 119.382 91.492 110.375 1.00 0.00 H TER 11013 WAT 5333 ATOM 11013 O WAT 5334 130.231 15.752 3.546 1.00 0.00 O ATOM 11014 H1 WAT 5334 130.149 15.428 4.442 1.00 0.00 H ATOM 11015 H2 WAT 5334 129.567 16.438 3.477 1.00 0.00 H TER 11017 WAT 5334 ATOM 11017 O WAT 5335 68.862 86.829 146.526 1.00 0.00 O ATOM 11018 H1 WAT 5335 68.364 87.350 147.156 1.00 0.00 H ATOM 11019 H2 WAT 5335 68.209 86.522 145.898 1.00 0.00 H TER 11021 WAT 5335 ATOM 11021 O WAT 5336 128.198 46.719 79.433 1.00 0.00 O ATOM 11022 H1 WAT 5336 128.789 46.775 80.183 1.00 0.00 H ATOM 11023 H2 WAT 5336 128.600 47.278 78.768 1.00 0.00 H TER 11025 WAT 5336 ATOM 11025 O WAT 5337 91.260 7.626 154.134 1.00 0.00 O ATOM 11026 H1 WAT 5337 90.886 6.814 153.791 1.00 0.00 H ATOM 11027 H2 WAT 5337 90.589 7.968 154.724 1.00 0.00 H TER 11029 WAT 5337 ATOM 11029 O WAT 5338 7.978 144.011 7.167 1.00 0.00 O ATOM 11030 H1 WAT 5338 8.327 144.843 7.487 1.00 0.00 H ATOM 11031 H2 WAT 5338 8.630 143.361 7.429 1.00 0.00 H TER 11033 WAT 5338 ATOM 11033 O WAT 5339 32.933 121.938 110.481 1.00 0.00 O ATOM 11034 H1 WAT 5339 33.185 122.017 109.561 1.00 0.00 H ATOM 11035 H2 WAT 5339 33.376 122.668 110.914 1.00 0.00 H TER 11037 WAT 5339 ATOM 11037 O WAT 5340 67.230 94.385 157.156 1.00 0.00 O ATOM 11038 H1 WAT 5340 66.973 93.497 156.904 1.00 0.00 H ATOM 11039 H2 WAT 5340 67.634 94.749 156.368 1.00 0.00 H TER 11041 WAT 5340 ATOM 11041 O WAT 5341 128.246 58.279 104.625 1.00 0.00 O ATOM 11042 H1 WAT 5341 128.340 58.413 103.682 1.00 0.00 H ATOM 11043 H2 WAT 5341 128.520 57.373 104.768 1.00 0.00 H TER 11045 WAT 5341 ATOM 11045 O WAT 5342 14.969 118.725 144.909 1.00 0.00 O ATOM 11046 H1 WAT 5342 14.592 119.482 145.356 1.00 0.00 H ATOM 11047 H2 WAT 5342 14.308 118.474 144.264 1.00 0.00 H TER 11049 WAT 5342 ATOM 11049 O WAT 5343 73.058 122.115 106.581 1.00 0.00 O ATOM 11050 H1 WAT 5343 73.681 121.866 105.897 1.00 0.00 H ATOM 11051 H2 WAT 5343 72.612 122.886 106.230 1.00 0.00 H TER 11053 WAT 5343 ATOM 11053 O WAT 5344 105.837 47.833 13.062 1.00 0.00 O ATOM 11054 H1 WAT 5344 105.226 48.321 12.510 1.00 0.00 H ATOM 11055 H2 WAT 5344 106.176 47.142 12.493 1.00 0.00 H TER 11057 WAT 5344 ATOM 11057 O WAT 5345 33.130 130.609 74.431 1.00 0.00 O ATOM 11058 H1 WAT 5345 32.467 130.992 73.857 1.00 0.00 H ATOM 11059 H2 WAT 5345 33.961 130.791 73.992 1.00 0.00 H TER 11061 WAT 5345 ATOM 11061 O WAT 5346 141.371 59.979 61.557 1.00 0.00 O ATOM 11062 H1 WAT 5346 142.149 59.790 62.081 1.00 0.00 H ATOM 11063 H2 WAT 5346 141.503 59.486 60.747 1.00 0.00 H TER 11065 WAT 5346 ATOM 11065 O WAT 5347 52.980 24.284 104.876 1.00 0.00 O ATOM 11066 H1 WAT 5347 52.184 23.817 105.131 1.00 0.00 H ATOM 11067 H2 WAT 5347 52.693 24.892 104.195 1.00 0.00 H TER 11069 WAT 5347 ATOM 11069 O WAT 5348 20.399 74.707 90.798 1.00 0.00 O ATOM 11070 H1 WAT 5348 19.819 75.439 90.587 1.00 0.00 H ATOM 11071 H2 WAT 5348 20.268 74.560 91.734 1.00 0.00 H TER 11073 WAT 5348 ATOM 11073 O WAT 5349 46.479 42.938 150.070 1.00 0.00 O ATOM 11074 H1 WAT 5349 45.756 43.528 150.281 1.00 0.00 H ATOM 11075 H2 WAT 5349 47.132 43.106 150.749 1.00 0.00 H TER 11077 WAT 5349 ATOM 11077 O WAT 5350 100.249 114.988 14.122 1.00 0.00 O ATOM 11078 H1 WAT 5350 100.599 115.038 13.233 1.00 0.00 H ATOM 11079 H2 WAT 5350 100.407 115.857 14.491 1.00 0.00 H TER 11081 WAT 5350 ATOM 11081 O WAT 5351 74.801 69.891 3.080 1.00 0.00 O ATOM 11082 H1 WAT 5351 74.509 69.077 3.489 1.00 0.00 H ATOM 11083 H2 WAT 5351 74.240 69.986 2.310 1.00 0.00 H TER 11085 WAT 5351 ATOM 11085 O WAT 5352 115.818 104.442 122.311 1.00 0.00 O ATOM 11086 H1 WAT 5352 116.522 104.918 121.871 1.00 0.00 H ATOM 11087 H2 WAT 5352 115.016 104.773 121.906 1.00 0.00 H TER 11089 WAT 5352 ATOM 11089 O WAT 5353 13.529 11.468 2.867 1.00 0.00 O ATOM 11090 H1 WAT 5353 13.282 12.370 2.665 1.00 0.00 H ATOM 11091 H2 WAT 5353 12.696 11.004 2.950 1.00 0.00 H TER 11093 WAT 5353 ATOM 11093 O WAT 5354 57.154 24.523 126.668 1.00 0.00 O ATOM 11094 H1 WAT 5354 57.957 24.907 126.316 1.00 0.00 H ATOM 11095 H2 WAT 5354 56.698 25.256 127.080 1.00 0.00 H TER 11097 WAT 5354 ATOM 11097 O WAT 5355 40.733 100.542 3.458 1.00 0.00 O ATOM 11098 H1 WAT 5355 40.260 100.077 2.767 1.00 0.00 H ATOM 11099 H2 WAT 5355 40.719 101.459 3.182 1.00 0.00 H TER 11101 WAT 5355 ATOM 11101 O WAT 5356 125.266 132.068 128.481 1.00 0.00 O ATOM 11102 H1 WAT 5356 125.938 131.810 129.112 1.00 0.00 H ATOM 11103 H2 WAT 5356 125.111 132.995 128.662 1.00 0.00 H TER 11105 WAT 5356 ATOM 11105 O WAT 5357 11.127 1.239 11.041 1.00 0.00 O ATOM 11106 H1 WAT 5357 12.035 1.393 11.303 1.00 0.00 H ATOM 11107 H2 WAT 5357 10.694 0.944 11.843 1.00 0.00 H TER 11109 WAT 5357 ATOM 11109 O WAT 5358 8.207 124.555 127.728 1.00 0.00 O ATOM 11110 H1 WAT 5358 7.896 124.818 126.862 1.00 0.00 H ATOM 11111 H2 WAT 5358 8.251 123.600 127.687 1.00 0.00 H TER 11113 WAT 5358 ATOM 11113 O WAT 5359 85.562 103.211 112.396 1.00 0.00 O ATOM 11114 H1 WAT 5359 85.104 103.986 112.070 1.00 0.00 H ATOM 11115 H2 WAT 5359 86.255 103.054 111.754 1.00 0.00 H TER 11117 WAT 5359 ATOM 11117 O WAT 5360 117.612 43.154 101.413 1.00 0.00 O ATOM 11118 H1 WAT 5360 118.252 42.445 101.357 1.00 0.00 H ATOM 11119 H2 WAT 5360 116.764 42.719 101.318 1.00 0.00 H TER 11121 WAT 5360 ATOM 11121 O WAT 5361 68.554 10.950 56.766 1.00 0.00 O ATOM 11122 H1 WAT 5361 69.283 11.226 57.321 1.00 0.00 H ATOM 11123 H2 WAT 5361 67.951 11.693 56.775 1.00 0.00 H TER 11125 WAT 5361 ATOM 11125 O WAT 5362 61.494 124.090 77.070 1.00 0.00 O ATOM 11126 H1 WAT 5362 61.287 124.852 77.611 1.00 0.00 H ATOM 11127 H2 WAT 5362 61.207 123.340 77.592 1.00 0.00 H TER 11129 WAT 5362 ATOM 11129 O WAT 5363 140.708 94.629 14.341 1.00 0.00 O ATOM 11130 H1 WAT 5363 140.788 94.948 15.240 1.00 0.00 H ATOM 11131 H2 WAT 5363 139.777 94.435 14.238 1.00 0.00 H TER 11133 WAT 5363 ATOM 11133 O WAT 5364 11.686 6.214 72.027 1.00 0.00 O ATOM 11134 H1 WAT 5364 11.393 6.227 71.116 1.00 0.00 H ATOM 11135 H2 WAT 5364 12.327 5.505 72.063 1.00 0.00 H TER 11137 WAT 5364 ATOM 11137 O WAT 5365 126.187 119.898 9.655 1.00 0.00 O ATOM 11138 H1 WAT 5365 126.544 120.163 8.807 1.00 0.00 H ATOM 11139 H2 WAT 5365 125.448 119.330 9.437 1.00 0.00 H TER 11141 WAT 5365 ATOM 11141 O WAT 5366 10.186 37.218 114.441 1.00 0.00 O ATOM 11142 H1 WAT 5366 10.929 37.564 114.936 1.00 0.00 H ATOM 11143 H2 WAT 5366 9.595 37.965 114.344 1.00 0.00 H TER 11145 WAT 5366 ATOM 11145 O WAT 5367 141.997 109.883 99.919 1.00 0.00 O ATOM 11146 H1 WAT 5367 141.463 109.722 100.697 1.00 0.00 H ATOM 11147 H2 WAT 5367 141.564 109.386 99.225 1.00 0.00 H TER 11149 WAT 5367 ATOM 11149 O WAT 5368 114.034 51.517 121.456 1.00 0.00 O ATOM 11150 H1 WAT 5368 114.146 51.844 120.563 1.00 0.00 H ATOM 11151 H2 WAT 5368 114.684 51.996 121.970 1.00 0.00 H TER 11153 WAT 5368 ATOM 11153 O WAT 5369 2.334 74.846 98.850 1.00 0.00 O ATOM 11154 H1 WAT 5369 2.229 73.913 98.663 1.00 0.00 H ATOM 11155 H2 WAT 5369 2.462 74.886 99.798 1.00 0.00 H TER 11157 WAT 5369 ATOM 11157 O WAT 5370 58.712 10.312 73.086 1.00 0.00 O ATOM 11158 H1 WAT 5370 57.964 10.104 73.647 1.00 0.00 H ATOM 11159 H2 WAT 5370 58.866 11.246 73.228 1.00 0.00 H TER 11161 WAT 5370 ATOM 11161 O WAT 5371 60.922 115.687 104.358 1.00 0.00 O ATOM 11162 H1 WAT 5371 61.643 115.276 104.836 1.00 0.00 H ATOM 11163 H2 WAT 5371 60.143 115.472 104.871 1.00 0.00 H TER 11165 WAT 5371 ATOM 11165 O WAT 5372 52.097 57.123 123.728 1.00 0.00 O ATOM 11166 H1 WAT 5372 51.189 57.130 123.425 1.00 0.00 H ATOM 11167 H2 WAT 5372 52.493 57.890 123.315 1.00 0.00 H TER 11169 WAT 5372 ATOM 11169 O WAT 5373 51.893 80.516 12.975 1.00 0.00 O ATOM 11170 H1 WAT 5373 50.985 80.816 12.939 1.00 0.00 H ATOM 11171 H2 WAT 5373 52.066 80.386 13.908 1.00 0.00 H TER 11173 WAT 5373 ATOM 11173 O WAT 5374 115.888 43.774 18.187 1.00 0.00 O ATOM 11174 H1 WAT 5374 115.970 42.863 18.467 1.00 0.00 H ATOM 11175 H2 WAT 5374 116.483 44.256 18.760 1.00 0.00 H TER 11177 WAT 5374 ATOM 11177 O WAT 5375 144.311 87.492 79.376 1.00 0.00 O ATOM 11178 H1 WAT 5375 144.703 87.555 78.505 1.00 0.00 H ATOM 11179 H2 WAT 5375 145.057 87.510 79.976 1.00 0.00 H TER 11181 WAT 5375 ATOM 11181 O WAT 5376 25.426 101.775 64.716 1.00 0.00 O ATOM 11182 H1 WAT 5376 25.169 100.931 65.088 1.00 0.00 H ATOM 11183 H2 WAT 5376 24.738 101.976 64.081 1.00 0.00 H TER 11185 WAT 5376 ATOM 11185 O WAT 5377 20.123 25.415 74.575 1.00 0.00 O ATOM 11186 H1 WAT 5377 19.212 25.127 74.523 1.00 0.00 H ATOM 11187 H2 WAT 5377 20.523 25.093 73.767 1.00 0.00 H TER 11189 WAT 5377 ATOM 11189 O WAT 5378 98.422 30.722 91.696 1.00 0.00 O ATOM 11190 H1 WAT 5378 99.005 30.068 91.311 1.00 0.00 H ATOM 11191 H2 WAT 5378 97.816 30.214 92.236 1.00 0.00 H TER 11193 WAT 5378 ATOM 11193 O WAT 5379 76.935 137.465 147.200 1.00 0.00 O ATOM 11194 H1 WAT 5379 76.516 136.991 146.481 1.00 0.00 H ATOM 11195 H2 WAT 5379 77.678 136.915 147.449 1.00 0.00 H TER 11197 WAT 5379 ATOM 11197 O WAT 5380 46.325 110.853 69.252 1.00 0.00 O ATOM 11198 H1 WAT 5380 45.425 110.541 69.152 1.00 0.00 H ATOM 11199 H2 WAT 5380 46.240 111.682 69.724 1.00 0.00 H TER 11201 WAT 5380 ATOM 11201 O WAT 5381 112.004 107.769 77.389 1.00 0.00 O ATOM 11202 H1 WAT 5381 112.918 107.655 77.649 1.00 0.00 H ATOM 11203 H2 WAT 5381 111.994 108.595 76.906 1.00 0.00 H TER 11205 WAT 5381 ATOM 11205 O WAT 5382 47.745 113.958 146.549 1.00 0.00 O ATOM 11206 H1 WAT 5382 47.606 114.620 145.871 1.00 0.00 H ATOM 11207 H2 WAT 5382 47.727 113.125 146.078 1.00 0.00 H TER 11209 WAT 5382 ATOM 11209 O WAT 5383 18.286 125.005 59.496 1.00 0.00 O ATOM 11210 H1 WAT 5383 18.045 125.914 59.670 1.00 0.00 H ATOM 11211 H2 WAT 5383 17.996 124.848 58.598 1.00 0.00 H TER 11213 WAT 5383 ATOM 11213 O WAT 5384 72.734 71.199 121.516 1.00 0.00 O ATOM 11214 H1 WAT 5384 71.896 71.661 121.488 1.00 0.00 H ATOM 11215 H2 WAT 5384 72.686 70.572 120.794 1.00 0.00 H TER 11217 WAT 5384 ATOM 11217 O WAT 5385 96.765 90.720 13.886 1.00 0.00 O ATOM 11218 H1 WAT 5385 96.698 90.499 12.957 1.00 0.00 H ATOM 11219 H2 WAT 5385 97.589 90.324 14.168 1.00 0.00 H TER 11221 WAT 5385 ATOM 11221 O WAT 5386 41.545 121.160 79.354 1.00 0.00 O ATOM 11222 H1 WAT 5386 41.265 120.249 79.443 1.00 0.00 H ATOM 11223 H2 WAT 5386 40.784 121.610 78.988 1.00 0.00 H TER 11225 WAT 5386 ATOM 11225 O WAT 5387 79.699 127.908 9.012 1.00 0.00 O ATOM 11226 H1 WAT 5387 79.135 128.605 8.677 1.00 0.00 H ATOM 11227 H2 WAT 5387 79.240 127.578 9.784 1.00 0.00 H TER 11229 WAT 5387 ATOM 11229 O WAT 5388 11.382 111.344 101.895 1.00 0.00 O ATOM 11230 H1 WAT 5388 11.902 110.881 101.237 1.00 0.00 H ATOM 11231 H2 WAT 5388 11.982 111.994 102.259 1.00 0.00 H TER 11233 WAT 5388 ATOM 11233 O WAT 5389 32.720 8.614 85.311 1.00 0.00 O ATOM 11234 H1 WAT 5389 31.789 8.392 85.330 1.00 0.00 H ATOM 11235 H2 WAT 5389 33.169 7.770 85.353 1.00 0.00 H TER 11237 WAT 5389 ATOM 11237 O WAT 5390 89.288 115.830 123.477 1.00 0.00 O ATOM 11238 H1 WAT 5390 88.412 115.500 123.676 1.00 0.00 H ATOM 11239 H2 WAT 5390 89.879 115.156 123.812 1.00 0.00 H TER 11241 WAT 5390 ATOM 11241 O WAT 5391 38.235 82.317 125.320 1.00 0.00 O ATOM 11242 H1 WAT 5391 37.617 81.949 125.952 1.00 0.00 H ATOM 11243 H2 WAT 5391 38.032 83.253 125.305 1.00 0.00 H TER 11245 WAT 5391 ATOM 11245 O WAT 5392 134.641 22.687 8.038 1.00 0.00 O ATOM 11246 H1 WAT 5392 133.932 23.172 7.617 1.00 0.00 H ATOM 11247 H2 WAT 5392 134.676 23.038 8.928 1.00 0.00 H TER 11249 WAT 5392 ATOM 11249 O WAT 5393 89.547 128.755 149.855 1.00 0.00 O ATOM 11250 H1 WAT 5393 89.602 127.896 150.274 1.00 0.00 H ATOM 11251 H2 WAT 5393 88.786 128.692 149.278 1.00 0.00 H TER 11253 WAT 5393 ATOM 11253 O WAT 5394 141.461 112.494 124.708 1.00 0.00 O ATOM 11254 H1 WAT 5394 142.316 112.726 124.345 1.00 0.00 H ATOM 11255 H2 WAT 5394 141.372 113.049 125.483 1.00 0.00 H TER 11257 WAT 5394 ATOM 11257 O WAT 5395 95.139 3.299 85.090 1.00 0.00 O ATOM 11258 H1 WAT 5395 94.847 3.162 84.189 1.00 0.00 H ATOM 11259 H2 WAT 5395 94.388 3.042 85.626 1.00 0.00 H TER 11261 WAT 5395 ATOM 11261 O WAT 5396 52.866 90.341 14.898 1.00 0.00 O ATOM 11262 H1 WAT 5396 53.500 90.817 15.435 1.00 0.00 H ATOM 11263 H2 WAT 5396 53.214 90.400 14.008 1.00 0.00 H TER 11265 WAT 5396 ATOM 11265 O WAT 5397 100.693 59.394 119.368 1.00 0.00 O ATOM 11266 H1 WAT 5397 100.368 59.132 120.229 1.00 0.00 H ATOM 11267 H2 WAT 5397 99.974 59.193 118.769 1.00 0.00 H TER 11269 WAT 5397 ATOM 11269 O WAT 5398 134.041 19.862 153.162 1.00 0.00 O ATOM 11270 H1 WAT 5398 133.215 20.251 153.449 1.00 0.00 H ATOM 11271 H2 WAT 5398 133.802 18.987 152.858 1.00 0.00 H TER 11273 WAT 5398 ATOM 11273 O WAT 5399 102.843 13.452 71.898 1.00 0.00 O ATOM 11274 H1 WAT 5399 103.543 12.811 71.773 1.00 0.00 H ATOM 11275 H2 WAT 5399 103.256 14.166 72.384 1.00 0.00 H TER 11277 WAT 5399 ATOM 11277 O WAT 5400 15.170 8.595 118.861 1.00 0.00 O ATOM 11278 H1 WAT 5400 15.868 9.244 118.773 1.00 0.00 H ATOM 11279 H2 WAT 5400 15.063 8.485 119.806 1.00 0.00 H TER 11281 WAT 5400 ATOM 11281 O WAT 5401 84.497 61.930 86.589 1.00 0.00 O ATOM 11282 H1 WAT 5401 85.434 62.088 86.707 1.00 0.00 H ATOM 11283 H2 WAT 5401 84.179 61.713 87.466 1.00 0.00 H TER 11285 WAT 5401 ATOM 11285 O WAT 5402 62.457 83.543 139.016 1.00 0.00 O ATOM 11286 H1 WAT 5402 61.674 84.059 138.826 1.00 0.00 H ATOM 11287 H2 WAT 5402 62.975 84.099 139.597 1.00 0.00 H TER 11289 WAT 5402 ATOM 11289 O WAT 5403 113.548 96.833 66.492 1.00 0.00 O ATOM 11290 H1 WAT 5403 113.429 96.958 65.551 1.00 0.00 H ATOM 11291 H2 WAT 5403 112.659 96.761 66.839 1.00 0.00 H TER 11293 WAT 5403 ATOM 11293 O WAT 5404 31.471 54.848 80.183 1.00 0.00 O ATOM 11294 H1 WAT 5404 32.046 54.405 80.807 1.00 0.00 H ATOM 11295 H2 WAT 5404 31.556 55.777 80.397 1.00 0.00 H TER 11297 WAT 5404 ATOM 11297 O WAT 5405 43.699 133.289 117.027 1.00 0.00 O ATOM 11298 H1 WAT 5405 43.833 134.132 117.458 1.00 0.00 H ATOM 11299 H2 WAT 5405 42.952 133.433 116.446 1.00 0.00 H TER 11301 WAT 5405 ATOM 11301 O WAT 5406 39.646 7.728 126.974 1.00 0.00 O ATOM 11302 H1 WAT 5406 39.161 7.527 127.774 1.00 0.00 H ATOM 11303 H2 WAT 5406 39.047 7.492 126.265 1.00 0.00 H TER 11305 WAT 5406 ATOM 11305 O WAT 5407 74.592 39.592 88.629 1.00 0.00 O ATOM 11306 H1 WAT 5407 74.370 39.642 89.559 1.00 0.00 H ATOM 11307 H2 WAT 5407 75.306 40.220 88.520 1.00 0.00 H TER 11309 WAT 5407 ATOM 11309 O WAT 5408 106.527 123.285 116.330 1.00 0.00 O ATOM 11310 H1 WAT 5408 107.361 123.204 116.793 1.00 0.00 H ATOM 11311 H2 WAT 5408 105.864 123.193 117.014 1.00 0.00 H TER 11313 WAT 5408 ATOM 11313 O WAT 5409 43.719 50.596 63.513 1.00 0.00 O ATOM 11314 H1 WAT 5409 42.797 50.615 63.769 1.00 0.00 H ATOM 11315 H2 WAT 5409 43.797 49.822 62.956 1.00 0.00 H TER 11317 WAT 5409 ATOM 11317 O WAT 5410 118.760 36.595 111.816 1.00 0.00 O ATOM 11318 H1 WAT 5410 119.239 35.787 111.997 1.00 0.00 H ATOM 11319 H2 WAT 5410 118.366 36.453 110.955 1.00 0.00 H TER 11321 WAT 5410 ATOM 11321 O WAT 5411 109.517 124.349 86.791 1.00 0.00 O ATOM 11322 H1 WAT 5411 108.838 123.891 87.285 1.00 0.00 H ATOM 11323 H2 WAT 5411 110.219 124.494 87.426 1.00 0.00 H TER 11325 WAT 5411 ATOM 11325 O WAT 5412 80.628 17.070 86.551 1.00 0.00 O ATOM 11326 H1 WAT 5412 80.626 17.803 87.166 1.00 0.00 H ATOM 11327 H2 WAT 5412 80.109 17.379 85.809 1.00 0.00 H TER 11329 WAT 5412 ATOM 11329 O WAT 5413 52.343 58.142 78.765 1.00 0.00 O ATOM 11330 H1 WAT 5413 51.441 58.030 79.065 1.00 0.00 H ATOM 11331 H2 WAT 5413 52.314 58.912 78.198 1.00 0.00 H TER 11333 WAT 5413 ATOM 11333 O WAT 5414 75.222 71.818 18.416 1.00 0.00 O ATOM 11334 H1 WAT 5414 74.708 72.131 17.672 1.00 0.00 H ATOM 11335 H2 WAT 5414 74.626 71.880 19.163 1.00 0.00 H TER 11337 WAT 5414 ATOM 11337 O WAT 5415 112.720 57.148 85.535 1.00 0.00 O ATOM 11338 H1 WAT 5415 113.413 57.399 84.924 1.00 0.00 H ATOM 11339 H2 WAT 5415 112.711 57.849 86.187 1.00 0.00 H TER 11341 WAT 5415 ATOM 11341 O WAT 5416 125.785 139.379 20.838 1.00 0.00 O ATOM 11342 H1 WAT 5416 125.240 138.809 21.380 1.00 0.00 H ATOM 11343 H2 WAT 5416 126.451 139.715 21.439 1.00 0.00 H TER 11345 WAT 5416 ATOM 11345 O WAT 5417 43.293 115.496 5.699 1.00 0.00 O ATOM 11346 H1 WAT 5417 43.654 116.281 5.288 1.00 0.00 H ATOM 11347 H2 WAT 5417 42.351 115.662 5.745 1.00 0.00 H TER 11349 WAT 5417 ATOM 11349 O WAT 5418 119.511 77.562 80.855 1.00 0.00 O ATOM 11350 H1 WAT 5418 119.554 76.610 80.763 1.00 0.00 H ATOM 11351 H2 WAT 5418 119.830 77.731 81.741 1.00 0.00 H TER 11353 WAT 5418 ATOM 11353 O WAT 5419 40.244 88.276 84.300 1.00 0.00 O ATOM 11354 H1 WAT 5419 41.159 88.036 84.155 1.00 0.00 H ATOM 11355 H2 WAT 5419 39.751 87.486 84.074 1.00 0.00 H TER 11357 WAT 5419 ATOM 11357 O WAT 5420 37.710 44.350 12.731 1.00 0.00 O ATOM 11358 H1 WAT 5420 37.071 44.052 13.379 1.00 0.00 H ATOM 11359 H2 WAT 5420 37.536 45.286 12.637 1.00 0.00 H TER 11361 WAT 5420 ATOM 11361 O WAT 5421 44.019 132.408 98.988 1.00 0.00 O ATOM 11362 H1 WAT 5421 43.985 133.153 98.387 1.00 0.00 H ATOM 11363 H2 WAT 5421 43.405 131.774 98.617 1.00 0.00 H TER 11365 WAT 5421 ATOM 11365 O WAT 5422 81.073 102.729 126.471 1.00 0.00 O ATOM 11366 H1 WAT 5422 81.759 102.911 125.829 1.00 0.00 H ATOM 11367 H2 WAT 5422 80.806 103.592 126.788 1.00 0.00 H TER 11369 WAT 5422 ATOM 11369 O WAT 5423 132.513 30.064 63.381 1.00 0.00 O ATOM 11370 H1 WAT 5423 133.142 30.781 63.459 1.00 0.00 H ATOM 11371 H2 WAT 5423 132.346 29.793 64.284 1.00 0.00 H TER 11373 WAT 5423 ATOM 11373 O WAT 5424 80.573 103.336 88.400 1.00 0.00 O ATOM 11374 H1 WAT 5424 80.703 102.987 89.282 1.00 0.00 H ATOM 11375 H2 WAT 5424 81.452 103.570 88.103 1.00 0.00 H TER 11377 WAT 5424 ATOM 11377 O WAT 5425 86.306 38.943 67.914 1.00 0.00 O ATOM 11378 H1 WAT 5425 86.384 39.236 68.822 1.00 0.00 H ATOM 11379 H2 WAT 5425 87.083 38.401 67.771 1.00 0.00 H TER 11381 WAT 5425 ATOM 11381 O WAT 5426 80.340 126.186 148.863 1.00 0.00 O ATOM 11382 H1 WAT 5426 80.258 125.265 148.614 1.00 0.00 H ATOM 11383 H2 WAT 5426 80.471 126.167 149.811 1.00 0.00 H TER 11385 WAT 5426 ATOM 11385 O WAT 5427 96.108 120.095 118.027 1.00 0.00 O ATOM 11386 H1 WAT 5427 96.236 119.924 117.094 1.00 0.00 H ATOM 11387 H2 WAT 5427 96.766 119.553 118.462 1.00 0.00 H TER 11389 WAT 5427 ATOM 11389 O WAT 5428 55.985 140.187 109.431 1.00 0.00 O ATOM 11390 H1 WAT 5428 56.361 141.053 109.274 1.00 0.00 H ATOM 11391 H2 WAT 5428 56.220 139.984 110.337 1.00 0.00 H TER 11393 WAT 5428 ATOM 11393 O WAT 5429 106.012 123.925 21.250 1.00 0.00 O ATOM 11394 H1 WAT 5429 106.256 123.133 21.729 1.00 0.00 H ATOM 11395 H2 WAT 5429 105.089 124.061 21.467 1.00 0.00 H TER 11397 WAT 5429 ATOM 11397 O WAT 5430 49.042 85.697 144.446 1.00 0.00 O ATOM 11398 H1 WAT 5430 48.304 86.302 144.514 1.00 0.00 H ATOM 11399 H2 WAT 5430 49.274 85.705 143.518 1.00 0.00 H TER 11401 WAT 5430 ATOM 11401 O WAT 5431 119.704 65.840 79.667 1.00 0.00 O ATOM 11402 H1 WAT 5431 120.478 65.348 79.392 1.00 0.00 H ATOM 11403 H2 WAT 5431 120.042 66.496 80.277 1.00 0.00 H TER 11405 WAT 5431 ATOM 11405 O WAT 5432 10.169 17.006 149.723 1.00 0.00 O ATOM 11406 H1 WAT 5432 9.950 16.075 149.763 1.00 0.00 H ATOM 11407 H2 WAT 5432 9.353 17.453 149.948 1.00 0.00 H TER 11409 WAT 5432 ATOM 11409 O WAT 5433 47.125 81.896 156.929 1.00 0.00 O ATOM 11410 H1 WAT 5433 47.635 81.568 157.669 1.00 0.00 H ATOM 11411 H2 WAT 5433 46.358 82.304 157.329 1.00 0.00 H TER 11413 WAT 5433 ATOM 11413 O WAT 5434 65.922 65.509 133.290 1.00 0.00 O ATOM 11414 H1 WAT 5434 66.790 65.248 132.983 1.00 0.00 H ATOM 11415 H2 WAT 5434 65.997 66.450 133.449 1.00 0.00 H TER 11417 WAT 5434 ATOM 11417 O WAT 5435 99.464 130.060 91.661 1.00 0.00 O ATOM 11418 H1 WAT 5435 100.361 130.106 91.329 1.00 0.00 H ATOM 11419 H2 WAT 5435 99.262 130.956 91.930 1.00 0.00 H TER 11421 WAT 5435 ATOM 11421 O WAT 5436 96.948 73.638 146.569 1.00 0.00 O ATOM 11422 H1 WAT 5436 97.015 72.938 145.920 1.00 0.00 H ATOM 11423 H2 WAT 5436 97.774 73.598 147.052 1.00 0.00 H TER 11425 WAT 5436 ATOM 11425 O WAT 5437 124.509 77.154 5.298 1.00 0.00 O ATOM 11426 H1 WAT 5437 123.639 77.352 4.952 1.00 0.00 H ATOM 11427 H2 WAT 5437 124.356 76.476 5.957 1.00 0.00 H TER 11429 WAT 5437 ATOM 11429 O WAT 5438 39.364 23.456 91.742 1.00 0.00 O ATOM 11430 H1 WAT 5438 39.951 23.507 92.496 1.00 0.00 H ATOM 11431 H2 WAT 5438 38.930 22.608 91.833 1.00 0.00 H TER 11433 WAT 5438 ATOM 11433 O WAT 5439 83.864 60.747 12.062 1.00 0.00 O ATOM 11434 H1 WAT 5439 83.024 61.091 11.759 1.00 0.00 H ATOM 11435 H2 WAT 5439 83.630 60.035 12.658 1.00 0.00 H TER 11437 WAT 5439 ATOM 11437 O WAT 5440 1.131 50.248 103.406 1.00 0.00 O ATOM 11438 H1 WAT 5440 1.100 50.435 102.468 1.00 0.00 H ATOM 11439 H2 WAT 5440 0.213 50.195 103.670 1.00 0.00 H TER 11441 WAT 5440 ATOM 11441 O WAT 5441 96.408 75.390 133.537 1.00 0.00 O ATOM 11442 H1 WAT 5441 96.788 74.699 132.995 1.00 0.00 H ATOM 11443 H2 WAT 5441 95.605 75.640 133.078 1.00 0.00 H TER 11445 WAT 5441 ATOM 11445 O WAT 5442 41.792 122.378 132.854 1.00 0.00 O ATOM 11446 H1 WAT 5442 42.189 121.631 132.405 1.00 0.00 H ATOM 11447 H2 WAT 5442 40.876 122.128 132.972 1.00 0.00 H TER 11449 WAT 5442 ATOM 11449 O WAT 5443 128.446 132.543 140.547 1.00 0.00 O ATOM 11450 H1 WAT 5443 127.873 132.878 139.857 1.00 0.00 H ATOM 11451 H2 WAT 5443 127.861 132.062 141.132 1.00 0.00 H TER 11453 WAT 5443 ATOM 11453 O WAT 5444 133.988 3.364 65.656 1.00 0.00 O ATOM 11454 H1 WAT 5444 133.485 2.732 65.143 1.00 0.00 H ATOM 11455 H2 WAT 5444 134.472 2.830 66.286 1.00 0.00 H TER 11457 WAT 5444 ATOM 11457 O WAT 5445 141.804 22.838 125.981 1.00 0.00 O ATOM 11458 H1 WAT 5445 141.033 22.417 125.600 1.00 0.00 H ATOM 11459 H2 WAT 5445 141.554 23.018 126.888 1.00 0.00 H TER 11461 WAT 5445 ATOM 11461 O WAT 5446 135.416 136.094 12.642 1.00 0.00 O ATOM 11462 H1 WAT 5446 135.572 136.022 13.583 1.00 0.00 H ATOM 11463 H2 WAT 5446 135.306 137.032 12.488 1.00 0.00 H TER 11465 WAT 5446 ATOM 11465 O WAT 5447 123.981 9.119 9.587 1.00 0.00 O ATOM 11466 H1 WAT 5447 123.900 8.165 9.586 1.00 0.00 H ATOM 11467 H2 WAT 5447 123.263 9.421 9.031 1.00 0.00 H TER 11469 WAT 5447 ATOM 11469 O WAT 5448 135.688 80.331 69.160 1.00 0.00 O ATOM 11470 H1 WAT 5448 135.385 80.507 68.269 1.00 0.00 H ATOM 11471 H2 WAT 5448 135.612 81.173 69.609 1.00 0.00 H TER 11473 WAT 5448 ATOM 11473 O WAT 5449 145.249 110.491 141.927 1.00 0.00 O ATOM 11474 H1 WAT 5449 145.423 109.571 142.125 1.00 0.00 H ATOM 11475 H2 WAT 5449 144.615 110.764 142.590 1.00 0.00 H TER 11477 WAT 5449 ATOM 11477 O WAT 5450 93.045 17.989 131.086 1.00 0.00 O ATOM 11478 H1 WAT 5450 93.574 17.889 130.295 1.00 0.00 H ATOM 11479 H2 WAT 5450 92.512 17.195 131.120 1.00 0.00 H TER 11481 WAT 5450 ATOM 11481 O WAT 5451 94.020 0.201 142.782 1.00 0.00 O ATOM 11482 H1 WAT 5451 93.067 0.140 142.848 1.00 0.00 H ATOM 11483 H2 WAT 5451 94.192 0.270 141.843 1.00 0.00 H TER 11485 WAT 5451 ATOM 11485 O WAT 5452 91.266 137.142 96.952 1.00 0.00 O ATOM 11486 H1 WAT 5452 90.392 137.371 97.267 1.00 0.00 H ATOM 11487 H2 WAT 5452 91.755 136.920 97.744 1.00 0.00 H TER 11489 WAT 5452 ATOM 11489 O WAT 5453 38.763 80.072 157.910 1.00 0.00 O ATOM 11490 H1 WAT 5453 38.765 80.610 157.118 1.00 0.00 H ATOM 11491 H2 WAT 5453 38.016 80.393 158.416 1.00 0.00 H TER 11493 WAT 5453 ATOM 11493 O WAT 5454 51.156 13.297 156.756 1.00 0.00 O ATOM 11494 H1 WAT 5454 50.320 12.847 156.882 1.00 0.00 H ATOM 11495 H2 WAT 5454 50.981 14.203 157.007 1.00 0.00 H TER 11497 WAT 5454 ATOM 11497 O WAT 5455 120.633 54.155 13.940 1.00 0.00 O ATOM 11498 H1 WAT 5455 121.522 53.908 14.193 1.00 0.00 H ATOM 11499 H2 WAT 5455 120.687 54.308 12.996 1.00 0.00 H TER 11501 WAT 5455 ATOM 11501 O WAT 5456 143.905 7.377 10.607 1.00 0.00 O ATOM 11502 H1 WAT 5456 144.485 6.698 10.262 1.00 0.00 H ATOM 11503 H2 WAT 5456 143.261 6.898 11.129 1.00 0.00 H TER 11505 WAT 5456 ATOM 11505 O WAT 5457 71.521 32.199 150.379 1.00 0.00 O ATOM 11506 H1 WAT 5457 71.588 32.785 151.132 1.00 0.00 H ATOM 11507 H2 WAT 5457 71.570 31.320 150.755 1.00 0.00 H TER 11509 WAT 5457 ATOM 11509 O WAT 5458 89.664 84.110 68.797 1.00 0.00 O ATOM 11510 H1 WAT 5458 89.577 83.731 67.922 1.00 0.00 H ATOM 11511 H2 WAT 5458 88.876 83.826 69.261 1.00 0.00 H TER 11513 WAT 5458 ATOM 11513 O WAT 5459 68.799 136.289 8.214 1.00 0.00 O ATOM 11514 H1 WAT 5459 68.505 136.869 8.916 1.00 0.00 H ATOM 11515 H2 WAT 5459 69.734 136.473 8.127 1.00 0.00 H TER 11517 WAT 5459 ATOM 11517 O WAT 5460 137.092 113.946 116.157 1.00 0.00 O ATOM 11518 H1 WAT 5460 136.600 114.740 116.366 1.00 0.00 H ATOM 11519 H2 WAT 5460 136.732 113.280 116.742 1.00 0.00 H TER 11521 WAT 5460 ATOM 11521 O WAT 5461 49.556 34.510 141.161 1.00 0.00 O ATOM 11522 H1 WAT 5461 49.340 33.816 141.784 1.00 0.00 H ATOM 11523 H2 WAT 5461 50.513 34.519 141.134 1.00 0.00 H TER 11525 WAT 5461 ATOM 11525 O WAT 5462 86.891 95.900 88.184 1.00 0.00 O ATOM 11526 H1 WAT 5462 86.617 95.212 87.578 1.00 0.00 H ATOM 11527 H2 WAT 5462 86.396 96.672 87.909 1.00 0.00 H TER 11529 WAT 5462 ATOM 11529 O WAT 5463 138.469 102.216 1.896 1.00 0.00 O ATOM 11530 H1 WAT 5463 138.387 101.519 1.245 1.00 0.00 H ATOM 11531 H2 WAT 5463 138.992 102.889 1.461 1.00 0.00 H TER 11533 WAT 5463 ATOM 11533 O WAT 5464 43.870 64.850 70.457 1.00 0.00 O ATOM 11534 H1 WAT 5464 43.367 65.599 70.778 1.00 0.00 H ATOM 11535 H2 WAT 5464 44.501 65.231 69.846 1.00 0.00 H TER 11537 WAT 5464 ATOM 11537 O WAT 5465 93.018 100.799 69.290 1.00 0.00 O ATOM 11538 H1 WAT 5465 93.331 100.368 68.495 1.00 0.00 H ATOM 11539 H2 WAT 5465 92.137 101.100 69.069 1.00 0.00 H TER 11541 WAT 5465 ATOM 11541 O WAT 5466 73.173 91.928 146.876 1.00 0.00 O ATOM 11542 H1 WAT 5466 74.086 91.995 147.157 1.00 0.00 H ATOM 11543 H2 WAT 5466 73.128 91.097 146.403 1.00 0.00 H TER 11545 WAT 5466 ATOM 11545 O WAT 5467 122.808 60.598 151.993 1.00 0.00 O ATOM 11546 H1 WAT 5467 123.272 61.321 152.416 1.00 0.00 H ATOM 11547 H2 WAT 5467 122.138 61.024 151.458 1.00 0.00 H TER 11549 WAT 5467 ATOM 11549 O WAT 5468 46.647 90.540 68.586 1.00 0.00 O ATOM 11550 H1 WAT 5468 46.184 91.196 69.108 1.00 0.00 H ATOM 11551 H2 WAT 5468 47.196 90.075 69.217 1.00 0.00 H TER 11553 WAT 5468 ATOM 11553 O WAT 5469 143.483 129.144 14.901 1.00 0.00 O ATOM 11554 H1 WAT 5469 142.865 129.835 15.140 1.00 0.00 H ATOM 11555 H2 WAT 5469 144.167 129.596 14.405 1.00 0.00 H TER 11557 WAT 5469 ATOM 11557 O WAT 5470 99.859 1.505 144.438 1.00 0.00 O ATOM 11558 H1 WAT 5470 100.570 1.240 143.854 1.00 0.00 H ATOM 11559 H2 WAT 5470 99.413 2.210 143.968 1.00 0.00 H TER 11561 WAT 5470 ATOM 11561 O WAT 5471 17.816 100.554 113.409 1.00 0.00 O ATOM 11562 H1 WAT 5471 18.335 100.418 112.616 1.00 0.00 H ATOM 11563 H2 WAT 5471 17.963 101.473 113.636 1.00 0.00 H TER 11565 WAT 5471 ATOM 11565 O WAT 5472 132.830 80.315 140.028 1.00 0.00 O ATOM 11566 H1 WAT 5472 132.362 81.123 139.815 1.00 0.00 H ATOM 11567 H2 WAT 5472 133.442 80.568 140.719 1.00 0.00 H TER 11569 WAT 5472 ATOM 11569 O WAT 5473 33.423 19.430 97.998 1.00 0.00 O ATOM 11570 H1 WAT 5473 33.676 18.613 97.569 1.00 0.00 H ATOM 11571 H2 WAT 5473 33.960 20.100 97.573 1.00 0.00 H TER 11573 WAT 5473 ATOM 11573 O WAT 5474 51.605 145.438 16.874 1.00 0.00 O ATOM 11574 H1 WAT 5474 52.519 145.490 16.595 1.00 0.00 H ATOM 11575 H2 WAT 5474 51.574 144.678 17.455 1.00 0.00 H TER 11577 WAT 5474 ATOM 11577 O WAT 5475 19.404 102.117 10.363 1.00 0.00 O ATOM 11578 H1 WAT 5475 19.226 102.266 9.435 1.00 0.00 H ATOM 11579 H2 WAT 5475 18.538 102.024 10.761 1.00 0.00 H TER 11581 WAT 5475 ATOM 11581 O WAT 5476 115.344 83.600 13.076 1.00 0.00 O ATOM 11582 H1 WAT 5476 114.716 83.899 13.735 1.00 0.00 H ATOM 11583 H2 WAT 5476 115.947 83.035 13.559 1.00 0.00 H TER 11585 WAT 5476 ATOM 11585 O WAT 5477 142.836 22.975 130.640 1.00 0.00 O ATOM 11586 H1 WAT 5477 143.297 22.424 131.273 1.00 0.00 H ATOM 11587 H2 WAT 5477 143.450 23.683 130.447 1.00 0.00 H TER 11589 WAT 5477 ATOM 11589 O WAT 5478 23.306 121.440 15.858 1.00 0.00 O ATOM 11590 H1 WAT 5478 23.295 120.907 16.653 1.00 0.00 H ATOM 11591 H2 WAT 5478 24.140 121.226 15.438 1.00 0.00 H TER 11593 WAT 5478 ATOM 11593 O WAT 5479 88.469 126.160 122.260 1.00 0.00 O ATOM 11594 H1 WAT 5479 88.833 126.845 121.698 1.00 0.00 H ATOM 11595 H2 WAT 5479 89.175 125.955 122.874 1.00 0.00 H TER 11597 WAT 5479 ATOM 11597 O WAT 5480 35.192 87.681 143.377 1.00 0.00 O ATOM 11598 H1 WAT 5480 34.317 87.543 143.013 1.00 0.00 H ATOM 11599 H2 WAT 5480 35.080 88.394 144.006 1.00 0.00 H TER 11601 WAT 5480 ATOM 11601 O WAT 5481 70.011 68.506 98.796 1.00 0.00 O ATOM 11602 H1 WAT 5481 69.357 68.109 99.371 1.00 0.00 H ATOM 11603 H2 WAT 5481 69.555 69.240 98.385 1.00 0.00 H TER 11605 WAT 5481 ATOM 11605 O WAT 5482 130.745 32.186 13.240 1.00 0.00 O ATOM 11606 H1 WAT 5482 131.000 33.043 13.582 1.00 0.00 H ATOM 11607 H2 WAT 5482 130.379 31.726 13.995 1.00 0.00 H TER 11609 WAT 5482 ATOM 11609 O WAT 5483 29.818 108.963 60.603 1.00 0.00 O ATOM 11610 H1 WAT 5483 29.219 109.043 61.345 1.00 0.00 H ATOM 11611 H2 WAT 5483 30.426 109.696 60.706 1.00 0.00 H TER 11613 WAT 5483 ATOM 11613 O WAT 5484 28.830 40.610 19.231 1.00 0.00 O ATOM 11614 H1 WAT 5484 29.606 40.316 19.706 1.00 0.00 H ATOM 11615 H2 WAT 5484 29.110 40.653 18.316 1.00 0.00 H TER 11617 WAT 5484 ATOM 11617 O WAT 5485 51.250 6.093 134.585 1.00 0.00 O ATOM 11618 H1 WAT 5485 51.583 6.209 135.475 1.00 0.00 H ATOM 11619 H2 WAT 5485 50.468 5.552 134.691 1.00 0.00 H TER 11621 WAT 5485 ATOM 11621 O WAT 5486 91.993 83.501 70.508 1.00 0.00 O ATOM 11622 H1 WAT 5486 91.125 83.775 70.213 1.00 0.00 H ATOM 11623 H2 WAT 5486 92.314 84.240 71.026 1.00 0.00 H TER 11625 WAT 5486 ATOM 11625 O WAT 5487 117.285 64.839 124.566 1.00 0.00 O ATOM 11626 H1 WAT 5487 116.969 64.257 125.257 1.00 0.00 H ATOM 11627 H2 WAT 5487 116.646 65.552 124.543 1.00 0.00 H TER 11629 WAT 5487 ATOM 11629 O WAT 5488 74.128 9.461 133.965 1.00 0.00 O ATOM 11630 H1 WAT 5488 73.536 8.787 134.299 1.00 0.00 H ATOM 11631 H2 WAT 5488 74.084 9.369 133.014 1.00 0.00 H TER 11633 WAT 5488 ATOM 11633 O WAT 5489 119.841 75.142 90.771 1.00 0.00 O ATOM 11634 H1 WAT 5489 119.001 74.813 91.090 1.00 0.00 H ATOM 11635 H2 WAT 5489 119.949 74.731 89.913 1.00 0.00 H TER 11637 WAT 5489 ATOM 11637 O WAT 5490 2.066 63.079 102.585 1.00 0.00 O ATOM 11638 H1 WAT 5490 2.223 62.703 101.718 1.00 0.00 H ATOM 11639 H2 WAT 5490 2.872 62.904 103.071 1.00 0.00 H TER 11641 WAT 5490 ATOM 11641 O WAT 5491 20.499 63.301 138.147 1.00 0.00 O ATOM 11642 H1 WAT 5491 20.994 63.732 138.844 1.00 0.00 H ATOM 11643 H2 WAT 5491 19.663 63.073 138.554 1.00 0.00 H TER 11645 WAT 5491 ATOM 11645 O WAT 5492 133.986 118.578 101.714 1.00 0.00 O ATOM 11646 H1 WAT 5492 133.923 119.484 101.412 1.00 0.00 H ATOM 11647 H2 WAT 5492 134.926 118.420 101.802 1.00 0.00 H TER 11649 WAT 5492 ATOM 11649 O WAT 5493 81.303 75.105 23.630 1.00 0.00 O ATOM 11650 H1 WAT 5493 81.714 74.440 24.182 1.00 0.00 H ATOM 11651 H2 WAT 5493 82.017 75.440 23.088 1.00 0.00 H TER 11653 WAT 5493 ATOM 11653 O WAT 5494 31.066 142.289 112.194 1.00 0.00 O ATOM 11654 H1 WAT 5494 31.398 142.162 113.083 1.00 0.00 H ATOM 11655 H2 WAT 5494 30.289 142.837 112.303 1.00 0.00 H TER 11657 WAT 5494 ATOM 11657 O WAT 5495 76.619 6.126 135.908 1.00 0.00 O ATOM 11658 H1 WAT 5495 76.562 5.562 135.137 1.00 0.00 H ATOM 11659 H2 WAT 5495 76.500 5.532 136.649 1.00 0.00 H TER 11661 WAT 5495 ATOM 11661 O WAT 5496 53.782 108.635 110.778 1.00 0.00 O ATOM 11662 H1 WAT 5496 53.155 109.164 111.271 1.00 0.00 H ATOM 11663 H2 WAT 5496 54.546 109.203 110.676 1.00 0.00 H TER 11665 WAT 5496 ATOM 11665 O WAT 5497 52.334 21.851 73.877 1.00 0.00 O ATOM 11666 H1 WAT 5497 51.565 22.268 74.266 1.00 0.00 H ATOM 11667 H2 WAT 5497 51.979 21.290 73.187 1.00 0.00 H TER 11669 WAT 5497 ATOM 11669 O WAT 5498 131.649 134.145 81.632 1.00 0.00 O ATOM 11670 H1 WAT 5498 132.539 133.870 81.852 1.00 0.00 H ATOM 11671 H2 WAT 5498 131.114 133.827 82.360 1.00 0.00 H TER 11673 WAT 5498 ATOM 11673 O WAT 5499 65.599 60.831 156.169 1.00 0.00 O ATOM 11674 H1 WAT 5499 66.050 60.446 155.418 1.00 0.00 H ATOM 11675 H2 WAT 5499 64.920 61.384 155.782 1.00 0.00 H TER 11677 WAT 5499 ATOM 11677 O WAT 5500 25.365 90.695 76.272 1.00 0.00 O ATOM 11678 H1 WAT 5500 26.111 91.114 75.842 1.00 0.00 H ATOM 11679 H2 WAT 5500 25.753 89.988 76.788 1.00 0.00 H TER 11681 WAT 5500 ATOM 11681 O WAT 5501 50.984 116.161 143.912 1.00 0.00 O ATOM 11682 H1 WAT 5501 51.056 117.111 143.817 1.00 0.00 H ATOM 11683 H2 WAT 5501 51.889 115.856 143.961 1.00 0.00 H TER 11685 WAT 5501 ATOM 11685 O WAT 5502 29.294 68.348 94.938 1.00 0.00 O ATOM 11686 H1 WAT 5502 29.356 69.261 94.657 1.00 0.00 H ATOM 11687 H2 WAT 5502 28.380 68.240 95.201 1.00 0.00 H TER 11689 WAT 5502 ATOM 11689 O WAT 5503 50.208 16.436 134.023 1.00 0.00 O ATOM 11690 H1 WAT 5503 50.549 16.059 134.834 1.00 0.00 H ATOM 11691 H2 WAT 5503 49.822 17.271 134.290 1.00 0.00 H TER 11693 WAT 5503 ATOM 11693 O WAT 5504 141.131 60.587 93.545 1.00 0.00 O ATOM 11694 H1 WAT 5504 140.382 60.023 93.734 1.00 0.00 H ATOM 11695 H2 WAT 5504 141.075 61.286 94.197 1.00 0.00 H TER 11697 WAT 5504 ATOM 11697 O WAT 5505 91.451 44.487 136.892 1.00 0.00 O ATOM 11698 H1 WAT 5505 91.451 45.413 137.134 1.00 0.00 H ATOM 11699 H2 WAT 5505 92.002 44.067 137.553 1.00 0.00 H TER 11701 WAT 5505 ATOM 11701 O WAT 5506 29.150 138.966 96.692 1.00 0.00 O ATOM 11702 H1 WAT 5506 29.567 138.378 96.063 1.00 0.00 H ATOM 11703 H2 WAT 5506 28.578 138.398 97.208 1.00 0.00 H TER 11705 WAT 5506 ATOM 11705 O WAT 5507 70.134 110.108 22.224 1.00 0.00 O ATOM 11706 H1 WAT 5507 69.254 109.943 21.885 1.00 0.00 H ATOM 11707 H2 WAT 5507 70.715 109.667 21.605 1.00 0.00 H TER 11709 WAT 5507 ATOM 11709 O WAT 5508 87.113 35.678 142.510 1.00 0.00 O ATOM 11710 H1 WAT 5508 87.092 36.519 142.967 1.00 0.00 H ATOM 11711 H2 WAT 5508 86.445 35.758 141.829 1.00 0.00 H TER 11713 WAT 5508 ATOM 11713 O WAT 5509 95.751 5.507 70.344 1.00 0.00 O ATOM 11714 H1 WAT 5509 95.506 5.739 71.240 1.00 0.00 H ATOM 11715 H2 WAT 5509 96.327 6.217 70.062 1.00 0.00 H TER 11717 WAT 5509 ATOM 11717 O WAT 5510 109.117 132.062 75.984 1.00 0.00 O ATOM 11718 H1 WAT 5510 110.034 131.869 75.788 1.00 0.00 H ATOM 11719 H2 WAT 5510 108.621 131.506 75.384 1.00 0.00 H TER 11721 WAT 5510 ATOM 11721 O WAT 5511 55.657 140.435 0.745 1.00 0.00 O ATOM 11722 H1 WAT 5511 56.061 139.832 1.369 1.00 0.00 H ATOM 11723 H2 WAT 5511 56.392 140.919 0.370 1.00 0.00 H TER 11725 WAT 5511 ATOM 11725 O WAT 5512 94.458 144.010 123.561 1.00 0.00 O ATOM 11726 H1 WAT 5512 95.158 144.657 123.471 1.00 0.00 H ATOM 11727 H2 WAT 5512 94.232 144.029 124.491 1.00 0.00 H TER 11729 WAT 5512 ATOM 11729 O WAT 5513 69.294 100.887 123.908 1.00 0.00 O ATOM 11730 H1 WAT 5513 69.172 101.695 123.410 1.00 0.00 H ATOM 11731 H2 WAT 5513 69.345 101.173 124.820 1.00 0.00 H TER 11733 WAT 5513 ATOM 11733 O WAT 5514 69.215 114.299 62.160 1.00 0.00 O ATOM 11734 H1 WAT 5514 69.639 114.909 61.557 1.00 0.00 H ATOM 11735 H2 WAT 5514 69.839 114.200 62.878 1.00 0.00 H TER 11737 WAT 5514 ATOM 11737 O WAT 5515 60.981 101.823 141.120 1.00 0.00 O ATOM 11738 H1 WAT 5515 60.481 102.608 140.898 1.00 0.00 H ATOM 11739 H2 WAT 5515 61.690 101.801 140.477 1.00 0.00 H TER 11741 WAT 5515 ATOM 11741 O WAT 5516 54.424 90.589 95.103 1.00 0.00 O ATOM 11742 H1 WAT 5516 54.240 89.657 94.986 1.00 0.00 H ATOM 11743 H2 WAT 5516 54.939 90.830 94.333 1.00 0.00 H TER 11745 WAT 5516 ATOM 11745 O WAT 5517 16.353 34.804 66.134 1.00 0.00 O ATOM 11746 H1 WAT 5517 15.664 34.536 66.743 1.00 0.00 H ATOM 11747 H2 WAT 5517 16.960 34.063 66.120 1.00 0.00 H TER 11749 WAT 5517 ATOM 11749 O WAT 5518 7.670 49.003 93.197 1.00 0.00 O ATOM 11750 H1 WAT 5518 7.827 49.943 93.289 1.00 0.00 H ATOM 11751 H2 WAT 5518 6.758 48.939 92.911 1.00 0.00 H TER 11753 WAT 5518 ATOM 11753 O WAT 5519 144.739 25.633 100.212 1.00 0.00 O ATOM 11754 H1 WAT 5519 145.087 26.394 100.677 1.00 0.00 H ATOM 11755 H2 WAT 5519 144.486 25.024 100.905 1.00 0.00 H TER 11757 WAT 5519 ATOM 11757 O WAT 5520 118.999 22.877 115.792 1.00 0.00 O ATOM 11758 H1 WAT 5520 119.664 22.852 115.105 1.00 0.00 H ATOM 11759 H2 WAT 5520 119.260 23.608 116.352 1.00 0.00 H TER 11761 WAT 5520 ATOM 11761 O WAT 5521 83.655 87.047 109.224 1.00 0.00 O ATOM 11762 H1 WAT 5521 83.045 87.604 109.708 1.00 0.00 H ATOM 11763 H2 WAT 5521 83.131 86.293 108.956 1.00 0.00 H TER 11765 WAT 5521 ATOM 11765 O WAT 5522 66.170 14.810 129.048 1.00 0.00 O ATOM 11766 H1 WAT 5522 67.093 14.974 129.239 1.00 0.00 H ATOM 11767 H2 WAT 5522 65.836 15.652 128.737 1.00 0.00 H TER 11769 WAT 5522 ATOM 11769 O WAT 5523 125.229 132.043 121.725 1.00 0.00 O ATOM 11770 H1 WAT 5523 124.372 132.102 122.145 1.00 0.00 H ATOM 11771 H2 WAT 5523 125.070 132.302 120.817 1.00 0.00 H TER 11773 WAT 5523 ATOM 11773 O WAT 5524 18.737 89.741 85.144 1.00 0.00 O ATOM 11774 H1 WAT 5524 18.701 90.683 85.308 1.00 0.00 H ATOM 11775 H2 WAT 5524 17.834 89.499 84.937 1.00 0.00 H TER 11777 WAT 5524 ATOM 11777 O WAT 5525 85.692 30.586 2.667 1.00 0.00 O ATOM 11778 H1 WAT 5525 85.767 30.250 3.560 1.00 0.00 H ATOM 11779 H2 WAT 5525 84.897 31.119 2.677 1.00 0.00 H TER 11781 WAT 5525 ATOM 11781 O WAT 5526 50.315 57.373 138.592 1.00 0.00 O ATOM 11782 H1 WAT 5526 50.655 57.417 137.698 1.00 0.00 H ATOM 11783 H2 WAT 5526 50.941 57.877 139.112 1.00 0.00 H TER 11785 WAT 5526 ATOM 11785 O WAT 5527 121.304 35.458 118.064 1.00 0.00 O ATOM 11786 H1 WAT 5527 122.259 35.400 118.014 1.00 0.00 H ATOM 11787 H2 WAT 5527 121.015 34.552 118.177 1.00 0.00 H TER 11789 WAT 5527 ATOM 11789 O WAT 5528 83.854 97.599 79.655 1.00 0.00 O ATOM 11790 H1 WAT 5528 82.946 97.557 79.954 1.00 0.00 H ATOM 11791 H2 WAT 5528 84.314 96.957 80.196 1.00 0.00 H TER 11793 WAT 5528 ATOM 11793 O WAT 5529 132.910 130.604 5.777 1.00 0.00 O ATOM 11794 H1 WAT 5529 132.109 130.131 6.001 1.00 0.00 H ATOM 11795 H2 WAT 5529 132.813 130.814 4.849 1.00 0.00 H TER 11797 WAT 5529 ATOM 11797 O WAT 5530 60.184 16.088 158.309 1.00 0.00 O ATOM 11798 H1 WAT 5530 59.352 16.330 157.903 1.00 0.00 H ATOM 11799 H2 WAT 5530 60.521 15.380 157.760 1.00 0.00 H TER 11801 WAT 5530 ATOM 11801 O WAT 5531 93.064 52.802 22.734 1.00 0.00 O ATOM 11802 H1 WAT 5531 93.465 53.620 23.030 1.00 0.00 H ATOM 11803 H2 WAT 5531 93.552 52.117 23.192 1.00 0.00 H TER 11805 WAT 5531 ATOM 11805 O WAT 5532 119.495 134.130 7.591 1.00 0.00 O ATOM 11806 H1 WAT 5532 119.681 134.803 8.246 1.00 0.00 H ATOM 11807 H2 WAT 5532 119.756 133.310 8.010 1.00 0.00 H TER 11809 WAT 5532 ATOM 11809 O WAT 5533 102.170 98.842 154.126 1.00 0.00 O ATOM 11810 H1 WAT 5533 102.545 99.251 153.346 1.00 0.00 H ATOM 11811 H2 WAT 5533 101.246 98.718 153.911 1.00 0.00 H TER 11813 WAT 5533 ATOM 11813 O WAT 5534 124.570 77.894 12.508 1.00 0.00 O ATOM 11814 H1 WAT 5534 123.927 77.276 12.855 1.00 0.00 H ATOM 11815 H2 WAT 5534 124.074 78.699 12.363 1.00 0.00 H TER 11817 WAT 5534 ATOM 11817 O WAT 5535 116.214 77.243 1.046 1.00 0.00 O ATOM 11818 H1 WAT 5535 115.306 77.458 0.834 1.00 0.00 H ATOM 11819 H2 WAT 5535 116.149 76.529 1.680 1.00 0.00 H TER 11821 WAT 5535 ATOM 11821 O WAT 5536 119.677 109.619 120.873 1.00 0.00 O ATOM 11822 H1 WAT 5536 120.160 110.393 121.162 1.00 0.00 H ATOM 11823 H2 WAT 5536 118.769 109.797 121.120 1.00 0.00 H TER 11825 WAT 5536 ATOM 11825 O WAT 5537 59.134 1.141 108.243 1.00 0.00 O ATOM 11826 H1 WAT 5537 59.706 1.906 108.176 1.00 0.00 H ATOM 11827 H2 WAT 5537 59.212 0.709 107.392 1.00 0.00 H TER 11829 WAT 5537 ATOM 11829 O WAT 5538 127.481 109.008 153.142 1.00 0.00 O ATOM 11830 H1 WAT 5538 126.816 109.666 152.942 1.00 0.00 H ATOM 11831 H2 WAT 5538 127.070 108.175 152.910 1.00 0.00 H TER 11833 WAT 5538 ATOM 11833 O WAT 5539 53.055 13.699 67.627 1.00 0.00 O ATOM 11834 H1 WAT 5539 52.250 13.681 68.145 1.00 0.00 H ATOM 11835 H2 WAT 5539 52.960 14.467 67.064 1.00 0.00 H TER 11837 WAT 5539 ATOM 11837 O WAT 5540 64.427 20.112 87.806 1.00 0.00 O ATOM 11838 H1 WAT 5540 63.483 20.187 87.945 1.00 0.00 H ATOM 11839 H2 WAT 5540 64.511 19.715 86.939 1.00 0.00 H TER 11841 WAT 5540 ATOM 11841 O WAT 5541 137.244 18.716 128.227 1.00 0.00 O ATOM 11842 H1 WAT 5541 137.545 17.824 128.054 1.00 0.00 H ATOM 11843 H2 WAT 5541 137.245 19.139 127.368 1.00 0.00 H TER 11845 WAT 5541 ATOM 11845 O WAT 5542 126.446 122.059 146.616 1.00 0.00 O ATOM 11846 H1 WAT 5542 127.041 121.316 146.716 1.00 0.00 H ATOM 11847 H2 WAT 5542 125.970 121.878 145.806 1.00 0.00 H TER 11849 WAT 5542 ATOM 11849 O WAT 5543 1.400 63.547 58.713 1.00 0.00 O ATOM 11850 H1 WAT 5543 2.096 62.919 58.520 1.00 0.00 H ATOM 11851 H2 WAT 5543 0.657 63.007 58.980 1.00 0.00 H TER 11853 WAT 5543 ATOM 11853 O WAT 5544 4.806 78.166 113.388 1.00 0.00 O ATOM 11854 H1 WAT 5544 4.274 77.623 113.971 1.00 0.00 H ATOM 11855 H2 WAT 5544 4.484 79.056 113.530 1.00 0.00 H TER 11857 WAT 5544 ATOM 11857 O WAT 5545 95.204 64.871 113.656 1.00 0.00 O ATOM 11858 H1 WAT 5545 95.523 63.983 113.499 1.00 0.00 H ATOM 11859 H2 WAT 5545 94.409 64.753 114.177 1.00 0.00 H TER 11861 WAT 5545 ATOM 11861 O WAT 5546 61.565 68.975 124.345 1.00 0.00 O ATOM 11862 H1 WAT 5546 61.743 69.763 123.831 1.00 0.00 H ATOM 11863 H2 WAT 5546 60.621 69.000 124.502 1.00 0.00 H TER 11865 WAT 5546 ATOM 11865 O WAT 5547 112.484 12.093 11.217 1.00 0.00 O ATOM 11866 H1 WAT 5547 113.288 12.568 11.008 1.00 0.00 H ATOM 11867 H2 WAT 5547 112.750 11.449 11.874 1.00 0.00 H TER 11869 WAT 5547 ATOM 11869 O WAT 5548 93.984 45.201 62.583 1.00 0.00 O ATOM 11870 H1 WAT 5548 94.931 45.126 62.465 1.00 0.00 H ATOM 11871 H2 WAT 5548 93.632 45.206 61.693 1.00 0.00 H TER 11873 WAT 5548 ATOM 11873 O WAT 5549 25.970 126.981 3.907 1.00 0.00 O ATOM 11874 H1 WAT 5549 25.146 127.127 4.372 1.00 0.00 H ATOM 11875 H2 WAT 5549 25.770 126.290 3.276 1.00 0.00 H TER 11877 WAT 5549 ATOM 11877 O WAT 5550 105.098 45.952 81.598 1.00 0.00 O ATOM 11878 H1 WAT 5550 105.655 46.222 82.329 1.00 0.00 H ATOM 11879 H2 WAT 5550 104.262 45.727 82.006 1.00 0.00 H TER 11881 WAT 5550 ATOM 11881 O WAT 5551 45.809 77.947 120.085 1.00 0.00 O ATOM 11882 H1 WAT 5551 45.734 77.013 120.283 1.00 0.00 H ATOM 11883 H2 WAT 5551 46.737 78.145 120.212 1.00 0.00 H TER 11885 WAT 5551 ATOM 11885 O WAT 5552 112.878 63.305 102.297 1.00 0.00 O ATOM 11886 H1 WAT 5552 112.009 63.617 102.044 1.00 0.00 H ATOM 11887 H2 WAT 5552 112.923 62.414 101.949 1.00 0.00 H TER 11889 WAT 5552 ATOM 11889 O WAT 5553 63.321 3.275 123.435 1.00 0.00 O ATOM 11890 H1 WAT 5553 63.723 2.448 123.703 1.00 0.00 H ATOM 11891 H2 WAT 5553 62.984 3.651 124.248 1.00 0.00 H TER 11893 WAT 5553 ATOM 11893 O WAT 5554 117.671 22.402 95.429 1.00 0.00 O ATOM 11894 H1 WAT 5554 118.541 22.701 95.165 1.00 0.00 H ATOM 11895 H2 WAT 5554 117.551 21.574 94.964 1.00 0.00 H TER 11897 WAT 5554 ATOM 11897 O WAT 5555 77.299 145.446 138.037 1.00 0.00 O ATOM 11898 H1 WAT 5555 76.434 145.565 138.429 1.00 0.00 H ATOM 11899 H2 WAT 5555 77.902 145.859 138.656 1.00 0.00 H TER 11901 WAT 5555 ATOM 11901 O WAT 5556 13.372 25.634 11.040 1.00 0.00 O ATOM 11902 H1 WAT 5556 13.670 24.867 11.528 1.00 0.00 H ATOM 11903 H2 WAT 5556 12.417 25.588 11.082 1.00 0.00 H TER 11905 WAT 5556 ATOM 11905 O WAT 5557 34.827 11.149 112.991 1.00 0.00 O ATOM 11906 H1 WAT 5557 34.087 11.579 113.421 1.00 0.00 H ATOM 11907 H2 WAT 5557 34.729 11.375 112.066 1.00 0.00 H TER 11909 WAT 5557 ATOM 11909 O WAT 5558 7.732 35.740 133.653 1.00 0.00 O ATOM 11910 H1 WAT 5558 7.595 35.209 132.869 1.00 0.00 H ATOM 11911 H2 WAT 5558 8.094 36.563 133.324 1.00 0.00 H TER 11913 WAT 5558 ATOM 11913 O WAT 5559 85.560 14.876 73.940 1.00 0.00 O ATOM 11914 H1 WAT 5559 85.759 14.125 73.381 1.00 0.00 H ATOM 11915 H2 WAT 5559 85.300 15.566 73.330 1.00 0.00 H TER 11917 WAT 5559 ATOM 11917 O WAT 5560 94.905 42.906 105.782 1.00 0.00 O ATOM 11918 H1 WAT 5560 95.710 43.423 105.754 1.00 0.00 H ATOM 11919 H2 WAT 5560 95.135 42.082 105.352 1.00 0.00 H TER 11921 WAT 5560 ATOM 11921 O WAT 5561 55.439 50.569 153.094 1.00 0.00 O ATOM 11922 H1 WAT 5561 55.939 50.007 153.686 1.00 0.00 H ATOM 11923 H2 WAT 5561 54.572 50.628 153.495 1.00 0.00 H TER 11925 WAT 5561 ATOM 11925 O WAT 5562 127.773 12.571 88.261 1.00 0.00 O ATOM 11926 H1 WAT 5562 127.755 13.114 87.473 1.00 0.00 H ATOM 11927 H2 WAT 5562 127.082 11.924 88.121 1.00 0.00 H TER 11929 WAT 5562 ATOM 11929 O WAT 5563 134.987 9.515 150.095 1.00 0.00 O ATOM 11930 H1 WAT 5563 135.022 8.558 150.097 1.00 0.00 H ATOM 11931 H2 WAT 5563 135.677 9.779 149.486 1.00 0.00 H TER 11933 WAT 5563 ATOM 11933 O WAT 5564 86.653 36.279 146.005 1.00 0.00 O ATOM 11934 H1 WAT 5564 87.350 35.668 145.766 1.00 0.00 H ATOM 11935 H2 WAT 5564 86.666 36.941 145.314 1.00 0.00 H TER 11937 WAT 5564 ATOM 11937 O WAT 5565 0.283 18.102 95.266 1.00 0.00 O ATOM 11938 H1 WAT 5565 -0.215 18.911 95.380 1.00 0.00 H ATOM 11939 H2 WAT 5565 -0.193 17.620 94.590 1.00 0.00 H TER 11941 WAT 5565 ATOM 11941 O WAT 5566 49.147 138.889 81.193 1.00 0.00 O ATOM 11942 H1 WAT 5566 48.614 138.963 81.985 1.00 0.00 H ATOM 11943 H2 WAT 5566 48.699 138.228 80.664 1.00 0.00 H TER 11945 WAT 5566 ATOM 11945 O WAT 5567 130.333 45.695 106.248 1.00 0.00 O ATOM 11946 H1 WAT 5567 131.090 45.219 105.905 1.00 0.00 H ATOM 11947 H2 WAT 5567 129.581 45.290 105.816 1.00 0.00 H TER 11949 WAT 5567 ATOM 11949 O WAT 5568 110.835 59.376 76.104 1.00 0.00 O ATOM 11950 H1 WAT 5568 111.623 59.719 75.682 1.00 0.00 H ATOM 11951 H2 WAT 5568 111.154 58.683 76.681 1.00 0.00 H TER 11953 WAT 5568 ATOM 11953 O WAT 5569 15.100 49.422 127.181 1.00 0.00 O ATOM 11954 H1 WAT 5569 15.882 49.406 127.733 1.00 0.00 H ATOM 11955 H2 WAT 5569 14.429 49.829 127.729 1.00 0.00 H TER 11957 WAT 5569 ATOM 11957 O WAT 5570 61.040 144.492 126.901 1.00 0.00 O ATOM 11958 H1 WAT 5570 61.654 144.627 127.623 1.00 0.00 H ATOM 11959 H2 WAT 5570 60.185 144.419 127.325 1.00 0.00 H TER 11961 WAT 5570 ATOM 11961 O WAT 5571 20.805 35.139 114.630 1.00 0.00 O ATOM 11962 H1 WAT 5571 20.109 34.582 114.980 1.00 0.00 H ATOM 11963 H2 WAT 5571 20.465 36.029 114.715 1.00 0.00 H TER 11965 WAT 5571 ATOM 11965 O WAT 5572 87.035 45.368 108.920 1.00 0.00 O ATOM 11966 H1 WAT 5572 86.353 46.016 108.743 1.00 0.00 H ATOM 11967 H2 WAT 5572 86.597 44.698 109.445 1.00 0.00 H TER 11969 WAT 5572 ATOM 11969 O WAT 5573 59.690 57.143 17.556 1.00 0.00 O ATOM 11970 H1 WAT 5573 60.102 56.315 17.804 1.00 0.00 H ATOM 11971 H2 WAT 5573 59.865 57.226 16.618 1.00 0.00 H TER 11973 WAT 5573 ATOM 11973 O WAT 5574 38.506 74.391 4.706 1.00 0.00 O ATOM 11974 H1 WAT 5574 39.238 74.972 4.497 1.00 0.00 H ATOM 11975 H2 WAT 5574 38.916 73.628 5.113 1.00 0.00 H TER 11977 WAT 5574 ATOM 11977 O WAT 5575 124.893 117.838 77.447 1.00 0.00 O ATOM 11978 H1 WAT 5575 125.112 118.545 76.840 1.00 0.00 H ATOM 11979 H2 WAT 5575 125.724 117.388 77.601 1.00 0.00 H TER 11981 WAT 5575 ATOM 11981 O WAT 5576 42.156 58.653 72.240 1.00 0.00 O ATOM 11982 H1 WAT 5576 42.847 58.007 72.389 1.00 0.00 H ATOM 11983 H2 WAT 5576 42.625 59.466 72.052 1.00 0.00 H TER 11985 WAT 5576 ATOM 11985 O WAT 5577 144.842 86.220 66.032 1.00 0.00 O ATOM 11986 H1 WAT 5577 145.106 85.954 65.151 1.00 0.00 H ATOM 11987 H2 WAT 5577 145.624 86.625 66.405 1.00 0.00 H TER 11989 WAT 5577 ATOM 11989 O WAT 5578 102.211 18.912 55.594 1.00 0.00 O ATOM 11990 H1 WAT 5578 102.962 19.484 55.436 1.00 0.00 H ATOM 11991 H2 WAT 5578 102.270 18.689 56.523 1.00 0.00 H TER 11993 WAT 5578 ATOM 11993 O WAT 5579 78.559 119.583 104.335 1.00 0.00 O ATOM 11994 H1 WAT 5579 79.043 120.235 103.828 1.00 0.00 H ATOM 11995 H2 WAT 5579 78.938 118.745 104.071 1.00 0.00 H TER 11997 WAT 5579 ATOM 11997 O WAT 5580 50.301 52.510 96.962 1.00 0.00 O ATOM 11998 H1 WAT 5580 50.125 51.625 96.642 1.00 0.00 H ATOM 11999 H2 WAT 5580 50.905 52.385 97.694 1.00 0.00 H TER 12001 WAT 5580 ATOM 12001 O WAT 5581 63.210 124.221 153.003 1.00 0.00 O ATOM 12002 H1 WAT 5581 62.375 123.755 153.020 1.00 0.00 H ATOM 12003 H2 WAT 5581 63.331 124.528 153.902 1.00 0.00 H TER 12005 WAT 5581 ATOM 12005 O WAT 5582 129.424 110.498 135.059 1.00 0.00 O ATOM 12006 H1 WAT 5582 130.161 111.092 134.919 1.00 0.00 H ATOM 12007 H2 WAT 5582 128.654 111.067 135.059 1.00 0.00 H TER 12009 WAT 5582 ATOM 12009 O WAT 5583 82.428 47.366 63.272 1.00 0.00 O ATOM 12010 H1 WAT 5583 82.785 48.244 63.404 1.00 0.00 H ATOM 12011 H2 WAT 5583 82.928 47.012 62.537 1.00 0.00 H TER 12013 WAT 5583 ATOM 12013 O WAT 5584 144.922 104.593 66.781 1.00 0.00 O ATOM 12014 H1 WAT 5584 145.047 103.665 66.582 1.00 0.00 H ATOM 12015 H2 WAT 5584 145.434 104.738 67.577 1.00 0.00 H TER 12017 WAT 5584 ATOM 12017 O WAT 5585 53.260 0.386 71.013 1.00 0.00 O ATOM 12018 H1 WAT 5585 53.403 0.396 70.066 1.00 0.00 H ATOM 12019 H2 WAT 5585 53.125 -0.538 71.224 1.00 0.00 H TER 12021 WAT 5585 ATOM 12021 O WAT 5586 21.794 118.691 67.386 1.00 0.00 O ATOM 12022 H1 WAT 5586 22.589 118.538 67.896 1.00 0.00 H ATOM 12023 H2 WAT 5586 21.082 118.423 67.967 1.00 0.00 H TER 12025 WAT 5586 ATOM 12025 O WAT 5587 11.685 70.387 5.880 1.00 0.00 O ATOM 12026 H1 WAT 5587 10.825 70.019 5.680 1.00 0.00 H ATOM 12027 H2 WAT 5587 11.809 70.212 6.813 1.00 0.00 H TER 12029 WAT 5587 ATOM 12029 O WAT 5588 92.624 129.901 74.119 1.00 0.00 O ATOM 12030 H1 WAT 5588 93.476 129.470 74.053 1.00 0.00 H ATOM 12031 H2 WAT 5588 92.057 129.248 74.531 1.00 0.00 H TER 12033 WAT 5588 ATOM 12033 O WAT 5589 24.029 109.085 58.950 1.00 0.00 O ATOM 12034 H1 WAT 5589 23.216 108.603 59.100 1.00 0.00 H ATOM 12035 H2 WAT 5589 24.713 108.515 59.299 1.00 0.00 H TER 12037 WAT 5589 ATOM 12037 O WAT 5590 104.310 11.663 141.489 1.00 0.00 O ATOM 12038 H1 WAT 5590 103.450 11.981 141.212 1.00 0.00 H ATOM 12039 H2 WAT 5590 104.927 12.096 140.900 1.00 0.00 H TER 12041 WAT 5590 ATOM 12041 O WAT 5591 50.218 89.148 0.164 1.00 0.00 O ATOM 12042 H1 WAT 5591 51.001 88.851 -0.299 1.00 0.00 H ATOM 12043 H2 WAT 5591 50.367 90.082 0.312 1.00 0.00 H TER 12045 WAT 5591 ATOM 12045 O WAT 5592 124.250 77.155 129.144 1.00 0.00 O ATOM 12046 H1 WAT 5592 123.609 76.577 128.731 1.00 0.00 H ATOM 12047 H2 WAT 5592 124.238 76.904 130.068 1.00 0.00 H TER 12049 WAT 5592 ATOM 12049 O WAT 5593 92.078 135.019 143.802 1.00 0.00 O ATOM 12050 H1 WAT 5593 92.591 135.759 144.128 1.00 0.00 H ATOM 12051 H2 WAT 5593 92.300 134.967 142.872 1.00 0.00 H TER 12053 WAT 5593 ATOM 12053 O WAT 5594 62.723 119.767 62.660 1.00 0.00 O ATOM 12054 H1 WAT 5594 62.490 119.410 61.802 1.00 0.00 H ATOM 12055 H2 WAT 5594 62.861 118.996 63.210 1.00 0.00 H TER 12057 WAT 5594 ATOM 12057 O WAT 5595 58.230 36.606 80.353 1.00 0.00 O ATOM 12058 H1 WAT 5595 57.403 36.466 79.891 1.00 0.00 H ATOM 12059 H2 WAT 5595 58.226 37.537 80.573 1.00 0.00 H TER 12061 WAT 5595 ATOM 12061 O WAT 5596 142.787 70.649 12.704 1.00 0.00 O ATOM 12062 H1 WAT 5596 142.079 70.390 12.114 1.00 0.00 H ATOM 12063 H2 WAT 5596 143.377 71.166 12.155 1.00 0.00 H TER 12065 WAT 5596 ATOM 12065 O WAT 5597 83.563 82.290 142.698 1.00 0.00 O ATOM 12066 H1 WAT 5597 83.649 81.347 142.558 1.00 0.00 H ATOM 12067 H2 WAT 5597 84.287 82.512 143.284 1.00 0.00 H TER 12069 WAT 5597 ATOM 12069 O WAT 5598 133.424 103.439 86.709 1.00 0.00 O ATOM 12070 H1 WAT 5598 133.715 104.172 87.252 1.00 0.00 H ATOM 12071 H2 WAT 5598 133.583 102.664 87.249 1.00 0.00 H TER 12073 WAT 5598 ATOM 12073 O WAT 5599 127.765 130.109 71.021 1.00 0.00 O ATOM 12074 H1 WAT 5599 127.800 130.643 71.814 1.00 0.00 H ATOM 12075 H2 WAT 5599 128.324 130.571 70.396 1.00 0.00 H TER 12077 WAT 5599 ATOM 12077 O WAT 5600 53.453 61.572 23.098 1.00 0.00 O ATOM 12078 H1 WAT 5600 53.218 61.742 24.011 1.00 0.00 H ATOM 12079 H2 WAT 5600 54.409 61.625 23.083 1.00 0.00 H TER 12081 WAT 5600 ATOM 12081 O WAT 5601 135.347 76.768 6.012 1.00 0.00 O ATOM 12082 H1 WAT 5601 135.656 77.417 6.645 1.00 0.00 H ATOM 12083 H2 WAT 5601 136.138 76.486 5.554 1.00 0.00 H TER 12085 WAT 5601 ATOM 12085 O WAT 5602 33.034 111.690 98.189 1.00 0.00 O ATOM 12086 H1 WAT 5602 32.200 111.962 97.805 1.00 0.00 H ATOM 12087 H2 WAT 5602 32.811 110.935 98.735 1.00 0.00 H TER 12089 WAT 5602 ATOM 12089 O WAT 5603 66.376 55.282 83.143 1.00 0.00 O ATOM 12090 H1 WAT 5603 67.292 55.328 82.871 1.00 0.00 H ATOM 12091 H2 WAT 5603 66.173 56.166 83.451 1.00 0.00 H TER 12093 WAT 5603 ATOM 12093 O WAT 5604 117.954 52.901 15.519 1.00 0.00 O ATOM 12094 H1 WAT 5604 118.769 53.027 16.007 1.00 0.00 H ATOM 12095 H2 WAT 5604 117.330 53.491 15.941 1.00 0.00 H TER 12097 WAT 5604 ATOM 12097 O WAT 5605 50.065 56.483 132.257 1.00 0.00 O ATOM 12098 H1 WAT 5605 50.578 55.810 131.808 1.00 0.00 H ATOM 12099 H2 WAT 5605 49.739 57.044 131.553 1.00 0.00 H TER 12101 WAT 5605 ATOM 12101 O WAT 5606 92.256 134.365 8.623 1.00 0.00 O ATOM 12102 H1 WAT 5606 93.175 134.259 8.868 1.00 0.00 H ATOM 12103 H2 WAT 5606 92.033 135.253 8.904 1.00 0.00 H TER 12105 WAT 5606 ATOM 12105 O WAT 5607 117.747 88.733 15.212 1.00 0.00 O ATOM 12106 H1 WAT 5607 117.167 88.736 14.450 1.00 0.00 H ATOM 12107 H2 WAT 5607 118.629 88.711 14.841 1.00 0.00 H TER 12109 WAT 5607 ATOM 12109 O WAT 5608 131.648 144.678 0.093 1.00 0.00 O ATOM 12110 H1 WAT 5608 131.193 144.592 -0.745 1.00 0.00 H ATOM 12111 H2 WAT 5608 131.097 145.269 0.606 1.00 0.00 H TER 12113 WAT 5608 ATOM 12113 O WAT 5609 144.476 15.361 24.513 1.00 0.00 O ATOM 12114 H1 WAT 5609 143.549 15.183 24.670 1.00 0.00 H ATOM 12115 H2 WAT 5609 144.906 15.137 25.338 1.00 0.00 H TER 12117 WAT 5609 ATOM 12117 O WAT 5610 24.277 64.689 16.387 1.00 0.00 O ATOM 12118 H1 WAT 5610 24.898 65.316 16.758 1.00 0.00 H ATOM 12119 H2 WAT 5610 23.509 64.747 16.954 1.00 0.00 H TER 12121 WAT 5610 ATOM 12121 O WAT 5611 89.751 52.493 99.183 1.00 0.00 O ATOM 12122 H1 WAT 5611 89.352 51.788 99.694 1.00 0.00 H ATOM 12123 H2 WAT 5611 89.996 52.079 98.355 1.00 0.00 H TER 12125 WAT 5611 ATOM 12125 O WAT 5612 80.909 99.553 155.978 1.00 0.00 O ATOM 12126 H1 WAT 5612 80.711 99.310 156.882 1.00 0.00 H ATOM 12127 H2 WAT 5612 80.124 99.310 155.487 1.00 0.00 H TER 12129 WAT 5612 ATOM 12129 O WAT 5613 1.513 35.733 132.263 1.00 0.00 O ATOM 12130 H1 WAT 5613 2.287 36.157 131.892 1.00 0.00 H ATOM 12131 H2 WAT 5613 1.845 34.918 132.639 1.00 0.00 H TER 12133 WAT 5613 ATOM 12133 O WAT 5614 57.762 61.610 6.374 1.00 0.00 O ATOM 12134 H1 WAT 5614 57.718 60.673 6.183 1.00 0.00 H ATOM 12135 H2 WAT 5614 56.919 61.955 6.079 1.00 0.00 H TER 12137 WAT 5614 ATOM 12137 O WAT 5615 125.219 46.023 96.837 1.00 0.00 O ATOM 12138 H1 WAT 5615 125.536 46.767 97.349 1.00 0.00 H ATOM 12139 H2 WAT 5615 124.361 45.823 97.212 1.00 0.00 H TER 12141 WAT 5615 ATOM 12141 O WAT 5616 77.380 110.393 72.666 1.00 0.00 O ATOM 12142 H1 WAT 5616 78.073 111.029 72.489 1.00 0.00 H ATOM 12143 H2 WAT 5616 76.567 110.876 72.516 1.00 0.00 H TER 12145 WAT 5616 ATOM 12145 O WAT 5617 84.397 51.035 128.741 1.00 0.00 O ATOM 12146 H1 WAT 5617 83.582 50.900 128.259 1.00 0.00 H ATOM 12147 H2 WAT 5617 84.117 51.247 129.631 1.00 0.00 H TER 12149 WAT 5617 ATOM 12149 O WAT 5618 2.744 52.056 120.460 1.00 0.00 O ATOM 12150 H1 WAT 5618 3.009 51.532 121.215 1.00 0.00 H ATOM 12151 H2 WAT 5618 3.367 51.819 119.773 1.00 0.00 H TER 12153 WAT 5618 ATOM 12153 O WAT 5619 112.005 109.778 28.244 1.00 0.00 O ATOM 12154 H1 WAT 5619 112.344 110.634 28.506 1.00 0.00 H ATOM 12155 H2 WAT 5619 111.211 109.976 27.748 1.00 0.00 H TER 12157 WAT 5619 ATOM 12157 O WAT 5620 35.121 58.065 66.773 1.00 0.00 O ATOM 12158 H1 WAT 5620 34.909 58.698 66.088 1.00 0.00 H ATOM 12159 H2 WAT 5620 35.906 57.620 66.454 1.00 0.00 H TER 12161 WAT 5620 ATOM 12161 O WAT 5621 13.081 119.434 93.866 1.00 0.00 O ATOM 12162 H1 WAT 5621 12.322 119.876 94.246 1.00 0.00 H ATOM 12163 H2 WAT 5621 12.897 119.408 92.927 1.00 0.00 H TER 12165 WAT 5621 ATOM 12165 O WAT 5622 80.294 113.105 19.156 1.00 0.00 O ATOM 12166 H1 WAT 5622 80.277 113.814 18.513 1.00 0.00 H ATOM 12167 H2 WAT 5622 81.210 113.051 19.428 1.00 0.00 H TER 12169 WAT 5622 ATOM 12169 O WAT 5623 35.724 6.765 82.848 1.00 0.00 O ATOM 12170 H1 WAT 5623 35.297 7.473 82.366 1.00 0.00 H ATOM 12171 H2 WAT 5623 36.499 6.554 82.328 1.00 0.00 H TER 12173 WAT 5623 ATOM 12173 O WAT 5624 69.707 115.659 68.861 1.00 0.00 O ATOM 12174 H1 WAT 5624 69.989 114.770 68.646 1.00 0.00 H ATOM 12175 H2 WAT 5624 70.212 115.889 69.640 1.00 0.00 H TER 12177 WAT 5624 ATOM 12177 O WAT 5625 27.448 134.265 78.819 1.00 0.00 O ATOM 12178 H1 WAT 5625 28.039 133.742 79.360 1.00 0.00 H ATOM 12179 H2 WAT 5625 27.719 135.170 78.974 1.00 0.00 H TER 12181 WAT 5625 ATOM 12181 O WAT 5626 110.419 41.863 106.107 1.00 0.00 O ATOM 12182 H1 WAT 5626 109.796 41.877 106.833 1.00 0.00 H ATOM 12183 H2 WAT 5626 111.242 41.577 106.503 1.00 0.00 H TER 12185 WAT 5626 ATOM 12185 O WAT 5627 66.836 62.416 90.358 1.00 0.00 O ATOM 12186 H1 WAT 5627 66.863 62.836 91.218 1.00 0.00 H ATOM 12187 H2 WAT 5627 67.733 62.117 90.209 1.00 0.00 H TER 12189 WAT 5627 ATOM 12189 O WAT 5628 36.579 28.624 16.334 1.00 0.00 O ATOM 12190 H1 WAT 5628 37.450 28.539 16.721 1.00 0.00 H ATOM 12191 H2 WAT 5628 35.994 28.207 16.967 1.00 0.00 H TER 12193 WAT 5628 ATOM 12193 O WAT 5629 30.476 95.368 88.065 1.00 0.00 O ATOM 12194 H1 WAT 5629 29.567 95.562 88.292 1.00 0.00 H ATOM 12195 H2 WAT 5629 30.549 94.418 88.155 1.00 0.00 H TER 12197 WAT 5629 ATOM 12197 O WAT 5630 57.310 71.520 108.454 1.00 0.00 O ATOM 12198 H1 WAT 5630 58.141 71.712 108.019 1.00 0.00 H ATOM 12199 H2 WAT 5630 57.159 72.272 109.026 1.00 0.00 H TER 12201 WAT 5630 ATOM 12201 O WAT 5631 53.996 5.382 126.493 1.00 0.00 O ATOM 12202 H1 WAT 5631 54.663 4.718 126.319 1.00 0.00 H ATOM 12203 H2 WAT 5631 53.233 5.092 125.992 1.00 0.00 H TER 12205 WAT 5631 ATOM 12205 O WAT 5632 82.826 66.099 88.593 1.00 0.00 O ATOM 12206 H1 WAT 5632 82.551 65.870 89.481 1.00 0.00 H ATOM 12207 H2 WAT 5632 83.703 65.725 88.510 1.00 0.00 H TER 12209 WAT 5632 ATOM 12209 O WAT 5633 100.942 130.619 60.108 1.00 0.00 O ATOM 12210 H1 WAT 5633 101.083 129.698 60.330 1.00 0.00 H ATOM 12211 H2 WAT 5633 101.776 131.043 60.310 1.00 0.00 H TER 12213 WAT 5633 ATOM 12213 O WAT 5634 130.524 75.839 129.409 1.00 0.00 O ATOM 12214 H1 WAT 5634 129.926 76.019 130.134 1.00 0.00 H ATOM 12215 H2 WAT 5634 130.008 76.021 128.623 1.00 0.00 H TER 12217 WAT 5634 ATOM 12217 O WAT 5635 44.490 61.120 149.886 1.00 0.00 O ATOM 12218 H1 WAT 5635 44.892 61.961 150.104 1.00 0.00 H ATOM 12219 H2 WAT 5635 43.886 60.949 150.608 1.00 0.00 H TER 12221 WAT 5635 ATOM 12221 O WAT 5636 104.765 8.508 18.671 1.00 0.00 O ATOM 12222 H1 WAT 5636 105.684 8.258 18.570 1.00 0.00 H ATOM 12223 H2 WAT 5636 104.454 8.644 17.776 1.00 0.00 H TER 12225 WAT 5636 ATOM 12225 O WAT 5637 120.439 92.556 95.872 1.00 0.00 O ATOM 12226 H1 WAT 5637 119.852 93.267 96.127 1.00 0.00 H ATOM 12227 H2 WAT 5637 119.874 91.931 95.417 1.00 0.00 H TER 12229 WAT 5637 ATOM 12229 O WAT 5638 145.401 1.217 113.342 1.00 0.00 O ATOM 12230 H1 WAT 5638 145.739 1.460 114.204 1.00 0.00 H ATOM 12231 H2 WAT 5638 145.242 2.053 112.903 1.00 0.00 H TER 12233 WAT 5638 ATOM 12233 O WAT 5639 42.095 15.082 84.722 1.00 0.00 O ATOM 12234 H1 WAT 5639 42.999 14.923 84.996 1.00 0.00 H ATOM 12235 H2 WAT 5639 42.160 15.787 84.078 1.00 0.00 H TER 12237 WAT 5639 ATOM 12237 O WAT 5640 73.067 99.978 98.176 1.00 0.00 O ATOM 12238 H1 WAT 5640 73.844 100.488 97.947 1.00 0.00 H ATOM 12239 H2 WAT 5640 72.383 100.312 97.595 1.00 0.00 H TER 12241 WAT 5640 ATOM 12241 O WAT 5641 54.951 40.830 83.883 1.00 0.00 O ATOM 12242 H1 WAT 5641 54.242 41.373 84.226 1.00 0.00 H ATOM 12243 H2 WAT 5641 55.727 41.119 84.363 1.00 0.00 H TER 12245 WAT 5641 ATOM 12245 O WAT 5642 38.412 41.938 23.085 1.00 0.00 O ATOM 12246 H1 WAT 5642 39.302 41.721 23.362 1.00 0.00 H ATOM 12247 H2 WAT 5642 38.411 42.892 23.006 1.00 0.00 H TER 12249 WAT 5642 ATOM 12249 O WAT 5643 89.905 56.465 135.016 1.00 0.00 O ATOM 12250 H1 WAT 5643 90.375 57.273 135.218 1.00 0.00 H ATOM 12251 H2 WAT 5643 90.417 56.058 134.317 1.00 0.00 H TER 12253 WAT 5643 ATOM 12253 O WAT 5644 59.201 145.550 131.237 1.00 0.00 O ATOM 12254 H1 WAT 5644 58.668 145.960 131.918 1.00 0.00 H ATOM 12255 H2 WAT 5644 58.579 145.030 130.728 1.00 0.00 H TER 12257 WAT 5644 ATOM 12257 O WAT 5645 110.426 1.287 127.964 1.00 0.00 O ATOM 12258 H1 WAT 5645 110.592 2.228 128.031 1.00 0.00 H ATOM 12259 H2 WAT 5645 109.615 1.152 128.454 1.00 0.00 H TER 12261 WAT 5645 ATOM 12261 O WAT 5646 89.766 44.961 122.863 1.00 0.00 O ATOM 12262 H1 WAT 5646 89.796 45.856 122.524 1.00 0.00 H ATOM 12263 H2 WAT 5646 89.462 44.435 122.124 1.00 0.00 H TER 12265 WAT 5646 ATOM 12265 O WAT 5647 14.174 133.378 101.376 1.00 0.00 O ATOM 12266 H1 WAT 5647 14.135 132.623 100.789 1.00 0.00 H ATOM 12267 H2 WAT 5647 14.521 133.026 102.196 1.00 0.00 H TER 12269 WAT 5647 ATOM 12269 O WAT 5648 131.745 99.462 8.789 1.00 0.00 O ATOM 12270 H1 WAT 5648 132.341 100.207 8.867 1.00 0.00 H ATOM 12271 H2 WAT 5648 131.322 99.582 7.939 1.00 0.00 H TER 12273 WAT 5648 ATOM 12273 O WAT 5649 40.504 4.046 105.600 1.00 0.00 O ATOM 12274 H1 WAT 5649 39.935 3.929 104.839 1.00 0.00 H ATOM 12275 H2 WAT 5649 41.366 4.233 105.228 1.00 0.00 H TER 12277 WAT 5649 ATOM 12277 O WAT 5650 75.384 66.551 141.118 1.00 0.00 O ATOM 12278 H1 WAT 5650 75.017 65.668 141.155 1.00 0.00 H ATOM 12279 H2 WAT 5650 76.086 66.492 140.470 1.00 0.00 H TER 12281 WAT 5650 ATOM 12281 O WAT 5651 55.673 65.519 145.888 1.00 0.00 O ATOM 12282 H1 WAT 5651 55.436 66.178 146.541 1.00 0.00 H ATOM 12283 H2 WAT 5651 55.948 66.026 145.124 1.00 0.00 H TER 12285 WAT 5651 ATOM 12285 O WAT 5652 108.153 41.559 152.530 1.00 0.00 O ATOM 12286 H1 WAT 5652 107.251 41.880 152.505 1.00 0.00 H ATOM 12287 H2 WAT 5652 108.114 40.701 152.109 1.00 0.00 H TER 12289 WAT 5652 ATOM 12289 O WAT 5653 89.499 5.510 136.280 1.00 0.00 O ATOM 12290 H1 WAT 5653 89.544 5.079 137.134 1.00 0.00 H ATOM 12291 H2 WAT 5653 89.376 4.794 135.657 1.00 0.00 H TER 12293 WAT 5653 ATOM 12293 O WAT 5654 6.635 142.111 120.535 1.00 0.00 O ATOM 12294 H1 WAT 5654 7.199 141.555 119.999 1.00 0.00 H ATOM 12295 H2 WAT 5654 5.763 141.726 120.446 1.00 0.00 H TER 12297 WAT 5654 ATOM 12297 O WAT 5655 11.087 26.712 107.195 1.00 0.00 O ATOM 12298 H1 WAT 5655 11.235 27.445 107.793 1.00 0.00 H ATOM 12299 H2 WAT 5655 10.625 26.061 107.724 1.00 0.00 H TER 12301 WAT 5655 ATOM 12301 O WAT 5656 46.961 76.775 98.027 1.00 0.00 O ATOM 12302 H1 WAT 5656 46.394 77.503 97.774 1.00 0.00 H ATOM 12303 H2 WAT 5656 47.360 77.058 98.850 1.00 0.00 H TER 12305 WAT 5656 ATOM 12305 O WAT 5657 109.692 97.040 0.754 1.00 0.00 O ATOM 12306 H1 WAT 5657 109.275 97.608 1.402 1.00 0.00 H ATOM 12307 H2 WAT 5657 110.155 96.382 1.274 1.00 0.00 H TER 12309 WAT 5657 ATOM 12309 O WAT 5658 140.734 64.270 104.961 1.00 0.00 O ATOM 12310 H1 WAT 5658 140.876 63.872 105.820 1.00 0.00 H ATOM 12311 H2 WAT 5658 141.564 64.148 104.500 1.00 0.00 H TER 12313 WAT 5658 ATOM 12313 O WAT 5659 66.558 142.903 59.266 1.00 0.00 O ATOM 12314 H1 WAT 5659 67.277 143.509 59.088 1.00 0.00 H ATOM 12315 H2 WAT 5659 66.340 143.053 60.186 1.00 0.00 H TER 12317 WAT 5659 ATOM 12317 O WAT 5660 80.726 109.494 152.787 1.00 0.00 O ATOM 12318 H1 WAT 5660 80.400 110.132 153.422 1.00 0.00 H ATOM 12319 H2 WAT 5660 81.403 109.965 152.301 1.00 0.00 H TER 12321 WAT 5660 ATOM 12321 O WAT 5661 71.767 5.156 28.038 1.00 0.00 O ATOM 12322 H1 WAT 5661 71.251 4.350 28.038 1.00 0.00 H ATOM 12323 H2 WAT 5661 71.128 5.850 28.201 1.00 0.00 H TER 12325 WAT 5661 ATOM 12325 O WAT 5662 121.314 81.404 118.945 1.00 0.00 O ATOM 12326 H1 WAT 5662 121.444 80.669 119.544 1.00 0.00 H ATOM 12327 H2 WAT 5662 122.113 81.925 119.027 1.00 0.00 H TER 12329 WAT 5662 ATOM 12329 O WAT 5663 42.558 11.662 108.280 1.00 0.00 O ATOM 12330 H1 WAT 5663 41.728 11.208 108.427 1.00 0.00 H ATOM 12331 H2 WAT 5663 42.971 11.180 107.563 1.00 0.00 H TER 12333 WAT 5663 ATOM 12333 O WAT 5664 2.182 114.566 110.099 1.00 0.00 O ATOM 12334 H1 WAT 5664 2.913 114.009 110.368 1.00 0.00 H ATOM 12335 H2 WAT 5664 1.404 114.119 110.433 1.00 0.00 H TER 12337 WAT 5664 ATOM 12337 O WAT 5665 63.380 107.906 85.157 1.00 0.00 O ATOM 12338 H1 WAT 5665 63.921 107.227 84.755 1.00 0.00 H ATOM 12339 H2 WAT 5665 63.992 108.419 85.685 1.00 0.00 H TER 12341 WAT 5665 ATOM 12341 O WAT 5666 10.836 43.322 119.904 1.00 0.00 O ATOM 12342 H1 WAT 5666 10.906 44.269 119.783 1.00 0.00 H ATOM 12343 H2 WAT 5666 10.771 43.206 120.852 1.00 0.00 H TER 12345 WAT 5666 ATOM 12345 O WAT 5667 6.546 130.427 138.081 1.00 0.00 O ATOM 12346 H1 WAT 5667 6.790 131.352 138.050 1.00 0.00 H ATOM 12347 H2 WAT 5667 7.239 129.980 137.594 1.00 0.00 H TER 12349 WAT 5667 ATOM 12349 O WAT 5668 115.531 10.858 59.814 1.00 0.00 O ATOM 12350 H1 WAT 5668 115.402 11.480 60.530 1.00 0.00 H ATOM 12351 H2 WAT 5668 115.470 11.390 59.020 1.00 0.00 H TER 12353 WAT 5668 ATOM 12353 O WAT 5669 103.419 22.821 64.666 1.00 0.00 O ATOM 12354 H1 WAT 5669 103.128 23.712 64.470 1.00 0.00 H ATOM 12355 H2 WAT 5669 103.411 22.375 63.819 1.00 0.00 H TER 12357 WAT 5669 ATOM 12357 O WAT 5670 141.611 112.009 108.653 1.00 0.00 O ATOM 12358 H1 WAT 5670 141.686 112.948 108.480 1.00 0.00 H ATOM 12359 H2 WAT 5670 141.090 111.673 107.923 1.00 0.00 H TER 12361 WAT 5670 ATOM 12361 O WAT 5671 2.135 111.056 151.019 1.00 0.00 O ATOM 12362 H1 WAT 5671 2.477 110.399 151.626 1.00 0.00 H ATOM 12363 H2 WAT 5671 2.333 111.894 151.438 1.00 0.00 H TER 12365 WAT 5671 ATOM 12365 O WAT 5672 65.300 34.411 61.949 1.00 0.00 O ATOM 12366 H1 WAT 5672 65.985 34.814 61.416 1.00 0.00 H ATOM 12367 H2 WAT 5672 64.687 34.042 61.313 1.00 0.00 H TER 12369 WAT 5672 ATOM 12369 O WAT 5673 72.839 23.843 49.553 1.00 0.00 O ATOM 12370 H1 WAT 5673 72.259 24.503 49.931 1.00 0.00 H ATOM 12371 H2 WAT 5673 72.508 23.011 49.892 1.00 0.00 H TER 12373 WAT 5673 ATOM 12373 O WAT 5674 116.821 132.370 132.825 1.00 0.00 O ATOM 12374 H1 WAT 5674 116.053 131.834 133.021 1.00 0.00 H ATOM 12375 H2 WAT 5674 117.433 131.767 132.403 1.00 0.00 H TER 12377 WAT 5674 ATOM 12377 O WAT 5675 128.915 47.569 122.001 1.00 0.00 O ATOM 12378 H1 WAT 5675 128.444 48.350 121.709 1.00 0.00 H ATOM 12379 H2 WAT 5675 128.403 47.244 122.742 1.00 0.00 H TER 12381 WAT 5675 ATOM 12381 O WAT 5676 92.127 76.345 157.083 1.00 0.00 O ATOM 12382 H1 WAT 5676 91.984 75.400 157.025 1.00 0.00 H ATOM 12383 H2 WAT 5676 91.536 76.717 156.428 1.00 0.00 H TER 12385 WAT 5676 ATOM 12385 O WAT 5677 61.594 40.324 76.842 1.00 0.00 O ATOM 12386 H1 WAT 5677 61.466 39.470 77.254 1.00 0.00 H ATOM 12387 H2 WAT 5677 61.958 40.122 75.980 1.00 0.00 H TER 12389 WAT 5677 ATOM 12389 O WAT 5678 48.378 117.222 155.290 1.00 0.00 O ATOM 12390 H1 WAT 5678 48.881 116.415 155.402 1.00 0.00 H ATOM 12391 H2 WAT 5678 48.619 117.534 154.418 1.00 0.00 H TER 12393 WAT 5678 ATOM 12393 O WAT 5679 61.135 118.764 68.269 1.00 0.00 O ATOM 12394 H1 WAT 5679 61.458 119.647 68.447 1.00 0.00 H ATOM 12395 H2 WAT 5679 60.859 118.434 69.125 1.00 0.00 H TER 12397 WAT 5679 ATOM 12397 O WAT 5680 3.059 57.121 152.339 1.00 0.00 O ATOM 12398 H1 WAT 5680 2.333 57.626 152.704 1.00 0.00 H ATOM 12399 H2 WAT 5680 2.675 56.650 151.599 1.00 0.00 H TER 12401 WAT 5680 ATOM 12401 O WAT 5681 142.919 110.095 112.255 1.00 0.00 O ATOM 12402 H1 WAT 5681 143.463 110.875 112.148 1.00 0.00 H ATOM 12403 H2 WAT 5681 142.426 110.255 113.059 1.00 0.00 H TER 12405 WAT 5681 ATOM 12405 O WAT 5682 63.450 9.064 137.792 1.00 0.00 O ATOM 12406 H1 WAT 5682 63.307 8.974 136.850 1.00 0.00 H ATOM 12407 H2 WAT 5682 62.883 8.400 138.185 1.00 0.00 H TER 12409 WAT 5682 ATOM 12409 O WAT 5683 69.596 77.846 145.861 1.00 0.00 O ATOM 12410 H1 WAT 5683 69.320 78.737 145.646 1.00 0.00 H ATOM 12411 H2 WAT 5683 68.922 77.524 146.459 1.00 0.00 H TER 12413 WAT 5683 ATOM 12413 O WAT 5684 67.060 77.503 113.694 1.00 0.00 O ATOM 12414 H1 WAT 5684 68.010 77.426 113.785 1.00 0.00 H ATOM 12415 H2 WAT 5684 66.928 77.792 112.791 1.00 0.00 H TER 12417 WAT 5684 ATOM 12417 O WAT 5685 96.642 58.192 149.735 1.00 0.00 O ATOM 12418 H1 WAT 5685 95.773 58.093 149.346 1.00 0.00 H ATOM 12419 H2 WAT 5685 97.181 57.539 149.288 1.00 0.00 H TER 12421 WAT 5685 ATOM 12421 O WAT 5686 56.826 73.847 80.500 1.00 0.00 O ATOM 12422 H1 WAT 5686 56.140 73.534 81.090 1.00 0.00 H ATOM 12423 H2 WAT 5686 56.705 73.335 79.701 1.00 0.00 H TER 12425 WAT 5686 ATOM 12425 O WAT 5687 141.172 30.599 136.045 1.00 0.00 O ATOM 12426 H1 WAT 5687 140.479 30.377 135.423 1.00 0.00 H ATOM 12427 H2 WAT 5687 141.224 31.555 136.014 1.00 0.00 H TER 12429 WAT 5687 ATOM 12429 O WAT 5688 126.435 106.907 114.927 1.00 0.00 O ATOM 12430 H1 WAT 5688 126.884 107.063 114.096 1.00 0.00 H ATOM 12431 H2 WAT 5688 125.752 106.271 114.715 1.00 0.00 H TER 12433 WAT 5688 ATOM 12433 O WAT 5689 16.373 25.515 91.211 1.00 0.00 O ATOM 12434 H1 WAT 5689 16.661 26.424 91.126 1.00 0.00 H ATOM 12435 H2 WAT 5689 16.870 25.044 90.542 1.00 0.00 H TER 12437 WAT 5689 ATOM 12437 O WAT 5690 27.326 27.762 114.510 1.00 0.00 O ATOM 12438 H1 WAT 5690 26.543 27.656 113.969 1.00 0.00 H ATOM 12439 H2 WAT 5690 27.823 28.457 114.077 1.00 0.00 H TER 12441 WAT 5690 ATOM 12441 O WAT 5691 13.228 67.292 90.787 1.00 0.00 O ATOM 12442 H1 WAT 5691 14.125 67.360 90.460 1.00 0.00 H ATOM 12443 H2 WAT 5691 13.097 68.095 91.292 1.00 0.00 H TER 12445 WAT 5691 ATOM 12445 O WAT 5692 48.292 140.087 13.482 1.00 0.00 O ATOM 12446 H1 WAT 5692 48.425 139.259 13.944 1.00 0.00 H ATOM 12447 H2 WAT 5692 47.970 139.829 12.618 1.00 0.00 H TER 12449 WAT 5692 ATOM 12449 O WAT 5693 66.135 98.669 94.540 1.00 0.00 O ATOM 12450 H1 WAT 5693 66.807 99.132 95.041 1.00 0.00 H ATOM 12451 H2 WAT 5693 66.275 97.745 94.749 1.00 0.00 H TER 12453 WAT 5693 ATOM 12453 O WAT 5694 99.437 145.681 137.478 1.00 0.00 O ATOM 12454 H1 WAT 5694 98.996 145.191 138.173 1.00 0.00 H ATOM 12455 H2 WAT 5694 98.726 146.053 136.958 1.00 0.00 H TER 12457 WAT 5694 ATOM 12457 O WAT 5695 55.772 127.026 1.007 1.00 0.00 O ATOM 12458 H1 WAT 5695 55.957 126.347 0.359 1.00 0.00 H ATOM 12459 H2 WAT 5695 55.758 126.561 1.844 1.00 0.00 H TER 12461 WAT 5695 ATOM 12461 O WAT 5696 80.281 96.443 61.989 1.00 0.00 O ATOM 12462 H1 WAT 5696 80.855 96.608 61.242 1.00 0.00 H ATOM 12463 H2 WAT 5696 79.531 95.977 61.618 1.00 0.00 H TER 12465 WAT 5696 ATOM 12465 O WAT 5697 61.764 87.804 15.188 1.00 0.00 O ATOM 12466 H1 WAT 5697 60.920 88.211 15.384 1.00 0.00 H ATOM 12467 H2 WAT 5697 62.392 88.282 15.730 1.00 0.00 H TER 12469 WAT 5697 ATOM 12469 O WAT 5698 68.044 129.276 154.419 1.00 0.00 O ATOM 12470 H1 WAT 5698 68.302 128.854 155.239 1.00 0.00 H ATOM 12471 H2 WAT 5698 67.320 129.852 154.664 1.00 0.00 H TER 12473 WAT 5698 ATOM 12473 O WAT 5699 114.765 22.587 83.024 1.00 0.00 O ATOM 12474 H1 WAT 5699 114.858 21.713 82.645 1.00 0.00 H ATOM 12475 H2 WAT 5699 115.393 22.603 83.746 1.00 0.00 H TER 12477 WAT 5699 ATOM 12477 O WAT 5700 98.513 62.282 104.875 1.00 0.00 O ATOM 12478 H1 WAT 5700 98.914 61.894 104.098 1.00 0.00 H ATOM 12479 H2 WAT 5700 98.221 63.147 104.588 1.00 0.00 H TER 12481 WAT 5700 ATOM 12481 O WAT 5701 78.634 64.124 141.245 1.00 0.00 O ATOM 12482 H1 WAT 5701 79.544 64.419 141.243 1.00 0.00 H ATOM 12483 H2 WAT 5701 78.648 63.300 140.759 1.00 0.00 H TER 12485 WAT 5701 ATOM 12485 O WAT 5702 80.160 64.381 123.062 1.00 0.00 O ATOM 12486 H1 WAT 5702 80.504 64.045 123.890 1.00 0.00 H ATOM 12487 H2 WAT 5702 80.425 63.731 122.411 1.00 0.00 H TER 12489 WAT 5702 ATOM 12489 O WAT 5703 101.574 80.553 72.496 1.00 0.00 O ATOM 12490 H1 WAT 5703 101.824 80.352 73.398 1.00 0.00 H ATOM 12491 H2 WAT 5703 101.585 79.706 72.050 1.00 0.00 H TER 12493 WAT 5703 ATOM 12493 O WAT 5704 110.081 41.071 11.092 1.00 0.00 O ATOM 12494 H1 WAT 5704 110.689 40.449 11.492 1.00 0.00 H ATOM 12495 H2 WAT 5704 109.229 40.637 11.138 1.00 0.00 H TER 12497 WAT 5704 ATOM 12497 O WAT 5705 44.853 78.168 55.948 1.00 0.00 O ATOM 12498 H1 WAT 5705 45.685 78.084 55.483 1.00 0.00 H ATOM 12499 H2 WAT 5705 44.709 77.305 56.338 1.00 0.00 H TER 12501 WAT 5705 ATOM 12501 O WAT 5706 88.807 27.808 120.013 1.00 0.00 O ATOM 12502 H1 WAT 5706 88.419 27.629 120.870 1.00 0.00 H ATOM 12503 H2 WAT 5706 88.606 27.030 119.492 1.00 0.00 H TER 12505 WAT 5706 ATOM 12505 O WAT 5707 126.842 63.717 8.842 1.00 0.00 O ATOM 12506 H1 WAT 5707 127.526 63.605 8.182 1.00 0.00 H ATOM 12507 H2 WAT 5707 126.767 62.858 9.258 1.00 0.00 H TER 12509 WAT 5707 ATOM 12509 O WAT 5708 10.779 61.086 56.396 1.00 0.00 O ATOM 12510 H1 WAT 5708 9.841 60.925 56.498 1.00 0.00 H ATOM 12511 H2 WAT 5708 11.176 60.216 56.432 1.00 0.00 H TER 12513 WAT 5708 ATOM 12513 O WAT 5709 122.661 12.291 119.155 1.00 0.00 O ATOM 12514 H1 WAT 5709 122.565 11.979 118.256 1.00 0.00 H ATOM 12515 H2 WAT 5709 123.568 12.087 119.384 1.00 0.00 H TER 12517 WAT 5709 ATOM 12517 O WAT 5710 130.018 55.795 148.538 1.00 0.00 O ATOM 12518 H1 WAT 5710 129.594 55.932 149.385 1.00 0.00 H ATOM 12519 H2 WAT 5710 130.760 55.222 148.731 1.00 0.00 H TER 12521 WAT 5710 ATOM 12521 O WAT 5711 5.331 134.191 106.817 1.00 0.00 O ATOM 12522 H1 WAT 5711 4.946 134.562 107.611 1.00 0.00 H ATOM 12523 H2 WAT 5711 6.182 134.622 106.739 1.00 0.00 H TER 12525 WAT 5711 ATOM 12525 O WAT 5712 89.532 17.415 144.441 1.00 0.00 O ATOM 12526 H1 WAT 5712 89.833 16.994 145.246 1.00 0.00 H ATOM 12527 H2 WAT 5712 89.675 18.349 144.592 1.00 0.00 H TER 12529 WAT 5712 ATOM 12529 O WAT 5713 34.390 135.214 16.485 1.00 0.00 O ATOM 12530 H1 WAT 5713 34.068 134.472 15.972 1.00 0.00 H ATOM 12531 H2 WAT 5713 33.913 135.157 17.313 1.00 0.00 H TER 12533 WAT 5713 ATOM 12533 O WAT 5714 132.890 61.433 131.705 1.00 0.00 O ATOM 12534 H1 WAT 5714 133.598 61.115 131.144 1.00 0.00 H ATOM 12535 H2 WAT 5714 132.127 61.470 131.128 1.00 0.00 H TER 12537 WAT 5714 ATOM 12537 O WAT 5715 12.026 15.650 79.456 1.00 0.00 O ATOM 12538 H1 WAT 5715 12.049 16.467 79.954 1.00 0.00 H ATOM 12539 H2 WAT 5715 11.244 15.725 78.909 1.00 0.00 H TER 12541 WAT 5715 ATOM 12541 O WAT 5716 62.764 35.615 114.414 1.00 0.00 O ATOM 12542 H1 WAT 5716 62.906 35.340 115.320 1.00 0.00 H ATOM 12543 H2 WAT 5716 63.053 34.869 113.889 1.00 0.00 H TER 12545 WAT 5716 ATOM 12545 O WAT 5717 59.080 42.376 69.010 1.00 0.00 O ATOM 12546 H1 WAT 5717 58.349 42.988 68.931 1.00 0.00 H ATOM 12547 H2 WAT 5717 59.197 42.026 68.127 1.00 0.00 H TER 12549 WAT 5717 ATOM 12549 O WAT 5718 129.524 63.715 86.741 1.00 0.00 O ATOM 12550 H1 WAT 5718 130.008 63.042 86.261 1.00 0.00 H ATOM 12551 H2 WAT 5718 128.688 63.301 86.957 1.00 0.00 H TER 12553 WAT 5718 ATOM 12553 O WAT 5719 92.151 36.496 16.036 1.00 0.00 O ATOM 12554 H1 WAT 5719 92.358 36.894 15.191 1.00 0.00 H ATOM 12555 H2 WAT 5719 92.378 37.168 16.679 1.00 0.00 H TER 12557 WAT 5719 ATOM 12557 O WAT 5720 36.831 14.237 77.822 1.00 0.00 O ATOM 12558 H1 WAT 5720 36.318 13.513 77.464 1.00 0.00 H ATOM 12559 H2 WAT 5720 36.196 14.762 78.309 1.00 0.00 H TER 12561 WAT 5720 ATOM 12561 O WAT 5721 33.791 139.339 11.618 1.00 0.00 O ATOM 12562 H1 WAT 5721 34.731 139.159 11.639 1.00 0.00 H ATOM 12563 H2 WAT 5721 33.684 140.116 12.166 1.00 0.00 H TER 12565 WAT 5721 ATOM 12565 O WAT 5722 54.845 14.744 99.871 1.00 0.00 O ATOM 12566 H1 WAT 5722 54.317 14.747 99.072 1.00 0.00 H ATOM 12567 H2 WAT 5722 54.995 15.669 100.063 1.00 0.00 H TER 12569 WAT 5722 ATOM 12569 O WAT 5723 145.682 111.594 135.780 1.00 0.00 O ATOM 12570 H1 WAT 5723 145.324 111.712 134.901 1.00 0.00 H ATOM 12571 H2 WAT 5723 146.425 112.197 135.819 1.00 0.00 H TER 12573 WAT 5723 ATOM 12573 O WAT 5724 26.782 88.136 153.534 1.00 0.00 O ATOM 12574 H1 WAT 5724 27.331 88.392 154.275 1.00 0.00 H ATOM 12575 H2 WAT 5724 27.366 87.636 152.964 1.00 0.00 H TER 12577 WAT 5724 ATOM 12577 O WAT 5725 67.900 80.079 66.272 1.00 0.00 O ATOM 12578 H1 WAT 5725 67.297 79.415 66.608 1.00 0.00 H ATOM 12579 H2 WAT 5725 67.355 80.641 65.722 1.00 0.00 H TER 12581 WAT 5725 ATOM 12581 O WAT 5726 52.500 34.741 83.126 1.00 0.00 O ATOM 12582 H1 WAT 5726 52.519 35.683 82.956 1.00 0.00 H ATOM 12583 H2 WAT 5726 53.375 34.437 82.884 1.00 0.00 H TER 12585 WAT 5726 ATOM 12585 O WAT 5727 12.119 134.380 137.233 1.00 0.00 O ATOM 12586 H1 WAT 5727 12.762 135.003 137.570 1.00 0.00 H ATOM 12587 H2 WAT 5727 12.187 134.458 136.281 1.00 0.00 H TER 12589 WAT 5727 ATOM 12589 O WAT 5728 32.269 122.727 158.577 1.00 0.00 O ATOM 12590 H1 WAT 5728 32.208 123.636 158.282 1.00 0.00 H ATOM 12591 H2 WAT 5728 33.175 122.631 158.868 1.00 0.00 H TER 12593 WAT 5728 ATOM 12593 O WAT 5729 63.593 132.026 70.934 1.00 0.00 O ATOM 12594 H1 WAT 5729 62.773 131.532 70.915 1.00 0.00 H ATOM 12595 H2 WAT 5729 63.385 132.853 70.499 1.00 0.00 H TER 12597 WAT 5729 ATOM 12597 O WAT 5730 81.965 47.484 12.625 1.00 0.00 O ATOM 12598 H1 WAT 5730 82.283 47.257 13.499 1.00 0.00 H ATOM 12599 H2 WAT 5730 81.458 48.285 12.755 1.00 0.00 H TER 12601 WAT 5730 ATOM 12601 O WAT 5731 91.814 17.038 91.724 1.00 0.00 O ATOM 12602 H1 WAT 5731 91.134 16.435 91.420 1.00 0.00 H ATOM 12603 H2 WAT 5731 91.356 17.637 92.314 1.00 0.00 H TER 12605 WAT 5731 ATOM 12605 O WAT 5732 60.527 59.903 62.594 1.00 0.00 O ATOM 12606 H1 WAT 5732 60.250 59.038 62.288 1.00 0.00 H ATOM 12607 H2 WAT 5732 60.508 60.451 61.809 1.00 0.00 H TER 12609 WAT 5732 ATOM 12609 O WAT 5733 74.957 84.911 15.643 1.00 0.00 O ATOM 12610 H1 WAT 5733 75.343 85.674 15.213 1.00 0.00 H ATOM 12611 H2 WAT 5733 75.500 84.774 16.420 1.00 0.00 H TER 12613 WAT 5733 ATOM 12613 O WAT 5734 15.122 86.372 149.468 1.00 0.00 O ATOM 12614 H1 WAT 5734 15.759 86.822 150.023 1.00 0.00 H ATOM 12615 H2 WAT 5734 14.515 87.060 149.195 1.00 0.00 H TER 12617 WAT 5734 ATOM 12617 O WAT 5735 42.508 132.618 119.553 1.00 0.00 O ATOM 12618 H1 WAT 5735 43.071 132.880 118.825 1.00 0.00 H ATOM 12619 H2 WAT 5735 41.709 132.297 119.134 1.00 0.00 H TER 12621 WAT 5735 ATOM 12621 O WAT 5736 87.339 122.432 59.166 1.00 0.00 O ATOM 12622 H1 WAT 5736 87.868 121.814 58.661 1.00 0.00 H ATOM 12623 H2 WAT 5736 86.624 122.673 58.576 1.00 0.00 H TER 12625 WAT 5736 ATOM 12625 O WAT 5737 89.443 6.039 151.518 1.00 0.00 O ATOM 12626 H1 WAT 5737 89.623 5.480 150.763 1.00 0.00 H ATOM 12627 H2 WAT 5737 89.643 5.489 152.276 1.00 0.00 H TER 12629 WAT 5737 ATOM 12629 O WAT 5738 139.546 32.314 101.634 1.00 0.00 O ATOM 12630 H1 WAT 5738 139.270 33.160 101.987 1.00 0.00 H ATOM 12631 H2 WAT 5738 139.293 32.345 100.712 1.00 0.00 H TER 12633 WAT 5738 ATOM 12633 O WAT 5739 80.388 55.700 147.878 1.00 0.00 O ATOM 12634 H1 WAT 5739 81.207 55.444 148.303 1.00 0.00 H ATOM 12635 H2 WAT 5739 80.093 56.467 148.369 1.00 0.00 H TER 12637 WAT 5739 ATOM 12637 O WAT 5740 132.298 40.996 116.572 1.00 0.00 O ATOM 12638 H1 WAT 5740 132.225 41.013 115.618 1.00 0.00 H ATOM 12639 H2 WAT 5740 133.197 41.273 116.748 1.00 0.00 H TER 12641 WAT 5740 ATOM 12641 O WAT 5741 114.716 23.936 75.157 1.00 0.00 O ATOM 12642 H1 WAT 5741 114.390 24.383 74.377 1.00 0.00 H ATOM 12643 H2 WAT 5741 115.180 24.615 75.647 1.00 0.00 H TER 12645 WAT 5741 ATOM 12645 O WAT 5742 9.222 109.785 96.324 1.00 0.00 O ATOM 12646 H1 WAT 5742 10.096 110.176 96.335 1.00 0.00 H ATOM 12647 H2 WAT 5742 8.774 110.220 95.599 1.00 0.00 H TER 12649 WAT 5742 ATOM 12649 O WAT 5743 56.251 113.372 152.658 1.00 0.00 O ATOM 12650 H1 WAT 5743 55.804 113.622 151.849 1.00 0.00 H ATOM 12651 H2 WAT 5743 56.653 114.183 152.970 1.00 0.00 H TER 12653 WAT 5743 ATOM 12653 O WAT 5744 82.744 54.491 83.240 1.00 0.00 O ATOM 12654 H1 WAT 5744 82.900 53.594 82.948 1.00 0.00 H ATOM 12655 H2 WAT 5744 83.450 55.000 82.840 1.00 0.00 H TER 12657 WAT 5744 ATOM 12657 O WAT 5745 53.988 113.895 111.198 1.00 0.00 O ATOM 12658 H1 WAT 5745 54.692 114.052 110.569 1.00 0.00 H ATOM 12659 H2 WAT 5745 54.372 114.109 112.047 1.00 0.00 H TER 12661 WAT 5745 ATOM 12661 O WAT 5746 55.317 141.526 103.249 1.00 0.00 O ATOM 12662 H1 WAT 5746 54.595 140.910 103.122 1.00 0.00 H ATOM 12663 H2 WAT 5746 55.053 142.050 104.006 1.00 0.00 H TER 12665 WAT 5746 ATOM 12665 O WAT 5747 75.083 104.456 61.173 1.00 0.00 O ATOM 12666 H1 WAT 5747 75.797 104.397 61.808 1.00 0.00 H ATOM 12667 H2 WAT 5747 75.280 103.779 60.526 1.00 0.00 H TER 12669 WAT 5747 ATOM 12669 O WAT 5748 125.168 85.736 156.765 1.00 0.00 O ATOM 12670 H1 WAT 5748 126.094 85.823 156.540 1.00 0.00 H ATOM 12671 H2 WAT 5748 125.165 85.222 157.573 1.00 0.00 H TER 12673 WAT 5748 ATOM 12673 O WAT 5749 137.816 85.786 146.830 1.00 0.00 O ATOM 12674 H1 WAT 5749 137.783 85.879 147.782 1.00 0.00 H ATOM 12675 H2 WAT 5749 136.992 85.355 146.603 1.00 0.00 H TER 12677 WAT 5749 ATOM 12677 O WAT 5750 109.629 42.386 66.267 1.00 0.00 O ATOM 12678 H1 WAT 5750 108.869 42.445 66.846 1.00 0.00 H ATOM 12679 H2 WAT 5750 109.259 42.198 65.404 1.00 0.00 H TER 12681 WAT 5750 ATOM 12681 O WAT 5751 145.041 45.086 80.858 1.00 0.00 O ATOM 12682 H1 WAT 5751 145.126 44.985 81.806 1.00 0.00 H ATOM 12683 H2 WAT 5751 145.705 45.736 80.626 1.00 0.00 H TER 12685 WAT 5751 ATOM 12685 O WAT 5752 121.176 145.127 108.159 1.00 0.00 O ATOM 12686 H1 WAT 5752 121.070 144.355 107.604 1.00 0.00 H ATOM 12687 H2 WAT 5752 121.945 144.932 108.695 1.00 0.00 H TER 12689 WAT 5752 ATOM 12689 O WAT 5753 18.429 22.493 144.636 1.00 0.00 O ATOM 12690 H1 WAT 5753 17.690 22.240 145.190 1.00 0.00 H ATOM 12691 H2 WAT 5753 18.506 21.782 144.000 1.00 0.00 H TER 12693 WAT 5753 ATOM 12693 O WAT 5754 54.319 103.877 69.149 1.00 0.00 O ATOM 12694 H1 WAT 5754 55.098 103.328 69.244 1.00 0.00 H ATOM 12695 H2 WAT 5754 54.641 104.771 69.263 1.00 0.00 H TER 12697 WAT 5754 ATOM 12697 O WAT 5755 26.302 49.342 81.724 1.00 0.00 O ATOM 12698 H1 WAT 5755 26.153 49.996 81.041 1.00 0.00 H ATOM 12699 H2 WAT 5755 27.074 48.859 81.428 1.00 0.00 H TER 12701 WAT 5755 ATOM 12701 O WAT 5756 134.119 59.094 134.478 1.00 0.00 O ATOM 12702 H1 WAT 5756 133.308 59.212 133.982 1.00 0.00 H ATOM 12703 H2 WAT 5756 134.478 59.977 134.564 1.00 0.00 H TER 12705 WAT 5756 ATOM 12705 O WAT 5757 72.560 49.100 145.733 1.00 0.00 O ATOM 12706 H1 WAT 5757 72.008 49.811 146.060 1.00 0.00 H ATOM 12707 H2 WAT 5757 72.041 48.309 145.879 1.00 0.00 H TER 12709 WAT 5757 ATOM 12709 O WAT 5758 59.886 100.753 108.686 1.00 0.00 O ATOM 12710 H1 WAT 5758 60.240 99.864 108.718 1.00 0.00 H ATOM 12711 H2 WAT 5758 59.968 101.076 109.583 1.00 0.00 H TER 12713 WAT 5758 ATOM 12713 O WAT 5759 68.215 128.610 148.413 1.00 0.00 O ATOM 12714 H1 WAT 5759 69.087 128.753 148.782 1.00 0.00 H ATOM 12715 H2 WAT 5759 68.376 128.139 147.595 1.00 0.00 H TER 12717 WAT 5759 ATOM 12717 O WAT 5760 99.015 71.391 107.849 1.00 0.00 O ATOM 12718 H1 WAT 5760 99.034 72.206 108.351 1.00 0.00 H ATOM 12719 H2 WAT 5760 98.086 71.228 107.691 1.00 0.00 H TER 12721 WAT 5760 ATOM 12721 O WAT 5761 21.140 9.454 122.074 1.00 0.00 O ATOM 12722 H1 WAT 5761 22.095 9.517 122.045 1.00 0.00 H ATOM 12723 H2 WAT 5761 20.891 9.940 122.859 1.00 0.00 H TER 12725 WAT 5761 ATOM 12725 O WAT 5762 124.527 44.984 106.862 1.00 0.00 O ATOM 12726 H1 WAT 5762 125.376 45.110 107.285 1.00 0.00 H ATOM 12727 H2 WAT 5762 123.973 45.676 107.224 1.00 0.00 H TER 12729 WAT 5762 ATOM 12729 O WAT 5763 122.269 107.217 71.843 1.00 0.00 O ATOM 12730 H1 WAT 5763 121.338 107.182 72.064 1.00 0.00 H ATOM 12731 H2 WAT 5763 122.484 106.326 71.570 1.00 0.00 H TER 12733 WAT 5763 ATOM 12733 O WAT 5764 48.973 22.500 102.266 1.00 0.00 O ATOM 12734 H1 WAT 5764 48.586 21.817 101.717 1.00 0.00 H ATOM 12735 H2 WAT 5764 49.864 22.194 102.437 1.00 0.00 H TER 12737 WAT 5764 ATOM 12737 O WAT 5765 4.017 90.586 141.811 1.00 0.00 O ATOM 12738 H1 WAT 5765 3.524 89.839 142.150 1.00 0.00 H ATOM 12739 H2 WAT 5765 4.358 91.022 142.592 1.00 0.00 H TER 12741 WAT 5765 ATOM 12741 O WAT 5766 44.373 119.147 56.057 1.00 0.00 O ATOM 12742 H1 WAT 5766 44.024 118.305 56.350 1.00 0.00 H ATOM 12743 H2 WAT 5766 44.854 118.941 55.256 1.00 0.00 H TER 12745 WAT 5766 ATOM 12745 O WAT 5767 24.760 118.209 67.407 1.00 0.00 O ATOM 12746 H1 WAT 5767 25.008 118.305 68.326 1.00 0.00 H ATOM 12747 H2 WAT 5767 25.012 117.314 67.183 1.00 0.00 H TER 12749 WAT 5767 ATOM 12749 O WAT 5768 102.336 70.985 15.916 1.00 0.00 O ATOM 12750 H1 WAT 5768 102.600 71.656 16.545 1.00 0.00 H ATOM 12751 H2 WAT 5768 102.879 71.152 15.146 1.00 0.00 H TER 12753 WAT 5768 ATOM 12753 O WAT 5769 85.624 143.575 156.672 1.00 0.00 O ATOM 12754 H1 WAT 5769 86.575 143.468 156.660 1.00 0.00 H ATOM 12755 H2 WAT 5769 85.308 142.989 155.984 1.00 0.00 H TER 12757 WAT 5769 ATOM 12757 O WAT 5770 78.098 112.623 12.850 1.00 0.00 O ATOM 12758 H1 WAT 5770 78.289 113.545 13.019 1.00 0.00 H ATOM 12759 H2 WAT 5770 77.624 112.330 13.628 1.00 0.00 H TER 12761 WAT 5770 ATOM 12761 O WAT 5771 47.569 115.467 137.109 1.00 0.00 O ATOM 12762 H1 WAT 5771 46.863 114.911 136.779 1.00 0.00 H ATOM 12763 H2 WAT 5771 48.312 115.276 136.537 1.00 0.00 H TER 12765 WAT 5771 ATOM 12765 O WAT 5772 93.504 98.080 113.669 1.00 0.00 O ATOM 12766 H1 WAT 5772 92.628 97.906 114.015 1.00 0.00 H ATOM 12767 H2 WAT 5772 93.635 97.409 113.000 1.00 0.00 H TER 12769 WAT 5772 ATOM 12769 O WAT 5773 26.245 65.135 78.456 1.00 0.00 O ATOM 12770 H1 WAT 5773 26.252 65.294 77.512 1.00 0.00 H ATOM 12771 H2 WAT 5773 25.929 64.236 78.546 1.00 0.00 H TER 12773 WAT 5773 ATOM 12773 O WAT 5774 102.378 41.893 7.497 1.00 0.00 O ATOM 12774 H1 WAT 5774 102.015 42.265 8.301 1.00 0.00 H ATOM 12775 H2 WAT 5774 101.624 41.796 6.916 1.00 0.00 H TER 12777 WAT 5774 ATOM 12777 O WAT 5775 19.807 46.334 123.767 1.00 0.00 O ATOM 12778 H1 WAT 5775 19.728 45.532 124.283 1.00 0.00 H ATOM 12779 H2 WAT 5775 19.049 46.860 124.023 1.00 0.00 H TER 12781 WAT 5775 ATOM 12781 O WAT 5776 131.776 127.152 80.381 1.00 0.00 O ATOM 12782 H1 WAT 5776 132.374 126.440 80.607 1.00 0.00 H ATOM 12783 H2 WAT 5776 131.188 127.220 81.133 1.00 0.00 H TER 12785 WAT 5776 ATOM 12785 O WAT 5777 97.181 92.233 75.435 1.00 0.00 O ATOM 12786 H1 WAT 5777 96.475 91.588 75.399 1.00 0.00 H ATOM 12787 H2 WAT 5777 97.597 92.181 74.574 1.00 0.00 H TER 12789 WAT 5777 ATOM 12789 O WAT 5778 9.256 10.263 124.880 1.00 0.00 O ATOM 12790 H1 WAT 5778 9.762 11.056 125.063 1.00 0.00 H ATOM 12791 H2 WAT 5778 9.285 9.767 125.698 1.00 0.00 H TER 12793 WAT 5778 ATOM 12793 O WAT 5779 30.704 64.798 94.007 1.00 0.00 O ATOM 12794 H1 WAT 5779 31.306 64.154 93.635 1.00 0.00 H ATOM 12795 H2 WAT 5779 30.692 65.512 93.369 1.00 0.00 H TER 12797 WAT 5779 ATOM 12797 O WAT 5780 68.946 20.298 142.510 1.00 0.00 O ATOM 12798 H1 WAT 5780 68.910 19.468 142.985 1.00 0.00 H ATOM 12799 H2 WAT 5780 69.603 20.155 141.828 1.00 0.00 H TER 12801 WAT 5780 ATOM 12801 O WAT 5781 60.274 137.852 143.345 1.00 0.00 O ATOM 12802 H1 WAT 5781 59.481 137.966 143.870 1.00 0.00 H ATOM 12803 H2 WAT 5781 60.979 137.785 143.988 1.00 0.00 H TER 12805 WAT 5781 ATOM 12805 O WAT 5782 139.961 64.808 8.991 1.00 0.00 O ATOM 12806 H1 WAT 5782 139.580 64.441 9.790 1.00 0.00 H ATOM 12807 H2 WAT 5782 140.906 64.714 9.111 1.00 0.00 H TER 12809 WAT 5782 ATOM 12809 O WAT 5783 26.275 132.026 56.798 1.00 0.00 O ATOM 12810 H1 WAT 5783 26.543 131.373 56.151 1.00 0.00 H ATOM 12811 H2 WAT 5783 27.087 132.470 57.042 1.00 0.00 H TER 12813 WAT 5783 ATOM 12813 O WAT 5784 14.253 14.791 84.237 1.00 0.00 O ATOM 12814 H1 WAT 5784 15.138 15.134 84.362 1.00 0.00 H ATOM 12815 H2 WAT 5784 13.680 15.539 84.405 1.00 0.00 H TER 12817 WAT 5784 ATOM 12817 O WAT 5785 46.857 11.440 89.273 1.00 0.00 O ATOM 12818 H1 WAT 5785 46.946 11.844 88.409 1.00 0.00 H ATOM 12819 H2 WAT 5785 45.912 11.405 89.424 1.00 0.00 H TER 12821 WAT 5785 ATOM 12821 O WAT 5786 50.192 73.505 116.724 1.00 0.00 O ATOM 12822 H1 WAT 5786 49.750 74.190 117.226 1.00 0.00 H ATOM 12823 H2 WAT 5786 51.070 73.460 117.102 1.00 0.00 H TER 12825 WAT 5786 ATOM 12825 O WAT 5787 76.012 40.971 4.190 1.00 0.00 O ATOM 12826 H1 WAT 5787 75.555 40.292 3.694 1.00 0.00 H ATOM 12827 H2 WAT 5787 75.410 41.197 4.899 1.00 0.00 H TER 12829 WAT 5787 ATOM 12829 O WAT 5788 75.604 120.399 142.648 1.00 0.00 O ATOM 12830 H1 WAT 5788 76.051 119.680 142.200 1.00 0.00 H ATOM 12831 H2 WAT 5788 74.673 120.193 142.561 1.00 0.00 H TER 12833 WAT 5788 ATOM 12833 O WAT 5789 102.822 135.000 118.918 1.00 0.00 O ATOM 12834 H1 WAT 5789 103.662 135.352 118.624 1.00 0.00 H ATOM 12835 H2 WAT 5789 102.445 134.597 118.136 1.00 0.00 H TER 12837 WAT 5789 ATOM 12837 O WAT 5790 94.420 104.066 115.984 1.00 0.00 O ATOM 12838 H1 WAT 5790 93.671 104.285 116.539 1.00 0.00 H ATOM 12839 H2 WAT 5790 94.041 103.589 115.246 1.00 0.00 H TER 12841 WAT 5790 ATOM 12841 O WAT 5791 92.023 80.822 11.862 1.00 0.00 O ATOM 12842 H1 WAT 5791 92.245 79.950 12.188 1.00 0.00 H ATOM 12843 H2 WAT 5791 91.939 80.709 10.915 1.00 0.00 H TER 12845 WAT 5791 ATOM 12845 O WAT 5792 145.625 140.997 126.992 1.00 0.00 O ATOM 12846 H1 WAT 5792 145.696 141.254 127.911 1.00 0.00 H ATOM 12847 H2 WAT 5792 146.318 140.348 126.870 1.00 0.00 H TER 12849 WAT 5792 ATOM 12849 O WAT 5793 48.976 9.683 90.482 1.00 0.00 O ATOM 12850 H1 WAT 5793 48.817 8.739 90.469 1.00 0.00 H ATOM 12851 H2 WAT 5793 48.103 10.073 90.434 1.00 0.00 H TER 12853 WAT 5793 ATOM 12853 O WAT 5794 11.402 30.513 89.347 1.00 0.00 O ATOM 12854 H1 WAT 5794 12.080 29.851 89.211 1.00 0.00 H ATOM 12855 H2 WAT 5794 10.713 30.055 89.828 1.00 0.00 H TER 12857 WAT 5794 ATOM 12857 O WAT 5795 128.214 79.891 140.474 1.00 0.00 O ATOM 12858 H1 WAT 5795 128.309 80.560 139.797 1.00 0.00 H ATOM 12859 H2 WAT 5795 128.980 79.328 140.364 1.00 0.00 H TER 12861 WAT 5795 ATOM 12861 O WAT 5796 58.728 140.975 147.510 1.00 0.00 O ATOM 12862 H1 WAT 5796 59.549 140.525 147.308 1.00 0.00 H ATOM 12863 H2 WAT 5796 58.227 140.936 146.694 1.00 0.00 H TER 12865 WAT 5796 ATOM 12865 O WAT 5797 143.627 17.881 77.131 1.00 0.00 O ATOM 12866 H1 WAT 5797 143.603 17.250 77.850 1.00 0.00 H ATOM 12867 H2 WAT 5797 143.985 17.388 76.392 1.00 0.00 H TER 12869 WAT 5797 ATOM 12869 O WAT 5798 122.061 57.917 90.656 1.00 0.00 O ATOM 12870 H1 WAT 5798 121.315 57.328 90.767 1.00 0.00 H ATOM 12871 H2 WAT 5798 122.817 57.334 90.586 1.00 0.00 H TER 12873 WAT 5798 ATOM 12873 O WAT 5799 125.101 45.382 91.020 1.00 0.00 O ATOM 12874 H1 WAT 5799 125.486 45.825 91.776 1.00 0.00 H ATOM 12875 H2 WAT 5799 125.448 44.491 91.062 1.00 0.00 H TER 12877 WAT 5799 ATOM 12877 O WAT 5800 55.096 84.383 65.821 1.00 0.00 O ATOM 12878 H1 WAT 5800 54.797 84.175 64.936 1.00 0.00 H ATOM 12879 H2 WAT 5800 55.971 84.751 65.699 1.00 0.00 H TER 12881 WAT 5800 ATOM 12881 O WAT 5801 0.152 119.475 146.963 1.00 0.00 O ATOM 12882 H1 WAT 5801 0.880 120.051 147.195 1.00 0.00 H ATOM 12883 H2 WAT 5801 -0.606 119.855 147.408 1.00 0.00 H TER 12885 WAT 5801 ATOM 12885 O WAT 5802 -0.187 44.399 142.716 1.00 0.00 O ATOM 12886 H1 WAT 5802 -0.226 44.866 143.551 1.00 0.00 H ATOM 12887 H2 WAT 5802 0.741 44.409 142.480 1.00 0.00 H TER 12889 WAT 5802 ATOM 12889 O WAT 5803 143.831 130.750 6.585 1.00 0.00 O ATOM 12890 H1 WAT 5803 144.671 130.431 6.254 1.00 0.00 H ATOM 12891 H2 WAT 5803 143.857 130.561 7.523 1.00 0.00 H TER 12893 WAT 5803 ATOM 12893 O WAT 5804 13.129 45.475 107.047 1.00 0.00 O ATOM 12894 H1 WAT 5804 13.310 46.377 107.311 1.00 0.00 H ATOM 12895 H2 WAT 5804 12.768 45.551 106.164 1.00 0.00 H TER 12897 WAT 5804 ATOM 12897 O WAT 5805 36.098 130.715 2.509 1.00 0.00 O ATOM 12898 H1 WAT 5805 35.148 130.606 2.473 1.00 0.00 H ATOM 12899 H2 WAT 5805 36.358 130.289 3.326 1.00 0.00 H TER 12901 WAT 5805 ATOM 12901 O WAT 5806 74.700 134.706 79.927 1.00 0.00 O ATOM 12902 H1 WAT 5806 75.336 134.784 80.638 1.00 0.00 H ATOM 12903 H2 WAT 5806 74.455 135.609 79.726 1.00 0.00 H TER 12905 WAT 5806 ATOM 12905 O WAT 5807 37.474 25.990 128.498 1.00 0.00 O ATOM 12906 H1 WAT 5807 37.468 25.033 128.522 1.00 0.00 H ATOM 12907 H2 WAT 5807 37.095 26.211 127.647 1.00 0.00 H TER 12909 WAT 5807 ATOM 12909 O WAT 5808 132.895 5.556 61.162 1.00 0.00 O ATOM 12910 H1 WAT 5808 132.250 5.853 60.520 1.00 0.00 H ATOM 12911 H2 WAT 5808 132.374 5.134 61.846 1.00 0.00 H TER 12913 WAT 5808 ATOM 12913 O WAT 5809 113.799 114.081 6.346 1.00 0.00 O ATOM 12914 H1 WAT 5809 112.957 114.115 5.892 1.00 0.00 H ATOM 12915 H2 WAT 5809 114.451 114.110 5.646 1.00 0.00 H TER 12917 WAT 5809 ATOM 12917 O WAT 5810 34.663 82.376 15.131 1.00 0.00 O ATOM 12918 H1 WAT 5810 34.275 81.828 15.813 1.00 0.00 H ATOM 12919 H2 WAT 5810 34.579 81.858 14.330 1.00 0.00 H TER 12921 WAT 5810 ATOM 12921 O WAT 5811 113.489 7.568 3.834 1.00 0.00 O ATOM 12922 H1 WAT 5811 113.493 6.681 4.194 1.00 0.00 H ATOM 12923 H2 WAT 5811 112.746 7.996 4.260 1.00 0.00 H TER 12925 WAT 5811 ATOM 12925 O WAT 5812 38.860 111.381 83.358 1.00 0.00 O ATOM 12926 H1 WAT 5812 39.225 111.528 84.230 1.00 0.00 H ATOM 12927 H2 WAT 5812 39.238 112.077 82.820 1.00 0.00 H TER 12929 WAT 5812 ATOM 12929 O WAT 5813 97.440 6.444 1.615 1.00 0.00 O ATOM 12930 H1 WAT 5813 98.179 5.844 1.515 1.00 0.00 H ATOM 12931 H2 WAT 5813 97.843 7.297 1.773 1.00 0.00 H TER 12933 WAT 5813 ATOM 12933 O WAT 5814 46.874 128.063 4.526 1.00 0.00 O ATOM 12934 H1 WAT 5814 47.098 127.180 4.231 1.00 0.00 H ATOM 12935 H2 WAT 5814 45.919 128.100 4.469 1.00 0.00 H TER 12937 WAT 5814 ATOM 12937 O WAT 5815 73.325 132.879 111.245 1.00 0.00 O ATOM 12938 H1 WAT 5815 72.957 133.474 111.899 1.00 0.00 H ATOM 12939 H2 WAT 5815 73.874 132.279 111.750 1.00 0.00 H TER 12941 WAT 5815 ATOM 12941 O WAT 5816 143.893 12.734 66.474 1.00 0.00 O ATOM 12942 H1 WAT 5816 144.441 11.977 66.267 1.00 0.00 H ATOM 12943 H2 WAT 5816 143.595 12.576 67.369 1.00 0.00 H TER 12945 WAT 5816 ATOM 12945 O WAT 5817 14.923 107.464 61.436 1.00 0.00 O ATOM 12946 H1 WAT 5817 15.083 107.192 62.339 1.00 0.00 H ATOM 12947 H2 WAT 5817 14.452 108.294 61.516 1.00 0.00 H TER 12949 WAT 5817 ATOM 12949 O WAT 5818 34.574 30.975 118.913 1.00 0.00 O ATOM 12950 H1 WAT 5818 33.988 31.517 118.384 1.00 0.00 H ATOM 12951 H2 WAT 5818 34.932 30.338 118.296 1.00 0.00 H TER 12953 WAT 5818 ATOM 12953 O WAT 5819 97.507 87.305 4.304 1.00 0.00 O ATOM 12954 H1 WAT 5819 97.996 86.790 3.662 1.00 0.00 H ATOM 12955 H2 WAT 5819 97.498 88.192 3.943 1.00 0.00 H TER 12957 WAT 5819 ATOM 12957 O WAT 5820 118.309 144.835 116.433 1.00 0.00 O ATOM 12958 H1 WAT 5820 117.493 145.328 116.354 1.00 0.00 H ATOM 12959 H2 WAT 5820 118.655 145.080 117.292 1.00 0.00 H TER 12961 WAT 5820 ATOM 12961 O WAT 5821 89.060 71.864 97.011 1.00 0.00 O ATOM 12962 H1 WAT 5821 89.543 71.634 96.217 1.00 0.00 H ATOM 12963 H2 WAT 5821 88.563 72.646 96.770 1.00 0.00 H TER 12965 WAT 5821 ATOM 12965 O WAT 5822 43.541 52.666 140.184 1.00 0.00 O ATOM 12966 H1 WAT 5822 44.202 53.316 139.945 1.00 0.00 H ATOM 12967 H2 WAT 5822 43.351 52.207 139.365 1.00 0.00 H TER 12969 WAT 5822 ATOM 12969 O WAT 5823 129.460 85.162 145.364 1.00 0.00 O ATOM 12970 H1 WAT 5823 130.124 84.747 144.813 1.00 0.00 H ATOM 12971 H2 WAT 5823 129.834 86.014 145.589 1.00 0.00 H TER 12973 WAT 5823 ATOM 12973 O WAT 5824 99.617 51.521 102.714 1.00 0.00 O ATOM 12974 H1 WAT 5824 99.448 51.364 103.643 1.00 0.00 H ATOM 12975 H2 WAT 5824 99.208 52.368 102.537 1.00 0.00 H TER 12977 WAT 5824 ATOM 12977 O WAT 5825 86.307 82.740 157.181 1.00 0.00 O ATOM 12978 H1 WAT 5825 87.172 82.386 156.969 1.00 0.00 H ATOM 12979 H2 WAT 5825 86.268 82.720 158.137 1.00 0.00 H TER 12981 WAT 5825 ATOM 12981 O WAT 5826 0.503 63.937 123.430 1.00 0.00 O ATOM 12982 H1 WAT 5826 1.459 63.980 123.418 1.00 0.00 H ATOM 12983 H2 WAT 5826 0.307 63.022 123.634 1.00 0.00 H TER 12985 WAT 5826 ATOM 12985 O WAT 5827 20.009 46.907 134.491 1.00 0.00 O ATOM 12986 H1 WAT 5827 19.420 46.209 134.204 1.00 0.00 H ATOM 12987 H2 WAT 5827 20.101 46.771 135.434 1.00 0.00 H TER 12989 WAT 5827 ATOM 12989 O WAT 5828 134.190 121.728 2.960 1.00 0.00 O ATOM 12990 H1 WAT 5828 133.631 121.985 3.693 1.00 0.00 H ATOM 12991 H2 WAT 5828 134.224 122.504 2.400 1.00 0.00 H TER 12993 WAT 5828 ATOM 12993 O WAT 5829 113.183 22.055 112.682 1.00 0.00 O ATOM 12994 H1 WAT 5829 113.142 21.553 111.869 1.00 0.00 H ATOM 12995 H2 WAT 5829 114.112 22.071 112.909 1.00 0.00 H TER 12997 WAT 5829 ATOM 12997 O WAT 5830 19.142 142.702 66.599 1.00 0.00 O ATOM 12998 H1 WAT 5830 18.720 143.528 66.362 1.00 0.00 H ATOM 12999 H2 WAT 5830 19.381 142.810 67.519 1.00 0.00 H TER 13001 WAT 5830 ATOM 13001 O WAT 5831 80.612 115.767 17.559 1.00 0.00 O ATOM 13002 H1 WAT 5831 79.866 116.366 17.520 1.00 0.00 H ATOM 13003 H2 WAT 5831 81.185 116.141 18.228 1.00 0.00 H TER 13005 WAT 5831 ATOM 13005 O WAT 5832 31.437 67.468 12.053 1.00 0.00 O ATOM 13006 H1 WAT 5832 31.753 66.570 12.154 1.00 0.00 H ATOM 13007 H2 WAT 5832 31.802 67.937 12.803 1.00 0.00 H TER 13009 WAT 5832 ATOM 13009 O WAT 5833 75.644 46.844 128.768 1.00 0.00 O ATOM 13010 H1 WAT 5833 74.931 47.399 129.085 1.00 0.00 H ATOM 13011 H2 WAT 5833 76.401 47.105 129.293 1.00 0.00 H TER 13013 WAT 5833 ATOM 13013 O WAT 5834 35.720 94.498 102.549 1.00 0.00 O ATOM 13014 H1 WAT 5834 36.208 94.942 103.241 1.00 0.00 H ATOM 13015 H2 WAT 5834 35.740 93.573 102.796 1.00 0.00 H TER 13017 WAT 5834 ATOM 13017 O WAT 5835 142.086 49.587 4.920 1.00 0.00 O ATOM 13018 H1 WAT 5835 142.874 49.053 5.014 1.00 0.00 H ATOM 13019 H2 WAT 5835 142.400 50.417 4.562 1.00 0.00 H TER 13021 WAT 5835 ATOM 13021 O WAT 5836 114.865 23.864 108.739 1.00 0.00 O ATOM 13022 H1 WAT 5836 115.452 24.136 109.445 1.00 0.00 H ATOM 13023 H2 WAT 5836 114.001 23.822 109.148 1.00 0.00 H TER 13025 WAT 5836 ATOM 13025 O WAT 5837 41.555 22.878 21.003 1.00 0.00 O ATOM 13026 H1 WAT 5837 42.390 23.333 20.894 1.00 0.00 H ATOM 13027 H2 WAT 5837 40.957 23.550 21.330 1.00 0.00 H TER 13029 WAT 5837 ATOM 13029 O WAT 5838 37.808 87.796 136.057 1.00 0.00 O ATOM 13030 H1 WAT 5838 37.870 88.491 135.402 1.00 0.00 H ATOM 13031 H2 WAT 5838 37.817 88.256 136.896 1.00 0.00 H TER 13033 WAT 5838 ATOM 13033 O WAT 5839 74.776 39.988 91.324 1.00 0.00 O ATOM 13034 H1 WAT 5839 75.067 39.086 91.456 1.00 0.00 H ATOM 13035 H2 WAT 5839 73.951 40.047 91.805 1.00 0.00 H TER 13037 WAT 5839 ATOM 13037 O WAT 5840 15.788 140.889 68.522 1.00 0.00 O ATOM 13038 H1 WAT 5840 16.640 140.928 68.957 1.00 0.00 H ATOM 13039 H2 WAT 5840 15.985 141.036 67.597 1.00 0.00 H TER 13041 WAT 5840 ATOM 13041 O WAT 5841 85.077 86.767 104.736 1.00 0.00 O ATOM 13042 H1 WAT 5841 84.496 87.135 105.403 1.00 0.00 H ATOM 13043 H2 WAT 5841 84.494 86.528 104.016 1.00 0.00 H TER 13045 WAT 5841 ATOM 13045 O WAT 5842 112.081 35.839 131.162 1.00 0.00 O ATOM 13046 H1 WAT 5842 111.646 36.165 130.374 1.00 0.00 H ATOM 13047 H2 WAT 5842 112.062 36.578 131.769 1.00 0.00 H TER 13049 WAT 5842 ATOM 13049 O WAT 5843 25.850 132.763 71.818 1.00 0.00 O ATOM 13050 H1 WAT 5843 25.015 133.129 72.111 1.00 0.00 H ATOM 13051 H2 WAT 5843 26.498 133.425 72.060 1.00 0.00 H TER 13053 WAT 5843 ATOM 13053 O WAT 5844 109.548 52.731 145.712 1.00 0.00 O ATOM 13054 H1 WAT 5844 110.284 53.312 145.901 1.00 0.00 H ATOM 13055 H2 WAT 5844 109.300 52.372 146.564 1.00 0.00 H TER 13057 WAT 5844 ATOM 13057 O WAT 5845 60.409 23.405 138.715 1.00 0.00 O ATOM 13058 H1 WAT 5845 60.209 22.713 139.345 1.00 0.00 H ATOM 13059 H2 WAT 5845 59.576 23.575 138.274 1.00 0.00 H TER 13061 WAT 5845 ATOM 13061 O WAT 5846 144.692 124.077 151.486 1.00 0.00 O ATOM 13062 H1 WAT 5846 144.799 123.546 152.275 1.00 0.00 H ATOM 13063 H2 WAT 5846 144.182 124.834 151.773 1.00 0.00 H TER 13065 WAT 5846 ATOM 13065 O WAT 5847 11.575 86.534 23.241 1.00 0.00 O ATOM 13066 H1 WAT 5847 12.035 86.047 23.924 1.00 0.00 H ATOM 13067 H2 WAT 5847 11.864 87.439 23.356 1.00 0.00 H TER 13069 WAT 5847 ATOM 13069 O WAT 5848 126.946 135.152 2.869 1.00 0.00 O ATOM 13070 H1 WAT 5848 127.432 135.180 3.693 1.00 0.00 H ATOM 13071 H2 WAT 5848 127.050 134.252 2.560 1.00 0.00 H TER 13073 WAT 5848 ATOM 13073 O WAT 5849 125.913 63.336 1.094 1.00 0.00 O ATOM 13074 H1 WAT 5849 126.036 62.705 0.386 1.00 0.00 H ATOM 13075 H2 WAT 5849 126.569 63.094 1.748 1.00 0.00 H TER 13077 WAT 5849 ATOM 13077 O WAT 5850 32.004 39.194 158.056 1.00 0.00 O ATOM 13078 H1 WAT 5850 31.798 38.876 157.177 1.00 0.00 H ATOM 13079 H2 WAT 5850 31.381 39.904 158.206 1.00 0.00 H TER 13081 WAT 5850 ATOM 13081 O WAT 5851 22.054 99.228 70.989 1.00 0.00 O ATOM 13082 H1 WAT 5851 22.179 98.322 71.272 1.00 0.00 H ATOM 13083 H2 WAT 5851 21.671 99.666 71.749 1.00 0.00 H TER 13085 WAT 5851 ATOM 13085 O WAT 5852 13.412 7.039 142.826 1.00 0.00 O ATOM 13086 H1 WAT 5852 13.172 6.234 142.366 1.00 0.00 H ATOM 13087 H2 WAT 5852 13.451 7.705 142.140 1.00 0.00 H TER 13089 WAT 5852 ATOM 13089 O WAT 5853 12.415 86.046 12.100 1.00 0.00 O ATOM 13090 H1 WAT 5853 11.537 86.272 11.794 1.00 0.00 H ATOM 13091 H2 WAT 5853 13.002 86.416 11.440 1.00 0.00 H TER 13093 WAT 5853 ATOM 13093 O WAT 5854 96.250 134.501 74.373 1.00 0.00 O ATOM 13094 H1 WAT 5854 96.053 133.778 74.968 1.00 0.00 H ATOM 13095 H2 WAT 5854 96.906 134.147 73.773 1.00 0.00 H TER 13097 WAT 5854 ATOM 13097 O WAT 5855 103.607 84.474 120.373 1.00 0.00 O ATOM 13098 H1 WAT 5855 102.985 83.759 120.501 1.00 0.00 H ATOM 13099 H2 WAT 5855 104.414 84.043 120.093 1.00 0.00 H TER 13101 WAT 5855 ATOM 13101 O WAT 5856 105.746 44.771 112.777 1.00 0.00 O ATOM 13102 H1 WAT 5856 105.051 45.430 112.786 1.00 0.00 H ATOM 13103 H2 WAT 5856 106.476 45.200 112.330 1.00 0.00 H TER 13105 WAT 5856 ATOM 13105 O WAT 5857 136.712 13.295 107.218 1.00 0.00 O ATOM 13106 H1 WAT 5857 136.508 12.410 106.916 1.00 0.00 H ATOM 13107 H2 WAT 5857 136.314 13.348 108.088 1.00 0.00 H TER 13109 WAT 5857 ATOM 13109 O WAT 5858 133.839 98.802 98.661 1.00 0.00 O ATOM 13110 H1 WAT 5858 133.209 98.119 98.429 1.00 0.00 H ATOM 13111 H2 WAT 5858 134.010 98.663 99.593 1.00 0.00 H TER 13113 WAT 5858 ATOM 13113 O WAT 5859 63.216 39.396 65.403 1.00 0.00 O ATOM 13114 H1 WAT 5859 63.127 39.528 66.347 1.00 0.00 H ATOM 13115 H2 WAT 5859 62.345 39.580 65.052 1.00 0.00 H TER 13117 WAT 5859 ATOM 13117 O WAT 5860 115.139 51.386 98.339 1.00 0.00 O ATOM 13118 H1 WAT 5860 115.602 51.809 99.063 1.00 0.00 H ATOM 13119 H2 WAT 5860 114.687 50.646 98.744 1.00 0.00 H TER 13121 WAT 5860 ATOM 13121 O WAT 5861 118.542 122.624 84.819 1.00 0.00 O ATOM 13122 H1 WAT 5861 117.855 122.829 84.184 1.00 0.00 H ATOM 13123 H2 WAT 5861 118.138 122.789 85.671 1.00 0.00 H TER 13125 WAT 5861 ATOM 13125 O WAT 5862 79.795 135.495 125.292 1.00 0.00 O ATOM 13126 H1 WAT 5862 80.332 135.042 125.942 1.00 0.00 H ATOM 13127 H2 WAT 5862 79.484 136.280 125.744 1.00 0.00 H TER 13129 WAT 5862 ATOM 13129 O WAT 5863 73.832 14.584 11.055 1.00 0.00 O ATOM 13130 H1 WAT 5863 74.325 15.218 10.534 1.00 0.00 H ATOM 13131 H2 WAT 5863 73.901 14.907 11.953 1.00 0.00 H TER 13133 WAT 5863 ATOM 13133 O WAT 5864 120.262 135.050 18.598 1.00 0.00 O ATOM 13134 H1 WAT 5864 119.930 134.856 19.475 1.00 0.00 H ATOM 13135 H2 WAT 5864 119.780 134.456 18.023 1.00 0.00 H TER 13137 WAT 5864 ATOM 13137 O WAT 5865 5.501 133.094 17.496 1.00 0.00 O ATOM 13138 H1 WAT 5865 6.178 132.629 17.004 1.00 0.00 H ATOM 13139 H2 WAT 5865 5.221 132.471 18.167 1.00 0.00 H TER 13141 WAT 5865 ATOM 13141 O WAT 5866 113.382 15.687 85.656 1.00 0.00 O ATOM 13142 H1 WAT 5866 113.476 14.752 85.476 1.00 0.00 H ATOM 13143 H2 WAT 5866 113.172 15.732 86.588 1.00 0.00 H TER 13145 WAT 5866 ATOM 13145 O WAT 5867 17.169 80.809 16.433 1.00 0.00 O ATOM 13146 H1 WAT 5867 16.874 79.927 16.209 1.00 0.00 H ATOM 13147 H2 WAT 5867 17.511 80.728 17.323 1.00 0.00 H TER 13149 WAT 5867 ATOM 13149 O WAT 5868 116.385 144.039 21.451 1.00 0.00 O ATOM 13150 H1 WAT 5868 115.786 144.168 22.187 1.00 0.00 H ATOM 13151 H2 WAT 5868 115.841 143.656 20.763 1.00 0.00 H TER 13153 WAT 5868 ATOM 13153 O WAT 5869 55.079 97.347 104.525 1.00 0.00 O ATOM 13154 H1 WAT 5869 54.894 97.691 105.399 1.00 0.00 H ATOM 13155 H2 WAT 5869 54.805 98.044 103.930 1.00 0.00 H TER 13157 WAT 5869 ATOM 13157 O WAT 5870 118.980 84.967 19.332 1.00 0.00 O ATOM 13158 H1 WAT 5870 119.293 85.065 18.433 1.00 0.00 H ATOM 13159 H2 WAT 5870 119.604 85.467 19.859 1.00 0.00 H TER 13161 WAT 5870 ATOM 13161 O WAT 5871 10.162 6.242 101.237 1.00 0.00 O ATOM 13162 H1 WAT 5871 10.284 5.459 100.700 1.00 0.00 H ATOM 13163 H2 WAT 5871 10.155 6.964 100.610 1.00 0.00 H TER 13165 WAT 5871 ATOM 13165 O WAT 5872 32.450 111.664 91.391 1.00 0.00 O ATOM 13166 H1 WAT 5872 31.511 111.845 91.436 1.00 0.00 H ATOM 13167 H2 WAT 5872 32.825 112.446 90.984 1.00 0.00 H TER 13169 WAT 5872 ATOM 13169 O WAT 5873 45.014 97.157 14.415 1.00 0.00 O ATOM 13170 H1 WAT 5873 44.689 97.902 13.909 1.00 0.00 H ATOM 13171 H2 WAT 5873 45.403 97.550 15.196 1.00 0.00 H TER 13173 WAT 5873 ATOM 13173 O WAT 5874 16.627 6.389 20.254 1.00 0.00 O ATOM 13174 H1 WAT 5874 16.123 5.925 19.585 1.00 0.00 H ATOM 13175 H2 WAT 5874 16.316 6.024 21.083 1.00 0.00 H TER 13177 WAT 5874 ATOM 13177 O WAT 5875 131.781 4.923 90.897 1.00 0.00 O ATOM 13178 H1 WAT 5875 131.770 5.581 91.592 1.00 0.00 H ATOM 13179 H2 WAT 5875 132.708 4.713 90.782 1.00 0.00 H TER 13181 WAT 5875 ATOM 13181 O WAT 5876 115.798 48.789 68.612 1.00 0.00 O ATOM 13182 H1 WAT 5876 115.280 49.247 67.950 1.00 0.00 H ATOM 13183 H2 WAT 5876 115.532 49.186 69.441 1.00 0.00 H TER 13185 WAT 5876 ATOM 13185 O WAT 5877 102.589 7.957 63.150 1.00 0.00 O ATOM 13186 H1 WAT 5877 102.906 7.379 63.844 1.00 0.00 H ATOM 13187 H2 WAT 5877 103.174 8.714 63.183 1.00 0.00 H TER 13189 WAT 5877 ATOM 13189 O WAT 5878 77.033 141.217 60.416 1.00 0.00 O ATOM 13190 H1 WAT 5878 77.846 141.431 59.957 1.00 0.00 H ATOM 13191 H2 WAT 5878 76.412 141.010 59.718 1.00 0.00 H TER 13193 WAT 5878 ATOM 13193 O WAT 5879 28.580 110.746 135.703 1.00 0.00 O ATOM 13194 H1 WAT 5879 28.829 111.670 135.687 1.00 0.00 H ATOM 13195 H2 WAT 5879 28.369 110.570 136.620 1.00 0.00 H TER 13197 WAT 5879 ATOM 13197 O WAT 5880 116.382 30.385 119.488 1.00 0.00 O ATOM 13198 H1 WAT 5880 116.170 29.463 119.340 1.00 0.00 H ATOM 13199 H2 WAT 5880 116.888 30.386 120.300 1.00 0.00 H TER 13201 WAT 5880 ATOM 13201 O WAT 5881 53.664 95.662 107.937 1.00 0.00 O ATOM 13202 H1 WAT 5881 54.492 95.842 107.492 1.00 0.00 H ATOM 13203 H2 WAT 5881 53.270 94.952 107.432 1.00 0.00 H TER 13205 WAT 5881 ATOM 13205 O WAT 5882 109.588 128.750 149.789 1.00 0.00 O ATOM 13206 H1 WAT 5882 108.917 128.599 150.454 1.00 0.00 H ATOM 13207 H2 WAT 5882 109.823 127.874 149.483 1.00 0.00 H TER 13209 WAT 5882 ATOM 13209 O WAT 5883 80.148 115.574 91.493 1.00 0.00 O ATOM 13210 H1 WAT 5883 80.765 115.006 91.954 1.00 0.00 H ATOM 13211 H2 WAT 5883 79.976 115.121 90.668 1.00 0.00 H TER 13213 WAT 5883 ATOM 13213 O WAT 5884 17.372 126.875 107.531 1.00 0.00 O ATOM 13214 H1 WAT 5884 17.144 126.032 107.923 1.00 0.00 H ATOM 13215 H2 WAT 5884 16.907 127.521 108.063 1.00 0.00 H TER 13217 WAT 5884 ATOM 13217 O WAT 5885 76.122 86.814 132.423 1.00 0.00 O ATOM 13218 H1 WAT 5885 76.164 87.723 132.128 1.00 0.00 H ATOM 13219 H2 WAT 5885 75.224 86.705 132.737 1.00 0.00 H TER 13221 WAT 5885 ATOM 13221 O WAT 5886 31.994 103.996 126.556 1.00 0.00 O ATOM 13222 H1 WAT 5886 32.177 103.850 127.484 1.00 0.00 H ATOM 13223 H2 WAT 5886 31.418 104.761 126.543 1.00 0.00 H TER 13225 WAT 5886 ATOM 13225 O WAT 5887 139.175 118.447 120.601 1.00 0.00 O ATOM 13226 H1 WAT 5887 139.184 117.513 120.393 1.00 0.00 H ATOM 13227 H2 WAT 5887 138.278 118.726 120.415 1.00 0.00 H TER 13229 WAT 5887 ATOM 13229 O WAT 5888 61.067 78.334 79.368 1.00 0.00 O ATOM 13230 H1 WAT 5888 60.476 78.312 78.616 1.00 0.00 H ATOM 13231 H2 WAT 5888 60.669 77.740 80.004 1.00 0.00 H TER 13233 WAT 5888 ATOM 13233 O WAT 5889 137.674 62.007 119.701 1.00 0.00 O ATOM 13234 H1 WAT 5889 136.845 62.024 120.179 1.00 0.00 H ATOM 13235 H2 WAT 5889 137.701 61.139 119.297 1.00 0.00 H TER 13237 WAT 5889 ATOM 13237 O WAT 5890 47.732 65.892 64.724 1.00 0.00 O ATOM 13238 H1 WAT 5890 47.697 65.236 64.027 1.00 0.00 H ATOM 13239 H2 WAT 5890 47.907 65.387 65.518 1.00 0.00 H TER 13241 WAT 5890 ATOM 13241 O WAT 5891 82.690 52.286 123.741 1.00 0.00 O ATOM 13242 H1 WAT 5891 82.227 52.453 124.562 1.00 0.00 H ATOM 13243 H2 WAT 5891 82.718 51.332 123.671 1.00 0.00 H TER 13245 WAT 5891 ATOM 13245 O WAT 5892 59.637 52.990 102.144 1.00 0.00 O ATOM 13246 H1 WAT 5892 60.483 53.234 101.768 1.00 0.00 H ATOM 13247 H2 WAT 5892 59.853 52.617 102.999 1.00 0.00 H TER 13249 WAT 5892 ATOM 13249 O WAT 5893 51.363 64.929 130.784 1.00 0.00 O ATOM 13250 H1 WAT 5893 50.961 64.148 130.404 1.00 0.00 H ATOM 13251 H2 WAT 5893 52.083 64.592 131.318 1.00 0.00 H TER 13253 WAT 5893 ATOM 13253 O WAT 5894 43.639 7.375 20.196 1.00 0.00 O ATOM 13254 H1 WAT 5894 43.595 8.044 19.512 1.00 0.00 H ATOM 13255 H2 WAT 5894 44.482 7.524 20.622 1.00 0.00 H TER 13257 WAT 5894 ATOM 13257 O WAT 5895 83.917 65.841 83.122 1.00 0.00 O ATOM 13258 H1 WAT 5895 84.760 65.764 82.674 1.00 0.00 H ATOM 13259 H2 WAT 5895 84.090 65.534 84.012 1.00 0.00 H TER 13261 WAT 5895 ATOM 13261 O WAT 5896 23.147 73.745 120.824 1.00 0.00 O ATOM 13262 H1 WAT 5896 22.618 74.531 120.964 1.00 0.00 H ATOM 13263 H2 WAT 5896 23.032 73.541 119.896 1.00 0.00 H TER 13265 WAT 5896 ATOM 13265 O WAT 5897 90.212 125.279 142.449 1.00 0.00 O ATOM 13266 H1 WAT 5897 89.590 125.998 142.558 1.00 0.00 H ATOM 13267 H2 WAT 5897 90.529 125.100 143.334 1.00 0.00 H TER 13269 WAT 5897 ATOM 13269 O WAT 5898 41.712 41.233 129.348 1.00 0.00 O ATOM 13270 H1 WAT 5898 42.592 40.936 129.117 1.00 0.00 H ATOM 13271 H2 WAT 5898 41.128 40.675 128.835 1.00 0.00 H TER 13273 WAT 5898 ATOM 13273 O WAT 5899 126.834 52.559 151.617 1.00 0.00 O ATOM 13274 H1 WAT 5899 126.509 52.481 152.514 1.00 0.00 H ATOM 13275 H2 WAT 5899 126.496 53.401 151.313 1.00 0.00 H TER 13277 WAT 5899 ATOM 13277 O WAT 5900 51.363 41.300 157.404 1.00 0.00 O ATOM 13278 H1 WAT 5900 51.273 40.706 156.659 1.00 0.00 H ATOM 13279 H2 WAT 5900 52.251 41.148 157.725 1.00 0.00 H TER 13281 WAT 5900 ATOM 13281 O WAT 5901 2.015 130.515 74.368 1.00 0.00 O ATOM 13282 H1 WAT 5901 1.188 130.547 74.848 1.00 0.00 H ATOM 13283 H2 WAT 5901 2.602 131.085 74.865 1.00 0.00 H TER 13285 WAT 5901 ATOM 13285 O WAT 5902 97.364 135.717 95.219 1.00 0.00 O ATOM 13286 H1 WAT 5902 96.629 136.303 95.399 1.00 0.00 H ATOM 13287 H2 WAT 5902 98.141 136.259 95.354 1.00 0.00 H TER 13289 WAT 5902 ATOM 13289 O WAT 5903 88.148 140.054 20.058 1.00 0.00 O ATOM 13290 H1 WAT 5903 89.002 139.749 19.753 1.00 0.00 H ATOM 13291 H2 WAT 5903 88.022 139.616 20.899 1.00 0.00 H TER 13293 WAT 5903 ATOM 13293 O WAT 5904 9.166 103.799 60.203 1.00 0.00 O ATOM 13294 H1 WAT 5904 8.243 103.547 60.181 1.00 0.00 H ATOM 13295 H2 WAT 5904 9.553 103.233 60.870 1.00 0.00 H TER 13297 WAT 5904 ATOM 13297 O WAT 5905 82.382 117.293 124.203 1.00 0.00 O ATOM 13298 H1 WAT 5905 82.009 118.100 124.559 1.00 0.00 H ATOM 13299 H2 WAT 5905 82.838 117.570 123.408 1.00 0.00 H TER 13301 WAT 5905 ATOM 13301 O WAT 5906 9.881 87.641 110.113 1.00 0.00 O ATOM 13302 H1 WAT 5906 10.198 86.843 110.537 1.00 0.00 H ATOM 13303 H2 WAT 5906 9.040 87.818 110.534 1.00 0.00 H TER 13305 WAT 5906 ATOM 13305 O WAT 5907 60.689 114.201 138.893 1.00 0.00 O ATOM 13306 H1 WAT 5907 61.368 114.676 138.415 1.00 0.00 H ATOM 13307 H2 WAT 5907 61.110 113.382 139.156 1.00 0.00 H TER 13309 WAT 5907 ATOM 13309 O WAT 5908 105.421 48.049 9.690 1.00 0.00 O ATOM 13310 H1 WAT 5908 104.759 47.857 9.026 1.00 0.00 H ATOM 13311 H2 WAT 5908 106.220 48.214 9.191 1.00 0.00 H TER 13313 WAT 5908 ATOM 13313 O WAT 5909 37.767 16.123 76.069 1.00 0.00 O ATOM 13314 H1 WAT 5909 37.403 15.513 76.711 1.00 0.00 H ATOM 13315 H2 WAT 5909 38.478 16.564 76.533 1.00 0.00 H TER 13317 WAT 5909 ATOM 13317 O WAT 5910 3.163 139.224 79.062 1.00 0.00 O ATOM 13318 H1 WAT 5910 2.745 139.932 78.572 1.00 0.00 H ATOM 13319 H2 WAT 5910 2.454 138.838 79.576 1.00 0.00 H TER 13321 WAT 5910 ATOM 13321 O WAT 5911 70.382 98.635 9.267 1.00 0.00 O ATOM 13322 H1 WAT 5911 70.105 97.719 9.294 1.00 0.00 H ATOM 13323 H2 WAT 5911 71.306 98.613 9.518 1.00 0.00 H TER 13325 WAT 5911 ATOM 13325 O WAT 5912 68.429 28.952 126.563 1.00 0.00 O ATOM 13326 H1 WAT 5912 68.537 29.840 126.222 1.00 0.00 H ATOM 13327 H2 WAT 5912 69.307 28.573 126.527 1.00 0.00 H TER 13329 WAT 5912 ATOM 13329 O WAT 5913 119.394 122.621 148.112 1.00 0.00 O ATOM 13330 H1 WAT 5913 120.336 122.451 148.089 1.00 0.00 H ATOM 13331 H2 WAT 5913 119.205 122.795 149.034 1.00 0.00 H TER 13333 WAT 5913 ATOM 13333 O WAT 5914 67.549 18.028 130.299 1.00 0.00 O ATOM 13334 H1 WAT 5914 68.029 18.816 130.045 1.00 0.00 H ATOM 13335 H2 WAT 5914 66.998 18.308 131.029 1.00 0.00 H TER 13337 WAT 5914 ATOM 13337 O WAT 5915 22.822 50.732 102.166 1.00 0.00 O ATOM 13338 H1 WAT 5915 22.143 51.053 101.572 1.00 0.00 H ATOM 13339 H2 WAT 5915 22.472 50.899 103.041 1.00 0.00 H TER 13341 WAT 5915 ATOM 13341 O WAT 5916 76.602 95.599 8.150 1.00 0.00 O ATOM 13342 H1 WAT 5916 77.351 96.112 8.456 1.00 0.00 H ATOM 13343 H2 WAT 5916 76.303 96.057 7.364 1.00 0.00 H TER 13345 WAT 5916 ATOM 13345 O WAT 5917 103.914 132.318 124.791 1.00 0.00 O ATOM 13346 H1 WAT 5917 104.492 132.552 125.517 1.00 0.00 H ATOM 13347 H2 WAT 5917 104.502 132.208 124.043 1.00 0.00 H TER 13349 WAT 5917 ATOM 13349 O WAT 5918 35.979 8.547 21.990 1.00 0.00 O ATOM 13350 H1 WAT 5918 36.166 8.195 22.861 1.00 0.00 H ATOM 13351 H2 WAT 5918 36.711 8.250 21.450 1.00 0.00 H TER 13353 WAT 5918 ATOM 13353 O WAT 5919 27.633 5.825 152.318 1.00 0.00 O ATOM 13354 H1 WAT 5919 27.263 6.314 151.583 1.00 0.00 H ATOM 13355 H2 WAT 5919 28.438 6.295 152.537 1.00 0.00 H TER 13357 WAT 5919 ATOM 13357 O WAT 5920 57.823 55.308 3.894 1.00 0.00 O ATOM 13358 H1 WAT 5920 57.456 55.057 3.046 1.00 0.00 H ATOM 13359 H2 WAT 5920 58.195 56.177 3.746 1.00 0.00 H TER 13361 WAT 5920 ATOM 13361 O WAT 5921 49.465 111.495 72.587 1.00 0.00 O ATOM 13362 H1 WAT 5921 49.521 112.317 72.099 1.00 0.00 H ATOM 13363 H2 WAT 5921 50.277 111.035 72.375 1.00 0.00 H TER 13365 WAT 5921 ATOM 13365 O WAT 5922 51.239 119.163 140.470 1.00 0.00 O ATOM 13366 H1 WAT 5922 51.686 119.941 140.804 1.00 0.00 H ATOM 13367 H2 WAT 5922 50.475 119.065 141.038 1.00 0.00 H TER 13369 WAT 5922 ATOM 13369 O WAT 5923 46.766 125.500 67.268 1.00 0.00 O ATOM 13370 H1 WAT 5923 46.811 125.681 68.207 1.00 0.00 H ATOM 13371 H2 WAT 5923 46.151 126.150 66.928 1.00 0.00 H TER 13373 WAT 5923 ATOM 13373 O WAT 5924 127.389 8.812 15.112 1.00 0.00 O ATOM 13374 H1 WAT 5924 127.126 8.019 15.578 1.00 0.00 H ATOM 13375 H2 WAT 5924 126.676 9.431 15.272 1.00 0.00 H TER 13377 WAT 5924 ATOM 13377 O WAT 5925 127.299 142.734 108.305 1.00 0.00 O ATOM 13378 H1 WAT 5925 128.048 142.649 107.715 1.00 0.00 H ATOM 13379 H2 WAT 5925 126.565 142.950 107.730 1.00 0.00 H TER 13381 WAT 5925 ATOM 13381 O WAT 5926 13.140 74.969 121.997 1.00 0.00 O ATOM 13382 H1 WAT 5926 13.018 75.726 122.571 1.00 0.00 H ATOM 13383 H2 WAT 5926 12.908 74.216 122.541 1.00 0.00 H TER 13385 WAT 5926 ATOM 13385 O WAT 5927 42.066 112.312 61.767 1.00 0.00 O ATOM 13386 H1 WAT 5927 41.595 113.107 62.016 1.00 0.00 H ATOM 13387 H2 WAT 5927 42.083 111.784 62.565 1.00 0.00 H TER 13389 WAT 5927 ATOM 13389 O WAT 5928 8.929 116.558 136.984 1.00 0.00 O ATOM 13390 H1 WAT 5928 9.316 117.296 137.455 1.00 0.00 H ATOM 13391 H2 WAT 5928 8.342 116.963 136.346 1.00 0.00 H TER 13393 WAT 5928 ATOM 13393 O WAT 5929 90.883 113.023 157.724 1.00 0.00 O ATOM 13394 H1 WAT 5929 90.155 112.506 157.379 1.00 0.00 H ATOM 13395 H2 WAT 5929 90.472 113.817 158.066 1.00 0.00 H TER 13397 WAT 5929 ATOM 13397 O WAT 5930 120.088 35.494 115.437 1.00 0.00 O ATOM 13398 H1 WAT 5930 120.789 35.066 114.945 1.00 0.00 H ATOM 13399 H2 WAT 5930 120.298 35.320 116.354 1.00 0.00 H TER 13401 WAT 5930 ATOM 13401 O WAT 5931 41.115 59.834 92.070 1.00 0.00 O ATOM 13402 H1 WAT 5931 40.534 59.221 92.519 1.00 0.00 H ATOM 13403 H2 WAT 5931 41.720 60.132 92.749 1.00 0.00 H TER 13405 WAT 5931 ATOM 13405 O WAT 5932 48.352 89.273 86.739 1.00 0.00 O ATOM 13406 H1 WAT 5932 48.919 90.026 86.574 1.00 0.00 H ATOM 13407 H2 WAT 5932 48.954 88.562 86.958 1.00 0.00 H TER 13409 WAT 5932 ATOM 13409 O WAT 5933 48.131 51.879 10.984 1.00 0.00 O ATOM 13410 H1 WAT 5933 48.731 52.227 11.643 1.00 0.00 H ATOM 13411 H2 WAT 5933 47.305 51.756 11.453 1.00 0.00 H TER 13413 WAT 5933 ATOM 13413 O WAT 5934 89.394 43.337 120.590 1.00 0.00 O ATOM 13414 H1 WAT 5934 89.536 43.379 119.645 1.00 0.00 H ATOM 13415 H2 WAT 5934 88.678 42.711 120.697 1.00 0.00 H TER 13417 WAT 5934 ATOM 13417 O WAT 5935 86.285 130.090 139.797 1.00 0.00 O ATOM 13418 H1 WAT 5935 86.109 129.171 139.596 1.00 0.00 H ATOM 13419 H2 WAT 5935 86.840 130.063 140.577 1.00 0.00 H TER 13421 WAT 5935 ATOM 13421 O WAT 5936 122.399 58.682 153.870 1.00 0.00 O ATOM 13422 H1 WAT 5936 121.501 58.361 153.780 1.00 0.00 H ATOM 13423 H2 WAT 5936 122.460 59.402 153.242 1.00 0.00 H TER 13425 WAT 5936 ATOM 13425 O WAT 5937 45.954 137.262 15.071 1.00 0.00 O ATOM 13426 H1 WAT 5937 46.608 136.590 15.262 1.00 0.00 H ATOM 13427 H2 WAT 5937 45.849 137.736 15.896 1.00 0.00 H TER 13429 WAT 5937 ATOM 13429 O WAT 5938 107.843 144.057 138.774 1.00 0.00 O ATOM 13430 H1 WAT 5938 108.232 144.469 138.003 1.00 0.00 H ATOM 13431 H2 WAT 5938 108.588 143.862 139.343 1.00 0.00 H TER 13433 WAT 5938 ATOM 13433 O WAT 5939 107.288 0.165 132.296 1.00 0.00 O ATOM 13434 H1 WAT 5939 107.686 0.995 132.031 1.00 0.00 H ATOM 13435 H2 WAT 5939 107.049 0.296 133.213 1.00 0.00 H TER 13437 WAT 5939 ATOM 13437 O WAT 5940 112.200 23.005 141.323 1.00 0.00 O ATOM 13438 H1 WAT 5940 112.347 23.762 140.756 1.00 0.00 H ATOM 13439 H2 WAT 5940 113.073 22.642 141.470 1.00 0.00 H TER 13441 WAT 5940 ATOM 13441 O WAT 5941 9.893 34.973 12.064 1.00 0.00 O ATOM 13442 H1 WAT 5941 9.495 34.220 11.627 1.00 0.00 H ATOM 13443 H2 WAT 5941 9.158 35.558 12.249 1.00 0.00 H TER 13445 WAT 5941 ATOM 13445 O WAT 5942 35.780 9.970 149.795 1.00 0.00 O ATOM 13446 H1 WAT 5942 35.948 9.434 150.571 1.00 0.00 H ATOM 13447 H2 WAT 5942 35.324 10.741 150.131 1.00 0.00 H TER 13449 WAT 5942 ATOM 13449 O WAT 5943 68.194 13.416 146.427 1.00 0.00 O ATOM 13450 H1 WAT 5943 68.083 13.212 145.498 1.00 0.00 H ATOM 13451 H2 WAT 5943 68.995 13.938 146.464 1.00 0.00 H TER 13453 WAT 5943 ATOM 13453 O WAT 5944 66.799 4.498 144.154 1.00 0.00 O ATOM 13454 H1 WAT 5944 66.950 4.944 144.988 1.00 0.00 H ATOM 13455 H2 WAT 5944 67.268 5.029 143.510 1.00 0.00 H TER 13457 WAT 5944 ATOM 13457 O WAT 5945 52.873 75.100 16.708 1.00 0.00 O ATOM 13458 H1 WAT 5945 53.165 74.232 16.429 1.00 0.00 H ATOM 13459 H2 WAT 5945 52.023 75.215 16.283 1.00 0.00 H TER 13461 WAT 5945 ATOM 13461 O WAT 5946 83.076 96.257 138.734 1.00 0.00 O ATOM 13462 H1 WAT 5946 83.348 96.794 137.990 1.00 0.00 H ATOM 13463 H2 WAT 5946 83.880 96.119 139.236 1.00 0.00 H TER 13465 WAT 5946 ATOM 13465 O WAT 5947 71.129 143.517 92.571 1.00 0.00 O ATOM 13466 H1 WAT 5947 71.868 143.020 92.221 1.00 0.00 H ATOM 13467 H2 WAT 5947 70.788 142.972 93.281 1.00 0.00 H TER 13469 WAT 5947 ATOM 13469 O WAT 5948 48.998 136.969 145.522 1.00 0.00 O ATOM 13470 H1 WAT 5948 48.444 136.524 144.881 1.00 0.00 H ATOM 13471 H2 WAT 5948 49.877 136.934 145.145 1.00 0.00 H TER 13473 WAT 5948 ATOM 13473 O WAT 5949 25.334 66.828 75.359 1.00 0.00 O ATOM 13474 H1 WAT 5949 24.710 66.806 76.085 1.00 0.00 H ATOM 13475 H2 WAT 5949 25.030 66.145 74.761 1.00 0.00 H TER 13477 WAT 5949 ATOM 13477 O WAT 5950 120.668 94.028 79.484 1.00 0.00 O ATOM 13478 H1 WAT 5950 120.300 94.886 79.695 1.00 0.00 H ATOM 13479 H2 WAT 5950 121.227 93.817 80.232 1.00 0.00 H TER 13481 WAT 5950 ATOM 13481 O WAT 5951 47.891 89.983 143.339 1.00 0.00 O ATOM 13482 H1 WAT 5951 48.448 89.310 142.948 1.00 0.00 H ATOM 13483 H2 WAT 5951 48.505 90.605 143.730 1.00 0.00 H TER 13485 WAT 5951 ATOM 13485 O WAT 5952 140.864 22.118 9.596 1.00 0.00 O ATOM 13486 H1 WAT 5952 140.328 22.128 8.803 1.00 0.00 H ATOM 13487 H2 WAT 5952 141.766 22.102 9.275 1.00 0.00 H TER 13489 WAT 5952 ATOM 13489 O WAT 5953 89.762 89.899 154.216 1.00 0.00 O ATOM 13490 H1 WAT 5953 89.520 89.273 153.534 1.00 0.00 H ATOM 13491 H2 WAT 5953 89.631 89.423 155.036 1.00 0.00 H TER 13493 WAT 5953 ATOM 13493 O WAT 5954 59.048 42.077 66.269 1.00 0.00 O ATOM 13494 H1 WAT 5954 58.154 42.325 66.031 1.00 0.00 H ATOM 13495 H2 WAT 5954 59.461 42.898 66.536 1.00 0.00 H TER 13497 WAT 5954 ATOM 13497 O WAT 5955 14.274 42.663 97.754 1.00 0.00 O ATOM 13498 H1 WAT 5955 15.201 42.473 97.897 1.00 0.00 H ATOM 13499 H2 WAT 5955 14.223 42.931 96.836 1.00 0.00 H TER 13501 WAT 5955 ATOM 13501 O WAT 5956 65.770 97.090 71.931 1.00 0.00 O ATOM 13502 H1 WAT 5956 65.947 98.018 71.777 1.00 0.00 H ATOM 13503 H2 WAT 5956 66.127 96.647 71.161 1.00 0.00 H TER 13505 WAT 5956 ATOM 13505 O WAT 5957 72.771 11.082 8.477 1.00 0.00 O ATOM 13506 H1 WAT 5957 72.578 11.354 9.374 1.00 0.00 H ATOM 13507 H2 WAT 5957 72.154 10.370 8.305 1.00 0.00 H TER 13509 WAT 5957 ATOM 13509 O WAT 5958 145.457 141.123 129.734 1.00 0.00 O ATOM 13510 H1 WAT 5958 145.630 141.680 130.493 1.00 0.00 H ATOM 13511 H2 WAT 5958 144.515 140.956 129.769 1.00 0.00 H TER 13513 WAT 5958 ATOM 13513 O WAT 5959 7.006 132.834 0.505 1.00 0.00 O ATOM 13514 H1 WAT 5959 7.110 133.730 0.826 1.00 0.00 H ATOM 13515 H2 WAT 5959 7.579 132.310 1.064 1.00 0.00 H TER 13517 WAT 5959 ATOM 13517 O WAT 5960 14.235 110.634 155.669 1.00 0.00 O ATOM 13518 H1 WAT 5960 14.478 111.018 156.511 1.00 0.00 H ATOM 13519 H2 WAT 5960 14.011 111.385 155.119 1.00 0.00 H TER 13521 WAT 5960 ATOM 13521 O WAT 5961 61.536 12.176 136.581 1.00 0.00 O ATOM 13522 H1 WAT 5961 61.755 12.993 137.029 1.00 0.00 H ATOM 13523 H2 WAT 5961 61.862 11.489 137.163 1.00 0.00 H TER 13525 WAT 5961 ATOM 13525 O WAT 5962 99.722 76.431 96.197 1.00 0.00 O ATOM 13526 H1 WAT 5962 100.673 76.512 96.275 1.00 0.00 H ATOM 13527 H2 WAT 5962 99.423 76.248 97.088 1.00 0.00 H TER 13529 WAT 5962 ATOM 13529 O WAT 5963 77.713 82.251 120.964 1.00 0.00 O ATOM 13530 H1 WAT 5963 77.390 83.145 120.852 1.00 0.00 H ATOM 13531 H2 WAT 5963 76.980 81.696 120.694 1.00 0.00 H TER 13533 WAT 5963 ATOM 13533 O WAT 5964 97.833 65.997 73.370 1.00 0.00 O ATOM 13534 H1 WAT 5964 98.288 65.424 72.753 1.00 0.00 H ATOM 13535 H2 WAT 5964 96.973 65.593 73.484 1.00 0.00 H TER 13537 WAT 5964 ATOM 13537 O WAT 5965 27.418 79.782 106.579 1.00 0.00 O ATOM 13538 H1 WAT 5965 26.710 79.396 106.064 1.00 0.00 H ATOM 13539 H2 WAT 5965 28.117 79.941 105.944 1.00 0.00 H TER 13541 WAT 5965 ATOM 13541 O WAT 5966 92.662 62.790 82.848 1.00 0.00 O ATOM 13542 H1 WAT 5966 91.997 63.109 83.457 1.00 0.00 H ATOM 13543 H2 WAT 5966 92.517 63.296 82.048 1.00 0.00 H TER 13545 WAT 5966 ATOM 13545 O WAT 5967 108.317 89.543 68.673 1.00 0.00 O ATOM 13546 H1 WAT 5967 107.961 88.654 68.674 1.00 0.00 H ATOM 13547 H2 WAT 5967 109.251 89.427 68.847 1.00 0.00 H TER 13549 WAT 5967 ATOM 13549 O WAT 5968 61.231 2.207 25.131 1.00 0.00 O ATOM 13550 H1 WAT 5968 60.788 1.439 25.493 1.00 0.00 H ATOM 13551 H2 WAT 5968 61.045 2.171 24.193 1.00 0.00 H TER 13553 WAT 5968 ATOM 13553 O WAT 5969 122.266 93.404 89.586 1.00 0.00 O ATOM 13554 H1 WAT 5969 123.085 93.898 89.566 1.00 0.00 H ATOM 13555 H2 WAT 5969 121.589 94.067 89.721 1.00 0.00 H TER 13557 WAT 5969 ATOM 13557 O WAT 5970 90.337 2.613 9.437 1.00 0.00 O ATOM 13558 H1 WAT 5970 90.870 2.786 10.212 1.00 0.00 H ATOM 13559 H2 WAT 5970 90.914 2.121 8.853 1.00 0.00 H TER 13561 WAT 5970 ATOM 13561 O WAT 5971 60.403 6.237 20.033 1.00 0.00 O ATOM 13562 H1 WAT 5971 60.577 5.608 20.733 1.00 0.00 H ATOM 13563 H2 WAT 5971 61.192 6.216 19.491 1.00 0.00 H TER 13565 WAT 5971 ATOM 13565 O WAT 5972 99.155 106.709 156.245 1.00 0.00 O ATOM 13566 H1 WAT 5972 99.032 106.161 155.470 1.00 0.00 H ATOM 13567 H2 WAT 5972 98.379 106.545 156.781 1.00 0.00 H TER 13569 WAT 5972 ATOM 13569 O WAT 5973 54.976 117.367 96.061 1.00 0.00 O ATOM 13570 H1 WAT 5973 54.177 117.270 95.543 1.00 0.00 H ATOM 13571 H2 WAT 5973 54.666 117.546 96.949 1.00 0.00 H TER 13573 WAT 5973 ATOM 13573 O WAT 5974 29.796 132.981 126.553 1.00 0.00 O ATOM 13574 H1 WAT 5974 29.781 133.936 126.618 1.00 0.00 H ATOM 13575 H2 WAT 5974 29.723 132.804 125.615 1.00 0.00 H TER 13577 WAT 5974 ATOM 13577 O WAT 5975 93.559 133.749 125.495 1.00 0.00 O ATOM 13578 H1 WAT 5975 92.713 133.791 125.049 1.00 0.00 H ATOM 13579 H2 WAT 5975 94.084 133.157 124.957 1.00 0.00 H TER 13581 WAT 5975 ATOM 13581 O WAT 5976 128.312 52.733 99.321 1.00 0.00 O ATOM 13582 H1 WAT 5976 128.231 53.675 99.473 1.00 0.00 H ATOM 13583 H2 WAT 5976 127.669 52.545 98.637 1.00 0.00 H TER 13585 WAT 5976 ATOM 13585 O WAT 5977 64.286 57.718 107.368 1.00 0.00 O ATOM 13586 H1 WAT 5977 63.346 57.557 107.281 1.00 0.00 H ATOM 13587 H2 WAT 5977 64.688 56.858 107.248 1.00 0.00 H TER 13589 WAT 5977 ATOM 13589 O WAT 5978 71.751 88.314 121.486 1.00 0.00 O ATOM 13590 H1 WAT 5978 71.438 87.774 120.760 1.00 0.00 H ATOM 13591 H2 WAT 5978 72.107 87.686 122.115 1.00 0.00 H TER 13593 WAT 5978 ATOM 13593 O WAT 5979 56.756 129.483 124.519 1.00 0.00 O ATOM 13594 H1 WAT 5979 56.440 130.369 124.341 1.00 0.00 H ATOM 13595 H2 WAT 5979 57.619 129.611 124.913 1.00 0.00 H TER 13597 WAT 5979 ATOM 13597 O WAT 5980 144.332 22.025 138.108 1.00 0.00 O ATOM 13598 H1 WAT 5980 143.849 22.273 137.320 1.00 0.00 H ATOM 13599 H2 WAT 5980 144.678 21.154 137.913 1.00 0.00 H TER 13601 WAT 5980 ATOM 13601 O WAT 5981 111.104 124.532 121.774 1.00 0.00 O ATOM 13602 H1 WAT 5981 111.363 125.453 121.782 1.00 0.00 H ATOM 13603 H2 WAT 5981 110.900 124.348 120.858 1.00 0.00 H TER 13605 WAT 5981 ATOM 13605 O WAT 5982 26.121 102.465 13.733 1.00 0.00 O ATOM 13606 H1 WAT 5982 26.702 102.652 14.471 1.00 0.00 H ATOM 13607 H2 WAT 5982 26.644 101.915 13.150 1.00 0.00 H TER 13609 WAT 5982 ATOM 13609 O WAT 5983 134.482 123.152 78.739 1.00 0.00 O ATOM 13610 H1 WAT 5983 135.234 123.486 78.251 1.00 0.00 H ATOM 13611 H2 WAT 5983 134.694 123.327 79.655 1.00 0.00 H TER 13613 WAT 5983 ATOM 13613 O WAT 5984 109.220 2.447 105.473 1.00 0.00 O ATOM 13614 H1 WAT 5984 109.056 3.018 104.723 1.00 0.00 H ATOM 13615 H2 WAT 5984 108.942 1.580 105.179 1.00 0.00 H TER 13617 WAT 5984 ATOM 13617 O WAT 5985 94.838 100.943 60.871 1.00 0.00 O ATOM 13618 H1 WAT 5985 94.252 100.213 61.072 1.00 0.00 H ATOM 13619 H2 WAT 5985 94.539 101.262 60.019 1.00 0.00 H TER 13621 WAT 5985 ATOM 13621 O WAT 5986 51.404 132.496 125.361 1.00 0.00 O ATOM 13622 H1 WAT 5986 51.493 132.607 124.415 1.00 0.00 H ATOM 13623 H2 WAT 5986 51.926 133.205 125.736 1.00 0.00 H TER 13625 WAT 5986 ATOM 13625 O WAT 5987 33.020 51.087 61.349 1.00 0.00 O ATOM 13626 H1 WAT 5987 33.836 50.837 61.783 1.00 0.00 H ATOM 13627 H2 WAT 5987 32.570 51.642 61.985 1.00 0.00 H TER 13629 WAT 5987 ATOM 13629 O WAT 5988 105.814 137.541 131.738 1.00 0.00 O ATOM 13630 H1 WAT 5988 105.226 136.968 132.229 1.00 0.00 H ATOM 13631 H2 WAT 5988 106.296 138.023 132.410 1.00 0.00 H TER 13633 WAT 5988 ATOM 13633 O WAT 5989 104.063 115.464 139.942 1.00 0.00 O ATOM 13634 H1 WAT 5989 104.125 116.410 140.079 1.00 0.00 H ATOM 13635 H2 WAT 5989 104.936 115.133 140.155 1.00 0.00 H TER 13637 WAT 5989 ATOM 13637 O WAT 5990 13.597 114.526 66.936 1.00 0.00 O ATOM 13638 H1 WAT 5990 13.913 113.670 66.644 1.00 0.00 H ATOM 13639 H2 WAT 5990 13.874 115.131 66.247 1.00 0.00 H TER 13641 WAT 5990 ATOM 13641 O WAT 5991 105.141 62.090 15.915 1.00 0.00 O ATOM 13642 H1 WAT 5991 104.193 61.964 15.904 1.00 0.00 H ATOM 13643 H2 WAT 5991 105.439 61.600 16.681 1.00 0.00 H TER 13645 WAT 5991 ATOM 13645 O WAT 5992 131.600 16.647 106.980 1.00 0.00 O ATOM 13646 H1 WAT 5992 131.398 17.335 106.346 1.00 0.00 H ATOM 13647 H2 WAT 5992 132.451 16.895 107.341 1.00 0.00 H TER 13649 WAT 5992 ATOM 13649 O WAT 5993 95.430 62.001 8.517 1.00 0.00 O ATOM 13650 H1 WAT 5993 94.728 62.399 9.032 1.00 0.00 H ATOM 13651 H2 WAT 5993 95.898 62.744 8.136 1.00 0.00 H TER 13653 WAT 5993 ATOM 13653 O WAT 5994 121.774 40.520 98.277 1.00 0.00 O ATOM 13654 H1 WAT 5994 121.265 41.281 98.000 1.00 0.00 H ATOM 13655 H2 WAT 5994 122.395 40.868 98.918 1.00 0.00 H TER 13657 WAT 5994 ATOM 13657 O WAT 5995 77.300 131.571 99.713 1.00 0.00 O ATOM 13658 H1 WAT 5995 77.595 130.673 99.864 1.00 0.00 H ATOM 13659 H2 WAT 5995 77.023 131.581 98.796 1.00 0.00 H TER 13661 WAT 5995 ATOM 13661 O WAT 5996 128.879 140.965 2.066 1.00 0.00 O ATOM 13662 H1 WAT 5996 129.047 141.666 2.695 1.00 0.00 H ATOM 13663 H2 WAT 5996 129.669 140.932 1.527 1.00 0.00 H TER 13665 WAT 5996 ATOM 13665 O WAT 5997 145.446 45.501 129.877 1.00 0.00 O ATOM 13666 H1 WAT 5997 145.199 44.600 130.085 1.00 0.00 H ATOM 13667 H2 WAT 5997 145.554 45.505 128.926 1.00 0.00 H TER 13669 WAT 5997 ATOM 13669 O WAT 5998 3.555 141.388 94.527 1.00 0.00 O ATOM 13670 H1 WAT 5998 2.902 140.904 94.023 1.00 0.00 H ATOM 13671 H2 WAT 5998 3.255 142.296 94.499 1.00 0.00 H TER 13673 WAT 5998 ATOM 13673 O WAT 5999 88.202 66.288 146.289 1.00 0.00 O ATOM 13674 H1 WAT 5999 88.732 65.546 145.995 1.00 0.00 H ATOM 13675 H2 WAT 5999 88.192 66.886 145.542 1.00 0.00 H TER 13677 WAT 5999 ATOM 13677 O WAT 6000 101.605 18.971 79.258 1.00 0.00 O ATOM 13678 H1 WAT 6000 101.636 18.866 80.208 1.00 0.00 H ATOM 13679 H2 WAT 6000 101.044 19.734 79.119 1.00 0.00 H TER 13681 WAT 6000 ATOM 13681 O WAT 6001 96.512 38.619 106.522 1.00 0.00 O ATOM 13682 H1 WAT 6001 96.524 37.662 106.546 1.00 0.00 H ATOM 13683 H2 WAT 6001 97.186 38.882 107.149 1.00 0.00 H TER 13685 WAT 6001 ATOM 13685 O WAT 6002 81.797 34.121 148.932 1.00 0.00 O ATOM 13686 H1 WAT 6002 81.489 34.638 148.188 1.00 0.00 H ATOM 13687 H2 WAT 6002 81.893 34.756 149.641 1.00 0.00 H TER 13689 WAT 6002 ATOM 13689 O WAT 6003 85.360 53.548 10.836 1.00 0.00 O ATOM 13690 H1 WAT 6003 84.540 54.025 10.962 1.00 0.00 H ATOM 13691 H2 WAT 6003 85.511 53.107 11.672 1.00 0.00 H TER 13693 WAT 6003 ATOM 13693 O WAT 6004 45.573 26.617 111.817 1.00 0.00 O ATOM 13694 H1 WAT 6004 45.300 25.742 111.539 1.00 0.00 H ATOM 13695 H2 WAT 6004 46.130 26.462 112.579 1.00 0.00 H TER 13697 WAT 6004 ATOM 13697 O WAT 6005 103.430 21.251 86.040 1.00 0.00 O ATOM 13698 H1 WAT 6005 104.126 21.796 86.408 1.00 0.00 H ATOM 13699 H2 WAT 6005 103.281 20.575 86.700 1.00 0.00 H TER 13701 WAT 6005 ATOM 13701 O WAT 6006 106.294 68.147 78.513 1.00 0.00 O ATOM 13702 H1 WAT 6006 106.959 68.175 77.825 1.00 0.00 H ATOM 13703 H2 WAT 6006 105.499 68.472 78.092 1.00 0.00 H TER 13705 WAT 6006 ATOM 13705 O WAT 6007 52.601 137.355 97.528 1.00 0.00 O ATOM 13706 H1 WAT 6007 52.274 137.867 98.268 1.00 0.00 H ATOM 13707 H2 WAT 6007 53.216 137.940 97.085 1.00 0.00 H TER 13709 WAT 6007 ATOM 13709 O WAT 6008 59.051 12.512 95.079 1.00 0.00 O ATOM 13710 H1 WAT 6008 58.807 11.589 95.153 1.00 0.00 H ATOM 13711 H2 WAT 6008 58.272 12.938 94.723 1.00 0.00 H TER 13713 WAT 6008 ATOM 13713 O WAT 6009 82.609 54.703 129.361 1.00 0.00 O ATOM 13714 H1 WAT 6009 81.877 54.089 129.406 1.00 0.00 H ATOM 13715 H2 WAT 6009 82.783 54.802 128.425 1.00 0.00 H TER 13717 WAT 6009 ATOM 13717 O WAT 6010 96.859 54.747 83.332 1.00 0.00 O ATOM 13718 H1 WAT 6010 97.396 54.997 82.580 1.00 0.00 H ATOM 13719 H2 WAT 6010 97.323 54.007 83.722 1.00 0.00 H TER 13721 WAT 6010 ATOM 13721 O WAT 6011 144.757 34.877 140.213 1.00 0.00 O ATOM 13722 H1 WAT 6011 145.502 35.413 140.484 1.00 0.00 H ATOM 13723 H2 WAT 6011 144.342 34.610 141.034 1.00 0.00 H TER 13725 WAT 6011 ATOM 13725 O WAT 6012 22.621 59.875 114.907 1.00 0.00 O ATOM 13726 H1 WAT 6012 22.345 60.270 115.734 1.00 0.00 H ATOM 13727 H2 WAT 6012 23.272 60.483 114.556 1.00 0.00 H TER 13729 WAT 6012 ATOM 13729 O WAT 6013 39.674 72.666 90.373 1.00 0.00 O ATOM 13730 H1 WAT 6013 39.467 72.704 91.307 1.00 0.00 H ATOM 13731 H2 WAT 6013 39.719 71.731 90.175 1.00 0.00 H TER 13733 WAT 6013 ATOM 13733 O WAT 6014 66.375 121.534 70.837 1.00 0.00 O ATOM 13734 H1 WAT 6014 66.442 121.682 71.780 1.00 0.00 H ATOM 13735 H2 WAT 6014 66.728 120.654 70.707 1.00 0.00 H TER 13737 WAT 6014 ATOM 13737 O WAT 6015 119.786 101.235 20.164 1.00 0.00 O ATOM 13738 H1 WAT 6015 120.181 102.046 20.485 1.00 0.00 H ATOM 13739 H2 WAT 6015 119.103 101.031 20.803 1.00 0.00 H TER 13741 WAT 6015 ATOM 13741 O WAT 6016 22.805 28.148 114.417 1.00 0.00 O ATOM 13742 H1 WAT 6016 22.836 27.770 113.538 1.00 0.00 H ATOM 13743 H2 WAT 6016 22.743 29.091 114.270 1.00 0.00 H TER 13745 WAT 6016 ATOM 13745 O WAT 6017 24.995 126.900 93.898 1.00 0.00 O ATOM 13746 H1 WAT 6017 24.464 127.685 93.763 1.00 0.00 H ATOM 13747 H2 WAT 6017 24.990 126.459 93.048 1.00 0.00 H TER 13749 WAT 6017 ATOM 13749 O WAT 6018 83.179 5.594 87.626 1.00 0.00 O ATOM 13750 H1 WAT 6018 82.729 5.046 88.268 1.00 0.00 H ATOM 13751 H2 WAT 6018 82.845 5.296 86.780 1.00 0.00 H TER 13753 WAT 6018 ATOM 13753 O WAT 6019 144.227 72.498 125.286 1.00 0.00 O ATOM 13754 H1 WAT 6019 144.407 71.639 124.904 1.00 0.00 H ATOM 13755 H2 WAT 6019 143.619 72.319 126.003 1.00 0.00 H TER 13757 WAT 6019 ATOM 13757 O WAT 6020 58.500 75.831 8.580 1.00 0.00 O ATOM 13758 H1 WAT 6020 59.377 75.868 8.199 1.00 0.00 H ATOM 13759 H2 WAT 6020 57.970 76.395 8.017 1.00 0.00 H TER 13761 WAT 6020 ATOM 13761 O WAT 6021 89.581 20.871 6.193 1.00 0.00 O ATOM 13762 H1 WAT 6021 89.302 21.669 6.642 1.00 0.00 H ATOM 13763 H2 WAT 6021 88.829 20.625 5.653 1.00 0.00 H TER 13765 WAT 6021 ATOM 13765 O WAT 6022 77.259 142.756 119.989 1.00 0.00 O ATOM 13766 H1 WAT 6022 76.919 141.873 119.848 1.00 0.00 H ATOM 13767 H2 WAT 6022 77.781 142.939 119.208 1.00 0.00 H TER 13769 WAT 6022 ATOM 13769 O WAT 6023 72.285 97.634 24.445 1.00 0.00 O ATOM 13770 H1 WAT 6023 72.241 96.877 25.029 1.00 0.00 H ATOM 13771 H2 WAT 6023 72.323 98.388 25.032 1.00 0.00 H TER 13773 WAT 6023 ATOM 13773 O WAT 6024 117.812 88.812 22.018 1.00 0.00 O ATOM 13774 H1 WAT 6024 116.917 88.625 22.303 1.00 0.00 H ATOM 13775 H2 WAT 6024 117.728 89.027 21.089 1.00 0.00 H TER 13777 WAT 6024 ATOM 13777 O WAT 6025 83.611 23.769 101.796 1.00 0.00 O ATOM 13778 H1 WAT 6025 82.823 23.230 101.727 1.00 0.00 H ATOM 13779 H2 WAT 6025 83.398 24.421 102.463 1.00 0.00 H TER 13781 WAT 6025 ATOM 13781 O WAT 6026 15.665 38.912 93.191 1.00 0.00 O ATOM 13782 H1 WAT 6026 16.576 38.838 93.474 1.00 0.00 H ATOM 13783 H2 WAT 6026 15.155 38.815 93.995 1.00 0.00 H TER 13785 WAT 6026 ATOM 13785 O WAT 6027 2.919 4.578 117.553 1.00 0.00 O ATOM 13786 H1 WAT 6027 2.027 4.346 117.813 1.00 0.00 H ATOM 13787 H2 WAT 6027 3.058 4.111 116.730 1.00 0.00 H TER 13789 WAT 6027 ATOM 13789 O WAT 6028 113.762 60.602 25.427 1.00 0.00 O ATOM 13790 H1 WAT 6028 114.041 59.690 25.339 1.00 0.00 H ATOM 13791 H2 WAT 6028 114.573 61.087 25.582 1.00 0.00 H TER 13793 WAT 6028 ATOM 13793 O WAT 6029 127.270 94.764 132.209 1.00 0.00 O ATOM 13794 H1 WAT 6029 127.184 94.149 131.480 1.00 0.00 H ATOM 13795 H2 WAT 6029 126.387 95.111 132.335 1.00 0.00 H TER 13797 WAT 6029 ATOM 13797 O WAT 6030 91.485 23.013 157.353 1.00 0.00 O ATOM 13798 H1 WAT 6030 90.824 22.391 157.657 1.00 0.00 H ATOM 13799 H2 WAT 6030 91.254 23.837 157.781 1.00 0.00 H TER 13801 WAT 6030 ATOM 13801 O WAT 6031 76.196 28.307 132.032 1.00 0.00 O ATOM 13802 H1 WAT 6031 76.557 27.421 132.056 1.00 0.00 H ATOM 13803 H2 WAT 6031 75.904 28.422 131.128 1.00 0.00 H TER 13805 WAT 6031 ATOM 13805 O WAT 6032 0.088 88.791 68.761 1.00 0.00 O ATOM 13806 H1 WAT 6032 0.901 88.372 69.042 1.00 0.00 H ATOM 13807 H2 WAT 6032 -0.358 89.020 69.577 1.00 0.00 H TER 13809 WAT 6032 ATOM 13809 O WAT 6033 18.225 40.964 79.231 1.00 0.00 O ATOM 13810 H1 WAT 6033 17.855 41.242 80.069 1.00 0.00 H ATOM 13811 H2 WAT 6033 18.162 40.009 79.247 1.00 0.00 H TER 13813 WAT 6033 ATOM 13813 O WAT 6034 68.525 88.419 11.810 1.00 0.00 O ATOM 13814 H1 WAT 6034 68.620 87.650 11.248 1.00 0.00 H ATOM 13815 H2 WAT 6034 68.931 89.130 11.313 1.00 0.00 H TER 13817 WAT 6034 ATOM 13817 O WAT 6035 15.575 7.692 98.401 1.00 0.00 O ATOM 13818 H1 WAT 6035 15.044 8.485 98.323 1.00 0.00 H ATOM 13819 H2 WAT 6035 15.209 7.232 99.156 1.00 0.00 H TER 13821 WAT 6035 ATOM 13821 O WAT 6036 117.001 52.858 94.393 1.00 0.00 O ATOM 13822 H1 WAT 6036 117.329 52.129 93.866 1.00 0.00 H ATOM 13823 H2 WAT 6036 117.790 53.305 94.700 1.00 0.00 H TER 13825 WAT 6036 ATOM 13825 O WAT 6037 116.602 74.475 158.076 1.00 0.00 O ATOM 13826 H1 WAT 6037 116.966 73.669 158.443 1.00 0.00 H ATOM 13827 H2 WAT 6037 117.339 75.086 158.062 1.00 0.00 H TER 13829 WAT 6037 ATOM 13829 O WAT 6038 30.293 118.296 91.501 1.00 0.00 O ATOM 13830 H1 WAT 6038 30.150 117.424 91.870 1.00 0.00 H ATOM 13831 H2 WAT 6038 30.497 118.135 90.579 1.00 0.00 H TER 13833 WAT 6038 ATOM 13833 O WAT 6039 65.146 107.545 108.631 1.00 0.00 O ATOM 13834 H1 WAT 6039 65.418 107.955 109.452 1.00 0.00 H ATOM 13835 H2 WAT 6039 64.604 106.804 108.902 1.00 0.00 H TER 13837 WAT 6039 ATOM 13837 O WAT 6040 8.626 41.817 156.090 1.00 0.00 O ATOM 13838 H1 WAT 6040 7.927 41.742 156.740 1.00 0.00 H ATOM 13839 H2 WAT 6040 9.430 41.651 156.583 1.00 0.00 H TER 13841 WAT 6040 ATOM 13841 O WAT 6041 28.514 132.411 140.893 1.00 0.00 O ATOM 13842 H1 WAT 6041 29.144 132.953 140.418 1.00 0.00 H ATOM 13843 H2 WAT 6041 27.694 132.520 140.412 1.00 0.00 H TER 13845 WAT 6041 ATOM 13845 O WAT 6042 138.958 101.527 4.931 1.00 0.00 O ATOM 13846 H1 WAT 6042 138.969 101.738 3.998 1.00 0.00 H ATOM 13847 H2 WAT 6042 139.882 101.471 5.175 1.00 0.00 H TER 13849 WAT 6042 ATOM 13849 O WAT 6043 41.733 23.140 2.619 1.00 0.00 O ATOM 13850 H1 WAT 6043 42.191 23.898 2.256 1.00 0.00 H ATOM 13851 H2 WAT 6043 40.892 23.489 2.917 1.00 0.00 H TER 13853 WAT 6043 ATOM 13853 O WAT 6044 24.356 100.548 96.168 1.00 0.00 O ATOM 13854 H1 WAT 6044 24.765 101.003 95.431 1.00 0.00 H ATOM 13855 H2 WAT 6044 24.950 100.700 96.903 1.00 0.00 H TER 13857 WAT 6044 ATOM 13857 O WAT 6045 61.294 141.716 61.459 1.00 0.00 O ATOM 13858 H1 WAT 6045 61.459 141.575 60.527 1.00 0.00 H ATOM 13859 H2 WAT 6045 60.795 140.947 61.733 1.00 0.00 H TER 13861 WAT 6045 ATOM 13861 O WAT 6046 127.340 99.664 2.260 1.00 0.00 O ATOM 13862 H1 WAT 6046 126.622 99.310 2.786 1.00 0.00 H ATOM 13863 H2 WAT 6046 127.389 100.586 2.511 1.00 0.00 H TER 13865 WAT 6046 ATOM 13865 O WAT 6047 140.377 33.970 76.648 1.00 0.00 O ATOM 13866 H1 WAT 6047 139.731 34.504 76.185 1.00 0.00 H ATOM 13867 H2 WAT 6047 140.818 33.476 75.957 1.00 0.00 H TER 13869 WAT 6047 ATOM 13869 O WAT 6048 0.899 116.916 61.611 1.00 0.00 O ATOM 13870 H1 WAT 6048 0.641 117.073 60.703 1.00 0.00 H ATOM 13871 H2 WAT 6048 0.687 117.732 62.064 1.00 0.00 H TER 13873 WAT 6048 ATOM 13873 O WAT 6049 65.949 139.744 109.916 1.00 0.00 O ATOM 13874 H1 WAT 6049 66.566 139.044 109.703 1.00 0.00 H ATOM 13875 H2 WAT 6049 65.187 139.568 109.364 1.00 0.00 H TER 13877 WAT 6049 ATOM 13877 O WAT 6050 140.553 93.917 82.638 1.00 0.00 O ATOM 13878 H1 WAT 6050 141.060 94.211 83.395 1.00 0.00 H ATOM 13879 H2 WAT 6050 139.808 93.449 83.015 1.00 0.00 H TER 13881 WAT 6050 ATOM 13881 O WAT 6051 138.550 74.392 66.746 1.00 0.00 O ATOM 13882 H1 WAT 6051 137.813 74.973 66.557 1.00 0.00 H ATOM 13883 H2 WAT 6051 139.318 74.868 66.430 1.00 0.00 H TER 13885 WAT 6051 ATOM 13885 O WAT 6052 0.835 60.724 128.303 1.00 0.00 O ATOM 13886 H1 WAT 6052 0.172 60.801 127.617 1.00 0.00 H ATOM 13887 H2 WAT 6052 1.518 60.176 127.915 1.00 0.00 H TER 13889 WAT 6052 ATOM 13889 O WAT 6053 95.620 136.687 137.206 1.00 0.00 O ATOM 13890 H1 WAT 6053 95.560 137.401 136.571 1.00 0.00 H ATOM 13891 H2 WAT 6053 96.021 137.086 137.978 1.00 0.00 H TER 13893 WAT 6053 ATOM 13893 O WAT 6054 136.527 56.491 128.670 1.00 0.00 O ATOM 13894 H1 WAT 6054 137.027 55.989 129.314 1.00 0.00 H ATOM 13895 H2 WAT 6054 136.135 57.204 129.175 1.00 0.00 H TER 13897 WAT 6054 ATOM 13897 O WAT 6055 74.318 107.906 102.887 1.00 0.00 O ATOM 13898 H1 WAT 6055 74.160 108.019 101.949 1.00 0.00 H ATOM 13899 H2 WAT 6055 74.152 106.977 103.047 1.00 0.00 H TER 13901 WAT 6055 ATOM 13901 O WAT 6056 115.880 12.735 116.169 1.00 0.00 O ATOM 13902 H1 WAT 6056 115.071 13.132 115.848 1.00 0.00 H ATOM 13903 H2 WAT 6056 115.888 11.860 115.781 1.00 0.00 H TER 13905 WAT 6056 ATOM 13905 O WAT 6057 100.598 23.391 81.323 1.00 0.00 O ATOM 13906 H1 WAT 6057 101.390 23.075 81.757 1.00 0.00 H ATOM 13907 H2 WAT 6057 100.517 24.302 81.606 1.00 0.00 H TER 13909 WAT 6057 ATOM 13909 O WAT 6058 104.106 40.936 124.309 1.00 0.00 O ATOM 13910 H1 WAT 6058 103.781 41.354 123.512 1.00 0.00 H ATOM 13911 H2 WAT 6058 103.330 40.542 124.707 1.00 0.00 H TER 13913 WAT 6058 ATOM 13913 O WAT 6059 50.775 93.439 85.568 1.00 0.00 O ATOM 13914 H1 WAT 6059 50.000 93.258 85.037 1.00 0.00 H ATOM 13915 H2 WAT 6059 51.492 93.488 84.936 1.00 0.00 H TER 13917 WAT 6059 ATOM 13917 O WAT 6060 14.440 84.211 13.749 1.00 0.00 O ATOM 13918 H1 WAT 6060 15.083 84.392 14.434 1.00 0.00 H ATOM 13919 H2 WAT 6060 13.742 84.849 13.901 1.00 0.00 H TER 13921 WAT 6060 ATOM 13921 O WAT 6061 55.684 142.190 78.107 1.00 0.00 O ATOM 13922 H1 WAT 6061 56.070 141.358 77.836 1.00 0.00 H ATOM 13923 H2 WAT 6061 56.429 142.719 78.392 1.00 0.00 H TER 13925 WAT 6061 ATOM 13925 O WAT 6062 140.059 9.099 87.350 1.00 0.00 O ATOM 13926 H1 WAT 6062 140.517 9.917 87.540 1.00 0.00 H ATOM 13927 H2 WAT 6062 139.906 8.705 88.209 1.00 0.00 H TER 13929 WAT 6062 ATOM 13929 O WAT 6063 66.541 133.528 95.015 1.00 0.00 O ATOM 13930 H1 WAT 6063 66.714 134.469 95.009 1.00 0.00 H ATOM 13931 H2 WAT 6063 66.260 133.330 94.122 1.00 0.00 H TER 13933 WAT 6063 ATOM 13933 O WAT 6064 32.350 15.514 73.956 1.00 0.00 O ATOM 13934 H1 WAT 6064 32.767 15.484 73.095 1.00 0.00 H ATOM 13935 H2 WAT 6064 32.376 14.609 74.266 1.00 0.00 H TER 13937 WAT 6064 ATOM 13937 O WAT 6065 103.144 30.353 88.417 1.00 0.00 O ATOM 13938 H1 WAT 6065 102.574 29.706 88.001 1.00 0.00 H ATOM 13939 H2 WAT 6065 104.020 30.146 88.091 1.00 0.00 H TER 13941 WAT 6065 ATOM 13941 O WAT 6066 15.218 3.486 79.246 1.00 0.00 O ATOM 13942 H1 WAT 6066 15.346 3.904 80.098 1.00 0.00 H ATOM 13943 H2 WAT 6066 14.561 4.028 78.810 1.00 0.00 H TER 13945 WAT 6066 ATOM 13945 O WAT 6067 82.555 127.572 120.028 1.00 0.00 O ATOM 13946 H1 WAT 6067 82.271 126.957 119.352 1.00 0.00 H ATOM 13947 H2 WAT 6067 82.119 127.271 120.824 1.00 0.00 H TER 13949 WAT 6067 ATOM 13949 O WAT 6068 28.006 122.873 60.294 1.00 0.00 O ATOM 13950 H1 WAT 6068 27.756 122.969 59.376 1.00 0.00 H ATOM 13951 H2 WAT 6068 28.942 123.074 60.310 1.00 0.00 H TER 13953 WAT 6068 ATOM 13953 O WAT 6069 28.481 16.256 131.371 1.00 0.00 O ATOM 13954 H1 WAT 6069 28.285 17.114 130.994 1.00 0.00 H ATOM 13955 H2 WAT 6069 28.872 15.761 130.652 1.00 0.00 H TER 13957 WAT 6069 ATOM 13957 O WAT 6070 20.105 39.560 107.705 1.00 0.00 O ATOM 13958 H1 WAT 6070 20.263 40.015 106.877 1.00 0.00 H ATOM 13959 H2 WAT 6070 19.156 39.440 107.735 1.00 0.00 H TER 13961 WAT 6070 ATOM 13961 O WAT 6071 59.214 21.660 66.193 1.00 0.00 O ATOM 13962 H1 WAT 6071 59.885 21.305 66.776 1.00 0.00 H ATOM 13963 H2 WAT 6071 58.467 21.833 66.766 1.00 0.00 H TER 13965 WAT 6071 ATOM 13965 O WAT 6072 70.592 128.914 83.245 1.00 0.00 O ATOM 13966 H1 WAT 6072 70.692 129.802 82.903 1.00 0.00 H ATOM 13967 H2 WAT 6072 69.703 128.660 82.995 1.00 0.00 H TER 13969 WAT 6072 ATOM 13969 O WAT 6073 10.727 97.937 74.150 1.00 0.00 O ATOM 13970 H1 WAT 6073 10.320 98.666 74.619 1.00 0.00 H ATOM 13971 H2 WAT 6073 10.248 97.163 74.447 1.00 0.00 H TER 13973 WAT 6073 ATOM 13973 O WAT 6074 97.520 55.727 139.511 1.00 0.00 O ATOM 13974 H1 WAT 6074 98.278 55.344 139.068 1.00 0.00 H ATOM 13975 H2 WAT 6074 97.377 55.163 140.271 1.00 0.00 H TER 13977 WAT 6074 ATOM 13977 O WAT 6075 1.828 113.065 66.939 1.00 0.00 O ATOM 13978 H1 WAT 6075 2.098 112.225 67.310 1.00 0.00 H ATOM 13979 H2 WAT 6075 0.904 113.145 67.175 1.00 0.00 H TER 13981 WAT 6075 ATOM 13981 O WAT 6076 68.422 2.789 128.411 1.00 0.00 O ATOM 13982 H1 WAT 6076 68.911 3.557 128.706 1.00 0.00 H ATOM 13983 H2 WAT 6076 68.287 2.936 127.475 1.00 0.00 H TER 13985 WAT 6076 ATOM 13985 O WAT 6077 54.440 38.067 139.393 1.00 0.00 O ATOM 13986 H1 WAT 6077 54.005 37.706 140.165 1.00 0.00 H ATOM 13987 H2 WAT 6077 54.812 38.896 139.693 1.00 0.00 H TER 13989 WAT 6077 ATOM 13989 O WAT 6078 46.833 9.136 81.147 1.00 0.00 O ATOM 13990 H1 WAT 6078 46.613 9.998 81.501 1.00 0.00 H ATOM 13991 H2 WAT 6078 46.560 8.521 81.828 1.00 0.00 H TER 13993 WAT 6078 ATOM 13993 O WAT 6079 73.418 128.274 20.192 1.00 0.00 O ATOM 13994 H1 WAT 6079 73.371 127.430 19.742 1.00 0.00 H ATOM 13995 H2 WAT 6079 73.725 128.886 19.523 1.00 0.00 H TER 13997 WAT 6079 ATOM 13997 O WAT 6080 27.360 0.060 114.204 1.00 0.00 O ATOM 13998 H1 WAT 6080 28.157 0.362 113.769 1.00 0.00 H ATOM 13999 H2 WAT 6080 26.776 -0.190 113.488 1.00 0.00 H TER 14001 WAT 6080 ATOM 14001 O WAT 6081 118.749 101.303 138.052 1.00 0.00 O ATOM 14002 H1 WAT 6081 117.814 101.179 138.214 1.00 0.00 H ATOM 14003 H2 WAT 6081 119.147 101.292 138.923 1.00 0.00 H TER 14005 WAT 6081 ATOM 14005 O WAT 6082 139.354 56.528 115.067 1.00 0.00 O ATOM 14006 H1 WAT 6082 139.604 56.739 114.168 1.00 0.00 H ATOM 14007 H2 WAT 6082 138.458 56.854 115.150 1.00 0.00 H TER 14009 WAT 6082 ATOM 14009 O WAT 6083 68.983 32.745 119.321 1.00 0.00 O ATOM 14010 H1 WAT 6083 68.388 33.488 119.423 1.00 0.00 H ATOM 14011 H2 WAT 6083 69.225 32.759 118.395 1.00 0.00 H TER 14013 WAT 6083 ATOM 14013 O WAT 6084 106.611 144.773 102.327 1.00 0.00 O ATOM 14014 H1 WAT 6084 105.680 144.924 102.488 1.00 0.00 H ATOM 14015 H2 WAT 6084 106.702 143.820 102.320 1.00 0.00 H TER 14017 WAT 6084 ATOM 14017 O WAT 6085 96.724 140.023 155.354 1.00 0.00 O ATOM 14018 H1 WAT 6085 96.626 140.623 156.093 1.00 0.00 H ATOM 14019 H2 WAT 6085 97.549 140.282 154.943 1.00 0.00 H TER 14021 WAT 6085 ATOM 14021 O WAT 6086 108.567 5.101 3.474 1.00 0.00 O ATOM 14022 H1 WAT 6086 108.698 4.379 2.859 1.00 0.00 H ATOM 14023 H2 WAT 6086 109.083 5.821 3.111 1.00 0.00 H TER 14025 WAT 6086 ATOM 14025 O WAT 6087 35.457 0.404 120.444 1.00 0.00 O ATOM 14026 H1 WAT 6087 36.407 0.514 120.495 1.00 0.00 H ATOM 14027 H2 WAT 6087 35.104 1.258 120.691 1.00 0.00 H TER 14029 WAT 6087 ATOM 14029 O WAT 6088 114.351 19.497 114.141 1.00 0.00 O ATOM 14030 H1 WAT 6088 114.037 20.216 113.593 1.00 0.00 H ATOM 14031 H2 WAT 6088 113.863 19.587 114.959 1.00 0.00 H TER 14033 WAT 6088 ATOM 14033 O WAT 6089 81.528 39.974 119.341 1.00 0.00 O ATOM 14034 H1 WAT 6089 81.760 39.397 118.613 1.00 0.00 H ATOM 14035 H2 WAT 6089 82.278 39.925 119.934 1.00 0.00 H TER 14037 WAT 6089 ATOM 14037 O WAT 6090 106.175 56.025 1.918 1.00 0.00 O ATOM 14038 H1 WAT 6090 105.342 55.842 2.352 1.00 0.00 H ATOM 14039 H2 WAT 6090 106.245 56.979 1.925 1.00 0.00 H TER 14041 WAT 6090 ATOM 14041 O WAT 6091 23.458 93.472 63.887 1.00 0.00 O ATOM 14042 H1 WAT 6091 22.791 94.158 63.874 1.00 0.00 H ATOM 14043 H2 WAT 6091 24.012 93.691 64.636 1.00 0.00 H TER 14045 WAT 6091 ATOM 14045 O WAT 6092 23.963 111.084 74.049 1.00 0.00 O ATOM 14046 H1 WAT 6092 24.848 110.734 73.953 1.00 0.00 H ATOM 14047 H2 WAT 6092 23.814 111.104 74.995 1.00 0.00 H TER 14049 WAT 6092 ATOM 14049 O WAT 6093 7.508 63.982 92.287 1.00 0.00 O ATOM 14050 H1 WAT 6093 6.799 64.324 91.743 1.00 0.00 H ATOM 14051 H2 WAT 6093 7.235 64.173 93.185 1.00 0.00 H TER 14053 WAT 6093 ATOM 14053 O WAT 6094 3.528 61.337 69.997 1.00 0.00 O ATOM 14054 H1 WAT 6094 3.210 60.619 69.449 1.00 0.00 H ATOM 14055 H2 WAT 6094 4.315 61.649 69.550 1.00 0.00 H TER 14057 WAT 6094 ATOM 14057 O WAT 6095 141.645 28.008 81.020 1.00 0.00 O ATOM 14058 H1 WAT 6095 142.370 28.624 81.117 1.00 0.00 H ATOM 14059 H2 WAT 6095 140.872 28.562 80.908 1.00 0.00 H TER 14061 WAT 6095 ATOM 14061 O WAT 6096 97.107 60.396 5.155 1.00 0.00 O ATOM 14062 H1 WAT 6096 96.178 60.504 4.952 1.00 0.00 H ATOM 14063 H2 WAT 6096 97.448 61.289 5.202 1.00 0.00 H TER 14065 WAT 6096 ATOM 14065 O WAT 6097 138.238 123.248 2.378 1.00 0.00 O ATOM 14066 H1 WAT 6097 137.951 123.415 1.480 1.00 0.00 H ATOM 14067 H2 WAT 6097 137.431 123.257 2.893 1.00 0.00 H TER 14069 WAT 6097 ATOM 14069 O WAT 6098 90.383 21.797 136.409 1.00 0.00 O ATOM 14070 H1 WAT 6098 90.119 20.894 136.231 1.00 0.00 H ATOM 14071 H2 WAT 6098 90.054 21.974 137.290 1.00 0.00 H TER 14073 WAT 6098 ATOM 14073 O WAT 6099 145.371 28.654 77.531 1.00 0.00 O ATOM 14074 H1 WAT 6099 144.926 27.846 77.789 1.00 0.00 H ATOM 14075 H2 WAT 6099 145.181 29.269 78.240 1.00 0.00 H TER 14077 WAT 6099 ATOM 14077 O WAT 6100 129.770 130.160 110.911 1.00 0.00 O ATOM 14078 H1 WAT 6100 128.833 130.296 111.050 1.00 0.00 H ATOM 14079 H2 WAT 6100 130.116 129.970 111.783 1.00 0.00 H TER 14081 WAT 6100 ATOM 14081 O WAT 6101 43.699 144.467 100.719 1.00 0.00 O ATOM 14082 H1 WAT 6101 43.556 143.603 100.334 1.00 0.00 H ATOM 14083 H2 WAT 6101 42.983 145.003 100.378 1.00 0.00 H TER 14085 WAT 6101 ATOM 14085 O WAT 6102 115.648 35.760 141.551 1.00 0.00 O ATOM 14086 H1 WAT 6102 116.546 36.092 141.534 1.00 0.00 H ATOM 14087 H2 WAT 6102 115.516 35.473 142.454 1.00 0.00 H TER 14089 WAT 6102 ATOM 14089 O WAT 6103 57.107 140.731 145.385 1.00 0.00 O ATOM 14090 H1 WAT 6103 57.311 139.902 144.953 1.00 0.00 H ATOM 14091 H2 WAT 6103 57.095 141.374 144.676 1.00 0.00 H TER 14093 WAT 6103 ATOM 14093 O WAT 6104 91.015 139.901 120.338 1.00 0.00 O ATOM 14094 H1 WAT 6104 90.392 140.111 121.035 1.00 0.00 H ATOM 14095 H2 WAT 6104 91.855 140.227 120.661 1.00 0.00 H TER 14097 WAT 6104 ATOM 14097 O WAT 6105 96.756 103.257 109.694 1.00 0.00 O ATOM 14098 H1 WAT 6105 96.621 103.830 110.450 1.00 0.00 H ATOM 14099 H2 WAT 6105 97.452 102.660 109.968 1.00 0.00 H TER 14101 WAT 6105 ATOM 14101 O WAT 6106 5.868 85.412 58.149 1.00 0.00 O ATOM 14102 H1 WAT 6106 5.033 85.758 57.835 1.00 0.00 H ATOM 14103 H2 WAT 6106 5.683 84.499 58.368 1.00 0.00 H TER 14105 WAT 6106 ATOM 14105 O WAT 6107 105.338 93.704 133.141 1.00 0.00 O ATOM 14106 H1 WAT 6107 105.613 93.801 132.229 1.00 0.00 H ATOM 14107 H2 WAT 6107 104.408 93.484 133.089 1.00 0.00 H TER 14109 WAT 6107 ATOM 14109 O WAT 6108 68.802 106.102 90.282 1.00 0.00 O ATOM 14110 H1 WAT 6108 68.841 106.758 90.978 1.00 0.00 H ATOM 14111 H2 WAT 6108 68.286 105.387 90.655 1.00 0.00 H TER 14113 WAT 6108 ATOM 14113 O WAT 6109 22.518 39.339 148.755 1.00 0.00 O ATOM 14114 H1 WAT 6109 22.750 39.448 149.678 1.00 0.00 H ATOM 14115 H2 WAT 6109 22.797 38.448 148.543 1.00 0.00 H TER 14117 WAT 6109 ATOM 14117 O WAT 6110 54.483 55.338 123.171 1.00 0.00 O ATOM 14118 H1 WAT 6110 53.790 55.917 122.853 1.00 0.00 H ATOM 14119 H2 WAT 6110 54.392 55.356 124.123 1.00 0.00 H TER 14121 WAT 6110 ATOM 14121 O WAT 6111 57.401 13.674 68.197 1.00 0.00 O ATOM 14122 H1 WAT 6111 57.332 13.674 67.242 1.00 0.00 H ATOM 14123 H2 WAT 6111 58.196 13.172 68.379 1.00 0.00 H TER 14125 WAT 6111 ATOM 14125 O WAT 6112 123.518 107.944 119.003 1.00 0.00 O ATOM 14126 H1 WAT 6112 123.856 107.531 119.798 1.00 0.00 H ATOM 14127 H2 WAT 6112 123.274 108.828 119.278 1.00 0.00 H TER 14129 WAT 6112 ATOM 14129 O WAT 6113 2.355 114.667 124.433 1.00 0.00 O ATOM 14130 H1 WAT 6113 3.216 114.305 124.226 1.00 0.00 H ATOM 14131 H2 WAT 6113 2.348 115.526 124.011 1.00 0.00 H TER 14133 WAT 6113 ATOM 14133 O WAT 6114 98.549 108.902 1.115 1.00 0.00 O ATOM 14134 H1 WAT 6114 97.662 108.568 0.981 1.00 0.00 H ATOM 14135 H2 WAT 6114 99.116 108.147 0.957 1.00 0.00 H TER 14137 WAT 6114 ATOM 14137 O WAT 6115 109.138 88.304 23.886 1.00 0.00 O ATOM 14138 H1 WAT 6115 109.253 89.233 24.083 1.00 0.00 H ATOM 14139 H2 WAT 6115 109.869 87.872 24.329 1.00 0.00 H TER 14141 WAT 6115 ATOM 14141 O WAT 6116 106.647 3.405 80.363 1.00 0.00 O ATOM 14142 H1 WAT 6116 106.764 4.190 80.898 1.00 0.00 H ATOM 14143 H2 WAT 6116 106.898 3.677 79.480 1.00 0.00 H TER 14145 WAT 6116 ATOM 14145 O WAT 6117 13.937 60.136 110.003 1.00 0.00 O ATOM 14146 H1 WAT 6117 13.552 59.298 110.260 1.00 0.00 H ATOM 14147 H2 WAT 6117 14.223 60.001 109.100 1.00 0.00 H TER 14149 WAT 6117 ATOM 14149 O WAT 6118 57.269 119.067 142.791 1.00 0.00 O ATOM 14150 H1 WAT 6118 57.616 119.028 141.900 1.00 0.00 H ATOM 14151 H2 WAT 6118 57.746 118.385 143.264 1.00 0.00 H TER 14153 WAT 6118 ATOM 14153 O WAT 6119 131.022 127.086 88.239 1.00 0.00 O ATOM 14154 H1 WAT 6119 130.354 126.937 88.909 1.00 0.00 H ATOM 14155 H2 WAT 6119 131.322 127.982 88.396 1.00 0.00 H TER 14157 WAT 6119 ATOM 14157 O WAT 6120 22.254 46.402 9.144 1.00 0.00 O ATOM 14158 H1 WAT 6120 22.166 45.455 9.040 1.00 0.00 H ATOM 14159 H2 WAT 6120 22.864 46.507 9.875 1.00 0.00 H TER 14161 WAT 6120 ATOM 14161 O WAT 6121 50.633 121.854 108.763 1.00 0.00 O ATOM 14162 H1 WAT 6121 50.720 121.670 109.699 1.00 0.00 H ATOM 14163 H2 WAT 6121 49.693 121.967 108.628 1.00 0.00 H TER 14165 WAT 6121 ATOM 14165 O WAT 6122 111.023 37.373 112.179 1.00 0.00 O ATOM 14166 H1 WAT 6122 111.971 37.496 112.223 1.00 0.00 H ATOM 14167 H2 WAT 6122 110.884 36.478 112.490 1.00 0.00 H TER 14169 WAT 6122 ATOM 14169 O WAT 6123 40.555 28.498 152.226 1.00 0.00 O ATOM 14170 H1 WAT 6123 41.486 28.562 152.442 1.00 0.00 H ATOM 14171 H2 WAT 6123 40.496 28.820 151.327 1.00 0.00 H TER 14173 WAT 6123 ATOM 14173 O WAT 6124 66.305 65.556 81.398 1.00 0.00 O ATOM 14174 H1 WAT 6124 65.956 64.970 82.069 1.00 0.00 H ATOM 14175 H2 WAT 6124 65.532 65.978 81.023 1.00 0.00 H TER 14177 WAT 6124 ATOM 14177 O WAT 6125 132.174 99.849 156.526 1.00 0.00 O ATOM 14178 H1 WAT 6125 131.413 99.433 156.120 1.00 0.00 H ATOM 14179 H2 WAT 6125 132.768 99.124 156.720 1.00 0.00 H TER 14181 WAT 6125 ATOM 14181 O WAT 6126 108.642 144.085 68.544 1.00 0.00 O ATOM 14182 H1 WAT 6126 109.016 144.953 68.389 1.00 0.00 H ATOM 14183 H2 WAT 6126 107.926 144.016 67.913 1.00 0.00 H TER 14185 WAT 6126 ATOM 14185 O WAT 6127 139.997 7.889 14.920 1.00 0.00 O ATOM 14186 H1 WAT 6127 140.399 8.358 14.189 1.00 0.00 H ATOM 14187 H2 WAT 6127 140.678 7.288 15.222 1.00 0.00 H TER 14189 WAT 6127 ATOM 14189 O WAT 6128 124.984 93.125 70.348 1.00 0.00 O ATOM 14190 H1 WAT 6128 124.997 94.072 70.487 1.00 0.00 H ATOM 14191 H2 WAT 6128 124.512 92.779 71.105 1.00 0.00 H TER 14193 WAT 6128 ATOM 14193 O WAT 6129 73.432 102.953 63.196 1.00 0.00 O ATOM 14194 H1 WAT 6129 74.348 102.679 63.236 1.00 0.00 H ATOM 14195 H2 WAT 6129 73.468 103.909 63.206 1.00 0.00 H TER 14197 WAT 6129 ATOM 14197 O WAT 6130 75.526 63.204 101.044 1.00 0.00 O ATOM 14198 H1 WAT 6130 74.909 63.138 101.774 1.00 0.00 H ATOM 14199 H2 WAT 6130 75.558 64.139 100.841 1.00 0.00 H TER 14201 WAT 6130 ATOM 14201 O WAT 6131 15.360 143.142 149.751 1.00 0.00 O ATOM 14202 H1 WAT 6131 15.624 143.910 149.244 1.00 0.00 H ATOM 14203 H2 WAT 6131 14.423 143.051 149.577 1.00 0.00 H TER 14205 WAT 6131 ATOM 14205 O WAT 6132 75.294 19.287 90.855 1.00 0.00 O ATOM 14206 H1 WAT 6132 74.604 18.979 90.268 1.00 0.00 H ATOM 14207 H2 WAT 6132 76.039 19.460 90.279 1.00 0.00 H TER 14209 WAT 6132 ATOM 14209 O WAT 6133 111.673 40.152 4.797 1.00 0.00 O ATOM 14210 H1 WAT 6133 112.612 40.185 4.615 1.00 0.00 H ATOM 14211 H2 WAT 6133 111.390 39.309 4.443 1.00 0.00 H TER 14213 WAT 6133 ATOM 14213 O WAT 6134 63.024 122.582 79.551 1.00 0.00 O ATOM 14214 H1 WAT 6134 63.815 123.010 79.877 1.00 0.00 H ATOM 14215 H2 WAT 6134 63.337 121.769 79.155 1.00 0.00 H TER 14217 WAT 6134 ATOM 14217 O WAT 6135 134.268 59.917 141.188 1.00 0.00 O ATOM 14218 H1 WAT 6135 134.181 59.601 142.087 1.00 0.00 H ATOM 14219 H2 WAT 6135 133.541 60.529 141.077 1.00 0.00 H TER 14221 WAT 6135 ATOM 14221 O WAT 6136 97.866 64.802 3.317 1.00 0.00 O ATOM 14222 H1 WAT 6136 98.297 65.656 3.356 1.00 0.00 H ATOM 14223 H2 WAT 6136 97.564 64.728 2.411 1.00 0.00 H TER 14225 WAT 6136 ATOM 14225 O WAT 6137 96.642 21.154 108.801 1.00 0.00 O ATOM 14226 H1 WAT 6137 96.985 20.502 108.190 1.00 0.00 H ATOM 14227 H2 WAT 6137 96.080 20.655 109.394 1.00 0.00 H TER 14229 WAT 6137 ATOM 14229 O WAT 6138 105.038 88.472 123.489 1.00 0.00 O ATOM 14230 H1 WAT 6138 105.860 88.785 123.111 1.00 0.00 H ATOM 14231 H2 WAT 6138 104.639 87.948 122.794 1.00 0.00 H TER 14233 WAT 6138 ATOM 14233 O WAT 6139 15.300 141.338 109.567 1.00 0.00 O ATOM 14234 H1 WAT 6139 16.037 141.832 109.207 1.00 0.00 H ATOM 14235 H2 WAT 6139 14.557 141.938 109.503 1.00 0.00 H TER 14237 WAT 6139 ATOM 14237 O WAT 6140 135.810 12.089 11.676 1.00 0.00 O ATOM 14238 H1 WAT 6140 136.237 12.710 11.087 1.00 0.00 H ATOM 14239 H2 WAT 6140 136.079 12.367 12.552 1.00 0.00 H TER 14241 WAT 6140 ATOM 14241 O WAT 6141 61.232 75.162 97.948 1.00 0.00 O ATOM 14242 H1 WAT 6141 61.595 75.955 97.553 1.00 0.00 H ATOM 14243 H2 WAT 6141 61.809 74.978 98.689 1.00 0.00 H TER 14245 WAT 6141 ATOM 14245 O WAT 6142 66.511 52.534 136.140 1.00 0.00 O ATOM 14246 H1 WAT 6142 65.619 52.732 136.423 1.00 0.00 H ATOM 14247 H2 WAT 6142 66.494 51.600 135.929 1.00 0.00 H TER 14249 WAT 6142 ATOM 14249 O WAT 6143 88.076 128.856 14.851 1.00 0.00 O ATOM 14250 H1 WAT 6143 88.037 129.421 14.079 1.00 0.00 H ATOM 14251 H2 WAT 6143 88.972 128.519 14.857 1.00 0.00 H TER 14253 WAT 6143 ATOM 14253 O WAT 6144 15.421 28.359 110.668 1.00 0.00 O ATOM 14254 H1 WAT 6144 14.625 28.804 110.960 1.00 0.00 H ATOM 14255 H2 WAT 6144 16.132 28.830 111.103 1.00 0.00 H TER 14257 WAT 6144 ATOM 14257 O WAT 6145 84.736 41.372 13.122 1.00 0.00 O ATOM 14258 H1 WAT 6145 84.181 42.037 12.714 1.00 0.00 H ATOM 14259 H2 WAT 6145 85.340 41.106 12.429 1.00 0.00 H TER 14261 WAT 6145 ATOM 14261 O WAT 6146 51.611 127.892 154.800 1.00 0.00 O ATOM 14262 H1 WAT 6146 52.092 128.181 155.575 1.00 0.00 H ATOM 14263 H2 WAT 6146 50.809 128.415 154.807 1.00 0.00 H TER 14265 WAT 6146 ATOM 14265 O WAT 6147 48.895 6.755 86.319 1.00 0.00 O ATOM 14266 H1 WAT 6147 48.394 6.435 85.569 1.00 0.00 H ATOM 14267 H2 WAT 6147 49.775 6.403 86.188 1.00 0.00 H TER 14269 WAT 6147 ATOM 14269 O WAT 6148 87.025 110.144 75.753 1.00 0.00 O ATOM 14270 H1 WAT 6148 86.969 111.052 76.052 1.00 0.00 H ATOM 14271 H2 WAT 6148 87.879 109.842 76.063 1.00 0.00 H TER 14273 WAT 6148 ATOM 14273 O WAT 6149 137.392 123.254 96.758 1.00 0.00 O ATOM 14274 H1 WAT 6149 138.038 123.233 96.052 1.00 0.00 H ATOM 14275 H2 WAT 6149 137.743 122.661 97.421 1.00 0.00 H TER 14277 WAT 6149 ATOM 14277 O WAT 6150 85.755 81.356 94.649 1.00 0.00 O ATOM 14278 H1 WAT 6150 86.648 81.318 94.305 1.00 0.00 H ATOM 14279 H2 WAT 6150 85.208 81.040 93.930 1.00 0.00 H TER 14281 WAT 6150 ATOM 14281 O WAT 6151 47.050 6.149 110.142 1.00 0.00 O ATOM 14282 H1 WAT 6151 47.167 6.693 109.363 1.00 0.00 H ATOM 14283 H2 WAT 6151 47.730 5.479 110.070 1.00 0.00 H TER 14285 WAT 6151 ATOM 14285 O WAT 6152 127.240 23.322 101.484 1.00 0.00 O ATOM 14286 H1 WAT 6152 127.644 23.180 100.628 1.00 0.00 H ATOM 14287 H2 WAT 6152 127.144 24.272 101.549 1.00 0.00 H TER 14289 WAT 6152 ATOM 14289 O WAT 6153 27.881 65.664 122.343 1.00 0.00 O ATOM 14290 H1 WAT 6153 27.690 66.314 121.667 1.00 0.00 H ATOM 14291 H2 WAT 6153 28.632 65.178 122.003 1.00 0.00 H TER 14293 WAT 6153 ATOM 14293 O WAT 6154 25.271 72.506 65.089 1.00 0.00 O ATOM 14294 H1 WAT 6154 25.241 72.610 64.137 1.00 0.00 H ATOM 14295 H2 WAT 6154 26.204 72.521 65.302 1.00 0.00 H TER 14297 WAT 6154 ATOM 14297 O WAT 6155 60.432 92.393 142.821 1.00 0.00 O ATOM 14298 H1 WAT 6155 60.608 91.454 142.876 1.00 0.00 H ATOM 14299 H2 WAT 6155 59.724 92.466 142.181 1.00 0.00 H TER 14301 WAT 6155 ATOM 14301 O WAT 6156 15.940 105.589 155.591 1.00 0.00 O ATOM 14302 H1 WAT 6156 15.486 106.406 155.794 1.00 0.00 H ATOM 14303 H2 WAT 6156 15.238 104.957 155.435 1.00 0.00 H TER 14305 WAT 6156 ATOM 14305 O WAT 6157 40.495 95.358 108.349 1.00 0.00 O ATOM 14306 H1 WAT 6157 41.246 95.752 107.904 1.00 0.00 H ATOM 14307 H2 WAT 6157 40.455 94.465 108.007 1.00 0.00 H TER 14309 WAT 6157 ATOM 14309 O WAT 6158 18.687 110.295 91.598 1.00 0.00 O ATOM 14310 H1 WAT 6158 19.023 109.553 92.100 1.00 0.00 H ATOM 14311 H2 WAT 6158 18.003 110.670 92.154 1.00 0.00 H TER 14313 WAT 6158 ATOM 14313 O WAT 6159 46.327 126.517 61.335 1.00 0.00 O ATOM 14314 H1 WAT 6159 46.758 126.075 60.603 1.00 0.00 H ATOM 14315 H2 WAT 6159 46.700 126.106 62.115 1.00 0.00 H TER 14317 WAT 6159 ATOM 14317 O WAT 6160 106.901 109.088 19.674 1.00 0.00 O ATOM 14318 H1 WAT 6160 105.975 108.982 19.457 1.00 0.00 H ATOM 14319 H2 WAT 6160 107.360 108.935 18.849 1.00 0.00 H TER 14321 WAT 6160 ATOM 14321 O WAT 6161 125.217 98.433 121.007 1.00 0.00 O ATOM 14322 H1 WAT 6161 124.461 98.979 120.793 1.00 0.00 H ATOM 14323 H2 WAT 6161 125.322 98.531 121.954 1.00 0.00 H TER 14325 WAT 6161 ATOM 14325 O WAT 6162 101.228 110.195 22.305 1.00 0.00 O ATOM 14326 H1 WAT 6162 100.428 110.458 22.761 1.00 0.00 H ATOM 14327 H2 WAT 6162 101.648 111.021 22.063 1.00 0.00 H TER 14329 WAT 6162 ATOM 14329 O WAT 6163 21.229 72.259 115.982 1.00 0.00 O ATOM 14330 H1 WAT 6163 20.636 71.580 115.661 1.00 0.00 H ATOM 14331 H2 WAT 6163 21.168 72.958 115.331 1.00 0.00 H TER 14333 WAT 6163 ATOM 14333 O WAT 6164 58.374 105.887 13.303 1.00 0.00 O ATOM 14334 H1 WAT 6164 58.523 106.430 12.529 1.00 0.00 H ATOM 14335 H2 WAT 6164 57.724 106.369 13.813 1.00 0.00 H TER 14337 WAT 6164 ATOM 14337 O WAT 6165 56.806 51.818 90.572 1.00 0.00 O ATOM 14338 H1 WAT 6165 56.941 52.594 91.116 1.00 0.00 H ATOM 14339 H2 WAT 6165 56.720 52.161 89.683 1.00 0.00 H TER 14341 WAT 6165 ATOM 14341 O WAT 6166 52.997 137.079 102.084 1.00 0.00 O ATOM 14342 H1 WAT 6166 52.095 136.782 101.964 1.00 0.00 H ATOM 14343 H2 WAT 6166 53.360 136.483 102.739 1.00 0.00 H TER 14345 WAT 6166 ATOM 14345 O WAT 6167 50.702 34.538 133.582 1.00 0.00 O ATOM 14346 H1 WAT 6167 49.912 35.054 133.743 1.00 0.00 H ATOM 14347 H2 WAT 6167 51.421 35.109 133.856 1.00 0.00 H TER 14349 WAT 6167 ATOM 14349 O WAT 6168 46.118 111.530 86.692 1.00 0.00 O ATOM 14350 H1 WAT 6168 45.522 110.787 86.787 1.00 0.00 H ATOM 14351 H2 WAT 6168 45.593 112.205 86.264 1.00 0.00 H TER 14353 WAT 6168 ATOM 14353 O WAT 6169 59.874 64.350 22.992 1.00 0.00 O ATOM 14354 H1 WAT 6169 59.481 64.063 22.168 1.00 0.00 H ATOM 14355 H2 WAT 6169 60.324 63.574 23.326 1.00 0.00 H TER 14357 WAT 6169 ATOM 14357 O WAT 6170 105.565 39.141 24.609 1.00 0.00 O ATOM 14358 H1 WAT 6170 106.346 38.891 25.102 1.00 0.00 H ATOM 14359 H2 WAT 6170 105.519 38.506 23.895 1.00 0.00 H TER 14361 WAT 6170 ATOM 14361 O WAT 6171 92.693 139.445 9.993 1.00 0.00 O ATOM 14362 H1 WAT 6171 92.209 140.257 9.841 1.00 0.00 H ATOM 14363 H2 WAT 6171 93.455 139.508 9.417 1.00 0.00 H TER 14365 WAT 6171 ATOM 14365 O WAT 6172 104.683 43.578 146.719 1.00 0.00 O ATOM 14366 H1 WAT 6172 103.796 43.893 146.541 1.00 0.00 H ATOM 14367 H2 WAT 6172 104.700 43.437 147.666 1.00 0.00 H TER 14369 WAT 6172 ATOM 14369 O WAT 6173 38.202 57.751 54.119 1.00 0.00 O ATOM 14370 H1 WAT 6173 37.716 57.820 53.297 1.00 0.00 H ATOM 14371 H2 WAT 6173 38.881 57.101 53.943 1.00 0.00 H TER 14373 WAT 6173 ATOM 14373 O WAT 6174 17.654 47.945 86.235 1.00 0.00 O ATOM 14374 H1 WAT 6174 18.326 48.281 85.642 1.00 0.00 H ATOM 14375 H2 WAT 6174 17.926 47.046 86.421 1.00 0.00 H TER 14377 WAT 6174 ATOM 14377 O WAT 6175 128.866 77.299 116.936 1.00 0.00 O ATOM 14378 H1 WAT 6175 128.359 76.762 116.328 1.00 0.00 H ATOM 14379 H2 WAT 6175 128.304 78.052 117.118 1.00 0.00 H TER 14381 WAT 6175 ATOM 14381 O WAT 6176 41.136 38.501 109.961 1.00 0.00 O ATOM 14382 H1 WAT 6176 40.858 38.445 110.875 1.00 0.00 H ATOM 14383 H2 WAT 6176 42.047 38.207 109.970 1.00 0.00 H TER 14385 WAT 6176 ATOM 14385 O WAT 6177 139.569 47.653 85.939 1.00 0.00 O ATOM 14386 H1 WAT 6177 140.251 48.079 85.420 1.00 0.00 H ATOM 14387 H2 WAT 6177 139.366 46.852 85.457 1.00 0.00 H TER 14389 WAT 6177 ATOM 14389 O WAT 6178 58.901 52.407 15.479 1.00 0.00 O ATOM 14390 H1 WAT 6178 58.452 52.048 16.244 1.00 0.00 H ATOM 14391 H2 WAT 6178 59.642 51.817 15.337 1.00 0.00 H TER 14393 WAT 6178 ATOM 14393 O WAT 6179 56.330 83.539 120.129 1.00 0.00 O ATOM 14394 H1 WAT 6179 56.671 82.911 120.765 1.00 0.00 H ATOM 14395 H2 WAT 6179 56.890 84.309 120.228 1.00 0.00 H TER 14397 WAT 6179 ATOM 14397 O WAT 6180 13.775 9.851 0.252 1.00 0.00 O ATOM 14398 H1 WAT 6180 13.365 10.436 0.889 1.00 0.00 H ATOM 14399 H2 WAT 6180 14.600 9.591 0.662 1.00 0.00 H TER 14401 WAT 6180 ATOM 14401 O WAT 6181 123.643 144.044 124.023 1.00 0.00 O ATOM 14402 H1 WAT 6181 122.820 143.681 123.695 1.00 0.00 H ATOM 14403 H2 WAT 6181 123.930 143.420 124.691 1.00 0.00 H TER 14405 WAT 6181 ATOM 14405 O WAT 6182 108.338 130.936 5.650 1.00 0.00 O ATOM 14406 H1 WAT 6182 108.216 131.841 5.938 1.00 0.00 H ATOM 14407 H2 WAT 6182 107.508 130.703 5.234 1.00 0.00 H TER 14409 WAT 6182 ATOM 14409 O WAT 6183 93.509 102.774 137.308 1.00 0.00 O ATOM 14410 H1 WAT 6183 93.489 102.524 138.232 1.00 0.00 H ATOM 14411 H2 WAT 6183 93.580 101.943 136.837 1.00 0.00 H TER 14413 WAT 6183 ATOM 14413 O WAT 6184 54.950 100.132 108.600 1.00 0.00 O ATOM 14414 H1 WAT 6184 55.589 100.807 108.373 1.00 0.00 H ATOM 14415 H2 WAT 6184 54.273 100.598 109.092 1.00 0.00 H TER 14417 WAT 6184 ATOM 14417 O WAT 6185 57.068 71.143 120.262 1.00 0.00 O ATOM 14418 H1 WAT 6185 57.923 71.573 120.263 1.00 0.00 H ATOM 14419 H2 WAT 6185 56.829 71.087 119.337 1.00 0.00 H TER 14421 WAT 6185 ATOM 14421 O WAT 6186 110.825 27.389 120.319 1.00 0.00 O ATOM 14422 H1 WAT 6186 110.871 26.834 121.098 1.00 0.00 H ATOM 14423 H2 WAT 6186 110.194 26.950 119.749 1.00 0.00 H TER 14425 WAT 6186 ATOM 14425 O WAT 6187 117.769 93.513 93.413 1.00 0.00 O ATOM 14426 H1 WAT 6187 117.210 92.790 93.697 1.00 0.00 H ATOM 14427 H2 WAT 6187 118.303 93.719 94.180 1.00 0.00 H TER 14429 WAT 6187 ATOM 14429 O WAT 6188 91.195 85.626 15.834 1.00 0.00 O ATOM 14430 H1 WAT 6188 91.472 85.829 14.940 1.00 0.00 H ATOM 14431 H2 WAT 6188 91.943 85.871 16.378 1.00 0.00 H TER 14433 WAT 6188 ATOM 14433 O WAT 6189 131.556 105.514 2.510 1.00 0.00 O ATOM 14434 H1 WAT 6189 131.199 105.231 1.669 1.00 0.00 H ATOM 14435 H2 WAT 6189 132.470 105.228 2.491 1.00 0.00 H TER 14437 WAT 6189 ATOM 14437 O WAT 6190 61.595 51.546 22.536 1.00 0.00 O ATOM 14438 H1 WAT 6190 62.259 52.235 22.524 1.00 0.00 H ATOM 14439 H2 WAT 6190 62.067 50.753 22.282 1.00 0.00 H TER 14441 WAT 6190 ATOM 14441 O WAT 6191 50.894 87.699 135.785 1.00 0.00 O ATOM 14442 H1 WAT 6191 51.121 88.119 134.955 1.00 0.00 H ATOM 14443 H2 WAT 6191 51.737 87.499 136.191 1.00 0.00 H TER 14445 WAT 6191 ATOM 14445 O WAT 6192 118.858 64.116 138.103 1.00 0.00 O ATOM 14446 H1 WAT 6192 118.793 63.874 137.179 1.00 0.00 H ATOM 14447 H2 WAT 6192 119.778 64.347 138.227 1.00 0.00 H TER 14449 WAT 6192 ATOM 14449 O WAT 6193 56.813 31.332 131.757 1.00 0.00 O ATOM 14450 H1 WAT 6193 56.868 30.701 132.475 1.00 0.00 H ATOM 14451 H2 WAT 6193 56.499 32.137 132.170 1.00 0.00 H TER 14453 WAT 6193 ATOM 14453 O WAT 6194 55.028 15.328 10.016 1.00 0.00 O ATOM 14454 H1 WAT 6194 55.905 15.227 10.388 1.00 0.00 H ATOM 14455 H2 WAT 6194 54.798 16.241 10.190 1.00 0.00 H TER 14457 WAT 6194 ATOM 14457 O WAT 6195 138.165 143.602 137.847 1.00 0.00 O ATOM 14458 H1 WAT 6195 137.706 144.375 138.175 1.00 0.00 H ATOM 14459 H2 WAT 6195 138.800 143.949 137.220 1.00 0.00 H TER 14461 WAT 6195 ATOM 14461 O WAT 6196 17.411 95.928 108.253 1.00 0.00 O ATOM 14462 H1 WAT 6196 16.937 95.097 108.244 1.00 0.00 H ATOM 14463 H2 WAT 6196 18.295 95.704 107.964 1.00 0.00 H TER 14465 WAT 6196 ATOM 14465 O WAT 6197 60.149 7.957 89.109 1.00 0.00 O ATOM 14466 H1 WAT 6197 59.619 7.874 89.902 1.00 0.00 H ATOM 14467 H2 WAT 6197 59.995 7.142 88.631 1.00 0.00 H TER 14469 WAT 6197 ATOM 14469 O WAT 6198 70.727 86.262 102.930 1.00 0.00 O ATOM 14470 H1 WAT 6198 70.372 85.623 102.312 1.00 0.00 H ATOM 14471 H2 WAT 6198 71.601 85.932 103.139 1.00 0.00 H TER 14473 WAT 6198 ATOM 14473 O WAT 6199 126.724 132.240 3.824 1.00 0.00 O ATOM 14474 H1 WAT 6199 127.526 131.755 4.016 1.00 0.00 H ATOM 14475 H2 WAT 6199 126.059 131.563 3.698 1.00 0.00 H TER 14477 WAT 6199 ATOM 14477 O WAT 6200 46.490 21.082 144.953 1.00 0.00 O ATOM 14478 H1 WAT 6200 46.730 20.191 145.208 1.00 0.00 H ATOM 14479 H2 WAT 6200 46.115 21.466 145.746 1.00 0.00 H TER 14481 WAT 6200 ATOM 14481 O WAT 6201 27.525 71.594 144.080 1.00 0.00 O ATOM 14482 H1 WAT 6201 27.248 71.584 144.996 1.00 0.00 H ATOM 14483 H2 WAT 6201 27.826 72.490 143.930 1.00 0.00 H TER 14485 WAT 6201 ATOM 14485 O WAT 6202 31.922 129.666 92.920 1.00 0.00 O ATOM 14486 H1 WAT 6202 32.254 129.296 92.103 1.00 0.00 H ATOM 14487 H2 WAT 6202 32.127 129.006 93.583 1.00 0.00 H TER 14489 WAT 6202 ATOM 14489 O WAT 6203 22.023 91.443 147.832 1.00 0.00 O ATOM 14490 H1 WAT 6203 22.293 90.578 148.140 1.00 0.00 H ATOM 14491 H2 WAT 6203 22.296 92.041 148.528 1.00 0.00 H TER 14493 WAT 6203 ATOM 14493 O WAT 6204 55.011 113.939 21.374 1.00 0.00 O ATOM 14494 H1 WAT 6204 55.822 113.556 21.708 1.00 0.00 H ATOM 14495 H2 WAT 6204 54.702 113.312 20.720 1.00 0.00 H TER 14497 WAT 6204 ATOM 14497 O WAT 6205 58.742 43.877 17.411 1.00 0.00 O ATOM 14498 H1 WAT 6205 59.449 44.271 17.922 1.00 0.00 H ATOM 14499 H2 WAT 6205 58.890 42.934 17.486 1.00 0.00 H TER 14501 WAT 6205 ATOM 14501 O WAT 6206 88.589 104.902 104.833 1.00 0.00 O ATOM 14502 H1 WAT 6206 89.369 105.428 105.006 1.00 0.00 H ATOM 14503 H2 WAT 6206 88.312 104.593 105.695 1.00 0.00 H TER 14505 WAT 6206 ATOM 14505 O WAT 6207 47.403 93.641 4.100 1.00 0.00 O ATOM 14506 H1 WAT 6207 46.915 93.463 4.904 1.00 0.00 H ATOM 14507 H2 WAT 6207 48.211 94.059 4.397 1.00 0.00 H TER 14509 WAT 6207 ATOM 14509 O WAT 6208 112.861 33.612 12.812 1.00 0.00 O ATOM 14510 H1 WAT 6208 113.738 33.945 13.005 1.00 0.00 H ATOM 14511 H2 WAT 6208 112.275 34.169 13.324 1.00 0.00 H TER 14513 WAT 6208 ATOM 14513 O WAT 6209 41.575 135.617 2.097 1.00 0.00 O ATOM 14514 H1 WAT 6209 40.954 136.310 1.873 1.00 0.00 H ATOM 14515 H2 WAT 6209 41.827 135.804 3.001 1.00 0.00 H TER 14517 WAT 6209 ATOM 14517 O WAT 6210 90.032 103.973 80.469 1.00 0.00 O ATOM 14518 H1 WAT 6210 89.985 104.135 81.412 1.00 0.00 H ATOM 14519 H2 WAT 6210 89.163 104.204 80.143 1.00 0.00 H TER 14521 WAT 6210 ATOM 14521 O WAT 6211 30.619 119.028 94.142 1.00 0.00 O ATOM 14522 H1 WAT 6211 31.541 118.790 94.046 1.00 0.00 H ATOM 14523 H2 WAT 6211 30.234 118.847 93.284 1.00 0.00 H TER 14525 WAT 6211 ATOM 14525 O WAT 6212 118.825 22.107 144.522 1.00 0.00 O ATOM 14526 H1 WAT 6212 118.530 22.866 145.025 1.00 0.00 H ATOM 14527 H2 WAT 6212 119.720 21.953 144.823 1.00 0.00 H TER 14529 WAT 6212 ATOM 14529 O WAT 6213 59.108 50.160 88.152 1.00 0.00 O ATOM 14530 H1 WAT 6213 59.589 49.648 87.502 1.00 0.00 H ATOM 14531 H2 WAT 6213 59.466 51.044 88.075 1.00 0.00 H TER 14533 WAT 6213 ATOM 14533 O WAT 6214 108.584 75.120 155.137 1.00 0.00 O ATOM 14534 H1 WAT 6214 107.807 74.600 154.932 1.00 0.00 H ATOM 14535 H2 WAT 6214 108.524 75.879 154.556 1.00 0.00 H TER 14537 WAT 6214 ATOM 14537 O WAT 6215 28.165 67.907 144.444 1.00 0.00 O ATOM 14538 H1 WAT 6215 28.558 68.604 143.919 1.00 0.00 H ATOM 14539 H2 WAT 6215 28.912 67.428 144.804 1.00 0.00 H TER 14541 WAT 6215 ATOM 14541 O WAT 6216 70.496 125.312 135.542 1.00 0.00 O ATOM 14542 H1 WAT 6216 71.258 125.864 135.367 1.00 0.00 H ATOM 14543 H2 WAT 6216 70.642 124.527 135.014 1.00 0.00 H TER 14545 WAT 6216 ATOM 14545 O WAT 6217 77.294 119.456 129.738 1.00 0.00 O ATOM 14546 H1 WAT 6217 76.979 120.318 130.010 1.00 0.00 H ATOM 14547 H2 WAT 6217 77.390 118.968 130.556 1.00 0.00 H TER 14549 WAT 6217 ATOM 14549 O WAT 6218 121.048 44.594 3.598 1.00 0.00 O ATOM 14550 H1 WAT 6218 121.119 44.014 2.840 1.00 0.00 H ATOM 14551 H2 WAT 6218 120.390 45.241 3.343 1.00 0.00 H TER 14553 WAT 6218 ATOM 14553 O WAT 6219 144.721 105.811 140.994 1.00 0.00 O ATOM 14554 H1 WAT 6219 143.826 105.561 140.764 1.00 0.00 H ATOM 14555 H2 WAT 6219 145.091 106.152 140.179 1.00 0.00 H TER 14557 WAT 6219 ATOM 14557 O WAT 6220 94.049 49.806 131.390 1.00 0.00 O ATOM 14558 H1 WAT 6220 94.369 50.354 130.674 1.00 0.00 H ATOM 14559 H2 WAT 6220 93.660 49.046 130.955 1.00 0.00 H TER 14561 WAT 6220 ATOM 14561 O WAT 6221 55.985 143.446 65.829 1.00 0.00 O ATOM 14562 H1 WAT 6221 55.987 143.816 64.946 1.00 0.00 H ATOM 14563 H2 WAT 6221 55.927 144.206 66.407 1.00 0.00 H TER 14565 WAT 6221 ATOM 14565 O WAT 6222 69.862 135.903 3.934 1.00 0.00 O ATOM 14566 H1 WAT 6222 70.399 136.683 3.793 1.00 0.00 H ATOM 14567 H2 WAT 6222 70.432 135.304 4.417 1.00 0.00 H TER 14569 WAT 6222 ATOM 14569 O WAT 6223 42.620 137.421 60.549 1.00 0.00 O ATOM 14570 H1 WAT 6223 42.299 136.566 60.835 1.00 0.00 H ATOM 14571 H2 WAT 6223 41.830 137.948 60.434 1.00 0.00 H TER 14573 WAT 6223 ATOM 14573 O WAT 6224 23.231 66.430 9.172 1.00 0.00 O ATOM 14574 H1 WAT 6224 23.430 67.302 8.832 1.00 0.00 H ATOM 14575 H2 WAT 6224 22.635 66.589 9.905 1.00 0.00 H TER 14577 WAT 6224 ATOM 14577 O WAT 6225 83.174 78.568 110.285 1.00 0.00 O ATOM 14578 H1 WAT 6225 83.910 77.998 110.509 1.00 0.00 H ATOM 14579 H2 WAT 6225 83.261 78.711 109.343 1.00 0.00 H TER 14581 WAT 6225 ATOM 14581 O WAT 6226 51.443 28.675 13.546 1.00 0.00 O ATOM 14582 H1 WAT 6226 52.282 28.217 13.491 1.00 0.00 H ATOM 14583 H2 WAT 6226 51.246 28.923 12.642 1.00 0.00 H TER 14585 WAT 6226 ATOM 14585 O WAT 6227 87.502 109.922 110.192 1.00 0.00 O ATOM 14586 H1 WAT 6227 86.878 109.967 110.916 1.00 0.00 H ATOM 14587 H2 WAT 6227 87.190 109.198 109.650 1.00 0.00 H TER 14589 WAT 6227 ATOM 14589 O WAT 6228 136.594 88.273 132.079 1.00 0.00 O ATOM 14590 H1 WAT 6228 136.374 89.164 131.807 1.00 0.00 H ATOM 14591 H2 WAT 6228 135.756 87.883 132.326 1.00 0.00 H TER 14593 WAT 6228 ATOM 14593 O WAT 6229 100.862 108.475 142.115 1.00 0.00 O ATOM 14594 H1 WAT 6229 100.357 109.282 142.017 1.00 0.00 H ATOM 14595 H2 WAT 6229 100.424 107.846 141.541 1.00 0.00 H TER 14597 WAT 6229 ATOM 14597 O WAT 6230 19.778 69.377 134.600 1.00 0.00 O ATOM 14598 H1 WAT 6230 19.395 70.114 134.125 1.00 0.00 H ATOM 14599 H2 WAT 6230 20.135 68.811 133.915 1.00 0.00 H TER 14601 WAT 6230 ATOM 14601 O WAT 6231 75.803 62.376 155.807 1.00 0.00 O ATOM 14602 H1 WAT 6231 75.163 61.722 156.087 1.00 0.00 H ATOM 14603 H2 WAT 6231 75.516 63.187 156.226 1.00 0.00 H TER 14605 WAT 6231 ATOM 14605 O WAT 6232 132.665 106.457 129.770 1.00 0.00 O ATOM 14606 H1 WAT 6232 132.026 106.401 130.481 1.00 0.00 H ATOM 14607 H2 WAT 6232 132.374 107.203 129.245 1.00 0.00 H TER 14609 WAT 6232 ATOM 14609 O WAT 6233 11.025 81.379 145.587 1.00 0.00 O ATOM 14610 H1 WAT 6233 10.891 82.190 146.078 1.00 0.00 H ATOM 14611 H2 WAT 6233 10.179 80.933 145.626 1.00 0.00 H TER 14613 WAT 6233 ATOM 14613 O WAT 6234 110.572 105.528 75.575 1.00 0.00 O ATOM 14614 H1 WAT 6234 110.622 105.032 74.757 1.00 0.00 H ATOM 14615 H2 WAT 6234 111.220 106.225 75.473 1.00 0.00 H TER 14617 WAT 6234 ATOM 14617 O WAT 6235 29.199 113.022 69.663 1.00 0.00 O ATOM 14618 H1 WAT 6235 29.232 113.170 70.609 1.00 0.00 H ATOM 14619 H2 WAT 6235 29.891 113.582 69.309 1.00 0.00 H TER 14621 WAT 6235 ATOM 14621 O WAT 6236 27.633 78.759 75.513 1.00 0.00 O ATOM 14622 H1 WAT 6236 27.342 77.945 75.101 1.00 0.00 H ATOM 14623 H2 WAT 6236 28.588 78.700 75.511 1.00 0.00 H TER 14625 WAT 6236 ATOM 14625 O WAT 6237 134.243 50.375 84.281 1.00 0.00 O ATOM 14626 H1 WAT 6237 134.597 51.121 83.797 1.00 0.00 H ATOM 14627 H2 WAT 6237 134.488 50.542 85.191 1.00 0.00 H TER 14629 WAT 6237 ATOM 14629 O WAT 6238 100.563 11.769 101.285 1.00 0.00 O ATOM 14630 H1 WAT 6238 100.051 10.973 101.426 1.00 0.00 H ATOM 14631 H2 WAT 6238 99.913 12.471 101.259 1.00 0.00 H TER 14633 WAT 6238 ATOM 14633 O WAT 6239 49.844 136.020 138.526 1.00 0.00 O ATOM 14634 H1 WAT 6239 49.178 135.385 138.788 1.00 0.00 H ATOM 14635 H2 WAT 6239 49.922 135.909 137.578 1.00 0.00 H TER 14637 WAT 6239 ATOM 14637 O WAT 6240 144.632 111.592 133.156 1.00 0.00 O ATOM 14638 H1 WAT 6240 144.314 112.487 133.034 1.00 0.00 H ATOM 14639 H2 WAT 6240 143.898 111.038 132.892 1.00 0.00 H TER 14641 WAT 6240 ATOM 14641 O WAT 6241 42.884 61.940 93.291 1.00 0.00 O ATOM 14642 H1 WAT 6241 43.347 61.363 93.898 1.00 0.00 H ATOM 14643 H2 WAT 6241 42.876 62.791 93.729 1.00 0.00 H TER 14645 WAT 6241 ATOM 14645 O WAT 6242 49.310 124.303 97.690 1.00 0.00 O ATOM 14646 H1 WAT 6242 49.932 123.802 98.217 1.00 0.00 H ATOM 14647 H2 WAT 6242 49.617 124.194 96.790 1.00 0.00 H TER 14649 WAT 6242 ATOM 14649 O WAT 6243 41.295 22.944 113.861 1.00 0.00 O ATOM 14650 H1 WAT 6243 40.951 23.255 113.024 1.00 0.00 H ATOM 14651 H2 WAT 6243 42.087 23.463 114.003 1.00 0.00 H TER 14653 WAT 6243 ATOM 14653 O WAT 6244 91.997 89.607 11.258 1.00 0.00 O ATOM 14654 H1 WAT 6244 92.197 90.523 11.062 1.00 0.00 H ATOM 14655 H2 WAT 6244 92.666 89.347 11.891 1.00 0.00 H TER 14657 WAT 6244 ATOM 14657 O WAT 6245 137.033 109.811 153.385 1.00 0.00 O ATOM 14658 H1 WAT 6245 137.328 110.590 153.858 1.00 0.00 H ATOM 14659 H2 WAT 6245 136.078 109.857 153.421 1.00 0.00 H TER 14661 WAT 6245 ATOM 14661 O WAT 6246 115.548 100.066 158.118 1.00 0.00 O ATOM 14662 H1 WAT 6246 115.416 99.337 157.512 1.00 0.00 H ATOM 14663 H2 WAT 6246 115.472 99.672 158.987 1.00 0.00 H TER 14665 WAT 6246 ATOM 14665 O WAT 6247 117.118 93.243 130.384 1.00 0.00 O ATOM 14666 H1 WAT 6247 117.110 93.697 131.226 1.00 0.00 H ATOM 14667 H2 WAT 6247 116.242 92.864 130.308 1.00 0.00 H TER 14669 WAT 6247 ATOM 14669 O WAT 6248 23.172 26.261 142.988 1.00 0.00 O ATOM 14670 H1 WAT 6248 22.883 25.915 143.832 1.00 0.00 H ATOM 14671 H2 WAT 6248 24.054 26.593 143.155 1.00 0.00 H TER 14673 WAT 6248 ATOM 14673 O WAT 6249 85.685 113.645 21.710 1.00 0.00 O ATOM 14674 H1 WAT 6249 86.326 113.832 22.396 1.00 0.00 H ATOM 14675 H2 WAT 6249 85.382 112.757 21.900 1.00 0.00 H TER 14677 WAT 6249 ATOM 14677 O WAT 6250 104.471 50.423 14.589 1.00 0.00 O ATOM 14678 H1 WAT 6250 104.790 50.481 15.490 1.00 0.00 H ATOM 14679 H2 WAT 6250 103.875 51.166 14.497 1.00 0.00 H TER 14681 WAT 6250 ATOM 14681 O WAT 6251 76.065 0.149 71.362 1.00 0.00 O ATOM 14682 H1 WAT 6251 75.322 0.579 71.787 1.00 0.00 H ATOM 14683 H2 WAT 6251 76.030 -0.755 71.675 1.00 0.00 H TER 14685 WAT 6251 ATOM 14685 O WAT 6252 18.425 111.991 98.634 1.00 0.00 O ATOM 14686 H1 WAT 6252 17.593 111.522 98.706 1.00 0.00 H ATOM 14687 H2 WAT 6252 18.200 112.812 98.196 1.00 0.00 H TER 14689 WAT 6252 ATOM 14689 O WAT 6253 127.603 92.309 143.561 1.00 0.00 O ATOM 14690 H1 WAT 6253 127.450 93.041 142.964 1.00 0.00 H ATOM 14691 H2 WAT 6253 126.788 91.807 143.538 1.00 0.00 H TER 14693 WAT 6253 ATOM 14693 O WAT 6254 130.577 139.395 77.394 1.00 0.00 O ATOM 14694 H1 WAT 6254 130.217 138.677 77.915 1.00 0.00 H ATOM 14695 H2 WAT 6254 131.407 139.055 77.061 1.00 0.00 H TER 14697 WAT 6254 ATOM 14697 O WAT 6255 3.561 72.188 25.047 1.00 0.00 O ATOM 14698 H1 WAT 6255 3.430 72.129 25.993 1.00 0.00 H ATOM 14699 H2 WAT 6255 2.731 71.896 24.671 1.00 0.00 H TER 14701 WAT 6255 ATOM 14701 O WAT 6256 106.418 79.984 10.094 1.00 0.00 O ATOM 14702 H1 WAT 6256 106.857 80.778 9.788 1.00 0.00 H ATOM 14703 H2 WAT 6256 107.123 79.344 10.193 1.00 0.00 H TER 14705 WAT 6256 ATOM 14705 O WAT 6257 76.457 132.194 97.112 1.00 0.00 O ATOM 14706 H1 WAT 6257 76.964 132.138 96.302 1.00 0.00 H ATOM 14707 H2 WAT 6257 75.554 132.023 96.842 1.00 0.00 H TER 14709 WAT 6257 ATOM 14709 O WAT 6258 26.389 135.797 55.374 1.00 0.00 O ATOM 14710 H1 WAT 6258 26.032 136.659 55.587 1.00 0.00 H ATOM 14711 H2 WAT 6258 26.751 135.898 54.493 1.00 0.00 H TER 14713 WAT 6258 ATOM 14713 O WAT 6259 21.047 44.952 6.081 1.00 0.00 O ATOM 14714 H1 WAT 6259 20.448 45.120 5.354 1.00 0.00 H ATOM 14715 H2 WAT 6259 21.458 45.799 6.253 1.00 0.00 H TER 14717 WAT 6259 ATOM 14717 O WAT 6260 45.009 45.586 59.836 1.00 0.00 O ATOM 14718 H1 WAT 6260 44.950 45.366 60.766 1.00 0.00 H ATOM 14719 H2 WAT 6260 45.192 46.525 59.823 1.00 0.00 H TER 14721 WAT 6260 ATOM 14721 O WAT 6261 75.809 75.184 109.399 1.00 0.00 O ATOM 14722 H1 WAT 6261 74.995 74.802 109.725 1.00 0.00 H ATOM 14723 H2 WAT 6261 75.624 76.121 109.331 1.00 0.00 H TER 14725 WAT 6261 ATOM 14725 O WAT 6262 98.469 109.794 27.361 1.00 0.00 O ATOM 14726 H1 WAT 6262 97.966 110.337 26.755 1.00 0.00 H ATOM 14727 H2 WAT 6262 99.362 109.816 27.018 1.00 0.00 H TER 14729 WAT 6262 ATOM 14729 O WAT 6263 6.147 26.037 96.765 1.00 0.00 O ATOM 14730 H1 WAT 6263 5.580 25.939 97.531 1.00 0.00 H ATOM 14731 H2 WAT 6263 6.309 26.978 96.706 1.00 0.00 H TER 14733 WAT 6263 ATOM 14733 O WAT 6264 72.697 20.017 104.125 1.00 0.00 O ATOM 14734 H1 WAT 6264 71.883 19.551 103.936 1.00 0.00 H ATOM 14735 H2 WAT 6264 73.365 19.331 104.147 1.00 0.00 H TER 14737 WAT 6264 ATOM 14737 O WAT 6265 118.938 101.742 123.208 1.00 0.00 O ATOM 14738 H1 WAT 6265 118.422 101.514 123.981 1.00 0.00 H ATOM 14739 H2 WAT 6265 119.026 102.694 123.251 1.00 0.00 H TER 14741 WAT 6265 ATOM 14741 O WAT 6266 123.446 96.862 100.961 1.00 0.00 O ATOM 14742 H1 WAT 6266 123.606 97.531 100.295 1.00 0.00 H ATOM 14743 H2 WAT 6266 124.240 96.862 101.496 1.00 0.00 H TER 14745 WAT 6266 ATOM 14745 O WAT 6267 104.148 96.074 86.243 1.00 0.00 O ATOM 14746 H1 WAT 6267 104.381 95.550 85.476 1.00 0.00 H ATOM 14747 H2 WAT 6267 104.659 95.694 86.957 1.00 0.00 H TER 14749 WAT 6267 ATOM 14749 O WAT 6268 68.299 113.249 141.211 1.00 0.00 O ATOM 14750 H1 WAT 6268 67.979 113.503 142.077 1.00 0.00 H ATOM 14751 H2 WAT 6268 67.536 112.866 140.778 1.00 0.00 H TER 14753 WAT 6268 ATOM 14753 O WAT 6269 132.993 129.707 81.113 1.00 0.00 O ATOM 14754 H1 WAT 6269 132.658 128.836 80.898 1.00 0.00 H ATOM 14755 H2 WAT 6269 132.664 130.269 80.412 1.00 0.00 H TER 14757 WAT 6269 ATOM 14757 O WAT 6270 53.612 28.774 146.896 1.00 0.00 O ATOM 14758 H1 WAT 6270 53.170 28.785 147.745 1.00 0.00 H ATOM 14759 H2 WAT 6270 54.496 28.462 147.090 1.00 0.00 H TER 14761 WAT 6270 ATOM 14761 O WAT 6271 111.579 103.383 61.841 1.00 0.00 O ATOM 14762 H1 WAT 6271 111.691 102.652 62.449 1.00 0.00 H ATOM 14763 H2 WAT 6271 111.857 104.152 62.338 1.00 0.00 H TER 14765 WAT 6271 ATOM 14765 O WAT 6272 59.004 139.093 97.830 1.00 0.00 O ATOM 14766 H1 WAT 6272 59.729 138.666 98.286 1.00 0.00 H ATOM 14767 H2 WAT 6272 58.970 138.660 96.976 1.00 0.00 H TER 14769 WAT 6272 ATOM 14769 O WAT 6273 48.871 123.915 154.055 1.00 0.00 O ATOM 14770 H1 WAT 6273 47.980 123.568 154.098 1.00 0.00 H ATOM 14771 H2 WAT 6273 49.261 123.480 153.296 1.00 0.00 H TER 14773 WAT 6273 ATOM 14773 O WAT 6274 49.561 21.601 10.872 1.00 0.00 O ATOM 14774 H1 WAT 6274 48.918 21.139 11.411 1.00 0.00 H ATOM 14775 H2 WAT 6274 50.196 21.946 11.499 1.00 0.00 H TER 14777 WAT 6274 ATOM 14777 O WAT 6275 17.198 4.406 112.332 1.00 0.00 O ATOM 14778 H1 WAT 6275 17.200 5.362 112.293 1.00 0.00 H ATOM 14779 H2 WAT 6275 17.750 4.135 111.598 1.00 0.00 H TER 14781 WAT 6275 ATOM 14781 O WAT 6276 32.628 144.976 145.472 1.00 0.00 O ATOM 14782 H1 WAT 6276 31.972 145.674 145.457 1.00 0.00 H ATOM 14783 H2 WAT 6276 32.555 144.561 144.613 1.00 0.00 H TER 14785 WAT 6276 ATOM 14785 O WAT 6277 6.300 118.603 74.381 1.00 0.00 O ATOM 14786 H1 WAT 6277 6.786 118.379 75.175 1.00 0.00 H ATOM 14787 H2 WAT 6277 6.867 118.317 73.665 1.00 0.00 H TER 14789 WAT 6277 ATOM 14789 O WAT 6278 51.808 81.079 23.823 1.00 0.00 O ATOM 14790 H1 WAT 6278 51.593 82.008 23.899 1.00 0.00 H ATOM 14791 H2 WAT 6278 51.614 80.716 24.687 1.00 0.00 H TER 14793 WAT 6278 ATOM 14793 O WAT 6279 128.562 129.623 102.093 1.00 0.00 O ATOM 14794 H1 WAT 6279 127.675 129.576 101.737 1.00 0.00 H ATOM 14795 H2 WAT 6279 128.828 130.532 101.953 1.00 0.00 H TER 14797 WAT 6279 ATOM 14797 O WAT 6280 91.526 88.109 81.196 1.00 0.00 O ATOM 14798 H1 WAT 6280 91.667 87.287 80.726 1.00 0.00 H ATOM 14799 H2 WAT 6280 90.935 87.877 81.913 1.00 0.00 H TER 14801 WAT 6280 ATOM 14801 O WAT 6281 45.894 98.606 153.754 1.00 0.00 O ATOM 14802 H1 WAT 6281 45.737 98.922 152.864 1.00 0.00 H ATOM 14803 H2 WAT 6281 46.642 98.014 153.669 1.00 0.00 H TER 14805 WAT 6281 ATOM 14805 O WAT 6282 18.227 131.202 115.183 1.00 0.00 O ATOM 14806 H1 WAT 6282 18.205 131.027 114.242 1.00 0.00 H ATOM 14807 H2 WAT 6282 17.452 131.738 115.346 1.00 0.00 H TER 14809 WAT 6282 ATOM 14809 O WAT 6283 45.121 32.983 93.176 1.00 0.00 O ATOM 14810 H1 WAT 6283 44.713 32.131 93.328 1.00 0.00 H ATOM 14811 H2 WAT 6283 45.084 33.422 94.026 1.00 0.00 H TER 14813 WAT 6283 ATOM 14813 O WAT 6284 0.688 63.622 139.626 1.00 0.00 O ATOM 14814 H1 WAT 6284 0.710 63.544 138.672 1.00 0.00 H ATOM 14815 H2 WAT 6284 -0.163 63.262 139.876 1.00 0.00 H TER 14817 WAT 6284 ATOM 14817 O WAT 6285 106.397 100.548 75.608 1.00 0.00 O ATOM 14818 H1 WAT 6285 106.648 99.911 76.276 1.00 0.00 H ATOM 14819 H2 WAT 6285 105.819 101.159 76.065 1.00 0.00 H TER 14821 WAT 6285 ATOM 14821 O WAT 6286 141.445 93.244 125.502 1.00 0.00 O ATOM 14822 H1 WAT 6286 141.321 92.703 124.723 1.00 0.00 H ATOM 14823 H2 WAT 6286 142.389 93.230 125.656 1.00 0.00 H TER 14825 WAT 6286 ATOM 14825 O WAT 6287 73.106 137.903 1.582 1.00 0.00 O ATOM 14826 H1 WAT 6287 73.407 137.102 1.153 1.00 0.00 H ATOM 14827 H2 WAT 6287 72.578 138.346 0.919 1.00 0.00 H TER 14829 WAT 6287 ATOM 14829 O WAT 6288 27.285 111.027 154.564 1.00 0.00 O ATOM 14830 H1 WAT 6288 27.813 111.632 155.084 1.00 0.00 H ATOM 14831 H2 WAT 6288 27.728 110.989 153.716 1.00 0.00 H TER 14833 WAT 6288 ATOM 14833 O WAT 6289 18.751 22.096 22.981 1.00 0.00 O ATOM 14834 H1 WAT 6289 19.486 22.391 23.519 1.00 0.00 H ATOM 14835 H2 WAT 6289 18.507 22.865 22.466 1.00 0.00 H TER 14837 WAT 6289 ATOM 14837 O WAT 6290 34.943 56.110 153.471 1.00 0.00 O ATOM 14838 H1 WAT 6290 34.996 55.502 154.208 1.00 0.00 H ATOM 14839 H2 WAT 6290 35.829 56.128 153.110 1.00 0.00 H TER 14841 WAT 6290 ATOM 14841 O WAT 6291 72.218 9.048 85.108 1.00 0.00 O ATOM 14842 H1 WAT 6291 72.218 8.669 85.987 1.00 0.00 H ATOM 14843 H2 WAT 6291 71.682 9.837 85.188 1.00 0.00 H TER 14845 WAT 6291 ATOM 14845 O WAT 6292 85.332 55.375 3.875 1.00 0.00 O ATOM 14846 H1 WAT 6292 86.261 55.144 3.858 1.00 0.00 H ATOM 14847 H2 WAT 6292 85.297 56.187 4.381 1.00 0.00 H TER 14849 WAT 6292 ATOM 14849 O WAT 6293 22.917 127.911 21.471 1.00 0.00 O ATOM 14850 H1 WAT 6293 23.828 127.810 21.746 1.00 0.00 H ATOM 14851 H2 WAT 6293 22.411 127.829 22.279 1.00 0.00 H TER 14853 WAT 6293 ATOM 14853 O WAT 6294 31.540 4.969 104.639 1.00 0.00 O ATOM 14854 H1 WAT 6294 31.326 5.776 104.170 1.00 0.00 H ATOM 14855 H2 WAT 6294 30.864 4.348 104.368 1.00 0.00 H TER 14857 WAT 6294 ATOM 14857 O WAT 6295 41.198 56.135 81.198 1.00 0.00 O ATOM 14858 H1 WAT 6295 40.379 55.771 81.535 1.00 0.00 H ATOM 14859 H2 WAT 6295 41.873 55.778 81.775 1.00 0.00 H TER 14861 WAT 6295 ATOM 14861 O WAT 6296 93.977 40.307 102.502 1.00 0.00 O ATOM 14862 H1 WAT 6296 94.691 40.591 103.072 1.00 0.00 H ATOM 14863 H2 WAT 6296 94.005 39.351 102.541 1.00 0.00 H TER 14865 WAT 6296 ATOM 14865 O WAT 6297 117.691 135.307 86.924 1.00 0.00 O ATOM 14866 H1 WAT 6297 118.307 134.967 86.276 1.00 0.00 H ATOM 14867 H2 WAT 6297 117.788 136.258 86.870 1.00 0.00 H TER 14869 WAT 6297 ATOM 14869 O WAT 6298 69.388 111.748 80.318 1.00 0.00 O ATOM 14870 H1 WAT 6298 69.325 112.277 81.113 1.00 0.00 H ATOM 14871 H2 WAT 6298 70.280 111.892 80.004 1.00 0.00 H TER 14873 WAT 6298 ATOM 14873 O WAT 6299 113.771 74.130 2.738 1.00 0.00 O ATOM 14874 H1 WAT 6299 113.502 74.208 1.823 1.00 0.00 H ATOM 14875 H2 WAT 6299 113.309 73.355 3.058 1.00 0.00 H TER 14877 WAT 6299 ATOM 14877 O WAT 6300 70.946 75.203 144.661 1.00 0.00 O ATOM 14878 H1 WAT 6300 70.650 76.096 144.839 1.00 0.00 H ATOM 14879 H2 WAT 6300 70.394 74.653 145.218 1.00 0.00 H TER 14881 WAT 6300 ATOM 14881 O WAT 6301 4.429 29.870 106.275 1.00 0.00 O ATOM 14882 H1 WAT 6301 4.465 29.786 107.228 1.00 0.00 H ATOM 14883 H2 WAT 6301 4.019 29.058 105.978 1.00 0.00 H TER 14885 WAT 6301 ATOM 14885 O WAT 6302 137.474 58.200 66.437 1.00 0.00 O ATOM 14886 H1 WAT 6302 138.141 57.514 66.445 1.00 0.00 H ATOM 14887 H2 WAT 6302 137.481 58.530 65.538 1.00 0.00 H TER 14889 WAT 6302 ATOM 14889 O WAT 6303 26.589 34.257 94.649 1.00 0.00 O ATOM 14890 H1 WAT 6303 26.550 35.087 95.124 1.00 0.00 H ATOM 14891 H2 WAT 6303 25.955 34.358 93.939 1.00 0.00 H TER 14893 WAT 6303 ATOM 14893 O WAT 6304 49.426 34.553 67.606 1.00 0.00 O ATOM 14894 H1 WAT 6304 49.889 34.944 68.347 1.00 0.00 H ATOM 14895 H2 WAT 6304 49.433 33.613 67.789 1.00 0.00 H TER 14897 WAT 6304 ATOM 14897 O WAT 6305 53.811 129.213 3.950 1.00 0.00 O ATOM 14898 H1 WAT 6305 53.216 129.378 4.681 1.00 0.00 H ATOM 14899 H2 WAT 6305 53.613 128.317 3.677 1.00 0.00 H TER 14901 WAT 6305 ATOM 14901 O WAT 6306 76.245 120.687 2.856 1.00 0.00 O ATOM 14902 H1 WAT 6306 76.237 121.564 3.237 1.00 0.00 H ATOM 14903 H2 WAT 6306 75.340 120.385 2.930 1.00 0.00 H TER 14905 WAT 6306 ATOM 14905 O WAT 6307 114.062 80.748 70.693 1.00 0.00 O ATOM 14906 H1 WAT 6307 114.686 81.463 70.820 1.00 0.00 H ATOM 14907 H2 WAT 6307 113.353 80.937 71.308 1.00 0.00 H TER 14909 WAT 6307 ATOM 14909 O WAT 6308 94.711 69.074 84.440 1.00 0.00 O ATOM 14910 H1 WAT 6308 94.785 68.190 84.081 1.00 0.00 H ATOM 14911 H2 WAT 6308 94.105 68.985 85.175 1.00 0.00 H TER 14913 WAT 6308 ATOM 14913 O WAT 6309 73.957 66.374 152.414 1.00 0.00 O ATOM 14914 H1 WAT 6309 73.842 66.850 151.592 1.00 0.00 H ATOM 14915 H2 WAT 6309 73.087 66.029 152.615 1.00 0.00 H TER 14917 WAT 6309 ATOM 14917 O WAT 6310 63.034 25.794 109.685 1.00 0.00 O ATOM 14918 H1 WAT 6310 62.164 25.853 110.079 1.00 0.00 H ATOM 14919 H2 WAT 6310 63.335 24.911 109.902 1.00 0.00 H TER 14921 WAT 6310 ATOM 14921 O WAT 6311 66.338 22.342 101.557 1.00 0.00 O ATOM 14922 H1 WAT 6311 65.693 21.820 101.080 1.00 0.00 H ATOM 14923 H2 WAT 6311 65.863 22.671 102.320 1.00 0.00 H TER 14925 WAT 6311 ATOM 14925 O WAT 6312 143.317 60.070 7.049 1.00 0.00 O ATOM 14926 H1 WAT 6312 143.745 59.234 7.237 1.00 0.00 H ATOM 14927 H2 WAT 6312 142.736 60.214 7.796 1.00 0.00 H TER 14929 WAT 6312 ATOM 14929 O WAT 6313 103.681 93.688 91.568 1.00 0.00 O ATOM 14930 H1 WAT 6313 102.743 93.798 91.414 1.00 0.00 H ATOM 14931 H2 WAT 6313 104.074 93.732 90.696 1.00 0.00 H TER 14933 WAT 6313 ATOM 14933 O WAT 6314 76.731 129.653 56.680 1.00 0.00 O ATOM 14934 H1 WAT 6314 76.654 129.516 55.736 1.00 0.00 H ATOM 14935 H2 WAT 6314 76.014 129.141 57.055 1.00 0.00 H TER 14937 WAT 6314 ATOM 14937 O WAT 6315 0.176 10.784 8.945 1.00 0.00 O ATOM 14938 H1 WAT 6315 0.895 10.173 8.783 1.00 0.00 H ATOM 14939 H2 WAT 6315 -0.616 10.263 8.809 1.00 0.00 H TER 14941 WAT 6315 ATOM 14941 O WAT 6316 120.773 22.617 70.658 1.00 0.00 O ATOM 14942 H1 WAT 6316 120.099 23.213 70.333 1.00 0.00 H ATOM 14943 H2 WAT 6316 120.296 21.989 71.201 1.00 0.00 H TER 14945 WAT 6316 ATOM 14945 O WAT 6317 45.552 33.070 80.544 1.00 0.00 O ATOM 14946 H1 WAT 6317 46.410 32.892 80.930 1.00 0.00 H ATOM 14947 H2 WAT 6317 45.625 33.961 80.200 1.00 0.00 H TER 14949 WAT 6317 ATOM 14949 O WAT 6318 136.556 75.383 145.716 1.00 0.00 O ATOM 14950 H1 WAT 6318 137.127 75.639 144.992 1.00 0.00 H ATOM 14951 H2 WAT 6318 136.056 76.174 145.918 1.00 0.00 H TER 14953 WAT 6318 ATOM 14953 O WAT 6319 13.351 31.846 65.606 1.00 0.00 O ATOM 14954 H1 WAT 6319 13.065 31.452 64.782 1.00 0.00 H ATOM 14955 H2 WAT 6319 13.175 31.175 66.266 1.00 0.00 H TER 14957 WAT 6319 ATOM 14957 O WAT 6320 137.768 59.476 118.249 1.00 0.00 O ATOM 14958 H1 WAT 6320 137.054 59.650 117.635 1.00 0.00 H ATOM 14959 H2 WAT 6320 137.427 58.791 118.824 1.00 0.00 H TER 14961 WAT 6320 ATOM 14961 O WAT 6321 130.205 136.753 78.658 1.00 0.00 O ATOM 14962 H1 WAT 6321 130.978 136.189 78.676 1.00 0.00 H ATOM 14963 H2 WAT 6321 130.015 136.927 79.580 1.00 0.00 H TER 14965 WAT 6321 ATOM 14965 O WAT 6322 61.722 36.859 117.671 1.00 0.00 O ATOM 14966 H1 WAT 6322 62.410 37.362 117.235 1.00 0.00 H ATOM 14967 H2 WAT 6322 61.644 37.261 118.536 1.00 0.00 H TER 14969 WAT 6322 ATOM 14969 O WAT 6323 42.656 24.404 87.721 1.00 0.00 O ATOM 14970 H1 WAT 6323 43.500 24.810 87.524 1.00 0.00 H ATOM 14971 H2 WAT 6323 42.598 24.424 88.676 1.00 0.00 H TER 14973 WAT 6323 ATOM 14973 O WAT 6324 142.554 135.735 132.743 1.00 0.00 O ATOM 14974 H1 WAT 6324 143.172 135.209 133.251 1.00 0.00 H ATOM 14975 H2 WAT 6324 141.709 135.307 132.878 1.00 0.00 H TER 14977 WAT 6324 ATOM 14977 O WAT 6325 43.869 75.002 123.976 1.00 0.00 O ATOM 14978 H1 WAT 6325 43.131 74.884 123.378 1.00 0.00 H ATOM 14979 H2 WAT 6325 44.500 74.332 123.713 1.00 0.00 H TER 14981 WAT 6325 ATOM 14981 O WAT 6326 40.332 131.418 73.415 1.00 0.00 O ATOM 14982 H1 WAT 6326 41.159 131.310 72.947 1.00 0.00 H ATOM 14983 H2 WAT 6326 40.568 131.345 74.340 1.00 0.00 H TER 14985 WAT 6326 ATOM 14985 O WAT 6327 8.762 142.834 151.397 1.00 0.00 O ATOM 14986 H1 WAT 6327 7.982 143.314 151.673 1.00 0.00 H ATOM 14987 H2 WAT 6327 8.858 143.047 150.468 1.00 0.00 H TER 14989 WAT 6327 ATOM 14989 O WAT 6328 5.457 33.257 116.330 1.00 0.00 O ATOM 14990 H1 WAT 6328 5.739 33.967 115.754 1.00 0.00 H ATOM 14991 H2 WAT 6328 4.560 33.067 116.056 1.00 0.00 H TER 14993 WAT 6328 ATOM 14993 O WAT 6329 47.354 11.777 127.394 1.00 0.00 O ATOM 14994 H1 WAT 6329 47.722 10.899 127.298 1.00 0.00 H ATOM 14995 H2 WAT 6329 47.773 12.129 128.179 1.00 0.00 H TER 14997 WAT 6329 ATOM 14997 O WAT 6330 33.551 130.528 12.735 1.00 0.00 O ATOM 14998 H1 WAT 6330 34.232 130.848 12.144 1.00 0.00 H ATOM 14999 H2 WAT 6330 33.774 130.907 13.585 1.00 0.00 H TER 15001 WAT 6330 ATOM 15001 O WAT 6331 19.052 51.608 156.154 1.00 0.00 O ATOM 15002 H1 WAT 6331 19.046 51.362 155.229 1.00 0.00 H ATOM 15003 H2 WAT 6331 18.134 51.781 156.362 1.00 0.00 H TER 15005 WAT 6331 ATOM 15005 O WAT 6332 136.830 90.500 95.601 1.00 0.00 O ATOM 15006 H1 WAT 6332 136.625 90.219 96.493 1.00 0.00 H ATOM 15007 H2 WAT 6332 137.237 89.734 95.197 1.00 0.00 H TER 15009 WAT 6332 ATOM 15009 O WAT 6333 94.017 3.390 152.032 1.00 0.00 O ATOM 15010 H1 WAT 6333 93.834 4.267 151.696 1.00 0.00 H ATOM 15011 H2 WAT 6333 94.618 3.534 152.763 1.00 0.00 H TER 15013 WAT 6333 ATOM 15013 O WAT 6334 120.890 139.437 91.090 1.00 0.00 O ATOM 15014 H1 WAT 6334 120.995 139.253 92.023 1.00 0.00 H ATOM 15015 H2 WAT 6334 121.360 140.260 90.954 1.00 0.00 H TER 15017 WAT 6334 ATOM 15017 O WAT 6335 110.408 129.661 82.138 1.00 0.00 O ATOM 15018 H1 WAT 6335 110.915 129.928 81.370 1.00 0.00 H ATOM 15019 H2 WAT 6335 110.096 130.483 82.515 1.00 0.00 H TER 15021 WAT 6335 ATOM 15021 O WAT 6336 108.394 136.041 105.485 1.00 0.00 O ATOM 15022 H1 WAT 6336 109.139 136.555 105.176 1.00 0.00 H ATOM 15023 H2 WAT 6336 107.744 136.693 105.746 1.00 0.00 H TER 15025 WAT 6336 ATOM 15025 O WAT 6337 13.218 78.217 127.523 1.00 0.00 O ATOM 15026 H1 WAT 6337 12.350 77.863 127.716 1.00 0.00 H ATOM 15027 H2 WAT 6337 13.444 78.733 128.297 1.00 0.00 H TER 15029 WAT 6337 ATOM 15029 O WAT 6338 138.137 23.702 71.893 1.00 0.00 O ATOM 15030 H1 WAT 6338 138.206 22.791 71.608 1.00 0.00 H ATOM 15031 H2 WAT 6338 138.759 24.173 71.338 1.00 0.00 H TER 15033 WAT 6338 ATOM 15033 O WAT 6339 37.430 141.978 139.870 1.00 0.00 O ATOM 15034 H1 WAT 6339 37.831 142.539 139.205 1.00 0.00 H ATOM 15035 H2 WAT 6339 37.979 142.097 140.645 1.00 0.00 H TER 15037 WAT 6339 ATOM 15037 O WAT 6340 97.429 39.204 99.805 1.00 0.00 O ATOM 15038 H1 WAT 6340 96.798 38.489 99.886 1.00 0.00 H ATOM 15039 H2 WAT 6340 98.128 38.846 99.258 1.00 0.00 H TER 15041 WAT 6340 ATOM 15041 O WAT 6341 123.971 77.042 139.214 1.00 0.00 O ATOM 15042 H1 WAT 6341 123.612 77.337 140.051 1.00 0.00 H ATOM 15043 H2 WAT 6341 123.214 76.704 138.735 1.00 0.00 H TER 15045 WAT 6341 ATOM 15045 O WAT 6342 101.257 139.847 16.295 1.00 0.00 O ATOM 15046 H1 WAT 6342 101.019 139.114 16.862 1.00 0.00 H ATOM 15047 H2 WAT 6342 102.205 139.932 16.397 1.00 0.00 H TER 15049 WAT 6342 ATOM 15049 O WAT 6343 43.828 105.428 9.707 1.00 0.00 O ATOM 15050 H1 WAT 6343 44.046 104.797 10.393 1.00 0.00 H ATOM 15051 H2 WAT 6343 43.787 106.270 10.159 1.00 0.00 H TER 15053 WAT 6343 ATOM 15053 O WAT 6344 108.145 111.542 103.282 1.00 0.00 O ATOM 15054 H1 WAT 6344 107.593 110.814 103.569 1.00 0.00 H ATOM 15055 H2 WAT 6344 107.527 112.238 103.059 1.00 0.00 H TER 15057 WAT 6344 ATOM 15057 O WAT 6345 27.883 8.816 134.558 1.00 0.00 O ATOM 15058 H1 WAT 6345 27.117 9.167 134.104 1.00 0.00 H ATOM 15059 H2 WAT 6345 27.595 8.708 135.465 1.00 0.00 H TER 15061 WAT 6345 ATOM 15061 O WAT 6346 43.061 17.289 146.823 1.00 0.00 O ATOM 15062 H1 WAT 6346 42.948 16.367 147.053 1.00 0.00 H ATOM 15063 H2 WAT 6346 43.676 17.280 146.090 1.00 0.00 H TER 15065 WAT 6346 ATOM 15065 O WAT 6347 89.783 135.655 108.730 1.00 0.00 O ATOM 15066 H1 WAT 6347 89.535 134.910 108.181 1.00 0.00 H ATOM 15067 H2 WAT 6347 89.372 135.476 109.576 1.00 0.00 H TER 15069 WAT 6347 ATOM 15069 O WAT 6348 104.809 138.958 9.821 1.00 0.00 O ATOM 15070 H1 WAT 6348 104.511 139.852 9.653 1.00 0.00 H ATOM 15071 H2 WAT 6348 105.283 139.016 10.651 1.00 0.00 H TER 15073 WAT 6348 ATOM 15073 O WAT 6349 138.175 141.321 15.724 1.00 0.00 O ATOM 15074 H1 WAT 6349 138.313 140.753 16.482 1.00 0.00 H ATOM 15075 H2 WAT 6349 137.389 140.972 15.303 1.00 0.00 H TER 15077 WAT 6349 ATOM 15077 O WAT 6350 40.826 37.457 86.838 1.00 0.00 O ATOM 15078 H1 WAT 6350 40.642 38.344 87.145 1.00 0.00 H ATOM 15079 H2 WAT 6350 41.128 37.573 85.937 1.00 0.00 H TER 15081 WAT 6350 ATOM 15081 O WAT 6351 40.534 84.890 143.262 1.00 0.00 O ATOM 15082 H1 WAT 6351 39.838 84.358 142.878 1.00 0.00 H ATOM 15083 H2 WAT 6351 40.286 85.792 143.059 1.00 0.00 H TER 15085 WAT 6351 ATOM 15085 O WAT 6352 127.965 95.125 80.092 1.00 0.00 O ATOM 15086 H1 WAT 6352 128.373 95.542 79.333 1.00 0.00 H ATOM 15087 H2 WAT 6352 127.936 95.813 80.757 1.00 0.00 H TER 15089 WAT 6352 ATOM 15089 O WAT 6353 53.980 115.588 73.504 1.00 0.00 O ATOM 15090 H1 WAT 6353 54.705 115.223 74.012 1.00 0.00 H ATOM 15091 H2 WAT 6353 54.400 116.007 72.753 1.00 0.00 H TER 15093 WAT 6353 ATOM 15093 O WAT 6354 28.412 19.663 8.025 1.00 0.00 O ATOM 15094 H1 WAT 6354 27.464 19.627 8.154 1.00 0.00 H ATOM 15095 H2 WAT 6354 28.623 20.596 8.061 1.00 0.00 H TER 15097 WAT 6354 ATOM 15097 O WAT 6355 66.714 57.785 56.291 1.00 0.00 O ATOM 15098 H1 WAT 6355 67.551 57.321 56.327 1.00 0.00 H ATOM 15099 H2 WAT 6355 66.062 57.119 56.510 1.00 0.00 H TER 15101 WAT 6355 ATOM 15101 O WAT 6356 65.658 114.442 105.228 1.00 0.00 O ATOM 15102 H1 WAT 6356 66.553 114.478 105.567 1.00 0.00 H ATOM 15103 H2 WAT 6356 65.440 115.354 105.032 1.00 0.00 H TER 15105 WAT 6356 ATOM 15105 O WAT 6357 78.792 36.890 65.239 1.00 0.00 O ATOM 15106 H1 WAT 6357 78.312 37.509 65.789 1.00 0.00 H ATOM 15107 H2 WAT 6357 78.521 37.103 64.346 1.00 0.00 H TER 15109 WAT 6357 ATOM 15109 O WAT 6358 120.161 106.437 97.745 1.00 0.00 O ATOM 15110 H1 WAT 6358 119.554 106.709 98.433 1.00 0.00 H ATOM 15111 H2 WAT 6358 120.221 107.195 97.165 1.00 0.00 H TER 15113 WAT 6358 ATOM 15113 O WAT 6359 97.468 48.432 20.319 1.00 0.00 O ATOM 15114 H1 WAT 6359 96.518 48.551 20.341 1.00 0.00 H ATOM 15115 H2 WAT 6359 97.751 48.603 21.217 1.00 0.00 H TER 15117 WAT 6359 ATOM 15117 O WAT 6360 95.469 50.844 90.538 1.00 0.00 O ATOM 15118 H1 WAT 6360 95.491 51.244 89.668 1.00 0.00 H ATOM 15119 H2 WAT 6360 94.584 51.019 90.859 1.00 0.00 H TER 15121 WAT 6360 ATOM 15121 O WAT 6361 39.789 60.142 64.795 1.00 0.00 O ATOM 15122 H1 WAT 6361 40.068 59.358 65.267 1.00 0.00 H ATOM 15123 H2 WAT 6361 38.844 60.185 64.938 1.00 0.00 H TER 15125 WAT 6361 ATOM 15125 O WAT 6362 56.130 87.942 91.279 1.00 0.00 O ATOM 15126 H1 WAT 6362 56.429 87.036 91.356 1.00 0.00 H ATOM 15127 H2 WAT 6362 56.927 88.465 91.374 1.00 0.00 H TER 15129 WAT 6362 ATOM 15129 O WAT 6363 112.679 132.884 69.260 1.00 0.00 O ATOM 15130 H1 WAT 6363 112.473 131.953 69.338 1.00 0.00 H ATOM 15131 H2 WAT 6363 111.855 133.329 69.460 1.00 0.00 H TER 15133 WAT 6363 ATOM 15133 O WAT 6364 93.149 68.937 86.745 1.00 0.00 O ATOM 15134 H1 WAT 6364 93.288 69.703 87.301 1.00 0.00 H ATOM 15135 H2 WAT 6364 92.253 69.036 86.421 1.00 0.00 H TER 15137 WAT 6364 ATOM 15137 O WAT 6365 103.397 12.272 102.403 1.00 0.00 O ATOM 15138 H1 WAT 6365 104.180 12.821 102.381 1.00 0.00 H ATOM 15139 H2 WAT 6365 102.947 12.529 103.209 1.00 0.00 H TER 15141 WAT 6365 ATOM 15141 O WAT 6366 137.441 133.853 144.221 1.00 0.00 O ATOM 15142 H1 WAT 6366 138.236 134.311 144.491 1.00 0.00 H ATOM 15143 H2 WAT 6366 136.727 134.415 144.521 1.00 0.00 H TER 15145 WAT 6366 ATOM 15145 O WAT 6367 77.966 130.597 82.133 1.00 0.00 O ATOM 15146 H1 WAT 6367 77.147 130.532 82.625 1.00 0.00 H ATOM 15147 H2 WAT 6367 78.571 131.035 82.732 1.00 0.00 H TER 15149 WAT 6367 ATOM 15149 O WAT 6368 23.612 134.980 153.678 1.00 0.00 O ATOM 15150 H1 WAT 6368 22.808 135.096 154.184 1.00 0.00 H ATOM 15151 H2 WAT 6368 23.995 135.856 153.632 1.00 0.00 H TER 15153 WAT 6368 ATOM 15153 O WAT 6369 2.437 79.496 119.425 1.00 0.00 O ATOM 15154 H1 WAT 6369 2.365 78.721 119.982 1.00 0.00 H ATOM 15155 H2 WAT 6369 1.532 79.773 119.282 1.00 0.00 H TER 15157 WAT 6369 ATOM 15157 O WAT 6370 109.042 99.498 71.606 1.00 0.00 O ATOM 15158 H1 WAT 6370 109.600 99.929 70.958 1.00 0.00 H ATOM 15159 H2 WAT 6370 108.417 98.993 71.085 1.00 0.00 H TER 15161 WAT 6370 ATOM 15161 O WAT 6371 97.544 12.496 122.761 1.00 0.00 O ATOM 15162 H1 WAT 6371 97.331 12.034 123.572 1.00 0.00 H ATOM 15163 H2 WAT 6371 98.293 12.019 122.404 1.00 0.00 H TER 15165 WAT 6371 ATOM 15165 O WAT 6372 100.799 139.913 21.728 1.00 0.00 O ATOM 15166 H1 WAT 6372 101.287 139.325 22.304 1.00 0.00 H ATOM 15167 H2 WAT 6372 101.404 140.104 21.012 1.00 0.00 H TER 15169 WAT 6372 ATOM 15169 O WAT 6373 116.205 75.175 18.867 1.00 0.00 O ATOM 15170 H1 WAT 6373 115.840 76.031 19.090 1.00 0.00 H ATOM 15171 H2 WAT 6373 117.146 75.271 19.012 1.00 0.00 H TER 15173 WAT 6373 ATOM 15173 O WAT 6374 84.518 33.136 112.194 1.00 0.00 O ATOM 15174 H1 WAT 6374 83.783 33.747 112.140 1.00 0.00 H ATOM 15175 H2 WAT 6374 85.268 33.635 111.871 1.00 0.00 H TER 15177 WAT 6374 ATOM 15177 O WAT 6375 50.965 131.553 115.812 1.00 0.00 O ATOM 15178 H1 WAT 6375 51.408 132.260 115.342 1.00 0.00 H ATOM 15179 H2 WAT 6375 51.673 131.067 116.236 1.00 0.00 H TER 15181 WAT 6375 ATOM 15181 O WAT 6376 42.151 79.762 133.840 1.00 0.00 O ATOM 15182 H1 WAT 6376 41.815 80.568 133.449 1.00 0.00 H ATOM 15183 H2 WAT 6376 42.896 79.522 133.290 1.00 0.00 H TER 15185 WAT 6376 ATOM 15185 O WAT 6377 48.626 104.026 108.855 1.00 0.00 O ATOM 15186 H1 WAT 6377 47.721 104.318 108.744 1.00 0.00 H ATOM 15187 H2 WAT 6377 48.707 103.269 108.275 1.00 0.00 H TER 15189 WAT 6377 ATOM 15189 O WAT 6378 45.361 48.672 123.097 1.00 0.00 O ATOM 15190 H1 WAT 6378 45.743 49.540 123.229 1.00 0.00 H ATOM 15191 H2 WAT 6378 44.586 48.664 123.658 1.00 0.00 H TER 15193 WAT 6378 ATOM 15193 O WAT 6379 94.838 34.723 87.822 1.00 0.00 O ATOM 15194 H1 WAT 6379 95.397 35.103 88.501 1.00 0.00 H ATOM 15195 H2 WAT 6379 93.946 34.905 88.117 1.00 0.00 H TER 15197 WAT 6379 ATOM 15197 O WAT 6380 96.047 27.444 131.497 1.00 0.00 O ATOM 15198 H1 WAT 6380 95.105 27.527 131.648 1.00 0.00 H ATOM 15199 H2 WAT 6380 96.311 28.299 131.157 1.00 0.00 H TER 15201 WAT 6380 ATOM 15201 O WAT 6381 129.703 141.406 151.457 1.00 0.00 O ATOM 15202 H1 WAT 6381 129.898 141.657 152.360 1.00 0.00 H ATOM 15203 H2 WAT 6381 129.824 140.456 151.441 1.00 0.00 H TER 15205 WAT 6381 ATOM 15205 O WAT 6382 128.339 47.603 84.765 1.00 0.00 O ATOM 15206 H1 WAT 6382 128.491 47.133 85.585 1.00 0.00 H ATOM 15207 H2 WAT 6382 127.766 48.330 85.008 1.00 0.00 H TER 15209 WAT 6382 ATOM 15209 O WAT 6383 99.561 6.996 153.355 1.00 0.00 O ATOM 15210 H1 WAT 6383 99.103 6.396 153.944 1.00 0.00 H ATOM 15211 H2 WAT 6383 99.063 7.812 153.410 1.00 0.00 H TER 15213 WAT 6383 ATOM 15213 O WAT 6384 110.291 121.797 85.917 1.00 0.00 O ATOM 15214 H1 WAT 6384 109.962 121.149 86.540 1.00 0.00 H ATOM 15215 H2 WAT 6384 110.108 122.641 86.330 1.00 0.00 H TER 15217 WAT 6384 ATOM 15217 O WAT 6385 29.717 84.275 75.187 1.00 0.00 O ATOM 15218 H1 WAT 6385 30.457 83.706 75.399 1.00 0.00 H ATOM 15219 H2 WAT 6385 28.981 83.676 75.068 1.00 0.00 H TER 15221 WAT 6385 ATOM 15221 O WAT 6386 120.409 80.265 158.221 1.00 0.00 O ATOM 15222 H1 WAT 6386 119.983 80.801 158.890 1.00 0.00 H ATOM 15223 H2 WAT 6386 119.711 80.061 157.597 1.00 0.00 H TER 15225 WAT 6386 ATOM 15225 O WAT 6387 85.850 35.723 108.640 1.00 0.00 O ATOM 15226 H1 WAT 6387 85.123 36.320 108.814 1.00 0.00 H ATOM 15227 H2 WAT 6387 86.306 36.113 107.894 1.00 0.00 H TER 15229 WAT 6387 ATOM 15229 O WAT 6388 125.164 62.028 109.542 1.00 0.00 O ATOM 15230 H1 WAT 6388 124.258 62.189 109.804 1.00 0.00 H ATOM 15231 H2 WAT 6388 125.628 61.872 110.365 1.00 0.00 H TER 15233 WAT 6388 ATOM 15233 O WAT 6389 32.507 80.382 115.601 1.00 0.00 O ATOM 15234 H1 WAT 6389 32.919 81.198 115.316 1.00 0.00 H ATOM 15235 H2 WAT 6389 31.721 80.661 116.069 1.00 0.00 H TER 15237 WAT 6389 ATOM 15237 O WAT 6390 52.230 55.978 70.123 1.00 0.00 O ATOM 15238 H1 WAT 6390 51.934 55.896 71.030 1.00 0.00 H ATOM 15239 H2 WAT 6390 52.684 55.154 69.945 1.00 0.00 H TER 15241 WAT 6390 ATOM 15241 O WAT 6391 48.309 132.113 66.281 1.00 0.00 O ATOM 15242 H1 WAT 6391 47.564 131.783 65.778 1.00 0.00 H ATOM 15243 H2 WAT 6391 48.551 132.928 65.843 1.00 0.00 H TER 15245 WAT 6391 ATOM 15245 O WAT 6392 93.327 129.225 124.435 1.00 0.00 O ATOM 15246 H1 WAT 6392 93.295 128.309 124.159 1.00 0.00 H ATOM 15247 H2 WAT 6392 92.760 129.683 123.814 1.00 0.00 H TER 15249 WAT 6392 ATOM 15249 O WAT 6393 75.692 12.311 11.156 1.00 0.00 O ATOM 15250 H1 WAT 6393 74.910 12.757 11.482 1.00 0.00 H ATOM 15251 H2 WAT 6393 76.114 11.963 11.942 1.00 0.00 H TER 15253 WAT 6393 ATOM 15253 O WAT 6394 80.114 118.733 88.870 1.00 0.00 O ATOM 15254 H1 WAT 6394 80.199 118.449 89.780 1.00 0.00 H ATOM 15255 H2 WAT 6394 81.016 118.808 88.557 1.00 0.00 H TER 15257 WAT 6394 ATOM 15257 O WAT 6395 24.087 38.728 64.935 1.00 0.00 O ATOM 15258 H1 WAT 6395 24.198 37.889 64.488 1.00 0.00 H ATOM 15259 H2 WAT 6395 23.352 39.144 64.485 1.00 0.00 H TER 15261 WAT 6395 ATOM 15261 O WAT 6396 40.108 143.156 96.154 1.00 0.00 O ATOM 15262 H1 WAT 6396 40.247 144.092 96.009 1.00 0.00 H ATOM 15263 H2 WAT 6396 40.988 142.799 96.275 1.00 0.00 H TER 15265 WAT 6396 ATOM 15265 O WAT 6397 66.282 126.228 152.450 1.00 0.00 O ATOM 15266 H1 WAT 6397 65.967 125.347 152.248 1.00 0.00 H ATOM 15267 H2 WAT 6397 66.930 126.098 153.143 1.00 0.00 H TER 15269 WAT 6397 ATOM 15269 O WAT 6398 108.855 31.264 152.397 1.00 0.00 O ATOM 15270 H1 WAT 6398 108.093 31.296 152.975 1.00 0.00 H ATOM 15271 H2 WAT 6398 108.628 31.842 151.668 1.00 0.00 H TER 15273 WAT 6398 ATOM 15273 O WAT 6399 41.812 78.519 92.631 1.00 0.00 O ATOM 15274 H1 WAT 6399 41.789 78.294 93.562 1.00 0.00 H ATOM 15275 H2 WAT 6399 41.002 79.006 92.483 1.00 0.00 H TER 15277 WAT 6399 ATOM 15277 O WAT 6400 53.713 91.357 135.112 1.00 0.00 O ATOM 15278 H1 WAT 6400 53.266 91.705 134.340 1.00 0.00 H ATOM 15279 H2 WAT 6400 54.575 91.771 135.097 1.00 0.00 H TER 15281 WAT 6400 ATOM 15281 O WAT 6401 91.296 145.310 5.622 1.00 0.00 O ATOM 15282 H1 WAT 6401 90.752 146.061 5.858 1.00 0.00 H ATOM 15283 H2 WAT 6401 90.988 144.603 6.189 1.00 0.00 H TER 15285 WAT 6401 ATOM 15285 O WAT 6402 119.373 18.621 129.352 1.00 0.00 O ATOM 15286 H1 WAT 6402 119.521 19.566 129.304 1.00 0.00 H ATOM 15287 H2 WAT 6402 119.499 18.313 128.455 1.00 0.00 H TER 15289 WAT 6402 ATOM 15289 O WAT 6403 72.827 47.552 134.717 1.00 0.00 O ATOM 15290 H1 WAT 6403 72.350 47.659 135.540 1.00 0.00 H ATOM 15291 H2 WAT 6403 73.343 46.755 134.841 1.00 0.00 H TER 15293 WAT 6403 ATOM 15293 O WAT 6404 128.135 69.768 125.914 1.00 0.00 O ATOM 15294 H1 WAT 6404 127.651 68.942 125.915 1.00 0.00 H ATOM 15295 H2 WAT 6404 128.115 70.058 126.826 1.00 0.00 H TER 15297 WAT 6404 ATOM 15297 O WAT 6405 63.348 7.558 123.372 1.00 0.00 O ATOM 15298 H1 WAT 6405 63.688 7.067 122.624 1.00 0.00 H ATOM 15299 H2 WAT 6405 64.097 7.642 123.963 1.00 0.00 H TER 15301 WAT 6405 ATOM 15301 O WAT 6406 23.386 139.726 96.286 1.00 0.00 O ATOM 15302 H1 WAT 6406 23.236 138.796 96.455 1.00 0.00 H ATOM 15303 H2 WAT 6406 23.338 139.806 95.333 1.00 0.00 H TER 15305 WAT 6406 ATOM 15305 O WAT 6407 138.281 51.057 119.047 1.00 0.00 O ATOM 15306 H1 WAT 6407 137.666 50.513 118.554 1.00 0.00 H ATOM 15307 H2 WAT 6407 138.712 51.594 118.382 1.00 0.00 H TER 15309 WAT 6407 ATOM 15309 O WAT 6408 86.268 45.547 98.975 1.00 0.00 O ATOM 15310 H1 WAT 6408 86.698 45.981 98.238 1.00 0.00 H ATOM 15311 H2 WAT 6408 86.098 46.250 99.601 1.00 0.00 H TER 15313 WAT 6408 ATOM 15313 O WAT 6409 25.720 74.520 152.491 1.00 0.00 O ATOM 15314 H1 WAT 6409 25.718 75.154 151.774 1.00 0.00 H ATOM 15315 H2 WAT 6409 24.810 74.234 152.560 1.00 0.00 H TER 15317 WAT 6409 ATOM 15317 O WAT 6410 20.209 92.200 57.036 1.00 0.00 O ATOM 15318 H1 WAT 6410 19.808 92.048 57.892 1.00 0.00 H ATOM 15319 H2 WAT 6410 20.942 92.788 57.216 1.00 0.00 H TER 15321 WAT 6410 ATOM 15321 O WAT 6411 47.330 35.095 123.554 1.00 0.00 O ATOM 15322 H1 WAT 6411 46.400 35.165 123.771 1.00 0.00 H ATOM 15323 H2 WAT 6411 47.641 34.351 124.070 1.00 0.00 H TER 15325 WAT 6411 ATOM 15325 O WAT 6412 49.904 19.533 158.317 1.00 0.00 O ATOM 15326 H1 WAT 6412 50.207 19.801 159.184 1.00 0.00 H ATOM 15327 H2 WAT 6412 49.456 18.700 158.467 1.00 0.00 H TER 15329 WAT 6412 ATOM 15329 O WAT 6413 133.460 87.091 29.779 1.00 0.00 O ATOM 15330 H1 WAT 6413 133.568 86.914 28.844 1.00 0.00 H ATOM 15331 H2 WAT 6413 133.821 86.317 30.212 1.00 0.00 H TER 15333 WAT 6413 ATOM 15333 O WAT 6414 37.270 3.266 118.277 1.00 0.00 O ATOM 15334 H1 WAT 6414 36.923 4.002 117.773 1.00 0.00 H ATOM 15335 H2 WAT 6414 36.840 3.336 119.130 1.00 0.00 H TER 15337 WAT 6414 ATOM 15337 O WAT 6415 20.983 0.324 8.886 1.00 0.00 O ATOM 15338 H1 WAT 6415 20.177 0.775 9.140 1.00 0.00 H ATOM 15339 H2 WAT 6415 21.685 0.881 9.224 1.00 0.00 H TER 15341 WAT 6415 ATOM 15341 O WAT 6416 24.957 70.036 12.798 1.00 0.00 O ATOM 15342 H1 WAT 6416 24.390 69.698 12.105 1.00 0.00 H ATOM 15343 H2 WAT 6416 25.559 69.317 12.988 1.00 0.00 H TER 15345 WAT 6416 ATOM 15345 O WAT 6417 103.141 97.661 101.181 1.00 0.00 O ATOM 15346 H1 WAT 6417 102.539 98.296 100.793 1.00 0.00 H ATOM 15347 H2 WAT 6417 103.505 98.110 101.943 1.00 0.00 H TER 15349 WAT 6417 ATOM 15349 O WAT 6418 14.378 46.589 98.442 1.00 0.00 O ATOM 15350 H1 WAT 6418 13.655 45.965 98.503 1.00 0.00 H ATOM 15351 H2 WAT 6418 14.721 46.472 97.556 1.00 0.00 H TER 15353 WAT 6418 ATOM 15353 O WAT 6419 102.676 72.777 18.573 1.00 0.00 O ATOM 15354 H1 WAT 6419 103.461 73.086 18.121 1.00 0.00 H ATOM 15355 H2 WAT 6419 102.884 72.866 19.503 1.00 0.00 H TER 15357 WAT 6419 ATOM 15357 O WAT 6420 137.761 6.557 150.965 1.00 0.00 O ATOM 15358 H1 WAT 6420 136.814 6.685 150.895 1.00 0.00 H ATOM 15359 H2 WAT 6420 137.856 5.753 151.476 1.00 0.00 H TER 15361 WAT 6420 ATOM 15361 O WAT 6421 106.135 19.122 154.024 1.00 0.00 O ATOM 15362 H1 WAT 6421 105.276 18.765 153.796 1.00 0.00 H ATOM 15363 H2 WAT 6421 106.336 19.733 153.315 1.00 0.00 H TER 15365 WAT 6421 ATOM 15365 O WAT 6422 110.259 38.080 88.417 1.00 0.00 O ATOM 15366 H1 WAT 6422 109.609 38.474 89.000 1.00 0.00 H ATOM 15367 H2 WAT 6422 110.447 38.763 87.773 1.00 0.00 H TER 15369 WAT 6422 ATOM 15369 O WAT 6423 127.222 110.135 78.623 1.00 0.00 O ATOM 15370 H1 WAT 6423 127.409 109.199 78.704 1.00 0.00 H ATOM 15371 H2 WAT 6423 127.966 110.486 78.134 1.00 0.00 H TER 15373 WAT 6423 ATOM 15373 O WAT 6424 91.266 102.165 11.858 1.00 0.00 O ATOM 15374 H1 WAT 6424 91.910 102.164 11.150 1.00 0.00 H ATOM 15375 H2 WAT 6424 91.654 102.720 12.534 1.00 0.00 H TER 15377 WAT 6424 ATOM 15377 O WAT 6425 25.760 64.687 66.063 1.00 0.00 O ATOM 15378 H1 WAT 6425 26.483 65.297 65.918 1.00 0.00 H ATOM 15379 H2 WAT 6425 25.962 63.938 65.504 1.00 0.00 H TER 15381 WAT 6425 ATOM 15381 O WAT 6426 42.616 44.690 92.829 1.00 0.00 O ATOM 15382 H1 WAT 6426 42.781 45.632 92.873 1.00 0.00 H ATOM 15383 H2 WAT 6426 41.851 44.555 93.388 1.00 0.00 H TER 15385 WAT 6426 ATOM 15385 O WAT 6427 103.713 133.262 104.781 1.00 0.00 O ATOM 15386 H1 WAT 6427 102.818 133.601 104.756 1.00 0.00 H ATOM 15387 H2 WAT 6427 104.144 133.777 105.464 1.00 0.00 H TER 15389 WAT 6427 ATOM 15389 O WAT 6428 136.600 134.521 148.803 1.00 0.00 O ATOM 15390 H1 WAT 6428 136.517 135.297 148.249 1.00 0.00 H ATOM 15391 H2 WAT 6428 135.770 134.058 148.693 1.00 0.00 H TER 15393 WAT 6428 ATOM 15393 O WAT 6429 80.896 96.606 140.306 1.00 0.00 O ATOM 15394 H1 WAT 6429 80.827 95.734 140.695 1.00 0.00 H ATOM 15395 H2 WAT 6429 81.722 96.589 139.823 1.00 0.00 H TER 15397 WAT 6429 ATOM 15397 O WAT 6430 84.213 84.973 5.960 1.00 0.00 O ATOM 15398 H1 WAT 6430 84.317 84.775 6.891 1.00 0.00 H ATOM 15399 H2 WAT 6430 83.271 84.901 5.804 1.00 0.00 H TER 15401 WAT 6430 ATOM 15401 O WAT 6431 29.065 33.556 140.635 1.00 0.00 O ATOM 15402 H1 WAT 6431 28.633 33.576 139.781 1.00 0.00 H ATOM 15403 H2 WAT 6431 29.269 32.632 140.778 1.00 0.00 H TER 15405 WAT 6431 ATOM 15405 O WAT 6432 4.265 5.980 131.415 1.00 0.00 O ATOM 15406 H1 WAT 6432 3.708 6.602 131.884 1.00 0.00 H ATOM 15407 H2 WAT 6432 5.147 6.153 131.744 1.00 0.00 H TER 15409 WAT 6432 ATOM 15409 O WAT 6433 85.501 132.759 85.510 1.00 0.00 O ATOM 15410 H1 WAT 6433 85.598 132.875 86.455 1.00 0.00 H ATOM 15411 H2 WAT 6433 84.604 132.445 85.398 1.00 0.00 H TER 15413 WAT 6433 ATOM 15413 O WAT 6434 96.753 71.895 71.859 1.00 0.00 O ATOM 15414 H1 WAT 6434 96.234 71.215 71.428 1.00 0.00 H ATOM 15415 H2 WAT 6434 96.459 71.881 72.769 1.00 0.00 H TER 15417 WAT 6434 ATOM 15417 O WAT 6435 62.890 144.106 6.635 1.00 0.00 O ATOM 15418 H1 WAT 6435 63.634 143.661 7.040 1.00 0.00 H ATOM 15419 H2 WAT 6435 62.173 143.989 7.258 1.00 0.00 H TER 15421 WAT 6435 ATOM 15421 O WAT 6436 64.230 43.915 146.909 1.00 0.00 O ATOM 15422 H1 WAT 6436 64.282 42.960 146.921 1.00 0.00 H ATOM 15423 H2 WAT 6436 64.620 44.166 146.071 1.00 0.00 H TER 15425 WAT 6436 ATOM 15425 O WAT 6437 39.119 23.190 54.208 1.00 0.00 O ATOM 15426 H1 WAT 6437 39.756 22.807 53.605 1.00 0.00 H ATOM 15427 H2 WAT 6437 38.643 22.438 54.562 1.00 0.00 H TER 15429 WAT 6437 ATOM 15429 O WAT 6438 103.633 0.873 90.250 1.00 0.00 O ATOM 15430 H1 WAT 6438 103.907 0.005 89.955 1.00 0.00 H ATOM 15431 H2 WAT 6438 102.677 0.845 90.222 1.00 0.00 H TER 15433 WAT 6438 ATOM 15433 O WAT 6439 132.961 94.364 120.621 1.00 0.00 O ATOM 15434 H1 WAT 6439 132.119 94.108 120.998 1.00 0.00 H ATOM 15435 H2 WAT 6439 133.613 93.979 121.206 1.00 0.00 H TER 15437 WAT 6439 ATOM 15437 O WAT 6440 94.474 28.530 145.369 1.00 0.00 O ATOM 15438 H1 WAT 6440 93.612 28.625 145.773 1.00 0.00 H ATOM 15439 H2 WAT 6440 94.829 29.418 145.349 1.00 0.00 H TER 15441 WAT 6440 ATOM 15441 O WAT 6441 45.316 23.926 103.097 1.00 0.00 O ATOM 15442 H1 WAT 6441 44.823 24.713 103.327 1.00 0.00 H ATOM 15443 H2 WAT 6441 46.152 24.025 103.553 1.00 0.00 H TER 15445 WAT 6441 ATOM 15445 O WAT 6442 82.507 113.762 151.619 1.00 0.00 O ATOM 15446 H1 WAT 6442 83.442 113.811 151.418 1.00 0.00 H ATOM 15447 H2 WAT 6442 82.198 114.665 151.539 1.00 0.00 H TER 15449 WAT 6442 ATOM 15449 O WAT 6443 99.689 35.225 134.442 1.00 0.00 O ATOM 15450 H1 WAT 6443 98.994 34.948 135.039 1.00 0.00 H ATOM 15451 H2 WAT 6443 99.617 36.179 134.417 1.00 0.00 H TER 15453 WAT 6443 ATOM 15453 O WAT 6444 74.258 90.061 5.145 1.00 0.00 O ATOM 15454 H1 WAT 6444 74.255 90.922 5.563 1.00 0.00 H ATOM 15455 H2 WAT 6444 75.139 89.721 5.302 1.00 0.00 H TER 15457 WAT 6444 ATOM 15457 O WAT 6445 19.979 5.139 87.273 1.00 0.00 O ATOM 15458 H1 WAT 6445 19.431 5.602 86.639 1.00 0.00 H ATOM 15459 H2 WAT 6445 19.356 4.701 87.853 1.00 0.00 H TER 15461 WAT 6445 ATOM 15461 O WAT 6446 93.789 141.462 114.206 1.00 0.00 O ATOM 15462 H1 WAT 6446 94.131 141.998 114.922 1.00 0.00 H ATOM 15463 H2 WAT 6446 93.798 140.569 114.549 1.00 0.00 H TER 15465 WAT 6446 ATOM 15465 O WAT 6447 60.773 70.896 2.788 1.00 0.00 O ATOM 15466 H1 WAT 6447 60.607 71.834 2.696 1.00 0.00 H ATOM 15467 H2 WAT 6447 60.746 70.560 1.892 1.00 0.00 H TER 15469 WAT 6447 ATOM 15469 O WAT 6448 104.981 124.516 3.879 1.00 0.00 O ATOM 15470 H1 WAT 6448 104.077 124.783 3.715 1.00 0.00 H ATOM 15471 H2 WAT 6448 105.480 124.905 3.160 1.00 0.00 H TER 15473 WAT 6448 ATOM 15473 O WAT 6449 120.125 48.248 142.204 1.00 0.00 O ATOM 15474 H1 WAT 6449 120.002 48.178 141.257 1.00 0.00 H ATOM 15475 H2 WAT 6449 121.075 48.256 142.322 1.00 0.00 H TER 15477 WAT 6449 ATOM 15477 O WAT 6450 115.415 16.602 113.230 1.00 0.00 O ATOM 15478 H1 WAT 6450 116.000 16.562 113.987 1.00 0.00 H ATOM 15479 H2 WAT 6450 115.304 17.537 113.063 1.00 0.00 H TER 15481 WAT 6450 ATOM 15481 O WAT 6451 90.797 73.865 22.886 1.00 0.00 O ATOM 15482 H1 WAT 6451 91.689 73.804 22.544 1.00 0.00 H ATOM 15483 H2 WAT 6451 90.579 74.795 22.821 1.00 0.00 H TER 15485 WAT 6451 ATOM 15485 O WAT 6452 128.596 32.697 96.944 1.00 0.00 O ATOM 15486 H1 WAT 6452 128.031 32.090 97.422 1.00 0.00 H ATOM 15487 H2 WAT 6452 129.226 33.002 97.597 1.00 0.00 H TER 15489 WAT 6452 ATOM 15489 O WAT 6453 0.492 68.763 155.558 1.00 0.00 O ATOM 15490 H1 WAT 6453 0.928 69.002 156.376 1.00 0.00 H ATOM 15491 H2 WAT 6453 1.194 68.750 154.908 1.00 0.00 H TER 15493 WAT 6453 ATOM 15493 O WAT 6454 117.576 76.362 7.771 1.00 0.00 O ATOM 15494 H1 WAT 6454 117.551 77.309 7.911 1.00 0.00 H ATOM 15495 H2 WAT 6454 118.009 76.257 6.923 1.00 0.00 H TER 15497 WAT 6454 ATOM 15497 O WAT 6455 9.936 29.540 121.968 1.00 0.00 O ATOM 15498 H1 WAT 6455 10.267 29.318 122.838 1.00 0.00 H ATOM 15499 H2 WAT 6455 9.165 28.984 121.856 1.00 0.00 H TER 15501 WAT 6455 ATOM 15501 O WAT 6456 120.120 139.019 105.108 1.00 0.00 O ATOM 15502 H1 WAT 6456 120.661 138.235 105.203 1.00 0.00 H ATOM 15503 H2 WAT 6456 119.617 138.868 104.308 1.00 0.00 H TER 15505 WAT 6456 ATOM 15505 O WAT 6457 137.961 95.485 6.184 1.00 0.00 O ATOM 15506 H1 WAT 6457 138.591 95.512 5.464 1.00 0.00 H ATOM 15507 H2 WAT 6457 138.011 94.588 6.513 1.00 0.00 H TER 15509 WAT 6457 ATOM 15509 O WAT 6458 99.713 90.233 100.651 1.00 0.00 O ATOM 15510 H1 WAT 6458 100.668 90.283 100.694 1.00 0.00 H ATOM 15511 H2 WAT 6458 99.521 90.132 99.718 1.00 0.00 H TER 15513 WAT 6458 ATOM 15513 O WAT 6459 136.439 106.298 80.742 1.00 0.00 O ATOM 15514 H1 WAT 6459 135.910 106.715 80.062 1.00 0.00 H ATOM 15515 H2 WAT 6459 135.846 106.212 81.488 1.00 0.00 H TER 15517 WAT 6459 ATOM 15517 O WAT 6460 9.486 135.302 145.190 1.00 0.00 O ATOM 15518 H1 WAT 6460 8.647 135.255 144.733 1.00 0.00 H ATOM 15519 H2 WAT 6460 9.256 135.529 146.091 1.00 0.00 H TER 15521 WAT 6460 ATOM 15521 O WAT 6461 78.598 7.177 157.960 1.00 0.00 O ATOM 15522 H1 WAT 6461 78.128 6.706 157.271 1.00 0.00 H ATOM 15523 H2 WAT 6461 78.882 7.990 157.543 1.00 0.00 H TER 15525 WAT 6461 ATOM 15525 O WAT 6462 111.129 29.093 62.984 1.00 0.00 O ATOM 15526 H1 WAT 6462 110.983 28.389 63.617 1.00 0.00 H ATOM 15527 H2 WAT 6462 110.249 29.352 62.708 1.00 0.00 H TER 15529 WAT 6462 ATOM 15529 O WAT 6463 143.983 112.589 150.992 1.00 0.00 O ATOM 15530 H1 WAT 6463 143.691 111.678 151.000 1.00 0.00 H ATOM 15531 H2 WAT 6463 143.332 113.054 151.518 1.00 0.00 H TER 15533 WAT 6463 ATOM 15533 O WAT 6464 44.073 64.153 99.844 1.00 0.00 O ATOM 15534 H1 WAT 6464 43.360 64.783 99.743 1.00 0.00 H ATOM 15535 H2 WAT 6464 43.807 63.402 99.314 1.00 0.00 H TER 15537 WAT 6464 ATOM 15537 O WAT 6465 60.189 117.022 118.464 1.00 0.00 O ATOM 15538 H1 WAT 6465 60.335 116.387 119.165 1.00 0.00 H ATOM 15539 H2 WAT 6465 60.473 116.571 117.669 1.00 0.00 H TER 15541 WAT 6465 ATOM 15541 O WAT 6466 129.957 50.746 14.040 1.00 0.00 O ATOM 15542 H1 WAT 6466 129.869 51.279 13.250 1.00 0.00 H ATOM 15543 H2 WAT 6466 130.049 51.381 14.749 1.00 0.00 H TER 15545 WAT 6466 ATOM 15545 O WAT 6467 76.183 56.705 134.147 1.00 0.00 O ATOM 15546 H1 WAT 6467 75.880 57.110 133.335 1.00 0.00 H ATOM 15547 H2 WAT 6467 76.730 55.974 133.861 1.00 0.00 H TER 15549 WAT 6467 ATOM 15549 O WAT 6468 143.864 117.586 105.271 1.00 0.00 O ATOM 15550 H1 WAT 6468 144.422 118.337 105.069 1.00 0.00 H ATOM 15551 H2 WAT 6468 143.718 117.644 106.215 1.00 0.00 H TER 15553 WAT 6468 ATOM 15553 O WAT 6469 137.303 76.277 102.626 1.00 0.00 O ATOM 15554 H1 WAT 6469 136.742 75.656 102.162 1.00 0.00 H ATOM 15555 H2 WAT 6469 136.819 76.486 103.425 1.00 0.00 H TER 15557 WAT 6469 ATOM 15557 O WAT 6470 56.332 89.202 148.290 1.00 0.00 O ATOM 15558 H1 WAT 6470 55.700 88.484 148.254 1.00 0.00 H ATOM 15559 H2 WAT 6470 56.703 89.150 149.171 1.00 0.00 H TER 15561 WAT 6470 ATOM 15561 O WAT 6471 134.887 44.078 106.108 1.00 0.00 O ATOM 15562 H1 WAT 6471 135.006 45.007 106.305 1.00 0.00 H ATOM 15563 H2 WAT 6471 135.614 43.862 105.524 1.00 0.00 H TER 15565 WAT 6471 ATOM 15565 O WAT 6472 95.802 143.780 13.696 1.00 0.00 O ATOM 15566 H1 WAT 6472 94.889 143.748 13.412 1.00 0.00 H ATOM 15567 H2 WAT 6472 95.785 144.300 14.499 1.00 0.00 H TER 15569 WAT 6472 ATOM 15569 O WAT 6473 9.109 117.157 93.656 1.00 0.00 O ATOM 15570 H1 WAT 6473 8.943 116.224 93.791 1.00 0.00 H ATOM 15571 H2 WAT 6473 9.429 117.215 92.755 1.00 0.00 H TER 15573 WAT 6473 ATOM 15573 O WAT 6474 111.149 63.764 67.709 1.00 0.00 O ATOM 15574 H1 WAT 6474 111.466 63.903 68.602 1.00 0.00 H ATOM 15575 H2 WAT 6474 110.870 62.848 67.694 1.00 0.00 H TER 15577 WAT 6474 ATOM 15577 O WAT 6475 53.697 141.372 55.672 1.00 0.00 O ATOM 15578 H1 WAT 6475 54.038 140.503 55.885 1.00 0.00 H ATOM 15579 H2 WAT 6475 53.137 141.229 54.909 1.00 0.00 H TER 15581 WAT 6475 ATOM 15581 O WAT 6476 38.192 83.486 132.048 1.00 0.00 O ATOM 15582 H1 WAT 6476 39.033 83.084 131.832 1.00 0.00 H ATOM 15583 H2 WAT 6476 37.545 82.811 131.844 1.00 0.00 H TER 15585 WAT 6476 ATOM 15585 O WAT 6477 91.049 88.300 101.759 1.00 0.00 O ATOM 15586 H1 WAT 6477 91.428 87.552 102.221 1.00 0.00 H ATOM 15587 H2 WAT 6477 91.558 89.052 102.062 1.00 0.00 H TER 15589 WAT 6477 ATOM 15589 O WAT 6478 27.856 62.503 3.023 1.00 0.00 O ATOM 15590 H1 WAT 6478 28.142 62.822 3.879 1.00 0.00 H ATOM 15591 H2 WAT 6478 28.109 63.195 2.412 1.00 0.00 H TER 15593 WAT 6478 ATOM 15593 O WAT 6479 93.963 76.850 132.745 1.00 0.00 O ATOM 15594 H1 WAT 6479 93.147 76.362 132.634 1.00 0.00 H ATOM 15595 H2 WAT 6479 93.815 77.393 133.519 1.00 0.00 H TER 15597 WAT 6479 ATOM 15597 O WAT 6480 104.175 16.038 10.182 1.00 0.00 O ATOM 15598 H1 WAT 6480 104.973 15.876 10.686 1.00 0.00 H ATOM 15599 H2 WAT 6480 103.600 15.305 10.400 1.00 0.00 H TER 15601 WAT 6480 ATOM 15601 O WAT 6481 44.602 48.530 147.878 1.00 0.00 O ATOM 15602 H1 WAT 6481 45.144 47.749 147.765 1.00 0.00 H ATOM 15603 H2 WAT 6481 43.867 48.401 147.279 1.00 0.00 H TER 15605 WAT 6481 ATOM 15605 O WAT 6482 85.320 109.625 87.223 1.00 0.00 O ATOM 15606 H1 WAT 6482 86.152 110.062 87.402 1.00 0.00 H ATOM 15607 H2 WAT 6482 85.562 108.720 87.026 1.00 0.00 H TER 15609 WAT 6482 ATOM 15609 O WAT 6483 48.336 112.200 107.460 1.00 0.00 O ATOM 15610 H1 WAT 6483 49.062 111.785 107.925 1.00 0.00 H ATOM 15611 H2 WAT 6483 47.626 112.229 108.101 1.00 0.00 H TER 15613 WAT 6483 ATOM 15613 O WAT 6484 20.728 32.989 139.999 1.00 0.00 O ATOM 15614 H1 WAT 6484 20.029 32.335 140.033 1.00 0.00 H ATOM 15615 H2 WAT 6484 21.536 32.475 140.004 1.00 0.00 H TER 15617 WAT 6484 ATOM 15617 O WAT 6485 18.289 85.310 21.619 1.00 0.00 O ATOM 15618 H1 WAT 6485 19.062 84.765 21.471 1.00 0.00 H ATOM 15619 H2 WAT 6485 18.306 85.499 22.558 1.00 0.00 H TER 15621 WAT 6485 ATOM 15621 O WAT 6486 114.864 100.729 153.359 1.00 0.00 O ATOM 15622 H1 WAT 6486 114.391 100.923 154.168 1.00 0.00 H ATOM 15623 H2 WAT 6486 115.701 100.369 153.652 1.00 0.00 H TER 15625 WAT 6486 ATOM 15625 O WAT 6487 6.675 123.984 152.186 1.00 0.00 O ATOM 15626 H1 WAT 6487 6.086 124.542 151.678 1.00 0.00 H ATOM 15627 H2 WAT 6487 7.243 124.598 152.652 1.00 0.00 H TER 15629 WAT 6487 ATOM 15629 O WAT 6488 23.110 62.833 9.464 1.00 0.00 O ATOM 15630 H1 WAT 6488 22.906 61.980 9.849 1.00 0.00 H ATOM 15631 H2 WAT 6488 22.386 63.397 9.736 1.00 0.00 H TER 15633 WAT 6488 ATOM 15633 O WAT 6489 114.683 26.181 101.789 1.00 0.00 O ATOM 15634 H1 WAT 6489 115.379 26.127 102.443 1.00 0.00 H ATOM 15635 H2 WAT 6489 114.957 26.887 101.204 1.00 0.00 H TER 15637 WAT 6489 ATOM 15637 O WAT 6490 11.216 63.163 3.272 1.00 0.00 O ATOM 15638 H1 WAT 6490 10.477 63.497 3.782 1.00 0.00 H ATOM 15639 H2 WAT 6490 11.050 63.470 2.381 1.00 0.00 H TER 15641 WAT 6490 ATOM 15641 O WAT 6491 142.672 54.820 78.042 1.00 0.00 O ATOM 15642 H1 WAT 6491 143.550 54.445 77.975 1.00 0.00 H ATOM 15643 H2 WAT 6491 142.820 55.758 78.160 1.00 0.00 H TER 15645 WAT 6491 ATOM 15645 O WAT 6492 64.613 102.263 86.868 1.00 0.00 O ATOM 15646 H1 WAT 6492 65.096 101.604 87.367 1.00 0.00 H ATOM 15647 H2 WAT 6492 63.730 101.901 86.787 1.00 0.00 H TER 15649 WAT 6492 ATOM 15649 O WAT 6493 83.193 8.530 122.109 1.00 0.00 O ATOM 15650 H1 WAT 6493 84.066 8.605 122.494 1.00 0.00 H ATOM 15651 H2 WAT 6493 82.848 9.423 122.122 1.00 0.00 H TER 15653 WAT 6493 ATOM 15653 O WAT 6494 81.520 66.710 108.926 1.00 0.00 O ATOM 15654 H1 WAT 6494 81.041 67.236 109.567 1.00 0.00 H ATOM 15655 H2 WAT 6494 80.920 66.630 108.185 1.00 0.00 H TER 15657 WAT 6494 ATOM 15657 O WAT 6495 38.143 126.162 141.028 1.00 0.00 O ATOM 15658 H1 WAT 6495 38.257 126.572 140.170 1.00 0.00 H ATOM 15659 H2 WAT 6495 37.898 125.259 140.830 1.00 0.00 H TER 15661 WAT 6495 ATOM 15661 O WAT 6496 23.678 91.144 29.516 1.00 0.00 O ATOM 15662 H1 WAT 6496 24.363 91.413 30.129 1.00 0.00 H ATOM 15663 H2 WAT 6496 23.747 90.190 29.484 1.00 0.00 H TER 15665 WAT 6496 ATOM 15665 O WAT 6497 35.352 70.161 140.231 1.00 0.00 O ATOM 15666 H1 WAT 6497 35.043 70.290 141.128 1.00 0.00 H ATOM 15667 H2 WAT 6497 36.257 70.472 140.242 1.00 0.00 H TER 15669 WAT 6497 ATOM 15669 O WAT 6498 53.015 143.646 71.719 1.00 0.00 O ATOM 15670 H1 WAT 6498 53.142 143.302 70.835 1.00 0.00 H ATOM 15671 H2 WAT 6498 52.325 143.097 72.092 1.00 0.00 H TER 15673 WAT 6498 ATOM 15673 O WAT 6499 7.444 51.094 82.902 1.00 0.00 O ATOM 15674 H1 WAT 6499 7.293 50.149 82.875 1.00 0.00 H ATOM 15675 H2 WAT 6499 7.018 51.428 82.113 1.00 0.00 H TER 15677 WAT 6499 ATOM 15677 O WAT 6500 131.893 108.444 127.896 1.00 0.00 O ATOM 15678 H1 WAT 6500 132.435 109.232 127.867 1.00 0.00 H ATOM 15679 H2 WAT 6500 130.994 108.769 127.850 1.00 0.00 H TER 15681 WAT 6500 ATOM 15681 O WAT 6501 46.748 20.669 64.746 1.00 0.00 O ATOM 15682 H1 WAT 6501 47.541 20.164 64.926 1.00 0.00 H ATOM 15683 H2 WAT 6501 46.850 20.961 63.840 1.00 0.00 H TER 15685 WAT 6501 ATOM 15685 O WAT 6502 35.527 66.778 12.061 1.00 0.00 O ATOM 15686 H1 WAT 6502 36.208 66.105 12.074 1.00 0.00 H ATOM 15687 H2 WAT 6502 34.906 66.502 12.735 1.00 0.00 H TER 15689 WAT 6502 ATOM 15689 O WAT 6503 16.391 41.746 124.895 1.00 0.00 O ATOM 15690 H1 WAT 6503 17.078 42.372 125.125 1.00 0.00 H ATOM 15691 H2 WAT 6503 15.722 41.867 125.568 1.00 0.00 H TER 15693 WAT 6503 ATOM 15693 O WAT 6504 115.489 40.964 157.974 1.00 0.00 O ATOM 15694 H1 WAT 6504 114.980 40.154 157.994 1.00 0.00 H ATOM 15695 H2 WAT 6504 116.253 40.753 157.437 1.00 0.00 H TER 15697 WAT 6504 ATOM 15697 O WAT 6505 93.749 119.864 69.801 1.00 0.00 O ATOM 15698 H1 WAT 6505 94.526 119.565 69.328 1.00 0.00 H ATOM 15699 H2 WAT 6505 94.047 119.978 70.703 1.00 0.00 H TER 15701 WAT 6505 ATOM 15701 O WAT 6506 43.796 4.457 151.137 1.00 0.00 O ATOM 15702 H1 WAT 6506 44.276 5.286 151.139 1.00 0.00 H ATOM 15703 H2 WAT 6506 44.271 3.906 150.515 1.00 0.00 H TER 15705 WAT 6506 ATOM 15705 O WAT 6507 17.513 65.640 151.117 1.00 0.00 O ATOM 15706 H1 WAT 6507 16.664 65.267 151.357 1.00 0.00 H ATOM 15707 H2 WAT 6507 17.474 65.733 150.166 1.00 0.00 H TER 15709 WAT 6507 ATOM 15709 O WAT 6508 52.077 22.828 63.837 1.00 0.00 O ATOM 15710 H1 WAT 6508 51.143 22.690 63.678 1.00 0.00 H ATOM 15711 H2 WAT 6508 52.202 22.581 64.754 1.00 0.00 H TER 15713 WAT 6508 ATOM 15713 O WAT 6509 115.812 111.371 2.810 1.00 0.00 O ATOM 15714 H1 WAT 6509 116.416 111.147 2.102 1.00 0.00 H ATOM 15715 H2 WAT 6509 116.087 112.243 3.092 1.00 0.00 H TER 15717 WAT 6509 ATOM 15717 O WAT 6510 77.517 25.058 123.047 1.00 0.00 O ATOM 15718 H1 WAT 6510 76.785 24.449 122.952 1.00 0.00 H ATOM 15719 H2 WAT 6510 77.607 25.180 123.992 1.00 0.00 H TER 15721 WAT 6510 ATOM 15721 O WAT 6511 104.982 40.166 3.585 1.00 0.00 O ATOM 15722 H1 WAT 6511 105.387 40.938 3.980 1.00 0.00 H ATOM 15723 H2 WAT 6511 105.525 39.434 3.878 1.00 0.00 H TER 15725 WAT 6511 ATOM 15725 O WAT 6512 28.410 50.732 4.788 1.00 0.00 O ATOM 15726 H1 WAT 6512 27.549 51.138 4.686 1.00 0.00 H ATOM 15727 H2 WAT 6512 28.596 50.347 3.931 1.00 0.00 H TER 15729 WAT 6512 ATOM 15729 O WAT 6513 118.053 126.213 126.503 1.00 0.00 O ATOM 15730 H1 WAT 6513 117.843 126.810 127.221 1.00 0.00 H ATOM 15731 H2 WAT 6513 119.008 126.149 126.517 1.00 0.00 H TER 15733 WAT 6513 ATOM 15733 O WAT 6514 107.549 109.893 81.836 1.00 0.00 O ATOM 15734 H1 WAT 6514 107.505 110.651 82.419 1.00 0.00 H ATOM 15735 H2 WAT 6514 107.752 109.157 82.413 1.00 0.00 H TER 15737 WAT 6514 ATOM 15737 O WAT 6515 140.971 127.999 95.646 1.00 0.00 O ATOM 15738 H1 WAT 6515 141.154 127.645 96.516 1.00 0.00 H ATOM 15739 H2 WAT 6515 140.955 128.948 95.771 1.00 0.00 H TER 15741 WAT 6515 ATOM 15741 O WAT 6516 64.675 97.267 78.275 1.00 0.00 O ATOM 15742 H1 WAT 6516 65.195 96.494 78.055 1.00 0.00 H ATOM 15743 H2 WAT 6516 65.229 98.007 78.027 1.00 0.00 H TER 15745 WAT 6516 ATOM 15745 O WAT 6517 53.815 108.978 145.785 1.00 0.00 O ATOM 15746 H1 WAT 6517 54.185 109.504 145.076 1.00 0.00 H ATOM 15747 H2 WAT 6517 53.967 108.072 145.515 1.00 0.00 H TER 15749 WAT 6517 ATOM 15749 O WAT 6518 80.867 114.868 14.538 1.00 0.00 O ATOM 15750 H1 WAT 6518 80.256 115.489 14.142 1.00 0.00 H ATOM 15751 H2 WAT 6518 80.422 114.564 15.328 1.00 0.00 H TER 15753 WAT 6518 ATOM 15753 O WAT 6519 138.192 113.837 0.873 1.00 0.00 O ATOM 15754 H1 WAT 6519 137.778 113.588 1.699 1.00 0.00 H ATOM 15755 H2 WAT 6519 137.489 113.777 0.225 1.00 0.00 H TER 15757 WAT 6519 ATOM 15757 O WAT 6520 85.351 76.992 147.413 1.00 0.00 O ATOM 15758 H1 WAT 6520 85.859 77.254 146.645 1.00 0.00 H ATOM 15759 H2 WAT 6520 85.093 77.818 147.822 1.00 0.00 H TER 15761 WAT 6520 ATOM 15761 O WAT 6521 98.022 30.649 60.169 1.00 0.00 O ATOM 15762 H1 WAT 6521 97.223 30.757 60.686 1.00 0.00 H ATOM 15763 H2 WAT 6521 97.907 31.239 59.424 1.00 0.00 H TER 15765 WAT 6521 ATOM 15765 O WAT 6522 137.351 74.305 0.736 1.00 0.00 O ATOM 15766 H1 WAT 6522 137.347 74.149 -0.208 1.00 0.00 H ATOM 15767 H2 WAT 6522 136.743 73.655 1.089 1.00 0.00 H TER 15769 WAT 6522 ATOM 15769 O WAT 6523 59.930 34.722 116.943 1.00 0.00 O ATOM 15770 H1 WAT 6523 60.358 33.936 117.283 1.00 0.00 H ATOM 15771 H2 WAT 6523 60.440 35.448 117.304 1.00 0.00 H TER 15773 WAT 6523 ATOM 15773 O WAT 6524 70.499 66.414 83.190 1.00 0.00 O ATOM 15774 H1 WAT 6524 71.274 66.802 82.783 1.00 0.00 H ATOM 15775 H2 WAT 6524 70.836 65.969 83.968 1.00 0.00 H TER 15777 WAT 6524 ATOM 15777 O WAT 6525 48.287 9.866 131.116 1.00 0.00 O ATOM 15778 H1 WAT 6525 47.522 9.600 130.605 1.00 0.00 H ATOM 15779 H2 WAT 6525 48.078 9.606 132.013 1.00 0.00 H TER 15781 WAT 6525 ATOM 15781 O WAT 6526 66.948 134.677 118.002 1.00 0.00 O ATOM 15782 H1 WAT 6526 67.650 134.116 118.333 1.00 0.00 H ATOM 15783 H2 WAT 6526 66.232 134.558 118.627 1.00 0.00 H TER 15785 WAT 6526 ATOM 15785 O WAT 6527 144.355 93.714 133.204 1.00 0.00 O ATOM 15786 H1 WAT 6527 144.193 93.840 134.139 1.00 0.00 H ATOM 15787 H2 WAT 6527 144.232 92.775 133.064 1.00 0.00 H TER 15789 WAT 6527 ATOM 15789 O WAT 6528 59.237 65.804 101.478 1.00 0.00 O ATOM 15790 H1 WAT 6528 59.561 64.979 101.839 1.00 0.00 H ATOM 15791 H2 WAT 6528 58.395 65.942 101.913 1.00 0.00 H TER 15793 WAT 6528 ATOM 15793 O WAT 6529 51.790 44.443 98.155 1.00 0.00 O ATOM 15794 H1 WAT 6529 50.982 44.113 97.762 1.00 0.00 H ATOM 15795 H2 WAT 6529 51.604 45.361 98.350 1.00 0.00 H TER 15797 WAT 6529 ATOM 15797 O WAT 6530 30.189 47.009 83.072 1.00 0.00 O ATOM 15798 H1 WAT 6530 30.233 47.428 82.212 1.00 0.00 H ATOM 15799 H2 WAT 6530 31.048 47.171 83.461 1.00 0.00 H TER 15801 WAT 6530 ATOM 15801 O WAT 6531 113.070 31.255 25.138 1.00 0.00 O ATOM 15802 H1 WAT 6531 113.317 31.501 26.030 1.00 0.00 H ATOM 15803 H2 WAT 6531 113.399 30.361 25.037 1.00 0.00 H TER 15805 WAT 6531 ATOM 15805 O WAT 6532 61.454 1.175 61.971 1.00 0.00 O ATOM 15806 H1 WAT 6532 61.154 1.491 62.824 1.00 0.00 H ATOM 15807 H2 WAT 6532 62.262 1.661 61.806 1.00 0.00 H TER 15809 WAT 6532 ATOM 15809 O WAT 6533 64.104 116.803 61.000 1.00 0.00 O ATOM 15810 H1 WAT 6533 64.732 117.425 60.633 1.00 0.00 H ATOM 15811 H2 WAT 6533 63.248 117.198 60.831 1.00 0.00 H TER 15813 WAT 6533 ATOM 15813 O WAT 6534 64.407 130.016 57.843 1.00 0.00 O ATOM 15814 H1 WAT 6534 63.548 130.368 57.610 1.00 0.00 H ATOM 15815 H2 WAT 6534 64.536 130.281 58.753 1.00 0.00 H TER 15817 WAT 6534 ATOM 15817 O WAT 6535 96.167 2.416 90.931 1.00 0.00 O ATOM 15818 H1 WAT 6535 96.245 3.182 90.363 1.00 0.00 H ATOM 15819 H2 WAT 6535 96.824 1.804 90.600 1.00 0.00 H TER 15821 WAT 6535 ATOM 15821 O WAT 6536 105.192 22.897 87.135 1.00 0.00 O ATOM 15822 H1 WAT 6536 105.207 22.348 87.919 1.00 0.00 H ATOM 15823 H2 WAT 6536 104.446 23.482 87.266 1.00 0.00 H TER 15825 WAT 6536 ATOM 15825 O WAT 6537 96.257 5.653 66.470 1.00 0.00 O ATOM 15826 H1 WAT 6537 96.275 4.823 65.993 1.00 0.00 H ATOM 15827 H2 WAT 6537 95.732 6.234 65.920 1.00 0.00 H TER 15829 WAT 6537 ATOM 15829 O WAT 6538 118.276 6.115 26.898 1.00 0.00 O ATOM 15830 H1 WAT 6538 118.622 5.385 26.383 1.00 0.00 H ATOM 15831 H2 WAT 6538 117.439 5.795 27.234 1.00 0.00 H TER 15833 WAT 6538 ATOM 15833 O WAT 6539 49.310 91.528 99.814 1.00 0.00 O ATOM 15834 H1 WAT 6539 49.580 90.956 99.095 1.00 0.00 H ATOM 15835 H2 WAT 6539 48.938 90.933 100.465 1.00 0.00 H TER 15837 WAT 6539 ATOM 15837 O WAT 6540 128.957 123.952 139.304 1.00 0.00 O ATOM 15838 H1 WAT 6540 129.368 124.816 139.329 1.00 0.00 H ATOM 15839 H2 WAT 6540 128.026 124.134 139.170 1.00 0.00 H TER 15841 WAT 6540 ATOM 15841 O WAT 6541 77.042 30.100 124.581 1.00 0.00 O ATOM 15842 H1 WAT 6541 76.451 29.903 125.308 1.00 0.00 H ATOM 15843 H2 WAT 6541 77.285 29.243 124.232 1.00 0.00 H TER 15845 WAT 6541 ATOM 15845 O WAT 6542 67.839 40.603 119.270 1.00 0.00 O ATOM 15846 H1 WAT 6542 67.962 41.181 120.024 1.00 0.00 H ATOM 15847 H2 WAT 6542 68.393 40.980 118.587 1.00 0.00 H TER 15849 WAT 6542 ATOM 15849 O WAT 6543 24.352 34.512 153.765 1.00 0.00 O ATOM 15850 H1 WAT 6543 23.878 34.266 152.971 1.00 0.00 H ATOM 15851 H2 WAT 6543 23.967 33.968 154.452 1.00 0.00 H TER 15853 WAT 6543 ATOM 15853 O WAT 6544 6.149 21.999 15.271 1.00 0.00 O ATOM 15854 H1 WAT 6544 6.527 22.875 15.343 1.00 0.00 H ATOM 15855 H2 WAT 6544 5.785 21.822 16.138 1.00 0.00 H TER 15857 WAT 6544 ATOM 15857 O WAT 6545 114.131 77.179 130.971 1.00 0.00 O ATOM 15858 H1 WAT 6545 113.184 77.064 130.894 1.00 0.00 H ATOM 15859 H2 WAT 6545 114.401 77.525 130.120 1.00 0.00 H TER 15861 WAT 6545 ATOM 15861 O WAT 6546 142.649 119.069 112.392 1.00 0.00 O ATOM 15862 H1 WAT 6546 142.922 118.269 112.841 1.00 0.00 H ATOM 15863 H2 WAT 6546 143.067 119.016 111.533 1.00 0.00 H TER 15865 WAT 6546 ATOM 15865 O WAT 6547 50.375 116.565 110.253 1.00 0.00 O ATOM 15866 H1 WAT 6547 50.810 117.257 109.754 1.00 0.00 H ATOM 15867 H2 WAT 6547 50.784 116.600 111.118 1.00 0.00 H TER 15869 WAT 6547 ATOM 15869 O WAT 6548 79.630 70.936 93.242 1.00 0.00 O ATOM 15870 H1 WAT 6548 78.908 71.539 93.069 1.00 0.00 H ATOM 15871 H2 WAT 6548 79.930 70.666 92.373 1.00 0.00 H TER 15873 WAT 6548 ATOM 15873 O WAT 6549 116.545 106.083 86.531 1.00 0.00 O ATOM 15874 H1 WAT 6549 116.072 106.745 87.036 1.00 0.00 H ATOM 15875 H2 WAT 6549 116.642 105.346 87.133 1.00 0.00 H TER 15877 WAT 6549 ATOM 15877 O WAT 6550 38.532 44.952 77.265 1.00 0.00 O ATOM 15878 H1 WAT 6550 38.698 44.150 77.760 1.00 0.00 H ATOM 15879 H2 WAT 6550 38.046 45.511 77.871 1.00 0.00 H TER 15881 WAT 6550 ATOM 15881 O WAT 6551 40.923 90.149 113.691 1.00 0.00 O ATOM 15882 H1 WAT 6551 41.454 90.842 113.298 1.00 0.00 H ATOM 15883 H2 WAT 6551 41.474 89.793 114.388 1.00 0.00 H TER 15885 WAT 6551 ATOM 15885 O WAT 6552 132.336 65.136 101.755 1.00 0.00 O ATOM 15886 H1 WAT 6552 133.236 65.432 101.894 1.00 0.00 H ATOM 15887 H2 WAT 6552 132.191 64.483 102.439 1.00 0.00 H TER 15889 WAT 6552 ATOM 15889 O WAT 6553 128.178 124.127 125.278 1.00 0.00 O ATOM 15890 H1 WAT 6553 129.063 124.288 125.605 1.00 0.00 H ATOM 15891 H2 WAT 6553 128.271 124.130 124.325 1.00 0.00 H TER 15893 WAT 6553 ATOM 15893 O WAT 6554 109.279 13.194 156.389 1.00 0.00 O ATOM 15894 H1 WAT 6554 108.346 13.039 156.241 1.00 0.00 H ATOM 15895 H2 WAT 6554 109.310 13.999 156.905 1.00 0.00 H TER 15897 WAT 6554 ATOM 15897 O WAT 6555 13.573 72.866 86.717 1.00 0.00 O ATOM 15898 H1 WAT 6555 13.028 72.920 87.503 1.00 0.00 H ATOM 15899 H2 WAT 6555 13.033 73.248 86.025 1.00 0.00 H TER 15901 WAT 6555 ATOM 15901 O WAT 6556 61.084 27.168 82.065 1.00 0.00 O ATOM 15902 H1 WAT 6556 61.990 26.907 82.233 1.00 0.00 H ATOM 15903 H2 WAT 6556 60.991 27.109 81.114 1.00 0.00 H TER 15905 WAT 6556 ATOM 15905 O WAT 6557 48.203 63.493 125.851 1.00 0.00 O ATOM 15906 H1 WAT 6557 48.365 62.550 125.879 1.00 0.00 H ATOM 15907 H2 WAT 6557 47.809 63.694 126.700 1.00 0.00 H TER 15909 WAT 6557 ATOM 15909 O WAT 6558 31.294 99.149 68.651 1.00 0.00 O ATOM 15910 H1 WAT 6558 30.753 99.762 69.150 1.00 0.00 H ATOM 15911 H2 WAT 6558 32.193 99.432 68.819 1.00 0.00 H TER 15913 WAT 6558 ATOM 15913 O WAT 6559 99.345 108.667 70.683 1.00 0.00 O ATOM 15914 H1 WAT 6559 98.414 108.744 70.474 1.00 0.00 H ATOM 15915 H2 WAT 6559 99.558 107.754 70.491 1.00 0.00 H TER 15917 WAT 6559 ATOM 15917 O WAT 6560 17.684 50.310 120.200 1.00 0.00 O ATOM 15918 H1 WAT 6560 18.083 50.972 120.766 1.00 0.00 H ATOM 15919 H2 WAT 6560 17.019 50.788 119.705 1.00 0.00 H TER 15921 WAT 6560 ATOM 15921 O WAT 6561 92.033 29.828 98.827 1.00 0.00 O ATOM 15922 H1 WAT 6561 92.884 29.674 98.418 1.00 0.00 H ATOM 15923 H2 WAT 6561 92.195 30.527 99.461 1.00 0.00 H TER 15925 WAT 6561 ATOM 15925 O WAT 6562 106.129 97.392 108.784 1.00 0.00 O ATOM 15926 H1 WAT 6562 106.445 98.171 108.326 1.00 0.00 H ATOM 15927 H2 WAT 6562 105.282 97.204 108.380 1.00 0.00 H TER 15929 WAT 6562 ATOM 15929 O WAT 6563 60.780 103.678 115.887 1.00 0.00 O ATOM 15930 H1 WAT 6563 61.565 103.926 116.376 1.00 0.00 H ATOM 15931 H2 WAT 6563 60.734 104.311 115.171 1.00 0.00 H TER 15933 WAT 6563 ATOM 15933 O WAT 6564 113.161 9.772 12.730 1.00 0.00 O ATOM 15934 H1 WAT 6564 112.417 10.179 13.174 1.00 0.00 H ATOM 15935 H2 WAT 6564 113.019 8.832 12.837 1.00 0.00 H TER 15937 WAT 6564 ATOM 15937 O WAT 6565 32.073 129.721 63.083 1.00 0.00 O ATOM 15938 H1 WAT 6565 32.068 130.651 62.855 1.00 0.00 H ATOM 15939 H2 WAT 6565 31.929 129.270 62.251 1.00 0.00 H TER 15941 WAT 6565 ATOM 15941 O WAT 6566 55.698 16.100 74.757 1.00 0.00 O ATOM 15942 H1 WAT 6566 55.131 15.599 75.343 1.00 0.00 H ATOM 15943 H2 WAT 6566 55.829 15.528 74.002 1.00 0.00 H TER 15945 WAT 6566 ATOM 15945 O WAT 6567 143.126 120.785 135.891 1.00 0.00 O ATOM 15946 H1 WAT 6567 142.428 121.021 135.280 1.00 0.00 H ATOM 15947 H2 WAT 6567 143.933 121.020 135.434 1.00 0.00 H TER 15949 WAT 6567 ATOM 15949 O WAT 6568 33.589 26.753 139.916 1.00 0.00 O ATOM 15950 H1 WAT 6568 33.097 27.504 139.585 1.00 0.00 H ATOM 15951 H2 WAT 6568 33.406 26.742 140.856 1.00 0.00 H TER 15953 WAT 6568 ATOM 15953 O WAT 6569 141.747 96.954 138.731 1.00 0.00 O ATOM 15954 H1 WAT 6569 141.742 96.588 137.846 1.00 0.00 H ATOM 15955 H2 WAT 6569 140.881 96.745 139.081 1.00 0.00 H TER 15957 WAT 6569 ATOM 15957 O WAT 6570 128.120 10.664 99.546 1.00 0.00 O ATOM 15958 H1 WAT 6570 127.557 9.952 99.851 1.00 0.00 H ATOM 15959 H2 WAT 6570 127.516 11.383 99.360 1.00 0.00 H TER 15961 WAT 6570 ATOM 15961 O WAT 6571 54.037 48.153 63.758 1.00 0.00 O ATOM 15962 H1 WAT 6571 53.324 47.556 63.529 1.00 0.00 H ATOM 15963 H2 WAT 6571 53.675 48.704 64.451 1.00 0.00 H TER 15965 WAT 6571 ATOM 15965 O WAT 6572 128.824 14.846 64.205 1.00 0.00 O ATOM 15966 H1 WAT 6572 128.871 14.115 63.589 1.00 0.00 H ATOM 15967 H2 WAT 6572 129.400 15.512 63.829 1.00 0.00 H TER 15969 WAT 6572 ATOM 15969 O WAT 6573 6.789 40.799 119.869 1.00 0.00 O ATOM 15970 H1 WAT 6573 6.677 40.011 120.400 1.00 0.00 H ATOM 15971 H2 WAT 6573 5.902 41.034 119.598 1.00 0.00 H TER 15973 WAT 6573 ATOM 15973 O WAT 6574 124.877 77.940 135.356 1.00 0.00 O ATOM 15974 H1 WAT 6574 125.040 78.806 135.730 1.00 0.00 H ATOM 15975 H2 WAT 6574 123.954 77.768 135.542 1.00 0.00 H TER 15977 WAT 6574 ATOM 15977 O WAT 6575 77.070 134.663 13.547 1.00 0.00 O ATOM 15978 H1 WAT 6575 76.484 133.927 13.725 1.00 0.00 H ATOM 15979 H2 WAT 6575 77.813 134.525 14.134 1.00 0.00 H TER 15981 WAT 6575 ATOM 15981 O WAT 6576 6.792 101.340 5.382 1.00 0.00 O ATOM 15982 H1 WAT 6576 7.611 100.849 5.452 1.00 0.00 H ATOM 15983 H2 WAT 6576 6.841 101.988 6.085 1.00 0.00 H TER 15985 WAT 6576 ATOM 15985 O WAT 6577 48.892 30.618 69.714 1.00 0.00 O ATOM 15986 H1 WAT 6577 48.502 30.170 68.964 1.00 0.00 H ATOM 15987 H2 WAT 6577 49.125 29.914 70.320 1.00 0.00 H TER 15989 WAT 6577 ATOM 15989 O WAT 6578 30.454 99.670 158.244 1.00 0.00 O ATOM 15990 H1 WAT 6578 30.287 100.575 158.508 1.00 0.00 H ATOM 15991 H2 WAT 6578 31.265 99.435 158.695 1.00 0.00 H TER 15993 WAT 6578 ATOM 15993 O WAT 6579 127.070 106.422 95.209 1.00 0.00 O ATOM 15994 H1 WAT 6579 127.993 106.437 95.462 1.00 0.00 H ATOM 15995 H2 WAT 6579 126.893 105.505 95.001 1.00 0.00 H TER 15997 WAT 6579 ATOM 15997 O WAT 6580 120.286 99.435 108.905 1.00 0.00 O ATOM 15998 H1 WAT 6580 119.496 99.377 109.442 1.00 0.00 H ATOM 15999 H2 WAT 6580 120.486 100.371 108.872 1.00 0.00 H TER 16001 WAT 6580 ATOM 16001 O WAT 6581 40.669 10.871 130.780 1.00 0.00 O ATOM 16002 H1 WAT 6581 40.474 11.189 129.898 1.00 0.00 H ATOM 16003 H2 WAT 6581 39.968 10.248 130.971 1.00 0.00 H TER 16005 WAT 6581 ATOM 16005 O WAT 6582 15.011 4.994 18.495 1.00 0.00 O ATOM 16006 H1 WAT 6582 14.616 5.494 19.209 1.00 0.00 H ATOM 16007 H2 WAT 6582 14.691 5.418 17.699 1.00 0.00 H TER 16009 WAT 6582 ATOM 16009 O WAT 6583 28.120 127.768 122.558 1.00 0.00 O ATOM 16010 H1 WAT 6583 28.374 126.958 122.999 1.00 0.00 H ATOM 16011 H2 WAT 6583 28.474 127.681 121.673 1.00 0.00 H TER 16013 WAT 6583 ATOM 16013 O WAT 6584 79.717 57.725 149.588 1.00 0.00 O ATOM 16014 H1 WAT 6584 80.577 58.146 149.605 1.00 0.00 H ATOM 16015 H2 WAT 6584 79.138 58.379 149.198 1.00 0.00 H TER 16017 WAT 6584 ATOM 16017 O WAT 6585 103.666 96.941 17.834 1.00 0.00 O ATOM 16018 H1 WAT 6585 103.863 96.839 18.765 1.00 0.00 H ATOM 16019 H2 WAT 6585 102.858 96.444 17.705 1.00 0.00 H TER 16021 WAT 6585 ATOM 16021 O WAT 6586 7.434 100.668 2.022 1.00 0.00 O ATOM 16022 H1 WAT 6586 7.174 101.498 2.422 1.00 0.00 H ATOM 16023 H2 WAT 6586 8.391 100.689 2.026 1.00 0.00 H TER 16025 WAT 6586 ATOM 16025 O WAT 6587 63.705 127.683 126.657 1.00 0.00 O ATOM 16026 H1 WAT 6587 64.493 128.159 126.918 1.00 0.00 H ATOM 16027 H2 WAT 6587 63.095 127.811 127.383 1.00 0.00 H TER 16029 WAT 6587 ATOM 16029 O WAT 6588 20.041 87.107 100.871 1.00 0.00 O ATOM 16030 H1 WAT 6588 20.195 87.936 101.324 1.00 0.00 H ATOM 16031 H2 WAT 6588 20.915 86.736 100.745 1.00 0.00 H TER 16033 WAT 6588 ATOM 16033 O WAT 6589 133.320 9.088 158.402 1.00 0.00 O ATOM 16034 H1 WAT 6589 133.109 9.173 159.332 1.00 0.00 H ATOM 16035 H2 WAT 6589 134.220 9.407 158.330 1.00 0.00 H TER 16037 WAT 6589 ATOM 16037 O WAT 6590 117.881 82.870 135.485 1.00 0.00 O ATOM 16038 H1 WAT 6590 118.522 83.292 134.912 1.00 0.00 H ATOM 16039 H2 WAT 6590 118.092 81.938 135.435 1.00 0.00 H TER 16041 WAT 6590 ATOM 16041 O WAT 6591 22.325 126.810 53.291 1.00 0.00 O ATOM 16042 H1 WAT 6591 22.059 127.376 54.016 1.00 0.00 H ATOM 16043 H2 WAT 6591 21.502 126.469 52.940 1.00 0.00 H TER 16045 WAT 6591 ATOM 16045 O WAT 6592 60.307 135.158 129.288 1.00 0.00 O ATOM 16046 H1 WAT 6592 61.182 135.291 128.923 1.00 0.00 H ATOM 16047 H2 WAT 6592 60.400 135.374 130.216 1.00 0.00 H TER 16049 WAT 6592 ATOM 16049 O WAT 6593 104.775 29.210 93.929 1.00 0.00 O ATOM 16050 H1 WAT 6593 103.916 28.795 93.861 1.00 0.00 H ATOM 16051 H2 WAT 6593 105.164 28.829 94.717 1.00 0.00 H TER 16053 WAT 6593 ATOM 16053 O WAT 6594 105.580 83.194 130.576 1.00 0.00 O ATOM 16054 H1 WAT 6594 105.423 83.441 131.488 1.00 0.00 H ATOM 16055 H2 WAT 6594 106.277 82.539 130.622 1.00 0.00 H TER 16057 WAT 6594 ATOM 16057 O WAT 6595 82.705 66.925 149.290 1.00 0.00 O ATOM 16058 H1 WAT 6595 83.102 67.759 149.043 1.00 0.00 H ATOM 16059 H2 WAT 6595 81.793 67.000 149.008 1.00 0.00 H TER 16061 WAT 6595 ATOM 16061 O WAT 6596 100.172 67.523 100.108 1.00 0.00 O ATOM 16062 H1 WAT 6596 99.215 67.530 100.102 1.00 0.00 H ATOM 16063 H2 WAT 6596 100.421 68.087 99.376 1.00 0.00 H TER 16065 WAT 6596 ATOM 16065 O WAT 6597 87.812 141.668 67.446 1.00 0.00 O ATOM 16066 H1 WAT 6597 87.103 141.034 67.551 1.00 0.00 H ATOM 16067 H2 WAT 6597 87.550 142.199 66.694 1.00 0.00 H TER 16069 WAT 6597 ATOM 16069 O WAT 6598 120.946 120.771 98.253 1.00 0.00 O ATOM 16070 H1 WAT 6598 121.665 120.148 98.353 1.00 0.00 H ATOM 16071 H2 WAT 6598 120.281 120.471 98.872 1.00 0.00 H TER 16073 WAT 6598 ATOM 16073 O WAT 6599 7.728 17.055 129.284 1.00 0.00 O ATOM 16074 H1 WAT 6599 7.639 17.151 128.336 1.00 0.00 H ATOM 16075 H2 WAT 6599 8.563 16.602 129.402 1.00 0.00 H TER 16077 WAT 6599 ATOM 16077 O WAT 6600 11.500 51.642 14.621 1.00 0.00 O ATOM 16078 H1 WAT 6600 10.878 51.937 15.286 1.00 0.00 H ATOM 16079 H2 WAT 6600 11.443 50.687 14.646 1.00 0.00 H TER 16081 WAT 6600 ATOM 16081 O WAT 6601 89.275 92.593 9.675 1.00 0.00 O ATOM 16082 H1 WAT 6601 88.850 93.150 10.328 1.00 0.00 H ATOM 16083 H2 WAT 6601 88.840 91.745 9.765 1.00 0.00 H TER 16085 WAT 6601 ATOM 16085 O WAT 6602 99.290 67.817 90.263 1.00 0.00 O ATOM 16086 H1 WAT 6602 99.876 67.215 90.722 1.00 0.00 H ATOM 16087 H2 WAT 6602 99.795 68.113 89.506 1.00 0.00 H TER 16089 WAT 6602 ATOM 16089 O WAT 6603 42.998 96.119 82.422 1.00 0.00 O ATOM 16090 H1 WAT 6603 43.476 95.846 83.205 1.00 0.00 H ATOM 16091 H2 WAT 6603 43.677 96.440 81.828 1.00 0.00 H TER 16093 WAT 6603 ATOM 16093 O WAT 6604 67.032 30.158 92.596 1.00 0.00 O ATOM 16094 H1 WAT 6604 67.836 30.676 92.549 1.00 0.00 H ATOM 16095 H2 WAT 6604 66.344 30.756 92.306 1.00 0.00 H TER 16097 WAT 6604 ATOM 16097 O WAT 6605 17.324 98.802 105.399 1.00 0.00 O ATOM 16098 H1 WAT 6605 16.378 98.939 105.442 1.00 0.00 H ATOM 16099 H2 WAT 6605 17.657 99.168 106.219 1.00 0.00 H TER 16101 WAT 6605 ATOM 16101 O WAT 6606 69.936 72.131 72.761 1.00 0.00 O ATOM 16102 H1 WAT 6606 70.431 71.795 73.509 1.00 0.00 H ATOM 16103 H2 WAT 6606 70.512 71.989 72.010 1.00 0.00 H TER 16105 WAT 6606 ATOM 16105 O WAT 6607 121.345 19.420 78.475 1.00 0.00 O ATOM 16106 H1 WAT 6607 121.381 18.508 78.185 1.00 0.00 H ATOM 16107 H2 WAT 6607 120.670 19.820 77.926 1.00 0.00 H TER 16109 WAT 6607 ATOM 16109 O WAT 6608 100.476 15.481 2.014 1.00 0.00 O ATOM 16110 H1 WAT 6608 99.930 15.265 2.770 1.00 0.00 H ATOM 16111 H2 WAT 6608 100.886 14.652 1.770 1.00 0.00 H TER 16113 WAT 6608 ATOM 16113 O WAT 6609 35.682 142.505 11.404 1.00 0.00 O ATOM 16114 H1 WAT 6609 36.318 143.049 11.868 1.00 0.00 H ATOM 16115 H2 WAT 6609 35.044 142.259 12.074 1.00 0.00 H TER 16117 WAT 6609 ATOM 16117 O WAT 6610 100.048 76.995 100.264 1.00 0.00 O ATOM 16118 H1 WAT 6610 100.528 76.167 100.248 1.00 0.00 H ATOM 16119 H2 WAT 6610 99.539 76.962 101.074 1.00 0.00 H TER 16121 WAT 6610 ATOM 16121 O WAT 6611 3.913 19.815 12.049 1.00 0.00 O ATOM 16122 H1 WAT 6611 4.012 20.635 11.564 1.00 0.00 H ATOM 16123 H2 WAT 6611 3.552 19.201 11.410 1.00 0.00 H TER 16125 WAT 6611 ATOM 16125 O WAT 6612 94.468 79.917 114.117 1.00 0.00 O ATOM 16126 H1 WAT 6612 95.394 79.990 114.350 1.00 0.00 H ATOM 16127 H2 WAT 6612 94.000 80.129 114.925 1.00 0.00 H TER 16129 WAT 6612 ATOM 16129 O WAT 6613 2.313 133.633 122.769 1.00 0.00 O ATOM 16130 H1 WAT 6613 2.211 132.831 122.257 1.00 0.00 H ATOM 16131 H2 WAT 6613 2.511 134.308 122.120 1.00 0.00 H TER 16133 WAT 6613 ATOM 16133 O WAT 6614 140.788 33.212 136.668 1.00 0.00 O ATOM 16134 H1 WAT 6614 139.983 33.677 136.898 1.00 0.00 H ATOM 16135 H2 WAT 6614 141.087 32.828 137.492 1.00 0.00 H TER 16137 WAT 6614 ATOM 16137 O WAT 6615 103.169 123.469 1.265 1.00 0.00 O ATOM 16138 H1 WAT 6615 103.233 122.997 0.434 1.00 0.00 H ATOM 16139 H2 WAT 6615 104.039 123.847 1.392 1.00 0.00 H TER 16141 WAT 6615 ATOM 16141 O WAT 6616 121.615 132.252 152.043 1.00 0.00 O ATOM 16142 H1 WAT 6616 121.267 131.871 151.237 1.00 0.00 H ATOM 16143 H2 WAT 6616 121.578 131.539 152.681 1.00 0.00 H TER 16145 WAT 6616 ATOM 16145 O WAT 6617 85.671 123.613 99.207 1.00 0.00 O ATOM 16146 H1 WAT 6617 85.722 123.458 100.150 1.00 0.00 H ATOM 16147 H2 WAT 6617 86.233 122.939 98.823 1.00 0.00 H TER 16149 WAT 6617 ATOM 16149 O WAT 6618 32.153 114.933 104.688 1.00 0.00 O ATOM 16150 H1 WAT 6618 32.655 115.141 103.900 1.00 0.00 H ATOM 16151 H2 WAT 6618 31.633 115.719 104.856 1.00 0.00 H TER 16153 WAT 6618 ATOM 16153 O WAT 6619 112.240 89.481 89.182 1.00 0.00 O ATOM 16154 H1 WAT 6619 111.406 89.379 89.640 1.00 0.00 H ATOM 16155 H2 WAT 6619 112.074 90.166 88.534 1.00 0.00 H TER 16157 WAT 6619 ATOM 16157 O WAT 6620 30.828 105.527 19.180 1.00 0.00 O ATOM 16158 H1 WAT 6620 30.016 105.201 18.792 1.00 0.00 H ATOM 16159 H2 WAT 6620 31.384 104.751 19.257 1.00 0.00 H TER 16161 WAT 6620 ATOM 16161 O WAT 6621 85.591 97.380 124.213 1.00 0.00 O ATOM 16162 H1 WAT 6621 84.980 97.611 123.513 1.00 0.00 H ATOM 16163 H2 WAT 6621 85.225 96.584 124.597 1.00 0.00 H TER 16165 WAT 6621 ATOM 16165 O WAT 6622 40.720 142.626 10.882 1.00 0.00 O ATOM 16166 H1 WAT 6622 40.671 142.091 10.090 1.00 0.00 H ATOM 16167 H2 WAT 6622 40.632 143.526 10.568 1.00 0.00 H TER 16169 WAT 6622 ATOM 16169 O WAT 6623 138.451 28.591 113.651 1.00 0.00 O ATOM 16170 H1 WAT 6623 138.108 27.747 113.942 1.00 0.00 H ATOM 16171 H2 WAT 6623 137.907 29.238 114.101 1.00 0.00 H TER 16173 WAT 6623 ATOM 16173 O WAT 6624 90.254 140.896 142.491 1.00 0.00 O ATOM 16174 H1 WAT 6624 89.309 141.048 142.489 1.00 0.00 H ATOM 16175 H2 WAT 6624 90.477 140.762 141.570 1.00 0.00 H TER 16177 WAT 6624 ATOM 16177 O WAT 6625 89.808 44.837 20.500 1.00 0.00 O ATOM 16178 H1 WAT 6625 90.250 44.857 21.349 1.00 0.00 H ATOM 16179 H2 WAT 6625 90.338 44.242 19.969 1.00 0.00 H TER 16181 WAT 6625 ATOM 16181 O WAT 6626 118.747 121.712 15.095 1.00 0.00 O ATOM 16182 H1 WAT 6626 119.310 120.941 15.032 1.00 0.00 H ATOM 16183 H2 WAT 6626 119.157 122.255 15.768 1.00 0.00 H TER 16185 WAT 6626 ATOM 16185 O WAT 6627 31.213 127.179 113.463 1.00 0.00 O ATOM 16186 H1 WAT 6627 31.566 127.648 114.219 1.00 0.00 H ATOM 16187 H2 WAT 6627 30.511 127.743 113.138 1.00 0.00 H TER 16189 WAT 6627 ATOM 16189 O WAT 6628 122.850 7.203 97.367 1.00 0.00 O ATOM 16190 H1 WAT 6628 122.575 6.443 97.880 1.00 0.00 H ATOM 16191 H2 WAT 6628 123.761 7.021 97.138 1.00 0.00 H TER 16193 WAT 6628 ATOM 16193 O WAT 6629 53.062 2.035 94.234 1.00 0.00 O ATOM 16194 H1 WAT 6629 52.823 2.023 93.307 1.00 0.00 H ATOM 16195 H2 WAT 6629 52.255 1.799 94.692 1.00 0.00 H TER 16197 WAT 6629 ATOM 16197 O WAT 6630 20.618 15.089 2.646 1.00 0.00 O ATOM 16198 H1 WAT 6630 19.750 14.712 2.786 1.00 0.00 H ATOM 16199 H2 WAT 6630 20.940 14.661 1.853 1.00 0.00 H TER 16201 WAT 6630 ATOM 16201 O WAT 6631 0.272 127.032 130.857 1.00 0.00 O ATOM 16202 H1 WAT 6631 -0.586 127.270 131.208 1.00 0.00 H ATOM 16203 H2 WAT 6631 0.441 127.683 130.176 1.00 0.00 H TER 16205 WAT 6631 ATOM 16205 O WAT 6632 48.717 132.805 143.510 1.00 0.00 O ATOM 16206 H1 WAT 6632 48.303 133.626 143.778 1.00 0.00 H ATOM 16207 H2 WAT 6632 49.554 132.797 143.973 1.00 0.00 H TER 16209 WAT 6632 ATOM 16209 O WAT 6633 145.143 89.867 140.238 1.00 0.00 O ATOM 16210 H1 WAT 6633 146.003 89.516 140.006 1.00 0.00 H ATOM 16211 H2 WAT 6633 145.306 90.407 141.012 1.00 0.00 H TER 16213 WAT 6633 ATOM 16213 O WAT 6634 91.190 58.111 3.533 1.00 0.00 O ATOM 16214 H1 WAT 6634 90.980 57.211 3.783 1.00 0.00 H ATOM 16215 H2 WAT 6634 91.997 58.310 4.008 1.00 0.00 H TER 16217 WAT 6634 ATOM 16217 O WAT 6635 136.144 105.243 18.383 1.00 0.00 O ATOM 16218 H1 WAT 6635 136.104 105.078 19.325 1.00 0.00 H ATOM 16219 H2 WAT 6635 135.929 106.171 18.293 1.00 0.00 H TER 16221 WAT 6635 ATOM 16221 O WAT 6636 146.086 89.572 91.147 1.00 0.00 O ATOM 16222 H1 WAT 6636 145.145 89.429 91.045 1.00 0.00 H ATOM 16223 H2 WAT 6636 146.227 90.465 90.831 1.00 0.00 H TER 16225 WAT 6636 ATOM 16225 O WAT 6637 88.226 6.263 108.521 1.00 0.00 O ATOM 16226 H1 WAT 6637 89.006 6.117 107.986 1.00 0.00 H ATOM 16227 H2 WAT 6637 88.207 7.209 108.664 1.00 0.00 H TER 16229 WAT 6637 ATOM 16229 O WAT 6638 21.189 15.344 9.353 1.00 0.00 O ATOM 16230 H1 WAT 6638 21.293 14.577 8.790 1.00 0.00 H ATOM 16231 H2 WAT 6638 20.277 15.608 9.232 1.00 0.00 H TER 16233 WAT 6638 ATOM 16233 O WAT 6639 88.040 71.811 142.177 1.00 0.00 O ATOM 16234 H1 WAT 6639 87.895 72.750 142.298 1.00 0.00 H ATOM 16235 H2 WAT 6639 88.865 71.756 141.696 1.00 0.00 H TER 16237 WAT 6639 ATOM 16237 O WAT 6640 33.188 82.199 154.404 1.00 0.00 O ATOM 16238 H1 WAT 6640 32.697 82.935 154.769 1.00 0.00 H ATOM 16239 H2 WAT 6640 33.821 82.604 153.811 1.00 0.00 H TER 16241 WAT 6640 ATOM 16241 O WAT 6641 6.901 104.284 124.131 1.00 0.00 O ATOM 16242 H1 WAT 6641 6.168 104.005 123.583 1.00 0.00 H ATOM 16243 H2 WAT 6641 6.813 103.766 124.931 1.00 0.00 H TER 16245 WAT 6641 ATOM 16245 O WAT 6642 31.311 23.762 141.887 1.00 0.00 O ATOM 16246 H1 WAT 6642 31.799 23.046 142.294 1.00 0.00 H ATOM 16247 H2 WAT 6642 30.392 23.552 142.055 1.00 0.00 H TER 16249 WAT 6642 ATOM 16249 O WAT 6643 140.858 108.512 76.030 1.00 0.00 O ATOM 16250 H1 WAT 6643 141.554 108.292 76.649 1.00 0.00 H ATOM 16251 H2 WAT 6643 141.239 108.338 75.169 1.00 0.00 H TER 16253 WAT 6643 ATOM 16253 O WAT 6644 107.924 90.537 147.777 1.00 0.00 O ATOM 16254 H1 WAT 6644 108.001 90.201 148.669 1.00 0.00 H ATOM 16255 H2 WAT 6644 108.711 91.067 147.652 1.00 0.00 H TER 16257 WAT 6644 ATOM 16257 O WAT 6645 95.431 65.562 101.617 1.00 0.00 O ATOM 16258 H1 WAT 6645 96.022 66.236 101.281 1.00 0.00 H ATOM 16259 H2 WAT 6645 94.612 65.703 101.143 1.00 0.00 H TER 16261 WAT 6645 ATOM 16261 O WAT 6646 90.067 111.578 92.104 1.00 0.00 O ATOM 16262 H1 WAT 6646 90.918 112.015 92.134 1.00 0.00 H ATOM 16263 H2 WAT 6646 90.145 110.951 91.385 1.00 0.00 H TER 16265 WAT 6646 ATOM 16265 O WAT 6647 47.728 13.585 114.940 1.00 0.00 O ATOM 16266 H1 WAT 6647 48.055 12.753 115.284 1.00 0.00 H ATOM 16267 H2 WAT 6647 46.816 13.621 115.230 1.00 0.00 H TER 16269 WAT 6647 ATOM 16269 O WAT 6648 87.207 107.298 79.494 1.00 0.00 O ATOM 16270 H1 WAT 6648 87.500 107.037 78.621 1.00 0.00 H ATOM 16271 H2 WAT 6648 86.252 107.256 79.449 1.00 0.00 H TER 16273 WAT 6648 ATOM 16273 O WAT 6649 55.602 19.716 24.007 1.00 0.00 O ATOM 16274 H1 WAT 6649 56.530 19.733 23.772 1.00 0.00 H ATOM 16275 H2 WAT 6649 55.406 20.613 24.276 1.00 0.00 H TER 16277 WAT 6649 ATOM 16277 O WAT 6650 29.849 19.615 106.057 1.00 0.00 O ATOM 16278 H1 WAT 6650 30.407 19.863 105.320 1.00 0.00 H ATOM 16279 H2 WAT 6650 29.101 19.176 105.654 1.00 0.00 H TER 16281 WAT 6650 ATOM 16281 O WAT 6651 107.867 108.936 140.650 1.00 0.00 O ATOM 16282 H1 WAT 6651 107.595 109.108 141.551 1.00 0.00 H ATOM 16283 H2 WAT 6651 107.112 109.191 140.119 1.00 0.00 H TER 16285 WAT 6651 ATOM 16285 O WAT 6652 91.881 83.256 61.219 1.00 0.00 O ATOM 16286 H1 WAT 6652 91.689 83.316 60.283 1.00 0.00 H ATOM 16287 H2 WAT 6652 92.474 83.989 61.389 1.00 0.00 H TER 16289 WAT 6652 ATOM 16289 O WAT 6653 5.152 125.716 92.746 1.00 0.00 O ATOM 16290 H1 WAT 6653 4.283 125.363 92.938 1.00 0.00 H ATOM 16291 H2 WAT 6653 5.563 125.051 92.194 1.00 0.00 H TER 16293 WAT 6653 ATOM 16293 O WAT 6654 12.919 32.421 18.885 1.00 0.00 O ATOM 16294 H1 WAT 6654 12.706 32.826 19.726 1.00 0.00 H ATOM 16295 H2 WAT 6654 13.864 32.541 18.794 1.00 0.00 H TER 16297 WAT 6654 ATOM 16297 O WAT 6655 14.895 44.701 22.533 1.00 0.00 O ATOM 16298 H1 WAT 6655 14.716 43.779 22.720 1.00 0.00 H ATOM 16299 H2 WAT 6655 15.825 44.723 22.308 1.00 0.00 H TER 16301 WAT 6655 ATOM 16301 O WAT 6656 8.007 66.629 80.237 1.00 0.00 O ATOM 16302 H1 WAT 6656 7.720 67.095 81.023 1.00 0.00 H ATOM 16303 H2 WAT 6656 8.896 66.339 80.442 1.00 0.00 H TER 16305 WAT 6656 ATOM 16305 O WAT 6657 6.370 71.902 1.511 1.00 0.00 O ATOM 16306 H1 WAT 6657 6.990 71.193 1.340 1.00 0.00 H ATOM 16307 H2 WAT 6657 6.437 72.058 2.453 1.00 0.00 H TER 16309 WAT 6657 ATOM 16309 O WAT 6658 104.993 21.016 156.165 1.00 0.00 O ATOM 16310 H1 WAT 6658 105.127 20.482 155.382 1.00 0.00 H ATOM 16311 H2 WAT 6658 105.336 21.878 155.929 1.00 0.00 H TER 16313 WAT 6658 ATOM 16313 O WAT 6659 77.443 6.005 129.504 1.00 0.00 O ATOM 16314 H1 WAT 6659 77.006 6.211 128.678 1.00 0.00 H ATOM 16315 H2 WAT 6659 77.291 5.067 129.628 1.00 0.00 H TER 16317 WAT 6659 ATOM 16317 O WAT 6660 120.800 32.461 76.018 1.00 0.00 O ATOM 16318 H1 WAT 6660 120.419 33.214 76.471 1.00 0.00 H ATOM 16319 H2 WAT 6660 121.743 32.550 76.156 1.00 0.00 H TER 16321 WAT 6660 ATOM 16321 O WAT 6661 41.745 128.663 94.229 1.00 0.00 O ATOM 16322 H1 WAT 6661 42.456 128.046 94.403 1.00 0.00 H ATOM 16323 H2 WAT 6661 42.187 129.489 94.032 1.00 0.00 H TER 16325 WAT 6661 ATOM 16325 O WAT 6662 74.536 136.772 148.788 1.00 0.00 O ATOM 16326 H1 WAT 6662 74.463 135.855 149.049 1.00 0.00 H ATOM 16327 H2 WAT 6662 75.470 136.900 148.621 1.00 0.00 H TER 16329 WAT 6662 ATOM 16329 O WAT 6663 81.823 99.308 99.327 1.00 0.00 O ATOM 16330 H1 WAT 6663 82.299 98.934 98.585 1.00 0.00 H ATOM 16331 H2 WAT 6663 82.323 100.089 99.562 1.00 0.00 H TER 16333 WAT 6663 ATOM 16333 O WAT 6664 57.398 131.127 55.933 1.00 0.00 O ATOM 16334 H1 WAT 6664 57.436 130.298 55.456 1.00 0.00 H ATOM 16335 H2 WAT 6664 56.846 131.690 55.389 1.00 0.00 H TER 16337 WAT 6664 ATOM 16337 O WAT 6665 65.071 102.986 54.520 1.00 0.00 O ATOM 16338 H1 WAT 6665 64.320 102.888 55.105 1.00 0.00 H ATOM 16339 H2 WAT 6665 65.410 103.861 54.709 1.00 0.00 H TER 16341 WAT 6665 ATOM 16341 O WAT 6666 20.983 140.846 96.748 1.00 0.00 O ATOM 16342 H1 WAT 6666 21.789 140.338 96.657 1.00 0.00 H ATOM 16343 H2 WAT 6666 21.202 141.532 97.379 1.00 0.00 H TER 16345 WAT 6666 ATOM 16345 O WAT 6667 123.297 128.325 84.189 1.00 0.00 O ATOM 16346 H1 WAT 6667 123.618 128.185 83.298 1.00 0.00 H ATOM 16347 H2 WAT 6667 123.729 129.130 84.475 1.00 0.00 H TER 16349 WAT 6667 ATOM 16349 O WAT 6668 119.379 79.312 107.712 1.00 0.00 O ATOM 16350 H1 WAT 6668 118.462 79.588 107.706 1.00 0.00 H ATOM 16351 H2 WAT 6668 119.347 78.376 107.908 1.00 0.00 H TER 16353 WAT 6668 ATOM 16353 O WAT 6669 120.825 42.676 120.870 1.00 0.00 O ATOM 16354 H1 WAT 6669 121.237 42.560 120.014 1.00 0.00 H ATOM 16355 H2 WAT 6669 120.726 41.787 121.211 1.00 0.00 H TER 16357 WAT 6669 ATOM 16357 O WAT 6670 68.306 21.497 126.593 1.00 0.00 O ATOM 16358 H1 WAT 6670 69.196 21.633 126.270 1.00 0.00 H ATOM 16359 H2 WAT 6670 67.744 21.862 125.909 1.00 0.00 H TER 16361 WAT 6670 ATOM 16361 O WAT 6671 118.449 73.098 7.310 1.00 0.00 O ATOM 16362 H1 WAT 6671 118.852 73.317 6.470 1.00 0.00 H ATOM 16363 H2 WAT 6671 117.533 73.358 7.211 1.00 0.00 H TER 16365 WAT 6671 ATOM 16365 O WAT 6672 48.030 1.793 131.367 1.00 0.00 O ATOM 16366 H1 WAT 6672 48.278 2.037 130.475 1.00 0.00 H ATOM 16367 H2 WAT 6672 48.643 1.097 131.605 1.00 0.00 H TER 16369 WAT 6672 ATOM 16369 O WAT 6673 66.236 127.378 57.095 1.00 0.00 O ATOM 16370 H1 WAT 6673 65.743 127.502 56.283 1.00 0.00 H ATOM 16371 H2 WAT 6673 65.693 127.787 57.769 1.00 0.00 H TER 16373 WAT 6673 ATOM 16373 O WAT 6674 71.256 119.400 10.697 1.00 0.00 O ATOM 16374 H1 WAT 6674 70.423 119.218 11.133 1.00 0.00 H ATOM 16375 H2 WAT 6674 71.622 118.536 10.508 1.00 0.00 H TER 16377 WAT 6674 ATOM 16377 O WAT 6675 104.251 7.996 114.904 1.00 0.00 O ATOM 16378 H1 WAT 6675 103.906 8.183 115.777 1.00 0.00 H ATOM 16379 H2 WAT 6675 103.574 7.461 114.489 1.00 0.00 H TER 16381 WAT 6675 ATOM 16381 O WAT 6676 108.317 54.913 0.486 1.00 0.00 O ATOM 16382 H1 WAT 6676 107.934 54.629 -0.344 1.00 0.00 H ATOM 16383 H2 WAT 6676 107.591 55.318 0.959 1.00 0.00 H TER 16385 WAT 6676 ATOM 16385 O WAT 6677 8.717 36.959 137.325 1.00 0.00 O ATOM 16386 H1 WAT 6677 8.127 36.267 137.028 1.00 0.00 H ATOM 16387 H2 WAT 6677 8.778 37.558 136.581 1.00 0.00 H TER 16389 WAT 6677 ATOM 16389 O WAT 6678 56.510 107.645 63.132 1.00 0.00 O ATOM 16390 H1 WAT 6678 57.262 107.877 62.586 1.00 0.00 H ATOM 16391 H2 WAT 6678 56.510 106.688 63.144 1.00 0.00 H TER 16393 WAT 6678 ATOM 16393 O WAT 6679 24.093 139.791 79.778 1.00 0.00 O ATOM 16394 H1 WAT 6679 23.391 139.802 80.429 1.00 0.00 H ATOM 16395 H2 WAT 6679 24.848 139.435 80.247 1.00 0.00 H TER 16397 WAT 6679 ATOM 16397 O WAT 6680 90.356 40.809 116.561 1.00 0.00 O ATOM 16398 H1 WAT 6680 91.069 40.185 116.425 1.00 0.00 H ATOM 16399 H2 WAT 6680 90.759 41.533 117.040 1.00 0.00 H TER 16401 WAT 6680 ATOM 16401 O WAT 6681 136.583 14.309 68.782 1.00 0.00 O ATOM 16402 H1 WAT 6681 136.217 13.428 68.863 1.00 0.00 H ATOM 16403 H2 WAT 6681 135.824 14.870 68.621 1.00 0.00 H TER 16405 WAT 6681 ATOM 16405 O WAT 6682 116.015 25.891 142.080 1.00 0.00 O ATOM 16406 H1 WAT 6682 115.729 26.675 141.612 1.00 0.00 H ATOM 16407 H2 WAT 6682 115.234 25.340 142.124 1.00 0.00 H TER 16409 WAT 6682 ATOM 16409 O WAT 6683 34.898 119.457 66.919 1.00 0.00 O ATOM 16410 H1 WAT 6683 34.781 118.625 66.460 1.00 0.00 H ATOM 16411 H2 WAT 6683 34.886 119.222 67.847 1.00 0.00 H TER 16413 WAT 6683 ATOM 16413 O WAT 6684 141.371 50.527 122.449 1.00 0.00 O ATOM 16414 H1 WAT 6684 141.153 50.296 121.546 1.00 0.00 H ATOM 16415 H2 WAT 6684 141.242 51.475 122.492 1.00 0.00 H TER 16417 WAT 6684 ATOM 16417 O WAT 6685 112.207 27.991 27.692 1.00 0.00 O ATOM 16418 H1 WAT 6685 112.184 28.800 28.204 1.00 0.00 H ATOM 16419 H2 WAT 6685 111.313 27.652 27.738 1.00 0.00 H TER 16421 WAT 6685 ATOM 16421 O WAT 6686 67.731 9.717 21.495 1.00 0.00 O ATOM 16422 H1 WAT 6686 67.024 9.232 21.922 1.00 0.00 H ATOM 16423 H2 WAT 6686 67.764 10.552 21.961 1.00 0.00 H TER 16425 WAT 6686 ATOM 16425 O WAT 6687 16.398 90.914 126.066 1.00 0.00 O ATOM 16426 H1 WAT 6687 15.667 90.653 126.626 1.00 0.00 H ATOM 16427 H2 WAT 6687 16.319 90.355 125.293 1.00 0.00 H TER 16429 WAT 6687 ATOM 16429 O WAT 6688 52.570 46.135 1.043 1.00 0.00 O ATOM 16430 H1 WAT 6688 53.204 45.526 1.423 1.00 0.00 H ATOM 16431 H2 WAT 6688 52.474 45.846 0.136 1.00 0.00 H TER 16433 WAT 6688 ATOM 16433 O WAT 6689 9.105 10.437 130.596 1.00 0.00 O ATOM 16434 H1 WAT 6689 9.750 9.854 130.197 1.00 0.00 H ATOM 16435 H2 WAT 6689 9.623 11.039 131.129 1.00 0.00 H TER 16437 WAT 6689 ATOM 16437 O WAT 6690 37.972 24.469 86.590 1.00 0.00 O ATOM 16438 H1 WAT 6690 37.914 23.691 87.144 1.00 0.00 H ATOM 16439 H2 WAT 6690 38.045 24.125 85.700 1.00 0.00 H TER 16441 WAT 6690 ATOM 16441 O WAT 6691 138.557 19.594 144.715 1.00 0.00 O ATOM 16442 H1 WAT 6691 138.256 19.412 145.606 1.00 0.00 H ATOM 16443 H2 WAT 6691 139.472 19.853 144.821 1.00 0.00 H TER 16445 WAT 6691 ATOM 16445 O WAT 6692 114.846 130.085 143.297 1.00 0.00 O ATOM 16446 H1 WAT 6692 113.920 129.968 143.084 1.00 0.00 H ATOM 16447 H2 WAT 6692 115.245 129.235 143.106 1.00 0.00 H TER 16449 WAT 6692 ATOM 16449 O WAT 6693 52.109 15.367 2.991 1.00 0.00 O ATOM 16450 H1 WAT 6693 52.547 15.378 2.140 1.00 0.00 H ATOM 16451 H2 WAT 6693 51.511 16.114 2.961 1.00 0.00 H TER 16453 WAT 6693 ATOM 16453 O WAT 6694 131.252 96.754 73.537 1.00 0.00 O ATOM 16454 H1 WAT 6694 131.289 97.476 74.165 1.00 0.00 H ATOM 16455 H2 WAT 6694 131.195 95.967 74.079 1.00 0.00 H TER 16457 WAT 6694 ATOM 16457 O WAT 6695 31.000 102.383 150.308 1.00 0.00 O ATOM 16458 H1 WAT 6695 31.761 102.877 150.004 1.00 0.00 H ATOM 16459 H2 WAT 6695 30.254 102.809 149.886 1.00 0.00 H TER 16461 WAT 6695 ATOM 16461 O WAT 6696 7.388 77.772 91.293 1.00 0.00 O ATOM 16462 H1 WAT 6696 7.448 78.547 91.852 1.00 0.00 H ATOM 16463 H2 WAT 6696 6.956 78.084 90.498 1.00 0.00 H TER 16465 WAT 6696 ATOM 16465 O WAT 6697 84.693 40.485 80.028 1.00 0.00 O ATOM 16466 H1 WAT 6697 84.421 41.204 80.598 1.00 0.00 H ATOM 16467 H2 WAT 6697 84.792 40.887 79.165 1.00 0.00 H TER 16469 WAT 6697 ATOM 16469 O WAT 6698 80.246 84.703 144.411 1.00 0.00 O ATOM 16470 H1 WAT 6698 80.947 84.653 143.761 1.00 0.00 H ATOM 16471 H2 WAT 6698 79.675 83.964 144.205 1.00 0.00 H TER 16473 WAT 6698 ATOM 16473 O WAT 6699 3.418 100.389 136.559 1.00 0.00 O ATOM 16474 H1 WAT 6699 4.147 100.484 137.173 1.00 0.00 H ATOM 16475 H2 WAT 6699 3.636 99.611 136.046 1.00 0.00 H TER 16477 WAT 6699 ATOM 16477 O WAT 6700 130.043 123.778 87.330 1.00 0.00 O ATOM 16478 H1 WAT 6700 130.748 124.423 87.391 1.00 0.00 H ATOM 16479 H2 WAT 6700 130.179 123.203 88.083 1.00 0.00 H TER 16481 WAT 6700 ATOM 16481 O WAT 6701 21.398 97.731 4.169 1.00 0.00 O ATOM 16482 H1 WAT 6701 21.647 96.844 3.908 1.00 0.00 H ATOM 16483 H2 WAT 6701 21.843 97.869 5.005 1.00 0.00 H TER 16485 WAT 6701 ATOM 16485 O WAT 6702 43.240 70.079 61.363 1.00 0.00 O ATOM 16486 H1 WAT 6702 43.020 69.409 60.715 1.00 0.00 H ATOM 16487 H2 WAT 6702 43.765 70.717 60.879 1.00 0.00 H TER 16489 WAT 6702 ATOM 16489 O WAT 6703 119.495 64.097 11.747 1.00 0.00 O ATOM 16490 H1 WAT 6703 119.706 63.188 11.958 1.00 0.00 H ATOM 16491 H2 WAT 6703 120.068 64.311 11.011 1.00 0.00 H TER 16493 WAT 6703 ATOM 16493 O WAT 6704 10.224 93.104 25.452 1.00 0.00 O ATOM 16494 H1 WAT 6704 9.851 92.671 24.684 1.00 0.00 H ATOM 16495 H2 WAT 6704 9.477 93.245 26.034 1.00 0.00 H TER 16497 WAT 6704 ATOM 16497 O WAT 6705 73.277 20.904 147.141 1.00 0.00 O ATOM 16498 H1 WAT 6705 72.988 21.806 147.002 1.00 0.00 H ATOM 16499 H2 WAT 6705 74.213 20.979 147.328 1.00 0.00 H TER 16501 WAT 6705 ATOM 16501 O WAT 6706 74.529 12.632 131.388 1.00 0.00 O ATOM 16502 H1 WAT 6706 75.013 13.155 130.749 1.00 0.00 H ATOM 16503 H2 WAT 6706 75.058 12.677 132.184 1.00 0.00 H TER 16505 WAT 6706 ATOM 16505 O WAT 6707 129.526 13.162 10.249 1.00 0.00 O ATOM 16506 H1 WAT 6707 130.163 13.864 10.388 1.00 0.00 H ATOM 16507 H2 WAT 6707 128.842 13.563 9.713 1.00 0.00 H TER 16509 WAT 6707 ATOM 16509 O WAT 6708 79.219 51.694 84.984 1.00 0.00 O ATOM 16510 H1 WAT 6708 78.578 51.964 84.326 1.00 0.00 H ATOM 16511 H2 WAT 6708 78.692 51.334 85.698 1.00 0.00 H TER 16513 WAT 6708 ATOM 16513 O WAT 6709 42.170 51.088 58.788 1.00 0.00 O ATOM 16514 H1 WAT 6709 42.587 50.307 59.151 1.00 0.00 H ATOM 16515 H2 WAT 6709 41.231 50.921 58.874 1.00 0.00 H TER 16517 WAT 6709 ATOM 16517 O WAT 6710 82.892 76.524 152.300 1.00 0.00 O ATOM 16518 H1 WAT 6710 82.848 75.589 152.501 1.00 0.00 H ATOM 16519 H2 WAT 6710 82.970 76.949 153.154 1.00 0.00 H TER 16521 WAT 6710 ATOM 16521 O WAT 6711 91.763 92.101 157.513 1.00 0.00 O ATOM 16522 H1 WAT 6711 90.964 92.628 157.509 1.00 0.00 H ATOM 16523 H2 WAT 6711 92.360 92.566 156.928 1.00 0.00 H TER 16525 WAT 6711 ATOM 16525 O WAT 6712 78.321 144.150 126.300 1.00 0.00 O ATOM 16526 H1 WAT 6712 79.056 143.560 126.469 1.00 0.00 H ATOM 16527 H2 WAT 6712 77.904 143.794 125.515 1.00 0.00 H TER 16529 WAT 6712 ATOM 16529 O WAT 6713 0.695 33.325 136.047 1.00 0.00 O ATOM 16530 H1 WAT 6713 1.526 33.207 135.587 1.00 0.00 H ATOM 16531 H2 WAT 6713 0.909 33.181 136.969 1.00 0.00 H TER 16533 WAT 6713 ATOM 16533 O WAT 6714 142.866 36.988 153.464 1.00 0.00 O ATOM 16534 H1 WAT 6714 143.440 37.513 152.907 1.00 0.00 H ATOM 16535 H2 WAT 6714 143.461 36.427 153.962 1.00 0.00 H TER 16537 WAT 6714 ATOM 16537 O WAT 6715 133.129 118.310 98.143 1.00 0.00 O ATOM 16538 H1 WAT 6715 133.110 119.253 97.978 1.00 0.00 H ATOM 16539 H2 WAT 6715 132.829 117.918 97.323 1.00 0.00 H TER 16541 WAT 6715 ATOM 16541 O WAT 6716 113.494 55.360 14.794 1.00 0.00 O ATOM 16542 H1 WAT 6716 114.327 55.246 15.251 1.00 0.00 H ATOM 16543 H2 WAT 6716 112.944 54.646 15.117 1.00 0.00 H TER 16545 WAT 6716 ATOM 16545 O WAT 6717 142.121 105.290 19.288 1.00 0.00 O ATOM 16546 H1 WAT 6717 141.315 105.750 19.054 1.00 0.00 H ATOM 16547 H2 WAT 6717 141.949 104.936 20.161 1.00 0.00 H TER 16549 WAT 6717 ATOM 16549 O WAT 6718 42.798 79.577 4.678 1.00 0.00 O ATOM 16550 H1 WAT 6718 43.639 79.785 4.271 1.00 0.00 H ATOM 16551 H2 WAT 6718 42.888 79.878 5.582 1.00 0.00 H TER 16553 WAT 6718 ATOM 16553 O WAT 6719 62.360 33.848 132.729 1.00 0.00 O ATOM 16554 H1 WAT 6719 62.766 33.278 132.076 1.00 0.00 H ATOM 16555 H2 WAT 6719 61.484 34.021 132.385 1.00 0.00 H TER 16557 WAT 6719 ATOM 16557 O WAT 6720 28.439 80.454 124.506 1.00 0.00 O ATOM 16558 H1 WAT 6720 27.945 80.813 123.769 1.00 0.00 H ATOM 16559 H2 WAT 6720 29.250 80.128 124.115 1.00 0.00 H TER 16561 WAT 6720 ATOM 16561 O WAT 6721 70.451 45.609 87.371 1.00 0.00 O ATOM 16562 H1 WAT 6721 70.821 45.176 88.140 1.00 0.00 H ATOM 16563 H2 WAT 6721 71.082 45.436 86.672 1.00 0.00 H TER 16565 WAT 6721 ATOM 16565 O WAT 6722 116.354 39.223 101.848 1.00 0.00 O ATOM 16566 H1 WAT 6722 116.639 39.887 102.475 1.00 0.00 H ATOM 16567 H2 WAT 6722 116.902 38.462 102.040 1.00 0.00 H TER 16569 WAT 6722 ATOM 16569 O WAT 6723 110.793 60.238 8.881 1.00 0.00 O ATOM 16570 H1 WAT 6723 110.226 59.898 8.189 1.00 0.00 H ATOM 16571 H2 WAT 6723 111.582 59.698 8.832 1.00 0.00 H TER 16573 WAT 6723 ATOM 16573 O WAT 6724 61.479 4.563 134.788 1.00 0.00 O ATOM 16574 H1 WAT 6724 61.202 5.414 134.448 1.00 0.00 H ATOM 16575 H2 WAT 6724 62.081 4.224 134.126 1.00 0.00 H TER 16577 WAT 6724 ATOM 16577 O WAT 6725 131.549 56.935 93.636 1.00 0.00 O ATOM 16578 H1 WAT 6725 132.351 57.171 94.103 1.00 0.00 H ATOM 16579 H2 WAT 6725 131.585 57.445 92.826 1.00 0.00 H TER 16581 WAT 6725 ATOM 16581 O WAT 6726 107.085 104.544 92.920 1.00 0.00 O ATOM 16582 H1 WAT 6726 107.813 104.591 93.539 1.00 0.00 H ATOM 16583 H2 WAT 6726 106.684 103.691 93.084 1.00 0.00 H TER 16585 WAT 6726 ATOM 16585 O WAT 6727 105.118 50.418 123.670 1.00 0.00 O ATOM 16586 H1 WAT 6727 104.199 50.444 123.938 1.00 0.00 H ATOM 16587 H2 WAT 6727 105.361 49.494 123.738 1.00 0.00 H TER 16589 WAT 6727 ATOM 16589 O WAT 6728 113.619 119.760 93.853 1.00 0.00 O ATOM 16590 H1 WAT 6728 113.362 120.639 93.578 1.00 0.00 H ATOM 16591 H2 WAT 6728 114.144 119.899 94.641 1.00 0.00 H TER 16593 WAT 6728 ATOM 16593 O WAT 6729 138.518 117.091 137.697 1.00 0.00 O ATOM 16594 H1 WAT 6729 137.816 117.636 138.053 1.00 0.00 H ATOM 16595 H2 WAT 6729 138.339 116.216 138.040 1.00 0.00 H TER 16597 WAT 6729 ATOM 16597 O WAT 6730 89.495 79.524 157.592 1.00 0.00 O ATOM 16598 H1 WAT 6730 89.434 78.885 156.882 1.00 0.00 H ATOM 16599 H2 WAT 6730 89.178 80.341 157.207 1.00 0.00 H TER 16601 WAT 6730 ATOM 16601 O WAT 6731 52.821 107.670 71.941 1.00 0.00 O ATOM 16602 H1 WAT 6731 52.084 108.262 71.794 1.00 0.00 H ATOM 16603 H2 WAT 6731 53.522 108.236 72.264 1.00 0.00 H TER 16605 WAT 6731 ATOM 16605 O WAT 6732 3.530 52.631 147.705 1.00 0.00 O ATOM 16606 H1 WAT 6732 4.141 52.981 148.354 1.00 0.00 H ATOM 16607 H2 WAT 6732 2.763 53.200 147.768 1.00 0.00 H TER 16609 WAT 6732 ATOM 16609 O WAT 6733 93.340 114.137 2.068 1.00 0.00 O ATOM 16610 H1 WAT 6733 93.740 114.479 2.867 1.00 0.00 H ATOM 16611 H2 WAT 6733 92.472 114.540 2.044 1.00 0.00 H TER 16613 WAT 6733 ATOM 16613 O WAT 6734 35.173 31.640 6.741 1.00 0.00 O ATOM 16614 H1 WAT 6734 34.454 32.171 6.400 1.00 0.00 H ATOM 16615 H2 WAT 6734 35.474 31.131 5.988 1.00 0.00 H TER 16617 WAT 6734 ATOM 16617 O WAT 6735 100.812 67.640 104.998 1.00 0.00 O ATOM 16618 H1 WAT 6735 101.296 68.324 105.461 1.00 0.00 H ATOM 16619 H2 WAT 6735 100.182 68.118 104.458 1.00 0.00 H TER 16621 WAT 6735 ATOM 16621 O WAT 6736 17.149 58.644 148.047 1.00 0.00 O ATOM 16622 H1 WAT 6736 16.706 57.943 148.525 1.00 0.00 H ATOM 16623 H2 WAT 6736 16.439 59.158 147.662 1.00 0.00 H TER 16625 WAT 6736 ATOM 16625 O WAT 6737 125.656 95.774 119.575 1.00 0.00 O ATOM 16626 H1 WAT 6737 125.507 96.500 120.180 1.00 0.00 H ATOM 16627 H2 WAT 6737 124.827 95.680 119.105 1.00 0.00 H TER 16629 WAT 6737 ATOM 16629 O WAT 6738 83.823 144.960 100.553 1.00 0.00 O ATOM 16630 H1 WAT 6738 84.597 144.998 101.114 1.00 0.00 H ATOM 16631 H2 WAT 6738 83.086 145.078 101.153 1.00 0.00 H TER 16633 WAT 6738 ATOM 16633 O WAT 6739 57.272 42.103 122.946 1.00 0.00 O ATOM 16634 H1 WAT 6739 56.947 41.229 123.163 1.00 0.00 H ATOM 16635 H2 WAT 6739 56.490 42.656 122.944 1.00 0.00 H TER 16637 WAT 6739 ATOM 16637 O WAT 6740 107.675 0.699 140.042 1.00 0.00 O ATOM 16638 H1 WAT 6740 107.518 -0.232 139.887 1.00 0.00 H ATOM 16639 H2 WAT 6740 106.809 1.059 140.234 1.00 0.00 H TER 16641 WAT 6740 ATOM 16641 O WAT 6741 131.025 4.064 147.468 1.00 0.00 O ATOM 16642 H1 WAT 6741 130.505 3.272 147.331 1.00 0.00 H ATOM 16643 H2 WAT 6741 131.238 4.367 146.585 1.00 0.00 H TER 16645 WAT 6741 ATOM 16645 O WAT 6742 15.370 10.030 66.870 1.00 0.00 O ATOM 16646 H1 WAT 6742 15.511 10.938 66.603 1.00 0.00 H ATOM 16647 H2 WAT 6742 16.248 9.649 66.898 1.00 0.00 H TER 16649 WAT 6742 ATOM 16649 O WAT 6743 49.311 33.366 95.962 1.00 0.00 O ATOM 16650 H1 WAT 6743 50.245 33.563 95.893 1.00 0.00 H ATOM 16651 H2 WAT 6743 49.238 32.454 95.680 1.00 0.00 H TER 16653 WAT 6743 ATOM 16653 O WAT 6744 89.465 110.164 147.072 1.00 0.00 O ATOM 16654 H1 WAT 6744 89.284 110.407 147.980 1.00 0.00 H ATOM 16655 H2 WAT 6744 88.877 110.714 146.555 1.00 0.00 H TER 16657 WAT 6744 ATOM 16657 O WAT 6745 116.628 96.501 25.110 1.00 0.00 O ATOM 16658 H1 WAT 6745 115.837 96.530 25.649 1.00 0.00 H ATOM 16659 H2 WAT 6745 117.101 95.729 25.420 1.00 0.00 H TER 16661 WAT 6745 ATOM 16661 O WAT 6746 95.218 78.788 153.700 1.00 0.00 O ATOM 16662 H1 WAT 6746 95.840 78.229 153.234 1.00 0.00 H ATOM 16663 H2 WAT 6746 94.465 78.222 153.867 1.00 0.00 H TER 16665 WAT 6746 ATOM 16665 O WAT 6747 51.349 36.521 128.761 1.00 0.00 O ATOM 16666 H1 WAT 6747 51.266 35.631 129.106 1.00 0.00 H ATOM 16667 H2 WAT 6747 52.160 36.852 129.146 1.00 0.00 H TER 16669 WAT 6747 ATOM 16669 O WAT 6748 131.526 72.237 15.181 1.00 0.00 O ATOM 16670 H1 WAT 6748 131.498 72.744 15.992 1.00 0.00 H ATOM 16671 H2 WAT 6748 131.086 72.792 14.537 1.00 0.00 H TER 16673 WAT 6748 ATOM 16673 O WAT 6749 34.621 6.162 131.313 1.00 0.00 O ATOM 16674 H1 WAT 6749 35.353 5.557 131.195 1.00 0.00 H ATOM 16675 H2 WAT 6749 34.499 6.208 132.262 1.00 0.00 H TER 16677 WAT 6749 ATOM 16677 O WAT 6750 104.006 39.114 148.511 1.00 0.00 O ATOM 16678 H1 WAT 6750 104.117 38.413 147.869 1.00 0.00 H ATOM 16679 H2 WAT 6750 103.869 39.902 147.985 1.00 0.00 H TER 16681 WAT 6750 ATOM 16681 O WAT 6751 40.458 102.143 128.875 1.00 0.00 O ATOM 16682 H1 WAT 6751 40.151 102.913 129.354 1.00 0.00 H ATOM 16683 H2 WAT 6751 41.081 101.724 129.468 1.00 0.00 H TER 16685 WAT 6751 ATOM 16685 O WAT 6752 72.372 2.744 102.563 1.00 0.00 O ATOM 16686 H1 WAT 6752 72.713 2.355 101.758 1.00 0.00 H ATOM 16687 H2 WAT 6752 71.977 2.011 103.035 1.00 0.00 H TER 16689 WAT 6752 ATOM 16689 O WAT 6753 33.752 59.584 81.777 1.00 0.00 O ATOM 16690 H1 WAT 6753 34.160 60.229 82.355 1.00 0.00 H ATOM 16691 H2 WAT 6753 33.745 60.003 80.916 1.00 0.00 H TER 16693 WAT 6753 ATOM 16693 O WAT 6754 19.466 37.978 69.137 1.00 0.00 O ATOM 16694 H1 WAT 6754 20.248 37.427 69.106 1.00 0.00 H ATOM 16695 H2 WAT 6754 18.755 37.401 68.859 1.00 0.00 H TER 16697 WAT 6754 ATOM 16697 O WAT 6755 57.759 23.957 138.019 1.00 0.00 O ATOM 16698 H1 WAT 6755 57.441 23.425 137.290 1.00 0.00 H ATOM 16699 H2 WAT 6755 57.242 23.667 138.771 1.00 0.00 H TER 16701 WAT 6755 ATOM 16701 O WAT 6756 26.361 118.799 77.640 1.00 0.00 O ATOM 16702 H1 WAT 6756 26.112 119.506 77.044 1.00 0.00 H ATOM 16703 H2 WAT 6756 25.653 118.160 77.562 1.00 0.00 H TER 16705 WAT 6756 ATOM 16705 O WAT 6757 122.533 139.355 3.186 1.00 0.00 O ATOM 16706 H1 WAT 6757 122.427 138.941 4.042 1.00 0.00 H ATOM 16707 H2 WAT 6757 122.130 138.742 2.571 1.00 0.00 H TER 16709 WAT 6757 ATOM 16709 O WAT 6758 102.731 59.012 70.676 1.00 0.00 O ATOM 16710 H1 WAT 6758 103.429 59.514 71.095 1.00 0.00 H ATOM 16711 H2 WAT 6758 102.625 58.239 71.230 1.00 0.00 H TER 16713 WAT 6758 ATOM 16713 O WAT 6759 74.435 77.620 109.343 1.00 0.00 O ATOM 16714 H1 WAT 6759 74.565 78.457 108.897 1.00 0.00 H ATOM 16715 H2 WAT 6759 74.488 77.835 110.274 1.00 0.00 H TER 16717 WAT 6759 ATOM 16717 O WAT 6760 88.471 50.526 14.024 1.00 0.00 O ATOM 16718 H1 WAT 6760 89.059 50.478 14.778 1.00 0.00 H ATOM 16719 H2 WAT 6760 87.598 50.387 14.391 1.00 0.00 H TER 16721 WAT 6760 ATOM 16721 O WAT 6761 90.402 48.295 156.761 1.00 0.00 O ATOM 16722 H1 WAT 6761 89.585 48.586 157.167 1.00 0.00 H ATOM 16723 H2 WAT 6761 90.706 49.054 156.265 1.00 0.00 H TER 16725 WAT 6761 ATOM 16725 O WAT 6762 91.625 52.651 9.382 1.00 0.00 O ATOM 16726 H1 WAT 6762 91.620 53.608 9.384 1.00 0.00 H ATOM 16727 H2 WAT 6762 91.052 52.409 8.655 1.00 0.00 H TER 16729 WAT 6762 ATOM 16729 O WAT 6763 48.726 140.287 101.381 1.00 0.00 O ATOM 16730 H1 WAT 6763 49.679 140.380 101.381 1.00 0.00 H ATOM 16731 H2 WAT 6763 48.567 139.452 101.821 1.00 0.00 H TER 16733 WAT 6763 ATOM 16733 O WAT 6764 3.705 109.933 123.478 1.00 0.00 O ATOM 16734 H1 WAT 6764 3.599 109.841 124.425 1.00 0.00 H ATOM 16735 H2 WAT 6764 3.884 109.044 123.170 1.00 0.00 H TER 16737 WAT 6764 ATOM 16737 O WAT 6765 72.204 35.679 61.200 1.00 0.00 O ATOM 16738 H1 WAT 6765 71.844 35.915 62.055 1.00 0.00 H ATOM 16739 H2 WAT 6765 73.032 35.243 61.401 1.00 0.00 H TER 16741 WAT 6765 ATOM 16741 O WAT 6766 95.676 74.512 86.678 1.00 0.00 O ATOM 16742 H1 WAT 6766 96.554 74.836 86.880 1.00 0.00 H ATOM 16743 H2 WAT 6766 95.195 75.288 86.392 1.00 0.00 H TER 16745 WAT 6766 ATOM 16745 O WAT 6767 94.669 132.913 92.172 1.00 0.00 O ATOM 16746 H1 WAT 6767 95.238 132.624 91.459 1.00 0.00 H ATOM 16747 H2 WAT 6767 94.873 132.320 92.896 1.00 0.00 H TER 16749 WAT 6767 ATOM 16749 O WAT 6768 120.992 129.589 83.245 1.00 0.00 O ATOM 16750 H1 WAT 6768 121.751 129.137 83.615 1.00 0.00 H ATOM 16751 H2 WAT 6768 120.237 129.116 83.595 1.00 0.00 H TER 16753 WAT 6768 ATOM 16753 O WAT 6769 8.093 119.056 6.860 1.00 0.00 O ATOM 16754 H1 WAT 6769 7.496 119.597 6.344 1.00 0.00 H ATOM 16755 H2 WAT 6769 7.883 118.158 6.606 1.00 0.00 H TER 16757 WAT 6769 ATOM 16757 O WAT 6770 7.624 107.614 155.420 1.00 0.00 O ATOM 16758 H1 WAT 6770 7.075 107.582 154.636 1.00 0.00 H ATOM 16759 H2 WAT 6770 7.001 107.633 156.147 1.00 0.00 H TER 16761 WAT 6770 ATOM 16761 O WAT 6771 100.022 35.775 97.118 1.00 0.00 O ATOM 16762 H1 WAT 6771 100.976 35.860 97.108 1.00 0.00 H ATOM 16763 H2 WAT 6771 99.867 34.840 97.251 1.00 0.00 H TER 16765 WAT 6771 ATOM 16765 O WAT 6772 61.334 61.505 16.004 1.00 0.00 O ATOM 16766 H1 WAT 6772 62.103 61.659 16.552 1.00 0.00 H ATOM 16767 H2 WAT 6772 61.610 60.826 15.389 1.00 0.00 H TER 16769 WAT 6772 ATOM 16769 O WAT 6773 17.592 44.704 80.952 1.00 0.00 O ATOM 16770 H1 WAT 6773 18.321 44.468 81.527 1.00 0.00 H ATOM 16771 H2 WAT 6773 18.011 44.999 80.143 1.00 0.00 H TER 16773 WAT 6773 ATOM 16773 O WAT 6774 42.723 43.142 120.624 1.00 0.00 O ATOM 16774 H1 WAT 6774 42.380 43.926 120.194 1.00 0.00 H ATOM 16775 H2 WAT 6774 43.602 43.035 120.261 1.00 0.00 H TER 16777 WAT 6774 ATOM 16777 O WAT 6775 77.398 1.962 59.497 1.00 0.00 O ATOM 16778 H1 WAT 6775 76.631 1.472 59.794 1.00 0.00 H ATOM 16779 H2 WAT 6775 77.786 2.310 60.300 1.00 0.00 H TER 16781 WAT 6775 ATOM 16781 O WAT 6776 81.231 2.063 12.166 1.00 0.00 O ATOM 16782 H1 WAT 6776 82.103 2.457 12.143 1.00 0.00 H ATOM 16783 H2 WAT 6776 81.071 1.783 11.264 1.00 0.00 H TER 16785 WAT 6776 ATOM 16785 O WAT 6777 120.922 108.703 95.707 1.00 0.00 O ATOM 16786 H1 WAT 6777 120.829 109.333 96.422 1.00 0.00 H ATOM 16787 H2 WAT 6777 120.558 109.150 94.944 1.00 0.00 H TER 16789 WAT 6777 ATOM 16789 O WAT 6778 60.985 75.674 6.978 1.00 0.00 O ATOM 16790 H1 WAT 6778 61.470 74.876 7.189 1.00 0.00 H ATOM 16791 H2 WAT 6778 61.584 76.179 6.427 1.00 0.00 H TER 16793 WAT 6778 ATOM 16793 O WAT 6779 3.583 124.952 59.808 1.00 0.00 O ATOM 16794 H1 WAT 6779 4.407 124.537 60.060 1.00 0.00 H ATOM 16795 H2 WAT 6779 3.662 125.852 60.123 1.00 0.00 H TER 16797 WAT 6779 ATOM 16797 O WAT 6780 111.375 138.456 110.631 1.00 0.00 O ATOM 16798 H1 WAT 6780 110.798 139.006 110.102 1.00 0.00 H ATOM 16799 H2 WAT 6780 112.238 138.559 110.229 1.00 0.00 H TER 16801 WAT 6780 ATOM 16801 O WAT 6781 91.802 73.218 138.664 1.00 0.00 O ATOM 16802 H1 WAT 6781 91.783 72.476 138.059 1.00 0.00 H ATOM 16803 H2 WAT 6781 92.438 72.966 139.333 1.00 0.00 H TER 16805 WAT 6781 ATOM 16805 O WAT 6782 83.562 55.600 146.889 1.00 0.00 O ATOM 16806 H1 WAT 6782 82.726 55.343 146.500 1.00 0.00 H ATOM 16807 H2 WAT 6782 83.666 56.520 146.647 1.00 0.00 H TER 16809 WAT 6782 ATOM 16809 O WAT 6783 10.189 75.101 76.825 1.00 0.00 O ATOM 16810 H1 WAT 6783 9.903 74.600 76.062 1.00 0.00 H ATOM 16811 H2 WAT 6783 9.389 75.250 77.328 1.00 0.00 H TER 16813 WAT 6783 ATOM 16813 O WAT 6784 14.193 78.128 9.757 1.00 0.00 O ATOM 16814 H1 WAT 6784 14.794 78.855 9.920 1.00 0.00 H ATOM 16815 H2 WAT 6784 14.622 77.610 9.076 1.00 0.00 H TER 16817 WAT 6784 ATOM 16817 O WAT 6785 87.691 57.582 109.343 1.00 0.00 O ATOM 16818 H1 WAT 6785 87.707 58.434 109.778 1.00 0.00 H ATOM 16819 H2 WAT 6785 88.004 57.759 108.456 1.00 0.00 H TER 16821 WAT 6785 ATOM 16821 O WAT 6786 132.133 84.949 132.026 1.00 0.00 O ATOM 16822 H1 WAT 6786 132.424 84.037 132.018 1.00 0.00 H ATOM 16823 H2 WAT 6786 132.290 85.259 131.134 1.00 0.00 H TER 16825 WAT 6786 ATOM 16825 O WAT 6787 41.482 94.697 57.507 1.00 0.00 O ATOM 16826 H1 WAT 6787 41.145 93.834 57.746 1.00 0.00 H ATOM 16827 H2 WAT 6787 41.386 94.737 56.555 1.00 0.00 H TER 16829 WAT 6787 ATOM 16829 O WAT 6788 31.896 105.573 120.942 1.00 0.00 O ATOM 16830 H1 WAT 6788 32.264 105.758 121.806 1.00 0.00 H ATOM 16831 H2 WAT 6788 31.486 106.396 120.676 1.00 0.00 H TER 16833 WAT 6788 ATOM 16833 O WAT 6789 101.608 73.083 107.222 1.00 0.00 O ATOM 16834 H1 WAT 6789 101.660 74.017 107.020 1.00 0.00 H ATOM 16835 H2 WAT 6789 101.811 73.028 108.155 1.00 0.00 H TER 16837 WAT 6789 ATOM 16837 O WAT 6790 27.420 129.070 83.961 1.00 0.00 O ATOM 16838 H1 WAT 6790 27.596 128.313 84.520 1.00 0.00 H ATOM 16839 H2 WAT 6790 27.627 128.767 83.077 1.00 0.00 H TER 16841 WAT 6790 ATOM 16841 O WAT 6791 93.933 137.018 85.167 1.00 0.00 O ATOM 16842 H1 WAT 6791 94.205 137.045 86.084 1.00 0.00 H ATOM 16843 H2 WAT 6791 92.977 137.049 85.200 1.00 0.00 H TER 16845 WAT 6791 ATOM 16845 O WAT 6792 11.012 138.506 97.221 1.00 0.00 O ATOM 16846 H1 WAT 6792 11.902 138.842 97.330 1.00 0.00 H ATOM 16847 H2 WAT 6792 10.926 137.832 97.895 1.00 0.00 H TER 16849 WAT 6792 ATOM 16849 O WAT 6793 131.475 4.357 79.711 1.00 0.00 O ATOM 16850 H1 WAT 6793 130.768 3.717 79.789 1.00 0.00 H ATOM 16851 H2 WAT 6793 132.226 3.849 79.403 1.00 0.00 H TER 16853 WAT 6793 ATOM 16853 O WAT 6794 25.473 40.100 90.798 1.00 0.00 O ATOM 16854 H1 WAT 6794 26.217 40.701 90.844 1.00 0.00 H ATOM 16855 H2 WAT 6794 24.714 40.642 91.015 1.00 0.00 H TER 16857 WAT 6794 ATOM 16857 O WAT 6795 139.254 83.316 136.227 1.00 0.00 O ATOM 16858 H1 WAT 6795 139.345 83.260 137.178 1.00 0.00 H ATOM 16859 H2 WAT 6795 139.314 82.409 135.926 1.00 0.00 H TER 16861 WAT 6795 ATOM 16861 O WAT 6796 39.298 14.410 95.297 1.00 0.00 O ATOM 16862 H1 WAT 6796 39.157 15.260 95.713 1.00 0.00 H ATOM 16863 H2 WAT 6796 40.057 14.044 95.750 1.00 0.00 H TER 16865 WAT 6796 ATOM 16865 O WAT 6797 3.344 24.129 110.200 1.00 0.00 O ATOM 16866 H1 WAT 6797 3.316 24.943 109.696 1.00 0.00 H ATOM 16867 H2 WAT 6797 2.765 24.289 110.945 1.00 0.00 H TER 16869 WAT 6797 ATOM 16869 O WAT 6798 23.815 56.085 106.598 1.00 0.00 O ATOM 16870 H1 WAT 6798 24.612 56.541 106.869 1.00 0.00 H ATOM 16871 H2 WAT 6798 24.126 55.262 106.221 1.00 0.00 H TER 16873 WAT 6798 ATOM 16873 O WAT 6799 57.472 131.810 119.172 1.00 0.00 O ATOM 16874 H1 WAT 6799 57.453 131.121 118.508 1.00 0.00 H ATOM 16875 H2 WAT 6799 57.890 132.552 118.735 1.00 0.00 H TER 16877 WAT 6799 ATOM 16877 O WAT 6800 142.978 112.258 154.726 1.00 0.00 O ATOM 16878 H1 WAT 6800 142.849 112.053 155.652 1.00 0.00 H ATOM 16879 H2 WAT 6800 143.251 113.175 154.719 1.00 0.00 H TER 16881 WAT 6800 ATOM 16881 O WAT 6801 61.801 21.107 113.753 1.00 0.00 O ATOM 16882 H1 WAT 6801 60.864 21.035 113.567 1.00 0.00 H ATOM 16883 H2 WAT 6801 61.870 20.953 114.695 1.00 0.00 H TER 16885 WAT 6801 ATOM 16885 O WAT 6802 32.670 94.858 20.375 1.00 0.00 O ATOM 16886 H1 WAT 6802 32.021 95.439 20.772 1.00 0.00 H ATOM 16887 H2 WAT 6802 33.399 94.855 20.996 1.00 0.00 H TER 16889 WAT 6802 ATOM 16889 O WAT 6803 24.631 145.473 68.034 1.00 0.00 O ATOM 16890 H1 WAT 6803 24.001 145.408 67.316 1.00 0.00 H ATOM 16891 H2 WAT 6803 25.392 144.980 67.730 1.00 0.00 H TER 16893 WAT 6803 ATOM 16893 O WAT 6804 46.810 80.807 88.345 1.00 0.00 O ATOM 16894 H1 WAT 6804 47.444 81.448 88.023 1.00 0.00 H ATOM 16895 H2 WAT 6804 46.464 80.394 87.553 1.00 0.00 H TER 16897 WAT 6804 ATOM 16897 O WAT 6805 101.986 108.401 19.823 1.00 0.00 O ATOM 16898 H1 WAT 6805 102.185 107.759 20.505 1.00 0.00 H ATOM 16899 H2 WAT 6805 101.819 109.214 20.300 1.00 0.00 H TER 16901 WAT 6805 ATOM 16901 O WAT 6806 95.296 71.508 127.048 1.00 0.00 O ATOM 16902 H1 WAT 6806 96.167 71.306 127.391 1.00 0.00 H ATOM 16903 H2 WAT 6806 95.234 72.461 127.099 1.00 0.00 H TER 16905 WAT 6806 ATOM 16905 O WAT 6807 26.383 87.523 113.104 1.00 0.00 O ATOM 16906 H1 WAT 6807 26.776 87.647 112.240 1.00 0.00 H ATOM 16907 H2 WAT 6807 25.860 86.726 113.017 1.00 0.00 H TER 16909 WAT 6807 ATOM 16909 O WAT 6808 126.959 10.306 0.658 1.00 0.00 O ATOM 16910 H1 WAT 6808 126.852 11.105 1.174 1.00 0.00 H ATOM 16911 H2 WAT 6808 126.074 10.090 0.364 1.00 0.00 H TER 16913 WAT 6808 ATOM 16913 O WAT 6809 136.711 29.997 147.621 1.00 0.00 O ATOM 16914 H1 WAT 6809 137.075 30.718 148.133 1.00 0.00 H ATOM 16915 H2 WAT 6809 137.365 29.830 146.942 1.00 0.00 H TER 16917 WAT 6809 ATOM 16917 O WAT 6810 20.829 102.543 129.073 1.00 0.00 O ATOM 16918 H1 WAT 6810 19.974 102.113 129.102 1.00 0.00 H ATOM 16919 H2 WAT 6810 21.325 102.047 128.422 1.00 0.00 H TER 16921 WAT 6810 ATOM 16921 O WAT 6811 110.015 48.900 157.793 1.00 0.00 O ATOM 16922 H1 WAT 6811 109.828 49.838 157.748 1.00 0.00 H ATOM 16923 H2 WAT 6811 110.478 48.709 156.978 1.00 0.00 H TER 16925 WAT 6811 ATOM 16925 O WAT 6812 62.394 96.746 76.722 1.00 0.00 O ATOM 16926 H1 WAT 6812 63.109 96.915 77.337 1.00 0.00 H ATOM 16927 H2 WAT 6812 62.233 97.592 76.304 1.00 0.00 H TER 16929 WAT 6812 ATOM 16929 O WAT 6813 39.838 118.953 96.691 1.00 0.00 O ATOM 16930 H1 WAT 6813 39.968 119.638 97.346 1.00 0.00 H ATOM 16931 H2 WAT 6813 40.184 119.328 95.881 1.00 0.00 H TER 16933 WAT 6813 ATOM 16933 O WAT 6814 44.689 113.589 148.634 1.00 0.00 O ATOM 16934 H1 WAT 6814 44.562 113.098 149.446 1.00 0.00 H ATOM 16935 H2 WAT 6814 45.516 114.053 148.762 1.00 0.00 H TER 16937 WAT 6814 ATOM 16937 O WAT 6815 14.958 115.089 129.825 1.00 0.00 O ATOM 16938 H1 WAT 6815 15.472 114.344 129.512 1.00 0.00 H ATOM 16939 H2 WAT 6815 14.332 114.706 130.439 1.00 0.00 H TER 16941 WAT 6815 ATOM 16941 O WAT 6816 128.168 72.353 127.470 1.00 0.00 O ATOM 16942 H1 WAT 6816 127.553 72.978 127.087 1.00 0.00 H ATOM 16943 H2 WAT 6816 127.906 72.290 128.388 1.00 0.00 H TER 16945 WAT 6816 ATOM 16945 O WAT 6817 131.652 103.698 20.791 1.00 0.00 O ATOM 16946 H1 WAT 6817 132.021 102.860 20.512 1.00 0.00 H ATOM 16947 H2 WAT 6817 131.342 103.538 21.683 1.00 0.00 H TER 16949 WAT 6817 ATOM 16949 O WAT 6818 47.880 78.634 147.485 1.00 0.00 O ATOM 16950 H1 WAT 6818 48.656 79.093 147.164 1.00 0.00 H ATOM 16951 H2 WAT 6818 47.502 79.227 148.133 1.00 0.00 H TER 16953 WAT 6818 ATOM 16953 O WAT 6819 115.620 25.085 17.437 1.00 0.00 O ATOM 16954 H1 WAT 6819 115.877 24.471 16.749 1.00 0.00 H ATOM 16955 H2 WAT 6819 115.639 24.566 18.241 1.00 0.00 H TER 16957 WAT 6819 ATOM 16957 O WAT 6820 110.558 59.924 94.712 1.00 0.00 O ATOM 16958 H1 WAT 6820 110.674 60.706 94.173 1.00 0.00 H ATOM 16959 H2 WAT 6820 109.996 59.353 94.189 1.00 0.00 H TER 16961 WAT 6820 ATOM 16961 O WAT 6821 136.294 82.851 86.678 1.00 0.00 O ATOM 16962 H1 WAT 6821 136.020 83.753 86.514 1.00 0.00 H ATOM 16963 H2 WAT 6821 135.980 82.363 85.916 1.00 0.00 H TER 16965 WAT 6821 ATOM 16965 O WAT 6822 112.470 46.177 103.832 1.00 0.00 O ATOM 16966 H1 WAT 6822 111.933 46.717 104.412 1.00 0.00 H ATOM 16967 H2 WAT 6822 112.119 46.342 102.957 1.00 0.00 H TER 16969 WAT 6822 ATOM 16969 O WAT 6823 112.665 90.906 130.014 1.00 0.00 O ATOM 16970 H1 WAT 6823 113.179 91.174 130.775 1.00 0.00 H ATOM 16971 H2 WAT 6823 112.955 90.013 129.830 1.00 0.00 H TER 16973 WAT 6823 ATOM 16973 O WAT 6824 39.860 124.852 80.672 1.00 0.00 O ATOM 16974 H1 WAT 6824 39.208 124.849 79.972 1.00 0.00 H ATOM 16975 H2 WAT 6824 39.440 124.382 81.393 1.00 0.00 H TER 16977 WAT 6824 ATOM 16977 O WAT 6825 66.403 14.426 54.041 1.00 0.00 O ATOM 16978 H1 WAT 6825 65.455 14.513 53.940 1.00 0.00 H ATOM 16979 H2 WAT 6825 66.757 15.246 53.696 1.00 0.00 H TER 16981 WAT 6825 ATOM 16981 O WAT 6826 72.056 121.687 87.947 1.00 0.00 O ATOM 16982 H1 WAT 6826 72.644 120.977 87.691 1.00 0.00 H ATOM 16983 H2 WAT 6826 71.468 121.793 87.198 1.00 0.00 H TER 16985 WAT 6826 ATOM 16985 O WAT 6827 80.696 142.822 126.936 1.00 0.00 O ATOM 16986 H1 WAT 6827 81.198 143.451 126.417 1.00 0.00 H ATOM 16987 H2 WAT 6827 80.460 143.302 127.730 1.00 0.00 H TER 16989 WAT 6827 ATOM 16989 O WAT 6828 32.191 116.660 110.052 1.00 0.00 O ATOM 16990 H1 WAT 6828 32.550 116.570 109.169 1.00 0.00 H ATOM 16991 H2 WAT 6828 32.894 117.069 110.556 1.00 0.00 H TER 16993 WAT 6828 ATOM 16993 O WAT 6829 115.698 133.709 127.960 1.00 0.00 O ATOM 16994 H1 WAT 6829 116.480 133.675 128.512 1.00 0.00 H ATOM 16995 H2 WAT 6829 115.021 133.271 128.476 1.00 0.00 H TER 16997 WAT 6829 ATOM 16997 O WAT 6830 15.343 138.892 6.204 1.00 0.00 O ATOM 16998 H1 WAT 6830 16.157 139.268 6.539 1.00 0.00 H ATOM 16999 H2 WAT 6830 15.588 138.494 5.368 1.00 0.00 H TER 17001 WAT 6830 ATOM 17001 O WAT 6831 37.422 11.395 109.349 1.00 0.00 O ATOM 17002 H1 WAT 6831 37.406 11.439 108.393 1.00 0.00 H ATOM 17003 H2 WAT 6831 37.493 10.461 109.544 1.00 0.00 H TER 17005 WAT 6831 ATOM 17005 O WAT 6832 135.247 47.290 105.166 1.00 0.00 O ATOM 17006 H1 WAT 6832 134.350 47.603 105.287 1.00 0.00 H ATOM 17007 H2 WAT 6832 135.515 47.651 104.322 1.00 0.00 H TER 17009 WAT 6832 ATOM 17009 O WAT 6833 96.676 38.623 110.907 1.00 0.00 O ATOM 17010 H1 WAT 6833 96.378 39.519 110.752 1.00 0.00 H ATOM 17011 H2 WAT 6833 96.911 38.295 110.039 1.00 0.00 H TER 17013 WAT 6833 ATOM 17013 O WAT 6834 80.853 108.009 93.993 1.00 0.00 O ATOM 17014 H1 WAT 6834 81.414 108.248 94.730 1.00 0.00 H ATOM 17015 H2 WAT 6834 80.478 107.164 94.242 1.00 0.00 H TER 17017 WAT 6834 ATOM 17017 O WAT 6835 30.250 37.741 13.260 1.00 0.00 O ATOM 17018 H1 WAT 6835 30.743 38.484 13.607 1.00 0.00 H ATOM 17019 H2 WAT 6835 29.856 37.333 14.031 1.00 0.00 H TER 17021 WAT 6835 ATOM 17021 O WAT 6836 89.006 140.276 5.716 1.00 0.00 O ATOM 17022 H1 WAT 6836 89.441 139.426 5.649 1.00 0.00 H ATOM 17023 H2 WAT 6836 88.688 140.453 4.831 1.00 0.00 H TER 17025 WAT 6836 ATOM 17025 O WAT 6837 39.029 91.904 11.404 1.00 0.00 O ATOM 17026 H1 WAT 6837 38.445 91.431 10.811 1.00 0.00 H ATOM 17027 H2 WAT 6837 39.473 91.217 11.901 1.00 0.00 H TER 17029 WAT 6837 ATOM 17029 O WAT 6838 50.274 67.079 152.430 1.00 0.00 O ATOM 17030 H1 WAT 6838 50.088 67.127 151.493 1.00 0.00 H ATOM 17031 H2 WAT 6838 49.695 66.389 152.754 1.00 0.00 H TER 17033 WAT 6838 ATOM 17033 O WAT 6839 38.408 43.279 114.204 1.00 0.00 O ATOM 17034 H1 WAT 6839 39.061 43.885 114.555 1.00 0.00 H ATOM 17035 H2 WAT 6839 38.745 42.411 114.424 1.00 0.00 H TER 17037 WAT 6839 ATOM 17037 O WAT 6840 88.442 80.045 92.372 1.00 0.00 O ATOM 17038 H1 WAT 6840 89.238 80.172 92.889 1.00 0.00 H ATOM 17039 H2 WAT 6840 88.758 79.812 91.499 1.00 0.00 H TER 17041 WAT 6840 ATOM 17041 O WAT 6841 123.328 11.011 2.484 1.00 0.00 O ATOM 17042 H1 WAT 6841 124.234 11.270 2.648 1.00 0.00 H ATOM 17043 H2 WAT 6841 122.811 11.781 2.721 1.00 0.00 H TER 17045 WAT 6841 ATOM 17045 O WAT 6842 83.960 41.481 68.876 1.00 0.00 O ATOM 17046 H1 WAT 6842 84.730 42.014 68.680 1.00 0.00 H ATOM 17047 H2 WAT 6842 83.489 41.977 69.546 1.00 0.00 H TER 17049 WAT 6842 ATOM 17049 O WAT 6843 51.486 124.212 149.935 1.00 0.00 O ATOM 17050 H1 WAT 6843 51.962 123.663 149.311 1.00 0.00 H ATOM 17051 H2 WAT 6843 52.099 124.914 150.152 1.00 0.00 H TER 17053 WAT 6843 ATOM 17053 O WAT 6844 96.196 39.193 154.006 1.00 0.00 O ATOM 17054 H1 WAT 6844 96.693 39.617 154.706 1.00 0.00 H ATOM 17055 H2 WAT 6844 96.345 38.257 154.139 1.00 0.00 H TER 17057 WAT 6844 ATOM 17057 O WAT 6845 134.596 30.541 19.682 1.00 0.00 O ATOM 17058 H1 WAT 6845 134.694 31.195 20.374 1.00 0.00 H ATOM 17059 H2 WAT 6845 135.088 30.899 18.943 1.00 0.00 H TER 17061 WAT 6845 ATOM 17061 O WAT 6846 36.942 102.158 156.349 1.00 0.00 O ATOM 17062 H1 WAT 6846 37.268 101.468 155.772 1.00 0.00 H ATOM 17063 H2 WAT 6846 37.476 102.923 156.133 1.00 0.00 H TER 17065 WAT 6846 ATOM 17065 O WAT 6847 13.558 43.875 122.711 1.00 0.00 O ATOM 17066 H1 WAT 6847 12.868 44.533 122.620 1.00 0.00 H ATOM 17067 H2 WAT 6847 14.344 44.304 122.373 1.00 0.00 H TER 17069 WAT 6847 ATOM 17069 O WAT 6848 110.666 90.139 139.466 1.00 0.00 O ATOM 17070 H1 WAT 6848 110.069 90.559 138.847 1.00 0.00 H ATOM 17071 H2 WAT 6848 110.287 89.273 139.614 1.00 0.00 H TER 17073 WAT 6848 ATOM 17073 O WAT 6849 124.751 106.109 145.878 1.00 0.00 O ATOM 17074 H1 WAT 6849 124.252 106.726 145.342 1.00 0.00 H ATOM 17075 H2 WAT 6849 125.601 106.046 145.442 1.00 0.00 H TER 17077 WAT 6849 ATOM 17077 O WAT 6850 137.865 5.539 75.200 1.00 0.00 O ATOM 17078 H1 WAT 6850 137.743 6.431 75.526 1.00 0.00 H ATOM 17079 H2 WAT 6850 137.163 5.420 74.560 1.00 0.00 H TER 17081 WAT 6850 ATOM 17081 O WAT 6851 52.828 132.348 67.998 1.00 0.00 O ATOM 17082 H1 WAT 6851 52.236 131.668 68.321 1.00 0.00 H ATOM 17083 H2 WAT 6851 52.316 132.818 67.340 1.00 0.00 H TER 17085 WAT 6851 ATOM 17085 O WAT 6852 143.553 94.780 143.838 1.00 0.00 O ATOM 17086 H1 WAT 6852 143.505 94.854 144.791 1.00 0.00 H ATOM 17087 H2 WAT 6852 143.104 95.561 143.514 1.00 0.00 H TER 17089 WAT 6852 ATOM 17089 O WAT 6853 110.962 66.946 91.673 1.00 0.00 O ATOM 17090 H1 WAT 6853 111.205 67.389 92.486 1.00 0.00 H ATOM 17091 H2 WAT 6853 110.006 66.905 91.700 1.00 0.00 H TER 17093 WAT 6853 ATOM 17093 O WAT 6854 134.248 89.443 97.637 1.00 0.00 O ATOM 17094 H1 WAT 6854 135.067 88.979 97.809 1.00 0.00 H ATOM 17095 H2 WAT 6854 133.654 88.767 97.310 1.00 0.00 H TER 17097 WAT 6854 ATOM 17097 O WAT 6855 100.496 100.453 9.887 1.00 0.00 O ATOM 17098 H1 WAT 6855 99.877 101.004 9.409 1.00 0.00 H ATOM 17099 H2 WAT 6855 100.053 99.609 9.969 1.00 0.00 H TER 17101 WAT 6855 ATOM 17101 O WAT 6856 116.544 124.012 127.124 1.00 0.00 O ATOM 17102 H1 WAT 6856 117.055 124.709 126.711 1.00 0.00 H ATOM 17103 H2 WAT 6856 117.196 123.470 127.569 1.00 0.00 H TER 17105 WAT 6856 ATOM 17105 O WAT 6857 82.867 85.340 68.732 1.00 0.00 O ATOM 17106 H1 WAT 6857 83.539 85.940 69.054 1.00 0.00 H ATOM 17107 H2 WAT 6857 82.085 85.562 69.238 1.00 0.00 H TER 17109 WAT 6857 ATOM 17109 O WAT 6858 46.727 3.328 62.642 1.00 0.00 O ATOM 17110 H1 WAT 6858 45.806 3.562 62.751 1.00 0.00 H ATOM 17111 H2 WAT 6858 47.094 3.380 63.524 1.00 0.00 H TER 17113 WAT 6858 ATOM 17113 O WAT 6859 1.892 142.390 6.320 1.00 0.00 O ATOM 17114 H1 WAT 6859 0.967 142.436 6.077 1.00 0.00 H ATOM 17115 H2 WAT 6859 2.340 142.137 5.512 1.00 0.00 H TER 17117 WAT 6859 ATOM 17117 O WAT 6860 48.785 26.653 96.856 1.00 0.00 O ATOM 17118 H1 WAT 6860 48.275 26.683 96.047 1.00 0.00 H ATOM 17119 H2 WAT 6860 49.030 25.732 96.951 1.00 0.00 H TER 17121 WAT 6860 ATOM 17121 O WAT 6861 26.040 137.899 77.680 1.00 0.00 O ATOM 17122 H1 WAT 6861 25.384 138.459 77.265 1.00 0.00 H ATOM 17123 H2 WAT 6861 25.535 137.323 78.254 1.00 0.00 H TER 17125 WAT 6861 ATOM 17125 O WAT 6862 129.248 6.634 66.885 1.00 0.00 O ATOM 17126 H1 WAT 6862 128.443 6.257 66.530 1.00 0.00 H ATOM 17127 H2 WAT 6862 129.866 6.608 66.155 1.00 0.00 H TER 17129 WAT 6862 ATOM 17129 O WAT 6863 53.249 1.535 113.783 1.00 0.00 O ATOM 17130 H1 WAT 6863 53.872 1.762 113.092 1.00 0.00 H ATOM 17131 H2 WAT 6863 53.743 0.967 114.374 1.00 0.00 H TER 17133 WAT 6863 ATOM 17133 O WAT 6864 70.977 19.196 90.169 1.00 0.00 O ATOM 17134 H1 WAT 6864 70.285 18.967 89.549 1.00 0.00 H ATOM 17135 H2 WAT 6864 71.790 19.052 89.686 1.00 0.00 H TER 17137 WAT 6864 ATOM 17137 O WAT 6865 99.517 11.302 104.274 1.00 0.00 O ATOM 17138 H1 WAT 6865 99.522 11.119 105.213 1.00 0.00 H ATOM 17139 H2 WAT 6865 99.699 10.456 103.864 1.00 0.00 H TER 17141 WAT 6865 ATOM 17141 O WAT 6866 111.829 112.655 97.797 1.00 0.00 O ATOM 17142 H1 WAT 6866 111.901 113.221 97.029 1.00 0.00 H ATOM 17143 H2 WAT 6866 112.718 112.330 97.940 1.00 0.00 H TER 17145 WAT 6866 ATOM 17145 O WAT 6867 145.697 117.125 102.508 1.00 0.00 O ATOM 17146 H1 WAT 6867 146.397 117.588 102.048 1.00 0.00 H ATOM 17147 H2 WAT 6867 145.553 116.332 101.990 1.00 0.00 H TER 17149 WAT 6867 ATOM 17149 O WAT 6868 28.212 31.230 4.820 1.00 0.00 O ATOM 17150 H1 WAT 6868 28.263 31.130 3.869 1.00 0.00 H ATOM 17151 H2 WAT 6868 28.412 30.360 5.164 1.00 0.00 H TER 17153 WAT 6868 ATOM 17153 O WAT 6869 131.266 25.244 155.990 1.00 0.00 O ATOM 17154 H1 WAT 6869 131.141 25.299 155.042 1.00 0.00 H ATOM 17155 H2 WAT 6869 132.195 25.432 156.120 1.00 0.00 H TER 17157 WAT 6869 ATOM 17157 O WAT 6870 1.809 117.863 135.592 1.00 0.00 O ATOM 17158 H1 WAT 6870 0.906 117.825 135.906 1.00 0.00 H ATOM 17159 H2 WAT 6870 2.329 118.027 136.379 1.00 0.00 H TER 17161 WAT 6870 ATOM 17161 O WAT 6871 126.815 115.171 75.029 1.00 0.00 O ATOM 17162 H1 WAT 6871 126.222 115.138 74.279 1.00 0.00 H ATOM 17163 H2 WAT 6871 127.598 114.704 74.737 1.00 0.00 H TER 17165 WAT 6871 ATOM 17165 O WAT 6872 72.207 43.360 10.722 1.00 0.00 O ATOM 17166 H1 WAT 6872 72.380 44.250 11.029 1.00 0.00 H ATOM 17167 H2 WAT 6872 73.034 42.896 10.850 1.00 0.00 H TER 17169 WAT 6872 ATOM 17169 O WAT 6873 99.781 53.099 98.531 1.00 0.00 O ATOM 17170 H1 WAT 6873 99.463 53.720 97.876 1.00 0.00 H ATOM 17171 H2 WAT 6873 100.656 53.417 98.757 1.00 0.00 H TER 17173 WAT 6873 ATOM 17173 O WAT 6874 18.273 63.768 103.277 1.00 0.00 O ATOM 17174 H1 WAT 6874 18.107 64.706 103.370 1.00 0.00 H ATOM 17175 H2 WAT 6874 18.014 63.567 102.377 1.00 0.00 H TER 17177 WAT 6874 ATOM 17177 O WAT 6875 107.175 95.465 100.566 1.00 0.00 O ATOM 17178 H1 WAT 6875 106.851 95.835 101.387 1.00 0.00 H ATOM 17179 H2 WAT 6875 107.848 96.081 100.275 1.00 0.00 H TER 17181 WAT 6875 ATOM 17181 O WAT 6876 130.482 105.662 131.704 1.00 0.00 O ATOM 17182 H1 WAT 6876 131.122 105.559 132.409 1.00 0.00 H ATOM 17183 H2 WAT 6876 129.829 104.982 131.872 1.00 0.00 H TER 17185 WAT 6876 ATOM 17185 O WAT 6877 50.742 136.344 80.133 1.00 0.00 O ATOM 17186 H1 WAT 6877 50.850 136.926 79.381 1.00 0.00 H ATOM 17187 H2 WAT 6877 51.453 135.709 80.049 1.00 0.00 H TER 17189 WAT 6877 ATOM 17189 O WAT 6878 99.308 56.194 91.086 1.00 0.00 O ATOM 17190 H1 WAT 6878 98.606 56.075 91.726 1.00 0.00 H ATOM 17191 H2 WAT 6878 99.703 55.327 91.000 1.00 0.00 H TER 17193 WAT 6878 ATOM 17193 O WAT 6879 20.887 27.970 157.823 1.00 0.00 O ATOM 17194 H1 WAT 6879 21.694 28.186 158.290 1.00 0.00 H ATOM 17195 H2 WAT 6879 20.782 27.026 157.950 1.00 0.00 H TER 17197 WAT 6879 ATOM 17197 O WAT 6880 128.956 120.409 71.220 1.00 0.00 O ATOM 17198 H1 WAT 6880 128.891 120.720 72.122 1.00 0.00 H ATOM 17199 H2 WAT 6880 128.749 119.476 71.273 1.00 0.00 H TER 17201 WAT 6880 ATOM 17201 O WAT 6881 4.456 62.327 19.137 1.00 0.00 O ATOM 17202 H1 WAT 6881 3.907 61.996 19.848 1.00 0.00 H ATOM 17203 H2 WAT 6881 4.722 63.200 19.427 1.00 0.00 H TER 17205 WAT 6881 ATOM 17205 O WAT 6882 117.049 122.403 108.064 1.00 0.00 O ATOM 17206 H1 WAT 6882 116.702 123.067 108.660 1.00 0.00 H ATOM 17207 H2 WAT 6882 117.334 121.692 108.637 1.00 0.00 H TER 17209 WAT 6882 ATOM 17209 O WAT 6883 113.894 102.723 151.163 1.00 0.00 O ATOM 17210 H1 WAT 6883 114.763 103.117 151.091 1.00 0.00 H ATOM 17211 H2 WAT 6883 114.047 101.882 151.594 1.00 0.00 H TER 17213 WAT 6883 ATOM 17213 O WAT 6884 116.308 0.450 19.743 1.00 0.00 O ATOM 17214 H1 WAT 6884 115.651 0.058 19.167 1.00 0.00 H ATOM 17215 H2 WAT 6884 116.105 1.386 19.735 1.00 0.00 H TER 17217 WAT 6884 ATOM 17217 O WAT 6885 24.898 77.746 64.148 1.00 0.00 O ATOM 17218 H1 WAT 6885 25.155 78.618 63.848 1.00 0.00 H ATOM 17219 H2 WAT 6885 24.801 77.837 65.096 1.00 0.00 H TER 17221 WAT 6885 ATOM 17221 O WAT 6886 100.406 55.358 118.565 1.00 0.00 O ATOM 17222 H1 WAT 6886 100.015 55.192 119.422 1.00 0.00 H ATOM 17223 H2 WAT 6886 101.320 55.092 118.663 1.00 0.00 H TER 17225 WAT 6886 ATOM 17225 O WAT 6887 105.447 29.545 148.685 1.00 0.00 O ATOM 17226 H1 WAT 6887 106.212 29.920 148.249 1.00 0.00 H ATOM 17227 H2 WAT 6887 105.242 28.761 148.175 1.00 0.00 H TER 17229 WAT 6887 ATOM 17229 O WAT 6888 36.650 139.609 98.902 1.00 0.00 O ATOM 17230 H1 WAT 6888 37.185 138.863 98.630 1.00 0.00 H ATOM 17231 H2 WAT 6888 36.890 140.309 98.295 1.00 0.00 H TER 17233 WAT 6888 ATOM 17233 O WAT 6889 9.712 33.103 9.412 1.00 0.00 O ATOM 17234 H1 WAT 6889 9.802 32.219 9.766 1.00 0.00 H ATOM 17235 H2 WAT 6889 10.612 33.415 9.316 1.00 0.00 H TER 17237 WAT 6889 ATOM 17237 O WAT 6890 85.713 4.866 1.136 1.00 0.00 O ATOM 17238 H1 WAT 6890 85.070 4.166 1.254 1.00 0.00 H ATOM 17239 H2 WAT 6890 86.356 4.500 0.530 1.00 0.00 H TER 17241 WAT 6890 ATOM 17241 O WAT 6891 121.314 45.655 100.594 1.00 0.00 O ATOM 17242 H1 WAT 6891 121.870 45.673 101.374 1.00 0.00 H ATOM 17243 H2 WAT 6891 120.597 46.254 100.797 1.00 0.00 H TER 17245 WAT 6891 ATOM 17245 O WAT 6892 74.136 4.028 126.873 1.00 0.00 O ATOM 17246 H1 WAT 6892 73.475 3.987 127.564 1.00 0.00 H ATOM 17247 H2 WAT 6892 74.682 4.778 127.107 1.00 0.00 H TER 17249 WAT 6892 ATOM 17249 O WAT 6893 27.167 110.782 2.916 1.00 0.00 O ATOM 17250 H1 WAT 6893 27.329 110.825 1.974 1.00 0.00 H ATOM 17251 H2 WAT 6893 27.593 109.972 3.196 1.00 0.00 H TER 17253 WAT 6893 ATOM 17253 O WAT 6894 104.182 89.770 107.719 1.00 0.00 O ATOM 17254 H1 WAT 6894 103.394 90.223 107.419 1.00 0.00 H ATOM 17255 H2 WAT 6894 104.801 90.472 107.919 1.00 0.00 H TER 17257 WAT 6894 ATOM 17257 O WAT 6895 59.453 30.375 67.295 1.00 0.00 O ATOM 17258 H1 WAT 6895 58.724 30.527 67.896 1.00 0.00 H ATOM 17259 H2 WAT 6895 59.976 29.695 67.720 1.00 0.00 H TER 17261 WAT 6895 ATOM 17261 O WAT 6896 104.322 2.640 92.791 1.00 0.00 O ATOM 17262 H1 WAT 6896 104.052 2.085 92.060 1.00 0.00 H ATOM 17263 H2 WAT 6896 103.632 2.529 93.445 1.00 0.00 H TER 17265 WAT 6896 ATOM 17265 O WAT 6897 65.860 62.896 98.244 1.00 0.00 O ATOM 17266 H1 WAT 6897 65.081 62.340 98.242 1.00 0.00 H ATOM 17267 H2 WAT 6897 66.434 62.506 97.585 1.00 0.00 H TER 17269 WAT 6897 ATOM 17269 O WAT 6898 35.968 45.410 65.377 1.00 0.00 O ATOM 17270 H1 WAT 6898 35.156 45.917 65.337 1.00 0.00 H ATOM 17271 H2 WAT 6898 36.561 45.860 64.776 1.00 0.00 H TER 17273 WAT 6898 ATOM 17273 O WAT 6899 87.897 64.314 151.798 1.00 0.00 O ATOM 17274 H1 WAT 6899 88.668 64.177 152.349 1.00 0.00 H ATOM 17275 H2 WAT 6899 87.218 63.770 152.196 1.00 0.00 H TER 17277 WAT 6899 ATOM 17277 O WAT 6900 119.570 108.390 71.426 1.00 0.00 O ATOM 17278 H1 WAT 6900 119.202 109.272 71.484 1.00 0.00 H ATOM 17279 H2 WAT 6900 119.560 108.187 70.491 1.00 0.00 H TER 17281 WAT 6900 ATOM 17281 O WAT 6901 9.773 6.671 127.949 1.00 0.00 O ATOM 17282 H1 WAT 6901 9.524 6.369 128.822 1.00 0.00 H ATOM 17283 H2 WAT 6901 10.307 5.961 127.593 1.00 0.00 H TER 17285 WAT 6901 ATOM 17285 O WAT 6902 43.960 70.908 56.055 1.00 0.00 O ATOM 17286 H1 WAT 6902 43.592 71.154 56.904 1.00 0.00 H ATOM 17287 H2 WAT 6902 43.291 70.351 55.656 1.00 0.00 H TER 17289 WAT 6902 ATOM 17289 O WAT 6903 37.243 141.815 155.495 1.00 0.00 O ATOM 17290 H1 WAT 6903 36.907 141.952 154.609 1.00 0.00 H ATOM 17291 H2 WAT 6903 37.269 140.863 155.596 1.00 0.00 H TER 17293 WAT 6903 ATOM 17293 O WAT 6904 119.366 57.278 156.120 1.00 0.00 O ATOM 17294 H1 WAT 6904 118.542 57.014 156.528 1.00 0.00 H ATOM 17295 H2 WAT 6904 119.550 58.142 156.489 1.00 0.00 H TER 17297 WAT 6904 ATOM 17297 O WAT 6905 21.726 136.533 66.736 1.00 0.00 O ATOM 17298 H1 WAT 6905 21.892 136.355 65.810 1.00 0.00 H ATOM 17299 H2 WAT 6905 20.985 135.969 66.959 1.00 0.00 H TER 17301 WAT 6905 ATOM 17301 O WAT 6906 32.194 70.730 22.906 1.00 0.00 O ATOM 17302 H1 WAT 6906 32.520 71.593 23.163 1.00 0.00 H ATOM 17303 H2 WAT 6906 32.969 70.266 22.589 1.00 0.00 H TER 17305 WAT 6906 ATOM 17305 O WAT 6907 26.330 56.294 158.308 1.00 0.00 O ATOM 17306 H1 WAT 6907 26.174 57.131 158.744 1.00 0.00 H ATOM 17307 H2 WAT 6907 26.471 56.525 157.390 1.00 0.00 H TER 17309 WAT 6907 ATOM 17309 O WAT 6908 23.828 121.140 61.696 1.00 0.00 O ATOM 17310 H1 WAT 6908 24.474 121.842 61.788 1.00 0.00 H ATOM 17311 H2 WAT 6908 23.546 121.192 60.783 1.00 0.00 H TER 17313 WAT 6908 ATOM 17313 O WAT 6909 14.227 46.109 153.630 1.00 0.00 O ATOM 17314 H1 WAT 6909 15.126 46.312 153.372 1.00 0.00 H ATOM 17315 H2 WAT 6909 13.780 46.955 153.626 1.00 0.00 H TER 17317 WAT 6909 ATOM 17317 O WAT 6910 5.469 4.504 149.369 1.00 0.00 O ATOM 17318 H1 WAT 6910 5.369 3.618 149.022 1.00 0.00 H ATOM 17319 H2 WAT 6910 5.052 5.066 148.716 1.00 0.00 H TER 17321 WAT 6910 ATOM 17321 O WAT 6911 3.174 21.892 94.037 1.00 0.00 O ATOM 17322 H1 WAT 6911 3.447 22.810 94.045 1.00 0.00 H ATOM 17323 H2 WAT 6911 2.321 21.900 93.603 1.00 0.00 H TER 17325 WAT 6911 ATOM 17325 O WAT 6912 29.507 81.571 112.049 1.00 0.00 O ATOM 17326 H1 WAT 6912 30.050 80.807 112.245 1.00 0.00 H ATOM 17327 H2 WAT 6912 29.129 81.819 112.893 1.00 0.00 H TER 17329 WAT 6912 ATOM 17329 O WAT 6913 57.987 108.352 21.154 1.00 0.00 O ATOM 17330 H1 WAT 6913 57.364 108.345 20.428 1.00 0.00 H ATOM 17331 H2 WAT 6913 58.716 107.811 20.850 1.00 0.00 H TER 17333 WAT 6913 ATOM 17333 O WAT 6914 50.359 5.289 128.104 1.00 0.00 O ATOM 17334 H1 WAT 6914 49.805 4.571 128.410 1.00 0.00 H ATOM 17335 H2 WAT 6914 49.855 5.698 127.401 1.00 0.00 H TER 17337 WAT 6914 ATOM 17337 O WAT 6915 68.763 81.145 22.492 1.00 0.00 O ATOM 17338 H1 WAT 6915 69.603 80.944 22.905 1.00 0.00 H ATOM 17339 H2 WAT 6915 68.373 81.814 23.055 1.00 0.00 H TER 17341 WAT 6915 ATOM 17341 O WAT 6916 49.288 134.207 131.289 1.00 0.00 O ATOM 17342 H1 WAT 6916 49.678 133.451 131.726 1.00 0.00 H ATOM 17343 H2 WAT 6916 49.303 133.980 130.359 1.00 0.00 H TER 17345 WAT 6916 ATOM 17345 O WAT 6917 103.341 46.773 17.369 1.00 0.00 O ATOM 17346 H1 WAT 6917 103.223 45.985 17.899 1.00 0.00 H ATOM 17347 H2 WAT 6917 103.945 46.507 16.676 1.00 0.00 H TER 17349 WAT 6917 ATOM 17349 O WAT 6918 121.804 60.402 75.815 1.00 0.00 O ATOM 17350 H1 WAT 6918 121.602 61.326 75.965 1.00 0.00 H ATOM 17351 H2 WAT 6918 122.748 60.387 75.658 1.00 0.00 H TER 17353 WAT 6918 ATOM 17353 O WAT 6919 39.157 127.485 117.238 1.00 0.00 O ATOM 17354 H1 WAT 6919 39.888 127.113 117.730 1.00 0.00 H ATOM 17355 H2 WAT 6919 39.535 127.729 116.393 1.00 0.00 H TER 17357 WAT 6919 ATOM 17357 O WAT 6920 4.006 61.951 91.877 1.00 0.00 O ATOM 17358 H1 WAT 6920 3.703 61.749 90.991 1.00 0.00 H ATOM 17359 H2 WAT 6920 4.609 61.240 92.092 1.00 0.00 H TER 17361 WAT 6920 ATOM 17361 O WAT 6921 120.393 53.712 93.040 1.00 0.00 O ATOM 17362 H1 WAT 6921 120.193 52.980 93.623 1.00 0.00 H ATOM 17363 H2 WAT 6921 119.854 54.432 93.365 1.00 0.00 H TER 17365 WAT 6921 ATOM 17365 O WAT 6922 52.537 114.790 64.988 1.00 0.00 O ATOM 17366 H1 WAT 6922 52.182 113.932 65.222 1.00 0.00 H ATOM 17367 H2 WAT 6922 53.284 114.908 65.574 1.00 0.00 H TER 17369 WAT 6922 ATOM 17369 O WAT 6923 99.431 21.656 118.451 1.00 0.00 O ATOM 17370 H1 WAT 6923 99.058 22.223 117.776 1.00 0.00 H ATOM 17371 H2 WAT 6923 98.854 20.893 118.469 1.00 0.00 H TER 17373 WAT 6923 ATOM 17373 O WAT 6924 54.234 100.335 149.896 1.00 0.00 O ATOM 17374 H1 WAT 6924 55.132 100.583 150.116 1.00 0.00 H ATOM 17375 H2 WAT 6924 53.880 101.098 149.439 1.00 0.00 H TER 17377 WAT 6924 ATOM 17377 O WAT 6925 0.136 4.915 139.093 1.00 0.00 O ATOM 17378 H1 WAT 6925 0.182 3.998 139.362 1.00 0.00 H ATOM 17379 H2 WAT 6925 0.596 4.942 138.254 1.00 0.00 H TER 17381 WAT 6925 ATOM 17381 O WAT 6926 68.512 72.926 127.497 1.00 0.00 O ATOM 17382 H1 WAT 6926 68.752 72.888 126.572 1.00 0.00 H ATOM 17383 H2 WAT 6926 69.269 72.563 127.957 1.00 0.00 H TER 17385 WAT 6926 ATOM 17385 O WAT 6927 128.001 91.217 73.244 1.00 0.00 O ATOM 17386 H1 WAT 6927 128.533 90.421 73.231 1.00 0.00 H ATOM 17387 H2 WAT 6927 127.868 91.401 74.174 1.00 0.00 H TER 17389 WAT 6927 ATOM 17389 O WAT 6928 9.624 30.536 9.805 1.00 0.00 O ATOM 17390 H1 WAT 6928 10.256 30.054 9.272 1.00 0.00 H ATOM 17391 H2 WAT 6928 9.921 30.406 10.705 1.00 0.00 H TER 17393 WAT 6928 ATOM 17393 O WAT 6929 67.163 110.675 114.391 1.00 0.00 O ATOM 17394 H1 WAT 6929 67.408 109.753 114.473 1.00 0.00 H ATOM 17395 H2 WAT 6929 67.661 110.989 113.636 1.00 0.00 H TER 17397 WAT 6929 ATOM 17397 O WAT 6930 127.411 139.913 143.789 1.00 0.00 O ATOM 17398 H1 WAT 6930 127.057 139.121 144.193 1.00 0.00 H ATOM 17399 H2 WAT 6930 128.320 139.948 144.086 1.00 0.00 H TER 17401 WAT 6930 ATOM 17401 O WAT 6931 81.453 82.487 97.135 1.00 0.00 O ATOM 17402 H1 WAT 6931 81.038 83.167 97.666 1.00 0.00 H ATOM 17403 H2 WAT 6931 81.678 82.928 96.316 1.00 0.00 H TER 17405 WAT 6931 ATOM 17405 O WAT 6932 14.951 134.566 75.891 1.00 0.00 O ATOM 17406 H1 WAT 6932 15.394 134.609 75.043 1.00 0.00 H ATOM 17407 H2 WAT 6932 15.330 135.286 76.395 1.00 0.00 H TER 17409 WAT 6932 ATOM 17409 O WAT 6933 42.132 120.623 91.824 1.00 0.00 O ATOM 17410 H1 WAT 6933 43.042 120.388 92.004 1.00 0.00 H ATOM 17411 H2 WAT 6933 41.628 120.167 92.498 1.00 0.00 H TER 17413 WAT 6933 ATOM 17413 O WAT 6934 70.086 114.472 122.486 1.00 0.00 O ATOM 17414 H1 WAT 6934 69.609 114.213 123.274 1.00 0.00 H ATOM 17415 H2 WAT 6934 70.402 113.648 122.116 1.00 0.00 H TER 17417 WAT 6934 ATOM 17417 O WAT 6935 16.398 10.163 141.985 1.00 0.00 O ATOM 17418 H1 WAT 6935 15.881 10.260 141.186 1.00 0.00 H ATOM 17419 H2 WAT 6935 17.107 10.800 141.890 1.00 0.00 H TER 17421 WAT 6935 ATOM 17421 O WAT 6936 89.133 107.929 81.569 1.00 0.00 O ATOM 17422 H1 WAT 6936 89.044 107.183 82.163 1.00 0.00 H ATOM 17423 H2 WAT 6936 88.420 107.821 80.940 1.00 0.00 H TER 17425 WAT 6936 ATOM 17425 O WAT 6937 3.154 100.723 148.189 1.00 0.00 O ATOM 17426 H1 WAT 6937 2.393 100.168 148.016 1.00 0.00 H ATOM 17427 H2 WAT 6937 3.068 101.448 147.571 1.00 0.00 H TER 17429 WAT 6937 ATOM 17429 O WAT 6938 0.531 112.867 141.377 1.00 0.00 O ATOM 17430 H1 WAT 6938 0.052 112.083 141.644 1.00 0.00 H ATOM 17431 H2 WAT 6938 -0.062 113.317 140.776 1.00 0.00 H TER 17433 WAT 6938 ATOM 17433 O WAT 6939 34.044 37.578 104.985 1.00 0.00 O ATOM 17434 H1 WAT 6939 33.830 38.344 104.452 1.00 0.00 H ATOM 17435 H2 WAT 6939 34.945 37.362 104.744 1.00 0.00 H TER 17437 WAT 6939 ATOM 17437 O WAT 6940 85.598 38.138 151.547 1.00 0.00 O ATOM 17438 H1 WAT 6940 84.710 38.496 151.565 1.00 0.00 H ATOM 17439 H2 WAT 6940 85.866 38.210 150.631 1.00 0.00 H TER 17441 WAT 6940 ATOM 17441 O WAT 6941 14.675 71.166 112.714 1.00 0.00 O ATOM 17442 H1 WAT 6941 15.568 71.079 112.383 1.00 0.00 H ATOM 17443 H2 WAT 6941 14.137 70.692 112.080 1.00 0.00 H TER 17445 WAT 6941 ATOM 17445 O WAT 6942 103.807 65.095 121.398 1.00 0.00 O ATOM 17446 H1 WAT 6942 103.614 64.223 121.055 1.00 0.00 H ATOM 17447 H2 WAT 6942 104.186 64.935 122.263 1.00 0.00 H TER 17449 WAT 6942 ATOM 17449 O WAT 6943 137.674 70.292 74.329 1.00 0.00 O ATOM 17450 H1 WAT 6943 137.787 71.119 73.862 1.00 0.00 H ATOM 17451 H2 WAT 6943 137.263 70.539 75.157 1.00 0.00 H TER 17453 WAT 6943 ATOM 17453 O WAT 6944 5.778 58.470 5.667 1.00 0.00 O ATOM 17454 H1 WAT 6944 6.288 58.614 6.465 1.00 0.00 H ATOM 17455 H2 WAT 6944 5.565 59.351 5.357 1.00 0.00 H TER 17457 WAT 6944 ATOM 17457 O WAT 6945 92.739 82.118 123.983 1.00 0.00 O ATOM 17458 H1 WAT 6945 92.389 82.524 124.777 1.00 0.00 H ATOM 17459 H2 WAT 6945 92.527 82.737 123.284 1.00 0.00 H TER 17461 WAT 6945 ATOM 17461 O WAT 6946 42.681 136.621 53.990 1.00 0.00 O ATOM 17462 H1 WAT 6946 43.469 137.107 54.233 1.00 0.00 H ATOM 17463 H2 WAT 6946 42.313 137.115 53.257 1.00 0.00 H TER 17465 WAT 6946 ATOM 17465 O WAT 6947 36.573 78.684 2.817 1.00 0.00 O ATOM 17466 H1 WAT 6947 36.798 79.279 2.102 1.00 0.00 H ATOM 17467 H2 WAT 6947 36.370 77.855 2.384 1.00 0.00 H TER 17469 WAT 6947 ATOM 17469 O WAT 6948 134.413 68.635 4.815 1.00 0.00 O ATOM 17470 H1 WAT 6948 133.567 68.212 4.963 1.00 0.00 H ATOM 17471 H2 WAT 6948 134.518 69.227 5.560 1.00 0.00 H TER 17473 WAT 6948 ATOM 17473 O WAT 6949 122.374 119.468 135.065 1.00 0.00 O ATOM 17474 H1 WAT 6949 122.298 118.898 134.300 1.00 0.00 H ATOM 17475 H2 WAT 6949 121.874 119.020 135.747 1.00 0.00 H TER 17477 WAT 6949 ATOM 17477 O WAT 6950 8.841 90.660 129.437 1.00 0.00 O ATOM 17478 H1 WAT 6950 8.306 90.085 128.889 1.00 0.00 H ATOM 17479 H2 WAT 6950 9.406 91.123 128.819 1.00 0.00 H TER 17481 WAT 6950 ATOM 17481 O WAT 6951 106.213 67.682 123.488 1.00 0.00 O ATOM 17482 H1 WAT 6951 105.763 67.049 124.048 1.00 0.00 H ATOM 17483 H2 WAT 6951 105.537 68.320 123.257 1.00 0.00 H TER 17485 WAT 6951 ATOM 17485 O WAT 6952 8.711 70.246 111.645 1.00 0.00 O ATOM 17486 H1 WAT 6952 7.852 70.136 112.053 1.00 0.00 H ATOM 17487 H2 WAT 6952 8.518 70.477 110.737 1.00 0.00 H TER 17489 WAT 6952 ATOM 17489 O WAT 6953 61.719 120.154 152.031 1.00 0.00 O ATOM 17490 H1 WAT 6953 61.554 119.555 152.759 1.00 0.00 H ATOM 17491 H2 WAT 6953 61.323 120.981 152.307 1.00 0.00 H TER 17493 WAT 6953 ATOM 17493 O WAT 6954 91.684 17.908 124.943 1.00 0.00 O ATOM 17494 H1 WAT 6954 92.232 18.057 124.172 1.00 0.00 H ATOM 17495 H2 WAT 6954 91.882 17.009 125.207 1.00 0.00 H TER 17497 WAT 6954 ATOM 17497 O WAT 6955 123.448 18.912 149.104 1.00 0.00 O ATOM 17498 H1 WAT 6955 123.072 19.792 149.129 1.00 0.00 H ATOM 17499 H2 WAT 6955 123.959 18.848 149.911 1.00 0.00 H TER 17501 WAT 6955 ATOM 17501 O WAT 6956 30.690 106.184 70.946 1.00 0.00 O ATOM 17502 H1 WAT 6956 31.572 106.334 71.286 1.00 0.00 H ATOM 17503 H2 WAT 6956 30.746 105.340 70.498 1.00 0.00 H TER 17505 WAT 6956 ATOM 17505 O WAT 6957 80.147 83.288 64.154 1.00 0.00 O ATOM 17506 H1 WAT 6957 80.263 83.708 65.007 1.00 0.00 H ATOM 17507 H2 WAT 6957 79.223 83.039 64.134 1.00 0.00 H TER 17509 WAT 6957 ATOM 17509 O WAT 6958 91.689 69.622 149.870 1.00 0.00 O ATOM 17510 H1 WAT 6958 91.031 70.221 150.223 1.00 0.00 H ATOM 17511 H2 WAT 6958 92.421 70.188 149.624 1.00 0.00 H TER 17513 WAT 6958 ATOM 17513 O WAT 6959 89.939 88.736 15.411 1.00 0.00 O ATOM 17514 H1 WAT 6959 89.189 89.124 15.861 1.00 0.00 H ATOM 17515 H2 WAT 6959 90.065 89.285 14.637 1.00 0.00 H TER 17517 WAT 6959 ATOM 17517 O WAT 6960 4.799 87.905 86.242 1.00 0.00 O ATOM 17518 H1 WAT 6960 4.900 87.880 85.290 1.00 0.00 H ATOM 17519 H2 WAT 6960 3.904 88.216 86.379 1.00 0.00 H TER 17521 WAT 6960 ATOM 17521 O WAT 6961 129.749 101.555 101.443 1.00 0.00 O ATOM 17522 H1 WAT 6961 129.254 100.787 101.728 1.00 0.00 H ATOM 17523 H2 WAT 6961 130.666 101.302 101.548 1.00 0.00 H TER 17525 WAT 6961 ATOM 17525 O WAT 6962 68.830 98.634 4.173 1.00 0.00 O ATOM 17526 H1 WAT 6962 68.756 98.392 3.250 1.00 0.00 H ATOM 17527 H2 WAT 6962 69.737 98.922 4.273 1.00 0.00 H TER 17529 WAT 6962 ATOM 17529 O WAT 6963 49.947 95.473 154.077 1.00 0.00 O ATOM 17530 H1 WAT 6963 49.856 94.901 154.839 1.00 0.00 H ATOM 17531 H2 WAT 6963 50.014 96.354 154.446 1.00 0.00 H TER 17533 WAT 6963 ATOM 17533 O WAT 6964 130.231 77.218 61.413 1.00 0.00 O ATOM 17534 H1 WAT 6964 129.661 77.959 61.622 1.00 0.00 H ATOM 17535 H2 WAT 6964 129.643 76.561 61.042 1.00 0.00 H TER 17537 WAT 6964 ATOM 17537 O WAT 6965 48.091 135.459 74.804 1.00 0.00 O ATOM 17538 H1 WAT 6965 48.669 134.832 74.368 1.00 0.00 H ATOM 17539 H2 WAT 6965 47.209 135.186 74.553 1.00 0.00 H TER 17541 WAT 6965 ATOM 17541 O WAT 6966 100.897 100.005 69.936 1.00 0.00 O ATOM 17542 H1 WAT 6966 100.928 100.747 69.332 1.00 0.00 H ATOM 17543 H2 WAT 6966 100.119 100.164 70.471 1.00 0.00 H TER 17545 WAT 6966 ATOM 17545 O WAT 6967 104.437 32.860 82.414 1.00 0.00 O ATOM 17546 H1 WAT 6967 104.995 33.564 82.083 1.00 0.00 H ATOM 17547 H2 WAT 6967 104.431 32.985 83.363 1.00 0.00 H TER 17549 WAT 6967 ATOM 17549 O WAT 6968 105.660 111.487 11.305 1.00 0.00 O ATOM 17550 H1 WAT 6968 106.213 111.072 11.967 1.00 0.00 H ATOM 17551 H2 WAT 6968 106.244 111.629 10.560 1.00 0.00 H TER 17553 WAT 6968 ATOM 17553 O WAT 6969 69.804 136.224 23.732 1.00 0.00 O ATOM 17554 H1 WAT 6969 69.077 136.727 24.100 1.00 0.00 H ATOM 17555 H2 WAT 6969 69.520 135.312 23.794 1.00 0.00 H TER 17557 WAT 6969 ATOM 17557 O WAT 6970 65.109 129.932 142.456 1.00 0.00 O ATOM 17558 H1 WAT 6970 65.516 129.544 143.230 1.00 0.00 H ATOM 17559 H2 WAT 6970 65.207 129.268 141.775 1.00 0.00 H TER 17561 WAT 6970 ATOM 17561 O WAT 6971 140.462 95.683 145.463 1.00 0.00 O ATOM 17562 H1 WAT 6971 140.729 95.996 144.599 1.00 0.00 H ATOM 17563 H2 WAT 6971 139.622 96.113 145.624 1.00 0.00 H TER 17565 WAT 6971 ATOM 17565 O WAT 6972 2.940 127.790 154.604 1.00 0.00 O ATOM 17566 H1 WAT 6972 2.521 127.565 155.434 1.00 0.00 H ATOM 17567 H2 WAT 6972 2.243 127.705 153.953 1.00 0.00 H TER 17569 WAT 6972 ATOM 17569 O WAT 6973 90.271 14.201 120.576 1.00 0.00 O ATOM 17570 H1 WAT 6973 91.035 14.027 121.126 1.00 0.00 H ATOM 17571 H2 WAT 6973 90.383 15.107 120.289 1.00 0.00 H TER 17573 WAT 6973 ATOM 17573 O WAT 6974 84.193 37.866 79.472 1.00 0.00 O ATOM 17574 H1 WAT 6974 84.222 38.736 79.870 1.00 0.00 H ATOM 17575 H2 WAT 6974 84.162 37.263 80.215 1.00 0.00 H TER 17577 WAT 6974 ATOM 17577 O WAT 6975 107.059 52.292 133.710 1.00 0.00 O ATOM 17578 H1 WAT 6975 106.356 51.692 133.459 1.00 0.00 H ATOM 17579 H2 WAT 6975 107.130 52.195 134.659 1.00 0.00 H TER 17581 WAT 6975 ATOM 17581 O WAT 6976 141.362 66.202 149.917 1.00 0.00 O ATOM 17582 H1 WAT 6976 140.572 66.292 150.449 1.00 0.00 H ATOM 17583 H2 WAT 6976 141.316 66.928 149.294 1.00 0.00 H TER 17585 WAT 6976 ATOM 17585 O WAT 6977 71.376 39.044 146.753 1.00 0.00 O ATOM 17586 H1 WAT 6977 70.444 38.840 146.826 1.00 0.00 H ATOM 17587 H2 WAT 6977 71.413 39.781 146.144 1.00 0.00 H TER 17589 WAT 6977 ATOM 17589 O WAT 6978 20.362 131.650 117.070 1.00 0.00 O ATOM 17590 H1 WAT 6978 20.796 130.801 116.993 1.00 0.00 H ATOM 17591 H2 WAT 6978 19.602 131.584 116.491 1.00 0.00 H TER 17593 WAT 6978 ATOM 17593 O WAT 6979 87.155 26.229 56.851 1.00 0.00 O ATOM 17594 H1 WAT 6979 87.641 25.444 57.102 1.00 0.00 H ATOM 17595 H2 WAT 6979 87.399 26.381 55.938 1.00 0.00 H TER 17597 WAT 6979 ATOM 17597 O WAT 6980 141.436 77.390 75.159 1.00 0.00 O ATOM 17598 H1 WAT 6980 141.440 77.059 76.057 1.00 0.00 H ATOM 17599 H2 WAT 6980 141.086 76.667 74.639 1.00 0.00 H TER 17601 WAT 6980 ATOM 17601 O WAT 6981 95.217 110.298 126.066 1.00 0.00 O ATOM 17602 H1 WAT 6981 94.578 110.970 126.304 1.00 0.00 H ATOM 17603 H2 WAT 6981 95.280 109.742 126.843 1.00 0.00 H TER 17605 WAT 6981 ATOM 17605 O WAT 6982 132.299 32.258 8.280 1.00 0.00 O ATOM 17606 H1 WAT 6982 131.443 32.213 7.854 1.00 0.00 H ATOM 17607 H2 WAT 6982 132.140 31.945 9.171 1.00 0.00 H TER 17609 WAT 6982 ATOM 17609 O WAT 6983 4.372 93.738 131.268 1.00 0.00 O ATOM 17610 H1 WAT 6983 4.892 93.401 131.997 1.00 0.00 H ATOM 17611 H2 WAT 6983 4.001 94.557 131.596 1.00 0.00 H TER 17613 WAT 6983 ATOM 17613 O WAT 6984 140.470 94.834 69.278 1.00 0.00 O ATOM 17614 H1 WAT 6984 141.290 94.345 69.350 1.00 0.00 H ATOM 17615 H2 WAT 6984 140.666 95.687 69.664 1.00 0.00 H TER 17617 WAT 6984 ATOM 17617 O WAT 6985 125.259 103.411 128.940 1.00 0.00 O ATOM 17618 H1 WAT 6985 124.303 103.418 128.991 1.00 0.00 H ATOM 17619 H2 WAT 6985 125.480 104.217 128.475 1.00 0.00 H TER 17621 WAT 6985 ATOM 17621 O WAT 6986 80.605 41.699 91.311 1.00 0.00 O ATOM 17622 H1 WAT 6986 80.924 42.029 90.471 1.00 0.00 H ATOM 17623 H2 WAT 6986 80.074 42.413 91.664 1.00 0.00 H TER 17625 WAT 6986 ATOM 17625 O WAT 6987 89.101 14.803 139.998 1.00 0.00 O ATOM 17626 H1 WAT 6987 89.403 15.599 139.560 1.00 0.00 H ATOM 17627 H2 WAT 6987 88.434 15.106 140.613 1.00 0.00 H TER 17629 WAT 6987 ATOM 17629 O WAT 6988 26.072 8.541 93.423 1.00 0.00 O ATOM 17630 H1 WAT 6988 25.260 8.038 93.486 1.00 0.00 H ATOM 17631 H2 WAT 6988 25.975 9.235 94.076 1.00 0.00 H TER 17633 WAT 6988 ATOM 17633 O WAT 6989 113.643 96.186 129.041 1.00 0.00 O ATOM 17634 H1 WAT 6989 113.809 95.636 129.806 1.00 0.00 H ATOM 17635 H2 WAT 6989 112.750 95.966 128.777 1.00 0.00 H TER 17637 WAT 6989 ATOM 17637 O WAT 6990 79.405 133.782 88.942 1.00 0.00 O ATOM 17638 H1 WAT 6990 79.817 134.612 89.184 1.00 0.00 H ATOM 17639 H2 WAT 6990 78.803 134.011 88.234 1.00 0.00 H TER 17641 WAT 6990 ATOM 17641 O WAT 6991 117.662 35.868 88.789 1.00 0.00 O ATOM 17642 H1 WAT 6991 118.075 35.062 88.480 1.00 0.00 H ATOM 17643 H2 WAT 6991 117.553 36.399 88.001 1.00 0.00 H TER 17645 WAT 6991 ATOM 17645 O WAT 6992 40.315 23.095 63.680 1.00 0.00 O ATOM 17646 H1 WAT 6992 41.134 22.693 63.968 1.00 0.00 H ATOM 17647 H2 WAT 6992 39.698 22.915 64.389 1.00 0.00 H TER 17649 WAT 6992 ATOM 17649 O WAT 6993 70.778 43.356 105.137 1.00 0.00 O ATOM 17650 H1 WAT 6993 70.371 42.819 105.817 1.00 0.00 H ATOM 17651 H2 WAT 6993 71.572 43.700 105.547 1.00 0.00 H TER 17653 WAT 6993 ATOM 17653 O WAT 6994 122.921 119.456 21.556 1.00 0.00 O ATOM 17654 H1 WAT 6994 122.710 120.121 22.211 1.00 0.00 H ATOM 17655 H2 WAT 6994 122.152 118.886 21.537 1.00 0.00 H TER 17657 WAT 6994 ATOM 17657 O WAT 6995 131.386 108.221 96.424 1.00 0.00 O ATOM 17658 H1 WAT 6995 132.177 107.755 96.154 1.00 0.00 H ATOM 17659 H2 WAT 6995 131.692 108.854 97.074 1.00 0.00 H TER 17661 WAT 6995 ATOM 17661 O WAT 6996 123.509 134.219 105.427 1.00 0.00 O ATOM 17662 H1 WAT 6996 124.008 133.577 105.931 1.00 0.00 H ATOM 17663 H2 WAT 6996 123.703 134.009 104.513 1.00 0.00 H TER 17665 WAT 6996 ATOM 17665 O WAT 6997 18.504 108.918 22.139 1.00 0.00 O ATOM 17666 H1 WAT 6997 18.557 109.837 22.402 1.00 0.00 H ATOM 17667 H2 WAT 6997 17.764 108.569 22.637 1.00 0.00 H TER 17669 WAT 6997 ATOM 17669 O WAT 6998 102.845 42.693 79.547 1.00 0.00 O ATOM 17670 H1 WAT 6998 102.689 43.168 80.364 1.00 0.00 H ATOM 17671 H2 WAT 6998 102.473 41.824 79.701 1.00 0.00 H TER 17673 WAT 6998 ATOM 17673 O WAT 6999 0.713 115.517 88.169 1.00 0.00 O ATOM 17674 H1 WAT 6999 0.421 116.288 87.681 1.00 0.00 H ATOM 17675 H2 WAT 6999 1.091 114.942 87.504 1.00 0.00 H TER 17677 WAT 6999 ATOM 17677 O WAT 7000 138.699 108.420 143.089 1.00 0.00 O ATOM 17678 H1 WAT 7000 138.085 107.926 143.632 1.00 0.00 H ATOM 17679 H2 WAT 7000 138.490 108.157 142.192 1.00 0.00 H TER 17681 WAT 7000 ATOM 17681 O WAT 7001 32.254 27.788 86.907 1.00 0.00 O ATOM 17682 H1 WAT 7001 32.191 27.056 86.293 1.00 0.00 H ATOM 17683 H2 WAT 7001 32.721 28.468 86.421 1.00 0.00 H TER 17685 WAT 7001 ATOM 17685 O WAT 7002 107.073 93.801 87.092 1.00 0.00 O ATOM 17686 H1 WAT 7002 106.388 93.644 87.742 1.00 0.00 H ATOM 17687 H2 WAT 7002 107.250 92.938 86.718 1.00 0.00 H TER 17689 WAT 7002 ATOM 17689 O WAT 7003 31.947 69.406 73.946 1.00 0.00 O ATOM 17690 H1 WAT 7003 32.772 68.949 73.781 1.00 0.00 H ATOM 17691 H2 WAT 7003 32.194 70.158 74.484 1.00 0.00 H TER 17693 WAT 7003 ATOM 17693 O WAT 7004 45.651 56.760 85.600 1.00 0.00 O ATOM 17694 H1 WAT 7004 45.705 56.264 86.417 1.00 0.00 H ATOM 17695 H2 WAT 7004 44.749 56.637 85.304 1.00 0.00 H TER 17697 WAT 7004 ATOM 17697 O WAT 7005 11.548 74.096 96.119 1.00 0.00 O ATOM 17698 H1 WAT 7005 11.970 74.292 96.956 1.00 0.00 H ATOM 17699 H2 WAT 7005 11.639 73.149 96.021 1.00 0.00 H TER 17701 WAT 7005 ATOM 17701 O WAT 7006 143.286 29.589 101.963 1.00 0.00 O ATOM 17702 H1 WAT 7006 143.535 30.387 102.428 1.00 0.00 H ATOM 17703 H2 WAT 7006 143.595 28.878 102.525 1.00 0.00 H TER 17705 WAT 7006 ATOM 17705 O WAT 7007 113.651 94.775 54.428 1.00 0.00 O ATOM 17706 H1 WAT 7007 113.582 93.873 54.114 1.00 0.00 H ATOM 17707 H2 WAT 7007 113.931 94.690 55.339 1.00 0.00 H TER 17709 WAT 7007 ATOM 17709 O WAT 7008 19.412 84.605 17.612 1.00 0.00 O ATOM 17710 H1 WAT 7008 18.585 84.292 17.978 1.00 0.00 H ATOM 17711 H2 WAT 7008 19.711 85.271 18.231 1.00 0.00 H TER 17713 WAT 7008 ATOM 17713 O WAT 7009 5.348 86.642 136.905 1.00 0.00 O ATOM 17714 H1 WAT 7009 5.029 86.504 136.013 1.00 0.00 H ATOM 17715 H2 WAT 7009 4.927 87.453 137.188 1.00 0.00 H TER 17717 WAT 7009 ATOM 17717 O WAT 7010 137.235 48.961 93.889 1.00 0.00 O ATOM 17718 H1 WAT 7010 137.093 49.693 94.489 1.00 0.00 H ATOM 17719 H2 WAT 7010 137.760 48.338 94.391 1.00 0.00 H TER 17721 WAT 7010 ATOM 17721 O WAT 7011 93.741 142.256 103.931 1.00 0.00 O ATOM 17722 H1 WAT 7011 93.256 142.500 104.719 1.00 0.00 H ATOM 17723 H2 WAT 7011 93.660 141.303 103.885 1.00 0.00 H TER 17725 WAT 7011 ATOM 17725 O WAT 7012 58.278 40.771 91.598 1.00 0.00 O ATOM 17726 H1 WAT 7012 58.669 40.197 90.939 1.00 0.00 H ATOM 17727 H2 WAT 7012 58.970 41.398 91.810 1.00 0.00 H TER 17729 WAT 7012 ATOM 17729 O WAT 7013 91.361 111.795 154.196 1.00 0.00 O ATOM 17730 H1 WAT 7013 90.728 111.997 154.885 1.00 0.00 H ATOM 17731 H2 WAT 7013 90.895 111.201 153.608 1.00 0.00 H TER 17733 WAT 7013 ATOM 17733 O WAT 7014 55.978 75.344 106.237 1.00 0.00 O ATOM 17734 H1 WAT 7014 56.368 75.138 105.387 1.00 0.00 H ATOM 17735 H2 WAT 7014 55.142 74.878 106.236 1.00 0.00 H TER 17737 WAT 7014 ATOM 17737 O WAT 7015 136.848 4.402 3.955 1.00 0.00 O ATOM 17738 H1 WAT 7015 136.109 3.875 4.259 1.00 0.00 H ATOM 17739 H2 WAT 7015 136.782 5.217 4.453 1.00 0.00 H TER 17741 WAT 7015 ATOM 17741 O WAT 7016 27.220 132.389 114.694 1.00 0.00 O ATOM 17742 H1 WAT 7016 28.174 132.325 114.651 1.00 0.00 H ATOM 17743 H2 WAT 7016 26.948 132.532 113.787 1.00 0.00 H TER 17745 WAT 7016 ATOM 17745 O WAT 7017 12.053 34.126 153.420 1.00 0.00 O ATOM 17746 H1 WAT 7017 11.799 34.990 153.096 1.00 0.00 H ATOM 17747 H2 WAT 7017 12.695 34.307 154.106 1.00 0.00 H TER 17749 WAT 7017 ATOM 17749 O WAT 7018 0.930 122.392 3.064 1.00 0.00 O ATOM 17750 H1 WAT 7018 1.521 122.738 3.733 1.00 0.00 H ATOM 17751 H2 WAT 7018 0.056 122.637 3.366 1.00 0.00 H TER 17753 WAT 7018 ATOM 17753 O WAT 7019 114.185 45.226 56.943 1.00 0.00 O ATOM 17754 H1 WAT 7019 114.463 45.847 56.268 1.00 0.00 H ATOM 17755 H2 WAT 7019 114.564 44.391 56.670 1.00 0.00 H TER 17757 WAT 7019 ATOM 17757 O WAT 7020 7.837 109.930 68.817 1.00 0.00 O ATOM 17758 H1 WAT 7020 7.788 110.355 67.961 1.00 0.00 H ATOM 17759 H2 WAT 7020 8.284 110.567 69.375 1.00 0.00 H TER 17761 WAT 7020 ATOM 17761 O WAT 7021 138.272 50.532 14.299 1.00 0.00 O ATOM 17762 H1 WAT 7021 139.005 50.114 14.750 1.00 0.00 H ATOM 17763 H2 WAT 7021 137.744 49.803 13.974 1.00 0.00 H TER 17765 WAT 7021 ATOM 17765 O WAT 7022 36.422 104.488 146.902 1.00 0.00 O ATOM 17766 H1 WAT 7022 36.343 103.940 146.122 1.00 0.00 H ATOM 17767 H2 WAT 7022 37.294 104.292 147.245 1.00 0.00 H TER 17769 WAT 7022 ATOM 17769 O WAT 7023 26.872 88.786 73.310 1.00 0.00 O ATOM 17770 H1 WAT 7023 27.332 88.876 74.145 1.00 0.00 H ATOM 17771 H2 WAT 7023 27.338 89.374 72.716 1.00 0.00 H TER 17773 WAT 7023 ATOM 17773 O WAT 7024 54.026 3.624 115.883 1.00 0.00 O ATOM 17774 H1 WAT 7024 53.163 3.795 116.261 1.00 0.00 H ATOM 17775 H2 WAT 7024 54.200 2.706 116.091 1.00 0.00 H TER 17777 WAT 7024 ATOM 17777 O WAT 7025 86.440 122.453 15.329 1.00 0.00 O ATOM 17778 H1 WAT 7025 85.842 121.994 15.918 1.00 0.00 H ATOM 17779 H2 WAT 7025 86.019 123.298 15.171 1.00 0.00 H TER 17781 WAT 7025 ATOM 17781 O WAT 7026 29.277 88.302 118.363 1.00 0.00 O ATOM 17782 H1 WAT 7026 29.082 89.233 118.468 1.00 0.00 H ATOM 17783 H2 WAT 7026 28.994 88.097 117.472 1.00 0.00 H TER 17785 WAT 7026 ATOM 17785 O WAT 7027 44.999 145.499 78.529 1.00 0.00 O ATOM 17786 H1 WAT 7027 44.583 146.068 77.882 1.00 0.00 H ATOM 17787 H2 WAT 7027 45.905 145.420 78.231 1.00 0.00 H TER 17789 WAT 7027 ATOM 17789 O WAT 7028 136.301 85.900 6.860 1.00 0.00 O ATOM 17790 H1 WAT 7028 136.511 86.829 6.953 1.00 0.00 H ATOM 17791 H2 WAT 7028 135.359 85.850 7.021 1.00 0.00 H TER 17793 WAT 7028 ATOM 17793 O WAT 7029 86.462 96.244 13.561 1.00 0.00 O ATOM 17794 H1 WAT 7029 85.558 96.269 13.875 1.00 0.00 H ATOM 17795 H2 WAT 7029 86.588 97.088 13.128 1.00 0.00 H TER 17797 WAT 7029 ATOM 17797 O WAT 7030 109.839 68.456 150.013 1.00 0.00 O ATOM 17798 H1 WAT 7030 110.584 68.746 149.486 1.00 0.00 H ATOM 17799 H2 WAT 7030 109.306 67.938 149.409 1.00 0.00 H TER 17801 WAT 7030 ATOM 17801 O WAT 7031 95.761 45.909 85.821 1.00 0.00 O ATOM 17802 H1 WAT 7031 96.542 45.361 85.745 1.00 0.00 H ATOM 17803 H2 WAT 7031 95.956 46.679 85.286 1.00 0.00 H TER 17805 WAT 7031 ATOM 17805 O WAT 7032 112.774 137.739 63.177 1.00 0.00 O ATOM 17806 H1 WAT 7032 113.650 137.597 63.535 1.00 0.00 H ATOM 17807 H2 WAT 7032 112.260 138.054 63.920 1.00 0.00 H TER 17809 WAT 7032 ATOM 17809 O WAT 7033 29.973 68.272 86.753 1.00 0.00 O ATOM 17810 H1 WAT 7033 29.054 68.362 86.499 1.00 0.00 H ATOM 17811 H2 WAT 7033 30.333 69.154 86.667 1.00 0.00 H TER 17813 WAT 7033 ATOM 17813 O WAT 7034 71.557 64.690 7.154 1.00 0.00 O ATOM 17814 H1 WAT 7034 71.816 64.919 6.262 1.00 0.00 H ATOM 17815 H2 WAT 7034 72.382 64.497 7.600 1.00 0.00 H TER 17817 WAT 7034 ATOM 17817 O WAT 7035 73.885 140.354 9.382 1.00 0.00 O ATOM 17818 H1 WAT 7035 74.827 140.519 9.330 1.00 0.00 H ATOM 17819 H2 WAT 7035 73.652 140.025 8.514 1.00 0.00 H TER 17821 WAT 7035 ATOM 17821 O WAT 7036 141.916 104.213 65.715 1.00 0.00 O ATOM 17822 H1 WAT 7036 141.362 104.661 65.075 1.00 0.00 H ATOM 17823 H2 WAT 7036 142.515 103.687 65.186 1.00 0.00 H TER 17825 WAT 7036 ATOM 17825 O WAT 7037 45.538 101.714 57.872 1.00 0.00 O ATOM 17826 H1 WAT 7037 46.137 100.990 58.051 1.00 0.00 H ATOM 17827 H2 WAT 7037 44.666 101.320 57.916 1.00 0.00 H TER 17829 WAT 7037 ATOM 17829 O WAT 7038 11.311 118.050 68.393 1.00 0.00 O ATOM 17830 H1 WAT 7038 10.563 117.752 68.911 1.00 0.00 H ATOM 17831 H2 WAT 7038 11.111 118.963 68.187 1.00 0.00 H TER 17833 WAT 7038 ATOM 17833 O WAT 7039 96.173 46.612 68.036 1.00 0.00 O ATOM 17834 H1 WAT 7039 95.937 46.406 68.940 1.00 0.00 H ATOM 17835 H2 WAT 7039 95.519 46.153 67.508 1.00 0.00 H TER 17837 WAT 7039 ATOM 17837 O WAT 7040 102.856 25.818 131.105 1.00 0.00 O ATOM 17838 H1 WAT 7040 102.744 25.877 130.156 1.00 0.00 H ATOM 17839 H2 WAT 7040 101.990 26.015 131.461 1.00 0.00 H TER 17841 WAT 7040 ATOM 17841 O WAT 7041 35.449 121.621 91.033 1.00 0.00 O ATOM 17842 H1 WAT 7041 34.656 121.252 91.422 1.00 0.00 H ATOM 17843 H2 WAT 7041 35.792 120.921 90.478 1.00 0.00 H TER 17845 WAT 7041 ATOM 17845 O WAT 7042 119.599 35.933 60.052 1.00 0.00 O ATOM 17846 H1 WAT 7042 120.553 35.874 60.114 1.00 0.00 H ATOM 17847 H2 WAT 7042 119.309 35.027 59.946 1.00 0.00 H TER 17849 WAT 7042 ATOM 17849 O WAT 7043 68.873 22.902 56.751 1.00 0.00 O ATOM 17850 H1 WAT 7043 69.239 22.200 56.213 1.00 0.00 H ATOM 17851 H2 WAT 7043 67.925 22.788 56.682 1.00 0.00 H TER 17853 WAT 7043 ATOM 17853 O WAT 7044 118.145 67.127 149.166 1.00 0.00 O ATOM 17854 H1 WAT 7044 118.908 66.977 149.724 1.00 0.00 H ATOM 17855 H2 WAT 7044 118.324 67.961 148.734 1.00 0.00 H TER 17857 WAT 7044 ATOM 17857 O WAT 7045 95.498 43.057 108.395 1.00 0.00 O ATOM 17858 H1 WAT 7045 95.378 42.879 107.462 1.00 0.00 H ATOM 17859 H2 WAT 7045 95.455 44.010 108.465 1.00 0.00 H TER 17861 WAT 7045 ATOM 17861 O WAT 7046 80.590 94.000 141.884 1.00 0.00 O ATOM 17862 H1 WAT 7046 80.870 94.146 142.788 1.00 0.00 H ATOM 17863 H2 WAT 7046 81.153 93.292 141.570 1.00 0.00 H TER 17865 WAT 7046 ATOM 17865 O WAT 7047 79.723 28.727 97.618 1.00 0.00 O ATOM 17866 H1 WAT 7047 80.109 28.474 98.456 1.00 0.00 H ATOM 17867 H2 WAT 7047 79.368 27.913 97.262 1.00 0.00 H TER 17869 WAT 7047 ATOM 17869 O WAT 7048 59.001 45.966 117.422 1.00 0.00 O ATOM 17870 H1 WAT 7048 58.902 46.861 117.097 1.00 0.00 H ATOM 17871 H2 WAT 7048 59.934 45.777 117.321 1.00 0.00 H TER 17873 WAT 7048 ATOM 17873 O WAT 7049 144.817 38.831 142.023 1.00 0.00 O ATOM 17874 H1 WAT 7049 144.579 39.720 141.762 1.00 0.00 H ATOM 17875 H2 WAT 7049 145.113 38.415 141.214 1.00 0.00 H TER 17877 WAT 7049 ATOM 17877 O WAT 7050 35.592 97.568 69.551 1.00 0.00 O ATOM 17878 H1 WAT 7050 35.338 96.719 69.913 1.00 0.00 H ATOM 17879 H2 WAT 7050 35.588 97.435 68.603 1.00 0.00 H TER 17881 WAT 7050 ATOM 17881 O WAT 7051 136.365 48.029 102.821 1.00 0.00 O ATOM 17882 H1 WAT 7051 135.521 47.884 102.395 1.00 0.00 H ATOM 17883 H2 WAT 7051 136.528 48.967 102.718 1.00 0.00 H TER 17885 WAT 7051 ATOM 17885 O WAT 7052 77.475 56.710 95.695 1.00 0.00 O ATOM 17886 H1 WAT 7052 76.765 57.314 95.478 1.00 0.00 H ATOM 17887 H2 WAT 7052 77.156 56.230 96.459 1.00 0.00 H TER 17889 WAT 7052 ATOM 17889 O WAT 7053 69.188 8.524 133.123 1.00 0.00 O ATOM 17890 H1 WAT 7053 69.660 8.703 133.936 1.00 0.00 H ATOM 17891 H2 WAT 7053 68.529 9.216 133.070 1.00 0.00 H TER 17893 WAT 7053 ATOM 17893 O WAT 7054 24.723 45.016 123.555 1.00 0.00 O ATOM 17894 H1 WAT 7054 23.934 44.489 123.686 1.00 0.00 H ATOM 17895 H2 WAT 7054 24.554 45.504 122.749 1.00 0.00 H TER 17897 WAT 7054 ATOM 17897 O WAT 7055 37.711 36.496 0.185 1.00 0.00 O ATOM 17898 H1 WAT 7055 37.469 35.576 0.288 1.00 0.00 H ATOM 17899 H2 WAT 7055 38.273 36.681 0.938 1.00 0.00 H TER 17901 WAT 7055 ATOM 17901 O WAT 7056 65.606 121.348 111.543 1.00 0.00 O ATOM 17902 H1 WAT 7056 65.837 120.454 111.795 1.00 0.00 H ATOM 17903 H2 WAT 7056 66.253 121.896 111.986 1.00 0.00 H TER 17905 WAT 7056 ATOM 17905 O WAT 7057 67.282 10.031 54.174 1.00 0.00 O ATOM 17906 H1 WAT 7057 67.660 10.167 55.042 1.00 0.00 H ATOM 17907 H2 WAT 7057 67.674 9.213 53.868 1.00 0.00 H TER 17909 WAT 7057 ATOM 17909 O WAT 7058 11.332 32.583 103.672 1.00 0.00 O ATOM 17910 H1 WAT 7058 12.188 32.157 103.722 1.00 0.00 H ATOM 17911 H2 WAT 7058 10.711 31.862 103.574 1.00 0.00 H TER 17913 WAT 7058 ATOM 17913 O WAT 7059 35.245 82.249 84.966 1.00 0.00 O ATOM 17914 H1 WAT 7059 34.318 82.470 84.885 1.00 0.00 H ATOM 17915 H2 WAT 7059 35.269 81.552 85.622 1.00 0.00 H TER 17917 WAT 7059 ATOM 17917 O WAT 7060 136.583 66.228 59.117 1.00 0.00 O ATOM 17918 H1 WAT 7060 136.901 65.633 58.438 1.00 0.00 H ATOM 17919 H2 WAT 7060 136.885 67.092 58.839 1.00 0.00 H TER 17921 WAT 7060 ATOM 17921 O WAT 7061 8.246 65.139 123.322 1.00 0.00 O ATOM 17922 H1 WAT 7061 8.322 64.403 122.714 1.00 0.00 H ATOM 17923 H2 WAT 7061 8.279 64.737 124.190 1.00 0.00 H TER 17925 WAT 7061 ATOM 17925 O WAT 7062 74.615 12.583 81.155 1.00 0.00 O ATOM 17926 H1 WAT 7062 75.277 11.927 81.372 1.00 0.00 H ATOM 17927 H2 WAT 7062 74.624 12.626 80.199 1.00 0.00 H TER 17929 WAT 7062 ATOM 17929 O WAT 7063 38.980 92.783 96.028 1.00 0.00 O ATOM 17930 H1 WAT 7063 38.903 91.835 96.135 1.00 0.00 H ATOM 17931 H2 WAT 7063 39.445 92.894 95.199 1.00 0.00 H TER 17933 WAT 7063 ATOM 17933 O WAT 7064 74.191 92.473 128.217 1.00 0.00 O ATOM 17934 H1 WAT 7064 74.687 93.139 128.693 1.00 0.00 H ATOM 17935 H2 WAT 7064 73.333 92.871 128.071 1.00 0.00 H TER 17937 WAT 7064 ATOM 17937 O WAT 7065 46.338 47.645 127.960 1.00 0.00 O ATOM 17938 H1 WAT 7065 45.435 47.602 128.275 1.00 0.00 H ATOM 17939 H2 WAT 7065 46.258 47.671 127.006 1.00 0.00 H TER 17941 WAT 7065 ATOM 17941 O WAT 7066 26.390 54.131 71.883 1.00 0.00 O ATOM 17942 H1 WAT 7066 25.739 54.827 71.795 1.00 0.00 H ATOM 17943 H2 WAT 7066 26.725 54.227 72.775 1.00 0.00 H TER 17945 WAT 7066 ATOM 17945 O WAT 7067 143.742 93.994 107.205 1.00 0.00 O ATOM 17946 H1 WAT 7067 144.095 93.460 106.493 1.00 0.00 H ATOM 17947 H2 WAT 7067 143.186 93.393 107.702 1.00 0.00 H TER 17949 WAT 7067 ATOM 17949 O WAT 7068 108.070 0.426 17.333 1.00 0.00 O ATOM 17950 H1 WAT 7068 108.013 1.089 18.022 1.00 0.00 H ATOM 17951 H2 WAT 7068 108.991 0.164 17.329 1.00 0.00 H TER 17953 WAT 7068 ATOM 17953 O WAT 7069 130.960 134.573 19.579 1.00 0.00 O ATOM 17954 H1 WAT 7069 130.772 134.026 20.342 1.00 0.00 H ATOM 17955 H2 WAT 7069 130.510 135.398 19.759 1.00 0.00 H TER 17957 WAT 7069 ATOM 17957 O WAT 7070 47.574 79.144 12.175 1.00 0.00 O ATOM 17958 H1 WAT 7070 47.877 78.605 11.444 1.00 0.00 H ATOM 17959 H2 WAT 7070 48.372 79.378 12.648 1.00 0.00 H TER 17961 WAT 7070 ATOM 17961 O WAT 7071 43.296 120.400 67.704 1.00 0.00 O ATOM 17962 H1 WAT 7071 42.805 120.771 68.437 1.00 0.00 H ATOM 17963 H2 WAT 7071 42.653 119.879 67.223 1.00 0.00 H TER 17965 WAT 7071 ATOM 17965 O WAT 7072 116.138 74.347 138.361 1.00 0.00 O ATOM 17966 H1 WAT 7072 116.052 73.717 137.646 1.00 0.00 H ATOM 17967 H2 WAT 7072 115.811 75.169 137.996 1.00 0.00 H TER 17969 WAT 7072 ATOM 17969 O WAT 7073 128.709 85.566 77.692 1.00 0.00 O ATOM 17970 H1 WAT 7073 128.043 85.047 77.242 1.00 0.00 H ATOM 17971 H2 WAT 7073 128.911 85.065 78.482 1.00 0.00 H TER 17973 WAT 7073 ATOM 17973 O WAT 7074 65.786 12.971 16.433 1.00 0.00 O ATOM 17974 H1 WAT 7074 66.563 12.496 16.730 1.00 0.00 H ATOM 17975 H2 WAT 7074 65.132 12.806 17.112 1.00 0.00 H TER 17977 WAT 7074 ATOM 17977 O WAT 7075 77.928 78.897 23.235 1.00 0.00 O ATOM 17978 H1 WAT 7075 77.431 79.400 23.880 1.00 0.00 H ATOM 17979 H2 WAT 7075 78.745 78.676 23.681 1.00 0.00 H TER 17981 WAT 7075 ATOM 17981 O WAT 7076 26.223 31.240 83.285 1.00 0.00 O ATOM 17982 H1 WAT 7076 27.085 31.317 82.875 1.00 0.00 H ATOM 17983 H2 WAT 7076 26.410 31.159 84.221 1.00 0.00 H TER 17985 WAT 7076 ATOM 17985 O WAT 7077 62.392 130.259 142.638 1.00 0.00 O ATOM 17986 H1 WAT 7077 63.303 130.073 142.411 1.00 0.00 H ATOM 17987 H2 WAT 7077 62.004 130.586 141.826 1.00 0.00 H TER 17989 WAT 7077 ATOM 17989 O WAT 7078 107.230 49.807 1.473 1.00 0.00 O ATOM 17990 H1 WAT 7078 106.957 50.246 2.279 1.00 0.00 H ATOM 17991 H2 WAT 7078 107.618 50.502 0.941 1.00 0.00 H TER 17993 WAT 7078 ATOM 17993 O WAT 7079 96.314 1.680 5.162 1.00 0.00 O ATOM 17994 H1 WAT 7079 95.708 2.217 4.653 1.00 0.00 H ATOM 17995 H2 WAT 7079 97.055 1.532 4.575 1.00 0.00 H TER 17997 WAT 7079 ATOM 17997 O WAT 7080 114.524 22.796 144.897 1.00 0.00 O ATOM 17998 H1 WAT 7080 113.592 22.599 144.986 1.00 0.00 H ATOM 17999 H2 WAT 7080 114.763 22.441 144.041 1.00 0.00 H TER 18001 WAT 7080 ATOM 18001 O WAT 7081 133.699 144.094 88.224 1.00 0.00 O ATOM 18002 H1 WAT 7081 133.729 143.274 87.731 1.00 0.00 H ATOM 18003 H2 WAT 7081 134.575 144.466 88.124 1.00 0.00 H TER 18005 WAT 7081 ATOM 18005 O WAT 7082 135.094 123.587 86.875 1.00 0.00 O ATOM 18006 H1 WAT 7082 134.362 124.184 86.719 1.00 0.00 H ATOM 18007 H2 WAT 7082 134.922 122.842 86.299 1.00 0.00 H TER 18009 WAT 7082 ATOM 18009 O WAT 7083 80.881 123.533 78.819 1.00 0.00 O ATOM 18010 H1 WAT 7083 80.721 124.196 78.147 1.00 0.00 H ATOM 18011 H2 WAT 7083 81.440 122.886 78.388 1.00 0.00 H TER 18013 WAT 7083 ATOM 18013 O WAT 7084 41.929 132.613 108.611 1.00 0.00 O ATOM 18014 H1 WAT 7084 41.440 132.431 109.413 1.00 0.00 H ATOM 18015 H2 WAT 7084 41.753 131.859 108.047 1.00 0.00 H TER 18017 WAT 7084 ATOM 18017 O WAT 7085 102.501 102.988 72.013 1.00 0.00 O ATOM 18018 H1 WAT 7085 101.807 102.724 72.616 1.00 0.00 H ATOM 18019 H2 WAT 7085 103.009 102.190 71.868 1.00 0.00 H TER 18021 WAT 7085 ATOM 18021 O WAT 7086 143.508 102.729 96.732 1.00 0.00 O ATOM 18022 H1 WAT 7086 143.903 101.878 96.541 1.00 0.00 H ATOM 18023 H2 WAT 7086 142.591 102.630 96.477 1.00 0.00 H TER 18025 WAT 7086 ATOM 18025 O WAT 7087 125.489 89.710 11.897 1.00 0.00 O ATOM 18026 H1 WAT 7087 126.350 89.335 12.082 1.00 0.00 H ATOM 18027 H2 WAT 7087 125.155 89.977 12.753 1.00 0.00 H TER 18029 WAT 7087 ATOM 18029 O WAT 7088 113.379 118.978 134.788 1.00 0.00 O ATOM 18030 H1 WAT 7088 112.561 118.682 135.190 1.00 0.00 H ATOM 18031 H2 WAT 7088 113.849 118.171 134.580 1.00 0.00 H TER 18033 WAT 7088 ATOM 18033 O WAT 7089 134.909 58.409 2.463 1.00 0.00 O ATOM 18034 H1 WAT 7089 135.742 58.165 2.059 1.00 0.00 H ATOM 18035 H2 WAT 7089 134.441 57.580 2.566 1.00 0.00 H TER 18037 WAT 7089 ATOM 18037 O WAT 7090 102.527 41.019 74.570 1.00 0.00 O ATOM 18038 H1 WAT 7090 102.504 40.922 73.618 1.00 0.00 H ATOM 18039 H2 WAT 7090 101.914 41.731 74.753 1.00 0.00 H TER 18041 WAT 7090 ATOM 18041 O WAT 7091 105.202 129.605 150.751 1.00 0.00 O ATOM 18042 H1 WAT 7091 105.499 129.136 149.972 1.00 0.00 H ATOM 18043 H2 WAT 7091 104.273 129.384 150.825 1.00 0.00 H TER 18045 WAT 7091 ATOM 18045 O WAT 7092 118.862 99.524 84.753 1.00 0.00 O ATOM 18046 H1 WAT 7092 119.730 99.868 84.540 1.00 0.00 H ATOM 18047 H2 WAT 7092 118.281 99.923 84.106 1.00 0.00 H TER 18049 WAT 7092 ATOM 18049 O WAT 7093 18.551 6.523 119.458 1.00 0.00 O ATOM 18050 H1 WAT 7093 17.885 6.205 120.069 1.00 0.00 H ATOM 18051 H2 WAT 7093 19.317 6.690 120.006 1.00 0.00 H TER 18053 WAT 7093 ATOM 18053 O WAT 7094 55.010 21.763 3.933 1.00 0.00 O ATOM 18054 H1 WAT 7094 55.852 21.693 3.484 1.00 0.00 H ATOM 18055 H2 WAT 7094 55.239 21.874 4.856 1.00 0.00 H TER 18057 WAT 7094 ATOM 18057 O WAT 7095 36.971 46.808 139.879 1.00 0.00 O ATOM 18058 H1 WAT 7095 37.204 47.648 140.274 1.00 0.00 H ATOM 18059 H2 WAT 7095 37.381 46.154 140.447 1.00 0.00 H TER 18061 WAT 7095 ATOM 18061 O WAT 7096 23.171 82.708 157.229 1.00 0.00 O ATOM 18062 H1 WAT 7096 22.940 83.306 157.940 1.00 0.00 H ATOM 18063 H2 WAT 7096 23.042 83.221 156.432 1.00 0.00 H TER 18065 WAT 7096 ATOM 18065 O WAT 7097 51.986 5.049 11.793 1.00 0.00 O ATOM 18066 H1 WAT 7097 52.621 5.753 11.659 1.00 0.00 H ATOM 18067 H2 WAT 7097 51.134 5.467 11.666 1.00 0.00 H TER 18069 WAT 7097 ATOM 18069 O WAT 7098 54.883 132.661 132.237 1.00 0.00 O ATOM 18070 H1 WAT 7098 54.747 131.714 132.282 1.00 0.00 H ATOM 18071 H2 WAT 7098 55.327 132.799 131.400 1.00 0.00 H TER 18073 WAT 7098 ATOM 18073 O WAT 7099 145.893 83.822 129.760 1.00 0.00 O ATOM 18074 H1 WAT 7099 146.337 84.670 129.735 1.00 0.00 H ATOM 18075 H2 WAT 7099 144.966 84.039 129.859 1.00 0.00 H TER 18077 WAT 7099 ATOM 18077 O WAT 7100 18.834 58.765 144.652 1.00 0.00 O ATOM 18078 H1 WAT 7100 19.598 58.403 144.205 1.00 0.00 H ATOM 18079 H2 WAT 7100 18.283 58.004 144.838 1.00 0.00 H TER 18081 WAT 7100 ATOM 18081 O WAT 7101 51.452 103.296 20.217 1.00 0.00 O ATOM 18082 H1 WAT 7101 50.711 103.350 20.821 1.00 0.00 H ATOM 18083 H2 WAT 7101 51.948 104.100 20.375 1.00 0.00 H TER 18085 WAT 7101 ATOM 18085 O WAT 7102 117.453 75.220 122.601 1.00 0.00 O ATOM 18086 H1 WAT 7102 117.181 74.476 122.063 1.00 0.00 H ATOM 18087 H2 WAT 7102 117.131 75.988 122.129 1.00 0.00 H TER 18089 WAT 7102 ATOM 18089 O WAT 7103 40.649 50.337 3.243 1.00 0.00 O ATOM 18090 H1 WAT 7103 41.110 50.208 4.072 1.00 0.00 H ATOM 18091 H2 WAT 7103 41.038 49.695 2.650 1.00 0.00 H TER 18093 WAT 7103 ATOM 18093 O WAT 7104 117.654 135.596 102.699 1.00 0.00 O ATOM 18094 H1 WAT 7104 118.001 134.852 103.190 1.00 0.00 H ATOM 18095 H2 WAT 7104 116.820 135.285 102.348 1.00 0.00 H TER 18097 WAT 7104 ATOM 18097 O WAT 7105 41.213 69.655 109.426 1.00 0.00 O ATOM 18098 H1 WAT 7105 41.382 68.795 109.811 1.00 0.00 H ATOM 18099 H2 WAT 7105 42.020 69.873 108.961 1.00 0.00 H TER 18101 WAT 7105 ATOM 18101 O WAT 7106 134.184 119.954 71.508 1.00 0.00 O ATOM 18102 H1 WAT 7106 133.426 120.404 71.136 1.00 0.00 H ATOM 18103 H2 WAT 7106 133.915 119.037 71.562 1.00 0.00 H TER 18105 WAT 7106 ATOM 18105 O WAT 7107 112.964 139.674 67.821 1.00 0.00 O ATOM 18106 H1 WAT 7107 113.347 139.593 66.947 1.00 0.00 H ATOM 18107 H2 WAT 7107 112.135 140.130 67.678 1.00 0.00 H TER 18109 WAT 7107 ATOM 18109 O WAT 7108 10.926 27.938 147.240 1.00 0.00 O ATOM 18110 H1 WAT 7108 10.526 28.699 147.661 1.00 0.00 H ATOM 18111 H2 WAT 7108 11.775 27.843 147.671 1.00 0.00 H TER 18113 WAT 7108 ATOM 18113 O WAT 7109 95.935 14.652 60.399 1.00 0.00 O ATOM 18114 H1 WAT 7109 96.024 15.507 60.822 1.00 0.00 H ATOM 18115 H2 WAT 7109 95.017 14.416 60.528 1.00 0.00 H TER 18117 WAT 7109 ATOM 18117 O WAT 7110 68.805 120.420 127.664 1.00 0.00 O ATOM 18118 H1 WAT 7110 69.415 119.780 128.031 1.00 0.00 H ATOM 18119 H2 WAT 7110 67.958 120.190 128.046 1.00 0.00 H TER 18121 WAT 7110 ATOM 18121 O WAT 7111 11.679 80.294 151.500 1.00 0.00 O ATOM 18122 H1 WAT 7111 11.548 80.572 152.406 1.00 0.00 H ATOM 18123 H2 WAT 7111 12.055 81.061 151.067 1.00 0.00 H TER 18125 WAT 7111 ATOM 18125 O WAT 7112 21.317 68.579 75.447 1.00 0.00 O ATOM 18126 H1 WAT 7112 20.799 68.400 74.663 1.00 0.00 H ATOM 18127 H2 WAT 7112 21.988 69.196 75.156 1.00 0.00 H TER 18129 WAT 7112 ATOM 18129 O WAT 7113 42.474 139.959 151.876 1.00 0.00 O ATOM 18130 H1 WAT 7113 41.967 140.216 151.106 1.00 0.00 H ATOM 18131 H2 WAT 7113 42.331 140.667 152.504 1.00 0.00 H TER 18133 WAT 7113 ATOM 18133 O WAT 7114 57.252 97.184 102.603 1.00 0.00 O ATOM 18134 H1 WAT 7114 56.736 97.358 103.389 1.00 0.00 H ATOM 18135 H2 WAT 7114 56.879 97.763 101.938 1.00 0.00 H TER 18137 WAT 7114 ATOM 18137 O WAT 7115 45.688 80.802 76.104 1.00 0.00 O ATOM 18138 H1 WAT 7115 44.737 80.725 76.185 1.00 0.00 H ATOM 18139 H2 WAT 7115 45.951 80.025 75.612 1.00 0.00 H TER 18141 WAT 7115 ATOM 18141 O WAT 7116 143.585 49.058 24.082 1.00 0.00 O ATOM 18142 H1 WAT 7116 143.409 48.322 23.496 1.00 0.00 H ATOM 18143 H2 WAT 7116 142.754 49.532 24.127 1.00 0.00 H TER 18145 WAT 7116 ATOM 18145 O WAT 7117 61.169 103.533 100.921 1.00 0.00 O ATOM 18146 H1 WAT 7117 61.119 104.463 100.699 1.00 0.00 H ATOM 18147 H2 WAT 7117 60.353 103.162 100.584 1.00 0.00 H TER 18149 WAT 7117 ATOM 18149 O WAT 7118 137.058 57.175 98.941 1.00 0.00 O ATOM 18150 H1 WAT 7118 137.076 58.131 98.980 1.00 0.00 H ATOM 18151 H2 WAT 7118 136.704 56.908 99.789 1.00 0.00 H TER 18153 WAT 7118 ATOM 18153 O WAT 7119 2.080 32.930 132.981 1.00 0.00 O ATOM 18154 H1 WAT 7119 1.329 32.352 133.116 1.00 0.00 H ATOM 18155 H2 WAT 7119 2.363 32.749 132.085 1.00 0.00 H TER 18157 WAT 7119 ATOM 18157 O WAT 7120 24.852 4.082 109.951 1.00 0.00 O ATOM 18158 H1 WAT 7120 25.403 4.622 109.385 1.00 0.00 H ATOM 18159 H2 WAT 7120 25.464 3.674 110.564 1.00 0.00 H TER 18161 WAT 7120 ATOM 18161 O WAT 7121 114.738 109.383 86.091 1.00 0.00 O ATOM 18162 H1 WAT 7121 114.056 110.015 86.318 1.00 0.00 H ATOM 18163 H2 WAT 7121 114.627 109.236 85.152 1.00 0.00 H TER 18165 WAT 7121 ATOM 18165 O WAT 7122 2.898 91.834 6.607 1.00 0.00 O ATOM 18166 H1 WAT 7122 2.250 92.339 6.116 1.00 0.00 H ATOM 18167 H2 WAT 7122 2.593 91.869 7.513 1.00 0.00 H TER 18169 WAT 7122 ATOM 18169 O WAT 7123 88.725 111.885 102.169 1.00 0.00 O ATOM 18170 H1 WAT 7123 89.546 111.839 102.658 1.00 0.00 H ATOM 18171 H2 WAT 7123 88.631 111.017 101.776 1.00 0.00 H TER 18173 WAT 7123 ATOM 18173 O WAT 7124 133.800 89.998 31.495 1.00 0.00 O ATOM 18174 H1 WAT 7124 134.108 90.181 30.608 1.00 0.00 H ATOM 18175 H2 WAT 7124 134.269 89.204 31.752 1.00 0.00 H TER 18177 WAT 7124 ATOM 18177 O WAT 7125 67.439 143.279 103.588 1.00 0.00 O ATOM 18178 H1 WAT 7125 67.595 143.775 104.392 1.00 0.00 H ATOM 18179 H2 WAT 7125 66.490 143.314 103.466 1.00 0.00 H TER 18181 WAT 7125 ATOM 18181 O WAT 7126 0.473 135.568 139.150 1.00 0.00 O ATOM 18182 H1 WAT 7126 0.440 134.651 139.424 1.00 0.00 H ATOM 18183 H2 WAT 7126 0.722 136.045 139.941 1.00 0.00 H TER 18185 WAT 7126 ATOM 18185 O WAT 7127 5.493 87.616 134.357 1.00 0.00 O ATOM 18186 H1 WAT 7127 5.867 86.936 133.797 1.00 0.00 H ATOM 18187 H2 WAT 7127 6.093 88.357 134.269 1.00 0.00 H TER 18189 WAT 7127 ATOM 18189 O WAT 7128 91.950 22.703 73.611 1.00 0.00 O ATOM 18190 H1 WAT 7128 91.798 21.921 74.142 1.00 0.00 H ATOM 18191 H2 WAT 7128 91.073 23.018 73.393 1.00 0.00 H TER 18193 WAT 7128 ATOM 18193 O WAT 7129 126.991 128.633 79.640 1.00 0.00 O ATOM 18194 H1 WAT 7129 127.629 128.544 78.933 1.00 0.00 H ATOM 18195 H2 WAT 7129 127.229 127.948 80.265 1.00 0.00 H TER 18197 WAT 7129 ATOM 18197 O WAT 7130 5.259 139.121 11.042 1.00 0.00 O ATOM 18198 H1 WAT 7130 4.374 139.387 11.291 1.00 0.00 H ATOM 18199 H2 WAT 7130 5.758 139.938 11.023 1.00 0.00 H TER 18201 WAT 7130 ATOM 18201 O WAT 7131 50.872 47.430 10.198 1.00 0.00 O ATOM 18202 H1 WAT 7131 50.957 47.694 9.282 1.00 0.00 H ATOM 18203 H2 WAT 7131 50.568 48.219 10.647 1.00 0.00 H TER 18205 WAT 7131 ATOM 18205 O WAT 7132 95.906 15.205 94.170 1.00 0.00 O ATOM 18206 H1 WAT 7132 96.696 14.722 94.412 1.00 0.00 H ATOM 18207 H2 WAT 7132 95.335 15.128 94.935 1.00 0.00 H TER 18209 WAT 7132 ATOM 18209 O WAT 7133 14.478 13.684 138.312 1.00 0.00 O ATOM 18210 H1 WAT 7133 14.656 13.499 139.234 1.00 0.00 H ATOM 18211 H2 WAT 7133 14.185 14.595 138.302 1.00 0.00 H TER 18213 WAT 7133 ATOM 18213 O WAT 7134 93.695 46.683 21.109 1.00 0.00 O ATOM 18214 H1 WAT 7134 94.214 47.487 21.097 1.00 0.00 H ATOM 18215 H2 WAT 7134 94.311 46.004 21.382 1.00 0.00 H TER 18217 WAT 7134 ATOM 18217 O WAT 7135 47.500 97.155 5.807 1.00 0.00 O ATOM 18218 H1 WAT 7135 48.010 96.899 5.038 1.00 0.00 H ATOM 18219 H2 WAT 7135 48.017 97.848 6.217 1.00 0.00 H TER 18221 WAT 7135 ATOM 18221 O WAT 7136 20.241 113.011 3.460 1.00 0.00 O ATOM 18222 H1 WAT 7136 19.926 113.094 2.560 1.00 0.00 H ATOM 18223 H2 WAT 7136 20.606 112.127 3.506 1.00 0.00 H TER 18225 WAT 7136 ATOM 18225 O WAT 7137 60.450 141.875 81.138 1.00 0.00 O ATOM 18226 H1 WAT 7137 61.105 142.438 81.550 1.00 0.00 H ATOM 18227 H2 WAT 7137 60.306 142.266 80.276 1.00 0.00 H TER 18229 WAT 7137 ATOM 18229 O WAT 7138 145.167 74.244 55.770 1.00 0.00 O ATOM 18230 H1 WAT 7138 144.799 74.443 54.909 1.00 0.00 H ATOM 18231 H2 WAT 7138 144.404 74.125 56.336 1.00 0.00 H TER 18233 WAT 7138 ATOM 18233 O WAT 7139 107.163 16.469 130.685 1.00 0.00 O ATOM 18234 H1 WAT 7139 106.386 16.124 131.123 1.00 0.00 H ATOM 18235 H2 WAT 7139 107.820 15.781 130.785 1.00 0.00 H TER 18237 WAT 7139 ATOM 18237 O WAT 7140 105.454 51.342 81.927 1.00 0.00 O ATOM 18238 H1 WAT 7140 105.656 51.680 81.054 1.00 0.00 H ATOM 18239 H2 WAT 7140 105.813 51.996 82.527 1.00 0.00 H TER 18241 WAT 7140 ATOM 18241 O WAT 7141 89.737 133.661 9.954 1.00 0.00 O ATOM 18242 H1 WAT 7141 89.823 133.137 10.749 1.00 0.00 H ATOM 18243 H2 WAT 7141 90.632 133.744 9.624 1.00 0.00 H TER 18245 WAT 7141 ATOM 18245 O WAT 7142 125.253 103.419 68.062 1.00 0.00 O ATOM 18246 H1 WAT 7142 125.856 104.146 68.218 1.00 0.00 H ATOM 18247 H2 WAT 7142 124.456 103.835 67.735 1.00 0.00 H TER 18249 WAT 7142 ATOM 18249 O WAT 7143 47.120 51.690 83.583 1.00 0.00 O ATOM 18250 H1 WAT 7143 47.515 51.905 84.428 1.00 0.00 H ATOM 18251 H2 WAT 7143 46.368 51.141 83.803 1.00 0.00 H TER 18253 WAT 7143 ATOM 18253 O WAT 7144 134.912 114.058 76.651 1.00 0.00 O ATOM 18254 H1 WAT 7144 134.384 113.600 77.305 1.00 0.00 H ATOM 18255 H2 WAT 7144 134.730 114.986 76.804 1.00 0.00 H TER 18257 WAT 7144 ATOM 18257 O WAT 7145 44.422 48.697 136.109 1.00 0.00 O ATOM 18258 H1 WAT 7145 44.265 48.925 135.193 1.00 0.00 H ATOM 18259 H2 WAT 7145 44.515 47.744 136.106 1.00 0.00 H TER 18261 WAT 7145 ATOM 18261 O WAT 7146 24.703 138.280 14.394 1.00 0.00 O ATOM 18262 H1 WAT 7146 24.066 138.992 14.341 1.00 0.00 H ATOM 18263 H2 WAT 7146 24.554 137.765 13.601 1.00 0.00 H TER 18265 WAT 7146 ATOM 18265 O WAT 7147 102.250 105.027 24.715 1.00 0.00 O ATOM 18266 H1 WAT 7147 102.170 105.179 25.656 1.00 0.00 H ATOM 18267 H2 WAT 7147 101.411 105.315 24.354 1.00 0.00 H TER 18269 WAT 7147 ATOM 18269 O WAT 7148 0.817 103.475 18.188 1.00 0.00 O ATOM 18270 H1 WAT 7148 1.008 104.080 17.471 1.00 0.00 H ATOM 18271 H2 WAT 7148 0.150 102.887 17.834 1.00 0.00 H TER 18273 WAT 7148 ATOM 18273 O WAT 7149 13.962 132.156 109.782 1.00 0.00 O ATOM 18274 H1 WAT 7149 13.359 132.014 110.512 1.00 0.00 H ATOM 18275 H2 WAT 7149 13.631 132.943 109.348 1.00 0.00 H TER 18277 WAT 7149 ATOM 18277 O WAT 7150 122.191 138.618 60.258 1.00 0.00 O ATOM 18278 H1 WAT 7150 122.688 137.841 60.003 1.00 0.00 H ATOM 18279 H2 WAT 7150 121.808 138.936 59.440 1.00 0.00 H TER 18281 WAT 7150 ATOM 18281 O WAT 7151 77.849 131.420 144.317 1.00 0.00 O ATOM 18282 H1 WAT 7151 77.364 131.976 143.707 1.00 0.00 H ATOM 18283 H2 WAT 7151 78.154 132.020 144.997 1.00 0.00 H TER 18285 WAT 7151 ATOM 18285 O WAT 7152 106.246 132.865 118.272 1.00 0.00 O ATOM 18286 H1 WAT 7152 106.826 132.989 117.521 1.00 0.00 H ATOM 18287 H2 WAT 7152 105.751 133.682 118.330 1.00 0.00 H TER 18289 WAT 7152 ATOM 18289 O WAT 7153 90.286 5.761 106.788 1.00 0.00 O ATOM 18290 H1 WAT 7153 90.462 6.356 106.058 1.00 0.00 H ATOM 18291 H2 WAT 7153 91.044 5.858 107.364 1.00 0.00 H TER 18293 WAT 7153 ATOM 18293 O WAT 7154 39.275 0.120 86.210 1.00 0.00 O ATOM 18294 H1 WAT 7154 40.121 0.189 86.652 1.00 0.00 H ATOM 18295 H2 WAT 7154 38.725 0.774 86.642 1.00 0.00 H TER 18297 WAT 7154 ATOM 18297 O WAT 7155 105.921 37.174 60.262 1.00 0.00 O ATOM 18298 H1 WAT 7155 105.228 36.622 60.625 1.00 0.00 H ATOM 18299 H2 WAT 7155 105.668 37.306 59.348 1.00 0.00 H TER 18301 WAT 7155 ATOM 18301 O WAT 7156 84.967 62.370 126.684 1.00 0.00 O ATOM 18302 H1 WAT 7156 85.452 61.608 127.003 1.00 0.00 H ATOM 18303 H2 WAT 7156 85.645 62.989 126.413 1.00 0.00 H TER 18305 WAT 7156 ATOM 18305 O WAT 7157 17.973 67.198 78.339 1.00 0.00 O ATOM 18306 H1 WAT 7157 18.144 67.060 79.271 1.00 0.00 H ATOM 18307 H2 WAT 7157 17.223 67.792 78.319 1.00 0.00 H TER 18309 WAT 7157 ATOM 18309 O WAT 7158 41.580 82.054 150.036 1.00 0.00 O ATOM 18310 H1 WAT 7158 42.041 81.220 149.943 1.00 0.00 H ATOM 18311 H2 WAT 7158 40.738 81.912 149.603 1.00 0.00 H TER 18313 WAT 7158 ATOM 18313 O WAT 7159 28.839 116.252 82.747 1.00 0.00 O ATOM 18314 H1 WAT 7159 28.637 115.329 82.594 1.00 0.00 H ATOM 18315 H2 WAT 7159 28.568 116.693 81.942 1.00 0.00 H TER 18317 WAT 7159 ATOM 18317 O WAT 7160 21.267 32.413 62.014 1.00 0.00 O ATOM 18318 H1 WAT 7160 21.746 33.044 62.551 1.00 0.00 H ATOM 18319 H2 WAT 7160 21.884 31.693 61.881 1.00 0.00 H TER 18321 WAT 7160 ATOM 18321 O WAT 7161 2.121 143.920 127.989 1.00 0.00 O ATOM 18322 H1 WAT 7161 2.492 144.591 127.416 1.00 0.00 H ATOM 18323 H2 WAT 7161 2.761 143.209 127.971 1.00 0.00 H TER 18325 WAT 7161 ATOM 18325 O WAT 7162 101.129 27.683 110.637 1.00 0.00 O ATOM 18326 H1 WAT 7162 101.669 27.518 109.864 1.00 0.00 H ATOM 18327 H2 WAT 7162 100.816 28.580 110.524 1.00 0.00 H TER 18329 WAT 7162 ATOM 18329 O WAT 7163 88.663 17.286 129.835 1.00 0.00 O ATOM 18330 H1 WAT 7163 88.239 16.568 130.305 1.00 0.00 H ATOM 18331 H2 WAT 7163 88.121 18.051 130.027 1.00 0.00 H TER 18333 WAT 7163 ATOM 18333 O WAT 7164 123.251 34.884 90.630 1.00 0.00 O ATOM 18334 H1 WAT 7164 122.959 35.362 91.406 1.00 0.00 H ATOM 18335 H2 WAT 7164 123.976 35.406 90.287 1.00 0.00 H TER 18337 WAT 7164 ATOM 18337 O WAT 7165 105.422 9.360 157.579 1.00 0.00 O ATOM 18338 H1 WAT 7165 105.076 9.650 158.423 1.00 0.00 H ATOM 18339 H2 WAT 7165 106.347 9.604 157.602 1.00 0.00 H TER 18341 WAT 7165 ATOM 18341 O WAT 7166 137.848 66.919 54.226 1.00 0.00 O ATOM 18342 H1 WAT 7166 137.189 66.268 54.465 1.00 0.00 H ATOM 18343 H2 WAT 7166 138.674 66.548 54.536 1.00 0.00 H TER 18345 WAT 7166 ATOM 18345 O WAT 7167 89.629 47.299 116.269 1.00 0.00 O ATOM 18346 H1 WAT 7167 90.146 46.682 115.751 1.00 0.00 H ATOM 18347 H2 WAT 7167 90.222 48.032 116.432 1.00 0.00 H TER 18349 WAT 7167 ATOM 18349 O WAT 7168 106.754 22.126 127.486 1.00 0.00 O ATOM 18350 H1 WAT 7168 106.001 21.964 128.055 1.00 0.00 H ATOM 18351 H2 WAT 7168 106.411 22.686 126.789 1.00 0.00 H TER 18353 WAT 7168 ATOM 18353 O WAT 7169 58.009 6.931 126.238 1.00 0.00 O ATOM 18354 H1 WAT 7169 58.731 7.493 126.519 1.00 0.00 H ATOM 18355 H2 WAT 7169 58.015 6.204 126.860 1.00 0.00 H TER 18357 WAT 7169 ATOM 18357 O WAT 7170 74.248 5.205 59.543 1.00 0.00 O ATOM 18358 H1 WAT 7170 75.139 4.899 59.373 1.00 0.00 H ATOM 18359 H2 WAT 7170 74.293 5.605 60.412 1.00 0.00 H TER 18361 WAT 7170 ATOM 18361 O WAT 7171 12.652 23.627 84.232 1.00 0.00 O ATOM 18362 H1 WAT 7171 13.022 23.695 85.113 1.00 0.00 H ATOM 18363 H2 WAT 7171 12.299 22.739 84.189 1.00 0.00 H TER 18365 WAT 7171 ATOM 18365 O WAT 7172 43.319 16.268 108.953 1.00 0.00 O ATOM 18366 H1 WAT 7172 43.365 15.546 108.327 1.00 0.00 H ATOM 18367 H2 WAT 7172 43.148 15.845 109.795 1.00 0.00 H TER 18369 WAT 7172 ATOM 18369 O WAT 7173 58.789 80.785 76.345 1.00 0.00 O ATOM 18370 H1 WAT 7173 58.042 80.938 76.924 1.00 0.00 H ATOM 18371 H2 WAT 7173 58.519 81.153 75.504 1.00 0.00 H TER 18373 WAT 7173 ATOM 18373 O WAT 7174 46.502 1.565 107.219 1.00 0.00 O ATOM 18374 H1 WAT 7174 46.921 0.890 107.753 1.00 0.00 H ATOM 18375 H2 WAT 7174 45.938 2.039 107.831 1.00 0.00 H TER 18377 WAT 7174 ATOM 18377 O WAT 7175 107.335 67.064 153.454 1.00 0.00 O ATOM 18378 H1 WAT 7175 107.853 66.495 152.885 1.00 0.00 H ATOM 18379 H2 WAT 7175 107.980 67.626 153.883 1.00 0.00 H TER 18381 WAT 7175 ATOM 18381 O WAT 7176 111.316 56.661 80.274 1.00 0.00 O ATOM 18382 H1 WAT 7176 111.669 56.141 80.996 1.00 0.00 H ATOM 18383 H2 WAT 7176 111.199 57.536 80.645 1.00 0.00 H TER 18385 WAT 7176 ATOM 18385 O WAT 7177 36.288 39.081 58.910 1.00 0.00 O ATOM 18386 H1 WAT 7177 36.970 39.276 59.552 1.00 0.00 H ATOM 18387 H2 WAT 7177 35.534 39.597 59.197 1.00 0.00 H TER 18389 WAT 7177 ATOM 18389 O WAT 7178 83.727 124.881 149.029 1.00 0.00 O ATOM 18390 H1 WAT 7178 83.720 125.540 149.722 1.00 0.00 H ATOM 18391 H2 WAT 7178 83.454 125.355 148.244 1.00 0.00 H TER 18393 WAT 7178 ATOM 18393 O WAT 7179 82.940 60.139 85.002 1.00 0.00 O ATOM 18394 H1 WAT 7179 83.237 60.741 85.684 1.00 0.00 H ATOM 18395 H2 WAT 7179 83.528 60.304 84.264 1.00 0.00 H TER 18397 WAT 7179 ATOM 18397 O WAT 7180 83.467 111.030 6.771 1.00 0.00 O ATOM 18398 H1 WAT 7180 82.534 111.204 6.650 1.00 0.00 H ATOM 18399 H2 WAT 7180 83.652 110.294 6.188 1.00 0.00 H TER 18401 WAT 7180 ATOM 18401 O WAT 7181 127.653 86.068 111.090 1.00 0.00 O ATOM 18402 H1 WAT 7181 127.769 85.118 111.076 1.00 0.00 H ATOM 18403 H2 WAT 7181 126.848 86.204 111.589 1.00 0.00 H TER 18405 WAT 7181 ATOM 18405 O WAT 7182 77.015 76.793 96.277 1.00 0.00 O ATOM 18406 H1 WAT 7182 77.002 75.893 96.602 1.00 0.00 H ATOM 18407 H2 WAT 7182 77.941 77.038 96.286 1.00 0.00 H TER 18409 WAT 7182 ATOM 18409 O WAT 7183 0.508 38.207 93.392 1.00 0.00 O ATOM 18410 H1 WAT 7183 -0.405 38.420 93.587 1.00 0.00 H ATOM 18411 H2 WAT 7183 0.509 37.987 92.461 1.00 0.00 H TER 18413 WAT 7183 ATOM 18413 O WAT 7184 144.346 123.189 105.965 1.00 0.00 O ATOM 18414 H1 WAT 7184 145.281 123.003 106.052 1.00 0.00 H ATOM 18415 H2 WAT 7184 144.311 124.079 105.614 1.00 0.00 H TER 18417 WAT 7184 ATOM 18417 O WAT 7185 52.877 95.721 89.137 1.00 0.00 O ATOM 18418 H1 WAT 7185 52.978 95.126 88.394 1.00 0.00 H ATOM 18419 H2 WAT 7185 51.945 95.937 89.146 1.00 0.00 H TER 18421 WAT 7185 ATOM 18421 O WAT 7186 51.056 49.893 99.826 1.00 0.00 O ATOM 18422 H1 WAT 7186 51.179 50.831 99.682 1.00 0.00 H ATOM 18423 H2 WAT 7186 51.141 49.784 100.774 1.00 0.00 H TER 18425 WAT 7186 ATOM 18425 O WAT 7187 113.181 34.501 4.320 1.00 0.00 O ATOM 18426 H1 WAT 7187 113.394 34.346 3.400 1.00 0.00 H ATOM 18427 H2 WAT 7187 114.029 34.637 4.743 1.00 0.00 H TER 18429 WAT 7187 ATOM 18429 O WAT 7188 97.501 123.307 17.920 1.00 0.00 O ATOM 18430 H1 WAT 7188 96.874 123.707 18.523 1.00 0.00 H ATOM 18431 H2 WAT 7188 97.802 122.520 18.373 1.00 0.00 H TER 18433 WAT 7188 ATOM 18433 O WAT 7189 66.093 23.442 134.794 1.00 0.00 O ATOM 18434 H1 WAT 7189 65.261 23.302 134.342 1.00 0.00 H ATOM 18435 H2 WAT 7189 66.712 23.655 134.096 1.00 0.00 H TER 18437 WAT 7189 ATOM 18437 O WAT 7190 88.046 111.628 98.322 1.00 0.00 O ATOM 18438 H1 WAT 7190 88.632 112.385 98.317 1.00 0.00 H ATOM 18439 H2 WAT 7190 88.005 111.352 97.406 1.00 0.00 H TER 18441 WAT 7190 ATOM 18441 O WAT 7191 11.786 96.943 114.633 1.00 0.00 O ATOM 18442 H1 WAT 7191 12.472 97.567 114.872 1.00 0.00 H ATOM 18443 H2 WAT 7191 12.213 96.088 114.677 1.00 0.00 H TER 18445 WAT 7191 ATOM 18445 O WAT 7192 44.023 84.702 88.036 1.00 0.00 O ATOM 18446 H1 WAT 7192 44.179 84.863 88.967 1.00 0.00 H ATOM 18447 H2 WAT 7192 44.838 84.964 87.608 1.00 0.00 H TER 18449 WAT 7192 ATOM 18449 O WAT 7193 134.690 143.706 15.129 1.00 0.00 O ATOM 18450 H1 WAT 7193 134.010 143.832 15.792 1.00 0.00 H ATOM 18451 H2 WAT 7193 135.484 143.524 15.632 1.00 0.00 H TER 18453 WAT 7193 ATOM 18453 O WAT 7194 42.746 100.861 21.900 1.00 0.00 O ATOM 18454 H1 WAT 7194 43.589 100.429 22.040 1.00 0.00 H ATOM 18455 H2 WAT 7194 42.517 101.220 22.757 1.00 0.00 H TER 18457 WAT 7194 ATOM 18457 O WAT 7195 78.409 54.724 107.510 1.00 0.00 O ATOM 18458 H1 WAT 7195 78.622 54.568 106.590 1.00 0.00 H ATOM 18459 H2 WAT 7195 78.955 55.469 107.760 1.00 0.00 H TER 18461 WAT 7195 ATOM 18461 O WAT 7196 49.467 47.289 142.516 1.00 0.00 O ATOM 18462 H1 WAT 7196 48.721 46.695 142.603 1.00 0.00 H ATOM 18463 H2 WAT 7196 49.098 48.160 142.657 1.00 0.00 H TER 18465 WAT 7196 ATOM 18465 O WAT 7197 29.815 21.703 70.879 1.00 0.00 O ATOM 18466 H1 WAT 7197 30.030 20.998 71.490 1.00 0.00 H ATOM 18467 H2 WAT 7197 28.930 21.497 70.579 1.00 0.00 H TER 18469 WAT 7197 ATOM 18469 O WAT 7198 17.395 57.992 106.456 1.00 0.00 O ATOM 18470 H1 WAT 7198 18.122 58.516 106.792 1.00 0.00 H ATOM 18471 H2 WAT 7198 17.538 57.120 106.824 1.00 0.00 H TER 18473 WAT 7198 ATOM 18473 O WAT 7199 107.990 28.779 100.876 1.00 0.00 O ATOM 18474 H1 WAT 7199 107.424 29.540 100.743 1.00 0.00 H ATOM 18475 H2 WAT 7199 107.463 28.180 101.405 1.00 0.00 H TER 18477 WAT 7199 ATOM 18477 O WAT 7200 72.268 85.573 87.700 1.00 0.00 O ATOM 18478 H1 WAT 7200 72.588 84.671 87.701 1.00 0.00 H ATOM 18479 H2 WAT 7200 73.006 86.089 87.377 1.00 0.00 H TER 18481 WAT 7200 ATOM 18481 O WAT 7201 84.723 63.686 119.702 1.00 0.00 O ATOM 18482 H1 WAT 7201 84.327 63.042 120.289 1.00 0.00 H ATOM 18483 H2 WAT 7201 85.194 64.283 120.283 1.00 0.00 H TER 18485 WAT 7201 ATOM 18485 O WAT 7202 21.420 108.357 81.356 1.00 0.00 O ATOM 18486 H1 WAT 7202 20.985 108.798 82.085 1.00 0.00 H ATOM 18487 H2 WAT 7202 22.339 108.614 81.434 1.00 0.00 H TER 18489 WAT 7202 ATOM 18489 O WAT 7203 112.493 134.891 141.074 1.00 0.00 O ATOM 18490 H1 WAT 7203 113.191 135.473 141.375 1.00 0.00 H ATOM 18491 H2 WAT 7203 112.069 134.590 141.878 1.00 0.00 H TER 18493 WAT 7203 ATOM 18493 O WAT 7204 77.190 87.948 17.756 1.00 0.00 O ATOM 18494 H1 WAT 7204 76.454 88.386 17.329 1.00 0.00 H ATOM 18495 H2 WAT 7204 77.091 88.161 18.684 1.00 0.00 H TER 18497 WAT 7204 ATOM 18497 O WAT 7205 58.987 100.136 8.867 1.00 0.00 O ATOM 18498 H1 WAT 7205 58.050 100.016 9.018 1.00 0.00 H ATOM 18499 H2 WAT 7205 59.201 99.510 8.176 1.00 0.00 H TER 18501 WAT 7205 ATOM 18501 O WAT 7206 107.650 114.788 3.998 1.00 0.00 O ATOM 18502 H1 WAT 7206 106.808 114.595 3.586 1.00 0.00 H ATOM 18503 H2 WAT 7206 108.093 113.941 4.046 1.00 0.00 H TER 18505 WAT 7206 ATOM 18505 O WAT 7207 54.735 79.242 4.818 1.00 0.00 O ATOM 18506 H1 WAT 7207 55.436 78.642 4.564 1.00 0.00 H ATOM 18507 H2 WAT 7207 53.941 78.850 4.457 1.00 0.00 H TER 18509 WAT 7207 ATOM 18509 O WAT 7208 92.094 51.418 150.615 1.00 0.00 O ATOM 18510 H1 WAT 7208 92.941 50.988 150.493 1.00 0.00 H ATOM 18511 H2 WAT 7208 91.653 50.894 151.283 1.00 0.00 H TER 18513 WAT 7208 ATOM 18513 O WAT 7209 38.751 3.879 149.880 1.00 0.00 O ATOM 18514 H1 WAT 7209 38.064 4.259 149.332 1.00 0.00 H ATOM 18515 H2 WAT 7209 39.543 4.359 149.638 1.00 0.00 H TER 18517 WAT 7209 ATOM 18517 O WAT 7210 24.729 99.337 71.137 1.00 0.00 O ATOM 18518 H1 WAT 7210 25.017 99.788 70.344 1.00 0.00 H ATOM 18519 H2 WAT 7210 23.774 99.388 71.109 1.00 0.00 H TER 18521 WAT 7210 ATOM 18521 O WAT 7211 1.872 114.644 103.536 1.00 0.00 O ATOM 18522 H1 WAT 7211 2.496 114.211 104.119 1.00 0.00 H ATOM 18523 H2 WAT 7211 1.326 113.934 103.199 1.00 0.00 H TER 18525 WAT 7211 ATOM 18525 O WAT 7212 62.597 63.718 25.821 1.00 0.00 O ATOM 18526 H1 WAT 7212 63.391 64.176 25.546 1.00 0.00 H ATOM 18527 H2 WAT 7212 61.997 64.416 26.084 1.00 0.00 H TER 18529 WAT 7212 ATOM 18529 O WAT 7213 140.321 62.195 102.122 1.00 0.00 O ATOM 18530 H1 WAT 7213 140.420 63.146 102.164 1.00 0.00 H ATOM 18531 H2 WAT 7213 141.126 61.853 102.512 1.00 0.00 H TER 18533 WAT 7213 ATOM 18533 O WAT 7214 83.377 81.658 98.809 1.00 0.00 O ATOM 18534 H1 WAT 7214 83.943 82.373 98.518 1.00 0.00 H ATOM 18535 H2 WAT 7214 82.555 81.795 98.337 1.00 0.00 H TER 18537 WAT 7214 ATOM 18537 O WAT 7215 43.618 4.895 129.743 1.00 0.00 O ATOM 18538 H1 WAT 7215 43.608 5.055 128.799 1.00 0.00 H ATOM 18539 H2 WAT 7215 42.728 4.605 129.946 1.00 0.00 H TER 18541 WAT 7215 ATOM 18541 O WAT 7216 114.174 78.661 75.134 1.00 0.00 O ATOM 18542 H1 WAT 7216 114.692 78.912 75.898 1.00 0.00 H ATOM 18543 H2 WAT 7216 114.718 78.905 74.385 1.00 0.00 H TER 18545 WAT 7216 ATOM 18545 O WAT 7217 89.405 98.555 89.634 1.00 0.00 O ATOM 18546 H1 WAT 7217 90.085 98.594 90.307 1.00 0.00 H ATOM 18547 H2 WAT 7217 89.798 98.978 88.871 1.00 0.00 H TER 18549 WAT 7217 ATOM 18549 O WAT 7218 61.539 37.747 97.537 1.00 0.00 O ATOM 18550 H1 WAT 7218 61.353 37.990 98.444 1.00 0.00 H ATOM 18551 H2 WAT 7218 60.720 37.915 97.071 1.00 0.00 H TER 18553 WAT 7218 ATOM 18553 O WAT 7219 84.174 101.704 66.445 1.00 0.00 O ATOM 18554 H1 WAT 7219 84.767 101.973 67.146 1.00 0.00 H ATOM 18555 H2 WAT 7219 84.079 102.485 65.899 1.00 0.00 H TER 18557 WAT 7219 ATOM 18557 O WAT 7220 127.492 110.091 5.679 1.00 0.00 O ATOM 18558 H1 WAT 7220 127.379 109.389 5.038 1.00 0.00 H ATOM 18559 H2 WAT 7220 128.350 110.465 5.477 1.00 0.00 H TER 18561 WAT 7220 ATOM 18561 O WAT 7221 59.880 61.358 60.451 1.00 0.00 O ATOM 18562 H1 WAT 7221 59.185 61.003 59.897 1.00 0.00 H ATOM 18563 H2 WAT 7221 59.910 62.289 60.231 1.00 0.00 H TER 18565 WAT 7221 ATOM 18565 O WAT 7222 65.365 96.579 55.816 1.00 0.00 O ATOM 18566 H1 WAT 7222 64.613 96.848 55.287 1.00 0.00 H ATOM 18567 H2 WAT 7222 65.699 95.797 55.377 1.00 0.00 H TER 18569 WAT 7222 ATOM 18569 O WAT 7223 144.493 75.821 150.067 1.00 0.00 O ATOM 18570 H1 WAT 7223 144.507 75.824 149.110 1.00 0.00 H ATOM 18571 H2 WAT 7223 144.756 76.707 150.314 1.00 0.00 H TER 18573 WAT 7223 ATOM 18573 O WAT 7224 125.345 141.613 97.332 1.00 0.00 O ATOM 18574 H1 WAT 7224 124.962 141.760 96.467 1.00 0.00 H ATOM 18575 H2 WAT 7224 124.987 142.316 97.875 1.00 0.00 H TER 18577 WAT 7224 ATOM 18577 O WAT 7225 28.272 57.191 76.206 1.00 0.00 O ATOM 18578 H1 WAT 7225 28.880 56.509 75.920 1.00 0.00 H ATOM 18579 H2 WAT 7225 28.824 57.829 76.659 1.00 0.00 H TER 18581 WAT 7225 ATOM 18581 O WAT 7226 73.272 102.237 105.796 1.00 0.00 O ATOM 18582 H1 WAT 7226 73.281 101.284 105.884 1.00 0.00 H ATOM 18583 H2 WAT 7226 72.647 102.406 105.091 1.00 0.00 H TER 18585 WAT 7226 ATOM 18585 O WAT 7227 35.661 53.864 87.814 1.00 0.00 O ATOM 18586 H1 WAT 7227 36.262 53.225 87.432 1.00 0.00 H ATOM 18587 H2 WAT 7227 35.014 53.335 88.281 1.00 0.00 H TER 18589 WAT 7227 ATOM 18589 O WAT 7228 142.204 140.986 84.315 1.00 0.00 O ATOM 18590 H1 WAT 7228 141.726 141.727 83.942 1.00 0.00 H ATOM 18591 H2 WAT 7228 142.667 140.601 83.571 1.00 0.00 H TER 18593 WAT 7228 ATOM 18593 O WAT 7229 77.711 40.657 25.418 1.00 0.00 O ATOM 18594 H1 WAT 7229 77.425 41.520 25.117 1.00 0.00 H ATOM 18595 H2 WAT 7229 78.489 40.467 24.893 1.00 0.00 H TER 18597 WAT 7229 ATOM 18597 O WAT 7230 84.612 104.063 150.498 1.00 0.00 O ATOM 18598 H1 WAT 7230 84.081 104.352 151.241 1.00 0.00 H ATOM 18599 H2 WAT 7230 84.328 104.616 149.771 1.00 0.00 H TER 18601 WAT 7230 ATOM 18601 O WAT 7231 5.447 67.666 67.115 1.00 0.00 O ATOM 18602 H1 WAT 7231 4.785 67.902 66.465 1.00 0.00 H ATOM 18603 H2 WAT 7231 6.250 67.549 66.608 1.00 0.00 H TER 18605 WAT 7231 ATOM 18605 O WAT 7232 98.757 12.244 131.916 1.00 0.00 O ATOM 18606 H1 WAT 7232 98.800 12.520 132.831 1.00 0.00 H ATOM 18607 H2 WAT 7232 97.900 12.547 131.615 1.00 0.00 H TER 18609 WAT 7232 ATOM 18609 O WAT 7233 89.186 48.530 127.342 1.00 0.00 O ATOM 18610 H1 WAT 7233 90.029 48.103 127.186 1.00 0.00 H ATOM 18611 H2 WAT 7233 89.353 49.458 127.174 1.00 0.00 H TER 18613 WAT 7233 ATOM 18613 O WAT 7234 32.124 125.139 157.074 1.00 0.00 O ATOM 18614 H1 WAT 7234 32.749 125.063 156.353 1.00 0.00 H ATOM 18615 H2 WAT 7234 32.219 126.040 157.380 1.00 0.00 H TER 18617 WAT 7234 ATOM 18617 O WAT 7235 68.851 48.168 91.429 1.00 0.00 O ATOM 18618 H1 WAT 7235 69.739 47.958 91.716 1.00 0.00 H ATOM 18619 H2 WAT 7235 68.359 47.357 91.558 1.00 0.00 H TER 18621 WAT 7235 ATOM 18621 O WAT 7236 17.787 60.429 154.771 1.00 0.00 O ATOM 18622 H1 WAT 7236 18.372 60.076 154.101 1.00 0.00 H ATOM 18623 H2 WAT 7236 18.175 61.271 155.010 1.00 0.00 H TER 18625 WAT 7236 ATOM 18625 O WAT 7237 114.567 23.686 104.419 1.00 0.00 O ATOM 18626 H1 WAT 7237 113.671 23.868 104.702 1.00 0.00 H ATOM 18627 H2 WAT 7237 115.006 23.363 105.206 1.00 0.00 H TER 18629 WAT 7237 ATOM 18629 O WAT 7238 40.252 122.335 121.135 1.00 0.00 O ATOM 18630 H1 WAT 7238 39.404 121.904 121.027 1.00 0.00 H ATOM 18631 H2 WAT 7238 40.035 123.234 121.382 1.00 0.00 H TER 18633 WAT 7238 ATOM 18633 O WAT 7239 121.151 13.908 109.759 1.00 0.00 O ATOM 18634 H1 WAT 7239 122.051 13.660 109.968 1.00 0.00 H ATOM 18635 H2 WAT 7239 120.648 13.100 109.863 1.00 0.00 H TER 18637 WAT 7239 ATOM 18637 O WAT 7240 55.167 119.717 100.362 1.00 0.00 O ATOM 18638 H1 WAT 7240 56.098 119.821 100.165 1.00 0.00 H ATOM 18639 H2 WAT 7240 54.826 120.611 100.390 1.00 0.00 H TER 18641 WAT 7240 ATOM 18641 O WAT 7241 135.302 14.012 5.796 1.00 0.00 O ATOM 18642 H1 WAT 7241 134.425 13.630 5.810 1.00 0.00 H ATOM 18643 H2 WAT 7241 135.500 14.192 6.715 1.00 0.00 H TER 18645 WAT 7241 ATOM 18645 O WAT 7242 92.682 116.272 72.488 1.00 0.00 O ATOM 18646 H1 WAT 7242 92.949 117.033 73.004 1.00 0.00 H ATOM 18647 H2 WAT 7242 92.092 115.787 73.065 1.00 0.00 H TER 18649 WAT 7242 ATOM 18649 O WAT 7243 145.655 64.990 3.511 1.00 0.00 O ATOM 18650 H1 WAT 7243 145.406 65.788 3.045 1.00 0.00 H ATOM 18651 H2 WAT 7243 146.610 65.033 3.566 1.00 0.00 H TER 18653 WAT 7243 ATOM 18653 O WAT 7244 85.652 137.577 72.413 1.00 0.00 O ATOM 18654 H1 WAT 7244 85.240 138.145 71.762 1.00 0.00 H ATOM 18655 H2 WAT 7244 85.451 136.689 72.118 1.00 0.00 H TER 18657 WAT 7244 ATOM 18657 O WAT 7245 42.819 55.818 90.148 1.00 0.00 O ATOM 18658 H1 WAT 7245 43.739 55.585 90.020 1.00 0.00 H ATOM 18659 H2 WAT 7245 42.453 55.841 89.264 1.00 0.00 H TER 18661 WAT 7245 ATOM 18661 O WAT 7246 116.970 12.430 69.171 1.00 0.00 O ATOM 18662 H1 WAT 7246 116.385 12.177 69.885 1.00 0.00 H ATOM 18663 H2 WAT 7246 116.897 11.718 68.536 1.00 0.00 H TER 18665 WAT 7246 ATOM 18665 O WAT 7247 22.998 39.564 120.863 1.00 0.00 O ATOM 18666 H1 WAT 7247 23.112 39.072 120.050 1.00 0.00 H ATOM 18667 H2 WAT 7247 22.813 40.459 120.577 1.00 0.00 H TER 18669 WAT 7247 ATOM 18669 O WAT 7248 90.944 137.695 101.862 1.00 0.00 O ATOM 18670 H1 WAT 7248 90.521 137.401 101.054 1.00 0.00 H ATOM 18671 H2 WAT 7248 90.278 137.573 102.539 1.00 0.00 H TER 18673 WAT 7248 ATOM 18673 O WAT 7249 59.527 81.324 95.390 1.00 0.00 O ATOM 18674 H1 WAT 7249 58.819 81.830 94.992 1.00 0.00 H ATOM 18675 H2 WAT 7249 59.925 81.924 96.021 1.00 0.00 H TER 18677 WAT 7249 ATOM 18677 O WAT 7250 115.650 26.991 55.103 1.00 0.00 O ATOM 18678 H1 WAT 7250 115.957 26.328 55.722 1.00 0.00 H ATOM 18679 H2 WAT 7250 116.319 27.675 55.134 1.00 0.00 H TER 18681 WAT 7250 ATOM 18681 O WAT 7251 130.570 60.275 114.341 1.00 0.00 O ATOM 18682 H1 WAT 7251 129.995 59.634 114.759 1.00 0.00 H ATOM 18683 H2 WAT 7251 130.704 59.936 113.456 1.00 0.00 H TER 18685 WAT 7251 ATOM 18685 O WAT 7252 130.374 5.860 55.759 1.00 0.00 O ATOM 18686 H1 WAT 7252 130.318 4.926 55.558 1.00 0.00 H ATOM 18687 H2 WAT 7252 129.482 6.107 56.004 1.00 0.00 H TER 18689 WAT 7252 ATOM 18689 O WAT 7253 90.628 66.302 89.201 1.00 0.00 O ATOM 18690 H1 WAT 7253 90.959 67.193 89.093 1.00 0.00 H ATOM 18691 H2 WAT 7253 91.363 65.817 89.576 1.00 0.00 H TER 18693 WAT 7253 ATOM 18693 O WAT 7254 102.396 142.817 103.107 1.00 0.00 O ATOM 18694 H1 WAT 7254 102.171 142.510 102.229 1.00 0.00 H ATOM 18695 H2 WAT 7254 102.686 143.720 102.978 1.00 0.00 H TER 18697 WAT 7254 ATOM 18697 O WAT 7255 70.450 43.292 63.052 1.00 0.00 O ATOM 18698 H1 WAT 7255 71.312 43.043 62.718 1.00 0.00 H ATOM 18699 H2 WAT 7255 69.849 42.659 62.658 1.00 0.00 H TER 18701 WAT 7255 ATOM 18701 O WAT 7256 47.492 15.070 8.065 1.00 0.00 O ATOM 18702 H1 WAT 7256 47.274 15.917 7.676 1.00 0.00 H ATOM 18703 H2 WAT 7256 46.940 14.443 7.597 1.00 0.00 H TER 18705 WAT 7256 ATOM 18705 O WAT 7257 104.392 22.411 79.772 1.00 0.00 O ATOM 18706 H1 WAT 7257 103.632 22.438 79.190 1.00 0.00 H ATOM 18707 H2 WAT 7257 105.137 22.273 79.186 1.00 0.00 H TER 18709 WAT 7257 ATOM 18709 O WAT 7258 26.016 108.877 157.801 1.00 0.00 O ATOM 18710 H1 WAT 7258 25.080 109.079 157.813 1.00 0.00 H ATOM 18711 H2 WAT 7258 26.146 108.391 156.987 1.00 0.00 H TER 18713 WAT 7258 ATOM 18713 O WAT 7259 2.425 28.513 151.129 1.00 0.00 O ATOM 18714 H1 WAT 7259 2.950 28.143 151.838 1.00 0.00 H ATOM 18715 H2 WAT 7259 2.929 28.331 150.336 1.00 0.00 H TER 18717 WAT 7259 ATOM 18717 O WAT 7260 6.015 107.115 17.650 1.00 0.00 O ATOM 18718 H1 WAT 7260 6.389 107.435 18.471 1.00 0.00 H ATOM 18719 H2 WAT 7260 6.734 106.648 17.225 1.00 0.00 H TER 18721 WAT 7260 ATOM 18721 O WAT 7261 4.332 19.746 145.662 1.00 0.00 O ATOM 18722 H1 WAT 7261 4.883 20.526 145.608 1.00 0.00 H ATOM 18723 H2 WAT 7261 4.400 19.467 146.575 1.00 0.00 H TER 18725 WAT 7261 ATOM 18725 O WAT 7262 87.086 139.579 137.620 1.00 0.00 O ATOM 18726 H1 WAT 7262 86.498 139.452 138.364 1.00 0.00 H ATOM 18727 H2 WAT 7262 86.787 138.946 136.967 1.00 0.00 H TER 18729 WAT 7262 ATOM 18729 O WAT 7263 89.604 85.579 156.534 1.00 0.00 O ATOM 18730 H1 WAT 7263 90.185 84.819 156.500 1.00 0.00 H ATOM 18731 H2 WAT 7263 89.188 85.600 155.672 1.00 0.00 H TER 18733 WAT 7263 ATOM 18733 O WAT 7264 71.762 82.211 25.642 1.00 0.00 O ATOM 18734 H1 WAT 7264 71.621 81.577 24.940 1.00 0.00 H ATOM 18735 H2 WAT 7264 71.041 82.834 25.550 1.00 0.00 H TER 18737 WAT 7264 ATOM 18737 O WAT 7265 47.054 108.491 107.544 1.00 0.00 O ATOM 18738 H1 WAT 7265 47.980 108.697 107.672 1.00 0.00 H ATOM 18739 H2 WAT 7265 46.619 108.853 108.316 1.00 0.00 H TER 18741 WAT 7265 ATOM 18741 O WAT 7266 115.961 120.965 102.034 1.00 0.00 O ATOM 18742 H1 WAT 7266 116.274 120.261 101.466 1.00 0.00 H ATOM 18743 H2 WAT 7266 116.756 121.324 102.430 1.00 0.00 H TER 18745 WAT 7266 ATOM 18745 O WAT 7267 8.233 78.484 107.903 1.00 0.00 O ATOM 18746 H1 WAT 7267 8.879 78.413 108.605 1.00 0.00 H ATOM 18747 H2 WAT 7267 7.779 77.641 107.909 1.00 0.00 H TER 18749 WAT 7267 ATOM 18749 O WAT 7268 127.814 101.391 152.062 1.00 0.00 O ATOM 18750 H1 WAT 7268 127.298 101.168 152.837 1.00 0.00 H ATOM 18751 H2 WAT 7268 128.433 102.053 152.370 1.00 0.00 H TER 18753 WAT 7268 ATOM 18753 O WAT 7269 33.259 119.710 4.797 1.00 0.00 O ATOM 18754 H1 WAT 7269 32.813 119.043 5.318 1.00 0.00 H ATOM 18755 H2 WAT 7269 33.610 120.324 5.442 1.00 0.00 H TER 18757 WAT 7269 ATOM 18757 O WAT 7270 124.224 136.471 158.666 1.00 0.00 O ATOM 18758 H1 WAT 7270 124.667 136.806 157.886 1.00 0.00 H ATOM 18759 H2 WAT 7270 124.517 137.046 159.373 1.00 0.00 H TER 18761 WAT 7270 ATOM 18761 O WAT 7271 100.828 63.465 6.297 1.00 0.00 O ATOM 18762 H1 WAT 7271 100.947 64.122 6.983 1.00 0.00 H ATOM 18763 H2 WAT 7271 101.377 62.731 6.572 1.00 0.00 H TER 18765 WAT 7271 ATOM 18765 O WAT 7272 118.355 144.837 68.928 1.00 0.00 O ATOM 18766 H1 WAT 7272 117.857 145.292 68.249 1.00 0.00 H ATOM 18767 H2 WAT 7272 118.263 143.909 68.710 1.00 0.00 H TER 18769 WAT 7272 ATOM 18769 O WAT 7273 94.800 66.085 81.153 1.00 0.00 O ATOM 18770 H1 WAT 7273 95.189 65.227 80.979 1.00 0.00 H ATOM 18771 H2 WAT 7273 94.543 66.049 82.074 1.00 0.00 H TER 18773 WAT 7273 ATOM 18773 O WAT 7274 74.110 89.095 19.324 1.00 0.00 O ATOM 18774 H1 WAT 7274 73.634 89.025 20.151 1.00 0.00 H ATOM 18775 H2 WAT 7274 74.090 88.210 18.960 1.00 0.00 H TER 18777 WAT 7274 ATOM 18777 O WAT 7275 16.585 48.341 14.545 1.00 0.00 O ATOM 18778 H1 WAT 7275 15.857 47.850 14.926 1.00 0.00 H ATOM 18779 H2 WAT 7275 17.142 48.562 15.291 1.00 0.00 H TER 18781 WAT 7275 ATOM 18781 O WAT 7276 67.110 45.995 155.633 1.00 0.00 O ATOM 18782 H1 WAT 7276 67.471 46.670 155.058 1.00 0.00 H ATOM 18783 H2 WAT 7276 66.267 46.349 155.917 1.00 0.00 H TER 18785 WAT 7276 ATOM 18785 O WAT 7277 103.211 28.512 69.115 1.00 0.00 O ATOM 18786 H1 WAT 7277 102.443 28.086 69.495 1.00 0.00 H ATOM 18787 H2 WAT 7277 103.529 27.891 68.460 1.00 0.00 H TER 18789 WAT 7277 ATOM 18789 O WAT 7278 67.329 7.971 113.981 1.00 0.00 O ATOM 18790 H1 WAT 7278 68.031 7.686 114.566 1.00 0.00 H ATOM 18791 H2 WAT 7278 66.685 7.263 114.017 1.00 0.00 H TER 18793 WAT 7278 ATOM 18793 O WAT 7279 62.764 94.289 6.926 1.00 0.00 O ATOM 18794 H1 WAT 7279 63.372 93.737 7.417 1.00 0.00 H ATOM 18795 H2 WAT 7279 62.859 95.158 7.318 1.00 0.00 H TER 18797 WAT 7279 ATOM 18797 O WAT 7280 117.371 66.594 4.204 1.00 0.00 O ATOM 18798 H1 WAT 7280 116.962 65.763 4.447 1.00 0.00 H ATOM 18799 H2 WAT 7280 116.876 67.255 4.687 1.00 0.00 H TER 18801 WAT 7280 ATOM 18801 O WAT 7281 35.448 68.376 154.773 1.00 0.00 O ATOM 18802 H1 WAT 7281 35.708 68.442 155.692 1.00 0.00 H ATOM 18803 H2 WAT 7281 35.207 69.269 154.527 1.00 0.00 H TER 18805 WAT 7281 ATOM 18805 O WAT 7282 79.367 141.524 148.044 1.00 0.00 O ATOM 18806 H1 WAT 7282 80.093 140.937 147.831 1.00 0.00 H ATOM 18807 H2 WAT 7282 78.584 140.984 147.942 1.00 0.00 H TER 18809 WAT 7282 ATOM 18809 O WAT 7283 1.320 91.879 16.924 1.00 0.00 O ATOM 18810 H1 WAT 7283 1.592 92.303 17.738 1.00 0.00 H ATOM 18811 H2 WAT 7283 0.616 91.286 17.186 1.00 0.00 H TER 18813 WAT 7283 ATOM 18813 O WAT 7284 43.255 113.806 78.619 1.00 0.00 O ATOM 18814 H1 WAT 7284 43.503 113.963 77.709 1.00 0.00 H ATOM 18815 H2 WAT 7284 43.091 114.678 78.978 1.00 0.00 H TER 18817 WAT 7284 ATOM 18817 O WAT 7285 9.215 123.344 27.807 1.00 0.00 O ATOM 18818 H1 WAT 7285 9.791 122.580 27.813 1.00 0.00 H ATOM 18819 H2 WAT 7285 9.781 124.073 28.063 1.00 0.00 H TER 18821 WAT 7285 ATOM 18821 O WAT 7286 28.026 116.172 70.615 1.00 0.00 O ATOM 18822 H1 WAT 7286 27.698 115.310 70.358 1.00 0.00 H ATOM 18823 H2 WAT 7286 28.975 116.109 70.506 1.00 0.00 H TER 18825 WAT 7286 ATOM 18825 O WAT 7287 109.394 121.425 96.834 1.00 0.00 O ATOM 18826 H1 WAT 7287 110.175 121.781 96.410 1.00 0.00 H ATOM 18827 H2 WAT 7287 109.567 120.487 96.908 1.00 0.00 H TER 18829 WAT 7287 ATOM 18829 O WAT 7288 26.256 145.117 80.559 1.00 0.00 O ATOM 18830 H1 WAT 7288 25.557 145.731 80.784 1.00 0.00 H ATOM 18831 H2 WAT 7288 26.778 145.044 81.358 1.00 0.00 H TER 18833 WAT 7288 ATOM 18833 O WAT 7289 70.769 61.310 91.392 1.00 0.00 O ATOM 18834 H1 WAT 7289 70.917 61.025 90.491 1.00 0.00 H ATOM 18835 H2 WAT 7289 70.363 60.556 91.819 1.00 0.00 H TER 18837 WAT 7289 ATOM 18837 O WAT 7290 87.711 57.195 155.675 1.00 0.00 O ATOM 18838 H1 WAT 7290 87.006 57.495 156.250 1.00 0.00 H ATOM 18839 H2 WAT 7290 88.338 57.918 155.669 1.00 0.00 H TER 18841 WAT 7290 ATOM 18841 O WAT 7291 124.373 58.998 13.010 1.00 0.00 O ATOM 18842 H1 WAT 7291 124.111 58.599 12.180 1.00 0.00 H ATOM 18843 H2 WAT 7291 124.323 58.284 13.646 1.00 0.00 H TER 18845 WAT 7291 ATOM 18845 O WAT 7292 116.933 46.897 4.331 1.00 0.00 O ATOM 18846 H1 WAT 7292 116.804 46.088 4.827 1.00 0.00 H ATOM 18847 H2 WAT 7292 116.048 47.223 4.169 1.00 0.00 H TER 18849 WAT 7292 ATOM 18849 O WAT 7293 122.804 73.906 109.382 1.00 0.00 O ATOM 18850 H1 WAT 7293 122.496 73.527 110.205 1.00 0.00 H ATOM 18851 H2 WAT 7293 123.067 74.797 109.613 1.00 0.00 H TER 18853 WAT 7293 ATOM 18853 O WAT 7294 121.497 66.731 121.465 1.00 0.00 O ATOM 18854 H1 WAT 7294 122.351 66.528 121.847 1.00 0.00 H ATOM 18855 H2 WAT 7294 121.433 66.155 120.703 1.00 0.00 H TER 18857 WAT 7294 ATOM 18857 O WAT 7295 70.271 123.450 21.015 1.00 0.00 O ATOM 18858 H1 WAT 7295 70.686 124.167 21.495 1.00 0.00 H ATOM 18859 H2 WAT 7295 69.726 123.885 20.359 1.00 0.00 H TER 18861 WAT 7295 ATOM 18861 O WAT 7296 115.664 43.209 80.940 1.00 0.00 O ATOM 18862 H1 WAT 7296 115.264 42.380 81.204 1.00 0.00 H ATOM 18863 H2 WAT 7296 114.964 43.680 80.488 1.00 0.00 H TER 18865 WAT 7296 ATOM 18865 O WAT 7297 82.314 105.281 73.657 1.00 0.00 O ATOM 18866 H1 WAT 7297 81.638 105.359 74.330 1.00 0.00 H ATOM 18867 H2 WAT 7297 82.975 104.708 74.047 1.00 0.00 H TER 18869 WAT 7297 ATOM 18869 O WAT 7298 69.223 130.162 101.823 1.00 0.00 O ATOM 18870 H1 WAT 7298 69.923 130.742 102.122 1.00 0.00 H ATOM 18871 H2 WAT 7298 68.763 129.910 102.624 1.00 0.00 H TER 18873 WAT 7298 ATOM 18873 O WAT 7299 128.574 137.863 148.069 1.00 0.00 O ATOM 18874 H1 WAT 7299 129.043 137.504 147.316 1.00 0.00 H ATOM 18875 H2 WAT 7299 128.761 137.252 148.781 1.00 0.00 H TER 18877 WAT 7299 ATOM 18877 O WAT 7300 11.871 14.896 109.598 1.00 0.00 O ATOM 18878 H1 WAT 7300 11.254 14.214 109.865 1.00 0.00 H ATOM 18879 H2 WAT 7300 11.384 15.714 109.705 1.00 0.00 H TER 18881 WAT 7300 ATOM 18881 O WAT 7301 124.724 104.867 113.960 1.00 0.00 O ATOM 18882 H1 WAT 7301 125.200 104.044 113.852 1.00 0.00 H ATOM 18883 H2 WAT 7301 124.753 105.275 113.095 1.00 0.00 H TER 18885 WAT 7301 ATOM 18885 O WAT 7302 26.150 81.984 78.415 1.00 0.00 O ATOM 18886 H1 WAT 7302 26.597 81.888 77.574 1.00 0.00 H ATOM 18887 H2 WAT 7302 25.221 82.026 78.189 1.00 0.00 H TER 18889 WAT 7302 ATOM 18889 O WAT 7303 34.097 62.867 104.475 1.00 0.00 O ATOM 18890 H1 WAT 7303 33.850 63.475 103.777 1.00 0.00 H ATOM 18891 H2 WAT 7303 35.054 62.885 104.479 1.00 0.00 H TER 18893 WAT 7303 ATOM 18893 O WAT 7304 32.046 141.181 147.301 1.00 0.00 O ATOM 18894 H1 WAT 7304 31.476 140.982 146.558 1.00 0.00 H ATOM 18895 H2 WAT 7304 31.535 140.927 148.070 1.00 0.00 H TER 18897 WAT 7304 ATOM 18897 O WAT 7305 81.661 14.540 102.624 1.00 0.00 O ATOM 18898 H1 WAT 7305 81.496 13.761 102.092 1.00 0.00 H ATOM 18899 H2 WAT 7305 81.040 15.191 102.294 1.00 0.00 H TER 18901 WAT 7305 ATOM 18901 O WAT 7306 80.095 107.812 15.392 1.00 0.00 O ATOM 18902 H1 WAT 7306 80.422 108.514 15.954 1.00 0.00 H ATOM 18903 H2 WAT 7306 80.506 107.018 15.736 1.00 0.00 H TER 18905 WAT 7306 ATOM 18905 O WAT 7307 89.034 144.172 150.576 1.00 0.00 O ATOM 18906 H1 WAT 7307 89.373 143.298 150.771 1.00 0.00 H ATOM 18907 H2 WAT 7307 89.632 144.767 151.029 1.00 0.00 H TER 18909 WAT 7307 ATOM 18909 O WAT 7308 118.786 63.893 130.088 1.00 0.00 O ATOM 18910 H1 WAT 7308 119.710 64.051 129.894 1.00 0.00 H ATOM 18911 H2 WAT 7308 118.670 62.953 129.955 1.00 0.00 H TER 18913 WAT 7308 ATOM 18913 O WAT 7309 76.333 8.227 101.168 1.00 0.00 O ATOM 18914 H1 WAT 7309 75.965 8.893 100.587 1.00 0.00 H ATOM 18915 H2 WAT 7309 75.651 8.078 101.823 1.00 0.00 H TER 18917 WAT 7309 ATOM 18917 O WAT 7310 12.842 76.368 20.141 1.00 0.00 O ATOM 18918 H1 WAT 7310 12.188 76.405 19.443 1.00 0.00 H ATOM 18919 H2 WAT 7310 13.525 75.791 19.800 1.00 0.00 H TER 18921 WAT 7310 ATOM 18921 O WAT 7311 8.929 19.835 70.767 1.00 0.00 O ATOM 18922 H1 WAT 7311 8.163 20.295 71.109 1.00 0.00 H ATOM 18923 H2 WAT 7311 8.582 19.010 70.427 1.00 0.00 H TER 18925 WAT 7311 ATOM 18925 O WAT 7312 99.305 34.474 142.878 1.00 0.00 O ATOM 18926 H1 WAT 7312 98.854 34.656 142.053 1.00 0.00 H ATOM 18927 H2 WAT 7312 99.694 35.312 143.128 1.00 0.00 H TER 18929 WAT 7312 ATOM 18929 O WAT 7313 20.601 26.716 3.056 1.00 0.00 O ATOM 18930 H1 WAT 7313 19.878 26.404 3.601 1.00 0.00 H ATOM 18931 H2 WAT 7313 20.223 27.431 2.543 1.00 0.00 H TER 18933 WAT 7313 ATOM 18933 O WAT 7314 85.392 70.991 128.424 1.00 0.00 O ATOM 18934 H1 WAT 7314 85.142 71.190 127.521 1.00 0.00 H ATOM 18935 H2 WAT 7314 84.566 70.997 128.907 1.00 0.00 H TER 18937 WAT 7314 ATOM 18937 O WAT 7315 133.351 21.443 98.657 1.00 0.00 O ATOM 18938 H1 WAT 7315 134.232 21.559 98.302 1.00 0.00 H ATOM 18939 H2 WAT 7315 132.822 21.179 97.904 1.00 0.00 H TER 18941 WAT 7315 ATOM 18941 O WAT 7316 17.248 31.493 113.744 1.00 0.00 O ATOM 18942 H1 WAT 7316 16.942 31.829 112.901 1.00 0.00 H ATOM 18943 H2 WAT 7316 17.563 32.267 114.210 1.00 0.00 H TER 18945 WAT 7316 ATOM 18945 O WAT 7317 114.831 63.811 104.396 1.00 0.00 O ATOM 18946 H1 WAT 7317 114.248 63.911 103.644 1.00 0.00 H ATOM 18947 H2 WAT 7317 115.189 62.928 104.306 1.00 0.00 H TER 18949 WAT 7317 ATOM 18949 O WAT 7318 71.997 10.549 17.297 1.00 0.00 O ATOM 18950 H1 WAT 7318 71.457 9.784 17.098 1.00 0.00 H ATOM 18951 H2 WAT 7318 71.845 10.713 18.228 1.00 0.00 H TER 18953 WAT 7318 ATOM 18953 O WAT 7319 81.696 129.160 10.549 1.00 0.00 O ATOM 18954 H1 WAT 7319 80.950 128.688 10.179 1.00 0.00 H ATOM 18955 H2 WAT 7319 81.355 129.559 11.349 1.00 0.00 H TER 18957 WAT 7319 ATOM 18957 O WAT 7320 85.355 128.911 19.265 1.00 0.00 O ATOM 18958 H1 WAT 7320 84.646 129.524 19.072 1.00 0.00 H ATOM 18959 H2 WAT 7320 85.717 129.217 20.097 1.00 0.00 H TER 18961 WAT 7320 ATOM 18961 O WAT 7321 66.402 61.356 27.477 1.00 0.00 O ATOM 18962 H1 WAT 7321 66.239 60.518 27.044 1.00 0.00 H ATOM 18963 H2 WAT 7321 66.552 61.971 26.760 1.00 0.00 H TER 18965 WAT 7321 ATOM 18965 O WAT 7322 60.592 35.606 100.491 1.00 0.00 O ATOM 18966 H1 WAT 7322 61.451 35.185 100.470 1.00 0.00 H ATOM 18967 H2 WAT 7322 60.785 36.544 100.495 1.00 0.00 H TER 18969 WAT 7322 ATOM 18969 O WAT 7323 0.923 56.096 101.683 1.00 0.00 O ATOM 18970 H1 WAT 7323 0.197 55.855 101.108 1.00 0.00 H ATOM 18971 H2 WAT 7323 0.516 56.229 102.539 1.00 0.00 H TER 18973 WAT 7323 ATOM 18973 O WAT 7324 131.636 108.988 154.973 1.00 0.00 O ATOM 18974 H1 WAT 7324 132.017 109.040 155.849 1.00 0.00 H ATOM 18975 H2 WAT 7324 130.818 109.482 155.037 1.00 0.00 H TER 18977 WAT 7324 ATOM 18977 O WAT 7325 132.360 76.475 121.457 1.00 0.00 O ATOM 18978 H1 WAT 7325 131.929 76.894 122.201 1.00 0.00 H ATOM 18979 H2 WAT 7325 133.231 76.873 121.429 1.00 0.00 H TER 18981 WAT 7325 ATOM 18981 O WAT 7326 104.928 43.290 20.123 1.00 0.00 O ATOM 18982 H1 WAT 7326 105.014 42.440 20.554 1.00 0.00 H ATOM 18983 H2 WAT 7326 105.334 43.166 19.265 1.00 0.00 H TER 18985 WAT 7326 ATOM 18985 O WAT 7327 65.332 139.068 14.460 1.00 0.00 O ATOM 18986 H1 WAT 7327 65.625 138.536 15.200 1.00 0.00 H ATOM 18987 H2 WAT 7327 66.141 139.361 14.040 1.00 0.00 H TER 18989 WAT 7327 ATOM 18989 O WAT 7328 125.704 73.381 25.608 1.00 0.00 O ATOM 18990 H1 WAT 7328 125.995 74.244 25.313 1.00 0.00 H ATOM 18991 H2 WAT 7328 126.169 72.765 25.042 1.00 0.00 H TER 18993 WAT 7328 ATOM 18993 O WAT 7329 26.838 17.482 66.224 1.00 0.00 O ATOM 18994 H1 WAT 7329 25.920 17.583 66.473 1.00 0.00 H ATOM 18995 H2 WAT 7329 26.811 17.256 65.294 1.00 0.00 H TER 18997 WAT 7329 ATOM 18997 O WAT 7330 35.271 91.300 151.358 1.00 0.00 O ATOM 18998 H1 WAT 7330 34.819 91.532 150.547 1.00 0.00 H ATOM 18999 H2 WAT 7330 35.038 90.384 151.508 1.00 0.00 H TER 19001 WAT 7330 ATOM 19001 O WAT 7331 102.891 34.201 111.772 1.00 0.00 O ATOM 19002 H1 WAT 7331 102.102 33.750 111.472 1.00 0.00 H ATOM 19003 H2 WAT 7331 103.612 33.702 111.390 1.00 0.00 H TER 19005 WAT 7331 ATOM 19005 O WAT 7332 81.921 72.628 101.893 1.00 0.00 O ATOM 19006 H1 WAT 7332 81.283 73.337 101.974 1.00 0.00 H ATOM 19007 H2 WAT 7332 82.727 72.987 102.265 1.00 0.00 H TER 19009 WAT 7332 ATOM 19009 O WAT 7333 107.922 40.430 0.848 1.00 0.00 O ATOM 19010 H1 WAT 7333 108.309 40.983 0.169 1.00 0.00 H ATOM 19011 H2 WAT 7333 107.469 41.044 1.426 1.00 0.00 H TER 19013 WAT 7333 ATOM 19013 O WAT 7334 110.153 99.800 127.736 1.00 0.00 O ATOM 19014 H1 WAT 7334 111.028 99.414 127.780 1.00 0.00 H ATOM 19015 H2 WAT 7334 110.165 100.329 126.938 1.00 0.00 H TER 19017 WAT 7334 ATOM 19017 O WAT 7335 123.204 82.964 126.371 1.00 0.00 O ATOM 19018 H1 WAT 7335 123.376 83.615 127.051 1.00 0.00 H ATOM 19019 H2 WAT 7335 123.520 83.370 125.564 1.00 0.00 H TER 19021 WAT 7335 ATOM 19021 O WAT 7336 55.961 74.176 71.940 1.00 0.00 O ATOM 19022 H1 WAT 7336 55.732 75.030 72.308 1.00 0.00 H ATOM 19023 H2 WAT 7336 56.902 74.231 71.774 1.00 0.00 H TER 19025 WAT 7336 ATOM 19025 O WAT 7337 23.507 56.325 128.440 1.00 0.00 O ATOM 19026 H1 WAT 7337 24.379 56.652 128.219 1.00 0.00 H ATOM 19027 H2 WAT 7337 23.369 55.590 127.843 1.00 0.00 H TER 19029 WAT 7337 ATOM 19029 O WAT 7338 70.296 56.740 7.981 1.00 0.00 O ATOM 19030 H1 WAT 7338 70.903 56.155 8.434 1.00 0.00 H ATOM 19031 H2 WAT 7338 69.776 57.135 8.681 1.00 0.00 H TER 19033 WAT 7338 ATOM 19033 O WAT 7339 49.711 79.473 72.828 1.00 0.00 O ATOM 19034 H1 WAT 7339 48.938 79.444 72.264 1.00 0.00 H ATOM 19035 H2 WAT 7339 50.351 79.983 72.332 1.00 0.00 H TER 19037 WAT 7339 ATOM 19037 O WAT 7340 73.287 133.593 152.113 1.00 0.00 O ATOM 19038 H1 WAT 7340 73.715 133.287 152.913 1.00 0.00 H ATOM 19039 H2 WAT 7340 72.363 133.672 152.352 1.00 0.00 H TER 19041 WAT 7340 ATOM 19041 O WAT 7341 101.249 83.989 4.452 1.00 0.00 O ATOM 19042 H1 WAT 7341 101.736 84.808 4.354 1.00 0.00 H ATOM 19043 H2 WAT 7341 101.779 83.339 3.991 1.00 0.00 H TER 19045 WAT 7341 ATOM 19045 O WAT 7342 57.914 63.401 113.531 1.00 0.00 O ATOM 19046 H1 WAT 7342 58.243 63.717 112.690 1.00 0.00 H ATOM 19047 H2 WAT 7342 57.544 62.540 113.335 1.00 0.00 H TER 19049 WAT 7342 ATOM 19049 O WAT 7343 107.087 112.065 157.623 1.00 0.00 O ATOM 19050 H1 WAT 7343 107.666 112.828 157.626 1.00 0.00 H ATOM 19051 H2 WAT 7343 106.295 112.367 157.180 1.00 0.00 H TER 19053 WAT 7343 ATOM 19053 O WAT 7344 30.952 16.707 83.024 1.00 0.00 O ATOM 19054 H1 WAT 7344 31.831 16.799 83.393 1.00 0.00 H ATOM 19055 H2 WAT 7344 30.444 17.403 83.439 1.00 0.00 H TER 19057 WAT 7344 ATOM 19057 O WAT 7345 143.305 109.149 2.840 1.00 0.00 O ATOM 19058 H1 WAT 7345 143.302 108.251 2.508 1.00 0.00 H ATOM 19059 H2 WAT 7345 143.675 109.667 2.125 1.00 0.00 H TER 19061 WAT 7345 ATOM 19061 O WAT 7346 11.984 77.775 71.217 1.00 0.00 O ATOM 19062 H1 WAT 7346 12.496 78.140 71.939 1.00 0.00 H ATOM 19063 H2 WAT 7346 11.659 78.541 70.743 1.00 0.00 H TER 19065 WAT 7346 ATOM 19065 O WAT 7347 112.933 106.810 70.368 1.00 0.00 O ATOM 19066 H1 WAT 7347 113.208 107.673 70.059 1.00 0.00 H ATOM 19067 H2 WAT 7347 112.500 106.412 69.612 1.00 0.00 H TER 19069 WAT 7347 ATOM 19069 O WAT 7348 2.853 96.898 122.353 1.00 0.00 O ATOM 19070 H1 WAT 7348 2.884 96.026 122.746 1.00 0.00 H ATOM 19071 H2 WAT 7348 3.381 96.821 121.558 1.00 0.00 H TER 19073 WAT 7348 ATOM 19073 O WAT 7349 16.974 84.303 18.738 1.00 0.00 O ATOM 19074 H1 WAT 7349 16.459 84.988 18.312 1.00 0.00 H ATOM 19075 H2 WAT 7349 16.549 83.487 18.477 1.00 0.00 H TER 19077 WAT 7349 ATOM 19077 O WAT 7350 77.850 125.242 64.755 1.00 0.00 O ATOM 19078 H1 WAT 7350 77.397 124.993 63.949 1.00 0.00 H ATOM 19079 H2 WAT 7350 78.001 124.415 65.212 1.00 0.00 H TER 19081 WAT 7350 ATOM 19081 O WAT 7351 53.831 136.455 107.466 1.00 0.00 O ATOM 19082 H1 WAT 7351 53.440 137.075 108.082 1.00 0.00 H ATOM 19083 H2 WAT 7351 54.393 135.902 108.007 1.00 0.00 H TER 19085 WAT 7351 ATOM 19085 O WAT 7352 124.221 63.764 112.802 1.00 0.00 O ATOM 19086 H1 WAT 7352 124.106 64.405 113.504 1.00 0.00 H ATOM 19087 H2 WAT 7352 124.604 63.001 113.235 1.00 0.00 H TER 19089 WAT 7352 ATOM 19089 O WAT 7353 29.308 130.362 154.105 1.00 0.00 O ATOM 19090 H1 WAT 7353 28.571 130.520 153.515 1.00 0.00 H ATOM 19091 H2 WAT 7353 29.977 129.960 153.552 1.00 0.00 H TER 19093 WAT 7353 ATOM 19093 O WAT 7354 59.674 133.117 107.849 1.00 0.00 O ATOM 19094 H1 WAT 7354 59.140 132.359 107.615 1.00 0.00 H ATOM 19095 H2 WAT 7354 59.853 133.551 107.015 1.00 0.00 H TER 19097 WAT 7354 ATOM 19097 O WAT 7355 32.245 24.819 26.759 1.00 0.00 O ATOM 19098 H1 WAT 7355 32.286 23.907 27.049 1.00 0.00 H ATOM 19099 H2 WAT 7355 31.862 25.288 27.500 1.00 0.00 H TER 19101 WAT 7355 ATOM 19101 O WAT 7356 67.983 119.119 17.116 1.00 0.00 O ATOM 19102 H1 WAT 7356 68.827 118.689 17.249 1.00 0.00 H ATOM 19103 H2 WAT 7356 67.428 118.783 17.820 1.00 0.00 H TER 19105 WAT 7356 ATOM 19105 O WAT 7357 128.130 71.399 137.980 1.00 0.00 O ATOM 19106 H1 WAT 7357 127.800 72.241 137.665 1.00 0.00 H ATOM 19107 H2 WAT 7357 129.045 71.570 138.204 1.00 0.00 H TER 19109 WAT 7357 ATOM 19109 O WAT 7358 130.552 16.566 63.110 1.00 0.00 O ATOM 19110 H1 WAT 7358 130.530 16.789 62.180 1.00 0.00 H ATOM 19111 H2 WAT 7358 130.829 17.373 63.543 1.00 0.00 H TER 19113 WAT 7358 ATOM 19113 O WAT 7359 84.370 23.659 155.506 1.00 0.00 O ATOM 19114 H1 WAT 7359 84.063 22.891 155.024 1.00 0.00 H ATOM 19115 H2 WAT 7359 85.116 23.978 154.998 1.00 0.00 H TER 19117 WAT 7359 ATOM 19117 O WAT 7360 62.218 33.200 80.830 1.00 0.00 O ATOM 19118 H1 WAT 7360 62.831 33.079 80.105 1.00 0.00 H ATOM 19119 H2 WAT 7360 61.355 33.209 80.415 1.00 0.00 H TER 19121 WAT 7360 ATOM 19121 O WAT 7361 16.130 33.938 116.320 1.00 0.00 O ATOM 19122 H1 WAT 7361 16.217 33.047 116.658 1.00 0.00 H ATOM 19123 H2 WAT 7361 15.314 33.926 115.820 1.00 0.00 H TER 19125 WAT 7361 ATOM 19125 O WAT 7362 64.215 125.311 61.726 1.00 0.00 O ATOM 19126 H1 WAT 7362 64.008 124.742 62.468 1.00 0.00 H ATOM 19127 H2 WAT 7362 63.677 124.975 61.009 1.00 0.00 H TER 19129 WAT 7362 ATOM 19129 O WAT 7363 110.474 33.632 4.184 1.00 0.00 O ATOM 19130 H1 WAT 7363 110.502 32.681 4.082 1.00 0.00 H ATOM 19131 H2 WAT 7363 111.273 33.846 4.666 1.00 0.00 H TER 19133 WAT 7363 ATOM 19133 O WAT 7364 2.678 72.804 119.983 1.00 0.00 O ATOM 19134 H1 WAT 7364 2.294 73.645 119.732 1.00 0.00 H ATOM 19135 H2 WAT 7364 3.364 73.032 120.610 1.00 0.00 H TER 19137 WAT 7364 ATOM 19137 O WAT 7365 106.958 120.420 85.433 1.00 0.00 O ATOM 19138 H1 WAT 7365 106.155 119.903 85.369 1.00 0.00 H ATOM 19139 H2 WAT 7365 106.659 121.300 85.662 1.00 0.00 H TER 19141 WAT 7365 ATOM 19141 O WAT 7366 27.907 14.570 20.500 1.00 0.00 O ATOM 19142 H1 WAT 7366 28.653 14.712 19.917 1.00 0.00 H ATOM 19143 H2 WAT 7366 28.291 14.194 21.293 1.00 0.00 H TER 19145 WAT 7366 ATOM 19145 O WAT 7367 77.066 1.889 84.620 1.00 0.00 O ATOM 19146 H1 WAT 7367 76.547 1.989 85.418 1.00 0.00 H ATOM 19147 H2 WAT 7367 77.528 1.060 84.738 1.00 0.00 H TER 19149 WAT 7367 ATOM 19149 O WAT 7368 23.794 58.592 102.473 1.00 0.00 O ATOM 19150 H1 WAT 7368 23.998 58.638 101.539 1.00 0.00 H ATOM 19151 H2 WAT 7368 24.584 58.913 102.907 1.00 0.00 H TER 19153 WAT 7368 ATOM 19153 O WAT 7369 40.050 94.703 137.617 1.00 0.00 O ATOM 19154 H1 WAT 7369 40.639 93.972 137.807 1.00 0.00 H ATOM 19155 H2 WAT 7369 39.956 94.693 136.665 1.00 0.00 H TER 19157 WAT 7369 ATOM 19157 O WAT 7370 53.315 94.591 138.562 1.00 0.00 O ATOM 19158 H1 WAT 7370 53.467 94.042 139.331 1.00 0.00 H ATOM 19159 H2 WAT 7370 52.640 95.211 138.839 1.00 0.00 H TER 19161 WAT 7370 ATOM 19161 O WAT 7371 33.403 10.357 134.545 1.00 0.00 O ATOM 19162 H1 WAT 7371 33.053 9.533 134.207 1.00 0.00 H ATOM 19163 H2 WAT 7371 33.223 10.994 133.854 1.00 0.00 H TER 19165 WAT 7371 ATOM 19165 O WAT 7372 91.175 97.834 1.986 1.00 0.00 O ATOM 19166 H1 WAT 7372 90.719 97.092 2.384 1.00 0.00 H ATOM 19167 H2 WAT 7372 92.066 97.780 2.331 1.00 0.00 H TER 19169 WAT 7372 ATOM 19169 O WAT 7373 125.865 75.261 86.832 1.00 0.00 O ATOM 19170 H1 WAT 7373 125.843 74.304 86.829 1.00 0.00 H ATOM 19171 H2 WAT 7373 125.726 75.506 85.917 1.00 0.00 H TER 19173 WAT 7373 ATOM 19173 O WAT 7374 68.679 4.286 14.175 1.00 0.00 O ATOM 19174 H1 WAT 7374 68.591 3.376 13.890 1.00 0.00 H ATOM 19175 H2 WAT 7374 69.573 4.527 13.933 1.00 0.00 H TER 19177 WAT 7374 ATOM 19177 O WAT 7375 56.452 101.177 141.490 1.00 0.00 O ATOM 19178 H1 WAT 7375 56.159 100.463 140.923 1.00 0.00 H ATOM 19179 H2 WAT 7375 57.049 101.688 140.943 1.00 0.00 H TER 19181 WAT 7375 ATOM 19181 O WAT 7376 135.740 57.073 68.887 1.00 0.00 O ATOM 19182 H1 WAT 7376 135.570 58.003 68.736 1.00 0.00 H ATOM 19183 H2 WAT 7376 136.694 57.011 68.945 1.00 0.00 H TER 19185 WAT 7376 ATOM 19185 O WAT 7377 124.420 15.806 132.958 1.00 0.00 O ATOM 19186 H1 WAT 7377 123.697 16.306 133.336 1.00 0.00 H ATOM 19187 H2 WAT 7377 124.188 15.710 132.034 1.00 0.00 H TER 19189 WAT 7377 ATOM 19189 O WAT 7378 59.418 124.135 150.027 1.00 0.00 O ATOM 19190 H1 WAT 7378 60.354 124.308 150.127 1.00 0.00 H ATOM 19191 H2 WAT 7378 59.040 124.355 150.878 1.00 0.00 H TER 19193 WAT 7378 ATOM 19193 O WAT 7379 121.480 50.101 138.727 1.00 0.00 O ATOM 19194 H1 WAT 7379 122.083 49.392 138.950 1.00 0.00 H ATOM 19195 H2 WAT 7379 121.504 50.144 137.771 1.00 0.00 H TER 19197 WAT 7379 ATOM 19197 O WAT 7380 120.589 40.496 72.260 1.00 0.00 O ATOM 19198 H1 WAT 7380 120.400 40.034 71.443 1.00 0.00 H ATOM 19199 H2 WAT 7380 121.521 40.710 72.204 1.00 0.00 H TER 19201 WAT 7380 ATOM 19201 O WAT 7381 66.319 9.123 82.423 1.00 0.00 O ATOM 19202 H1 WAT 7381 66.275 10.060 82.231 1.00 0.00 H ATOM 19203 H2 WAT 7381 66.449 9.078 83.370 1.00 0.00 H TER 19205 WAT 7381 ATOM 19205 O WAT 7382 47.158 14.733 17.903 1.00 0.00 O ATOM 19206 H1 WAT 7382 46.338 14.952 18.346 1.00 0.00 H ATOM 19207 H2 WAT 7382 47.375 13.856 18.220 1.00 0.00 H TER 19209 WAT 7382 ATOM 19209 O WAT 7383 82.002 24.731 1.089 1.00 0.00 O ATOM 19210 H1 WAT 7383 81.736 23.820 0.966 1.00 0.00 H ATOM 19211 H2 WAT 7383 81.700 24.951 1.970 1.00 0.00 H TER 19213 WAT 7383 ATOM 19213 O WAT 7384 79.666 28.916 75.659 1.00 0.00 O ATOM 19214 H1 WAT 7384 79.351 29.809 75.802 1.00 0.00 H ATOM 19215 H2 WAT 7384 78.941 28.359 75.942 1.00 0.00 H TER 19217 WAT 7384 ATOM 19217 O WAT 7385 58.692 125.964 63.989 1.00 0.00 O ATOM 19218 H1 WAT 7385 58.538 125.023 64.067 1.00 0.00 H ATOM 19219 H2 WAT 7385 59.641 126.045 63.895 1.00 0.00 H TER 19221 WAT 7385 ATOM 19221 O WAT 7386 49.269 62.460 77.241 1.00 0.00 O ATOM 19222 H1 WAT 7386 48.829 63.230 77.602 1.00 0.00 H ATOM 19223 H2 WAT 7386 49.430 61.899 77.999 1.00 0.00 H TER 19225 WAT 7386 ATOM 19225 O WAT 7387 134.657 100.966 91.880 1.00 0.00 O ATOM 19226 H1 WAT 7387 133.901 101.161 92.434 1.00 0.00 H ATOM 19227 H2 WAT 7387 135.153 101.784 91.855 1.00 0.00 H TER 19229 WAT 7387 ATOM 19229 O WAT 7388 31.067 111.880 84.918 1.00 0.00 O ATOM 19230 H1 WAT 7388 31.855 112.306 84.582 1.00 0.00 H ATOM 19231 H2 WAT 7388 31.390 111.091 85.355 1.00 0.00 H TER 19233 WAT 7388 ATOM 19233 O WAT 7389 73.873 27.147 16.816 1.00 0.00 O ATOM 19234 H1 WAT 7389 73.367 26.335 16.827 1.00 0.00 H ATOM 19235 H2 WAT 7389 73.819 27.450 15.909 1.00 0.00 H TER 19237 WAT 7389 ATOM 19237 O WAT 7390 138.942 133.131 19.586 1.00 0.00 O ATOM 19238 H1 WAT 7390 138.763 132.533 20.311 1.00 0.00 H ATOM 19239 H2 WAT 7390 138.081 133.328 19.219 1.00 0.00 H TER 19241 WAT 7390 ATOM 19241 O WAT 7391 145.265 37.322 149.864 1.00 0.00 O ATOM 19242 H1 WAT 7391 144.540 36.794 149.528 1.00 0.00 H ATOM 19243 H2 WAT 7391 145.673 37.693 149.082 1.00 0.00 H TER 19245 WAT 7391 ATOM 19245 O WAT 7392 28.171 50.956 59.284 1.00 0.00 O ATOM 19246 H1 WAT 7392 28.882 50.374 59.016 1.00 0.00 H ATOM 19247 H2 WAT 7392 28.077 51.571 58.557 1.00 0.00 H TER 19249 WAT 7392 ATOM 19249 O WAT 7393 44.609 115.385 138.831 1.00 0.00 O ATOM 19250 H1 WAT 7393 45.073 116.068 139.315 1.00 0.00 H ATOM 19251 H2 WAT 7393 43.922 115.853 138.356 1.00 0.00 H TER 19253 WAT 7393 ATOM 19253 O WAT 7394 129.230 99.214 10.103 1.00 0.00 O ATOM 19254 H1 WAT 7394 128.381 99.505 9.771 1.00 0.00 H ATOM 19255 H2 WAT 7394 129.843 99.407 9.394 1.00 0.00 H TER 19257 WAT 7394 ATOM 19257 O WAT 7395 50.971 120.655 61.405 1.00 0.00 O ATOM 19258 H1 WAT 7395 51.527 120.429 62.151 1.00 0.00 H ATOM 19259 H2 WAT 7395 51.501 121.257 60.885 1.00 0.00 H TER 19261 WAT 7395 ATOM 19261 O WAT 7396 134.879 51.686 154.164 1.00 0.00 O ATOM 19262 H1 WAT 7396 134.728 52.521 154.607 1.00 0.00 H ATOM 19263 H2 WAT 7396 134.184 51.634 153.508 1.00 0.00 H TER 19265 WAT 7396 ATOM 19265 O WAT 7397 57.084 13.364 154.371 1.00 0.00 O ATOM 19266 H1 WAT 7397 57.506 13.639 153.557 1.00 0.00 H ATOM 19267 H2 WAT 7397 56.199 13.111 154.108 1.00 0.00 H TER 19269 WAT 7397 ATOM 19269 O WAT 7398 126.570 131.632 58.710 1.00 0.00 O ATOM 19270 H1 WAT 7398 126.505 131.103 57.915 1.00 0.00 H ATOM 19271 H2 WAT 7398 126.090 131.132 59.370 1.00 0.00 H TER 19273 WAT 7398 ATOM 19273 O WAT 7399 72.520 139.170 11.541 1.00 0.00 O ATOM 19274 H1 WAT 7399 73.055 138.870 12.276 1.00 0.00 H ATOM 19275 H2 WAT 7399 73.152 139.514 10.910 1.00 0.00 H TER 19277 WAT 7399 ATOM 19277 O WAT 7400 127.726 86.714 4.635 1.00 0.00 O ATOM 19278 H1 WAT 7400 128.131 87.501 4.998 1.00 0.00 H ATOM 19279 H2 WAT 7400 127.218 86.349 5.359 1.00 0.00 H TER 19281 WAT 7400 ATOM 19281 O WAT 7401 31.557 5.927 119.386 1.00 0.00 O ATOM 19282 H1 WAT 7401 32.372 6.370 119.151 1.00 0.00 H ATOM 19283 H2 WAT 7401 30.918 6.634 119.478 1.00 0.00 H TER 19285 WAT 7401 ATOM 19285 O WAT 7402 87.619 32.054 129.037 1.00 0.00 O ATOM 19286 H1 WAT 7402 87.604 31.754 128.128 1.00 0.00 H ATOM 19287 H2 WAT 7402 87.820 31.267 129.545 1.00 0.00 H TER 19289 WAT 7402 ATOM 19289 O WAT 7403 87.567 24.767 63.853 1.00 0.00 O ATOM 19290 H1 WAT 7403 87.144 23.915 63.956 1.00 0.00 H ATOM 19291 H2 WAT 7403 87.056 25.357 64.407 1.00 0.00 H TER 19293 WAT 7403 ATOM 19293 O WAT 7404 21.838 112.464 15.545 1.00 0.00 O ATOM 19294 H1 WAT 7404 21.587 113.281 15.976 1.00 0.00 H ATOM 19295 H2 WAT 7404 21.349 111.787 16.012 1.00 0.00 H TER 19297 WAT 7404 ATOM 19297 O WAT 7405 145.477 18.680 65.545 1.00 0.00 O ATOM 19298 H1 WAT 7405 146.283 19.083 65.220 1.00 0.00 H ATOM 19299 H2 WAT 7405 145.752 18.187 66.318 1.00 0.00 H TER 19301 WAT 7405 ATOM 19301 O WAT 7406 105.597 128.556 141.801 1.00 0.00 O ATOM 19302 H1 WAT 7406 104.881 127.967 141.559 1.00 0.00 H ATOM 19303 H2 WAT 7406 105.797 129.033 140.995 1.00 0.00 H TER 19305 WAT 7406 ATOM 19305 O WAT 7407 16.898 68.257 92.782 1.00 0.00 O ATOM 19306 H1 WAT 7407 16.589 67.943 91.932 1.00 0.00 H ATOM 19307 H2 WAT 7407 17.852 68.264 92.702 1.00 0.00 H TER 19309 WAT 7407 ATOM 19309 O WAT 7408 85.133 121.951 63.883 1.00 0.00 O ATOM 19310 H1 WAT 7408 85.760 122.045 64.600 1.00 0.00 H ATOM 19311 H2 WAT 7408 85.346 121.106 63.487 1.00 0.00 H TER 19313 WAT 7408 ATOM 19313 O WAT 7409 87.204 51.489 157.527 1.00 0.00 O ATOM 19314 H1 WAT 7409 87.779 51.517 158.291 1.00 0.00 H ATOM 19315 H2 WAT 7409 86.320 51.460 157.894 1.00 0.00 H TER 19317 WAT 7409 ATOM 19317 O WAT 7410 64.364 11.975 138.842 1.00 0.00 O ATOM 19318 H1 WAT 7410 64.679 11.622 138.011 1.00 0.00 H ATOM 19319 H2 WAT 7410 65.146 12.030 139.391 1.00 0.00 H TER 19321 WAT 7410 ATOM 19321 O WAT 7411 81.231 75.510 129.234 1.00 0.00 O ATOM 19322 H1 WAT 7411 80.468 75.507 128.656 1.00 0.00 H ATOM 19323 H2 WAT 7411 81.849 76.107 128.813 1.00 0.00 H TER 19325 WAT 7411 ATOM 19325 O WAT 7412 51.548 32.573 88.406 1.00 0.00 O ATOM 19326 H1 WAT 7412 51.061 33.338 88.099 1.00 0.00 H ATOM 19327 H2 WAT 7412 52.338 32.937 88.806 1.00 0.00 H TER 19329 WAT 7412 ATOM 19329 O WAT 7413 131.213 16.476 125.158 1.00 0.00 O ATOM 19330 H1 WAT 7413 131.853 17.094 125.511 1.00 0.00 H ATOM 19331 H2 WAT 7413 131.067 16.769 124.259 1.00 0.00 H TER 19333 WAT 7413 ATOM 19333 O WAT 7414 125.180 85.886 125.902 1.00 0.00 O ATOM 19334 H1 WAT 7414 124.768 85.528 125.115 1.00 0.00 H ATOM 19335 H2 WAT 7414 125.074 86.834 125.817 1.00 0.00 H TER 19337 WAT 7414 ATOM 19337 O WAT 7415 36.191 89.642 105.020 1.00 0.00 O ATOM 19338 H1 WAT 7415 36.316 88.884 104.448 1.00 0.00 H ATOM 19339 H2 WAT 7415 35.343 89.490 105.437 1.00 0.00 H TER 19341 WAT 7415 ATOM 19341 O WAT 7416 107.140 141.394 115.116 1.00 0.00 O ATOM 19342 H1 WAT 7416 106.471 141.188 115.769 1.00 0.00 H ATOM 19343 H2 WAT 7416 106.656 141.468 114.293 1.00 0.00 H TER 19345 WAT 7416 ATOM 19345 O WAT 7417 88.516 44.232 140.911 1.00 0.00 O ATOM 19346 H1 WAT 7417 87.582 44.067 141.044 1.00 0.00 H ATOM 19347 H2 WAT 7417 88.724 43.781 140.093 1.00 0.00 H TER 19349 WAT 7417 ATOM 19349 O WAT 7418 114.387 19.129 68.349 1.00 0.00 O ATOM 19350 H1 WAT 7418 115.075 18.463 68.345 1.00 0.00 H ATOM 19351 H2 WAT 7418 113.587 18.644 68.549 1.00 0.00 H TER 19353 WAT 7418 ATOM 19353 O WAT 7419 136.379 21.360 89.783 1.00 0.00 O ATOM 19354 H1 WAT 7419 135.552 21.050 90.152 1.00 0.00 H ATOM 19355 H2 WAT 7419 137.019 21.222 90.481 1.00 0.00 H TER 19357 WAT 7419 ATOM 19357 O WAT 7420 39.040 82.089 155.736 1.00 0.00 O ATOM 19358 H1 WAT 7420 38.653 82.797 156.250 1.00 0.00 H ATOM 19359 H2 WAT 7420 39.982 82.172 155.882 1.00 0.00 H TER 19361 WAT 7420 ATOM 19361 O WAT 7421 81.742 86.579 137.562 1.00 0.00 O ATOM 19362 H1 WAT 7421 82.695 86.493 137.528 1.00 0.00 H ATOM 19363 H2 WAT 7421 81.427 86.055 136.825 1.00 0.00 H TER 19365 WAT 7421 ATOM 19365 O WAT 7422 19.371 105.152 154.538 1.00 0.00 O ATOM 19366 H1 WAT 7422 19.646 105.552 153.713 1.00 0.00 H ATOM 19367 H2 WAT 7422 18.621 104.607 154.300 1.00 0.00 H TER 19369 WAT 7422 ATOM 19369 O WAT 7423 20.919 61.308 80.418 1.00 0.00 O ATOM 19370 H1 WAT 7423 20.534 62.182 80.472 1.00 0.00 H ATOM 19371 H2 WAT 7423 20.935 60.997 81.323 1.00 0.00 H TER 19373 WAT 7423 ATOM 19373 O WAT 7424 100.683 115.891 96.886 1.00 0.00 O ATOM 19374 H1 WAT 7424 100.397 116.032 97.788 1.00 0.00 H ATOM 19375 H2 WAT 7424 100.021 115.308 96.513 1.00 0.00 H TER 19377 WAT 7424 ATOM 19377 O WAT 7425 126.637 61.096 104.617 1.00 0.00 O ATOM 19378 H1 WAT 7425 126.569 60.948 105.561 1.00 0.00 H ATOM 19379 H2 WAT 7425 126.680 62.048 104.527 1.00 0.00 H TER 19381 WAT 7425 ATOM 19381 O WAT 7426 1.457 81.947 19.403 1.00 0.00 O ATOM 19382 H1 WAT 7426 0.804 82.645 19.424 1.00 0.00 H ATOM 19383 H2 WAT 7426 2.036 82.138 20.142 1.00 0.00 H TER 19385 WAT 7426 ATOM 19385 O WAT 7427 79.996 2.126 67.589 1.00 0.00 O ATOM 19386 H1 WAT 7427 80.250 2.378 66.701 1.00 0.00 H ATOM 19387 H2 WAT 7427 80.507 1.337 67.769 1.00 0.00 H TER 19389 WAT 7427 ATOM 19389 O WAT 7428 21.403 66.435 119.945 1.00 0.00 O ATOM 19390 H1 WAT 7428 21.027 65.557 119.996 1.00 0.00 H ATOM 19391 H2 WAT 7428 22.050 66.378 119.242 1.00 0.00 H TER 19393 WAT 7428 ATOM 19393 O WAT 7429 46.270 58.990 8.333 1.00 0.00 O ATOM 19394 H1 WAT 7429 47.066 58.460 8.377 1.00 0.00 H ATOM 19395 H2 WAT 7429 46.049 59.167 9.248 1.00 0.00 H TER 19397 WAT 7429 ATOM 19397 O WAT 7430 52.761 63.136 141.827 1.00 0.00 O ATOM 19398 H1 WAT 7430 52.595 63.611 142.641 1.00 0.00 H ATOM 19399 H2 WAT 7430 51.910 63.108 141.388 1.00 0.00 H TER 19401 WAT 7430 ATOM 19401 O WAT 7431 64.111 138.675 108.091 1.00 0.00 O ATOM 19402 H1 WAT 7431 64.234 137.744 107.905 1.00 0.00 H ATOM 19403 H2 WAT 7431 63.246 138.878 107.735 1.00 0.00 H TER 19405 WAT 7431 ATOM 19405 O WAT 7432 64.328 137.014 7.977 1.00 0.00 O ATOM 19406 H1 WAT 7432 64.659 136.121 7.883 1.00 0.00 H ATOM 19407 H2 WAT 7432 63.950 137.038 8.856 1.00 0.00 H TER 19409 WAT 7432 ATOM 19409 O WAT 7433 23.557 56.830 7.233 1.00 0.00 O ATOM 19410 H1 WAT 7433 24.032 56.644 8.043 1.00 0.00 H ATOM 19411 H2 WAT 7433 22.928 57.509 7.475 1.00 0.00 H TER 19413 WAT 7433 ATOM 19413 O WAT 7434 37.295 22.020 56.129 1.00 0.00 O ATOM 19414 H1 WAT 7434 37.060 21.471 56.878 1.00 0.00 H ATOM 19415 H2 WAT 7434 37.146 21.460 55.366 1.00 0.00 H TER 19417 WAT 7434 ATOM 19417 O WAT 7435 47.292 31.010 150.165 1.00 0.00 O ATOM 19418 H1 WAT 7435 46.945 30.607 150.961 1.00 0.00 H ATOM 19419 H2 WAT 7435 46.555 31.504 149.805 1.00 0.00 H TER 19421 WAT 7435 ATOM 19421 O WAT 7436 107.638 42.293 148.430 1.00 0.00 O ATOM 19422 H1 WAT 7436 107.368 41.374 148.422 1.00 0.00 H ATOM 19423 H2 WAT 7436 106.920 42.756 147.998 1.00 0.00 H TER 19425 WAT 7436 ATOM 19425 O WAT 7437 62.016 99.478 82.467 1.00 0.00 O ATOM 19426 H1 WAT 7437 61.520 99.044 81.772 1.00 0.00 H ATOM 19427 H2 WAT 7437 62.096 100.385 82.174 1.00 0.00 H TER 19429 WAT 7437 ATOM 19429 O WAT 7438 80.306 115.282 70.846 1.00 0.00 O ATOM 19430 H1 WAT 7438 80.429 115.985 70.209 1.00 0.00 H ATOM 19431 H2 WAT 7438 80.277 114.483 70.319 1.00 0.00 H TER 19433 WAT 7438 ATOM 19433 O WAT 7439 95.718 79.430 90.587 1.00 0.00 O ATOM 19434 H1 WAT 7439 95.297 79.619 89.748 1.00 0.00 H ATOM 19435 H2 WAT 7439 95.741 78.474 90.633 1.00 0.00 H TER 19437 WAT 7439 ATOM 19437 O WAT 7440 83.130 79.069 18.622 1.00 0.00 O ATOM 19438 H1 WAT 7440 82.541 79.144 19.372 1.00 0.00 H ATOM 19439 H2 WAT 7440 83.440 79.962 18.470 1.00 0.00 H TER 19441 WAT 7440 ATOM 19441 O WAT 7441 118.504 117.623 142.397 1.00 0.00 O ATOM 19442 H1 WAT 7441 118.553 116.747 142.013 1.00 0.00 H ATOM 19443 H2 WAT 7441 118.147 117.480 143.273 1.00 0.00 H TER 19445 WAT 7441 ATOM 19445 O WAT 7442 50.314 47.251 135.608 1.00 0.00 O ATOM 19446 H1 WAT 7442 50.950 47.449 134.920 1.00 0.00 H ATOM 19447 H2 WAT 7442 50.216 46.300 135.577 1.00 0.00 H TER 19449 WAT 7442 ATOM 19449 O WAT 7443 5.535 96.968 149.244 1.00 0.00 O ATOM 19450 H1 WAT 7443 6.113 97.528 148.726 1.00 0.00 H ATOM 19451 H2 WAT 7443 6.085 96.655 149.962 1.00 0.00 H TER 19453 WAT 7443 ATOM 19453 O WAT 7444 85.758 122.443 120.646 1.00 0.00 O ATOM 19454 H1 WAT 7444 85.573 123.352 120.408 1.00 0.00 H ATOM 19455 H2 WAT 7444 86.185 122.501 121.501 1.00 0.00 H TER 19457 WAT 7444 ATOM 19457 O WAT 7445 55.285 138.706 157.432 1.00 0.00 O ATOM 19458 H1 WAT 7445 55.190 139.232 158.226 1.00 0.00 H ATOM 19459 H2 WAT 7445 55.607 139.321 156.774 1.00 0.00 H TER 19461 WAT 7445 ATOM 19461 O WAT 7446 133.700 68.339 14.741 1.00 0.00 O ATOM 19462 H1 WAT 7446 133.448 67.476 14.412 1.00 0.00 H ATOM 19463 H2 WAT 7446 134.644 68.387 14.590 1.00 0.00 H TER 19465 WAT 7446 ATOM 19465 O WAT 7447 110.860 34.509 153.465 1.00 0.00 O ATOM 19466 H1 WAT 7447 110.361 34.958 154.148 1.00 0.00 H ATOM 19467 H2 WAT 7447 110.317 34.586 152.681 1.00 0.00 H TER 19469 WAT 7447 ATOM 19469 O WAT 7448 5.020 1.886 102.274 1.00 0.00 O ATOM 19470 H1 WAT 7448 5.201 1.044 101.858 1.00 0.00 H ATOM 19471 H2 WAT 7448 4.095 2.050 102.090 1.00 0.00 H TER 19473 WAT 7448 ATOM 19473 O WAT 7449 31.795 91.630 149.704 1.00 0.00 O ATOM 19474 H1 WAT 7449 31.452 92.472 149.404 1.00 0.00 H ATOM 19475 H2 WAT 7449 31.878 91.730 150.652 1.00 0.00 H TER 19477 WAT 7449 ATOM 19477 O WAT 7450 139.777 92.783 86.030 1.00 0.00 O ATOM 19478 H1 WAT 7450 139.206 93.541 85.914 1.00 0.00 H ATOM 19479 H2 WAT 7450 139.983 92.778 86.965 1.00 0.00 H TER 19481 WAT 7450 ATOM 19481 O WAT 7451 135.144 137.735 15.776 1.00 0.00 O ATOM 19482 H1 WAT 7451 134.952 137.650 16.710 1.00 0.00 H ATOM 19483 H2 WAT 7451 135.550 136.901 15.539 1.00 0.00 H TER 19485 WAT 7451 ATOM 19485 O WAT 7452 10.398 2.331 119.587 1.00 0.00 O ATOM 19486 H1 WAT 7452 11.308 2.506 119.828 1.00 0.00 H ATOM 19487 H2 WAT 7452 9.950 3.167 119.720 1.00 0.00 H TER 19489 WAT 7452 ATOM 19489 O WAT 7453 93.655 69.626 110.574 1.00 0.00 O ATOM 19490 H1 WAT 7453 93.585 70.356 109.958 1.00 0.00 H ATOM 19491 H2 WAT 7453 94.590 69.566 110.768 1.00 0.00 H TER 19493 WAT 7453 ATOM 19493 O WAT 7454 44.454 122.490 123.079 1.00 0.00 O ATOM 19494 H1 WAT 7454 43.947 122.752 122.310 1.00 0.00 H ATOM 19495 H2 WAT 7454 44.045 121.674 123.369 1.00 0.00 H TER 19497 WAT 7454 ATOM 19497 O WAT 7455 19.655 86.576 19.468 1.00 0.00 O ATOM 19498 H1 WAT 7455 20.572 86.345 19.614 1.00 0.00 H ATOM 19499 H2 WAT 7455 19.206 86.292 20.264 1.00 0.00 H TER 19501 WAT 7455 ATOM 19501 O WAT 7456 112.729 114.943 89.029 1.00 0.00 O ATOM 19502 H1 WAT 7456 113.240 114.202 88.706 1.00 0.00 H ATOM 19503 H2 WAT 7456 113.352 115.461 89.538 1.00 0.00 H TER 19505 WAT 7456 ATOM 19505 O WAT 7457 86.157 34.736 73.403 1.00 0.00 O ATOM 19506 H1 WAT 7457 86.974 34.245 73.314 1.00 0.00 H ATOM 19507 H2 WAT 7457 86.366 35.609 73.070 1.00 0.00 H TER 19509 WAT 7457 ATOM 19509 O WAT 7458 133.665 35.548 158.502 1.00 0.00 O ATOM 19510 H1 WAT 7458 134.350 35.168 159.052 1.00 0.00 H ATOM 19511 H2 WAT 7458 133.952 36.449 158.352 1.00 0.00 H TER 19513 WAT 7458 ATOM 19513 O WAT 7459 43.961 72.534 131.653 1.00 0.00 O ATOM 19514 H1 WAT 7459 43.020 72.651 131.787 1.00 0.00 H ATOM 19515 H2 WAT 7459 44.090 71.586 131.674 1.00 0.00 H TER 19517 WAT 7459 ATOM 19517 O WAT 7460 76.155 105.277 133.177 1.00 0.00 O ATOM 19518 H1 WAT 7460 76.841 105.943 133.204 1.00 0.00 H ATOM 19519 H2 WAT 7460 75.518 105.614 132.547 1.00 0.00 H TER 19521 WAT 7460 ATOM 19521 O WAT 7461 34.503 124.985 125.797 1.00 0.00 O ATOM 19522 H1 WAT 7461 34.552 125.224 126.723 1.00 0.00 H ATOM 19523 H2 WAT 7461 35.239 125.443 125.392 1.00 0.00 H TER 19525 WAT 7461 ATOM 19525 O WAT 7462 94.820 93.883 90.046 1.00 0.00 O ATOM 19526 H1 WAT 7462 94.830 93.813 91.000 1.00 0.00 H ATOM 19527 H2 WAT 7462 95.661 94.283 89.826 1.00 0.00 H TER 19529 WAT 7462 ATOM 19529 O WAT 7463 140.460 63.106 135.784 1.00 0.00 O ATOM 19530 H1 WAT 7463 140.489 62.198 136.085 1.00 0.00 H ATOM 19531 H2 WAT 7463 139.827 63.099 135.065 1.00 0.00 H TER 19533 WAT 7463 ATOM 19533 O WAT 7464 80.991 29.449 93.772 1.00 0.00 O ATOM 19534 H1 WAT 7464 81.449 29.675 94.582 1.00 0.00 H ATOM 19535 H2 WAT 7464 81.284 30.105 93.140 1.00 0.00 H TER 19537 WAT 7464 ATOM 19537 O WAT 7465 67.904 142.244 15.773 1.00 0.00 O ATOM 19538 H1 WAT 7465 68.715 141.984 15.336 1.00 0.00 H ATOM 19539 H2 WAT 7465 67.530 141.422 16.092 1.00 0.00 H TER 19541 WAT 7465 ATOM 19541 O WAT 7466 128.188 75.201 69.065 1.00 0.00 O ATOM 19542 H1 WAT 7466 127.879 75.492 69.923 1.00 0.00 H ATOM 19543 H2 WAT 7466 128.234 76.002 68.543 1.00 0.00 H TER 19545 WAT 7466 ATOM 19545 O WAT 7467 128.377 14.201 136.232 1.00 0.00 O ATOM 19546 H1 WAT 7467 128.862 15.026 136.255 1.00 0.00 H ATOM 19547 H2 WAT 7467 128.778 13.669 136.919 1.00 0.00 H TER 19549 WAT 7467 ATOM 19549 O WAT 7468 144.755 102.701 90.185 1.00 0.00 O ATOM 19550 H1 WAT 7468 143.800 102.638 90.197 1.00 0.00 H ATOM 19551 H2 WAT 7468 145.029 102.343 91.029 1.00 0.00 H TER 19553 WAT 7468 ATOM 19553 O WAT 7469 57.688 25.059 106.846 1.00 0.00 O ATOM 19554 H1 WAT 7469 58.234 25.821 107.040 1.00 0.00 H ATOM 19555 H2 WAT 7469 57.570 25.086 105.896 1.00 0.00 H TER 19557 WAT 7469 ATOM 19557 O WAT 7470 114.041 108.402 102.755 1.00 0.00 O ATOM 19558 H1 WAT 7470 114.950 108.696 102.809 1.00 0.00 H ATOM 19559 H2 WAT 7470 113.709 108.795 101.948 1.00 0.00 H TER 19561 WAT 7470 ATOM 19561 O WAT 7471 65.379 45.589 119.031 1.00 0.00 O ATOM 19562 H1 WAT 7471 65.989 44.876 119.224 1.00 0.00 H ATOM 19563 H2 WAT 7471 65.122 45.444 118.121 1.00 0.00 H TER 19565 WAT 7471 ATOM 19565 O WAT 7472 19.368 21.050 2.133 1.00 0.00 O ATOM 19566 H1 WAT 7472 18.516 20.641 2.282 1.00 0.00 H ATOM 19567 H2 WAT 7472 19.484 21.641 2.877 1.00 0.00 H TER 19569 WAT 7472 ATOM 19569 O WAT 7473 106.551 52.270 66.308 1.00 0.00 O ATOM 19570 H1 WAT 7473 106.921 52.817 67.001 1.00 0.00 H ATOM 19571 H2 WAT 7473 107.219 52.267 65.623 1.00 0.00 H TER 19573 WAT 7473 ATOM 19573 O WAT 7474 65.690 38.762 3.487 1.00 0.00 O ATOM 19574 H1 WAT 7474 65.844 39.022 2.578 1.00 0.00 H ATOM 19575 H2 WAT 7474 66.509 38.970 3.937 1.00 0.00 H TER 19577 WAT 7474 ATOM 19577 O WAT 7475 92.285 110.499 134.863 1.00 0.00 O ATOM 19578 H1 WAT 7475 91.822 110.507 135.701 1.00 0.00 H ATOM 19579 H2 WAT 7475 92.788 109.684 134.875 1.00 0.00 H TER 19581 WAT 7475 ATOM 19581 O WAT 7476 25.270 60.788 91.156 1.00 0.00 O ATOM 19582 H1 WAT 7476 25.753 60.339 90.462 1.00 0.00 H ATOM 19583 H2 WAT 7476 25.245 60.159 91.877 1.00 0.00 H TER 19585 WAT 7476 ATOM 19585 O WAT 7477 134.817 43.691 14.631 1.00 0.00 O ATOM 19586 H1 WAT 7477 134.725 43.324 13.752 1.00 0.00 H ATOM 19587 H2 WAT 7477 134.017 44.201 14.762 1.00 0.00 H TER 19589 WAT 7477 ATOM 19589 O WAT 7478 91.810 144.103 63.497 1.00 0.00 O ATOM 19590 H1 WAT 7478 91.546 144.136 62.578 1.00 0.00 H ATOM 19591 H2 WAT 7478 91.065 144.470 63.973 1.00 0.00 H TER 19593 WAT 7478 ATOM 19593 O WAT 7479 61.893 7.912 142.008 1.00 0.00 O ATOM 19594 H1 WAT 7479 62.491 7.677 142.718 1.00 0.00 H ATOM 19595 H2 WAT 7479 62.332 8.629 141.552 1.00 0.00 H TER 19597 WAT 7479 ATOM 19597 O WAT 7480 92.449 56.172 111.325 1.00 0.00 O ATOM 19598 H1 WAT 7480 93.159 56.073 110.691 1.00 0.00 H ATOM 19599 H2 WAT 7480 92.563 55.437 111.928 1.00 0.00 H TER 19601 WAT 7480 ATOM 19601 O WAT 7481 44.025 124.130 100.242 1.00 0.00 O ATOM 19602 H1 WAT 7481 44.828 123.611 100.293 1.00 0.00 H ATOM 19603 H2 WAT 7481 43.896 124.280 99.305 1.00 0.00 H TER 19605 WAT 7481 ATOM 19605 O WAT 7482 57.876 116.470 89.818 1.00 0.00 O ATOM 19606 H1 WAT 7482 58.579 116.081 90.339 1.00 0.00 H ATOM 19607 H2 WAT 7482 57.228 115.771 89.730 1.00 0.00 H TER 19609 WAT 7482 ATOM 19609 O WAT 7483 15.913 126.306 93.537 1.00 0.00 O ATOM 19610 H1 WAT 7483 16.498 125.596 93.273 1.00 0.00 H ATOM 19611 H2 WAT 7483 15.708 126.764 92.722 1.00 0.00 H TER 19613 WAT 7483 ATOM 19613 O WAT 7484 71.854 102.220 109.656 1.00 0.00 O ATOM 19614 H1 WAT 7484 71.728 101.779 110.496 1.00 0.00 H ATOM 19615 H2 WAT 7484 72.803 102.309 109.573 1.00 0.00 H TER 19617 WAT 7484 ATOM 19617 O WAT 7485 69.845 0.239 80.693 1.00 0.00 O ATOM 19618 H1 WAT 7485 70.161 0.915 81.293 1.00 0.00 H ATOM 19619 H2 WAT 7485 69.125 -0.181 81.164 1.00 0.00 H TER 19621 WAT 7485 ATOM 19621 O WAT 7486 68.106 140.491 62.279 1.00 0.00 O ATOM 19622 H1 WAT 7486 68.000 139.593 62.593 1.00 0.00 H ATOM 19623 H2 WAT 7486 68.231 140.402 61.335 1.00 0.00 H TER 19625 WAT 7486 ATOM 19625 O WAT 7487 16.660 104.895 98.367 1.00 0.00 O ATOM 19626 H1 WAT 7487 17.248 104.366 98.906 1.00 0.00 H ATOM 19627 H2 WAT 7487 15.888 105.031 98.918 1.00 0.00 H TER 19629 WAT 7487 ATOM 19629 O WAT 7488 132.250 81.130 85.000 1.00 0.00 O ATOM 19630 H1 WAT 7488 133.195 81.133 85.152 1.00 0.00 H ATOM 19631 H2 WAT 7488 131.955 80.287 85.344 1.00 0.00 H TER 19633 WAT 7488 ATOM 19633 O WAT 7489 32.584 8.091 92.186 1.00 0.00 O ATOM 19634 H1 WAT 7489 31.975 7.353 92.168 1.00 0.00 H ATOM 19635 H2 WAT 7489 32.030 8.861 92.060 1.00 0.00 H TER 19637 WAT 7489 ATOM 19637 O WAT 7490 23.040 132.860 105.427 1.00 0.00 O ATOM 19638 H1 WAT 7490 23.143 131.932 105.215 1.00 0.00 H ATOM 19639 H2 WAT 7490 23.936 133.186 105.515 1.00 0.00 H TER 19641 WAT 7490 ATOM 19641 O WAT 7491 125.546 119.508 124.550 1.00 0.00 O ATOM 19642 H1 WAT 7491 126.374 119.913 124.809 1.00 0.00 H ATOM 19643 H2 WAT 7491 125.455 118.754 125.133 1.00 0.00 H TER 19645 WAT 7491 ATOM 19645 O WAT 7492 36.932 125.516 158.280 1.00 0.00 O ATOM 19646 H1 WAT 7492 37.166 126.375 157.928 1.00 0.00 H ATOM 19647 H2 WAT 7492 36.796 124.969 157.506 1.00 0.00 H TER 19649 WAT 7492 ATOM 19649 O WAT 7493 136.501 91.013 75.951 1.00 0.00 O ATOM 19650 H1 WAT 7493 136.829 90.984 75.052 1.00 0.00 H ATOM 19651 H2 WAT 7493 135.593 91.306 75.865 1.00 0.00 H TER 19653 WAT 7493 ATOM 19653 O WAT 7494 137.137 21.967 99.585 1.00 0.00 O ATOM 19654 H1 WAT 7494 136.659 22.760 99.830 1.00 0.00 H ATOM 19655 H2 WAT 7494 136.714 21.268 100.083 1.00 0.00 H TER 19657 WAT 7494 ATOM 19657 O WAT 7495 19.666 85.914 65.044 1.00 0.00 O ATOM 19658 H1 WAT 7495 20.302 85.207 65.156 1.00 0.00 H ATOM 19659 H2 WAT 7495 20.075 86.672 65.463 1.00 0.00 H TER 19661 WAT 7495 ATOM 19661 O WAT 7496 120.230 37.520 105.134 1.00 0.00 O ATOM 19662 H1 WAT 7496 120.236 38.168 105.838 1.00 0.00 H ATOM 19663 H2 WAT 7496 120.658 37.960 104.399 1.00 0.00 H TER 19665 WAT 7496 ATOM 19665 O WAT 7497 67.096 32.546 153.576 1.00 0.00 O ATOM 19666 H1 WAT 7497 66.807 32.286 154.451 1.00 0.00 H ATOM 19667 H2 WAT 7497 66.341 32.999 153.200 1.00 0.00 H TER 19669 WAT 7497 ATOM 19669 O WAT 7498 119.506 106.161 62.801 1.00 0.00 O ATOM 19670 H1 WAT 7498 120.144 106.859 62.657 1.00 0.00 H ATOM 19671 H2 WAT 7498 119.953 105.364 62.514 1.00 0.00 H TER 19673 WAT 7498 ATOM 19673 O WAT 7499 70.818 92.497 70.920 1.00 0.00 O ATOM 19674 H1 WAT 7499 71.156 91.789 71.468 1.00 0.00 H ATOM 19675 H2 WAT 7499 70.808 93.262 71.496 1.00 0.00 H TER 19677 WAT 7499 ATOM 19677 O WAT 7500 67.326 18.539 84.385 1.00 0.00 O ATOM 19678 H1 WAT 7500 67.878 17.778 84.563 1.00 0.00 H ATOM 19679 H2 WAT 7500 67.851 19.287 84.669 1.00 0.00 H TER 19681 WAT 7500 ATOM 19681 O WAT 7501 26.067 56.994 65.434 1.00 0.00 O ATOM 19682 H1 WAT 7501 27.014 56.995 65.568 1.00 0.00 H ATOM 19683 H2 WAT 7501 25.960 56.985 64.482 1.00 0.00 H TER 19685 WAT 7501 ATOM 19685 O WAT 7502 129.723 1.268 137.930 1.00 0.00 O ATOM 19686 H1 WAT 7502 130.096 1.682 138.708 1.00 0.00 H ATOM 19687 H2 WAT 7502 128.893 1.724 137.792 1.00 0.00 H TER 19689 WAT 7502 ATOM 19689 O WAT 7503 76.486 31.023 112.639 1.00 0.00 O ATOM 19690 H1 WAT 7503 76.034 31.006 111.796 1.00 0.00 H ATOM 19691 H2 WAT 7503 76.119 30.282 113.122 1.00 0.00 H TER 19693 WAT 7503 ATOM 19693 O WAT 7504 9.135 81.056 3.488 1.00 0.00 O ATOM 19694 H1 WAT 7504 8.588 80.661 4.167 1.00 0.00 H ATOM 19695 H2 WAT 7504 9.246 81.965 3.768 1.00 0.00 H TER 19697 WAT 7504 ATOM 19697 O WAT 7505 111.492 91.240 77.825 1.00 0.00 O ATOM 19698 H1 WAT 7505 111.958 91.877 77.283 1.00 0.00 H ATOM 19699 H2 WAT 7505 110.901 90.796 77.217 1.00 0.00 H TER 19701 WAT 7505 ATOM 19701 O WAT 7506 70.957 21.658 125.639 1.00 0.00 O ATOM 19702 H1 WAT 7506 70.980 22.290 124.920 1.00 0.00 H ATOM 19703 H2 WAT 7506 71.510 22.047 126.317 1.00 0.00 H TER 19705 WAT 7506 ATOM 19705 O WAT 7507 20.682 108.501 61.205 1.00 0.00 O ATOM 19706 H1 WAT 7507 19.780 108.729 60.980 1.00 0.00 H ATOM 19707 H2 WAT 7507 21.065 108.200 60.382 1.00 0.00 H TER 19709 WAT 7507 ATOM 19709 O WAT 7508 113.759 53.652 148.724 1.00 0.00 O ATOM 19710 H1 WAT 7508 113.030 53.114 148.416 1.00 0.00 H ATOM 19711 H2 WAT 7508 113.361 54.496 148.935 1.00 0.00 H TER 19713 WAT 7508 ATOM 19713 O WAT 7509 109.536 106.203 105.783 1.00 0.00 O ATOM 19714 H1 WAT 7509 110.485 106.081 105.815 1.00 0.00 H ATOM 19715 H2 WAT 7509 109.420 107.129 105.571 1.00 0.00 H TER 19717 WAT 7509 ATOM 19717 O WAT 7510 11.068 134.628 102.134 1.00 0.00 O ATOM 19718 H1 WAT 7510 11.382 134.986 101.304 1.00 0.00 H ATOM 19719 H2 WAT 7510 10.150 134.412 101.969 1.00 0.00 H TER 19721 WAT 7510 ATOM 19721 O WAT 7511 67.720 117.598 62.624 1.00 0.00 O ATOM 19722 H1 WAT 7511 68.171 117.204 61.877 1.00 0.00 H ATOM 19723 H2 WAT 7511 67.734 118.538 62.443 1.00 0.00 H TER 19725 WAT 7511 ATOM 19725 O WAT 7512 97.371 110.684 123.312 1.00 0.00 O ATOM 19726 H1 WAT 7512 96.615 111.176 123.632 1.00 0.00 H ATOM 19727 H2 WAT 7512 97.115 110.393 122.437 1.00 0.00 H TER 19729 WAT 7512 ATOM 19729 O WAT 7513 37.466 47.538 71.100 1.00 0.00 O ATOM 19730 H1 WAT 7513 36.595 47.183 71.282 1.00 0.00 H ATOM 19731 H2 WAT 7513 37.715 47.986 71.909 1.00 0.00 H TER 19733 WAT 7513 ATOM 19733 O WAT 7514 107.780 51.461 120.432 1.00 0.00 O ATOM 19734 H1 WAT 7514 107.712 50.627 120.898 1.00 0.00 H ATOM 19735 H2 WAT 7514 106.880 51.667 120.179 1.00 0.00 H TER 19737 WAT 7514 ATOM 19737 O WAT 7515 113.772 108.354 138.737 1.00 0.00 O ATOM 19738 H1 WAT 7515 113.661 109.303 138.673 1.00 0.00 H ATOM 19739 H2 WAT 7515 112.980 107.993 138.338 1.00 0.00 H TER 19741 WAT 7515 ATOM 19741 O WAT 7516 26.971 45.028 141.445 1.00 0.00 O ATOM 19742 H1 WAT 7516 26.981 44.089 141.628 1.00 0.00 H ATOM 19743 H2 WAT 7516 26.763 45.088 140.512 1.00 0.00 H TER 19745 WAT 7516 ATOM 19745 O WAT 7517 92.338 79.794 27.512 1.00 0.00 O ATOM 19746 H1 WAT 7517 92.505 80.736 27.516 1.00 0.00 H ATOM 19747 H2 WAT 7517 91.409 79.715 27.730 1.00 0.00 H TER 19749 WAT 7517 ATOM 19749 O WAT 7518 120.210 81.172 132.860 1.00 0.00 O ATOM 19750 H1 WAT 7518 120.973 80.679 133.164 1.00 0.00 H ATOM 19751 H2 WAT 7518 119.951 80.735 132.049 1.00 0.00 H TER 19753 WAT 7518 ATOM 19753 O WAT 7519 131.249 64.703 95.250 1.00 0.00 O ATOM 19754 H1 WAT 7519 130.792 65.450 95.636 1.00 0.00 H ATOM 19755 H2 WAT 7519 131.312 64.067 95.962 1.00 0.00 H TER 19757 WAT 7519 ATOM 19757 O WAT 7520 46.181 0.312 123.647 1.00 0.00 O ATOM 19758 H1 WAT 7520 46.985 0.320 124.165 1.00 0.00 H ATOM 19759 H2 WAT 7520 46.346 0.932 122.937 1.00 0.00 H TER 19761 WAT 7520 ATOM 19761 O WAT 7521 5.814 115.015 133.577 1.00 0.00 O ATOM 19762 H1 WAT 7521 5.509 114.451 132.866 1.00 0.00 H ATOM 19763 H2 WAT 7521 5.533 115.894 133.322 1.00 0.00 H TER 19765 WAT 7521 ATOM 19765 O WAT 7522 131.291 109.225 3.457 1.00 0.00 O ATOM 19766 H1 WAT 7522 131.906 108.496 3.372 1.00 0.00 H ATOM 19767 H2 WAT 7522 130.444 108.853 3.214 1.00 0.00 H TER 19769 WAT 7522 ATOM 19769 O WAT 7523 38.265 56.327 138.510 1.00 0.00 O ATOM 19770 H1 WAT 7523 37.342 56.441 138.737 1.00 0.00 H ATOM 19771 H2 WAT 7523 38.333 56.652 137.612 1.00 0.00 H TER 19773 WAT 7523 ATOM 19773 O WAT 7524 121.273 10.881 133.909 1.00 0.00 O ATOM 19774 H1 WAT 7524 121.473 11.248 133.048 1.00 0.00 H ATOM 19775 H2 WAT 7524 121.518 9.958 133.839 1.00 0.00 H TER 19777 WAT 7524 ATOM 19777 O WAT 7525 74.703 94.972 99.499 1.00 0.00 O ATOM 19778 H1 WAT 7525 75.001 95.761 99.952 1.00 0.00 H ATOM 19779 H2 WAT 7525 75.044 95.063 98.609 1.00 0.00 H TER 19781 WAT 7525 ATOM 19781 O WAT 7526 91.953 46.591 101.127 1.00 0.00 O ATOM 19782 H1 WAT 7526 92.138 45.797 100.626 1.00 0.00 H ATOM 19783 H2 WAT 7526 92.745 47.121 101.040 1.00 0.00 H TER 19785 WAT 7526 ATOM 19785 O WAT 7527 135.182 93.376 121.943 1.00 0.00 O ATOM 19786 H1 WAT 7527 135.297 93.509 122.884 1.00 0.00 H ATOM 19787 H2 WAT 7527 135.771 94.012 121.538 1.00 0.00 H TER 19789 WAT 7527 ATOM 19789 O WAT 7528 20.002 46.443 109.442 1.00 0.00 O ATOM 19790 H1 WAT 7528 20.713 46.129 108.884 1.00 0.00 H ATOM 19791 H2 WAT 7528 20.254 47.337 109.672 1.00 0.00 H TER 19793 WAT 7528 ATOM 19793 O WAT 7529 63.734 34.981 100.017 1.00 0.00 O ATOM 19794 H1 WAT 7529 64.176 35.667 99.516 1.00 0.00 H ATOM 19795 H2 WAT 7529 64.245 34.906 100.823 1.00 0.00 H TER 19797 WAT 7529 ATOM 19797 O WAT 7530 134.372 64.176 8.262 1.00 0.00 O ATOM 19798 H1 WAT 7530 134.835 64.772 7.673 1.00 0.00 H ATOM 19799 H2 WAT 7530 134.956 64.083 9.015 1.00 0.00 H TER 19801 WAT 7530 ATOM 19801 O WAT 7531 44.845 21.538 5.729 1.00 0.00 O ATOM 19802 H1 WAT 7531 45.509 21.838 6.350 1.00 0.00 H ATOM 19803 H2 WAT 7531 45.341 21.084 5.048 1.00 0.00 H TER 19805 WAT 7531 ATOM 19805 O WAT 7532 82.708 96.620 128.380 1.00 0.00 O ATOM 19806 H1 WAT 7532 81.924 96.983 128.792 1.00 0.00 H ATOM 19807 H2 WAT 7532 83.327 97.350 128.357 1.00 0.00 H TER 19809 WAT 7532 ATOM 19809 O WAT 7533 18.025 42.238 16.395 1.00 0.00 O ATOM 19810 H1 WAT 7533 18.333 42.276 15.489 1.00 0.00 H ATOM 19811 H2 WAT 7533 17.709 41.341 16.503 1.00 0.00 H TER 19813 WAT 7533 ATOM 19813 O WAT 7534 19.606 61.268 95.668 1.00 0.00 O ATOM 19814 H1 WAT 7534 19.041 60.502 95.768 1.00 0.00 H ATOM 19815 H2 WAT 7534 20.443 60.911 95.372 1.00 0.00 H TER 19817 WAT 7534 ATOM 19817 O WAT 7535 2.756 61.204 57.988 1.00 0.00 O ATOM 19818 H1 WAT 7535 3.519 61.269 57.413 1.00 0.00 H ATOM 19819 H2 WAT 7535 2.629 60.263 58.111 1.00 0.00 H TER 19821 WAT 7535 ATOM 19821 O WAT 7536 34.533 115.781 141.113 1.00 0.00 O ATOM 19822 H1 WAT 7536 34.591 116.633 141.546 1.00 0.00 H ATOM 19823 H2 WAT 7536 35.350 115.706 140.620 1.00 0.00 H TER 19825 WAT 7536 ATOM 19825 O WAT 7537 51.262 76.773 125.727 1.00 0.00 O ATOM 19826 H1 WAT 7537 51.744 76.834 126.552 1.00 0.00 H ATOM 19827 H2 WAT 7537 50.343 76.864 125.980 1.00 0.00 H TER 19829 WAT 7537 ATOM 19829 O WAT 7538 118.830 2.420 149.729 1.00 0.00 O ATOM 19830 H1 WAT 7538 119.349 2.015 149.035 1.00 0.00 H ATOM 19831 H2 WAT 7538 119.001 1.881 150.502 1.00 0.00 H TER 19833 WAT 7538 ATOM 19833 O WAT 7539 114.019 36.495 98.638 1.00 0.00 O ATOM 19834 H1 WAT 7539 114.969 36.552 98.732 1.00 0.00 H ATOM 19835 H2 WAT 7539 113.842 36.851 97.768 1.00 0.00 H TER 19837 WAT 7539 ATOM 19837 O WAT 7540 69.722 95.561 142.848 1.00 0.00 O ATOM 19838 H1 WAT 7540 70.526 96.069 142.961 1.00 0.00 H ATOM 19839 H2 WAT 7540 69.114 96.165 142.421 1.00 0.00 H TER 19841 WAT 7540 ATOM 19841 O WAT 7541 34.130 111.540 2.479 1.00 0.00 O ATOM 19842 H1 WAT 7541 34.450 110.673 2.231 1.00 0.00 H ATOM 19843 H2 WAT 7541 33.207 111.404 2.690 1.00 0.00 H TER 19845 WAT 7541 ATOM 19845 O WAT 7542 141.299 52.931 12.324 1.00 0.00 O ATOM 19846 H1 WAT 7542 141.443 53.842 12.068 1.00 0.00 H ATOM 19847 H2 WAT 7542 141.232 52.958 13.279 1.00 0.00 H TER 19849 WAT 7542 ATOM 19849 O WAT 7543 13.539 59.672 91.789 1.00 0.00 O ATOM 19850 H1 WAT 7543 13.372 59.062 91.071 1.00 0.00 H ATOM 19851 H2 WAT 7543 13.317 59.180 92.579 1.00 0.00 H TER 19853 WAT 7543 ATOM 19853 O WAT 7544 18.736 67.864 65.332 1.00 0.00 O ATOM 19854 H1 WAT 7544 18.330 68.317 66.071 1.00 0.00 H ATOM 19855 H2 WAT 7544 19.675 67.907 65.512 1.00 0.00 H TER 19857 WAT 7544 ATOM 19857 O WAT 7545 91.999 107.332 126.040 1.00 0.00 O ATOM 19858 H1 WAT 7545 92.536 106.597 125.746 1.00 0.00 H ATOM 19859 H2 WAT 7545 91.113 106.973 126.100 1.00 0.00 H TER 19861 WAT 7545 ATOM 19861 O WAT 7546 29.273 142.084 21.454 1.00 0.00 O ATOM 19862 H1 WAT 7546 29.936 141.740 22.052 1.00 0.00 H ATOM 19863 H2 WAT 7546 28.831 142.770 21.955 1.00 0.00 H TER 19865 WAT 7546 ATOM 19865 O WAT 7547 20.208 42.641 78.168 1.00 0.00 O ATOM 19866 H1 WAT 7547 19.586 41.982 78.476 1.00 0.00 H ATOM 19867 H2 WAT 7547 20.993 42.495 78.697 1.00 0.00 H TER 19869 WAT 7547 ATOM 19869 O WAT 7548 119.158 142.792 71.723 1.00 0.00 O ATOM 19870 H1 WAT 7548 119.872 142.802 71.085 1.00 0.00 H ATOM 19871 H2 WAT 7548 118.917 143.712 71.827 1.00 0.00 H TER 19873 WAT 7548 ATOM 19873 O WAT 7549 52.097 94.873 132.455 1.00 0.00 O ATOM 19874 H1 WAT 7549 52.654 95.620 132.674 1.00 0.00 H ATOM 19875 H2 WAT 7549 51.607 94.696 133.258 1.00 0.00 H TER 19877 WAT 7549 ATOM 19877 O WAT 7550 109.435 68.801 89.391 1.00 0.00 O ATOM 19878 H1 WAT 7550 109.246 69.735 89.481 1.00 0.00 H ATOM 19879 H2 WAT 7550 110.308 68.696 89.770 1.00 0.00 H TER 19881 WAT 7550 ATOM 19881 O WAT 7551 78.589 99.450 131.603 1.00 0.00 O ATOM 19882 H1 WAT 7551 77.986 99.908 131.018 1.00 0.00 H ATOM 19883 H2 WAT 7551 79.449 99.567 131.201 1.00 0.00 H TER 19885 WAT 7551 ATOM 19885 O WAT 7552 145.080 4.573 61.629 1.00 0.00 O ATOM 19886 H1 WAT 7552 144.681 3.802 61.227 1.00 0.00 H ATOM 19887 H2 WAT 7552 145.771 4.830 61.018 1.00 0.00 H TER 19889 WAT 7552 ATOM 19889 O WAT 7553 85.682 40.268 109.680 1.00 0.00 O ATOM 19890 H1 WAT 7553 85.329 40.341 110.566 1.00 0.00 H ATOM 19891 H2 WAT 7553 86.435 39.683 109.769 1.00 0.00 H TER 19893 WAT 7553 ATOM 19893 O WAT 7554 108.591 10.131 103.669 1.00 0.00 O ATOM 19894 H1 WAT 7554 108.366 10.424 102.786 1.00 0.00 H ATOM 19895 H2 WAT 7554 107.760 9.836 104.043 1.00 0.00 H TER 19897 WAT 7554 ATOM 19897 O WAT 7555 74.009 60.263 156.515 1.00 0.00 O ATOM 19898 H1 WAT 7555 74.159 59.659 157.243 1.00 0.00 H ATOM 19899 H2 WAT 7555 73.455 59.772 155.908 1.00 0.00 H TER 19901 WAT 7555 ATOM 19901 O WAT 7556 66.446 5.152 67.524 1.00 0.00 O ATOM 19902 H1 WAT 7556 65.619 5.368 67.094 1.00 0.00 H ATOM 19903 H2 WAT 7556 66.460 5.701 68.308 1.00 0.00 H TER 19905 WAT 7556 ATOM 19905 O WAT 7557 50.387 88.236 146.091 1.00 0.00 O ATOM 19906 H1 WAT 7557 51.089 88.603 146.628 1.00 0.00 H ATOM 19907 H2 WAT 7557 50.740 88.235 145.201 1.00 0.00 H TER 19909 WAT 7557 ATOM 19909 O WAT 7558 143.294 75.135 114.389 1.00 0.00 O ATOM 19910 H1 WAT 7558 142.597 74.524 114.628 1.00 0.00 H ATOM 19911 H2 WAT 7558 144.015 74.918 114.980 1.00 0.00 H TER 19913 WAT 7558 ATOM 19913 O WAT 7559 102.650 99.588 13.206 1.00 0.00 O ATOM 19914 H1 WAT 7559 103.193 98.892 12.837 1.00 0.00 H ATOM 19915 H2 WAT 7559 102.178 99.168 13.926 1.00 0.00 H TER 19917 WAT 7559 ATOM 19917 O WAT 7560 135.536 71.431 66.828 1.00 0.00 O ATOM 19918 H1 WAT 7560 136.454 71.180 66.726 1.00 0.00 H ATOM 19919 H2 WAT 7560 135.207 71.503 65.932 1.00 0.00 H TER 19921 WAT 7560 ATOM 19921 O WAT 7561 85.143 16.445 128.752 1.00 0.00 O ATOM 19922 H1 WAT 7561 84.335 16.209 128.297 1.00 0.00 H ATOM 19923 H2 WAT 7561 85.353 17.322 128.430 1.00 0.00 H TER 19925 WAT 7561 ATOM 19925 O WAT 7562 36.359 22.365 131.077 1.00 0.00 O ATOM 19926 H1 WAT 7562 37.279 22.201 130.871 1.00 0.00 H ATOM 19927 H2 WAT 7562 36.035 22.878 130.337 1.00 0.00 H TER 19929 WAT 7562 ATOM 19929 O WAT 7563 136.978 135.902 73.087 1.00 0.00 O ATOM 19930 H1 WAT 7563 137.324 135.134 72.632 1.00 0.00 H ATOM 19931 H2 WAT 7563 137.700 136.530 73.078 1.00 0.00 H TER 19933 WAT 7563 ATOM 19933 O WAT 7564 35.149 104.398 14.285 1.00 0.00 O ATOM 19934 H1 WAT 7564 35.414 103.710 14.895 1.00 0.00 H ATOM 19935 H2 WAT 7564 35.762 104.319 13.554 1.00 0.00 H TER 19937 WAT 7564 ATOM 19937 O WAT 7565 81.137 70.228 107.159 1.00 0.00 O ATOM 19938 H1 WAT 7565 80.411 70.100 107.769 1.00 0.00 H ATOM 19939 H2 WAT 7565 80.715 70.379 106.313 1.00 0.00 H TER 19941 WAT 7565 ATOM 19941 O WAT 7566 32.700 44.665 63.138 1.00 0.00 O ATOM 19942 H1 WAT 7566 32.449 43.742 63.093 1.00 0.00 H ATOM 19943 H2 WAT 7566 33.259 44.798 62.373 1.00 0.00 H TER 19945 WAT 7566 ATOM 19945 O WAT 7567 28.709 31.564 96.552 1.00 0.00 O ATOM 19946 H1 WAT 7567 28.086 31.859 97.216 1.00 0.00 H ATOM 19947 H2 WAT 7567 28.565 30.620 96.490 1.00 0.00 H TER 19949 WAT 7567 ATOM 19949 O WAT 7568 75.569 19.203 118.287 1.00 0.00 O ATOM 19950 H1 WAT 7568 76.439 19.541 118.076 1.00 0.00 H ATOM 19951 H2 WAT 7568 75.357 19.598 119.133 1.00 0.00 H TER 19953 WAT 7568 ATOM 19953 O WAT 7569 140.010 144.839 127.174 1.00 0.00 O ATOM 19954 H1 WAT 7569 140.856 144.861 127.622 1.00 0.00 H ATOM 19955 H2 WAT 7569 139.927 143.937 126.864 1.00 0.00 H TER 19957 WAT 7569 ATOM 19957 O WAT 7570 7.566 26.325 101.053 1.00 0.00 O ATOM 19958 H1 WAT 7570 8.089 26.473 100.264 1.00 0.00 H ATOM 19959 H2 WAT 7570 6.740 25.968 100.729 1.00 0.00 H TER 19961 WAT 7570 ATOM 19961 O WAT 7571 107.933 36.701 101.922 1.00 0.00 O ATOM 19962 H1 WAT 7571 108.650 36.307 102.419 1.00 0.00 H ATOM 19963 H2 WAT 7571 108.364 37.320 101.331 1.00 0.00 H TER 19965 WAT 7571 ATOM 19965 O WAT 7572 29.923 90.838 76.812 1.00 0.00 O ATOM 19966 H1 WAT 7572 30.559 90.309 77.293 1.00 0.00 H ATOM 19967 H2 WAT 7572 29.774 91.601 77.370 1.00 0.00 H TER 19969 WAT 7572 ATOM 19969 O WAT 7573 23.828 127.921 152.780 1.00 0.00 O ATOM 19970 H1 WAT 7573 24.542 127.864 153.415 1.00 0.00 H ATOM 19971 H2 WAT 7573 23.697 128.860 152.652 1.00 0.00 H TER 19973 WAT 7573 ATOM 19973 O WAT 7574 83.404 104.177 144.504 1.00 0.00 O ATOM 19974 H1 WAT 7574 82.850 103.585 143.995 1.00 0.00 H ATOM 19975 H2 WAT 7574 84.152 104.353 143.933 1.00 0.00 H TER 19977 WAT 7574 ATOM 19977 O WAT 7575 48.316 70.869 76.917 1.00 0.00 O ATOM 19978 H1 WAT 7575 48.244 70.465 76.052 1.00 0.00 H ATOM 19979 H2 WAT 7575 48.929 71.594 76.792 1.00 0.00 H TER 19981 WAT 7575 ATOM 19981 O WAT 7576 48.112 31.669 156.753 1.00 0.00 O ATOM 19982 H1 WAT 7576 48.961 31.810 156.335 1.00 0.00 H ATOM 19983 H2 WAT 7576 48.245 30.908 157.317 1.00 0.00 H TER 19985 WAT 7576 ATOM 19985 O WAT 7577 118.664 43.952 55.608 1.00 0.00 O ATOM 19986 H1 WAT 7577 118.116 43.426 56.189 1.00 0.00 H ATOM 19987 H2 WAT 7577 118.139 44.058 54.815 1.00 0.00 H TER 19989 WAT 7577 ATOM 19989 O WAT 7578 117.157 133.328 21.472 1.00 0.00 O ATOM 19990 H1 WAT 7578 116.525 134.008 21.238 1.00 0.00 H ATOM 19991 H2 WAT 7578 116.970 132.610 20.868 1.00 0.00 H TER 19993 WAT 7578 ATOM 19993 O WAT 7579 136.167 73.139 57.276 1.00 0.00 O ATOM 19994 H1 WAT 7579 136.912 72.777 56.797 1.00 0.00 H ATOM 19995 H2 WAT 7579 136.278 72.818 58.171 1.00 0.00 H TER 19997 WAT 7579 ATOM 19997 O WAT 7580 62.059 91.424 3.035 1.00 0.00 O ATOM 19998 H1 WAT 7580 62.238 92.006 2.296 1.00 0.00 H ATOM 19999 H2 WAT 7580 62.554 90.629 2.839 1.00 0.00 H TER 20001 WAT 7580 ATOM 20001 O WAT 7581 26.887 45.956 114.468 1.00 0.00 O ATOM 20002 H1 WAT 7581 27.776 45.637 114.626 1.00 0.00 H ATOM 20003 H2 WAT 7581 27.010 46.799 114.032 1.00 0.00 H TER 20005 WAT 7581 ATOM 20005 O WAT 7582 31.222 74.602 9.461 1.00 0.00 O ATOM 20006 H1 WAT 7582 30.362 74.259 9.216 1.00 0.00 H ATOM 20007 H2 WAT 7582 31.189 74.670 10.416 1.00 0.00 H TER 20009 WAT 7582 ATOM 20009 O WAT 7583 38.433 49.983 104.887 1.00 0.00 O ATOM 20010 H1 WAT 7583 37.731 49.349 105.037 1.00 0.00 H ATOM 20011 H2 WAT 7583 37.978 50.808 104.716 1.00 0.00 H TER 20013 WAT 7583 ATOM 20013 O WAT 7584 7.800 75.678 78.457 1.00 0.00 O ATOM 20014 H1 WAT 7584 8.023 75.412 79.349 1.00 0.00 H ATOM 20015 H2 WAT 7584 7.758 76.634 78.495 1.00 0.00 H TER 20017 WAT 7584 ATOM 20017 O WAT 7585 31.491 64.585 154.119 1.00 0.00 O ATOM 20018 H1 WAT 7585 30.872 64.453 154.837 1.00 0.00 H ATOM 20019 H2 WAT 7585 31.898 65.430 154.306 1.00 0.00 H TER 20021 WAT 7585 ATOM 20021 O WAT 7586 80.972 117.796 101.835 1.00 0.00 O ATOM 20022 H1 WAT 7586 81.488 118.201 102.532 1.00 0.00 H ATOM 20023 H2 WAT 7586 81.433 118.028 101.029 1.00 0.00 H TER 20025 WAT 7586 ATOM 20025 O WAT 7587 86.284 42.614 134.243 1.00 0.00 O ATOM 20026 H1 WAT 7587 85.665 42.006 134.646 1.00 0.00 H ATOM 20027 H2 WAT 7587 86.657 43.099 134.979 1.00 0.00 H TER 20029 WAT 7587 ATOM 20029 O WAT 7588 120.928 11.320 99.924 1.00 0.00 O ATOM 20030 H1 WAT 7588 121.713 11.864 99.985 1.00 0.00 H ATOM 20031 H2 WAT 7588 120.246 11.833 100.359 1.00 0.00 H TER 20033 WAT 7588 ATOM 20033 O WAT 7589 13.623 60.703 149.573 1.00 0.00 O ATOM 20034 H1 WAT 7589 13.365 61.333 148.901 1.00 0.00 H ATOM 20035 H2 WAT 7589 14.578 60.760 149.601 1.00 0.00 H TER 20037 WAT 7589 ATOM 20037 O WAT 7590 120.158 29.719 76.662 1.00 0.00 O ATOM 20038 H1 WAT 7590 120.670 30.506 76.477 1.00 0.00 H ATOM 20039 H2 WAT 7590 120.643 29.276 77.358 1.00 0.00 H TER 20041 WAT 7590 ATOM 20041 O WAT 7591 37.067 88.513 141.551 1.00 0.00 O ATOM 20042 H1 WAT 7591 37.808 87.925 141.697 1.00 0.00 H ATOM 20043 H2 WAT 7591 36.356 88.134 142.069 1.00 0.00 H TER 20045 WAT 7591 ATOM 20045 O WAT 7592 120.615 96.856 1.752 1.00 0.00 O ATOM 20046 H1 WAT 7592 121.333 96.248 1.576 1.00 0.00 H ATOM 20047 H2 WAT 7592 120.813 97.623 1.215 1.00 0.00 H TER 20049 WAT 7592 ATOM 20049 O WAT 7593 139.884 3.795 127.461 1.00 0.00 O ATOM 20050 H1 WAT 7593 139.416 2.961 127.407 1.00 0.00 H ATOM 20051 H2 WAT 7593 139.906 3.996 128.397 1.00 0.00 H TER 20053 WAT 7593 ATOM 20053 O WAT 7594 28.593 121.163 109.836 1.00 0.00 O ATOM 20054 H1 WAT 7594 29.045 120.353 110.072 1.00 0.00 H ATOM 20055 H2 WAT 7594 28.041 121.358 110.592 1.00 0.00 H TER 20057 WAT 7594 ATOM 20057 O WAT 7595 98.795 139.501 143.429 1.00 0.00 O ATOM 20058 H1 WAT 7595 98.504 138.719 143.898 1.00 0.00 H ATOM 20059 H2 WAT 7595 98.206 139.563 142.678 1.00 0.00 H TER 20061 WAT 7595 ATOM 20061 O WAT 7596 139.042 69.195 15.895 1.00 0.00 O ATOM 20062 H1 WAT 7596 138.737 68.956 15.020 1.00 0.00 H ATOM 20063 H2 WAT 7596 138.461 68.720 16.489 1.00 0.00 H TER 20065 WAT 7596 ATOM 20065 O WAT 7597 18.619 110.801 126.619 1.00 0.00 O ATOM 20066 H1 WAT 7597 18.466 109.931 126.986 1.00 0.00 H ATOM 20067 H2 WAT 7597 19.532 110.784 126.333 1.00 0.00 H TER 20069 WAT 7597 ATOM 20069 O WAT 7598 105.941 73.997 154.181 1.00 0.00 O ATOM 20070 H1 WAT 7598 105.701 73.683 153.309 1.00 0.00 H ATOM 20071 H2 WAT 7598 105.265 74.639 154.399 1.00 0.00 H TER 20073 WAT 7598 ATOM 20073 O WAT 7599 63.240 139.950 13.017 1.00 0.00 O ATOM 20074 H1 WAT 7599 62.540 139.332 13.228 1.00 0.00 H ATOM 20075 H2 WAT 7599 63.993 139.639 13.518 1.00 0.00 H TER 20077 WAT 7599 ATOM 20077 O WAT 7600 93.231 128.670 145.126 1.00 0.00 O ATOM 20078 H1 WAT 7600 93.559 129.541 144.902 1.00 0.00 H ATOM 20079 H2 WAT 7600 92.332 128.821 145.418 1.00 0.00 H TER 20081 WAT 7600 ATOM 20081 O WAT 7601 22.045 126.430 23.960 1.00 0.00 O ATOM 20082 H1 WAT 7601 21.303 126.250 23.384 1.00 0.00 H ATOM 20083 H2 WAT 7601 21.749 127.154 24.513 1.00 0.00 H TER 20085 WAT 7601 ATOM 20085 O WAT 7602 126.084 24.594 87.560 1.00 0.00 O ATOM 20086 H1 WAT 7602 126.922 25.031 87.412 1.00 0.00 H ATOM 20087 H2 WAT 7602 126.292 23.660 87.529 1.00 0.00 H TER 20089 WAT 7602 ATOM 20089 O WAT 7603 97.531 134.516 151.643 1.00 0.00 O ATOM 20090 H1 WAT 7603 97.669 135.164 150.952 1.00 0.00 H ATOM 20091 H2 WAT 7603 97.362 135.035 152.429 1.00 0.00 H TER 20093 WAT 7603 ATOM 20093 O WAT 7604 21.467 20.863 149.035 1.00 0.00 O ATOM 20094 H1 WAT 7604 21.692 20.354 149.814 1.00 0.00 H ATOM 20095 H2 WAT 7604 21.829 20.359 148.306 1.00 0.00 H TER 20097 WAT 7604 ATOM 20097 O WAT 7605 121.054 130.345 16.938 1.00 0.00 O ATOM 20098 H1 WAT 7605 120.889 130.882 17.714 1.00 0.00 H ATOM 20099 H2 WAT 7605 121.601 129.627 17.256 1.00 0.00 H TER 20101 WAT 7605 ATOM 20101 O WAT 7606 72.929 145.804 127.423 1.00 0.00 O ATOM 20102 H1 WAT 7606 73.886 145.783 127.424 1.00 0.00 H ATOM 20103 H2 WAT 7606 72.686 145.627 126.514 1.00 0.00 H TER 20105 WAT 7606 ATOM 20105 O WAT 7607 98.527 81.073 153.545 1.00 0.00 O ATOM 20106 H1 WAT 7607 98.279 81.074 152.621 1.00 0.00 H ATOM 20107 H2 WAT 7607 99.054 81.866 153.652 1.00 0.00 H TER 20109 WAT 7607 ATOM 20109 O WAT 7608 68.747 53.098 75.383 1.00 0.00 O ATOM 20110 H1 WAT 7608 68.807 52.628 74.551 1.00 0.00 H ATOM 20111 H2 WAT 7608 68.360 53.943 75.153 1.00 0.00 H TER 20113 WAT 7608 ATOM 20113 O WAT 7609 71.280 140.466 110.045 1.00 0.00 O ATOM 20114 H1 WAT 7609 72.170 140.160 110.221 1.00 0.00 H ATOM 20115 H2 WAT 7609 70.981 139.924 109.315 1.00 0.00 H TER 20117 WAT 7609 ATOM 20117 O WAT 7610 89.255 135.815 100.167 1.00 0.00 O ATOM 20118 H1 WAT 7610 89.420 135.330 100.975 1.00 0.00 H ATOM 20119 H2 WAT 7610 90.111 135.867 99.740 1.00 0.00 H TER 20121 WAT 7610 ATOM 20121 O WAT 7611 30.026 15.260 113.220 1.00 0.00 O ATOM 20122 H1 WAT 7611 30.539 15.246 112.412 1.00 0.00 H ATOM 20123 H2 WAT 7611 29.976 16.186 113.456 1.00 0.00 H TER 20125 WAT 7611 ATOM 20125 O WAT 7612 100.096 33.814 74.948 1.00 0.00 O ATOM 20126 H1 WAT 7612 99.833 33.315 75.722 1.00 0.00 H ATOM 20127 H2 WAT 7612 99.331 33.787 74.374 1.00 0.00 H TER 20129 WAT 7612 ATOM 20129 O WAT 7613 121.820 5.211 150.374 1.00 0.00 O ATOM 20130 H1 WAT 7613 121.204 5.784 150.831 1.00 0.00 H ATOM 20131 H2 WAT 7613 122.633 5.715 150.336 1.00 0.00 H TER 20133 WAT 7613 ATOM 20133 O WAT 7614 58.171 4.010 85.418 1.00 0.00 O ATOM 20134 H1 WAT 7614 58.929 3.539 85.074 1.00 0.00 H ATOM 20135 H2 WAT 7614 58.299 4.914 85.130 1.00 0.00 H TER 20137 WAT 7614 ATOM 20137 O WAT 7615 31.952 81.163 83.096 1.00 0.00 O ATOM 20138 H1 WAT 7615 31.427 81.110 83.895 1.00 0.00 H ATOM 20139 H2 WAT 7615 32.732 80.642 83.286 1.00 0.00 H TER 20141 WAT 7615 ATOM 20141 O WAT 7616 40.689 70.930 9.068 1.00 0.00 O ATOM 20142 H1 WAT 7616 40.390 70.596 9.914 1.00 0.00 H ATOM 20143 H2 WAT 7616 40.671 71.882 9.166 1.00 0.00 H TER 20145 WAT 7616 ATOM 20145 O WAT 7617 94.095 6.201 126.234 1.00 0.00 O ATOM 20146 H1 WAT 7617 93.351 6.024 126.811 1.00 0.00 H ATOM 20147 H2 WAT 7617 93.729 6.157 125.351 1.00 0.00 H TER 20149 WAT 7617 ATOM 20149 O WAT 7618 59.802 12.862 129.278 1.00 0.00 O ATOM 20150 H1 WAT 7618 60.677 12.563 129.031 1.00 0.00 H ATOM 20151 H2 WAT 7618 59.931 13.762 129.576 1.00 0.00 H TER 20153 WAT 7618 ATOM 20153 O WAT 7619 99.841 92.285 117.249 1.00 0.00 O ATOM 20154 H1 WAT 7619 100.729 91.955 117.107 1.00 0.00 H ATOM 20155 H2 WAT 7619 99.954 93.029 117.842 1.00 0.00 H TER 20157 WAT 7619 ATOM 20157 O WAT 7620 58.253 64.747 19.735 1.00 0.00 O ATOM 20158 H1 WAT 7620 59.137 64.380 19.720 1.00 0.00 H ATOM 20159 H2 WAT 7620 57.891 64.535 18.875 1.00 0.00 H TER 20161 WAT 7620 ATOM 20161 O WAT 7621 138.495 33.001 67.664 1.00 0.00 O ATOM 20162 H1 WAT 7621 139.208 32.467 68.014 1.00 0.00 H ATOM 20163 H2 WAT 7621 138.933 33.739 67.240 1.00 0.00 H TER 20165 WAT 7621 ATOM 20165 O WAT 7622 60.368 38.574 144.027 1.00 0.00 O ATOM 20166 H1 WAT 7622 59.620 38.142 143.614 1.00 0.00 H ATOM 20167 H2 WAT 7622 60.725 39.141 143.344 1.00 0.00 H TER 20169 WAT 7622 ATOM 20169 O WAT 7623 142.171 134.790 13.941 1.00 0.00 O ATOM 20170 H1 WAT 7623 141.291 134.490 13.713 1.00 0.00 H ATOM 20171 H2 WAT 7623 142.238 134.642 14.884 1.00 0.00 H TER 20173 WAT 7623 ATOM 20173 O WAT 7624 108.088 55.870 117.955 1.00 0.00 O ATOM 20174 H1 WAT 7624 107.919 54.928 117.944 1.00 0.00 H ATOM 20175 H2 WAT 7624 107.432 56.238 117.364 1.00 0.00 H TER 20177 WAT 7624 ATOM 20177 O WAT 7625 114.812 75.736 113.998 1.00 0.00 O ATOM 20178 H1 WAT 7625 114.021 75.466 114.465 1.00 0.00 H ATOM 20179 H2 WAT 7625 114.662 75.462 113.093 1.00 0.00 H TER 20181 WAT 7625 ATOM 20181 O WAT 7626 7.751 119.085 155.531 1.00 0.00 O ATOM 20182 H1 WAT 7626 7.231 118.838 156.295 1.00 0.00 H ATOM 20183 H2 WAT 7626 7.393 118.559 154.816 1.00 0.00 H TER 20185 WAT 7626 ATOM 20185 O WAT 7627 49.573 21.376 69.246 1.00 0.00 O ATOM 20186 H1 WAT 7627 48.788 21.579 68.737 1.00 0.00 H ATOM 20187 H2 WAT 7627 49.935 22.230 69.480 1.00 0.00 H TER 20189 WAT 7627 ATOM 20189 O WAT 7628 15.474 58.735 83.341 1.00 0.00 O ATOM 20190 H1 WAT 7628 15.820 59.622 83.240 1.00 0.00 H ATOM 20191 H2 WAT 7628 16.175 58.167 83.020 1.00 0.00 H TER 20193 WAT 7628 ATOM 20193 O WAT 7629 143.582 80.180 76.504 1.00 0.00 O ATOM 20194 H1 WAT 7629 142.631 80.258 76.588 1.00 0.00 H ATOM 20195 H2 WAT 7629 143.860 81.024 76.149 1.00 0.00 H TER 20197 WAT 7629 ATOM 20197 O WAT 7630 19.437 43.798 125.263 1.00 0.00 O ATOM 20198 H1 WAT 7630 19.711 42.882 125.218 1.00 0.00 H ATOM 20199 H2 WAT 7630 19.186 43.928 126.178 1.00 0.00 H TER 20201 WAT 7630 ATOM 20201 O WAT 7631 60.998 132.239 17.770 1.00 0.00 O ATOM 20202 H1 WAT 7631 61.496 132.818 18.347 1.00 0.00 H ATOM 20203 H2 WAT 7631 61.433 131.390 17.847 1.00 0.00 H TER 20205 WAT 7631 ATOM 20205 O WAT 7632 30.293 6.772 108.693 1.00 0.00 O ATOM 20206 H1 WAT 7632 30.602 6.523 109.564 1.00 0.00 H ATOM 20207 H2 WAT 7632 30.334 5.962 108.184 1.00 0.00 H TER 20209 WAT 7632 ATOM 20209 O WAT 7633 140.375 43.455 9.778 1.00 0.00 O ATOM 20210 H1 WAT 7633 141.108 43.570 10.384 1.00 0.00 H ATOM 20211 H2 WAT 7633 139.911 42.685 10.106 1.00 0.00 H TER 20213 WAT 7633 ATOM 20213 O WAT 7634 116.917 106.821 61.770 1.00 0.00 O ATOM 20214 H1 WAT 7634 117.805 106.674 62.095 1.00 0.00 H ATOM 20215 H2 WAT 7634 116.485 105.972 61.860 1.00 0.00 H TER 20217 WAT 7634 ATOM 20217 O WAT 7635 143.214 95.727 116.630 1.00 0.00 O ATOM 20218 H1 WAT 7635 142.263 95.824 116.582 1.00 0.00 H ATOM 20219 H2 WAT 7635 143.347 94.855 117.000 1.00 0.00 H TER 20221 WAT 7635 ATOM 20221 O WAT 7636 32.207 90.798 0.473 1.00 0.00 O ATOM 20222 H1 WAT 7636 31.594 91.274 -0.087 1.00 0.00 H ATOM 20223 H2 WAT 7636 31.922 89.886 0.417 1.00 0.00 H TER 20225 WAT 7636 ATOM 20225 O WAT 7637 132.168 38.209 82.129 1.00 0.00 O ATOM 20226 H1 WAT 7637 132.048 38.033 83.062 1.00 0.00 H ATOM 20227 H2 WAT 7637 132.932 37.687 81.883 1.00 0.00 H TER 20229 WAT 7637 ATOM 20229 O WAT 7638 85.189 28.462 86.261 1.00 0.00 O ATOM 20230 H1 WAT 7638 85.602 28.276 85.418 1.00 0.00 H ATOM 20231 H2 WAT 7638 85.743 29.136 86.656 1.00 0.00 H TER 20233 WAT 7638 ATOM 20233 O WAT 7639 16.027 93.343 120.711 1.00 0.00 O ATOM 20234 H1 WAT 7639 16.788 93.817 120.375 1.00 0.00 H ATOM 20235 H2 WAT 7639 15.905 93.685 121.597 1.00 0.00 H TER 20237 WAT 7639 ATOM 20237 O WAT 7640 90.111 113.675 114.303 1.00 0.00 O ATOM 20238 H1 WAT 7640 90.836 114.269 114.107 1.00 0.00 H ATOM 20239 H2 WAT 7640 90.146 113.017 113.609 1.00 0.00 H TER 20241 WAT 7640 ATOM 20241 O WAT 7641 92.513 27.788 4.020 1.00 0.00 O ATOM 20242 H1 WAT 7641 91.885 27.438 3.388 1.00 0.00 H ATOM 20243 H2 WAT 7641 93.359 27.444 3.733 1.00 0.00 H TER 20245 WAT 7641 ATOM 20245 O WAT 7642 59.383 26.409 58.657 1.00 0.00 O ATOM 20246 H1 WAT 7642 58.779 26.860 58.067 1.00 0.00 H ATOM 20247 H2 WAT 7642 58.835 25.777 59.122 1.00 0.00 H TER 20249 WAT 7642 ATOM 20249 O WAT 7643 63.313 96.001 18.760 1.00 0.00 O ATOM 20250 H1 WAT 7643 62.634 95.676 18.169 1.00 0.00 H ATOM 20251 H2 WAT 7643 62.879 96.066 19.610 1.00 0.00 H TER 20253 WAT 7643 ATOM 20253 O WAT 7644 108.438 15.127 158.600 1.00 0.00 O ATOM 20254 H1 WAT 7644 107.487 15.116 158.490 1.00 0.00 H ATOM 20255 H2 WAT 7644 108.743 15.785 157.976 1.00 0.00 H TER 20257 WAT 7644 ATOM 20257 O WAT 7645 108.786 24.733 101.216 1.00 0.00 O ATOM 20258 H1 WAT 7645 107.833 24.775 101.137 1.00 0.00 H ATOM 20259 H2 WAT 7645 109.024 23.902 100.806 1.00 0.00 H TER 20261 WAT 7645 ATOM 20261 O WAT 7646 85.901 91.512 128.383 1.00 0.00 O ATOM 20262 H1 WAT 7646 86.148 91.671 127.472 1.00 0.00 H ATOM 20263 H2 WAT 7646 86.313 92.224 128.872 1.00 0.00 H TER 20265 WAT 7646 ATOM 20265 O WAT 7647 15.690 78.203 152.113 1.00 0.00 O ATOM 20266 H1 WAT 7647 15.620 78.511 153.017 1.00 0.00 H ATOM 20267 H2 WAT 7647 15.463 77.274 152.159 1.00 0.00 H TER 20269 WAT 7647 ATOM 20269 O WAT 7648 98.298 31.307 136.477 1.00 0.00 O ATOM 20270 H1 WAT 7648 98.669 31.814 137.199 1.00 0.00 H ATOM 20271 H2 WAT 7648 97.362 31.508 136.500 1.00 0.00 H TER 20273 WAT 7648 ATOM 20273 O WAT 7649 88.071 53.668 109.394 1.00 0.00 O ATOM 20274 H1 WAT 7649 87.613 53.534 108.564 1.00 0.00 H ATOM 20275 H2 WAT 7649 87.582 54.369 109.826 1.00 0.00 H TER 20277 WAT 7649 ATOM 20277 O WAT 7650 47.073 36.059 147.819 1.00 0.00 O ATOM 20278 H1 WAT 7650 46.559 36.557 147.183 1.00 0.00 H ATOM 20279 H2 WAT 7650 46.840 36.439 148.665 1.00 0.00 H TER 20281 WAT 7650 ATOM 20281 O WAT 7651 104.132 72.138 123.141 1.00 0.00 O ATOM 20282 H1 WAT 7651 104.939 72.457 122.737 1.00 0.00 H ATOM 20283 H2 WAT 7651 103.437 72.647 122.723 1.00 0.00 H TER 20285 WAT 7651 ATOM 20285 O WAT 7652 121.833 126.258 117.835 1.00 0.00 O ATOM 20286 H1 WAT 7652 122.262 125.784 117.123 1.00 0.00 H ATOM 20287 H2 WAT 7652 120.897 126.167 117.654 1.00 0.00 H TER 20289 WAT 7652 ATOM 20289 O WAT 7653 134.411 74.165 67.514 1.00 0.00 O ATOM 20290 H1 WAT 7653 135.134 74.762 67.324 1.00 0.00 H ATOM 20291 H2 WAT 7653 134.654 73.347 67.081 1.00 0.00 H TER 20293 WAT 7653 ATOM 20293 O WAT 7654 47.100 96.448 125.698 1.00 0.00 O ATOM 20294 H1 WAT 7654 47.225 96.843 126.561 1.00 0.00 H ATOM 20295 H2 WAT 7654 46.420 95.787 125.834 1.00 0.00 H TER 20297 WAT 7654 ATOM 20297 O WAT 7655 75.068 96.066 75.553 1.00 0.00 O ATOM 20298 H1 WAT 7655 74.961 95.115 75.570 1.00 0.00 H ATOM 20299 H2 WAT 7655 75.975 96.201 75.278 1.00 0.00 H TER 20301 WAT 7655 ATOM 20301 O WAT 7656 101.446 73.991 103.759 1.00 0.00 O ATOM 20302 H1 WAT 7656 102.268 73.535 103.575 1.00 0.00 H ATOM 20303 H2 WAT 7656 101.639 74.532 104.524 1.00 0.00 H TER 20305 WAT 7656 ATOM 20305 O WAT 7657 58.256 84.851 95.927 1.00 0.00 O ATOM 20306 H1 WAT 7657 58.418 85.119 96.831 1.00 0.00 H ATOM 20307 H2 WAT 7657 57.713 85.551 95.564 1.00 0.00 H TER 20309 WAT 7657 ATOM 20309 O WAT 7658 37.919 36.617 138.509 1.00 0.00 O ATOM 20310 H1 WAT 7658 38.744 36.969 138.174 1.00 0.00 H ATOM 20311 H2 WAT 7658 37.270 37.289 138.299 1.00 0.00 H TER 20313 WAT 7658 ATOM 20313 O WAT 7659 46.232 116.393 116.921 1.00 0.00 O ATOM 20314 H1 WAT 7659 46.216 116.549 117.865 1.00 0.00 H ATOM 20315 H2 WAT 7659 45.517 116.929 116.578 1.00 0.00 H TER 20317 WAT 7659 ATOM 20317 O WAT 7660 125.009 56.358 70.066 1.00 0.00 O ATOM 20318 H1 WAT 7660 125.121 56.794 69.221 1.00 0.00 H ATOM 20319 H2 WAT 7660 125.542 55.565 69.998 1.00 0.00 H TER 20321 WAT 7660 ATOM 20321 O WAT 7661 36.799 135.472 59.916 1.00 0.00 O ATOM 20322 H1 WAT 7661 37.365 136.237 60.021 1.00 0.00 H ATOM 20323 H2 WAT 7661 36.831 135.278 58.979 1.00 0.00 H TER 20325 WAT 7661 ATOM 20325 O WAT 7662 32.189 38.763 75.876 1.00 0.00 O ATOM 20326 H1 WAT 7662 31.898 39.137 75.045 1.00 0.00 H ATOM 20327 H2 WAT 7662 31.803 37.887 75.893 1.00 0.00 H TER 20329 WAT 7662 ATOM 20329 O WAT 7663 89.711 109.402 59.885 1.00 0.00 O ATOM 20330 H1 WAT 7663 88.812 109.712 59.773 1.00 0.00 H ATOM 20331 H2 WAT 7663 89.938 109.015 59.040 1.00 0.00 H TER 20333 WAT 7663 ATOM 20333 O WAT 7664 38.057 90.109 107.130 1.00 0.00 O ATOM 20334 H1 WAT 7664 37.383 90.123 106.450 1.00 0.00 H ATOM 20335 H2 WAT 7664 38.165 89.181 107.340 1.00 0.00 H TER 20337 WAT 7664 ATOM 20337 O WAT 7665 47.504 90.736 150.977 1.00 0.00 O ATOM 20338 H1 WAT 7665 48.320 90.306 151.232 1.00 0.00 H ATOM 20339 H2 WAT 7665 46.925 90.018 150.721 1.00 0.00 H TER 20341 WAT 7665 ATOM 20341 O WAT 7666 112.737 2.500 65.795 1.00 0.00 O ATOM 20342 H1 WAT 7666 112.685 2.814 66.698 1.00 0.00 H ATOM 20343 H2 WAT 7666 112.093 1.794 65.749 1.00 0.00 H TER 20345 WAT 7666 ATOM 20345 O WAT 7667 136.778 104.161 9.010 1.00 0.00 O ATOM 20346 H1 WAT 7667 136.198 103.860 8.311 1.00 0.00 H ATOM 20347 H2 WAT 7667 137.645 104.189 8.607 1.00 0.00 H TER 20349 WAT 7667 ATOM 20349 O WAT 7668 42.965 36.093 17.959 1.00 0.00 O ATOM 20350 H1 WAT 7668 42.385 36.125 18.720 1.00 0.00 H ATOM 20351 H2 WAT 7668 43.815 36.380 18.293 1.00 0.00 H TER 20353 WAT 7668 ATOM 20353 O WAT 7669 101.433 75.657 108.935 1.00 0.00 O ATOM 20354 H1 WAT 7669 101.437 75.642 107.978 1.00 0.00 H ATOM 20355 H2 WAT 7669 100.699 75.093 109.180 1.00 0.00 H TER 20357 WAT 7669 ATOM 20357 O WAT 7670 77.203 118.936 75.074 1.00 0.00 O ATOM 20358 H1 WAT 7670 77.682 118.259 74.596 1.00 0.00 H ATOM 20359 H2 WAT 7670 77.747 119.719 74.991 1.00 0.00 H TER 20361 WAT 7670 ATOM 20361 O WAT 7671 84.546 136.559 111.523 1.00 0.00 O ATOM 20362 H1 WAT 7671 84.959 135.726 111.749 1.00 0.00 H ATOM 20363 H2 WAT 7671 83.963 136.348 110.793 1.00 0.00 H TER 20365 WAT 7671 ATOM 20365 O WAT 7672 90.708 73.981 97.461 1.00 0.00 O ATOM 20366 H1 WAT 7672 90.151 73.270 97.143 1.00 0.00 H ATOM 20367 H2 WAT 7672 90.127 74.741 97.501 1.00 0.00 H TER 20369 WAT 7672 ATOM 20369 O WAT 7673 83.867 131.901 121.167 1.00 0.00 O ATOM 20370 H1 WAT 7673 84.579 131.413 120.754 1.00 0.00 H ATOM 20371 H2 WAT 7673 84.282 132.359 121.898 1.00 0.00 H TER 20373 WAT 7673 ATOM 20373 O WAT 7674 32.352 73.861 77.005 1.00 0.00 O ATOM 20374 H1 WAT 7674 31.408 73.715 77.068 1.00 0.00 H ATOM 20375 H2 WAT 7674 32.445 74.542 76.339 1.00 0.00 H TER 20377 WAT 7674 ATOM 20377 O WAT 7675 43.912 88.962 71.817 1.00 0.00 O ATOM 20378 H1 WAT 7675 44.569 89.591 72.115 1.00 0.00 H ATOM 20379 H2 WAT 7675 44.116 88.157 72.293 1.00 0.00 H TER 20381 WAT 7675 ATOM 20381 O WAT 7676 8.715 101.095 10.997 1.00 0.00 O ATOM 20382 H1 WAT 7676 7.947 101.336 10.479 1.00 0.00 H ATOM 20383 H2 WAT 7676 8.470 100.273 11.421 1.00 0.00 H TER 20385 WAT 7676 ATOM 20385 O WAT 7677 11.992 26.586 132.434 1.00 0.00 O ATOM 20386 H1 WAT 7677 12.799 26.867 132.865 1.00 0.00 H ATOM 20387 H2 WAT 7677 11.387 27.317 132.557 1.00 0.00 H TER 20389 WAT 7677 ATOM 20389 O WAT 7678 21.412 137.165 80.423 1.00 0.00 O ATOM 20390 H1 WAT 7678 21.163 136.241 80.429 1.00 0.00 H ATOM 20391 H2 WAT 7678 21.639 137.347 79.511 1.00 0.00 H TER 20393 WAT 7678 ATOM 20393 O WAT 7679 113.417 106.795 81.086 1.00 0.00 O ATOM 20394 H1 WAT 7679 112.838 106.046 80.944 1.00 0.00 H ATOM 20395 H2 WAT 7679 112.829 107.550 81.110 1.00 0.00 H TER 20397 WAT 7679 ATOM 20397 O WAT 7680 130.458 64.143 99.961 1.00 0.00 O ATOM 20398 H1 WAT 7680 131.311 64.458 100.262 1.00 0.00 H ATOM 20399 H2 WAT 7680 130.522 64.156 99.006 1.00 0.00 H TER 20401 WAT 7680 ATOM 20401 O WAT 7681 10.794 50.085 81.257 1.00 0.00 O ATOM 20402 H1 WAT 7681 10.171 49.636 80.686 1.00 0.00 H ATOM 20403 H2 WAT 7681 10.930 50.937 80.841 1.00 0.00 H TER 20405 WAT 7681 ATOM 20405 O WAT 7682 57.857 134.575 110.632 1.00 0.00 O ATOM 20406 H1 WAT 7682 58.061 135.502 110.508 1.00 0.00 H ATOM 20407 H2 WAT 7682 58.710 134.154 110.742 1.00 0.00 H TER 20409 WAT 7682 ATOM 20409 O WAT 7683 51.246 33.432 156.793 1.00 0.00 O ATOM 20410 H1 WAT 7683 50.955 33.651 155.908 1.00 0.00 H ATOM 20411 H2 WAT 7683 51.059 32.498 156.882 1.00 0.00 H TER 20413 WAT 7683 ATOM 20413 O WAT 7684 35.679 7.974 74.202 1.00 0.00 O ATOM 20414 H1 WAT 7684 36.188 7.264 73.810 1.00 0.00 H ATOM 20415 H2 WAT 7684 36.336 8.595 74.516 1.00 0.00 H TER 20417 WAT 7684 ATOM 20417 O WAT 7685 10.910 4.592 143.896 1.00 0.00 O ATOM 20418 H1 WAT 7685 10.276 3.877 143.956 1.00 0.00 H ATOM 20419 H2 WAT 7685 11.118 4.804 144.806 1.00 0.00 H TER 20421 WAT 7685 ATOM 20421 O WAT 7686 52.313 44.536 93.848 1.00 0.00 O ATOM 20422 H1 WAT 7686 52.628 43.886 93.220 1.00 0.00 H ATOM 20423 H2 WAT 7686 53.108 44.887 94.249 1.00 0.00 H TER 20425 WAT 7686 ATOM 20425 O WAT 7687 127.579 107.962 3.719 1.00 0.00 O ATOM 20426 H1 WAT 7687 128.114 107.654 2.987 1.00 0.00 H ATOM 20427 H2 WAT 7687 126.679 107.780 3.450 1.00 0.00 H TER 20429 WAT 7687 ATOM 20429 O WAT 7688 60.599 113.165 156.715 1.00 0.00 O ATOM 20430 H1 WAT 7688 60.013 112.644 156.166 1.00 0.00 H ATOM 20431 H2 WAT 7688 60.995 113.795 156.113 1.00 0.00 H TER 20433 WAT 7688 ATOM 20433 O WAT 7689 77.366 42.994 82.707 1.00 0.00 O ATOM 20434 H1 WAT 7689 77.410 42.424 83.474 1.00 0.00 H ATOM 20435 H2 WAT 7689 76.489 43.376 82.743 1.00 0.00 H TER 20437 WAT 7689 ATOM 20437 O WAT 7690 76.939 131.709 79.404 1.00 0.00 O ATOM 20438 H1 WAT 7690 77.716 132.008 78.932 1.00 0.00 H ATOM 20439 H2 WAT 7690 77.239 131.582 80.304 1.00 0.00 H TER 20441 WAT 7690 ATOM 20441 O WAT 7691 28.651 11.412 138.014 1.00 0.00 O ATOM 20442 H1 WAT 7691 28.428 10.481 137.992 1.00 0.00 H ATOM 20443 H2 WAT 7691 29.576 11.443 137.772 1.00 0.00 H TER 20445 WAT 7691 ATOM 20445 O WAT 7692 126.668 145.389 88.054 1.00 0.00 O ATOM 20446 H1 WAT 7692 125.858 144.889 87.959 1.00 0.00 H ATOM 20447 H2 WAT 7692 126.434 146.118 88.628 1.00 0.00 H TER 20449 WAT 7692 ATOM 20449 O WAT 7693 47.222 3.486 112.818 1.00 0.00 O ATOM 20450 H1 WAT 7693 47.342 3.429 111.870 1.00 0.00 H ATOM 20451 H2 WAT 7693 47.139 2.576 113.104 1.00 0.00 H TER 20453 WAT 7693 ATOM 20453 O WAT 7694 111.782 47.912 127.504 1.00 0.00 O ATOM 20454 H1 WAT 7694 112.120 47.055 127.765 1.00 0.00 H ATOM 20455 H2 WAT 7694 112.379 48.205 126.816 1.00 0.00 H TER 20457 WAT 7694 ATOM 20457 O WAT 7695 59.365 129.722 50.281 1.00 0.00 O ATOM 20458 H1 WAT 7695 58.783 128.998 50.513 1.00 0.00 H ATOM 20459 H2 WAT 7695 58.858 130.509 50.479 1.00 0.00 H TER 20461 WAT 7695 ATOM 20461 O WAT 7696 72.571 11.686 134.790 1.00 0.00 O ATOM 20462 H1 WAT 7696 72.631 11.834 135.734 1.00 0.00 H ATOM 20463 H2 WAT 7696 73.318 11.124 134.587 1.00 0.00 H TER 20465 WAT 7696 ATOM 20465 O WAT 7697 2.147 89.311 82.327 1.00 0.00 O ATOM 20466 H1 WAT 7697 2.978 89.595 81.946 1.00 0.00 H ATOM 20467 H2 WAT 7697 2.388 88.921 83.167 1.00 0.00 H TER 20469 WAT 7697 ATOM 20469 O WAT 7698 47.268 50.830 103.356 1.00 0.00 O ATOM 20470 H1 WAT 7698 47.167 50.372 102.521 1.00 0.00 H ATOM 20471 H2 WAT 7698 47.697 51.654 103.126 1.00 0.00 H TER 20473 WAT 7698 ATOM 20473 O WAT 7699 36.695 39.908 7.909 1.00 0.00 O ATOM 20474 H1 WAT 7699 37.274 39.146 7.913 1.00 0.00 H ATOM 20475 H2 WAT 7699 37.238 40.623 8.240 1.00 0.00 H TER 20477 WAT 7699 ATOM 20477 O WAT 7700 101.914 111.188 73.581 1.00 0.00 O ATOM 20478 H1 WAT 7700 102.380 111.814 73.027 1.00 0.00 H ATOM 20479 H2 WAT 7700 102.502 111.037 74.321 1.00 0.00 H TER 20481 WAT 7700 ATOM 20481 O WAT 7701 73.635 20.464 75.662 1.00 0.00 O ATOM 20482 H1 WAT 7701 72.864 19.977 75.371 1.00 0.00 H ATOM 20483 H2 WAT 7701 74.360 20.083 75.166 1.00 0.00 H TER 20485 WAT 7701 ATOM 20485 O WAT 7702 132.202 128.273 16.036 1.00 0.00 O ATOM 20486 H1 WAT 7702 133.019 128.752 15.894 1.00 0.00 H ATOM 20487 H2 WAT 7702 131.955 128.484 16.937 1.00 0.00 H TER 20489 WAT 7702 ATOM 20489 O WAT 7703 47.508 49.710 129.353 1.00 0.00 O ATOM 20490 H1 WAT 7703 46.781 50.330 129.412 1.00 0.00 H ATOM 20491 H2 WAT 7703 47.193 49.026 128.762 1.00 0.00 H TER 20493 WAT 7703 ATOM 20493 O WAT 7704 81.329 78.225 126.422 1.00 0.00 O ATOM 20494 H1 WAT 7704 81.753 78.492 125.606 1.00 0.00 H ATOM 20495 H2 WAT 7704 82.054 77.996 127.004 1.00 0.00 H TER 20497 WAT 7704 ATOM 20497 O WAT 7705 72.718 107.320 142.238 1.00 0.00 O ATOM 20498 H1 WAT 7705 73.623 107.010 142.213 1.00 0.00 H ATOM 20499 H2 WAT 7705 72.735 108.060 142.846 1.00 0.00 H TER 20501 WAT 7705 ATOM 20501 O WAT 7706 79.079 87.093 66.885 1.00 0.00 O ATOM 20502 H1 WAT 7706 78.341 86.989 66.285 1.00 0.00 H ATOM 20503 H2 WAT 7706 79.015 87.998 67.190 1.00 0.00 H TER 20505 WAT 7706 ATOM 20505 O WAT 7707 47.945 2.990 110.017 1.00 0.00 O ATOM 20506 H1 WAT 7707 48.772 2.508 110.001 1.00 0.00 H ATOM 20507 H2 WAT 7707 47.273 2.316 109.926 1.00 0.00 H TER 20509 WAT 7707 ATOM 20509 O WAT 7708 132.808 63.119 153.977 1.00 0.00 O ATOM 20510 H1 WAT 7708 133.544 62.520 153.847 1.00 0.00 H ATOM 20511 H2 WAT 7708 132.187 62.623 154.510 1.00 0.00 H TER 20513 WAT 7708 ATOM 20513 O WAT 7709 110.441 56.280 100.174 1.00 0.00 O ATOM 20514 H1 WAT 7709 110.611 56.710 101.012 1.00 0.00 H ATOM 20515 H2 WAT 7709 111.306 56.173 99.780 1.00 0.00 H TER 20517 WAT 7709 ATOM 20517 O WAT 7710 19.811 78.065 19.213 1.00 0.00 O ATOM 20518 H1 WAT 7710 19.704 77.188 19.581 1.00 0.00 H ATOM 20519 H2 WAT 7710 20.743 78.257 19.319 1.00 0.00 H TER 20521 WAT 7710 ATOM 20521 O WAT 7711 73.372 122.284 128.565 1.00 0.00 O ATOM 20522 H1 WAT 7711 72.539 122.356 129.030 1.00 0.00 H ATOM 20523 H2 WAT 7711 73.215 121.621 127.892 1.00 0.00 H TER 20525 WAT 7711 ATOM 20525 O WAT 7712 145.871 48.275 149.288 1.00 0.00 O ATOM 20526 H1 WAT 7712 145.970 49.179 149.587 1.00 0.00 H ATOM 20527 H2 WAT 7712 144.939 48.088 149.396 1.00 0.00 H TER 20529 WAT 7712 ATOM 20529 O WAT 7713 7.762 89.759 102.146 1.00 0.00 O ATOM 20530 H1 WAT 7713 8.362 90.280 101.613 1.00 0.00 H ATOM 20531 H2 WAT 7713 6.950 89.736 101.640 1.00 0.00 H TER 20533 WAT 7713 ATOM 20533 O WAT 7714 39.698 12.630 114.043 1.00 0.00 O ATOM 20534 H1 WAT 7714 39.534 12.393 113.130 1.00 0.00 H ATOM 20535 H2 WAT 7714 38.847 12.536 114.472 1.00 0.00 H TER 20537 WAT 7714 ATOM 20537 O WAT 7715 32.152 5.879 96.075 1.00 0.00 O ATOM 20538 H1 WAT 7715 32.743 6.027 96.813 1.00 0.00 H ATOM 20539 H2 WAT 7715 32.668 5.364 95.455 1.00 0.00 H TER 20541 WAT 7715 ATOM 20541 O WAT 7716 28.094 14.601 73.094 1.00 0.00 O ATOM 20542 H1 WAT 7716 28.678 15.270 73.451 1.00 0.00 H ATOM 20543 H2 WAT 7716 28.287 13.816 73.606 1.00 0.00 H TER 20545 WAT 7716 ATOM 20545 O WAT 7717 131.668 127.803 11.404 1.00 0.00 O ATOM 20546 H1 WAT 7717 131.811 128.347 10.629 1.00 0.00 H ATOM 20547 H2 WAT 7717 130.977 128.256 11.889 1.00 0.00 H TER 20549 WAT 7717 ATOM 20549 O WAT 7718 8.626 89.085 72.137 1.00 0.00 O ATOM 20550 H1 WAT 7718 8.519 88.653 72.984 1.00 0.00 H ATOM 20551 H2 WAT 7718 8.468 90.012 72.319 1.00 0.00 H TER 20553 WAT 7718 ATOM 20553 O WAT 7719 30.068 33.565 146.861 1.00 0.00 O ATOM 20554 H1 WAT 7719 30.231 33.495 145.920 1.00 0.00 H ATOM 20555 H2 WAT 7719 29.563 32.780 147.075 1.00 0.00 H TER 20557 WAT 7719 ATOM 20557 O WAT 7720 114.816 9.469 66.515 1.00 0.00 O ATOM 20558 H1 WAT 7720 115.525 9.875 67.015 1.00 0.00 H ATOM 20559 H2 WAT 7720 114.146 10.150 66.454 1.00 0.00 H TER 20561 WAT 7720 ATOM 20561 O WAT 7721 141.760 110.971 148.659 1.00 0.00 O ATOM 20562 H1 WAT 7721 142.203 110.555 149.398 1.00 0.00 H ATOM 20563 H2 WAT 7721 140.828 110.838 148.832 1.00 0.00 H TER 20565 WAT 7721 ATOM 20565 O WAT 7722 32.352 74.581 130.211 1.00 0.00 O ATOM 20566 H1 WAT 7722 31.649 74.098 129.778 1.00 0.00 H ATOM 20567 H2 WAT 7722 32.939 74.839 129.500 1.00 0.00 H TER 20569 WAT 7722 ATOM 20569 O WAT 7723 97.554 24.366 95.803 1.00 0.00 O ATOM 20570 H1 WAT 7723 98.422 24.658 96.079 1.00 0.00 H ATOM 20571 H2 WAT 7723 97.536 24.527 94.859 1.00 0.00 H TER 20573 WAT 7723 ATOM 20573 O WAT 7724 11.697 98.886 16.571 1.00 0.00 O ATOM 20574 H1 WAT 7724 11.282 98.033 16.443 1.00 0.00 H ATOM 20575 H2 WAT 7724 12.582 98.679 16.871 1.00 0.00 H TER 20577 WAT 7724 ATOM 20577 O WAT 7725 38.716 101.368 56.804 1.00 0.00 O ATOM 20578 H1 WAT 7725 38.180 102.077 56.447 1.00 0.00 H ATOM 20579 H2 WAT 7725 38.147 100.936 57.442 1.00 0.00 H TER 20581 WAT 7725 ATOM 20581 O WAT 7726 134.211 121.195 115.254 1.00 0.00 O ATOM 20582 H1 WAT 7726 133.944 121.860 114.620 1.00 0.00 H ATOM 20583 H2 WAT 7726 133.983 120.363 114.839 1.00 0.00 H TER 20585 WAT 7726 ATOM 20585 O WAT 7727 138.945 43.957 90.679 1.00 0.00 O ATOM 20586 H1 WAT 7727 139.507 44.356 90.015 1.00 0.00 H ATOM 20587 H2 WAT 7727 138.623 44.696 91.196 1.00 0.00 H TER 20589 WAT 7727 ATOM 20589 O WAT 7728 89.828 101.185 14.030 1.00 0.00 O ATOM 20590 H1 WAT 7728 90.048 100.253 14.065 1.00 0.00 H ATOM 20591 H2 WAT 7728 90.109 101.465 13.159 1.00 0.00 H TER 20593 WAT 7728 ATOM 20593 O WAT 7729 106.562 48.355 67.517 1.00 0.00 O ATOM 20594 H1 WAT 7729 106.377 47.748 68.233 1.00 0.00 H ATOM 20595 H2 WAT 7729 105.916 49.053 67.621 1.00 0.00 H TER 20597 WAT 7729 ATOM 20597 O WAT 7730 139.259 51.006 74.563 1.00 0.00 O ATOM 20598 H1 WAT 7730 139.821 50.867 73.801 1.00 0.00 H ATOM 20599 H2 WAT 7730 138.654 51.697 74.291 1.00 0.00 H TER 20601 WAT 7730 ATOM 20601 O WAT 7731 135.902 101.117 131.592 1.00 0.00 O ATOM 20602 H1 WAT 7731 136.135 100.886 132.491 1.00 0.00 H ATOM 20603 H2 WAT 7731 135.446 100.345 131.256 1.00 0.00 H TER 20605 WAT 7731 ATOM 20605 O WAT 7732 6.362 102.170 10.150 1.00 0.00 O ATOM 20606 H1 WAT 7732 5.596 101.635 10.357 1.00 0.00 H ATOM 20607 H2 WAT 7732 6.249 102.404 9.229 1.00 0.00 H TER 20609 WAT 7732 ATOM 20609 O WAT 7733 80.377 52.098 96.450 1.00 0.00 O ATOM 20610 H1 WAT 7733 79.432 52.136 96.596 1.00 0.00 H ATOM 20611 H2 WAT 7733 80.744 51.892 97.310 1.00 0.00 H TER 20613 WAT 7733 ATOM 20613 O WAT 7734 89.770 137.856 116.777 1.00 0.00 O ATOM 20614 H1 WAT 7734 89.298 138.335 117.459 1.00 0.00 H ATOM 20615 H2 WAT 7734 90.603 138.319 116.692 1.00 0.00 H TER 20617 WAT 7734 ATOM 20617 O WAT 7735 60.907 73.568 151.969 1.00 0.00 O ATOM 20618 H1 WAT 7735 61.444 74.282 151.626 1.00 0.00 H ATOM 20619 H2 WAT 7735 61.319 73.337 152.801 1.00 0.00 H TER 20621 WAT 7735 ATOM 20621 O WAT 7736 9.334 24.326 90.129 1.00 0.00 O ATOM 20622 H1 WAT 7736 9.462 23.502 90.598 1.00 0.00 H ATOM 20623 H2 WAT 7736 10.163 24.793 90.234 1.00 0.00 H TER 20625 WAT 7736 ATOM 20625 O WAT 7737 51.578 113.308 8.754 1.00 0.00 O ATOM 20626 H1 WAT 7737 52.337 113.564 8.230 1.00 0.00 H ATOM 20627 H2 WAT 7737 50.834 113.402 8.159 1.00 0.00 H TER 20629 WAT 7737 ATOM 20629 O WAT 7738 73.195 64.511 74.623 1.00 0.00 O ATOM 20630 H1 WAT 7738 72.829 65.275 74.178 1.00 0.00 H ATOM 20631 H2 WAT 7738 73.111 63.801 73.988 1.00 0.00 H TER 20633 WAT 7738 ATOM 20633 O WAT 7739 43.836 16.403 75.034 1.00 0.00 O ATOM 20634 H1 WAT 7739 43.080 16.121 75.548 1.00 0.00 H ATOM 20635 H2 WAT 7739 44.272 17.052 75.586 1.00 0.00 H TER 20637 WAT 7739 ATOM 20637 O WAT 7740 43.133 55.694 79.216 1.00 0.00 O ATOM 20638 H1 WAT 7740 42.356 55.715 79.776 1.00 0.00 H ATOM 20639 H2 WAT 7740 43.150 56.555 78.799 1.00 0.00 H TER 20641 WAT 7740 ATOM 20641 O WAT 7741 135.920 49.682 99.321 1.00 0.00 O ATOM 20642 H1 WAT 7741 136.066 49.646 100.267 1.00 0.00 H ATOM 20643 H2 WAT 7741 135.831 50.616 99.129 1.00 0.00 H TER 20645 WAT 7741 ATOM 20645 O WAT 7742 44.249 134.202 126.015 1.00 0.00 O ATOM 20646 H1 WAT 7742 43.788 134.115 126.849 1.00 0.00 H ATOM 20647 H2 WAT 7742 45.176 134.218 126.254 1.00 0.00 H TER 20649 WAT 7742 ATOM 20649 O WAT 7743 93.751 7.909 69.246 1.00 0.00 O ATOM 20650 H1 WAT 7743 93.491 7.854 68.327 1.00 0.00 H ATOM 20651 H2 WAT 7743 94.707 7.850 69.228 1.00 0.00 H TER 20653 WAT 7743 ATOM 20653 O WAT 7744 52.810 44.286 11.723 1.00 0.00 O ATOM 20654 H1 WAT 7744 53.083 45.147 11.408 1.00 0.00 H ATOM 20655 H2 WAT 7744 53.271 43.666 11.158 1.00 0.00 H TER 20657 WAT 7744 ATOM 20657 O WAT 7745 91.052 101.324 108.367 1.00 0.00 O ATOM 20658 H1 WAT 7745 90.880 102.223 108.089 1.00 0.00 H ATOM 20659 H2 WAT 7745 91.994 101.302 108.538 1.00 0.00 H TER 20661 WAT 7745 ATOM 20661 O WAT 7746 9.923 112.298 9.245 1.00 0.00 O ATOM 20662 H1 WAT 7746 9.769 111.415 9.581 1.00 0.00 H ATOM 20663 H2 WAT 7746 9.125 112.780 9.462 1.00 0.00 H TER 20665 WAT 7746 ATOM 20665 O WAT 7747 128.862 118.862 116.953 1.00 0.00 O ATOM 20666 H1 WAT 7747 129.268 118.004 117.079 1.00 0.00 H ATOM 20667 H2 WAT 7747 129.572 119.417 116.631 1.00 0.00 H TER 20669 WAT 7747 ATOM 20669 O WAT 7748 124.933 22.124 12.732 1.00 0.00 O ATOM 20670 H1 WAT 7748 125.121 22.007 13.663 1.00 0.00 H ATOM 20671 H2 WAT 7748 125.509 21.500 12.291 1.00 0.00 H TER 20673 WAT 7748 ATOM 20673 O WAT 7749 19.056 91.652 148.531 1.00 0.00 O ATOM 20674 H1 WAT 7749 18.958 92.463 149.029 1.00 0.00 H ATOM 20675 H2 WAT 7749 19.950 91.687 148.190 1.00 0.00 H TER 20677 WAT 7749 ATOM 20677 O WAT 7750 64.843 2.607 152.525 1.00 0.00 O ATOM 20678 H1 WAT 7750 64.661 2.331 153.424 1.00 0.00 H ATOM 20679 H2 WAT 7750 64.759 3.560 152.546 1.00 0.00 H TER 20681 WAT 7750 ATOM 20681 O WAT 7751 70.028 80.324 100.930 1.00 0.00 O ATOM 20682 H1 WAT 7751 69.192 79.878 100.789 1.00 0.00 H ATOM 20683 H2 WAT 7751 69.957 80.693 101.810 1.00 0.00 H TER 20685 WAT 7751 ATOM 20685 O WAT 7752 110.252 51.441 134.602 1.00 0.00 O ATOM 20686 H1 WAT 7752 109.444 51.954 134.571 1.00 0.00 H ATOM 20687 H2 WAT 7752 110.143 50.870 135.363 1.00 0.00 H TER 20689 WAT 7752 ATOM 20689 O WAT 7753 6.538 114.461 21.612 1.00 0.00 O ATOM 20690 H1 WAT 7753 6.864 115.361 21.612 1.00 0.00 H ATOM 20691 H2 WAT 7753 7.326 113.921 21.670 1.00 0.00 H TER 20693 WAT 7753 ATOM 20693 O WAT 7754 45.357 25.183 15.730 1.00 0.00 O ATOM 20694 H1 WAT 7754 45.870 24.738 15.056 1.00 0.00 H ATOM 20695 H2 WAT 7754 44.973 25.936 15.281 1.00 0.00 H TER 20697 WAT 7754 ATOM 20697 O WAT 7755 56.610 118.953 50.948 1.00 0.00 O ATOM 20698 H1 WAT 7755 56.103 118.314 51.450 1.00 0.00 H ATOM 20699 H2 WAT 7755 56.004 119.267 50.278 1.00 0.00 H TER 20701 WAT 7755 ATOM 20701 O WAT 7756 105.089 65.222 5.755 1.00 0.00 O ATOM 20702 H1 WAT 7756 105.946 65.264 6.181 1.00 0.00 H ATOM 20703 H2 WAT 7756 104.477 65.544 6.417 1.00 0.00 H TER 20705 WAT 7756 ATOM 20705 O WAT 7757 79.463 51.426 127.209 1.00 0.00 O ATOM 20706 H1 WAT 7757 79.296 50.535 127.517 1.00 0.00 H ATOM 20707 H2 WAT 7757 78.705 51.637 126.664 1.00 0.00 H TER 20709 WAT 7757 ATOM 20709 O WAT 7758 102.026 79.844 117.845 1.00 0.00 O ATOM 20710 H1 WAT 7758 102.180 79.594 116.934 1.00 0.00 H ATOM 20711 H2 WAT 7758 102.750 79.447 118.329 1.00 0.00 H TER 20713 WAT 7758 ATOM 20713 O WAT 7759 4.273 21.069 114.922 1.00 0.00 O ATOM 20714 H1 WAT 7759 3.944 21.968 114.932 1.00 0.00 H ATOM 20715 H2 WAT 7759 4.934 21.063 114.230 1.00 0.00 H TER 20717 WAT 7759 ATOM 20717 O WAT 7760 19.012 60.504 150.535 1.00 0.00 O ATOM 20718 H1 WAT 7760 18.802 60.461 151.468 1.00 0.00 H ATOM 20719 H2 WAT 7760 18.162 60.483 150.096 1.00 0.00 H TER 20721 WAT 7760 ATOM 20721 O WAT 7761 19.197 59.419 67.505 1.00 0.00 O ATOM 20722 H1 WAT 7761 19.653 60.115 67.034 1.00 0.00 H ATOM 20723 H2 WAT 7761 19.851 59.070 68.111 1.00 0.00 H TER 20725 WAT 7761 ATOM 20725 O WAT 7762 52.166 21.398 148.383 1.00 0.00 O ATOM 20726 H1 WAT 7762 52.565 20.573 148.660 1.00 0.00 H ATOM 20727 H2 WAT 7762 51.413 21.507 148.964 1.00 0.00 H TER 20729 WAT 7762 ATOM 20729 O WAT 7763 69.384 98.112 96.932 1.00 0.00 O ATOM 20730 H1 WAT 7763 70.181 98.242 96.417 1.00 0.00 H ATOM 20731 H2 WAT 7763 69.653 98.282 97.835 1.00 0.00 H TER 20733 WAT 7763 ATOM 20733 O WAT 7764 98.246 3.545 156.840 1.00 0.00 O ATOM 20734 H1 WAT 7764 97.385 3.858 157.118 1.00 0.00 H ATOM 20735 H2 WAT 7764 98.516 2.941 157.532 1.00 0.00 H TER 20737 WAT 7764 ATOM 20737 O WAT 7765 85.619 122.845 128.953 1.00 0.00 O ATOM 20738 H1 WAT 7765 85.689 123.652 129.462 1.00 0.00 H ATOM 20739 H2 WAT 7765 86.110 123.023 128.151 1.00 0.00 H TER 20741 WAT 7765 ATOM 20741 O WAT 7766 36.420 102.917 71.237 1.00 0.00 O ATOM 20742 H1 WAT 7766 37.024 102.549 71.883 1.00 0.00 H ATOM 20743 H2 WAT 7766 36.496 103.864 71.351 1.00 0.00 H TER 20745 WAT 7766 ATOM 20745 O WAT 7767 106.678 60.973 21.271 1.00 0.00 O ATOM 20746 H1 WAT 7767 107.173 60.163 21.397 1.00 0.00 H ATOM 20747 H2 WAT 7767 107.043 61.580 21.914 1.00 0.00 H TER 20749 WAT 7767 ATOM 20749 O WAT 7768 40.220 110.794 95.376 1.00 0.00 O ATOM 20750 H1 WAT 7768 39.415 110.774 94.858 1.00 0.00 H ATOM 20751 H2 WAT 7768 40.741 111.494 94.982 1.00 0.00 H TER 20753 WAT 7768 ATOM 20753 O WAT 7769 19.826 121.008 150.254 1.00 0.00 O ATOM 20754 H1 WAT 7769 19.251 120.379 150.690 1.00 0.00 H ATOM 20755 H2 WAT 7769 20.622 120.512 150.062 1.00 0.00 H TER 20757 WAT 7769 ATOM 20757 O WAT 7770 5.172 17.362 78.017 1.00 0.00 O ATOM 20758 H1 WAT 7770 4.355 17.330 77.519 1.00 0.00 H ATOM 20759 H2 WAT 7770 5.859 17.271 77.356 1.00 0.00 H TER 20761 WAT 7770 ATOM 20761 O WAT 7771 91.340 36.619 62.576 1.00 0.00 O ATOM 20762 H1 WAT 7771 91.544 36.755 61.651 1.00 0.00 H ATOM 20763 H2 WAT 7771 91.188 37.499 62.919 1.00 0.00 H TER 20765 WAT 7771 ATOM 20765 O WAT 7772 90.222 59.888 133.324 1.00 0.00 O ATOM 20766 H1 WAT 7772 89.482 59.483 132.872 1.00 0.00 H ATOM 20767 H2 WAT 7772 89.857 60.682 133.715 1.00 0.00 H TER 20769 WAT 7772 ATOM 20769 O WAT 7773 4.307 126.164 55.964 1.00 0.00 O ATOM 20770 H1 WAT 7773 3.380 126.258 55.746 1.00 0.00 H ATOM 20771 H2 WAT 7773 4.346 125.382 56.514 1.00 0.00 H TER 20773 WAT 7773 ATOM 20773 O WAT 7774 40.852 1.488 92.964 1.00 0.00 O ATOM 20774 H1 WAT 7774 41.479 2.173 93.197 1.00 0.00 H ATOM 20775 H2 WAT 7774 40.016 1.801 93.309 1.00 0.00 H TER 20777 WAT 7774 ATOM 20777 O WAT 7775 71.665 100.330 111.774 1.00 0.00 O ATOM 20778 H1 WAT 7775 71.140 100.507 112.555 1.00 0.00 H ATOM 20779 H2 WAT 7775 71.505 99.406 111.582 1.00 0.00 H TER 20781 WAT 7775 ATOM 20781 O WAT 7776 123.838 6.219 90.315 1.00 0.00 O ATOM 20782 H1 WAT 7776 124.349 5.414 90.393 1.00 0.00 H ATOM 20783 H2 WAT 7776 123.046 5.956 89.845 1.00 0.00 H TER 20785 WAT 7776 ATOM 20785 O WAT 7777 104.564 62.404 80.840 1.00 0.00 O ATOM 20786 H1 WAT 7777 104.086 61.889 81.490 1.00 0.00 H ATOM 20787 H2 WAT 7777 105.448 62.484 81.200 1.00 0.00 H TER 20789 WAT 7777 ATOM 20789 O WAT 7778 30.755 88.795 151.753 1.00 0.00 O ATOM 20790 H1 WAT 7778 30.216 89.582 151.680 1.00 0.00 H ATOM 20791 H2 WAT 7778 31.338 88.833 150.995 1.00 0.00 H TER 20793 WAT 7778 ATOM 20793 O WAT 7779 59.675 57.161 116.463 1.00 0.00 O ATOM 20794 H1 WAT 7779 59.560 56.307 116.047 1.00 0.00 H ATOM 20795 H2 WAT 7779 59.958 57.737 115.753 1.00 0.00 H TER 20797 WAT 7779 ATOM 20797 O WAT 7780 20.338 80.895 136.628 1.00 0.00 O ATOM 20798 H1 WAT 7780 21.181 81.340 136.540 1.00 0.00 H ATOM 20799 H2 WAT 7780 20.413 80.398 137.442 1.00 0.00 H TER 20801 WAT 7780 ATOM 20801 O WAT 7781 43.472 53.215 144.604 1.00 0.00 O ATOM 20802 H1 WAT 7781 43.907 53.998 144.267 1.00 0.00 H ATOM 20803 H2 WAT 7781 44.079 52.501 144.410 1.00 0.00 H TER 20805 WAT 7781 ATOM 20805 O WAT 7782 74.564 145.396 152.387 1.00 0.00 O ATOM 20806 H1 WAT 7782 73.870 146.031 152.564 1.00 0.00 H ATOM 20807 H2 WAT 7782 74.626 144.879 153.189 1.00 0.00 H TER 20809 WAT 7782 ATOM 20809 O WAT 7783 122.175 24.094 135.819 1.00 0.00 O ATOM 20810 H1 WAT 7783 122.641 24.611 136.475 1.00 0.00 H ATOM 20811 H2 WAT 7783 122.731 23.327 135.679 1.00 0.00 H TER 20813 WAT 7783 ATOM 20813 O WAT 7784 143.471 102.766 75.893 1.00 0.00 O ATOM 20814 H1 WAT 7784 143.292 103.551 75.375 1.00 0.00 H ATOM 20815 H2 WAT 7784 142.866 102.109 75.549 1.00 0.00 H TER 20817 WAT 7784 ATOM 20817 O WAT 7785 117.588 124.743 19.892 1.00 0.00 O ATOM 20818 H1 WAT 7785 118.424 124.764 20.357 1.00 0.00 H ATOM 20819 H2 WAT 7785 117.069 124.090 20.362 1.00 0.00 H TER 20821 WAT 7785 ATOM 20821 O WAT 7786 136.854 7.915 7.894 1.00 0.00 O ATOM 20822 H1 WAT 7786 137.437 8.601 8.218 1.00 0.00 H ATOM 20823 H2 WAT 7786 136.081 8.386 7.582 1.00 0.00 H TER 20825 WAT 7786 ATOM 20825 O WAT 7787 21.354 3.150 74.655 1.00 0.00 O ATOM 20826 H1 WAT 7787 20.845 3.589 75.337 1.00 0.00 H ATOM 20827 H2 WAT 7787 20.857 3.301 73.851 1.00 0.00 H TER 20829 WAT 7787 ATOM 20829 O WAT 7788 122.732 56.019 71.589 1.00 0.00 O ATOM 20830 H1 WAT 7788 123.480 56.149 71.006 1.00 0.00 H ATOM 20831 H2 WAT 7788 122.281 55.254 71.233 1.00 0.00 H TER 20833 WAT 7788 ATOM 20833 O WAT 7789 77.109 42.217 90.018 1.00 0.00 O ATOM 20834 H1 WAT 7789 77.666 41.495 89.729 1.00 0.00 H ATOM 20835 H2 WAT 7789 77.522 42.531 90.823 1.00 0.00 H TER 20837 WAT 7789 ATOM 20837 O WAT 7790 119.968 27.538 103.025 1.00 0.00 O ATOM 20838 H1 WAT 7790 120.283 26.768 102.551 1.00 0.00 H ATOM 20839 H2 WAT 7790 120.762 28.025 103.246 1.00 0.00 H TER 20841 WAT 7790 ATOM 20841 O WAT 7791 100.135 137.672 145.227 1.00 0.00 O ATOM 20842 H1 WAT 7791 100.561 138.033 144.450 1.00 0.00 H ATOM 20843 H2 WAT 7791 100.766 137.041 145.575 1.00 0.00 H TER 20845 WAT 7791 ATOM 20845 O WAT 7792 88.148 54.131 95.157 1.00 0.00 O ATOM 20846 H1 WAT 7792 88.124 54.206 96.111 1.00 0.00 H ATOM 20847 H2 WAT 7792 88.131 55.035 94.844 1.00 0.00 H TER 20849 WAT 7792 ATOM 20849 O WAT 7793 83.467 46.455 57.525 1.00 0.00 O ATOM 20850 H1 WAT 7793 83.271 45.596 57.150 1.00 0.00 H ATOM 20851 H2 WAT 7793 84.392 46.598 57.325 1.00 0.00 H TER 20853 WAT 7793 ATOM 20853 O WAT 7794 60.127 128.794 110.663 1.00 0.00 O ATOM 20854 H1 WAT 7794 59.312 129.095 110.262 1.00 0.00 H ATOM 20855 H2 WAT 7794 60.801 129.362 110.289 1.00 0.00 H TER 20857 WAT 7794 ATOM 20857 O WAT 7795 83.572 14.697 100.648 1.00 0.00 O ATOM 20858 H1 WAT 7795 83.100 14.594 101.474 1.00 0.00 H ATOM 20859 H2 WAT 7795 84.396 15.116 100.894 1.00 0.00 H TER 20861 WAT 7795 ATOM 20861 O WAT 7796 140.777 85.588 147.000 1.00 0.00 O ATOM 20862 H1 WAT 7796 141.445 85.523 147.682 1.00 0.00 H ATOM 20863 H2 WAT 7796 139.999 85.909 147.456 1.00 0.00 H TER 20865 WAT 7796 ATOM 20865 O WAT 7797 121.820 45.625 135.457 1.00 0.00 O ATOM 20866 H1 WAT 7797 121.930 45.914 134.551 1.00 0.00 H ATOM 20867 H2 WAT 7797 121.400 44.768 135.385 1.00 0.00 H TER 20869 WAT 7797 ATOM 20869 O WAT 7798 33.851 112.338 21.255 1.00 0.00 O ATOM 20870 H1 WAT 7798 34.686 111.888 21.387 1.00 0.00 H ATOM 20871 H2 WAT 7798 34.095 113.232 21.020 1.00 0.00 H TER 20873 WAT 7798 ATOM 20873 O WAT 7799 73.101 126.304 110.784 1.00 0.00 O ATOM 20874 H1 WAT 7799 72.596 125.799 110.146 1.00 0.00 H ATOM 20875 H2 WAT 7799 72.690 127.169 110.783 1.00 0.00 H TER 20877 WAT 7799 ATOM 20877 O WAT 7800 133.824 80.501 62.090 1.00 0.00 O ATOM 20878 H1 WAT 7800 134.064 81.408 61.899 1.00 0.00 H ATOM 20879 H2 WAT 7800 132.875 80.525 62.210 1.00 0.00 H TER 20881 WAT 7800 ATOM 20881 O WAT 7801 127.370 50.406 73.350 1.00 0.00 O ATOM 20882 H1 WAT 7801 127.168 50.424 72.414 1.00 0.00 H ATOM 20883 H2 WAT 7801 128.303 50.616 73.397 1.00 0.00 H TER 20885 WAT 7801 ATOM 20885 O WAT 7802 78.311 62.695 7.837 1.00 0.00 O ATOM 20886 H1 WAT 7802 77.502 63.193 7.725 1.00 0.00 H ATOM 20887 H2 WAT 7802 78.862 62.965 7.102 1.00 0.00 H TER 20889 WAT 7802 ATOM 20889 O WAT 7803 83.677 105.232 111.161 1.00 0.00 O ATOM 20890 H1 WAT 7803 83.769 104.734 110.349 1.00 0.00 H ATOM 20891 H2 WAT 7803 83.457 106.119 110.875 1.00 0.00 H TER 20893 WAT 7803 ATOM 20893 O WAT 7804 138.494 109.121 111.717 1.00 0.00 O ATOM 20894 H1 WAT 7804 137.777 108.715 111.229 1.00 0.00 H ATOM 20895 H2 WAT 7804 138.705 109.911 111.220 1.00 0.00 H TER 20897 WAT 7804 ATOM 20897 O WAT 7805 65.806 96.105 2.243 1.00 0.00 O ATOM 20898 H1 WAT 7805 65.390 96.654 2.908 1.00 0.00 H ATOM 20899 H2 WAT 7805 66.407 95.546 2.735 1.00 0.00 H TER 20901 WAT 7805 ATOM 20901 O WAT 7806 75.608 31.105 144.609 1.00 0.00 O ATOM 20902 H1 WAT 7806 75.302 30.310 145.045 1.00 0.00 H ATOM 20903 H2 WAT 7806 76.517 30.917 144.376 1.00 0.00 H TER 20905 WAT 7806 ATOM 20905 O WAT 7807 68.900 83.373 13.512 1.00 0.00 O ATOM 20906 H1 WAT 7807 68.127 82.849 13.725 1.00 0.00 H ATOM 20907 H2 WAT 7807 69.640 82.820 13.762 1.00 0.00 H TER 20909 WAT 7807 ATOM 20909 O WAT 7808 140.003 47.340 112.144 1.00 0.00 O ATOM 20910 H1 WAT 7808 139.623 48.059 111.638 1.00 0.00 H ATOM 20911 H2 WAT 7808 140.920 47.313 111.869 1.00 0.00 H TER 20913 WAT 7808 ATOM 20913 O WAT 7809 58.804 99.252 2.569 1.00 0.00 O ATOM 20914 H1 WAT 7809 59.287 98.447 2.383 1.00 0.00 H ATOM 20915 H2 WAT 7809 59.479 99.885 2.814 1.00 0.00 H TER 20917 WAT 7809 ATOM 20917 O WAT 7810 140.906 57.060 25.269 1.00 0.00 O ATOM 20918 H1 WAT 7810 140.407 56.975 26.082 1.00 0.00 H ATOM 20919 H2 WAT 7810 140.367 57.627 24.716 1.00 0.00 H TER 20921 WAT 7810 ATOM 20921 O WAT 7811 135.208 21.999 145.110 1.00 0.00 O ATOM 20922 H1 WAT 7811 135.416 21.173 145.546 1.00 0.00 H ATOM 20923 H2 WAT 7811 134.527 22.393 145.655 1.00 0.00 H TER 20925 WAT 7811 ATOM 20925 O WAT 7812 141.453 24.283 1.489 1.00 0.00 O ATOM 20926 H1 WAT 7812 140.829 24.433 0.779 1.00 0.00 H ATOM 20927 H2 WAT 7812 140.918 24.288 2.283 1.00 0.00 H TER 20929 WAT 7812 ATOM 20929 O WAT 7813 4.084 120.001 94.622 1.00 0.00 O ATOM 20930 H1 WAT 7813 4.758 119.404 94.296 1.00 0.00 H ATOM 20931 H2 WAT 7813 4.480 120.412 95.390 1.00 0.00 H TER 20933 WAT 7813 ATOM 20933 O WAT 7814 135.204 4.417 98.369 1.00 0.00 O ATOM 20934 H1 WAT 7814 134.657 3.639 98.257 1.00 0.00 H ATOM 20935 H2 WAT 7814 135.840 4.367 97.656 1.00 0.00 H TER 20937 WAT 7814 ATOM 20937 O WAT 7815 91.552 141.373 85.109 1.00 0.00 O ATOM 20938 H1 WAT 7815 91.463 140.720 85.803 1.00 0.00 H ATOM 20939 H2 WAT 7815 92.156 142.023 85.467 1.00 0.00 H TER 20941 WAT 7815 ATOM 20941 O WAT 7816 116.157 92.417 76.149 1.00 0.00 O ATOM 20942 H1 WAT 7816 115.369 92.436 76.694 1.00 0.00 H ATOM 20943 H2 WAT 7816 115.870 92.759 75.302 1.00 0.00 H TER 20945 WAT 7816 ATOM 20945 O WAT 7817 108.384 121.671 120.595 1.00 0.00 O ATOM 20946 H1 WAT 7817 108.986 121.163 121.138 1.00 0.00 H ATOM 20947 H2 WAT 7817 107.850 121.013 120.150 1.00 0.00 H TER 20949 WAT 7817 ATOM 20949 O WAT 7818 46.618 143.257 150.269 1.00 0.00 O ATOM 20950 H1 WAT 7818 46.742 144.094 149.820 1.00 0.00 H ATOM 20951 H2 WAT 7818 46.957 142.604 149.657 1.00 0.00 H TER 20953 WAT 7818 ATOM 20953 O WAT 7819 122.098 73.353 75.330 1.00 0.00 O ATOM 20954 H1 WAT 7819 122.125 72.661 74.668 1.00 0.00 H ATOM 20955 H2 WAT 7819 122.966 73.332 75.733 1.00 0.00 H TER 20957 WAT 7819 ATOM 20957 O WAT 7820 144.343 127.344 147.388 1.00 0.00 O ATOM 20958 H1 WAT 7820 144.913 126.754 147.880 1.00 0.00 H ATOM 20959 H2 WAT 7820 143.499 126.893 147.359 1.00 0.00 H TER 20961 WAT 7820 ATOM 20961 O WAT 7821 83.145 113.915 86.605 1.00 0.00 O ATOM 20962 H1 WAT 7821 82.443 114.251 86.048 1.00 0.00 H ATOM 20963 H2 WAT 7821 83.046 114.392 87.429 1.00 0.00 H TER 20965 WAT 7821 ATOM 20965 O WAT 7822 66.263 7.281 93.747 1.00 0.00 O ATOM 20966 H1 WAT 7822 66.144 6.366 93.493 1.00 0.00 H ATOM 20967 H2 WAT 7822 65.376 7.642 93.761 1.00 0.00 H TER 20969 WAT 7822 ATOM 20969 O WAT 7823 28.079 82.038 7.984 1.00 0.00 O ATOM 20970 H1 WAT 7823 28.425 81.649 8.787 1.00 0.00 H ATOM 20971 H2 WAT 7823 28.757 81.876 7.328 1.00 0.00 H TER 20973 WAT 7823 ATOM 20973 O WAT 7824 4.742 69.911 70.256 1.00 0.00 O ATOM 20974 H1 WAT 7824 4.837 70.731 69.771 1.00 0.00 H ATOM 20975 H2 WAT 7824 3.967 69.497 69.876 1.00 0.00 H TER 20977 WAT 7824 ATOM 20977 O WAT 7825 51.912 129.833 125.872 1.00 0.00 O ATOM 20978 H1 WAT 7825 51.184 129.491 126.391 1.00 0.00 H ATOM 20979 H2 WAT 7825 51.696 130.755 125.736 1.00 0.00 H TER 20981 WAT 7825 ATOM 20981 O WAT 7826 132.823 19.090 148.272 1.00 0.00 O ATOM 20982 H1 WAT 7826 132.367 18.458 147.716 1.00 0.00 H ATOM 20983 H2 WAT 7826 133.435 18.561 148.784 1.00 0.00 H TER 20985 WAT 7826 ATOM 20985 O WAT 7827 70.654 138.186 108.432 1.00 0.00 O ATOM 20986 H1 WAT 7827 69.755 137.867 108.354 1.00 0.00 H ATOM 20987 H2 WAT 7827 71.167 137.406 108.646 1.00 0.00 H TER 20989 WAT 7827 ATOM 20989 O WAT 7828 40.850 54.014 154.446 1.00 0.00 O ATOM 20990 H1 WAT 7828 41.184 53.219 154.860 1.00 0.00 H ATOM 20991 H2 WAT 7828 40.835 53.809 153.511 1.00 0.00 H TER 20993 WAT 7828 ATOM 20993 O WAT 7829 132.856 65.943 86.220 1.00 0.00 O ATOM 20994 H1 WAT 7829 133.542 65.994 85.554 1.00 0.00 H ATOM 20995 H2 WAT 7829 132.784 65.010 86.419 1.00 0.00 H TER 20997 WAT 7829 ATOM 20997 O WAT 7830 2.358 132.932 130.844 1.00 0.00 O ATOM 20998 H1 WAT 7830 3.269 133.219 130.901 1.00 0.00 H ATOM 20999 H2 WAT 7830 2.294 132.506 129.989 1.00 0.00 H TER 21001 WAT 7830 ATOM 21001 O WAT 7831 66.283 97.560 82.443 1.00 0.00 O ATOM 21002 H1 WAT 7831 65.818 96.812 82.818 1.00 0.00 H ATOM 21003 H2 WAT 7831 65.596 98.092 82.041 1.00 0.00 H TER 21005 WAT 7831 ATOM 21005 O WAT 7832 84.707 39.398 126.288 1.00 0.00 O ATOM 21006 H1 WAT 7832 85.004 38.550 126.616 1.00 0.00 H ATOM 21007 H2 WAT 7832 85.506 39.920 126.215 1.00 0.00 H TER 21009 WAT 7832 ATOM 21009 O WAT 7833 42.802 115.179 112.614 1.00 0.00 O ATOM 21010 H1 WAT 7833 42.122 115.422 111.986 1.00 0.00 H ATOM 21011 H2 WAT 7833 43.211 116.010 112.857 1.00 0.00 H TER 21013 WAT 7833 ATOM 21013 O WAT 7834 17.775 85.732 101.806 1.00 0.00 O ATOM 21014 H1 WAT 7834 18.631 85.989 101.463 1.00 0.00 H ATOM 21015 H2 WAT 7834 17.158 86.324 101.377 1.00 0.00 H TER 21017 WAT 7834 ATOM 21017 O WAT 7835 21.542 7.395 140.588 1.00 0.00 O ATOM 21018 H1 WAT 7835 21.278 7.248 139.679 1.00 0.00 H ATOM 21019 H2 WAT 7835 21.162 8.245 140.813 1.00 0.00 H TER 21021 WAT 7835 ATOM 21021 O WAT 7836 132.277 12.977 2.433 1.00 0.00 O ATOM 21022 H1 WAT 7836 132.604 13.298 3.273 1.00 0.00 H ATOM 21023 H2 WAT 7836 132.368 13.723 1.840 1.00 0.00 H TER 21025 WAT 7836 ATOM 21025 O WAT 7837 42.478 126.809 97.906 1.00 0.00 O ATOM 21026 H1 WAT 7837 42.545 127.299 98.726 1.00 0.00 H ATOM 21027 H2 WAT 7837 43.061 126.060 98.026 1.00 0.00 H TER 21029 WAT 7837 ATOM 21029 O WAT 7838 63.571 14.668 96.381 1.00 0.00 O ATOM 21030 H1 WAT 7838 63.044 15.356 96.787 1.00 0.00 H ATOM 21031 H2 WAT 7838 62.945 14.162 95.863 1.00 0.00 H TER 21033 WAT 7838 ATOM 21033 O WAT 7839 72.290 42.056 88.996 1.00 0.00 O ATOM 21034 H1 WAT 7839 72.365 41.444 88.264 1.00 0.00 H ATOM 21035 H2 WAT 7839 71.431 42.463 88.881 1.00 0.00 H TER 21037 WAT 7839 ATOM 21037 O WAT 7840 39.440 11.150 102.946 1.00 0.00 O ATOM 21038 H1 WAT 7840 40.103 10.571 102.568 1.00 0.00 H ATOM 21039 H2 WAT 7840 39.104 11.647 102.200 1.00 0.00 H TER 21041 WAT 7840 ATOM 21041 O WAT 7841 79.316 111.016 130.357 1.00 0.00 O ATOM 21042 H1 WAT 7841 79.335 111.940 130.108 1.00 0.00 H ATOM 21043 H2 WAT 7841 79.813 110.572 129.669 1.00 0.00 H TER 21045 WAT 7841 ATOM 21045 O WAT 7842 44.977 139.661 73.199 1.00 0.00 O ATOM 21046 H1 WAT 7842 44.773 140.596 73.228 1.00 0.00 H ATOM 21047 H2 WAT 7842 44.609 139.310 74.010 1.00 0.00 H TER 21049 WAT 7842 ATOM 21049 O WAT 7843 79.763 80.228 12.304 1.00 0.00 O ATOM 21050 H1 WAT 7843 78.829 80.309 12.111 1.00 0.00 H ATOM 21051 H2 WAT 7843 79.828 80.391 13.245 1.00 0.00 H TER 21053 WAT 7843 ATOM 21053 O WAT 7844 39.412 145.068 145.990 1.00 0.00 O ATOM 21054 H1 WAT 7844 38.690 144.803 145.420 1.00 0.00 H ATOM 21055 H2 WAT 7844 39.486 144.359 146.629 1.00 0.00 H TER 21057 WAT 7844 ATOM 21057 O WAT 7845 11.745 33.290 123.859 1.00 0.00 O ATOM 21058 H1 WAT 7845 12.480 32.930 123.364 1.00 0.00 H ATOM 21059 H2 WAT 7845 10.968 32.947 123.417 1.00 0.00 H TER 21061 WAT 7845 ATOM 21061 O WAT 7846 133.985 134.044 9.847 1.00 0.00 O ATOM 21062 H1 WAT 7846 133.457 134.081 10.645 1.00 0.00 H ATOM 21063 H2 WAT 7846 133.523 133.425 9.282 1.00 0.00 H TER 21065 WAT 7846 ATOM 21065 O WAT 7847 93.465 130.649 150.800 1.00 0.00 O ATOM 21066 H1 WAT 7847 93.340 131.371 150.184 1.00 0.00 H ATOM 21067 H2 WAT 7847 94.227 130.177 150.464 1.00 0.00 H TER 21069 WAT 7847 ATOM 21069 O WAT 7848 134.084 57.090 23.210 1.00 0.00 O ATOM 21070 H1 WAT 7848 133.282 56.568 23.165 1.00 0.00 H ATOM 21071 H2 WAT 7848 133.964 57.648 23.979 1.00 0.00 H TER 21073 WAT 7848 ATOM 21073 O WAT 7849 16.189 134.075 119.926 1.00 0.00 O ATOM 21074 H1 WAT 7849 16.978 133.961 120.456 1.00 0.00 H ATOM 21075 H2 WAT 7849 15.792 133.204 119.898 1.00 0.00 H TER 21077 WAT 7849 ATOM 21077 O WAT 7850 90.313 66.046 114.463 1.00 0.00 O ATOM 21078 H1 WAT 7850 89.571 66.208 113.880 1.00 0.00 H ATOM 21079 H2 WAT 7850 90.602 65.160 114.243 1.00 0.00 H TER 21081 WAT 7850 ATOM 21081 O WAT 7851 128.899 19.940 0.984 1.00 0.00 O ATOM 21082 H1 WAT 7851 129.648 20.529 1.076 1.00 0.00 H ATOM 21083 H2 WAT 7851 129.281 19.108 0.706 1.00 0.00 H TER 21085 WAT 7851 ATOM 21085 O WAT 7852 26.447 115.654 74.317 1.00 0.00 O ATOM 21086 H1 WAT 7852 27.033 116.370 74.072 1.00 0.00 H ATOM 21087 H2 WAT 7852 26.667 114.946 73.712 1.00 0.00 H TER 21089 WAT 7852 ATOM 21089 O WAT 7853 27.009 137.687 133.387 1.00 0.00 O ATOM 21090 H1 WAT 7853 27.184 138.138 132.561 1.00 0.00 H ATOM 21091 H2 WAT 7853 26.980 136.759 133.151 1.00 0.00 H TER 21093 WAT 7853 ATOM 21093 O WAT 7854 51.951 16.950 20.895 1.00 0.00 O ATOM 21094 H1 WAT 7854 52.486 17.689 21.186 1.00 0.00 H ATOM 21095 H2 WAT 7854 51.453 16.695 21.672 1.00 0.00 H TER 21097 WAT 7854 ATOM 21097 O WAT 7855 90.266 119.728 21.793 1.00 0.00 O ATOM 21098 H1 WAT 7855 90.220 120.025 22.702 1.00 0.00 H ATOM 21099 H2 WAT 7855 91.094 120.081 21.468 1.00 0.00 H TER 21101 WAT 7855 ATOM 21101 O WAT 7856 108.998 32.713 89.846 1.00 0.00 O ATOM 21102 H1 WAT 7856 108.228 33.269 89.966 1.00 0.00 H ATOM 21103 H2 WAT 7856 109.185 32.762 88.909 1.00 0.00 H TER 21105 WAT 7856 ATOM 21105 O WAT 7857 111.738 66.395 117.548 1.00 0.00 O ATOM 21106 H1 WAT 7857 112.684 66.435 117.406 1.00 0.00 H ATOM 21107 H2 WAT 7857 111.372 66.236 116.678 1.00 0.00 H TER 21109 WAT 7857 ATOM 21109 O WAT 7858 102.954 132.426 71.447 1.00 0.00 O ATOM 21110 H1 WAT 7858 103.592 133.131 71.561 1.00 0.00 H ATOM 21111 H2 WAT 7858 102.856 132.048 72.321 1.00 0.00 H TER 21113 WAT 7858 ATOM 21113 O WAT 7859 92.933 38.346 109.020 1.00 0.00 O ATOM 21114 H1 WAT 7859 93.283 39.180 109.334 1.00 0.00 H ATOM 21115 H2 WAT 7859 92.614 37.908 109.810 1.00 0.00 H TER 21117 WAT 7859 ATOM 21117 O WAT 7860 80.047 33.727 145.638 1.00 0.00 O ATOM 21118 H1 WAT 7860 79.565 34.133 146.359 1.00 0.00 H ATOM 21119 H2 WAT 7860 79.488 33.005 145.353 1.00 0.00 H TER 21121 WAT 7860 ATOM 21121 O WAT 7861 95.268 67.118 69.690 1.00 0.00 O ATOM 21122 H1 WAT 7861 96.037 67.599 69.384 1.00 0.00 H ATOM 21123 H2 WAT 7861 94.759 66.952 68.897 1.00 0.00 H TER 21125 WAT 7861 ATOM 21125 O WAT 7862 113.285 17.373 74.980 1.00 0.00 O ATOM 21126 H1 WAT 7862 112.611 17.743 75.550 1.00 0.00 H ATOM 21127 H2 WAT 7862 114.109 17.568 75.425 1.00 0.00 H TER 21129 WAT 7862 ATOM 21129 O WAT 7863 80.972 47.889 102.971 1.00 0.00 O ATOM 21130 H1 WAT 7863 80.565 48.262 103.753 1.00 0.00 H ATOM 21131 H2 WAT 7863 80.357 48.084 102.264 1.00 0.00 H TER 21133 WAT 7863 ATOM 21133 O WAT 7864 18.984 11.731 142.568 1.00 0.00 O ATOM 21134 H1 WAT 7864 19.625 12.413 142.769 1.00 0.00 H ATOM 21135 H2 WAT 7864 19.194 11.019 143.172 1.00 0.00 H TER 21137 WAT 7864 ATOM 21137 O WAT 7865 3.096 95.544 105.427 1.00 0.00 O ATOM 21138 H1 WAT 7865 2.153 95.515 105.586 1.00 0.00 H ATOM 21139 H2 WAT 7865 3.446 94.806 105.926 1.00 0.00 H TER 21141 WAT 7865 ATOM 21141 O WAT 7866 76.254 88.962 153.794 1.00 0.00 O ATOM 21142 H1 WAT 7866 75.911 89.490 154.515 1.00 0.00 H ATOM 21143 H2 WAT 7866 75.554 88.965 153.141 1.00 0.00 H TER 21145 WAT 7866 ATOM 21145 O WAT 7867 109.596 84.780 68.075 1.00 0.00 O ATOM 21146 H1 WAT 7867 109.909 84.001 68.534 1.00 0.00 H ATOM 21147 H2 WAT 7867 109.106 84.437 67.328 1.00 0.00 H TER 21149 WAT 7867 ATOM 21149 O WAT 7868 129.235 28.788 105.024 1.00 0.00 O ATOM 21150 H1 WAT 7868 130.045 28.426 105.382 1.00 0.00 H ATOM 21151 H2 WAT 7868 129.487 29.142 104.172 1.00 0.00 H TER 21153 WAT 7868 ATOM 21153 O WAT 7869 145.724 38.136 105.470 1.00 0.00 O ATOM 21154 H1 WAT 7869 145.289 37.455 105.984 1.00 0.00 H ATOM 21155 H2 WAT 7869 145.276 38.945 105.717 1.00 0.00 H TER 21157 WAT 7869 ATOM 21157 O WAT 7870 131.800 140.823 66.975 1.00 0.00 O ATOM 21158 H1 WAT 7870 131.583 141.610 67.475 1.00 0.00 H ATOM 21159 H2 WAT 7870 132.593 141.057 66.492 1.00 0.00 H TER 21161 WAT 7870 ATOM 21161 O WAT 7871 108.278 105.856 114.978 1.00 0.00 O ATOM 21162 H1 WAT 7871 108.120 105.658 114.054 1.00 0.00 H ATOM 21163 H2 WAT 7871 108.487 105.009 115.372 1.00 0.00 H TER 21165 WAT 7871 ATOM 21165 O WAT 7872 78.772 58.141 83.673 1.00 0.00 O ATOM 21166 H1 WAT 7872 79.428 58.067 82.981 1.00 0.00 H ATOM 21167 H2 WAT 7872 79.227 58.588 84.387 1.00 0.00 H TER 21169 WAT 7872 ATOM 21169 O WAT 7873 39.598 97.963 146.910 1.00 0.00 O ATOM 21170 H1 WAT 7873 40.180 98.671 147.183 1.00 0.00 H ATOM 21171 H2 WAT 7873 40.154 97.184 146.904 1.00 0.00 H TER 21173 WAT 7873 ATOM 21173 O WAT 7874 44.677 17.972 90.597 1.00 0.00 O ATOM 21174 H1 WAT 7874 45.535 17.891 90.180 1.00 0.00 H ATOM 21175 H2 WAT 7874 44.768 18.716 91.192 1.00 0.00 H TER 21177 WAT 7874 ATOM 21177 O WAT 7875 47.579 110.700 150.575 1.00 0.00 O ATOM 21178 H1 WAT 7875 48.159 111.307 150.116 1.00 0.00 H ATOM 21179 H2 WAT 7875 46.834 110.587 149.985 1.00 0.00 H TER 21181 WAT 7875 ATOM 21181 O WAT 7876 106.812 33.412 156.571 1.00 0.00 O ATOM 21182 H1 WAT 7876 106.440 34.228 156.238 1.00 0.00 H ATOM 21183 H2 WAT 7876 107.650 33.327 156.116 1.00 0.00 H TER 21185 WAT 7876 ATOM 21185 O WAT 7877 59.991 91.306 89.477 1.00 0.00 O ATOM 21186 H1 WAT 7877 60.100 91.518 88.550 1.00 0.00 H ATOM 21187 H2 WAT 7877 60.759 90.778 89.694 1.00 0.00 H TER 21189 WAT 7877 ATOM 21189 O WAT 7878 65.100 19.832 129.612 1.00 0.00 O ATOM 21190 H1 WAT 7878 65.152 19.013 129.120 1.00 0.00 H ATOM 21191 H2 WAT 7878 64.516 19.636 130.344 1.00 0.00 H TER 21193 WAT 7878 ATOM 21193 O WAT 7879 91.966 6.329 143.628 1.00 0.00 O ATOM 21194 H1 WAT 7879 92.410 5.925 142.882 1.00 0.00 H ATOM 21195 H2 WAT 7879 91.607 5.592 144.122 1.00 0.00 H TER 21197 WAT 7879 ATOM 21197 O WAT 7880 68.710 81.050 89.542 1.00 0.00 O ATOM 21198 H1 WAT 7880 69.448 80.442 89.571 1.00 0.00 H ATOM 21199 H2 WAT 7880 68.016 80.609 90.031 1.00 0.00 H TER 21201 WAT 7880 ATOM 21201 O WAT 7881 140.361 40.155 96.003 1.00 0.00 O ATOM 21202 H1 WAT 7881 140.578 39.271 95.709 1.00 0.00 H ATOM 21203 H2 WAT 7881 139.850 40.023 96.802 1.00 0.00 H TER 21205 WAT 7881 ATOM 21205 O WAT 7882 76.474 135.194 81.944 1.00 0.00 O ATOM 21206 H1 WAT 7882 76.481 135.084 82.895 1.00 0.00 H ATOM 21207 H2 WAT 7882 77.356 134.946 81.668 1.00 0.00 H TER 21209 WAT 7882 ATOM 21209 O WAT 7883 70.351 69.385 117.331 1.00 0.00 O ATOM 21210 H1 WAT 7883 70.187 69.708 116.445 1.00 0.00 H ATOM 21211 H2 WAT 7883 69.514 69.013 117.609 1.00 0.00 H TER 21213 WAT 7883 ATOM 21213 O WAT 7884 92.643 54.853 140.500 1.00 0.00 O ATOM 21214 H1 WAT 7884 92.659 55.171 141.402 1.00 0.00 H ATOM 21215 H2 WAT 7884 93.561 54.856 140.228 1.00 0.00 H TER 21217 WAT 7884 ATOM 21217 O WAT 7885 142.602 68.928 123.645 1.00 0.00 O ATOM 21218 H1 WAT 7885 142.020 68.377 123.122 1.00 0.00 H ATOM 21219 H2 WAT 7885 143.161 69.364 123.002 1.00 0.00 H TER 21221 WAT 7885 ATOM 21221 O WAT 7886 2.137 40.948 134.483 1.00 0.00 O ATOM 21222 H1 WAT 7886 2.556 40.677 135.300 1.00 0.00 H ATOM 21223 H2 WAT 7886 1.263 40.558 134.520 1.00 0.00 H TER 21225 WAT 7886 ATOM 21225 O WAT 7887 50.486 80.174 127.652 1.00 0.00 O ATOM 21226 H1 WAT 7887 50.006 80.910 127.273 1.00 0.00 H ATOM 21227 H2 WAT 7887 49.811 79.523 127.848 1.00 0.00 H TER 21229 WAT 7887 ATOM 21229 O WAT 7888 40.987 8.190 9.469 1.00 0.00 O ATOM 21230 H1 WAT 7888 41.508 7.935 10.231 1.00 0.00 H ATOM 21231 H2 WAT 7888 41.123 9.135 9.392 1.00 0.00 H TER 21233 WAT 7888 ATOM 21233 O WAT 7889 87.213 127.633 154.726 1.00 0.00 O ATOM 21234 H1 WAT 7889 87.431 127.342 155.612 1.00 0.00 H ATOM 21235 H2 WAT 7889 86.473 128.228 154.845 1.00 0.00 H TER 21237 WAT 7889 ATOM 21237 O WAT 7890 52.124 31.265 14.545 1.00 0.00 O ATOM 21238 H1 WAT 7890 51.410 31.760 14.143 1.00 0.00 H ATOM 21239 H2 WAT 7890 51.869 30.349 14.438 1.00 0.00 H TER 21241 WAT 7890 ATOM 21241 O WAT 7891 97.595 107.176 96.735 1.00 0.00 O ATOM 21242 H1 WAT 7891 97.602 106.909 97.654 1.00 0.00 H ATOM 21243 H2 WAT 7891 98.020 108.033 96.732 1.00 0.00 H TER 21245 WAT 7891 ATOM 21245 O WAT 7892 28.105 93.110 126.967 1.00 0.00 O ATOM 21246 H1 WAT 7892 28.792 93.763 126.835 1.00 0.00 H ATOM 21247 H2 WAT 7892 28.009 92.689 126.113 1.00 0.00 H TER 21249 WAT 7892 ATOM 21249 O WAT 7893 6.813 6.238 73.378 1.00 0.00 O ATOM 21250 H1 WAT 7893 6.420 5.850 72.596 1.00 0.00 H ATOM 21251 H2 WAT 7893 6.188 6.053 74.078 1.00 0.00 H TER 21253 WAT 7893 ATOM 21253 O WAT 7894 69.885 145.186 144.660 1.00 0.00 O ATOM 21254 H1 WAT 7894 70.652 144.629 144.792 1.00 0.00 H ATOM 21255 H2 WAT 7894 69.552 145.346 145.543 1.00 0.00 H TER 21257 WAT 7894 ATOM 21257 O WAT 7895 96.942 11.884 58.457 1.00 0.00 O ATOM 21258 H1 WAT 7895 97.406 11.919 59.293 1.00 0.00 H ATOM 21259 H2 WAT 7895 97.443 11.261 57.930 1.00 0.00 H TER 21261 WAT 7895 ATOM 21261 O WAT 7896 139.740 9.457 141.364 1.00 0.00 O ATOM 21262 H1 WAT 7896 139.463 10.370 141.290 1.00 0.00 H ATOM 21263 H2 WAT 7896 138.984 8.952 141.063 1.00 0.00 H TER 21265 WAT 7896 ATOM 21265 O WAT 7897 111.405 86.772 118.355 1.00 0.00 O ATOM 21266 H1 WAT 7897 110.456 86.807 118.472 1.00 0.00 H ATOM 21267 H2 WAT 7897 111.737 87.513 118.862 1.00 0.00 H TER 21269 WAT 7897 ATOM 21269 O WAT 7898 8.039 74.086 81.053 1.00 0.00 O ATOM 21270 H1 WAT 7898 7.339 73.598 80.618 1.00 0.00 H ATOM 21271 H2 WAT 7898 8.668 73.416 81.320 1.00 0.00 H TER 21273 WAT 7898 ATOM 21273 O WAT 7899 85.605 87.345 132.138 1.00 0.00 O ATOM 21274 H1 WAT 7899 84.853 87.189 131.566 1.00 0.00 H ATOM 21275 H2 WAT 7899 86.092 88.047 131.707 1.00 0.00 H TER 21277 WAT 7899 ATOM 21277 O WAT 7900 22.431 54.344 132.608 1.00 0.00 O ATOM 21278 H1 WAT 7900 22.154 54.100 133.491 1.00 0.00 H ATOM 21279 H2 WAT 7900 22.078 53.653 132.047 1.00 0.00 H TER 21281 WAT 7900 ATOM 21281 O WAT 7901 139.898 123.738 129.561 1.00 0.00 O ATOM 21282 H1 WAT 7901 140.781 123.860 129.910 1.00 0.00 H ATOM 21283 H2 WAT 7901 139.563 124.627 129.439 1.00 0.00 H TER 21285 WAT 7901 ATOM 21285 O WAT 7902 41.125 6.580 4.370 1.00 0.00 O ATOM 21286 H1 WAT 7902 41.083 6.844 5.289 1.00 0.00 H ATOM 21287 H2 WAT 7902 41.784 5.886 4.350 1.00 0.00 H TER 21289 WAT 7902 ATOM 21289 O WAT 7903 103.336 122.875 152.419 1.00 0.00 O ATOM 21290 H1 WAT 7903 102.748 122.938 153.171 1.00 0.00 H ATOM 21291 H2 WAT 7903 104.174 123.208 152.740 1.00 0.00 H TER 21293 WAT 7903 ATOM 21293 O WAT 7904 39.940 34.327 141.870 1.00 0.00 O ATOM 21294 H1 WAT 7904 40.145 34.105 140.962 1.00 0.00 H ATOM 21295 H2 WAT 7904 40.554 35.027 142.090 1.00 0.00 H TER 21297 WAT 7904 ATOM 21297 O WAT 7905 37.389 33.929 0.942 1.00 0.00 O ATOM 21298 H1 WAT 7905 36.924 34.022 1.773 1.00 0.00 H ATOM 21299 H2 WAT 7905 38.250 33.587 1.186 1.00 0.00 H TER 21301 WAT 7905 ATOM 21301 O WAT 7906 66.053 32.340 158.641 1.00 0.00 O ATOM 21302 H1 WAT 7906 65.882 32.018 157.756 1.00 0.00 H ATOM 21303 H2 WAT 7906 65.495 31.803 159.203 1.00 0.00 H TER 21305 WAT 7906 ATOM 21305 O WAT 7907 96.973 119.501 85.962 1.00 0.00 O ATOM 21306 H1 WAT 7907 97.183 119.214 86.851 1.00 0.00 H ATOM 21307 H2 WAT 7907 97.299 120.400 85.916 1.00 0.00 H TER 21309 WAT 7907 ATOM 21309 O WAT 7908 66.753 107.460 123.021 1.00 0.00 O ATOM 21310 H1 WAT 7908 67.403 107.775 123.650 1.00 0.00 H ATOM 21311 H2 WAT 7908 65.926 107.835 123.324 1.00 0.00 H TER 21313 WAT 7908 ATOM 21313 O WAT 7909 5.915 81.127 83.335 1.00 0.00 O ATOM 21314 H1 WAT 7909 5.426 80.402 82.946 1.00 0.00 H ATOM 21315 H2 WAT 7909 6.131 80.823 84.217 1.00 0.00 H TER 21317 WAT 7909 ATOM 21317 O WAT 7910 142.181 82.141 153.001 1.00 0.00 O ATOM 21318 H1 WAT 7910 142.563 82.806 153.574 1.00 0.00 H ATOM 21319 H2 WAT 7910 142.861 81.472 152.924 1.00 0.00 H TER 21321 WAT 7910 ATOM 21321 O WAT 7911 45.836 57.309 118.585 1.00 0.00 O ATOM 21322 H1 WAT 7911 45.872 56.390 118.850 1.00 0.00 H ATOM 21323 H2 WAT 7911 44.980 57.612 118.887 1.00 0.00 H TER 21325 WAT 7911 ATOM 21325 O WAT 7912 92.493 12.619 150.051 1.00 0.00 O ATOM 21326 H1 WAT 7912 91.936 12.310 150.766 1.00 0.00 H ATOM 21327 H2 WAT 7912 92.533 13.567 150.171 1.00 0.00 H TER 21329 WAT 7912 ATOM 21329 O WAT 7913 97.939 16.143 11.925 1.00 0.00 O ATOM 21330 H1 WAT 7913 97.648 16.424 12.792 1.00 0.00 H ATOM 21331 H2 WAT 7913 97.354 15.421 11.698 1.00 0.00 H TER 21333 WAT 7913 ATOM 21333 O WAT 7914 58.935 4.143 18.831 1.00 0.00 O ATOM 21334 H1 WAT 7914 59.512 3.403 19.022 1.00 0.00 H ATOM 21335 H2 WAT 7914 59.365 4.894 19.240 1.00 0.00 H TER 21337 WAT 7914 ATOM 21337 O WAT 7915 9.443 14.533 156.097 1.00 0.00 O ATOM 21338 H1 WAT 7915 9.424 14.624 155.144 1.00 0.00 H ATOM 21339 H2 WAT 7915 8.654 14.984 156.396 1.00 0.00 H TER 21341 WAT 7915 ATOM 21341 O WAT 7916 26.488 118.849 157.141 1.00 0.00 O ATOM 21342 H1 WAT 7916 26.717 118.583 156.250 1.00 0.00 H ATOM 21343 H2 WAT 7916 26.937 119.685 157.263 1.00 0.00 H TER 21345 WAT 7916 ATOM 21345 O WAT 7917 88.244 26.655 87.455 1.00 0.00 O ATOM 21346 H1 WAT 7917 89.043 26.140 87.340 1.00 0.00 H ATOM 21347 H2 WAT 7917 88.546 27.562 87.487 1.00 0.00 H TER 21349 WAT 7917 ATOM 21349 O WAT 7918 60.609 145.343 117.394 1.00 0.00 O ATOM 21350 H1 WAT 7918 61.126 145.784 118.067 1.00 0.00 H ATOM 21351 H2 WAT 7918 61.256 145.022 116.766 1.00 0.00 H TER 21353 WAT 7918 ATOM 21353 O WAT 7919 24.840 36.431 97.744 1.00 0.00 O ATOM 21354 H1 WAT 7919 24.508 35.553 97.557 1.00 0.00 H ATOM 21355 H2 WAT 7919 25.528 36.570 97.094 1.00 0.00 H TER 21357 WAT 7919 ATOM 21357 O WAT 7920 42.608 59.121 104.853 1.00 0.00 O ATOM 21358 H1 WAT 7920 43.200 58.405 104.626 1.00 0.00 H ATOM 21359 H2 WAT 7920 43.118 59.915 104.691 1.00 0.00 H TER 21361 WAT 7920 ATOM 21361 O WAT 7921 101.867 78.510 138.320 1.00 0.00 O ATOM 21362 H1 WAT 7921 101.399 78.464 137.486 1.00 0.00 H ATOM 21363 H2 WAT 7921 102.709 78.092 138.145 1.00 0.00 H TER 21365 WAT 7921 ATOM 21365 O WAT 7922 72.047 50.895 96.742 1.00 0.00 O ATOM 21366 H1 WAT 7922 72.090 50.883 95.786 1.00 0.00 H ATOM 21367 H2 WAT 7922 71.210 51.316 96.939 1.00 0.00 H TER 21369 WAT 7922 ATOM 21369 O WAT 7923 135.711 48.795 9.341 1.00 0.00 O ATOM 21370 H1 WAT 7923 135.469 49.719 9.406 1.00 0.00 H ATOM 21371 H2 WAT 7923 136.618 48.805 9.036 1.00 0.00 H TER 21373 WAT 7923 ATOM 21373 O WAT 7924 70.008 21.694 19.814 1.00 0.00 O ATOM 21374 H1 WAT 7924 69.142 21.313 19.669 1.00 0.00 H ATOM 21375 H2 WAT 7924 70.203 21.503 20.732 1.00 0.00 H TER 21377 WAT 7924 ATOM 21377 O WAT 7925 57.842 114.653 82.160 1.00 0.00 O ATOM 21378 H1 WAT 7925 58.069 114.602 81.231 1.00 0.00 H ATOM 21379 H2 WAT 7925 58.327 115.412 82.484 1.00 0.00 H TER 21381 WAT 7925 ATOM 21381 O WAT 7926 76.846 52.497 8.501 1.00 0.00 O ATOM 21382 H1 WAT 7926 76.592 51.812 7.882 1.00 0.00 H ATOM 21383 H2 WAT 7926 77.658 52.855 8.143 1.00 0.00 H TER 21385 WAT 7926 ATOM 21385 O WAT 7927 59.653 68.564 65.524 1.00 0.00 O ATOM 21386 H1 WAT 7927 59.668 68.376 66.463 1.00 0.00 H ATOM 21387 H2 WAT 7927 60.163 69.369 65.433 1.00 0.00 H TER 21389 WAT 7927 ATOM 21389 O WAT 7928 60.102 98.819 16.525 1.00 0.00 O ATOM 21390 H1 WAT 7928 60.895 98.285 16.569 1.00 0.00 H ATOM 21391 H2 WAT 7928 59.837 98.930 17.438 1.00 0.00 H TER 21393 WAT 7928 ATOM 21393 O WAT 7929 24.232 107.269 3.435 1.00 0.00 O ATOM 21394 H1 WAT 7929 24.546 106.374 3.569 1.00 0.00 H ATOM 21395 H2 WAT 7929 24.078 107.603 4.319 1.00 0.00 H TER 21397 WAT 7929 ATOM 21397 O WAT 7930 0.879 142.962 113.696 1.00 0.00 O ATOM 21398 H1 WAT 7930 0.087 142.998 113.160 1.00 0.00 H ATOM 21399 H2 WAT 7930 1.572 142.716 113.083 1.00 0.00 H TER 21401 WAT 7930 ATOM 21401 O WAT 7931 33.384 124.444 121.737 1.00 0.00 O ATOM 21402 H1 WAT 7931 34.335 124.483 121.842 1.00 0.00 H ATOM 21403 H2 WAT 7931 33.245 124.494 120.791 1.00 0.00 H TER 21405 WAT 7931 ATOM 21405 O WAT 7932 120.299 42.972 99.926 1.00 0.00 O ATOM 21406 H1 WAT 7932 120.757 42.547 100.652 1.00 0.00 H ATOM 21407 H2 WAT 7932 120.656 43.859 99.904 1.00 0.00 H TER 21409 WAT 7932 ATOM 21409 O WAT 7933 132.386 108.179 72.684 1.00 0.00 O ATOM 21410 H1 WAT 7933 132.952 108.483 73.393 1.00 0.00 H ATOM 21411 H2 WAT 7933 131.869 107.475 73.076 1.00 0.00 H TER 21413 WAT 7933 ATOM 21413 O WAT 7934 88.601 118.824 110.784 1.00 0.00 O ATOM 21414 H1 WAT 7934 88.950 117.991 111.099 1.00 0.00 H ATOM 21415 H2 WAT 7934 89.296 119.181 110.231 1.00 0.00 H TER 21417 WAT 7934 ATOM 21417 O WAT 7935 79.179 98.628 4.049 1.00 0.00 O ATOM 21418 H1 WAT 7935 78.876 98.126 4.806 1.00 0.00 H ATOM 21419 H2 WAT 7935 79.375 99.497 4.400 1.00 0.00 H TER 21421 WAT 7935 ATOM 21421 O WAT 7936 137.625 104.184 79.302 1.00 0.00 O ATOM 21422 H1 WAT 7936 137.229 104.858 79.854 1.00 0.00 H ATOM 21423 H2 WAT 7936 138.326 103.815 79.839 1.00 0.00 H TER 21425 WAT 7936 ATOM 21425 O WAT 7937 64.745 72.511 138.261 1.00 0.00 O ATOM 21426 H1 WAT 7937 64.942 71.810 138.883 1.00 0.00 H ATOM 21427 H2 WAT 7937 63.817 72.699 138.398 1.00 0.00 H TER 21429 WAT 7937 ATOM 21429 O WAT 7938 19.811 142.106 63.961 1.00 0.00 O ATOM 21430 H1 WAT 7938 20.626 141.877 63.514 1.00 0.00 H ATOM 21431 H2 WAT 7938 19.955 142.998 64.279 1.00 0.00 H TER 21433 WAT 7938 ATOM 21433 O WAT 7939 131.136 59.836 144.957 1.00 0.00 O ATOM 21434 H1 WAT 7939 130.612 59.041 145.057 1.00 0.00 H ATOM 21435 H2 WAT 7939 131.281 60.142 145.852 1.00 0.00 H TER 21437 WAT 7939 ATOM 21437 O WAT 7940 89.852 43.492 84.621 1.00 0.00 O ATOM 21438 H1 WAT 7940 90.099 44.368 84.323 1.00 0.00 H ATOM 21439 H2 WAT 7940 90.189 43.441 85.516 1.00 0.00 H TER 21441 WAT 7940 ATOM 21441 O WAT 7941 79.047 143.235 10.882 1.00 0.00 O ATOM 21442 H1 WAT 7941 79.262 142.384 10.502 1.00 0.00 H ATOM 21443 H2 WAT 7941 79.896 143.635 11.072 1.00 0.00 H TER 21445 WAT 7941 ATOM 21445 O WAT 7942 39.052 114.118 96.577 1.00 0.00 O ATOM 21446 H1 WAT 7942 38.949 113.768 95.692 1.00 0.00 H ATOM 21447 H2 WAT 7942 38.990 113.352 97.147 1.00 0.00 H TER 21449 WAT 7942 ATOM 21449 O WAT 7943 89.621 37.123 154.412 1.00 0.00 O ATOM 21450 H1 WAT 7943 90.290 36.703 154.953 1.00 0.00 H ATOM 21451 H2 WAT 7943 88.846 37.156 154.973 1.00 0.00 H TER 21453 WAT 7943 ATOM 21453 O WAT 7944 101.419 32.564 91.025 1.00 0.00 O ATOM 21454 H1 WAT 7944 101.677 33.053 90.243 1.00 0.00 H ATOM 21455 H2 WAT 7944 102.108 31.909 91.135 1.00 0.00 H TER 21457 WAT 7944 ATOM 21457 O WAT 7945 9.294 138.670 133.478 1.00 0.00 O ATOM 21458 H1 WAT 7945 8.578 138.045 133.593 1.00 0.00 H ATOM 21459 H2 WAT 7945 9.349 138.801 132.532 1.00 0.00 H TER 21461 WAT 7945 ATOM 21461 O WAT 7946 48.159 2.121 153.890 1.00 0.00 O ATOM 21462 H1 WAT 7946 48.282 1.757 153.014 1.00 0.00 H ATOM 21463 H2 WAT 7946 49.019 2.470 154.127 1.00 0.00 H TER 21465 WAT 7946 ATOM 21465 O WAT 7947 49.522 91.543 71.460 1.00 0.00 O ATOM 21466 H1 WAT 7947 50.182 91.584 70.767 1.00 0.00 H ATOM 21467 H2 WAT 7947 49.221 90.634 71.450 1.00 0.00 H TER 21469 WAT 7947 ATOM 21469 O WAT 7948 121.414 109.121 86.800 1.00 0.00 O ATOM 21470 H1 WAT 7948 121.372 108.191 87.024 1.00 0.00 H ATOM 21471 H2 WAT 7948 122.070 109.170 86.105 1.00 0.00 H TER 21473 WAT 7948 ATOM 21473 O WAT 7949 54.709 120.101 95.330 1.00 0.00 O ATOM 21474 H1 WAT 7949 55.550 120.504 95.113 1.00 0.00 H ATOM 21475 H2 WAT 7949 54.898 119.164 95.379 1.00 0.00 H TER 21477 WAT 7949 ATOM 21477 O WAT 7950 72.364 135.597 88.593 1.00 0.00 O ATOM 21478 H1 WAT 7950 72.173 136.535 88.607 1.00 0.00 H ATOM 21479 H2 WAT 7950 71.686 135.223 88.031 1.00 0.00 H TER 21481 WAT 7950 ATOM 21481 O WAT 7951 99.618 100.414 108.624 1.00 0.00 O ATOM 21482 H1 WAT 7951 100.494 100.596 108.963 1.00 0.00 H ATOM 21483 H2 WAT 7951 99.544 100.963 107.843 1.00 0.00 H TER 21485 WAT 7951 ATOM 21485 O WAT 7952 65.211 109.190 132.369 1.00 0.00 O ATOM 21486 H1 WAT 7952 65.136 108.690 131.556 1.00 0.00 H ATOM 21487 H2 WAT 7952 64.354 109.100 132.786 1.00 0.00 H TER 21489 WAT 7952 ATOM 21489 O WAT 7953 121.726 96.425 62.588 1.00 0.00 O ATOM 21490 H1 WAT 7953 121.298 96.021 61.833 1.00 0.00 H ATOM 21491 H2 WAT 7953 121.715 97.363 62.395 1.00 0.00 H TER 21493 WAT 7953 ATOM 21493 O WAT 7954 105.654 144.887 110.259 1.00 0.00 O ATOM 21494 H1 WAT 7954 105.645 144.007 109.884 1.00 0.00 H ATOM 21495 H2 WAT 7954 106.406 145.315 109.848 1.00 0.00 H TER 21497 WAT 7954 ATOM 21497 O WAT 7955 40.124 145.006 74.446 1.00 0.00 O ATOM 21498 H1 WAT 7955 40.825 144.846 73.813 1.00 0.00 H ATOM 21499 H2 WAT 7955 39.398 144.461 74.141 1.00 0.00 H TER 21501 WAT 7955 ATOM 21501 O WAT 7956 61.793 130.790 150.012 1.00 0.00 O ATOM 21502 H1 WAT 7956 62.424 130.082 150.144 1.00 0.00 H ATOM 21503 H2 WAT 7956 61.387 130.912 150.870 1.00 0.00 H TER 21505 WAT 7956 ATOM 21505 O WAT 7957 38.784 2.839 4.549 1.00 0.00 O ATOM 21506 H1 WAT 7957 39.082 3.059 5.432 1.00 0.00 H ATOM 21507 H2 WAT 7957 38.645 3.686 4.125 1.00 0.00 H TER 21509 WAT 7957 ATOM 21509 O WAT 7958 21.547 54.486 9.654 1.00 0.00 O ATOM 21510 H1 WAT 7958 22.271 54.399 10.274 1.00 0.00 H ATOM 21511 H2 WAT 7958 20.857 54.925 10.152 1.00 0.00 H TER 21513 WAT 7958 ATOM 21513 O WAT 7959 32.011 105.881 97.457 1.00 0.00 O ATOM 21514 H1 WAT 7959 31.728 104.985 97.271 1.00 0.00 H ATOM 21515 H2 WAT 7959 32.360 105.842 98.347 1.00 0.00 H TER 21517 WAT 7959 ATOM 21517 O WAT 7960 89.620 119.166 146.312 1.00 0.00 O ATOM 21518 H1 WAT 7960 89.382 120.091 146.371 1.00 0.00 H ATOM 21519 H2 WAT 7960 89.796 119.023 145.382 1.00 0.00 H TER 21521 WAT 7960 ATOM 21521 O WAT 7961 88.299 92.241 154.519 1.00 0.00 O ATOM 21522 H1 WAT 7961 88.607 92.536 155.376 1.00 0.00 H ATOM 21523 H2 WAT 7961 88.925 91.566 154.259 1.00 0.00 H TER 21525 WAT 7961 ATOM 21525 O WAT 7962 74.294 118.680 146.761 1.00 0.00 O ATOM 21526 H1 WAT 7962 73.849 119.500 146.976 1.00 0.00 H ATOM 21527 H2 WAT 7962 73.779 118.005 147.202 1.00 0.00 H TER 21529 WAT 7962 ATOM 21529 O WAT 7963 129.832 116.652 145.426 1.00 0.00 O ATOM 21530 H1 WAT 7963 130.297 117.403 145.057 1.00 0.00 H ATOM 21531 H2 WAT 7963 129.858 116.795 146.372 1.00 0.00 H TER 21533 WAT 7963 ATOM 21533 O WAT 7964 22.589 94.023 135.320 1.00 0.00 O ATOM 21534 H1 WAT 7964 23.319 93.444 135.541 1.00 0.00 H ATOM 21535 H2 WAT 7964 22.941 94.906 135.435 1.00 0.00 H TER 21537 WAT 7964 ATOM 21537 O WAT 7965 105.126 89.278 158.482 1.00 0.00 O ATOM 21538 H1 WAT 7965 106.075 89.359 158.392 1.00 0.00 H ATOM 21539 H2 WAT 7965 104.771 89.840 157.794 1.00 0.00 H TER 21541 WAT 7965 ATOM 21541 O WAT 7966 53.178 106.989 79.494 1.00 0.00 O ATOM 21542 H1 WAT 7966 53.709 107.167 78.718 1.00 0.00 H ATOM 21543 H2 WAT 7966 52.994 106.051 79.449 1.00 0.00 H TER 21545 WAT 7966 ATOM 21545 O WAT 7967 119.182 111.465 150.179 1.00 0.00 O ATOM 21546 H1 WAT 7967 119.781 111.442 150.925 1.00 0.00 H ATOM 21547 H2 WAT 7967 118.669 110.661 150.258 1.00 0.00 H TER 21549 WAT 7967 ATOM 21549 O WAT 7968 64.723 107.181 150.593 1.00 0.00 O ATOM 21550 H1 WAT 7968 65.646 106.994 150.426 1.00 0.00 H ATOM 21551 H2 WAT 7968 64.405 106.414 151.069 1.00 0.00 H TER 21553 WAT 7968 ATOM 21553 O WAT 7969 72.506 16.291 112.878 1.00 0.00 O ATOM 21554 H1 WAT 7969 71.964 15.506 112.959 1.00 0.00 H ATOM 21555 H2 WAT 7969 72.389 16.571 111.971 1.00 0.00 H TER 21557 WAT 7969 ATOM 21557 O WAT 7970 122.453 55.560 80.390 1.00 0.00 O ATOM 21558 H1 WAT 7970 122.217 55.884 81.260 1.00 0.00 H ATOM 21559 H2 WAT 7970 122.895 54.728 80.557 1.00 0.00 H TER 21561 WAT 7970 ATOM 21561 O WAT 7971 138.207 115.428 123.062 1.00 0.00 O ATOM 21562 H1 WAT 7971 138.919 115.861 122.591 1.00 0.00 H ATOM 21563 H2 WAT 7971 138.609 115.118 123.873 1.00 0.00 H TER 21565 WAT 7971 ATOM 21565 O WAT 7972 42.523 16.474 118.484 1.00 0.00 O ATOM 21566 H1 WAT 7972 43.148 17.176 118.302 1.00 0.00 H ATOM 21567 H2 WAT 7972 41.757 16.922 118.842 1.00 0.00 H TER 21569 WAT 7972 ATOM 21569 O WAT 7973 70.643 120.622 62.155 1.00 0.00 O ATOM 21570 H1 WAT 7973 70.725 121.575 62.149 1.00 0.00 H ATOM 21571 H2 WAT 7973 70.542 120.384 61.233 1.00 0.00 H TER 21573 WAT 7973 ATOM 21573 O WAT 7974 144.942 64.270 84.304 1.00 0.00 O ATOM 21574 H1 WAT 7974 145.818 63.896 84.203 1.00 0.00 H ATOM 21575 H2 WAT 7974 144.482 64.024 83.501 1.00 0.00 H TER 21577 WAT 7974 ATOM 21577 O WAT 7975 10.776 85.020 116.914 1.00 0.00 O ATOM 21578 H1 WAT 7975 11.336 84.325 117.258 1.00 0.00 H ATOM 21579 H2 WAT 7975 9.896 84.788 117.210 1.00 0.00 H TER 21581 WAT 7975 ATOM 21581 O WAT 7976 9.343 53.218 83.193 1.00 0.00 O ATOM 21582 H1 WAT 7976 8.725 52.529 82.947 1.00 0.00 H ATOM 21583 H2 WAT 7976 9.403 53.774 82.416 1.00 0.00 H TER 21585 WAT 7976 ATOM 21585 O WAT 7977 131.547 31.717 99.767 1.00 0.00 O ATOM 21586 H1 WAT 7977 132.459 31.921 99.558 1.00 0.00 H ATOM 21587 H2 WAT 7977 131.362 30.915 99.280 1.00 0.00 H TER 21589 WAT 7977 ATOM 21589 O WAT 7978 27.090 29.911 63.411 1.00 0.00 O ATOM 21590 H1 WAT 7978 27.779 29.564 62.843 1.00 0.00 H ATOM 21591 H2 WAT 7978 27.556 30.448 64.052 1.00 0.00 H TER 21593 WAT 7978 ATOM 21593 O WAT 7979 8.953 4.708 87.414 1.00 0.00 O ATOM 21594 H1 WAT 7979 9.660 5.333 87.569 1.00 0.00 H ATOM 21595 H2 WAT 7979 8.159 5.241 87.405 1.00 0.00 H TER 21597 WAT 7979 ATOM 21597 O WAT 7980 23.852 51.049 85.388 1.00 0.00 O ATOM 21598 H1 WAT 7980 23.041 51.506 85.165 1.00 0.00 H ATOM 21599 H2 WAT 7980 24.128 51.442 86.216 1.00 0.00 H TER 21601 WAT 7980 ATOM 21601 O WAT 7981 10.127 16.696 57.634 1.00 0.00 O ATOM 21602 H1 WAT 7981 10.228 15.781 57.898 1.00 0.00 H ATOM 21603 H2 WAT 7981 9.697 16.653 56.780 1.00 0.00 H TER 21605 WAT 7981 ATOM 21605 O WAT 7982 24.820 62.921 138.203 1.00 0.00 O ATOM 21606 H1 WAT 7982 24.695 63.426 137.400 1.00 0.00 H ATOM 21607 H2 WAT 7982 24.062 62.337 138.239 1.00 0.00 H TER 21609 WAT 7982 ATOM 21609 O WAT 7983 82.162 80.732 151.270 1.00 0.00 O ATOM 21610 H1 WAT 7983 82.271 81.605 151.647 1.00 0.00 H ATOM 21611 H2 WAT 7983 81.316 80.432 151.602 1.00 0.00 H TER 21613 WAT 7983 ATOM 21613 O WAT 7984 42.035 130.080 106.924 1.00 0.00 O ATOM 21614 H1 WAT 7984 42.875 130.300 107.327 1.00 0.00 H ATOM 21615 H2 WAT 7984 42.220 130.054 105.985 1.00 0.00 H TER 21617 WAT 7984 ATOM 21617 O WAT 7985 119.906 93.627 142.755 1.00 0.00 O ATOM 21618 H1 WAT 7985 120.174 93.141 141.975 1.00 0.00 H ATOM 21619 H2 WAT 7985 120.430 94.428 142.731 1.00 0.00 H TER 21621 WAT 7985 ATOM 21621 O WAT 7986 90.976 120.910 94.607 1.00 0.00 O ATOM 21622 H1 WAT 7986 90.094 120.712 94.293 1.00 0.00 H ATOM 21623 H2 WAT 7986 91.428 120.066 94.598 1.00 0.00 H TER 21625 WAT 7986 ATOM 21625 O WAT 7987 61.940 46.915 120.097 1.00 0.00 O ATOM 21626 H1 WAT 7987 62.252 47.812 119.981 1.00 0.00 H ATOM 21627 H2 WAT 7987 61.793 46.596 119.207 1.00 0.00 H TER 21629 WAT 7987 ATOM 21629 O WAT 7988 92.409 118.424 82.685 1.00 0.00 O ATOM 21630 H1 WAT 7988 92.156 119.142 82.104 1.00 0.00 H ATOM 21631 H2 WAT 7988 91.593 118.161 83.110 1.00 0.00 H TER 21633 WAT 7988 ATOM 21633 O WAT 7989 1.499 60.514 118.920 1.00 0.00 O ATOM 21634 H1 WAT 7989 2.244 59.966 118.676 1.00 0.00 H ATOM 21635 H2 WAT 7989 0.914 59.925 119.396 1.00 0.00 H TER 21637 WAT 7989 ATOM 21637 O WAT 7990 84.211 80.521 87.553 1.00 0.00 O ATOM 21638 H1 WAT 7990 84.136 81.209 88.215 1.00 0.00 H ATOM 21639 H2 WAT 7990 83.388 80.566 87.067 1.00 0.00 H TER 21641 WAT 7990 ATOM 21641 O WAT 7991 32.606 39.009 126.186 1.00 0.00 O ATOM 21642 H1 WAT 7991 32.067 38.977 125.395 1.00 0.00 H ATOM 21643 H2 WAT 7991 33.435 38.607 125.927 1.00 0.00 H TER 21645 WAT 7991 ATOM 21645 O WAT 7992 124.583 91.718 113.762 1.00 0.00 O ATOM 21646 H1 WAT 7992 124.584 92.408 114.425 1.00 0.00 H ATOM 21647 H2 WAT 7992 125.394 91.853 113.273 1.00 0.00 H TER 21649 WAT 7992 ATOM 21649 O WAT 7993 44.256 55.112 126.057 1.00 0.00 O ATOM 21650 H1 WAT 7993 44.419 54.264 125.643 1.00 0.00 H ATOM 21651 H2 WAT 7993 44.710 55.058 126.898 1.00 0.00 H TER 21653 WAT 7993 ATOM 21653 O WAT 7994 138.256 47.957 78.411 1.00 0.00 O ATOM 21654 H1 WAT 7994 138.018 47.230 77.835 1.00 0.00 H ATOM 21655 H2 WAT 7994 137.429 48.406 78.585 1.00 0.00 H TER 21657 WAT 7994 ATOM 21657 O WAT 7995 60.019 48.897 146.434 1.00 0.00 O ATOM 21658 H1 WAT 7995 59.749 48.078 146.850 1.00 0.00 H ATOM 21659 H2 WAT 7995 59.199 49.309 146.164 1.00 0.00 H TER 21661 WAT 7995 ATOM 21661 O WAT 7996 80.638 19.136 151.609 1.00 0.00 O ATOM 21662 H1 WAT 7996 80.583 19.871 152.220 1.00 0.00 H ATOM 21663 H2 WAT 7996 80.405 18.370 152.133 1.00 0.00 H TER 21665 WAT 7996 ATOM 21665 O WAT 7997 55.986 140.872 63.682 1.00 0.00 O ATOM 21666 H1 WAT 7997 56.661 140.569 63.074 1.00 0.00 H ATOM 21667 H2 WAT 7997 55.409 140.117 63.795 1.00 0.00 H TER 21669 WAT 7997 ATOM 21669 O WAT 7998 13.553 145.766 121.572 1.00 0.00 O ATOM 21670 H1 WAT 7998 13.474 144.825 121.724 1.00 0.00 H ATOM 21671 H2 WAT 7998 12.907 146.159 122.160 1.00 0.00 H TER 21673 WAT 7998 ATOM 21673 O WAT 7999 132.561 116.454 10.145 1.00 0.00 O ATOM 21674 H1 WAT 7999 132.544 115.936 9.340 1.00 0.00 H ATOM 21675 H2 WAT 7999 133.015 117.261 9.901 1.00 0.00 H TER 21677 WAT 7999 ATOM 21677 O WAT 8000 45.921 134.702 65.615 1.00 0.00 O ATOM 21678 H1 WAT 8000 45.728 134.419 66.509 1.00 0.00 H ATOM 21679 H2 WAT 8000 46.062 133.888 65.131 1.00 0.00 H TER 21681 WAT 8000 ATOM 21681 O WAT 8001 5.938 16.197 131.133 1.00 0.00 O ATOM 21682 H1 WAT 8001 6.692 16.486 130.619 1.00 0.00 H ATOM 21683 H2 WAT 8001 5.184 16.369 130.569 1.00 0.00 H TER 21685 WAT 8001 ATOM 21685 O WAT 8002 119.815 26.508 109.943 1.00 0.00 O ATOM 21686 H1 WAT 8002 119.691 26.193 110.839 1.00 0.00 H ATOM 21687 H2 WAT 8002 120.650 26.975 109.967 1.00 0.00 H TER 21689 WAT 8002 ATOM 21689 O WAT 8003 78.892 47.079 83.869 1.00 0.00 O ATOM 21690 H1 WAT 8003 78.167 47.694 83.984 1.00 0.00 H ATOM 21691 H2 WAT 8003 79.411 47.451 83.156 1.00 0.00 H TER 21693 WAT 8003 ATOM 21693 O WAT 8004 58.010 48.699 154.486 1.00 0.00 O ATOM 21694 H1 WAT 8004 58.778 48.128 154.476 1.00 0.00 H ATOM 21695 H2 WAT 8004 57.291 48.128 154.757 1.00 0.00 H TER 21697 WAT 8004 ATOM 21697 O WAT 8005 41.771 124.300 93.111 1.00 0.00 O ATOM 21698 H1 WAT 8005 41.613 123.703 93.842 1.00 0.00 H ATOM 21699 H2 WAT 8005 42.324 123.802 92.509 1.00 0.00 H TER 21701 WAT 8005 ATOM 21701 O WAT 8006 90.687 110.075 21.497 1.00 0.00 O ATOM 21702 H1 WAT 8006 91.062 110.141 20.619 1.00 0.00 H ATOM 21703 H2 WAT 8006 91.037 109.255 21.846 1.00 0.00 H TER 21705 WAT 8006 ATOM 21705 O WAT 8007 84.211 43.361 151.815 1.00 0.00 O ATOM 21706 H1 WAT 8007 84.624 42.702 151.257 1.00 0.00 H ATOM 21707 H2 WAT 8007 84.468 44.198 151.429 1.00 0.00 H TER 21709 WAT 8007 ATOM 21709 O WAT 8008 56.857 44.759 81.722 1.00 0.00 O ATOM 21710 H1 WAT 8008 57.101 45.531 82.234 1.00 0.00 H ATOM 21711 H2 WAT 8008 56.065 44.430 82.148 1.00 0.00 H TER 21713 WAT 8008 ATOM 21713 O WAT 8009 92.760 64.934 106.931 1.00 0.00 O ATOM 21714 H1 WAT 8009 92.734 65.614 106.258 1.00 0.00 H ATOM 21715 H2 WAT 8009 92.064 65.174 107.542 1.00 0.00 H TER 21717 WAT 8009 ATOM 21717 O WAT 8010 45.281 144.667 2.870 1.00 0.00 O ATOM 21718 H1 WAT 8010 45.349 145.575 3.167 1.00 0.00 H ATOM 21719 H2 WAT 8010 44.464 144.638 2.372 1.00 0.00 H TER 21721 WAT 8010 ATOM 21721 O WAT 8011 106.038 33.158 124.009 1.00 0.00 O ATOM 21722 H1 WAT 8011 105.304 33.087 124.619 1.00 0.00 H ATOM 21723 H2 WAT 8011 106.022 34.070 123.720 1.00 0.00 H TER 21725 WAT 8011 ATOM 21725 O WAT 8012 32.114 95.661 16.151 1.00 0.00 O ATOM 21726 H1 WAT 8012 31.892 96.591 16.182 1.00 0.00 H ATOM 21727 H2 WAT 8012 32.337 95.498 15.234 1.00 0.00 H TER 21729 WAT 8012 ATOM 21729 O WAT 8013 71.735 19.128 69.538 1.00 0.00 O ATOM 21730 H1 WAT 8013 72.607 19.523 69.555 1.00 0.00 H ATOM 21731 H2 WAT 8013 71.881 18.238 69.217 1.00 0.00 H TER 21733 WAT 8013 ATOM 21733 O WAT 8014 72.521 100.105 94.014 1.00 0.00 O ATOM 21734 H1 WAT 8014 72.224 99.337 94.502 1.00 0.00 H ATOM 21735 H2 WAT 8014 73.429 99.906 93.785 1.00 0.00 H TER 21737 WAT 8014 ATOM 21737 O WAT 8015 105.113 81.951 88.062 1.00 0.00 O ATOM 21738 H1 WAT 8015 105.913 82.056 87.548 1.00 0.00 H ATOM 21739 H2 WAT 8015 104.966 82.811 88.456 1.00 0.00 H TER 21741 WAT 8015 ATOM 21741 O WAT 8016 47.357 103.323 7.765 1.00 0.00 O ATOM 21742 H1 WAT 8016 46.498 102.908 7.685 1.00 0.00 H ATOM 21743 H2 WAT 8016 47.235 104.198 7.398 1.00 0.00 H TER 21745 WAT 8016 ATOM 21745 O WAT 8017 74.179 63.778 69.926 1.00 0.00 O ATOM 21746 H1 WAT 8017 75.001 63.582 70.376 1.00 0.00 H ATOM 21747 H2 WAT 8017 74.221 63.266 69.118 1.00 0.00 H TER 21749 WAT 8017 ATOM 21749 O WAT 8018 37.549 87.158 75.172 1.00 0.00 O ATOM 21750 H1 WAT 8018 36.880 87.121 74.488 1.00 0.00 H ATOM 21751 H2 WAT 8018 37.884 88.054 75.132 1.00 0.00 H TER 21753 WAT 8018 ATOM 21753 O WAT 8019 105.981 133.189 62.877 1.00 0.00 O ATOM 21754 H1 WAT 8019 105.727 133.296 61.961 1.00 0.00 H ATOM 21755 H2 WAT 8019 106.890 132.890 62.840 1.00 0.00 H TER 21757 WAT 8019 ATOM 21757 O WAT 8020 43.766 115.834 62.520 1.00 0.00 O ATOM 21758 H1 WAT 8020 42.999 116.137 62.034 1.00 0.00 H ATOM 21759 H2 WAT 8020 43.406 115.430 63.309 1.00 0.00 H TER 21761 WAT 8020 ATOM 21761 O WAT 8021 109.338 142.016 119.418 1.00 0.00 O ATOM 21762 H1 WAT 8021 110.128 142.446 119.745 1.00 0.00 H ATOM 21763 H2 WAT 8021 109.423 141.107 119.705 1.00 0.00 H TER 21765 WAT 8021 ATOM 21765 O WAT 8022 67.686 61.127 106.106 1.00 0.00 O ATOM 21766 H1 WAT 8022 68.613 61.113 105.867 1.00 0.00 H ATOM 21767 H2 WAT 8022 67.583 61.929 106.619 1.00 0.00 H TER 21769 WAT 8022 ATOM 21769 O WAT 8023 22.481 7.177 125.136 1.00 0.00 O ATOM 21770 H1 WAT 8023 21.575 7.117 124.833 1.00 0.00 H ATOM 21771 H2 WAT 8023 23.006 7.079 124.343 1.00 0.00 H TER 21773 WAT 8023 ATOM 21773 O WAT 8024 68.542 98.852 135.064 1.00 0.00 O ATOM 21774 H1 WAT 8024 68.543 99.656 134.544 1.00 0.00 H ATOM 21775 H2 WAT 8024 67.929 98.274 134.609 1.00 0.00 H TER 21777 WAT 8024 ATOM 21777 O WAT 8025 97.371 13.713 154.129 1.00 0.00 O ATOM 21778 H1 WAT 8025 97.041 13.734 155.028 1.00 0.00 H ATOM 21779 H2 WAT 8025 98.209 13.254 154.192 1.00 0.00 H TER 21781 WAT 8025 ATOM 21781 O WAT 8026 135.271 109.914 158.520 1.00 0.00 O ATOM 21782 H1 WAT 8026 135.561 109.051 158.226 1.00 0.00 H ATOM 21783 H2 WAT 8026 134.448 110.061 158.054 1.00 0.00 H TER 21785 WAT 8026 ATOM 21785 O WAT 8027 47.412 85.380 0.264 1.00 0.00 O ATOM 21786 H1 WAT 8027 47.934 86.021 0.747 1.00 0.00 H ATOM 21787 H2 WAT 8027 47.998 84.631 0.152 1.00 0.00 H TER 21789 WAT 8027 ATOM 21789 O WAT 8028 90.438 26.642 90.610 1.00 0.00 O ATOM 21790 H1 WAT 8028 90.719 25.851 91.070 1.00 0.00 H ATOM 21791 H2 WAT 8028 91.109 27.292 90.819 1.00 0.00 H TER 21793 WAT 8028 ATOM 21793 O WAT 8029 141.565 79.204 111.301 1.00 0.00 O ATOM 21794 H1 WAT 8029 142.075 78.551 111.780 1.00 0.00 H ATOM 21795 H2 WAT 8029 141.480 78.841 110.419 1.00 0.00 H TER 21797 WAT 8029 ATOM 21797 O WAT 8030 118.808 88.987 82.935 1.00 0.00 O ATOM 21798 H1 WAT 8030 118.883 89.515 83.731 1.00 0.00 H ATOM 21799 H2 WAT 8030 117.872 88.989 82.735 1.00 0.00 H TER 21801 WAT 8030 ATOM 21801 O WAT 8031 22.310 64.507 108.706 1.00 0.00 O ATOM 21802 H1 WAT 8031 21.967 63.626 108.553 1.00 0.00 H ATOM 21803 H2 WAT 8031 22.258 64.623 109.655 1.00 0.00 H TER 21805 WAT 8031 ATOM 21805 O WAT 8032 86.421 125.030 130.541 1.00 0.00 O ATOM 21806 H1 WAT 8032 85.763 124.976 131.234 1.00 0.00 H ATOM 21807 H2 WAT 8032 86.157 125.787 130.018 1.00 0.00 H TER 21809 WAT 8032 ATOM 21809 O WAT 8033 71.613 136.417 7.906 1.00 0.00 O ATOM 21810 H1 WAT 8033 72.371 135.873 7.689 1.00 0.00 H ATOM 21811 H2 WAT 8033 71.889 137.308 7.690 1.00 0.00 H TER 21813 WAT 8033 ATOM 21813 O WAT 8034 63.160 17.179 51.368 1.00 0.00 O ATOM 21814 H1 WAT 8034 63.028 17.910 50.766 1.00 0.00 H ATOM 21815 H2 WAT 8034 62.318 17.081 51.813 1.00 0.00 H TER 21817 WAT 8034 ATOM 21817 O WAT 8035 10.708 46.001 125.408 1.00 0.00 O ATOM 21818 H1 WAT 8035 10.138 46.769 125.439 1.00 0.00 H ATOM 21819 H2 WAT 8035 11.170 46.078 124.573 1.00 0.00 H TER 21821 WAT 8035 ATOM 21821 O WAT 8036 83.609 97.375 69.616 1.00 0.00 O ATOM 21822 H1 WAT 8036 84.037 97.904 68.944 1.00 0.00 H ATOM 21823 H2 WAT 8036 83.728 97.873 70.425 1.00 0.00 H TER 21825 WAT 8036 ATOM 21825 O WAT 8037 112.570 127.372 16.077 1.00 0.00 O ATOM 21826 H1 WAT 8037 112.617 128.087 16.711 1.00 0.00 H ATOM 21827 H2 WAT 8037 111.632 127.212 15.965 1.00 0.00 H TER 21829 WAT 8037 ATOM 21829 O WAT 8038 137.612 41.651 15.382 1.00 0.00 O ATOM 21830 H1 WAT 8038 137.184 41.018 15.959 1.00 0.00 H ATOM 21831 H2 WAT 8038 137.850 42.378 15.959 1.00 0.00 H TER 21833 WAT 8038 ATOM 21833 O WAT 8039 129.780 57.977 135.604 1.00 0.00 O ATOM 21834 H1 WAT 8039 130.451 58.000 136.286 1.00 0.00 H ATOM 21835 H2 WAT 8039 129.620 57.044 135.457 1.00 0.00 H TER 21837 WAT 8039 ATOM 21837 O WAT 8040 92.314 32.931 65.884 1.00 0.00 O ATOM 21838 H1 WAT 8040 92.995 32.738 66.529 1.00 0.00 H ATOM 21839 H2 WAT 8040 92.726 33.547 65.278 1.00 0.00 H TER 21841 WAT 8040 ATOM 21841 O WAT 8041 3.836 59.647 106.738 1.00 0.00 O ATOM 21842 H1 WAT 8041 3.981 59.420 107.656 1.00 0.00 H ATOM 21843 H2 WAT 8041 2.951 60.011 106.719 1.00 0.00 H TER 21845 WAT 8041 ATOM 21845 O WAT 8042 41.188 121.788 56.350 1.00 0.00 O ATOM 21846 H1 WAT 8042 42.081 121.657 56.030 1.00 0.00 H ATOM 21847 H2 WAT 8042 40.800 122.406 55.730 1.00 0.00 H TER 21849 WAT 8042 ATOM 21849 O WAT 8043 106.551 5.175 89.669 1.00 0.00 O ATOM 21850 H1 WAT 8043 107.146 5.597 90.289 1.00 0.00 H ATOM 21851 H2 WAT 8043 107.077 4.487 89.262 1.00 0.00 H TER 21853 WAT 8043 ATOM 21853 O WAT 8044 6.480 145.083 127.175 1.00 0.00 O ATOM 21854 H1 WAT 8044 7.261 145.215 126.637 1.00 0.00 H ATOM 21855 H2 WAT 8044 6.814 145.020 128.070 1.00 0.00 H TER 21857 WAT 8044 ATOM 21857 O WAT 8045 41.007 56.150 135.226 1.00 0.00 O ATOM 21858 H1 WAT 8045 41.874 56.556 135.239 1.00 0.00 H ATOM 21859 H2 WAT 8045 40.398 56.887 135.185 1.00 0.00 H TER 21861 WAT 8045 ATOM 21861 O WAT 8046 119.765 89.396 124.728 1.00 0.00 O ATOM 21862 H1 WAT 8046 119.559 89.476 123.797 1.00 0.00 H ATOM 21863 H2 WAT 8046 119.754 90.296 125.054 1.00 0.00 H TER 21865 WAT 8046 ATOM 21865 O WAT 8047 38.251 95.371 126.553 1.00 0.00 O ATOM 21866 H1 WAT 8047 37.939 95.679 127.404 1.00 0.00 H ATOM 21867 H2 WAT 8047 37.661 95.780 125.920 1.00 0.00 H TER 21869 WAT 8047 ATOM 21869 O WAT 8048 33.595 139.228 82.715 1.00 0.00 O ATOM 21870 H1 WAT 8048 33.049 139.838 83.212 1.00 0.00 H ATOM 21871 H2 WAT 8048 33.101 139.063 81.913 1.00 0.00 H TER 21873 WAT 8048 ATOM 21873 O WAT 8049 34.990 31.998 0.519 1.00 0.00 O ATOM 21874 H1 WAT 8049 34.382 31.642 1.167 1.00 0.00 H ATOM 21875 H2 WAT 8049 35.856 31.747 0.840 1.00 0.00 H TER 21877 WAT 8049 ATOM 21877 O WAT 8050 96.242 76.770 116.279 1.00 0.00 O ATOM 21878 H1 WAT 8050 95.976 76.378 117.110 1.00 0.00 H ATOM 21879 H2 WAT 8050 95.419 76.976 115.836 1.00 0.00 H TER 21881 WAT 8050 ATOM 21881 O WAT 8051 67.580 110.347 65.971 1.00 0.00 O ATOM 21882 H1 WAT 8051 67.314 110.352 65.051 1.00 0.00 H ATOM 21883 H2 WAT 8051 67.703 111.270 66.190 1.00 0.00 H TER 21885 WAT 8051 ATOM 21885 O WAT 8052 79.942 65.059 81.981 1.00 0.00 O ATOM 21886 H1 WAT 8052 80.153 64.741 81.103 1.00 0.00 H ATOM 21887 H2 WAT 8052 79.755 65.990 81.860 1.00 0.00 H TER 21889 WAT 8052 ATOM 21889 O WAT 8053 97.299 73.308 131.871 1.00 0.00 O ATOM 21890 H1 WAT 8053 98.218 73.287 131.604 1.00 0.00 H ATOM 21891 H2 WAT 8053 96.998 72.406 131.764 1.00 0.00 H TER 21893 WAT 8053 ATOM 21893 O WAT 8054 89.847 2.855 59.426 1.00 0.00 O ATOM 21894 H1 WAT 8054 89.720 3.567 58.799 1.00 0.00 H ATOM 21895 H2 WAT 8054 89.100 2.274 59.282 1.00 0.00 H TER 21897 WAT 8054 ATOM 21897 O WAT 8055 34.525 2.494 115.890 1.00 0.00 O ATOM 21898 H1 WAT 8055 33.909 2.322 116.602 1.00 0.00 H ATOM 21899 H2 WAT 8055 35.352 2.119 116.192 1.00 0.00 H TER 21901 WAT 8055 ATOM 21901 O WAT 8056 1.888 17.802 109.270 1.00 0.00 O ATOM 21902 H1 WAT 8056 2.755 17.468 109.500 1.00 0.00 H ATOM 21903 H2 WAT 8056 1.792 18.598 109.792 1.00 0.00 H TER 21905 WAT 8056 ATOM 21905 O WAT 8057 8.092 93.069 136.729 1.00 0.00 O ATOM 21906 H1 WAT 8057 7.159 93.156 136.926 1.00 0.00 H ATOM 21907 H2 WAT 8057 8.211 93.561 135.917 1.00 0.00 H TER 21909 WAT 8057 ATOM 21909 O WAT 8058 124.316 7.182 128.719 1.00 0.00 O ATOM 21910 H1 WAT 8058 124.023 6.649 127.980 1.00 0.00 H ATOM 21911 H2 WAT 8058 123.786 7.978 128.666 1.00 0.00 H TER 21913 WAT 8058 ATOM 21913 O WAT 8059 68.158 42.139 93.994 1.00 0.00 O ATOM 21914 H1 WAT 8059 68.811 41.486 94.248 1.00 0.00 H ATOM 21915 H2 WAT 8059 67.348 41.639 93.890 1.00 0.00 H TER 21917 WAT 8059 ATOM 21917 O WAT 8060 52.838 71.579 96.991 1.00 0.00 O ATOM 21918 H1 WAT 8060 52.923 72.156 97.750 1.00 0.00 H ATOM 21919 H2 WAT 8060 53.643 71.717 96.493 1.00 0.00 H TER 21921 WAT 8060 ATOM 21921 O WAT 8061 15.124 128.743 141.578 1.00 0.00 O ATOM 21922 H1 WAT 8061 15.434 129.125 142.399 1.00 0.00 H ATOM 21923 H2 WAT 8061 15.920 128.599 141.065 1.00 0.00 H TER 21925 WAT 8061 ATOM 21925 O WAT 8062 93.221 48.019 104.699 1.00 0.00 O ATOM 21926 H1 WAT 8062 93.269 48.969 104.798 1.00 0.00 H ATOM 21927 H2 WAT 8062 92.346 47.860 104.344 1.00 0.00 H TER 21929 WAT 8062 ATOM 21929 O WAT 8063 72.945 82.621 122.698 1.00 0.00 O ATOM 21930 H1 WAT 8063 73.538 82.909 123.391 1.00 0.00 H ATOM 21931 H2 WAT 8063 73.470 82.023 122.166 1.00 0.00 H TER 21933 WAT 8063 ATOM 21933 O WAT 8064 4.644 75.685 90.297 1.00 0.00 O ATOM 21934 H1 WAT 8064 4.816 75.250 91.132 1.00 0.00 H ATOM 21935 H2 WAT 8064 5.245 76.430 90.287 1.00 0.00 H TER 21937 WAT 8064 ATOM 21937 O WAT 8065 33.190 98.234 72.384 1.00 0.00 O ATOM 21938 H1 WAT 8065 32.990 97.300 72.327 1.00 0.00 H ATOM 21939 H2 WAT 8065 32.342 98.668 72.287 1.00 0.00 H TER 21941 WAT 8065 ATOM 21941 O WAT 8066 132.048 120.292 20.750 1.00 0.00 O ATOM 21942 H1 WAT 8066 132.014 119.344 20.880 1.00 0.00 H ATOM 21943 H2 WAT 8066 132.102 120.653 21.635 1.00 0.00 H TER 21945 WAT 8066 ATOM 21945 O WAT 8067 105.330 100.811 22.456 1.00 0.00 O ATOM 21946 H1 WAT 8067 105.759 101.565 22.860 1.00 0.00 H ATOM 21947 H2 WAT 8067 104.896 100.364 23.182 1.00 0.00 H TER 21949 WAT 8067 ATOM 21949 O WAT 8068 47.921 80.554 81.343 1.00 0.00 O ATOM 21950 H1 WAT 8068 48.774 80.329 80.971 1.00 0.00 H ATOM 21951 H2 WAT 8068 47.287 80.160 80.743 1.00 0.00 H TER 21953 WAT 8068 ATOM 21953 O WAT 8069 97.889 72.830 153.290 1.00 0.00 O ATOM 21954 H1 WAT 8069 98.221 71.936 153.211 1.00 0.00 H ATOM 21955 H2 WAT 8069 98.077 73.076 154.195 1.00 0.00 H TER 21957 WAT 8069 ATOM 21957 O WAT 8070 135.761 47.287 149.769 1.00 0.00 O ATOM 21958 H1 WAT 8070 134.983 46.907 149.362 1.00 0.00 H ATOM 21959 H2 WAT 8070 136.359 46.547 149.878 1.00 0.00 H TER 21961 WAT 8070 ATOM 21961 O WAT 8071 100.581 66.373 156.957 1.00 0.00 O ATOM 21962 H1 WAT 8071 101.326 66.972 156.901 1.00 0.00 H ATOM 21963 H2 WAT 8071 100.349 66.195 156.045 1.00 0.00 H TER 21965 WAT 8071 ATOM 21965 O WAT 8072 93.421 131.194 8.665 1.00 0.00 O ATOM 21966 H1 WAT 8072 93.630 132.084 8.949 1.00 0.00 H ATOM 21967 H2 WAT 8072 92.469 131.135 8.745 1.00 0.00 H TER 21969 WAT 8072 ATOM 21969 O WAT 8073 59.376 9.876 87.425 1.00 0.00 O ATOM 21970 H1 WAT 8073 59.850 9.249 87.971 1.00 0.00 H ATOM 21971 H2 WAT 8073 58.613 9.391 87.111 1.00 0.00 H TER 21973 WAT 8073 ATOM 21973 O WAT 8074 140.638 38.545 60.629 1.00 0.00 O ATOM 21974 H1 WAT 8074 141.316 38.879 60.042 1.00 0.00 H ATOM 21975 H2 WAT 8074 139.965 39.226 60.629 1.00 0.00 H TER 21977 WAT 8074 ATOM 21977 O WAT 8075 81.499 108.253 75.469 1.00 0.00 O ATOM 21978 H1 WAT 8075 81.045 108.514 76.270 1.00 0.00 H ATOM 21979 H2 WAT 8075 80.838 108.333 74.782 1.00 0.00 H TER 21981 WAT 8075 ATOM 21981 O WAT 8076 96.842 75.935 93.177 1.00 0.00 O ATOM 21982 H1 WAT 8076 96.580 76.755 93.596 1.00 0.00 H ATOM 21983 H2 WAT 8076 97.379 76.206 92.433 1.00 0.00 H TER 21985 WAT 8076 ATOM 21985 O WAT 8077 3.559 67.855 57.094 1.00 0.00 O ATOM 21986 H1 WAT 8077 4.038 67.407 56.397 1.00 0.00 H ATOM 21987 H2 WAT 8077 3.381 68.726 56.741 1.00 0.00 H TER 21989 WAT 8077 ATOM 21989 O WAT 8078 60.310 40.789 101.655 1.00 0.00 O ATOM 21990 H1 WAT 8078 60.771 41.619 101.530 1.00 0.00 H ATOM 21991 H2 WAT 8078 60.240 40.695 102.605 1.00 0.00 H TER 21993 WAT 8078 ATOM 21993 O WAT 8079 96.395 138.544 131.624 1.00 0.00 O ATOM 21994 H1 WAT 8079 96.022 137.791 131.166 1.00 0.00 H ATOM 21995 H2 WAT 8079 96.833 139.048 130.939 1.00 0.00 H TER 21997 WAT 8079 ATOM 21997 O WAT 8080 22.435 122.286 152.362 1.00 0.00 O ATOM 21998 H1 WAT 8080 23.019 122.952 152.724 1.00 0.00 H ATOM 21999 H2 WAT 8080 22.350 122.518 151.438 1.00 0.00 H TER 22001 WAT 8080 ATOM 22001 O WAT 8081 134.403 32.682 109.073 1.00 0.00 O ATOM 22002 H1 WAT 8081 134.705 31.776 109.137 1.00 0.00 H ATOM 22003 H2 WAT 8081 133.671 32.647 108.457 1.00 0.00 H TER 22005 WAT 8081 ATOM 22005 O WAT 8082 73.763 79.666 146.892 1.00 0.00 O ATOM 22006 H1 WAT 8082 72.815 79.682 147.021 1.00 0.00 H ATOM 22007 H2 WAT 8082 73.956 80.483 146.432 1.00 0.00 H TER 22009 WAT 8082 ATOM 22009 O WAT 8083 34.928 129.539 84.193 1.00 0.00 O ATOM 22010 H1 WAT 8083 34.180 130.114 84.031 1.00 0.00 H ATOM 22011 H2 WAT 8083 34.740 129.136 85.041 1.00 0.00 H TER 22013 WAT 8083 ATOM 22013 O WAT 8084 32.785 28.149 82.398 1.00 0.00 O ATOM 22014 H1 WAT 8084 33.460 28.632 81.920 1.00 0.00 H ATOM 22015 H2 WAT 8084 32.199 28.827 82.736 1.00 0.00 H TER 22017 WAT 8084 ATOM 22017 O WAT 8085 25.529 57.183 86.958 1.00 0.00 O ATOM 22018 H1 WAT 8085 24.883 56.563 86.623 1.00 0.00 H ATOM 22019 H2 WAT 8085 26.277 57.093 86.368 1.00 0.00 H TER 22021 WAT 8085 ATOM 22021 O WAT 8086 36.186 58.760 145.979 1.00 0.00 O ATOM 22022 H1 WAT 8086 36.571 57.895 146.115 1.00 0.00 H ATOM 22023 H2 WAT 8086 36.934 59.357 145.967 1.00 0.00 H TER 22025 WAT 8086 ATOM 22025 O WAT 8087 62.147 81.955 14.840 1.00 0.00 O ATOM 22026 H1 WAT 8087 62.476 82.778 14.476 1.00 0.00 H ATOM 22027 H2 WAT 8087 61.748 81.507 14.094 1.00 0.00 H TER 22029 WAT 8087 ATOM 22029 O WAT 8088 100.737 2.262 113.959 1.00 0.00 O ATOM 22030 H1 WAT 8088 99.819 2.531 113.929 1.00 0.00 H ATOM 22031 H2 WAT 8088 100.713 1.362 114.283 1.00 0.00 H TER 22033 WAT 8088 ATOM 22033 O WAT 8089 78.785 108.955 146.139 1.00 0.00 O ATOM 22034 H1 WAT 8089 78.994 109.813 145.769 1.00 0.00 H ATOM 22035 H2 WAT 8089 79.213 108.952 146.995 1.00 0.00 H TER 22037 WAT 8089 ATOM 22037 O WAT 8090 83.966 18.810 97.350 1.00 0.00 O ATOM 22038 H1 WAT 8090 84.823 18.676 96.945 1.00 0.00 H ATOM 22039 H2 WAT 8090 83.595 17.931 97.423 1.00 0.00 H TER 22041 WAT 8090 ATOM 22041 O WAT 8091 16.135 136.080 102.165 1.00 0.00 O ATOM 22042 H1 WAT 8091 15.231 135.832 102.359 1.00 0.00 H ATOM 22043 H2 WAT 8091 16.462 136.456 102.982 1.00 0.00 H TER 22045 WAT 8091 ATOM 22045 O WAT 8092 24.072 6.571 137.796 1.00 0.00 O ATOM 22046 H1 WAT 8092 24.924 6.598 137.361 1.00 0.00 H ATOM 22047 H2 WAT 8092 24.264 6.778 138.711 1.00 0.00 H TER 22049 WAT 8092 ATOM 22049 O WAT 8093 6.855 121.031 72.121 1.00 0.00 O ATOM 22050 H1 WAT 8093 6.721 120.114 71.883 1.00 0.00 H ATOM 22051 H2 WAT 8093 7.657 121.028 72.644 1.00 0.00 H TER 22053 WAT 8093 ATOM 22053 O WAT 8094 111.242 135.480 97.763 1.00 0.00 O ATOM 22054 H1 WAT 8094 110.582 135.565 98.451 1.00 0.00 H ATOM 22055 H2 WAT 8094 111.987 135.062 98.197 1.00 0.00 H TER 22057 WAT 8094 ATOM 22057 O WAT 8095 65.461 93.061 3.218 1.00 0.00 O ATOM 22058 H1 WAT 8095 66.178 93.602 2.889 1.00 0.00 H ATOM 22059 H2 WAT 8095 65.590 92.211 2.798 1.00 0.00 H TER 22061 WAT 8095 ATOM 22061 O WAT 8096 97.987 100.746 67.979 1.00 0.00 O ATOM 22062 H1 WAT 8096 97.522 100.011 68.380 1.00 0.00 H ATOM 22063 H2 WAT 8096 97.435 101.506 68.162 1.00 0.00 H TER 22065 WAT 8096 ATOM 22065 O WAT 8097 37.741 95.093 90.310 1.00 0.00 O ATOM 22066 H1 WAT 8097 37.133 94.380 90.506 1.00 0.00 H ATOM 22067 H2 WAT 8097 38.608 94.692 90.369 1.00 0.00 H TER 22069 WAT 8097 ATOM 22069 O WAT 8098 137.633 107.902 1.340 1.00 0.00 O ATOM 22070 H1 WAT 8098 137.207 108.485 1.969 1.00 0.00 H ATOM 22071 H2 WAT 8098 137.179 107.066 1.443 1.00 0.00 H TER 22073 WAT 8098 ATOM 22073 O WAT 8099 67.097 89.429 14.587 1.00 0.00 O ATOM 22074 H1 WAT 8099 66.995 88.488 14.730 1.00 0.00 H ATOM 22075 H2 WAT 8099 68.044 89.567 14.568 1.00 0.00 H TER 22077 WAT 8099 ATOM 22077 O WAT 8100 49.361 82.124 78.314 1.00 0.00 O ATOM 22078 H1 WAT 8100 48.834 82.447 77.583 1.00 0.00 H ATOM 22079 H2 WAT 8100 50.265 82.311 78.059 1.00 0.00 H TER 22081 WAT 8100 ATOM 22081 O WAT 8101 31.518 81.022 22.969 1.00 0.00 O ATOM 22082 H1 WAT 8101 30.574 81.153 23.067 1.00 0.00 H ATOM 22083 H2 WAT 8101 31.909 81.804 23.358 1.00 0.00 H TER 22085 WAT 8101 ATOM 22085 O WAT 8102 16.109 47.890 9.261 1.00 0.00 O ATOM 22086 H1 WAT 8102 16.625 48.694 9.205 1.00 0.00 H ATOM 22087 H2 WAT 8102 16.643 47.232 8.817 1.00 0.00 H TER 22089 WAT 8102 ATOM 22089 O WAT 8103 42.929 122.616 152.330 1.00 0.00 O ATOM 22090 H1 WAT 8103 43.241 123.108 151.571 1.00 0.00 H ATOM 22091 H2 WAT 8103 43.460 121.819 152.333 1.00 0.00 H TER 22093 WAT 8103 ATOM 22093 O WAT 8104 119.403 3.998 101.599 1.00 0.00 O ATOM 22094 H1 WAT 8104 120.202 4.379 101.965 1.00 0.00 H ATOM 22095 H2 WAT 8104 118.907 3.701 102.362 1.00 0.00 H TER 22097 WAT 8104 ATOM 22097 O WAT 8105 20.335 88.190 122.279 1.00 0.00 O ATOM 22098 H1 WAT 8105 20.529 89.126 122.238 1.00 0.00 H ATOM 22099 H2 WAT 8105 20.218 88.010 123.211 1.00 0.00 H TER 22101 WAT 8105 ATOM 22101 O WAT 8106 82.485 127.864 83.624 1.00 0.00 O ATOM 22102 H1 WAT 8106 81.846 127.245 83.976 1.00 0.00 H ATOM 22103 H2 WAT 8106 83.111 127.316 83.150 1.00 0.00 H TER 22105 WAT 8106 ATOM 22105 O WAT 8107 49.204 5.719 152.471 1.00 0.00 O ATOM 22106 H1 WAT 8107 48.674 5.238 151.836 1.00 0.00 H ATOM 22107 H2 WAT 8107 49.630 5.038 152.992 1.00 0.00 H TER 22109 WAT 8107 ATOM 22109 O WAT 8108 142.137 51.876 157.342 1.00 0.00 O ATOM 22110 H1 WAT 8108 142.344 51.123 156.789 1.00 0.00 H ATOM 22111 H2 WAT 8108 142.801 52.528 157.118 1.00 0.00 H TER 22113 WAT 8108 ATOM 22113 O WAT 8109 40.917 59.300 26.826 1.00 0.00 O ATOM 22114 H1 WAT 8109 40.648 60.199 26.634 1.00 0.00 H ATOM 22115 H2 WAT 8109 40.274 58.987 27.461 1.00 0.00 H TER 22117 WAT 8109 ATOM 22117 O WAT 8110 83.252 14.688 144.381 1.00 0.00 O ATOM 22118 H1 WAT 8110 83.493 15.391 144.984 1.00 0.00 H ATOM 22119 H2 WAT 8110 83.965 14.054 144.454 1.00 0.00 H TER 22121 WAT 8110 ATOM 22121 O WAT 8111 130.591 73.675 141.211 1.00 0.00 O ATOM 22122 H1 WAT 8111 130.775 73.533 142.139 1.00 0.00 H ATOM 22123 H2 WAT 8111 131.063 74.479 140.994 1.00 0.00 H TER 22125 WAT 8111 ATOM 22125 O WAT 8112 46.254 72.725 113.645 1.00 0.00 O ATOM 22126 H1 WAT 8112 46.824 72.610 114.405 1.00 0.00 H ATOM 22127 H2 WAT 8112 45.447 72.266 113.880 1.00 0.00 H TER 22129 WAT 8112 ATOM 22129 O WAT 8113 123.104 1.472 120.147 1.00 0.00 O ATOM 22130 H1 WAT 8113 123.170 1.942 119.316 1.00 0.00 H ATOM 22131 H2 WAT 8113 122.355 1.870 120.589 1.00 0.00 H TER 22133 WAT 8113 ATOM 22133 O WAT 8114 22.399 139.661 21.510 1.00 0.00 O ATOM 22134 H1 WAT 8114 21.535 139.332 21.758 1.00 0.00 H ATOM 22135 H2 WAT 8114 23.015 139.073 21.948 1.00 0.00 H TER 22137 WAT 8114 ATOM 22137 O WAT 8115 98.733 75.750 75.005 1.00 0.00 O ATOM 22138 H1 WAT 8115 98.102 76.134 74.397 1.00 0.00 H ATOM 22139 H2 WAT 8115 99.365 76.450 75.168 1.00 0.00 H TER 22141 WAT 8115 ATOM 22141 O WAT 8116 60.770 50.967 56.645 1.00 0.00 O ATOM 22142 H1 WAT 8116 59.838 51.069 56.452 1.00 0.00 H ATOM 22143 H2 WAT 8116 61.214 51.400 55.916 1.00 0.00 H TER 22145 WAT 8116 ATOM 22145 O WAT 8117 137.501 92.048 63.797 1.00 0.00 O ATOM 22146 H1 WAT 8117 137.541 92.303 62.875 1.00 0.00 H ATOM 22147 H2 WAT 8117 137.053 91.203 63.792 1.00 0.00 H TER 22149 WAT 8117 ATOM 22149 O WAT 8118 50.179 125.713 91.378 1.00 0.00 O ATOM 22150 H1 WAT 8118 50.613 124.919 91.691 1.00 0.00 H ATOM 22151 H2 WAT 8118 49.886 125.493 90.493 1.00 0.00 H TER 22153 WAT 8118 ATOM 22153 O WAT 8119 86.406 17.564 65.030 1.00 0.00 O ATOM 22154 H1 WAT 8119 85.648 17.437 64.459 1.00 0.00 H ATOM 22155 H2 WAT 8119 86.989 18.136 64.530 1.00 0.00 H TER 22157 WAT 8119 ATOM 22157 O WAT 8120 33.251 45.949 0.737 1.00 0.00 O ATOM 22158 H1 WAT 8120 33.202 45.035 0.459 1.00 0.00 H ATOM 22159 H2 WAT 8120 33.910 45.954 1.431 1.00 0.00 H TER 22161 WAT 8120 ATOM 22161 O WAT 8121 91.161 139.421 106.280 1.00 0.00 O ATOM 22162 H1 WAT 8121 91.531 139.041 107.077 1.00 0.00 H ATOM 22163 H2 WAT 8121 90.576 140.111 106.593 1.00 0.00 H TER 22165 WAT 8121 ATOM 22165 O WAT 8122 31.473 111.073 61.020 1.00 0.00 O ATOM 22166 H1 WAT 8122 31.923 110.730 61.793 1.00 0.00 H ATOM 22167 H2 WAT 8122 32.164 111.174 60.366 1.00 0.00 H TER 22169 WAT 8122 ATOM 22169 O WAT 8123 81.150 25.375 3.641 1.00 0.00 O ATOM 22170 H1 WAT 8123 81.704 25.455 4.418 1.00 0.00 H ATOM 22171 H2 WAT 8123 80.398 24.862 3.936 1.00 0.00 H TER 22173 WAT 8123 ATOM 22173 O WAT 8124 73.668 109.811 61.025 1.00 0.00 O ATOM 22174 H1 WAT 8124 73.896 110.090 60.139 1.00 0.00 H ATOM 22175 H2 WAT 8124 72.802 109.414 60.936 1.00 0.00 H TER 22177 WAT 8124 ATOM 22177 O WAT 8125 35.036 41.182 4.447 1.00 0.00 O ATOM 22178 H1 WAT 8125 35.824 40.683 4.662 1.00 0.00 H ATOM 22179 H2 WAT 8125 34.570 41.264 5.279 1.00 0.00 H TER 22181 WAT 8125 ATOM 22181 O WAT 8126 135.787 113.792 83.710 1.00 0.00 O ATOM 22182 H1 WAT 8126 135.564 114.664 84.037 1.00 0.00 H ATOM 22183 H2 WAT 8126 135.681 113.858 82.761 1.00 0.00 H TER 22185 WAT 8126 ATOM 22185 O WAT 8127 78.132 0.105 66.041 1.00 0.00 O ATOM 22186 H1 WAT 8127 77.579 0.754 66.478 1.00 0.00 H ATOM 22187 H2 WAT 8127 78.469 0.559 65.269 1.00 0.00 H TER 22189 WAT 8127 ATOM 22189 O WAT 8128 94.303 66.494 111.773 1.00 0.00 O ATOM 22190 H1 WAT 8128 94.447 65.892 112.503 1.00 0.00 H ATOM 22191 H2 WAT 8128 94.532 65.986 110.995 1.00 0.00 H TER 22193 WAT 8128 ATOM 22193 O WAT 8129 20.293 82.129 68.578 1.00 0.00 O ATOM 22194 H1 WAT 8129 20.172 81.188 68.703 1.00 0.00 H ATOM 22195 H2 WAT 8129 20.888 82.197 67.832 1.00 0.00 H TER 22197 WAT 8129 ATOM 22197 O WAT 8130 136.884 137.115 139.959 1.00 0.00 O ATOM 22198 H1 WAT 8130 137.376 137.126 139.137 1.00 0.00 H ATOM 22199 H2 WAT 8130 136.977 136.218 140.282 1.00 0.00 H TER 22201 WAT 8130 ATOM 22201 O WAT 8131 132.687 36.574 79.280 1.00 0.00 O ATOM 22202 H1 WAT 8131 132.885 36.272 78.393 1.00 0.00 H ATOM 22203 H2 WAT 8131 133.088 37.441 79.332 1.00 0.00 H TER 22205 WAT 8131 ATOM 22205 O WAT 8132 2.067 17.086 149.692 1.00 0.00 O ATOM 22206 H1 WAT 8132 1.350 17.089 149.057 1.00 0.00 H ATOM 22207 H2 WAT 8132 2.591 16.320 149.459 1.00 0.00 H TER 22209 WAT 8132 ATOM 22209 O WAT 8133 42.168 107.686 84.458 1.00 0.00 O ATOM 22210 H1 WAT 8133 42.315 108.564 84.106 1.00 0.00 H ATOM 22211 H2 WAT 8133 42.310 107.102 83.713 1.00 0.00 H TER 22213 WAT 8133 ATOM 22213 O WAT 8134 124.354 20.419 131.493 1.00 0.00 O ATOM 22214 H1 WAT 8134 123.984 21.100 130.931 1.00 0.00 H ATOM 22215 H2 WAT 8134 123.619 20.130 132.034 1.00 0.00 H TER 22217 WAT 8134 ATOM 22217 O WAT 8135 88.539 97.190 22.593 1.00 0.00 O ATOM 22218 H1 WAT 8135 88.283 96.696 23.372 1.00 0.00 H ATOM 22219 H2 WAT 8135 89.421 97.506 22.789 1.00 0.00 H TER 22221 WAT 8135 ATOM 22221 O WAT 8136 98.617 87.522 110.373 1.00 0.00 O ATOM 22222 H1 WAT 8136 98.875 86.818 110.968 1.00 0.00 H ATOM 22223 H2 WAT 8136 98.544 87.099 109.518 1.00 0.00 H TER 22225 WAT 8136 ATOM 22225 O WAT 8137 108.789 104.890 95.134 1.00 0.00 O ATOM 22226 H1 WAT 8137 109.641 104.502 94.932 1.00 0.00 H ATOM 22227 H2 WAT 8137 108.848 105.784 94.797 1.00 0.00 H TER 22229 WAT 8137 ATOM 22229 O WAT 8138 119.439 95.429 134.130 1.00 0.00 O ATOM 22230 H1 WAT 8138 120.039 95.990 133.638 1.00 0.00 H ATOM 22231 H2 WAT 8138 118.692 95.304 133.544 1.00 0.00 H TER 22233 WAT 8138 ATOM 22233 O WAT 8139 118.107 97.604 144.010 1.00 0.00 O ATOM 22234 H1 WAT 8139 117.957 96.868 144.604 1.00 0.00 H ATOM 22235 H2 WAT 8139 118.401 98.316 144.579 1.00 0.00 H TER 22237 WAT 8139 ATOM 22237 O WAT 8140 4.491 57.939 96.607 1.00 0.00 O ATOM 22238 H1 WAT 8140 3.855 58.036 97.316 1.00 0.00 H ATOM 22239 H2 WAT 8140 5.176 58.575 96.811 1.00 0.00 H TER 22241 WAT 8140 ATOM 22241 O WAT 8141 84.276 136.175 124.607 1.00 0.00 O ATOM 22242 H1 WAT 8141 84.342 136.445 125.523 1.00 0.00 H ATOM 22243 H2 WAT 8141 85.100 135.721 124.431 1.00 0.00 H TER 22245 WAT 8141 ATOM 22245 O WAT 8142 21.445 24.239 60.604 1.00 0.00 O ATOM 22246 H1 WAT 8142 21.050 23.567 61.161 1.00 0.00 H ATOM 22247 H2 WAT 8142 21.717 24.925 61.213 1.00 0.00 H TER 22249 WAT 8142 ATOM 22249 O WAT 8143 34.168 8.310 116.603 1.00 0.00 O ATOM 22250 H1 WAT 8143 34.500 7.981 117.438 1.00 0.00 H ATOM 22251 H2 WAT 8143 34.949 8.596 116.130 1.00 0.00 H TER 22253 WAT 8143 ATOM 22253 O WAT 8144 67.198 131.461 72.068 1.00 0.00 O ATOM 22254 H1 WAT 8144 66.287 131.637 72.300 1.00 0.00 H ATOM 22255 H2 WAT 8144 67.466 132.222 71.553 1.00 0.00 H TER 22257 WAT 8144 ATOM 22257 O WAT 8145 144.135 59.217 86.353 1.00 0.00 O ATOM 22258 H1 WAT 8145 144.354 58.833 85.505 1.00 0.00 H ATOM 22259 H2 WAT 8145 144.330 60.149 86.252 1.00 0.00 H TER 22261 WAT 8145 ATOM 22261 O WAT 8146 26.785 109.393 142.735 1.00 0.00 O ATOM 22262 H1 WAT 8146 26.309 109.843 142.037 1.00 0.00 H ATOM 22263 H2 WAT 8146 26.409 108.513 142.753 1.00 0.00 H TER 22265 WAT 8146 ATOM 22265 O WAT 8147 69.917 44.904 66.604 1.00 0.00 O ATOM 22266 H1 WAT 8147 70.763 44.455 66.626 1.00 0.00 H ATOM 22267 H2 WAT 8147 69.733 45.020 65.672 1.00 0.00 H TER 22269 WAT 8147 ATOM 22269 O WAT 8148 80.274 20.362 148.933 1.00 0.00 O ATOM 22270 H1 WAT 8148 80.387 21.302 149.076 1.00 0.00 H ATOM 22271 H2 WAT 8148 80.592 19.957 149.740 1.00 0.00 H TER 22273 WAT 8148 ATOM 22273 O WAT 8149 96.107 85.379 68.093 1.00 0.00 O ATOM 22274 H1 WAT 8149 95.436 84.870 68.548 1.00 0.00 H ATOM 22275 H2 WAT 8149 96.674 85.705 68.792 1.00 0.00 H TER 22277 WAT 8149 ATOM 22277 O WAT 8150 96.772 87.538 0.088 1.00 0.00 O ATOM 22278 H1 WAT 8150 97.477 86.908 -0.058 1.00 0.00 H ATOM 22279 H2 WAT 8150 96.188 87.105 0.711 1.00 0.00 H TER 22281 WAT 8150 ATOM 22281 O WAT 8151 93.392 108.030 120.178 1.00 0.00 O ATOM 22282 H1 WAT 8151 92.676 108.631 119.970 1.00 0.00 H ATOM 22283 H2 WAT 8151 93.074 107.172 119.898 1.00 0.00 H TER 22285 WAT 8151 ATOM 22285 O WAT 8152 94.338 47.400 80.042 1.00 0.00 O ATOM 22286 H1 WAT 8152 94.532 46.463 80.071 1.00 0.00 H ATOM 22287 H2 WAT 8152 93.412 47.446 79.806 1.00 0.00 H TER 22289 WAT 8152 ATOM 22289 O WAT 8153 45.596 71.801 63.924 1.00 0.00 O ATOM 22290 H1 WAT 8153 46.229 72.191 64.526 1.00 0.00 H ATOM 22291 H2 WAT 8153 46.049 71.778 63.081 1.00 0.00 H TER 22293 WAT 8153 ATOM 22293 O WAT 8154 104.505 10.812 134.044 1.00 0.00 O ATOM 22294 H1 WAT 8154 103.562 10.941 133.943 1.00 0.00 H ATOM 22295 H2 WAT 8154 104.654 9.906 133.771 1.00 0.00 H TER 22297 WAT 8154 ATOM 22297 O WAT 8155 31.373 22.728 118.658 1.00 0.00 O ATOM 22298 H1 WAT 8155 31.671 21.821 118.581 1.00 0.00 H ATOM 22299 H2 WAT 8155 32.038 23.153 119.199 1.00 0.00 H TER 22301 WAT 8155 ATOM 22301 O WAT 8156 86.685 68.636 82.314 1.00 0.00 O ATOM 22302 H1 WAT 8156 87.089 69.459 82.588 1.00 0.00 H ATOM 22303 H2 WAT 8156 87.423 68.070 82.086 1.00 0.00 H TER 22305 WAT 8156 ATOM 22305 O WAT 8157 42.561 96.382 102.485 1.00 0.00 O ATOM 22306 H1 WAT 8157 42.235 97.184 102.078 1.00 0.00 H ATOM 22307 H2 WAT 8157 43.469 96.582 102.715 1.00 0.00 H TER 22309 WAT 8157 ATOM 22309 O WAT 8158 10.850 34.671 3.483 1.00 0.00 O ATOM 22310 H1 WAT 8158 10.029 34.929 3.902 1.00 0.00 H ATOM 22311 H2 WAT 8158 11.527 35.134 3.976 1.00 0.00 H TER 22313 WAT 8158 ATOM 22313 O WAT 8159 128.104 49.218 112.715 1.00 0.00 O ATOM 22314 H1 WAT 8159 127.219 49.031 112.403 1.00 0.00 H ATOM 22315 H2 WAT 8159 128.091 48.964 113.638 1.00 0.00 H TER 22317 WAT 8159 ATOM 22317 O WAT 8160 98.589 122.394 66.368 1.00 0.00 O ATOM 22318 H1 WAT 8160 97.808 122.335 65.818 1.00 0.00 H ATOM 22319 H2 WAT 8160 98.352 123.016 67.056 1.00 0.00 H TER 22321 WAT 8160 ATOM 22321 O WAT 8161 74.795 44.145 82.963 1.00 0.00 O ATOM 22322 H1 WAT 8161 74.743 44.805 82.272 1.00 0.00 H ATOM 22323 H2 WAT 8161 74.937 44.648 83.765 1.00 0.00 H TER 22325 WAT 8161 ATOM 22325 O WAT 8162 138.954 69.949 135.243 1.00 0.00 O ATOM 22326 H1 WAT 8162 139.546 69.786 134.509 1.00 0.00 H ATOM 22327 H2 WAT 8162 139.271 69.373 135.939 1.00 0.00 H TER 22329 WAT 8162 ATOM 22329 O WAT 8163 84.792 40.479 66.249 1.00 0.00 O ATOM 22330 H1 WAT 8163 84.124 40.835 66.835 1.00 0.00 H ATOM 22331 H2 WAT 8163 85.225 39.799 66.764 1.00 0.00 H TER 22333 WAT 8163 ATOM 22333 O WAT 8164 96.132 124.391 62.463 1.00 0.00 O ATOM 22334 H1 WAT 8164 97.013 124.724 62.634 1.00 0.00 H ATOM 22335 H2 WAT 8164 95.620 125.169 62.245 1.00 0.00 H TER 22337 WAT 8164 ATOM 22337 O WAT 8165 131.643 5.584 85.907 1.00 0.00 O ATOM 22338 H1 WAT 8165 130.692 5.623 86.005 1.00 0.00 H ATOM 22339 H2 WAT 8165 131.979 6.160 86.594 1.00 0.00 H TER 22341 WAT 8165 ATOM 22341 O WAT 8166 134.198 41.929 144.381 1.00 0.00 O ATOM 22342 H1 WAT 8166 133.992 41.114 143.923 1.00 0.00 H ATOM 22343 H2 WAT 8166 134.337 42.568 143.683 1.00 0.00 H TER 22345 WAT 8166 ATOM 22345 O WAT 8167 32.647 28.185 0.823 1.00 0.00 O ATOM 22346 H1 WAT 8167 33.120 27.937 1.617 1.00 0.00 H ATOM 22347 H2 WAT 8167 32.420 27.353 0.408 1.00 0.00 H TER 22349 WAT 8167 ATOM 22349 O WAT 8168 83.706 43.807 92.794 1.00 0.00 O ATOM 22350 H1 WAT 8168 83.960 44.191 93.633 1.00 0.00 H ATOM 22351 H2 WAT 8168 83.064 44.419 92.435 1.00 0.00 H TER 22353 WAT 8168 ATOM 22353 O WAT 8169 51.643 58.094 62.516 1.00 0.00 O ATOM 22354 H1 WAT 8169 51.003 58.029 63.225 1.00 0.00 H ATOM 22355 H2 WAT 8169 51.180 57.767 61.744 1.00 0.00 H TER 22357 WAT 8169 ATOM 22357 O WAT 8170 26.708 46.095 152.785 1.00 0.00 O ATOM 22358 H1 WAT 8170 26.654 45.176 152.522 1.00 0.00 H ATOM 22359 H2 WAT 8170 27.132 46.074 153.643 1.00 0.00 H TER 22361 WAT 8170 ATOM 22361 O WAT 8171 76.681 42.721 108.779 1.00 0.00 O ATOM 22362 H1 WAT 8171 76.314 42.848 109.655 1.00 0.00 H ATOM 22363 H2 WAT 8171 76.889 43.606 108.477 1.00 0.00 H TER 22365 WAT 8171 ATOM 22365 O WAT 8172 137.110 141.285 148.459 1.00 0.00 O ATOM 22366 H1 WAT 8172 137.146 142.094 148.970 1.00 0.00 H ATOM 22367 H2 WAT 8172 137.377 140.601 149.074 1.00 0.00 H TER 22369 WAT 8172 ATOM 22369 O WAT 8173 118.161 69.284 78.014 1.00 0.00 O ATOM 22370 H1 WAT 8173 118.114 68.943 78.907 1.00 0.00 H ATOM 22371 H2 WAT 8173 117.582 70.047 78.018 1.00 0.00 H TER 22373 WAT 8173 ATOM 22373 O WAT 8174 3.141 83.846 119.386 1.00 0.00 O ATOM 22374 H1 WAT 8174 2.999 83.664 118.457 1.00 0.00 H ATOM 22375 H2 WAT 8174 2.260 83.911 119.754 1.00 0.00 H TER 22377 WAT 8174 ATOM 22377 O WAT 8175 31.407 72.998 88.630 1.00 0.00 O ATOM 22378 H1 WAT 8175 30.605 72.841 89.128 1.00 0.00 H ATOM 22379 H2 WAT 8175 31.230 73.801 88.139 1.00 0.00 H TER 22381 WAT 8175 ATOM 22381 O WAT 8176 128.257 58.367 98.481 1.00 0.00 O ATOM 22382 H1 WAT 8176 128.868 58.018 97.832 1.00 0.00 H ATOM 22383 H2 WAT 8176 128.487 59.294 98.552 1.00 0.00 H TER 22385 WAT 8176 ATOM 22385 O WAT 8177 98.488 84.804 64.576 1.00 0.00 O ATOM 22386 H1 WAT 8177 97.611 84.962 64.926 1.00 0.00 H ATOM 22387 H2 WAT 8177 98.765 83.985 64.987 1.00 0.00 H TER 22389 WAT 8177 ATOM 22389 O WAT 8178 83.453 50.059 155.866 1.00 0.00 O ATOM 22390 H1 WAT 8178 84.240 50.121 155.324 1.00 0.00 H ATOM 22391 H2 WAT 8178 83.010 49.270 155.556 1.00 0.00 H TER 22393 WAT 8178 ATOM 22393 O WAT 8179 68.744 10.782 87.071 1.00 0.00 O ATOM 22394 H1 WAT 8179 69.356 10.741 86.336 1.00 0.00 H ATOM 22395 H2 WAT 8179 68.375 11.664 87.027 1.00 0.00 H TER 22397 WAT 8179 ATOM 22397 O WAT 8180 20.251 11.345 1.659 1.00 0.00 O ATOM 22398 H1 WAT 8180 19.969 10.470 1.396 1.00 0.00 H ATOM 22399 H2 WAT 8180 19.674 11.938 1.178 1.00 0.00 H TER 22401 WAT 8180 ATOM 22401 O WAT 8181 27.635 1.173 19.533 1.00 0.00 O ATOM 22402 H1 WAT 8181 27.782 2.016 19.104 1.00 0.00 H ATOM 22403 H2 WAT 8181 27.898 1.318 20.442 1.00 0.00 H TER 22405 WAT 8181 ATOM 22405 O WAT 8182 23.934 137.872 136.016 1.00 0.00 O ATOM 22406 H1 WAT 8182 23.162 137.785 135.458 1.00 0.00 H ATOM 22407 H2 WAT 8182 24.567 137.255 135.647 1.00 0.00 H TER 22409 WAT 8182 ATOM 22409 O WAT 8183 85.490 0.316 139.567 1.00 0.00 O ATOM 22410 H1 WAT 8183 85.762 1.125 140.000 1.00 0.00 H ATOM 22411 H2 WAT 8183 86.308 -0.087 139.276 1.00 0.00 H TER 22413 WAT 8183 ATOM 22413 O WAT 8184 12.874 37.993 13.727 1.00 0.00 O ATOM 22414 H1 WAT 8184 13.798 38.159 13.917 1.00 0.00 H ATOM 22415 H2 WAT 8184 12.506 38.859 13.552 1.00 0.00 H TER 22417 WAT 8184 ATOM 22417 O WAT 8185 53.997 111.629 102.725 1.00 0.00 O ATOM 22418 H1 WAT 8185 54.524 110.992 103.206 1.00 0.00 H ATOM 22419 H2 WAT 8185 53.303 111.876 103.335 1.00 0.00 H TER 22421 WAT 8185 ATOM 22421 O WAT 8186 42.535 97.773 137.252 1.00 0.00 O ATOM 22422 H1 WAT 8186 42.569 97.212 138.027 1.00 0.00 H ATOM 22423 H2 WAT 8186 41.874 97.366 136.691 1.00 0.00 H TER 22425 WAT 8186 ATOM 22425 O WAT 8187 82.875 32.219 85.509 1.00 0.00 O ATOM 22426 H1 WAT 8187 82.597 32.829 86.192 1.00 0.00 H ATOM 22427 H2 WAT 8187 82.460 32.547 84.711 1.00 0.00 H TER 22429 WAT 8187 ATOM 22429 O WAT 8188 71.434 62.444 106.734 1.00 0.00 O ATOM 22430 H1 WAT 8188 72.169 61.997 106.316 1.00 0.00 H ATOM 22431 H2 WAT 8188 71.829 63.198 107.172 1.00 0.00 H TER 22433 WAT 8188 ATOM 22433 O WAT 8189 85.464 113.862 110.945 1.00 0.00 O ATOM 22434 H1 WAT 8189 85.955 113.504 110.205 1.00 0.00 H ATOM 22435 H2 WAT 8189 84.707 113.283 111.032 1.00 0.00 H TER 22437 WAT 8189 ATOM 22437 O WAT 8190 26.002 102.535 21.630 1.00 0.00 O ATOM 22438 H1 WAT 8190 25.163 102.830 21.276 1.00 0.00 H ATOM 22439 H2 WAT 8190 25.767 102.012 22.396 1.00 0.00 H TER 22441 WAT 8190 ATOM 22441 O WAT 8191 134.699 59.024 103.218 1.00 0.00 O ATOM 22442 H1 WAT 8191 134.740 58.182 103.671 1.00 0.00 H ATOM 22443 H2 WAT 8191 134.369 58.810 102.345 1.00 0.00 H TER 22445 WAT 8191 ATOM 22445 O WAT 8192 48.297 128.691 2.094 1.00 0.00 O ATOM 22446 H1 WAT 8192 49.211 128.495 2.302 1.00 0.00 H ATOM 22447 H2 WAT 8192 47.854 128.691 2.943 1.00 0.00 H TER 22449 WAT 8192 ATOM 22449 O WAT 8193 64.341 39.948 105.219 1.00 0.00 O ATOM 22450 H1 WAT 8193 64.154 39.011 105.148 1.00 0.00 H ATOM 22451 H2 WAT 8193 64.240 40.280 104.328 1.00 0.00 H TER 22453 WAT 8193 ATOM 22453 O WAT 8194 88.970 135.442 115.583 1.00 0.00 O ATOM 22454 H1 WAT 8194 89.422 136.260 115.789 1.00 0.00 H ATOM 22455 H2 WAT 8194 88.267 135.701 114.987 1.00 0.00 H TER 22457 WAT 8194 ATOM 22457 O WAT 8195 113.363 74.758 16.662 1.00 0.00 O ATOM 22458 H1 WAT 8195 113.566 74.122 17.347 1.00 0.00 H ATOM 22459 H2 WAT 8195 113.585 75.605 17.048 1.00 0.00 H TER 22461 WAT 8195 ATOM 22461 O WAT 8196 56.478 119.532 66.137 1.00 0.00 O ATOM 22462 H1 WAT 8196 56.642 118.679 65.734 1.00 0.00 H ATOM 22463 H2 WAT 8196 57.220 119.665 66.726 1.00 0.00 H TER 22465 WAT 8196 ATOM 22465 O WAT 8197 91.412 3.749 121.581 1.00 0.00 O ATOM 22466 H1 WAT 8197 90.511 4.055 121.693 1.00 0.00 H ATOM 22467 H2 WAT 8197 91.898 4.529 121.314 1.00 0.00 H TER 22469 WAT 8197 ATOM 22469 O WAT 8198 20.799 34.646 85.016 1.00 0.00 O ATOM 22470 H1 WAT 8198 21.185 35.028 84.227 1.00 0.00 H ATOM 22471 H2 WAT 8198 21.100 35.211 85.727 1.00 0.00 H TER 22473 WAT 8198 ATOM 22473 O WAT 8199 67.981 80.193 144.771 1.00 0.00 O ATOM 22474 H1 WAT 8199 67.138 80.182 145.224 1.00 0.00 H ATOM 22475 H2 WAT 8199 67.783 79.883 143.888 1.00 0.00 H TER 22477 WAT 8199 ATOM 22477 O WAT 8200 125.931 54.843 123.881 1.00 0.00 O ATOM 22478 H1 WAT 8200 125.345 54.599 124.598 1.00 0.00 H ATOM 22479 H2 WAT 8200 125.597 54.362 123.124 1.00 0.00 H TER 22481 WAT 8200 ATOM 22481 O WAT 8201 84.908 111.175 74.049 1.00 0.00 O ATOM 22482 H1 WAT 8201 85.293 111.877 73.526 1.00 0.00 H ATOM 22483 H2 WAT 8201 84.609 111.607 74.849 1.00 0.00 H TER 22485 WAT 8201 ATOM 22485 O WAT 8202 103.896 100.993 106.134 1.00 0.00 O ATOM 22486 H1 WAT 8202 103.270 100.268 106.136 1.00 0.00 H ATOM 22487 H2 WAT 8202 103.356 101.775 106.025 1.00 0.00 H TER 22489 WAT 8202 ATOM 22489 O WAT 8203 100.237 136.182 69.619 1.00 0.00 O ATOM 22490 H1 WAT 8203 100.811 136.297 68.862 1.00 0.00 H ATOM 22491 H2 WAT 8203 100.484 135.330 69.979 1.00 0.00 H TER 22493 WAT 8203 ATOM 22493 O WAT 8204 141.286 22.857 106.463 1.00 0.00 O ATOM 22494 H1 WAT 8204 141.924 22.734 105.760 1.00 0.00 H ATOM 22495 H2 WAT 8204 141.488 23.721 106.821 1.00 0.00 H TER 22497 WAT 8204 ATOM 22497 O WAT 8205 47.514 128.249 77.342 1.00 0.00 O ATOM 22498 H1 WAT 8205 47.575 127.510 76.737 1.00 0.00 H ATOM 22499 H2 WAT 8205 48.217 128.839 77.071 1.00 0.00 H TER 22501 WAT 8205 ATOM 22501 O WAT 8206 37.993 58.719 16.441 1.00 0.00 O ATOM 22502 H1 WAT 8206 38.811 59.210 16.362 1.00 0.00 H ATOM 22503 H2 WAT 8206 38.057 58.283 17.291 1.00 0.00 H TER 22505 WAT 8206 ATOM 22505 O WAT 8207 99.964 30.941 73.815 1.00 0.00 O ATOM 22506 H1 WAT 8207 100.339 30.958 74.696 1.00 0.00 H ATOM 22507 H2 WAT 8207 99.041 31.159 73.943 1.00 0.00 H TER 22509 WAT 8207 ATOM 22509 O WAT 8208 38.481 107.750 141.487 1.00 0.00 O ATOM 22510 H1 WAT 8208 37.736 108.337 141.616 1.00 0.00 H ATOM 22511 H2 WAT 8208 39.244 108.327 141.488 1.00 0.00 H TER 22513 WAT 8208 ATOM 22513 O WAT 8209 41.097 103.342 86.049 1.00 0.00 O ATOM 22514 H1 WAT 8209 41.788 102.811 85.654 1.00 0.00 H ATOM 22515 H2 WAT 8209 40.633 103.724 85.304 1.00 0.00 H TER 22517 WAT 8209 ATOM 22517 O WAT 8210 109.547 88.633 101.699 1.00 0.00 O ATOM 22518 H1 WAT 8210 110.168 88.407 102.391 1.00 0.00 H ATOM 22519 H2 WAT 8210 109.552 89.590 101.677 1.00 0.00 H TER 22521 WAT 8210 ATOM 22521 O WAT 8211 32.199 51.734 82.510 1.00 0.00 O ATOM 22522 H1 WAT 8211 32.762 52.443 82.200 1.00 0.00 H ATOM 22523 H2 WAT 8211 32.478 50.969 82.007 1.00 0.00 H TER 22525 WAT 8211 ATOM 22525 O WAT 8212 143.363 97.869 0.019 1.00 0.00 O ATOM 22526 H1 WAT 8212 144.053 97.205 0.022 1.00 0.00 H ATOM 22527 H2 WAT 8212 143.622 98.485 0.704 1.00 0.00 H TER 22529 WAT 8212 ATOM 22529 O WAT 8213 3.215 14.854 148.674 1.00 0.00 O ATOM 22530 H1 WAT 8213 4.023 14.344 148.614 1.00 0.00 H ATOM 22531 H2 WAT 8213 2.516 14.202 148.625 1.00 0.00 H TER 22533 WAT 8213 ATOM 22533 O WAT 8214 136.261 9.007 -0.032 1.00 0.00 O ATOM 22534 H1 WAT 8214 136.919 9.700 0.024 1.00 0.00 H ATOM 22535 H2 WAT 8214 136.321 8.552 0.808 1.00 0.00 H TER 22537 WAT 8214 ATOM 22537 O WAT 8215 17.727 129.430 65.115 1.00 0.00 O ATOM 22538 H1 WAT 8215 17.639 130.212 64.569 1.00 0.00 H ATOM 22539 H2 WAT 8215 18.040 129.760 65.957 1.00 0.00 H TER 22541 WAT 8215 ATOM 22541 O WAT 8216 40.361 97.631 135.489 1.00 0.00 O ATOM 22542 H1 WAT 8216 40.435 97.150 134.665 1.00 0.00 H ATOM 22543 H2 WAT 8216 40.575 98.535 135.258 1.00 0.00 H TER 22545 WAT 8216 ATOM 22545 O WAT 8217 2.473 97.429 145.603 1.00 0.00 O ATOM 22546 H1 WAT 8217 2.197 97.967 146.345 1.00 0.00 H ATOM 22547 H2 WAT 8217 3.182 96.887 145.950 1.00 0.00 H TER 22549 WAT 8217 ATOM 22549 O WAT 8218 30.532 26.855 139.466 1.00 0.00 O ATOM 22550 H1 WAT 8218 30.722 27.748 139.755 1.00 0.00 H ATOM 22551 H2 WAT 8218 31.332 26.366 139.655 1.00 0.00 H TER 22553 WAT 8218 ATOM 22553 O WAT 8219 89.993 44.555 129.748 1.00 0.00 O ATOM 22554 H1 WAT 8219 89.253 43.956 129.849 1.00 0.00 H ATOM 22555 H2 WAT 8219 90.306 44.702 130.640 1.00 0.00 H TER 22557 WAT 8219 ATOM 22557 O WAT 8220 106.840 61.875 86.578 1.00 0.00 O ATOM 22558 H1 WAT 8220 106.574 61.031 86.945 1.00 0.00 H ATOM 22559 H2 WAT 8220 106.078 62.441 86.703 1.00 0.00 H TER 22561 WAT 8220 ATOM 22561 O WAT 8221 90.981 62.629 74.530 1.00 0.00 O ATOM 22562 H1 WAT 8221 91.242 62.524 75.445 1.00 0.00 H ATOM 22563 H2 WAT 8221 91.800 62.801 74.066 1.00 0.00 H TER 22565 WAT 8221 ATOM 22565 O WAT 8222 97.571 34.108 112.029 1.00 0.00 O ATOM 22566 H1 WAT 8222 98.041 34.109 112.863 1.00 0.00 H ATOM 22567 H2 WAT 8222 96.656 33.963 112.270 1.00 0.00 H TER 22569 WAT 8222 ATOM 22569 O WAT 8223 16.686 75.575 90.911 1.00 0.00 O ATOM 22570 H1 WAT 8223 16.310 76.295 91.418 1.00 0.00 H ATOM 22571 H2 WAT 8223 16.475 75.786 90.002 1.00 0.00 H TER 22573 WAT 8223 ATOM 22573 O WAT 8224 112.566 72.597 112.525 1.00 0.00 O ATOM 22574 H1 WAT 8224 112.749 72.024 111.781 1.00 0.00 H ATOM 22575 H2 WAT 8224 112.725 73.480 112.192 1.00 0.00 H TER 22577 WAT 8224 ATOM 22577 O WAT 8225 47.137 26.356 67.597 1.00 0.00 O ATOM 22578 H1 WAT 8225 46.492 26.204 68.288 1.00 0.00 H ATOM 22579 H2 WAT 8225 47.982 26.234 68.029 1.00 0.00 H TER 22581 WAT 8225 ATOM 22581 O WAT 8226 61.807 78.734 105.099 1.00 0.00 O ATOM 22582 H1 WAT 8226 62.278 79.286 104.475 1.00 0.00 H ATOM 22583 H2 WAT 8226 60.926 79.105 105.130 1.00 0.00 H TER 22585 WAT 8226 ATOM 22585 O WAT 8227 48.727 71.623 97.052 1.00 0.00 O ATOM 22586 H1 WAT 8227 48.422 72.496 97.302 1.00 0.00 H ATOM 22587 H2 WAT 8227 47.937 71.169 96.759 1.00 0.00 H TER 22589 WAT 8227 ATOM 22589 O WAT 8228 83.557 109.201 4.694 1.00 0.00 O ATOM 22590 H1 WAT 8228 83.270 108.291 4.769 1.00 0.00 H ATOM 22591 H2 WAT 8228 84.438 109.144 4.324 1.00 0.00 H TER 22593 WAT 8228 ATOM 22593 O WAT 8229 121.844 94.083 93.833 1.00 0.00 O ATOM 22594 H1 WAT 8229 121.366 93.514 94.435 1.00 0.00 H ATOM 22595 H2 WAT 8229 121.888 94.927 94.283 1.00 0.00 H TER 22597 WAT 8229 ATOM 22597 O WAT 8230 110.650 10.449 141.983 1.00 0.00 O ATOM 22598 H1 WAT 8230 110.689 10.367 142.936 1.00 0.00 H ATOM 22599 H2 WAT 8230 109.846 10.940 141.818 1.00 0.00 H TER 22601 WAT 8230 ATOM 22601 O WAT 8231 141.246 83.243 72.606 1.00 0.00 O ATOM 22602 H1 WAT 8231 140.583 83.665 73.153 1.00 0.00 H ATOM 22603 H2 WAT 8231 141.449 83.891 71.932 1.00 0.00 H TER 22605 WAT 8231 ATOM 22605 O WAT 8232 46.351 103.550 14.479 1.00 0.00 O ATOM 22606 H1 WAT 8232 46.795 103.412 15.316 1.00 0.00 H ATOM 22607 H2 WAT 8232 46.245 102.670 14.116 1.00 0.00 H TER 22609 WAT 8232 ATOM 22609 O WAT 8233 20.087 34.252 111.961 1.00 0.00 O ATOM 22610 H1 WAT 8233 19.816 33.335 112.004 1.00 0.00 H ATOM 22611 H2 WAT 8233 20.482 34.425 112.816 1.00 0.00 H TER 22613 WAT 8233 ATOM 22613 O WAT 8234 55.453 84.505 98.006 1.00 0.00 O ATOM 22614 H1 WAT 8234 55.415 85.383 97.625 1.00 0.00 H ATOM 22615 H2 WAT 8234 56.039 84.595 98.757 1.00 0.00 H TER 22617 WAT 8234 ATOM 22617 O WAT 8235 81.678 103.898 2.212 1.00 0.00 O ATOM 22618 H1 WAT 8235 82.030 103.536 3.025 1.00 0.00 H ATOM 22619 H2 WAT 8235 81.236 104.703 2.480 1.00 0.00 H TER 22621 WAT 8235 ATOM 22621 O WAT 8236 108.492 132.058 62.283 1.00 0.00 O ATOM 22622 H1 WAT 8236 109.405 132.342 62.231 1.00 0.00 H ATOM 22623 H2 WAT 8236 108.065 132.485 61.540 1.00 0.00 H TER 22625 WAT 8236 ATOM 22625 O WAT 8237 96.982 97.785 153.234 1.00 0.00 O ATOM 22626 H1 WAT 8237 97.166 96.903 153.557 1.00 0.00 H ATOM 22627 H2 WAT 8237 97.666 97.949 152.584 1.00 0.00 H TER 22629 WAT 8237 ATOM 22629 O WAT 8238 97.189 3.390 101.742 1.00 0.00 O ATOM 22630 H1 WAT 8238 97.619 2.999 100.981 1.00 0.00 H ATOM 22631 H2 WAT 8238 97.181 4.329 101.556 1.00 0.00 H TER 22633 WAT 8238 ATOM 22633 O WAT 8239 118.122 43.340 9.099 1.00 0.00 O ATOM 22634 H1 WAT 8239 118.730 42.945 8.473 1.00 0.00 H ATOM 22635 H2 WAT 8239 117.459 42.666 9.247 1.00 0.00 H TER 22637 WAT 8239 ATOM 22637 O WAT 8240 65.549 43.161 5.994 1.00 0.00 O ATOM 22638 H1 WAT 8240 65.404 42.964 5.068 1.00 0.00 H ATOM 22639 H2 WAT 8240 64.981 43.910 6.171 1.00 0.00 H TER 22641 WAT 8240 ATOM 22641 O WAT 8241 65.111 50.543 14.031 1.00 0.00 O ATOM 22642 H1 WAT 8241 65.693 50.309 13.308 1.00 0.00 H ATOM 22643 H2 WAT 8241 64.246 50.614 13.629 1.00 0.00 H TER 22645 WAT 8241 ATOM 22645 O WAT 8242 45.596 3.234 76.016 1.00 0.00 O ATOM 22646 H1 WAT 8242 45.511 3.831 75.273 1.00 0.00 H ATOM 22647 H2 WAT 8242 46.541 3.132 76.134 1.00 0.00 H TER 22649 WAT 8242 ATOM 22649 O WAT 8243 108.701 55.695 80.235 1.00 0.00 O ATOM 22650 H1 WAT 8243 109.584 56.057 80.307 1.00 0.00 H ATOM 22651 H2 WAT 8243 108.271 56.240 79.576 1.00 0.00 H TER 22653 WAT 8243 ATOM 22653 O WAT 8244 35.832 112.042 14.383 1.00 0.00 O ATOM 22654 H1 WAT 8244 35.636 111.512 13.611 1.00 0.00 H ATOM 22655 H2 WAT 8244 35.898 111.408 15.098 1.00 0.00 H TER 22657 WAT 8244 ATOM 22657 O WAT 8245 103.612 121.824 149.494 1.00 0.00 O ATOM 22658 H1 WAT 8245 103.546 121.889 150.446 1.00 0.00 H ATOM 22659 H2 WAT 8245 103.043 121.089 149.264 1.00 0.00 H TER 22661 WAT 8245 ATOM 22661 O WAT 8246 3.697 141.107 108.029 1.00 0.00 O ATOM 22662 H1 WAT 8246 3.274 141.748 108.602 1.00 0.00 H ATOM 22663 H2 WAT 8246 3.029 140.891 107.378 1.00 0.00 H TER 22665 WAT 8246 ATOM 22665 O WAT 8247 34.227 143.129 116.574 1.00 0.00 O ATOM 22666 H1 WAT 8247 34.678 142.296 116.711 1.00 0.00 H ATOM 22667 H2 WAT 8247 34.649 143.734 117.185 1.00 0.00 H TER 22669 WAT 8247 ATOM 22669 O WAT 8248 78.167 104.891 84.689 1.00 0.00 O ATOM 22670 H1 WAT 8248 78.944 104.414 84.398 1.00 0.00 H ATOM 22671 H2 WAT 8248 78.204 105.721 84.214 1.00 0.00 H TER 22673 WAT 8248 ATOM 22673 O WAT 8249 116.585 132.170 84.951 1.00 0.00 O ATOM 22674 H1 WAT 8249 116.362 132.278 84.026 1.00 0.00 H ATOM 22675 H2 WAT 8249 117.285 132.805 85.104 1.00 0.00 H TER 22677 WAT 8249 ATOM 22677 O WAT 8250 63.223 96.442 124.513 1.00 0.00 O ATOM 22678 H1 WAT 8250 64.045 96.229 124.071 1.00 0.00 H ATOM 22679 H2 WAT 8250 63.488 96.727 125.388 1.00 0.00 H TER 22681 WAT 8250 ATOM 22681 O WAT 8251 44.006 30.460 80.635 1.00 0.00 O ATOM 22682 H1 WAT 8251 44.341 31.352 80.548 1.00 0.00 H ATOM 22683 H2 WAT 8251 43.681 30.240 79.762 1.00 0.00 H TER 22685 WAT 8251 ATOM 22685 O WAT 8252 27.056 1.990 95.887 1.00 0.00 O ATOM 22686 H1 WAT 8252 27.737 1.668 95.296 1.00 0.00 H ATOM 22687 H2 WAT 8252 26.355 1.341 95.820 1.00 0.00 H TER 22689 WAT 8252 ATOM 22689 O WAT 8253 19.360 115.969 94.325 1.00 0.00 O ATOM 22690 H1 WAT 8253 19.193 116.901 94.185 1.00 0.00 H ATOM 22691 H2 WAT 8253 18.544 115.632 94.695 1.00 0.00 H TER 22693 WAT 8253 ATOM 22693 O WAT 8254 134.180 72.799 139.445 1.00 0.00 O ATOM 22694 H1 WAT 8254 134.986 73.306 139.348 1.00 0.00 H ATOM 22695 H2 WAT 8254 133.917 72.940 140.355 1.00 0.00 H TER 22697 WAT 8254 ATOM 22697 O WAT 8255 79.162 73.325 109.433 1.00 0.00 O ATOM 22698 H1 WAT 8255 78.760 73.914 108.794 1.00 0.00 H ATOM 22699 H2 WAT 8255 78.590 73.376 110.198 1.00 0.00 H TER 22701 WAT 8255 ATOM 22701 O WAT 8256 49.351 108.305 132.115 1.00 0.00 O ATOM 22702 H1 WAT 8256 49.186 107.369 132.226 1.00 0.00 H ATOM 22703 H2 WAT 8256 50.261 108.354 131.821 1.00 0.00 H TER 22705 WAT 8256 ATOM 22705 O WAT 8257 106.574 134.392 86.458 1.00 0.00 O ATOM 22706 H1 WAT 8257 105.852 134.964 86.197 1.00 0.00 H ATOM 22707 H2 WAT 8257 107.328 134.719 85.968 1.00 0.00 H TER 22709 WAT 8257 ATOM 22709 O WAT 8258 62.288 19.335 144.872 1.00 0.00 O ATOM 22710 H1 WAT 8258 61.769 20.126 144.722 1.00 0.00 H ATOM 22711 H2 WAT 8258 62.812 19.239 144.076 1.00 0.00 H TER 22713 WAT 8258 ATOM 22713 O WAT 8259 144.397 9.897 126.476 1.00 0.00 O ATOM 22714 H1 WAT 8259 144.216 10.132 125.566 1.00 0.00 H ATOM 22715 H2 WAT 8259 143.698 9.287 126.709 1.00 0.00 H TER 22717 WAT 8259 ATOM 22717 O WAT 8260 72.760 63.239 156.939 1.00 0.00 O ATOM 22718 H1 WAT 8260 71.915 63.661 156.784 1.00 0.00 H ATOM 22719 H2 WAT 8260 72.539 62.410 157.365 1.00 0.00 H TER 22721 WAT 8260 ATOM 22721 O WAT 8261 11.947 10.976 92.791 1.00 0.00 O ATOM 22722 H1 WAT 8261 11.930 10.272 92.143 1.00 0.00 H ATOM 22723 H2 WAT 8261 12.867 11.233 92.842 1.00 0.00 H TER 22725 WAT 8261 ATOM 22725 O WAT 8262 62.174 9.556 10.309 1.00 0.00 O ATOM 22726 H1 WAT 8262 62.530 8.787 9.865 1.00 0.00 H ATOM 22727 H2 WAT 8262 61.835 9.219 11.138 1.00 0.00 H TER 22729 WAT 8262 ATOM 22729 O WAT 8263 143.356 89.919 150.905 1.00 0.00 O ATOM 22730 H1 WAT 8263 143.047 90.610 151.491 1.00 0.00 H ATOM 22731 H2 WAT 8263 144.094 90.313 150.439 1.00 0.00 H TER 22733 WAT 8263 ATOM 22733 O WAT 8264 120.866 104.733 69.033 1.00 0.00 O ATOM 22734 H1 WAT 8264 121.480 104.349 69.658 1.00 0.00 H ATOM 22735 H2 WAT 8264 120.638 105.582 69.412 1.00 0.00 H TER 22737 WAT 8264 ATOM 22737 O WAT 8265 30.857 61.880 95.598 1.00 0.00 O ATOM 22738 H1 WAT 8265 30.513 62.704 95.944 1.00 0.00 H ATOM 22739 H2 WAT 8265 30.189 61.583 94.979 1.00 0.00 H TER 22741 WAT 8265 ATOM 22741 O WAT 8266 44.099 9.870 94.166 1.00 0.00 O ATOM 22742 H1 WAT 8266 44.681 9.143 94.387 1.00 0.00 H ATOM 22743 H2 WAT 8266 43.899 9.742 93.238 1.00 0.00 H TER 22745 WAT 8266 ATOM 22745 O WAT 8267 54.566 66.075 113.103 1.00 0.00 O ATOM 22746 H1 WAT 8267 55.016 66.915 113.187 1.00 0.00 H ATOM 22747 H2 WAT 8267 54.270 66.051 112.193 1.00 0.00 H TER 22749 WAT 8267 ATOM 22749 O WAT 8268 86.967 35.099 57.456 1.00 0.00 O ATOM 22750 H1 WAT 8268 87.911 34.967 57.365 1.00 0.00 H ATOM 22751 H2 WAT 8268 86.774 35.848 56.893 1.00 0.00 H TER 22753 WAT 8268 ATOM 22753 O WAT 8269 28.584 71.947 132.546 1.00 0.00 O ATOM 22754 H1 WAT 8269 29.475 72.055 132.876 1.00 0.00 H ATOM 22755 H2 WAT 8269 28.278 71.132 132.945 1.00 0.00 H TER 22757 WAT 8269 ATOM 22757 O WAT 8270 21.989 74.547 126.455 1.00 0.00 O ATOM 22758 H1 WAT 8270 21.625 75.040 125.720 1.00 0.00 H ATOM 22759 H2 WAT 8270 22.930 74.520 126.283 1.00 0.00 H TER 22761 WAT 8270 ATOM 22761 O WAT 8271 81.691 98.253 66.279 1.00 0.00 O ATOM 22762 H1 WAT 8271 80.920 98.779 66.069 1.00 0.00 H ATOM 22763 H2 WAT 8271 81.419 97.351 66.113 1.00 0.00 H TER 22765 WAT 8271 ATOM 22765 O WAT 8272 28.155 92.716 135.078 1.00 0.00 O ATOM 22766 H1 WAT 8272 27.586 92.398 134.377 1.00 0.00 H ATOM 22767 H2 WAT 8272 27.556 92.937 135.791 1.00 0.00 H TER 22769 WAT 8272 ATOM 22769 O WAT 8273 54.940 72.302 89.533 1.00 0.00 O ATOM 22770 H1 WAT 8273 55.047 71.561 88.937 1.00 0.00 H ATOM 22771 H2 WAT 8273 54.146 72.100 90.027 1.00 0.00 H TER 22773 WAT 8273 ATOM 22773 O WAT 8274 135.926 60.788 58.246 1.00 0.00 O ATOM 22774 H1 WAT 8274 135.255 60.436 58.831 1.00 0.00 H ATOM 22775 H2 WAT 8274 135.576 60.642 57.366 1.00 0.00 H TER 22777 WAT 8274 ATOM 22777 O WAT 8275 56.732 47.442 121.330 1.00 0.00 O ATOM 22778 H1 WAT 8275 56.598 48.366 121.538 1.00 0.00 H ATOM 22779 H2 WAT 8275 57.660 47.289 121.505 1.00 0.00 H TER 22781 WAT 8275 ATOM 22781 O WAT 8276 103.747 71.884 100.961 1.00 0.00 O ATOM 22782 H1 WAT 8276 103.678 71.048 100.501 1.00 0.00 H ATOM 22783 H2 WAT 8276 103.380 71.711 101.828 1.00 0.00 H TER 22785 WAT 8276 ATOM 22785 O WAT 8277 1.402 138.391 118.813 1.00 0.00 O ATOM 22786 H1 WAT 8277 1.044 137.937 118.050 1.00 0.00 H ATOM 22787 H2 WAT 8277 1.488 137.709 119.480 1.00 0.00 H TER 22789 WAT 8277 ATOM 22789 O WAT 8278 96.844 89.166 136.341 1.00 0.00 O ATOM 22790 H1 WAT 8278 96.834 89.217 135.385 1.00 0.00 H ATOM 22791 H2 WAT 8278 97.573 89.729 136.602 1.00 0.00 H TER 22793 WAT 8278 ATOM 22793 O WAT 8279 104.247 60.595 72.355 1.00 0.00 O ATOM 22794 H1 WAT 8279 103.972 60.801 73.248 1.00 0.00 H ATOM 22795 H2 WAT 8279 104.527 61.434 71.990 1.00 0.00 H TER 22797 WAT 8279 ATOM 22797 O WAT 8280 44.697 114.712 110.575 1.00 0.00 O ATOM 22798 H1 WAT 8280 43.981 114.715 111.210 1.00 0.00 H ATOM 22799 H2 WAT 8280 44.995 115.621 110.544 1.00 0.00 H TER 22801 WAT 8280 ATOM 22801 O WAT 8281 138.416 54.415 96.937 1.00 0.00 O ATOM 22802 H1 WAT 8281 137.464 54.380 97.023 1.00 0.00 H ATOM 22803 H2 WAT 8281 138.718 53.563 97.251 1.00 0.00 H TER 22805 WAT 8281 ATOM 22805 O WAT 8282 64.021 61.243 82.544 1.00 0.00 O ATOM 22806 H1 WAT 8282 63.238 61.290 83.093 1.00 0.00 H ATOM 22807 H2 WAT 8282 63.699 61.398 81.655 1.00 0.00 H TER 22809 WAT 8282 ATOM 22809 O WAT 8283 111.718 22.088 135.833 1.00 0.00 O ATOM 22810 H1 WAT 8283 111.171 21.691 136.511 1.00 0.00 H ATOM 22811 H2 WAT 8283 112.220 21.357 135.473 1.00 0.00 H TER 22813 WAT 8283 ATOM 22813 O WAT 8284 16.615 68.363 148.039 1.00 0.00 O ATOM 22814 H1 WAT 8284 15.918 68.403 148.694 1.00 0.00 H ATOM 22815 H2 WAT 8284 17.005 67.497 148.156 1.00 0.00 H TER 22817 WAT 8284 ATOM 22817 O WAT 8285 46.093 81.862 121.037 1.00 0.00 O ATOM 22818 H1 WAT 8285 46.061 82.188 120.137 1.00 0.00 H ATOM 22819 H2 WAT 8285 47.026 81.743 121.215 1.00 0.00 H TER 22821 WAT 8285 ATOM 22821 O WAT 8286 139.533 96.649 24.031 1.00 0.00 O ATOM 22822 H1 WAT 8286 140.319 96.763 24.565 1.00 0.00 H ATOM 22823 H2 WAT 8286 138.865 96.352 24.649 1.00 0.00 H TER 22825 WAT 8286 ATOM 22825 O WAT 8287 71.062 41.060 144.507 1.00 0.00 O ATOM 22826 H1 WAT 8287 70.765 41.645 145.204 1.00 0.00 H ATOM 22827 H2 WAT 8287 71.232 41.640 143.764 1.00 0.00 H TER 22829 WAT 8287 ATOM 22829 O WAT 8288 18.892 60.624 115.794 1.00 0.00 O ATOM 22830 H1 WAT 8288 18.007 60.987 115.757 1.00 0.00 H ATOM 22831 H2 WAT 8288 18.782 59.766 116.205 1.00 0.00 H TER 22833 WAT 8288 ATOM 22833 O WAT 8289 144.668 136.980 136.321 1.00 0.00 O ATOM 22834 H1 WAT 8289 145.517 136.928 135.883 1.00 0.00 H ATOM 22835 H2 WAT 8289 144.832 136.643 137.202 1.00 0.00 H TER 22837 WAT 8289 ATOM 22837 O WAT 8290 79.036 88.749 105.741 1.00 0.00 O ATOM 22838 H1 WAT 8290 79.236 89.498 105.179 1.00 0.00 H ATOM 22839 H2 WAT 8290 79.643 88.066 105.455 1.00 0.00 H TER 22841 WAT 8290 ATOM 22841 O WAT 8291 124.207 1.604 108.259 1.00 0.00 O ATOM 22842 H1 WAT 8291 124.472 1.713 109.172 1.00 0.00 H ATOM 22843 H2 WAT 8291 124.166 2.495 107.913 1.00 0.00 H TER 22845 WAT 8291 ATOM 22845 O WAT 8292 142.774 107.356 15.978 1.00 0.00 O ATOM 22846 H1 WAT 8292 143.503 107.811 15.557 1.00 0.00 H ATOM 22847 H2 WAT 8292 142.569 106.632 15.386 1.00 0.00 H TER 22849 WAT 8292 ATOM 22849 O WAT 8293 9.162 0.457 136.298 1.00 0.00 O ATOM 22850 H1 WAT 8293 8.896 0.938 135.514 1.00 0.00 H ATOM 22851 H2 WAT 8293 10.093 0.279 136.165 1.00 0.00 H TER 22853 WAT 8293 ATOM 22853 O WAT 8294 132.588 117.095 114.399 1.00 0.00 O ATOM 22854 H1 WAT 8294 132.553 116.626 113.566 1.00 0.00 H ATOM 22855 H2 WAT 8294 132.770 116.417 115.049 1.00 0.00 H TER 22857 WAT 8294 ATOM 22857 O WAT 8295 0.277 6.333 77.561 1.00 0.00 O ATOM 22858 H1 WAT 8295 1.062 6.837 77.778 1.00 0.00 H ATOM 22859 H2 WAT 8295 -0.307 6.967 77.145 1.00 0.00 H TER 22861 WAT 8295 ATOM 22861 O WAT 8296 101.625 28.326 142.619 1.00 0.00 O ATOM 22862 H1 WAT 8296 101.132 29.099 142.344 1.00 0.00 H ATOM 22863 H2 WAT 8296 101.084 27.586 142.343 1.00 0.00 H TER 22865 WAT 8296 ATOM 22865 O WAT 8297 57.856 60.939 116.278 1.00 0.00 O ATOM 22866 H1 WAT 8297 58.662 61.300 116.648 1.00 0.00 H ATOM 22867 H2 WAT 8297 57.689 60.149 116.792 1.00 0.00 H TER 22869 WAT 8297 ATOM 22869 O WAT 8298 53.324 128.868 62.792 1.00 0.00 O ATOM 22870 H1 WAT 8298 53.072 128.076 62.318 1.00 0.00 H ATOM 22871 H2 WAT 8298 54.276 128.907 62.705 1.00 0.00 H TER 22873 WAT 8298 ATOM 22873 O WAT 8299 57.785 20.678 151.243 1.00 0.00 O ATOM 22874 H1 WAT 8299 58.482 20.405 150.646 1.00 0.00 H ATOM 22875 H2 WAT 8299 57.671 21.612 151.067 1.00 0.00 H TER 22877 WAT 8299 ATOM 22877 O WAT 8300 33.421 2.532 106.485 1.00 0.00 O ATOM 22878 H1 WAT 8300 33.000 2.960 107.231 1.00 0.00 H ATOM 22879 H2 WAT 8300 33.358 1.597 106.678 1.00 0.00 H TER 22881 WAT 8300 ATOM 22881 O WAT 8301 58.163 88.834 77.109 1.00 0.00 O ATOM 22882 H1 WAT 8301 58.530 89.465 76.491 1.00 0.00 H ATOM 22883 H2 WAT 8301 58.084 88.023 76.606 1.00 0.00 H TER 22885 WAT 8301 ATOM 22885 O WAT 8302 72.677 61.878 154.285 1.00 0.00 O ATOM 22886 H1 WAT 8302 73.524 61.672 153.890 1.00 0.00 H ATOM 22887 H2 WAT 8302 72.895 62.311 155.110 1.00 0.00 H TER 22889 WAT 8302 ATOM 22889 O WAT 8303 33.366 113.576 109.054 1.00 0.00 O ATOM 22890 H1 WAT 8303 33.006 114.015 109.824 1.00 0.00 H ATOM 22891 H2 WAT 8303 34.192 113.199 109.357 1.00 0.00 H TER 22893 WAT 8303 ATOM 22893 O WAT 8304 39.235 58.329 134.744 1.00 0.00 O ATOM 22894 H1 WAT 8304 39.658 59.179 134.628 1.00 0.00 H ATOM 22895 H2 WAT 8304 38.521 58.498 135.359 1.00 0.00 H TER 22897 WAT 8304 ATOM 22897 O WAT 8305 22.238 105.101 103.702 1.00 0.00 O ATOM 22898 H1 WAT 8305 22.997 104.738 104.158 1.00 0.00 H ATOM 22899 H2 WAT 8305 21.955 105.832 104.251 1.00 0.00 H TER 22901 WAT 8305 ATOM 22901 O WAT 8306 88.154 107.228 103.154 1.00 0.00 O ATOM 22902 H1 WAT 8306 88.586 107.970 103.578 1.00 0.00 H ATOM 22903 H2 WAT 8306 88.116 106.554 103.833 1.00 0.00 H TER 22905 WAT 8306 ATOM 22905 O WAT 8307 79.153 58.257 13.648 1.00 0.00 O ATOM 22906 H1 WAT 8307 78.609 58.886 14.123 1.00 0.00 H ATOM 22907 H2 WAT 8307 79.870 58.057 14.250 1.00 0.00 H TER 22909 WAT 8307 ATOM 22909 O WAT 8308 6.217 82.531 94.131 1.00 0.00 O ATOM 22910 H1 WAT 8308 6.018 82.185 95.001 1.00 0.00 H ATOM 22911 H2 WAT 8308 6.762 81.857 93.725 1.00 0.00 H TER 22913 WAT 8308 ATOM 22913 O WAT 8309 131.877 93.205 124.217 1.00 0.00 O ATOM 22914 H1 WAT 8309 132.584 92.585 124.399 1.00 0.00 H ATOM 22915 H2 WAT 8309 131.538 92.938 123.363 1.00 0.00 H TER 22917 WAT 8309 ATOM 22917 O WAT 8310 57.035 40.594 105.786 1.00 0.00 O ATOM 22918 H1 WAT 8310 56.145 40.242 105.755 1.00 0.00 H ATOM 22919 H2 WAT 8310 57.208 40.725 106.718 1.00 0.00 H TER 22921 WAT 8310 ATOM 22921 O WAT 8311 30.331 23.280 151.625 1.00 0.00 O ATOM 22922 H1 WAT 8311 30.447 22.330 151.642 1.00 0.00 H ATOM 22923 H2 WAT 8311 30.453 23.520 150.706 1.00 0.00 H TER 22925 WAT 8311 ATOM 22925 O WAT 8312 88.312 86.280 122.315 1.00 0.00 O ATOM 22926 H1 WAT 8312 89.245 86.118 122.178 1.00 0.00 H ATOM 22927 H2 WAT 8312 88.249 86.561 123.228 1.00 0.00 H TER 22929 WAT 8312 ATOM 22929 O WAT 8313 118.956 11.331 10.080 1.00 0.00 O ATOM 22930 H1 WAT 8313 118.614 10.441 10.174 1.00 0.00 H ATOM 22931 H2 WAT 8313 119.659 11.387 10.728 1.00 0.00 H TER 22933 WAT 8313 ATOM 22933 O WAT 8314 42.200 61.306 120.895 1.00 0.00 O ATOM 22934 H1 WAT 8314 42.551 60.666 121.514 1.00 0.00 H ATOM 22935 H2 WAT 8314 42.393 62.155 121.293 1.00 0.00 H TER 22937 WAT 8314 ATOM 22937 O WAT 8315 23.567 90.430 16.482 1.00 0.00 O ATOM 22938 H1 WAT 8315 24.410 90.068 16.754 1.00 0.00 H ATOM 22939 H2 WAT 8315 23.633 91.365 16.678 1.00 0.00 H TER 22941 WAT 8315 ATOM 22941 O WAT 8316 64.908 110.682 13.692 1.00 0.00 O ATOM 22942 H1 WAT 8316 64.109 111.144 13.947 1.00 0.00 H ATOM 22943 H2 WAT 8316 64.936 110.761 12.738 1.00 0.00 H TER 22945 WAT 8316 ATOM 22945 O WAT 8317 128.386 36.620 115.281 1.00 0.00 O ATOM 22946 H1 WAT 8317 128.347 37.411 115.819 1.00 0.00 H ATOM 22947 H2 WAT 8317 129.319 36.489 115.115 1.00 0.00 H TER 22949 WAT 8317 ATOM 22949 O WAT 8318 48.125 46.456 113.883 1.00 0.00 O ATOM 22950 H1 WAT 8318 47.944 45.579 113.543 1.00 0.00 H ATOM 22951 H2 WAT 8318 48.700 46.308 114.634 1.00 0.00 H TER 22953 WAT 8318 ATOM 22953 O WAT 8319 57.937 70.008 115.130 1.00 0.00 O ATOM 22954 H1 WAT 8319 57.556 69.163 114.891 1.00 0.00 H ATOM 22955 H2 WAT 8319 58.810 69.996 114.737 1.00 0.00 H TER 22957 WAT 8319 ATOM 22957 O WAT 8320 134.897 64.156 130.584 1.00 0.00 O ATOM 22958 H1 WAT 8320 134.034 64.569 130.565 1.00 0.00 H ATOM 22959 H2 WAT 8320 135.313 64.507 131.371 1.00 0.00 H TER 22961 WAT 8320 ATOM 22961 O WAT 8321 63.569 33.635 112.588 1.00 0.00 O ATOM 22962 H1 WAT 8321 63.383 34.279 111.904 1.00 0.00 H ATOM 22963 H2 WAT 8321 64.517 33.512 112.550 1.00 0.00 H TER 22965 WAT 8321 ATOM 22965 O WAT 8322 38.883 109.430 152.719 1.00 0.00 O ATOM 22966 H1 WAT 8322 39.092 109.805 153.575 1.00 0.00 H ATOM 22967 H2 WAT 8322 37.939 109.562 152.624 1.00 0.00 H TER 22969 WAT 8322 ATOM 22969 O WAT 8323 98.577 35.538 130.553 1.00 0.00 O ATOM 22970 H1 WAT 8323 97.940 35.313 129.874 1.00 0.00 H ATOM 22971 H2 WAT 8323 98.044 35.796 131.305 1.00 0.00 H TER 22973 WAT 8323 ATOM 22973 O WAT 8324 104.105 1.543 64.046 1.00 0.00 O ATOM 22974 H1 WAT 8324 104.452 1.198 64.869 1.00 0.00 H ATOM 22975 H2 WAT 8324 104.004 2.481 64.204 1.00 0.00 H TER 22977 WAT 8324 ATOM 22977 O WAT 8325 74.341 29.449 97.856 1.00 0.00 O ATOM 22978 H1 WAT 8325 74.403 29.968 98.658 1.00 0.00 H ATOM 22979 H2 WAT 8325 74.022 30.064 97.196 1.00 0.00 H TER 22981 WAT 8325 ATOM 22981 O WAT 8326 3.576 121.321 132.790 1.00 0.00 O ATOM 22982 H1 WAT 8326 4.176 120.636 132.497 1.00 0.00 H ATOM 22983 H2 WAT 8326 4.138 122.080 132.946 1.00 0.00 H TER 22985 WAT 8326 ATOM 22985 O WAT 8327 117.047 23.892 71.443 1.00 0.00 O ATOM 22986 H1 WAT 8327 116.820 23.238 72.104 1.00 0.00 H ATOM 22987 H2 WAT 8327 116.321 23.865 70.820 1.00 0.00 H TER 22989 WAT 8327 ATOM 22989 O WAT 8328 69.047 135.346 130.469 1.00 0.00 O ATOM 22990 H1 WAT 8328 69.751 134.700 130.402 1.00 0.00 H ATOM 22991 H2 WAT 8328 68.260 134.871 130.201 1.00 0.00 H TER 22993 WAT 8328 ATOM 22993 O WAT 8329 122.063 91.096 115.008 1.00 0.00 O ATOM 22994 H1 WAT 8329 121.327 91.021 114.400 1.00 0.00 H ATOM 22995 H2 WAT 8329 122.840 91.026 114.452 1.00 0.00 H TER 22997 WAT 8329 ATOM 22997 O WAT 8330 74.286 25.169 128.722 1.00 0.00 O ATOM 22998 H1 WAT 8330 74.622 25.547 127.910 1.00 0.00 H ATOM 22999 H2 WAT 8330 73.652 24.512 128.437 1.00 0.00 H TER 23001 WAT 8330 ATOM 23001 O WAT 8331 76.894 77.943 88.633 1.00 0.00 O ATOM 23002 H1 WAT 8331 76.009 77.578 88.652 1.00 0.00 H ATOM 23003 H2 WAT 8331 77.366 77.393 88.008 1.00 0.00 H TER 23005 WAT 8331 ATOM 23005 O WAT 8332 24.380 36.692 23.549 1.00 0.00 O ATOM 23006 H1 WAT 8332 25.011 35.974 23.497 1.00 0.00 H ATOM 23007 H2 WAT 8332 24.601 37.259 22.810 1.00 0.00 H TER 23009 WAT 8332 ATOM 23009 O WAT 8333 7.535 101.082 116.882 1.00 0.00 O ATOM 23010 H1 WAT 8333 8.173 101.624 117.346 1.00 0.00 H ATOM 23011 H2 WAT 8333 8.067 100.473 116.369 1.00 0.00 H TER 23013 WAT 8333 ATOM 23013 O WAT 8334 10.978 93.486 108.901 1.00 0.00 O ATOM 23014 H1 WAT 8334 11.042 94.265 109.453 1.00 0.00 H ATOM 23015 H2 WAT 8334 11.852 93.097 108.932 1.00 0.00 H TER 23017 WAT 8334 ATOM 23017 O WAT 8335 27.983 23.622 92.225 1.00 0.00 O ATOM 23018 H1 WAT 8335 28.216 23.091 91.463 1.00 0.00 H ATOM 23019 H2 WAT 8335 27.050 23.456 92.356 1.00 0.00 H TER 23021 WAT 8335 ATOM 23021 O WAT 8336 70.528 109.772 117.886 1.00 0.00 O ATOM 23022 H1 WAT 8336 69.975 110.532 117.706 1.00 0.00 H ATOM 23023 H2 WAT 8336 70.465 109.650 118.834 1.00 0.00 H TER 23025 WAT 8336 ATOM 23025 O WAT 8337 45.652 114.457 114.633 1.00 0.00 O ATOM 23026 H1 WAT 8337 44.948 114.899 114.158 1.00 0.00 H ATOM 23027 H2 WAT 8337 45.687 114.904 115.479 1.00 0.00 H TER 23029 WAT 8337 ATOM 23029 O WAT 8338 81.328 32.919 129.570 1.00 0.00 O ATOM 23030 H1 WAT 8338 82.148 32.528 129.870 1.00 0.00 H ATOM 23031 H2 WAT 8338 81.598 33.591 128.944 1.00 0.00 H TER 23033 WAT 8338 ATOM 23033 O WAT 8339 21.138 7.705 26.960 1.00 0.00 O ATOM 23034 H1 WAT 8339 20.759 8.341 27.566 1.00 0.00 H ATOM 23035 H2 WAT 8339 21.877 8.165 26.561 1.00 0.00 H TER 23037 WAT 8339 ATOM 23037 O WAT 8340 22.963 20.974 0.906 1.00 0.00 O ATOM 23038 H1 WAT 8340 22.184 20.423 0.828 1.00 0.00 H ATOM 23039 H2 WAT 8340 22.914 21.566 0.155 1.00 0.00 H TER 23041 WAT 8340 ATOM 23041 O WAT 8341 48.199 22.035 59.614 1.00 0.00 O ATOM 23042 H1 WAT 8341 48.599 21.354 59.073 1.00 0.00 H ATOM 23043 H2 WAT 8341 47.535 22.430 59.050 1.00 0.00 H TER 23045 WAT 8341 ATOM 23045 O WAT 8342 64.808 125.081 126.935 1.00 0.00 O ATOM 23046 H1 WAT 8342 64.228 125.704 126.497 1.00 0.00 H ATOM 23047 H2 WAT 8342 64.278 124.719 127.646 1.00 0.00 H TER 23049 WAT 8342 ATOM 23049 O WAT 8343 37.684 108.955 100.175 1.00 0.00 O ATOM 23050 H1 WAT 8343 36.890 108.511 100.471 1.00 0.00 H ATOM 23051 H2 WAT 8343 38.254 108.965 100.944 1.00 0.00 H TER 23053 WAT 8343 ATOM 23053 O WAT 8344 38.730 129.008 0.995 1.00 0.00 O ATOM 23054 H1 WAT 8344 38.804 129.955 0.881 1.00 0.00 H ATOM 23055 H2 WAT 8344 39.310 128.640 0.329 1.00 0.00 H TER 23057 WAT 8344 ATOM 23057 O WAT 8345 57.297 77.962 132.020 1.00 0.00 O ATOM 23058 H1 WAT 8345 56.989 78.303 132.859 1.00 0.00 H ATOM 23059 H2 WAT 8345 57.765 77.158 132.245 1.00 0.00 H TER 23061 WAT 8345 ATOM 23061 O WAT 8346 135.613 33.999 97.524 1.00 0.00 O ATOM 23062 H1 WAT 8346 134.806 33.952 98.037 1.00 0.00 H ATOM 23063 H2 WAT 8346 136.170 33.312 97.890 1.00 0.00 H TER 23065 WAT 8346 ATOM 23065 O WAT 8347 142.968 59.321 55.993 1.00 0.00 O ATOM 23066 H1 WAT 8347 142.693 58.981 56.845 1.00 0.00 H ATOM 23067 H2 WAT 8347 143.514 60.079 56.202 1.00 0.00 H TER 23069 WAT 8347 ATOM 23069 O WAT 8348 7.243 143.439 79.228 1.00 0.00 O ATOM 23070 H1 WAT 8348 6.841 143.860 79.988 1.00 0.00 H ATOM 23071 H2 WAT 8348 6.503 143.121 78.711 1.00 0.00 H TER 23073 WAT 8348 ATOM 23073 O WAT 8349 10.955 71.282 91.546 1.00 0.00 O ATOM 23074 H1 WAT 8349 11.193 71.590 90.671 1.00 0.00 H ATOM 23075 H2 WAT 8349 11.656 70.675 91.785 1.00 0.00 H TER 23077 WAT 8349 ATOM 23077 O WAT 8350 135.226 100.736 16.709 1.00 0.00 O ATOM 23078 H1 WAT 8350 134.447 101.272 16.558 1.00 0.00 H ATOM 23079 H2 WAT 8350 135.511 100.476 15.833 1.00 0.00 H TER 23081 WAT 8350 ATOM 23081 O WAT 8351 101.703 136.934 67.371 1.00 0.00 O ATOM 23082 H1 WAT 8351 102.090 136.291 66.776 1.00 0.00 H ATOM 23083 H2 WAT 8351 100.815 137.062 67.039 1.00 0.00 H TER 23085 WAT 8351 ATOM 23085 O WAT 8352 140.458 129.114 4.056 1.00 0.00 O ATOM 23086 H1 WAT 8352 140.923 128.578 4.698 1.00 0.00 H ATOM 23087 H2 WAT 8352 140.345 128.538 3.300 1.00 0.00 H TER 23089 WAT 8352 ATOM 23089 O WAT 8353 113.099 87.354 135.327 1.00 0.00 O ATOM 23090 H1 WAT 8353 114.047 87.276 135.438 1.00 0.00 H ATOM 23091 H2 WAT 8353 112.819 86.486 135.039 1.00 0.00 H TER 23093 WAT 8353 ATOM 23093 O WAT 8354 42.477 68.022 146.951 1.00 0.00 O ATOM 23094 H1 WAT 8354 43.269 68.140 147.476 1.00 0.00 H ATOM 23095 H2 WAT 8354 42.800 67.807 146.076 1.00 0.00 H TER 23097 WAT 8354 ATOM 23097 O WAT 8355 105.360 48.880 153.563 1.00 0.00 O ATOM 23098 H1 WAT 8355 105.128 49.299 154.392 1.00 0.00 H ATOM 23099 H2 WAT 8355 105.925 48.150 153.815 1.00 0.00 H TER 23101 WAT 8355 ATOM 23101 O WAT 8356 8.901 72.946 142.133 1.00 0.00 O ATOM 23102 H1 WAT 8356 8.236 72.796 142.805 1.00 0.00 H ATOM 23103 H2 WAT 8356 8.530 72.562 141.339 1.00 0.00 H TER 23105 WAT 8356 ATOM 23105 O WAT 8357 79.824 123.276 143.130 1.00 0.00 O ATOM 23106 H1 WAT 8357 80.520 123.172 143.778 1.00 0.00 H ATOM 23107 H2 WAT 8357 80.272 123.595 142.346 1.00 0.00 H TER 23109 WAT 8357 ATOM 23109 O WAT 8358 35.653 40.636 1.407 1.00 0.00 O ATOM 23110 H1 WAT 8358 36.298 41.196 0.976 1.00 0.00 H ATOM 23111 H2 WAT 8358 35.546 41.020 2.278 1.00 0.00 H TER 23113 WAT 8358 ATOM 23113 O WAT 8359 13.236 49.747 73.368 1.00 0.00 O ATOM 23114 H1 WAT 8359 13.629 49.985 72.528 1.00 0.00 H ATOM 23115 H2 WAT 8359 12.640 50.469 73.566 1.00 0.00 H TER 23117 WAT 8359 ATOM 23117 O WAT 8360 99.948 48.319 96.832 1.00 0.00 O ATOM 23118 H1 WAT 8360 100.895 48.356 96.698 1.00 0.00 H ATOM 23119 H2 WAT 8360 99.577 48.593 95.993 1.00 0.00 H TER 23121 WAT 8360 ATOM 23121 O WAT 8361 95.829 76.147 99.910 1.00 0.00 O ATOM 23122 H1 WAT 8361 95.981 75.453 100.551 1.00 0.00 H ATOM 23123 H2 WAT 8361 96.603 76.128 99.348 1.00 0.00 H TER 23125 WAT 8361 ATOM 23125 O WAT 8362 62.595 105.693 91.649 1.00 0.00 O ATOM 23126 H1 WAT 8362 62.884 106.568 91.390 1.00 0.00 H ATOM 23127 H2 WAT 8362 61.686 105.644 91.353 1.00 0.00 H TER 23129 WAT 8362 ATOM 23129 O WAT 8363 130.241 144.394 82.493 1.00 0.00 O ATOM 23130 H1 WAT 8363 129.759 143.848 81.872 1.00 0.00 H ATOM 23131 H2 WAT 8363 130.257 143.881 83.301 1.00 0.00 H TER 23133 WAT 8363 ATOM 23133 O WAT 8364 1.949 54.770 67.685 1.00 0.00 O ATOM 23134 H1 WAT 8364 2.178 55.643 67.367 1.00 0.00 H ATOM 23135 H2 WAT 8364 2.783 54.385 67.952 1.00 0.00 H TER 23137 WAT 8364 ATOM 23137 O WAT 8365 111.175 48.895 100.526 1.00 0.00 O ATOM 23138 H1 WAT 8365 111.294 47.947 100.479 1.00 0.00 H ATOM 23139 H2 WAT 8365 112.035 49.256 100.311 1.00 0.00 H TER 23141 WAT 8365 ATOM 23141 O WAT 8366 35.978 11.831 145.587 1.00 0.00 O ATOM 23142 H1 WAT 8366 35.915 11.656 144.648 1.00 0.00 H ATOM 23143 H2 WAT 8366 35.111 12.158 145.828 1.00 0.00 H TER 23145 WAT 8366 ATOM 23145 O WAT 8367 80.855 32.836 89.723 1.00 0.00 O ATOM 23146 H1 WAT 8367 81.527 33.217 90.289 1.00 0.00 H ATOM 23147 H2 WAT 8367 80.056 32.860 90.251 1.00 0.00 H TER 23149 WAT 8367 ATOM 23149 O WAT 8368 131.597 123.290 112.248 1.00 0.00 O ATOM 23150 H1 WAT 8368 131.420 122.461 112.693 1.00 0.00 H ATOM 23151 H2 WAT 8368 130.835 123.426 111.684 1.00 0.00 H TER 23153 WAT 8368 ATOM 23153 O WAT 8369 133.746 14.625 64.711 1.00 0.00 O ATOM 23154 H1 WAT 8369 134.177 13.857 65.087 1.00 0.00 H ATOM 23155 H2 WAT 8369 133.375 14.311 63.886 1.00 0.00 H TER 23157 WAT 8369 ATOM 23157 O WAT 8370 6.330 39.229 92.813 1.00 0.00 O ATOM 23158 H1 WAT 8370 6.471 38.292 92.672 1.00 0.00 H ATOM 23159 H2 WAT 8370 6.878 39.441 93.569 1.00 0.00 H TER 23161 WAT 8370 ATOM 23161 O WAT 8371 69.112 62.323 148.841 1.00 0.00 O ATOM 23162 H1 WAT 8371 68.674 61.541 149.179 1.00 0.00 H ATOM 23163 H2 WAT 8371 68.397 62.895 148.560 1.00 0.00 H TER 23165 WAT 8371 ATOM 23165 O WAT 8372 145.457 44.470 150.216 1.00 0.00 O ATOM 23166 H1 WAT 8372 145.540 45.298 150.689 1.00 0.00 H ATOM 23167 H2 WAT 8372 146.360 44.194 150.056 1.00 0.00 H TER 23169 WAT 8372 ATOM 23169 O WAT 8373 86.805 139.131 76.230 1.00 0.00 O ATOM 23170 H1 WAT 8373 86.818 139.105 77.186 1.00 0.00 H ATOM 23171 H2 WAT 8373 86.224 138.413 75.978 1.00 0.00 H TER 23173 WAT 8373 ATOM 23173 O WAT 8374 64.430 144.926 145.888 1.00 0.00 O ATOM 23174 H1 WAT 8374 63.548 144.909 146.259 1.00 0.00 H ATOM 23175 H2 WAT 8374 64.440 145.704 145.330 1.00 0.00 H TER 23177 WAT 8374 ATOM 23177 O WAT 8375 23.226 125.786 115.830 1.00 0.00 O ATOM 23178 H1 WAT 8375 22.989 125.281 116.608 1.00 0.00 H ATOM 23179 H2 WAT 8375 24.066 125.420 115.554 1.00 0.00 H TER 23181 WAT 8375 ATOM 23181 O WAT 8376 36.211 144.084 118.593 1.00 0.00 O ATOM 23182 H1 WAT 8376 36.616 144.784 118.081 1.00 0.00 H ATOM 23183 H2 WAT 8376 36.110 144.456 119.469 1.00 0.00 H TER 23185 WAT 8376 ATOM 23185 O WAT 8377 24.952 142.717 146.959 1.00 0.00 O ATOM 23186 H1 WAT 8377 24.256 142.414 146.377 1.00 0.00 H ATOM 23187 H2 WAT 8377 25.658 142.082 146.840 1.00 0.00 H TER 23189 WAT 8377 ATOM 23189 O WAT 8378 44.757 0.955 9.433 1.00 0.00 O ATOM 23190 H1 WAT 8378 45.213 1.758 9.180 1.00 0.00 H ATOM 23191 H2 WAT 8378 45.082 0.762 10.313 1.00 0.00 H TER 23193 WAT 8378 ATOM 23193 O WAT 8379 90.160 141.935 98.473 1.00 0.00 O ATOM 23194 H1 WAT 8379 90.447 141.431 97.712 1.00 0.00 H ATOM 23195 H2 WAT 8379 90.353 141.370 99.221 1.00 0.00 H TER 23197 WAT 8379 ATOM 23197 O WAT 8380 89.964 112.832 126.475 1.00 0.00 O ATOM 23198 H1 WAT 8380 90.413 113.393 125.842 1.00 0.00 H ATOM 23199 H2 WAT 8380 89.125 112.628 126.060 1.00 0.00 H TER 23201 WAT 8380 ATOM 23201 O WAT 8381 44.643 83.519 63.219 1.00 0.00 O ATOM 23202 H1 WAT 8381 44.599 82.855 62.531 1.00 0.00 H ATOM 23203 H2 WAT 8381 44.041 84.204 62.929 1.00 0.00 H TER 23205 WAT 8381 ATOM 23205 O WAT 8382 100.287 95.174 138.445 1.00 0.00 O ATOM 23206 H1 WAT 8382 99.402 95.093 138.801 1.00 0.00 H ATOM 23207 H2 WAT 8382 100.714 95.818 139.010 1.00 0.00 H TER 23209 WAT 8382 ATOM 23209 O WAT 8383 27.341 37.730 150.011 1.00 0.00 O ATOM 23210 H1 WAT 8383 28.162 38.216 150.085 1.00 0.00 H ATOM 23211 H2 WAT 8383 27.611 36.831 149.824 1.00 0.00 H TER 23213 WAT 8383 ATOM 23213 O WAT 8384 130.239 89.408 14.918 1.00 0.00 O ATOM 23214 H1 WAT 8384 130.681 89.773 15.685 1.00 0.00 H ATOM 23215 H2 WAT 8384 130.914 89.393 14.239 1.00 0.00 H TER 23217 WAT 8384 ATOM 23217 O WAT 8385 27.431 144.178 22.517 1.00 0.00 O ATOM 23218 H1 WAT 8385 28.030 144.924 22.500 1.00 0.00 H ATOM 23219 H2 WAT 8385 27.390 143.925 23.439 1.00 0.00 H TER 23221 WAT 8385 ATOM 23221 O WAT 8386 90.703 139.396 56.685 1.00 0.00 O ATOM 23222 H1 WAT 8386 91.314 138.960 57.279 1.00 0.00 H ATOM 23223 H2 WAT 8386 90.526 140.240 57.100 1.00 0.00 H TER 23225 WAT 8386 ATOM 23225 O WAT 8387 68.988 144.849 101.656 1.00 0.00 O ATOM 23226 H1 WAT 8387 68.471 144.308 102.254 1.00 0.00 H ATOM 23227 H2 WAT 8387 69.536 144.225 101.181 1.00 0.00 H TER 23229 WAT 8387 ATOM 23229 O WAT 8388 93.195 86.646 157.571 1.00 0.00 O ATOM 23230 H1 WAT 8388 93.747 86.121 156.992 1.00 0.00 H ATOM 23231 H2 WAT 8388 92.308 86.520 157.235 1.00 0.00 H TER 23233 WAT 8388 ATOM 23233 O WAT 8389 36.009 85.677 79.013 1.00 0.00 O ATOM 23234 H1 WAT 8389 35.056 85.770 79.016 1.00 0.00 H ATOM 23235 H2 WAT 8389 36.334 86.547 78.784 1.00 0.00 H TER 23237 WAT 8389 ATOM 23237 O WAT 8390 50.691 35.774 121.737 1.00 0.00 O ATOM 23238 H1 WAT 8390 50.383 34.891 121.535 1.00 0.00 H ATOM 23239 H2 WAT 8390 49.999 36.151 122.280 1.00 0.00 H TER 23241 WAT 8390 ATOM 23241 O WAT 8391 70.154 50.965 23.563 1.00 0.00 O ATOM 23242 H1 WAT 8391 70.279 51.466 22.757 1.00 0.00 H ATOM 23243 H2 WAT 8391 69.218 50.766 23.580 1.00 0.00 H TER 23245 WAT 8391 ATOM 23245 O WAT 8392 112.902 60.762 146.469 1.00 0.00 O ATOM 23246 H1 WAT 8392 113.254 60.357 147.262 1.00 0.00 H ATOM 23247 H2 WAT 8392 113.447 60.418 145.762 1.00 0.00 H TER 23249 WAT 8392 ATOM 23249 O WAT 8393 71.857 28.543 63.022 1.00 0.00 O ATOM 23250 H1 WAT 8393 71.197 29.222 62.887 1.00 0.00 H ATOM 23251 H2 WAT 8393 72.597 28.816 62.481 1.00 0.00 H TER 23253 WAT 8393 ATOM 23253 O WAT 8394 11.009 74.305 15.734 1.00 0.00 O ATOM 23254 H1 WAT 8394 11.872 74.152 15.349 1.00 0.00 H ATOM 23255 H2 WAT 8394 11.089 73.989 16.634 1.00 0.00 H TER 23257 WAT 8394 ATOM 23257 O WAT 8395 46.305 55.956 6.339 1.00 0.00 O ATOM 23258 H1 WAT 8395 45.565 55.615 5.836 1.00 0.00 H ATOM 23259 H2 WAT 8395 46.860 56.384 5.687 1.00 0.00 H TER 23261 WAT 8395 ATOM 23261 O WAT 8396 50.611 44.247 1.667 1.00 0.00 O ATOM 23262 H1 WAT 8396 51.147 45.033 1.557 1.00 0.00 H ATOM 23263 H2 WAT 8396 49.710 44.558 1.575 1.00 0.00 H TER 23265 WAT 8396 ATOM 23265 O WAT 8397 60.655 26.954 8.505 1.00 0.00 O ATOM 23266 H1 WAT 8397 60.148 26.968 9.317 1.00 0.00 H ATOM 23267 H2 WAT 8397 61.212 26.179 8.584 1.00 0.00 H TER 23269 WAT 8397 ATOM 23269 O WAT 8398 84.123 121.254 156.601 1.00 0.00 O ATOM 23270 H1 WAT 8398 84.247 122.071 157.084 1.00 0.00 H ATOM 23271 H2 WAT 8398 85.008 120.989 156.348 1.00 0.00 H TER 23273 WAT 8398 ATOM 23273 O WAT 8399 105.261 97.474 151.904 1.00 0.00 O ATOM 23274 H1 WAT 8399 105.640 97.512 151.025 1.00 0.00 H ATOM 23275 H2 WAT 8399 104.445 97.969 151.834 1.00 0.00 H TER 23277 WAT 8399 ATOM 23277 O WAT 8400 128.419 94.761 69.050 1.00 0.00 O ATOM 23278 H1 WAT 8400 128.934 94.076 68.624 1.00 0.00 H ATOM 23279 H2 WAT 8400 128.332 94.467 69.956 1.00 0.00 H TER 23281 WAT 8400 ATOM 23281 O WAT 8401 20.459 30.450 129.340 1.00 0.00 O ATOM 23282 H1 WAT 8401 21.199 31.038 129.188 1.00 0.00 H ATOM 23283 H2 WAT 8401 19.688 30.979 129.135 1.00 0.00 H TER 23285 WAT 8401 ATOM 23285 O WAT 8402 96.720 53.524 21.784 1.00 0.00 O ATOM 23286 H1 WAT 8402 97.598 53.864 21.957 1.00 0.00 H ATOM 23287 H2 WAT 8402 96.740 52.627 22.118 1.00 0.00 H TER 23289 WAT 8402 ATOM 23289 O WAT 8403 58.637 30.401 117.917 1.00 0.00 O ATOM 23290 H1 WAT 8403 57.871 30.953 118.076 1.00 0.00 H ATOM 23291 H2 WAT 8403 58.368 29.814 117.211 1.00 0.00 H TER 23293 WAT 8403 ATOM 23293 O WAT 8404 42.009 139.478 107.325 1.00 0.00 O ATOM 23294 H1 WAT 8404 41.458 140.223 107.084 1.00 0.00 H ATOM 23295 H2 WAT 8404 41.677 138.753 106.795 1.00 0.00 H TER 23297 WAT 8404 ATOM 23297 O WAT 8405 47.508 17.543 118.029 1.00 0.00 O ATOM 23298 H1 WAT 8405 48.011 16.908 117.519 1.00 0.00 H ATOM 23299 H2 WAT 8405 47.981 18.367 117.918 1.00 0.00 H TER 23301 WAT 8405 ATOM 23301 O WAT 8406 64.805 25.947 125.613 1.00 0.00 O ATOM 23302 H1 WAT 8406 64.202 25.884 124.872 1.00 0.00 H ATOM 23303 H2 WAT 8406 64.275 25.708 126.374 1.00 0.00 H TER 23305 WAT 8406 ATOM 23305 O WAT 8407 4.032 26.466 102.666 1.00 0.00 O ATOM 23306 H1 WAT 8407 4.703 27.073 102.353 1.00 0.00 H ATOM 23307 H2 WAT 8407 4.514 25.828 103.194 1.00 0.00 H TER 23309 WAT 8407 ATOM 23309 O WAT 8408 112.794 131.285 88.081 1.00 0.00 O ATOM 23310 H1 WAT 8408 112.058 131.870 88.264 1.00 0.00 H ATOM 23311 H2 WAT 8408 113.422 131.465 88.780 1.00 0.00 H TER 23313 WAT 8408 ATOM 23313 O WAT 8409 33.962 92.998 130.563 1.00 0.00 O ATOM 23314 H1 WAT 8409 33.252 92.367 130.675 1.00 0.00 H ATOM 23315 H2 WAT 8409 33.834 93.351 129.683 1.00 0.00 H TER 23317 WAT 8409 ATOM 23317 O WAT 8410 27.893 9.443 83.616 1.00 0.00 O ATOM 23318 H1 WAT 8410 28.040 9.303 82.681 1.00 0.00 H ATOM 23319 H2 WAT 8410 27.476 8.636 83.917 1.00 0.00 H TER 23321 WAT 8410 ATOM 23321 O WAT 8411 138.115 85.977 121.413 1.00 0.00 O ATOM 23322 H1 WAT 8411 137.247 86.277 121.142 1.00 0.00 H ATOM 23323 H2 WAT 8411 138.723 86.549 120.945 1.00 0.00 H TER 23325 WAT 8411 ATOM 23325 O WAT 8412 119.660 13.647 4.948 1.00 0.00 O ATOM 23326 H1 WAT 8412 118.918 14.250 4.913 1.00 0.00 H ATOM 23327 H2 WAT 8412 119.795 13.487 5.883 1.00 0.00 H TER 23329 WAT 8412 ATOM 23329 O WAT 8413 92.851 42.946 97.335 1.00 0.00 O ATOM 23330 H1 WAT 8413 92.226 43.059 96.619 1.00 0.00 H ATOM 23331 H2 WAT 8413 92.640 43.648 97.951 1.00 0.00 H TER 23333 WAT 8413 ATOM 23333 O WAT 8414 47.741 60.490 98.684 1.00 0.00 O ATOM 23334 H1 WAT 8414 48.197 59.656 98.570 1.00 0.00 H ATOM 23335 H2 WAT 8414 47.238 60.601 97.878 1.00 0.00 H TER 23337 WAT 8414 ATOM 23337 O WAT 8415 136.964 93.117 67.158 1.00 0.00 O ATOM 23338 H1 WAT 8415 136.687 93.919 66.715 1.00 0.00 H ATOM 23339 H2 WAT 8415 136.301 92.469 66.916 1.00 0.00 H TER 23341 WAT 8415 ATOM 23341 O WAT 8416 74.078 83.117 70.334 1.00 0.00 O ATOM 23342 H1 WAT 8416 73.239 82.835 69.971 1.00 0.00 H ATOM 23343 H2 WAT 8416 74.309 83.896 69.828 1.00 0.00 H TER 23345 WAT 8416 ATOM 23345 O WAT 8417 49.618 36.896 80.107 1.00 0.00 O ATOM 23346 H1 WAT 8417 48.916 36.925 80.758 1.00 0.00 H ATOM 23347 H2 WAT 8417 50.185 37.632 80.334 1.00 0.00 H TER 23349 WAT 8417 ATOM 23349 O WAT 8418 106.913 49.029 110.508 1.00 0.00 O ATOM 23350 H1 WAT 8418 106.294 49.034 111.238 1.00 0.00 H ATOM 23351 H2 WAT 8418 106.488 49.556 109.831 1.00 0.00 H TER 23353 WAT 8418 ATOM 23353 O WAT 8419 121.377 92.347 76.764 1.00 0.00 O ATOM 23354 H1 WAT 8419 121.534 92.878 77.545 1.00 0.00 H ATOM 23355 H2 WAT 8419 120.493 92.587 76.485 1.00 0.00 H TER 23357 WAT 8419 ATOM 23357 O WAT 8420 23.163 136.800 16.699 1.00 0.00 O ATOM 23358 H1 WAT 8420 24.019 137.069 16.364 1.00 0.00 H ATOM 23359 H2 WAT 8420 23.321 136.595 17.621 1.00 0.00 H TER 23361 WAT 8420 ATOM 23361 O WAT 8421 111.646 15.988 2.914 1.00 0.00 O ATOM 23362 H1 WAT 8421 112.090 15.977 3.762 1.00 0.00 H ATOM 23363 H2 WAT 8421 112.265 16.421 2.325 1.00 0.00 H TER 23365 WAT 8421 ATOM 23365 O WAT 8422 4.601 38.275 97.190 1.00 0.00 O ATOM 23366 H1 WAT 8422 4.202 37.671 97.817 1.00 0.00 H ATOM 23367 H2 WAT 8422 3.859 38.701 96.762 1.00 0.00 H TER 23369 WAT 8422 ATOM 23369 O WAT 8423 104.911 84.578 91.276 1.00 0.00 O ATOM 23370 H1 WAT 8423 104.339 84.156 91.917 1.00 0.00 H ATOM 23371 H2 WAT 8423 105.777 84.568 91.684 1.00 0.00 H TER 23373 WAT 8423 ATOM 23373 O WAT 8424 134.684 4.005 71.024 1.00 0.00 O ATOM 23374 H1 WAT 8424 135.424 4.518 71.349 1.00 0.00 H ATOM 23375 H2 WAT 8424 134.104 4.651 70.620 1.00 0.00 H TER 23377 WAT 8424 ATOM 23377 O WAT 8425 112.875 79.731 108.293 1.00 0.00 O ATOM 23378 H1 WAT 8425 112.432 79.425 107.501 1.00 0.00 H ATOM 23379 H2 WAT 8425 113.303 78.950 108.644 1.00 0.00 H TER 23381 WAT 8425 ATOM 23381 O WAT 8426 115.787 133.351 105.537 1.00 0.00 O ATOM 23382 H1 WAT 8426 115.749 132.432 105.801 1.00 0.00 H ATOM 23383 H2 WAT 8426 116.668 133.462 105.181 1.00 0.00 H TER 23385 WAT 8426 ATOM 23385 O WAT 8427 42.465 36.107 141.903 1.00 0.00 O ATOM 23386 H1 WAT 8427 43.249 35.591 141.717 1.00 0.00 H ATOM 23387 H2 WAT 8427 42.041 36.215 141.051 1.00 0.00 H TER 23389 WAT 8427 ATOM 23389 O WAT 8428 104.436 108.348 13.287 1.00 0.00 O ATOM 23390 H1 WAT 8428 103.795 108.405 13.996 1.00 0.00 H ATOM 23391 H2 WAT 8428 104.724 107.435 13.298 1.00 0.00 H TER 23393 WAT 8428 ATOM 23393 O WAT 8429 132.170 120.180 112.732 1.00 0.00 O ATOM 23394 H1 WAT 8429 132.888 120.617 112.273 1.00 0.00 H ATOM 23395 H2 WAT 8429 131.912 119.467 112.148 1.00 0.00 H TER 23397 WAT 8429 ATOM 23397 O WAT 8430 117.956 114.755 123.822 1.00 0.00 O ATOM 23398 H1 WAT 8430 117.202 114.267 124.151 1.00 0.00 H ATOM 23399 H2 WAT 8430 117.824 114.791 122.875 1.00 0.00 H TER 23401 WAT 8430 ATOM 23401 O WAT 8431 36.600 55.332 62.896 1.00 0.00 O ATOM 23402 H1 WAT 8431 37.000 55.334 62.027 1.00 0.00 H ATOM 23403 H2 WAT 8431 36.296 56.231 63.023 1.00 0.00 H TER 23405 WAT 8431 ATOM 23405 O WAT 8432 95.863 46.507 74.276 1.00 0.00 O ATOM 23406 H1 WAT 8432 96.216 46.356 75.153 1.00 0.00 H ATOM 23407 H2 WAT 8432 95.041 46.015 74.261 1.00 0.00 H TER 23409 WAT 8432 ATOM 23409 O WAT 8433 79.563 40.765 18.941 1.00 0.00 O ATOM 23410 H1 WAT 8433 80.295 40.947 19.530 1.00 0.00 H ATOM 23411 H2 WAT 8433 79.363 39.840 19.086 1.00 0.00 H TER 23413 WAT 8433 ATOM 23413 O WAT 8434 93.777 84.682 29.386 1.00 0.00 O ATOM 23414 H1 WAT 8434 93.403 83.954 28.889 1.00 0.00 H ATOM 23415 H2 WAT 8434 94.337 85.139 28.757 1.00 0.00 H TER 23417 WAT 8434 ATOM 23417 O WAT 8435 28.297 38.321 112.002 1.00 0.00 O ATOM 23418 H1 WAT 8435 28.388 37.403 111.747 1.00 0.00 H ATOM 23419 H2 WAT 8435 28.040 38.288 112.924 1.00 0.00 H TER 23421 WAT 8435 ATOM 23421 O WAT 8436 93.129 32.761 125.134 1.00 0.00 O ATOM 23422 H1 WAT 8436 92.894 32.147 125.830 1.00 0.00 H ATOM 23423 H2 WAT 8436 93.816 33.306 125.517 1.00 0.00 H TER 23425 WAT 8436 ATOM 23425 O WAT 8437 56.160 23.117 116.368 1.00 0.00 O ATOM 23426 H1 WAT 8437 56.378 22.215 116.603 1.00 0.00 H ATOM 23427 H2 WAT 8437 56.921 23.627 116.645 1.00 0.00 H TER 23429 WAT 8437 ATOM 23429 O WAT 8438 128.958 22.997 142.825 1.00 0.00 O ATOM 23430 H1 WAT 8438 128.984 23.235 141.898 1.00 0.00 H ATOM 23431 H2 WAT 8438 129.699 23.464 143.212 1.00 0.00 H TER 23433 WAT 8438 ATOM 23433 O WAT 8439 32.996 90.427 86.302 1.00 0.00 O ATOM 23434 H1 WAT 8439 32.961 91.018 87.054 1.00 0.00 H ATOM 23435 H2 WAT 8439 33.916 90.172 86.240 1.00 0.00 H TER 23437 WAT 8439 ATOM 23437 O WAT 8440 51.115 118.839 154.189 1.00 0.00 O ATOM 23438 H1 WAT 8440 51.826 118.335 153.792 1.00 0.00 H ATOM 23439 H2 WAT 8440 51.228 118.712 155.131 1.00 0.00 H TER 23441 WAT 8440 ATOM 23441 O WAT 8441 51.313 125.027 121.640 1.00 0.00 O ATOM 23442 H1 WAT 8441 50.478 124.938 122.099 1.00 0.00 H ATOM 23443 H2 WAT 8441 51.873 124.355 122.029 1.00 0.00 H TER 23445 WAT 8441 ATOM 23445 O WAT 8442 29.647 120.962 149.809 1.00 0.00 O ATOM 23446 H1 WAT 8442 30.189 120.173 149.833 1.00 0.00 H ATOM 23447 H2 WAT 8442 29.978 121.457 149.059 1.00 0.00 H TER 23449 WAT 8442 ATOM 23449 O WAT 8443 143.875 109.529 116.635 1.00 0.00 O ATOM 23450 H1 WAT 8443 144.119 110.230 116.030 1.00 0.00 H ATOM 23451 H2 WAT 8443 144.709 109.198 116.967 1.00 0.00 H TER 23453 WAT 8443 ATOM 23453 O WAT 8444 1.195 78.932 125.033 1.00 0.00 O ATOM 23454 H1 WAT 8444 1.952 79.453 125.302 1.00 0.00 H ATOM 23455 H2 WAT 8444 0.509 79.167 125.658 1.00 0.00 H TER 23457 WAT 8444 ATOM 23457 O WAT 8445 137.835 77.462 119.068 1.00 0.00 O ATOM 23458 H1 WAT 8445 138.153 77.641 118.183 1.00 0.00 H ATOM 23459 H2 WAT 8445 137.044 76.939 118.937 1.00 0.00 H TER 23461 WAT 8445 ATOM 23461 O WAT 8446 60.050 53.605 4.626 1.00 0.00 O ATOM 23462 H1 WAT 8446 59.290 54.142 4.402 1.00 0.00 H ATOM 23463 H2 WAT 8446 60.242 53.829 5.536 1.00 0.00 H TER 23465 WAT 8446 ATOM 23465 O WAT 8447 63.681 134.515 112.896 1.00 0.00 O ATOM 23466 H1 WAT 8447 64.518 134.952 112.741 1.00 0.00 H ATOM 23467 H2 WAT 8447 63.668 134.349 113.839 1.00 0.00 H TER 23469 WAT 8447 ATOM 23469 O WAT 8448 98.564 2.398 99.671 1.00 0.00 O ATOM 23470 H1 WAT 8448 98.773 1.514 99.367 1.00 0.00 H ATOM 23471 H2 WAT 8448 98.592 2.936 98.880 1.00 0.00 H TER 23473 WAT 8448 ATOM 23473 O WAT 8449 109.059 6.670 124.314 1.00 0.00 O ATOM 23474 H1 WAT 8449 108.350 6.388 123.735 1.00 0.00 H ATOM 23475 H2 WAT 8449 108.918 7.610 124.425 1.00 0.00 H TER 23477 WAT 8449 ATOM 23477 O WAT 8450 104.041 145.525 75.293 1.00 0.00 O ATOM 23478 H1 WAT 8450 104.847 145.645 74.790 1.00 0.00 H ATOM 23479 H2 WAT 8450 104.232 145.909 76.148 1.00 0.00 H TER 23481 WAT 8450 ATOM 23481 O WAT 8451 34.835 10.462 89.379 1.00 0.00 O ATOM 23482 H1 WAT 8451 34.101 10.160 89.914 1.00 0.00 H ATOM 23483 H2 WAT 8451 35.561 9.888 89.622 1.00 0.00 H TER 23485 WAT 8451 ATOM 23485 O WAT 8452 15.636 96.417 148.919 1.00 0.00 O ATOM 23486 H1 WAT 8452 15.991 95.887 148.205 1.00 0.00 H ATOM 23487 H2 WAT 8452 16.369 96.965 149.197 1.00 0.00 H TER 23489 WAT 8452 ATOM 23489 O WAT 8453 6.915 101.501 56.734 1.00 0.00 O ATOM 23490 H1 WAT 8453 7.009 100.567 56.546 1.00 0.00 H ATOM 23491 H2 WAT 8453 6.117 101.561 57.259 1.00 0.00 H TER 23493 WAT 8453 ATOM 23493 O WAT 8454 74.138 111.037 146.643 1.00 0.00 O ATOM 23494 H1 WAT 8454 74.686 110.609 145.985 1.00 0.00 H ATOM 23495 H2 WAT 8454 74.634 110.956 147.458 1.00 0.00 H TER 23497 WAT 8454 ATOM 23497 O WAT 8455 73.514 30.627 65.448 1.00 0.00 O ATOM 23498 H1 WAT 8455 72.981 31.276 64.988 1.00 0.00 H ATOM 23499 H2 WAT 8455 73.869 30.073 64.752 1.00 0.00 H TER 23501 WAT 8455 ATOM 23501 O WAT 8456 45.162 49.287 17.380 1.00 0.00 O ATOM 23502 H1 WAT 8456 44.298 49.323 17.790 1.00 0.00 H ATOM 23503 H2 WAT 8456 45.221 48.401 17.023 1.00 0.00 H TER 23505 WAT 8456 ATOM 23505 O WAT 8457 89.367 55.367 11.608 1.00 0.00 O ATOM 23506 H1 WAT 8457 89.313 54.436 11.823 1.00 0.00 H ATOM 23507 H2 WAT 8457 90.007 55.412 10.897 1.00 0.00 H TER 23509 WAT 8457 ATOM 23509 O WAT 8458 30.798 95.584 74.504 1.00 0.00 O ATOM 23510 H1 WAT 8458 30.202 95.955 75.155 1.00 0.00 H ATOM 23511 H2 WAT 8458 30.754 94.639 74.651 1.00 0.00 H TER 23513 WAT 8458 ATOM 23513 O WAT 8459 48.489 143.230 108.963 1.00 0.00 O ATOM 23514 H1 WAT 8459 48.030 142.440 109.248 1.00 0.00 H ATOM 23515 H2 WAT 8459 49.102 143.421 109.673 1.00 0.00 H TER 23517 WAT 8459 ATOM 23517 O WAT 8460 90.443 68.526 96.160 1.00 0.00 O ATOM 23518 H1 WAT 8460 89.695 68.060 96.535 1.00 0.00 H ATOM 23519 H2 WAT 8460 90.303 68.482 95.215 1.00 0.00 H TER 23521 WAT 8460 ATOM 23521 O WAT 8461 144.774 1.959 20.688 1.00 0.00 O ATOM 23522 H1 WAT 8461 145.653 1.612 20.839 1.00 0.00 H ATOM 23523 H2 WAT 8461 144.629 1.843 19.749 1.00 0.00 H TER 23525 WAT 8461 ATOM 23525 O WAT 8462 118.626 67.821 96.453 1.00 0.00 O ATOM 23526 H1 WAT 8462 117.716 68.106 96.535 1.00 0.00 H ATOM 23527 H2 WAT 8462 119.130 68.490 96.917 1.00 0.00 H TER 23529 WAT 8462 ATOM 23529 O WAT 8463 85.883 25.992 6.415 1.00 0.00 O ATOM 23530 H1 WAT 8463 85.145 25.472 6.735 1.00 0.00 H ATOM 23531 H2 WAT 8463 85.962 26.709 7.043 1.00 0.00 H TER 23533 WAT 8463 ATOM 23533 O WAT 8464 133.252 109.189 150.607 1.00 0.00 O ATOM 23534 H1 WAT 8464 132.981 109.619 149.796 1.00 0.00 H ATOM 23535 H2 WAT 8464 132.832 108.330 150.574 1.00 0.00 H TER 23537 WAT 8464 ATOM 23537 O WAT 8465 122.564 142.894 62.985 1.00 0.00 O ATOM 23538 H1 WAT 8465 123.191 142.512 62.371 1.00 0.00 H ATOM 23539 H2 WAT 8465 121.821 143.152 62.439 1.00 0.00 H TER 23541 WAT 8465 ATOM 23541 O WAT 8466 18.535 45.087 137.667 1.00 0.00 O ATOM 23542 H1 WAT 8466 19.193 44.441 137.410 1.00 0.00 H ATOM 23543 H2 WAT 8466 18.763 45.317 138.567 1.00 0.00 H TER 23545 WAT 8466 ATOM 23545 O WAT 8467 18.292 109.507 17.376 1.00 0.00 O ATOM 23546 H1 WAT 8467 17.827 109.656 18.199 1.00 0.00 H ATOM 23547 H2 WAT 8467 18.946 110.206 17.340 1.00 0.00 H TER 23549 WAT 8467 ATOM 23549 O WAT 8468 48.365 35.738 111.909 1.00 0.00 O ATOM 23550 H1 WAT 8468 48.102 34.818 111.883 1.00 0.00 H ATOM 23551 H2 WAT 8468 47.922 36.135 111.159 1.00 0.00 H TER 23553 WAT 8468 ATOM 23553 O WAT 8469 58.603 64.972 104.430 1.00 0.00 O ATOM 23554 H1 WAT 8469 57.806 65.012 103.902 1.00 0.00 H ATOM 23555 H2 WAT 8469 58.309 65.159 105.322 1.00 0.00 H TER 23557 WAT 8469 ATOM 23557 O WAT 8470 86.262 5.830 99.628 1.00 0.00 O ATOM 23558 H1 WAT 8470 86.279 5.890 98.672 1.00 0.00 H ATOM 23559 H2 WAT 8470 86.378 4.898 99.812 1.00 0.00 H TER 23561 WAT 8470 ATOM 23561 O WAT 8471 10.681 108.806 129.427 1.00 0.00 O ATOM 23562 H1 WAT 8471 10.000 108.362 129.931 1.00 0.00 H ATOM 23563 H2 WAT 8471 11.501 108.527 129.835 1.00 0.00 H TER 23565 WAT 8471 ATOM 23565 O WAT 8472 122.479 32.915 105.462 1.00 0.00 O ATOM 23566 H1 WAT 8472 122.228 33.743 105.054 1.00 0.00 H ATOM 23567 H2 WAT 8472 123.240 32.622 104.960 1.00 0.00 H TER 23569 WAT 8472 ATOM 23569 O WAT 8473 140.482 55.828 112.619 1.00 0.00 O ATOM 23570 H1 WAT 8473 141.152 56.394 112.234 1.00 0.00 H ATOM 23571 H2 WAT 8473 139.821 55.739 111.932 1.00 0.00 H TER 23573 WAT 8473 ATOM 23573 O WAT 8474 116.109 17.993 5.117 1.00 0.00 O ATOM 23574 H1 WAT 8474 116.452 18.273 5.966 1.00 0.00 H ATOM 23575 H2 WAT 8474 115.490 17.293 5.328 1.00 0.00 H TER 23577 WAT 8474 ATOM 23577 O WAT 8475 40.859 39.808 147.218 1.00 0.00 O ATOM 23578 H1 WAT 8475 41.651 40.303 147.007 1.00 0.00 H ATOM 23579 H2 WAT 8475 41.156 39.125 147.819 1.00 0.00 H TER 23581 WAT 8475 ATOM 23581 O WAT 8476 131.000 93.445 105.575 1.00 0.00 O ATOM 23582 H1 WAT 8476 130.234 93.505 106.147 1.00 0.00 H ATOM 23583 H2 WAT 8476 131.556 94.178 105.842 1.00 0.00 H TER 23585 WAT 8476 ATOM 23585 O WAT 8477 127.390 12.167 149.268 1.00 0.00 O ATOM 23586 H1 WAT 8477 128.261 11.975 148.919 1.00 0.00 H ATOM 23587 H2 WAT 8477 126.819 12.164 148.500 1.00 0.00 H TER 23589 WAT 8477 ATOM 23589 O WAT 8478 23.779 99.120 62.030 1.00 0.00 O ATOM 23590 H1 WAT 8478 22.840 99.262 61.914 1.00 0.00 H ATOM 23591 H2 WAT 8478 24.080 98.804 61.178 1.00 0.00 H TER 23593 WAT 8478 ATOM 23593 O WAT 8479 102.141 95.403 76.286 1.00 0.00 O ATOM 23594 H1 WAT 8479 101.859 95.113 75.418 1.00 0.00 H ATOM 23595 H2 WAT 8479 103.088 95.263 76.289 1.00 0.00 H TER 23597 WAT 8479 ATOM 23597 O WAT 8480 1.180 47.609 59.202 1.00 0.00 O ATOM 23598 H1 WAT 8480 0.935 47.191 60.028 1.00 0.00 H ATOM 23599 H2 WAT 8480 0.359 47.957 58.856 1.00 0.00 H TER 23601 WAT 8480 ATOM 23601 O WAT 8481 35.050 44.824 156.710 1.00 0.00 O ATOM 23602 H1 WAT 8481 34.907 43.878 156.692 1.00 0.00 H ATOM 23603 H2 WAT 8481 35.231 45.021 157.629 1.00 0.00 H TER 23605 WAT 8481 ATOM 23605 O WAT 8482 137.083 79.061 13.462 1.00 0.00 O ATOM 23606 H1 WAT 8482 137.511 79.917 13.489 1.00 0.00 H ATOM 23607 H2 WAT 8482 136.219 79.237 13.089 1.00 0.00 H TER 23609 WAT 8482 ATOM 23609 O WAT 8483 79.601 75.588 77.582 1.00 0.00 O ATOM 23610 H1 WAT 8483 80.554 75.494 77.565 1.00 0.00 H ATOM 23611 H2 WAT 8483 79.312 74.967 78.251 1.00 0.00 H TER 23613 WAT 8483 ATOM 23613 O WAT 8484 1.897 116.546 67.206 1.00 0.00 O ATOM 23614 H1 WAT 8484 2.796 116.481 66.885 1.00 0.00 H ATOM 23615 H2 WAT 8484 1.370 116.672 66.417 1.00 0.00 H TER 23617 WAT 8484 ATOM 23617 O WAT 8485 34.160 47.393 130.786 1.00 0.00 O ATOM 23618 H1 WAT 8485 35.005 47.818 130.934 1.00 0.00 H ATOM 23619 H2 WAT 8485 33.585 47.761 131.457 1.00 0.00 H TER 23621 WAT 8485 ATOM 23621 O WAT 8486 120.918 137.333 69.331 1.00 0.00 O ATOM 23622 H1 WAT 8486 120.688 138.193 68.979 1.00 0.00 H ATOM 23623 H2 WAT 8486 120.217 136.756 69.031 1.00 0.00 H TER 23625 WAT 8486 ATOM 23625 O WAT 8487 122.154 77.670 70.388 1.00 0.00 O ATOM 23626 H1 WAT 8487 122.089 78.371 69.739 1.00 0.00 H ATOM 23627 H2 WAT 8487 121.293 77.251 70.375 1.00 0.00 H TER 23629 WAT 8487 ATOM 23629 O WAT 8488 2.754 53.296 72.384 1.00 0.00 O ATOM 23630 H1 WAT 8488 2.730 53.312 71.427 1.00 0.00 H ATOM 23631 H2 WAT 8488 2.075 52.669 72.630 1.00 0.00 H TER 23633 WAT 8488 ATOM 23633 O WAT 8489 28.385 82.306 89.563 1.00 0.00 O ATOM 23634 H1 WAT 8489 27.802 82.795 88.982 1.00 0.00 H ATOM 23635 H2 WAT 8489 27.849 81.584 89.890 1.00 0.00 H TER 23637 WAT 8489 ATOM 23637 O WAT 8490 74.015 47.045 101.462 1.00 0.00 O ATOM 23638 H1 WAT 8490 74.529 47.756 101.844 1.00 0.00 H ATOM 23639 H2 WAT 8490 73.125 47.394 101.409 1.00 0.00 H TER 23641 WAT 8490 ATOM 23641 O WAT 8491 142.497 51.767 142.253 1.00 0.00 O ATOM 23642 H1 WAT 8491 141.891 52.389 142.656 1.00 0.00 H ATOM 23643 H2 WAT 8491 142.045 50.925 142.304 1.00 0.00 H TER 23645 WAT 8491 ATOM 23645 O WAT 8492 100.627 112.520 87.878 1.00 0.00 O ATOM 23646 H1 WAT 8492 101.459 112.451 88.346 1.00 0.00 H ATOM 23647 H2 WAT 8492 100.808 112.154 87.012 1.00 0.00 H TER 23649 WAT 8492 ATOM 23649 O WAT 8493 4.514 106.651 65.029 1.00 0.00 O ATOM 23650 H1 WAT 8493 5.040 107.415 65.269 1.00 0.00 H ATOM 23651 H2 WAT 8493 3.873 106.989 64.404 1.00 0.00 H TER 23653 WAT 8493 ATOM 23653 O WAT 8494 9.930 95.617 96.356 1.00 0.00 O ATOM 23654 H1 WAT 8494 10.116 94.774 95.942 1.00 0.00 H ATOM 23655 H2 WAT 8494 9.871 95.416 97.291 1.00 0.00 H TER 23657 WAT 8494 ATOM 23657 O WAT 8495 99.580 10.812 65.355 1.00 0.00 O ATOM 23658 H1 WAT 8495 100.510 10.618 65.474 1.00 0.00 H ATOM 23659 H2 WAT 8495 99.327 10.310 64.580 1.00 0.00 H TER 23661 WAT 8495 ATOM 23661 O WAT 8496 12.312 131.945 134.593 1.00 0.00 O ATOM 23662 H1 WAT 8496 12.363 132.901 134.601 1.00 0.00 H ATOM 23663 H2 WAT 8496 11.374 131.756 134.563 1.00 0.00 H TER 23665 WAT 8496 ATOM 23665 O WAT 8497 52.057 2.262 60.636 1.00 0.00 O ATOM 23666 H1 WAT 8497 51.126 2.061 60.546 1.00 0.00 H ATOM 23667 H2 WAT 8497 52.285 2.713 59.823 1.00 0.00 H TER 23669 WAT 8497 ATOM 23669 O WAT 8498 48.400 76.207 22.835 1.00 0.00 O ATOM 23670 H1 WAT 8498 48.591 75.280 22.693 1.00 0.00 H ATOM 23671 H2 WAT 8498 48.318 76.572 21.954 1.00 0.00 H TER 23673 WAT 8498 ATOM 23673 O WAT 8499 145.154 24.600 130.290 1.00 0.00 O ATOM 23674 H1 WAT 8499 145.636 24.171 129.583 1.00 0.00 H ATOM 23675 H2 WAT 8499 144.929 25.461 129.938 1.00 0.00 H TER 23677 WAT 8499 ATOM 23677 O WAT 8500 98.077 138.483 8.331 1.00 0.00 O ATOM 23678 H1 WAT 8500 98.600 139.255 8.546 1.00 0.00 H ATOM 23679 H2 WAT 8500 97.332 138.827 7.839 1.00 0.00 H TER 23681 WAT 8500 ATOM 23681 O WAT 8501 22.549 141.387 84.255 1.00 0.00 O ATOM 23682 H1 WAT 8501 22.773 141.999 83.554 1.00 0.00 H ATOM 23683 H2 WAT 8501 21.611 141.516 84.395 1.00 0.00 H TER 23685 WAT 8501 ATOM 23685 O WAT 8502 5.101 137.218 65.020 1.00 0.00 O ATOM 23686 H1 WAT 8502 5.909 137.611 64.689 1.00 0.00 H ATOM 23687 H2 WAT 8502 5.196 136.284 64.834 1.00 0.00 H TER 23689 WAT 8502 ATOM 23689 O WAT 8503 55.630 1.611 5.593 1.00 0.00 O ATOM 23690 H1 WAT 8503 55.835 1.983 6.451 1.00 0.00 H ATOM 23691 H2 WAT 8503 54.917 0.996 5.763 1.00 0.00 H TER 23693 WAT 8503 ATOM 23693 O WAT 8504 71.426 93.844 60.480 1.00 0.00 O ATOM 23694 H1 WAT 8504 72.278 93.883 60.047 1.00 0.00 H ATOM 23695 H2 WAT 8504 70.951 94.604 60.143 1.00 0.00 H TER 23697 WAT 8504 ATOM 23697 O WAT 8505 53.753 27.898 131.983 1.00 0.00 O ATOM 23698 H1 WAT 8505 53.726 27.165 131.368 1.00 0.00 H ATOM 23699 H2 WAT 8505 53.478 27.521 132.818 1.00 0.00 H TER 23701 WAT 8505 ATOM 23701 O WAT 8506 94.925 127.907 65.348 1.00 0.00 O ATOM 23702 H1 WAT 8506 95.396 128.351 64.643 1.00 0.00 H ATOM 23703 H2 WAT 8506 95.472 128.040 66.122 1.00 0.00 H TER 23705 WAT 8506 ATOM 23705 O WAT 8507 55.735 136.849 13.611 1.00 0.00 O ATOM 23706 H1 WAT 8507 55.934 137.427 14.348 1.00 0.00 H ATOM 23707 H2 WAT 8507 56.590 136.620 13.247 1.00 0.00 H TER 23709 WAT 8507 ATOM 23709 O WAT 8508 55.930 117.831 58.367 1.00 0.00 O ATOM 23710 H1 WAT 8508 55.037 118.000 58.666 1.00 0.00 H ATOM 23711 H2 WAT 8508 56.466 118.467 58.840 1.00 0.00 H TER 23713 WAT 8508 ATOM 23713 O WAT 8509 45.037 145.523 69.611 1.00 0.00 O ATOM 23714 H1 WAT 8509 45.956 145.676 69.828 1.00 0.00 H ATOM 23715 H2 WAT 8509 45.027 144.656 69.207 1.00 0.00 H TER 23717 WAT 8509 ATOM 23717 O WAT 8510 103.737 145.336 10.979 1.00 0.00 O ATOM 23718 H1 WAT 8510 103.403 146.227 10.875 1.00 0.00 H ATOM 23719 H2 WAT 8510 104.679 145.415 10.830 1.00 0.00 H TER 23721 WAT 8510 ATOM 23721 O WAT 8511 40.454 143.192 134.807 1.00 0.00 O ATOM 23722 H1 WAT 8511 41.395 143.031 134.871 1.00 0.00 H ATOM 23723 H2 WAT 8511 40.379 144.143 134.727 1.00 0.00 H TER 23725 WAT 8511 ATOM 23725 O WAT 8512 123.183 75.251 87.353 1.00 0.00 O ATOM 23726 H1 WAT 8512 123.192 74.350 87.675 1.00 0.00 H ATOM 23727 H2 WAT 8512 124.107 75.477 87.248 1.00 0.00 H TER 23729 WAT 8512 ATOM 23729 O WAT 8513 47.087 53.215 131.463 1.00 0.00 O ATOM 23730 H1 WAT 8513 47.353 52.598 132.145 1.00 0.00 H ATOM 23731 H2 WAT 8513 46.180 52.979 131.267 1.00 0.00 H TER 23733 WAT 8513 ATOM 23733 O WAT 8514 41.072 110.624 19.766 1.00 0.00 O ATOM 23734 H1 WAT 8514 41.988 110.381 19.637 1.00 0.00 H ATOM 23735 H2 WAT 8514 41.102 111.353 20.385 1.00 0.00 H TER 23737 WAT 8514 ATOM 23737 O WAT 8515 70.348 19.101 58.908 1.00 0.00 O ATOM 23738 H1 WAT 8515 70.788 18.767 59.690 1.00 0.00 H ATOM 23739 H2 WAT 8515 70.043 19.973 59.159 1.00 0.00 H TER 23741 WAT 8515 ATOM 23741 O WAT 8516 15.396 74.246 149.448 1.00 0.00 O ATOM 23742 H1 WAT 8516 15.719 73.482 148.969 1.00 0.00 H ATOM 23743 H2 WAT 8516 14.534 73.980 149.769 1.00 0.00 H TER 23745 WAT 8516 ATOM 23745 O WAT 8517 99.320 122.135 120.346 1.00 0.00 O ATOM 23746 H1 WAT 8517 99.981 121.524 120.021 1.00 0.00 H ATOM 23747 H2 WAT 8517 99.005 121.738 121.158 1.00 0.00 H TER 23749 WAT 8517 ATOM 23749 O WAT 8518 66.792 78.954 73.296 1.00 0.00 O ATOM 23750 H1 WAT 8518 66.281 79.580 73.809 1.00 0.00 H ATOM 23751 H2 WAT 8518 67.694 79.269 73.364 1.00 0.00 H TER 23753 WAT 8518 ATOM 23753 O WAT 8519 135.567 31.826 94.445 1.00 0.00 O ATOM 23754 H1 WAT 8519 135.703 31.008 93.967 1.00 0.00 H ATOM 23755 H2 WAT 8519 136.030 32.485 93.928 1.00 0.00 H TER 23757 WAT 8519 ATOM 23757 O WAT 8520 133.674 140.902 113.674 1.00 0.00 O ATOM 23758 H1 WAT 8520 133.436 141.075 114.585 1.00 0.00 H ATOM 23759 H2 WAT 8520 134.631 140.934 113.666 1.00 0.00 H TER 23761 WAT 8520 ATOM 23761 O WAT 8521 75.607 51.399 117.939 1.00 0.00 O ATOM 23762 H1 WAT 8521 76.315 50.814 117.670 1.00 0.00 H ATOM 23763 H2 WAT 8521 75.743 51.523 118.878 1.00 0.00 H TER 23765 WAT 8521 ATOM 23765 O WAT 8522 83.902 40.371 59.998 1.00 0.00 O ATOM 23766 H1 WAT 8522 84.294 40.859 59.274 1.00 0.00 H ATOM 23767 H2 WAT 8522 82.960 40.417 59.835 1.00 0.00 H TER 23769 WAT 8522 ATOM 23769 O WAT 8523 143.052 85.045 153.783 1.00 0.00 O ATOM 23770 H1 WAT 8523 143.625 85.794 153.949 1.00 0.00 H ATOM 23771 H2 WAT 8523 142.226 85.435 153.496 1.00 0.00 H TER 23773 WAT 8523 ATOM 23773 O WAT 8524 138.514 103.316 17.272 1.00 0.00 O ATOM 23774 H1 WAT 8524 137.868 103.674 17.881 1.00 0.00 H ATOM 23775 H2 WAT 8524 139.282 103.138 17.816 1.00 0.00 H TER 23777 WAT 8524 ATOM 23777 O WAT 8525 18.848 110.247 11.401 1.00 0.00 O ATOM 23778 H1 WAT 8525 19.305 109.429 11.598 1.00 0.00 H ATOM 23779 H2 WAT 8525 19.311 110.909 11.915 1.00 0.00 H TER 23781 WAT 8525 ATOM 23781 O WAT 8526 44.376 86.715 157.440 1.00 0.00 O ATOM 23782 H1 WAT 8526 44.587 86.862 158.362 1.00 0.00 H ATOM 23783 H2 WAT 8526 45.226 86.593 157.017 1.00 0.00 H TER 23785 WAT 8526 ATOM 23785 O WAT 8527 56.014 21.131 105.069 1.00 0.00 O ATOM 23786 H1 WAT 8527 56.015 21.472 105.963 1.00 0.00 H ATOM 23787 H2 WAT 8527 55.220 20.598 105.017 1.00 0.00 H TER 23789 WAT 8527 ATOM 23789 O WAT 8528 31.378 49.340 10.022 1.00 0.00 O ATOM 23790 H1 WAT 8528 32.303 49.509 9.844 1.00 0.00 H ATOM 23791 H2 WAT 8528 31.023 49.047 9.183 1.00 0.00 H TER 23793 WAT 8528 ATOM 23793 O WAT 8529 123.860 70.119 147.047 1.00 0.00 O ATOM 23794 H1 WAT 8529 124.399 69.353 147.246 1.00 0.00 H ATOM 23795 H2 WAT 8529 122.964 69.784 147.032 1.00 0.00 H TER 23797 WAT 8529 ATOM 23797 O WAT 8530 88.489 68.610 72.064 1.00 0.00 O ATOM 23798 H1 WAT 8530 88.558 67.657 72.002 1.00 0.00 H ATOM 23799 H2 WAT 8530 89.232 68.937 71.557 1.00 0.00 H TER 23801 WAT 8530 ATOM 23801 O WAT 8531 121.198 136.227 65.774 1.00 0.00 O ATOM 23802 H1 WAT 8531 121.725 135.611 66.282 1.00 0.00 H ATOM 23803 H2 WAT 8531 120.404 136.350 66.295 1.00 0.00 H TER 23805 WAT 8531 ATOM 23805 O WAT 8532 19.640 81.678 115.739 1.00 0.00 O ATOM 23806 H1 WAT 8532 19.108 82.000 116.467 1.00 0.00 H ATOM 23807 H2 WAT 8532 20.006 80.853 116.056 1.00 0.00 H TER 23809 WAT 8532 ATOM 23809 O WAT 8533 31.064 58.176 110.961 1.00 0.00 O ATOM 23810 H1 WAT 8533 30.680 58.689 111.672 1.00 0.00 H ATOM 23811 H2 WAT 8533 30.846 58.666 110.168 1.00 0.00 H TER 23813 WAT 8533 ATOM 23813 O WAT 8534 85.238 66.487 138.060 1.00 0.00 O ATOM 23814 H1 WAT 8534 85.624 66.710 138.907 1.00 0.00 H ATOM 23815 H2 WAT 8534 85.647 67.095 137.444 1.00 0.00 H TER 23817 WAT 8534 ATOM 23817 O WAT 8535 74.768 1.926 118.111 1.00 0.00 O ATOM 23818 H1 WAT 8535 74.926 1.949 117.167 1.00 0.00 H ATOM 23819 H2 WAT 8535 75.095 2.768 118.430 1.00 0.00 H TER 23821 WAT 8535 ATOM 23821 O WAT 8536 108.764 90.295 125.543 1.00 0.00 O ATOM 23822 H1 WAT 8536 108.054 90.795 125.947 1.00 0.00 H ATOM 23823 H2 WAT 8536 109.157 90.902 124.916 1.00 0.00 H TER 23825 WAT 8536 ATOM 23825 O WAT 8537 4.966 64.528 91.022 1.00 0.00 O ATOM 23826 H1 WAT 8537 4.862 63.672 91.439 1.00 0.00 H ATOM 23827 H2 WAT 8537 4.797 65.158 91.722 1.00 0.00 H TER 23829 WAT 8537 ATOM 23829 O WAT 8538 113.716 80.167 111.368 1.00 0.00 O ATOM 23830 H1 WAT 8538 113.044 80.742 111.735 1.00 0.00 H ATOM 23831 H2 WAT 8538 114.527 80.442 111.795 1.00 0.00 H TER 23833 WAT 8538 ATOM 23833 O WAT 8539 118.032 142.235 77.863 1.00 0.00 O ATOM 23834 H1 WAT 8539 118.189 142.589 78.738 1.00 0.00 H ATOM 23835 H2 WAT 8539 118.666 141.523 77.776 1.00 0.00 H TER 23837 WAT 8539 ATOM 23837 O WAT 8540 95.283 26.571 102.121 1.00 0.00 O ATOM 23838 H1 WAT 8540 95.565 26.737 101.222 1.00 0.00 H ATOM 23839 H2 WAT 8540 95.386 25.626 102.235 1.00 0.00 H TER 23841 WAT 8540 ATOM 23841 O WAT 8541 106.814 13.706 16.019 1.00 0.00 O ATOM 23842 H1 WAT 8541 106.130 14.346 15.817 1.00 0.00 H ATOM 23843 H2 WAT 8541 107.509 13.891 15.388 1.00 0.00 H TER 23845 WAT 8541 ATOM 23845 O WAT 8542 26.544 113.301 93.423 1.00 0.00 O ATOM 23846 H1 WAT 8542 26.163 112.993 94.245 1.00 0.00 H ATOM 23847 H2 WAT 8542 26.259 112.660 92.772 1.00 0.00 H TER 23849 WAT 8542 ATOM 23849 O WAT 8543 64.040 25.537 112.885 1.00 0.00 O ATOM 23850 H1 WAT 8543 63.824 26.044 112.102 1.00 0.00 H ATOM 23851 H2 WAT 8543 63.987 24.624 112.600 1.00 0.00 H TER 23853 WAT 8543 ATOM 23853 O WAT 8544 48.414 35.507 5.097 1.00 0.00 O ATOM 23854 H1 WAT 8544 49.264 35.929 5.225 1.00 0.00 H ATOM 23855 H2 WAT 8544 47.783 36.226 5.123 1.00 0.00 H TER 23857 WAT 8544 ATOM 23857 O WAT 8545 9.264 40.915 86.451 1.00 0.00 O ATOM 23858 H1 WAT 8545 8.328 40.724 86.400 1.00 0.00 H ATOM 23859 H2 WAT 8545 9.611 40.256 87.053 1.00 0.00 H TER 23861 WAT 8545 ATOM 23861 O WAT 8546 16.644 76.787 25.799 1.00 0.00 O ATOM 23862 H1 WAT 8546 16.199 77.038 26.608 1.00 0.00 H ATOM 23863 H2 WAT 8546 16.955 75.896 25.963 1.00 0.00 H TER 23865 WAT 8546 ATOM 23865 O WAT 8547 107.108 104.629 146.670 1.00 0.00 O ATOM 23866 H1 WAT 8547 107.659 104.702 147.449 1.00 0.00 H ATOM 23867 H2 WAT 8547 107.713 104.734 145.936 1.00 0.00 H TER 23869 WAT 8547 ATOM 23869 O WAT 8548 51.393 12.759 64.660 1.00 0.00 O ATOM 23870 H1 WAT 8548 50.708 12.232 64.250 1.00 0.00 H ATOM 23871 H2 WAT 8548 51.870 12.142 65.216 1.00 0.00 H TER 23873 WAT 8548 ATOM 23873 O WAT 8549 120.963 45.784 55.434 1.00 0.00 O ATOM 23874 H1 WAT 8549 121.489 45.930 56.220 1.00 0.00 H ATOM 23875 H2 WAT 8549 120.368 45.073 55.672 1.00 0.00 H TER 23877 WAT 8549 ATOM 23877 O WAT 8550 117.238 111.504 108.623 1.00 0.00 O ATOM 23878 H1 WAT 8550 117.055 112.096 107.894 1.00 0.00 H ATOM 23879 H2 WAT 8550 117.174 112.056 109.403 1.00 0.00 H TER 23881 WAT 8550 ATOM 23881 O WAT 8551 55.331 30.132 105.769 1.00 0.00 O ATOM 23882 H1 WAT 8551 55.506 29.302 105.324 1.00 0.00 H ATOM 23883 H2 WAT 8551 54.382 30.140 105.894 1.00 0.00 H TER 23885 WAT 8551 ATOM 23885 O WAT 8552 25.729 87.226 67.400 1.00 0.00 O ATOM 23886 H1 WAT 8552 25.384 88.087 67.165 1.00 0.00 H ATOM 23887 H2 WAT 8552 25.165 86.928 68.114 1.00 0.00 H TER 23889 WAT 8552 ATOM 23889 O WAT 8553 30.804 85.929 107.047 1.00 0.00 O ATOM 23890 H1 WAT 8553 30.331 86.724 106.803 1.00 0.00 H ATOM 23891 H2 WAT 8553 31.715 86.210 107.137 1.00 0.00 H TER 23893 WAT 8553 ATOM 23893 O WAT 8554 49.991 72.434 63.242 1.00 0.00 O ATOM 23894 H1 WAT 8554 49.041 72.323 63.235 1.00 0.00 H ATOM 23895 H2 WAT 8554 50.316 71.764 62.641 1.00 0.00 H TER 23897 WAT 8554 ATOM 23897 O WAT 8555 27.595 40.647 123.605 1.00 0.00 O ATOM 23898 H1 WAT 8555 27.906 40.707 124.508 1.00 0.00 H ATOM 23899 H2 WAT 8555 28.146 41.262 123.120 1.00 0.00 H TER 23901 WAT 8555 ATOM 23901 O WAT 8556 106.715 140.389 137.064 1.00 0.00 O ATOM 23902 H1 WAT 8556 107.404 140.131 137.676 1.00 0.00 H ATOM 23903 H2 WAT 8556 106.277 139.569 136.837 1.00 0.00 H TER 23905 WAT 8556 ATOM 23905 O WAT 8557 43.802 5.461 127.005 1.00 0.00 O ATOM 23906 H1 WAT 8557 42.958 5.865 126.804 1.00 0.00 H ATOM 23907 H2 WAT 8557 44.142 5.179 126.155 1.00 0.00 H TER 23909 WAT 8557 ATOM 23909 O WAT 8558 76.425 10.887 82.143 1.00 0.00 O ATOM 23910 H1 WAT 8558 75.844 10.595 82.845 1.00 0.00 H ATOM 23911 H2 WAT 8558 77.135 10.244 82.138 1.00 0.00 H TER 23913 WAT 8558 ATOM 23913 O WAT 8559 8.208 2.836 77.886 1.00 0.00 O ATOM 23914 H1 WAT 8559 7.949 3.514 78.510 1.00 0.00 H ATOM 23915 H2 WAT 8559 8.894 2.344 78.337 1.00 0.00 H TER 23917 WAT 8559 ATOM 23917 O WAT 8560 111.745 46.669 3.086 1.00 0.00 O ATOM 23918 H1 WAT 8560 111.190 47.255 2.571 1.00 0.00 H ATOM 23919 H2 WAT 8560 112.599 47.102 3.103 1.00 0.00 H TER 23921 WAT 8560 ATOM 23921 O WAT 8561 84.224 37.975 12.169 1.00 0.00 O ATOM 23922 H1 WAT 8561 84.874 37.526 12.711 1.00 0.00 H ATOM 23923 H2 WAT 8561 84.475 37.763 11.270 1.00 0.00 H TER 23925 WAT 8561 ATOM 23925 O WAT 8562 141.620 56.475 20.262 1.00 0.00 O ATOM 23926 H1 WAT 8562 141.143 55.676 20.036 1.00 0.00 H ATOM 23927 H2 WAT 8562 141.292 56.713 21.129 1.00 0.00 H TER 23929 WAT 8562 ATOM 23929 O WAT 8563 92.137 3.142 74.408 1.00 0.00 O ATOM 23930 H1 WAT 8563 92.327 4.052 74.181 1.00 0.00 H ATOM 23931 H2 WAT 8563 92.446 2.638 73.655 1.00 0.00 H TER 23933 WAT 8563 ATOM 23933 O WAT 8564 145.494 122.261 98.441 1.00 0.00 O ATOM 23934 H1 WAT 8564 145.095 121.520 97.985 1.00 0.00 H ATOM 23935 H2 WAT 8564 144.771 122.874 98.578 1.00 0.00 H TER 23937 WAT 8564 ATOM 23937 O WAT 8565 100.205 50.017 16.179 1.00 0.00 O ATOM 23938 H1 WAT 8565 100.880 49.461 15.791 1.00 0.00 H ATOM 23939 H2 WAT 8565 99.744 49.443 16.791 1.00 0.00 H TER 23941 WAT 8565 ATOM 23941 O WAT 8566 44.829 128.400 143.823 1.00 0.00 O ATOM 23942 H1 WAT 8566 45.598 128.586 144.362 1.00 0.00 H ATOM 23943 H2 WAT 8566 44.967 128.910 143.025 1.00 0.00 H TER 23945 WAT 8566 ATOM 23945 O WAT 8567 14.692 81.501 92.644 1.00 0.00 O ATOM 23946 H1 WAT 8567 14.977 80.894 93.327 1.00 0.00 H ATOM 23947 H2 WAT 8567 14.016 81.021 92.165 1.00 0.00 H TER 23949 WAT 8567 ATOM 23949 O WAT 8568 101.778 40.042 125.604 1.00 0.00 O ATOM 23950 H1 WAT 8568 101.141 39.377 125.340 1.00 0.00 H ATOM 23951 H2 WAT 8568 101.982 39.830 126.515 1.00 0.00 H TER 23953 WAT 8568 ATOM 23953 O WAT 8569 139.190 139.782 137.682 1.00 0.00 O ATOM 23954 H1 WAT 8569 138.544 140.303 137.205 1.00 0.00 H ATOM 23955 H2 WAT 8569 139.002 138.878 137.430 1.00 0.00 H TER 23957 WAT 8569 ATOM 23957 O WAT 8570 131.829 75.901 1.156 1.00 0.00 O ATOM 23958 H1 WAT 8570 132.256 76.480 0.525 1.00 0.00 H ATOM 23959 H2 WAT 8570 131.348 76.492 1.736 1.00 0.00 H TER 23961 WAT 8570 ATOM 23961 O WAT 8571 23.044 90.252 11.216 1.00 0.00 O ATOM 23962 H1 WAT 8571 23.490 90.456 12.038 1.00 0.00 H ATOM 23963 H2 WAT 8571 23.325 90.941 10.614 1.00 0.00 H TER 23965 WAT 8571 ATOM 23965 O WAT 8572 11.438 92.521 88.487 1.00 0.00 O ATOM 23966 H1 WAT 8572 11.568 92.337 87.556 1.00 0.00 H ATOM 23967 H2 WAT 8572 11.903 93.344 88.636 1.00 0.00 H TER 23969 WAT 8572 ATOM 23969 O WAT 8573 80.083 46.764 66.949 1.00 0.00 O ATOM 23970 H1 WAT 8573 80.429 47.569 67.334 1.00 0.00 H ATOM 23971 H2 WAT 8573 80.219 46.098 67.622 1.00 0.00 H TER 23973 WAT 8573 ATOM 23973 O WAT 8574 81.624 55.618 71.556 1.00 0.00 O ATOM 23974 H1 WAT 8574 81.889 55.614 72.476 1.00 0.00 H ATOM 23975 H2 WAT 8574 82.395 55.938 71.087 1.00 0.00 H TER 23977 WAT 8574 ATOM 23977 O WAT 8575 91.175 78.443 96.176 1.00 0.00 O ATOM 23978 H1 WAT 8575 90.732 79.042 96.778 1.00 0.00 H ATOM 23979 H2 WAT 8575 90.469 77.919 95.798 1.00 0.00 H TER 23981 WAT 8575 ATOM 23981 O WAT 8576 47.589 76.717 117.078 1.00 0.00 O ATOM 23982 H1 WAT 8576 47.387 77.264 117.837 1.00 0.00 H ATOM 23983 H2 WAT 8576 46.956 76.000 117.124 1.00 0.00 H TER 23985 WAT 8576 ATOM 23985 O WAT 8577 105.692 59.625 132.216 1.00 0.00 O ATOM 23986 H1 WAT 8577 105.748 60.371 132.812 1.00 0.00 H ATOM 23987 H2 WAT 8577 106.222 58.945 132.632 1.00 0.00 H TER 23989 WAT 8577 ATOM 23989 O WAT 8578 120.997 57.519 17.737 1.00 0.00 O ATOM 23990 H1 WAT 8578 120.163 57.970 17.605 1.00 0.00 H ATOM 23991 H2 WAT 8578 121.503 58.110 18.294 1.00 0.00 H TER 23993 WAT 8578 ATOM 23993 O WAT 8579 68.462 8.810 4.078 1.00 0.00 O ATOM 23994 H1 WAT 8579 68.627 8.691 5.014 1.00 0.00 H ATOM 23995 H2 WAT 8579 67.724 8.230 3.890 1.00 0.00 H TER 23997 WAT 8579 ATOM 23997 O WAT 8580 23.726 111.963 6.283 1.00 0.00 O ATOM 23998 H1 WAT 8580 24.239 112.195 7.057 1.00 0.00 H ATOM 23999 H2 WAT 8580 23.534 112.802 5.863 1.00 0.00 H TER 24001 WAT 8580 ATOM 24001 O WAT 8581 44.492 124.605 151.019 1.00 0.00 O ATOM 24002 H1 WAT 8581 43.775 125.233 150.935 1.00 0.00 H ATOM 24003 H2 WAT 8581 45.180 124.949 150.450 1.00 0.00 H TER 24005 WAT 8581 ATOM 24005 O WAT 8582 25.173 107.943 71.274 1.00 0.00 O ATOM 24006 H1 WAT 8582 25.778 107.338 70.845 1.00 0.00 H ATOM 24007 H2 WAT 8582 24.565 108.203 70.583 1.00 0.00 H TER 24009 WAT 8582 ATOM 24009 O WAT 8583 22.732 108.393 90.325 1.00 0.00 O ATOM 24010 H1 WAT 8583 22.682 108.264 89.377 1.00 0.00 H ATOM 24011 H2 WAT 8583 22.157 109.139 90.496 1.00 0.00 H TER 24013 WAT 8583 ATOM 24013 O WAT 8584 73.740 71.514 20.669 1.00 0.00 O ATOM 24014 H1 WAT 8584 73.933 71.181 21.546 1.00 0.00 H ATOM 24015 H2 WAT 8584 73.440 72.411 20.814 1.00 0.00 H TER 24017 WAT 8584 ATOM 24017 O WAT 8585 39.372 134.953 56.871 1.00 0.00 O ATOM 24018 H1 WAT 8585 38.421 135.059 56.844 1.00 0.00 H ATOM 24019 H2 WAT 8585 39.504 134.055 57.178 1.00 0.00 H TER 24021 WAT 8585 ATOM 24021 O WAT 8586 75.662 27.703 9.894 1.00 0.00 O ATOM 24022 H1 WAT 8586 75.228 26.879 9.673 1.00 0.00 H ATOM 24023 H2 WAT 8586 75.861 27.626 10.828 1.00 0.00 H TER 24025 WAT 8586 ATOM 24025 O WAT 8587 58.378 128.835 86.311 1.00 0.00 O ATOM 24026 H1 WAT 8587 58.623 129.623 85.826 1.00 0.00 H ATOM 24027 H2 WAT 8587 57.438 128.931 86.463 1.00 0.00 H TER 24029 WAT 8587 ATOM 24029 O WAT 8588 2.948 43.580 94.195 1.00 0.00 O ATOM 24030 H1 WAT 8588 3.459 42.825 94.488 1.00 0.00 H ATOM 24031 H2 WAT 8588 3.536 44.326 94.312 1.00 0.00 H TER 24033 WAT 8588 ATOM 24033 O WAT 8589 137.475 33.789 93.575 1.00 0.00 O ATOM 24034 H1 WAT 8589 138.125 33.892 94.270 1.00 0.00 H ATOM 24035 H2 WAT 8589 137.993 33.711 92.773 1.00 0.00 H TER 24037 WAT 8589 ATOM 24037 O WAT 8590 30.969 58.699 124.044 1.00 0.00 O ATOM 24038 H1 WAT 8590 30.404 59.207 123.462 1.00 0.00 H ATOM 24039 H2 WAT 8590 31.233 57.943 123.520 1.00 0.00 H TER 24041 WAT 8590 ATOM 24041 O WAT 8591 59.616 4.796 58.972 1.00 0.00 O ATOM 24042 H1 WAT 8591 58.982 4.418 58.363 1.00 0.00 H ATOM 24043 H2 WAT 8591 59.214 5.617 59.258 1.00 0.00 H TER 24045 WAT 8591 ATOM 24045 O WAT 8592 112.394 129.690 84.141 1.00 0.00 O ATOM 24046 H1 WAT 8592 111.964 129.617 84.992 1.00 0.00 H ATOM 24047 H2 WAT 8592 111.683 129.604 83.505 1.00 0.00 H TER 24049 WAT 8592 ATOM 24049 O WAT 8593 64.241 51.515 24.247 1.00 0.00 O ATOM 24050 H1 WAT 8593 63.847 51.331 25.100 1.00 0.00 H ATOM 24051 H2 WAT 8593 64.384 50.652 23.858 1.00 0.00 H TER 24053 WAT 8593 ATOM 24053 O WAT 8594 80.127 68.028 96.418 1.00 0.00 O ATOM 24054 H1 WAT 8594 80.732 67.357 96.733 1.00 0.00 H ATOM 24055 H2 WAT 8594 79.894 67.744 95.534 1.00 0.00 H TER 24057 WAT 8594 ATOM 24057 O WAT 8595 15.184 121.059 6.160 1.00 0.00 O ATOM 24058 H1 WAT 8595 14.755 121.885 5.936 1.00 0.00 H ATOM 24059 H2 WAT 8595 15.617 121.233 6.996 1.00 0.00 H TER 24061 WAT 8595 ATOM 24061 O WAT 8596 50.388 53.160 121.224 1.00 0.00 O ATOM 24062 H1 WAT 8596 49.808 52.940 121.953 1.00 0.00 H ATOM 24063 H2 WAT 8596 51.243 53.299 121.633 1.00 0.00 H TER 24065 WAT 8596 ATOM 24065 O WAT 8597 89.208 75.150 106.371 1.00 0.00 O ATOM 24066 H1 WAT 8597 88.448 75.581 105.979 1.00 0.00 H ATOM 24067 H2 WAT 8597 88.999 74.217 106.333 1.00 0.00 H TER 24069 WAT 8597 ATOM 24069 O WAT 8598 60.156 96.552 62.607 1.00 0.00 O ATOM 24070 H1 WAT 8598 60.672 97.183 63.108 1.00 0.00 H ATOM 24071 H2 WAT 8598 59.739 96.002 63.271 1.00 0.00 H TER 24073 WAT 8598 ATOM 24073 O WAT 8599 67.955 3.472 153.779 1.00 0.00 O ATOM 24074 H1 WAT 8599 68.601 3.031 154.332 1.00 0.00 H ATOM 24075 H2 WAT 8599 67.938 4.372 154.104 1.00 0.00 H TER 24077 WAT 8599 ATOM 24077 O WAT 8600 102.015 125.542 9.757 1.00 0.00 O ATOM 24078 H1 WAT 8600 102.240 126.297 9.214 1.00 0.00 H ATOM 24079 H2 WAT 8600 102.581 125.622 10.525 1.00 0.00 H TER 24081 WAT 8600 ATOM 24081 O WAT 8601 121.407 37.834 115.107 1.00 0.00 O ATOM 24082 H1 WAT 8601 120.932 37.014 115.242 1.00 0.00 H ATOM 24083 H2 WAT 8601 121.817 38.015 115.953 1.00 0.00 H TER 24085 WAT 8601 ATOM 24085 O WAT 8602 107.569 97.120 155.197 1.00 0.00 O ATOM 24086 H1 WAT 8602 107.321 96.364 154.665 1.00 0.00 H ATOM 24087 H2 WAT 8602 107.157 97.866 154.760 1.00 0.00 H TER 24089 WAT 8602 ATOM 24089 O WAT 8603 84.008 101.807 92.749 1.00 0.00 O ATOM 24090 H1 WAT 8603 84.832 101.433 93.063 1.00 0.00 H ATOM 24091 H2 WAT 8603 83.572 101.082 92.301 1.00 0.00 H TER 24093 WAT 8603 ATOM 24093 O WAT 8604 55.844 1.313 108.451 1.00 0.00 O ATOM 24094 H1 WAT 8604 54.966 1.022 108.695 1.00 0.00 H ATOM 24095 H2 WAT 8604 56.111 1.895 109.163 1.00 0.00 H TER 24097 WAT 8604 ATOM 24097 O WAT 8605 39.664 61.901 130.554 1.00 0.00 O ATOM 24098 H1 WAT 8605 39.419 61.051 130.188 1.00 0.00 H ATOM 24099 H2 WAT 8605 40.016 62.390 129.810 1.00 0.00 H TER 24101 WAT 8605 ATOM 24101 O WAT 8606 137.372 71.297 84.699 1.00 0.00 O ATOM 24102 H1 WAT 8606 137.287 72.103 85.208 1.00 0.00 H ATOM 24103 H2 WAT 8606 138.195 70.911 84.998 1.00 0.00 H TER 24105 WAT 8606 ATOM 24105 O WAT 8607 15.313 72.886 69.201 1.00 0.00 O ATOM 24106 H1 WAT 8607 15.464 72.203 69.854 1.00 0.00 H ATOM 24107 H2 WAT 8607 14.710 72.488 68.573 1.00 0.00 H TER 24109 WAT 8607 ATOM 24109 O WAT 8608 34.821 81.648 122.523 1.00 0.00 O ATOM 24110 H1 WAT 8608 35.398 81.814 121.777 1.00 0.00 H ATOM 24111 H2 WAT 8608 34.663 80.705 122.498 1.00 0.00 H TER 24113 WAT 8608 ATOM 24113 O WAT 8609 12.140 96.663 63.773 1.00 0.00 O ATOM 24114 H1 WAT 8609 12.478 97.251 63.098 1.00 0.00 H ATOM 24115 H2 WAT 8609 12.815 95.991 63.866 1.00 0.00 H TER 24117 WAT 8609 ATOM 24117 O WAT 8610 26.661 113.794 22.554 1.00 0.00 O ATOM 24118 H1 WAT 8610 25.894 113.665 23.113 1.00 0.00 H ATOM 24119 H2 WAT 8610 26.768 112.960 22.099 1.00 0.00 H TER 24121 WAT 8610 ATOM 24121 O WAT 8611 51.115 117.964 104.358 1.00 0.00 O ATOM 24122 H1 WAT 8611 50.160 118.012 104.411 1.00 0.00 H ATOM 24123 H2 WAT 8611 51.369 118.763 103.896 1.00 0.00 H TER 24125 WAT 8611 ATOM 24125 O WAT 8612 142.756 6.772 100.382 1.00 0.00 O ATOM 24126 H1 WAT 8612 143.649 6.736 100.725 1.00 0.00 H ATOM 24127 H2 WAT 8612 142.604 5.899 100.020 1.00 0.00 H TER 24129 WAT 8612 ATOM 24129 O WAT 8613 118.449 41.684 89.516 1.00 0.00 O ATOM 24130 H1 WAT 8613 117.974 42.434 89.874 1.00 0.00 H ATOM 24131 H2 WAT 8613 118.460 41.837 88.571 1.00 0.00 H TER 24133 WAT 8613 ATOM 24133 O WAT 8614 9.896 91.139 152.548 1.00 0.00 O ATOM 24134 H1 WAT 8614 9.591 90.781 153.382 1.00 0.00 H ATOM 24135 H2 WAT 8614 10.510 90.485 152.216 1.00 0.00 H TER 24137 WAT 8614 ATOM 24137 O WAT 8615 145.430 62.900 5.394 1.00 0.00 O ATOM 24138 H1 WAT 8615 145.450 63.647 4.796 1.00 0.00 H ATOM 24139 H2 WAT 8615 144.682 62.379 5.101 1.00 0.00 H TER 24141 WAT 8615 ATOM 24141 O WAT 8616 136.544 115.452 10.812 1.00 0.00 O ATOM 24142 H1 WAT 8616 136.596 115.470 9.857 1.00 0.00 H ATOM 24143 H2 WAT 8616 136.894 114.595 11.055 1.00 0.00 H TER 24145 WAT 8616 ATOM 24145 O WAT 8617 19.141 71.179 72.895 1.00 0.00 O ATOM 24146 H1 WAT 8617 18.921 71.243 71.966 1.00 0.00 H ATOM 24147 H2 WAT 8617 18.984 72.058 73.240 1.00 0.00 H TER 24149 WAT 8617 ATOM 24149 O WAT 8618 121.906 98.586 86.824 1.00 0.00 O ATOM 24150 H1 WAT 8618 121.619 99.223 86.169 1.00 0.00 H ATOM 24151 H2 WAT 8618 122.652 98.145 86.417 1.00 0.00 H TER 24153 WAT 8618 ATOM 24153 O WAT 8619 0.879 64.950 81.253 1.00 0.00 O ATOM 24154 H1 WAT 8619 1.403 65.257 80.513 1.00 0.00 H ATOM 24155 H2 WAT 8619 -0.016 64.922 80.916 1.00 0.00 H TER 24157 WAT 8619 ATOM 24157 O WAT 8620 93.016 3.585 92.853 1.00 0.00 O ATOM 24158 H1 WAT 8620 93.503 3.764 93.657 1.00 0.00 H ATOM 24159 H2 WAT 8620 93.509 4.037 92.168 1.00 0.00 H TER 24161 WAT 8620 ATOM 24161 O WAT 8621 41.231 102.169 112.853 1.00 0.00 O ATOM 24162 H1 WAT 8621 41.716 102.589 113.562 1.00 0.00 H ATOM 24163 H2 WAT 8621 40.332 102.114 113.177 1.00 0.00 H TER 24165 WAT 8621 ATOM 24165 O WAT 8622 27.683 67.284 119.822 1.00 0.00 O ATOM 24166 H1 WAT 8622 28.322 66.943 119.197 1.00 0.00 H ATOM 24167 H2 WAT 8622 28.108 68.053 120.204 1.00 0.00 H TER 24169 WAT 8622 ATOM 24169 O WAT 8623 126.790 74.505 126.108 1.00 0.00 O ATOM 24170 H1 WAT 8623 126.122 74.133 125.532 1.00 0.00 H ATOM 24171 H2 WAT 8623 127.427 74.899 125.513 1.00 0.00 H TER 24173 WAT 8623 ATOM 24173 O WAT 8624 134.755 34.896 59.486 1.00 0.00 O ATOM 24174 H1 WAT 8624 135.433 34.746 58.827 1.00 0.00 H ATOM 24175 H2 WAT 8624 134.001 35.211 58.987 1.00 0.00 H TER 24177 WAT 8624 ATOM 24177 O WAT 8625 108.177 49.029 149.563 1.00 0.00 O ATOM 24178 H1 WAT 8625 107.689 49.179 150.372 1.00 0.00 H ATOM 24179 H2 WAT 8625 108.953 48.542 149.838 1.00 0.00 H TER 24181 WAT 8625 ATOM 24181 O WAT 8626 128.429 76.752 108.190 1.00 0.00 O ATOM 24182 H1 WAT 8626 128.323 77.376 107.472 1.00 0.00 H ATOM 24183 H2 WAT 8626 128.447 77.294 108.978 1.00 0.00 H TER 24185 WAT 8626 ATOM 24185 O WAT 8627 28.269 71.496 4.779 1.00 0.00 O ATOM 24186 H1 WAT 8627 28.658 71.605 3.911 1.00 0.00 H ATOM 24187 H2 WAT 8627 28.071 70.562 4.838 1.00 0.00 H TER 24189 WAT 8627 ATOM 24189 O WAT 8628 72.188 20.101 62.968 1.00 0.00 O ATOM 24190 H1 WAT 8628 71.492 20.721 62.747 1.00 0.00 H ATOM 24191 H2 WAT 8628 72.997 20.600 62.858 1.00 0.00 H TER 24193 WAT 8628 ATOM 24193 O WAT 8629 136.776 143.859 150.192 1.00 0.00 O ATOM 24194 H1 WAT 8629 136.786 144.501 149.481 1.00 0.00 H ATOM 24195 H2 WAT 8629 135.906 143.463 150.144 1.00 0.00 H TER 24197 WAT 8629 ATOM 24197 O WAT 8630 42.822 91.494 152.323 1.00 0.00 O ATOM 24198 H1 WAT 8630 42.191 91.583 153.037 1.00 0.00 H ATOM 24199 H2 WAT 8630 43.587 91.085 152.728 1.00 0.00 H TER 24201 WAT 8630 ATOM 24201 O WAT 8631 8.789 61.586 115.221 1.00 0.00 O ATOM 24202 H1 WAT 8631 8.032 62.106 114.951 1.00 0.00 H ATOM 24203 H2 WAT 8631 8.720 61.538 116.174 1.00 0.00 H TER 24205 WAT 8631 ATOM 24205 O WAT 8632 1.257 36.349 107.982 1.00 0.00 O ATOM 24206 H1 WAT 8632 1.304 37.013 108.670 1.00 0.00 H ATOM 24207 H2 WAT 8632 0.770 35.627 108.379 1.00 0.00 H TER 24209 WAT 8632 ATOM 24209 O WAT 8633 52.131 141.126 6.662 1.00 0.00 O ATOM 24210 H1 WAT 8633 52.832 141.428 6.085 1.00 0.00 H ATOM 24211 H2 WAT 8633 52.173 140.171 6.610 1.00 0.00 H TER 24213 WAT 8633 ATOM 24213 O WAT 8634 46.062 101.021 84.251 1.00 0.00 O ATOM 24214 H1 WAT 8634 45.837 101.228 83.344 1.00 0.00 H ATOM 24215 H2 WAT 8634 46.295 100.093 84.235 1.00 0.00 H TER 24217 WAT 8634 ATOM 24217 O WAT 8635 110.910 54.866 116.312 1.00 0.00 O ATOM 24218 H1 WAT 8635 110.332 55.613 116.466 1.00 0.00 H ATOM 24219 H2 WAT 8635 111.309 55.043 115.460 1.00 0.00 H TER 24221 WAT 8635 ATOM 24221 O WAT 8636 40.206 116.237 0.640 1.00 0.00 O ATOM 24222 H1 WAT 8636 40.050 115.970 1.545 1.00 0.00 H ATOM 24223 H2 WAT 8636 40.650 115.488 0.242 1.00 0.00 H TER 24225 WAT 8636 ATOM 24225 O WAT 8637 30.904 129.176 119.779 1.00 0.00 O ATOM 24226 H1 WAT 8637 31.495 129.788 119.341 1.00 0.00 H ATOM 24227 H2 WAT 8637 30.594 129.652 120.549 1.00 0.00 H TER 24229 WAT 8637 ATOM 24229 O WAT 8638 94.572 60.650 57.705 1.00 0.00 O ATOM 24230 H1 WAT 8638 94.329 61.410 57.176 1.00 0.00 H ATOM 24231 H2 WAT 8638 93.757 60.382 58.129 1.00 0.00 H TER 24233 WAT 8638 ATOM 24233 O WAT 8639 82.267 139.357 124.982 1.00 0.00 O ATOM 24234 H1 WAT 8639 82.617 140.015 124.381 1.00 0.00 H ATOM 24235 H2 WAT 8639 82.347 138.531 124.505 1.00 0.00 H TER 24237 WAT 8639 ATOM 24237 O WAT 8640 117.597 144.852 137.870 1.00 0.00 O ATOM 24238 H1 WAT 8640 118.264 145.219 137.290 1.00 0.00 H ATOM 24239 H2 WAT 8640 117.074 144.284 137.305 1.00 0.00 H TER 24241 WAT 8640 ATOM 24241 O WAT 8641 76.371 102.983 83.112 1.00 0.00 O ATOM 24242 H1 WAT 8641 76.218 102.063 83.327 1.00 0.00 H ATOM 24243 H2 WAT 8641 76.872 103.323 83.853 1.00 0.00 H TER 24245 WAT 8641 ATOM 24245 O WAT 8642 130.526 29.143 78.181 1.00 0.00 O ATOM 24246 H1 WAT 8642 130.252 28.743 77.356 1.00 0.00 H ATOM 24247 H2 WAT 8642 131.460 28.946 78.245 1.00 0.00 H TER 24249 WAT 8642 ATOM 24249 O WAT 8643 64.812 14.098 10.671 1.00 0.00 O ATOM 24250 H1 WAT 8643 64.104 14.384 10.094 1.00 0.00 H ATOM 24251 H2 WAT 8643 64.839 13.147 10.564 1.00 0.00 H TER 24253 WAT 8643 ATOM 24253 O WAT 8644 108.023 136.893 150.559 1.00 0.00 O ATOM 24254 H1 WAT 8644 107.088 137.056 150.429 1.00 0.00 H ATOM 24255 H2 WAT 8644 108.165 136.018 150.198 1.00 0.00 H TER 24257 WAT 8644 ATOM 24257 O WAT 8645 2.306 117.675 89.084 1.00 0.00 O ATOM 24258 H1 WAT 8645 1.659 116.989 88.920 1.00 0.00 H ATOM 24259 H2 WAT 8645 2.854 117.325 89.786 1.00 0.00 H TER 24261 WAT 8645 ATOM 24261 O WAT 8646 81.158 50.846 82.353 1.00 0.00 O ATOM 24262 H1 WAT 8646 81.140 51.291 83.200 1.00 0.00 H ATOM 24263 H2 WAT 8646 81.689 51.414 81.795 1.00 0.00 H TER 24265 WAT 8646 ATOM 24265 O WAT 8647 78.697 110.435 97.219 1.00 0.00 O ATOM 24266 H1 WAT 8647 79.317 110.976 96.730 1.00 0.00 H ATOM 24267 H2 WAT 8647 78.090 110.106 96.556 1.00 0.00 H TER 24269 WAT 8647 ATOM 24269 O WAT 8648 96.028 140.857 101.110 1.00 0.00 O ATOM 24270 H1 WAT 8648 96.825 140.673 100.613 1.00 0.00 H ATOM 24271 H2 WAT 8648 96.319 140.907 102.020 1.00 0.00 H TER 24273 WAT 8648 ATOM 24273 O WAT 8649 101.269 124.517 126.857 1.00 0.00 O ATOM 24274 H1 WAT 8649 101.233 125.467 126.746 1.00 0.00 H ATOM 24275 H2 WAT 8649 101.959 124.378 127.506 1.00 0.00 H TER 24277 WAT 8649 ATOM 24277 O WAT 8650 66.607 112.959 61.326 1.00 0.00 O ATOM 24278 H1 WAT 8650 66.856 112.408 60.584 1.00 0.00 H ATOM 24279 H2 WAT 8650 67.431 113.339 61.629 1.00 0.00 H TER 24281 WAT 8650 ATOM 24281 O WAT 8651 47.873 47.832 101.898 1.00 0.00 O ATOM 24282 H1 WAT 8651 47.807 47.120 101.261 1.00 0.00 H ATOM 24283 H2 WAT 8651 48.040 48.612 101.369 1.00 0.00 H TER 24285 WAT 8651 ATOM 24285 O WAT 8652 77.905 120.868 54.597 1.00 0.00 O ATOM 24286 H1 WAT 8652 78.184 120.605 53.720 1.00 0.00 H ATOM 24287 H2 WAT 8652 78.167 121.786 54.667 1.00 0.00 H TER 24289 WAT 8652 ATOM 24289 O WAT 8653 58.260 12.127 52.159 1.00 0.00 O ATOM 24290 H1 WAT 8653 58.046 11.205 52.017 1.00 0.00 H ATOM 24291 H2 WAT 8653 59.124 12.112 52.570 1.00 0.00 H TER 24293 WAT 8653 ATOM 24293 O WAT 8654 80.424 42.496 119.012 1.00 0.00 O ATOM 24294 H1 WAT 8654 80.666 41.667 119.424 1.00 0.00 H ATOM 24295 H2 WAT 8654 80.653 43.162 119.660 1.00 0.00 H TER 24297 WAT 8654 ATOM 24297 O WAT 8655 143.279 22.278 97.210 1.00 0.00 O ATOM 24298 H1 WAT 8655 144.118 22.545 97.586 1.00 0.00 H ATOM 24299 H2 WAT 8655 143.467 21.452 96.766 1.00 0.00 H TER 24301 WAT 8655 ATOM 24301 O WAT 8656 94.335 9.171 11.673 1.00 0.00 O ATOM 24302 H1 WAT 8656 94.477 10.096 11.874 1.00 0.00 H ATOM 24303 H2 WAT 8656 93.748 8.863 12.363 1.00 0.00 H TER 24305 WAT 8656 ATOM 24305 O WAT 8657 46.907 3.120 97.769 1.00 0.00 O ATOM 24306 H1 WAT 8657 46.947 2.295 97.285 1.00 0.00 H ATOM 24307 H2 WAT 8657 47.243 2.903 98.639 1.00 0.00 H TER 24309 WAT 8657 ATOM 24309 O WAT 8658 9.111 14.444 133.468 1.00 0.00 O ATOM 24310 H1 WAT 8658 8.930 15.243 132.972 1.00 0.00 H ATOM 24311 H2 WAT 8658 8.421 13.836 133.202 1.00 0.00 H TER 24313 WAT 8658 ATOM 24313 O WAT 8659 34.722 31.569 99.001 1.00 0.00 O ATOM 24314 H1 WAT 8659 35.537 32.072 99.010 1.00 0.00 H ATOM 24315 H2 WAT 8659 34.735 31.079 99.823 1.00 0.00 H TER 24317 WAT 8659 ATOM 24317 O WAT 8660 63.839 104.472 88.160 1.00 0.00 O ATOM 24318 H1 WAT 8660 64.110 103.717 87.638 1.00 0.00 H ATOM 24319 H2 WAT 8660 62.903 104.564 87.982 1.00 0.00 H TER 24321 WAT 8660 ATOM 24321 O WAT 8661 109.504 41.197 18.466 1.00 0.00 O ATOM 24322 H1 WAT 8661 110.292 40.662 18.562 1.00 0.00 H ATOM 24323 H2 WAT 8661 109.833 42.087 18.339 1.00 0.00 H TER 24325 WAT 8661 ATOM 24325 O WAT 8662 57.867 26.457 21.992 1.00 0.00 O ATOM 24326 H1 WAT 8662 58.741 26.844 21.941 1.00 0.00 H ATOM 24327 H2 WAT 8662 58.025 25.514 22.019 1.00 0.00 H TER 24329 WAT 8662 ATOM 24329 O WAT 8663 136.873 17.864 8.212 1.00 0.00 O ATOM 24330 H1 WAT 8663 137.695 18.170 7.829 1.00 0.00 H ATOM 24331 H2 WAT 8663 137.047 17.822 9.152 1.00 0.00 H TER 24333 WAT 8663 ATOM 24333 O WAT 8664 124.148 83.183 145.226 1.00 0.00 O ATOM 24334 H1 WAT 8664 123.585 83.949 145.339 1.00 0.00 H ATOM 24335 H2 WAT 8664 124.928 83.381 145.745 1.00 0.00 H TER 24337 WAT 8664 ATOM 24337 O WAT 8665 74.394 78.347 114.750 1.00 0.00 O ATOM 24338 H1 WAT 8665 74.504 78.543 113.819 1.00 0.00 H ATOM 24339 H2 WAT 8665 75.193 78.677 115.160 1.00 0.00 H TER 24341 WAT 8665 ATOM 24341 O WAT 8666 127.785 65.185 97.863 1.00 0.00 O ATOM 24342 H1 WAT 8666 127.957 65.899 98.476 1.00 0.00 H ATOM 24343 H2 WAT 8666 126.939 65.403 97.472 1.00 0.00 H TER 24345 WAT 8666 ATOM 24345 O WAT 8667 143.709 58.222 60.948 1.00 0.00 O ATOM 24346 H1 WAT 8667 144.445 57.794 61.386 1.00 0.00 H ATOM 24347 H2 WAT 8667 144.119 58.820 60.322 1.00 0.00 H TER 24349 WAT 8667 ATOM 24349 O WAT 8668 36.709 2.288 87.121 1.00 0.00 O ATOM 24350 H1 WAT 8668 36.651 3.171 87.487 1.00 0.00 H ATOM 24351 H2 WAT 8668 36.718 1.712 87.885 1.00 0.00 H TER 24353 WAT 8668 ATOM 24353 O WAT 8669 4.543 134.975 109.257 1.00 0.00 O ATOM 24354 H1 WAT 8669 4.608 134.222 109.844 1.00 0.00 H ATOM 24355 H2 WAT 8669 4.876 135.710 109.772 1.00 0.00 H TER 24357 WAT 8669 ATOM 24357 O WAT 8670 0.231 44.174 13.195 1.00 0.00 O ATOM 24358 H1 WAT 8670 0.842 44.581 13.809 1.00 0.00 H ATOM 24359 H2 WAT 8670 -0.635 44.382 13.546 1.00 0.00 H TER 24361 WAT 8670 ATOM 24361 O WAT 8671 93.937 100.918 124.544 1.00 0.00 O ATOM 24362 H1 WAT 8671 93.653 101.420 125.307 1.00 0.00 H ATOM 24363 H2 WAT 8671 94.883 101.058 124.504 1.00 0.00 H TER 24365 WAT 8671 ATOM 24365 O WAT 8672 44.784 17.778 149.024 1.00 0.00 O ATOM 24366 H1 WAT 8672 44.078 17.460 148.462 1.00 0.00 H ATOM 24367 H2 WAT 8672 44.541 17.487 149.903 1.00 0.00 H TER 24369 WAT 8672 ATOM 24369 O WAT 8673 135.348 86.586 148.453 1.00 0.00 O ATOM 24370 H1 WAT 8673 135.088 85.926 149.096 1.00 0.00 H ATOM 24371 H2 WAT 8673 135.613 87.341 148.978 1.00 0.00 H TER 24373 WAT 8673 ATOM 24373 O WAT 8674 37.699 139.785 158.281 1.00 0.00 O ATOM 24374 H1 WAT 8674 37.222 139.282 157.622 1.00 0.00 H ATOM 24375 H2 WAT 8674 37.112 139.808 159.036 1.00 0.00 H TER 24377 WAT 8674 ATOM 24377 O WAT 8675 6.160 25.867 74.808 1.00 0.00 O ATOM 24378 H1 WAT 8675 5.862 26.442 75.512 1.00 0.00 H ATOM 24379 H2 WAT 8675 5.379 25.376 74.551 1.00 0.00 H TER 24381 WAT 8675 ATOM 24381 O WAT 8676 4.324 86.059 16.385 1.00 0.00 O ATOM 24382 H1 WAT 8676 3.385 86.244 16.407 1.00 0.00 H ATOM 24383 H2 WAT 8676 4.467 85.456 17.114 1.00 0.00 H TER 24385 WAT 8676 ATOM 24385 O WAT 8677 120.298 1.223 147.594 1.00 0.00 O ATOM 24386 H1 WAT 8677 119.766 0.936 146.853 1.00 0.00 H ATOM 24387 H2 WAT 8677 120.933 1.830 147.213 1.00 0.00 H TER 24389 WAT 8677 ATOM 24389 O WAT 8678 50.063 123.455 88.240 1.00 0.00 O ATOM 24390 H1 WAT 8678 49.923 122.766 87.590 1.00 0.00 H ATOM 24391 H2 WAT 8678 49.323 123.371 88.841 1.00 0.00 H TER 24393 WAT 8678 ATOM 24393 O WAT 8679 4.113 118.147 138.317 1.00 0.00 O ATOM 24394 H1 WAT 8679 3.653 117.318 138.446 1.00 0.00 H ATOM 24395 H2 WAT 8679 4.851 118.109 138.926 1.00 0.00 H TER 24397 WAT 8679 ATOM 24397 O WAT 8680 65.213 51.994 94.412 1.00 0.00 O ATOM 24398 H1 WAT 8680 65.650 52.801 94.139 1.00 0.00 H ATOM 24399 H2 WAT 8680 64.907 51.599 93.596 1.00 0.00 H TER 24401 WAT 8680 ATOM 24401 O WAT 8681 56.263 90.015 103.645 1.00 0.00 O ATOM 24402 H1 WAT 8681 55.790 89.192 103.768 1.00 0.00 H ATOM 24403 H2 WAT 8681 56.114 90.501 104.456 1.00 0.00 H TER 24405 WAT 8681 ATOM 24405 O WAT 8682 10.130 44.614 77.122 1.00 0.00 O ATOM 24406 H1 WAT 8682 10.720 44.549 76.372 1.00 0.00 H ATOM 24407 H2 WAT 8682 9.417 45.175 76.818 1.00 0.00 H TER 24409 WAT 8682 ATOM 24409 O WAT 8683 55.177 125.424 112.349 1.00 0.00 O ATOM 24410 H1 WAT 8683 54.231 125.371 112.490 1.00 0.00 H ATOM 24411 H2 WAT 8683 55.394 124.621 111.876 1.00 0.00 H TER 24413 WAT 8683 ATOM 24413 O WAT 8684 56.618 121.938 58.713 1.00 0.00 O ATOM 24414 H1 WAT 8684 56.487 122.254 59.607 1.00 0.00 H ATOM 24415 H2 WAT 8684 57.543 122.107 58.532 1.00 0.00 H TER 24417 WAT 8684 ATOM 24417 O WAT 8685 47.155 53.478 26.316 1.00 0.00 O ATOM 24418 H1 WAT 8685 48.110 53.515 26.255 1.00 0.00 H ATOM 24419 H2 WAT 8685 46.879 54.394 26.301 1.00 0.00 H TER 24421 WAT 8685 ATOM 24421 O WAT 8686 91.877 82.099 151.456 1.00 0.00 O ATOM 24422 H1 WAT 8686 91.666 82.935 151.873 1.00 0.00 H ATOM 24423 H2 WAT 8686 92.263 81.572 152.155 1.00 0.00 H TER 24425 WAT 8686 ATOM 24425 O WAT 8687 42.733 52.603 78.451 1.00 0.00 O ATOM 24426 H1 WAT 8687 43.109 52.450 79.318 1.00 0.00 H ATOM 24427 H2 WAT 8687 43.170 53.394 78.136 1.00 0.00 H TER 24429 WAT 8687 ATOM 24429 O WAT 8688 143.082 133.047 95.873 1.00 0.00 O ATOM 24430 H1 WAT 8688 142.859 133.430 95.025 1.00 0.00 H ATOM 24431 H2 WAT 8688 143.289 133.798 96.429 1.00 0.00 H TER 24433 WAT 8688 ATOM 24433 O WAT 8689 2.451 10.816 118.041 1.00 0.00 O ATOM 24434 H1 WAT 8689 3.342 10.741 118.384 1.00 0.00 H ATOM 24435 H2 WAT 8689 2.183 9.913 117.871 1.00 0.00 H TER 24437 WAT 8689 ATOM 24437 O WAT 8690 34.474 105.655 52.354 1.00 0.00 O ATOM 24438 H1 WAT 8690 35.138 106.307 52.133 1.00 0.00 H ATOM 24439 H2 WAT 8690 34.974 104.870 52.577 1.00 0.00 H TER 24441 WAT 8690 ATOM 24441 O WAT 8691 67.958 132.432 80.581 1.00 0.00 O ATOM 24442 H1 WAT 8691 68.103 132.690 81.491 1.00 0.00 H ATOM 24443 H2 WAT 8691 68.759 131.971 80.332 1.00 0.00 H TER 24445 WAT 8691 ATOM 24445 O WAT 8692 83.669 37.547 72.317 1.00 0.00 O ATOM 24446 H1 WAT 8692 84.148 37.428 73.137 1.00 0.00 H ATOM 24447 H2 WAT 8692 84.338 37.477 71.636 1.00 0.00 H TER 24449 WAT 8692 ATOM 24449 O WAT 8693 22.017 108.222 119.255 1.00 0.00 O ATOM 24450 H1 WAT 8693 21.345 107.920 119.867 1.00 0.00 H ATOM 24451 H2 WAT 8693 21.738 107.880 118.405 1.00 0.00 H TER 24453 WAT 8693 ATOM 24453 O WAT 8694 139.784 106.561 9.255 1.00 0.00 O ATOM 24454 H1 WAT 8694 139.646 105.717 8.825 1.00 0.00 H ATOM 24455 H2 WAT 8694 139.671 106.376 10.188 1.00 0.00 H TER 24457 WAT 8694 ATOM 24457 O WAT 8695 115.628 100.601 127.383 1.00 0.00 O ATOM 24458 H1 WAT 8695 115.683 99.668 127.591 1.00 0.00 H ATOM 24459 H2 WAT 8695 114.975 100.944 127.993 1.00 0.00 H TER 24461 WAT 8695 ATOM 24461 O WAT 8696 23.820 63.490 93.787 1.00 0.00 O ATOM 24462 H1 WAT 8696 23.091 64.091 93.942 1.00 0.00 H ATOM 24463 H2 WAT 8696 24.526 63.822 94.342 1.00 0.00 H TER 24465 WAT 8696 ATOM 24465 O WAT 8697 2.496 85.668 68.022 1.00 0.00 O ATOM 24466 H1 WAT 8697 3.402 85.573 68.317 1.00 0.00 H ATOM 24467 H2 WAT 8697 2.018 85.947 68.802 1.00 0.00 H TER 24469 WAT 8697 ATOM 24469 O WAT 8698 142.820 62.057 156.702 1.00 0.00 O ATOM 24470 H1 WAT 8698 142.349 61.671 157.440 1.00 0.00 H ATOM 24471 H2 WAT 8698 143.313 62.783 157.086 1.00 0.00 H TER 24473 WAT 8698 ATOM 24473 O WAT 8699 68.305 87.326 89.434 1.00 0.00 O ATOM 24474 H1 WAT 8699 68.965 87.351 88.741 1.00 0.00 H ATOM 24475 H2 WAT 8699 67.868 86.483 89.318 1.00 0.00 H TER 24477 WAT 8699 ATOM 24477 O WAT 8700 34.199 49.796 129.156 1.00 0.00 O ATOM 24478 H1 WAT 8700 33.268 49.989 129.044 1.00 0.00 H ATOM 24479 H2 WAT 8700 34.217 48.929 129.562 1.00 0.00 H TER 24481 WAT 8700 ATOM 24481 O WAT 8701 91.009 22.475 1.556 1.00 0.00 O ATOM 24482 H1 WAT 8701 90.709 22.560 2.461 1.00 0.00 H ATOM 24483 H2 WAT 8701 91.599 21.721 1.570 1.00 0.00 H TER 24485 WAT 8701 ATOM 24485 O WAT 8702 89.629 19.232 66.344 1.00 0.00 O ATOM 24486 H1 WAT 8702 90.563 19.023 66.370 1.00 0.00 H ATOM 24487 H2 WAT 8702 89.597 20.189 66.342 1.00 0.00 H TER 24489 WAT 8702 ATOM 24489 O WAT 8703 138.180 10.222 69.137 1.00 0.00 O ATOM 24490 H1 WAT 8703 138.258 10.548 70.034 1.00 0.00 H ATOM 24491 H2 WAT 8703 139.025 9.809 68.958 1.00 0.00 H TER 24493 WAT 8703 ATOM 24493 O WAT 8704 121.707 45.001 78.178 1.00 0.00 O ATOM 24494 H1 WAT 8704 122.417 45.175 78.797 1.00 0.00 H ATOM 24495 H2 WAT 8704 121.245 44.250 78.548 1.00 0.00 H TER 24497 WAT 8704 ATOM 24497 O WAT 8705 83.439 117.139 8.879 1.00 0.00 O ATOM 24498 H1 WAT 8705 83.071 117.634 8.147 1.00 0.00 H ATOM 24499 H2 WAT 8705 82.964 117.458 9.647 1.00 0.00 H TER 24501 WAT 8705 ATOM 24501 O WAT 8706 36.469 29.450 154.329 1.00 0.00 O ATOM 24502 H1 WAT 8706 35.776 29.333 153.679 1.00 0.00 H ATOM 24503 H2 WAT 8706 36.165 28.962 155.094 1.00 0.00 H TER 24505 WAT 8706 ATOM 24505 O WAT 8707 23.972 41.735 12.231 1.00 0.00 O ATOM 24506 H1 WAT 8707 24.057 41.426 13.132 1.00 0.00 H ATOM 24507 H2 WAT 8707 23.487 42.557 12.304 1.00 0.00 H TER 24509 WAT 8707 ATOM 24509 O WAT 8708 20.424 29.743 86.148 1.00 0.00 O ATOM 24510 H1 WAT 8708 20.065 30.607 86.347 1.00 0.00 H ATOM 24511 H2 WAT 8708 20.459 29.298 86.995 1.00 0.00 H TER 24513 WAT 8708 ATOM 24513 O WAT 8709 141.424 87.040 157.761 1.00 0.00 O ATOM 24514 H1 WAT 8709 140.514 87.088 157.469 1.00 0.00 H ATOM 24515 H2 WAT 8709 141.791 86.297 157.283 1.00 0.00 H TER 24517 WAT 8709 ATOM 24517 O WAT 8710 5.318 98.723 155.000 1.00 0.00 O ATOM 24518 H1 WAT 8710 5.277 99.362 155.712 1.00 0.00 H ATOM 24519 H2 WAT 8710 4.528 98.193 155.108 1.00 0.00 H TER 24521 WAT 8710 ATOM 24521 O WAT 8711 22.086 87.068 154.113 1.00 0.00 O ATOM 24522 H1 WAT 8711 22.036 87.480 154.975 1.00 0.00 H ATOM 24523 H2 WAT 8711 22.911 87.384 153.744 1.00 0.00 H TER 24525 WAT 8711 ATOM 24525 O WAT 8712 69.777 13.586 55.269 1.00 0.00 O ATOM 24526 H1 WAT 8712 69.254 12.809 55.471 1.00 0.00 H ATOM 24527 H2 WAT 8712 70.505 13.552 55.889 1.00 0.00 H TER 24529 WAT 8712 ATOM 24529 O WAT 8713 56.265 75.880 28.280 1.00 0.00 O ATOM 24530 H1 WAT 8713 55.521 76.350 28.655 1.00 0.00 H ATOM 24531 H2 WAT 8713 56.288 75.049 28.755 1.00 0.00 H TER 24533 WAT 8713 ATOM 24533 O WAT 8714 137.742 105.180 99.441 1.00 0.00 O ATOM 24534 H1 WAT 8714 137.294 105.890 98.983 1.00 0.00 H ATOM 24535 H2 WAT 8714 138.229 105.616 100.141 1.00 0.00 H TER 24537 WAT 8714 ATOM 24537 O WAT 8715 7.446 135.744 78.819 1.00 0.00 O ATOM 24538 H1 WAT 8715 6.794 135.278 78.295 1.00 0.00 H ATOM 24539 H2 WAT 8715 6.964 136.043 79.590 1.00 0.00 H TER 24541 WAT 8715 ATOM 24541 O WAT 8716 34.768 114.695 121.592 1.00 0.00 O ATOM 24542 H1 WAT 8716 35.720 114.683 121.491 1.00 0.00 H ATOM 24543 H2 WAT 8716 34.499 113.791 121.425 1.00 0.00 H TER 24545 WAT 8716 ATOM 24545 O WAT 8717 98.586 144.818 79.281 1.00 0.00 O ATOM 24546 H1 WAT 8717 98.026 144.149 78.886 1.00 0.00 H ATOM 24547 H2 WAT 8717 98.466 145.589 78.727 1.00 0.00 H TER 24549 WAT 8717 ATOM 24549 O WAT 8718 63.667 37.919 86.275 1.00 0.00 O ATOM 24550 H1 WAT 8718 63.755 37.443 85.450 1.00 0.00 H ATOM 24551 H2 WAT 8718 63.160 37.333 86.837 1.00 0.00 H TER 24553 WAT 8718 ATOM 24553 O WAT 8719 63.855 88.103 81.955 1.00 0.00 O ATOM 24554 H1 WAT 8719 63.173 87.811 82.561 1.00 0.00 H ATOM 24555 H2 WAT 8719 63.446 88.050 81.091 1.00 0.00 H TER 24557 WAT 8719 ATOM 24557 O WAT 8720 144.435 137.384 100.907 1.00 0.00 O ATOM 24558 H1 WAT 8720 143.915 138.153 101.141 1.00 0.00 H ATOM 24559 H2 WAT 8720 143.794 136.679 100.819 1.00 0.00 H TER 24561 WAT 8720 ATOM 24561 O WAT 8721 54.541 55.116 72.990 1.00 0.00 O ATOM 24562 H1 WAT 8721 53.635 54.878 72.795 1.00 0.00 H ATOM 24563 H2 WAT 8721 54.903 54.346 73.427 1.00 0.00 H TER 24565 WAT 8721 ATOM 24565 O WAT 8722 11.540 109.943 142.799 1.00 0.00 O ATOM 24566 H1 WAT 8722 11.195 110.693 143.284 1.00 0.00 H ATOM 24567 H2 WAT 8722 11.064 109.191 143.150 1.00 0.00 H TER 24569 WAT 8722 ATOM 24569 O WAT 8723 62.524 113.436 152.175 1.00 0.00 O ATOM 24570 H1 WAT 8723 63.452 113.260 152.023 1.00 0.00 H ATOM 24571 H2 WAT 8723 62.446 113.505 153.127 1.00 0.00 H TER 24573 WAT 8723 ATOM 24573 O WAT 8724 109.557 140.047 109.642 1.00 0.00 O ATOM 24574 H1 WAT 8724 108.941 140.490 110.226 1.00 0.00 H ATOM 24575 H2 WAT 8724 109.460 140.499 108.804 1.00 0.00 H TER 24577 WAT 8724 ATOM 24577 O WAT 8725 62.697 71.332 127.645 1.00 0.00 O ATOM 24578 H1 WAT 8725 62.946 70.581 128.183 1.00 0.00 H ATOM 24579 H2 WAT 8725 62.966 72.094 128.158 1.00 0.00 H TER 24581 WAT 8725 ATOM 24581 O WAT 8726 100.899 29.726 122.186 1.00 0.00 O ATOM 24582 H1 WAT 8726 100.183 29.694 122.820 1.00 0.00 H ATOM 24583 H2 WAT 8726 101.544 30.311 122.583 1.00 0.00 H TER 24585 WAT 8726 ATOM 24585 O WAT 8727 15.799 94.247 111.776 1.00 0.00 O ATOM 24586 H1 WAT 8727 15.439 95.111 111.575 1.00 0.00 H ATOM 24587 H2 WAT 8727 15.057 93.752 112.122 1.00 0.00 H TER 24589 WAT 8727 ATOM 24589 O WAT 8728 133.042 86.892 77.881 1.00 0.00 O ATOM 24590 H1 WAT 8728 132.199 86.966 77.432 1.00 0.00 H ATOM 24591 H2 WAT 8728 132.817 86.887 78.811 1.00 0.00 H TER 24593 WAT 8728 ATOM 24593 O WAT 8729 77.812 24.010 113.340 1.00 0.00 O ATOM 24594 H1 WAT 8729 77.770 23.722 112.429 1.00 0.00 H ATOM 24595 H2 WAT 8729 76.897 24.058 113.619 1.00 0.00 H TER 24597 WAT 8729 ATOM 24597 O WAT 8730 105.023 52.036 27.960 1.00 0.00 O ATOM 24598 H1 WAT 8730 104.339 51.474 27.595 1.00 0.00 H ATOM 24599 H2 WAT 8730 104.550 52.788 28.317 1.00 0.00 H TER 24601 WAT 8730 ATOM 24601 O WAT 8731 67.627 4.882 112.263 1.00 0.00 O ATOM 24602 H1 WAT 8731 68.356 5.477 112.441 1.00 0.00 H ATOM 24603 H2 WAT 8731 67.989 4.235 111.657 1.00 0.00 H TER 24605 WAT 8731 ATOM 24605 O WAT 8732 0.326 55.004 110.291 1.00 0.00 O ATOM 24606 H1 WAT 8732 -0.068 54.133 110.239 1.00 0.00 H ATOM 24607 H2 WAT 8732 -0.026 55.378 111.098 1.00 0.00 H TER 24609 WAT 8732 ATOM 24609 O WAT 8733 109.180 2.094 81.357 1.00 0.00 O ATOM 24610 H1 WAT 8733 108.365 2.538 81.123 1.00 0.00 H ATOM 24611 H2 WAT 8733 108.944 1.168 81.403 1.00 0.00 H TER 24613 WAT 8733 ATOM 24613 O WAT 8734 63.167 45.051 73.336 1.00 0.00 O ATOM 24614 H1 WAT 8734 64.072 44.945 73.045 1.00 0.00 H ATOM 24615 H2 WAT 8734 62.887 44.168 73.575 1.00 0.00 H TER 24617 WAT 8734 ATOM 24617 O WAT 8735 6.979 17.353 148.699 1.00 0.00 O ATOM 24618 H1 WAT 8735 6.170 17.854 148.590 1.00 0.00 H ATOM 24619 H2 WAT 8735 6.980 16.738 147.966 1.00 0.00 H TER 24621 WAT 8735 ATOM 24621 O WAT 8736 91.971 115.652 64.117 1.00 0.00 O ATOM 24622 H1 WAT 8736 92.023 116.187 63.326 1.00 0.00 H ATOM 24623 H2 WAT 8736 91.945 114.751 63.796 1.00 0.00 H TER 24625 WAT 8736 ATOM 24625 O WAT 8737 51.714 96.015 25.383 1.00 0.00 O ATOM 24626 H1 WAT 8737 51.553 95.410 26.107 1.00 0.00 H ATOM 24627 H2 WAT 8737 52.150 96.764 25.789 1.00 0.00 H TER 24629 WAT 8737 ATOM 24629 O WAT 8738 115.213 72.199 136.625 1.00 0.00 O ATOM 24630 H1 WAT 8738 116.122 72.092 136.346 1.00 0.00 H ATOM 24631 H2 WAT 8738 114.827 72.774 135.964 1.00 0.00 H TER 24633 WAT 8738 ATOM 24633 O WAT 8739 79.638 46.931 74.356 1.00 0.00 O ATOM 24634 H1 WAT 8739 79.264 47.504 73.686 1.00 0.00 H ATOM 24635 H2 WAT 8739 79.261 47.246 75.177 1.00 0.00 H TER 24637 WAT 8739 ATOM 24637 O WAT 8740 109.742 94.579 87.769 1.00 0.00 O ATOM 24638 H1 WAT 8740 108.842 94.258 87.824 1.00 0.00 H ATOM 24639 H2 WAT 8740 110.076 94.508 88.663 1.00 0.00 H TER 24641 WAT 8740 ATOM 24641 O WAT 8741 58.278 115.308 109.861 1.00 0.00 O ATOM 24642 H1 WAT 8741 58.653 116.059 110.321 1.00 0.00 H ATOM 24643 H2 WAT 8741 58.862 115.168 109.115 1.00 0.00 H TER 24645 WAT 8741 ATOM 24645 O WAT 8742 92.079 49.705 82.095 1.00 0.00 O ATOM 24646 H1 WAT 8742 92.145 48.851 82.524 1.00 0.00 H ATOM 24647 H2 WAT 8742 91.275 49.653 81.579 1.00 0.00 H TER 24649 WAT 8742 ATOM 24649 O WAT 8743 139.648 62.353 85.135 1.00 0.00 O ATOM 24650 H1 WAT 8743 138.760 62.448 84.790 1.00 0.00 H ATOM 24651 H2 WAT 8743 139.988 61.566 84.709 1.00 0.00 H TER 24653 WAT 8743 ATOM 24653 O WAT 8744 48.822 81.792 5.471 1.00 0.00 O ATOM 24654 H1 WAT 8744 48.405 80.962 5.705 1.00 0.00 H ATOM 24655 H2 WAT 8744 49.438 81.563 4.775 1.00 0.00 H TER 24657 WAT 8744 ATOM 24657 O WAT 8745 110.777 88.208 82.241 1.00 0.00 O ATOM 24658 H1 WAT 8745 111.420 87.514 82.099 1.00 0.00 H ATOM 24659 H2 WAT 8745 109.970 87.871 81.851 1.00 0.00 H TER 24661 WAT 8745 ATOM 24661 O WAT 8746 11.423 137.358 112.072 1.00 0.00 O ATOM 24662 H1 WAT 8746 11.269 137.626 111.166 1.00 0.00 H ATOM 24663 H2 WAT 8746 12.257 137.766 112.304 1.00 0.00 H TER 24665 WAT 8746 ATOM 24665 O WAT 8747 38.505 109.130 134.878 1.00 0.00 O ATOM 24666 H1 WAT 8747 38.197 109.964 135.232 1.00 0.00 H ATOM 24667 H2 WAT 8747 39.459 109.212 134.866 1.00 0.00 H TER 24669 WAT 8747 ATOM 24669 O WAT 8748 48.803 27.800 14.142 1.00 0.00 O ATOM 24670 H1 WAT 8748 49.689 28.111 13.956 1.00 0.00 H ATOM 24671 H2 WAT 8748 48.250 28.573 14.032 1.00 0.00 H TER 24673 WAT 8748 ATOM 24673 O WAT 8749 54.568 0.263 81.360 1.00 0.00 O ATOM 24674 H1 WAT 8749 54.429 0.413 82.295 1.00 0.00 H ATOM 24675 H2 WAT 8749 54.217 -0.614 81.204 1.00 0.00 H TER 24677 WAT 8749 ATOM 24677 O WAT 8750 53.410 31.762 10.069 1.00 0.00 O ATOM 24678 H1 WAT 8750 53.139 31.406 9.223 1.00 0.00 H ATOM 24679 H2 WAT 8750 53.606 30.991 10.602 1.00 0.00 H TER 24681 WAT 8750 ATOM 24681 O WAT 8751 130.540 46.993 9.739 1.00 0.00 O ATOM 24682 H1 WAT 8751 130.037 46.474 10.367 1.00 0.00 H ATOM 24683 H2 WAT 8751 130.456 46.517 8.913 1.00 0.00 H TER 24685 WAT 8751 ATOM 24685 O WAT 8752 111.065 19.648 17.848 1.00 0.00 O ATOM 24686 H1 WAT 8752 111.463 18.927 18.335 1.00 0.00 H ATOM 24687 H2 WAT 8752 111.017 20.366 18.480 1.00 0.00 H TER 24689 WAT 8752 ATOM 24689 O WAT 8753 24.971 37.403 125.104 1.00 0.00 O ATOM 24690 H1 WAT 8753 24.759 37.170 126.008 1.00 0.00 H ATOM 24691 H2 WAT 8753 24.569 38.262 124.978 1.00 0.00 H TER 24693 WAT 8753 ATOM 24693 O WAT 8754 46.214 3.683 154.787 1.00 0.00 O ATOM 24694 H1 WAT 8754 46.409 4.606 154.626 1.00 0.00 H ATOM 24695 H2 WAT 8754 46.877 3.207 154.286 1.00 0.00 H TER 24697 WAT 8754 ATOM 24697 O WAT 8755 134.482 77.850 108.525 1.00 0.00 O ATOM 24698 H1 WAT 8755 134.662 77.910 109.463 1.00 0.00 H ATOM 24699 H2 WAT 8755 133.671 78.345 108.405 1.00 0.00 H TER 24701 WAT 8755 ATOM 24701 O WAT 8756 127.253 37.906 105.779 1.00 0.00 O ATOM 24702 H1 WAT 8756 126.391 38.121 106.135 1.00 0.00 H ATOM 24703 H2 WAT 8756 127.222 38.217 104.874 1.00 0.00 H TER 24705 WAT 8756 ATOM 24705 O WAT 8757 79.262 108.459 87.913 1.00 0.00 O ATOM 24706 H1 WAT 8757 78.575 107.863 87.613 1.00 0.00 H ATOM 24707 H2 WAT 8757 78.891 109.333 87.791 1.00 0.00 H TER 24709 WAT 8757 ATOM 24709 O WAT 8758 125.006 70.867 121.726 1.00 0.00 O ATOM 24710 H1 WAT 8758 124.611 70.077 121.358 1.00 0.00 H ATOM 24711 H2 WAT 8758 124.346 71.205 122.332 1.00 0.00 H TER 24713 WAT 8758 ATOM 24713 O WAT 8759 13.592 7.492 114.388 1.00 0.00 O ATOM 24714 H1 WAT 8759 14.517 7.706 114.509 1.00 0.00 H ATOM 24715 H2 WAT 8759 13.576 6.928 113.615 1.00 0.00 H TER 24717 WAT 8759 ATOM 24717 O WAT 8760 106.881 117.047 79.988 1.00 0.00 O ATOM 24718 H1 WAT 8760 106.221 117.291 80.637 1.00 0.00 H ATOM 24719 H2 WAT 8760 106.772 116.102 79.879 1.00 0.00 H TER 24721 WAT 8760 ATOM 24721 O WAT 8761 77.443 37.809 94.310 1.00 0.00 O ATOM 24722 H1 WAT 8761 77.806 38.592 93.897 1.00 0.00 H ATOM 24723 H2 WAT 8761 78.166 37.451 94.825 1.00 0.00 H TER 24725 WAT 8761 ATOM 24725 O WAT 8762 12.206 121.531 13.688 1.00 0.00 O ATOM 24726 H1 WAT 8762 11.285 121.724 13.511 1.00 0.00 H ATOM 24727 H2 WAT 8762 12.197 120.659 14.082 1.00 0.00 H TER 24729 WAT 8762 ATOM 24729 O WAT 8763 103.568 72.125 7.881 1.00 0.00 O ATOM 24730 H1 WAT 8763 103.543 72.946 7.389 1.00 0.00 H ATOM 24731 H2 WAT 8763 103.276 72.364 8.761 1.00 0.00 H TER 24733 WAT 8763 ATOM 24733 O WAT 8764 42.895 12.739 70.418 1.00 0.00 O ATOM 24734 H1 WAT 8764 42.991 13.547 70.923 1.00 0.00 H ATOM 24735 H2 WAT 8764 42.639 13.033 69.544 1.00 0.00 H TER 24737 WAT 8764 ATOM 24737 O WAT 8765 85.313 145.199 65.890 1.00 0.00 O ATOM 24738 H1 WAT 8765 86.087 144.639 65.828 1.00 0.00 H ATOM 24739 H2 WAT 8765 85.589 146.033 65.510 1.00 0.00 H TER 24741 WAT 8765 ATOM 24741 O WAT 8766 48.333 41.352 135.411 1.00 0.00 O ATOM 24742 H1 WAT 8766 49.202 41.376 135.009 1.00 0.00 H ATOM 24743 H2 WAT 8766 47.804 41.939 134.871 1.00 0.00 H TER 24745 WAT 8766 ATOM 24745 O WAT 8767 106.419 42.568 12.775 1.00 0.00 O ATOM 24746 H1 WAT 8767 107.150 42.175 13.252 1.00 0.00 H ATOM 24747 H2 WAT 8767 106.534 42.270 11.872 1.00 0.00 H TER 24749 WAT 8767 ATOM 24749 O WAT 8768 104.731 123.101 70.582 1.00 0.00 O ATOM 24750 H1 WAT 8768 104.179 123.883 70.552 1.00 0.00 H ATOM 24751 H2 WAT 8768 105.469 123.307 70.008 1.00 0.00 H TER 24753 WAT 8768 ATOM 24753 O WAT 8769 51.282 2.965 87.266 1.00 0.00 O ATOM 24754 H1 WAT 8769 51.237 2.065 87.588 1.00 0.00 H ATOM 24755 H2 WAT 8769 50.550 3.409 87.695 1.00 0.00 H TER 24757 WAT 8769 ATOM 24757 O WAT 8770 138.627 42.502 123.292 1.00 0.00 O ATOM 24758 H1 WAT 8770 139.323 42.762 123.896 1.00 0.00 H ATOM 24759 H2 WAT 8770 138.949 41.695 122.890 1.00 0.00 H TER 24761 WAT 8770 ATOM 24761 O WAT 8771 140.210 83.816 124.853 1.00 0.00 O ATOM 24762 H1 WAT 8771 140.413 84.744 124.735 1.00 0.00 H ATOM 24763 H2 WAT 8771 139.821 83.765 125.726 1.00 0.00 H TER 24765 WAT 8771 ATOM 24765 O WAT 8772 62.622 29.302 129.449 1.00 0.00 O ATOM 24766 H1 WAT 8772 62.974 29.684 128.645 1.00 0.00 H ATOM 24767 H2 WAT 8772 61.682 29.477 129.406 1.00 0.00 H TER 24769 WAT 8772 ATOM 24769 O WAT 8773 143.860 78.340 95.639 1.00 0.00 O ATOM 24770 H1 WAT 8773 143.671 78.746 96.485 1.00 0.00 H ATOM 24771 H2 WAT 8773 143.436 78.911 94.999 1.00 0.00 H TER 24773 WAT 8773 ATOM 24773 O WAT 8774 108.913 116.300 7.739 1.00 0.00 O ATOM 24774 H1 WAT 8774 108.354 115.526 7.684 1.00 0.00 H ATOM 24775 H2 WAT 8774 109.645 116.029 8.294 1.00 0.00 H TER 24777 WAT 8774 ATOM 24777 O WAT 8775 16.971 118.893 105.211 1.00 0.00 O ATOM 24778 H1 WAT 8775 17.768 118.947 104.684 1.00 0.00 H ATOM 24779 H2 WAT 8775 16.513 118.123 104.874 1.00 0.00 H TER 24781 WAT 8775 ATOM 24781 O WAT 8776 139.218 113.964 86.230 1.00 0.00 O ATOM 24782 H1 WAT 8776 139.283 113.127 86.690 1.00 0.00 H ATOM 24783 H2 WAT 8776 138.872 113.737 85.367 1.00 0.00 H TER 24785 WAT 8776 ATOM 24785 O WAT 8777 77.745 94.850 134.150 1.00 0.00 O ATOM 24786 H1 WAT 8777 78.522 94.347 134.394 1.00 0.00 H ATOM 24787 H2 WAT 8777 77.902 95.723 134.509 1.00 0.00 H TER 24789 WAT 8777 ATOM 24789 O WAT 8778 99.227 80.284 103.478 1.00 0.00 O ATOM 24790 H1 WAT 8778 98.381 80.569 103.133 1.00 0.00 H ATOM 24791 H2 WAT 8778 99.395 80.872 104.215 1.00 0.00 H TER 24793 WAT 8778 ATOM 24793 O WAT 8779 126.172 23.865 67.540 1.00 0.00 O ATOM 24794 H1 WAT 8779 126.292 24.578 66.913 1.00 0.00 H ATOM 24795 H2 WAT 8779 125.266 23.958 67.837 1.00 0.00 H TER 24797 WAT 8779 ATOM 24797 O WAT 8780 17.663 34.113 141.722 1.00 0.00 O ATOM 24798 H1 WAT 8780 17.898 33.474 141.049 1.00 0.00 H ATOM 24799 H2 WAT 8780 17.747 34.961 141.287 1.00 0.00 H TER 24801 WAT 8780 ATOM 24801 O WAT 8781 54.646 124.486 62.396 1.00 0.00 O ATOM 24802 H1 WAT 8781 55.002 125.138 62.999 1.00 0.00 H ATOM 24803 H2 WAT 8781 54.084 123.936 62.942 1.00 0.00 H TER 24805 WAT 8781 ATOM 24805 O WAT 8782 87.511 132.395 80.421 1.00 0.00 O ATOM 24806 H1 WAT 8782 87.265 132.394 79.496 1.00 0.00 H ATOM 24807 H2 WAT 8782 87.212 133.244 80.748 1.00 0.00 H TER 24809 WAT 8782 ATOM 24809 O WAT 8783 87.760 84.704 107.825 1.00 0.00 O ATOM 24810 H1 WAT 8783 87.332 83.861 107.978 1.00 0.00 H ATOM 24811 H2 WAT 8783 88.691 84.525 107.953 1.00 0.00 H TER 24813 WAT 8783 ATOM 24813 O WAT 8784 110.476 57.089 154.076 1.00 0.00 O ATOM 24814 H1 WAT 8784 111.105 56.405 153.846 1.00 0.00 H ATOM 24815 H2 WAT 8784 109.796 56.632 154.570 1.00 0.00 H TER 24817 WAT 8784 ATOM 24817 O WAT 8785 131.068 107.263 69.149 1.00 0.00 O ATOM 24818 H1 WAT 8785 131.333 107.100 68.245 1.00 0.00 H ATOM 24819 H2 WAT 8785 131.890 107.290 69.639 1.00 0.00 H TER 24821 WAT 8785 ATOM 24821 O WAT 8786 44.919 88.290 95.261 1.00 0.00 O ATOM 24822 H1 WAT 8786 44.084 88.185 94.804 1.00 0.00 H ATOM 24823 H2 WAT 8786 44.812 89.092 95.772 1.00 0.00 H TER 24825 WAT 8786 ATOM 24825 O WAT 8787 116.717 102.193 98.914 1.00 0.00 O ATOM 24826 H1 WAT 8787 117.411 101.533 98.913 1.00 0.00 H ATOM 24827 H2 WAT 8787 115.919 101.702 99.112 1.00 0.00 H TER 24829 WAT 8787 ATOM 24829 O WAT 8788 36.641 3.029 14.229 1.00 0.00 O ATOM 24830 H1 WAT 8788 36.693 2.115 14.508 1.00 0.00 H ATOM 24831 H2 WAT 8788 36.922 3.530 14.994 1.00 0.00 H TER 24833 WAT 8788 ATOM 24833 O WAT 8789 130.408 21.632 90.368 1.00 0.00 O ATOM 24834 H1 WAT 8789 129.581 21.178 90.208 1.00 0.00 H ATOM 24835 H2 WAT 8789 130.303 22.480 89.935 1.00 0.00 H TER 24837 WAT 8789 ATOM 24837 O WAT 8790 131.574 141.569 5.018 1.00 0.00 O ATOM 24838 H1 WAT 8790 131.402 140.642 5.180 1.00 0.00 H ATOM 24839 H2 WAT 8790 131.671 141.633 4.068 1.00 0.00 H TER 24841 WAT 8790 ATOM 24841 O WAT 8791 38.662 106.713 98.871 1.00 0.00 O ATOM 24842 H1 WAT 8791 38.240 107.518 99.172 1.00 0.00 H ATOM 24843 H2 WAT 8791 39.510 106.999 98.532 1.00 0.00 H TER 24845 WAT 8791 ATOM 24845 O WAT 8792 11.576 135.476 126.324 1.00 0.00 O ATOM 24846 H1 WAT 8792 10.754 135.663 126.779 1.00 0.00 H ATOM 24847 H2 WAT 8792 12.126 136.239 126.504 1.00 0.00 H TER 24849 WAT 8792 ATOM 24849 O WAT 8793 61.980 136.269 126.230 1.00 0.00 O ATOM 24850 H1 WAT 8793 62.588 135.537 126.332 1.00 0.00 H ATOM 24851 H2 WAT 8793 62.401 136.843 125.590 1.00 0.00 H TER 24853 WAT 8793 ATOM 24853 O WAT 8794 108.339 109.680 158.075 1.00 0.00 O ATOM 24854 H1 WAT 8794 109.012 109.617 157.398 1.00 0.00 H ATOM 24855 H2 WAT 8794 107.730 110.341 157.746 1.00 0.00 H TER 24857 WAT 8794 ATOM 24857 O WAT 8795 74.187 82.800 103.942 1.00 0.00 O ATOM 24858 H1 WAT 8795 73.379 82.463 103.555 1.00 0.00 H ATOM 24859 H2 WAT 8795 74.112 82.592 104.873 1.00 0.00 H TER 24861 WAT 8795 ATOM 24861 O WAT 8796 129.212 1.653 122.652 1.00 0.00 O ATOM 24862 H1 WAT 8796 129.444 2.386 122.082 1.00 0.00 H ATOM 24863 H2 WAT 8796 129.176 2.034 123.529 1.00 0.00 H TER 24865 WAT 8796 ATOM 24865 O WAT 8797 96.133 34.842 123.692 1.00 0.00 O ATOM 24866 H1 WAT 8797 95.491 35.400 123.253 1.00 0.00 H ATOM 24867 H2 WAT 8797 95.815 34.775 124.593 1.00 0.00 H TER 24869 WAT 8797 ATOM 24869 O WAT 8798 117.110 81.067 21.655 1.00 0.00 O ATOM 24870 H1 WAT 8798 117.240 80.258 21.160 1.00 0.00 H ATOM 24871 H2 WAT 8798 117.954 81.515 21.609 1.00 0.00 H TER 24873 WAT 8798 ATOM 24873 O WAT 8799 111.362 13.646 148.054 1.00 0.00 O ATOM 24874 H1 WAT 8799 110.481 13.287 148.153 1.00 0.00 H ATOM 24875 H2 WAT 8799 111.252 14.394 147.468 1.00 0.00 H TER 24877 WAT 8799 ATOM 24877 O WAT 8800 82.482 75.649 121.209 1.00 0.00 O ATOM 24878 H1 WAT 8800 83.099 76.002 121.851 1.00 0.00 H ATOM 24879 H2 WAT 8800 81.777 76.295 121.174 1.00 0.00 H TER 24881 WAT 8800 ATOM 24881 O WAT 8801 115.228 87.873 77.293 1.00 0.00 O ATOM 24882 H1 WAT 8801 115.645 88.734 77.266 1.00 0.00 H ATOM 24883 H2 WAT 8801 114.316 88.040 77.055 1.00 0.00 H TER 24885 WAT 8801 ATOM 24885 O WAT 8802 88.486 98.273 67.168 1.00 0.00 O ATOM 24886 H1 WAT 8802 89.326 98.092 67.591 1.00 0.00 H ATOM 24887 H2 WAT 8802 88.388 99.223 67.225 1.00 0.00 H TER 24889 WAT 8802 ATOM 24889 O WAT 8803 113.750 49.218 141.617 1.00 0.00 O ATOM 24890 H1 WAT 8803 114.190 49.695 140.913 1.00 0.00 H ATOM 24891 H2 WAT 8803 114.403 49.164 142.315 1.00 0.00 H TER 24893 WAT 8803 ATOM 24893 O WAT 8804 139.217 135.969 69.001 1.00 0.00 O ATOM 24894 H1 WAT 8804 139.561 136.226 68.145 1.00 0.00 H ATOM 24895 H2 WAT 8804 138.286 135.808 68.846 1.00 0.00 H TER 24897 WAT 8804 ATOM 24897 O WAT 8805 76.959 144.691 130.219 1.00 0.00 O ATOM 24898 H1 WAT 8805 76.163 145.017 130.638 1.00 0.00 H ATOM 24899 H2 WAT 8805 77.638 145.316 130.474 1.00 0.00 H TER 24901 WAT 8805 ATOM 24901 O WAT 8806 124.486 93.277 116.085 1.00 0.00 O ATOM 24902 H1 WAT 8806 123.628 93.532 116.425 1.00 0.00 H ATOM 24903 H2 WAT 8806 125.110 93.633 116.717 1.00 0.00 H TER 24905 WAT 8806 ATOM 24905 O WAT 8807 15.201 90.616 136.210 1.00 0.00 O ATOM 24906 H1 WAT 8807 15.288 90.137 137.035 1.00 0.00 H ATOM 24907 H2 WAT 8807 14.740 91.420 136.448 1.00 0.00 H TER 24909 WAT 8807 ATOM 24909 O WAT 8808 35.870 98.073 83.271 1.00 0.00 O ATOM 24910 H1 WAT 8808 35.361 97.649 82.581 1.00 0.00 H ATOM 24911 H2 WAT 8808 35.234 98.245 83.966 1.00 0.00 H TER 24913 WAT 8808 ATOM 24913 O WAT 8809 3.714 17.844 1.598 1.00 0.00 O ATOM 24914 H1 WAT 8809 4.566 18.035 1.206 1.00 0.00 H ATOM 24915 H2 WAT 8809 3.125 18.497 1.220 1.00 0.00 H TER 24917 WAT 8809 ATOM 24917 O WAT 8810 130.584 95.912 125.390 1.00 0.00 O ATOM 24918 H1 WAT 8810 130.945 95.025 125.369 1.00 0.00 H ATOM 24919 H2 WAT 8810 130.112 95.959 126.221 1.00 0.00 H TER 24921 WAT 8810 ATOM 24921 O WAT 8811 128.154 66.552 145.040 1.00 0.00 O ATOM 24922 H1 WAT 8811 128.212 65.654 145.366 1.00 0.00 H ATOM 24923 H2 WAT 8811 128.532 66.513 144.162 1.00 0.00 H TER 24925 WAT 8811 ATOM 24925 O WAT 8812 36.877 131.241 65.478 1.00 0.00 O ATOM 24926 H1 WAT 8812 37.593 131.837 65.257 1.00 0.00 H ATOM 24927 H2 WAT 8812 36.396 131.692 66.172 1.00 0.00 H TER 24929 WAT 8812 ATOM 24929 O WAT 8813 72.750 52.075 1.114 1.00 0.00 O ATOM 24930 H1 WAT 8813 72.464 51.601 0.332 1.00 0.00 H ATOM 24931 H2 WAT 8813 71.941 52.262 1.590 1.00 0.00 H TER 24933 WAT 8813 ATOM 24933 O WAT 8814 117.615 97.475 94.256 1.00 0.00 O ATOM 24934 H1 WAT 8814 116.875 97.099 94.733 1.00 0.00 H ATOM 24935 H2 WAT 8814 117.335 97.475 93.341 1.00 0.00 H TER 24937 WAT 8814 ATOM 24937 O WAT 8815 32.496 5.662 147.238 1.00 0.00 O ATOM 24938 H1 WAT 8815 31.610 5.752 147.589 1.00 0.00 H ATOM 24939 H2 WAT 8815 32.465 4.865 146.709 1.00 0.00 H TER 24941 WAT 8815 ATOM 24941 O WAT 8816 97.742 52.373 84.092 1.00 0.00 O ATOM 24942 H1 WAT 8816 96.918 51.914 83.929 1.00 0.00 H ATOM 24943 H2 WAT 8816 97.856 52.331 85.042 1.00 0.00 H TER 24945 WAT 8816 ATOM 24945 O WAT 8817 126.721 138.922 15.895 1.00 0.00 O ATOM 24946 H1 WAT 8817 126.718 139.654 15.278 1.00 0.00 H ATOM 24947 H2 WAT 8817 126.873 139.329 16.748 1.00 0.00 H TER 24949 WAT 8817 ATOM 24949 O WAT 8818 3.729 68.454 65.172 1.00 0.00 O ATOM 24950 H1 WAT 8818 2.925 68.669 65.646 1.00 0.00 H ATOM 24951 H2 WAT 8818 3.486 67.720 64.609 1.00 0.00 H TER 24953 WAT 8818 ATOM 24953 O WAT 8819 16.171 54.999 125.179 1.00 0.00 O ATOM 24954 H1 WAT 8819 16.613 55.844 125.259 1.00 0.00 H ATOM 24955 H2 WAT 8819 16.801 54.365 125.523 1.00 0.00 H TER 24957 WAT 8819 ATOM 24957 O WAT 8820 94.432 96.077 13.681 1.00 0.00 O ATOM 24958 H1 WAT 8820 93.976 96.814 14.088 1.00 0.00 H ATOM 24959 H2 WAT 8820 93.830 95.766 13.005 1.00 0.00 H TER 24961 WAT 8820 ATOM 24961 O WAT 8821 57.065 32.841 72.586 1.00 0.00 O ATOM 24962 H1 WAT 8821 56.493 32.085 72.454 1.00 0.00 H ATOM 24963 H2 WAT 8821 57.832 32.659 72.044 1.00 0.00 H TER 24965 WAT 8821 ATOM 24965 O WAT 8822 106.499 104.545 99.868 1.00 0.00 O ATOM 24966 H1 WAT 8822 106.927 105.234 99.360 1.00 0.00 H ATOM 24967 H2 WAT 8822 107.217 104.092 100.311 1.00 0.00 H TER 24969 WAT 8822 ATOM 24969 O WAT 8823 5.421 51.037 1.325 1.00 0.00 O ATOM 24970 H1 WAT 8823 6.286 50.684 1.531 1.00 0.00 H ATOM 24971 H2 WAT 8823 4.961 51.049 2.164 1.00 0.00 H TER 24973 WAT 8823 ATOM 24973 O WAT 8824 102.556 39.868 109.077 1.00 0.00 O ATOM 24974 H1 WAT 8824 102.219 40.764 109.090 1.00 0.00 H ATOM 24975 H2 WAT 8824 103.503 39.970 108.982 1.00 0.00 H TER 24977 WAT 8824 ATOM 24977 O WAT 8825 31.185 74.363 110.072 1.00 0.00 O ATOM 24978 H1 WAT 8825 31.860 74.815 109.565 1.00 0.00 H ATOM 24979 H2 WAT 8825 31.672 73.758 110.633 1.00 0.00 H TER 24981 WAT 8825 ATOM 24981 O WAT 8826 47.845 28.045 151.873 1.00 0.00 O ATOM 24982 H1 WAT 8826 47.348 27.242 152.027 1.00 0.00 H ATOM 24983 H2 WAT 8826 48.414 28.125 152.638 1.00 0.00 H TER 24985 WAT 8826 ATOM 24985 O WAT 8827 54.904 2.825 102.788 1.00 0.00 O ATOM 24986 H1 WAT 8827 55.734 2.474 102.464 1.00 0.00 H ATOM 24987 H2 WAT 8827 54.950 3.762 102.601 1.00 0.00 H TER 24989 WAT 8827 ATOM 24989 O WAT 8828 69.445 1.216 78.064 1.00 0.00 O ATOM 24990 H1 WAT 8828 69.005 2.056 78.194 1.00 0.00 H ATOM 24991 H2 WAT 8828 69.745 0.965 78.938 1.00 0.00 H TER 24993 WAT 8828 ATOM 24993 O WAT 8829 98.534 90.975 137.768 1.00 0.00 O ATOM 24994 H1 WAT 8829 98.084 91.744 138.118 1.00 0.00 H ATOM 24995 H2 WAT 8829 98.637 90.394 138.521 1.00 0.00 H TER 24997 WAT 8829 ATOM 24997 O WAT 8830 16.448 127.913 74.782 1.00 0.00 O ATOM 24998 H1 WAT 8830 15.530 127.893 74.512 1.00 0.00 H ATOM 24999 H2 WAT 8830 16.573 127.096 75.266 1.00 0.00 H TER 25001 WAT 8830 ATOM 25001 O WAT 8831 121.716 85.611 3.585 1.00 0.00 O ATOM 25002 H1 WAT 8831 121.274 85.664 4.433 1.00 0.00 H ATOM 25003 H2 WAT 8831 122.603 85.320 3.795 1.00 0.00 H TER 25005 WAT 8831 ATOM 25005 O WAT 8832 24.800 27.108 58.254 1.00 0.00 O ATOM 25006 H1 WAT 8832 25.451 26.874 57.592 1.00 0.00 H ATOM 25007 H2 WAT 8832 24.121 26.438 58.168 1.00 0.00 H TER 25009 WAT 8832 ATOM 25009 O WAT 8833 142.682 64.738 8.969 1.00 0.00 O ATOM 25010 H1 WAT 8833 142.941 65.054 8.104 1.00 0.00 H ATOM 25011 H2 WAT 8833 143.503 64.470 9.381 1.00 0.00 H TER 25013 WAT 8833 ATOM 25013 O WAT 8834 73.845 25.467 134.627 1.00 0.00 O ATOM 25014 H1 WAT 8834 73.166 25.298 135.281 1.00 0.00 H ATOM 25015 H2 WAT 8834 73.833 26.416 134.508 1.00 0.00 H TER 25017 WAT 8834 ATOM 25017 O WAT 8835 60.814 30.850 6.659 1.00 0.00 O ATOM 25018 H1 WAT 8835 61.558 31.054 6.092 1.00 0.00 H ATOM 25019 H2 WAT 8835 60.312 31.664 6.696 1.00 0.00 H TER 25021 WAT 8835 ATOM 25021 O WAT 8836 76.246 44.001 76.787 1.00 0.00 O ATOM 25022 H1 WAT 8836 76.955 44.534 76.428 1.00 0.00 H ATOM 25023 H2 WAT 8836 76.689 43.252 77.186 1.00 0.00 H TER 25025 WAT 8836 ATOM 25025 O WAT 8837 74.362 25.632 153.365 1.00 0.00 O ATOM 25026 H1 WAT 8837 73.465 25.947 153.474 1.00 0.00 H ATOM 25027 H2 WAT 8837 74.908 26.397 153.547 1.00 0.00 H TER 25029 WAT 8837 ATOM 25029 O WAT 8838 59.709 95.527 118.672 1.00 0.00 O ATOM 25030 H1 WAT 8838 59.239 95.424 117.844 1.00 0.00 H ATOM 25031 H2 WAT 8838 60.438 96.111 118.463 1.00 0.00 H TER 25033 WAT 8838 ATOM 25033 O WAT 8839 93.883 130.919 101.151 1.00 0.00 O ATOM 25034 H1 WAT 8839 94.767 130.752 100.823 1.00 0.00 H ATOM 25035 H2 WAT 8839 93.805 131.873 101.153 1.00 0.00 H TER 25037 WAT 8839 ATOM 25037 O WAT 8840 42.292 27.627 25.192 1.00 0.00 O ATOM 25038 H1 WAT 8840 41.344 27.736 25.115 1.00 0.00 H ATOM 25039 H2 WAT 8840 42.551 28.251 25.870 1.00 0.00 H TER 25041 WAT 8840 ATOM 25041 O WAT 8841 127.508 21.565 103.610 1.00 0.00 O ATOM 25042 H1 WAT 8841 127.203 21.913 102.772 1.00 0.00 H ATOM 25043 H2 WAT 8841 126.708 21.416 104.114 1.00 0.00 H TER 25045 WAT 8841 ATOM 25045 O WAT 8842 66.787 32.667 106.890 1.00 0.00 O ATOM 25046 H1 WAT 8842 66.640 31.741 107.081 1.00 0.00 H ATOM 25047 H2 WAT 8842 67.692 32.708 106.583 1.00 0.00 H TER 25049 WAT 8842 ATOM 25049 O WAT 8843 90.086 111.509 84.905 1.00 0.00 O ATOM 25050 H1 WAT 8843 89.896 111.306 83.990 1.00 0.00 H ATOM 25051 H2 WAT 8843 90.958 111.144 85.055 1.00 0.00 H TER 25053 WAT 8843 ATOM 25053 O WAT 8844 101.928 142.728 119.390 1.00 0.00 O ATOM 25054 H1 WAT 8844 101.467 142.015 118.948 1.00 0.00 H ATOM 25055 H2 WAT 8844 102.849 142.469 119.367 1.00 0.00 H TER 25057 WAT 8844 ATOM 25057 O WAT 8845 29.861 115.363 5.835 1.00 0.00 O ATOM 25058 H1 WAT 8845 30.584 115.603 6.415 1.00 0.00 H ATOM 25059 H2 WAT 8845 29.791 116.097 5.224 1.00 0.00 H TER 25061 WAT 8845 ATOM 25061 O WAT 8846 75.888 42.786 134.958 1.00 0.00 O ATOM 25062 H1 WAT 8846 76.174 42.759 135.871 1.00 0.00 H ATOM 25063 H2 WAT 8846 76.613 43.202 134.492 1.00 0.00 H TER 25065 WAT 8846 ATOM 25065 O WAT 8847 142.698 92.899 66.166 1.00 0.00 O ATOM 25066 H1 WAT 8847 142.993 93.104 67.054 1.00 0.00 H ATOM 25067 H2 WAT 8847 143.118 92.063 65.961 1.00 0.00 H TER 25069 WAT 8847 ATOM 25069 O WAT 8848 23.725 131.845 17.503 1.00 0.00 O ATOM 25070 H1 WAT 8848 24.415 131.772 16.843 1.00 0.00 H ATOM 25071 H2 WAT 8848 23.927 131.157 18.138 1.00 0.00 H TER 25073 WAT 8848 ATOM 25073 O WAT 8849 104.898 45.520 77.184 1.00 0.00 O ATOM 25074 H1 WAT 8849 104.631 46.025 77.951 1.00 0.00 H ATOM 25075 H2 WAT 8849 104.799 44.606 77.453 1.00 0.00 H TER 25077 WAT 8849 ATOM 25077 O WAT 8850 77.557 77.030 21.160 1.00 0.00 O ATOM 25078 H1 WAT 8850 77.734 77.545 20.372 1.00 0.00 H ATOM 25079 H2 WAT 8850 77.831 77.596 21.882 1.00 0.00 H TER 25081 WAT 8850 ATOM 25081 O WAT 8851 92.292 11.335 15.167 1.00 0.00 O ATOM 25082 H1 WAT 8851 91.479 11.783 14.934 1.00 0.00 H ATOM 25083 H2 WAT 8851 92.060 10.407 15.175 1.00 0.00 H TER 25085 WAT 8851 ATOM 25085 O WAT 8852 34.723 104.571 120.581 1.00 0.00 O ATOM 25086 H1 WAT 8852 35.569 104.270 120.249 1.00 0.00 H ATOM 25087 H2 WAT 8852 34.944 105.158 121.304 1.00 0.00 H TER 25089 WAT 8852 ATOM 25089 O WAT 8853 0.835 63.786 55.887 1.00 0.00 O ATOM 25090 H1 WAT 8853 0.703 62.926 55.487 1.00 0.00 H ATOM 25091 H2 WAT 8853 0.659 63.646 56.818 1.00 0.00 H TER 25093 WAT 8853 ATOM 25093 O WAT 8854 99.860 31.539 81.422 1.00 0.00 O ATOM 25094 H1 WAT 8854 99.625 31.026 82.195 1.00 0.00 H ATOM 25095 H2 WAT 8854 99.048 31.980 81.172 1.00 0.00 H TER 25097 WAT 8854 ATOM 25097 O WAT 8855 2.044 21.366 24.539 1.00 0.00 O ATOM 25098 H1 WAT 8855 2.176 22.314 24.545 1.00 0.00 H ATOM 25099 H2 WAT 8855 2.809 21.015 24.996 1.00 0.00 H TER 25101 WAT 8855 ATOM 25101 O WAT 8856 24.532 26.205 11.205 1.00 0.00 O ATOM 25102 H1 WAT 8856 25.378 26.445 10.827 1.00 0.00 H ATOM 25103 H2 WAT 8856 23.895 26.730 10.721 1.00 0.00 H TER 25105 WAT 8856 ATOM 25105 O WAT 8857 129.823 51.305 105.319 1.00 0.00 O ATOM 25106 H1 WAT 8857 129.564 50.384 105.314 1.00 0.00 H ATOM 25107 H2 WAT 8857 129.049 51.770 105.635 1.00 0.00 H TER 25109 WAT 8857 ATOM 25109 O WAT 8858 58.539 79.484 20.746 1.00 0.00 O ATOM 25110 H1 WAT 8858 57.797 79.524 21.349 1.00 0.00 H ATOM 25111 H2 WAT 8858 59.249 79.928 21.209 1.00 0.00 H TER 25113 WAT 8858 ATOM 25113 O WAT 8859 79.929 17.590 127.017 1.00 0.00 O ATOM 25114 H1 WAT 8859 79.125 17.365 127.485 1.00 0.00 H ATOM 25115 H2 WAT 8859 80.573 16.953 127.327 1.00 0.00 H TER 25117 WAT 8859 ATOM 25117 O WAT 8860 94.384 121.071 114.494 1.00 0.00 O ATOM 25118 H1 WAT 8860 95.223 120.625 114.608 1.00 0.00 H ATOM 25119 H2 WAT 8860 94.213 121.024 113.553 1.00 0.00 H TER 25121 WAT 8860 ATOM 25121 O WAT 8861 127.550 141.836 134.100 1.00 0.00 O ATOM 25122 H1 WAT 8861 128.428 141.504 133.912 1.00 0.00 H ATOM 25123 H2 WAT 8861 127.390 142.490 133.420 1.00 0.00 H TER 25125 WAT 8861 ATOM 25125 O WAT 8862 14.449 93.217 137.904 1.00 0.00 O ATOM 25126 H1 WAT 8862 15.170 93.587 138.413 1.00 0.00 H ATOM 25127 H2 WAT 8862 13.659 93.513 138.356 1.00 0.00 H TER 25129 WAT 8862 ATOM 25129 O WAT 8863 137.688 142.441 106.954 1.00 0.00 O ATOM 25130 H1 WAT 8863 137.079 141.711 107.070 1.00 0.00 H ATOM 25131 H2 WAT 8863 138.509 142.028 106.688 1.00 0.00 H TER 25133 WAT 8863 ATOM 25133 O WAT 8864 32.995 12.012 145.725 1.00 0.00 O ATOM 25134 H1 WAT 8864 33.007 12.088 144.771 1.00 0.00 H ATOM 25135 H2 WAT 8864 32.867 11.078 145.889 1.00 0.00 H TER 25137 WAT 8864 ATOM 25137 O WAT 8865 100.226 141.562 95.074 1.00 0.00 O ATOM 25138 H1 WAT 8865 100.022 142.480 95.251 1.00 0.00 H ATOM 25139 H2 WAT 8865 100.230 141.145 95.936 1.00 0.00 H TER 25141 WAT 8865 ATOM 25141 O WAT 8866 81.823 18.158 10.697 1.00 0.00 O ATOM 25142 H1 WAT 8866 82.488 18.527 11.277 1.00 0.00 H ATOM 25143 H2 WAT 8866 81.030 18.126 11.232 1.00 0.00 H TER 25145 WAT 8866 ATOM 25145 O WAT 8867 107.723 89.676 130.050 1.00 0.00 O ATOM 25146 H1 WAT 8867 107.385 90.364 130.624 1.00 0.00 H ATOM 25147 H2 WAT 8867 108.424 89.265 130.556 1.00 0.00 H TER 25149 WAT 8867 ATOM 25149 O WAT 8868 41.349 103.863 136.190 1.00 0.00 O ATOM 25150 H1 WAT 8868 42.085 103.786 135.583 1.00 0.00 H ATOM 25151 H2 WAT 8868 40.932 104.693 135.959 1.00 0.00 H TER 25153 WAT 8868 ATOM 25153 O WAT 8869 106.772 110.161 99.025 1.00 0.00 O ATOM 25154 H1 WAT 8869 106.543 110.963 99.496 1.00 0.00 H ATOM 25155 H2 WAT 8869 105.930 109.749 98.831 1.00 0.00 H TER 25157 WAT 8869 ATOM 25157 O WAT 8870 114.336 90.593 10.416 1.00 0.00 O ATOM 25158 H1 WAT 8870 115.034 91.226 10.582 1.00 0.00 H ATOM 25159 H2 WAT 8870 114.139 90.693 9.485 1.00 0.00 H TER 25161 WAT 8870 ATOM 25161 O WAT 8871 113.528 36.908 134.042 1.00 0.00 O ATOM 25162 H1 WAT 8871 112.612 36.974 134.314 1.00 0.00 H ATOM 25163 H2 WAT 8871 113.985 36.579 134.816 1.00 0.00 H TER 25165 WAT 8871 ATOM 25165 O WAT 8872 128.811 89.067 149.875 1.00 0.00 O ATOM 25166 H1 WAT 8872 129.461 89.723 150.125 1.00 0.00 H ATOM 25167 H2 WAT 8872 128.890 88.385 150.541 1.00 0.00 H TER 25169 WAT 8872 ATOM 25169 O WAT 8873 74.836 35.200 100.585 1.00 0.00 O ATOM 25170 H1 WAT 8873 74.100 35.801 100.476 1.00 0.00 H ATOM 25171 H2 WAT 8873 75.611 35.741 100.435 1.00 0.00 H TER 25173 WAT 8873 ATOM 25173 O WAT 8874 124.359 126.171 58.520 1.00 0.00 O ATOM 25174 H1 WAT 8874 124.222 126.798 59.230 1.00 0.00 H ATOM 25175 H2 WAT 8874 124.562 125.347 58.963 1.00 0.00 H TER 25177 WAT 8874 ATOM 25177 O WAT 8875 87.393 83.028 3.729 1.00 0.00 O ATOM 25178 H1 WAT 8875 86.950 82.297 4.159 1.00 0.00 H ATOM 25179 H2 WAT 8875 87.038 83.808 4.155 1.00 0.00 H TER 25181 WAT 8875 ATOM 25181 O WAT 8876 138.162 107.561 140.512 1.00 0.00 O ATOM 25182 H1 WAT 8876 137.221 107.556 140.339 1.00 0.00 H ATOM 25183 H2 WAT 8876 138.540 108.027 139.766 1.00 0.00 H TER 25185 WAT 8876 ATOM 25185 O WAT 8877 112.062 80.354 126.124 1.00 0.00 O ATOM 25186 H1 WAT 8877 113.007 80.386 125.977 1.00 0.00 H ATOM 25187 H2 WAT 8877 111.697 80.093 125.279 1.00 0.00 H TER 25189 WAT 8877 ATOM 25189 O WAT 8878 107.193 24.008 54.840 1.00 0.00 O ATOM 25190 H1 WAT 8878 107.336 23.740 55.748 1.00 0.00 H ATOM 25191 H2 WAT 8878 108.016 23.800 54.397 1.00 0.00 H TER 25193 WAT 8878 ATOM 25193 O WAT 8879 87.501 2.042 135.297 1.00 0.00 O ATOM 25194 H1 WAT 8879 87.294 2.935 135.021 1.00 0.00 H ATOM 25195 H2 WAT 8879 86.784 1.512 134.950 1.00 0.00 H TER 25197 WAT 8879 ATOM 25197 O WAT 8880 113.006 42.885 109.197 1.00 0.00 O ATOM 25198 H1 WAT 8880 113.785 43.438 109.265 1.00 0.00 H ATOM 25199 H2 WAT 8880 112.375 43.419 108.714 1.00 0.00 H TER 25201 WAT 8880 ATOM 25201 O WAT 8881 140.597 8.159 133.800 1.00 0.00 O ATOM 25202 H1 WAT 8881 139.985 7.599 134.278 1.00 0.00 H ATOM 25203 H2 WAT 8881 141.068 7.558 133.222 1.00 0.00 H TER 25205 WAT 8881 ATOM 25205 O WAT 8882 104.491 51.074 71.667 1.00 0.00 O ATOM 25206 H1 WAT 8882 105.068 51.644 71.158 1.00 0.00 H ATOM 25207 H2 WAT 8882 103.898 50.694 71.020 1.00 0.00 H TER 25209 WAT 8882 ATOM 25209 O WAT 8883 65.558 104.528 9.912 1.00 0.00 O ATOM 25210 H1 WAT 8883 64.782 104.229 9.438 1.00 0.00 H ATOM 25211 H2 WAT 8883 65.273 105.325 10.358 1.00 0.00 H TER 25213 WAT 8883 ATOM 25213 O WAT 8884 138.815 145.364 10.745 1.00 0.00 O ATOM 25214 H1 WAT 8884 139.100 146.203 10.383 1.00 0.00 H ATOM 25215 H2 WAT 8884 138.285 145.599 11.506 1.00 0.00 H TER 25217 WAT 8884 ATOM 25217 O WAT 8885 7.513 143.482 14.738 1.00 0.00 O ATOM 25218 H1 WAT 8885 7.074 142.785 14.251 1.00 0.00 H ATOM 25219 H2 WAT 8885 7.968 143.029 15.448 1.00 0.00 H TER 25221 WAT 8885 ATOM 25221 O WAT 8886 133.030 15.246 74.226 1.00 0.00 O ATOM 25222 H1 WAT 8886 133.644 14.679 74.695 1.00 0.00 H ATOM 25223 H2 WAT 8886 133.470 15.443 73.399 1.00 0.00 H TER 25225 WAT 8886 ATOM 25225 O WAT 8887 31.967 107.211 31.802 1.00 0.00 O ATOM 25226 H1 WAT 8887 31.491 106.432 31.517 1.00 0.00 H ATOM 25227 H2 WAT 8887 32.610 107.366 31.109 1.00 0.00 H TER 25229 WAT 8887 ATOM 25229 O WAT 8888 56.500 4.155 94.913 1.00 0.00 O ATOM 25230 H1 WAT 8888 56.592 4.996 95.361 1.00 0.00 H ATOM 25231 H2 WAT 8888 56.462 4.381 93.984 1.00 0.00 H TER 25233 WAT 8888 ATOM 25233 O WAT 8889 131.233 30.626 94.298 1.00 0.00 O ATOM 25234 H1 WAT 8889 130.575 31.311 94.176 1.00 0.00 H ATOM 25235 H2 WAT 8889 131.104 30.035 93.557 1.00 0.00 H TER 25237 WAT 8889 ATOM 25237 O WAT 8890 97.132 91.419 62.183 1.00 0.00 O ATOM 25238 H1 WAT 8890 96.786 90.823 62.846 1.00 0.00 H ATOM 25239 H2 WAT 8890 96.361 91.715 61.700 1.00 0.00 H TER 25241 WAT 8890 ATOM 25241 O WAT 8891 8.012 68.202 123.474 1.00 0.00 O ATOM 25242 H1 WAT 8891 7.530 67.827 122.737 1.00 0.00 H ATOM 25243 H2 WAT 8891 7.631 67.785 124.246 1.00 0.00 H TER 25245 WAT 8891 ATOM 25245 O WAT 8892 41.233 89.019 106.311 1.00 0.00 O ATOM 25246 H1 WAT 8892 40.728 88.635 107.027 1.00 0.00 H ATOM 25247 H2 WAT 8892 41.919 89.526 106.746 1.00 0.00 H TER 25249 WAT 8892 ATOM 25249 O WAT 8893 98.341 36.746 122.496 1.00 0.00 O ATOM 25250 H1 WAT 8893 97.471 36.571 122.855 1.00 0.00 H ATOM 25251 H2 WAT 8893 98.537 37.642 122.769 1.00 0.00 H TER 25253 WAT 8893 ATOM 25253 O WAT 8894 12.677 121.594 76.649 1.00 0.00 O ATOM 25254 H1 WAT 8894 12.390 122.408 77.063 1.00 0.00 H ATOM 25255 H2 WAT 8894 13.595 121.749 76.427 1.00 0.00 H TER 25257 WAT 8894 ATOM 25257 O WAT 8895 45.614 56.770 113.394 1.00 0.00 O ATOM 25258 H1 WAT 8895 45.152 56.652 112.564 1.00 0.00 H ATOM 25259 H2 WAT 8895 45.812 57.706 113.427 1.00 0.00 H TER 25261 WAT 8895 ATOM 25261 O WAT 8896 143.801 72.197 2.620 1.00 0.00 O ATOM 25262 H1 WAT 8896 143.479 71.621 3.313 1.00 0.00 H ATOM 25263 H2 WAT 8896 144.551 72.646 3.010 1.00 0.00 H TER 25265 WAT 8896 ATOM 25265 O WAT 8897 115.528 64.686 146.954 1.00 0.00 O ATOM 25266 H1 WAT 8897 115.158 65.566 146.888 1.00 0.00 H ATOM 25267 H2 WAT 8897 115.199 64.350 147.788 1.00 0.00 H TER 25269 WAT 8897 ATOM 25269 O WAT 8898 45.694 94.323 13.418 1.00 0.00 O ATOM 25270 H1 WAT 8898 45.700 94.187 12.470 1.00 0.00 H ATOM 25271 H2 WAT 8898 45.262 95.169 13.536 1.00 0.00 H TER 25273 WAT 8898 ATOM 25273 O WAT 8899 92.161 123.827 6.139 1.00 0.00 O ATOM 25274 H1 WAT 8899 92.842 123.579 6.765 1.00 0.00 H ATOM 25275 H2 WAT 8899 92.319 123.266 5.380 1.00 0.00 H TER 25277 WAT 8899 ATOM 25277 O WAT 8900 110.452 78.999 151.906 1.00 0.00 O ATOM 25278 H1 WAT 8900 110.305 79.715 151.288 1.00 0.00 H ATOM 25279 H2 WAT 8900 109.612 78.892 152.352 1.00 0.00 H TER 25281 WAT 8900 ATOM 25281 O WAT 8901 0.640 101.494 96.919 1.00 0.00 O ATOM 25282 H1 WAT 8901 0.125 101.045 96.248 1.00 0.00 H ATOM 25283 H2 WAT 8901 0.940 102.297 96.493 1.00 0.00 H TER 25285 WAT 8901 ATOM 25285 O WAT 8902 32.149 77.608 91.570 1.00 0.00 O ATOM 25286 H1 WAT 8902 32.055 77.610 90.617 1.00 0.00 H ATOM 25287 H2 WAT 8902 32.304 78.524 91.797 1.00 0.00 H TER 25289 WAT 8902 ATOM 25289 O WAT 8903 92.825 92.215 137.339 1.00 0.00 O ATOM 25290 H1 WAT 8903 92.693 93.005 136.815 1.00 0.00 H ATOM 25291 H2 WAT 8903 92.893 92.534 138.239 1.00 0.00 H TER 25293 WAT 8903 ATOM 25293 O WAT 8904 72.949 98.946 105.761 1.00 0.00 O ATOM 25294 H1 WAT 8904 73.543 98.734 105.041 1.00 0.00 H ATOM 25295 H2 WAT 8904 72.163 99.285 105.332 1.00 0.00 H TER 25297 WAT 8904 ATOM 25297 O WAT 8905 47.997 105.969 124.920 1.00 0.00 O ATOM 25298 H1 WAT 8905 48.129 105.035 125.080 1.00 0.00 H ATOM 25299 H2 WAT 8905 48.349 106.114 124.042 1.00 0.00 H TER 25301 WAT 8905 ATOM 25301 O WAT 8906 95.855 3.268 154.158 1.00 0.00 O ATOM 25302 H1 WAT 8906 95.441 3.495 154.991 1.00 0.00 H ATOM 25303 H2 WAT 8906 96.666 3.778 154.148 1.00 0.00 H TER 25305 WAT 8906 ATOM 25305 O WAT 8907 94.042 26.143 15.368 1.00 0.00 O ATOM 25306 H1 WAT 8907 93.772 26.296 14.462 1.00 0.00 H ATOM 25307 H2 WAT 8907 93.696 25.276 15.577 1.00 0.00 H TER 25309 WAT 8907 ATOM 25309 O WAT 8908 71.612 142.344 5.233 1.00 0.00 O ATOM 25310 H1 WAT 8908 70.900 142.599 5.819 1.00 0.00 H ATOM 25311 H2 WAT 8908 72.372 142.829 5.554 1.00 0.00 H TER 25313 WAT 8908 ATOM 25313 O WAT 8909 138.424 100.188 158.434 1.00 0.00 O ATOM 25314 H1 WAT 8909 138.487 100.168 157.479 1.00 0.00 H ATOM 25315 H2 WAT 8909 139.089 99.566 158.730 1.00 0.00 H TER 25317 WAT 8909 ATOM 25317 O WAT 8910 79.909 25.989 108.419 1.00 0.00 O ATOM 25318 H1 WAT 8910 80.038 25.467 107.627 1.00 0.00 H ATOM 25319 H2 WAT 8910 80.512 25.607 109.057 1.00 0.00 H TER 25321 WAT 8910 ATOM 25321 O WAT 8911 99.426 75.728 6.923 1.00 0.00 O ATOM 25322 H1 WAT 8911 99.083 74.838 7.013 1.00 0.00 H ATOM 25323 H2 WAT 8911 98.830 76.267 7.442 1.00 0.00 H TER 25325 WAT 8911 ATOM 25325 O WAT 8912 97.365 87.717 74.059 1.00 0.00 O ATOM 25326 H1 WAT 8912 97.951 87.769 74.815 1.00 0.00 H ATOM 25327 H2 WAT 8912 97.412 86.802 73.783 1.00 0.00 H TER 25329 WAT 8912 ATOM 25329 O WAT 8913 83.144 117.806 17.374 1.00 0.00 O ATOM 25330 H1 WAT 8913 82.807 118.477 17.968 1.00 0.00 H ATOM 25331 H2 WAT 8913 84.027 117.622 17.696 1.00 0.00 H TER 25333 WAT 8913 ATOM 25333 O WAT 8914 137.005 11.616 8.307 1.00 0.00 O ATOM 25334 H1 WAT 8914 136.059 11.471 8.302 1.00 0.00 H ATOM 25335 H2 WAT 8914 137.133 12.337 8.924 1.00 0.00 H TER 25337 WAT 8914 ATOM 25337 O WAT 8915 45.918 133.505 81.380 1.00 0.00 O ATOM 25338 H1 WAT 8915 45.153 132.933 81.326 1.00 0.00 H ATOM 25339 H2 WAT 8915 45.692 134.260 80.838 1.00 0.00 H TER 25341 WAT 8915 ATOM 25341 O WAT 8916 68.977 66.169 147.151 1.00 0.00 O ATOM 25342 H1 WAT 8916 69.625 66.858 147.301 1.00 0.00 H ATOM 25343 H2 WAT 8916 69.376 65.606 146.488 1.00 0.00 H TER 25345 WAT 8916 ATOM 25345 O WAT 8917 12.310 73.459 1.674 1.00 0.00 O ATOM 25346 H1 WAT 8917 12.199 73.976 0.876 1.00 0.00 H ATOM 25347 H2 WAT 8917 13.171 73.052 1.577 1.00 0.00 H TER 25349 WAT 8917 ATOM 25349 O WAT 8918 141.858 22.995 60.532 1.00 0.00 O ATOM 25350 H1 WAT 8918 140.997 23.166 60.150 1.00 0.00 H ATOM 25351 H2 WAT 8918 142.479 23.284 59.863 1.00 0.00 H TER 25353 WAT 8918 ATOM 25353 O WAT 8919 53.214 132.100 129.057 1.00 0.00 O ATOM 25354 H1 WAT 8919 52.586 132.815 128.957 1.00 0.00 H ATOM 25355 H2 WAT 8919 53.540 131.942 128.171 1.00 0.00 H TER 25357 WAT 8919 ATOM 25357 O WAT 8920 56.034 71.779 74.766 1.00 0.00 O ATOM 25358 H1 WAT 8920 55.357 71.933 74.107 1.00 0.00 H ATOM 25359 H2 WAT 8920 55.626 71.185 75.395 1.00 0.00 H TER 25361 WAT 8920 ATOM 25361 O WAT 8921 0.272 62.768 90.489 1.00 0.00 O ATOM 25362 H1 WAT 8921 0.972 63.347 90.187 1.00 0.00 H ATOM 25363 H2 WAT 8921 0.570 62.459 91.345 1.00 0.00 H TER 25365 WAT 8921 ATOM 25365 O WAT 8922 66.737 24.148 4.973 1.00 0.00 O ATOM 25366 H1 WAT 8922 67.268 24.046 4.183 1.00 0.00 H ATOM 25367 H2 WAT 8922 66.675 23.265 5.336 1.00 0.00 H TER 25369 WAT 8922 ATOM 25369 O WAT 8923 124.649 35.827 125.575 1.00 0.00 O ATOM 25370 H1 WAT 8923 123.696 35.893 125.520 1.00 0.00 H ATOM 25371 H2 WAT 8923 124.942 35.827 124.663 1.00 0.00 H TER 25373 WAT 8923 ATOM 25373 O WAT 8924 89.518 101.441 86.043 1.00 0.00 O ATOM 25374 H1 WAT 8924 89.967 101.406 85.199 1.00 0.00 H ATOM 25375 H2 WAT 8924 88.627 101.147 85.853 1.00 0.00 H TER 25377 WAT 8924 ATOM 25377 O WAT 8925 138.891 50.569 126.753 1.00 0.00 O ATOM 25378 H1 WAT 8925 138.007 50.202 126.725 1.00 0.00 H ATOM 25379 H2 WAT 8925 138.811 51.420 126.321 1.00 0.00 H TER 25381 WAT 8925 ATOM 25381 O WAT 8926 99.528 84.012 108.260 1.00 0.00 O ATOM 25382 H1 WAT 8926 98.892 83.303 108.170 1.00 0.00 H ATOM 25383 H2 WAT 8926 99.031 84.806 108.063 1.00 0.00 H TER 25385 WAT 8926 ATOM 25385 O WAT 8927 0.197 55.899 151.718 1.00 0.00 O ATOM 25386 H1 WAT 8927 0.696 55.377 152.346 1.00 0.00 H ATOM 25387 H2 WAT 8927 -0.316 56.499 152.260 1.00 0.00 H TER 25389 WAT 8927 ATOM 25389 O WAT 8928 114.965 87.685 147.279 1.00 0.00 O ATOM 25390 H1 WAT 8928 115.141 87.293 146.423 1.00 0.00 H ATOM 25391 H2 WAT 8928 114.577 86.975 147.791 1.00 0.00 H TER 25393 WAT 8928 ATOM 25393 O WAT 8929 59.562 68.021 135.405 1.00 0.00 O ATOM 25394 H1 WAT 8929 58.927 68.628 135.027 1.00 0.00 H ATOM 25395 H2 WAT 8929 60.184 68.582 135.868 1.00 0.00 H TER 25397 WAT 8929 ATOM 25397 O WAT 8930 23.977 12.241 109.361 1.00 0.00 O ATOM 25398 H1 WAT 8930 24.731 11.867 108.904 1.00 0.00 H ATOM 25399 H2 WAT 8930 23.293 12.293 108.693 1.00 0.00 H TER 25401 WAT 8930 ATOM 25401 O WAT 8931 103.103 46.152 129.241 1.00 0.00 O ATOM 25402 H1 WAT 8931 102.191 46.251 128.969 1.00 0.00 H ATOM 25403 H2 WAT 8931 103.584 46.778 128.700 1.00 0.00 H TER 25405 WAT 8931 ATOM 25405 O WAT 8932 45.342 50.555 151.356 1.00 0.00 O ATOM 25406 H1 WAT 8932 46.115 50.152 151.752 1.00 0.00 H ATOM 25407 H2 WAT 8932 44.604 50.063 151.718 1.00 0.00 H TER 25409 WAT 8932 ATOM 25409 O WAT 8933 89.617 67.453 65.194 1.00 0.00 O ATOM 25410 H1 WAT 8933 90.057 68.148 65.683 1.00 0.00 H ATOM 25411 H2 WAT 8933 90.017 67.481 64.324 1.00 0.00 H TER 25413 WAT 8933 ATOM 25413 O WAT 8934 72.938 121.554 78.299 1.00 0.00 O ATOM 25414 H1 WAT 8934 73.048 121.120 79.145 1.00 0.00 H ATOM 25415 H2 WAT 8934 73.088 122.481 78.484 1.00 0.00 H TER 25417 WAT 8934 ATOM 25417 O WAT 8935 55.295 6.435 79.740 1.00 0.00 O ATOM 25418 H1 WAT 8935 55.460 5.715 79.131 1.00 0.00 H ATOM 25419 H2 WAT 8935 54.547 6.142 80.260 1.00 0.00 H TER 25421 WAT 8935 ATOM 25421 O WAT 8936 40.216 50.139 94.993 1.00 0.00 O ATOM 25422 H1 WAT 8936 40.523 50.048 94.091 1.00 0.00 H ATOM 25423 H2 WAT 8936 39.261 50.121 94.924 1.00 0.00 H TER 25425 WAT 8936 ATOM 25425 O WAT 8937 102.006 34.652 84.852 1.00 0.00 O ATOM 25426 H1 WAT 8937 102.442 35.374 85.305 1.00 0.00 H ATOM 25427 H2 WAT 8937 101.742 35.023 84.010 1.00 0.00 H TER 25429 WAT 8937 ATOM 25429 O WAT 8938 32.104 11.152 6.358 1.00 0.00 O ATOM 25430 H1 WAT 8938 32.179 10.595 5.583 1.00 0.00 H ATOM 25431 H2 WAT 8938 31.493 10.687 6.929 1.00 0.00 H TER 25433 WAT 8938 ATOM 25433 O WAT 8939 115.725 43.462 104.353 1.00 0.00 O ATOM 25434 H1 WAT 8939 115.961 43.793 105.220 1.00 0.00 H ATOM 25435 H2 WAT 8939 115.455 44.240 103.866 1.00 0.00 H TER 25437 WAT 8939 ATOM 25437 O WAT 8940 69.994 73.226 146.299 1.00 0.00 O ATOM 25438 H1 WAT 8940 70.627 73.289 147.015 1.00 0.00 H ATOM 25439 H2 WAT 8940 70.369 72.577 145.704 1.00 0.00 H TER 25441 WAT 8940 ATOM 25441 O WAT 8941 128.897 23.035 120.638 1.00 0.00 O ATOM 25442 H1 WAT 8941 128.146 23.622 120.548 1.00 0.00 H ATOM 25443 H2 WAT 8941 129.626 23.517 120.247 1.00 0.00 H TER 25445 WAT 8941 ATOM 25445 O WAT 8942 3.522 64.587 106.379 1.00 0.00 O ATOM 25446 H1 WAT 8942 2.567 64.592 106.440 1.00 0.00 H ATOM 25447 H2 WAT 8942 3.809 64.100 107.151 1.00 0.00 H TER 25449 WAT 8942 ATOM 25449 O WAT 8943 140.547 17.970 104.309 1.00 0.00 O ATOM 25450 H1 WAT 8943 140.586 18.776 104.824 1.00 0.00 H ATOM 25451 H2 WAT 8943 140.520 17.270 104.961 1.00 0.00 H TER 25453 WAT 8943 ATOM 25453 O WAT 8944 60.511 51.555 104.881 1.00 0.00 O ATOM 25454 H1 WAT 8944 60.480 52.259 105.528 1.00 0.00 H ATOM 25455 H2 WAT 8944 59.676 51.099 104.984 1.00 0.00 H TER 25457 WAT 8944 ATOM 25457 O WAT 8945 10.835 48.122 155.875 1.00 0.00 O ATOM 25458 H1 WAT 8945 11.356 47.515 156.400 1.00 0.00 H ATOM 25459 H2 WAT 8945 10.186 47.567 155.442 1.00 0.00 H TER 25461 WAT 8945 ATOM 25461 O WAT 8946 25.296 68.559 8.550 1.00 0.00 O ATOM 25462 H1 WAT 8946 24.847 68.975 9.285 1.00 0.00 H ATOM 25463 H2 WAT 8946 25.221 69.190 7.834 1.00 0.00 H TER 25465 WAT 8946 ATOM 25465 O WAT 8947 117.691 5.308 121.008 1.00 0.00 O ATOM 25466 H1 WAT 8947 118.547 5.728 121.094 1.00 0.00 H ATOM 25467 H2 WAT 8947 117.237 5.824 120.342 1.00 0.00 H TER 25469 WAT 8947 ATOM 25469 O WAT 8948 75.549 117.892 108.616 1.00 0.00 O ATOM 25470 H1 WAT 8948 75.142 117.919 107.750 1.00 0.00 H ATOM 25471 H2 WAT 8948 75.601 118.809 108.884 1.00 0.00 H TER 25473 WAT 8948 ATOM 25473 O WAT 8949 110.470 52.244 156.796 1.00 0.00 O ATOM 25474 H1 WAT 8949 111.083 52.945 156.571 1.00 0.00 H ATOM 25475 H2 WAT 8949 110.403 51.720 155.998 1.00 0.00 H TER 25477 WAT 8949 ATOM 25477 O WAT 8950 78.188 131.730 151.006 1.00 0.00 O ATOM 25478 H1 WAT 8950 77.741 131.535 151.829 1.00 0.00 H ATOM 25479 H2 WAT 8950 78.929 132.280 151.260 1.00 0.00 H TER 25481 WAT 8950 ATOM 25481 O WAT 8951 3.597 45.096 67.772 1.00 0.00 O ATOM 25482 H1 WAT 8951 3.257 45.882 68.198 1.00 0.00 H ATOM 25483 H2 WAT 8951 4.212 44.727 68.406 1.00 0.00 H TER 25485 WAT 8951 ATOM 25485 O WAT 8952 80.127 32.822 141.437 1.00 0.00 O ATOM 25486 H1 WAT 8952 80.433 33.012 140.551 1.00 0.00 H ATOM 25487 H2 WAT 8952 80.280 33.633 141.922 1.00 0.00 H TER 25489 WAT 8952 ATOM 25489 O WAT 8953 95.294 43.327 153.820 1.00 0.00 O ATOM 25490 H1 WAT 8953 96.165 42.951 153.947 1.00 0.00 H ATOM 25491 H2 WAT 8953 95.187 43.937 154.550 1.00 0.00 H TER 25493 WAT 8953 ATOM 25493 O WAT 8954 32.514 54.649 16.619 1.00 0.00 O ATOM 25494 H1 WAT 8954 33.114 54.786 17.352 1.00 0.00 H ATOM 25495 H2 WAT 8954 31.661 54.507 17.031 1.00 0.00 H TER 25497 WAT 8954 ATOM 25497 O WAT 8955 52.417 107.847 114.690 1.00 0.00 O ATOM 25498 H1 WAT 8955 52.115 107.865 115.598 1.00 0.00 H ATOM 25499 H2 WAT 8955 52.115 107.003 114.354 1.00 0.00 H TER 25501 WAT 8955 ATOM 25501 O WAT 8956 84.636 83.678 56.680 1.00 0.00 O ATOM 25502 H1 WAT 8956 84.501 83.176 57.484 1.00 0.00 H ATOM 25503 H2 WAT 8956 83.820 83.570 56.191 1.00 0.00 H TER 25505 WAT 8956 ATOM 25505 O WAT 8957 119.527 109.783 155.781 1.00 0.00 O ATOM 25506 H1 WAT 8957 118.711 109.283 155.755 1.00 0.00 H ATOM 25507 H2 WAT 8957 119.461 110.309 156.578 1.00 0.00 H TER 25509 WAT 8957 ATOM 25509 O WAT 8958 101.431 123.583 135.534 1.00 0.00 O ATOM 25510 H1 WAT 8958 100.721 123.641 136.174 1.00 0.00 H ATOM 25511 H2 WAT 8958 101.109 124.069 134.775 1.00 0.00 H TER 25513 WAT 8958 ATOM 25513 O WAT 8959 130.969 44.998 90.076 1.00 0.00 O ATOM 25514 H1 WAT 8959 131.261 45.383 89.249 1.00 0.00 H ATOM 25515 H2 WAT 8959 131.775 44.707 90.502 1.00 0.00 H TER 25517 WAT 8959 ATOM 25517 O WAT 8960 107.965 121.352 82.974 1.00 0.00 O ATOM 25518 H1 WAT 8960 108.380 122.207 83.085 1.00 0.00 H ATOM 25519 H2 WAT 8960 107.845 121.026 83.867 1.00 0.00 H TER 25521 WAT 8960 ATOM 25521 O WAT 8961 144.039 120.883 131.547 1.00 0.00 O ATOM 25522 H1 WAT 8961 143.113 121.071 131.700 1.00 0.00 H ATOM 25523 H2 WAT 8961 144.264 121.401 130.773 1.00 0.00 H TER 25525 WAT 8961 ATOM 25525 O WAT 8962 49.564 67.146 108.605 1.00 0.00 O ATOM 25526 H1 WAT 8962 49.957 67.466 107.793 1.00 0.00 H ATOM 25527 H2 WAT 8962 49.020 67.873 108.909 1.00 0.00 H TER 25529 WAT 8962 ATOM 25529 O WAT 8963 28.600 53.128 129.325 1.00 0.00 O ATOM 25530 H1 WAT 8963 27.930 52.774 129.911 1.00 0.00 H ATOM 25531 H2 WAT 8963 28.203 53.917 128.956 1.00 0.00 H TER 25533 WAT 8963 ATOM 25533 O WAT 8964 140.463 99.962 28.251 1.00 0.00 O ATOM 25534 H1 WAT 8964 139.726 99.418 28.528 1.00 0.00 H ATOM 25535 H2 WAT 8964 140.234 100.241 27.364 1.00 0.00 H TER 25537 WAT 8964 ATOM 25537 O WAT 8965 2.554 105.634 53.389 1.00 0.00 O ATOM 25538 H1 WAT 8965 1.880 106.295 53.553 1.00 0.00 H ATOM 25539 H2 WAT 8965 2.186 104.824 53.743 1.00 0.00 H TER 25541 WAT 8965 ATOM 25541 O WAT 8966 126.149 120.964 71.293 1.00 0.00 O ATOM 25542 H1 WAT 8966 125.673 120.180 71.566 1.00 0.00 H ATOM 25543 H2 WAT 8966 127.030 120.651 71.089 1.00 0.00 H TER 25545 WAT 8966 ATOM 25545 O WAT 8967 51.149 56.700 145.706 1.00 0.00 O ATOM 25546 H1 WAT 8967 50.792 57.576 145.850 1.00 0.00 H ATOM 25547 H2 WAT 8967 51.894 56.643 146.304 1.00 0.00 H TER 25549 WAT 8967 ATOM 25549 O WAT 8968 140.265 134.309 132.937 1.00 0.00 O ATOM 25550 H1 WAT 8968 140.109 133.999 133.829 1.00 0.00 H ATOM 25551 H2 WAT 8968 139.452 134.752 132.692 1.00 0.00 H TER 25553 WAT 8968 ATOM 25553 O WAT 8969 99.026 145.556 98.323 1.00 0.00 O ATOM 25554 H1 WAT 8969 99.861 146.010 98.215 1.00 0.00 H ATOM 25555 H2 WAT 8969 99.263 144.632 98.400 1.00 0.00 H TER 25557 WAT 8969 ATOM 25557 O WAT 8970 138.794 145.728 112.036 1.00 0.00 O ATOM 25558 H1 WAT 8970 137.898 145.395 111.977 1.00 0.00 H ATOM 25559 H2 WAT 8970 139.321 144.961 112.256 1.00 0.00 H TER 25561 WAT 8970 ATOM 25561 O WAT 8971 138.692 66.206 150.925 1.00 0.00 O ATOM 25562 H1 WAT 8971 138.068 66.898 150.705 1.00 0.00 H ATOM 25563 H2 WAT 8971 138.176 65.565 151.414 1.00 0.00 H TER 25565 WAT 8971 ATOM 25565 O WAT 8972 70.571 81.425 136.420 1.00 0.00 O ATOM 25566 H1 WAT 8972 70.485 80.931 137.235 1.00 0.00 H ATOM 25567 H2 WAT 8972 71.186 80.915 135.894 1.00 0.00 H TER 25569 WAT 8972 ATOM 25569 O WAT 8973 72.922 38.758 21.578 1.00 0.00 O ATOM 25570 H1 WAT 8973 72.952 39.316 22.355 1.00 0.00 H ATOM 25571 H2 WAT 8973 73.822 38.754 21.251 1.00 0.00 H TER 25573 WAT 8973 ATOM 25573 O WAT 8974 82.043 47.524 109.257 1.00 0.00 O ATOM 25574 H1 WAT 8974 82.970 47.287 109.231 1.00 0.00 H ATOM 25575 H2 WAT 8974 81.674 46.971 109.945 1.00 0.00 H TER 25577 WAT 8974 ATOM 25577 O WAT 8975 137.931 132.824 94.843 1.00 0.00 O ATOM 25578 H1 WAT 8975 138.257 133.590 94.371 1.00 0.00 H ATOM 25579 H2 WAT 8975 136.992 132.812 94.660 1.00 0.00 H TER 25581 WAT 8975 ATOM 25581 O WAT 8976 71.219 77.657 65.126 1.00 0.00 O ATOM 25582 H1 WAT 8976 71.073 78.603 65.100 1.00 0.00 H ATOM 25583 H2 WAT 8976 72.171 77.561 65.091 1.00 0.00 H TER 25585 WAT 8976 ATOM 25585 O WAT 8977 118.504 73.433 81.338 1.00 0.00 O ATOM 25586 H1 WAT 8977 118.877 74.214 80.930 1.00 0.00 H ATOM 25587 H2 WAT 8977 118.987 72.705 80.947 1.00 0.00 H TER 25589 WAT 8977 ATOM 25589 O WAT 8978 58.071 20.238 119.110 1.00 0.00 O ATOM 25590 H1 WAT 8978 57.750 21.085 119.418 1.00 0.00 H ATOM 25591 H2 WAT 8978 57.292 19.681 119.086 1.00 0.00 H TER 25593 WAT 8978 ATOM 25593 O WAT 8979 120.964 39.827 130.894 1.00 0.00 O ATOM 25594 H1 WAT 8979 120.470 39.012 130.798 1.00 0.00 H ATOM 25595 H2 WAT 8979 121.805 39.555 131.260 1.00 0.00 H TER 25597 WAT 8979 ATOM 25597 O WAT 8980 59.942 86.950 134.169 1.00 0.00 O ATOM 25598 H1 WAT 8980 59.218 87.573 134.220 1.00 0.00 H ATOM 25599 H2 WAT 8980 60.703 87.484 133.941 1.00 0.00 H TER 25601 WAT 8980 ATOM 25601 O WAT 8981 18.348 2.627 102.095 1.00 0.00 O ATOM 25602 H1 WAT 8981 18.655 3.379 101.589 1.00 0.00 H ATOM 25603 H2 WAT 8981 19.146 2.148 102.320 1.00 0.00 H TER 25605 WAT 8981 ATOM 25605 O WAT 8982 93.345 9.621 93.266 1.00 0.00 O ATOM 25606 H1 WAT 8982 93.613 10.485 92.954 1.00 0.00 H ATOM 25607 H2 WAT 8982 93.039 9.773 94.160 1.00 0.00 H TER 25609 WAT 8982 ATOM 25609 O WAT 8983 86.686 122.486 157.256 1.00 0.00 O ATOM 25610 H1 WAT 8983 87.075 123.059 157.917 1.00 0.00 H ATOM 25611 H2 WAT 8983 86.872 122.920 156.423 1.00 0.00 H TER 25613 WAT 8983 ATOM 25613 O WAT 8984 11.165 108.803 102.851 1.00 0.00 O ATOM 25614 H1 WAT 8984 10.332 108.476 103.190 1.00 0.00 H ATOM 25615 H2 WAT 8984 10.987 109.714 102.617 1.00 0.00 H TER 25617 WAT 8984 ATOM 25617 O WAT 8985 104.125 20.935 101.378 1.00 0.00 O ATOM 25618 H1 WAT 8985 104.010 21.865 101.570 1.00 0.00 H ATOM 25619 H2 WAT 8985 103.300 20.531 101.648 1.00 0.00 H TER 25621 WAT 8985 ATOM 25621 O WAT 8986 35.433 83.470 142.018 1.00 0.00 O ATOM 25622 H1 WAT 8986 35.416 84.065 141.269 1.00 0.00 H ATOM 25623 H2 WAT 8986 34.518 83.400 142.290 1.00 0.00 H TER 25625 WAT 8986 ATOM 25625 O WAT 8987 138.387 135.624 94.564 1.00 0.00 O ATOM 25626 H1 WAT 8987 138.371 135.909 95.478 1.00 0.00 H ATOM 25627 H2 WAT 8987 137.538 135.896 94.214 1.00 0.00 H TER 25629 WAT 8987 ATOM 25629 O WAT 8988 139.533 15.317 77.788 1.00 0.00 O ATOM 25630 H1 WAT 8988 139.577 15.085 76.861 1.00 0.00 H ATOM 25631 H2 WAT 8988 138.770 14.842 78.119 1.00 0.00 H TER 25633 WAT 8988 ATOM 25633 O WAT 8989 143.748 47.073 107.848 1.00 0.00 O ATOM 25634 H1 WAT 8989 144.586 47.415 108.157 1.00 0.00 H ATOM 25635 H2 WAT 8989 143.914 46.812 106.943 1.00 0.00 H TER 25637 WAT 8989 ATOM 25637 O WAT 8990 94.393 111.957 139.257 1.00 0.00 O ATOM 25638 H1 WAT 8990 95.284 111.761 138.969 1.00 0.00 H ATOM 25639 H2 WAT 8990 93.987 111.099 139.384 1.00 0.00 H TER 25641 WAT 8990 ATOM 25641 O WAT 8991 59.585 34.348 17.443 1.00 0.00 O ATOM 25642 H1 WAT 8991 59.815 35.043 18.060 1.00 0.00 H ATOM 25643 H2 WAT 8991 58.890 33.858 17.883 1.00 0.00 H TER 25645 WAT 8991 ATOM 25645 O WAT 8992 60.976 137.862 3.423 1.00 0.00 O ATOM 25646 H1 WAT 8992 61.013 138.203 2.530 1.00 0.00 H ATOM 25647 H2 WAT 8992 61.870 137.951 3.752 1.00 0.00 H TER 25649 WAT 8992 ATOM 25649 O WAT 8993 17.640 123.309 85.094 1.00 0.00 O ATOM 25650 H1 WAT 8993 17.301 122.677 84.460 1.00 0.00 H ATOM 25651 H2 WAT 8993 18.578 123.353 84.910 1.00 0.00 H TER 25653 WAT 8993 ATOM 25653 O WAT 8994 130.036 33.299 155.482 1.00 0.00 O ATOM 25654 H1 WAT 8994 129.778 32.491 155.038 1.00 0.00 H ATOM 25655 H2 WAT 8994 129.774 33.165 156.393 1.00 0.00 H TER 25657 WAT 8994 ATOM 25657 O WAT 8995 104.106 65.212 136.400 1.00 0.00 O ATOM 25658 H1 WAT 8995 104.881 64.767 136.057 1.00 0.00 H ATOM 25659 H2 WAT 8995 104.186 66.112 136.082 1.00 0.00 H TER 25661 WAT 8995 ATOM 25661 O WAT 8996 36.462 15.071 87.547 1.00 0.00 O ATOM 25662 H1 WAT 8996 36.139 14.417 88.166 1.00 0.00 H ATOM 25663 H2 WAT 8996 36.890 15.729 88.095 1.00 0.00 H TER 25665 WAT 8996 ATOM 25665 O WAT 8997 111.429 110.783 63.346 1.00 0.00 O ATOM 25666 H1 WAT 8997 111.754 111.344 64.050 1.00 0.00 H ATOM 25667 H2 WAT 8997 112.114 110.125 63.228 1.00 0.00 H TER 25669 WAT 8997 ATOM 25669 O WAT 8998 87.904 36.482 67.933 1.00 0.00 O ATOM 25670 H1 WAT 8998 88.761 36.858 67.736 1.00 0.00 H ATOM 25671 H2 WAT 8998 87.725 35.896 67.197 1.00 0.00 H TER 25673 WAT 8998 ATOM 25673 O WAT 8999 40.137 126.173 155.018 1.00 0.00 O ATOM 25674 H1 WAT 8999 39.346 126.464 154.564 1.00 0.00 H ATOM 25675 H2 WAT 8999 40.790 126.843 154.813 1.00 0.00 H TER 25677 WAT 8999 ATOM 25677 O WAT 9000 143.158 120.593 86.826 1.00 0.00 O ATOM 25678 H1 WAT 9000 142.312 120.276 86.509 1.00 0.00 H ATOM 25679 H2 WAT 9000 143.739 120.522 86.069 1.00 0.00 H TER 25681 WAT 9000 ATOM 25681 O WAT 9001 140.714 58.309 133.667 1.00 0.00 O ATOM 25682 H1 WAT 9001 141.120 57.468 133.459 1.00 0.00 H ATOM 25683 H2 WAT 9001 139.786 58.182 133.473 1.00 0.00 H TER 25685 WAT 9001 ATOM 25685 O WAT 9002 61.959 88.462 79.847 1.00 0.00 O ATOM 25686 H1 WAT 9002 61.137 88.010 80.040 1.00 0.00 H ATOM 25687 H2 WAT 9002 61.945 88.591 78.899 1.00 0.00 H TER 25689 WAT 9002 ATOM 25689 O WAT 9003 39.396 7.835 78.883 1.00 0.00 O ATOM 25690 H1 WAT 9003 40.330 7.990 79.021 1.00 0.00 H ATOM 25691 H2 WAT 9003 38.993 8.699 78.979 1.00 0.00 H TER 25693 WAT 9003 ATOM 25693 O WAT 9004 69.876 121.862 74.862 1.00 0.00 O ATOM 25694 H1 WAT 9004 70.335 121.105 74.497 1.00 0.00 H ATOM 25695 H2 WAT 9004 70.520 122.569 74.834 1.00 0.00 H TER 25697 WAT 9004 ATOM 25697 O WAT 9005 64.606 57.263 101.586 1.00 0.00 O ATOM 25698 H1 WAT 9005 65.060 57.964 102.054 1.00 0.00 H ATOM 25699 H2 WAT 9005 64.118 57.713 100.896 1.00 0.00 H TER 25701 WAT 9005 ATOM 25701 O WAT 9006 104.229 55.977 84.064 1.00 0.00 O ATOM 25702 H1 WAT 9006 105.008 56.524 84.163 1.00 0.00 H ATOM 25703 H2 WAT 9006 103.924 56.153 83.174 1.00 0.00 H TER 25705 WAT 9006 ATOM 25705 O WAT 9007 17.175 97.262 2.414 1.00 0.00 O ATOM 25706 H1 WAT 9007 17.470 97.337 3.321 1.00 0.00 H ATOM 25707 H2 WAT 9007 17.824 96.695 1.998 1.00 0.00 H TER 25709 WAT 9007 ATOM 25709 O WAT 9008 129.650 50.999 130.543 1.00 0.00 O ATOM 25710 H1 WAT 9008 128.784 50.953 130.138 1.00 0.00 H ATOM 25711 H2 WAT 9008 129.714 51.895 130.873 1.00 0.00 H TER 25713 WAT 9008 ATOM 25713 O WAT 9009 56.049 110.773 99.071 1.00 0.00 O ATOM 25714 H1 WAT 9009 56.352 110.394 98.246 1.00 0.00 H ATOM 25715 H2 WAT 9009 55.444 110.121 99.427 1.00 0.00 H TER 25717 WAT 9009 ATOM 25717 O WAT 9010 111.955 42.128 157.457 1.00 0.00 O ATOM 25718 H1 WAT 9010 112.168 42.270 158.379 1.00 0.00 H ATOM 25719 H2 WAT 9010 111.904 43.008 157.084 1.00 0.00 H TER 25721 WAT 9010 ATOM 25721 O WAT 9011 63.695 141.182 73.816 1.00 0.00 O ATOM 25722 H1 WAT 9011 63.402 142.056 73.561 1.00 0.00 H ATOM 25723 H2 WAT 9011 63.211 140.590 73.240 1.00 0.00 H TER 25725 WAT 9011 ATOM 25725 O WAT 9012 2.172 0.831 18.168 1.00 0.00 O ATOM 25726 H1 WAT 9012 3.075 1.059 17.945 1.00 0.00 H ATOM 25727 H2 WAT 9012 2.100 -0.099 17.953 1.00 0.00 H TER 25729 WAT 9012 ATOM 25729 O WAT 9013 94.290 18.927 96.457 1.00 0.00 O ATOM 25730 H1 WAT 9013 94.585 18.560 95.624 1.00 0.00 H ATOM 25731 H2 WAT 9013 93.855 19.746 96.218 1.00 0.00 H TER 25733 WAT 9013 ATOM 25733 O WAT 9014 107.379 88.065 9.130 1.00 0.00 O ATOM 25734 H1 WAT 9014 106.825 88.844 9.090 1.00 0.00 H ATOM 25735 H2 WAT 9014 107.239 87.715 10.010 1.00 0.00 H TER 25737 WAT 9014 ATOM 25737 O WAT 9015 64.779 124.190 141.525 1.00 0.00 O ATOM 25738 H1 WAT 9015 65.085 123.293 141.658 1.00 0.00 H ATOM 25739 H2 WAT 9015 65.308 124.518 140.798 1.00 0.00 H TER 25741 WAT 9015 ATOM 25741 O WAT 9016 28.119 5.417 96.623 1.00 0.00 O ATOM 25742 H1 WAT 9016 28.520 6.286 96.617 1.00 0.00 H ATOM 25743 H2 WAT 9016 28.328 5.050 95.765 1.00 0.00 H TER 25745 WAT 9016 ATOM 25745 O WAT 9017 93.408 117.052 76.735 1.00 0.00 O ATOM 25746 H1 WAT 9017 93.266 116.164 77.063 1.00 0.00 H ATOM 25747 H2 WAT 9017 93.723 117.541 77.496 1.00 0.00 H TER 25749 WAT 9017 ATOM 25749 O WAT 9018 104.885 76.663 12.350 1.00 0.00 O ATOM 25750 H1 WAT 9018 104.019 77.068 12.310 1.00 0.00 H ATOM 25751 H2 WAT 9018 104.708 75.731 12.479 1.00 0.00 H TER 25753 WAT 9018 ATOM 25753 O WAT 9019 3.555 122.746 12.974 1.00 0.00 O ATOM 25754 H1 WAT 9019 3.545 121.872 12.583 1.00 0.00 H ATOM 25755 H2 WAT 9019 4.484 122.961 13.057 1.00 0.00 H TER 25757 WAT 9019 ATOM 25757 O WAT 9020 70.155 104.298 85.968 1.00 0.00 O ATOM 25758 H1 WAT 9020 70.169 103.442 85.541 1.00 0.00 H ATOM 25759 H2 WAT 9020 70.917 104.756 85.613 1.00 0.00 H TER 25761 WAT 9020 ATOM 25761 O WAT 9021 77.190 80.078 109.119 1.00 0.00 O ATOM 25762 H1 WAT 9021 77.661 79.330 109.488 1.00 0.00 H ATOM 25763 H2 WAT 9021 76.953 80.610 109.879 1.00 0.00 H TER 25765 WAT 9021 ATOM 25765 O WAT 9022 138.379 114.234 128.060 1.00 0.00 O ATOM 25766 H1 WAT 9022 138.649 113.321 127.956 1.00 0.00 H ATOM 25767 H2 WAT 9022 137.445 114.232 127.848 1.00 0.00 H TER 25769 WAT 9022 ATOM 25769 O WAT 9023 14.979 128.270 157.189 1.00 0.00 O ATOM 25770 H1 WAT 9023 14.366 128.072 157.896 1.00 0.00 H ATOM 25771 H2 WAT 9023 15.694 128.741 157.617 1.00 0.00 H TER 25773 WAT 9023 ATOM 25773 O WAT 9024 13.520 126.374 26.783 1.00 0.00 O ATOM 25774 H1 WAT 9024 13.971 126.826 27.496 1.00 0.00 H ATOM 25775 H2 WAT 9024 13.087 127.072 26.292 1.00 0.00 H TER 25777 WAT 9024 ATOM 25777 O WAT 9025 24.568 102.722 102.584 1.00 0.00 O ATOM 25778 H1 WAT 9025 25.211 102.846 103.283 1.00 0.00 H ATOM 25779 H2 WAT 9025 23.862 102.222 102.994 1.00 0.00 H TER 25781 WAT 9025 ATOM 25781 O WAT 9026 1.320 109.157 75.252 1.00 0.00 O ATOM 25782 H1 WAT 9026 2.075 109.635 75.596 1.00 0.00 H ATOM 25783 H2 WAT 9026 0.672 109.836 75.066 1.00 0.00 H TER 25785 WAT 9026 ATOM 25785 O WAT 9027 130.196 4.133 129.765 1.00 0.00 O ATOM 25786 H1 WAT 9027 130.881 4.544 129.239 1.00 0.00 H ATOM 25787 H2 WAT 9027 129.883 4.831 130.340 1.00 0.00 H TER 25789 WAT 9027 ATOM 25789 O WAT 9028 4.562 104.699 26.517 1.00 0.00 O ATOM 25790 H1 WAT 9028 3.925 105.380 26.299 1.00 0.00 H ATOM 25791 H2 WAT 9028 4.801 104.316 25.673 1.00 0.00 H TER 25793 WAT 9028 ATOM 25793 O WAT 9029 119.081 16.643 76.968 1.00 0.00 O ATOM 25794 H1 WAT 9029 118.491 16.051 76.502 1.00 0.00 H ATOM 25795 H2 WAT 9029 119.949 16.438 76.620 1.00 0.00 H TER 25797 WAT 9029 ATOM 25797 O WAT 9030 144.665 95.793 29.654 1.00 0.00 O ATOM 25798 H1 WAT 9030 144.626 94.849 29.812 1.00 0.00 H ATOM 25799 H2 WAT 9030 144.083 96.170 30.313 1.00 0.00 H TER 25801 WAT 9030 ATOM 25801 O WAT 9031 10.455 26.138 15.311 1.00 0.00 O ATOM 25802 H1 WAT 9031 10.279 26.949 14.833 1.00 0.00 H ATOM 25803 H2 WAT 9031 11.408 26.053 15.296 1.00 0.00 H TER 25805 WAT 9031 ATOM 25805 O WAT 9032 61.597 130.028 116.996 1.00 0.00 O ATOM 25806 H1 WAT 9032 61.305 129.864 117.893 1.00 0.00 H ATOM 25807 H2 WAT 9032 61.874 130.944 116.997 1.00 0.00 H TER 25809 WAT 9032 ATOM 25809 O WAT 9033 92.073 141.560 67.448 1.00 0.00 O ATOM 25810 H1 WAT 9033 91.935 142.483 67.660 1.00 0.00 H ATOM 25811 H2 WAT 9033 92.083 141.534 66.491 1.00 0.00 H TER 25813 WAT 9033 ATOM 25813 O WAT 9034 132.024 93.411 88.987 1.00 0.00 O ATOM 25814 H1 WAT 9034 131.158 93.184 88.647 1.00 0.00 H ATOM 25815 H2 WAT 9034 132.537 92.609 88.890 1.00 0.00 H TER 25817 WAT 9034 ATOM 25817 O WAT 9035 13.255 76.406 107.023 1.00 0.00 O ATOM 25818 H1 WAT 9035 12.350 76.714 106.982 1.00 0.00 H ATOM 25819 H2 WAT 9035 13.774 77.142 106.698 1.00 0.00 H TER 25821 WAT 9035 ATOM 25821 O WAT 9036 31.444 117.357 79.581 1.00 0.00 O ATOM 25822 H1 WAT 9036 31.083 117.549 78.715 1.00 0.00 H ATOM 25823 H2 WAT 9036 31.766 118.201 79.898 1.00 0.00 H TER 25825 WAT 9036 ATOM 25825 O WAT 9037 6.855 63.017 142.074 1.00 0.00 O ATOM 25826 H1 WAT 9037 7.490 62.305 142.153 1.00 0.00 H ATOM 25827 H2 WAT 9037 7.169 63.687 142.681 1.00 0.00 H TER 25829 WAT 9037 ATOM 25829 O WAT 9038 47.009 100.901 10.452 1.00 0.00 O ATOM 25830 H1 WAT 9038 46.578 100.727 9.615 1.00 0.00 H ATOM 25831 H2 WAT 9038 47.620 101.613 10.263 1.00 0.00 H TER 25833 WAT 9038 ATOM 25833 O WAT 9039 114.609 135.462 125.943 1.00 0.00 O ATOM 25834 H1 WAT 9039 113.969 135.035 125.374 1.00 0.00 H ATOM 25835 H2 WAT 9039 114.626 134.921 126.733 1.00 0.00 H TER 25837 WAT 9039 ATOM 25837 O WAT 9040 37.474 65.272 136.838 1.00 0.00 O ATOM 25838 H1 WAT 9040 37.257 65.567 137.723 1.00 0.00 H ATOM 25839 H2 WAT 9040 37.607 64.328 136.927 1.00 0.00 H TER 25841 WAT 9040 ATOM 25841 O WAT 9041 100.245 49.640 146.011 1.00 0.00 O ATOM 25842 H1 WAT 9041 100.508 50.220 146.725 1.00 0.00 H ATOM 25843 H2 WAT 9041 101.067 49.391 145.589 1.00 0.00 H TER 25845 WAT 9041 ATOM 25845 O WAT 9042 143.744 35.099 120.141 1.00 0.00 O ATOM 25846 H1 WAT 9042 144.040 35.868 119.654 1.00 0.00 H ATOM 25847 H2 WAT 9042 143.440 35.448 120.979 1.00 0.00 H TER 25849 WAT 9042 ATOM 25849 O WAT 9043 35.156 56.613 60.603 1.00 0.00 O ATOM 25850 H1 WAT 9043 34.960 56.692 61.536 1.00 0.00 H ATOM 25851 H2 WAT 9043 35.557 57.450 60.370 1.00 0.00 H TER 25853 WAT 9043 ATOM 25853 O WAT 9044 40.209 32.289 81.155 1.00 0.00 O ATOM 25854 H1 WAT 9044 39.882 31.670 81.808 1.00 0.00 H ATOM 25855 H2 WAT 9044 39.461 32.448 80.579 1.00 0.00 H TER 25857 WAT 9044 ATOM 25857 O WAT 9045 55.552 131.775 59.362 1.00 0.00 O ATOM 25858 H1 WAT 9045 55.225 132.380 58.695 1.00 0.00 H ATOM 25859 H2 WAT 9045 55.669 130.947 58.897 1.00 0.00 H TER 25861 WAT 9045 ATOM 25861 O WAT 9046 78.362 98.183 6.759 1.00 0.00 O ATOM 25862 H1 WAT 9046 78.902 97.663 7.354 1.00 0.00 H ATOM 25863 H2 WAT 9046 78.316 99.046 7.171 1.00 0.00 H TER 25865 WAT 9046 ATOM 25865 O WAT 9047 20.273 91.647 139.181 1.00 0.00 O ATOM 25866 H1 WAT 9047 20.391 92.288 139.882 1.00 0.00 H ATOM 25867 H2 WAT 9047 20.192 92.173 138.386 1.00 0.00 H TER 25869 WAT 9047 ATOM 25869 O WAT 9048 40.343 105.939 142.973 1.00 0.00 O ATOM 25870 H1 WAT 9048 40.413 106.254 142.072 1.00 0.00 H ATOM 25871 H2 WAT 9048 39.791 106.586 143.412 1.00 0.00 H TER 25873 WAT 9048 ATOM 25873 O WAT 9049 51.513 122.466 126.381 1.00 0.00 O ATOM 25874 H1 WAT 9049 51.964 123.260 126.096 1.00 0.00 H ATOM 25875 H2 WAT 9049 50.800 122.357 125.752 1.00 0.00 H TER 25877 WAT 9049 ATOM 25877 O WAT 9050 44.265 140.593 117.634 1.00 0.00 O ATOM 25878 H1 WAT 9050 44.674 141.402 117.327 1.00 0.00 H ATOM 25879 H2 WAT 9050 43.357 140.656 117.336 1.00 0.00 H TER 25881 WAT 9050 ATOM 25881 O WAT 9051 137.887 58.707 59.686 1.00 0.00 O ATOM 25882 H1 WAT 9051 138.085 59.522 60.148 1.00 0.00 H ATOM 25883 H2 WAT 9051 137.153 58.929 59.113 1.00 0.00 H TER 25885 WAT 9051 ATOM 25885 O WAT 9052 85.919 133.486 88.171 1.00 0.00 O ATOM 25886 H1 WAT 9052 86.381 133.904 88.897 1.00 0.00 H ATOM 25887 H2 WAT 9052 85.117 133.141 88.564 1.00 0.00 H TER 25889 WAT 9052 ATOM 25889 O WAT 9053 92.791 122.576 157.774 1.00 0.00 O ATOM 25890 H1 WAT 9053 93.559 122.922 158.230 1.00 0.00 H ATOM 25891 H2 WAT 9053 92.054 123.060 158.145 1.00 0.00 H TER 25893 WAT 9053 ATOM 25893 O WAT 9054 136.364 25.486 92.985 1.00 0.00 O ATOM 25894 H1 WAT 9054 135.626 26.050 93.217 1.00 0.00 H ATOM 25895 H2 WAT 9054 137.136 26.039 93.108 1.00 0.00 H TER 25897 WAT 9054 ATOM 25897 O WAT 9055 69.748 11.188 118.749 1.00 0.00 O ATOM 25898 H1 WAT 9055 69.092 10.885 118.121 1.00 0.00 H ATOM 25899 H2 WAT 9055 70.571 10.814 118.434 1.00 0.00 H TER 25901 WAT 9055 ATOM 25901 O WAT 9056 94.031 103.115 121.537 1.00 0.00 O ATOM 25902 H1 WAT 9056 94.933 102.839 121.375 1.00 0.00 H ATOM 25903 H2 WAT 9056 93.641 102.389 122.025 1.00 0.00 H TER 25905 WAT 9056 ATOM 25905 O WAT 9057 90.488 40.081 108.982 1.00 0.00 O ATOM 25906 H1 WAT 9057 90.613 40.661 108.231 1.00 0.00 H ATOM 25907 H2 WAT 9057 90.737 39.214 108.659 1.00 0.00 H TER 25909 WAT 9057 ATOM 25909 O WAT 9058 113.332 125.930 115.201 1.00 0.00 O ATOM 25910 H1 WAT 9058 113.587 125.020 115.352 1.00 0.00 H ATOM 25911 H2 WAT 9058 112.391 125.947 115.377 1.00 0.00 H TER 25913 WAT 9058 ATOM 25913 O WAT 9059 31.517 68.370 68.704 1.00 0.00 O ATOM 25914 H1 WAT 9059 31.407 68.237 67.762 1.00 0.00 H ATOM 25915 H2 WAT 9059 30.627 68.496 69.033 1.00 0.00 H TER 25917 WAT 9059 ATOM 25917 O WAT 9060 73.730 108.947 68.664 1.00 0.00 O ATOM 25918 H1 WAT 9060 73.930 109.438 69.461 1.00 0.00 H ATOM 25919 H2 WAT 9060 72.879 108.545 68.838 1.00 0.00 H TER 25921 WAT 9060 ATOM 25921 O WAT 9061 63.414 83.665 155.263 1.00 0.00 O ATOM 25922 H1 WAT 9061 63.937 83.012 154.797 1.00 0.00 H ATOM 25923 H2 WAT 9061 62.519 83.329 155.221 1.00 0.00 H TER 25925 WAT 9061 ATOM 25925 O WAT 9062 115.111 120.676 115.005 1.00 0.00 O ATOM 25926 H1 WAT 9062 114.314 120.277 114.657 1.00 0.00 H ATOM 25927 H2 WAT 9062 114.834 121.543 115.304 1.00 0.00 H TER 25929 WAT 9062 ATOM 25929 O WAT 9063 132.487 75.408 23.223 1.00 0.00 O ATOM 25930 H1 WAT 9063 132.333 76.271 23.606 1.00 0.00 H ATOM 25931 H2 WAT 9063 133.440 75.326 23.191 1.00 0.00 H TER 25933 WAT 9063 ATOM 25933 O WAT 9064 92.509 130.418 96.701 1.00 0.00 O ATOM 25934 H1 WAT 9064 92.728 131.308 96.427 1.00 0.00 H ATOM 25935 H2 WAT 9064 92.366 129.943 95.883 1.00 0.00 H TER 25937 WAT 9064 ATOM 25937 O WAT 9065 141.995 84.626 86.564 1.00 0.00 O ATOM 25938 H1 WAT 9065 141.683 84.083 87.288 1.00 0.00 H ATOM 25939 H2 WAT 9065 141.608 84.229 85.783 1.00 0.00 H TER 25941 WAT 9065 ATOM 25941 O WAT 9066 97.240 26.338 14.958 1.00 0.00 O ATOM 25942 H1 WAT 9066 96.354 25.994 15.071 1.00 0.00 H ATOM 25943 H2 WAT 9066 97.210 27.211 15.348 1.00 0.00 H TER 25945 WAT 9066 ATOM 25945 O WAT 9067 114.216 128.906 110.307 1.00 0.00 O ATOM 25946 H1 WAT 9067 113.952 128.274 110.977 1.00 0.00 H ATOM 25947 H2 WAT 9067 113.727 128.646 109.527 1.00 0.00 H TER 25949 WAT 9067 ATOM 25949 O WAT 9068 75.809 55.534 90.907 1.00 0.00 O ATOM 25950 H1 WAT 9068 75.416 56.404 90.836 1.00 0.00 H ATOM 25951 H2 WAT 9068 76.073 55.465 91.825 1.00 0.00 H TER 25953 WAT 9068 ATOM 25953 O WAT 9069 0.126 119.823 142.722 1.00 0.00 O ATOM 25954 H1 WAT 9069 -0.440 120.122 143.434 1.00 0.00 H ATOM 25955 H2 WAT 9069 0.297 118.903 142.923 1.00 0.00 H TER 25957 WAT 9069 ATOM 25957 O WAT 9070 94.709 62.511 110.581 1.00 0.00 O ATOM 25958 H1 WAT 9070 95.527 62.028 110.462 1.00 0.00 H ATOM 25959 H2 WAT 9070 94.218 62.353 109.775 1.00 0.00 H TER 25961 WAT 9070 ATOM 25961 O WAT 9071 5.199 46.135 154.388 1.00 0.00 O ATOM 25962 H1 WAT 9071 4.740 46.461 155.163 1.00 0.00 H ATOM 25963 H2 WAT 9071 4.827 46.634 153.661 1.00 0.00 H TER 25965 WAT 9071 ATOM 25965 O WAT 9072 75.193 70.139 138.401 1.00 0.00 O ATOM 25966 H1 WAT 9072 74.677 69.627 137.778 1.00 0.00 H ATOM 25967 H2 WAT 9072 75.002 69.744 139.252 1.00 0.00 H TER 25969 WAT 9072 ATOM 25969 O WAT 9073 135.694 37.794 73.561 1.00 0.00 O ATOM 25970 H1 WAT 9073 136.421 38.330 73.879 1.00 0.00 H ATOM 25971 H2 WAT 9073 136.084 37.237 72.888 1.00 0.00 H TER 25973 WAT 9073 ATOM 25973 O WAT 9074 135.222 135.872 132.318 1.00 0.00 O ATOM 25974 H1 WAT 9074 134.523 135.270 132.572 1.00 0.00 H ATOM 25975 H2 WAT 9074 134.765 136.635 131.965 1.00 0.00 H TER 25977 WAT 9074 ATOM 25977 O WAT 9075 51.286 78.823 85.190 1.00 0.00 O ATOM 25978 H1 WAT 9075 50.740 78.172 84.750 1.00 0.00 H ATOM 25979 H2 WAT 9075 51.121 78.683 86.123 1.00 0.00 H TER 25981 WAT 9075 ATOM 25981 O WAT 9076 143.961 27.586 150.811 1.00 0.00 O ATOM 25982 H1 WAT 9076 144.087 27.355 149.890 1.00 0.00 H ATOM 25983 H2 WAT 9076 144.552 28.325 150.955 1.00 0.00 H TER 25985 WAT 9076 ATOM 25985 O WAT 9077 83.232 22.374 116.657 1.00 0.00 O ATOM 25986 H1 WAT 9077 83.782 21.744 117.122 1.00 0.00 H ATOM 25987 H2 WAT 9077 82.488 21.859 116.346 1.00 0.00 H TER 25989 WAT 9077 ATOM 25989 O WAT 9078 85.778 13.292 76.450 1.00 0.00 O ATOM 25990 H1 WAT 9078 85.891 13.916 75.733 1.00 0.00 H ATOM 25991 H2 WAT 9078 86.405 12.594 76.261 1.00 0.00 H TER 25993 WAT 9078 ATOM 25993 O WAT 9079 138.168 83.333 149.354 1.00 0.00 O ATOM 25994 H1 WAT 9079 137.243 83.135 149.498 1.00 0.00 H ATOM 25995 H2 WAT 9079 138.315 83.133 148.429 1.00 0.00 H TER 25997 WAT 9079 ATOM 25997 O WAT 9080 97.254 107.502 136.069 1.00 0.00 O ATOM 25998 H1 WAT 9080 97.943 107.781 135.466 1.00 0.00 H ATOM 25999 H2 WAT 9080 97.140 106.569 135.888 1.00 0.00 H TER 26001 WAT 9080 ATOM 26001 O WAT 9081 30.849 71.142 107.887 1.00 0.00 O ATOM 26002 H1 WAT 9081 30.320 70.761 107.186 1.00 0.00 H ATOM 26003 H2 WAT 9081 30.951 72.061 107.637 1.00 0.00 H TER 26005 WAT 9081 ATOM 26005 O WAT 9082 8.390 52.654 126.210 1.00 0.00 O ATOM 26006 H1 WAT 9082 8.925 52.666 125.417 1.00 0.00 H ATOM 26007 H2 WAT 9082 9.020 52.745 126.925 1.00 0.00 H TER 26009 WAT 9082 ATOM 26009 O WAT 9083 0.935 69.723 109.175 1.00 0.00 O ATOM 26010 H1 WAT 9083 0.151 69.618 108.634 1.00 0.00 H ATOM 26011 H2 WAT 9083 0.717 69.289 109.999 1.00 0.00 H TER 26013 WAT 9083 ATOM 26013 O WAT 9084 110.955 17.026 122.156 1.00 0.00 O ATOM 26014 H1 WAT 9084 110.140 17.211 121.688 1.00 0.00 H ATOM 26015 H2 WAT 9084 111.263 16.201 121.781 1.00 0.00 H TER 26017 WAT 9084 ATOM 26017 O WAT 9085 94.972 81.829 59.773 1.00 0.00 O ATOM 26018 H1 WAT 9085 94.626 81.718 58.888 1.00 0.00 H ATOM 26019 H2 WAT 9085 94.365 81.341 60.330 1.00 0.00 H TER 26021 WAT 9085 ATOM 26021 O WAT 9086 1.794 56.416 76.797 1.00 0.00 O ATOM 26022 H1 WAT 9086 1.198 57.079 76.448 1.00 0.00 H ATOM 26023 H2 WAT 9086 1.317 56.026 77.528 1.00 0.00 H TER 26025 WAT 9086 ATOM 26025 O WAT 9087 36.470 84.131 134.926 1.00 0.00 O ATOM 26026 H1 WAT 9087 37.318 84.573 134.889 1.00 0.00 H ATOM 26027 H2 WAT 9087 36.636 83.335 135.430 1.00 0.00 H TER 26029 WAT 9087 ATOM 26029 O WAT 9088 106.964 99.657 119.455 1.00 0.00 O ATOM 26030 H1 WAT 9088 106.570 99.229 120.215 1.00 0.00 H ATOM 26031 H2 WAT 9088 107.364 98.943 118.959 1.00 0.00 H TER 26033 WAT 9088 ATOM 26033 O WAT 9089 33.611 38.627 107.668 1.00 0.00 O ATOM 26034 H1 WAT 9089 33.416 37.929 108.293 1.00 0.00 H ATOM 26035 H2 WAT 9089 33.898 38.169 106.879 1.00 0.00 H TER 26037 WAT 9089 ATOM 26037 O WAT 9090 139.021 145.047 142.960 1.00 0.00 O ATOM 26038 H1 WAT 9090 139.160 144.657 142.096 1.00 0.00 H ATOM 26039 H2 WAT 9090 138.436 145.787 142.797 1.00 0.00 H TER 26041 WAT 9090 ATOM 26041 O WAT 9091 39.416 69.947 131.808 1.00 0.00 O ATOM 26042 H1 WAT 9091 40.218 69.629 132.222 1.00 0.00 H ATOM 26043 H2 WAT 9091 39.138 70.681 132.356 1.00 0.00 H TER 26045 WAT 9091 ATOM 26045 O WAT 9092 18.995 112.332 82.582 1.00 0.00 O ATOM 26046 H1 WAT 9092 18.409 112.272 81.828 1.00 0.00 H ATOM 26047 H2 WAT 9092 19.500 111.519 82.560 1.00 0.00 H TER 26049 WAT 9092 ATOM 26049 O WAT 9093 76.924 4.613 114.587 1.00 0.00 O ATOM 26050 H1 WAT 9093 77.083 4.959 113.709 1.00 0.00 H ATOM 26051 H2 WAT 9093 76.394 5.284 115.017 1.00 0.00 H TER 26053 WAT 9093 ATOM 26053 O WAT 9094 121.981 75.576 92.529 1.00 0.00 O ATOM 26054 H1 WAT 9094 122.300 75.878 91.678 1.00 0.00 H ATOM 26055 H2 WAT 9094 121.166 75.116 92.329 1.00 0.00 H TER 26057 WAT 9094 ATOM 26057 O WAT 9095 29.253 71.169 94.273 1.00 0.00 O ATOM 26058 H1 WAT 9095 29.711 71.238 95.111 1.00 0.00 H ATOM 26059 H2 WAT 9095 28.356 71.443 94.467 1.00 0.00 H TER 26061 WAT 9095 ATOM 26061 O WAT 9096 43.159 128.812 158.305 1.00 0.00 O ATOM 26062 H1 WAT 9096 43.735 129.561 158.154 1.00 0.00 H ATOM 26063 H2 WAT 9096 43.661 128.057 157.998 1.00 0.00 H TER 26065 WAT 9096 ATOM 26065 O WAT 9097 28.327 133.492 61.527 1.00 0.00 O ATOM 26066 H1 WAT 9097 27.913 133.153 62.320 1.00 0.00 H ATOM 26067 H2 WAT 9097 29.245 133.615 61.770 1.00 0.00 H TER 26069 WAT 9097 ATOM 26069 O WAT 9098 43.520 137.810 74.832 1.00 0.00 O ATOM 26070 H1 WAT 9098 42.710 138.216 75.140 1.00 0.00 H ATOM 26071 H2 WAT 9098 43.849 137.327 75.589 1.00 0.00 H TER 26073 WAT 9098 ATOM 26073 O WAT 9099 85.824 94.032 19.574 1.00 0.00 O ATOM 26074 H1 WAT 9099 85.188 94.594 19.131 1.00 0.00 H ATOM 26075 H2 WAT 9099 86.620 94.561 19.619 1.00 0.00 H TER 26077 WAT 9099 ATOM 26077 O WAT 9100 77.283 80.001 144.772 1.00 0.00 O ATOM 26078 H1 WAT 9100 77.597 79.519 144.007 1.00 0.00 H ATOM 26079 H2 WAT 9100 77.829 80.787 144.801 1.00 0.00 H TER 26081 WAT 9100 ATOM 26081 O WAT 9101 88.705 100.184 123.637 1.00 0.00 O ATOM 26082 H1 WAT 9101 88.623 99.282 123.329 1.00 0.00 H ATOM 26083 H2 WAT 9101 88.662 100.117 124.591 1.00 0.00 H TER 26085 WAT 9101 ATOM 26085 O WAT 9102 54.101 61.633 124.339 1.00 0.00 O ATOM 26086 H1 WAT 9102 53.292 62.125 124.200 1.00 0.00 H ATOM 26087 H2 WAT 9102 54.061 60.921 123.700 1.00 0.00 H TER 26089 WAT 9102 ATOM 26089 O WAT 9103 66.582 76.010 119.030 1.00 0.00 O ATOM 26090 H1 WAT 9103 65.704 76.389 119.064 1.00 0.00 H ATOM 26091 H2 WAT 9103 66.911 76.247 118.163 1.00 0.00 H TER 26093 WAT 9103 ATOM 26093 O WAT 9104 4.660 53.154 107.350 1.00 0.00 O ATOM 26094 H1 WAT 9104 5.423 53.385 106.821 1.00 0.00 H ATOM 26095 H2 WAT 9104 4.970 53.206 108.254 1.00 0.00 H TER 26097 WAT 9104 ATOM 26097 O WAT 9105 58.295 86.947 105.885 1.00 0.00 O ATOM 26098 H1 WAT 9105 57.475 87.335 105.580 1.00 0.00 H ATOM 26099 H2 WAT 9105 58.382 87.250 106.788 1.00 0.00 H TER 26101 WAT 9105 ATOM 26101 O WAT 9106 109.571 118.367 138.674 1.00 0.00 O ATOM 26102 H1 WAT 9106 110.507 118.452 138.856 1.00 0.00 H ATOM 26103 H2 WAT 9106 109.159 119.027 139.231 1.00 0.00 H TER 26105 WAT 9106 ATOM 26105 O WAT 9107 140.048 78.625 54.362 1.00 0.00 O ATOM 26106 H1 WAT 9107 139.930 79.303 53.696 1.00 0.00 H ATOM 26107 H2 WAT 9107 139.298 78.042 54.245 1.00 0.00 H TER 26109 WAT 9107 ATOM 26109 O WAT 9108 53.388 114.928 92.955 1.00 0.00 O ATOM 26110 H1 WAT 9108 54.194 114.497 93.240 1.00 0.00 H ATOM 26111 H2 WAT 9108 53.684 115.736 92.537 1.00 0.00 H TER 26113 WAT 9108 ATOM 26113 O WAT 9109 94.107 11.496 58.310 1.00 0.00 O ATOM 26114 H1 WAT 9109 94.278 10.570 58.138 1.00 0.00 H ATOM 26115 H2 WAT 9109 94.965 11.863 58.524 1.00 0.00 H TER 26117 WAT 9109 ATOM 26117 O WAT 9110 129.391 135.994 74.259 1.00 0.00 O ATOM 26118 H1 WAT 9110 129.577 135.414 73.520 1.00 0.00 H ATOM 26119 H2 WAT 9110 130.022 136.708 74.169 1.00 0.00 H TER 26121 WAT 9110 ATOM 26121 O WAT 9111 126.611 17.526 106.835 1.00 0.00 O ATOM 26122 H1 WAT 9111 125.698 17.692 106.599 1.00 0.00 H ATOM 26123 H2 WAT 9111 127.042 18.374 106.729 1.00 0.00 H TER 26125 WAT 9111 ATOM 26125 O WAT 9112 72.288 64.621 4.219 1.00 0.00 O ATOM 26126 H1 WAT 9112 72.056 63.877 3.662 1.00 0.00 H ATOM 26127 H2 WAT 9112 71.888 65.376 3.788 1.00 0.00 H TER 26129 WAT 9112 ATOM 26129 O WAT 9113 68.580 3.679 107.111 1.00 0.00 O ATOM 26130 H1 WAT 9113 69.438 3.452 106.750 1.00 0.00 H ATOM 26131 H2 WAT 9113 67.982 3.610 106.367 1.00 0.00 H TER 26133 WAT 9113 ATOM 26133 O WAT 9114 89.928 5.284 110.413 1.00 0.00 O ATOM 26134 H1 WAT 9114 90.264 6.043 110.890 1.00 0.00 H ATOM 26135 H2 WAT 9114 89.305 5.652 109.787 1.00 0.00 H TER 26137 WAT 9114 ATOM 26137 O WAT 9115 63.968 9.492 151.440 1.00 0.00 O ATOM 26138 H1 WAT 9115 64.068 10.415 151.210 1.00 0.00 H ATOM 26139 H2 WAT 9115 64.629 9.041 150.915 1.00 0.00 H TER 26141 WAT 9115 ATOM 26141 O WAT 9116 21.025 143.304 114.461 1.00 0.00 O ATOM 26142 H1 WAT 9116 20.237 143.167 114.986 1.00 0.00 H ATOM 26143 H2 WAT 9116 21.619 142.603 114.731 1.00 0.00 H TER 26145 WAT 9116 ATOM 26145 O WAT 9117 49.796 22.896 21.762 1.00 0.00 O ATOM 26146 H1 WAT 9117 49.872 23.815 21.508 1.00 0.00 H ATOM 26147 H2 WAT 9117 49.465 22.457 20.978 1.00 0.00 H TER 26149 WAT 9117 ATOM 26149 O WAT 9118 62.446 62.619 142.118 1.00 0.00 O ATOM 26150 H1 WAT 9118 63.087 62.504 142.819 1.00 0.00 H ATOM 26151 H2 WAT 9118 62.862 63.231 141.511 1.00 0.00 H TER 26153 WAT 9118 ATOM 26153 O WAT 9119 13.809 142.349 114.197 1.00 0.00 O ATOM 26154 H1 WAT 9119 14.283 141.808 113.564 1.00 0.00 H ATOM 26155 H2 WAT 9119 14.372 142.360 114.971 1.00 0.00 H TER 26157 WAT 9119 ATOM 26157 O WAT 9120 60.310 87.734 137.108 1.00 0.00 O ATOM 26158 H1 WAT 9120 59.802 88.537 136.987 1.00 0.00 H ATOM 26159 H2 WAT 9120 60.540 87.460 136.221 1.00 0.00 H TER 26161 WAT 9120 ATOM 26161 O WAT 9121 0.894 68.441 151.513 1.00 0.00 O ATOM 26162 H1 WAT 9121 0.906 68.091 150.622 1.00 0.00 H ATOM 26163 H2 WAT 9121 0.950 69.390 151.398 1.00 0.00 H TER 26165 WAT 9121 ATOM 26165 O WAT 9122 65.385 142.700 118.432 1.00 0.00 O ATOM 26166 H1 WAT 9122 65.853 141.896 118.205 1.00 0.00 H ATOM 26167 H2 WAT 9122 64.483 142.539 118.154 1.00 0.00 H TER 26169 WAT 9122 ATOM 26169 O WAT 9123 81.392 141.266 23.051 1.00 0.00 O ATOM 26170 H1 WAT 9123 80.838 140.727 22.486 1.00 0.00 H ATOM 26171 H2 WAT 9123 81.001 142.138 23.008 1.00 0.00 H TER 26173 WAT 9123 ATOM 26173 O WAT 9124 123.071 72.052 123.890 1.00 0.00 O ATOM 26174 H1 WAT 9124 123.320 71.308 124.438 1.00 0.00 H ATOM 26175 H2 WAT 9124 122.181 71.851 123.602 1.00 0.00 H TER 26177 WAT 9124 ATOM 26177 O WAT 9125 134.538 93.954 144.157 1.00 0.00 O ATOM 26178 H1 WAT 9125 135.489 94.023 144.243 1.00 0.00 H ATOM 26179 H2 WAT 9125 134.210 94.813 144.423 1.00 0.00 H TER 26181 WAT 9125 ATOM 26181 O WAT 9126 18.981 62.640 128.010 1.00 0.00 O ATOM 26182 H1 WAT 9126 18.783 63.337 127.384 1.00 0.00 H ATOM 26183 H2 WAT 9126 18.448 61.899 127.721 1.00 0.00 H TER 26185 WAT 9126 ATOM 26185 O WAT 9127 45.231 140.024 87.461 1.00 0.00 O ATOM 26186 H1 WAT 9127 44.756 139.444 88.056 1.00 0.00 H ATOM 26187 H2 WAT 9127 46.117 140.063 87.821 1.00 0.00 H TER 26189 WAT 9127 ATOM 26189 O WAT 9128 10.135 109.054 134.138 1.00 0.00 O ATOM 26190 H1 WAT 9128 10.521 109.646 133.492 1.00 0.00 H ATOM 26191 H2 WAT 9128 9.192 109.206 134.069 1.00 0.00 H TER 26193 WAT 9128 ATOM 26193 O WAT 9129 59.673 71.797 120.017 1.00 0.00 O ATOM 26194 H1 WAT 9129 60.602 71.686 120.219 1.00 0.00 H ATOM 26195 H2 WAT 9129 59.555 72.744 119.942 1.00 0.00 H TER 26197 WAT 9129 ATOM 26197 O WAT 9130 129.210 85.699 138.175 1.00 0.00 O ATOM 26198 H1 WAT 9130 129.807 86.445 138.237 1.00 0.00 H ATOM 26199 H2 WAT 9130 128.430 85.976 138.657 1.00 0.00 H TER 26201 WAT 9130 ATOM 26201 O WAT 9131 84.449 129.565 62.217 1.00 0.00 O ATOM 26202 H1 WAT 9131 83.886 129.342 62.958 1.00 0.00 H ATOM 26203 H2 WAT 9131 84.092 130.389 61.885 1.00 0.00 H TER 26205 WAT 9131 ATOM 26205 O WAT 9132 49.443 33.409 92.341 1.00 0.00 O ATOM 26206 H1 WAT 9132 48.831 33.153 91.652 1.00 0.00 H ATOM 26207 H2 WAT 9132 50.181 33.800 91.873 1.00 0.00 H TER 26209 WAT 9132 ATOM 26209 O WAT 9133 38.586 19.179 64.544 1.00 0.00 O ATOM 26210 H1 WAT 9133 38.400 19.648 63.731 1.00 0.00 H ATOM 26211 H2 WAT 9133 39.068 18.400 64.267 1.00 0.00 H TER 26213 WAT 9133 ATOM 26213 O WAT 9134 61.666 94.364 115.563 1.00 0.00 O ATOM 26214 H1 WAT 9134 61.735 93.640 116.185 1.00 0.00 H ATOM 26215 H2 WAT 9134 60.733 94.576 115.544 1.00 0.00 H TER 26217 WAT 9134 ATOM 26217 O WAT 9135 56.376 123.868 145.917 1.00 0.00 O ATOM 26218 H1 WAT 9135 56.081 124.199 145.068 1.00 0.00 H ATOM 26219 H2 WAT 9135 55.765 124.248 146.548 1.00 0.00 H TER 26221 WAT 9135 ATOM 26221 O WAT 9136 101.146 1.999 16.649 1.00 0.00 O ATOM 26222 H1 WAT 9136 100.235 2.183 16.875 1.00 0.00 H ATOM 26223 H2 WAT 9136 101.136 1.098 16.327 1.00 0.00 H TER 26225 WAT 9136 ATOM 26225 O WAT 9137 50.364 104.003 132.550 1.00 0.00 O ATOM 26226 H1 WAT 9137 50.714 104.747 133.040 1.00 0.00 H ATOM 26227 H2 WAT 9137 50.871 103.992 131.738 1.00 0.00 H TER 26229 WAT 9137 ATOM 26229 O WAT 9138 48.965 69.803 92.020 1.00 0.00 O ATOM 26230 H1 WAT 9138 48.092 69.414 91.969 1.00 0.00 H ATOM 26231 H2 WAT 9138 49.554 69.110 91.721 1.00 0.00 H TER 26233 WAT 9138 ATOM 26233 O WAT 9139 64.408 122.080 129.526 1.00 0.00 O ATOM 26234 H1 WAT 9139 64.456 121.487 130.276 1.00 0.00 H ATOM 26235 H2 WAT 9139 65.144 121.823 128.970 1.00 0.00 H TER 26237 WAT 9139 ATOM 26237 O WAT 9140 82.588 112.657 140.167 1.00 0.00 O ATOM 26238 H1 WAT 9140 82.992 113.298 139.582 1.00 0.00 H ATOM 26239 H2 WAT 9140 82.320 113.168 140.931 1.00 0.00 H TER 26241 WAT 9140 ATOM 26241 O WAT 9141 22.028 4.005 142.747 1.00 0.00 O ATOM 26242 H1 WAT 9141 21.700 3.482 143.478 1.00 0.00 H ATOM 26243 H2 WAT 9141 21.578 4.845 142.832 1.00 0.00 H TER 26245 WAT 9141 ATOM 26245 O WAT 9142 123.597 70.789 112.481 1.00 0.00 O ATOM 26246 H1 WAT 9142 123.402 69.851 112.472 1.00 0.00 H ATOM 26247 H2 WAT 9142 124.465 70.857 112.084 1.00 0.00 H TER 26249 WAT 9142 ATOM 26249 O WAT 9143 142.194 92.496 94.195 1.00 0.00 O ATOM 26250 H1 WAT 9143 142.597 92.590 95.059 1.00 0.00 H ATOM 26251 H2 WAT 9143 142.701 91.805 93.769 1.00 0.00 H TER 26253 WAT 9143 ATOM 26253 O WAT 9144 53.289 24.656 10.127 1.00 0.00 O ATOM 26254 H1 WAT 9144 53.278 25.605 10.246 1.00 0.00 H ATOM 26255 H2 WAT 9144 52.761 24.317 10.850 1.00 0.00 H TER 26257 WAT 9144 ATOM 26257 O WAT 9145 140.697 121.209 155.857 1.00 0.00 O ATOM 26258 H1 WAT 9145 140.397 120.318 155.679 1.00 0.00 H ATOM 26259 H2 WAT 9145 140.113 121.525 156.546 1.00 0.00 H TER 26261 WAT 9145 ATOM 26261 O WAT 9146 3.190 90.605 25.418 1.00 0.00 O ATOM 26262 H1 WAT 9146 2.540 89.905 25.360 1.00 0.00 H ATOM 26263 H2 WAT 9146 2.693 91.369 25.712 1.00 0.00 H TER 26265 WAT 9146 ATOM 26265 O WAT 9147 106.457 71.783 136.965 1.00 0.00 O ATOM 26266 H1 WAT 9147 105.865 72.148 136.308 1.00 0.00 H ATOM 26267 H2 WAT 9147 105.958 71.075 137.370 1.00 0.00 H TER 26269 WAT 9147 ATOM 26269 O WAT 9148 21.206 67.811 17.093 1.00 0.00 O ATOM 26270 H1 WAT 9148 20.763 68.462 16.550 1.00 0.00 H ATOM 26271 H2 WAT 9148 20.521 67.183 17.321 1.00 0.00 H TER 26273 WAT 9148 ATOM 26273 O WAT 9149 130.862 30.241 122.117 1.00 0.00 O ATOM 26274 H1 WAT 9149 130.271 29.530 121.869 1.00 0.00 H ATOM 26275 H2 WAT 9149 131.112 30.646 121.287 1.00 0.00 H TER 26277 WAT 9149 ATOM 26277 O WAT 9150 24.572 119.054 115.571 1.00 0.00 O ATOM 26278 H1 WAT 9150 24.842 118.858 116.468 1.00 0.00 H ATOM 26279 H2 WAT 9150 23.663 119.343 115.652 1.00 0.00 H TER 26281 WAT 9150 ATOM 26281 O WAT 9151 77.913 102.843 106.815 1.00 0.00 O ATOM 26282 H1 WAT 9151 77.671 103.759 106.953 1.00 0.00 H ATOM 26283 H2 WAT 9151 78.837 102.874 106.567 1.00 0.00 H TER 26285 WAT 9151 ATOM 26285 O WAT 9152 68.827 86.120 10.142 1.00 0.00 O ATOM 26286 H1 WAT 9152 69.775 86.052 10.251 1.00 0.00 H ATOM 26287 H2 WAT 9152 68.698 86.169 9.194 1.00 0.00 H TER 26289 WAT 9152 ATOM 26289 O WAT 9153 80.618 119.827 17.406 1.00 0.00 O ATOM 26290 H1 WAT 9153 80.972 120.687 17.180 1.00 0.00 H ATOM 26291 H2 WAT 9153 81.123 119.554 18.171 1.00 0.00 H TER 26293 WAT 9153 ATOM 26293 O WAT 9154 59.240 120.204 104.787 1.00 0.00 O ATOM 26294 H1 WAT 9154 60.105 120.532 105.032 1.00 0.00 H ATOM 26295 H2 WAT 9154 58.860 120.904 104.255 1.00 0.00 H TER 26297 WAT 9154 ATOM 26297 O WAT 9155 8.995 65.705 97.914 1.00 0.00 O ATOM 26298 H1 WAT 9155 8.142 66.013 97.608 1.00 0.00 H ATOM 26299 H2 WAT 9155 9.626 66.136 97.337 1.00 0.00 H TER 26301 WAT 9155 ATOM 26301 O WAT 9156 83.342 89.844 67.576 1.00 0.00 O ATOM 26302 H1 WAT 9156 83.342 89.308 66.783 1.00 0.00 H ATOM 26303 H2 WAT 9156 84.064 89.497 68.099 1.00 0.00 H TER 26305 WAT 9156 ATOM 26305 O WAT 9157 89.983 91.570 98.149 1.00 0.00 O ATOM 26306 H1 WAT 9157 90.249 91.739 99.053 1.00 0.00 H ATOM 26307 H2 WAT 9157 89.527 92.368 97.881 1.00 0.00 H TER 26309 WAT 9157 ATOM 26309 O WAT 9158 61.441 109.348 71.986 1.00 0.00 O ATOM 26310 H1 WAT 9158 62.125 110.000 71.834 1.00 0.00 H ATOM 26311 H2 WAT 9158 61.839 108.720 72.589 1.00 0.00 H TER 26313 WAT 9158 ATOM 26313 O WAT 9159 130.391 33.266 158.311 1.00 0.00 O ATOM 26314 H1 WAT 9159 131.248 32.951 158.024 1.00 0.00 H ATOM 26315 H2 WAT 9159 130.487 34.218 158.353 1.00 0.00 H TER 26317 WAT 9159 ATOM 26317 O WAT 9160 138.006 143.544 145.068 1.00 0.00 O ATOM 26318 H1 WAT 9160 138.496 142.731 144.944 1.00 0.00 H ATOM 26319 H2 WAT 9160 138.414 144.164 144.464 1.00 0.00 H TER 26321 WAT 9160 ATOM 26321 O WAT 9161 42.642 25.517 157.214 1.00 0.00 O ATOM 26322 H1 WAT 9161 41.967 25.250 157.838 1.00 0.00 H ATOM 26323 H2 WAT 9161 42.447 26.436 157.029 1.00 0.00 H TER 26325 WAT 9161 ATOM 26325 O WAT 9162 31.756 107.709 6.141 1.00 0.00 O ATOM 26326 H1 WAT 9162 32.550 107.727 5.607 1.00 0.00 H ATOM 26327 H2 WAT 9162 31.491 106.789 6.145 1.00 0.00 H TER 26329 WAT 9162 ATOM 26329 O WAT 9163 16.646 106.294 117.789 1.00 0.00 O ATOM 26330 H1 WAT 9163 15.780 106.061 117.455 1.00 0.00 H ATOM 26331 H2 WAT 9163 16.657 107.251 117.778 1.00 0.00 H TER 26333 WAT 9163 ATOM 26333 O WAT 9164 44.484 43.640 130.726 1.00 0.00 O ATOM 26334 H1 WAT 9164 44.765 42.790 131.063 1.00 0.00 H ATOM 26335 H2 WAT 9164 44.668 43.600 129.788 1.00 0.00 H TER 26337 WAT 9164 ATOM 26337 O WAT 9165 56.080 95.113 122.592 1.00 0.00 O ATOM 26338 H1 WAT 9165 56.769 94.692 123.106 1.00 0.00 H ATOM 26339 H2 WAT 9165 56.549 95.697 121.996 1.00 0.00 H TER 26341 WAT 9165 ATOM 26341 O WAT 9166 42.609 38.950 121.510 1.00 0.00 O ATOM 26342 H1 WAT 9166 42.443 38.315 122.207 1.00 0.00 H ATOM 26343 H2 WAT 9166 41.857 38.864 120.924 1.00 0.00 H TER 26345 WAT 9166 ATOM 26345 O WAT 9167 38.167 102.414 79.129 1.00 0.00 O ATOM 26346 H1 WAT 9167 38.428 101.601 79.562 1.00 0.00 H ATOM 26347 H2 WAT 9167 38.676 103.095 79.572 1.00 0.00 H TER 26349 WAT 9167 ATOM 26349 O WAT 9168 98.633 70.126 130.284 1.00 0.00 O ATOM 26350 H1 WAT 9168 99.575 70.284 130.235 1.00 0.00 H ATOM 26351 H2 WAT 9168 98.548 69.173 130.270 1.00 0.00 H TER 26353 WAT 9168 ATOM 26353 O WAT 9169 145.059 105.568 149.465 1.00 0.00 O ATOM 26354 H1 WAT 9169 144.856 106.032 148.653 1.00 0.00 H ATOM 26355 H2 WAT 9169 145.627 104.847 149.193 1.00 0.00 H TER 26357 WAT 9169 ATOM 26357 O WAT 9170 61.813 127.071 7.180 1.00 0.00 O ATOM 26358 H1 WAT 9170 62.681 127.459 7.289 1.00 0.00 H ATOM 26359 H2 WAT 9170 61.858 126.612 6.341 1.00 0.00 H TER 26361 WAT 9170 ATOM 26361 O WAT 9171 47.189 31.262 106.744 1.00 0.00 O ATOM 26362 H1 WAT 9171 47.437 32.161 106.958 1.00 0.00 H ATOM 26363 H2 WAT 9171 47.195 31.233 105.787 1.00 0.00 H TER 26365 WAT 9171 ATOM 26365 O WAT 9172 0.440 109.940 94.370 1.00 0.00 O ATOM 26366 H1 WAT 9172 1.359 109.679 94.300 1.00 0.00 H ATOM 26367 H2 WAT 9172 0.030 109.586 93.581 1.00 0.00 H TER 26369 WAT 9172 ATOM 26369 O WAT 9173 71.902 97.448 91.258 1.00 0.00 O ATOM 26370 H1 WAT 9173 72.090 97.928 90.451 1.00 0.00 H ATOM 26371 H2 WAT 9173 71.990 96.527 91.014 1.00 0.00 H TER 26373 WAT 9173 ATOM 26373 O WAT 9174 85.330 131.594 74.948 1.00 0.00 O ATOM 26374 H1 WAT 9174 85.328 132.511 74.676 1.00 0.00 H ATOM 26375 H2 WAT 9174 86.191 131.465 75.346 1.00 0.00 H TER 26377 WAT 9174 ATOM 26377 O WAT 9175 59.158 114.590 9.675 1.00 0.00 O ATOM 26378 H1 WAT 9175 58.752 113.796 10.024 1.00 0.00 H ATOM 26379 H2 WAT 9175 60.070 114.539 9.961 1.00 0.00 H TER 26381 WAT 9175 ATOM 26381 O WAT 9176 72.458 124.232 92.985 1.00 0.00 O ATOM 26382 H1 WAT 9176 72.931 124.929 93.440 1.00 0.00 H ATOM 26383 H2 WAT 9176 72.662 124.368 92.060 1.00 0.00 H TER 26385 WAT 9176 ATOM 26385 O WAT 9177 111.125 18.338 76.856 1.00 0.00 O ATOM 26386 H1 WAT 9177 111.045 19.287 76.951 1.00 0.00 H ATOM 26387 H2 WAT 9177 110.399 18.093 76.282 1.00 0.00 H TER 26389 WAT 9177 ATOM 26389 O WAT 9178 46.870 94.514 85.992 1.00 0.00 O ATOM 26390 H1 WAT 9178 46.913 94.013 86.807 1.00 0.00 H ATOM 26391 H2 WAT 9178 47.382 94.000 85.368 1.00 0.00 H TER 26393 WAT 9178 ATOM 26393 O WAT 9179 48.073 20.271 132.728 1.00 0.00 O ATOM 26394 H1 WAT 9179 48.768 20.648 132.189 1.00 0.00 H ATOM 26395 H2 WAT 9179 47.288 20.762 132.484 1.00 0.00 H TER 26397 WAT 9179 ATOM 26397 O WAT 9180 89.980 37.120 112.971 1.00 0.00 O ATOM 26398 H1 WAT 9180 89.905 37.196 113.923 1.00 0.00 H ATOM 26399 H2 WAT 9180 89.771 36.205 112.786 1.00 0.00 H TER 26401 WAT 9180 ATOM 26401 O WAT 9181 73.747 104.607 55.068 1.00 0.00 O ATOM 26402 H1 WAT 9181 73.488 103.885 55.641 1.00 0.00 H ATOM 26403 H2 WAT 9181 72.927 105.054 54.859 1.00 0.00 H TER 26405 WAT 9181 ATOM 26405 O WAT 9182 129.214 117.472 81.102 1.00 0.00 O ATOM 26406 H1 WAT 9182 129.430 118.391 80.939 1.00 0.00 H ATOM 26407 H2 WAT 9182 128.390 117.333 80.635 1.00 0.00 H TER 26409 WAT 9182 ATOM 26409 O WAT 9183 98.344 75.431 124.859 1.00 0.00 O ATOM 26410 H1 WAT 9183 99.114 75.643 125.386 1.00 0.00 H ATOM 26411 H2 WAT 9183 98.296 76.134 124.211 1.00 0.00 H TER 26413 WAT 9183 ATOM 26413 O WAT 9184 88.831 93.951 95.039 1.00 0.00 O ATOM 26414 H1 WAT 9184 88.274 94.445 94.437 1.00 0.00 H ATOM 26415 H2 WAT 9184 88.561 93.041 94.923 1.00 0.00 H TER 26417 WAT 9184 ATOM 26417 O WAT 9185 124.717 105.275 17.040 1.00 0.00 O ATOM 26418 H1 WAT 9185 123.812 105.159 17.328 1.00 0.00 H ATOM 26419 H2 WAT 9185 125.244 104.939 17.765 1.00 0.00 H TER 26421 WAT 9185 ATOM 26421 O WAT 9186 37.640 65.600 124.096 1.00 0.00 O ATOM 26422 H1 WAT 9186 36.831 65.291 123.687 1.00 0.00 H ATOM 26423 H2 WAT 9186 38.333 65.108 123.656 1.00 0.00 H TER 26425 WAT 9186 ATOM 26425 O WAT 9187 140.076 81.751 101.934 1.00 0.00 O ATOM 26426 H1 WAT 9187 140.932 82.089 101.673 1.00 0.00 H ATOM 26427 H2 WAT 9187 139.788 81.226 101.187 1.00 0.00 H TER 26429 WAT 9187 ATOM 26429 O WAT 9188 114.581 40.783 81.423 1.00 0.00 O ATOM 26430 H1 WAT 9188 113.767 40.319 81.227 1.00 0.00 H ATOM 26431 H2 WAT 9188 114.671 40.716 82.374 1.00 0.00 H TER 26433 WAT 9188 ATOM 26433 O WAT 9189 106.032 39.240 126.653 1.00 0.00 O ATOM 26434 H1 WAT 9189 106.482 38.992 125.845 1.00 0.00 H ATOM 26435 H2 WAT 9189 106.629 38.971 127.351 1.00 0.00 H TER 26437 WAT 9189 ATOM 26437 O WAT 9190 81.720 136.971 135.146 1.00 0.00 O ATOM 26438 H1 WAT 9190 82.429 136.919 135.787 1.00 0.00 H ATOM 26439 H2 WAT 9190 81.303 136.110 135.179 1.00 0.00 H TER 26441 WAT 9190 ATOM 26441 O WAT 9191 39.937 37.779 137.225 1.00 0.00 O ATOM 26442 H1 WAT 9191 40.686 37.186 137.162 1.00 0.00 H ATOM 26443 H2 WAT 9191 40.127 38.472 136.592 1.00 0.00 H TER 26445 WAT 9191 ATOM 26445 O WAT 9192 70.221 18.084 145.448 1.00 0.00 O ATOM 26446 H1 WAT 9192 69.805 18.718 146.033 1.00 0.00 H ATOM 26447 H2 WAT 9192 69.573 17.933 144.760 1.00 0.00 H TER 26449 WAT 9192 ATOM 26449 O WAT 9193 30.644 117.328 156.645 1.00 0.00 O ATOM 26450 H1 WAT 9193 30.475 118.253 156.467 1.00 0.00 H ATOM 26451 H2 WAT 9193 31.123 117.020 155.876 1.00 0.00 H TER 26453 WAT 9193 ATOM 26453 O WAT 9194 49.063 27.776 149.496 1.00 0.00 O ATOM 26454 H1 WAT 9194 48.773 27.874 150.403 1.00 0.00 H ATOM 26455 H2 WAT 9194 48.292 27.451 149.031 1.00 0.00 H TER 26457 WAT 9194 ATOM 26457 O WAT 9195 1.994 142.462 69.936 1.00 0.00 O ATOM 26458 H1 WAT 9195 1.833 142.505 70.879 1.00 0.00 H ATOM 26459 H2 WAT 9195 2.871 142.085 69.860 1.00 0.00 H TER 26461 WAT 9195 ATOM 26461 O WAT 9196 96.791 37.581 118.897 1.00 0.00 O ATOM 26462 H1 WAT 9196 97.659 37.256 119.136 1.00 0.00 H ATOM 26463 H2 WAT 9196 96.953 38.454 118.539 1.00 0.00 H TER 26465 WAT 9196 ATOM 26465 O WAT 9197 82.476 24.704 53.607 1.00 0.00 O ATOM 26466 H1 WAT 9197 82.606 23.806 53.300 1.00 0.00 H ATOM 26467 H2 WAT 9197 81.790 24.634 54.270 1.00 0.00 H TER 26469 WAT 9197 ATOM 26469 O WAT 9198 132.203 86.991 149.297 1.00 0.00 O ATOM 26470 H1 WAT 9198 133.010 86.943 148.785 1.00 0.00 H ATOM 26471 H2 WAT 9198 132.497 87.156 150.192 1.00 0.00 H TER 26473 WAT 9198 ATOM 26473 O WAT 9199 107.624 46.553 139.633 1.00 0.00 O ATOM 26474 H1 WAT 9199 107.723 46.910 140.516 1.00 0.00 H ATOM 26475 H2 WAT 9199 107.739 47.307 139.055 1.00 0.00 H TER 26477 WAT 9199 ATOM 26477 O WAT 9200 15.069 55.434 11.124 1.00 0.00 O ATOM 26478 H1 WAT 9200 14.729 55.327 12.013 1.00 0.00 H ATOM 26479 H2 WAT 9200 15.519 54.610 10.939 1.00 0.00 H TER 26481 WAT 9200 ATOM 26481 O WAT 9201 68.801 12.518 143.707 1.00 0.00 O ATOM 26482 H1 WAT 9201 68.416 13.115 143.065 1.00 0.00 H ATOM 26483 H2 WAT 9201 68.374 11.678 143.538 1.00 0.00 H TER 26485 WAT 9201 ATOM 26485 O WAT 9202 103.763 51.824 136.081 1.00 0.00 O ATOM 26486 H1 WAT 9202 104.007 51.589 136.976 1.00 0.00 H ATOM 26487 H2 WAT 9202 102.809 51.901 136.105 1.00 0.00 H TER 26489 WAT 9202 ATOM 26489 O WAT 9203 96.837 113.310 16.438 1.00 0.00 O ATOM 26490 H1 WAT 9203 95.977 113.715 16.330 1.00 0.00 H ATOM 26491 H2 WAT 9203 97.324 113.924 16.987 1.00 0.00 H TER 26493 WAT 9203 ATOM 26493 O WAT 9204 76.457 105.563 13.244 1.00 0.00 O ATOM 26494 H1 WAT 9204 76.657 106.035 14.052 1.00 0.00 H ATOM 26495 H2 WAT 9204 76.429 106.243 12.570 1.00 0.00 H TER 26497 WAT 9204 ATOM 26497 O WAT 9205 56.956 13.104 121.457 1.00 0.00 O ATOM 26498 H1 WAT 9205 56.678 12.436 122.084 1.00 0.00 H ATOM 26499 H2 WAT 9205 57.717 12.721 121.020 1.00 0.00 H TER 26501 WAT 9205 ATOM 26501 O WAT 9206 104.213 43.704 13.877 1.00 0.00 O ATOM 26502 H1 WAT 9206 105.004 43.406 13.428 1.00 0.00 H ATOM 26503 H2 WAT 9206 103.845 44.371 13.296 1.00 0.00 H TER 26505 WAT 9206 ATOM 26505 O WAT 9207 41.080 58.652 79.503 1.00 0.00 O ATOM 26506 H1 WAT 9207 41.207 57.802 79.924 1.00 0.00 H ATOM 26507 H2 WAT 9207 40.669 59.194 80.176 1.00 0.00 H TER 26509 WAT 9207 ATOM 26509 O WAT 9208 10.170 90.101 10.922 1.00 0.00 O ATOM 26510 H1 WAT 9208 10.071 90.424 11.817 1.00 0.00 H ATOM 26511 H2 WAT 9208 11.093 90.247 10.714 1.00 0.00 H TER 26513 WAT 9208 ATOM 26513 O WAT 9209 61.664 82.778 5.126 1.00 0.00 O ATOM 26514 H1 WAT 9209 61.620 83.725 4.996 1.00 0.00 H ATOM 26515 H2 WAT 9209 62.535 82.534 4.816 1.00 0.00 H TER 26517 WAT 9209 ATOM 26517 O WAT 9210 103.967 25.164 79.812 1.00 0.00 O ATOM 26518 H1 WAT 9210 104.407 24.327 79.957 1.00 0.00 H ATOM 26519 H2 WAT 9210 104.657 25.819 79.921 1.00 0.00 H TER 26521 WAT 9210 ATOM 26521 O WAT 9211 102.821 43.624 97.238 1.00 0.00 O ATOM 26522 H1 WAT 9211 102.908 44.258 97.949 1.00 0.00 H ATOM 26523 H2 WAT 9211 103.386 42.896 97.495 1.00 0.00 H TER 26525 WAT 9211 ATOM 26525 O WAT 9212 64.678 97.335 60.568 1.00 0.00 O ATOM 26526 H1 WAT 9212 65.063 97.406 61.441 1.00 0.00 H ATOM 26527 H2 WAT 9212 64.380 98.221 60.364 1.00 0.00 H TER 26529 WAT 9212 ATOM 26529 O WAT 9213 10.617 16.212 23.919 1.00 0.00 O ATOM 26530 H1 WAT 9213 9.726 16.169 24.268 1.00 0.00 H ATOM 26531 H2 WAT 9213 11.089 15.521 24.383 1.00 0.00 H TER 26533 WAT 9213 ATOM 26533 O WAT 9214 114.927 80.405 129.659 1.00 0.00 O ATOM 26534 H1 WAT 9214 115.758 80.869 129.754 1.00 0.00 H ATOM 26535 H2 WAT 9214 114.320 81.065 129.325 1.00 0.00 H TER 26537 WAT 9214 ATOM 26537 O WAT 9215 140.580 95.534 87.305 1.00 0.00 O ATOM 26538 H1 WAT 9215 140.760 94.644 87.609 1.00 0.00 H ATOM 26539 H2 WAT 9215 140.756 96.087 88.067 1.00 0.00 H TER 26541 WAT 9215 ATOM 26541 O WAT 9216 54.848 74.311 69.495 1.00 0.00 O ATOM 26542 H1 WAT 9216 55.320 74.932 68.941 1.00 0.00 H ATOM 26543 H2 WAT 9216 55.155 74.500 70.382 1.00 0.00 H TER 26545 WAT 9216 ATOM 26545 O WAT 9217 15.938 93.861 115.356 1.00 0.00 O ATOM 26546 H1 WAT 9217 15.145 94.368 115.179 1.00 0.00 H ATOM 26547 H2 WAT 9217 15.619 92.981 115.559 1.00 0.00 H TER 26549 WAT 9217 ATOM 26549 O WAT 9218 28.181 40.326 76.574 1.00 0.00 O ATOM 26550 H1 WAT 9218 28.474 40.201 75.671 1.00 0.00 H ATOM 26551 H2 WAT 9218 28.815 39.840 77.101 1.00 0.00 H TER 26553 WAT 9218 ATOM 26553 O WAT 9219 107.868 61.792 74.939 1.00 0.00 O ATOM 26554 H1 WAT 9219 108.583 62.165 75.453 1.00 0.00 H ATOM 26555 H2 WAT 9219 108.304 61.287 74.252 1.00 0.00 H TER 26557 WAT 9219 ATOM 26557 O WAT 9220 74.638 91.665 118.370 1.00 0.00 O ATOM 26558 H1 WAT 9220 75.189 91.096 118.907 1.00 0.00 H ATOM 26559 H2 WAT 9220 75.255 92.147 117.820 1.00 0.00 H TER 26561 WAT 9220 ATOM 26561 O WAT 9221 41.385 86.302 87.094 1.00 0.00 O ATOM 26562 H1 WAT 9221 41.004 87.177 87.171 1.00 0.00 H ATOM 26563 H2 WAT 9221 42.326 86.440 87.199 1.00 0.00 H TER 26565 WAT 9221 ATOM 26565 O WAT 9222 87.964 123.469 155.087 1.00 0.00 O ATOM 26566 H1 WAT 9222 88.881 123.372 155.343 1.00 0.00 H ATOM 26567 H2 WAT 9222 87.987 124.048 154.326 1.00 0.00 H TER 26569 WAT 9222 ATOM 26569 O WAT 9223 40.729 32.988 151.666 1.00 0.00 O ATOM 26570 H1 WAT 9223 40.062 33.440 151.151 1.00 0.00 H ATOM 26571 H2 WAT 9223 40.293 32.779 152.493 1.00 0.00 H TER 26573 WAT 9223 ATOM 26573 O WAT 9224 111.734 109.685 110.358 1.00 0.00 O ATOM 26574 H1 WAT 9224 112.293 109.828 111.122 1.00 0.00 H ATOM 26575 H2 WAT 9224 111.150 110.443 110.343 1.00 0.00 H TER 26577 WAT 9224 ATOM 26577 O WAT 9225 10.985 13.537 4.321 1.00 0.00 O ATOM 26578 H1 WAT 9225 10.033 13.573 4.228 1.00 0.00 H ATOM 26579 H2 WAT 9225 11.318 13.668 3.434 1.00 0.00 H TER 26581 WAT 9225 ATOM 26581 O WAT 9226 55.324 89.485 110.020 1.00 0.00 O ATOM 26582 H1 WAT 9226 55.136 89.894 110.865 1.00 0.00 H ATOM 26583 H2 WAT 9226 54.902 90.056 109.378 1.00 0.00 H TER 26585 WAT 9226 ATOM 26585 O WAT 9227 98.489 15.687 84.396 1.00 0.00 O ATOM 26586 H1 WAT 9227 99.130 15.257 84.962 1.00 0.00 H ATOM 26587 H2 WAT 9227 99.017 16.201 83.784 1.00 0.00 H TER 26589 WAT 9227 ATOM 26589 O WAT 9228 114.951 17.749 130.344 1.00 0.00 O ATOM 26590 H1 WAT 9228 115.092 17.262 129.532 1.00 0.00 H ATOM 26591 H2 WAT 9228 115.244 18.638 130.144 1.00 0.00 H TER 26593 WAT 9228 ATOM 26593 O WAT 9229 136.058 134.902 112.366 1.00 0.00 O ATOM 26594 H1 WAT 9229 136.771 134.285 112.532 1.00 0.00 H ATOM 26595 H2 WAT 9229 136.023 135.445 113.153 1.00 0.00 H TER 26597 WAT 9229 ATOM 26597 O WAT 9230 30.388 101.283 130.160 1.00 0.00 O ATOM 26598 H1 WAT 9230 30.918 101.931 130.624 1.00 0.00 H ATOM 26599 H2 WAT 9230 29.991 101.769 129.438 1.00 0.00 H TER 26601 WAT 9230 ATOM 26601 O WAT 9231 112.559 117.205 24.461 1.00 0.00 O ATOM 26602 H1 WAT 9231 112.068 116.724 23.795 1.00 0.00 H ATOM 26603 H2 WAT 9231 112.462 116.680 25.256 1.00 0.00 H TER 26605 WAT 9231 ATOM 26605 O WAT 9232 108.096 42.311 127.201 1.00 0.00 O ATOM 26606 H1 WAT 9232 108.064 43.013 127.852 1.00 0.00 H ATOM 26607 H2 WAT 9232 107.210 42.281 126.838 1.00 0.00 H TER 26609 WAT 9232 ATOM 26609 O WAT 9233 66.894 64.582 147.831 1.00 0.00 O ATOM 26610 H1 WAT 9233 67.589 65.163 147.522 1.00 0.00 H ATOM 26611 H2 WAT 9233 66.116 65.138 147.869 1.00 0.00 H TER 26613 WAT 9233 ATOM 26613 O WAT 9234 126.580 109.357 124.674 1.00 0.00 O ATOM 26614 H1 WAT 9234 126.124 109.497 123.844 1.00 0.00 H ATOM 26615 H2 WAT 9234 126.653 110.231 125.058 1.00 0.00 H TER 26617 WAT 9234 ATOM 26617 O WAT 9235 23.895 84.970 82.978 1.00 0.00 O ATOM 26618 H1 WAT 9235 24.503 85.647 82.680 1.00 0.00 H ATOM 26619 H2 WAT 9235 23.342 85.411 83.623 1.00 0.00 H TER 26621 WAT 9235 ATOM 26621 O WAT 9236 81.644 42.846 133.914 1.00 0.00 O ATOM 26622 H1 WAT 9236 82.418 43.384 134.078 1.00 0.00 H ATOM 26623 H2 WAT 9236 81.491 42.926 132.973 1.00 0.00 H TER 26625 WAT 9236 ATOM 26625 O WAT 9237 55.583 26.419 93.437 1.00 0.00 O ATOM 26626 H1 WAT 9237 55.798 25.603 93.888 1.00 0.00 H ATOM 26627 H2 WAT 9237 55.684 27.097 94.105 1.00 0.00 H TER 26629 WAT 9237 ATOM 26629 O WAT 9238 50.873 133.707 84.340 1.00 0.00 O ATOM 26630 H1 WAT 9238 50.507 134.588 84.416 1.00 0.00 H ATOM 26631 H2 WAT 9238 50.320 133.273 83.690 1.00 0.00 H TER 26633 WAT 9238 ATOM 26633 O WAT 9239 145.641 141.786 93.383 1.00 0.00 O ATOM 26634 H1 WAT 9239 144.800 142.242 93.405 1.00 0.00 H ATOM 26635 H2 WAT 9239 145.985 141.959 92.507 1.00 0.00 H TER 26637 WAT 9239 ATOM 26637 O WAT 9240 106.070 47.806 123.743 1.00 0.00 O ATOM 26638 H1 WAT 9240 106.051 46.914 123.397 1.00 0.00 H ATOM 26639 H2 WAT 9240 106.450 47.716 124.617 1.00 0.00 H TER 26641 WAT 9240 ATOM 26641 O WAT 9241 65.241 104.083 96.138 1.00 0.00 O ATOM 26642 H1 WAT 9241 65.569 104.644 95.434 1.00 0.00 H ATOM 26643 H2 WAT 9241 65.979 103.512 96.352 1.00 0.00 H TER 26645 WAT 9241 ATOM 26645 O WAT 9242 43.079 5.358 15.902 1.00 0.00 O ATOM 26646 H1 WAT 9242 42.735 6.252 15.880 1.00 0.00 H ATOM 26647 H2 WAT 9242 42.339 4.811 15.637 1.00 0.00 H TER 26649 WAT 9242 ATOM 26649 O WAT 9243 41.212 110.126 11.673 1.00 0.00 O ATOM 26650 H1 WAT 9243 40.901 110.172 12.577 1.00 0.00 H ATOM 26651 H2 WAT 9243 40.414 110.113 11.145 1.00 0.00 H TER 26653 WAT 9243 ATOM 26653 O WAT 9244 99.639 26.767 122.406 1.00 0.00 O ATOM 26654 H1 WAT 9244 99.206 27.551 122.744 1.00 0.00 H ATOM 26655 H2 WAT 9244 100.504 27.071 122.131 1.00 0.00 H TER 26657 WAT 9244 ATOM 26657 O WAT 9245 11.509 65.682 143.926 1.00 0.00 O ATOM 26658 H1 WAT 9245 10.974 65.779 144.713 1.00 0.00 H ATOM 26659 H2 WAT 9245 11.015 65.077 143.373 1.00 0.00 H TER 26661 WAT 9245 ATOM 26661 O WAT 9246 89.494 21.237 62.222 1.00 0.00 O ATOM 26662 H1 WAT 9246 88.833 20.836 62.786 1.00 0.00 H ATOM 26663 H2 WAT 9246 89.064 21.319 61.370 1.00 0.00 H TER 26665 WAT 9246 ATOM 26665 O WAT 9247 61.545 125.327 73.159 1.00 0.00 O ATOM 26666 H1 WAT 9247 60.905 125.155 73.850 1.00 0.00 H ATOM 26667 H2 WAT 9247 61.864 124.460 72.907 1.00 0.00 H TER 26669 WAT 9247 ATOM 26669 O WAT 9248 112.303 61.205 124.140 1.00 0.00 O ATOM 26670 H1 WAT 9248 113.200 61.446 124.368 1.00 0.00 H ATOM 26671 H2 WAT 9248 112.309 61.133 123.185 1.00 0.00 H TER 26673 WAT 9248 ATOM 26673 O WAT 9249 70.093 22.481 90.098 1.00 0.00 O ATOM 26674 H1 WAT 9249 70.267 22.409 89.159 1.00 0.00 H ATOM 26675 H2 WAT 9249 69.699 21.641 90.334 1.00 0.00 H TER 26677 WAT 9249 ATOM 26677 O WAT 9250 98.433 44.781 139.609 1.00 0.00 O ATOM 26678 H1 WAT 9250 98.536 43.991 140.139 1.00 0.00 H ATOM 26679 H2 WAT 9250 97.735 44.565 138.991 1.00 0.00 H TER 26681 WAT 9250 ATOM 26681 O WAT 9251 58.063 11.843 3.252 1.00 0.00 O ATOM 26682 H1 WAT 9251 57.923 11.809 2.305 1.00 0.00 H ATOM 26683 H2 WAT 9251 59.015 11.865 3.352 1.00 0.00 H TER 26685 WAT 9251 ATOM 26685 O WAT 9252 34.953 77.716 149.642 1.00 0.00 O ATOM 26686 H1 WAT 9252 34.741 77.813 150.570 1.00 0.00 H ATOM 26687 H2 WAT 9252 35.758 78.222 149.526 1.00 0.00 H TER 26689 WAT 9252 ATOM 26689 O WAT 9253 21.649 125.029 26.344 1.00 0.00 O ATOM 26690 H1 WAT 9253 22.076 125.426 25.585 1.00 0.00 H ATOM 26691 H2 WAT 9253 20.719 125.226 26.226 1.00 0.00 H TER 26693 WAT 9253 ATOM 26693 O WAT 9254 87.560 138.722 119.280 1.00 0.00 O ATOM 26694 H1 WAT 9254 87.258 138.483 118.404 1.00 0.00 H ATOM 26695 H2 WAT 9254 86.835 138.479 119.857 1.00 0.00 H TER 26697 WAT 9254 ATOM 26697 O WAT 9255 54.381 13.013 118.160 1.00 0.00 O ATOM 26698 H1 WAT 9255 54.643 13.756 118.705 1.00 0.00 H ATOM 26699 H2 WAT 9255 53.602 13.320 117.696 1.00 0.00 H TER 26701 WAT 9255 ATOM 26701 O WAT 9256 27.006 138.825 94.789 1.00 0.00 O ATOM 26702 H1 WAT 9256 27.387 138.703 93.919 1.00 0.00 H ATOM 26703 H2 WAT 9256 27.736 139.125 95.330 1.00 0.00 H TER 26705 WAT 9256 ATOM 26705 O WAT 9257 61.589 2.794 156.108 1.00 0.00 O ATOM 26706 H1 WAT 9257 60.634 2.805 156.043 1.00 0.00 H ATOM 26707 H2 WAT 9257 61.881 3.408 155.434 1.00 0.00 H TER 26709 WAT 9257 ATOM 26709 O WAT 9258 86.288 82.583 81.329 1.00 0.00 O ATOM 26710 H1 WAT 9258 86.930 82.037 81.782 1.00 0.00 H ATOM 26711 H2 WAT 9258 85.902 82.003 80.672 1.00 0.00 H TER 26713 WAT 9258 ATOM 26713 O WAT 9259 39.539 113.173 153.603 1.00 0.00 O ATOM 26714 H1 WAT 9259 39.793 112.332 153.984 1.00 0.00 H ATOM 26715 H2 WAT 9259 40.352 113.678 153.576 1.00 0.00 H TER 26717 WAT 9259 ATOM 26717 O WAT 9260 123.462 130.366 93.957 1.00 0.00 O ATOM 26718 H1 WAT 9260 123.999 131.157 94.002 1.00 0.00 H ATOM 26719 H2 WAT 9260 123.030 130.321 94.810 1.00 0.00 H TER 26721 WAT 9260 ATOM 26721 O WAT 9261 123.687 32.573 127.638 1.00 0.00 O ATOM 26722 H1 WAT 9261 124.081 33.376 127.980 1.00 0.00 H ATOM 26723 H2 WAT 9261 124.342 32.222 127.035 1.00 0.00 H TER 26725 WAT 9261 ATOM 26725 O WAT 9262 104.480 128.349 113.497 1.00 0.00 O ATOM 26726 H1 WAT 9262 105.223 127.921 113.923 1.00 0.00 H ATOM 26727 H2 WAT 9262 104.865 128.806 112.749 1.00 0.00 H TER 26729 WAT 9262 ATOM 26729 O WAT 9263 59.912 120.178 6.324 1.00 0.00 O ATOM 26730 H1 WAT 9263 60.762 119.757 6.457 1.00 0.00 H ATOM 26731 H2 WAT 9263 59.298 119.451 6.220 1.00 0.00 H TER 26733 WAT 9263 ATOM 26733 O WAT 9264 132.736 35.757 97.813 1.00 0.00 O ATOM 26734 H1 WAT 9264 133.689 35.770 97.717 1.00 0.00 H ATOM 26735 H2 WAT 9264 132.573 36.204 98.643 1.00 0.00 H TER 26737 WAT 9264 ATOM 26737 O WAT 9265 90.401 12.501 152.114 1.00 0.00 O ATOM 26738 H1 WAT 9265 90.644 13.274 152.622 1.00 0.00 H ATOM 26739 H2 WAT 9265 90.078 11.878 152.765 1.00 0.00 H TER 26741 WAT 9265 ATOM 26741 O WAT 9266 124.639 56.907 14.789 1.00 0.00 O ATOM 26742 H1 WAT 9266 125.128 56.218 14.340 1.00 0.00 H ATOM 26743 H2 WAT 9266 123.855 56.468 15.119 1.00 0.00 H TER 26745 WAT 9266 ATOM 26745 O WAT 9267 139.017 102.526 110.495 1.00 0.00 O ATOM 26746 H1 WAT 9267 139.645 103.237 110.366 1.00 0.00 H ATOM 26747 H2 WAT 9267 138.228 102.817 110.038 1.00 0.00 H TER 26749 WAT 9267 ATOM 26749 O WAT 9268 94.287 37.304 158.610 1.00 0.00 O ATOM 26750 H1 WAT 9268 94.772 38.082 158.332 1.00 0.00 H ATOM 26751 H2 WAT 9268 94.392 36.686 157.887 1.00 0.00 H TER 26753 WAT 9268 ATOM 26753 O WAT 9269 75.469 15.245 81.323 1.00 0.00 O ATOM 26754 H1 WAT 9269 75.181 14.339 81.215 1.00 0.00 H ATOM 26755 H2 WAT 9269 75.805 15.285 82.218 1.00 0.00 H TER 26757 WAT 9269 ATOM 26757 O WAT 9270 85.898 139.447 109.666 1.00 0.00 O ATOM 26758 H1 WAT 9270 86.647 139.963 109.368 1.00 0.00 H ATOM 26759 H2 WAT 9270 86.028 139.360 110.610 1.00 0.00 H TER 26761 WAT 9270 ATOM 26761 O WAT 9271 135.590 142.492 1.313 1.00 0.00 O ATOM 26762 H1 WAT 9271 135.399 143.255 0.769 1.00 0.00 H ATOM 26763 H2 WAT 9271 136.059 142.847 2.068 1.00 0.00 H TER 26765 WAT 9271 ATOM 26765 O WAT 9272 20.878 42.236 121.164 1.00 0.00 O ATOM 26766 H1 WAT 9272 20.425 41.454 121.480 1.00 0.00 H ATOM 26767 H2 WAT 9272 21.724 42.219 121.610 1.00 0.00 H TER 26769 WAT 9272 ATOM 26769 O WAT 9273 81.254 26.422 141.166 1.00 0.00 O ATOM 26770 H1 WAT 9273 81.025 25.694 141.744 1.00 0.00 H ATOM 26771 H2 WAT 9273 81.253 26.041 140.288 1.00 0.00 H TER 26773 WAT 9273 ATOM 26773 O WAT 9274 120.157 77.046 62.406 1.00 0.00 O ATOM 26774 H1 WAT 9274 120.135 77.660 63.140 1.00 0.00 H ATOM 26775 H2 WAT 9274 119.649 77.475 61.719 1.00 0.00 H TER 26777 WAT 9274 ATOM 26777 O WAT 9275 37.764 109.124 74.640 1.00 0.00 O ATOM 26778 H1 WAT 9275 37.826 108.182 74.481 1.00 0.00 H ATOM 26779 H2 WAT 9275 37.524 109.196 75.564 1.00 0.00 H TER 26781 WAT 9275 ATOM 26781 O WAT 9276 19.768 67.941 59.606 1.00 0.00 O ATOM 26782 H1 WAT 9276 20.424 67.421 59.142 1.00 0.00 H ATOM 26783 H2 WAT 9276 18.929 67.601 59.295 1.00 0.00 H TER 26785 WAT 9276 ATOM 26785 O WAT 9277 6.047 114.717 101.636 1.00 0.00 O ATOM 26786 H1 WAT 9277 6.708 115.399 101.511 1.00 0.00 H ATOM 26787 H2 WAT 9277 6.185 114.412 102.533 1.00 0.00 H TER 26789 WAT 9277 ATOM 26789 O WAT 9278 83.900 69.656 110.391 1.00 0.00 O ATOM 26790 H1 WAT 9278 84.368 69.144 109.731 1.00 0.00 H ATOM 26791 H2 WAT 9278 84.001 69.154 111.199 1.00 0.00 H TER 26793 WAT 9278 ATOM 26793 O WAT 9279 81.922 47.539 146.285 1.00 0.00 O ATOM 26794 H1 WAT 9279 82.528 46.979 145.801 1.00 0.00 H ATOM 26795 H2 WAT 9279 81.057 47.172 146.101 1.00 0.00 H TER 26797 WAT 9279 ATOM 26797 O WAT 9280 0.465 140.489 135.644 1.00 0.00 O ATOM 26798 H1 WAT 9280 -0.279 140.526 136.245 1.00 0.00 H ATOM 26799 H2 WAT 9280 1.178 140.915 136.119 1.00 0.00 H TER 26801 WAT 9280 ATOM 26801 O WAT 9281 98.977 52.984 147.649 1.00 0.00 O ATOM 26802 H1 WAT 9281 98.325 52.473 148.128 1.00 0.00 H ATOM 26803 H2 WAT 9281 99.816 52.594 147.898 1.00 0.00 H TER 26805 WAT 9281 ATOM 26805 O WAT 9282 56.850 124.244 49.394 1.00 0.00 O ATOM 26806 H1 WAT 9282 56.365 124.444 50.194 1.00 0.00 H ATOM 26807 H2 WAT 9282 56.628 124.957 48.795 1.00 0.00 H TER 26809 WAT 9282 ATOM 26809 O WAT 9283 89.213 114.555 101.122 1.00 0.00 O ATOM 26810 H1 WAT 9283 88.964 113.800 101.656 1.00 0.00 H ATOM 26811 H2 WAT 9283 89.468 114.179 100.280 1.00 0.00 H TER 26813 WAT 9283 ATOM 26813 O WAT 9284 62.266 32.704 126.371 1.00 0.00 O ATOM 26814 H1 WAT 9284 62.729 33.311 125.794 1.00 0.00 H ATOM 26815 H2 WAT 9284 62.302 33.118 127.233 1.00 0.00 H TER 26817 WAT 9284 ATOM 26817 O WAT 9285 77.539 105.639 103.668 1.00 0.00 O ATOM 26818 H1 WAT 9285 77.953 104.981 103.111 1.00 0.00 H ATOM 26819 H2 WAT 9285 76.896 106.064 103.100 1.00 0.00 H TER 26821 WAT 9285 ATOM 26821 O WAT 9286 93.139 28.456 17.395 1.00 0.00 O ATOM 26822 H1 WAT 9286 93.443 27.688 16.911 1.00 0.00 H ATOM 26823 H2 WAT 9286 92.249 28.233 17.665 1.00 0.00 H TER 26825 WAT 9286 ATOM 26825 O WAT 9287 6.298 4.757 99.252 1.00 0.00 O ATOM 26826 H1 WAT 9287 6.911 5.346 98.812 1.00 0.00 H ATOM 26827 H2 WAT 9287 5.433 5.085 99.006 1.00 0.00 H TER 26829 WAT 9287 ATOM 26829 O WAT 9288 94.975 107.329 103.610 1.00 0.00 O ATOM 26830 H1 WAT 9288 95.576 107.730 104.238 1.00 0.00 H ATOM 26831 H2 WAT 9288 95.110 107.821 102.801 1.00 0.00 H TER 26833 WAT 9288 ATOM 26833 O WAT 9289 46.577 133.672 136.777 1.00 0.00 O ATOM 26834 H1 WAT 9289 46.033 134.458 136.724 1.00 0.00 H ATOM 26835 H2 WAT 9289 47.266 133.813 136.127 1.00 0.00 H TER 26837 WAT 9289 ATOM 26837 O WAT 9290 128.515 136.114 157.388 1.00 0.00 O ATOM 26838 H1 WAT 9290 128.998 136.937 157.455 1.00 0.00 H ATOM 26839 H2 WAT 9290 128.147 135.980 158.261 1.00 0.00 H TER 26841 WAT 9290 ATOM 26841 O WAT 9291 86.549 75.199 135.806 1.00 0.00 O ATOM 26842 H1 WAT 9291 87.425 74.831 135.920 1.00 0.00 H ATOM 26843 H2 WAT 9291 85.957 74.497 136.076 1.00 0.00 H TER 26845 WAT 9291 ATOM 26845 O WAT 9292 114.319 127.084 129.938 1.00 0.00 O ATOM 26846 H1 WAT 9292 114.227 126.485 130.679 1.00 0.00 H ATOM 26847 H2 WAT 9292 114.715 127.871 130.313 1.00 0.00 H TER 26849 WAT 9292 ATOM 26849 O WAT 9293 37.277 130.027 138.524 1.00 0.00 O ATOM 26850 H1 WAT 9293 37.283 130.706 137.849 1.00 0.00 H ATOM 26851 H2 WAT 9293 36.440 129.579 138.407 1.00 0.00 H TER 26853 WAT 9293 ATOM 26853 O WAT 9294 50.986 14.942 84.586 1.00 0.00 O ATOM 26854 H1 WAT 9294 51.417 14.406 83.920 1.00 0.00 H ATOM 26855 H2 WAT 9294 50.657 15.701 84.105 1.00 0.00 H TER 26857 WAT 9294 ATOM 26857 O WAT 9295 6.482 134.593 129.684 1.00 0.00 O ATOM 26858 H1 WAT 9295 6.669 135.526 129.791 1.00 0.00 H ATOM 26859 H2 WAT 9295 5.553 134.509 129.896 1.00 0.00 H TER 26861 WAT 9295 ATOM 26861 O WAT 9296 119.458 46.154 58.387 1.00 0.00 O ATOM 26862 H1 WAT 9296 118.992 45.322 58.474 1.00 0.00 H ATOM 26863 H2 WAT 9296 119.246 46.632 59.189 1.00 0.00 H TER 26865 WAT 9296 ATOM 26865 O WAT 9297 64.784 55.118 80.824 1.00 0.00 O ATOM 26866 H1 WAT 9297 65.191 54.492 80.225 1.00 0.00 H ATOM 26867 H2 WAT 9297 65.383 55.160 81.570 1.00 0.00 H TER 26869 WAT 9297 ATOM 26869 O WAT 9298 25.739 113.902 129.817 1.00 0.00 O ATOM 26870 H1 WAT 9298 25.205 113.589 129.087 1.00 0.00 H ATOM 26871 H2 WAT 9298 26.581 114.124 129.420 1.00 0.00 H TER 26873 WAT 9298 ATOM 26873 O WAT 9299 65.343 133.540 92.519 1.00 0.00 O ATOM 26874 H1 WAT 9299 65.372 134.471 92.302 1.00 0.00 H ATOM 26875 H2 WAT 9299 64.414 133.356 92.661 1.00 0.00 H TER 26877 WAT 9299 ATOM 26877 O WAT 9300 120.400 133.926 23.673 1.00 0.00 O ATOM 26878 H1 WAT 9300 120.352 134.403 24.501 1.00 0.00 H ATOM 26879 H2 WAT 9300 121.312 134.016 23.397 1.00 0.00 H TER 26881 WAT 9300 ATOM 26881 O WAT 9301 141.109 92.492 119.718 1.00 0.00 O ATOM 26882 H1 WAT 9301 140.391 92.340 119.103 1.00 0.00 H ATOM 26883 H2 WAT 9301 140.829 93.252 120.229 1.00 0.00 H TER 26885 WAT 9301 ATOM 26885 O WAT 9302 69.724 69.484 18.656 1.00 0.00 O ATOM 26886 H1 WAT 9302 70.210 68.659 18.686 1.00 0.00 H ATOM 26887 H2 WAT 9302 70.398 70.153 18.535 1.00 0.00 H TER 26889 WAT 9302 ATOM 26889 O WAT 9303 98.184 98.645 104.804 1.00 0.00 O ATOM 26890 H1 WAT 9303 97.921 99.129 105.587 1.00 0.00 H ATOM 26891 H2 WAT 9303 97.756 99.106 104.083 1.00 0.00 H TER 26893 WAT 9303 ATOM 26893 O WAT 9304 102.199 143.638 115.797 1.00 0.00 O ATOM 26894 H1 WAT 9304 102.021 144.296 115.126 1.00 0.00 H ATOM 26895 H2 WAT 9304 102.770 144.083 116.424 1.00 0.00 H TER 26897 WAT 9304 ATOM 26897 O WAT 9305 53.766 25.270 123.452 1.00 0.00 O ATOM 26898 H1 WAT 9305 53.018 24.766 123.771 1.00 0.00 H ATOM 26899 H2 WAT 9305 53.727 25.180 122.500 1.00 0.00 H TER 26901 WAT 9305 ATOM 26901 O WAT 9306 1.174 118.137 125.397 1.00 0.00 O ATOM 26902 H1 WAT 9306 1.080 118.387 124.478 1.00 0.00 H ATOM 26903 H2 WAT 9306 2.104 117.930 125.495 1.00 0.00 H TER 26905 WAT 9306 ATOM 26905 O WAT 9307 89.038 34.960 152.996 1.00 0.00 O ATOM 26906 H1 WAT 9307 89.199 35.709 153.570 1.00 0.00 H ATOM 26907 H2 WAT 9307 89.889 34.526 152.923 1.00 0.00 H TER 26909 WAT 9307 ATOM 26909 O WAT 9308 15.093 10.900 78.908 1.00 0.00 O ATOM 26910 H1 WAT 9308 14.555 11.475 78.364 1.00 0.00 H ATOM 26911 H2 WAT 9308 15.641 11.497 79.418 1.00 0.00 H TER 26913 WAT 9308 ATOM 26913 O WAT 9309 129.976 3.308 97.368 1.00 0.00 O ATOM 26914 H1 WAT 9309 130.295 4.188 97.168 1.00 0.00 H ATOM 26915 H2 WAT 9309 129.165 3.228 96.866 1.00 0.00 H TER 26917 WAT 9309 ATOM 26917 O WAT 9310 5.261 117.806 105.798 1.00 0.00 O ATOM 26918 H1 WAT 9310 5.009 118.673 106.114 1.00 0.00 H ATOM 26919 H2 WAT 9310 4.528 117.528 105.248 1.00 0.00 H TER 26921 WAT 9310 ATOM 26921 O WAT 9311 38.259 123.311 98.650 1.00 0.00 O ATOM 26922 H1 WAT 9311 37.478 123.501 98.130 1.00 0.00 H ATOM 26923 H2 WAT 9311 38.923 123.913 98.314 1.00 0.00 H TER 26925 WAT 9311 ATOM 26925 O WAT 9312 122.093 97.605 109.105 1.00 0.00 O ATOM 26926 H1 WAT 9312 121.417 98.281 109.162 1.00 0.00 H ATOM 26927 H2 WAT 9312 122.494 97.593 109.974 1.00 0.00 H TER 26929 WAT 9312 ATOM 26929 O WAT 9313 60.263 139.056 129.427 1.00 0.00 O ATOM 26930 H1 WAT 9313 60.787 139.175 128.635 1.00 0.00 H ATOM 26931 H2 WAT 9313 60.318 138.119 129.613 1.00 0.00 H TER 26933 WAT 9313 ATOM 26933 O WAT 9314 87.335 31.725 13.092 1.00 0.00 O ATOM 26934 H1 WAT 9314 86.501 31.592 13.543 1.00 0.00 H ATOM 26935 H2 WAT 9314 87.202 32.519 12.573 1.00 0.00 H TER 26937 WAT 9314 ATOM 26937 O WAT 9315 86.636 56.940 149.219 1.00 0.00 O ATOM 26938 H1 WAT 9315 87.347 56.986 149.858 1.00 0.00 H ATOM 26939 H2 WAT 9315 85.847 57.142 149.724 1.00 0.00 H TER 26941 WAT 9315 ATOM 26941 O WAT 9316 111.732 104.551 82.153 1.00 0.00 O ATOM 26942 H1 WAT 9316 111.205 104.436 81.363 1.00 0.00 H ATOM 26943 H2 WAT 9316 112.193 103.719 82.258 1.00 0.00 H TER 26945 WAT 9316 ATOM 26945 O WAT 9317 49.900 108.005 21.716 1.00 0.00 O ATOM 26946 H1 WAT 9317 50.811 108.075 22.001 1.00 0.00 H ATOM 26947 H2 WAT 9317 49.697 108.865 21.346 1.00 0.00 H TER 26949 WAT 9317 ATOM 26949 O WAT 9318 86.848 44.936 10.170 1.00 0.00 O ATOM 26950 H1 WAT 9318 87.097 45.793 9.825 1.00 0.00 H ATOM 26951 H2 WAT 9318 87.261 44.895 11.032 1.00 0.00 H TER 26953 WAT 9318 ATOM 26953 O WAT 9319 93.611 45.447 6.526 1.00 0.00 O ATOM 26954 H1 WAT 9319 93.357 45.429 7.449 1.00 0.00 H ATOM 26955 H2 WAT 9319 93.034 46.101 6.132 1.00 0.00 H TER 26957 WAT 9319 ATOM 26957 O WAT 9320 23.479 81.697 60.382 1.00 0.00 O ATOM 26958 H1 WAT 9320 23.624 81.929 61.300 1.00 0.00 H ATOM 26959 H2 WAT 9320 24.355 81.689 59.996 1.00 0.00 H TER 26961 WAT 9320 ATOM 26961 O WAT 9321 74.440 119.642 97.984 1.00 0.00 O ATOM 26962 H1 WAT 9321 74.072 119.763 98.859 1.00 0.00 H ATOM 26963 H2 WAT 9321 74.367 118.701 97.822 1.00 0.00 H TER 26965 WAT 9321 ATOM 26965 O WAT 9322 7.442 88.798 107.583 1.00 0.00 O ATOM 26966 H1 WAT 9322 8.377 88.595 107.600 1.00 0.00 H ATOM 26967 H2 WAT 9322 7.038 88.114 108.118 1.00 0.00 H TER 26969 WAT 9322 ATOM 26969 O WAT 9323 49.516 67.073 149.830 1.00 0.00 O ATOM 26970 H1 WAT 9323 49.969 67.608 149.179 1.00 0.00 H ATOM 26971 H2 WAT 9323 49.647 66.172 149.533 1.00 0.00 H TER 26973 WAT 9323 ATOM 26973 O WAT 9324 44.428 57.868 132.661 1.00 0.00 O ATOM 26974 H1 WAT 9324 44.886 58.488 133.228 1.00 0.00 H ATOM 26975 H2 WAT 9324 44.625 57.010 133.036 1.00 0.00 H TER 26977 WAT 9324 ATOM 26977 O WAT 9325 75.199 60.321 77.947 1.00 0.00 O ATOM 26978 H1 WAT 9325 75.719 61.092 78.177 1.00 0.00 H ATOM 26979 H2 WAT 9325 75.060 60.399 77.003 1.00 0.00 H TER 26981 WAT 9325 ATOM 26981 O WAT 9326 5.089 15.479 156.329 1.00 0.00 O ATOM 26982 H1 WAT 9326 4.668 14.733 155.902 1.00 0.00 H ATOM 26983 H2 WAT 9326 4.634 15.563 157.167 1.00 0.00 H TER 26985 WAT 9326 ATOM 26985 O WAT 9327 118.640 93.914 4.636 1.00 0.00 O ATOM 26986 H1 WAT 9327 118.841 93.233 3.994 1.00 0.00 H ATOM 26987 H2 WAT 9327 119.103 93.641 5.428 1.00 0.00 H TER 26989 WAT 9327 ATOM 26989 O WAT 9328 22.896 30.990 139.318 1.00 0.00 O ATOM 26990 H1 WAT 9328 23.185 30.092 139.156 1.00 0.00 H ATOM 26991 H2 WAT 9328 22.606 31.307 138.463 1.00 0.00 H TER 26993 WAT 9328 ATOM 26993 O WAT 9329 143.928 95.278 110.293 1.00 0.00 O ATOM 26994 H1 WAT 9329 143.480 95.638 109.528 1.00 0.00 H ATOM 26995 H2 WAT 9329 144.717 95.812 110.382 1.00 0.00 H TER 26997 WAT 9329 ATOM 26997 O WAT 9330 63.119 116.702 134.729 1.00 0.00 O ATOM 26998 H1 WAT 9330 62.215 116.760 134.418 1.00 0.00 H ATOM 26999 H2 WAT 9330 63.293 117.556 135.123 1.00 0.00 H TER 27001 WAT 9330 ATOM 27001 O WAT 9331 95.865 97.015 124.195 1.00 0.00 O ATOM 27002 H1 WAT 9331 95.564 96.327 123.601 1.00 0.00 H ATOM 27003 H2 WAT 9331 96.334 97.630 123.630 1.00 0.00 H TER 27005 WAT 9331 ATOM 27005 O WAT 9332 109.644 8.799 136.692 1.00 0.00 O ATOM 27006 H1 WAT 9332 109.067 9.185 136.033 1.00 0.00 H ATOM 27007 H2 WAT 9332 110.461 9.292 136.612 1.00 0.00 H TER 27009 WAT 9332 ATOM 27009 O WAT 9333 41.965 102.572 7.091 1.00 0.00 O ATOM 27010 H1 WAT 9333 42.572 103.297 7.238 1.00 0.00 H ATOM 27011 H2 WAT 9333 42.389 102.037 6.419 1.00 0.00 H TER 27013 WAT 9333 ATOM 27013 O WAT 9334 75.125 63.074 130.850 1.00 0.00 O ATOM 27014 H1 WAT 9334 75.374 63.902 131.261 1.00 0.00 H ATOM 27015 H2 WAT 9334 75.950 62.603 130.740 1.00 0.00 H TER 27017 WAT 9334 ATOM 27017 O WAT 9335 1.276 92.477 140.957 1.00 0.00 O ATOM 27018 H1 WAT 9335 1.607 91.669 140.567 1.00 0.00 H ATOM 27019 H2 WAT 9335 0.626 92.797 140.332 1.00 0.00 H TER 27021 WAT 9335 ATOM 27021 O WAT 9336 71.676 95.146 155.224 1.00 0.00 O ATOM 27022 H1 WAT 9336 71.767 94.744 154.360 1.00 0.00 H ATOM 27023 H2 WAT 9336 71.898 94.446 155.838 1.00 0.00 H TER 27025 WAT 9336 ATOM 27025 O WAT 9337 66.010 116.433 134.436 1.00 0.00 O ATOM 27026 H1 WAT 9337 65.125 116.121 134.623 1.00 0.00 H ATOM 27027 H2 WAT 9337 66.575 115.689 134.646 1.00 0.00 H TER 27029 WAT 9337 ATOM 27029 O WAT 9338 91.703 141.318 125.475 1.00 0.00 O ATOM 27030 H1 WAT 9338 90.747 141.312 125.426 1.00 0.00 H ATOM 27031 H2 WAT 9338 91.930 142.240 125.595 1.00 0.00 H TER 27033 WAT 9338 ATOM 27033 O WAT 9339 83.179 55.312 118.664 1.00 0.00 O ATOM 27034 H1 WAT 9339 83.356 55.553 119.573 1.00 0.00 H ATOM 27035 H2 WAT 9339 83.317 56.121 118.171 1.00 0.00 H TER 27037 WAT 9339 ATOM 27037 O WAT 9340 45.687 77.999 112.949 1.00 0.00 O ATOM 27038 H1 WAT 9340 45.038 78.525 112.480 1.00 0.00 H ATOM 27039 H2 WAT 9340 46.398 77.880 112.320 1.00 0.00 H TER 27041 WAT 9340 ATOM 27041 O WAT 9341 12.893 112.701 111.509 1.00 0.00 O ATOM 27042 H1 WAT 9341 12.821 113.606 111.813 1.00 0.00 H ATOM 27043 H2 WAT 9341 11.987 112.415 111.392 1.00 0.00 H TER 27045 WAT 9341 ATOM 27045 O WAT 9342 94.316 60.023 15.264 1.00 0.00 O ATOM 27046 H1 WAT 9342 94.633 60.605 15.954 1.00 0.00 H ATOM 27047 H2 WAT 9342 93.766 59.387 15.721 1.00 0.00 H TER 27049 WAT 9342 ATOM 27049 O WAT 9343 116.476 41.338 19.689 1.00 0.00 O ATOM 27050 H1 WAT 9343 115.871 41.183 20.414 1.00 0.00 H ATOM 27051 H2 WAT 9343 116.701 40.462 19.373 1.00 0.00 H TER 27053 WAT 9343 ATOM 27053 O WAT 9344 34.744 137.981 134.971 1.00 0.00 O ATOM 27054 H1 WAT 9344 34.978 138.344 135.825 1.00 0.00 H ATOM 27055 H2 WAT 9344 33.904 137.545 135.117 1.00 0.00 H TER 27057 WAT 9344 ATOM 27057 O WAT 9345 28.676 0.828 16.479 1.00 0.00 O ATOM 27058 H1 WAT 9345 28.295 1.300 15.739 1.00 0.00 H ATOM 27059 H2 WAT 9345 29.622 0.902 16.348 1.00 0.00 H TER 27061 WAT 9345 ATOM 27061 O WAT 9346 80.459 83.376 156.641 1.00 0.00 O ATOM 27062 H1 WAT 9346 80.440 82.433 156.477 1.00 0.00 H ATOM 27063 H2 WAT 9346 81.032 83.726 155.958 1.00 0.00 H TER 27065 WAT 9346 ATOM 27065 O WAT 9347 139.712 24.002 58.883 1.00 0.00 O ATOM 27066 H1 WAT 9347 140.104 24.870 58.984 1.00 0.00 H ATOM 27067 H2 WAT 9347 139.825 23.795 57.956 1.00 0.00 H TER 27069 WAT 9347 ATOM 27069 O WAT 9348 27.004 63.199 72.505 1.00 0.00 O ATOM 27070 H1 WAT 9348 27.334 63.117 73.400 1.00 0.00 H ATOM 27071 H2 WAT 9348 26.396 63.937 72.541 1.00 0.00 H TER 27073 WAT 9348 ATOM 27073 O WAT 9349 13.862 112.680 4.409 1.00 0.00 O ATOM 27074 H1 WAT 9349 14.365 111.942 4.754 1.00 0.00 H ATOM 27075 H2 WAT 9349 14.306 113.455 4.753 1.00 0.00 H TER 27077 WAT 9349 ATOM 27077 O WAT 9350 63.807 35.286 138.207 1.00 0.00 O ATOM 27078 H1 WAT 9350 64.323 35.062 137.433 1.00 0.00 H ATOM 27079 H2 WAT 9350 64.263 34.857 138.931 1.00 0.00 H TER 27081 WAT 9350 ATOM 27081 O WAT 9351 104.058 106.914 21.629 1.00 0.00 O ATOM 27082 H1 WAT 9351 104.015 107.160 22.554 1.00 0.00 H ATOM 27083 H2 WAT 9351 104.541 107.628 21.214 1.00 0.00 H TER 27085 WAT 9351 ATOM 27085 O WAT 9352 14.348 12.840 141.026 1.00 0.00 O ATOM 27086 H1 WAT 9352 13.555 13.039 141.523 1.00 0.00 H ATOM 27087 H2 WAT 9352 15.037 13.344 141.460 1.00 0.00 H TER 27089 WAT 9352 ATOM 27089 O WAT 9353 36.039 104.505 136.172 1.00 0.00 O ATOM 27090 H1 WAT 9353 35.599 104.155 135.397 1.00 0.00 H ATOM 27091 H2 WAT 9353 36.702 103.849 136.389 1.00 0.00 H TER 27093 WAT 9353 ATOM 27093 O WAT 9354 40.055 55.638 53.404 1.00 0.00 O ATOM 27094 H1 WAT 9354 39.572 54.812 53.435 1.00 0.00 H ATOM 27095 H2 WAT 9354 40.550 55.657 54.223 1.00 0.00 H TER 27097 WAT 9354 ATOM 27097 O WAT 9355 60.824 98.182 80.002 1.00 0.00 O ATOM 27098 H1 WAT 9355 61.048 98.583 79.162 1.00 0.00 H ATOM 27099 H2 WAT 9355 60.813 97.241 79.823 1.00 0.00 H TER 27101 WAT 9355 ATOM 27101 O WAT 9356 85.296 101.207 57.932 1.00 0.00 O ATOM 27102 H1 WAT 9356 85.458 100.327 57.592 1.00 0.00 H ATOM 27103 H2 WAT 9356 84.553 101.528 57.420 1.00 0.00 H TER 27105 WAT 9356 ATOM 27105 O WAT 9357 92.102 14.677 145.139 1.00 0.00 O ATOM 27106 H1 WAT 9357 91.396 14.062 144.939 1.00 0.00 H ATOM 27107 H2 WAT 9357 92.506 14.328 145.933 1.00 0.00 H TER 27109 WAT 9357 ATOM 27109 O WAT 9358 27.186 57.467 121.510 1.00 0.00 O ATOM 27110 H1 WAT 9358 27.155 57.878 122.374 1.00 0.00 H ATOM 27111 H2 WAT 9358 27.430 58.177 120.916 1.00 0.00 H TER 27113 WAT 9358 ATOM 27113 O WAT 9359 74.760 17.021 130.630 1.00 0.00 O ATOM 27114 H1 WAT 9359 74.344 17.533 129.937 1.00 0.00 H ATOM 27115 H2 WAT 9359 74.470 17.438 131.442 1.00 0.00 H TER 27117 WAT 9359 ATOM 27117 O WAT 9360 6.858 30.274 105.224 1.00 0.00 O ATOM 27118 H1 WAT 9360 6.601 30.479 104.325 1.00 0.00 H ATOM 27119 H2 WAT 9360 6.036 30.059 105.665 1.00 0.00 H TER 27121 WAT 9360 ATOM 27121 O WAT 9361 52.863 145.772 2.277 1.00 0.00 O ATOM 27122 H1 WAT 9361 53.047 146.447 1.624 1.00 0.00 H ATOM 27123 H2 WAT 9361 52.999 144.946 1.813 1.00 0.00 H TER 27125 WAT 9361 ATOM 27125 O WAT 9362 77.963 94.455 94.745 1.00 0.00 O ATOM 27126 H1 WAT 9362 77.189 94.482 95.308 1.00 0.00 H ATOM 27127 H2 WAT 9362 77.693 94.908 93.946 1.00 0.00 H TER 27129 WAT 9362 ATOM 27129 O WAT 9363 80.856 139.130 153.530 1.00 0.00 O ATOM 27130 H1 WAT 9363 80.488 138.475 154.124 1.00 0.00 H ATOM 27131 H2 WAT 9363 80.490 139.961 153.833 1.00 0.00 H TER 27133 WAT 9363 ATOM 27133 O WAT 9364 13.383 87.954 100.857 1.00 0.00 O ATOM 27134 H1 WAT 9364 13.759 88.043 101.733 1.00 0.00 H ATOM 27135 H2 WAT 9364 12.842 88.736 100.749 1.00 0.00 H TER 27137 WAT 9364 ATOM 27137 O WAT 9365 31.434 67.062 4.758 1.00 0.00 O ATOM 27138 H1 WAT 9365 32.284 66.639 4.876 1.00 0.00 H ATOM 27139 H2 WAT 9365 31.312 67.095 3.809 1.00 0.00 H TER 27141 WAT 9365 ATOM 27141 O WAT 9366 100.736 42.462 121.094 1.00 0.00 O ATOM 27142 H1 WAT 9366 100.687 41.534 121.326 1.00 0.00 H ATOM 27143 H2 WAT 9366 100.840 42.466 120.143 1.00 0.00 H TER 27145 WAT 9366 ATOM 27145 O WAT 9367 72.884 19.149 145.171 1.00 0.00 O ATOM 27146 H1 WAT 9367 71.948 19.038 145.006 1.00 0.00 H ATOM 27147 H2 WAT 9367 72.934 19.886 145.780 1.00 0.00 H TER 27149 WAT 9367 ATOM 27149 O WAT 9368 45.929 109.972 148.316 1.00 0.00 O ATOM 27150 H1 WAT 9368 45.414 110.590 147.797 1.00 0.00 H ATOM 27151 H2 WAT 9368 45.735 109.117 147.933 1.00 0.00 H TER 27153 WAT 9368 ATOM 27153 O WAT 9369 142.169 45.167 140.966 1.00 0.00 O ATOM 27154 H1 WAT 9369 141.898 44.929 141.852 1.00 0.00 H ATOM 27155 H2 WAT 9369 141.504 45.788 140.670 1.00 0.00 H TER 27157 WAT 9369 ATOM 27157 O WAT 9370 34.809 40.151 122.802 1.00 0.00 O ATOM 27158 H1 WAT 9370 34.108 39.921 122.192 1.00 0.00 H ATOM 27159 H2 WAT 9370 34.789 41.107 122.841 1.00 0.00 H TER 27161 WAT 9370 ATOM 27161 O WAT 9371 30.808 1.389 124.069 1.00 0.00 O ATOM 27162 H1 WAT 9371 31.049 1.859 124.868 1.00 0.00 H ATOM 27163 H2 WAT 9371 31.371 0.615 124.068 1.00 0.00 H TER 27165 WAT 9371 ATOM 27165 O WAT 9372 65.348 138.179 58.262 1.00 0.00 O ATOM 27166 H1 WAT 9372 65.324 137.513 58.949 1.00 0.00 H ATOM 27167 H2 WAT 9372 66.260 138.192 57.973 1.00 0.00 H TER 27169 WAT 9372 ATOM 27169 O WAT 9373 67.913 102.469 118.138 1.00 0.00 O ATOM 27170 H1 WAT 9373 67.857 103.163 118.794 1.00 0.00 H ATOM 27171 H2 WAT 9373 68.618 101.902 118.449 1.00 0.00 H TER 27173 WAT 9373 ATOM 27173 O WAT 9374 115.873 94.355 138.449 1.00 0.00 O ATOM 27174 H1 WAT 9374 115.180 94.708 137.891 1.00 0.00 H ATOM 27175 H2 WAT 9374 116.301 95.128 138.817 1.00 0.00 H TER 27177 WAT 9374 ATOM 27177 O WAT 9375 90.952 58.972 9.664 1.00 0.00 O ATOM 27178 H1 WAT 9375 90.521 59.319 10.445 1.00 0.00 H ATOM 27179 H2 WAT 9375 91.887 59.033 9.858 1.00 0.00 H TER 27181 WAT 9375 ATOM 27181 O WAT 9376 6.988 84.069 9.172 1.00 0.00 O ATOM 27182 H1 WAT 9376 7.153 83.157 9.410 1.00 0.00 H ATOM 27183 H2 WAT 9376 6.283 84.025 8.526 1.00 0.00 H TER 27185 WAT 9376 ATOM 27185 O WAT 9377 58.835 135.706 101.239 1.00 0.00 O ATOM 27186 H1 WAT 9377 58.188 135.202 101.734 1.00 0.00 H ATOM 27187 H2 WAT 9377 58.316 136.216 100.618 1.00 0.00 H TER 27189 WAT 9377 ATOM 27189 O WAT 9378 113.829 117.588 122.845 1.00 0.00 O ATOM 27190 H1 WAT 9378 113.699 118.012 123.693 1.00 0.00 H ATOM 27191 H2 WAT 9378 114.152 116.713 123.061 1.00 0.00 H TER 27193 WAT 9378 ATOM 27193 O WAT 9379 28.616 112.673 64.395 1.00 0.00 O ATOM 27194 H1 WAT 9379 29.253 112.890 63.715 1.00 0.00 H ATOM 27195 H2 WAT 9379 29.107 112.145 65.025 1.00 0.00 H TER 27197 WAT 9379 ATOM 27197 O WAT 9380 38.759 67.565 88.707 1.00 0.00 O ATOM 27198 H1 WAT 9380 38.054 67.392 88.083 1.00 0.00 H ATOM 27199 H2 WAT 9380 38.791 66.781 89.256 1.00 0.00 H TER 27201 WAT 9380 ATOM 27201 O WAT 9381 32.505 133.527 135.646 1.00 0.00 O ATOM 27202 H1 WAT 9381 32.281 133.084 136.465 1.00 0.00 H ATOM 27203 H2 WAT 9381 33.376 133.890 135.800 1.00 0.00 H TER 27205 WAT 9381 ATOM 27205 O WAT 9382 19.419 21.502 130.582 1.00 0.00 O ATOM 27206 H1 WAT 9382 20.172 21.275 131.129 1.00 0.00 H ATOM 27207 H2 WAT 9382 19.803 21.837 129.772 1.00 0.00 H TER 27209 WAT 9382 ATOM 27209 O WAT 9383 114.129 52.723 118.748 1.00 0.00 O ATOM 27210 H1 WAT 9383 114.565 52.468 117.935 1.00 0.00 H ATOM 27211 H2 WAT 9383 113.220 52.446 118.630 1.00 0.00 H TER 27213 WAT 9383 ATOM 27213 O WAT 9384 125.469 133.037 98.499 1.00 0.00 O ATOM 27214 H1 WAT 9384 124.873 133.292 97.795 1.00 0.00 H ATOM 27215 H2 WAT 9384 124.918 132.561 99.120 1.00 0.00 H TER 27217 WAT 9384 ATOM 27217 O WAT 9385 13.051 33.012 76.874 1.00 0.00 O ATOM 27218 H1 WAT 9385 13.220 32.890 75.940 1.00 0.00 H ATOM 27219 H2 WAT 9385 12.184 33.415 76.910 1.00 0.00 H TER 27221 WAT 9385 ATOM 27221 O WAT 9386 104.579 47.475 79.291 1.00 0.00 O ATOM 27222 H1 WAT 9386 104.938 47.025 80.056 1.00 0.00 H ATOM 27223 H2 WAT 9386 105.088 48.283 79.227 1.00 0.00 H TER 27225 WAT 9386 ATOM 27225 O WAT 9387 62.872 67.881 100.640 1.00 0.00 O ATOM 27226 H1 WAT 9387 63.498 68.459 100.202 1.00 0.00 H ATOM 27227 H2 WAT 9387 63.418 67.274 101.141 1.00 0.00 H TER 27229 WAT 9387 ATOM 27229 O WAT 9388 142.268 127.683 118.324 1.00 0.00 O ATOM 27230 H1 WAT 9388 141.594 127.923 117.688 1.00 0.00 H ATOM 27231 H2 WAT 9388 141.780 127.391 119.093 1.00 0.00 H TER 27233 WAT 9388 ATOM 27233 O WAT 9389 72.434 102.594 82.239 1.00 0.00 O ATOM 27234 H1 WAT 9389 71.804 102.073 81.741 1.00 0.00 H ATOM 27235 H2 WAT 9389 72.208 103.502 82.036 1.00 0.00 H TER 27237 WAT 9389 ATOM 27237 O WAT 9390 16.249 126.129 86.555 1.00 0.00 O ATOM 27238 H1 WAT 9390 16.894 125.794 85.931 1.00 0.00 H ATOM 27239 H2 WAT 9390 15.411 125.792 86.238 1.00 0.00 H TER 27241 WAT 9390 ATOM 27241 O WAT 9391 127.186 38.762 78.191 1.00 0.00 O ATOM 27242 H1 WAT 9391 128.132 38.821 78.056 1.00 0.00 H ATOM 27243 H2 WAT 9391 127.056 37.911 78.610 1.00 0.00 H TER 27245 WAT 9391 ATOM 27245 O WAT 9392 123.929 26.225 10.560 1.00 0.00 O ATOM 27246 H1 WAT 9392 123.986 27.175 10.669 1.00 0.00 H ATOM 27247 H2 WAT 9392 124.582 25.875 11.165 1.00 0.00 H TER 27249 WAT 9392 ATOM 27249 O WAT 9393 7.178 126.543 9.148 1.00 0.00 O ATOM 27250 H1 WAT 9393 8.026 126.968 9.274 1.00 0.00 H ATOM 27251 H2 WAT 9393 6.630 126.888 9.853 1.00 0.00 H TER 27253 WAT 9393 ATOM 27253 O WAT 9394 142.564 97.222 84.888 1.00 0.00 O ATOM 27254 H1 WAT 9394 142.774 97.482 85.784 1.00 0.00 H ATOM 27255 H2 WAT 9394 142.394 96.282 84.944 1.00 0.00 H TER 27257 WAT 9394 ATOM 27257 O WAT 9395 88.487 116.999 128.451 1.00 0.00 O ATOM 27258 H1 WAT 9395 89.109 117.661 128.754 1.00 0.00 H ATOM 27259 H2 WAT 9395 88.553 117.027 127.497 1.00 0.00 H TER 27261 WAT 9395 ATOM 27261 O WAT 9396 30.925 92.300 101.928 1.00 0.00 O ATOM 27262 H1 WAT 9396 30.118 91.894 102.247 1.00 0.00 H ATOM 27263 H2 WAT 9396 31.560 92.152 102.629 1.00 0.00 H TER 27265 WAT 9396 ATOM 27265 O WAT 9397 30.822 107.425 67.947 1.00 0.00 O ATOM 27266 H1 WAT 9397 31.175 107.587 68.822 1.00 0.00 H ATOM 27267 H2 WAT 9397 31.464 106.848 67.533 1.00 0.00 H TER 27269 WAT 9397 ATOM 27269 O WAT 9398 97.342 117.224 14.909 1.00 0.00 O ATOM 27270 H1 WAT 9398 98.159 117.681 15.109 1.00 0.00 H ATOM 27271 H2 WAT 9398 97.090 116.812 15.736 1.00 0.00 H TER 27273 WAT 9398 ATOM 27273 O WAT 9399 141.094 83.787 77.168 1.00 0.00 O ATOM 27274 H1 WAT 9399 141.897 84.231 77.441 1.00 0.00 H ATOM 27275 H2 WAT 9399 140.650 83.569 77.987 1.00 0.00 H TER 27277 WAT 9399 ATOM 27277 O WAT 9400 53.163 117.737 65.934 1.00 0.00 O ATOM 27278 H1 WAT 9400 53.826 117.403 65.330 1.00 0.00 H ATOM 27279 H2 WAT 9400 53.308 118.684 65.949 1.00 0.00 H TER 27281 WAT 9400 ATOM 27281 O WAT 9401 79.521 106.419 146.215 1.00 0.00 O ATOM 27282 H1 WAT 9401 80.155 106.230 145.524 1.00 0.00 H ATOM 27283 H2 WAT 9401 79.321 107.349 146.110 1.00 0.00 H TER 27285 WAT 9401 ATOM 27285 O WAT 9402 57.041 8.622 157.422 1.00 0.00 O ATOM 27286 H1 WAT 9402 56.676 7.945 156.853 1.00 0.00 H ATOM 27287 H2 WAT 9402 56.411 8.699 158.138 1.00 0.00 H TER 27289 WAT 9402 ATOM 27289 O WAT 9403 71.742 68.335 103.294 1.00 0.00 O ATOM 27290 H1 WAT 9403 70.860 68.056 103.045 1.00 0.00 H ATOM 27291 H2 WAT 9403 72.020 67.692 103.947 1.00 0.00 H TER 27293 WAT 9403 ATOM 27293 O WAT 9404 67.342 35.751 153.164 1.00 0.00 O ATOM 27294 H1 WAT 9404 67.765 36.493 152.732 1.00 0.00 H ATOM 27295 H2 WAT 9404 68.064 35.174 153.411 1.00 0.00 H TER 27297 WAT 9404 ATOM 27297 O WAT 9405 75.601 130.430 83.805 1.00 0.00 O ATOM 27298 H1 WAT 9405 74.841 130.902 83.462 1.00 0.00 H ATOM 27299 H2 WAT 9405 75.250 129.588 84.094 1.00 0.00 H TER 27301 WAT 9405 ATOM 27301 O WAT 9406 108.340 132.375 115.931 1.00 0.00 O ATOM 27302 H1 WAT 9406 108.744 132.618 115.098 1.00 0.00 H ATOM 27303 H2 WAT 9406 108.691 131.505 116.122 1.00 0.00 H TER 27305 WAT 9406 ATOM 27305 O WAT 9407 70.890 10.254 72.151 1.00 0.00 O ATOM 27306 H1 WAT 9407 70.475 9.644 72.762 1.00 0.00 H ATOM 27307 H2 WAT 9407 71.823 10.201 72.357 1.00 0.00 H TER 27309 WAT 9407 ATOM 27309 O WAT 9408 121.034 9.718 60.442 1.00 0.00 O ATOM 27310 H1 WAT 9408 120.603 9.434 61.248 1.00 0.00 H ATOM 27311 H2 WAT 9408 120.325 10.062 59.899 1.00 0.00 H TER 27313 WAT 9408 ATOM 27313 O WAT 9409 5.285 29.535 108.942 1.00 0.00 O ATOM 27314 H1 WAT 9409 4.960 28.636 108.985 1.00 0.00 H ATOM 27315 H2 WAT 9409 5.087 29.903 109.803 1.00 0.00 H TER 27317 WAT 9409 ATOM 27317 O WAT 9410 139.402 5.030 20.781 1.00 0.00 O ATOM 27318 H1 WAT 9410 138.765 4.412 21.140 1.00 0.00 H ATOM 27319 H2 WAT 9410 140.201 4.515 20.673 1.00 0.00 H TER 27321 WAT 9410 ATOM 27321 O WAT 9411 45.879 130.254 139.009 1.00 0.00 O ATOM 27322 H1 WAT 9411 46.143 129.534 139.583 1.00 0.00 H ATOM 27323 H2 WAT 9411 46.553 130.922 139.138 1.00 0.00 H TER 27325 WAT 9411 ATOM 27325 O WAT 9412 73.263 36.836 12.941 1.00 0.00 O ATOM 27326 H1 WAT 9412 72.323 36.678 12.857 1.00 0.00 H ATOM 27327 H2 WAT 9412 73.343 37.404 13.707 1.00 0.00 H TER 27329 WAT 9412 ATOM 27329 O WAT 9413 40.892 46.251 88.802 1.00 0.00 O ATOM 27330 H1 WAT 9413 41.824 46.415 88.947 1.00 0.00 H ATOM 27331 H2 WAT 9413 40.870 45.574 88.125 1.00 0.00 H TER 27333 WAT 9413 ATOM 27333 O WAT 9414 68.149 87.879 57.825 1.00 0.00 O ATOM 27334 H1 WAT 9414 68.388 86.965 57.980 1.00 0.00 H ATOM 27335 H2 WAT 9414 67.193 87.873 57.784 1.00 0.00 H TER 27337 WAT 9414 ATOM 27337 O WAT 9415 133.735 107.897 3.697 1.00 0.00 O ATOM 27338 H1 WAT 9415 134.050 107.824 4.598 1.00 0.00 H ATOM 27339 H2 WAT 9415 133.878 107.028 3.323 1.00 0.00 H TER 27341 WAT 9415 ATOM 27341 O WAT 9416 3.324 45.145 77.942 1.00 0.00 O ATOM 27342 H1 WAT 9416 4.071 45.743 77.968 1.00 0.00 H ATOM 27343 H2 WAT 9416 3.706 44.278 78.079 1.00 0.00 H TER 27345 WAT 9416 ATOM 27345 O WAT 9417 140.561 95.701 72.891 1.00 0.00 O ATOM 27346 H1 WAT 9417 140.597 95.829 73.839 1.00 0.00 H ATOM 27347 H2 WAT 9417 139.626 95.696 72.686 1.00 0.00 H TER 27349 WAT 9417 ATOM 27349 O WAT 9418 26.703 43.505 10.920 1.00 0.00 O ATOM 27350 H1 WAT 9418 27.257 44.155 10.488 1.00 0.00 H ATOM 27351 H2 WAT 9418 26.133 43.176 10.225 1.00 0.00 H TER 27353 WAT 9418 ATOM 27353 O WAT 9419 38.251 77.108 74.643 1.00 0.00 O ATOM 27354 H1 WAT 9419 37.842 76.259 74.473 1.00 0.00 H ATOM 27355 H2 WAT 9419 38.511 77.068 75.563 1.00 0.00 H TER 27357 WAT 9419 ATOM 27357 O WAT 9420 117.632 84.444 115.869 1.00 0.00 O ATOM 27358 H1 WAT 9420 116.888 84.624 116.444 1.00 0.00 H ATOM 27359 H2 WAT 9420 118.343 84.977 116.225 1.00 0.00 H TER 27361 WAT 9420 ATOM 27361 O WAT 9421 60.951 72.456 132.081 1.00 0.00 O ATOM 27362 H1 WAT 9421 60.982 73.282 131.599 1.00 0.00 H ATOM 27363 H2 WAT 9421 61.286 71.805 131.464 1.00 0.00 H TER 27365 WAT 9421 ATOM 27365 O WAT 9422 99.176 80.853 67.911 1.00 0.00 O ATOM 27366 H1 WAT 9422 98.513 81.535 68.018 1.00 0.00 H ATOM 27367 H2 WAT 9422 99.796 81.009 68.623 1.00 0.00 H TER 27369 WAT 9422 ATOM 27369 O WAT 9423 81.416 138.634 24.243 1.00 0.00 O ATOM 27370 H1 WAT 9423 81.627 139.548 24.055 1.00 0.00 H ATOM 27371 H2 WAT 9423 80.463 138.621 24.331 1.00 0.00 H TER 27373 WAT 9423 ATOM 27373 O WAT 9424 34.450 40.224 73.772 1.00 0.00 O ATOM 27374 H1 WAT 9424 34.581 39.301 73.991 1.00 0.00 H ATOM 27375 H2 WAT 9424 34.942 40.351 72.961 1.00 0.00 H TER 27377 WAT 9424 ATOM 27377 O WAT 9425 106.517 128.211 107.216 1.00 0.00 O ATOM 27378 H1 WAT 9425 106.210 129.035 107.593 1.00 0.00 H ATOM 27379 H2 WAT 9425 107.446 128.358 107.042 1.00 0.00 H TER 27381 WAT 9425 ATOM 27381 O WAT 9426 141.981 139.065 99.033 1.00 0.00 O ATOM 27382 H1 WAT 9426 141.846 139.496 99.877 1.00 0.00 H ATOM 27383 H2 WAT 9426 142.774 139.469 98.682 1.00 0.00 H TER 27385 WAT 9426 ATOM 27385 O WAT 9427 80.624 142.164 142.158 1.00 0.00 O ATOM 27386 H1 WAT 9427 80.356 141.412 142.685 1.00 0.00 H ATOM 27387 H2 WAT 9427 79.847 142.388 141.646 1.00 0.00 H TER 27389 WAT 9427 ATOM 27389 O WAT 9428 131.989 82.062 157.246 1.00 0.00 O ATOM 27390 H1 WAT 9428 131.046 82.090 157.409 1.00 0.00 H ATOM 27391 H2 WAT 9428 132.266 81.211 157.584 1.00 0.00 H TER 27393 WAT 9428 ATOM 27393 O WAT 9429 138.834 124.622 119.026 1.00 0.00 O ATOM 27394 H1 WAT 9429 137.990 124.685 118.580 1.00 0.00 H ATOM 27395 H2 WAT 9429 139.417 125.185 118.517 1.00 0.00 H TER 27397 WAT 9429 ATOM 27397 O WAT 9430 94.681 90.387 74.816 1.00 0.00 O ATOM 27398 H1 WAT 9430 94.670 90.135 73.893 1.00 0.00 H ATOM 27399 H2 WAT 9430 94.726 89.558 75.291 1.00 0.00 H TER 27401 WAT 9430 ATOM 27401 O WAT 9431 44.249 112.985 10.134 1.00 0.00 O ATOM 27402 H1 WAT 9431 44.887 112.725 10.798 1.00 0.00 H ATOM 27403 H2 WAT 9431 43.414 113.016 10.601 1.00 0.00 H TER 27405 WAT 9431 ATOM 27405 O WAT 9432 0.356 37.215 15.077 1.00 0.00 O ATOM 27406 H1 WAT 9432 0.621 37.312 15.992 1.00 0.00 H ATOM 27407 H2 WAT 9432 -0.515 37.610 15.037 1.00 0.00 H TER 27409 WAT 9432 ATOM 27409 O WAT 9433 78.769 112.831 120.165 1.00 0.00 O ATOM 27410 H1 WAT 9433 79.168 112.987 121.021 1.00 0.00 H ATOM 27411 H2 WAT 9433 79.463 112.422 119.648 1.00 0.00 H TER 27413 WAT 9433 ATOM 27413 O WAT 9434 70.714 42.678 96.065 1.00 0.00 O ATOM 27414 H1 WAT 9434 69.969 42.713 96.665 1.00 0.00 H ATOM 27415 H2 WAT 9434 71.283 43.394 96.347 1.00 0.00 H TER 27417 WAT 9434 ATOM 27417 O WAT 9435 7.630 56.432 127.072 1.00 0.00 O ATOM 27418 H1 WAT 9435 6.749 56.090 126.918 1.00 0.00 H ATOM 27419 H2 WAT 9435 7.847 56.144 127.959 1.00 0.00 H TER 27421 WAT 9435 ATOM 27421 O WAT 9436 44.627 76.354 133.393 1.00 0.00 O ATOM 27422 H1 WAT 9436 43.894 75.738 133.396 1.00 0.00 H ATOM 27423 H2 WAT 9436 45.367 75.843 133.064 1.00 0.00 H TER 27425 WAT 9436 ATOM 27425 O WAT 9437 103.304 78.370 83.486 1.00 0.00 O ATOM 27426 H1 WAT 9437 103.871 79.135 83.583 1.00 0.00 H ATOM 27427 H2 WAT 9437 103.123 78.090 84.384 1.00 0.00 H TER 27429 WAT 9437 ATOM 27429 O WAT 9438 110.232 119.579 18.024 1.00 0.00 O ATOM 27430 H1 WAT 9438 109.881 119.319 18.876 1.00 0.00 H ATOM 27431 H2 WAT 9438 110.607 118.775 17.664 1.00 0.00 H TER 27433 WAT 9438 ATOM 27433 O WAT 9439 131.089 118.073 83.308 1.00 0.00 O ATOM 27434 H1 WAT 9439 131.796 117.468 83.533 1.00 0.00 H ATOM 27435 H2 WAT 9439 130.604 117.628 82.614 1.00 0.00 H TER 27437 WAT 9439 ATOM 27437 O WAT 9440 67.157 51.152 124.767 1.00 0.00 O ATOM 27438 H1 WAT 9440 67.234 50.337 125.263 1.00 0.00 H ATOM 27439 H2 WAT 9440 67.370 50.906 123.867 1.00 0.00 H TER 27441 WAT 9440 ATOM 27441 O WAT 9441 35.932 58.104 3.767 1.00 0.00 O ATOM 27442 H1 WAT 9441 36.465 58.888 3.897 1.00 0.00 H ATOM 27443 H2 WAT 9441 35.702 57.821 4.651 1.00 0.00 H TER 27445 WAT 9441 ATOM 27445 O WAT 9442 63.258 61.667 92.562 1.00 0.00 O ATOM 27446 H1 WAT 9442 63.381 62.311 93.260 1.00 0.00 H ATOM 27447 H2 WAT 9442 62.312 61.647 92.419 1.00 0.00 H TER 27449 WAT 9442 ATOM 27449 O WAT 9443 16.903 69.602 96.277 1.00 0.00 O ATOM 27450 H1 WAT 9443 17.608 69.705 96.916 1.00 0.00 H ATOM 27451 H2 WAT 9443 16.162 69.277 96.789 1.00 0.00 H TER 27453 WAT 9443 ATOM 27453 O WAT 9444 34.439 11.939 151.447 1.00 0.00 O ATOM 27454 H1 WAT 9444 34.191 11.916 152.371 1.00 0.00 H ATOM 27455 H2 WAT 9444 33.631 12.167 150.988 1.00 0.00 H TER 27457 WAT 9444 ATOM 27457 O WAT 9445 104.876 104.164 73.526 1.00 0.00 O ATOM 27458 H1 WAT 9445 104.057 103.780 73.214 1.00 0.00 H ATOM 27459 H2 WAT 9445 104.602 104.874 74.106 1.00 0.00 H TER 27461 WAT 9445 ATOM 27461 O WAT 9446 118.650 68.119 101.217 1.00 0.00 O ATOM 27462 H1 WAT 9446 118.310 67.232 101.334 1.00 0.00 H ATOM 27463 H2 WAT 9446 118.957 68.374 102.088 1.00 0.00 H TER 27465 WAT 9446 ATOM 27465 O WAT 9447 49.255 142.631 70.332 1.00 0.00 O ATOM 27466 H1 WAT 9447 49.446 142.454 71.253 1.00 0.00 H ATOM 27467 H2 WAT 9447 48.558 142.015 70.109 1.00 0.00 H TER 27469 WAT 9447 ATOM 27469 O WAT 9448 88.862 133.189 6.305 1.00 0.00 O ATOM 27470 H1 WAT 9448 88.381 133.311 7.124 1.00 0.00 H ATOM 27471 H2 WAT 9448 89.782 133.179 6.568 1.00 0.00 H TER 27473 WAT 9448 ATOM 27473 O WAT 9449 32.255 108.681 70.807 1.00 0.00 O ATOM 27474 H1 WAT 9449 32.089 109.623 70.839 1.00 0.00 H ATOM 27475 H2 WAT 9449 32.595 108.468 71.676 1.00 0.00 H TER 27477 WAT 9449 ATOM 27477 O WAT 9450 61.080 81.534 145.786 1.00 0.00 O ATOM 27478 H1 WAT 9450 62.009 81.421 145.588 1.00 0.00 H ATOM 27479 H2 WAT 9450 60.947 82.482 145.779 1.00 0.00 H TER 27481 WAT 9450 ATOM 27481 O WAT 9451 35.064 76.311 61.049 1.00 0.00 O ATOM 27482 H1 WAT 9451 34.614 77.041 61.475 1.00 0.00 H ATOM 27483 H2 WAT 9451 35.631 76.726 60.399 1.00 0.00 H TER 27485 WAT 9451 ATOM 27485 O WAT 9452 83.866 62.056 102.997 1.00 0.00 O ATOM 27486 H1 WAT 9452 84.330 62.473 102.271 1.00 0.00 H ATOM 27487 H2 WAT 9452 83.037 61.765 102.617 1.00 0.00 H TER 27489 WAT 9452 ATOM 27489 O WAT 9453 6.117 95.509 110.762 1.00 0.00 O ATOM 27490 H1 WAT 9453 5.622 94.828 110.306 1.00 0.00 H ATOM 27491 H2 WAT 9453 6.019 96.286 110.212 1.00 0.00 H TER 27493 WAT 9453 ATOM 27493 O WAT 9454 45.145 23.297 122.131 1.00 0.00 O ATOM 27494 H1 WAT 9454 45.307 24.219 122.334 1.00 0.00 H ATOM 27495 H2 WAT 9454 44.286 23.115 122.513 1.00 0.00 H TER 27497 WAT 9454 ATOM 27497 O WAT 9455 4.371 32.768 127.346 1.00 0.00 O ATOM 27498 H1 WAT 9455 3.701 32.321 126.829 1.00 0.00 H ATOM 27499 H2 WAT 9455 5.083 32.930 126.727 1.00 0.00 H TER 27501 WAT 9455 ATOM 27501 O WAT 9456 37.223 71.252 76.255 1.00 0.00 O ATOM 27502 H1 WAT 9456 37.716 71.473 77.046 1.00 0.00 H ATOM 27503 H2 WAT 9456 36.311 71.426 76.486 1.00 0.00 H TER 27505 WAT 9456 ATOM 27505 O WAT 9457 10.837 88.341 75.050 1.00 0.00 O ATOM 27506 H1 WAT 9457 10.886 88.003 75.945 1.00 0.00 H ATOM 27507 H2 WAT 9457 9.951 88.125 74.760 1.00 0.00 H TER 27509 WAT 9457 ATOM 27509 O WAT 9458 105.233 20.951 14.602 1.00 0.00 O ATOM 27510 H1 WAT 9458 106.127 21.044 14.930 1.00 0.00 H ATOM 27511 H2 WAT 9458 105.161 21.610 13.912 1.00 0.00 H TER 27513 WAT 9458 ATOM 27513 O WAT 9459 130.843 64.650 79.554 1.00 0.00 O ATOM 27514 H1 WAT 9459 131.062 65.261 78.851 1.00 0.00 H ATOM 27515 H2 WAT 9459 129.987 64.943 79.868 1.00 0.00 H TER 27517 WAT 9459 ATOM 27517 O WAT 9460 48.186 50.160 119.038 1.00 0.00 O ATOM 27518 H1 WAT 9460 48.061 50.040 118.097 1.00 0.00 H ATOM 27519 H2 WAT 9460 48.129 51.107 119.169 1.00 0.00 H TER 27521 WAT 9460 ATOM 27521 O WAT 9461 69.208 98.867 12.854 1.00 0.00 O ATOM 27522 H1 WAT 9461 68.830 98.268 12.210 1.00 0.00 H ATOM 27523 H2 WAT 9461 68.895 99.732 12.590 1.00 0.00 H TER 27525 WAT 9461 ATOM 27525 O WAT 9462 123.732 96.470 7.091 1.00 0.00 O ATOM 27526 H1 WAT 9462 123.598 97.403 6.929 1.00 0.00 H ATOM 27527 H2 WAT 9462 124.668 96.391 7.275 1.00 0.00 H TER 27529 WAT 9462 ATOM 27529 O WAT 9463 73.321 117.922 130.234 1.00 0.00 O ATOM 27530 H1 WAT 9463 72.394 118.088 130.061 1.00 0.00 H ATOM 27531 H2 WAT 9463 73.554 118.552 130.915 1.00 0.00 H TER 27533 WAT 9463 ATOM 27533 O WAT 9464 89.310 82.479 9.957 1.00 0.00 O ATOM 27534 H1 WAT 9464 90.088 82.986 9.727 1.00 0.00 H ATOM 27535 H2 WAT 9464 89.622 81.577 10.026 1.00 0.00 H TER 27537 WAT 9464 ATOM 27537 O WAT 9465 97.072 112.018 92.807 1.00 0.00 O ATOM 27538 H1 WAT 9465 97.365 112.752 93.347 1.00 0.00 H ATOM 27539 H2 WAT 9465 97.837 111.789 92.279 1.00 0.00 H TER 27541 WAT 9465 ATOM 27541 O WAT 9466 126.842 138.461 101.856 1.00 0.00 O ATOM 27542 H1 WAT 9466 126.349 137.824 101.339 1.00 0.00 H ATOM 27543 H2 WAT 9466 126.886 138.077 102.732 1.00 0.00 H TER 27545 WAT 9466 ATOM 27545 O WAT 9467 12.713 33.253 9.690 1.00 0.00 O ATOM 27546 H1 WAT 9467 12.714 32.491 9.110 1.00 0.00 H ATOM 27547 H2 WAT 9467 13.051 32.921 10.522 1.00 0.00 H TER 27549 WAT 9467 ATOM 27549 O WAT 9468 106.542 97.609 128.600 1.00 0.00 O ATOM 27550 H1 WAT 9468 106.850 98.464 128.904 1.00 0.00 H ATOM 27551 H2 WAT 9468 107.293 97.233 128.143 1.00 0.00 H TER 27553 WAT 9468 ATOM 27553 O WAT 9469 82.985 25.873 117.043 1.00 0.00 O ATOM 27554 H1 WAT 9469 83.178 25.138 117.625 1.00 0.00 H ATOM 27555 H2 WAT 9469 83.663 25.829 116.369 1.00 0.00 H TER 27557 WAT 9469 ATOM 27557 O WAT 9470 85.630 97.960 94.176 1.00 0.00 O ATOM 27558 H1 WAT 9470 85.972 97.952 95.070 1.00 0.00 H ATOM 27559 H2 WAT 9470 84.684 97.854 94.281 1.00 0.00 H TER 27561 WAT 9470 ATOM 27561 O WAT 9471 75.596 141.781 63.919 1.00 0.00 O ATOM 27562 H1 WAT 9471 75.962 142.302 64.634 1.00 0.00 H ATOM 27563 H2 WAT 9471 74.959 142.360 63.502 1.00 0.00 H TER 27565 WAT 9471 ATOM 27565 O WAT 9472 128.328 101.310 121.326 1.00 0.00 O ATOM 27566 H1 WAT 9472 129.031 101.755 120.853 1.00 0.00 H ATOM 27567 H2 WAT 9472 127.950 100.710 120.683 1.00 0.00 H TER 27569 WAT 9472 ATOM 27569 O WAT 9473 39.871 62.961 107.619 1.00 0.00 O ATOM 27570 H1 WAT 9473 39.247 63.563 108.024 1.00 0.00 H ATOM 27571 H2 WAT 9473 40.721 63.387 107.729 1.00 0.00 H TER 27573 WAT 9473 ATOM 27573 O WAT 9474 71.309 135.305 125.251 1.00 0.00 O ATOM 27574 H1 WAT 9474 71.433 134.452 125.667 1.00 0.00 H ATOM 27575 H2 WAT 9474 72.165 135.518 124.881 1.00 0.00 H TER 27577 WAT 9474 ATOM 27577 O WAT 9475 130.688 142.239 54.045 1.00 0.00 O ATOM 27578 H1 WAT 9475 129.946 141.965 53.507 1.00 0.00 H ATOM 27579 H2 WAT 9475 131.144 141.424 54.257 1.00 0.00 H TER 27581 WAT 9475 ATOM 27581 O WAT 9476 115.228 38.601 17.412 1.00 0.00 O ATOM 27582 H1 WAT 9476 114.474 39.166 17.582 1.00 0.00 H ATOM 27583 H2 WAT 9476 115.065 38.240 16.540 1.00 0.00 H TER 27585 WAT 9476 ATOM 27585 O WAT 9477 55.553 94.752 12.761 1.00 0.00 O ATOM 27586 H1 WAT 9477 56.261 94.112 12.680 1.00 0.00 H ATOM 27587 H2 WAT 9477 54.763 94.222 12.867 1.00 0.00 H TER 27589 WAT 9477 ATOM 27589 O WAT 9478 90.361 38.093 86.263 1.00 0.00 O ATOM 27590 H1 WAT 9478 91.024 37.719 85.684 1.00 0.00 H ATOM 27591 H2 WAT 9478 90.823 38.778 86.746 1.00 0.00 H TER 27593 WAT 9478 ATOM 27593 O WAT 9479 31.745 51.383 120.071 1.00 0.00 O ATOM 27594 H1 WAT 9479 32.042 50.481 120.195 1.00 0.00 H ATOM 27595 H2 WAT 9479 32.361 51.752 119.438 1.00 0.00 H TER 27597 WAT 9479 ATOM 27597 O WAT 9480 70.955 8.961 128.057 1.00 0.00 O ATOM 27598 H1 WAT 9480 71.022 9.351 128.929 1.00 0.00 H ATOM 27599 H2 WAT 9480 71.688 8.347 128.013 1.00 0.00 H TER 27601 WAT 9480 ATOM 27601 O WAT 9481 40.269 38.018 119.759 1.00 0.00 O ATOM 27602 H1 WAT 9481 40.635 37.516 119.031 1.00 0.00 H ATOM 27603 H2 WAT 9481 39.841 37.364 120.310 1.00 0.00 H TER 27605 WAT 9481 ATOM 27605 O WAT 9482 69.678 63.615 110.178 1.00 0.00 O ATOM 27606 H1 WAT 9482 69.826 63.170 111.012 1.00 0.00 H ATOM 27607 H2 WAT 9482 69.555 64.534 110.415 1.00 0.00 H TER 27609 WAT 9482 ATOM 27609 O WAT 9483 23.751 127.257 136.769 1.00 0.00 O ATOM 27610 H1 WAT 9483 24.608 127.286 137.195 1.00 0.00 H ATOM 27611 H2 WAT 9483 23.125 127.224 137.493 1.00 0.00 H TER 27613 WAT 9483 ATOM 27613 O WAT 9484 73.309 108.088 131.110 1.00 0.00 O ATOM 27614 H1 WAT 9484 72.897 108.886 130.779 1.00 0.00 H ATOM 27615 H2 WAT 9484 74.190 108.362 131.366 1.00 0.00 H TER 27617 WAT 9484 ATOM 27617 O WAT 9485 106.020 62.463 18.646 1.00 0.00 O ATOM 27618 H1 WAT 9485 106.175 62.929 19.468 1.00 0.00 H ATOM 27619 H2 WAT 9485 105.975 61.541 18.899 1.00 0.00 H TER 27621 WAT 9485 ATOM 27621 O WAT 9486 135.568 66.367 73.320 1.00 0.00 O ATOM 27622 H1 WAT 9486 135.768 66.406 74.255 1.00 0.00 H ATOM 27623 H2 WAT 9486 135.669 65.443 73.091 1.00 0.00 H TER 27625 WAT 9486 ATOM 27625 O WAT 9487 83.199 88.068 100.605 1.00 0.00 O ATOM 27626 H1 WAT 9487 83.216 88.959 100.954 1.00 0.00 H ATOM 27627 H2 WAT 9487 83.803 88.090 99.863 1.00 0.00 H TER 27629 WAT 9487 ATOM 27629 O WAT 9488 56.576 10.133 49.178 1.00 0.00 O ATOM 27630 H1 WAT 9488 55.715 10.013 48.778 1.00 0.00 H ATOM 27631 H2 WAT 9488 56.713 11.080 49.173 1.00 0.00 H TER 27633 WAT 9488 ATOM 27633 O WAT 9489 86.487 89.976 79.019 1.00 0.00 O ATOM 27634 H1 WAT 9489 85.728 90.518 78.803 1.00 0.00 H ATOM 27635 H2 WAT 9489 87.232 90.446 78.644 1.00 0.00 H TER 27637 WAT 9489 ATOM 27637 O WAT 9490 10.232 77.679 147.352 1.00 0.00 O ATOM 27638 H1 WAT 9490 10.227 78.082 148.220 1.00 0.00 H ATOM 27639 H2 WAT 9490 11.137 77.397 147.223 1.00 0.00 H TER 27641 WAT 9490 ATOM 27641 O WAT 9491 112.185 43.849 142.996 1.00 0.00 O ATOM 27642 H1 WAT 9491 112.134 44.750 143.315 1.00 0.00 H ATOM 27643 H2 WAT 9491 112.309 43.937 142.051 1.00 0.00 H TER 27645 WAT 9491 ATOM 27645 O WAT 9492 135.433 59.808 67.567 1.00 0.00 O ATOM 27646 H1 WAT 9492 136.248 59.367 67.328 1.00 0.00 H ATOM 27647 H2 WAT 9492 135.691 60.714 67.736 1.00 0.00 H TER 27649 WAT 9492 ATOM 27649 O WAT 9493 38.792 124.687 121.681 1.00 0.00 O ATOM 27650 H1 WAT 9493 38.599 124.912 120.771 1.00 0.00 H ATOM 27651 H2 WAT 9493 38.948 125.530 122.107 1.00 0.00 H TER 27653 WAT 9493 ATOM 27653 O WAT 9494 43.674 9.173 62.611 1.00 0.00 O ATOM 27654 H1 WAT 9494 44.505 9.294 62.152 1.00 0.00 H ATOM 27655 H2 WAT 9494 43.603 8.226 62.733 1.00 0.00 H TER 27657 WAT 9494 ATOM 27657 O WAT 9495 125.552 77.316 20.111 1.00 0.00 O ATOM 27658 H1 WAT 9495 124.940 77.015 19.440 1.00 0.00 H ATOM 27659 H2 WAT 9495 125.358 76.772 20.874 1.00 0.00 H TER 27661 WAT 9495 ATOM 27661 O WAT 9496 125.849 40.372 1.275 1.00 0.00 O ATOM 27662 H1 WAT 9496 126.708 39.991 1.094 1.00 0.00 H ATOM 27663 H2 WAT 9496 125.671 40.140 2.186 1.00 0.00 H TER 27665 WAT 9496 ATOM 27665 O WAT 9497 143.866 139.665 93.055 1.00 0.00 O ATOM 27666 H1 WAT 9497 144.542 140.296 93.304 1.00 0.00 H ATOM 27667 H2 WAT 9497 144.214 139.239 92.272 1.00 0.00 H TER 27669 WAT 9497 ATOM 27669 O WAT 9498 45.196 122.237 14.937 1.00 0.00 O ATOM 27670 H1 WAT 9498 45.880 121.816 14.416 1.00 0.00 H ATOM 27671 H2 WAT 9498 44.768 122.839 14.329 1.00 0.00 H TER 27673 WAT 9498 ATOM 27673 O WAT 9499 135.216 102.006 113.411 1.00 0.00 O ATOM 27674 H1 WAT 9499 136.094 102.223 113.098 1.00 0.00 H ATOM 27675 H2 WAT 9499 135.169 102.395 114.284 1.00 0.00 H TER 27677 WAT 9499 ATOM 27677 O WAT 9500 142.473 0.136 125.716 1.00 0.00 O ATOM 27678 H1 WAT 9500 143.337 0.089 125.306 1.00 0.00 H ATOM 27679 H2 WAT 9500 142.621 0.619 126.530 1.00 0.00 H TER 27681 WAT 9500 ATOM 27681 O WAT 9501 136.482 12.290 14.587 1.00 0.00 O ATOM 27682 H1 WAT 9501 135.688 12.742 14.871 1.00 0.00 H ATOM 27683 H2 WAT 9501 136.750 11.773 15.347 1.00 0.00 H TER 27685 WAT 9501 ATOM 27685 O WAT 9502 92.929 15.039 150.727 1.00 0.00 O ATOM 27686 H1 WAT 9502 92.345 15.425 151.381 1.00 0.00 H ATOM 27687 H2 WAT 9502 93.063 15.737 150.085 1.00 0.00 H TER 27689 WAT 9502 ATOM 27689 O WAT 9503 21.785 22.426 74.438 1.00 0.00 O ATOM 27690 H1 WAT 9503 22.326 22.431 75.228 1.00 0.00 H ATOM 27691 H2 WAT 9503 21.705 21.500 74.209 1.00 0.00 H TER 27693 WAT 9503 ATOM 27693 O WAT 9504 128.727 46.164 91.941 1.00 0.00 O ATOM 27694 H1 WAT 9504 129.310 46.395 92.665 1.00 0.00 H ATOM 27695 H2 WAT 9504 127.847 46.235 92.311 1.00 0.00 H TER 27697 WAT 9504 ATOM 27697 O WAT 9505 2.024 9.246 70.410 1.00 0.00 O ATOM 27698 H1 WAT 9505 2.039 10.196 70.528 1.00 0.00 H ATOM 27699 H2 WAT 9505 2.613 9.087 69.673 1.00 0.00 H TER 27701 WAT 9505 ATOM 27701 O WAT 9506 99.616 125.494 112.793 1.00 0.00 O ATOM 27702 H1 WAT 9506 99.387 125.693 111.886 1.00 0.00 H ATOM 27703 H2 WAT 9506 100.548 125.701 112.857 1.00 0.00 H TER 27705 WAT 9506 ATOM 27705 O WAT 9507 127.845 134.684 17.149 1.00 0.00 O ATOM 27706 H1 WAT 9507 127.815 133.921 17.726 1.00 0.00 H ATOM 27707 H2 WAT 9507 127.560 135.413 17.700 1.00 0.00 H TER 27709 WAT 9507 ATOM 27709 O WAT 9508 28.522 99.327 147.216 1.00 0.00 O ATOM 27710 H1 WAT 9508 28.490 98.739 146.461 1.00 0.00 H ATOM 27711 H2 WAT 9508 29.363 99.777 147.134 1.00 0.00 H TER 27713 WAT 9508 ATOM 27713 O WAT 9509 145.946 40.102 82.201 1.00 0.00 O ATOM 27714 H1 WAT 9509 145.074 39.708 82.228 1.00 0.00 H ATOM 27715 H2 WAT 9509 145.789 41.014 81.956 1.00 0.00 H TER 27717 WAT 9509 ATOM 27717 O WAT 9510 26.565 9.622 100.609 1.00 0.00 O ATOM 27718 H1 WAT 9510 26.211 10.297 101.188 1.00 0.00 H ATOM 27719 H2 WAT 9510 26.363 9.933 99.727 1.00 0.00 H TER 27721 WAT 9510 ATOM 27721 O WAT 9511 71.559 30.740 81.457 1.00 0.00 O ATOM 27722 H1 WAT 9511 71.829 31.304 82.182 1.00 0.00 H ATOM 27723 H2 WAT 9511 71.001 31.298 80.915 1.00 0.00 H TER 27725 WAT 9511 ATOM 27725 O WAT 9512 142.269 132.150 26.259 1.00 0.00 O ATOM 27726 H1 WAT 9512 142.104 131.341 25.775 1.00 0.00 H ATOM 27727 H2 WAT 9512 143.223 132.222 26.287 1.00 0.00 H TER 27729 WAT 9512 ATOM 27729 O WAT 9513 131.461 113.978 88.942 1.00 0.00 O ATOM 27730 H1 WAT 9513 130.633 113.507 88.851 1.00 0.00 H ATOM 27731 H2 WAT 9513 131.503 114.213 89.869 1.00 0.00 H TER 27733 WAT 9513 ATOM 27733 O WAT 9514 93.700 27.485 128.676 1.00 0.00 O ATOM 27734 H1 WAT 9514 94.029 28.125 128.044 1.00 0.00 H ATOM 27735 H2 WAT 9514 93.595 27.982 129.487 1.00 0.00 H TER 27737 WAT 9514 ATOM 27737 O WAT 9515 46.891 106.690 64.771 1.00 0.00 O ATOM 27738 H1 WAT 9515 46.563 107.547 65.040 1.00 0.00 H ATOM 27739 H2 WAT 9515 47.712 106.879 64.316 1.00 0.00 H TER 27741 WAT 9515 ATOM 27741 O WAT 9516 17.602 80.199 58.893 1.00 0.00 O ATOM 27742 H1 WAT 9516 16.834 80.154 59.462 1.00 0.00 H ATOM 27743 H2 WAT 9516 17.404 79.596 58.176 1.00 0.00 H TER 27745 WAT 9516 ATOM 27745 O WAT 9517 26.115 112.719 96.248 1.00 0.00 O ATOM 27746 H1 WAT 9517 26.734 111.989 96.259 1.00 0.00 H ATOM 27747 H2 WAT 9517 26.593 113.445 96.647 1.00 0.00 H TER 27749 WAT 9517 ATOM 27749 O WAT 9518 95.201 143.828 119.025 1.00 0.00 O ATOM 27750 H1 WAT 9518 95.135 144.783 119.021 1.00 0.00 H ATOM 27751 H2 WAT 9518 94.672 143.554 119.774 1.00 0.00 H TER 27753 WAT 9518 ATOM 27753 O WAT 9519 123.555 68.082 112.825 1.00 0.00 O ATOM 27754 H1 WAT 9519 123.633 67.206 112.449 1.00 0.00 H ATOM 27755 H2 WAT 9519 124.421 68.263 113.193 1.00 0.00 H TER 27757 WAT 9519 ATOM 27757 O WAT 9520 111.102 108.705 133.286 1.00 0.00 O ATOM 27758 H1 WAT 9520 111.753 108.958 132.631 1.00 0.00 H ATOM 27759 H2 WAT 9520 111.061 109.452 133.883 1.00 0.00 H TER 27761 WAT 9520 ATOM 27761 O WAT 9521 134.648 97.927 136.072 1.00 0.00 O ATOM 27762 H1 WAT 9521 134.160 97.106 135.997 1.00 0.00 H ATOM 27763 H2 WAT 9521 135.014 97.908 136.956 1.00 0.00 H TER 27765 WAT 9521 ATOM 27765 O WAT 9522 50.821 55.750 149.374 1.00 0.00 O ATOM 27766 H1 WAT 9522 50.608 55.611 150.297 1.00 0.00 H ATOM 27767 H2 WAT 9522 51.770 55.877 149.363 1.00 0.00 H TER 27769 WAT 9522 ATOM 27769 O WAT 9523 84.152 21.827 87.597 1.00 0.00 O ATOM 27770 H1 WAT 9523 83.415 21.811 88.208 1.00 0.00 H ATOM 27771 H2 WAT 9523 84.573 22.672 87.752 1.00 0.00 H TER 27773 WAT 9523 ATOM 27773 O WAT 9524 46.070 52.455 157.268 1.00 0.00 O ATOM 27774 H1 WAT 9524 45.410 52.697 157.918 1.00 0.00 H ATOM 27775 H2 WAT 9524 45.701 51.691 156.825 1.00 0.00 H TER 27777 WAT 9524 ATOM 27777 O WAT 9525 38.656 104.188 155.832 1.00 0.00 O ATOM 27778 H1 WAT 9525 38.151 104.957 155.568 1.00 0.00 H ATOM 27779 H2 WAT 9525 39.317 104.088 155.147 1.00 0.00 H TER 27781 WAT 9525 ATOM 27781 O WAT 9526 30.951 130.677 22.788 1.00 0.00 O ATOM 27782 H1 WAT 9526 30.126 130.431 23.207 1.00 0.00 H ATOM 27783 H2 WAT 9526 30.943 131.634 22.785 1.00 0.00 H TER 27785 WAT 9526 ATOM 27785 O WAT 9527 74.976 42.705 96.278 1.00 0.00 O ATOM 27786 H1 WAT 9527 74.836 43.507 95.776 1.00 0.00 H ATOM 27787 H2 WAT 9527 75.136 42.033 95.616 1.00 0.00 H TER 27789 WAT 9527 ATOM 27789 O WAT 9528 79.580 97.501 1.485 1.00 0.00 O ATOM 27790 H1 WAT 9528 79.636 97.753 2.407 1.00 0.00 H ATOM 27791 H2 WAT 9528 78.719 97.091 1.401 1.00 0.00 H TER 27793 WAT 9528 ATOM 27793 O WAT 9529 122.083 39.743 17.511 1.00 0.00 O ATOM 27794 H1 WAT 9529 122.679 39.466 18.207 1.00 0.00 H ATOM 27795 H2 WAT 9529 121.396 39.077 17.505 1.00 0.00 H TER 27797 WAT 9529 ATOM 27797 O WAT 9530 62.342 45.289 10.317 1.00 0.00 O ATOM 27798 H1 WAT 9530 61.754 45.968 9.986 1.00 0.00 H ATOM 27799 H2 WAT 9530 61.759 44.622 10.678 1.00 0.00 H TER 27801 WAT 9530 ATOM 27801 O WAT 9531 17.872 3.853 68.616 1.00 0.00 O ATOM 27802 H1 WAT 9531 17.570 3.297 67.898 1.00 0.00 H ATOM 27803 H2 WAT 9531 17.315 3.610 69.356 1.00 0.00 H TER 27805 WAT 9531 ATOM 27805 O WAT 9532 130.925 20.400 129.481 1.00 0.00 O ATOM 27806 H1 WAT 9532 129.989 20.284 129.315 1.00 0.00 H ATOM 27807 H2 WAT 9532 131.043 20.124 130.390 1.00 0.00 H TER 27809 WAT 9532 ATOM 27809 O WAT 9533 136.797 79.887 133.009 1.00 0.00 O ATOM 27810 H1 WAT 9533 137.590 80.175 133.461 1.00 0.00 H ATOM 27811 H2 WAT 9533 137.094 79.189 132.425 1.00 0.00 H TER 27813 WAT 9533 ATOM 27813 O WAT 9534 61.009 38.579 80.342 1.00 0.00 O ATOM 27814 H1 WAT 9534 61.376 37.973 80.985 1.00 0.00 H ATOM 27815 H2 WAT 9534 60.452 39.164 80.856 1.00 0.00 H TER 27817 WAT 9534 ATOM 27817 O WAT 9535 10.009 10.376 5.639 1.00 0.00 O ATOM 27818 H1 WAT 9535 10.871 10.645 5.957 1.00 0.00 H ATOM 27819 H2 WAT 9535 10.175 10.026 4.764 1.00 0.00 H TER 27821 WAT 9535 ATOM 27821 O WAT 9536 94.098 24.502 62.937 1.00 0.00 O ATOM 27822 H1 WAT 9536 94.018 23.761 63.537 1.00 0.00 H ATOM 27823 H2 WAT 9536 94.287 24.103 62.087 1.00 0.00 H TER 27825 WAT 9536 ATOM 27825 O WAT 9537 92.816 113.073 108.111 1.00 0.00 O ATOM 27826 H1 WAT 9537 93.559 112.481 108.228 1.00 0.00 H ATOM 27827 H2 WAT 9537 92.355 113.049 108.950 1.00 0.00 H TER 27829 WAT 9537 ATOM 27829 O WAT 9538 14.305 63.922 114.496 1.00 0.00 O ATOM 27830 H1 WAT 9538 14.740 64.284 115.267 1.00 0.00 H ATOM 27831 H2 WAT 9538 13.620 63.356 114.851 1.00 0.00 H TER 27833 WAT 9538 ATOM 27833 O WAT 9539 74.411 100.759 112.119 1.00 0.00 O ATOM 27834 H1 WAT 9539 74.406 100.391 113.002 1.00 0.00 H ATOM 27835 H2 WAT 9539 73.534 100.583 111.781 1.00 0.00 H TER 27837 WAT 9539 ATOM 27837 O WAT 9540 114.122 5.336 157.480 1.00 0.00 O ATOM 27838 H1 WAT 9540 114.724 4.592 157.496 1.00 0.00 H ATOM 27839 H2 WAT 9540 113.481 5.140 158.163 1.00 0.00 H TER 27841 WAT 9540 ATOM 27841 O WAT 9541 22.148 76.322 6.092 1.00 0.00 O ATOM 27842 H1 WAT 9541 22.033 75.384 5.945 1.00 0.00 H ATOM 27843 H2 WAT 9541 21.534 76.532 6.796 1.00 0.00 H TER 27845 WAT 9541 ATOM 27845 O WAT 9542 41.565 87.717 101.161 1.00 0.00 O ATOM 27846 H1 WAT 9542 41.765 86.995 101.756 1.00 0.00 H ATOM 27847 H2 WAT 9542 41.183 88.392 101.722 1.00 0.00 H TER 27849 WAT 9542 ATOM 27849 O WAT 9543 21.161 91.159 99.721 1.00 0.00 O ATOM 27850 H1 WAT 9543 21.085 92.023 100.126 1.00 0.00 H ATOM 27851 H2 WAT 9543 21.142 91.332 98.780 1.00 0.00 H TER 27853 WAT 9543 ATOM 27853 O WAT 9544 50.149 18.478 62.274 1.00 0.00 O ATOM 27854 H1 WAT 9544 50.390 19.294 61.836 1.00 0.00 H ATOM 27855 H2 WAT 9544 49.442 18.118 61.739 1.00 0.00 H TER 27857 WAT 9544 ATOM 27857 O WAT 9545 68.895 104.603 11.806 1.00 0.00 O ATOM 27858 H1 WAT 9545 69.788 104.489 11.480 1.00 0.00 H ATOM 27859 H2 WAT 9545 68.458 105.120 11.129 1.00 0.00 H TER 27861 WAT 9545 ATOM 27861 O WAT 9546 116.533 135.188 133.451 1.00 0.00 O ATOM 27862 H1 WAT 9546 116.867 134.291 133.456 1.00 0.00 H ATOM 27863 H2 WAT 9546 117.274 135.718 133.156 1.00 0.00 H TER 27865 WAT 9546 ATOM 27865 O WAT 9547 14.172 136.056 150.922 1.00 0.00 O ATOM 27866 H1 WAT 9547 13.909 136.095 151.842 1.00 0.00 H ATOM 27867 H2 WAT 9547 13.587 135.405 150.534 1.00 0.00 H TER 27869 WAT 9547 ATOM 27869 O WAT 9548 76.262 109.785 121.911 1.00 0.00 O ATOM 27870 H1 WAT 9548 76.455 110.504 121.310 1.00 0.00 H ATOM 27871 H2 WAT 9548 76.188 109.015 121.348 1.00 0.00 H TER 27873 WAT 9548 ATOM 27873 O WAT 9549 103.661 2.242 120.382 1.00 0.00 O ATOM 27874 H1 WAT 9549 103.331 2.636 119.575 1.00 0.00 H ATOM 27875 H2 WAT 9549 103.734 1.309 120.181 1.00 0.00 H TER 27877 WAT 9549 ATOM 27877 O WAT 9550 83.434 100.890 119.687 1.00 0.00 O ATOM 27878 H1 WAT 9550 83.796 100.049 119.409 1.00 0.00 H ATOM 27879 H2 WAT 9550 82.565 100.676 120.027 1.00 0.00 H TER 27881 WAT 9550 ATOM 27881 O WAT 9551 109.938 59.894 155.051 1.00 0.00 O ATOM 27882 H1 WAT 9551 109.760 58.956 155.120 1.00 0.00 H ATOM 27883 H2 WAT 9551 110.513 59.973 154.289 1.00 0.00 H TER 27885 WAT 9551 ATOM 27885 O WAT 9552 65.424 102.847 139.418 1.00 0.00 O ATOM 27886 H1 WAT 9552 65.333 103.167 138.521 1.00 0.00 H ATOM 27887 H2 WAT 9552 65.429 103.639 139.956 1.00 0.00 H TER 27889 WAT 9552 ATOM 27889 O WAT 9553 134.464 6.958 101.375 1.00 0.00 O ATOM 27890 H1 WAT 9553 134.114 7.744 101.793 1.00 0.00 H ATOM 27891 H2 WAT 9553 133.901 6.250 101.687 1.00 0.00 H TER 27893 WAT 9553 ATOM 27893 O WAT 9554 55.978 29.787 108.564 1.00 0.00 O ATOM 27894 H1 WAT 9554 55.913 30.583 109.091 1.00 0.00 H ATOM 27895 H2 WAT 9554 55.804 30.077 107.669 1.00 0.00 H TER 27897 WAT 9554 ATOM 27897 O WAT 9555 51.140 88.526 80.032 1.00 0.00 O ATOM 27898 H1 WAT 9555 51.020 89.374 79.604 1.00 0.00 H ATOM 27899 H2 WAT 9555 52.032 88.266 79.802 1.00 0.00 H TER 27901 WAT 9555 ATOM 27901 O WAT 9556 144.200 140.564 82.226 1.00 0.00 O ATOM 27902 H1 WAT 9556 145.075 140.223 82.410 1.00 0.00 H ATOM 27903 H2 WAT 9556 143.680 139.789 82.014 1.00 0.00 H TER 27905 WAT 9556 ATOM 27905 O WAT 9557 59.110 123.147 145.628 1.00 0.00 O ATOM 27906 H1 WAT 9557 58.263 123.571 145.768 1.00 0.00 H ATOM 27907 H2 WAT 9557 59.674 123.843 145.290 1.00 0.00 H TER 27909 WAT 9557 ATOM 27909 O WAT 9558 42.363 47.401 11.133 1.00 0.00 O ATOM 27910 H1 WAT 9558 43.263 47.637 10.907 1.00 0.00 H ATOM 27911 H2 WAT 9558 42.447 46.865 11.922 1.00 0.00 H TER 27913 WAT 9558 ATOM 27913 O WAT 9559 32.793 36.910 151.571 1.00 0.00 O ATOM 27914 H1 WAT 9559 31.929 37.277 151.759 1.00 0.00 H ATOM 27915 H2 WAT 9559 33.296 37.060 152.372 1.00 0.00 H TER 27917 WAT 9559 ATOM 27917 O WAT 9560 64.245 6.449 53.724 1.00 0.00 O ATOM 27918 H1 WAT 9560 64.599 5.690 53.262 1.00 0.00 H ATOM 27919 H2 WAT 9560 64.615 6.387 54.605 1.00 0.00 H TER 27921 WAT 9560 ATOM 27921 O WAT 9561 63.166 28.982 103.102 1.00 0.00 O ATOM 27922 H1 WAT 9561 62.516 28.911 102.402 1.00 0.00 H ATOM 27923 H2 WAT 9561 63.322 29.922 103.189 1.00 0.00 H TER 27925 WAT 9561 ATOM 27925 O WAT 9562 35.437 107.097 125.679 1.00 0.00 O ATOM 27926 H1 WAT 9562 36.387 107.164 125.587 1.00 0.00 H ATOM 27927 H2 WAT 9562 35.294 106.228 126.055 1.00 0.00 H TER 27929 WAT 9562 ATOM 27929 O WAT 9563 28.696 128.693 96.620 1.00 0.00 O ATOM 27930 H1 WAT 9563 27.997 128.719 95.967 1.00 0.00 H ATOM 27931 H2 WAT 9563 28.389 129.266 97.323 1.00 0.00 H TER 27933 WAT 9563 ATOM 27933 O WAT 9564 10.312 86.570 129.699 1.00 0.00 O ATOM 27934 H1 WAT 9564 10.145 86.035 130.476 1.00 0.00 H ATOM 27935 H2 WAT 9564 10.208 87.472 130.003 1.00 0.00 H TER 27937 WAT 9564 ATOM 27937 O WAT 9565 109.743 51.234 14.960 1.00 0.00 O ATOM 27938 H1 WAT 9565 108.833 51.490 14.811 1.00 0.00 H ATOM 27939 H2 WAT 9565 109.827 50.384 14.528 1.00 0.00 H TER 27941 WAT 9565 ATOM 27941 O WAT 9566 18.874 36.604 65.686 1.00 0.00 O ATOM 27942 H1 WAT 9566 19.393 35.799 65.696 1.00 0.00 H ATOM 27943 H2 WAT 9566 18.001 36.323 65.412 1.00 0.00 H TER 27945 WAT 9566 ATOM 27945 O WAT 9567 61.881 27.822 93.324 1.00 0.00 O ATOM 27946 H1 WAT 9567 61.097 27.539 93.795 1.00 0.00 H ATOM 27947 H2 WAT 9567 62.432 27.040 93.285 1.00 0.00 H TER 27949 WAT 9567 ATOM 27949 O WAT 9568 36.500 133.156 142.455 1.00 0.00 O ATOM 27950 H1 WAT 9568 37.232 132.544 142.538 1.00 0.00 H ATOM 27951 H2 WAT 9568 36.882 133.932 142.044 1.00 0.00 H TER 27953 WAT 9568 ATOM 27953 O WAT 9569 126.903 30.411 97.689 1.00 0.00 O ATOM 27954 H1 WAT 9569 126.120 30.931 97.873 1.00 0.00 H ATOM 27955 H2 WAT 9569 126.906 30.312 96.737 1.00 0.00 H TER 27957 WAT 9569 ATOM 27957 O WAT 9570 81.111 145.663 154.146 1.00 0.00 O ATOM 27958 H1 WAT 9570 81.265 146.465 154.644 1.00 0.00 H ATOM 27959 H2 WAT 9570 81.308 144.957 154.761 1.00 0.00 H TER 27961 WAT 9570 ATOM 27961 O WAT 9571 37.906 43.525 88.045 1.00 0.00 O ATOM 27962 H1 WAT 9571 38.384 43.031 87.378 1.00 0.00 H ATOM 27963 H2 WAT 9571 38.443 43.444 88.833 1.00 0.00 H TER 27965 WAT 9571 ATOM 27965 O WAT 9572 64.826 10.828 20.421 1.00 0.00 O ATOM 27966 H1 WAT 9572 65.081 10.190 19.754 1.00 0.00 H ATOM 27967 H2 WAT 9572 64.164 10.376 20.944 1.00 0.00 H TER 27969 WAT 9572 ATOM 27969 O WAT 9573 25.493 75.627 156.787 1.00 0.00 O ATOM 27970 H1 WAT 9573 25.642 76.244 157.504 1.00 0.00 H ATOM 27971 H2 WAT 9573 25.921 76.030 156.032 1.00 0.00 H TER 27973 WAT 9573 ATOM 27973 O WAT 9574 116.716 4.068 61.376 1.00 0.00 O ATOM 27974 H1 WAT 9574 116.014 4.580 61.777 1.00 0.00 H ATOM 27975 H2 WAT 9574 116.455 3.979 60.459 1.00 0.00 H TER 27977 WAT 9574 ATOM 27977 O WAT 9575 41.457 87.723 22.298 1.00 0.00 O ATOM 27978 H1 WAT 9575 40.608 87.700 22.741 1.00 0.00 H ATOM 27979 H2 WAT 9575 42.037 87.216 22.866 1.00 0.00 H TER 27981 WAT 9575 ATOM 27981 O WAT 9576 138.151 65.301 103.921 1.00 0.00 O ATOM 27982 H1 WAT 9576 137.649 65.074 104.704 1.00 0.00 H ATOM 27983 H2 WAT 9576 139.064 65.175 104.177 1.00 0.00 H TER 27985 WAT 9576 ATOM 27985 O WAT 9577 103.002 66.837 75.678 1.00 0.00 O ATOM 27986 H1 WAT 9577 102.250 66.268 75.513 1.00 0.00 H ATOM 27987 H2 WAT 9577 103.044 66.908 76.631 1.00 0.00 H TER 27989 WAT 9577 ATOM 27989 O WAT 9578 46.371 59.330 114.333 1.00 0.00 O ATOM 27990 H1 WAT 9578 47.252 59.044 114.092 1.00 0.00 H ATOM 27991 H2 WAT 9578 46.461 60.268 114.499 1.00 0.00 H TER 27993 WAT 9578 ATOM 27993 O WAT 9579 24.385 3.183 82.941 1.00 0.00 O ATOM 27994 H1 WAT 9579 24.183 3.591 82.100 1.00 0.00 H ATOM 27995 H2 WAT 9579 24.206 3.865 83.588 1.00 0.00 H TER 27997 WAT 9579 ATOM 27997 O WAT 9580 116.378 21.387 87.638 1.00 0.00 O ATOM 27998 H1 WAT 9580 115.525 21.681 87.959 1.00 0.00 H ATOM 27999 H2 WAT 9580 116.384 20.444 87.803 1.00 0.00 H TER 28001 WAT 9580 ATOM 28001 O WAT 9581 93.915 108.745 80.934 1.00 0.00 O ATOM 28002 H1 WAT 9581 93.994 109.317 80.170 1.00 0.00 H ATOM 28003 H2 WAT 9581 93.024 108.893 81.251 1.00 0.00 H TER 28005 WAT 9581 ATOM 28005 O WAT 9582 28.765 139.053 146.535 1.00 0.00 O ATOM 28006 H1 WAT 9582 27.964 139.449 146.190 1.00 0.00 H ATOM 28007 H2 WAT 9582 28.668 138.119 146.353 1.00 0.00 H TER 28009 WAT 9582 ATOM 28009 O WAT 9583 5.321 15.497 137.972 1.00 0.00 O ATOM 28010 H1 WAT 9583 5.443 14.873 138.687 1.00 0.00 H ATOM 28011 H2 WAT 9583 4.615 15.123 137.445 1.00 0.00 H TER 28013 WAT 9583 ATOM 28013 O WAT 9584 139.179 129.068 117.946 1.00 0.00 O ATOM 28014 H1 WAT 9584 138.263 128.864 117.757 1.00 0.00 H ATOM 28015 H2 WAT 9584 139.289 128.839 118.869 1.00 0.00 H TER 28017 WAT 9584 ATOM 28017 O WAT 9585 76.147 105.040 100.900 1.00 0.00 O ATOM 28018 H1 WAT 9585 76.321 104.152 100.588 1.00 0.00 H ATOM 28019 H2 WAT 9585 75.683 105.461 100.176 1.00 0.00 H TER 28021 WAT 9585 ATOM 28021 O WAT 9586 19.603 44.174 114.862 1.00 0.00 O ATOM 28022 H1 WAT 9586 18.841 43.838 114.390 1.00 0.00 H ATOM 28023 H2 WAT 9586 20.196 44.477 114.174 1.00 0.00 H TER 28025 WAT 9586 ATOM 28025 O WAT 9587 68.085 117.742 57.982 1.00 0.00 O ATOM 28026 H1 WAT 9587 67.559 117.226 57.371 1.00 0.00 H ATOM 28027 H2 WAT 9587 68.333 117.121 58.667 1.00 0.00 H TER 28029 WAT 9587 ATOM 28029 O WAT 9588 92.360 18.605 115.814 1.00 0.00 O ATOM 28030 H1 WAT 9588 91.479 18.327 115.565 1.00 0.00 H ATOM 28031 H2 WAT 9588 92.363 19.552 115.669 1.00 0.00 H TER 28033 WAT 9588 ATOM 28033 O WAT 9589 131.132 44.412 157.798 1.00 0.00 O ATOM 28034 H1 WAT 9589 131.910 44.438 158.355 1.00 0.00 H ATOM 28035 H2 WAT 9589 131.192 45.204 157.265 1.00 0.00 H TER 28037 WAT 9589 ATOM 28037 O WAT 9590 93.421 96.846 21.710 1.00 0.00 O ATOM 28038 H1 WAT 9590 92.508 96.986 21.962 1.00 0.00 H ATOM 28039 H2 WAT 9590 93.922 97.387 22.320 1.00 0.00 H TER 28041 WAT 9590 ATOM 28041 O WAT 9591 35.204 40.620 117.318 1.00 0.00 O ATOM 28042 H1 WAT 9591 35.056 39.675 117.351 1.00 0.00 H ATOM 28043 H2 WAT 9591 35.282 40.883 118.235 1.00 0.00 H TER 28045 WAT 9591 ATOM 28045 O WAT 9592 108.453 38.492 146.147 1.00 0.00 O ATOM 28046 H1 WAT 9592 109.071 38.669 145.437 1.00 0.00 H ATOM 28047 H2 WAT 9592 108.034 37.668 145.900 1.00 0.00 H TER 28049 WAT 9592 ATOM 28049 O WAT 9593 17.643 145.532 156.838 1.00 0.00 O ATOM 28050 H1 WAT 9593 18.428 145.023 156.637 1.00 0.00 H ATOM 28051 H2 WAT 9593 16.916 144.943 156.634 1.00 0.00 H TER 28053 WAT 9593 ATOM 28053 O WAT 9594 6.259 128.366 81.729 1.00 0.00 O ATOM 28054 H1 WAT 9594 6.811 129.028 81.314 1.00 0.00 H ATOM 28055 H2 WAT 9594 6.015 127.776 81.016 1.00 0.00 H TER 28057 WAT 9594 ATOM 28057 O WAT 9595 48.474 128.486 116.308 1.00 0.00 O ATOM 28058 H1 WAT 9595 48.453 127.925 115.533 1.00 0.00 H ATOM 28059 H2 WAT 9595 47.746 128.177 116.848 1.00 0.00 H TER 28061 WAT 9595 ATOM 28061 O WAT 9596 61.232 103.939 148.282 1.00 0.00 O ATOM 28062 H1 WAT 9596 62.063 104.400 148.404 1.00 0.00 H ATOM 28063 H2 WAT 9596 61.438 103.231 147.672 1.00 0.00 H TER 28065 WAT 9596 ATOM 28065 O WAT 9597 19.557 120.881 134.271 1.00 0.00 O ATOM 28066 H1 WAT 9597 20.299 121.485 134.243 1.00 0.00 H ATOM 28067 H2 WAT 9597 19.569 120.448 133.418 1.00 0.00 H TER 28069 WAT 9597 ATOM 28069 O WAT 9598 100.312 141.907 124.011 1.00 0.00 O ATOM 28070 H1 WAT 9598 100.825 141.436 123.355 1.00 0.00 H ATOM 28071 H2 WAT 9598 100.852 141.881 124.801 1.00 0.00 H TER 28073 WAT 9598 ATOM 28073 O WAT 9599 84.360 92.837 64.558 1.00 0.00 O ATOM 28074 H1 WAT 9599 83.641 93.121 63.993 1.00 0.00 H ATOM 28075 H2 WAT 9599 85.004 93.543 64.500 1.00 0.00 H TER 28077 WAT 9599 ATOM 28077 O WAT 9600 70.532 17.391 128.520 1.00 0.00 O ATOM 28078 H1 WAT 9600 69.927 17.802 127.902 1.00 0.00 H ATOM 28079 H2 WAT 9600 70.087 16.590 128.795 1.00 0.00 H TER 28081 WAT 9600 ATOM 28081 O WAT 9601 80.925 80.415 133.736 1.00 0.00 O ATOM 28082 H1 WAT 9601 80.395 79.641 133.929 1.00 0.00 H ATOM 28083 H2 WAT 9601 81.805 80.182 134.031 1.00 0.00 H TER 28085 WAT 9601 ATOM 28085 O WAT 9602 144.831 50.043 20.641 1.00 0.00 O ATOM 28086 H1 WAT 9602 143.889 50.082 20.478 1.00 0.00 H ATOM 28087 H2 WAT 9602 145.185 49.566 19.890 1.00 0.00 H TER 28089 WAT 9602 ATOM 28089 O WAT 9603 136.171 107.596 157.316 1.00 0.00 O ATOM 28090 H1 WAT 9603 136.716 107.305 158.046 1.00 0.00 H ATOM 28091 H2 WAT 9603 136.740 107.526 156.549 1.00 0.00 H TER 28093 WAT 9603 ATOM 28093 O WAT 9604 122.226 24.091 128.068 1.00 0.00 O ATOM 28094 H1 WAT 9604 122.457 23.454 128.744 1.00 0.00 H ATOM 28095 H2 WAT 9604 121.763 23.579 127.405 1.00 0.00 H TER 28097 WAT 9604 ATOM 28097 O WAT 9605 22.865 102.133 11.183 1.00 0.00 O ATOM 28098 H1 WAT 9605 23.024 101.786 12.061 1.00 0.00 H ATOM 28099 H2 WAT 9605 22.319 101.471 10.760 1.00 0.00 H TER 28101 WAT 9605 ATOM 28101 O WAT 9606 66.558 82.456 87.164 1.00 0.00 O ATOM 28102 H1 WAT 9606 65.845 82.179 87.739 1.00 0.00 H ATOM 28103 H2 WAT 9606 66.596 81.781 86.487 1.00 0.00 H TER 28105 WAT 9606 ATOM 28105 O WAT 9607 99.168 81.805 143.779 1.00 0.00 O ATOM 28106 H1 WAT 9607 98.553 82.452 144.123 1.00 0.00 H ATOM 28107 H2 WAT 9607 98.792 80.961 144.028 1.00 0.00 H TER 28109 WAT 9607 ATOM 28109 O WAT 9608 39.618 107.112 83.700 1.00 0.00 O ATOM 28110 H1 WAT 9608 40.452 107.329 84.117 1.00 0.00 H ATOM 28111 H2 WAT 9608 39.511 107.775 83.018 1.00 0.00 H TER 28113 WAT 9608 ATOM 28113 O WAT 9609 47.512 47.251 134.353 1.00 0.00 O ATOM 28114 H1 WAT 9609 47.771 47.723 133.561 1.00 0.00 H ATOM 28115 H2 WAT 9609 48.335 47.085 134.813 1.00 0.00 H TER 28117 WAT 9609 ATOM 28117 O WAT 9610 108.436 60.013 139.944 1.00 0.00 O ATOM 28118 H1 WAT 9610 107.654 59.655 140.364 1.00 0.00 H ATOM 28119 H2 WAT 9610 108.330 59.796 139.017 1.00 0.00 H TER 28121 WAT 9610 ATOM 28121 O WAT 9611 46.812 49.288 157.568 1.00 0.00 O ATOM 28122 H1 WAT 9611 46.401 49.674 158.341 1.00 0.00 H ATOM 28123 H2 WAT 9611 47.571 49.846 157.396 1.00 0.00 H TER 28125 WAT 9611 ATOM 28125 O WAT 9612 53.264 126.773 15.590 1.00 0.00 O ATOM 28126 H1 WAT 9612 53.361 126.004 16.151 1.00 0.00 H ATOM 28127 H2 WAT 9612 52.731 127.379 16.104 1.00 0.00 H TER 28129 WAT 9612 ATOM 28129 O WAT 9613 51.796 128.414 17.071 1.00 0.00 O ATOM 28130 H1 WAT 9613 52.004 129.291 17.395 1.00 0.00 H ATOM 28131 H2 WAT 9613 51.079 128.552 16.452 1.00 0.00 H TER 28133 WAT 9613 ATOM 28133 O WAT 9614 73.276 119.686 91.522 1.00 0.00 O ATOM 28134 H1 WAT 9614 72.398 119.967 91.265 1.00 0.00 H ATOM 28135 H2 WAT 9614 73.529 120.294 92.216 1.00 0.00 H TER 28137 WAT 9614 ATOM 28137 O WAT 9615 90.289 18.990 8.424 1.00 0.00 O ATOM 28138 H1 WAT 9615 90.124 19.869 8.085 1.00 0.00 H ATOM 28139 H2 WAT 9615 89.917 18.405 7.764 1.00 0.00 H TER 28141 WAT 9615 ATOM 28141 O WAT 9616 139.131 85.992 31.054 1.00 0.00 O ATOM 28142 H1 WAT 9616 139.443 86.760 31.532 1.00 0.00 H ATOM 28143 H2 WAT 9616 138.203 86.168 30.899 1.00 0.00 H TER 28145 WAT 9616 ATOM 28145 O WAT 9617 120.938 133.810 128.742 1.00 0.00 O ATOM 28146 H1 WAT 9617 121.155 132.916 128.479 1.00 0.00 H ATOM 28147 H2 WAT 9617 120.516 133.712 129.596 1.00 0.00 H TER 28149 WAT 9617 ATOM 28149 O WAT 9618 60.957 50.641 140.569 1.00 0.00 O ATOM 28150 H1 WAT 9618 61.337 50.629 139.690 1.00 0.00 H ATOM 28151 H2 WAT 9618 61.613 50.212 141.119 1.00 0.00 H TER 28153 WAT 9618 ATOM 28153 O WAT 9619 32.145 128.772 108.666 1.00 0.00 O ATOM 28154 H1 WAT 9619 31.265 128.488 108.914 1.00 0.00 H ATOM 28155 H2 WAT 9619 32.730 128.224 109.189 1.00 0.00 H TER 28157 WAT 9619 ATOM 28157 O WAT 9620 63.315 2.493 139.187 1.00 0.00 O ATOM 28158 H1 WAT 9620 62.528 3.036 139.133 1.00 0.00 H ATOM 28159 H2 WAT 9620 63.780 2.664 138.369 1.00 0.00 H TER 28161 WAT 9620 ATOM 28161 O WAT 9621 82.280 66.726 131.147 1.00 0.00 O ATOM 28162 H1 WAT 9621 82.400 66.915 130.216 1.00 0.00 H ATOM 28163 H2 WAT 9621 82.100 67.579 131.543 1.00 0.00 H TER 28165 WAT 9621 ATOM 28165 O WAT 9622 118.752 21.948 120.545 1.00 0.00 O ATOM 28166 H1 WAT 9622 117.891 22.223 120.862 1.00 0.00 H ATOM 28167 H2 WAT 9622 118.959 21.169 121.060 1.00 0.00 H TER 28169 WAT 9622 ATOM 28169 O WAT 9623 82.889 55.452 136.114 1.00 0.00 O ATOM 28170 H1 WAT 9623 82.387 55.462 135.299 1.00 0.00 H ATOM 28171 H2 WAT 9623 83.707 55.899 135.897 1.00 0.00 H TER 28173 WAT 9623 ATOM 28173 O WAT 9624 92.467 78.624 103.501 1.00 0.00 O ATOM 28174 H1 WAT 9624 91.821 79.307 103.323 1.00 0.00 H ATOM 28175 H2 WAT 9624 93.006 78.593 102.711 1.00 0.00 H TER 28177 WAT 9624 ATOM 28177 O WAT 9625 101.506 107.716 132.692 1.00 0.00 O ATOM 28178 H1 WAT 9625 101.284 107.949 131.790 1.00 0.00 H ATOM 28179 H2 WAT 9625 101.307 106.782 132.754 1.00 0.00 H TER 28181 WAT 9625 ATOM 28181 O WAT 9626 103.022 72.117 120.154 1.00 0.00 O ATOM 28182 H1 WAT 9626 103.717 72.284 120.791 1.00 0.00 H ATOM 28183 H2 WAT 9626 102.289 71.794 120.678 1.00 0.00 H TER 28185 WAT 9626 ATOM 28185 O WAT 9627 19.805 26.708 123.325 1.00 0.00 O ATOM 28186 H1 WAT 9627 20.750 26.807 123.207 1.00 0.00 H ATOM 28187 H2 WAT 9627 19.713 26.300 124.186 1.00 0.00 H TER 28189 WAT 9627 ATOM 28189 O WAT 9628 96.401 113.503 153.134 1.00 0.00 O ATOM 28190 H1 WAT 9628 96.021 113.764 153.973 1.00 0.00 H ATOM 28191 H2 WAT 9628 95.819 113.885 152.478 1.00 0.00 H TER 28193 WAT 9628 ATOM 28193 O WAT 9629 80.111 87.950 8.629 1.00 0.00 O ATOM 28194 H1 WAT 9629 79.298 87.809 9.115 1.00 0.00 H ATOM 28195 H2 WAT 9629 80.652 87.190 8.842 1.00 0.00 H TER 28197 WAT 9629 ATOM 28197 O WAT 9630 51.488 82.379 57.903 1.00 0.00 O ATOM 28198 H1 WAT 9630 52.329 81.933 57.999 1.00 0.00 H ATOM 28199 H2 WAT 9630 50.847 81.671 57.839 1.00 0.00 H TER 28201 WAT 9630 ATOM 28201 O WAT 9631 36.559 81.560 69.920 1.00 0.00 O ATOM 28202 H1 WAT 9631 36.074 81.815 70.706 1.00 0.00 H ATOM 28203 H2 WAT 9631 36.463 80.609 69.878 1.00 0.00 H TER 28205 WAT 9631 ATOM 28205 O WAT 9632 109.672 53.519 138.079 1.00 0.00 O ATOM 28206 H1 WAT 9632 110.430 52.954 137.929 1.00 0.00 H ATOM 28207 H2 WAT 9632 109.464 53.401 139.006 1.00 0.00 H TER 28209 WAT 9632 ATOM 28209 O WAT 9633 57.453 83.287 123.875 1.00 0.00 O ATOM 28210 H1 WAT 9633 57.468 82.675 123.139 1.00 0.00 H ATOM 28211 H2 WAT 9633 57.540 84.150 123.470 1.00 0.00 H TER 28213 WAT 9633 ATOM 28213 O WAT 9634 101.798 101.726 126.819 1.00 0.00 O ATOM 28214 H1 WAT 9634 102.553 101.910 126.261 1.00 0.00 H ATOM 28215 H2 WAT 9634 102.130 101.825 127.711 1.00 0.00 H TER 28217 WAT 9634 ATOM 28217 O WAT 9635 78.973 4.727 8.569 1.00 0.00 O ATOM 28218 H1 WAT 9635 78.392 5.375 8.968 1.00 0.00 H ATOM 28219 H2 WAT 9635 79.460 5.219 7.907 1.00 0.00 H TER 28221 WAT 9635 ATOM 28221 O WAT 9636 17.249 109.681 8.723 1.00 0.00 O ATOM 28222 H1 WAT 9636 17.608 110.007 7.898 1.00 0.00 H ATOM 28223 H2 WAT 9636 17.830 110.038 9.395 1.00 0.00 H TER 28225 WAT 9636 ATOM 28225 O WAT 9637 57.612 42.259 101.237 1.00 0.00 O ATOM 28226 H1 WAT 9637 58.511 41.979 101.064 1.00 0.00 H ATOM 28227 H2 WAT 9637 57.706 43.073 101.731 1.00 0.00 H TER 28229 WAT 9637 ATOM 28229 O WAT 9638 43.688 127.310 61.593 1.00 0.00 O ATOM 28230 H1 WAT 9638 43.534 128.195 61.925 1.00 0.00 H ATOM 28231 H2 WAT 9638 44.625 127.165 61.722 1.00 0.00 H TER 28233 WAT 9638 ATOM 28233 O WAT 9639 51.153 104.978 128.573 1.00 0.00 O ATOM 28234 H1 WAT 9639 51.513 104.710 127.727 1.00 0.00 H ATOM 28235 H2 WAT 9639 50.388 105.507 128.351 1.00 0.00 H TER 28237 WAT 9639 ATOM 28237 O WAT 9640 10.002 33.715 65.279 1.00 0.00 O ATOM 28238 H1 WAT 9640 10.452 34.387 64.767 1.00 0.00 H ATOM 28239 H2 WAT 9640 10.151 32.904 64.793 1.00 0.00 H TER 28241 WAT 9640 ATOM 28241 O WAT 9641 107.681 79.459 151.131 1.00 0.00 O ATOM 28242 H1 WAT 9641 107.948 80.371 151.244 1.00 0.00 H ATOM 28243 H2 WAT 9641 107.972 79.232 150.248 1.00 0.00 H TER 28245 WAT 9641 ATOM 28245 O WAT 9642 106.898 37.728 128.961 1.00 0.00 O ATOM 28246 H1 WAT 9642 105.963 37.834 129.136 1.00 0.00 H ATOM 28247 H2 WAT 9642 107.330 38.095 129.732 1.00 0.00 H TER 28249 WAT 9642 ATOM 28249 O WAT 9643 130.779 74.231 82.652 1.00 0.00 O ATOM 28250 H1 WAT 9643 130.699 74.663 83.502 1.00 0.00 H ATOM 28251 H2 WAT 9643 130.225 74.749 82.067 1.00 0.00 H TER 28253 WAT 9643 ATOM 28253 O WAT 9644 127.641 2.122 140.766 1.00 0.00 O ATOM 28254 H1 WAT 9644 128.069 2.683 141.413 1.00 0.00 H ATOM 28255 H2 WAT 9644 128.008 1.252 140.923 1.00 0.00 H TER 28257 WAT 9644 ATOM 28257 O WAT 9645 134.131 133.387 85.605 1.00 0.00 O ATOM 28258 H1 WAT 9645 133.884 134.217 85.198 1.00 0.00 H ATOM 28259 H2 WAT 9645 134.219 132.777 84.872 1.00 0.00 H TER 28261 WAT 9645 ATOM 28261 O WAT 9646 128.642 123.914 122.491 1.00 0.00 O ATOM 28262 H1 WAT 9646 128.984 123.474 121.713 1.00 0.00 H ATOM 28263 H2 WAT 9646 127.733 123.622 122.551 1.00 0.00 H TER 28265 WAT 9646 ATOM 28265 O WAT 9647 111.908 113.181 116.714 1.00 0.00 O ATOM 28266 H1 WAT 9647 111.361 113.956 116.842 1.00 0.00 H ATOM 28267 H2 WAT 9647 112.804 113.518 116.718 1.00 0.00 H TER 28269 WAT 9647 ATOM 28269 O WAT 9648 145.239 22.695 111.842 1.00 0.00 O ATOM 28270 H1 WAT 9648 144.360 22.323 111.912 1.00 0.00 H ATOM 28271 H2 WAT 9648 145.726 22.298 112.565 1.00 0.00 H TER 28273 WAT 9648 ATOM 28273 O WAT 9649 21.248 1.468 150.869 1.00 0.00 O ATOM 28274 H1 WAT 9649 20.866 0.672 151.238 1.00 0.00 H ATOM 28275 H2 WAT 9649 22.186 1.386 151.043 1.00 0.00 H TER 28277 WAT 9649 ATOM 28277 O WAT 9650 1.509 72.788 55.339 1.00 0.00 O ATOM 28278 H1 WAT 9650 2.419 73.057 55.467 1.00 0.00 H ATOM 28279 H2 WAT 9650 1.000 73.585 55.490 1.00 0.00 H TER 28281 WAT 9650 ATOM 28281 O WAT 9651 143.062 109.447 94.319 1.00 0.00 O ATOM 28282 H1 WAT 9651 143.503 110.296 94.326 1.00 0.00 H ATOM 28283 H2 WAT 9651 143.546 108.930 93.675 1.00 0.00 H TER 28285 WAT 9651 ATOM 28285 O WAT 9652 53.867 93.816 146.572 1.00 0.00 O ATOM 28286 H1 WAT 9652 54.155 94.729 146.559 1.00 0.00 H ATOM 28287 H2 WAT 9652 54.086 93.484 145.701 1.00 0.00 H TER 28289 WAT 9652 ATOM 28289 O WAT 9653 129.880 133.111 7.581 1.00 0.00 O ATOM 28290 H1 WAT 9653 129.015 133.424 7.846 1.00 0.00 H ATOM 28291 H2 WAT 9653 130.050 133.554 6.750 1.00 0.00 H TER 28293 WAT 9653 ATOM 28293 O WAT 9654 26.393 137.128 154.775 1.00 0.00 O ATOM 28294 H1 WAT 9654 26.998 136.388 154.835 1.00 0.00 H ATOM 28295 H2 WAT 9654 25.917 137.116 155.605 1.00 0.00 H TER 28297 WAT 9654 ATOM 28297 O WAT 9655 99.294 112.392 75.151 1.00 0.00 O ATOM 28298 H1 WAT 9655 98.806 112.711 75.910 1.00 0.00 H ATOM 28299 H2 WAT 9655 98.642 112.340 74.452 1.00 0.00 H TER 28301 WAT 9655 ATOM 28301 O WAT 9656 21.999 54.546 102.495 1.00 0.00 O ATOM 28302 H1 WAT 9656 22.386 53.875 103.058 1.00 0.00 H ATOM 28303 H2 WAT 9656 22.474 54.468 101.668 1.00 0.00 H TER 28305 WAT 9656 ATOM 28305 O WAT 9657 118.573 38.103 80.509 1.00 0.00 O ATOM 28306 H1 WAT 9657 117.643 38.195 80.718 1.00 0.00 H ATOM 28307 H2 WAT 9657 118.611 38.155 79.554 1.00 0.00 H TER 28309 WAT 9657 ATOM 28309 O WAT 9658 21.364 52.317 85.353 1.00 0.00 O ATOM 28310 H1 WAT 9658 20.693 52.768 85.866 1.00 0.00 H ATOM 28311 H2 WAT 9658 20.999 52.269 84.469 1.00 0.00 H TER 28313 WAT 9658 ATOM 28313 O WAT 9659 85.771 80.054 9.671 1.00 0.00 O ATOM 28314 H1 WAT 9659 85.326 80.899 9.744 1.00 0.00 H ATOM 28315 H2 WAT 9659 85.681 79.816 8.748 1.00 0.00 H TER 28317 WAT 9659 ATOM 28317 O WAT 9660 65.187 11.406 10.158 1.00 0.00 O ATOM 28318 H1 WAT 9660 65.266 10.508 10.479 1.00 0.00 H ATOM 28319 H2 WAT 9660 66.057 11.615 9.816 1.00 0.00 H TER 28321 WAT 9660 ATOM 28321 O WAT 9661 121.047 110.325 74.648 1.00 0.00 O ATOM 28322 H1 WAT 9661 120.249 110.359 75.177 1.00 0.00 H ATOM 28323 H2 WAT 9661 120.851 110.868 73.885 1.00 0.00 H TER 28325 WAT 9661 ATOM 28325 O WAT 9662 101.447 58.452 89.351 1.00 0.00 O ATOM 28326 H1 WAT 9662 101.834 59.318 89.224 1.00 0.00 H ATOM 28327 H2 WAT 9662 102.135 57.942 89.778 1.00 0.00 H TER 28329 WAT 9662 ATOM 28329 O WAT 9663 63.458 39.705 123.527 1.00 0.00 O ATOM 28330 H1 WAT 9663 63.574 39.923 124.452 1.00 0.00 H ATOM 28331 H2 WAT 9663 64.347 39.677 123.174 1.00 0.00 H TER 28333 WAT 9663 ATOM 28333 O WAT 9664 131.595 76.987 103.159 1.00 0.00 O ATOM 28334 H1 WAT 9664 131.266 77.836 102.861 1.00 0.00 H ATOM 28335 H2 WAT 9664 131.266 76.363 102.512 1.00 0.00 H TER 28337 WAT 9664 ATOM 28337 O WAT 9665 25.054 112.667 8.612 1.00 0.00 O ATOM 28338 H1 WAT 9665 25.936 112.374 8.382 1.00 0.00 H ATOM 28339 H2 WAT 9665 25.153 113.601 8.799 1.00 0.00 H TER 28341 WAT 9665 ATOM 28341 O WAT 9666 10.803 137.367 156.598 1.00 0.00 O ATOM 28342 H1 WAT 9666 11.097 137.462 155.692 1.00 0.00 H ATOM 28343 H2 WAT 9666 10.147 138.055 156.710 1.00 0.00 H TER 28345 WAT 9666 ATOM 28345 O WAT 9667 51.708 71.653 125.211 1.00 0.00 O ATOM 28346 H1 WAT 9667 52.012 72.557 125.132 1.00 0.00 H ATOM 28347 H2 WAT 9667 51.434 71.415 124.325 1.00 0.00 H TER 28349 WAT 9667 ATOM 28349 O WAT 9668 51.694 33.826 145.314 1.00 0.00 O ATOM 28350 H1 WAT 9668 51.232 34.492 144.805 1.00 0.00 H ATOM 28351 H2 WAT 9668 51.571 33.017 144.818 1.00 0.00 H TER 28353 WAT 9668 ATOM 28353 O WAT 9669 64.058 37.041 68.556 1.00 0.00 O ATOM 28354 H1 WAT 9669 64.010 36.407 67.841 1.00 0.00 H ATOM 28355 H2 WAT 9669 64.933 37.422 68.481 1.00 0.00 H TER 28357 WAT 9669 ATOM 28357 O WAT 9670 107.777 47.914 137.084 1.00 0.00 O ATOM 28358 H1 WAT 9670 106.955 48.377 136.921 1.00 0.00 H ATOM 28359 H2 WAT 9670 107.555 46.989 136.984 1.00 0.00 H TER 28361 WAT 9670 ATOM 28361 O WAT 9671 114.822 139.019 106.021 1.00 0.00 O ATOM 28362 H1 WAT 9671 114.094 139.326 105.481 1.00 0.00 H ATOM 28363 H2 WAT 9671 115.511 139.668 105.886 1.00 0.00 H TER 28365 WAT 9671 ATOM 28365 O WAT 9672 117.673 47.765 132.745 1.00 0.00 O ATOM 28366 H1 WAT 9672 118.221 48.292 133.326 1.00 0.00 H ATOM 28367 H2 WAT 9672 116.787 48.096 132.886 1.00 0.00 H TER 28369 WAT 9672 ATOM 28369 O WAT 9673 84.736 80.832 126.341 1.00 0.00 O ATOM 28370 H1 WAT 9673 84.507 81.150 127.214 1.00 0.00 H ATOM 28371 H2 WAT 9673 84.996 79.921 126.478 1.00 0.00 H TER 28373 WAT 9673 ATOM 28373 O WAT 9674 120.940 109.319 147.128 1.00 0.00 O ATOM 28374 H1 WAT 9674 121.235 108.817 147.888 1.00 0.00 H ATOM 28375 H2 WAT 9674 119.997 109.158 147.087 1.00 0.00 H TER 28377 WAT 9674 ATOM 28377 O WAT 9675 19.678 121.198 65.543 1.00 0.00 O ATOM 28378 H1 WAT 9675 20.062 121.306 66.413 1.00 0.00 H ATOM 28379 H2 WAT 9675 18.733 121.200 65.697 1.00 0.00 H TER 28381 WAT 9675 ATOM 28381 O WAT 9676 8.118 95.354 120.853 1.00 0.00 O ATOM 28382 H1 WAT 9676 7.634 94.531 120.921 1.00 0.00 H ATOM 28383 H2 WAT 9676 8.786 95.296 121.536 1.00 0.00 H TER 28385 WAT 9676 ATOM 28385 O WAT 9677 84.233 137.485 68.720 1.00 0.00 O ATOM 28386 H1 WAT 9677 83.679 137.197 67.994 1.00 0.00 H ATOM 28387 H2 WAT 9677 83.626 137.611 69.449 1.00 0.00 H TER 28389 WAT 9677 ATOM 28389 O WAT 9678 109.383 43.160 12.785 1.00 0.00 O ATOM 28390 H1 WAT 9678 109.628 42.732 11.964 1.00 0.00 H ATOM 28391 H2 WAT 9678 109.423 42.463 13.440 1.00 0.00 H TER 28393 WAT 9678 ATOM 28393 O WAT 9679 93.104 140.445 55.468 1.00 0.00 O ATOM 28394 H1 WAT 9679 93.047 139.969 54.640 1.00 0.00 H ATOM 28395 H2 WAT 9679 92.296 140.220 55.929 1.00 0.00 H TER 28397 WAT 9679 ATOM 28397 O WAT 9680 81.099 30.971 123.649 1.00 0.00 O ATOM 28398 H1 WAT 9680 81.137 31.727 124.235 1.00 0.00 H ATOM 28399 H2 WAT 9680 81.997 30.640 123.628 1.00 0.00 H TER 28401 WAT 9680 ATOM 28401 O WAT 9681 104.796 36.441 85.984 1.00 0.00 O ATOM 28402 H1 WAT 9681 104.613 35.848 86.713 1.00 0.00 H ATOM 28403 H2 WAT 9681 104.048 37.038 85.968 1.00 0.00 H TER 28405 WAT 9681 ATOM 28405 O WAT 9682 32.849 30.627 131.496 1.00 0.00 O ATOM 28406 H1 WAT 9682 32.745 31.325 132.143 1.00 0.00 H ATOM 28407 H2 WAT 9682 31.954 30.394 131.249 1.00 0.00 H TER 28409 WAT 9682 ATOM 28409 O WAT 9683 35.119 43.077 128.503 1.00 0.00 O ATOM 28410 H1 WAT 9683 34.162 43.069 128.537 1.00 0.00 H ATOM 28411 H2 WAT 9683 35.365 43.918 128.889 1.00 0.00 H TER 28413 WAT 9683 ATOM 28413 O WAT 9684 59.643 132.869 55.578 1.00 0.00 O ATOM 28414 H1 WAT 9684 59.366 132.217 56.222 1.00 0.00 H ATOM 28415 H2 WAT 9684 59.811 132.364 54.783 1.00 0.00 H TER 28417 WAT 9684 ATOM 28417 O WAT 9685 73.539 20.178 2.565 1.00 0.00 O ATOM 28418 H1 WAT 9685 73.573 21.060 2.937 1.00 0.00 H ATOM 28419 H2 WAT 9685 73.693 19.598 3.311 1.00 0.00 H TER 28421 WAT 9685 ATOM 28421 O WAT 9686 112.434 119.968 144.874 1.00 0.00 O ATOM 28422 H1 WAT 9686 112.389 120.752 145.422 1.00 0.00 H ATOM 28423 H2 WAT 9686 111.593 119.532 145.011 1.00 0.00 H TER 28425 WAT 9686 ATOM 28425 O WAT 9687 90.532 91.714 70.253 1.00 0.00 O ATOM 28426 H1 WAT 9687 91.160 92.221 70.767 1.00 0.00 H ATOM 28427 H2 WAT 9687 89.754 91.664 70.807 1.00 0.00 H TER 28429 WAT 9687 ATOM 28429 O WAT 9688 131.954 24.440 83.544 1.00 0.00 O ATOM 28430 H1 WAT 9688 132.525 24.752 82.842 1.00 0.00 H ATOM 28431 H2 WAT 9688 132.554 24.113 84.213 1.00 0.00 H TER 28433 WAT 9688 ATOM 28433 O WAT 9689 132.946 108.327 81.780 1.00 0.00 O ATOM 28434 H1 WAT 9689 133.159 108.766 82.604 1.00 0.00 H ATOM 28435 H2 WAT 9689 132.606 109.024 81.218 1.00 0.00 H TER 28437 WAT 9689 ATOM 28437 O WAT 9690 53.064 55.140 22.790 1.00 0.00 O ATOM 28438 H1 WAT 9690 52.842 55.768 23.478 1.00 0.00 H ATOM 28439 H2 WAT 9690 53.213 54.318 23.256 1.00 0.00 H TER 28441 WAT 9690 ATOM 28441 O WAT 9691 12.343 66.194 84.303 1.00 0.00 O ATOM 28442 H1 WAT 9691 12.567 66.005 83.392 1.00 0.00 H ATOM 28443 H2 WAT 9691 11.732 66.930 84.251 1.00 0.00 H TER 28445 WAT 9691 ATOM 28445 O WAT 9692 77.752 143.893 111.935 1.00 0.00 O ATOM 28446 H1 WAT 9692 78.250 143.574 112.688 1.00 0.00 H ATOM 28447 H2 WAT 9692 78.053 143.354 111.203 1.00 0.00 H TER 28449 WAT 9692 ATOM 28449 O WAT 9693 2.386 73.183 94.896 1.00 0.00 O ATOM 28450 H1 WAT 9693 2.475 72.710 94.068 1.00 0.00 H ATOM 28451 H2 WAT 9693 1.527 73.601 94.841 1.00 0.00 H TER 28453 WAT 9693 ATOM 28453 O WAT 9694 84.252 87.901 84.151 1.00 0.00 O ATOM 28454 H1 WAT 9694 84.447 87.619 83.258 1.00 0.00 H ATOM 28455 H2 WAT 9694 83.807 88.742 84.044 1.00 0.00 H TER 28457 WAT 9694 ATOM 28457 O WAT 9695 10.331 52.801 69.223 1.00 0.00 O ATOM 28458 H1 WAT 9695 11.099 53.005 68.688 1.00 0.00 H ATOM 28459 H2 WAT 9695 9.691 53.473 68.988 1.00 0.00 H TER 28461 WAT 9695 ATOM 28461 O WAT 9696 111.090 87.019 148.093 1.00 0.00 O ATOM 28462 H1 WAT 9696 111.273 87.272 147.188 1.00 0.00 H ATOM 28463 H2 WAT 9696 111.330 86.093 148.137 1.00 0.00 H TER 28465 WAT 9696 ATOM 28465 O WAT 9697 35.738 77.111 81.964 1.00 0.00 O ATOM 28466 H1 WAT 9697 35.729 77.403 81.053 1.00 0.00 H ATOM 28467 H2 WAT 9697 34.818 77.117 82.228 1.00 0.00 H TER 28469 WAT 9697 ATOM 28469 O WAT 9698 17.963 37.403 89.421 1.00 0.00 O ATOM 28470 H1 WAT 9698 18.239 37.136 88.544 1.00 0.00 H ATOM 28471 H2 WAT 9698 18.218 36.673 89.985 1.00 0.00 H TER 28473 WAT 9698 ATOM 28473 O WAT 9699 96.505 69.940 149.904 1.00 0.00 O ATOM 28474 H1 WAT 9699 97.321 70.434 149.983 1.00 0.00 H ATOM 28475 H2 WAT 9699 95.996 70.194 150.674 1.00 0.00 H TER 28477 WAT 9699 ATOM 28477 O WAT 9700 48.702 5.948 98.070 1.00 0.00 O ATOM 28478 H1 WAT 9700 49.037 5.326 97.424 1.00 0.00 H ATOM 28479 H2 WAT 9700 49.477 6.225 98.559 1.00 0.00 H TER 28481 WAT 9700 ATOM 28481 O WAT 9701 116.342 3.169 12.069 1.00 0.00 O ATOM 28482 H1 WAT 9701 116.628 2.378 12.526 1.00 0.00 H ATOM 28483 H2 WAT 9701 115.762 3.608 12.691 1.00 0.00 H TER 28485 WAT 9701 ATOM 28485 O WAT 9702 84.134 18.585 136.554 1.00 0.00 O ATOM 28486 H1 WAT 9702 83.520 17.887 136.325 1.00 0.00 H ATOM 28487 H2 WAT 9702 83.606 19.218 137.041 1.00 0.00 H TER 28489 WAT 9702 ATOM 28489 O WAT 9703 52.607 119.413 106.478 1.00 0.00 O ATOM 28490 H1 WAT 9703 52.103 119.325 105.669 1.00 0.00 H ATOM 28491 H2 WAT 9703 53.265 118.720 106.428 1.00 0.00 H TER 28493 WAT 9703 ATOM 28493 O WAT 9704 134.648 1.210 70.216 1.00 0.00 O ATOM 28494 H1 WAT 9704 135.516 1.031 69.854 1.00 0.00 H ATOM 28495 H2 WAT 9704 134.692 2.122 70.504 1.00 0.00 H TER 28497 WAT 9704 ATOM 28497 O WAT 9705 47.629 47.292 89.194 1.00 0.00 O ATOM 28498 H1 WAT 9705 47.011 48.006 89.035 1.00 0.00 H ATOM 28499 H2 WAT 9705 47.323 46.581 88.631 1.00 0.00 H TER 28501 WAT 9705 ATOM 28501 O WAT 9706 2.736 145.234 96.852 1.00 0.00 O ATOM 28502 H1 WAT 9706 1.847 145.430 97.150 1.00 0.00 H ATOM 28503 H2 WAT 9706 2.968 144.425 97.308 1.00 0.00 H TER 28505 WAT 9706 ATOM 28505 O WAT 9707 5.723 27.368 8.959 1.00 0.00 O ATOM 28506 H1 WAT 9707 6.634 27.649 9.037 1.00 0.00 H ATOM 28507 H2 WAT 9707 5.422 27.275 9.863 1.00 0.00 H TER 28509 WAT 9707 ATOM 28509 O WAT 9708 125.610 95.628 86.637 1.00 0.00 O ATOM 28510 H1 WAT 9708 124.821 95.932 86.187 1.00 0.00 H ATOM 28511 H2 WAT 9708 125.486 94.684 86.726 1.00 0.00 H TER 28513 WAT 9708 ATOM 28513 O WAT 9709 76.573 31.861 7.624 1.00 0.00 O ATOM 28514 H1 WAT 9709 75.810 32.379 7.369 1.00 0.00 H ATOM 28515 H2 WAT 9709 76.781 31.343 6.846 1.00 0.00 H TER 28517 WAT 9709 ATOM 28517 O WAT 9710 12.610 97.664 125.926 1.00 0.00 O ATOM 28518 H1 WAT 9710 13.332 97.794 125.311 1.00 0.00 H ATOM 28519 H2 WAT 9710 12.152 96.890 125.597 1.00 0.00 H TER 28521 WAT 9710 ATOM 28521 O WAT 9711 48.145 103.496 101.464 1.00 0.00 O ATOM 28522 H1 WAT 9711 47.779 103.110 102.259 1.00 0.00 H ATOM 28523 H2 WAT 9711 47.422 103.486 100.837 1.00 0.00 H TER 28525 WAT 9711 ATOM 28525 O WAT 9712 103.466 48.000 98.492 1.00 0.00 O ATOM 28526 H1 WAT 9712 103.199 48.708 99.078 1.00 0.00 H ATOM 28527 H2 WAT 9712 103.260 48.324 97.615 1.00 0.00 H TER 28529 WAT 9712 ATOM 28529 O WAT 9713 9.910 71.963 1.578 1.00 0.00 O ATOM 28530 H1 WAT 9713 9.809 71.777 0.644 1.00 0.00 H ATOM 28531 H2 WAT 9713 10.749 72.419 1.642 1.00 0.00 H TER 28533 WAT 9713 ATOM 28533 O WAT 9714 52.808 37.059 141.539 1.00 0.00 O ATOM 28534 H1 WAT 9714 51.940 37.461 141.581 1.00 0.00 H ATOM 28535 H2 WAT 9714 52.643 36.162 141.249 1.00 0.00 H TER 28537 WAT 9714 ATOM 28537 O WAT 9715 50.762 133.988 154.502 1.00 0.00 O ATOM 28538 H1 WAT 9715 51.165 134.821 154.748 1.00 0.00 H ATOM 28539 H2 WAT 9715 50.098 134.225 153.854 1.00 0.00 H TER 28541 WAT 9715 ATOM 28541 O WAT 9716 59.951 7.241 101.766 1.00 0.00 O ATOM 28542 H1 WAT 9716 60.318 6.845 102.556 1.00 0.00 H ATOM 28543 H2 WAT 9716 59.060 7.490 102.014 1.00 0.00 H TER 28545 WAT 9716 ATOM 28545 O WAT 9717 141.991 111.314 104.182 1.00 0.00 O ATOM 28546 H1 WAT 9717 141.349 111.494 104.870 1.00 0.00 H ATOM 28547 H2 WAT 9717 142.597 110.688 104.578 1.00 0.00 H TER 28549 WAT 9717 ATOM 28549 O WAT 9718 57.494 90.369 107.519 1.00 0.00 O ATOM 28550 H1 WAT 9718 58.209 90.632 106.939 1.00 0.00 H ATOM 28551 H2 WAT 9718 57.681 89.454 107.731 1.00 0.00 H TER 28553 WAT 9718 ATOM 28553 O WAT 9719 122.804 131.717 123.455 1.00 0.00 O ATOM 28554 H1 WAT 9719 122.639 132.070 124.328 1.00 0.00 H ATOM 28555 H2 WAT 9719 122.026 131.951 122.950 1.00 0.00 H TER 28557 WAT 9719 ATOM 28557 O WAT 9720 6.038 114.502 85.150 1.00 0.00 O ATOM 28558 H1 WAT 9720 6.929 114.719 85.423 1.00 0.00 H ATOM 28559 H2 WAT 9720 5.516 114.586 85.948 1.00 0.00 H TER 28561 WAT 9720 ATOM 28561 O WAT 9721 31.747 95.253 117.989 1.00 0.00 O ATOM 28562 H1 WAT 9721 31.990 95.978 118.565 1.00 0.00 H ATOM 28563 H2 WAT 9721 32.239 94.504 118.326 1.00 0.00 H TER 28565 WAT 9721 ATOM 28565 O WAT 9722 23.359 125.615 59.758 1.00 0.00 O ATOM 28566 H1 WAT 9722 23.312 126.570 59.781 1.00 0.00 H ATOM 28567 H2 WAT 9722 23.129 125.342 60.646 1.00 0.00 H TER 28569 WAT 9722 ATOM 28569 O WAT 9723 48.723 28.819 154.510 1.00 0.00 O ATOM 28570 H1 WAT 9723 49.049 29.585 154.984 1.00 0.00 H ATOM 28571 H2 WAT 9723 47.981 28.514 155.031 1.00 0.00 H TER 28573 WAT 9723 ATOM 28573 O WAT 9724 45.997 72.883 69.965 1.00 0.00 O ATOM 28574 H1 WAT 9724 45.888 73.379 69.153 1.00 0.00 H ATOM 28575 H2 WAT 9724 45.108 72.783 70.305 1.00 0.00 H TER 28577 WAT 9724 ATOM 28577 O WAT 9725 89.937 54.165 59.043 1.00 0.00 O ATOM 28578 H1 WAT 9725 90.833 54.489 59.143 1.00 0.00 H ATOM 28579 H2 WAT 9725 89.491 54.447 59.842 1.00 0.00 H TER 28581 WAT 9725 ATOM 28581 O WAT 9726 87.004 133.969 103.462 1.00 0.00 O ATOM 28582 H1 WAT 9726 86.385 134.692 103.365 1.00 0.00 H ATOM 28583 H2 WAT 9726 86.473 133.181 103.343 1.00 0.00 H TER 28585 WAT 9726 ATOM 28585 O WAT 9727 12.749 35.170 66.010 1.00 0.00 O ATOM 28586 H1 WAT 9727 13.333 34.675 66.583 1.00 0.00 H ATOM 28587 H2 WAT 9727 12.374 34.512 65.424 1.00 0.00 H TER 28589 WAT 9727 ATOM 28589 O WAT 9728 113.706 49.957 153.981 1.00 0.00 O ATOM 28590 H1 WAT 9728 113.591 49.458 153.172 1.00 0.00 H ATOM 28591 H2 WAT 9728 114.613 50.258 153.949 1.00 0.00 H TER 28593 WAT 9728 ATOM 28593 O WAT 9729 135.203 125.111 125.084 1.00 0.00 O ATOM 28594 H1 WAT 9729 136.093 124.776 125.193 1.00 0.00 H ATOM 28595 H2 WAT 9729 134.690 124.347 124.818 1.00 0.00 H TER 28597 WAT 9729 ATOM 28597 O WAT 9730 62.963 55.055 73.216 1.00 0.00 O ATOM 28598 H1 WAT 9730 62.588 55.254 74.074 1.00 0.00 H ATOM 28599 H2 WAT 9730 63.623 54.384 73.393 1.00 0.00 H TER 28601 WAT 9730 ATOM 28601 O WAT 9731 49.972 125.458 82.369 1.00 0.00 O ATOM 28602 H1 WAT 9731 49.639 125.169 83.219 1.00 0.00 H ATOM 28603 H2 WAT 9731 50.295 126.345 82.529 1.00 0.00 H TER 28605 WAT 9731 ATOM 28605 O WAT 9732 74.001 95.464 107.461 1.00 0.00 O ATOM 28606 H1 WAT 9732 74.533 96.249 107.328 1.00 0.00 H ATOM 28607 H2 WAT 9732 73.145 95.691 107.099 1.00 0.00 H TER 28609 WAT 9732 ATOM 28609 O WAT 9733 83.214 89.564 88.335 1.00 0.00 O ATOM 28610 H1 WAT 9733 83.703 89.071 88.994 1.00 0.00 H ATOM 28611 H2 WAT 9733 83.004 88.919 87.660 1.00 0.00 H TER 28613 WAT 9733 ATOM 28613 O WAT 9734 136.616 118.977 119.585 1.00 0.00 O ATOM 28614 H1 WAT 9734 135.900 119.607 119.507 1.00 0.00 H ATOM 28615 H2 WAT 9734 136.276 118.177 119.183 1.00 0.00 H TER 28617 WAT 9734 ATOM 28617 O WAT 9735 129.310 36.645 131.724 1.00 0.00 O ATOM 28618 H1 WAT 9735 130.135 36.205 131.930 1.00 0.00 H ATOM 28619 H2 WAT 9735 129.074 37.102 132.532 1.00 0.00 H TER 28621 WAT 9735 ATOM 28621 O WAT 9736 83.163 7.329 116.739 1.00 0.00 O ATOM 28622 H1 WAT 9736 83.196 7.642 117.643 1.00 0.00 H ATOM 28623 H2 WAT 9736 82.231 7.206 116.561 1.00 0.00 H TER 28625 WAT 9736 ATOM 28625 O WAT 9737 57.680 113.243 98.563 1.00 0.00 O ATOM 28626 H1 WAT 9737 57.200 112.450 98.801 1.00 0.00 H ATOM 28627 H2 WAT 9737 56.998 113.888 98.375 1.00 0.00 H TER 28629 WAT 9737 ATOM 28629 O WAT 9738 36.708 49.402 79.020 1.00 0.00 O ATOM 28630 H1 WAT 9738 37.231 50.194 79.148 1.00 0.00 H ATOM 28631 H2 WAT 9738 35.817 49.723 78.883 1.00 0.00 H TER 28633 WAT 9738 ATOM 28633 O WAT 9739 32.011 110.130 154.015 1.00 0.00 O ATOM 28634 H1 WAT 9739 31.199 109.650 154.173 1.00 0.00 H ATOM 28635 H2 WAT 9739 32.680 109.632 154.486 1.00 0.00 H TER 28637 WAT 9739 ATOM 28637 O WAT 9740 5.892 25.411 128.045 1.00 0.00 O ATOM 28638 H1 WAT 9740 5.535 24.583 128.368 1.00 0.00 H ATOM 28639 H2 WAT 9740 6.299 25.812 128.813 1.00 0.00 H TER 28641 WAT 9740 ATOM 28641 O WAT 9741 63.356 40.429 112.541 1.00 0.00 O ATOM 28642 H1 WAT 9741 64.126 40.128 113.024 1.00 0.00 H ATOM 28643 H2 WAT 9741 63.398 39.961 111.707 1.00 0.00 H TER 28645 WAT 9741 ATOM 28645 O WAT 9742 31.459 3.495 141.616 1.00 0.00 O ATOM 28646 H1 WAT 9742 31.253 4.390 141.885 1.00 0.00 H ATOM 28647 H2 WAT 9742 31.358 3.502 140.664 1.00 0.00 H TER 28649 WAT 9742 ATOM 28649 O WAT 9743 111.778 96.873 90.927 1.00 0.00 O ATOM 28650 H1 WAT 9743 112.322 97.349 90.300 1.00 0.00 H ATOM 28651 H2 WAT 9743 111.766 95.974 90.600 1.00 0.00 H TER 28653 WAT 9743 ATOM 28653 O WAT 9744 96.538 51.256 148.121 1.00 0.00 O ATOM 28654 H1 WAT 9744 95.979 51.334 147.348 1.00 0.00 H ATOM 28655 H2 WAT 9744 96.957 50.401 148.029 1.00 0.00 H TER 28657 WAT 9744 ATOM 28657 O WAT 9745 86.342 129.782 85.312 1.00 0.00 O ATOM 28658 H1 WAT 9745 85.879 128.973 85.530 1.00 0.00 H ATOM 28659 H2 WAT 9745 85.678 130.333 84.898 1.00 0.00 H TER 28661 WAT 9745 ATOM 28661 O WAT 9746 110.588 73.117 23.135 1.00 0.00 O ATOM 28662 H1 WAT 9746 110.109 73.599 22.460 1.00 0.00 H ATOM 28663 H2 WAT 9746 111.499 73.137 22.842 1.00 0.00 H TER 28665 WAT 9746 ATOM 28665 O WAT 9747 59.682 24.762 4.965 1.00 0.00 O ATOM 28666 H1 WAT 9747 59.965 24.096 5.592 1.00 0.00 H ATOM 28667 H2 WAT 9747 60.428 25.358 4.897 1.00 0.00 H TER 28669 WAT 9747 ATOM 28669 O WAT 9748 64.846 103.898 136.779 1.00 0.00 O ATOM 28670 H1 WAT 9748 63.904 103.729 136.789 1.00 0.00 H ATOM 28671 H2 WAT 9748 64.925 104.824 137.008 1.00 0.00 H TER 28673 WAT 9748 ATOM 28673 O WAT 9749 143.619 138.285 107.262 1.00 0.00 O ATOM 28674 H1 WAT 9749 143.014 137.928 106.612 1.00 0.00 H ATOM 28675 H2 WAT 9749 144.465 137.894 107.043 1.00 0.00 H TER 28677 WAT 9749 ATOM 28677 O WAT 9750 109.188 2.853 108.558 1.00 0.00 O ATOM 28678 H1 WAT 9750 108.801 2.727 107.691 1.00 0.00 H ATOM 28679 H2 WAT 9750 110.028 2.397 108.514 1.00 0.00 H TER 28681 WAT 9750 ATOM 28681 O WAT 9751 77.095 49.099 83.525 1.00 0.00 O ATOM 28682 H1 WAT 9751 77.270 49.678 82.783 1.00 0.00 H ATOM 28683 H2 WAT 9751 76.417 49.551 84.027 1.00 0.00 H TER 28685 WAT 9751 ATOM 28685 O WAT 9752 109.368 7.221 66.283 1.00 0.00 O ATOM 28686 H1 WAT 9752 109.882 6.497 66.641 1.00 0.00 H ATOM 28687 H2 WAT 9752 109.917 7.583 65.587 1.00 0.00 H TER 28689 WAT 9752 ATOM 28689 O WAT 9753 49.648 125.203 131.680 1.00 0.00 O ATOM 28690 H1 WAT 9753 49.918 124.345 131.353 1.00 0.00 H ATOM 28691 H2 WAT 9753 49.909 125.202 132.601 1.00 0.00 H TER 28693 WAT 9753 ATOM 28693 O WAT 9754 102.359 114.437 78.354 1.00 0.00 O ATOM 28694 H1 WAT 9754 103.113 114.752 77.855 1.00 0.00 H ATOM 28695 H2 WAT 9754 101.602 114.826 77.915 1.00 0.00 H TER 28697 WAT 9754 ATOM 28697 O WAT 9755 121.309 2.038 108.243 1.00 0.00 O ATOM 28698 H1 WAT 9755 122.252 2.171 108.145 1.00 0.00 H ATOM 28699 H2 WAT 9755 121.174 1.115 108.026 1.00 0.00 H TER 28701 WAT 9755 ATOM 28701 O WAT 9756 44.705 20.464 10.199 1.00 0.00 O ATOM 28702 H1 WAT 9756 45.587 20.181 9.957 1.00 0.00 H ATOM 28703 H2 WAT 9756 44.267 19.663 10.487 1.00 0.00 H TER 28705 WAT 9756 ATOM 28705 O WAT 9757 117.023 36.556 101.798 1.00 0.00 O ATOM 28706 H1 WAT 9757 117.662 35.849 101.891 1.00 0.00 H ATOM 28707 H2 WAT 9757 116.174 36.126 101.900 1.00 0.00 H TER 28709 WAT 9757 ATOM 28709 O WAT 9758 72.274 13.039 114.162 1.00 0.00 O ATOM 28710 H1 WAT 9758 71.642 13.480 114.730 1.00 0.00 H ATOM 28711 H2 WAT 9758 73.074 12.989 114.686 1.00 0.00 H TER 28713 WAT 9758 ATOM 28713 O WAT 9759 7.790 108.636 13.769 1.00 0.00 O ATOM 28714 H1 WAT 9759 7.056 108.861 14.339 1.00 0.00 H ATOM 28715 H2 WAT 9759 7.664 107.707 13.572 1.00 0.00 H TER 28717 WAT 9759 ATOM 28717 O WAT 9760 57.363 79.079 120.493 1.00 0.00 O ATOM 28718 H1 WAT 9760 57.947 78.333 120.355 1.00 0.00 H ATOM 28719 H2 WAT 9760 56.967 79.235 119.636 1.00 0.00 H TER 28721 WAT 9760 ATOM 28721 O WAT 9761 15.777 94.184 88.146 1.00 0.00 O ATOM 28722 H1 WAT 9761 14.947 94.661 88.169 1.00 0.00 H ATOM 28723 H2 WAT 9761 15.605 93.433 87.578 1.00 0.00 H TER 28725 WAT 9761 ATOM 28725 O WAT 9762 70.151 75.442 76.917 1.00 0.00 O ATOM 28726 H1 WAT 9762 69.332 75.393 76.424 1.00 0.00 H ATOM 28727 H2 WAT 9762 70.163 74.642 77.443 1.00 0.00 H TER 28729 WAT 9762 ATOM 28729 O WAT 9763 11.077 102.116 120.790 1.00 0.00 O ATOM 28730 H1 WAT 9763 11.818 101.778 120.287 1.00 0.00 H ATOM 28731 H2 WAT 9763 10.423 102.343 120.129 1.00 0.00 H TER 28733 WAT 9763 ATOM 28733 O WAT 9764 107.268 72.175 123.663 1.00 0.00 O ATOM 28734 H1 WAT 9764 107.582 72.745 124.366 1.00 0.00 H ATOM 28735 H2 WAT 9764 106.655 71.579 124.094 1.00 0.00 H TER 28737 WAT 9764 ATOM 28737 O WAT 9765 99.910 84.271 13.851 1.00 0.00 O ATOM 28738 H1 WAT 9765 100.038 84.366 14.795 1.00 0.00 H ATOM 28739 H2 WAT 9765 99.036 83.891 13.765 1.00 0.00 H TER 28741 WAT 9765 ATOM 28741 O WAT 9766 144.417 131.181 155.699 1.00 0.00 O ATOM 28742 H1 WAT 9766 145.213 130.739 155.403 1.00 0.00 H ATOM 28743 H2 WAT 9766 143.742 130.503 155.668 1.00 0.00 H TER 28745 WAT 9766 ATOM 28745 O WAT 9767 44.751 112.450 104.763 1.00 0.00 O ATOM 28746 H1 WAT 9767 44.427 112.319 105.654 1.00 0.00 H ATOM 28747 H2 WAT 9767 45.561 111.941 104.725 1.00 0.00 H TER 28749 WAT 9767 ATOM 28749 O WAT 9768 105.047 79.565 16.234 1.00 0.00 O ATOM 28750 H1 WAT 9768 104.695 80.202 15.612 1.00 0.00 H ATOM 28751 H2 WAT 9768 105.573 80.087 16.840 1.00 0.00 H TER 28753 WAT 9768 ATOM 28753 O WAT 9769 40.750 31.667 140.401 1.00 0.00 O ATOM 28754 H1 WAT 9769 40.430 31.044 141.053 1.00 0.00 H ATOM 28755 H2 WAT 9769 40.132 31.591 139.674 1.00 0.00 H TER 28757 WAT 9769 ATOM 28757 O WAT 9770 114.840 35.517 105.054 1.00 0.00 O ATOM 28758 H1 WAT 9770 115.570 35.781 105.615 1.00 0.00 H ATOM 28759 H2 WAT 9770 114.300 34.957 105.611 1.00 0.00 H TER 28761 WAT 9770 ATOM 28761 O WAT 9771 136.633 16.076 98.979 1.00 0.00 O ATOM 28762 H1 WAT 9771 136.026 16.665 99.428 1.00 0.00 H ATOM 28763 H2 WAT 9771 137.449 16.150 99.474 1.00 0.00 H TER 28765 WAT 9771 ATOM 28765 O WAT 9772 24.913 49.943 105.008 1.00 0.00 O ATOM 28766 H1 WAT 9772 25.709 50.425 105.232 1.00 0.00 H ATOM 28767 H2 WAT 9772 24.218 50.600 105.043 1.00 0.00 H TER 28769 WAT 9772 ATOM 28769 O WAT 9773 27.093 136.865 148.296 1.00 0.00 O ATOM 28770 H1 WAT 9773 27.055 137.095 147.367 1.00 0.00 H ATOM 28771 H2 WAT 9773 27.438 137.650 148.723 1.00 0.00 H TER 28773 WAT 9773 ATOM 28773 O WAT 9774 85.182 99.061 102.357 1.00 0.00 O ATOM 28774 H1 WAT 9774 84.235 98.951 102.278 1.00 0.00 H ATOM 28775 H2 WAT 9774 85.488 98.241 102.746 1.00 0.00 H TER 28777 WAT 9774 ATOM 28777 O WAT 9775 87.036 65.453 17.389 1.00 0.00 O ATOM 28778 H1 WAT 9775 87.035 66.175 18.018 1.00 0.00 H ATOM 28779 H2 WAT 9775 87.453 64.729 17.856 1.00 0.00 H TER 28781 WAT 9775 ATOM 28781 O WAT 9776 131.572 101.988 123.428 1.00 0.00 O ATOM 28782 H1 WAT 9776 131.327 102.023 122.503 1.00 0.00 H ATOM 28783 H2 WAT 9776 130.754 102.149 123.898 1.00 0.00 H TER 28785 WAT 9776 ATOM 28785 O WAT 9777 124.920 65.744 14.912 1.00 0.00 O ATOM 28786 H1 WAT 9777 124.044 65.478 15.189 1.00 0.00 H ATOM 28787 H2 WAT 9777 125.016 65.375 14.034 1.00 0.00 H TER 28789 WAT 9777 ATOM 28789 O WAT 9778 61.700 101.983 106.660 1.00 0.00 O ATOM 28790 H1 WAT 9778 61.094 101.631 107.311 1.00 0.00 H ATOM 28791 H2 WAT 9778 62.147 102.699 107.111 1.00 0.00 H TER 28793 WAT 9778 ATOM 28793 O WAT 9779 51.010 71.455 154.370 1.00 0.00 O ATOM 28794 H1 WAT 9779 50.464 70.670 154.334 1.00 0.00 H ATOM 28795 H2 WAT 9779 50.449 72.153 154.033 1.00 0.00 H TER 28797 WAT 9779 ATOM 28797 O WAT 9780 64.287 108.630 1.191 1.00 0.00 O ATOM 28798 H1 WAT 9780 63.583 108.023 0.962 1.00 0.00 H ATOM 28799 H2 WAT 9780 64.642 108.287 2.011 1.00 0.00 H TER 28801 WAT 9780 ATOM 28801 O WAT 9781 26.775 30.786 86.223 1.00 0.00 O ATOM 28802 H1 WAT 9781 27.628 30.475 86.527 1.00 0.00 H ATOM 28803 H2 WAT 9781 26.209 30.724 86.992 1.00 0.00 H TER 28805 WAT 9781 ATOM 28805 O WAT 9782 121.314 58.229 20.676 1.00 0.00 O ATOM 28806 H1 WAT 9782 121.027 57.384 21.021 1.00 0.00 H ATOM 28807 H2 WAT 9782 122.030 58.494 21.254 1.00 0.00 H TER 28809 WAT 9782 ATOM 28809 O WAT 9783 117.461 127.229 137.009 1.00 0.00 O ATOM 28810 H1 WAT 9783 117.392 127.835 137.746 1.00 0.00 H ATOM 28811 H2 WAT 9783 116.584 126.856 136.922 1.00 0.00 H TER 28813 WAT 9783 ATOM 28813 O WAT 9784 32.849 48.978 120.565 1.00 0.00 O ATOM 28814 H1 WAT 9784 33.074 49.322 121.430 1.00 0.00 H ATOM 28815 H2 WAT 9784 33.678 48.656 120.212 1.00 0.00 H TER 28817 WAT 9784 ATOM 28817 O WAT 9785 38.313 8.537 8.740 1.00 0.00 O ATOM 28818 H1 WAT 9785 39.201 8.456 9.088 1.00 0.00 H ATOM 28819 H2 WAT 9785 38.197 9.476 8.594 1.00 0.00 H TER 28821 WAT 9785 ATOM 28821 O WAT 9786 21.814 39.742 141.242 1.00 0.00 O ATOM 28822 H1 WAT 9786 22.241 39.143 140.629 1.00 0.00 H ATOM 28823 H2 WAT 9786 22.495 40.373 141.473 1.00 0.00 H TER 28825 WAT 9786 ATOM 28825 O WAT 9787 64.688 68.478 104.419 1.00 0.00 O ATOM 28826 H1 WAT 9787 64.271 69.106 105.009 1.00 0.00 H ATOM 28827 H2 WAT 9787 64.784 67.684 104.945 1.00 0.00 H TER 28829 WAT 9787 ATOM 28829 O WAT 9788 139.799 22.060 100.970 1.00 0.00 O ATOM 28830 H1 WAT 9788 138.924 21.946 100.599 1.00 0.00 H ATOM 28831 H2 WAT 9788 140.326 22.390 100.242 1.00 0.00 H TER 28833 WAT 9788 ATOM 28833 O WAT 9789 95.890 0.675 101.754 1.00 0.00 O ATOM 28834 H1 WAT 9789 96.265 1.546 101.623 1.00 0.00 H ATOM 28835 H2 WAT 9789 96.494 0.242 102.357 1.00 0.00 H TER 28837 WAT 9789 ATOM 28837 O WAT 9790 85.154 16.406 78.240 1.00 0.00 O ATOM 28838 H1 WAT 9790 84.658 15.849 77.640 1.00 0.00 H ATOM 28839 H2 WAT 9790 85.227 17.244 77.784 1.00 0.00 H TER 28841 WAT 9790 ATOM 28841 O WAT 9791 27.263 4.595 126.444 1.00 0.00 O ATOM 28842 H1 WAT 9791 26.723 5.207 125.944 1.00 0.00 H ATOM 28843 H2 WAT 9791 28.148 4.720 126.101 1.00 0.00 H TER 28845 WAT 9791 ATOM 28845 O WAT 9792 30.355 71.059 20.706 1.00 0.00 O ATOM 28846 H1 WAT 9792 29.706 70.711 21.317 1.00 0.00 H ATOM 28847 H2 WAT 9792 31.127 71.226 21.246 1.00 0.00 H TER 28849 WAT 9792 ATOM 28849 O WAT 9793 125.800 77.572 9.995 1.00 0.00 O ATOM 28850 H1 WAT 9793 126.092 76.676 9.830 1.00 0.00 H ATOM 28851 H2 WAT 9793 125.625 77.597 10.936 1.00 0.00 H TER 28853 WAT 9793 ATOM 28853 O WAT 9794 113.300 98.113 84.586 1.00 0.00 O ATOM 28854 H1 WAT 9794 113.756 98.905 84.871 1.00 0.00 H ATOM 28855 H2 WAT 9794 112.386 98.264 84.825 1.00 0.00 H TER 28857 WAT 9794 ATOM 28857 O WAT 9795 22.273 120.795 105.690 1.00 0.00 O ATOM 28858 H1 WAT 9795 21.788 119.973 105.769 1.00 0.00 H ATOM 28859 H2 WAT 9795 21.723 121.344 105.131 1.00 0.00 H TER 28861 WAT 9795 ATOM 28861 O WAT 9796 20.819 54.661 156.463 1.00 0.00 O ATOM 28862 H1 WAT 9796 20.812 54.721 155.508 1.00 0.00 H ATOM 28863 H2 WAT 9796 21.697 54.344 156.677 1.00 0.00 H TER 28865 WAT 9796 ATOM 28865 O WAT 9797 97.408 112.548 129.135 1.00 0.00 O ATOM 28866 H1 WAT 9797 96.704 112.009 128.775 1.00 0.00 H ATOM 28867 H2 WAT 9797 97.525 113.249 128.494 1.00 0.00 H TER 28869 WAT 9797 ATOM 28869 O WAT 9798 68.428 92.358 1.192 1.00 0.00 O ATOM 28870 H1 WAT 9798 68.494 93.313 1.216 1.00 0.00 H ATOM 28871 H2 WAT 9798 68.404 92.096 2.112 1.00 0.00 H TER 28873 WAT 9798 ATOM 28873 O WAT 9799 25.154 115.605 132.054 1.00 0.00 O ATOM 28874 H1 WAT 9799 25.342 115.055 131.294 1.00 0.00 H ATOM 28875 H2 WAT 9799 24.686 115.029 132.658 1.00 0.00 H TER 28877 WAT 9799 ATOM 28877 O WAT 9800 16.350 81.214 101.771 1.00 0.00 O ATOM 28878 H1 WAT 9800 16.663 81.907 102.353 1.00 0.00 H ATOM 28879 H2 WAT 9800 17.029 80.541 101.813 1.00 0.00 H TER 28881 WAT 9800 ATOM 28881 O WAT 9801 132.275 93.132 130.906 1.00 0.00 O ATOM 28882 H1 WAT 9801 131.533 93.174 131.509 1.00 0.00 H ATOM 28883 H2 WAT 9801 131.876 93.111 130.036 1.00 0.00 H TER 28885 WAT 9801 ATOM 28885 O WAT 9802 24.929 73.177 98.661 1.00 0.00 O ATOM 28886 H1 WAT 9802 25.350 72.378 98.977 1.00 0.00 H ATOM 28887 H2 WAT 9802 25.270 73.293 97.774 1.00 0.00 H TER 28889 WAT 9802 ATOM 28889 O WAT 9803 48.957 33.363 26.482 1.00 0.00 O ATOM 28890 H1 WAT 9803 48.091 33.676 26.220 1.00 0.00 H ATOM 28891 H2 WAT 9803 49.461 34.160 26.644 1.00 0.00 H TER 28893 WAT 9803 ATOM 28893 O WAT 9804 1.029 80.868 148.344 1.00 0.00 O ATOM 28894 H1 WAT 9804 1.861 81.089 147.924 1.00 0.00 H ATOM 28895 H2 WAT 9804 0.378 81.392 147.876 1.00 0.00 H TER 28897 WAT 9804 ATOM 28897 O WAT 9805 63.527 11.498 107.595 1.00 0.00 O ATOM 28898 H1 WAT 9805 62.865 10.977 108.047 1.00 0.00 H ATOM 28899 H2 WAT 9805 63.484 12.358 108.014 1.00 0.00 H TER 28901 WAT 9805 ATOM 28901 O WAT 9806 89.598 114.555 146.352 1.00 0.00 O ATOM 28902 H1 WAT 9806 90.342 115.129 146.167 1.00 0.00 H ATOM 28903 H2 WAT 9806 89.419 114.689 147.283 1.00 0.00 H TER 28905 WAT 9806 ATOM 28905 O WAT 9807 9.421 142.915 115.179 1.00 0.00 O ATOM 28906 H1 WAT 9807 9.741 143.681 114.703 1.00 0.00 H ATOM 28907 H2 WAT 9807 10.026 142.214 114.939 1.00 0.00 H TER 28909 WAT 9807 ATOM 28909 O WAT 9808 29.895 84.826 132.853 1.00 0.00 O ATOM 28910 H1 WAT 9808 29.035 84.447 132.674 1.00 0.00 H ATOM 28911 H2 WAT 9808 30.067 84.608 133.769 1.00 0.00 H TER 28913 WAT 9808 ATOM 28913 O WAT 9809 75.819 125.905 9.351 1.00 0.00 O ATOM 28914 H1 WAT 9809 75.306 125.350 9.938 1.00 0.00 H ATOM 28915 H2 WAT 9809 75.234 126.633 9.139 1.00 0.00 H TER 28917 WAT 9809 ATOM 28917 O WAT 9810 67.191 27.825 86.604 1.00 0.00 O ATOM 28918 H1 WAT 9810 67.433 27.231 87.314 1.00 0.00 H ATOM 28919 H2 WAT 9810 66.317 27.539 86.339 1.00 0.00 H TER 28921 WAT 9810 ATOM 28921 O WAT 9811 81.497 84.955 59.282 1.00 0.00 O ATOM 28922 H1 WAT 9811 81.100 84.136 58.987 1.00 0.00 H ATOM 28923 H2 WAT 9811 80.932 85.639 58.923 1.00 0.00 H TER 28925 WAT 9811 ATOM 28925 O WAT 9812 2.238 142.308 97.649 1.00 0.00 O ATOM 28926 H1 WAT 9812 2.766 141.756 97.073 1.00 0.00 H ATOM 28927 H2 WAT 9812 1.966 141.724 98.357 1.00 0.00 H TER 28929 WAT 9812 ATOM 28929 O WAT 9813 99.317 20.055 99.937 1.00 0.00 O ATOM 28930 H1 WAT 9813 99.502 19.987 100.874 1.00 0.00 H ATOM 28931 H2 WAT 9813 98.916 19.216 99.711 1.00 0.00 H TER 28933 WAT 9813 ATOM 28933 O WAT 9814 15.444 17.932 91.051 1.00 0.00 O ATOM 28934 H1 WAT 9814 16.381 17.938 90.860 1.00 0.00 H ATOM 28935 H2 WAT 9814 15.166 18.838 90.918 1.00 0.00 H TER 28937 WAT 9814 ATOM 28937 O WAT 9815 122.686 107.775 82.434 1.00 0.00 O ATOM 28938 H1 WAT 9815 123.401 108.274 82.039 1.00 0.00 H ATOM 28939 H2 WAT 9815 122.120 107.542 81.697 1.00 0.00 H TER 28941 WAT 9815 ATOM 28941 O WAT 9816 111.898 138.742 138.363 1.00 0.00 O ATOM 28942 H1 WAT 9816 112.044 139.159 139.213 1.00 0.00 H ATOM 28943 H2 WAT 9816 112.713 138.272 138.184 1.00 0.00 H TER 28945 WAT 9816 ATOM 28945 O WAT 9817 98.455 0.853 13.725 1.00 0.00 O ATOM 28946 H1 WAT 9817 99.196 1.447 13.606 1.00 0.00 H ATOM 28947 H2 WAT 9817 98.832 -0.022 13.631 1.00 0.00 H TER 28949 WAT 9817 ATOM 28949 O WAT 9818 115.013 113.989 146.131 1.00 0.00 O ATOM 28950 H1 WAT 9818 115.002 113.816 147.073 1.00 0.00 H ATOM 28951 H2 WAT 9818 114.242 113.534 145.795 1.00 0.00 H TER 28953 WAT 9818 ATOM 28953 O WAT 9819 13.015 105.272 61.574 1.00 0.00 O ATOM 28954 H1 WAT 9819 13.732 105.875 61.380 1.00 0.00 H ATOM 28955 H2 WAT 9819 12.315 105.831 61.909 1.00 0.00 H TER 28957 WAT 9819 ATOM 28957 O WAT 9820 1.174 110.390 111.592 1.00 0.00 O ATOM 28958 H1 WAT 9820 1.072 109.994 112.458 1.00 0.00 H ATOM 28959 H2 WAT 9820 0.635 109.848 111.016 1.00 0.00 H TER 28961 WAT 9820 ATOM 28961 O WAT 9821 106.347 45.855 91.178 1.00 0.00 O ATOM 28962 H1 WAT 9821 106.939 45.767 91.924 1.00 0.00 H ATOM 28963 H2 WAT 9821 106.631 46.657 90.739 1.00 0.00 H TER 28965 WAT 9821 ATOM 28965 O WAT 9822 91.338 67.469 62.638 1.00 0.00 O ATOM 28966 H1 WAT 9822 91.694 68.194 62.123 1.00 0.00 H ATOM 28967 H2 WAT 9822 90.676 67.075 62.070 1.00 0.00 H TER 28969 WAT 9822 ATOM 28969 O WAT 9823 118.062 137.169 144.133 1.00 0.00 O ATOM 28970 H1 WAT 9823 117.618 136.597 144.758 1.00 0.00 H ATOM 28971 H2 WAT 9823 117.830 138.055 144.411 1.00 0.00 H TER 28973 WAT 9823 ATOM 28973 O WAT 9824 66.150 65.580 119.983 1.00 0.00 O ATOM 28974 H1 WAT 9824 65.742 66.333 119.556 1.00 0.00 H ATOM 28975 H2 WAT 9824 65.491 64.888 119.927 1.00 0.00 H TER 28977 WAT 9824 ATOM 28977 O WAT 9825 63.869 98.958 90.065 1.00 0.00 O ATOM 28978 H1 WAT 9825 64.121 99.629 90.699 1.00 0.00 H ATOM 28979 H2 WAT 9825 62.914 99.011 90.027 1.00 0.00 H TER 28981 WAT 9825 ATOM 28981 O WAT 9826 17.041 11.888 145.443 1.00 0.00 O ATOM 28982 H1 WAT 9826 16.869 11.785 146.379 1.00 0.00 H ATOM 28983 H2 WAT 9826 17.784 11.310 145.271 1.00 0.00 H TER 28985 WAT 9826 ATOM 28985 O WAT 9827 70.281 116.101 105.886 1.00 0.00 O ATOM 28986 H1 WAT 9827 70.413 115.153 105.871 1.00 0.00 H ATOM 28987 H2 WAT 9827 69.438 116.232 105.453 1.00 0.00 H TER 28989 WAT 9827 ATOM 28989 O WAT 9828 48.420 83.523 76.064 1.00 0.00 O ATOM 28990 H1 WAT 9828 48.887 83.105 75.340 1.00 0.00 H ATOM 28991 H2 WAT 9828 48.771 84.413 76.092 1.00 0.00 H TER 28993 WAT 9828 ATOM 28993 O WAT 9829 19.309 45.309 143.879 1.00 0.00 O ATOM 28994 H1 WAT 9829 19.269 44.355 143.815 1.00 0.00 H ATOM 28995 H2 WAT 9829 18.399 45.578 144.011 1.00 0.00 H TER 28997 WAT 9829 ATOM 28997 O WAT 9830 27.321 26.405 92.407 1.00 0.00 O ATOM 28998 H1 WAT 9830 27.992 26.819 91.866 1.00 0.00 H ATOM 28999 H2 WAT 9830 27.484 25.466 92.314 1.00 0.00 H TER 29001 WAT 9830 ATOM 29001 O WAT 9831 126.295 77.942 65.845 1.00 0.00 O ATOM 29002 H1 WAT 9831 127.094 77.430 65.973 1.00 0.00 H ATOM 29003 H2 WAT 9831 126.430 78.392 65.011 1.00 0.00 H TER 29005 WAT 9831 ATOM 29005 O WAT 9832 145.739 85.736 5.723 1.00 0.00 O ATOM 29006 H1 WAT 9832 145.580 85.459 4.820 1.00 0.00 H ATOM 29007 H2 WAT 9832 145.401 85.017 6.256 1.00 0.00 H TER 29009 WAT 9832 ATOM 29009 O WAT 9833 73.915 81.529 125.545 1.00 0.00 O ATOM 29010 H1 WAT 9833 74.213 80.782 125.026 1.00 0.00 H ATOM 29011 H2 WAT 9833 72.991 81.627 125.315 1.00 0.00 H TER 29013 WAT 9833 ATOM 29013 O WAT 9834 53.617 67.150 79.892 1.00 0.00 O ATOM 29014 H1 WAT 9834 54.535 67.395 80.004 1.00 0.00 H ATOM 29015 H2 WAT 9834 53.177 67.513 80.661 1.00 0.00 H TER 29017 WAT 9834 ATOM 29017 O WAT 9835 129.712 111.531 117.659 1.00 0.00 O ATOM 29018 H1 WAT 9835 129.970 111.415 116.744 1.00 0.00 H ATOM 29019 H2 WAT 9835 129.784 112.474 117.810 1.00 0.00 H TER 29021 WAT 9835 ATOM 29021 O WAT 9836 47.240 61.018 146.021 1.00 0.00 O ATOM 29022 H1 WAT 9836 47.089 60.866 145.089 1.00 0.00 H ATOM 29023 H2 WAT 9836 47.889 60.359 146.269 1.00 0.00 H TER 29025 WAT 9836 ATOM 29025 O WAT 9837 32.365 33.246 75.604 1.00 0.00 O ATOM 29026 H1 WAT 9837 32.887 33.736 74.968 1.00 0.00 H ATOM 29027 H2 WAT 9837 31.803 32.684 75.070 1.00 0.00 H TER 29029 WAT 9837 ATOM 29029 O WAT 9838 65.467 35.056 102.353 1.00 0.00 O ATOM 29030 H1 WAT 9838 65.644 34.763 103.247 1.00 0.00 H ATOM 29031 H2 WAT 9838 66.118 34.601 101.819 1.00 0.00 H TER 29033 WAT 9838 ATOM 29033 O WAT 9839 44.911 15.671 61.578 1.00 0.00 O ATOM 29034 H1 WAT 9839 45.667 15.197 61.926 1.00 0.00 H ATOM 29035 H2 WAT 9839 44.614 15.138 60.840 1.00 0.00 H TER 29037 WAT 9839 ATOM 29037 O WAT 9840 46.078 99.530 98.899 1.00 0.00 O ATOM 29038 H1 WAT 9840 45.583 100.344 98.806 1.00 0.00 H ATOM 29039 H2 WAT 9840 45.489 98.852 98.569 1.00 0.00 H TER 29041 WAT 9840 ATOM 29041 O WAT 9841 82.502 25.883 103.482 1.00 0.00 O ATOM 29042 H1 WAT 9841 82.968 26.662 103.179 1.00 0.00 H ATOM 29043 H2 WAT 9841 81.734 25.828 102.914 1.00 0.00 H TER 29045 WAT 9841 ATOM 29045 O WAT 9842 7.802 123.950 156.604 1.00 0.00 O ATOM 29046 H1 WAT 9842 7.355 124.523 155.981 1.00 0.00 H ATOM 29047 H2 WAT 9842 8.285 123.331 156.057 1.00 0.00 H TER 29049 WAT 9842 ATOM 29049 O WAT 9843 73.825 141.468 116.917 1.00 0.00 O ATOM 29050 H1 WAT 9843 73.116 141.214 117.508 1.00 0.00 H ATOM 29051 H2 WAT 9843 73.630 141.013 116.098 1.00 0.00 H TER 29053 WAT 9843 ATOM 29053 O WAT 9844 136.900 95.840 8.769 1.00 0.00 O ATOM 29054 H1 WAT 9844 137.255 95.824 7.881 1.00 0.00 H ATOM 29055 H2 WAT 9844 137.584 96.257 9.293 1.00 0.00 H TER 29057 WAT 9844 ATOM 29057 O WAT 9845 17.401 47.064 141.739 1.00 0.00 O ATOM 29058 H1 WAT 9845 17.095 47.967 141.650 1.00 0.00 H ATOM 29059 H2 WAT 9845 18.252 47.055 141.302 1.00 0.00 H TER 29061 WAT 9845 ATOM 29061 O WAT 9846 22.826 73.108 88.790 1.00 0.00 O ATOM 29062 H1 WAT 9846 22.078 73.700 88.718 1.00 0.00 H ATOM 29063 H2 WAT 9846 22.602 72.526 89.517 1.00 0.00 H TER 29065 WAT 9846 ATOM 29065 O WAT 9847 25.677 83.485 73.324 1.00 0.00 O ATOM 29066 H1 WAT 9847 25.182 83.014 72.653 1.00 0.00 H ATOM 29067 H2 WAT 9847 25.631 84.403 73.055 1.00 0.00 H TER 29069 WAT 9847 ATOM 29069 O WAT 9848 38.861 141.875 112.864 1.00 0.00 O ATOM 29070 H1 WAT 9848 39.473 142.365 113.412 1.00 0.00 H ATOM 29071 H2 WAT 9848 39.130 140.961 112.961 1.00 0.00 H TER 29073 WAT 9848 ATOM 29073 O WAT 9849 69.709 84.891 151.491 1.00 0.00 O ATOM 29074 H1 WAT 9849 69.722 85.671 150.936 1.00 0.00 H ATOM 29075 H2 WAT 9849 69.112 85.114 152.205 1.00 0.00 H TER 29077 WAT 9849 ATOM 29077 O WAT 9850 32.647 59.060 126.224 1.00 0.00 O ATOM 29078 H1 WAT 9850 33.443 58.739 125.800 1.00 0.00 H ATOM 29079 H2 WAT 9850 32.003 59.108 125.518 1.00 0.00 H TER 29081 WAT 9850 ATOM 29081 O WAT 9851 86.707 75.277 60.150 1.00 0.00 O ATOM 29082 H1 WAT 9851 87.586 75.326 59.774 1.00 0.00 H ATOM 29083 H2 WAT 9851 86.151 74.993 59.425 1.00 0.00 H TER 29085 WAT 9851 ATOM 29085 O WAT 9852 108.127 2.029 97.782 1.00 0.00 O ATOM 29086 H1 WAT 9852 107.425 1.888 97.147 1.00 0.00 H ATOM 29087 H2 WAT 9852 107.756 1.744 98.617 1.00 0.00 H TER 29089 WAT 9852 ATOM 29089 O WAT 9853 48.604 70.449 22.300 1.00 0.00 O ATOM 29090 H1 WAT 9853 49.080 70.497 23.130 1.00 0.00 H ATOM 29091 H2 WAT 9853 47.697 70.649 22.532 1.00 0.00 H TER 29093 WAT 9853 ATOM 29093 O WAT 9854 53.194 128.814 152.482 1.00 0.00 O ATOM 29094 H1 WAT 9854 53.943 129.352 152.738 1.00 0.00 H ATOM 29095 H2 WAT 9854 52.824 128.510 153.311 1.00 0.00 H TER 29097 WAT 9854 ATOM 29097 O WAT 9855 91.297 143.876 70.476 1.00 0.00 O ATOM 29098 H1 WAT 9855 90.990 143.265 71.145 1.00 0.00 H ATOM 29099 H2 WAT 9855 91.031 144.738 70.797 1.00 0.00 H TER 29101 WAT 9855 ATOM 29101 O WAT 9856 112.865 55.864 120.926 1.00 0.00 O ATOM 29102 H1 WAT 9856 113.003 55.349 121.721 1.00 0.00 H ATOM 29103 H2 WAT 9856 111.987 55.619 120.633 1.00 0.00 H TER 29105 WAT 9856 ATOM 29105 O WAT 9857 9.687 53.637 153.828 1.00 0.00 O ATOM 29106 H1 WAT 9857 8.821 53.274 153.640 1.00 0.00 H ATOM 29107 H2 WAT 9857 10.022 53.098 154.544 1.00 0.00 H TER 29109 WAT 9857 ATOM 29109 O WAT 9858 121.811 99.560 137.362 1.00 0.00 O ATOM 29110 H1 WAT 9858 122.703 99.578 137.707 1.00 0.00 H ATOM 29111 H2 WAT 9858 121.872 99.025 136.570 1.00 0.00 H TER 29113 WAT 9858 ATOM 29113 O WAT 9859 40.107 21.359 127.649 1.00 0.00 O ATOM 29114 H1 WAT 9859 39.546 20.585 127.683 1.00 0.00 H ATOM 29115 H2 WAT 9859 40.826 21.160 128.249 1.00 0.00 H TER 29117 WAT 9859 ATOM 29117 O WAT 9860 133.262 29.788 2.028 1.00 0.00 O ATOM 29118 H1 WAT 9860 133.542 30.633 2.379 1.00 0.00 H ATOM 29119 H2 WAT 9860 134.065 29.390 1.692 1.00 0.00 H TER 29121 WAT 9860 ATOM 29121 O WAT 9861 0.402 117.986 156.431 1.00 0.00 O ATOM 29122 H1 WAT 9861 -0.236 118.699 156.463 1.00 0.00 H ATOM 29123 H2 WAT 9861 0.881 118.129 155.615 1.00 0.00 H TER 29125 WAT 9861 ATOM 29125 O WAT 9862 56.845 60.713 113.362 1.00 0.00 O ATOM 29126 H1 WAT 9862 56.188 60.213 112.878 1.00 0.00 H ATOM 29127 H2 WAT 9862 56.946 60.240 114.188 1.00 0.00 H TER 29129 WAT 9862 ATOM 29129 O WAT 9863 38.097 75.796 12.655 1.00 0.00 O ATOM 29130 H1 WAT 9863 37.605 75.034 12.348 1.00 0.00 H ATOM 29131 H2 WAT 9863 37.698 76.015 13.497 1.00 0.00 H TER 29133 WAT 9863 ATOM 29133 O WAT 9864 116.606 145.391 126.107 1.00 0.00 O ATOM 29134 H1 WAT 9864 115.939 146.054 125.928 1.00 0.00 H ATOM 29135 H2 WAT 9864 116.823 145.031 125.247 1.00 0.00 H TER 29137 WAT 9864 ATOM 29137 O WAT 9865 33.672 24.053 119.501 1.00 0.00 O ATOM 29138 H1 WAT 9865 33.563 24.704 118.808 1.00 0.00 H ATOM 29139 H2 WAT 9865 34.146 24.515 120.193 1.00 0.00 H TER 29141 WAT 9865 ATOM 29141 O WAT 9866 131.207 122.716 100.721 1.00 0.00 O ATOM 29142 H1 WAT 9866 130.426 123.269 100.726 1.00 0.00 H ATOM 29143 H2 WAT 9866 130.878 121.836 100.902 1.00 0.00 H TER 29145 WAT 9866 ATOM 29145 O WAT 9867 112.143 65.654 74.410 1.00 0.00 O ATOM 29146 H1 WAT 9867 112.138 66.251 75.158 1.00 0.00 H ATOM 29147 H2 WAT 9867 111.364 65.895 73.908 1.00 0.00 H TER 29149 WAT 9867 ATOM 29149 O WAT 9868 17.140 129.602 158.022 1.00 0.00 O ATOM 29150 H1 WAT 9868 17.497 130.110 157.294 1.00 0.00 H ATOM 29151 H2 WAT 9868 17.612 128.769 157.988 1.00 0.00 H TER 29153 WAT 9868 ATOM 29153 O WAT 9869 143.530 119.704 94.139 1.00 0.00 O ATOM 29154 H1 WAT 9869 144.263 120.123 93.686 1.00 0.00 H ATOM 29155 H2 WAT 9869 143.509 118.814 93.788 1.00 0.00 H TER 29157 WAT 9869 ATOM 29157 O WAT 9870 69.618 109.534 68.133 1.00 0.00 O ATOM 29158 H1 WAT 9870 68.982 109.608 67.422 1.00 0.00 H ATOM 29159 H2 WAT 9870 69.819 110.440 68.369 1.00 0.00 H TER 29161 WAT 9870 ATOM 29161 O WAT 9871 7.451 136.397 157.988 1.00 0.00 O ATOM 29162 H1 WAT 9871 6.829 135.716 157.732 1.00 0.00 H ATOM 29163 H2 WAT 9871 6.905 137.157 158.187 1.00 0.00 H TER 29165 WAT 9871 ATOM 29165 O WAT 9872 101.427 131.198 143.485 1.00 0.00 O ATOM 29166 H1 WAT 9872 101.648 132.129 143.456 1.00 0.00 H ATOM 29167 H2 WAT 9872 102.210 130.756 143.158 1.00 0.00 H TER 29169 WAT 9872 ATOM 29169 O WAT 9873 115.960 32.886 94.361 1.00 0.00 O ATOM 29170 H1 WAT 9873 116.455 32.197 93.919 1.00 0.00 H ATOM 29171 H2 WAT 9873 115.169 32.448 94.676 1.00 0.00 H TER 29173 WAT 9873 ATOM 29173 O WAT 9874 99.230 34.257 10.184 1.00 0.00 O ATOM 29174 H1 WAT 9874 99.022 33.410 10.579 1.00 0.00 H ATOM 29175 H2 WAT 9874 98.408 34.547 9.789 1.00 0.00 H TER 29177 WAT 9874 ATOM 29177 O WAT 9875 76.751 124.075 78.050 1.00 0.00 O ATOM 29178 H1 WAT 9875 76.490 123.279 77.586 1.00 0.00 H ATOM 29179 H2 WAT 9875 77.018 123.770 78.917 1.00 0.00 H TER 29181 WAT 9875 ATOM 29181 O WAT 9876 130.048 84.782 127.808 1.00 0.00 O ATOM 29182 H1 WAT 9876 129.281 84.332 128.162 1.00 0.00 H ATOM 29183 H2 WAT 9876 129.993 84.641 126.863 1.00 0.00 H TER 29185 WAT 9876 ATOM 29185 O WAT 9877 12.100 106.641 86.196 1.00 0.00 O ATOM 29186 H1 WAT 9877 12.404 107.509 85.929 1.00 0.00 H ATOM 29187 H2 WAT 9877 12.809 106.296 86.740 1.00 0.00 H TER 29189 WAT 9877 ATOM 29189 O WAT 9878 135.340 0.315 77.405 1.00 0.00 O ATOM 29190 H1 WAT 9878 134.631 -0.262 77.687 1.00 0.00 H ATOM 29191 H2 WAT 9878 135.669 -0.084 76.600 1.00 0.00 H TER 29193 WAT 9878 ATOM 29193 O WAT 9879 127.212 84.048 128.383 1.00 0.00 O ATOM 29194 H1 WAT 9879 126.841 83.553 127.653 1.00 0.00 H ATOM 29195 H2 WAT 9879 126.665 84.831 128.445 1.00 0.00 H TER 29197 WAT 9879 ATOM 29197 O WAT 9880 125.992 25.966 148.239 1.00 0.00 O ATOM 29198 H1 WAT 9880 126.365 26.815 148.474 1.00 0.00 H ATOM 29199 H2 WAT 9880 125.185 26.179 147.770 1.00 0.00 H TER 29201 WAT 9880 ATOM 29201 O WAT 9881 55.170 18.423 127.053 1.00 0.00 O ATOM 29202 H1 WAT 9881 54.855 19.041 126.393 1.00 0.00 H ATOM 29203 H2 WAT 9881 56.120 18.538 127.056 1.00 0.00 H TER 29205 WAT 9881 ATOM 29205 O WAT 9882 15.945 6.292 67.563 1.00 0.00 O ATOM 29206 H1 WAT 9882 16.412 5.489 67.796 1.00 0.00 H ATOM 29207 H2 WAT 9882 15.077 6.186 67.952 1.00 0.00 H TER 29209 WAT 9882 ATOM 29209 O WAT 9883 29.148 88.916 125.718 1.00 0.00 O ATOM 29210 H1 WAT 9883 29.336 89.716 125.227 1.00 0.00 H ATOM 29211 H2 WAT 9883 30.005 88.511 125.853 1.00 0.00 H TER 29213 WAT 9883 ATOM 29213 O WAT 9884 0.148 97.395 99.047 1.00 0.00 O ATOM 29214 H1 WAT 9884 -0.233 98.254 98.865 1.00 0.00 H ATOM 29215 H2 WAT 9884 0.963 97.587 99.510 1.00 0.00 H TER 29217 WAT 9884 ATOM 29217 O WAT 9885 63.745 122.419 70.750 1.00 0.00 O ATOM 29218 H1 WAT 9885 64.038 123.330 70.772 1.00 0.00 H ATOM 29219 H2 WAT 9885 64.507 121.929 70.443 1.00 0.00 H TER 29221 WAT 9885 ATOM 29221 O WAT 9886 130.014 19.998 71.222 1.00 0.00 O ATOM 29222 H1 WAT 9886 130.410 20.719 70.733 1.00 0.00 H ATOM 29223 H2 WAT 9886 129.190 20.357 71.551 1.00 0.00 H TER 29225 WAT 9886 ATOM 29225 O WAT 9887 20.192 51.227 133.835 1.00 0.00 O ATOM 29226 H1 WAT 9887 20.671 50.420 133.645 1.00 0.00 H ATOM 29227 H2 WAT 9887 20.840 51.800 134.245 1.00 0.00 H TER 29229 WAT 9887 ATOM 29229 O WAT 9888 118.175 8.484 10.702 1.00 0.00 O ATOM 29230 H1 WAT 9888 117.283 8.321 11.009 1.00 0.00 H ATOM 29231 H2 WAT 9888 118.379 7.729 10.150 1.00 0.00 H TER 29233 WAT 9888 ATOM 29233 O WAT 9889 103.594 57.847 158.193 1.00 0.00 O ATOM 29234 H1 WAT 9889 103.038 58.370 157.615 1.00 0.00 H ATOM 29235 H2 WAT 9889 104.462 57.888 157.790 1.00 0.00 H TER 29237 WAT 9889 ATOM 29237 O WAT 9890 98.730 26.593 149.963 1.00 0.00 O ATOM 29238 H1 WAT 9890 99.309 26.968 149.300 1.00 0.00 H ATOM 29239 H2 WAT 9890 99.188 25.809 150.265 1.00 0.00 H TER 29241 WAT 9890 ATOM 29241 O WAT 9891 85.547 24.015 87.965 1.00 0.00 O ATOM 29242 H1 WAT 9891 85.248 24.919 88.066 1.00 0.00 H ATOM 29243 H2 WAT 9891 86.230 24.062 87.297 1.00 0.00 H TER 29245 WAT 9891 ATOM 29245 O WAT 9892 94.197 54.092 102.492 1.00 0.00 O ATOM 29246 H1 WAT 9892 93.874 53.988 103.387 1.00 0.00 H ATOM 29247 H2 WAT 9892 94.721 54.892 102.518 1.00 0.00 H TER 29249 WAT 9892 ATOM 29249 O WAT 9893 78.980 103.716 61.147 1.00 0.00 O ATOM 29250 H1 WAT 9893 78.493 103.019 60.708 1.00 0.00 H ATOM 29251 H2 WAT 9893 78.962 103.475 62.073 1.00 0.00 H TER 29253 WAT 9893 ATOM 29253 O WAT 9894 127.838 20.646 78.838 1.00 0.00 O ATOM 29254 H1 WAT 9894 128.073 21.102 78.030 1.00 0.00 H ATOM 29255 H2 WAT 9894 128.442 20.994 79.494 1.00 0.00 H TER 29257 WAT 9894 ATOM 29257 O WAT 9895 106.123 22.140 84.515 1.00 0.00 O ATOM 29258 H1 WAT 9895 105.445 21.465 84.542 1.00 0.00 H ATOM 29259 H2 WAT 9895 105.821 22.809 85.130 1.00 0.00 H TER 29261 WAT 9895 ATOM 29261 O WAT 9896 20.260 2.165 58.725 1.00 0.00 O ATOM 29262 H1 WAT 9896 21.079 2.110 58.233 1.00 0.00 H ATOM 29263 H2 WAT 9896 19.616 1.728 58.168 1.00 0.00 H TER 29265 WAT 9896 ATOM 29265 O WAT 9897 36.214 142.178 107.465 1.00 0.00 O ATOM 29266 H1 WAT 9897 36.150 141.790 108.338 1.00 0.00 H ATOM 29267 H2 WAT 9897 37.128 142.454 107.392 1.00 0.00 H TER 29269 WAT 9897 ATOM 29269 O WAT 9898 52.003 10.489 154.286 1.00 0.00 O ATOM 29270 H1 WAT 9898 51.127 10.769 154.552 1.00 0.00 H ATOM 29271 H2 WAT 9898 52.531 11.286 154.324 1.00 0.00 H TER 29273 WAT 9898 ATOM 29273 O WAT 9899 18.961 20.385 10.869 1.00 0.00 O ATOM 29274 H1 WAT 9899 18.031 20.167 10.923 1.00 0.00 H ATOM 29275 H2 WAT 9899 19.388 19.758 11.452 1.00 0.00 H TER 29277 WAT 9899 ATOM 29277 O WAT 9900 33.418 141.652 13.296 1.00 0.00 O ATOM 29278 H1 WAT 9900 33.628 141.674 14.229 1.00 0.00 H ATOM 29279 H2 WAT 9900 32.880 142.431 13.153 1.00 0.00 H TER 29281 WAT 9900 ATOM 29281 O WAT 9901 25.904 104.506 67.371 1.00 0.00 O ATOM 29282 H1 WAT 9901 25.001 104.351 67.094 1.00 0.00 H ATOM 29283 H2 WAT 9901 25.904 105.405 67.699 1.00 0.00 H TER 29285 WAT 9901 ATOM 29285 O WAT 9902 61.725 26.676 131.366 1.00 0.00 O ATOM 29286 H1 WAT 9902 62.081 27.195 130.645 1.00 0.00 H ATOM 29287 H2 WAT 9902 61.178 26.016 130.940 1.00 0.00 H TER 29289 WAT 9902 ATOM 29289 O WAT 9903 56.218 1.550 50.744 1.00 0.00 O ATOM 29290 H1 WAT 9903 56.394 2.045 51.544 1.00 0.00 H ATOM 29291 H2 WAT 9903 55.939 0.688 51.052 1.00 0.00 H TER 29293 WAT 9903 ATOM 29293 O WAT 9904 135.288 35.045 109.972 1.00 0.00 O ATOM 29294 H1 WAT 9904 134.729 34.297 109.765 1.00 0.00 H ATOM 29295 H2 WAT 9904 134.690 35.699 110.334 1.00 0.00 H TER 29297 WAT 9904 ATOM 29297 O WAT 9905 138.010 84.355 1.690 1.00 0.00 O ATOM 29298 H1 WAT 9905 138.866 84.305 2.117 1.00 0.00 H ATOM 29299 H2 WAT 9905 137.383 84.166 2.387 1.00 0.00 H TER 29301 WAT 9905 ATOM 29301 O WAT 9906 95.256 112.669 96.853 1.00 0.00 O ATOM 29302 H1 WAT 9906 95.998 113.273 96.851 1.00 0.00 H ATOM 29303 H2 WAT 9906 95.627 111.834 97.138 1.00 0.00 H TER 29305 WAT 9906 ATOM 29305 O WAT 9907 113.774 132.086 129.667 1.00 0.00 O ATOM 29306 H1 WAT 9907 113.125 131.883 130.341 1.00 0.00 H ATOM 29307 H2 WAT 9907 113.271 132.118 128.853 1.00 0.00 H TER 29309 WAT 9907 ATOM 29309 O WAT 9908 51.765 20.049 124.207 1.00 0.00 O ATOM 29310 H1 WAT 9908 51.762 20.278 123.278 1.00 0.00 H ATOM 29311 H2 WAT 9908 52.599 20.386 124.535 1.00 0.00 H TER 29313 WAT 9908 ATOM 29313 O WAT 9909 64.367 30.799 138.587 1.00 0.00 O ATOM 29314 H1 WAT 9909 65.156 30.757 139.127 1.00 0.00 H ATOM 29315 H2 WAT 9909 64.678 31.096 137.732 1.00 0.00 H TER 29317 WAT 9909 ATOM 29317 O WAT 9910 72.661 63.923 136.400 1.00 0.00 O ATOM 29318 H1 WAT 9910 71.847 64.222 135.996 1.00 0.00 H ATOM 29319 H2 WAT 9910 73.334 64.097 135.742 1.00 0.00 H TER 29321 WAT 9910 ATOM 29321 O WAT 9911 0.877 89.205 3.397 1.00 0.00 O ATOM 29322 H1 WAT 9911 0.633 90.119 3.250 1.00 0.00 H ATOM 29323 H2 WAT 9911 1.816 89.175 3.210 1.00 0.00 H TER 29325 WAT 9911 ATOM 29325 O WAT 9912 54.379 21.745 120.608 1.00 0.00 O ATOM 29326 H1 WAT 9912 54.850 21.775 121.441 1.00 0.00 H ATOM 29327 H2 WAT 9912 53.873 22.558 120.590 1.00 0.00 H TER 29329 WAT 9912 ATOM 29329 O WAT 9913 103.434 114.661 24.267 1.00 0.00 O ATOM 29330 H1 WAT 9913 102.933 115.203 23.657 1.00 0.00 H ATOM 29331 H2 WAT 9913 103.120 114.923 25.133 1.00 0.00 H TER 29333 WAT 9913 ATOM 29333 O WAT 9914 37.903 54.292 69.064 1.00 0.00 O ATOM 29334 H1 WAT 9914 38.248 55.165 69.252 1.00 0.00 H ATOM 29335 H2 WAT 9914 38.406 53.708 69.632 1.00 0.00 H TER 29337 WAT 9914 ATOM 29337 O WAT 9915 60.031 104.149 154.486 1.00 0.00 O ATOM 29338 H1 WAT 9915 60.575 104.795 154.936 1.00 0.00 H ATOM 29339 H2 WAT 9915 59.422 103.838 155.157 1.00 0.00 H TER 29341 WAT 9915 ATOM 29341 O WAT 9916 55.807 86.608 139.755 1.00 0.00 O ATOM 29342 H1 WAT 9916 56.108 86.374 138.877 1.00 0.00 H ATOM 29343 H2 WAT 9916 56.009 85.841 140.290 1.00 0.00 H TER 29345 WAT 9916 ATOM 29345 O WAT 9917 81.233 92.404 106.858 1.00 0.00 O ATOM 29346 H1 WAT 9917 80.389 92.624 107.253 1.00 0.00 H ATOM 29347 H2 WAT 9917 81.824 93.095 107.156 1.00 0.00 H TER 29349 WAT 9917 ATOM 29349 O WAT 9918 115.336 120.194 2.017 1.00 0.00 O ATOM 29350 H1 WAT 9918 114.940 119.426 1.605 1.00 0.00 H ATOM 29351 H2 WAT 9918 115.174 120.073 2.953 1.00 0.00 H TER 29353 WAT 9918 ATOM 29353 O WAT 9919 71.830 95.408 125.998 1.00 0.00 O ATOM 29354 H1 WAT 9919 72.737 95.465 125.698 1.00 0.00 H ATOM 29355 H2 WAT 9919 71.389 94.886 125.328 1.00 0.00 H TER 29357 WAT 9919 ATOM 29357 O WAT 9920 106.015 59.163 4.655 1.00 0.00 O ATOM 29358 H1 WAT 9920 106.520 59.204 3.843 1.00 0.00 H ATOM 29359 H2 WAT 9920 106.211 59.986 5.102 1.00 0.00 H TER 29361 WAT 9920 ATOM 29361 O WAT 9921 134.429 123.204 103.072 1.00 0.00 O ATOM 29362 H1 WAT 9921 134.032 122.404 103.417 1.00 0.00 H ATOM 29363 H2 WAT 9921 134.228 123.186 102.136 1.00 0.00 H TER 29365 WAT 9921 ATOM 29365 O WAT 9922 49.592 22.327 88.600 1.00 0.00 O ATOM 29366 H1 WAT 9922 48.664 22.126 88.478 1.00 0.00 H ATOM 29367 H2 WAT 9922 49.736 22.229 89.541 1.00 0.00 H TER 29369 WAT 9922 ATOM 29369 O WAT 9923 95.468 131.966 96.292 1.00 0.00 O ATOM 29370 H1 WAT 9923 95.102 131.170 95.906 1.00 0.00 H ATOM 29371 H2 WAT 9923 94.754 132.602 96.250 1.00 0.00 H TER 29373 WAT 9923 ATOM 29373 O WAT 9924 81.087 126.554 79.947 1.00 0.00 O ATOM 29374 H1 WAT 9924 81.737 127.253 79.874 1.00 0.00 H ATOM 29375 H2 WAT 9924 80.324 126.885 79.474 1.00 0.00 H TER 29377 WAT 9924 ATOM 29377 O WAT 9925 32.881 91.043 126.370 1.00 0.00 O ATOM 29378 H1 WAT 9925 32.497 90.533 125.656 1.00 0.00 H ATOM 29379 H2 WAT 9925 32.685 90.537 127.158 1.00 0.00 H TER 29381 WAT 9925 ATOM 29381 O WAT 9926 11.982 59.958 114.060 1.00 0.00 O ATOM 29382 H1 WAT 9926 12.795 59.505 113.836 1.00 0.00 H ATOM 29383 H2 WAT 9926 12.054 60.807 113.624 1.00 0.00 H TER 29385 WAT 9926 ATOM 29385 O WAT 9927 74.024 58.107 105.056 1.00 0.00 O ATOM 29386 H1 WAT 9927 74.026 57.480 104.333 1.00 0.00 H ATOM 29387 H2 WAT 9927 74.790 57.871 105.580 1.00 0.00 H TER 29389 WAT 9927 ATOM 29389 O WAT 9928 11.900 92.876 100.147 1.00 0.00 O ATOM 29390 H1 WAT 9928 12.605 93.069 99.529 1.00 0.00 H ATOM 29391 H2 WAT 9928 11.099 93.095 99.672 1.00 0.00 H TER 29393 WAT 9928 ATOM 29393 O WAT 9929 139.599 88.837 101.233 1.00 0.00 O ATOM 29394 H1 WAT 9929 139.095 88.520 101.982 1.00 0.00 H ATOM 29395 H2 WAT 9929 139.330 89.751 101.133 1.00 0.00 H TER 29397 WAT 9929 ATOM 29397 O WAT 9930 13.656 131.532 65.115 1.00 0.00 O ATOM 29398 H1 WAT 9930 13.365 131.337 66.006 1.00 0.00 H ATOM 29399 H2 WAT 9930 13.469 130.733 64.622 1.00 0.00 H TER 29401 WAT 9930 ATOM 29401 O WAT 9931 80.900 57.446 100.742 1.00 0.00 O ATOM 29402 H1 WAT 9931 81.534 57.451 100.025 1.00 0.00 H ATOM 29403 H2 WAT 9931 81.062 58.265 101.210 1.00 0.00 H TER 29405 WAT 9931 ATOM 29405 O WAT 9932 2.327 104.971 128.273 1.00 0.00 O ATOM 29406 H1 WAT 9932 2.550 105.237 129.165 1.00 0.00 H ATOM 29407 H2 WAT 9932 2.069 105.783 127.838 1.00 0.00 H TER 29409 WAT 9932 ATOM 29409 O WAT 9933 6.145 103.639 59.021 1.00 0.00 O ATOM 29410 H1 WAT 9933 5.740 102.904 58.561 1.00 0.00 H ATOM 29411 H2 WAT 9933 5.868 103.533 59.931 1.00 0.00 H TER 29413 WAT 9933 ATOM 29413 O WAT 9934 90.957 141.271 114.298 1.00 0.00 O ATOM 29414 H1 WAT 9934 90.660 141.727 115.086 1.00 0.00 H ATOM 29415 H2 WAT 9934 91.910 141.353 114.318 1.00 0.00 H TER 29417 WAT 9934 ATOM 29417 O WAT 9935 112.524 100.720 137.574 1.00 0.00 O ATOM 29418 H1 WAT 9935 112.561 101.594 137.963 1.00 0.00 H ATOM 29419 H2 WAT 9935 111.823 100.276 138.051 1.00 0.00 H TER 29421 WAT 9935 ATOM 29421 O WAT 9936 94.973 11.066 68.585 1.00 0.00 O ATOM 29422 H1 WAT 9936 95.050 10.113 68.648 1.00 0.00 H ATOM 29423 H2 WAT 9936 94.500 11.214 67.766 1.00 0.00 H TER 29425 WAT 9936 ATOM 29425 O WAT 9937 76.300 24.841 3.936 1.00 0.00 O ATOM 29426 H1 WAT 9937 77.208 24.559 4.046 1.00 0.00 H ATOM 29427 H2 WAT 9937 76.288 25.283 3.087 1.00 0.00 H TER 29429 WAT 9937 ATOM 29429 O WAT 9938 101.836 113.841 75.335 1.00 0.00 O ATOM 29430 H1 WAT 9938 101.527 113.063 74.871 1.00 0.00 H ATOM 29431 H2 WAT 9938 102.388 113.499 76.037 1.00 0.00 H TER 29433 WAT 9938 ATOM 29433 O WAT 9939 137.679 84.953 112.517 1.00 0.00 O ATOM 29434 H1 WAT 9939 138.538 85.377 112.514 1.00 0.00 H ATOM 29435 H2 WAT 9939 137.060 85.669 112.663 1.00 0.00 H TER 29437 WAT 9939 ATOM 29437 O WAT 9940 39.839 64.536 122.718 1.00 0.00 O ATOM 29438 H1 WAT 9940 39.946 65.087 121.942 1.00 0.00 H ATOM 29439 H2 WAT 9940 40.728 64.423 123.055 1.00 0.00 H TER 29441 WAT 9940 ATOM 29441 O WAT 9941 111.675 56.633 26.598 1.00 0.00 O ATOM 29442 H1 WAT 9941 110.857 56.151 26.723 1.00 0.00 H ATOM 29443 H2 WAT 9941 111.564 57.431 27.114 1.00 0.00 H TER 29445 WAT 9941 ATOM 29445 O WAT 9942 118.635 82.637 154.421 1.00 0.00 O ATOM 29446 H1 WAT 9942 119.463 83.059 154.190 1.00 0.00 H ATOM 29447 H2 WAT 9942 118.207 82.473 153.581 1.00 0.00 H TER 29449 WAT 9942 ATOM 29449 O WAT 9943 40.560 132.406 136.695 1.00 0.00 O ATOM 29450 H1 WAT 9943 41.321 132.975 136.814 1.00 0.00 H ATOM 29451 H2 WAT 9943 39.808 132.992 136.773 1.00 0.00 H TER 29453 WAT 9943 ATOM 29453 O WAT 9944 110.575 75.625 69.993 1.00 0.00 O ATOM 29454 H1 WAT 9944 109.622 75.697 69.945 1.00 0.00 H ATOM 29455 H2 WAT 9944 110.761 75.538 70.928 1.00 0.00 H TER 29457 WAT 9944 ATOM 29457 O WAT 9945 138.203 71.850 8.501 1.00 0.00 O ATOM 29458 H1 WAT 9945 138.020 72.580 9.093 1.00 0.00 H ATOM 29459 H2 WAT 9945 137.990 71.069 9.011 1.00 0.00 H TER 29461 WAT 9945 ATOM 29461 O WAT 9946 28.382 21.846 84.311 1.00 0.00 O ATOM 29462 H1 WAT 9946 27.827 21.356 84.918 1.00 0.00 H ATOM 29463 H2 WAT 9946 29.230 21.900 84.753 1.00 0.00 H TER 29465 WAT 9946 ATOM 29465 O WAT 9947 4.402 46.374 119.684 1.00 0.00 O ATOM 29466 H1 WAT 9947 3.467 46.445 119.488 1.00 0.00 H ATOM 29467 H2 WAT 9947 4.736 47.265 119.583 1.00 0.00 H TER 29469 WAT 9947 ATOM 29469 O WAT 9948 23.516 36.187 134.315 1.00 0.00 O ATOM 29470 H1 WAT 9948 22.663 35.905 134.644 1.00 0.00 H ATOM 29471 H2 WAT 9948 24.145 35.823 134.938 1.00 0.00 H TER 29473 WAT 9948 ATOM 29473 O WAT 9949 86.082 33.523 130.837 1.00 0.00 O ATOM 29474 H1 WAT 9949 85.346 33.807 130.294 1.00 0.00 H ATOM 29475 H2 WAT 9949 86.645 33.031 130.239 1.00 0.00 H TER 29477 WAT 9949 ATOM 29477 O WAT 9950 80.917 131.165 0.327 1.00 0.00 O ATOM 29478 H1 WAT 9950 80.145 130.928 -0.186 1.00 0.00 H ATOM 29479 H2 WAT 9950 80.602 131.205 1.230 1.00 0.00 H TER 29481 WAT 9950 ATOM 29481 O WAT 9951 71.065 67.240 154.704 1.00 0.00 O ATOM 29482 H1 WAT 9951 71.407 66.374 154.929 1.00 0.00 H ATOM 29483 H2 WAT 9951 70.489 67.083 153.956 1.00 0.00 H TER 29485 WAT 9951 ATOM 29485 O WAT 9952 62.800 94.778 4.160 1.00 0.00 O ATOM 29486 H1 WAT 9952 63.253 94.045 3.743 1.00 0.00 H ATOM 29487 H2 WAT 9952 62.954 94.654 5.097 1.00 0.00 H TER 29489 WAT 9952 ATOM 29489 O WAT 9953 70.920 111.874 121.861 1.00 0.00 O ATOM 29490 H1 WAT 9953 71.035 111.921 122.810 1.00 0.00 H ATOM 29491 H2 WAT 9953 71.809 111.793 121.515 1.00 0.00 H TER 29493 WAT 9953 ATOM 29493 O WAT 9954 118.153 47.988 12.115 1.00 0.00 O ATOM 29494 H1 WAT 9954 118.625 47.851 12.936 1.00 0.00 H ATOM 29495 H2 WAT 9954 117.330 47.514 12.229 1.00 0.00 H TER 29497 WAT 9954 ATOM 29497 O WAT 9955 20.851 138.062 158.199 1.00 0.00 O ATOM 29498 H1 WAT 9955 21.457 137.887 158.919 1.00 0.00 H ATOM 29499 H2 WAT 9955 20.018 138.256 158.629 1.00 0.00 H TER 29501 WAT 9955 ATOM 29501 O WAT 9956 47.211 125.868 75.855 1.00 0.00 O ATOM 29502 H1 WAT 9956 47.826 125.575 76.528 1.00 0.00 H ATOM 29503 H2 WAT 9956 47.151 125.130 75.248 1.00 0.00 H TER 29505 WAT 9956 ATOM 29505 O WAT 9957 101.469 116.883 114.590 1.00 0.00 O ATOM 29506 H1 WAT 9957 101.584 117.470 115.338 1.00 0.00 H ATOM 29507 H2 WAT 9957 102.335 116.837 114.186 1.00 0.00 H TER 29509 WAT 9957 ATOM 29509 O WAT 9958 34.130 51.152 146.908 1.00 0.00 O ATOM 29510 H1 WAT 9958 34.058 51.766 146.178 1.00 0.00 H ATOM 29511 H2 WAT 9958 34.941 50.673 146.740 1.00 0.00 H TER 29513 WAT 9958 ATOM 29513 O WAT 9959 69.455 32.935 142.135 1.00 0.00 O ATOM 29514 H1 WAT 9959 70.194 32.911 141.526 1.00 0.00 H ATOM 29515 H2 WAT 9959 69.574 32.160 142.685 1.00 0.00 H TER 29517 WAT 9959 ATOM 29517 O WAT 9960 88.341 44.716 89.809 1.00 0.00 O ATOM 29518 H1 WAT 9960 88.268 44.979 88.891 1.00 0.00 H ATOM 29519 H2 WAT 9960 87.440 44.541 90.080 1.00 0.00 H TER 29521 WAT 9960 ATOM 29521 O WAT 9961 109.584 65.983 137.217 1.00 0.00 O ATOM 29522 H1 WAT 9961 110.417 66.358 136.930 1.00 0.00 H ATOM 29523 H2 WAT 9961 109.056 66.740 137.470 1.00 0.00 H TER 29525 WAT 9961 ATOM 29525 O WAT 9962 17.644 25.358 135.725 1.00 0.00 O ATOM 29526 H1 WAT 9962 17.783 25.694 134.839 1.00 0.00 H ATOM 29527 H2 WAT 9962 18.466 24.922 135.948 1.00 0.00 H TER 29529 WAT 9962 ATOM 29529 O WAT 9963 64.465 131.568 81.995 1.00 0.00 O ATOM 29530 H1 WAT 9963 65.005 131.556 81.206 1.00 0.00 H ATOM 29531 H2 WAT 9963 63.620 131.217 81.712 1.00 0.00 H TER 29533 WAT 9963 ATOM 29533 O WAT 9964 38.438 38.041 156.874 1.00 0.00 O ATOM 29534 H1 WAT 9964 38.237 37.639 157.719 1.00 0.00 H ATOM 29535 H2 WAT 9964 38.976 38.802 157.093 1.00 0.00 H TER 29537 WAT 9964 ATOM 29537 O WAT 9965 114.982 36.397 14.151 1.00 0.00 O ATOM 29538 H1 WAT 9965 115.245 37.080 13.534 1.00 0.00 H ATOM 29539 H2 WAT 9965 115.626 35.700 14.026 1.00 0.00 H TER 29541 WAT 9965 ATOM 29541 O WAT 9966 80.850 55.691 77.985 1.00 0.00 O ATOM 29542 H1 WAT 9966 80.262 56.386 77.688 1.00 0.00 H ATOM 29543 H2 WAT 9966 80.813 55.033 77.291 1.00 0.00 H TER 29545 WAT 9966 ATOM 29545 O WAT 9967 106.400 134.407 9.052 1.00 0.00 O ATOM 29546 H1 WAT 9967 106.396 134.935 9.851 1.00 0.00 H ATOM 29547 H2 WAT 9967 106.129 135.012 8.363 1.00 0.00 H TER 29549 WAT 9967 ATOM 29549 O WAT 9968 63.909 54.367 55.579 1.00 0.00 O ATOM 29550 H1 WAT 9968 64.402 54.751 56.305 1.00 0.00 H ATOM 29551 H2 WAT 9968 63.065 54.819 55.598 1.00 0.00 H TER 29553 WAT 9968 ATOM 29553 O WAT 9969 80.950 101.970 149.117 1.00 0.00 O ATOM 29554 H1 WAT 9969 80.519 102.142 148.280 1.00 0.00 H ATOM 29555 H2 WAT 9969 81.873 101.851 148.891 1.00 0.00 H TER 29557 WAT 9969 ATOM 29557 O WAT 9970 58.854 42.970 76.646 1.00 0.00 O ATOM 29558 H1 WAT 9970 58.730 42.719 77.562 1.00 0.00 H ATOM 29559 H2 WAT 9970 58.778 42.149 76.160 1.00 0.00 H TER 29561 WAT 9970 ATOM 29561 O WAT 9971 21.009 78.684 77.734 1.00 0.00 O ATOM 29562 H1 WAT 9971 20.164 78.622 77.288 1.00 0.00 H ATOM 29563 H2 WAT 9971 21.257 79.605 77.651 1.00 0.00 H TER 29565 WAT 9971 ATOM 29565 O WAT 9972 123.319 10.299 124.408 1.00 0.00 O ATOM 29566 H1 WAT 9972 123.726 10.658 123.620 1.00 0.00 H ATOM 29567 H2 WAT 9972 123.547 9.369 124.392 1.00 0.00 H TER 29569 WAT 9972 ATOM 29569 O WAT 9973 96.527 74.447 151.514 1.00 0.00 O ATOM 29570 H1 WAT 9973 95.622 74.404 151.822 1.00 0.00 H ATOM 29571 H2 WAT 9973 97.027 73.964 152.173 1.00 0.00 H TER 29573 WAT 9973 ATOM 29573 O WAT 9974 12.273 92.894 132.272 1.00 0.00 O ATOM 29574 H1 WAT 9974 12.441 93.477 133.013 1.00 0.00 H ATOM 29575 H2 WAT 9974 11.950 92.086 132.671 1.00 0.00 H TER 29577 WAT 9974 ATOM 29577 O WAT 9975 2.966 74.706 87.967 1.00 0.00 O ATOM 29578 H1 WAT 9975 3.321 75.060 88.783 1.00 0.00 H ATOM 29579 H2 WAT 9975 2.490 73.920 88.234 1.00 0.00 H TER 29581 WAT 9975 ATOM 29581 O WAT 9976 49.120 98.795 120.938 1.00 0.00 O ATOM 29582 H1 WAT 9976 48.338 98.979 121.458 1.00 0.00 H ATOM 29583 H2 WAT 9976 49.840 99.163 121.449 1.00 0.00 H TER 29585 WAT 9976 ATOM 29585 O WAT 9977 21.082 27.225 68.182 1.00 0.00 O ATOM 29586 H1 WAT 9977 21.919 26.879 68.492 1.00 0.00 H ATOM 29587 H2 WAT 9977 21.224 27.400 67.252 1.00 0.00 H TER 29589 WAT 9977 ATOM 29589 O WAT 9978 74.574 123.995 111.174 1.00 0.00 O ATOM 29590 H1 WAT 9978 74.093 124.822 111.194 1.00 0.00 H ATOM 29591 H2 WAT 9978 74.113 123.434 111.798 1.00 0.00 H TER 29593 WAT 9978 ATOM 29593 O WAT 9979 85.496 74.332 110.637 1.00 0.00 O ATOM 29594 H1 WAT 9979 86.420 74.422 110.870 1.00 0.00 H ATOM 29595 H2 WAT 9979 85.086 75.129 110.973 1.00 0.00 H TER 29597 WAT 9979 ATOM 29597 O WAT 9980 113.070 90.430 106.620 1.00 0.00 O ATOM 29598 H1 WAT 9980 113.469 90.941 105.916 1.00 0.00 H ATOM 29599 H2 WAT 9980 113.728 89.771 106.840 1.00 0.00 H TER 29601 WAT 9980 ATOM 29601 O WAT 9981 18.808 58.187 117.167 1.00 0.00 O ATOM 29602 H1 WAT 9981 19.291 57.429 116.838 1.00 0.00 H ATOM 29603 H2 WAT 9981 17.984 58.177 116.680 1.00 0.00 H TER 29605 WAT 9981 ATOM 29605 O WAT 9982 113.213 99.962 27.839 1.00 0.00 O ATOM 29606 H1 WAT 9982 112.286 100.017 28.069 1.00 0.00 H ATOM 29607 H2 WAT 9982 113.672 100.258 28.625 1.00 0.00 H TER 29609 WAT 9982 ATOM 29609 O WAT 9983 130.574 35.965 111.816 1.00 0.00 O ATOM 29610 H1 WAT 9983 129.960 36.663 112.042 1.00 0.00 H ATOM 29611 H2 WAT 9983 130.305 35.683 110.942 1.00 0.00 H TER 29613 WAT 9983 ATOM 29613 O WAT 9984 24.212 17.210 5.895 1.00 0.00 O ATOM 29614 H1 WAT 9984 25.072 16.962 5.557 1.00 0.00 H ATOM 29615 H2 WAT 9984 23.648 17.234 5.122 1.00 0.00 H TER 29617 WAT 9984 ATOM 29617 O WAT 9985 74.035 3.404 148.291 1.00 0.00 O ATOM 29618 H1 WAT 9985 73.852 3.430 147.352 1.00 0.00 H ATOM 29619 H2 WAT 9985 74.242 2.487 148.470 1.00 0.00 H TER 29621 WAT 9985 ATOM 29621 O WAT 9986 3.152 139.870 132.246 1.00 0.00 O ATOM 29622 H1 WAT 9986 2.736 139.521 131.458 1.00 0.00 H ATOM 29623 H2 WAT 9986 2.673 139.464 132.969 1.00 0.00 H TER 29625 WAT 9986 ATOM 29625 O WAT 9987 55.368 143.527 157.256 1.00 0.00 O ATOM 29626 H1 WAT 9987 55.698 142.980 156.543 1.00 0.00 H ATOM 29627 H2 WAT 9987 55.881 143.261 158.019 1.00 0.00 H TER 29629 WAT 9987 ATOM 29629 O WAT 9988 114.270 112.873 127.114 1.00 0.00 O ATOM 29630 H1 WAT 9988 113.460 113.372 127.218 1.00 0.00 H ATOM 29631 H2 WAT 9988 114.758 113.345 126.439 1.00 0.00 H TER 29633 WAT 9988 ATOM 29633 O WAT 9989 26.831 128.129 89.517 1.00 0.00 O ATOM 29634 H1 WAT 9989 27.370 127.460 89.938 1.00 0.00 H ATOM 29635 H2 WAT 9989 26.577 127.740 88.680 1.00 0.00 H TER 29637 WAT 9989 ATOM 29637 O WAT 9990 25.737 1.639 99.893 1.00 0.00 O ATOM 29638 H1 WAT 9990 25.839 2.304 99.212 1.00 0.00 H ATOM 29639 H2 WAT 9990 26.621 1.297 100.027 1.00 0.00 H TER 29641 WAT 9990 ATOM 29641 O WAT 9991 0.397 89.876 76.911 1.00 0.00 O ATOM 29642 H1 WAT 9991 -0.432 89.423 77.064 1.00 0.00 H ATOM 29643 H2 WAT 9991 0.619 90.261 77.758 1.00 0.00 H TER 29645 WAT 9991 ATOM 29645 O WAT 9992 94.501 95.712 70.503 1.00 0.00 O ATOM 29646 H1 WAT 9992 94.893 95.444 69.672 1.00 0.00 H ATOM 29647 H2 WAT 9992 95.249 95.907 71.068 1.00 0.00 H TER 29649 WAT 9992 ATOM 29649 O WAT 9993 83.467 69.936 78.624 1.00 0.00 O ATOM 29650 H1 WAT 9993 84.276 69.433 78.719 1.00 0.00 H ATOM 29651 H2 WAT 9993 83.003 69.801 79.450 1.00 0.00 H TER 29653 WAT 9993 ATOM 29653 O WAT 9994 46.892 134.736 148.634 1.00 0.00 O ATOM 29654 H1 WAT 9994 47.086 133.815 148.807 1.00 0.00 H ATOM 29655 H2 WAT 9994 46.260 134.716 147.915 1.00 0.00 H TER 29657 WAT 9994 ATOM 29657 O WAT 9995 136.768 130.681 65.044 1.00 0.00 O ATOM 29658 H1 WAT 9995 137.389 131.382 64.843 1.00 0.00 H ATOM 29659 H2 WAT 9995 136.632 130.235 64.208 1.00 0.00 H TER 29661 WAT 9995 ATOM 29661 O WAT 9996 141.450 20.329 148.026 1.00 0.00 O ATOM 29662 H1 WAT 9996 140.905 21.082 147.795 1.00 0.00 H ATOM 29663 H2 WAT 9996 141.313 20.213 148.966 1.00 0.00 H TER 29665 WAT 9996 ATOM 29665 O WAT 9997 42.561 31.158 86.238 1.00 0.00 O ATOM 29666 H1 WAT 9997 43.362 31.522 85.861 1.00 0.00 H ATOM 29667 H2 WAT 9997 41.913 31.856 86.144 1.00 0.00 H TER 29669 WAT 9997 ATOM 29669 O WAT 9998 94.826 17.672 59.821 1.00 0.00 O ATOM 29670 H1 WAT 9998 95.745 17.829 60.037 1.00 0.00 H ATOM 29671 H2 WAT 9998 94.842 17.353 58.919 1.00 0.00 H TER 29673 WAT 9998 ATOM 29673 O WAT 9999 143.880 14.901 150.653 1.00 0.00 O ATOM 29674 H1 WAT 9999 143.619 14.003 150.860 1.00 0.00 H ATOM 29675 H2 WAT 9999 144.832 14.903 150.753 1.00 0.00 H TER 29677 WAT 9999 ATOM 29677 O WAT 0 133.517 126.707 101.825 1.00 0.00 O ATOM 29678 H1 WAT 0 134.310 126.824 102.349 1.00 0.00 H ATOM 29679 H2 WAT 0 133.637 125.861 101.394 1.00 0.00 H TER 29681 WAT 0 ATOM 29681 O WAT 1 65.068 114.502 139.030 1.00 0.00 O ATOM 29682 H1 WAT 1 64.228 114.532 138.572 1.00 0.00 H ATOM 29683 H2 WAT 1 65.614 115.141 138.571 1.00 0.00 H TER 29685 WAT 1 ATOM 29685 O WAT 2 92.960 33.595 109.411 1.00 0.00 O ATOM 29686 H1 WAT 2 93.168 34.526 109.490 1.00 0.00 H ATOM 29687 H2 WAT 2 92.020 33.574 109.230 1.00 0.00 H TER 29689 WAT 2 ATOM 29689 O WAT 3 12.840 27.487 71.524 1.00 0.00 O ATOM 29690 H1 WAT 3 13.433 28.238 71.557 1.00 0.00 H ATOM 29691 H2 WAT 3 12.356 27.601 70.706 1.00 0.00 H TER 29693 WAT 3 ATOM 29693 O WAT 4 45.792 92.175 137.239 1.00 0.00 O ATOM 29694 H1 WAT 4 45.866 91.221 137.221 1.00 0.00 H ATOM 29695 H2 WAT 4 45.514 92.411 136.354 1.00 0.00 H TER 29697 WAT 4 ATOM 29697 O WAT 5 11.269 38.084 132.310 1.00 0.00 O ATOM 29698 H1 WAT 5 10.595 38.371 131.693 1.00 0.00 H ATOM 29699 H2 WAT 5 10.848 38.140 133.168 1.00 0.00 H TER 29701 WAT 5 ATOM 29701 O WAT 6 97.028 65.732 77.591 1.00 0.00 O ATOM 29702 H1 WAT 6 97.623 66.313 77.117 1.00 0.00 H ATOM 29703 H2 WAT 6 96.852 66.189 78.414 1.00 0.00 H TER 29705 WAT 6 ATOM 29705 O WAT 7 76.785 107.178 112.822 1.00 0.00 O ATOM 29706 H1 WAT 7 77.145 107.508 111.999 1.00 0.00 H ATOM 29707 H2 WAT 7 77.456 106.580 113.153 1.00 0.00 H TER 29709 WAT 7 ATOM 29709 O WAT 8 33.992 135.969 131.689 1.00 0.00 O ATOM 29710 H1 WAT 8 33.647 136.184 132.556 1.00 0.00 H ATOM 29711 H2 WAT 8 34.935 136.115 131.765 1.00 0.00 H TER 29713 WAT 8 ATOM 29713 O WAT 9 125.821 58.785 71.678 1.00 0.00 O ATOM 29714 H1 WAT 9 125.556 58.184 70.982 1.00 0.00 H ATOM 29715 H2 WAT 9 124.997 59.105 72.045 1.00 0.00 H TER 29717 WAT 9 ATOM 29717 O WAT 10 91.120 104.007 56.522 1.00 0.00 O ATOM 29718 H1 WAT 10 90.731 104.273 55.689 1.00 0.00 H ATOM 29719 H2 WAT 10 91.691 104.736 56.764 1.00 0.00 H TER 29721 WAT 10 ATOM 29721 O WAT 11 43.260 145.540 109.262 1.00 0.00 O ATOM 29722 H1 WAT 11 42.968 146.428 109.469 1.00 0.00 H ATOM 29723 H2 WAT 11 42.460 145.015 109.276 1.00 0.00 H TER 29725 WAT 11 ATOM 29725 O WAT 12 133.516 75.409 3.517 1.00 0.00 O ATOM 29726 H1 WAT 12 133.072 75.635 2.699 1.00 0.00 H ATOM 29727 H2 WAT 12 134.244 76.029 3.573 1.00 0.00 H TER 29729 WAT 12 ATOM 29729 O WAT 13 27.601 116.727 121.393 1.00 0.00 O ATOM 29730 H1 WAT 13 27.958 116.881 122.268 1.00 0.00 H ATOM 29731 H2 WAT 13 28.321 116.323 120.909 1.00 0.00 H TER 29733 WAT 13 ATOM 29733 O WAT 14 45.384 68.790 56.552 1.00 0.00 O ATOM 29734 H1 WAT 14 44.830 69.557 56.408 1.00 0.00 H ATOM 29735 H2 WAT 14 46.278 69.125 56.483 1.00 0.00 H TER 29737 WAT 14 ATOM 29737 O WAT 15 76.252 113.483 106.063 1.00 0.00 O ATOM 29738 H1 WAT 15 75.827 114.323 106.232 1.00 0.00 H ATOM 29739 H2 WAT 15 76.240 113.033 106.908 1.00 0.00 H TER 29741 WAT 15 ATOM 29741 O WAT 16 115.902 80.401 90.603 1.00 0.00 O ATOM 29742 H1 WAT 16 115.748 80.981 89.857 1.00 0.00 H ATOM 29743 H2 WAT 16 115.443 79.593 90.376 1.00 0.00 H TER 29745 WAT 16 ATOM 29745 O WAT 17 93.605 119.458 130.868 1.00 0.00 O ATOM 29746 H1 WAT 17 93.807 118.620 130.452 1.00 0.00 H ATOM 29747 H2 WAT 17 92.837 119.278 131.410 1.00 0.00 H TER 29749 WAT 17 ATOM 29749 O WAT 18 113.025 7.984 146.202 1.00 0.00 O ATOM 29750 H1 WAT 18 113.162 7.900 145.259 1.00 0.00 H ATOM 29751 H2 WAT 18 113.713 7.443 146.592 1.00 0.00 H TER 29753 WAT 18 ATOM 29753 O WAT 19 113.740 16.639 146.330 1.00 0.00 O ATOM 29754 H1 WAT 19 114.459 16.010 146.273 1.00 0.00 H ATOM 29755 H2 WAT 19 114.004 17.357 145.755 1.00 0.00 H TER 29757 WAT 19 ATOM 29757 O WAT 20 54.676 21.979 136.921 1.00 0.00 O ATOM 29758 H1 WAT 20 55.308 22.125 136.217 1.00 0.00 H ATOM 29759 H2 WAT 20 55.189 22.064 137.725 1.00 0.00 H TER 29761 WAT 20 ATOM 29761 O WAT 21 135.415 25.082 12.938 1.00 0.00 O ATOM 29762 H1 WAT 21 135.061 24.475 13.589 1.00 0.00 H ATOM 29763 H2 WAT 21 135.744 25.819 13.451 1.00 0.00 H TER 29765 WAT 21 ATOM 29765 O WAT 22 39.989 83.683 99.253 1.00 0.00 O ATOM 29766 H1 WAT 22 39.946 84.450 99.824 1.00 0.00 H ATOM 29767 H2 WAT 22 40.917 83.598 99.035 1.00 0.00 H TER 29769 WAT 22 ATOM 29769 O WAT 23 5.924 43.885 144.641 1.00 0.00 O ATOM 29770 H1 WAT 23 6.154 44.778 144.385 1.00 0.00 H ATOM 29771 H2 WAT 23 6.208 43.817 145.552 1.00 0.00 H TER 29773 WAT 23 ATOM 29773 O WAT 24 47.335 39.383 112.876 1.00 0.00 O ATOM 29774 H1 WAT 24 48.008 38.761 112.602 1.00 0.00 H ATOM 29775 H2 WAT 24 46.615 38.835 113.189 1.00 0.00 H TER 29777 WAT 24 ATOM 29777 O WAT 25 137.719 21.478 147.562 1.00 0.00 O ATOM 29778 H1 WAT 25 138.366 22.134 147.301 1.00 0.00 H ATOM 29779 H2 WAT 25 138.181 20.924 148.192 1.00 0.00 H TER 29781 WAT 25 ATOM 29781 O WAT 26 90.642 91.830 141.939 1.00 0.00 O ATOM 29782 H1 WAT 26 91.088 91.088 141.531 1.00 0.00 H ATOM 29783 H2 WAT 26 90.321 91.488 142.773 1.00 0.00 H TER 29785 WAT 26 ATOM 29785 O WAT 27 32.456 122.438 153.794 1.00 0.00 O ATOM 29786 H1 WAT 27 33.066 122.428 153.056 1.00 0.00 H ATOM 29787 H2 WAT 27 31.614 122.189 153.412 1.00 0.00 H TER 29789 WAT 27 ATOM 29789 O WAT 28 80.642 58.881 1.080 1.00 0.00 O ATOM 29790 H1 WAT 28 80.664 58.060 1.571 1.00 0.00 H ATOM 29791 H2 WAT 28 79.987 59.413 1.532 1.00 0.00 H TER 29793 WAT 28 ATOM 29793 O WAT 29 28.584 116.022 154.478 1.00 0.00 O ATOM 29794 H1 WAT 29 28.238 116.912 154.405 1.00 0.00 H ATOM 29795 H2 WAT 29 27.873 115.521 154.880 1.00 0.00 H TER 29797 WAT 29 ATOM 29797 O WAT 30 81.374 111.742 86.658 1.00 0.00 O ATOM 29798 H1 WAT 30 80.576 112.206 86.405 1.00 0.00 H ATOM 29799 H2 WAT 30 82.058 112.411 86.631 1.00 0.00 H TER 29801 WAT 30 ATOM 29801 O WAT 31 23.775 90.932 4.795 1.00 0.00 O ATOM 29802 H1 WAT 31 22.928 91.375 4.753 1.00 0.00 H ATOM 29803 H2 WAT 31 23.802 90.550 5.673 1.00 0.00 H TER 29805 WAT 31 ATOM 29805 O WAT 32 128.368 64.844 138.566 1.00 0.00 O ATOM 29806 H1 WAT 32 129.164 65.367 138.471 1.00 0.00 H ATOM 29807 H2 WAT 32 128.663 64.031 138.976 1.00 0.00 H TER 29809 WAT 32 ATOM 29809 O WAT 33 29.251 63.889 131.347 1.00 0.00 O ATOM 29810 H1 WAT 33 30.141 64.230 131.266 1.00 0.00 H ATOM 29811 H2 WAT 33 28.766 64.587 131.787 1.00 0.00 H TER 29813 WAT 33 ATOM 29813 O WAT 34 1.241 140.445 99.532 1.00 0.00 O ATOM 29814 H1 WAT 34 0.292 140.452 99.406 1.00 0.00 H ATOM 29815 H2 WAT 34 1.545 139.695 99.022 1.00 0.00 H TER 29817 WAT 34 ATOM 29817 O WAT 35 47.754 89.580 15.968 1.00 0.00 O ATOM 29818 H1 WAT 35 48.601 89.618 15.524 1.00 0.00 H ATOM 29819 H2 WAT 35 47.902 89.002 16.717 1.00 0.00 H TER 29821 WAT 35 ATOM 29821 O WAT 36 75.845 48.175 -0.054 1.00 0.00 O ATOM 29822 H1 WAT 36 74.930 48.395 -0.233 1.00 0.00 H ATOM 29823 H2 WAT 36 75.893 48.111 0.900 1.00 0.00 H TER 29825 WAT 36 ATOM 29825 O WAT 37 101.168 11.612 85.496 1.00 0.00 O ATOM 29826 H1 WAT 37 102.105 11.509 85.329 1.00 0.00 H ATOM 29827 H2 WAT 37 100.743 11.189 84.750 1.00 0.00 H TER 29829 WAT 37 ATOM 29829 O WAT 38 70.357 109.124 125.245 1.00 0.00 O ATOM 29830 H1 WAT 38 70.618 108.706 124.425 1.00 0.00 H ATOM 29831 H2 WAT 38 69.543 108.683 125.490 1.00 0.00 H TER 29833 WAT 38 ATOM 29833 O WAT 39 112.578 69.903 59.520 1.00 0.00 O ATOM 29834 H1 WAT 39 112.750 70.842 59.446 1.00 0.00 H ATOM 29835 H2 WAT 39 111.640 69.817 59.347 1.00 0.00 H TER 29837 WAT 39 ATOM 29837 O WAT 40 132.539 138.185 116.895 1.00 0.00 O ATOM 29838 H1 WAT 40 131.976 137.828 117.582 1.00 0.00 H ATOM 29839 H2 WAT 40 133.343 138.435 117.349 1.00 0.00 H TER 29841 WAT 40 ATOM 29841 O WAT 41 108.811 123.906 92.833 1.00 0.00 O ATOM 29842 H1 WAT 41 108.199 124.479 92.370 1.00 0.00 H ATOM 29843 H2 WAT 41 108.251 123.310 93.330 1.00 0.00 H TER 29845 WAT 41 ATOM 29845 O WAT 42 109.463 113.929 142.671 1.00 0.00 O ATOM 29846 H1 WAT 42 109.703 113.189 142.113 1.00 0.00 H ATOM 29847 H2 WAT 42 110.299 114.274 142.983 1.00 0.00 H TER 29849 WAT 42 ATOM 29849 O WAT 43 47.658 53.764 99.629 1.00 0.00 O ATOM 29850 H1 WAT 43 47.724 54.717 99.685 1.00 0.00 H ATOM 29851 H2 WAT 43 48.039 53.448 100.449 1.00 0.00 H TER 29853 WAT 43 ATOM 29853 O WAT 44 13.647 113.832 74.240 1.00 0.00 O ATOM 29854 H1 WAT 44 12.828 113.778 73.747 1.00 0.00 H ATOM 29855 H2 WAT 44 13.726 112.979 74.665 1.00 0.00 H TER 29857 WAT 44 ATOM 29857 O WAT 45 133.343 15.208 0.831 1.00 0.00 O ATOM 29858 H1 WAT 45 133.186 15.612 -0.022 1.00 0.00 H ATOM 29859 H2 WAT 45 133.160 15.904 1.463 1.00 0.00 H TER 29861 WAT 45 ATOM 29861 O WAT 46 93.386 128.799 10.741 1.00 0.00 O ATOM 29862 H1 WAT 46 93.708 129.615 10.358 1.00 0.00 H ATOM 29863 H2 WAT 46 94.100 128.175 10.612 1.00 0.00 H TER 29865 WAT 46 ATOM 29865 O WAT 47 67.791 141.863 142.031 1.00 0.00 O ATOM 29866 H1 WAT 47 67.529 142.369 141.261 1.00 0.00 H ATOM 29867 H2 WAT 47 67.310 141.039 141.951 1.00 0.00 H TER 29869 WAT 47 ATOM 29869 O WAT 48 101.696 61.690 114.565 1.00 0.00 O ATOM 29870 H1 WAT 48 101.225 60.859 114.508 1.00 0.00 H ATOM 29871 H2 WAT 48 101.008 62.351 114.641 1.00 0.00 H TER 29873 WAT 48 ATOM 29873 O WAT 49 129.211 108.550 84.201 1.00 0.00 O ATOM 29874 H1 WAT 49 128.312 108.227 84.147 1.00 0.00 H ATOM 29875 H2 WAT 49 129.211 109.349 83.674 1.00 0.00 H TER 29877 WAT 49 ATOM 29877 O WAT 50 128.414 2.451 105.823 1.00 0.00 O ATOM 29878 H1 WAT 50 128.748 3.025 106.512 1.00 0.00 H ATOM 29879 H2 WAT 50 129.199 2.086 105.414 1.00 0.00 H TER 29881 WAT 50 ATOM 29881 O WAT 51 33.280 70.772 106.721 1.00 0.00 O ATOM 29882 H1 WAT 51 32.447 70.852 107.185 1.00 0.00 H ATOM 29883 H2 WAT 51 33.798 70.174 107.258 1.00 0.00 H TER 29885 WAT 51 ATOM 29885 O WAT 52 61.409 96.216 14.473 1.00 0.00 O ATOM 29886 H1 WAT 52 60.736 95.945 13.849 1.00 0.00 H ATOM 29887 H2 WAT 52 61.671 97.088 14.180 1.00 0.00 H TER 29889 WAT 52 ATOM 29889 O WAT 53 58.544 72.034 117.343 1.00 0.00 O ATOM 29890 H1 WAT 53 58.441 71.248 116.806 1.00 0.00 H ATOM 29891 H2 WAT 53 59.181 71.784 118.013 1.00 0.00 H TER 29893 WAT 53 ATOM 29893 O WAT 54 56.786 122.900 137.016 1.00 0.00 O ATOM 29894 H1 WAT 54 56.395 123.004 136.149 1.00 0.00 H ATOM 29895 H2 WAT 54 56.520 123.685 137.495 1.00 0.00 H TER 29897 WAT 54 ATOM 29897 O WAT 55 4.897 19.853 61.842 1.00 0.00 O ATOM 29898 H1 WAT 55 5.831 19.917 61.642 1.00 0.00 H ATOM 29899 H2 WAT 55 4.856 19.296 62.619 1.00 0.00 H TER 29901 WAT 55 ATOM 29901 O WAT 56 124.861 16.903 27.961 1.00 0.00 O ATOM 29902 H1 WAT 56 124.276 16.872 27.204 1.00 0.00 H ATOM 29903 H2 WAT 56 125.421 16.132 27.862 1.00 0.00 H TER 29905 WAT 56 ATOM 29905 O WAT 57 7.546 21.634 117.312 1.00 0.00 O ATOM 29906 H1 WAT 57 7.949 22.446 117.618 1.00 0.00 H ATOM 29907 H2 WAT 57 6.627 21.862 117.169 1.00 0.00 H TER 29909 WAT 57 ATOM 29909 O WAT 58 89.318 129.909 93.144 1.00 0.00 O ATOM 29910 H1 WAT 58 89.059 130.772 93.465 1.00 0.00 H ATOM 29911 H2 WAT 58 89.124 129.315 93.869 1.00 0.00 H TER 29913 WAT 58 ATOM 29913 O WAT 59 0.217 109.147 150.441 1.00 0.00 O ATOM 29914 H1 WAT 59 0.637 109.935 150.786 1.00 0.00 H ATOM 29915 H2 WAT 59 0.107 109.325 149.507 1.00 0.00 H TER 29917 WAT 59 ATOM 29917 O WAT 60 104.661 56.769 117.987 1.00 0.00 O ATOM 29918 H1 WAT 60 104.158 57.572 117.854 1.00 0.00 H ATOM 29919 H2 WAT 60 105.430 57.047 118.484 1.00 0.00 H TER 29921 WAT 60 ATOM 29921 O WAT 61 134.658 131.626 100.735 1.00 0.00 O ATOM 29922 H1 WAT 61 134.481 131.556 101.673 1.00 0.00 H ATOM 29923 H2 WAT 61 135.010 130.770 100.493 1.00 0.00 H TER 29925 WAT 61 ATOM 29925 O WAT 62 90.512 24.567 126.310 1.00 0.00 O ATOM 29926 H1 WAT 62 90.341 24.741 125.384 1.00 0.00 H ATOM 29927 H2 WAT 62 91.379 24.163 126.321 1.00 0.00 H TER 29929 WAT 62 ATOM 29929 O WAT 63 33.261 55.900 115.696 1.00 0.00 O ATOM 29930 H1 WAT 63 33.006 56.150 116.584 1.00 0.00 H ATOM 29931 H2 WAT 63 33.092 54.959 115.655 1.00 0.00 H TER 29933 WAT 63 ATOM 29933 O WAT 64 138.828 90.023 19.717 1.00 0.00 O ATOM 29934 H1 WAT 64 139.455 89.497 19.221 1.00 0.00 H ATOM 29935 H2 WAT 64 138.736 89.563 20.551 1.00 0.00 H TER 29937 WAT 64 ATOM 29937 O WAT 65 66.685 141.243 21.597 1.00 0.00 O ATOM 29938 H1 WAT 65 65.846 141.393 22.031 1.00 0.00 H ATOM 29939 H2 WAT 65 67.339 141.542 22.229 1.00 0.00 H TER 29941 WAT 65 ATOM 29941 O WAT 66 100.843 100.568 84.181 1.00 0.00 O ATOM 29942 H1 WAT 66 100.577 100.821 85.064 1.00 0.00 H ATOM 29943 H2 WAT 66 101.453 101.253 83.909 1.00 0.00 H TER 29945 WAT 66 ATOM 29945 O WAT 67 113.873 110.217 127.399 1.00 0.00 O ATOM 29946 H1 WAT 67 114.086 111.137 127.240 1.00 0.00 H ATOM 29947 H2 WAT 67 113.998 109.792 126.550 1.00 0.00 H TER 29949 WAT 67 ATOM 29949 O WAT 68 97.267 36.764 80.121 1.00 0.00 O ATOM 29950 H1 WAT 68 97.544 37.290 79.371 1.00 0.00 H ATOM 29951 H2 WAT 68 96.830 37.386 80.702 1.00 0.00 H TER 29953 WAT 68 ATOM 29953 O WAT 69 101.581 41.154 88.199 1.00 0.00 O ATOM 29954 H1 WAT 69 102.420 41.233 87.744 1.00 0.00 H ATOM 29955 H2 WAT 69 101.194 42.027 88.139 1.00 0.00 H TER 29957 WAT 69 ATOM 29957 O WAT 70 86.050 85.100 11.046 1.00 0.00 O ATOM 29958 H1 WAT 70 85.446 84.665 10.444 1.00 0.00 H ATOM 29959 H2 WAT 70 86.901 85.046 10.611 1.00 0.00 H TER 29961 WAT 70 ATOM 29961 O WAT 71 32.142 99.946 116.163 1.00 0.00 O ATOM 29962 H1 WAT 71 31.619 100.727 115.983 1.00 0.00 H ATOM 29963 H2 WAT 71 33.026 100.280 116.315 1.00 0.00 H TER 29965 WAT 71 ATOM 29965 O WAT 72 98.393 72.319 92.928 1.00 0.00 O ATOM 29966 H1 WAT 72 97.458 72.421 92.752 1.00 0.00 H ATOM 29967 H2 WAT 72 98.581 72.967 93.607 1.00 0.00 H TER 29969 WAT 72 ATOM 29969 O WAT 73 105.806 40.860 129.438 1.00 0.00 O ATOM 29970 H1 WAT 73 105.482 40.752 128.544 1.00 0.00 H ATOM 29971 H2 WAT 73 105.016 40.909 129.975 1.00 0.00 H TER 29973 WAT 73 ATOM 29973 O WAT 74 9.903 76.534 90.298 1.00 0.00 O ATOM 29974 H1 WAT 74 9.732 76.845 89.409 1.00 0.00 H ATOM 29975 H2 WAT 74 9.209 76.928 90.827 1.00 0.00 H TER 29977 WAT 74 ATOM 29977 O WAT 75 7.733 72.128 147.692 1.00 0.00 O ATOM 29978 H1 WAT 75 7.749 71.996 148.640 1.00 0.00 H ATOM 29979 H2 WAT 75 8.648 72.283 147.456 1.00 0.00 H TER 29981 WAT 75 ATOM 29981 O WAT 76 25.322 18.309 63.493 1.00 0.00 O ATOM 29982 H1 WAT 76 26.150 17.832 63.542 1.00 0.00 H ATOM 29983 H2 WAT 76 24.828 17.862 62.805 1.00 0.00 H TER 29985 WAT 76 ATOM 29985 O WAT 77 42.269 114.742 150.356 1.00 0.00 O ATOM 29986 H1 WAT 77 42.462 115.212 151.167 1.00 0.00 H ATOM 29987 H2 WAT 77 43.109 114.697 149.900 1.00 0.00 H TER 29989 WAT 77 ATOM 29989 O WAT 78 134.002 126.739 122.319 1.00 0.00 O ATOM 29990 H1 WAT 78 134.027 125.824 122.599 1.00 0.00 H ATOM 29991 H2 WAT 78 134.919 126.968 122.165 1.00 0.00 H TER 29993 WAT 78 ATOM 29993 O WAT 79 4.416 117.317 0.305 1.00 0.00 O ATOM 29994 H1 WAT 79 3.742 116.794 -0.129 1.00 0.00 H ATOM 29995 H2 WAT 79 4.287 118.203 -0.034 1.00 0.00 H TER 29997 WAT 79 ATOM 29997 O WAT 80 12.288 133.910 0.746 1.00 0.00 O ATOM 29998 H1 WAT 80 11.806 134.031 -0.073 1.00 0.00 H ATOM 29999 H2 WAT 80 11.959 133.083 1.097 1.00 0.00 H TER 30001 WAT 80 ATOM 30001 O WAT 81 128.629 113.083 88.888 1.00 0.00 O ATOM 30002 H1 WAT 81 128.311 112.413 89.492 1.00 0.00 H ATOM 30003 H2 WAT 81 127.860 113.324 88.371 1.00 0.00 H TER 30005 WAT 81 ATOM 30005 O WAT 82 21.135 99.738 84.894 1.00 0.00 O ATOM 30006 H1 WAT 82 20.641 100.292 85.499 1.00 0.00 H ATOM 30007 H2 WAT 82 20.783 98.858 85.035 1.00 0.00 H TER 30009 WAT 82 ATOM 30009 O WAT 83 17.649 37.177 11.748 1.00 0.00 O ATOM 30010 H1 WAT 83 18.397 36.875 11.233 1.00 0.00 H ATOM 30011 H2 WAT 83 16.924 36.618 11.469 1.00 0.00 H TER 30013 WAT 83 ATOM 30013 O WAT 84 116.255 114.524 150.530 1.00 0.00 O ATOM 30014 H1 WAT 84 116.546 115.151 149.868 1.00 0.00 H ATOM 30015 H2 WAT 84 115.773 115.053 151.166 1.00 0.00 H TER 30017 WAT 84 ATOM 30017 O WAT 85 11.528 5.257 120.272 1.00 0.00 O ATOM 30018 H1 WAT 85 12.194 4.595 120.457 1.00 0.00 H ATOM 30019 H2 WAT 85 11.751 5.586 119.402 1.00 0.00 H TER 30021 WAT 85 ATOM 30021 O WAT 86 125.298 127.745 94.083 1.00 0.00 O ATOM 30022 H1 WAT 86 124.576 127.224 94.434 1.00 0.00 H ATOM 30023 H2 WAT 86 125.079 128.647 94.318 1.00 0.00 H TER 30025 WAT 86 ATOM 30025 O WAT 87 95.926 47.565 145.844 1.00 0.00 O ATOM 30026 H1 WAT 87 96.303 47.872 145.020 1.00 0.00 H ATOM 30027 H2 WAT 87 95.667 46.661 145.667 1.00 0.00 H TER 30029 WAT 87 ATOM 30029 O WAT 88 133.716 124.172 89.504 1.00 0.00 O ATOM 30030 H1 WAT 88 134.186 124.961 89.233 1.00 0.00 H ATOM 30031 H2 WAT 88 133.546 123.703 88.687 1.00 0.00 H TER 30033 WAT 88 ATOM 30033 O WAT 89 59.178 96.823 110.783 1.00 0.00 O ATOM 30034 H1 WAT 89 59.418 97.290 109.982 1.00 0.00 H ATOM 30035 H2 WAT 89 59.631 97.295 111.481 1.00 0.00 H TER 30037 WAT 89 ATOM 30037 O WAT 90 106.678 18.686 1.637 1.00 0.00 O ATOM 30038 H1 WAT 90 107.052 17.812 1.750 1.00 0.00 H ATOM 30039 H2 WAT 90 106.201 18.637 0.808 1.00 0.00 H TER 30041 WAT 90 ATOM 30041 O WAT 91 59.595 122.583 142.122 1.00 0.00 O ATOM 30042 H1 WAT 91 59.318 121.792 142.585 1.00 0.00 H ATOM 30043 H2 WAT 91 59.409 122.400 141.202 1.00 0.00 H TER 30045 WAT 91 ATOM 30045 O WAT 92 134.613 26.307 87.386 1.00 0.00 O ATOM 30046 H1 WAT 92 133.706 26.454 87.654 1.00 0.00 H ATOM 30047 H2 WAT 92 135.084 26.161 88.206 1.00 0.00 H TER 30049 WAT 92 ATOM 30049 O WAT 93 132.490 23.442 117.497 1.00 0.00 O ATOM 30050 H1 WAT 93 131.988 22.811 116.981 1.00 0.00 H ATOM 30051 H2 WAT 93 133.189 22.922 117.896 1.00 0.00 H TER 30053 WAT 93 ATOM 30053 O WAT 94 145.480 113.820 18.275 1.00 0.00 O ATOM 30054 H1 WAT 94 146.061 113.121 18.576 1.00 0.00 H ATOM 30055 H2 WAT 94 145.030 114.114 19.066 1.00 0.00 H TER 30057 WAT 94 ATOM 30057 O WAT 95 97.745 19.469 68.623 1.00 0.00 O ATOM 30058 H1 WAT 95 97.813 20.036 69.392 1.00 0.00 H ATOM 30059 H2 WAT 95 97.766 18.581 68.978 1.00 0.00 H TER 30061 WAT 95 ATOM 30061 O WAT 96 47.826 114.637 113.005 1.00 0.00 O ATOM 30062 H1 WAT 96 47.067 114.351 113.513 1.00 0.00 H ATOM 30063 H2 WAT 96 48.194 113.828 112.649 1.00 0.00 H TER 30065 WAT 96 ATOM 30065 O WAT 97 54.290 94.698 8.307 1.00 0.00 O ATOM 30066 H1 WAT 97 54.418 95.519 8.783 1.00 0.00 H ATOM 30067 H2 WAT 97 55.168 94.324 8.235 1.00 0.00 H TER 30069 WAT 97 ATOM 30069 O WAT 98 56.338 34.318 87.339 1.00 0.00 O ATOM 30070 H1 WAT 98 56.069 34.475 88.244 1.00 0.00 H ATOM 30071 H2 WAT 98 55.706 33.678 87.009 1.00 0.00 H TER 30073 WAT 98 ATOM 30073 O WAT 99 144.012 9.874 79.399 1.00 0.00 O ATOM 30074 H1 WAT 99 143.701 10.243 78.573 1.00 0.00 H ATOM 30075 H2 WAT 99 143.899 10.580 80.035 1.00 0.00 H TER 30077 WAT 99 ATOM 30077 O WAT 100 46.363 82.023 153.252 1.00 0.00 O ATOM 30078 H1 WAT 100 46.483 82.520 152.443 1.00 0.00 H ATOM 30079 H2 WAT 100 47.249 81.776 153.515 1.00 0.00 H TER 30081 WAT 100 ATOM 30081 O WAT 101 38.179 101.762 118.810 1.00 0.00 O ATOM 30082 H1 WAT 101 38.871 101.245 119.223 1.00 0.00 H ATOM 30083 H2 WAT 101 37.375 101.474 119.243 1.00 0.00 H TER 30085 WAT 101 ATOM 30085 O WAT 102 122.525 40.938 77.647 1.00 0.00 O ATOM 30086 H1 WAT 102 123.449 41.055 77.869 1.00 0.00 H ATOM 30087 H2 WAT 102 122.052 41.417 78.327 1.00 0.00 H TER 30089 WAT 102 ATOM 30089 O WAT 103 4.065 100.914 65.141 1.00 0.00 O ATOM 30090 H1 WAT 103 3.889 100.103 64.664 1.00 0.00 H ATOM 30091 H2 WAT 103 3.826 100.716 66.046 1.00 0.00 H TER 30093 WAT 103 ATOM 30093 O WAT 104 12.580 127.679 81.382 1.00 0.00 O ATOM 30094 H1 WAT 104 12.308 127.389 80.512 1.00 0.00 H ATOM 30095 H2 WAT 104 13.275 127.069 81.631 1.00 0.00 H TER 30097 WAT 104 ATOM 30097 O WAT 105 100.033 114.438 17.144 1.00 0.00 O ATOM 30098 H1 WAT 105 100.493 114.703 16.347 1.00 0.00 H ATOM 30099 H2 WAT 105 100.419 113.593 17.374 1.00 0.00 H TER 30101 WAT 105 ATOM 30101 O WAT 106 44.569 64.209 135.449 1.00 0.00 O ATOM 30102 H1 WAT 106 43.677 64.315 135.780 1.00 0.00 H ATOM 30103 H2 WAT 106 44.485 64.303 134.500 1.00 0.00 H TER 30105 WAT 106 ATOM 30105 O WAT 107 16.243 98.124 113.343 1.00 0.00 O ATOM 30106 H1 WAT 107 16.839 98.833 113.102 1.00 0.00 H ATOM 30107 H2 WAT 107 16.035 97.694 112.514 1.00 0.00 H TER 30109 WAT 107 ATOM 30109 O WAT 108 81.870 14.401 7.529 1.00 0.00 O ATOM 30110 H1 WAT 108 81.851 13.487 7.813 1.00 0.00 H ATOM 30111 H2 WAT 108 81.338 14.416 6.734 1.00 0.00 H TER 30113 WAT 108 ATOM 30113 O WAT 109 55.824 47.978 150.989 1.00 0.00 O ATOM 30114 H1 WAT 109 55.955 47.689 150.086 1.00 0.00 H ATOM 30115 H2 WAT 109 56.552 48.575 151.158 1.00 0.00 H TER 30117 WAT 109 ATOM 30117 O WAT 110 79.776 48.881 107.964 1.00 0.00 O ATOM 30118 H1 WAT 110 80.403 48.239 108.295 1.00 0.00 H ATOM 30119 H2 WAT 110 80.218 49.723 108.067 1.00 0.00 H TER 30121 WAT 110 ATOM 30121 O WAT 111 57.463 62.084 18.408 1.00 0.00 O ATOM 30122 H1 WAT 111 58.255 62.132 18.943 1.00 0.00 H ATOM 30123 H2 WAT 111 57.764 62.268 17.518 1.00 0.00 H TER 30125 WAT 111 ATOM 30125 O WAT 112 32.671 83.367 24.115 1.00 0.00 O ATOM 30126 H1 WAT 112 33.266 83.758 23.476 1.00 0.00 H ATOM 30127 H2 WAT 112 33.185 82.673 24.528 1.00 0.00 H TER 30129 WAT 112 ATOM 30129 O WAT 113 25.695 55.868 139.193 1.00 0.00 O ATOM 30130 H1 WAT 113 24.895 56.194 138.778 1.00 0.00 H ATOM 30131 H2 WAT 113 25.525 55.941 140.132 1.00 0.00 H TER 30133 WAT 113 ATOM 30133 O WAT 114 26.235 94.587 140.464 1.00 0.00 O ATOM 30134 H1 WAT 114 26.890 95.013 141.017 1.00 0.00 H ATOM 30135 H2 WAT 114 26.402 93.651 140.572 1.00 0.00 H TER 30137 WAT 114 ATOM 30137 O WAT 115 46.891 24.634 108.695 1.00 0.00 O ATOM 30138 H1 WAT 115 47.523 23.917 108.741 1.00 0.00 H ATOM 30139 H2 WAT 115 47.353 25.384 109.070 1.00 0.00 H TER 30141 WAT 115 ATOM 30141 O WAT 116 79.762 71.500 124.604 1.00 0.00 O ATOM 30142 H1 WAT 116 80.054 71.435 123.695 1.00 0.00 H ATOM 30143 H2 WAT 116 78.979 70.950 124.644 1.00 0.00 H TER 30145 WAT 116 ATOM 30145 O WAT 117 31.720 102.432 86.153 1.00 0.00 O ATOM 30146 H1 WAT 117 31.157 102.707 85.430 1.00 0.00 H ATOM 30147 H2 WAT 117 31.209 102.619 86.940 1.00 0.00 H TER 30149 WAT 117 ATOM 30149 O WAT 118 57.078 28.710 150.838 1.00 0.00 O ATOM 30150 H1 WAT 118 57.551 29.423 150.410 1.00 0.00 H ATOM 30151 H2 WAT 118 56.165 29.000 150.847 1.00 0.00 H TER 30153 WAT 118 ATOM 30153 O WAT 119 50.361 108.868 102.227 1.00 0.00 O ATOM 30154 H1 WAT 119 50.826 109.205 101.462 1.00 0.00 H ATOM 30155 H2 WAT 119 49.896 108.096 101.904 1.00 0.00 H TER 30157 WAT 119 ATOM 30157 O WAT 120 111.972 51.964 130.212 1.00 0.00 O ATOM 30158 H1 WAT 120 111.485 51.405 130.818 1.00 0.00 H ATOM 30159 H2 WAT 120 112.686 52.323 130.740 1.00 0.00 H TER 30161 WAT 120 ATOM 30161 O WAT 121 62.006 129.983 136.620 1.00 0.00 O ATOM 30162 H1 WAT 121 62.394 130.207 137.466 1.00 0.00 H ATOM 30163 H2 WAT 121 61.942 129.028 136.632 1.00 0.00 H TER 30165 WAT 121 ATOM 30165 O WAT 122 88.526 89.435 10.602 1.00 0.00 O ATOM 30166 H1 WAT 122 88.527 88.738 11.258 1.00 0.00 H ATOM 30167 H2 WAT 122 87.611 89.711 10.546 1.00 0.00 H TER 30169 WAT 122 ATOM 30169 O WAT 123 14.360 122.884 111.032 1.00 0.00 O ATOM 30170 H1 WAT 123 15.148 122.691 111.540 1.00 0.00 H ATOM 30171 H2 WAT 123 14.082 123.747 111.340 1.00 0.00 H TER 30173 WAT 123 ATOM 30173 O WAT 124 26.458 51.030 110.768 1.00 0.00 O ATOM 30174 H1 WAT 124 26.134 50.622 109.965 1.00 0.00 H ATOM 30175 H2 WAT 124 25.756 50.896 111.405 1.00 0.00 H TER 30177 WAT 124 ATOM 30177 O WAT 125 58.409 128.918 129.521 1.00 0.00 O ATOM 30178 H1 WAT 125 59.046 128.929 130.235 1.00 0.00 H ATOM 30179 H2 WAT 125 58.845 128.436 128.818 1.00 0.00 H TER 30181 WAT 125 ATOM 30181 O WAT 126 93.149 60.271 146.314 1.00 0.00 O ATOM 30182 H1 WAT 126 92.710 59.614 145.774 1.00 0.00 H ATOM 30183 H2 WAT 126 92.757 60.169 147.181 1.00 0.00 H TER 30185 WAT 126 ATOM 30185 O WAT 127 27.053 20.488 66.682 1.00 0.00 O ATOM 30186 H1 WAT 127 26.518 21.049 66.120 1.00 0.00 H ATOM 30187 H2 WAT 127 26.799 19.597 66.443 1.00 0.00 H TER 30189 WAT 127 ATOM 30189 O WAT 128 73.939 78.092 12.496 1.00 0.00 O ATOM 30190 H1 WAT 128 73.672 78.853 13.012 1.00 0.00 H ATOM 30191 H2 WAT 128 74.257 78.462 11.672 1.00 0.00 H TER 30193 WAT 128 ATOM 30193 O WAT 129 65.396 117.524 8.887 1.00 0.00 O ATOM 30194 H1 WAT 129 65.016 118.400 8.826 1.00 0.00 H ATOM 30195 H2 WAT 129 66.068 117.601 9.565 1.00 0.00 H TER 30197 WAT 129 ATOM 30197 O WAT 130 134.262 91.649 23.696 1.00 0.00 O ATOM 30198 H1 WAT 130 134.938 92.142 24.161 1.00 0.00 H ATOM 30199 H2 WAT 130 133.436 92.009 24.020 1.00 0.00 H TER 30201 WAT 130 ATOM 30201 O WAT 131 59.319 97.856 153.539 1.00 0.00 O ATOM 30202 H1 WAT 131 60.065 97.319 153.272 1.00 0.00 H ATOM 30203 H2 WAT 131 59.698 98.712 153.738 1.00 0.00 H TER 30205 WAT 131 ATOM 30205 O WAT 132 121.422 86.946 135.196 1.00 0.00 O ATOM 30206 H1 WAT 132 122.057 86.621 134.558 1.00 0.00 H ATOM 30207 H2 WAT 132 121.899 87.611 135.692 1.00 0.00 H TER 30209 WAT 132 ATOM 30209 O WAT 133 64.455 86.767 3.567 1.00 0.00 O ATOM 30210 H1 WAT 133 65.029 86.548 2.833 1.00 0.00 H ATOM 30211 H2 WAT 133 65.053 87.012 4.273 1.00 0.00 H TER 30213 WAT 133 ATOM 30213 O WAT 134 52.267 73.019 24.843 1.00 0.00 O ATOM 30214 H1 WAT 134 51.559 73.102 25.481 1.00 0.00 H ATOM 30215 H2 WAT 134 52.415 72.076 24.771 1.00 0.00 H TER 30217 WAT 134 ATOM 30217 O WAT 135 24.674 87.236 22.649 1.00 0.00 O ATOM 30218 H1 WAT 135 23.743 87.432 22.547 1.00 0.00 H ATOM 30219 H2 WAT 135 24.965 87.814 23.354 1.00 0.00 H TER 30221 WAT 135 ATOM 30221 O WAT 136 74.846 109.375 151.282 1.00 0.00 O ATOM 30222 H1 WAT 136 75.015 108.486 151.595 1.00 0.00 H ATOM 30223 H2 WAT 136 75.363 109.448 150.480 1.00 0.00 H TER 30225 WAT 136 ATOM 30225 O WAT 137 127.836 111.220 1.040 1.00 0.00 O ATOM 30226 H1 WAT 137 128.474 111.815 1.435 1.00 0.00 H ATOM 30227 H2 WAT 137 127.157 111.120 1.707 1.00 0.00 H TER 30229 WAT 137 ATOM 30229 O WAT 138 34.767 124.859 143.340 1.00 0.00 O ATOM 30230 H1 WAT 138 35.632 124.800 142.934 1.00 0.00 H ATOM 30231 H2 WAT 138 34.868 125.523 144.022 1.00 0.00 H TER 30233 WAT 138 ATOM 30233 O WAT 139 108.959 51.075 97.396 1.00 0.00 O ATOM 30234 H1 WAT 139 109.498 51.817 97.670 1.00 0.00 H ATOM 30235 H2 WAT 139 108.829 50.565 98.196 1.00 0.00 H TER 30237 WAT 139 ATOM 30237 O WAT 140 105.482 65.383 75.025 1.00 0.00 O ATOM 30238 H1 WAT 140 105.689 65.405 74.091 1.00 0.00 H ATOM 30239 H2 WAT 140 104.654 65.857 75.098 1.00 0.00 H TER 30241 WAT 140 ATOM 30241 O WAT 141 18.035 47.410 61.737 1.00 0.00 O ATOM 30242 H1 WAT 141 17.510 47.203 60.964 1.00 0.00 H ATOM 30243 H2 WAT 141 18.178 48.355 61.684 1.00 0.00 H TER 30245 WAT 141 ATOM 30245 O WAT 142 40.187 89.470 103.248 1.00 0.00 O ATOM 30246 H1 WAT 142 39.269 89.204 103.196 1.00 0.00 H ATOM 30247 H2 WAT 142 40.431 89.311 104.160 1.00 0.00 H TER 30249 WAT 142 ATOM 30249 O WAT 143 7.083 77.852 7.534 1.00 0.00 O ATOM 30250 H1 WAT 143 7.460 77.877 8.414 1.00 0.00 H ATOM 30251 H2 WAT 143 7.825 78.014 6.951 1.00 0.00 H TER 30253 WAT 143 ATOM 30253 O WAT 144 35.224 54.272 72.972 1.00 0.00 O ATOM 30254 H1 WAT 144 34.352 54.370 73.355 1.00 0.00 H ATOM 30255 H2 WAT 144 35.209 54.836 72.198 1.00 0.00 H TER 30257 WAT 144 ATOM 30257 O WAT 145 56.790 63.564 88.908 1.00 0.00 O ATOM 30258 H1 WAT 145 55.846 63.603 89.060 1.00 0.00 H ATOM 30259 H2 WAT 145 56.879 63.135 88.057 1.00 0.00 H TER 30261 WAT 145 ATOM 30261 O WAT 146 77.792 95.810 108.363 1.00 0.00 O ATOM 30262 H1 WAT 146 78.356 96.563 108.185 1.00 0.00 H ATOM 30263 H2 WAT 146 78.377 95.054 108.304 1.00 0.00 H TER 30265 WAT 146 ATOM 30265 O WAT 147 1.034 60.827 15.561 1.00 0.00 O ATOM 30266 H1 WAT 147 1.522 60.062 15.256 1.00 0.00 H ATOM 30267 H2 WAT 147 1.707 61.479 15.755 1.00 0.00 H TER 30269 WAT 147 ATOM 30269 O WAT 148 25.973 49.241 131.830 1.00 0.00 O ATOM 30270 H1 WAT 148 25.948 48.657 131.072 1.00 0.00 H ATOM 30271 H2 WAT 148 26.814 49.055 132.248 1.00 0.00 H TER 30273 WAT 148 ATOM 30273 O WAT 149 75.420 6.854 151.168 1.00 0.00 O ATOM 30274 H1 WAT 149 75.327 7.692 150.715 1.00 0.00 H ATOM 30275 H2 WAT 149 76.335 6.609 151.034 1.00 0.00 H TER 30277 WAT 149 ATOM 30277 O WAT 150 8.893 35.315 116.227 1.00 0.00 O ATOM 30278 H1 WAT 150 9.450 34.669 116.662 1.00 0.00 H ATOM 30279 H2 WAT 150 9.505 35.873 115.746 1.00 0.00 H TER 30281 WAT 150 ATOM 30281 O WAT 151 104.438 15.190 15.110 1.00 0.00 O ATOM 30282 H1 WAT 151 103.685 14.720 15.468 1.00 0.00 H ATOM 30283 H2 WAT 151 104.140 16.097 15.035 1.00 0.00 H TER 30285 WAT 151 ATOM 30285 O WAT 152 43.269 132.790 80.872 1.00 0.00 O ATOM 30286 H1 WAT 152 42.754 132.707 81.675 1.00 0.00 H ATOM 30287 H2 WAT 152 42.727 133.327 80.295 1.00 0.00 H TER 30289 WAT 152 ATOM 30289 O WAT 153 101.938 94.719 83.224 1.00 0.00 O ATOM 30290 H1 WAT 153 102.869 94.626 83.425 1.00 0.00 H ATOM 30291 H2 WAT 153 101.519 94.835 84.077 1.00 0.00 H TER 30293 WAT 153 ATOM 30293 O WAT 154 134.415 134.427 92.390 1.00 0.00 O ATOM 30294 H1 WAT 154 134.913 135.204 92.643 1.00 0.00 H ATOM 30295 H2 WAT 154 134.170 134.585 91.478 1.00 0.00 H TER 30297 WAT 154 ATOM 30297 O WAT 155 45.723 111.710 115.299 1.00 0.00 O ATOM 30298 H1 WAT 155 45.282 111.736 116.148 1.00 0.00 H ATOM 30299 H2 WAT 155 45.969 112.619 115.129 1.00 0.00 H TER 30301 WAT 155 ATOM 30301 O WAT 156 100.122 37.015 143.254 1.00 0.00 O ATOM 30302 H1 WAT 156 99.504 37.584 143.713 1.00 0.00 H ATOM 30303 H2 WAT 156 100.890 36.986 143.824 1.00 0.00 H TER 30305 WAT 156 ATOM 30305 O WAT 157 39.531 24.156 3.948 1.00 0.00 O ATOM 30306 H1 WAT 157 38.772 23.604 3.761 1.00 0.00 H ATOM 30307 H2 WAT 157 39.361 24.512 4.820 1.00 0.00 H TER 30309 WAT 157 ATOM 30309 O WAT 158 67.454 49.548 73.556 1.00 0.00 O ATOM 30310 H1 WAT 158 66.999 50.010 72.852 1.00 0.00 H ATOM 30311 H2 WAT 158 68.308 49.327 73.185 1.00 0.00 H TER 30313 WAT 158 ATOM 30313 O WAT 159 58.365 121.293 110.960 1.00 0.00 O ATOM 30314 H1 WAT 159 59.061 121.590 110.373 1.00 0.00 H ATOM 30315 H2 WAT 159 57.776 120.790 110.398 1.00 0.00 H TER 30317 WAT 159 ATOM 30317 O WAT 160 9.280 98.413 128.819 1.00 0.00 O ATOM 30318 H1 WAT 160 8.744 99.094 129.225 1.00 0.00 H ATOM 30319 H2 WAT 160 9.945 98.893 128.326 1.00 0.00 H TER 30321 WAT 160 ATOM 30321 O WAT 161 76.818 71.082 114.470 1.00 0.00 O ATOM 30322 H1 WAT 161 76.535 71.819 115.011 1.00 0.00 H ATOM 30323 H2 WAT 161 77.133 70.431 115.098 1.00 0.00 H TER 30325 WAT 161 ATOM 30325 O WAT 162 82.869 58.472 89.977 1.00 0.00 O ATOM 30326 H1 WAT 162 82.869 57.624 89.532 1.00 0.00 H ATOM 30327 H2 WAT 162 82.236 58.370 90.687 1.00 0.00 H TER 30329 WAT 162 ATOM 30329 O WAT 163 15.409 28.535 89.418 1.00 0.00 O ATOM 30330 H1 WAT 163 14.702 28.199 89.968 1.00 0.00 H ATOM 30331 H2 WAT 163 15.800 29.240 89.934 1.00 0.00 H TER 30333 WAT 163 ATOM 30333 O WAT 164 95.430 57.170 135.799 1.00 0.00 O ATOM 30334 H1 WAT 164 95.204 57.725 136.545 1.00 0.00 H ATOM 30335 H2 WAT 164 95.085 56.307 136.029 1.00 0.00 H TER 30337 WAT 164 ATOM 30337 O WAT 165 42.796 124.692 131.679 1.00 0.00 O ATOM 30338 H1 WAT 165 42.230 124.100 132.175 1.00 0.00 H ATOM 30339 H2 WAT 165 42.505 125.569 131.931 1.00 0.00 H TER 30341 WAT 165 ATOM 30341 O WAT 166 86.992 110.748 66.102 1.00 0.00 O ATOM 30342 H1 WAT 166 87.742 111.080 65.609 1.00 0.00 H ATOM 30343 H2 WAT 166 87.283 109.902 66.441 1.00 0.00 H TER 30345 WAT 166 ATOM 30345 O WAT 167 106.354 141.119 131.362 1.00 0.00 O ATOM 30346 H1 WAT 167 106.005 140.683 132.140 1.00 0.00 H ATOM 30347 H2 WAT 167 106.164 140.515 130.644 1.00 0.00 H TER 30349 WAT 167 ATOM 30349 O WAT 168 87.235 48.611 123.423 1.00 0.00 O ATOM 30350 H1 WAT 168 86.824 48.017 124.051 1.00 0.00 H ATOM 30351 H2 WAT 168 88.094 48.225 123.254 1.00 0.00 H TER 30353 WAT 168 ATOM 30353 O WAT 169 53.590 91.297 103.541 1.00 0.00 O ATOM 30354 H1 WAT 169 54.302 90.742 103.223 1.00 0.00 H ATOM 30355 H2 WAT 169 53.391 90.956 104.413 1.00 0.00 H TER 30357 WAT 169 ATOM 30357 O WAT 170 98.812 92.750 80.264 1.00 0.00 O ATOM 30358 H1 WAT 170 99.749 92.921 80.354 1.00 0.00 H ATOM 30359 H2 WAT 170 98.556 93.231 79.477 1.00 0.00 H TER 30361 WAT 170 ATOM 30361 O WAT 171 0.606 49.287 122.598 1.00 0.00 O ATOM 30362 H1 WAT 171 1.533 49.481 122.738 1.00 0.00 H ATOM 30363 H2 WAT 171 0.368 48.716 123.329 1.00 0.00 H TER 30365 WAT 171 ATOM 30365 O WAT 172 64.768 143.278 142.048 1.00 0.00 O ATOM 30366 H1 WAT 172 65.404 143.041 142.723 1.00 0.00 H ATOM 30367 H2 WAT 172 65.279 143.315 141.239 1.00 0.00 H TER 30369 WAT 172 ATOM 30369 O WAT 173 124.325 139.475 5.813 1.00 0.00 O ATOM 30370 H1 WAT 173 124.041 139.603 6.718 1.00 0.00 H ATOM 30371 H2 WAT 173 125.132 139.984 5.740 1.00 0.00 H TER 30373 WAT 173 ATOM 30373 O WAT 174 103.924 15.965 73.370 1.00 0.00 O ATOM 30374 H1 WAT 174 104.573 15.744 74.038 1.00 0.00 H ATOM 30375 H2 WAT 174 103.101 16.041 73.852 1.00 0.00 H TER 30377 WAT 174 ATOM 30377 O WAT 175 52.450 68.780 68.501 1.00 0.00 O ATOM 30378 H1 WAT 175 52.480 69.590 67.992 1.00 0.00 H ATOM 30379 H2 WAT 175 52.620 69.056 69.401 1.00 0.00 H TER 30381 WAT 175 ATOM 30381 O WAT 176 117.959 99.058 25.621 1.00 0.00 O ATOM 30382 H1 WAT 176 117.692 98.147 25.496 1.00 0.00 H ATOM 30383 H2 WAT 176 118.607 99.213 24.935 1.00 0.00 H TER 30385 WAT 176 ATOM 30385 O WAT 177 103.734 71.862 75.683 1.00 0.00 O ATOM 30386 H1 WAT 177 103.338 72.404 75.001 1.00 0.00 H ATOM 30387 H2 WAT 177 103.926 72.473 76.394 1.00 0.00 H TER 30389 WAT 177 ATOM 30389 O WAT 178 88.197 95.692 24.793 1.00 0.00 O ATOM 30390 H1 WAT 178 88.890 95.126 25.134 1.00 0.00 H ATOM 30391 H2 WAT 178 87.671 95.917 25.561 1.00 0.00 H TER 30393 WAT 178 ATOM 30393 O WAT 179 110.893 43.425 18.788 1.00 0.00 O ATOM 30394 H1 WAT 179 111.730 43.170 19.176 1.00 0.00 H ATOM 30395 H2 WAT 179 111.053 44.296 18.425 1.00 0.00 H TER 30397 WAT 179 ATOM 30397 O WAT 180 8.037 128.723 0.112 1.00 0.00 O ATOM 30398 H1 WAT 180 8.268 129.537 0.560 1.00 0.00 H ATOM 30399 H2 WAT 180 7.519 128.236 0.753 1.00 0.00 H TER 30401 WAT 180 ATOM 30401 O WAT 181 20.559 103.643 138.960 1.00 0.00 O ATOM 30402 H1 WAT 181 19.810 103.160 139.310 1.00 0.00 H ATOM 30403 H2 WAT 181 20.927 104.097 139.718 1.00 0.00 H TER 30405 WAT 181 ATOM 30405 O WAT 182 65.850 94.161 54.564 1.00 0.00 O ATOM 30406 H1 WAT 182 66.782 94.007 54.413 1.00 0.00 H ATOM 30407 H2 WAT 182 65.612 93.535 55.248 1.00 0.00 H TER 30409 WAT 182 ATOM 30409 O WAT 183 3.799 112.486 73.126 1.00 0.00 O ATOM 30410 H1 WAT 183 2.885 112.207 73.068 1.00 0.00 H ATOM 30411 H2 WAT 183 3.753 113.431 73.272 1.00 0.00 H TER 30413 WAT 183 ATOM 30413 O WAT 184 113.502 3.972 144.018 1.00 0.00 O ATOM 30414 H1 WAT 184 113.257 4.443 143.221 1.00 0.00 H ATOM 30415 H2 WAT 184 113.629 3.068 143.732 1.00 0.00 H TER 30417 WAT 184 ATOM 30417 O WAT 185 138.571 113.885 105.515 1.00 0.00 O ATOM 30418 H1 WAT 185 138.104 114.367 104.833 1.00 0.00 H ATOM 30419 H2 WAT 185 138.010 113.960 106.287 1.00 0.00 H TER 30421 WAT 185 ATOM 30421 O WAT 186 25.976 35.277 77.218 1.00 0.00 O ATOM 30422 H1 WAT 186 25.888 36.048 76.657 1.00 0.00 H ATOM 30423 H2 WAT 186 25.201 34.750 77.021 1.00 0.00 H TER 30425 WAT 186 ATOM 30425 O WAT 187 66.972 102.698 28.004 1.00 0.00 O ATOM 30426 H1 WAT 187 67.381 102.122 27.358 1.00 0.00 H ATOM 30427 H2 WAT 187 66.197 102.218 28.296 1.00 0.00 H TER 30429 WAT 187 ATOM 30429 O WAT 188 85.878 8.972 68.671 1.00 0.00 O ATOM 30430 H1 WAT 188 85.234 8.519 68.127 1.00 0.00 H ATOM 30431 H2 WAT 188 85.844 8.516 69.512 1.00 0.00 H TER 30433 WAT 188 ATOM 30433 O WAT 189 89.139 1.196 89.392 1.00 0.00 O ATOM 30434 H1 WAT 189 88.980 1.805 90.113 1.00 0.00 H ATOM 30435 H2 WAT 189 89.970 0.775 89.613 1.00 0.00 H TER 30437 WAT 189 ATOM 30437 O WAT 190 21.311 116.662 119.130 1.00 0.00 O ATOM 30438 H1 WAT 190 21.618 116.943 119.992 1.00 0.00 H ATOM 30439 H2 WAT 190 22.059 116.807 118.551 1.00 0.00 H TER 30441 WAT 190 ATOM 30441 O WAT 191 89.750 4.087 138.780 1.00 0.00 O ATOM 30442 H1 WAT 191 88.910 4.103 139.237 1.00 0.00 H ATOM 30443 H2 WAT 191 90.320 4.648 139.305 1.00 0.00 H TER 30445 WAT 191 ATOM 30445 O WAT 192 92.402 94.632 122.681 1.00 0.00 O ATOM 30446 H1 WAT 192 92.078 95.522 122.540 1.00 0.00 H ATOM 30447 H2 WAT 192 91.834 94.082 122.141 1.00 0.00 H TER 30449 WAT 192 ATOM 30449 O WAT 193 25.088 16.558 127.067 1.00 0.00 O ATOM 30450 H1 WAT 193 24.460 15.862 127.264 1.00 0.00 H ATOM 30451 H2 WAT 193 24.754 17.322 127.537 1.00 0.00 H TER 30453 WAT 193 ATOM 30453 O WAT 194 122.178 116.195 91.049 1.00 0.00 O ATOM 30454 H1 WAT 194 121.952 115.902 90.166 1.00 0.00 H ATOM 30455 H2 WAT 194 122.768 115.519 91.382 1.00 0.00 H TER 30457 WAT 194 ATOM 30457 O WAT 195 116.285 70.682 122.253 1.00 0.00 O ATOM 30458 H1 WAT 195 115.336 70.571 122.201 1.00 0.00 H ATOM 30459 H2 WAT 195 116.620 69.800 122.419 1.00 0.00 H TER 30461 WAT 195 ATOM 30461 O WAT 196 7.311 6.129 102.048 1.00 0.00 O ATOM 30462 H1 WAT 196 7.115 5.222 101.814 1.00 0.00 H ATOM 30463 H2 WAT 196 8.231 6.244 101.811 1.00 0.00 H TER 30465 WAT 196 ATOM 30465 O WAT 197 15.143 43.152 109.272 1.00 0.00 O ATOM 30466 H1 WAT 197 15.635 43.180 110.093 1.00 0.00 H ATOM 30467 H2 WAT 197 14.395 42.585 109.461 1.00 0.00 H TER 30469 WAT 197 ATOM 30469 O WAT 198 98.795 52.382 69.956 1.00 0.00 O ATOM 30470 H1 WAT 198 99.091 51.682 70.538 1.00 0.00 H ATOM 30471 H2 WAT 198 97.860 52.215 69.837 1.00 0.00 H TER 30473 WAT 198 ATOM 30473 O WAT 199 87.652 98.879 119.657 1.00 0.00 O ATOM 30474 H1 WAT 199 87.353 99.474 120.345 1.00 0.00 H ATOM 30475 H2 WAT 199 88.195 99.424 119.088 1.00 0.00 H TER 30477 WAT 199 ATOM 30477 O WAT 200 66.499 14.998 108.757 1.00 0.00 O ATOM 30478 H1 WAT 200 66.560 15.941 108.909 1.00 0.00 H ATOM 30479 H2 WAT 200 65.562 14.808 108.800 1.00 0.00 H TER 30481 WAT 200 ATOM 30481 O WAT 201 125.123 100.437 127.584 1.00 0.00 O ATOM 30482 H1 WAT 201 125.231 101.262 128.057 1.00 0.00 H ATOM 30483 H2 WAT 201 124.192 100.409 127.360 1.00 0.00 H TER 30485 WAT 201 ATOM 30485 O WAT 202 85.325 15.305 14.750 1.00 0.00 O ATOM 30486 H1 WAT 202 84.981 14.964 15.576 1.00 0.00 H ATOM 30487 H2 WAT 202 84.551 15.602 14.273 1.00 0.00 H TER 30489 WAT 202 ATOM 30489 O WAT 203 17.408 83.362 103.476 1.00 0.00 O ATOM 30490 H1 WAT 203 17.810 84.058 102.956 1.00 0.00 H ATOM 30491 H2 WAT 203 17.836 83.425 104.330 1.00 0.00 H TER 30493 WAT 203 ATOM 30493 O WAT 204 91.629 20.689 105.672 1.00 0.00 O ATOM 30494 H1 WAT 204 92.299 21.373 105.639 1.00 0.00 H ATOM 30495 H2 WAT 204 91.451 20.573 106.605 1.00 0.00 H TER 30497 WAT 204 ATOM 30497 O WAT 205 85.267 106.812 83.036 1.00 0.00 O ATOM 30498 H1 WAT 205 84.405 107.215 83.138 1.00 0.00 H ATOM 30499 H2 WAT 205 85.698 106.951 83.880 1.00 0.00 H TER 30501 WAT 205 ATOM 30501 O WAT 206 7.943 131.723 96.866 1.00 0.00 O ATOM 30502 H1 WAT 206 8.015 130.905 96.375 1.00 0.00 H ATOM 30503 H2 WAT 206 8.349 131.532 97.712 1.00 0.00 H TER 30505 WAT 206 ATOM 30505 O WAT 207 15.940 74.711 114.674 1.00 0.00 O ATOM 30506 H1 WAT 207 15.527 75.450 114.228 1.00 0.00 H ATOM 30507 H2 WAT 207 15.217 74.113 114.865 1.00 0.00 H TER 30509 WAT 207 ATOM 30509 O WAT 208 83.709 20.805 4.063 1.00 0.00 O ATOM 30510 H1 WAT 208 84.442 20.540 4.618 1.00 0.00 H ATOM 30511 H2 WAT 208 83.822 20.298 3.259 1.00 0.00 H TER 30513 WAT 208 ATOM 30513 O WAT 209 95.359 38.935 131.084 1.00 0.00 O ATOM 30514 H1 WAT 209 94.621 39.326 131.552 1.00 0.00 H ATOM 30515 H2 WAT 209 95.909 39.678 130.839 1.00 0.00 H TER 30517 WAT 209 ATOM 30517 O WAT 210 65.173 129.534 105.698 1.00 0.00 O ATOM 30518 H1 WAT 210 65.032 129.120 106.549 1.00 0.00 H ATOM 30519 H2 WAT 210 64.919 130.447 105.830 1.00 0.00 H TER 30521 WAT 210 ATOM 30521 O WAT 211 39.363 55.841 122.458 1.00 0.00 O ATOM 30522 H1 WAT 211 39.806 56.006 123.290 1.00 0.00 H ATOM 30523 H2 WAT 211 39.309 54.887 122.400 1.00 0.00 H TER 30525 WAT 211 ATOM 30525 O WAT 212 19.737 96.667 88.160 1.00 0.00 O ATOM 30526 H1 WAT 212 20.149 97.513 88.336 1.00 0.00 H ATOM 30527 H2 WAT 212 20.448 96.032 88.246 1.00 0.00 H TER 30529 WAT 212 ATOM 30529 O WAT 213 5.298 109.075 75.848 1.00 0.00 O ATOM 30530 H1 WAT 213 4.845 109.912 75.748 1.00 0.00 H ATOM 30531 H2 WAT 213 5.637 108.880 74.974 1.00 0.00 H TER 30533 WAT 213 ATOM 30533 O WAT 214 24.181 136.918 133.219 1.00 0.00 O ATOM 30534 H1 WAT 214 25.086 137.227 133.192 1.00 0.00 H ATOM 30535 H2 WAT 214 24.032 136.535 132.355 1.00 0.00 H TER 30537 WAT 214 ATOM 30537 O WAT 215 27.621 98.054 84.398 1.00 0.00 O ATOM 30538 H1 WAT 215 27.045 98.209 83.650 1.00 0.00 H ATOM 30539 H2 WAT 215 27.070 98.222 85.163 1.00 0.00 H TER 30541 WAT 215 ATOM 30541 O WAT 216 125.356 117.781 81.972 1.00 0.00 O ATOM 30542 H1 WAT 216 124.602 117.290 82.300 1.00 0.00 H ATOM 30543 H2 WAT 216 125.752 117.204 81.320 1.00 0.00 H TER 30545 WAT 216 ATOM 30545 O WAT 217 77.971 74.904 139.174 1.00 0.00 O ATOM 30546 H1 WAT 217 78.562 74.576 138.496 1.00 0.00 H ATOM 30547 H2 WAT 217 77.825 75.821 138.941 1.00 0.00 H TER 30549 WAT 217 ATOM 30549 O WAT 218 69.879 101.925 150.438 1.00 0.00 O ATOM 30550 H1 WAT 218 70.029 102.363 151.276 1.00 0.00 H ATOM 30551 H2 WAT 218 69.322 102.530 149.948 1.00 0.00 H TER 30553 WAT 218 ATOM 30553 O WAT 219 141.516 128.010 68.355 1.00 0.00 O ATOM 30554 H1 WAT 219 141.678 128.514 69.153 1.00 0.00 H ATOM 30555 H2 WAT 219 140.852 127.368 68.607 1.00 0.00 H TER 30557 WAT 219 ATOM 30557 O WAT 220 131.960 123.606 130.503 1.00 0.00 O ATOM 30558 H1 WAT 220 132.826 123.197 130.502 1.00 0.00 H ATOM 30559 H2 WAT 220 131.673 123.555 131.415 1.00 0.00 H TER 30561 WAT 220 ATOM 30561 O WAT 221 119.906 94.162 91.249 1.00 0.00 O ATOM 30562 H1 WAT 221 119.178 93.881 91.804 1.00 0.00 H ATOM 30563 H2 WAT 221 120.667 94.154 91.830 1.00 0.00 H TER 30565 WAT 221 ATOM 30565 O WAT 222 97.295 122.485 132.729 1.00 0.00 O ATOM 30566 H1 WAT 222 97.286 123.059 133.495 1.00 0.00 H ATOM 30567 H2 WAT 222 96.612 121.838 132.906 1.00 0.00 H TER 30569 WAT 222 ATOM 30569 O WAT 223 115.580 39.506 115.066 1.00 0.00 O ATOM 30570 H1 WAT 223 116.007 38.795 114.588 1.00 0.00 H ATOM 30571 H2 WAT 223 115.013 39.063 115.697 1.00 0.00 H TER 30573 WAT 223 ATOM 30573 O WAT 224 17.309 30.129 145.250 1.00 0.00 O ATOM 30574 H1 WAT 224 18.252 30.221 145.113 1.00 0.00 H ATOM 30575 H2 WAT 224 16.931 30.211 144.375 1.00 0.00 H TER 30577 WAT 224 ATOM 30577 O WAT 225 142.534 50.874 99.634 1.00 0.00 O ATOM 30578 H1 WAT 225 142.754 50.041 100.051 1.00 0.00 H ATOM 30579 H2 WAT 225 142.470 51.495 100.360 1.00 0.00 H TER 30581 WAT 225 ATOM 30581 O WAT 226 25.235 108.583 9.836 1.00 0.00 O ATOM 30582 H1 WAT 226 25.372 108.570 8.888 1.00 0.00 H ATOM 30583 H2 WAT 226 24.536 109.223 9.968 1.00 0.00 H TER 30585 WAT 226 ATOM 30585 O WAT 227 33.748 124.254 113.814 1.00 0.00 O ATOM 30586 H1 WAT 227 34.538 123.753 114.017 1.00 0.00 H ATOM 30587 H2 WAT 227 33.886 125.101 114.238 1.00 0.00 H TER 30589 WAT 227 ATOM 30589 O WAT 228 144.755 119.484 97.503 1.00 0.00 O ATOM 30590 H1 WAT 228 144.721 118.609 97.890 1.00 0.00 H ATOM 30591 H2 WAT 228 145.439 119.424 96.836 1.00 0.00 H TER 30593 WAT 228 ATOM 30593 O WAT 229 45.526 31.224 155.229 1.00 0.00 O ATOM 30594 H1 WAT 229 46.375 31.498 155.575 1.00 0.00 H ATOM 30595 H2 WAT 229 45.229 30.543 155.833 1.00 0.00 H TER 30597 WAT 229 ATOM 30597 O WAT 230 8.430 49.358 66.166 1.00 0.00 O ATOM 30598 H1 WAT 230 7.816 48.943 65.559 1.00 0.00 H ATOM 30599 H2 WAT 230 9.265 49.360 65.698 1.00 0.00 H TER 30601 WAT 230 ATOM 30601 O WAT 231 93.457 114.743 102.979 1.00 0.00 O ATOM 30602 H1 WAT 231 94.409 114.662 102.926 1.00 0.00 H ATOM 30603 H2 WAT 231 93.222 115.295 102.233 1.00 0.00 H TER 30605 WAT 231 ATOM 30605 O WAT 232 57.478 17.893 99.930 1.00 0.00 O ATOM 30606 H1 WAT 232 57.656 18.303 100.777 1.00 0.00 H ATOM 30607 H2 WAT 232 56.634 17.458 100.048 1.00 0.00 H TER 30609 WAT 232 ATOM 30609 O WAT 233 85.366 53.346 66.911 1.00 0.00 O ATOM 30610 H1 WAT 233 84.883 52.597 67.259 1.00 0.00 H ATOM 30611 H2 WAT 233 86.087 53.475 67.528 1.00 0.00 H TER 30613 WAT 233 ATOM 30613 O WAT 234 43.144 115.316 72.145 1.00 0.00 O ATOM 30614 H1 WAT 234 43.268 115.687 73.018 1.00 0.00 H ATOM 30615 H2 WAT 234 43.952 115.529 71.677 1.00 0.00 H TER 30617 WAT 234 ATOM 30617 O WAT 235 78.832 140.560 96.261 1.00 0.00 O ATOM 30618 H1 WAT 235 78.805 139.763 95.731 1.00 0.00 H ATOM 30619 H2 WAT 235 79.557 141.066 95.896 1.00 0.00 H TER 30621 WAT 235 ATOM 30621 O WAT 236 7.101 32.575 121.294 1.00 0.00 O ATOM 30622 H1 WAT 236 6.269 32.512 121.764 1.00 0.00 H ATOM 30623 H2 WAT 236 6.945 33.235 120.619 1.00 0.00 H TER 30625 WAT 236 ATOM 30625 O WAT 237 99.316 123.597 128.497 1.00 0.00 O ATOM 30626 H1 WAT 237 99.719 122.899 129.014 1.00 0.00 H ATOM 30627 H2 WAT 237 100.010 123.884 127.903 1.00 0.00 H TER 30629 WAT 237 ATOM 30629 O WAT 238 128.415 57.821 68.743 1.00 0.00 O ATOM 30630 H1 WAT 238 128.786 58.205 67.949 1.00 0.00 H ATOM 30631 H2 WAT 238 127.509 58.128 68.757 1.00 0.00 H TER 30633 WAT 238 ATOM 30633 O WAT 239 114.360 4.689 82.373 1.00 0.00 O ATOM 30634 H1 WAT 239 113.838 4.368 83.108 1.00 0.00 H ATOM 30635 H2 WAT 239 114.343 3.974 81.737 1.00 0.00 H TER 30637 WAT 239 ATOM 30637 O WAT 240 49.019 23.145 155.868 1.00 0.00 O ATOM 30638 H1 WAT 240 49.750 22.947 155.282 1.00 0.00 H ATOM 30639 H2 WAT 240 48.275 23.289 155.282 1.00 0.00 H TER 30641 WAT 240 ATOM 30641 O WAT 241 90.984 61.438 112.085 1.00 0.00 O ATOM 30642 H1 WAT 241 90.960 60.491 112.227 1.00 0.00 H ATOM 30643 H2 WAT 241 91.916 61.645 112.011 1.00 0.00 H TER 30645 WAT 241 ATOM 30645 O WAT 242 124.395 3.317 118.415 1.00 0.00 O ATOM 30646 H1 WAT 242 124.457 4.025 119.056 1.00 0.00 H ATOM 30647 H2 WAT 242 124.095 3.745 117.613 1.00 0.00 H TER 30649 WAT 242 ATOM 30649 O WAT 243 89.036 12.571 138.430 1.00 0.00 O ATOM 30650 H1 WAT 243 89.548 13.298 138.077 1.00 0.00 H ATOM 30651 H2 WAT 243 88.904 12.795 139.351 1.00 0.00 H TER 30653 WAT 243 ATOM 30653 O WAT 244 143.776 59.341 93.935 1.00 0.00 O ATOM 30654 H1 WAT 244 143.788 59.160 94.875 1.00 0.00 H ATOM 30655 H2 WAT 244 142.958 59.818 93.794 1.00 0.00 H TER 30657 WAT 244 ATOM 30657 O WAT 245 24.043 0.280 82.390 1.00 0.00 O ATOM 30658 H1 WAT 245 24.176 1.223 82.486 1.00 0.00 H ATOM 30659 H2 WAT 245 24.505 -0.105 83.135 1.00 0.00 H TER 30661 WAT 245 ATOM 30661 O WAT 246 108.033 119.987 100.068 1.00 0.00 O ATOM 30662 H1 WAT 246 108.040 120.251 100.988 1.00 0.00 H ATOM 30663 H2 WAT 246 107.410 119.261 100.032 1.00 0.00 H TER 30665 WAT 246 ATOM 30665 O WAT 247 60.267 56.055 68.903 1.00 0.00 O ATOM 30666 H1 WAT 247 59.406 55.983 69.317 1.00 0.00 H ATOM 30667 H2 WAT 247 60.833 56.408 69.589 1.00 0.00 H TER 30669 WAT 247 ATOM 30669 O WAT 248 39.039 2.790 94.394 1.00 0.00 O ATOM 30670 H1 WAT 248 39.571 3.571 94.243 1.00 0.00 H ATOM 30671 H2 WAT 248 38.331 2.854 93.752 1.00 0.00 H TER 30673 WAT 248 ATOM 30673 O WAT 249 56.647 35.181 107.864 1.00 0.00 O ATOM 30674 H1 WAT 249 56.667 34.974 106.930 1.00 0.00 H ATOM 30675 H2 WAT 249 56.014 35.896 107.937 1.00 0.00 H TER 30677 WAT 249 ATOM 30677 O WAT 250 45.901 99.084 15.967 1.00 0.00 O ATOM 30678 H1 WAT 250 45.726 99.225 16.897 1.00 0.00 H ATOM 30679 H2 WAT 250 46.731 99.536 15.809 1.00 0.00 H TER 30681 WAT 250 ATOM 30681 O WAT 251 51.215 144.074 153.537 1.00 0.00 O ATOM 30682 H1 WAT 251 52.136 144.168 153.293 1.00 0.00 H ATOM 30683 H2 WAT 251 51.049 144.806 154.132 1.00 0.00 H TER 30685 WAT 251 ATOM 30685 O WAT 252 6.313 117.893 153.404 1.00 0.00 O ATOM 30686 H1 WAT 252 5.649 117.480 152.852 1.00 0.00 H ATOM 30687 H2 WAT 252 6.385 118.785 153.065 1.00 0.00 H TER 30689 WAT 252 ATOM 30689 O WAT 253 109.914 116.354 4.840 1.00 0.00 O ATOM 30690 H1 WAT 253 109.771 116.550 5.766 1.00 0.00 H ATOM 30691 H2 WAT 253 109.036 116.195 4.491 1.00 0.00 H TER 30693 WAT 253 ATOM 30693 O WAT 254 29.854 43.920 4.368 1.00 0.00 O ATOM 30694 H1 WAT 254 29.738 43.744 3.434 1.00 0.00 H ATOM 30695 H2 WAT 254 28.965 43.941 4.721 1.00 0.00 H TER 30697 WAT 254 ATOM 30697 O WAT 255 132.496 35.382 106.134 1.00 0.00 O ATOM 30698 H1 WAT 255 132.301 34.564 106.590 1.00 0.00 H ATOM 30699 H2 WAT 255 131.836 35.998 106.455 1.00 0.00 H TER 30701 WAT 255 ATOM 30701 O WAT 256 97.119 3.075 94.163 1.00 0.00 O ATOM 30702 H1 WAT 256 97.812 3.530 93.684 1.00 0.00 H ATOM 30703 H2 WAT 256 96.704 2.513 93.509 1.00 0.00 H TER 30705 WAT 256 ATOM 30705 O WAT 257 24.377 120.615 103.713 1.00 0.00 O ATOM 30706 H1 WAT 257 23.713 120.867 104.355 1.00 0.00 H ATOM 30707 H2 WAT 257 25.173 120.490 104.228 1.00 0.00 H TER 30709 WAT 257 ATOM 30709 O WAT 258 108.070 141.272 150.249 1.00 0.00 O ATOM 30710 H1 WAT 258 107.733 142.165 150.312 1.00 0.00 H ATOM 30711 H2 WAT 258 108.417 141.208 149.359 1.00 0.00 H TER 30713 WAT 258 ATOM 30713 O WAT 259 145.351 63.781 95.796 1.00 0.00 O ATOM 30714 H1 WAT 259 146.273 64.033 95.834 1.00 0.00 H ATOM 30715 H2 WAT 259 145.295 62.994 96.339 1.00 0.00 H TER 30717 WAT 259 ATOM 30717 O WAT 260 27.454 36.986 132.544 1.00 0.00 O ATOM 30718 H1 WAT 260 28.406 36.887 132.578 1.00 0.00 H ATOM 30719 H2 WAT 260 27.171 36.896 133.454 1.00 0.00 H TER 30721 WAT 260 ATOM 30721 O WAT 261 75.810 81.160 97.753 1.00 0.00 O ATOM 30722 H1 WAT 261 75.329 81.983 97.663 1.00 0.00 H ATOM 30723 H2 WAT 261 76.217 81.214 98.618 1.00 0.00 H TER 30725 WAT 261 ATOM 30725 O WAT 262 76.964 141.276 101.059 1.00 0.00 O ATOM 30726 H1 WAT 262 76.628 141.358 101.951 1.00 0.00 H ATOM 30727 H2 WAT 262 77.206 140.354 100.977 1.00 0.00 H TER 30729 WAT 262 ATOM 30729 O WAT 263 146.002 5.762 21.048 1.00 0.00 O ATOM 30730 H1 WAT 263 145.264 5.587 21.632 1.00 0.00 H ATOM 30731 H2 WAT 263 145.684 5.515 20.179 1.00 0.00 H TER 30733 WAT 263 ATOM 30733 O WAT 264 45.218 55.380 133.416 1.00 0.00 O ATOM 30734 H1 WAT 264 44.474 54.807 133.600 1.00 0.00 H ATOM 30735 H2 WAT 264 45.656 54.972 132.669 1.00 0.00 H TER 30737 WAT 264 ATOM 30737 O WAT 265 87.142 59.386 96.245 1.00 0.00 O ATOM 30738 H1 WAT 265 87.497 59.925 96.952 1.00 0.00 H ATOM 30739 H2 WAT 265 87.026 59.995 95.515 1.00 0.00 H TER 30741 WAT 265 ATOM 30741 O WAT 266 130.444 78.139 115.006 1.00 0.00 O ATOM 30742 H1 WAT 266 131.100 78.745 115.350 1.00 0.00 H ATOM 30743 H2 WAT 266 129.835 78.006 115.732 1.00 0.00 H TER 30745 WAT 266 ATOM 30745 O WAT 267 4.043 91.159 57.996 1.00 0.00 O ATOM 30746 H1 WAT 267 4.321 92.061 57.841 1.00 0.00 H ATOM 30747 H2 WAT 267 3.220 91.075 57.513 1.00 0.00 H TER 30749 WAT 267 ATOM 30749 O WAT 268 47.154 4.084 26.191 1.00 0.00 O ATOM 30750 H1 WAT 268 46.358 3.560 26.281 1.00 0.00 H ATOM 30751 H2 WAT 268 46.852 4.917 25.828 1.00 0.00 H TER 30753 WAT 268 ATOM 30753 O WAT 269 1.195 106.650 5.799 1.00 0.00 O ATOM 30754 H1 WAT 269 0.368 106.897 6.214 1.00 0.00 H ATOM 30755 H2 WAT 269 1.345 107.330 5.142 1.00 0.00 H TER 30757 WAT 269 ATOM 30757 O WAT 270 71.952 91.109 64.017 1.00 0.00 O ATOM 30758 H1 WAT 270 72.067 92.033 64.240 1.00 0.00 H ATOM 30759 H2 WAT 270 71.062 90.903 64.302 1.00 0.00 H TER 30761 WAT 270 ATOM 30761 O WAT 271 54.588 28.981 125.372 1.00 0.00 O ATOM 30762 H1 WAT 271 54.917 28.383 126.044 1.00 0.00 H ATOM 30763 H2 WAT 271 55.348 29.159 124.818 1.00 0.00 H TER 30765 WAT 271 ATOM 30765 O WAT 272 2.181 4.941 136.042 1.00 0.00 O ATOM 30766 H1 WAT 272 1.923 5.703 135.523 1.00 0.00 H ATOM 30767 H2 WAT 272 1.655 4.223 135.690 1.00 0.00 H TER 30769 WAT 272 ATOM 30769 O WAT 273 121.690 117.014 104.052 1.00 0.00 O ATOM 30770 H1 WAT 273 121.385 116.208 103.636 1.00 0.00 H ATOM 30771 H2 WAT 273 121.769 116.789 104.979 1.00 0.00 H TER 30773 WAT 273 ATOM 30773 O WAT 274 9.359 94.395 11.648 1.00 0.00 O ATOM 30774 H1 WAT 274 9.510 93.685 11.024 1.00 0.00 H ATOM 30775 H2 WAT 274 8.740 94.031 12.280 1.00 0.00 H TER 30777 WAT 274 ATOM 30777 O WAT 275 118.337 78.795 18.325 1.00 0.00 O ATOM 30778 H1 WAT 275 118.805 77.960 18.364 1.00 0.00 H ATOM 30779 H2 WAT 275 117.860 78.840 19.154 1.00 0.00 H TER 30781 WAT 275 ATOM 30781 O WAT 276 13.403 8.362 65.535 1.00 0.00 O ATOM 30782 H1 WAT 276 13.571 7.798 64.780 1.00 0.00 H ATOM 30783 H2 WAT 276 14.217 8.852 65.654 1.00 0.00 H TER 30785 WAT 276 ATOM 30785 O WAT 277 123.205 121.691 19.964 1.00 0.00 O ATOM 30786 H1 WAT 277 122.886 120.936 20.459 1.00 0.00 H ATOM 30787 H2 WAT 277 123.840 121.323 19.349 1.00 0.00 H TER 30789 WAT 277 ATOM 30789 O WAT 278 33.977 106.351 95.553 1.00 0.00 O ATOM 30790 H1 WAT 278 33.167 106.182 96.033 1.00 0.00 H ATOM 30791 H2 WAT 278 34.410 105.499 95.504 1.00 0.00 H TER 30793 WAT 278 ATOM 30793 O WAT 279 64.519 67.652 19.201 1.00 0.00 O ATOM 30794 H1 WAT 279 64.076 66.822 19.376 1.00 0.00 H ATOM 30795 H2 WAT 279 64.660 67.654 18.254 1.00 0.00 H TER 30797 WAT 279 ATOM 30797 O WAT 280 70.784 39.567 25.181 1.00 0.00 O ATOM 30798 H1 WAT 280 70.622 39.928 26.053 1.00 0.00 H ATOM 30799 H2 WAT 280 71.713 39.732 25.023 1.00 0.00 H TER 30801 WAT 280 ATOM 30801 O WAT 281 17.495 35.941 105.136 1.00 0.00 O ATOM 30802 H1 WAT 281 17.843 35.054 105.221 1.00 0.00 H ATOM 30803 H2 WAT 281 16.577 35.816 104.894 1.00 0.00 H TER 30805 WAT 281 ATOM 30805 O WAT 282 71.025 17.976 131.559 1.00 0.00 O ATOM 30806 H1 WAT 282 71.892 18.227 131.876 1.00 0.00 H ATOM 30807 H2 WAT 282 71.048 18.169 130.621 1.00 0.00 H TER 30809 WAT 282 ATOM 30809 O WAT 283 83.793 65.099 1.468 1.00 0.00 O ATOM 30810 H1 WAT 283 84.726 64.969 1.639 1.00 0.00 H ATOM 30811 H2 WAT 283 83.735 65.991 1.125 1.00 0.00 H TER 30813 WAT 283 ATOM 30813 O WAT 284 51.972 94.433 2.892 1.00 0.00 O ATOM 30814 H1 WAT 284 51.291 94.146 2.284 1.00 0.00 H ATOM 30815 H2 WAT 284 51.982 95.386 2.807 1.00 0.00 H TER 30817 WAT 284 ATOM 30817 O WAT 285 53.813 66.967 147.671 1.00 0.00 O ATOM 30818 H1 WAT 285 53.482 66.128 147.992 1.00 0.00 H ATOM 30819 H2 WAT 285 54.061 67.446 148.462 1.00 0.00 H TER 30821 WAT 285 ATOM 30821 O WAT 286 123.617 113.213 108.538 1.00 0.00 O ATOM 30822 H1 WAT 286 123.523 112.711 107.729 1.00 0.00 H ATOM 30823 H2 WAT 286 124.440 112.905 108.917 1.00 0.00 H TER 30825 WAT 286 ATOM 30825 O WAT 287 61.537 59.071 29.827 1.00 0.00 O ATOM 30826 H1 WAT 287 62.035 59.677 30.375 1.00 0.00 H ATOM 30827 H2 WAT 287 61.112 58.480 30.448 1.00 0.00 H TER 30829 WAT 287 ATOM 30829 O WAT 288 89.413 83.298 19.875 1.00 0.00 O ATOM 30830 H1 WAT 288 89.378 84.250 19.968 1.00 0.00 H ATOM 30831 H2 WAT 288 88.941 83.120 19.061 1.00 0.00 H TER 30833 WAT 288 ATOM 30833 O WAT 289 6.420 83.822 86.894 1.00 0.00 O ATOM 30834 H1 WAT 289 6.434 82.973 86.451 1.00 0.00 H ATOM 30835 H2 WAT 289 5.949 84.398 86.292 1.00 0.00 H TER 30837 WAT 289 ATOM 30837 O WAT 290 57.678 51.540 149.258 1.00 0.00 O ATOM 30838 H1 WAT 290 58.232 50.817 149.552 1.00 0.00 H ATOM 30839 H2 WAT 290 57.052 51.667 149.971 1.00 0.00 H TER 30841 WAT 290 ATOM 30841 O WAT 291 119.048 145.676 127.731 1.00 0.00 O ATOM 30842 H1 WAT 291 119.697 144.975 127.683 1.00 0.00 H ATOM 30843 H2 WAT 291 118.388 145.437 127.080 1.00 0.00 H TER 30845 WAT 291 ATOM 30845 O WAT 292 0.604 122.648 142.731 1.00 0.00 O ATOM 30846 H1 WAT 292 0.653 121.710 142.543 1.00 0.00 H ATOM 30847 H2 WAT 292 0.649 123.067 141.871 1.00 0.00 H TER 30849 WAT 292 ATOM 30849 O WAT 293 23.210 130.654 115.936 1.00 0.00 O ATOM 30850 H1 WAT 293 22.654 130.181 116.556 1.00 0.00 H ATOM 30851 H2 WAT 293 24.069 130.680 116.356 1.00 0.00 H TER 30853 WAT 293 ATOM 30853 O WAT 294 14.187 37.743 140.676 1.00 0.00 O ATOM 30854 H1 WAT 294 14.832 38.122 141.273 1.00 0.00 H ATOM 30855 H2 WAT 294 14.172 36.812 140.899 1.00 0.00 H TER 30857 WAT 294 ATOM 30857 O WAT 295 34.182 131.284 125.259 1.00 0.00 O ATOM 30858 H1 WAT 295 34.286 130.867 124.404 1.00 0.00 H ATOM 30859 H2 WAT 295 33.278 131.094 125.511 1.00 0.00 H TER 30861 WAT 295 ATOM 30861 O WAT 296 134.925 125.113 15.950 1.00 0.00 O ATOM 30862 H1 WAT 296 135.770 124.878 15.568 1.00 0.00 H ATOM 30863 H2 WAT 296 134.279 124.784 15.325 1.00 0.00 H TER 30865 WAT 296 ATOM 30865 O WAT 297 138.375 60.430 123.062 1.00 0.00 O ATOM 30866 H1 WAT 297 138.626 60.552 123.978 1.00 0.00 H ATOM 30867 H2 WAT 297 138.853 59.648 122.785 1.00 0.00 H TER 30869 WAT 297 ATOM 30869 O WAT 298 9.760 140.969 153.724 1.00 0.00 O ATOM 30870 H1 WAT 298 9.222 141.229 152.977 1.00 0.00 H ATOM 30871 H2 WAT 298 10.648 141.235 153.485 1.00 0.00 H TER 30873 WAT 298 ATOM 30873 O WAT 299 76.429 125.807 158.153 1.00 0.00 O ATOM 30874 H1 WAT 299 76.018 125.182 158.750 1.00 0.00 H ATOM 30875 H2 WAT 299 75.842 126.564 158.158 1.00 0.00 H TER 30877 WAT 299 ATOM 30877 O WAT 300 4.827 78.327 5.596 1.00 0.00 O ATOM 30878 H1 WAT 300 4.305 77.710 5.083 1.00 0.00 H ATOM 30879 H2 WAT 300 5.642 77.859 5.776 1.00 0.00 H TER 30881 WAT 300 ATOM 30881 O WAT 301 88.902 22.840 8.491 1.00 0.00 O ATOM 30882 H1 WAT 301 89.518 23.158 9.151 1.00 0.00 H ATOM 30883 H2 WAT 301 88.530 22.046 8.874 1.00 0.00 H TER 30885 WAT 301 ATOM 30885 O WAT 302 62.639 26.479 123.935 1.00 0.00 O ATOM 30886 H1 WAT 302 62.256 25.660 123.620 1.00 0.00 H ATOM 30887 H2 WAT 302 62.790 26.993 123.142 1.00 0.00 H TER 30889 WAT 302 ATOM 30889 O WAT 303 108.856 105.054 140.016 1.00 0.00 O ATOM 30890 H1 WAT 303 109.152 104.233 140.408 1.00 0.00 H ATOM 30891 H2 WAT 303 109.615 105.376 139.531 1.00 0.00 H TER 30893 WAT 303 ATOM 30893 O WAT 304 2.086 40.628 147.294 1.00 0.00 O ATOM 30894 H1 WAT 304 1.769 41.464 147.636 1.00 0.00 H ATOM 30895 H2 WAT 304 2.417 40.837 146.421 1.00 0.00 H TER 30897 WAT 304 ATOM 30897 O WAT 305 138.067 90.679 158.700 1.00 0.00 O ATOM 30898 H1 WAT 305 137.391 90.916 158.065 1.00 0.00 H ATOM 30899 H2 WAT 305 138.783 91.290 158.527 1.00 0.00 H TER 30901 WAT 305 ATOM 30901 O WAT 306 119.448 93.884 -0.064 1.00 0.00 O ATOM 30902 H1 WAT 306 119.832 93.081 0.289 1.00 0.00 H ATOM 30903 H2 WAT 306 118.850 94.184 0.620 1.00 0.00 H TER 30905 WAT 306 ATOM 30905 O WAT 307 107.827 19.777 143.015 1.00 0.00 O ATOM 30906 H1 WAT 307 108.631 20.093 142.601 1.00 0.00 H ATOM 30907 H2 WAT 307 108.053 18.906 143.342 1.00 0.00 H TER 30909 WAT 307 ATOM 30909 O WAT 308 23.953 61.355 98.068 1.00 0.00 O ATOM 30910 H1 WAT 308 24.228 61.294 97.153 1.00 0.00 H ATOM 30911 H2 WAT 308 22.998 61.409 98.027 1.00 0.00 H TER 30913 WAT 308 ATOM 30913 O WAT 309 31.454 142.775 123.227 1.00 0.00 O ATOM 30914 H1 WAT 309 31.353 141.830 123.121 1.00 0.00 H ATOM 30915 H2 WAT 309 30.605 143.137 122.974 1.00 0.00 H TER 30917 WAT 309 ATOM 30917 O WAT 310 71.184 70.614 21.314 1.00 0.00 O ATOM 30918 H1 WAT 310 70.982 71.235 22.015 1.00 0.00 H ATOM 30919 H2 WAT 310 72.134 70.671 21.212 1.00 0.00 H TER 30921 WAT 310 ATOM 30921 O WAT 311 41.795 50.756 67.367 1.00 0.00 O ATOM 30922 H1 WAT 311 42.103 50.046 67.930 1.00 0.00 H ATOM 30923 H2 WAT 311 41.628 50.337 66.523 1.00 0.00 H TER 30925 WAT 311 ATOM 30925 O WAT 312 96.065 54.335 3.348 1.00 0.00 O ATOM 30926 H1 WAT 312 96.776 53.693 3.328 1.00 0.00 H ATOM 30927 H2 WAT 312 96.452 55.108 3.759 1.00 0.00 H TER 30929 WAT 312 ATOM 30929 O WAT 313 49.216 124.744 66.274 1.00 0.00 O ATOM 30930 H1 WAT 313 48.286 124.957 66.348 1.00 0.00 H ATOM 30931 H2 WAT 313 49.246 123.788 66.298 1.00 0.00 H TER 30933 WAT 313 ATOM 30933 O WAT 314 132.059 73.303 156.532 1.00 0.00 O ATOM 30934 H1 WAT 314 132.376 72.400 156.536 1.00 0.00 H ATOM 30935 H2 WAT 314 131.560 73.385 157.345 1.00 0.00 H TER 30937 WAT 314 ATOM 30937 O WAT 315 46.794 27.237 156.097 1.00 0.00 O ATOM 30938 H1 WAT 315 46.093 26.613 155.907 1.00 0.00 H ATOM 30939 H2 WAT 315 47.089 27.004 156.977 1.00 0.00 H TER 30941 WAT 315 ATOM 30941 O WAT 316 61.675 137.459 90.826 1.00 0.00 O ATOM 30942 H1 WAT 316 61.934 137.997 90.078 1.00 0.00 H ATOM 30943 H2 WAT 316 60.850 137.055 90.557 1.00 0.00 H TER 30945 WAT 316 ATOM 30945 O WAT 317 140.058 20.467 135.439 1.00 0.00 O ATOM 30946 H1 WAT 317 139.489 20.820 134.755 1.00 0.00 H ATOM 30947 H2 WAT 317 139.495 20.408 136.211 1.00 0.00 H TER 30949 WAT 317 ATOM 30949 O WAT 318 9.107 16.679 75.537 1.00 0.00 O ATOM 30950 H1 WAT 318 9.200 15.886 75.008 1.00 0.00 H ATOM 30951 H2 WAT 318 9.658 17.326 75.097 1.00 0.00 H TER 30953 WAT 318 ATOM 30953 O WAT 319 87.087 37.354 71.987 1.00 0.00 O ATOM 30954 H1 WAT 319 87.300 37.780 72.816 1.00 0.00 H ATOM 30955 H2 WAT 319 86.755 38.060 71.432 1.00 0.00 H TER 30957 WAT 319 ATOM 30957 O WAT 320 78.417 17.491 133.104 1.00 0.00 O ATOM 30958 H1 WAT 320 78.044 17.469 133.985 1.00 0.00 H ATOM 30959 H2 WAT 320 78.051 16.721 132.669 1.00 0.00 H TER 30961 WAT 320 ATOM 30961 O WAT 321 105.472 104.051 134.873 1.00 0.00 O ATOM 30962 H1 WAT 321 105.755 104.908 134.554 1.00 0.00 H ATOM 30963 H2 WAT 321 106.250 103.683 135.292 1.00 0.00 H TER 30965 WAT 321 ATOM 30965 O WAT 322 110.762 76.610 10.345 1.00 0.00 O ATOM 30966 H1 WAT 322 110.077 76.163 10.843 1.00 0.00 H ATOM 30967 H2 WAT 322 111.390 76.899 11.007 1.00 0.00 H TER 30969 WAT 322 ATOM 30969 O WAT 323 83.047 61.927 22.122 1.00 0.00 O ATOM 30970 H1 WAT 323 83.896 62.021 22.554 1.00 0.00 H ATOM 30971 H2 WAT 323 82.463 62.505 22.612 1.00 0.00 H TER 30973 WAT 323 ATOM 30973 O WAT 324 38.613 98.675 96.325 1.00 0.00 O ATOM 30974 H1 WAT 324 39.389 98.117 96.384 1.00 0.00 H ATOM 30975 H2 WAT 324 38.385 98.866 97.235 1.00 0.00 H TER 30977 WAT 324 ATOM 30977 O WAT 325 130.488 83.571 1.479 1.00 0.00 O ATOM 30978 H1 WAT 325 131.186 84.206 1.636 1.00 0.00 H ATOM 30979 H2 WAT 325 130.934 82.724 1.458 1.00 0.00 H TER 30981 WAT 325 ATOM 30981 O WAT 326 117.227 118.600 59.920 1.00 0.00 O ATOM 30982 H1 WAT 326 116.371 118.965 59.693 1.00 0.00 H ATOM 30983 H2 WAT 326 117.127 118.299 60.823 1.00 0.00 H TER 30985 WAT 326 ATOM 30985 O WAT 327 70.690 57.469 103.613 1.00 0.00 O ATOM 30986 H1 WAT 327 71.200 58.077 103.078 1.00 0.00 H ATOM 30987 H2 WAT 327 71.127 57.473 104.464 1.00 0.00 H TER 30989 WAT 327 ATOM 30989 O WAT 328 44.205 38.653 0.240 1.00 0.00 O ATOM 30990 H1 WAT 328 43.551 39.273 -0.081 1.00 0.00 H ATOM 30991 H2 WAT 328 43.781 37.798 0.169 1.00 0.00 H TER 30993 WAT 328 ATOM 30993 O WAT 329 132.063 82.346 119.671 1.00 0.00 O ATOM 30994 H1 WAT 329 131.991 82.545 120.604 1.00 0.00 H ATOM 30995 H2 WAT 329 132.997 82.429 119.479 1.00 0.00 H TER 30997 WAT 329 ATOM 30997 O WAT 330 114.187 31.471 98.072 1.00 0.00 O ATOM 30998 H1 WAT 330 114.907 31.143 97.534 1.00 0.00 H ATOM 30999 H2 WAT 330 113.408 31.354 97.528 1.00 0.00 H TER 31001 WAT 330 ATOM 31001 O WAT 331 98.132 39.761 20.727 1.00 0.00 O ATOM 31002 H1 WAT 331 98.365 40.173 21.560 1.00 0.00 H ATOM 31003 H2 WAT 331 98.899 39.237 20.496 1.00 0.00 H TER 31005 WAT 331 ATOM 31005 O WAT 332 106.727 118.880 152.698 1.00 0.00 O ATOM 31006 H1 WAT 332 106.293 119.559 153.214 1.00 0.00 H ATOM 31007 H2 WAT 332 106.558 119.125 151.788 1.00 0.00 H TER 31009 WAT 332 ATOM 31009 O WAT 333 75.605 136.522 88.418 1.00 0.00 O ATOM 31010 H1 WAT 333 76.420 137.018 88.492 1.00 0.00 H ATOM 31011 H2 WAT 333 75.106 136.761 89.199 1.00 0.00 H TER 31013 WAT 333 ATOM 31013 O WAT 334 20.956 25.436 105.911 1.00 0.00 O ATOM 31014 H1 WAT 334 20.216 25.304 105.318 1.00 0.00 H ATOM 31015 H2 WAT 334 21.644 24.866 105.566 1.00 0.00 H TER 31017 WAT 334 ATOM 31017 O WAT 335 83.231 73.315 73.283 1.00 0.00 O ATOM 31018 H1 WAT 335 82.939 74.166 72.959 1.00 0.00 H ATOM 31019 H2 WAT 335 82.754 73.195 74.104 1.00 0.00 H TER 31021 WAT 335 ATOM 31021 O WAT 336 145.510 107.180 122.663 1.00 0.00 O ATOM 31022 H1 WAT 336 145.483 108.135 122.599 1.00 0.00 H ATOM 31023 H2 WAT 336 144.597 106.907 122.564 1.00 0.00 H TER 31025 WAT 336 ATOM 31025 O WAT 337 53.623 26.906 140.144 1.00 0.00 O ATOM 31026 H1 WAT 337 53.383 27.588 140.771 1.00 0.00 H ATOM 31027 H2 WAT 337 52.787 26.582 139.811 1.00 0.00 H TER 31029 WAT 337 ATOM 31029 O WAT 338 67.123 74.233 101.090 1.00 0.00 O ATOM 31030 H1 WAT 338 66.696 74.982 101.507 1.00 0.00 H ATOM 31031 H2 WAT 338 68.058 74.386 101.222 1.00 0.00 H TER 31033 WAT 338 ATOM 31033 O WAT 339 59.244 134.015 85.653 1.00 0.00 O ATOM 31034 H1 WAT 339 58.865 134.805 86.038 1.00 0.00 H ATOM 31035 H2 WAT 339 59.370 134.234 84.730 1.00 0.00 H TER 31037 WAT 339 ATOM 31037 O WAT 340 11.059 88.064 117.275 1.00 0.00 O ATOM 31038 H1 WAT 340 10.846 87.132 117.234 1.00 0.00 H ATOM 31039 H2 WAT 340 11.823 88.160 116.706 1.00 0.00 H TER 31041 WAT 340 ATOM 31041 O WAT 341 70.510 8.921 61.717 1.00 0.00 O ATOM 31042 H1 WAT 341 70.306 9.675 62.269 1.00 0.00 H ATOM 31043 H2 WAT 341 71.034 8.348 62.277 1.00 0.00 H TER 31045 WAT 341 ATOM 31045 O WAT 342 66.301 14.937 124.198 1.00 0.00 O ATOM 31046 H1 WAT 342 65.701 14.481 124.789 1.00 0.00 H ATOM 31047 H2 WAT 342 67.150 14.891 124.638 1.00 0.00 H TER 31049 WAT 342 ATOM 31049 O WAT 343 51.978 113.700 57.319 1.00 0.00 O ATOM 31050 H1 WAT 343 51.127 114.065 57.561 1.00 0.00 H ATOM 31051 H2 WAT 343 51.843 112.753 57.325 1.00 0.00 H TER 31053 WAT 343 ATOM 31053 O WAT 344 48.722 52.513 19.810 1.00 0.00 O ATOM 31054 H1 WAT 344 48.767 51.779 20.423 1.00 0.00 H ATOM 31055 H2 WAT 344 49.362 52.297 19.131 1.00 0.00 H TER 31057 WAT 344 ATOM 31057 O WAT 345 32.222 8.943 4.833 1.00 0.00 O ATOM 31058 H1 WAT 345 33.008 8.847 4.296 1.00 0.00 H ATOM 31059 H2 WAT 345 31.624 8.271 4.505 1.00 0.00 H TER 31061 WAT 345 ATOM 31061 O WAT 346 36.379 128.825 158.318 1.00 0.00 O ATOM 31062 H1 WAT 346 37.034 129.257 158.867 1.00 0.00 H ATOM 31063 H2 WAT 346 35.540 129.152 158.644 1.00 0.00 H TER 31065 WAT 346 ATOM 31065 O WAT 347 51.507 66.631 110.391 1.00 0.00 O ATOM 31066 H1 WAT 347 50.812 66.794 109.753 1.00 0.00 H ATOM 31067 H2 WAT 347 51.064 66.654 111.239 1.00 0.00 H TER 31069 WAT 347 ATOM 31069 O WAT 348 59.318 13.218 119.786 1.00 0.00 O ATOM 31070 H1 WAT 348 58.799 13.132 118.987 1.00 0.00 H ATOM 31071 H2 WAT 348 59.725 12.360 119.902 1.00 0.00 H TER 31073 WAT 348 ATOM 31073 O WAT 349 67.364 41.830 158.379 1.00 0.00 O ATOM 31074 H1 WAT 349 67.880 41.072 158.104 1.00 0.00 H ATOM 31075 H2 WAT 349 67.928 42.582 158.199 1.00 0.00 H TER 31077 WAT 349 ATOM 31077 O WAT 350 87.350 117.126 63.854 1.00 0.00 O ATOM 31078 H1 WAT 350 87.261 116.209 64.112 1.00 0.00 H ATOM 31079 H2 WAT 350 88.282 117.233 63.664 1.00 0.00 H TER 31081 WAT 350 ATOM 31081 O WAT 351 98.446 52.495 126.200 1.00 0.00 O ATOM 31082 H1 WAT 351 98.151 52.496 127.110 1.00 0.00 H ATOM 31083 H2 WAT 351 99.401 52.525 126.257 1.00 0.00 H TER 31085 WAT 351 ATOM 31085 O WAT 352 97.360 114.979 97.120 1.00 0.00 O ATOM 31086 H1 WAT 352 96.777 114.887 97.874 1.00 0.00 H ATOM 31087 H2 WAT 352 97.165 115.848 96.771 1.00 0.00 H TER 31089 WAT 352 ATOM 31089 O WAT 353 58.846 117.433 105.926 1.00 0.00 O ATOM 31090 H1 WAT 353 58.978 118.306 105.558 1.00 0.00 H ATOM 31091 H2 WAT 353 57.957 117.194 105.662 1.00 0.00 H TER 31093 WAT 353 ATOM 31093 O WAT 354 74.403 58.316 158.341 1.00 0.00 O ATOM 31094 H1 WAT 354 74.916 58.875 158.925 1.00 0.00 H ATOM 31095 H2 WAT 354 73.502 58.410 158.651 1.00 0.00 H TER 31097 WAT 354 ATOM 31097 O WAT 355 27.257 16.479 100.887 1.00 0.00 O ATOM 31098 H1 WAT 355 27.327 15.993 101.709 1.00 0.00 H ATOM 31099 H2 WAT 355 27.646 17.332 101.080 1.00 0.00 H TER 31101 WAT 355 ATOM 31101 O WAT 356 3.630 51.977 144.824 1.00 0.00 O ATOM 31102 H1 WAT 356 2.876 51.388 144.798 1.00 0.00 H ATOM 31103 H2 WAT 356 3.739 52.185 145.752 1.00 0.00 H TER 31105 WAT 356 ATOM 31105 O WAT 357 50.497 134.826 10.216 1.00 0.00 O ATOM 31106 H1 WAT 357 51.080 134.166 10.590 1.00 0.00 H ATOM 31107 H2 WAT 357 50.275 135.396 10.953 1.00 0.00 H TER 31109 WAT 357 ATOM 31109 O WAT 358 46.522 3.344 12.236 1.00 0.00 O ATOM 31110 H1 WAT 358 46.799 2.617 12.793 1.00 0.00 H ATOM 31111 H2 WAT 358 46.997 4.102 12.576 1.00 0.00 H TER 31113 WAT 358 ATOM 31113 O WAT 359 133.056 60.447 22.624 1.00 0.00 O ATOM 31114 H1 WAT 359 133.737 60.397 23.295 1.00 0.00 H ATOM 31115 H2 WAT 359 132.242 60.267 23.094 1.00 0.00 H TER 31117 WAT 359 ATOM 31117 O WAT 360 9.998 25.714 122.342 1.00 0.00 O ATOM 31118 H1 WAT 360 10.340 26.569 122.604 1.00 0.00 H ATOM 31119 H2 WAT 360 10.108 25.694 121.391 1.00 0.00 H TER 31121 WAT 360 ATOM 31121 O WAT 361 35.540 23.990 94.407 1.00 0.00 O ATOM 31122 H1 WAT 361 35.114 24.411 95.154 1.00 0.00 H ATOM 31123 H2 WAT 361 36.260 23.491 94.792 1.00 0.00 H TER 31125 WAT 361 ATOM 31125 O WAT 362 96.106 122.090 7.202 1.00 0.00 O ATOM 31126 H1 WAT 362 96.862 121.680 7.622 1.00 0.00 H ATOM 31127 H2 WAT 362 95.892 121.507 6.473 1.00 0.00 H TER 31129 WAT 362 ATOM 31129 O WAT 363 87.896 40.197 154.937 1.00 0.00 O ATOM 31130 H1 WAT 363 88.059 39.326 155.299 1.00 0.00 H ATOM 31131 H2 WAT 363 87.040 40.445 155.287 1.00 0.00 H TER 31133 WAT 363 ATOM 31133 O WAT 364 31.982 31.158 10.030 1.00 0.00 O ATOM 31134 H1 WAT 364 32.907 31.202 9.789 1.00 0.00 H ATOM 31135 H2 WAT 364 31.524 31.031 9.199 1.00 0.00 H TER 31137 WAT 364 ATOM 31137 O WAT 365 109.934 132.484 88.829 1.00 0.00 O ATOM 31138 H1 WAT 365 109.190 133.086 88.818 1.00 0.00 H ATOM 31139 H2 WAT 365 109.552 131.627 88.643 1.00 0.00 H TER 31141 WAT 365 ATOM 31141 O WAT 366 140.103 17.776 14.083 1.00 0.00 O ATOM 31142 H1 WAT 366 140.063 16.948 14.561 1.00 0.00 H ATOM 31143 H2 WAT 366 139.537 18.366 14.580 1.00 0.00 H TER 31145 WAT 366 ATOM 31145 O WAT 367 71.121 138.881 122.896 1.00 0.00 O ATOM 31146 H1 WAT 367 71.741 138.781 123.619 1.00 0.00 H ATOM 31147 H2 WAT 367 71.296 138.133 122.325 1.00 0.00 H TER 31149 WAT 367 ATOM 31149 O WAT 368 76.119 105.089 110.280 1.00 0.00 O ATOM 31150 H1 WAT 368 76.857 105.643 110.535 1.00 0.00 H ATOM 31151 H2 WAT 368 76.501 104.436 109.694 1.00 0.00 H TER 31153 WAT 368 ATOM 31153 O WAT 369 85.256 116.113 62.024 1.00 0.00 O ATOM 31154 H1 WAT 369 85.922 116.246 62.698 1.00 0.00 H ATOM 31155 H2 WAT 369 85.732 115.722 61.291 1.00 0.00 H TER 31157 WAT 369 ATOM 31157 O WAT 370 97.481 53.574 141.578 1.00 0.00 O ATOM 31158 H1 WAT 370 97.023 54.039 142.279 1.00 0.00 H ATOM 31159 H2 WAT 370 96.836 52.953 141.240 1.00 0.00 H TER 31161 WAT 370 ATOM 31161 O WAT 371 18.998 118.305 6.286 1.00 0.00 O ATOM 31162 H1 WAT 371 18.693 118.895 6.975 1.00 0.00 H ATOM 31163 H2 WAT 371 18.338 117.613 6.254 1.00 0.00 H TER 31165 WAT 371 ATOM 31165 O WAT 372 136.502 36.541 71.341 1.00 0.00 O ATOM 31166 H1 WAT 372 135.902 35.985 70.845 1.00 0.00 H ATOM 31167 H2 WAT 372 137.356 36.121 71.242 1.00 0.00 H TER 31169 WAT 372 ATOM 31169 O WAT 373 35.672 82.885 2.788 1.00 0.00 O ATOM 31170 H1 WAT 373 36.224 83.662 2.871 1.00 0.00 H ATOM 31171 H2 WAT 373 35.669 82.498 3.663 1.00 0.00 H TER 31173 WAT 373 ATOM 31173 O WAT 374 101.101 94.132 142.413 1.00 0.00 O ATOM 31174 H1 WAT 374 100.239 94.060 142.003 1.00 0.00 H ATOM 31175 H2 WAT 374 100.971 93.803 143.303 1.00 0.00 H TER 31177 WAT 374 ATOM 31177 O WAT 375 46.909 120.662 140.155 1.00 0.00 O ATOM 31178 H1 WAT 375 47.689 120.152 140.371 1.00 0.00 H ATOM 31179 H2 WAT 375 47.142 121.127 139.351 1.00 0.00 H TER 31181 WAT 375 ATOM 31181 O WAT 376 24.505 15.829 86.991 1.00 0.00 O ATOM 31182 H1 WAT 376 24.479 16.231 87.860 1.00 0.00 H ATOM 31183 H2 WAT 376 25.308 15.309 86.991 1.00 0.00 H TER 31185 WAT 376 ATOM 31185 O WAT 377 116.785 13.397 91.212 1.00 0.00 O ATOM 31186 H1 WAT 377 116.588 13.113 90.319 1.00 0.00 H ATOM 31187 H2 WAT 377 117.434 12.767 91.526 1.00 0.00 H TER 31189 WAT 377 ATOM 31189 O WAT 378 65.658 23.611 80.280 1.00 0.00 O ATOM 31190 H1 WAT 378 65.592 22.974 79.568 1.00 0.00 H ATOM 31191 H2 WAT 378 65.997 24.403 79.861 1.00 0.00 H TER 31193 WAT 378 ATOM 31193 O WAT 379 136.939 114.108 132.753 1.00 0.00 O ATOM 31194 H1 WAT 379 137.387 114.535 133.484 1.00 0.00 H ATOM 31195 H2 WAT 379 136.819 114.803 132.106 1.00 0.00 H TER 31197 WAT 379 ATOM 31197 O WAT 380 129.398 141.389 64.969 1.00 0.00 O ATOM 31198 H1 WAT 380 129.251 141.891 65.771 1.00 0.00 H ATOM 31199 H2 WAT 380 128.890 140.587 65.092 1.00 0.00 H TER 31201 WAT 380 ATOM 31201 O WAT 381 145.469 10.980 129.816 1.00 0.00 O ATOM 31202 H1 WAT 381 144.707 10.447 130.043 1.00 0.00 H ATOM 31203 H2 WAT 381 145.189 11.488 129.055 1.00 0.00 H TER 31205 WAT 381 ATOM 31205 O WAT 382 125.980 124.782 22.312 1.00 0.00 O ATOM 31206 H1 WAT 382 125.894 125.542 22.887 1.00 0.00 H ATOM 31207 H2 WAT 382 126.619 124.221 22.752 1.00 0.00 H TER 31209 WAT 382 ATOM 31209 O WAT 383 22.381 54.366 145.699 1.00 0.00 O ATOM 31210 H1 WAT 383 23.039 53.856 146.172 1.00 0.00 H ATOM 31211 H2 WAT 383 22.524 54.146 144.779 1.00 0.00 H TER 31213 WAT 383 ATOM 31213 O WAT 384 90.703 83.771 116.867 1.00 0.00 O ATOM 31214 H1 WAT 384 90.794 84.588 117.357 1.00 0.00 H ATOM 31215 H2 WAT 384 89.790 83.515 116.995 1.00 0.00 H TER 31217 WAT 384 ATOM 31217 O WAT 385 107.655 95.809 60.595 1.00 0.00 O ATOM 31218 H1 WAT 385 108.369 95.945 59.973 1.00 0.00 H ATOM 31219 H2 WAT 385 106.890 96.199 60.172 1.00 0.00 H TER 31221 WAT 385 ATOM 31221 O WAT 386 4.427 17.130 113.942 1.00 0.00 O ATOM 31222 H1 WAT 386 4.682 16.407 113.369 1.00 0.00 H ATOM 31223 H2 WAT 386 3.661 16.803 114.414 1.00 0.00 H TER 31225 WAT 386 ATOM 31225 O WAT 387 60.514 106.370 117.925 1.00 0.00 O ATOM 31226 H1 WAT 387 60.757 106.973 118.628 1.00 0.00 H ATOM 31227 H2 WAT 387 60.324 105.545 118.373 1.00 0.00 H TER 31229 WAT 387 ATOM 31229 O WAT 388 13.685 4.929 154.984 1.00 0.00 O ATOM 31230 H1 WAT 388 13.762 5.633 154.340 1.00 0.00 H ATOM 31231 H2 WAT 388 14.589 4.683 155.180 1.00 0.00 H TER 31233 WAT 388 ATOM 31233 O WAT 389 142.814 29.673 140.399 1.00 0.00 O ATOM 31234 H1 WAT 389 142.964 30.282 139.676 1.00 0.00 H ATOM 31235 H2 WAT 389 142.587 28.846 139.972 1.00 0.00 H TER 31237 WAT 389 ATOM 31237 O WAT 390 74.225 11.496 146.990 1.00 0.00 O ATOM 31238 H1 WAT 390 75.105 11.461 147.365 1.00 0.00 H ATOM 31239 H2 WAT 390 73.736 12.069 147.581 1.00 0.00 H TER 31241 WAT 390 ATOM 31241 O WAT 391 64.587 26.459 87.303 1.00 0.00 O ATOM 31242 H1 WAT 391 64.677 25.506 87.293 1.00 0.00 H ATOM 31243 H2 WAT 391 64.655 26.695 88.228 1.00 0.00 H TER 31245 WAT 391 ATOM 31245 O WAT 392 121.844 127.960 15.102 1.00 0.00 O ATOM 31246 H1 WAT 392 121.182 127.296 14.913 1.00 0.00 H ATOM 31247 H2 WAT 392 122.577 127.469 15.473 1.00 0.00 H TER 31249 WAT 392 ATOM 31249 O WAT 393 8.910 86.703 24.530 1.00 0.00 O ATOM 31250 H1 WAT 393 9.799 86.617 24.187 1.00 0.00 H ATOM 31251 H2 WAT 393 8.355 86.305 23.859 1.00 0.00 H TER 31253 WAT 393 ATOM 31253 O WAT 394 81.283 72.397 94.994 1.00 0.00 O ATOM 31254 H1 WAT 394 81.103 72.101 95.886 1.00 0.00 H ATOM 31255 H2 WAT 394 80.690 71.882 94.447 1.00 0.00 H TER 31257 WAT 394 ATOM 31257 O WAT 395 16.973 133.688 100.204 1.00 0.00 O ATOM 31258 H1 WAT 395 16.658 133.837 99.313 1.00 0.00 H ATOM 31259 H2 WAT 395 16.191 133.764 100.751 1.00 0.00 H TER 31261 WAT 395 ATOM 31261 O WAT 396 64.482 2.196 68.590 1.00 0.00 O ATOM 31262 H1 WAT 396 63.991 2.370 67.787 1.00 0.00 H ATOM 31263 H2 WAT 396 64.083 2.771 69.244 1.00 0.00 H TER 31265 WAT 396 ATOM 31265 O WAT 397 77.111 91.790 21.264 1.00 0.00 O ATOM 31266 H1 WAT 397 77.180 92.164 20.385 1.00 0.00 H ATOM 31267 H2 WAT 397 77.261 90.853 21.137 1.00 0.00 H TER 31269 WAT 397 ATOM 31269 O WAT 398 122.492 105.409 95.869 1.00 0.00 O ATOM 31270 H1 WAT 398 121.809 105.615 96.507 1.00 0.00 H ATOM 31271 H2 WAT 398 122.941 106.242 95.722 1.00 0.00 H TER 31273 WAT 398 ATOM 31273 O WAT 399 140.066 23.226 85.010 1.00 0.00 O ATOM 31274 H1 WAT 399 139.386 23.372 84.353 1.00 0.00 H ATOM 31275 H2 WAT 399 140.035 24.006 85.564 1.00 0.00 H TER 31277 WAT 399 ATOM 31277 O WAT 400 124.970 69.217 155.219 1.00 0.00 O ATOM 31278 H1 WAT 400 124.092 68.873 155.383 1.00 0.00 H ATOM 31279 H2 WAT 400 125.552 68.623 155.692 1.00 0.00 H TER 31281 WAT 400 ATOM 31281 O WAT 401 101.716 13.467 99.244 1.00 0.00 O ATOM 31282 H1 WAT 401 101.468 12.835 98.569 1.00 0.00 H ATOM 31283 H2 WAT 401 101.410 13.075 100.063 1.00 0.00 H TER 31285 WAT 401 ATOM 31285 O WAT 402 84.347 15.514 105.608 1.00 0.00 O ATOM 31286 H1 WAT 402 83.654 14.870 105.460 1.00 0.00 H ATOM 31287 H2 WAT 402 84.707 15.286 106.465 1.00 0.00 H TER 31289 WAT 402 ATOM 31289 O WAT 403 88.241 144.920 14.153 1.00 0.00 O ATOM 31290 H1 WAT 403 87.860 145.082 13.290 1.00 0.00 H ATOM 31291 H2 WAT 403 88.053 145.715 14.651 1.00 0.00 H TER 31293 WAT 403 ATOM 31293 O WAT 404 80.390 129.100 122.803 1.00 0.00 O ATOM 31294 H1 WAT 404 80.809 128.240 122.836 1.00 0.00 H ATOM 31295 H2 WAT 404 80.142 129.210 121.885 1.00 0.00 H TER 31297 WAT 404 ATOM 31297 O WAT 405 24.500 71.291 114.897 1.00 0.00 O ATOM 31298 H1 WAT 405 24.344 71.904 114.179 1.00 0.00 H ATOM 31299 H2 WAT 405 24.651 71.849 115.660 1.00 0.00 H TER 31301 WAT 405 ATOM 31301 O WAT 406 23.532 85.322 93.259 1.00 0.00 O ATOM 31302 H1 WAT 406 24.075 85.995 93.669 1.00 0.00 H ATOM 31303 H2 WAT 406 22.646 85.682 93.279 1.00 0.00 H TER 31305 WAT 406 ATOM 31305 O WAT 407 13.772 50.348 3.649 1.00 0.00 O ATOM 31306 H1 WAT 407 14.571 49.840 3.503 1.00 0.00 H ATOM 31307 H2 WAT 407 13.524 50.660 2.779 1.00 0.00 H TER 31309 WAT 407 ATOM 31309 O WAT 408 21.147 112.525 142.349 1.00 0.00 O ATOM 31310 H1 WAT 408 20.809 112.758 141.485 1.00 0.00 H ATOM 31311 H2 WAT 408 20.504 111.909 142.700 1.00 0.00 H TER 31313 WAT 408 ATOM 31313 O WAT 409 66.403 39.917 122.789 1.00 0.00 O ATOM 31314 H1 WAT 409 67.027 40.594 122.526 1.00 0.00 H ATOM 31315 H2 WAT 409 66.676 39.670 123.672 1.00 0.00 H TER 31317 WAT 409 ATOM 31317 O WAT 410 98.843 78.046 115.704 1.00 0.00 O ATOM 31318 H1 WAT 410 97.894 77.921 115.725 1.00 0.00 H ATOM 31319 H2 WAT 410 98.977 78.755 115.075 1.00 0.00 H TER 31321 WAT 410 ATOM 31321 O WAT 411 83.114 66.146 21.935 1.00 0.00 O ATOM 31322 H1 WAT 411 82.785 65.927 22.806 1.00 0.00 H ATOM 31323 H2 WAT 411 82.430 65.844 21.337 1.00 0.00 H TER 31325 WAT 411 ATOM 31325 O WAT 412 120.620 56.190 115.992 1.00 0.00 O ATOM 31326 H1 WAT 412 121.195 56.684 116.576 1.00 0.00 H ATOM 31327 H2 WAT 412 121.191 55.537 115.587 1.00 0.00 H TER 31329 WAT 412 ATOM 31329 O WAT 413 20.479 51.548 147.032 1.00 0.00 O ATOM 31330 H1 WAT 413 20.479 52.307 147.616 1.00 0.00 H ATOM 31331 H2 WAT 413 19.651 51.104 147.217 1.00 0.00 H TER 31333 WAT 413 ATOM 31333 O WAT 414 103.802 78.575 100.456 1.00 0.00 O ATOM 31334 H1 WAT 414 103.161 78.772 101.139 1.00 0.00 H ATOM 31335 H2 WAT 414 103.307 78.637 99.639 1.00 0.00 H TER 31337 WAT 414 ATOM 31337 O WAT 415 111.495 22.453 128.571 1.00 0.00 O ATOM 31338 H1 WAT 415 112.397 22.140 128.513 1.00 0.00 H ATOM 31339 H2 WAT 415 111.414 22.789 129.464 1.00 0.00 H TER 31341 WAT 415 ATOM 31341 O WAT 416 145.247 144.506 128.731 1.00 0.00 O ATOM 31342 H1 WAT 416 146.009 143.927 128.720 1.00 0.00 H ATOM 31343 H2 WAT 416 144.628 144.075 129.320 1.00 0.00 H TER 31345 WAT 416 ATOM 31345 O WAT 417 73.662 68.467 17.223 1.00 0.00 O ATOM 31346 H1 WAT 417 74.604 68.636 17.220 1.00 0.00 H ATOM 31347 H2 WAT 417 73.406 68.521 16.302 1.00 0.00 H TER 31349 WAT 417 ATOM 31349 O WAT 418 128.002 63.838 112.118 1.00 0.00 O ATOM 31350 H1 WAT 418 127.877 64.123 113.023 1.00 0.00 H ATOM 31351 H2 WAT 418 127.599 64.529 111.592 1.00 0.00 H TER 31353 WAT 418 ATOM 31353 O WAT 419 22.862 16.036 75.504 1.00 0.00 O ATOM 31354 H1 WAT 419 22.877 15.845 76.442 1.00 0.00 H ATOM 31355 H2 WAT 419 23.625 15.576 75.154 1.00 0.00 H TER 31357 WAT 419 ATOM 31357 O WAT 420 144.674 118.972 80.601 1.00 0.00 O ATOM 31358 H1 WAT 420 144.908 119.665 79.985 1.00 0.00 H ATOM 31359 H2 WAT 420 145.473 118.453 80.692 1.00 0.00 H TER 31361 WAT 420 ATOM 31361 O WAT 421 82.452 118.300 87.487 1.00 0.00 O ATOM 31362 H1 WAT 421 83.209 118.885 87.477 1.00 0.00 H ATOM 31363 H2 WAT 421 82.050 118.414 86.626 1.00 0.00 H TER 31365 WAT 421 ATOM 31365 O WAT 422 109.682 29.208 116.872 1.00 0.00 O ATOM 31366 H1 WAT 422 109.444 28.346 117.214 1.00 0.00 H ATOM 31367 H2 WAT 422 108.855 29.688 116.836 1.00 0.00 H TER 31369 WAT 422 ATOM 31369 O WAT 423 56.386 47.061 118.673 1.00 0.00 O ATOM 31370 H1 WAT 423 56.427 47.232 119.614 1.00 0.00 H ATOM 31371 H2 WAT 423 57.301 46.987 118.403 1.00 0.00 H TER 31373 WAT 423 ATOM 31373 O WAT 424 57.931 3.734 56.531 1.00 0.00 O ATOM 31374 H1 WAT 424 58.599 3.465 55.901 1.00 0.00 H ATOM 31375 H2 WAT 424 57.500 2.918 56.786 1.00 0.00 H TER 31377 WAT 424 ATOM 31377 O WAT 425 113.166 3.478 2.776 1.00 0.00 O ATOM 31378 H1 WAT 425 112.523 2.770 2.723 1.00 0.00 H ATOM 31379 H2 WAT 425 112.812 4.165 2.211 1.00 0.00 H TER 31381 WAT 425 ATOM 31381 O WAT 426 30.325 113.772 0.756 1.00 0.00 O ATOM 31382 H1 WAT 426 30.974 114.407 1.058 1.00 0.00 H ATOM 31383 H2 WAT 426 29.514 114.031 1.193 1.00 0.00 H TER 31385 WAT 426 ATOM 31385 O WAT 427 46.075 128.531 92.094 1.00 0.00 O ATOM 31386 H1 WAT 427 46.242 127.994 92.869 1.00 0.00 H ATOM 31387 H2 WAT 427 46.054 129.429 92.426 1.00 0.00 H TER 31389 WAT 427 ATOM 31389 O WAT 428 106.880 85.609 104.607 1.00 0.00 O ATOM 31390 H1 WAT 428 107.218 86.287 104.023 1.00 0.00 H ATOM 31391 H2 WAT 428 106.817 84.828 104.056 1.00 0.00 H TER 31393 WAT 428 ATOM 31393 O WAT 429 58.923 23.630 148.379 1.00 0.00 O ATOM 31394 H1 WAT 429 58.210 23.551 149.012 1.00 0.00 H ATOM 31395 H2 WAT 429 58.958 22.775 147.950 1.00 0.00 H TER 31397 WAT 429 ATOM 31397 O WAT 430 20.262 22.765 112.168 1.00 0.00 O ATOM 31398 H1 WAT 430 20.058 22.180 112.898 1.00 0.00 H ATOM 31399 H2 WAT 430 19.551 23.406 112.170 1.00 0.00 H TER 31401 WAT 430 ATOM 31401 O WAT 431 35.398 132.826 105.938 1.00 0.00 O ATOM 31402 H1 WAT 431 35.917 132.457 105.224 1.00 0.00 H ATOM 31403 H2 WAT 431 36.002 132.862 106.679 1.00 0.00 H TER 31405 WAT 431 ATOM 31405 O WAT 432 13.599 26.713 123.780 1.00 0.00 O ATOM 31406 H1 WAT 432 14.023 27.506 124.107 1.00 0.00 H ATOM 31407 H2 WAT 432 12.932 26.510 124.437 1.00 0.00 H TER 31409 WAT 432 ATOM 31409 O WAT 433 81.327 128.145 126.654 1.00 0.00 O ATOM 31410 H1 WAT 433 81.851 128.647 126.031 1.00 0.00 H ATOM 31411 H2 WAT 433 81.925 127.964 127.379 1.00 0.00 H TER 31413 WAT 433 ATOM 31413 O WAT 434 61.094 19.497 108.404 1.00 0.00 O ATOM 31414 H1 WAT 434 61.737 19.034 108.941 1.00 0.00 H ATOM 31415 H2 WAT 434 60.315 19.553 108.957 1.00 0.00 H TER 31417 WAT 434 ATOM 31417 O WAT 435 62.360 89.479 89.623 1.00 0.00 O ATOM 31418 H1 WAT 435 62.924 90.095 89.156 1.00 0.00 H ATOM 31419 H2 WAT 435 62.822 88.643 89.568 1.00 0.00 H TER 31421 WAT 435 ATOM 31421 O WAT 436 65.901 44.740 112.966 1.00 0.00 O ATOM 31422 H1 WAT 436 66.387 44.813 113.787 1.00 0.00 H ATOM 31423 H2 WAT 436 65.742 43.802 112.864 1.00 0.00 H TER 31425 WAT 436 ATOM 31425 O WAT 437 68.887 7.756 6.738 1.00 0.00 O ATOM 31426 H1 WAT 437 69.406 8.400 7.220 1.00 0.00 H ATOM 31427 H2 WAT 437 69.525 7.289 6.198 1.00 0.00 H TER 31429 WAT 437 ATOM 31429 O WAT 438 99.809 141.628 129.435 1.00 0.00 O ATOM 31430 H1 WAT 438 99.342 140.804 129.573 1.00 0.00 H ATOM 31431 H2 WAT 438 100.701 141.363 129.212 1.00 0.00 H TER 31433 WAT 438 ATOM 31433 O WAT 439 106.649 81.378 70.067 1.00 0.00 O ATOM 31434 H1 WAT 439 106.952 82.084 69.497 1.00 0.00 H ATOM 31435 H2 WAT 439 105.924 80.977 69.587 1.00 0.00 H TER 31437 WAT 439 ATOM 31437 O WAT 440 94.821 6.967 2.156 1.00 0.00 O ATOM 31438 H1 WAT 440 94.416 6.602 1.369 1.00 0.00 H ATOM 31439 H2 WAT 440 95.762 6.876 2.005 1.00 0.00 H TER 31441 WAT 440 ATOM 31441 O WAT 441 142.960 14.676 60.656 1.00 0.00 O ATOM 31442 H1 WAT 441 143.224 15.493 61.080 1.00 0.00 H ATOM 31443 H2 WAT 441 142.299 14.306 61.241 1.00 0.00 H TER 31445 WAT 441 ATOM 31445 O WAT 442 139.623 12.344 102.204 1.00 0.00 O ATOM 31446 H1 WAT 442 139.425 12.331 101.268 1.00 0.00 H ATOM 31447 H2 WAT 442 140.159 11.564 102.346 1.00 0.00 H TER 31449 WAT 442 ATOM 31449 O WAT 443 26.568 25.272 85.075 1.00 0.00 O ATOM 31450 H1 WAT 443 26.778 24.770 85.863 1.00 0.00 H ATOM 31451 H2 WAT 443 26.161 26.074 85.404 1.00 0.00 H TER 31453 WAT 443 ATOM 31453 O WAT 444 135.102 140.914 116.334 1.00 0.00 O ATOM 31454 H1 WAT 444 134.961 141.849 116.484 1.00 0.00 H ATOM 31455 H2 WAT 444 135.078 140.525 117.209 1.00 0.00 H TER 31457 WAT 444 ATOM 31457 O WAT 445 93.971 113.775 15.731 1.00 0.00 O ATOM 31458 H1 WAT 445 93.276 114.051 16.329 1.00 0.00 H ATOM 31459 H2 WAT 445 94.225 114.576 15.273 1.00 0.00 H TER 31461 WAT 445 ATOM 31461 O WAT 446 129.381 52.697 125.978 1.00 0.00 O ATOM 31462 H1 WAT 446 130.323 52.584 126.106 1.00 0.00 H ATOM 31463 H2 WAT 446 129.288 52.887 125.044 1.00 0.00 H TER 31465 WAT 446 ATOM 31465 O WAT 447 98.879 125.474 83.108 1.00 0.00 O ATOM 31466 H1 WAT 447 99.803 125.229 83.154 1.00 0.00 H ATOM 31467 H2 WAT 447 98.423 124.785 83.592 1.00 0.00 H TER 31469 WAT 447 ATOM 31469 O WAT 448 24.877 27.036 86.595 1.00 0.00 O ATOM 31470 H1 WAT 448 24.119 26.540 86.905 1.00 0.00 H ATOM 31471 H2 WAT 448 24.500 27.796 86.152 1.00 0.00 H TER 31473 WAT 448 ATOM 31473 O WAT 449 6.854 106.096 150.020 1.00 0.00 O ATOM 31474 H1 WAT 449 5.916 106.136 149.832 1.00 0.00 H ATOM 31475 H2 WAT 449 7.265 106.555 149.287 1.00 0.00 H TER 31477 WAT 449 ATOM 31477 O WAT 450 101.125 102.416 119.594 1.00 0.00 O ATOM 31478 H1 WAT 450 100.315 102.922 119.654 1.00 0.00 H ATOM 31479 H2 WAT 450 101.283 102.109 120.487 1.00 0.00 H TER 31481 WAT 450 ATOM 31481 O WAT 451 84.417 12.207 99.368 1.00 0.00 O ATOM 31482 H1 WAT 451 84.478 11.485 99.994 1.00 0.00 H ATOM 31483 H2 WAT 451 84.175 12.965 99.900 1.00 0.00 H TER 31485 WAT 451 ATOM 31485 O WAT 452 33.078 133.550 108.773 1.00 0.00 O ATOM 31486 H1 WAT 452 32.870 133.458 109.703 1.00 0.00 H ATOM 31487 H2 WAT 452 32.585 132.850 108.346 1.00 0.00 H TER 31489 WAT 452 ATOM 31489 O WAT 453 8.182 46.159 86.989 1.00 0.00 O ATOM 31490 H1 WAT 453 8.407 46.571 87.823 1.00 0.00 H ATOM 31491 H2 WAT 453 8.822 45.454 86.890 1.00 0.00 H TER 31493 WAT 453 ATOM 31493 O WAT 454 23.350 13.944 122.488 1.00 0.00 O ATOM 31494 H1 WAT 454 23.987 14.162 123.168 1.00 0.00 H ATOM 31495 H2 WAT 454 23.038 13.070 122.723 1.00 0.00 H TER 31497 WAT 454 ATOM 31497 O WAT 455 98.539 43.563 82.108 1.00 0.00 O ATOM 31498 H1 WAT 455 99.075 44.045 81.479 1.00 0.00 H ATOM 31499 H2 WAT 455 98.511 42.670 81.763 1.00 0.00 H TER 31501 WAT 455 ATOM 31501 O WAT 456 120.117 141.722 101.388 1.00 0.00 O ATOM 31502 H1 WAT 456 120.426 141.880 102.280 1.00 0.00 H ATOM 31503 H2 WAT 456 120.436 142.472 100.887 1.00 0.00 H TER 31505 WAT 456 ATOM 31505 O WAT 457 34.467 67.672 139.414 1.00 0.00 O ATOM 31506 H1 WAT 457 34.215 67.768 138.496 1.00 0.00 H ATOM 31507 H2 WAT 457 34.738 68.550 139.681 1.00 0.00 H TER 31509 WAT 457 ATOM 31509 O WAT 458 6.256 6.718 63.781 1.00 0.00 O ATOM 31510 H1 WAT 458 5.860 5.891 63.507 1.00 0.00 H ATOM 31511 H2 WAT 458 5.941 7.358 63.143 1.00 0.00 H TER 31513 WAT 458 ATOM 31513 O WAT 459 128.362 18.308 133.507 1.00 0.00 O ATOM 31514 H1 WAT 459 128.731 17.494 133.852 1.00 0.00 H ATOM 31515 H2 WAT 459 127.561 18.036 133.058 1.00 0.00 H TER 31517 WAT 459 ATOM 31517 O WAT 460 80.043 119.732 113.366 1.00 0.00 O ATOM 31518 H1 WAT 460 79.571 119.135 112.786 1.00 0.00 H ATOM 31519 H2 WAT 460 80.468 120.353 112.775 1.00 0.00 H TER 31521 WAT 460 ATOM 31521 O WAT 461 22.717 104.841 13.291 1.00 0.00 O ATOM 31522 H1 WAT 461 22.536 104.383 14.112 1.00 0.00 H ATOM 31523 H2 WAT 461 22.529 105.760 13.484 1.00 0.00 H TER 31525 WAT 461 ATOM 31525 O WAT 462 124.863 123.389 106.310 1.00 0.00 O ATOM 31526 H1 WAT 462 124.141 123.827 106.760 1.00 0.00 H ATOM 31527 H2 WAT 462 124.437 122.743 105.746 1.00 0.00 H TER 31529 WAT 462 ATOM 31529 O WAT 463 120.729 27.997 97.051 1.00 0.00 O ATOM 31530 H1 WAT 463 120.337 28.403 96.278 1.00 0.00 H ATOM 31531 H2 WAT 463 120.082 27.353 97.338 1.00 0.00 H TER 31533 WAT 463 ATOM 31533 O WAT 464 72.910 5.058 106.116 1.00 0.00 O ATOM 31534 H1 WAT 464 72.655 5.981 106.102 1.00 0.00 H ATOM 31535 H2 WAT 464 73.755 5.051 106.566 1.00 0.00 H TER 31537 WAT 464 ATOM 31537 O WAT 465 73.354 91.399 81.090 1.00 0.00 O ATOM 31538 H1 WAT 465 73.217 92.221 80.618 1.00 0.00 H ATOM 31539 H2 WAT 465 73.751 90.815 80.445 1.00 0.00 H TER 31541 WAT 465 ATOM 31541 O WAT 466 93.093 92.806 142.685 1.00 0.00 O ATOM 31542 H1 WAT 466 93.203 92.170 143.392 1.00 0.00 H ATOM 31543 H2 WAT 466 92.168 92.743 142.448 1.00 0.00 H TER 31545 WAT 466 ATOM 31545 O WAT 467 19.155 94.244 106.079 1.00 0.00 O ATOM 31546 H1 WAT 467 19.133 95.121 105.696 1.00 0.00 H ATOM 31547 H2 WAT 467 19.589 94.362 106.924 1.00 0.00 H TER 31549 WAT 467 ATOM 31549 O WAT 468 118.753 7.424 24.371 1.00 0.00 O ATOM 31550 H1 WAT 468 118.670 6.541 24.012 1.00 0.00 H ATOM 31551 H2 WAT 468 118.695 7.304 25.319 1.00 0.00 H TER 31553 WAT 468 ATOM 31553 O WAT 469 73.814 105.858 7.418 1.00 0.00 O ATOM 31554 H1 WAT 469 74.097 106.769 7.345 1.00 0.00 H ATOM 31555 H2 WAT 469 72.914 105.911 7.738 1.00 0.00 H TER 31557 WAT 469 ATOM 31557 O WAT 470 26.247 41.972 155.992 1.00 0.00 O ATOM 31558 H1 WAT 470 26.142 41.558 156.849 1.00 0.00 H ATOM 31559 H2 WAT 470 27.150 42.291 155.989 1.00 0.00 H TER 31561 WAT 470 ATOM 31561 O WAT 471 39.986 105.344 13.760 1.00 0.00 O ATOM 31562 H1 WAT 471 40.888 105.053 13.897 1.00 0.00 H ATOM 31563 H2 WAT 471 39.804 105.921 14.501 1.00 0.00 H TER 31565 WAT 471 ATOM 31565 O WAT 472 11.453 109.292 121.319 1.00 0.00 O ATOM 31566 H1 WAT 472 11.074 108.653 121.923 1.00 0.00 H ATOM 31567 H2 WAT 472 11.864 108.763 120.636 1.00 0.00 H TER 31569 WAT 472 ATOM 31569 O WAT 473 138.421 45.241 158.543 1.00 0.00 O ATOM 31570 H1 WAT 473 138.948 45.450 157.772 1.00 0.00 H ATOM 31571 H2 WAT 473 138.843 44.469 158.920 1.00 0.00 H TER 31573 WAT 473 ATOM 31573 O WAT 474 103.114 31.247 65.205 1.00 0.00 O ATOM 31574 H1 WAT 474 102.934 30.610 64.513 1.00 0.00 H ATOM 31575 H2 WAT 474 102.869 32.090 64.824 1.00 0.00 H TER 31577 WAT 474 ATOM 31577 O WAT 475 110.216 34.549 82.691 1.00 0.00 O ATOM 31578 H1 WAT 475 110.784 33.783 82.612 1.00 0.00 H ATOM 31579 H2 WAT 475 110.574 35.179 82.066 1.00 0.00 H TER 31581 WAT 475 ATOM 31581 O WAT 476 101.167 35.440 3.174 1.00 0.00 O ATOM 31582 H1 WAT 476 101.448 34.821 3.848 1.00 0.00 H ATOM 31583 H2 WAT 476 100.470 34.982 2.704 1.00 0.00 H TER 31585 WAT 476 ATOM 31585 O WAT 477 121.154 77.315 111.098 1.00 0.00 O ATOM 31586 H1 WAT 477 120.795 76.627 111.659 1.00 0.00 H ATOM 31587 H2 WAT 477 120.569 77.336 110.341 1.00 0.00 H TER 31589 WAT 477 ATOM 31589 O WAT 478 71.864 34.209 97.086 1.00 0.00 O ATOM 31590 H1 WAT 478 72.323 33.700 97.754 1.00 0.00 H ATOM 31591 H2 WAT 478 70.937 34.031 97.245 1.00 0.00 H TER 31593 WAT 478 ATOM 31593 O WAT 479 107.451 48.241 22.008 1.00 0.00 O ATOM 31594 H1 WAT 479 106.624 48.057 22.453 1.00 0.00 H ATOM 31595 H2 WAT 479 108.092 48.319 22.715 1.00 0.00 H TER 31597 WAT 479 ATOM 31597 O WAT 480 96.308 7.529 95.757 1.00 0.00 O ATOM 31598 H1 WAT 480 96.809 6.976 96.357 1.00 0.00 H ATOM 31599 H2 WAT 480 95.394 7.307 95.934 1.00 0.00 H TER 31601 WAT 480 ATOM 31601 O WAT 481 85.597 66.632 95.993 1.00 0.00 O ATOM 31602 H1 WAT 481 85.595 65.676 96.027 1.00 0.00 H ATOM 31603 H2 WAT 481 84.704 66.883 96.230 1.00 0.00 H TER 31605 WAT 481 ATOM 31605 O WAT 482 5.897 46.639 144.947 1.00 0.00 O ATOM 31606 H1 WAT 482 6.265 46.989 144.136 1.00 0.00 H ATOM 31607 H2 WAT 482 6.661 46.398 145.472 1.00 0.00 H TER 31609 WAT 482 ATOM 31609 O WAT 483 34.366 16.382 101.283 1.00 0.00 O ATOM 31610 H1 WAT 483 34.717 16.013 102.094 1.00 0.00 H ATOM 31611 H2 WAT 483 34.911 16.005 100.593 1.00 0.00 H TER 31613 WAT 483 ATOM 31613 O WAT 484 135.032 48.674 154.601 1.00 0.00 O ATOM 31614 H1 WAT 484 134.902 49.616 154.709 1.00 0.00 H ATOM 31615 H2 WAT 484 135.371 48.580 153.711 1.00 0.00 H TER 31617 WAT 484 ATOM 31617 O WAT 485 108.912 53.210 99.912 1.00 0.00 O ATOM 31618 H1 WAT 485 108.881 52.476 100.527 1.00 0.00 H ATOM 31619 H2 WAT 485 109.239 53.944 100.432 1.00 0.00 H TER 31621 WAT 485 ATOM 31621 O WAT 486 14.357 79.667 79.761 1.00 0.00 O ATOM 31622 H1 WAT 486 13.931 79.375 78.955 1.00 0.00 H ATOM 31623 H2 WAT 486 14.579 78.857 80.221 1.00 0.00 H TER 31625 WAT 486 ATOM 31625 O WAT 487 31.892 33.046 24.403 1.00 0.00 O ATOM 31626 H1 WAT 487 31.251 32.869 25.092 1.00 0.00 H ATOM 31627 H2 WAT 487 31.618 33.883 24.029 1.00 0.00 H TER 31629 WAT 487 ATOM 31629 O WAT 488 25.157 78.634 122.160 1.00 0.00 O ATOM 31630 H1 WAT 488 24.971 78.582 121.222 1.00 0.00 H ATOM 31631 H2 WAT 488 25.819 79.321 122.235 1.00 0.00 H TER 31633 WAT 488 ATOM 31633 O WAT 489 137.269 64.011 57.450 1.00 0.00 O ATOM 31634 H1 WAT 489 138.216 63.939 57.571 1.00 0.00 H ATOM 31635 H2 WAT 489 136.898 63.432 58.117 1.00 0.00 H TER 31637 WAT 489 ATOM 31637 O WAT 490 18.188 126.929 145.646 1.00 0.00 O ATOM 31638 H1 WAT 490 18.955 126.494 145.273 1.00 0.00 H ATOM 31639 H2 WAT 490 17.539 126.231 145.737 1.00 0.00 H TER 31641 WAT 490 ATOM 31641 O WAT 491 79.489 128.487 89.593 1.00 0.00 O ATOM 31642 H1 WAT 491 79.834 129.065 90.273 1.00 0.00 H ATOM 31643 H2 WAT 491 79.441 127.627 90.011 1.00 0.00 H TER 31645 WAT 491 ATOM 31645 O WAT 492 27.639 33.709 90.123 1.00 0.00 O ATOM 31646 H1 WAT 492 27.713 34.252 90.907 1.00 0.00 H ATOM 31647 H2 WAT 492 27.291 34.299 89.455 1.00 0.00 H TER 31649 WAT 492 ATOM 31649 O WAT 493 143.904 37.143 127.436 1.00 0.00 O ATOM 31650 H1 WAT 493 143.317 37.589 126.825 1.00 0.00 H ATOM 31651 H2 WAT 493 143.748 36.212 127.281 1.00 0.00 H TER 31653 WAT 493 ATOM 31653 O WAT 494 116.943 86.346 12.151 1.00 0.00 O ATOM 31654 H1 WAT 494 116.489 86.909 11.524 1.00 0.00 H ATOM 31655 H2 WAT 494 116.244 85.856 12.583 1.00 0.00 H TER 31657 WAT 494 ATOM 31657 O WAT 495 26.102 33.349 63.888 1.00 0.00 O ATOM 31658 H1 WAT 495 25.910 32.539 63.414 1.00 0.00 H ATOM 31659 H2 WAT 495 26.542 33.904 63.245 1.00 0.00 H TER 31661 WAT 495 ATOM 31661 O WAT 496 72.557 17.766 121.973 1.00 0.00 O ATOM 31662 H1 WAT 496 72.416 17.775 121.027 1.00 0.00 H ATOM 31663 H2 WAT 496 72.021 18.488 122.302 1.00 0.00 H TER 31665 WAT 496 ATOM 31665 O WAT 497 115.754 82.757 70.914 1.00 0.00 O ATOM 31666 H1 WAT 497 115.679 83.194 71.762 1.00 0.00 H ATOM 31667 H2 WAT 497 116.696 82.709 70.752 1.00 0.00 H TER 31669 WAT 497 ATOM 31669 O WAT 498 12.421 0.531 138.819 1.00 0.00 O ATOM 31670 H1 WAT 498 12.300 -0.307 139.265 1.00 0.00 H ATOM 31671 H2 WAT 498 11.532 0.833 138.631 1.00 0.00 H TER 31673 WAT 498 ATOM 31673 O WAT 499 22.338 102.950 24.254 1.00 0.00 O ATOM 31674 H1 WAT 499 22.213 102.734 25.178 1.00 0.00 H ATOM 31675 H2 WAT 499 21.917 102.232 23.780 1.00 0.00 H TER 31677 WAT 499 ATOM 31677 O WAT 500 5.246 17.545 25.072 1.00 0.00 O ATOM 31678 H1 WAT 500 5.521 17.348 24.176 1.00 0.00 H ATOM 31679 H2 WAT 500 4.617 16.856 25.286 1.00 0.00 H TER 31681 WAT 500 ATOM 31681 O WAT 501 88.315 2.304 56.089 1.00 0.00 O ATOM 31682 H1 WAT 501 88.102 2.074 56.993 1.00 0.00 H ATOM 31683 H2 WAT 501 88.576 3.224 56.131 1.00 0.00 H TER 31685 WAT 501 ATOM 31685 O WAT 502 132.256 75.204 66.020 1.00 0.00 O ATOM 31686 H1 WAT 502 131.566 74.599 66.294 1.00 0.00 H ATOM 31687 H2 WAT 502 133.003 74.983 66.576 1.00 0.00 H TER 31689 WAT 502 ATOM 31689 O WAT 503 11.887 43.512 75.359 1.00 0.00 O ATOM 31690 H1 WAT 503 12.235 43.309 74.491 1.00 0.00 H ATOM 31691 H2 WAT 503 12.523 44.119 75.736 1.00 0.00 H TER 31693 WAT 503 ATOM 31693 O WAT 504 26.645 11.001 148.421 1.00 0.00 O ATOM 31694 H1 WAT 504 25.705 11.000 148.602 1.00 0.00 H ATOM 31695 H2 WAT 504 26.803 11.834 147.977 1.00 0.00 H TER 31697 WAT 504 ATOM 31697 O WAT 505 19.932 64.478 152.225 1.00 0.00 O ATOM 31698 H1 WAT 505 20.409 64.881 152.951 1.00 0.00 H ATOM 31699 H2 WAT 505 19.200 65.073 152.060 1.00 0.00 H TER 31701 WAT 505 ATOM 31701 O WAT 506 12.355 48.250 147.623 1.00 0.00 O ATOM 31702 H1 WAT 506 12.253 49.082 147.161 1.00 0.00 H ATOM 31703 H2 WAT 506 11.632 48.233 148.249 1.00 0.00 H TER 31705 WAT 506 ATOM 31705 O WAT 507 29.539 16.604 74.169 1.00 0.00 O ATOM 31706 H1 WAT 507 29.563 17.398 74.702 1.00 0.00 H ATOM 31707 H2 WAT 507 30.268 16.075 74.494 1.00 0.00 H TER 31709 WAT 507 ATOM 31709 O WAT 508 86.534 42.821 109.927 1.00 0.00 O ATOM 31710 H1 WAT 508 86.888 42.737 110.812 1.00 0.00 H ATOM 31711 H2 WAT 508 86.218 41.944 109.712 1.00 0.00 H TER 31713 WAT 508 ATOM 31713 O WAT 509 11.425 19.253 108.121 1.00 0.00 O ATOM 31714 H1 WAT 509 11.935 19.779 108.737 1.00 0.00 H ATOM 31715 H2 WAT 509 12.077 18.880 107.528 1.00 0.00 H TER 31717 WAT 509 ATOM 31717 O WAT 510 97.702 55.065 106.264 1.00 0.00 O ATOM 31718 H1 WAT 510 98.412 54.494 105.972 1.00 0.00 H ATOM 31719 H2 WAT 510 98.024 55.450 107.079 1.00 0.00 H TER 31721 WAT 510 ATOM 31721 O WAT 511 132.975 134.613 12.377 1.00 0.00 O ATOM 31722 H1 WAT 511 133.624 135.256 12.662 1.00 0.00 H ATOM 31723 H2 WAT 511 133.079 133.881 12.986 1.00 0.00 H TER 31725 WAT 511 ATOM 31725 O WAT 512 0.912 6.960 131.721 1.00 0.00 O ATOM 31726 H1 WAT 512 0.964 7.815 131.292 1.00 0.00 H ATOM 31727 H2 WAT 512 0.262 6.476 131.212 1.00 0.00 H TER 31729 WAT 512 ATOM 31729 O WAT 513 135.552 129.169 3.662 1.00 0.00 O ATOM 31730 H1 WAT 513 136.266 128.897 4.239 1.00 0.00 H ATOM 31731 H2 WAT 513 135.554 130.125 3.714 1.00 0.00 H TER 31733 WAT 513 ATOM 31733 O WAT 514 96.476 109.439 74.988 1.00 0.00 O ATOM 31734 H1 WAT 514 95.596 109.426 74.612 1.00 0.00 H ATOM 31735 H2 WAT 514 96.608 108.550 75.320 1.00 0.00 H TER 31737 WAT 514 ATOM 31737 O WAT 515 104.316 124.553 96.067 1.00 0.00 O ATOM 31738 H1 WAT 515 104.914 124.991 95.461 1.00 0.00 H ATOM 31739 H2 WAT 515 103.449 124.679 95.681 1.00 0.00 H TER 31741 WAT 515 ATOM 31741 O WAT 516 55.910 100.042 72.357 1.00 0.00 O ATOM 31742 H1 WAT 516 55.791 99.548 73.168 1.00 0.00 H ATOM 31743 H2 WAT 516 55.781 99.396 71.662 1.00 0.00 H TER 31745 WAT 516 ATOM 31745 O WAT 517 109.209 24.310 8.635 1.00 0.00 O ATOM 31746 H1 WAT 517 108.721 24.563 9.418 1.00 0.00 H ATOM 31747 H2 WAT 517 110.093 24.642 8.786 1.00 0.00 H TER 31749 WAT 517 ATOM 31749 O WAT 518 60.011 93.266 26.072 1.00 0.00 O ATOM 31750 H1 WAT 518 59.487 92.754 25.457 1.00 0.00 H ATOM 31751 H2 WAT 518 59.875 94.175 25.804 1.00 0.00 H TER 31753 WAT 518 ATOM 31753 O WAT 519 61.703 99.367 77.701 1.00 0.00 O ATOM 31754 H1 WAT 519 61.077 100.035 77.421 1.00 0.00 H ATOM 31755 H2 WAT 519 62.511 99.851 77.869 1.00 0.00 H TER 31757 WAT 519 ATOM 31757 O WAT 520 51.896 35.033 22.717 1.00 0.00 O ATOM 31758 H1 WAT 520 52.733 34.571 22.766 1.00 0.00 H ATOM 31759 H2 WAT 520 51.243 34.371 22.945 1.00 0.00 H TER 31761 WAT 520 ATOM 31761 O WAT 521 126.440 69.007 59.243 1.00 0.00 O ATOM 31762 H1 WAT 521 126.345 68.071 59.063 1.00 0.00 H ATOM 31763 H2 WAT 521 126.810 69.369 58.438 1.00 0.00 H TER 31765 WAT 521 ATOM 31765 O WAT 522 86.073 65.177 128.651 1.00 0.00 O ATOM 31766 H1 WAT 522 86.028 65.482 129.557 1.00 0.00 H ATOM 31767 H2 WAT 522 85.226 64.757 128.498 1.00 0.00 H TER 31769 WAT 522 ATOM 31769 O WAT 523 117.832 82.115 151.828 1.00 0.00 O ATOM 31770 H1 WAT 523 117.864 83.070 151.766 1.00 0.00 H ATOM 31771 H2 WAT 523 118.575 81.817 151.304 1.00 0.00 H TER 31773 WAT 523 ATOM 31773 O WAT 524 136.798 8.796 122.826 1.00 0.00 O ATOM 31774 H1 WAT 524 137.329 8.717 122.034 1.00 0.00 H ATOM 31775 H2 WAT 524 137.130 8.111 123.407 1.00 0.00 H TER 31777 WAT 524 ATOM 31777 O WAT 525 128.974 121.496 13.034 1.00 0.00 O ATOM 31778 H1 WAT 525 129.036 122.451 13.059 1.00 0.00 H ATOM 31779 H2 WAT 525 128.038 121.314 13.122 1.00 0.00 H TER 31781 WAT 525 ATOM 31781 O WAT 526 0.674 106.231 107.056 1.00 0.00 O ATOM 31782 H1 WAT 526 1.337 106.209 107.746 1.00 0.00 H ATOM 31783 H2 WAT 526 1.020 106.848 106.411 1.00 0.00 H TER 31785 WAT 526 ATOM 31785 O WAT 527 0.425 130.419 108.071 1.00 0.00 O ATOM 31786 H1 WAT 527 0.886 130.164 108.869 1.00 0.00 H ATOM 31787 H2 WAT 527 1.081 130.338 107.378 1.00 0.00 H TER 31789 WAT 527 ATOM 31789 O WAT 528 71.278 33.284 68.216 1.00 0.00 O ATOM 31790 H1 WAT 528 70.877 33.806 67.521 1.00 0.00 H ATOM 31791 H2 WAT 528 71.405 33.901 68.937 1.00 0.00 H TER 31793 WAT 528 ATOM 31793 O WAT 529 129.763 142.611 107.001 1.00 0.00 O ATOM 31794 H1 WAT 529 130.436 143.054 107.518 1.00 0.00 H ATOM 31795 H2 WAT 529 130.112 141.732 106.856 1.00 0.00 H TER 31797 WAT 529 ATOM 31797 O WAT 530 25.691 27.196 143.257 1.00 0.00 O ATOM 31798 H1 WAT 530 26.367 26.540 143.427 1.00 0.00 H ATOM 31799 H2 WAT 530 25.706 27.761 144.029 1.00 0.00 H TER 31801 WAT 530 ATOM 31801 O WAT 531 93.344 30.350 157.086 1.00 0.00 O ATOM 31802 H1 WAT 531 94.079 29.805 156.806 1.00 0.00 H ATOM 31803 H2 WAT 531 93.002 29.910 157.864 1.00 0.00 H TER 31805 WAT 531 ATOM 31805 O WAT 532 79.921 71.317 81.336 1.00 0.00 O ATOM 31806 H1 WAT 532 80.565 70.609 81.339 1.00 0.00 H ATOM 31807 H2 WAT 532 80.033 71.746 82.184 1.00 0.00 H TER 31809 WAT 532 ATOM 31809 O WAT 533 125.051 52.148 67.425 1.00 0.00 O ATOM 31810 H1 WAT 533 125.934 52.399 67.699 1.00 0.00 H ATOM 31811 H2 WAT 533 124.967 51.234 67.694 1.00 0.00 H TER 31813 WAT 533 ATOM 31813 O WAT 534 139.255 129.774 132.959 1.00 0.00 O ATOM 31814 H1 WAT 534 139.894 130.159 133.558 1.00 0.00 H ATOM 31815 H2 WAT 534 139.757 129.573 132.170 1.00 0.00 H TER 31817 WAT 534 ATOM 31817 O WAT 535 7.026 8.288 103.718 1.00 0.00 O ATOM 31818 H1 WAT 535 7.182 7.490 103.214 1.00 0.00 H ATOM 31819 H2 WAT 535 6.403 8.026 104.396 1.00 0.00 H TER 31821 WAT 535 ATOM 31821 O WAT 536 17.280 19.693 118.234 1.00 0.00 O ATOM 31822 H1 WAT 536 16.529 19.779 118.821 1.00 0.00 H ATOM 31823 H2 WAT 536 17.981 20.176 118.670 1.00 0.00 H TER 31825 WAT 536 ATOM 31825 O WAT 537 6.915 141.936 140.239 1.00 0.00 O ATOM 31826 H1 WAT 537 7.485 141.809 139.480 1.00 0.00 H ATOM 31827 H2 WAT 537 6.896 141.081 140.668 1.00 0.00 H TER 31829 WAT 537 ATOM 31829 O WAT 538 137.023 36.579 112.426 1.00 0.00 O ATOM 31830 H1 WAT 538 136.076 36.707 112.480 1.00 0.00 H ATOM 31831 H2 WAT 538 137.139 35.949 111.715 1.00 0.00 H TER 31833 WAT 538 ATOM 31833 O WAT 539 117.310 71.768 15.426 1.00 0.00 O ATOM 31834 H1 WAT 539 117.902 72.407 15.825 1.00 0.00 H ATOM 31835 H2 WAT 539 117.819 70.958 15.394 1.00 0.00 H TER 31837 WAT 539 ATOM 31837 O WAT 540 120.429 115.070 102.741 1.00 0.00 O ATOM 31838 H1 WAT 540 120.711 114.277 103.197 1.00 0.00 H ATOM 31839 H2 WAT 540 120.800 114.985 101.862 1.00 0.00 H TER 31841 WAT 540 ATOM 31841 O WAT 541 76.144 81.344 8.383 1.00 0.00 O ATOM 31842 H1 WAT 541 76.326 81.587 7.475 1.00 0.00 H ATOM 31843 H2 WAT 541 76.809 81.806 8.893 1.00 0.00 H TER 31845 WAT 541 ATOM 31845 O WAT 542 66.454 14.293 51.088 1.00 0.00 O ATOM 31846 H1 WAT 542 66.668 14.268 52.020 1.00 0.00 H ATOM 31847 H2 WAT 542 65.506 14.422 51.063 1.00 0.00 H TER 31849 WAT 542 ATOM 31849 O WAT 543 91.688 122.911 69.501 1.00 0.00 O ATOM 31850 H1 WAT 543 90.826 123.232 69.237 1.00 0.00 H ATOM 31851 H2 WAT 543 91.898 122.233 68.860 1.00 0.00 H TER 31853 WAT 543 ATOM 31853 O WAT 544 89.584 64.193 8.260 1.00 0.00 O ATOM 31854 H1 WAT 544 89.953 63.695 8.989 1.00 0.00 H ATOM 31855 H2 WAT 544 90.256 64.154 7.579 1.00 0.00 H TER 31857 WAT 544 ATOM 31857 O WAT 545 39.674 121.305 11.781 1.00 0.00 O ATOM 31858 H1 WAT 545 39.094 122.063 11.711 1.00 0.00 H ATOM 31859 H2 WAT 545 40.347 121.456 11.118 1.00 0.00 H TER 31861 WAT 545 ATOM 31861 O WAT 546 54.838 47.539 94.287 1.00 0.00 O ATOM 31862 H1 WAT 546 54.418 47.765 93.457 1.00 0.00 H ATOM 31863 H2 WAT 546 54.313 47.985 94.951 1.00 0.00 H TER 31865 WAT 546 ATOM 31865 O WAT 547 18.377 100.162 80.118 1.00 0.00 O ATOM 31866 H1 WAT 547 17.644 99.845 79.591 1.00 0.00 H ATOM 31867 H2 WAT 547 19.151 99.982 79.585 1.00 0.00 H TER 31869 WAT 547 ATOM 31869 O WAT 548 108.760 103.215 77.329 1.00 0.00 O ATOM 31870 H1 WAT 548 108.640 103.656 76.487 1.00 0.00 H ATOM 31871 H2 WAT 548 109.108 102.353 77.100 1.00 0.00 H TER 31873 WAT 548 ATOM 31873 O WAT 549 83.160 62.083 108.086 1.00 0.00 O ATOM 31874 H1 WAT 549 82.624 62.791 107.728 1.00 0.00 H ATOM 31875 H2 WAT 549 82.556 61.577 108.630 1.00 0.00 H TER 31877 WAT 549 ATOM 31877 O WAT 550 62.532 95.345 105.670 1.00 0.00 O ATOM 31878 H1 WAT 550 62.818 94.656 105.070 1.00 0.00 H ATOM 31879 H2 WAT 550 61.991 94.889 106.316 1.00 0.00 H TER 31881 WAT 550 ATOM 31881 O WAT 551 42.474 130.900 155.042 1.00 0.00 O ATOM 31882 H1 WAT 551 42.529 129.954 155.179 1.00 0.00 H ATOM 31883 H2 WAT 551 43.181 131.094 154.426 1.00 0.00 H TER 31885 WAT 551 ATOM 31885 O WAT 552 134.669 1.687 7.304 1.00 0.00 O ATOM 31886 H1 WAT 552 135.538 1.779 6.913 1.00 0.00 H ATOM 31887 H2 WAT 552 134.222 1.051 6.745 1.00 0.00 H TER 31889 WAT 552 ATOM 31889 O WAT 553 63.724 57.834 111.233 1.00 0.00 O ATOM 31890 H1 WAT 553 64.438 57.305 110.877 1.00 0.00 H ATOM 31891 H2 WAT 553 64.000 58.038 112.126 1.00 0.00 H TER 31893 WAT 553 ATOM 31893 O WAT 554 38.936 2.759 99.800 1.00 0.00 O ATOM 31894 H1 WAT 554 38.618 2.416 98.965 1.00 0.00 H ATOM 31895 H2 WAT 554 38.963 1.997 100.378 1.00 0.00 H TER 31897 WAT 554 ATOM 31897 O WAT 555 90.770 41.927 128.545 1.00 0.00 O ATOM 31898 H1 WAT 555 91.584 41.480 128.776 1.00 0.00 H ATOM 31899 H2 WAT 555 90.751 42.698 129.113 1.00 0.00 H TER 31901 WAT 555 ATOM 31901 O WAT 556 100.877 11.217 109.746 1.00 0.00 O ATOM 31902 H1 WAT 556 101.541 11.696 110.242 1.00 0.00 H ATOM 31903 H2 WAT 556 100.675 11.787 109.004 1.00 0.00 H TER 31905 WAT 556 ATOM 31905 O WAT 557 89.223 101.708 24.116 1.00 0.00 O ATOM 31906 H1 WAT 557 89.988 101.133 24.098 1.00 0.00 H ATOM 31907 H2 WAT 557 88.528 101.194 23.704 1.00 0.00 H TER 31909 WAT 557 ATOM 31909 O WAT 558 37.225 91.965 63.897 1.00 0.00 O ATOM 31910 H1 WAT 558 37.038 92.442 63.089 1.00 0.00 H ATOM 31911 H2 WAT 558 36.378 91.895 64.336 1.00 0.00 H TER 31913 WAT 558 ATOM 31913 O WAT 559 67.945 45.561 91.779 1.00 0.00 O ATOM 31914 H1 WAT 559 68.125 45.582 92.719 1.00 0.00 H ATOM 31915 H2 WAT 559 68.565 44.921 91.431 1.00 0.00 H TER 31917 WAT 559 ATOM 31917 O WAT 560 15.280 13.109 150.186 1.00 0.00 O ATOM 31918 H1 WAT 560 15.490 13.898 150.687 1.00 0.00 H ATOM 31919 H2 WAT 560 15.995 13.031 149.553 1.00 0.00 H TER 31921 WAT 560 ATOM 31921 O WAT 561 51.746 52.517 99.627 1.00 0.00 O ATOM 31922 H1 WAT 561 52.557 52.627 100.123 1.00 0.00 H ATOM 31923 H2 WAT 561 51.426 53.409 99.490 1.00 0.00 H TER 31925 WAT 561 ATOM 31925 O WAT 562 69.172 125.422 132.135 1.00 0.00 O ATOM 31926 H1 WAT 562 69.511 126.248 132.480 1.00 0.00 H ATOM 31927 H2 WAT 562 69.656 124.747 132.612 1.00 0.00 H TER 31929 WAT 562 ATOM 31929 O WAT 563 75.701 106.820 152.663 1.00 0.00 O ATOM 31930 H1 WAT 563 76.170 106.527 151.882 1.00 0.00 H ATOM 31931 H2 WAT 563 75.763 106.083 153.271 1.00 0.00 H TER 31933 WAT 563 ATOM 31933 O WAT 564 46.151 103.594 99.285 1.00 0.00 O ATOM 31934 H1 WAT 564 45.578 104.308 99.007 1.00 0.00 H ATOM 31935 H2 WAT 564 45.563 102.847 99.399 1.00 0.00 H TER 31937 WAT 564 ATOM 31937 O WAT 565 39.822 109.710 158.267 1.00 0.00 O ATOM 31938 H1 WAT 565 39.789 110.050 157.373 1.00 0.00 H ATOM 31939 H2 WAT 565 40.495 110.236 158.699 1.00 0.00 H TER 31941 WAT 565 ATOM 31941 O WAT 566 46.202 11.018 0.904 1.00 0.00 O ATOM 31942 H1 WAT 566 45.700 11.820 0.762 1.00 0.00 H ATOM 31943 H2 WAT 566 45.755 10.358 0.373 1.00 0.00 H TER 31945 WAT 566 ATOM 31945 O WAT 567 145.622 55.034 11.692 1.00 0.00 O ATOM 31946 H1 WAT 567 144.980 54.358 11.477 1.00 0.00 H ATOM 31947 H2 WAT 567 145.165 55.859 11.530 1.00 0.00 H TER 31949 WAT 567 ATOM 31949 O WAT 568 118.905 20.714 84.129 1.00 0.00 O ATOM 31950 H1 WAT 568 119.018 20.902 83.197 1.00 0.00 H ATOM 31951 H2 WAT 568 119.141 19.791 84.217 1.00 0.00 H TER 31953 WAT 568 ATOM 31953 O WAT 569 65.255 101.983 102.484 1.00 0.00 O ATOM 31954 H1 WAT 569 64.578 101.479 102.936 1.00 0.00 H ATOM 31955 H2 WAT 569 66.068 101.514 102.671 1.00 0.00 H TER 31957 WAT 569 ATOM 31957 O WAT 570 91.082 113.207 110.080 1.00 0.00 O ATOM 31958 H1 WAT 570 90.633 112.448 109.706 1.00 0.00 H ATOM 31959 H2 WAT 570 90.474 113.934 109.949 1.00 0.00 H TER 31961 WAT 570 ATOM 31961 O WAT 571 65.744 37.857 11.344 1.00 0.00 O ATOM 31962 H1 WAT 571 65.121 37.153 11.520 1.00 0.00 H ATOM 31963 H2 WAT 571 65.734 38.390 12.139 1.00 0.00 H TER 31965 WAT 571 ATOM 31965 O WAT 572 78.687 73.414 53.126 1.00 0.00 O ATOM 31966 H1 WAT 572 78.446 74.326 52.961 1.00 0.00 H ATOM 31967 H2 WAT 572 79.193 73.443 53.938 1.00 0.00 H TER 31969 WAT 572 ATOM 31969 O WAT 573 107.958 33.377 85.206 1.00 0.00 O ATOM 31970 H1 WAT 573 107.923 32.853 84.406 1.00 0.00 H ATOM 31971 H2 WAT 573 108.583 34.075 85.009 1.00 0.00 H TER 31973 WAT 573 ATOM 31973 O WAT 574 143.816 62.072 92.807 1.00 0.00 O ATOM 31974 H1 WAT 574 144.273 61.301 93.143 1.00 0.00 H ATOM 31975 H2 WAT 574 144.312 62.814 93.152 1.00 0.00 H TER 31977 WAT 574 ATOM 31977 O WAT 575 21.112 7.492 137.613 1.00 0.00 O ATOM 31978 H1 WAT 575 21.709 6.743 137.609 1.00 0.00 H ATOM 31979 H2 WAT 575 20.255 7.115 137.418 1.00 0.00 H TER 31981 WAT 575 ATOM 31981 O WAT 576 66.250 34.074 64.845 1.00 0.00 O ATOM 31982 H1 WAT 576 66.065 34.118 63.907 1.00 0.00 H ATOM 31983 H2 WAT 576 66.594 34.941 65.062 1.00 0.00 H TER 31985 WAT 576 ATOM 31985 O WAT 577 39.060 70.455 104.174 1.00 0.00 O ATOM 31986 H1 WAT 577 38.292 70.981 103.953 1.00 0.00 H ATOM 31987 H2 WAT 577 38.873 69.592 103.805 1.00 0.00 H TER 31989 WAT 577 ATOM 31989 O WAT 578 57.289 12.234 146.990 1.00 0.00 O ATOM 31990 H1 WAT 578 56.413 12.435 147.319 1.00 0.00 H ATOM 31991 H2 WAT 578 57.804 13.016 147.188 1.00 0.00 H TER 31993 WAT 578 ATOM 31993 O WAT 579 39.120 44.041 81.407 1.00 0.00 O ATOM 31994 H1 WAT 579 38.368 44.405 81.873 1.00 0.00 H ATOM 31995 H2 WAT 579 38.748 43.359 80.848 1.00 0.00 H TER 31997 WAT 579 ATOM 31997 O WAT 580 108.389 77.309 137.294 1.00 0.00 O ATOM 31998 H1 WAT 580 107.813 76.550 137.206 1.00 0.00 H ATOM 31999 H2 WAT 580 108.802 77.199 138.151 1.00 0.00 H TER 32001 WAT 580 ATOM 32001 O WAT 581 9.264 1.331 102.414 1.00 0.00 O ATOM 32002 H1 WAT 581 8.952 2.164 102.062 1.00 0.00 H ATOM 32003 H2 WAT 581 8.762 1.208 103.220 1.00 0.00 H TER 32005 WAT 581 ATOM 32005 O WAT 582 139.524 28.740 111.214 1.00 0.00 O ATOM 32006 H1 WAT 582 139.238 28.700 112.127 1.00 0.00 H ATOM 32007 H2 WAT 582 139.397 29.655 110.963 1.00 0.00 H TER 32009 WAT 582 ATOM 32009 O WAT 583 28.002 124.185 148.465 1.00 0.00 O ATOM 32010 H1 WAT 583 28.281 124.914 149.018 1.00 0.00 H ATOM 32011 H2 WAT 583 28.320 124.412 147.591 1.00 0.00 H TER 32013 WAT 583 ATOM 32013 O WAT 584 79.647 23.070 97.539 1.00 0.00 O ATOM 32014 H1 WAT 584 80.181 23.858 97.634 1.00 0.00 H ATOM 32015 H2 WAT 584 80.281 22.365 97.405 1.00 0.00 H TER 32017 WAT 584 ATOM 32017 O WAT 585 125.011 43.908 155.696 1.00 0.00 O ATOM 32018 H1 WAT 585 125.087 44.022 156.643 1.00 0.00 H ATOM 32019 H2 WAT 585 125.132 42.969 155.557 1.00 0.00 H TER 32021 WAT 585 ATOM 32021 O WAT 586 116.085 106.525 125.751 1.00 0.00 O ATOM 32022 H1 WAT 586 115.443 106.794 126.408 1.00 0.00 H ATOM 32023 H2 WAT 586 116.928 106.585 126.201 1.00 0.00 H TER 32025 WAT 586 ATOM 32025 O WAT 587 103.136 75.524 129.562 1.00 0.00 O ATOM 32026 H1 WAT 587 103.386 75.041 128.775 1.00 0.00 H ATOM 32027 H2 WAT 587 102.199 75.687 129.456 1.00 0.00 H TER 32029 WAT 587 ATOM 32029 O WAT 588 33.961 19.795 80.712 1.00 0.00 O ATOM 32030 H1 WAT 588 34.552 19.960 79.977 1.00 0.00 H ATOM 32031 H2 WAT 588 33.625 20.660 80.947 1.00 0.00 H TER 32033 WAT 588 ATOM 32033 O WAT 589 97.425 1.072 83.887 1.00 0.00 O ATOM 32034 H1 WAT 589 97.580 0.294 83.351 1.00 0.00 H ATOM 32035 H2 WAT 589 96.840 1.615 83.359 1.00 0.00 H TER 32037 WAT 589 ATOM 32037 O WAT 590 103.336 66.599 25.530 1.00 0.00 O ATOM 32038 H1 WAT 590 102.449 66.341 25.780 1.00 0.00 H ATOM 32039 H2 WAT 590 103.560 67.306 26.135 1.00 0.00 H TER 32041 WAT 590 ATOM 32041 O WAT 591 134.537 32.934 64.340 1.00 0.00 O ATOM 32042 H1 WAT 591 135.433 33.016 64.011 1.00 0.00 H ATOM 32043 H2 WAT 591 134.295 33.823 64.599 1.00 0.00 H TER 32045 WAT 591 ATOM 32045 O WAT 592 60.409 47.996 143.520 1.00 0.00 O ATOM 32046 H1 WAT 592 59.803 48.243 144.218 1.00 0.00 H ATOM 32047 H2 WAT 592 59.850 47.871 142.752 1.00 0.00 H TER 32049 WAT 592 ATOM 32049 O WAT 593 104.405 122.086 100.038 1.00 0.00 O ATOM 32050 H1 WAT 593 104.309 122.973 99.691 1.00 0.00 H ATOM 32051 H2 WAT 593 104.367 122.195 100.988 1.00 0.00 H TER 32053 WAT 593 ATOM 32053 O WAT 594 134.309 88.750 0.590 1.00 0.00 O ATOM 32054 H1 WAT 594 134.569 88.028 1.163 1.00 0.00 H ATOM 32055 H2 WAT 594 133.835 88.327 -0.127 1.00 0.00 H TER 32057 WAT 594 ATOM 32057 O WAT 595 130.629 27.771 139.189 1.00 0.00 O ATOM 32058 H1 WAT 595 130.984 27.315 138.425 1.00 0.00 H ATOM 32059 H2 WAT 595 131.179 28.549 139.280 1.00 0.00 H TER 32061 WAT 595 ATOM 32061 O WAT 596 29.474 22.213 14.328 1.00 0.00 O ATOM 32062 H1 WAT 596 29.612 22.884 14.996 1.00 0.00 H ATOM 32063 H2 WAT 596 28.695 21.740 14.620 1.00 0.00 H TER 32065 WAT 596 ATOM 32065 O WAT 597 50.112 86.887 113.932 1.00 0.00 O ATOM 32066 H1 WAT 597 51.040 87.111 113.866 1.00 0.00 H ATOM 32067 H2 WAT 597 49.782 87.440 114.640 1.00 0.00 H TER 32069 WAT 597 ATOM 32069 O WAT 598 66.567 60.919 142.656 1.00 0.00 O ATOM 32070 H1 WAT 598 66.563 61.562 141.946 1.00 0.00 H ATOM 32071 H2 WAT 598 65.872 60.303 142.425 1.00 0.00 H TER 32073 WAT 598 ATOM 32073 O WAT 599 47.326 14.329 112.203 1.00 0.00 O ATOM 32074 H1 WAT 599 47.069 13.854 112.993 1.00 0.00 H ATOM 32075 H2 WAT 599 47.760 13.672 111.658 1.00 0.00 H TER 32077 WAT 599 ATOM 32077 O WAT 600 117.310 28.565 15.674 1.00 0.00 O ATOM 32078 H1 WAT 600 118.172 28.965 15.797 1.00 0.00 H ATOM 32079 H2 WAT 600 117.229 28.458 14.727 1.00 0.00 H TER 32081 WAT 600 ATOM 32081 O WAT 601 26.197 93.696 16.317 1.00 0.00 O ATOM 32082 H1 WAT 601 26.185 93.565 17.265 1.00 0.00 H ATOM 32083 H2 WAT 601 27.007 93.274 16.028 1.00 0.00 H TER 32085 WAT 601 ATOM 32085 O WAT 602 101.622 91.686 121.961 1.00 0.00 O ATOM 32086 H1 WAT 602 100.853 91.655 121.392 1.00 0.00 H ATOM 32087 H2 WAT 602 101.386 92.306 122.650 1.00 0.00 H TER 32089 WAT 602 ATOM 32089 O WAT 603 15.775 19.988 18.837 1.00 0.00 O ATOM 32090 H1 WAT 603 15.080 20.382 19.364 1.00 0.00 H ATOM 32091 H2 WAT 603 15.467 20.069 17.935 1.00 0.00 H TER 32093 WAT 603 ATOM 32093 O WAT 604 78.460 38.559 155.965 1.00 0.00 O ATOM 32094 H1 WAT 604 78.623 37.818 156.548 1.00 0.00 H ATOM 32095 H2 WAT 604 77.637 38.934 156.277 1.00 0.00 H TER 32097 WAT 604 ATOM 32097 O WAT 605 93.084 16.481 97.718 1.00 0.00 O ATOM 32098 H1 WAT 605 93.364 17.317 97.346 1.00 0.00 H ATOM 32099 H2 WAT 605 93.029 16.644 98.660 1.00 0.00 H TER 32101 WAT 605 ATOM 32101 O WAT 606 59.456 76.902 81.443 1.00 0.00 O ATOM 32102 H1 WAT 606 59.409 76.039 81.853 1.00 0.00 H ATOM 32103 H2 WAT 606 59.449 77.517 82.176 1.00 0.00 H TER 32105 WAT 606 ATOM 32105 O WAT 607 59.328 109.779 107.582 1.00 0.00 O ATOM 32106 H1 WAT 607 59.695 109.697 106.702 1.00 0.00 H ATOM 32107 H2 WAT 607 58.758 109.016 107.677 1.00 0.00 H TER 32109 WAT 607 ATOM 32109 O WAT 608 124.414 105.104 88.040 1.00 0.00 O ATOM 32110 H1 WAT 608 124.195 105.639 87.276 1.00 0.00 H ATOM 32111 H2 WAT 608 123.586 104.695 88.291 1.00 0.00 H TER 32113 WAT 608 ATOM 32113 O WAT 609 19.920 33.162 7.634 1.00 0.00 O ATOM 32114 H1 WAT 609 19.121 33.040 7.120 1.00 0.00 H ATOM 32115 H2 WAT 609 20.572 32.616 7.194 1.00 0.00 H TER 32117 WAT 609 ATOM 32117 O WAT 610 112.245 60.114 4.402 1.00 0.00 O ATOM 32118 H1 WAT 610 112.800 59.504 4.888 1.00 0.00 H ATOM 32119 H2 WAT 610 112.231 60.905 4.942 1.00 0.00 H TER 32121 WAT 610 ATOM 32121 O WAT 611 108.182 72.282 129.406 1.00 0.00 O ATOM 32122 H1 WAT 611 108.713 71.516 129.190 1.00 0.00 H ATOM 32123 H2 WAT 611 107.281 71.958 129.399 1.00 0.00 H TER 32125 WAT 611 ATOM 32125 O WAT 612 16.834 104.684 86.941 1.00 0.00 O ATOM 32126 H1 WAT 612 17.382 104.114 87.481 1.00 0.00 H ATOM 32127 H2 WAT 612 15.946 104.348 87.063 1.00 0.00 H TER 32129 WAT 612 ATOM 32129 O WAT 613 97.300 58.528 139.288 1.00 0.00 O ATOM 32130 H1 WAT 613 97.989 59.006 138.827 1.00 0.00 H ATOM 32131 H2 WAT 613 97.612 57.624 139.316 1.00 0.00 H TER 32133 WAT 613 ATOM 32133 O WAT 614 22.581 73.907 151.757 1.00 0.00 O ATOM 32134 H1 WAT 614 22.529 73.739 152.698 1.00 0.00 H ATOM 32135 H2 WAT 614 21.686 73.778 151.441 1.00 0.00 H TER 32137 WAT 614 ATOM 32137 O WAT 615 41.496 4.950 113.394 1.00 0.00 O ATOM 32138 H1 WAT 615 42.342 4.531 113.551 1.00 0.00 H ATOM 32139 H2 WAT 615 41.596 5.832 113.753 1.00 0.00 H TER 32141 WAT 615 ATOM 32141 O WAT 616 58.706 104.287 81.336 1.00 0.00 O ATOM 32142 H1 WAT 616 58.329 103.895 82.123 1.00 0.00 H ATOM 32143 H2 WAT 616 57.969 104.362 80.729 1.00 0.00 H TER 32145 WAT 616 ATOM 32145 O WAT 617 91.295 1.273 68.722 1.00 0.00 O ATOM 32146 H1 WAT 617 90.508 1.773 68.507 1.00 0.00 H ATOM 32147 H2 WAT 617 92.016 1.807 68.391 1.00 0.00 H TER 32149 WAT 617 ATOM 32149 O WAT 618 137.049 42.597 83.119 1.00 0.00 O ATOM 32150 H1 WAT 618 136.629 41.939 82.565 1.00 0.00 H ATOM 32151 H2 WAT 618 136.349 42.911 83.691 1.00 0.00 H TER 32153 WAT 618 ATOM 32153 O WAT 619 24.510 73.448 110.532 1.00 0.00 O ATOM 32154 H1 WAT 619 24.904 73.192 109.698 1.00 0.00 H ATOM 32155 H2 WAT 619 24.556 74.404 110.535 1.00 0.00 H TER 32157 WAT 619 ATOM 32157 O WAT 620 95.087 3.896 4.067 1.00 0.00 O ATOM 32158 H1 WAT 620 95.374 4.782 4.287 1.00 0.00 H ATOM 32159 H2 WAT 620 95.057 3.885 3.110 1.00 0.00 H TER 32161 WAT 620 ATOM 32161 O WAT 621 60.701 15.113 82.952 1.00 0.00 O ATOM 32162 H1 WAT 621 61.656 15.085 82.895 1.00 0.00 H ATOM 32163 H2 WAT 621 60.520 15.765 83.630 1.00 0.00 H TER 32165 WAT 621 ATOM 32165 O WAT 622 18.643 86.343 146.579 1.00 0.00 O ATOM 32166 H1 WAT 622 18.977 86.511 147.460 1.00 0.00 H ATOM 32167 H2 WAT 622 18.073 87.090 146.392 1.00 0.00 H TER 32169 WAT 622 ATOM 32169 O WAT 623 27.315 62.084 138.722 1.00 0.00 O ATOM 32170 H1 WAT 623 27.735 62.936 138.837 1.00 0.00 H ATOM 32171 H2 WAT 623 26.405 62.293 138.510 1.00 0.00 H TER 32173 WAT 623 ATOM 32173 O WAT 624 81.535 33.134 97.050 1.00 0.00 O ATOM 32174 H1 WAT 624 81.987 32.831 96.263 1.00 0.00 H ATOM 32175 H2 WAT 624 81.117 32.348 97.403 1.00 0.00 H TER 32177 WAT 624 ATOM 32177 O WAT 625 61.380 57.334 6.569 1.00 0.00 O ATOM 32178 H1 WAT 625 61.265 58.279 6.471 1.00 0.00 H ATOM 32179 H2 WAT 625 60.562 56.957 6.245 1.00 0.00 H TER 32181 WAT 625 ATOM 32181 O WAT 626 69.291 16.694 116.945 1.00 0.00 O ATOM 32182 H1 WAT 626 69.083 16.088 117.657 1.00 0.00 H ATOM 32183 H2 WAT 626 69.290 17.558 117.358 1.00 0.00 H TER 32185 WAT 626 ATOM 32185 O WAT 627 68.559 3.677 104.096 1.00 0.00 O ATOM 32186 H1 WAT 627 68.892 4.238 103.396 1.00 0.00 H ATOM 32187 H2 WAT 627 69.340 3.409 104.580 1.00 0.00 H TER 32189 WAT 627 ATOM 32189 O WAT 628 32.885 127.917 74.066 1.00 0.00 O ATOM 32190 H1 WAT 628 31.941 127.993 73.922 1.00 0.00 H ATOM 32191 H2 WAT 628 33.186 128.822 74.152 1.00 0.00 H TER 32193 WAT 628 ATOM 32193 O WAT 629 140.195 123.799 82.386 1.00 0.00 O ATOM 32194 H1 WAT 629 140.880 124.080 81.779 1.00 0.00 H ATOM 32195 H2 WAT 629 140.265 124.405 83.123 1.00 0.00 H TER 32197 WAT 629 ATOM 32197 O WAT 630 36.406 75.372 138.830 1.00 0.00 O ATOM 32198 H1 WAT 630 37.120 75.997 138.957 1.00 0.00 H ATOM 32199 H2 WAT 630 36.825 74.604 138.442 1.00 0.00 H TER 32201 WAT 630 ATOM 32201 O WAT 631 10.365 55.522 78.921 1.00 0.00 O ATOM 32202 H1 WAT 631 9.520 55.306 79.317 1.00 0.00 H ATOM 32203 H2 WAT 631 10.903 55.821 79.654 1.00 0.00 H TER 32205 WAT 631 ATOM 32205 O WAT 632 100.887 103.161 16.680 1.00 0.00 O ATOM 32206 H1 WAT 632 101.475 103.859 16.970 1.00 0.00 H ATOM 32207 H2 WAT 632 100.017 103.455 16.947 1.00 0.00 H TER 32209 WAT 632 ATOM 32209 O WAT 633 82.374 5.549 21.435 1.00 0.00 O ATOM 32210 H1 WAT 633 82.489 5.117 20.588 1.00 0.00 H ATOM 32211 H2 WAT 633 81.482 5.322 21.700 1.00 0.00 H TER 32213 WAT 633 ATOM 32213 O WAT 634 25.883 56.869 100.575 1.00 0.00 O ATOM 32214 H1 WAT 634 26.320 57.354 101.275 1.00 0.00 H ATOM 32215 H2 WAT 634 26.551 56.776 99.895 1.00 0.00 H TER 32217 WAT 634 ATOM 32217 O WAT 635 101.476 91.737 138.781 1.00 0.00 O ATOM 32218 H1 WAT 635 101.779 90.976 139.277 1.00 0.00 H ATOM 32219 H2 WAT 635 100.729 92.067 139.281 1.00 0.00 H TER 32221 WAT 635 ATOM 32221 O WAT 636 115.443 17.645 101.394 1.00 0.00 O ATOM 32222 H1 WAT 636 116.367 17.595 101.638 1.00 0.00 H ATOM 32223 H2 WAT 636 115.452 17.882 100.467 1.00 0.00 H TER 32225 WAT 636 ATOM 32225 O WAT 637 120.645 132.662 147.043 1.00 0.00 O ATOM 32226 H1 WAT 637 120.934 132.548 146.137 1.00 0.00 H ATOM 32227 H2 WAT 637 119.691 132.716 146.985 1.00 0.00 H TER 32229 WAT 637 ATOM 32229 O WAT 638 112.083 124.383 94.583 1.00 0.00 O ATOM 32230 H1 WAT 638 111.690 124.534 95.443 1.00 0.00 H ATOM 32231 H2 WAT 638 112.447 125.233 94.334 1.00 0.00 H TER 32233 WAT 638 ATOM 32233 O WAT 639 70.029 68.331 138.201 1.00 0.00 O ATOM 32234 H1 WAT 639 69.672 69.201 138.376 1.00 0.00 H ATOM 32235 H2 WAT 639 70.734 68.228 138.840 1.00 0.00 H TER 32237 WAT 639 ATOM 32237 O WAT 640 7.143 103.145 3.372 1.00 0.00 O ATOM 32238 H1 WAT 640 6.796 102.640 4.107 1.00 0.00 H ATOM 32239 H2 WAT 640 7.871 103.642 3.746 1.00 0.00 H TER 32241 WAT 640 ATOM 32241 O WAT 641 124.616 51.519 106.278 1.00 0.00 O ATOM 32242 H1 WAT 641 123.664 51.532 106.376 1.00 0.00 H ATOM 32243 H2 WAT 641 124.762 51.633 105.339 1.00 0.00 H TER 32245 WAT 641 ATOM 32245 O WAT 642 3.218 111.766 97.920 1.00 0.00 O ATOM 32246 H1 WAT 642 2.278 111.923 97.832 1.00 0.00 H ATOM 32247 H2 WAT 642 3.625 112.584 97.632 1.00 0.00 H TER 32249 WAT 642 ATOM 32249 O WAT 643 93.775 108.809 10.384 1.00 0.00 O ATOM 32250 H1 WAT 643 93.370 109.354 9.709 1.00 0.00 H ATOM 32251 H2 WAT 643 93.996 107.994 9.932 1.00 0.00 H TER 32253 WAT 643 ATOM 32253 O WAT 644 98.971 118.621 104.004 1.00 0.00 O ATOM 32254 H1 WAT 644 98.147 119.107 104.034 1.00 0.00 H ATOM 32255 H2 WAT 644 99.505 119.012 104.695 1.00 0.00 H TER 32257 WAT 644 ATOM 32257 O WAT 645 54.029 47.052 121.995 1.00 0.00 O ATOM 32258 H1 WAT 645 54.978 47.095 121.874 1.00 0.00 H ATOM 32259 H2 WAT 645 53.840 47.724 122.649 1.00 0.00 H TER 32261 WAT 645 ATOM 32261 O WAT 646 63.727 77.527 91.875 1.00 0.00 O ATOM 32262 H1 WAT 646 63.451 78.420 92.081 1.00 0.00 H ATOM 32263 H2 WAT 646 63.262 76.981 92.508 1.00 0.00 H TER 32265 WAT 646 ATOM 32265 O WAT 647 14.483 54.762 13.812 1.00 0.00 O ATOM 32266 H1 WAT 647 15.401 54.742 14.082 1.00 0.00 H ATOM 32267 H2 WAT 647 14.147 55.586 14.165 1.00 0.00 H TER 32269 WAT 647 ATOM 32269 O WAT 648 61.179 12.067 123.195 1.00 0.00 O ATOM 32270 H1 WAT 648 60.611 12.593 123.758 1.00 0.00 H ATOM 32271 H2 WAT 648 61.206 11.209 123.618 1.00 0.00 H TER 32273 WAT 648 ATOM 32273 O WAT 649 31.244 58.940 82.895 1.00 0.00 O ATOM 32274 H1 WAT 649 32.055 59.332 82.572 1.00 0.00 H ATOM 32275 H2 WAT 649 30.669 59.687 83.066 1.00 0.00 H TER 32277 WAT 649 ATOM 32277 O WAT 650 55.204 27.623 7.952 1.00 0.00 O ATOM 32278 H1 WAT 650 56.004 27.516 8.467 1.00 0.00 H ATOM 32279 H2 WAT 650 54.959 28.540 8.078 1.00 0.00 H TER 32281 WAT 650 ATOM 32281 O WAT 651 13.913 23.836 86.706 1.00 0.00 O ATOM 32282 H1 WAT 651 13.313 24.111 87.399 1.00 0.00 H ATOM 32283 H2 WAT 651 14.444 24.612 86.528 1.00 0.00 H TER 32285 WAT 651 ATOM 32285 O WAT 652 40.420 119.619 93.852 1.00 0.00 O ATOM 32286 H1 WAT 652 40.711 118.769 93.520 1.00 0.00 H ATOM 32287 H2 WAT 652 39.695 119.865 93.279 1.00 0.00 H TER 32289 WAT 652 ATOM 32289 O WAT 653 0.782 23.162 -0.092 1.00 0.00 O ATOM 32290 H1 WAT 653 0.080 22.846 0.477 1.00 0.00 H ATOM 32291 H2 WAT 653 1.532 22.606 0.122 1.00 0.00 H TER 32293 WAT 653 ATOM 32293 O WAT 654 139.111 63.610 77.416 1.00 0.00 O ATOM 32294 H1 WAT 654 138.252 63.990 77.600 1.00 0.00 H ATOM 32295 H2 WAT 654 139.716 64.350 77.466 1.00 0.00 H TER 32297 WAT 654 ATOM 32297 O WAT 655 58.179 129.545 79.649 1.00 0.00 O ATOM 32298 H1 WAT 655 59.022 129.238 79.983 1.00 0.00 H ATOM 32299 H2 WAT 655 57.891 130.196 80.289 1.00 0.00 H TER 32301 WAT 655 ATOM 32301 O WAT 656 28.863 35.753 111.540 1.00 0.00 O ATOM 32302 H1 WAT 656 28.900 35.529 110.610 1.00 0.00 H ATOM 32303 H2 WAT 656 29.777 35.738 111.826 1.00 0.00 H TER 32305 WAT 656 ATOM 32305 O WAT 657 75.392 94.484 129.439 1.00 0.00 O ATOM 32306 H1 WAT 657 74.625 94.701 129.970 1.00 0.00 H ATOM 32307 H2 WAT 657 76.094 94.350 130.076 1.00 0.00 H TER 32309 WAT 657 ATOM 32309 O WAT 658 65.161 128.203 68.213 1.00 0.00 O ATOM 32310 H1 WAT 658 65.293 128.818 67.491 1.00 0.00 H ATOM 32311 H2 WAT 658 65.771 128.494 68.890 1.00 0.00 H TER 32313 WAT 658 ATOM 32313 O WAT 659 8.258 145.121 138.947 1.00 0.00 O ATOM 32314 H1 WAT 659 8.236 144.970 139.892 1.00 0.00 H ATOM 32315 H2 WAT 659 8.161 146.068 138.854 1.00 0.00 H TER 32317 WAT 659 ATOM 32317 O WAT 660 5.454 94.603 118.509 1.00 0.00 O ATOM 32318 H1 WAT 660 6.135 94.774 117.858 1.00 0.00 H ATOM 32319 H2 WAT 660 4.647 94.531 117.999 1.00 0.00 H TER 32321 WAT 660 ATOM 32321 O WAT 661 136.152 3.132 92.231 1.00 0.00 O ATOM 32322 H1 WAT 661 135.752 3.306 91.379 1.00 0.00 H ATOM 32323 H2 WAT 661 136.780 2.429 92.061 1.00 0.00 H TER 32325 WAT 661 ATOM 32325 O WAT 662 40.301 123.961 137.939 1.00 0.00 O ATOM 32326 H1 WAT 662 41.033 123.592 137.446 1.00 0.00 H ATOM 32327 H2 WAT 662 40.477 123.719 138.848 1.00 0.00 H TER 32329 WAT 662 ATOM 32329 O WAT 663 28.458 14.312 120.121 1.00 0.00 O ATOM 32330 H1 WAT 663 28.607 13.430 119.778 1.00 0.00 H ATOM 32331 H2 WAT 663 27.541 14.311 120.395 1.00 0.00 H TER 32333 WAT 663 ATOM 32333 O WAT 664 63.510 53.131 105.728 1.00 0.00 O ATOM 32334 H1 WAT 664 63.885 52.285 105.974 1.00 0.00 H ATOM 32335 H2 WAT 664 63.570 53.150 104.773 1.00 0.00 H TER 32337 WAT 664 ATOM 32337 O WAT 665 31.180 87.331 133.445 1.00 0.00 O ATOM 32338 H1 WAT 665 30.770 86.503 133.194 1.00 0.00 H ATOM 32339 H2 WAT 665 31.767 87.100 134.164 1.00 0.00 H TER 32341 WAT 665 ATOM 32341 O WAT 666 18.047 44.600 59.284 1.00 0.00 O ATOM 32342 H1 WAT 666 17.225 44.519 59.767 1.00 0.00 H ATOM 32343 H2 WAT 666 18.463 43.743 59.374 1.00 0.00 H TER 32345 WAT 666 ATOM 32345 O WAT 667 7.700 45.164 127.374 1.00 0.00 O ATOM 32346 H1 WAT 667 8.157 44.546 127.944 1.00 0.00 H ATOM 32347 H2 WAT 667 7.090 44.622 126.874 1.00 0.00 H TER 32349 WAT 667 ATOM 32349 O WAT 668 48.075 100.589 5.761 1.00 0.00 O ATOM 32350 H1 WAT 668 48.905 100.256 6.104 1.00 0.00 H ATOM 32351 H2 WAT 668 48.028 100.240 4.870 1.00 0.00 H TER 32353 WAT 668 ATOM 32353 O WAT 669 75.708 56.287 156.665 1.00 0.00 O ATOM 32354 H1 WAT 669 75.419 56.812 157.411 1.00 0.00 H ATOM 32355 H2 WAT 669 76.172 55.548 157.057 1.00 0.00 H TER 32357 WAT 669 ATOM 32357 O WAT 670 9.183 138.068 105.408 1.00 0.00 O ATOM 32358 H1 WAT 670 8.367 138.191 104.921 1.00 0.00 H ATOM 32359 H2 WAT 670 9.213 138.807 106.015 1.00 0.00 H TER 32361 WAT 670 ATOM 32361 O WAT 671 32.599 106.021 88.512 1.00 0.00 O ATOM 32362 H1 WAT 671 33.064 106.039 89.348 1.00 0.00 H ATOM 32363 H2 WAT 671 33.291 105.967 87.854 1.00 0.00 H TER 32365 WAT 671 ATOM 32365 O WAT 672 103.685 82.669 0.831 1.00 0.00 O ATOM 32366 H1 WAT 672 104.546 82.249 0.812 1.00 0.00 H ATOM 32367 H2 WAT 672 103.436 82.662 1.755 1.00 0.00 H TER 32369 WAT 672 ATOM 32369 O WAT 673 51.321 60.386 103.905 1.00 0.00 O ATOM 32370 H1 WAT 673 50.458 60.786 103.794 1.00 0.00 H ATOM 32371 H2 WAT 673 51.920 60.980 103.454 1.00 0.00 H TER 32373 WAT 673 ATOM 32373 O WAT 674 83.452 2.072 157.974 1.00 0.00 O ATOM 32374 H1 WAT 674 83.434 2.142 157.019 1.00 0.00 H ATOM 32375 H2 WAT 674 84.090 1.381 158.151 1.00 0.00 H TER 32377 WAT 674 ATOM 32377 O WAT 675 76.709 47.196 21.612 1.00 0.00 O ATOM 32378 H1 WAT 675 76.235 47.760 22.223 1.00 0.00 H ATOM 32379 H2 WAT 675 76.029 46.661 21.202 1.00 0.00 H TER 32381 WAT 675 ATOM 32381 O WAT 676 122.482 79.683 122.131 1.00 0.00 O ATOM 32382 H1 WAT 676 122.498 80.618 121.925 1.00 0.00 H ATOM 32383 H2 WAT 676 121.568 79.503 122.354 1.00 0.00 H TER 32385 WAT 676 ATOM 32385 O WAT 677 23.469 103.607 20.961 1.00 0.00 O ATOM 32386 H1 WAT 677 23.169 102.824 20.501 1.00 0.00 H ATOM 32387 H2 WAT 677 22.680 104.139 21.068 1.00 0.00 H TER 32389 WAT 677 ATOM 32389 O WAT 678 12.810 71.588 154.123 1.00 0.00 O ATOM 32390 H1 WAT 678 13.396 70.898 154.434 1.00 0.00 H ATOM 32391 H2 WAT 678 12.093 71.119 153.697 1.00 0.00 H TER 32393 WAT 678 ATOM 32393 O WAT 679 48.411 94.866 24.335 1.00 0.00 O ATOM 32394 H1 WAT 679 48.931 94.441 25.018 1.00 0.00 H ATOM 32395 H2 WAT 679 47.955 94.147 23.898 1.00 0.00 H TER 32397 WAT 679 ATOM 32397 O WAT 680 113.737 19.921 141.803 1.00 0.00 O ATOM 32398 H1 WAT 680 114.330 19.187 141.964 1.00 0.00 H ATOM 32399 H2 WAT 680 113.615 19.926 140.854 1.00 0.00 H TER 32401 WAT 680 ATOM 32401 O WAT 681 10.199 2.542 114.151 1.00 0.00 O ATOM 32402 H1 WAT 681 10.663 3.047 114.819 1.00 0.00 H ATOM 32403 H2 WAT 681 10.753 2.608 113.373 1.00 0.00 H TER 32405 WAT 681 ATOM 32405 O WAT 682 2.688 82.311 154.515 1.00 0.00 O ATOM 32406 H1 WAT 682 3.309 83.014 154.710 1.00 0.00 H ATOM 32407 H2 WAT 682 3.223 81.517 154.499 1.00 0.00 H TER 32409 WAT 682 ATOM 32409 O WAT 683 69.939 1.600 19.118 1.00 0.00 O ATOM 32410 H1 WAT 683 69.929 2.365 19.694 1.00 0.00 H ATOM 32411 H2 WAT 683 70.464 0.953 19.589 1.00 0.00 H TER 32413 WAT 683 ATOM 32413 O WAT 684 41.840 125.950 86.427 1.00 0.00 O ATOM 32414 H1 WAT 684 42.318 125.856 87.251 1.00 0.00 H ATOM 32415 H2 WAT 684 41.170 125.268 86.460 1.00 0.00 H TER 32417 WAT 684 ATOM 32417 O WAT 685 48.798 144.999 93.485 1.00 0.00 O ATOM 32418 H1 WAT 685 48.114 145.620 93.231 1.00 0.00 H ATOM 32419 H2 WAT 685 48.983 145.208 94.401 1.00 0.00 H TER 32421 WAT 685 ATOM 32421 O WAT 686 16.620 14.608 116.357 1.00 0.00 O ATOM 32422 H1 WAT 686 16.154 14.545 115.523 1.00 0.00 H ATOM 32423 H2 WAT 686 16.124 14.044 116.951 1.00 0.00 H TER 32425 WAT 686 ATOM 32425 O WAT 687 79.925 110.600 13.307 1.00 0.00 O ATOM 32426 H1 WAT 687 79.222 111.132 12.936 1.00 0.00 H ATOM 32427 H2 WAT 687 80.643 111.217 13.451 1.00 0.00 H TER 32429 WAT 687 ATOM 32429 O WAT 688 128.268 53.402 4.451 1.00 0.00 O ATOM 32430 H1 WAT 688 129.002 52.788 4.449 1.00 0.00 H ATOM 32431 H2 WAT 688 128.678 54.266 4.440 1.00 0.00 H TER 32433 WAT 688 ATOM 32433 O WAT 689 19.686 74.634 58.199 1.00 0.00 O ATOM 32434 H1 WAT 689 19.409 75.068 59.005 1.00 0.00 H ATOM 32435 H2 WAT 689 18.907 74.643 57.642 1.00 0.00 H TER 32437 WAT 689 ATOM 32437 O WAT 690 69.593 108.145 74.042 1.00 0.00 O ATOM 32438 H1 WAT 690 69.618 107.921 73.112 1.00 0.00 H ATOM 32439 H2 WAT 690 69.654 109.100 74.061 1.00 0.00 H TER 32441 WAT 690 ATOM 32441 O WAT 691 133.233 87.553 127.384 1.00 0.00 O ATOM 32442 H1 WAT 691 134.008 87.912 127.817 1.00 0.00 H ATOM 32443 H2 WAT 691 132.959 86.828 127.946 1.00 0.00 H TER 32445 WAT 691 ATOM 32445 O WAT 692 14.675 139.326 107.222 1.00 0.00 O ATOM 32446 H1 WAT 692 14.882 139.283 106.289 1.00 0.00 H ATOM 32447 H2 WAT 692 15.458 139.703 107.624 1.00 0.00 H TER 32449 WAT 692 ATOM 32449 O WAT 693 6.732 108.134 70.957 1.00 0.00 O ATOM 32450 H1 WAT 693 6.315 107.287 70.801 1.00 0.00 H ATOM 32451 H2 WAT 693 6.928 108.469 70.082 1.00 0.00 H TER 32453 WAT 693 ATOM 32453 O WAT 694 58.941 57.143 1.553 1.00 0.00 O ATOM 32454 H1 WAT 694 58.035 57.107 1.246 1.00 0.00 H ATOM 32455 H2 WAT 694 59.063 58.050 1.834 1.00 0.00 H TER 32457 WAT 694 ATOM 32457 O WAT 695 85.221 79.798 6.995 1.00 0.00 O ATOM 32458 H1 WAT 695 84.943 78.944 6.665 1.00 0.00 H ATOM 32459 H2 WAT 695 85.583 80.244 6.229 1.00 0.00 H TER 32461 WAT 695 ATOM 32461 O WAT 696 20.761 43.969 95.117 1.00 0.00 O ATOM 32462 H1 WAT 696 20.442 44.667 95.688 1.00 0.00 H ATOM 32463 H2 WAT 696 20.768 43.189 95.673 1.00 0.00 H TER 32465 WAT 696 ATOM 32465 O WAT 697 45.717 73.722 -0.097 1.00 0.00 O ATOM 32466 H1 WAT 697 45.035 73.116 0.193 1.00 0.00 H ATOM 32467 H2 WAT 697 45.377 74.589 0.124 1.00 0.00 H TER 32469 WAT 697 ATOM 32469 O WAT 698 132.297 3.964 122.601 1.00 0.00 O ATOM 32470 H1 WAT 698 132.814 3.992 121.797 1.00 0.00 H ATOM 32471 H2 WAT 698 132.885 3.579 123.251 1.00 0.00 H TER 32473 WAT 698 ATOM 32473 O WAT 699 16.660 87.744 105.719 1.00 0.00 O ATOM 32474 H1 WAT 699 17.410 88.339 105.712 1.00 0.00 H ATOM 32475 H2 WAT 699 17.045 86.874 105.821 1.00 0.00 H TER 32477 WAT 699 ATOM 32477 O WAT 700 106.336 42.887 2.081 1.00 0.00 O ATOM 32478 H1 WAT 700 105.937 43.624 2.543 1.00 0.00 H ATOM 32479 H2 WAT 700 106.517 43.224 1.203 1.00 0.00 H TER 32481 WAT 700 ATOM 32481 O WAT 701 61.163 43.527 5.002 1.00 0.00 O ATOM 32482 H1 WAT 701 61.817 43.169 4.402 1.00 0.00 H ATOM 32483 H2 WAT 701 60.779 44.263 4.526 1.00 0.00 H TER 32485 WAT 701 ATOM 32485 O WAT 702 107.112 65.487 7.770 1.00 0.00 O ATOM 32486 H1 WAT 702 107.050 66.427 7.604 1.00 0.00 H ATOM 32487 H2 WAT 702 108.002 65.254 7.504 1.00 0.00 H TER 32489 WAT 702 ATOM 32489 O WAT 703 27.900 55.685 9.359 1.00 0.00 O ATOM 32490 H1 WAT 703 28.341 56.141 10.076 1.00 0.00 H ATOM 32491 H2 WAT 703 26.967 55.788 9.548 1.00 0.00 H TER 32493 WAT 703 ATOM 32493 O WAT 704 1.422 26.385 70.415 1.00 0.00 O ATOM 32494 H1 WAT 704 2.367 26.247 70.348 1.00 0.00 H ATOM 32495 H2 WAT 704 1.070 26.020 69.603 1.00 0.00 H TER 32497 WAT 704 ATOM 32497 O WAT 705 113.640 48.848 125.840 1.00 0.00 O ATOM 32498 H1 WAT 705 113.439 48.995 124.915 1.00 0.00 H ATOM 32499 H2 WAT 705 113.708 49.727 126.212 1.00 0.00 H TER 32501 WAT 705 ATOM 32501 O WAT 706 84.166 25.864 78.981 1.00 0.00 O ATOM 32502 H1 WAT 706 84.489 25.228 79.618 1.00 0.00 H ATOM 32503 H2 WAT 706 84.279 26.712 79.410 1.00 0.00 H TER 32505 WAT 706 ATOM 32505 O WAT 707 145.004 50.716 98.566 1.00 0.00 O ATOM 32506 H1 WAT 707 144.140 50.948 98.908 1.00 0.00 H ATOM 32507 H2 WAT 707 145.391 51.552 98.307 1.00 0.00 H TER 32509 WAT 707 ATOM 32509 O WAT 708 103.920 143.222 72.588 1.00 0.00 O ATOM 32510 H1 WAT 708 103.210 143.693 73.025 1.00 0.00 H ATOM 32511 H2 WAT 708 104.189 143.801 71.875 1.00 0.00 H TER 32513 WAT 708 ATOM 32513 O WAT 709 111.939 13.292 118.932 1.00 0.00 O ATOM 32514 H1 WAT 709 112.684 12.714 118.765 1.00 0.00 H ATOM 32515 H2 WAT 709 111.305 13.068 118.251 1.00 0.00 H TER 32517 WAT 709 ATOM 32517 O WAT 710 90.974 4.914 8.021 1.00 0.00 O ATOM 32518 H1 WAT 710 90.660 4.077 8.362 1.00 0.00 H ATOM 32519 H2 WAT 710 91.194 4.733 7.107 1.00 0.00 H TER 32521 WAT 710 ATOM 32521 O WAT 711 13.797 42.458 77.885 1.00 0.00 O ATOM 32522 H1 WAT 711 13.619 41.569 78.191 1.00 0.00 H ATOM 32523 H2 WAT 711 14.136 42.913 78.656 1.00 0.00 H TER 32525 WAT 711 ATOM 32525 O WAT 712 63.641 70.531 2.775 1.00 0.00 O ATOM 32526 H1 WAT 712 62.684 70.551 2.791 1.00 0.00 H ATOM 32527 H2 WAT 712 63.904 71.126 3.478 1.00 0.00 H TER 32529 WAT 712 ATOM 32529 O WAT 713 21.236 55.682 74.751 1.00 0.00 O ATOM 32530 H1 WAT 713 21.335 56.549 74.358 1.00 0.00 H ATOM 32531 H2 WAT 713 21.501 55.074 74.061 1.00 0.00 H TER 32533 WAT 713 ATOM 32533 O WAT 714 69.756 135.303 145.606 1.00 0.00 O ATOM 32534 H1 WAT 714 69.968 134.639 144.950 1.00 0.00 H ATOM 32535 H2 WAT 714 68.894 135.050 145.934 1.00 0.00 H TER 32537 WAT 714 ATOM 32537 O WAT 715 122.012 123.678 80.637 1.00 0.00 O ATOM 32538 H1 WAT 715 121.087 123.907 80.725 1.00 0.00 H ATOM 32539 H2 WAT 715 122.087 122.821 81.057 1.00 0.00 H TER 32541 WAT 715 ATOM 32541 O WAT 716 54.669 12.009 147.898 1.00 0.00 O ATOM 32542 H1 WAT 716 54.801 11.075 148.062 1.00 0.00 H ATOM 32543 H2 WAT 716 54.113 12.040 147.120 1.00 0.00 H TER 32545 WAT 716 ATOM 32545 O WAT 717 79.604 77.367 84.567 1.00 0.00 O ATOM 32546 H1 WAT 717 80.220 78.037 84.269 1.00 0.00 H ATOM 32547 H2 WAT 717 78.829 77.494 84.019 1.00 0.00 H TER 32549 WAT 717 ATOM 32549 O WAT 718 8.335 119.832 95.357 1.00 0.00 O ATOM 32550 H1 WAT 718 8.055 118.952 95.105 1.00 0.00 H ATOM 32551 H2 WAT 718 7.679 120.119 95.992 1.00 0.00 H TER 32553 WAT 718 ATOM 32553 O WAT 719 63.236 5.465 94.674 1.00 0.00 O ATOM 32554 H1 WAT 719 63.098 5.577 93.734 1.00 0.00 H ATOM 32555 H2 WAT 719 62.504 4.918 94.960 1.00 0.00 H TER 32557 WAT 719 ATOM 32557 O WAT 720 12.836 50.892 138.598 1.00 0.00 O ATOM 32558 H1 WAT 720 13.441 51.634 138.638 1.00 0.00 H ATOM 32559 H2 WAT 720 13.404 50.124 138.532 1.00 0.00 H TER 32561 WAT 720 ATOM 32561 O WAT 721 59.449 135.799 89.821 1.00 0.00 O ATOM 32562 H1 WAT 721 59.358 136.399 89.081 1.00 0.00 H ATOM 32563 H2 WAT 721 60.070 135.136 89.518 1.00 0.00 H TER 32565 WAT 721 ATOM 32565 O WAT 722 4.122 50.785 106.216 1.00 0.00 O ATOM 32566 H1 WAT 722 4.658 50.088 106.595 1.00 0.00 H ATOM 32567 H2 WAT 722 4.364 51.568 106.710 1.00 0.00 H TER 32569 WAT 722 ATOM 32569 O WAT 723 45.712 62.523 2.034 1.00 0.00 O ATOM 32570 H1 WAT 723 46.345 62.427 2.746 1.00 0.00 H ATOM 32571 H2 WAT 723 45.178 63.275 2.289 1.00 0.00 H TER 32573 WAT 723 ATOM 32573 O WAT 724 97.069 128.020 67.434 1.00 0.00 O ATOM 32574 H1 WAT 724 97.465 127.387 68.032 1.00 0.00 H ATOM 32575 H2 WAT 724 97.375 128.871 67.749 1.00 0.00 H TER 32577 WAT 724 ATOM 32577 O WAT 725 48.910 62.921 1.301 1.00 0.00 O ATOM 32578 H1 WAT 725 49.134 62.082 1.704 1.00 0.00 H ATOM 32579 H2 WAT 725 49.735 63.408 1.290 1.00 0.00 H TER 32581 WAT 725 ATOM 32581 O WAT 726 38.583 23.490 108.854 1.00 0.00 O ATOM 32582 H1 WAT 726 39.521 23.424 108.677 1.00 0.00 H ATOM 32583 H2 WAT 726 38.299 22.584 108.978 1.00 0.00 H TER 32585 WAT 726 ATOM 32585 O WAT 727 11.635 8.281 144.677 1.00 0.00 O ATOM 32586 H1 WAT 727 12.235 7.942 144.012 1.00 0.00 H ATOM 32587 H2 WAT 727 11.845 7.781 145.465 1.00 0.00 H TER 32589 WAT 727 ATOM 32589 O WAT 728 7.900 59.746 94.408 1.00 0.00 O ATOM 32590 H1 WAT 728 8.076 60.522 94.940 1.00 0.00 H ATOM 32591 H2 WAT 728 8.009 59.012 95.012 1.00 0.00 H TER 32593 WAT 728 ATOM 32593 O WAT 729 51.538 84.463 112.825 1.00 0.00 O ATOM 32594 H1 WAT 729 52.334 84.877 112.490 1.00 0.00 H ATOM 32595 H2 WAT 729 51.696 83.525 112.725 1.00 0.00 H TER 32597 WAT 729 ATOM 32597 O WAT 730 37.754 33.388 135.362 1.00 0.00 O ATOM 32598 H1 WAT 730 38.633 33.326 135.736 1.00 0.00 H ATOM 32599 H2 WAT 730 37.186 33.564 136.112 1.00 0.00 H TER 32601 WAT 730 ATOM 32601 O WAT 731 25.679 88.764 19.882 1.00 0.00 O ATOM 32602 H1 WAT 731 25.672 88.786 18.925 1.00 0.00 H ATOM 32603 H2 WAT 731 25.090 88.044 20.109 1.00 0.00 H TER 32605 WAT 731 ATOM 32605 O WAT 732 65.676 71.655 85.767 1.00 0.00 O ATOM 32606 H1 WAT 732 65.293 72.151 85.043 1.00 0.00 H ATOM 32607 H2 WAT 732 66.469 71.266 85.397 1.00 0.00 H TER 32609 WAT 732 ATOM 32609 O WAT 733 64.311 7.300 2.142 1.00 0.00 O ATOM 32610 H1 WAT 733 63.371 7.164 2.021 1.00 0.00 H ATOM 32611 H2 WAT 733 64.711 6.479 1.854 1.00 0.00 H TER 32613 WAT 733 ATOM 32613 O WAT 734 3.938 81.266 7.529 1.00 0.00 O ATOM 32614 H1 WAT 734 3.640 81.772 6.773 1.00 0.00 H ATOM 32615 H2 WAT 734 3.445 80.448 7.479 1.00 0.00 H TER 32617 WAT 734 ATOM 32617 O WAT 735 137.983 68.493 57.705 1.00 0.00 O ATOM 32618 H1 WAT 735 137.855 68.924 56.860 1.00 0.00 H ATOM 32619 H2 WAT 735 138.673 67.850 57.543 1.00 0.00 H TER 32621 WAT 735 ATOM 32621 O WAT 736 14.403 23.516 78.037 1.00 0.00 O ATOM 32622 H1 WAT 736 15.341 23.368 77.921 1.00 0.00 H ATOM 32623 H2 WAT 736 14.088 22.724 78.474 1.00 0.00 H TER 32625 WAT 736 ATOM 32625 O WAT 737 0.725 20.263 98.018 1.00 0.00 O ATOM 32626 H1 WAT 737 1.616 20.201 98.361 1.00 0.00 H ATOM 32627 H2 WAT 737 0.839 20.423 97.081 1.00 0.00 H TER 32629 WAT 737 ATOM 32629 O WAT 738 44.304 65.551 157.901 1.00 0.00 O ATOM 32630 H1 WAT 738 44.647 65.017 157.185 1.00 0.00 H ATOM 32631 H2 WAT 738 43.888 66.296 157.467 1.00 0.00 H TER 32633 WAT 738 ATOM 32633 O WAT 739 82.429 26.058 150.332 1.00 0.00 O ATOM 32634 H1 WAT 739 83.309 25.816 150.041 1.00 0.00 H ATOM 32635 H2 WAT 739 82.533 26.267 151.260 1.00 0.00 H TER 32637 WAT 739 ATOM 32637 O WAT 740 109.211 105.763 119.236 1.00 0.00 O ATOM 32638 H1 WAT 740 108.685 106.349 119.780 1.00 0.00 H ATOM 32639 H2 WAT 740 110.041 106.226 119.118 1.00 0.00 H TER 32641 WAT 740 ATOM 32641 O WAT 741 113.169 74.140 142.939 1.00 0.00 O ATOM 32642 H1 WAT 741 113.774 74.275 143.669 1.00 0.00 H ATOM 32643 H2 WAT 741 113.490 74.722 142.251 1.00 0.00 H TER 32645 WAT 741 ATOM 32645 O WAT 742 121.892 76.385 133.060 1.00 0.00 O ATOM 32646 H1 WAT 742 121.253 76.912 132.581 1.00 0.00 H ATOM 32647 H2 WAT 742 122.730 76.816 132.895 1.00 0.00 H TER 32649 WAT 742 ATOM 32649 O WAT 743 60.823 57.129 110.509 1.00 0.00 O ATOM 32650 H1 WAT 743 61.620 57.576 110.793 1.00 0.00 H ATOM 32651 H2 WAT 743 60.269 57.827 110.159 1.00 0.00 H TER 32653 WAT 743 ATOM 32653 O WAT 744 110.606 30.216 123.607 1.00 0.00 O ATOM 32654 H1 WAT 744 110.079 29.859 122.891 1.00 0.00 H ATOM 32655 H2 WAT 744 111.392 30.556 123.179 1.00 0.00 H TER 32657 WAT 744 ATOM 32657 O WAT 745 61.657 47.996 83.545 1.00 0.00 O ATOM 32658 H1 WAT 745 61.979 48.214 82.670 1.00 0.00 H ATOM 32659 H2 WAT 745 61.079 47.245 83.407 1.00 0.00 H TER 32661 WAT 745 ATOM 32661 O WAT 746 34.488 28.838 7.619 1.00 0.00 O ATOM 32662 H1 WAT 746 34.291 28.793 8.554 1.00 0.00 H ATOM 32663 H2 WAT 746 34.669 29.764 7.456 1.00 0.00 H TER 32665 WAT 746 ATOM 32665 O WAT 747 114.459 124.552 0.336 1.00 0.00 O ATOM 32666 H1 WAT 747 113.594 124.846 0.051 1.00 0.00 H ATOM 32667 H2 WAT 747 114.282 123.938 1.048 1.00 0.00 H TER 32669 WAT 747 ATOM 32669 O WAT 748 25.783 66.984 150.692 1.00 0.00 O ATOM 32670 H1 WAT 748 25.249 66.466 150.089 1.00 0.00 H ATOM 32671 H2 WAT 748 25.275 67.783 150.835 1.00 0.00 H TER 32673 WAT 748 ATOM 32673 O WAT 749 19.845 70.486 101.279 1.00 0.00 O ATOM 32674 H1 WAT 749 20.676 70.961 101.301 1.00 0.00 H ATOM 32675 H2 WAT 749 19.390 70.764 102.074 1.00 0.00 H TER 32677 WAT 749 ATOM 32677 O WAT 750 51.157 22.708 109.293 1.00 0.00 O ATOM 32678 H1 WAT 750 51.769 23.417 109.488 1.00 0.00 H ATOM 32679 H2 WAT 750 51.491 21.959 109.787 1.00 0.00 H TER 32681 WAT 750 ATOM 32681 O WAT 751 113.545 45.001 -0.167 1.00 0.00 O ATOM 32682 H1 WAT 751 113.359 44.611 0.687 1.00 0.00 H ATOM 32683 H2 WAT 751 113.021 45.801 -0.184 1.00 0.00 H TER 32685 WAT 751 ATOM 32685 O WAT 752 128.838 96.206 63.502 1.00 0.00 O ATOM 32686 H1 WAT 752 129.657 95.944 63.922 1.00 0.00 H ATOM 32687 H2 WAT 752 129.060 97.001 63.018 1.00 0.00 H TER 32689 WAT 752 ATOM 32689 O WAT 753 102.740 80.073 151.467 1.00 0.00 O ATOM 32690 H1 WAT 753 102.065 80.355 150.851 1.00 0.00 H ATOM 32691 H2 WAT 753 103.534 80.002 150.937 1.00 0.00 H TER 32693 WAT 753 ATOM 32693 O WAT 754 46.405 36.976 150.312 1.00 0.00 O ATOM 32694 H1 WAT 754 45.609 36.620 149.917 1.00 0.00 H ATOM 32695 H2 WAT 754 46.092 37.504 151.046 1.00 0.00 H TER 32697 WAT 754 ATOM 32697 O WAT 755 8.349 3.664 156.808 1.00 0.00 O ATOM 32698 H1 WAT 755 7.841 3.647 155.997 1.00 0.00 H ATOM 32699 H2 WAT 755 8.057 2.890 157.289 1.00 0.00 H TER 32701 WAT 755 ATOM 32701 O WAT 756 43.155 21.243 68.993 1.00 0.00 O ATOM 32702 H1 WAT 756 42.436 21.873 69.046 1.00 0.00 H ATOM 32703 H2 WAT 756 43.938 21.755 69.195 1.00 0.00 H TER 32705 WAT 756 ATOM 32705 O WAT 757 20.950 46.603 150.845 1.00 0.00 O ATOM 32706 H1 WAT 757 21.496 45.817 150.852 1.00 0.00 H ATOM 32707 H2 WAT 757 21.127 47.009 149.996 1.00 0.00 H TER 32709 WAT 757 ATOM 32709 O WAT 758 9.059 118.809 59.149 1.00 0.00 O ATOM 32710 H1 WAT 758 8.777 119.445 59.807 1.00 0.00 H ATOM 32711 H2 WAT 758 8.469 118.951 58.409 1.00 0.00 H TER 32713 WAT 758 ATOM 32713 O WAT 759 18.038 6.614 10.567 1.00 0.00 O ATOM 32714 H1 WAT 759 18.181 7.346 11.167 1.00 0.00 H ATOM 32715 H2 WAT 759 18.717 5.980 10.797 1.00 0.00 H TER 32717 WAT 759 ATOM 32717 O WAT 760 12.935 124.554 82.439 1.00 0.00 O ATOM 32718 H1 WAT 760 13.678 125.150 82.538 1.00 0.00 H ATOM 32719 H2 WAT 760 12.400 124.707 83.218 1.00 0.00 H TER 32721 WAT 760 ATOM 32721 O WAT 761 14.639 12.978 127.590 1.00 0.00 O ATOM 32722 H1 WAT 761 14.613 12.970 128.547 1.00 0.00 H ATOM 32723 H2 WAT 761 13.726 13.098 127.327 1.00 0.00 H TER 32725 WAT 761 ATOM 32725 O WAT 762 20.151 67.647 149.926 1.00 0.00 O ATOM 32726 H1 WAT 762 20.000 67.721 150.868 1.00 0.00 H ATOM 32727 H2 WAT 762 20.389 66.729 149.793 1.00 0.00 H TER 32729 WAT 762 ATOM 32729 O WAT 763 136.018 98.725 105.466 1.00 0.00 O ATOM 32730 H1 WAT 763 136.666 99.366 105.762 1.00 0.00 H ATOM 32731 H2 WAT 763 135.283 98.832 106.070 1.00 0.00 H TER 32733 WAT 763 ATOM 32733 O WAT 764 119.150 51.658 3.515 1.00 0.00 O ATOM 32734 H1 WAT 764 119.382 51.750 4.439 1.00 0.00 H ATOM 32735 H2 WAT 764 119.401 52.493 3.120 1.00 0.00 H TER 32737 WAT 764 ATOM 32737 O WAT 765 95.977 70.570 82.414 1.00 0.00 O ATOM 32738 H1 WAT 765 95.618 70.398 83.285 1.00 0.00 H ATOM 32739 H2 WAT 765 96.363 69.736 82.146 1.00 0.00 H TER 32741 WAT 765 ATOM 32741 O WAT 766 124.310 139.351 92.864 1.00 0.00 O ATOM 32742 H1 WAT 766 124.728 140.159 92.564 1.00 0.00 H ATOM 32743 H2 WAT 766 124.450 138.730 92.150 1.00 0.00 H TER 32745 WAT 766 ATOM 32745 O WAT 767 124.313 124.492 109.842 1.00 0.00 O ATOM 32746 H1 WAT 767 123.865 123.674 110.059 1.00 0.00 H ATOM 32747 H2 WAT 767 125.122 124.215 109.412 1.00 0.00 H TER 32749 WAT 767 ATOM 32749 O WAT 768 105.996 73.390 2.929 1.00 0.00 O ATOM 32750 H1 WAT 768 106.191 72.820 2.185 1.00 0.00 H ATOM 32751 H2 WAT 768 106.679 73.190 3.569 1.00 0.00 H TER 32753 WAT 768 ATOM 32753 O WAT 769 33.913 122.856 60.389 1.00 0.00 O ATOM 32754 H1 WAT 769 34.030 123.786 60.579 1.00 0.00 H ATOM 32755 H2 WAT 769 34.581 122.418 60.916 1.00 0.00 H TER 32757 WAT 769 ATOM 32757 O WAT 770 36.498 77.176 155.470 1.00 0.00 O ATOM 32758 H1 WAT 770 35.542 77.203 155.504 1.00 0.00 H ATOM 32759 H2 WAT 770 36.745 77.984 155.019 1.00 0.00 H TER 32761 WAT 770 ATOM 32761 O WAT 771 92.041 129.492 94.264 1.00 0.00 O ATOM 32762 H1 WAT 771 91.302 129.952 93.865 1.00 0.00 H ATOM 32763 H2 WAT 771 92.147 128.703 93.732 1.00 0.00 H TER 32765 WAT 771 ATOM 32765 O WAT 772 116.212 65.692 84.599 1.00 0.00 O ATOM 32766 H1 WAT 772 116.875 66.375 84.491 1.00 0.00 H ATOM 32767 H2 WAT 772 115.493 66.127 85.057 1.00 0.00 H TER 32769 WAT 772 ATOM 32769 O WAT 773 55.490 143.341 55.080 1.00 0.00 O ATOM 32770 H1 WAT 773 54.753 142.796 55.356 1.00 0.00 H ATOM 32771 H2 WAT 773 55.729 143.000 54.218 1.00 0.00 H TER 32773 WAT 773 ATOM 32773 O WAT 774 141.371 77.483 61.896 1.00 0.00 O ATOM 32774 H1 WAT 774 140.694 76.917 61.526 1.00 0.00 H ATOM 32775 H2 WAT 774 141.569 78.107 61.198 1.00 0.00 H TER 32777 WAT 774 ATOM 32777 O WAT 775 57.206 135.077 115.917 1.00 0.00 O ATOM 32778 H1 WAT 775 57.347 134.898 114.988 1.00 0.00 H ATOM 32779 H2 WAT 775 56.482 134.501 116.165 1.00 0.00 H TER 32781 WAT 775 ATOM 32781 O WAT 776 111.894 126.906 13.160 1.00 0.00 O ATOM 32782 H1 WAT 776 112.060 126.141 13.712 1.00 0.00 H ATOM 32783 H2 WAT 776 111.111 126.675 12.661 1.00 0.00 H TER 32785 WAT 776 ATOM 32785 O WAT 777 67.240 10.794 146.762 1.00 0.00 O ATOM 32786 H1 WAT 777 66.871 10.791 147.646 1.00 0.00 H ATOM 32787 H2 WAT 777 67.497 11.704 146.613 1.00 0.00 H TER 32789 WAT 777 ATOM 32789 O WAT 778 122.992 85.711 141.870 1.00 0.00 O ATOM 32790 H1 WAT 778 123.257 86.352 142.528 1.00 0.00 H ATOM 32791 H2 WAT 778 123.749 85.132 141.781 1.00 0.00 H TER 32793 WAT 778 ATOM 32793 O WAT 779 19.633 77.321 89.901 1.00 0.00 O ATOM 32794 H1 WAT 779 18.994 77.857 90.371 1.00 0.00 H ATOM 32795 H2 WAT 779 19.764 77.778 89.070 1.00 0.00 H TER 32797 WAT 779 ATOM 32797 O WAT 780 113.623 133.444 134.293 1.00 0.00 O ATOM 32798 H1 WAT 780 113.694 134.034 133.543 1.00 0.00 H ATOM 32799 H2 WAT 780 113.078 132.723 133.979 1.00 0.00 H TER 32801 WAT 780 ATOM 32801 O WAT 781 10.046 49.873 103.273 1.00 0.00 O ATOM 32802 H1 WAT 781 9.158 49.651 102.994 1.00 0.00 H ATOM 32803 H2 WAT 781 10.612 49.463 102.618 1.00 0.00 H TER 32805 WAT 781 ATOM 32805 O WAT 782 35.224 15.520 95.303 1.00 0.00 O ATOM 32806 H1 WAT 782 34.821 16.387 95.345 1.00 0.00 H ATOM 32807 H2 WAT 782 35.957 15.625 94.697 1.00 0.00 H TER 32809 WAT 782 ATOM 32809 O WAT 783 116.012 119.794 70.935 1.00 0.00 O ATOM 32810 H1 WAT 783 115.803 119.020 71.458 1.00 0.00 H ATOM 32811 H2 WAT 783 116.960 119.748 70.808 1.00 0.00 H TER 32813 WAT 783 ATOM 32813 O WAT 784 95.538 70.708 9.667 1.00 0.00 O ATOM 32814 H1 WAT 784 96.409 71.035 9.444 1.00 0.00 H ATOM 32815 H2 WAT 784 95.703 69.939 10.212 1.00 0.00 H TER 32817 WAT 784 ATOM 32817 O WAT 785 126.430 73.306 154.297 1.00 0.00 O ATOM 32818 H1 WAT 785 127.291 72.898 154.381 1.00 0.00 H ATOM 32819 H2 WAT 785 126.531 74.166 154.705 1.00 0.00 H TER 32821 WAT 785 ATOM 32821 O WAT 786 125.682 9.144 120.234 1.00 0.00 O ATOM 32822 H1 WAT 786 125.840 8.545 119.505 1.00 0.00 H ATOM 32823 H2 WAT 786 126.025 8.685 121.001 1.00 0.00 H TER 32825 WAT 786 ATOM 32825 O WAT 787 0.817 85.098 150.215 1.00 0.00 O ATOM 32826 H1 WAT 787 0.785 84.171 150.451 1.00 0.00 H ATOM 32827 H2 WAT 787 1.018 85.101 149.279 1.00 0.00 H TER 32829 WAT 787 ATOM 32829 O WAT 788 103.538 41.815 65.050 1.00 0.00 O ATOM 32830 H1 WAT 788 103.449 42.605 64.518 1.00 0.00 H ATOM 32831 H2 WAT 788 103.163 41.119 64.511 1.00 0.00 H TER 32833 WAT 788 ATOM 32833 O WAT 789 129.142 46.766 119.084 1.00 0.00 O ATOM 32834 H1 WAT 789 129.606 47.189 119.807 1.00 0.00 H ATOM 32835 H2 WAT 789 129.059 45.852 119.355 1.00 0.00 H TER 32837 WAT 789 ATOM 32837 O WAT 790 5.982 60.497 9.800 1.00 0.00 O ATOM 32838 H1 WAT 790 6.107 59.775 10.416 1.00 0.00 H ATOM 32839 H2 WAT 790 6.514 61.209 10.155 1.00 0.00 H TER 32841 WAT 790 ATOM 32841 O WAT 791 111.394 4.782 14.465 1.00 0.00 O ATOM 32842 H1 WAT 791 112.002 4.223 14.949 1.00 0.00 H ATOM 32843 H2 WAT 791 110.979 4.194 13.834 1.00 0.00 H TER 32845 WAT 791 ATOM 32845 O WAT 792 0.398 35.061 126.000 1.00 0.00 O ATOM 32846 H1 WAT 792 0.234 34.958 125.063 1.00 0.00 H ATOM 32847 H2 WAT 792 -0.458 34.930 126.408 1.00 0.00 H TER 32849 WAT 792 ATOM 32849 O WAT 793 97.912 142.385 62.303 1.00 0.00 O ATOM 32850 H1 WAT 793 97.949 143.299 62.021 1.00 0.00 H ATOM 32851 H2 WAT 793 98.290 142.391 63.183 1.00 0.00 H TER 32853 WAT 793 ATOM 32853 O WAT 794 9.287 17.425 94.274 1.00 0.00 O ATOM 32854 H1 WAT 794 8.787 17.131 93.513 1.00 0.00 H ATOM 32855 H2 WAT 794 9.381 16.642 94.817 1.00 0.00 H TER 32857 WAT 794 ATOM 32857 O WAT 795 138.136 4.988 132.621 1.00 0.00 O ATOM 32858 H1 WAT 795 137.431 5.282 132.044 1.00 0.00 H ATOM 32859 H2 WAT 795 137.861 4.118 132.910 1.00 0.00 H TER 32861 WAT 795 ATOM 32861 O WAT 796 2.985 82.547 5.364 1.00 0.00 O ATOM 32862 H1 WAT 796 3.585 83.026 4.793 1.00 0.00 H ATOM 32863 H2 WAT 796 2.209 82.398 4.824 1.00 0.00 H TER 32865 WAT 796 ATOM 32865 O WAT 797 120.627 99.153 69.121 1.00 0.00 O ATOM 32866 H1 WAT 797 119.875 99.744 69.132 1.00 0.00 H ATOM 32867 H2 WAT 797 120.880 99.104 68.200 1.00 0.00 H TER 32869 WAT 797 ATOM 32869 O WAT 798 47.014 142.408 104.649 1.00 0.00 O ATOM 32870 H1 WAT 798 47.874 141.998 104.557 1.00 0.00 H ATOM 32871 H2 WAT 798 47.048 142.847 105.499 1.00 0.00 H TER 32873 WAT 798 ATOM 32873 O WAT 799 114.955 20.983 146.686 1.00 0.00 O ATOM 32874 H1 WAT 799 115.127 21.338 147.559 1.00 0.00 H ATOM 32875 H2 WAT 799 114.750 21.750 146.152 1.00 0.00 H TER 32877 WAT 799 ATOM 32877 O WAT 800 125.988 135.877 109.746 1.00 0.00 O ATOM 32878 H1 WAT 800 125.983 136.155 108.830 1.00 0.00 H ATOM 32879 H2 WAT 800 125.784 136.671 110.240 1.00 0.00 H TER 32881 WAT 800 ATOM 32881 O WAT 801 97.606 111.587 149.379 1.00 0.00 O ATOM 32882 H1 WAT 801 97.821 110.987 148.665 1.00 0.00 H ATOM 32883 H2 WAT 801 98.329 112.213 149.393 1.00 0.00 H TER 32885 WAT 801 ATOM 32885 O WAT 802 125.836 124.743 112.437 1.00 0.00 O ATOM 32886 H1 WAT 802 126.671 124.322 112.641 1.00 0.00 H ATOM 32887 H2 WAT 802 125.429 124.168 111.790 1.00 0.00 H TER 32889 WAT 802 ATOM 32889 O WAT 803 58.928 139.817 4.121 1.00 0.00 O ATOM 32890 H1 WAT 803 58.587 140.106 4.966 1.00 0.00 H ATOM 32891 H2 WAT 803 59.471 139.056 4.329 1.00 0.00 H TER 32893 WAT 803 ATOM 32893 O WAT 804 21.991 30.946 146.541 1.00 0.00 O ATOM 32894 H1 WAT 804 22.929 30.976 146.349 1.00 0.00 H ATOM 32895 H2 WAT 804 21.604 30.517 145.778 1.00 0.00 H TER 32897 WAT 804 ATOM 32897 O WAT 805 60.136 104.154 119.736 1.00 0.00 O ATOM 32898 H1 WAT 805 59.452 104.589 120.244 1.00 0.00 H ATOM 32899 H2 WAT 805 60.644 103.667 120.386 1.00 0.00 H TER 32901 WAT 805 ATOM 32901 O WAT 806 13.746 88.341 85.753 1.00 0.00 O ATOM 32902 H1 WAT 806 12.887 88.026 86.034 1.00 0.00 H ATOM 32903 H2 WAT 806 13.569 89.193 85.354 1.00 0.00 H TER 32905 WAT 806 ATOM 32905 O WAT 807 118.123 124.544 26.235 1.00 0.00 O ATOM 32906 H1 WAT 807 118.172 123.626 25.969 1.00 0.00 H ATOM 32907 H2 WAT 807 118.881 124.955 25.820 1.00 0.00 H TER 32909 WAT 807 ATOM 32909 O WAT 808 104.813 96.769 156.352 1.00 0.00 O ATOM 32910 H1 WAT 808 104.607 97.690 156.189 1.00 0.00 H ATOM 32911 H2 WAT 808 104.963 96.400 155.482 1.00 0.00 H TER 32913 WAT 808 ATOM 32913 O WAT 809 118.347 25.578 93.762 1.00 0.00 O ATOM 32914 H1 WAT 809 118.948 24.957 94.175 1.00 0.00 H ATOM 32915 H2 WAT 809 118.737 26.436 93.931 1.00 0.00 H TER 32917 WAT 809 ATOM 32917 O WAT 810 41.949 44.361 131.870 1.00 0.00 O ATOM 32918 H1 WAT 810 42.737 43.994 131.469 1.00 0.00 H ATOM 32919 H2 WAT 810 42.190 44.504 132.785 1.00 0.00 H TER 32921 WAT 810 ATOM 32921 O WAT 811 122.979 102.057 141.058 1.00 0.00 O ATOM 32922 H1 WAT 811 123.171 102.307 140.154 1.00 0.00 H ATOM 32923 H2 WAT 811 123.702 102.424 141.566 1.00 0.00 H TER 32925 WAT 811 ATOM 32925 O WAT 812 132.346 131.890 114.434 1.00 0.00 O ATOM 32926 H1 WAT 812 131.842 132.684 114.612 1.00 0.00 H ATOM 32927 H2 WAT 812 133.101 132.194 113.929 1.00 0.00 H TER 32929 WAT 812 ATOM 32929 O WAT 813 141.787 131.273 19.392 1.00 0.00 O ATOM 32930 H1 WAT 813 140.906 131.016 19.118 1.00 0.00 H ATOM 32931 H2 WAT 813 141.872 130.926 20.280 1.00 0.00 H TER 32933 WAT 813 ATOM 32933 O WAT 814 123.397 2.968 133.587 1.00 0.00 O ATOM 32934 H1 WAT 814 123.332 2.013 133.559 1.00 0.00 H ATOM 32935 H2 WAT 814 124.054 3.182 132.924 1.00 0.00 H TER 32937 WAT 814 ATOM 32937 O WAT 815 21.794 94.868 104.089 1.00 0.00 O ATOM 32938 H1 WAT 815 21.070 94.250 104.189 1.00 0.00 H ATOM 32939 H2 WAT 815 21.492 95.663 104.528 1.00 0.00 H TER 32941 WAT 815 ATOM 32941 O WAT 816 38.782 20.865 130.942 1.00 0.00 O ATOM 32942 H1 WAT 816 38.986 21.618 130.386 1.00 0.00 H ATOM 32943 H2 WAT 816 39.379 20.948 131.685 1.00 0.00 H TER 32945 WAT 816 ATOM 32945 O WAT 817 23.888 134.237 78.850 1.00 0.00 O ATOM 32946 H1 WAT 817 24.105 135.105 79.189 1.00 0.00 H ATOM 32947 H2 WAT 817 24.095 134.285 77.916 1.00 0.00 H TER 32949 WAT 817 ATOM 32949 O WAT 818 35.150 97.333 109.680 1.00 0.00 O ATOM 32950 H1 WAT 818 35.925 97.124 109.159 1.00 0.00 H ATOM 32951 H2 WAT 818 35.464 97.336 110.585 1.00 0.00 H TER 32953 WAT 818 ATOM 32953 O WAT 819 75.328 52.349 120.520 1.00 0.00 O ATOM 32954 H1 WAT 819 76.253 52.507 120.707 1.00 0.00 H ATOM 32955 H2 WAT 819 74.902 53.189 120.694 1.00 0.00 H TER 32957 WAT 819 ATOM 32957 O WAT 820 42.713 97.055 114.556 1.00 0.00 O ATOM 32958 H1 WAT 820 42.664 96.167 114.202 1.00 0.00 H ATOM 32959 H2 WAT 820 42.080 97.554 114.040 1.00 0.00 H TER 32961 WAT 820 ATOM 32961 O WAT 821 125.229 94.423 -0.180 1.00 0.00 O ATOM 32962 H1 WAT 821 126.032 94.445 0.341 1.00 0.00 H ATOM 32963 H2 WAT 821 124.529 94.312 0.463 1.00 0.00 H TER 32965 WAT 821 ATOM 32965 O WAT 822 66.122 83.620 68.998 1.00 0.00 O ATOM 32966 H1 WAT 822 66.961 83.247 69.268 1.00 0.00 H ATOM 32967 H2 WAT 822 66.286 83.973 68.124 1.00 0.00 H TER 32969 WAT 822 ATOM 32969 O WAT 823 125.594 129.187 63.079 1.00 0.00 O ATOM 32970 H1 WAT 823 125.577 129.240 62.123 1.00 0.00 H ATOM 32971 H2 WAT 823 125.014 128.454 63.288 1.00 0.00 H TER 32973 WAT 823 ATOM 32973 O WAT 824 24.625 86.860 2.271 1.00 0.00 O ATOM 32974 H1 WAT 824 24.472 87.298 3.108 1.00 0.00 H ATOM 32975 H2 WAT 824 25.458 87.218 1.962 1.00 0.00 H TER 32977 WAT 824 ATOM 32977 O WAT 825 105.368 94.373 126.395 1.00 0.00 O ATOM 32978 H1 WAT 825 104.592 93.816 126.462 1.00 0.00 H ATOM 32979 H2 WAT 825 105.803 94.279 127.242 1.00 0.00 H TER 32981 WAT 825 ATOM 32981 O WAT 826 63.479 114.692 59.080 1.00 0.00 O ATOM 32982 H1 WAT 826 62.547 114.662 58.864 1.00 0.00 H ATOM 32983 H2 WAT 826 63.614 115.568 59.440 1.00 0.00 H TER 32985 WAT 826 ATOM 32985 O WAT 827 57.726 6.355 116.340 1.00 0.00 O ATOM 32986 H1 WAT 827 58.374 6.455 117.038 1.00 0.00 H ATOM 32987 H2 WAT 827 57.055 5.786 116.717 1.00 0.00 H TER 32989 WAT 827 ATOM 32989 O WAT 828 132.306 114.249 97.050 1.00 0.00 O ATOM 32990 H1 WAT 828 132.189 114.526 97.959 1.00 0.00 H ATOM 32991 H2 WAT 828 131.636 113.579 96.915 1.00 0.00 H TER 32993 WAT 828 ATOM 32993 O WAT 829 105.119 2.957 1.043 1.00 0.00 O ATOM 32994 H1 WAT 829 104.720 2.099 0.902 1.00 0.00 H ATOM 32995 H2 WAT 829 104.405 3.503 1.371 1.00 0.00 H TER 32997 WAT 829 ATOM 32997 O WAT 830 18.046 49.011 134.609 1.00 0.00 O ATOM 32998 H1 WAT 830 18.730 48.563 135.108 1.00 0.00 H ATOM 32999 H2 WAT 830 17.489 48.306 134.281 1.00 0.00 H TER 33001 WAT 830 ATOM 33001 O WAT 831 69.256 140.351 105.823 1.00 0.00 O ATOM 33002 H1 WAT 831 69.318 139.405 105.958 1.00 0.00 H ATOM 33003 H2 WAT 831 70.160 140.660 105.875 1.00 0.00 H TER 33005 WAT 831 ATOM 33005 O WAT 832 40.956 15.687 22.381 1.00 0.00 O ATOM 33006 H1 WAT 832 41.535 16.324 22.799 1.00 0.00 H ATOM 33007 H2 WAT 832 40.227 16.208 22.047 1.00 0.00 H TER 33009 WAT 832 ATOM 33009 O WAT 833 88.961 49.960 81.884 1.00 0.00 O ATOM 33010 H1 WAT 833 88.211 50.536 82.031 1.00 0.00 H ATOM 33011 H2 WAT 833 88.599 49.212 81.409 1.00 0.00 H TER 33013 WAT 833 ATOM 33013 O WAT 834 83.008 44.198 155.613 1.00 0.00 O ATOM 33014 H1 WAT 834 83.091 43.423 156.168 1.00 0.00 H ATOM 33015 H2 WAT 834 83.689 44.090 154.948 1.00 0.00 H TER 33017 WAT 834 ATOM 33017 O WAT 835 34.021 88.926 133.691 1.00 0.00 O ATOM 33018 H1 WAT 835 34.253 88.334 134.406 1.00 0.00 H ATOM 33019 H2 WAT 835 34.823 89.003 133.175 1.00 0.00 H TER 33021 WAT 835 ATOM 33021 O WAT 836 17.412 59.506 19.772 1.00 0.00 O ATOM 33022 H1 WAT 836 17.534 58.768 19.175 1.00 0.00 H ATOM 33023 H2 WAT 836 16.572 59.335 20.198 1.00 0.00 H TER 33025 WAT 836 ATOM 33025 O WAT 837 74.172 34.976 144.156 1.00 0.00 O ATOM 33026 H1 WAT 837 73.618 35.446 144.779 1.00 0.00 H ATOM 33027 H2 WAT 837 73.650 34.217 143.896 1.00 0.00 H TER 33029 WAT 837 ATOM 33029 O WAT 838 90.658 69.181 99.390 1.00 0.00 O ATOM 33030 H1 WAT 838 89.923 69.784 99.500 1.00 0.00 H ATOM 33031 H2 WAT 838 91.234 69.367 100.132 1.00 0.00 H TER 33033 WAT 838 ATOM 33033 O WAT 839 142.493 89.575 101.878 1.00 0.00 O ATOM 33034 H1 WAT 839 141.859 89.071 102.388 1.00 0.00 H ATOM 33035 H2 WAT 839 143.324 89.120 102.010 1.00 0.00 H TER 33037 WAT 839 ATOM 33037 O WAT 840 5.164 42.191 151.826 1.00 0.00 O ATOM 33038 H1 WAT 840 5.742 42.101 152.584 1.00 0.00 H ATOM 33039 H2 WAT 840 4.881 43.105 151.847 1.00 0.00 H TER 33041 WAT 840 ATOM 33041 O WAT 841 138.771 94.297 100.314 1.00 0.00 O ATOM 33042 H1 WAT 841 139.309 95.087 100.360 1.00 0.00 H ATOM 33043 H2 WAT 841 138.745 94.078 99.383 1.00 0.00 H TER 33045 WAT 841 ATOM 33045 O WAT 842 20.755 28.387 72.081 1.00 0.00 O ATOM 33046 H1 WAT 842 21.487 27.779 72.181 1.00 0.00 H ATOM 33047 H2 WAT 842 20.873 28.763 71.208 1.00 0.00 H TER 33049 WAT 842 ATOM 33049 O WAT 843 15.542 115.639 68.877 1.00 0.00 O ATOM 33050 H1 WAT 843 15.054 115.270 68.142 1.00 0.00 H ATOM 33051 H2 WAT 843 14.910 116.199 69.328 1.00 0.00 H TER 33053 WAT 843 ATOM 33053 O WAT 844 8.272 132.054 150.524 1.00 0.00 O ATOM 33054 H1 WAT 844 7.445 131.895 150.978 1.00 0.00 H ATOM 33055 H2 WAT 844 8.823 131.309 150.761 1.00 0.00 H TER 33057 WAT 844 ATOM 33057 O WAT 845 34.449 86.569 0.184 1.00 0.00 O ATOM 33058 H1 WAT 845 34.664 86.678 1.110 1.00 0.00 H ATOM 33059 H2 WAT 845 35.140 87.040 -0.281 1.00 0.00 H TER 33061 WAT 845 ATOM 33061 O WAT 846 122.696 140.783 130.352 1.00 0.00 O ATOM 33062 H1 WAT 846 122.957 140.767 129.431 1.00 0.00 H ATOM 33063 H2 WAT 846 123.049 141.607 130.686 1.00 0.00 H TER 33065 WAT 846 ATOM 33065 O WAT 847 25.385 134.095 156.022 1.00 0.00 O ATOM 33066 H1 WAT 847 25.122 134.141 155.102 1.00 0.00 H ATOM 33067 H2 WAT 847 24.663 134.505 156.498 1.00 0.00 H TER 33069 WAT 847 ATOM 33069 O WAT 848 46.088 91.095 10.508 1.00 0.00 O ATOM 33070 H1 WAT 848 45.665 90.635 9.784 1.00 0.00 H ATOM 33071 H2 WAT 848 46.962 91.307 10.180 1.00 0.00 H TER 33073 WAT 848 ATOM 33073 O WAT 849 60.931 107.721 114.316 1.00 0.00 O ATOM 33074 H1 WAT 849 60.298 107.703 115.033 1.00 0.00 H ATOM 33075 H2 WAT 849 60.430 108.032 113.562 1.00 0.00 H TER 33077 WAT 849 ATOM 33077 O WAT 850 57.758 28.419 93.624 1.00 0.00 O ATOM 33078 H1 WAT 850 57.986 29.349 93.611 1.00 0.00 H ATOM 33079 H2 WAT 850 57.502 28.222 92.723 1.00 0.00 H TER 33081 WAT 850 ATOM 33081 O WAT 851 51.837 127.653 82.253 1.00 0.00 O ATOM 33082 H1 WAT 851 51.448 128.513 82.415 1.00 0.00 H ATOM 33083 H2 WAT 851 51.940 127.612 81.303 1.00 0.00 H TER 33085 WAT 851 ATOM 33085 O WAT 852 115.967 22.190 112.935 1.00 0.00 O ATOM 33086 H1 WAT 852 116.503 22.670 112.305 1.00 0.00 H ATOM 33087 H2 WAT 852 116.199 22.568 113.784 1.00 0.00 H TER 33089 WAT 852 ATOM 33089 O WAT 853 105.929 142.120 83.391 1.00 0.00 O ATOM 33090 H1 WAT 853 105.138 142.218 82.862 1.00 0.00 H ATOM 33091 H2 WAT 853 106.282 143.007 83.460 1.00 0.00 H TER 33093 WAT 853 ATOM 33093 O WAT 854 1.242 103.406 14.155 1.00 0.00 O ATOM 33094 H1 WAT 854 0.369 103.217 13.810 1.00 0.00 H ATOM 33095 H2 WAT 854 1.103 104.110 14.788 1.00 0.00 H TER 33097 WAT 854 ATOM 33097 O WAT 855 28.492 21.616 5.518 1.00 0.00 O ATOM 33098 H1 WAT 855 28.731 20.705 5.691 1.00 0.00 H ATOM 33099 H2 WAT 855 29.309 22.028 5.237 1.00 0.00 H TER 33101 WAT 855 ATOM 33101 O WAT 856 76.207 89.380 157.116 1.00 0.00 O ATOM 33102 H1 WAT 856 76.399 89.189 158.034 1.00 0.00 H ATOM 33103 H2 WAT 856 77.013 89.771 156.780 1.00 0.00 H TER 33105 WAT 856 ATOM 33105 O WAT 857 127.342 94.353 27.205 1.00 0.00 O ATOM 33106 H1 WAT 857 127.740 93.712 27.794 1.00 0.00 H ATOM 33107 H2 WAT 857 126.435 94.421 27.503 1.00 0.00 H TER 33109 WAT 857 ATOM 33109 O WAT 858 20.113 15.037 133.031 1.00 0.00 O ATOM 33110 H1 WAT 858 20.688 14.277 132.942 1.00 0.00 H ATOM 33111 H2 WAT 858 20.096 15.216 133.971 1.00 0.00 H TER 33113 WAT 858 ATOM 33113 O WAT 859 24.659 62.544 62.027 1.00 0.00 O ATOM 33114 H1 WAT 859 24.956 63.371 61.647 1.00 0.00 H ATOM 33115 H2 WAT 859 23.816 62.376 61.605 1.00 0.00 H TER 33117 WAT 859 ATOM 33117 O WAT 860 86.178 56.088 125.232 1.00 0.00 O ATOM 33118 H1 WAT 860 85.705 56.883 124.984 1.00 0.00 H ATOM 33119 H2 WAT 860 85.613 55.373 124.940 1.00 0.00 H TER 33121 WAT 860 ATOM 33121 O WAT 861 90.849 123.746 84.947 1.00 0.00 O ATOM 33122 H1 WAT 861 90.983 122.822 85.160 1.00 0.00 H ATOM 33123 H2 WAT 861 89.904 123.827 84.817 1.00 0.00 H TER 33125 WAT 861 ATOM 33125 O WAT 862 27.402 89.546 108.276 1.00 0.00 O ATOM 33126 H1 WAT 862 27.307 88.848 108.923 1.00 0.00 H ATOM 33127 H2 WAT 862 27.861 89.134 107.544 1.00 0.00 H TER 33129 WAT 862 ATOM 33129 O WAT 863 20.742 41.424 156.330 1.00 0.00 O ATOM 33130 H1 WAT 863 20.835 40.704 155.707 1.00 0.00 H ATOM 33131 H2 WAT 863 20.116 42.019 155.917 1.00 0.00 H TER 33133 WAT 863 ATOM 33133 O WAT 864 26.033 3.676 93.491 1.00 0.00 O ATOM 33134 H1 WAT 864 25.191 4.114 93.618 1.00 0.00 H ATOM 33135 H2 WAT 864 26.196 3.226 94.321 1.00 0.00 H TER 33137 WAT 864 ATOM 33137 O WAT 865 0.665 27.079 103.813 1.00 0.00 O ATOM 33138 H1 WAT 865 1.001 26.693 103.004 1.00 0.00 H ATOM 33139 H2 WAT 865 0.696 28.023 103.659 1.00 0.00 H TER 33141 WAT 865 ATOM 33141 O WAT 866 105.180 0.477 15.585 1.00 0.00 O ATOM 33142 H1 WAT 866 105.547 0.787 16.413 1.00 0.00 H ATOM 33143 H2 WAT 866 105.119 1.262 15.042 1.00 0.00 H TER 33145 WAT 866 ATOM 33145 O WAT 867 77.122 24.149 157.170 1.00 0.00 O ATOM 33146 H1 WAT 867 76.211 24.428 157.262 1.00 0.00 H ATOM 33147 H2 WAT 867 77.105 23.502 156.466 1.00 0.00 H TER 33149 WAT 867 ATOM 33149 O WAT 868 101.010 65.843 119.077 1.00 0.00 O ATOM 33150 H1 WAT 868 101.785 65.281 119.081 1.00 0.00 H ATOM 33151 H2 WAT 868 100.292 65.259 118.833 1.00 0.00 H TER 33153 WAT 868 ATOM 33153 O WAT 869 12.036 57.477 59.927 1.00 0.00 O ATOM 33154 H1 WAT 869 11.291 56.891 59.795 1.00 0.00 H ATOM 33155 H2 WAT 869 12.685 56.940 60.383 1.00 0.00 H TER 33157 WAT 869 ATOM 33157 O WAT 870 77.951 43.883 133.711 1.00 0.00 O ATOM 33158 H1 WAT 870 77.939 44.151 132.792 1.00 0.00 H ATOM 33159 H2 WAT 870 78.415 44.590 134.160 1.00 0.00 H TER 33161 WAT 870 ATOM 33161 O WAT 871 52.537 80.691 154.457 1.00 0.00 O ATOM 33162 H1 WAT 871 52.871 80.651 153.561 1.00 0.00 H ATOM 33163 H2 WAT 871 51.725 80.185 154.433 1.00 0.00 H TER 33165 WAT 871 ATOM 33165 O WAT 872 99.512 37.528 110.812 1.00 0.00 O ATOM 33166 H1 WAT 872 99.929 37.162 111.592 1.00 0.00 H ATOM 33167 H2 WAT 872 98.645 37.805 111.111 1.00 0.00 H TER 33169 WAT 872 ATOM 33169 O WAT 873 85.458 81.592 103.923 1.00 0.00 O ATOM 33170 H1 WAT 873 85.078 81.654 103.047 1.00 0.00 H ATOM 33171 H2 WAT 873 85.310 82.455 104.310 1.00 0.00 H TER 33173 WAT 873 ATOM 33173 O WAT 874 9.930 102.625 112.596 1.00 0.00 O ATOM 33174 H1 WAT 874 10.010 102.519 113.544 1.00 0.00 H ATOM 33175 H2 WAT 874 9.968 101.733 112.251 1.00 0.00 H TER 33177 WAT 874 ATOM 33177 O WAT 875 92.727 63.773 92.976 1.00 0.00 O ATOM 33178 H1 WAT 875 92.375 64.385 93.622 1.00 0.00 H ATOM 33179 H2 WAT 875 93.432 64.257 92.546 1.00 0.00 H TER 33181 WAT 875 ATOM 33181 O WAT 876 121.444 99.075 71.965 1.00 0.00 O ATOM 33182 H1 WAT 876 121.843 99.872 72.313 1.00 0.00 H ATOM 33183 H2 WAT 876 121.170 99.311 71.079 1.00 0.00 H TER 33185 WAT 876 ATOM 33185 O WAT 877 111.829 17.808 69.084 1.00 0.00 O ATOM 33186 H1 WAT 877 111.648 18.617 69.563 1.00 0.00 H ATOM 33187 H2 WAT 877 111.543 17.111 69.676 1.00 0.00 H TER 33189 WAT 877 ATOM 33189 O WAT 878 23.891 28.459 139.844 1.00 0.00 O ATOM 33190 H1 WAT 878 23.601 27.754 139.265 1.00 0.00 H ATOM 33191 H2 WAT 878 24.777 28.205 140.105 1.00 0.00 H TER 33193 WAT 878 ATOM 33193 O WAT 879 55.384 103.845 156.530 1.00 0.00 O ATOM 33194 H1 WAT 879 55.338 104.633 157.071 1.00 0.00 H ATOM 33195 H2 WAT 879 54.822 103.213 156.978 1.00 0.00 H TER 33197 WAT 879 ATOM 33197 O WAT 880 85.927 45.686 114.463 1.00 0.00 O ATOM 33198 H1 WAT 880 85.122 45.858 113.974 1.00 0.00 H ATOM 33199 H2 WAT 880 85.826 44.791 114.784 1.00 0.00 H TER 33201 WAT 880 ATOM 33201 O WAT 881 104.181 71.704 70.528 1.00 0.00 O ATOM 33202 H1 WAT 881 104.349 72.587 70.857 1.00 0.00 H ATOM 33203 H2 WAT 881 103.644 71.838 69.747 1.00 0.00 H TER 33205 WAT 881 ATOM 33205 O WAT 882 28.592 26.938 84.291 1.00 0.00 O ATOM 33206 H1 WAT 882 27.840 27.306 83.826 1.00 0.00 H ATOM 33207 H2 WAT 882 28.249 26.152 84.717 1.00 0.00 H TER 33209 WAT 882 ATOM 33209 O WAT 883 0.175 17.247 85.129 1.00 0.00 O ATOM 33210 H1 WAT 883 -0.519 16.598 85.251 1.00 0.00 H ATOM 33211 H2 WAT 883 0.298 17.631 85.997 1.00 0.00 H TER 33213 WAT 883 ATOM 33213 O WAT 884 108.524 33.969 93.812 1.00 0.00 O ATOM 33214 H1 WAT 884 107.613 33.715 93.963 1.00 0.00 H ATOM 33215 H2 WAT 884 109.038 33.272 94.220 1.00 0.00 H TER 33217 WAT 884 ATOM 33217 O WAT 885 76.669 85.478 62.996 1.00 0.00 O ATOM 33218 H1 WAT 885 76.181 84.662 62.887 1.00 0.00 H ATOM 33219 H2 WAT 885 77.498 85.325 62.542 1.00 0.00 H TER 33221 WAT 885 ATOM 33221 O WAT 886 3.166 39.663 113.227 1.00 0.00 O ATOM 33222 H1 WAT 886 4.020 39.913 113.580 1.00 0.00 H ATOM 33223 H2 WAT 886 2.699 39.287 113.974 1.00 0.00 H TER 33225 WAT 886 ATOM 33225 O WAT 887 57.462 20.283 115.893 1.00 0.00 O ATOM 33226 H1 WAT 887 58.050 20.785 115.328 1.00 0.00 H ATOM 33227 H2 WAT 887 57.932 20.210 116.723 1.00 0.00 H TER 33229 WAT 887 ATOM 33229 O WAT 888 12.674 95.886 121.437 1.00 0.00 O ATOM 33230 H1 WAT 888 12.862 96.820 121.347 1.00 0.00 H ATOM 33231 H2 WAT 888 13.031 95.492 120.641 1.00 0.00 H TER 33233 WAT 888 ATOM 33233 O WAT 889 9.354 94.381 79.078 1.00 0.00 O ATOM 33234 H1 WAT 889 9.056 94.819 79.875 1.00 0.00 H ATOM 33235 H2 WAT 889 9.609 95.095 78.494 1.00 0.00 H TER 33237 WAT 889 ATOM 33237 O WAT 890 44.913 97.017 128.315 1.00 0.00 O ATOM 33238 H1 WAT 890 45.523 96.506 128.847 1.00 0.00 H ATOM 33239 H2 WAT 890 44.661 96.425 127.606 1.00 0.00 H TER 33241 WAT 890 ATOM 33241 O WAT 891 57.267 7.117 81.766 1.00 0.00 O ATOM 33242 H1 WAT 891 56.746 6.819 81.021 1.00 0.00 H ATOM 33243 H2 WAT 891 57.570 7.989 81.512 1.00 0.00 H TER 33245 WAT 891 ATOM 33245 O WAT 892 26.498 53.933 90.756 1.00 0.00 O ATOM 33246 H1 WAT 892 26.393 54.882 90.823 1.00 0.00 H ATOM 33247 H2 WAT 892 25.646 53.580 91.012 1.00 0.00 H TER 33249 WAT 892 ATOM 33249 O WAT 893 36.223 56.799 112.031 1.00 0.00 O ATOM 33250 H1 WAT 893 36.549 57.019 111.158 1.00 0.00 H ATOM 33251 H2 WAT 893 35.312 57.091 112.027 1.00 0.00 H TER 33253 WAT 893 ATOM 33253 O WAT 894 67.360 9.559 85.061 1.00 0.00 O ATOM 33254 H1 WAT 894 67.971 9.752 85.772 1.00 0.00 H ATOM 33255 H2 WAT 894 66.886 10.379 84.921 1.00 0.00 H TER 33257 WAT 894 ATOM 33257 O WAT 895 135.152 104.366 122.606 1.00 0.00 O ATOM 33258 H1 WAT 895 134.865 103.765 123.294 1.00 0.00 H ATOM 33259 H2 WAT 895 134.344 104.624 122.161 1.00 0.00 H TER 33261 WAT 895 ATOM 33261 O WAT 896 33.819 86.848 146.654 1.00 0.00 O ATOM 33262 H1 WAT 896 34.774 86.916 146.674 1.00 0.00 H ATOM 33263 H2 WAT 896 33.513 87.751 146.737 1.00 0.00 H TER 33265 WAT 896 ATOM 33265 O WAT 897 24.999 48.535 117.909 1.00 0.00 O ATOM 33266 H1 WAT 897 25.342 47.665 117.706 1.00 0.00 H ATOM 33267 H2 WAT 897 24.456 48.403 118.686 1.00 0.00 H TER 33269 WAT 897 ATOM 33269 O WAT 898 132.508 112.966 114.366 1.00 0.00 O ATOM 33270 H1 WAT 898 133.160 112.469 113.872 1.00 0.00 H ATOM 33271 H2 WAT 898 132.393 113.774 113.865 1.00 0.00 H TER 33273 WAT 898 ATOM 33273 O WAT 899 127.464 39.565 103.407 1.00 0.00 O ATOM 33274 H1 WAT 899 128.391 39.470 103.185 1.00 0.00 H ATOM 33275 H2 WAT 899 127.213 40.409 103.032 1.00 0.00 H TER 33277 WAT 899 ATOM 33277 O WAT 900 107.205 108.612 25.860 1.00 0.00 O ATOM 33278 H1 WAT 900 107.751 107.964 25.415 1.00 0.00 H ATOM 33279 H2 WAT 900 107.768 109.381 25.946 1.00 0.00 H TER 33281 WAT 900 ATOM 33281 O WAT 901 29.743 136.164 153.883 1.00 0.00 O ATOM 33282 H1 WAT 901 30.300 136.925 154.052 1.00 0.00 H ATOM 33283 H2 WAT 901 30.356 135.464 153.660 1.00 0.00 H TER 33285 WAT 901 ATOM 33285 O WAT 902 40.224 76.192 72.583 1.00 0.00 O ATOM 33286 H1 WAT 902 39.550 75.891 71.973 1.00 0.00 H ATOM 33287 H2 WAT 902 39.734 76.568 73.314 1.00 0.00 H TER 33289 WAT 902 ATOM 33289 O WAT 903 93.559 22.846 106.031 1.00 0.00 O ATOM 33290 H1 WAT 903 93.770 23.032 106.946 1.00 0.00 H ATOM 33291 H2 WAT 903 93.504 23.708 105.618 1.00 0.00 H TER 33293 WAT 903 ATOM 33293 O WAT 904 20.114 47.070 127.510 1.00 0.00 O ATOM 33294 H1 WAT 904 20.389 47.705 126.849 1.00 0.00 H ATOM 33295 H2 WAT 904 20.242 47.522 128.344 1.00 0.00 H TER 33297 WAT 904 ATOM 33297 O WAT 905 113.915 5.050 146.641 1.00 0.00 O ATOM 33298 H1 WAT 905 113.956 4.832 145.710 1.00 0.00 H ATOM 33299 H2 WAT 905 114.432 4.368 147.070 1.00 0.00 H TER 33301 WAT 905 ATOM 33301 O WAT 906 27.419 116.428 104.466 1.00 0.00 O ATOM 33302 H1 WAT 906 27.199 116.742 105.343 1.00 0.00 H ATOM 33303 H2 WAT 906 26.792 116.866 103.890 1.00 0.00 H TER 33305 WAT 906 ATOM 33305 O WAT 907 94.975 78.837 9.480 1.00 0.00 O ATOM 33306 H1 WAT 907 95.035 78.929 10.431 1.00 0.00 H ATOM 33307 H2 WAT 907 94.162 78.353 9.337 1.00 0.00 H TER 33309 WAT 907 ATOM 33309 O WAT 908 60.681 11.412 141.190 1.00 0.00 O ATOM 33310 H1 WAT 908 59.930 10.913 140.870 1.00 0.00 H ATOM 33311 H2 WAT 908 61.442 10.887 140.939 1.00 0.00 H TER 33313 WAT 908 ATOM 33313 O WAT 909 77.843 23.033 68.355 1.00 0.00 O ATOM 33314 H1 WAT 909 78.053 23.181 69.277 1.00 0.00 H ATOM 33315 H2 WAT 909 77.328 23.799 68.101 1.00 0.00 H TER 33317 WAT 909 ATOM 33317 O WAT 910 9.213 128.876 78.768 1.00 0.00 O ATOM 33318 H1 WAT 910 8.799 129.419 79.439 1.00 0.00 H ATOM 33319 H2 WAT 910 8.487 128.572 78.224 1.00 0.00 H TER 33321 WAT 910 ATOM 33321 O WAT 911 126.485 130.956 76.003 1.00 0.00 O ATOM 33322 H1 WAT 911 127.116 131.625 76.268 1.00 0.00 H ATOM 33323 H2 WAT 911 127.022 130.194 75.784 1.00 0.00 H TER 33325 WAT 911 ATOM 33325 O WAT 912 86.556 7.910 104.810 1.00 0.00 O ATOM 33326 H1 WAT 912 86.239 7.756 105.700 1.00 0.00 H ATOM 33327 H2 WAT 912 85.888 7.520 104.247 1.00 0.00 H TER 33329 WAT 912 ATOM 33329 O WAT 913 2.432 74.637 15.641 1.00 0.00 O ATOM 33330 H1 WAT 913 2.816 74.828 16.497 1.00 0.00 H ATOM 33331 H2 WAT 913 1.846 75.374 15.472 1.00 0.00 H TER 33333 WAT 913 ATOM 33333 O WAT 914 119.017 132.071 81.201 1.00 0.00 O ATOM 33334 H1 WAT 914 119.530 131.265 81.253 1.00 0.00 H ATOM 33335 H2 WAT 914 118.837 132.300 82.113 1.00 0.00 H TER 33337 WAT 914 ATOM 33337 O WAT 915 88.352 102.372 97.717 1.00 0.00 O ATOM 33338 H1 WAT 915 88.921 102.725 97.033 1.00 0.00 H ATOM 33339 H2 WAT 915 87.502 102.265 97.290 1.00 0.00 H TER 33341 WAT 915 ATOM 33341 O WAT 916 143.289 137.765 158.174 1.00 0.00 O ATOM 33342 H1 WAT 916 142.392 137.899 158.483 1.00 0.00 H ATOM 33343 H2 WAT 916 143.264 138.016 157.251 1.00 0.00 H TER 33345 WAT 916 ATOM 33345 O WAT 917 22.799 3.457 113.078 1.00 0.00 O ATOM 33346 H1 WAT 917 22.888 2.862 113.822 1.00 0.00 H ATOM 33347 H2 WAT 917 21.913 3.811 113.159 1.00 0.00 H TER 33349 WAT 917 ATOM 33349 O WAT 918 24.351 37.752 153.257 1.00 0.00 O ATOM 33350 H1 WAT 918 24.179 36.816 153.156 1.00 0.00 H ATOM 33351 H2 WAT 918 25.305 37.824 153.240 1.00 0.00 H TER 33353 WAT 918 ATOM 33353 O WAT 919 142.102 18.065 107.071 1.00 0.00 O ATOM 33354 H1 WAT 919 142.339 17.375 107.691 1.00 0.00 H ATOM 33355 H2 WAT 919 142.103 18.867 107.593 1.00 0.00 H TER 33357 WAT 919 ATOM 33357 O WAT 920 145.013 124.062 119.332 1.00 0.00 O ATOM 33358 H1 WAT 920 144.890 123.332 119.939 1.00 0.00 H ATOM 33359 H2 WAT 920 145.378 123.660 118.544 1.00 0.00 H TER 33361 WAT 920 ATOM 33361 O WAT 921 56.907 93.372 138.114 1.00 0.00 O ATOM 33362 H1 WAT 921 57.713 93.100 138.552 1.00 0.00 H ATOM 33363 H2 WAT 921 57.150 94.166 137.637 1.00 0.00 H TER 33365 WAT 921 ATOM 33365 O WAT 922 58.027 145.735 74.882 1.00 0.00 O ATOM 33366 H1 WAT 922 58.018 145.630 73.931 1.00 0.00 H ATOM 33367 H2 WAT 922 57.437 145.054 75.204 1.00 0.00 H TER 33369 WAT 922 ATOM 33369 O WAT 923 58.669 130.127 126.291 1.00 0.00 O ATOM 33370 H1 WAT 923 59.544 130.411 126.027 1.00 0.00 H ATOM 33371 H2 WAT 923 58.293 130.889 126.731 1.00 0.00 H TER 33373 WAT 923 ATOM 33373 O WAT 924 42.736 104.695 148.064 1.00 0.00 O ATOM 33374 H1 WAT 924 41.910 104.941 147.646 1.00 0.00 H ATOM 33375 H2 WAT 924 43.005 105.480 148.543 1.00 0.00 H TER 33377 WAT 924 ATOM 33377 O WAT 925 50.924 70.331 7.912 1.00 0.00 O ATOM 33378 H1 WAT 925 50.030 70.075 8.137 1.00 0.00 H ATOM 33379 H2 WAT 925 51.473 69.859 8.538 1.00 0.00 H TER 33381 WAT 925 ATOM 33381 O WAT 926 64.339 81.274 88.629 1.00 0.00 O ATOM 33382 H1 WAT 926 63.630 81.784 88.236 1.00 0.00 H ATOM 33383 H2 WAT 926 64.090 81.188 89.549 1.00 0.00 H TER 33385 WAT 926 ATOM 33385 O WAT 927 99.438 118.742 142.104 1.00 0.00 O ATOM 33386 H1 WAT 927 99.234 119.083 142.974 1.00 0.00 H ATOM 33387 H2 WAT 927 98.867 119.233 141.514 1.00 0.00 H TER 33389 WAT 927 ATOM 33389 O WAT 928 93.690 32.264 120.123 1.00 0.00 O ATOM 33390 H1 WAT 928 93.949 32.684 120.944 1.00 0.00 H ATOM 33391 H2 WAT 928 93.552 31.347 120.357 1.00 0.00 H TER 33393 WAT 928 ATOM 33393 O WAT 929 62.433 37.209 94.365 1.00 0.00 O ATOM 33394 H1 WAT 929 62.339 36.798 95.225 1.00 0.00 H ATOM 33395 H2 WAT 929 62.081 36.564 93.752 1.00 0.00 H TER 33397 WAT 929 ATOM 33397 O WAT 930 85.137 22.929 75.303 1.00 0.00 O ATOM 33398 H1 WAT 930 85.413 23.789 75.619 1.00 0.00 H ATOM 33399 H2 WAT 930 85.955 22.473 75.105 1.00 0.00 H TER 33401 WAT 930 ATOM 33401 O WAT 931 1.432 138.518 65.783 1.00 0.00 O ATOM 33402 H1 WAT 931 0.596 138.081 65.945 1.00 0.00 H ATOM 33403 H2 WAT 931 1.794 138.675 66.655 1.00 0.00 H TER 33405 WAT 931 ATOM 33405 O WAT 932 58.707 62.616 130.869 1.00 0.00 O ATOM 33406 H1 WAT 932 59.599 62.640 130.523 1.00 0.00 H ATOM 33407 H2 WAT 932 58.294 63.408 130.524 1.00 0.00 H TER 33409 WAT 932 ATOM 33409 O WAT 933 106.545 63.052 155.009 1.00 0.00 O ATOM 33410 H1 WAT 933 105.966 63.287 154.284 1.00 0.00 H ATOM 33411 H2 WAT 933 105.956 62.919 155.752 1.00 0.00 H TER 33413 WAT 933 ATOM 33413 O WAT 934 102.917 77.794 24.040 1.00 0.00 O ATOM 33414 H1 WAT 934 102.982 76.857 24.223 1.00 0.00 H ATOM 33415 H2 WAT 934 103.279 78.215 24.820 1.00 0.00 H TER 33417 WAT 934 ATOM 33417 O WAT 935 52.890 11.520 89.499 1.00 0.00 O ATOM 33418 H1 WAT 935 52.160 11.545 90.118 1.00 0.00 H ATOM 33419 H2 WAT 935 53.656 11.756 90.022 1.00 0.00 H TER 33421 WAT 935 ATOM 33421 O WAT 936 136.632 86.567 99.691 1.00 0.00 O ATOM 33422 H1 WAT 936 136.099 85.776 99.770 1.00 0.00 H ATOM 33423 H2 WAT 936 137.448 86.353 100.143 1.00 0.00 H TER 33425 WAT 936 ATOM 33425 O WAT 937 64.459 87.494 89.930 1.00 0.00 O ATOM 33426 H1 WAT 937 64.459 86.949 89.144 1.00 0.00 H ATOM 33427 H2 WAT 937 65.287 87.973 89.889 1.00 0.00 H TER 33429 WAT 937 ATOM 33429 O WAT 938 3.742 84.551 3.714 1.00 0.00 O ATOM 33430 H1 WAT 938 3.365 85.259 4.236 1.00 0.00 H ATOM 33431 H2 WAT 938 3.526 84.778 2.810 1.00 0.00 H TER 33433 WAT 938 ATOM 33433 O WAT 939 135.508 138.660 73.052 1.00 0.00 O ATOM 33434 H1 WAT 939 134.759 138.991 72.555 1.00 0.00 H ATOM 33435 H2 WAT 939 135.423 137.708 73.007 1.00 0.00 H TER 33437 WAT 939 ATOM 33437 O WAT 940 133.458 19.677 76.751 1.00 0.00 O ATOM 33438 H1 WAT 940 133.989 19.505 77.529 1.00 0.00 H ATOM 33439 H2 WAT 940 133.379 18.824 76.323 1.00 0.00 H TER 33441 WAT 940 ATOM 33441 O WAT 941 75.038 143.446 111.684 1.00 0.00 O ATOM 33442 H1 WAT 941 74.771 143.224 110.792 1.00 0.00 H ATOM 33443 H2 WAT 941 75.971 143.647 111.611 1.00 0.00 H TER 33445 WAT 941 ATOM 33445 O WAT 942 48.605 53.249 102.397 1.00 0.00 O ATOM 33446 H1 WAT 942 48.772 54.140 102.706 1.00 0.00 H ATOM 33447 H2 WAT 942 49.473 52.897 102.202 1.00 0.00 H TER 33449 WAT 942 ATOM 33449 O WAT 943 4.917 51.706 118.460 1.00 0.00 O ATOM 33450 H1 WAT 943 4.366 52.313 117.965 1.00 0.00 H ATOM 33451 H2 WAT 943 4.995 50.938 117.895 1.00 0.00 H TER 33453 WAT 943 ATOM 33453 O WAT 944 33.195 81.283 147.271 1.00 0.00 O ATOM 33454 H1 WAT 944 33.982 81.100 146.757 1.00 0.00 H ATOM 33455 H2 WAT 944 32.937 80.432 147.625 1.00 0.00 H TER 33457 WAT 944 ATOM 33457 O WAT 945 122.978 50.892 144.802 1.00 0.00 O ATOM 33458 H1 WAT 945 123.146 51.212 145.688 1.00 0.00 H ATOM 33459 H2 WAT 945 123.141 51.649 144.239 1.00 0.00 H TER 33461 WAT 945 ATOM 33461 O WAT 946 116.072 73.475 118.189 1.00 0.00 O ATOM 33462 H1 WAT 946 116.837 73.546 118.759 1.00 0.00 H ATOM 33463 H2 WAT 946 116.413 73.635 117.309 1.00 0.00 H TER 33465 WAT 946 ATOM 33465 O WAT 947 68.731 82.284 82.849 1.00 0.00 O ATOM 33466 H1 WAT 947 68.953 83.188 83.069 1.00 0.00 H ATOM 33467 H2 WAT 947 67.849 82.337 82.480 1.00 0.00 H TER 33469 WAT 947 ATOM 33469 O WAT 948 83.825 46.472 60.398 1.00 0.00 O ATOM 33470 H1 WAT 948 83.477 46.775 59.560 1.00 0.00 H ATOM 33471 H2 WAT 948 84.775 46.520 60.295 1.00 0.00 H TER 33473 WAT 948 ATOM 33473 O WAT 949 130.812 93.665 14.609 1.00 0.00 O ATOM 33474 H1 WAT 949 129.916 93.984 14.710 1.00 0.00 H ATOM 33475 H2 WAT 949 131.308 94.127 15.285 1.00 0.00 H TER 33477 WAT 949 ATOM 33477 O WAT 950 126.812 67.384 119.333 1.00 0.00 O ATOM 33478 H1 WAT 950 127.083 67.725 118.481 1.00 0.00 H ATOM 33479 H2 WAT 950 127.623 67.074 119.736 1.00 0.00 H TER 33481 WAT 950 ATOM 33481 O WAT 951 121.753 64.063 3.419 1.00 0.00 O ATOM 33482 H1 WAT 951 122.452 63.433 3.596 1.00 0.00 H ATOM 33483 H2 WAT 951 121.368 64.241 4.277 1.00 0.00 H TER 33485 WAT 951 ATOM 33485 O WAT 952 77.176 39.038 137.524 1.00 0.00 O ATOM 33486 H1 WAT 952 76.641 38.771 138.272 1.00 0.00 H ATOM 33487 H2 WAT 952 77.394 38.218 137.082 1.00 0.00 H TER 33489 WAT 952 ATOM 33489 O WAT 953 112.958 47.583 158.228 1.00 0.00 O ATOM 33490 H1 WAT 953 112.699 48.035 157.425 1.00 0.00 H ATOM 33491 H2 WAT 953 113.117 48.287 158.857 1.00 0.00 H TER 33493 WAT 953 ATOM 33493 O WAT 954 36.874 40.126 86.299 1.00 0.00 O ATOM 33494 H1 WAT 954 36.106 40.689 86.205 1.00 0.00 H ATOM 33495 H2 WAT 954 36.969 40.006 87.244 1.00 0.00 H TER 33497 WAT 954 ATOM 33497 O WAT 955 142.860 42.742 145.716 1.00 0.00 O ATOM 33498 H1 WAT 955 142.425 41.983 146.105 1.00 0.00 H ATOM 33499 H2 WAT 955 143.273 43.187 146.456 1.00 0.00 H TER 33501 WAT 955 ATOM 33501 O WAT 956 102.435 89.069 6.140 1.00 0.00 O ATOM 33502 H1 WAT 956 102.513 88.415 6.834 1.00 0.00 H ATOM 33503 H2 WAT 956 101.506 89.065 5.911 1.00 0.00 H TER 33505 WAT 956 ATOM 33505 O WAT 957 69.353 60.414 79.410 1.00 0.00 O ATOM 33506 H1 WAT 957 69.994 60.672 80.072 1.00 0.00 H ATOM 33507 H2 WAT 957 69.008 61.242 79.075 1.00 0.00 H TER 33509 WAT 957 ATOM 33509 O WAT 958 138.020 63.843 89.535 1.00 0.00 O ATOM 33510 H1 WAT 958 138.698 63.337 89.086 1.00 0.00 H ATOM 33511 H2 WAT 958 137.253 63.271 89.533 1.00 0.00 H TER 33513 WAT 958 ATOM 33513 O WAT 959 98.289 136.385 6.505 1.00 0.00 O ATOM 33514 H1 WAT 959 99.164 136.385 6.117 1.00 0.00 H ATOM 33515 H2 WAT 959 98.260 137.184 7.030 1.00 0.00 H TER 33517 WAT 959 ATOM 33517 O WAT 960 1.166 117.078 107.463 1.00 0.00 O ATOM 33518 H1 WAT 960 1.382 118.009 107.409 1.00 0.00 H ATOM 33519 H2 WAT 960 0.216 117.059 107.577 1.00 0.00 H TER 33521 WAT 960 ATOM 33521 O WAT 961 131.775 48.170 121.558 1.00 0.00 O ATOM 33522 H1 WAT 961 130.870 47.927 121.756 1.00 0.00 H ATOM 33523 H2 WAT 961 131.821 49.105 121.757 1.00 0.00 H TER 33525 WAT 961 ATOM 33525 O WAT 962 47.027 7.965 108.130 1.00 0.00 O ATOM 33526 H1 WAT 962 46.098 8.129 108.293 1.00 0.00 H ATOM 33527 H2 WAT 962 47.454 8.801 108.317 1.00 0.00 H TER 33529 WAT 962 ATOM 33529 O WAT 963 123.349 68.015 14.486 1.00 0.00 O ATOM 33530 H1 WAT 963 123.183 68.113 13.548 1.00 0.00 H ATOM 33531 H2 WAT 963 123.974 67.292 14.544 1.00 0.00 H TER 33533 WAT 963 ATOM 33533 O WAT 964 88.502 37.763 127.173 1.00 0.00 O ATOM 33534 H1 WAT 964 88.764 38.314 127.911 1.00 0.00 H ATOM 33535 H2 WAT 964 88.612 36.868 127.492 1.00 0.00 H TER 33537 WAT 964 ATOM 33537 O WAT 965 88.826 18.027 124.688 1.00 0.00 O ATOM 33538 H1 WAT 965 89.770 17.957 124.832 1.00 0.00 H ATOM 33539 H2 WAT 965 88.436 17.757 125.520 1.00 0.00 H TER 33541 WAT 965 ATOM 33541 O WAT 966 36.526 85.284 144.092 1.00 0.00 O ATOM 33542 H1 WAT 966 36.320 84.675 143.383 1.00 0.00 H ATOM 33543 H2 WAT 966 36.050 86.083 143.866 1.00 0.00 H TER 33545 WAT 966 ATOM 33545 O WAT 967 52.390 91.553 128.798 1.00 0.00 O ATOM 33546 H1 WAT 967 52.912 91.572 129.601 1.00 0.00 H ATOM 33547 H2 WAT 967 52.738 92.271 128.269 1.00 0.00 H TER 33549 WAT 967 ATOM 33549 O WAT 968 25.489 136.676 96.384 1.00 0.00 O ATOM 33550 H1 WAT 968 24.553 136.856 96.465 1.00 0.00 H ATOM 33551 H2 WAT 968 25.804 137.323 95.753 1.00 0.00 H TER 33553 WAT 968 ATOM 33553 O WAT 969 22.822 35.238 123.406 1.00 0.00 O ATOM 33554 H1 WAT 969 22.453 34.446 123.014 1.00 0.00 H ATOM 33555 H2 WAT 969 23.357 35.622 122.711 1.00 0.00 H TER 33557 WAT 969 ATOM 33557 O WAT 970 92.853 91.275 18.358 1.00 0.00 O ATOM 33558 H1 WAT 970 92.686 90.722 17.595 1.00 0.00 H ATOM 33559 H2 WAT 970 92.876 92.166 18.008 1.00 0.00 H TER 33561 WAT 970 ATOM 33561 O WAT 971 41.373 127.849 128.602 1.00 0.00 O ATOM 33562 H1 WAT 971 41.279 127.887 129.554 1.00 0.00 H ATOM 33563 H2 WAT 971 40.677 128.416 128.270 1.00 0.00 H TER 33565 WAT 971 ATOM 33565 O WAT 972 97.100 81.637 155.847 1.00 0.00 O ATOM 33566 H1 WAT 972 97.628 82.242 156.368 1.00 0.00 H ATOM 33567 H2 WAT 972 97.615 81.491 155.054 1.00 0.00 H TER 33569 WAT 972 ATOM 33569 O WAT 973 130.415 106.218 22.211 1.00 0.00 O ATOM 33570 H1 WAT 973 130.033 106.265 21.335 1.00 0.00 H ATOM 33571 H2 WAT 973 131.360 106.213 22.060 1.00 0.00 H TER 33573 WAT 973 ATOM 33573 O WAT 974 71.769 128.563 94.707 1.00 0.00 O ATOM 33574 H1 WAT 974 71.362 128.846 93.888 1.00 0.00 H ATOM 33575 H2 WAT 974 71.635 129.297 95.306 1.00 0.00 H TER 33577 WAT 974 ATOM 33577 O WAT 975 32.506 1.129 52.212 1.00 0.00 O ATOM 33578 H1 WAT 975 33.165 1.065 52.903 1.00 0.00 H ATOM 33579 H2 WAT 975 31.697 0.825 52.624 1.00 0.00 H TER 33581 WAT 975 ATOM 33581 O WAT 976 62.515 27.379 85.743 1.00 0.00 O ATOM 33582 H1 WAT 976 62.579 26.579 86.265 1.00 0.00 H ATOM 33583 H2 WAT 976 63.251 27.328 85.134 1.00 0.00 H TER 33585 WAT 976 ATOM 33585 O WAT 977 90.463 42.870 68.020 1.00 0.00 O ATOM 33586 H1 WAT 977 89.915 42.128 67.765 1.00 0.00 H ATOM 33587 H2 WAT 977 89.842 43.573 68.209 1.00 0.00 H TER 33589 WAT 977 ATOM 33589 O WAT 978 61.263 100.058 132.742 1.00 0.00 O ATOM 33590 H1 WAT 978 61.149 100.591 133.529 1.00 0.00 H ATOM 33591 H2 WAT 978 60.381 99.969 132.382 1.00 0.00 H TER 33593 WAT 978 ATOM 33593 O WAT 979 4.501 121.372 103.562 1.00 0.00 O ATOM 33594 H1 WAT 979 4.411 121.277 102.614 1.00 0.00 H ATOM 33595 H2 WAT 979 5.377 121.738 103.684 1.00 0.00 H TER 33597 WAT 979 ATOM 33597 O WAT 980 88.534 142.243 115.846 1.00 0.00 O ATOM 33598 H1 WAT 980 88.343 141.314 115.976 1.00 0.00 H ATOM 33599 H2 WAT 980 88.015 142.691 116.514 1.00 0.00 H TER 33601 WAT 980 ATOM 33601 O WAT 981 79.571 93.205 72.222 1.00 0.00 O ATOM 33602 H1 WAT 981 79.087 93.477 71.442 1.00 0.00 H ATOM 33603 H2 WAT 981 80.490 93.355 71.997 1.00 0.00 H TER 33605 WAT 981 ATOM 33605 O WAT 982 87.253 75.803 5.935 1.00 0.00 O ATOM 33606 H1 WAT 982 88.101 75.360 5.915 1.00 0.00 H ATOM 33607 H2 WAT 982 87.353 76.539 5.332 1.00 0.00 H TER 33609 WAT 982 ATOM 33609 O WAT 983 22.580 24.287 129.803 1.00 0.00 O ATOM 33610 H1 WAT 983 22.215 24.325 128.919 1.00 0.00 H ATOM 33611 H2 WAT 983 23.519 24.429 129.680 1.00 0.00 H TER 33613 WAT 983 ATOM 33613 O WAT 984 139.736 118.953 123.656 1.00 0.00 O ATOM 33614 H1 WAT 984 140.212 118.187 123.977 1.00 0.00 H ATOM 33615 H2 WAT 984 139.481 118.719 122.763 1.00 0.00 H TER 33617 WAT 984 ATOM 33617 O WAT 985 20.385 50.526 129.814 1.00 0.00 O ATOM 33618 H1 WAT 985 19.790 50.542 130.563 1.00 0.00 H ATOM 33619 H2 WAT 985 20.796 49.662 129.852 1.00 0.00 H TER 33621 WAT 985 ATOM 33621 O WAT 986 43.366 121.553 1.925 1.00 0.00 O ATOM 33622 H1 WAT 986 43.229 120.863 2.574 1.00 0.00 H ATOM 33623 H2 WAT 986 42.543 121.592 1.439 1.00 0.00 H TER 33625 WAT 986 ATOM 33625 O WAT 987 0.792 97.628 124.542 1.00 0.00 O ATOM 33626 H1 WAT 987 -0.147 97.442 124.528 1.00 0.00 H ATOM 33627 H2 WAT 987 1.064 97.554 123.627 1.00 0.00 H TER 33629 WAT 987 ATOM 33629 O WAT 988 97.328 77.238 122.572 1.00 0.00 O ATOM 33630 H1 WAT 988 96.581 76.857 122.111 1.00 0.00 H ATOM 33631 H2 WAT 988 98.081 77.037 122.016 1.00 0.00 H TER 33633 WAT 988 ATOM 33633 O WAT 989 134.142 85.822 113.247 1.00 0.00 O ATOM 33634 H1 WAT 989 134.220 85.085 112.642 1.00 0.00 H ATOM 33635 H2 WAT 989 133.862 85.425 114.072 1.00 0.00 H TER 33637 WAT 989 ATOM 33637 O WAT 990 21.931 33.622 150.633 1.00 0.00 O ATOM 33638 H1 WAT 990 21.859 32.852 150.068 1.00 0.00 H ATOM 33639 H2 WAT 990 21.788 33.284 151.517 1.00 0.00 H TER 33641 WAT 990 ATOM 33641 O WAT 991 138.755 109.123 105.195 1.00 0.00 O ATOM 33642 H1 WAT 991 138.159 109.855 105.040 1.00 0.00 H ATOM 33643 H2 WAT 991 138.541 108.491 104.509 1.00 0.00 H TER 33645 WAT 991 ATOM 33645 O WAT 992 44.295 69.039 149.184 1.00 0.00 O ATOM 33646 H1 WAT 992 45.093 69.246 148.697 1.00 0.00 H ATOM 33647 H2 WAT 992 44.545 68.312 149.755 1.00 0.00 H TER 33649 WAT 992 ATOM 33649 O WAT 993 88.915 19.832 91.464 1.00 0.00 O ATOM 33650 H1 WAT 993 89.480 20.476 91.038 1.00 0.00 H ATOM 33651 H2 WAT 993 89.437 19.502 92.196 1.00 0.00 H TER 33653 WAT 993 ATOM 33653 O WAT 994 142.682 53.291 133.947 1.00 0.00 O ATOM 33654 H1 WAT 994 142.599 52.643 134.647 1.00 0.00 H ATOM 33655 H2 WAT 994 142.880 52.776 133.165 1.00 0.00 H TER 33657 WAT 994 ATOM 33657 O WAT 995 110.200 139.835 97.186 1.00 0.00 O ATOM 33658 H1 WAT 995 110.397 140.599 97.728 1.00 0.00 H ATOM 33659 H2 WAT 995 110.996 139.305 97.223 1.00 0.00 H TER 33661 WAT 995 ATOM 33661 O WAT 996 0.902 68.924 82.648 1.00 0.00 O ATOM 33662 H1 WAT 996 0.238 69.584 82.448 1.00 0.00 H ATOM 33663 H2 WAT 996 0.773 68.728 83.576 1.00 0.00 H TER 33665 WAT 996 ATOM 33665 O WAT 997 141.786 44.059 4.058 1.00 0.00 O ATOM 33666 H1 WAT 997 141.122 43.406 4.276 1.00 0.00 H ATOM 33667 H2 WAT 997 142.212 44.256 4.893 1.00 0.00 H TER 33669 WAT 997 ATOM 33669 O WAT 998 58.706 74.777 61.148 1.00 0.00 O ATOM 33670 H1 WAT 998 58.680 73.945 61.621 1.00 0.00 H ATOM 33671 H2 WAT 998 59.041 75.405 61.788 1.00 0.00 H TER 33673 WAT 998 ATOM 33673 O WAT 999 112.682 73.015 10.067 1.00 0.00 O ATOM 33674 H1 WAT 999 112.626 73.946 9.850 1.00 0.00 H ATOM 33675 H2 WAT 999 112.729 72.995 11.023 1.00 0.00 H TER 33677 WAT 999 ATOM 33677 O WAT 1000 24.970 6.018 99.531 1.00 0.00 O ATOM 33678 H1 WAT 1000 24.232 5.440 99.338 1.00 0.00 H ATOM 33679 H2 WAT 1000 24.566 6.826 99.845 1.00 0.00 H TER 33681 WAT 1000 ATOM 33681 O WAT 1001 61.373 33.378 15.430 1.00 0.00 O ATOM 33682 H1 WAT 1001 62.146 32.950 15.798 1.00 0.00 H ATOM 33683 H2 WAT 1001 60.910 33.730 16.190 1.00 0.00 H TER 33685 WAT 1001 ATOM 33685 O WAT 1002 41.955 8.549 144.552 1.00 0.00 O ATOM 33686 H1 WAT 1002 41.402 8.687 145.321 1.00 0.00 H ATOM 33687 H2 WAT 1002 41.426 8.003 143.971 1.00 0.00 H TER 33689 WAT 1002 ATOM 33689 O WAT 1003 124.850 124.704 157.596 1.00 0.00 O ATOM 33690 H1 WAT 1003 125.387 124.497 156.831 1.00 0.00 H ATOM 33691 H2 WAT 1003 125.448 125.154 158.193 1.00 0.00 H TER 33693 WAT 1003 ATOM 33693 O WAT 1004 34.473 3.525 139.139 1.00 0.00 O ATOM 33694 H1 WAT 1004 34.761 2.911 138.463 1.00 0.00 H ATOM 33695 H2 WAT 1004 34.871 3.197 139.945 1.00 0.00 H TER 33697 WAT 1004 ATOM 33697 O WAT 1005 66.075 73.179 74.698 1.00 0.00 O ATOM 33698 H1 WAT 1005 66.069 72.969 73.764 1.00 0.00 H ATOM 33699 H2 WAT 1005 65.151 73.190 74.947 1.00 0.00 H TER 33701 WAT 1005 ATOM 33701 O WAT 1006 60.877 56.352 149.989 1.00 0.00 O ATOM 33702 H1 WAT 1006 61.471 55.682 149.651 1.00 0.00 H ATOM 33703 H2 WAT 1006 61.428 56.900 150.548 1.00 0.00 H TER 33705 WAT 1006 ATOM 33705 O WAT 1007 25.068 24.282 103.740 1.00 0.00 O ATOM 33706 H1 WAT 1007 25.238 25.221 103.667 1.00 0.00 H ATOM 33707 H2 WAT 1007 25.400 24.044 104.605 1.00 0.00 H TER 33709 WAT 1007 ATOM 33709 O WAT 1008 81.919 5.221 68.936 1.00 0.00 O ATOM 33710 H1 WAT 1008 82.060 4.292 68.756 1.00 0.00 H ATOM 33711 H2 WAT 1008 81.780 5.614 68.074 1.00 0.00 H TER 33713 WAT 1008 ATOM 33713 O WAT 1009 71.143 126.919 81.402 1.00 0.00 O ATOM 33714 H1 WAT 1009 71.140 127.558 82.114 1.00 0.00 H ATOM 33715 H2 WAT 1009 72.007 126.510 81.451 1.00 0.00 H TER 33717 WAT 1009 ATOM 33717 O WAT 1010 121.679 104.700 138.421 1.00 0.00 O ATOM 33718 H1 WAT 1010 122.101 104.101 137.805 1.00 0.00 H ATOM 33719 H2 WAT 1010 120.746 104.502 138.346 1.00 0.00 H TER 33721 WAT 1010 ATOM 33721 O WAT 1011 70.020 40.483 83.873 1.00 0.00 O ATOM 33722 H1 WAT 1011 70.067 41.117 84.588 1.00 0.00 H ATOM 33723 H2 WAT 1011 70.116 41.010 83.079 1.00 0.00 H TER 33725 WAT 1011 ATOM 33725 O WAT 1012 100.056 106.283 61.483 1.00 0.00 O ATOM 33726 H1 WAT 1012 100.015 105.771 62.290 1.00 0.00 H ATOM 33727 H2 WAT 1012 99.147 106.526 61.307 1.00 0.00 H TER 33729 WAT 1012 ATOM 33729 O WAT 1013 43.342 103.134 118.274 1.00 0.00 O ATOM 33730 H1 WAT 1013 43.298 102.297 117.812 1.00 0.00 H ATOM 33731 H2 WAT 1013 43.163 103.790 117.600 1.00 0.00 H TER 33733 WAT 1013 ATOM 33733 O WAT 1014 71.997 64.658 108.630 1.00 0.00 O ATOM 33734 H1 WAT 1014 71.434 64.369 109.347 1.00 0.00 H ATOM 33735 H2 WAT 1014 71.517 65.380 108.224 1.00 0.00 H TER 33737 WAT 1014 ATOM 33737 O WAT 1015 51.260 17.936 125.747 1.00 0.00 O ATOM 33738 H1 WAT 1015 50.398 17.682 125.417 1.00 0.00 H ATOM 33739 H2 WAT 1015 51.521 18.672 125.193 1.00 0.00 H TER 33741 WAT 1015 ATOM 33741 O WAT 1016 21.214 134.467 144.373 1.00 0.00 O ATOM 33742 H1 WAT 1016 21.275 133.629 143.914 1.00 0.00 H ATOM 33743 H2 WAT 1016 22.053 134.554 144.825 1.00 0.00 H TER 33745 WAT 1016 ATOM 33745 O WAT 1017 20.504 41.452 126.131 1.00 0.00 O ATOM 33746 H1 WAT 1017 21.412 41.548 126.420 1.00 0.00 H ATOM 33747 H2 WAT 1017 20.118 40.837 126.754 1.00 0.00 H TER 33749 WAT 1017 ATOM 33749 O WAT 1018 28.630 108.936 56.458 1.00 0.00 O ATOM 33750 H1 WAT 1018 27.852 109.469 56.624 1.00 0.00 H ATOM 33751 H2 WAT 1018 29.182 109.486 55.903 1.00 0.00 H TER 33753 WAT 1018 ATOM 33753 O WAT 1019 84.333 98.014 2.351 1.00 0.00 O ATOM 33754 H1 WAT 1019 84.629 97.956 3.259 1.00 0.00 H ATOM 33755 H2 WAT 1019 84.965 97.491 1.859 1.00 0.00 H TER 33757 WAT 1019 ATOM 33757 O WAT 1020 97.496 85.077 10.185 1.00 0.00 O ATOM 33758 H1 WAT 1020 98.410 84.854 10.008 1.00 0.00 H ATOM 33759 H2 WAT 1020 97.111 85.214 9.319 1.00 0.00 H TER 33761 WAT 1020 ATOM 33761 O WAT 1021 119.198 96.563 125.060 1.00 0.00 O ATOM 33762 H1 WAT 1021 118.354 96.994 124.927 1.00 0.00 H ATOM 33763 H2 WAT 1021 118.972 95.684 125.364 1.00 0.00 H TER 33765 WAT 1021 ATOM 33765 O WAT 1022 68.285 29.180 129.244 1.00 0.00 O ATOM 33766 H1 WAT 1022 68.366 29.068 128.297 1.00 0.00 H ATOM 33767 H2 WAT 1022 67.698 29.930 129.347 1.00 0.00 H TER 33769 WAT 1022 ATOM 33769 O WAT 1023 68.148 28.845 80.077 1.00 0.00 O ATOM 33770 H1 WAT 1023 68.713 28.788 80.848 1.00 0.00 H ATOM 33771 H2 WAT 1023 67.524 29.539 80.288 1.00 0.00 H TER 33773 WAT 1023 ATOM 33773 O WAT 1024 89.477 122.392 103.799 1.00 0.00 O ATOM 33774 H1 WAT 1024 90.404 122.171 103.891 1.00 0.00 H ATOM 33775 H2 WAT 1024 89.040 121.548 103.687 1.00 0.00 H TER 33777 WAT 1024 ATOM 33777 O WAT 1025 33.014 46.584 153.147 1.00 0.00 O ATOM 33778 H1 WAT 1025 32.778 46.298 154.030 1.00 0.00 H ATOM 33779 H2 WAT 1025 33.959 46.731 153.188 1.00 0.00 H TER 33781 WAT 1025 ATOM 33781 O WAT 1026 123.497 82.733 6.616 1.00 0.00 O ATOM 33782 H1 WAT 1026 123.999 81.918 6.628 1.00 0.00 H ATOM 33783 H2 WAT 1026 122.678 82.504 6.179 1.00 0.00 H TER 33785 WAT 1026 ATOM 33785 O WAT 1027 94.289 125.411 58.917 1.00 0.00 O ATOM 33786 H1 WAT 1027 94.226 124.467 59.063 1.00 0.00 H ATOM 33787 H2 WAT 1027 94.677 125.493 58.046 1.00 0.00 H TER 33789 WAT 1027 ATOM 33789 O WAT 1028 113.074 19.776 156.566 1.00 0.00 O ATOM 33790 H1 WAT 1028 113.517 20.340 155.932 1.00 0.00 H ATOM 33791 H2 WAT 1028 112.242 19.552 156.148 1.00 0.00 H TER 33793 WAT 1028 ATOM 33793 O WAT 1029 130.194 74.889 152.805 1.00 0.00 O ATOM 33794 H1 WAT 1029 129.951 74.309 152.084 1.00 0.00 H ATOM 33795 H2 WAT 1029 131.033 74.547 153.115 1.00 0.00 H TER 33797 WAT 1029 ATOM 33797 O WAT 1030 52.919 30.210 101.230 1.00 0.00 O ATOM 33798 H1 WAT 1030 52.215 30.718 101.633 1.00 0.00 H ATOM 33799 H2 WAT 1030 52.529 29.851 100.432 1.00 0.00 H TER 33801 WAT 1030 ATOM 33801 O WAT 1031 77.415 23.587 106.748 1.00 0.00 O ATOM 33802 H1 WAT 1031 76.992 22.948 107.321 1.00 0.00 H ATOM 33803 H2 WAT 1031 76.944 24.404 106.912 1.00 0.00 H TER 33805 WAT 1031 ATOM 33805 O WAT 1032 7.740 79.903 127.677 1.00 0.00 O ATOM 33806 H1 WAT 1032 8.144 80.386 126.956 1.00 0.00 H ATOM 33807 H2 WAT 1032 6.988 79.464 127.279 1.00 0.00 H TER 33809 WAT 1032 ATOM 33809 O WAT 1033 80.306 64.554 16.656 1.00 0.00 O ATOM 33810 H1 WAT 1033 80.999 64.900 17.218 1.00 0.00 H ATOM 33811 H2 WAT 1033 80.311 63.611 16.823 1.00 0.00 H TER 33813 WAT 1033 ATOM 33813 O WAT 1034 138.675 135.802 118.170 1.00 0.00 O ATOM 33814 H1 WAT 1034 139.272 135.637 117.441 1.00 0.00 H ATOM 33815 H2 WAT 1034 138.712 136.749 118.301 1.00 0.00 H TER 33817 WAT 1034 ATOM 33817 O WAT 1035 73.771 131.414 116.262 1.00 0.00 O ATOM 33818 H1 WAT 1035 73.958 130.480 116.359 1.00 0.00 H ATOM 33819 H2 WAT 1035 73.222 131.628 117.017 1.00 0.00 H TER 33821 WAT 1035 ATOM 33821 O WAT 1036 28.477 136.580 105.256 1.00 0.00 O ATOM 33822 H1 WAT 1036 28.482 136.001 104.494 1.00 0.00 H ATOM 33823 H2 WAT 1036 27.557 136.624 105.518 1.00 0.00 H TER 33825 WAT 1036 ATOM 33825 O WAT 1037 133.281 17.329 152.069 1.00 0.00 O ATOM 33826 H1 WAT 1037 133.635 16.709 151.431 1.00 0.00 H ATOM 33827 H2 WAT 1037 132.357 17.414 151.832 1.00 0.00 H TER 33829 WAT 1037 ATOM 33829 O WAT 1038 87.872 20.041 152.124 1.00 0.00 O ATOM 33830 H1 WAT 1038 88.585 20.677 152.058 1.00 0.00 H ATOM 33831 H2 WAT 1038 87.187 20.389 151.554 1.00 0.00 H TER 33833 WAT 1038 ATOM 33833 O WAT 1039 48.251 1.964 23.219 1.00 0.00 O ATOM 33834 H1 WAT 1039 47.572 2.579 22.940 1.00 0.00 H ATOM 33835 H2 WAT 1039 48.521 2.282 24.081 1.00 0.00 H TER 33837 WAT 1039 ATOM 33837 O WAT 1040 85.958 26.030 157.614 1.00 0.00 O ATOM 33838 H1 WAT 1040 86.502 25.620 158.287 1.00 0.00 H ATOM 33839 H2 WAT 1040 85.888 25.368 156.926 1.00 0.00 H TER 33841 WAT 1040 ATOM 33841 O WAT 1041 62.743 75.092 20.269 1.00 0.00 O ATOM 33842 H1 WAT 1041 63.121 74.622 21.013 1.00 0.00 H ATOM 33843 H2 WAT 1041 63.239 75.909 20.226 1.00 0.00 H TER 33845 WAT 1041 ATOM 33845 O WAT 1042 63.922 114.287 101.149 1.00 0.00 O ATOM 33846 H1 WAT 1042 63.519 113.690 100.519 1.00 0.00 H ATOM 33847 H2 WAT 1042 63.224 114.902 101.375 1.00 0.00 H TER 33849 WAT 1042 ATOM 33849 O WAT 1043 130.650 12.801 83.230 1.00 0.00 O ATOM 33850 H1 WAT 1043 130.830 12.334 84.046 1.00 0.00 H ATOM 33851 H2 WAT 1043 129.701 12.739 83.122 1.00 0.00 H TER 33853 WAT 1043 ATOM 33853 O WAT 1044 94.686 144.967 133.432 1.00 0.00 O ATOM 33854 H1 WAT 1044 95.058 145.226 132.589 1.00 0.00 H ATOM 33855 H2 WAT 1044 93.844 145.421 133.472 1.00 0.00 H TER 33857 WAT 1044 ATOM 33857 O WAT 1045 137.346 85.488 150.906 1.00 0.00 O ATOM 33858 H1 WAT 1045 137.689 84.603 150.781 1.00 0.00 H ATOM 33859 H2 WAT 1045 137.944 86.049 150.413 1.00 0.00 H TER 33861 WAT 1045 ATOM 33861 O WAT 1046 76.265 11.053 4.816 1.00 0.00 O ATOM 33862 H1 WAT 1046 76.283 10.337 5.451 1.00 0.00 H ATOM 33863 H2 WAT 1046 76.497 10.642 3.984 1.00 0.00 H TER 33865 WAT 1046 ATOM 33865 O WAT 1047 66.821 112.695 1.726 1.00 0.00 O ATOM 33866 H1 WAT 1047 65.868 112.671 1.810 1.00 0.00 H ATOM 33867 H2 WAT 1047 67.023 112.010 1.089 1.00 0.00 H TER 33869 WAT 1047 ATOM 33869 O WAT 1048 55.139 2.885 141.971 1.00 0.00 O ATOM 33870 H1 WAT 1048 54.733 3.473 142.608 1.00 0.00 H ATOM 33871 H2 WAT 1048 54.440 2.280 141.724 1.00 0.00 H TER 33873 WAT 1048 ATOM 33873 O WAT 1049 0.962 54.732 131.969 1.00 0.00 O ATOM 33874 H1 WAT 1049 0.069 55.067 132.050 1.00 0.00 H ATOM 33875 H2 WAT 1049 0.914 53.837 132.306 1.00 0.00 H TER 33877 WAT 1049 ATOM 33877 O WAT 1050 121.099 36.593 1.290 1.00 0.00 O ATOM 33878 H1 WAT 1050 121.552 35.984 0.706 1.00 0.00 H ATOM 33879 H2 WAT 1050 120.789 37.291 0.714 1.00 0.00 H TER 33881 WAT 1050 ATOM 33881 O WAT 1051 92.037 86.892 24.719 1.00 0.00 O ATOM 33882 H1 WAT 1051 92.157 86.553 23.831 1.00 0.00 H ATOM 33883 H2 WAT 1051 91.363 87.566 24.629 1.00 0.00 H TER 33885 WAT 1051 ATOM 33885 O WAT 1052 144.336 106.965 27.397 1.00 0.00 O ATOM 33886 H1 WAT 1052 143.458 106.595 27.310 1.00 0.00 H ATOM 33887 H2 WAT 1052 144.236 107.881 27.138 1.00 0.00 H TER 33889 WAT 1052 ATOM 33889 O WAT 1053 94.613 96.823 128.714 1.00 0.00 O ATOM 33890 H1 WAT 1053 94.664 97.559 128.104 1.00 0.00 H ATOM 33891 H2 WAT 1053 94.773 97.212 129.573 1.00 0.00 H TER 33893 WAT 1053 ATOM 33893 O WAT 1054 77.474 30.013 100.717 1.00 0.00 O ATOM 33894 H1 WAT 1054 77.508 30.267 99.795 1.00 0.00 H ATOM 33895 H2 WAT 1054 78.373 29.766 100.931 1.00 0.00 H TER 33897 WAT 1054 ATOM 33897 O WAT 1055 95.453 30.848 16.111 1.00 0.00 O ATOM 33898 H1 WAT 1055 96.349 30.536 15.984 1.00 0.00 H ATOM 33899 H2 WAT 1055 94.969 30.497 15.364 1.00 0.00 H TER 33901 WAT 1055 ATOM 33901 O WAT 1056 26.110 18.542 2.320 1.00 0.00 O ATOM 33902 H1 WAT 1056 25.322 18.665 2.850 1.00 0.00 H ATOM 33903 H2 WAT 1056 26.693 19.251 2.590 1.00 0.00 H TER 33905 WAT 1056 ATOM 33905 O WAT 1057 0.374 105.145 25.914 1.00 0.00 O ATOM 33906 H1 WAT 1057 0.043 105.525 25.101 1.00 0.00 H ATOM 33907 H2 WAT 1057 -0.157 105.549 26.601 1.00 0.00 H TER 33909 WAT 1057 ATOM 33909 O WAT 1058 56.661 19.936 62.667 1.00 0.00 O ATOM 33910 H1 WAT 1058 57.613 20.009 62.730 1.00 0.00 H ATOM 33911 H2 WAT 1058 56.491 19.815 61.733 1.00 0.00 H TER 33913 WAT 1058 ATOM 33913 O WAT 1059 123.734 116.499 94.623 1.00 0.00 O ATOM 33914 H1 WAT 1059 124.113 117.088 93.971 1.00 0.00 H ATOM 33915 H2 WAT 1059 124.242 116.662 95.417 1.00 0.00 H TER 33917 WAT 1059 ATOM 33917 O WAT 1060 34.341 115.723 112.297 1.00 0.00 O ATOM 33918 H1 WAT 1060 35.089 115.357 111.824 1.00 0.00 H ATOM 33919 H2 WAT 1060 34.142 115.072 112.971 1.00 0.00 H TER 33921 WAT 1060 ATOM 33921 O WAT 1061 55.123 79.414 74.206 1.00 0.00 O ATOM 33922 H1 WAT 1061 54.998 79.799 75.074 1.00 0.00 H ATOM 33923 H2 WAT 1061 55.971 79.749 73.915 1.00 0.00 H TER 33925 WAT 1061 ATOM 33925 O WAT 1062 6.608 125.841 133.072 1.00 0.00 O ATOM 33926 H1 WAT 1062 5.998 125.157 133.346 1.00 0.00 H ATOM 33927 H2 WAT 1062 7.031 125.485 132.290 1.00 0.00 H TER 33929 WAT 1062 ATOM 33929 O WAT 1063 5.938 91.432 113.018 1.00 0.00 O ATOM 33930 H1 WAT 1063 6.596 92.094 112.807 1.00 0.00 H ATOM 33931 H2 WAT 1063 5.104 91.840 112.784 1.00 0.00 H TER 33933 WAT 1063 ATOM 33933 O WAT 1064 114.308 113.484 148.779 1.00 0.00 O ATOM 33934 H1 WAT 1064 113.463 113.729 149.156 1.00 0.00 H ATOM 33935 H2 WAT 1064 114.952 113.787 149.419 1.00 0.00 H TER 33937 WAT 1064 ATOM 33937 O WAT 1065 99.124 37.118 157.710 1.00 0.00 O ATOM 33938 H1 WAT 1065 99.842 36.835 157.144 1.00 0.00 H ATOM 33939 H2 WAT 1065 98.618 36.322 157.872 1.00 0.00 H TER 33941 WAT 1065 ATOM 33941 O WAT 1066 20.376 49.853 86.341 1.00 0.00 O ATOM 33942 H1 WAT 1066 20.905 50.623 86.134 1.00 0.00 H ATOM 33943 H2 WAT 1066 20.791 49.478 87.117 1.00 0.00 H TER 33945 WAT 1066 ATOM 33945 O WAT 1067 17.584 102.567 133.101 1.00 0.00 O ATOM 33946 H1 WAT 1067 18.247 102.037 132.659 1.00 0.00 H ATOM 33947 H2 WAT 1067 17.893 103.468 133.002 1.00 0.00 H TER 33949 WAT 1067 ATOM 33949 O WAT 1068 139.754 39.620 66.545 1.00 0.00 O ATOM 33950 H1 WAT 1068 138.939 40.060 66.786 1.00 0.00 H ATOM 33951 H2 WAT 1068 139.600 39.299 65.656 1.00 0.00 H TER 33953 WAT 1068 ATOM 33953 O WAT 1069 10.261 41.980 142.705 1.00 0.00 O ATOM 33954 H1 WAT 1069 9.609 41.284 142.624 1.00 0.00 H ATOM 33955 H2 WAT 1069 9.891 42.581 143.352 1.00 0.00 H TER 33957 WAT 1069 ATOM 33957 O WAT 1070 122.517 43.590 20.441 1.00 0.00 O ATOM 33958 H1 WAT 1070 122.278 44.115 21.205 1.00 0.00 H ATOM 33959 H2 WAT 1070 122.714 42.724 20.798 1.00 0.00 H TER 33961 WAT 1070 ATOM 33961 O WAT 1071 127.667 30.080 63.823 1.00 0.00 O ATOM 33962 H1 WAT 1071 128.108 29.315 63.453 1.00 0.00 H ATOM 33963 H2 WAT 1071 127.872 30.791 63.216 1.00 0.00 H TER 33965 WAT 1071 ATOM 33965 O WAT 1072 18.585 63.049 154.557 1.00 0.00 O ATOM 33966 H1 WAT 1072 18.554 63.506 155.397 1.00 0.00 H ATOM 33967 H2 WAT 1072 19.236 63.530 154.046 1.00 0.00 H TER 33969 WAT 1072 ATOM 33969 O WAT 1073 135.241 100.078 75.866 1.00 0.00 O ATOM 33970 H1 WAT 1073 134.366 100.466 75.849 1.00 0.00 H ATOM 33971 H2 WAT 1073 135.136 99.230 75.435 1.00 0.00 H TER 33973 WAT 1073 ATOM 33973 O WAT 1074 109.440 130.115 117.459 1.00 0.00 O ATOM 33974 H1 WAT 1074 109.788 130.733 118.101 1.00 0.00 H ATOM 33975 H2 WAT 1074 108.700 129.700 117.903 1.00 0.00 H TER 33977 WAT 1074 ATOM 33977 O WAT 1075 107.891 43.881 67.989 1.00 0.00 O ATOM 33978 H1 WAT 1075 107.000 43.645 68.244 1.00 0.00 H ATOM 33979 H2 WAT 1075 107.783 44.395 67.188 1.00 0.00 H TER 33981 WAT 1075 ATOM 33981 O WAT 1076 87.801 101.861 136.046 1.00 0.00 O ATOM 33982 H1 WAT 1076 88.381 101.898 135.285 1.00 0.00 H ATOM 33983 H2 WAT 1076 87.088 101.281 135.776 1.00 0.00 H TER 33985 WAT 1076 ATOM 33985 O WAT 1077 91.080 11.254 56.602 1.00 0.00 O ATOM 33986 H1 WAT 1077 91.616 10.720 56.017 1.00 0.00 H ATOM 33987 H2 WAT 1077 90.319 11.497 56.075 1.00 0.00 H TER 33989 WAT 1077 ATOM 33989 O WAT 1078 75.977 11.603 152.096 1.00 0.00 O ATOM 33990 H1 WAT 1078 75.928 11.132 151.264 1.00 0.00 H ATOM 33991 H2 WAT 1078 75.304 11.196 152.641 1.00 0.00 H TER 33993 WAT 1078 ATOM 33993 O WAT 1079 29.804 84.799 153.177 1.00 0.00 O ATOM 33994 H1 WAT 1079 30.001 84.087 152.569 1.00 0.00 H ATOM 33995 H2 WAT 1079 29.445 85.493 152.625 1.00 0.00 H TER 33997 WAT 1079 ATOM 33997 O WAT 1080 80.936 56.474 137.742 1.00 0.00 O ATOM 33998 H1 WAT 1080 81.737 56.237 137.274 1.00 0.00 H ATOM 33999 H2 WAT 1080 80.513 57.123 137.179 1.00 0.00 H TER 34001 WAT 1080 ATOM 34001 O WAT 1081 67.411 121.962 131.640 1.00 0.00 O ATOM 34002 H1 WAT 1081 67.717 122.185 130.761 1.00 0.00 H ATOM 34003 H2 WAT 1081 66.708 121.329 131.495 1.00 0.00 H TER 34005 WAT 1081 ATOM 34005 O WAT 1082 139.294 141.355 117.005 1.00 0.00 O ATOM 34006 H1 WAT 1082 139.712 142.201 116.846 1.00 0.00 H ATOM 34007 H2 WAT 1082 139.924 140.874 117.543 1.00 0.00 H TER 34009 WAT 1082 ATOM 34009 O WAT 1083 12.398 118.927 77.115 1.00 0.00 O ATOM 34010 H1 WAT 1083 11.756 118.580 76.495 1.00 0.00 H ATOM 34011 H2 WAT 1083 12.405 119.870 76.951 1.00 0.00 H TER 34013 WAT 1083 ATOM 34013 O WAT 1084 16.394 90.509 82.987 1.00 0.00 O ATOM 34014 H1 WAT 1084 16.351 89.672 83.449 1.00 0.00 H ATOM 34015 H2 WAT 1084 17.277 90.533 82.618 1.00 0.00 H TER 34017 WAT 1084 ATOM 34017 O WAT 1085 58.525 29.045 127.452 1.00 0.00 O ATOM 34018 H1 WAT 1085 57.629 29.338 127.613 1.00 0.00 H ATOM 34019 H2 WAT 1085 58.932 29.768 126.975 1.00 0.00 H TER 34021 WAT 1085 ATOM 34021 O WAT 1086 73.392 4.156 111.852 1.00 0.00 O ATOM 34022 H1 WAT 1086 74.025 3.438 111.854 1.00 0.00 H ATOM 34023 H2 WAT 1086 73.060 4.181 110.955 1.00 0.00 H TER 34025 WAT 1086 ATOM 34025 O WAT 1087 113.715 91.779 62.962 1.00 0.00 O ATOM 34026 H1 WAT 1087 114.505 91.245 63.040 1.00 0.00 H ATOM 34027 H2 WAT 1087 113.419 91.902 63.864 1.00 0.00 H TER 34029 WAT 1087 ATOM 34029 O WAT 1088 72.627 59.755 95.304 1.00 0.00 O ATOM 34030 H1 WAT 1088 72.448 60.627 94.951 1.00 0.00 H ATOM 34031 H2 WAT 1088 72.210 59.755 96.165 1.00 0.00 H TER 34033 WAT 1088 ATOM 34033 O WAT 1089 73.505 32.278 146.746 1.00 0.00 O ATOM 34034 H1 WAT 1089 73.988 31.937 145.993 1.00 0.00 H ATOM 34035 H2 WAT 1089 72.935 32.954 146.379 1.00 0.00 H TER 34037 WAT 1089 ATOM 34037 O WAT 1090 69.817 82.528 116.448 1.00 0.00 O ATOM 34038 H1 WAT 1090 69.549 83.446 116.419 1.00 0.00 H ATOM 34039 H2 WAT 1090 69.483 82.155 115.632 1.00 0.00 H TER 34041 WAT 1090 ATOM 34041 O WAT 1091 15.191 86.162 128.005 1.00 0.00 O ATOM 34042 H1 WAT 1091 15.633 86.854 128.497 1.00 0.00 H ATOM 34043 H2 WAT 1091 14.314 86.120 128.385 1.00 0.00 H TER 34045 WAT 1091 ATOM 34045 O WAT 1092 97.987 55.060 156.676 1.00 0.00 O ATOM 34046 H1 WAT 1092 97.670 54.271 157.116 1.00 0.00 H ATOM 34047 H2 WAT 1092 98.724 55.353 157.211 1.00 0.00 H TER 34049 WAT 1092 ATOM 34049 O WAT 1093 90.702 8.176 78.966 1.00 0.00 O ATOM 34050 H1 WAT 1093 90.289 7.375 78.642 1.00 0.00 H ATOM 34051 H2 WAT 1093 91.638 7.974 78.982 1.00 0.00 H TER 34053 WAT 1093 ATOM 34053 O WAT 1094 100.091 130.167 79.725 1.00 0.00 O ATOM 34054 H1 WAT 1094 100.837 130.635 80.100 1.00 0.00 H ATOM 34055 H2 WAT 1094 100.484 129.532 79.125 1.00 0.00 H TER 34057 WAT 1094 ATOM 34057 O WAT 1095 142.659 92.302 141.080 1.00 0.00 O ATOM 34058 H1 WAT 1095 142.416 91.990 141.952 1.00 0.00 H ATOM 34059 H2 WAT 1095 142.284 93.181 141.028 1.00 0.00 H TER 34061 WAT 1095 ATOM 34061 O WAT 1096 83.322 48.769 115.630 1.00 0.00 O ATOM 34062 H1 WAT 1096 83.705 48.632 114.763 1.00 0.00 H ATOM 34063 H2 WAT 1096 84.019 49.186 116.136 1.00 0.00 H TER 34065 WAT 1096 ATOM 34065 O WAT 1097 43.235 110.218 96.222 1.00 0.00 O ATOM 34066 H1 WAT 1097 43.589 111.021 96.604 1.00 0.00 H ATOM 34067 H2 WAT 1097 42.297 110.388 96.132 1.00 0.00 H TER 34069 WAT 1097 ATOM 34069 O WAT 1098 75.096 60.991 147.824 1.00 0.00 O ATOM 34070 H1 WAT 1098 75.423 61.572 147.137 1.00 0.00 H ATOM 34071 H2 WAT 1098 74.286 61.405 148.122 1.00 0.00 H TER 34073 WAT 1098 ATOM 34073 O WAT 1099 30.157 40.025 66.616 1.00 0.00 O ATOM 34074 H1 WAT 1099 29.357 40.457 66.913 1.00 0.00 H ATOM 34075 H2 WAT 1099 29.906 39.587 65.803 1.00 0.00 H TER 34077 WAT 1099 ATOM 34077 O WAT 1100 52.110 137.398 114.755 1.00 0.00 O ATOM 34078 H1 WAT 1100 52.750 137.975 115.172 1.00 0.00 H ATOM 34079 H2 WAT 1100 52.071 136.631 115.326 1.00 0.00 H TER 34081 WAT 1100 ATOM 34081 O WAT 1101 138.133 37.438 10.027 1.00 0.00 O ATOM 34082 H1 WAT 1101 137.910 37.898 10.837 1.00 0.00 H ATOM 34083 H2 WAT 1101 137.424 36.806 9.908 1.00 0.00 H TER 34085 WAT 1101 ATOM 34085 O WAT 1102 140.927 119.688 79.333 1.00 0.00 O ATOM 34086 H1 WAT 1102 141.768 119.243 79.232 1.00 0.00 H ATOM 34087 H2 WAT 1102 141.158 120.592 79.546 1.00 0.00 H TER 34089 WAT 1102 ATOM 34089 O WAT 1103 96.342 40.004 94.283 1.00 0.00 O ATOM 34090 H1 WAT 1103 96.441 40.786 94.827 1.00 0.00 H ATOM 34091 H2 WAT 1103 97.229 39.651 94.208 1.00 0.00 H TER 34093 WAT 1103 ATOM 34093 O WAT 1104 51.459 81.456 130.300 1.00 0.00 O ATOM 34094 H1 WAT 1104 50.934 80.930 129.697 1.00 0.00 H ATOM 34095 H2 WAT 1104 51.136 81.217 131.169 1.00 0.00 H TER 34097 WAT 1104 ATOM 34097 O WAT 1105 35.615 4.752 91.016 1.00 0.00 O ATOM 34098 H1 WAT 1105 34.787 4.308 91.199 1.00 0.00 H ATOM 34099 H2 WAT 1105 35.426 5.680 91.156 1.00 0.00 H TER 34101 WAT 1105 ATOM 34101 O WAT 1106 3.743 36.155 12.847 1.00 0.00 O ATOM 34102 H1 WAT 1106 3.160 35.584 13.348 1.00 0.00 H ATOM 34103 H2 WAT 1106 3.869 36.920 13.408 1.00 0.00 H TER 34105 WAT 1106 ATOM 34105 O WAT 1107 33.752 18.085 64.074 1.00 0.00 O ATOM 34106 H1 WAT 1107 34.187 18.272 63.242 1.00 0.00 H ATOM 34107 H2 WAT 1107 34.448 17.746 64.636 1.00 0.00 H TER 34109 WAT 1107 ATOM 34109 O WAT 1108 24.724 72.825 9.344 1.00 0.00 O ATOM 34110 H1 WAT 1108 25.487 73.379 9.178 1.00 0.00 H ATOM 34111 H2 WAT 1108 24.103 73.060 8.655 1.00 0.00 H TER 34113 WAT 1108 ATOM 34113 O WAT 1109 31.860 120.834 96.996 1.00 0.00 O ATOM 34114 H1 WAT 1109 32.044 121.250 96.153 1.00 0.00 H ATOM 34115 H2 WAT 1109 31.137 121.343 97.361 1.00 0.00 H TER 34117 WAT 1109 ATOM 34117 O WAT 1110 126.198 63.959 81.774 1.00 0.00 O ATOM 34118 H1 WAT 1110 126.504 64.712 82.278 1.00 0.00 H ATOM 34119 H2 WAT 1110 126.564 64.091 80.900 1.00 0.00 H TER 34121 WAT 1110 ATOM 34121 O WAT 1111 3.868 24.577 64.956 1.00 0.00 O ATOM 34122 H1 WAT 1111 3.147 23.975 65.143 1.00 0.00 H ATOM 34123 H2 WAT 1111 4.017 24.487 64.015 1.00 0.00 H TER 34125 WAT 1111 ATOM 34125 O WAT 1112 55.944 129.926 66.428 1.00 0.00 O ATOM 34126 H1 WAT 1112 55.950 130.775 65.987 1.00 0.00 H ATOM 34127 H2 WAT 1112 55.038 129.813 66.718 1.00 0.00 H TER 34129 WAT 1112 ATOM 34129 O WAT 1113 38.572 135.786 84.102 1.00 0.00 O ATOM 34130 H1 WAT 1113 39.216 135.924 84.796 1.00 0.00 H ATOM 34131 H2 WAT 1113 38.031 136.575 84.117 1.00 0.00 H TER 34133 WAT 1113 ATOM 34133 O WAT 1114 4.058 128.103 110.057 1.00 0.00 O ATOM 34134 H1 WAT 1114 3.538 127.478 109.553 1.00 0.00 H ATOM 34135 H2 WAT 1114 4.309 127.624 110.847 1.00 0.00 H TER 34137 WAT 1114 ATOM 34137 O WAT 1115 114.156 140.892 134.044 1.00 0.00 O ATOM 34138 H1 WAT 1115 114.739 140.950 134.801 1.00 0.00 H ATOM 34139 H2 WAT 1115 114.232 141.745 133.618 1.00 0.00 H TER 34141 WAT 1115 ATOM 34141 O WAT 1116 27.291 55.596 109.767 1.00 0.00 O ATOM 34142 H1 WAT 1116 28.218 55.787 109.630 1.00 0.00 H ATOM 34143 H2 WAT 1116 27.274 55.028 110.537 1.00 0.00 H TER 34145 WAT 1116 ATOM 34145 O WAT 1117 101.558 39.535 128.271 1.00 0.00 O ATOM 34146 H1 WAT 1117 101.445 40.479 128.379 1.00 0.00 H ATOM 34147 H2 WAT 1117 100.983 39.147 128.930 1.00 0.00 H TER 34149 WAT 1117 ATOM 34149 O WAT 1118 105.283 136.764 75.440 1.00 0.00 O ATOM 34150 H1 WAT 1118 105.425 136.058 76.070 1.00 0.00 H ATOM 34151 H2 WAT 1118 105.810 137.491 75.772 1.00 0.00 H TER 34153 WAT 1118 ATOM 34153 O WAT 1119 76.647 106.015 0.247 1.00 0.00 O ATOM 34154 H1 WAT 1119 77.353 105.473 0.597 1.00 0.00 H ATOM 34155 H2 WAT 1119 76.501 105.677 -0.637 1.00 0.00 H TER 34157 WAT 1119 ATOM 34157 O WAT 1120 142.248 86.476 90.834 1.00 0.00 O ATOM 34158 H1 WAT 1120 143.060 86.691 91.293 1.00 0.00 H ATOM 34159 H2 WAT 1120 142.326 85.544 90.633 1.00 0.00 H TER 34161 WAT 1120 ATOM 34161 O WAT 1121 65.468 129.445 108.629 1.00 0.00 O ATOM 34162 H1 WAT 1121 66.179 130.085 108.618 1.00 0.00 H ATOM 34163 H2 WAT 1121 65.542 129.019 109.482 1.00 0.00 H TER 34165 WAT 1121 ATOM 34165 O WAT 1122 98.987 23.726 1.032 1.00 0.00 O ATOM 34166 H1 WAT 1122 98.087 23.920 1.293 1.00 0.00 H ATOM 34167 H2 WAT 1122 98.919 23.466 0.113 1.00 0.00 H TER 34169 WAT 1122 ATOM 34169 O WAT 1123 42.769 11.215 97.261 1.00 0.00 O ATOM 34170 H1 WAT 1123 42.462 10.587 96.607 1.00 0.00 H ATOM 34171 H2 WAT 1123 43.720 11.222 97.159 1.00 0.00 H TER 34173 WAT 1123 ATOM 34173 O WAT 1124 45.456 103.995 150.987 1.00 0.00 O ATOM 34174 H1 WAT 1124 45.869 104.279 150.172 1.00 0.00 H ATOM 34175 H2 WAT 1124 45.131 104.803 151.385 1.00 0.00 H TER 34177 WAT 1124 ATOM 34177 O WAT 1125 33.287 91.917 115.420 1.00 0.00 O ATOM 34178 H1 WAT 1125 34.242 91.972 115.460 1.00 0.00 H ATOM 34179 H2 WAT 1125 33.106 90.984 115.304 1.00 0.00 H TER 34181 WAT 1125 ATOM 34181 O WAT 1126 19.779 105.733 0.228 1.00 0.00 O ATOM 34182 H1 WAT 1126 19.849 106.005 1.143 1.00 0.00 H ATOM 34183 H2 WAT 1126 19.660 106.549 -0.257 1.00 0.00 H TER 34185 WAT 1126 ATOM 34185 O WAT 1127 96.997 120.217 143.316 1.00 0.00 O ATOM 34186 H1 WAT 1127 96.296 120.139 142.669 1.00 0.00 H ATOM 34187 H2 WAT 1127 97.519 120.960 143.015 1.00 0.00 H TER 34189 WAT 1127 ATOM 34189 O WAT 1128 95.895 128.212 122.593 1.00 0.00 O ATOM 34190 H1 WAT 1128 95.291 128.936 122.430 1.00 0.00 H ATOM 34191 H2 WAT 1128 95.333 127.490 122.875 1.00 0.00 H TER 34193 WAT 1128 ATOM 34193 O WAT 1129 133.119 59.010 81.422 1.00 0.00 O ATOM 34194 H1 WAT 1129 133.077 58.934 82.375 1.00 0.00 H ATOM 34195 H2 WAT 1129 133.936 58.572 81.182 1.00 0.00 H TER 34197 WAT 1129 ATOM 34197 O WAT 1130 86.199 110.450 8.317 1.00 0.00 O ATOM 34198 H1 WAT 1130 85.805 111.221 7.907 1.00 0.00 H ATOM 34199 H2 WAT 1130 85.593 109.737 8.117 1.00 0.00 H TER 34201 WAT 1130 ATOM 34201 O WAT 1131 108.500 51.090 86.227 1.00 0.00 O ATOM 34202 H1 WAT 1131 108.828 50.362 85.700 1.00 0.00 H ATOM 34203 H2 WAT 1131 107.572 51.150 86.001 1.00 0.00 H TER 34205 WAT 1131 ATOM 34205 O WAT 1132 102.213 131.289 73.954 1.00 0.00 O ATOM 34206 H1 WAT 1132 101.788 131.819 74.628 1.00 0.00 H ATOM 34207 H2 WAT 1132 102.903 130.818 74.421 1.00 0.00 H TER 34209 WAT 1132 ATOM 34209 O WAT 1133 101.241 11.717 9.131 1.00 0.00 O ATOM 34210 H1 WAT 1133 101.571 11.520 8.255 1.00 0.00 H ATOM 34211 H2 WAT 1133 100.336 11.996 8.989 1.00 0.00 H TER 34213 WAT 1133 ATOM 34213 O WAT 1134 138.484 29.443 14.946 1.00 0.00 O ATOM 34214 H1 WAT 1134 138.059 30.285 14.777 1.00 0.00 H ATOM 34215 H2 WAT 1134 139.405 29.593 14.733 1.00 0.00 H TER 34217 WAT 1134 ATOM 34217 O WAT 1135 141.481 115.727 79.578 1.00 0.00 O ATOM 34218 H1 WAT 1135 140.929 115.587 78.808 1.00 0.00 H ATOM 34219 H2 WAT 1135 140.932 116.230 80.178 1.00 0.00 H TER 34221 WAT 1135 ATOM 34221 O WAT 1136 93.709 143.727 96.826 1.00 0.00 O ATOM 34222 H1 WAT 1136 93.240 143.475 96.030 1.00 0.00 H ATOM 34223 H2 WAT 1136 93.350 144.584 97.054 1.00 0.00 H TER 34225 WAT 1136 ATOM 34225 O WAT 1137 74.623 106.614 65.336 1.00 0.00 O ATOM 34226 H1 WAT 1137 73.716 106.598 65.033 1.00 0.00 H ATOM 34227 H2 WAT 1137 74.628 106.051 66.109 1.00 0.00 H TER 34229 WAT 1137 ATOM 34229 O WAT 1138 0.487 3.051 4.671 1.00 0.00 O ATOM 34230 H1 WAT 1138 1.151 3.728 4.799 1.00 0.00 H ATOM 34231 H2 WAT 1138 0.628 2.437 5.392 1.00 0.00 H TER 34233 WAT 1138 ATOM 34233 O WAT 1139 2.379 132.865 153.178 1.00 0.00 O ATOM 34234 H1 WAT 1139 2.861 132.948 154.001 1.00 0.00 H ATOM 34235 H2 WAT 1139 1.684 133.519 153.241 1.00 0.00 H TER 34237 WAT 1139 ATOM 34237 O WAT 1140 20.394 49.172 156.135 1.00 0.00 O ATOM 34238 H1 WAT 1140 19.902 49.968 156.336 1.00 0.00 H ATOM 34239 H2 WAT 1140 20.975 49.424 155.418 1.00 0.00 H TER 34241 WAT 1140 ATOM 34241 O WAT 1141 135.296 58.481 92.829 1.00 0.00 O ATOM 34242 H1 WAT 1141 134.984 58.925 93.617 1.00 0.00 H ATOM 34243 H2 WAT 1141 135.830 57.757 93.157 1.00 0.00 H TER 34245 WAT 1141 ATOM 34245 O WAT 1142 139.754 131.681 84.818 1.00 0.00 O ATOM 34246 H1 WAT 1142 139.818 132.000 83.917 1.00 0.00 H ATOM 34247 H2 WAT 1142 140.259 132.312 85.331 1.00 0.00 H TER 34249 WAT 1142 ATOM 34249 O WAT 1143 42.333 6.420 147.514 1.00 0.00 O ATOM 34250 H1 WAT 1143 43.270 6.483 147.329 1.00 0.00 H ATOM 34251 H2 WAT 1143 42.029 7.327 147.525 1.00 0.00 H TER 34253 WAT 1143 ATOM 34253 O WAT 1144 145.309 138.334 1.100 1.00 0.00 O ATOM 34254 H1 WAT 1144 146.091 138.583 0.607 1.00 0.00 H ATOM 34255 H2 WAT 1144 144.651 138.152 0.429 1.00 0.00 H TER 34257 WAT 1144 ATOM 34257 O WAT 1145 80.222 72.051 73.357 1.00 0.00 O ATOM 34258 H1 WAT 1145 80.899 72.679 73.104 1.00 0.00 H ATOM 34259 H2 WAT 1145 79.681 72.523 73.989 1.00 0.00 H TER 34261 WAT 1145 ATOM 34261 O WAT 1146 131.263 104.603 87.790 1.00 0.00 O ATOM 34262 H1 WAT 1146 131.803 104.077 87.201 1.00 0.00 H ATOM 34263 H2 WAT 1146 131.518 105.507 87.605 1.00 0.00 H TER 34265 WAT 1146 ATOM 34265 O WAT 1147 97.312 75.848 2.869 1.00 0.00 O ATOM 34266 H1 WAT 1147 97.415 76.797 2.803 1.00 0.00 H ATOM 34267 H2 WAT 1147 96.703 75.623 2.165 1.00 0.00 H TER 34269 WAT 1147 ATOM 34269 O WAT 1148 16.032 75.933 136.564 1.00 0.00 O ATOM 34270 H1 WAT 1148 15.305 75.452 136.960 1.00 0.00 H ATOM 34271 H2 WAT 1148 16.070 76.755 137.054 1.00 0.00 H TER 34273 WAT 1148 ATOM 34273 O WAT 1149 141.720 105.462 87.761 1.00 0.00 O ATOM 34274 H1 WAT 1149 142.333 105.495 88.496 1.00 0.00 H ATOM 34275 H2 WAT 1149 142.105 106.040 87.103 1.00 0.00 H TER 34277 WAT 1149 ATOM 34277 O WAT 1150 55.041 139.327 17.294 1.00 0.00 O ATOM 34278 H1 WAT 1150 55.136 138.976 18.179 1.00 0.00 H ATOM 34279 H2 WAT 1150 55.329 140.237 17.366 1.00 0.00 H TER 34281 WAT 1150 ATOM 34281 O WAT 1151 28.865 66.886 12.306 1.00 0.00 O ATOM 34282 H1 WAT 1151 29.770 66.931 11.997 1.00 0.00 H ATOM 34283 H2 WAT 1151 28.355 66.679 11.523 1.00 0.00 H TER 34285 WAT 1151 ATOM 34285 O WAT 1152 24.795 36.377 63.575 1.00 0.00 O ATOM 34286 H1 WAT 1152 25.676 36.705 63.397 1.00 0.00 H ATOM 34287 H2 WAT 1152 24.399 36.271 62.710 1.00 0.00 H TER 34289 WAT 1152 ATOM 34289 O WAT 1153 91.547 121.172 112.297 1.00 0.00 O ATOM 34290 H1 WAT 1153 91.720 121.578 113.147 1.00 0.00 H ATOM 34291 H2 WAT 1153 91.304 121.903 111.728 1.00 0.00 H TER 34293 WAT 1153 ATOM 34293 O WAT 1154 51.314 69.154 145.383 1.00 0.00 O ATOM 34294 H1 WAT 1154 51.070 69.026 146.300 1.00 0.00 H ATOM 34295 H2 WAT 1154 51.360 68.269 145.022 1.00 0.00 H TER 34297 WAT 1154 ATOM 34297 O WAT 1155 66.436 110.554 84.106 1.00 0.00 O ATOM 34298 H1 WAT 1155 66.489 109.904 83.405 1.00 0.00 H ATOM 34299 H2 WAT 1155 67.234 110.421 84.617 1.00 0.00 H TER 34301 WAT 1155 ATOM 34301 O WAT 1156 0.953 95.059 62.821 1.00 0.00 O ATOM 34302 H1 WAT 1156 0.020 95.272 62.833 1.00 0.00 H ATOM 34303 H2 WAT 1156 1.283 95.474 62.024 1.00 0.00 H TER 34305 WAT 1156 ATOM 34305 O WAT 1157 78.257 19.850 17.873 1.00 0.00 O ATOM 34306 H1 WAT 1157 77.576 20.208 17.304 1.00 0.00 H ATOM 34307 H2 WAT 1157 78.418 18.970 17.530 1.00 0.00 H TER 34309 WAT 1157 ATOM 34309 O WAT 1158 11.860 17.979 132.595 1.00 0.00 O ATOM 34310 H1 WAT 1158 11.871 18.873 132.937 1.00 0.00 H ATOM 34311 H2 WAT 1158 12.144 17.437 133.331 1.00 0.00 H TER 34313 WAT 1158 ATOM 34313 O WAT 1159 62.212 119.611 72.468 1.00 0.00 O ATOM 34314 H1 WAT 1159 62.889 119.570 71.792 1.00 0.00 H ATOM 34315 H2 WAT 1159 62.677 119.422 73.283 1.00 0.00 H TER 34317 WAT 1159 ATOM 34317 O WAT 1160 114.063 8.475 15.349 1.00 0.00 O ATOM 34318 H1 WAT 1160 113.650 8.147 14.551 1.00 0.00 H ATOM 34319 H2 WAT 1160 114.970 8.650 15.095 1.00 0.00 H TER 34321 WAT 1160 ATOM 34321 O WAT 1161 2.080 27.664 146.844 1.00 0.00 O ATOM 34322 H1 WAT 1161 1.374 28.292 146.688 1.00 0.00 H ATOM 34323 H2 WAT 1161 2.880 28.145 146.633 1.00 0.00 H TER 34325 WAT 1161 ATOM 34325 O WAT 1162 17.265 145.853 71.039 1.00 0.00 O ATOM 34326 H1 WAT 1162 18.214 145.737 71.081 1.00 0.00 H ATOM 34327 H2 WAT 1162 16.921 145.261 71.708 1.00 0.00 H TER 34329 WAT 1162 ATOM 34329 O WAT 1163 50.108 28.682 1.709 1.00 0.00 O ATOM 34330 H1 WAT 1163 49.869 29.175 2.494 1.00 0.00 H ATOM 34331 H2 WAT 1163 49.602 27.872 1.771 1.00 0.00 H TER 34333 WAT 1163 ATOM 34333 O WAT 1164 65.255 20.529 124.565 1.00 0.00 O ATOM 34334 H1 WAT 1164 64.726 19.826 124.941 1.00 0.00 H ATOM 34335 H2 WAT 1164 64.619 21.110 124.148 1.00 0.00 H TER 34337 WAT 1164 ATOM 34337 O WAT 1165 104.408 134.221 69.261 1.00 0.00 O ATOM 34338 H1 WAT 1165 104.581 134.565 70.138 1.00 0.00 H ATOM 34339 H2 WAT 1165 105.212 134.396 68.772 1.00 0.00 H TER 34341 WAT 1165 ATOM 34341 O WAT 1166 92.828 119.098 91.630 1.00 0.00 O ATOM 34342 H1 WAT 1166 93.703 119.006 92.005 1.00 0.00 H ATOM 34343 H2 WAT 1166 92.707 118.307 91.105 1.00 0.00 H TER 34345 WAT 1166 ATOM 34345 O WAT 1167 65.607 35.851 79.769 1.00 0.00 O ATOM 34346 H1 WAT 1167 65.235 35.568 80.604 1.00 0.00 H ATOM 34347 H2 WAT 1167 64.872 35.823 79.157 1.00 0.00 H TER 34349 WAT 1167 ATOM 34349 O WAT 1168 17.170 0.725 132.707 1.00 0.00 O ATOM 34350 H1 WAT 1168 17.517 1.546 132.356 1.00 0.00 H ATOM 34351 H2 WAT 1168 16.941 0.930 133.613 1.00 0.00 H TER 34353 WAT 1168 ATOM 34353 O WAT 1169 74.667 103.744 112.316 1.00 0.00 O ATOM 34354 H1 WAT 1169 75.026 102.857 112.288 1.00 0.00 H ATOM 34355 H2 WAT 1169 75.180 104.231 111.671 1.00 0.00 H TER 34357 WAT 1169 ATOM 34357 O WAT 1170 82.473 126.572 11.371 1.00 0.00 O ATOM 34358 H1 WAT 1170 82.111 127.435 11.171 1.00 0.00 H ATOM 34359 H2 WAT 1170 82.106 126.351 12.227 1.00 0.00 H TER 34361 WAT 1170 ATOM 34361 O WAT 1171 42.850 107.284 143.753 1.00 0.00 O ATOM 34362 H1 WAT 1171 42.695 107.446 144.684 1.00 0.00 H ATOM 34363 H2 WAT 1171 42.479 106.415 143.596 1.00 0.00 H TER 34365 WAT 1171 ATOM 34365 O WAT 1172 128.112 3.987 114.776 1.00 0.00 O ATOM 34366 H1 WAT 1172 127.931 3.899 113.840 1.00 0.00 H ATOM 34367 H2 WAT 1172 127.536 4.695 115.066 1.00 0.00 H TER 34369 WAT 1172 ATOM 34369 O WAT 1173 139.860 100.245 108.257 1.00 0.00 O ATOM 34370 H1 WAT 1173 139.633 100.900 108.917 1.00 0.00 H ATOM 34371 H2 WAT 1173 140.745 100.480 107.980 1.00 0.00 H TER 34373 WAT 1173 ATOM 34373 O WAT 1174 7.726 124.346 7.194 1.00 0.00 O ATOM 34374 H1 WAT 1174 8.224 124.830 6.535 1.00 0.00 H ATOM 34375 H2 WAT 1174 7.398 125.020 7.789 1.00 0.00 H TER 34377 WAT 1174 ATOM 34377 O WAT 1175 12.380 40.595 6.540 1.00 0.00 O ATOM 34378 H1 WAT 1175 11.670 40.216 6.021 1.00 0.00 H ATOM 34379 H2 WAT 1175 13.095 40.714 5.915 1.00 0.00 H TER 34381 WAT 1175 ATOM 34381 O WAT 1176 4.729 9.698 21.665 1.00 0.00 O ATOM 34382 H1 WAT 1176 3.955 9.925 21.149 1.00 0.00 H ATOM 34383 H2 WAT 1176 5.311 9.261 21.043 1.00 0.00 H TER 34385 WAT 1176 ATOM 34385 O WAT 1177 36.400 71.200 4.178 1.00 0.00 O ATOM 34386 H1 WAT 1177 35.694 70.734 3.729 1.00 0.00 H ATOM 34387 H2 WAT 1177 36.254 72.121 3.961 1.00 0.00 H TER 34389 WAT 1177 ATOM 34389 O WAT 1178 5.265 111.214 99.954 1.00 0.00 O ATOM 34390 H1 WAT 1178 4.656 111.455 99.256 1.00 0.00 H ATOM 34391 H2 WAT 1178 5.938 111.894 99.929 1.00 0.00 H TER 34393 WAT 1178 ATOM 34393 O WAT 1179 33.821 98.902 88.286 1.00 0.00 O ATOM 34394 H1 WAT 1179 33.468 98.692 87.421 1.00 0.00 H ATOM 34395 H2 WAT 1179 33.379 98.293 88.878 1.00 0.00 H TER 34397 WAT 1179 ATOM 34397 O WAT 1180 143.938 101.753 142.903 1.00 0.00 O ATOM 34398 H1 WAT 1180 144.326 100.890 143.047 1.00 0.00 H ATOM 34399 H2 WAT 1180 144.593 102.227 142.391 1.00 0.00 H TER 34401 WAT 1180 ATOM 34401 O WAT 1181 101.734 133.016 92.704 1.00 0.00 O ATOM 34402 H1 WAT 1181 101.900 133.803 93.222 1.00 0.00 H ATOM 34403 H2 WAT 1181 101.194 132.465 93.271 1.00 0.00 H TER 34405 WAT 1181 ATOM 34405 O WAT 1182 65.144 18.236 77.700 1.00 0.00 O ATOM 34406 H1 WAT 1182 64.866 17.811 76.888 1.00 0.00 H ATOM 34407 H2 WAT 1182 66.088 18.353 77.597 1.00 0.00 H TER 34409 WAT 1182 ATOM 34409 O WAT 1183 144.557 92.767 77.751 1.00 0.00 O ATOM 34410 H1 WAT 1183 144.782 92.769 76.821 1.00 0.00 H ATOM 34411 H2 WAT 1183 145.330 92.405 78.185 1.00 0.00 H TER 34413 WAT 1183 ATOM 34413 O WAT 1184 110.708 125.515 134.706 1.00 0.00 O ATOM 34414 H1 WAT 1184 111.389 125.703 134.060 1.00 0.00 H ATOM 34415 H2 WAT 1184 110.014 125.089 134.204 1.00 0.00 H TER 34417 WAT 1184 ATOM 34417 O WAT 1185 34.432 23.072 89.104 1.00 0.00 O ATOM 34418 H1 WAT 1185 34.708 23.646 89.819 1.00 0.00 H ATOM 34419 H2 WAT 1185 35.013 22.314 89.168 1.00 0.00 H TER 34421 WAT 1185 ATOM 34421 O WAT 1186 75.287 63.017 11.347 1.00 0.00 O ATOM 34422 H1 WAT 1186 75.744 63.032 12.188 1.00 0.00 H ATOM 34423 H2 WAT 1186 74.983 63.916 11.224 1.00 0.00 H TER 34425 WAT 1186 ATOM 34425 O WAT 1187 139.609 140.255 106.321 1.00 0.00 O ATOM 34426 H1 WAT 1187 139.792 139.361 106.609 1.00 0.00 H ATOM 34427 H2 WAT 1187 140.089 140.344 105.497 1.00 0.00 H TER 34429 WAT 1187 ATOM 34429 O WAT 1188 59.514 52.883 143.043 1.00 0.00 O ATOM 34430 H1 WAT 1188 59.562 53.669 142.500 1.00 0.00 H ATOM 34431 H2 WAT 1188 59.871 53.153 143.889 1.00 0.00 H TER 34433 WAT 1188 ATOM 34433 O WAT 1189 126.159 12.559 10.857 1.00 0.00 O ATOM 34434 H1 WAT 1189 126.279 12.029 11.645 1.00 0.00 H ATOM 34435 H2 WAT 1189 125.228 12.780 10.856 1.00 0.00 H TER 34437 WAT 1189 ATOM 34437 O WAT 1190 85.038 96.650 85.752 1.00 0.00 O ATOM 34438 H1 WAT 1190 85.334 95.741 85.713 1.00 0.00 H ATOM 34439 H2 WAT 1190 85.039 96.942 84.840 1.00 0.00 H TER 34441 WAT 1190 ATOM 34441 O WAT 1191 102.274 52.108 13.081 1.00 0.00 O ATOM 34442 H1 WAT 1191 102.680 52.974 13.108 1.00 0.00 H ATOM 34443 H2 WAT 1191 101.341 52.275 13.218 1.00 0.00 H TER 34445 WAT 1191 ATOM 34445 O WAT 1192 59.424 43.442 129.024 1.00 0.00 O ATOM 34446 H1 WAT 1192 59.761 43.920 129.781 1.00 0.00 H ATOM 34447 H2 WAT 1192 60.175 42.945 128.700 1.00 0.00 H TER 34449 WAT 1192 ATOM 34449 O WAT 1193 109.827 89.967 121.220 1.00 0.00 O ATOM 34450 H1 WAT 1193 109.175 90.402 120.669 1.00 0.00 H ATOM 34451 H2 WAT 1193 109.318 89.361 121.758 1.00 0.00 H TER 34453 WAT 1193 ATOM 34453 O WAT 1194 114.800 30.156 125.869 1.00 0.00 O ATOM 34454 H1 WAT 1194 114.658 30.106 126.814 1.00 0.00 H ATOM 34455 H2 WAT 1194 114.544 29.293 125.542 1.00 0.00 H TER 34457 WAT 1194 ATOM 34457 O WAT 1195 93.920 2.275 133.001 1.00 0.00 O ATOM 34458 H1 WAT 1195 93.179 1.670 133.022 1.00 0.00 H ATOM 34459 H2 WAT 1195 93.952 2.583 132.095 1.00 0.00 H TER 34461 WAT 1195 ATOM 34461 O WAT 1196 98.070 1.259 3.047 1.00 0.00 O ATOM 34462 H1 WAT 1196 98.676 0.563 3.301 1.00 0.00 H ATOM 34463 H2 WAT 1196 97.472 0.842 2.428 1.00 0.00 H TER 34465 WAT 1196 ATOM 34465 O WAT 1197 2.764 64.269 7.455 1.00 0.00 O ATOM 34466 H1 WAT 1197 2.184 65.015 7.608 1.00 0.00 H ATOM 34467 H2 WAT 1197 2.890 63.882 8.321 1.00 0.00 H TER 34469 WAT 1197 ATOM 34469 O WAT 1198 144.935 12.870 120.206 1.00 0.00 O ATOM 34470 H1 WAT 1198 145.419 12.973 121.025 1.00 0.00 H ATOM 34471 H2 WAT 1198 144.341 13.620 120.183 1.00 0.00 H TER 34473 WAT 1198 ATOM 34473 O WAT 1199 46.957 6.258 127.844 1.00 0.00 O ATOM 34474 H1 WAT 1199 47.199 6.170 128.766 1.00 0.00 H ATOM 34475 H2 WAT 1199 46.100 6.682 127.860 1.00 0.00 H TER 34477 WAT 1199 ATOM 34477 O WAT 1200 4.225 70.631 136.332 1.00 0.00 O ATOM 34478 H1 WAT 1200 3.453 70.853 136.852 1.00 0.00 H ATOM 34479 H2 WAT 1200 4.697 69.992 136.865 1.00 0.00 H TER 34481 WAT 1200 ATOM 34481 O WAT 1201 69.327 127.969 139.386 1.00 0.00 O ATOM 34482 H1 WAT 1201 68.466 127.802 139.004 1.00 0.00 H ATOM 34483 H2 WAT 1201 69.143 128.214 140.293 1.00 0.00 H TER 34485 WAT 1201 ATOM 34485 O WAT 1202 36.875 10.577 125.426 1.00 0.00 O ATOM 34486 H1 WAT 1202 36.128 10.519 124.831 1.00 0.00 H ATOM 34487 H2 WAT 1202 36.702 9.913 126.094 1.00 0.00 H TER 34489 WAT 1202 ATOM 34489 O WAT 1203 22.806 144.064 124.402 1.00 0.00 O ATOM 34490 H1 WAT 1203 21.991 144.566 124.427 1.00 0.00 H ATOM 34491 H2 WAT 1203 23.207 144.216 125.258 1.00 0.00 H TER 34493 WAT 1203 ATOM 34493 O WAT 1204 135.372 108.006 18.659 1.00 0.00 O ATOM 34494 H1 WAT 1204 134.446 107.787 18.556 1.00 0.00 H ATOM 34495 H2 WAT 1204 135.595 108.486 17.862 1.00 0.00 H TER 34497 WAT 1204 ATOM 34497 O WAT 1205 63.614 119.518 19.827 1.00 0.00 O ATOM 34498 H1 WAT 1205 64.179 120.246 20.087 1.00 0.00 H ATOM 34499 H2 WAT 1205 62.757 119.736 20.194 1.00 0.00 H TER 34501 WAT 1205 ATOM 34501 O WAT 1206 56.940 135.294 21.530 1.00 0.00 O ATOM 34502 H1 WAT 1206 56.259 135.922 21.772 1.00 0.00 H ATOM 34503 H2 WAT 1206 56.488 134.647 20.990 1.00 0.00 H TER 34505 WAT 1206 ATOM 34505 O WAT 1207 10.792 115.132 90.849 1.00 0.00 O ATOM 34506 H1 WAT 1207 11.189 115.378 90.014 1.00 0.00 H ATOM 34507 H2 WAT 1207 11.441 114.563 91.264 1.00 0.00 H TER 34509 WAT 1207 ATOM 34509 O WAT 1208 44.620 109.228 151.490 1.00 0.00 O ATOM 34510 H1 WAT 1208 44.047 109.779 150.957 1.00 0.00 H ATOM 34511 H2 WAT 1208 45.016 109.831 152.119 1.00 0.00 H TER 34513 WAT 1208 ATOM 34513 O WAT 1209 51.712 9.197 134.357 1.00 0.00 O ATOM 34514 H1 WAT 1209 52.310 9.770 133.878 1.00 0.00 H ATOM 34515 H2 WAT 1209 51.628 8.421 133.804 1.00 0.00 H TER 34517 WAT 1209 ATOM 34517 O WAT 1210 125.157 59.006 82.226 1.00 0.00 O ATOM 34518 H1 WAT 1210 125.922 59.518 82.491 1.00 0.00 H ATOM 34519 H2 WAT 1210 124.545 59.094 82.955 1.00 0.00 H TER 34521 WAT 1210 ATOM 34521 O WAT 1211 108.083 7.464 73.985 1.00 0.00 O ATOM 34522 H1 WAT 1211 108.853 8.033 74.011 1.00 0.00 H ATOM 34523 H2 WAT 1211 107.403 7.961 74.441 1.00 0.00 H TER 34525 WAT 1211 ATOM 34525 O WAT 1212 31.801 139.903 9.434 1.00 0.00 O ATOM 34526 H1 WAT 1212 31.298 139.089 9.445 1.00 0.00 H ATOM 34527 H2 WAT 1212 32.489 139.768 10.086 1.00 0.00 H TER 34529 WAT 1212 ATOM 34529 O WAT 1213 2.364 39.223 106.718 1.00 0.00 O ATOM 34530 H1 WAT 1213 1.675 38.658 106.368 1.00 0.00 H ATOM 34531 H2 WAT 1213 2.948 38.626 107.186 1.00 0.00 H TER 34533 WAT 1213 ATOM 34533 O WAT 1214 11.523 138.874 103.769 1.00 0.00 O ATOM 34534 H1 WAT 1214 11.538 139.820 103.918 1.00 0.00 H ATOM 34535 H2 WAT 1214 10.829 138.553 104.345 1.00 0.00 H TER 34537 WAT 1214 ATOM 34537 O WAT 1215 57.133 100.977 97.119 1.00 0.00 O ATOM 34538 H1 WAT 1215 56.278 101.077 97.540 1.00 0.00 H ATOM 34539 H2 WAT 1215 57.600 100.351 97.672 1.00 0.00 H TER 34541 WAT 1215 ATOM 34541 O WAT 1216 4.592 123.036 73.564 1.00 0.00 O ATOM 34542 H1 WAT 1216 4.588 122.477 74.341 1.00 0.00 H ATOM 34543 H2 WAT 1216 3.684 123.325 73.472 1.00 0.00 H TER 34545 WAT 1216 ATOM 34545 O WAT 1217 77.354 122.656 11.194 1.00 0.00 O ATOM 34546 H1 WAT 1217 77.365 123.047 10.320 1.00 0.00 H ATOM 34547 H2 WAT 1217 76.696 123.159 11.674 1.00 0.00 H TER 34549 WAT 1217 ATOM 34549 O WAT 1218 37.922 77.962 138.754 1.00 0.00 O ATOM 34550 H1 WAT 1218 37.921 77.952 137.797 1.00 0.00 H ATOM 34551 H2 WAT 1218 37.182 78.523 138.988 1.00 0.00 H TER 34553 WAT 1218 ATOM 34553 O WAT 1219 15.047 128.893 78.770 1.00 0.00 O ATOM 34554 H1 WAT 1219 14.962 127.939 78.776 1.00 0.00 H ATOM 34555 H2 WAT 1219 14.863 129.155 79.672 1.00 0.00 H TER 34557 WAT 1219 ATOM 34557 O WAT 1220 117.070 45.915 7.780 1.00 0.00 O ATOM 34558 H1 WAT 1220 117.990 46.082 7.578 1.00 0.00 H ATOM 34559 H2 WAT 1220 117.092 45.254 8.472 1.00 0.00 H TER 34561 WAT 1220 ATOM 34561 O WAT 1221 100.566 27.351 125.181 1.00 0.00 O ATOM 34562 H1 WAT 1221 100.506 26.903 124.338 1.00 0.00 H ATOM 34563 H2 WAT 1221 101.477 27.641 125.234 1.00 0.00 H TER 34565 WAT 1221 ATOM 34565 O WAT 1222 26.867 136.921 70.641 1.00 0.00 O ATOM 34566 H1 WAT 1222 27.272 137.755 70.879 1.00 0.00 H ATOM 34567 H2 WAT 1222 26.644 137.018 69.715 1.00 0.00 H TER 34569 WAT 1222 ATOM 34569 O WAT 1223 89.143 103.820 12.067 1.00 0.00 O ATOM 34570 H1 WAT 1223 89.900 103.439 11.622 1.00 0.00 H ATOM 34571 H2 WAT 1223 89.505 104.538 12.585 1.00 0.00 H TER 34573 WAT 1223 ATOM 34573 O WAT 1224 134.109 105.017 142.624 1.00 0.00 O ATOM 34574 H1 WAT 1224 134.486 105.424 143.404 1.00 0.00 H ATOM 34575 H2 WAT 1224 134.513 105.482 141.892 1.00 0.00 H TER 34577 WAT 1224 ATOM 34577 O WAT 1225 61.200 110.820 96.268 1.00 0.00 O ATOM 34578 H1 WAT 1225 61.332 110.043 96.812 1.00 0.00 H ATOM 34579 H2 WAT 1225 60.264 111.005 96.339 1.00 0.00 H TER 34581 WAT 1225 ATOM 34581 O WAT 1226 22.419 106.293 101.223 1.00 0.00 O ATOM 34582 H1 WAT 1226 21.591 106.063 100.800 1.00 0.00 H ATOM 34583 H2 WAT 1226 22.432 105.770 102.024 1.00 0.00 H TER 34585 WAT 1226 ATOM 34585 O WAT 1227 6.333 64.044 72.368 1.00 0.00 O ATOM 34586 H1 WAT 1227 6.989 64.654 72.703 1.00 0.00 H ATOM 34587 H2 WAT 1227 6.426 63.266 72.919 1.00 0.00 H TER 34589 WAT 1227 ATOM 34589 O WAT 1228 24.839 95.058 112.802 1.00 0.00 O ATOM 34590 H1 WAT 1228 25.439 95.711 113.162 1.00 0.00 H ATOM 34591 H2 WAT 1228 24.243 95.561 112.247 1.00 0.00 H TER 34593 WAT 1228 ATOM 34593 O WAT 1229 136.397 29.968 115.212 1.00 0.00 O ATOM 34594 H1 WAT 1229 136.465 29.091 115.588 1.00 0.00 H ATOM 34595 H2 WAT 1229 137.099 30.464 115.633 1.00 0.00 H TER 34597 WAT 1229 ATOM 34597 O WAT 1230 12.412 66.171 75.892 1.00 0.00 O ATOM 34598 H1 WAT 1230 12.805 66.949 75.494 1.00 0.00 H ATOM 34599 H2 WAT 1230 12.501 65.491 75.225 1.00 0.00 H TER 34601 WAT 1230 ATOM 34601 O WAT 1231 130.120 79.132 64.128 1.00 0.00 O ATOM 34602 H1 WAT 1231 129.719 79.633 64.838 1.00 0.00 H ATOM 34603 H2 WAT 1231 129.441 79.083 63.456 1.00 0.00 H TER 34605 WAT 1231 ATOM 34605 O WAT 1232 111.647 39.277 114.880 1.00 0.00 O ATOM 34606 H1 WAT 1232 110.881 39.110 114.331 1.00 0.00 H ATOM 34607 H2 WAT 1232 112.362 39.415 114.259 1.00 0.00 H TER 34609 WAT 1232 ATOM 34609 O WAT 1233 34.139 9.301 76.232 1.00 0.00 O ATOM 34610 H1 WAT 1233 34.717 8.742 75.713 1.00 0.00 H ATOM 34611 H2 WAT 1233 33.282 8.877 76.176 1.00 0.00 H TER 34613 WAT 1233 ATOM 34613 O WAT 1234 124.333 140.316 148.801 1.00 0.00 O ATOM 34614 H1 WAT 1234 123.503 140.098 148.376 1.00 0.00 H ATOM 34615 H2 WAT 1234 124.892 139.556 148.637 1.00 0.00 H TER 34617 WAT 1234 ATOM 34617 O WAT 1235 45.278 83.830 157.960 1.00 0.00 O ATOM 34618 H1 WAT 1235 45.757 84.569 158.337 1.00 0.00 H ATOM 34619 H2 WAT 1235 44.974 84.151 157.111 1.00 0.00 H TER 34621 WAT 1235 ATOM 34621 O WAT 1236 85.570 77.615 63.007 1.00 0.00 O ATOM 34622 H1 WAT 1236 85.309 76.698 63.088 1.00 0.00 H ATOM 34623 H2 WAT 1236 85.437 77.821 62.081 1.00 0.00 H TER 34625 WAT 1236 ATOM 34625 O WAT 1237 60.224 119.686 115.880 1.00 0.00 O ATOM 34626 H1 WAT 1237 60.903 119.011 115.894 1.00 0.00 H ATOM 34627 H2 WAT 1237 60.127 119.909 114.954 1.00 0.00 H TER 34629 WAT 1237 ATOM 34629 O WAT 1238 15.531 127.877 153.187 1.00 0.00 O ATOM 34630 H1 WAT 1238 14.978 127.369 153.781 1.00 0.00 H ATOM 34631 H2 WAT 1238 16.181 128.287 153.757 1.00 0.00 H TER 34633 WAT 1238 ATOM 34633 O WAT 1239 14.788 59.160 146.300 1.00 0.00 O ATOM 34634 H1 WAT 1239 14.903 59.350 145.369 1.00 0.00 H ATOM 34635 H2 WAT 1239 13.840 59.090 146.415 1.00 0.00 H TER 34637 WAT 1239 ATOM 34637 O WAT 1240 92.179 119.731 104.766 1.00 0.00 O ATOM 34638 H1 WAT 1240 91.819 118.868 104.973 1.00 0.00 H ATOM 34639 H2 WAT 1240 91.898 120.288 105.492 1.00 0.00 H TER 34641 WAT 1240 ATOM 34641 O WAT 1241 77.746 51.118 72.080 1.00 0.00 O ATOM 34642 H1 WAT 1241 78.650 51.433 72.070 1.00 0.00 H ATOM 34643 H2 WAT 1241 77.417 51.361 72.946 1.00 0.00 H TER 34645 WAT 1241 ATOM 34645 O WAT 1242 85.423 102.335 60.613 1.00 0.00 O ATOM 34646 H1 WAT 1242 86.161 101.856 60.988 1.00 0.00 H ATOM 34647 H2 WAT 1242 85.340 101.990 59.724 1.00 0.00 H TER 34649 WAT 1242 ATOM 34649 O WAT 1243 65.585 101.424 80.549 1.00 0.00 O ATOM 34650 H1 WAT 1243 65.224 100.596 80.867 1.00 0.00 H ATOM 34651 H2 WAT 1243 66.442 101.190 80.192 1.00 0.00 H TER 34653 WAT 1243 ATOM 34653 O WAT 1244 33.412 107.375 131.627 1.00 0.00 O ATOM 34654 H1 WAT 1244 32.552 107.462 132.037 1.00 0.00 H ATOM 34655 H2 WAT 1244 33.229 107.344 130.688 1.00 0.00 H TER 34657 WAT 1244 ATOM 34657 O WAT 1245 88.822 53.561 84.108 1.00 0.00 O ATOM 34658 H1 WAT 1245 88.217 53.805 84.809 1.00 0.00 H ATOM 34659 H2 WAT 1245 89.644 53.368 84.558 1.00 0.00 H TER 34661 WAT 1245 ATOM 34661 O WAT 1246 10.395 21.373 140.248 1.00 0.00 O ATOM 34662 H1 WAT 1246 10.974 20.785 140.733 1.00 0.00 H ATOM 34663 H2 WAT 1246 9.513 21.074 140.466 1.00 0.00 H TER 34665 WAT 1246 ATOM 34665 O WAT 1247 133.577 136.165 72.086 1.00 0.00 O ATOM 34666 H1 WAT 1247 133.000 136.729 72.601 1.00 0.00 H ATOM 34667 H2 WAT 1247 133.963 135.568 72.727 1.00 0.00 H TER 34669 WAT 1247 ATOM 34669 O WAT 1248 45.262 0.729 100.159 1.00 0.00 O ATOM 34670 H1 WAT 1248 44.843 1.353 99.566 1.00 0.00 H ATOM 34671 H2 WAT 1248 44.707 -0.050 100.117 1.00 0.00 H TER 34673 WAT 1248 ATOM 34673 O WAT 1249 47.151 101.290 142.903 1.00 0.00 O ATOM 34674 H1 WAT 1249 46.767 100.618 143.466 1.00 0.00 H ATOM 34675 H2 WAT 1249 46.944 102.116 143.340 1.00 0.00 H TER 34677 WAT 1249 ATOM 34677 O WAT 1250 38.542 49.458 155.531 1.00 0.00 O ATOM 34678 H1 WAT 1250 37.741 49.979 155.589 1.00 0.00 H ATOM 34679 H2 WAT 1250 38.238 48.571 155.341 1.00 0.00 H TER 34681 WAT 1250 ATOM 34681 O WAT 1251 71.767 109.844 12.350 1.00 0.00 O ATOM 34682 H1 WAT 1251 71.466 110.160 13.202 1.00 0.00 H ATOM 34683 H2 WAT 1251 71.526 110.540 11.738 1.00 0.00 H TER 34685 WAT 1251 ATOM 34685 O WAT 1252 132.205 9.330 64.654 1.00 0.00 O ATOM 34686 H1 WAT 1252 131.387 9.380 64.159 1.00 0.00 H ATOM 34687 H2 WAT 1252 131.928 9.172 65.557 1.00 0.00 H TER 34689 WAT 1252 ATOM 34689 O WAT 1253 142.205 144.791 12.083 1.00 0.00 O ATOM 34690 H1 WAT 1253 141.999 143.859 12.018 1.00 0.00 H ATOM 34691 H2 WAT 1253 142.575 144.894 12.959 1.00 0.00 H TER 34693 WAT 1253 ATOM 34693 O WAT 1254 4.838 84.943 107.943 1.00 0.00 O ATOM 34694 H1 WAT 1254 3.902 85.146 107.928 1.00 0.00 H ATOM 34695 H2 WAT 1254 5.049 84.723 107.036 1.00 0.00 H TER 34697 WAT 1254 ATOM 34697 O WAT 1255 13.609 37.554 99.081 1.00 0.00 O ATOM 34698 H1 WAT 1255 14.227 37.352 98.379 1.00 0.00 H ATOM 34699 H2 WAT 1255 14.079 37.332 99.885 1.00 0.00 H TER 34701 WAT 1255 ATOM 34701 O WAT 1256 80.274 134.271 84.154 1.00 0.00 O ATOM 34702 H1 WAT 1256 81.055 134.210 84.704 1.00 0.00 H ATOM 34703 H2 WAT 1256 80.381 133.575 83.506 1.00 0.00 H TER 34705 WAT 1256 ATOM 34705 O WAT 1257 43.659 139.162 99.718 1.00 0.00 O ATOM 34706 H1 WAT 1257 44.182 138.819 98.994 1.00 0.00 H ATOM 34707 H2 WAT 1257 43.955 140.066 99.822 1.00 0.00 H TER 34709 WAT 1257 ATOM 34709 O WAT 1258 9.855 30.529 25.446 1.00 0.00 O ATOM 34710 H1 WAT 1258 9.665 31.451 25.618 1.00 0.00 H ATOM 34711 H2 WAT 1258 10.753 30.527 25.116 1.00 0.00 H TER 34713 WAT 1258 ATOM 34713 O WAT 1259 96.220 135.373 113.180 1.00 0.00 O ATOM 34714 H1 WAT 1259 96.489 135.232 114.088 1.00 0.00 H ATOM 34715 H2 WAT 1259 96.013 136.307 113.134 1.00 0.00 H TER 34717 WAT 1259 ATOM 34717 O WAT 1260 93.534 90.696 114.139 1.00 0.00 O ATOM 34718 H1 WAT 1260 94.297 91.252 113.978 1.00 0.00 H ATOM 34719 H2 WAT 1260 92.870 91.017 113.530 1.00 0.00 H TER 34721 WAT 1260 ATOM 34721 O WAT 1261 134.301 17.658 6.404 1.00 0.00 O ATOM 34722 H1 WAT 1261 135.219 17.436 6.561 1.00 0.00 H ATOM 34723 H2 WAT 1261 134.115 18.361 7.026 1.00 0.00 H TER 34725 WAT 1261 ATOM 34725 O WAT 1262 97.029 77.125 8.034 1.00 0.00 O ATOM 34726 H1 WAT 1262 96.328 77.671 8.390 1.00 0.00 H ATOM 34727 H2 WAT 1262 96.999 77.282 7.090 1.00 0.00 H TER 34729 WAT 1262 ATOM 34729 O WAT 1263 57.588 133.953 83.283 1.00 0.00 O ATOM 34730 H1 WAT 1263 56.827 133.673 82.776 1.00 0.00 H ATOM 34731 H2 WAT 1263 57.222 134.481 83.992 1.00 0.00 H TER 34733 WAT 1263 ATOM 34733 O WAT 1264 9.324 63.214 63.773 1.00 0.00 O ATOM 34734 H1 WAT 1264 8.759 63.175 64.545 1.00 0.00 H ATOM 34735 H2 WAT 1264 8.914 63.869 63.209 1.00 0.00 H TER 34737 WAT 1264 ATOM 34737 O WAT 1265 69.959 122.967 120.468 1.00 0.00 O ATOM 34738 H1 WAT 1265 69.904 122.068 120.142 1.00 0.00 H ATOM 34739 H2 WAT 1265 69.321 123.451 119.944 1.00 0.00 H TER 34741 WAT 1265 ATOM 34741 O WAT 1266 30.299 39.477 2.619 1.00 0.00 O ATOM 34742 H1 WAT 1266 30.035 39.747 1.740 1.00 0.00 H ATOM 34743 H2 WAT 1266 30.727 38.630 2.491 1.00 0.00 H TER 34745 WAT 1266 ATOM 34745 O WAT 1267 98.396 6.382 132.075 1.00 0.00 O ATOM 34746 H1 WAT 1267 98.349 6.428 133.030 1.00 0.00 H ATOM 34747 H2 WAT 1267 98.810 7.205 131.815 1.00 0.00 H TER 34749 WAT 1267 ATOM 34749 O WAT 1268 23.760 3.318 126.077 1.00 0.00 O ATOM 34750 H1 WAT 1268 23.643 2.764 126.848 1.00 0.00 H ATOM 34751 H2 WAT 1268 23.574 4.204 126.388 1.00 0.00 H TER 34753 WAT 1268 ATOM 34753 O WAT 1269 46.573 47.127 9.711 1.00 0.00 O ATOM 34754 H1 WAT 1269 47.175 46.756 10.357 1.00 0.00 H ATOM 34755 H2 WAT 1269 47.127 47.337 8.960 1.00 0.00 H TER 34757 WAT 1269 ATOM 34757 O WAT 1270 117.197 35.102 3.644 1.00 0.00 O ATOM 34758 H1 WAT 1270 117.883 35.768 3.611 1.00 0.00 H ATOM 34759 H2 WAT 1270 116.735 35.275 4.465 1.00 0.00 H TER 34761 WAT 1270 ATOM 34761 O WAT 1271 99.890 56.329 131.233 1.00 0.00 O ATOM 34762 H1 WAT 1271 99.985 56.061 132.148 1.00 0.00 H ATOM 34763 H2 WAT 1271 99.017 56.026 130.984 1.00 0.00 H TER 34765 WAT 1271 ATOM 34765 O WAT 1272 60.250 53.427 133.125 1.00 0.00 O ATOM 34766 H1 WAT 1272 59.558 53.445 132.464 1.00 0.00 H ATOM 34767 H2 WAT 1272 60.905 52.826 132.770 1.00 0.00 H TER 34769 WAT 1272 ATOM 34769 O WAT 1273 5.890 80.596 129.828 1.00 0.00 O ATOM 34770 H1 WAT 1273 6.128 80.326 128.941 1.00 0.00 H ATOM 34771 H2 WAT 1273 6.269 79.923 130.393 1.00 0.00 H TER 34773 WAT 1273 ATOM 34773 O WAT 1274 104.303 96.577 137.281 1.00 0.00 O ATOM 34774 H1 WAT 1274 104.148 95.733 137.706 1.00 0.00 H ATOM 34775 H2 WAT 1274 105.250 96.610 137.151 1.00 0.00 H TER 34777 WAT 1274 ATOM 34777 O WAT 1275 66.711 14.496 155.082 1.00 0.00 O ATOM 34778 H1 WAT 1275 66.304 15.188 155.605 1.00 0.00 H ATOM 34779 H2 WAT 1275 67.310 14.959 154.497 1.00 0.00 H TER 34781 WAT 1275 ATOM 34781 O WAT 1276 95.848 105.829 131.939 1.00 0.00 O ATOM 34782 H1 WAT 1276 95.213 105.526 132.588 1.00 0.00 H ATOM 34783 H2 WAT 1276 95.432 105.650 131.096 1.00 0.00 H TER 34785 WAT 1276 ATOM 34785 O WAT 1277 130.740 66.125 138.473 1.00 0.00 O ATOM 34786 H1 WAT 1277 130.879 66.783 139.154 1.00 0.00 H ATOM 34787 H2 WAT 1277 131.189 66.478 137.705 1.00 0.00 H TER 34789 WAT 1277 ATOM 34789 O WAT 1278 69.178 113.780 4.614 1.00 0.00 O ATOM 34790 H1 WAT 1278 68.607 114.115 3.922 1.00 0.00 H ATOM 34791 H2 WAT 1278 69.851 114.453 4.716 1.00 0.00 H TER 34793 WAT 1278 ATOM 34793 O WAT 1279 41.306 91.674 135.187 1.00 0.00 O ATOM 34794 H1 WAT 1279 41.116 91.222 136.009 1.00 0.00 H ATOM 34795 H2 WAT 1279 42.061 91.209 134.826 1.00 0.00 H TER 34797 WAT 1279 ATOM 34797 O WAT 1280 55.411 0.409 87.153 1.00 0.00 O ATOM 34798 H1 WAT 1280 54.947 0.027 87.898 1.00 0.00 H ATOM 34799 H2 WAT 1280 55.942 1.108 87.535 1.00 0.00 H TER 34801 WAT 1280 ATOM 34801 O WAT 1281 27.542 98.989 110.202 1.00 0.00 O ATOM 34802 H1 WAT 1281 26.610 98.909 109.999 1.00 0.00 H ATOM 34803 H2 WAT 1281 27.713 99.931 110.173 1.00 0.00 H TER 34805 WAT 1281 ATOM 34805 O WAT 1282 36.469 45.922 104.057 1.00 0.00 O ATOM 34806 H1 WAT 1282 36.958 46.061 103.246 1.00 0.00 H ATOM 34807 H2 WAT 1282 35.790 45.289 103.822 1.00 0.00 H TER 34809 WAT 1282 ATOM 34809 O WAT 1283 98.531 14.495 73.264 1.00 0.00 O ATOM 34810 H1 WAT 1283 99.162 14.134 72.642 1.00 0.00 H ATOM 34811 H2 WAT 1283 97.715 14.562 72.766 1.00 0.00 H TER 34813 WAT 1283 ATOM 34813 O WAT 1284 112.253 125.153 61.292 1.00 0.00 O ATOM 34814 H1 WAT 1284 111.391 125.121 61.706 1.00 0.00 H ATOM 34815 H2 WAT 1284 112.438 126.088 61.196 1.00 0.00 H TER 34817 WAT 1284 ATOM 34817 O WAT 1285 137.829 14.022 95.038 1.00 0.00 O ATOM 34818 H1 WAT 1285 136.952 14.114 94.665 1.00 0.00 H ATOM 34819 H2 WAT 1285 137.720 13.397 95.755 1.00 0.00 H TER 34821 WAT 1285 ATOM 34821 O WAT 1286 118.172 46.386 88.609 1.00 0.00 O ATOM 34822 H1 WAT 1286 119.124 46.296 88.559 1.00 0.00 H ATOM 34823 H2 WAT 1286 117.998 47.270 88.287 1.00 0.00 H TER 34825 WAT 1286 ATOM 34825 O WAT 1287 58.170 49.198 133.987 1.00 0.00 O ATOM 34826 H1 WAT 1287 57.484 48.558 133.799 1.00 0.00 H ATOM 34827 H2 WAT 1287 58.718 48.775 134.649 1.00 0.00 H TER 34829 WAT 1287 ATOM 34829 O WAT 1288 96.636 42.394 60.895 1.00 0.00 O ATOM 34830 H1 WAT 1288 96.134 43.007 60.359 1.00 0.00 H ATOM 34831 H2 WAT 1288 97.549 42.564 60.664 1.00 0.00 H TER 34833 WAT 1288 ATOM 34833 O WAT 1289 126.877 46.134 128.510 1.00 0.00 O ATOM 34834 H1 WAT 1289 126.498 45.620 129.222 1.00 0.00 H ATOM 34835 H2 WAT 1289 126.389 46.958 128.524 1.00 0.00 H TER 34837 WAT 1289 ATOM 34837 O WAT 1290 84.860 39.832 130.014 1.00 0.00 O ATOM 34838 H1 WAT 1290 85.113 38.911 130.081 1.00 0.00 H ATOM 34839 H2 WAT 1290 84.867 40.148 130.918 1.00 0.00 H TER 34841 WAT 1290 ATOM 34841 O WAT 1291 11.787 70.079 8.682 1.00 0.00 O ATOM 34842 H1 WAT 1291 11.867 71.021 8.829 1.00 0.00 H ATOM 34843 H2 WAT 1291 12.685 69.751 8.734 1.00 0.00 H TER 34845 WAT 1291 ATOM 34845 O WAT 1292 11.097 65.855 158.584 1.00 0.00 O ATOM 34846 H1 WAT 1292 10.864 66.367 159.358 1.00 0.00 H ATOM 34847 H2 WAT 1292 10.428 66.081 157.937 1.00 0.00 H TER 34849 WAT 1292 ATOM 34849 O WAT 1293 79.662 19.515 82.286 1.00 0.00 O ATOM 34850 H1 WAT 1293 80.496 19.966 82.418 1.00 0.00 H ATOM 34851 H2 WAT 1293 79.862 18.818 81.661 1.00 0.00 H TER 34853 WAT 1293 ATOM 34853 O WAT 1294 120.165 19.189 1.346 1.00 0.00 O ATOM 34854 H1 WAT 1294 121.008 18.751 1.230 1.00 0.00 H ATOM 34855 H2 WAT 1294 119.600 18.523 1.738 1.00 0.00 H TER 34857 WAT 1294 ATOM 34857 O WAT 1295 131.863 41.397 64.859 1.00 0.00 O ATOM 34858 H1 WAT 1295 131.288 41.666 65.575 1.00 0.00 H ATOM 34859 H2 WAT 1295 131.311 41.448 64.078 1.00 0.00 H TER 34861 WAT 1295 ATOM 34861 O WAT 1296 37.662 49.724 148.755 1.00 0.00 O ATOM 34862 H1 WAT 1296 37.448 49.600 147.830 1.00 0.00 H ATOM 34863 H2 WAT 1296 38.594 49.515 148.815 1.00 0.00 H TER 34865 WAT 1296 ATOM 34865 O WAT 1297 106.268 141.061 2.928 1.00 0.00 O ATOM 34866 H1 WAT 1297 105.365 140.760 2.833 1.00 0.00 H ATOM 34867 H2 WAT 1297 106.634 140.508 3.618 1.00 0.00 H TER 34869 WAT 1297 ATOM 34869 O WAT 1298 71.802 13.022 122.547 1.00 0.00 O ATOM 34870 H1 WAT 1298 72.188 12.156 122.415 1.00 0.00 H ATOM 34871 H2 WAT 1298 71.425 13.248 121.697 1.00 0.00 H TER 34873 WAT 1298 ATOM 34873 O WAT 1299 14.846 39.966 117.899 1.00 0.00 O ATOM 34874 H1 WAT 1299 15.583 39.717 118.457 1.00 0.00 H ATOM 34875 H2 WAT 1299 14.306 40.530 118.453 1.00 0.00 H TER 34877 WAT 1299 ATOM 34877 O WAT 1300 88.401 41.091 67.644 1.00 0.00 O ATOM 34878 H1 WAT 1300 87.464 40.892 67.659 1.00 0.00 H ATOM 34879 H2 WAT 1300 88.785 40.483 68.276 1.00 0.00 H TER 34881 WAT 1300 ATOM 34881 O WAT 1301 40.141 73.977 1.957 1.00 0.00 O ATOM 34882 H1 WAT 1301 39.554 74.705 1.754 1.00 0.00 H ATOM 34883 H2 WAT 1301 39.603 73.369 2.464 1.00 0.00 H TER 34885 WAT 1301 ATOM 34885 O WAT 1302 16.745 14.723 74.517 1.00 0.00 O ATOM 34886 H1 WAT 1302 16.344 14.578 75.374 1.00 0.00 H ATOM 34887 H2 WAT 1302 17.321 15.476 74.647 1.00 0.00 H TER 34889 WAT 1302 ATOM 34889 O WAT 1303 42.916 126.109 135.560 1.00 0.00 O ATOM 34890 H1 WAT 1303 43.476 126.315 134.812 1.00 0.00 H ATOM 34891 H2 WAT 1303 43.435 126.360 136.324 1.00 0.00 H TER 34893 WAT 1303 ATOM 34893 O WAT 1304 66.155 10.399 63.726 1.00 0.00 O ATOM 34894 H1 WAT 1304 66.882 10.295 64.340 1.00 0.00 H ATOM 34895 H2 WAT 1304 66.571 10.671 62.907 1.00 0.00 H TER 34897 WAT 1304 ATOM 34897 O WAT 1305 32.425 55.075 96.657 1.00 0.00 O ATOM 34898 H1 WAT 1305 33.351 54.837 96.627 1.00 0.00 H ATOM 34899 H2 WAT 1305 32.082 54.608 97.419 1.00 0.00 H TER 34901 WAT 1305 ATOM 34901 O WAT 1306 132.318 114.559 100.489 1.00 0.00 O ATOM 34902 H1 WAT 1306 131.853 114.105 101.192 1.00 0.00 H ATOM 34903 H2 WAT 1306 131.631 115.021 100.007 1.00 0.00 H TER 34905 WAT 1306 ATOM 34905 O WAT 1307 87.459 130.278 98.178 1.00 0.00 O ATOM 34906 H1 WAT 1307 87.286 130.606 97.295 1.00 0.00 H ATOM 34907 H2 WAT 1307 88.164 129.641 98.062 1.00 0.00 H TER 34909 WAT 1307 ATOM 34909 O WAT 1308 9.611 11.356 114.261 1.00 0.00 O ATOM 34910 H1 WAT 1308 10.345 10.748 114.342 1.00 0.00 H ATOM 34911 H2 WAT 1308 9.274 11.208 113.377 1.00 0.00 H TER 34913 WAT 1308 ATOM 34913 O WAT 1309 51.005 121.815 78.708 1.00 0.00 O ATOM 34914 H1 WAT 1309 51.443 121.119 79.197 1.00 0.00 H ATOM 34915 H2 WAT 1309 50.086 121.548 78.682 1.00 0.00 H TER 34917 WAT 1309 ATOM 34917 O WAT 1310 28.298 21.178 147.373 1.00 0.00 O ATOM 34918 H1 WAT 1310 27.385 21.448 147.476 1.00 0.00 H ATOM 34919 H2 WAT 1310 28.742 21.959 147.042 1.00 0.00 H TER 34921 WAT 1310 ATOM 34921 O WAT 1311 14.556 96.450 142.202 1.00 0.00 O ATOM 34922 H1 WAT 1311 13.914 96.391 142.909 1.00 0.00 H ATOM 34923 H2 WAT 1311 14.030 96.554 141.409 1.00 0.00 H TER 34925 WAT 1311 ATOM 34925 O WAT 1312 25.616 126.442 19.077 1.00 0.00 O ATOM 34926 H1 WAT 1312 26.494 126.140 18.848 1.00 0.00 H ATOM 34927 H2 WAT 1312 25.094 126.278 18.291 1.00 0.00 H TER 34929 WAT 1312 ATOM 34929 O WAT 1313 126.298 13.829 124.605 1.00 0.00 O ATOM 34930 H1 WAT 1313 125.794 13.190 125.109 1.00 0.00 H ATOM 34931 H2 WAT 1313 125.649 14.467 124.309 1.00 0.00 H TER 34933 WAT 1313 ATOM 34933 O WAT 1314 98.155 21.943 92.341 1.00 0.00 O ATOM 34934 H1 WAT 1314 98.642 21.799 91.529 1.00 0.00 H ATOM 34935 H2 WAT 1314 98.696 21.540 93.020 1.00 0.00 H TER 34937 WAT 1314 ATOM 34937 O WAT 1315 92.150 55.754 143.232 1.00 0.00 O ATOM 34938 H1 WAT 1315 91.213 55.652 143.402 1.00 0.00 H ATOM 34939 H2 WAT 1315 92.485 56.213 144.002 1.00 0.00 H TER 34941 WAT 1315 ATOM 34941 O WAT 1316 8.237 41.715 7.514 1.00 0.00 O ATOM 34942 H1 WAT 1316 8.328 42.631 7.249 1.00 0.00 H ATOM 34943 H2 WAT 1316 7.453 41.702 8.064 1.00 0.00 H TER 34945 WAT 1316 ATOM 34945 O WAT 1317 19.910 50.633 96.724 1.00 0.00 O ATOM 34946 H1 WAT 1317 19.274 50.236 96.128 1.00 0.00 H ATOM 34947 H2 WAT 1317 20.402 49.892 97.078 1.00 0.00 H TER 34949 WAT 1317 ATOM 34949 O WAT 1318 143.946 104.558 114.286 1.00 0.00 O ATOM 34950 H1 WAT 1318 144.270 105.404 113.979 1.00 0.00 H ATOM 34951 H2 WAT 1318 143.073 104.746 114.632 1.00 0.00 H TER 34953 WAT 1318 ATOM 34953 O WAT 1319 107.587 39.990 116.938 1.00 0.00 O ATOM 34954 H1 WAT 1319 108.499 40.280 116.914 1.00 0.00 H ATOM 34955 H2 WAT 1319 107.494 39.427 116.170 1.00 0.00 H TER 34957 WAT 1319 ATOM 34957 O WAT 1320 122.518 108.087 145.242 1.00 0.00 O ATOM 34958 H1 WAT 1320 121.835 108.455 145.803 1.00 0.00 H ATOM 34959 H2 WAT 1320 123.053 108.840 144.990 1.00 0.00 H TER 34961 WAT 1320 ATOM 34961 O WAT 1321 69.271 7.960 83.420 1.00 0.00 O ATOM 34962 H1 WAT 1321 69.659 8.835 83.375 1.00 0.00 H ATOM 34963 H2 WAT 1321 68.551 8.050 84.044 1.00 0.00 H TER 34965 WAT 1321 ATOM 34965 O WAT 1322 6.455 36.430 158.420 1.00 0.00 O ATOM 34966 H1 WAT 1322 5.631 35.953 158.325 1.00 0.00 H ATOM 34967 H2 WAT 1322 7.132 35.773 158.259 1.00 0.00 H TER 34969 WAT 1322 ATOM 34969 O WAT 1323 91.922 132.952 70.181 1.00 0.00 O ATOM 34970 H1 WAT 1323 91.754 132.682 69.278 1.00 0.00 H ATOM 34971 H2 WAT 1323 92.034 133.901 70.129 1.00 0.00 H TER 34973 WAT 1323 ATOM 34973 O WAT 1324 94.822 93.998 15.480 1.00 0.00 O ATOM 34974 H1 WAT 1324 95.618 93.591 15.140 1.00 0.00 H ATOM 34975 H2 WAT 1324 94.738 94.812 14.984 1.00 0.00 H TER 34977 WAT 1324 ATOM 34977 O WAT 1325 115.089 38.676 69.956 1.00 0.00 O ATOM 34978 H1 WAT 1325 114.140 38.754 69.860 1.00 0.00 H ATOM 34979 H2 WAT 1325 115.323 37.919 69.419 1.00 0.00 H TER 34981 WAT 1325 ATOM 34981 O WAT 1326 81.437 75.321 1.202 1.00 0.00 O ATOM 34982 H1 WAT 1326 82.310 74.968 1.371 1.00 0.00 H ATOM 34983 H2 WAT 1326 80.959 75.177 2.018 1.00 0.00 H TER 34985 WAT 1326 ATOM 34985 O WAT 1327 67.620 101.259 16.622 1.00 0.00 O ATOM 34986 H1 WAT 1327 67.451 101.895 15.927 1.00 0.00 H ATOM 34987 H2 WAT 1327 68.530 101.416 16.874 1.00 0.00 H TER 34989 WAT 1327 ATOM 34989 O WAT 1328 46.731 109.921 122.303 1.00 0.00 O ATOM 34990 H1 WAT 1328 46.398 110.767 122.602 1.00 0.00 H ATOM 34991 H2 WAT 1328 46.623 109.341 123.057 1.00 0.00 H TER 34993 WAT 1328 ATOM 34993 O WAT 1329 46.812 92.416 23.881 1.00 0.00 O ATOM 34994 H1 WAT 1329 47.087 92.195 24.771 1.00 0.00 H ATOM 34995 H2 WAT 1329 47.315 91.824 23.321 1.00 0.00 H TER 34997 WAT 1329 ATOM 34997 O WAT 1330 73.499 3.725 158.088 1.00 0.00 O ATOM 34998 H1 WAT 1330 73.918 2.974 157.667 1.00 0.00 H ATOM 34999 H2 WAT 1330 73.021 3.349 158.828 1.00 0.00 H TER 35001 WAT 1330 ATOM 35001 O WAT 1331 110.108 50.317 6.135 1.00 0.00 O ATOM 35002 H1 WAT 1331 110.906 49.803 6.010 1.00 0.00 H ATOM 35003 H2 WAT 1331 109.397 49.704 5.946 1.00 0.00 H TER 35005 WAT 1331 ATOM 35005 O WAT 1332 71.295 144.167 129.098 1.00 0.00 O ATOM 35006 H1 WAT 1332 70.433 144.574 129.183 1.00 0.00 H ATOM 35007 H2 WAT 1332 71.733 144.673 128.414 1.00 0.00 H TER 35009 WAT 1332 ATOM 35009 O WAT 1333 85.955 27.403 64.691 1.00 0.00 O ATOM 35010 H1 WAT 1333 85.010 27.378 64.537 1.00 0.00 H ATOM 35011 H2 WAT 1333 86.048 27.258 65.632 1.00 0.00 H TER 35013 WAT 1333 ATOM 35013 O WAT 1334 32.827 101.765 61.938 1.00 0.00 O ATOM 35014 H1 WAT 1334 31.998 102.236 61.852 1.00 0.00 H ATOM 35015 H2 WAT 1334 33.189 101.753 61.052 1.00 0.00 H TER 35017 WAT 1334 ATOM 35017 O WAT 1335 101.924 129.606 124.982 1.00 0.00 O ATOM 35018 H1 WAT 1335 101.524 130.173 125.643 1.00 0.00 H ATOM 35019 H2 WAT 1335 102.021 128.760 125.420 1.00 0.00 H TER 35021 WAT 1335 ATOM 35021 O WAT 1336 145.726 36.184 70.841 1.00 0.00 O ATOM 35022 H1 WAT 1336 145.333 36.144 71.712 1.00 0.00 H ATOM 35023 H2 WAT 1336 146.155 37.039 70.810 1.00 0.00 H TER 35025 WAT 1336 ATOM 35025 O WAT 1337 133.719 35.422 76.691 1.00 0.00 O ATOM 35026 H1 WAT 1337 133.374 34.529 76.694 1.00 0.00 H ATOM 35027 H2 WAT 1337 134.619 35.332 77.005 1.00 0.00 H TER 35029 WAT 1337 ATOM 35029 O WAT 1338 1.637 25.521 133.575 1.00 0.00 O ATOM 35030 H1 WAT 1338 0.694 25.679 133.526 1.00 0.00 H ATOM 35031 H2 WAT 1338 1.723 24.568 133.540 1.00 0.00 H TER 35033 WAT 1338 ATOM 35033 O WAT 1339 114.206 73.304 121.033 1.00 0.00 O ATOM 35034 H1 WAT 1339 113.619 72.615 120.722 1.00 0.00 H ATOM 35035 H2 WAT 1339 115.068 72.890 121.062 1.00 0.00 H TER 35037 WAT 1339 ATOM 35037 O WAT 1340 67.230 14.438 61.407 1.00 0.00 O ATOM 35038 H1 WAT 1340 67.587 15.249 61.044 1.00 0.00 H ATOM 35039 H2 WAT 1340 67.898 13.778 61.220 1.00 0.00 H TER 35041 WAT 1340 ATOM 35041 O WAT 1341 92.352 94.389 129.602 1.00 0.00 O ATOM 35042 H1 WAT 1341 92.743 95.224 129.347 1.00 0.00 H ATOM 35043 H2 WAT 1341 91.986 94.038 128.790 1.00 0.00 H TER 35045 WAT 1341 ATOM 35045 O WAT 1342 61.706 87.329 87.456 1.00 0.00 O ATOM 35046 H1 WAT 1342 61.499 86.808 88.231 1.00 0.00 H ATOM 35047 H2 WAT 1342 60.871 87.722 87.201 1.00 0.00 H TER 35049 WAT 1342 ATOM 35049 O WAT 1343 64.658 94.159 119.781 1.00 0.00 O ATOM 35050 H1 WAT 1343 63.726 94.134 120.000 1.00 0.00 H ATOM 35051 H2 WAT 1343 64.794 93.392 119.226 1.00 0.00 H TER 35053 WAT 1343 ATOM 35053 O WAT 1344 110.534 83.205 136.684 1.00 0.00 O ATOM 35054 H1 WAT 1344 110.611 84.103 137.005 1.00 0.00 H ATOM 35055 H2 WAT 1344 111.137 83.162 135.942 1.00 0.00 H TER 35057 WAT 1344 ATOM 35057 O WAT 1345 28.002 144.692 156.059 1.00 0.00 O ATOM 35058 H1 WAT 1345 28.545 144.563 156.837 1.00 0.00 H ATOM 35059 H2 WAT 1345 28.207 145.581 155.769 1.00 0.00 H TER 35061 WAT 1345 ATOM 35061 O WAT 1346 83.389 73.017 81.032 1.00 0.00 O ATOM 35062 H1 WAT 1346 82.859 72.662 80.317 1.00 0.00 H ATOM 35063 H2 WAT 1346 84.287 72.774 80.807 1.00 0.00 H TER 35065 WAT 1346 ATOM 35065 O WAT 1347 40.655 25.481 86.342 1.00 0.00 O ATOM 35066 H1 WAT 1347 39.884 24.928 86.469 1.00 0.00 H ATOM 35067 H2 WAT 1347 41.283 25.170 86.995 1.00 0.00 H TER 35069 WAT 1347 ATOM 35069 O WAT 1348 31.427 119.637 133.070 1.00 0.00 O ATOM 35070 H1 WAT 1348 31.057 120.488 133.306 1.00 0.00 H ATOM 35071 H2 WAT 1348 31.074 119.034 133.725 1.00 0.00 H TER 35073 WAT 1348 ATOM 35073 O WAT 1349 29.777 23.002 137.206 1.00 0.00 O ATOM 35074 H1 WAT 1349 28.951 23.323 137.567 1.00 0.00 H ATOM 35075 H2 WAT 1349 29.589 22.100 136.944 1.00 0.00 H TER 35077 WAT 1349 ATOM 35077 O WAT 1350 112.872 33.436 114.880 1.00 0.00 O ATOM 35078 H1 WAT 1350 112.717 32.513 114.679 1.00 0.00 H ATOM 35079 H2 WAT 1350 113.513 33.422 115.591 1.00 0.00 H TER 35081 WAT 1350 ATOM 35081 O WAT 1351 75.136 139.804 72.902 1.00 0.00 O ATOM 35082 H1 WAT 1351 76.039 140.050 73.104 1.00 0.00 H ATOM 35083 H2 WAT 1351 75.014 138.961 73.338 1.00 0.00 H TER 35085 WAT 1351 ATOM 35085 O WAT 1352 27.840 38.137 7.317 1.00 0.00 O ATOM 35086 H1 WAT 1352 28.160 38.590 6.537 1.00 0.00 H ATOM 35087 H2 WAT 1352 27.616 38.841 7.927 1.00 0.00 H TER 35089 WAT 1352 ATOM 35089 O WAT 1353 95.167 11.562 121.185 1.00 0.00 O ATOM 35090 H1 WAT 1353 94.700 11.738 122.002 1.00 0.00 H ATOM 35091 H2 WAT 1353 95.153 12.397 120.717 1.00 0.00 H TER 35093 WAT 1353 ATOM 35093 O WAT 1354 139.124 138.672 119.078 1.00 0.00 O ATOM 35094 H1 WAT 1354 139.985 139.051 118.903 1.00 0.00 H ATOM 35095 H2 WAT 1354 138.581 139.419 119.330 1.00 0.00 H TER 35097 WAT 1354 ATOM 35097 O WAT 1355 60.532 79.953 123.524 1.00 0.00 O ATOM 35098 H1 WAT 1355 60.465 80.871 123.787 1.00 0.00 H ATOM 35099 H2 WAT 1355 61.465 79.751 123.592 1.00 0.00 H TER 35101 WAT 1355 ATOM 35101 O WAT 1356 64.129 70.172 92.456 1.00 0.00 O ATOM 35102 H1 WAT 1356 63.777 70.353 93.327 1.00 0.00 H ATOM 35103 H2 WAT 1356 63.456 69.640 92.031 1.00 0.00 H TER 35105 WAT 1356 ATOM 35105 O WAT 1357 78.093 60.858 137.224 1.00 0.00 O ATOM 35106 H1 WAT 1357 78.425 60.981 136.335 1.00 0.00 H ATOM 35107 H2 WAT 1357 77.159 60.684 137.109 1.00 0.00 H TER 35109 WAT 1357 ATOM 35109 O WAT 1358 9.916 2.461 89.059 1.00 0.00 O ATOM 35110 H1 WAT 1358 9.314 2.857 88.428 1.00 0.00 H ATOM 35111 H2 WAT 1358 9.693 2.873 89.894 1.00 0.00 H TER 35113 WAT 1358 ATOM 35113 O WAT 1359 69.519 91.681 100.115 1.00 0.00 O ATOM 35114 H1 WAT 1359 69.474 92.036 101.003 1.00 0.00 H ATOM 35115 H2 WAT 1359 69.492 92.452 99.547 1.00 0.00 H TER 35117 WAT 1359 ATOM 35117 O WAT 1360 2.509 103.066 64.438 1.00 0.00 O ATOM 35118 H1 WAT 1360 2.755 103.687 65.124 1.00 0.00 H ATOM 35119 H2 WAT 1360 3.060 102.300 64.600 1.00 0.00 H TER 35121 WAT 1360 ATOM 35121 O WAT 1361 101.817 53.625 74.407 1.00 0.00 O ATOM 35122 H1 WAT 1361 102.706 53.906 74.189 1.00 0.00 H ATOM 35123 H2 WAT 1361 101.782 52.709 74.132 1.00 0.00 H TER 35125 WAT 1361 ATOM 35125 O WAT 1362 4.725 137.042 140.013 1.00 0.00 O ATOM 35126 H1 WAT 1362 4.853 136.173 140.392 1.00 0.00 H ATOM 35127 H2 WAT 1362 4.504 137.599 140.760 1.00 0.00 H TER 35129 WAT 1362 ATOM 35129 O WAT 1363 58.810 4.396 96.474 1.00 0.00 O ATOM 35130 H1 WAT 1363 59.034 5.314 96.316 1.00 0.00 H ATOM 35131 H2 WAT 1363 58.344 4.124 95.683 1.00 0.00 H TER 35133 WAT 1363 ATOM 35133 O WAT 1364 42.942 127.930 81.636 1.00 0.00 O ATOM 35134 H1 WAT 1364 43.228 127.235 81.043 1.00 0.00 H ATOM 35135 H2 WAT 1364 43.079 128.738 81.142 1.00 0.00 H TER 35137 WAT 1364 ATOM 35137 O WAT 1365 37.373 115.531 69.775 1.00 0.00 O ATOM 35138 H1 WAT 1365 37.624 115.782 68.886 1.00 0.00 H ATOM 35139 H2 WAT 1365 38.114 115.016 70.096 1.00 0.00 H TER 35141 WAT 1365 ATOM 35141 O WAT 1366 134.615 36.776 82.641 1.00 0.00 O ATOM 35142 H1 WAT 1366 134.560 36.173 83.383 1.00 0.00 H ATOM 35143 H2 WAT 1366 135.363 36.462 82.133 1.00 0.00 H TER 35145 WAT 1366 ATOM 35145 O WAT 1367 65.258 131.078 114.348 1.00 0.00 O ATOM 35146 H1 WAT 1367 65.959 131.087 113.697 1.00 0.00 H ATOM 35147 H2 WAT 1367 65.455 131.817 114.924 1.00 0.00 H TER 35149 WAT 1367 ATOM 35149 O WAT 1368 139.478 131.087 17.832 1.00 0.00 O ATOM 35150 H1 WAT 1368 139.229 131.751 18.476 1.00 0.00 H ATOM 35151 H2 WAT 1368 139.071 131.381 17.017 1.00 0.00 H TER 35153 WAT 1368 ATOM 35153 O WAT 1369 73.907 28.802 109.143 1.00 0.00 O ATOM 35154 H1 WAT 1369 74.439 28.789 108.348 1.00 0.00 H ATOM 35155 H2 WAT 1369 74.476 28.434 109.819 1.00 0.00 H TER 35157 WAT 1369 ATOM 35157 O WAT 1370 71.335 132.397 120.819 1.00 0.00 O ATOM 35158 H1 WAT 1370 70.943 131.823 121.478 1.00 0.00 H ATOM 35159 H2 WAT 1370 72.267 132.407 121.035 1.00 0.00 H TER 35161 WAT 1370 ATOM 35161 O WAT 1371 122.334 119.427 3.917 1.00 0.00 O ATOM 35162 H1 WAT 1371 122.008 119.520 4.812 1.00 0.00 H ATOM 35163 H2 WAT 1371 121.963 120.174 3.448 1.00 0.00 H TER 35165 WAT 1371 ATOM 35165 O WAT 1372 92.142 41.914 147.998 1.00 0.00 O ATOM 35166 H1 WAT 1372 91.861 41.533 147.166 1.00 0.00 H ATOM 35167 H2 WAT 1372 92.887 41.377 148.268 1.00 0.00 H TER 35169 WAT 1372 ATOM 35169 O WAT 1373 42.724 96.058 24.850 1.00 0.00 O ATOM 35170 H1 WAT 1373 43.492 95.496 24.742 1.00 0.00 H ATOM 35171 H2 WAT 1373 41.979 95.459 24.785 1.00 0.00 H TER 35173 WAT 1373 ATOM 35173 O WAT 1374 77.515 82.831 69.788 1.00 0.00 O ATOM 35174 H1 WAT 1374 77.468 83.385 70.567 1.00 0.00 H ATOM 35175 H2 WAT 1374 77.198 81.977 70.082 1.00 0.00 H TER 35177 WAT 1374 ATOM 35177 O WAT 1375 68.378 91.443 3.811 1.00 0.00 O ATOM 35178 H1 WAT 1375 68.504 91.998 4.582 1.00 0.00 H ATOM 35179 H2 WAT 1375 67.526 91.031 3.949 1.00 0.00 H TER 35181 WAT 1375 ATOM 35181 O WAT 1376 7.363 104.740 98.218 1.00 0.00 O ATOM 35182 H1 WAT 1376 8.268 105.047 98.253 1.00 0.00 H ATOM 35183 H2 WAT 1376 7.378 103.899 98.675 1.00 0.00 H TER 35185 WAT 1376 ATOM 35185 O WAT 1377 125.085 111.060 129.817 1.00 0.00 O ATOM 35186 H1 WAT 1377 124.834 111.927 129.499 1.00 0.00 H ATOM 35187 H2 WAT 1377 124.671 110.452 129.205 1.00 0.00 H TER 35189 WAT 1377 ATOM 35189 O WAT 1378 22.191 26.514 151.567 1.00 0.00 O ATOM 35190 H1 WAT 1378 22.093 25.564 151.501 1.00 0.00 H ATOM 35191 H2 WAT 1378 21.394 26.865 151.170 1.00 0.00 H TER 35193 WAT 1378 ATOM 35193 O WAT 1379 100.576 76.146 129.684 1.00 0.00 O ATOM 35194 H1 WAT 1379 100.495 76.727 130.440 1.00 0.00 H ATOM 35195 H2 WAT 1379 100.061 76.571 128.998 1.00 0.00 H TER 35197 WAT 1379 ATOM 35197 O WAT 1380 136.432 50.828 149.809 1.00 0.00 O ATOM 35198 H1 WAT 1380 137.378 50.815 149.665 1.00 0.00 H ATOM 35199 H2 WAT 1380 136.057 50.938 148.935 1.00 0.00 H TER 35201 WAT 1380 ATOM 35201 O WAT 1381 51.563 95.032 22.701 1.00 0.00 O ATOM 35202 H1 WAT 1381 51.582 95.532 23.517 1.00 0.00 H ATOM 35203 H2 WAT 1381 51.156 94.199 22.941 1.00 0.00 H TER 35205 WAT 1381 ATOM 35205 O WAT 1382 67.749 24.668 9.631 1.00 0.00 O ATOM 35206 H1 WAT 1382 68.400 25.202 9.176 1.00 0.00 H ATOM 35207 H2 WAT 1382 67.485 24.011 8.987 1.00 0.00 H TER 35209 WAT 1382 ATOM 35209 O WAT 1383 72.494 67.502 95.036 1.00 0.00 O ATOM 35210 H1 WAT 1383 72.944 68.255 94.654 1.00 0.00 H ATOM 35211 H2 WAT 1383 71.564 67.691 94.915 1.00 0.00 H TER 35213 WAT 1383 ATOM 35213 O WAT 1384 83.449 145.501 120.715 1.00 0.00 O ATOM 35214 H1 WAT 1384 83.759 145.450 119.811 1.00 0.00 H ATOM 35215 H2 WAT 1384 82.865 146.260 120.725 1.00 0.00 H TER 35217 WAT 1384 ATOM 35217 O WAT 1385 8.149 91.051 65.438 1.00 0.00 O ATOM 35218 H1 WAT 1385 8.494 90.334 64.905 1.00 0.00 H ATOM 35219 H2 WAT 1385 8.890 91.648 65.545 1.00 0.00 H TER 35221 WAT 1385 ATOM 35221 O WAT 1386 72.368 128.300 122.036 1.00 0.00 O ATOM 35222 H1 WAT 1386 72.061 127.548 121.529 1.00 0.00 H ATOM 35223 H2 WAT 1386 73.081 127.953 122.571 1.00 0.00 H TER 35225 WAT 1386 ATOM 35225 O WAT 1387 40.915 139.304 13.816 1.00 0.00 O ATOM 35226 H1 WAT 1387 39.998 139.061 13.687 1.00 0.00 H ATOM 35227 H2 WAT 1387 41.406 138.512 13.596 1.00 0.00 H TER 35229 WAT 1387 ATOM 35229 O WAT 1388 96.622 42.394 95.550 1.00 0.00 O ATOM 35230 H1 WAT 1388 96.387 42.306 96.474 1.00 0.00 H ATOM 35231 H2 WAT 1388 97.579 42.409 95.546 1.00 0.00 H TER 35233 WAT 1388 ATOM 35233 O WAT 1389 13.007 61.665 116.125 1.00 0.00 O ATOM 35234 H1 WAT 1389 12.398 61.872 116.834 1.00 0.00 H ATOM 35235 H2 WAT 1389 12.659 60.863 115.736 1.00 0.00 H TER 35237 WAT 1389 ATOM 35237 O WAT 1390 67.306 20.270 105.995 1.00 0.00 O ATOM 35238 H1 WAT 1390 66.566 20.786 105.675 1.00 0.00 H ATOM 35239 H2 WAT 1390 67.729 20.834 106.642 1.00 0.00 H TER 35241 WAT 1390 ATOM 35241 O WAT 1391 129.472 60.407 93.856 1.00 0.00 O ATOM 35242 H1 WAT 1391 129.317 59.556 94.265 1.00 0.00 H ATOM 35243 H2 WAT 1391 128.900 61.009 94.333 1.00 0.00 H TER 35245 WAT 1391 ATOM 35245 O WAT 1392 41.761 34.575 74.617 1.00 0.00 O ATOM 35246 H1 WAT 1392 41.748 35.370 75.149 1.00 0.00 H ATOM 35247 H2 WAT 1392 41.653 34.886 73.718 1.00 0.00 H TER 35249 WAT 1392 ATOM 35249 O WAT 1393 32.057 48.406 149.758 1.00 0.00 O ATOM 35250 H1 WAT 1393 31.378 49.063 149.603 1.00 0.00 H ATOM 35251 H2 WAT 1393 32.427 48.235 148.892 1.00 0.00 H TER 35253 WAT 1393 ATOM 35253 O WAT 1394 129.293 12.240 95.705 1.00 0.00 O ATOM 35254 H1 WAT 1394 130.117 12.180 95.222 1.00 0.00 H ATOM 35255 H2 WAT 1394 129.164 11.364 96.069 1.00 0.00 H TER 35257 WAT 1394 ATOM 35257 O WAT 1395 131.448 125.559 15.550 1.00 0.00 O ATOM 35258 H1 WAT 1395 131.187 126.441 15.283 1.00 0.00 H ATOM 35259 H2 WAT 1395 131.866 125.680 16.402 1.00 0.00 H TER 35261 WAT 1395 ATOM 35261 O WAT 1396 11.227 47.886 78.039 1.00 0.00 O ATOM 35262 H1 WAT 1396 11.637 48.750 78.012 1.00 0.00 H ATOM 35263 H2 WAT 1396 11.737 47.399 78.687 1.00 0.00 H TER 35265 WAT 1396 ATOM 35265 O WAT 1397 17.352 89.762 134.543 1.00 0.00 O ATOM 35266 H1 WAT 1397 16.820 90.197 135.209 1.00 0.00 H ATOM 35267 H2 WAT 1397 17.359 90.373 133.806 1.00 0.00 H TER 35269 WAT 1397 ATOM 35269 O WAT 1398 144.007 140.449 137.433 1.00 0.00 O ATOM 35270 H1 WAT 1398 143.526 139.791 137.934 1.00 0.00 H ATOM 35271 H2 WAT 1398 143.333 141.055 137.124 1.00 0.00 H TER 35273 WAT 1398 ATOM 35273 O WAT 1399 101.411 93.084 81.099 1.00 0.00 O ATOM 35274 H1 WAT 1399 101.611 93.557 81.906 1.00 0.00 H ATOM 35275 H2 WAT 1399 102.227 93.108 80.599 1.00 0.00 H TER 35277 WAT 1399 ATOM 35277 O WAT 1400 80.622 98.392 133.232 1.00 0.00 O ATOM 35278 H1 WAT 1400 80.459 99.312 133.023 1.00 0.00 H ATOM 35279 H2 WAT 1400 81.517 98.380 133.573 1.00 0.00 H TER 35281 WAT 1400 ATOM 35281 O WAT 1401 104.938 105.801 6.914 1.00 0.00 O ATOM 35282 H1 WAT 1401 103.987 105.905 6.942 1.00 0.00 H ATOM 35283 H2 WAT 1401 105.238 106.496 6.329 1.00 0.00 H TER 35285 WAT 1401 ATOM 35285 O WAT 1402 59.596 58.784 146.389 1.00 0.00 O ATOM 35286 H1 WAT 1402 59.215 59.331 145.702 1.00 0.00 H ATOM 35287 H2 WAT 1402 59.887 57.994 145.934 1.00 0.00 H TER 35289 WAT 1402 ATOM 35289 O WAT 1403 130.847 62.289 125.526 1.00 0.00 O ATOM 35290 H1 WAT 1403 130.248 62.489 126.245 1.00 0.00 H ATOM 35291 H2 WAT 1403 131.166 63.144 125.236 1.00 0.00 H TER 35293 WAT 1403 ATOM 35293 O WAT 1404 37.851 93.671 147.126 1.00 0.00 O ATOM 35294 H1 WAT 1404 37.083 94.193 147.355 1.00 0.00 H ATOM 35295 H2 WAT 1404 38.346 94.225 146.522 1.00 0.00 H TER 35297 WAT 1404 ATOM 35297 O WAT 1405 36.121 41.322 61.273 1.00 0.00 O ATOM 35298 H1 WAT 1405 35.361 41.235 60.698 1.00 0.00 H ATOM 35299 H2 WAT 1405 36.173 40.483 61.731 1.00 0.00 H TER 35301 WAT 1405 ATOM 35301 O WAT 1406 16.934 127.725 68.916 1.00 0.00 O ATOM 35302 H1 WAT 1406 17.165 126.886 68.516 1.00 0.00 H ATOM 35303 H2 WAT 1406 16.206 128.050 68.386 1.00 0.00 H TER 35305 WAT 1406 ATOM 35305 O WAT 1407 141.373 26.858 102.983 1.00 0.00 O ATOM 35306 H1 WAT 1407 140.789 26.101 102.932 1.00 0.00 H ATOM 35307 H2 WAT 1407 140.794 27.595 103.175 1.00 0.00 H TER 35309 WAT 1407 ATOM 35309 O WAT 1408 12.115 135.716 10.820 1.00 0.00 O ATOM 35310 H1 WAT 1408 12.475 136.516 10.437 1.00 0.00 H ATOM 35311 H2 WAT 1408 12.833 135.355 11.340 1.00 0.00 H TER 35313 WAT 1408 ATOM 35313 O WAT 1409 38.697 118.723 21.861 1.00 0.00 O ATOM 35314 H1 WAT 1409 38.650 119.643 21.602 1.00 0.00 H ATOM 35315 H2 WAT 1409 39.622 118.496 21.773 1.00 0.00 H TER 35317 WAT 1409 ATOM 35317 O WAT 1410 39.144 40.439 149.492 1.00 0.00 O ATOM 35318 H1 WAT 1410 39.834 40.705 148.883 1.00 0.00 H ATOM 35319 H2 WAT 1410 39.509 40.615 150.359 1.00 0.00 H TER 35321 WAT 1410 ATOM 35321 O WAT 1411 24.805 103.057 141.142 1.00 0.00 O ATOM 35322 H1 WAT 1411 24.715 102.870 140.207 1.00 0.00 H ATOM 35323 H2 WAT 1411 24.834 104.012 141.193 1.00 0.00 H TER 35325 WAT 1411 ATOM 35325 O WAT 1412 101.353 105.859 98.727 1.00 0.00 O ATOM 35326 H1 WAT 1412 102.186 106.143 98.351 1.00 0.00 H ATOM 35327 H2 WAT 1412 101.168 105.024 98.297 1.00 0.00 H TER 35329 WAT 1412 ATOM 35329 O WAT 1413 102.144 111.419 107.706 1.00 0.00 O ATOM 35330 H1 WAT 1413 102.252 110.529 107.371 1.00 0.00 H ATOM 35331 H2 WAT 1413 101.268 111.425 108.091 1.00 0.00 H TER 35333 WAT 1413 ATOM 35333 O WAT 1414 117.216 18.362 72.639 1.00 0.00 O ATOM 35334 H1 WAT 1414 117.137 18.471 73.586 1.00 0.00 H ATOM 35335 H2 WAT 1414 117.735 19.114 72.354 1.00 0.00 H TER 35337 WAT 1414 ATOM 35337 O WAT 1415 66.185 76.389 138.021 1.00 0.00 O ATOM 35338 H1 WAT 1415 65.487 76.420 137.366 1.00 0.00 H ATOM 35339 H2 WAT 1415 66.510 75.490 137.982 1.00 0.00 H TER 35341 WAT 1415 ATOM 35341 O WAT 1416 134.061 73.047 92.648 1.00 0.00 O ATOM 35342 H1 WAT 1416 133.852 72.118 92.746 1.00 0.00 H ATOM 35343 H2 WAT 1416 133.210 73.474 92.546 1.00 0.00 H TER 35345 WAT 1416 ATOM 35345 O WAT 1417 75.599 113.389 2.703 1.00 0.00 O ATOM 35346 H1 WAT 1417 75.132 112.619 3.028 1.00 0.00 H ATOM 35347 H2 WAT 1417 75.217 113.555 1.842 1.00 0.00 H TER 35349 WAT 1417 ATOM 35349 O WAT 1418 44.121 135.673 103.404 1.00 0.00 O ATOM 35350 H1 WAT 1418 44.150 136.608 103.202 1.00 0.00 H ATOM 35351 H2 WAT 1418 43.417 135.588 104.048 1.00 0.00 H TER 35353 WAT 1418 ATOM 35353 O WAT 1419 46.958 128.929 101.500 1.00 0.00 O ATOM 35354 H1 WAT 1419 46.684 128.021 101.369 1.00 0.00 H ATOM 35355 H2 WAT 1419 47.876 128.943 101.231 1.00 0.00 H TER 35357 WAT 1419 ATOM 35357 O WAT 1420 66.635 85.019 89.017 1.00 0.00 O ATOM 35358 H1 WAT 1420 66.154 84.374 89.536 1.00 0.00 H ATOM 35359 H2 WAT 1420 65.961 85.465 88.504 1.00 0.00 H TER 35361 WAT 1420 ATOM 35361 O WAT 1421 144.228 44.554 68.920 1.00 0.00 O ATOM 35362 H1 WAT 1421 143.801 43.834 69.383 1.00 0.00 H ATOM 35363 H2 WAT 1421 144.961 44.800 69.484 1.00 0.00 H TER 35365 WAT 1421 ATOM 35365 O WAT 1422 67.050 130.434 57.062 1.00 0.00 O ATOM 35366 H1 WAT 1422 66.099 130.457 57.165 1.00 0.00 H ATOM 35367 H2 WAT 1422 67.343 131.301 57.341 1.00 0.00 H TER 35369 WAT 1422 ATOM 35369 O WAT 1423 115.481 125.946 143.922 1.00 0.00 O ATOM 35370 H1 WAT 1423 115.811 126.346 144.726 1.00 0.00 H ATOM 35371 H2 WAT 1423 115.937 125.107 143.866 1.00 0.00 H TER 35373 WAT 1423 ATOM 35373 O WAT 1424 7.933 51.875 62.301 1.00 0.00 O ATOM 35374 H1 WAT 1424 8.882 51.866 62.427 1.00 0.00 H ATOM 35375 H2 WAT 1424 7.581 52.154 63.146 1.00 0.00 H TER 35377 WAT 1424 ATOM 35377 O WAT 1425 43.659 52.299 105.488 1.00 0.00 O ATOM 35378 H1 WAT 1425 44.382 52.414 104.872 1.00 0.00 H ATOM 35379 H2 WAT 1425 44.030 52.535 106.339 1.00 0.00 H TER 35381 WAT 1425 ATOM 35381 O WAT 1426 124.800 118.217 92.588 1.00 0.00 O ATOM 35382 H1 WAT 1426 124.318 119.006 92.340 1.00 0.00 H ATOM 35383 H2 WAT 1426 125.669 118.536 92.833 1.00 0.00 H TER 35385 WAT 1426 ATOM 35385 O WAT 1427 102.424 91.978 2.591 1.00 0.00 O ATOM 35386 H1 WAT 1427 103.165 91.384 2.474 1.00 0.00 H ATOM 35387 H2 WAT 1427 101.660 91.461 2.335 1.00 0.00 H TER 35389 WAT 1427 ATOM 35389 O WAT 1428 122.487 100.565 113.125 1.00 0.00 O ATOM 35390 H1 WAT 1428 121.726 100.681 113.694 1.00 0.00 H ATOM 35391 H2 WAT 1428 122.363 101.207 112.426 1.00 0.00 H TER 35393 WAT 1428 ATOM 35393 O WAT 1429 8.212 71.323 71.068 1.00 0.00 O ATOM 35394 H1 WAT 1429 8.994 70.772 71.091 1.00 0.00 H ATOM 35395 H2 WAT 1429 8.299 71.830 70.260 1.00 0.00 H TER 35397 WAT 1429 ATOM 35397 O WAT 1430 63.816 20.315 57.528 1.00 0.00 O ATOM 35398 H1 WAT 1430 63.411 20.368 56.662 1.00 0.00 H ATOM 35399 H2 WAT 1430 63.581 19.445 57.850 1.00 0.00 H TER 35401 WAT 1430 ATOM 35401 O WAT 1431 33.294 2.345 143.179 1.00 0.00 O ATOM 35402 H1 WAT 1431 32.618 2.943 142.860 1.00 0.00 H ATOM 35403 H2 WAT 1431 33.430 2.602 144.091 1.00 0.00 H TER 35405 WAT 1431 ATOM 35405 O WAT 1432 130.973 94.935 0.415 1.00 0.00 O ATOM 35406 H1 WAT 1432 130.179 95.136 0.911 1.00 0.00 H ATOM 35407 H2 WAT 1432 130.716 95.040 -0.501 1.00 0.00 H TER 35409 WAT 1432 ATOM 35409 O WAT 1433 23.181 58.789 150.298 1.00 0.00 O ATOM 35410 H1 WAT 1433 23.456 57.890 150.118 1.00 0.00 H ATOM 35411 H2 WAT 1433 22.806 59.094 149.472 1.00 0.00 H TER 35413 WAT 1433 ATOM 35413 O WAT 1434 80.133 11.624 151.862 1.00 0.00 O ATOM 35414 H1 WAT 1434 80.617 11.995 152.599 1.00 0.00 H ATOM 35415 H2 WAT 1434 79.597 12.348 151.538 1.00 0.00 H TER 35417 WAT 1434 ATOM 35417 O WAT 1435 96.540 70.646 6.197 1.00 0.00 O ATOM 35418 H1 WAT 1435 96.213 69.903 5.691 1.00 0.00 H ATOM 35419 H2 WAT 1435 97.451 70.743 5.919 1.00 0.00 H TER 35421 WAT 1435 ATOM 35421 O WAT 1436 124.855 121.269 134.314 1.00 0.00 O ATOM 35422 H1 WAT 1436 125.299 120.437 134.478 1.00 0.00 H ATOM 35423 H2 WAT 1436 124.292 121.395 135.077 1.00 0.00 H TER 35425 WAT 1436 ATOM 35425 O WAT 1437 92.747 136.696 147.492 1.00 0.00 O ATOM 35426 H1 WAT 1437 93.533 136.293 147.860 1.00 0.00 H ATOM 35427 H2 WAT 1437 92.588 137.461 148.045 1.00 0.00 H TER 35429 WAT 1437 ATOM 35429 O WAT 1438 60.197 101.527 76.539 1.00 0.00 O ATOM 35430 H1 WAT 1438 59.636 102.204 76.919 1.00 0.00 H ATOM 35431 H2 WAT 1438 60.626 101.959 75.800 1.00 0.00 H TER 35433 WAT 1438 ATOM 35433 O WAT 1439 104.984 110.166 128.190 1.00 0.00 O ATOM 35434 H1 WAT 1439 105.849 110.193 127.782 1.00 0.00 H ATOM 35435 H2 WAT 1439 105.110 110.574 129.046 1.00 0.00 H TER 35437 WAT 1439 ATOM 35437 O WAT 1440 122.101 7.662 66.240 1.00 0.00 O ATOM 35438 H1 WAT 1440 121.754 7.430 65.379 1.00 0.00 H ATOM 35439 H2 WAT 1440 121.325 7.821 66.777 1.00 0.00 H TER 35441 WAT 1440 ATOM 35441 O WAT 1441 41.780 7.906 57.238 1.00 0.00 O ATOM 35442 H1 WAT 1441 42.147 7.179 57.740 1.00 0.00 H ATOM 35443 H2 WAT 1441 42.129 7.786 56.354 1.00 0.00 H TER 35445 WAT 1441 ATOM 35445 O WAT 1442 62.790 19.778 78.356 1.00 0.00 O ATOM 35446 H1 WAT 1442 63.494 19.157 78.171 1.00 0.00 H ATOM 35447 H2 WAT 1442 62.020 19.230 78.508 1.00 0.00 H TER 35449 WAT 1442 ATOM 35449 O WAT 1443 5.329 71.515 8.037 1.00 0.00 O ATOM 35450 H1 WAT 1443 5.196 72.463 8.037 1.00 0.00 H ATOM 35451 H2 WAT 1443 6.259 71.404 7.838 1.00 0.00 H TER 35453 WAT 1443 ATOM 35453 O WAT 1444 77.860 6.431 138.953 1.00 0.00 O ATOM 35454 H1 WAT 1444 78.029 7.370 139.031 1.00 0.00 H ATOM 35455 H2 WAT 1444 77.047 6.293 139.438 1.00 0.00 H TER 35457 WAT 1444 ATOM 35457 O WAT 1445 115.692 71.269 102.278 1.00 0.00 O ATOM 35458 H1 WAT 1445 116.141 70.677 101.674 1.00 0.00 H ATOM 35459 H2 WAT 1445 115.430 72.012 101.735 1.00 0.00 H TER 35461 WAT 1445 ATOM 35461 O WAT 1446 49.219 109.533 152.994 1.00 0.00 O ATOM 35462 H1 WAT 1446 48.906 109.778 152.123 1.00 0.00 H ATOM 35463 H2 WAT 1446 48.731 108.739 153.210 1.00 0.00 H TER 35465 WAT 1446 ATOM 35465 O WAT 1447 45.631 40.962 142.044 1.00 0.00 O ATOM 35466 H1 WAT 1447 44.807 41.407 141.846 1.00 0.00 H ATOM 35467 H2 WAT 1447 45.398 40.034 142.085 1.00 0.00 H TER 35469 WAT 1447 ATOM 35469 O WAT 1448 74.722 103.467 1.509 1.00 0.00 O ATOM 35470 H1 WAT 1448 74.307 103.742 0.691 1.00 0.00 H ATOM 35471 H2 WAT 1448 75.068 104.277 1.886 1.00 0.00 H TER 35473 WAT 1448 ATOM 35473 O WAT 1449 113.917 125.309 63.495 1.00 0.00 O ATOM 35474 H1 WAT 1449 113.285 125.536 62.813 1.00 0.00 H ATOM 35475 H2 WAT 1449 114.736 125.709 63.205 1.00 0.00 H TER 35477 WAT 1449 ATOM 35477 O WAT 1450 129.104 17.433 56.756 1.00 0.00 O ATOM 35478 H1 WAT 1450 129.228 16.485 56.716 1.00 0.00 H ATOM 35479 H2 WAT 1450 129.875 17.755 57.225 1.00 0.00 H TER 35481 WAT 1450 ATOM 35481 O WAT 1451 137.737 108.222 82.190 1.00 0.00 O ATOM 35482 H1 WAT 1451 137.236 107.524 81.768 1.00 0.00 H ATOM 35483 H2 WAT 1451 138.533 107.791 82.502 1.00 0.00 H TER 35485 WAT 1451 ATOM 35485 O WAT 1452 145.621 105.646 81.339 1.00 0.00 O ATOM 35486 H1 WAT 1452 146.374 105.286 81.808 1.00 0.00 H ATOM 35487 H2 WAT 1452 145.240 106.278 81.949 1.00 0.00 H TER 35489 WAT 1452 ATOM 35489 O WAT 1453 81.539 64.951 111.302 1.00 0.00 O ATOM 35490 H1 WAT 1453 81.445 65.241 110.395 1.00 0.00 H ATOM 35491 H2 WAT 1453 80.721 65.214 111.723 1.00 0.00 H TER 35493 WAT 1453 ATOM 35493 O WAT 1454 61.108 81.960 78.072 1.00 0.00 O ATOM 35494 H1 WAT 1454 60.566 82.604 78.528 1.00 0.00 H ATOM 35495 H2 WAT 1454 60.480 81.388 77.631 1.00 0.00 H TER 35497 WAT 1454 ATOM 35497 O WAT 1455 20.239 93.122 136.911 1.00 0.00 O ATOM 35498 H1 WAT 1455 19.758 92.775 136.160 1.00 0.00 H ATOM 35499 H2 WAT 1455 21.158 92.940 136.713 1.00 0.00 H TER 35501 WAT 1455 ATOM 35501 O WAT 1456 71.887 45.932 74.697 1.00 0.00 O ATOM 35502 H1 WAT 1456 72.831 46.019 74.834 1.00 0.00 H ATOM 35503 H2 WAT 1456 71.576 46.831 74.591 1.00 0.00 H TER 35505 WAT 1456 ATOM 35505 O WAT 1457 113.055 110.439 3.669 1.00 0.00 O ATOM 35506 H1 WAT 1457 113.957 110.317 3.373 1.00 0.00 H ATOM 35507 H2 WAT 1457 112.521 110.044 2.980 1.00 0.00 H TER 35509 WAT 1457 ATOM 35509 O WAT 1458 126.084 89.886 115.164 1.00 0.00 O ATOM 35510 H1 WAT 1458 125.586 90.594 114.756 1.00 0.00 H ATOM 35511 H2 WAT 1458 126.932 89.901 114.720 1.00 0.00 H TER 35513 WAT 1458 ATOM 35513 O WAT 1459 32.339 141.345 84.431 1.00 0.00 O ATOM 35514 H1 WAT 1459 31.417 141.141 84.592 1.00 0.00 H ATOM 35515 H2 WAT 1459 32.634 141.769 85.237 1.00 0.00 H TER 35517 WAT 1459 ATOM 35517 O WAT 1460 99.856 119.499 6.403 1.00 0.00 O ATOM 35518 H1 WAT 1460 99.506 120.234 5.899 1.00 0.00 H ATOM 35519 H2 WAT 1460 100.758 119.405 6.096 1.00 0.00 H TER 35521 WAT 1460 ATOM 35521 O WAT 1461 25.559 103.764 125.784 1.00 0.00 O ATOM 35522 H1 WAT 1461 24.757 103.645 125.276 1.00 0.00 H ATOM 35523 H2 WAT 1461 25.481 104.644 126.152 1.00 0.00 H TER 35525 WAT 1461 ATOM 35525 O WAT 1462 138.048 134.726 131.649 1.00 0.00 O ATOM 35526 H1 WAT 1462 138.364 135.186 130.871 1.00 0.00 H ATOM 35527 H2 WAT 1462 137.244 135.187 131.890 1.00 0.00 H TER 35529 WAT 1462 ATOM 35529 O WAT 1463 104.889 39.401 13.016 1.00 0.00 O ATOM 35530 H1 WAT 1463 104.442 40.216 12.787 1.00 0.00 H ATOM 35531 H2 WAT 1463 104.639 39.237 13.925 1.00 0.00 H TER 35533 WAT 1463 ATOM 35533 O WAT 1464 43.460 101.323 88.743 1.00 0.00 O ATOM 35534 H1 WAT 1464 43.860 101.986 89.305 1.00 0.00 H ATOM 35535 H2 WAT 1464 44.166 101.047 88.158 1.00 0.00 H TER 35537 WAT 1464 ATOM 35537 O WAT 1465 120.254 6.427 121.175 1.00 0.00 O ATOM 35538 H1 WAT 1465 120.503 6.742 120.306 1.00 0.00 H ATOM 35539 H2 WAT 1465 119.748 7.146 121.554 1.00 0.00 H TER 35541 WAT 1465 ATOM 35541 O WAT 1466 137.888 96.583 86.522 1.00 0.00 O ATOM 35542 H1 WAT 1466 137.753 97.131 85.748 1.00 0.00 H ATOM 35543 H2 WAT 1466 138.833 96.431 86.546 1.00 0.00 H TER 35545 WAT 1466 ATOM 35545 O WAT 1467 59.337 42.106 71.593 1.00 0.00 O ATOM 35546 H1 WAT 1467 58.859 41.278 71.557 1.00 0.00 H ATOM 35547 H2 WAT 1467 59.358 42.410 70.685 1.00 0.00 H TER 35549 WAT 1467 ATOM 35549 O WAT 1468 34.275 109.670 83.131 1.00 0.00 O ATOM 35550 H1 WAT 1468 34.473 110.500 83.565 1.00 0.00 H ATOM 35551 H2 WAT 1468 34.943 109.591 82.450 1.00 0.00 H TER 35553 WAT 1468 ATOM 35553 O WAT 1469 100.489 30.254 67.532 1.00 0.00 O ATOM 35554 H1 WAT 1469 101.255 30.702 67.891 1.00 0.00 H ATOM 35555 H2 WAT 1469 99.746 30.640 67.996 1.00 0.00 H TER 35557 WAT 1469 ATOM 35557 O WAT 1470 136.351 8.830 78.259 1.00 0.00 O ATOM 35558 H1 WAT 1470 136.959 9.082 78.954 1.00 0.00 H ATOM 35559 H2 WAT 1470 135.964 9.656 77.969 1.00 0.00 H TER 35561 WAT 1470 ATOM 35561 O WAT 1471 62.568 36.640 131.825 1.00 0.00 O ATOM 35562 H1 WAT 1471 63.360 36.777 131.305 1.00 0.00 H ATOM 35563 H2 WAT 1471 62.339 35.722 131.676 1.00 0.00 H TER 35565 WAT 1471 ATOM 35565 O WAT 1472 83.176 53.446 20.156 1.00 0.00 O ATOM 35566 H1 WAT 1472 82.967 52.708 19.583 1.00 0.00 H ATOM 35567 H2 WAT 1472 82.768 54.201 19.733 1.00 0.00 H TER 35569 WAT 1472 ATOM 35569 O WAT 1473 124.524 136.858 17.148 1.00 0.00 O ATOM 35570 H1 WAT 1473 125.209 137.039 17.792 1.00 0.00 H ATOM 35571 H2 WAT 1473 124.470 135.903 17.117 1.00 0.00 H TER 35573 WAT 1473 ATOM 35573 O WAT 1474 4.932 84.050 156.052 1.00 0.00 O ATOM 35574 H1 WAT 1474 5.625 84.452 155.528 1.00 0.00 H ATOM 35575 H2 WAT 1474 5.264 83.176 156.257 1.00 0.00 H TER 35577 WAT 1474 ATOM 35577 O WAT 1475 109.741 144.998 88.479 1.00 0.00 O ATOM 35578 H1 WAT 1475 108.872 144.924 88.085 1.00 0.00 H ATOM 35579 H2 WAT 1475 109.980 145.917 88.359 1.00 0.00 H TER 35581 WAT 1475 ATOM 35581 O WAT 1476 7.608 62.577 81.499 1.00 0.00 O ATOM 35582 H1 WAT 1476 8.087 61.999 82.093 1.00 0.00 H ATOM 35583 H2 WAT 1476 6.691 62.471 81.750 1.00 0.00 H TER 35585 WAT 1476 ATOM 35585 O WAT 1477 144.270 142.206 68.236 1.00 0.00 O ATOM 35586 H1 WAT 1477 144.877 141.561 68.597 1.00 0.00 H ATOM 35587 H2 WAT 1477 144.514 142.274 67.313 1.00 0.00 H TER 35589 WAT 1477 ATOM 35589 O WAT 1478 115.222 24.339 64.247 1.00 0.00 O ATOM 35590 H1 WAT 1478 115.739 25.069 64.585 1.00 0.00 H ATOM 35591 H2 WAT 1478 114.317 24.563 64.466 1.00 0.00 H TER 35593 WAT 1478 ATOM 35593 O WAT 1479 42.043 133.478 91.335 1.00 0.00 O ATOM 35594 H1 WAT 1479 42.378 132.583 91.392 1.00 0.00 H ATOM 35595 H2 WAT 1479 41.652 133.532 90.463 1.00 0.00 H TER 35597 WAT 1479 ATOM 35597 O WAT 1480 118.249 98.819 14.699 1.00 0.00 O ATOM 35598 H1 WAT 1480 118.957 98.732 14.061 1.00 0.00 H ATOM 35599 H2 WAT 1480 118.609 99.387 15.381 1.00 0.00 H TER 35601 WAT 1480 ATOM 35601 O WAT 1481 4.247 55.382 2.742 1.00 0.00 O ATOM 35602 H1 WAT 1481 4.504 56.296 2.863 1.00 0.00 H ATOM 35603 H2 WAT 1481 4.617 55.140 1.893 1.00 0.00 H TER 35605 WAT 1481 ATOM 35605 O WAT 1482 25.860 140.564 150.820 1.00 0.00 O ATOM 35606 H1 WAT 1482 25.358 140.761 151.611 1.00 0.00 H ATOM 35607 H2 WAT 1482 25.553 141.205 150.177 1.00 0.00 H TER 35609 WAT 1482 ATOM 35609 O WAT 1483 129.853 20.682 119.368 1.00 0.00 O ATOM 35610 H1 WAT 1483 129.572 21.446 119.872 1.00 0.00 H ATOM 35611 H2 WAT 1483 129.105 20.085 119.400 1.00 0.00 H TER 35613 WAT 1483 ATOM 35613 O WAT 1484 53.296 81.983 83.941 1.00 0.00 O ATOM 35614 H1 WAT 1484 52.397 82.109 83.639 1.00 0.00 H ATOM 35615 H2 WAT 1484 53.471 81.054 83.791 1.00 0.00 H TER 35617 WAT 1484 ATOM 35617 O WAT 1485 81.753 98.626 22.483 1.00 0.00 O ATOM 35618 H1 WAT 1485 81.610 99.445 22.958 1.00 0.00 H ATOM 35619 H2 WAT 1485 82.630 98.716 22.110 1.00 0.00 H TER 35621 WAT 1485 ATOM 35621 O WAT 1486 70.959 130.317 153.801 1.00 0.00 O ATOM 35622 H1 WAT 1486 71.561 129.646 154.122 1.00 0.00 H ATOM 35623 H2 WAT 1486 70.186 130.233 154.360 1.00 0.00 H TER 35625 WAT 1486 ATOM 35625 O WAT 1487 20.039 134.066 132.699 1.00 0.00 O ATOM 35626 H1 WAT 1487 20.624 133.463 133.157 1.00 0.00 H ATOM 35627 H2 WAT 1487 20.515 134.302 131.902 1.00 0.00 H TER 35629 WAT 1487 ATOM 35629 O WAT 1488 2.043 116.163 157.870 1.00 0.00 O ATOM 35630 H1 WAT 1488 1.303 116.766 157.808 1.00 0.00 H ATOM 35631 H2 WAT 1488 1.658 115.342 158.179 1.00 0.00 H TER 35633 WAT 1488 ATOM 35633 O WAT 1489 140.578 92.074 20.310 1.00 0.00 O ATOM 35634 H1 WAT 1489 140.379 92.454 21.166 1.00 0.00 H ATOM 35635 H2 WAT 1489 139.916 91.392 20.192 1.00 0.00 H TER 35637 WAT 1489 ATOM 35637 O WAT 1490 18.212 117.444 64.727 1.00 0.00 O ATOM 35638 H1 WAT 1490 18.149 116.516 64.498 1.00 0.00 H ATOM 35639 H2 WAT 1490 19.153 117.614 64.780 1.00 0.00 H TER 35641 WAT 1490 ATOM 35641 O WAT 1491 128.652 85.925 66.747 1.00 0.00 O ATOM 35642 H1 WAT 1491 127.853 86.234 66.319 1.00 0.00 H ATOM 35643 H2 WAT 1491 129.356 86.419 66.326 1.00 0.00 H TER 35645 WAT 1491 ATOM 35645 O WAT 1492 17.770 128.129 17.585 1.00 0.00 O ATOM 35646 H1 WAT 1492 16.941 127.659 17.674 1.00 0.00 H ATOM 35647 H2 WAT 1492 17.516 129.048 17.500 1.00 0.00 H TER 35649 WAT 1492 ATOM 35649 O WAT 1493 88.137 95.109 90.701 1.00 0.00 O ATOM 35650 H1 WAT 1493 87.770 95.451 89.886 1.00 0.00 H ATOM 35651 H2 WAT 1493 87.617 95.522 91.390 1.00 0.00 H TER 35653 WAT 1493 ATOM 35653 O WAT 1494 106.750 3.906 15.953 1.00 0.00 O ATOM 35654 H1 WAT 1494 106.116 3.563 16.583 1.00 0.00 H ATOM 35655 H2 WAT 1494 107.600 3.634 16.297 1.00 0.00 H TER 35657 WAT 1494 ATOM 35657 O WAT 1495 38.707 30.661 138.478 1.00 0.00 O ATOM 35658 H1 WAT 1495 38.024 30.154 138.917 1.00 0.00 H ATOM 35659 H2 WAT 1495 39.236 30.007 138.022 1.00 0.00 H TER 35661 WAT 1495 ATOM 35661 O WAT 1496 74.790 51.975 68.871 1.00 0.00 O ATOM 35662 H1 WAT 1496 75.365 51.242 68.651 1.00 0.00 H ATOM 35663 H2 WAT 1496 73.908 51.652 68.685 1.00 0.00 H TER 35665 WAT 1496 ATOM 35665 O WAT 1497 57.977 50.019 64.291 1.00 0.00 O ATOM 35666 H1 WAT 1497 57.551 50.873 64.217 1.00 0.00 H ATOM 35667 H2 WAT 1497 58.772 50.102 63.765 1.00 0.00 H TER 35669 WAT 1497 ATOM 35669 O WAT 1498 140.107 122.022 71.487 1.00 0.00 O ATOM 35670 H1 WAT 1498 139.845 122.080 70.568 1.00 0.00 H ATOM 35671 H2 WAT 1498 139.420 121.498 71.899 1.00 0.00 H TER 35673 WAT 1498 ATOM 35673 O WAT 1499 18.572 92.154 144.205 1.00 0.00 O ATOM 35674 H1 WAT 1499 18.034 92.937 144.088 1.00 0.00 H ATOM 35675 H2 WAT 1499 18.449 91.654 143.399 1.00 0.00 H TER 35677 WAT 1499 ATOM 35677 O WAT 1500 39.653 33.581 77.106 1.00 0.00 O ATOM 35678 H1 WAT 1500 40.429 34.070 77.380 1.00 0.00 H ATOM 35679 H2 WAT 1500 39.746 33.498 76.157 1.00 0.00 H TER 35681 WAT 1500 ATOM 35681 O WAT 1501 100.013 85.969 141.821 1.00 0.00 O ATOM 35682 H1 WAT 1501 99.134 86.320 141.966 1.00 0.00 H ATOM 35683 H2 WAT 1501 99.868 85.052 141.584 1.00 0.00 H TER 35685 WAT 1501 ATOM 35685 O WAT 1502 103.325 75.595 123.005 1.00 0.00 O ATOM 35686 H1 WAT 1502 102.636 74.940 122.891 1.00 0.00 H ATOM 35687 H2 WAT 1502 103.532 75.882 122.116 1.00 0.00 H TER 35689 WAT 1502 ATOM 35689 O WAT 1503 95.003 91.514 147.152 1.00 0.00 O ATOM 35690 H1 WAT 1503 95.540 90.809 147.514 1.00 0.00 H ATOM 35691 H2 WAT 1503 95.628 92.088 146.710 1.00 0.00 H TER 35693 WAT 1503 ATOM 35693 O WAT 1504 13.337 26.898 138.583 1.00 0.00 O ATOM 35694 H1 WAT 1504 12.662 27.427 139.008 1.00 0.00 H ATOM 35695 H2 WAT 1504 13.312 27.169 137.666 1.00 0.00 H TER 35697 WAT 1504 ATOM 35697 O WAT 1505 11.672 13.229 142.027 1.00 0.00 O ATOM 35698 H1 WAT 1505 11.307 12.601 141.404 1.00 0.00 H ATOM 35699 H2 WAT 1505 11.343 14.078 141.731 1.00 0.00 H TER 35701 WAT 1505 ATOM 35701 O WAT 1506 99.619 71.031 158.332 1.00 0.00 O ATOM 35702 H1 WAT 1506 99.851 71.898 158.001 1.00 0.00 H ATOM 35703 H2 WAT 1506 99.946 70.425 157.667 1.00 0.00 H TER 35705 WAT 1506 ATOM 35705 O WAT 1507 116.202 7.654 153.379 1.00 0.00 O ATOM 35706 H1 WAT 1507 115.247 7.671 153.436 1.00 0.00 H ATOM 35707 H2 WAT 1507 116.416 6.737 153.207 1.00 0.00 H TER 35709 WAT 1507 ATOM 35709 O WAT 1508 20.843 107.863 9.961 1.00 0.00 O ATOM 35710 H1 WAT 1508 21.652 107.493 10.315 1.00 0.00 H ATOM 35711 H2 WAT 1508 20.203 107.758 10.665 1.00 0.00 H TER 35713 WAT 1508 ATOM 35713 O WAT 1509 8.281 72.455 139.375 1.00 0.00 O ATOM 35714 H1 WAT 1509 9.179 72.475 139.044 1.00 0.00 H ATOM 35715 H2 WAT 1509 7.927 71.626 139.055 1.00 0.00 H TER 35717 WAT 1509 ATOM 35717 O WAT 1510 32.657 20.244 118.163 1.00 0.00 O ATOM 35718 H1 WAT 1510 32.379 19.387 118.487 1.00 0.00 H ATOM 35719 H2 WAT 1510 32.979 20.072 117.278 1.00 0.00 H TER 35721 WAT 1510 ATOM 35721 O WAT 1511 22.422 7.387 83.995 1.00 0.00 O ATOM 35722 H1 WAT 1511 22.136 6.695 83.399 1.00 0.00 H ATOM 35723 H2 WAT 1511 21.756 7.403 84.682 1.00 0.00 H TER 35725 WAT 1511 ATOM 35725 O WAT 1512 40.384 2.843 27.315 1.00 0.00 O ATOM 35726 H1 WAT 1512 41.036 3.523 27.487 1.00 0.00 H ATOM 35727 H2 WAT 1512 39.555 3.228 27.598 1.00 0.00 H TER 35729 WAT 1512 ATOM 35729 O WAT 1513 138.574 121.681 98.522 1.00 0.00 O ATOM 35730 H1 WAT 1513 139.499 121.668 98.768 1.00 0.00 H ATOM 35731 H2 WAT 1513 138.464 120.911 97.964 1.00 0.00 H TER 35733 WAT 1513 ATOM 35733 O WAT 1514 96.644 107.722 88.529 1.00 0.00 O ATOM 35734 H1 WAT 1514 97.098 107.238 87.839 1.00 0.00 H ATOM 35735 H2 WAT 1514 96.832 108.641 88.341 1.00 0.00 H TER 35737 WAT 1514 ATOM 35737 O WAT 1515 18.823 78.896 87.545 1.00 0.00 O ATOM 35738 H1 WAT 1515 18.858 78.429 86.710 1.00 0.00 H ATOM 35739 H2 WAT 1515 17.898 79.112 87.660 1.00 0.00 H TER 35741 WAT 1515 ATOM 35741 O WAT 1516 8.503 67.155 111.857 1.00 0.00 O ATOM 35742 H1 WAT 1516 8.713 68.085 111.774 1.00 0.00 H ATOM 35743 H2 WAT 1516 7.547 67.128 111.902 1.00 0.00 H TER 35745 WAT 1516 ATOM 35745 O WAT 1517 130.821 113.849 85.492 1.00 0.00 O ATOM 35746 H1 WAT 1517 131.554 113.431 85.945 1.00 0.00 H ATOM 35747 H2 WAT 1517 130.921 113.582 84.579 1.00 0.00 H TER 35749 WAT 1517 ATOM 35749 O WAT 1518 10.090 82.406 69.702 1.00 0.00 O ATOM 35750 H1 WAT 1518 9.353 81.820 69.879 1.00 0.00 H ATOM 35751 H2 WAT 1518 10.561 82.455 70.534 1.00 0.00 H TER 35753 WAT 1518 ATOM 35753 O WAT 1519 64.567 31.418 109.888 1.00 0.00 O ATOM 35754 H1 WAT 1519 65.410 30.975 109.987 1.00 0.00 H ATOM 35755 H2 WAT 1519 64.794 32.337 109.747 1.00 0.00 H TER 35757 WAT 1519 ATOM 35757 O WAT 1520 36.046 110.440 73.085 1.00 0.00 O ATOM 35758 H1 WAT 1520 35.377 110.679 73.726 1.00 0.00 H ATOM 35759 H2 WAT 1520 36.516 109.710 73.490 1.00 0.00 H TER 35761 WAT 1520 ATOM 35761 O WAT 1521 35.358 3.164 120.534 1.00 0.00 O ATOM 35762 H1 WAT 1521 35.175 3.835 121.191 1.00 0.00 H ATOM 35763 H2 WAT 1521 34.646 3.249 119.900 1.00 0.00 H TER 35765 WAT 1521 ATOM 35765 O WAT 1522 103.579 85.078 152.630 1.00 0.00 O ATOM 35766 H1 WAT 1522 104.036 85.399 151.853 1.00 0.00 H ATOM 35767 H2 WAT 1522 103.332 84.180 152.408 1.00 0.00 H TER 35769 WAT 1522 ATOM 35769 O WAT 1523 127.947 106.602 143.873 1.00 0.00 O ATOM 35770 H1 WAT 1523 128.709 107.091 143.562 1.00 0.00 H ATOM 35771 H2 WAT 1523 128.064 106.554 144.822 1.00 0.00 H TER 35773 WAT 1523 ATOM 35773 O WAT 1524 91.054 79.264 82.399 1.00 0.00 O ATOM 35774 H1 WAT 1524 91.568 79.924 82.864 1.00 0.00 H ATOM 35775 H2 WAT 1524 90.422 78.953 83.046 1.00 0.00 H TER 35777 WAT 1524 ATOM 35777 O WAT 1525 12.461 115.644 133.897 1.00 0.00 O ATOM 35778 H1 WAT 1525 11.921 116.379 133.607 1.00 0.00 H ATOM 35779 H2 WAT 1525 12.074 115.377 134.731 1.00 0.00 H TER 35781 WAT 1525 ATOM 35781 O WAT 1526 135.734 75.591 104.810 1.00 0.00 O ATOM 35782 H1 WAT 1526 136.192 75.288 105.594 1.00 0.00 H ATOM 35783 H2 WAT 1526 135.100 76.230 105.136 1.00 0.00 H TER 35785 WAT 1526 ATOM 35785 O WAT 1527 42.292 37.085 13.372 1.00 0.00 O ATOM 35786 H1 WAT 1527 42.308 37.807 14.001 1.00 0.00 H ATOM 35787 H2 WAT 1527 41.657 37.359 12.710 1.00 0.00 H TER 35789 WAT 1527 ATOM 35789 O WAT 1528 121.969 39.899 108.352 1.00 0.00 O ATOM 35790 H1 WAT 1528 122.525 39.675 109.099 1.00 0.00 H ATOM 35791 H2 WAT 1528 121.117 39.520 108.567 1.00 0.00 H TER 35793 WAT 1528 ATOM 35793 O WAT 1529 102.740 86.911 77.570 1.00 0.00 O ATOM 35794 H1 WAT 1529 102.306 86.556 78.346 1.00 0.00 H ATOM 35795 H2 WAT 1529 103.636 87.088 77.858 1.00 0.00 H TER 35797 WAT 1529 ATOM 35797 O WAT 1530 119.587 6.726 99.162 1.00 0.00 O ATOM 35798 H1 WAT 1530 120.503 6.500 99.321 1.00 0.00 H ATOM 35799 H2 WAT 1530 119.246 6.966 100.023 1.00 0.00 H TER 35801 WAT 1530 ATOM 35801 O WAT 1531 25.424 123.880 107.346 1.00 0.00 O ATOM 35802 H1 WAT 1531 26.266 123.462 107.167 1.00 0.00 H ATOM 35803 H2 WAT 1531 24.802 123.153 107.395 1.00 0.00 H TER 35805 WAT 1531 ATOM 35805 O WAT 1532 112.095 32.246 152.193 1.00 0.00 O ATOM 35806 H1 WAT 1532 111.815 33.092 152.544 1.00 0.00 H ATOM 35807 H2 WAT 1532 112.323 32.429 151.281 1.00 0.00 H TER 35809 WAT 1532 ATOM 35809 O WAT 1533 36.308 66.547 146.492 1.00 0.00 O ATOM 35810 H1 WAT 1533 35.394 66.631 146.761 1.00 0.00 H ATOM 35811 H2 WAT 1533 36.726 66.069 147.208 1.00 0.00 H TER 35813 WAT 1533 ATOM 35813 O WAT 1534 10.974 56.774 19.238 1.00 0.00 O ATOM 35814 H1 WAT 1534 11.815 56.507 18.866 1.00 0.00 H ATOM 35815 H2 WAT 1534 10.771 57.601 18.801 1.00 0.00 H TER 35817 WAT 1534 ATOM 35817 O WAT 1535 136.045 36.978 107.963 1.00 0.00 O ATOM 35818 H1 WAT 1535 135.668 37.810 108.250 1.00 0.00 H ATOM 35819 H2 WAT 1535 135.687 36.330 108.569 1.00 0.00 H TER 35821 WAT 1535 ATOM 35821 O WAT 1536 14.638 45.345 83.183 1.00 0.00 O ATOM 35822 H1 WAT 1536 15.202 46.000 82.773 1.00 0.00 H ATOM 35823 H2 WAT 1536 13.755 45.708 83.108 1.00 0.00 H TER 35825 WAT 1536 ATOM 35825 O WAT 1537 114.407 13.060 81.916 1.00 0.00 O ATOM 35826 H1 WAT 1537 113.603 12.670 81.571 1.00 0.00 H ATOM 35827 H2 WAT 1537 115.002 13.085 81.167 1.00 0.00 H TER 35829 WAT 1537 ATOM 35829 O WAT 1538 12.514 44.709 151.285 1.00 0.00 O ATOM 35830 H1 WAT 1538 12.872 45.592 151.381 1.00 0.00 H ATOM 35831 H2 WAT 1538 12.521 44.350 152.172 1.00 0.00 H TER 35833 WAT 1538 ATOM 35833 O WAT 1539 1.873 43.267 149.293 1.00 0.00 O ATOM 35834 H1 WAT 1539 1.753 42.594 149.963 1.00 0.00 H ATOM 35835 H2 WAT 1539 2.757 43.118 148.958 1.00 0.00 H TER 35837 WAT 1539 ATOM 35837 O WAT 1540 6.698 92.989 3.961 1.00 0.00 O ATOM 35838 H1 WAT 1540 6.186 92.487 3.327 1.00 0.00 H ATOM 35839 H2 WAT 1540 6.890 92.366 4.661 1.00 0.00 H TER 35841 WAT 1540 ATOM 35841 O WAT 1541 35.421 107.029 97.909 1.00 0.00 O ATOM 35842 H1 WAT 1541 35.994 107.753 97.660 1.00 0.00 H ATOM 35843 H2 WAT 1541 34.913 106.842 97.119 1.00 0.00 H TER 35845 WAT 1541 ATOM 35845 O WAT 1542 68.530 122.340 12.628 1.00 0.00 O ATOM 35846 H1 WAT 1542 69.150 123.067 12.687 1.00 0.00 H ATOM 35847 H2 WAT 1542 67.707 122.700 12.959 1.00 0.00 H TER 35849 WAT 1542 ATOM 35849 O WAT 1543 101.682 59.450 141.960 1.00 0.00 O ATOM 35850 H1 WAT 1543 102.545 59.170 142.265 1.00 0.00 H ATOM 35851 H2 WAT 1543 101.764 60.397 141.846 1.00 0.00 H TER 35853 WAT 1543 ATOM 35853 O WAT 1544 60.821 50.571 14.827 1.00 0.00 O ATOM 35854 H1 WAT 1544 60.917 50.689 13.882 1.00 0.00 H ATOM 35855 H2 WAT 1544 61.683 50.786 15.184 1.00 0.00 H TER 35857 WAT 1544 ATOM 35857 O WAT 1545 42.168 81.318 64.613 1.00 0.00 O ATOM 35858 H1 WAT 1545 42.511 80.629 65.183 1.00 0.00 H ATOM 35859 H2 WAT 1545 42.299 80.982 63.726 1.00 0.00 H TER 35861 WAT 1545 ATOM 35861 O WAT 1546 26.337 135.721 16.370 1.00 0.00 O ATOM 35862 H1 WAT 1546 26.525 134.856 16.734 1.00 0.00 H ATOM 35863 H2 WAT 1546 26.005 135.544 15.491 1.00 0.00 H TER 35865 WAT 1546 ATOM 35865 O WAT 1547 123.702 66.890 68.470 1.00 0.00 O ATOM 35866 H1 WAT 1547 122.951 66.915 67.877 1.00 0.00 H ATOM 35867 H2 WAT 1547 124.448 66.692 67.904 1.00 0.00 H TER 35869 WAT 1547 ATOM 35869 O WAT 1548 53.885 95.920 77.353 1.00 0.00 O ATOM 35870 H1 WAT 1548 53.799 96.851 77.558 1.00 0.00 H ATOM 35871 H2 WAT 1548 53.652 95.472 78.166 1.00 0.00 H TER 35873 WAT 1548 ATOM 35873 O WAT 1549 28.945 135.876 156.946 1.00 0.00 O ATOM 35874 H1 WAT 1549 28.931 135.271 156.205 1.00 0.00 H ATOM 35875 H2 WAT 1549 28.399 135.456 157.610 1.00 0.00 H TER 35877 WAT 1549 ATOM 35877 O WAT 1550 4.721 7.330 141.866 1.00 0.00 O ATOM 35878 H1 WAT 1550 4.549 7.702 142.731 1.00 0.00 H ATOM 35879 H2 WAT 1550 3.853 7.200 141.484 1.00 0.00 H TER 35881 WAT 1550 ATOM 35881 O WAT 1551 53.256 140.364 92.227 1.00 0.00 O ATOM 35882 H1 WAT 1551 52.442 140.824 92.436 1.00 0.00 H ATOM 35883 H2 WAT 1551 53.246 140.279 91.274 1.00 0.00 H TER 35885 WAT 1551 ATOM 35885 O WAT 1552 54.262 21.562 87.404 1.00 0.00 O ATOM 35886 H1 WAT 1552 53.852 20.918 86.826 1.00 0.00 H ATOM 35887 H2 WAT 1552 53.528 21.978 87.857 1.00 0.00 H TER 35889 WAT 1552 ATOM 35889 O WAT 1553 114.936 31.560 79.705 1.00 0.00 O ATOM 35890 H1 WAT 1553 114.385 32.343 79.722 1.00 0.00 H ATOM 35891 H2 WAT 1553 115.657 31.761 80.301 1.00 0.00 H TER 35893 WAT 1553 ATOM 35893 O WAT 1554 100.198 117.970 138.360 1.00 0.00 O ATOM 35894 H1 WAT 1554 100.747 118.357 137.677 1.00 0.00 H ATOM 35895 H2 WAT 1554 99.653 118.694 138.668 1.00 0.00 H TER 35897 WAT 1554 ATOM 35897 O WAT 1555 67.925 42.754 128.055 1.00 0.00 O ATOM 35898 H1 WAT 1555 68.772 43.198 128.015 1.00 0.00 H ATOM 35899 H2 WAT 1555 67.690 42.604 127.139 1.00 0.00 H TER 35901 WAT 1555 ATOM 35901 O WAT 1556 13.047 139.870 74.006 1.00 0.00 O ATOM 35902 H1 WAT 1556 13.699 140.497 74.317 1.00 0.00 H ATOM 35903 H2 WAT 1556 12.299 139.991 74.590 1.00 0.00 H TER 35905 WAT 1556 ATOM 35905 O WAT 1557 42.319 142.012 131.076 1.00 0.00 O ATOM 35906 H1 WAT 1557 41.466 141.627 130.876 1.00 0.00 H ATOM 35907 H2 WAT 1557 42.940 141.292 130.965 1.00 0.00 H TER 35909 WAT 1557 ATOM 35909 O WAT 1558 49.619 110.402 123.388 1.00 0.00 O ATOM 35910 H1 WAT 1558 48.784 109.934 123.372 1.00 0.00 H ATOM 35911 H2 WAT 1558 49.408 111.279 123.070 1.00 0.00 H TER 35913 WAT 1558 ATOM 35913 O WAT 1559 70.024 118.654 110.851 1.00 0.00 O ATOM 35914 H1 WAT 1559 69.443 117.936 110.598 1.00 0.00 H ATOM 35915 H2 WAT 1559 70.894 118.366 110.576 1.00 0.00 H TER 35917 WAT 1559 ATOM 35917 O WAT 1560 25.913 55.890 118.903 1.00 0.00 O ATOM 35918 H1 WAT 1560 25.848 55.098 118.371 1.00 0.00 H ATOM 35919 H2 WAT 1560 25.754 56.606 118.288 1.00 0.00 H TER 35921 WAT 1560 ATOM 35921 O WAT 1561 29.582 76.342 127.925 1.00 0.00 O ATOM 35922 H1 WAT 1561 29.021 76.850 127.340 1.00 0.00 H ATOM 35923 H2 WAT 1561 29.285 76.575 128.805 1.00 0.00 H TER 35925 WAT 1561 ATOM 35925 O WAT 1562 39.515 127.792 132.662 1.00 0.00 O ATOM 35926 H1 WAT 1562 39.426 128.675 133.021 1.00 0.00 H ATOM 35927 H2 WAT 1562 38.972 127.799 131.874 1.00 0.00 H TER 35929 WAT 1562 ATOM 35929 O WAT 1563 14.392 58.653 113.685 1.00 0.00 O ATOM 35930 H1 WAT 1563 14.594 57.762 113.971 1.00 0.00 H ATOM 35931 H2 WAT 1563 15.238 59.018 113.425 1.00 0.00 H TER 35933 WAT 1563 ATOM 35933 O WAT 1564 122.567 69.881 88.780 1.00 0.00 O ATOM 35934 H1 WAT 1564 122.224 69.235 88.162 1.00 0.00 H ATOM 35935 H2 WAT 1564 123.517 69.781 88.727 1.00 0.00 H TER 35937 WAT 1564 ATOM 35937 O WAT 1565 12.273 78.527 88.354 1.00 0.00 O ATOM 35938 H1 WAT 1565 11.324 78.568 88.235 1.00 0.00 H ATOM 35939 H2 WAT 1565 12.395 78.509 89.303 1.00 0.00 H TER 35941 WAT 1565 ATOM 35941 O WAT 1566 114.471 34.866 102.423 1.00 0.00 O ATOM 35942 H1 WAT 1566 114.513 34.879 103.379 1.00 0.00 H ATOM 35943 H2 WAT 1566 114.161 33.987 102.208 1.00 0.00 H TER 35945 WAT 1566 ATOM 35945 O WAT 1567 23.637 3.026 106.159 1.00 0.00 O ATOM 35946 H1 WAT 1567 23.493 2.737 107.060 1.00 0.00 H ATOM 35947 H2 WAT 1567 24.571 2.881 106.008 1.00 0.00 H TER 35949 WAT 1567 ATOM 35949 O WAT 1568 26.210 61.110 12.855 1.00 0.00 O ATOM 35950 H1 WAT 1568 25.499 61.576 13.296 1.00 0.00 H ATOM 35951 H2 WAT 1568 26.719 60.721 13.565 1.00 0.00 H TER 35953 WAT 1568 ATOM 35953 O WAT 1569 102.639 92.114 109.507 1.00 0.00 O ATOM 35954 H1 WAT 1569 102.185 92.723 110.089 1.00 0.00 H ATOM 35955 H2 WAT 1569 103.022 92.671 108.830 1.00 0.00 H TER 35957 WAT 1569 ATOM 35957 O WAT 1570 65.801 99.925 108.115 1.00 0.00 O ATOM 35958 H1 WAT 1570 66.128 99.320 108.781 1.00 0.00 H ATOM 35959 H2 WAT 1570 65.038 100.337 108.520 1.00 0.00 H TER 35961 WAT 1570 ATOM 35961 O WAT 1571 41.800 61.505 145.638 1.00 0.00 O ATOM 35962 H1 WAT 1571 42.559 61.098 146.056 1.00 0.00 H ATOM 35963 H2 WAT 1571 41.126 61.510 146.318 1.00 0.00 H TER 35965 WAT 1571 ATOM 35965 O WAT 1572 100.634 94.575 64.268 1.00 0.00 O ATOM 35966 H1 WAT 1572 101.405 94.546 63.701 1.00 0.00 H ATOM 35967 H2 WAT 1572 100.942 94.239 65.109 1.00 0.00 H TER 35969 WAT 1572 ATOM 35969 O WAT 1573 22.878 5.351 7.518 1.00 0.00 O ATOM 35970 H1 WAT 1573 22.092 5.125 8.015 1.00 0.00 H ATOM 35971 H2 WAT 1573 22.707 6.233 7.189 1.00 0.00 H TER 35973 WAT 1573 ATOM 35973 O WAT 1574 91.313 113.154 96.566 1.00 0.00 O ATOM 35974 H1 WAT 1574 92.066 113.554 97.001 1.00 0.00 H ATOM 35975 H2 WAT 1574 91.386 112.222 96.771 1.00 0.00 H TER 35977 WAT 1574 ATOM 35977 O WAT 1575 25.922 81.021 89.967 1.00 0.00 O ATOM 35978 H1 WAT 1575 25.779 81.215 89.040 1.00 0.00 H ATOM 35979 H2 WAT 1575 25.415 81.687 90.432 1.00 0.00 H TER 35981 WAT 1575 ATOM 35981 O WAT 1576 64.132 24.730 7.289 1.00 0.00 O ATOM 35982 H1 WAT 1576 64.356 25.525 7.773 1.00 0.00 H ATOM 35983 H2 WAT 1576 63.350 24.395 7.728 1.00 0.00 H TER 35985 WAT 1576 ATOM 35985 O WAT 1577 4.949 2.335 83.937 1.00 0.00 O ATOM 35986 H1 WAT 1577 4.826 1.553 84.476 1.00 0.00 H ATOM 35987 H2 WAT 1577 5.899 2.438 83.879 1.00 0.00 H TER 35989 WAT 1577 ATOM 35989 O WAT 1578 129.235 109.057 150.832 1.00 0.00 O ATOM 35990 H1 WAT 1578 128.591 109.536 150.312 1.00 0.00 H ATOM 35991 H2 WAT 1578 128.810 108.927 151.680 1.00 0.00 H TER 35993 WAT 1578 ATOM 35993 O WAT 1579 83.764 81.369 74.002 1.00 0.00 O ATOM 35994 H1 WAT 1579 83.237 81.203 74.784 1.00 0.00 H ATOM 35995 H2 WAT 1579 83.359 82.136 73.598 1.00 0.00 H TER 35997 WAT 1579 ATOM 35997 O WAT 1580 68.802 106.638 65.600 1.00 0.00 O ATOM 35998 H1 WAT 1580 68.800 106.719 64.647 1.00 0.00 H ATOM 35999 H2 WAT 1580 69.721 106.503 65.828 1.00 0.00 H TER 36001 WAT 1580 ATOM 36001 O WAT 1581 35.475 15.757 145.051 1.00 0.00 O ATOM 36002 H1 WAT 1581 35.538 16.709 145.119 1.00 0.00 H ATOM 36003 H2 WAT 1581 36.095 15.525 144.359 1.00 0.00 H TER 36005 WAT 1581 ATOM 36005 O WAT 1582 30.926 138.232 120.454 1.00 0.00 O ATOM 36006 H1 WAT 1582 31.458 137.599 120.937 1.00 0.00 H ATOM 36007 H2 WAT 1582 30.107 137.769 120.276 1.00 0.00 H TER 36009 WAT 1582 ATOM 36009 O WAT 1583 122.466 129.186 127.126 1.00 0.00 O ATOM 36010 H1 WAT 1583 121.582 129.074 126.777 1.00 0.00 H ATOM 36011 H2 WAT 1583 122.966 129.553 126.397 1.00 0.00 H TER 36013 WAT 1583 ATOM 36013 O WAT 1584 118.236 72.680 2.891 1.00 0.00 O ATOM 36014 H1 WAT 1584 117.991 72.009 3.528 1.00 0.00 H ATOM 36015 H2 WAT 1584 118.124 72.255 2.041 1.00 0.00 H TER 36017 WAT 1584 ATOM 36017 O WAT 1585 137.200 74.466 27.617 1.00 0.00 O ATOM 36018 H1 WAT 1585 138.137 74.332 27.759 1.00 0.00 H ATOM 36019 H2 WAT 1585 137.074 74.309 26.681 1.00 0.00 H TER 36021 WAT 1585 ATOM 36021 O WAT 1586 88.308 25.132 119.108 1.00 0.00 O ATOM 36022 H1 WAT 1586 87.817 24.827 118.345 1.00 0.00 H ATOM 36023 H2 WAT 1586 87.851 24.747 119.856 1.00 0.00 H TER 36025 WAT 1586 ATOM 36025 O WAT 1587 12.980 2.980 120.534 1.00 0.00 O ATOM 36026 H1 WAT 1587 13.134 3.148 121.464 1.00 0.00 H ATOM 36027 H2 WAT 1587 13.849 3.021 120.136 1.00 0.00 H TER 36029 WAT 1587 ATOM 36029 O WAT 1588 69.143 16.770 124.543 1.00 0.00 O ATOM 36030 H1 WAT 1588 69.067 16.905 123.599 1.00 0.00 H ATOM 36031 H2 WAT 1588 70.073 16.899 124.730 1.00 0.00 H TER 36033 WAT 1588 ATOM 36033 O WAT 1589 83.223 9.576 3.090 1.00 0.00 O ATOM 36034 H1 WAT 1589 82.383 9.154 3.272 1.00 0.00 H ATOM 36035 H2 WAT 1589 83.516 9.903 3.941 1.00 0.00 H TER 36037 WAT 1589 ATOM 36037 O WAT 1590 42.168 58.754 20.014 1.00 0.00 O ATOM 36038 H1 WAT 1590 41.725 57.909 20.098 1.00 0.00 H ATOM 36039 H2 WAT 1590 41.716 59.324 20.636 1.00 0.00 H TER 36041 WAT 1590 ATOM 36041 O WAT 1591 0.905 96.626 15.419 1.00 0.00 O ATOM 36042 H1 WAT 1591 1.044 96.196 16.263 1.00 0.00 H ATOM 36043 H2 WAT 1591 0.715 95.909 14.814 1.00 0.00 H TER 36045 WAT 1591 ATOM 36045 O WAT 1592 33.986 5.544 112.712 1.00 0.00 O ATOM 36046 H1 WAT 1592 33.662 5.618 113.610 1.00 0.00 H ATOM 36047 H2 WAT 1592 34.924 5.384 112.809 1.00 0.00 H TER 36049 WAT 1592 ATOM 36049 O WAT 1593 29.025 90.996 141.326 1.00 0.00 O ATOM 36050 H1 WAT 1593 29.155 91.848 141.743 1.00 0.00 H ATOM 36051 H2 WAT 1593 28.879 91.201 140.403 1.00 0.00 H TER 36053 WAT 1593 ATOM 36053 O WAT 1594 23.499 102.347 67.849 1.00 0.00 O ATOM 36054 H1 WAT 1594 23.210 102.630 66.981 1.00 0.00 H ATOM 36055 H2 WAT 1594 24.404 102.062 67.719 1.00 0.00 H TER 36057 WAT 1594 ATOM 36057 O WAT 1595 16.093 103.318 64.731 1.00 0.00 O ATOM 36058 H1 WAT 1595 15.326 103.231 64.166 1.00 0.00 H ATOM 36059 H2 WAT 1595 16.165 102.471 65.170 1.00 0.00 H TER 36061 WAT 1595 ATOM 36061 O WAT 1596 46.705 57.202 61.524 1.00 0.00 O ATOM 36062 H1 WAT 1596 46.917 57.071 60.600 1.00 0.00 H ATOM 36063 H2 WAT 1596 47.209 57.976 61.778 1.00 0.00 H TER 36065 WAT 1596 ATOM 36065 O WAT 1597 20.427 30.124 64.623 1.00 0.00 O ATOM 36066 H1 WAT 1597 20.555 29.741 63.756 1.00 0.00 H ATOM 36067 H2 WAT 1597 19.618 29.726 64.945 1.00 0.00 H TER 36069 WAT 1597 ATOM 36069 O WAT 1598 130.739 127.271 109.505 1.00 0.00 O ATOM 36070 H1 WAT 1598 130.994 128.177 109.681 1.00 0.00 H ATOM 36071 H2 WAT 1598 130.360 127.295 108.627 1.00 0.00 H TER 36073 WAT 1598 ATOM 36073 O WAT 1599 68.087 89.470 138.287 1.00 0.00 O ATOM 36074 H1 WAT 1599 68.998 89.503 138.578 1.00 0.00 H ATOM 36075 H2 WAT 1599 67.873 90.376 138.065 1.00 0.00 H TER 36077 WAT 1599 ATOM 36077 O WAT 1600 15.172 97.884 12.915 1.00 0.00 O ATOM 36078 H1 WAT 1600 15.410 98.720 12.514 1.00 0.00 H ATOM 36079 H2 WAT 1600 14.217 97.854 12.859 1.00 0.00 H TER 36081 WAT 1600 ATOM 36081 O WAT 1601 92.896 12.653 109.783 1.00 0.00 O ATOM 36082 H1 WAT 1601 93.028 12.387 110.693 1.00 0.00 H ATOM 36083 H2 WAT 1601 93.726 12.452 109.351 1.00 0.00 H TER 36085 WAT 1601 ATOM 36085 O WAT 1602 129.341 134.425 10.419 1.00 0.00 O ATOM 36086 H1 WAT 1602 129.860 133.631 10.292 1.00 0.00 H ATOM 36087 H2 WAT 1602 129.723 134.841 11.192 1.00 0.00 H TER 36089 WAT 1602 ATOM 36089 O WAT 1603 61.455 61.763 146.613 1.00 0.00 O ATOM 36090 H1 WAT 1603 62.072 62.442 146.338 1.00 0.00 H ATOM 36091 H2 WAT 1603 61.824 61.421 147.427 1.00 0.00 H TER 36093 WAT 1603 ATOM 36093 O WAT 1604 86.369 101.763 153.410 1.00 0.00 O ATOM 36094 H1 WAT 1604 87.116 101.306 153.024 1.00 0.00 H ATOM 36095 H2 WAT 1604 86.548 102.690 153.253 1.00 0.00 H TER 36097 WAT 1604 ATOM 36097 O WAT 1605 18.055 26.652 84.243 1.00 0.00 O ATOM 36098 H1 WAT 1605 18.109 25.793 83.824 1.00 0.00 H ATOM 36099 H2 WAT 1605 18.932 27.023 84.145 1.00 0.00 H TER 36101 WAT 1605 ATOM 36101 O WAT 1606 31.241 14.539 110.327 1.00 0.00 O ATOM 36102 H1 WAT 1606 31.257 13.629 110.625 1.00 0.00 H ATOM 36103 H2 WAT 1606 30.310 14.749 110.251 1.00 0.00 H TER 36105 WAT 1606 ATOM 36105 O WAT 1607 93.892 133.884 114.195 1.00 0.00 O ATOM 36106 H1 WAT 1607 94.414 134.607 113.846 1.00 0.00 H ATOM 36107 H2 WAT 1607 93.082 133.906 113.686 1.00 0.00 H TER 36109 WAT 1607 ATOM 36109 O WAT 1608 3.987 72.176 82.189 1.00 0.00 O ATOM 36110 H1 WAT 1608 3.128 72.255 81.775 1.00 0.00 H ATOM 36111 H2 WAT 1608 4.515 72.861 81.777 1.00 0.00 H TER 36113 WAT 1608 ATOM 36113 O WAT 1609 90.768 25.540 56.284 1.00 0.00 O ATOM 36114 H1 WAT 1609 90.224 24.781 56.494 1.00 0.00 H ATOM 36115 H2 WAT 1609 90.244 26.293 56.556 1.00 0.00 H TER 36117 WAT 1609 ATOM 36117 O WAT 1610 116.189 132.448 115.638 1.00 0.00 O ATOM 36118 H1 WAT 1610 116.056 133.374 115.433 1.00 0.00 H ATOM 36119 H2 WAT 1610 115.798 131.981 114.900 1.00 0.00 H TER 36121 WAT 1610 ATOM 36121 O WAT 1611 123.384 18.360 87.815 1.00 0.00 O ATOM 36122 H1 WAT 1611 123.485 17.422 87.653 1.00 0.00 H ATOM 36123 H2 WAT 1611 123.984 18.776 87.196 1.00 0.00 H TER 36125 WAT 1611 ATOM 36125 O WAT 1612 124.120 57.149 124.651 1.00 0.00 O ATOM 36126 H1 WAT 1612 124.853 56.653 124.285 1.00 0.00 H ATOM 36127 H2 WAT 1612 124.516 57.697 125.328 1.00 0.00 H TER 36129 WAT 1612 ATOM 36129 O WAT 1613 78.289 75.068 23.697 1.00 0.00 O ATOM 36130 H1 WAT 1613 77.864 75.824 23.292 1.00 0.00 H ATOM 36131 H2 WAT 1613 77.575 74.449 23.856 1.00 0.00 H TER 36133 WAT 1613 ATOM 36133 O WAT 1614 103.825 107.740 143.342 1.00 0.00 O ATOM 36134 H1 WAT 1614 104.562 108.111 142.857 1.00 0.00 H ATOM 36135 H2 WAT 1614 103.063 107.916 142.790 1.00 0.00 H TER 36137 WAT 1614 ATOM 36137 O WAT 1615 129.000 35.302 63.119 1.00 0.00 O ATOM 36138 H1 WAT 1615 129.689 34.923 63.665 1.00 0.00 H ATOM 36139 H2 WAT 1615 129.152 34.931 62.250 1.00 0.00 H TER 36141 WAT 1615 ATOM 36141 O WAT 1616 77.380 2.379 80.992 1.00 0.00 O ATOM 36142 H1 WAT 1616 76.442 2.562 81.055 1.00 0.00 H ATOM 36143 H2 WAT 1616 77.587 2.506 80.066 1.00 0.00 H TER 36145 WAT 1616 ATOM 36145 O WAT 1617 102.875 63.439 112.757 1.00 0.00 O ATOM 36146 H1 WAT 1617 102.516 63.079 113.568 1.00 0.00 H ATOM 36147 H2 WAT 1617 103.762 63.714 112.988 1.00 0.00 H TER 36149 WAT 1617 ATOM 36149 O WAT 1618 21.556 142.114 86.930 1.00 0.00 O ATOM 36150 H1 WAT 1618 21.298 142.943 86.527 1.00 0.00 H ATOM 36151 H2 WAT 1618 22.406 142.297 87.330 1.00 0.00 H TER 36153 WAT 1618 ATOM 36153 O WAT 1619 105.823 88.206 114.023 1.00 0.00 O ATOM 36154 H1 WAT 1619 106.422 88.052 114.754 1.00 0.00 H ATOM 36155 H2 WAT 1619 106.397 88.365 113.273 1.00 0.00 H TER 36157 WAT 1619 ATOM 36157 O WAT 1620 75.260 20.322 120.842 1.00 0.00 O ATOM 36158 H1 WAT 1620 74.592 21.007 120.886 1.00 0.00 H ATOM 36159 H2 WAT 1620 75.026 19.714 121.543 1.00 0.00 H TER 36161 WAT 1620 ATOM 36161 O WAT 1621 96.520 14.237 147.232 1.00 0.00 O ATOM 36162 H1 WAT 1621 97.296 14.184 146.673 1.00 0.00 H ATOM 36163 H2 WAT 1621 96.111 13.375 147.155 1.00 0.00 H TER 36165 WAT 1621 ATOM 36165 O WAT 1622 71.317 49.938 13.738 1.00 0.00 O ATOM 36166 H1 WAT 1622 70.819 49.262 14.198 1.00 0.00 H ATOM 36167 H2 WAT 1622 71.732 50.446 14.436 1.00 0.00 H TER 36169 WAT 1622 ATOM 36169 O WAT 1623 80.498 30.066 134.531 1.00 0.00 O ATOM 36170 H1 WAT 1623 79.819 29.947 133.867 1.00 0.00 H ATOM 36171 H2 WAT 1623 80.943 30.875 134.276 1.00 0.00 H TER 36173 WAT 1623 ATOM 36173 O WAT 1624 48.274 72.620 99.855 1.00 0.00 O ATOM 36174 H1 WAT 1624 47.709 73.323 100.177 1.00 0.00 H ATOM 36175 H2 WAT 1624 49.000 73.074 99.425 1.00 0.00 H TER 36177 WAT 1624 ATOM 36177 O WAT 1625 143.901 2.782 132.962 1.00 0.00 O ATOM 36178 H1 WAT 1625 143.086 3.240 132.759 1.00 0.00 H ATOM 36179 H2 WAT 1625 144.556 3.199 132.402 1.00 0.00 H TER 36181 WAT 1625 ATOM 36181 O WAT 1626 93.968 28.626 97.080 1.00 0.00 O ATOM 36182 H1 WAT 1626 93.295 28.764 96.413 1.00 0.00 H ATOM 36183 H2 WAT 1626 94.337 27.767 96.874 1.00 0.00 H TER 36185 WAT 1626 ATOM 36185 O WAT 1627 140.882 23.902 65.196 1.00 0.00 O ATOM 36186 H1 WAT 1627 140.910 23.216 65.862 1.00 0.00 H ATOM 36187 H2 WAT 1627 140.084 23.720 64.699 1.00 0.00 H TER 36189 WAT 1627 ATOM 36189 O WAT 1628 58.511 129.109 134.800 1.00 0.00 O ATOM 36190 H1 WAT 1628 58.815 129.916 134.386 1.00 0.00 H ATOM 36191 H2 WAT 1628 58.494 128.467 134.090 1.00 0.00 H TER 36193 WAT 1628 ATOM 36193 O WAT 1629 108.890 124.861 138.862 1.00 0.00 O ATOM 36194 H1 WAT 1629 109.252 124.967 139.742 1.00 0.00 H ATOM 36195 H2 WAT 1629 109.317 125.544 138.345 1.00 0.00 H TER 36197 WAT 1629 ATOM 36197 O WAT 1630 114.118 97.590 26.486 1.00 0.00 O ATOM 36198 H1 WAT 1630 113.791 98.302 27.036 1.00 0.00 H ATOM 36199 H2 WAT 1630 113.376 97.358 25.928 1.00 0.00 H TER 36201 WAT 1630 ATOM 36201 O WAT 1631 57.160 76.326 75.101 1.00 0.00 O ATOM 36202 H1 WAT 1631 57.257 75.387 74.942 1.00 0.00 H ATOM 36203 H2 WAT 1631 57.947 76.715 74.718 1.00 0.00 H TER 36205 WAT 1631 ATOM 36205 O WAT 1632 75.100 106.400 82.604 1.00 0.00 O ATOM 36206 H1 WAT 1632 74.695 106.003 83.375 1.00 0.00 H ATOM 36207 H2 WAT 1632 75.969 106.668 82.901 1.00 0.00 H TER 36209 WAT 1632 ATOM 36209 O WAT 1633 23.417 128.742 76.148 1.00 0.00 O ATOM 36210 H1 WAT 1633 23.657 127.883 76.494 1.00 0.00 H ATOM 36211 H2 WAT 1633 23.172 128.574 75.238 1.00 0.00 H TER 36213 WAT 1633 ATOM 36213 O WAT 1634 8.409 76.112 83.049 1.00 0.00 O ATOM 36214 H1 WAT 1634 8.001 75.437 82.508 1.00 0.00 H ATOM 36215 H2 WAT 1634 8.363 76.906 82.517 1.00 0.00 H TER 36217 WAT 1634 ATOM 36217 O WAT 1635 20.524 139.034 76.126 1.00 0.00 O ATOM 36218 H1 WAT 1635 20.711 139.060 75.187 1.00 0.00 H ATOM 36219 H2 WAT 1635 20.707 139.923 76.430 1.00 0.00 H TER 36221 WAT 1635 ATOM 36221 O WAT 1636 51.206 38.146 95.744 1.00 0.00 O ATOM 36222 H1 WAT 1636 51.297 37.656 94.927 1.00 0.00 H ATOM 36223 H2 WAT 1636 52.035 38.615 95.837 1.00 0.00 H TER 36225 WAT 1636 ATOM 36225 O WAT 1637 43.137 84.774 78.326 1.00 0.00 O ATOM 36226 H1 WAT 1637 43.280 85.380 79.054 1.00 0.00 H ATOM 36227 H2 WAT 1637 43.901 84.893 77.762 1.00 0.00 H TER 36229 WAT 1637 ATOM 36229 O WAT 1638 69.411 81.865 148.468 1.00 0.00 O ATOM 36230 H1 WAT 1638 70.047 81.238 148.125 1.00 0.00 H ATOM 36231 H2 WAT 1638 68.564 81.435 148.354 1.00 0.00 H TER 36233 WAT 1638 ATOM 36233 O WAT 1639 143.658 92.164 72.814 1.00 0.00 O ATOM 36234 H1 WAT 1639 144.080 92.045 73.664 1.00 0.00 H ATOM 36235 H2 WAT 1639 143.062 91.419 72.735 1.00 0.00 H TER 36237 WAT 1639 ATOM 36237 O WAT 1640 21.106 0.513 81.727 1.00 0.00 O ATOM 36238 H1 WAT 1640 22.050 0.425 81.865 1.00 0.00 H ATOM 36239 H2 WAT 1640 21.029 1.035 80.928 1.00 0.00 H TER 36241 WAT 1640 ATOM 36241 O WAT 1641 118.173 105.701 91.507 1.00 0.00 O ATOM 36242 H1 WAT 1641 117.809 104.897 91.138 1.00 0.00 H ATOM 36243 H2 WAT 1641 118.137 105.569 92.454 1.00 0.00 H TER 36245 WAT 1641 ATOM 36245 O WAT 1642 90.557 74.542 142.962 1.00 0.00 O ATOM 36246 H1 WAT 1642 91.497 74.716 143.004 1.00 0.00 H ATOM 36247 H2 WAT 1642 90.319 74.288 143.854 1.00 0.00 H TER 36249 WAT 1642 ATOM 36249 O WAT 1643 84.768 75.726 10.045 1.00 0.00 O ATOM 36250 H1 WAT 1643 84.440 76.619 9.937 1.00 0.00 H ATOM 36251 H2 WAT 1643 85.504 75.813 10.652 1.00 0.00 H TER 36253 WAT 1643 ATOM 36253 O WAT 1644 12.408 125.411 97.718 1.00 0.00 O ATOM 36254 H1 WAT 1644 12.996 125.752 97.044 1.00 0.00 H ATOM 36255 H2 WAT 1644 12.109 126.188 98.190 1.00 0.00 H TER 36257 WAT 1644 ATOM 36257 O WAT 1645 114.376 97.647 122.482 1.00 0.00 O ATOM 36258 H1 WAT 1645 114.649 97.391 121.601 1.00 0.00 H ATOM 36259 H2 WAT 1645 114.715 98.536 122.589 1.00 0.00 H TER 36261 WAT 1645 ATOM 36261 O WAT 1646 120.421 75.694 86.455 1.00 0.00 O ATOM 36262 H1 WAT 1646 121.320 75.371 86.516 1.00 0.00 H ATOM 36263 H2 WAT 1646 120.438 76.309 85.721 1.00 0.00 H TER 36265 WAT 1646 ATOM 36265 O WAT 1647 81.573 84.401 158.947 1.00 0.00 O ATOM 36266 H1 WAT 1647 81.461 83.883 158.150 1.00 0.00 H ATOM 36267 H2 WAT 1647 82.174 85.102 158.695 1.00 0.00 H TER 36269 WAT 1647 ATOM 36269 O WAT 1648 120.954 118.250 122.617 1.00 0.00 O ATOM 36270 H1 WAT 1648 121.360 119.075 122.883 1.00 0.00 H ATOM 36271 H2 WAT 1648 120.046 118.324 122.909 1.00 0.00 H TER 36273 WAT 1648 ATOM 36273 O WAT 1649 90.598 62.310 17.679 1.00 0.00 O ATOM 36274 H1 WAT 1649 91.326 62.212 18.293 1.00 0.00 H ATOM 36275 H2 WAT 1649 90.970 62.793 16.942 1.00 0.00 H TER 36277 WAT 1649 ATOM 36277 O WAT 1650 34.384 134.674 13.127 1.00 0.00 O ATOM 36278 H1 WAT 1650 33.878 134.063 13.664 1.00 0.00 H ATOM 36279 H2 WAT 1650 35.130 134.160 12.818 1.00 0.00 H TER 36281 WAT 1650 ATOM 36281 O WAT 1651 54.329 91.522 108.045 1.00 0.00 O ATOM 36282 H1 WAT 1651 53.650 92.187 107.934 1.00 0.00 H ATOM 36283 H2 WAT 1651 54.896 91.629 107.281 1.00 0.00 H TER 36285 WAT 1651 ATOM 36285 O WAT 1652 31.813 57.921 117.647 1.00 0.00 O ATOM 36286 H1 WAT 1652 30.883 58.134 117.732 1.00 0.00 H ATOM 36287 H2 WAT 1652 32.262 58.605 118.142 1.00 0.00 H TER 36289 WAT 1652 ATOM 36289 O WAT 1653 39.384 73.762 129.791 1.00 0.00 O ATOM 36290 H1 WAT 1653 38.792 73.166 129.332 1.00 0.00 H ATOM 36291 H2 WAT 1653 38.871 74.085 130.532 1.00 0.00 H TER 36293 WAT 1653 ATOM 36293 O WAT 1654 97.685 62.486 22.870 1.00 0.00 O ATOM 36294 H1 WAT 1654 97.072 61.827 22.545 1.00 0.00 H ATOM 36295 H2 WAT 1654 98.379 61.980 23.293 1.00 0.00 H TER 36297 WAT 1654 ATOM 36297 O WAT 1655 138.589 87.428 103.204 1.00 0.00 O ATOM 36298 H1 WAT 1655 137.722 87.831 103.163 1.00 0.00 H ATOM 36299 H2 WAT 1655 138.573 86.754 102.524 1.00 0.00 H TER 36301 WAT 1655 ATOM 36301 O WAT 1656 53.691 117.037 84.349 1.00 0.00 O ATOM 36302 H1 WAT 1656 54.216 116.974 83.551 1.00 0.00 H ATOM 36303 H2 WAT 1656 53.400 116.141 84.516 1.00 0.00 H TER 36305 WAT 1656 ATOM 36305 O WAT 1657 53.348 36.029 146.034 1.00 0.00 O ATOM 36306 H1 WAT 1657 54.010 36.116 145.349 1.00 0.00 H ATOM 36307 H2 WAT 1657 52.920 35.194 145.849 1.00 0.00 H TER 36309 WAT 1657 ATOM 36309 O WAT 1658 66.617 102.303 122.675 1.00 0.00 O ATOM 36310 H1 WAT 1658 66.061 101.665 123.122 1.00 0.00 H ATOM 36311 H2 WAT 1658 66.679 101.978 121.777 1.00 0.00 H TER 36313 WAT 1658 ATOM 36313 O WAT 1659 99.620 78.905 29.992 1.00 0.00 O ATOM 36314 H1 WAT 1659 99.194 78.306 29.380 1.00 0.00 H ATOM 36315 H2 WAT 1659 99.931 79.626 29.444 1.00 0.00 H TER 36317 WAT 1659 ATOM 36317 O WAT 1660 86.789 14.175 0.336 1.00 0.00 O ATOM 36318 H1 WAT 1660 87.374 13.438 0.512 1.00 0.00 H ATOM 36319 H2 WAT 1660 85.929 13.773 0.207 1.00 0.00 H TER 36321 WAT 1660 ATOM 36321 O WAT 1661 21.466 7.956 68.379 1.00 0.00 O ATOM 36322 H1 WAT 1661 20.680 7.549 68.744 1.00 0.00 H ATOM 36323 H2 WAT 1661 21.349 8.892 68.545 1.00 0.00 H TER 36325 WAT 1661 ATOM 36325 O WAT 1662 118.535 20.850 124.175 1.00 0.00 O ATOM 36326 H1 WAT 1662 119.454 21.078 124.040 1.00 0.00 H ATOM 36327 H2 WAT 1662 118.242 21.436 124.873 1.00 0.00 H TER 36329 WAT 1662 ATOM 36329 O WAT 1663 72.050 113.439 157.690 1.00 0.00 O ATOM 36330 H1 WAT 1663 71.750 112.708 157.151 1.00 0.00 H ATOM 36331 H2 WAT 1663 71.572 114.197 157.354 1.00 0.00 H TER 36333 WAT 1663 ATOM 36333 O WAT 1664 77.003 87.670 79.306 1.00 0.00 O ATOM 36334 H1 WAT 1664 76.163 88.077 79.517 1.00 0.00 H ATOM 36335 H2 WAT 1664 77.646 88.180 79.799 1.00 0.00 H TER 36337 WAT 1664 ATOM 36337 O WAT 1665 107.124 72.404 118.566 1.00 0.00 O ATOM 36338 H1 WAT 1665 108.073 72.302 118.640 1.00 0.00 H ATOM 36339 H2 WAT 1665 106.831 71.606 118.126 1.00 0.00 H TER 36341 WAT 1665 ATOM 36341 O WAT 1666 89.140 63.652 24.126 1.00 0.00 O ATOM 36342 H1 WAT 1666 89.739 64.020 23.477 1.00 0.00 H ATOM 36343 H2 WAT 1666 89.407 62.737 24.208 1.00 0.00 H TER 36345 WAT 1666 ATOM 36345 O WAT 1667 7.287 133.880 126.582 1.00 0.00 O ATOM 36346 H1 WAT 1667 6.918 134.190 125.755 1.00 0.00 H ATOM 36347 H2 WAT 1667 7.925 133.215 126.325 1.00 0.00 H TER 36349 WAT 1667 ATOM 36349 O WAT 1668 30.075 124.586 117.283 1.00 0.00 O ATOM 36350 H1 WAT 1668 30.876 124.073 117.178 1.00 0.00 H ATOM 36351 H2 WAT 1668 29.789 124.771 116.389 1.00 0.00 H TER 36353 WAT 1668 ATOM 36353 O WAT 1669 34.444 21.650 93.134 1.00 0.00 O ATOM 36354 H1 WAT 1669 35.061 21.473 92.424 1.00 0.00 H ATOM 36355 H2 WAT 1669 34.596 22.568 93.360 1.00 0.00 H TER 36357 WAT 1669 ATOM 36357 O WAT 1670 82.898 65.458 134.024 1.00 0.00 O ATOM 36358 H1 WAT 1670 81.976 65.389 134.269 1.00 0.00 H ATOM 36359 H2 WAT 1670 83.376 65.269 134.832 1.00 0.00 H TER 36361 WAT 1670 ATOM 36361 O WAT 1671 30.484 142.306 5.083 1.00 0.00 O ATOM 36362 H1 WAT 1671 29.567 142.032 5.091 1.00 0.00 H ATOM 36363 H2 WAT 1671 30.448 143.262 5.064 1.00 0.00 H TER 36365 WAT 1671 ATOM 36365 O WAT 1672 92.774 77.583 143.140 1.00 0.00 O ATOM 36366 H1 WAT 1672 92.213 77.763 142.385 1.00 0.00 H ATOM 36367 H2 WAT 1672 92.497 78.218 143.800 1.00 0.00 H TER 36369 WAT 1672 ATOM 36369 O WAT 1673 55.910 22.136 93.893 1.00 0.00 O ATOM 36370 H1 WAT 1673 55.945 22.922 94.437 1.00 0.00 H ATOM 36371 H2 WAT 1673 56.323 22.396 93.069 1.00 0.00 H TER 36373 WAT 1673 ATOM 36373 O WAT 1674 75.294 57.516 122.456 1.00 0.00 O ATOM 36374 H1 WAT 1674 75.701 57.636 123.314 1.00 0.00 H ATOM 36375 H2 WAT 1674 75.852 58.009 121.854 1.00 0.00 H TER 36377 WAT 1674 ATOM 36377 O WAT 1675 144.436 98.237 145.217 1.00 0.00 O ATOM 36378 H1 WAT 1675 144.938 98.814 144.642 1.00 0.00 H ATOM 36379 H2 WAT 1675 144.730 97.355 144.987 1.00 0.00 H TER 36381 WAT 1675 ATOM 36381 O WAT 1676 103.652 38.561 116.388 1.00 0.00 O ATOM 36382 H1 WAT 1676 103.822 38.659 115.452 1.00 0.00 H ATOM 36383 H2 WAT 1676 104.111 39.296 116.793 1.00 0.00 H TER 36385 WAT 1676 ATOM 36385 O WAT 1677 27.240 38.897 61.050 1.00 0.00 O ATOM 36386 H1 WAT 1677 26.467 38.427 60.737 1.00 0.00 H ATOM 36387 H2 WAT 1677 27.849 38.873 60.312 1.00 0.00 H TER 36389 WAT 1677 ATOM 36389 O WAT 1678 144.021 83.017 79.614 1.00 0.00 O ATOM 36390 H1 WAT 1678 144.359 83.402 80.423 1.00 0.00 H ATOM 36391 H2 WAT 1678 143.962 83.753 79.005 1.00 0.00 H TER 36393 WAT 1678 ATOM 36393 O WAT 1679 113.881 21.604 89.095 1.00 0.00 O ATOM 36394 H1 WAT 1679 113.573 21.458 89.989 1.00 0.00 H ATOM 36395 H2 WAT 1679 113.547 22.472 88.866 1.00 0.00 H TER 36397 WAT 1679 ATOM 36397 O WAT 1680 8.502 14.056 60.070 1.00 0.00 O ATOM 36398 H1 WAT 1680 8.625 13.687 60.944 1.00 0.00 H ATOM 36399 H2 WAT 1680 9.390 14.208 59.747 1.00 0.00 H TER 36401 WAT 1680 ATOM 36401 O WAT 1681 23.005 53.765 142.894 1.00 0.00 O ATOM 36402 H1 WAT 1681 22.386 54.424 142.578 1.00 0.00 H ATOM 36403 H2 WAT 1681 23.853 54.049 142.553 1.00 0.00 H TER 36405 WAT 1681 ATOM 36405 O WAT 1682 78.825 115.184 145.666 1.00 0.00 O ATOM 36406 H1 WAT 1682 78.725 116.130 145.560 1.00 0.00 H ATOM 36407 H2 WAT 1682 78.300 114.973 146.438 1.00 0.00 H TER 36409 WAT 1682 ATOM 36409 O WAT 1683 31.888 66.827 135.409 1.00 0.00 O ATOM 36410 H1 WAT 1683 31.838 65.933 135.746 1.00 0.00 H ATOM 36411 H2 WAT 1683 32.629 67.217 135.872 1.00 0.00 H TER 36413 WAT 1683 ATOM 36413 O WAT 1684 100.303 108.916 100.493 1.00 0.00 O ATOM 36414 H1 WAT 1684 99.528 109.465 100.379 1.00 0.00 H ATOM 36415 H2 WAT 1684 100.738 109.273 101.268 1.00 0.00 H TER 36417 WAT 1684 ATOM 36417 O WAT 1685 137.020 100.261 77.894 1.00 0.00 O ATOM 36418 H1 WAT 1685 137.890 100.464 77.550 1.00 0.00 H ATOM 36419 H2 WAT 1685 136.461 100.212 77.119 1.00 0.00 H TER 36421 WAT 1685 ATOM 36421 O WAT 1686 68.104 23.134 136.707 1.00 0.00 O ATOM 36422 H1 WAT 1686 68.777 23.563 136.179 1.00 0.00 H ATOM 36423 H2 WAT 1686 67.335 23.107 136.138 1.00 0.00 H TER 36425 WAT 1686 ATOM 36425 O WAT 1687 135.212 135.991 114.845 1.00 0.00 O ATOM 36426 H1 WAT 1687 134.289 136.197 114.696 1.00 0.00 H ATOM 36427 H2 WAT 1687 135.428 136.436 115.665 1.00 0.00 H TER 36429 WAT 1687 ATOM 36429 O WAT 1688 52.398 15.183 149.962 1.00 0.00 O ATOM 36430 H1 WAT 1688 53.013 15.744 150.436 1.00 0.00 H ATOM 36431 H2 WAT 1688 52.886 14.375 149.802 1.00 0.00 H TER 36433 WAT 1688 ATOM 36433 O WAT 1689 4.467 33.523 139.063 1.00 0.00 O ATOM 36434 H1 WAT 1689 5.248 33.709 139.585 1.00 0.00 H ATOM 36435 H2 WAT 1689 4.805 33.317 138.192 1.00 0.00 H TER 36437 WAT 1689 ATOM 36437 O WAT 1690 77.944 142.286 93.515 1.00 0.00 O ATOM 36438 H1 WAT 1690 78.633 142.890 93.791 1.00 0.00 H ATOM 36439 H2 WAT 1690 77.293 142.330 94.216 1.00 0.00 H TER 36441 WAT 1690 ATOM 36441 O WAT 1691 28.859 130.967 93.796 1.00 0.00 O ATOM 36442 H1 WAT 1691 29.151 131.149 92.903 1.00 0.00 H ATOM 36443 H2 WAT 1691 29.666 130.926 94.309 1.00 0.00 H TER 36445 WAT 1691 ATOM 36445 O WAT 1692 23.715 15.557 107.829 1.00 0.00 O ATOM 36446 H1 WAT 1692 23.032 14.909 108.006 1.00 0.00 H ATOM 36447 H2 WAT 1692 23.310 16.397 108.046 1.00 0.00 H TER 36449 WAT 1692 ATOM 36449 O WAT 1693 37.613 79.576 61.889 1.00 0.00 O ATOM 36450 H1 WAT 1693 38.546 79.607 62.100 1.00 0.00 H ATOM 36451 H2 WAT 1693 37.341 80.494 61.874 1.00 0.00 H TER 36453 WAT 1693 ATOM 36453 O WAT 1694 37.295 94.054 86.543 1.00 0.00 O ATOM 36454 H1 WAT 1694 37.292 94.409 85.654 1.00 0.00 H ATOM 36455 H2 WAT 1694 36.393 94.157 86.845 1.00 0.00 H TER 36457 WAT 1694 ATOM 36457 O WAT 1695 89.994 12.927 110.976 1.00 0.00 O ATOM 36458 H1 WAT 1695 90.629 13.475 111.436 1.00 0.00 H ATOM 36459 H2 WAT 1695 90.226 12.032 111.222 1.00 0.00 H TER 36461 WAT 1695 ATOM 36461 O WAT 1696 70.931 125.286 129.675 1.00 0.00 O ATOM 36462 H1 WAT 1696 71.837 125.149 129.950 1.00 0.00 H ATOM 36463 H2 WAT 1696 70.425 125.242 130.487 1.00 0.00 H TER 36465 WAT 1696 ATOM 36465 O WAT 1697 14.328 30.866 84.038 1.00 0.00 O ATOM 36466 H1 WAT 1697 13.710 30.594 83.360 1.00 0.00 H ATOM 36467 H2 WAT 1697 15.172 30.521 83.745 1.00 0.00 H TER 36469 WAT 1697 ATOM 36469 O WAT 1698 3.125 85.541 1.263 1.00 0.00 O ATOM 36470 H1 WAT 1698 2.304 85.919 1.579 1.00 0.00 H ATOM 36471 H2 WAT 1698 3.498 86.218 0.698 1.00 0.00 H TER 36473 WAT 1698 ATOM 36473 O WAT 1699 61.802 1.686 127.289 1.00 0.00 O ATOM 36474 H1 WAT 1699 62.459 0.993 127.228 1.00 0.00 H ATOM 36475 H2 WAT 1699 62.209 2.354 127.841 1.00 0.00 H TER 36477 WAT 1699 ATOM 36477 O WAT 1700 102.589 85.473 71.504 1.00 0.00 O ATOM 36478 H1 WAT 1700 103.414 85.833 71.831 1.00 0.00 H ATOM 36479 H2 WAT 1700 102.524 84.612 71.918 1.00 0.00 H TER 36481 WAT 1700 ATOM 36481 O WAT 1701 144.103 138.985 6.916 1.00 0.00 O ATOM 36482 H1 WAT 1701 144.436 138.124 7.170 1.00 0.00 H ATOM 36483 H2 WAT 1701 143.256 138.804 6.508 1.00 0.00 H TER 36485 WAT 1701 ATOM 36485 O WAT 1702 19.770 60.541 86.761 1.00 0.00 O ATOM 36486 H1 WAT 1702 18.952 60.844 87.154 1.00 0.00 H ATOM 36487 H2 WAT 1702 20.442 61.108 87.140 1.00 0.00 H TER 36489 WAT 1702 ATOM 36489 O WAT 1703 42.468 71.882 92.870 1.00 0.00 O ATOM 36490 H1 WAT 1703 41.537 72.067 92.995 1.00 0.00 H ATOM 36491 H2 WAT 1703 42.601 71.953 91.924 1.00 0.00 H TER 36493 WAT 1703 ATOM 36493 O WAT 1704 7.590 10.679 22.908 1.00 0.00 O ATOM 36494 H1 WAT 1704 7.662 10.598 21.957 1.00 0.00 H ATOM 36495 H2 WAT 1704 6.650 10.752 23.072 1.00 0.00 H TER 36497 WAT 1704 ATOM 36497 O WAT 1705 22.819 106.689 85.172 1.00 0.00 O ATOM 36498 H1 WAT 1705 22.683 105.746 85.083 1.00 0.00 H ATOM 36499 H2 WAT 1705 23.632 106.860 84.697 1.00 0.00 H TER 36501 WAT 1705 ATOM 36501 O WAT 1706 119.256 72.003 98.930 1.00 0.00 O ATOM 36502 H1 WAT 1706 119.758 72.082 99.741 1.00 0.00 H ATOM 36503 H2 WAT 1706 118.670 72.760 98.937 1.00 0.00 H TER 36505 WAT 1706 ATOM 36505 O WAT 1707 81.607 73.921 150.455 1.00 0.00 O ATOM 36506 H1 WAT 1707 81.722 73.689 151.376 1.00 0.00 H ATOM 36507 H2 WAT 1707 82.376 74.451 150.244 1.00 0.00 H TER 36509 WAT 1707 ATOM 36509 O WAT 1708 93.891 97.447 2.627 1.00 0.00 O ATOM 36510 H1 WAT 1708 94.451 97.735 1.907 1.00 0.00 H ATOM 36511 H2 WAT 1708 94.437 97.538 3.408 1.00 0.00 H TER 36513 WAT 1708 ATOM 36513 O WAT 1709 21.863 76.264 97.162 1.00 0.00 O ATOM 36514 H1 WAT 1709 22.545 75.810 96.667 1.00 0.00 H ATOM 36515 H2 WAT 1709 21.094 76.236 96.592 1.00 0.00 H TER 36517 WAT 1709 ATOM 36517 O WAT 1710 4.303 90.084 90.296 1.00 0.00 O ATOM 36518 H1 WAT 1710 3.691 89.378 90.086 1.00 0.00 H ATOM 36519 H2 WAT 1710 4.937 90.072 89.580 1.00 0.00 H TER 36521 WAT 1710 ATOM 36521 O WAT 1711 75.529 120.972 109.685 1.00 0.00 O ATOM 36522 H1 WAT 1711 76.342 121.332 109.331 1.00 0.00 H ATOM 36523 H2 WAT 1711 74.883 121.666 109.554 1.00 0.00 H TER 36525 WAT 1711 ATOM 36525 O WAT 1712 82.526 7.712 79.072 1.00 0.00 O ATOM 36526 H1 WAT 1712 82.892 7.342 79.876 1.00 0.00 H ATOM 36527 H2 WAT 1712 82.749 8.642 79.113 1.00 0.00 H TER 36529 WAT 1712 ATOM 36529 O WAT 1713 79.331 105.279 29.154 1.00 0.00 O ATOM 36530 H1 WAT 1713 80.231 104.958 29.090 1.00 0.00 H ATOM 36531 H2 WAT 1713 78.871 104.603 29.653 1.00 0.00 H TER 36533 WAT 1713 ATOM 36533 O WAT 1714 127.343 7.208 135.286 1.00 0.00 O ATOM 36534 H1 WAT 1714 126.677 7.698 134.804 1.00 0.00 H ATOM 36535 H2 WAT 1714 127.241 7.494 136.193 1.00 0.00 H TER 36537 WAT 1714 ATOM 36537 O WAT 1715 126.636 87.730 144.157 1.00 0.00 O ATOM 36538 H1 WAT 1715 127.147 88.120 144.866 1.00 0.00 H ATOM 36539 H2 WAT 1715 127.190 87.025 143.822 1.00 0.00 H TER 36541 WAT 1715 ATOM 36541 O WAT 1716 138.707 37.439 97.709 1.00 0.00 O ATOM 36542 H1 WAT 1716 137.807 37.359 97.392 1.00 0.00 H ATOM 36543 H2 WAT 1716 139.151 36.665 97.362 1.00 0.00 H TER 36545 WAT 1716 ATOM 36545 O WAT 1717 57.155 100.856 150.589 1.00 0.00 O ATOM 36546 H1 WAT 1717 58.043 101.209 150.638 1.00 0.00 H ATOM 36547 H2 WAT 1717 57.224 99.981 150.972 1.00 0.00 H TER 36549 WAT 1717 ATOM 36549 O WAT 1718 93.223 106.915 155.916 1.00 0.00 O ATOM 36550 H1 WAT 1718 92.730 107.483 155.324 1.00 0.00 H ATOM 36551 H2 WAT 1718 92.678 106.134 156.007 1.00 0.00 H TER 36553 WAT 1718 ATOM 36553 O WAT 1719 71.861 74.526 126.682 1.00 0.00 O ATOM 36554 H1 WAT 1719 72.522 75.193 126.496 1.00 0.00 H ATOM 36555 H2 WAT 1719 71.229 74.610 125.969 1.00 0.00 H TER 36557 WAT 1719 ATOM 36557 O WAT 1720 24.422 128.947 16.630 1.00 0.00 O ATOM 36558 H1 WAT 1720 23.783 128.798 17.326 1.00 0.00 H ATOM 36559 H2 WAT 1720 23.917 129.349 15.923 1.00 0.00 H TER 36561 WAT 1720 ATOM 36561 O WAT 1721 107.637 114.539 137.171 1.00 0.00 O ATOM 36562 H1 WAT 1721 107.481 114.579 138.114 1.00 0.00 H ATOM 36563 H2 WAT 1721 108.137 115.331 136.976 1.00 0.00 H TER 36565 WAT 1721 ATOM 36565 O WAT 1722 111.808 40.121 81.426 1.00 0.00 O ATOM 36566 H1 WAT 1722 111.549 39.324 80.962 1.00 0.00 H ATOM 36567 H2 WAT 1722 111.256 40.131 82.208 1.00 0.00 H TER 36569 WAT 1722 ATOM 36569 O WAT 1723 104.727 49.662 0.292 1.00 0.00 O ATOM 36570 H1 WAT 1723 105.628 49.539 0.592 1.00 0.00 H ATOM 36571 H2 WAT 1723 104.354 48.780 0.285 1.00 0.00 H TER 36573 WAT 1723 ATOM 36573 O WAT 1724 116.767 91.835 152.229 1.00 0.00 O ATOM 36574 H1 WAT 1724 116.812 91.235 152.973 1.00 0.00 H ATOM 36575 H2 WAT 1724 116.001 92.380 152.407 1.00 0.00 H TER 36577 WAT 1724 ATOM 36577 O WAT 1725 51.237 119.311 86.956 1.00 0.00 O ATOM 36578 H1 WAT 1725 51.877 120.009 86.819 1.00 0.00 H ATOM 36579 H2 WAT 1725 51.686 118.682 87.521 1.00 0.00 H TER 36581 WAT 1725 ATOM 36581 O WAT 1726 35.853 95.335 153.171 1.00 0.00 O ATOM 36582 H1 WAT 1726 35.054 95.497 153.674 1.00 0.00 H ATOM 36583 H2 WAT 1726 35.673 95.711 152.310 1.00 0.00 H TER 36585 WAT 1726 ATOM 36585 O WAT 1727 137.408 93.954 2.653 1.00 0.00 O ATOM 36586 H1 WAT 1727 136.831 93.820 3.405 1.00 0.00 H ATOM 36587 H2 WAT 1727 138.282 94.035 3.033 1.00 0.00 H TER 36589 WAT 1727 ATOM 36589 O WAT 1728 100.700 58.085 153.324 1.00 0.00 O ATOM 36590 H1 WAT 1728 101.528 57.726 153.005 1.00 0.00 H ATOM 36591 H2 WAT 1728 100.030 57.520 152.939 1.00 0.00 H TER 36593 WAT 1728 ATOM 36593 O WAT 1729 69.191 32.206 21.054 1.00 0.00 O ATOM 36594 H1 WAT 1729 69.172 31.590 20.322 1.00 0.00 H ATOM 36595 H2 WAT 1729 68.565 31.848 21.684 1.00 0.00 H TER 36597 WAT 1729 ATOM 36597 O WAT 1730 54.924 102.340 11.283 1.00 0.00 O ATOM 36598 H1 WAT 1730 54.217 101.797 11.631 1.00 0.00 H ATOM 36599 H2 WAT 1730 54.489 103.139 10.986 1.00 0.00 H TER 36601 WAT 1730 ATOM 36601 O WAT 1731 71.741 57.029 0.697 1.00 0.00 O ATOM 36602 H1 WAT 1731 72.270 56.404 1.193 1.00 0.00 H ATOM 36603 H2 WAT 1731 71.650 57.782 1.282 1.00 0.00 H TER 36605 WAT 1731 ATOM 36605 O WAT 1732 137.759 67.506 92.572 1.00 0.00 O ATOM 36606 H1 WAT 1732 137.712 66.794 91.934 1.00 0.00 H ATOM 36607 H2 WAT 1732 137.259 68.218 92.173 1.00 0.00 H TER 36609 WAT 1732 ATOM 36609 O WAT 1733 69.717 84.671 4.223 1.00 0.00 O ATOM 36610 H1 WAT 1733 69.106 85.027 3.577 1.00 0.00 H ATOM 36611 H2 WAT 1733 70.549 84.605 3.755 1.00 0.00 H TER 36613 WAT 1733 ATOM 36613 O WAT 1734 10.803 58.879 3.920 1.00 0.00 O ATOM 36614 H1 WAT 1734 11.373 59.567 3.575 1.00 0.00 H ATOM 36615 H2 WAT 1734 10.509 59.215 4.767 1.00 0.00 H TER 36617 WAT 1734 ATOM 36617 O WAT 1735 119.563 29.452 11.736 1.00 0.00 O ATOM 36618 H1 WAT 1735 118.696 29.857 11.715 1.00 0.00 H ATOM 36619 H2 WAT 1735 120.134 30.128 12.103 1.00 0.00 H TER 36621 WAT 1735 ATOM 36621 O WAT 1736 71.209 59.969 8.474 1.00 0.00 O ATOM 36622 H1 WAT 1736 70.379 59.657 8.114 1.00 0.00 H ATOM 36623 H2 WAT 1736 71.815 59.946 7.734 1.00 0.00 H TER 36625 WAT 1736 ATOM 36625 O WAT 1737 74.499 75.395 146.838 1.00 0.00 O ATOM 36626 H1 WAT 1737 74.819 76.240 146.522 1.00 0.00 H ATOM 36627 H2 WAT 1737 75.282 74.948 147.160 1.00 0.00 H TER 36629 WAT 1737 ATOM 36629 O WAT 1738 45.267 66.005 114.043 1.00 0.00 O ATOM 36630 H1 WAT 1738 45.605 65.976 113.147 1.00 0.00 H ATOM 36631 H2 WAT 1738 46.001 66.330 114.565 1.00 0.00 H TER 36633 WAT 1738 ATOM 36633 O WAT 1739 53.243 78.426 108.329 1.00 0.00 O ATOM 36634 H1 WAT 1739 53.776 78.550 109.114 1.00 0.00 H ATOM 36635 H2 WAT 1739 52.446 78.928 108.499 1.00 0.00 H TER 36637 WAT 1739 ATOM 36637 O WAT 1740 86.521 46.701 105.954 1.00 0.00 O ATOM 36638 H1 WAT 1740 87.408 46.720 105.594 1.00 0.00 H ATOM 36639 H2 WAT 1740 86.188 45.834 105.723 1.00 0.00 H TER 36641 WAT 1740 ATOM 36641 O WAT 1741 30.488 95.508 80.782 1.00 0.00 O ATOM 36642 H1 WAT 1741 30.109 94.680 81.078 1.00 0.00 H ATOM 36643 H2 WAT 1741 30.896 95.297 79.942 1.00 0.00 H TER 36645 WAT 1741 ATOM 36645 O WAT 1742 49.094 107.007 122.485 1.00 0.00 O ATOM 36646 H1 WAT 1742 50.039 107.121 122.381 1.00 0.00 H ATOM 36647 H2 WAT 1742 48.805 106.632 121.652 1.00 0.00 H TER 36649 WAT 1742 ATOM 36649 O WAT 1743 125.835 72.814 13.353 1.00 0.00 O ATOM 36650 H1 WAT 1743 126.290 71.974 13.419 1.00 0.00 H ATOM 36651 H2 WAT 1743 125.626 72.900 12.423 1.00 0.00 H TER 36653 WAT 1743 ATOM 36653 O WAT 1744 93.115 14.723 133.802 1.00 0.00 O ATOM 36654 H1 WAT 1744 92.710 14.256 134.533 1.00 0.00 H ATOM 36655 H2 WAT 1744 93.853 14.171 133.544 1.00 0.00 H TER 36657 WAT 1744 ATOM 36657 O WAT 1745 62.587 103.877 72.086 1.00 0.00 O ATOM 36658 H1 WAT 1745 63.216 104.096 71.398 1.00 0.00 H ATOM 36659 H2 WAT 1745 61.808 104.390 71.871 1.00 0.00 H TER 36661 WAT 1745 ATOM 36661 O WAT 1746 138.387 55.936 110.774 1.00 0.00 O ATOM 36662 H1 WAT 1746 138.032 55.054 110.666 1.00 0.00 H ATOM 36663 H2 WAT 1746 137.839 56.334 111.450 1.00 0.00 H TER 36665 WAT 1746 ATOM 36665 O WAT 1747 103.379 108.322 137.327 1.00 0.00 O ATOM 36666 H1 WAT 1747 103.093 108.236 138.237 1.00 0.00 H ATOM 36667 H2 WAT 1747 103.294 107.441 136.964 1.00 0.00 H TER 36669 WAT 1747 ATOM 36669 O WAT 1748 17.639 9.113 18.119 1.00 0.00 O ATOM 36670 H1 WAT 1748 18.408 9.088 17.550 1.00 0.00 H ATOM 36671 H2 WAT 1748 17.007 8.534 17.693 1.00 0.00 H TER 36673 WAT 1748 ATOM 36673 O WAT 1749 107.661 65.610 99.362 1.00 0.00 O ATOM 36674 H1 WAT 1749 107.843 65.606 100.302 1.00 0.00 H ATOM 36675 H2 WAT 1749 107.067 64.871 99.230 1.00 0.00 H TER 36677 WAT 1749 ATOM 36677 O WAT 1750 52.175 53.801 158.484 1.00 0.00 O ATOM 36678 H1 WAT 1750 51.226 53.798 158.609 1.00 0.00 H ATOM 36679 H2 WAT 1750 52.520 53.356 159.258 1.00 0.00 H TER 36681 WAT 1750 ATOM 36681 O WAT 1751 59.078 100.194 126.763 1.00 0.00 O ATOM 36682 H1 WAT 1751 59.244 100.522 125.879 1.00 0.00 H ATOM 36683 H2 WAT 1751 59.793 100.553 127.289 1.00 0.00 H TER 36685 WAT 1751 ATOM 36685 O WAT 1752 129.900 44.910 7.897 1.00 0.00 O ATOM 36686 H1 WAT 1752 129.027 45.301 7.854 1.00 0.00 H ATOM 36687 H2 WAT 1752 129.770 44.083 8.362 1.00 0.00 H TER 36689 WAT 1752 ATOM 36689 O WAT 1753 141.019 100.221 125.087 1.00 0.00 O ATOM 36690 H1 WAT 1753 141.365 99.343 124.929 1.00 0.00 H ATOM 36691 H2 WAT 1753 141.741 100.693 125.502 1.00 0.00 H TER 36693 WAT 1753 ATOM 36693 O WAT 1754 27.307 8.418 65.797 1.00 0.00 O ATOM 36694 H1 WAT 1754 27.943 8.751 66.431 1.00 0.00 H ATOM 36695 H2 WAT 1754 27.814 8.285 64.996 1.00 0.00 H TER 36697 WAT 1754 ATOM 36697 O WAT 1755 114.097 10.199 77.734 1.00 0.00 O ATOM 36698 H1 WAT 1755 114.616 9.941 78.496 1.00 0.00 H ATOM 36699 H2 WAT 1755 113.839 11.103 77.914 1.00 0.00 H TER 36701 WAT 1755 ATOM 36701 O WAT 1756 26.243 21.532 75.654 1.00 0.00 O ATOM 36702 H1 WAT 1756 25.789 21.296 74.845 1.00 0.00 H ATOM 36703 H2 WAT 1756 26.000 20.844 76.274 1.00 0.00 H TER 36705 WAT 1756 ATOM 36705 O WAT 1757 75.689 133.169 117.075 1.00 0.00 O ATOM 36706 H1 WAT 1757 75.105 132.432 116.900 1.00 0.00 H ATOM 36707 H2 WAT 1757 76.256 132.863 117.783 1.00 0.00 H TER 36709 WAT 1757 ATOM 36709 O WAT 1758 54.631 80.763 105.164 1.00 0.00 O ATOM 36710 H1 WAT 1758 54.062 81.086 105.863 1.00 0.00 H ATOM 36711 H2 WAT 1758 55.116 80.042 105.565 1.00 0.00 H TER 36713 WAT 1758 ATOM 36713 O WAT 1759 27.587 141.722 91.696 1.00 0.00 O ATOM 36714 H1 WAT 1759 28.365 142.244 91.894 1.00 0.00 H ATOM 36715 H2 WAT 1759 27.119 141.665 92.529 1.00 0.00 H TER 36717 WAT 1759 ATOM 36717 O WAT 1760 135.636 55.061 75.905 1.00 0.00 O ATOM 36718 H1 WAT 1760 134.855 54.890 75.378 1.00 0.00 H ATOM 36719 H2 WAT 1760 135.305 55.505 76.685 1.00 0.00 H TER 36721 WAT 1760 ATOM 36721 O WAT 1761 131.163 113.915 109.086 1.00 0.00 O ATOM 36722 H1 WAT 1761 131.670 114.720 108.981 1.00 0.00 H ATOM 36723 H2 WAT 1761 130.334 114.095 108.643 1.00 0.00 H TER 36725 WAT 1761 ATOM 36725 O WAT 1762 124.053 137.726 82.382 1.00 0.00 O ATOM 36726 H1 WAT 1762 123.468 137.220 82.947 1.00 0.00 H ATOM 36727 H2 WAT 1762 123.501 138.424 82.030 1.00 0.00 H TER 36729 WAT 1762 ATOM 36729 O WAT 1763 15.410 63.304 154.780 1.00 0.00 O ATOM 36730 H1 WAT 1763 15.495 64.253 154.867 1.00 0.00 H ATOM 36731 H2 WAT 1763 16.167 62.952 155.248 1.00 0.00 H TER 36733 WAT 1763 ATOM 36733 O WAT 1764 110.426 8.735 63.580 1.00 0.00 O ATOM 36734 H1 WAT 1764 111.134 8.832 62.942 1.00 0.00 H ATOM 36735 H2 WAT 1764 109.980 9.581 63.573 1.00 0.00 H TER 36737 WAT 1764 ATOM 36737 O WAT 1765 132.309 96.131 154.865 1.00 0.00 O ATOM 36738 H1 WAT 1765 132.927 95.468 155.173 1.00 0.00 H ATOM 36739 H2 WAT 1765 131.764 95.672 154.227 1.00 0.00 H TER 36741 WAT 1765 ATOM 36741 O WAT 1766 11.600 101.716 19.893 1.00 0.00 O ATOM 36742 H1 WAT 1766 10.926 101.418 20.505 1.00 0.00 H ATOM 36743 H2 WAT 1766 11.194 101.631 19.030 1.00 0.00 H TER 36745 WAT 1766 ATOM 36745 O WAT 1767 25.870 12.611 139.126 1.00 0.00 O ATOM 36746 H1 WAT 1767 26.123 11.706 138.948 1.00 0.00 H ATOM 36747 H2 WAT 1767 25.503 12.588 140.010 1.00 0.00 H TER 36749 WAT 1767 ATOM 36749 O WAT 1768 51.460 114.073 17.264 1.00 0.00 O ATOM 36750 H1 WAT 1768 52.199 113.465 17.231 1.00 0.00 H ATOM 36751 H2 WAT 1768 51.679 114.676 17.974 1.00 0.00 H TER 36753 WAT 1768 ATOM 36753 O WAT 1769 130.275 76.172 76.461 1.00 0.00 O ATOM 36754 H1 WAT 1769 130.321 76.712 75.673 1.00 0.00 H ATOM 36755 H2 WAT 1769 129.759 75.409 76.200 1.00 0.00 H TER 36757 WAT 1769 ATOM 36757 O WAT 1770 96.362 73.701 101.430 1.00 0.00 O ATOM 36758 H1 WAT 1770 96.755 73.342 102.225 1.00 0.00 H ATOM 36759 H2 WAT 1770 95.430 73.500 101.511 1.00 0.00 H TER 36761 WAT 1770 ATOM 36761 O WAT 1771 128.729 7.395 74.625 1.00 0.00 O ATOM 36762 H1 WAT 1771 128.062 7.804 74.075 1.00 0.00 H ATOM 36763 H2 WAT 1771 129.338 8.104 74.831 1.00 0.00 H TER 36765 WAT 1771 ATOM 36765 O WAT 1772 84.964 37.834 58.708 1.00 0.00 O ATOM 36766 H1 WAT 1772 85.714 38.122 59.229 1.00 0.00 H ATOM 36767 H2 WAT 1772 84.251 38.415 58.973 1.00 0.00 H TER 36769 WAT 1772 ATOM 36769 O WAT 1773 122.622 42.417 13.158 1.00 0.00 O ATOM 36770 H1 WAT 1773 122.947 42.596 14.040 1.00 0.00 H ATOM 36771 H2 WAT 1773 122.143 43.208 12.914 1.00 0.00 H TER 36773 WAT 1773 ATOM 36773 O WAT 1774 61.717 24.050 12.948 1.00 0.00 O ATOM 36774 H1 WAT 1774 61.401 23.327 12.405 1.00 0.00 H ATOM 36775 H2 WAT 1774 61.045 24.725 12.863 1.00 0.00 H TER 36777 WAT 1774 ATOM 36777 O WAT 1775 137.557 85.826 118.009 1.00 0.00 O ATOM 36778 H1 WAT 1775 137.530 86.781 118.074 1.00 0.00 H ATOM 36779 H2 WAT 1775 138.248 85.649 117.371 1.00 0.00 H TER 36781 WAT 1775 ATOM 36781 O WAT 1776 117.770 77.228 153.890 1.00 0.00 O ATOM 36782 H1 WAT 1776 117.258 76.965 154.655 1.00 0.00 H ATOM 36783 H2 WAT 1776 117.755 76.462 153.317 1.00 0.00 H TER 36785 WAT 1776 ATOM 36785 O WAT 1777 70.355 71.070 148.847 1.00 0.00 O ATOM 36786 H1 WAT 1777 69.412 71.201 148.743 1.00 0.00 H ATOM 36787 H2 WAT 1777 70.701 71.106 147.955 1.00 0.00 H TER 36789 WAT 1777 ATOM 36789 O WAT 1778 113.208 6.293 17.312 1.00 0.00 O ATOM 36790 H1 WAT 1778 113.960 6.030 16.781 1.00 0.00 H ATOM 36791 H2 WAT 1778 113.033 7.196 17.048 1.00 0.00 H TER 36793 WAT 1778 ATOM 36793 O WAT 1779 112.082 100.445 123.166 1.00 0.00 O ATOM 36794 H1 WAT 1779 111.745 99.549 123.127 1.00 0.00 H ATOM 36795 H2 WAT 1779 112.895 100.374 123.666 1.00 0.00 H TER 36797 WAT 1779 ATOM 36797 O WAT 1780 121.259 61.602 105.624 1.00 0.00 O ATOM 36798 H1 WAT 1780 121.454 62.083 104.820 1.00 0.00 H ATOM 36799 H2 WAT 1780 121.149 62.281 106.289 1.00 0.00 H TER 36801 WAT 1780 ATOM 36801 O WAT 1781 60.036 61.873 137.710 1.00 0.00 O ATOM 36802 H1 WAT 1781 59.980 62.678 138.226 1.00 0.00 H ATOM 36803 H2 WAT 1781 60.577 61.287 138.240 1.00 0.00 H TER 36805 WAT 1781 ATOM 36805 O WAT 1782 61.470 17.913 64.839 1.00 0.00 O ATOM 36806 H1 WAT 1782 61.401 18.062 63.896 1.00 0.00 H ATOM 36807 H2 WAT 1782 60.699 18.343 65.207 1.00 0.00 H TER 36809 WAT 1782 ATOM 36809 O WAT 1783 77.245 128.131 2.650 1.00 0.00 O ATOM 36810 H1 WAT 1783 77.525 127.640 3.422 1.00 0.00 H ATOM 36811 H2 WAT 1783 77.724 127.731 1.924 1.00 0.00 H TER 36813 WAT 1783 ATOM 36813 O WAT 1784 82.448 54.714 140.233 1.00 0.00 O ATOM 36814 H1 WAT 1784 81.548 54.501 139.986 1.00 0.00 H ATOM 36815 H2 WAT 1784 82.985 54.306 139.555 1.00 0.00 H TER 36817 WAT 1784 ATOM 36817 O WAT 1785 50.280 38.729 19.351 1.00 0.00 O ATOM 36818 H1 WAT 1785 50.718 38.354 20.114 1.00 0.00 H ATOM 36819 H2 WAT 1785 49.621 39.319 19.718 1.00 0.00 H TER 36821 WAT 1785 ATOM 36821 O WAT 1786 46.155 97.711 1.416 1.00 0.00 O ATOM 36822 H1 WAT 1786 46.425 97.772 0.500 1.00 0.00 H ATOM 36823 H2 WAT 1786 46.025 96.775 1.566 1.00 0.00 H TER 36825 WAT 1786 ATOM 36825 O WAT 1787 136.043 84.604 4.040 1.00 0.00 O ATOM 36826 H1 WAT 1787 135.354 83.966 4.227 1.00 0.00 H ATOM 36827 H2 WAT 1787 136.158 85.080 4.862 1.00 0.00 H TER 36829 WAT 1787 ATOM 36829 O WAT 1788 138.700 118.271 77.565 1.00 0.00 O ATOM 36830 H1 WAT 1788 139.305 118.989 77.753 1.00 0.00 H ATOM 36831 H2 WAT 1788 139.152 117.744 76.906 1.00 0.00 H TER 36833 WAT 1788 ATOM 36833 O WAT 1789 31.155 112.683 153.164 1.00 0.00 O ATOM 36834 H1 WAT 1789 31.612 111.854 153.309 1.00 0.00 H ATOM 36835 H2 WAT 1789 31.106 113.084 154.032 1.00 0.00 H TER 36837 WAT 1789 ATOM 36837 O WAT 1790 144.571 5.004 89.476 1.00 0.00 O ATOM 36838 H1 WAT 1790 145.330 5.579 89.376 1.00 0.00 H ATOM 36839 H2 WAT 1790 144.754 4.263 88.898 1.00 0.00 H TER 36841 WAT 1790 ATOM 36841 O WAT 1791 79.043 3.105 16.324 1.00 0.00 O ATOM 36842 H1 WAT 1791 79.600 3.298 15.570 1.00 0.00 H ATOM 36843 H2 WAT 1791 79.167 3.852 16.910 1.00 0.00 H TER 36845 WAT 1791 ATOM 36845 O WAT 1792 18.916 55.133 112.020 1.00 0.00 O ATOM 36846 H1 WAT 1792 18.453 55.579 111.310 1.00 0.00 H ATOM 36847 H2 WAT 1792 18.899 55.757 112.746 1.00 0.00 H TER 36849 WAT 1792 ATOM 36849 O WAT 1793 61.574 3.534 96.154 1.00 0.00 O ATOM 36850 H1 WAT 1793 60.636 3.715 96.219 1.00 0.00 H ATOM 36851 H2 WAT 1793 61.684 3.148 95.286 1.00 0.00 H TER 36853 WAT 1793 ATOM 36853 O WAT 1794 57.333 32.530 90.735 1.00 0.00 O ATOM 36854 H1 WAT 1794 58.093 32.665 90.169 1.00 0.00 H ATOM 36855 H2 WAT 1794 56.688 32.101 90.172 1.00 0.00 H TER 36857 WAT 1794 ATOM 36857 O WAT 1795 75.310 38.984 106.478 1.00 0.00 O ATOM 36858 H1 WAT 1795 74.670 39.484 106.984 1.00 0.00 H ATOM 36859 H2 WAT 1795 75.961 39.631 106.207 1.00 0.00 H TER 36861 WAT 1795 ATOM 36861 O WAT 1796 114.025 0.384 22.892 1.00 0.00 O ATOM 36862 H1 WAT 1796 114.959 0.588 22.916 1.00 0.00 H ATOM 36863 H2 WAT 1796 113.976 -0.542 23.129 1.00 0.00 H TER 36865 WAT 1796 ATOM 36865 O WAT 1797 82.286 65.453 24.743 1.00 0.00 O ATOM 36866 H1 WAT 1797 83.122 65.823 25.025 1.00 0.00 H ATOM 36867 H2 WAT 1797 81.727 66.214 24.586 1.00 0.00 H TER 36869 WAT 1797 ATOM 36869 O WAT 1798 127.261 122.148 102.726 1.00 0.00 O ATOM 36870 H1 WAT 1798 126.367 122.480 102.814 1.00 0.00 H ATOM 36871 H2 WAT 1798 127.501 121.871 103.611 1.00 0.00 H TER 36873 WAT 1798 ATOM 36873 O WAT 1799 32.870 142.028 78.050 1.00 0.00 O ATOM 36874 H1 WAT 1799 33.622 141.507 77.770 1.00 0.00 H ATOM 36875 H2 WAT 1799 33.128 142.934 77.880 1.00 0.00 H TER 36877 WAT 1799 ATOM 36877 O WAT 1800 119.631 143.343 139.599 1.00 0.00 O ATOM 36878 H1 WAT 1800 119.176 144.159 139.389 1.00 0.00 H ATOM 36879 H2 WAT 1800 120.472 143.623 139.960 1.00 0.00 H TER 36881 WAT 1800 ATOM 36881 O WAT 1801 51.025 60.775 10.802 1.00 0.00 O ATOM 36882 H1 WAT 1801 50.263 60.881 11.372 1.00 0.00 H ATOM 36883 H2 WAT 1801 51.229 61.663 10.508 1.00 0.00 H TER 36885 WAT 1801 ATOM 36885 O WAT 1802 7.857 109.054 132.881 1.00 0.00 O ATOM 36886 H1 WAT 1802 7.118 108.803 133.434 1.00 0.00 H ATOM 36887 H2 WAT 1802 7.490 109.687 132.264 1.00 0.00 H TER 36889 WAT 1802 ATOM 36889 O WAT 1803 75.000 32.081 154.199 1.00 0.00 O ATOM 36890 H1 WAT 1803 75.899 32.011 154.519 1.00 0.00 H ATOM 36891 H2 WAT 1803 74.931 32.979 153.874 1.00 0.00 H TER 36893 WAT 1803 ATOM 36893 O WAT 1804 129.105 130.357 155.431 1.00 0.00 O ATOM 36894 H1 WAT 1804 129.866 130.676 155.916 1.00 0.00 H ATOM 36895 H2 WAT 1804 129.437 129.613 154.928 1.00 0.00 H TER 36897 WAT 1804 ATOM 36897 O WAT 1805 55.081 11.150 63.285 1.00 0.00 O ATOM 36898 H1 WAT 1805 54.983 10.511 63.991 1.00 0.00 H ATOM 36899 H2 WAT 1805 56.023 11.179 63.117 1.00 0.00 H TER 36901 WAT 1805 ATOM 36901 O WAT 1806 88.674 76.150 80.595 1.00 0.00 O ATOM 36902 H1 WAT 1806 89.354 76.710 80.222 1.00 0.00 H ATOM 36903 H2 WAT 1806 89.128 75.629 81.257 1.00 0.00 H TER 36905 WAT 1806 ATOM 36905 O WAT 1807 87.706 111.440 123.781 1.00 0.00 O ATOM 36906 H1 WAT 1807 88.102 110.827 124.400 1.00 0.00 H ATOM 36907 H2 WAT 1807 86.912 111.745 124.220 1.00 0.00 H TER 36909 WAT 1807 ATOM 36909 O WAT 1808 125.414 139.388 130.200 1.00 0.00 O ATOM 36910 H1 WAT 1808 125.251 139.677 131.098 1.00 0.00 H ATOM 36911 H2 WAT 1808 125.510 140.200 129.701 1.00 0.00 H TER 36913 WAT 1808 ATOM 36913 O WAT 1809 124.183 43.542 136.663 1.00 0.00 O ATOM 36914 H1 WAT 1809 124.631 43.448 135.822 1.00 0.00 H ATOM 36915 H2 WAT 1809 123.739 44.387 136.605 1.00 0.00 H TER 36917 WAT 1809 ATOM 36917 O WAT 1810 10.222 16.217 98.684 1.00 0.00 O ATOM 36918 H1 WAT 1810 10.793 16.863 99.099 1.00 0.00 H ATOM 36919 H2 WAT 1810 10.635 15.375 98.876 1.00 0.00 H TER 36921 WAT 1810 ATOM 36921 O WAT 1811 92.653 41.273 130.771 1.00 0.00 O ATOM 36922 H1 WAT 1811 92.133 41.943 131.215 1.00 0.00 H ATOM 36923 H2 WAT 1811 93.506 41.685 130.632 1.00 0.00 H TER 36925 WAT 1811 ATOM 36925 O WAT 1812 75.553 129.511 139.045 1.00 0.00 O ATOM 36926 H1 WAT 1812 76.241 130.168 138.938 1.00 0.00 H ATOM 36927 H2 WAT 1812 75.610 129.251 139.964 1.00 0.00 H TER 36929 WAT 1812 ATOM 36929 O WAT 1813 14.284 25.450 146.990 1.00 0.00 O ATOM 36930 H1 WAT 1813 13.903 26.012 147.665 1.00 0.00 H ATOM 36931 H2 WAT 1813 15.225 25.469 147.167 1.00 0.00 H TER 36933 WAT 1813 ATOM 36933 O WAT 1814 131.816 91.591 3.314 1.00 0.00 O ATOM 36934 H1 WAT 1814 131.792 92.506 3.596 1.00 0.00 H ATOM 36935 H2 WAT 1814 132.737 91.427 3.113 1.00 0.00 H TER 36937 WAT 1814 ATOM 36937 O WAT 1815 114.303 71.966 93.191 1.00 0.00 O ATOM 36938 H1 WAT 1815 113.884 72.748 92.833 1.00 0.00 H ATOM 36939 H2 WAT 1815 114.373 71.369 92.446 1.00 0.00 H TER 36941 WAT 1815 ATOM 36941 O WAT 1816 53.509 19.770 105.088 1.00 0.00 O ATOM 36942 H1 WAT 1816 53.430 20.382 105.820 1.00 0.00 H ATOM 36943 H2 WAT 1816 54.038 19.051 105.433 1.00 0.00 H TER 36945 WAT 1816 ATOM 36945 O WAT 1817 130.048 25.865 124.522 1.00 0.00 O ATOM 36946 H1 WAT 1817 130.321 26.757 124.735 1.00 0.00 H ATOM 36947 H2 WAT 1817 130.796 25.320 124.767 1.00 0.00 H TER 36949 WAT 1817 ATOM 36949 O WAT 1818 82.539 29.317 106.173 1.00 0.00 O ATOM 36950 H1 WAT 1818 82.797 28.415 106.362 1.00 0.00 H ATOM 36951 H2 WAT 1818 83.311 29.706 105.762 1.00 0.00 H TER 36953 WAT 1818 ATOM 36953 O WAT 1819 14.180 112.743 154.036 1.00 0.00 O ATOM 36954 H1 WAT 1819 14.507 112.625 153.144 1.00 0.00 H ATOM 36955 H2 WAT 1819 14.913 113.138 154.509 1.00 0.00 H TER 36957 WAT 1819 ATOM 36957 O WAT 1820 97.884 36.186 72.085 1.00 0.00 O ATOM 36958 H1 WAT 1820 98.049 35.513 71.425 1.00 0.00 H ATOM 36959 H2 WAT 1820 97.484 36.906 71.598 1.00 0.00 H TER 36961 WAT 1820 ATOM 36961 O WAT 1821 112.995 20.322 0.479 1.00 0.00 O ATOM 36962 H1 WAT 1821 113.238 21.245 0.557 1.00 0.00 H ATOM 36963 H2 WAT 1821 113.039 20.142 -0.460 1.00 0.00 H TER 36965 WAT 1821 ATOM 36965 O WAT 1822 3.885 101.524 132.688 1.00 0.00 O ATOM 36966 H1 WAT 1822 3.160 101.980 132.260 1.00 0.00 H ATOM 36967 H2 WAT 1822 4.396 101.157 131.966 1.00 0.00 H TER 36969 WAT 1822 ATOM 36969 O WAT 1823 106.091 129.834 16.246 1.00 0.00 O ATOM 36970 H1 WAT 1823 105.407 129.391 16.748 1.00 0.00 H ATOM 36971 H2 WAT 1823 106.793 129.985 16.879 1.00 0.00 H TER 36973 WAT 1823 ATOM 36973 O WAT 1824 113.202 69.105 79.441 1.00 0.00 O ATOM 36974 H1 WAT 1824 113.325 70.040 79.601 1.00 0.00 H ATOM 36975 H2 WAT 1824 113.760 68.915 78.688 1.00 0.00 H TER 36977 WAT 1824 ATOM 36977 O WAT 1825 41.845 21.360 136.787 1.00 0.00 O ATOM 36978 H1 WAT 1825 40.915 21.547 136.913 1.00 0.00 H ATOM 36979 H2 WAT 1825 41.867 20.455 136.476 1.00 0.00 H TER 36981 WAT 1825 ATOM 36981 O WAT 1826 82.580 67.209 79.565 1.00 0.00 O ATOM 36982 H1 WAT 1826 82.644 67.179 78.610 1.00 0.00 H ATOM 36983 H2 WAT 1826 82.132 68.035 79.749 1.00 0.00 H TER 36985 WAT 1826 ATOM 36985 O WAT 1827 140.771 90.522 109.639 1.00 0.00 O ATOM 36986 H1 WAT 1827 140.323 91.319 109.355 1.00 0.00 H ATOM 36987 H2 WAT 1827 141.662 90.615 109.303 1.00 0.00 H TER 36989 WAT 1827 ATOM 36989 O WAT 1828 76.238 27.491 100.318 1.00 0.00 O ATOM 36990 H1 WAT 1828 76.649 28.355 100.298 1.00 0.00 H ATOM 36991 H2 WAT 1828 75.314 27.670 100.494 1.00 0.00 H TER 36993 WAT 1828 ATOM 36993 O WAT 1829 126.756 143.022 118.188 1.00 0.00 O ATOM 36994 H1 WAT 1829 126.094 143.695 118.342 1.00 0.00 H ATOM 36995 H2 WAT 1829 127.397 143.152 118.887 1.00 0.00 H TER 36997 WAT 1829 ATOM 36997 O WAT 1830 26.108 4.124 102.223 1.00 0.00 O ATOM 36998 H1 WAT 1830 26.476 4.726 101.576 1.00 0.00 H ATOM 36999 H2 WAT 1830 25.626 3.480 101.704 1.00 0.00 H TER 37001 WAT 1830 ATOM 37001 O WAT 1831 11.701 114.587 96.361 1.00 0.00 O ATOM 37002 H1 WAT 1831 11.308 113.795 95.994 1.00 0.00 H ATOM 37003 H2 WAT 1831 11.242 115.305 95.926 1.00 0.00 H TER 37005 WAT 1831 ATOM 37005 O WAT 1832 6.956 16.941 111.303 1.00 0.00 O ATOM 37006 H1 WAT 1832 7.378 16.756 110.464 1.00 0.00 H ATOM 37007 H2 WAT 1832 6.947 16.098 111.758 1.00 0.00 H TER 37009 WAT 1832 ATOM 37009 O WAT 1833 78.799 86.884 74.159 1.00 0.00 O ATOM 37010 H1 WAT 1833 78.739 87.198 75.061 1.00 0.00 H ATOM 37011 H2 WAT 1833 79.590 86.344 74.145 1.00 0.00 H TER 37013 WAT 1833 ATOM 37013 O WAT 1834 5.523 12.220 113.697 1.00 0.00 O ATOM 37014 H1 WAT 1834 6.089 12.065 112.941 1.00 0.00 H ATOM 37015 H2 WAT 1834 4.911 11.484 113.694 1.00 0.00 H TER 37017 WAT 1834 ATOM 37017 O WAT 1835 58.890 18.740 129.814 1.00 0.00 O ATOM 37018 H1 WAT 1835 58.207 19.173 130.327 1.00 0.00 H ATOM 37019 H2 WAT 1835 59.057 17.921 130.281 1.00 0.00 H TER 37021 WAT 1835 ATOM 37021 O WAT 1836 134.983 55.472 92.652 1.00 0.00 O ATOM 37022 H1 WAT 1836 135.664 55.806 92.068 1.00 0.00 H ATOM 37023 H2 WAT 1836 135.281 54.594 92.890 1.00 0.00 H TER 37025 WAT 1836 ATOM 37025 O WAT 1837 125.876 135.440 144.226 1.00 0.00 O ATOM 37026 H1 WAT 1837 126.752 135.079 144.089 1.00 0.00 H ATOM 37027 H2 WAT 1837 125.331 134.679 144.422 1.00 0.00 H TER 37029 WAT 1837 ATOM 37029 O WAT 1838 130.799 54.797 106.554 1.00 0.00 O ATOM 37030 H1 WAT 1838 130.832 54.162 107.269 1.00 0.00 H ATOM 37031 H2 WAT 1838 131.214 54.349 105.817 1.00 0.00 H TER 37033 WAT 1838 ATOM 37033 O WAT 1839 64.113 141.709 106.010 1.00 0.00 O ATOM 37034 H1 WAT 1839 64.355 140.801 105.828 1.00 0.00 H ATOM 37035 H2 WAT 1839 63.874 141.711 106.937 1.00 0.00 H TER 37037 WAT 1839 ATOM 37037 O WAT 1840 130.356 56.121 76.637 1.00 0.00 O ATOM 37038 H1 WAT 1840 129.713 55.550 77.058 1.00 0.00 H ATOM 37039 H2 WAT 1840 129.853 56.607 75.984 1.00 0.00 H TER 37041 WAT 1840 ATOM 37041 O WAT 1841 45.461 70.281 118.595 1.00 0.00 O ATOM 37042 H1 WAT 1841 45.786 71.000 118.053 1.00 0.00 H ATOM 37043 H2 WAT 1841 45.378 70.659 119.470 1.00 0.00 H TER 37045 WAT 1841 ATOM 37045 O WAT 1842 32.910 113.176 100.672 1.00 0.00 O ATOM 37046 H1 WAT 1842 33.420 113.973 100.527 1.00 0.00 H ATOM 37047 H2 WAT 1842 33.052 112.654 99.881 1.00 0.00 H TER 37049 WAT 1842 ATOM 37049 O WAT 1843 133.825 76.057 18.482 1.00 0.00 O ATOM 37050 H1 WAT 1843 133.336 75.746 19.244 1.00 0.00 H ATOM 37051 H2 WAT 1843 133.574 76.977 18.395 1.00 0.00 H TER 37053 WAT 1843 ATOM 37053 O WAT 1844 7.382 118.216 135.251 1.00 0.00 O ATOM 37054 H1 WAT 1844 7.837 118.953 135.658 1.00 0.00 H ATOM 37055 H2 WAT 1844 6.494 118.538 135.098 1.00 0.00 H TER 37057 WAT 1844 ATOM 37057 O WAT 1845 108.972 100.731 68.778 1.00 0.00 O ATOM 37058 H1 WAT 1845 109.236 100.422 67.911 1.00 0.00 H ATOM 37059 H2 WAT 1845 109.588 101.434 68.980 1.00 0.00 H TER 37061 WAT 1845 ATOM 37061 O WAT 1846 94.010 70.865 148.923 1.00 0.00 O ATOM 37062 H1 WAT 1846 94.217 71.561 148.299 1.00 0.00 H ATOM 37063 H2 WAT 1846 94.855 70.457 149.115 1.00 0.00 H TER 37065 WAT 1846 ATOM 37065 O WAT 1847 30.010 45.310 16.583 1.00 0.00 O ATOM 37066 H1 WAT 1847 29.649 46.047 16.089 1.00 0.00 H ATOM 37067 H2 WAT 1847 29.253 44.752 16.766 1.00 0.00 H TER 37069 WAT 1847 ATOM 37069 O WAT 1848 30.016 32.876 133.091 1.00 0.00 O ATOM 37070 H1 WAT 1848 30.962 32.742 133.141 1.00 0.00 H ATOM 37071 H2 WAT 1848 29.653 32.265 133.732 1.00 0.00 H TER 37073 WAT 1848 ATOM 37073 O WAT 1849 85.569 139.971 67.292 1.00 0.00 O ATOM 37074 H1 WAT 1849 85.261 139.666 68.145 1.00 0.00 H ATOM 37075 H2 WAT 1849 85.455 139.217 66.713 1.00 0.00 H TER 37077 WAT 1849 ATOM 37077 O WAT 1850 111.684 72.811 100.655 1.00 0.00 O ATOM 37078 H1 WAT 1850 111.600 72.724 99.706 1.00 0.00 H ATOM 37079 H2 WAT 1850 111.672 71.911 100.980 1.00 0.00 H TER 37081 WAT 1850 ATOM 37081 O WAT 1851 34.293 16.971 21.584 1.00 0.00 O ATOM 37082 H1 WAT 1851 33.874 16.123 21.729 1.00 0.00 H ATOM 37083 H2 WAT 1851 35.179 16.754 21.294 1.00 0.00 H TER 37085 WAT 1851 ATOM 37085 O WAT 1852 135.824 55.425 100.934 1.00 0.00 O ATOM 37086 H1 WAT 1852 136.000 55.076 101.808 1.00 0.00 H ATOM 37087 H2 WAT 1852 134.953 55.095 100.716 1.00 0.00 H TER 37089 WAT 1852 ATOM 37089 O WAT 1853 26.491 145.451 119.687 1.00 0.00 O ATOM 37090 H1 WAT 1853 27.296 145.966 119.633 1.00 0.00 H ATOM 37091 H2 WAT 1853 25.941 145.931 120.307 1.00 0.00 H TER 37093 WAT 1853 ATOM 37093 O WAT 1854 130.391 64.541 147.478 1.00 0.00 O ATOM 37094 H1 WAT 1854 130.543 65.451 147.730 1.00 0.00 H ATOM 37095 H2 WAT 1854 131.256 64.133 147.516 1.00 0.00 H TER 37097 WAT 1854 ATOM 37097 O WAT 1855 9.649 123.545 103.937 1.00 0.00 O ATOM 37098 H1 WAT 1855 9.886 123.980 103.118 1.00 0.00 H ATOM 37099 H2 WAT 1855 9.596 124.254 104.578 1.00 0.00 H TER 37101 WAT 1855 ATOM 37101 O WAT 1856 124.133 45.576 79.921 1.00 0.00 O ATOM 37102 H1 WAT 1856 123.989 46.491 80.163 1.00 0.00 H ATOM 37103 H2 WAT 1856 124.237 45.121 80.757 1.00 0.00 H TER 37105 WAT 1856 ATOM 37105 O WAT 1857 99.448 19.431 0.908 1.00 0.00 O ATOM 37106 H1 WAT 1857 99.346 20.150 1.532 1.00 0.00 H ATOM 37107 H2 WAT 1857 100.126 19.733 0.304 1.00 0.00 H TER 37109 WAT 1857 ATOM 37109 O WAT 1858 104.208 142.134 13.736 1.00 0.00 O ATOM 37110 H1 WAT 1858 104.109 143.084 13.804 1.00 0.00 H ATOM 37111 H2 WAT 1858 103.997 141.808 14.611 1.00 0.00 H TER 37113 WAT 1858 ATOM 37113 O WAT 1859 68.690 92.731 80.534 1.00 0.00 O ATOM 37114 H1 WAT 1859 69.282 92.236 79.968 1.00 0.00 H ATOM 37115 H2 WAT 1859 68.436 93.490 80.009 1.00 0.00 H TER 37117 WAT 1859 ATOM 37117 O WAT 1860 29.740 31.004 140.770 1.00 0.00 O ATOM 37118 H1 WAT 1860 29.293 30.715 141.565 1.00 0.00 H ATOM 37119 H2 WAT 1860 29.275 30.562 140.059 1.00 0.00 H TER 37121 WAT 1860 ATOM 37121 O WAT 1861 50.674 34.070 58.199 1.00 0.00 O ATOM 37122 H1 WAT 1861 51.587 34.302 58.031 1.00 0.00 H ATOM 37123 H2 WAT 1861 50.607 33.152 57.934 1.00 0.00 H TER 37125 WAT 1861 ATOM 37125 O WAT 1862 99.373 47.184 87.700 1.00 0.00 O ATOM 37126 H1 WAT 1862 100.285 47.472 87.739 1.00 0.00 H ATOM 37127 H2 WAT 1862 99.335 46.426 88.283 1.00 0.00 H TER 37129 WAT 1862 ATOM 37129 O WAT 1863 90.717 72.307 111.376 1.00 0.00 O ATOM 37130 H1 WAT 1863 91.308 72.000 110.689 1.00 0.00 H ATOM 37131 H2 WAT 1863 90.570 71.539 111.927 1.00 0.00 H TER 37133 WAT 1863 ATOM 37133 O WAT 1864 113.398 77.363 17.576 1.00 0.00 O ATOM 37134 H1 WAT 1864 112.607 77.166 18.079 1.00 0.00 H ATOM 37135 H2 WAT 1864 114.080 77.477 18.237 1.00 0.00 H TER 37137 WAT 1864 ATOM 37137 O WAT 1865 145.390 95.944 137.202 1.00 0.00 O ATOM 37138 H1 WAT 1865 145.204 96.090 138.129 1.00 0.00 H ATOM 37139 H2 WAT 1865 144.945 96.663 136.752 1.00 0.00 H TER 37141 WAT 1865 ATOM 37141 O WAT 1866 39.177 69.785 90.259 1.00 0.00 O ATOM 37142 H1 WAT 1866 39.063 68.940 89.823 1.00 0.00 H ATOM 37143 H2 WAT 1866 38.939 69.618 91.171 1.00 0.00 H TER 37145 WAT 1866 ATOM 37145 O WAT 1867 54.819 120.309 61.384 1.00 0.00 O ATOM 37146 H1 WAT 1867 54.300 119.611 60.985 1.00 0.00 H ATOM 37147 H2 WAT 1867 55.720 120.117 61.125 1.00 0.00 H TER 37149 WAT 1867 ATOM 37149 O WAT 1868 95.515 62.109 98.961 1.00 0.00 O ATOM 37150 H1 WAT 1868 95.505 62.898 98.419 1.00 0.00 H ATOM 37151 H2 WAT 1868 96.236 61.586 98.609 1.00 0.00 H TER 37153 WAT 1868 ATOM 37153 O WAT 1869 122.343 10.352 7.813 1.00 0.00 O ATOM 37154 H1 WAT 1869 122.980 10.633 7.157 1.00 0.00 H ATOM 37155 H2 WAT 1869 121.727 11.081 7.877 1.00 0.00 H TER 37157 WAT 1869 ATOM 37157 O WAT 1870 21.775 100.256 64.717 1.00 0.00 O ATOM 37158 H1 WAT 1870 21.205 101.001 64.910 1.00 0.00 H ATOM 37159 H2 WAT 1870 21.510 99.972 63.842 1.00 0.00 H TER 37161 WAT 1870 ATOM 37161 O WAT 1871 42.441 20.661 77.279 1.00 0.00 O ATOM 37162 H1 WAT 1871 41.627 20.673 77.781 1.00 0.00 H ATOM 37163 H2 WAT 1871 43.086 20.285 77.879 1.00 0.00 H TER 37165 WAT 1871 ATOM 37165 O WAT 1872 116.648 98.237 114.925 1.00 0.00 O ATOM 37166 H1 WAT 1872 116.759 97.290 114.844 1.00 0.00 H ATOM 37167 H2 WAT 1872 115.723 98.352 115.142 1.00 0.00 H TER 37169 WAT 1872 ATOM 37169 O WAT 1873 94.614 68.731 146.015 1.00 0.00 O ATOM 37170 H1 WAT 1873 93.947 69.414 145.937 1.00 0.00 H ATOM 37171 H2 WAT 1873 94.143 67.916 145.841 1.00 0.00 H TER 37173 WAT 1873 ATOM 37173 O WAT 1874 28.082 123.561 1.293 1.00 0.00 O ATOM 37174 H1 WAT 1874 27.982 123.855 2.198 1.00 0.00 H ATOM 37175 H2 WAT 1874 28.733 122.861 1.339 1.00 0.00 H TER 37177 WAT 1874 ATOM 37177 O WAT 1875 128.641 63.030 20.166 1.00 0.00 O ATOM 37178 H1 WAT 1875 128.629 62.531 19.349 1.00 0.00 H ATOM 37179 H2 WAT 1875 128.116 63.807 19.979 1.00 0.00 H TER 37181 WAT 1875 ATOM 37181 O WAT 1876 116.936 72.186 19.276 1.00 0.00 O ATOM 37182 H1 WAT 1876 116.538 72.984 18.928 1.00 0.00 H ATOM 37183 H2 WAT 1876 116.263 71.811 19.843 1.00 0.00 H TER 37185 WAT 1876 ATOM 37185 O WAT 1877 9.484 89.528 18.620 1.00 0.00 O ATOM 37186 H1 WAT 1877 9.056 88.675 18.679 1.00 0.00 H ATOM 37187 H2 WAT 1877 9.994 89.485 17.811 1.00 0.00 H TER 37189 WAT 1877 ATOM 37189 O WAT 1878 20.173 64.741 3.714 1.00 0.00 O ATOM 37190 H1 WAT 1878 20.500 65.599 3.982 1.00 0.00 H ATOM 37191 H2 WAT 1878 20.953 64.265 3.429 1.00 0.00 H TER 37193 WAT 1878 ATOM 37193 O WAT 1879 53.266 137.606 59.572 1.00 0.00 O ATOM 37194 H1 WAT 1879 53.256 138.562 59.528 1.00 0.00 H ATOM 37195 H2 WAT 1879 52.543 137.386 60.160 1.00 0.00 H TER 37197 WAT 1879 ATOM 37197 O WAT 1880 92.025 16.243 6.713 1.00 0.00 O ATOM 37198 H1 WAT 1880 91.135 16.489 6.962 1.00 0.00 H ATOM 37199 H2 WAT 1880 92.468 17.076 6.551 1.00 0.00 H TER 37201 WAT 1880 ATOM 37201 O WAT 1881 111.651 46.488 11.909 1.00 0.00 O ATOM 37202 H1 WAT 1881 110.722 46.264 11.846 1.00 0.00 H ATOM 37203 H2 WAT 1881 111.984 46.377 11.018 1.00 0.00 H TER 37205 WAT 1881 ATOM 37205 O WAT 1882 92.104 22.150 84.492 1.00 0.00 O ATOM 37206 H1 WAT 1882 91.222 22.487 84.652 1.00 0.00 H ATOM 37207 H2 WAT 1882 92.415 21.874 85.354 1.00 0.00 H TER 37209 WAT 1882 ATOM 37209 O WAT 1883 95.242 35.919 95.623 1.00 0.00 O ATOM 37210 H1 WAT 1883 96.025 35.746 95.100 1.00 0.00 H ATOM 37211 H2 WAT 1883 94.645 35.203 95.405 1.00 0.00 H TER 37213 WAT 1883 ATOM 37213 O WAT 1884 34.683 140.260 77.276 1.00 0.00 O ATOM 37214 H1 WAT 1884 34.825 139.701 78.040 1.00 0.00 H ATOM 37215 H2 WAT 1884 35.514 140.230 76.801 1.00 0.00 H TER 37217 WAT 1884 ATOM 37217 O WAT 1885 127.367 89.958 152.752 1.00 0.00 O ATOM 37218 H1 WAT 1885 128.049 89.322 152.536 1.00 0.00 H ATOM 37219 H2 WAT 1885 127.245 89.866 153.697 1.00 0.00 H TER 37221 WAT 1885 ATOM 37221 O WAT 1886 116.946 25.426 7.010 1.00 0.00 O ATOM 37222 H1 WAT 1886 116.872 24.629 6.484 1.00 0.00 H ATOM 37223 H2 WAT 1886 117.861 25.442 7.292 1.00 0.00 H TER 37225 WAT 1886 ATOM 37225 O WAT 1887 80.107 93.086 67.968 1.00 0.00 O ATOM 37226 H1 WAT 1887 80.977 93.390 68.228 1.00 0.00 H ATOM 37227 H2 WAT 1887 80.275 92.309 67.434 1.00 0.00 H TER 37229 WAT 1887 ATOM 37229 O WAT 1888 118.431 36.567 7.617 1.00 0.00 O ATOM 37230 H1 WAT 1888 119.016 35.986 7.131 1.00 0.00 H ATOM 37231 H2 WAT 1888 118.134 36.041 8.360 1.00 0.00 H TER 37233 WAT 1888 ATOM 37233 O WAT 1889 1.606 44.666 100.507 1.00 0.00 O ATOM 37234 H1 WAT 1889 2.288 44.343 101.096 1.00 0.00 H ATOM 37235 H2 WAT 1889 1.392 45.536 100.844 1.00 0.00 H TER 37237 WAT 1889 ATOM 37237 O WAT 1890 92.450 137.968 14.921 1.00 0.00 O ATOM 37238 H1 WAT 1890 93.195 137.872 15.515 1.00 0.00 H ATOM 37239 H2 WAT 1890 92.063 138.811 15.157 1.00 0.00 H TER 37241 WAT 1890 ATOM 37241 O WAT 1891 77.100 11.071 147.374 1.00 0.00 O ATOM 37242 H1 WAT 1891 77.286 10.205 147.737 1.00 0.00 H ATOM 37243 H2 WAT 1891 77.757 11.189 146.689 1.00 0.00 H TER 37245 WAT 1891 ATOM 37245 O WAT 1892 34.980 138.726 153.413 1.00 0.00 O ATOM 37246 H1 WAT 1892 34.779 138.050 154.060 1.00 0.00 H ATOM 37247 H2 WAT 1892 35.864 138.515 153.113 1.00 0.00 H TER 37249 WAT 1892 ATOM 37249 O WAT 1893 11.451 90.208 122.636 1.00 0.00 O ATOM 37250 H1 WAT 1893 11.113 91.103 122.647 1.00 0.00 H ATOM 37251 H2 WAT 1893 11.354 89.926 121.726 1.00 0.00 H TER 37253 WAT 1893 ATOM 37253 O WAT 1894 90.669 88.096 91.734 1.00 0.00 O ATOM 37254 H1 WAT 1894 90.641 87.456 91.023 1.00 0.00 H ATOM 37255 H2 WAT 1894 90.578 88.943 91.298 1.00 0.00 H TER 37257 WAT 1894 ATOM 37257 O WAT 1895 0.314 67.544 142.868 1.00 0.00 O ATOM 37258 H1 WAT 1895 0.182 67.317 143.788 1.00 0.00 H ATOM 37259 H2 WAT 1895 -0.219 68.327 142.735 1.00 0.00 H TER 37261 WAT 1895 ATOM 37261 O WAT 1896 110.058 114.785 70.060 1.00 0.00 O ATOM 37262 H1 WAT 1896 109.448 114.068 70.228 1.00 0.00 H ATOM 37263 H2 WAT 1896 109.783 115.479 70.660 1.00 0.00 H TER 37265 WAT 1896 ATOM 37265 O WAT 1897 135.788 133.608 19.630 1.00 0.00 O ATOM 37266 H1 WAT 1897 136.206 134.304 20.138 1.00 0.00 H ATOM 37267 H2 WAT 1897 134.958 133.450 20.080 1.00 0.00 H TER 37269 WAT 1897 ATOM 37269 O WAT 1898 131.565 83.223 64.561 1.00 0.00 O ATOM 37270 H1 WAT 1898 131.208 84.052 64.241 1.00 0.00 H ATOM 37271 H2 WAT 1898 132.052 83.461 65.350 1.00 0.00 H TER 37273 WAT 1898 ATOM 37273 O WAT 1899 118.966 25.831 66.466 1.00 0.00 O ATOM 37274 H1 WAT 1899 119.093 26.743 66.728 1.00 0.00 H ATOM 37275 H2 WAT 1899 118.015 25.721 66.437 1.00 0.00 H TER 37277 WAT 1899 ATOM 37277 O WAT 1900 46.468 93.240 110.634 1.00 0.00 O ATOM 37278 H1 WAT 1900 46.515 93.924 109.966 1.00 0.00 H ATOM 37279 H2 WAT 1900 47.350 93.206 111.004 1.00 0.00 H TER 37281 WAT 1900 ATOM 37281 O WAT 1901 129.032 9.709 97.098 1.00 0.00 O ATOM 37282 H1 WAT 1901 128.948 10.096 97.969 1.00 0.00 H ATOM 37283 H2 WAT 1901 129.934 9.390 97.063 1.00 0.00 H TER 37285 WAT 1901 ATOM 37285 O WAT 1902 66.418 116.713 96.917 1.00 0.00 O ATOM 37286 H1 WAT 1902 65.557 116.404 96.635 1.00 0.00 H ATOM 37287 H2 WAT 1902 67.029 116.319 96.294 1.00 0.00 H TER 37289 WAT 1902 ATOM 37289 O WAT 1903 56.640 82.355 111.369 1.00 0.00 O ATOM 37290 H1 WAT 1903 55.935 82.795 111.846 1.00 0.00 H ATOM 37291 H2 WAT 1903 56.642 81.462 111.714 1.00 0.00 H TER 37293 WAT 1903 ATOM 37293 O WAT 1904 135.565 88.383 75.736 1.00 0.00 O ATOM 37294 H1 WAT 1904 135.842 89.248 76.039 1.00 0.00 H ATOM 37295 H2 WAT 1904 135.217 87.955 76.519 1.00 0.00 H TER 37297 WAT 1904 ATOM 37297 O WAT 1905 113.246 12.954 77.991 1.00 0.00 O ATOM 37298 H1 WAT 1905 112.749 13.143 77.195 1.00 0.00 H ATOM 37299 H2 WAT 1905 114.034 13.493 77.915 1.00 0.00 H TER 37301 WAT 1905 ATOM 37301 O WAT 1906 102.787 92.438 153.570 1.00 0.00 O ATOM 37302 H1 WAT 1906 102.591 91.503 153.634 1.00 0.00 H ATOM 37303 H2 WAT 1906 103.728 92.474 153.399 1.00 0.00 H TER 37305 WAT 1906 ATOM 37305 O WAT 1907 135.183 1.593 10.146 1.00 0.00 O ATOM 37306 H1 WAT 1907 135.451 0.729 10.458 1.00 0.00 H ATOM 37307 H2 WAT 1907 135.053 1.478 9.204 1.00 0.00 H TER 37309 WAT 1907 ATOM 37309 O WAT 1908 48.583 51.863 92.993 1.00 0.00 O ATOM 37310 H1 WAT 1908 48.593 51.518 92.101 1.00 0.00 H ATOM 37311 H2 WAT 1908 49.452 51.661 93.339 1.00 0.00 H TER 37313 WAT 1908 ATOM 37313 O WAT 1909 131.521 133.120 25.749 1.00 0.00 O ATOM 37314 H1 WAT 1909 131.232 133.593 24.968 1.00 0.00 H ATOM 37315 H2 WAT 1909 130.789 133.196 26.360 1.00 0.00 H TER 37317 WAT 1909 ATOM 37317 O WAT 1910 45.753 103.260 75.320 1.00 0.00 O ATOM 37318 H1 WAT 1910 45.185 102.780 74.717 1.00 0.00 H ATOM 37319 H2 WAT 1910 46.550 103.428 74.817 1.00 0.00 H TER 37321 WAT 1910 ATOM 37321 O WAT 1911 82.689 68.309 135.090 1.00 0.00 O ATOM 37322 H1 WAT 1911 82.402 67.502 134.665 1.00 0.00 H ATOM 37323 H2 WAT 1911 82.872 68.910 134.367 1.00 0.00 H TER 37325 WAT 1911 ATOM 37325 O WAT 1912 122.690 27.747 149.604 1.00 0.00 O ATOM 37326 H1 WAT 1912 123.539 28.186 149.652 1.00 0.00 H ATOM 37327 H2 WAT 1912 122.502 27.489 150.507 1.00 0.00 H TER 37329 WAT 1912 ATOM 37329 O WAT 1913 18.912 61.053 100.810 1.00 0.00 O ATOM 37330 H1 WAT 1913 18.765 60.706 101.690 1.00 0.00 H ATOM 37331 H2 WAT 1913 19.651 60.546 100.474 1.00 0.00 H TER 37333 WAT 1913 ATOM 37333 O WAT 1914 83.648 23.316 114.213 1.00 0.00 O ATOM 37334 H1 WAT 1914 83.622 22.940 115.092 1.00 0.00 H ATOM 37335 H2 WAT 1914 82.730 23.466 113.988 1.00 0.00 H TER 37337 WAT 1914 ATOM 37337 O WAT 1915 44.509 92.720 150.231 1.00 0.00 O ATOM 37338 H1 WAT 1915 43.957 92.277 150.875 1.00 0.00 H ATOM 37339 H2 WAT 1915 44.792 92.023 149.639 1.00 0.00 H TER 37341 WAT 1915 ATOM 37341 O WAT 1916 25.335 29.899 135.321 1.00 0.00 O ATOM 37342 H1 WAT 1916 26.000 29.282 135.014 1.00 0.00 H ATOM 37343 H2 WAT 1916 25.317 30.583 134.652 1.00 0.00 H TER 37345 WAT 1916 ATOM 37345 O WAT 1917 74.845 0.589 75.344 1.00 0.00 O ATOM 37346 H1 WAT 1917 75.800 0.658 75.313 1.00 0.00 H ATOM 37347 H2 WAT 1917 74.541 1.496 75.364 1.00 0.00 H TER 37349 WAT 1917 ATOM 37349 O WAT 1918 90.876 95.339 154.376 1.00 0.00 O ATOM 37350 H1 WAT 1918 91.085 96.109 154.905 1.00 0.00 H ATOM 37351 H2 WAT 1918 90.126 95.609 153.845 1.00 0.00 H TER 37353 WAT 1918 ATOM 37353 O WAT 1919 2.864 51.117 155.368 1.00 0.00 O ATOM 37354 H1 WAT 1919 3.308 50.576 156.021 1.00 0.00 H ATOM 37355 H2 WAT 1919 2.794 50.553 154.598 1.00 0.00 H TER 37357 WAT 1919 ATOM 37357 O WAT 1920 8.031 113.729 14.931 1.00 0.00 O ATOM 37358 H1 WAT 1920 7.495 113.828 15.718 1.00 0.00 H ATOM 37359 H2 WAT 1920 7.813 112.858 14.600 1.00 0.00 H TER 37361 WAT 1920 ATOM 37361 O WAT 1921 132.067 40.385 113.696 1.00 0.00 O ATOM 37362 H1 WAT 1921 132.356 40.939 112.971 1.00 0.00 H ATOM 37363 H2 WAT 1921 132.810 39.806 113.866 1.00 0.00 H TER 37365 WAT 1921 ATOM 37365 O WAT 1922 11.920 145.523 64.771 1.00 0.00 O ATOM 37366 H1 WAT 1922 11.455 145.328 63.958 1.00 0.00 H ATOM 37367 H2 WAT 1922 12.839 145.587 64.512 1.00 0.00 H TER 37369 WAT 1922 ATOM 37369 O WAT 1923 80.970 95.772 5.555 1.00 0.00 O ATOM 37370 H1 WAT 1923 81.595 95.688 4.835 1.00 0.00 H ATOM 37371 H2 WAT 1923 80.123 95.884 5.125 1.00 0.00 H TER 37373 WAT 1923 ATOM 37373 O WAT 1924 5.052 133.235 83.597 1.00 0.00 O ATOM 37374 H1 WAT 1924 4.724 132.916 84.437 1.00 0.00 H ATOM 37375 H2 WAT 1924 5.781 132.652 83.387 1.00 0.00 H TER 37377 WAT 1924 ATOM 37377 O WAT 1925 51.224 76.803 105.366 1.00 0.00 O ATOM 37378 H1 WAT 1925 50.298 76.807 105.124 1.00 0.00 H ATOM 37379 H2 WAT 1925 51.599 76.076 104.869 1.00 0.00 H TER 37381 WAT 1925 ATOM 37381 O WAT 1926 45.091 104.223 69.528 1.00 0.00 O ATOM 37382 H1 WAT 1926 45.189 104.684 70.361 1.00 0.00 H ATOM 37383 H2 WAT 1926 45.618 104.730 68.911 1.00 0.00 H TER 37385 WAT 1926 ATOM 37385 O WAT 1927 76.357 107.757 78.891 1.00 0.00 O ATOM 37386 H1 WAT 1927 76.420 108.709 78.814 1.00 0.00 H ATOM 37387 H2 WAT 1927 77.049 107.520 79.509 1.00 0.00 H TER 37389 WAT 1927 ATOM 37389 O WAT 1928 117.179 86.211 96.850 1.00 0.00 O ATOM 37390 H1 WAT 1928 117.953 85.975 96.338 1.00 0.00 H ATOM 37391 H2 WAT 1928 116.468 86.240 96.210 1.00 0.00 H TER 37393 WAT 1928 ATOM 37393 O WAT 1929 141.364 80.580 136.729 1.00 0.00 O ATOM 37394 H1 WAT 1929 140.761 80.521 135.989 1.00 0.00 H ATOM 37395 H2 WAT 1929 142.100 80.018 136.486 1.00 0.00 H TER 37397 WAT 1929 ATOM 37397 O WAT 1930 46.785 34.404 153.790 1.00 0.00 O ATOM 37398 H1 WAT 1930 45.863 34.389 153.532 1.00 0.00 H ATOM 37399 H2 WAT 1930 46.769 34.300 154.741 1.00 0.00 H TER 37401 WAT 1930 ATOM 37401 O WAT 1931 92.695 119.254 121.391 1.00 0.00 O ATOM 37402 H1 WAT 1931 91.877 118.791 121.569 1.00 0.00 H ATOM 37403 H2 WAT 1931 92.451 119.943 120.773 1.00 0.00 H TER 37405 WAT 1931 ATOM 37405 O WAT 1932 123.851 13.882 7.637 1.00 0.00 O ATOM 37406 H1 WAT 1932 123.964 13.074 7.137 1.00 0.00 H ATOM 37407 H2 WAT 1932 123.793 13.594 8.548 1.00 0.00 H TER 37409 WAT 1932 ATOM 37409 O WAT 1933 128.669 120.006 122.798 1.00 0.00 O ATOM 37410 H1 WAT 1933 128.451 120.630 122.106 1.00 0.00 H ATOM 37411 H2 WAT 1933 129.619 120.080 122.897 1.00 0.00 H TER 37413 WAT 1933 ATOM 37413 O WAT 1934 0.297 128.192 157.941 1.00 0.00 O ATOM 37414 H1 WAT 1934 0.781 128.677 158.609 1.00 0.00 H ATOM 37415 H2 WAT 1934 -0.067 127.440 158.407 1.00 0.00 H TER 37417 WAT 1934 ATOM 37417 O WAT 1935 2.858 126.732 17.256 1.00 0.00 O ATOM 37418 H1 WAT 1935 3.061 126.258 18.062 1.00 0.00 H ATOM 37419 H2 WAT 1935 3.699 127.086 16.967 1.00 0.00 H TER 37421 WAT 1935 ATOM 37421 O WAT 1936 78.323 46.513 70.174 1.00 0.00 O ATOM 37422 H1 WAT 1936 79.216 46.442 69.838 1.00 0.00 H ATOM 37423 H2 WAT 1936 78.310 47.344 70.649 1.00 0.00 H TER 37425 WAT 1936 ATOM 37425 O WAT 1937 43.646 110.415 110.855 1.00 0.00 O ATOM 37426 H1 WAT 1937 44.532 110.275 110.521 1.00 0.00 H ATOM 37427 H2 WAT 1937 43.601 109.881 111.648 1.00 0.00 H TER 37429 WAT 1937 ATOM 37429 O WAT 1938 73.585 134.986 54.561 1.00 0.00 O ATOM 37430 H1 WAT 1938 73.334 134.168 54.990 1.00 0.00 H ATOM 37431 H2 WAT 1938 73.400 135.664 55.210 1.00 0.00 H TER 37433 WAT 1938 ATOM 37433 O WAT 1939 140.156 44.500 98.590 1.00 0.00 O ATOM 37434 H1 WAT 1939 139.388 44.993 98.880 1.00 0.00 H ATOM 37435 H2 WAT 1939 140.028 43.623 98.951 1.00 0.00 H TER 37437 WAT 1939 ATOM 37437 O WAT 1940 100.281 13.759 13.761 1.00 0.00 O ATOM 37438 H1 WAT 1940 100.086 12.860 13.496 1.00 0.00 H ATOM 37439 H2 WAT 1940 100.195 14.270 12.956 1.00 0.00 H TER 37441 WAT 1940 ATOM 37441 O WAT 1941 79.167 132.550 77.902 1.00 0.00 O ATOM 37442 H1 WAT 1941 78.938 132.358 76.993 1.00 0.00 H ATOM 37443 H2 WAT 1941 79.536 133.433 77.875 1.00 0.00 H TER 37445 WAT 1941 ATOM 37445 O WAT 1942 109.356 141.427 107.092 1.00 0.00 O ATOM 37446 H1 WAT 1942 110.105 141.906 107.447 1.00 0.00 H ATOM 37447 H2 WAT 1942 109.645 141.138 106.226 1.00 0.00 H TER 37449 WAT 1942 ATOM 37449 O WAT 1943 110.739 115.976 22.510 1.00 0.00 O ATOM 37450 H1 WAT 1943 109.829 116.184 22.299 1.00 0.00 H ATOM 37451 H2 WAT 1943 110.709 115.080 22.844 1.00 0.00 H TER 37453 WAT 1943 ATOM 37453 O WAT 1944 42.584 22.649 133.776 1.00 0.00 O ATOM 37454 H1 WAT 1944 43.075 23.470 133.785 1.00 0.00 H ATOM 37455 H2 WAT 1944 42.290 22.535 134.680 1.00 0.00 H TER 37457 WAT 1944 ATOM 37457 O WAT 1945 15.925 56.078 117.294 1.00 0.00 O ATOM 37458 H1 WAT 1945 16.130 56.482 116.451 1.00 0.00 H ATOM 37459 H2 WAT 1945 16.688 55.536 117.493 1.00 0.00 H TER 37461 WAT 1945 ATOM 37461 O WAT 1946 82.233 118.634 10.857 1.00 0.00 O ATOM 37462 H1 WAT 1946 81.374 118.565 11.275 1.00 0.00 H ATOM 37463 H2 WAT 1946 82.159 119.394 10.281 1.00 0.00 H TER 37465 WAT 1946 ATOM 37465 O WAT 1947 70.346 90.665 95.618 1.00 0.00 O ATOM 37466 H1 WAT 1947 69.986 90.243 94.839 1.00 0.00 H ATOM 37467 H2 WAT 1947 69.578 90.945 96.116 1.00 0.00 H TER 37469 WAT 1947 ATOM 37469 O WAT 1948 35.907 31.571 16.299 1.00 0.00 O ATOM 37470 H1 WAT 1948 36.314 31.766 17.143 1.00 0.00 H ATOM 37471 H2 WAT 1948 35.898 30.615 16.252 1.00 0.00 H TER 37473 WAT 1948 ATOM 37473 O WAT 1949 15.721 80.131 6.328 1.00 0.00 O ATOM 37474 H1 WAT 1949 15.659 81.026 6.660 1.00 0.00 H ATOM 37475 H2 WAT 1949 14.813 79.861 6.193 1.00 0.00 H TER 37477 WAT 1949 ATOM 37477 O WAT 1950 141.598 56.535 156.986 1.00 0.00 O ATOM 37478 H1 WAT 1950 141.003 56.221 157.667 1.00 0.00 H ATOM 37479 H2 WAT 1950 141.020 56.865 156.297 1.00 0.00 H TER 37481 WAT 1950 ATOM 37481 O WAT 1951 127.849 117.444 132.525 1.00 0.00 O ATOM 37482 H1 WAT 1951 128.775 117.636 132.382 1.00 0.00 H ATOM 37483 H2 WAT 1951 127.845 116.787 133.221 1.00 0.00 H TER 37485 WAT 1951 ATOM 37485 O WAT 1952 69.561 27.055 132.477 1.00 0.00 O ATOM 37486 H1 WAT 1952 70.276 26.427 132.584 1.00 0.00 H ATOM 37487 H2 WAT 1952 69.024 26.688 131.775 1.00 0.00 H TER 37489 WAT 1952 ATOM 37489 O WAT 1953 37.911 11.890 94.939 1.00 0.00 O ATOM 37490 H1 WAT 1953 37.406 11.510 95.658 1.00 0.00 H ATOM 37491 H2 WAT 1953 38.267 12.702 95.301 1.00 0.00 H TER 37493 WAT 1953 ATOM 37493 O WAT 1954 1.439 100.399 109.903 1.00 0.00 O ATOM 37494 H1 WAT 1954 0.583 100.260 110.308 1.00 0.00 H ATOM 37495 H2 WAT 1954 2.026 99.806 110.374 1.00 0.00 H TER 37497 WAT 1954 ATOM 37497 O WAT 1955 137.681 45.564 92.388 1.00 0.00 O ATOM 37498 H1 WAT 1955 136.733 45.457 92.464 1.00 0.00 H ATOM 37499 H2 WAT 1955 137.791 46.295 91.780 1.00 0.00 H TER 37501 WAT 1955 ATOM 37501 O WAT 1956 29.694 141.352 89.018 1.00 0.00 O ATOM 37502 H1 WAT 1956 28.781 141.522 88.785 1.00 0.00 H ATOM 37503 H2 WAT 1956 30.004 142.179 89.389 1.00 0.00 H TER 37505 WAT 1956 ATOM 37505 O WAT 1957 45.477 132.451 73.228 1.00 0.00 O ATOM 37506 H1 WAT 1957 45.386 133.298 73.663 1.00 0.00 H ATOM 37507 H2 WAT 1957 46.196 132.020 73.691 1.00 0.00 H TER 37509 WAT 1957 ATOM 37509 O WAT 1958 89.633 118.721 158.258 1.00 0.00 O ATOM 37510 H1 WAT 1958 90.029 117.863 158.102 1.00 0.00 H ATOM 37511 H2 WAT 1958 89.625 118.811 159.211 1.00 0.00 H TER 37513 WAT 1958 ATOM 37513 O WAT 1959 127.964 48.714 59.571 1.00 0.00 O ATOM 37514 H1 WAT 1959 127.296 48.858 58.901 1.00 0.00 H ATOM 37515 H2 WAT 1959 128.790 48.921 59.134 1.00 0.00 H TER 37517 WAT 1959 ATOM 37517 O WAT 1960 112.173 86.448 88.755 1.00 0.00 O ATOM 37518 H1 WAT 1960 112.390 87.360 88.948 1.00 0.00 H ATOM 37519 H2 WAT 1960 111.819 86.106 89.576 1.00 0.00 H TER 37521 WAT 1960 ATOM 37521 O WAT 1961 33.370 30.279 113.120 1.00 0.00 O ATOM 37522 H1 WAT 1961 33.954 29.537 113.279 1.00 0.00 H ATOM 37523 H2 WAT 1961 33.623 30.602 112.255 1.00 0.00 H TER 37525 WAT 1961 ATOM 37525 O WAT 1962 120.584 38.350 88.804 1.00 0.00 O ATOM 37526 H1 WAT 1962 120.402 39.142 88.298 1.00 0.00 H ATOM 37527 H2 WAT 1962 119.852 38.284 89.418 1.00 0.00 H TER 37529 WAT 1962 ATOM 37529 O WAT 1963 93.211 45.567 73.309 1.00 0.00 O ATOM 37530 H1 WAT 1963 93.005 46.475 73.533 1.00 0.00 H ATOM 37531 H2 WAT 1963 92.814 45.437 72.448 1.00 0.00 H TER 37533 WAT 1963 ATOM 37533 O WAT 1964 72.901 115.627 122.778 1.00 0.00 O ATOM 37534 H1 WAT 1964 73.077 115.847 123.693 1.00 0.00 H ATOM 37535 H2 WAT 1964 71.980 115.367 122.767 1.00 0.00 H TER 37537 WAT 1964 ATOM 37537 O WAT 1965 65.524 6.356 128.447 1.00 0.00 O ATOM 37538 H1 WAT 1965 64.719 6.049 128.864 1.00 0.00 H ATOM 37539 H2 WAT 1965 65.829 7.068 129.009 1.00 0.00 H TER 37541 WAT 1965 ATOM 37541 O WAT 1966 76.263 26.429 15.165 1.00 0.00 O ATOM 37542 H1 WAT 1966 76.747 25.618 15.012 1.00 0.00 H ATOM 37543 H2 WAT 1966 75.622 26.201 15.839 1.00 0.00 H TER 37545 WAT 1966 ATOM 37545 O WAT 1967 65.692 62.744 122.873 1.00 0.00 O ATOM 37546 H1 WAT 1967 64.795 62.857 123.190 1.00 0.00 H ATOM 37547 H2 WAT 1967 66.040 62.020 123.393 1.00 0.00 H TER 37549 WAT 1967 ATOM 37549 O WAT 1968 9.092 109.363 158.659 1.00 0.00 O ATOM 37550 H1 WAT 1968 10.024 109.579 158.696 1.00 0.00 H ATOM 37551 H2 WAT 1968 8.733 109.966 158.008 1.00 0.00 H TER 37553 WAT 1968 ATOM 37553 O WAT 1969 99.346 104.458 135.184 1.00 0.00 O ATOM 37554 H1 WAT 1969 99.810 104.942 135.867 1.00 0.00 H ATOM 37555 H2 WAT 1969 99.485 103.538 135.406 1.00 0.00 H TER 37557 WAT 1969 ATOM 37557 O WAT 1970 126.785 1.163 90.926 1.00 0.00 O ATOM 37558 H1 WAT 1970 127.216 2.015 90.862 1.00 0.00 H ATOM 37559 H2 WAT 1970 127.480 0.561 91.191 1.00 0.00 H TER 37561 WAT 1970 ATOM 37561 O WAT 1971 78.671 6.969 16.431 1.00 0.00 O ATOM 37562 H1 WAT 1971 77.765 7.088 16.716 1.00 0.00 H ATOM 37563 H2 WAT 1971 78.604 6.775 15.496 1.00 0.00 H TER 37565 WAT 1971 ATOM 37565 O WAT 1972 19.094 105.048 12.924 1.00 0.00 O ATOM 37566 H1 WAT 1972 19.499 105.156 13.784 1.00 0.00 H ATOM 37567 H2 WAT 1972 19.789 104.682 12.376 1.00 0.00 H TER 37569 WAT 1972 ATOM 37569 O WAT 1973 137.974 137.243 144.644 1.00 0.00 O ATOM 37570 H1 WAT 1973 137.619 138.034 145.049 1.00 0.00 H ATOM 37571 H2 WAT 1973 138.237 137.520 143.767 1.00 0.00 H TER 37573 WAT 1973 ATOM 37573 O WAT 1974 47.652 85.601 133.517 1.00 0.00 O ATOM 37574 H1 WAT 1974 48.364 85.355 132.927 1.00 0.00 H ATOM 37575 H2 WAT 1974 48.083 85.771 134.354 1.00 0.00 H TER 37577 WAT 1974 ATOM 37577 O WAT 1975 50.890 18.115 140.076 1.00 0.00 O ATOM 37578 H1 WAT 1975 51.325 18.744 140.651 1.00 0.00 H ATOM 37579 H2 WAT 1975 50.235 17.694 140.634 1.00 0.00 H TER 37581 WAT 1975 ATOM 37581 O WAT 1976 76.054 142.337 139.967 1.00 0.00 O ATOM 37582 H1 WAT 1976 75.300 142.359 140.555 1.00 0.00 H ATOM 37583 H2 WAT 1976 76.799 142.562 140.524 1.00 0.00 H TER 37585 WAT 1976 ATOM 37585 O WAT 1977 39.425 84.314 4.982 1.00 0.00 O ATOM 37586 H1 WAT 1977 39.833 85.163 5.149 1.00 0.00 H ATOM 37587 H2 WAT 1977 39.392 83.890 5.840 1.00 0.00 H TER 37589 WAT 1977 ATOM 37589 O WAT 1978 24.601 48.185 22.851 1.00 0.00 O ATOM 37590 H1 WAT 1978 24.686 48.999 22.355 1.00 0.00 H ATOM 37591 H2 WAT 1978 23.663 47.998 22.848 1.00 0.00 H TER 37593 WAT 1978 ATOM 37593 O WAT 1979 94.205 91.488 85.240 1.00 0.00 O ATOM 37594 H1 WAT 1979 93.782 90.644 85.083 1.00 0.00 H ATOM 37595 H2 WAT 1979 94.989 91.468 84.691 1.00 0.00 H TER 37597 WAT 1979 ATOM 37597 O WAT 1980 82.590 37.525 145.819 1.00 0.00 O ATOM 37598 H1 WAT 1980 82.941 38.365 146.116 1.00 0.00 H ATOM 37599 H2 WAT 1980 82.037 37.748 145.070 1.00 0.00 H TER 37601 WAT 1980 ATOM 37601 O WAT 1981 54.336 84.753 111.989 1.00 0.00 O ATOM 37602 H1 WAT 1981 55.066 85.269 112.331 1.00 0.00 H ATOM 37603 H2 WAT 1981 54.540 84.632 111.062 1.00 0.00 H TER 37605 WAT 1981 ATOM 37605 O WAT 1982 21.806 128.434 79.163 1.00 0.00 O ATOM 37606 H1 WAT 1982 21.073 129.048 79.121 1.00 0.00 H ATOM 37607 H2 WAT 1982 22.552 128.927 78.821 1.00 0.00 H TER 37609 WAT 1982 ATOM 37609 O WAT 1983 52.853 123.657 135.156 1.00 0.00 O ATOM 37610 H1 WAT 1983 52.356 124.468 135.262 1.00 0.00 H ATOM 37611 H2 WAT 1983 52.308 123.115 134.585 1.00 0.00 H TER 37613 WAT 1983 ATOM 37613 O WAT 1984 118.424 32.764 106.299 1.00 0.00 O ATOM 37614 H1 WAT 1984 117.919 32.793 105.486 1.00 0.00 H ATOM 37615 H2 WAT 1984 117.769 32.630 106.984 1.00 0.00 H TER 37617 WAT 1984 ATOM 37617 O WAT 1985 139.973 25.039 158.069 1.00 0.00 O ATOM 37618 H1 WAT 1985 140.038 25.986 158.189 1.00 0.00 H ATOM 37619 H2 WAT 1985 139.593 24.934 157.197 1.00 0.00 H TER 37621 WAT 1985 ATOM 37621 O WAT 1986 81.458 143.662 92.208 1.00 0.00 O ATOM 37622 H1 WAT 1986 80.809 143.806 92.896 1.00 0.00 H ATOM 37623 H2 WAT 1986 81.689 142.736 92.286 1.00 0.00 H TER 37625 WAT 1986 ATOM 37625 O WAT 1987 141.131 72.661 9.855 1.00 0.00 O ATOM 37626 H1 WAT 1987 140.679 73.309 9.315 1.00 0.00 H ATOM 37627 H2 WAT 1987 141.868 73.139 10.236 1.00 0.00 H TER 37629 WAT 1987 ATOM 37629 O WAT 1988 96.250 91.205 119.741 1.00 0.00 O ATOM 37630 H1 WAT 1988 96.348 91.409 118.811 1.00 0.00 H ATOM 37631 H2 WAT 1988 95.305 91.224 119.893 1.00 0.00 H TER 37633 WAT 1988 ATOM 37633 O WAT 1989 53.571 88.648 18.693 1.00 0.00 O ATOM 37634 H1 WAT 1989 53.761 89.484 19.119 1.00 0.00 H ATOM 37635 H2 WAT 1989 53.310 88.068 19.408 1.00 0.00 H TER 37637 WAT 1989 ATOM 37637 O WAT 1990 90.225 86.499 89.326 1.00 0.00 O ATOM 37638 H1 WAT 1990 91.078 86.131 89.097 1.00 0.00 H ATOM 37639 H2 WAT 1990 89.995 87.054 88.581 1.00 0.00 H TER 37641 WAT 1990 ATOM 37641 O WAT 1991 36.936 83.845 102.662 1.00 0.00 O ATOM 37642 H1 WAT 1991 37.869 83.758 102.857 1.00 0.00 H ATOM 37643 H2 WAT 1991 36.756 83.140 102.040 1.00 0.00 H TER 37645 WAT 1991 ATOM 37645 O WAT 1992 77.454 106.878 15.460 1.00 0.00 O ATOM 37646 H1 WAT 1992 76.885 107.510 15.899 1.00 0.00 H ATOM 37647 H2 WAT 1992 78.284 107.341 15.348 1.00 0.00 H TER 37649 WAT 1992 ATOM 37649 O WAT 1993 59.398 63.686 5.272 1.00 0.00 O ATOM 37650 H1 WAT 1993 58.862 63.721 4.480 1.00 0.00 H ATOM 37651 H2 WAT 1993 59.256 62.806 5.619 1.00 0.00 H TER 37653 WAT 1993 ATOM 37653 O WAT 1994 121.239 36.955 17.699 1.00 0.00 O ATOM 37654 H1 WAT 1994 120.425 36.453 17.673 1.00 0.00 H ATOM 37655 H2 WAT 1994 121.917 36.302 17.877 1.00 0.00 H TER 37657 WAT 1994 ATOM 37657 O WAT 1995 14.844 94.070 135.426 1.00 0.00 O ATOM 37658 H1 WAT 1995 13.942 94.073 135.104 1.00 0.00 H ATOM 37659 H2 WAT 1995 14.767 93.844 136.353 1.00 0.00 H TER 37661 WAT 1995 ATOM 37661 O WAT 1996 72.519 90.489 97.136 1.00 0.00 O ATOM 37662 H1 WAT 1996 71.743 90.589 96.586 1.00 0.00 H ATOM 37663 H2 WAT 1996 73.130 89.984 96.600 1.00 0.00 H TER 37665 WAT 1996 ATOM 37665 O WAT 1997 55.164 49.544 113.948 1.00 0.00 O ATOM 37666 H1 WAT 1997 54.695 49.445 113.119 1.00 0.00 H ATOM 37667 H2 WAT 1997 55.206 50.490 114.087 1.00 0.00 H TER 37669 WAT 1997 ATOM 37669 O WAT 1998 27.097 135.104 0.066 1.00 0.00 O ATOM 37670 H1 WAT 1998 27.400 134.743 0.899 1.00 0.00 H ATOM 37671 H2 WAT 1998 26.550 134.414 -0.309 1.00 0.00 H TER 37673 WAT 1998 ATOM 37673 O WAT 1999 126.108 13.324 73.166 1.00 0.00 O ATOM 37674 H1 WAT 1999 125.778 14.032 73.720 1.00 0.00 H ATOM 37675 H2 WAT 1999 125.851 13.574 72.279 1.00 0.00 H TER 37677 WAT 1999 ATOM 37677 O WAT 2000 53.665 45.555 129.383 1.00 0.00 O ATOM 37678 H1 WAT 2000 52.837 45.496 128.906 1.00 0.00 H ATOM 37679 H2 WAT 2000 53.790 46.493 129.530 1.00 0.00 H TER 37681 WAT 2000 ATOM 37681 O WAT 2001 91.804 106.188 13.727 1.00 0.00 O ATOM 37682 H1 WAT 2001 92.070 107.020 13.337 1.00 0.00 H ATOM 37683 H2 WAT 2001 91.120 106.424 14.353 1.00 0.00 H TER 37685 WAT 2001 ATOM 37685 O WAT 2002 30.842 92.772 27.515 1.00 0.00 O ATOM 37686 H1 WAT 2002 31.716 92.938 27.868 1.00 0.00 H ATOM 37687 H2 WAT 2002 30.803 93.294 26.714 1.00 0.00 H TER 37689 WAT 2002 ATOM 37689 O WAT 2003 106.135 145.915 59.432 1.00 0.00 O ATOM 37690 H1 WAT 2003 106.877 146.202 59.964 1.00 0.00 H ATOM 37691 H2 WAT 2003 106.295 144.984 59.279 1.00 0.00 H TER 37693 WAT 2003 ATOM 37693 O WAT 2004 123.674 140.152 69.278 1.00 0.00 O ATOM 37694 H1 WAT 2004 124.096 139.306 69.426 1.00 0.00 H ATOM 37695 H2 WAT 2004 124.204 140.775 69.775 1.00 0.00 H TER 37697 WAT 2004 ATOM 37697 O WAT 2005 27.492 71.117 135.912 1.00 0.00 O ATOM 37698 H1 WAT 2005 28.043 71.882 136.073 1.00 0.00 H ATOM 37699 H2 WAT 2005 27.992 70.382 136.269 1.00 0.00 H TER 37701 WAT 2005 ATOM 37701 O WAT 2006 126.154 139.706 89.726 1.00 0.00 O ATOM 37702 H1 WAT 2006 125.992 138.843 89.345 1.00 0.00 H ATOM 37703 H2 WAT 2006 126.626 140.184 89.044 1.00 0.00 H TER 37705 WAT 2006 ATOM 37705 O WAT 2007 55.295 122.075 6.160 1.00 0.00 O ATOM 37706 H1 WAT 2007 55.787 122.892 6.240 1.00 0.00 H ATOM 37707 H2 WAT 2007 54.386 122.325 6.328 1.00 0.00 H TER 37709 WAT 2007 ATOM 37709 O WAT 2008 117.806 128.068 100.713 1.00 0.00 O ATOM 37710 H1 WAT 2008 117.245 128.329 101.443 1.00 0.00 H ATOM 37711 H2 WAT 2008 117.689 127.120 100.649 1.00 0.00 H TER 37713 WAT 2008 ATOM 37713 O WAT 2009 119.560 126.970 155.832 1.00 0.00 O ATOM 37714 H1 WAT 2009 118.690 126.926 156.227 1.00 0.00 H ATOM 37715 H2 WAT 2009 119.894 127.831 156.083 1.00 0.00 H TER 37717 WAT 2009 ATOM 37717 O WAT 2010 124.669 24.323 121.384 1.00 0.00 O ATOM 37718 H1 WAT 2010 124.110 23.656 120.984 1.00 0.00 H ATOM 37719 H2 WAT 2010 124.063 25.014 121.650 1.00 0.00 H TER 37721 WAT 2010 ATOM 37721 O WAT 2011 103.069 43.287 62.515 1.00 0.00 O ATOM 37722 H1 WAT 2011 102.611 42.620 62.004 1.00 0.00 H ATOM 37723 H2 WAT 2011 103.816 43.534 61.970 1.00 0.00 H TER 37725 WAT 2011 ATOM 37725 O WAT 2012 47.161 68.240 138.676 1.00 0.00 O ATOM 37726 H1 WAT 2012 47.045 67.519 138.057 1.00 0.00 H ATOM 37727 H2 WAT 2012 46.389 68.791 138.548 1.00 0.00 H TER 37729 WAT 2012 ATOM 37729 O WAT 2013 23.727 57.157 156.209 1.00 0.00 O ATOM 37730 H1 WAT 2013 23.558 57.580 157.052 1.00 0.00 H ATOM 37731 H2 WAT 2013 24.015 56.274 156.438 1.00 0.00 H TER 37733 WAT 2013 ATOM 37733 O WAT 2014 112.931 98.209 78.477 1.00 0.00 O ATOM 37734 H1 WAT 2014 111.987 98.366 78.477 1.00 0.00 H ATOM 37735 H2 WAT 2014 113.019 97.284 78.711 1.00 0.00 H TER 37737 WAT 2014 ATOM 37737 O WAT 2015 133.005 27.635 101.699 1.00 0.00 O ATOM 37738 H1 WAT 2015 132.358 28.331 101.808 1.00 0.00 H ATOM 37739 H2 WAT 2015 132.842 27.291 100.820 1.00 0.00 H TER 37741 WAT 2015 ATOM 37741 O WAT 2016 5.521 104.521 82.722 1.00 0.00 O ATOM 37742 H1 WAT 2016 4.926 105.127 82.280 1.00 0.00 H ATOM 37743 H2 WAT 2016 5.407 103.692 82.259 1.00 0.00 H TER 37745 WAT 2016 ATOM 37745 O WAT 2017 110.065 144.973 151.535 1.00 0.00 O ATOM 37746 H1 WAT 2017 109.752 144.954 152.439 1.00 0.00 H ATOM 37747 H2 WAT 2017 109.905 145.871 151.245 1.00 0.00 H TER 37749 WAT 2017 ATOM 37749 O WAT 2018 19.362 8.638 7.727 1.00 0.00 O ATOM 37750 H1 WAT 2018 18.692 9.042 8.277 1.00 0.00 H ATOM 37751 H2 WAT 2018 20.023 9.321 7.613 1.00 0.00 H TER 37753 WAT 2018 ATOM 37753 O WAT 2019 61.877 95.263 10.721 1.00 0.00 O ATOM 37754 H1 WAT 2019 62.266 94.575 11.261 1.00 0.00 H ATOM 37755 H2 WAT 2019 61.188 95.638 11.270 1.00 0.00 H TER 37757 WAT 2019 ATOM 37757 O WAT 2020 124.322 22.093 62.609 1.00 0.00 O ATOM 37758 H1 WAT 2020 123.501 22.336 63.037 1.00 0.00 H ATOM 37759 H2 WAT 2020 124.450 21.173 62.841 1.00 0.00 H TER 37761 WAT 2020 ATOM 37761 O WAT 2021 50.139 38.532 155.489 1.00 0.00 O ATOM 37762 H1 WAT 2021 50.798 38.246 156.122 1.00 0.00 H ATOM 37763 H2 WAT 2021 49.316 38.518 155.977 1.00 0.00 H TER 37765 WAT 2021 ATOM 37765 O WAT 2022 118.741 118.940 86.008 1.00 0.00 O ATOM 37766 H1 WAT 2022 118.785 118.460 86.835 1.00 0.00 H ATOM 37767 H2 WAT 2022 117.997 119.533 86.114 1.00 0.00 H TER 37769 WAT 2022 ATOM 37769 O WAT 2023 58.900 122.522 74.185 1.00 0.00 O ATOM 37770 H1 WAT 2023 59.400 122.213 73.430 1.00 0.00 H ATOM 37771 H2 WAT 2023 58.618 121.722 74.629 1.00 0.00 H TER 37773 WAT 2023 ATOM 37773 O WAT 2024 134.599 78.018 111.136 1.00 0.00 O ATOM 37774 H1 WAT 2024 135.402 77.590 111.435 1.00 0.00 H ATOM 37775 H2 WAT 2024 134.441 78.707 111.780 1.00 0.00 H TER 37777 WAT 2024 ATOM 37777 O WAT 2025 55.615 130.211 136.351 1.00 0.00 O ATOM 37778 H1 WAT 2025 55.301 130.998 135.905 1.00 0.00 H ATOM 37779 H2 WAT 2025 56.290 129.859 135.770 1.00 0.00 H TER 37781 WAT 2025 ATOM 37781 O WAT 2026 82.455 97.430 86.120 1.00 0.00 O ATOM 37782 H1 WAT 2026 83.248 96.952 85.877 1.00 0.00 H ATOM 37783 H2 WAT 2026 82.029 97.627 85.286 1.00 0.00 H TER 37785 WAT 2026 ATOM 37785 O WAT 2027 23.760 121.208 64.493 1.00 0.00 O ATOM 37786 H1 WAT 2027 23.604 121.073 63.559 1.00 0.00 H ATOM 37787 H2 WAT 2027 24.447 120.579 64.714 1.00 0.00 H TER 37789 WAT 2027 ATOM 37789 O WAT 2028 60.950 106.417 85.322 1.00 0.00 O ATOM 37790 H1 WAT 2028 60.334 107.012 84.894 1.00 0.00 H ATOM 37791 H2 WAT 2028 61.771 106.906 85.357 1.00 0.00 H TER 37793 WAT 2028 ATOM 37793 O WAT 2029 93.795 99.145 92.822 1.00 0.00 O ATOM 37794 H1 WAT 2029 94.235 99.270 93.663 1.00 0.00 H ATOM 37795 H2 WAT 2029 94.170 98.336 92.473 1.00 0.00 H TER 37797 WAT 2029 ATOM 37797 O WAT 2030 7.059 58.272 109.354 1.00 0.00 O ATOM 37798 H1 WAT 2030 7.145 59.123 108.925 1.00 0.00 H ATOM 37799 H2 WAT 2030 7.434 57.650 108.731 1.00 0.00 H TER 37801 WAT 2030 ATOM 37801 O WAT 2031 93.647 70.210 80.465 1.00 0.00 O ATOM 37802 H1 WAT 2031 94.113 70.562 81.223 1.00 0.00 H ATOM 37803 H2 WAT 2031 94.339 69.905 79.879 1.00 0.00 H TER 37805 WAT 2031 ATOM 37805 O WAT 2032 25.069 75.606 129.245 1.00 0.00 O ATOM 37806 H1 WAT 2032 25.721 75.972 129.844 1.00 0.00 H ATOM 37807 H2 WAT 2032 24.924 74.716 129.564 1.00 0.00 H TER 37809 WAT 2032 ATOM 37809 O WAT 2033 98.661 105.693 27.076 1.00 0.00 O ATOM 37810 H1 WAT 2033 97.901 106.180 26.758 1.00 0.00 H ATOM 37811 H2 WAT 2033 98.288 104.947 27.545 1.00 0.00 H TER 37813 WAT 2033 ATOM 37813 O WAT 2034 68.019 101.965 10.004 1.00 0.00 O ATOM 37814 H1 WAT 2034 67.376 102.232 10.661 1.00 0.00 H ATOM 37815 H2 WAT 2034 68.006 102.669 9.356 1.00 0.00 H TER 37817 WAT 2034 ATOM 37817 O WAT 2035 42.963 80.285 118.768 1.00 0.00 O ATOM 37818 H1 WAT 2035 43.483 80.078 119.544 1.00 0.00 H ATOM 37819 H2 WAT 2035 42.526 81.109 118.985 1.00 0.00 H TER 37821 WAT 2035 ATOM 37821 O WAT 2036 13.142 11.106 5.978 1.00 0.00 O ATOM 37822 H1 WAT 2036 13.473 10.951 5.094 1.00 0.00 H ATOM 37823 H2 WAT 2036 13.786 10.692 6.552 1.00 0.00 H TER 37825 WAT 2036 ATOM 37825 O WAT 2037 120.674 5.133 136.849 1.00 0.00 O ATOM 37826 H1 WAT 2037 120.158 4.776 137.571 1.00 0.00 H ATOM 37827 H2 WAT 2037 120.030 5.542 136.272 1.00 0.00 H TER 37829 WAT 2037 ATOM 37829 O WAT 2038 25.726 20.953 139.877 1.00 0.00 O ATOM 37830 H1 WAT 2038 25.232 20.620 140.626 1.00 0.00 H ATOM 37831 H2 WAT 2038 26.568 20.499 139.924 1.00 0.00 H TER 37833 WAT 2038 ATOM 37833 O WAT 2039 55.968 51.510 158.925 1.00 0.00 O ATOM 37834 H1 WAT 2039 56.668 50.875 158.775 1.00 0.00 H ATOM 37835 H2 WAT 2039 55.672 51.752 158.047 1.00 0.00 H TER 37837 WAT 2039 ATOM 37837 O WAT 2040 85.219 45.628 23.779 1.00 0.00 O ATOM 37838 H1 WAT 2040 84.315 45.317 23.831 1.00 0.00 H ATOM 37839 H2 WAT 2040 85.749 44.869 24.021 1.00 0.00 H TER 37841 WAT 2040 ATOM 37841 O WAT 2041 22.893 86.289 97.179 1.00 0.00 O ATOM 37842 H1 WAT 2041 23.803 86.305 96.884 1.00 0.00 H ATOM 37843 H2 WAT 2041 22.546 85.463 96.842 1.00 0.00 H TER 37845 WAT 2041 ATOM 37845 O WAT 2042 77.877 80.894 149.908 1.00 0.00 O ATOM 37846 H1 WAT 2042 77.996 80.271 149.191 1.00 0.00 H ATOM 37847 H2 WAT 2042 78.440 81.633 149.679 1.00 0.00 H TER 37849 WAT 2042 ATOM 37849 O WAT 2043 49.497 61.378 150.208 1.00 0.00 O ATOM 37850 H1 WAT 2043 48.787 61.498 150.839 1.00 0.00 H ATOM 37851 H2 WAT 2043 49.186 60.684 149.626 1.00 0.00 H TER 37853 WAT 2043 ATOM 37853 O WAT 2044 35.531 50.890 119.277 1.00 0.00 O ATOM 37854 H1 WAT 2044 35.750 50.237 118.613 1.00 0.00 H ATOM 37855 H2 WAT 2044 36.356 51.342 119.450 1.00 0.00 H TER 37857 WAT 2044 ATOM 37857 O WAT 2045 73.895 107.720 106.252 1.00 0.00 O ATOM 37858 H1 WAT 2045 73.689 107.049 105.600 1.00 0.00 H ATOM 37859 H2 WAT 2045 73.837 108.546 105.771 1.00 0.00 H TER 37861 WAT 2045 ATOM 37861 O WAT 2046 21.410 6.488 131.970 1.00 0.00 O ATOM 37862 H1 WAT 2046 21.183 6.841 132.830 1.00 0.00 H ATOM 37863 H2 WAT 2046 21.076 5.591 131.984 1.00 0.00 H TER 37865 WAT 2046 ATOM 37865 O WAT 2047 4.559 66.291 81.035 1.00 0.00 O ATOM 37866 H1 WAT 2047 4.072 66.801 81.682 1.00 0.00 H ATOM 37867 H2 WAT 2047 5.190 66.909 80.668 1.00 0.00 H TER 37869 WAT 2047 ATOM 37869 O WAT 2048 71.825 50.692 67.493 1.00 0.00 O ATOM 37870 H1 WAT 2048 71.254 50.024 67.112 1.00 0.00 H ATOM 37871 H2 WAT 2048 71.683 51.466 66.949 1.00 0.00 H TER 37873 WAT 2048 ATOM 37873 O WAT 2049 71.741 138.277 88.565 1.00 0.00 O ATOM 37874 H1 WAT 2049 71.734 138.900 89.292 1.00 0.00 H ATOM 37875 H2 WAT 2049 72.657 138.244 88.287 1.00 0.00 H TER 37877 WAT 2049 ATOM 37877 O WAT 2050 77.772 53.399 77.024 1.00 0.00 O ATOM 37878 H1 WAT 2050 78.646 53.054 77.206 1.00 0.00 H ATOM 37879 H2 WAT 2050 77.904 54.020 76.308 1.00 0.00 H TER 37881 WAT 2050 ATOM 37881 O WAT 2051 97.674 122.624 91.376 1.00 0.00 O ATOM 37882 H1 WAT 2051 97.953 122.315 90.514 1.00 0.00 H ATOM 37883 H2 WAT 2051 96.718 122.645 91.325 1.00 0.00 H TER 37885 WAT 2051 ATOM 37885 O WAT 2052 114.496 21.384 9.138 1.00 0.00 O ATOM 37886 H1 WAT 2052 113.860 21.761 8.530 1.00 0.00 H ATOM 37887 H2 WAT 2052 114.438 21.935 9.918 1.00 0.00 H TER 37889 WAT 2052 ATOM 37889 O WAT 2053 57.576 84.268 104.838 1.00 0.00 O ATOM 37890 H1 WAT 2053 57.815 85.128 105.184 1.00 0.00 H ATOM 37891 H2 WAT 2053 57.812 83.655 105.534 1.00 0.00 H TER 37893 WAT 2053 ATOM 37893 O WAT 2054 132.996 8.235 79.005 1.00 0.00 O ATOM 37894 H1 WAT 2054 132.103 8.564 78.909 1.00 0.00 H ATOM 37895 H2 WAT 2054 133.422 8.454 78.176 1.00 0.00 H TER 37897 WAT 2054 ATOM 37897 O WAT 2055 56.834 135.162 66.826 1.00 0.00 O ATOM 37898 H1 WAT 2055 56.202 134.547 67.197 1.00 0.00 H ATOM 37899 H2 WAT 2055 57.685 134.836 67.117 1.00 0.00 H TER 37901 WAT 2055 ATOM 37901 O WAT 2056 60.152 23.223 84.706 1.00 0.00 O ATOM 37902 H1 WAT 2056 60.284 24.166 84.804 1.00 0.00 H ATOM 37903 H2 WAT 2056 60.747 22.829 85.344 1.00 0.00 H TER 37905 WAT 2056 ATOM 37905 O WAT 2057 0.864 109.190 90.236 1.00 0.00 O ATOM 37906 H1 WAT 2057 1.768 108.883 90.172 1.00 0.00 H ATOM 37907 H2 WAT 2057 0.904 110.110 89.976 1.00 0.00 H TER 37909 WAT 2057 ATOM 37909 O WAT 2058 135.974 51.542 129.429 1.00 0.00 O ATOM 37910 H1 WAT 2058 136.275 51.207 128.585 1.00 0.00 H ATOM 37911 H2 WAT 2058 135.399 52.274 129.206 1.00 0.00 H TER 37913 WAT 2058 ATOM 37913 O WAT 2059 31.178 27.467 132.054 1.00 0.00 O ATOM 37914 H1 WAT 2059 31.183 27.654 131.116 1.00 0.00 H ATOM 37915 H2 WAT 2059 32.089 27.261 132.263 1.00 0.00 H TER 37917 WAT 2059 ATOM 37917 O WAT 2060 57.386 25.067 130.773 1.00 0.00 O ATOM 37918 H1 WAT 2060 57.574 24.790 131.670 1.00 0.00 H ATOM 37919 H2 WAT 2060 56.949 24.313 130.377 1.00 0.00 H TER 37921 WAT 2060 ATOM 37921 O WAT 2061 94.364 11.949 77.545 1.00 0.00 O ATOM 37922 H1 WAT 2061 93.409 11.928 77.600 1.00 0.00 H ATOM 37923 H2 WAT 2061 94.546 12.206 76.641 1.00 0.00 H TER 37925 WAT 2061 ATOM 37925 O WAT 2062 82.808 75.392 90.280 1.00 0.00 O ATOM 37926 H1 WAT 2062 82.101 75.857 89.832 1.00 0.00 H ATOM 37927 H2 WAT 2062 83.477 75.267 89.607 1.00 0.00 H TER 37929 WAT 2062 ATOM 37929 O WAT 2063 35.275 54.876 68.587 1.00 0.00 O ATOM 37930 H1 WAT 2063 36.160 54.525 68.687 1.00 0.00 H ATOM 37931 H2 WAT 2063 35.163 55.460 69.337 1.00 0.00 H TER 37933 WAT 2063 ATOM 37933 O WAT 2064 79.581 82.302 140.961 1.00 0.00 O ATOM 37934 H1 WAT 2064 80.013 83.014 140.489 1.00 0.00 H ATOM 37935 H2 WAT 2064 78.699 82.631 141.136 1.00 0.00 H TER 37937 WAT 2064 ATOM 37937 O WAT 2065 69.107 4.663 73.644 1.00 0.00 O ATOM 37938 H1 WAT 2065 68.770 5.439 73.197 1.00 0.00 H ATOM 37939 H2 WAT 2065 69.906 4.964 74.077 1.00 0.00 H TER 37941 WAT 2065 ATOM 37941 O WAT 2066 21.095 69.259 94.306 1.00 0.00 O ATOM 37942 H1 WAT 2066 21.917 69.721 94.144 1.00 0.00 H ATOM 37943 H2 WAT 2066 20.454 69.955 94.454 1.00 0.00 H TER 37945 WAT 2066 ATOM 37945 O WAT 2067 86.818 92.955 4.274 1.00 0.00 O ATOM 37946 H1 WAT 2067 86.654 92.785 5.202 1.00 0.00 H ATOM 37947 H2 WAT 2067 85.958 92.884 3.862 1.00 0.00 H TER 37949 WAT 2067 ATOM 37949 O WAT 2068 115.411 1.664 129.375 1.00 0.00 O ATOM 37950 H1 WAT 2068 115.987 1.370 130.080 1.00 0.00 H ATOM 37951 H2 WAT 2068 114.800 0.939 129.246 1.00 0.00 H TER 37953 WAT 2068 ATOM 37953 O WAT 2069 94.856 34.653 113.019 1.00 0.00 O ATOM 37954 H1 WAT 2069 94.984 35.041 113.884 1.00 0.00 H ATOM 37955 H2 WAT 2069 94.034 34.169 113.093 1.00 0.00 H TER 37957 WAT 2069 ATOM 37957 O WAT 2070 109.084 100.488 1.148 1.00 0.00 O ATOM 37958 H1 WAT 2070 108.661 100.253 1.974 1.00 0.00 H ATOM 37959 H2 WAT 2070 108.377 100.477 0.504 1.00 0.00 H TER 37961 WAT 2070 ATOM 37961 O WAT 2071 119.140 129.178 109.244 1.00 0.00 O ATOM 37962 H1 WAT 2071 118.316 128.826 109.582 1.00 0.00 H ATOM 37963 H2 WAT 2071 118.887 129.978 108.782 1.00 0.00 H TER 37965 WAT 2071 ATOM 37965 O WAT 2072 61.557 51.063 1.752 1.00 0.00 O ATOM 37966 H1 WAT 2072 61.767 50.553 2.534 1.00 0.00 H ATOM 37967 H2 WAT 2072 61.123 50.441 1.169 1.00 0.00 H TER 37969 WAT 2072 ATOM 37969 O WAT 2073 14.958 47.655 148.286 1.00 0.00 O ATOM 37970 H1 WAT 2073 15.436 47.777 147.466 1.00 0.00 H ATOM 37971 H2 WAT 2073 14.058 47.906 148.079 1.00 0.00 H TER 37973 WAT 2073 ATOM 37973 O WAT 2074 78.867 127.767 79.018 1.00 0.00 O ATOM 37974 H1 WAT 2074 79.338 128.474 79.458 1.00 0.00 H ATOM 37975 H2 WAT 2074 78.056 127.673 79.517 1.00 0.00 H TER 37977 WAT 2074 ATOM 37977 O WAT 2075 52.564 139.340 145.005 1.00 0.00 O ATOM 37978 H1 WAT 2075 53.138 139.963 145.450 1.00 0.00 H ATOM 37979 H2 WAT 2075 52.291 139.793 144.207 1.00 0.00 H TER 37981 WAT 2075 ATOM 37981 O WAT 2076 134.951 11.307 102.725 1.00 0.00 O ATOM 37982 H1 WAT 2076 134.300 10.633 102.919 1.00 0.00 H ATOM 37983 H2 WAT 2076 135.526 10.904 102.074 1.00 0.00 H TER 37985 WAT 2076 ATOM 37985 O WAT 2077 73.019 61.502 10.029 1.00 0.00 O ATOM 37986 H1 WAT 2077 73.797 61.204 9.557 1.00 0.00 H ATOM 37987 H2 WAT 2077 72.285 61.175 9.510 1.00 0.00 H TER 37989 WAT 2077 ATOM 37989 O WAT 2078 108.501 97.862 62.923 1.00 0.00 O ATOM 37990 H1 WAT 2078 107.895 97.404 63.506 1.00 0.00 H ATOM 37991 H2 WAT 2078 108.815 97.185 62.323 1.00 0.00 H TER 37993 WAT 2078 ATOM 37993 O WAT 2079 50.949 44.748 129.081 1.00 0.00 O ATOM 37994 H1 WAT 2079 51.285 43.859 128.966 1.00 0.00 H ATOM 37995 H2 WAT 2079 50.227 44.813 128.457 1.00 0.00 H TER 37997 WAT 2079 ATOM 37997 O WAT 2080 105.341 79.382 93.731 1.00 0.00 O ATOM 37998 H1 WAT 2080 104.836 79.572 92.940 1.00 0.00 H ATOM 37999 H2 WAT 2080 105.544 78.448 93.666 1.00 0.00 H TER 38001 WAT 2080 ATOM 38001 O WAT 2081 103.441 -0.044 152.900 1.00 0.00 O ATOM 38002 H1 WAT 2081 103.131 0.180 152.023 1.00 0.00 H ATOM 38003 H2 WAT 2081 102.824 0.390 153.490 1.00 0.00 H TER 38005 WAT 2081 ATOM 38005 O WAT 2082 124.134 110.210 137.955 1.00 0.00 O ATOM 38006 H1 WAT 2082 123.281 109.785 137.865 1.00 0.00 H ATOM 38007 H2 WAT 2082 124.326 110.551 137.082 1.00 0.00 H TER 38009 WAT 2082 ATOM 38009 O WAT 2083 140.007 20.629 97.516 1.00 0.00 O ATOM 38010 H1 WAT 2083 140.696 20.448 98.156 1.00 0.00 H ATOM 38011 H2 WAT 2083 139.938 21.583 97.502 1.00 0.00 H TER 38013 WAT 2083 ATOM 38013 O WAT 2084 49.301 110.238 62.677 1.00 0.00 O ATOM 38014 H1 WAT 2084 50.215 110.135 62.411 1.00 0.00 H ATOM 38015 H2 WAT 2084 48.817 110.291 61.853 1.00 0.00 H TER 38017 WAT 2084 ATOM 38017 O WAT 2085 19.313 65.803 96.647 1.00 0.00 O ATOM 38018 H1 WAT 2085 19.705 65.048 96.209 1.00 0.00 H ATOM 38019 H2 WAT 2085 18.564 66.036 96.099 1.00 0.00 H TER 38021 WAT 2085 ATOM 38021 O WAT 2086 10.503 33.223 130.308 1.00 0.00 O ATOM 38022 H1 WAT 2086 10.581 33.056 129.369 1.00 0.00 H ATOM 38023 H2 WAT 2086 10.675 34.160 130.400 1.00 0.00 H TER 38025 WAT 2086 ATOM 38025 O WAT 2087 75.909 30.409 12.055 1.00 0.00 O ATOM 38026 H1 WAT 2087 76.558 30.925 11.576 1.00 0.00 H ATOM 38027 H2 WAT 2087 76.240 29.511 12.015 1.00 0.00 H TER 38029 WAT 2087 ATOM 38029 O WAT 2088 122.421 19.951 110.532 1.00 0.00 O ATOM 38030 H1 WAT 2088 121.992 19.218 110.090 1.00 0.00 H ATOM 38031 H2 WAT 2088 121.779 20.660 110.497 1.00 0.00 H TER 38033 WAT 2088 ATOM 38033 O WAT 2089 52.999 124.097 156.794 1.00 0.00 O ATOM 38034 H1 WAT 2089 52.711 124.313 155.907 1.00 0.00 H ATOM 38035 H2 WAT 2089 52.197 124.116 157.318 1.00 0.00 H TER 38037 WAT 2089 ATOM 38037 O WAT 2090 142.709 97.627 30.735 1.00 0.00 O ATOM 38038 H1 WAT 2090 142.832 98.417 30.210 1.00 0.00 H ATOM 38039 H2 WAT 2090 142.240 97.025 30.157 1.00 0.00 H TER 38041 WAT 2090 ATOM 38041 O WAT 2091 24.176 63.197 91.069 1.00 0.00 O ATOM 38042 H1 WAT 2091 24.645 62.364 91.025 1.00 0.00 H ATOM 38043 H2 WAT 2091 24.029 63.340 92.004 1.00 0.00 H TER 38045 WAT 2091 ATOM 38045 O WAT 2092 81.194 99.040 152.741 1.00 0.00 O ATOM 38046 H1 WAT 2092 81.743 99.809 152.594 1.00 0.00 H ATOM 38047 H2 WAT 2092 81.798 98.373 153.068 1.00 0.00 H TER 38049 WAT 2092 ATOM 38049 O WAT 2093 82.353 27.754 82.086 1.00 0.00 O ATOM 38050 H1 WAT 2093 82.779 28.030 82.898 1.00 0.00 H ATOM 38051 H2 WAT 2093 82.365 26.798 82.123 1.00 0.00 H TER 38053 WAT 2093 ATOM 38053 O WAT 2094 89.082 138.354 12.828 1.00 0.00 O ATOM 38054 H1 WAT 2094 88.249 138.735 12.550 1.00 0.00 H ATOM 38055 H2 WAT 2094 89.614 139.106 13.089 1.00 0.00 H TER 38057 WAT 2094 ATOM 38057 O WAT 2095 103.400 33.872 4.077 1.00 0.00 O ATOM 38058 H1 WAT 2095 103.628 34.611 3.513 1.00 0.00 H ATOM 38059 H2 WAT 2095 103.179 33.166 3.469 1.00 0.00 H TER 38061 WAT 2095 ATOM 38061 O WAT 2096 132.552 111.638 125.920 1.00 0.00 O ATOM 38062 H1 WAT 2096 131.751 111.269 125.547 1.00 0.00 H ATOM 38063 H2 WAT 2096 132.386 112.581 125.956 1.00 0.00 H TER 38065 WAT 2096 ATOM 38065 O WAT 2097 87.600 14.767 77.972 1.00 0.00 O ATOM 38066 H1 WAT 2097 87.086 14.009 77.695 1.00 0.00 H ATOM 38067 H2 WAT 2097 86.953 15.462 78.098 1.00 0.00 H TER 38069 WAT 2097 ATOM 38069 O WAT 2098 63.653 22.929 133.602 1.00 0.00 O ATOM 38070 H1 WAT 2098 63.558 21.989 133.756 1.00 0.00 H ATOM 38071 H2 WAT 2098 63.894 22.997 132.678 1.00 0.00 H TER 38073 WAT 2098 ATOM 38073 O WAT 2099 70.371 135.007 63.994 1.00 0.00 O ATOM 38074 H1 WAT 2099 71.259 134.924 63.647 1.00 0.00 H ATOM 38075 H2 WAT 2099 70.201 135.949 63.994 1.00 0.00 H TER 38077 WAT 2099 ATOM 38077 O WAT 2100 96.033 121.986 81.669 1.00 0.00 O ATOM 38078 H1 WAT 2100 96.429 121.272 82.168 1.00 0.00 H ATOM 38079 H2 WAT 2100 95.755 121.580 80.848 1.00 0.00 H TER 38081 WAT 2100 ATOM 38081 O WAT 2101 135.367 84.689 93.833 1.00 0.00 O ATOM 38082 H1 WAT 2101 135.533 84.040 94.516 1.00 0.00 H ATOM 38083 H2 WAT 2101 135.668 84.270 93.026 1.00 0.00 H TER 38085 WAT 2101 ATOM 38085 O WAT 2102 60.465 126.298 123.485 1.00 0.00 O ATOM 38086 H1 WAT 2102 59.577 126.547 123.742 1.00 0.00 H ATOM 38087 H2 WAT 2102 60.347 125.526 122.932 1.00 0.00 H TER 38089 WAT 2102 ATOM 38089 O WAT 2103 110.532 79.971 147.665 1.00 0.00 O ATOM 38090 H1 WAT 2103 111.376 79.799 148.084 1.00 0.00 H ATOM 38091 H2 WAT 2103 110.715 79.919 146.727 1.00 0.00 H TER 38093 WAT 2103 ATOM 38093 O WAT 2104 84.847 12.292 157.939 1.00 0.00 O ATOM 38094 H1 WAT 2104 84.686 13.229 157.828 1.00 0.00 H ATOM 38095 H2 WAT 2104 84.256 12.029 158.646 1.00 0.00 H TER 38097 WAT 2104 ATOM 38097 O WAT 2105 40.742 46.660 22.895 1.00 0.00 O ATOM 38098 H1 WAT 2105 39.941 46.879 23.370 1.00 0.00 H ATOM 38099 H2 WAT 2105 41.111 47.506 22.642 1.00 0.00 H TER 38101 WAT 2105 ATOM 38101 O WAT 2106 37.591 108.593 17.902 1.00 0.00 O ATOM 38102 H1 WAT 2106 38.294 108.399 18.523 1.00 0.00 H ATOM 38103 H2 WAT 2106 36.939 107.910 18.056 1.00 0.00 H TER 38105 WAT 2106 ATOM 38105 O WAT 2107 68.052 49.695 64.667 1.00 0.00 O ATOM 38106 H1 WAT 2107 68.536 49.203 65.330 1.00 0.00 H ATOM 38107 H2 WAT 2107 68.729 50.133 64.152 1.00 0.00 H TER 38109 WAT 2107 ATOM 38109 O WAT 2108 139.081 58.568 81.513 1.00 0.00 O ATOM 38110 H1 WAT 2108 138.911 59.455 81.830 1.00 0.00 H ATOM 38111 H2 WAT 2108 138.807 58.584 80.596 1.00 0.00 H TER 38113 WAT 2108 ATOM 38113 O WAT 2109 82.422 144.713 125.758 1.00 0.00 O ATOM 38114 H1 WAT 2109 83.345 144.519 125.920 1.00 0.00 H ATOM 38115 H2 WAT 2109 82.279 144.456 124.847 1.00 0.00 H TER 38117 WAT 2109 ATOM 38117 O WAT 2110 115.994 82.649 106.533 1.00 0.00 O ATOM 38118 H1 WAT 2110 116.015 83.292 107.242 1.00 0.00 H ATOM 38119 H2 WAT 2110 115.072 82.602 106.280 1.00 0.00 H TER 38121 WAT 2110 ATOM 38121 O WAT 2111 77.867 15.749 139.306 1.00 0.00 O ATOM 38122 H1 WAT 2111 77.409 16.586 139.385 1.00 0.00 H ATOM 38123 H2 WAT 2111 78.097 15.688 138.379 1.00 0.00 H TER 38125 WAT 2111 ATOM 38125 O WAT 2112 20.618 125.965 145.114 1.00 0.00 O ATOM 38126 H1 WAT 2112 20.766 125.567 144.256 1.00 0.00 H ATOM 38127 H2 WAT 2112 21.102 125.407 145.723 1.00 0.00 H TER 38129 WAT 2112 ATOM 38129 O WAT 2113 7.887 135.556 154.992 1.00 0.00 O ATOM 38130 H1 WAT 2113 8.074 135.699 155.920 1.00 0.00 H ATOM 38131 H2 WAT 2113 7.455 134.702 154.964 1.00 0.00 H TER 38133 WAT 2113 ATOM 38133 O WAT 2114 18.297 49.992 128.099 1.00 0.00 O ATOM 38134 H1 WAT 2114 18.392 50.530 127.314 1.00 0.00 H ATOM 38135 H2 WAT 2114 18.988 50.300 128.686 1.00 0.00 H TER 38137 WAT 2114 ATOM 38137 O WAT 2115 120.754 136.187 78.385 1.00 0.00 O ATOM 38138 H1 WAT 2115 121.587 136.544 78.695 1.00 0.00 H ATOM 38139 H2 WAT 2115 120.775 135.267 78.648 1.00 0.00 H TER 38141 WAT 2115 ATOM 38141 O WAT 2116 129.314 88.692 73.528 1.00 0.00 O ATOM 38142 H1 WAT 2116 129.474 88.259 72.690 1.00 0.00 H ATOM 38143 H2 WAT 2116 128.725 88.100 73.995 1.00 0.00 H TER 38145 WAT 2116 ATOM 38145 O WAT 2117 26.494 66.102 81.144 1.00 0.00 O ATOM 38146 H1 WAT 2117 26.360 65.260 81.579 1.00 0.00 H ATOM 38147 H2 WAT 2117 26.437 65.900 80.210 1.00 0.00 H TER 38149 WAT 2117 ATOM 38149 O WAT 2118 56.462 85.427 148.625 1.00 0.00 O ATOM 38150 H1 WAT 2118 56.365 84.815 149.355 1.00 0.00 H ATOM 38151 H2 WAT 2118 55.568 85.699 148.420 1.00 0.00 H TER 38153 WAT 2118 ATOM 38153 O WAT 2119 29.810 44.605 150.251 1.00 0.00 O ATOM 38154 H1 WAT 2119 29.446 45.442 150.539 1.00 0.00 H ATOM 38155 H2 WAT 2119 30.605 44.841 149.774 1.00 0.00 H TER 38157 WAT 2119 ATOM 38157 O WAT 2120 104.875 114.291 131.467 1.00 0.00 O ATOM 38158 H1 WAT 2120 104.201 114.031 132.095 1.00 0.00 H ATOM 38159 H2 WAT 2120 105.240 115.099 131.827 1.00 0.00 H TER 38161 WAT 2120 ATOM 38161 O WAT 2121 45.212 12.759 16.723 1.00 0.00 O ATOM 38162 H1 WAT 2121 45.698 11.970 16.481 1.00 0.00 H ATOM 38163 H2 WAT 2121 45.354 13.361 15.993 1.00 0.00 H TER 38165 WAT 2121 ATOM 38165 O WAT 2122 122.056 50.608 69.530 1.00 0.00 O ATOM 38166 H1 WAT 2122 121.455 50.015 69.979 1.00 0.00 H ATOM 38167 H2 WAT 2122 122.522 50.051 68.907 1.00 0.00 H TER 38169 WAT 2122 ATOM 38169 O WAT 2123 32.428 39.583 63.830 1.00 0.00 O ATOM 38170 H1 WAT 2123 32.589 39.233 64.706 1.00 0.00 H ATOM 38171 H2 WAT 2123 32.815 38.937 63.239 1.00 0.00 H TER 38173 WAT 2123 ATOM 38173 O WAT 2124 64.879 81.948 134.884 1.00 0.00 O ATOM 38174 H1 WAT 2124 65.712 82.195 135.286 1.00 0.00 H ATOM 38175 H2 WAT 2124 64.708 81.064 135.210 1.00 0.00 H TER 38177 WAT 2124 ATOM 38177 O WAT 2125 13.281 22.656 142.765 1.00 0.00 O ATOM 38178 H1 WAT 2125 13.220 23.578 142.516 1.00 0.00 H ATOM 38179 H2 WAT 2125 13.272 22.666 143.722 1.00 0.00 H TER 38181 WAT 2125 ATOM 38181 O WAT 2126 120.514 125.223 25.104 1.00 0.00 O ATOM 38182 H1 WAT 2126 120.828 125.979 24.608 1.00 0.00 H ATOM 38183 H2 WAT 2126 120.844 124.465 24.622 1.00 0.00 H TER 38185 WAT 2126 ATOM 38185 O WAT 2127 114.865 56.391 115.807 1.00 0.00 O ATOM 38186 H1 WAT 2127 114.352 56.186 116.589 1.00 0.00 H ATOM 38187 H2 WAT 2127 114.938 57.346 115.812 1.00 0.00 H TER 38189 WAT 2127 ATOM 38189 O WAT 2128 72.959 111.043 15.572 1.00 0.00 O ATOM 38190 H1 WAT 2128 73.056 111.727 16.234 1.00 0.00 H ATOM 38191 H2 WAT 2128 72.343 110.420 15.958 1.00 0.00 H TER 38193 WAT 2128 ATOM 38193 O WAT 2129 122.091 142.598 157.012 1.00 0.00 O ATOM 38194 H1 WAT 2129 122.681 143.337 157.159 1.00 0.00 H ATOM 38195 H2 WAT 2129 121.641 142.809 156.194 1.00 0.00 H TER 38197 WAT 2129 ATOM 38197 O WAT 2130 32.824 88.431 75.204 1.00 0.00 O ATOM 38198 H1 WAT 2130 32.572 88.591 76.114 1.00 0.00 H ATOM 38199 H2 WAT 2130 32.001 88.473 74.717 1.00 0.00 H TER 38201 WAT 2130 ATOM 38201 O WAT 2131 32.798 47.296 83.993 1.00 0.00 O ATOM 38202 H1 WAT 2131 33.311 47.974 84.433 1.00 0.00 H ATOM 38203 H2 WAT 2131 32.963 46.502 84.501 1.00 0.00 H TER 38205 WAT 2131 ATOM 38205 O WAT 2132 75.361 35.979 83.504 1.00 0.00 O ATOM 38206 H1 WAT 2132 74.941 35.296 84.027 1.00 0.00 H ATOM 38207 H2 WAT 2132 75.676 36.613 84.148 1.00 0.00 H TER 38209 WAT 2132 ATOM 38209 O WAT 2133 66.172 5.552 104.361 1.00 0.00 O ATOM 38210 H1 WAT 2133 66.800 6.043 104.891 1.00 0.00 H ATOM 38211 H2 WAT 2133 66.141 4.686 104.768 1.00 0.00 H TER 38213 WAT 2133 ATOM 38213 O WAT 2134 74.285 5.837 9.787 1.00 0.00 O ATOM 38214 H1 WAT 2134 73.883 5.150 10.319 1.00 0.00 H ATOM 38215 H2 WAT 2134 73.607 6.079 9.157 1.00 0.00 H TER 38217 WAT 2134 ATOM 38217 O WAT 2135 30.735 103.266 139.278 1.00 0.00 O ATOM 38218 H1 WAT 2135 30.543 102.345 139.100 1.00 0.00 H ATOM 38219 H2 WAT 2135 29.979 103.576 139.777 1.00 0.00 H TER 38221 WAT 2135 ATOM 38221 O WAT 2136 134.622 94.581 138.377 1.00 0.00 O ATOM 38222 H1 WAT 2136 134.242 94.419 139.241 1.00 0.00 H ATOM 38223 H2 WAT 2136 134.961 93.729 138.101 1.00 0.00 H TER 38225 WAT 2136 ATOM 38225 O WAT 2137 76.868 95.574 85.894 1.00 0.00 O ATOM 38226 H1 WAT 2137 76.676 95.791 84.982 1.00 0.00 H ATOM 38227 H2 WAT 2137 77.169 94.665 85.865 1.00 0.00 H TER 38229 WAT 2137 ATOM 38229 O WAT 2138 106.797 17.702 86.628 1.00 0.00 O ATOM 38230 H1 WAT 2138 105.960 17.362 86.312 1.00 0.00 H ATOM 38231 H2 WAT 2138 106.895 18.546 86.186 1.00 0.00 H TER 38233 WAT 2138 ATOM 38233 O WAT 2139 33.430 86.243 90.365 1.00 0.00 O ATOM 38234 H1 WAT 2139 32.980 86.487 91.174 1.00 0.00 H ATOM 38235 H2 WAT 2139 34.350 86.168 90.616 1.00 0.00 H TER 38237 WAT 2139 ATOM 38237 O WAT 2140 94.577 112.571 18.972 1.00 0.00 O ATOM 38238 H1 WAT 2140 95.264 113.028 19.458 1.00 0.00 H ATOM 38239 H2 WAT 2140 93.764 112.828 19.408 1.00 0.00 H TER 38241 WAT 2140 ATOM 38241 O WAT 2141 133.435 20.230 90.662 1.00 0.00 O ATOM 38242 H1 WAT 2141 132.928 19.779 89.988 1.00 0.00 H ATOM 38243 H2 WAT 2141 133.056 19.928 91.488 1.00 0.00 H TER 38245 WAT 2141 ATOM 38245 O WAT 2142 87.605 135.942 93.499 1.00 0.00 O ATOM 38246 H1 WAT 2142 87.453 135.505 94.337 1.00 0.00 H ATOM 38247 H2 WAT 2142 86.892 135.638 92.937 1.00 0.00 H TER 38249 WAT 2142 ATOM 38249 O WAT 2143 120.201 118.645 -0.286 1.00 0.00 O ATOM 38250 H1 WAT 2143 119.436 118.456 0.258 1.00 0.00 H ATOM 38251 H2 WAT 2143 120.948 118.384 0.253 1.00 0.00 H TER 38253 WAT 2143 ATOM 38253 O WAT 2144 48.446 46.463 150.503 1.00 0.00 O ATOM 38254 H1 WAT 2144 49.017 45.854 150.035 1.00 0.00 H ATOM 38255 H2 WAT 2144 48.137 47.068 149.828 1.00 0.00 H TER 38257 WAT 2144 ATOM 38257 O WAT 2145 86.581 132.840 108.334 1.00 0.00 O ATOM 38258 H1 WAT 2145 86.676 133.604 107.764 1.00 0.00 H ATOM 38259 H2 WAT 2145 86.245 132.153 107.759 1.00 0.00 H TER 38261 WAT 2145 ATOM 38261 O WAT 2146 37.098 124.844 136.476 1.00 0.00 O ATOM 38262 H1 WAT 2146 36.591 124.633 137.260 1.00 0.00 H ATOM 38263 H2 WAT 2146 37.239 125.789 136.529 1.00 0.00 H TER 38265 WAT 2146 ATOM 38265 O WAT 2147 41.964 15.988 94.584 1.00 0.00 O ATOM 38266 H1 WAT 2147 41.077 16.286 94.379 1.00 0.00 H ATOM 38267 H2 WAT 2147 42.292 16.630 95.214 1.00 0.00 H TER 38269 WAT 2147 ATOM 38269 O WAT 2148 4.394 26.462 57.802 1.00 0.00 O ATOM 38270 H1 WAT 2148 4.544 25.606 58.202 1.00 0.00 H ATOM 38271 H2 WAT 2148 4.630 27.090 58.486 1.00 0.00 H TER 38273 WAT 2148 ATOM 38273 O WAT 2149 125.212 47.978 12.345 1.00 0.00 O ATOM 38274 H1 WAT 2149 125.859 47.807 11.661 1.00 0.00 H ATOM 38275 H2 WAT 2149 125.726 48.052 13.149 1.00 0.00 H TER 38277 WAT 2149 ATOM 38277 O WAT 2150 13.748 19.351 122.803 1.00 0.00 O ATOM 38278 H1 WAT 2150 14.105 19.742 123.601 1.00 0.00 H ATOM 38279 H2 WAT 2150 12.804 19.311 122.958 1.00 0.00 H TER 38281 WAT 2150 ATOM 38281 O WAT 2151 106.156 57.028 137.663 1.00 0.00 O ATOM 38282 H1 WAT 2151 105.289 56.800 137.999 1.00 0.00 H ATOM 38283 H2 WAT 2151 106.751 56.838 138.388 1.00 0.00 H TER 38285 WAT 2151 ATOM 38285 O WAT 2152 47.696 89.999 84.080 1.00 0.00 O ATOM 38286 H1 WAT 2152 47.862 89.474 84.863 1.00 0.00 H ATOM 38287 H2 WAT 2152 46.769 89.854 83.887 1.00 0.00 H TER 38289 WAT 2152 ATOM 38289 O WAT 2153 68.123 121.213 65.721 1.00 0.00 O ATOM 38290 H1 WAT 2153 67.951 120.295 65.514 1.00 0.00 H ATOM 38291 H2 WAT 2153 67.261 121.580 65.916 1.00 0.00 H TER 38293 WAT 2153 ATOM 38293 O WAT 2154 14.295 7.198 153.395 1.00 0.00 O ATOM 38294 H1 WAT 2154 14.790 7.210 152.575 1.00 0.00 H ATOM 38295 H2 WAT 2154 13.837 8.039 153.410 1.00 0.00 H TER 38297 WAT 2154 ATOM 38297 O WAT 2155 137.590 132.992 137.744 1.00 0.00 O ATOM 38298 H1 WAT 2155 138.364 133.555 137.746 1.00 0.00 H ATOM 38299 H2 WAT 2155 136.856 133.592 137.874 1.00 0.00 H TER 38301 WAT 2155 ATOM 38301 O WAT 2156 63.221 0.490 82.090 1.00 0.00 O ATOM 38302 H1 WAT 2156 62.385 0.423 82.553 1.00 0.00 H ATOM 38303 H2 WAT 2156 63.086 1.192 81.453 1.00 0.00 H TER 38305 WAT 2156 ATOM 38305 O WAT 2157 132.524 47.187 4.311 1.00 0.00 O ATOM 38306 H1 WAT 2157 133.455 47.410 4.307 1.00 0.00 H ATOM 38307 H2 WAT 2157 132.506 46.234 4.217 1.00 0.00 H TER 38309 WAT 2157 ATOM 38309 O WAT 2158 134.347 74.413 151.879 1.00 0.00 O ATOM 38310 H1 WAT 2158 135.128 73.901 152.090 1.00 0.00 H ATOM 38311 H2 WAT 2158 134.681 75.289 151.684 1.00 0.00 H TER 38313 WAT 2158 ATOM 38313 O WAT 2159 86.088 129.714 21.898 1.00 0.00 O ATOM 38314 H1 WAT 2159 86.277 130.638 21.734 1.00 0.00 H ATOM 38315 H2 WAT 2159 85.174 129.704 22.184 1.00 0.00 H TER 38317 WAT 2159 ATOM 38317 O WAT 2160 103.437 22.336 107.842 1.00 0.00 O ATOM 38318 H1 WAT 2160 102.666 22.780 107.488 1.00 0.00 H ATOM 38319 H2 WAT 2160 103.098 21.513 108.193 1.00 0.00 H TER 38321 WAT 2160 ATOM 38321 O WAT 2161 145.048 47.160 121.042 1.00 0.00 O ATOM 38322 H1 WAT 2161 144.390 47.097 120.350 1.00 0.00 H ATOM 38323 H2 WAT 2161 145.060 48.088 121.278 1.00 0.00 H TER 38325 WAT 2161 ATOM 38325 O WAT 2162 123.565 39.991 104.171 1.00 0.00 O ATOM 38326 H1 WAT 2162 124.093 40.213 103.404 1.00 0.00 H ATOM 38327 H2 WAT 2162 123.364 40.835 104.576 1.00 0.00 H TER 38329 WAT 2162 ATOM 38329 O WAT 2163 50.592 87.282 8.888 1.00 0.00 O ATOM 38330 H1 WAT 2163 51.517 87.066 9.004 1.00 0.00 H ATOM 38331 H2 WAT 2163 50.447 88.031 9.466 1.00 0.00 H TER 38333 WAT 2163 ATOM 38333 O WAT 2164 25.087 82.008 14.396 1.00 0.00 O ATOM 38334 H1 WAT 2164 24.998 82.121 15.342 1.00 0.00 H ATOM 38335 H2 WAT 2164 24.713 81.145 14.221 1.00 0.00 H TER 38337 WAT 2164 ATOM 38337 O WAT 2165 34.030 61.018 142.563 1.00 0.00 O ATOM 38338 H1 WAT 2165 33.208 61.070 142.076 1.00 0.00 H ATOM 38339 H2 WAT 2165 34.130 61.885 142.957 1.00 0.00 H TER 38341 WAT 2165 ATOM 38341 O WAT 2166 42.451 132.516 58.833 1.00 0.00 O ATOM 38342 H1 WAT 2166 42.058 132.978 58.092 1.00 0.00 H ATOM 38343 H2 WAT 2166 43.393 132.645 58.723 1.00 0.00 H TER 38345 WAT 2166 ATOM 38345 O WAT 2167 41.994 124.730 68.827 1.00 0.00 O ATOM 38346 H1 WAT 2167 41.092 124.614 68.528 1.00 0.00 H ATOM 38347 H2 WAT 2167 42.499 124.848 68.022 1.00 0.00 H TER 38349 WAT 2167 ATOM 38349 O WAT 2168 65.478 8.536 55.651 1.00 0.00 O ATOM 38350 H1 WAT 2168 64.893 9.226 55.964 1.00 0.00 H ATOM 38351 H2 WAT 2168 66.007 8.960 54.974 1.00 0.00 H TER 38353 WAT 2168 ATOM 38353 O WAT 2169 109.724 17.071 67.231 1.00 0.00 O ATOM 38354 H1 WAT 2169 109.343 17.708 66.627 1.00 0.00 H ATOM 38355 H2 WAT 2169 109.905 17.573 68.026 1.00 0.00 H TER 38357 WAT 2169 ATOM 38357 O WAT 2170 100.611 66.360 128.474 1.00 0.00 O ATOM 38358 H1 WAT 2170 100.588 67.139 127.918 1.00 0.00 H ATOM 38359 H2 WAT 2170 99.873 66.472 129.073 1.00 0.00 H TER 38361 WAT 2170 ATOM 38361 O WAT 2171 50.090 44.195 81.431 1.00 0.00 O ATOM 38362 H1 WAT 2171 50.330 45.067 81.118 1.00 0.00 H ATOM 38363 H2 WAT 2171 50.689 43.604 80.976 1.00 0.00 H TER 38365 WAT 2171 ATOM 38365 O WAT 2172 23.441 92.244 155.941 1.00 0.00 O ATOM 38366 H1 WAT 2172 23.156 93.155 156.013 1.00 0.00 H ATOM 38367 H2 WAT 2172 22.640 91.733 156.053 1.00 0.00 H TER 38369 WAT 2172 ATOM 38369 O WAT 2173 86.192 115.116 93.589 1.00 0.00 O ATOM 38370 H1 WAT 2173 85.372 114.877 94.021 1.00 0.00 H ATOM 38371 H2 WAT 2173 86.125 116.061 93.454 1.00 0.00 H TER 38373 WAT 2173 ATOM 38373 O WAT 2174 91.171 48.503 99.334 1.00 0.00 O ATOM 38374 H1 WAT 2174 91.934 49.064 99.473 1.00 0.00 H ATOM 38375 H2 WAT 2174 91.232 47.841 100.023 1.00 0.00 H TER 38377 WAT 2174 ATOM 38377 O WAT 2175 48.830 142.096 140.000 1.00 0.00 O ATOM 38378 H1 WAT 2175 48.657 141.157 140.074 1.00 0.00 H ATOM 38379 H2 WAT 2175 48.296 142.493 140.688 1.00 0.00 H TER 38381 WAT 2175 ATOM 38381 O WAT 2176 8.941 69.053 105.385 1.00 0.00 O ATOM 38382 H1 WAT 2176 8.910 68.137 105.663 1.00 0.00 H ATOM 38383 H2 WAT 2176 9.197 69.533 106.173 1.00 0.00 H TER 38385 WAT 2176 ATOM 38385 O WAT 2177 76.315 37.361 91.808 1.00 0.00 O ATOM 38386 H1 WAT 2177 75.944 36.482 91.730 1.00 0.00 H ATOM 38387 H2 WAT 2177 76.390 37.506 92.751 1.00 0.00 H TER 38389 WAT 2177 ATOM 38389 O WAT 2178 118.547 6.175 9.247 1.00 0.00 O ATOM 38390 H1 WAT 2178 118.913 6.760 8.583 1.00 0.00 H ATOM 38391 H2 WAT 2178 117.796 5.766 8.818 1.00 0.00 H TER 38393 WAT 2178 ATOM 38393 O WAT 2179 3.296 67.339 53.297 1.00 0.00 O ATOM 38394 H1 WAT 2179 3.735 66.836 53.983 1.00 0.00 H ATOM 38395 H2 WAT 2179 3.882 67.279 52.543 1.00 0.00 H TER 38397 WAT 2179 ATOM 38397 O WAT 2180 7.636 61.065 78.071 1.00 0.00 O ATOM 38398 H1 WAT 2180 7.495 61.517 77.240 1.00 0.00 H ATOM 38399 H2 WAT 2180 7.266 60.193 77.936 1.00 0.00 H TER 38401 WAT 2180 ATOM 38401 O WAT 2181 4.636 114.183 97.900 1.00 0.00 O ATOM 38402 H1 WAT 2181 3.844 114.449 98.366 1.00 0.00 H ATOM 38403 H2 WAT 2181 4.589 114.646 97.064 1.00 0.00 H TER 38405 WAT 2181 ATOM 38405 O WAT 2182 19.972 15.030 139.586 1.00 0.00 O ATOM 38406 H1 WAT 2182 20.780 15.288 139.142 1.00 0.00 H ATOM 38407 H2 WAT 2182 19.782 14.155 139.247 1.00 0.00 H TER 38409 WAT 2182 ATOM 38409 O WAT 2183 23.526 102.601 157.697 1.00 0.00 O ATOM 38410 H1 WAT 2183 23.094 103.446 157.828 1.00 0.00 H ATOM 38411 H2 WAT 2183 24.392 102.826 157.356 1.00 0.00 H TER 38413 WAT 2183 ATOM 38413 O WAT 2184 81.416 102.345 153.345 1.00 0.00 O ATOM 38414 H1 WAT 2184 81.657 102.453 154.265 1.00 0.00 H ATOM 38415 H2 WAT 2184 80.536 101.969 153.370 1.00 0.00 H TER 38417 WAT 2184 ATOM 38417 O WAT 2185 124.639 56.174 141.926 1.00 0.00 O ATOM 38418 H1 WAT 2185 124.541 55.657 142.725 1.00 0.00 H ATOM 38419 H2 WAT 2185 123.813 56.652 141.847 1.00 0.00 H TER 38421 WAT 2185 ATOM 38421 O WAT 2186 120.148 31.658 1.572 1.00 0.00 O ATOM 38422 H1 WAT 2186 120.556 31.749 2.433 1.00 0.00 H ATOM 38423 H2 WAT 2186 120.816 31.960 0.957 1.00 0.00 H TER 38425 WAT 2186 ATOM 38425 O WAT 2187 26.086 141.386 94.117 1.00 0.00 O ATOM 38426 H1 WAT 2187 26.304 140.482 94.345 1.00 0.00 H ATOM 38427 H2 WAT 2187 25.985 141.828 94.960 1.00 0.00 H TER 38429 WAT 2187 ATOM 38429 O WAT 2188 67.220 49.961 92.689 1.00 0.00 O ATOM 38430 H1 WAT 2188 67.636 49.157 92.377 1.00 0.00 H ATOM 38431 H2 WAT 2188 67.535 50.059 93.588 1.00 0.00 H TER 38433 WAT 2188 ATOM 38433 O WAT 2189 73.210 45.052 123.841 1.00 0.00 O ATOM 38434 H1 WAT 2189 73.183 45.737 124.509 1.00 0.00 H ATOM 38435 H2 WAT 2189 72.375 45.135 123.380 1.00 0.00 H TER 38437 WAT 2189 ATOM 38437 O WAT 2190 128.293 140.068 110.064 1.00 0.00 O ATOM 38438 H1 WAT 2190 127.368 140.288 109.947 1.00 0.00 H ATOM 38439 H2 WAT 2190 128.520 139.566 109.282 1.00 0.00 H TER 38441 WAT 2190 ATOM 38441 O WAT 2191 41.605 22.427 81.585 1.00 0.00 O ATOM 38442 H1 WAT 2191 42.132 22.808 80.883 1.00 0.00 H ATOM 38443 H2 WAT 2191 41.786 22.978 82.347 1.00 0.00 H TER 38445 WAT 2191 ATOM 38445 O WAT 2192 78.877 54.005 82.048 1.00 0.00 O ATOM 38446 H1 WAT 2192 79.188 54.164 82.939 1.00 0.00 H ATOM 38447 H2 WAT 2192 78.519 54.846 81.765 1.00 0.00 H TER 38449 WAT 2192 ATOM 38449 O WAT 2193 106.483 87.221 86.726 1.00 0.00 O ATOM 38450 H1 WAT 2193 105.710 87.787 86.724 1.00 0.00 H ATOM 38451 H2 WAT 2193 106.160 86.376 87.039 1.00 0.00 H TER 38453 WAT 2193 ATOM 38453 O WAT 2194 5.397 127.253 2.721 1.00 0.00 O ATOM 38454 H1 WAT 2194 5.173 128.128 2.405 1.00 0.00 H ATOM 38455 H2 WAT 2194 6.295 127.337 3.043 1.00 0.00 H TER 38457 WAT 2194 ATOM 38457 O WAT 2195 108.325 98.791 111.961 1.00 0.00 O ATOM 38458 H1 WAT 2195 108.789 99.616 112.102 1.00 0.00 H ATOM 38459 H2 WAT 2195 107.406 99.045 111.875 1.00 0.00 H TER 38461 WAT 2195 ATOM 38461 O WAT 2196 115.693 9.894 108.997 1.00 0.00 O ATOM 38462 H1 WAT 2196 115.050 10.371 109.521 1.00 0.00 H ATOM 38463 H2 WAT 2196 115.275 9.787 108.143 1.00 0.00 H TER 38465 WAT 2196 ATOM 38465 O WAT 2197 47.828 28.555 127.591 1.00 0.00 O ATOM 38466 H1 WAT 2197 47.849 28.826 128.509 1.00 0.00 H ATOM 38467 H2 WAT 2197 46.966 28.154 127.479 1.00 0.00 H TER 38469 WAT 2197 ATOM 38469 O WAT 2198 35.090 118.465 112.999 1.00 0.00 O ATOM 38470 H1 WAT 2198 35.080 119.032 112.227 1.00 0.00 H ATOM 38471 H2 WAT 2198 34.862 117.599 112.663 1.00 0.00 H TER 38473 WAT 2198 ATOM 38473 O WAT 2199 82.744 33.664 91.566 1.00 0.00 O ATOM 38474 H1 WAT 2199 83.600 34.061 91.401 1.00 0.00 H ATOM 38475 H2 WAT 2199 82.265 34.327 92.063 1.00 0.00 H TER 38477 WAT 2199 ATOM 38477 O WAT 2200 46.884 89.627 56.766 1.00 0.00 O ATOM 38478 H1 WAT 2200 46.697 88.760 57.128 1.00 0.00 H ATOM 38479 H2 WAT 2200 46.033 90.065 56.742 1.00 0.00 H TER 38481 WAT 2200 ATOM 38481 O WAT 2201 66.703 94.214 134.871 1.00 0.00 O ATOM 38482 H1 WAT 2201 67.139 93.743 134.161 1.00 0.00 H ATOM 38483 H2 WAT 2201 67.281 94.100 135.625 1.00 0.00 H TER 38485 WAT 2201 ATOM 38485 O WAT 2202 120.072 113.124 100.280 1.00 0.00 O ATOM 38486 H1 WAT 2202 119.803 112.330 100.741 1.00 0.00 H ATOM 38487 H2 WAT 2202 120.881 112.877 99.830 1.00 0.00 H TER 38489 WAT 2202 ATOM 38489 O WAT 2203 79.300 48.856 128.364 1.00 0.00 O ATOM 38490 H1 WAT 2203 79.671 48.075 128.773 1.00 0.00 H ATOM 38491 H2 WAT 2203 78.506 49.036 128.867 1.00 0.00 H TER 38493 WAT 2203 ATOM 38493 O WAT 2204 127.242 127.893 59.945 1.00 0.00 O ATOM 38494 H1 WAT 2204 126.622 128.580 60.190 1.00 0.00 H ATOM 38495 H2 WAT 2204 126.784 127.076 60.143 1.00 0.00 H TER 38497 WAT 2204 ATOM 38497 O WAT 2205 130.417 103.045 63.767 1.00 0.00 O ATOM 38498 H1 WAT 2205 130.575 102.123 63.563 1.00 0.00 H ATOM 38499 H2 WAT 2205 129.739 103.315 63.148 1.00 0.00 H TER 38501 WAT 2205 ATOM 38501 O WAT 2206 128.063 87.331 9.517 1.00 0.00 O ATOM 38502 H1 WAT 2206 128.183 88.129 10.033 1.00 0.00 H ATOM 38503 H2 WAT 2206 128.921 86.906 9.531 1.00 0.00 H TER 38505 WAT 2206 ATOM 38505 O WAT 2207 74.326 133.871 139.209 1.00 0.00 O ATOM 38506 H1 WAT 2207 75.003 133.325 138.811 1.00 0.00 H ATOM 38507 H2 WAT 2207 74.444 134.731 138.806 1.00 0.00 H TER 38509 WAT 2207 ATOM 38509 O WAT 2208 126.792 79.800 70.762 1.00 0.00 O ATOM 38510 H1 WAT 2208 127.561 79.383 71.152 1.00 0.00 H ATOM 38511 H2 WAT 2208 126.051 79.436 71.246 1.00 0.00 H TER 38513 WAT 2208 ATOM 38513 O WAT 2209 88.742 78.514 153.762 1.00 0.00 O ATOM 38514 H1 WAT 2209 89.035 77.846 154.382 1.00 0.00 H ATOM 38515 H2 WAT 2209 89.271 79.284 153.971 1.00 0.00 H TER 38517 WAT 2209 ATOM 38517 O WAT 2210 14.259 64.235 124.069 1.00 0.00 O ATOM 38518 H1 WAT 2210 14.177 65.188 124.109 1.00 0.00 H ATOM 38519 H2 WAT 2210 14.272 63.956 124.984 1.00 0.00 H TER 38521 WAT 2210 ATOM 38521 O WAT 2211 44.897 94.686 105.277 1.00 0.00 O ATOM 38522 H1 WAT 2211 44.895 94.901 104.344 1.00 0.00 H ATOM 38523 H2 WAT 2211 45.433 95.370 105.679 1.00 0.00 H TER 38525 WAT 2211 ATOM 38525 O WAT 2212 117.738 92.490 137.762 1.00 0.00 O ATOM 38526 H1 WAT 2212 118.404 93.151 137.573 1.00 0.00 H ATOM 38527 H2 WAT 2212 116.943 92.995 137.936 1.00 0.00 H TER 38529 WAT 2212 ATOM 38529 O WAT 2213 136.894 88.650 97.982 1.00 0.00 O ATOM 38530 H1 WAT 2213 136.848 89.481 98.455 1.00 0.00 H ATOM 38531 H2 WAT 2213 136.810 87.983 98.663 1.00 0.00 H TER 38533 WAT 2213 ATOM 38533 O WAT 2214 129.007 12.425 17.187 1.00 0.00 O ATOM 38534 H1 WAT 2214 129.079 13.122 17.839 1.00 0.00 H ATOM 38535 H2 WAT 2214 128.072 12.219 17.158 1.00 0.00 H TER 38537 WAT 2214 ATOM 38537 O WAT 2215 31.115 113.509 124.193 1.00 0.00 O ATOM 38538 H1 WAT 2215 31.763 114.212 124.245 1.00 0.00 H ATOM 38539 H2 WAT 2215 31.477 112.809 124.736 1.00 0.00 H TER 38541 WAT 2215 ATOM 38541 O WAT 2216 78.747 112.520 79.562 1.00 0.00 O ATOM 38542 H1 WAT 2216 79.657 112.765 79.389 1.00 0.00 H ATOM 38543 H2 WAT 2216 78.324 112.549 78.704 1.00 0.00 H TER 38545 WAT 2216 ATOM 38545 O WAT 2217 86.042 64.888 145.127 1.00 0.00 O ATOM 38546 H1 WAT 2217 86.523 65.656 145.433 1.00 0.00 H ATOM 38547 H2 WAT 2217 85.509 64.624 145.877 1.00 0.00 H TER 38549 WAT 2217 ATOM 38549 O WAT 2218 92.701 47.684 92.185 1.00 0.00 O ATOM 38550 H1 WAT 2218 91.989 47.665 91.545 1.00 0.00 H ATOM 38551 H2 WAT 2218 92.945 46.766 92.298 1.00 0.00 H TER 38553 WAT 2218 ATOM 38553 O WAT 2219 80.364 28.628 78.405 1.00 0.00 O ATOM 38554 H1 WAT 2219 80.071 28.711 77.498 1.00 0.00 H ATOM 38555 H2 WAT 2219 80.769 27.762 78.449 1.00 0.00 H TER 38557 WAT 2219 ATOM 38557 O WAT 2220 93.010 75.794 5.163 1.00 0.00 O ATOM 38558 H1 WAT 2220 92.588 75.282 5.852 1.00 0.00 H ATOM 38559 H2 WAT 2220 92.914 75.260 4.375 1.00 0.00 H TER 38561 WAT 2220 ATOM 38561 O WAT 2221 23.137 7.995 143.726 1.00 0.00 O ATOM 38562 H1 WAT 2221 22.931 8.630 143.040 1.00 0.00 H ATOM 38563 H2 WAT 2221 22.285 7.719 144.062 1.00 0.00 H TER 38565 WAT 2221 ATOM 38565 O WAT 2222 15.968 138.651 158.170 1.00 0.00 O ATOM 38566 H1 WAT 2222 16.042 138.546 157.222 1.00 0.00 H ATOM 38567 H2 WAT 2222 16.038 137.761 158.516 1.00 0.00 H TER 38569 WAT 2222 ATOM 38569 O WAT 2223 94.628 119.016 19.432 1.00 0.00 O ATOM 38570 H1 WAT 2223 94.922 118.235 19.901 1.00 0.00 H ATOM 38571 H2 WAT 2223 94.565 118.736 18.519 1.00 0.00 H TER 38573 WAT 2223 ATOM 38573 O WAT 2224 145.120 102.260 93.159 1.00 0.00 O ATOM 38574 H1 WAT 2224 145.897 101.736 93.355 1.00 0.00 H ATOM 38575 H2 WAT 2224 145.122 102.949 93.823 1.00 0.00 H TER 38577 WAT 2224 ATOM 38577 O WAT 2225 5.887 95.468 27.388 1.00 0.00 O ATOM 38578 H1 WAT 2225 5.879 96.290 26.897 1.00 0.00 H ATOM 38579 H2 WAT 2225 4.995 95.131 27.304 1.00 0.00 H TER 38581 WAT 2225 ATOM 38581 O WAT 2226 56.698 22.419 134.979 1.00 0.00 O ATOM 38582 H1 WAT 2226 56.993 23.126 134.404 1.00 0.00 H ATOM 38583 H2 WAT 2226 56.196 21.839 134.407 1.00 0.00 H TER 38585 WAT 2226 ATOM 38585 O WAT 2227 8.615 94.596 104.687 1.00 0.00 O ATOM 38586 H1 WAT 2227 9.213 94.516 103.944 1.00 0.00 H ATOM 38587 H2 WAT 2227 9.031 95.240 105.261 1.00 0.00 H TER 38589 WAT 2227 ATOM 38589 O WAT 2228 116.613 23.267 15.572 1.00 0.00 O ATOM 38590 H1 WAT 2228 116.311 23.666 14.756 1.00 0.00 H ATOM 38591 H2 WAT 2228 117.567 23.316 15.524 1.00 0.00 H TER 38593 WAT 2228 ATOM 38593 O WAT 2229 25.755 5.941 118.932 1.00 0.00 O ATOM 38594 H1 WAT 2229 25.772 4.984 118.949 1.00 0.00 H ATOM 38595 H2 WAT 2229 25.612 6.161 118.011 1.00 0.00 H TER 38597 WAT 2229 ATOM 38597 O WAT 2230 143.676 69.222 53.582 1.00 0.00 O ATOM 38598 H1 WAT 2230 144.421 68.628 53.667 1.00 0.00 H ATOM 38599 H2 WAT 2230 143.875 69.943 54.180 1.00 0.00 H TER 38601 WAT 2230 ATOM 38601 O WAT 2231 7.496 100.288 107.364 1.00 0.00 O ATOM 38602 H1 WAT 2231 7.773 100.701 106.547 1.00 0.00 H ATOM 38603 H2 WAT 2231 6.883 100.912 107.752 1.00 0.00 H TER 38605 WAT 2231 ATOM 38605 O WAT 2232 22.020 80.235 151.425 1.00 0.00 O ATOM 38606 H1 WAT 2232 21.350 80.735 150.959 1.00 0.00 H ATOM 38607 H2 WAT 2232 21.572 79.438 151.708 1.00 0.00 H TER 38609 WAT 2232 ATOM 38609 O WAT 2233 52.792 44.108 4.361 1.00 0.00 O ATOM 38610 H1 WAT 2233 52.321 43.347 4.022 1.00 0.00 H ATOM 38611 H2 WAT 2233 53.313 44.417 3.620 1.00 0.00 H TER 38613 WAT 2233 ATOM 38613 O WAT 2234 102.579 36.055 109.585 1.00 0.00 O ATOM 38614 H1 WAT 2234 102.753 35.277 110.115 1.00 0.00 H ATOM 38615 H2 WAT 2234 101.681 36.300 109.806 1.00 0.00 H TER 38617 WAT 2234 ATOM 38617 O WAT 2235 106.005 29.870 87.660 1.00 0.00 O ATOM 38618 H1 WAT 2235 105.913 30.738 87.268 1.00 0.00 H ATOM 38619 H2 WAT 2235 106.480 30.024 88.477 1.00 0.00 H TER 38621 WAT 2235 ATOM 38621 O WAT 2236 113.344 31.212 154.636 1.00 0.00 O ATOM 38622 H1 WAT 2236 113.784 30.393 154.408 1.00 0.00 H ATOM 38623 H2 WAT 2236 112.739 31.369 153.911 1.00 0.00 H TER 38625 WAT 2236 ATOM 38625 O WAT 2237 59.279 2.790 73.954 1.00 0.00 O ATOM 38626 H1 WAT 2237 60.065 2.316 74.226 1.00 0.00 H ATOM 38627 H2 WAT 2237 59.040 2.396 73.115 1.00 0.00 H TER 38629 WAT 2237 ATOM 38629 O WAT 2238 49.748 39.032 104.395 1.00 0.00 O ATOM 38630 H1 WAT 2238 50.037 39.906 104.659 1.00 0.00 H ATOM 38631 H2 WAT 2238 50.540 38.496 104.432 1.00 0.00 H TER 38633 WAT 2238 ATOM 38633 O WAT 2239 96.832 75.170 108.699 1.00 0.00 O ATOM 38634 H1 WAT 2239 96.268 75.562 109.365 1.00 0.00 H ATOM 38635 H2 WAT 2239 97.364 75.897 108.377 1.00 0.00 H TER 38637 WAT 2239 ATOM 38637 O WAT 2240 34.104 51.288 126.699 1.00 0.00 O ATOM 38638 H1 WAT 2240 34.225 50.855 127.544 1.00 0.00 H ATOM 38639 H2 WAT 2240 33.823 52.175 126.923 1.00 0.00 H TER 38641 WAT 2240 ATOM 38641 O WAT 2241 136.591 14.751 122.073 1.00 0.00 O ATOM 38642 H1 WAT 2241 137.188 14.886 122.810 1.00 0.00 H ATOM 38643 H2 WAT 2241 136.095 15.567 122.014 1.00 0.00 H TER 38645 WAT 2241 ATOM 38645 O WAT 2242 38.402 107.885 129.743 1.00 0.00 O ATOM 38646 H1 WAT 2242 38.062 108.779 129.774 1.00 0.00 H ATOM 38647 H2 WAT 2242 37.995 107.448 130.491 1.00 0.00 H TER 38649 WAT 2242 ATOM 38649 O WAT 2243 100.383 121.612 116.364 1.00 0.00 O ATOM 38650 H1 WAT 2243 100.594 121.443 117.282 1.00 0.00 H ATOM 38651 H2 WAT 2243 99.990 120.797 116.054 1.00 0.00 H TER 38653 WAT 2243 ATOM 38653 O WAT 2244 5.042 104.860 75.334 1.00 0.00 O ATOM 38654 H1 WAT 2244 4.691 103.970 75.359 1.00 0.00 H ATOM 38655 H2 WAT 2244 4.800 105.189 74.468 1.00 0.00 H TER 38657 WAT 2244 ATOM 38657 O WAT 2245 50.511 67.379 135.422 1.00 0.00 O ATOM 38658 H1 WAT 2245 50.312 67.763 136.276 1.00 0.00 H ATOM 38659 H2 WAT 2245 50.291 66.453 135.519 1.00 0.00 H TER 38661 WAT 2245 ATOM 38661 O WAT 2246 145.065 144.989 23.639 1.00 0.00 O ATOM 38662 H1 WAT 2246 144.721 145.317 22.808 1.00 0.00 H ATOM 38663 H2 WAT 2246 145.379 145.771 24.093 1.00 0.00 H TER 38665 WAT 2246 ATOM 38665 O WAT 2247 86.926 73.579 129.251 1.00 0.00 O ATOM 38666 H1 WAT 2247 87.857 73.365 129.309 1.00 0.00 H ATOM 38667 H2 WAT 2247 86.528 72.806 128.851 1.00 0.00 H TER 38669 WAT 2247 ATOM 38669 O WAT 2248 70.817 36.824 92.736 1.00 0.00 O ATOM 38670 H1 WAT 2248 70.737 37.771 92.854 1.00 0.00 H ATOM 38671 H2 WAT 2248 69.914 36.515 92.668 1.00 0.00 H TER 38673 WAT 2248 ATOM 38673 O WAT 2249 108.844 63.900 87.392 1.00 0.00 O ATOM 38674 H1 WAT 2249 108.525 64.701 87.809 1.00 0.00 H ATOM 38675 H2 WAT 2249 108.195 63.235 87.621 1.00 0.00 H TER 38677 WAT 2249 ATOM 38677 O WAT 2250 109.282 124.598 117.227 1.00 0.00 O ATOM 38678 H1 WAT 2250 109.675 123.995 117.858 1.00 0.00 H ATOM 38679 H2 WAT 2250 108.707 125.153 117.753 1.00 0.00 H TER 38681 WAT 2250 ATOM 38681 O WAT 2251 83.399 30.448 61.955 1.00 0.00 O ATOM 38682 H1 WAT 2251 83.450 29.539 61.660 1.00 0.00 H ATOM 38683 H2 WAT 2251 83.061 30.927 61.197 1.00 0.00 H TER 38685 WAT 2251 ATOM 38685 O WAT 2252 35.882 10.729 138.866 1.00 0.00 O ATOM 38686 H1 WAT 2252 36.368 10.004 139.258 1.00 0.00 H ATOM 38687 H2 WAT 2252 35.062 10.335 138.567 1.00 0.00 H TER 38689 WAT 2252 ATOM 38689 O WAT 2253 61.007 132.039 86.286 1.00 0.00 O ATOM 38690 H1 WAT 2253 60.362 132.726 86.118 1.00 0.00 H ATOM 38691 H2 WAT 2253 60.700 131.611 87.085 1.00 0.00 H TER 38693 WAT 2253 ATOM 38693 O WAT 2254 80.353 89.564 29.131 1.00 0.00 O ATOM 38694 H1 WAT 2254 81.078 89.035 29.465 1.00 0.00 H ATOM 38695 H2 WAT 2254 79.566 89.111 29.436 1.00 0.00 H TER 38697 WAT 2254 ATOM 38697 O WAT 2255 36.181 56.837 157.486 1.00 0.00 O ATOM 38698 H1 WAT 2255 37.130 56.820 157.606 1.00 0.00 H ATOM 38699 H2 WAT 2255 35.834 57.053 158.352 1.00 0.00 H TER 38701 WAT 2255 ATOM 38701 O WAT 2256 51.931 23.225 130.632 1.00 0.00 O ATOM 38702 H1 WAT 2256 51.296 23.483 129.964 1.00 0.00 H ATOM 38703 H2 WAT 2256 51.481 22.552 131.143 1.00 0.00 H TER 38705 WAT 2256 ATOM 38705 O WAT 2257 15.607 132.984 66.598 1.00 0.00 O ATOM 38706 H1 WAT 2257 15.239 132.615 65.795 1.00 0.00 H ATOM 38707 H2 WAT 2257 15.401 133.918 66.547 1.00 0.00 H TER 38709 WAT 2257 ATOM 38709 O WAT 2258 72.800 112.857 101.006 1.00 0.00 O ATOM 38710 H1 WAT 2258 71.934 112.720 101.391 1.00 0.00 H ATOM 38711 H2 WAT 2258 73.404 112.444 101.623 1.00 0.00 H TER 38713 WAT 2258 ATOM 38713 O WAT 2259 145.868 52.745 57.542 1.00 0.00 O ATOM 38714 H1 WAT 2259 145.918 52.994 56.619 1.00 0.00 H ATOM 38715 H2 WAT 2259 145.264 52.002 57.557 1.00 0.00 H TER 38717 WAT 2259 ATOM 38717 O WAT 2260 68.767 61.780 155.102 1.00 0.00 O ATOM 38718 H1 WAT 2260 69.295 62.551 155.312 1.00 0.00 H ATOM 38719 H2 WAT 2260 68.143 62.089 154.446 1.00 0.00 H TER 38721 WAT 2260 ATOM 38721 O WAT 2261 24.385 58.024 12.830 1.00 0.00 O ATOM 38722 H1 WAT 2261 24.773 58.764 13.298 1.00 0.00 H ATOM 38723 H2 WAT 2261 24.345 57.323 13.481 1.00 0.00 H TER 38725 WAT 2261 ATOM 38725 O WAT 2262 103.062 56.564 75.439 1.00 0.00 O ATOM 38726 H1 WAT 2262 102.643 56.835 74.622 1.00 0.00 H ATOM 38727 H2 WAT 2262 103.665 57.279 75.646 1.00 0.00 H TER 38729 WAT 2262 ATOM 38729 O WAT 2263 36.561 138.866 130.018 1.00 0.00 O ATOM 38730 H1 WAT 2263 36.676 139.758 129.691 1.00 0.00 H ATOM 38731 H2 WAT 2263 35.977 138.960 130.771 1.00 0.00 H TER 38733 WAT 2263 ATOM 38733 O WAT 2264 137.479 134.280 98.812 1.00 0.00 O ATOM 38734 H1 WAT 2264 136.569 134.267 98.514 1.00 0.00 H ATOM 38735 H2 WAT 2264 137.759 133.366 98.765 1.00 0.00 H TER 38737 WAT 2264 ATOM 38737 O WAT 2265 90.850 116.418 107.513 1.00 0.00 O ATOM 38738 H1 WAT 2265 91.175 115.969 106.732 1.00 0.00 H ATOM 38739 H2 WAT 2265 90.019 115.985 107.710 1.00 0.00 H TER 38741 WAT 2265 ATOM 38741 O WAT 2266 36.980 112.797 68.230 1.00 0.00 O ATOM 38742 H1 WAT 2266 36.933 113.440 68.937 1.00 0.00 H ATOM 38743 H2 WAT 2266 37.422 112.043 68.621 1.00 0.00 H TER 38745 WAT 2266 ATOM 38745 O WAT 2267 23.738 102.178 129.945 1.00 0.00 O ATOM 38746 H1 WAT 2267 23.418 103.049 129.711 1.00 0.00 H ATOM 38747 H2 WAT 2267 24.685 102.226 129.815 1.00 0.00 H TER 38749 WAT 2267 ATOM 38749 O WAT 2268 63.131 13.025 148.217 1.00 0.00 O ATOM 38750 H1 WAT 2268 62.276 12.772 147.870 1.00 0.00 H ATOM 38751 H2 WAT 2268 63.431 13.722 147.633 1.00 0.00 H TER 38753 WAT 2268 ATOM 38753 O WAT 2269 133.107 101.830 8.657 1.00 0.00 O ATOM 38754 H1 WAT 2269 133.244 101.955 9.596 1.00 0.00 H ATOM 38755 H2 WAT 2269 132.293 102.298 8.469 1.00 0.00 H TER 38757 WAT 2269 ATOM 38757 O WAT 2270 14.284 82.148 71.503 1.00 0.00 O ATOM 38758 H1 WAT 2270 14.591 82.558 72.311 1.00 0.00 H ATOM 38759 H2 WAT 2270 14.198 82.873 70.884 1.00 0.00 H TER 38761 WAT 2270 ATOM 38761 O WAT 2271 20.275 53.530 149.342 1.00 0.00 O ATOM 38762 H1 WAT 2271 20.350 54.463 149.539 1.00 0.00 H ATOM 38763 H2 WAT 2271 20.999 53.125 149.820 1.00 0.00 H TER 38765 WAT 2271 ATOM 38765 O WAT 2272 47.885 9.656 138.567 1.00 0.00 O ATOM 38766 H1 WAT 2272 48.321 9.204 137.845 1.00 0.00 H ATOM 38767 H2 WAT 2272 48.067 9.114 139.334 1.00 0.00 H TER 38769 WAT 2272 ATOM 38769 O WAT 2273 96.739 47.509 155.994 1.00 0.00 O ATOM 38770 H1 WAT 2273 96.783 48.021 155.186 1.00 0.00 H ATOM 38771 H2 WAT 2273 96.357 46.673 155.726 1.00 0.00 H TER 38773 WAT 2273 ATOM 38773 O WAT 2274 69.460 60.793 141.941 1.00 0.00 O ATOM 38774 H1 WAT 2274 68.517 60.724 142.088 1.00 0.00 H ATOM 38775 H2 WAT 2274 69.767 59.887 141.923 1.00 0.00 H TER 38777 WAT 2274 ATOM 38777 O WAT 2275 38.958 80.576 6.736 1.00 0.00 O ATOM 38778 H1 WAT 2275 38.093 80.471 7.132 1.00 0.00 H ATOM 38779 H2 WAT 2275 38.837 80.308 5.825 1.00 0.00 H TER 38781 WAT 2275 ATOM 38781 O WAT 2276 67.469 118.725 71.027 1.00 0.00 O ATOM 38782 H1 WAT 2276 68.421 118.829 71.020 1.00 0.00 H ATOM 38783 H2 WAT 2276 67.305 117.989 70.437 1.00 0.00 H TER 38785 WAT 2276 ATOM 38785 O WAT 2277 32.836 82.454 78.774 1.00 0.00 O ATOM 38786 H1 WAT 2277 31.880 82.410 78.795 1.00 0.00 H ATOM 38787 H2 WAT 2277 33.122 81.631 79.169 1.00 0.00 H TER 38789 WAT 2277 ATOM 38789 O WAT 2278 74.955 87.219 1.184 1.00 0.00 O ATOM 38790 H1 WAT 2278 74.617 86.898 2.020 1.00 0.00 H ATOM 38791 H2 WAT 2278 74.367 86.844 0.528 1.00 0.00 H TER 38793 WAT 2278 ATOM 38793 O WAT 2279 37.272 141.139 3.191 1.00 0.00 O ATOM 38794 H1 WAT 2279 38.039 141.080 2.622 1.00 0.00 H ATOM 38795 H2 WAT 2279 36.527 141.018 2.603 1.00 0.00 H TER 38797 WAT 2279 ATOM 38797 O WAT 2280 133.926 22.237 72.263 1.00 0.00 O ATOM 38798 H1 WAT 2280 133.367 22.156 73.035 1.00 0.00 H ATOM 38799 H2 WAT 2280 134.502 21.473 72.303 1.00 0.00 H TER 38801 WAT 2280 ATOM 38801 O WAT 2281 107.729 87.799 137.388 1.00 0.00 O ATOM 38802 H1 WAT 2281 108.109 88.556 136.942 1.00 0.00 H ATOM 38803 H2 WAT 2281 107.891 87.066 136.794 1.00 0.00 H TER 38805 WAT 2281 ATOM 38805 O WAT 2282 56.979 40.059 22.885 1.00 0.00 O ATOM 38806 H1 WAT 2282 56.408 39.634 22.245 1.00 0.00 H ATOM 38807 H2 WAT 2282 56.853 40.996 22.734 1.00 0.00 H TER 38809 WAT 2282 ATOM 38809 O WAT 2283 115.280 132.178 71.202 1.00 0.00 O ATOM 38810 H1 WAT 2283 116.149 131.893 71.485 1.00 0.00 H ATOM 38811 H2 WAT 2283 114.955 131.457 70.662 1.00 0.00 H TER 38813 WAT 2283 ATOM 38813 O WAT 2284 131.040 82.752 96.149 1.00 0.00 O ATOM 38814 H1 WAT 2284 131.628 82.149 96.605 1.00 0.00 H ATOM 38815 H2 WAT 2284 131.531 83.025 95.374 1.00 0.00 H TER 38817 WAT 2284 ATOM 38817 O WAT 2285 24.220 106.188 20.783 1.00 0.00 O ATOM 38818 H1 WAT 2285 23.521 106.468 20.192 1.00 0.00 H ATOM 38819 H2 WAT 2285 24.226 105.234 20.711 1.00 0.00 H TER 38821 WAT 2285 ATOM 38821 O WAT 2286 101.868 102.520 69.195 1.00 0.00 O ATOM 38822 H1 WAT 2286 102.352 102.778 69.980 1.00 0.00 H ATOM 38823 H2 WAT 2286 102.508 102.584 68.487 1.00 0.00 H TER 38825 WAT 2286 ATOM 38825 O WAT 2287 145.290 133.014 108.281 1.00 0.00 O ATOM 38826 H1 WAT 2287 145.632 132.145 108.073 1.00 0.00 H ATOM 38827 H2 WAT 2287 144.717 133.228 107.545 1.00 0.00 H TER 38829 WAT 2287 ATOM 38829 O WAT 2288 141.277 2.170 138.187 1.00 0.00 O ATOM 38830 H1 WAT 2288 142.089 2.264 138.684 1.00 0.00 H ATOM 38831 H2 WAT 2288 141.273 1.256 137.903 1.00 0.00 H TER 38833 WAT 2288 ATOM 38833 O WAT 2289 13.550 50.228 113.910 1.00 0.00 O ATOM 38834 H1 WAT 2289 13.679 50.546 113.017 1.00 0.00 H ATOM 38835 H2 WAT 2289 13.947 50.900 114.464 1.00 0.00 H TER 38837 WAT 2289 ATOM 38837 O WAT 2290 46.349 5.848 114.149 1.00 0.00 O ATOM 38838 H1 WAT 2290 46.809 5.101 113.764 1.00 0.00 H ATOM 38839 H2 WAT 2290 46.185 6.434 113.410 1.00 0.00 H TER 38841 WAT 2290 ATOM 38841 O WAT 2291 41.995 55.321 51.424 1.00 0.00 O ATOM 38842 H1 WAT 2291 41.202 55.235 51.953 1.00 0.00 H ATOM 38843 H2 WAT 2291 41.742 55.897 50.704 1.00 0.00 H TER 38845 WAT 2291 ATOM 38845 O WAT 2292 56.748 32.482 58.784 1.00 0.00 O ATOM 38846 H1 WAT 2292 56.112 33.168 58.580 1.00 0.00 H ATOM 38847 H2 WAT 2292 57.570 32.798 58.412 1.00 0.00 H TER 38849 WAT 2292 ATOM 38849 O WAT 2293 10.705 84.712 66.563 1.00 0.00 O ATOM 38850 H1 WAT 2293 11.465 85.181 66.218 1.00 0.00 H ATOM 38851 H2 WAT 2293 10.654 83.916 66.035 1.00 0.00 H TER 38853 WAT 2293 ATOM 38853 O WAT 2294 106.339 0.985 134.778 1.00 0.00 O ATOM 38854 H1 WAT 2294 105.916 1.525 134.110 1.00 0.00 H ATOM 38855 H2 WAT 2294 106.528 1.594 135.492 1.00 0.00 H TER 38857 WAT 2294 ATOM 38857 O WAT 2295 25.714 133.583 130.603 1.00 0.00 O ATOM 38858 H1 WAT 2295 25.189 133.093 129.971 1.00 0.00 H ATOM 38859 H2 WAT 2295 25.430 133.256 131.456 1.00 0.00 H TER 38861 WAT 2295 ATOM 38861 O WAT 2296 15.992 53.674 122.509 1.00 0.00 O ATOM 38862 H1 WAT 2296 15.114 53.294 122.527 1.00 0.00 H ATOM 38863 H2 WAT 2296 16.014 54.263 123.263 1.00 0.00 H TER 38865 WAT 2296 ATOM 38865 O WAT 2297 137.169 6.649 5.357 1.00 0.00 O ATOM 38866 H1 WAT 2297 137.753 7.272 4.925 1.00 0.00 H ATOM 38867 H2 WAT 2297 137.307 6.800 6.292 1.00 0.00 H TER 38869 WAT 2297 ATOM 38869 O WAT 2298 66.864 40.707 106.323 1.00 0.00 O ATOM 38870 H1 WAT 2298 66.403 39.962 105.936 1.00 0.00 H ATOM 38871 H2 WAT 2298 66.607 41.454 105.782 1.00 0.00 H TER 38873 WAT 2298 ATOM 38873 O WAT 2299 107.008 129.694 129.681 1.00 0.00 O ATOM 38874 H1 WAT 2299 106.090 129.929 129.817 1.00 0.00 H ATOM 38875 H2 WAT 2299 107.222 129.127 130.422 1.00 0.00 H TER 38877 WAT 2299 ATOM 38877 O WAT 2300 127.726 32.512 136.894 1.00 0.00 O ATOM 38878 H1 WAT 2300 128.151 32.107 137.651 1.00 0.00 H ATOM 38879 H2 WAT 2300 126.829 32.678 137.183 1.00 0.00 H TER 38881 WAT 2300 ATOM 38881 O WAT 2301 43.696 97.280 146.650 1.00 0.00 O ATOM 38882 H1 WAT 2301 43.987 97.295 145.738 1.00 0.00 H ATOM 38883 H2 WAT 2301 44.478 97.042 147.147 1.00 0.00 H TER 38885 WAT 2301 ATOM 38885 O WAT 2302 57.886 18.588 72.865 1.00 0.00 O ATOM 38886 H1 WAT 2302 57.643 17.830 72.334 1.00 0.00 H ATOM 38887 H2 WAT 2302 58.032 18.231 73.741 1.00 0.00 H TER 38889 WAT 2302 ATOM 38889 O WAT 2303 56.679 13.019 86.806 1.00 0.00 O ATOM 38890 H1 WAT 2303 56.540 13.868 86.386 1.00 0.00 H ATOM 38891 H2 WAT 2303 57.619 12.861 86.721 1.00 0.00 H TER 38893 WAT 2303 ATOM 38893 O WAT 2304 5.810 52.813 60.576 1.00 0.00 O ATOM 38894 H1 WAT 2304 6.736 52.813 60.819 1.00 0.00 H ATOM 38895 H2 WAT 2304 5.483 53.660 60.878 1.00 0.00 H TER 38897 WAT 2304 ATOM 38897 O WAT 2305 111.426 120.416 149.081 1.00 0.00 O ATOM 38898 H1 WAT 2305 111.227 120.040 148.224 1.00 0.00 H ATOM 38899 H2 WAT 2305 111.277 121.355 148.972 1.00 0.00 H TER 38901 WAT 2305 ATOM 38901 O WAT 2306 145.955 112.863 111.084 1.00 0.00 O ATOM 38902 H1 WAT 2306 145.253 112.941 111.730 1.00 0.00 H ATOM 38903 H2 WAT 2306 146.297 111.978 111.209 1.00 0.00 H TER 38905 WAT 2306 ATOM 38905 O WAT 2307 65.090 68.037 11.453 1.00 0.00 O ATOM 38906 H1 WAT 2307 65.953 68.079 11.865 1.00 0.00 H ATOM 38907 H2 WAT 2307 65.185 67.377 10.766 1.00 0.00 H TER 38909 WAT 2307 ATOM 38909 O WAT 2308 71.477 138.105 3.601 1.00 0.00 O ATOM 38910 H1 WAT 2308 71.984 138.112 2.789 1.00 0.00 H ATOM 38911 H2 WAT 2308 71.030 138.952 3.612 1.00 0.00 H TER 38913 WAT 2308 ATOM 38913 O WAT 2309 19.294 121.125 107.730 1.00 0.00 O ATOM 38914 H1 WAT 2309 19.476 120.247 107.396 1.00 0.00 H ATOM 38915 H2 WAT 2309 19.327 121.688 106.957 1.00 0.00 H TER 38917 WAT 2309 ATOM 38917 O WAT 2310 118.381 144.571 101.449 1.00 0.00 O ATOM 38918 H1 WAT 2310 119.238 144.426 101.850 1.00 0.00 H ATOM 38919 H2 WAT 2310 117.961 143.711 101.463 1.00 0.00 H TER 38921 WAT 2310 ATOM 38921 O WAT 2311 2.131 130.902 124.769 1.00 0.00 O ATOM 38922 H1 WAT 2311 2.006 130.077 124.300 1.00 0.00 H ATOM 38923 H2 WAT 2311 2.771 131.381 124.244 1.00 0.00 H TER 38925 WAT 2311 ATOM 38925 O WAT 2312 21.887 0.281 140.429 1.00 0.00 O ATOM 38926 H1 WAT 2312 21.077 0.413 140.921 1.00 0.00 H ATOM 38927 H2 WAT 2312 22.176 1.165 140.203 1.00 0.00 H TER 38929 WAT 2312 ATOM 38929 O WAT 2313 142.258 142.480 153.624 1.00 0.00 O ATOM 38930 H1 WAT 2313 141.912 143.263 153.196 1.00 0.00 H ATOM 38931 H2 WAT 2313 142.702 142.810 154.405 1.00 0.00 H TER 38933 WAT 2313 ATOM 38933 O WAT 2314 60.052 118.891 99.068 1.00 0.00 O ATOM 38934 H1 WAT 2314 60.811 119.209 98.579 1.00 0.00 H ATOM 38935 H2 WAT 2314 59.929 117.992 98.762 1.00 0.00 H TER 38937 WAT 2314 ATOM 38937 O WAT 2315 73.765 32.683 23.260 1.00 0.00 O ATOM 38938 H1 WAT 2315 74.342 33.400 23.523 1.00 0.00 H ATOM 38939 H2 WAT 2315 73.155 33.082 22.639 1.00 0.00 H TER 38941 WAT 2315 ATOM 38941 O WAT 2316 76.701 125.769 94.528 1.00 0.00 O ATOM 38942 H1 WAT 2316 75.830 126.165 94.545 1.00 0.00 H ATOM 38943 H2 WAT 2316 76.624 124.995 95.086 1.00 0.00 H TER 38945 WAT 2316 ATOM 38945 O WAT 2317 53.274 62.414 25.942 1.00 0.00 O ATOM 38946 H1 WAT 2317 53.915 63.033 25.592 1.00 0.00 H ATOM 38947 H2 WAT 2317 53.801 61.741 26.371 1.00 0.00 H TER 38949 WAT 2317 ATOM 38949 O WAT 2318 63.353 27.627 64.733 1.00 0.00 O ATOM 38950 H1 WAT 2318 62.847 28.054 64.041 1.00 0.00 H ATOM 38951 H2 WAT 2318 63.843 26.940 64.281 1.00 0.00 H TER 38953 WAT 2318 ATOM 38953 O WAT 2319 114.123 43.756 53.823 1.00 0.00 O ATOM 38954 H1 WAT 2319 113.792 44.650 53.911 1.00 0.00 H ATOM 38955 H2 WAT 2319 114.498 43.554 54.681 1.00 0.00 H TER 38957 WAT 2319 ATOM 38957 O WAT 2320 104.714 130.616 85.758 1.00 0.00 O ATOM 38958 H1 WAT 2320 104.544 131.285 86.421 1.00 0.00 H ATOM 38959 H2 WAT 2320 103.852 130.419 85.390 1.00 0.00 H TER 38961 WAT 2320 ATOM 38961 O WAT 2321 8.886 71.334 136.570 1.00 0.00 O ATOM 38962 H1 WAT 2321 8.988 71.085 135.651 1.00 0.00 H ATOM 38963 H2 WAT 2321 9.732 71.713 136.810 1.00 0.00 H TER 38965 WAT 2321 ATOM 38965 O WAT 2322 22.513 4.009 4.871 1.00 0.00 O ATOM 38966 H1 WAT 2322 22.804 4.411 5.689 1.00 0.00 H ATOM 38967 H2 WAT 2322 22.559 3.067 5.038 1.00 0.00 H TER 38969 WAT 2322 ATOM 38969 O WAT 2323 43.975 110.943 78.425 1.00 0.00 O ATOM 38970 H1 WAT 2323 43.055 110.797 78.203 1.00 0.00 H ATOM 38971 H2 WAT 2323 44.066 111.895 78.454 1.00 0.00 H TER 38973 WAT 2323 ATOM 38973 O WAT 2324 72.776 77.328 101.821 1.00 0.00 O ATOM 38974 H1 WAT 2324 72.414 77.784 101.062 1.00 0.00 H ATOM 38975 H2 WAT 2324 72.131 77.466 102.515 1.00 0.00 H TER 38977 WAT 2324 ATOM 38977 O WAT 2325 3.495 58.208 93.654 1.00 0.00 O ATOM 38978 H1 WAT 2325 3.367 58.744 94.437 1.00 0.00 H ATOM 38979 H2 WAT 2325 3.820 57.371 93.987 1.00 0.00 H TER 38981 WAT 2325 ATOM 38981 O WAT 2326 93.511 54.382 113.510 1.00 0.00 O ATOM 38982 H1 WAT 2326 93.609 53.440 113.648 1.00 0.00 H ATOM 38983 H2 WAT 2326 94.145 54.591 112.824 1.00 0.00 H TER 38985 WAT 2326 ATOM 38985 O WAT 2327 108.702 7.730 61.339 1.00 0.00 O ATOM 38986 H1 WAT 2327 109.255 7.780 62.118 1.00 0.00 H ATOM 38987 H2 WAT 2327 109.008 6.950 60.876 1.00 0.00 H TER 38989 WAT 2327 ATOM 38989 O WAT 2328 49.405 13.943 119.016 1.00 0.00 O ATOM 38990 H1 WAT 2328 50.057 13.823 119.706 1.00 0.00 H ATOM 38991 H2 WAT 2328 48.630 14.272 119.473 1.00 0.00 H TER 38993 WAT 2328 ATOM 38993 O WAT 2329 3.203 51.697 126.855 1.00 0.00 O ATOM 38994 H1 WAT 2329 3.994 52.000 126.409 1.00 0.00 H ATOM 38995 H2 WAT 2329 3.342 51.929 127.773 1.00 0.00 H TER 38997 WAT 2329 ATOM 38997 O WAT 2330 72.039 31.191 88.479 1.00 0.00 O ATOM 38998 H1 WAT 2330 72.912 30.801 88.440 1.00 0.00 H ATOM 38999 H2 WAT 2330 71.896 31.363 89.410 1.00 0.00 H TER 39001 WAT 2330 ATOM 39001 O WAT 2331 29.531 73.440 120.987 1.00 0.00 O ATOM 39002 H1 WAT 2331 29.733 74.314 120.654 1.00 0.00 H ATOM 39003 H2 WAT 2331 28.660 73.526 121.375 1.00 0.00 H TER 39005 WAT 2331 ATOM 39005 O WAT 2332 118.402 101.036 27.703 1.00 0.00 O ATOM 39006 H1 WAT 2332 119.296 100.941 28.031 1.00 0.00 H ATOM 39007 H2 WAT 2332 118.328 100.376 27.014 1.00 0.00 H TER 39009 WAT 2332 ATOM 39009 O WAT 2333 5.331 68.368 51.282 1.00 0.00 O ATOM 39010 H1 WAT 2333 5.292 69.316 51.152 1.00 0.00 H ATOM 39011 H2 WAT 2333 6.162 68.223 51.735 1.00 0.00 H TER 39013 WAT 2333 ATOM 39013 O WAT 2334 5.278 95.892 -0.050 1.00 0.00 O ATOM 39014 H1 WAT 2334 5.174 95.018 -0.425 1.00 0.00 H ATOM 39015 H2 WAT 2334 5.803 95.753 0.739 1.00 0.00 H TER 39017 WAT 2334 ATOM 39017 O WAT 2335 76.867 11.977 92.019 1.00 0.00 O ATOM 39018 H1 WAT 2335 77.813 11.999 91.873 1.00 0.00 H ATOM 39019 H2 WAT 2335 76.739 11.272 92.654 1.00 0.00 H TER 39021 WAT 2335 ATOM 39021 O WAT 2336 3.712 81.042 74.119 1.00 0.00 O ATOM 39022 H1 WAT 2336 3.885 80.519 73.336 1.00 0.00 H ATOM 39023 H2 WAT 2336 4.534 81.502 74.285 1.00 0.00 H TER 39025 WAT 2336 ATOM 39025 O WAT 2337 112.095 8.508 19.127 1.00 0.00 O ATOM 39026 H1 WAT 2337 111.206 8.157 19.092 1.00 0.00 H ATOM 39027 H2 WAT 2337 112.509 8.040 19.853 1.00 0.00 H TER 39029 WAT 2337 ATOM 39029 O WAT 2338 46.001 0.326 87.856 1.00 0.00 O ATOM 39030 H1 WAT 2338 45.373 0.860 88.344 1.00 0.00 H ATOM 39031 H2 WAT 2338 46.746 0.231 88.449 1.00 0.00 H TER 39033 WAT 2338 ATOM 39033 O WAT 2339 135.122 16.784 56.720 1.00 0.00 O ATOM 39034 H1 WAT 2339 135.941 16.751 57.214 1.00 0.00 H ATOM 39035 H2 WAT 2339 134.462 17.037 57.366 1.00 0.00 H TER 39037 WAT 2339 ATOM 39037 O WAT 2340 51.663 9.558 4.671 1.00 0.00 O ATOM 39038 H1 WAT 2340 50.706 9.590 4.700 1.00 0.00 H ATOM 39039 H2 WAT 2340 51.905 8.982 5.395 1.00 0.00 H TER 39041 WAT 2340 ATOM 39041 O WAT 2341 26.035 97.060 5.238 1.00 0.00 O ATOM 39042 H1 WAT 2341 26.583 97.131 4.457 1.00 0.00 H ATOM 39043 H2 WAT 2341 25.462 96.314 5.062 1.00 0.00 H TER 39045 WAT 2341 ATOM 39045 O WAT 2342 129.691 41.048 148.385 1.00 0.00 O ATOM 39046 H1 WAT 2342 128.975 40.450 148.169 1.00 0.00 H ATOM 39047 H2 WAT 2342 130.481 40.587 148.102 1.00 0.00 H TER 39049 WAT 2342 ATOM 39049 O WAT 2343 55.078 54.422 126.099 1.00 0.00 O ATOM 39050 H1 WAT 2343 56.034 54.456 126.126 1.00 0.00 H ATOM 39051 H2 WAT 2343 54.797 54.992 126.815 1.00 0.00 H TER 39053 WAT 2343 ATOM 39053 O WAT 2344 43.652 18.583 105.758 1.00 0.00 O ATOM 39054 H1 WAT 2344 43.342 18.918 104.917 1.00 0.00 H ATOM 39055 H2 WAT 2344 43.005 18.893 106.392 1.00 0.00 H TER 39057 WAT 2344 ATOM 39057 O WAT 2345 69.170 1.691 13.269 1.00 0.00 O ATOM 39058 H1 WAT 2345 68.782 1.650 12.395 1.00 0.00 H ATOM 39059 H2 WAT 2345 69.926 1.106 13.224 1.00 0.00 H TER 39061 WAT 2345 ATOM 39061 O WAT 2346 136.933 99.995 142.271 1.00 0.00 O ATOM 39062 H1 WAT 2346 136.930 99.752 141.345 1.00 0.00 H ATOM 39063 H2 WAT 2346 137.434 100.810 142.304 1.00 0.00 H TER 39065 WAT 2346 ATOM 39065 O WAT 2347 26.201 37.639 88.562 1.00 0.00 O ATOM 39066 H1 WAT 2347 26.822 38.317 88.296 1.00 0.00 H ATOM 39067 H2 WAT 2347 25.421 37.807 88.032 1.00 0.00 H TER 39069 WAT 2347 ATOM 39069 O WAT 2348 18.384 119.362 75.559 1.00 0.00 O ATOM 39070 H1 WAT 2348 17.956 119.878 76.242 1.00 0.00 H ATOM 39071 H2 WAT 2348 17.787 118.630 75.404 1.00 0.00 H TER 39073 WAT 2348 ATOM 39073 O WAT 2349 77.325 133.085 148.487 1.00 0.00 O ATOM 39074 H1 WAT 2349 77.645 132.574 149.230 1.00 0.00 H ATOM 39075 H2 WAT 2349 76.412 133.274 148.701 1.00 0.00 H TER 39077 WAT 2349 ATOM 39077 O WAT 2350 68.244 85.103 136.648 1.00 0.00 O ATOM 39078 H1 WAT 2350 68.455 85.199 137.577 1.00 0.00 H ATOM 39079 H2 WAT 2350 68.019 85.988 136.361 1.00 0.00 H TER 39081 WAT 2350 ATOM 39081 O WAT 2351 79.922 11.052 77.698 1.00 0.00 O ATOM 39082 H1 WAT 2351 80.042 10.508 76.919 1.00 0.00 H ATOM 39083 H2 WAT 2351 79.921 11.950 77.366 1.00 0.00 H TER 39085 WAT 2351 ATOM 39085 O WAT 2352 25.525 32.246 133.834 1.00 0.00 O ATOM 39086 H1 WAT 2352 24.741 32.272 133.285 1.00 0.00 H ATOM 39087 H2 WAT 2352 26.251 32.213 133.212 1.00 0.00 H TER 39089 WAT 2352 ATOM 39089 O WAT 2353 69.127 119.573 145.369 1.00 0.00 O ATOM 39090 H1 WAT 2353 69.774 119.254 144.739 1.00 0.00 H ATOM 39091 H2 WAT 2353 68.304 119.589 144.880 1.00 0.00 H TER 39093 WAT 2353 ATOM 39093 O WAT 2354 88.532 61.872 156.950 1.00 0.00 O ATOM 39094 H1 WAT 2354 87.993 62.239 156.249 1.00 0.00 H ATOM 39095 H2 WAT 2354 87.901 61.543 157.590 1.00 0.00 H TER 39097 WAT 2354 ATOM 39097 O WAT 2355 88.389 132.700 84.751 1.00 0.00 O ATOM 39098 H1 WAT 2355 87.519 132.303 84.796 1.00 0.00 H ATOM 39099 H2 WAT 2355 88.318 133.491 85.285 1.00 0.00 H TER 39101 WAT 2355 ATOM 39101 O WAT 2356 113.225 -0.054 116.168 1.00 0.00 O ATOM 39102 H1 WAT 2356 112.645 0.691 116.012 1.00 0.00 H ATOM 39103 H2 WAT 2356 113.189 -0.561 115.357 1.00 0.00 H TER 39105 WAT 2356 ATOM 39105 O WAT 2357 43.085 52.304 3.087 1.00 0.00 O ATOM 39106 H1 WAT 2357 42.347 52.795 3.450 1.00 0.00 H ATOM 39107 H2 WAT 2357 42.740 51.423 2.943 1.00 0.00 H TER 39109 WAT 2357 ATOM 39109 O WAT 2358 21.439 115.745 132.144 1.00 0.00 O ATOM 39110 H1 WAT 2358 21.840 114.997 132.584 1.00 0.00 H ATOM 39111 H2 WAT 2358 22.165 116.177 131.694 1.00 0.00 H TER 39113 WAT 2358 ATOM 39113 O WAT 2359 50.130 32.655 22.561 1.00 0.00 O ATOM 39114 H1 WAT 2359 49.406 33.065 22.089 1.00 0.00 H ATOM 39115 H2 WAT 2359 49.813 31.777 22.771 1.00 0.00 H TER 39117 WAT 2359 ATOM 39117 O WAT 2360 47.606 40.231 151.056 1.00 0.00 O ATOM 39118 H1 WAT 2360 48.553 40.099 151.047 1.00 0.00 H ATOM 39119 H2 WAT 2360 47.339 40.119 150.144 1.00 0.00 H TER 39121 WAT 2360 ATOM 39121 O WAT 2361 7.060 52.966 150.698 1.00 0.00 O ATOM 39122 H1 WAT 2361 7.015 53.019 151.652 1.00 0.00 H ATOM 39123 H2 WAT 2361 7.845 52.446 150.524 1.00 0.00 H TER 39125 WAT 2361 ATOM 39125 O WAT 2362 131.612 53.243 2.042 1.00 0.00 O ATOM 39126 H1 WAT 2362 131.610 52.408 1.574 1.00 0.00 H ATOM 39127 H2 WAT 2362 131.029 53.805 1.532 1.00 0.00 H TER 39129 WAT 2362 ATOM 39129 O WAT 2363 104.349 98.316 132.431 1.00 0.00 O ATOM 39130 H1 WAT 2363 104.459 97.667 133.126 1.00 0.00 H ATOM 39131 H2 WAT 2363 104.665 99.134 132.815 1.00 0.00 H TER 39133 WAT 2363 ATOM 39133 O WAT 2364 54.204 146.076 55.993 1.00 0.00 O ATOM 39134 H1 WAT 2364 54.002 145.204 56.332 1.00 0.00 H ATOM 39135 H2 WAT 2364 54.673 145.912 55.175 1.00 0.00 H TER 39137 WAT 2364 ATOM 39137 O WAT 2365 35.415 127.701 147.721 1.00 0.00 O ATOM 39138 H1 WAT 2365 35.318 127.897 146.790 1.00 0.00 H ATOM 39139 H2 WAT 2365 35.001 128.440 148.166 1.00 0.00 H TER 39141 WAT 2365 ATOM 39141 O WAT 2366 37.321 98.921 17.778 1.00 0.00 O ATOM 39142 H1 WAT 2366 37.205 97.971 17.781 1.00 0.00 H ATOM 39143 H2 WAT 2366 38.270 99.045 17.752 1.00 0.00 H TER 39145 WAT 2366 ATOM 39145 O WAT 2367 116.545 34.478 59.084 1.00 0.00 O ATOM 39146 H1 WAT 2367 116.370 33.752 58.486 1.00 0.00 H ATOM 39147 H2 WAT 2367 116.312 35.261 58.586 1.00 0.00 H TER 39149 WAT 2367 ATOM 39149 O WAT 2368 120.526 133.398 78.337 1.00 0.00 O ATOM 39150 H1 WAT 2368 120.866 132.866 79.057 1.00 0.00 H ATOM 39151 H2 WAT 2368 120.457 132.789 77.602 1.00 0.00 H TER 39153 WAT 2368 ATOM 39153 O WAT 2369 38.627 129.046 76.040 1.00 0.00 O ATOM 39154 H1 WAT 2369 38.048 129.780 75.837 1.00 0.00 H ATOM 39155 H2 WAT 2369 38.143 128.528 76.683 1.00 0.00 H TER 39157 WAT 2369 ATOM 39157 O WAT 2370 106.624 126.214 109.347 1.00 0.00 O ATOM 39158 H1 WAT 2370 106.783 125.445 108.799 1.00 0.00 H ATOM 39159 H2 WAT 2370 106.677 126.954 108.742 1.00 0.00 H TER 39161 WAT 2370 ATOM 39161 O WAT 2371 84.696 93.524 142.375 1.00 0.00 O ATOM 39162 H1 WAT 2371 84.306 93.434 143.245 1.00 0.00 H ATOM 39163 H2 WAT 2371 85.214 92.727 142.263 1.00 0.00 H TER 39165 WAT 2371 ATOM 39165 O WAT 2372 115.773 143.594 3.013 1.00 0.00 O ATOM 39166 H1 WAT 2372 115.321 144.412 3.220 1.00 0.00 H ATOM 39167 H2 WAT 2372 115.147 142.908 3.248 1.00 0.00 H TER 39169 WAT 2372 ATOM 39169 O WAT 2373 115.048 62.463 79.414 1.00 0.00 O ATOM 39170 H1 WAT 2373 115.334 62.519 78.502 1.00 0.00 H ATOM 39171 H2 WAT 2373 114.156 62.118 79.364 1.00 0.00 H TER 39173 WAT 2373 ATOM 39173 O WAT 2374 54.892 47.176 110.892 1.00 0.00 O ATOM 39174 H1 WAT 2374 54.599 46.502 111.505 1.00 0.00 H ATOM 39175 H2 WAT 2374 54.468 47.978 111.197 1.00 0.00 H TER 39177 WAT 2374 ATOM 39177 O WAT 2375 22.736 103.895 85.345 1.00 0.00 O ATOM 39178 H1 WAT 2375 22.680 104.174 86.259 1.00 0.00 H ATOM 39179 H2 WAT 2375 22.070 103.213 85.261 1.00 0.00 H TER 39181 WAT 2375 ATOM 39181 O WAT 2376 76.616 28.756 140.569 1.00 0.00 O ATOM 39182 H1 WAT 2376 77.182 29.396 140.137 1.00 0.00 H ATOM 39183 H2 WAT 2376 75.986 28.500 139.895 1.00 0.00 H TER 39185 WAT 2376 ATOM 39185 O WAT 2377 137.771 79.148 92.301 1.00 0.00 O ATOM 39186 H1 WAT 2377 137.151 78.483 92.002 1.00 0.00 H ATOM 39187 H2 WAT 2377 138.435 78.656 92.784 1.00 0.00 H TER 39189 WAT 2377 ATOM 39189 O WAT 2378 94.980 26.441 3.089 1.00 0.00 O ATOM 39190 H1 WAT 2378 94.860 26.979 2.307 1.00 0.00 H ATOM 39191 H2 WAT 2378 95.261 27.059 3.764 1.00 0.00 H TER 39193 WAT 2378 ATOM 39193 O WAT 2379 7.217 42.900 65.992 1.00 0.00 O ATOM 39194 H1 WAT 2379 8.092 43.246 65.817 1.00 0.00 H ATOM 39195 H2 WAT 2379 6.902 42.602 65.139 1.00 0.00 H TER 39197 WAT 2379 ATOM 39197 O WAT 2380 114.442 47.925 3.101 1.00 0.00 O ATOM 39198 H1 WAT 2380 114.843 47.522 2.331 1.00 0.00 H ATOM 39199 H2 WAT 2380 114.911 48.752 3.210 1.00 0.00 H TER 39201 WAT 2380 ATOM 39201 O WAT 2381 91.786 25.875 153.814 1.00 0.00 O ATOM 39202 H1 WAT 2381 92.233 25.517 153.047 1.00 0.00 H ATOM 39203 H2 WAT 2381 92.303 26.642 154.057 1.00 0.00 H TER 39205 WAT 2381 ATOM 39205 O WAT 2382 65.990 63.943 20.768 1.00 0.00 O ATOM 39206 H1 WAT 2382 65.563 64.295 21.549 1.00 0.00 H ATOM 39207 H2 WAT 2382 66.082 63.007 20.946 1.00 0.00 H TER 39209 WAT 2382 ATOM 39209 O WAT 2383 111.290 137.946 65.652 1.00 0.00 O ATOM 39210 H1 WAT 2383 111.048 138.805 65.999 1.00 0.00 H ATOM 39211 H2 WAT 2383 112.107 137.728 66.101 1.00 0.00 H TER 39213 WAT 2383 ATOM 39213 O WAT 2384 88.231 74.375 86.795 1.00 0.00 O ATOM 39214 H1 WAT 2384 88.521 73.464 86.843 1.00 0.00 H ATOM 39215 H2 WAT 2384 89.028 74.871 86.610 1.00 0.00 H TER 39217 WAT 2384 ATOM 39217 O WAT 2385 116.353 90.291 99.503 1.00 0.00 O ATOM 39218 H1 WAT 2385 115.475 90.274 99.885 1.00 0.00 H ATOM 39219 H2 WAT 2385 116.424 89.463 99.028 1.00 0.00 H TER 39221 WAT 2385 ATOM 39221 O WAT 2386 77.507 31.554 10.283 1.00 0.00 O ATOM 39222 H1 WAT 2386 77.009 31.672 9.474 1.00 0.00 H ATOM 39223 H2 WAT 2386 78.422 31.646 10.016 1.00 0.00 H TER 39225 WAT 2386 ATOM 39225 O WAT 2387 28.313 41.046 147.360 1.00 0.00 O ATOM 39226 H1 WAT 2387 27.425 40.814 147.087 1.00 0.00 H ATOM 39227 H2 WAT 2387 28.418 41.957 147.083 1.00 0.00 H TER 39229 WAT 2387 ATOM 39229 O WAT 2388 142.716 83.251 109.548 1.00 0.00 O ATOM 39230 H1 WAT 2388 142.989 83.674 110.362 1.00 0.00 H ATOM 39231 H2 WAT 2388 143.171 82.409 109.551 1.00 0.00 H TER 39233 WAT 2388 ATOM 39233 O WAT 2389 16.663 66.410 142.809 1.00 0.00 O ATOM 39234 H1 WAT 2389 17.402 65.805 142.880 1.00 0.00 H ATOM 39235 H2 WAT 2389 15.966 65.998 143.320 1.00 0.00 H TER 39237 WAT 2389 ATOM 39237 O WAT 2390 51.627 27.310 145.387 1.00 0.00 O ATOM 39238 H1 WAT 2390 51.958 27.974 145.992 1.00 0.00 H ATOM 39239 H2 WAT 2390 52.410 26.970 144.953 1.00 0.00 H TER 39241 WAT 2390 ATOM 39241 O WAT 2391 58.801 1.600 11.228 1.00 0.00 O ATOM 39242 H1 WAT 2391 59.677 1.525 10.849 1.00 0.00 H ATOM 39243 H2 WAT 2391 58.685 2.538 11.378 1.00 0.00 H TER 39245 WAT 2391 ATOM 39245 O WAT 2392 73.736 28.316 102.012 1.00 0.00 O ATOM 39246 H1 WAT 2392 74.217 28.726 102.730 1.00 0.00 H ATOM 39247 H2 WAT 2392 73.517 29.040 101.426 1.00 0.00 H TER 39249 WAT 2392 ATOM 39249 O WAT 2393 75.520 40.482 77.031 1.00 0.00 O ATOM 39250 H1 WAT 2393 74.845 41.114 76.784 1.00 0.00 H ATOM 39251 H2 WAT 2393 75.142 40.005 77.770 1.00 0.00 H TER 39253 WAT 2393 ATOM 39253 O WAT 2394 35.209 50.189 112.061 1.00 0.00 O ATOM 39254 H1 WAT 2394 35.944 50.798 112.133 1.00 0.00 H ATOM 39255 H2 WAT 2394 34.713 50.501 111.305 1.00 0.00 H TER 39257 WAT 2394 ATOM 39257 O WAT 2395 2.497 18.471 132.550 1.00 0.00 O ATOM 39258 H1 WAT 2395 3.435 18.644 132.636 1.00 0.00 H ATOM 39259 H2 WAT 2395 2.432 17.516 132.512 1.00 0.00 H TER 39261 WAT 2395 ATOM 39261 O WAT 2396 102.469 100.882 129.359 1.00 0.00 O ATOM 39262 H1 WAT 2396 102.933 100.215 128.853 1.00 0.00 H ATOM 39263 H2 WAT 2396 102.967 101.685 129.209 1.00 0.00 H TER 39265 WAT 2396 ATOM 39265 O WAT 2397 4.915 94.189 71.323 1.00 0.00 O ATOM 39266 H1 WAT 2397 5.228 94.984 71.755 1.00 0.00 H ATOM 39267 H2 WAT 2397 4.994 93.507 71.989 1.00 0.00 H TER 39269 WAT 2397 ATOM 39269 O WAT 2398 44.061 124.950 119.256 1.00 0.00 O ATOM 39270 H1 WAT 2398 43.333 125.401 118.828 1.00 0.00 H ATOM 39271 H2 WAT 2398 44.833 125.210 118.753 1.00 0.00 H TER 39273 WAT 2398 ATOM 39273 O WAT 2399 59.741 47.278 150.337 1.00 0.00 O ATOM 39274 H1 WAT 2399 59.860 46.734 151.116 1.00 0.00 H ATOM 39275 H2 WAT 2399 60.383 46.942 149.711 1.00 0.00 H TER 39277 WAT 2399 ATOM 39277 O WAT 2400 87.490 113.694 64.873 1.00 0.00 O ATOM 39278 H1 WAT 2400 86.673 113.752 65.368 1.00 0.00 H ATOM 39279 H2 WAT 2400 87.304 113.063 64.177 1.00 0.00 H TER 39281 WAT 2400 ATOM 39281 O WAT 2401 94.462 25.871 84.561 1.00 0.00 O ATOM 39282 H1 WAT 2401 93.803 26.419 84.986 1.00 0.00 H ATOM 39283 H2 WAT 2401 93.980 25.399 83.882 1.00 0.00 H TER 39285 WAT 2401 ATOM 39285 O WAT 2402 131.693 3.766 107.103 1.00 0.00 O ATOM 39286 H1 WAT 2402 131.235 3.073 107.578 1.00 0.00 H ATOM 39287 H2 WAT 2402 132.607 3.678 107.373 1.00 0.00 H TER 39289 WAT 2402 ATOM 39289 O WAT 2403 76.480 47.795 112.517 1.00 0.00 O ATOM 39290 H1 WAT 2403 76.053 46.956 112.689 1.00 0.00 H ATOM 39291 H2 WAT 2403 76.432 48.264 113.350 1.00 0.00 H TER 39293 WAT 2403 ATOM 39293 O WAT 2404 66.907 91.773 84.184 1.00 0.00 O ATOM 39294 H1 WAT 2404 67.762 91.345 84.144 1.00 0.00 H ATOM 39295 H2 WAT 2404 66.353 91.256 83.600 1.00 0.00 H TER 39297 WAT 2404 ATOM 39297 O WAT 2405 3.030 24.722 17.093 1.00 0.00 O ATOM 39298 H1 WAT 2405 3.811 25.190 16.798 1.00 0.00 H ATOM 39299 H2 WAT 2405 3.274 23.798 17.051 1.00 0.00 H TER 39301 WAT 2405 ATOM 39301 O WAT 2406 4.567 71.663 99.991 1.00 0.00 O ATOM 39302 H1 WAT 2406 3.710 71.615 99.566 1.00 0.00 H ATOM 39303 H2 WAT 2406 4.927 72.505 99.711 1.00 0.00 H TER 39305 WAT 2406 ATOM 39305 O WAT 2407 39.287 109.290 102.357 1.00 0.00 O ATOM 39306 H1 WAT 2407 39.498 110.201 102.152 1.00 0.00 H ATOM 39307 H2 WAT 2407 40.054 108.968 102.831 1.00 0.00 H TER 39309 WAT 2407 ATOM 39309 O WAT 2408 145.127 88.919 85.792 1.00 0.00 O ATOM 39310 H1 WAT 2408 144.824 88.648 86.658 1.00 0.00 H ATOM 39311 H2 WAT 2408 144.374 89.365 85.404 1.00 0.00 H TER 39313 WAT 2408 ATOM 39313 O WAT 2409 91.768 56.722 156.999 1.00 0.00 O ATOM 39314 H1 WAT 2409 91.776 56.983 156.078 1.00 0.00 H ATOM 39315 H2 WAT 2409 91.331 57.445 157.449 1.00 0.00 H TER 39317 WAT 2409 ATOM 39317 O WAT 2410 36.700 87.856 99.809 1.00 0.00 O ATOM 39318 H1 WAT 2410 36.809 87.424 98.962 1.00 0.00 H ATOM 39319 H2 WAT 2410 36.092 88.574 99.635 1.00 0.00 H TER 39321 WAT 2410 ATOM 39321 O WAT 2411 42.314 1.854 85.380 1.00 0.00 O ATOM 39322 H1 WAT 2411 42.817 2.491 85.887 1.00 0.00 H ATOM 39323 H2 WAT 2411 42.389 1.039 85.876 1.00 0.00 H TER 39325 WAT 2411 ATOM 39325 O WAT 2412 49.031 50.077 142.690 1.00 0.00 O ATOM 39326 H1 WAT 2412 49.868 50.534 142.613 1.00 0.00 H ATOM 39327 H2 WAT 2412 48.645 50.417 143.497 1.00 0.00 H TER 39329 WAT 2412 ATOM 39329 O WAT 2413 29.529 3.788 155.114 1.00 0.00 O ATOM 39330 H1 WAT 2413 30.333 4.174 155.461 1.00 0.00 H ATOM 39331 H2 WAT 2413 29.688 3.711 154.173 1.00 0.00 H TER 39333 WAT 2413 ATOM 39333 O WAT 2414 87.246 74.627 125.064 1.00 0.00 O ATOM 39334 H1 WAT 2414 87.604 75.102 125.814 1.00 0.00 H ATOM 39335 H2 WAT 2414 87.817 74.867 124.334 1.00 0.00 H TER 39337 WAT 2414 ATOM 39337 O WAT 2415 36.315 80.196 86.527 1.00 0.00 O ATOM 39338 H1 WAT 2415 36.383 80.117 87.479 1.00 0.00 H ATOM 39339 H2 WAT 2415 37.096 79.754 86.194 1.00 0.00 H TER 39341 WAT 2415 ATOM 39341 O WAT 2416 120.707 71.361 90.255 1.00 0.00 O ATOM 39342 H1 WAT 2416 121.053 71.261 91.142 1.00 0.00 H ATOM 39343 H2 WAT 2416 121.326 70.885 89.702 1.00 0.00 H TER 39345 WAT 2416 ATOM 39345 O WAT 2417 134.862 19.656 105.794 1.00 0.00 O ATOM 39346 H1 WAT 2417 134.439 19.216 105.056 1.00 0.00 H ATOM 39347 H2 WAT 2417 135.591 20.135 105.402 1.00 0.00 H TER 39349 WAT 2417 ATOM 39349 O WAT 2418 89.309 23.932 73.165 1.00 0.00 O ATOM 39350 H1 WAT 2418 89.371 24.820 73.516 1.00 0.00 H ATOM 39351 H2 WAT 2418 88.643 23.507 73.705 1.00 0.00 H TER 39353 WAT 2418 ATOM 39353 O WAT 2419 10.474 65.264 79.928 1.00 0.00 O ATOM 39354 H1 WAT 2419 10.493 64.978 80.841 1.00 0.00 H ATOM 39355 H2 WAT 2419 11.069 64.665 79.477 1.00 0.00 H TER 39357 WAT 2419 ATOM 39357 O WAT 2420 2.937 102.692 108.955 1.00 0.00 O ATOM 39358 H1 WAT 2420 2.380 102.189 109.549 1.00 0.00 H ATOM 39359 H2 WAT 2420 2.804 102.285 108.099 1.00 0.00 H TER 39361 WAT 2420 ATOM 39361 O WAT 2421 33.041 20.915 102.076 1.00 0.00 O ATOM 39362 H1 WAT 2421 33.614 21.282 102.749 1.00 0.00 H ATOM 39363 H2 WAT 2421 32.885 21.642 101.473 1.00 0.00 H TER 39365 WAT 2421 ATOM 39365 O WAT 2422 4.535 21.469 152.029 1.00 0.00 O ATOM 39366 H1 WAT 2422 5.438 21.167 152.126 1.00 0.00 H ATOM 39367 H2 WAT 2422 4.129 20.828 151.445 1.00 0.00 H TER 39369 WAT 2422 ATOM 39369 O WAT 2423 104.725 64.917 123.999 1.00 0.00 O ATOM 39370 H1 WAT 2423 105.306 64.164 124.110 1.00 0.00 H ATOM 39371 H2 WAT 2423 104.135 64.877 124.751 1.00 0.00 H TER 39373 WAT 2423 ATOM 39373 O WAT 2424 58.642 113.486 66.425 1.00 0.00 O ATOM 39374 H1 WAT 2424 59.388 112.966 66.726 1.00 0.00 H ATOM 39375 H2 WAT 2424 58.326 113.024 65.648 1.00 0.00 H TER 39377 WAT 2424 ATOM 39377 O WAT 2425 107.806 17.062 150.552 1.00 0.00 O ATOM 39378 H1 WAT 2425 107.914 16.889 151.488 1.00 0.00 H ATOM 39379 H2 WAT 2425 108.269 16.344 150.121 1.00 0.00 H TER 39381 WAT 2425 ATOM 39381 O WAT 2426 95.293 16.751 83.111 1.00 0.00 O ATOM 39382 H1 WAT 2426 94.458 16.294 83.209 1.00 0.00 H ATOM 39383 H2 WAT 2426 95.906 16.073 82.829 1.00 0.00 H TER 39385 WAT 2426 ATOM 39385 O WAT 2427 119.747 26.606 105.731 1.00 0.00 O ATOM 39386 H1 WAT 2427 120.362 27.211 106.144 1.00 0.00 H ATOM 39387 H2 WAT 2427 119.800 26.809 104.797 1.00 0.00 H TER 39389 WAT 2427 ATOM 39389 O WAT 2428 37.470 135.388 119.965 1.00 0.00 O ATOM 39390 H1 WAT 2428 37.343 134.762 119.252 1.00 0.00 H ATOM 39391 H2 WAT 2428 38.368 135.701 119.851 1.00 0.00 H TER 39393 WAT 2428 ATOM 39393 O WAT 2429 124.697 80.312 67.013 1.00 0.00 O ATOM 39394 H1 WAT 2429 124.423 79.739 66.297 1.00 0.00 H ATOM 39395 H2 WAT 2429 125.225 80.989 66.589 1.00 0.00 H TER 39397 WAT 2429 ATOM 39397 O WAT 2430 19.203 73.750 74.037 1.00 0.00 O ATOM 39398 H1 WAT 2430 18.609 74.063 74.719 1.00 0.00 H ATOM 39399 H2 WAT 2430 20.035 74.186 74.224 1.00 0.00 H TER 39401 WAT 2430 ATOM 39401 O WAT 2431 80.958 20.019 17.326 1.00 0.00 O ATOM 39402 H1 WAT 2431 81.104 20.732 16.704 1.00 0.00 H ATOM 39403 H2 WAT 2431 80.086 20.186 17.681 1.00 0.00 H TER 39405 WAT 2431 ATOM 39405 O WAT 2432 76.162 69.359 17.124 1.00 0.00 O ATOM 39406 H1 WAT 2432 77.111 69.345 17.001 1.00 0.00 H ATOM 39407 H2 WAT 2432 75.980 70.228 17.483 1.00 0.00 H TER 39409 WAT 2432 ATOM 39409 O WAT 2433 33.381 50.895 136.773 1.00 0.00 O ATOM 39410 H1 WAT 2433 32.903 50.964 137.599 1.00 0.00 H ATOM 39411 H2 WAT 2433 33.241 51.738 136.343 1.00 0.00 H TER 39413 WAT 2433 ATOM 39413 O WAT 2434 27.242 23.291 18.764 1.00 0.00 O ATOM 39414 H1 WAT 2434 28.084 22.859 18.621 1.00 0.00 H ATOM 39415 H2 WAT 2434 27.169 23.919 18.045 1.00 0.00 H TER 39417 WAT 2434 ATOM 39417 O WAT 2435 52.672 84.228 97.713 1.00 0.00 O ATOM 39418 H1 WAT 2435 52.306 83.352 97.834 1.00 0.00 H ATOM 39419 H2 WAT 2435 53.612 84.084 97.613 1.00 0.00 H TER 39421 WAT 2435 ATOM 39421 O WAT 2436 121.745 140.926 120.805 1.00 0.00 O ATOM 39422 H1 WAT 2436 121.734 140.615 119.900 1.00 0.00 H ATOM 39423 H2 WAT 2436 122.482 141.536 120.840 1.00 0.00 H TER 39425 WAT 2436 ATOM 39425 O WAT 2437 91.988 76.991 139.061 1.00 0.00 O ATOM 39426 H1 WAT 2437 92.447 76.181 138.838 1.00 0.00 H ATOM 39427 H2 WAT 2437 91.121 76.890 138.670 1.00 0.00 H TER 39429 WAT 2437 ATOM 39429 O WAT 2438 74.557 57.956 21.398 1.00 0.00 O ATOM 39430 H1 WAT 2438 74.397 57.025 21.553 1.00 0.00 H ATOM 39431 H2 WAT 2438 74.070 58.152 20.598 1.00 0.00 H TER 39433 WAT 2438 ATOM 39433 O WAT 2439 141.528 52.822 7.817 1.00 0.00 O ATOM 39434 H1 WAT 2439 140.587 52.845 7.993 1.00 0.00 H ATOM 39435 H2 WAT 2439 141.851 52.088 8.339 1.00 0.00 H TER 39437 WAT 2439 ATOM 39437 O WAT 2440 135.551 118.009 59.862 1.00 0.00 O ATOM 39438 H1 WAT 2440 135.652 117.124 59.511 1.00 0.00 H ATOM 39439 H2 WAT 2440 136.175 118.537 59.364 1.00 0.00 H TER 39441 WAT 2440 ATOM 39441 O WAT 2441 120.316 122.202 109.531 1.00 0.00 O ATOM 39442 H1 WAT 2441 119.717 122.949 109.538 1.00 0.00 H ATOM 39443 H2 WAT 2441 120.805 122.295 108.714 1.00 0.00 H TER 39445 WAT 2441 ATOM 39445 O WAT 2442 94.496 100.070 136.142 1.00 0.00 O ATOM 39446 H1 WAT 2442 94.886 99.294 135.740 1.00 0.00 H ATOM 39447 H2 WAT 2442 93.715 99.741 136.588 1.00 0.00 H TER 39449 WAT 2442 ATOM 39449 O WAT 2443 95.875 108.292 84.177 1.00 0.00 O ATOM 39450 H1 WAT 2443 96.607 108.206 84.788 1.00 0.00 H ATOM 39451 H2 WAT 2443 95.618 107.390 83.983 1.00 0.00 H TER 39453 WAT 2443 ATOM 39453 O WAT 2444 127.087 54.675 59.279 1.00 0.00 O ATOM 39454 H1 WAT 2444 127.789 54.322 59.825 1.00 0.00 H ATOM 39455 H2 WAT 2444 126.283 54.343 59.679 1.00 0.00 H TER 39457 WAT 2444 ATOM 39457 O WAT 2445 85.520 128.302 105.421 1.00 0.00 O ATOM 39458 H1 WAT 2445 85.757 129.174 105.736 1.00 0.00 H ATOM 39459 H2 WAT 2445 86.357 127.887 105.213 1.00 0.00 H TER 39461 WAT 2445 ATOM 39461 O WAT 2446 113.539 33.198 131.329 1.00 0.00 O ATOM 39462 H1 WAT 2446 114.035 33.259 132.145 1.00 0.00 H ATOM 39463 H2 WAT 2446 113.073 34.033 131.270 1.00 0.00 H TER 39465 WAT 2446 ATOM 39465 O WAT 2447 16.075 100.611 12.877 1.00 0.00 O ATOM 39466 H1 WAT 2447 15.170 100.922 12.845 1.00 0.00 H ATOM 39467 H2 WAT 2447 16.572 101.356 13.215 1.00 0.00 H TER 39469 WAT 2447 ATOM 39469 O WAT 2448 145.253 21.552 1.578 1.00 0.00 O ATOM 39470 H1 WAT 2448 145.623 20.856 2.120 1.00 0.00 H ATOM 39471 H2 WAT 2448 144.627 21.105 1.009 1.00 0.00 H TER 39473 WAT 2448 ATOM 39473 O WAT 2449 108.955 25.310 25.687 1.00 0.00 O ATOM 39474 H1 WAT 2449 108.155 25.432 25.176 1.00 0.00 H ATOM 39475 H2 WAT 2449 108.723 25.600 26.569 1.00 0.00 H TER 39477 WAT 2449 ATOM 39477 O WAT 2450 102.278 50.838 2.876 1.00 0.00 O ATOM 39478 H1 WAT 2450 101.696 50.243 2.402 1.00 0.00 H ATOM 39479 H2 WAT 2450 102.142 51.688 2.459 1.00 0.00 H TER 39481 WAT 2450 ATOM 39481 O WAT 2451 139.103 8.354 4.322 1.00 0.00 O ATOM 39482 H1 WAT 2451 139.557 7.881 3.625 1.00 0.00 H ATOM 39483 H2 WAT 2451 139.802 8.655 4.903 1.00 0.00 H TER 39485 WAT 2451 ATOM 39485 O WAT 2452 116.978 123.756 143.370 1.00 0.00 O ATOM 39486 H1 WAT 2452 117.271 122.991 143.866 1.00 0.00 H ATOM 39487 H2 WAT 2452 117.686 123.924 142.749 1.00 0.00 H TER 39489 WAT 2452 ATOM 39489 O WAT 2453 37.015 71.079 154.484 1.00 0.00 O ATOM 39490 H1 WAT 2453 36.741 71.994 154.542 1.00 0.00 H ATOM 39491 H2 WAT 2453 36.667 70.777 153.646 1.00 0.00 H TER 39493 WAT 2453 ATOM 39493 O WAT 2454 73.329 142.132 140.831 1.00 0.00 O ATOM 39494 H1 WAT 2454 73.190 141.488 140.136 1.00 0.00 H ATOM 39495 H2 WAT 2454 72.449 142.342 141.143 1.00 0.00 H TER 39497 WAT 2454 ATOM 39497 O WAT 2455 2.589 93.892 59.175 1.00 0.00 O ATOM 39498 H1 WAT 2455 3.256 94.331 58.647 1.00 0.00 H ATOM 39499 H2 WAT 2455 1.885 93.696 58.557 1.00 0.00 H TER 39501 WAT 2455 ATOM 39501 O WAT 2456 88.356 10.082 68.436 1.00 0.00 O ATOM 39502 H1 WAT 2456 87.473 9.716 68.381 1.00 0.00 H ATOM 39503 H2 WAT 2456 88.222 10.987 68.719 1.00 0.00 H TER 39505 WAT 2456 ATOM 39505 O WAT 2457 87.427 25.235 10.842 1.00 0.00 O ATOM 39506 H1 WAT 2457 87.999 24.899 11.532 1.00 0.00 H ATOM 39507 H2 WAT 2457 88.027 25.576 10.179 1.00 0.00 H TER 39509 WAT 2457 ATOM 39509 O WAT 2458 91.933 79.571 149.893 1.00 0.00 O ATOM 39510 H1 WAT 2458 91.062 79.935 150.050 1.00 0.00 H ATOM 39511 H2 WAT 2458 92.533 80.286 150.104 1.00 0.00 H TER 39513 WAT 2458 ATOM 39513 O WAT 2459 72.298 54.884 15.252 1.00 0.00 O ATOM 39514 H1 WAT 2459 71.398 55.038 15.540 1.00 0.00 H ATOM 39515 H2 WAT 2459 72.485 55.607 14.654 1.00 0.00 H TER 39517 WAT 2459 ATOM 39517 O WAT 2460 92.139 38.634 115.962 1.00 0.00 O ATOM 39518 H1 WAT 2460 92.141 38.990 115.074 1.00 0.00 H ATOM 39519 H2 WAT 2460 92.035 37.690 115.842 1.00 0.00 H TER 39521 WAT 2460 ATOM 39521 O WAT 2461 119.861 137.848 61.462 1.00 0.00 O ATOM 39522 H1 WAT 2461 119.568 138.657 61.881 1.00 0.00 H ATOM 39523 H2 WAT 2461 120.612 138.112 60.930 1.00 0.00 H TER 39525 WAT 2461 ATOM 39525 O WAT 2462 121.487 145.355 120.405 1.00 0.00 O ATOM 39526 H1 WAT 2462 122.122 146.070 120.394 1.00 0.00 H ATOM 39527 H2 WAT 2462 121.792 144.773 121.101 1.00 0.00 H TER 39529 WAT 2462 ATOM 39529 O WAT 2463 32.161 14.264 81.014 1.00 0.00 O ATOM 39530 H1 WAT 2463 32.614 13.952 80.231 1.00 0.00 H ATOM 39531 H2 WAT 2463 31.364 13.736 81.056 1.00 0.00 H TER 39533 WAT 2463 ATOM 39533 O WAT 2464 66.774 15.166 7.438 1.00 0.00 O ATOM 39534 H1 WAT 2464 66.284 15.385 6.645 1.00 0.00 H ATOM 39535 H2 WAT 2464 67.121 14.290 7.270 1.00 0.00 H TER 39537 WAT 2464 ATOM 39537 O WAT 2465 133.407 139.508 71.354 1.00 0.00 O ATOM 39538 H1 WAT 2465 133.653 139.742 70.459 1.00 0.00 H ATOM 39539 H2 WAT 2465 132.943 138.675 71.265 1.00 0.00 H TER 39541 WAT 2465 ATOM 39541 O WAT 2466 110.196 106.251 71.497 1.00 0.00 O ATOM 39542 H1 WAT 2466 110.761 106.827 72.012 1.00 0.00 H ATOM 39543 H2 WAT 2466 109.307 106.506 71.742 1.00 0.00 H TER 39545 WAT 2466 ATOM 39545 O WAT 2467 145.872 2.205 115.764 1.00 0.00 O ATOM 39546 H1 WAT 2467 145.017 2.622 115.872 1.00 0.00 H ATOM 39547 H2 WAT 2467 146.047 1.794 116.610 1.00 0.00 H TER 39549 WAT 2467 ATOM 39549 O WAT 2468 23.023 58.478 3.953 1.00 0.00 O ATOM 39550 H1 WAT 2468 23.094 59.032 4.730 1.00 0.00 H ATOM 39551 H2 WAT 2468 23.928 58.331 3.679 1.00 0.00 H TER 39553 WAT 2468 ATOM 39553 O WAT 2469 42.265 144.246 72.931 1.00 0.00 O ATOM 39554 H1 WAT 2469 42.378 144.939 72.281 1.00 0.00 H ATOM 39555 H2 WAT 2469 43.055 143.712 72.851 1.00 0.00 H TER 39557 WAT 2469 ATOM 39557 O WAT 2470 20.419 14.534 69.331 1.00 0.00 O ATOM 39558 H1 WAT 2470 19.541 14.834 69.566 1.00 0.00 H ATOM 39559 H2 WAT 2470 20.645 15.044 68.552 1.00 0.00 H TER 39561 WAT 2470 ATOM 39561 O WAT 2471 80.756 134.177 149.129 1.00 0.00 O ATOM 39562 H1 WAT 2471 80.854 133.256 148.885 1.00 0.00 H ATOM 39563 H2 WAT 2471 81.650 134.518 149.140 1.00 0.00 H TER 39565 WAT 2471 ATOM 39565 O WAT 2472 52.240 66.880 114.940 1.00 0.00 O ATOM 39566 H1 WAT 2472 52.561 66.448 115.731 1.00 0.00 H ATOM 39567 H2 WAT 2472 52.971 66.830 114.326 1.00 0.00 H TER 39569 WAT 2472 ATOM 39569 O WAT 2473 26.262 59.201 88.727 1.00 0.00 O ATOM 39570 H1 WAT 2473 26.166 58.379 88.245 1.00 0.00 H ATOM 39571 H2 WAT 2473 26.722 59.782 88.120 1.00 0.00 H TER 39573 WAT 2473 ATOM 39573 O WAT 2474 40.234 32.839 94.681 1.00 0.00 O ATOM 39574 H1 WAT 2474 40.468 33.305 93.878 1.00 0.00 H ATOM 39575 H2 WAT 2474 40.761 33.255 95.362 1.00 0.00 H TER 39577 WAT 2474 ATOM 39577 O WAT 2475 55.355 54.583 116.286 1.00 0.00 O ATOM 39578 H1 WAT 2475 56.270 54.306 116.340 1.00 0.00 H ATOM 39579 H2 WAT 2475 55.079 54.676 117.198 1.00 0.00 H TER 39581 WAT 2475 ATOM 39581 O WAT 2476 59.463 7.898 17.202 1.00 0.00 O ATOM 39582 H1 WAT 2476 58.909 7.264 17.657 1.00 0.00 H ATOM 39583 H2 WAT 2476 59.889 8.392 17.903 1.00 0.00 H TER 39585 WAT 2476 ATOM 39585 O WAT 2477 143.273 2.781 139.985 1.00 0.00 O ATOM 39586 H1 WAT 2477 143.248 2.190 140.738 1.00 0.00 H ATOM 39587 H2 WAT 2477 144.181 2.748 139.684 1.00 0.00 H TER 39589 WAT 2477 ATOM 39589 O WAT 2478 85.485 108.207 108.148 1.00 0.00 O ATOM 39590 H1 WAT 2478 84.855 108.927 108.143 1.00 0.00 H ATOM 39591 H2 WAT 2478 84.965 107.433 107.931 1.00 0.00 H TER 39593 WAT 2478 ATOM 39593 O WAT 2479 88.745 3.697 65.562 1.00 0.00 O ATOM 39594 H1 WAT 2479 89.533 3.240 65.267 1.00 0.00 H ATOM 39595 H2 WAT 2479 89.071 4.506 65.956 1.00 0.00 H TER 39597 WAT 2479 ATOM 39597 O WAT 2480 87.562 134.970 17.412 1.00 0.00 O ATOM 39598 H1 WAT 2480 86.660 134.690 17.261 1.00 0.00 H ATOM 39599 H2 WAT 2480 87.986 134.210 17.810 1.00 0.00 H TER 39601 WAT 2480 ATOM 39601 O WAT 2481 29.638 56.763 101.213 1.00 0.00 O ATOM 39602 H1 WAT 2481 30.510 57.120 101.382 1.00 0.00 H ATOM 39603 H2 WAT 2481 29.668 55.877 101.575 1.00 0.00 H TER 39605 WAT 2481 ATOM 39605 O WAT 2482 20.993 107.189 113.019 1.00 0.00 O ATOM 39606 H1 WAT 2482 21.258 106.944 112.132 1.00 0.00 H ATOM 39607 H2 WAT 2482 20.857 108.135 112.976 1.00 0.00 H TER 39609 WAT 2482 ATOM 39609 O WAT 2483 124.270 63.687 86.946 1.00 0.00 O ATOM 39610 H1 WAT 2483 124.244 64.163 86.116 1.00 0.00 H ATOM 39611 H2 WAT 2483 125.203 63.606 87.146 1.00 0.00 H TER 39613 WAT 2483 ATOM 39613 O WAT 2484 31.756 52.596 63.570 1.00 0.00 O ATOM 39614 H1 WAT 2484 32.646 52.884 63.365 1.00 0.00 H ATOM 39615 H2 WAT 2484 31.194 53.162 63.042 1.00 0.00 H TER 39617 WAT 2484 ATOM 39617 O WAT 2485 123.210 114.718 60.659 1.00 0.00 O ATOM 39618 H1 WAT 2485 122.756 114.724 61.502 1.00 0.00 H ATOM 39619 H2 WAT 2485 122.679 115.284 60.098 1.00 0.00 H TER 39621 WAT 2485 ATOM 39621 O WAT 2486 83.496 92.324 94.071 1.00 0.00 O ATOM 39622 H1 WAT 2486 83.485 93.202 94.453 1.00 0.00 H ATOM 39623 H2 WAT 2486 84.014 91.802 94.684 1.00 0.00 H TER 39625 WAT 2486 ATOM 39625 O WAT 2487 106.128 57.627 94.766 1.00 0.00 O ATOM 39626 H1 WAT 2487 106.391 56.729 94.966 1.00 0.00 H ATOM 39627 H2 WAT 2487 106.769 57.927 94.121 1.00 0.00 H TER 39629 WAT 2487 ATOM 39629 O WAT 2488 133.882 75.114 70.032 1.00 0.00 O ATOM 39630 H1 WAT 2488 134.058 74.709 69.183 1.00 0.00 H ATOM 39631 H2 WAT 2488 134.079 74.428 70.670 1.00 0.00 H TER 39633 WAT 2488 ATOM 39633 O WAT 2489 58.903 132.756 130.562 1.00 0.00 O ATOM 39634 H1 WAT 2489 59.140 133.562 130.103 1.00 0.00 H ATOM 39635 H2 WAT 2489 57.996 132.592 130.306 1.00 0.00 H TER 39637 WAT 2489 ATOM 39637 O WAT 2490 17.572 105.229 71.101 1.00 0.00 O ATOM 39638 H1 WAT 2490 18.125 104.777 71.738 1.00 0.00 H ATOM 39639 H2 WAT 2490 17.609 106.149 71.362 1.00 0.00 H TER 39641 WAT 2490 ATOM 39641 O WAT 2491 67.458 96.797 20.817 1.00 0.00 O ATOM 39642 H1 WAT 2491 68.099 97.305 20.319 1.00 0.00 H ATOM 39643 H2 WAT 2491 66.937 96.351 20.150 1.00 0.00 H TER 39645 WAT 2491 ATOM 39645 O WAT 2492 35.592 130.260 148.765 1.00 0.00 O ATOM 39646 H1 WAT 2492 36.537 130.225 148.911 1.00 0.00 H ATOM 39647 H2 WAT 2492 35.240 130.646 149.567 1.00 0.00 H TER 39649 WAT 2492 ATOM 39649 O WAT 2493 101.580 116.114 126.595 1.00 0.00 O ATOM 39650 H1 WAT 2493 101.942 115.501 127.235 1.00 0.00 H ATOM 39651 H2 WAT 2493 101.136 115.558 125.955 1.00 0.00 H TER 39653 WAT 2493 ATOM 39653 O WAT 2494 108.273 67.092 83.929 1.00 0.00 O ATOM 39654 H1 WAT 2494 107.977 67.467 84.758 1.00 0.00 H ATOM 39655 H2 WAT 2494 108.306 66.149 84.091 1.00 0.00 H TER 39657 WAT 2494 ATOM 39657 O WAT 2495 76.561 143.596 9.800 1.00 0.00 O ATOM 39658 H1 WAT 2495 76.706 144.017 8.953 1.00 0.00 H ATOM 39659 H2 WAT 2495 77.369 143.757 10.288 1.00 0.00 H TER 39661 WAT 2495 ATOM 39661 O WAT 2496 35.460 118.282 5.935 1.00 0.00 O ATOM 39662 H1 WAT 2496 36.029 117.678 5.459 1.00 0.00 H ATOM 39663 H2 WAT 2496 34.679 118.359 5.387 1.00 0.00 H TER 39665 WAT 2496 ATOM 39665 O WAT 2497 143.784 41.922 60.643 1.00 0.00 O ATOM 39666 H1 WAT 2497 143.967 41.745 61.566 1.00 0.00 H ATOM 39667 H2 WAT 2497 142.920 42.334 60.646 1.00 0.00 H TER 39669 WAT 2497 ATOM 39669 O WAT 2498 135.086 34.295 125.110 1.00 0.00 O ATOM 39670 H1 WAT 2498 135.667 34.865 124.607 1.00 0.00 H ATOM 39671 H2 WAT 2498 135.507 33.435 125.078 1.00 0.00 H TER 39673 WAT 2498 ATOM 39673 O WAT 2499 71.892 139.763 150.375 1.00 0.00 O ATOM 39674 H1 WAT 2499 72.373 138.941 150.471 1.00 0.00 H ATOM 39675 H2 WAT 2499 72.525 140.440 150.616 1.00 0.00 H TER 39677 WAT 2499 ATOM 39677 O WAT 2500 49.069 124.469 84.933 1.00 0.00 O ATOM 39678 H1 WAT 2500 48.255 124.384 85.430 1.00 0.00 H ATOM 39679 H2 WAT 2500 49.419 125.321 85.192 1.00 0.00 H TER 39681 WAT 2500 ATOM 39681 O WAT 2501 55.423 26.429 100.500 1.00 0.00 O ATOM 39682 H1 WAT 2501 55.009 25.568 100.554 1.00 0.00 H ATOM 39683 H2 WAT 2501 55.091 26.903 101.263 1.00 0.00 H TER 39685 WAT 2501 ATOM 39685 O WAT 2502 52.262 108.860 75.298 1.00 0.00 O ATOM 39686 H1 WAT 2502 53.005 108.272 75.159 1.00 0.00 H ATOM 39687 H2 WAT 2502 51.493 108.298 75.208 1.00 0.00 H TER 39689 WAT 2502 ATOM 39689 O WAT 2503 92.315 99.352 63.771 1.00 0.00 O ATOM 39690 H1 WAT 2503 92.637 99.235 62.878 1.00 0.00 H ATOM 39691 H2 WAT 2503 91.362 99.309 63.690 1.00 0.00 H TER 39693 WAT 2503 ATOM 39693 O WAT 2504 25.157 91.043 104.048 1.00 0.00 O ATOM 39694 H1 WAT 2504 25.026 90.711 104.936 1.00 0.00 H ATOM 39695 H2 WAT 2504 25.687 90.372 103.617 1.00 0.00 H TER 39697 WAT 2504 ATOM 39697 O WAT 2505 142.130 7.513 77.992 1.00 0.00 O ATOM 39698 H1 WAT 2505 142.863 7.788 77.443 1.00 0.00 H ATOM 39699 H2 WAT 2505 142.016 6.583 77.793 1.00 0.00 H TER 39701 WAT 2505 ATOM 39701 O WAT 2506 34.647 95.704 116.231 1.00 0.00 O ATOM 39702 H1 WAT 2506 34.964 96.162 117.009 1.00 0.00 H ATOM 39703 H2 WAT 2506 34.357 96.402 115.643 1.00 0.00 H TER 39705 WAT 2506 ATOM 39705 O WAT 2507 10.829 134.559 91.984 1.00 0.00 O ATOM 39706 H1 WAT 2507 11.340 135.367 91.941 1.00 0.00 H ATOM 39707 H2 WAT 2507 11.421 133.923 92.386 1.00 0.00 H TER 39709 WAT 2507 ATOM 39709 O WAT 2508 98.583 61.732 155.083 1.00 0.00 O ATOM 39710 H1 WAT 2508 99.449 62.117 154.943 1.00 0.00 H ATOM 39711 H2 WAT 2508 98.763 60.858 155.429 1.00 0.00 H TER 39713 WAT 2508 ATOM 39713 O WAT 2509 28.735 74.559 147.834 1.00 0.00 O ATOM 39714 H1 WAT 2509 28.241 75.379 147.831 1.00 0.00 H ATOM 39715 H2 WAT 2509 29.028 74.451 146.930 1.00 0.00 H TER 39717 WAT 2509 ATOM 39717 O WAT 2510 85.239 17.749 148.158 1.00 0.00 O ATOM 39718 H1 WAT 2510 85.537 18.101 147.318 1.00 0.00 H ATOM 39719 H2 WAT 2510 85.413 18.451 148.786 1.00 0.00 H TER 39721 WAT 2510 ATOM 39721 O WAT 2511 110.304 108.542 64.652 1.00 0.00 O ATOM 39722 H1 WAT 2511 110.490 109.371 64.210 1.00 0.00 H ATOM 39723 H2 WAT 2511 109.372 108.392 64.497 1.00 0.00 H TER 39725 WAT 2511 ATOM 39725 O WAT 2512 2.056 77.369 90.613 1.00 0.00 O ATOM 39726 H1 WAT 2512 2.787 76.796 90.847 1.00 0.00 H ATOM 39727 H2 WAT 2512 1.423 77.252 91.321 1.00 0.00 H TER 39729 WAT 2512 ATOM 39729 O WAT 2513 2.152 9.623 123.868 1.00 0.00 O ATOM 39730 H1 WAT 2513 2.528 8.744 123.908 1.00 0.00 H ATOM 39731 H2 WAT 2513 2.047 9.796 122.933 1.00 0.00 H TER 39733 WAT 2513 ATOM 39733 O WAT 2514 93.419 61.657 86.017 1.00 0.00 O ATOM 39734 H1 WAT 2514 93.989 61.691 85.249 1.00 0.00 H ATOM 39735 H2 WAT 2514 93.824 61.004 86.588 1.00 0.00 H TER 39737 WAT 2514 ATOM 39737 O WAT 2515 3.014 72.523 76.099 1.00 0.00 O ATOM 39738 H1 WAT 2515 2.523 71.865 75.608 1.00 0.00 H ATOM 39739 H2 WAT 2515 3.465 73.036 75.429 1.00 0.00 H TER 39741 WAT 2515 ATOM 39741 O WAT 2516 49.181 76.599 72.585 1.00 0.00 O ATOM 39742 H1 WAT 2516 49.520 77.476 72.764 1.00 0.00 H ATOM 39743 H2 WAT 2516 49.596 76.043 73.245 1.00 0.00 H TER 39745 WAT 2516 ATOM 39745 O WAT 2517 102.968 138.660 131.881 1.00 0.00 O ATOM 39746 H1 WAT 2517 103.646 139.012 132.458 1.00 0.00 H ATOM 39747 H2 WAT 2517 103.048 137.710 131.968 1.00 0.00 H TER 39749 WAT 2517 ATOM 39749 O WAT 2518 7.376 82.093 72.881 1.00 0.00 O ATOM 39750 H1 WAT 2518 7.504 83.041 72.862 1.00 0.00 H ATOM 39751 H2 WAT 2518 7.535 81.812 71.979 1.00 0.00 H TER 39753 WAT 2518 ATOM 39753 O WAT 2519 53.160 142.909 88.714 1.00 0.00 O ATOM 39754 H1 WAT 2519 53.176 141.979 88.941 1.00 0.00 H ATOM 39755 H2 WAT 2519 53.233 142.922 87.759 1.00 0.00 H TER 39757 WAT 2519 ATOM 39757 O WAT 2520 121.543 143.031 149.478 1.00 0.00 O ATOM 39758 H1 WAT 2520 121.729 143.787 150.034 1.00 0.00 H ATOM 39759 H2 WAT 2520 122.160 142.360 149.770 1.00 0.00 H TER 39761 WAT 2520 ATOM 39761 O WAT 2521 82.194 10.366 137.720 1.00 0.00 O ATOM 39762 H1 WAT 2521 82.618 10.063 136.917 1.00 0.00 H ATOM 39763 H2 WAT 2521 82.871 10.870 138.172 1.00 0.00 H TER 39765 WAT 2521 ATOM 39765 O WAT 2522 63.608 111.804 68.036 1.00 0.00 O ATOM 39766 H1 WAT 2522 63.601 112.495 67.374 1.00 0.00 H ATOM 39767 H2 WAT 2522 64.125 111.101 67.642 1.00 0.00 H TER 39769 WAT 2522 ATOM 39769 O WAT 2523 22.692 17.368 142.133 1.00 0.00 O ATOM 39770 H1 WAT 2523 22.609 16.458 142.419 1.00 0.00 H ATOM 39771 H2 WAT 2523 21.838 17.756 142.320 1.00 0.00 H TER 39773 WAT 2523 ATOM 39773 O WAT 2524 57.141 110.390 15.654 1.00 0.00 O ATOM 39774 H1 WAT 2524 57.883 110.586 16.227 1.00 0.00 H ATOM 39775 H2 WAT 2524 56.957 111.217 15.209 1.00 0.00 H TER 39777 WAT 2524 ATOM 39777 O WAT 2525 129.981 135.417 117.512 1.00 0.00 O ATOM 39778 H1 WAT 2525 130.493 135.895 118.165 1.00 0.00 H ATOM 39779 H2 WAT 2525 129.591 136.101 116.967 1.00 0.00 H TER 39781 WAT 2525 ATOM 39781 O WAT 2526 65.808 114.455 128.325 1.00 0.00 O ATOM 39782 H1 WAT 2526 65.907 114.415 129.276 1.00 0.00 H ATOM 39783 H2 WAT 2526 66.462 115.094 128.043 1.00 0.00 H TER 39785 WAT 2526 ATOM 39785 O WAT 2527 127.102 41.400 157.634 1.00 0.00 O ATOM 39786 H1 WAT 2527 126.410 41.467 158.292 1.00 0.00 H ATOM 39787 H2 WAT 2527 127.517 42.263 157.634 1.00 0.00 H TER 39789 WAT 2527 ATOM 39789 O WAT 2528 4.352 71.294 157.164 1.00 0.00 O ATOM 39790 H1 WAT 2528 3.957 70.479 157.474 1.00 0.00 H ATOM 39791 H2 WAT 2528 4.148 71.319 156.230 1.00 0.00 H TER 39793 WAT 2528 ATOM 39793 O WAT 2529 121.903 89.107 137.043 1.00 0.00 O ATOM 39794 H1 WAT 2529 122.127 89.346 137.942 1.00 0.00 H ATOM 39795 H2 WAT 2529 121.033 89.481 136.904 1.00 0.00 H TER 39797 WAT 2529 ATOM 39797 O WAT 2530 38.535 137.270 154.635 1.00 0.00 O ATOM 39798 H1 WAT 2530 39.199 137.873 154.300 1.00 0.00 H ATOM 39799 H2 WAT 2530 38.521 136.553 154.001 1.00 0.00 H TER 39801 WAT 2530 ATOM 39801 O WAT 2531 13.732 142.349 142.882 1.00 0.00 O ATOM 39802 H1 WAT 2531 13.631 141.905 142.040 1.00 0.00 H ATOM 39803 H2 WAT 2531 14.152 141.700 143.446 1.00 0.00 H TER 39805 WAT 2531 ATOM 39805 O WAT 2532 7.459 50.509 120.849 1.00 0.00 O ATOM 39806 H1 WAT 2532 7.277 51.384 121.194 1.00 0.00 H ATOM 39807 H2 WAT 2532 8.374 50.547 120.573 1.00 0.00 H TER 39809 WAT 2532 ATOM 39809 O WAT 2533 106.140 63.183 99.183 1.00 0.00 O ATOM 39810 H1 WAT 2533 106.573 63.011 98.347 1.00 0.00 H ATOM 39811 H2 WAT 2533 105.210 63.041 99.004 1.00 0.00 H TER 39813 WAT 2533 ATOM 39813 O WAT 2534 56.493 86.790 21.073 1.00 0.00 O ATOM 39814 H1 WAT 2534 57.204 87.213 20.591 1.00 0.00 H ATOM 39815 H2 WAT 2534 56.367 87.341 21.846 1.00 0.00 H TER 39817 WAT 2534 ATOM 39817 O WAT 2535 18.850 45.529 85.986 1.00 0.00 O ATOM 39818 H1 WAT 2535 18.184 45.148 86.558 1.00 0.00 H ATOM 39819 H2 WAT 2535 19.603 45.674 86.558 1.00 0.00 H TER 39821 WAT 2535 ATOM 39821 O WAT 2536 133.423 9.711 116.059 1.00 0.00 O ATOM 39822 H1 WAT 2536 133.304 10.532 116.537 1.00 0.00 H ATOM 39823 H2 WAT 2536 132.922 9.068 116.560 1.00 0.00 H TER 39825 WAT 2536 ATOM 39825 O WAT 2537 55.145 33.617 136.917 1.00 0.00 O ATOM 39826 H1 WAT 2537 54.942 34.530 137.123 1.00 0.00 H ATOM 39827 H2 WAT 2537 55.422 33.239 137.752 1.00 0.00 H TER 39829 WAT 2537 ATOM 39829 O WAT 2538 120.747 4.122 10.974 1.00 0.00 O ATOM 39830 H1 WAT 2538 121.052 4.723 10.294 1.00 0.00 H ATOM 39831 H2 WAT 2538 119.962 4.539 11.328 1.00 0.00 H TER 39833 WAT 2538 ATOM 39833 O WAT 2539 27.069 5.490 72.313 1.00 0.00 O ATOM 39834 H1 WAT 2539 27.226 4.581 72.055 1.00 0.00 H ATOM 39835 H2 WAT 2539 27.000 5.966 71.486 1.00 0.00 H TER 39837 WAT 2539 ATOM 39837 O WAT 2540 109.280 31.907 108.405 1.00 0.00 O ATOM 39838 H1 WAT 2540 108.923 32.351 107.636 1.00 0.00 H ATOM 39839 H2 WAT 2540 109.032 30.990 108.287 1.00 0.00 H TER 39841 WAT 2540 ATOM 39841 O WAT 2541 75.335 130.447 59.853 1.00 0.00 O ATOM 39842 H1 WAT 2541 74.770 130.797 59.164 1.00 0.00 H ATOM 39843 H2 WAT 2541 75.009 129.560 60.004 1.00 0.00 H TER 39845 WAT 2541 ATOM 39845 O WAT 2542 89.166 100.114 99.014 1.00 0.00 O ATOM 39846 H1 WAT 2542 89.380 99.393 98.422 1.00 0.00 H ATOM 39847 H2 WAT 2542 88.879 100.821 98.437 1.00 0.00 H TER 39849 WAT 2542 ATOM 39849 O WAT 2543 35.901 94.346 14.998 1.00 0.00 O ATOM 39850 H1 WAT 2543 36.300 93.735 14.378 1.00 0.00 H ATOM 39851 H2 WAT 2543 36.514 94.374 15.734 1.00 0.00 H TER 39853 WAT 2543 ATOM 39853 O WAT 2544 118.525 119.303 123.742 1.00 0.00 O ATOM 39854 H1 WAT 2544 118.013 119.340 124.550 1.00 0.00 H ATOM 39855 H2 WAT 2544 117.948 119.676 123.076 1.00 0.00 H TER 39857 WAT 2544 ATOM 39857 O WAT 2545 94.258 44.223 128.130 1.00 0.00 O ATOM 39858 H1 WAT 2545 94.855 44.846 127.714 1.00 0.00 H ATOM 39859 H2 WAT 2545 94.317 43.436 127.588 1.00 0.00 H TER 39861 WAT 2545 ATOM 39861 O WAT 2546 91.120 58.225 118.055 1.00 0.00 O ATOM 39862 H1 WAT 2546 90.874 59.148 118.125 1.00 0.00 H ATOM 39863 H2 WAT 2546 91.469 58.138 117.168 1.00 0.00 H TER 39865 WAT 2546 ATOM 39865 O WAT 2547 28.288 43.367 82.476 1.00 0.00 O ATOM 39866 H1 WAT 2547 27.490 42.973 82.124 1.00 0.00 H ATOM 39867 H2 WAT 2547 28.189 43.303 83.426 1.00 0.00 H TER 39869 WAT 2547 ATOM 39869 O WAT 2548 133.968 75.163 60.516 1.00 0.00 O ATOM 39870 H1 WAT 2548 134.541 74.808 61.196 1.00 0.00 H ATOM 39871 H2 WAT 2548 133.665 75.999 60.870 1.00 0.00 H TER 39873 WAT 2548 ATOM 39873 O WAT 2549 23.748 137.668 89.612 1.00 0.00 O ATOM 39874 H1 WAT 2549 24.430 137.388 90.223 1.00 0.00 H ATOM 39875 H2 WAT 2549 22.978 137.155 89.861 1.00 0.00 H TER 39877 WAT 2549 ATOM 39877 O WAT 2550 14.197 119.724 15.756 1.00 0.00 O ATOM 39878 H1 WAT 2550 14.675 120.153 15.046 1.00 0.00 H ATOM 39879 H2 WAT 2550 14.619 118.870 15.848 1.00 0.00 H TER 39881 WAT 2550 ATOM 39881 O WAT 2551 47.292 121.706 151.646 1.00 0.00 O ATOM 39882 H1 WAT 2551 47.016 122.005 152.512 1.00 0.00 H ATOM 39883 H2 WAT 2551 46.480 121.446 151.211 1.00 0.00 H TER 39885 WAT 2551 ATOM 39885 O WAT 2552 126.775 6.992 130.359 1.00 0.00 O ATOM 39886 H1 WAT 2552 126.131 6.895 129.658 1.00 0.00 H ATOM 39887 H2 WAT 2552 127.091 7.892 130.270 1.00 0.00 H TER 39889 WAT 2552 ATOM 39889 O WAT 2553 109.249 112.068 76.348 1.00 0.00 O ATOM 39890 H1 WAT 2553 109.762 111.929 77.143 1.00 0.00 H ATOM 39891 H2 WAT 2553 109.658 112.824 75.927 1.00 0.00 H TER 39893 WAT 2553 ATOM 39893 O WAT 2554 48.239 86.577 28.866 1.00 0.00 O ATOM 39894 H1 WAT 2554 48.206 85.627 28.751 1.00 0.00 H ATOM 39895 H2 WAT 2554 47.321 86.846 28.904 1.00 0.00 H TER 39897 WAT 2554 ATOM 39897 O WAT 2555 106.637 75.803 9.870 1.00 0.00 O ATOM 39898 H1 WAT 2555 107.135 76.619 9.925 1.00 0.00 H ATOM 39899 H2 WAT 2555 105.857 75.963 10.402 1.00 0.00 H TER 39901 WAT 2555 ATOM 39901 O WAT 2556 26.406 101.564 11.075 1.00 0.00 O ATOM 39902 H1 WAT 2556 27.324 101.388 10.867 1.00 0.00 H ATOM 39903 H2 WAT 2556 25.946 101.450 10.243 1.00 0.00 H TER 39905 WAT 2556 ATOM 39905 O WAT 2557 24.786 46.026 88.854 1.00 0.00 O ATOM 39906 H1 WAT 2557 25.062 45.756 87.978 1.00 0.00 H ATOM 39907 H2 WAT 2557 24.844 46.982 88.840 1.00 0.00 H TER 39909 WAT 2557 ATOM 39909 O WAT 2558 27.481 110.789 10.429 1.00 0.00 O ATOM 39910 H1 WAT 2558 26.880 110.059 10.285 1.00 0.00 H ATOM 39911 H2 WAT 2558 28.081 110.756 9.683 1.00 0.00 H TER 39913 WAT 2558 ATOM 39913 O WAT 2559 113.294 20.688 62.902 1.00 0.00 O ATOM 39914 H1 WAT 2559 113.852 20.580 63.672 1.00 0.00 H ATOM 39915 H2 WAT 2559 113.819 21.212 62.297 1.00 0.00 H TER 39917 WAT 2559 ATOM 39917 O WAT 2560 59.890 33.517 114.305 1.00 0.00 O ATOM 39918 H1 WAT 2560 60.156 33.898 115.141 1.00 0.00 H ATOM 39919 H2 WAT 2560 59.304 34.169 113.920 1.00 0.00 H TER 39921 WAT 2560 ATOM 39921 O WAT 2561 2.706 60.596 143.665 1.00 0.00 O ATOM 39922 H1 WAT 2561 2.706 59.642 143.744 1.00 0.00 H ATOM 39923 H2 WAT 2561 3.406 60.785 143.041 1.00 0.00 H TER 39925 WAT 2561 ATOM 39925 O WAT 2562 66.146 116.110 66.855 1.00 0.00 O ATOM 39926 H1 WAT 2562 66.143 115.348 66.275 1.00 0.00 H ATOM 39927 H2 WAT 2562 66.671 116.762 66.391 1.00 0.00 H TER 39929 WAT 2562 ATOM 39929 O WAT 2563 88.804 71.459 23.944 1.00 0.00 O ATOM 39930 H1 WAT 2563 89.711 71.507 24.246 1.00 0.00 H ATOM 39931 H2 WAT 2563 88.692 70.549 23.666 1.00 0.00 H TER 39933 WAT 2563 ATOM 39933 O WAT 2564 60.865 8.735 67.521 1.00 0.00 O ATOM 39934 H1 WAT 2564 60.052 9.221 67.661 1.00 0.00 H ATOM 39935 H2 WAT 2564 61.130 8.456 68.398 1.00 0.00 H TER 39937 WAT 2564 ATOM 39937 O WAT 2565 15.424 101.167 18.789 1.00 0.00 O ATOM 39938 H1 WAT 2565 16.301 101.000 19.134 1.00 0.00 H ATOM 39939 H2 WAT 2565 14.861 100.551 19.257 1.00 0.00 H TER 39941 WAT 2565 ATOM 39941 O WAT 2566 98.163 64.116 111.303 1.00 0.00 O ATOM 39942 H1 WAT 2566 99.119 64.079 111.255 1.00 0.00 H ATOM 39943 H2 WAT 2566 97.866 63.478 110.654 1.00 0.00 H TER 39945 WAT 2566 ATOM 39945 O WAT 2567 25.479 131.960 121.472 1.00 0.00 O ATOM 39946 H1 WAT 2567 25.835 132.370 122.260 1.00 0.00 H ATOM 39947 H2 WAT 2567 26.066 132.241 120.770 1.00 0.00 H TER 39949 WAT 2567 ATOM 39949 O WAT 2568 64.424 12.691 71.015 1.00 0.00 O ATOM 39950 H1 WAT 2568 65.130 12.157 71.380 1.00 0.00 H ATOM 39951 H2 WAT 2568 64.631 13.583 71.292 1.00 0.00 H TER 39953 WAT 2568 ATOM 39953 O WAT 2569 49.470 44.607 102.063 1.00 0.00 O ATOM 39954 H1 WAT 2569 49.024 44.148 101.351 1.00 0.00 H ATOM 39955 H2 WAT 2569 49.910 43.915 102.556 1.00 0.00 H TER 39957 WAT 2569 ATOM 39957 O WAT 2570 139.753 125.914 23.803 1.00 0.00 O ATOM 39958 H1 WAT 2570 139.592 125.857 22.861 1.00 0.00 H ATOM 39959 H2 WAT 2570 140.696 125.775 23.893 1.00 0.00 H TER 39961 WAT 2570 ATOM 39961 O WAT 2571 131.112 20.587 15.928 1.00 0.00 O ATOM 39962 H1 WAT 2571 130.256 21.004 16.029 1.00 0.00 H ATOM 39963 H2 WAT 2571 130.924 19.762 15.481 1.00 0.00 H TER 39965 WAT 2571 ATOM 39965 O WAT 2572 128.645 108.693 130.770 1.00 0.00 O ATOM 39966 H1 WAT 2572 128.288 109.471 131.198 1.00 0.00 H ATOM 39967 H2 WAT 2572 128.765 108.063 131.481 1.00 0.00 H TER 39969 WAT 2572 ATOM 39969 O WAT 2573 18.431 91.022 89.859 1.00 0.00 O ATOM 39970 H1 WAT 2573 18.341 91.869 89.422 1.00 0.00 H ATOM 39971 H2 WAT 2573 18.674 90.416 89.159 1.00 0.00 H TER 39973 WAT 2573 ATOM 39973 O WAT 2574 107.751 13.606 69.421 1.00 0.00 O ATOM 39974 H1 WAT 2574 107.146 12.965 69.047 1.00 0.00 H ATOM 39975 H2 WAT 2574 108.264 13.915 68.674 1.00 0.00 H TER 39977 WAT 2574 ATOM 39977 O WAT 2575 1.331 59.506 86.961 1.00 0.00 O ATOM 39978 H1 WAT 2575 0.597 58.894 87.020 1.00 0.00 H ATOM 39979 H2 WAT 2575 1.685 59.542 87.850 1.00 0.00 H TER 39981 WAT 2575 ATOM 39981 O WAT 2576 9.870 29.848 0.357 1.00 0.00 O ATOM 39982 H1 WAT 2576 9.763 29.187 1.040 1.00 0.00 H ATOM 39983 H2 WAT 2576 10.098 30.648 0.831 1.00 0.00 H TER 39985 WAT 2576 ATOM 39985 O WAT 2577 141.446 92.898 17.507 1.00 0.00 O ATOM 39986 H1 WAT 2577 141.225 92.628 18.398 1.00 0.00 H ATOM 39987 H2 WAT 2577 141.027 93.753 17.404 1.00 0.00 H TER 39989 WAT 2577 ATOM 39989 O WAT 2578 26.538 13.351 1.038 1.00 0.00 O ATOM 39990 H1 WAT 2578 26.938 12.758 0.401 1.00 0.00 H ATOM 39991 H2 WAT 2578 27.118 14.112 1.054 1.00 0.00 H TER 39993 WAT 2578 ATOM 39993 O WAT 2579 80.317 37.584 141.148 1.00 0.00 O ATOM 39994 H1 WAT 2579 80.043 38.322 140.604 1.00 0.00 H ATOM 39995 H2 WAT 2579 79.531 37.042 141.230 1.00 0.00 H TER 39997 WAT 2579 ATOM 39997 O WAT 2580 139.411 121.515 68.722 1.00 0.00 O ATOM 39998 H1 WAT 2580 138.797 121.035 68.166 1.00 0.00 H ATOM 39999 H2 WAT 2580 140.203 121.594 68.190 1.00 0.00 H TER 40001 WAT 2580 ATOM 40001 O WAT 2581 6.338 100.304 127.523 1.00 0.00 O ATOM 40002 H1 WAT 2581 6.493 100.215 128.463 1.00 0.00 H ATOM 40003 H2 WAT 2581 7.194 100.148 127.123 1.00 0.00 H TER 40005 WAT 2581 ATOM 40005 O WAT 2582 106.776 144.280 78.977 1.00 0.00 O ATOM 40006 H1 WAT 2582 107.486 143.688 79.223 1.00 0.00 H ATOM 40007 H2 WAT 2582 106.176 143.736 78.468 1.00 0.00 H TER 40009 WAT 2582 ATOM 40009 O WAT 2583 15.964 97.408 145.723 1.00 0.00 O ATOM 40010 H1 WAT 2583 16.101 97.921 144.926 1.00 0.00 H ATOM 40011 H2 WAT 2583 15.046 97.141 145.680 1.00 0.00 H TER 40013 WAT 2583 ATOM 40013 O WAT 2584 144.275 34.787 21.084 1.00 0.00 O ATOM 40014 H1 WAT 2584 144.464 34.295 21.883 1.00 0.00 H ATOM 40015 H2 WAT 2584 143.594 35.409 21.341 1.00 0.00 H TER 40017 WAT 2584 ATOM 40017 O WAT 2585 138.783 6.855 120.112 1.00 0.00 O ATOM 40018 H1 WAT 2585 138.918 7.651 120.626 1.00 0.00 H ATOM 40019 H2 WAT 2585 137.832 6.751 120.077 1.00 0.00 H TER 40021 WAT 2585 ATOM 40021 O WAT 2586 18.264 69.552 105.861 1.00 0.00 O ATOM 40022 H1 WAT 2586 19.119 69.133 105.956 1.00 0.00 H ATOM 40023 H2 WAT 2586 18.117 69.992 106.698 1.00 0.00 H TER 40025 WAT 2586 ATOM 40025 O WAT 2587 97.732 143.549 120.519 1.00 0.00 O ATOM 40026 H1 WAT 2587 98.259 143.006 119.932 1.00 0.00 H ATOM 40027 H2 WAT 2587 96.837 143.457 120.191 1.00 0.00 H TER 40029 WAT 2587 ATOM 40029 O WAT 2588 100.632 101.018 90.954 1.00 0.00 O ATOM 40030 H1 WAT 2588 100.589 100.782 90.027 1.00 0.00 H ATOM 40031 H2 WAT 2588 101.480 101.451 91.051 1.00 0.00 H TER 40033 WAT 2588 ATOM 40033 O WAT 2589 78.321 139.447 150.589 1.00 0.00 O ATOM 40034 H1 WAT 2589 79.180 139.864 150.529 1.00 0.00 H ATOM 40035 H2 WAT 2589 77.912 139.617 149.741 1.00 0.00 H TER 40037 WAT 2589 ATOM 40037 O WAT 2590 20.635 30.330 3.662 1.00 0.00 O ATOM 40038 H1 WAT 2590 21.556 30.223 3.425 1.00 0.00 H ATOM 40039 H2 WAT 2590 20.283 30.920 2.995 1.00 0.00 H TER 40041 WAT 2590 ATOM 40041 O WAT 2591 43.682 8.558 85.423 1.00 0.00 O ATOM 40042 H1 WAT 2591 43.870 9.155 86.148 1.00 0.00 H ATOM 40043 H2 WAT 2591 43.721 9.110 84.642 1.00 0.00 H TER 40045 WAT 2591 ATOM 40045 O WAT 2592 56.475 81.259 77.830 1.00 0.00 O ATOM 40046 H1 WAT 2592 56.266 82.183 77.960 1.00 0.00 H ATOM 40047 H2 WAT 2592 55.641 80.856 77.587 1.00 0.00 H TER 40049 WAT 2592 ATOM 40049 O WAT 2593 51.760 14.862 132.496 1.00 0.00 O ATOM 40050 H1 WAT 2593 51.629 15.115 131.582 1.00 0.00 H ATOM 40051 H2 WAT 2593 51.132 15.395 132.984 1.00 0.00 H TER 40053 WAT 2593 ATOM 40053 O WAT 2594 64.906 20.590 91.620 1.00 0.00 O ATOM 40054 H1 WAT 2594 64.587 21.274 91.031 1.00 0.00 H ATOM 40055 H2 WAT 2594 64.555 20.831 92.478 1.00 0.00 H TER 40057 WAT 2594 ATOM 40057 O WAT 2595 120.022 77.980 90.188 1.00 0.00 O ATOM 40058 H1 WAT 2595 119.796 77.066 90.356 1.00 0.00 H ATOM 40059 H2 WAT 2595 119.477 78.478 90.798 1.00 0.00 H TER 40061 WAT 2595 ATOM 40061 O WAT 2596 35.246 13.960 8.092 1.00 0.00 O ATOM 40062 H1 WAT 2596 36.060 13.613 7.726 1.00 0.00 H ATOM 40063 H2 WAT 2596 35.479 14.834 8.406 1.00 0.00 H TER 40065 WAT 2596 ATOM 40065 O WAT 2597 16.008 139.817 115.745 1.00 0.00 O ATOM 40066 H1 WAT 2597 16.167 138.909 115.488 1.00 0.00 H ATOM 40067 H2 WAT 2597 16.523 139.933 116.544 1.00 0.00 H TER 40069 WAT 2597 ATOM 40069 O WAT 2598 117.920 117.987 22.909 1.00 0.00 O ATOM 40070 H1 WAT 2598 117.814 118.320 22.018 1.00 0.00 H ATOM 40071 H2 WAT 2598 117.083 118.171 23.335 1.00 0.00 H TER 40073 WAT 2598 ATOM 40073 O WAT 2599 145.583 87.503 142.828 1.00 0.00 O ATOM 40074 H1 WAT 2599 145.934 86.759 143.317 1.00 0.00 H ATOM 40075 H2 WAT 2599 144.914 87.122 142.260 1.00 0.00 H TER 40077 WAT 2599 ATOM 40077 O WAT 2600 59.937 36.336 72.384 1.00 0.00 O ATOM 40078 H1 WAT 2600 59.100 35.894 72.242 1.00 0.00 H ATOM 40079 H2 WAT 2600 59.732 37.268 72.311 1.00 0.00 H TER 40081 WAT 2600 ATOM 40081 O WAT 2601 65.443 99.072 85.678 1.00 0.00 O ATOM 40082 H1 WAT 2601 66.257 98.698 85.342 1.00 0.00 H ATOM 40083 H2 WAT 2601 65.648 99.324 86.578 1.00 0.00 H TER 40085 WAT 2601 ATOM 40085 O WAT 2602 39.005 36.156 121.122 1.00 0.00 O ATOM 40086 H1 WAT 2602 38.758 35.288 120.803 1.00 0.00 H ATOM 40087 H2 WAT 2602 38.183 36.647 121.141 1.00 0.00 H TER 40089 WAT 2602 ATOM 40089 O WAT 2603 36.535 18.757 85.193 1.00 0.00 O ATOM 40090 H1 WAT 2603 36.849 17.938 85.577 1.00 0.00 H ATOM 40091 H2 WAT 2603 35.778 18.998 85.727 1.00 0.00 H TER 40093 WAT 2603 ATOM 40093 O WAT 2604 34.650 42.760 107.076 1.00 0.00 O ATOM 40094 H1 WAT 2604 34.459 43.051 107.968 1.00 0.00 H ATOM 40095 H2 WAT 2604 35.162 41.960 107.188 1.00 0.00 H TER 40097 WAT 2604 ATOM 40097 O WAT 2605 54.688 74.668 157.848 1.00 0.00 O ATOM 40098 H1 WAT 2605 54.096 75.374 158.108 1.00 0.00 H ATOM 40099 H2 WAT 2605 54.521 74.548 156.913 1.00 0.00 H TER 40101 WAT 2605 ATOM 40101 O WAT 2606 99.905 86.677 91.999 1.00 0.00 O ATOM 40102 H1 WAT 2606 99.233 87.235 91.608 1.00 0.00 H ATOM 40103 H2 WAT 2606 99.690 85.795 91.695 1.00 0.00 H TER 40105 WAT 2606 ATOM 40105 O WAT 2607 97.975 19.069 132.105 1.00 0.00 O ATOM 40106 H1 WAT 2607 97.520 19.276 132.922 1.00 0.00 H ATOM 40107 H2 WAT 2607 97.356 19.315 131.418 1.00 0.00 H TER 40109 WAT 2607 ATOM 40109 O WAT 2608 6.664 121.920 112.957 1.00 0.00 O ATOM 40110 H1 WAT 2608 6.657 121.639 113.872 1.00 0.00 H ATOM 40111 H2 WAT 2608 7.046 122.798 112.979 1.00 0.00 H TER 40113 WAT 2608 ATOM 40113 O WAT 2609 31.663 130.388 5.385 1.00 0.00 O ATOM 40114 H1 WAT 2609 31.215 131.233 5.342 1.00 0.00 H ATOM 40115 H2 WAT 2609 31.735 130.202 6.321 1.00 0.00 H TER 40117 WAT 2609 ATOM 40117 O WAT 2610 79.300 36.037 123.407 1.00 0.00 O ATOM 40118 H1 WAT 2610 79.382 36.818 122.860 1.00 0.00 H ATOM 40119 H2 WAT 2610 78.820 36.336 124.180 1.00 0.00 H TER 40121 WAT 2610 ATOM 40121 O WAT 2611 32.086 76.225 69.095 1.00 0.00 O ATOM 40122 H1 WAT 2611 31.992 76.962 68.490 1.00 0.00 H ATOM 40123 H2 WAT 2611 32.179 76.633 69.956 1.00 0.00 H TER 40125 WAT 2611 ATOM 40125 O WAT 2612 143.826 63.376 70.589 1.00 0.00 O ATOM 40126 H1 WAT 2612 144.073 62.743 69.915 1.00 0.00 H ATOM 40127 H2 WAT 2612 142.982 63.720 70.298 1.00 0.00 H TER 40129 WAT 2612 ATOM 40129 O WAT 2613 132.814 71.369 8.765 1.00 0.00 O ATOM 40130 H1 WAT 2613 133.184 70.861 9.487 1.00 0.00 H ATOM 40131 H2 WAT 2613 132.318 72.067 9.193 1.00 0.00 H TER 40133 WAT 2613 ATOM 40133 O WAT 2614 58.841 8.272 150.183 1.00 0.00 O ATOM 40134 H1 WAT 2614 58.285 7.612 150.597 1.00 0.00 H ATOM 40135 H2 WAT 2614 58.306 8.624 149.471 1.00 0.00 H TER 40137 WAT 2614 ATOM 40137 O WAT 2615 83.830 127.941 103.047 1.00 0.00 O ATOM 40138 H1 WAT 2615 84.495 127.735 102.391 1.00 0.00 H ATOM 40139 H2 WAT 2615 84.327 128.268 103.797 1.00 0.00 H TER 40141 WAT 2615 ATOM 40141 O WAT 2616 109.479 32.265 87.107 1.00 0.00 O ATOM 40142 H1 WAT 2616 110.354 32.495 86.794 1.00 0.00 H ATOM 40143 H2 WAT 2616 108.887 32.795 86.573 1.00 0.00 H TER 40145 WAT 2616 ATOM 40145 O WAT 2617 100.337 77.260 20.501 1.00 0.00 O ATOM 40146 H1 WAT 2617 100.290 76.768 19.681 1.00 0.00 H ATOM 40147 H2 WAT 2617 99.429 77.317 20.799 1.00 0.00 H TER 40149 WAT 2617 ATOM 40149 O WAT 2618 76.316 82.794 14.718 1.00 0.00 O ATOM 40150 H1 WAT 2618 75.695 83.448 15.039 1.00 0.00 H ATOM 40151 H2 WAT 2618 76.150 82.748 13.776 1.00 0.00 H TER 40153 WAT 2618 ATOM 40153 O WAT 2619 82.290 33.166 65.727 1.00 0.00 O ATOM 40154 H1 WAT 2619 82.170 32.484 65.067 1.00 0.00 H ATOM 40155 H2 WAT 2619 82.010 33.972 65.292 1.00 0.00 H TER 40157 WAT 2619 ATOM 40157 O WAT 2620 94.690 12.179 100.960 1.00 0.00 O ATOM 40158 H1 WAT 2620 93.754 12.326 101.090 1.00 0.00 H ATOM 40159 H2 WAT 2620 95.051 13.052 100.806 1.00 0.00 H TER 40161 WAT 2620 ATOM 40161 O WAT 2621 11.551 122.519 113.447 1.00 0.00 O ATOM 40162 H1 WAT 2621 11.919 121.843 112.878 1.00 0.00 H ATOM 40163 H2 WAT 2621 11.472 122.097 114.302 1.00 0.00 H TER 40165 WAT 2621 ATOM 40165 O WAT 2622 116.763 134.899 113.941 1.00 0.00 O ATOM 40166 H1 WAT 2622 116.923 134.021 113.596 1.00 0.00 H ATOM 40167 H2 WAT 2622 117.578 135.136 114.383 1.00 0.00 H TER 40169 WAT 2622 ATOM 40169 O WAT 2623 144.487 79.950 54.153 1.00 0.00 O ATOM 40170 H1 WAT 2623 145.442 79.992 54.110 1.00 0.00 H ATOM 40171 H2 WAT 2623 144.198 80.839 53.949 1.00 0.00 H TER 40173 WAT 2623 ATOM 40173 O WAT 2624 61.122 84.374 126.029 1.00 0.00 O ATOM 40174 H1 WAT 2624 61.430 83.968 126.839 1.00 0.00 H ATOM 40175 H2 WAT 2624 61.891 84.828 125.682 1.00 0.00 H TER 40177 WAT 2624 ATOM 40177 O WAT 2625 51.809 104.250 137.853 1.00 0.00 O ATOM 40178 H1 WAT 2625 51.833 103.341 137.555 1.00 0.00 H ATOM 40179 H2 WAT 2625 52.677 104.402 138.229 1.00 0.00 H TER 40181 WAT 2625 ATOM 40181 O WAT 2626 64.578 118.686 109.446 1.00 0.00 O ATOM 40182 H1 WAT 2626 63.752 118.235 109.625 1.00 0.00 H ATOM 40183 H2 WAT 2626 65.013 118.139 108.792 1.00 0.00 H TER 40185 WAT 2626 ATOM 40185 O WAT 2627 51.601 140.706 101.945 1.00 0.00 O ATOM 40186 H1 WAT 2627 51.565 141.615 102.242 1.00 0.00 H ATOM 40187 H2 WAT 2627 52.181 140.272 102.572 1.00 0.00 H TER 40189 WAT 2627 ATOM 40189 O WAT 2628 64.263 56.609 20.036 1.00 0.00 O ATOM 40190 H1 WAT 2628 63.748 57.249 19.545 1.00 0.00 H ATOM 40191 H2 WAT 2628 64.291 55.838 19.469 1.00 0.00 H TER 40193 WAT 2628 ATOM 40193 O WAT 2629 19.854 5.030 99.680 1.00 0.00 O ATOM 40194 H1 WAT 2629 20.431 5.634 99.212 1.00 0.00 H ATOM 40195 H2 WAT 2629 19.225 5.597 100.126 1.00 0.00 H TER 40197 WAT 2629 ATOM 40197 O WAT 2630 18.607 44.721 127.960 1.00 0.00 O ATOM 40198 H1 WAT 2630 18.965 45.582 127.741 1.00 0.00 H ATOM 40199 H2 WAT 2630 17.693 44.764 127.679 1.00 0.00 H TER 40201 WAT 2630 ATOM 40201 O WAT 2631 114.947 28.646 17.627 1.00 0.00 O ATOM 40202 H1 WAT 2631 115.626 28.515 16.965 1.00 0.00 H ATOM 40203 H2 WAT 2631 114.251 28.037 17.379 1.00 0.00 H TER 40205 WAT 2631 ATOM 40205 O WAT 2632 30.728 30.720 150.096 1.00 0.00 O ATOM 40206 H1 WAT 2632 30.980 29.830 149.850 1.00 0.00 H ATOM 40207 H2 WAT 2632 30.268 30.618 150.930 1.00 0.00 H TER 40209 WAT 2632 ATOM 40209 O WAT 2633 140.230 46.499 139.203 1.00 0.00 O ATOM 40210 H1 WAT 2633 140.189 45.935 138.431 1.00 0.00 H ATOM 40211 H2 WAT 2633 139.318 46.591 139.481 1.00 0.00 H TER 40213 WAT 2633 ATOM 40213 O WAT 2634 18.567 15.014 5.558 1.00 0.00 O ATOM 40214 H1 WAT 2634 19.512 15.154 5.505 1.00 0.00 H ATOM 40215 H2 WAT 2634 18.365 14.460 4.803 1.00 0.00 H TER 40217 WAT 2634 ATOM 40217 O WAT 2635 -0.031 67.446 53.653 1.00 0.00 O ATOM 40218 H1 WAT 2635 0.919 67.535 53.734 1.00 0.00 H ATOM 40219 H2 WAT 2635 -0.159 66.574 53.281 1.00 0.00 H TER 40221 WAT 2635 ATOM 40221 O WAT 2636 70.690 19.425 16.325 1.00 0.00 O ATOM 40222 H1 WAT 2636 69.914 19.985 16.319 1.00 0.00 H ATOM 40223 H2 WAT 2636 71.267 19.808 15.664 1.00 0.00 H TER 40225 WAT 2636 ATOM 40225 O WAT 2637 140.338 129.644 144.546 1.00 0.00 O ATOM 40226 H1 WAT 2637 141.055 130.169 144.190 1.00 0.00 H ATOM 40227 H2 WAT 2637 139.545 130.114 144.288 1.00 0.00 H TER 40229 WAT 2637 ATOM 40229 O WAT 2638 124.397 127.920 128.653 1.00 0.00 O ATOM 40230 H1 WAT 2638 124.469 128.512 129.402 1.00 0.00 H ATOM 40231 H2 WAT 2638 123.650 128.251 128.156 1.00 0.00 H TER 40233 WAT 2638 ATOM 40233 O WAT 2639 113.890 126.004 72.107 1.00 0.00 O ATOM 40234 H1 WAT 2639 113.369 126.022 72.909 1.00 0.00 H ATOM 40235 H2 WAT 2639 113.255 126.144 71.405 1.00 0.00 H TER 40237 WAT 2639 ATOM 40237 O WAT 2640 63.672 143.206 54.768 1.00 0.00 O ATOM 40238 H1 WAT 2640 63.044 142.513 54.969 1.00 0.00 H ATOM 40239 H2 WAT 2640 63.131 143.946 54.490 1.00 0.00 H TER 40241 WAT 2640 ATOM 40241 O WAT 2641 122.512 33.337 97.084 1.00 0.00 O ATOM 40242 H1 WAT 2641 122.906 33.868 97.776 1.00 0.00 H ATOM 40243 H2 WAT 2641 122.132 33.975 96.479 1.00 0.00 H TER 40245 WAT 2641 ATOM 40245 O WAT 2642 101.589 120.441 119.214 1.00 0.00 O ATOM 40246 H1 WAT 2642 102.426 120.878 119.370 1.00 0.00 H ATOM 40247 H2 WAT 2642 101.641 119.634 119.727 1.00 0.00 H TER 40249 WAT 2642 ATOM 40249 O WAT 2643 9.203 132.410 10.245 1.00 0.00 O ATOM 40250 H1 WAT 2643 8.263 132.523 10.106 1.00 0.00 H ATOM 40251 H2 WAT 2643 9.610 132.864 9.507 1.00 0.00 H TER 40253 WAT 2643 ATOM 40253 O WAT 2644 92.079 82.212 95.240 1.00 0.00 O ATOM 40254 H1 WAT 2644 91.717 83.059 94.982 1.00 0.00 H ATOM 40255 H2 WAT 2644 93.016 82.286 95.059 1.00 0.00 H TER 40257 WAT 2644 ATOM 40257 O WAT 2645 40.574 78.305 154.696 1.00 0.00 O ATOM 40258 H1 WAT 2645 41.213 78.870 155.130 1.00 0.00 H ATOM 40259 H2 WAT 2645 39.964 78.056 155.391 1.00 0.00 H TER 40261 WAT 2645 ATOM 40261 O WAT 2646 54.992 117.628 106.812 1.00 0.00 O ATOM 40262 H1 WAT 2646 54.557 116.776 106.794 1.00 0.00 H ATOM 40263 H2 WAT 2646 55.697 117.550 106.169 1.00 0.00 H TER 40265 WAT 2646 ATOM 40265 O WAT 2647 16.876 29.700 59.745 1.00 0.00 O ATOM 40266 H1 WAT 2647 17.406 29.246 60.399 1.00 0.00 H ATOM 40267 H2 WAT 2647 17.165 29.337 58.908 1.00 0.00 H TER 40269 WAT 2647 ATOM 40269 O WAT 2648 119.950 74.496 155.823 1.00 0.00 O ATOM 40270 H1 WAT 2648 119.991 74.931 156.675 1.00 0.00 H ATOM 40271 H2 WAT 2648 120.593 74.959 155.287 1.00 0.00 H TER 40273 WAT 2648 ATOM 40273 O WAT 2649 82.860 40.181 72.296 1.00 0.00 O ATOM 40274 H1 WAT 2649 83.040 39.252 72.156 1.00 0.00 H ATOM 40275 H2 WAT 2649 83.595 40.490 72.827 1.00 0.00 H TER 40277 WAT 2649 ATOM 40277 O WAT 2650 87.520 99.386 0.381 1.00 0.00 O ATOM 40278 H1 WAT 2650 86.986 100.180 0.346 1.00 0.00 H ATOM 40279 H2 WAT 2650 88.186 99.574 1.041 1.00 0.00 H TER 40281 WAT 2650 ATOM 40281 O WAT 2651 103.024 106.559 0.950 1.00 0.00 O ATOM 40282 H1 WAT 2651 102.691 106.360 0.075 1.00 0.00 H ATOM 40283 H2 WAT 2651 102.443 107.246 1.277 1.00 0.00 H TER 40285 WAT 2651 ATOM 40285 O WAT 2652 126.281 39.435 73.051 1.00 0.00 O ATOM 40286 H1 WAT 2652 126.453 38.834 73.775 1.00 0.00 H ATOM 40287 H2 WAT 2652 125.384 39.237 72.782 1.00 0.00 H TER 40289 WAT 2652 ATOM 40289 O WAT 2653 15.851 74.502 10.808 1.00 0.00 O ATOM 40290 H1 WAT 2653 16.132 75.416 10.853 1.00 0.00 H ATOM 40291 H2 WAT 2653 16.652 73.998 10.951 1.00 0.00 H TER 40293 WAT 2653 ATOM 40293 O WAT 2654 0.742 56.502 114.407 1.00 0.00 O ATOM 40294 H1 WAT 2654 1.332 56.720 115.128 1.00 0.00 H ATOM 40295 H2 WAT 2654 0.207 55.783 114.743 1.00 0.00 H TER 40297 WAT 2654 ATOM 40297 O WAT 2655 4.931 76.510 74.163 1.00 0.00 O ATOM 40298 H1 WAT 2655 4.038 76.248 73.936 1.00 0.00 H ATOM 40299 H2 WAT 2655 5.398 75.683 74.286 1.00 0.00 H TER 40301 WAT 2655 ATOM 40301 O WAT 2656 132.256 17.420 98.627 1.00 0.00 O ATOM 40302 H1 WAT 2656 132.205 17.795 97.748 1.00 0.00 H ATOM 40303 H2 WAT 2656 132.479 16.500 98.482 1.00 0.00 H TER 40305 WAT 2656 ATOM 40305 O WAT 2657 62.285 74.287 71.630 1.00 0.00 O ATOM 40306 H1 WAT 2657 62.178 73.350 71.792 1.00 0.00 H ATOM 40307 H2 WAT 2657 62.717 74.619 72.417 1.00 0.00 H TER 40309 WAT 2657 ATOM 40309 O WAT 2658 94.367 35.403 105.909 1.00 0.00 O ATOM 40310 H1 WAT 2658 94.984 34.678 105.806 1.00 0.00 H ATOM 40311 H2 WAT 2658 94.482 35.929 105.117 1.00 0.00 H TER 40313 WAT 2658 ATOM 40313 O WAT 2659 88.487 120.480 76.709 1.00 0.00 O ATOM 40314 H1 WAT 2659 89.127 120.585 76.004 1.00 0.00 H ATOM 40315 H2 WAT 2659 87.681 120.221 76.263 1.00 0.00 H TER 40317 WAT 2659 ATOM 40317 O WAT 2660 20.439 43.597 136.023 1.00 0.00 O ATOM 40318 H1 WAT 2660 20.323 42.648 135.976 1.00 0.00 H ATOM 40319 H2 WAT 2660 20.096 43.921 135.189 1.00 0.00 H TER 40321 WAT 2660 ATOM 40321 O WAT 2661 132.224 103.005 95.579 1.00 0.00 O ATOM 40322 H1 WAT 2661 132.630 102.199 95.896 1.00 0.00 H ATOM 40323 H2 WAT 2661 131.396 103.060 96.057 1.00 0.00 H TER 40325 WAT 2661 ATOM 40325 O WAT 2662 76.999 62.273 94.698 1.00 0.00 O ATOM 40326 H1 WAT 2662 76.450 62.297 93.914 1.00 0.00 H ATOM 40327 H2 WAT 2662 77.776 62.781 94.463 1.00 0.00 H TER 40329 WAT 2662 ATOM 40329 O WAT 2663 13.551 125.572 111.316 1.00 0.00 O ATOM 40330 H1 WAT 2663 13.927 126.231 111.899 1.00 0.00 H ATOM 40331 H2 WAT 2663 12.616 125.574 111.524 1.00 0.00 H TER 40333 WAT 2663 ATOM 40333 O WAT 2664 98.484 115.913 74.375 1.00 0.00 O ATOM 40334 H1 WAT 2664 97.863 115.225 74.614 1.00 0.00 H ATOM 40335 H2 WAT 2664 97.986 116.726 74.460 1.00 0.00 H TER 40337 WAT 2664 ATOM 40337 O WAT 2665 53.639 8.458 105.547 1.00 0.00 O ATOM 40338 H1 WAT 2665 52.899 8.222 106.106 1.00 0.00 H ATOM 40339 H2 WAT 2665 53.921 9.314 105.871 1.00 0.00 H TER 40341 WAT 2665 ATOM 40341 O WAT 2666 64.204 22.524 89.708 1.00 0.00 O ATOM 40342 H1 WAT 2666 64.628 22.630 88.856 1.00 0.00 H ATOM 40343 H2 WAT 2666 64.405 23.334 90.177 1.00 0.00 H TER 40345 WAT 2666 ATOM 40345 O WAT 2667 82.284 142.834 -0.062 1.00 0.00 O ATOM 40346 H1 WAT 2667 82.379 142.537 0.843 1.00 0.00 H ATOM 40347 H2 WAT 2667 82.772 142.192 -0.577 1.00 0.00 H TER 40349 WAT 2667 ATOM 40349 O WAT 2668 17.363 104.718 158.004 1.00 0.00 O ATOM 40350 H1 WAT 2668 17.044 104.921 157.124 1.00 0.00 H ATOM 40351 H2 WAT 2668 18.136 105.271 158.112 1.00 0.00 H TER 40353 WAT 2668 ATOM 40353 O WAT 2669 71.885 108.713 103.957 1.00 0.00 O ATOM 40354 H1 WAT 2669 72.532 108.296 103.389 1.00 0.00 H ATOM 40355 H2 WAT 2669 71.180 108.975 103.365 1.00 0.00 H TER 40357 WAT 2669 ATOM 40357 O WAT 2670 117.960 141.680 94.931 1.00 0.00 O ATOM 40358 H1 WAT 2670 117.211 141.668 95.527 1.00 0.00 H ATOM 40359 H2 WAT 2670 118.633 141.169 95.381 1.00 0.00 H TER 40361 WAT 2670 ATOM 40361 O WAT 2671 123.336 125.872 12.479 1.00 0.00 O ATOM 40362 H1 WAT 2671 123.455 126.818 12.394 1.00 0.00 H ATOM 40363 H2 WAT 2671 123.563 125.683 13.390 1.00 0.00 H TER 40365 WAT 2671 ATOM 40365 O WAT 2672 37.612 115.329 88.278 1.00 0.00 O ATOM 40366 H1 WAT 2672 37.851 114.503 88.700 1.00 0.00 H ATOM 40367 H2 WAT 2672 37.045 115.070 87.551 1.00 0.00 H TER 40369 WAT 2672 ATOM 40369 O WAT 2673 10.845 123.311 20.028 1.00 0.00 O ATOM 40370 H1 WAT 2673 11.161 123.080 19.154 1.00 0.00 H ATOM 40371 H2 WAT 2673 9.936 123.009 20.041 1.00 0.00 H TER 40373 WAT 2673 ATOM 40373 O WAT 2674 59.201 82.968 156.625 1.00 0.00 O ATOM 40374 H1 WAT 2674 58.253 83.033 156.741 1.00 0.00 H ATOM 40375 H2 WAT 2674 59.552 82.978 157.516 1.00 0.00 H TER 40377 WAT 2674 ATOM 40377 O WAT 2675 141.967 4.672 156.507 1.00 0.00 O ATOM 40378 H1 WAT 2675 142.874 4.462 156.287 1.00 0.00 H ATOM 40379 H2 WAT 2675 142.023 5.123 157.350 1.00 0.00 H TER 40381 WAT 2675 ATOM 40381 O WAT 2676 90.540 115.297 9.000 1.00 0.00 O ATOM 40382 H1 WAT 2676 89.831 115.862 8.693 1.00 0.00 H ATOM 40383 H2 WAT 2676 90.101 114.618 9.513 1.00 0.00 H TER 40385 WAT 2676 ATOM 40385 O WAT 2677 100.746 123.766 124.328 1.00 0.00 O ATOM 40386 H1 WAT 2677 101.031 123.829 125.240 1.00 0.00 H ATOM 40387 H2 WAT 2677 101.236 123.024 123.975 1.00 0.00 H TER 40389 WAT 2677 ATOM 40389 O WAT 2678 131.365 91.132 135.628 1.00 0.00 O ATOM 40390 H1 WAT 2678 131.844 91.772 135.101 1.00 0.00 H ATOM 40391 H2 WAT 2678 131.265 90.374 135.051 1.00 0.00 H TER 40393 WAT 2678 ATOM 40393 O WAT 2679 17.522 84.964 106.692 1.00 0.00 O ATOM 40394 H1 WAT 2679 17.657 85.193 107.612 1.00 0.00 H ATOM 40395 H2 WAT 2679 17.900 84.089 106.604 1.00 0.00 H TER 40397 WAT 2679 ATOM 40397 O WAT 2680 6.676 17.265 8.741 1.00 0.00 O ATOM 40398 H1 WAT 2680 7.123 16.666 8.143 1.00 0.00 H ATOM 40399 H2 WAT 2680 7.084 17.102 9.592 1.00 0.00 H TER 40401 WAT 2680 ATOM 40401 O WAT 2681 19.494 43.939 83.532 1.00 0.00 O ATOM 40402 H1 WAT 2681 19.330 44.311 84.399 1.00 0.00 H ATOM 40403 H2 WAT 2681 19.463 42.992 83.668 1.00 0.00 H TER 40405 WAT 2681 ATOM 40405 O WAT 2682 58.622 136.236 134.069 1.00 0.00 O ATOM 40406 H1 WAT 2682 59.023 136.665 134.825 1.00 0.00 H ATOM 40407 H2 WAT 2682 58.314 135.395 134.406 1.00 0.00 H TER 40409 WAT 2682 ATOM 40409 O WAT 2683 39.145 125.189 92.767 1.00 0.00 O ATOM 40410 H1 WAT 2683 39.967 124.730 92.594 1.00 0.00 H ATOM 40411 H2 WAT 2683 39.223 125.488 93.673 1.00 0.00 H TER 40413 WAT 2683 ATOM 40413 O WAT 2684 0.333 127.875 16.936 1.00 0.00 O ATOM 40414 H1 WAT 2684 0.153 127.927 17.874 1.00 0.00 H ATOM 40415 H2 WAT 2684 1.184 127.441 16.879 1.00 0.00 H TER 40417 WAT 2684 ATOM 40417 O WAT 2685 49.044 49.343 86.145 1.00 0.00 O ATOM 40418 H1 WAT 2685 49.743 49.434 86.793 1.00 0.00 H ATOM 40419 H2 WAT 2685 49.419 49.695 85.338 1.00 0.00 H TER 40421 WAT 2685 ATOM 40421 O WAT 2686 85.436 20.379 139.990 1.00 0.00 O ATOM 40422 H1 WAT 2686 84.755 21.048 139.930 1.00 0.00 H ATOM 40423 H2 WAT 2686 85.804 20.331 139.108 1.00 0.00 H TER 40425 WAT 2686 ATOM 40425 O WAT 2687 109.241 25.317 138.101 1.00 0.00 O ATOM 40426 H1 WAT 2687 108.742 25.821 137.458 1.00 0.00 H ATOM 40427 H2 WAT 2687 109.606 24.586 137.602 1.00 0.00 H TER 40429 WAT 2687 ATOM 40429 O WAT 2688 89.617 93.578 156.800 1.00 0.00 O ATOM 40430 H1 WAT 2688 89.046 93.998 157.443 1.00 0.00 H ATOM 40431 H2 WAT 2688 90.106 94.300 156.406 1.00 0.00 H TER 40433 WAT 2688 ATOM 40433 O WAT 2689 113.105 142.271 105.227 1.00 0.00 O ATOM 40434 H1 WAT 2689 112.333 142.828 105.326 1.00 0.00 H ATOM 40435 H2 WAT 2689 112.750 141.390 105.103 1.00 0.00 H TER 40437 WAT 2689 ATOM 40437 O WAT 2690 15.324 77.700 139.112 1.00 0.00 O ATOM 40438 H1 WAT 2690 14.417 77.771 138.815 1.00 0.00 H ATOM 40439 H2 WAT 2690 15.255 77.439 140.030 1.00 0.00 H TER 40441 WAT 2690 ATOM 40441 O WAT 2691 9.495 97.650 64.889 1.00 0.00 O ATOM 40442 H1 WAT 2691 9.693 98.585 64.842 1.00 0.00 H ATOM 40443 H2 WAT 2691 10.253 97.224 64.487 1.00 0.00 H TER 40445 WAT 2691 ATOM 40445 O WAT 2692 18.682 44.230 13.186 1.00 0.00 O ATOM 40446 H1 WAT 2692 17.842 43.774 13.132 1.00 0.00 H ATOM 40447 H2 WAT 2692 18.515 45.087 12.794 1.00 0.00 H TER 40449 WAT 2692 ATOM 40449 O WAT 2693 45.154 145.440 14.834 1.00 0.00 O ATOM 40450 H1 WAT 2693 45.010 144.549 15.151 1.00 0.00 H ATOM 40451 H2 WAT 2693 44.383 145.926 15.126 1.00 0.00 H TER 40453 WAT 2693 ATOM 40453 O WAT 2694 12.648 66.536 130.734 1.00 0.00 O ATOM 40454 H1 WAT 2694 12.456 67.170 130.043 1.00 0.00 H ATOM 40455 H2 WAT 2694 12.766 65.706 130.271 1.00 0.00 H TER 40457 WAT 2694 ATOM 40457 O WAT 2695 143.311 83.736 11.333 1.00 0.00 O ATOM 40458 H1 WAT 2695 142.925 83.746 10.457 1.00 0.00 H ATOM 40459 H2 WAT 2695 144.243 83.581 11.182 1.00 0.00 H TER 40461 WAT 2695 ATOM 40461 O WAT 2696 120.707 86.230 21.149 1.00 0.00 O ATOM 40462 H1 WAT 2696 120.267 86.229 21.999 1.00 0.00 H ATOM 40463 H2 WAT 2696 121.548 85.803 21.313 1.00 0.00 H TER 40465 WAT 2696 ATOM 40465 O WAT 2697 79.085 144.842 157.565 1.00 0.00 O ATOM 40466 H1 WAT 2697 79.659 145.518 157.204 1.00 0.00 H ATOM 40467 H2 WAT 2697 78.877 145.150 158.447 1.00 0.00 H TER 40469 WAT 2697 ATOM 40469 O WAT 2698 1.602 79.101 128.881 1.00 0.00 O ATOM 40470 H1 WAT 2698 1.875 79.812 129.461 1.00 0.00 H ATOM 40471 H2 WAT 2698 2.412 78.807 128.464 1.00 0.00 H TER 40473 WAT 2698 ATOM 40473 O WAT 2699 14.308 128.659 146.587 1.00 0.00 O ATOM 40474 H1 WAT 2699 13.662 129.327 146.815 1.00 0.00 H ATOM 40475 H2 WAT 2699 15.146 129.122 146.599 1.00 0.00 H TER 40477 WAT 2699 ATOM 40477 O WAT 2700 84.424 39.966 107.241 1.00 0.00 O ATOM 40478 H1 WAT 2700 84.763 40.253 108.089 1.00 0.00 H ATOM 40479 H2 WAT 2700 83.823 39.252 107.453 1.00 0.00 H TER 40481 WAT 2700 ATOM 40481 O WAT 2701 112.480 79.139 141.733 1.00 0.00 O ATOM 40482 H1 WAT 2701 112.037 78.367 142.085 1.00 0.00 H ATOM 40483 H2 WAT 2701 113.007 78.802 141.008 1.00 0.00 H TER 40485 WAT 2701 ATOM 40485 O WAT 2702 38.530 73.074 95.535 1.00 0.00 O ATOM 40486 H1 WAT 2702 38.225 72.402 96.145 1.00 0.00 H ATOM 40487 H2 WAT 2702 38.596 73.867 96.066 1.00 0.00 H TER 40489 WAT 2702 ATOM 40489 O WAT 2703 100.427 8.647 51.388 1.00 0.00 O ATOM 40490 H1 WAT 2703 100.920 7.874 51.663 1.00 0.00 H ATOM 40491 H2 WAT 2703 100.802 9.365 51.897 1.00 0.00 H TER 40493 WAT 2703 ATOM 40493 O WAT 2704 130.890 31.126 142.378 1.00 0.00 O ATOM 40494 H1 WAT 2704 130.879 31.648 141.576 1.00 0.00 H ATOM 40495 H2 WAT 2704 131.292 31.699 143.032 1.00 0.00 H TER 40497 WAT 2704 ATOM 40497 O WAT 2705 130.825 137.687 88.857 1.00 0.00 O ATOM 40498 H1 WAT 2705 131.578 137.784 89.440 1.00 0.00 H ATOM 40499 H2 WAT 2705 130.067 137.709 89.440 1.00 0.00 H TER 40501 WAT 2705 ATOM 40501 O WAT 2706 72.440 125.944 65.077 1.00 0.00 O ATOM 40502 H1 WAT 2706 72.616 126.671 65.673 1.00 0.00 H ATOM 40503 H2 WAT 2706 73.307 125.632 64.817 1.00 0.00 H TER 40505 WAT 2706 ATOM 40505 O WAT 2707 140.079 27.994 147.516 1.00 0.00 O ATOM 40506 H1 WAT 2707 139.864 28.100 148.443 1.00 0.00 H ATOM 40507 H2 WAT 2707 139.353 27.482 147.159 1.00 0.00 H TER 40509 WAT 2707 ATOM 40509 O WAT 2708 117.577 127.553 60.756 1.00 0.00 O ATOM 40510 H1 WAT 2708 116.825 127.535 61.348 1.00 0.00 H ATOM 40511 H2 WAT 2708 117.297 128.111 60.031 1.00 0.00 H TER 40513 WAT 2708 ATOM 40513 O WAT 2709 35.666 83.781 124.098 1.00 0.00 O ATOM 40514 H1 WAT 2709 35.565 82.940 123.652 1.00 0.00 H ATOM 40515 H2 WAT 2709 35.356 83.618 124.989 1.00 0.00 H TER 40517 WAT 2709 ATOM 40517 O WAT 2710 98.021 40.315 133.361 1.00 0.00 O ATOM 40518 H1 WAT 2710 98.419 41.156 133.587 1.00 0.00 H ATOM 40519 H2 WAT 2710 97.215 40.286 133.877 1.00 0.00 H TER 40521 WAT 2710 ATOM 40521 O WAT 2711 81.948 34.515 15.209 1.00 0.00 O ATOM 40522 H1 WAT 2711 82.328 35.178 15.786 1.00 0.00 H ATOM 40523 H2 WAT 2711 82.322 33.688 15.514 1.00 0.00 H TER 40525 WAT 2711 ATOM 40525 O WAT 2712 111.095 82.627 131.517 1.00 0.00 O ATOM 40526 H1 WAT 2712 110.773 82.335 130.664 1.00 0.00 H ATOM 40527 H2 WAT 2712 111.458 83.497 131.350 1.00 0.00 H TER 40529 WAT 2712 ATOM 40529 O WAT 2713 19.969 37.200 118.699 1.00 0.00 O ATOM 40530 H1 WAT 2713 20.010 37.125 119.653 1.00 0.00 H ATOM 40531 H2 WAT 2713 19.906 36.296 118.390 1.00 0.00 H TER 40533 WAT 2713 ATOM 40533 O WAT 2714 52.763 11.974 58.773 1.00 0.00 O ATOM 40534 H1 WAT 2714 53.701 12.112 58.642 1.00 0.00 H ATOM 40535 H2 WAT 2714 52.674 11.815 59.713 1.00 0.00 H TER 40537 WAT 2714 ATOM 40537 O WAT 2715 131.439 37.445 63.394 1.00 0.00 O ATOM 40538 H1 WAT 2715 130.583 37.869 63.338 1.00 0.00 H ATOM 40539 H2 WAT 2715 131.744 37.400 62.488 1.00 0.00 H TER 40541 WAT 2715 ATOM 40541 O WAT 2716 102.950 140.996 11.360 1.00 0.00 O ATOM 40542 H1 WAT 2716 102.974 140.056 11.539 1.00 0.00 H ATOM 40543 H2 WAT 2716 103.329 141.398 12.142 1.00 0.00 H TER 40545 WAT 2716 ATOM 40545 O WAT 2717 30.833 61.976 13.080 1.00 0.00 O ATOM 40546 H1 WAT 2717 29.962 62.299 12.848 1.00 0.00 H ATOM 40547 H2 WAT 2717 30.745 61.681 13.986 1.00 0.00 H TER 40549 WAT 2717 ATOM 40549 O WAT 2718 15.737 54.217 142.079 1.00 0.00 O ATOM 40550 H1 WAT 2718 15.240 54.994 142.335 1.00 0.00 H ATOM 40551 H2 WAT 2718 16.547 54.273 142.586 1.00 0.00 H TER 40553 WAT 2718 ATOM 40553 O WAT 2719 117.859 95.986 73.467 1.00 0.00 O ATOM 40554 H1 WAT 2719 117.008 96.410 73.354 1.00 0.00 H ATOM 40555 H2 WAT 2719 117.738 95.107 73.110 1.00 0.00 H TER 40557 WAT 2719 ATOM 40557 O WAT 2720 123.943 90.638 133.067 1.00 0.00 O ATOM 40558 H1 WAT 2720 124.102 90.204 132.229 1.00 0.00 H ATOM 40559 H2 WAT 2720 123.053 90.379 133.306 1.00 0.00 H TER 40561 WAT 2720 ATOM 40561 O WAT 2721 49.364 121.430 96.488 1.00 0.00 O ATOM 40562 H1 WAT 2721 48.577 121.424 97.033 1.00 0.00 H ATOM 40563 H2 WAT 2721 49.222 120.727 95.854 1.00 0.00 H TER 40565 WAT 2721 ATOM 40565 O WAT 2722 51.901 23.376 6.131 1.00 0.00 O ATOM 40566 H1 WAT 2722 51.149 23.897 6.412 1.00 0.00 H ATOM 40567 H2 WAT 2722 52.258 23.014 6.942 1.00 0.00 H TER 40569 WAT 2722 ATOM 40569 O WAT 2723 35.543 99.752 67.035 1.00 0.00 O ATOM 40570 H1 WAT 2723 35.388 98.993 66.472 1.00 0.00 H ATOM 40571 H2 WAT 2723 36.427 99.620 67.377 1.00 0.00 H TER 40573 WAT 2723 ATOM 40573 O WAT 2724 57.481 144.668 68.852 1.00 0.00 O ATOM 40574 H1 WAT 2724 57.717 144.398 69.739 1.00 0.00 H ATOM 40575 H2 WAT 2724 58.294 145.012 68.482 1.00 0.00 H TER 40577 WAT 2724 ATOM 40577 O WAT 2725 92.356 103.159 94.812 1.00 0.00 O ATOM 40578 H1 WAT 2725 92.205 102.653 94.013 1.00 0.00 H ATOM 40579 H2 WAT 2725 92.373 102.505 95.510 1.00 0.00 H TER 40581 WAT 2725 ATOM 40581 O WAT 2726 45.919 104.447 108.344 1.00 0.00 O ATOM 40582 H1 WAT 2726 45.267 105.094 108.612 1.00 0.00 H ATOM 40583 H2 WAT 2726 45.592 103.618 108.695 1.00 0.00 H TER 40585 WAT 2726 ATOM 40585 O WAT 2727 138.636 109.594 108.342 1.00 0.00 O ATOM 40586 H1 WAT 2727 138.051 109.506 107.590 1.00 0.00 H ATOM 40587 H2 WAT 2727 139.422 109.107 108.093 1.00 0.00 H TER 40589 WAT 2727 ATOM 40589 O WAT 2728 56.830 93.032 77.753 1.00 0.00 O ATOM 40590 H1 WAT 2728 56.773 93.967 77.947 1.00 0.00 H ATOM 40591 H2 WAT 2728 57.712 92.782 78.029 1.00 0.00 H TER 40593 WAT 2728 ATOM 40593 O WAT 2729 88.673 78.960 103.941 1.00 0.00 O ATOM 40594 H1 WAT 2729 87.754 79.119 103.724 1.00 0.00 H ATOM 40595 H2 WAT 2729 89.120 79.770 103.697 1.00 0.00 H TER 40597 WAT 2729 ATOM 40597 O WAT 2730 19.981 106.741 121.010 1.00 0.00 O ATOM 40598 H1 WAT 2730 19.431 107.023 121.741 1.00 0.00 H ATOM 40599 H2 WAT 2730 20.795 106.449 121.422 1.00 0.00 H TER 40601 WAT 2730 ATOM 40601 O WAT 2731 103.299 105.705 80.174 1.00 0.00 O ATOM 40602 H1 WAT 2731 103.733 105.424 80.979 1.00 0.00 H ATOM 40603 H2 WAT 2731 103.101 106.630 80.317 1.00 0.00 H TER 40605 WAT 2731 ATOM 40605 O WAT 2732 70.829 9.107 8.359 1.00 0.00 O ATOM 40606 H1 WAT 2732 71.316 8.307 8.162 1.00 0.00 H ATOM 40607 H2 WAT 2732 70.697 9.080 9.306 1.00 0.00 H TER 40609 WAT 2732 ATOM 40609 O WAT 2733 4.935 130.600 57.321 1.00 0.00 O ATOM 40610 H1 WAT 2733 5.027 129.984 56.594 1.00 0.00 H ATOM 40611 H2 WAT 2733 5.527 130.265 57.995 1.00 0.00 H TER 40613 WAT 2733 ATOM 40613 O WAT 2734 10.426 46.806 19.178 1.00 0.00 O ATOM 40614 H1 WAT 2734 10.207 45.896 19.374 1.00 0.00 H ATOM 40615 H2 WAT 2734 11.157 46.749 18.563 1.00 0.00 H TER 40617 WAT 2734 ATOM 40617 O WAT 2735 17.467 113.641 111.585 1.00 0.00 O ATOM 40618 H1 WAT 2735 17.072 113.111 112.277 1.00 0.00 H ATOM 40619 H2 WAT 2735 17.480 114.529 111.941 1.00 0.00 H TER 40621 WAT 2735 ATOM 40621 O WAT 2736 132.655 104.464 15.509 1.00 0.00 O ATOM 40622 H1 WAT 2736 133.366 103.922 15.850 1.00 0.00 H ATOM 40623 H2 WAT 2736 132.135 104.690 16.281 1.00 0.00 H TER 40625 WAT 2736 ATOM 40625 O WAT 2737 7.967 30.399 152.101 1.00 0.00 O ATOM 40626 H1 WAT 2737 8.859 30.066 151.999 1.00 0.00 H ATOM 40627 H2 WAT 2737 8.054 31.348 152.012 1.00 0.00 H TER 40629 WAT 2737 ATOM 40629 O WAT 2738 140.485 1.028 130.256 1.00 0.00 O ATOM 40630 H1 WAT 2738 140.617 1.073 131.202 1.00 0.00 H ATOM 40631 H2 WAT 2738 139.799 0.370 130.141 1.00 0.00 H TER 40633 WAT 2738 ATOM 40633 O WAT 2739 139.374 78.717 96.587 1.00 0.00 O ATOM 40634 H1 WAT 2739 139.768 79.586 96.507 1.00 0.00 H ATOM 40635 H2 WAT 2739 139.435 78.345 95.707 1.00 0.00 H TER 40637 WAT 2739 ATOM 40637 O WAT 2740 12.828 127.363 148.508 1.00 0.00 O ATOM 40638 H1 WAT 2740 12.460 128.104 148.989 1.00 0.00 H ATOM 40639 H2 WAT 2740 13.555 127.737 148.011 1.00 0.00 H TER 40641 WAT 2740 ATOM 40641 O WAT 2741 141.216 116.708 127.755 1.00 0.00 O ATOM 40642 H1 WAT 2741 141.961 116.289 128.186 1.00 0.00 H ATOM 40643 H2 WAT 2741 141.471 117.627 127.675 1.00 0.00 H TER 40645 WAT 2741 ATOM 40645 O WAT 2742 88.167 43.207 92.787 1.00 0.00 O ATOM 40646 H1 WAT 2742 87.415 43.315 92.204 1.00 0.00 H ATOM 40647 H2 WAT 2742 88.915 43.508 92.271 1.00 0.00 H TER 40649 WAT 2742 ATOM 40649 O WAT 2743 120.605 9.747 146.972 1.00 0.00 O ATOM 40650 H1 WAT 2743 119.776 10.037 147.352 1.00 0.00 H ATOM 40651 H2 WAT 2743 121.174 10.515 147.023 1.00 0.00 H TER 40653 WAT 2743 ATOM 40653 O WAT 2744 95.771 12.009 150.687 1.00 0.00 O ATOM 40654 H1 WAT 2744 95.026 11.854 150.105 1.00 0.00 H ATOM 40655 H2 WAT 2744 95.465 12.684 151.292 1.00 0.00 H TER 40657 WAT 2744 ATOM 40657 O WAT 2745 43.407 107.168 105.115 1.00 0.00 O ATOM 40658 H1 WAT 2745 43.230 107.813 105.800 1.00 0.00 H ATOM 40659 H2 WAT 2745 44.352 107.026 105.158 1.00 0.00 H TER 40661 WAT 2745 ATOM 40661 O WAT 2746 83.783 48.519 102.416 1.00 0.00 O ATOM 40662 H1 WAT 2746 82.831 48.608 102.436 1.00 0.00 H ATOM 40663 H2 WAT 2746 84.029 48.365 103.328 1.00 0.00 H TER 40665 WAT 2746 ATOM 40665 O WAT 2747 59.429 58.800 149.476 1.00 0.00 O ATOM 40666 H1 WAT 2747 59.589 58.816 148.532 1.00 0.00 H ATOM 40667 H2 WAT 2747 59.631 57.902 149.738 1.00 0.00 H TER 40669 WAT 2747 ATOM 40669 O WAT 2748 10.574 91.191 67.493 1.00 0.00 O ATOM 40670 H1 WAT 2748 9.656 90.937 67.591 1.00 0.00 H ATOM 40671 H2 WAT 2748 10.898 90.649 66.774 1.00 0.00 H TER 40673 WAT 2748 ATOM 40673 O WAT 2749 13.192 42.127 124.876 1.00 0.00 O ATOM 40674 H1 WAT 2749 13.173 42.848 124.248 1.00 0.00 H ATOM 40675 H2 WAT 2749 12.371 41.659 124.730 1.00 0.00 H TER 40677 WAT 2749 ATOM 40677 O WAT 2750 145.311 105.771 71.371 1.00 0.00 O ATOM 40678 H1 WAT 2750 145.101 106.525 71.922 1.00 0.00 H ATOM 40679 H2 WAT 2750 145.563 105.085 71.989 1.00 0.00 H TER 40681 WAT 2750 ATOM 40681 O WAT 2751 28.383 47.089 24.265 1.00 0.00 O ATOM 40682 H1 WAT 2751 28.776 47.611 24.965 1.00 0.00 H ATOM 40683 H2 WAT 2751 27.449 47.293 24.310 1.00 0.00 H TER 40685 WAT 2751 ATOM 40685 O WAT 2752 107.896 83.375 20.761 1.00 0.00 O ATOM 40686 H1 WAT 2752 107.905 84.329 20.686 1.00 0.00 H ATOM 40687 H2 WAT 2752 108.332 83.068 19.966 1.00 0.00 H TER 40689 WAT 2752 ATOM 40689 O WAT 2753 11.524 60.044 135.293 1.00 0.00 O ATOM 40690 H1 WAT 2753 11.216 59.765 134.431 1.00 0.00 H ATOM 40691 H2 WAT 2753 10.992 60.813 135.499 1.00 0.00 H TER 40693 WAT 2753 ATOM 40693 O WAT 2754 68.184 44.925 158.070 1.00 0.00 O ATOM 40694 H1 WAT 2754 67.752 45.294 157.300 1.00 0.00 H ATOM 40695 H2 WAT 2754 67.835 45.429 158.805 1.00 0.00 H TER 40697 WAT 2754 ATOM 40697 O WAT 2755 96.072 57.074 113.636 1.00 0.00 O ATOM 40698 H1 WAT 2755 96.813 56.881 114.211 1.00 0.00 H ATOM 40699 H2 WAT 2755 95.312 57.080 114.217 1.00 0.00 H TER 40701 WAT 2755 ATOM 40701 O WAT 2756 3.955 119.356 127.715 1.00 0.00 O ATOM 40702 H1 WAT 2756 4.785 119.664 127.351 1.00 0.00 H ATOM 40703 H2 WAT 2756 3.743 118.576 127.202 1.00 0.00 H TER 40705 WAT 2756 ATOM 40705 O WAT 2757 122.156 124.104 157.003 1.00 0.00 O ATOM 40706 H1 WAT 2757 122.098 123.338 157.574 1.00 0.00 H ATOM 40707 H2 WAT 2757 123.078 124.358 157.036 1.00 0.00 H TER 40709 WAT 2757 ATOM 40709 O WAT 2758 130.902 9.640 157.087 1.00 0.00 O ATOM 40710 H1 WAT 2758 131.170 9.110 156.336 1.00 0.00 H ATOM 40711 H2 WAT 2758 131.602 9.518 157.729 1.00 0.00 H TER 40713 WAT 2758 ATOM 40713 O WAT 2759 67.537 88.721 73.729 1.00 0.00 O ATOM 40714 H1 WAT 2759 67.946 88.191 73.045 1.00 0.00 H ATOM 40715 H2 WAT 2759 66.969 89.328 73.255 1.00 0.00 H TER 40717 WAT 2759 ATOM 40717 O WAT 2760 121.901 109.309 8.851 1.00 0.00 O ATOM 40718 H1 WAT 2760 121.220 108.715 9.167 1.00 0.00 H ATOM 40719 H2 WAT 2760 121.689 109.446 7.928 1.00 0.00 H TER 40721 WAT 2760 ATOM 40721 O WAT 2761 64.599 142.982 156.134 1.00 0.00 O ATOM 40722 H1 WAT 2761 64.504 142.074 156.422 1.00 0.00 H ATOM 40723 H2 WAT 2761 64.614 143.490 156.946 1.00 0.00 H TER 40725 WAT 2761 ATOM 40725 O WAT 2762 117.241 118.856 151.229 1.00 0.00 O ATOM 40726 H1 WAT 2762 117.077 118.845 150.286 1.00 0.00 H ATOM 40727 H2 WAT 2762 116.422 118.551 151.619 1.00 0.00 H TER 40729 WAT 2762 ATOM 40729 O WAT 2763 119.735 53.984 132.642 1.00 0.00 O ATOM 40730 H1 WAT 2763 119.091 53.303 132.832 1.00 0.00 H ATOM 40731 H2 WAT 2763 119.756 54.522 133.433 1.00 0.00 H TER 40733 WAT 2763 ATOM 40733 O WAT 2764 50.722 91.298 87.087 1.00 0.00 O ATOM 40734 H1 WAT 2764 51.622 90.972 87.098 1.00 0.00 H ATOM 40735 H2 WAT 2764 50.700 91.914 86.354 1.00 0.00 H TER 40737 WAT 2764 ATOM 40737 O WAT 2765 122.393 54.211 0.595 1.00 0.00 O ATOM 40738 H1 WAT 2765 122.151 53.810 -0.240 1.00 0.00 H ATOM 40739 H2 WAT 2765 121.644 54.043 1.167 1.00 0.00 H TER 40741 WAT 2765 ATOM 40741 O WAT 2766 53.298 30.898 81.255 1.00 0.00 O ATOM 40742 H1 WAT 2766 53.861 31.531 81.700 1.00 0.00 H ATOM 40743 H2 WAT 2766 53.018 30.298 81.946 1.00 0.00 H TER 40745 WAT 2766 ATOM 40745 O WAT 2767 110.432 76.876 143.059 1.00 0.00 O ATOM 40746 H1 WAT 2767 110.197 76.025 142.688 1.00 0.00 H ATOM 40747 H2 WAT 2767 111.268 76.722 143.500 1.00 0.00 H TER 40749 WAT 2767 ATOM 40749 O WAT 2768 126.610 23.072 81.432 1.00 0.00 O ATOM 40750 H1 WAT 2768 125.891 22.900 80.825 1.00 0.00 H ATOM 40751 H2 WAT 2768 127.287 23.479 80.892 1.00 0.00 H TER 40753 WAT 2768 ATOM 40753 O WAT 2769 18.124 63.441 18.686 1.00 0.00 O ATOM 40754 H1 WAT 2769 17.568 63.489 19.464 1.00 0.00 H ATOM 40755 H2 WAT 2769 18.737 62.730 18.873 1.00 0.00 H TER 40757 WAT 2769 ATOM 40757 O WAT 2770 97.416 86.023 70.414 1.00 0.00 O ATOM 40758 H1 WAT 2770 98.262 85.932 69.977 1.00 0.00 H ATOM 40759 H2 WAT 2770 97.423 85.350 71.095 1.00 0.00 H TER 40761 WAT 2770 ATOM 40761 O WAT 2771 48.611 38.222 84.726 1.00 0.00 O ATOM 40762 H1 WAT 2771 49.397 38.687 84.437 1.00 0.00 H ATOM 40763 H2 WAT 2771 48.244 38.777 85.414 1.00 0.00 H TER 40765 WAT 2771 ATOM 40765 O WAT 2772 108.962 86.103 110.850 1.00 0.00 O ATOM 40766 H1 WAT 2772 108.150 86.451 111.217 1.00 0.00 H ATOM 40767 H2 WAT 2772 108.881 85.154 110.946 1.00 0.00 H TER 40769 WAT 2772 ATOM 40769 O WAT 2773 27.450 40.744 95.616 1.00 0.00 O ATOM 40770 H1 WAT 2773 28.294 41.141 95.403 1.00 0.00 H ATOM 40771 H2 WAT 2773 26.803 41.393 95.341 1.00 0.00 H TER 40773 WAT 2773 ATOM 40773 O WAT 2774 14.484 47.931 107.392 1.00 0.00 O ATOM 40774 H1 WAT 2774 14.153 48.691 107.871 1.00 0.00 H ATOM 40775 H2 WAT 2774 15.435 48.036 107.405 1.00 0.00 H TER 40777 WAT 2774 ATOM 40777 O WAT 2775 0.590 6.799 6.991 1.00 0.00 O ATOM 40778 H1 WAT 2775 0.925 6.143 6.380 1.00 0.00 H ATOM 40779 H2 WAT 2775 -0.246 7.072 6.614 1.00 0.00 H TER 40781 WAT 2775 ATOM 40781 O WAT 2776 32.501 42.981 56.443 1.00 0.00 O ATOM 40782 H1 WAT 2776 32.908 42.821 55.592 1.00 0.00 H ATOM 40783 H2 WAT 2776 31.568 42.824 56.296 1.00 0.00 H TER 40785 WAT 2776 ATOM 40785 O WAT 2777 64.540 102.580 143.154 1.00 0.00 O ATOM 40786 H1 WAT 2777 64.976 102.787 143.981 1.00 0.00 H ATOM 40787 H2 WAT 2777 63.841 103.230 143.083 1.00 0.00 H TER 40789 WAT 2777 ATOM 40789 O WAT 2778 113.817 111.601 154.942 1.00 0.00 O ATOM 40790 H1 WAT 2778 114.351 111.918 155.670 1.00 0.00 H ATOM 40791 H2 WAT 2778 113.894 112.283 154.274 1.00 0.00 H TER 40793 WAT 2778 ATOM 40793 O WAT 2779 105.488 112.916 90.512 1.00 0.00 O ATOM 40794 H1 WAT 2779 104.692 112.517 90.160 1.00 0.00 H ATOM 40795 H2 WAT 2779 105.856 113.404 89.776 1.00 0.00 H TER 40797 WAT 2779 ATOM 40797 O WAT 2780 10.525 62.629 104.869 1.00 0.00 O ATOM 40798 H1 WAT 2780 9.927 62.231 105.502 1.00 0.00 H ATOM 40799 H2 WAT 2780 9.974 62.832 104.114 1.00 0.00 H TER 40801 WAT 2780 ATOM 40801 O WAT 2781 117.449 117.668 17.731 1.00 0.00 O ATOM 40802 H1 WAT 2781 117.448 118.625 17.721 1.00 0.00 H ATOM 40803 H2 WAT 2781 116.524 117.428 17.769 1.00 0.00 H TER 40805 WAT 2781 ATOM 40805 O WAT 2782 64.397 111.547 141.681 1.00 0.00 O ATOM 40806 H1 WAT 2782 64.162 110.621 141.746 1.00 0.00 H ATOM 40807 H2 WAT 2782 65.041 111.581 140.973 1.00 0.00 H TER 40809 WAT 2782 ATOM 40809 O WAT 2783 0.994 17.843 7.573 1.00 0.00 O ATOM 40810 H1 WAT 2783 0.288 17.993 6.944 1.00 0.00 H ATOM 40811 H2 WAT 2783 0.576 17.933 8.429 1.00 0.00 H TER 40813 WAT 2783 ATOM 40813 O WAT 2784 122.070 9.345 57.708 1.00 0.00 O ATOM 40814 H1 WAT 2784 121.389 9.091 57.085 1.00 0.00 H ATOM 40815 H2 WAT 2784 121.691 9.156 58.566 1.00 0.00 H TER 40817 WAT 2784 ATOM 40817 O WAT 2785 138.501 135.214 17.125 1.00 0.00 O ATOM 40818 H1 WAT 2785 138.686 135.983 16.586 1.00 0.00 H ATOM 40819 H2 WAT 2785 138.317 135.569 17.994 1.00 0.00 H TER 40821 WAT 2785 ATOM 40821 O WAT 2786 4.222 60.812 5.179 1.00 0.00 O ATOM 40822 H1 WAT 2786 4.580 61.351 5.884 1.00 0.00 H ATOM 40823 H2 WAT 2786 3.363 60.537 5.500 1.00 0.00 H TER 40825 WAT 2786 ATOM 40825 O WAT 2787 42.448 54.294 12.028 1.00 0.00 O ATOM 40826 H1 WAT 2787 42.706 55.194 12.227 1.00 0.00 H ATOM 40827 H2 WAT 2787 43.055 53.754 12.534 1.00 0.00 H TER 40829 WAT 2787 ATOM 40829 O WAT 2788 132.164 41.209 106.685 1.00 0.00 O ATOM 40830 H1 WAT 2788 131.527 40.636 107.111 1.00 0.00 H ATOM 40831 H2 WAT 2788 132.802 40.611 106.295 1.00 0.00 H TER 40833 WAT 2788 ATOM 40833 O WAT 2789 145.165 0.101 146.546 1.00 0.00 O ATOM 40834 H1 WAT 2789 144.409 0.605 146.847 1.00 0.00 H ATOM 40835 H2 WAT 2789 145.078 -0.746 146.983 1.00 0.00 H TER 40837 WAT 2789 ATOM 40837 O WAT 2790 47.490 61.906 154.947 1.00 0.00 O ATOM 40838 H1 WAT 2790 47.115 62.654 155.413 1.00 0.00 H ATOM 40839 H2 WAT 2790 48.434 62.064 154.962 1.00 0.00 H TER 40841 WAT 2790 ATOM 40841 O WAT 2791 55.290 78.673 110.617 1.00 0.00 O ATOM 40842 H1 WAT 2791 56.121 79.093 110.838 1.00 0.00 H ATOM 40843 H2 WAT 2791 54.663 79.039 111.240 1.00 0.00 H TER 40845 WAT 2791 ATOM 40845 O WAT 2792 102.325 16.953 98.483 1.00 0.00 O ATOM 40846 H1 WAT 2792 102.988 16.263 98.501 1.00 0.00 H ATOM 40847 H2 WAT 2792 101.677 16.646 97.849 1.00 0.00 H TER 40849 WAT 2792 ATOM 40849 O WAT 2793 122.534 72.433 1.198 1.00 0.00 O ATOM 40850 H1 WAT 2793 122.634 71.924 2.002 1.00 0.00 H ATOM 40851 H2 WAT 2793 121.851 71.975 0.708 1.00 0.00 H TER 40853 WAT 2793 ATOM 40853 O WAT 2794 123.814 49.286 89.773 1.00 0.00 O ATOM 40854 H1 WAT 2794 123.196 48.566 89.653 1.00 0.00 H ATOM 40855 H2 WAT 2794 124.676 48.880 89.683 1.00 0.00 H TER 40857 WAT 2794 ATOM 40857 O WAT 2795 120.160 16.929 144.880 1.00 0.00 O ATOM 40858 H1 WAT 2795 120.826 17.389 145.390 1.00 0.00 H ATOM 40859 H2 WAT 2795 120.068 17.448 144.082 1.00 0.00 H TER 40861 WAT 2795 ATOM 40861 O WAT 2796 78.800 108.356 105.959 1.00 0.00 O ATOM 40862 H1 WAT 2796 78.609 108.644 105.066 1.00 0.00 H ATOM 40863 H2 WAT 2796 78.578 107.425 105.963 1.00 0.00 H TER 40865 WAT 2796 ATOM 40865 O WAT 2797 50.755 89.702 62.814 1.00 0.00 O ATOM 40866 H1 WAT 2797 51.308 89.065 62.362 1.00 0.00 H ATOM 40867 H2 WAT 2797 51.021 90.548 62.454 1.00 0.00 H TER 40869 WAT 2797 ATOM 40869 O WAT 2798 23.378 16.907 84.551 1.00 0.00 O ATOM 40870 H1 WAT 2798 22.913 16.137 84.224 1.00 0.00 H ATOM 40871 H2 WAT 2798 23.895 16.580 85.287 1.00 0.00 H TER 40873 WAT 2798 ATOM 40873 O WAT 2799 123.755 92.649 137.683 1.00 0.00 O ATOM 40874 H1 WAT 2799 123.986 92.496 138.599 1.00 0.00 H ATOM 40875 H2 WAT 2799 122.824 92.432 137.631 1.00 0.00 H TER 40877 WAT 2799 ATOM 40877 O WAT 2800 121.351 111.933 9.847 1.00 0.00 O ATOM 40878 H1 WAT 2800 122.202 112.094 10.255 1.00 0.00 H ATOM 40879 H2 WAT 2800 121.371 111.006 9.609 1.00 0.00 H TER 40881 WAT 2800 ATOM 40881 O WAT 2801 23.566 57.774 59.549 1.00 0.00 O ATOM 40882 H1 WAT 2801 23.779 58.382 58.840 1.00 0.00 H ATOM 40883 H2 WAT 2801 23.574 56.911 59.135 1.00 0.00 H TER 40885 WAT 2801 ATOM 40885 O WAT 2802 41.810 82.997 155.522 1.00 0.00 O ATOM 40886 H1 WAT 2802 41.742 83.869 155.912 1.00 0.00 H ATOM 40887 H2 WAT 2802 42.278 83.139 154.699 1.00 0.00 H TER 40889 WAT 2802 ATOM 40889 O WAT 2803 51.356 104.477 17.034 1.00 0.00 O ATOM 40890 H1 WAT 2803 52.092 103.865 17.050 1.00 0.00 H ATOM 40891 H2 WAT 2803 51.506 105.051 17.785 1.00 0.00 H TER 40893 WAT 2803 ATOM 40893 O WAT 2804 122.214 138.228 152.926 1.00 0.00 O ATOM 40894 H1 WAT 2804 122.503 138.744 153.680 1.00 0.00 H ATOM 40895 H2 WAT 2804 121.262 138.188 153.015 1.00 0.00 H TER 40897 WAT 2804 ATOM 40897 O WAT 2805 130.328 49.768 58.206 1.00 0.00 O ATOM 40898 H1 WAT 2805 131.166 49.628 57.766 1.00 0.00 H ATOM 40899 H2 WAT 2805 130.350 50.687 58.475 1.00 0.00 H TER 40901 WAT 2805 ATOM 40901 O WAT 2806 93.744 18.532 137.281 1.00 0.00 O ATOM 40902 H1 WAT 2806 93.452 18.791 136.407 1.00 0.00 H ATOM 40903 H2 WAT 2806 93.331 19.165 137.868 1.00 0.00 H TER 40905 WAT 2806 ATOM 40905 O WAT 2807 81.077 134.090 0.131 1.00 0.00 O ATOM 40906 H1 WAT 2807 81.322 134.382 1.009 1.00 0.00 H ATOM 40907 H2 WAT 2807 80.533 133.316 0.279 1.00 0.00 H TER 40909 WAT 2807 ATOM 40909 O WAT 2808 31.966 122.146 125.726 1.00 0.00 O ATOM 40910 H1 WAT 2808 31.796 121.924 126.641 1.00 0.00 H ATOM 40911 H2 WAT 2808 31.108 122.105 125.305 1.00 0.00 H TER 40913 WAT 2808 ATOM 40913 O WAT 2809 5.363 74.418 8.128 1.00 0.00 O ATOM 40914 H1 WAT 2809 6.085 74.943 8.472 1.00 0.00 H ATOM 40915 H2 WAT 2809 4.582 74.778 8.549 1.00 0.00 H TER 40917 WAT 2809 ATOM 40917 O WAT 2810 12.114 93.903 139.675 1.00 0.00 O ATOM 40918 H1 WAT 2810 12.675 94.679 139.679 1.00 0.00 H ATOM 40919 H2 WAT 2810 11.869 93.780 140.592 1.00 0.00 H TER 40921 WAT 2810 ATOM 40921 O WAT 2811 145.055 71.469 82.577 1.00 0.00 O ATOM 40922 H1 WAT 2811 145.432 71.406 83.454 1.00 0.00 H ATOM 40923 H2 WAT 2811 145.758 71.834 82.040 1.00 0.00 H TER 40925 WAT 2811 ATOM 40925 O WAT 2812 144.467 80.968 132.066 1.00 0.00 O ATOM 40926 H1 WAT 2812 144.067 81.793 132.340 1.00 0.00 H ATOM 40927 H2 WAT 2812 145.306 81.224 131.684 1.00 0.00 H TER 40929 WAT 2812 ATOM 40929 O WAT 2813 55.079 15.171 77.737 1.00 0.00 O ATOM 40930 H1 WAT 2813 55.577 15.100 78.552 1.00 0.00 H ATOM 40931 H2 WAT 2813 54.257 14.715 77.918 1.00 0.00 H TER 40933 WAT 2813 ATOM 40933 O WAT 2814 106.830 145.287 106.909 1.00 0.00 O ATOM 40934 H1 WAT 2814 106.842 144.334 106.821 1.00 0.00 H ATOM 40935 H2 WAT 2814 107.392 145.465 107.662 1.00 0.00 H TER 40937 WAT 2814 ATOM 40937 O WAT 2815 68.829 3.441 120.184 1.00 0.00 O ATOM 40938 H1 WAT 2815 68.987 3.233 119.263 1.00 0.00 H ATOM 40939 H2 WAT 2815 68.553 4.357 120.179 1.00 0.00 H TER 40941 WAT 2815 ATOM 40941 O WAT 2816 56.347 44.607 19.285 1.00 0.00 O ATOM 40942 H1 WAT 2816 56.916 45.306 19.610 1.00 0.00 H ATOM 40943 H2 WAT 2816 56.926 43.850 19.194 1.00 0.00 H TER 40945 WAT 2816 ATOM 40945 O WAT 2817 145.448 2.325 78.396 1.00 0.00 O ATOM 40946 H1 WAT 2817 144.782 1.961 78.978 1.00 0.00 H ATOM 40947 H2 WAT 2817 144.953 2.831 77.751 1.00 0.00 H TER 40949 WAT 2817 ATOM 40949 O WAT 2818 52.733 64.531 82.614 1.00 0.00 O ATOM 40950 H1 WAT 2818 52.557 63.722 83.094 1.00 0.00 H ATOM 40951 H2 WAT 2818 52.484 64.333 81.711 1.00 0.00 H TER 40953 WAT 2818 ATOM 40953 O WAT 2819 18.774 85.327 136.260 1.00 0.00 O ATOM 40954 H1 WAT 2819 19.468 85.440 135.611 1.00 0.00 H ATOM 40955 H2 WAT 2819 19.235 85.275 137.097 1.00 0.00 H TER 40957 WAT 2819 ATOM 40957 O WAT 2820 62.160 131.635 144.817 1.00 0.00 O ATOM 40958 H1 WAT 2820 61.873 131.171 145.604 1.00 0.00 H ATOM 40959 H2 WAT 2820 62.177 130.963 144.136 1.00 0.00 H TER 40961 WAT 2820 ATOM 40961 O WAT 2821 109.392 91.881 133.169 1.00 0.00 O ATOM 40962 H1 WAT 2821 109.270 91.041 133.613 1.00 0.00 H ATOM 40963 H2 WAT 2821 108.545 92.062 132.762 1.00 0.00 H TER 40965 WAT 2821 ATOM 40965 O WAT 2822 76.172 10.246 124.279 1.00 0.00 O ATOM 40966 H1 WAT 2822 75.759 10.994 124.711 1.00 0.00 H ATOM 40967 H2 WAT 2822 75.446 9.660 124.068 1.00 0.00 H TER 40969 WAT 2822 ATOM 40969 O WAT 2823 4.190 126.461 143.184 1.00 0.00 O ATOM 40970 H1 WAT 2823 4.462 126.870 144.005 1.00 0.00 H ATOM 40971 H2 WAT 2823 4.560 125.579 143.221 1.00 0.00 H TER 40973 WAT 2823 ATOM 40973 O WAT 2824 118.847 105.690 3.929 1.00 0.00 O ATOM 40974 H1 WAT 2824 118.208 104.985 4.034 1.00 0.00 H ATOM 40975 H2 WAT 2824 118.885 106.109 4.789 1.00 0.00 H TER 40977 WAT 2824 ATOM 40977 O WAT 2825 112.827 62.321 13.548 1.00 0.00 O ATOM 40978 H1 WAT 2825 112.008 62.313 13.052 1.00 0.00 H ATOM 40979 H2 WAT 2825 112.600 62.738 14.379 1.00 0.00 H TER 40981 WAT 2825 ATOM 40981 O WAT 2826 44.719 134.852 154.869 1.00 0.00 O ATOM 40982 H1 WAT 2826 44.909 135.270 154.029 1.00 0.00 H ATOM 40983 H2 WAT 2826 45.400 134.186 154.965 1.00 0.00 H TER 40985 WAT 2826 ATOM 40985 O WAT 2827 34.914 32.509 138.535 1.00 0.00 O ATOM 40986 H1 WAT 2827 34.972 32.568 137.581 1.00 0.00 H ATOM 40987 H2 WAT 2827 34.964 31.571 138.720 1.00 0.00 H TER 40989 WAT 2827 ATOM 40989 O WAT 2828 61.346 139.529 126.481 1.00 0.00 O ATOM 40990 H1 WAT 2828 61.400 139.087 125.634 1.00 0.00 H ATOM 40991 H2 WAT 2828 60.534 140.032 126.437 1.00 0.00 H TER 40993 WAT 2828 ATOM 40993 O WAT 2829 5.233 108.535 134.251 1.00 0.00 O ATOM 40994 H1 WAT 2829 5.168 107.603 134.045 1.00 0.00 H ATOM 40995 H2 WAT 2829 4.503 108.937 133.779 1.00 0.00 H TER 40997 WAT 2829 ATOM 40997 O WAT 2830 95.323 104.765 70.342 1.00 0.00 O ATOM 40998 H1 WAT 2830 94.888 104.143 70.925 1.00 0.00 H ATOM 40999 H2 WAT 2830 95.971 104.241 69.872 1.00 0.00 H TER 41001 WAT 2830 ATOM 41001 O WAT 2831 71.988 45.683 154.876 1.00 0.00 O ATOM 41002 H1 WAT 2831 72.475 45.644 155.698 1.00 0.00 H ATOM 41003 H2 WAT 2831 72.649 45.887 154.215 1.00 0.00 H TER 41005 WAT 2831 ATOM 41005 O WAT 2832 61.783 118.328 104.571 1.00 0.00 O ATOM 41006 H1 WAT 2832 61.387 118.796 103.836 1.00 0.00 H ATOM 41007 H2 WAT 2832 61.457 117.432 104.487 1.00 0.00 H TER 41009 WAT 2832 ATOM 41009 O WAT 2833 103.645 32.459 85.182 1.00 0.00 O ATOM 41010 H1 WAT 2833 104.021 32.714 86.025 1.00 0.00 H ATOM 41011 H2 WAT 2833 102.951 33.099 85.026 1.00 0.00 H TER 41013 WAT 2833 ATOM 41013 O WAT 2834 88.389 41.556 76.313 1.00 0.00 O ATOM 41014 H1 WAT 2834 89.063 41.977 75.779 1.00 0.00 H ATOM 41015 H2 WAT 2834 87.897 42.283 76.694 1.00 0.00 H TER 41017 WAT 2834 ATOM 41017 O WAT 2835 63.511 53.539 22.582 1.00 0.00 O ATOM 41018 H1 WAT 2835 63.948 53.014 23.253 1.00 0.00 H ATOM 41019 H2 WAT 2835 63.033 54.207 23.073 1.00 0.00 H TER 41021 WAT 2835 ATOM 41021 O WAT 2836 42.465 144.439 92.448 1.00 0.00 O ATOM 41022 H1 WAT 2836 43.407 144.477 92.611 1.00 0.00 H ATOM 41023 H2 WAT 2836 42.083 145.007 93.117 1.00 0.00 H TER 41025 WAT 2836 ATOM 41025 O WAT 2837 42.087 138.005 63.756 1.00 0.00 O ATOM 41026 H1 WAT 2837 42.896 137.665 64.139 1.00 0.00 H ATOM 41027 H2 WAT 2837 41.927 137.445 62.996 1.00 0.00 H TER 41029 WAT 2837 ATOM 41029 O WAT 2838 116.099 100.233 138.274 1.00 0.00 O ATOM 41030 H1 WAT 2838 115.914 100.864 138.971 1.00 0.00 H ATOM 41031 H2 WAT 2838 115.997 99.378 138.692 1.00 0.00 H TER 41033 WAT 2838 ATOM 41033 O WAT 2839 96.424 103.039 127.953 1.00 0.00 O ATOM 41034 H1 WAT 2839 97.132 103.044 127.310 1.00 0.00 H ATOM 41035 H2 WAT 2839 96.685 102.376 128.592 1.00 0.00 H TER 41037 WAT 2839 ATOM 41037 O WAT 2840 108.709 45.780 149.221 1.00 0.00 O ATOM 41038 H1 WAT 2840 108.960 44.953 149.633 1.00 0.00 H ATOM 41039 H2 WAT 2840 107.758 45.817 149.316 1.00 0.00 H TER 41041 WAT 2840 ATOM 41041 O WAT 2841 15.883 87.229 115.612 1.00 0.00 O ATOM 41042 H1 WAT 2841 16.145 87.428 114.713 1.00 0.00 H ATOM 41043 H2 WAT 2841 16.272 86.373 115.792 1.00 0.00 H TER 41045 WAT 2841 ATOM 41045 O WAT 2842 64.476 119.599 117.364 1.00 0.00 O ATOM 41046 H1 WAT 2842 64.239 120.183 116.643 1.00 0.00 H ATOM 41047 H2 WAT 2842 64.562 120.178 118.122 1.00 0.00 H TER 41049 WAT 2842 ATOM 41049 O WAT 2843 71.778 109.517 91.776 1.00 0.00 O ATOM 41050 H1 WAT 2843 71.923 108.667 92.192 1.00 0.00 H ATOM 41051 H2 WAT 2843 71.714 109.319 90.842 1.00 0.00 H TER 41053 WAT 2843 ATOM 41053 O WAT 2844 34.826 88.141 111.780 1.00 0.00 O ATOM 41054 H1 WAT 2844 35.242 87.287 111.896 1.00 0.00 H ATOM 41055 H2 WAT 2844 35.037 88.389 110.879 1.00 0.00 H TER 41057 WAT 2844 ATOM 41057 O WAT 2845 100.860 10.582 91.598 1.00 0.00 O ATOM 41058 H1 WAT 2845 100.254 11.104 92.124 1.00 0.00 H ATOM 41059 H2 WAT 2845 101.725 10.929 91.816 1.00 0.00 H TER 41061 WAT 2845 ATOM 41061 O WAT 2846 77.033 42.921 140.438 1.00 0.00 O ATOM 41062 H1 WAT 2846 76.092 43.054 140.322 1.00 0.00 H ATOM 41063 H2 WAT 2846 77.436 43.448 139.749 1.00 0.00 H TER 41065 WAT 2846 ATOM 41065 O WAT 2847 116.484 16.488 132.093 1.00 0.00 O ATOM 41066 H1 WAT 2847 116.654 17.069 132.835 1.00 0.00 H ATOM 41067 H2 WAT 2847 116.042 17.044 131.451 1.00 0.00 H TER 41069 WAT 2847 ATOM 41069 O WAT 2848 50.795 79.206 101.618 1.00 0.00 O ATOM 41070 H1 WAT 2848 51.438 78.665 101.159 1.00 0.00 H ATOM 41071 H2 WAT 2848 51.108 79.235 102.522 1.00 0.00 H TER 41073 WAT 2848 ATOM 41073 O WAT 2849 98.348 22.801 110.574 1.00 0.00 O ATOM 41074 H1 WAT 2849 98.122 22.626 111.487 1.00 0.00 H ATOM 41075 H2 WAT 2849 97.592 22.489 110.076 1.00 0.00 H TER 41077 WAT 2849 ATOM 41077 O WAT 2850 60.038 27.644 1.275 1.00 0.00 O ATOM 41078 H1 WAT 2850 59.689 27.864 2.139 1.00 0.00 H ATOM 41079 H2 WAT 2850 59.772 28.375 0.717 1.00 0.00 H TER 41081 WAT 2850 ATOM 41081 O WAT 2851 103.982 52.476 61.023 1.00 0.00 O ATOM 41082 H1 WAT 2851 104.253 52.246 61.912 1.00 0.00 H ATOM 41083 H2 WAT 2851 103.100 52.834 61.127 1.00 0.00 H TER 41085 WAT 2851 ATOM 41085 O WAT 2852 115.380 85.539 16.004 1.00 0.00 O ATOM 41086 H1 WAT 2852 114.655 85.641 16.620 1.00 0.00 H ATOM 41087 H2 WAT 2852 116.074 86.095 16.357 1.00 0.00 H TER 41089 WAT 2852 ATOM 41089 O WAT 2853 10.664 32.598 138.878 1.00 0.00 O ATOM 41090 H1 WAT 2853 11.476 33.094 138.777 1.00 0.00 H ATOM 41091 H2 WAT 2853 10.445 32.685 139.806 1.00 0.00 H TER 41093 WAT 2853 ATOM 41093 O WAT 2854 4.153 129.610 130.055 1.00 0.00 O ATOM 41094 H1 WAT 2854 3.543 130.102 129.505 1.00 0.00 H ATOM 41095 H2 WAT 2854 3.767 129.645 130.930 1.00 0.00 H TER 41097 WAT 2854 ATOM 41097 O WAT 2855 76.471 85.972 140.818 1.00 0.00 O ATOM 41098 H1 WAT 2855 76.862 86.845 140.821 1.00 0.00 H ATOM 41099 H2 WAT 2855 75.563 86.116 140.552 1.00 0.00 H TER 41101 WAT 2855 ATOM 41101 O WAT 2856 19.690 24.264 147.455 1.00 0.00 O ATOM 41102 H1 WAT 2856 20.288 24.145 148.193 1.00 0.00 H ATOM 41103 H2 WAT 2856 19.362 23.384 147.269 1.00 0.00 H TER 41105 WAT 2856 ATOM 41105 O WAT 2857 91.810 115.207 55.334 1.00 0.00 O ATOM 41106 H1 WAT 2857 91.348 115.760 54.704 1.00 0.00 H ATOM 41107 H2 WAT 2857 91.140 114.609 55.665 1.00 0.00 H TER 41109 WAT 2857 ATOM 41109 O WAT 2858 11.703 126.554 18.760 1.00 0.00 O ATOM 41110 H1 WAT 2858 12.282 126.873 18.068 1.00 0.00 H ATOM 41111 H2 WAT 2858 11.345 127.347 19.158 1.00 0.00 H TER 41113 WAT 2858 ATOM 41113 O WAT 2859 119.680 126.240 14.760 1.00 0.00 O ATOM 41114 H1 WAT 2859 119.710 125.432 15.273 1.00 0.00 H ATOM 41115 H2 WAT 2859 119.322 126.892 15.362 1.00 0.00 H TER 41117 WAT 2859 ATOM 41117 O WAT 2860 17.541 142.647 86.597 1.00 0.00 O ATOM 41118 H1 WAT 2860 16.750 142.623 87.136 1.00 0.00 H ATOM 41119 H2 WAT 2860 18.161 143.170 87.105 1.00 0.00 H TER 41121 WAT 2860 ATOM 41121 O WAT 2861 100.032 116.065 19.437 1.00 0.00 O ATOM 41122 H1 WAT 2861 100.219 115.328 20.018 1.00 0.00 H ATOM 41123 H2 WAT 2861 99.891 115.664 18.579 1.00 0.00 H TER 41125 WAT 2861 ATOM 41125 O WAT 2862 106.149 69.814 140.766 1.00 0.00 O ATOM 41126 H1 WAT 2862 106.722 69.558 140.043 1.00 0.00 H ATOM 41127 H2 WAT 2862 105.848 70.692 140.533 1.00 0.00 H TER 41129 WAT 2862 ATOM 41129 O WAT 2863 134.608 122.657 130.334 1.00 0.00 O ATOM 41130 H1 WAT 2863 134.881 121.768 130.108 1.00 0.00 H ATOM 41131 H2 WAT 2863 134.958 123.201 129.628 1.00 0.00 H TER 41133 WAT 2863 ATOM 41133 O WAT 2864 79.314 78.435 106.537 1.00 0.00 O ATOM 41134 H1 WAT 2864 79.968 78.986 106.966 1.00 0.00 H ATOM 41135 H2 WAT 2864 79.298 77.632 107.057 1.00 0.00 H TER 41137 WAT 2864 ATOM 41137 O WAT 2865 30.641 124.435 96.161 1.00 0.00 O ATOM 41138 H1 WAT 2865 30.517 124.356 95.215 1.00 0.00 H ATOM 41139 H2 WAT 2865 30.880 125.352 96.295 1.00 0.00 H TER 41141 WAT 2865 ATOM 41141 O WAT 2866 104.625 5.491 125.110 1.00 0.00 O ATOM 41142 H1 WAT 2866 103.794 5.925 124.913 1.00 0.00 H ATOM 41143 H2 WAT 2866 104.406 4.560 125.148 1.00 0.00 H TER 41145 WAT 2866 ATOM 41145 O WAT 2867 31.270 24.941 153.652 1.00 0.00 O ATOM 41146 H1 WAT 2867 30.895 24.387 152.967 1.00 0.00 H ATOM 41147 H2 WAT 2867 31.733 24.331 154.226 1.00 0.00 H TER 41149 WAT 2867 ATOM 41149 O WAT 2868 47.731 96.114 14.835 1.00 0.00 O ATOM 41150 H1 WAT 2868 47.244 95.376 15.202 1.00 0.00 H ATOM 41151 H2 WAT 2868 47.055 96.722 14.537 1.00 0.00 H TER 41153 WAT 2868 ATOM 41153 O WAT 2869 13.996 24.408 135.756 1.00 0.00 O ATOM 41154 H1 WAT 2869 13.162 24.617 136.176 1.00 0.00 H ATOM 41155 H2 WAT 2869 14.588 24.213 136.483 1.00 0.00 H TER 41157 WAT 2869 ATOM 41157 O WAT 2870 21.778 17.210 63.535 1.00 0.00 O ATOM 41158 H1 WAT 2870 21.214 16.524 63.179 1.00 0.00 H ATOM 41159 H2 WAT 2870 22.615 17.089 63.087 1.00 0.00 H TER 41161 WAT 2870 ATOM 41161 O WAT 2871 49.788 137.973 77.925 1.00 0.00 O ATOM 41162 H1 WAT 2871 48.970 138.466 77.861 1.00 0.00 H ATOM 41163 H2 WAT 2871 50.473 138.638 77.862 1.00 0.00 H TER 41165 WAT 2871 ATOM 41165 O WAT 2872 100.838 43.029 99.861 1.00 0.00 O ATOM 41166 H1 WAT 2872 100.031 43.005 99.347 1.00 0.00 H ATOM 41167 H2 WAT 2872 100.784 43.849 100.353 1.00 0.00 H TER 41169 WAT 2872 ATOM 41169 O WAT 2873 36.817 66.741 69.239 1.00 0.00 O ATOM 41170 H1 WAT 2873 36.471 67.496 69.714 1.00 0.00 H ATOM 41171 H2 WAT 2873 36.083 66.437 68.705 1.00 0.00 H TER 41173 WAT 2873 ATOM 41173 O WAT 2874 1.998 10.504 66.296 1.00 0.00 O ATOM 41174 H1 WAT 2874 2.232 11.387 66.582 1.00 0.00 H ATOM 41175 H2 WAT 2874 1.048 10.534 66.177 1.00 0.00 H TER 41177 WAT 2874 ATOM 41177 O WAT 2875 78.515 107.659 65.892 1.00 0.00 O ATOM 41178 H1 WAT 2875 77.856 107.980 66.507 1.00 0.00 H ATOM 41179 H2 WAT 2875 79.346 107.762 66.356 1.00 0.00 H TER 41181 WAT 2875 ATOM 41181 O WAT 2876 48.618 76.503 126.299 1.00 0.00 O ATOM 41182 H1 WAT 2876 48.108 75.965 126.905 1.00 0.00 H ATOM 41183 H2 WAT 2876 48.200 76.368 125.449 1.00 0.00 H TER 41185 WAT 2876 ATOM 41185 O WAT 2877 127.378 43.947 93.974 1.00 0.00 O ATOM 41186 H1 WAT 2877 126.563 43.814 94.459 1.00 0.00 H ATOM 41187 H2 WAT 2877 127.224 43.528 93.128 1.00 0.00 H TER 41189 WAT 2877 ATOM 41189 O WAT 2878 34.212 137.401 125.894 1.00 0.00 O ATOM 41190 H1 WAT 2878 34.440 136.928 125.093 1.00 0.00 H ATOM 41191 H2 WAT 2878 33.626 138.099 125.600 1.00 0.00 H TER 41193 WAT 2878 ATOM 41193 O WAT 2879 125.176 92.148 140.018 1.00 0.00 O ATOM 41194 H1 WAT 2879 124.803 91.334 140.356 1.00 0.00 H ATOM 41195 H2 WAT 2879 125.966 91.873 139.551 1.00 0.00 H TER 41197 WAT 2879 ATOM 41197 O WAT 2880 111.395 43.741 9.251 1.00 0.00 O ATOM 41198 H1 WAT 2880 110.904 44.485 9.600 1.00 0.00 H ATOM 41199 H2 WAT 2880 111.809 44.079 8.456 1.00 0.00 H TER 41201 WAT 2880 ATOM 41201 O WAT 2881 110.841 72.977 60.388 1.00 0.00 O ATOM 41202 H1 WAT 2881 111.507 72.878 59.707 1.00 0.00 H ATOM 41203 H2 WAT 2881 111.191 73.653 60.968 1.00 0.00 H TER 41205 WAT 2881 ATOM 41205 O WAT 2882 37.565 94.118 98.607 1.00 0.00 O ATOM 41206 H1 WAT 2882 37.991 93.698 97.860 1.00 0.00 H ATOM 41207 H2 WAT 2882 38.214 94.741 98.933 1.00 0.00 H TER 41209 WAT 2882 ATOM 41209 O WAT 2883 114.010 31.320 135.380 1.00 0.00 O ATOM 41210 H1 WAT 2883 113.372 31.971 135.089 1.00 0.00 H ATOM 41211 H2 WAT 2883 114.133 30.748 134.622 1.00 0.00 H TER 41213 WAT 2883 ATOM 41213 O WAT 2884 145.960 33.892 143.403 1.00 0.00 O ATOM 41214 H1 WAT 2884 145.022 34.074 143.352 1.00 0.00 H ATOM 41215 H2 WAT 2884 146.370 34.756 143.438 1.00 0.00 H TER 41217 WAT 2884 ATOM 41217 O WAT 2885 134.486 35.292 91.580 1.00 0.00 O ATOM 41218 H1 WAT 2885 133.650 35.181 92.034 1.00 0.00 H ATOM 41219 H2 WAT 2885 134.685 36.224 91.671 1.00 0.00 H TER 41221 WAT 2885 ATOM 41221 O WAT 2886 25.765 137.338 68.124 1.00 0.00 O ATOM 41222 H1 WAT 2886 26.510 137.319 67.524 1.00 0.00 H ATOM 41223 H2 WAT 2886 25.177 136.657 67.798 1.00 0.00 H TER 41225 WAT 2886 ATOM 41225 O WAT 2887 139.916 60.759 65.626 1.00 0.00 O ATOM 41226 H1 WAT 2887 139.944 59.915 66.078 1.00 0.00 H ATOM 41227 H2 WAT 2887 140.778 60.842 65.219 1.00 0.00 H TER 41229 WAT 2887 ATOM 41229 O WAT 2888 33.498 88.061 103.181 1.00 0.00 O ATOM 41230 H1 WAT 2888 34.055 87.283 103.162 1.00 0.00 H ATOM 41231 H2 WAT 2888 33.455 88.303 104.106 1.00 0.00 H TER 41233 WAT 2888 ATOM 41233 O WAT 2889 114.278 5.302 132.390 1.00 0.00 O ATOM 41234 H1 WAT 2889 113.550 5.642 131.869 1.00 0.00 H ATOM 41235 H2 WAT 2889 113.993 4.428 132.657 1.00 0.00 H TER 41237 WAT 2889 ATOM 41237 O WAT 2890 71.845 78.705 99.358 1.00 0.00 O ATOM 41238 H1 WAT 2890 72.503 79.095 98.782 1.00 0.00 H ATOM 41239 H2 WAT 2890 71.388 79.453 99.742 1.00 0.00 H TER 41241 WAT 2890 ATOM 41241 O WAT 2891 61.373 6.847 49.475 1.00 0.00 O ATOM 41242 H1 WAT 2891 62.299 6.820 49.235 1.00 0.00 H ATOM 41243 H2 WAT 2891 61.230 6.043 49.974 1.00 0.00 H TER 41245 WAT 2891 ATOM 41245 O WAT 2892 125.365 57.934 105.230 1.00 0.00 O ATOM 41246 H1 WAT 2892 126.296 58.143 105.151 1.00 0.00 H ATOM 41247 H2 WAT 2892 125.344 57.113 105.721 1.00 0.00 H TER 41249 WAT 2892 ATOM 41249 O WAT 2893 71.240 14.405 72.701 1.00 0.00 O ATOM 41250 H1 WAT 2893 71.334 13.738 73.381 1.00 0.00 H ATOM 41251 H2 WAT 2893 70.659 14.005 72.053 1.00 0.00 H TER 41253 WAT 2893 ATOM 41253 O WAT 2894 51.970 66.459 12.308 1.00 0.00 O ATOM 41254 H1 WAT 2894 51.468 66.994 11.693 1.00 0.00 H ATOM 41255 H2 WAT 2894 52.484 67.091 12.811 1.00 0.00 H TER 41257 WAT 2894 ATOM 41257 O WAT 2895 47.445 120.091 7.417 1.00 0.00 O ATOM 41258 H1 WAT 2895 47.345 120.201 6.471 1.00 0.00 H ATOM 41259 H2 WAT 2895 46.557 120.170 7.762 1.00 0.00 H TER 41261 WAT 2895 ATOM 41261 O WAT 2896 0.704 62.464 112.973 1.00 0.00 O ATOM 41262 H1 WAT 2896 0.354 62.317 112.094 1.00 0.00 H ATOM 41263 H2 WAT 2896 1.518 62.947 112.829 1.00 0.00 H TER 41265 WAT 2896 ATOM 41265 O WAT 2897 74.955 75.161 17.977 1.00 0.00 O ATOM 41266 H1 WAT 2897 75.729 75.276 17.425 1.00 0.00 H ATOM 41267 H2 WAT 2897 75.117 75.722 18.736 1.00 0.00 H TER 41269 WAT 2897 ATOM 41269 O WAT 2898 90.110 105.225 5.470 1.00 0.00 O ATOM 41270 H1 WAT 2898 90.823 105.327 4.839 1.00 0.00 H ATOM 41271 H2 WAT 2898 90.518 105.390 6.321 1.00 0.00 H TER 41273 WAT 2898 ATOM 41273 O WAT 2899 134.593 61.627 99.918 1.00 0.00 O ATOM 41274 H1 WAT 2899 134.862 61.901 100.795 1.00 0.00 H ATOM 41275 H2 WAT 2899 135.236 62.030 99.334 1.00 0.00 H TER 41277 WAT 2899 ATOM 41277 O WAT 2900 130.424 7.933 119.477 1.00 0.00 O ATOM 41278 H1 WAT 2900 131.055 7.722 118.790 1.00 0.00 H ATOM 41279 H2 WAT 2900 130.748 7.471 120.251 1.00 0.00 H TER 41281 WAT 2900 ATOM 41281 O WAT 2901 72.930 117.153 90.506 1.00 0.00 O ATOM 41282 H1 WAT 2901 73.091 117.996 90.931 1.00 0.00 H ATOM 41283 H2 WAT 2901 72.046 116.912 90.781 1.00 0.00 H TER 41285 WAT 2901 ATOM 41285 O WAT 2902 54.522 96.840 22.389 1.00 0.00 O ATOM 41286 H1 WAT 2902 54.685 96.475 23.259 1.00 0.00 H ATOM 41287 H2 WAT 2902 55.370 96.793 21.947 1.00 0.00 H TER 41289 WAT 2902 ATOM 41289 O WAT 2903 41.960 7.519 114.611 1.00 0.00 O ATOM 41290 H1 WAT 2903 41.207 7.746 115.157 1.00 0.00 H ATOM 41291 H2 WAT 2903 42.209 8.343 114.192 1.00 0.00 H TER 41293 WAT 2903 ATOM 41293 O WAT 2904 135.819 26.363 107.374 1.00 0.00 O ATOM 41294 H1 WAT 2904 136.164 26.584 108.239 1.00 0.00 H ATOM 41295 H2 WAT 2904 135.277 25.588 107.523 1.00 0.00 H TER 41297 WAT 2904 ATOM 41297 O WAT 2905 5.516 47.551 69.630 1.00 0.00 O ATOM 41298 H1 WAT 2905 5.898 46.680 69.521 1.00 0.00 H ATOM 41299 H2 WAT 2905 6.138 48.017 70.190 1.00 0.00 H TER 41301 WAT 2905 ATOM 41301 O WAT 2906 31.669 49.491 66.157 1.00 0.00 O ATOM 41302 H1 WAT 2906 32.362 49.559 66.814 1.00 0.00 H ATOM 41303 H2 WAT 2906 32.092 49.081 65.403 1.00 0.00 H TER 41305 WAT 2906 ATOM 41305 O WAT 2907 17.943 73.614 136.549 1.00 0.00 O ATOM 41306 H1 WAT 2907 17.309 74.331 136.568 1.00 0.00 H ATOM 41307 H2 WAT 2907 17.420 72.827 136.698 1.00 0.00 H TER 41309 WAT 2907 ATOM 41309 O WAT 2908 96.939 115.143 149.843 1.00 0.00 O ATOM 41310 H1 WAT 2908 97.554 114.412 149.899 1.00 0.00 H ATOM 41311 H2 WAT 2908 96.084 114.728 149.732 1.00 0.00 H TER 41313 WAT 2908 ATOM 41313 O WAT 2909 64.670 125.733 117.974 1.00 0.00 O ATOM 41314 H1 WAT 2909 65.464 125.840 117.451 1.00 0.00 H ATOM 41315 H2 WAT 2909 64.988 125.594 118.866 1.00 0.00 H TER 41317 WAT 2909 ATOM 41317 O WAT 2910 91.848 65.834 127.749 1.00 0.00 O ATOM 41318 H1 WAT 2910 92.750 65.967 127.458 1.00 0.00 H ATOM 41319 H2 WAT 2910 91.315 66.054 126.984 1.00 0.00 H TER 41321 WAT 2910 ATOM 41321 O WAT 2911 122.366 9.184 128.649 1.00 0.00 O ATOM 41322 H1 WAT 2911 122.041 9.345 129.535 1.00 0.00 H ATOM 41323 H2 WAT 2911 121.641 9.440 128.078 1.00 0.00 H TER 41325 WAT 2911 ATOM 41325 O WAT 2912 67.165 99.038 144.937 1.00 0.00 O ATOM 41326 H1 WAT 2912 66.747 98.826 144.102 1.00 0.00 H ATOM 41327 H2 WAT 2912 68.102 99.050 144.739 1.00 0.00 H TER 41329 WAT 2912 ATOM 41329 O WAT 2913 4.155 90.599 18.244 1.00 0.00 O ATOM 41330 H1 WAT 2913 4.295 91.512 18.497 1.00 0.00 H ATOM 41331 H2 WAT 2913 4.095 90.621 17.289 1.00 0.00 H TER 41333 WAT 2913 ATOM 41333 O WAT 2914 68.747 67.525 103.572 1.00 0.00 O ATOM 41334 H1 WAT 2914 68.554 66.849 104.221 1.00 0.00 H ATOM 41335 H2 WAT 2914 68.359 68.322 103.933 1.00 0.00 H TER 41337 WAT 2914 ATOM 41337 O WAT 2915 58.671 30.508 11.922 1.00 0.00 O ATOM 41338 H1 WAT 2915 59.329 29.962 12.353 1.00 0.00 H ATOM 41339 H2 WAT 2915 58.208 29.908 11.337 1.00 0.00 H TER 41341 WAT 2915 ATOM 41341 O WAT 2916 25.329 25.466 5.860 1.00 0.00 O ATOM 41342 H1 WAT 2916 24.431 25.181 6.030 1.00 0.00 H ATOM 41343 H2 WAT 2916 25.467 25.281 4.931 1.00 0.00 H TER 41345 WAT 2916 ATOM 41345 O WAT 2917 48.276 56.694 99.919 1.00 0.00 O ATOM 41346 H1 WAT 2917 48.845 57.279 99.417 1.00 0.00 H ATOM 41347 H2 WAT 2917 47.422 57.124 99.910 1.00 0.00 H TER 41349 WAT 2917 ATOM 41349 O WAT 2918 119.717 67.839 20.179 1.00 0.00 O ATOM 41350 H1 WAT 2918 119.031 67.416 19.663 1.00 0.00 H ATOM 41351 H2 WAT 2918 120.403 68.044 19.542 1.00 0.00 H TER 41353 WAT 2918 ATOM 41353 O WAT 2919 2.754 85.797 143.518 1.00 0.00 O ATOM 41354 H1 WAT 2919 1.927 85.360 143.315 1.00 0.00 H ATOM 41355 H2 WAT 2919 3.427 85.183 143.225 1.00 0.00 H TER 41357 WAT 2919 ATOM 41357 O WAT 2920 2.477 51.278 108.651 1.00 0.00 O ATOM 41358 H1 WAT 2920 1.913 50.505 108.638 1.00 0.00 H ATOM 41359 H2 WAT 2920 3.093 51.138 107.932 1.00 0.00 H TER 41361 WAT 2920 ATOM 41361 O WAT 2921 145.385 14.355 105.449 1.00 0.00 O ATOM 41362 H1 WAT 2921 144.773 13.818 104.945 1.00 0.00 H ATOM 41363 H2 WAT 2921 145.219 14.115 106.361 1.00 0.00 H TER 41365 WAT 2921 ATOM 41365 O WAT 2922 106.864 75.100 99.963 1.00 0.00 O ATOM 41366 H1 WAT 2922 107.565 75.744 100.062 1.00 0.00 H ATOM 41367 H2 WAT 2922 107.212 74.303 100.362 1.00 0.00 H TER 41369 WAT 2922 ATOM 41369 O WAT 2923 36.413 132.765 125.474 1.00 0.00 O ATOM 41370 H1 WAT 2923 35.564 132.358 125.301 1.00 0.00 H ATOM 41371 H2 WAT 2923 36.420 133.547 124.922 1.00 0.00 H TER 41373 WAT 2923 ATOM 41373 O WAT 2924 65.945 128.290 9.416 1.00 0.00 O ATOM 41374 H1 WAT 2924 66.118 129.208 9.625 1.00 0.00 H ATOM 41375 H2 WAT 2924 65.970 127.843 10.262 1.00 0.00 H TER 41377 WAT 2924 ATOM 41377 O WAT 2925 40.925 87.597 128.556 1.00 0.00 O ATOM 41378 H1 WAT 2925 40.005 87.349 128.645 1.00 0.00 H ATOM 41379 H2 WAT 2925 41.205 87.804 129.448 1.00 0.00 H TER 41381 WAT 2925 ATOM 41381 O WAT 2926 6.300 15.960 60.223 1.00 0.00 O ATOM 41382 H1 WAT 2926 5.434 15.571 60.100 1.00 0.00 H ATOM 41383 H2 WAT 2926 6.908 15.225 60.133 1.00 0.00 H TER 41385 WAT 2926 ATOM 41385 O WAT 2927 3.182 73.004 144.241 1.00 0.00 O ATOM 41386 H1 WAT 2927 3.474 73.160 145.139 1.00 0.00 H ATOM 41387 H2 WAT 2927 2.329 72.579 144.337 1.00 0.00 H TER 41389 WAT 2927 ATOM 41389 O WAT 2928 125.262 58.088 146.177 1.00 0.00 O ATOM 41390 H1 WAT 2928 125.429 57.450 146.871 1.00 0.00 H ATOM 41391 H2 WAT 2928 125.999 57.986 145.575 1.00 0.00 H TER 41393 WAT 2928 ATOM 41393 O WAT 2929 101.674 18.505 58.286 1.00 0.00 O ATOM 41394 H1 WAT 2929 102.579 18.698 58.530 1.00 0.00 H ATOM 41395 H2 WAT 2929 101.509 17.635 58.648 1.00 0.00 H TER 41397 WAT 2929 ATOM 41397 O WAT 2930 117.365 74.964 69.074 1.00 0.00 O ATOM 41398 H1 WAT 2930 118.074 75.595 69.198 1.00 0.00 H ATOM 41399 H2 WAT 2930 117.343 74.465 69.890 1.00 0.00 H TER 41401 WAT 2930 ATOM 41401 O WAT 2931 53.265 23.376 80.656 1.00 0.00 O ATOM 41402 H1 WAT 2931 52.968 22.486 80.470 1.00 0.00 H ATOM 41403 H2 WAT 2931 53.881 23.276 81.382 1.00 0.00 H TER 41405 WAT 2931 ATOM 41405 O WAT 2932 43.949 5.452 136.807 1.00 0.00 O ATOM 41406 H1 WAT 2932 44.170 4.521 136.835 1.00 0.00 H ATOM 41407 H2 WAT 2932 44.136 5.715 135.906 1.00 0.00 H TER 41409 WAT 2932 ATOM 41409 O WAT 2933 26.612 71.593 108.595 1.00 0.00 O ATOM 41410 H1 WAT 2933 26.697 70.695 108.275 1.00 0.00 H ATOM 41411 H2 WAT 2933 27.334 71.696 109.215 1.00 0.00 H TER 41413 WAT 2933 ATOM 41413 O WAT 2934 50.454 121.265 68.644 1.00 0.00 O ATOM 41414 H1 WAT 2934 51.029 121.852 68.155 1.00 0.00 H ATOM 41415 H2 WAT 2934 49.608 121.333 68.200 1.00 0.00 H TER 41417 WAT 2934 ATOM 41417 O WAT 2935 104.344 86.677 141.118 1.00 0.00 O ATOM 41418 H1 WAT 2935 103.654 87.052 141.666 1.00 0.00 H ATOM 41419 H2 WAT 2935 103.998 85.827 140.846 1.00 0.00 H TER 41421 WAT 2935 ATOM 41421 O WAT 2936 79.979 87.380 145.400 1.00 0.00 O ATOM 41422 H1 WAT 2936 79.082 87.417 145.732 1.00 0.00 H ATOM 41423 H2 WAT 2936 79.991 86.614 144.827 1.00 0.00 H TER 41425 WAT 2936 ATOM 41425 O WAT 2937 76.567 39.410 134.103 1.00 0.00 O ATOM 41426 H1 WAT 2937 77.041 38.769 134.632 1.00 0.00 H ATOM 41427 H2 WAT 2937 75.848 39.699 134.664 1.00 0.00 H TER 41429 WAT 2937 ATOM 41429 O WAT 2938 127.924 87.736 127.284 1.00 0.00 O ATOM 41430 H1 WAT 2938 127.077 88.151 127.452 1.00 0.00 H ATOM 41431 H2 WAT 2938 128.296 87.593 128.154 1.00 0.00 H TER 41433 WAT 2938 ATOM 41433 O WAT 2939 38.887 139.396 123.594 1.00 0.00 O ATOM 41434 H1 WAT 2939 39.833 139.448 123.731 1.00 0.00 H ATOM 41435 H2 WAT 2939 38.560 140.258 123.852 1.00 0.00 H TER 41437 WAT 2939 ATOM 41437 O WAT 2940 35.375 61.969 72.849 1.00 0.00 O ATOM 41438 H1 WAT 2940 35.084 62.459 73.618 1.00 0.00 H ATOM 41439 H2 WAT 2940 36.265 62.282 72.688 1.00 0.00 H TER 41441 WAT 2940 ATOM 41441 O WAT 2941 33.626 65.012 63.196 1.00 0.00 O ATOM 41442 H1 WAT 2941 32.739 65.231 62.911 1.00 0.00 H ATOM 41443 H2 WAT 2941 33.794 65.601 63.931 1.00 0.00 H TER 41445 WAT 2941 ATOM 41445 O WAT 2942 11.460 70.698 124.844 1.00 0.00 O ATOM 41446 H1 WAT 2942 11.243 69.926 124.321 1.00 0.00 H ATOM 41447 H2 WAT 2942 12.413 70.767 124.784 1.00 0.00 H TER 41449 WAT 2942 ATOM 41449 O WAT 2943 3.169 119.786 70.651 1.00 0.00 O ATOM 41450 H1 WAT 2943 3.553 118.919 70.527 1.00 0.00 H ATOM 41451 H2 WAT 2943 2.233 119.658 70.498 1.00 0.00 H TER 41453 WAT 2943 ATOM 41453 O WAT 2944 113.904 86.622 126.745 1.00 0.00 O ATOM 41454 H1 WAT 2944 113.662 85.838 126.253 1.00 0.00 H ATOM 41455 H2 WAT 2944 113.559 87.347 126.224 1.00 0.00 H TER 41457 WAT 2944 ATOM 41457 O WAT 2945 26.044 140.082 99.036 1.00 0.00 O ATOM 41458 H1 WAT 2945 25.561 140.663 98.448 1.00 0.00 H ATOM 41459 H2 WAT 2945 26.768 140.618 99.359 1.00 0.00 H TER 41461 WAT 2945 ATOM 41461 O WAT 2946 12.833 84.940 87.517 1.00 0.00 O ATOM 41462 H1 WAT 2946 13.643 84.567 87.866 1.00 0.00 H ATOM 41463 H2 WAT 2946 12.750 85.786 87.956 1.00 0.00 H TER 41465 WAT 2946 ATOM 41465 O WAT 2947 17.759 106.917 96.677 1.00 0.00 O ATOM 41466 H1 WAT 2947 18.623 107.310 96.555 1.00 0.00 H ATOM 41467 H2 WAT 2947 17.897 106.235 97.335 1.00 0.00 H TER 41469 WAT 2947 ATOM 41469 O WAT 2948 23.519 66.074 106.950 1.00 0.00 O ATOM 41470 H1 WAT 2948 23.237 65.911 106.050 1.00 0.00 H ATOM 41471 H2 WAT 2948 23.100 65.382 107.461 1.00 0.00 H TER 41473 WAT 2948 ATOM 41473 O WAT 2949 101.553 106.592 153.288 1.00 0.00 O ATOM 41474 H1 WAT 2949 100.981 107.091 152.704 1.00 0.00 H ATOM 41475 H2 WAT 2949 102.052 107.259 153.760 1.00 0.00 H TER 41477 WAT 2949 ATOM 41477 O WAT 2950 75.890 26.172 68.089 1.00 0.00 O ATOM 41478 H1 WAT 2950 76.724 26.239 67.624 1.00 0.00 H ATOM 41479 H2 WAT 2950 75.267 26.640 67.533 1.00 0.00 H TER 41481 WAT 2950 ATOM 41481 O WAT 2951 144.040 118.566 141.067 1.00 0.00 O ATOM 41482 H1 WAT 2951 144.674 118.980 141.652 1.00 0.00 H ATOM 41483 H2 WAT 2951 143.288 118.372 141.626 1.00 0.00 H TER 41485 WAT 2951 ATOM 41485 O WAT 2952 84.275 118.153 100.209 1.00 0.00 O ATOM 41486 H1 WAT 2952 83.948 117.666 99.453 1.00 0.00 H ATOM 41487 H2 WAT 2952 84.050 119.064 100.023 1.00 0.00 H TER 41489 WAT 2952 ATOM 41489 O WAT 2953 5.367 78.020 11.792 1.00 0.00 O ATOM 41490 H1 WAT 2953 5.551 77.815 12.708 1.00 0.00 H ATOM 41491 H2 WAT 2953 5.328 78.976 11.764 1.00 0.00 H TER 41493 WAT 2953 ATOM 41493 O WAT 2954 110.690 24.887 149.049 1.00 0.00 O ATOM 41494 H1 WAT 2954 111.323 25.181 149.705 1.00 0.00 H ATOM 41495 H2 WAT 2954 110.068 25.610 148.976 1.00 0.00 H TER 41497 WAT 2954 ATOM 41497 O WAT 2955 7.842 87.764 141.760 1.00 0.00 O ATOM 41498 H1 WAT 2955 8.691 87.370 141.556 1.00 0.00 H ATOM 41499 H2 WAT 2955 7.295 87.559 141.001 1.00 0.00 H TER 41501 WAT 2955 ATOM 41501 O WAT 2956 109.765 133.164 1.897 1.00 0.00 O ATOM 41502 H1 WAT 2956 108.965 133.256 2.415 1.00 0.00 H ATOM 41503 H2 WAT 2956 110.472 133.185 2.542 1.00 0.00 H TER 41505 WAT 2956 ATOM 41505 O WAT 2957 8.318 17.327 69.477 1.00 0.00 O ATOM 41506 H1 WAT 2957 8.396 17.037 68.568 1.00 0.00 H ATOM 41507 H2 WAT 2957 7.759 16.670 69.891 1.00 0.00 H TER 41509 WAT 2957 ATOM 41509 O WAT 2958 72.990 141.753 73.720 1.00 0.00 O ATOM 41510 H1 WAT 2958 73.339 142.387 74.347 1.00 0.00 H ATOM 41511 H2 WAT 2958 73.765 141.324 73.357 1.00 0.00 H TER 41513 WAT 2958 ATOM 41513 O WAT 2959 69.338 124.097 153.298 1.00 0.00 O ATOM 41514 H1 WAT 2959 68.941 124.825 153.776 1.00 0.00 H ATOM 41515 H2 WAT 2959 70.154 123.921 153.765 1.00 0.00 H TER 41517 WAT 2959 ATOM 41517 O WAT 2960 86.205 46.963 125.674 1.00 0.00 O ATOM 41518 H1 WAT 2960 86.521 47.344 126.494 1.00 0.00 H ATOM 41519 H2 WAT 2960 86.573 46.079 125.665 1.00 0.00 H TER 41521 WAT 2960 ATOM 41521 O WAT 2961 140.391 54.220 125.577 1.00 0.00 O ATOM 41522 H1 WAT 2961 139.589 53.706 125.674 1.00 0.00 H ATOM 41523 H2 WAT 2961 141.092 53.568 125.554 1.00 0.00 H TER 41525 WAT 2961 ATOM 41525 O WAT 2962 91.378 7.471 116.487 1.00 0.00 O ATOM 41526 H1 WAT 2962 92.330 7.527 116.574 1.00 0.00 H ATOM 41527 H2 WAT 2962 91.224 6.621 116.077 1.00 0.00 H TER 41529 WAT 2962 ATOM 41529 O WAT 2963 39.211 59.785 84.603 1.00 0.00 O ATOM 41530 H1 WAT 2963 38.512 59.148 84.748 1.00 0.00 H ATOM 41531 H2 WAT 2963 38.880 60.596 84.989 1.00 0.00 H TER 41533 WAT 2963 ATOM 41533 O WAT 2964 139.311 41.086 88.714 1.00 0.00 O ATOM 41534 H1 WAT 2964 139.225 40.576 89.519 1.00 0.00 H ATOM 41535 H2 WAT 2964 139.986 41.736 88.913 1.00 0.00 H TER 41537 WAT 2964 ATOM 41537 O WAT 2965 11.059 11.283 0.287 1.00 0.00 O ATOM 41538 H1 WAT 2965 11.226 11.017 -0.617 1.00 0.00 H ATOM 41539 H2 WAT 2965 10.238 11.774 0.244 1.00 0.00 H TER 41541 WAT 2965 ATOM 41541 O WAT 2966 39.182 116.534 86.475 1.00 0.00 O ATOM 41542 H1 WAT 2966 39.874 116.926 87.009 1.00 0.00 H ATOM 41543 H2 WAT 2966 38.636 116.060 87.101 1.00 0.00 H TER 41545 WAT 2966 ATOM 41545 O WAT 2967 39.608 89.788 110.184 1.00 0.00 O ATOM 41546 H1 WAT 2967 40.514 89.722 110.486 1.00 0.00 H ATOM 41547 H2 WAT 2967 39.467 90.726 110.055 1.00 0.00 H TER 41549 WAT 2967 ATOM 41549 O WAT 2968 26.037 27.787 130.469 1.00 0.00 O ATOM 41550 H1 WAT 2968 26.978 27.613 130.430 1.00 0.00 H ATOM 41551 H2 WAT 2968 25.631 26.981 130.150 1.00 0.00 H TER 41553 WAT 2968 ATOM 41553 O WAT 2969 68.033 56.945 17.086 1.00 0.00 O ATOM 41554 H1 WAT 2969 68.060 57.901 17.123 1.00 0.00 H ATOM 41555 H2 WAT 2969 67.652 56.683 17.924 1.00 0.00 H TER 41557 WAT 2969 ATOM 41557 O WAT 2970 41.831 113.013 107.493 1.00 0.00 O ATOM 41558 H1 WAT 2970 41.547 112.664 106.648 1.00 0.00 H ATOM 41559 H2 WAT 2970 42.411 113.740 107.269 1.00 0.00 H TER 41561 WAT 2970 ATOM 41561 O WAT 2971 105.663 24.845 4.312 1.00 0.00 O ATOM 41562 H1 WAT 2971 105.608 24.329 5.116 1.00 0.00 H ATOM 41563 H2 WAT 2971 105.265 24.289 3.643 1.00 0.00 H TER 41565 WAT 2971 ATOM 41565 O WAT 2972 57.938 131.928 51.486 1.00 0.00 O ATOM 41566 H1 WAT 2972 58.600 131.846 52.173 1.00 0.00 H ATOM 41567 H2 WAT 2972 57.202 131.403 51.800 1.00 0.00 H TER 41569 WAT 2972 ATOM 41569 O WAT 2973 54.828 108.031 142.895 1.00 0.00 O ATOM 41570 H1 WAT 2973 54.009 107.845 142.435 1.00 0.00 H ATOM 41571 H2 WAT 2973 54.737 107.583 143.735 1.00 0.00 H TER 41573 WAT 2973 ATOM 41573 O WAT 2974 23.153 52.178 104.632 1.00 0.00 O ATOM 41574 H1 WAT 2974 22.322 52.186 105.108 1.00 0.00 H ATOM 41575 H2 WAT 2974 23.750 52.683 105.184 1.00 0.00 H TER 41577 WAT 2974 ATOM 41577 O WAT 2975 144.463 5.938 63.959 1.00 0.00 O ATOM 41578 H1 WAT 2975 144.742 5.446 63.187 1.00 0.00 H ATOM 41579 H2 WAT 2975 145.275 6.115 64.436 1.00 0.00 H TER 41581 WAT 2975 ATOM 41581 O WAT 2976 56.443 68.034 66.971 1.00 0.00 O ATOM 41582 H1 WAT 2976 56.932 68.754 66.571 1.00 0.00 H ATOM 41583 H2 WAT 2976 55.537 68.182 66.702 1.00 0.00 H TER 41585 WAT 2976 ATOM 41585 O WAT 2977 31.903 104.457 79.935 1.00 0.00 O ATOM 41586 H1 WAT 2977 31.726 103.551 79.683 1.00 0.00 H ATOM 41587 H2 WAT 2977 32.758 104.423 80.364 1.00 0.00 H TER 41589 WAT 2977 ATOM 41589 O WAT 2978 131.023 5.248 82.217 1.00 0.00 O ATOM 41590 H1 WAT 2978 131.665 5.020 82.889 1.00 0.00 H ATOM 41591 H2 WAT 2978 131.355 4.836 81.419 1.00 0.00 H TER 41593 WAT 2978 ATOM 41593 O WAT 2979 107.919 126.140 2.826 1.00 0.00 O ATOM 41594 H1 WAT 2979 108.358 125.459 3.336 1.00 0.00 H ATOM 41595 H2 WAT 2979 108.628 126.593 2.370 1.00 0.00 H TER 41597 WAT 2979 ATOM 41597 O WAT 2980 91.431 31.168 112.816 1.00 0.00 O ATOM 41598 H1 WAT 2980 92.148 30.574 113.038 1.00 0.00 H ATOM 41599 H2 WAT 2980 91.718 32.022 113.138 1.00 0.00 H TER 41601 WAT 2980 ATOM 41601 O WAT 2981 132.203 84.266 80.431 1.00 0.00 O ATOM 41602 H1 WAT 2981 132.790 83.980 79.731 1.00 0.00 H ATOM 41603 H2 WAT 2981 131.331 84.008 80.133 1.00 0.00 H TER 41605 WAT 2981 ATOM 41605 O WAT 2982 83.026 102.430 57.019 1.00 0.00 O ATOM 41606 H1 WAT 2982 83.126 103.319 56.677 1.00 0.00 H ATOM 41607 H2 WAT 2982 82.096 102.360 57.234 1.00 0.00 H TER 41609 WAT 2982 ATOM 41609 O WAT 2983 22.443 88.989 115.566 1.00 0.00 O ATOM 41610 H1 WAT 2983 21.513 88.761 115.578 1.00 0.00 H ATOM 41611 H2 WAT 2983 22.698 88.905 114.648 1.00 0.00 H TER 41613 WAT 2983 ATOM 41613 O WAT 2984 66.535 58.115 130.033 1.00 0.00 O ATOM 41614 H1 WAT 2984 66.885 58.698 130.707 1.00 0.00 H ATOM 41615 H2 WAT 2984 66.307 58.697 129.308 1.00 0.00 H TER 41617 WAT 2984 ATOM 41617 O WAT 2985 93.290 93.065 134.263 1.00 0.00 O ATOM 41618 H1 WAT 2985 92.660 93.654 134.679 1.00 0.00 H ATOM 41619 H2 WAT 2985 92.771 92.303 134.005 1.00 0.00 H TER 41621 WAT 2985 ATOM 41621 O WAT 2986 15.115 59.002 127.900 1.00 0.00 O ATOM 41622 H1 WAT 2986 14.661 59.340 128.672 1.00 0.00 H ATOM 41623 H2 WAT 2986 15.358 58.107 128.137 1.00 0.00 H TER 41625 WAT 2986 ATOM 41625 O WAT 2987 56.168 123.134 117.298 1.00 0.00 O ATOM 41626 H1 WAT 2987 56.684 123.732 116.757 1.00 0.00 H ATOM 41627 H2 WAT 2987 56.446 122.261 117.023 1.00 0.00 H TER 41629 WAT 2987 ATOM 41629 O WAT 2988 63.017 85.240 121.091 1.00 0.00 O ATOM 41630 H1 WAT 2988 62.181 84.949 121.455 1.00 0.00 H ATOM 41631 H2 WAT 2988 63.303 85.941 121.677 1.00 0.00 H TER 41633 WAT 2988 ATOM 41633 O WAT 2989 54.018 112.393 105.973 1.00 0.00 O ATOM 41634 H1 WAT 2989 53.900 111.947 106.812 1.00 0.00 H ATOM 41635 H2 WAT 2989 54.918 112.718 105.999 1.00 0.00 H TER 41637 WAT 2989 ATOM 41637 O WAT 2990 81.958 42.611 115.659 1.00 0.00 O ATOM 41638 H1 WAT 2990 82.366 42.752 116.513 1.00 0.00 H ATOM 41639 H2 WAT 2990 81.041 42.421 115.859 1.00 0.00 H TER 41641 WAT 2990 ATOM 41641 O WAT 2991 70.156 144.003 114.219 1.00 0.00 O ATOM 41642 H1 WAT 2991 69.873 143.976 113.304 1.00 0.00 H ATOM 41643 H2 WAT 2991 71.001 143.554 114.221 1.00 0.00 H TER 41645 WAT 2991 ATOM 41645 O WAT 2992 72.486 114.840 154.289 1.00 0.00 O ATOM 41646 H1 WAT 2992 71.692 115.338 154.484 1.00 0.00 H ATOM 41647 H2 WAT 2992 73.120 115.500 154.010 1.00 0.00 H TER 41649 WAT 2992 ATOM 41649 O WAT 2993 49.674 68.727 137.858 1.00 0.00 O ATOM 41650 H1 WAT 2993 49.438 69.647 137.740 1.00 0.00 H ATOM 41651 H2 WAT 2993 48.925 68.344 138.314 1.00 0.00 H TER 41653 WAT 2993 ATOM 41653 O WAT 2994 116.098 104.738 151.240 1.00 0.00 O ATOM 41654 H1 WAT 2994 116.990 104.882 150.923 1.00 0.00 H ATOM 41655 H2 WAT 2994 115.686 105.601 151.197 1.00 0.00 H TER 41657 WAT 2994 ATOM 41657 O WAT 2995 79.047 105.275 141.835 1.00 0.00 O ATOM 41658 H1 WAT 2995 79.456 106.009 142.294 1.00 0.00 H ATOM 41659 H2 WAT 2995 78.210 105.621 141.527 1.00 0.00 H TER 41661 WAT 2995 ATOM 41661 O WAT 2996 74.273 11.989 125.947 1.00 0.00 O ATOM 41662 H1 WAT 2996 73.320 12.004 125.856 1.00 0.00 H ATOM 41663 H2 WAT 2996 74.429 11.481 126.743 1.00 0.00 H TER 41665 WAT 2996 ATOM 41665 O WAT 2997 83.545 1.083 91.524 1.00 0.00 O ATOM 41666 H1 WAT 2997 82.941 0.593 90.965 1.00 0.00 H ATOM 41667 H2 WAT 2997 83.960 0.415 92.070 1.00 0.00 H TER 41669 WAT 2997 ATOM 41669 O WAT 2998 103.451 11.514 81.505 1.00 0.00 O ATOM 41670 H1 WAT 2998 103.421 11.295 80.573 1.00 0.00 H ATOM 41671 H2 WAT 2998 102.591 11.892 81.690 1.00 0.00 H TER 41673 WAT 2998 ATOM 41673 O WAT 2999 45.899 142.070 9.546 1.00 0.00 O ATOM 41674 H1 WAT 2999 46.108 142.989 9.713 1.00 0.00 H ATOM 41675 H2 WAT 2999 46.110 141.941 8.621 1.00 0.00 H TER 41677 WAT 2999 ATOM 41677 O WAT 3000 137.167 104.656 103.663 1.00 0.00 O ATOM 41678 H1 WAT 3000 137.997 104.300 103.345 1.00 0.00 H ATOM 41679 H2 WAT 3000 137.031 104.229 104.509 1.00 0.00 H TER 41681 WAT 3000 ATOM 41681 O WAT 3001 102.617 140.085 156.618 1.00 0.00 O ATOM 41682 H1 WAT 3001 103.032 140.140 155.757 1.00 0.00 H ATOM 41683 H2 WAT 3001 102.876 140.894 157.060 1.00 0.00 H TER 41685 WAT 3001 ATOM 41685 O WAT 3002 14.063 23.459 126.940 1.00 0.00 O ATOM 41686 H1 WAT 3002 14.098 24.361 127.259 1.00 0.00 H ATOM 41687 H2 WAT 3002 13.180 23.162 127.160 1.00 0.00 H TER 41689 WAT 3002 ATOM 41689 O WAT 3003 112.425 102.911 99.337 1.00 0.00 O ATOM 41690 H1 WAT 3003 112.244 103.701 99.846 1.00 0.00 H ATOM 41691 H2 WAT 3003 112.820 103.233 98.527 1.00 0.00 H TER 41693 WAT 3003 ATOM 41693 O WAT 3004 73.560 32.826 136.674 1.00 0.00 O ATOM 41694 H1 WAT 3004 74.081 32.977 137.462 1.00 0.00 H ATOM 41695 H2 WAT 3004 73.906 33.449 136.035 1.00 0.00 H TER 41697 WAT 3004 ATOM 41697 O WAT 3005 15.416 91.780 86.747 1.00 0.00 O ATOM 41698 H1 WAT 3005 14.666 91.529 86.208 1.00 0.00 H ATOM 41699 H2 WAT 3005 15.328 91.252 87.540 1.00 0.00 H TER 41701 WAT 3005 ATOM 41701 O WAT 3006 27.707 95.114 91.571 1.00 0.00 O ATOM 41702 H1 WAT 3006 27.475 95.954 91.175 1.00 0.00 H ATOM 41703 H2 WAT 3006 27.000 94.939 92.192 1.00 0.00 H TER 41705 WAT 3006 ATOM 41705 O WAT 3007 12.211 75.665 113.909 1.00 0.00 O ATOM 41706 H1 WAT 3007 11.357 75.457 114.287 1.00 0.00 H ATOM 41707 H2 WAT 3007 12.197 75.255 113.044 1.00 0.00 H TER 41709 WAT 3007 ATOM 41709 O WAT 3008 122.082 125.501 56.829 1.00 0.00 O ATOM 41710 H1 WAT 3008 122.591 126.126 56.311 1.00 0.00 H ATOM 41711 H2 WAT 3008 122.436 125.580 57.715 1.00 0.00 H TER 41713 WAT 3008 ATOM 41713 O WAT 3009 130.743 121.783 89.305 1.00 0.00 O ATOM 41714 H1 WAT 3009 130.185 121.062 89.595 1.00 0.00 H ATOM 41715 H2 WAT 3009 131.226 122.042 90.089 1.00 0.00 H TER 41717 WAT 3009 ATOM 41717 O WAT 3010 139.315 57.983 2.079 1.00 0.00 O ATOM 41718 H1 WAT 3010 139.176 57.318 2.753 1.00 0.00 H ATOM 41719 H2 WAT 3010 140.267 58.054 2.005 1.00 0.00 H TER 41721 WAT 3010 ATOM 41721 O WAT 3011 109.162 90.000 135.679 1.00 0.00 O ATOM 41722 H1 WAT 3011 109.144 90.829 136.158 1.00 0.00 H ATOM 41723 H2 WAT 3011 110.087 89.754 135.661 1.00 0.00 H TER 41725 WAT 3011 ATOM 41725 O WAT 3012 35.740 145.188 101.354 1.00 0.00 O ATOM 41726 H1 WAT 3012 35.148 145.872 101.042 1.00 0.00 H ATOM 41727 H2 WAT 3012 35.647 144.481 100.716 1.00 0.00 H TER 41729 WAT 3012 ATOM 41729 O WAT 3013 97.263 43.861 93.327 1.00 0.00 O ATOM 41730 H1 WAT 3013 97.943 44.535 93.365 1.00 0.00 H ATOM 41731 H2 WAT 3013 97.176 43.557 94.230 1.00 0.00 H TER 41733 WAT 3013 ATOM 41733 O WAT 3014 77.006 139.339 67.112 1.00 0.00 O ATOM 41734 H1 WAT 3014 77.285 139.324 66.197 1.00 0.00 H ATOM 41735 H2 WAT 3014 76.728 140.242 67.263 1.00 0.00 H TER 41737 WAT 3014 ATOM 41737 O WAT 3015 58.322 143.393 133.496 1.00 0.00 O ATOM 41738 H1 WAT 3015 58.026 144.000 132.817 1.00 0.00 H ATOM 41739 H2 WAT 3015 59.239 143.222 133.280 1.00 0.00 H TER 41741 WAT 3015 ATOM 41741 O WAT 3016 138.291 14.218 12.946 1.00 0.00 O ATOM 41742 H1 WAT 3016 137.855 14.961 13.364 1.00 0.00 H ATOM 41743 H2 WAT 3016 137.988 13.455 13.438 1.00 0.00 H TER 41745 WAT 3016 ATOM 41745 O WAT 3017 3.229 33.063 95.471 1.00 0.00 O ATOM 41746 H1 WAT 3017 3.934 32.675 94.952 1.00 0.00 H ATOM 41747 H2 WAT 3017 2.557 32.382 95.509 1.00 0.00 H TER 41749 WAT 3017 ATOM 41749 O WAT 3018 122.092 92.724 81.330 1.00 0.00 O ATOM 41750 H1 WAT 3018 121.635 92.014 80.879 1.00 0.00 H ATOM 41751 H2 WAT 3018 122.380 92.337 82.156 1.00 0.00 H TER 41753 WAT 3018 ATOM 41753 O WAT 3019 89.166 130.790 106.805 1.00 0.00 O ATOM 41754 H1 WAT 3019 88.898 130.043 107.340 1.00 0.00 H ATOM 41755 H2 WAT 3019 89.517 130.398 106.006 1.00 0.00 H TER 41757 WAT 3019 ATOM 41757 O WAT 3020 78.629 104.913 66.040 1.00 0.00 O ATOM 41758 H1 WAT 3020 78.364 105.830 65.966 1.00 0.00 H ATOM 41759 H2 WAT 3020 79.585 104.942 66.080 1.00 0.00 H TER 41761 WAT 3020 ATOM 41761 O WAT 3021 134.482 74.268 131.008 1.00 0.00 O ATOM 41762 H1 WAT 3021 135.250 74.487 130.481 1.00 0.00 H ATOM 41763 H2 WAT 3021 133.762 74.230 130.378 1.00 0.00 H TER 41765 WAT 3021 ATOM 41765 O WAT 3022 82.630 37.960 7.287 1.00 0.00 O ATOM 41766 H1 WAT 3022 82.253 37.398 7.964 1.00 0.00 H ATOM 41767 H2 WAT 3022 82.448 38.851 7.586 1.00 0.00 H TER 41769 WAT 3022 ATOM 41769 O WAT 3023 145.062 21.583 72.249 1.00 0.00 O ATOM 41770 H1 WAT 3023 144.601 21.872 71.462 1.00 0.00 H ATOM 41771 H2 WAT 3023 145.702 22.274 72.419 1.00 0.00 H TER 41773 WAT 3023 ATOM 41773 O WAT 3024 39.381 86.809 157.621 1.00 0.00 O ATOM 41774 H1 WAT 3024 38.985 85.949 157.761 1.00 0.00 H ATOM 41775 H2 WAT 3024 38.647 87.421 157.667 1.00 0.00 H TER 41777 WAT 3024 ATOM 41777 O WAT 3025 48.118 105.806 3.077 1.00 0.00 O ATOM 41778 H1 WAT 3025 48.436 106.449 2.443 1.00 0.00 H ATOM 41779 H2 WAT 3025 47.686 105.138 2.545 1.00 0.00 H TER 41781 WAT 3025 ATOM 41781 O WAT 3026 73.415 94.341 70.815 1.00 0.00 O ATOM 41782 H1 WAT 3026 72.482 94.128 70.801 1.00 0.00 H ATOM 41783 H2 WAT 3026 73.804 93.672 71.378 1.00 0.00 H TER 41785 WAT 3026 ATOM 41785 O WAT 3027 90.177 56.934 84.044 1.00 0.00 O ATOM 41786 H1 WAT 3027 89.247 57.016 83.834 1.00 0.00 H ATOM 41787 H2 WAT 3027 90.421 56.068 83.717 1.00 0.00 H TER 41789 WAT 3027 ATOM 41789 O WAT 3028 117.626 136.937 129.538 1.00 0.00 O ATOM 41790 H1 WAT 3028 116.978 137.594 129.792 1.00 0.00 H ATOM 41791 H2 WAT 3028 118.086 136.727 130.350 1.00 0.00 H TER 41793 WAT 3028 ATOM 41793 O WAT 3029 22.670 92.454 133.061 1.00 0.00 O ATOM 41794 H1 WAT 3029 22.135 91.671 133.189 1.00 0.00 H ATOM 41795 H2 WAT 3029 22.492 92.995 133.831 1.00 0.00 H TER 41797 WAT 3029 ATOM 41797 O WAT 3030 53.279 35.640 106.288 1.00 0.00 O ATOM 41798 H1 WAT 3030 52.903 34.801 106.555 1.00 0.00 H ATOM 41799 H2 WAT 3030 54.191 35.438 106.080 1.00 0.00 H TER 41801 WAT 3030 ATOM 41801 O WAT 3031 49.907 88.378 124.649 1.00 0.00 O ATOM 41802 H1 WAT 3031 50.688 87.826 124.696 1.00 0.00 H ATOM 41803 H2 WAT 3031 50.248 89.270 124.586 1.00 0.00 H TER 41805 WAT 3031 ATOM 41805 O WAT 3032 120.355 121.086 72.375 1.00 0.00 O ATOM 41806 H1 WAT 3032 119.841 121.744 72.842 1.00 0.00 H ATOM 41807 H2 WAT 3032 121.181 121.526 72.173 1.00 0.00 H TER 41809 WAT 3032 ATOM 41809 O WAT 3033 87.863 43.009 106.246 1.00 0.00 O ATOM 41810 H1 WAT 3033 88.306 42.165 106.158 1.00 0.00 H ATOM 41811 H2 WAT 3033 88.351 43.466 106.931 1.00 0.00 H TER 41813 WAT 3033 ATOM 41813 O WAT 3034 140.059 141.917 77.551 1.00 0.00 O ATOM 41814 H1 WAT 3034 140.742 141.261 77.413 1.00 0.00 H ATOM 41815 H2 WAT 3034 139.469 141.809 76.805 1.00 0.00 H TER 41817 WAT 3034 ATOM 41817 O WAT 3035 36.394 20.614 150.186 1.00 0.00 O ATOM 41818 H1 WAT 3035 37.168 20.091 149.976 1.00 0.00 H ATOM 41819 H2 WAT 3035 35.942 20.720 149.349 1.00 0.00 H TER 41821 WAT 3035 ATOM 41821 O WAT 3036 41.354 123.003 95.524 1.00 0.00 O ATOM 41822 H1 WAT 3036 42.145 122.587 95.868 1.00 0.00 H ATOM 41823 H2 WAT 3036 41.084 123.611 96.213 1.00 0.00 H TER 41825 WAT 3036 ATOM 41825 O WAT 3037 82.663 58.052 98.732 1.00 0.00 O ATOM 41826 H1 WAT 3037 83.503 58.446 98.497 1.00 0.00 H ATOM 41827 H2 WAT 3037 82.127 58.142 97.944 1.00 0.00 H TER 41829 WAT 3037 ATOM 41829 O WAT 3038 72.345 9.077 151.382 1.00 0.00 O ATOM 41830 H1 WAT 3038 72.180 9.167 150.443 1.00 0.00 H ATOM 41831 H2 WAT 3038 71.654 8.492 151.692 1.00 0.00 H TER 41833 WAT 3038 ATOM 41833 O WAT 3039 74.762 133.730 149.693 1.00 0.00 O ATOM 41834 H1 WAT 3039 74.050 133.539 149.082 1.00 0.00 H ATOM 41835 H2 WAT 3039 74.372 133.613 150.559 1.00 0.00 H TER 41837 WAT 3039 ATOM 41837 O WAT 3040 99.121 15.241 158.204 1.00 0.00 O ATOM 41838 H1 WAT 3040 99.603 15.372 159.021 1.00 0.00 H ATOM 41839 H2 WAT 3040 98.429 15.901 158.226 1.00 0.00 H TER 41841 WAT 3040 ATOM 41841 O WAT 3041 145.928 74.831 125.451 1.00 0.00 O ATOM 41842 H1 WAT 3041 145.436 74.011 125.397 1.00 0.00 H ATOM 41843 H2 WAT 3041 145.257 75.514 125.440 1.00 0.00 H TER 41845 WAT 3041 ATOM 41845 O WAT 3042 109.987 140.566 142.149 1.00 0.00 O ATOM 41846 H1 WAT 3042 109.307 140.801 141.518 1.00 0.00 H ATOM 41847 H2 WAT 3042 110.765 140.404 141.615 1.00 0.00 H TER 41849 WAT 3042 ATOM 41849 O WAT 3043 57.728 27.059 138.331 1.00 0.00 O ATOM 41850 H1 WAT 3043 58.456 27.428 137.831 1.00 0.00 H ATOM 41851 H2 WAT 3043 57.629 26.170 137.990 1.00 0.00 H TER 41853 WAT 3043 ATOM 41853 O WAT 3044 10.391 1.317 155.049 1.00 0.00 O ATOM 41854 H1 WAT 3044 10.311 1.333 156.003 1.00 0.00 H ATOM 41855 H2 WAT 3044 9.671 0.757 154.758 1.00 0.00 H TER 41857 WAT 3044 ATOM 41857 O WAT 3045 106.502 80.506 12.853 1.00 0.00 O ATOM 41858 H1 WAT 3045 106.251 80.338 11.945 1.00 0.00 H ATOM 41859 H2 WAT 3045 106.709 79.641 13.208 1.00 0.00 H TER 41861 WAT 3045 ATOM 41861 O WAT 3046 24.740 36.844 122.045 1.00 0.00 O ATOM 41862 H1 WAT 3046 24.790 37.198 122.933 1.00 0.00 H ATOM 41863 H2 WAT 3046 24.647 37.615 121.485 1.00 0.00 H TER 41865 WAT 3046 ATOM 41865 O WAT 3047 94.368 124.474 23.724 1.00 0.00 O ATOM 41866 H1 WAT 3047 94.025 124.977 24.462 1.00 0.00 H ATOM 41867 H2 WAT 3047 93.989 124.893 22.952 1.00 0.00 H TER 41869 WAT 3047 ATOM 41869 O WAT 3048 73.054 67.678 23.857 1.00 0.00 O ATOM 41870 H1 WAT 3048 73.232 68.616 23.797 1.00 0.00 H ATOM 41871 H2 WAT 3048 73.917 67.267 23.814 1.00 0.00 H TER 41873 WAT 3048 ATOM 41873 O WAT 3049 72.064 90.738 99.948 1.00 0.00 O ATOM 41874 H1 WAT 3049 71.128 90.933 99.998 1.00 0.00 H ATOM 41875 H2 WAT 3049 72.228 90.587 99.018 1.00 0.00 H TER 41877 WAT 3049 ATOM 41877 O WAT 3050 6.884 30.687 119.368 1.00 0.00 O ATOM 41878 H1 WAT 3050 6.999 31.298 120.096 1.00 0.00 H ATOM 41879 H2 WAT 3050 5.939 30.668 119.218 1.00 0.00 H TER 41881 WAT 3050 ATOM 41881 O WAT 3051 139.704 26.098 70.614 1.00 0.00 O ATOM 41882 H1 WAT 3051 140.021 26.726 71.264 1.00 0.00 H ATOM 41883 H2 WAT 3051 140.290 25.347 70.701 1.00 0.00 H TER 41885 WAT 3051 ATOM 41885 O WAT 3052 37.271 38.835 78.847 1.00 0.00 O ATOM 41886 H1 WAT 3052 37.547 37.918 78.852 1.00 0.00 H ATOM 41887 H2 WAT 3052 37.822 39.254 79.508 1.00 0.00 H TER 41889 WAT 3052 ATOM 41889 O WAT 3053 51.284 141.344 131.314 1.00 0.00 O ATOM 41890 H1 WAT 3053 50.385 141.507 131.600 1.00 0.00 H ATOM 41891 H2 WAT 3053 51.193 140.775 130.550 1.00 0.00 H TER 41893 WAT 3053 ATOM 41893 O WAT 3054 50.552 17.879 96.103 1.00 0.00 O ATOM 41894 H1 WAT 3054 50.179 18.689 96.451 1.00 0.00 H ATOM 41895 H2 WAT 3054 51.222 18.171 95.486 1.00 0.00 H TER 41897 WAT 3054 ATOM 41897 O WAT 3055 5.439 83.509 91.418 1.00 0.00 O ATOM 41898 H1 WAT 3055 5.501 83.150 92.303 1.00 0.00 H ATOM 41899 H2 WAT 3055 6.022 82.959 90.895 1.00 0.00 H TER 41901 WAT 3055 ATOM 41901 O WAT 3056 103.587 91.670 94.553 1.00 0.00 O ATOM 41902 H1 WAT 3056 103.553 91.450 93.622 1.00 0.00 H ATOM 41903 H2 WAT 3056 103.789 92.605 94.571 1.00 0.00 H TER 41905 WAT 3056 ATOM 41905 O WAT 3057 62.147 17.288 129.997 1.00 0.00 O ATOM 41906 H1 WAT 3057 63.051 17.331 130.309 1.00 0.00 H ATOM 41907 H2 WAT 3057 62.199 16.792 129.180 1.00 0.00 H TER 41909 WAT 3057 ATOM 41909 O WAT 3058 111.588 78.093 69.596 1.00 0.00 O ATOM 41910 H1 WAT 3058 111.255 77.195 69.595 1.00 0.00 H ATOM 41911 H2 WAT 3058 111.471 78.390 70.499 1.00 0.00 H TER 41913 WAT 3058 ATOM 41913 O WAT 3059 118.625 49.614 100.937 1.00 0.00 O ATOM 41914 H1 WAT 3059 119.239 50.327 101.115 1.00 0.00 H ATOM 41915 H2 WAT 3059 118.497 49.640 99.988 1.00 0.00 H TER 41917 WAT 3059 ATOM 41917 O WAT 3060 69.098 33.066 149.296 1.00 0.00 O ATOM 41918 H1 WAT 3060 69.850 32.744 149.793 1.00 0.00 H ATOM 41919 H2 WAT 3060 68.376 33.059 149.924 1.00 0.00 H TER 41921 WAT 3060 ATOM 41921 O WAT 3061 60.382 118.058 126.368 1.00 0.00 O ATOM 41922 H1 WAT 3061 60.583 118.947 126.661 1.00 0.00 H ATOM 41923 H2 WAT 3061 60.594 117.504 127.120 1.00 0.00 H TER 41925 WAT 3061 ATOM 41925 O WAT 3062 107.891 141.540 111.263 1.00 0.00 O ATOM 41926 H1 WAT 3062 108.662 142.083 111.429 1.00 0.00 H ATOM 41927 H2 WAT 3062 107.157 142.153 111.292 1.00 0.00 H TER 41929 WAT 3062 ATOM 41929 O WAT 3063 43.835 36.590 90.377 1.00 0.00 O ATOM 41930 H1 WAT 3063 43.931 36.449 89.435 1.00 0.00 H ATOM 41931 H2 WAT 3063 42.909 36.802 90.493 1.00 0.00 H TER 41933 WAT 3063 ATOM 41933 O WAT 3064 137.077 118.209 107.690 1.00 0.00 O ATOM 41934 H1 WAT 3064 137.871 117.688 107.806 1.00 0.00 H ATOM 41935 H2 WAT 3064 137.370 119.116 107.784 1.00 0.00 H TER 41937 WAT 3064 ATOM 41937 O WAT 3065 127.917 25.996 126.786 1.00 0.00 O ATOM 41938 H1 WAT 3065 128.524 25.980 126.045 1.00 0.00 H ATOM 41939 H2 WAT 3065 127.108 26.356 126.424 1.00 0.00 H TER 41941 WAT 3065 ATOM 41941 O WAT 3066 70.263 33.376 100.671 1.00 0.00 O ATOM 41942 H1 WAT 3066 70.665 32.555 100.955 1.00 0.00 H ATOM 41943 H2 WAT 3066 70.217 33.303 99.718 1.00 0.00 H TER 41945 WAT 3066 ATOM 41945 O WAT 3067 118.285 89.691 5.599 1.00 0.00 O ATOM 41946 H1 WAT 3067 119.076 90.024 5.175 1.00 0.00 H ATOM 41947 H2 WAT 3067 118.185 88.803 5.255 1.00 0.00 H TER 41949 WAT 3067 ATOM 41949 O WAT 3068 71.500 88.578 142.456 1.00 0.00 O ATOM 41950 H1 WAT 3068 70.722 88.034 142.576 1.00 0.00 H ATOM 41951 H2 WAT 3068 72.179 87.965 142.173 1.00 0.00 H TER 41953 WAT 3068 ATOM 41953 O WAT 3069 41.519 16.113 89.273 1.00 0.00 O ATOM 41954 H1 WAT 3069 41.739 16.519 90.111 1.00 0.00 H ATOM 41955 H2 WAT 3069 41.336 16.850 88.690 1.00 0.00 H TER 41957 WAT 3069 ATOM 41957 O WAT 3070 14.034 104.078 109.055 1.00 0.00 O ATOM 41958 H1 WAT 3070 14.543 104.802 109.419 1.00 0.00 H ATOM 41959 H2 WAT 3070 13.122 104.345 109.170 1.00 0.00 H TER 41961 WAT 3070 ATOM 41961 O WAT 3071 54.524 86.720 124.649 1.00 0.00 O ATOM 41962 H1 WAT 3071 54.650 86.814 123.705 1.00 0.00 H ATOM 41963 H2 WAT 3071 55.237 87.227 125.037 1.00 0.00 H TER 41965 WAT 3071 ATOM 41965 O WAT 3072 61.037 34.379 85.587 1.00 0.00 O ATOM 41966 H1 WAT 3072 60.573 34.614 84.784 1.00 0.00 H ATOM 41967 H2 WAT 3072 60.352 34.062 86.176 1.00 0.00 H TER 41969 WAT 3072 ATOM 41969 O WAT 3073 139.297 24.289 143.200 1.00 0.00 O ATOM 41970 H1 WAT 3073 138.588 23.734 143.525 1.00 0.00 H ATOM 41971 H2 WAT 3073 138.959 24.656 142.383 1.00 0.00 H TER 41973 WAT 3073 ATOM 41973 O WAT 3074 33.873 95.444 8.185 1.00 0.00 O ATOM 41974 H1 WAT 3074 33.653 95.297 9.105 1.00 0.00 H ATOM 41975 H2 WAT 3074 33.939 94.566 7.811 1.00 0.00 H TER 41977 WAT 3074 ATOM 41977 O WAT 3075 114.996 0.052 100.893 1.00 0.00 O ATOM 41978 H1 WAT 3075 115.644 -0.134 101.572 1.00 0.00 H ATOM 41979 H2 WAT 3075 115.430 0.674 100.311 1.00 0.00 H TER 41981 WAT 3075 ATOM 41981 O WAT 3076 85.739 75.984 141.817 1.00 0.00 O ATOM 41982 H1 WAT 3076 85.354 75.854 140.951 1.00 0.00 H ATOM 41983 H2 WAT 3076 85.003 75.892 142.422 1.00 0.00 H TER 41985 WAT 3076 ATOM 41985 O WAT 3077 93.244 19.208 90.616 1.00 0.00 O ATOM 41986 H1 WAT 3077 94.137 18.863 90.591 1.00 0.00 H ATOM 41987 H2 WAT 3077 92.697 18.443 90.792 1.00 0.00 H TER 41989 WAT 3077 ATOM 41989 O WAT 3078 145.837 94.653 151.370 1.00 0.00 O ATOM 41990 H1 WAT 3078 145.883 93.712 151.541 1.00 0.00 H ATOM 41991 H2 WAT 3078 145.290 94.728 150.588 1.00 0.00 H TER 41993 WAT 3078 ATOM 41993 O WAT 3079 29.114 66.474 89.248 1.00 0.00 O ATOM 41994 H1 WAT 3079 28.190 66.595 89.469 1.00 0.00 H ATOM 41995 H2 WAT 3079 29.272 67.092 88.534 1.00 0.00 H TER 41997 WAT 3079 ATOM 41997 O WAT 3080 81.393 99.713 130.466 1.00 0.00 O ATOM 41998 H1 WAT 3080 82.205 99.460 130.905 1.00 0.00 H ATOM 41999 H2 WAT 3080 81.309 100.651 130.639 1.00 0.00 H TER 42001 WAT 3080 ATOM 42001 O WAT 3081 63.921 68.738 73.816 1.00 0.00 O ATOM 42002 H1 WAT 3081 63.200 69.000 73.244 1.00 0.00 H ATOM 42003 H2 WAT 3081 63.495 68.457 74.626 1.00 0.00 H TER 42005 WAT 3081 ATOM 42005 O WAT 3082 92.623 110.153 109.662 1.00 0.00 O ATOM 42006 H1 WAT 3082 91.842 110.284 109.126 1.00 0.00 H ATOM 42007 H2 WAT 3082 93.042 109.377 109.291 1.00 0.00 H TER 42009 WAT 3082 ATOM 42009 O WAT 3083 57.264 126.311 114.161 1.00 0.00 O ATOM 42010 H1 WAT 3083 56.831 126.958 114.717 1.00 0.00 H ATOM 42011 H2 WAT 3083 56.547 125.844 113.733 1.00 0.00 H TER 42013 WAT 3083 ATOM 42013 O WAT 3084 53.596 115.201 143.888 1.00 0.00 O ATOM 42014 H1 WAT 3084 53.707 114.703 144.697 1.00 0.00 H ATOM 42015 H2 WAT 3084 54.091 116.008 144.033 1.00 0.00 H TER 42017 WAT 3084 ATOM 42017 O WAT 3085 144.416 143.787 8.858 1.00 0.00 O ATOM 42018 H1 WAT 3085 143.555 144.200 8.802 1.00 0.00 H ATOM 42019 H2 WAT 3085 144.416 143.136 8.157 1.00 0.00 H TER 42021 WAT 3085 ATOM 42021 O WAT 3086 102.816 68.043 156.363 1.00 0.00 O ATOM 42022 H1 WAT 3086 103.710 68.276 156.112 1.00 0.00 H ATOM 42023 H2 WAT 3086 102.277 68.757 156.022 1.00 0.00 H TER 42025 WAT 3086 ATOM 42025 O WAT 3087 109.609 62.154 77.397 1.00 0.00 O ATOM 42026 H1 WAT 3087 109.376 62.914 77.930 1.00 0.00 H ATOM 42027 H2 WAT 3087 110.333 62.459 76.850 1.00 0.00 H TER 42029 WAT 3087 ATOM 42029 O WAT 3088 69.266 80.545 73.907 1.00 0.00 O ATOM 42030 H1 WAT 3088 69.739 79.870 74.394 1.00 0.00 H ATOM 42031 H2 WAT 3088 69.575 80.451 73.006 1.00 0.00 H TER 42033 WAT 3088 ATOM 42033 O WAT 3089 72.938 115.610 133.887 1.00 0.00 O ATOM 42034 H1 WAT 3089 73.125 115.598 134.826 1.00 0.00 H ATOM 42035 H2 WAT 3089 72.694 114.707 133.680 1.00 0.00 H TER 42037 WAT 3089 ATOM 42037 O WAT 3090 10.769 20.852 118.363 1.00 0.00 O ATOM 42038 H1 WAT 3090 10.986 21.615 118.898 1.00 0.00 H ATOM 42039 H2 WAT 3090 11.229 20.999 117.537 1.00 0.00 H TER 42041 WAT 3090 ATOM 42041 O WAT 3091 38.150 57.850 103.346 1.00 0.00 O ATOM 42042 H1 WAT 3091 37.865 57.413 104.149 1.00 0.00 H ATOM 42043 H2 WAT 3091 38.932 58.338 103.603 1.00 0.00 H TER 42045 WAT 3091 ATOM 42045 O WAT 3092 84.901 102.173 116.124 1.00 0.00 O ATOM 42046 H1 WAT 3092 84.040 102.498 116.387 1.00 0.00 H ATOM 42047 H2 WAT 3092 84.854 101.228 116.269 1.00 0.00 H TER 42049 WAT 3092 ATOM 42049 O WAT 3093 91.937 121.277 85.563 1.00 0.00 O ATOM 42050 H1 WAT 3093 91.992 121.177 86.514 1.00 0.00 H ATOM 42051 H2 WAT 3093 92.535 120.614 85.217 1.00 0.00 H TER 42053 WAT 3093 ATOM 42053 O WAT 3094 139.836 74.452 85.197 1.00 0.00 O ATOM 42054 H1 WAT 3094 138.884 74.411 85.107 1.00 0.00 H ATOM 42055 H2 WAT 3094 140.170 74.021 84.410 1.00 0.00 H TER 42057 WAT 3094 ATOM 42057 O WAT 3095 59.636 50.612 62.151 1.00 0.00 O ATOM 42058 H1 WAT 3095 59.808 51.548 62.051 1.00 0.00 H ATOM 42059 H2 WAT 3095 60.324 50.186 61.640 1.00 0.00 H TER 42061 WAT 3095 ATOM 42061 O WAT 3096 75.640 128.478 125.500 1.00 0.00 O ATOM 42062 H1 WAT 3096 76.182 128.041 126.157 1.00 0.00 H ATOM 42063 H2 WAT 3096 76.249 129.041 125.023 1.00 0.00 H TER 42065 WAT 3096 ATOM 42065 O WAT 3097 128.192 96.191 57.516 1.00 0.00 O ATOM 42066 H1 WAT 3097 128.447 95.272 57.435 1.00 0.00 H ATOM 42067 H2 WAT 3097 128.800 96.552 58.161 1.00 0.00 H TER 42069 WAT 3097 ATOM 42069 O WAT 3098 54.426 10.249 94.135 1.00 0.00 O ATOM 42070 H1 WAT 3098 55.261 10.055 93.710 1.00 0.00 H ATOM 42071 H2 WAT 3098 54.667 10.553 95.010 1.00 0.00 H TER 42073 WAT 3098 ATOM 42073 O WAT 3099 35.079 120.998 14.920 1.00 0.00 O ATOM 42074 H1 WAT 3099 35.204 121.754 14.345 1.00 0.00 H ATOM 42075 H2 WAT 3099 34.575 121.339 15.658 1.00 0.00 H TER 42077 WAT 3099 ATOM 42077 O WAT 3100 12.158 90.788 137.633 1.00 0.00 O ATOM 42078 H1 WAT 3100 11.736 91.373 138.263 1.00 0.00 H ATOM 42079 H2 WAT 3100 12.775 90.277 138.157 1.00 0.00 H TER 42081 WAT 3100 ATOM 42081 O WAT 3101 128.587 57.555 89.124 1.00 0.00 O ATOM 42082 H1 WAT 3101 128.372 58.088 89.890 1.00 0.00 H ATOM 42083 H2 WAT 3101 128.047 56.770 89.219 1.00 0.00 H TER 42085 WAT 3101 ATOM 42085 O WAT 3102 48.822 13.554 88.044 1.00 0.00 O ATOM 42086 H1 WAT 3102 49.440 14.272 88.184 1.00 0.00 H ATOM 42087 H2 WAT 3102 48.887 13.360 87.109 1.00 0.00 H TER 42089 WAT 3102 ATOM 42089 O WAT 3103 72.607 96.575 151.844 1.00 0.00 O ATOM 42090 H1 WAT 3103 73.387 96.791 152.354 1.00 0.00 H ATOM 42091 H2 WAT 3103 72.856 96.754 150.937 1.00 0.00 H TER 42093 WAT 3103 ATOM 42093 O WAT 3104 91.632 106.403 78.050 1.00 0.00 O ATOM 42094 H1 WAT 3104 91.914 105.839 78.770 1.00 0.00 H ATOM 42095 H2 WAT 3104 90.970 105.888 77.588 1.00 0.00 H TER 42097 WAT 3104 ATOM 42097 O WAT 3105 104.690 133.438 5.779 1.00 0.00 O ATOM 42098 H1 WAT 3105 104.391 133.547 4.876 1.00 0.00 H ATOM 42099 H2 WAT 3105 103.980 132.961 6.210 1.00 0.00 H TER 42101 WAT 3105 ATOM 42101 O WAT 3106 0.940 20.766 107.106 1.00 0.00 O ATOM 42102 H1 WAT 3106 0.308 20.973 106.417 1.00 0.00 H ATOM 42103 H2 WAT 3106 1.186 19.856 106.940 1.00 0.00 H TER 42105 WAT 3106 ATOM 42105 O WAT 3107 85.510 68.618 136.338 1.00 0.00 O ATOM 42106 H1 WAT 3107 84.942 68.387 135.603 1.00 0.00 H ATOM 42107 H2 WAT 3107 86.373 68.746 135.942 1.00 0.00 H TER 42109 WAT 3107 ATOM 42109 O WAT 3108 91.842 86.085 85.863 1.00 0.00 O ATOM 42110 H1 WAT 3108 91.184 85.700 85.284 1.00 0.00 H ATOM 42111 H2 WAT 3108 92.667 85.980 85.390 1.00 0.00 H TER 42113 WAT 3108 ATOM 42113 O WAT 3109 83.835 12.652 70.304 1.00 0.00 O ATOM 42114 H1 WAT 3109 84.611 12.667 70.863 1.00 0.00 H ATOM 42115 H2 WAT 3109 83.491 13.544 70.347 1.00 0.00 H TER 42117 WAT 3109 ATOM 42117 O WAT 3110 110.658 112.933 109.750 1.00 0.00 O ATOM 42118 H1 WAT 3110 110.556 113.228 108.845 1.00 0.00 H ATOM 42119 H2 WAT 3110 111.298 113.535 110.129 1.00 0.00 H TER 42121 WAT 3110 ATOM 42121 O WAT 3111 18.192 44.586 9.678 1.00 0.00 O ATOM 42122 H1 WAT 3111 18.965 44.519 10.238 1.00 0.00 H ATOM 42123 H2 WAT 3111 18.314 43.904 9.018 1.00 0.00 H TER 42125 WAT 3111 ATOM 42125 O WAT 3112 4.776 143.866 56.120 1.00 0.00 O ATOM 42126 H1 WAT 3112 4.573 143.172 55.493 1.00 0.00 H ATOM 42127 H2 WAT 3112 4.055 144.488 56.031 1.00 0.00 H TER 42129 WAT 3112 ATOM 42129 O WAT 3113 129.274 50.568 70.516 1.00 0.00 O ATOM 42130 H1 WAT 3113 129.198 51.308 71.117 1.00 0.00 H ATOM 42131 H2 WAT 3113 130.122 50.175 70.725 1.00 0.00 H TER 42133 WAT 3113 ATOM 42133 O WAT 3114 129.739 138.762 150.977 1.00 0.00 O ATOM 42134 H1 WAT 3114 129.294 137.918 150.902 1.00 0.00 H ATOM 42135 H2 WAT 3114 130.404 138.745 150.288 1.00 0.00 H TER 42137 WAT 3114 ATOM 42137 O WAT 3115 113.747 43.999 137.854 1.00 0.00 O ATOM 42138 H1 WAT 3115 113.411 44.004 138.751 1.00 0.00 H ATOM 42139 H2 WAT 3115 112.969 43.885 137.308 1.00 0.00 H TER 42141 WAT 3115 ATOM 42141 O WAT 3116 3.258 122.462 65.578 1.00 0.00 O ATOM 42142 H1 WAT 3116 3.973 121.839 65.712 1.00 0.00 H ATOM 42143 H2 WAT 3116 3.695 123.302 65.440 1.00 0.00 H TER 42145 WAT 3116 ATOM 42145 O WAT 3117 71.854 55.047 73.435 1.00 0.00 O ATOM 42146 H1 WAT 3117 72.313 55.316 74.231 1.00 0.00 H ATOM 42147 H2 WAT 3117 71.657 54.121 73.573 1.00 0.00 H TER 42149 WAT 3117 ATOM 42149 O WAT 3118 51.507 36.569 63.095 1.00 0.00 O ATOM 42150 H1 WAT 3118 51.276 36.268 63.973 1.00 0.00 H ATOM 42151 H2 WAT 3118 50.942 37.327 62.945 1.00 0.00 H TER 42153 WAT 3118 ATOM 42153 O WAT 3119 1.541 106.352 155.547 1.00 0.00 O ATOM 42154 H1 WAT 3119 1.328 105.479 155.876 1.00 0.00 H ATOM 42155 H2 WAT 3119 1.444 106.926 156.307 1.00 0.00 H TER 42157 WAT 3119 ATOM 42157 O WAT 3120 138.950 67.565 118.305 1.00 0.00 O ATOM 42158 H1 WAT 3120 138.244 66.970 118.558 1.00 0.00 H ATOM 42159 H2 WAT 3120 139.382 67.125 117.573 1.00 0.00 H TER 42161 WAT 3120 ATOM 42161 O WAT 3121 109.337 118.121 152.870 1.00 0.00 O ATOM 42162 H1 WAT 3121 108.458 118.500 152.837 1.00 0.00 H ATOM 42163 H2 WAT 3121 109.638 118.292 153.763 1.00 0.00 H TER 42165 WAT 3121 ATOM 42165 O WAT 3122 33.513 59.721 155.212 1.00 0.00 O ATOM 42166 H1 WAT 3122 34.444 59.554 155.357 1.00 0.00 H ATOM 42167 H2 WAT 3122 33.495 60.452 154.594 1.00 0.00 H TER 42169 WAT 3122 ATOM 42169 O WAT 3123 39.654 101.478 61.283 1.00 0.00 O ATOM 42170 H1 WAT 3123 40.261 102.160 61.572 1.00 0.00 H ATOM 42171 H2 WAT 3123 39.795 101.417 60.338 1.00 0.00 H TER 42173 WAT 3123 ATOM 42173 O WAT 3124 62.185 25.445 58.547 1.00 0.00 O ATOM 42174 H1 WAT 3124 62.672 25.957 57.901 1.00 0.00 H ATOM 42175 H2 WAT 3124 61.266 25.638 58.362 1.00 0.00 H TER 42177 WAT 3124 ATOM 42177 O WAT 3125 31.802 107.384 76.001 1.00 0.00 O ATOM 42178 H1 WAT 3125 31.489 107.044 76.839 1.00 0.00 H ATOM 42179 H2 WAT 3125 31.415 106.803 75.347 1.00 0.00 H TER 42181 WAT 3125 ATOM 42181 O WAT 3126 71.633 77.817 109.227 1.00 0.00 O ATOM 42182 H1 WAT 3126 72.576 77.815 109.388 1.00 0.00 H ATOM 42183 H2 WAT 3126 71.383 76.893 109.251 1.00 0.00 H TER 42185 WAT 3126 ATOM 42185 O WAT 3127 41.721 108.598 103.091 1.00 0.00 O ATOM 42186 H1 WAT 3127 42.257 108.504 102.303 1.00 0.00 H ATOM 42187 H2 WAT 3127 41.839 107.773 103.562 1.00 0.00 H TER 42189 WAT 3127 ATOM 42189 O WAT 3128 123.333 68.525 -0.207 1.00 0.00 O ATOM 42190 H1 WAT 3128 123.812 69.306 0.068 1.00 0.00 H ATOM 42191 H2 WAT 3128 122.677 68.393 0.478 1.00 0.00 H TER 42193 WAT 3128 ATOM 42193 O WAT 3129 59.200 79.623 139.151 1.00 0.00 O ATOM 42194 H1 WAT 3129 59.794 79.566 139.900 1.00 0.00 H ATOM 42195 H2 WAT 3129 58.837 80.507 139.200 1.00 0.00 H TER 42197 WAT 3129 ATOM 42197 O WAT 3130 99.286 135.100 116.670 1.00 0.00 O ATOM 42198 H1 WAT 3130 99.502 134.301 116.189 1.00 0.00 H ATOM 42199 H2 WAT 3130 100.042 135.672 116.537 1.00 0.00 H TER 42201 WAT 3130 ATOM 42201 O WAT 3131 69.188 137.059 137.033 1.00 0.00 O ATOM 42202 H1 WAT 3131 69.550 137.454 137.826 1.00 0.00 H ATOM 42203 H2 WAT 3131 69.790 137.324 136.337 1.00 0.00 H TER 42205 WAT 3131 ATOM 42205 O WAT 3132 45.990 135.984 18.543 1.00 0.00 O ATOM 42206 H1 WAT 3132 45.167 135.590 18.254 1.00 0.00 H ATOM 42207 H2 WAT 3132 46.634 135.280 18.465 1.00 0.00 H TER 42209 WAT 3132 ATOM 42209 O WAT 3133 40.466 129.117 13.167 1.00 0.00 O ATOM 42210 H1 WAT 3133 40.929 128.666 13.874 1.00 0.00 H ATOM 42211 H2 WAT 3133 40.603 130.047 13.346 1.00 0.00 H TER 42213 WAT 3133 ATOM 42213 O WAT 3134 26.714 132.992 69.267 1.00 0.00 O ATOM 42214 H1 WAT 3134 26.261 132.874 70.102 1.00 0.00 H ATOM 42215 H2 WAT 3134 27.253 132.207 69.173 1.00 0.00 H TER 42217 WAT 3134 ATOM 42217 O WAT 3135 116.091 86.973 111.691 1.00 0.00 O ATOM 42218 H1 WAT 3135 116.603 86.848 110.892 1.00 0.00 H ATOM 42219 H2 WAT 3135 116.599 86.532 112.372 1.00 0.00 H TER 42221 WAT 3135 ATOM 42221 O WAT 3136 68.621 111.336 98.306 1.00 0.00 O ATOM 42222 H1 WAT 3136 68.202 112.093 98.715 1.00 0.00 H ATOM 42223 H2 WAT 3136 69.323 111.095 98.911 1.00 0.00 H TER 42225 WAT 3136 ATOM 42225 O WAT 3137 144.320 26.195 66.836 1.00 0.00 O ATOM 42226 H1 WAT 3137 144.543 26.448 65.940 1.00 0.00 H ATOM 42227 H2 WAT 3137 144.482 26.983 67.355 1.00 0.00 H TER 42229 WAT 3137 ATOM 42229 O WAT 3138 124.408 71.029 106.923 1.00 0.00 O ATOM 42230 H1 WAT 3138 124.887 70.258 106.621 1.00 0.00 H ATOM 42231 H2 WAT 3138 124.021 71.397 106.128 1.00 0.00 H TER 42233 WAT 3138 ATOM 42233 O WAT 3139 63.117 20.346 75.580 1.00 0.00 O ATOM 42234 H1 WAT 3139 63.470 21.229 75.468 1.00 0.00 H ATOM 42235 H2 WAT 3139 63.016 20.247 76.527 1.00 0.00 H TER 42237 WAT 3139 ATOM 42237 O WAT 3140 94.057 46.614 143.168 1.00 0.00 O ATOM 42238 H1 WAT 3140 93.774 46.068 143.902 1.00 0.00 H ATOM 42239 H2 WAT 3140 94.682 47.228 143.554 1.00 0.00 H TER 42241 WAT 3140 ATOM 42241 O WAT 3141 94.008 104.788 64.743 1.00 0.00 O ATOM 42242 H1 WAT 3141 94.045 105.087 63.834 1.00 0.00 H ATOM 42243 H2 WAT 3141 93.681 103.891 64.688 1.00 0.00 H TER 42245 WAT 3141 ATOM 42245 O WAT 3142 87.237 42.278 71.050 1.00 0.00 O ATOM 42246 H1 WAT 3142 88.172 42.207 71.245 1.00 0.00 H ATOM 42247 H2 WAT 3142 86.878 42.782 71.780 1.00 0.00 H TER 42249 WAT 3142 ATOM 42249 O WAT 3143 28.116 109.629 82.133 1.00 0.00 O ATOM 42250 H1 WAT 3143 28.950 110.096 82.191 1.00 0.00 H ATOM 42251 H2 WAT 3143 27.508 110.159 82.648 1.00 0.00 H TER 42253 WAT 3143 ATOM 42253 O WAT 3144 144.105 137.047 149.317 1.00 0.00 O ATOM 42254 H1 WAT 3144 143.800 136.151 149.177 1.00 0.00 H ATOM 42255 H2 WAT 3144 145.048 137.008 149.155 1.00 0.00 H TER 42257 WAT 3144 ATOM 42257 O WAT 3145 7.998 50.492 98.947 1.00 0.00 O ATOM 42258 H1 WAT 3145 7.676 50.133 98.120 1.00 0.00 H ATOM 42259 H2 WAT 3145 8.927 50.659 98.789 1.00 0.00 H TER 42261 WAT 3145 ATOM 42261 O WAT 3146 33.000 15.379 64.696 1.00 0.00 O ATOM 42262 H1 WAT 3146 33.680 15.218 65.350 1.00 0.00 H ATOM 42263 H2 WAT 3146 33.124 16.294 64.443 1.00 0.00 H TER 42265 WAT 3146 ATOM 42265 O WAT 3147 27.544 141.546 130.083 1.00 0.00 O ATOM 42266 H1 WAT 3147 26.835 141.546 130.726 1.00 0.00 H ATOM 42267 H2 WAT 3147 27.664 142.468 129.857 1.00 0.00 H TER 42269 WAT 3147 ATOM 42269 O WAT 3148 85.917 18.608 132.283 1.00 0.00 O ATOM 42270 H1 WAT 3148 86.686 18.444 132.830 1.00 0.00 H ATOM 42271 H2 WAT 3148 85.456 19.320 132.727 1.00 0.00 H TER 42273 WAT 3148 ATOM 42273 O WAT 3149 90.646 68.331 93.456 1.00 0.00 O ATOM 42274 H1 WAT 3149 91.456 68.573 93.007 1.00 0.00 H ATOM 42275 H2 WAT 3149 89.959 68.480 92.807 1.00 0.00 H TER 42277 WAT 3149 ATOM 42277 O WAT 3150 132.437 41.715 93.471 1.00 0.00 O ATOM 42278 H1 WAT 3150 131.779 42.393 93.624 1.00 0.00 H ATOM 42279 H2 WAT 3150 133.203 42.009 93.964 1.00 0.00 H TER 42281 WAT 3150 ATOM 42281 O WAT 3151 113.130 54.806 76.386 1.00 0.00 O ATOM 42282 H1 WAT 3151 112.564 54.048 76.529 1.00 0.00 H ATOM 42283 H2 WAT 3151 112.888 55.125 75.517 1.00 0.00 H TER 42285 WAT 3151 ATOM 42285 O WAT 3152 34.000 15.870 110.439 1.00 0.00 O ATOM 42286 H1 WAT 3152 33.144 15.492 110.238 1.00 0.00 H ATOM 42287 H2 WAT 3152 33.860 16.816 110.395 1.00 0.00 H TER 42289 WAT 3152 ATOM 42289 O WAT 3153 105.030 53.694 76.895 1.00 0.00 O ATOM 42290 H1 WAT 3153 105.503 54.522 76.979 1.00 0.00 H ATOM 42291 H2 WAT 3153 104.120 53.918 77.088 1.00 0.00 H TER 42293 WAT 3153 ATOM 42293 O WAT 3154 73.056 23.891 103.567 1.00 0.00 O ATOM 42294 H1 WAT 3154 73.031 24.347 104.408 1.00 0.00 H ATOM 42295 H2 WAT 3154 73.925 23.493 103.536 1.00 0.00 H TER 42297 WAT 3154 ATOM 42297 O WAT 3155 66.263 132.204 66.282 1.00 0.00 O ATOM 42298 H1 WAT 3155 66.943 132.358 66.937 1.00 0.00 H ATOM 42299 H2 WAT 3155 66.612 132.591 65.479 1.00 0.00 H TER 42301 WAT 3155 ATOM 42301 O WAT 3156 87.461 57.199 12.308 1.00 0.00 O ATOM 42302 H1 WAT 3156 87.546 57.861 11.622 1.00 0.00 H ATOM 42303 H2 WAT 3156 88.074 56.510 12.053 1.00 0.00 H TER 42305 WAT 3156 ATOM 42305 O WAT 3157 128.915 19.309 89.719 1.00 0.00 O ATOM 42306 H1 WAT 3157 128.492 18.812 89.019 1.00 0.00 H ATOM 42307 H2 WAT 3157 129.755 18.868 89.851 1.00 0.00 H TER 42309 WAT 3157 ATOM 42309 O WAT 3158 142.008 143.498 124.194 1.00 0.00 O ATOM 42310 H1 WAT 3158 142.164 144.335 124.631 1.00 0.00 H ATOM 42311 H2 WAT 3158 141.829 142.885 124.907 1.00 0.00 H TER 42313 WAT 3158 ATOM 42313 O WAT 3159 116.951 126.345 68.153 1.00 0.00 O ATOM 42314 H1 WAT 3159 117.691 126.442 67.554 1.00 0.00 H ATOM 42315 H2 WAT 3159 116.325 127.012 67.871 1.00 0.00 H TER 42317 WAT 3159 ATOM 42317 O WAT 3160 134.581 41.945 133.892 1.00 0.00 O ATOM 42318 H1 WAT 3160 135.318 41.340 133.970 1.00 0.00 H ATOM 42319 H2 WAT 3160 134.608 42.239 132.981 1.00 0.00 H TER 42321 WAT 3160 ATOM 42321 O WAT 3161 131.015 14.142 88.461 1.00 0.00 O ATOM 42322 H1 WAT 3161 131.866 13.705 88.458 1.00 0.00 H ATOM 42323 H2 WAT 3161 130.712 14.069 89.366 1.00 0.00 H TER 42325 WAT 3161 ATOM 42325 O WAT 3162 26.672 29.884 60.161 1.00 0.00 O ATOM 42326 H1 WAT 3162 26.284 30.365 60.893 1.00 0.00 H ATOM 42327 H2 WAT 3162 26.012 29.930 59.469 1.00 0.00 H TER 42329 WAT 3162 ATOM 42329 O WAT 3163 59.339 122.354 115.560 1.00 0.00 O ATOM 42330 H1 WAT 3163 59.533 122.053 114.672 1.00 0.00 H ATOM 42331 H2 WAT 3163 59.950 121.869 116.115 1.00 0.00 H TER 42333 WAT 3163 ATOM 42333 O WAT 3164 49.476 49.719 150.531 1.00 0.00 O ATOM 42334 H1 WAT 3164 49.032 50.330 149.943 1.00 0.00 H ATOM 42335 H2 WAT 3164 50.224 49.401 150.026 1.00 0.00 H TER 42337 WAT 3164 ATOM 42337 O WAT 3165 22.994 31.062 64.508 1.00 0.00 O ATOM 42338 H1 WAT 3165 22.056 30.868 64.506 1.00 0.00 H ATOM 42339 H2 WAT 3165 23.305 30.744 63.660 1.00 0.00 H TER 42341 WAT 3165 ATOM 42341 O WAT 3166 114.713 119.401 110.299 1.00 0.00 O ATOM 42342 H1 WAT 3166 114.351 118.794 110.945 1.00 0.00 H ATOM 42343 H2 WAT 3166 114.661 118.927 109.469 1.00 0.00 H TER 42345 WAT 3166 ATOM 42345 O WAT 3167 91.805 143.527 116.409 1.00 0.00 O ATOM 42346 H1 WAT 3167 91.153 143.831 115.778 1.00 0.00 H ATOM 42347 H2 WAT 3167 91.335 142.892 116.951 1.00 0.00 H TER 42349 WAT 3167 ATOM 42349 O WAT 3168 40.063 97.558 57.651 1.00 0.00 O ATOM 42350 H1 WAT 3168 39.216 97.220 57.358 1.00 0.00 H ATOM 42351 H2 WAT 3168 40.173 98.378 57.171 1.00 0.00 H TER 42353 WAT 3168 ATOM 42353 O WAT 3169 32.445 104.098 2.114 1.00 0.00 O ATOM 42354 H1 WAT 3169 32.229 103.273 2.548 1.00 0.00 H ATOM 42355 H2 WAT 3169 32.632 103.851 1.208 1.00 0.00 H TER 42357 WAT 3169 ATOM 42357 O WAT 3170 135.718 83.492 122.142 1.00 0.00 O ATOM 42358 H1 WAT 3170 136.072 83.479 121.253 1.00 0.00 H ATOM 42359 H2 WAT 3170 136.432 83.836 122.679 1.00 0.00 H TER 42361 WAT 3170 ATOM 42361 O WAT 3171 16.100 39.508 102.516 1.00 0.00 O ATOM 42362 H1 WAT 3171 15.677 39.967 103.242 1.00 0.00 H ATOM 42363 H2 WAT 3171 15.477 38.825 102.269 1.00 0.00 H TER 42365 WAT 3171 ATOM 42365 O WAT 3172 24.848 45.483 80.613 1.00 0.00 O ATOM 42366 H1 WAT 3172 24.715 46.091 81.340 1.00 0.00 H ATOM 42367 H2 WAT 3172 24.024 45.508 80.126 1.00 0.00 H TER 42369 WAT 3172 ATOM 42369 O WAT 3173 6.754 63.088 136.180 1.00 0.00 O ATOM 42370 H1 WAT 3173 7.632 62.836 135.894 1.00 0.00 H ATOM 42371 H2 WAT 3173 6.510 63.807 135.597 1.00 0.00 H TER 42373 WAT 3173 ATOM 42373 O WAT 3174 104.142 64.268 107.034 1.00 0.00 O ATOM 42374 H1 WAT 3174 103.234 64.381 107.317 1.00 0.00 H ATOM 42375 H2 WAT 3174 104.080 63.738 106.240 1.00 0.00 H TER 42377 WAT 3174 ATOM 42377 O WAT 3175 133.799 18.619 10.007 1.00 0.00 O ATOM 42378 H1 WAT 3175 132.880 18.815 9.825 1.00 0.00 H ATOM 42379 H2 WAT 3175 133.833 18.492 10.955 1.00 0.00 H TER 42381 WAT 3175 ATOM 42381 O WAT 3176 22.314 81.125 77.475 1.00 0.00 O ATOM 42382 H1 WAT 3176 21.512 81.606 77.269 1.00 0.00 H ATOM 42383 H2 WAT 3176 22.590 81.472 78.323 1.00 0.00 H TER 42385 WAT 3176 ATOM 42385 O WAT 3177 140.787 103.149 105.117 1.00 0.00 O ATOM 42386 H1 WAT 3177 140.161 103.158 104.393 1.00 0.00 H ATOM 42387 H2 WAT 3177 141.474 103.758 104.847 1.00 0.00 H TER 42389 WAT 3177 ATOM 42389 O WAT 3178 136.929 42.835 79.867 1.00 0.00 O ATOM 42390 H1 WAT 3178 135.985 42.758 79.731 1.00 0.00 H ATOM 42391 H2 WAT 3178 137.016 43.419 80.620 1.00 0.00 H TER 42393 WAT 3178 ATOM 42393 O WAT 3179 89.850 3.498 134.521 1.00 0.00 O ATOM 42394 H1 WAT 3179 89.502 2.695 134.908 1.00 0.00 H ATOM 42395 H2 WAT 3179 89.722 3.386 133.580 1.00 0.00 H TER 42397 WAT 3179 ATOM 42397 O WAT 3180 127.920 49.696 120.673 1.00 0.00 O ATOM 42398 H1 WAT 3180 127.833 50.366 121.352 1.00 0.00 H ATOM 42399 H2 WAT 3180 128.510 50.085 120.027 1.00 0.00 H TER 42401 WAT 3180 ATOM 42401 O WAT 3181 53.842 69.149 17.531 1.00 0.00 O ATOM 42402 H1 WAT 3181 53.785 69.745 18.277 1.00 0.00 H ATOM 42403 H2 WAT 3181 54.302 69.651 16.858 1.00 0.00 H TER 42405 WAT 3181 ATOM 42405 O WAT 3182 8.402 13.581 92.144 1.00 0.00 O ATOM 42406 H1 WAT 3182 8.759 14.373 91.742 1.00 0.00 H ATOM 42407 H2 WAT 3182 9.032 12.895 91.922 1.00 0.00 H TER 42409 WAT 3182 ATOM 42409 O WAT 3183 9.375 84.732 0.490 1.00 0.00 O ATOM 42410 H1 WAT 3183 9.919 85.355 0.971 1.00 0.00 H ATOM 42411 H2 WAT 3183 8.524 84.768 0.928 1.00 0.00 H TER 42413 WAT 3183 ATOM 42413 O WAT 3184 73.420 144.104 136.846 1.00 0.00 O ATOM 42414 H1 WAT 3184 74.139 143.637 136.421 1.00 0.00 H ATOM 42415 H2 WAT 3184 73.808 144.468 137.642 1.00 0.00 H TER 42417 WAT 3184 ATOM 42417 O WAT 3185 94.480 124.918 112.674 1.00 0.00 O ATOM 42418 H1 WAT 3185 95.219 124.367 112.932 1.00 0.00 H ATOM 42419 H2 WAT 3185 94.076 125.179 113.502 1.00 0.00 H TER 42421 WAT 3185 ATOM 42421 O WAT 3186 110.146 69.899 18.315 1.00 0.00 O ATOM 42422 H1 WAT 3186 110.286 70.610 18.940 1.00 0.00 H ATOM 42423 H2 WAT 3186 110.741 70.094 17.591 1.00 0.00 H TER 42425 WAT 3186 ATOM 42425 O WAT 3187 31.667 30.736 143.856 1.00 0.00 O ATOM 42426 H1 WAT 3187 31.239 31.563 144.080 1.00 0.00 H ATOM 42427 H2 WAT 3187 32.358 30.983 143.241 1.00 0.00 H TER 42429 WAT 3187 ATOM 42429 O WAT 3188 97.903 92.809 89.642 1.00 0.00 O ATOM 42430 H1 WAT 3188 97.442 93.217 90.375 1.00 0.00 H ATOM 42431 H2 WAT 3188 98.542 92.228 90.054 1.00 0.00 H TER 42433 WAT 3188 ATOM 42433 O WAT 3189 121.339 53.738 123.518 1.00 0.00 O ATOM 42434 H1 WAT 3189 121.337 54.681 123.685 1.00 0.00 H ATOM 42435 H2 WAT 3189 120.619 53.399 124.050 1.00 0.00 H TER 42437 WAT 3189 ATOM 42437 O WAT 3190 9.953 52.346 123.925 1.00 0.00 O ATOM 42438 H1 WAT 3190 9.197 52.686 123.446 1.00 0.00 H ATOM 42439 H2 WAT 3190 9.757 51.418 124.055 1.00 0.00 H TER 42441 WAT 3190 ATOM 42441 O WAT 3191 20.337 10.415 124.523 1.00 0.00 O ATOM 42442 H1 WAT 3191 19.440 10.602 124.798 1.00 0.00 H ATOM 42443 H2 WAT 3191 20.869 11.067 124.978 1.00 0.00 H TER 42445 WAT 3191 ATOM 42445 O WAT 3192 97.295 80.236 158.175 1.00 0.00 O ATOM 42446 H1 WAT 3192 97.089 80.635 157.330 1.00 0.00 H ATOM 42447 H2 WAT 3192 96.596 80.533 158.757 1.00 0.00 H TER 42449 WAT 3192 ATOM 42449 O WAT 3193 121.843 106.257 130.421 1.00 0.00 O ATOM 42450 H1 WAT 3193 121.478 106.166 131.301 1.00 0.00 H ATOM 42451 H2 WAT 3193 121.228 106.831 129.964 1.00 0.00 H TER 42453 WAT 3193 ATOM 42453 O WAT 3194 137.677 104.083 133.861 1.00 0.00 O ATOM 42454 H1 WAT 3194 137.784 103.138 133.971 1.00 0.00 H ATOM 42455 H2 WAT 3194 138.341 104.467 134.433 1.00 0.00 H TER 42457 WAT 3194 ATOM 42457 O WAT 3195 11.413 131.884 97.160 1.00 0.00 O ATOM 42458 H1 WAT 3195 11.513 131.030 97.582 1.00 0.00 H ATOM 42459 H2 WAT 3195 10.993 131.689 96.322 1.00 0.00 H TER 42461 WAT 3195 ATOM 42461 O WAT 3196 24.127 70.662 61.250 1.00 0.00 O ATOM 42462 H1 WAT 3196 23.879 70.979 60.382 1.00 0.00 H ATOM 42463 H2 WAT 3196 24.479 71.433 61.695 1.00 0.00 H TER 42465 WAT 3196 ATOM 42465 O WAT 3197 62.747 13.816 144.787 1.00 0.00 O ATOM 42466 H1 WAT 3197 62.426 14.370 145.498 1.00 0.00 H ATOM 42467 H2 WAT 3197 63.700 13.868 144.854 1.00 0.00 H TER 42469 WAT 3197 ATOM 42469 O WAT 3198 133.668 17.656 13.042 1.00 0.00 O ATOM 42470 H1 WAT 3198 134.133 16.927 12.633 1.00 0.00 H ATOM 42471 H2 WAT 3198 134.361 18.248 13.335 1.00 0.00 H TER 42473 WAT 3198 ATOM 42473 O WAT 3199 25.505 107.257 100.447 1.00 0.00 O ATOM 42474 H1 WAT 3199 25.859 106.377 100.322 1.00 0.00 H ATOM 42475 H2 WAT 3199 25.657 107.698 99.611 1.00 0.00 H TER 42477 WAT 3199 ATOM 42477 O WAT 3200 2.743 6.683 128.989 1.00 0.00 O ATOM 42478 H1 WAT 3200 2.381 7.544 129.199 1.00 0.00 H ATOM 42479 H2 WAT 3200 3.114 6.372 129.815 1.00 0.00 H TER 42481 WAT 3200 ATOM 42481 O WAT 3201 143.504 69.279 63.743 1.00 0.00 O ATOM 42482 H1 WAT 3201 144.376 69.253 64.139 1.00 0.00 H ATOM 42483 H2 WAT 3201 143.561 69.973 63.086 1.00 0.00 H TER 42485 WAT 3201 ATOM 42485 O WAT 3202 92.593 21.699 144.823 1.00 0.00 O ATOM 42486 H1 WAT 3202 92.072 21.740 145.625 1.00 0.00 H ATOM 42487 H2 WAT 3202 93.483 21.912 145.104 1.00 0.00 H TER 42489 WAT 3202 ATOM 42489 O WAT 3203 68.937 70.657 67.759 1.00 0.00 O ATOM 42490 H1 WAT 3203 68.990 69.702 67.722 1.00 0.00 H ATOM 42491 H2 WAT 3203 68.117 70.870 67.314 1.00 0.00 H TER 42493 WAT 3203 ATOM 42493 O WAT 3204 44.695 145.582 12.084 1.00 0.00 O ATOM 42494 H1 WAT 3204 44.879 145.453 13.015 1.00 0.00 H ATOM 42495 H2 WAT 3204 45.459 145.217 11.637 1.00 0.00 H TER 42497 WAT 3204 ATOM 42497 O WAT 3205 63.404 128.018 59.981 1.00 0.00 O ATOM 42498 H1 WAT 3205 64.121 127.421 60.193 1.00 0.00 H ATOM 42499 H2 WAT 3205 63.389 128.642 60.707 1.00 0.00 H TER 42501 WAT 3205 ATOM 42501 O WAT 3206 19.214 31.707 117.217 1.00 0.00 O ATOM 42502 H1 WAT 3206 19.406 30.770 117.192 1.00 0.00 H ATOM 42503 H2 WAT 3206 19.733 32.039 117.950 1.00 0.00 H TER 42505 WAT 3206 ATOM 42505 O WAT 3207 32.984 85.102 3.772 1.00 0.00 O ATOM 42506 H1 WAT 3207 33.553 84.422 3.412 1.00 0.00 H ATOM 42507 H2 WAT 3207 33.575 85.675 4.261 1.00 0.00 H TER 42509 WAT 3207 ATOM 42509 O WAT 3208 137.654 97.499 67.889 1.00 0.00 O ATOM 42510 H1 WAT 3208 138.028 98.342 67.633 1.00 0.00 H ATOM 42511 H2 WAT 3208 138.024 96.873 67.267 1.00 0.00 H TER 42513 WAT 3208 ATOM 42513 O WAT 3209 36.107 18.767 145.729 1.00 0.00 O ATOM 42514 H1 WAT 3209 35.884 19.552 145.229 1.00 0.00 H ATOM 42515 H2 WAT 3209 37.011 18.910 146.008 1.00 0.00 H TER 42517 WAT 3209 ATOM 42517 O WAT 3210 33.100 7.472 100.099 1.00 0.00 O ATOM 42518 H1 WAT 3210 33.575 6.904 100.705 1.00 0.00 H ATOM 42519 H2 WAT 3210 32.990 8.294 100.577 1.00 0.00 H TER 42521 WAT 3210 ATOM 42521 O WAT 3211 101.153 51.207 148.051 1.00 0.00 O ATOM 42522 H1 WAT 3211 100.809 50.747 148.817 1.00 0.00 H ATOM 42523 H2 WAT 3211 102.100 51.223 148.186 1.00 0.00 H TER 42525 WAT 3211 ATOM 42525 O WAT 3212 120.551 122.993 23.593 1.00 0.00 O ATOM 42526 H1 WAT 3212 121.435 122.776 23.298 1.00 0.00 H ATOM 42527 H2 WAT 3212 120.297 122.258 24.151 1.00 0.00 H TER 42529 WAT 3212 ATOM 42529 O WAT 3213 75.772 118.179 117.536 1.00 0.00 O ATOM 42530 H1 WAT 3213 75.227 118.964 117.489 1.00 0.00 H ATOM 42531 H2 WAT 3213 75.849 117.997 118.473 1.00 0.00 H TER 42533 WAT 3213 ATOM 42533 O WAT 3214 39.745 133.193 2.490 1.00 0.00 O ATOM 42534 H1 WAT 3214 40.143 132.323 2.522 1.00 0.00 H ATOM 42535 H2 WAT 3214 40.482 133.790 2.364 1.00 0.00 H TER 42537 WAT 3214 ATOM 42537 O WAT 3215 0.195 34.011 108.962 1.00 0.00 O ATOM 42538 H1 WAT 3215 -0.130 33.433 108.272 1.00 0.00 H ATOM 42539 H2 WAT 3215 1.120 33.779 109.052 1.00 0.00 H TER 42541 WAT 3215 ATOM 42541 O WAT 3216 113.261 75.101 105.753 1.00 0.00 O ATOM 42542 H1 WAT 3216 114.105 75.231 106.186 1.00 0.00 H ATOM 42543 H2 WAT 3216 113.402 75.405 104.857 1.00 0.00 H TER 42545 WAT 3216 ATOM 42545 O WAT 3217 145.144 5.244 111.616 1.00 0.00 O ATOM 42546 H1 WAT 3217 144.572 5.980 111.403 1.00 0.00 H ATOM 42547 H2 WAT 3217 144.768 4.502 111.141 1.00 0.00 H TER 42549 WAT 3217 ATOM 42549 O WAT 3218 29.703 130.088 141.734 1.00 0.00 O ATOM 42550 H1 WAT 3218 30.163 129.800 140.946 1.00 0.00 H ATOM 42551 H2 WAT 3218 29.186 130.841 141.448 1.00 0.00 H TER 42553 WAT 3218 ATOM 42553 O WAT 3219 144.910 117.162 83.986 1.00 0.00 O ATOM 42554 H1 WAT 3219 145.472 117.004 83.227 1.00 0.00 H ATOM 42555 H2 WAT 3219 144.666 116.287 84.288 1.00 0.00 H TER 42557 WAT 3219 ATOM 42557 O WAT 3220 76.585 44.548 145.472 1.00 0.00 O ATOM 42558 H1 WAT 3220 76.230 45.053 146.203 1.00 0.00 H ATOM 42559 H2 WAT 3220 77.101 43.857 145.887 1.00 0.00 H TER 42561 WAT 3220 ATOM 42561 O WAT 3221 125.760 74.131 99.059 1.00 0.00 O ATOM 42562 H1 WAT 3221 126.134 73.589 98.365 1.00 0.00 H ATOM 42563 H2 WAT 3221 125.138 74.702 98.608 1.00 0.00 H TER 42565 WAT 3221 ATOM 42565 O WAT 3222 82.914 14.806 77.734 1.00 0.00 O ATOM 42566 H1 WAT 3222 82.207 15.196 77.219 1.00 0.00 H ATOM 42567 H2 WAT 3222 82.734 15.080 78.633 1.00 0.00 H TER 42569 WAT 3222 ATOM 42569 O WAT 3223 11.944 99.099 98.308 1.00 0.00 O ATOM 42570 H1 WAT 3223 12.466 98.748 97.587 1.00 0.00 H ATOM 42571 H2 WAT 3223 11.077 99.245 97.927 1.00 0.00 H TER 42573 WAT 3223 ATOM 42573 O WAT 3224 139.527 27.669 8.542 1.00 0.00 O ATOM 42574 H1 WAT 3224 139.655 27.459 7.616 1.00 0.00 H ATOM 42575 H2 WAT 3224 140.411 27.679 8.909 1.00 0.00 H TER 42577 WAT 3224 ATOM 42577 O WAT 3225 86.010 127.630 96.967 1.00 0.00 O ATOM 42578 H1 WAT 3225 86.390 127.812 97.826 1.00 0.00 H ATOM 42579 H2 WAT 3225 85.410 126.900 97.120 1.00 0.00 H TER 42581 WAT 3225 ATOM 42581 O WAT 3226 123.868 77.582 153.195 1.00 0.00 O ATOM 42582 H1 WAT 3226 124.295 77.790 154.026 1.00 0.00 H ATOM 42583 H2 WAT 3226 124.495 77.022 152.737 1.00 0.00 H TER 42585 WAT 3226 ATOM 42585 O WAT 3227 100.111 92.846 145.038 1.00 0.00 O ATOM 42586 H1 WAT 3227 99.632 93.641 145.273 1.00 0.00 H ATOM 42587 H2 WAT 3227 100.936 92.913 145.519 1.00 0.00 H TER 42589 WAT 3227 ATOM 42589 O WAT 3228 89.817 90.038 74.252 1.00 0.00 O ATOM 42590 H1 WAT 3228 90.016 89.419 73.549 1.00 0.00 H ATOM 42591 H2 WAT 3228 88.922 90.327 74.070 1.00 0.00 H TER 42593 WAT 3228 ATOM 42593 O WAT 3229 42.055 117.931 100.940 1.00 0.00 O ATOM 42594 H1 WAT 3229 42.555 118.151 100.154 1.00 0.00 H ATOM 42595 H2 WAT 3229 42.494 118.407 101.644 1.00 0.00 H TER 42597 WAT 3229 ATOM 42597 O WAT 3230 17.987 19.981 96.415 1.00 0.00 O ATOM 42598 H1 WAT 3230 17.599 19.477 95.700 1.00 0.00 H ATOM 42599 H2 WAT 3230 18.521 19.346 96.894 1.00 0.00 H TER 42601 WAT 3230 ATOM 42601 O WAT 3231 84.058 44.050 110.356 1.00 0.00 O ATOM 42602 H1 WAT 3231 84.739 43.393 110.212 1.00 0.00 H ATOM 42603 H2 WAT 3231 83.530 44.027 109.558 1.00 0.00 H TER 42605 WAT 3231 ATOM 42605 O WAT 3232 129.794 43.368 3.282 1.00 0.00 O ATOM 42606 H1 WAT 3232 129.332 43.379 4.120 1.00 0.00 H ATOM 42607 H2 WAT 3232 130.581 43.891 3.435 1.00 0.00 H TER 42609 WAT 3232 ATOM 42609 O WAT 3233 138.215 115.967 94.590 1.00 0.00 O ATOM 42610 H1 WAT 3233 139.063 116.410 94.571 1.00 0.00 H ATOM 42611 H2 WAT 3233 138.278 115.361 95.329 1.00 0.00 H TER 42613 WAT 3233 ATOM 42613 O WAT 3234 61.431 80.933 150.272 1.00 0.00 O ATOM 42614 H1 WAT 3234 62.343 81.223 150.288 1.00 0.00 H ATOM 42615 H2 WAT 3234 60.922 81.739 150.355 1.00 0.00 H TER 42617 WAT 3234 ATOM 42617 O WAT 3235 111.806 84.281 119.391 1.00 0.00 O ATOM 42618 H1 WAT 3235 112.754 84.298 119.528 1.00 0.00 H ATOM 42619 H2 WAT 3235 111.637 85.013 118.797 1.00 0.00 H TER 42621 WAT 3235 ATOM 42621 O WAT 3236 28.305 39.544 16.144 1.00 0.00 O ATOM 42622 H1 WAT 3236 27.711 39.237 15.459 1.00 0.00 H ATOM 42623 H2 WAT 3236 28.475 38.768 16.678 1.00 0.00 H TER 42625 WAT 3236 ATOM 42625 O WAT 3237 6.708 79.286 56.772 1.00 0.00 O ATOM 42626 H1 WAT 3237 6.659 78.594 56.113 1.00 0.00 H ATOM 42627 H2 WAT 3237 7.254 78.918 57.467 1.00 0.00 H TER 42629 WAT 3237 ATOM 42629 O WAT 3238 111.167 110.578 117.474 1.00 0.00 O ATOM 42630 H1 WAT 3238 111.504 111.473 117.456 1.00 0.00 H ATOM 42631 H2 WAT 3238 111.072 110.339 116.552 1.00 0.00 H TER 42633 WAT 3238 ATOM 42633 O WAT 3239 74.098 12.710 107.200 1.00 0.00 O ATOM 42634 H1 WAT 3239 74.223 12.448 106.288 1.00 0.00 H ATOM 42635 H2 WAT 3239 73.674 13.566 107.147 1.00 0.00 H TER 42637 WAT 3239 ATOM 42637 O WAT 3240 32.179 42.187 73.951 1.00 0.00 O ATOM 42638 H1 WAT 3240 32.451 43.003 73.530 1.00 0.00 H ATOM 42639 H2 WAT 3240 32.942 41.613 73.875 1.00 0.00 H TER 42641 WAT 3240 ATOM 42641 O WAT 3241 98.061 83.118 3.543 1.00 0.00 O ATOM 42642 H1 WAT 3241 97.449 82.760 4.185 1.00 0.00 H ATOM 42643 H2 WAT 3241 98.810 82.522 3.569 1.00 0.00 H TER 42645 WAT 3241 ATOM 42645 O WAT 3242 122.227 106.513 65.147 1.00 0.00 O ATOM 42646 H1 WAT 3242 123.084 106.305 64.775 1.00 0.00 H ATOM 42647 H2 WAT 3242 122.421 107.086 65.889 1.00 0.00 H TER 42649 WAT 3242 ATOM 42649 O WAT 3243 40.862 84.848 16.129 1.00 0.00 O ATOM 42650 H1 WAT 3243 41.404 84.727 16.908 1.00 0.00 H ATOM 42651 H2 WAT 3243 41.270 84.293 15.464 1.00 0.00 H TER 42653 WAT 3243 ATOM 42653 O WAT 3244 16.017 13.429 111.297 1.00 0.00 O ATOM 42654 H1 WAT 3244 15.818 12.729 111.919 1.00 0.00 H ATOM 42655 H2 WAT 3244 16.779 13.111 110.814 1.00 0.00 H TER 42657 WAT 3244 ATOM 42657 O WAT 3245 53.314 58.184 106.701 1.00 0.00 O ATOM 42658 H1 WAT 3245 54.020 58.830 106.728 1.00 0.00 H ATOM 42659 H2 WAT 3245 53.337 57.840 105.809 1.00 0.00 H TER 42661 WAT 3245 ATOM 42661 O WAT 3246 61.259 82.531 97.146 1.00 0.00 O ATOM 42662 H1 WAT 3246 61.584 81.970 97.851 1.00 0.00 H ATOM 42663 H2 WAT 3246 61.230 83.406 97.531 1.00 0.00 H TER 42665 WAT 3246 ATOM 42665 O WAT 3247 21.920 39.234 127.580 1.00 0.00 O ATOM 42666 H1 WAT 3247 21.775 38.310 127.376 1.00 0.00 H ATOM 42667 H2 WAT 3247 22.263 39.607 126.769 1.00 0.00 H TER 42669 WAT 3247 ATOM 42669 O WAT 3248 106.351 29.873 81.514 1.00 0.00 O ATOM 42670 H1 WAT 3248 107.105 30.184 82.016 1.00 0.00 H ATOM 42671 H2 WAT 3248 105.594 30.255 81.957 1.00 0.00 H TER 42673 WAT 3248 ATOM 42673 O WAT 3249 114.992 18.590 61.921 1.00 0.00 O ATOM 42674 H1 WAT 3249 114.627 17.973 61.286 1.00 0.00 H ATOM 42675 H2 WAT 3249 114.419 19.355 61.868 1.00 0.00 H TER 42677 WAT 3249 ATOM 42677 O WAT 3250 108.891 20.078 97.332 1.00 0.00 O ATOM 42678 H1 WAT 3250 108.872 19.367 97.972 1.00 0.00 H ATOM 42679 H2 WAT 3250 109.796 20.096 97.020 1.00 0.00 H TER 42681 WAT 3250 ATOM 42681 O WAT 3251 121.702 9.547 4.280 1.00 0.00 O ATOM 42682 H1 WAT 3251 122.015 8.675 4.518 1.00 0.00 H ATOM 42683 H2 WAT 3251 122.268 9.815 3.555 1.00 0.00 H TER 42685 WAT 3251 ATOM 42685 O WAT 3252 123.468 9.801 137.229 1.00 0.00 O ATOM 42686 H1 WAT 3252 124.136 10.300 137.700 1.00 0.00 H ATOM 42687 H2 WAT 3252 122.639 10.191 137.505 1.00 0.00 H TER 42689 WAT 3252 ATOM 42689 O WAT 3253 106.074 132.805 114.043 1.00 0.00 O ATOM 42690 H1 WAT 3253 105.788 132.201 113.359 1.00 0.00 H ATOM 42691 H2 WAT 3253 106.330 132.239 114.771 1.00 0.00 H TER 42693 WAT 3253 ATOM 42693 O WAT 3254 78.953 9.716 15.823 1.00 0.00 O ATOM 42694 H1 WAT 3254 78.997 8.907 16.333 1.00 0.00 H ATOM 42695 H2 WAT 3254 79.864 9.994 15.734 1.00 0.00 H TER 42697 WAT 3254 ATOM 42697 O WAT 3255 60.256 3.731 80.028 1.00 0.00 O ATOM 42698 H1 WAT 3255 60.160 3.809 79.079 1.00 0.00 H ATOM 42699 H2 WAT 3255 59.522 3.180 80.300 1.00 0.00 H TER 42701 WAT 3255 ATOM 42701 O WAT 3256 120.656 136.092 101.969 1.00 0.00 O ATOM 42702 H1 WAT 3256 121.107 136.465 101.212 1.00 0.00 H ATOM 42703 H2 WAT 3256 119.985 136.737 102.190 1.00 0.00 H TER 42705 WAT 3256 ATOM 42705 O WAT 3257 124.460 145.396 90.734 1.00 0.00 O ATOM 42706 H1 WAT 3257 123.930 145.782 90.037 1.00 0.00 H ATOM 42707 H2 WAT 3257 125.248 145.938 90.764 1.00 0.00 H TER 42709 WAT 3257 ATOM 42709 O WAT 3258 10.128 36.956 9.568 1.00 0.00 O ATOM 42710 H1 WAT 3258 10.657 37.749 9.653 1.00 0.00 H ATOM 42711 H2 WAT 3258 10.190 36.534 10.425 1.00 0.00 H TER 42713 WAT 3258 ATOM 42713 O WAT 3259 12.334 8.465 73.740 1.00 0.00 O ATOM 42714 H1 WAT 3259 12.983 9.004 73.287 1.00 0.00 H ATOM 42715 H2 WAT 3259 12.143 7.755 73.127 1.00 0.00 H TER 42717 WAT 3259 ATOM 42717 O WAT 3260 32.925 41.387 18.311 1.00 0.00 O ATOM 42718 H1 WAT 3260 32.712 42.184 18.797 1.00 0.00 H ATOM 42719 H2 WAT 3260 33.389 40.839 18.944 1.00 0.00 H TER 42721 WAT 3260 ATOM 42721 O WAT 3261 50.268 102.408 123.610 1.00 0.00 O ATOM 42722 H1 WAT 3261 50.962 102.896 123.166 1.00 0.00 H ATOM 42723 H2 WAT 3261 50.574 101.501 123.609 1.00 0.00 H TER 42725 WAT 3261 ATOM 42725 O WAT 3262 58.239 33.729 4.674 1.00 0.00 O ATOM 42726 H1 WAT 3262 59.076 34.091 4.382 1.00 0.00 H ATOM 42727 H2 WAT 3262 58.126 32.936 4.151 1.00 0.00 H TER 42729 WAT 3262 ATOM 42729 O WAT 3263 19.959 0.724 158.476 1.00 0.00 O ATOM 42730 H1 WAT 3263 19.432 -0.003 158.144 1.00 0.00 H ATOM 42731 H2 WAT 3263 20.446 1.035 157.713 1.00 0.00 H TER 42733 WAT 3263 ATOM 42733 O WAT 3264 28.951 48.345 105.631 1.00 0.00 O ATOM 42734 H1 WAT 3264 29.215 49.161 106.057 1.00 0.00 H ATOM 42735 H2 WAT 3264 29.368 47.658 106.152 1.00 0.00 H TER 42737 WAT 3264 ATOM 42737 O WAT 3265 105.445 71.082 112.956 1.00 0.00 O ATOM 42738 H1 WAT 3265 104.707 71.684 113.050 1.00 0.00 H ATOM 42739 H2 WAT 3265 106.173 71.524 113.393 1.00 0.00 H TER 42741 WAT 3265 ATOM 42741 O WAT 3266 58.285 40.981 16.885 1.00 0.00 O ATOM 42742 H1 WAT 3266 58.356 40.289 17.542 1.00 0.00 H ATOM 42743 H2 WAT 3266 57.475 41.440 17.106 1.00 0.00 H TER 42745 WAT 3266 ATOM 42745 O WAT 3267 25.219 145.259 85.006 1.00 0.00 O ATOM 42746 H1 WAT 3267 25.457 144.536 85.587 1.00 0.00 H ATOM 42747 H2 WAT 3267 25.718 146.006 85.338 1.00 0.00 H TER 42749 WAT 3267 ATOM 42749 O WAT 3268 106.189 38.132 67.921 1.00 0.00 O ATOM 42750 H1 WAT 3268 106.671 38.352 68.717 1.00 0.00 H ATOM 42751 H2 WAT 3268 106.743 37.490 67.475 1.00 0.00 H TER 42753 WAT 3268 ATOM 42753 O WAT 3269 112.083 68.674 148.329 1.00 0.00 O ATOM 42754 H1 WAT 3269 112.752 69.328 148.126 1.00 0.00 H ATOM 42755 H2 WAT 3269 112.521 68.057 148.915 1.00 0.00 H TER 42757 WAT 3269 ATOM 42757 O WAT 3270 116.804 55.213 132.436 1.00 0.00 O ATOM 42758 H1 WAT 3270 117.712 55.514 132.398 1.00 0.00 H ATOM 42759 H2 WAT 3270 116.535 55.379 133.340 1.00 0.00 H TER 42761 WAT 3270 ATOM 42761 O WAT 3271 144.591 56.626 154.222 1.00 0.00 O ATOM 42762 H1 WAT 3271 143.679 56.381 154.067 1.00 0.00 H ATOM 42763 H2 WAT 3271 144.890 56.018 154.898 1.00 0.00 H TER 42765 WAT 3271 ATOM 42765 O WAT 3272 76.360 24.663 93.925 1.00 0.00 O ATOM 42766 H1 WAT 3272 77.236 24.687 94.310 1.00 0.00 H ATOM 42767 H2 WAT 3272 76.030 25.556 94.026 1.00 0.00 H TER 42769 WAT 3272 ATOM 42769 O WAT 3273 35.377 31.398 126.356 1.00 0.00 O ATOM 42770 H1 WAT 3273 34.788 31.842 126.966 1.00 0.00 H ATOM 42771 H2 WAT 3273 36.003 32.072 126.093 1.00 0.00 H TER 42773 WAT 3273 ATOM 42773 O WAT 3274 110.851 120.083 129.864 1.00 0.00 O ATOM 42774 H1 WAT 3274 111.417 119.315 129.786 1.00 0.00 H ATOM 42775 H2 WAT 3274 110.019 119.807 129.482 1.00 0.00 H TER 42777 WAT 3274 ATOM 42777 O WAT 3275 23.408 27.965 107.595 1.00 0.00 O ATOM 42778 H1 WAT 3275 24.019 28.055 106.864 1.00 0.00 H ATOM 42779 H2 WAT 3275 23.504 27.056 107.877 1.00 0.00 H TER 42781 WAT 3275 ATOM 42781 O WAT 3276 72.912 120.501 157.953 1.00 0.00 O ATOM 42782 H1 WAT 3276 73.134 119.670 157.534 1.00 0.00 H ATOM 42783 H2 WAT 3276 73.745 120.969 158.014 1.00 0.00 H TER 42785 WAT 3276 ATOM 42785 O WAT 3277 105.751 143.141 8.269 1.00 0.00 O ATOM 42786 H1 WAT 3277 106.456 143.234 8.909 1.00 0.00 H ATOM 42787 H2 WAT 3277 106.191 142.861 7.466 1.00 0.00 H TER 42789 WAT 3277 ATOM 42789 O WAT 3278 69.747 13.723 85.805 1.00 0.00 O ATOM 42790 H1 WAT 3278 69.701 12.837 85.444 1.00 0.00 H ATOM 42791 H2 WAT 3278 70.143 13.609 86.669 1.00 0.00 H TER 42793 WAT 3278 ATOM 42793 O WAT 3279 38.159 119.608 92.215 1.00 0.00 O ATOM 42794 H1 WAT 3279 38.569 118.756 92.064 1.00 0.00 H ATOM 42795 H2 WAT 3279 38.028 119.969 91.338 1.00 0.00 H TER 42797 WAT 3279 ATOM 42797 O WAT 3280 98.713 16.360 113.078 1.00 0.00 O ATOM 42798 H1 WAT 3280 99.085 17.240 113.131 1.00 0.00 H ATOM 42799 H2 WAT 3280 97.786 16.503 112.887 1.00 0.00 H TER 42801 WAT 3280 ATOM 42801 O WAT 3281 91.517 83.366 156.397 1.00 0.00 O ATOM 42802 H1 WAT 3281 92.377 83.769 156.278 1.00 0.00 H ATOM 42803 H2 WAT 3281 91.703 82.520 156.805 1.00 0.00 H TER 42805 WAT 3281 ATOM 42805 O WAT 3282 8.975 84.941 85.224 1.00 0.00 O ATOM 42806 H1 WAT 3282 9.475 84.423 84.594 1.00 0.00 H ATOM 42807 H2 WAT 3282 8.303 84.341 85.549 1.00 0.00 H TER 42809 WAT 3282 ATOM 42809 O WAT 3283 34.198 126.533 115.500 1.00 0.00 O ATOM 42810 H1 WAT 3283 33.524 126.858 116.096 1.00 0.00 H ATOM 42811 H2 WAT 3283 34.790 126.029 116.059 1.00 0.00 H TER 42813 WAT 3283 ATOM 42813 O WAT 3284 20.290 12.907 74.672 1.00 0.00 O ATOM 42814 H1 WAT 3284 19.932 12.198 75.206 1.00 0.00 H ATOM 42815 H2 WAT 3284 20.466 13.611 75.295 1.00 0.00 H TER 42817 WAT 3284 ATOM 42817 O WAT 3285 45.127 99.313 151.062 1.00 0.00 O ATOM 42818 H1 WAT 3285 45.441 98.589 150.521 1.00 0.00 H ATOM 42819 H2 WAT 3285 44.318 98.986 151.455 1.00 0.00 H TER 42821 WAT 3285 ATOM 42821 O WAT 3286 39.244 29.882 94.097 1.00 0.00 O ATOM 42822 H1 WAT 3286 38.914 30.755 93.885 1.00 0.00 H ATOM 42823 H2 WAT 3286 38.710 29.597 94.838 1.00 0.00 H TER 42825 WAT 3286 ATOM 42825 O WAT 3287 85.858 65.668 121.286 1.00 0.00 O ATOM 42826 H1 WAT 3287 85.344 66.031 120.565 1.00 0.00 H ATOM 42827 H2 WAT 3287 86.754 65.641 120.951 1.00 0.00 H TER 42829 WAT 3287 ATOM 42829 O WAT 3288 112.142 140.844 136.500 1.00 0.00 O ATOM 42830 H1 WAT 3288 111.926 141.601 137.044 1.00 0.00 H ATOM 42831 H2 WAT 3288 111.868 140.089 137.020 1.00 0.00 H TER 42833 WAT 3288 ATOM 42833 O WAT 3289 51.148 26.247 138.418 1.00 0.00 O ATOM 42834 H1 WAT 3289 51.564 25.533 137.935 1.00 0.00 H ATOM 42835 H2 WAT 3289 51.202 26.999 137.828 1.00 0.00 H TER 42837 WAT 3289 ATOM 42837 O WAT 3290 33.402 30.656 147.558 1.00 0.00 O ATOM 42838 H1 WAT 3290 32.808 31.349 147.848 1.00 0.00 H ATOM 42839 H2 WAT 3290 33.084 30.418 146.687 1.00 0.00 H TER 42841 WAT 3290 ATOM 42841 O WAT 3291 38.349 10.866 100.076 1.00 0.00 O ATOM 42842 H1 WAT 3291 37.687 10.193 100.234 1.00 0.00 H ATOM 42843 H2 WAT 3291 37.884 11.693 100.199 1.00 0.00 H TER 42845 WAT 3291 ATOM 42845 O WAT 3292 14.086 38.850 9.770 1.00 0.00 O ATOM 42846 H1 WAT 3292 13.162 39.092 9.709 1.00 0.00 H ATOM 42847 H2 WAT 3292 14.432 39.003 8.891 1.00 0.00 H TER 42849 WAT 3292 ATOM 42849 O WAT 3293 91.056 58.643 111.687 1.00 0.00 O ATOM 42850 H1 WAT 3293 91.678 57.916 111.637 1.00 0.00 H ATOM 42851 H2 WAT 3293 91.024 58.992 110.796 1.00 0.00 H TER 42853 WAT 3293 ATOM 42853 O WAT 3294 58.351 30.203 60.199 1.00 0.00 O ATOM 42854 H1 WAT 3294 58.389 29.392 60.706 1.00 0.00 H ATOM 42855 H2 WAT 3294 58.273 30.894 60.857 1.00 0.00 H TER 42857 WAT 3294 ATOM 42857 O WAT 3295 104.584 120.200 79.949 1.00 0.00 O ATOM 42858 H1 WAT 3295 103.942 120.827 79.614 1.00 0.00 H ATOM 42859 H2 WAT 3295 104.083 119.396 80.087 1.00 0.00 H TER 42861 WAT 3295 ATOM 42861 O WAT 3296 1.651 116.633 96.932 1.00 0.00 O ATOM 42862 H1 WAT 3296 1.853 117.286 97.602 1.00 0.00 H ATOM 42863 H2 WAT 3296 1.691 117.116 96.107 1.00 0.00 H TER 42865 WAT 3296 ATOM 42865 O WAT 3297 126.538 130.063 84.725 1.00 0.00 O ATOM 42866 H1 WAT 3297 126.708 130.457 85.581 1.00 0.00 H ATOM 42867 H2 WAT 3297 127.064 130.579 84.115 1.00 0.00 H TER 42869 WAT 3297 ATOM 42869 O WAT 3298 24.595 79.623 126.476 1.00 0.00 O ATOM 42870 H1 WAT 3298 24.746 80.214 127.213 1.00 0.00 H ATOM 42871 H2 WAT 3298 23.879 79.057 126.764 1.00 0.00 H TER 42873 WAT 3298 ATOM 42873 O WAT 3299 72.999 85.760 77.891 1.00 0.00 O ATOM 42874 H1 WAT 3299 72.700 86.569 78.306 1.00 0.00 H ATOM 42875 H2 WAT 3299 73.086 85.138 78.613 1.00 0.00 H TER 42877 WAT 3299 ATOM 42877 O WAT 3300 5.974 62.387 14.723 1.00 0.00 O ATOM 42878 H1 WAT 3300 5.606 62.738 13.911 1.00 0.00 H ATOM 42879 H2 WAT 3300 6.863 62.741 14.755 1.00 0.00 H TER 42881 WAT 3300 ATOM 42881 O WAT 3301 37.591 95.303 58.574 1.00 0.00 O ATOM 42882 H1 WAT 3301 37.209 94.435 58.700 1.00 0.00 H ATOM 42883 H2 WAT 3301 36.842 95.899 58.590 1.00 0.00 H TER 42885 WAT 3301 ATOM 42885 O WAT 3302 131.552 106.773 150.110 1.00 0.00 O ATOM 42886 H1 WAT 3302 131.933 105.901 150.010 1.00 0.00 H ATOM 42887 H2 WAT 3302 130.651 106.611 150.389 1.00 0.00 H TER 42889 WAT 3302 ATOM 42889 O WAT 3303 37.118 27.919 140.580 1.00 0.00 O ATOM 42890 H1 WAT 3303 37.601 28.648 140.970 1.00 0.00 H ATOM 42891 H2 WAT 3303 36.836 27.393 141.328 1.00 0.00 H TER 42893 WAT 3303 ATOM 42893 O WAT 3304 123.169 91.092 83.313 1.00 0.00 O ATOM 42894 H1 WAT 3304 123.818 90.749 82.699 1.00 0.00 H ATOM 42895 H2 WAT 3304 122.942 90.344 83.866 1.00 0.00 H TER 42897 WAT 3304 ATOM 42897 O WAT 3305 79.548 33.645 80.146 1.00 0.00 O ATOM 42898 H1 WAT 3305 78.905 34.208 80.577 1.00 0.00 H ATOM 42899 H2 WAT 3305 79.050 32.871 79.883 1.00 0.00 H TER 42901 WAT 3305 ATOM 42901 O WAT 3306 2.206 23.827 83.458 1.00 0.00 O ATOM 42902 H1 WAT 3306 2.176 23.176 84.159 1.00 0.00 H ATOM 42903 H2 WAT 3306 1.310 24.159 83.401 1.00 0.00 H TER 42905 WAT 3306 ATOM 42905 O WAT 3307 2.965 44.744 90.906 1.00 0.00 O ATOM 42906 H1 WAT 3307 3.124 44.080 91.578 1.00 0.00 H ATOM 42907 H2 WAT 3307 2.839 44.243 90.100 1.00 0.00 H TER 42909 WAT 3307 ATOM 42909 O WAT 3308 56.909 114.211 145.240 1.00 0.00 O ATOM 42910 H1 WAT 3308 57.243 114.583 144.424 1.00 0.00 H ATOM 42911 H2 WAT 3308 56.349 114.896 145.605 1.00 0.00 H TER 42913 WAT 3308 ATOM 42913 O WAT 3309 17.739 78.846 101.406 1.00 0.00 O ATOM 42914 H1 WAT 3309 18.571 78.707 101.859 1.00 0.00 H ATOM 42915 H2 WAT 3309 17.255 78.031 101.540 1.00 0.00 H TER 42917 WAT 3309 ATOM 42917 O WAT 3310 128.226 63.210 6.109 1.00 0.00 O ATOM 42918 H1 WAT 3310 129.162 63.026 6.194 1.00 0.00 H ATOM 42919 H2 WAT 3310 128.183 64.142 5.899 1.00 0.00 H TER 42921 WAT 3310 ATOM 42921 O WAT 3311 86.523 59.461 68.722 1.00 0.00 O ATOM 42922 H1 WAT 3311 86.683 59.014 69.553 1.00 0.00 H ATOM 42923 H2 WAT 3311 86.411 58.754 68.087 1.00 0.00 H TER 42925 WAT 3311 ATOM 42925 O WAT 3312 116.339 20.147 129.597 1.00 0.00 O ATOM 42926 H1 WAT 3312 117.249 20.445 129.614 1.00 0.00 H ATOM 42927 H2 WAT 3312 116.193 19.873 128.692 1.00 0.00 H TER 42929 WAT 3312 ATOM 42929 O WAT 3313 18.639 1.855 9.312 1.00 0.00 O ATOM 42930 H1 WAT 3313 18.134 2.666 9.364 1.00 0.00 H ATOM 42931 H2 WAT 3313 18.450 1.509 8.439 1.00 0.00 H TER 42933 WAT 3313 ATOM 42933 O WAT 3314 19.746 46.824 120.765 1.00 0.00 O ATOM 42934 H1 WAT 3314 20.085 46.888 121.658 1.00 0.00 H ATOM 42935 H2 WAT 3314 18.796 46.789 120.872 1.00 0.00 H TER 42937 WAT 3314 ATOM 42937 O WAT 3315 125.448 21.656 60.249 1.00 0.00 O ATOM 42938 H1 WAT 3315 126.051 22.361 60.484 1.00 0.00 H ATOM 42939 H2 WAT 3315 124.859 21.585 61.000 1.00 0.00 H TER 42941 WAT 3315 ATOM 42941 O WAT 3316 80.021 96.256 101.347 1.00 0.00 O ATOM 42942 H1 WAT 3316 79.219 96.774 101.269 1.00 0.00 H ATOM 42943 H2 WAT 3316 80.293 96.098 100.443 1.00 0.00 H TER 42945 WAT 3316 ATOM 42945 O WAT 3317 48.166 80.241 90.634 1.00 0.00 O ATOM 42946 H1 WAT 3317 47.816 80.421 89.761 1.00 0.00 H ATOM 42947 H2 WAT 3317 47.401 79.989 91.151 1.00 0.00 H TER 42949 WAT 3317 ATOM 42949 O WAT 3318 107.099 20.851 158.820 1.00 0.00 O ATOM 42950 H1 WAT 3318 107.011 20.030 159.304 1.00 0.00 H ATOM 42951 H2 WAT 3318 107.232 20.581 157.912 1.00 0.00 H TER 42953 WAT 3318 ATOM 42953 O WAT 3319 14.840 85.615 152.997 1.00 0.00 O ATOM 42954 H1 WAT 3319 14.911 85.091 153.795 1.00 0.00 H ATOM 42955 H2 WAT 3319 14.421 85.031 152.365 1.00 0.00 H TER 42957 WAT 3319 ATOM 42957 O WAT 3320 86.641 51.737 148.482 1.00 0.00 O ATOM 42958 H1 WAT 3320 86.935 52.609 148.744 1.00 0.00 H ATOM 42959 H2 WAT 3320 85.701 51.737 148.662 1.00 0.00 H TER 42961 WAT 3320 ATOM 42961 O WAT 3321 30.632 90.854 4.288 1.00 0.00 O ATOM 42962 H1 WAT 3321 29.915 91.016 3.676 1.00 0.00 H ATOM 42963 H2 WAT 3321 31.013 91.719 4.445 1.00 0.00 H TER 42965 WAT 3321 ATOM 42965 O WAT 3322 44.121 50.108 4.313 1.00 0.00 O ATOM 42966 H1 WAT 3322 43.882 51.034 4.316 1.00 0.00 H ATOM 42967 H2 WAT 3322 44.989 50.083 4.716 1.00 0.00 H TER 42969 WAT 3322 ATOM 42969 O WAT 3323 80.431 24.906 152.933 1.00 0.00 O ATOM 42970 H1 WAT 3323 79.844 24.323 152.450 1.00 0.00 H ATOM 42971 H2 WAT 3323 79.902 25.226 153.664 1.00 0.00 H TER 42973 WAT 3323 ATOM 42973 O WAT 3324 94.833 43.076 75.622 1.00 0.00 O ATOM 42974 H1 WAT 3324 93.960 42.684 75.612 1.00 0.00 H ATOM 42975 H2 WAT 3324 95.382 42.448 75.151 1.00 0.00 H TER 42977 WAT 3324 ATOM 42977 O WAT 3325 134.918 48.453 109.501 1.00 0.00 O ATOM 42978 H1 WAT 3325 134.459 47.652 109.247 1.00 0.00 H ATOM 42979 H2 WAT 3325 135.525 48.173 110.187 1.00 0.00 H TER 42981 WAT 3325 ATOM 42981 O WAT 3326 142.396 138.092 138.454 1.00 0.00 O ATOM 42982 H1 WAT 3326 141.676 138.559 138.030 1.00 0.00 H ATOM 42983 H2 WAT 3326 142.431 137.248 138.005 1.00 0.00 H TER 42985 WAT 3326 ATOM 42985 O WAT 3327 38.563 118.963 132.079 1.00 0.00 O ATOM 42986 H1 WAT 3327 38.029 119.205 131.322 1.00 0.00 H ATOM 42987 H2 WAT 3327 37.947 118.943 132.811 1.00 0.00 H TER 42989 WAT 3327 ATOM 42989 O WAT 3328 117.446 109.613 89.376 1.00 0.00 O ATOM 42990 H1 WAT 3328 118.163 110.243 89.304 1.00 0.00 H ATOM 42991 H2 WAT 3328 117.782 108.819 88.960 1.00 0.00 H TER 42993 WAT 3328 ATOM 42993 O WAT 3329 24.898 142.923 79.508 1.00 0.00 O ATOM 42994 H1 WAT 3329 24.551 142.630 80.350 1.00 0.00 H ATOM 42995 H2 WAT 3329 25.566 143.570 79.736 1.00 0.00 H TER 42997 WAT 3329 ATOM 42997 O WAT 3330 22.316 119.901 157.355 1.00 0.00 O ATOM 42998 H1 WAT 3330 22.713 120.669 157.766 1.00 0.00 H ATOM 42999 H2 WAT 3330 22.111 120.185 156.465 1.00 0.00 H TER 43001 WAT 3330 ATOM 43001 O WAT 3331 102.008 47.271 58.145 1.00 0.00 O ATOM 43002 H1 WAT 3331 102.340 46.373 58.162 1.00 0.00 H ATOM 43003 H2 WAT 3331 102.793 47.817 58.200 1.00 0.00 H TER 43005 WAT 3331 ATOM 43005 O WAT 3332 12.681 95.281 76.278 1.00 0.00 O ATOM 43006 H1 WAT 3332 13.577 94.972 76.411 1.00 0.00 H ATOM 43007 H2 WAT 3332 12.349 94.749 75.554 1.00 0.00 H TER 43009 WAT 3332 ATOM 43009 O WAT 3333 35.906 73.978 11.830 1.00 0.00 O ATOM 43010 H1 WAT 3333 35.201 73.478 12.240 1.00 0.00 H ATOM 43011 H2 WAT 3333 36.383 73.334 11.307 1.00 0.00 H TER 43013 WAT 3333 ATOM 43013 O WAT 3334 3.296 123.794 102.693 1.00 0.00 O ATOM 43014 H1 WAT 3334 4.064 124.133 102.233 1.00 0.00 H ATOM 43015 H2 WAT 3334 3.615 123.016 103.150 1.00 0.00 H TER 43017 WAT 3334 ATOM 43017 O WAT 3335 128.415 55.022 53.679 1.00 0.00 O ATOM 43018 H1 WAT 3335 128.484 54.068 53.689 1.00 0.00 H ATOM 43019 H2 WAT 3335 129.193 55.324 54.148 1.00 0.00 H TER 43021 WAT 3335 ATOM 43021 O WAT 3336 138.298 64.471 2.294 1.00 0.00 O ATOM 43022 H1 WAT 3336 137.401 64.214 2.508 1.00 0.00 H ATOM 43023 H2 WAT 3336 138.634 63.748 1.764 1.00 0.00 H TER 43025 WAT 3336 ATOM 43025 O WAT 3337 46.905 86.765 156.582 1.00 0.00 O ATOM 43026 H1 WAT 3337 47.132 86.539 157.484 1.00 0.00 H ATOM 43027 H2 WAT 3337 47.674 87.229 156.251 1.00 0.00 H TER 43029 WAT 3337 ATOM 43029 O WAT 3338 94.234 45.479 117.417 1.00 0.00 O ATOM 43030 H1 WAT 3338 93.917 44.594 117.238 1.00 0.00 H ATOM 43031 H2 WAT 3338 94.074 45.960 116.604 1.00 0.00 H TER 43033 WAT 3338 ATOM 43033 O WAT 3339 38.268 137.583 21.900 1.00 0.00 O ATOM 43034 H1 WAT 3339 38.357 137.422 22.840 1.00 0.00 H ATOM 43035 H2 WAT 3339 39.164 137.730 21.596 1.00 0.00 H TER 43037 WAT 3339 ATOM 43037 O WAT 3340 112.877 37.726 151.188 1.00 0.00 O ATOM 43038 H1 WAT 3340 112.733 36.960 150.632 1.00 0.00 H ATOM 43039 H2 WAT 3340 113.650 38.150 150.815 1.00 0.00 H TER 43041 WAT 3340 ATOM 43041 O WAT 3341 117.479 75.501 105.465 1.00 0.00 O ATOM 43042 H1 WAT 3341 118.060 74.741 105.457 1.00 0.00 H ATOM 43043 H2 WAT 3341 117.128 75.545 104.576 1.00 0.00 H TER 43045 WAT 3341 ATOM 43045 O WAT 3342 71.338 87.219 108.529 1.00 0.00 O ATOM 43046 H1 WAT 3342 70.875 86.382 108.576 1.00 0.00 H ATOM 43047 H2 WAT 3342 70.742 87.795 108.050 1.00 0.00 H TER 43049 WAT 3342 ATOM 43049 O WAT 3343 53.384 17.119 84.519 1.00 0.00 O ATOM 43050 H1 WAT 3343 54.260 17.287 84.173 1.00 0.00 H ATOM 43051 H2 WAT 3343 53.491 16.355 85.085 1.00 0.00 H TER 43053 WAT 3343 ATOM 43053 O WAT 3344 88.713 128.775 84.248 1.00 0.00 O ATOM 43054 H1 WAT 3344 89.112 128.611 85.103 1.00 0.00 H ATOM 43055 H2 WAT 3344 87.872 129.183 84.451 1.00 0.00 H TER 43057 WAT 3344 ATOM 43057 O WAT 3345 84.621 100.659 18.201 1.00 0.00 O ATOM 43058 H1 WAT 3345 84.657 101.276 17.470 1.00 0.00 H ATOM 43059 H2 WAT 3345 85.249 101.004 18.836 1.00 0.00 H TER 43061 WAT 3345 ATOM 43061 O WAT 3346 31.441 53.317 130.004 1.00 0.00 O ATOM 43062 H1 WAT 3346 30.527 53.466 129.762 1.00 0.00 H ATOM 43063 H2 WAT 3346 31.577 53.866 130.775 1.00 0.00 H TER 43065 WAT 3346 ATOM 43065 O WAT 3347 37.168 19.408 93.878 1.00 0.00 O ATOM 43066 H1 WAT 3347 36.406 19.086 93.396 1.00 0.00 H ATOM 43067 H2 WAT 3347 37.010 19.139 94.783 1.00 0.00 H TER 43069 WAT 3347 ATOM 43069 O WAT 3348 120.138 3.740 144.381 1.00 0.00 O ATOM 43070 H1 WAT 3348 120.745 4.462 144.545 1.00 0.00 H ATOM 43071 H2 WAT 3348 119.589 3.707 145.165 1.00 0.00 H TER 43073 WAT 3348 ATOM 43073 O WAT 3349 89.086 75.849 59.107 1.00 0.00 O ATOM 43074 H1 WAT 3349 89.534 75.134 59.560 1.00 0.00 H ATOM 43075 H2 WAT 3349 89.792 76.426 58.814 1.00 0.00 H TER 43077 WAT 3349 ATOM 43077 O WAT 3350 57.127 10.250 78.290 1.00 0.00 O ATOM 43078 H1 WAT 3350 56.406 10.558 78.839 1.00 0.00 H ATOM 43079 H2 WAT 3350 57.893 10.725 78.612 1.00 0.00 H TER 43081 WAT 3350 ATOM 43081 O WAT 3351 89.566 110.907 1.828 1.00 0.00 O ATOM 43082 H1 WAT 3351 89.196 110.284 2.453 1.00 0.00 H ATOM 43083 H2 WAT 3351 90.275 111.335 2.308 1.00 0.00 H TER 43085 WAT 3351 ATOM 43085 O WAT 3352 115.822 118.819 107.507 1.00 0.00 O ATOM 43086 H1 WAT 3352 116.035 119.258 106.683 1.00 0.00 H ATOM 43087 H2 WAT 3352 116.614 118.908 108.037 1.00 0.00 H TER 43089 WAT 3352 ATOM 43089 O WAT 3353 101.281 64.206 87.834 1.00 0.00 O ATOM 43090 H1 WAT 3353 101.324 64.449 88.759 1.00 0.00 H ATOM 43091 H2 WAT 3353 100.770 64.905 87.427 1.00 0.00 H TER 43093 WAT 3353 ATOM 43093 O WAT 3354 131.730 31.892 79.219 1.00 0.00 O ATOM 43094 H1 WAT 3354 131.123 31.212 78.926 1.00 0.00 H ATOM 43095 H2 WAT 3354 131.248 32.368 79.896 1.00 0.00 H TER 43097 WAT 3354 ATOM 43097 O WAT 3355 13.604 89.612 75.074 1.00 0.00 O ATOM 43098 H1 WAT 3355 12.879 89.109 74.703 1.00 0.00 H ATOM 43099 H2 WAT 3355 14.316 88.977 75.160 1.00 0.00 H TER 43101 WAT 3355 ATOM 43101 O WAT 3356 37.814 68.506 80.567 1.00 0.00 O ATOM 43102 H1 WAT 3356 37.234 68.320 79.828 1.00 0.00 H ATOM 43103 H2 WAT 3356 37.419 68.041 81.305 1.00 0.00 H TER 43105 WAT 3356 ATOM 43105 O WAT 3357 49.301 13.941 91.793 1.00 0.00 O ATOM 43106 H1 WAT 3357 49.788 14.452 91.146 1.00 0.00 H ATOM 43107 H2 WAT 3357 48.456 13.770 91.377 1.00 0.00 H TER 43109 WAT 3357 ATOM 43109 O WAT 3358 13.257 20.424 1.648 1.00 0.00 O ATOM 43110 H1 WAT 3358 13.070 20.937 2.434 1.00 0.00 H ATOM 43111 H2 WAT 3358 12.489 20.552 1.090 1.00 0.00 H TER 43113 WAT 3358 ATOM 43113 O WAT 3359 111.460 70.382 139.784 1.00 0.00 O ATOM 43114 H1 WAT 3359 111.804 71.274 139.726 1.00 0.00 H ATOM 43115 H2 WAT 3359 110.529 70.496 139.973 1.00 0.00 H TER 43117 WAT 3359 ATOM 43117 O WAT 3360 58.985 139.476 76.361 1.00 0.00 O ATOM 43118 H1 WAT 3360 59.758 138.997 76.661 1.00 0.00 H ATOM 43119 H2 WAT 3360 59.234 140.398 76.426 1.00 0.00 H TER 43121 WAT 3360 ATOM 43121 O WAT 3361 143.558 119.053 150.948 1.00 0.00 O ATOM 43122 H1 WAT 3361 144.370 118.590 151.152 1.00 0.00 H ATOM 43123 H2 WAT 3361 142.895 118.364 150.895 1.00 0.00 H TER 43125 WAT 3361 ATOM 43125 O WAT 3362 91.661 43.299 132.066 1.00 0.00 O ATOM 43126 H1 WAT 3362 92.380 43.771 132.487 1.00 0.00 H ATOM 43127 H2 WAT 3362 91.159 42.930 132.793 1.00 0.00 H TER 43129 WAT 3362 ATOM 43129 O WAT 3363 8.473 21.189 98.246 1.00 0.00 O ATOM 43130 H1 WAT 3363 8.481 21.118 99.200 1.00 0.00 H ATOM 43131 H2 WAT 3363 8.579 20.289 97.938 1.00 0.00 H TER 43133 WAT 3363 ATOM 43133 O WAT 3364 103.286 42.144 114.518 1.00 0.00 O ATOM 43134 H1 WAT 3364 103.974 42.756 114.780 1.00 0.00 H ATOM 43135 H2 WAT 3364 102.581 42.701 114.190 1.00 0.00 H TER 43137 WAT 3364 ATOM 43137 O WAT 3365 61.966 136.234 87.015 1.00 0.00 O ATOM 43138 H1 WAT 3365 62.435 135.420 86.827 1.00 0.00 H ATOM 43139 H2 WAT 3365 61.354 136.331 86.285 1.00 0.00 H TER 43141 WAT 3365 ATOM 43141 O WAT 3366 78.675 88.031 3.594 1.00 0.00 O ATOM 43142 H1 WAT 3366 78.188 88.482 2.904 1.00 0.00 H ATOM 43143 H2 WAT 3366 79.443 87.673 3.150 1.00 0.00 H TER 43145 WAT 3366 ATOM 43145 O WAT 3367 47.775 11.151 121.293 1.00 0.00 O ATOM 43146 H1 WAT 3367 48.121 10.966 120.421 1.00 0.00 H ATOM 43147 H2 WAT 3367 48.042 10.400 121.822 1.00 0.00 H TER 43149 WAT 3367 ATOM 43149 O WAT 3368 119.121 130.597 11.271 1.00 0.00 O ATOM 43150 H1 WAT 3368 119.730 129.866 11.374 1.00 0.00 H ATOM 43151 H2 WAT 3368 119.404 131.032 10.466 1.00 0.00 H TER 43153 WAT 3368 ATOM 43153 O WAT 3369 105.012 85.877 113.056 1.00 0.00 O ATOM 43154 H1 WAT 3369 105.319 86.728 113.369 1.00 0.00 H ATOM 43155 H2 WAT 3369 104.757 85.408 113.851 1.00 0.00 H TER 43157 WAT 3369 ATOM 43157 O WAT 3370 38.079 67.315 113.322 1.00 0.00 O ATOM 43158 H1 WAT 3370 38.367 66.406 113.401 1.00 0.00 H ATOM 43159 H2 WAT 3370 38.755 67.822 113.772 1.00 0.00 H TER 43161 WAT 3370 ATOM 43161 O WAT 3371 95.937 8.953 131.744 1.00 0.00 O ATOM 43162 H1 WAT 3371 95.636 9.700 131.227 1.00 0.00 H ATOM 43163 H2 WAT 3371 95.440 8.209 131.404 1.00 0.00 H TER 43165 WAT 3371 ATOM 43165 O WAT 3372 73.648 133.851 128.610 1.00 0.00 O ATOM 43166 H1 WAT 3372 74.550 133.966 128.313 1.00 0.00 H ATOM 43167 H2 WAT 3372 73.190 133.488 127.852 1.00 0.00 H TER 43169 WAT 3372 ATOM 43169 O WAT 3373 41.516 31.404 156.102 1.00 0.00 O ATOM 43170 H1 WAT 3373 41.495 30.926 156.931 1.00 0.00 H ATOM 43171 H2 WAT 3373 41.321 32.309 156.343 1.00 0.00 H TER 43173 WAT 3373 ATOM 43173 O WAT 3374 15.734 118.392 1.238 1.00 0.00 O ATOM 43174 H1 WAT 3374 14.780 118.329 1.215 1.00 0.00 H ATOM 43175 H2 WAT 3374 15.908 119.274 1.566 1.00 0.00 H TER 43177 WAT 3374 ATOM 43177 O WAT 3375 111.294 39.355 64.424 1.00 0.00 O ATOM 43178 H1 WAT 3375 110.902 38.786 65.086 1.00 0.00 H ATOM 43179 H2 WAT 3375 110.585 39.945 64.167 1.00 0.00 H TER 43181 WAT 3375 ATOM 43181 O WAT 3376 26.177 104.281 130.543 1.00 0.00 O ATOM 43182 H1 WAT 3376 26.625 103.479 130.274 1.00 0.00 H ATOM 43183 H2 WAT 3376 26.150 104.233 131.499 1.00 0.00 H TER 43185 WAT 3376 ATOM 43185 O WAT 3377 123.116 23.899 59.199 1.00 0.00 O ATOM 43186 H1 WAT 3377 123.228 24.340 60.041 1.00 0.00 H ATOM 43187 H2 WAT 3377 122.185 23.994 59.000 1.00 0.00 H TER 43189 WAT 3377 ATOM 43189 O WAT 3378 16.234 64.093 81.169 1.00 0.00 O ATOM 43190 H1 WAT 3378 16.492 64.693 81.869 1.00 0.00 H ATOM 43191 H2 WAT 3378 15.763 63.391 81.617 1.00 0.00 H TER 43193 WAT 3378 ATOM 43193 O WAT 3379 33.498 54.150 81.795 1.00 0.00 O ATOM 43194 H1 WAT 3379 34.372 54.183 81.407 1.00 0.00 H ATOM 43195 H2 WAT 3379 33.355 55.032 82.139 1.00 0.00 H TER 43197 WAT 3379 ATOM 43197 O WAT 3380 139.293 29.312 80.430 1.00 0.00 O ATOM 43198 H1 WAT 3380 139.115 29.308 79.489 1.00 0.00 H ATOM 43199 H2 WAT 3380 138.454 29.086 80.833 1.00 0.00 H TER 43201 WAT 3380 ATOM 43201 O WAT 3381 21.565 77.548 154.595 1.00 0.00 O ATOM 43202 H1 WAT 3381 21.988 77.282 153.778 1.00 0.00 H ATOM 43203 H2 WAT 3381 22.066 78.309 154.887 1.00 0.00 H TER 43205 WAT 3381 ATOM 43205 O WAT 3382 126.691 135.114 119.048 1.00 0.00 O ATOM 43206 H1 WAT 3382 127.358 134.690 118.507 1.00 0.00 H ATOM 43207 H2 WAT 3382 127.182 135.510 119.768 1.00 0.00 H TER 43209 WAT 3382 ATOM 43209 O WAT 3383 82.882 25.020 82.031 1.00 0.00 O ATOM 43210 H1 WAT 3383 83.534 24.516 81.543 1.00 0.00 H ATOM 43211 H2 WAT 3383 82.066 24.535 81.912 1.00 0.00 H TER 43213 WAT 3383 ATOM 43213 O WAT 3384 53.190 20.137 20.693 1.00 0.00 O ATOM 43214 H1 WAT 3384 53.069 20.878 21.287 1.00 0.00 H ATOM 43215 H2 WAT 3384 54.139 20.024 20.641 1.00 0.00 H TER 43217 WAT 3384 ATOM 43217 O WAT 3385 105.514 2.217 88.440 1.00 0.00 O ATOM 43218 H1 WAT 3385 104.956 2.164 89.216 1.00 0.00 H ATOM 43219 H2 WAT 3385 106.362 2.509 88.775 1.00 0.00 H TER 43221 WAT 3385 ATOM 43221 O WAT 3386 69.188 137.655 142.052 1.00 0.00 O ATOM 43222 H1 WAT 3386 68.941 136.741 141.909 1.00 0.00 H ATOM 43223 H2 WAT 3386 69.818 137.622 142.772 1.00 0.00 H TER 43225 WAT 3386 ATOM 43225 O WAT 3387 52.509 108.483 133.640 1.00 0.00 O ATOM 43226 H1 WAT 3387 53.300 108.773 134.095 1.00 0.00 H ATOM 43227 H2 WAT 3387 51.791 108.889 134.126 1.00 0.00 H TER 43229 WAT 3387 ATOM 43229 O WAT 3388 139.019 88.382 157.033 1.00 0.00 O ATOM 43230 H1 WAT 3388 138.376 87.694 157.204 1.00 0.00 H ATOM 43231 H2 WAT 3388 138.949 88.969 157.786 1.00 0.00 H TER 43233 WAT 3388 ATOM 43233 O WAT 3389 106.017 64.499 20.470 1.00 0.00 O ATOM 43234 H1 WAT 3389 105.748 65.275 19.978 1.00 0.00 H ATOM 43235 H2 WAT 3389 106.615 64.836 21.138 1.00 0.00 H TER 43237 WAT 3389 ATOM 43237 O WAT 3390 73.350 85.105 121.133 1.00 0.00 O ATOM 43238 H1 WAT 3390 73.199 84.238 121.510 1.00 0.00 H ATOM 43239 H2 WAT 3390 73.355 85.696 121.886 1.00 0.00 H TER 43241 WAT 3390 ATOM 43241 O WAT 3391 140.641 137.379 145.693 1.00 0.00 O ATOM 43242 H1 WAT 3391 141.030 136.969 144.920 1.00 0.00 H ATOM 43243 H2 WAT 3391 139.697 137.292 145.560 1.00 0.00 H TER 43245 WAT 3391 ATOM 43245 O WAT 3392 127.231 124.492 80.523 1.00 0.00 O ATOM 43246 H1 WAT 3392 127.967 124.266 79.954 1.00 0.00 H ATOM 43247 H2 WAT 3392 126.505 123.959 80.199 1.00 0.00 H TER 43249 WAT 3392 ATOM 43249 O WAT 3393 76.771 85.307 80.638 1.00 0.00 O ATOM 43250 H1 WAT 3393 76.757 86.171 80.227 1.00 0.00 H ATOM 43251 H2 WAT 3393 77.117 85.465 81.516 1.00 0.00 H TER 43253 WAT 3393 ATOM 43253 O WAT 3394 90.762 121.646 134.346 1.00 0.00 O ATOM 43254 H1 WAT 3394 91.668 121.800 134.077 1.00 0.00 H ATOM 43255 H2 WAT 3394 90.244 122.213 133.775 1.00 0.00 H TER 43257 WAT 3394 ATOM 43257 O WAT 3395 11.410 10.189 104.576 1.00 0.00 O ATOM 43258 H1 WAT 3395 12.203 10.464 105.037 1.00 0.00 H ATOM 43259 H2 WAT 3395 11.663 10.173 103.653 1.00 0.00 H TER 43261 WAT 3395 ATOM 43261 O WAT 3396 93.271 89.839 108.914 1.00 0.00 O ATOM 43262 H1 WAT 3396 92.379 89.498 108.852 1.00 0.00 H ATOM 43263 H2 WAT 3396 93.463 90.168 108.036 1.00 0.00 H TER 43265 WAT 3396 ATOM 43265 O WAT 3397 50.375 36.450 97.888 1.00 0.00 O ATOM 43266 H1 WAT 3397 49.437 36.316 97.755 1.00 0.00 H ATOM 43267 H2 WAT 3397 50.648 36.986 97.143 1.00 0.00 H TER 43269 WAT 3397 ATOM 43269 O WAT 3398 37.357 27.046 26.421 1.00 0.00 O ATOM 43270 H1 WAT 3398 37.643 26.181 26.716 1.00 0.00 H ATOM 43271 H2 WAT 3398 38.031 27.323 25.801 1.00 0.00 H TER 43273 WAT 3398 ATOM 43273 O WAT 3399 6.807 53.675 119.023 1.00 0.00 O ATOM 43274 H1 WAT 3399 6.179 52.958 118.946 1.00 0.00 H ATOM 43275 H2 WAT 3399 7.661 53.261 118.895 1.00 0.00 H TER 43277 WAT 3399 ATOM 43277 O WAT 3400 83.872 96.455 148.590 1.00 0.00 O ATOM 43278 H1 WAT 3400 84.482 95.718 148.564 1.00 0.00 H ATOM 43279 H2 WAT 3400 83.350 96.363 147.793 1.00 0.00 H TER 43281 WAT 3400 ATOM 43281 O WAT 3401 109.177 26.403 127.154 1.00 0.00 O ATOM 43282 H1 WAT 3401 108.255 26.197 127.306 1.00 0.00 H ATOM 43283 H2 WAT 3401 109.252 27.335 127.358 1.00 0.00 H TER 43285 WAT 3401 ATOM 43285 O WAT 3402 11.366 27.809 83.947 1.00 0.00 O ATOM 43286 H1 WAT 3402 12.229 27.651 84.329 1.00 0.00 H ATOM 43287 H2 WAT 3402 11.303 27.179 83.229 1.00 0.00 H TER 43289 WAT 3402 ATOM 43289 O WAT 3403 48.548 52.023 64.470 1.00 0.00 O ATOM 43290 H1 WAT 3403 47.686 51.764 64.797 1.00 0.00 H ATOM 43291 H2 WAT 3403 48.473 51.955 63.518 1.00 0.00 H TER 43293 WAT 3403 ATOM 43293 O WAT 3404 111.769 94.880 153.868 1.00 0.00 O ATOM 43294 H1 WAT 3404 111.902 94.832 154.815 1.00 0.00 H ATOM 43295 H2 WAT 3404 112.649 94.988 153.508 1.00 0.00 H TER 43297 WAT 3404 ATOM 43297 O WAT 3405 14.709 121.536 122.226 1.00 0.00 O ATOM 43298 H1 WAT 3405 14.700 122.374 122.688 1.00 0.00 H ATOM 43299 H2 WAT 3405 14.830 121.770 121.306 1.00 0.00 H TER 43301 WAT 3405 ATOM 43301 O WAT 3406 101.581 13.203 94.290 1.00 0.00 O ATOM 43302 H1 WAT 3406 102.473 13.046 93.981 1.00 0.00 H ATOM 43303 H2 WAT 3406 101.523 12.715 95.111 1.00 0.00 H TER 43305 WAT 3406 ATOM 43305 O WAT 3407 15.370 90.299 89.255 1.00 0.00 O ATOM 43306 H1 WAT 3407 15.134 89.450 88.880 1.00 0.00 H ATOM 43307 H2 WAT 3407 14.692 90.468 89.909 1.00 0.00 H TER 43309 WAT 3407 ATOM 43309 O WAT 3408 80.930 92.449 138.772 1.00 0.00 O ATOM 43310 H1 WAT 3408 80.403 93.194 138.485 1.00 0.00 H ATOM 43311 H2 WAT 3408 81.830 92.694 138.553 1.00 0.00 H TER 43313 WAT 3408 ATOM 43313 O WAT 3409 46.366 0.948 157.844 1.00 0.00 O ATOM 43314 H1 WAT 3409 46.526 0.253 158.482 1.00 0.00 H ATOM 43315 H2 WAT 3409 45.437 0.866 157.627 1.00 0.00 H TER 43317 WAT 3409 ATOM 43317 O WAT 3410 141.737 3.336 20.504 1.00 0.00 O ATOM 43318 H1 WAT 3410 141.992 3.719 19.665 1.00 0.00 H ATOM 43319 H2 WAT 3410 142.357 3.704 21.133 1.00 0.00 H TER 43321 WAT 3410 ATOM 43321 O WAT 3411 118.150 107.743 1.555 1.00 0.00 O ATOM 43322 H1 WAT 3411 118.534 107.368 2.348 1.00 0.00 H ATOM 43323 H2 WAT 3411 118.417 107.148 0.855 1.00 0.00 H TER 43325 WAT 3411 ATOM 43325 O WAT 3412 130.537 35.432 95.258 1.00 0.00 O ATOM 43326 H1 WAT 3412 130.335 35.334 96.188 1.00 0.00 H ATOM 43327 H2 WAT 3412 131.456 35.700 95.240 1.00 0.00 H TER 43329 WAT 3412 ATOM 43329 O WAT 3413 116.333 11.254 125.061 1.00 0.00 O ATOM 43330 H1 WAT 3413 116.594 11.835 125.774 1.00 0.00 H ATOM 43331 H2 WAT 3413 117.069 10.649 124.964 1.00 0.00 H TER 43333 WAT 3413 ATOM 43333 O WAT 3414 66.345 29.285 95.218 1.00 0.00 O ATOM 43334 H1 WAT 3414 66.241 29.988 95.859 1.00 0.00 H ATOM 43335 H2 WAT 3414 66.385 29.735 94.374 1.00 0.00 H TER 43337 WAT 3414 ATOM 43337 O WAT 3415 106.919 46.577 129.687 1.00 0.00 O ATOM 43338 H1 WAT 3415 107.854 46.409 129.572 1.00 0.00 H ATOM 43339 H2 WAT 3415 106.497 45.745 129.470 1.00 0.00 H TER 43341 WAT 3415 ATOM 43341 O WAT 3416 97.100 9.348 17.370 1.00 0.00 O ATOM 43342 H1 WAT 3416 96.719 8.506 17.124 1.00 0.00 H ATOM 43343 H2 WAT 3416 97.177 9.827 16.545 1.00 0.00 H TER 43345 WAT 3416 ATOM 43345 O WAT 3417 41.836 131.438 76.008 1.00 0.00 O ATOM 43346 H1 WAT 3417 42.396 130.760 75.630 1.00 0.00 H ATOM 43347 H2 WAT 3417 41.467 131.033 76.793 1.00 0.00 H TER 43349 WAT 3417 ATOM 43349 O WAT 3418 135.474 15.850 78.671 1.00 0.00 O ATOM 43350 H1 WAT 3418 134.526 15.737 78.726 1.00 0.00 H ATOM 43351 H2 WAT 3418 135.765 15.155 78.081 1.00 0.00 H TER 43353 WAT 3418 ATOM 43353 O WAT 3419 117.805 11.566 63.118 1.00 0.00 O ATOM 43354 H1 WAT 3419 118.100 11.788 64.001 1.00 0.00 H ATOM 43355 H2 WAT 3419 117.240 10.803 63.240 1.00 0.00 H TER 43357 WAT 3419 ATOM 43357 O WAT 3420 49.938 73.886 113.848 1.00 0.00 O ATOM 43358 H1 WAT 3420 49.744 74.271 114.703 1.00 0.00 H ATOM 43359 H2 WAT 3420 50.212 74.627 113.307 1.00 0.00 H TER 43361 WAT 3420 ATOM 43361 O WAT 3421 110.859 113.787 90.996 1.00 0.00 O ATOM 43362 H1 WAT 3421 111.432 114.004 90.261 1.00 0.00 H ATOM 43363 H2 WAT 3421 110.659 112.859 90.879 1.00 0.00 H TER 43365 WAT 3421 ATOM 43365 O WAT 3422 75.312 40.163 70.156 1.00 0.00 O ATOM 43366 H1 WAT 3422 75.681 40.225 69.275 1.00 0.00 H ATOM 43367 H2 WAT 3422 74.433 39.810 70.023 1.00 0.00 H TER 43369 WAT 3422 ATOM 43369 O WAT 3423 69.769 109.446 139.457 1.00 0.00 O ATOM 43370 H1 WAT 3423 69.286 108.818 139.993 1.00 0.00 H ATOM 43371 H2 WAT 3423 70.106 110.086 140.084 1.00 0.00 H TER 43373 WAT 3423 ATOM 43373 O WAT 3424 56.814 87.462 73.630 1.00 0.00 O ATOM 43374 H1 WAT 3424 57.360 88.006 73.062 1.00 0.00 H ATOM 43375 H2 WAT 3424 56.386 88.085 74.218 1.00 0.00 H TER 43377 WAT 3424 ATOM 43377 O WAT 3425 117.297 89.835 76.833 1.00 0.00 O ATOM 43378 H1 WAT 3425 117.043 90.655 76.409 1.00 0.00 H ATOM 43379 H2 WAT 3425 117.537 90.090 77.723 1.00 0.00 H TER 43381 WAT 3425 ATOM 43381 O WAT 3426 43.044 99.997 126.927 1.00 0.00 O ATOM 43382 H1 WAT 3426 43.378 99.630 126.108 1.00 0.00 H ATOM 43383 H2 WAT 3426 42.531 100.759 126.656 1.00 0.00 H TER 43385 WAT 3426 ATOM 43385 O WAT 3427 25.590 130.223 58.845 1.00 0.00 O ATOM 43386 H1 WAT 3427 26.428 130.122 59.296 1.00 0.00 H ATOM 43387 H2 WAT 3427 25.790 130.775 58.088 1.00 0.00 H TER 43389 WAT 3427 ATOM 43389 O WAT 3428 7.635 13.494 66.666 1.00 0.00 O ATOM 43390 H1 WAT 3428 8.473 13.034 66.603 1.00 0.00 H ATOM 43391 H2 WAT 3428 7.056 13.019 66.070 1.00 0.00 H TER 43393 WAT 3428 ATOM 43393 O WAT 3429 49.216 103.455 87.263 1.00 0.00 O ATOM 43394 H1 WAT 3429 49.267 102.500 87.287 1.00 0.00 H ATOM 43395 H2 WAT 3429 49.226 103.672 86.331 1.00 0.00 H TER 43397 WAT 3429 ATOM 43397 O WAT 3430 39.240 88.831 78.143 1.00 0.00 O ATOM 43398 H1 WAT 3430 38.295 88.693 78.203 1.00 0.00 H ATOM 43399 H2 WAT 3430 39.604 87.952 78.039 1.00 0.00 H TER 43401 WAT 3430 ATOM 43401 O WAT 3431 0.490 114.685 121.488 1.00 0.00 O ATOM 43402 H1 WAT 3431 0.506 113.934 122.081 1.00 0.00 H ATOM 43403 H2 WAT 3431 -0.415 114.728 121.179 1.00 0.00 H TER 43405 WAT 3431 ATOM 43405 O WAT 3432 83.120 120.672 107.250 1.00 0.00 O ATOM 43406 H1 WAT 3432 83.704 120.316 106.580 1.00 0.00 H ATOM 43407 H2 WAT 3432 82.565 121.293 106.779 1.00 0.00 H TER 43409 WAT 3432 ATOM 43409 O WAT 3433 132.947 62.997 127.974 1.00 0.00 O ATOM 43410 H1 WAT 3433 132.723 62.453 127.218 1.00 0.00 H ATOM 43411 H2 WAT 3433 133.889 63.144 127.892 1.00 0.00 H TER 43413 WAT 3433 ATOM 43413 O WAT 3434 10.825 96.672 8.172 1.00 0.00 O ATOM 43414 H1 WAT 3434 9.912 96.798 7.915 1.00 0.00 H ATOM 43415 H2 WAT 3434 10.879 95.751 8.424 1.00 0.00 H TER 43417 WAT 3434 ATOM 43417 O WAT 3435 53.287 89.123 127.664 1.00 0.00 O ATOM 43418 H1 WAT 3435 52.998 89.108 126.752 1.00 0.00 H ATOM 43419 H2 WAT 3435 52.913 89.928 128.021 1.00 0.00 H TER 43421 WAT 3435 ATOM 43421 O WAT 3436 139.504 63.288 117.480 1.00 0.00 O ATOM 43422 H1 WAT 3436 140.125 62.727 117.016 1.00 0.00 H ATOM 43423 H2 WAT 3436 138.707 62.761 117.544 1.00 0.00 H TER 43425 WAT 3436 ATOM 43425 O WAT 3437 113.068 117.409 4.867 1.00 0.00 O ATOM 43426 H1 WAT 3437 113.184 118.337 4.661 1.00 0.00 H ATOM 43427 H2 WAT 3437 112.233 117.176 4.464 1.00 0.00 H TER 43429 WAT 3437 ATOM 43429 O WAT 3438 73.312 48.066 2.597 1.00 0.00 O ATOM 43430 H1 WAT 3438 74.009 48.221 3.234 1.00 0.00 H ATOM 43431 H2 WAT 3438 72.680 47.518 3.063 1.00 0.00 H TER 43433 WAT 3438 ATOM 43433 O WAT 3439 47.172 33.441 121.291 1.00 0.00 O ATOM 43434 H1 WAT 3439 47.018 33.976 122.070 1.00 0.00 H ATOM 43435 H2 WAT 3439 48.119 33.473 121.161 1.00 0.00 H TER 43437 WAT 3439 ATOM 43437 O WAT 3440 36.929 94.254 115.425 1.00 0.00 O ATOM 43438 H1 WAT 3440 37.404 94.994 115.045 1.00 0.00 H ATOM 43439 H2 WAT 3440 36.202 94.656 115.901 1.00 0.00 H TER 43441 WAT 3440 ATOM 43441 O WAT 3441 39.540 67.373 146.762 1.00 0.00 O ATOM 43442 H1 WAT 3441 40.326 67.898 146.912 1.00 0.00 H ATOM 43443 H2 WAT 3441 39.088 67.819 146.045 1.00 0.00 H TER 43445 WAT 3441 ATOM 43445 O WAT 3442 137.898 98.563 84.388 1.00 0.00 O ATOM 43446 H1 WAT 3442 137.754 97.883 83.730 1.00 0.00 H ATOM 43447 H2 WAT 3442 137.400 99.315 84.069 1.00 0.00 H TER 43449 WAT 3442 ATOM 43449 O WAT 3443 132.146 70.222 131.142 1.00 0.00 O ATOM 43450 H1 WAT 3443 133.038 70.550 131.256 1.00 0.00 H ATOM 43451 H2 WAT 3443 131.593 70.999 131.221 1.00 0.00 H TER 43453 WAT 3443 ATOM 43453 O WAT 3444 52.476 97.519 74.491 1.00 0.00 O ATOM 43454 H1 WAT 3444 51.840 97.406 75.198 1.00 0.00 H ATOM 43455 H2 WAT 3444 52.528 96.658 74.077 1.00 0.00 H TER 43457 WAT 3444 ATOM 43457 O WAT 3445 126.864 48.858 18.529 1.00 0.00 O ATOM 43458 H1 WAT 3445 127.278 49.418 19.186 1.00 0.00 H ATOM 43459 H2 WAT 3445 126.049 48.569 18.940 1.00 0.00 H TER 43461 WAT 3445 ATOM 43461 O WAT 3446 50.260 70.206 98.831 1.00 0.00 O ATOM 43462 H1 WAT 3446 49.603 70.584 98.246 1.00 0.00 H ATOM 43463 H2 WAT 3446 50.383 70.868 99.511 1.00 0.00 H TER 43465 WAT 3446 ATOM 43465 O WAT 3447 125.383 88.701 128.147 1.00 0.00 O ATOM 43466 H1 WAT 3447 125.516 87.849 128.563 1.00 0.00 H ATOM 43467 H2 WAT 3447 125.154 89.286 128.869 1.00 0.00 H TER 43469 WAT 3447 ATOM 43469 O WAT 3448 36.523 138.695 7.444 1.00 0.00 O ATOM 43470 H1 WAT 3448 35.795 138.685 6.823 1.00 0.00 H ATOM 43471 H2 WAT 3448 36.366 139.469 7.986 1.00 0.00 H TER 43473 WAT 3448 ATOM 43473 O WAT 3449 74.566 48.480 138.705 1.00 0.00 O ATOM 43474 H1 WAT 3449 75.258 48.190 138.111 1.00 0.00 H ATOM 43475 H2 WAT 3449 74.097 49.156 138.215 1.00 0.00 H TER 43477 WAT 3449 ATOM 43477 O WAT 3450 112.334 77.327 153.266 1.00 0.00 O ATOM 43478 H1 WAT 3450 111.574 77.563 152.735 1.00 0.00 H ATOM 43479 H2 WAT 3450 112.046 76.568 153.774 1.00 0.00 H TER 43481 WAT 3450 ATOM 43481 O WAT 3451 118.959 79.087 87.745 1.00 0.00 O ATOM 43482 H1 WAT 3451 119.172 79.989 87.988 1.00 0.00 H ATOM 43483 H2 WAT 3451 119.089 78.586 88.550 1.00 0.00 H TER 43485 WAT 3451 ATOM 43485 O WAT 3452 114.050 40.992 3.403 1.00 0.00 O ATOM 43486 H1 WAT 3452 114.785 41.528 3.702 1.00 0.00 H ATOM 43487 H2 WAT 3452 113.706 41.461 2.643 1.00 0.00 H TER 43489 WAT 3452 ATOM 43489 O WAT 3453 41.665 112.014 58.477 1.00 0.00 O ATOM 43490 H1 WAT 3453 41.984 111.963 59.378 1.00 0.00 H ATOM 43491 H2 WAT 3453 42.203 112.694 58.071 1.00 0.00 H TER 43493 WAT 3453 ATOM 43493 O WAT 3454 22.508 73.856 80.211 1.00 0.00 O ATOM 43494 H1 WAT 3454 23.182 74.528 80.310 1.00 0.00 H ATOM 43495 H2 WAT 3454 21.957 73.953 80.988 1.00 0.00 H TER 43497 WAT 3454 ATOM 43497 O WAT 3455 53.328 139.495 154.110 1.00 0.00 O ATOM 43498 H1 WAT 3455 53.627 139.961 153.329 1.00 0.00 H ATOM 43499 H2 WAT 3455 53.317 140.162 154.797 1.00 0.00 H TER 43501 WAT 3455 ATOM 43501 O WAT 3456 73.469 136.538 4.542 1.00 0.00 O ATOM 43502 H1 WAT 3456 72.974 135.723 4.623 1.00 0.00 H ATOM 43503 H2 WAT 3456 72.800 137.219 4.472 1.00 0.00 H TER 43505 WAT 3456 ATOM 43505 O WAT 3457 126.150 88.306 2.826 1.00 0.00 O ATOM 43506 H1 WAT 3457 126.771 87.628 3.093 1.00 0.00 H ATOM 43507 H2 WAT 3457 126.621 89.128 2.962 1.00 0.00 H TER 43509 WAT 3457 ATOM 43509 O WAT 3458 76.883 27.360 120.487 1.00 0.00 O ATOM 43510 H1 WAT 3458 77.064 27.851 121.288 1.00 0.00 H ATOM 43511 H2 WAT 3458 76.739 28.032 119.821 1.00 0.00 H TER 43513 WAT 3458 ATOM 43513 O WAT 3459 68.804 74.205 90.149 1.00 0.00 O ATOM 43514 H1 WAT 3459 68.935 75.153 90.108 1.00 0.00 H ATOM 43515 H2 WAT 3459 67.967 74.099 90.602 1.00 0.00 H TER 43517 WAT 3459 ATOM 43517 O WAT 3460 9.133 119.060 65.243 1.00 0.00 O ATOM 43518 H1 WAT 3460 8.665 119.571 64.583 1.00 0.00 H ATOM 43519 H2 WAT 3460 10.057 119.255 65.087 1.00 0.00 H TER 43521 WAT 3460 ATOM 43521 O WAT 3461 27.247 94.822 6.245 1.00 0.00 O ATOM 43522 H1 WAT 3461 26.483 94.431 6.669 1.00 0.00 H ATOM 43523 H2 WAT 3461 26.933 95.664 5.914 1.00 0.00 H TER 43525 WAT 3461 ATOM 43525 O WAT 3462 142.715 122.697 101.159 1.00 0.00 O ATOM 43526 H1 WAT 3462 142.122 123.140 101.766 1.00 0.00 H ATOM 43527 H2 WAT 3462 143.296 122.185 101.722 1.00 0.00 H TER 43529 WAT 3462 ATOM 43529 O WAT 3463 86.982 78.217 16.283 1.00 0.00 O ATOM 43530 H1 WAT 3463 86.128 78.080 15.872 1.00 0.00 H ATOM 43531 H2 WAT 3463 87.529 78.574 15.584 1.00 0.00 H TER 43533 WAT 3463 ATOM 43533 O WAT 3464 99.409 106.318 0.660 1.00 0.00 O ATOM 43534 H1 WAT 3464 100.042 106.124 -0.031 1.00 0.00 H ATOM 43535 H2 WAT 3464 98.561 106.095 0.277 1.00 0.00 H TER 43537 WAT 3464 ATOM 43537 O WAT 3465 6.885 111.221 2.398 1.00 0.00 O ATOM 43538 H1 WAT 3465 7.783 111.365 2.101 1.00 0.00 H ATOM 43539 H2 WAT 3465 6.368 111.190 1.593 1.00 0.00 H TER 43541 WAT 3465 ATOM 43541 O WAT 3466 140.985 70.083 10.737 1.00 0.00 O ATOM 43542 H1 WAT 3466 141.041 69.280 10.220 1.00 0.00 H ATOM 43543 H2 WAT 3466 141.291 70.771 10.145 1.00 0.00 H TER 43545 WAT 3466 ATOM 43545 O WAT 3467 18.415 49.121 94.740 1.00 0.00 O ATOM 43546 H1 WAT 3467 18.355 49.731 94.005 1.00 0.00 H ATOM 43547 H2 WAT 3467 18.725 48.305 94.349 1.00 0.00 H TER 43549 WAT 3467 ATOM 43549 O WAT 3468 5.353 25.297 143.912 1.00 0.00 O ATOM 43550 H1 WAT 3468 4.897 26.139 143.897 1.00 0.00 H ATOM 43551 H2 WAT 3468 5.349 25.039 144.834 1.00 0.00 H TER 43553 WAT 3468 ATOM 43553 O WAT 3469 49.687 65.205 55.467 1.00 0.00 O ATOM 43554 H1 WAT 3469 50.190 66.016 55.401 1.00 0.00 H ATOM 43555 H2 WAT 3469 48.776 65.480 55.361 1.00 0.00 H TER 43557 WAT 3469 ATOM 43557 O WAT 3470 72.924 95.680 7.311 1.00 0.00 O ATOM 43558 H1 WAT 3470 72.856 96.260 8.070 1.00 0.00 H ATOM 43559 H2 WAT 3470 73.644 96.044 6.795 1.00 0.00 H TER 43561 WAT 3470 ATOM 43561 O WAT 3471 98.802 48.379 89.910 1.00 0.00 O ATOM 43562 H1 WAT 3471 99.155 48.058 89.081 1.00 0.00 H ATOM 43563 H2 WAT 3471 98.037 47.828 90.074 1.00 0.00 H TER 43565 WAT 3471 ATOM 43565 O WAT 3472 11.973 94.929 102.057 1.00 0.00 O ATOM 43566 H1 WAT 3472 11.970 95.757 101.577 1.00 0.00 H ATOM 43567 H2 WAT 3472 12.208 94.273 101.401 1.00 0.00 H TER 43569 WAT 3472 ATOM 43569 O WAT 3473 108.711 8.887 132.866 1.00 0.00 O ATOM 43570 H1 WAT 3473 109.561 8.522 133.111 1.00 0.00 H ATOM 43571 H2 WAT 3473 108.780 9.043 131.924 1.00 0.00 H TER 43573 WAT 3473 ATOM 43573 O WAT 3474 81.222 133.920 108.423 1.00 0.00 O ATOM 43574 H1 WAT 3474 80.561 133.590 109.032 1.00 0.00 H ATOM 43575 H2 WAT 3474 80.795 134.655 107.982 1.00 0.00 H TER 43577 WAT 3474 ATOM 43577 O WAT 3475 55.686 82.917 117.419 1.00 0.00 O ATOM 43578 H1 WAT 3475 56.475 82.996 116.883 1.00 0.00 H ATOM 43579 H2 WAT 3475 55.958 83.210 118.289 1.00 0.00 H TER 43581 WAT 3475 ATOM 43581 O WAT 3476 114.288 105.259 83.956 1.00 0.00 O ATOM 43582 H1 WAT 3476 113.516 105.515 83.451 1.00 0.00 H ATOM 43583 H2 WAT 3476 114.923 105.958 83.794 1.00 0.00 H TER 43585 WAT 3476 ATOM 43585 O WAT 3477 89.000 103.644 90.287 1.00 0.00 O ATOM 43586 H1 WAT 3477 88.724 103.434 89.394 1.00 0.00 H ATOM 43587 H2 WAT 3477 88.496 104.424 90.517 1.00 0.00 H TER 43589 WAT 3477 ATOM 43589 O WAT 3478 109.847 98.043 9.179 1.00 0.00 O ATOM 43590 H1 WAT 3478 110.599 97.477 9.011 1.00 0.00 H ATOM 43591 H2 WAT 3478 109.589 98.362 8.313 1.00 0.00 H TER 43593 WAT 3478 ATOM 43593 O WAT 3479 66.763 21.588 2.269 1.00 0.00 O ATOM 43594 H1 WAT 3479 67.302 21.022 1.716 1.00 0.00 H ATOM 43595 H2 WAT 3479 67.267 22.398 2.345 1.00 0.00 H TER 43597 WAT 3479 ATOM 43597 O WAT 3480 129.496 20.404 98.194 1.00 0.00 O ATOM 43598 H1 WAT 3480 129.666 19.469 98.304 1.00 0.00 H ATOM 43599 H2 WAT 3480 129.526 20.759 99.083 1.00 0.00 H TER 43601 WAT 3480 ATOM 43601 O WAT 3481 53.593 106.702 97.265 1.00 0.00 O ATOM 43602 H1 WAT 3481 52.645 106.755 97.392 1.00 0.00 H ATOM 43603 H2 WAT 3481 53.846 105.881 97.687 1.00 0.00 H TER 43605 WAT 3481 ATOM 43605 O WAT 3482 142.762 76.031 109.993 1.00 0.00 O ATOM 43606 H1 WAT 3482 142.163 75.334 110.260 1.00 0.00 H ATOM 43607 H2 WAT 3482 143.104 76.381 110.816 1.00 0.00 H TER 43609 WAT 3482 ATOM 43609 O WAT 3483 98.447 79.599 91.542 1.00 0.00 O ATOM 43610 H1 WAT 3483 97.505 79.436 91.584 1.00 0.00 H ATOM 43611 H2 WAT 3483 98.560 80.458 91.949 1.00 0.00 H TER 43613 WAT 3483 ATOM 43613 O WAT 3484 12.470 101.000 66.294 1.00 0.00 O ATOM 43614 H1 WAT 3484 13.054 101.750 66.406 1.00 0.00 H ATOM 43615 H2 WAT 3484 13.058 100.252 66.189 1.00 0.00 H TER 43617 WAT 3484 ATOM 43617 O WAT 3485 98.298 140.404 76.075 1.00 0.00 O ATOM 43618 H1 WAT 3485 98.977 141.066 76.202 1.00 0.00 H ATOM 43619 H2 WAT 3485 98.726 139.576 76.295 1.00 0.00 H TER 43621 WAT 3485 ATOM 43621 O WAT 3486 24.065 114.042 74.894 1.00 0.00 O ATOM 43622 H1 WAT 3486 24.752 114.680 75.084 1.00 0.00 H ATOM 43623 H2 WAT 3486 24.516 113.198 74.889 1.00 0.00 H TER 43625 WAT 3486 ATOM 43625 O WAT 3487 32.453 75.898 113.803 1.00 0.00 O ATOM 43626 H1 WAT 3487 33.375 76.069 113.615 1.00 0.00 H ATOM 43627 H2 WAT 3487 31.977 76.530 113.266 1.00 0.00 H TER 43629 WAT 3487 ATOM 43629 O WAT 3488 55.324 1.666 74.224 1.00 0.00 O ATOM 43630 H1 WAT 3488 55.949 2.241 74.666 1.00 0.00 H ATOM 43631 H2 WAT 3488 54.628 2.252 73.927 1.00 0.00 H TER 43633 WAT 3488 ATOM 43633 O WAT 3489 36.844 22.962 115.287 1.00 0.00 O ATOM 43634 H1 WAT 3489 37.627 22.512 114.969 1.00 0.00 H ATOM 43635 H2 WAT 3489 36.193 22.267 115.388 1.00 0.00 H TER 43637 WAT 3489 ATOM 43637 O WAT 3490 60.445 102.914 104.241 1.00 0.00 O ATOM 43638 H1 WAT 3490 59.845 102.212 103.987 1.00 0.00 H ATOM 43639 H2 WAT 3490 60.804 102.630 105.081 1.00 0.00 H TER 43641 WAT 3490 ATOM 43641 O WAT 3491 102.079 58.514 93.336 1.00 0.00 O ATOM 43642 H1 WAT 3491 101.382 58.766 92.730 1.00 0.00 H ATOM 43643 H2 WAT 3491 102.651 57.945 92.820 1.00 0.00 H TER 43645 WAT 3491 ATOM 43645 O WAT 3492 79.541 67.789 82.024 1.00 0.00 O ATOM 43646 H1 WAT 3492 79.198 68.087 81.181 1.00 0.00 H ATOM 43647 H2 WAT 3492 78.840 67.976 82.648 1.00 0.00 H TER 43649 WAT 3492 ATOM 43649 O WAT 3493 28.619 14.698 134.782 1.00 0.00 O ATOM 43650 H1 WAT 3493 27.876 15.300 134.825 1.00 0.00 H ATOM 43651 H2 WAT 3493 28.231 13.831 134.898 1.00 0.00 H TER 43653 WAT 3493 ATOM 43653 O WAT 3494 130.043 78.163 89.160 1.00 0.00 O ATOM 43654 H1 WAT 3494 129.146 78.192 88.828 1.00 0.00 H ATOM 43655 H2 WAT 3494 130.201 77.237 89.342 1.00 0.00 H TER 43657 WAT 3494 ATOM 43657 O WAT 3495 82.591 44.411 5.508 1.00 0.00 O ATOM 43658 H1 WAT 3495 82.340 43.489 5.454 1.00 0.00 H ATOM 43659 H2 WAT 3495 82.853 44.535 6.420 1.00 0.00 H TER 43661 WAT 3495 ATOM 43661 O WAT 3496 82.810 46.016 19.442 1.00 0.00 O ATOM 43662 H1 WAT 3496 82.037 45.615 19.840 1.00 0.00 H ATOM 43663 H2 WAT 3496 83.502 45.901 20.093 1.00 0.00 H TER 43665 WAT 3496 ATOM 43665 O WAT 3497 48.400 9.141 115.691 1.00 0.00 O ATOM 43666 H1 WAT 3497 48.254 8.195 115.702 1.00 0.00 H ATOM 43667 H2 WAT 3497 48.041 9.449 116.523 1.00 0.00 H TER 43669 WAT 3497 ATOM 43669 O WAT 3498 131.230 81.740 15.885 1.00 0.00 O ATOM 43670 H1 WAT 3498 130.384 81.677 15.442 1.00 0.00 H ATOM 43671 H2 WAT 3498 131.732 80.998 15.547 1.00 0.00 H TER 43673 WAT 3498 ATOM 43673 O WAT 3499 73.255 111.479 120.219 1.00 0.00 O ATOM 43674 H1 WAT 3499 74.111 111.472 120.647 1.00 0.00 H ATOM 43675 H2 WAT 3499 73.178 112.359 119.850 1.00 0.00 H TER 43677 WAT 3499 ATOM 43677 O WAT 3500 144.495 63.895 117.704 1.00 0.00 O ATOM 43678 H1 WAT 3500 144.047 63.216 118.209 1.00 0.00 H ATOM 43679 H2 WAT 3500 145.178 63.425 117.224 1.00 0.00 H TER 43681 WAT 3500 ATOM 43681 O WAT 3501 53.957 133.355 110.091 1.00 0.00 O ATOM 43682 H1 WAT 3501 53.182 133.172 109.560 1.00 0.00 H ATOM 43683 H2 WAT 3501 53.632 133.894 110.812 1.00 0.00 H TER 43685 WAT 3501 ATOM 43685 O WAT 3502 134.020 137.369 87.820 1.00 0.00 O ATOM 43686 H1 WAT 3502 133.951 138.257 88.169 1.00 0.00 H ATOM 43687 H2 WAT 3502 133.130 137.149 87.546 1.00 0.00 H TER 43689 WAT 3502 ATOM 43689 O WAT 3503 133.313 114.568 22.749 1.00 0.00 O ATOM 43690 H1 WAT 3503 133.099 114.218 23.614 1.00 0.00 H ATOM 43691 H2 WAT 3503 134.266 114.494 22.691 1.00 0.00 H TER 43693 WAT 3503 ATOM 43693 O WAT 3504 27.511 43.997 71.425 1.00 0.00 O ATOM 43694 H1 WAT 3504 27.469 43.040 71.441 1.00 0.00 H ATOM 43695 H2 WAT 3504 28.417 44.192 71.185 1.00 0.00 H TER 43697 WAT 3504 ATOM 43697 O WAT 3505 68.287 24.131 2.758 1.00 0.00 O ATOM 43698 H1 WAT 3505 69.117 24.262 3.216 1.00 0.00 H ATOM 43699 H2 WAT 3505 68.353 24.685 1.980 1.00 0.00 H TER 43701 WAT 3505 ATOM 43701 O WAT 3506 34.477 13.407 19.377 1.00 0.00 O ATOM 43702 H1 WAT 3506 34.766 12.789 18.705 1.00 0.00 H ATOM 43703 H2 WAT 3506 34.901 14.232 19.142 1.00 0.00 H TER 43705 WAT 3506 ATOM 43705 O WAT 3507 92.976 118.356 74.220 1.00 0.00 O ATOM 43706 H1 WAT 3507 93.208 117.858 75.004 1.00 0.00 H ATOM 43707 H2 WAT 3507 92.068 118.621 74.365 1.00 0.00 H TER 43709 WAT 3507 ATOM 43709 O WAT 3508 6.164 78.272 63.777 1.00 0.00 O ATOM 43710 H1 WAT 3508 5.751 77.985 62.963 1.00 0.00 H ATOM 43711 H2 WAT 3508 7.100 78.287 63.579 1.00 0.00 H TER 43713 WAT 3508 ATOM 43713 O WAT 3509 107.143 85.812 144.254 1.00 0.00 O ATOM 43714 H1 WAT 3509 107.101 85.600 143.322 1.00 0.00 H ATOM 43715 H2 WAT 3509 108.076 85.781 144.464 1.00 0.00 H TER 43717 WAT 3509 ATOM 43717 O WAT 3510 7.666 31.064 111.335 1.00 0.00 O ATOM 43718 H1 WAT 3510 7.337 30.772 112.186 1.00 0.00 H ATOM 43719 H2 WAT 3510 6.927 31.527 110.940 1.00 0.00 H TER 43721 WAT 3510 ATOM 43721 O WAT 3511 1.397 107.516 134.288 1.00 0.00 O ATOM 43722 H1 WAT 3511 1.733 107.245 133.433 1.00 0.00 H ATOM 43723 H2 WAT 3511 0.641 106.949 134.439 1.00 0.00 H TER 43725 WAT 3511 ATOM 43725 O WAT 3512 42.852 119.996 145.365 1.00 0.00 O ATOM 43726 H1 WAT 3512 43.458 119.605 144.735 1.00 0.00 H ATOM 43727 H2 WAT 3512 41.996 119.941 144.940 1.00 0.00 H TER 43729 WAT 3512 ATOM 43729 O WAT 3513 122.441 51.315 129.934 1.00 0.00 O ATOM 43730 H1 WAT 3513 121.640 51.086 130.404 1.00 0.00 H ATOM 43731 H2 WAT 3513 122.960 51.807 130.570 1.00 0.00 H TER 43733 WAT 3513 ATOM 43733 O WAT 3514 69.036 45.155 79.906 1.00 0.00 O ATOM 43734 H1 WAT 3514 69.652 44.444 79.730 1.00 0.00 H ATOM 43735 H2 WAT 3514 68.327 45.020 79.277 1.00 0.00 H TER 43737 WAT 3514 ATOM 43737 O WAT 3515 63.297 132.347 152.057 1.00 0.00 O ATOM 43738 H1 WAT 3515 62.381 132.533 152.262 1.00 0.00 H ATOM 43739 H2 WAT 3515 63.793 132.947 152.614 1.00 0.00 H TER 43741 WAT 3515 ATOM 43741 O WAT 3516 18.989 112.407 148.538 1.00 0.00 O ATOM 43742 H1 WAT 3516 19.502 111.652 148.250 1.00 0.00 H ATOM 43743 H2 WAT 3516 18.083 112.099 148.528 1.00 0.00 H TER 43745 WAT 3516 ATOM 43745 O WAT 3517 134.120 30.013 69.531 1.00 0.00 O ATOM 43746 H1 WAT 3517 134.047 30.275 68.614 1.00 0.00 H ATOM 43747 H2 WAT 3517 133.323 29.510 69.700 1.00 0.00 H TER 43749 WAT 3517 ATOM 43749 O WAT 3518 60.086 39.760 108.285 1.00 0.00 O ATOM 43750 H1 WAT 3518 60.418 40.475 108.828 1.00 0.00 H ATOM 43751 H2 WAT 3518 60.614 39.801 107.487 1.00 0.00 H TER 43753 WAT 3518 ATOM 43753 O WAT 3519 0.179 51.525 7.864 1.00 0.00 O ATOM 43754 H1 WAT 3519 0.806 51.751 8.552 1.00 0.00 H ATOM 43755 H2 WAT 3519 -0.549 51.114 8.329 1.00 0.00 H TER 43757 WAT 3519 ATOM 43757 O WAT 3520 44.942 138.702 21.806 1.00 0.00 O ATOM 43758 H1 WAT 3520 44.179 138.763 21.231 1.00 0.00 H ATOM 43759 H2 WAT 3520 45.202 137.781 21.762 1.00 0.00 H TER 43761 WAT 3520 ATOM 43761 O WAT 3521 66.116 7.804 65.422 1.00 0.00 O ATOM 43762 H1 WAT 3521 66.068 8.280 66.251 1.00 0.00 H ATOM 43763 H2 WAT 3521 65.697 8.386 64.788 1.00 0.00 H TER 43765 WAT 3521 ATOM 43765 O WAT 3522 56.059 108.122 11.673 1.00 0.00 O ATOM 43766 H1 WAT 3522 56.114 109.034 11.958 1.00 0.00 H ATOM 43767 H2 WAT 3522 56.793 108.016 11.067 1.00 0.00 H TER 43769 WAT 3522 ATOM 43769 O WAT 3523 25.484 120.466 75.430 1.00 0.00 O ATOM 43770 H1 WAT 3523 25.202 121.172 76.012 1.00 0.00 H ATOM 43771 H2 WAT 3523 26.166 120.861 74.886 1.00 0.00 H TER 43773 WAT 3523 ATOM 43773 O WAT 3524 9.745 26.932 151.229 1.00 0.00 O ATOM 43774 H1 WAT 3524 10.100 27.787 151.470 1.00 0.00 H ATOM 43775 H2 WAT 3524 9.053 27.129 150.597 1.00 0.00 H TER 43777 WAT 3524 ATOM 43777 O WAT 3525 13.307 60.846 76.342 1.00 0.00 O ATOM 43778 H1 WAT 3525 12.977 59.972 76.133 1.00 0.00 H ATOM 43779 H2 WAT 3525 12.523 61.357 76.543 1.00 0.00 H TER 43781 WAT 3525 ATOM 43781 O WAT 3526 84.731 69.437 138.907 1.00 0.00 O ATOM 43782 H1 WAT 3526 85.008 69.257 138.008 1.00 0.00 H ATOM 43783 H2 WAT 3526 85.546 69.470 139.407 1.00 0.00 H TER 43785 WAT 3526 ATOM 43785 O WAT 3527 20.530 51.450 105.231 1.00 0.00 O ATOM 43786 H1 WAT 3527 20.070 52.225 105.553 1.00 0.00 H ATOM 43787 H2 WAT 3527 19.973 51.117 104.527 1.00 0.00 H TER 43789 WAT 3527 ATOM 43789 O WAT 3528 84.491 50.172 145.830 1.00 0.00 O ATOM 43790 H1 WAT 3528 85.188 50.752 145.522 1.00 0.00 H ATOM 43791 H2 WAT 3528 84.752 49.935 146.719 1.00 0.00 H TER 43793 WAT 3528 ATOM 43793 O WAT 3529 132.765 104.337 150.046 1.00 0.00 O ATOM 43794 H1 WAT 3529 133.597 104.333 150.519 1.00 0.00 H ATOM 43795 H2 WAT 3529 132.220 103.704 150.515 1.00 0.00 H TER 43797 WAT 3529 ATOM 43797 O WAT 3530 2.791 72.761 152.284 1.00 0.00 O ATOM 43798 H1 WAT 3530 2.443 73.506 152.775 1.00 0.00 H ATOM 43799 H2 WAT 3530 2.067 72.483 151.724 1.00 0.00 H TER 43801 WAT 3530 ATOM 43801 O WAT 3531 62.562 110.101 52.902 1.00 0.00 O ATOM 43802 H1 WAT 3531 62.161 109.275 52.632 1.00 0.00 H ATOM 43803 H2 WAT 3531 61.994 110.776 52.530 1.00 0.00 H TER 43805 WAT 3531 ATOM 43805 O WAT 3532 85.891 3.927 5.035 1.00 0.00 O ATOM 43806 H1 WAT 3532 86.395 3.856 5.846 1.00 0.00 H ATOM 43807 H2 WAT 3532 86.548 4.084 4.357 1.00 0.00 H TER 43809 WAT 3532 ATOM 43809 O WAT 3533 72.218 48.590 78.579 1.00 0.00 O ATOM 43810 H1 WAT 3533 72.802 49.341 78.685 1.00 0.00 H ATOM 43811 H2 WAT 3533 71.597 48.862 77.903 1.00 0.00 H TER 43813 WAT 3533 ATOM 43813 O WAT 3534 108.842 93.625 92.122 1.00 0.00 O ATOM 43814 H1 WAT 3534 108.409 94.258 92.696 1.00 0.00 H ATOM 43815 H2 WAT 3534 108.157 93.346 91.514 1.00 0.00 H TER 43817 WAT 3534 ATOM 43817 O WAT 3535 109.711 36.030 148.977 1.00 0.00 O ATOM 43818 H1 WAT 3535 109.882 35.548 148.167 1.00 0.00 H ATOM 43819 H2 WAT 3535 109.643 36.944 148.702 1.00 0.00 H TER 43821 WAT 3535 ATOM 43821 O WAT 3536 61.758 79.942 12.671 1.00 0.00 O ATOM 43822 H1 WAT 3536 61.113 79.388 12.232 1.00 0.00 H ATOM 43823 H2 WAT 3536 62.592 79.705 12.264 1.00 0.00 H TER 43825 WAT 3536 ATOM 43825 O WAT 3537 46.740 75.100 150.782 1.00 0.00 O ATOM 43826 H1 WAT 3537 47.369 75.424 150.138 1.00 0.00 H ATOM 43827 H2 WAT 3537 45.950 75.618 150.627 1.00 0.00 H TER 43829 WAT 3537 ATOM 43829 O WAT 3538 13.978 135.488 88.127 1.00 0.00 O ATOM 43830 H1 WAT 3538 13.541 134.902 88.744 1.00 0.00 H ATOM 43831 H2 WAT 3538 14.055 134.975 87.323 1.00 0.00 H TER 43833 WAT 3538 ATOM 43833 O WAT 3539 30.492 92.510 157.737 1.00 0.00 O ATOM 43834 H1 WAT 3539 30.879 93.385 157.696 1.00 0.00 H ATOM 43835 H2 WAT 3539 30.080 92.472 158.601 1.00 0.00 H TER 43837 WAT 3539 ATOM 43837 O WAT 3540 1.701 111.407 132.889 1.00 0.00 O ATOM 43838 H1 WAT 3540 2.113 110.576 132.652 1.00 0.00 H ATOM 43839 H2 WAT 3540 0.767 111.204 132.944 1.00 0.00 H TER 43841 WAT 3540 ATOM 43841 O WAT 3541 30.031 105.242 93.048 1.00 0.00 O ATOM 43842 H1 WAT 3541 30.771 105.848 93.084 1.00 0.00 H ATOM 43843 H2 WAT 3541 30.348 104.509 92.519 1.00 0.00 H TER 43845 WAT 3541 ATOM 43845 O WAT 3542 81.725 10.202 16.610 1.00 0.00 O ATOM 43846 H1 WAT 3542 81.852 9.254 16.560 1.00 0.00 H ATOM 43847 H2 WAT 3542 81.219 10.333 17.412 1.00 0.00 H TER 43849 WAT 3542 ATOM 43849 O WAT 3543 49.562 130.949 7.997 1.00 0.00 O ATOM 43850 H1 WAT 3543 49.205 131.820 8.173 1.00 0.00 H ATOM 43851 H2 WAT 3543 50.078 130.740 8.776 1.00 0.00 H TER 43853 WAT 3543 ATOM 43853 O WAT 3544 5.087 135.038 157.242 1.00 0.00 O ATOM 43854 H1 WAT 3544 4.510 134.358 156.893 1.00 0.00 H ATOM 43855 H2 WAT 3544 5.111 134.872 158.184 1.00 0.00 H TER 43857 WAT 3544 ATOM 43857 O WAT 3545 58.540 137.812 92.777 1.00 0.00 O ATOM 43858 H1 WAT 3545 58.252 138.489 92.165 1.00 0.00 H ATOM 43859 H2 WAT 3545 57.801 137.701 93.376 1.00 0.00 H TER 43861 WAT 3545 ATOM 43861 O WAT 3546 36.190 62.127 1.246 1.00 0.00 O ATOM 43862 H1 WAT 3546 35.764 61.724 0.490 1.00 0.00 H ATOM 43863 H2 WAT 3546 37.056 62.380 0.925 1.00 0.00 H TER 43865 WAT 3546 ATOM 43865 O WAT 3547 80.296 71.915 114.701 1.00 0.00 O ATOM 43866 H1 WAT 3547 79.532 72.433 114.447 1.00 0.00 H ATOM 43867 H2 WAT 3547 80.023 71.459 115.497 1.00 0.00 H TER 43869 WAT 3547 ATOM 43869 O WAT 3548 57.385 91.036 133.858 1.00 0.00 O ATOM 43870 H1 WAT 3548 56.917 91.736 134.314 1.00 0.00 H ATOM 43871 H2 WAT 3548 56.709 90.591 133.345 1.00 0.00 H TER 43873 WAT 3548 ATOM 43873 O WAT 3549 120.250 118.145 100.589 1.00 0.00 O ATOM 43874 H1 WAT 3549 120.968 117.512 100.615 1.00 0.00 H ATOM 43875 H2 WAT 3549 119.457 117.608 100.585 1.00 0.00 H TER 43877 WAT 3549 ATOM 43877 O WAT 3550 5.648 129.114 135.811 1.00 0.00 O ATOM 43878 H1 WAT 3550 5.587 128.321 136.344 1.00 0.00 H ATOM 43879 H2 WAT 3550 5.600 129.831 136.442 1.00 0.00 H TER 43881 WAT 3550 ATOM 43881 O WAT 3551 131.323 17.190 131.626 1.00 0.00 O ATOM 43882 H1 WAT 3551 130.593 16.578 131.532 1.00 0.00 H ATOM 43883 H2 WAT 3551 131.451 17.268 132.571 1.00 0.00 H TER 43885 WAT 3551 ATOM 43885 O WAT 3552 137.250 50.005 114.940 1.00 0.00 O ATOM 43886 H1 WAT 3552 138.087 49.770 114.540 1.00 0.00 H ATOM 43887 H2 WAT 3552 136.941 50.752 114.426 1.00 0.00 H TER 43889 WAT 3552 ATOM 43889 O WAT 3553 53.250 41.143 124.005 1.00 0.00 O ATOM 43890 H1 WAT 3553 52.620 40.650 123.478 1.00 0.00 H ATOM 43891 H2 WAT 3553 53.828 40.476 124.374 1.00 0.00 H TER 43893 WAT 3553 ATOM 43893 O WAT 3554 105.040 42.794 110.889 1.00 0.00 O ATOM 43894 H1 WAT 3554 104.108 42.577 110.861 1.00 0.00 H ATOM 43895 H2 WAT 3554 105.131 43.366 111.651 1.00 0.00 H TER 43897 WAT 3554 ATOM 43897 O WAT 3555 39.831 127.081 3.122 1.00 0.00 O ATOM 43898 H1 WAT 3555 40.509 127.469 2.569 1.00 0.00 H ATOM 43899 H2 WAT 3555 39.026 127.532 2.867 1.00 0.00 H TER 43901 WAT 3555 ATOM 43901 O WAT 3556 83.725 67.740 92.027 1.00 0.00 O ATOM 43902 H1 WAT 3556 84.525 67.746 92.552 1.00 0.00 H ATOM 43903 H2 WAT 3556 83.754 68.560 91.535 1.00 0.00 H TER 43905 WAT 3556 ATOM 43905 O WAT 3557 91.634 9.767 141.404 1.00 0.00 O ATOM 43906 H1 WAT 3557 92.249 10.389 141.015 1.00 0.00 H ATOM 43907 H2 WAT 3557 92.086 9.435 142.179 1.00 0.00 H TER 43909 WAT 3557 ATOM 43909 O WAT 3558 33.999 61.289 95.154 1.00 0.00 O ATOM 43910 H1 WAT 3558 33.950 61.607 96.056 1.00 0.00 H ATOM 43911 H2 WAT 3558 34.870 61.550 94.856 1.00 0.00 H TER 43913 WAT 3558 ATOM 43913 O WAT 3559 61.666 38.617 57.724 1.00 0.00 O ATOM 43914 H1 WAT 3559 60.901 38.437 58.270 1.00 0.00 H ATOM 43915 H2 WAT 3559 62.222 37.845 57.828 1.00 0.00 H TER 43917 WAT 3559 ATOM 43917 O WAT 3560 79.153 18.181 62.609 1.00 0.00 O ATOM 43918 H1 WAT 3560 78.834 17.393 63.049 1.00 0.00 H ATOM 43919 H2 WAT 3560 80.055 17.970 62.367 1.00 0.00 H TER 43921 WAT 3560 ATOM 43921 O WAT 3561 19.859 31.203 124.169 1.00 0.00 O ATOM 43922 H1 WAT 3561 19.119 31.772 124.382 1.00 0.00 H ATOM 43923 H2 WAT 3561 20.478 31.336 124.886 1.00 0.00 H TER 43925 WAT 3561 ATOM 43925 O WAT 3562 82.150 137.911 132.318 1.00 0.00 O ATOM 43926 H1 WAT 3562 81.684 137.916 133.154 1.00 0.00 H ATOM 43927 H2 WAT 3562 82.632 138.737 132.308 1.00 0.00 H TER 43929 WAT 3562 ATOM 43929 O WAT 3563 91.554 54.996 82.458 1.00 0.00 O ATOM 43930 H1 WAT 3563 91.434 54.289 81.824 1.00 0.00 H ATOM 43931 H2 WAT 3563 92.503 55.096 82.528 1.00 0.00 H TER 43933 WAT 3563 ATOM 43933 O WAT 3564 50.829 43.753 106.797 1.00 0.00 O ATOM 43934 H1 WAT 3564 51.209 43.834 105.922 1.00 0.00 H ATOM 43935 H2 WAT 3564 49.969 43.360 106.650 1.00 0.00 H TER 43937 WAT 3564 ATOM 43937 O WAT 3565 43.054 32.154 135.749 1.00 0.00 O ATOM 43938 H1 WAT 3565 43.346 31.243 135.708 1.00 0.00 H ATOM 43939 H2 WAT 3565 42.944 32.411 134.833 1.00 0.00 H TER 43941 WAT 3565 ATOM 43941 O WAT 3566 119.935 58.282 119.007 1.00 0.00 O ATOM 43942 H1 WAT 3566 119.838 57.337 119.131 1.00 0.00 H ATOM 43943 H2 WAT 3566 119.326 58.493 118.299 1.00 0.00 H TER 43945 WAT 3566 ATOM 43945 O WAT 3567 109.261 86.914 80.253 1.00 0.00 O ATOM 43946 H1 WAT 3567 110.152 86.842 79.909 1.00 0.00 H ATOM 43947 H2 WAT 3567 109.028 86.020 80.502 1.00 0.00 H TER 43949 WAT 3567 ATOM 43949 O WAT 3568 5.919 17.281 22.369 1.00 0.00 O ATOM 43950 H1 WAT 3568 5.959 18.221 22.191 1.00 0.00 H ATOM 43951 H2 WAT 3568 6.832 16.993 22.343 1.00 0.00 H TER 43953 WAT 3568 ATOM 43953 O WAT 3569 37.588 101.069 150.230 1.00 0.00 O ATOM 43954 H1 WAT 3569 36.742 100.658 150.409 1.00 0.00 H ATOM 43955 H2 WAT 3569 38.200 100.623 150.815 1.00 0.00 H TER 43957 WAT 3569 ATOM 43957 O WAT 3570 32.726 134.564 79.311 1.00 0.00 O ATOM 43958 H1 WAT 3570 32.433 133.930 79.966 1.00 0.00 H ATOM 43959 H2 WAT 3570 33.405 135.071 79.755 1.00 0.00 H TER 43961 WAT 3570 ATOM 43961 O WAT 3571 56.364 71.535 113.017 1.00 0.00 O ATOM 43962 H1 WAT 3571 56.836 70.984 113.641 1.00 0.00 H ATOM 43963 H2 WAT 3571 55.736 72.020 113.553 1.00 0.00 H TER 43965 WAT 3571 ATOM 43965 O WAT 3572 128.194 85.811 142.970 1.00 0.00 O ATOM 43966 H1 WAT 3572 127.925 84.971 142.599 1.00 0.00 H ATOM 43967 H2 WAT 3572 128.409 85.613 143.881 1.00 0.00 H TER 43969 WAT 3572 ATOM 43969 O WAT 3573 0.513 30.315 119.933 1.00 0.00 O ATOM 43970 H1 WAT 3573 -0.171 30.594 119.325 1.00 0.00 H ATOM 43971 H2 WAT 3573 0.614 29.378 119.767 1.00 0.00 H TER 43973 WAT 3573 ATOM 43973 O WAT 3574 36.071 106.023 122.705 1.00 0.00 O ATOM 43974 H1 WAT 3574 36.115 106.347 123.605 1.00 0.00 H ATOM 43975 H2 WAT 3574 36.979 105.823 122.478 1.00 0.00 H TER 43977 WAT 3574 ATOM 43977 O WAT 3575 32.691 16.887 10.274 1.00 0.00 O ATOM 43978 H1 WAT 3575 33.576 16.592 10.061 1.00 0.00 H ATOM 43979 H2 WAT 3575 32.117 16.297 9.784 1.00 0.00 H TER 43981 WAT 3575 ATOM 43981 O WAT 3576 109.497 35.963 0.200 1.00 0.00 O ATOM 43982 H1 WAT 3576 109.299 35.035 0.330 1.00 0.00 H ATOM 43983 H2 WAT 3576 108.733 36.422 0.550 1.00 0.00 H TER 43985 WAT 3576 ATOM 43985 O WAT 3577 90.640 20.031 122.598 1.00 0.00 O ATOM 43986 H1 WAT 3577 90.226 19.272 123.008 1.00 0.00 H ATOM 43987 H2 WAT 3577 91.477 19.700 122.272 1.00 0.00 H TER 43989 WAT 3577 ATOM 43989 O WAT 3578 28.602 141.421 116.383 1.00 0.00 O ATOM 43990 H1 WAT 3578 28.893 142.244 115.990 1.00 0.00 H ATOM 43991 H2 WAT 3578 27.738 141.620 116.743 1.00 0.00 H TER 43993 WAT 3578 ATOM 43993 O WAT 3579 25.615 129.476 69.986 1.00 0.00 O ATOM 43994 H1 WAT 3579 25.539 128.529 69.870 1.00 0.00 H ATOM 43995 H2 WAT 3579 25.866 129.586 70.904 1.00 0.00 H TER 43997 WAT 3579 ATOM 43997 O WAT 3580 87.175 131.106 144.561 1.00 0.00 O ATOM 43998 H1 WAT 3580 86.327 131.502 144.758 1.00 0.00 H ATOM 43999 H2 WAT 3580 87.316 130.477 145.269 1.00 0.00 H TER 44001 WAT 3580 ATOM 44001 O WAT 3581 36.629 87.654 97.095 1.00 0.00 O ATOM 44002 H1 WAT 3581 37.239 86.931 96.949 1.00 0.00 H ATOM 44003 H2 WAT 3581 37.044 88.407 96.676 1.00 0.00 H TER 44005 WAT 3581 ATOM 44005 O WAT 3582 16.404 126.054 0.483 1.00 0.00 O ATOM 44006 H1 WAT 3582 16.621 125.145 0.690 1.00 0.00 H ATOM 44007 H2 WAT 3582 17.085 126.568 0.917 1.00 0.00 H TER 44009 WAT 3582 ATOM 44009 O WAT 3583 70.104 116.427 154.437 1.00 0.00 O ATOM 44010 H1 WAT 3583 70.457 117.311 154.535 1.00 0.00 H ATOM 44011 H2 WAT 3583 69.900 116.352 153.505 1.00 0.00 H TER 44013 WAT 3583 ATOM 44013 O WAT 3584 122.603 57.645 117.439 1.00 0.00 O ATOM 44014 H1 WAT 3584 122.200 58.509 117.349 1.00 0.00 H ATOM 44015 H2 WAT 3584 123.373 57.680 116.871 1.00 0.00 H TER 44017 WAT 3584 ATOM 44017 O WAT 3585 40.101 56.304 19.267 1.00 0.00 O ATOM 44018 H1 WAT 3585 39.798 55.434 19.523 1.00 0.00 H ATOM 44019 H2 WAT 3585 40.000 56.323 18.315 1.00 0.00 H TER 44021 WAT 3585 ATOM 44021 O WAT 3586 80.955 45.194 68.914 1.00 0.00 O ATOM 44022 H1 WAT 3586 81.769 44.890 68.513 1.00 0.00 H ATOM 44023 H2 WAT 3586 80.436 44.398 69.034 1.00 0.00 H TER 44025 WAT 3586 ATOM 44025 O WAT 3587 78.697 94.344 76.027 1.00 0.00 O ATOM 44026 H1 WAT 3587 79.367 94.332 76.711 1.00 0.00 H ATOM 44027 H2 WAT 3587 77.973 94.840 76.409 1.00 0.00 H TER 44029 WAT 3587 ATOM 44029 O WAT 3588 122.945 129.890 131.566 1.00 0.00 O ATOM 44030 H1 WAT 3588 123.483 130.641 131.815 1.00 0.00 H ATOM 44031 H2 WAT 3588 122.970 129.313 132.330 1.00 0.00 H TER 44033 WAT 3588 ATOM 44033 O WAT 3589 85.161 144.900 113.453 1.00 0.00 O ATOM 44034 H1 WAT 3589 84.659 144.331 114.037 1.00 0.00 H ATOM 44035 H2 WAT 3589 86.002 144.455 113.350 1.00 0.00 H TER 44037 WAT 3589 ATOM 44037 O WAT 3590 49.693 11.564 112.339 1.00 0.00 O ATOM 44038 H1 WAT 3590 50.435 12.049 111.978 1.00 0.00 H ATOM 44039 H2 WAT 3590 49.040 11.567 111.639 1.00 0.00 H TER 44041 WAT 3590 ATOM 44041 O WAT 3591 25.510 63.173 99.608 1.00 0.00 O ATOM 44042 H1 WAT 3591 25.891 63.796 98.988 1.00 0.00 H ATOM 44043 H2 WAT 3591 24.886 62.668 99.087 1.00 0.00 H TER 44045 WAT 3591 ATOM 44045 O WAT 3592 11.422 105.062 108.945 1.00 0.00 O ATOM 44046 H1 WAT 3592 11.029 105.913 108.751 1.00 0.00 H ATOM 44047 H2 WAT 3592 10.717 104.559 109.352 1.00 0.00 H TER 44049 WAT 3592 ATOM 44049 O WAT 3593 83.892 63.069 139.349 1.00 0.00 O ATOM 44050 H1 WAT 3593 83.740 62.516 138.583 1.00 0.00 H ATOM 44051 H2 WAT 3593 84.715 63.519 139.160 1.00 0.00 H TER 44053 WAT 3593 ATOM 44053 O WAT 3594 116.088 111.503 156.645 1.00 0.00 O ATOM 44054 H1 WAT 3594 116.891 111.909 156.320 1.00 0.00 H ATOM 44055 H2 WAT 3594 115.934 111.922 157.492 1.00 0.00 H TER 44057 WAT 3594 ATOM 44057 O WAT 3595 26.956 16.083 94.893 1.00 0.00 O ATOM 44058 H1 WAT 3595 27.865 16.264 94.656 1.00 0.00 H ATOM 44059 H2 WAT 3595 26.744 15.273 94.429 1.00 0.00 H TER 44061 WAT 3595 ATOM 44061 O WAT 3596 86.483 126.354 141.663 1.00 0.00 O ATOM 44062 H1 WAT 3596 86.483 125.842 142.472 1.00 0.00 H ATOM 44063 H2 WAT 3596 85.633 126.794 141.659 1.00 0.00 H TER 44065 WAT 3596 ATOM 44065 O WAT 3597 75.242 63.513 4.532 1.00 0.00 O ATOM 44066 H1 WAT 3597 75.767 63.241 3.780 1.00 0.00 H ATOM 44067 H2 WAT 3597 74.807 64.315 4.243 1.00 0.00 H TER 44069 WAT 3597 ATOM 44069 O WAT 3598 4.627 4.726 67.879 1.00 0.00 O ATOM 44070 H1 WAT 3598 5.404 5.101 67.466 1.00 0.00 H ATOM 44071 H2 WAT 3598 4.718 4.946 68.806 1.00 0.00 H TER 44073 WAT 3598 ATOM 44073 O WAT 3599 23.097 81.139 92.281 1.00 0.00 O ATOM 44074 H1 WAT 3599 23.806 81.782 92.283 1.00 0.00 H ATOM 44075 H2 WAT 3599 22.688 81.236 91.421 1.00 0.00 H TER 44077 WAT 3599 ATOM 44077 O WAT 3600 121.265 27.386 63.656 1.00 0.00 O ATOM 44078 H1 WAT 3600 121.887 28.101 63.789 1.00 0.00 H ATOM 44079 H2 WAT 3600 121.359 26.839 64.435 1.00 0.00 H TER 44081 WAT 3600 ATOM 44081 O WAT 3601 119.795 14.036 124.016 1.00 0.00 O ATOM 44082 H1 WAT 3601 119.441 14.917 123.893 1.00 0.00 H ATOM 44083 H2 WAT 3601 119.508 13.553 123.241 1.00 0.00 H TER 44085 WAT 3601 ATOM 44085 O WAT 3602 51.096 9.845 10.964 1.00 0.00 O ATOM 44086 H1 WAT 3602 51.128 10.638 10.430 1.00 0.00 H ATOM 44087 H2 WAT 3602 50.815 9.159 10.358 1.00 0.00 H TER 44089 WAT 3602 ATOM 44089 O WAT 3603 75.511 38.772 24.723 1.00 0.00 O ATOM 44090 H1 WAT 3603 75.636 38.319 23.889 1.00 0.00 H ATOM 44091 H2 WAT 3603 76.335 39.238 24.868 1.00 0.00 H TER 44093 WAT 3603 ATOM 44093 O WAT 3604 133.173 46.316 119.510 1.00 0.00 O ATOM 44094 H1 WAT 3604 132.763 46.873 120.172 1.00 0.00 H ATOM 44095 H2 WAT 3604 132.862 45.434 119.713 1.00 0.00 H TER 44097 WAT 3604 ATOM 44097 O WAT 3605 58.942 89.328 94.420 1.00 0.00 O ATOM 44098 H1 WAT 3605 58.480 88.531 94.680 1.00 0.00 H ATOM 44099 H2 WAT 3605 58.564 90.014 94.971 1.00 0.00 H TER 44101 WAT 3605 ATOM 44101 O WAT 3606 136.407 40.094 152.690 1.00 0.00 O ATOM 44102 H1 WAT 3606 136.866 39.416 153.186 1.00 0.00 H ATOM 44103 H2 WAT 3606 135.740 40.422 153.293 1.00 0.00 H TER 44105 WAT 3606 ATOM 44105 O WAT 3607 69.650 2.854 1.909 1.00 0.00 O ATOM 44106 H1 WAT 3607 70.552 2.667 1.649 1.00 0.00 H ATOM 44107 H2 WAT 3607 69.258 3.263 1.137 1.00 0.00 H TER 44109 WAT 3607 ATOM 44109 O WAT 3608 97.282 9.129 146.052 1.00 0.00 O ATOM 44110 H1 WAT 3608 96.996 9.263 146.956 1.00 0.00 H ATOM 44111 H2 WAT 3608 97.724 8.280 146.064 1.00 0.00 H TER 44113 WAT 3608 ATOM 44113 O WAT 3609 71.087 55.221 21.350 1.00 0.00 O ATOM 44114 H1 WAT 3609 70.710 56.099 21.299 1.00 0.00 H ATOM 44115 H2 WAT 3609 71.915 55.342 21.815 1.00 0.00 H TER 44117 WAT 3609 ATOM 44117 O WAT 3610 18.126 115.076 75.219 1.00 0.00 O ATOM 44118 H1 WAT 3610 17.578 114.919 74.450 1.00 0.00 H ATOM 44119 H2 WAT 3610 17.677 115.774 75.695 1.00 0.00 H TER 44121 WAT 3610 ATOM 44121 O WAT 3611 40.782 113.945 114.512 1.00 0.00 O ATOM 44122 H1 WAT 3611 41.511 114.376 114.065 1.00 0.00 H ATOM 44123 H2 WAT 3611 40.024 114.499 114.323 1.00 0.00 H TER 44125 WAT 3611 ATOM 44125 O WAT 3612 49.923 145.428 77.952 1.00 0.00 O ATOM 44126 H1 WAT 3612 49.022 145.324 77.647 1.00 0.00 H ATOM 44127 H2 WAT 3612 49.902 145.138 78.864 1.00 0.00 H TER 44129 WAT 3612 ATOM 44129 O WAT 3613 37.744 39.069 76.233 1.00 0.00 O ATOM 44130 H1 WAT 3613 37.627 39.014 77.181 1.00 0.00 H ATOM 44131 H2 WAT 3613 37.445 38.221 75.905 1.00 0.00 H TER 44133 WAT 3613 ATOM 44133 O WAT 3614 105.465 63.114 143.489 1.00 0.00 O ATOM 44134 H1 WAT 3614 104.748 63.743 143.566 1.00 0.00 H ATOM 44135 H2 WAT 3614 105.068 62.271 143.709 1.00 0.00 H TER 44137 WAT 3614 ATOM 44137 O WAT 3615 52.626 101.964 107.255 1.00 0.00 O ATOM 44138 H1 WAT 3615 53.354 101.864 106.642 1.00 0.00 H ATOM 44139 H2 WAT 3615 52.145 102.727 106.933 1.00 0.00 H TER 44141 WAT 3615 ATOM 44141 O WAT 3616 9.426 2.844 85.375 1.00 0.00 O ATOM 44142 H1 WAT 3616 9.217 3.572 85.960 1.00 0.00 H ATOM 44143 H2 WAT 3616 9.002 2.085 85.777 1.00 0.00 H TER 44145 WAT 3616 ATOM 44145 O WAT 3617 140.015 73.119 1.447 1.00 0.00 O ATOM 44146 H1 WAT 3617 139.173 73.569 1.513 1.00 0.00 H ATOM 44147 H2 WAT 3617 140.174 72.777 2.327 1.00 0.00 H TER 44149 WAT 3617 ATOM 44149 O WAT 3618 105.651 75.691 74.069 1.00 0.00 O ATOM 44150 H1 WAT 3618 105.243 76.159 74.797 1.00 0.00 H ATOM 44151 H2 WAT 3618 106.547 75.527 74.363 1.00 0.00 H TER 44153 WAT 3618 ATOM 44153 O WAT 3619 6.279 73.401 85.213 1.00 0.00 O ATOM 44154 H1 WAT 3619 6.596 72.755 84.582 1.00 0.00 H ATOM 44155 H2 WAT 3619 6.230 74.218 84.716 1.00 0.00 H TER 44157 WAT 3619 ATOM 44157 O WAT 3620 137.058 98.527 13.718 1.00 0.00 O ATOM 44158 H1 WAT 3620 137.981 98.678 13.515 1.00 0.00 H ATOM 44159 H2 WAT 3620 136.803 97.801 13.148 1.00 0.00 H TER 44161 WAT 3620 ATOM 44161 O WAT 3621 119.415 88.855 99.533 1.00 0.00 O ATOM 44162 H1 WAT 3621 120.181 88.566 99.038 1.00 0.00 H ATOM 44163 H2 WAT 3621 118.728 88.956 98.874 1.00 0.00 H TER 44165 WAT 3621 ATOM 44165 O WAT 3622 121.138 106.966 127.528 1.00 0.00 O ATOM 44166 H1 WAT 3622 120.183 107.018 127.506 1.00 0.00 H ATOM 44167 H2 WAT 3622 121.335 106.065 127.272 1.00 0.00 H TER 44169 WAT 3622 ATOM 44169 O WAT 3623 16.287 38.535 64.897 1.00 0.00 O ATOM 44170 H1 WAT 3623 16.840 38.190 64.196 1.00 0.00 H ATOM 44171 H2 WAT 3623 15.477 38.028 64.835 1.00 0.00 H TER 44173 WAT 3623 ATOM 44173 O WAT 3624 127.423 99.643 12.778 1.00 0.00 O ATOM 44174 H1 WAT 3624 127.469 98.835 12.267 1.00 0.00 H ATOM 44175 H2 WAT 3624 127.349 99.349 13.686 1.00 0.00 H TER 44177 WAT 3624 ATOM 44177 O WAT 3625 139.678 114.831 19.284 1.00 0.00 O ATOM 44178 H1 WAT 3625 140.414 114.342 18.917 1.00 0.00 H ATOM 44179 H2 WAT 3625 140.000 115.153 20.125 1.00 0.00 H TER 44181 WAT 3625 ATOM 44181 O WAT 3626 95.947 44.976 137.541 1.00 0.00 O ATOM 44182 H1 WAT 3626 95.321 44.948 136.817 1.00 0.00 H ATOM 44183 H2 WAT 3626 95.673 45.729 138.065 1.00 0.00 H TER 44185 WAT 3626 ATOM 44185 O WAT 3627 135.654 84.970 107.445 1.00 0.00 O ATOM 44186 H1 WAT 3627 135.979 85.042 108.342 1.00 0.00 H ATOM 44187 H2 WAT 3627 136.075 85.693 106.979 1.00 0.00 H TER 44189 WAT 3627 ATOM 44189 O WAT 3628 33.186 53.682 127.618 1.00 0.00 O ATOM 44190 H1 WAT 3628 33.441 54.487 128.069 1.00 0.00 H ATOM 44191 H2 WAT 3628 32.497 53.308 128.168 1.00 0.00 H TER 44193 WAT 3628 ATOM 44193 O WAT 3629 71.407 17.360 2.957 1.00 0.00 O ATOM 44194 H1 WAT 3629 70.498 17.602 3.135 1.00 0.00 H ATOM 44195 H2 WAT 3629 71.399 17.050 2.051 1.00 0.00 H TER 44197 WAT 3629 ATOM 44197 O WAT 3630 43.905 62.814 59.473 1.00 0.00 O ATOM 44198 H1 WAT 3630 44.477 63.573 59.583 1.00 0.00 H ATOM 44199 H2 WAT 3630 43.021 63.160 59.601 1.00 0.00 H TER 44201 WAT 3630 ATOM 44201 O WAT 3631 49.891 9.709 23.327 1.00 0.00 O ATOM 44202 H1 WAT 3631 50.799 9.978 23.186 1.00 0.00 H ATOM 44203 H2 WAT 3631 49.934 9.097 24.061 1.00 0.00 H TER 44205 WAT 3631 ATOM 44205 O WAT 3632 20.640 27.469 84.458 1.00 0.00 O ATOM 44206 H1 WAT 3632 20.579 28.197 85.076 1.00 0.00 H ATOM 44207 H2 WAT 3632 21.321 27.735 83.840 1.00 0.00 H TER 44209 WAT 3632 ATOM 44209 O WAT 3633 126.382 16.932 136.405 1.00 0.00 O ATOM 44210 H1 WAT 3633 125.729 16.370 135.988 1.00 0.00 H ATOM 44211 H2 WAT 3633 126.402 16.640 137.317 1.00 0.00 H TER 44213 WAT 3633 ATOM 44213 O WAT 3634 45.866 53.074 19.189 1.00 0.00 O ATOM 44214 H1 WAT 3634 45.985 54.008 19.360 1.00 0.00 H ATOM 44215 H2 WAT 3634 46.736 52.696 19.315 1.00 0.00 H TER 44217 WAT 3634 ATOM 44217 O WAT 3635 14.852 118.896 137.008 1.00 0.00 O ATOM 44218 H1 WAT 3635 13.957 118.713 137.293 1.00 0.00 H ATOM 44219 H2 WAT 3635 14.763 119.622 136.390 1.00 0.00 H TER 44221 WAT 3635 ATOM 44221 O WAT 3636 101.844 96.947 90.507 1.00 0.00 O ATOM 44222 H1 WAT 3636 101.924 96.733 89.577 1.00 0.00 H ATOM 44223 H2 WAT 3636 102.688 97.333 90.737 1.00 0.00 H TER 44225 WAT 3636 ATOM 44225 O WAT 3637 9.161 21.097 109.943 1.00 0.00 O ATOM 44226 H1 WAT 3637 9.020 20.415 110.600 1.00 0.00 H ATOM 44227 H2 WAT 3637 9.757 20.698 109.308 1.00 0.00 H TER 44229 WAT 3637 ATOM 44229 O WAT 3638 45.527 127.311 10.978 1.00 0.00 O ATOM 44230 H1 WAT 3638 45.707 127.877 10.226 1.00 0.00 H ATOM 44231 H2 WAT 3638 46.370 127.232 11.424 1.00 0.00 H TER 44233 WAT 3638 ATOM 44233 O WAT 3639 118.892 62.166 140.282 1.00 0.00 O ATOM 44234 H1 WAT 3639 119.036 62.815 139.593 1.00 0.00 H ATOM 44235 H2 WAT 3639 118.408 61.462 139.849 1.00 0.00 H TER 44237 WAT 3639 ATOM 44237 O WAT 3640 18.809 34.134 20.489 1.00 0.00 O ATOM 44238 H1 WAT 3640 19.246 34.980 20.390 1.00 0.00 H ATOM 44239 H2 WAT 3640 19.090 33.819 21.348 1.00 0.00 H TER 44241 WAT 3640 ATOM 44241 O WAT 3641 133.591 18.724 130.265 1.00 0.00 O ATOM 44242 H1 WAT 3641 132.715 18.540 130.602 1.00 0.00 H ATOM 44243 H2 WAT 3641 133.638 18.239 129.441 1.00 0.00 H TER 44245 WAT 3641 ATOM 44245 O WAT 3642 91.041 78.449 141.092 1.00 0.00 O ATOM 44246 H1 WAT 3642 91.502 77.959 140.411 1.00 0.00 H ATOM 44247 H2 WAT 3642 91.151 79.366 140.842 1.00 0.00 H TER 44249 WAT 3642 ATOM 44249 O WAT 3643 89.469 94.502 123.245 1.00 0.00 O ATOM 44250 H1 WAT 3643 90.060 94.969 123.836 1.00 0.00 H ATOM 44251 H2 WAT 3643 89.414 93.619 123.611 1.00 0.00 H TER 44253 WAT 3643 ATOM 44253 O WAT 3644 135.311 126.035 151.780 1.00 0.00 O ATOM 44254 H1 WAT 3644 135.446 126.101 150.834 1.00 0.00 H ATOM 44255 H2 WAT 3644 134.671 126.718 151.979 1.00 0.00 H TER 44257 WAT 3644 ATOM 44257 O WAT 3645 111.124 20.219 15.157 1.00 0.00 O ATOM 44258 H1 WAT 3645 111.024 20.026 16.089 1.00 0.00 H ATOM 44259 H2 WAT 3645 110.466 19.672 14.727 1.00 0.00 H TER 44261 WAT 3645 ATOM 44261 O WAT 3646 96.615 10.978 114.854 1.00 0.00 O ATOM 44262 H1 WAT 3646 96.135 11.742 114.533 1.00 0.00 H ATOM 44263 H2 WAT 3646 96.695 11.124 115.797 1.00 0.00 H TER 44265 WAT 3646 ATOM 44265 O WAT 3647 8.804 39.531 118.362 1.00 0.00 O ATOM 44266 H1 WAT 3647 8.516 38.618 118.357 1.00 0.00 H ATOM 44267 H2 WAT 3647 8.138 39.991 118.872 1.00 0.00 H TER 44269 WAT 3647 ATOM 44269 O WAT 3648 57.116 97.397 21.198 1.00 0.00 O ATOM 44270 H1 WAT 3648 56.860 96.902 20.420 1.00 0.00 H ATOM 44271 H2 WAT 3648 57.350 98.263 20.864 1.00 0.00 H TER 44273 WAT 3648 ATOM 44273 O WAT 3649 97.126 117.258 127.746 1.00 0.00 O ATOM 44274 H1 WAT 3649 96.284 117.235 128.201 1.00 0.00 H ATOM 44275 H2 WAT 3649 97.576 118.018 128.113 1.00 0.00 H TER 44277 WAT 3649 ATOM 44277 O WAT 3650 13.205 135.507 99.945 1.00 0.00 O ATOM 44278 H1 WAT 3650 13.499 134.702 100.372 1.00 0.00 H ATOM 44279 H2 WAT 3650 13.249 135.311 99.009 1.00 0.00 H TER 44281 WAT 3650 ATOM 44281 O WAT 3651 38.367 132.330 122.109 1.00 0.00 O ATOM 44282 H1 WAT 3651 38.093 131.811 122.865 1.00 0.00 H ATOM 44283 H2 WAT 3651 39.073 132.883 122.441 1.00 0.00 H TER 44285 WAT 3651 ATOM 44285 O WAT 3652 57.829 54.990 125.634 1.00 0.00 O ATOM 44286 H1 WAT 3652 58.412 54.612 124.975 1.00 0.00 H ATOM 44287 H2 WAT 3652 58.196 54.704 126.470 1.00 0.00 H TER 44289 WAT 3652 ATOM 44289 O WAT 3653 48.403 112.638 111.228 1.00 0.00 O ATOM 44290 H1 WAT 3653 49.291 112.618 111.586 1.00 0.00 H ATOM 44291 H2 WAT 3653 48.400 113.392 110.638 1.00 0.00 H TER 44293 WAT 3653 ATOM 44293 O WAT 3654 59.979 24.500 76.524 1.00 0.00 O ATOM 44294 H1 WAT 3654 59.162 24.113 76.210 1.00 0.00 H ATOM 44295 H2 WAT 3654 59.892 25.434 76.330 1.00 0.00 H TER 44297 WAT 3654 ATOM 44297 O WAT 3655 133.650 137.974 103.034 1.00 0.00 O ATOM 44298 H1 WAT 3655 133.534 137.276 102.390 1.00 0.00 H ATOM 44299 H2 WAT 3655 134.512 138.342 102.836 1.00 0.00 H TER 44301 WAT 3655 ATOM 44301 O WAT 3656 36.549 62.480 94.193 1.00 0.00 O ATOM 44302 H1 WAT 3656 37.124 61.812 94.568 1.00 0.00 H ATOM 44303 H2 WAT 3656 37.052 63.292 94.258 1.00 0.00 H TER 44305 WAT 3656 ATOM 44305 O WAT 3657 101.799 62.140 141.800 1.00 0.00 O ATOM 44306 H1 WAT 3657 100.963 62.071 142.262 1.00 0.00 H ATOM 44307 H2 WAT 3657 101.567 62.072 140.874 1.00 0.00 H TER 44309 WAT 3657 ATOM 44309 O WAT 3658 120.345 71.154 80.943 1.00 0.00 O ATOM 44310 H1 WAT 3658 119.929 70.664 81.652 1.00 0.00 H ATOM 44311 H2 WAT 3658 121.163 71.475 81.322 1.00 0.00 H TER 44313 WAT 3658 ATOM 44313 O WAT 3659 87.855 134.867 4.413 1.00 0.00 O ATOM 44314 H1 WAT 3659 87.827 134.348 5.217 1.00 0.00 H ATOM 44315 H2 WAT 3659 88.786 134.938 4.205 1.00 0.00 H TER 44317 WAT 3659 ATOM 44317 O WAT 3660 51.344 1.750 54.036 1.00 0.00 O ATOM 44318 H1 WAT 3660 50.717 2.471 54.092 1.00 0.00 H ATOM 44319 H2 WAT 3660 51.651 1.629 54.934 1.00 0.00 H TER 44321 WAT 3660 ATOM 44321 O WAT 3661 1.265 139.096 71.467 1.00 0.00 O ATOM 44322 H1 WAT 3661 0.428 139.208 71.917 1.00 0.00 H ATOM 44323 H2 WAT 3661 1.063 139.248 70.544 1.00 0.00 H TER 44325 WAT 3661 ATOM 44325 O WAT 3662 20.554 116.958 83.423 1.00 0.00 O ATOM 44326 H1 WAT 3662 21.333 117.230 83.907 1.00 0.00 H ATOM 44327 H2 WAT 3662 20.755 117.166 82.510 1.00 0.00 H TER 44329 WAT 3662 ATOM 44329 O WAT 3663 36.145 106.340 9.277 1.00 0.00 O ATOM 44330 H1 WAT 3663 36.014 105.685 9.962 1.00 0.00 H ATOM 44331 H2 WAT 3663 36.485 105.843 8.532 1.00 0.00 H TER 44333 WAT 3663 ATOM 44333 O WAT 3664 113.175 108.274 152.049 1.00 0.00 O ATOM 44334 H1 WAT 3664 112.862 108.715 151.259 1.00 0.00 H ATOM 44335 H2 WAT 3664 112.515 107.604 152.227 1.00 0.00 H TER 44337 WAT 3664 ATOM 44337 O WAT 3665 141.760 52.570 101.665 1.00 0.00 O ATOM 44338 H1 WAT 3665 142.020 53.489 101.731 1.00 0.00 H ATOM 44339 H2 WAT 3665 141.871 52.225 102.551 1.00 0.00 H TER 44341 WAT 3665 ATOM 44341 O WAT 3666 64.293 3.167 77.842 1.00 0.00 O ATOM 44342 H1 WAT 3666 64.354 2.986 76.904 1.00 0.00 H ATOM 44343 H2 WAT 3666 63.954 4.061 77.892 1.00 0.00 H TER 44345 WAT 3666 ATOM 44345 O WAT 3667 133.360 44.538 142.905 1.00 0.00 O ATOM 44346 H1 WAT 3667 134.167 45.005 142.690 1.00 0.00 H ATOM 44347 H2 WAT 3667 132.913 44.431 142.065 1.00 0.00 H TER 44349 WAT 3667 ATOM 44349 O WAT 3668 58.560 100.723 72.789 1.00 0.00 O ATOM 44350 H1 WAT 3668 58.842 101.122 71.966 1.00 0.00 H ATOM 44351 H2 WAT 3668 57.610 100.641 72.703 1.00 0.00 H TER 44353 WAT 3668 ATOM 44353 O WAT 3669 73.334 124.369 148.468 1.00 0.00 O ATOM 44354 H1 WAT 3669 73.482 123.458 148.214 1.00 0.00 H ATOM 44355 H2 WAT 3669 73.998 124.862 147.988 1.00 0.00 H TER 44357 WAT 3669 ATOM 44357 O WAT 3670 107.499 114.169 88.668 1.00 0.00 O ATOM 44358 H1 WAT 3670 107.848 114.569 89.464 1.00 0.00 H ATOM 44359 H2 WAT 3670 107.365 114.904 88.070 1.00 0.00 H TER 44361 WAT 3670 ATOM 44361 O WAT 3671 119.445 66.432 76.337 1.00 0.00 O ATOM 44362 H1 WAT 3671 119.658 65.764 75.685 1.00 0.00 H ATOM 44363 H2 WAT 3671 118.891 65.978 76.972 1.00 0.00 H TER 44365 WAT 3671 ATOM 44365 O WAT 3672 141.327 128.127 18.278 1.00 0.00 O ATOM 44366 H1 WAT 3672 141.672 127.243 18.409 1.00 0.00 H ATOM 44367 H2 WAT 3672 142.055 128.704 18.509 1.00 0.00 H TER 44369 WAT 3672 ATOM 44369 O WAT 3673 71.604 67.286 143.250 1.00 0.00 O ATOM 44370 H1 WAT 3673 72.077 66.631 142.737 1.00 0.00 H ATOM 44371 H2 WAT 3673 70.738 66.904 143.387 1.00 0.00 H TER 44373 WAT 3673 ATOM 44373 O WAT 3674 5.460 100.617 120.852 1.00 0.00 O ATOM 44374 H1 WAT 3674 5.824 100.322 120.018 1.00 0.00 H ATOM 44375 H2 WAT 3674 5.622 99.891 121.454 1.00 0.00 H TER 44377 WAT 3674 ATOM 44377 O WAT 3675 4.784 45.533 106.577 1.00 0.00 O ATOM 44378 H1 WAT 3675 5.325 44.874 107.012 1.00 0.00 H ATOM 44379 H2 WAT 3675 5.004 45.450 105.649 1.00 0.00 H TER 44381 WAT 3675 ATOM 44381 O WAT 3676 110.048 5.514 94.677 1.00 0.00 O ATOM 44382 H1 WAT 3676 110.543 6.253 94.324 1.00 0.00 H ATOM 44383 H2 WAT 3676 110.137 4.828 94.016 1.00 0.00 H TER 44385 WAT 3676 ATOM 44385 O WAT 3677 61.329 74.212 78.346 1.00 0.00 O ATOM 44386 H1 WAT 3677 61.426 74.751 79.131 1.00 0.00 H ATOM 44387 H2 WAT 3677 60.387 74.203 78.176 1.00 0.00 H TER 44389 WAT 3677 ATOM 44389 O WAT 3678 70.029 74.115 21.711 1.00 0.00 O ATOM 44390 H1 WAT 3678 69.853 73.456 22.382 1.00 0.00 H ATOM 44391 H2 WAT 3678 70.954 73.998 21.496 1.00 0.00 H TER 44393 WAT 3678 ATOM 44393 O WAT 3679 100.452 123.085 157.148 1.00 0.00 O ATOM 44394 H1 WAT 3679 99.574 122.722 157.261 1.00 0.00 H ATOM 44395 H2 WAT 3679 100.646 122.959 156.219 1.00 0.00 H TER 44397 WAT 3679 ATOM 44397 O WAT 3680 144.598 125.907 83.735 1.00 0.00 O ATOM 44398 H1 WAT 3680 144.208 125.230 84.289 1.00 0.00 H ATOM 44399 H2 WAT 3680 145.192 126.380 84.318 1.00 0.00 H TER 44401 WAT 3680 ATOM 44401 O WAT 3681 105.949 109.376 136.313 1.00 0.00 O ATOM 44402 H1 WAT 3681 106.485 108.588 136.234 1.00 0.00 H ATOM 44403 H2 WAT 3681 105.101 109.059 136.624 1.00 0.00 H TER 44405 WAT 3681 ATOM 44405 O WAT 3682 8.855 126.966 155.572 1.00 0.00 O ATOM 44406 H1 WAT 3682 7.965 127.256 155.770 1.00 0.00 H ATOM 44407 H2 WAT 3682 9.288 127.746 155.223 1.00 0.00 H TER 44409 WAT 3682 ATOM 44409 O WAT 3683 26.158 53.363 138.092 1.00 0.00 O ATOM 44410 H1 WAT 3683 26.127 54.275 138.380 1.00 0.00 H ATOM 44411 H2 WAT 3683 26.169 53.415 137.136 1.00 0.00 H TER 44413 WAT 3683 ATOM 44413 O WAT 3684 55.592 75.101 62.880 1.00 0.00 O ATOM 44414 H1 WAT 3684 55.637 74.703 63.749 1.00 0.00 H ATOM 44415 H2 WAT 3684 54.723 74.865 62.554 1.00 0.00 H TER 44417 WAT 3684 ATOM 44417 O WAT 3685 96.520 143.364 126.111 1.00 0.00 O ATOM 44418 H1 WAT 3685 95.980 142.719 126.567 1.00 0.00 H ATOM 44419 H2 WAT 3685 96.813 142.914 125.318 1.00 0.00 H TER 44421 WAT 3685 ATOM 44421 O WAT 3686 144.171 35.543 77.831 1.00 0.00 O ATOM 44422 H1 WAT 3686 143.337 35.415 78.284 1.00 0.00 H ATOM 44423 H2 WAT 3686 144.773 34.938 78.264 1.00 0.00 H TER 44425 WAT 3686 ATOM 44425 O WAT 3687 79.827 17.932 119.403 1.00 0.00 O ATOM 44426 H1 WAT 3687 80.165 17.798 120.288 1.00 0.00 H ATOM 44427 H2 WAT 3687 80.388 17.390 118.848 1.00 0.00 H TER 44429 WAT 3687 ATOM 44429 O WAT 3688 32.359 61.985 147.377 1.00 0.00 O ATOM 44430 H1 WAT 3688 32.888 62.734 147.100 1.00 0.00 H ATOM 44431 H2 WAT 3688 32.458 61.348 146.670 1.00 0.00 H TER 44433 WAT 3688 ATOM 44433 O WAT 3689 47.782 129.191 97.275 1.00 0.00 O ATOM 44434 H1 WAT 3689 48.274 129.127 96.457 1.00 0.00 H ATOM 44435 H2 WAT 3689 46.873 129.310 96.999 1.00 0.00 H TER 44437 WAT 3689 ATOM 44437 O WAT 3690 102.877 141.143 130.505 1.00 0.00 O ATOM 44438 H1 WAT 3690 102.984 140.249 130.831 1.00 0.00 H ATOM 44439 H2 WAT 3690 103.550 141.647 130.962 1.00 0.00 H TER 44441 WAT 3690 ATOM 44441 O WAT 3691 132.014 26.587 85.806 1.00 0.00 O ATOM 44442 H1 WAT 3691 131.537 26.416 86.618 1.00 0.00 H ATOM 44443 H2 WAT 3691 131.771 25.863 85.229 1.00 0.00 H TER 44445 WAT 3691 ATOM 44445 O WAT 3692 73.425 40.767 104.826 1.00 0.00 O ATOM 44446 H1 WAT 3692 73.793 41.203 105.595 1.00 0.00 H ATOM 44447 H2 WAT 3692 74.057 40.080 104.615 1.00 0.00 H TER 44449 WAT 3692 ATOM 44449 O WAT 3693 21.449 144.045 89.669 1.00 0.00 O ATOM 44450 H1 WAT 3693 22.101 143.613 90.221 1.00 0.00 H ATOM 44451 H2 WAT 3693 21.923 144.262 88.866 1.00 0.00 H TER 44453 WAT 3693 ATOM 44453 O WAT 3694 67.729 113.664 18.096 1.00 0.00 O ATOM 44454 H1 WAT 3694 67.474 113.616 17.174 1.00 0.00 H ATOM 44455 H2 WAT 3694 68.683 113.585 18.085 1.00 0.00 H TER 44457 WAT 3694 ATOM 44457 O WAT 3695 111.888 5.213 112.719 1.00 0.00 O ATOM 44458 H1 WAT 3695 111.004 5.493 112.957 1.00 0.00 H ATOM 44459 H2 WAT 3695 112.096 5.720 111.934 1.00 0.00 H TER 44461 WAT 3695 ATOM 44461 O WAT 3696 24.430 16.598 23.047 1.00 0.00 O ATOM 44462 H1 WAT 3696 24.746 16.229 22.222 1.00 0.00 H ATOM 44463 H2 WAT 3696 24.079 15.848 23.527 1.00 0.00 H TER 44465 WAT 3696 ATOM 44465 O WAT 3697 32.102 48.893 76.602 1.00 0.00 O ATOM 44466 H1 WAT 3697 31.559 49.549 76.165 1.00 0.00 H ATOM 44467 H2 WAT 3697 31.667 48.741 77.440 1.00 0.00 H TER 44469 WAT 3697 ATOM 44469 O WAT 3698 104.962 4.352 116.723 1.00 0.00 O ATOM 44470 H1 WAT 3698 104.894 4.598 115.800 1.00 0.00 H ATOM 44471 H2 WAT 3698 104.164 3.853 116.897 1.00 0.00 H TER 44473 WAT 3698 ATOM 44473 O WAT 3699 121.307 78.587 115.857 1.00 0.00 O ATOM 44474 H1 WAT 3699 121.508 78.299 116.747 1.00 0.00 H ATOM 44475 H2 WAT 3699 120.356 78.509 115.789 1.00 0.00 H TER 44477 WAT 3699 ATOM 44477 O WAT 3700 2.647 129.258 121.008 1.00 0.00 O ATOM 44478 H1 WAT 3700 2.639 128.700 120.229 1.00 0.00 H ATOM 44479 H2 WAT 3700 3.181 130.012 120.757 1.00 0.00 H TER 44481 WAT 3700 ATOM 44481 O WAT 3701 132.391 88.995 107.299 1.00 0.00 O ATOM 44482 H1 WAT 3701 131.512 88.642 107.163 1.00 0.00 H ATOM 44483 H2 WAT 3701 132.390 89.828 106.828 1.00 0.00 H TER 44485 WAT 3701 ATOM 44485 O WAT 3702 110.288 25.341 129.398 1.00 0.00 O ATOM 44486 H1 WAT 3702 109.809 25.664 128.634 1.00 0.00 H ATOM 44487 H2 WAT 3702 110.086 24.406 129.429 1.00 0.00 H TER 44489 WAT 3702 ATOM 44489 O WAT 3703 28.020 0.221 148.720 1.00 0.00 O ATOM 44490 H1 WAT 3703 27.146 -0.145 148.586 1.00 0.00 H ATOM 44491 H2 WAT 3703 27.913 1.160 148.569 1.00 0.00 H TER 44493 WAT 3703 ATOM 44493 O WAT 3704 80.474 0.253 109.940 1.00 0.00 O ATOM 44494 H1 WAT 3704 79.529 0.177 109.815 1.00 0.00 H ATOM 44495 H2 WAT 3704 80.590 0.270 110.890 1.00 0.00 H TER 44497 WAT 3704 ATOM 44497 O WAT 3705 136.918 125.545 130.757 1.00 0.00 O ATOM 44498 H1 WAT 3705 136.415 126.149 131.303 1.00 0.00 H ATOM 44499 H2 WAT 3705 137.824 125.843 130.842 1.00 0.00 H TER 44501 WAT 3705 ATOM 44501 O WAT 3706 43.344 110.176 84.372 1.00 0.00 O ATOM 44502 H1 WAT 3706 43.001 111.057 84.221 1.00 0.00 H ATOM 44503 H2 WAT 3706 44.236 110.204 84.025 1.00 0.00 H TER 44505 WAT 3706 ATOM 44505 O WAT 3707 2.997 128.239 148.656 1.00 0.00 O ATOM 44506 H1 WAT 3707 3.106 128.335 149.602 1.00 0.00 H ATOM 44507 H2 WAT 3707 3.857 128.453 148.292 1.00 0.00 H TER 44509 WAT 3707 ATOM 44509 O WAT 3708 56.179 15.042 59.711 1.00 0.00 O ATOM 44510 H1 WAT 3708 57.078 14.850 59.978 1.00 0.00 H ATOM 44511 H2 WAT 3708 55.712 15.192 60.533 1.00 0.00 H TER 44513 WAT 3708 ATOM 44513 O WAT 3709 121.866 84.487 88.205 1.00 0.00 O ATOM 44514 H1 WAT 3709 122.289 85.062 88.843 1.00 0.00 H ATOM 44515 H2 WAT 3709 121.926 84.962 87.377 1.00 0.00 H TER 44517 WAT 3709 ATOM 44517 O WAT 3710 71.685 132.881 126.863 1.00 0.00 O ATOM 44518 H1 WAT 3710 71.669 132.315 127.635 1.00 0.00 H ATOM 44519 H2 WAT 3710 72.134 132.362 126.195 1.00 0.00 H TER 44521 WAT 3710 ATOM 44521 O WAT 3711 54.181 38.378 84.730 1.00 0.00 O ATOM 44522 H1 WAT 3711 54.515 39.202 84.374 1.00 0.00 H ATOM 44523 H2 WAT 3711 53.845 37.907 83.968 1.00 0.00 H TER 44525 WAT 3711 ATOM 44525 O WAT 3712 121.237 96.558 149.878 1.00 0.00 O ATOM 44526 H1 WAT 3712 122.097 96.284 150.196 1.00 0.00 H ATOM 44527 H2 WAT 3712 120.746 95.742 149.783 1.00 0.00 H TER 44529 WAT 3712 ATOM 44529 O WAT 3713 118.124 31.308 72.357 1.00 0.00 O ATOM 44530 H1 WAT 3713 118.962 31.770 72.386 1.00 0.00 H ATOM 44531 H2 WAT 3713 117.949 31.072 73.268 1.00 0.00 H TER 44533 WAT 3713 ATOM 44533 O WAT 3714 29.763 76.198 92.346 1.00 0.00 O ATOM 44534 H1 WAT 3714 30.535 76.682 92.053 1.00 0.00 H ATOM 44535 H2 WAT 3714 30.098 75.333 92.584 1.00 0.00 H TER 44537 WAT 3714 ATOM 44537 O WAT 3715 114.396 9.659 23.104 1.00 0.00 O ATOM 44538 H1 WAT 3715 113.654 10.246 23.253 1.00 0.00 H ATOM 44539 H2 WAT 3715 115.127 10.244 22.903 1.00 0.00 H TER 44541 WAT 3715 ATOM 44541 O WAT 3716 62.682 46.108 22.197 1.00 0.00 O ATOM 44542 H1 WAT 3716 62.454 45.190 22.050 1.00 0.00 H ATOM 44543 H2 WAT 3716 61.840 46.561 22.227 1.00 0.00 H TER 44545 WAT 3716 ATOM 44545 O WAT 3717 90.903 7.930 4.586 1.00 0.00 O ATOM 44546 H1 WAT 3717 90.812 8.575 3.885 1.00 0.00 H ATOM 44547 H2 WAT 3717 91.031 8.453 5.378 1.00 0.00 H TER 44549 WAT 3717 ATOM 44549 O WAT 3718 78.880 1.555 136.698 1.00 0.00 O ATOM 44550 H1 WAT 3718 78.699 2.494 136.756 1.00 0.00 H ATOM 44551 H2 WAT 3718 78.026 1.139 136.815 1.00 0.00 H TER 44553 WAT 3718 ATOM 44553 O WAT 3719 92.236 94.393 75.968 1.00 0.00 O ATOM 44554 H1 WAT 3719 92.875 94.566 75.277 1.00 0.00 H ATOM 44555 H2 WAT 3719 92.201 93.438 76.029 1.00 0.00 H TER 44557 WAT 3719 ATOM 44557 O WAT 3720 46.709 45.773 143.154 1.00 0.00 O ATOM 44558 H1 WAT 3720 46.211 46.169 142.440 1.00 0.00 H ATOM 44559 H2 WAT 3720 46.981 44.921 142.813 1.00 0.00 H TER 44561 WAT 3720 ATOM 44561 O WAT 3721 51.850 102.002 113.721 1.00 0.00 O ATOM 44562 H1 WAT 3721 52.783 101.852 113.870 1.00 0.00 H ATOM 44563 H2 WAT 3721 51.818 102.556 112.941 1.00 0.00 H TER 44565 WAT 3721 ATOM 44565 O WAT 3722 71.398 27.370 86.402 1.00 0.00 O ATOM 44566 H1 WAT 3722 70.932 27.385 87.238 1.00 0.00 H ATOM 44567 H2 WAT 3722 72.190 27.884 86.560 1.00 0.00 H TER 44569 WAT 3722 ATOM 44569 O WAT 3723 124.318 63.775 140.159 1.00 0.00 O ATOM 44570 H1 WAT 3723 124.707 64.260 139.431 1.00 0.00 H ATOM 44571 H2 WAT 3723 125.045 63.628 140.764 1.00 0.00 H TER 44573 WAT 3723 ATOM 44573 O WAT 3724 55.952 124.932 85.359 1.00 0.00 O ATOM 44574 H1 WAT 3724 55.990 123.992 85.535 1.00 0.00 H ATOM 44575 H2 WAT 3724 56.228 125.017 84.447 1.00 0.00 H TER 44577 WAT 3724 ATOM 44577 O WAT 3725 79.569 69.426 0.049 1.00 0.00 O ATOM 44578 H1 WAT 3725 78.745 69.834 0.314 1.00 0.00 H ATOM 44579 H2 WAT 3725 80.080 70.141 -0.331 1.00 0.00 H TER 44581 WAT 3725 ATOM 44581 O WAT 3726 110.053 125.684 81.293 1.00 0.00 O ATOM 44582 H1 WAT 3726 110.922 126.081 81.231 1.00 0.00 H ATOM 44583 H2 WAT 3726 110.221 124.780 81.560 1.00 0.00 H TER 44585 WAT 3726 ATOM 44585 O WAT 3727 38.822 14.909 6.235 1.00 0.00 O ATOM 44586 H1 WAT 3727 39.732 14.843 5.945 1.00 0.00 H ATOM 44587 H2 WAT 3727 38.330 15.103 5.437 1.00 0.00 H TER 44589 WAT 3727 ATOM 44589 O WAT 3728 36.325 90.439 125.625 1.00 0.00 O ATOM 44590 H1 WAT 3728 36.727 90.013 124.868 1.00 0.00 H ATOM 44591 H2 WAT 3728 35.596 90.940 125.259 1.00 0.00 H TER 44593 WAT 3728 ATOM 44593 O WAT 3729 30.957 115.180 115.520 1.00 0.00 O ATOM 44594 H1 WAT 3729 30.489 115.752 114.912 1.00 0.00 H ATOM 44595 H2 WAT 3729 30.268 114.766 116.039 1.00 0.00 H TER 44597 WAT 3729 ATOM 44597 O WAT 3730 16.305 65.916 99.399 1.00 0.00 O ATOM 44598 H1 WAT 3730 15.986 65.570 98.565 1.00 0.00 H ATOM 44599 H2 WAT 3730 16.657 65.152 99.856 1.00 0.00 H TER 44601 WAT 3730 ATOM 44601 O WAT 3731 60.390 16.590 150.486 1.00 0.00 O ATOM 44602 H1 WAT 3731 60.988 15.842 150.487 1.00 0.00 H ATOM 44603 H2 WAT 3731 60.876 17.285 150.042 1.00 0.00 H TER 44605 WAT 3731 ATOM 44605 O WAT 3732 9.469 110.767 104.375 1.00 0.00 O ATOM 44606 H1 WAT 3732 10.269 110.639 104.885 1.00 0.00 H ATOM 44607 H2 WAT 3732 9.301 111.708 104.424 1.00 0.00 H TER 44609 WAT 3732 ATOM 44609 O WAT 3733 96.408 66.524 96.873 1.00 0.00 O ATOM 44610 H1 WAT 3733 95.924 65.699 96.922 1.00 0.00 H ATOM 44611 H2 WAT 3733 97.261 66.324 97.258 1.00 0.00 H TER 44613 WAT 3733 ATOM 44613 O WAT 3734 89.385 50.247 146.349 1.00 0.00 O ATOM 44614 H1 WAT 3734 89.131 51.154 146.521 1.00 0.00 H ATOM 44615 H2 WAT 3734 89.521 50.211 145.403 1.00 0.00 H TER 44617 WAT 3734 ATOM 44617 O WAT 3735 44.327 59.251 97.101 1.00 0.00 O ATOM 44618 H1 WAT 3735 43.479 58.948 97.426 1.00 0.00 H ATOM 44619 H2 WAT 3735 44.150 59.548 96.209 1.00 0.00 H TER 44621 WAT 3735 ATOM 44621 O WAT 3736 28.748 85.221 126.406 1.00 0.00 O ATOM 44622 H1 WAT 3736 27.881 85.208 126.812 1.00 0.00 H ATOM 44623 H2 WAT 3736 28.572 85.238 125.465 1.00 0.00 H TER 44625 WAT 3736 ATOM 44625 O WAT 3737 40.617 12.804 75.579 1.00 0.00 O ATOM 44626 H1 WAT 3737 40.284 13.512 75.027 1.00 0.00 H ATOM 44627 H2 WAT 3737 41.569 12.897 75.539 1.00 0.00 H TER 44629 WAT 3737 ATOM 44629 O WAT 3738 127.421 111.137 90.674 1.00 0.00 O ATOM 44630 H1 WAT 3738 128.201 110.781 91.099 1.00 0.00 H ATOM 44631 H2 WAT 3738 127.015 110.383 90.248 1.00 0.00 H TER 44633 WAT 3738 ATOM 44633 O WAT 3739 27.997 95.467 119.654 1.00 0.00 O ATOM 44634 H1 WAT 3739 28.316 96.329 119.923 1.00 0.00 H ATOM 44635 H2 WAT 3739 28.111 95.455 118.704 1.00 0.00 H TER 44637 WAT 3739 ATOM 44637 O WAT 3740 32.690 136.945 59.713 1.00 0.00 O ATOM 44638 H1 WAT 3740 31.864 136.492 59.880 1.00 0.00 H ATOM 44639 H2 WAT 3740 33.335 136.243 59.621 1.00 0.00 H TER 44641 WAT 3740 ATOM 44641 O WAT 3741 89.684 119.928 88.906 1.00 0.00 O ATOM 44642 H1 WAT 3741 89.360 119.335 88.228 1.00 0.00 H ATOM 44643 H2 WAT 3741 89.019 120.614 88.963 1.00 0.00 H TER 44645 WAT 3741 ATOM 44645 O WAT 3742 97.563 138.685 116.017 1.00 0.00 O ATOM 44646 H1 WAT 3742 97.602 137.962 116.643 1.00 0.00 H ATOM 44647 H2 WAT 3742 97.296 139.441 116.539 1.00 0.00 H TER 44649 WAT 3742 ATOM 44649 O WAT 3743 106.342 144.624 156.878 1.00 0.00 O ATOM 44650 H1 WAT 3743 106.506 144.055 156.126 1.00 0.00 H ATOM 44651 H2 WAT 3743 107.095 144.483 157.453 1.00 0.00 H TER 44653 WAT 3743 ATOM 44653 O WAT 3744 75.101 28.637 64.295 1.00 0.00 O ATOM 44654 H1 WAT 3744 74.736 27.823 64.640 1.00 0.00 H ATOM 44655 H2 WAT 3744 75.508 29.057 65.053 1.00 0.00 H TER 44657 WAT 3744 ATOM 44657 O WAT 3745 71.250 2.267 145.054 1.00 0.00 O ATOM 44658 H1 WAT 3745 71.295 1.484 145.603 1.00 0.00 H ATOM 44659 H2 WAT 3745 70.725 2.001 144.299 1.00 0.00 H TER 44661 WAT 3745 ATOM 44661 O WAT 3746 37.114 132.433 103.767 1.00 0.00 O ATOM 44662 H1 WAT 3746 37.215 133.375 103.905 1.00 0.00 H ATOM 44663 H2 WAT 3746 37.914 132.051 104.127 1.00 0.00 H TER 44665 WAT 3746 ATOM 44665 O WAT 3747 1.614 9.250 22.988 1.00 0.00 O ATOM 44666 H1 WAT 3747 1.914 9.811 22.273 1.00 0.00 H ATOM 44667 H2 WAT 3747 0.667 9.386 23.018 1.00 0.00 H TER 44669 WAT 3747 ATOM 44669 O WAT 3748 18.640 125.224 26.253 1.00 0.00 O ATOM 44670 H1 WAT 3748 17.915 125.848 26.235 1.00 0.00 H ATOM 44671 H2 WAT 3748 18.221 124.367 26.169 1.00 0.00 H TER 44673 WAT 3748 ATOM 44673 O WAT 3749 86.710 33.696 76.744 1.00 0.00 O ATOM 44674 H1 WAT 3749 86.121 33.861 77.480 1.00 0.00 H ATOM 44675 H2 WAT 3749 86.156 33.285 76.081 1.00 0.00 H TER 44677 WAT 3749 ATOM 44677 O WAT 3750 81.714 6.419 55.232 1.00 0.00 O ATOM 44678 H1 WAT 3750 81.933 5.489 55.287 1.00 0.00 H ATOM 44679 H2 WAT 3750 80.759 6.444 55.300 1.00 0.00 H TER 44681 WAT 3750 ATOM 44681 O WAT 3751 105.403 109.571 22.026 1.00 0.00 O ATOM 44682 H1 WAT 3751 104.873 109.984 21.345 1.00 0.00 H ATOM 44683 H2 WAT 3751 105.253 110.108 22.804 1.00 0.00 H TER 44685 WAT 3751 ATOM 44685 O WAT 3752 20.992 117.849 90.060 1.00 0.00 O ATOM 44686 H1 WAT 3752 20.366 117.328 90.562 1.00 0.00 H ATOM 44687 H2 WAT 3752 21.660 118.101 90.698 1.00 0.00 H TER 44689 WAT 3752 ATOM 44689 O WAT 3753 26.795 94.811 85.784 1.00 0.00 O ATOM 44690 H1 WAT 3753 26.307 95.030 84.991 1.00 0.00 H ATOM 44691 H2 WAT 3753 26.650 95.554 86.368 1.00 0.00 H TER 44693 WAT 3753 ATOM 44693 O WAT 3754 32.203 135.615 157.134 1.00 0.00 O ATOM 44694 H1 WAT 3754 32.726 136.259 156.658 1.00 0.00 H ATOM 44695 H2 WAT 3754 31.296 135.853 156.940 1.00 0.00 H TER 44697 WAT 3754 ATOM 44697 O WAT 3755 105.877 99.639 1.918 1.00 0.00 O ATOM 44698 H1 WAT 3755 105.692 100.474 2.349 1.00 0.00 H ATOM 44699 H2 WAT 3755 105.026 99.206 1.861 1.00 0.00 H TER 44701 WAT 3755 ATOM 44701 O WAT 3756 7.000 35.796 91.717 1.00 0.00 O ATOM 44702 H1 WAT 3756 7.549 35.126 91.309 1.00 0.00 H ATOM 44703 H2 WAT 3756 6.937 35.528 92.634 1.00 0.00 H TER 44705 WAT 3756 ATOM 44705 O WAT 3757 17.020 1.475 144.220 1.00 0.00 O ATOM 44706 H1 WAT 3757 16.536 1.448 145.045 1.00 0.00 H ATOM 44707 H2 WAT 3757 17.336 2.377 144.158 1.00 0.00 H TER 44709 WAT 3757 ATOM 44709 O WAT 3758 19.746 48.821 19.672 1.00 0.00 O ATOM 44710 H1 WAT 3758 19.059 48.247 20.014 1.00 0.00 H ATOM 44711 H2 WAT 3758 20.167 49.180 20.453 1.00 0.00 H TER 44713 WAT 3758 ATOM 44713 O WAT 3759 83.243 76.227 101.599 1.00 0.00 O ATOM 44714 H1 WAT 3759 83.994 76.572 102.082 1.00 0.00 H ATOM 44715 H2 WAT 3759 83.596 75.994 100.741 1.00 0.00 H TER 44717 WAT 3759 ATOM 44717 O WAT 3760 62.619 50.275 99.155 1.00 0.00 O ATOM 44718 H1 WAT 3760 63.472 49.900 99.379 1.00 0.00 H ATOM 44719 H2 WAT 3760 62.539 50.140 98.211 1.00 0.00 H TER 44721 WAT 3760 ATOM 44721 O WAT 3761 64.359 30.046 7.488 1.00 0.00 O ATOM 44722 H1 WAT 3761 64.837 30.306 6.700 1.00 0.00 H ATOM 44723 H2 WAT 3761 63.973 30.859 7.813 1.00 0.00 H TER 44725 WAT 3761 ATOM 44725 O WAT 3762 49.438 110.235 90.259 1.00 0.00 O ATOM 44726 H1 WAT 3762 49.568 110.730 91.068 1.00 0.00 H ATOM 44727 H2 WAT 3762 49.615 109.326 90.503 1.00 0.00 H TER 44729 WAT 3762 ATOM 44729 O WAT 3763 89.767 80.884 143.765 1.00 0.00 O ATOM 44730 H1 WAT 3763 89.675 80.795 142.816 1.00 0.00 H ATOM 44731 H2 WAT 3763 90.337 80.159 144.019 1.00 0.00 H TER 44733 WAT 3763 ATOM 44733 O WAT 3764 57.678 102.169 14.749 1.00 0.00 O ATOM 44734 H1 WAT 3764 58.565 101.837 14.882 1.00 0.00 H ATOM 44735 H2 WAT 3764 57.112 101.416 14.917 1.00 0.00 H TER 44737 WAT 3764 ATOM 44737 O WAT 3765 28.565 65.849 83.136 1.00 0.00 O ATOM 44738 H1 WAT 3765 27.974 65.623 83.855 1.00 0.00 H ATOM 44739 H2 WAT 3765 28.023 66.357 82.532 1.00 0.00 H TER 44741 WAT 3765 ATOM 44741 O WAT 3766 78.924 23.694 84.666 1.00 0.00 O ATOM 44742 H1 WAT 3766 78.434 24.462 84.373 1.00 0.00 H ATOM 44743 H2 WAT 3766 78.368 23.296 85.336 1.00 0.00 H TER 44745 WAT 3766 ATOM 44745 O WAT 3767 122.546 145.094 88.561 1.00 0.00 O ATOM 44746 H1 WAT 3767 122.861 144.341 88.061 1.00 0.00 H ATOM 44747 H2 WAT 3767 121.751 145.370 88.104 1.00 0.00 H TER 44749 WAT 3767 ATOM 44749 O WAT 3768 9.840 44.686 10.508 1.00 0.00 O ATOM 44750 H1 WAT 3768 10.741 44.891 10.256 1.00 0.00 H ATOM 44751 H2 WAT 3768 9.826 44.799 11.458 1.00 0.00 H TER 44753 WAT 3768 ATOM 44753 O WAT 3769 5.969 28.676 23.163 1.00 0.00 O ATOM 44754 H1 WAT 3769 5.770 28.288 24.015 1.00 0.00 H ATOM 44755 H2 WAT 3769 5.172 29.149 22.923 1.00 0.00 H TER 44757 WAT 3769 ATOM 44757 O WAT 3770 83.806 91.626 152.834 1.00 0.00 O ATOM 44758 H1 WAT 3770 83.528 92.506 153.088 1.00 0.00 H ATOM 44759 H2 WAT 3770 84.308 91.307 153.585 1.00 0.00 H TER 44761 WAT 3770 ATOM 44761 O WAT 3771 50.094 42.247 103.275 1.00 0.00 O ATOM 44762 H1 WAT 3771 49.216 42.278 103.654 1.00 0.00 H ATOM 44763 H2 WAT 3771 50.670 42.072 104.019 1.00 0.00 H TER 44765 WAT 3771 ATOM 44765 O WAT 3772 52.732 133.237 105.840 1.00 0.00 O ATOM 44766 H1 WAT 3772 53.127 133.922 105.300 1.00 0.00 H ATOM 44767 H2 WAT 3772 52.102 132.809 105.260 1.00 0.00 H TER 44769 WAT 3772 ATOM 44769 O WAT 3773 21.485 114.433 111.985 1.00 0.00 O ATOM 44770 H1 WAT 3773 20.927 114.228 111.235 1.00 0.00 H ATOM 44771 H2 WAT 3773 20.952 114.208 112.748 1.00 0.00 H TER 44773 WAT 3773 ATOM 44773 O WAT 3774 130.563 127.008 23.849 1.00 0.00 O ATOM 44774 H1 WAT 3774 129.905 126.335 24.023 1.00 0.00 H ATOM 44775 H2 WAT 3774 131.034 127.102 24.677 1.00 0.00 H TER 44777 WAT 3774 ATOM 44777 O WAT 3775 46.448 137.435 104.755 1.00 0.00 O ATOM 44778 H1 WAT 3775 45.821 138.157 104.703 1.00 0.00 H ATOM 44779 H2 WAT 3775 45.980 136.685 104.388 1.00 0.00 H TER 44781 WAT 3775 ATOM 44781 O WAT 3776 86.081 97.800 65.324 1.00 0.00 O ATOM 44782 H1 WAT 3776 86.866 97.879 65.865 1.00 0.00 H ATOM 44783 H2 WAT 3776 85.369 98.099 65.890 1.00 0.00 H TER 44785 WAT 3776 ATOM 44785 O WAT 3777 40.087 28.443 78.761 1.00 0.00 O ATOM 44786 H1 WAT 3777 40.807 28.528 79.387 1.00 0.00 H ATOM 44787 H2 WAT 3777 40.129 29.243 78.238 1.00 0.00 H TER 44789 WAT 3777 ATOM 44789 O WAT 3778 50.976 76.251 112.822 1.00 0.00 O ATOM 44790 H1 WAT 3778 51.866 76.141 113.158 1.00 0.00 H ATOM 44791 H2 WAT 3778 51.095 76.552 111.922 1.00 0.00 H TER 44793 WAT 3778 ATOM 44793 O WAT 3779 131.906 18.495 96.032 1.00 0.00 O ATOM 44794 H1 WAT 3779 132.016 19.444 95.985 1.00 0.00 H ATOM 44795 H2 WAT 3779 131.485 18.261 95.204 1.00 0.00 H TER 44797 WAT 3779 ATOM 44797 O WAT 3780 91.533 80.066 120.094 1.00 0.00 O ATOM 44798 H1 WAT 3780 92.468 79.916 119.956 1.00 0.00 H ATOM 44799 H2 WAT 3780 91.175 79.197 120.278 1.00 0.00 H TER 44801 WAT 3780 ATOM 44801 O WAT 3781 17.322 0.656 82.876 1.00 0.00 O ATOM 44802 H1 WAT 3781 17.346 1.228 82.109 1.00 0.00 H ATOM 44803 H2 WAT 3781 17.674 -0.178 82.564 1.00 0.00 H TER 44805 WAT 3781 ATOM 44805 O WAT 3782 119.992 7.097 124.461 1.00 0.00 O ATOM 44806 H1 WAT 3782 119.896 7.102 125.413 1.00 0.00 H ATOM 44807 H2 WAT 3782 119.703 6.224 124.195 1.00 0.00 H TER 44809 WAT 3782 ATOM 44809 O WAT 3783 79.322 136.023 119.812 1.00 0.00 O ATOM 44810 H1 WAT 3783 78.823 136.014 118.996 1.00 0.00 H ATOM 44811 H2 WAT 3783 78.925 135.333 120.344 1.00 0.00 H TER 44813 WAT 3783 ATOM 44813 O WAT 3784 46.501 39.194 135.944 1.00 0.00 O ATOM 44814 H1 WAT 3784 47.097 39.940 135.888 1.00 0.00 H ATOM 44815 H2 WAT 3784 46.469 38.846 135.052 1.00 0.00 H TER 44817 WAT 3784 ATOM 44817 O WAT 3785 83.597 114.888 103.509 1.00 0.00 O ATOM 44818 H1 WAT 3785 83.899 115.135 104.383 1.00 0.00 H ATOM 44819 H2 WAT 3785 82.908 114.243 103.667 1.00 0.00 H TER 44821 WAT 3785 ATOM 44821 O WAT 3786 88.827 7.503 126.560 1.00 0.00 O ATOM 44822 H1 WAT 3786 88.627 8.270 127.095 1.00 0.00 H ATOM 44823 H2 WAT 3786 89.684 7.211 126.871 1.00 0.00 H TER 44825 WAT 3786 ATOM 44825 O WAT 3787 35.151 85.830 101.829 1.00 0.00 O ATOM 44826 H1 WAT 3787 35.747 85.189 102.217 1.00 0.00 H ATOM 44827 H2 WAT 3787 35.335 85.791 100.891 1.00 0.00 H TER 44829 WAT 3787 ATOM 44829 O WAT 3788 72.180 93.720 157.845 1.00 0.00 O ATOM 44830 H1 WAT 3788 72.662 92.893 157.867 1.00 0.00 H ATOM 44831 H2 WAT 3788 72.612 94.267 158.501 1.00 0.00 H TER 44833 WAT 3788 ATOM 44833 O WAT 3789 106.266 46.986 74.532 1.00 0.00 O ATOM 44834 H1 WAT 3789 105.732 47.713 74.851 1.00 0.00 H ATOM 44835 H2 WAT 3789 105.923 46.218 74.988 1.00 0.00 H TER 44837 WAT 3789 ATOM 44837 O WAT 3790 127.187 60.643 66.558 1.00 0.00 O ATOM 44838 H1 WAT 3790 126.482 60.850 67.171 1.00 0.00 H ATOM 44839 H2 WAT 3790 127.974 61.005 66.967 1.00 0.00 H TER 44841 WAT 3790 ATOM 44841 O WAT 3791 25.350 99.109 133.823 1.00 0.00 O ATOM 44842 H1 WAT 3791 24.664 99.616 133.390 1.00 0.00 H ATOM 44843 H2 WAT 3791 25.235 98.218 133.492 1.00 0.00 H TER 44845 WAT 3791 ATOM 44845 O WAT 3792 100.049 60.718 134.228 1.00 0.00 O ATOM 44846 H1 WAT 3792 100.994 60.761 134.084 1.00 0.00 H ATOM 44847 H2 WAT 3792 99.668 60.881 133.365 1.00 0.00 H TER 44849 WAT 3792 ATOM 44849 O WAT 3793 111.726 125.568 110.794 1.00 0.00 O ATOM 44850 H1 WAT 3793 111.885 126.308 110.207 1.00 0.00 H ATOM 44851 H2 WAT 3793 112.473 125.573 111.393 1.00 0.00 H TER 44853 WAT 3793 ATOM 44853 O WAT 3794 135.521 72.884 77.951 1.00 0.00 O ATOM 44854 H1 WAT 3794 135.726 73.406 77.175 1.00 0.00 H ATOM 44855 H2 WAT 3794 136.045 72.089 77.851 1.00 0.00 H TER 44857 WAT 3794 ATOM 44857 O WAT 3795 1.254 123.441 23.901 1.00 0.00 O ATOM 44858 H1 WAT 3795 0.755 123.408 23.084 1.00 0.00 H ATOM 44859 H2 WAT 3795 0.593 123.369 24.589 1.00 0.00 H TER 44861 WAT 3795 ATOM 44861 O WAT 3796 49.076 97.450 25.757 1.00 0.00 O ATOM 44862 H1 WAT 3796 49.896 96.958 25.708 1.00 0.00 H ATOM 44863 H2 WAT 3796 49.162 97.980 26.550 1.00 0.00 H TER 44865 WAT 3796 ATOM 44865 O WAT 3797 69.359 127.478 109.029 1.00 0.00 O ATOM 44866 H1 WAT 3797 69.181 126.976 109.824 1.00 0.00 H ATOM 44867 H2 WAT 3797 68.525 127.485 108.559 1.00 0.00 H TER 44869 WAT 3797 ATOM 44869 O WAT 3798 59.548 46.379 138.438 1.00 0.00 O ATOM 44870 H1 WAT 3798 59.250 45.683 139.023 1.00 0.00 H ATOM 44871 H2 WAT 3798 60.466 46.513 138.672 1.00 0.00 H TER 44873 WAT 3798 ATOM 44873 O WAT 3799 32.354 91.936 94.424 1.00 0.00 O ATOM 44874 H1 WAT 3799 32.385 92.564 95.146 1.00 0.00 H ATOM 44875 H2 WAT 3799 31.961 91.151 94.806 1.00 0.00 H TER 44877 WAT 3799 ATOM 44877 O WAT 3800 21.427 71.272 146.753 1.00 0.00 O ATOM 44878 H1 WAT 3800 21.069 71.484 145.891 1.00 0.00 H ATOM 44879 H2 WAT 3800 20.739 70.761 147.179 1.00 0.00 H TER 44881 WAT 3800 ATOM 44881 O WAT 3801 93.266 79.590 106.477 1.00 0.00 O ATOM 44882 H1 WAT 3801 92.973 80.498 106.555 1.00 0.00 H ATOM 44883 H2 WAT 3801 92.508 79.123 106.125 1.00 0.00 H TER 44885 WAT 3801 ATOM 44885 O WAT 3802 56.299 138.869 68.718 1.00 0.00 O ATOM 44886 H1 WAT 3802 55.589 138.284 68.983 1.00 0.00 H ATOM 44887 H2 WAT 3802 55.860 139.688 68.486 1.00 0.00 H TER 44889 WAT 3802 ATOM 44889 O WAT 3803 119.603 1.785 5.473 1.00 0.00 O ATOM 44890 H1 WAT 3803 119.026 1.630 6.221 1.00 0.00 H ATOM 44891 H2 WAT 3803 120.020 2.626 5.663 1.00 0.00 H TER 44893 WAT 3803 ATOM 44893 O WAT 3804 92.506 136.542 75.596 1.00 0.00 O ATOM 44894 H1 WAT 3804 92.058 135.898 75.047 1.00 0.00 H ATOM 44895 H2 WAT 3804 91.894 137.276 75.652 1.00 0.00 H TER 44897 WAT 3804 ATOM 44897 O WAT 3805 116.723 60.541 131.604 1.00 0.00 O ATOM 44898 H1 WAT 3805 116.128 59.919 131.186 1.00 0.00 H ATOM 44899 H2 WAT 3805 117.455 60.619 130.992 1.00 0.00 H TER 44901 WAT 3805 ATOM 44901 O WAT 3806 78.562 66.018 2.238 1.00 0.00 O ATOM 44902 H1 WAT 3806 78.251 65.400 1.576 1.00 0.00 H ATOM 44903 H2 WAT 3806 79.385 66.355 1.883 1.00 0.00 H TER 44905 WAT 3806 ATOM 44905 O WAT 3807 140.468 80.915 141.040 1.00 0.00 O ATOM 44906 H1 WAT 3807 141.220 81.255 141.524 1.00 0.00 H ATOM 44907 H2 WAT 3807 139.713 81.356 141.429 1.00 0.00 H TER 44909 WAT 3807 ATOM 44909 O WAT 3808 31.667 70.022 66.282 1.00 0.00 O ATOM 44910 H1 WAT 3808 32.332 69.710 65.669 1.00 0.00 H ATOM 44911 H2 WAT 3808 31.262 70.767 65.836 1.00 0.00 H TER 44913 WAT 3808 ATOM 44913 O WAT 3809 104.722 132.599 87.656 1.00 0.00 O ATOM 44914 H1 WAT 3809 103.909 133.051 87.430 1.00 0.00 H ATOM 44915 H2 WAT 3809 105.413 133.159 87.303 1.00 0.00 H TER 44917 WAT 3809 ATOM 44917 O WAT 3810 27.601 112.285 28.384 1.00 0.00 O ATOM 44918 H1 WAT 3810 27.295 111.453 28.744 1.00 0.00 H ATOM 44919 H2 WAT 3810 28.009 112.050 27.550 1.00 0.00 H TER 44921 WAT 3810 ATOM 44921 O WAT 3811 51.999 125.019 6.726 1.00 0.00 O ATOM 44922 H1 WAT 3811 52.647 125.564 6.279 1.00 0.00 H ATOM 44923 H2 WAT 3811 52.133 125.203 7.656 1.00 0.00 H TER 44925 WAT 3811 ATOM 44925 O WAT 3812 89.399 120.312 85.024 1.00 0.00 O ATOM 44926 H1 WAT 3812 90.160 120.893 85.054 1.00 0.00 H ATOM 44927 H2 WAT 3812 88.997 120.488 84.173 1.00 0.00 H TER 44929 WAT 3812 ATOM 44929 O WAT 3813 25.674 91.179 58.827 1.00 0.00 O ATOM 44930 H1 WAT 3813 25.053 91.828 59.156 1.00 0.00 H ATOM 44931 H2 WAT 3813 25.275 90.335 59.039 1.00 0.00 H TER 44933 WAT 3813 ATOM 44933 O WAT 3814 133.826 83.774 115.317 1.00 0.00 O ATOM 44934 H1 WAT 3814 134.083 83.509 116.200 1.00 0.00 H ATOM 44935 H2 WAT 3814 133.606 82.955 114.875 1.00 0.00 H TER 44937 WAT 3814 ATOM 44937 O WAT 3815 28.230 36.197 127.072 1.00 0.00 O ATOM 44938 H1 WAT 3815 29.180 36.094 127.125 1.00 0.00 H ATOM 44939 H2 WAT 3815 28.023 36.047 126.149 1.00 0.00 H TER 44941 WAT 3815 ATOM 44941 O WAT 3816 120.748 138.222 122.278 1.00 0.00 O ATOM 44942 H1 WAT 3816 120.356 138.816 121.636 1.00 0.00 H ATOM 44943 H2 WAT 3816 120.038 137.627 122.518 1.00 0.00 H TER 44945 WAT 3816 ATOM 44945 O WAT 3817 114.388 47.139 75.667 1.00 0.00 O ATOM 44946 H1 WAT 3817 115.344 47.088 75.678 1.00 0.00 H ATOM 44947 H2 WAT 3817 114.105 46.474 76.294 1.00 0.00 H TER 44949 WAT 3817 ATOM 44949 O WAT 3818 79.303 43.342 25.770 1.00 0.00 O ATOM 44950 H1 WAT 3818 80.005 43.785 25.295 1.00 0.00 H ATOM 44951 H2 WAT 3818 78.521 43.496 25.240 1.00 0.00 H TER 44953 WAT 3818 ATOM 44953 O WAT 3819 61.724 71.042 22.077 1.00 0.00 O ATOM 44954 H1 WAT 3819 61.967 71.035 21.151 1.00 0.00 H ATOM 44955 H2 WAT 3819 62.438 70.577 22.515 1.00 0.00 H TER 44957 WAT 3819 ATOM 44957 O WAT 3820 122.824 22.581 155.264 1.00 0.00 O ATOM 44958 H1 WAT 3820 123.448 22.936 154.631 1.00 0.00 H ATOM 44959 H2 WAT 3820 123.024 23.040 156.080 1.00 0.00 H TER 44961 WAT 3820 ATOM 44961 O WAT 3821 13.733 0.791 15.255 1.00 0.00 O ATOM 44962 H1 WAT 3821 13.551 0.108 15.900 1.00 0.00 H ATOM 44963 H2 WAT 3821 14.111 0.323 14.511 1.00 0.00 H TER 44965 WAT 3821 ATOM 44965 O WAT 3822 1.027 20.038 110.983 1.00 0.00 O ATOM 44966 H1 WAT 3822 0.688 19.504 111.702 1.00 0.00 H ATOM 44967 H2 WAT 3822 1.811 20.452 111.341 1.00 0.00 H TER 44969 WAT 3822 ATOM 44969 O WAT 3823 89.041 15.562 63.446 1.00 0.00 O ATOM 44970 H1 WAT 3823 89.405 16.400 63.160 1.00 0.00 H ATOM 44971 H2 WAT 3823 89.604 15.291 64.171 1.00 0.00 H TER 44973 WAT 3823 ATOM 44973 O WAT 3824 110.082 115.212 117.826 1.00 0.00 O ATOM 44974 H1 WAT 3824 109.281 114.760 118.088 1.00 0.00 H ATOM 44975 H2 WAT 3824 110.539 115.386 118.650 1.00 0.00 H TER 44977 WAT 3824 ATOM 44977 O WAT 3825 66.011 86.222 1.308 1.00 0.00 O ATOM 44978 H1 WAT 3825 66.130 85.404 0.826 1.00 0.00 H ATOM 44979 H2 WAT 3825 66.002 86.900 0.632 1.00 0.00 H TER 44981 WAT 3825 ATOM 44981 O WAT 3826 17.469 74.135 112.487 1.00 0.00 O ATOM 44982 H1 WAT 3826 17.483 73.178 112.478 1.00 0.00 H ATOM 44983 H2 WAT 3826 17.206 74.362 113.379 1.00 0.00 H TER 44985 WAT 3826 ATOM 44985 O WAT 3827 38.684 3.509 68.749 1.00 0.00 O ATOM 44986 H1 WAT 3827 39.431 2.950 68.533 1.00 0.00 H ATOM 44987 H2 WAT 3827 38.300 3.105 69.527 1.00 0.00 H TER 44989 WAT 3827 ATOM 44989 O WAT 3828 12.794 136.950 146.485 1.00 0.00 O ATOM 44990 H1 WAT 3828 12.181 137.303 145.840 1.00 0.00 H ATOM 44991 H2 WAT 3828 12.279 136.314 146.981 1.00 0.00 H TER 44993 WAT 3828 ATOM 44993 O WAT 3829 64.375 74.028 18.239 1.00 0.00 O ATOM 44994 H1 WAT 3829 63.991 74.498 18.980 1.00 0.00 H ATOM 44995 H2 WAT 3829 64.310 73.105 18.482 1.00 0.00 H TER 44997 WAT 3829 ATOM 44997 O WAT 3830 9.997 22.163 151.599 1.00 0.00 O ATOM 44998 H1 WAT 3830 9.812 21.914 152.505 1.00 0.00 H ATOM 44999 H2 WAT 3830 10.593 22.907 151.672 1.00 0.00 H TER 45001 WAT 3830 ATOM 45001 O WAT 3831 101.389 82.087 158.158 1.00 0.00 O ATOM 45002 H1 WAT 3831 102.246 82.260 158.547 1.00 0.00 H ATOM 45003 H2 WAT 3831 101.060 81.324 158.633 1.00 0.00 H TER 45005 WAT 3831 ATOM 45005 O WAT 3832 28.513 84.968 123.610 1.00 0.00 O ATOM 45006 H1 WAT 3832 29.391 85.037 123.237 1.00 0.00 H ATOM 45007 H2 WAT 3832 28.019 85.672 123.189 1.00 0.00 H TER 45009 WAT 3832 ATOM 45009 O WAT 3833 120.429 88.680 151.283 1.00 0.00 O ATOM 45010 H1 WAT 3833 121.138 89.310 151.154 1.00 0.00 H ATOM 45011 H2 WAT 3833 120.221 88.742 152.215 1.00 0.00 H TER 45013 WAT 3833 ATOM 45013 O WAT 3834 106.268 73.693 143.590 1.00 0.00 O ATOM 45014 H1 WAT 3834 107.013 73.142 143.350 1.00 0.00 H ATOM 45015 H2 WAT 3834 106.449 73.963 144.490 1.00 0.00 H TER 45017 WAT 3834 ATOM 45017 O WAT 3835 27.736 84.739 87.103 1.00 0.00 O ATOM 45018 H1 WAT 3835 28.481 85.335 87.020 1.00 0.00 H ATOM 45019 H2 WAT 3835 27.898 84.061 86.447 1.00 0.00 H TER 45021 WAT 3835 ATOM 45021 O WAT 3836 17.454 1.995 155.194 1.00 0.00 O ATOM 45022 H1 WAT 3836 18.342 2.326 155.332 1.00 0.00 H ATOM 45023 H2 WAT 3836 17.412 1.197 155.722 1.00 0.00 H TER 45025 WAT 3836 ATOM 45025 O WAT 3837 46.716 3.708 157.483 1.00 0.00 O ATOM 45026 H1 WAT 3837 46.825 2.793 157.741 1.00 0.00 H ATOM 45027 H2 WAT 3837 46.536 3.673 156.544 1.00 0.00 H TER 45029 WAT 3837 ATOM 45029 O WAT 3838 8.554 33.137 6.915 1.00 0.00 O ATOM 45030 H1 WAT 3838 8.816 33.272 7.826 1.00 0.00 H ATOM 45031 H2 WAT 3838 7.974 32.376 6.943 1.00 0.00 H TER 45033 WAT 3838 ATOM 45033 O WAT 3839 138.527 121.521 131.645 1.00 0.00 O ATOM 45034 H1 WAT 3839 137.882 122.190 131.874 1.00 0.00 H ATOM 45035 H2 WAT 3839 138.192 120.719 132.045 1.00 0.00 H TER 45037 WAT 3839 ATOM 45037 O WAT 3840 8.629 57.975 66.791 1.00 0.00 O ATOM 45038 H1 WAT 3840 8.071 58.362 66.118 1.00 0.00 H ATOM 45039 H2 WAT 3840 9.196 57.369 66.313 1.00 0.00 H TER 45041 WAT 3840 ATOM 45041 O WAT 3841 24.385 108.472 136.397 1.00 0.00 O ATOM 45042 H1 WAT 3841 25.107 108.470 135.769 1.00 0.00 H ATOM 45043 H2 WAT 3841 23.868 107.698 136.169 1.00 0.00 H TER 45045 WAT 3841 ATOM 45045 O WAT 3842 0.942 49.945 140.366 1.00 0.00 O ATOM 45046 H1 WAT 3842 0.416 49.341 140.890 1.00 0.00 H ATOM 45047 H2 WAT 3842 0.934 50.763 140.862 1.00 0.00 H TER 45049 WAT 3842 ATOM 45049 O WAT 3843 139.981 84.230 116.944 1.00 0.00 O ATOM 45050 H1 WAT 3843 140.541 84.803 116.419 1.00 0.00 H ATOM 45051 H2 WAT 3843 139.735 83.524 116.346 1.00 0.00 H TER 45053 WAT 3843 ATOM 45053 O WAT 3844 7.780 58.903 82.109 1.00 0.00 O ATOM 45054 H1 WAT 3844 7.177 58.785 81.375 1.00 0.00 H ATOM 45055 H2 WAT 3844 7.212 58.998 82.873 1.00 0.00 H TER 45057 WAT 3844 ATOM 45057 O WAT 3845 0.522 130.767 89.673 1.00 0.00 O ATOM 45058 H1 WAT 3845 -0.188 130.885 90.305 1.00 0.00 H ATOM 45059 H2 WAT 3845 1.321 130.818 90.198 1.00 0.00 H TER 45061 WAT 3845 ATOM 45061 O WAT 3846 60.219 87.041 128.418 1.00 0.00 O ATOM 45062 H1 WAT 3846 60.558 86.332 128.965 1.00 0.00 H ATOM 45063 H2 WAT 3846 59.660 86.602 127.777 1.00 0.00 H TER 45065 WAT 3846 ATOM 45065 O WAT 3847 35.363 75.084 104.178 1.00 0.00 O ATOM 45066 H1 WAT 3847 35.088 74.548 104.921 1.00 0.00 H ATOM 45067 H2 WAT 3847 35.081 74.590 103.408 1.00 0.00 H TER 45069 WAT 3847 ATOM 45069 O WAT 3848 12.159 69.905 136.965 1.00 0.00 O ATOM 45070 H1 WAT 3848 12.430 69.793 136.054 1.00 0.00 H ATOM 45071 H2 WAT 3848 11.717 69.086 137.186 1.00 0.00 H TER 45073 WAT 3848 ATOM 45073 O WAT 3849 53.935 109.060 157.586 1.00 0.00 O ATOM 45074 H1 WAT 3849 54.468 109.765 157.954 1.00 0.00 H ATOM 45075 H2 WAT 3849 53.385 108.771 158.314 1.00 0.00 H TER 45077 WAT 3849 ATOM 45077 O WAT 3850 12.951 93.548 117.084 1.00 0.00 O ATOM 45078 H1 WAT 3850 12.146 93.149 117.414 1.00 0.00 H ATOM 45079 H2 WAT 3850 13.189 94.194 117.750 1.00 0.00 H TER 45081 WAT 3850 ATOM 45081 O WAT 3851 95.712 67.735 87.405 1.00 0.00 O ATOM 45082 H1 WAT 3851 94.926 68.139 87.036 1.00 0.00 H ATOM 45083 H2 WAT 3851 95.942 68.295 88.147 1.00 0.00 H TER 45085 WAT 3851 ATOM 45085 O WAT 3852 55.421 9.807 134.765 1.00 0.00 O ATOM 45086 H1 WAT 3852 55.479 10.625 135.260 1.00 0.00 H ATOM 45087 H2 WAT 3852 55.259 10.084 133.863 1.00 0.00 H TER 45089 WAT 3852 ATOM 45089 O WAT 3853 96.865 53.192 6.533 1.00 0.00 O ATOM 45090 H1 WAT 3853 96.058 52.833 6.900 1.00 0.00 H ATOM 45091 H2 WAT 3853 96.907 54.086 6.875 1.00 0.00 H TER 45093 WAT 3853 ATOM 45093 O WAT 3854 134.859 13.338 109.693 1.00 0.00 O ATOM 45094 H1 WAT 3854 134.000 12.973 109.478 1.00 0.00 H ATOM 45095 H2 WAT 3854 134.665 14.108 110.227 1.00 0.00 H TER 45097 WAT 3854 ATOM 45097 O WAT 3855 12.456 74.195 84.374 1.00 0.00 O ATOM 45098 H1 WAT 3855 12.578 74.901 83.738 1.00 0.00 H ATOM 45099 H2 WAT 3855 11.955 73.531 83.901 1.00 0.00 H TER 45101 WAT 3855 ATOM 45101 O WAT 3856 101.761 109.901 97.696 1.00 0.00 O ATOM 45102 H1 WAT 3856 101.277 109.558 96.945 1.00 0.00 H ATOM 45103 H2 WAT 3856 101.475 109.360 98.432 1.00 0.00 H TER 45105 WAT 3856 ATOM 45105 O WAT 3857 42.263 83.028 111.344 1.00 0.00 O ATOM 45106 H1 WAT 3857 43.073 83.340 111.747 1.00 0.00 H ATOM 45107 H2 WAT 3857 42.553 82.416 110.667 1.00 0.00 H TER 45109 WAT 3857 ATOM 45109 O WAT 3858 114.345 112.791 136.956 1.00 0.00 O ATOM 45110 H1 WAT 3858 113.995 112.221 137.641 1.00 0.00 H ATOM 45111 H2 WAT 3858 113.570 113.126 136.505 1.00 0.00 H TER 45113 WAT 3858 ATOM 45113 O WAT 3859 103.713 27.028 12.697 1.00 0.00 O ATOM 45114 H1 WAT 3859 103.525 27.273 13.603 1.00 0.00 H ATOM 45115 H2 WAT 3859 104.378 26.343 12.767 1.00 0.00 H TER 45117 WAT 3859 ATOM 45117 O WAT 3860 72.933 5.633 57.169 1.00 0.00 O ATOM 45118 H1 WAT 3860 73.309 5.506 58.040 1.00 0.00 H ATOM 45119 H2 WAT 3860 73.688 5.628 56.580 1.00 0.00 H TER 45121 WAT 3860 ATOM 45121 O WAT 3861 35.239 2.540 80.873 1.00 0.00 O ATOM 45122 H1 WAT 3861 35.273 1.672 80.470 1.00 0.00 H ATOM 45123 H2 WAT 3861 34.495 2.970 80.453 1.00 0.00 H TER 45125 WAT 3861 ATOM 45125 O WAT 3862 135.651 133.044 11.813 1.00 0.00 O ATOM 45126 H1 WAT 3862 135.534 133.854 12.310 1.00 0.00 H ATOM 45127 H2 WAT 3862 135.084 133.148 11.048 1.00 0.00 H TER 45129 WAT 3862 ATOM 45129 O WAT 3863 26.601 58.182 111.160 1.00 0.00 O ATOM 45130 H1 WAT 3863 26.521 58.765 110.405 1.00 0.00 H ATOM 45131 H2 WAT 3863 26.808 57.327 110.781 1.00 0.00 H TER 45133 WAT 3863 ATOM 45133 O WAT 3864 39.241 76.841 111.637 1.00 0.00 O ATOM 45134 H1 WAT 3864 38.601 76.149 111.803 1.00 0.00 H ATOM 45135 H2 WAT 3864 39.713 76.935 112.465 1.00 0.00 H TER 45137 WAT 3864 ATOM 45137 O WAT 3865 21.549 65.287 154.384 1.00 0.00 O ATOM 45138 H1 WAT 3865 21.742 65.404 155.314 1.00 0.00 H ATOM 45139 H2 WAT 3865 22.407 65.280 153.960 1.00 0.00 H TER 45141 WAT 3865 ATOM 45141 O WAT 3866 101.623 122.615 90.894 1.00 0.00 O ATOM 45142 H1 WAT 3866 101.515 121.819 91.414 1.00 0.00 H ATOM 45143 H2 WAT 3866 101.340 123.321 91.476 1.00 0.00 H TER 45145 WAT 3866 ATOM 45145 O WAT 3867 37.825 143.060 110.557 1.00 0.00 O ATOM 45146 H1 WAT 3867 38.279 143.021 111.399 1.00 0.00 H ATOM 45147 H2 WAT 3867 37.773 142.148 110.270 1.00 0.00 H TER 45149 WAT 3867 ATOM 45149 O WAT 3868 141.154 67.194 0.141 1.00 0.00 O ATOM 45150 H1 WAT 3868 140.799 67.970 -0.293 1.00 0.00 H ATOM 45151 H2 WAT 3868 141.592 67.536 0.921 1.00 0.00 H TER 45153 WAT 3868 ATOM 45153 O WAT 3869 139.607 46.469 130.366 1.00 0.00 O ATOM 45154 H1 WAT 3869 140.322 46.898 130.835 1.00 0.00 H ATOM 45155 H2 WAT 3869 138.959 46.273 131.042 1.00 0.00 H TER 45157 WAT 3869 ATOM 45157 O WAT 3870 78.800 58.097 5.028 1.00 0.00 O ATOM 45158 H1 WAT 3870 77.896 58.017 4.724 1.00 0.00 H ATOM 45159 H2 WAT 3870 79.320 57.666 4.350 1.00 0.00 H TER 45161 WAT 3870 ATOM 45161 O WAT 3871 44.058 130.123 136.985 1.00 0.00 O ATOM 45162 H1 WAT 3871 44.468 130.746 136.385 1.00 0.00 H ATOM 45163 H2 WAT 3871 44.668 130.061 137.720 1.00 0.00 H TER 45165 WAT 3871 ATOM 45165 O WAT 3872 128.365 98.163 15.631 1.00 0.00 O ATOM 45166 H1 WAT 3872 127.995 98.756 16.284 1.00 0.00 H ATOM 45167 H2 WAT 3872 127.626 97.623 15.351 1.00 0.00 H TER 45169 WAT 3872 ATOM 45169 O WAT 3873 0.540 86.893 1.496 1.00 0.00 O ATOM 45170 H1 WAT 3873 0.132 87.076 0.649 1.00 0.00 H ATOM 45171 H2 WAT 3873 0.659 87.755 1.895 1.00 0.00 H TER 45173 WAT 3873 ATOM 45173 O WAT 3874 33.780 140.398 143.267 1.00 0.00 O ATOM 45174 H1 WAT 3874 33.311 139.771 143.817 1.00 0.00 H ATOM 45175 H2 WAT 3874 34.640 140.482 143.678 1.00 0.00 H TER 45177 WAT 3874 ATOM 45177 O WAT 3875 28.754 109.243 79.244 1.00 0.00 O ATOM 45178 H1 WAT 3875 28.191 109.382 80.006 1.00 0.00 H ATOM 45179 H2 WAT 3875 28.889 110.119 78.884 1.00 0.00 H TER 45181 WAT 3875 ATOM 45181 O WAT 3876 5.083 42.038 76.439 1.00 0.00 O ATOM 45182 H1 WAT 3876 4.179 42.340 76.535 1.00 0.00 H ATOM 45183 H2 WAT 3876 5.022 41.281 75.858 1.00 0.00 H TER 45185 WAT 3876 ATOM 45185 O WAT 3877 99.594 20.810 94.438 1.00 0.00 O ATOM 45186 H1 WAT 3877 100.443 20.371 94.395 1.00 0.00 H ATOM 45187 H2 WAT 3877 99.620 21.301 95.260 1.00 0.00 H TER 45189 WAT 3877 ATOM 45189 O WAT 3878 122.461 111.152 19.099 1.00 0.00 O ATOM 45190 H1 WAT 3878 123.149 110.822 19.677 1.00 0.00 H ATOM 45191 H2 WAT 3878 122.802 111.011 18.216 1.00 0.00 H TER 45193 WAT 3878 ATOM 45193 O WAT 3879 118.334 117.603 10.662 1.00 0.00 O ATOM 45194 H1 WAT 3879 117.771 117.483 11.427 1.00 0.00 H ATOM 45195 H2 WAT 3879 118.059 118.442 10.292 1.00 0.00 H TER 45197 WAT 3879 ATOM 45197 O WAT 3880 49.725 128.430 68.812 1.00 0.00 O ATOM 45198 H1 WAT 3880 49.839 127.480 68.814 1.00 0.00 H ATOM 45199 H2 WAT 3880 49.612 128.656 67.888 1.00 0.00 H TER 45201 WAT 3880 ATOM 45201 O WAT 3881 11.484 132.047 84.991 1.00 0.00 O ATOM 45202 H1 WAT 3881 11.547 132.983 84.799 1.00 0.00 H ATOM 45203 H2 WAT 3881 11.069 131.670 84.216 1.00 0.00 H TER 45205 WAT 3881 ATOM 45205 O WAT 3882 33.816 89.820 3.618 1.00 0.00 O ATOM 45206 H1 WAT 3882 33.553 89.914 2.702 1.00 0.00 H ATOM 45207 H2 WAT 3882 34.340 90.600 3.798 1.00 0.00 H TER 45209 WAT 3882 ATOM 45209 O WAT 3883 67.886 1.447 151.829 1.00 0.00 O ATOM 45210 H1 WAT 3883 67.638 2.127 152.456 1.00 0.00 H ATOM 45211 H2 WAT 3883 68.831 1.556 151.719 1.00 0.00 H TER 45213 WAT 3883 ATOM 45213 O WAT 3884 55.229 129.409 18.149 1.00 0.00 O ATOM 45214 H1 WAT 3884 55.700 129.003 18.876 1.00 0.00 H ATOM 45215 H2 WAT 3884 55.188 130.337 18.379 1.00 0.00 H TER 45217 WAT 3884 ATOM 45217 O WAT 3885 56.858 137.578 65.610 1.00 0.00 O ATOM 45218 H1 WAT 3885 56.162 138.159 65.918 1.00 0.00 H ATOM 45219 H2 WAT 3885 57.038 137.003 66.354 1.00 0.00 H TER 45221 WAT 3885 ATOM 45221 O WAT 3886 47.111 20.739 118.397 1.00 0.00 O ATOM 45222 H1 WAT 3886 46.422 21.057 118.981 1.00 0.00 H ATOM 45223 H2 WAT 3886 47.917 20.833 118.905 1.00 0.00 H TER 45225 WAT 3886 ATOM 45225 O WAT 3887 103.976 10.490 63.124 1.00 0.00 O ATOM 45226 H1 WAT 3887 103.419 11.024 62.558 1.00 0.00 H ATOM 45227 H2 WAT 3887 104.552 11.120 63.556 1.00 0.00 H TER 45229 WAT 3887 ATOM 45229 O WAT 3888 16.083 105.665 131.371 1.00 0.00 O ATOM 45230 H1 WAT 3888 15.198 105.834 131.696 1.00 0.00 H ATOM 45231 H2 WAT 3888 15.968 104.993 130.699 1.00 0.00 H TER 45233 WAT 3888 ATOM 45233 O WAT 3889 76.391 5.499 78.500 1.00 0.00 O ATOM 45234 H1 WAT 3889 76.445 5.868 79.382 1.00 0.00 H ATOM 45235 H2 WAT 3889 77.094 5.931 78.016 1.00 0.00 H TER 45237 WAT 3889 ATOM 45237 O WAT 3890 109.662 28.275 77.086 1.00 0.00 O ATOM 45238 H1 WAT 3890 110.442 28.673 77.473 1.00 0.00 H ATOM 45239 H2 WAT 3890 109.806 28.335 76.142 1.00 0.00 H TER 45241 WAT 3890 ATOM 45241 O WAT 3891 81.047 24.298 114.311 1.00 0.00 O ATOM 45242 H1 WAT 3891 80.994 24.112 115.248 1.00 0.00 H ATOM 45243 H2 WAT 3891 80.249 23.916 113.945 1.00 0.00 H TER 45245 WAT 3891 ATOM 45245 O WAT 3892 76.794 80.504 16.602 1.00 0.00 O ATOM 45246 H1 WAT 3892 76.621 81.162 15.929 1.00 0.00 H ATOM 45247 H2 WAT 3892 75.966 80.031 16.693 1.00 0.00 H TER 45249 WAT 3892 ATOM 45249 O WAT 3893 38.323 66.555 157.311 1.00 0.00 O ATOM 45250 H1 WAT 3893 38.945 66.537 158.038 1.00 0.00 H ATOM 45251 H2 WAT 3893 38.348 65.668 156.953 1.00 0.00 H TER 45253 WAT 3893 ATOM 45253 O WAT 3894 119.211 125.875 92.715 1.00 0.00 O ATOM 45254 H1 WAT 3894 118.259 125.803 92.649 1.00 0.00 H ATOM 45255 H2 WAT 3894 119.470 125.132 93.260 1.00 0.00 H TER 45257 WAT 3894 ATOM 45257 O WAT 3895 124.091 7.528 71.952 1.00 0.00 O ATOM 45258 H1 WAT 3895 124.651 8.276 71.745 1.00 0.00 H ATOM 45259 H2 WAT 3895 124.445 6.811 71.425 1.00 0.00 H TER 45261 WAT 3895 ATOM 45261 O WAT 3896 102.038 67.733 130.704 1.00 0.00 O ATOM 45262 H1 WAT 3896 101.731 67.240 129.943 1.00 0.00 H ATOM 45263 H2 WAT 3896 101.427 67.501 131.403 1.00 0.00 H TER 45265 WAT 3896 ATOM 45265 O WAT 3897 144.667 45.128 85.793 1.00 0.00 O ATOM 45266 H1 WAT 3897 143.806 44.813 85.517 1.00 0.00 H ATOM 45267 H2 WAT 3897 144.523 46.044 86.028 1.00 0.00 H TER 45269 WAT 3897 ATOM 45269 O WAT 3898 71.958 42.796 114.248 1.00 0.00 O ATOM 45270 H1 WAT 3898 71.169 42.466 113.819 1.00 0.00 H ATOM 45271 H2 WAT 3898 72.507 42.022 114.368 1.00 0.00 H TER 45273 WAT 3898 ATOM 45273 O WAT 3899 82.030 116.046 135.880 1.00 0.00 O ATOM 45274 H1 WAT 3899 81.135 115.726 135.990 1.00 0.00 H ATOM 45275 H2 WAT 3899 82.573 115.393 136.321 1.00 0.00 H TER 45277 WAT 3899 ATOM 45277 O WAT 3900 48.596 56.146 75.330 1.00 0.00 O ATOM 45278 H1 WAT 3900 49.219 55.600 75.810 1.00 0.00 H ATOM 45279 H2 WAT 3900 48.709 55.890 74.415 1.00 0.00 H TER 45281 WAT 3900 ATOM 45281 O WAT 3901 139.476 91.951 27.854 1.00 0.00 O ATOM 45282 H1 WAT 3901 139.724 92.874 27.906 1.00 0.00 H ATOM 45283 H2 WAT 3901 140.304 91.487 27.732 1.00 0.00 H TER 45285 WAT 3901 ATOM 45285 O WAT 3902 27.284 49.164 12.461 1.00 0.00 O ATOM 45286 H1 WAT 3902 27.181 49.928 13.028 1.00 0.00 H ATOM 45287 H2 WAT 3902 26.723 49.348 11.707 1.00 0.00 H TER 45289 WAT 3902 ATOM 45289 O WAT 3903 93.070 129.760 103.723 1.00 0.00 O ATOM 45290 H1 WAT 3903 93.385 130.089 102.881 1.00 0.00 H ATOM 45291 H2 WAT 3903 92.188 129.437 103.539 1.00 0.00 H TER 45293 WAT 3903 ATOM 45293 O WAT 3904 66.604 144.934 93.358 1.00 0.00 O ATOM 45294 H1 WAT 3904 67.122 144.430 93.985 1.00 0.00 H ATOM 45295 H2 WAT 3904 66.180 145.611 93.886 1.00 0.00 H TER 45297 WAT 3904 ATOM 45297 O WAT 3905 141.803 121.031 24.691 1.00 0.00 O ATOM 45298 H1 WAT 3905 142.611 121.251 24.227 1.00 0.00 H ATOM 45299 H2 WAT 3905 141.373 120.385 24.131 1.00 0.00 H TER 45301 WAT 3905 ATOM 45301 O WAT 3906 109.204 28.916 67.107 1.00 0.00 O ATOM 45302 H1 WAT 3906 109.696 29.208 67.875 1.00 0.00 H ATOM 45303 H2 WAT 3906 109.069 27.979 67.251 1.00 0.00 H TER 45305 WAT 3906 ATOM 45305 O WAT 3907 97.067 40.024 117.665 1.00 0.00 O ATOM 45306 H1 WAT 3907 96.961 40.368 116.778 1.00 0.00 H ATOM 45307 H2 WAT 3907 97.494 40.733 118.147 1.00 0.00 H TER 45309 WAT 3907 ATOM 45309 O WAT 3908 58.172 96.801 95.897 1.00 0.00 O ATOM 45310 H1 WAT 3908 57.716 96.335 95.196 1.00 0.00 H ATOM 45311 H2 WAT 3908 57.852 97.701 95.834 1.00 0.00 H TER 45313 WAT 3908 ATOM 45313 O WAT 3909 120.771 64.695 22.713 1.00 0.00 O ATOM 45314 H1 WAT 3909 120.059 64.315 23.227 1.00 0.00 H ATOM 45315 H2 WAT 3909 121.523 64.690 23.305 1.00 0.00 H TER 45317 WAT 3909 ATOM 45317 O WAT 3910 2.918 131.384 80.032 1.00 0.00 O ATOM 45318 H1 WAT 3910 2.438 131.951 79.428 1.00 0.00 H ATOM 45319 H2 WAT 3910 2.273 131.142 80.696 1.00 0.00 H TER 45321 WAT 3910 ATOM 45321 O WAT 3911 116.196 35.798 149.689 1.00 0.00 O ATOM 45322 H1 WAT 3911 116.585 35.268 148.993 1.00 0.00 H ATOM 45323 H2 WAT 3911 115.252 35.702 149.564 1.00 0.00 H TER 45325 WAT 3911 ATOM 45325 O WAT 3912 111.188 139.648 114.940 1.00 0.00 O ATOM 45326 H1 WAT 3912 110.997 140.494 115.344 1.00 0.00 H ATOM 45327 H2 WAT 3912 111.745 139.859 114.191 1.00 0.00 H TER 45329 WAT 3912 ATOM 45329 O WAT 3913 10.073 118.099 86.851 1.00 0.00 O ATOM 45330 H1 WAT 3913 9.429 118.100 86.142 1.00 0.00 H ATOM 45331 H2 WAT 3913 10.515 118.944 86.773 1.00 0.00 H TER 45333 WAT 3913 ATOM 45333 O WAT 3914 115.485 24.638 139.012 1.00 0.00 O ATOM 45334 H1 WAT 3914 115.625 25.367 138.408 1.00 0.00 H ATOM 45335 H2 WAT 3914 114.533 24.578 139.099 1.00 0.00 H TER 45337 WAT 3914 ATOM 45337 O WAT 3915 111.720 66.381 141.388 1.00 0.00 O ATOM 45338 H1 WAT 3915 112.549 66.298 140.917 1.00 0.00 H ATOM 45339 H2 WAT 3915 111.400 65.483 141.470 1.00 0.00 H TER 45341 WAT 3915 ATOM 45341 O WAT 3916 99.761 39.302 0.341 1.00 0.00 O ATOM 45342 H1 WAT 3916 100.123 39.022 1.182 1.00 0.00 H ATOM 45343 H2 WAT 3916 99.604 38.487 -0.136 1.00 0.00 H TER 45345 WAT 3916 ATOM 45345 O WAT 3917 32.594 128.398 90.363 1.00 0.00 O ATOM 45346 H1 WAT 3917 33.529 128.290 90.534 1.00 0.00 H ATOM 45347 H2 WAT 3917 32.528 129.244 89.918 1.00 0.00 H TER 45349 WAT 3917 ATOM 45349 O WAT 3918 21.137 78.459 98.845 1.00 0.00 O ATOM 45350 H1 WAT 3918 21.288 77.688 98.299 1.00 0.00 H ATOM 45351 H2 WAT 3918 21.004 79.172 98.221 1.00 0.00 H TER 45353 WAT 3918 ATOM 45353 O WAT 3919 76.178 37.991 61.510 1.00 0.00 O ATOM 45354 H1 WAT 3919 75.306 37.846 61.143 1.00 0.00 H ATOM 45355 H2 WAT 3919 76.233 38.938 61.630 1.00 0.00 H TER 45357 WAT 3919 ATOM 45357 O WAT 3920 110.476 24.956 145.731 1.00 0.00 O ATOM 45358 H1 WAT 3920 109.910 24.186 145.680 1.00 0.00 H ATOM 45359 H2 WAT 3920 111.344 24.632 145.489 1.00 0.00 H TER 45361 WAT 3920 ATOM 45361 O WAT 3921 74.965 108.702 15.947 1.00 0.00 O ATOM 45362 H1 WAT 3921 74.219 108.341 16.426 1.00 0.00 H ATOM 45363 H2 WAT 3921 74.613 108.919 15.083 1.00 0.00 H TER 45365 WAT 3921 ATOM 45365 O WAT 3922 12.779 140.563 9.535 1.00 0.00 O ATOM 45366 H1 WAT 3922 12.114 139.888 9.400 1.00 0.00 H ATOM 45367 H2 WAT 3922 12.279 141.364 9.691 1.00 0.00 H TER 45369 WAT 3922 ATOM 45369 O WAT 3923 49.197 40.654 94.950 1.00 0.00 O ATOM 45370 H1 WAT 3923 50.022 41.140 94.930 1.00 0.00 H ATOM 45371 H2 WAT 3923 49.359 39.885 94.402 1.00 0.00 H TER 45373 WAT 3923 ATOM 45373 O WAT 3924 69.709 109.862 101.602 1.00 0.00 O ATOM 45374 H1 WAT 3924 69.942 110.773 101.785 1.00 0.00 H ATOM 45375 H2 WAT 3924 70.290 109.605 100.887 1.00 0.00 H TER 45377 WAT 3924 ATOM 45377 O WAT 3925 145.607 109.887 147.755 1.00 0.00 O ATOM 45378 H1 WAT 3925 144.945 109.196 147.757 1.00 0.00 H ATOM 45379 H2 WAT 3925 145.170 110.637 147.352 1.00 0.00 H TER 45381 WAT 3925 ATOM 45381 O WAT 3926 15.420 74.906 128.403 1.00 0.00 O ATOM 45382 H1 WAT 3926 15.460 74.607 129.311 1.00 0.00 H ATOM 45383 H2 WAT 3926 16.114 75.562 128.335 1.00 0.00 H TER 45385 WAT 3926 ATOM 45385 O WAT 3927 104.321 7.006 150.759 1.00 0.00 O ATOM 45386 H1 WAT 3927 104.622 7.879 151.010 1.00 0.00 H ATOM 45387 H2 WAT 3927 104.914 6.408 151.215 1.00 0.00 H TER 45389 WAT 3927 ATOM 45389 O WAT 3928 9.759 2.042 124.605 1.00 0.00 O ATOM 45390 H1 WAT 3928 8.820 1.857 124.594 1.00 0.00 H ATOM 45391 H2 WAT 3928 9.826 2.953 124.318 1.00 0.00 H TER 45393 WAT 3928 ATOM 45393 O WAT 3929 15.142 51.010 85.771 1.00 0.00 O ATOM 45394 H1 WAT 3929 14.748 51.856 85.557 1.00 0.00 H ATOM 45395 H2 WAT 3929 16.074 51.200 85.878 1.00 0.00 H TER 45397 WAT 3929 ATOM 45397 O WAT 3930 17.441 53.931 118.565 1.00 0.00 O ATOM 45398 H1 WAT 3930 17.255 54.436 119.356 1.00 0.00 H ATOM 45399 H2 WAT 3930 16.937 53.124 118.672 1.00 0.00 H TER 45401 WAT 3930 ATOM 45401 O WAT 3931 27.952 130.559 127.327 1.00 0.00 O ATOM 45402 H1 WAT 3931 28.285 129.857 126.768 1.00 0.00 H ATOM 45403 H2 WAT 3931 28.154 131.363 126.848 1.00 0.00 H TER 45405 WAT 3931 ATOM 45405 O WAT 3932 124.180 94.959 56.981 1.00 0.00 O ATOM 45406 H1 WAT 3932 124.837 95.362 57.549 1.00 0.00 H ATOM 45407 H2 WAT 3932 124.331 94.018 57.070 1.00 0.00 H TER 45409 WAT 3932 ATOM 45409 O WAT 3933 141.876 113.305 18.076 1.00 0.00 O ATOM 45410 H1 WAT 3933 141.611 112.895 17.252 1.00 0.00 H ATOM 45411 H2 WAT 3933 142.814 113.126 18.141 1.00 0.00 H TER 45413 WAT 3933 ATOM 45413 O WAT 3934 55.039 106.450 111.782 1.00 0.00 O ATOM 45414 H1 WAT 3934 55.927 106.512 111.431 1.00 0.00 H ATOM 45415 H2 WAT 3934 54.550 107.130 111.319 1.00 0.00 H TER 45417 WAT 3934 ATOM 45417 O WAT 3935 64.444 23.234 84.268 1.00 0.00 O ATOM 45418 H1 WAT 3935 65.180 22.799 83.839 1.00 0.00 H ATOM 45419 H2 WAT 3935 64.298 24.026 83.750 1.00 0.00 H TER 45421 WAT 3935 ATOM 45421 O WAT 3936 54.889 37.716 92.977 1.00 0.00 O ATOM 45422 H1 WAT 3936 54.070 37.224 93.020 1.00 0.00 H ATOM 45423 H2 WAT 3936 54.781 38.295 92.222 1.00 0.00 H TER 45425 WAT 3936 ATOM 45425 O WAT 3937 48.438 8.675 141.235 1.00 0.00 O ATOM 45426 H1 WAT 3937 47.838 8.443 141.945 1.00 0.00 H ATOM 45427 H2 WAT 3937 49.309 8.593 141.622 1.00 0.00 H TER 45429 WAT 3937 ATOM 45429 O WAT 3938 74.302 18.384 135.631 1.00 0.00 O ATOM 45430 H1 WAT 3938 73.937 17.876 136.355 1.00 0.00 H ATOM 45431 H2 WAT 3938 75.179 18.628 135.929 1.00 0.00 H TER 45433 WAT 3938 ATOM 45433 O WAT 3939 126.958 44.313 77.746 1.00 0.00 O ATOM 45434 H1 WAT 3939 127.720 43.734 77.777 1.00 0.00 H ATOM 45435 H2 WAT 3939 127.095 44.928 78.467 1.00 0.00 H TER 45437 WAT 3939 ATOM 45437 O WAT 3940 53.406 145.581 105.895 1.00 0.00 O ATOM 45438 H1 WAT 3940 53.361 145.201 105.017 1.00 0.00 H ATOM 45439 H2 WAT 3940 54.318 145.855 105.991 1.00 0.00 H TER 45441 WAT 3940 ATOM 45441 O WAT 3941 138.357 54.026 107.466 1.00 0.00 O ATOM 45442 H1 WAT 3941 137.568 54.567 107.447 1.00 0.00 H ATOM 45443 H2 WAT 3941 139.041 54.611 107.792 1.00 0.00 H TER 45445 WAT 3941 ATOM 45445 O WAT 3942 73.074 63.331 98.026 1.00 0.00 O ATOM 45446 H1 WAT 3942 73.056 63.630 98.935 1.00 0.00 H ATOM 45447 H2 WAT 3942 73.976 63.477 97.744 1.00 0.00 H TER 45449 WAT 3942 ATOM 45449 O WAT 3943 8.274 95.972 81.284 1.00 0.00 O ATOM 45450 H1 WAT 3943 7.661 96.707 81.240 1.00 0.00 H ATOM 45451 H2 WAT 3943 9.032 96.320 81.753 1.00 0.00 H TER 45453 WAT 3943 ATOM 45453 O WAT 3944 76.462 15.439 132.096 1.00 0.00 O ATOM 45454 H1 WAT 3944 76.021 15.416 132.945 1.00 0.00 H ATOM 45455 H2 WAT 3944 75.828 15.849 131.507 1.00 0.00 H TER 45457 WAT 3944 ATOM 45457 O WAT 3945 129.407 111.680 13.178 1.00 0.00 O ATOM 45458 H1 WAT 3945 129.867 111.816 12.350 1.00 0.00 H ATOM 45459 H2 WAT 3945 129.458 110.735 13.327 1.00 0.00 H TER 45461 WAT 3945 ATOM 45461 O WAT 3946 133.409 117.903 125.942 1.00 0.00 O ATOM 45462 H1 WAT 3946 133.880 118.300 126.674 1.00 0.00 H ATOM 45463 H2 WAT 3946 133.531 118.517 125.217 1.00 0.00 H TER 45465 WAT 3946 ATOM 45465 O WAT 3947 36.347 85.929 16.737 1.00 0.00 O ATOM 45466 H1 WAT 3947 36.668 86.319 15.924 1.00 0.00 H ATOM 45467 H2 WAT 3947 36.196 86.676 17.317 1.00 0.00 H TER 45469 WAT 3947 ATOM 45469 O WAT 3948 77.875 101.429 67.513 1.00 0.00 O ATOM 45470 H1 WAT 3948 77.142 101.068 68.011 1.00 0.00 H ATOM 45471 H2 WAT 3948 78.585 101.502 68.150 1.00 0.00 H TER 45473 WAT 3948 ATOM 45473 O WAT 3949 61.267 30.911 0.676 1.00 0.00 O ATOM 45474 H1 WAT 3949 61.773 30.395 0.048 1.00 0.00 H ATOM 45475 H2 WAT 3949 60.495 31.195 0.186 1.00 0.00 H TER 45477 WAT 3949 ATOM 45477 O WAT 3950 112.355 49.184 112.054 1.00 0.00 O ATOM 45478 H1 WAT 3950 111.603 49.558 111.596 1.00 0.00 H ATOM 45479 H2 WAT 3950 113.074 49.787 111.866 1.00 0.00 H TER 45481 WAT 3950 ATOM 45481 O WAT 3951 63.558 111.297 126.779 1.00 0.00 O ATOM 45482 H1 WAT 3951 63.817 111.751 125.977 1.00 0.00 H ATOM 45483 H2 WAT 3951 63.436 111.996 127.421 1.00 0.00 H TER 45485 WAT 3951 ATOM 45485 O WAT 3952 72.671 31.370 91.354 1.00 0.00 O ATOM 45486 H1 WAT 3952 73.444 31.932 91.411 1.00 0.00 H ATOM 45487 H2 WAT 3952 72.758 30.769 92.094 1.00 0.00 H TER 45489 WAT 3952 ATOM 45489 O WAT 3953 143.226 18.752 103.605 1.00 0.00 O ATOM 45490 H1 WAT 3953 142.432 18.296 103.884 1.00 0.00 H ATOM 45491 H2 WAT 3953 143.757 18.074 103.186 1.00 0.00 H TER 45493 WAT 3953 ATOM 45493 O WAT 3954 81.628 136.929 5.468 1.00 0.00 O ATOM 45494 H1 WAT 3954 80.870 137.413 5.140 1.00 0.00 H ATOM 45495 H2 WAT 3954 82.062 137.540 6.064 1.00 0.00 H TER 45497 WAT 3954 ATOM 45497 O WAT 3955 132.323 131.812 13.312 1.00 0.00 O ATOM 45498 H1 WAT 3955 132.829 132.220 14.014 1.00 0.00 H ATOM 45499 H2 WAT 3955 132.874 131.092 13.007 1.00 0.00 H TER 45501 WAT 3955 ATOM 45501 O WAT 3956 49.528 109.545 96.969 1.00 0.00 O ATOM 45502 H1 WAT 3956 48.721 109.912 96.608 1.00 0.00 H ATOM 45503 H2 WAT 3956 50.048 109.308 96.202 1.00 0.00 H TER 45505 WAT 3956 ATOM 45505 O WAT 3957 142.721 89.680 18.666 1.00 0.00 O ATOM 45506 H1 WAT 3957 142.884 89.019 19.339 1.00 0.00 H ATOM 45507 H2 WAT 3957 141.856 89.460 18.319 1.00 0.00 H TER 45509 WAT 3957 ATOM 45509 O WAT 3958 17.262 133.737 21.577 1.00 0.00 O ATOM 45510 H1 WAT 3958 18.193 133.516 21.561 1.00 0.00 H ATOM 45511 H2 WAT 3958 17.103 134.040 22.471 1.00 0.00 H TER 45513 WAT 3958 ATOM 45513 O WAT 3959 37.944 52.374 119.619 1.00 0.00 O ATOM 45514 H1 WAT 3959 38.285 51.481 119.575 1.00 0.00 H ATOM 45515 H2 WAT 3959 37.712 52.587 118.715 1.00 0.00 H TER 45517 WAT 3959 ATOM 45517 O WAT 3960 68.720 108.845 153.749 1.00 0.00 O ATOM 45518 H1 WAT 3960 67.833 109.202 153.787 1.00 0.00 H ATOM 45519 H2 WAT 3960 69.233 109.417 154.320 1.00 0.00 H TER 45521 WAT 3960 ATOM 45521 O WAT 3961 99.974 35.395 79.071 1.00 0.00 O ATOM 45522 H1 WAT 3961 100.612 34.941 79.622 1.00 0.00 H ATOM 45523 H2 WAT 3961 99.633 34.716 78.490 1.00 0.00 H TER 45525 WAT 3961 ATOM 45525 O WAT 3962 122.751 81.913 87.066 1.00 0.00 O ATOM 45526 H1 WAT 3962 123.481 81.666 87.633 1.00 0.00 H ATOM 45527 H2 WAT 3962 122.276 82.578 87.564 1.00 0.00 H TER 45529 WAT 3962 ATOM 45529 O WAT 3963 134.640 138.164 157.650 1.00 0.00 O ATOM 45530 H1 WAT 3963 133.998 137.742 157.077 1.00 0.00 H ATOM 45531 H2 WAT 3963 134.671 137.605 158.427 1.00 0.00 H TER 45533 WAT 3963 ATOM 45533 O WAT 3964 66.744 57.577 68.675 1.00 0.00 O ATOM 45534 H1 WAT 3964 65.872 57.825 68.371 1.00 0.00 H ATOM 45535 H2 WAT 3964 67.293 58.335 68.472 1.00 0.00 H TER 45537 WAT 3964 ATOM 45537 O WAT 3965 76.097 42.752 17.079 1.00 0.00 O ATOM 45538 H1 WAT 3965 75.339 42.642 17.654 1.00 0.00 H ATOM 45539 H2 WAT 3965 76.848 42.749 17.672 1.00 0.00 H TER 45541 WAT 3965 ATOM 45541 O WAT 3966 74.789 78.775 17.832 1.00 0.00 O ATOM 45542 H1 WAT 3966 74.858 78.217 18.606 1.00 0.00 H ATOM 45543 H2 WAT 3966 75.089 78.221 17.110 1.00 0.00 H TER 45545 WAT 3966 ATOM 45545 O WAT 3967 68.877 115.909 15.719 1.00 0.00 O ATOM 45546 H1 WAT 3967 67.932 116.018 15.821 1.00 0.00 H ATOM 45547 H2 WAT 3967 69.258 116.531 16.338 1.00 0.00 H TER 45549 WAT 3967 ATOM 45549 O WAT 3968 118.348 34.036 134.911 1.00 0.00 O ATOM 45550 H1 WAT 3968 119.110 34.300 135.427 1.00 0.00 H ATOM 45551 H2 WAT 3968 117.604 34.436 135.361 1.00 0.00 H TER 45553 WAT 3968 ATOM 45553 O WAT 3969 140.189 28.262 140.302 1.00 0.00 O ATOM 45554 H1 WAT 3969 139.580 27.571 140.562 1.00 0.00 H ATOM 45555 H2 WAT 3969 139.743 28.717 139.587 1.00 0.00 H TER 45557 WAT 3969 ATOM 45557 O WAT 3970 129.152 12.418 21.087 1.00 0.00 O ATOM 45558 H1 WAT 3970 129.313 13.015 20.357 1.00 0.00 H ATOM 45559 H2 WAT 3970 129.954 12.454 21.608 1.00 0.00 H TER 45561 WAT 3970 ATOM 45561 O WAT 3971 16.342 77.023 154.998 1.00 0.00 O ATOM 45562 H1 WAT 3971 17.008 77.087 154.313 1.00 0.00 H ATOM 45563 H2 WAT 3971 16.669 76.342 155.586 1.00 0.00 H TER 45565 WAT 3971 ATOM 45565 O WAT 3972 17.178 8.410 124.550 1.00 0.00 O ATOM 45566 H1 WAT 3972 16.579 7.674 124.680 1.00 0.00 H ATOM 45567 H2 WAT 3972 17.670 8.182 123.761 1.00 0.00 H TER 45569 WAT 3972 ATOM 45569 O WAT 3973 15.500 43.482 144.073 1.00 0.00 O ATOM 45570 H1 WAT 3973 16.224 43.260 143.488 1.00 0.00 H ATOM 45571 H2 WAT 3973 15.901 43.535 144.941 1.00 0.00 H TER 45573 WAT 3973 ATOM 45573 O WAT 3974 32.017 65.797 124.242 1.00 0.00 O ATOM 45574 H1 WAT 3974 32.954 65.712 124.420 1.00 0.00 H ATOM 45575 H2 WAT 3974 31.669 66.261 125.003 1.00 0.00 H TER 45577 WAT 3974 ATOM 45577 O WAT 3975 53.501 8.023 68.866 1.00 0.00 O ATOM 45578 H1 WAT 3975 53.640 7.164 68.466 1.00 0.00 H ATOM 45579 H2 WAT 3975 54.383 8.354 69.035 1.00 0.00 H TER 45581 WAT 3975 ATOM 45581 O WAT 3976 141.063 71.573 65.509 1.00 0.00 O ATOM 45582 H1 WAT 3976 140.276 71.466 66.043 1.00 0.00 H ATOM 45583 H2 WAT 3976 140.956 70.944 64.796 1.00 0.00 H TER 45585 WAT 3976 ATOM 45585 O WAT 3977 11.625 61.947 93.433 1.00 0.00 O ATOM 45586 H1 WAT 3977 11.648 62.560 92.698 1.00 0.00 H ATOM 45587 H2 WAT 3977 11.079 61.224 93.126 1.00 0.00 H TER 45589 WAT 3977 ATOM 45589 O WAT 3978 82.630 124.049 70.615 1.00 0.00 O ATOM 45590 H1 WAT 3978 82.020 123.313 70.681 1.00 0.00 H ATOM 45591 H2 WAT 3978 82.337 124.534 69.844 1.00 0.00 H TER 45593 WAT 3978 ATOM 45593 O WAT 3979 43.866 88.330 86.128 1.00 0.00 O ATOM 45594 H1 WAT 3979 43.369 87.926 85.417 1.00 0.00 H ATOM 45595 H2 WAT 3979 44.775 88.089 85.952 1.00 0.00 H TER 45597 WAT 3979 ATOM 45597 O WAT 3980 117.389 43.232 113.503 1.00 0.00 O ATOM 45598 H1 WAT 3980 118.003 42.783 114.085 1.00 0.00 H ATOM 45599 H2 WAT 3980 117.228 44.074 113.929 1.00 0.00 H TER 45601 WAT 3980 ATOM 45601 O WAT 3981 58.769 125.948 22.268 1.00 0.00 O ATOM 45602 H1 WAT 3981 58.030 126.508 22.506 1.00 0.00 H ATOM 45603 H2 WAT 3981 58.825 126.018 21.315 1.00 0.00 H TER 45605 WAT 3981 ATOM 45605 O WAT 3982 29.443 17.384 155.892 1.00 0.00 O ATOM 45606 H1 WAT 3982 29.326 18.138 156.469 1.00 0.00 H ATOM 45607 H2 WAT 3982 29.566 16.644 156.487 1.00 0.00 H TER 45609 WAT 3982 ATOM 45609 O WAT 3983 12.330 122.413 154.734 1.00 0.00 O ATOM 45610 H1 WAT 3983 12.373 121.823 155.486 1.00 0.00 H ATOM 45611 H2 WAT 3983 13.240 122.663 154.573 1.00 0.00 H TER 45613 WAT 3983 ATOM 45613 O WAT 3984 138.006 31.366 129.870 1.00 0.00 O ATOM 45614 H1 WAT 3984 138.953 31.481 129.782 1.00 0.00 H ATOM 45615 H2 WAT 3984 137.639 31.801 129.101 1.00 0.00 H TER 45617 WAT 3984 ATOM 45617 O WAT 3985 65.212 144.043 18.303 1.00 0.00 O ATOM 45618 H1 WAT 3985 65.498 144.923 18.547 1.00 0.00 H ATOM 45619 H2 WAT 3985 66.010 143.515 18.333 1.00 0.00 H TER 45621 WAT 3985 ATOM 45621 O WAT 3986 45.279 41.345 132.214 1.00 0.00 O ATOM 45622 H1 WAT 3986 45.042 41.464 133.134 1.00 0.00 H ATOM 45623 H2 WAT 3986 44.680 40.669 131.898 1.00 0.00 H TER 45625 WAT 3986 ATOM 45625 O WAT 3987 115.839 124.315 109.567 1.00 0.00 O ATOM 45626 H1 WAT 3987 115.369 123.638 110.053 1.00 0.00 H ATOM 45627 H2 WAT 3987 115.178 124.699 108.991 1.00 0.00 H TER 45629 WAT 3987 ATOM 45629 O WAT 3988 23.148 120.538 136.343 1.00 0.00 O ATOM 45630 H1 WAT 3988 22.358 120.025 136.175 1.00 0.00 H ATOM 45631 H2 WAT 3988 23.869 119.942 136.140 1.00 0.00 H TER 45633 WAT 3988 ATOM 45633 O WAT 3989 110.674 91.568 16.078 1.00 0.00 O ATOM 45634 H1 WAT 3989 110.655 90.625 16.243 1.00 0.00 H ATOM 45635 H2 WAT 3989 110.464 91.964 16.924 1.00 0.00 H TER 45637 WAT 3989 ATOM 45637 O WAT 3990 2.384 32.586 9.530 1.00 0.00 O ATOM 45638 H1 WAT 3990 3.264 32.950 9.621 1.00 0.00 H ATOM 45639 H2 WAT 3990 1.879 33.000 10.230 1.00 0.00 H TER 45641 WAT 3990 ATOM 45641 O WAT 3991 126.241 129.712 100.626 1.00 0.00 O ATOM 45642 H1 WAT 3991 126.073 129.252 99.803 1.00 0.00 H ATOM 45643 H2 WAT 3991 125.782 130.547 100.531 1.00 0.00 H TER 45645 WAT 3991 ATOM 45645 O WAT 3992 84.511 44.637 7.689 1.00 0.00 O ATOM 45646 H1 WAT 3992 84.872 45.111 6.939 1.00 0.00 H ATOM 45647 H2 WAT 3992 84.558 43.716 7.434 1.00 0.00 H TER 45649 WAT 3992 ATOM 45649 O WAT 3993 108.227 24.931 11.359 1.00 0.00 O ATOM 45650 H1 WAT 3993 108.676 24.299 11.920 1.00 0.00 H ATOM 45651 H2 WAT 3993 108.708 25.749 11.485 1.00 0.00 H TER 45653 WAT 3993 ATOM 45653 O WAT 3994 65.177 124.810 120.689 1.00 0.00 O ATOM 45654 H1 WAT 3994 65.044 124.164 121.382 1.00 0.00 H ATOM 45655 H2 WAT 3994 64.628 125.551 120.944 1.00 0.00 H TER 45657 WAT 3994 ATOM 45657 O WAT 3995 70.726 2.697 113.052 1.00 0.00 O ATOM 45658 H1 WAT 3995 71.493 3.212 112.802 1.00 0.00 H ATOM 45659 H2 WAT 3995 70.995 2.238 113.848 1.00 0.00 H TER 45661 WAT 3995 ATOM 45661 O WAT 3996 40.181 112.460 128.404 1.00 0.00 O ATOM 45662 H1 WAT 3996 40.510 111.672 127.971 1.00 0.00 H ATOM 45663 H2 WAT 3996 40.797 112.615 129.120 1.00 0.00 H TER 45665 WAT 3996 ATOM 45665 O WAT 3997 46.644 124.474 63.769 1.00 0.00 O ATOM 45666 H1 WAT 3997 46.075 123.720 63.611 1.00 0.00 H ATOM 45667 H2 WAT 3997 47.531 124.134 63.646 1.00 0.00 H TER 45669 WAT 3997 ATOM 45669 O WAT 3998 115.889 92.451 8.383 1.00 0.00 O ATOM 45670 H1 WAT 3998 116.478 92.400 9.136 1.00 0.00 H ATOM 45671 H2 WAT 3998 116.471 92.488 7.624 1.00 0.00 H TER 45673 WAT 3998 ATOM 45673 O WAT 3999 111.260 103.540 104.057 1.00 0.00 O ATOM 45674 H1 WAT 3999 111.924 103.040 103.583 1.00 0.00 H ATOM 45675 H2 WAT 3999 111.424 103.342 104.979 1.00 0.00 H TER 45677 WAT 3999 ATOM 45677 O WAT 4000 33.453 23.429 129.675 1.00 0.00 O ATOM 45678 H1 WAT 4000 33.401 24.371 129.508 1.00 0.00 H ATOM 45679 H2 WAT 4000 32.557 23.175 129.893 1.00 0.00 H TER 45681 WAT 4000 ATOM 45681 O WAT 4001 47.351 103.210 80.407 1.00 0.00 O ATOM 45682 H1 WAT 4001 46.675 103.491 79.790 1.00 0.00 H ATOM 45683 H2 WAT 4001 47.001 103.441 81.267 1.00 0.00 H TER 45685 WAT 4001 ATOM 45685 O WAT 4002 29.365 26.097 75.330 1.00 0.00 O ATOM 45686 H1 WAT 4002 28.591 25.687 74.945 1.00 0.00 H ATOM 45687 H2 WAT 4002 29.173 27.035 75.313 1.00 0.00 H TER 45689 WAT 4002 ATOM 45689 O WAT 4003 8.089 0.820 86.831 1.00 0.00 O ATOM 45690 H1 WAT 4003 7.386 1.124 87.406 1.00 0.00 H ATOM 45691 H2 WAT 4003 8.386 0.002 87.228 1.00 0.00 H TER 45693 WAT 4003 ATOM 45693 O WAT 4004 75.420 11.617 71.030 1.00 0.00 O ATOM 45694 H1 WAT 4004 75.429 11.243 70.149 1.00 0.00 H ATOM 45695 H2 WAT 4004 75.678 10.893 71.600 1.00 0.00 H TER 45697 WAT 4004 ATOM 45697 O WAT 4005 56.755 47.074 158.641 1.00 0.00 O ATOM 45698 H1 WAT 4005 56.845 47.996 158.881 1.00 0.00 H ATOM 45699 H2 WAT 4005 56.491 47.090 157.721 1.00 0.00 H TER 45701 WAT 4005 ATOM 45701 O WAT 4006 71.974 5.981 63.343 1.00 0.00 O ATOM 45702 H1 WAT 4006 71.736 5.365 64.036 1.00 0.00 H ATOM 45703 H2 WAT 4006 71.659 5.571 62.538 1.00 0.00 H TER 45705 WAT 4006 ATOM 45705 O WAT 4007 125.617 140.834 109.615 1.00 0.00 O ATOM 45706 H1 WAT 4007 125.177 140.228 109.019 1.00 0.00 H ATOM 45707 H2 WAT 4007 125.923 141.544 109.051 1.00 0.00 H TER 45709 WAT 4007 ATOM 45709 O WAT 4008 123.224 114.193 122.891 1.00 0.00 O ATOM 45710 H1 WAT 4008 123.314 113.248 123.007 1.00 0.00 H ATOM 45711 H2 WAT 4008 123.227 114.545 123.781 1.00 0.00 H TER 45713 WAT 4008 ATOM 45713 O WAT 4009 33.911 65.058 137.727 1.00 0.00 O ATOM 45714 H1 WAT 4009 34.251 64.374 137.151 1.00 0.00 H ATOM 45715 H2 WAT 4009 34.103 65.876 137.267 1.00 0.00 H TER 45717 WAT 4009 ATOM 45717 O WAT 4010 65.025 52.159 7.265 1.00 0.00 O ATOM 45718 H1 WAT 4010 65.697 51.972 7.920 1.00 0.00 H ATOM 45719 H2 WAT 4010 64.374 51.468 7.388 1.00 0.00 H TER 45721 WAT 4010 ATOM 45721 O WAT 4011 90.327 109.941 13.204 1.00 0.00 O ATOM 45722 H1 WAT 4011 90.565 110.781 13.597 1.00 0.00 H ATOM 45723 H2 WAT 4011 90.046 109.402 13.943 1.00 0.00 H TER 45725 WAT 4011 ATOM 45725 O WAT 4012 11.474 95.875 5.438 1.00 0.00 O ATOM 45726 H1 WAT 4012 11.633 96.055 6.365 1.00 0.00 H ATOM 45727 H2 WAT 4012 12.347 95.766 5.062 1.00 0.00 H TER 45729 WAT 4012 ATOM 45729 O WAT 4013 125.531 47.444 112.595 1.00 0.00 O ATOM 45730 H1 WAT 4013 125.815 46.643 113.035 1.00 0.00 H ATOM 45731 H2 WAT 4013 124.581 47.351 112.519 1.00 0.00 H TER 45733 WAT 4013 ATOM 45733 O WAT 4014 16.890 68.894 136.862 1.00 0.00 O ATOM 45734 H1 WAT 4014 17.429 68.261 136.387 1.00 0.00 H ATOM 45735 H2 WAT 4014 16.191 68.368 137.252 1.00 0.00 H TER 45737 WAT 4014 ATOM 45737 O WAT 4015 7.719 22.292 64.921 1.00 0.00 O ATOM 45738 H1 WAT 4015 7.288 22.582 64.117 1.00 0.00 H ATOM 45739 H2 WAT 4015 7.058 21.764 65.370 1.00 0.00 H TER 45741 WAT 4015 ATOM 45741 O WAT 4016 110.469 93.137 157.750 1.00 0.00 O ATOM 45742 H1 WAT 4016 110.227 92.422 157.162 1.00 0.00 H ATOM 45743 H2 WAT 4016 109.952 93.883 157.445 1.00 0.00 H TER 45745 WAT 4016 ATOM 45745 O WAT 4017 78.786 37.135 128.812 1.00 0.00 O ATOM 45746 H1 WAT 4017 77.951 37.282 129.258 1.00 0.00 H ATOM 45747 H2 WAT 4017 78.924 37.928 128.295 1.00 0.00 H TER 45749 WAT 4017 ATOM 45749 O WAT 4018 87.800 104.431 127.328 1.00 0.00 O ATOM 45750 H1 WAT 4018 87.416 104.219 128.179 1.00 0.00 H ATOM 45751 H2 WAT 4018 87.055 104.695 126.788 1.00 0.00 H TER 45753 WAT 4018 ATOM 45753 O WAT 4019 49.167 132.300 57.667 1.00 0.00 O ATOM 45754 H1 WAT 4019 48.760 131.510 57.314 1.00 0.00 H ATOM 45755 H2 WAT 4019 48.431 132.866 57.900 1.00 0.00 H TER 45757 WAT 4019 ATOM 45757 O WAT 4020 20.843 94.632 117.129 1.00 0.00 O ATOM 45758 H1 WAT 4020 20.694 93.918 116.509 1.00 0.00 H ATOM 45759 H2 WAT 4020 21.552 94.318 117.690 1.00 0.00 H TER 45761 WAT 4020 ATOM 45761 O WAT 4021 8.207 96.587 100.544 1.00 0.00 O ATOM 45762 H1 WAT 4021 7.771 97.150 99.904 1.00 0.00 H ATOM 45763 H2 WAT 4021 7.612 96.572 101.294 1.00 0.00 H TER 45765 WAT 4021 ATOM 45765 O WAT 4022 135.634 75.805 114.062 1.00 0.00 O ATOM 45766 H1 WAT 4022 134.854 75.993 113.540 1.00 0.00 H ATOM 45767 H2 WAT 4022 136.355 76.188 113.562 1.00 0.00 H TER 45769 WAT 4022 ATOM 45769 O WAT 4023 72.832 93.150 122.541 1.00 0.00 O ATOM 45770 H1 WAT 4023 73.303 93.946 122.296 1.00 0.00 H ATOM 45771 H2 WAT 4023 71.952 93.452 122.765 1.00 0.00 H TER 45773 WAT 4023 ATOM 45773 O WAT 4024 67.829 45.198 121.340 1.00 0.00 O ATOM 45774 H1 WAT 4024 68.153 44.932 120.480 1.00 0.00 H ATOM 45775 H2 WAT 4024 68.394 45.928 121.594 1.00 0.00 H TER 45777 WAT 4024 ATOM 45777 O WAT 4025 3.417 87.924 109.053 1.00 0.00 O ATOM 45778 H1 WAT 4025 4.273 87.677 109.404 1.00 0.00 H ATOM 45779 H2 WAT 4025 3.611 88.316 108.202 1.00 0.00 H TER 45781 WAT 4025 ATOM 45781 O WAT 4026 28.220 83.091 146.543 1.00 0.00 O ATOM 45782 H1 WAT 4026 28.471 83.954 146.214 1.00 0.00 H ATOM 45783 H2 WAT 4026 29.019 82.745 146.941 1.00 0.00 H TER 45785 WAT 4026 ATOM 45785 O WAT 4027 120.448 47.943 114.509 1.00 0.00 O ATOM 45786 H1 WAT 4027 120.385 46.994 114.617 1.00 0.00 H ATOM 45787 H2 WAT 4027 119.539 48.238 114.453 1.00 0.00 H TER 45789 WAT 4027 ATOM 45789 O WAT 4028 20.836 63.124 112.214 1.00 0.00 O ATOM 45790 H1 WAT 4028 20.796 63.923 112.740 1.00 0.00 H ATOM 45791 H2 WAT 4028 20.178 63.254 111.531 1.00 0.00 H TER 45793 WAT 4028 ATOM 45793 O WAT 4029 0.158 67.030 18.065 1.00 0.00 O ATOM 45794 H1 WAT 4029 -0.708 66.983 18.470 1.00 0.00 H ATOM 45795 H2 WAT 4029 0.701 66.442 18.591 1.00 0.00 H TER 45797 WAT 4029 ATOM 45797 O WAT 4030 62.114 51.332 132.400 1.00 0.00 O ATOM 45798 H1 WAT 4030 62.432 51.919 131.714 1.00 0.00 H ATOM 45799 H2 WAT 4030 62.820 50.696 132.516 1.00 0.00 H TER 45801 WAT 4030 ATOM 45801 O WAT 4031 1.803 87.692 15.057 1.00 0.00 O ATOM 45802 H1 WAT 4031 1.141 88.380 14.993 1.00 0.00 H ATOM 45803 H2 WAT 4031 1.370 86.987 15.539 1.00 0.00 H TER 45805 WAT 4031 ATOM 45805 O WAT 4032 81.042 107.313 52.849 1.00 0.00 O ATOM 45806 H1 WAT 4032 80.895 106.609 53.481 1.00 0.00 H ATOM 45807 H2 WAT 4032 80.457 108.016 53.133 1.00 0.00 H TER 45809 WAT 4032 ATOM 45809 O WAT 4033 52.561 104.262 79.811 1.00 0.00 O ATOM 45810 H1 WAT 4033 52.640 103.629 79.098 1.00 0.00 H ATOM 45811 H2 WAT 4033 53.217 103.985 80.451 1.00 0.00 H TER 45813 WAT 4033 ATOM 45813 O WAT 4034 139.035 94.950 113.156 1.00 0.00 O ATOM 45814 H1 WAT 4034 139.583 94.338 113.647 1.00 0.00 H ATOM 45815 H2 WAT 4034 138.930 95.701 113.741 1.00 0.00 H TER 45817 WAT 4034 ATOM 45817 O WAT 4035 84.817 31.573 83.563 1.00 0.00 O ATOM 45818 H1 WAT 4035 85.567 31.180 83.115 1.00 0.00 H ATOM 45819 H2 WAT 4035 84.914 32.513 83.413 1.00 0.00 H TER 45821 WAT 4035 ATOM 45821 O WAT 4036 17.878 45.298 104.435 1.00 0.00 O ATOM 45822 H1 WAT 4036 17.208 45.497 105.089 1.00 0.00 H ATOM 45823 H2 WAT 4036 18.187 44.422 104.667 1.00 0.00 H TER 45825 WAT 4036 ATOM 45825 O WAT 4037 106.391 20.081 110.706 1.00 0.00 O ATOM 45826 H1 WAT 4037 106.933 20.771 111.088 1.00 0.00 H ATOM 45827 H2 WAT 4037 106.442 19.361 111.335 1.00 0.00 H TER 45829 WAT 4037 ATOM 45829 O WAT 4038 53.046 23.245 134.014 1.00 0.00 O ATOM 45830 H1 WAT 4038 53.614 22.604 133.588 1.00 0.00 H ATOM 45831 H2 WAT 4038 53.628 23.730 134.598 1.00 0.00 H TER 45833 WAT 4038 ATOM 45833 O WAT 4039 139.718 87.053 112.501 1.00 0.00 O ATOM 45834 H1 WAT 4039 139.686 87.488 113.353 1.00 0.00 H ATOM 45835 H2 WAT 4039 140.636 87.116 112.234 1.00 0.00 H TER 45837 WAT 4039 ATOM 45837 O WAT 4040 61.482 3.079 147.291 1.00 0.00 O ATOM 45838 H1 WAT 4040 61.369 2.346 147.896 1.00 0.00 H ATOM 45839 H2 WAT 4040 62.409 3.052 147.053 1.00 0.00 H TER 45841 WAT 4040 ATOM 45841 O WAT 4041 118.673 47.273 60.901 1.00 0.00 O ATOM 45842 H1 WAT 4041 119.301 47.972 61.086 1.00 0.00 H ATOM 45843 H2 WAT 4041 117.838 47.608 61.228 1.00 0.00 H TER 45845 WAT 4041 ATOM 45845 O WAT 4042 29.378 68.735 135.905 1.00 0.00 O ATOM 45846 H1 WAT 4042 28.931 68.412 135.123 1.00 0.00 H ATOM 45847 H2 WAT 4042 30.309 68.657 135.698 1.00 0.00 H TER 45849 WAT 4042 ATOM 45849 O WAT 4043 87.391 137.909 59.073 1.00 0.00 O ATOM 45850 H1 WAT 4043 88.030 138.161 59.739 1.00 0.00 H ATOM 45851 H2 WAT 4043 86.576 138.325 59.354 1.00 0.00 H TER 45853 WAT 4043 ATOM 45853 O WAT 4044 143.293 39.336 82.475 1.00 0.00 O ATOM 45854 H1 WAT 4044 142.734 39.051 83.197 1.00 0.00 H ATOM 45855 H2 WAT 4044 142.875 38.976 81.692 1.00 0.00 H TER 45857 WAT 4044 ATOM 45857 O WAT 4045 131.577 94.049 109.325 1.00 0.00 O ATOM 45858 H1 WAT 4045 131.997 93.192 109.259 1.00 0.00 H ATOM 45859 H2 WAT 4045 132.196 94.651 108.910 1.00 0.00 H TER 45861 WAT 4045 ATOM 45861 O WAT 4046 62.385 91.757 26.713 1.00 0.00 O ATOM 45862 H1 WAT 4046 62.327 90.967 26.176 1.00 0.00 H ATOM 45863 H2 WAT 4046 61.616 92.271 26.469 1.00 0.00 H TER 45865 WAT 4046 ATOM 45865 O WAT 4047 29.812 89.584 148.667 1.00 0.00 O ATOM 45866 H1 WAT 4047 30.562 90.160 148.817 1.00 0.00 H ATOM 45867 H2 WAT 4047 29.179 90.130 148.202 1.00 0.00 H TER 45869 WAT 4047 ATOM 45869 O WAT 4048 31.719 98.152 145.184 1.00 0.00 O ATOM 45870 H1 WAT 4048 32.493 98.598 145.529 1.00 0.00 H ATOM 45871 H2 WAT 4048 31.288 98.808 144.637 1.00 0.00 H TER 45873 WAT 4048 ATOM 45873 O WAT 4049 93.292 25.507 90.491 1.00 0.00 O ATOM 45874 H1 WAT 4049 92.905 24.956 89.811 1.00 0.00 H ATOM 45875 H2 WAT 4049 93.551 26.306 90.034 1.00 0.00 H TER 45877 WAT 4049 ATOM 45877 O WAT 4050 75.523 103.551 53.002 1.00 0.00 O ATOM 45878 H1 WAT 4050 75.714 104.262 52.390 1.00 0.00 H ATOM 45879 H2 WAT 4050 74.967 103.953 53.669 1.00 0.00 H TER 45881 WAT 4050 ATOM 45881 O WAT 4051 90.771 88.138 114.922 1.00 0.00 O ATOM 45882 H1 WAT 4051 89.984 88.681 114.874 1.00 0.00 H ATOM 45883 H2 WAT 4051 90.442 87.239 114.914 1.00 0.00 H TER 45885 WAT 4051 ATOM 45885 O WAT 4052 117.782 83.973 9.639 1.00 0.00 O ATOM 45886 H1 WAT 4052 117.125 83.396 10.029 1.00 0.00 H ATOM 45887 H2 WAT 4052 118.164 83.456 8.930 1.00 0.00 H TER 45889 WAT 4052 ATOM 45889 O WAT 4053 132.886 64.780 111.297 1.00 0.00 O ATOM 45890 H1 WAT 4053 133.212 65.212 110.507 1.00 0.00 H ATOM 45891 H2 WAT 4053 132.374 65.454 111.744 1.00 0.00 H TER 45893 WAT 4053 ATOM 45893 O WAT 4054 15.127 27.556 95.666 1.00 0.00 O ATOM 45894 H1 WAT 4054 15.928 27.874 96.082 1.00 0.00 H ATOM 45895 H2 WAT 4054 15.427 26.893 95.044 1.00 0.00 H TER 45897 WAT 4054 ATOM 45897 O WAT 4055 51.391 138.691 125.294 1.00 0.00 O ATOM 45898 H1 WAT 4055 52.149 139.163 124.950 1.00 0.00 H ATOM 45899 H2 WAT 4055 50.659 138.986 124.752 1.00 0.00 H TER 45901 WAT 4055 ATOM 45901 O WAT 4056 99.326 104.005 139.207 1.00 0.00 O ATOM 45902 H1 WAT 4056 100.241 104.287 139.193 1.00 0.00 H ATOM 45903 H2 WAT 4056 98.867 104.658 138.679 1.00 0.00 H TER 45905 WAT 4056 ATOM 45905 O WAT 4057 120.776 64.803 9.339 1.00 0.00 O ATOM 45906 H1 WAT 4057 121.693 64.732 9.072 1.00 0.00 H ATOM 45907 H2 WAT 4057 120.425 65.514 8.804 1.00 0.00 H TER 45909 WAT 4057 ATOM 45909 O WAT 4058 97.663 16.276 75.397 1.00 0.00 O ATOM 45910 H1 WAT 4058 96.910 15.698 75.516 1.00 0.00 H ATOM 45911 H2 WAT 4058 98.206 15.831 74.746 1.00 0.00 H TER 45913 WAT 4058 ATOM 45913 O WAT 4059 62.945 75.625 23.735 1.00 0.00 O ATOM 45914 H1 WAT 4059 62.352 74.878 23.653 1.00 0.00 H ATOM 45915 H2 WAT 4059 62.661 76.071 24.532 1.00 0.00 H TER 45917 WAT 4059 ATOM 45917 O WAT 4060 86.887 129.436 158.819 1.00 0.00 O ATOM 45918 H1 WAT 4060 86.221 130.110 158.682 1.00 0.00 H ATOM 45919 H2 WAT 4060 87.687 129.812 158.453 1.00 0.00 H TER 45921 WAT 4060 ATOM 45921 O WAT 4061 118.037 133.858 13.757 1.00 0.00 O ATOM 45922 H1 WAT 4061 117.905 133.849 12.809 1.00 0.00 H ATOM 45923 H2 WAT 4061 117.226 134.229 14.107 1.00 0.00 H TER 45925 WAT 4061 ATOM 45925 O WAT 4062 114.794 128.240 155.605 1.00 0.00 O ATOM 45926 H1 WAT 4062 115.419 128.560 154.954 1.00 0.00 H ATOM 45927 H2 WAT 4062 114.553 127.367 155.297 1.00 0.00 H TER 45929 WAT 4062 ATOM 45929 O WAT 4063 55.234 133.529 141.701 1.00 0.00 O ATOM 45930 H1 WAT 4063 55.112 133.466 142.648 1.00 0.00 H ATOM 45931 H2 WAT 4063 54.351 133.652 141.353 1.00 0.00 H TER 45933 WAT 4063 ATOM 45933 O WAT 4064 121.471 67.853 71.928 1.00 0.00 O ATOM 45934 H1 WAT 4064 120.626 67.422 71.799 1.00 0.00 H ATOM 45935 H2 WAT 4064 121.555 67.935 72.878 1.00 0.00 H TER 45937 WAT 4064 ATOM 45937 O WAT 4065 68.012 89.675 124.521 1.00 0.00 O ATOM 45938 H1 WAT 4065 68.619 90.323 124.163 1.00 0.00 H ATOM 45939 H2 WAT 4065 68.510 89.233 125.208 1.00 0.00 H TER 45941 WAT 4065 ATOM 45941 O WAT 4066 73.329 41.522 67.650 1.00 0.00 O ATOM 45942 H1 WAT 4066 73.259 41.761 68.574 1.00 0.00 H ATOM 45943 H2 WAT 4066 74.270 41.435 67.497 1.00 0.00 H TER 45945 WAT 4066 ATOM 45945 O WAT 4067 111.041 66.086 131.022 1.00 0.00 O ATOM 45946 H1 WAT 4067 110.159 65.860 131.317 1.00 0.00 H ATOM 45947 H2 WAT 4067 111.388 65.270 130.659 1.00 0.00 H TER 45949 WAT 4067 ATOM 45949 O WAT 4068 73.155 44.608 116.033 1.00 0.00 O ATOM 45950 H1 WAT 4068 72.865 44.070 115.296 1.00 0.00 H ATOM 45951 H2 WAT 4068 74.096 44.714 115.897 1.00 0.00 H TER 45953 WAT 4068 ATOM 45953 O WAT 4069 31.528 131.926 138.169 1.00 0.00 O ATOM 45954 H1 WAT 4069 31.078 132.567 138.720 1.00 0.00 H ATOM 45955 H2 WAT 4069 31.334 131.082 138.577 1.00 0.00 H TER 45957 WAT 4069 ATOM 45957 O WAT 4070 50.064 73.926 98.322 1.00 0.00 O ATOM 45958 H1 WAT 4070 49.896 74.210 97.423 1.00 0.00 H ATOM 45959 H2 WAT 4070 50.888 73.441 98.270 1.00 0.00 H TER 45961 WAT 4070 ATOM 45961 O WAT 4071 100.161 30.586 141.821 1.00 0.00 O ATOM 45962 H1 WAT 4071 99.271 30.793 142.108 1.00 0.00 H ATOM 45963 H2 WAT 4071 100.644 31.405 141.929 1.00 0.00 H TER 45965 WAT 4071 ATOM 45965 O WAT 4072 3.223 82.755 108.828 1.00 0.00 O ATOM 45966 H1 WAT 4072 3.768 83.090 108.116 1.00 0.00 H ATOM 45967 H2 WAT 4072 2.326 82.848 108.507 1.00 0.00 H TER 45969 WAT 4072 ATOM 45969 O WAT 4073 56.942 118.168 92.729 1.00 0.00 O ATOM 45970 H1 WAT 4073 57.706 117.595 92.793 1.00 0.00 H ATOM 45971 H2 WAT 4073 57.201 118.844 92.103 1.00 0.00 H TER 45973 WAT 4073 ATOM 45973 O WAT 4074 14.304 68.362 75.506 1.00 0.00 O ATOM 45974 H1 WAT 4074 14.547 68.130 76.403 1.00 0.00 H ATOM 45975 H2 WAT 4074 14.891 67.842 74.957 1.00 0.00 H TER 45977 WAT 4074 ATOM 45977 O WAT 4075 26.380 143.939 127.547 1.00 0.00 O ATOM 45978 H1 WAT 4075 26.475 142.995 127.417 1.00 0.00 H ATOM 45979 H2 WAT 4075 26.680 144.089 128.444 1.00 0.00 H TER 45981 WAT 4075 ATOM 45981 O WAT 4076 119.090 73.516 148.197 1.00 0.00 O ATOM 45982 H1 WAT 4076 119.147 72.861 147.501 1.00 0.00 H ATOM 45983 H2 WAT 4076 118.502 73.127 148.844 1.00 0.00 H TER 45985 WAT 4076 ATOM 45985 O WAT 4077 125.323 91.308 126.995 1.00 0.00 O ATOM 45986 H1 WAT 4077 124.580 91.562 126.447 1.00 0.00 H ATOM 45987 H2 WAT 4077 125.319 90.351 126.975 1.00 0.00 H TER 45989 WAT 4077 ATOM 45989 O WAT 4078 5.517 105.802 130.765 1.00 0.00 O ATOM 45990 H1 WAT 4078 6.055 105.723 131.553 1.00 0.00 H ATOM 45991 H2 WAT 4078 4.701 106.197 131.071 1.00 0.00 H TER 45993 WAT 4078 ATOM 45993 O WAT 4079 56.060 131.748 95.392 1.00 0.00 O ATOM 45994 H1 WAT 4079 55.568 131.367 94.665 1.00 0.00 H ATOM 45995 H2 WAT 4079 56.659 132.369 94.977 1.00 0.00 H TER 45997 WAT 4079 ATOM 45997 O WAT 4080 27.118 89.708 87.622 1.00 0.00 O ATOM 45998 H1 WAT 4080 27.695 88.944 87.631 1.00 0.00 H ATOM 45999 H2 WAT 4080 26.316 89.406 88.050 1.00 0.00 H TER 46001 WAT 4080 ATOM 46001 O WAT 4081 101.713 21.969 130.304 1.00 0.00 O ATOM 46002 H1 WAT 4081 102.065 21.229 129.809 1.00 0.00 H ATOM 46003 H2 WAT 4081 101.333 21.574 131.088 1.00 0.00 H TER 46005 WAT 4081 ATOM 46005 O WAT 4082 62.991 98.520 151.501 1.00 0.00 O ATOM 46006 H1 WAT 4082 63.898 98.216 151.448 1.00 0.00 H ATOM 46007 H2 WAT 4082 63.058 99.475 151.508 1.00 0.00 H TER 46009 WAT 4082 ATOM 46009 O WAT 4083 56.727 67.956 2.204 1.00 0.00 O ATOM 46010 H1 WAT 4083 55.855 68.089 1.833 1.00 0.00 H ATOM 46011 H2 WAT 4083 56.698 68.402 3.050 1.00 0.00 H TER 46013 WAT 4083 ATOM 46013 O WAT 4084 122.765 0.943 112.736 1.00 0.00 O ATOM 46014 H1 WAT 4084 122.267 1.577 112.220 1.00 0.00 H ATOM 46015 H2 WAT 4084 122.862 1.356 113.595 1.00 0.00 H TER 46017 WAT 4084 ATOM 46017 O WAT 4085 92.143 3.169 109.525 1.00 0.00 O ATOM 46018 H1 WAT 4085 91.671 4.001 109.565 1.00 0.00 H ATOM 46019 H2 WAT 4085 92.291 3.023 108.590 1.00 0.00 H TER 46021 WAT 4085 ATOM 46021 O WAT 4086 11.125 79.040 17.773 1.00 0.00 O ATOM 46022 H1 WAT 4086 10.810 78.145 17.648 1.00 0.00 H ATOM 46023 H2 WAT 4086 10.390 79.497 18.182 1.00 0.00 H TER 46025 WAT 4086 ATOM 46025 O WAT 4087 61.591 119.685 145.461 1.00 0.00 O ATOM 46026 H1 WAT 4087 61.354 120.094 146.293 1.00 0.00 H ATOM 46027 H2 WAT 4087 60.796 119.743 144.931 1.00 0.00 H TER 46029 WAT 4087 ATOM 46029 O WAT 4088 61.057 55.958 94.513 1.00 0.00 O ATOM 46030 H1 WAT 4088 61.962 55.766 94.267 1.00 0.00 H ATOM 46031 H2 WAT 4088 60.566 55.180 94.248 1.00 0.00 H TER 46033 WAT 4088 ATOM 46033 O WAT 4089 40.436 137.622 71.504 1.00 0.00 O ATOM 46034 H1 WAT 4089 40.565 136.934 70.850 1.00 0.00 H ATOM 46035 H2 WAT 4089 41.299 138.025 71.599 1.00 0.00 H TER 46037 WAT 4089 ATOM 46037 O WAT 4090 24.455 22.509 90.410 1.00 0.00 O ATOM 46038 H1 WAT 4090 24.107 22.723 89.544 1.00 0.00 H ATOM 46039 H2 WAT 4090 24.630 23.359 90.814 1.00 0.00 H TER 46041 WAT 4090 ATOM 46041 O WAT 4091 108.797 101.206 156.223 1.00 0.00 O ATOM 46042 H1 WAT 4091 108.078 100.794 156.703 1.00 0.00 H ATOM 46043 H2 WAT 4091 108.381 101.912 155.728 1.00 0.00 H TER 46045 WAT 4091 ATOM 46045 O WAT 4092 131.282 137.994 11.539 1.00 0.00 O ATOM 46046 H1 WAT 4092 130.844 138.817 11.756 1.00 0.00 H ATOM 46047 H2 WAT 4092 131.988 137.922 12.182 1.00 0.00 H TER 46049 WAT 4092 ATOM 46049 O WAT 4093 72.510 30.799 125.869 1.00 0.00 O ATOM 46050 H1 WAT 4093 71.904 31.165 126.513 1.00 0.00 H ATOM 46051 H2 WAT 4093 73.307 30.616 126.367 1.00 0.00 H TER 46053 WAT 4093 ATOM 46053 O WAT 4094 27.387 108.477 14.385 1.00 0.00 O ATOM 46054 H1 WAT 4094 26.674 108.340 15.009 1.00 0.00 H ATOM 46055 H2 WAT 4094 27.048 108.136 13.557 1.00 0.00 H TER 46057 WAT 4094 ATOM 46057 O WAT 4095 22.413 8.363 112.718 1.00 0.00 O ATOM 46058 H1 WAT 4095 22.978 7.591 112.754 1.00 0.00 H ATOM 46059 H2 WAT 4095 22.681 8.819 111.920 1.00 0.00 H TER 46061 WAT 4095 ATOM 46061 O WAT 4096 31.486 33.664 152.648 1.00 0.00 O ATOM 46062 H1 WAT 4096 32.433 33.681 152.785 1.00 0.00 H ATOM 46063 H2 WAT 4096 31.369 33.969 151.749 1.00 0.00 H TER 46065 WAT 4096 ATOM 46065 O WAT 4097 5.738 52.989 126.543 1.00 0.00 O ATOM 46066 H1 WAT 4097 6.684 52.861 126.471 1.00 0.00 H ATOM 46067 H2 WAT 4097 5.611 53.349 127.421 1.00 0.00 H TER 46069 WAT 4097 ATOM 46069 O WAT 4098 59.767 27.114 71.440 1.00 0.00 O ATOM 46070 H1 WAT 4098 59.377 26.812 70.620 1.00 0.00 H ATOM 46071 H2 WAT 4098 59.254 26.680 72.123 1.00 0.00 H TER 46073 WAT 4098 ATOM 46073 O WAT 4099 34.491 46.438 98.939 1.00 0.00 O ATOM 46074 H1 WAT 4099 35.393 46.328 98.639 1.00 0.00 H ATOM 46075 H2 WAT 4099 33.956 46.130 98.208 1.00 0.00 H TER 46077 WAT 4099 ATOM 46077 O WAT 4100 114.387 0.466 15.720 1.00 0.00 O ATOM 46078 H1 WAT 4100 115.074 1.120 15.852 1.00 0.00 H ATOM 46079 H2 WAT 4100 114.511 -0.159 16.435 1.00 0.00 H TER 46081 WAT 4100 ATOM 46081 O WAT 4101 130.298 7.947 71.742 1.00 0.00 O ATOM 46082 H1 WAT 4101 130.054 7.382 71.008 1.00 0.00 H ATOM 46083 H2 WAT 4101 129.959 7.495 72.515 1.00 0.00 H TER 46085 WAT 4101 ATOM 46085 O WAT 4102 3.224 31.030 103.165 1.00 0.00 O ATOM 46086 H1 WAT 4102 3.203 31.987 103.135 1.00 0.00 H ATOM 46087 H2 WAT 4102 4.078 30.821 103.543 1.00 0.00 H TER 46089 WAT 4102 ATOM 46089 O WAT 4103 45.387 11.697 97.898 1.00 0.00 O ATOM 46090 H1 WAT 4103 45.899 11.084 97.371 1.00 0.00 H ATOM 46091 H2 WAT 4103 46.039 12.179 98.406 1.00 0.00 H TER 46093 WAT 4103 ATOM 46093 O WAT 4104 59.708 79.898 152.272 1.00 0.00 O ATOM 46094 H1 WAT 4104 60.538 79.925 151.796 1.00 0.00 H ATOM 46095 H2 WAT 4104 59.339 79.041 152.061 1.00 0.00 H TER 46097 WAT 4104 ATOM 46097 O WAT 4105 59.806 29.968 129.753 1.00 0.00 O ATOM 46098 H1 WAT 4105 59.386 30.798 129.976 1.00 0.00 H ATOM 46099 H2 WAT 4105 59.296 29.632 129.015 1.00 0.00 H TER 46101 WAT 4105 ATOM 46101 O WAT 4106 50.598 57.144 142.917 1.00 0.00 O ATOM 46102 H1 WAT 4106 50.649 56.923 143.847 1.00 0.00 H ATOM 46103 H2 WAT 4106 51.280 56.614 142.506 1.00 0.00 H TER 46105 WAT 4106 ATOM 46105 O WAT 4107 69.068 110.890 85.008 1.00 0.00 O ATOM 46106 H1 WAT 4107 69.468 111.666 85.399 1.00 0.00 H ATOM 46107 H2 WAT 4107 69.737 110.548 84.415 1.00 0.00 H TER 46109 WAT 4107 ATOM 46109 O WAT 4108 59.581 15.707 99.256 1.00 0.00 O ATOM 46110 H1 WAT 4108 58.969 14.974 99.181 1.00 0.00 H ATOM 46111 H2 WAT 4108 59.021 16.474 99.377 1.00 0.00 H TER 46113 WAT 4108 ATOM 46113 O WAT 4109 26.033 100.209 101.276 1.00 0.00 O ATOM 46114 H1 WAT 4109 25.300 100.812 101.405 1.00 0.00 H ATOM 46115 H2 WAT 4109 26.665 100.451 101.953 1.00 0.00 H TER 46117 WAT 4109 ATOM 46117 O WAT 4110 99.040 118.000 121.609 1.00 0.00 O ATOM 46118 H1 WAT 4110 98.756 118.842 121.965 1.00 0.00 H ATOM 46119 H2 WAT 4110 98.350 117.756 120.992 1.00 0.00 H TER 46121 WAT 4110 ATOM 46121 O WAT 4111 139.615 120.785 150.828 1.00 0.00 O ATOM 46122 H1 WAT 4111 139.990 121.070 149.995 1.00 0.00 H ATOM 46123 H2 WAT 4111 138.944 121.438 151.025 1.00 0.00 H TER 46125 WAT 4111 ATOM 46125 O WAT 4112 81.188 111.384 120.097 1.00 0.00 O ATOM 46126 H1 WAT 4112 81.232 111.482 121.048 1.00 0.00 H ATOM 46127 H2 WAT 4112 80.750 110.543 119.963 1.00 0.00 H TER 46129 WAT 4112 ATOM 46129 O WAT 4113 86.643 100.719 93.444 1.00 0.00 O ATOM 46130 H1 WAT 4113 86.883 99.816 93.654 1.00 0.00 H ATOM 46131 H2 WAT 4113 87.430 101.089 93.044 1.00 0.00 H TER 46133 WAT 4113 ATOM 46133 O WAT 4114 139.155 73.375 147.263 1.00 0.00 O ATOM 46134 H1 WAT 4114 138.574 74.086 147.534 1.00 0.00 H ATOM 46135 H2 WAT 4114 138.565 72.653 147.047 1.00 0.00 H TER 46137 WAT 4114 ATOM 46137 O WAT 4115 114.465 135.325 66.162 1.00 0.00 O ATOM 46138 H1 WAT 4115 114.136 135.971 66.788 1.00 0.00 H ATOM 46139 H2 WAT 4115 114.702 135.839 65.391 1.00 0.00 H TER 46141 WAT 4115 ATOM 46141 O WAT 4116 80.561 35.585 82.460 1.00 0.00 O ATOM 46142 H1 WAT 4116 80.380 35.641 83.398 1.00 0.00 H ATOM 46143 H2 WAT 4116 79.738 35.840 82.042 1.00 0.00 H TER 46145 WAT 4116 ATOM 46145 O WAT 4117 93.311 34.433 76.503 1.00 0.00 O ATOM 46146 H1 WAT 4117 94.119 34.932 76.383 1.00 0.00 H ATOM 46147 H2 WAT 4117 92.803 34.604 75.710 1.00 0.00 H TER 46149 WAT 4117 ATOM 46149 O WAT 4118 28.406 60.182 86.773 1.00 0.00 O ATOM 46150 H1 WAT 4118 28.257 59.335 86.352 1.00 0.00 H ATOM 46151 H2 WAT 4118 29.043 59.997 87.463 1.00 0.00 H TER 46153 WAT 4118 ATOM 46153 O WAT 4119 70.302 71.307 83.043 1.00 0.00 O ATOM 46154 H1 WAT 4119 70.739 70.775 82.378 1.00 0.00 H ATOM 46155 H2 WAT 4119 70.982 71.484 83.693 1.00 0.00 H TER 46157 WAT 4119 ATOM 46157 O WAT 4120 12.108 59.459 85.254 1.00 0.00 O ATOM 46158 H1 WAT 4120 11.988 58.543 85.003 1.00 0.00 H ATOM 46159 H2 WAT 4120 11.326 59.673 85.762 1.00 0.00 H TER 46161 WAT 4120 ATOM 46161 O WAT 4121 2.761 106.422 77.599 1.00 0.00 O ATOM 46162 H1 WAT 4121 2.902 107.314 77.917 1.00 0.00 H ATOM 46163 H2 WAT 4121 2.374 106.536 76.731 1.00 0.00 H TER 46165 WAT 4121 ATOM 46165 O WAT 4122 74.396 114.728 114.799 1.00 0.00 O ATOM 46166 H1 WAT 4122 74.050 114.842 113.914 1.00 0.00 H ATOM 46167 H2 WAT 4122 73.855 115.300 115.343 1.00 0.00 H TER 46169 WAT 4122 ATOM 46169 O WAT 4123 21.335 125.959 134.838 1.00 0.00 O ATOM 46170 H1 WAT 4123 21.240 126.816 135.255 1.00 0.00 H ATOM 46171 H2 WAT 4123 21.437 126.156 133.907 1.00 0.00 H TER 46173 WAT 4123 ATOM 46173 O WAT 4124 64.364 118.240 138.827 1.00 0.00 O ATOM 46174 H1 WAT 4124 64.913 117.634 138.330 1.00 0.00 H ATOM 46175 H2 WAT 4124 63.729 117.677 139.272 1.00 0.00 H TER 46177 WAT 4124 ATOM 46177 O WAT 4125 91.257 12.870 59.119 1.00 0.00 O ATOM 46178 H1 WAT 4125 90.736 12.126 58.819 1.00 0.00 H ATOM 46179 H2 WAT 4125 90.612 13.507 59.426 1.00 0.00 H TER 46181 WAT 4125 ATOM 46181 O WAT 4126 90.926 4.746 116.648 1.00 0.00 O ATOM 46182 H1 WAT 4126 91.663 4.848 117.251 1.00 0.00 H ATOM 46183 H2 WAT 4126 90.916 3.812 116.439 1.00 0.00 H TER 46185 WAT 4126 ATOM 46185 O WAT 4127 77.139 51.013 3.725 1.00 0.00 O ATOM 46186 H1 WAT 4127 77.573 51.310 2.925 1.00 0.00 H ATOM 46187 H2 WAT 4127 76.233 51.308 3.629 1.00 0.00 H TER 46189 WAT 4127 ATOM 46189 O WAT 4128 37.028 119.064 2.748 1.00 0.00 O ATOM 46190 H1 WAT 4128 36.101 119.216 2.562 1.00 0.00 H ATOM 46191 H2 WAT 4128 37.332 119.884 3.137 1.00 0.00 H TER 46193 WAT 4128 ATOM 46193 O WAT 4129 130.319 109.104 22.430 1.00 0.00 O ATOM 46194 H1 WAT 4129 130.622 109.441 23.273 1.00 0.00 H ATOM 46195 H2 WAT 4129 130.475 108.161 22.478 1.00 0.00 H TER 46197 WAT 4129 ATOM 46197 O WAT 4130 81.631 60.703 156.700 1.00 0.00 O ATOM 46198 H1 WAT 4130 80.756 61.088 156.759 1.00 0.00 H ATOM 46199 H2 WAT 4130 82.003 61.076 155.901 1.00 0.00 H TER 46201 WAT 4130 ATOM 46201 O WAT 4131 122.152 65.505 11.859 1.00 0.00 O ATOM 46202 H1 WAT 4131 122.571 66.314 11.565 1.00 0.00 H ATOM 46203 H2 WAT 4131 122.584 65.300 12.688 1.00 0.00 H TER 46205 WAT 4131 ATOM 46205 O WAT 4132 3.507 144.308 93.904 1.00 0.00 O ATOM 46206 H1 WAT 4132 4.262 144.580 94.424 1.00 0.00 H ATOM 46207 H2 WAT 4132 3.827 144.298 93.003 1.00 0.00 H TER 46209 WAT 4132 ATOM 46209 O WAT 4133 134.089 52.016 80.416 1.00 0.00 O ATOM 46210 H1 WAT 4133 134.254 51.948 79.475 1.00 0.00 H ATOM 46211 H2 WAT 4133 134.669 51.363 80.808 1.00 0.00 H TER 46213 WAT 4133 ATOM 46213 O WAT 4134 10.192 97.276 71.315 1.00 0.00 O ATOM 46214 H1 WAT 4134 10.210 97.733 72.156 1.00 0.00 H ATOM 46215 H2 WAT 4134 9.518 97.730 70.810 1.00 0.00 H TER 46217 WAT 4134 ATOM 46217 O WAT 4135 51.992 70.956 129.895 1.00 0.00 O ATOM 46218 H1 WAT 4135 51.155 70.563 130.141 1.00 0.00 H ATOM 46219 H2 WAT 4135 52.485 71.001 130.714 1.00 0.00 H TER 46221 WAT 4135 ATOM 46221 O WAT 4136 32.913 27.486 5.752 1.00 0.00 O ATOM 46222 H1 WAT 4136 32.139 27.144 6.201 1.00 0.00 H ATOM 46223 H2 WAT 4136 33.341 28.043 6.401 1.00 0.00 H TER 46225 WAT 4136 ATOM 46225 O WAT 4137 31.643 8.819 130.705 1.00 0.00 O ATOM 46226 H1 WAT 4137 32.452 9.001 130.228 1.00 0.00 H ATOM 46227 H2 WAT 4137 31.935 8.505 131.561 1.00 0.00 H TER 46229 WAT 4137 ATOM 46229 O WAT 4138 53.135 116.744 128.773 1.00 0.00 O ATOM 46230 H1 WAT 4138 52.503 116.567 128.077 1.00 0.00 H ATOM 46231 H2 WAT 4138 52.681 116.495 129.578 1.00 0.00 H TER 46233 WAT 4138 ATOM 46233 O WAT 4139 5.989 119.400 131.754 1.00 0.00 O ATOM 46234 H1 WAT 4139 6.640 120.002 132.115 1.00 0.00 H ATOM 46235 H2 WAT 4139 6.448 118.562 131.688 1.00 0.00 H TER 46237 WAT 4139 ATOM 46237 O WAT 4140 19.426 69.217 147.231 1.00 0.00 O ATOM 46238 H1 WAT 4140 19.412 68.411 147.747 1.00 0.00 H ATOM 46239 H2 WAT 4140 18.563 69.607 147.373 1.00 0.00 H TER 46241 WAT 4140 ATOM 46241 O WAT 4141 75.884 108.433 63.402 1.00 0.00 O ATOM 46242 H1 WAT 4141 75.154 109.042 63.511 1.00 0.00 H ATOM 46243 H2 WAT 4141 75.709 107.733 64.031 1.00 0.00 H TER 46245 WAT 4141 ATOM 46245 O WAT 4142 17.497 55.357 98.031 1.00 0.00 O ATOM 46246 H1 WAT 4142 17.259 55.635 97.146 1.00 0.00 H ATOM 46247 H2 WAT 4142 17.727 54.432 97.937 1.00 0.00 H TER 46249 WAT 4142 ATOM 46249 O WAT 4143 109.993 125.734 65.710 1.00 0.00 O ATOM 46250 H1 WAT 4143 110.114 125.177 64.940 1.00 0.00 H ATOM 46251 H2 WAT 4143 109.734 125.129 66.405 1.00 0.00 H TER 46253 WAT 4143 ATOM 46253 O WAT 4144 16.130 42.005 141.820 1.00 0.00 O ATOM 46254 H1 WAT 4144 16.970 41.547 141.794 1.00 0.00 H ATOM 46255 H2 WAT 4144 16.212 42.695 141.162 1.00 0.00 H TER 46257 WAT 4144 ATOM 46257 O WAT 4145 108.499 32.661 25.638 1.00 0.00 O ATOM 46258 H1 WAT 4145 108.072 33.362 25.146 1.00 0.00 H ATOM 46259 H2 WAT 4145 108.392 31.884 25.091 1.00 0.00 H TER 46261 WAT 4145 ATOM 46261 O WAT 4146 119.711 102.394 59.659 1.00 0.00 O ATOM 46262 H1 WAT 4146 118.817 102.092 59.500 1.00 0.00 H ATOM 46263 H2 WAT 4146 120.000 101.896 60.424 1.00 0.00 H TER 46265 WAT 4146 ATOM 46265 O WAT 4147 21.557 75.124 74.772 1.00 0.00 O ATOM 46266 H1 WAT 4147 21.580 74.941 75.711 1.00 0.00 H ATOM 46267 H2 WAT 4147 22.327 74.676 74.422 1.00 0.00 H TER 46269 WAT 4147 ATOM 46269 O WAT 4148 105.609 61.205 134.704 1.00 0.00 O ATOM 46270 H1 WAT 4148 105.964 60.318 134.764 1.00 0.00 H ATOM 46271 H2 WAT 4148 104.699 61.119 134.987 1.00 0.00 H TER 46273 WAT 4148 ATOM 46273 O WAT 4149 138.568 103.796 146.369 1.00 0.00 O ATOM 46274 H1 WAT 4149 137.794 103.690 146.922 1.00 0.00 H ATOM 46275 H2 WAT 4149 138.606 102.989 145.855 1.00 0.00 H TER 46277 WAT 4149 ATOM 46277 O WAT 4150 4.212 35.953 119.599 1.00 0.00 O ATOM 46278 H1 WAT 4150 3.395 36.130 119.133 1.00 0.00 H ATOM 46279 H2 WAT 4150 3.946 35.836 120.511 1.00 0.00 H TER 46281 WAT 4150 ATOM 46281 O WAT 4151 64.677 37.724 156.116 1.00 0.00 O ATOM 46282 H1 WAT 4151 63.852 37.247 156.033 1.00 0.00 H ATOM 46283 H2 WAT 4151 64.512 38.369 156.804 1.00 0.00 H TER 46285 WAT 4151 ATOM 46285 O WAT 4152 6.048 12.577 82.198 1.00 0.00 O ATOM 46286 H1 WAT 4152 5.940 13.509 82.390 1.00 0.00 H ATOM 46287 H2 WAT 4152 6.283 12.549 81.271 1.00 0.00 H TER 46289 WAT 4152 ATOM 46289 O WAT 4153 22.896 28.542 0.835 1.00 0.00 O ATOM 46290 H1 WAT 4153 23.217 29.000 1.612 1.00 0.00 H ATOM 46291 H2 WAT 4153 23.629 28.569 0.221 1.00 0.00 H TER 46293 WAT 4153 ATOM 46293 O WAT 4154 113.159 93.650 87.544 1.00 0.00 O ATOM 46294 H1 WAT 4154 112.324 93.208 87.697 1.00 0.00 H ATOM 46295 H2 WAT 4154 112.933 94.580 87.501 1.00 0.00 H TER 46297 WAT 4154 ATOM 46297 O WAT 4155 83.293 109.743 91.878 1.00 0.00 O ATOM 46298 H1 WAT 4155 83.593 109.447 91.018 1.00 0.00 H ATOM 46299 H2 WAT 4155 83.560 109.046 92.477 1.00 0.00 H TER 46301 WAT 4155 ATOM 46301 O WAT 4156 63.453 125.529 105.030 1.00 0.00 O ATOM 46302 H1 WAT 4156 63.267 126.324 104.530 1.00 0.00 H ATOM 46303 H2 WAT 4156 64.395 125.396 104.925 1.00 0.00 H TER 46305 WAT 4156 ATOM 46305 O WAT 4157 94.306 48.387 4.994 1.00 0.00 O ATOM 46306 H1 WAT 4157 95.134 48.572 4.551 1.00 0.00 H ATOM 46307 H2 WAT 4157 94.383 48.829 5.840 1.00 0.00 H TER 46309 WAT 4157 ATOM 46309 O WAT 4158 131.605 56.993 7.223 1.00 0.00 O ATOM 46310 H1 WAT 4158 131.842 56.078 7.370 1.00 0.00 H ATOM 46311 H2 WAT 4158 131.924 57.451 8.001 1.00 0.00 H TER 46313 WAT 4158 ATOM 46313 O WAT 4159 94.040 100.839 80.246 1.00 0.00 O ATOM 46314 H1 WAT 4159 94.689 100.147 80.122 1.00 0.00 H ATOM 46315 H2 WAT 4159 94.483 101.489 80.791 1.00 0.00 H TER 46317 WAT 4159 ATOM 46317 O WAT 4160 145.378 62.322 100.254 1.00 0.00 O ATOM 46318 H1 WAT 4160 145.164 61.395 100.359 1.00 0.00 H ATOM 46319 H2 WAT 4160 145.266 62.694 101.129 1.00 0.00 H TER 46321 WAT 4160 ATOM 46321 O WAT 4161 86.682 60.615 158.551 1.00 0.00 O ATOM 46322 H1 WAT 4161 85.740 60.731 158.433 1.00 0.00 H ATOM 46323 H2 WAT 4161 86.813 59.667 158.511 1.00 0.00 H TER 46325 WAT 4161 ATOM 46325 O WAT 4162 44.736 125.441 77.297 1.00 0.00 O ATOM 46326 H1 WAT 4162 45.474 125.908 76.907 1.00 0.00 H ATOM 46327 H2 WAT 4162 43.962 125.840 76.900 1.00 0.00 H TER 46329 WAT 4162 ATOM 46329 O WAT 4163 132.272 141.719 154.002 1.00 0.00 O ATOM 46330 H1 WAT 4163 132.590 141.948 154.875 1.00 0.00 H ATOM 46331 H2 WAT 4163 131.553 141.107 154.162 1.00 0.00 H TER 46333 WAT 4163 ATOM 46333 O WAT 4164 39.090 126.240 95.328 1.00 0.00 O ATOM 46334 H1 WAT 4164 39.398 127.117 95.557 1.00 0.00 H ATOM 46335 H2 WAT 4164 38.207 126.379 94.985 1.00 0.00 H TER 46337 WAT 4164 ATOM 46337 O WAT 4165 105.271 96.332 134.036 1.00 0.00 O ATOM 46338 H1 WAT 4165 105.223 95.404 133.807 1.00 0.00 H ATOM 46339 H2 WAT 4165 105.750 96.350 134.865 1.00 0.00 H TER 46341 WAT 4165 ATOM 46341 O WAT 4166 105.551 43.262 17.187 1.00 0.00 O ATOM 46342 H1 WAT 4166 105.291 44.058 16.725 1.00 0.00 H ATOM 46343 H2 WAT 4166 105.416 42.560 16.550 1.00 0.00 H TER 46345 WAT 4166 ATOM 46345 O WAT 4167 69.221 79.949 117.615 1.00 0.00 O ATOM 46346 H1 WAT 4167 69.697 80.648 117.167 1.00 0.00 H ATOM 46347 H2 WAT 4167 68.492 79.743 117.030 1.00 0.00 H TER 46349 WAT 4167 ATOM 46349 O WAT 4168 62.856 108.952 133.654 1.00 0.00 O ATOM 46350 H1 WAT 4168 61.983 109.220 133.367 1.00 0.00 H ATOM 46351 H2 WAT 4168 62.799 108.000 133.735 1.00 0.00 H TER 46353 WAT 4168 ATOM 46353 O WAT 4169 31.557 0.560 158.406 1.00 0.00 O ATOM 46354 H1 WAT 4169 30.932 1.027 157.851 1.00 0.00 H ATOM 46355 H2 WAT 4169 32.015 -0.030 157.808 1.00 0.00 H TER 46357 WAT 4169 ATOM 46357 O WAT 4170 97.881 122.340 88.601 1.00 0.00 O ATOM 46358 H1 WAT 4170 98.286 121.805 87.918 1.00 0.00 H ATOM 46359 H2 WAT 4170 96.999 122.518 88.274 1.00 0.00 H TER 46361 WAT 4170 ATOM 46361 O WAT 4171 61.755 59.911 96.849 1.00 0.00 O ATOM 46362 H1 WAT 4171 61.127 59.210 97.025 1.00 0.00 H ATOM 46363 H2 WAT 4171 61.256 60.563 96.358 1.00 0.00 H TER 46365 WAT 4171 ATOM 46365 O WAT 4172 21.101 110.618 137.730 1.00 0.00 O ATOM 46366 H1 WAT 4172 20.203 110.314 137.861 1.00 0.00 H ATOM 46367 H2 WAT 4172 21.582 110.277 138.484 1.00 0.00 H TER 46369 WAT 4172 ATOM 46369 O WAT 4173 107.953 72.936 98.000 1.00 0.00 O ATOM 46370 H1 WAT 4173 107.462 72.304 98.525 1.00 0.00 H ATOM 46371 H2 WAT 4173 107.752 73.784 98.397 1.00 0.00 H TER 46373 WAT 4173 ATOM 46373 O WAT 4174 49.215 125.440 19.016 1.00 0.00 O ATOM 46374 H1 WAT 4174 48.320 125.107 18.947 1.00 0.00 H ATOM 46375 H2 WAT 4174 49.635 125.165 18.201 1.00 0.00 H TER 46377 WAT 4174 ATOM 46377 O WAT 4175 141.268 65.236 70.325 1.00 0.00 O ATOM 46378 H1 WAT 4175 140.425 65.657 70.492 1.00 0.00 H ATOM 46379 H2 WAT 4175 141.646 65.104 71.195 1.00 0.00 H TER 46381 WAT 4175 ATOM 46381 O WAT 4176 86.376 41.465 15.283 1.00 0.00 O ATOM 46382 H1 WAT 4176 85.827 41.840 15.971 1.00 0.00 H ATOM 46383 H2 WAT 4176 85.878 41.604 14.477 1.00 0.00 H TER 46385 WAT 4176 ATOM 46385 O WAT 4177 107.808 45.267 136.857 1.00 0.00 O ATOM 46386 H1 WAT 4177 107.569 44.997 135.971 1.00 0.00 H ATOM 46387 H2 WAT 4177 108.664 44.866 137.007 1.00 0.00 H TER 46389 WAT 4177 ATOM 46389 O WAT 4178 26.037 95.747 137.763 1.00 0.00 O ATOM 46390 H1 WAT 4178 26.046 95.431 138.666 1.00 0.00 H ATOM 46391 H2 WAT 4178 26.857 96.233 137.671 1.00 0.00 H TER 46393 WAT 4178 ATOM 46393 O WAT 4179 98.181 125.685 63.905 1.00 0.00 O ATOM 46394 H1 WAT 4179 98.885 125.039 63.849 1.00 0.00 H ATOM 46395 H2 WAT 4179 98.387 126.323 63.222 1.00 0.00 H TER 46397 WAT 4179 ATOM 46397 O WAT 4180 120.303 86.825 83.999 1.00 0.00 O ATOM 46398 H1 WAT 4180 120.381 86.414 83.138 1.00 0.00 H ATOM 46399 H2 WAT 4180 119.488 87.325 83.953 1.00 0.00 H TER 46401 WAT 4180 ATOM 46401 O WAT 4181 52.960 140.253 60.883 1.00 0.00 O ATOM 46402 H1 WAT 4181 53.749 140.237 60.341 1.00 0.00 H ATOM 46403 H2 WAT 4181 53.199 139.763 61.669 1.00 0.00 H TER 46405 WAT 4181 ATOM 46405 O WAT 4182 103.836 120.997 132.518 1.00 0.00 O ATOM 46406 H1 WAT 4182 103.091 121.297 133.038 1.00 0.00 H ATOM 46407 H2 WAT 4182 103.443 120.643 131.719 1.00 0.00 H TER 46409 WAT 4182 ATOM 46409 O WAT 4183 128.175 32.470 122.654 1.00 0.00 O ATOM 46410 H1 WAT 4183 127.280 32.698 122.907 1.00 0.00 H ATOM 46411 H2 WAT 4183 128.686 33.256 122.849 1.00 0.00 H TER 46413 WAT 4183 ATOM 46413 O WAT 4184 48.430 128.231 7.311 1.00 0.00 O ATOM 46414 H1 WAT 4184 47.979 128.630 6.567 1.00 0.00 H ATOM 46415 H2 WAT 4184 48.875 128.962 7.741 1.00 0.00 H TER 46417 WAT 4184 ATOM 46417 O WAT 4185 106.938 94.001 72.781 1.00 0.00 O ATOM 46418 H1 WAT 4185 106.847 93.049 72.751 1.00 0.00 H ATOM 46419 H2 WAT 4185 106.158 94.330 72.335 1.00 0.00 H TER 46421 WAT 4185 ATOM 46421 O WAT 4186 56.054 72.260 155.596 1.00 0.00 O ATOM 46422 H1 WAT 4186 55.663 71.547 155.090 1.00 0.00 H ATOM 46423 H2 WAT 4186 56.991 72.200 155.409 1.00 0.00 H TER 46425 WAT 4186 ATOM 46425 O WAT 4187 53.139 7.877 14.534 1.00 0.00 O ATOM 46426 H1 WAT 4187 53.844 7.562 13.968 1.00 0.00 H ATOM 46427 H2 WAT 4187 52.962 7.145 15.125 1.00 0.00 H TER 46429 WAT 4187 ATOM 46429 O WAT 4188 124.616 42.702 68.898 1.00 0.00 O ATOM 46430 H1 WAT 4188 123.883 43.117 69.353 1.00 0.00 H ATOM 46431 H2 WAT 4188 124.330 41.799 68.757 1.00 0.00 H TER 46433 WAT 4188 ATOM 46433 O WAT 4189 38.989 103.797 20.729 1.00 0.00 O ATOM 46434 H1 WAT 4189 38.184 104.134 21.122 1.00 0.00 H ATOM 46435 H2 WAT 4189 39.290 103.124 21.340 1.00 0.00 H TER 46437 WAT 4189 ATOM 46437 O WAT 4190 141.378 44.237 130.007 1.00 0.00 O ATOM 46438 H1 WAT 4190 141.691 44.053 130.893 1.00 0.00 H ATOM 46439 H2 WAT 4190 140.719 44.921 130.123 1.00 0.00 H TER 46441 WAT 4190 ATOM 46441 O WAT 4191 86.616 98.257 73.194 1.00 0.00 O ATOM 46442 H1 WAT 4191 86.437 97.424 73.630 1.00 0.00 H ATOM 46443 H2 WAT 4191 87.316 98.653 73.713 1.00 0.00 H TER 46445 WAT 4191 ATOM 46445 O WAT 4192 130.241 86.023 122.171 1.00 0.00 O ATOM 46446 H1 WAT 4192 130.362 85.074 122.188 1.00 0.00 H ATOM 46447 H2 WAT 4192 130.866 86.333 121.517 1.00 0.00 H TER 46449 WAT 4192 ATOM 46449 O WAT 4193 83.567 83.716 126.416 1.00 0.00 O ATOM 46450 H1 WAT 4193 83.838 84.426 126.997 1.00 0.00 H ATOM 46451 H2 WAT 4193 82.678 83.502 126.696 1.00 0.00 H TER 46453 WAT 4193 ATOM 46453 O WAT 4194 121.239 54.960 11.529 1.00 0.00 O ATOM 46454 H1 WAT 4194 120.735 55.301 10.790 1.00 0.00 H ATOM 46455 H2 WAT 4194 122.143 54.944 11.216 1.00 0.00 H TER 46457 WAT 4194 ATOM 46457 O WAT 4195 130.821 73.251 96.539 1.00 0.00 O ATOM 46458 H1 WAT 4195 130.340 74.054 96.739 1.00 0.00 H ATOM 46459 H2 WAT 4195 131.743 73.502 96.604 1.00 0.00 H TER 46461 WAT 4195 ATOM 46461 O WAT 4196 90.218 16.901 119.917 1.00 0.00 O ATOM 46462 H1 WAT 4196 90.619 17.695 119.562 1.00 0.00 H ATOM 46463 H2 WAT 4196 89.780 17.190 120.717 1.00 0.00 H TER 46465 WAT 4196 ATOM 46465 O WAT 4197 130.171 60.257 77.185 1.00 0.00 O ATOM 46466 H1 WAT 4197 129.867 61.139 77.399 1.00 0.00 H ATOM 46467 H2 WAT 4197 129.471 59.681 77.492 1.00 0.00 H TER 46469 WAT 4197 ATOM 46469 O WAT 4198 87.178 35.127 28.507 1.00 0.00 O ATOM 46470 H1 WAT 4198 87.591 34.308 28.234 1.00 0.00 H ATOM 46471 H2 WAT 4198 87.876 35.612 28.947 1.00 0.00 H TER 46473 WAT 4198 ATOM 46473 O WAT 4199 20.969 73.585 16.234 1.00 0.00 O ATOM 46474 H1 WAT 4199 21.120 72.677 15.972 1.00 0.00 H ATOM 46475 H2 WAT 4199 21.632 73.755 16.903 1.00 0.00 H TER 46477 WAT 4199 ATOM 46477 O WAT 4200 24.482 121.922 80.949 1.00 0.00 O ATOM 46478 H1 WAT 4200 25.131 121.234 81.093 1.00 0.00 H ATOM 46479 H2 WAT 4200 24.959 122.606 80.478 1.00 0.00 H TER 46481 WAT 4200 ATOM 46481 O WAT 4201 129.641 39.249 57.128 1.00 0.00 O ATOM 46482 H1 WAT 4201 130.377 39.096 57.720 1.00 0.00 H ATOM 46483 H2 WAT 4201 129.388 38.375 56.831 1.00 0.00 H TER 46485 WAT 4201 ATOM 46485 O WAT 4202 117.869 40.288 69.402 1.00 0.00 O ATOM 46486 H1 WAT 4202 117.728 39.699 70.144 1.00 0.00 H ATOM 46487 H2 WAT 4202 118.534 40.904 69.710 1.00 0.00 H TER 46489 WAT 4202 ATOM 46489 O WAT 4203 113.932 71.288 16.958 1.00 0.00 O ATOM 46490 H1 WAT 4203 114.064 70.421 17.342 1.00 0.00 H ATOM 46491 H2 WAT 4203 113.692 71.844 17.699 1.00 0.00 H TER 46493 WAT 4203 ATOM 46493 O WAT 4204 118.454 101.570 117.296 1.00 0.00 O ATOM 46494 H1 WAT 4204 118.193 101.870 116.425 1.00 0.00 H ATOM 46495 H2 WAT 4204 118.251 102.306 117.873 1.00 0.00 H TER 46497 WAT 4204 ATOM 46497 O WAT 4205 102.813 119.604 130.157 1.00 0.00 O ATOM 46498 H1 WAT 4205 103.373 119.553 129.383 1.00 0.00 H ATOM 46499 H2 WAT 4205 102.817 118.715 130.514 1.00 0.00 H TER 46501 WAT 4205 ATOM 46501 O WAT 4206 34.807 140.937 146.822 1.00 0.00 O ATOM 46502 H1 WAT 4206 34.852 140.001 147.015 1.00 0.00 H ATOM 46503 H2 WAT 4206 33.871 141.138 146.826 1.00 0.00 H TER 46505 WAT 4206 ATOM 46505 O WAT 4207 132.431 91.212 154.305 1.00 0.00 O ATOM 46506 H1 WAT 4207 132.742 92.088 154.073 1.00 0.00 H ATOM 46507 H2 WAT 4207 132.447 91.198 155.262 1.00 0.00 H TER 46509 WAT 4207 ATOM 46509 O WAT 4208 47.056 22.533 76.593 1.00 0.00 O ATOM 46510 H1 WAT 4208 47.590 23.314 76.453 1.00 0.00 H ATOM 46511 H2 WAT 4208 46.162 22.865 76.677 1.00 0.00 H TER 46513 WAT 4208 ATOM 46513 O WAT 4209 30.796 101.532 108.974 1.00 0.00 O ATOM 46514 H1 WAT 4209 30.863 100.824 108.334 1.00 0.00 H ATOM 46515 H2 WAT 4209 31.413 102.195 108.664 1.00 0.00 H TER 46517 WAT 4209 ATOM 46517 O WAT 4210 84.789 49.328 151.470 1.00 0.00 O ATOM 46518 H1 WAT 4210 84.400 49.265 150.598 1.00 0.00 H ATOM 46519 H2 WAT 4210 85.669 49.671 151.315 1.00 0.00 H TER 46521 WAT 4210 ATOM 46521 O WAT 4211 84.823 20.930 99.052 1.00 0.00 O ATOM 46522 H1 WAT 4211 84.427 20.319 98.431 1.00 0.00 H ATOM 46523 H2 WAT 4211 84.861 20.443 99.875 1.00 0.00 H TER 46525 WAT 4211 ATOM 46525 O WAT 4212 110.523 32.580 27.550 1.00 0.00 O ATOM 46526 H1 WAT 4212 109.718 32.600 27.034 1.00 0.00 H ATOM 46527 H2 WAT 4212 110.929 33.433 27.394 1.00 0.00 H TER 46529 WAT 4212 ATOM 46529 O WAT 4213 4.076 3.407 71.740 1.00 0.00 O ATOM 46530 H1 WAT 4213 4.433 3.972 71.054 1.00 0.00 H ATOM 46531 H2 WAT 4213 4.265 3.872 72.555 1.00 0.00 H TER 46533 WAT 4213 ATOM 46533 O WAT 4214 44.409 103.995 11.919 1.00 0.00 O ATOM 46534 H1 WAT 4214 43.979 103.758 12.740 1.00 0.00 H ATOM 46535 H2 WAT 4214 45.340 103.844 12.083 1.00 0.00 H TER 46537 WAT 4214 ATOM 46537 O WAT 4215 3.691 122.038 146.562 1.00 0.00 O ATOM 46538 H1 WAT 4215 3.560 121.095 146.470 1.00 0.00 H ATOM 46539 H2 WAT 4215 2.979 122.325 147.133 1.00 0.00 H TER 46541 WAT 4215 ATOM 46541 O WAT 4216 36.634 70.152 73.056 1.00 0.00 O ATOM 46542 H1 WAT 4216 37.536 70.096 73.372 1.00 0.00 H ATOM 46543 H2 WAT 4216 36.388 71.066 73.196 1.00 0.00 H TER 46545 WAT 4216 ATOM 46545 O WAT 4217 85.381 113.077 7.865 1.00 0.00 O ATOM 46546 H1 WAT 4217 85.851 113.814 7.474 1.00 0.00 H ATOM 46547 H2 WAT 4217 84.583 112.998 7.343 1.00 0.00 H TER 46549 WAT 4217 ATOM 46549 O WAT 4218 0.323 83.390 155.533 1.00 0.00 O ATOM 46550 H1 WAT 4218 -0.210 82.614 155.705 1.00 0.00 H ATOM 46551 H2 WAT 4218 1.212 83.052 155.427 1.00 0.00 H TER 46553 WAT 4218 ATOM 46553 O WAT 4219 101.708 105.368 85.908 1.00 0.00 O ATOM 46554 H1 WAT 4219 102.371 105.456 85.222 1.00 0.00 H ATOM 46555 H2 WAT 4219 102.201 105.431 86.726 1.00 0.00 H TER 46557 WAT 4219 ATOM 46557 O WAT 4220 76.496 80.661 25.224 1.00 0.00 O ATOM 46558 H1 WAT 4220 76.239 81.577 25.121 1.00 0.00 H ATOM 46559 H2 WAT 4220 75.904 80.320 25.895 1.00 0.00 H TER 46561 WAT 4220 ATOM 46561 O WAT 4221 55.047 79.277 143.793 1.00 0.00 O ATOM 46562 H1 WAT 4221 54.425 79.044 144.482 1.00 0.00 H ATOM 46563 H2 WAT 4221 54.723 80.111 143.451 1.00 0.00 H TER 46565 WAT 4221 ATOM 46565 O WAT 4222 80.636 17.751 138.773 1.00 0.00 O ATOM 46566 H1 WAT 4222 80.945 17.239 139.520 1.00 0.00 H ATOM 46567 H2 WAT 4222 81.280 18.454 138.682 1.00 0.00 H TER 46569 WAT 4222 ATOM 46569 O WAT 4223 45.006 52.936 8.380 1.00 0.00 O ATOM 46570 H1 WAT 4223 45.214 52.342 9.101 1.00 0.00 H ATOM 46571 H2 WAT 4223 45.761 52.876 7.795 1.00 0.00 H TER 46573 WAT 4223 ATOM 46573 O WAT 4224 4.823 45.608 16.667 1.00 0.00 O ATOM 46574 H1 WAT 4224 4.022 45.913 16.240 1.00 0.00 H ATOM 46575 H2 WAT 4224 5.143 44.905 16.102 1.00 0.00 H TER 46577 WAT 4224 ATOM 46577 O WAT 4225 4.640 44.596 81.806 1.00 0.00 O ATOM 46578 H1 WAT 4225 4.496 45.495 81.512 1.00 0.00 H ATOM 46579 H2 WAT 4225 5.571 44.561 82.023 1.00 0.00 H TER 46581 WAT 4225 ATOM 46581 O WAT 4226 11.698 138.935 15.805 1.00 0.00 O ATOM 46582 H1 WAT 4226 11.595 138.048 15.460 1.00 0.00 H ATOM 46583 H2 WAT 4226 10.830 139.167 16.133 1.00 0.00 H TER 46585 WAT 4226 ATOM 46585 O WAT 4227 94.699 97.990 109.935 1.00 0.00 O ATOM 46586 H1 WAT 4227 94.450 98.178 109.030 1.00 0.00 H ATOM 46587 H2 WAT 4227 93.954 97.508 110.293 1.00 0.00 H TER 46589 WAT 4227 ATOM 46589 O WAT 4228 109.267 24.088 19.888 1.00 0.00 O ATOM 46590 H1 WAT 4228 110.143 23.844 20.188 1.00 0.00 H ATOM 46591 H2 WAT 4228 108.812 24.369 20.682 1.00 0.00 H TER 46593 WAT 4228 ATOM 46593 O WAT 4229 44.553 40.059 17.872 1.00 0.00 O ATOM 46594 H1 WAT 4229 45.019 39.310 18.244 1.00 0.00 H ATOM 46595 H2 WAT 4229 44.241 40.549 18.633 1.00 0.00 H TER 46597 WAT 4229 ATOM 46597 O WAT 4230 45.832 122.659 77.561 1.00 0.00 O ATOM 46598 H1 WAT 4230 45.007 122.292 77.245 1.00 0.00 H ATOM 46599 H2 WAT 4230 45.706 123.607 77.514 1.00 0.00 H TER 46601 WAT 4230 ATOM 46601 O WAT 4231 126.669 36.357 140.074 1.00 0.00 O ATOM 46602 H1 WAT 4231 126.346 37.108 140.572 1.00 0.00 H ATOM 46603 H2 WAT 4231 127.616 36.489 140.029 1.00 0.00 H TER 46605 WAT 4231 ATOM 46605 O WAT 4232 128.632 76.417 5.472 1.00 0.00 O ATOM 46606 H1 WAT 4232 128.276 77.272 5.716 1.00 0.00 H ATOM 46607 H2 WAT 4232 129.482 76.379 5.910 1.00 0.00 H TER 46609 WAT 4232 ATOM 46609 O WAT 4233 98.440 25.756 130.702 1.00 0.00 O ATOM 46610 H1 WAT 4233 97.520 25.929 130.502 1.00 0.00 H ATOM 46611 H2 WAT 4233 98.489 24.805 130.800 1.00 0.00 H TER 46613 WAT 4233 ATOM 46613 O WAT 4234 78.855 137.515 126.982 1.00 0.00 O ATOM 46614 H1 WAT 4234 79.150 138.406 126.792 1.00 0.00 H ATOM 46615 H2 WAT 4234 78.308 137.606 127.762 1.00 0.00 H TER 46617 WAT 4234 ATOM 46617 O WAT 4235 71.997 25.229 113.914 1.00 0.00 O ATOM 46618 H1 WAT 4235 72.410 25.350 113.059 1.00 0.00 H ATOM 46619 H2 WAT 4235 72.218 26.022 114.401 1.00 0.00 H TER 46621 WAT 4235 ATOM 46621 O WAT 4236 89.787 17.828 141.024 1.00 0.00 O ATOM 46622 H1 WAT 4236 89.295 17.322 141.671 1.00 0.00 H ATOM 46623 H2 WAT 4236 89.209 18.556 140.798 1.00 0.00 H TER 46625 WAT 4236 ATOM 46625 O WAT 4237 107.842 105.982 75.425 1.00 0.00 O ATOM 46626 H1 WAT 4237 108.789 106.074 75.532 1.00 0.00 H ATOM 46627 H2 WAT 4237 107.720 105.074 75.149 1.00 0.00 H TER 46629 WAT 4237 ATOM 46629 O WAT 4238 97.371 89.594 125.112 1.00 0.00 O ATOM 46630 H1 WAT 4238 97.705 88.914 124.526 1.00 0.00 H ATOM 46631 H2 WAT 4238 97.334 90.381 124.569 1.00 0.00 H TER 46633 WAT 4238 ATOM 46633 O WAT 4239 126.181 97.406 102.421 1.00 0.00 O ATOM 46634 H1 WAT 4239 126.873 98.062 102.339 1.00 0.00 H ATOM 46635 H2 WAT 4239 125.719 97.645 103.225 1.00 0.00 H TER 46637 WAT 4239 ATOM 46637 O WAT 4240 141.926 62.159 64.509 1.00 0.00 O ATOM 46638 H1 WAT 4240 141.283 62.528 65.114 1.00 0.00 H ATOM 46639 H2 WAT 4240 141.590 62.379 63.640 1.00 0.00 H TER 46641 WAT 4240 ATOM 46641 O WAT 4241 30.387 7.266 19.009 1.00 0.00 O ATOM 46642 H1 WAT 4241 30.353 6.389 19.392 1.00 0.00 H ATOM 46643 H2 WAT 4241 29.499 7.420 18.685 1.00 0.00 H TER 46645 WAT 4241 ATOM 46645 O WAT 4242 12.321 112.802 10.976 1.00 0.00 O ATOM 46646 H1 WAT 4242 12.021 112.853 11.883 1.00 0.00 H ATOM 46647 H2 WAT 4242 11.517 112.791 10.457 1.00 0.00 H TER 46649 WAT 4242 ATOM 46649 O WAT 4243 65.861 31.496 155.880 1.00 0.00 O ATOM 46650 H1 WAT 4243 64.967 31.410 155.548 1.00 0.00 H ATOM 46651 H2 WAT 4243 66.173 30.596 155.966 1.00 0.00 H TER 46653 WAT 4243 ATOM 46653 O WAT 4244 70.584 143.802 151.953 1.00 0.00 O ATOM 46654 H1 WAT 4244 70.603 144.721 152.219 1.00 0.00 H ATOM 46655 H2 WAT 4244 70.006 143.785 151.190 1.00 0.00 H TER 46657 WAT 4244 ATOM 46657 O WAT 4245 6.025 108.662 66.354 1.00 0.00 O ATOM 46658 H1 WAT 4245 5.483 108.213 67.003 1.00 0.00 H ATOM 46659 H2 WAT 4245 5.636 109.533 66.278 1.00 0.00 H TER 46661 WAT 4245 ATOM 46661 O WAT 4246 129.042 95.221 90.064 1.00 0.00 O ATOM 46662 H1 WAT 4246 129.149 95.126 89.118 1.00 0.00 H ATOM 46663 H2 WAT 4246 129.327 94.381 90.423 1.00 0.00 H TER 46665 WAT 4246 ATOM 46665 O WAT 4247 110.636 4.904 125.988 1.00 0.00 O ATOM 46666 H1 WAT 4247 109.998 4.661 126.659 1.00 0.00 H ATOM 46667 H2 WAT 4247 110.400 5.800 125.748 1.00 0.00 H TER 46669 WAT 4247 ATOM 46669 O WAT 4248 141.575 17.578 60.119 1.00 0.00 O ATOM 46670 H1 WAT 4248 140.810 17.268 59.633 1.00 0.00 H ATOM 46671 H2 WAT 4248 141.791 18.418 59.715 1.00 0.00 H TER 46673 WAT 4248 ATOM 46673 O WAT 4249 116.867 23.723 110.834 1.00 0.00 O ATOM 46674 H1 WAT 4249 117.426 23.840 110.066 1.00 0.00 H ATOM 46675 H2 WAT 4249 116.623 24.612 111.091 1.00 0.00 H TER 46677 WAT 4249 ATOM 46677 O WAT 4250 80.719 1.242 156.817 1.00 0.00 O ATOM 46678 H1 WAT 4250 80.636 2.181 156.650 1.00 0.00 H ATOM 46679 H2 WAT 4250 81.426 1.174 157.457 1.00 0.00 H TER 46681 WAT 4250 ATOM 46681 O WAT 4251 144.063 54.805 71.734 1.00 0.00 O ATOM 46682 H1 WAT 4251 143.346 55.216 71.250 1.00 0.00 H ATOM 46683 H2 WAT 4251 143.848 53.872 71.734 1.00 0.00 H TER 46685 WAT 4251 ATOM 46685 O WAT 4252 64.420 42.347 126.566 1.00 0.00 O ATOM 46686 H1 WAT 4252 64.647 43.167 127.004 1.00 0.00 H ATOM 46687 H2 WAT 4252 63.490 42.224 126.754 1.00 0.00 H TER 46689 WAT 4252 ATOM 46689 O WAT 4253 24.216 34.917 90.190 1.00 0.00 O ATOM 46690 H1 WAT 4253 24.129 34.269 89.491 1.00 0.00 H ATOM 46691 H2 WAT 4253 23.319 35.203 90.364 1.00 0.00 H TER 46693 WAT 4253 ATOM 46693 O WAT 4254 128.628 94.364 112.599 1.00 0.00 O ATOM 46694 H1 WAT 4254 127.999 93.643 112.559 1.00 0.00 H ATOM 46695 H2 WAT 4254 128.476 94.767 113.454 1.00 0.00 H TER 46697 WAT 4254 ATOM 46697 O WAT 4255 103.889 142.985 150.031 1.00 0.00 O ATOM 46698 H1 WAT 4255 102.999 143.334 149.982 1.00 0.00 H ATOM 46699 H2 WAT 4255 104.050 142.613 149.164 1.00 0.00 H TER 46701 WAT 4255 ATOM 46701 O WAT 4256 43.204 40.741 4.666 1.00 0.00 O ATOM 46702 H1 WAT 4256 42.912 40.924 5.559 1.00 0.00 H ATOM 46703 H2 WAT 4256 44.113 41.042 4.645 1.00 0.00 H TER 46705 WAT 4256 ATOM 46705 O WAT 4257 43.736 19.667 116.111 1.00 0.00 O ATOM 46706 H1 WAT 4257 43.261 19.130 115.477 1.00 0.00 H ATOM 46707 H2 WAT 4257 44.044 19.045 116.769 1.00 0.00 H TER 46709 WAT 4257 ATOM 46709 O WAT 4258 122.964 116.719 69.537 1.00 0.00 O ATOM 46710 H1 WAT 4258 123.014 116.050 70.220 1.00 0.00 H ATOM 46711 H2 WAT 4258 122.046 116.992 69.536 1.00 0.00 H TER 46713 WAT 4258 ATOM 46713 O WAT 4259 9.015 108.540 2.715 1.00 0.00 O ATOM 46714 H1 WAT 4259 8.844 109.026 1.908 1.00 0.00 H ATOM 46715 H2 WAT 4259 8.180 108.548 3.181 1.00 0.00 H TER 46717 WAT 4259 ATOM 46717 O WAT 4260 11.171 54.375 91.723 1.00 0.00 O ATOM 46718 H1 WAT 4260 10.631 53.636 91.442 1.00 0.00 H ATOM 46719 H2 WAT 4260 11.446 54.795 90.908 1.00 0.00 H TER 46721 WAT 4260 ATOM 46721 O WAT 4261 18.880 56.320 138.362 1.00 0.00 O ATOM 46722 H1 WAT 4261 17.933 56.233 138.475 1.00 0.00 H ATOM 46723 H2 WAT 4261 19.250 55.604 138.879 1.00 0.00 H TER 46725 WAT 4261 ATOM 46725 O WAT 4262 132.757 136.335 135.528 1.00 0.00 O ATOM 46726 H1 WAT 4262 131.915 136.187 135.098 1.00 0.00 H ATOM 46727 H2 WAT 4262 132.959 135.501 135.952 1.00 0.00 H TER 46729 WAT 4262 ATOM 46729 O WAT 4263 95.001 120.182 15.251 1.00 0.00 O ATOM 46730 H1 WAT 4263 94.426 120.740 15.775 1.00 0.00 H ATOM 46731 H2 WAT 4263 94.404 119.620 14.756 1.00 0.00 H TER 46733 WAT 4263 ATOM 46733 O WAT 4264 129.286 111.981 94.076 1.00 0.00 O ATOM 46734 H1 WAT 4264 129.478 112.908 93.938 1.00 0.00 H ATOM 46735 H2 WAT 4264 129.893 111.522 93.494 1.00 0.00 H TER 46737 WAT 4264 ATOM 46737 O WAT 4265 22.431 76.800 151.986 1.00 0.00 O ATOM 46738 H1 WAT 4265 22.679 75.894 151.800 1.00 0.00 H ATOM 46739 H2 WAT 4265 21.601 76.920 151.524 1.00 0.00 H TER 46741 WAT 4265 ATOM 46741 O WAT 4266 136.878 113.998 120.067 1.00 0.00 O ATOM 46742 H1 WAT 4266 137.264 113.178 120.372 1.00 0.00 H ATOM 46743 H2 WAT 4266 135.970 113.774 119.863 1.00 0.00 H TER 46745 WAT 4266 ATOM 46745 O WAT 4267 74.877 5.438 100.386 1.00 0.00 O ATOM 46746 H1 WAT 4267 74.351 6.141 100.767 1.00 0.00 H ATOM 46747 H2 WAT 4267 75.781 5.736 100.483 1.00 0.00 H TER 46749 WAT 4267 ATOM 46749 O WAT 4268 16.318 20.330 2.135 1.00 0.00 O ATOM 46750 H1 WAT 4268 16.242 19.379 2.063 1.00 0.00 H ATOM 46751 H2 WAT 4268 15.873 20.666 1.357 1.00 0.00 H TER 46753 WAT 4268 ATOM 46753 O WAT 4269 66.078 79.527 22.453 1.00 0.00 O ATOM 46754 H1 WAT 4269 66.812 80.113 22.269 1.00 0.00 H ATOM 46755 H2 WAT 4269 66.464 78.811 22.958 1.00 0.00 H TER 46757 WAT 4269 ATOM 46757 O WAT 4270 32.557 145.367 155.932 1.00 0.00 O ATOM 46758 H1 WAT 4270 32.032 145.514 155.145 1.00 0.00 H ATOM 46759 H2 WAT 4270 33.383 145.819 155.758 1.00 0.00 H TER 46761 WAT 4270 ATOM 46761 O WAT 4271 124.348 59.662 3.405 1.00 0.00 O ATOM 46762 H1 WAT 4271 125.032 59.387 2.795 1.00 0.00 H ATOM 46763 H2 WAT 4271 124.297 60.611 3.295 1.00 0.00 H TER 46765 WAT 4271 ATOM 46765 O WAT 4272 117.098 55.305 122.220 1.00 0.00 O ATOM 46766 H1 WAT 4272 116.872 54.529 121.707 1.00 0.00 H ATOM 46767 H2 WAT 4272 116.599 55.209 123.031 1.00 0.00 H TER 46769 WAT 4272 ATOM 46769 O WAT 4273 26.017 117.660 89.235 1.00 0.00 O ATOM 46770 H1 WAT 4273 26.440 116.844 88.968 1.00 0.00 H ATOM 46771 H2 WAT 4273 25.723 118.058 88.415 1.00 0.00 H TER 46773 WAT 4273 ATOM 46773 O WAT 4274 35.757 26.514 84.681 1.00 0.00 O ATOM 46774 H1 WAT 4274 35.868 26.115 85.544 1.00 0.00 H ATOM 46775 H2 WAT 4274 35.801 25.779 84.070 1.00 0.00 H TER 46777 WAT 4274 ATOM 46777 O WAT 4275 141.467 97.086 143.202 1.00 0.00 O ATOM 46778 H1 WAT 4275 142.104 97.496 142.618 1.00 0.00 H ATOM 46779 H2 WAT 4275 140.662 97.586 143.066 1.00 0.00 H TER 46781 WAT 4275 ATOM 46781 O WAT 4276 14.421 24.367 100.343 1.00 0.00 O ATOM 46782 H1 WAT 4276 14.973 24.486 101.116 1.00 0.00 H ATOM 46783 H2 WAT 4276 13.552 24.654 100.623 1.00 0.00 H TER 46785 WAT 4276 ATOM 46785 O WAT 4277 14.759 140.842 126.158 1.00 0.00 O ATOM 46786 H1 WAT 4277 14.302 140.332 126.827 1.00 0.00 H ATOM 46787 H2 WAT 4277 14.066 141.133 125.565 1.00 0.00 H TER 46789 WAT 4277 ATOM 46789 O WAT 4278 95.815 62.509 1.590 1.00 0.00 O ATOM 46790 H1 WAT 4278 94.873 62.340 1.598 1.00 0.00 H ATOM 46791 H2 WAT 4278 96.022 62.667 0.669 1.00 0.00 H TER 46793 WAT 4278 ATOM 46793 O WAT 4279 74.559 98.045 110.383 1.00 0.00 O ATOM 46794 H1 WAT 4279 74.230 97.941 111.276 1.00 0.00 H ATOM 46795 H2 WAT 4279 73.772 98.046 109.837 1.00 0.00 H TER 46797 WAT 4279 ATOM 46797 O WAT 4280 61.277 144.923 95.409 1.00 0.00 O ATOM 46798 H1 WAT 4280 61.810 145.531 95.920 1.00 0.00 H ATOM 46799 H2 WAT 4280 60.588 145.469 95.030 1.00 0.00 H TER 46801 WAT 4280 ATOM 46801 O WAT 4281 97.344 2.166 22.664 1.00 0.00 O ATOM 46802 H1 WAT 4281 97.090 2.930 23.181 1.00 0.00 H ATOM 46803 H2 WAT 4281 97.492 2.512 21.783 1.00 0.00 H TER 46805 WAT 4281 ATOM 46805 O WAT 4282 1.136 75.621 0.208 1.00 0.00 O ATOM 46806 H1 WAT 4282 1.459 76.439 -0.168 1.00 0.00 H ATOM 46807 H2 WAT 4282 0.556 75.895 0.918 1.00 0.00 H TER 46809 WAT 4282 ATOM 46809 O WAT 4283 53.168 105.765 126.134 1.00 0.00 O ATOM 46810 H1 WAT 4283 53.932 105.867 126.701 1.00 0.00 H ATOM 46811 H2 WAT 4283 52.822 104.900 126.351 1.00 0.00 H TER 46813 WAT 4283 ATOM 46813 O WAT 4284 68.367 17.646 143.494 1.00 0.00 O ATOM 46814 H1 WAT 4284 67.426 17.805 143.566 1.00 0.00 H ATOM 46815 H2 WAT 4284 68.436 16.859 142.954 1.00 0.00 H TER 46817 WAT 4284 ATOM 46817 O WAT 4285 53.873 136.828 118.935 1.00 0.00 O ATOM 46818 H1 WAT 4285 53.708 135.885 118.926 1.00 0.00 H ATOM 46819 H2 WAT 4285 54.141 137.032 118.039 1.00 0.00 H TER 46821 WAT 4285 ATOM 46821 O WAT 4286 89.817 51.591 64.716 1.00 0.00 O ATOM 46822 H1 WAT 4286 90.049 51.087 65.496 1.00 0.00 H ATOM 46823 H2 WAT 4286 89.072 52.126 64.990 1.00 0.00 H TER 46825 WAT 4286 ATOM 46825 O WAT 4287 77.333 63.445 128.321 1.00 0.00 O ATOM 46826 H1 WAT 4287 78.035 63.532 128.967 1.00 0.00 H ATOM 46827 H2 WAT 4287 76.754 64.187 128.496 1.00 0.00 H TER 46829 WAT 4287 ATOM 46829 O WAT 4288 112.366 0.414 152.804 1.00 0.00 O ATOM 46830 H1 WAT 4288 111.519 0.230 152.398 1.00 0.00 H ATOM 46831 H2 WAT 4288 112.438 -0.229 153.510 1.00 0.00 H TER 46833 WAT 4288 ATOM 46833 O WAT 4289 43.555 128.913 90.602 1.00 0.00 O ATOM 46834 H1 WAT 4289 42.851 128.265 90.574 1.00 0.00 H ATOM 46835 H2 WAT 4289 44.239 128.501 91.130 1.00 0.00 H TER 46837 WAT 4289 ATOM 46837 O WAT 4290 39.743 72.263 93.135 1.00 0.00 O ATOM 46838 H1 WAT 4290 39.244 71.472 92.931 1.00 0.00 H ATOM 46839 H2 WAT 4290 39.457 72.506 94.016 1.00 0.00 H TER 46841 WAT 4290 ATOM 46841 O WAT 4291 40.099 62.557 112.962 1.00 0.00 O ATOM 46842 H1 WAT 4291 39.740 61.697 112.743 1.00 0.00 H ATOM 46843 H2 WAT 4291 39.918 62.662 113.896 1.00 0.00 H TER 46845 WAT 4291 ATOM 46845 O WAT 4292 104.304 1.908 80.230 1.00 0.00 O ATOM 46846 H1 WAT 4292 103.763 2.344 80.888 1.00 0.00 H ATOM 46847 H2 WAT 4292 105.128 2.396 80.236 1.00 0.00 H TER 46849 WAT 4292 ATOM 46849 O WAT 4293 83.217 65.362 114.546 1.00 0.00 O ATOM 46850 H1 WAT 4293 82.448 65.915 114.403 1.00 0.00 H ATOM 46851 H2 WAT 4293 83.175 64.710 113.847 1.00 0.00 H TER 46853 WAT 4293 ATOM 46853 O WAT 4294 126.898 11.165 77.034 1.00 0.00 O ATOM 46854 H1 WAT 4294 126.644 11.143 76.111 1.00 0.00 H ATOM 46855 H2 WAT 4294 126.376 11.874 77.409 1.00 0.00 H TER 46857 WAT 4294 ATOM 46857 O WAT 4295 111.430 92.464 61.600 1.00 0.00 O ATOM 46858 H1 WAT 4295 110.724 91.916 61.945 1.00 0.00 H ATOM 46859 H2 WAT 4295 112.211 92.174 62.071 1.00 0.00 H TER 46861 WAT 4295 ATOM 46861 O WAT 4296 49.059 82.809 147.125 1.00 0.00 O ATOM 46862 H1 WAT 4296 48.406 83.018 146.458 1.00 0.00 H ATOM 46863 H2 WAT 4296 49.891 83.088 146.742 1.00 0.00 H TER 46865 WAT 4296 ATOM 46865 O WAT 4297 39.733 62.806 7.197 1.00 0.00 O ATOM 46866 H1 WAT 4297 40.521 63.245 6.878 1.00 0.00 H ATOM 46867 H2 WAT 4297 39.177 62.720 6.423 1.00 0.00 H TER 46869 WAT 4297 ATOM 46869 O WAT 4298 99.552 27.463 114.028 1.00 0.00 O ATOM 46870 H1 WAT 4298 99.717 28.325 114.410 1.00 0.00 H ATOM 46871 H2 WAT 4298 99.792 27.560 113.107 1.00 0.00 H TER 46873 WAT 4298 ATOM 46873 O WAT 4299 47.810 6.033 83.685 1.00 0.00 O ATOM 46874 H1 WAT 4299 47.026 6.375 84.114 1.00 0.00 H ATOM 46875 H2 WAT 4299 47.496 5.289 83.171 1.00 0.00 H TER 46877 WAT 4299 ATOM 46877 O WAT 4300 13.922 7.341 157.619 1.00 0.00 O ATOM 46878 H1 WAT 4300 13.505 8.145 157.930 1.00 0.00 H ATOM 46879 H2 WAT 4300 14.599 7.641 157.013 1.00 0.00 H TER 46881 WAT 4300 ATOM 46881 O WAT 4301 74.258 32.686 94.149 1.00 0.00 O ATOM 46882 H1 WAT 4301 74.819 33.307 94.612 1.00 0.00 H ATOM 46883 H2 WAT 4301 73.552 33.223 93.789 1.00 0.00 H TER 46885 WAT 4301 ATOM 46885 O WAT 4302 105.255 133.203 18.122 1.00 0.00 O ATOM 46886 H1 WAT 4302 105.043 134.103 18.370 1.00 0.00 H ATOM 46887 H2 WAT 4302 106.115 133.044 18.511 1.00 0.00 H TER 46889 WAT 4302 ATOM 46889 O WAT 4303 36.512 103.135 56.844 1.00 0.00 O ATOM 46890 H1 WAT 4303 37.274 103.714 56.804 1.00 0.00 H ATOM 46891 H2 WAT 4303 36.371 102.989 57.779 1.00 0.00 H TER 46893 WAT 4303 ATOM 46893 O WAT 4304 83.745 102.676 73.443 1.00 0.00 O ATOM 46894 H1 WAT 4304 84.307 101.964 73.749 1.00 0.00 H ATOM 46895 H2 WAT 4304 83.259 102.298 72.709 1.00 0.00 H TER 46897 WAT 4304 ATOM 46897 O WAT 4305 117.976 62.291 102.390 1.00 0.00 O ATOM 46898 H1 WAT 4305 117.303 62.222 103.068 1.00 0.00 H ATOM 46899 H2 WAT 4305 117.573 62.827 101.707 1.00 0.00 H TER 46901 WAT 4305 ATOM 46901 O WAT 4306 87.223 8.986 82.352 1.00 0.00 O ATOM 46902 H1 WAT 4306 87.043 8.426 83.107 1.00 0.00 H ATOM 46903 H2 WAT 4306 86.788 9.813 82.559 1.00 0.00 H TER 46905 WAT 4306 ATOM 46905 O WAT 4307 95.061 28.442 79.453 1.00 0.00 O ATOM 46906 H1 WAT 4307 95.414 28.668 78.592 1.00 0.00 H ATOM 46907 H2 WAT 4307 94.650 29.248 79.763 1.00 0.00 H TER 46909 WAT 4307 ATOM 46909 O WAT 4308 17.168 10.050 100.375 1.00 0.00 O ATOM 46910 H1 WAT 4308 17.111 9.908 99.431 1.00 0.00 H ATOM 46911 H2 WAT 4308 17.798 10.764 100.472 1.00 0.00 H TER 46913 WAT 4308 ATOM 46913 O WAT 4309 53.181 143.944 57.265 1.00 0.00 O ATOM 46914 H1 WAT 4309 53.066 143.026 57.020 1.00 0.00 H ATOM 46915 H2 WAT 4309 53.528 143.912 58.157 1.00 0.00 H TER 46917 WAT 4309 ATOM 46917 O WAT 4310 131.790 33.707 151.094 1.00 0.00 O ATOM 46918 H1 WAT 4310 131.797 32.971 151.705 1.00 0.00 H ATOM 46919 H2 WAT 4310 132.523 34.256 151.372 1.00 0.00 H TER 46921 WAT 4310 ATOM 46921 O WAT 4311 88.630 127.662 69.526 1.00 0.00 O ATOM 46922 H1 WAT 4311 87.840 127.225 69.842 1.00 0.00 H ATOM 46923 H2 WAT 4311 88.422 128.595 69.571 1.00 0.00 H TER 46925 WAT 4311 ATOM 46925 O WAT 4312 25.601 145.246 92.899 1.00 0.00 O ATOM 46926 H1 WAT 4312 25.650 144.443 92.382 1.00 0.00 H ATOM 46927 H2 WAT 4312 24.900 145.753 92.488 1.00 0.00 H TER 46929 WAT 4312 ATOM 46929 O WAT 4313 132.894 71.816 1.548 1.00 0.00 O ATOM 46930 H1 WAT 4313 132.865 70.872 1.395 1.00 0.00 H ATOM 46931 H2 WAT 4313 132.271 72.180 0.919 1.00 0.00 H TER 46933 WAT 4313 ATOM 46933 O WAT 4314 6.046 61.153 105.541 1.00 0.00 O ATOM 46934 H1 WAT 4314 5.315 60.661 105.916 1.00 0.00 H ATOM 46935 H2 WAT 4314 6.489 60.525 104.970 1.00 0.00 H TER 46937 WAT 4314 ATOM 46937 O WAT 4315 145.013 67.058 132.516 1.00 0.00 O ATOM 46938 H1 WAT 4315 144.280 67.456 132.985 1.00 0.00 H ATOM 46939 H2 WAT 4315 145.759 67.159 133.107 1.00 0.00 H TER 46941 WAT 4315 ATOM 46941 O WAT 4316 91.885 101.583 92.745 1.00 0.00 O ATOM 46942 H1 WAT 4316 92.533 100.912 92.962 1.00 0.00 H ATOM 46943 H2 WAT 4316 92.057 101.794 91.827 1.00 0.00 H TER 46945 WAT 4316 ATOM 46945 O WAT 4317 121.622 106.937 117.373 1.00 0.00 O ATOM 46946 H1 WAT 4317 122.335 107.297 117.900 1.00 0.00 H ATOM 46947 H2 WAT 4317 121.350 107.662 116.811 1.00 0.00 H TER 46949 WAT 4317 ATOM 46949 O WAT 4318 4.963 48.653 92.126 1.00 0.00 O ATOM 46950 H1 WAT 4318 4.140 48.623 92.614 1.00 0.00 H ATOM 46951 H2 WAT 4318 4.844 48.021 91.417 1.00 0.00 H TER 46953 WAT 4318 ATOM 46953 O WAT 4319 28.002 33.555 103.171 1.00 0.00 O ATOM 46954 H1 WAT 4319 28.914 33.395 103.414 1.00 0.00 H ATOM 46955 H2 WAT 4319 28.018 34.398 102.717 1.00 0.00 H TER 46957 WAT 4319 ATOM 46957 O WAT 4320 90.395 82.783 73.510 1.00 0.00 O ATOM 46958 H1 WAT 4320 91.038 82.627 74.203 1.00 0.00 H ATOM 46959 H2 WAT 4320 90.497 82.038 72.918 1.00 0.00 H TER 46961 WAT 4320 ATOM 46961 O WAT 4321 68.207 89.006 78.228 1.00 0.00 O ATOM 46962 H1 WAT 4321 68.644 88.742 77.419 1.00 0.00 H ATOM 46963 H2 WAT 4321 67.805 88.202 78.556 1.00 0.00 H TER 46965 WAT 4321 ATOM 46965 O WAT 4322 59.942 106.350 105.785 1.00 0.00 O ATOM 46966 H1 WAT 4322 59.370 107.059 105.490 1.00 0.00 H ATOM 46967 H2 WAT 4322 60.093 105.822 105.000 1.00 0.00 H TER 46969 WAT 4322 ATOM 46969 O WAT 4323 42.632 114.956 158.176 1.00 0.00 O ATOM 46970 H1 WAT 4323 43.312 115.566 158.464 1.00 0.00 H ATOM 46971 H2 WAT 4323 42.149 115.437 157.504 1.00 0.00 H TER 46973 WAT 4323 ATOM 46973 O WAT 4324 11.020 103.235 73.083 1.00 0.00 O ATOM 46974 H1 WAT 4324 11.774 103.364 72.508 1.00 0.00 H ATOM 46975 H2 WAT 4324 10.431 103.959 72.873 1.00 0.00 H TER 46977 WAT 4324 ATOM 46977 O WAT 4325 53.322 27.308 65.275 1.00 0.00 O ATOM 46978 H1 WAT 4325 52.671 27.438 65.964 1.00 0.00 H ATOM 46979 H2 WAT 4325 53.871 26.593 65.596 1.00 0.00 H TER 46981 WAT 4325 ATOM 46981 O WAT 4326 108.612 103.500 61.944 1.00 0.00 O ATOM 46982 H1 WAT 4326 109.569 103.529 61.920 1.00 0.00 H ATOM 46983 H2 WAT 4326 108.405 102.588 62.146 1.00 0.00 H TER 46985 WAT 4326 ATOM 46985 O WAT 4327 10.597 62.113 108.811 1.00 0.00 O ATOM 46986 H1 WAT 4327 10.620 62.045 109.766 1.00 0.00 H ATOM 46987 H2 WAT 4327 11.357 62.651 108.591 1.00 0.00 H TER 46989 WAT 4327 ATOM 46989 O WAT 4328 38.465 92.420 118.826 1.00 0.00 O ATOM 46990 H1 WAT 4328 38.842 92.087 118.011 1.00 0.00 H ATOM 46991 H2 WAT 4328 37.620 91.977 118.898 1.00 0.00 H TER 46993 WAT 4328 ATOM 46993 O WAT 4329 44.907 96.355 4.689 1.00 0.00 O ATOM 46994 H1 WAT 4329 45.680 96.919 4.670 1.00 0.00 H ATOM 46995 H2 WAT 4329 45.108 95.651 4.072 1.00 0.00 H TER 46997 WAT 4329 ATOM 46997 O WAT 4330 54.959 119.007 85.945 1.00 0.00 O ATOM 46998 H1 WAT 4330 54.541 118.275 85.490 1.00 0.00 H ATOM 46999 H2 WAT 4330 54.636 119.786 85.492 1.00 0.00 H TER 47001 WAT 4330 ATOM 47001 O WAT 4331 129.853 26.500 59.712 1.00 0.00 O ATOM 47002 H1 WAT 4331 129.270 25.789 59.445 1.00 0.00 H ATOM 47003 H2 WAT 4331 130.392 26.119 60.406 1.00 0.00 H TER 47005 WAT 4331 ATOM 47005 O WAT 4332 104.224 90.909 75.920 1.00 0.00 O ATOM 47006 H1 WAT 4332 104.905 91.122 76.557 1.00 0.00 H ATOM 47007 H2 WAT 4332 103.421 91.265 76.300 1.00 0.00 H TER 47009 WAT 4332 ATOM 47009 O WAT 4333 143.994 94.595 123.071 1.00 0.00 O ATOM 47010 H1 WAT 4333 144.367 94.263 122.255 1.00 0.00 H ATOM 47011 H2 WAT 4333 143.633 93.821 123.502 1.00 0.00 H TER 47013 WAT 4333 ATOM 47013 O WAT 4334 141.642 37.329 98.909 1.00 0.00 O ATOM 47014 H1 WAT 4334 141.143 36.520 99.028 1.00 0.00 H ATOM 47015 H2 WAT 4334 141.640 37.474 97.963 1.00 0.00 H TER 47017 WAT 4334 ATOM 47017 O WAT 4335 46.413 100.141 115.470 1.00 0.00 O ATOM 47018 H1 WAT 4335 45.525 99.784 115.489 1.00 0.00 H ATOM 47019 H2 WAT 4335 46.302 101.045 115.177 1.00 0.00 H TER 47021 WAT 4335 ATOM 47021 O WAT 4336 70.746 90.939 79.813 1.00 0.00 O ATOM 47022 H1 WAT 4336 71.318 91.307 80.487 1.00 0.00 H ATOM 47023 H2 WAT 4336 70.446 90.108 80.182 1.00 0.00 H TER 47025 WAT 4336 ATOM 47025 O WAT 4337 102.446 118.772 65.605 1.00 0.00 O ATOM 47026 H1 WAT 4337 102.398 119.284 66.413 1.00 0.00 H ATOM 47027 H2 WAT 4337 103.289 118.322 65.656 1.00 0.00 H TER 47029 WAT 4337 ATOM 47029 O WAT 4338 46.957 41.022 93.345 1.00 0.00 O ATOM 47030 H1 WAT 4338 46.704 41.944 93.390 1.00 0.00 H ATOM 47031 H2 WAT 4338 47.681 40.942 93.967 1.00 0.00 H TER 47033 WAT 4338 ATOM 47033 O WAT 4339 17.807 20.802 104.833 1.00 0.00 O ATOM 47034 H1 WAT 4339 18.436 21.400 105.235 1.00 0.00 H ATOM 47035 H2 WAT 4339 18.303 20.359 104.144 1.00 0.00 H TER 47037 WAT 4339 ATOM 47037 O WAT 4340 62.110 59.530 27.150 1.00 0.00 O ATOM 47038 H1 WAT 4340 62.675 60.299 27.080 1.00 0.00 H ATOM 47039 H2 WAT 4340 61.952 59.434 28.090 1.00 0.00 H TER 47041 WAT 4340 ATOM 47041 O WAT 4341 119.226 48.471 81.920 1.00 0.00 O ATOM 47042 H1 WAT 4341 120.161 48.443 82.123 1.00 0.00 H ATOM 47043 H2 WAT 4341 119.190 48.592 80.972 1.00 0.00 H TER 47045 WAT 4341 ATOM 47045 O WAT 4342 9.715 72.051 79.988 1.00 0.00 O ATOM 47046 H1 WAT 4342 10.058 72.018 79.095 1.00 0.00 H ATOM 47047 H2 WAT 4342 10.041 71.251 80.401 1.00 0.00 H TER 47049 WAT 4342 ATOM 47049 O WAT 4343 20.067 34.220 103.295 1.00 0.00 O ATOM 47050 H1 WAT 4343 20.808 33.818 102.841 1.00 0.00 H ATOM 47051 H2 WAT 4343 20.401 34.420 104.169 1.00 0.00 H TER 47053 WAT 4343 ATOM 47053 O WAT 4344 116.039 35.745 144.377 1.00 0.00 O ATOM 47054 H1 WAT 4344 115.527 36.477 144.722 1.00 0.00 H ATOM 47055 H2 WAT 4344 116.942 35.950 144.620 1.00 0.00 H TER 47057 WAT 4344 ATOM 47057 O WAT 4345 36.610 64.220 88.312 1.00 0.00 O ATOM 47058 H1 WAT 4345 36.016 63.532 88.011 1.00 0.00 H ATOM 47059 H2 WAT 4345 36.851 63.957 89.200 1.00 0.00 H TER 47061 WAT 4345 ATOM 47061 O WAT 4346 80.523 121.299 68.286 1.00 0.00 O ATOM 47062 H1 WAT 4346 79.767 120.751 68.074 1.00 0.00 H ATOM 47063 H2 WAT 4346 80.827 121.625 67.439 1.00 0.00 H TER 47065 WAT 4346 ATOM 47065 O WAT 4347 125.692 36.792 58.779 1.00 0.00 O ATOM 47066 H1 WAT 4347 124.766 36.570 58.683 1.00 0.00 H ATOM 47067 H2 WAT 4347 126.154 35.969 58.621 1.00 0.00 H TER 47069 WAT 4347 ATOM 47069 O WAT 4348 94.649 72.947 6.289 1.00 0.00 O ATOM 47070 H1 WAT 4348 94.876 73.278 7.158 1.00 0.00 H ATOM 47071 H2 WAT 4348 95.182 72.159 6.187 1.00 0.00 H TER 47073 WAT 4348 ATOM 47073 O WAT 4349 61.825 7.864 149.701 1.00 0.00 O ATOM 47074 H1 WAT 4349 62.011 8.725 150.077 1.00 0.00 H ATOM 47075 H2 WAT 4349 61.065 8.008 149.138 1.00 0.00 H TER 47077 WAT 4349 ATOM 47077 O WAT 4350 28.837 82.197 10.715 1.00 0.00 O ATOM 47078 H1 WAT 4350 28.891 83.128 10.498 1.00 0.00 H ATOM 47079 H2 WAT 4350 28.108 82.136 11.332 1.00 0.00 H TER 47081 WAT 4350 ATOM 47081 O WAT 4351 89.735 144.614 10.806 1.00 0.00 O ATOM 47082 H1 WAT 4351 90.329 145.360 10.723 1.00 0.00 H ATOM 47083 H2 WAT 4351 90.075 144.119 11.551 1.00 0.00 H TER 47085 WAT 4351 ATOM 47085 O WAT 4352 20.087 102.779 84.527 1.00 0.00 O ATOM 47086 H1 WAT 4352 19.675 101.951 84.279 1.00 0.00 H ATOM 47087 H2 WAT 4352 20.135 103.276 83.710 1.00 0.00 H TER 47089 WAT 4352 ATOM 47089 O WAT 4353 108.585 78.736 156.142 1.00 0.00 O ATOM 47090 H1 WAT 4353 109.007 78.570 156.985 1.00 0.00 H ATOM 47091 H2 WAT 4353 108.161 79.587 156.249 1.00 0.00 H TER 47093 WAT 4353 ATOM 47093 O WAT 4354 95.867 60.195 11.765 1.00 0.00 O ATOM 47094 H1 WAT 4354 95.960 59.725 12.594 1.00 0.00 H ATOM 47095 H2 WAT 4354 96.601 59.887 11.232 1.00 0.00 H TER 47097 WAT 4354 ATOM 47097 O WAT 4355 46.984 118.628 80.156 1.00 0.00 O ATOM 47098 H1 WAT 4355 47.306 117.775 80.448 1.00 0.00 H ATOM 47099 H2 WAT 4355 47.620 118.912 79.500 1.00 0.00 H TER 47101 WAT 4355 ATOM 47101 O WAT 4356 21.987 133.642 6.248 1.00 0.00 O ATOM 47102 H1 WAT 4356 21.578 134.453 6.550 1.00 0.00 H ATOM 47103 H2 WAT 4356 22.834 133.620 6.693 1.00 0.00 H TER 47105 WAT 4356 ATOM 47105 O WAT 4357 70.171 50.781 130.444 1.00 0.00 O ATOM 47106 H1 WAT 4357 71.116 50.629 130.447 1.00 0.00 H ATOM 47107 H2 WAT 4357 69.820 50.115 131.036 1.00 0.00 H TER 47109 WAT 4357 ATOM 47109 O WAT 4358 40.474 75.663 18.811 1.00 0.00 O ATOM 47110 H1 WAT 4358 40.321 74.970 18.168 1.00 0.00 H ATOM 47111 H2 WAT 4358 39.678 76.194 18.785 1.00 0.00 H TER 47113 WAT 4358 ATOM 47113 O WAT 4359 37.424 134.408 3.620 1.00 0.00 O ATOM 47114 H1 WAT 4359 38.012 135.019 4.064 1.00 0.00 H ATOM 47115 H2 WAT 4359 38.008 133.783 3.192 1.00 0.00 H TER 47117 WAT 4359 ATOM 47117 O WAT 4360 116.476 92.025 5.311 1.00 0.00 O ATOM 47118 H1 WAT 4360 116.965 91.204 5.367 1.00 0.00 H ATOM 47119 H2 WAT 4360 117.138 92.684 5.103 1.00 0.00 H TER 47121 WAT 4360 ATOM 47121 O WAT 4361 34.319 107.116 138.861 1.00 0.00 O ATOM 47122 H1 WAT 4361 33.555 107.407 139.359 1.00 0.00 H ATOM 47123 H2 WAT 4361 34.714 106.435 139.405 1.00 0.00 H TER 47125 WAT 4361 ATOM 47125 O WAT 4362 39.272 87.780 153.510 1.00 0.00 O ATOM 47126 H1 WAT 4362 39.994 87.174 153.678 1.00 0.00 H ATOM 47127 H2 WAT 4362 39.324 87.961 152.571 1.00 0.00 H TER 47129 WAT 4362 ATOM 47129 O WAT 4363 95.219 102.989 8.370 1.00 0.00 O ATOM 47130 H1 WAT 4363 95.577 103.814 8.698 1.00 0.00 H ATOM 47131 H2 WAT 4363 94.744 103.233 7.575 1.00 0.00 H TER 47133 WAT 4363 ATOM 47133 O WAT 4364 31.377 68.414 156.020 1.00 0.00 O ATOM 47134 H1 WAT 4364 31.784 68.299 156.879 1.00 0.00 H ATOM 47135 H2 WAT 4364 30.457 68.189 156.159 1.00 0.00 H TER 47137 WAT 4364 ATOM 47137 O WAT 4365 1.007 118.098 131.937 1.00 0.00 O ATOM 47138 H1 WAT 4365 0.961 118.956 132.360 1.00 0.00 H ATOM 47139 H2 WAT 4365 1.771 118.156 131.363 1.00 0.00 H TER 47141 WAT 4365 ATOM 47141 O WAT 4366 83.247 45.029 84.330 1.00 0.00 O ATOM 47142 H1 WAT 4366 83.238 45.680 83.629 1.00 0.00 H ATOM 47143 H2 WAT 4366 82.482 44.480 84.157 1.00 0.00 H TER 47145 WAT 4366 ATOM 47145 O WAT 4367 62.384 116.436 -0.091 1.00 0.00 O ATOM 47146 H1 WAT 4367 62.047 115.657 0.352 1.00 0.00 H ATOM 47147 H2 WAT 4367 62.733 116.981 0.615 1.00 0.00 H TER 47149 WAT 4367 ATOM 47149 O WAT 4368 46.062 33.324 18.929 1.00 0.00 O ATOM 47150 H1 WAT 4368 45.157 33.253 18.626 1.00 0.00 H ATOM 47151 H2 WAT 4368 46.442 34.016 18.388 1.00 0.00 H TER 47153 WAT 4368 ATOM 47153 O WAT 4369 75.360 132.616 13.292 1.00 0.00 O ATOM 47154 H1 WAT 4369 74.418 132.490 13.406 1.00 0.00 H ATOM 47155 H2 WAT 4369 75.680 131.768 12.985 1.00 0.00 H TER 47157 WAT 4369 ATOM 47157 O WAT 4370 119.373 128.550 85.904 1.00 0.00 O ATOM 47158 H1 WAT 4370 118.466 128.760 86.126 1.00 0.00 H ATOM 47159 H2 WAT 4370 119.569 127.766 86.417 1.00 0.00 H TER 47161 WAT 4370 ATOM 47161 O WAT 4371 131.782 101.098 67.080 1.00 0.00 O ATOM 47162 H1 WAT 4371 130.833 101.114 67.206 1.00 0.00 H ATOM 47163 H2 WAT 4371 132.105 100.514 67.767 1.00 0.00 H TER 47165 WAT 4371 ATOM 47165 O WAT 4372 22.518 43.261 147.118 1.00 0.00 O ATOM 47166 H1 WAT 4372 21.694 43.016 147.539 1.00 0.00 H ATOM 47167 H2 WAT 4372 22.593 44.203 147.269 1.00 0.00 H TER 47169 WAT 4372 ATOM 47169 O WAT 4373 2.681 44.476 108.302 1.00 0.00 O ATOM 47170 H1 WAT 4373 3.278 44.854 107.657 1.00 0.00 H ATOM 47171 H2 WAT 4373 1.807 44.695 107.978 1.00 0.00 H TER 47173 WAT 4373 ATOM 47173 O WAT 4374 52.770 57.988 126.102 1.00 0.00 O ATOM 47174 H1 WAT 4374 53.702 58.197 126.160 1.00 0.00 H ATOM 47175 H2 WAT 4374 52.662 57.618 125.226 1.00 0.00 H TER 47177 WAT 4374 ATOM 47177 O WAT 4375 6.328 128.105 102.067 1.00 0.00 O ATOM 47178 H1 WAT 4375 6.539 128.436 101.195 1.00 0.00 H ATOM 47179 H2 WAT 4375 6.109 128.886 102.574 1.00 0.00 H TER 47181 WAT 4375 ATOM 47181 O WAT 4376 0.799 21.688 60.949 1.00 0.00 O ATOM 47182 H1 WAT 4376 1.247 21.946 60.144 1.00 0.00 H ATOM 47183 H2 WAT 4376 0.347 22.482 61.237 1.00 0.00 H TER 47185 WAT 4376 ATOM 47185 O WAT 4377 7.354 115.258 97.487 1.00 0.00 O ATOM 47186 H1 WAT 4377 8.215 115.220 97.904 1.00 0.00 H ATOM 47187 H2 WAT 4377 6.791 114.728 98.050 1.00 0.00 H TER 47189 WAT 4377 ATOM 47189 O WAT 4378 106.547 26.893 130.253 1.00 0.00 O ATOM 47190 H1 WAT 4378 106.117 26.524 131.025 1.00 0.00 H ATOM 47191 H2 WAT 4378 107.443 26.560 130.297 1.00 0.00 H TER 47193 WAT 4378 ATOM 47193 O WAT 4379 36.451 20.003 98.899 1.00 0.00 O ATOM 47194 H1 WAT 4379 36.159 20.914 98.925 1.00 0.00 H ATOM 47195 H2 WAT 4379 35.910 19.558 99.551 1.00 0.00 H TER 47197 WAT 4379 ATOM 47197 O WAT 4380 78.551 6.895 22.914 1.00 0.00 O ATOM 47198 H1 WAT 4380 77.912 7.599 23.025 1.00 0.00 H ATOM 47199 H2 WAT 4380 78.988 6.832 23.763 1.00 0.00 H TER 47201 WAT 4380 ATOM 47201 O WAT 4381 22.477 127.948 86.829 1.00 0.00 O ATOM 47202 H1 WAT 4381 21.632 127.868 87.273 1.00 0.00 H ATOM 47203 H2 WAT 4381 22.257 127.963 85.898 1.00 0.00 H TER 47205 WAT 4381 ATOM 47205 O WAT 4382 63.487 46.286 151.251 1.00 0.00 O ATOM 47206 H1 WAT 4382 63.313 45.467 151.716 1.00 0.00 H ATOM 47207 H2 WAT 4382 64.326 46.140 150.813 1.00 0.00 H TER 47209 WAT 4382 ATOM 47209 O WAT 4383 107.462 52.113 18.098 1.00 0.00 O ATOM 47210 H1 WAT 4383 108.042 51.669 18.717 1.00 0.00 H ATOM 47211 H2 WAT 4383 107.873 52.966 17.955 1.00 0.00 H TER 47213 WAT 4383 ATOM 47213 O WAT 4384 8.071 10.829 134.095 1.00 0.00 O ATOM 47214 H1 WAT 4384 7.839 11.421 133.380 1.00 0.00 H ATOM 47215 H2 WAT 4384 7.837 11.309 134.890 1.00 0.00 H TER 47217 WAT 4384 ATOM 47217 O WAT 4385 39.297 83.835 105.379 1.00 0.00 O ATOM 47218 H1 WAT 4385 39.290 82.899 105.178 1.00 0.00 H ATOM 47219 H2 WAT 4385 40.007 83.938 106.012 1.00 0.00 H TER 47221 WAT 4385 ATOM 47221 O WAT 4386 45.371 58.355 130.240 1.00 0.00 O ATOM 47222 H1 WAT 4386 45.333 57.607 129.644 1.00 0.00 H ATOM 47223 H2 WAT 4386 44.941 58.047 131.038 1.00 0.00 H TER 47225 WAT 4386 ATOM 47225 O WAT 4387 133.678 94.874 111.617 1.00 0.00 O ATOM 47226 H1 WAT 4387 132.786 94.625 111.375 1.00 0.00 H ATOM 47227 H2 WAT 4387 133.710 94.755 112.567 1.00 0.00 H TER 47229 WAT 4387 ATOM 47229 O WAT 4388 70.355 63.333 96.181 1.00 0.00 O ATOM 47230 H1 WAT 4388 70.588 63.252 95.257 1.00 0.00 H ATOM 47231 H2 WAT 4388 71.179 63.547 96.618 1.00 0.00 H TER 47233 WAT 4388 ATOM 47233 O WAT 4389 11.276 21.089 87.080 1.00 0.00 O ATOM 47234 H1 WAT 4389 10.326 21.011 87.167 1.00 0.00 H ATOM 47235 H2 WAT 4389 11.627 20.446 87.696 1.00 0.00 H TER 47237 WAT 4389 ATOM 47237 O WAT 4390 96.279 140.681 23.297 1.00 0.00 O ATOM 47238 H1 WAT 4390 95.490 140.150 23.404 1.00 0.00 H ATOM 47239 H2 WAT 4390 96.988 140.125 23.620 1.00 0.00 H TER 47241 WAT 4390 ATOM 47241 O WAT 4391 7.911 65.858 16.899 1.00 0.00 O ATOM 47242 H1 WAT 4391 8.073 65.221 17.596 1.00 0.00 H ATOM 47243 H2 WAT 4391 7.410 66.554 17.323 1.00 0.00 H TER 47245 WAT 4391 ATOM 47245 O WAT 4392 68.232 100.279 65.239 1.00 0.00 O ATOM 47246 H1 WAT 4392 67.490 100.801 64.935 1.00 0.00 H ATOM 47247 H2 WAT 4392 69.000 100.719 64.873 1.00 0.00 H TER 47249 WAT 4392 ATOM 47249 O WAT 4393 123.071 129.321 10.820 1.00 0.00 O ATOM 47250 H1 WAT 4393 123.098 128.882 9.970 1.00 0.00 H ATOM 47251 H2 WAT 4393 122.159 129.242 11.100 1.00 0.00 H TER 47253 WAT 4393 ATOM 47253 O WAT 4394 68.620 55.479 87.243 1.00 0.00 O ATOM 47254 H1 WAT 4394 69.337 55.028 86.796 1.00 0.00 H ATOM 47255 H2 WAT 4394 68.506 56.293 86.752 1.00 0.00 H TER 47257 WAT 4394 ATOM 47257 O WAT 4395 130.096 13.540 152.167 1.00 0.00 O ATOM 47258 H1 WAT 4395 130.667 13.402 151.412 1.00 0.00 H ATOM 47259 H2 WAT 4395 130.594 13.199 152.910 1.00 0.00 H TER 47261 WAT 4395 ATOM 47261 O WAT 4396 82.603 98.475 106.367 1.00 0.00 O ATOM 47262 H1 WAT 4396 83.312 98.363 105.735 1.00 0.00 H ATOM 47263 H2 WAT 4396 82.136 97.639 106.355 1.00 0.00 H TER 47265 WAT 4396 ATOM 47265 O WAT 4397 73.141 14.951 141.105 1.00 0.00 O ATOM 47266 H1 WAT 4397 73.650 15.469 141.729 1.00 0.00 H ATOM 47267 H2 WAT 4397 73.785 14.378 140.689 1.00 0.00 H TER 47269 WAT 4397 ATOM 47269 O WAT 4398 83.704 45.733 112.740 1.00 0.00 O ATOM 47270 H1 WAT 4398 83.840 45.196 111.960 1.00 0.00 H ATOM 47271 H2 WAT 4398 82.904 45.386 113.134 1.00 0.00 H TER 47273 WAT 4398 ATOM 47273 O WAT 4399 21.112 57.257 106.253 1.00 0.00 O ATOM 47274 H1 WAT 4399 20.823 57.189 105.343 1.00 0.00 H ATOM 47275 H2 WAT 4399 21.982 56.859 106.259 1.00 0.00 H TER 47277 WAT 4399 ATOM 47277 O WAT 4400 78.003 39.053 72.541 1.00 0.00 O ATOM 47278 H1 WAT 4400 78.102 39.946 72.869 1.00 0.00 H ATOM 47279 H2 WAT 4400 78.361 39.081 71.654 1.00 0.00 H TER 47281 WAT 4400 ATOM 47281 O WAT 4401 19.477 14.989 97.622 1.00 0.00 O ATOM 47282 H1 WAT 4401 18.947 15.764 97.811 1.00 0.00 H ATOM 47283 H2 WAT 4401 19.143 14.670 96.784 1.00 0.00 H TER 47285 WAT 4401 ATOM 47285 O WAT 4402 11.995 142.749 79.404 1.00 0.00 O ATOM 47286 H1 WAT 4402 11.609 141.898 79.193 1.00 0.00 H ATOM 47287 H2 WAT 4402 12.869 142.540 79.733 1.00 0.00 H TER 47289 WAT 4402 ATOM 47289 O WAT 4403 9.144 47.620 118.466 1.00 0.00 O ATOM 47290 H1 WAT 4403 9.188 47.094 117.668 1.00 0.00 H ATOM 47291 H2 WAT 4403 8.227 47.888 118.525 1.00 0.00 H TER 47293 WAT 4403 ATOM 47293 O WAT 4404 24.315 92.437 158.534 1.00 0.00 O ATOM 47294 H1 WAT 4404 23.871 93.263 158.721 1.00 0.00 H ATOM 47295 H2 WAT 4404 24.086 92.241 157.625 1.00 0.00 H TER 47297 WAT 4404 ATOM 47297 O WAT 4405 38.143 69.046 4.804 1.00 0.00 O ATOM 47298 H1 WAT 4405 37.323 69.469 5.057 1.00 0.00 H ATOM 47299 H2 WAT 4405 38.178 68.253 5.339 1.00 0.00 H TER 47301 WAT 4405 ATOM 47301 O WAT 4406 40.963 140.873 8.581 1.00 0.00 O ATOM 47302 H1 WAT 4406 41.148 140.442 9.415 1.00 0.00 H ATOM 47303 H2 WAT 4406 41.729 141.424 8.421 1.00 0.00 H TER 47305 WAT 4406 ATOM 47305 O WAT 4407 89.540 53.592 18.945 1.00 0.00 O ATOM 47306 H1 WAT 4407 90.482 53.725 19.050 1.00 0.00 H ATOM 47307 H2 WAT 4407 89.342 52.837 19.498 1.00 0.00 H TER 47309 WAT 4407 ATOM 47309 O WAT 4408 49.834 24.135 1.595 1.00 0.00 O ATOM 47310 H1 WAT 4408 50.103 24.317 0.694 1.00 0.00 H ATOM 47311 H2 WAT 4408 50.612 24.323 2.120 1.00 0.00 H TER 47313 WAT 4408 ATOM 47313 O WAT 4409 15.506 101.845 158.274 1.00 0.00 O ATOM 47314 H1 WAT 4409 15.823 102.733 158.107 1.00 0.00 H ATOM 47315 H2 WAT 4409 16.299 101.336 158.445 1.00 0.00 H TER 47317 WAT 4409 ATOM 47317 O WAT 4410 46.411 127.929 118.597 1.00 0.00 O ATOM 47318 H1 WAT 4410 45.905 127.489 117.914 1.00 0.00 H ATOM 47319 H2 WAT 4410 46.278 127.390 119.377 1.00 0.00 H TER 47321 WAT 4410 ATOM 47321 O WAT 4411 130.724 127.116 125.325 1.00 0.00 O ATOM 47322 H1 WAT 4411 130.710 126.404 124.685 1.00 0.00 H ATOM 47323 H2 WAT 4411 129.924 127.611 125.150 1.00 0.00 H TER 47325 WAT 4411 ATOM 47325 O WAT 4412 111.150 39.720 128.102 1.00 0.00 O ATOM 47326 H1 WAT 4412 111.959 39.479 127.649 1.00 0.00 H ATOM 47327 H2 WAT 4412 111.380 40.501 128.604 1.00 0.00 H TER 47329 WAT 4412 ATOM 47329 O WAT 4413 3.158 74.310 129.859 1.00 0.00 O ATOM 47330 H1 WAT 4413 2.539 74.938 130.232 1.00 0.00 H ATOM 47331 H2 WAT 4413 2.956 74.302 128.924 1.00 0.00 H TER 47333 WAT 4413 ATOM 47333 O WAT 4414 66.711 120.505 139.420 1.00 0.00 O ATOM 47334 H1 WAT 4414 66.105 120.947 140.015 1.00 0.00 H ATOM 47335 H2 WAT 4414 66.786 119.617 139.771 1.00 0.00 H TER 47337 WAT 4414 ATOM 47337 O WAT 4415 131.474 126.045 1.522 1.00 0.00 O ATOM 47338 H1 WAT 4415 132.277 126.423 1.883 1.00 0.00 H ATOM 47339 H2 WAT 4415 131.508 126.257 0.589 1.00 0.00 H TER 47341 WAT 4415 ATOM 47341 O WAT 4416 56.481 134.930 148.500 1.00 0.00 O ATOM 47342 H1 WAT 4416 57.151 134.983 147.818 1.00 0.00 H ATOM 47343 H2 WAT 4416 56.719 135.616 149.123 1.00 0.00 H TER 47345 WAT 4416 ATOM 47345 O WAT 4417 93.840 73.019 82.181 1.00 0.00 O ATOM 47346 H1 WAT 4417 94.564 72.495 82.523 1.00 0.00 H ATOM 47347 H2 WAT 4417 93.443 73.415 82.958 1.00 0.00 H TER 47349 WAT 4417 ATOM 47349 O WAT 4418 121.743 94.972 101.950 1.00 0.00 O ATOM 47350 H1 WAT 4418 122.150 95.771 101.615 1.00 0.00 H ATOM 47351 H2 WAT 4418 121.653 94.409 101.181 1.00 0.00 H TER 47353 WAT 4418 ATOM 47353 O WAT 4419 67.056 82.510 93.516 1.00 0.00 O ATOM 47354 H1 WAT 4419 67.785 82.067 93.951 1.00 0.00 H ATOM 47355 H2 WAT 4419 66.295 81.961 93.705 1.00 0.00 H TER 47357 WAT 4419 ATOM 47357 O WAT 4420 92.515 20.448 138.724 1.00 0.00 O ATOM 47358 H1 WAT 4420 93.168 20.518 139.421 1.00 0.00 H ATOM 47359 H2 WAT 4420 92.703 21.186 138.145 1.00 0.00 H TER 47361 WAT 4420 ATOM 47361 O WAT 4421 20.069 17.857 70.667 1.00 0.00 O ATOM 47362 H1 WAT 4421 19.509 17.097 70.509 1.00 0.00 H ATOM 47363 H2 WAT 4421 20.917 17.610 70.299 1.00 0.00 H TER 47365 WAT 4421 ATOM 47365 O WAT 4422 94.603 97.845 9.464 1.00 0.00 O ATOM 47366 H1 WAT 4422 94.843 96.923 9.557 1.00 0.00 H ATOM 47367 H2 WAT 4422 93.687 97.827 9.186 1.00 0.00 H TER 47369 WAT 4422 ATOM 47369 O WAT 4423 106.814 28.405 125.919 1.00 0.00 O ATOM 47370 H1 WAT 4423 106.980 28.198 125.000 1.00 0.00 H ATOM 47371 H2 WAT 4423 106.768 27.552 126.352 1.00 0.00 H TER 47373 WAT 4423 ATOM 47373 O WAT 4424 101.350 145.433 124.021 1.00 0.00 O ATOM 47374 H1 WAT 4424 101.694 144.789 124.641 1.00 0.00 H ATOM 47375 H2 WAT 4424 100.468 145.122 123.818 1.00 0.00 H TER 47377 WAT 4424 ATOM 47377 O WAT 4425 42.491 66.212 80.459 1.00 0.00 O ATOM 47378 H1 WAT 4425 42.146 65.822 79.656 1.00 0.00 H ATOM 47379 H2 WAT 4425 41.790 66.786 80.767 1.00 0.00 H TER 47381 WAT 4425 ATOM 47381 O WAT 4426 40.867 8.463 84.982 1.00 0.00 O ATOM 47382 H1 WAT 4426 40.658 8.051 84.144 1.00 0.00 H ATOM 47383 H2 WAT 4426 41.820 8.546 84.977 1.00 0.00 H TER 47385 WAT 4426 ATOM 47385 O WAT 4427 116.291 36.607 132.384 1.00 0.00 O ATOM 47386 H1 WAT 4427 115.719 36.355 133.109 1.00 0.00 H ATOM 47387 H2 WAT 4427 116.305 35.839 131.812 1.00 0.00 H TER 47389 WAT 4427 ATOM 47389 O WAT 4428 113.379 44.215 7.030 1.00 0.00 O ATOM 47390 H1 WAT 4428 112.876 43.404 6.961 1.00 0.00 H ATOM 47391 H2 WAT 4428 112.789 44.893 6.700 1.00 0.00 H TER 47393 WAT 4428 ATOM 47393 O WAT 4429 52.531 57.378 140.621 1.00 0.00 O ATOM 47394 H1 WAT 4429 52.989 56.606 140.290 1.00 0.00 H ATOM 47395 H2 WAT 4429 53.121 57.743 141.280 1.00 0.00 H TER 47397 WAT 4429 ATOM 47397 O WAT 4430 137.578 40.047 139.917 1.00 0.00 O ATOM 47398 H1 WAT 4430 138.188 40.637 140.361 1.00 0.00 H ATOM 47399 H2 WAT 4430 138.136 39.488 139.376 1.00 0.00 H TER 47401 WAT 4430 ATOM 47401 O WAT 4431 94.943 18.297 114.952 1.00 0.00 O ATOM 47402 H1 WAT 4431 94.032 18.325 115.244 1.00 0.00 H ATOM 47403 H2 WAT 4431 95.291 17.490 115.331 1.00 0.00 H TER 47405 WAT 4431 ATOM 47405 O WAT 4432 22.108 42.497 144.585 1.00 0.00 O ATOM 47406 H1 WAT 4432 22.384 42.891 145.412 1.00 0.00 H ATOM 47407 H2 WAT 4432 21.163 42.380 144.679 1.00 0.00 H TER 47409 WAT 4432 ATOM 47409 O WAT 4433 15.406 117.558 100.557 1.00 0.00 O ATOM 47410 H1 WAT 4433 16.327 117.506 100.301 1.00 0.00 H ATOM 47411 H2 WAT 4433 15.113 116.647 100.584 1.00 0.00 H TER 47413 WAT 4433 ATOM 47413 O WAT 4434 130.237 119.587 15.253 1.00 0.00 O ATOM 47414 H1 WAT 4434 130.660 119.933 16.039 1.00 0.00 H ATOM 47415 H2 WAT 4434 129.744 120.327 14.899 1.00 0.00 H TER 47417 WAT 4434 ATOM 47417 O WAT 4435 108.290 53.909 156.629 1.00 0.00 O ATOM 47418 H1 WAT 4435 107.678 53.179 156.727 1.00 0.00 H ATOM 47419 H2 WAT 4435 109.153 53.496 156.606 1.00 0.00 H TER 47421 WAT 4435 ATOM 47421 O WAT 4436 28.670 113.561 81.273 1.00 0.00 O ATOM 47422 H1 WAT 4436 29.353 113.582 80.603 1.00 0.00 H ATOM 47423 H2 WAT 4436 28.951 112.878 81.882 1.00 0.00 H TER 47425 WAT 4436 ATOM 47425 O WAT 4437 69.154 112.967 58.479 1.00 0.00 O ATOM 47426 H1 WAT 4437 69.333 113.315 57.605 1.00 0.00 H ATOM 47427 H2 WAT 4437 69.946 112.481 58.710 1.00 0.00 H TER 47429 WAT 4437 ATOM 47429 O WAT 4438 1.428 48.958 145.930 1.00 0.00 O ATOM 47430 H1 WAT 4438 1.776 49.043 146.818 1.00 0.00 H ATOM 47431 H2 WAT 4438 0.596 48.499 146.041 1.00 0.00 H TER 47433 WAT 4438 ATOM 47433 O WAT 4439 118.228 77.904 117.088 1.00 0.00 O ATOM 47434 H1 WAT 4439 118.548 77.037 117.336 1.00 0.00 H ATOM 47435 H2 WAT 4439 118.234 77.897 116.131 1.00 0.00 H TER 47437 WAT 4439 ATOM 47437 O WAT 4440 60.087 40.496 136.959 1.00 0.00 O ATOM 47438 H1 WAT 4440 59.438 40.548 137.661 1.00 0.00 H ATOM 47439 H2 WAT 4440 60.449 39.613 137.032 1.00 0.00 H TER 47441 WAT 4440 ATOM 47441 O WAT 4441 60.024 9.687 114.387 1.00 0.00 O ATOM 47442 H1 WAT 4441 60.457 9.911 115.210 1.00 0.00 H ATOM 47443 H2 WAT 4441 60.636 9.972 113.709 1.00 0.00 H TER 47445 WAT 4441 ATOM 47445 O WAT 4442 127.825 70.896 88.300 1.00 0.00 O ATOM 47446 H1 WAT 4442 128.627 70.584 87.881 1.00 0.00 H ATOM 47447 H2 WAT 4442 128.130 71.457 89.013 1.00 0.00 H TER 47449 WAT 4442 ATOM 47449 O WAT 4443 93.025 18.127 149.074 1.00 0.00 O ATOM 47450 H1 WAT 4443 93.349 17.724 148.269 1.00 0.00 H ATOM 47451 H2 WAT 4443 93.812 18.288 149.595 1.00 0.00 H TER 47453 WAT 4443 ATOM 47453 O WAT 4444 6.285 14.610 122.413 1.00 0.00 O ATOM 47454 H1 WAT 4444 6.441 14.388 121.494 1.00 0.00 H ATOM 47455 H2 WAT 4444 6.817 13.983 122.904 1.00 0.00 H TER 47457 WAT 4444 ATOM 47457 O WAT 4445 61.440 24.582 97.534 1.00 0.00 O ATOM 47458 H1 WAT 4445 61.876 25.390 97.264 1.00 0.00 H ATOM 47459 H2 WAT 4445 61.572 23.982 96.800 1.00 0.00 H TER 47461 WAT 4445 ATOM 47461 O WAT 4446 74.889 62.438 89.677 1.00 0.00 O ATOM 47462 H1 WAT 4446 75.684 62.892 89.397 1.00 0.00 H ATOM 47463 H2 WAT 4446 74.181 62.887 89.215 1.00 0.00 H TER 47465 WAT 4446 ATOM 47465 O WAT 4447 119.094 10.139 79.494 1.00 0.00 O ATOM 47466 H1 WAT 4447 119.535 9.506 78.927 1.00 0.00 H ATOM 47467 H2 WAT 4447 119.645 10.187 80.274 1.00 0.00 H TER 47469 WAT 4447 ATOM 47469 O WAT 4448 131.893 136.420 6.989 1.00 0.00 O ATOM 47470 H1 WAT 4448 131.783 137.185 6.424 1.00 0.00 H ATOM 47471 H2 WAT 4448 131.502 136.680 7.823 1.00 0.00 H TER 47473 WAT 4448 ATOM 47473 O WAT 4449 39.684 84.405 153.314 1.00 0.00 O ATOM 47474 H1 WAT 4449 39.400 84.319 152.404 1.00 0.00 H ATOM 47475 H2 WAT 4449 40.234 83.638 153.467 1.00 0.00 H TER 47477 WAT 4449 ATOM 47477 O WAT 4450 24.039 44.492 72.566 1.00 0.00 O ATOM 47478 H1 WAT 4450 23.286 44.807 73.067 1.00 0.00 H ATOM 47479 H2 WAT 4450 24.376 43.756 73.077 1.00 0.00 H TER 47481 WAT 4450 ATOM 47481 O WAT 4451 39.469 145.942 20.937 1.00 0.00 O ATOM 47482 H1 WAT 4451 39.180 145.285 21.569 1.00 0.00 H ATOM 47483 H2 WAT 4451 40.423 145.868 20.932 1.00 0.00 H TER 47485 WAT 4451 ATOM 47485 O WAT 4452 17.712 113.473 102.998 1.00 0.00 O ATOM 47486 H1 WAT 4452 17.839 114.411 102.857 1.00 0.00 H ATOM 47487 H2 WAT 4452 18.599 113.114 103.029 1.00 0.00 H TER 47489 WAT 4452 ATOM 47489 O WAT 4453 102.075 55.426 156.064 1.00 0.00 O ATOM 47490 H1 WAT 4453 102.281 56.180 155.512 1.00 0.00 H ATOM 47491 H2 WAT 4453 102.920 55.150 156.418 1.00 0.00 H TER 47493 WAT 4453 ATOM 47493 O WAT 4454 71.926 18.755 74.184 1.00 0.00 O ATOM 47494 H1 WAT 4454 72.715 18.611 73.661 1.00 0.00 H ATOM 47495 H2 WAT 4454 71.485 19.489 73.756 1.00 0.00 H TER 47497 WAT 4454 ATOM 47497 O WAT 4455 82.854 50.962 4.629 1.00 0.00 O ATOM 47498 H1 WAT 4455 83.213 50.794 5.500 1.00 0.00 H ATOM 47499 H2 WAT 4455 83.121 51.859 4.429 1.00 0.00 H TER 47501 WAT 4455 ATOM 47501 O WAT 4456 7.465 91.677 109.498 1.00 0.00 O ATOM 47502 H1 WAT 4456 7.776 92.019 108.660 1.00 0.00 H ATOM 47503 H2 WAT 4456 7.462 90.726 109.382 1.00 0.00 H TER 47505 WAT 4456 ATOM 47505 O WAT 4457 6.192 25.289 84.690 1.00 0.00 O ATOM 47506 H1 WAT 4457 6.853 24.637 84.458 1.00 0.00 H ATOM 47507 H2 WAT 4457 6.121 25.845 83.915 1.00 0.00 H TER 47509 WAT 4457 ATOM 47509 O WAT 4458 99.997 9.911 4.650 1.00 0.00 O ATOM 47510 H1 WAT 4458 100.634 9.819 5.359 1.00 0.00 H ATOM 47511 H2 WAT 4458 99.757 10.837 4.663 1.00 0.00 H TER 47513 WAT 4458 ATOM 47513 O WAT 4459 107.736 106.659 98.411 1.00 0.00 O ATOM 47514 H1 WAT 4459 107.429 107.215 97.695 1.00 0.00 H ATOM 47515 H2 WAT 4459 107.850 107.260 99.148 1.00 0.00 H TER 47517 WAT 4459 ATOM 47517 O WAT 4460 124.001 108.423 156.090 1.00 0.00 O ATOM 47518 H1 WAT 4460 124.932 108.205 156.059 1.00 0.00 H ATOM 47519 H2 WAT 4460 123.975 109.378 156.027 1.00 0.00 H TER 47521 WAT 4460 ATOM 47521 O WAT 4461 108.746 74.781 131.071 1.00 0.00 O ATOM 47522 H1 WAT 4461 108.083 74.859 131.757 1.00 0.00 H ATOM 47523 H2 WAT 4461 108.575 73.930 130.668 1.00 0.00 H TER 47525 WAT 4461 ATOM 47525 O WAT 4462 53.991 121.200 12.137 1.00 0.00 O ATOM 47526 H1 WAT 4462 54.694 120.555 12.213 1.00 0.00 H ATOM 47527 H2 WAT 4462 53.768 121.203 11.206 1.00 0.00 H TER 47529 WAT 4462 ATOM 47529 O WAT 4463 66.320 73.000 104.713 1.00 0.00 O ATOM 47530 H1 WAT 4463 67.161 72.624 104.452 1.00 0.00 H ATOM 47531 H2 WAT 4463 65.915 72.326 105.259 1.00 0.00 H TER 47533 WAT 4463 ATOM 47533 O WAT 4464 84.643 39.916 139.583 1.00 0.00 O ATOM 47534 H1 WAT 4464 84.415 40.700 140.083 1.00 0.00 H ATOM 47535 H2 WAT 4464 83.848 39.382 139.600 1.00 0.00 H TER 47537 WAT 4464 ATOM 47537 O WAT 4465 82.918 96.129 103.497 1.00 0.00 O ATOM 47538 H1 WAT 4465 83.471 95.508 103.970 1.00 0.00 H ATOM 47539 H2 WAT 4465 82.637 95.653 102.715 1.00 0.00 H TER 47541 WAT 4465 ATOM 47541 O WAT 4466 55.349 132.672 54.256 1.00 0.00 O ATOM 47542 H1 WAT 4466 55.487 132.016 53.572 1.00 0.00 H ATOM 47543 H2 WAT 4466 55.661 133.490 53.870 1.00 0.00 H TER 47545 WAT 4466 ATOM 47545 O WAT 4467 27.517 103.760 136.574 1.00 0.00 O ATOM 47546 H1 WAT 4467 26.864 104.397 136.284 1.00 0.00 H ATOM 47547 H2 WAT 4467 27.840 103.363 135.765 1.00 0.00 H TER 47549 WAT 4467 ATOM 47549 O WAT 4468 70.809 79.466 71.376 1.00 0.00 O ATOM 47550 H1 WAT 4468 70.844 78.903 70.603 1.00 0.00 H ATOM 47551 H2 WAT 4468 71.717 79.516 71.678 1.00 0.00 H TER 47553 WAT 4468 ATOM 47553 O WAT 4469 135.057 57.694 18.124 1.00 0.00 O ATOM 47554 H1 WAT 4469 135.728 57.021 18.235 1.00 0.00 H ATOM 47555 H2 WAT 4469 134.566 57.680 18.945 1.00 0.00 H TER 47557 WAT 4469 ATOM 47557 O WAT 4470 124.952 104.104 91.554 1.00 0.00 O ATOM 47558 H1 WAT 4470 125.434 104.922 91.676 1.00 0.00 H ATOM 47559 H2 WAT 4470 124.035 104.344 91.691 1.00 0.00 H TER 47561 WAT 4470 ATOM 47561 O WAT 4471 108.617 124.463 132.943 1.00 0.00 O ATOM 47562 H1 WAT 4471 107.810 124.781 133.348 1.00 0.00 H ATOM 47563 H2 WAT 4471 108.611 123.519 133.105 1.00 0.00 H TER 47565 WAT 4471 ATOM 47565 O WAT 4472 100.398 16.032 93.383 1.00 0.00 O ATOM 47566 H1 WAT 4472 99.720 16.706 93.344 1.00 0.00 H ATOM 47567 H2 WAT 4472 100.128 15.462 94.103 1.00 0.00 H TER 47569 WAT 4472 ATOM 47569 O WAT 4473 144.968 125.271 90.176 1.00 0.00 O ATOM 47570 H1 WAT 4473 144.736 125.797 90.941 1.00 0.00 H ATOM 47571 H2 WAT 4473 144.662 124.389 90.389 1.00 0.00 H TER 47573 WAT 4473 ATOM 47573 O WAT 4474 21.126 117.171 111.625 1.00 0.00 O ATOM 47574 H1 WAT 4474 21.394 116.278 111.842 1.00 0.00 H ATOM 47575 H2 WAT 4474 21.704 117.426 110.906 1.00 0.00 H TER 47577 WAT 4474 ATOM 47577 O WAT 4475 100.076 0.119 150.938 1.00 0.00 O ATOM 47578 H1 WAT 4475 100.892 0.617 150.979 1.00 0.00 H ATOM 47579 H2 WAT 4475 99.595 0.382 151.722 1.00 0.00 H TER 47581 WAT 4475 ATOM 47581 O WAT 4476 58.191 112.875 59.756 1.00 0.00 O ATOM 47582 H1 WAT 4476 58.136 113.747 60.147 1.00 0.00 H ATOM 47583 H2 WAT 4476 57.628 112.923 58.983 1.00 0.00 H TER 47585 WAT 4476 ATOM 47585 O WAT 4477 125.752 54.034 140.129 1.00 0.00 O ATOM 47586 H1 WAT 4477 125.452 54.692 140.756 1.00 0.00 H ATOM 47587 H2 WAT 4477 125.050 53.382 140.112 1.00 0.00 H TER 47589 WAT 4477 ATOM 47589 O WAT 4478 23.512 5.725 65.233 1.00 0.00 O ATOM 47590 H1 WAT 4478 23.770 6.614 64.989 1.00 0.00 H ATOM 47591 H2 WAT 4478 22.786 5.516 64.645 1.00 0.00 H TER 47593 WAT 4478 ATOM 47593 O WAT 4479 145.114 28.943 131.153 1.00 0.00 O ATOM 47594 H1 WAT 4479 145.971 29.016 130.733 1.00 0.00 H ATOM 47595 H2 WAT 4479 145.306 28.622 132.034 1.00 0.00 H TER 47597 WAT 4479 ATOM 47597 O WAT 4480 53.759 31.888 5.715 1.00 0.00 O ATOM 47598 H1 WAT 4480 53.338 31.214 6.248 1.00 0.00 H ATOM 47599 H2 WAT 4480 54.646 31.954 6.068 1.00 0.00 H TER 47601 WAT 4480 ATOM 47601 O WAT 4481 40.467 48.705 78.042 1.00 0.00 O ATOM 47602 H1 WAT 4481 40.232 49.632 78.078 1.00 0.00 H ATOM 47603 H2 WAT 4481 41.025 48.629 77.268 1.00 0.00 H TER 47605 WAT 4481 ATOM 47605 O WAT 4482 34.751 89.568 20.419 1.00 0.00 O ATOM 47606 H1 WAT 4482 34.849 90.479 20.143 1.00 0.00 H ATOM 47607 H2 WAT 4482 34.769 89.604 21.376 1.00 0.00 H TER 47609 WAT 4482 ATOM 47609 O WAT 4483 123.488 106.375 4.213 1.00 0.00 O ATOM 47610 H1 WAT 4483 123.574 106.748 5.090 1.00 0.00 H ATOM 47611 H2 WAT 4483 124.088 106.890 3.673 1.00 0.00 H TER 47613 WAT 4483 ATOM 47613 O WAT 4484 53.637 35.593 5.239 1.00 0.00 O ATOM 47614 H1 WAT 4484 54.007 35.398 4.378 1.00 0.00 H ATOM 47615 H2 WAT 4484 54.373 35.499 5.843 1.00 0.00 H TER 47617 WAT 4484 ATOM 47617 O WAT 4485 20.565 8.801 102.773 1.00 0.00 O ATOM 47618 H1 WAT 4485 21.101 8.020 102.912 1.00 0.00 H ATOM 47619 H2 WAT 4485 20.770 9.077 101.880 1.00 0.00 H TER 47621 WAT 4485 ATOM 47621 O WAT 4486 98.674 97.500 84.756 1.00 0.00 O ATOM 47622 H1 WAT 4486 98.033 96.885 85.112 1.00 0.00 H ATOM 47623 H2 WAT 4486 98.978 97.996 85.517 1.00 0.00 H TER 47625 WAT 4486 ATOM 47625 O WAT 4487 1.386 77.660 133.577 1.00 0.00 O ATOM 47626 H1 WAT 4487 1.705 77.369 134.432 1.00 0.00 H ATOM 47627 H2 WAT 4487 0.769 78.363 133.779 1.00 0.00 H TER 47629 WAT 4487 ATOM 47629 O WAT 4488 14.571 44.657 148.184 1.00 0.00 O ATOM 47630 H1 WAT 4488 14.790 45.545 148.466 1.00 0.00 H ATOM 47631 H2 WAT 4488 13.901 44.368 148.803 1.00 0.00 H TER 47633 WAT 4488 ATOM 47633 O WAT 4489 75.691 28.756 104.166 1.00 0.00 O ATOM 47634 H1 WAT 4489 75.914 27.962 103.679 1.00 0.00 H ATOM 47635 H2 WAT 4489 75.756 28.499 105.086 1.00 0.00 H TER 47637 WAT 4489 ATOM 47637 O WAT 4490 99.580 139.253 68.372 1.00 0.00 O ATOM 47638 H1 WAT 4490 100.500 139.130 68.137 1.00 0.00 H ATOM 47639 H2 WAT 4490 99.466 140.203 68.402 1.00 0.00 H TER 47641 WAT 4490 ATOM 47641 O WAT 4491 75.861 95.721 126.869 1.00 0.00 O ATOM 47642 H1 WAT 4491 76.561 95.130 126.591 1.00 0.00 H ATOM 47643 H2 WAT 4491 75.570 95.369 127.710 1.00 0.00 H TER 47645 WAT 4491 ATOM 47645 O WAT 4492 29.433 13.004 140.401 1.00 0.00 O ATOM 47646 H1 WAT 4492 28.729 12.981 139.753 1.00 0.00 H ATOM 47647 H2 WAT 4492 29.590 13.936 140.551 1.00 0.00 H TER 47649 WAT 4492 ATOM 47649 O WAT 4493 111.624 67.890 21.168 1.00 0.00 O ATOM 47650 H1 WAT 4493 112.264 67.264 21.508 1.00 0.00 H ATOM 47651 H2 WAT 4493 110.838 67.738 21.692 1.00 0.00 H TER 47653 WAT 4493 ATOM 47653 O WAT 4494 11.112 111.879 92.307 1.00 0.00 O ATOM 47654 H1 WAT 4494 10.614 111.602 91.538 1.00 0.00 H ATOM 47655 H2 WAT 4494 11.952 112.172 91.955 1.00 0.00 H TER 47657 WAT 4494 ATOM 47657 O WAT 4495 43.746 54.351 152.779 1.00 0.00 O ATOM 47658 H1 WAT 4495 43.742 54.045 153.686 1.00 0.00 H ATOM 47659 H2 WAT 4495 43.738 55.305 152.848 1.00 0.00 H TER 47661 WAT 4495 ATOM 47661 O WAT 4496 116.548 39.132 131.284 1.00 0.00 O ATOM 47662 H1 WAT 4496 116.369 38.248 131.606 1.00 0.00 H ATOM 47663 H2 WAT 4496 116.533 39.046 130.330 1.00 0.00 H TER 47665 WAT 4496 ATOM 47665 O WAT 4497 55.146 108.395 74.408 1.00 0.00 O ATOM 47666 H1 WAT 4497 55.234 107.492 74.712 1.00 0.00 H ATOM 47667 H2 WAT 4497 55.581 108.918 75.081 1.00 0.00 H TER 47669 WAT 4497 ATOM 47669 O WAT 4498 112.908 135.837 112.158 1.00 0.00 O ATOM 47670 H1 WAT 4498 112.489 135.824 111.297 1.00 0.00 H ATOM 47671 H2 WAT 4498 112.320 135.331 112.718 1.00 0.00 H TER 47673 WAT 4498 ATOM 47673 O WAT 4499 64.257 81.376 67.876 1.00 0.00 O ATOM 47674 H1 WAT 4499 64.831 80.689 67.535 1.00 0.00 H ATOM 47675 H2 WAT 4499 64.854 82.012 68.272 1.00 0.00 H TER 47677 WAT 4499 ATOM 47677 O WAT 4500 59.592 113.466 93.808 1.00 0.00 O ATOM 47678 H1 WAT 4500 60.256 112.776 93.810 1.00 0.00 H ATOM 47679 H2 WAT 4500 59.522 113.733 94.724 1.00 0.00 H TER 47681 WAT 4500 ATOM 47681 O WAT 4501 123.664 83.575 2.417 1.00 0.00 O ATOM 47682 H1 WAT 4501 122.769 83.560 2.079 1.00 0.00 H ATOM 47683 H2 WAT 4501 124.204 83.788 1.655 1.00 0.00 H TER 47685 WAT 4501 ATOM 47685 O WAT 4502 69.511 120.252 83.470 1.00 0.00 O ATOM 47686 H1 WAT 4502 69.615 120.736 82.650 1.00 0.00 H ATOM 47687 H2 WAT 4502 68.571 120.078 83.526 1.00 0.00 H TER 47689 WAT 4502 ATOM 47689 O WAT 4503 60.632 136.928 84.920 1.00 0.00 O ATOM 47690 H1 WAT 4503 60.807 137.830 84.651 1.00 0.00 H ATOM 47691 H2 WAT 4503 59.795 136.975 85.383 1.00 0.00 H TER 47693 WAT 4503 ATOM 47693 O WAT 4504 62.455 130.972 95.502 1.00 0.00 O ATOM 47694 H1 WAT 4504 61.626 131.125 95.957 1.00 0.00 H ATOM 47695 H2 WAT 4504 63.095 130.854 96.204 1.00 0.00 H TER 47697 WAT 4504 ATOM 47697 O WAT 4505 110.279 70.825 1.285 1.00 0.00 O ATOM 47698 H1 WAT 4505 109.607 71.137 0.680 1.00 0.00 H ATOM 47699 H2 WAT 4505 110.334 69.884 1.116 1.00 0.00 H TER 47701 WAT 4505 ATOM 47701 O WAT 4506 17.452 8.257 158.191 1.00 0.00 O ATOM 47702 H1 WAT 4506 17.215 8.183 157.267 1.00 0.00 H ATOM 47703 H2 WAT 4506 17.269 7.392 158.557 1.00 0.00 H TER 47705 WAT 4506 ATOM 47705 O WAT 4507 38.687 18.372 146.573 1.00 0.00 O ATOM 47706 H1 WAT 4507 39.233 17.602 146.731 1.00 0.00 H ATOM 47707 H2 WAT 4507 39.310 19.070 146.368 1.00 0.00 H TER 47709 WAT 4507 ATOM 47709 O WAT 4508 117.702 69.710 135.535 1.00 0.00 O ATOM 47710 H1 WAT 4508 117.503 68.943 134.997 1.00 0.00 H ATOM 47711 H2 WAT 4508 117.333 69.504 136.393 1.00 0.00 H TER 47713 WAT 4508 ATOM 47713 O WAT 4509 73.131 82.954 87.371 1.00 0.00 O ATOM 47714 H1 WAT 4509 73.814 82.852 86.709 1.00 0.00 H ATOM 47715 H2 WAT 4509 72.819 82.064 87.533 1.00 0.00 H TER 47717 WAT 4509 ATOM 47717 O WAT 4510 55.411 78.276 86.034 1.00 0.00 O ATOM 47718 H1 WAT 4510 56.346 78.387 85.861 1.00 0.00 H ATOM 47719 H2 WAT 4510 55.374 77.832 86.881 1.00 0.00 H TER 47721 WAT 4510 ATOM 47721 O WAT 4511 135.298 92.318 58.615 1.00 0.00 O ATOM 47722 H1 WAT 4511 135.911 91.878 59.203 1.00 0.00 H ATOM 47723 H2 WAT 4511 134.831 91.605 58.178 1.00 0.00 H TER 47725 WAT 4511 ATOM 47725 O WAT 4512 28.673 120.848 95.493 1.00 0.00 O ATOM 47726 H1 WAT 4512 28.044 120.259 95.910 1.00 0.00 H ATOM 47727 H2 WAT 4512 29.301 120.265 95.067 1.00 0.00 H TER 47729 WAT 4512 ATOM 47729 O WAT 4513 98.491 4.653 67.976 1.00 0.00 O ATOM 47730 H1 WAT 4513 97.743 5.030 67.512 1.00 0.00 H ATOM 47731 H2 WAT 4513 98.570 5.182 68.770 1.00 0.00 H TER 47733 WAT 4513 ATOM 47733 O WAT 4514 35.674 81.220 10.318 1.00 0.00 O ATOM 47734 H1 WAT 4514 34.753 81.476 10.269 1.00 0.00 H ATOM 47735 H2 WAT 4514 35.715 80.612 11.056 1.00 0.00 H TER 47737 WAT 4514 ATOM 47737 O WAT 4515 65.800 17.587 2.843 1.00 0.00 O ATOM 47738 H1 WAT 4515 65.411 16.936 2.260 1.00 0.00 H ATOM 47739 H2 WAT 4515 65.081 18.186 3.047 1.00 0.00 H TER 47741 WAT 4515 ATOM 47741 O WAT 4516 95.239 115.723 121.881 1.00 0.00 O ATOM 47742 H1 WAT 4516 94.819 116.039 122.681 1.00 0.00 H ATOM 47743 H2 WAT 4516 95.088 116.418 121.240 1.00 0.00 H TER 47745 WAT 4516 ATOM 47745 O WAT 4517 5.963 65.094 127.329 1.00 0.00 O ATOM 47746 H1 WAT 4517 5.016 65.141 127.201 1.00 0.00 H ATOM 47747 H2 WAT 4517 6.217 65.984 127.574 1.00 0.00 H TER 47749 WAT 4517 ATOM 47749 O WAT 4518 123.517 111.862 105.985 1.00 0.00 O ATOM 47750 H1 WAT 4518 123.945 111.112 105.573 1.00 0.00 H ATOM 47751 H2 WAT 4518 122.666 111.527 106.267 1.00 0.00 H TER 47753 WAT 4518 ATOM 47753 O WAT 4519 120.716 79.273 141.877 1.00 0.00 O ATOM 47754 H1 WAT 4519 121.539 78.783 141.881 1.00 0.00 H ATOM 47755 H2 WAT 4519 120.433 79.257 140.963 1.00 0.00 H TER 47757 WAT 4519 ATOM 47757 O WAT 4520 46.335 0.701 111.172 1.00 0.00 O ATOM 47758 H1 WAT 4520 47.001 0.603 111.852 1.00 0.00 H ATOM 47759 H2 WAT 4520 46.261 -0.170 110.782 1.00 0.00 H TER 47761 WAT 4520 ATOM 47761 O WAT 4521 40.013 118.733 157.974 1.00 0.00 O ATOM 47762 H1 WAT 4521 40.232 117.868 158.320 1.00 0.00 H ATOM 47763 H2 WAT 4521 39.164 118.940 158.367 1.00 0.00 H TER 47765 WAT 4521 ATOM 47765 O WAT 4522 8.765 121.738 155.300 1.00 0.00 O ATOM 47766 H1 WAT 4522 9.549 121.580 154.774 1.00 0.00 H ATOM 47767 H2 WAT 4522 8.313 120.894 155.316 1.00 0.00 H TER 47769 WAT 4522 ATOM 47769 O WAT 4523 79.027 57.952 79.437 1.00 0.00 O ATOM 47770 H1 WAT 4523 78.823 57.866 78.506 1.00 0.00 H ATOM 47771 H2 WAT 4523 78.369 57.415 79.877 1.00 0.00 H TER 47773 WAT 4523 ATOM 47773 O WAT 4524 140.491 64.287 66.543 1.00 0.00 O ATOM 47774 H1 WAT 4524 139.942 65.042 66.329 1.00 0.00 H ATOM 47775 H2 WAT 4524 141.331 64.667 66.801 1.00 0.00 H TER 47777 WAT 4524 ATOM 47777 O WAT 4525 95.716 68.970 12.313 1.00 0.00 O ATOM 47778 H1 WAT 4525 96.623 68.807 12.571 1.00 0.00 H ATOM 47779 H2 WAT 4525 95.433 68.152 11.904 1.00 0.00 H TER 47781 WAT 4525 ATOM 47781 O WAT 4526 56.950 98.430 152.035 1.00 0.00 O ATOM 47782 H1 WAT 4526 56.573 97.570 151.850 1.00 0.00 H ATOM 47783 H2 WAT 4526 57.796 98.239 152.441 1.00 0.00 H TER 47785 WAT 4526 ATOM 47785 O WAT 4527 138.180 36.712 14.117 1.00 0.00 O ATOM 47786 H1 WAT 4527 137.301 36.354 14.239 1.00 0.00 H ATOM 47787 H2 WAT 4527 138.404 37.092 14.967 1.00 0.00 H TER 47789 WAT 4527 ATOM 47789 O WAT 4528 91.345 75.160 109.282 1.00 0.00 O ATOM 47790 H1 WAT 4528 91.576 74.603 110.026 1.00 0.00 H ATOM 47791 H2 WAT 4528 91.359 76.050 109.636 1.00 0.00 H TER 47793 WAT 4528 ATOM 47793 O WAT 4529 13.474 77.706 65.496 1.00 0.00 O ATOM 47794 H1 WAT 4529 12.582 77.367 65.422 1.00 0.00 H ATOM 47795 H2 WAT 4529 14.029 76.926 65.480 1.00 0.00 H TER 47797 WAT 4529 ATOM 47797 O WAT 4530 69.444 60.910 99.207 1.00 0.00 O ATOM 47798 H1 WAT 4530 69.151 61.792 99.439 1.00 0.00 H ATOM 47799 H2 WAT 4530 70.379 61.009 99.026 1.00 0.00 H TER 47801 WAT 4530 ATOM 47801 O WAT 4531 103.948 107.946 134.143 1.00 0.00 O ATOM 47802 H1 WAT 4531 103.750 108.874 134.269 1.00 0.00 H ATOM 47803 H2 WAT 4531 103.200 107.607 133.652 1.00 0.00 H TER 47805 WAT 4531 ATOM 47805 O WAT 4532 134.638 4.316 6.103 1.00 0.00 O ATOM 47806 H1 WAT 4532 135.303 4.585 6.737 1.00 0.00 H ATOM 47807 H2 WAT 4532 134.317 3.478 6.434 1.00 0.00 H TER 47809 WAT 4532 ATOM 47809 O WAT 4533 5.849 13.366 58.093 1.00 0.00 O ATOM 47810 H1 WAT 4533 5.345 13.977 58.630 1.00 0.00 H ATOM 47811 H2 WAT 4533 5.704 13.662 57.194 1.00 0.00 H TER 47813 WAT 4533 ATOM 47813 O WAT 4534 114.431 0.165 2.693 1.00 0.00 O ATOM 47814 H1 WAT 4534 113.509 -0.058 2.817 1.00 0.00 H ATOM 47815 H2 WAT 4534 114.680 0.613 3.502 1.00 0.00 H TER 47817 WAT 4534 ATOM 47817 O WAT 4535 115.975 32.050 5.388 1.00 0.00 O ATOM 47818 H1 WAT 4535 115.671 32.811 4.893 1.00 0.00 H ATOM 47819 H2 WAT 4535 115.188 31.708 5.811 1.00 0.00 H TER 47821 WAT 4535 ATOM 47821 O WAT 4536 118.588 62.197 93.352 1.00 0.00 O ATOM 47822 H1 WAT 4536 119.244 62.129 92.658 1.00 0.00 H ATOM 47823 H2 WAT 4536 118.119 61.363 93.321 1.00 0.00 H TER 47825 WAT 4536 ATOM 47825 O WAT 4537 37.325 47.205 12.407 1.00 0.00 O ATOM 47826 H1 WAT 4537 38.023 47.738 12.026 1.00 0.00 H ATOM 47827 H2 WAT 4537 36.622 47.230 11.758 1.00 0.00 H TER 47829 WAT 4537 ATOM 47829 O WAT 4538 24.072 17.286 120.502 1.00 0.00 O ATOM 47830 H1 WAT 4538 23.434 16.623 120.240 1.00 0.00 H ATOM 47831 H2 WAT 4538 24.771 16.790 120.928 1.00 0.00 H TER 47833 WAT 4538 ATOM 47833 O WAT 4539 51.234 72.988 92.252 1.00 0.00 O ATOM 47834 H1 WAT 4539 50.582 72.414 92.655 1.00 0.00 H ATOM 47835 H2 WAT 4539 51.749 73.318 92.987 1.00 0.00 H TER 47837 WAT 4539 ATOM 47837 O WAT 4540 124.896 84.773 67.564 1.00 0.00 O ATOM 47838 H1 WAT 4540 124.478 85.219 68.301 1.00 0.00 H ATOM 47839 H2 WAT 4540 124.526 85.194 66.789 1.00 0.00 H TER 47841 WAT 4540 ATOM 47841 O WAT 4541 23.585 9.087 127.194 1.00 0.00 O ATOM 47842 H1 WAT 4541 23.025 8.680 126.532 1.00 0.00 H ATOM 47843 H2 WAT 4541 24.226 8.411 127.413 1.00 0.00 H TER 47845 WAT 4541 ATOM 47845 O WAT 4542 80.320 12.322 3.077 1.00 0.00 O ATOM 47846 H1 WAT 4542 80.491 11.707 2.363 1.00 0.00 H ATOM 47847 H2 WAT 4542 81.149 12.377 3.551 1.00 0.00 H TER 47849 WAT 4542 ATOM 47849 O WAT 4543 106.204 133.467 134.291 1.00 0.00 O ATOM 47850 H1 WAT 4543 105.961 133.580 133.372 1.00 0.00 H ATOM 47851 H2 WAT 4543 106.911 134.097 134.431 1.00 0.00 H TER 47853 WAT 4543 ATOM 47853 O WAT 4544 81.738 115.211 64.582 1.00 0.00 O ATOM 47854 H1 WAT 4544 81.066 115.852 64.817 1.00 0.00 H ATOM 47855 H2 WAT 4544 81.279 114.570 64.040 1.00 0.00 H TER 47857 WAT 4544 ATOM 47857 O WAT 4545 70.699 13.632 0.608 1.00 0.00 O ATOM 47858 H1 WAT 4545 71.371 13.162 1.102 1.00 0.00 H ATOM 47859 H2 WAT 4545 69.981 13.748 1.230 1.00 0.00 H TER 47861 WAT 4545 ATOM 47861 O WAT 4546 67.538 78.614 0.083 1.00 0.00 O ATOM 47862 H1 WAT 4546 68.383 78.171 0.000 1.00 0.00 H ATOM 47863 H2 WAT 4546 67.511 78.910 0.993 1.00 0.00 H TER 47865 WAT 4546 ATOM 47865 O WAT 4547 61.131 111.917 55.697 1.00 0.00 O ATOM 47866 H1 WAT 4547 60.943 112.584 56.357 1.00 0.00 H ATOM 47867 H2 WAT 4547 61.346 112.415 54.908 1.00 0.00 H TER 47869 WAT 4547 ATOM 47869 O WAT 4548 8.401 25.775 81.885 1.00 0.00 O ATOM 47870 H1 WAT 4548 9.354 25.709 81.951 1.00 0.00 H ATOM 47871 H2 WAT 4548 8.156 25.087 81.266 1.00 0.00 H TER 47873 WAT 4548 ATOM 47873 O WAT 4549 25.290 71.284 69.157 1.00 0.00 O ATOM 47874 H1 WAT 4549 25.495 71.930 69.833 1.00 0.00 H ATOM 47875 H2 WAT 4549 25.968 71.410 68.493 1.00 0.00 H TER 47877 WAT 4549 ATOM 47877 O WAT 4550 106.982 34.037 59.009 1.00 0.00 O ATOM 47878 H1 WAT 4550 106.236 34.373 58.512 1.00 0.00 H ATOM 47879 H2 WAT 4550 107.580 33.697 58.343 1.00 0.00 H TER 47881 WAT 4550 ATOM 47881 O WAT 4551 40.549 21.382 110.125 1.00 0.00 O ATOM 47882 H1 WAT 4551 39.669 21.017 110.214 1.00 0.00 H ATOM 47883 H2 WAT 4551 41.085 20.865 110.728 1.00 0.00 H TER 47885 WAT 4551 ATOM 47885 O WAT 4552 118.400 110.760 71.116 1.00 0.00 O ATOM 47886 H1 WAT 4552 117.875 111.136 71.823 1.00 0.00 H ATOM 47887 H2 WAT 4552 117.977 111.067 70.314 1.00 0.00 H TER 47889 WAT 4552 ATOM 47889 O WAT 4553 111.796 129.208 151.736 1.00 0.00 O ATOM 47890 H1 WAT 4553 112.505 129.751 152.078 1.00 0.00 H ATOM 47891 H2 WAT 4553 111.009 129.740 151.851 1.00 0.00 H TER 47893 WAT 4553 ATOM 47893 O WAT 4554 14.852 73.152 153.143 1.00 0.00 O ATOM 47894 H1 WAT 4554 13.950 72.856 153.021 1.00 0.00 H ATOM 47895 H2 WAT 4554 14.849 74.061 152.845 1.00 0.00 H TER 47897 WAT 4554 ATOM 47897 O WAT 4555 57.243 107.734 103.474 1.00 0.00 O ATOM 47898 H1 WAT 4555 57.295 106.816 103.210 1.00 0.00 H ATOM 47899 H2 WAT 4555 57.453 108.224 102.679 1.00 0.00 H TER 47901 WAT 4555 ATOM 47901 O WAT 4556 107.087 29.841 110.678 1.00 0.00 O ATOM 47902 H1 WAT 4556 108.038 29.931 110.747 1.00 0.00 H ATOM 47903 H2 WAT 4556 106.826 30.525 110.061 1.00 0.00 H TER 47905 WAT 4556 ATOM 47905 O WAT 4557 24.685 137.246 156.858 1.00 0.00 O ATOM 47906 H1 WAT 4557 23.988 136.605 157.000 1.00 0.00 H ATOM 47907 H2 WAT 4557 25.135 137.302 157.700 1.00 0.00 H TER 47909 WAT 4557 ATOM 47909 O WAT 4558 30.031 68.357 113.029 1.00 0.00 O ATOM 47910 H1 WAT 4558 30.404 67.485 112.896 1.00 0.00 H ATOM 47911 H2 WAT 4558 30.054 68.485 113.977 1.00 0.00 H TER 47913 WAT 4558 ATOM 47913 O WAT 4559 97.675 67.519 83.103 1.00 0.00 O ATOM 47914 H1 WAT 4559 97.607 66.567 83.181 1.00 0.00 H ATOM 47915 H2 WAT 4559 97.791 67.825 84.003 1.00 0.00 H TER 47917 WAT 4559 ATOM 47917 O WAT 4560 79.351 132.234 74.769 1.00 0.00 O ATOM 47918 H1 WAT 4560 79.464 131.287 74.843 1.00 0.00 H ATOM 47919 H2 WAT 4560 80.227 132.592 74.917 1.00 0.00 H TER 47921 WAT 4560 ATOM 47921 O WAT 4561 26.258 142.917 76.765 1.00 0.00 O ATOM 47922 H1 WAT 4561 25.680 143.357 76.142 1.00 0.00 H ATOM 47923 H2 WAT 4561 26.460 143.586 77.419 1.00 0.00 H TER 47925 WAT 4561 ATOM 47925 O WAT 4562 103.740 140.503 151.285 1.00 0.00 O ATOM 47926 H1 WAT 4562 102.955 140.196 150.832 1.00 0.00 H ATOM 47927 H2 WAT 4562 103.814 141.425 151.039 1.00 0.00 H TER 47929 WAT 4562 ATOM 47929 O WAT 4563 130.078 66.471 85.915 1.00 0.00 O ATOM 47930 H1 WAT 4563 131.009 66.308 86.065 1.00 0.00 H ATOM 47931 H2 WAT 4563 129.631 65.817 86.453 1.00 0.00 H TER 47933 WAT 4563 ATOM 47933 O WAT 4564 57.085 21.516 76.235 1.00 0.00 O ATOM 47934 H1 WAT 4564 57.588 21.519 75.420 1.00 0.00 H ATOM 47935 H2 WAT 4564 56.466 20.793 76.131 1.00 0.00 H TER 47937 WAT 4564 ATOM 47937 O WAT 4565 9.762 60.807 139.535 1.00 0.00 O ATOM 47938 H1 WAT 4565 9.653 59.894 139.803 1.00 0.00 H ATOM 47939 H2 WAT 4565 8.945 61.023 139.085 1.00 0.00 H TER 47941 WAT 4565 ATOM 47941 O WAT 4566 67.705 23.524 147.705 1.00 0.00 O ATOM 47942 H1 WAT 4566 68.240 23.533 146.911 1.00 0.00 H ATOM 47943 H2 WAT 4566 68.337 23.434 148.418 1.00 0.00 H TER 47945 WAT 4566 ATOM 47945 O WAT 4567 79.301 107.890 125.491 1.00 0.00 O ATOM 47946 H1 WAT 4567 79.057 106.988 125.282 1.00 0.00 H ATOM 47947 H2 WAT 4567 79.925 107.809 126.211 1.00 0.00 H TER 47949 WAT 4567 ATOM 47949 O WAT 4568 53.570 125.030 131.706 1.00 0.00 O ATOM 47950 H1 WAT 4568 54.044 125.328 130.929 1.00 0.00 H ATOM 47951 H2 WAT 4568 53.161 125.822 132.056 1.00 0.00 H TER 47953 WAT 4568 ATOM 47953 O WAT 4569 93.760 54.196 155.514 1.00 0.00 O ATOM 47954 H1 WAT 4569 93.906 55.079 155.175 1.00 0.00 H ATOM 47955 H2 WAT 4569 93.921 54.270 156.454 1.00 0.00 H TER 47957 WAT 4569 ATOM 47957 O WAT 4570 97.938 37.447 150.457 1.00 0.00 O ATOM 47958 H1 WAT 4570 98.383 37.434 151.304 1.00 0.00 H ATOM 47959 H2 WAT 4570 97.450 36.624 150.429 1.00 0.00 H TER 47961 WAT 4570 ATOM 47961 O WAT 4571 133.944 96.788 143.794 1.00 0.00 O ATOM 47962 H1 WAT 4571 134.298 97.014 142.934 1.00 0.00 H ATOM 47963 H2 WAT 4571 133.268 97.446 143.955 1.00 0.00 H TER 47965 WAT 4571 ATOM 47965 O WAT 4572 89.879 141.981 11.190 1.00 0.00 O ATOM 47966 H1 WAT 4572 89.660 142.768 10.690 1.00 0.00 H ATOM 47967 H2 WAT 4572 89.520 141.261 10.671 1.00 0.00 H TER 47969 WAT 4572 ATOM 47969 O WAT 4573 58.312 60.771 119.574 1.00 0.00 O ATOM 47970 H1 WAT 4573 57.494 60.711 120.068 1.00 0.00 H ATOM 47971 H2 WAT 4573 58.744 61.551 119.921 1.00 0.00 H TER 47973 WAT 4573 ATOM 47973 O WAT 4574 106.484 48.664 116.475 1.00 0.00 O ATOM 47974 H1 WAT 4574 106.308 48.813 115.546 1.00 0.00 H ATOM 47975 H2 WAT 4574 107.246 49.211 116.666 1.00 0.00 H TER 47977 WAT 4574 ATOM 47977 O WAT 4575 1.772 33.279 152.519 1.00 0.00 O ATOM 47978 H1 WAT 4575 1.037 32.756 152.839 1.00 0.00 H ATOM 47979 H2 WAT 4575 1.366 33.963 151.986 1.00 0.00 H TER 47981 WAT 4575 ATOM 47981 O WAT 4576 20.203 54.152 91.748 1.00 0.00 O ATOM 47982 H1 WAT 4576 19.955 54.115 92.671 1.00 0.00 H ATOM 47983 H2 WAT 4576 20.857 54.851 91.704 1.00 0.00 H TER 47985 WAT 4576 ATOM 47985 O WAT 4577 23.122 67.979 143.140 1.00 0.00 O ATOM 47986 H1 WAT 4577 23.489 68.836 143.359 1.00 0.00 H ATOM 47987 H2 WAT 4577 23.670 67.355 143.616 1.00 0.00 H TER 47989 WAT 4577 ATOM 47989 O WAT 4578 9.319 71.435 133.341 1.00 0.00 O ATOM 47990 H1 WAT 4578 8.537 71.947 133.547 1.00 0.00 H ATOM 47991 H2 WAT 4578 10.048 71.990 133.618 1.00 0.00 H TER 47993 WAT 4578 ATOM 47993 O WAT 4579 113.453 75.098 123.106 1.00 0.00 O ATOM 47994 H1 WAT 4579 113.008 75.916 122.883 1.00 0.00 H ATOM 47995 H2 WAT 4579 113.480 74.609 122.284 1.00 0.00 H TER 47997 WAT 4579 ATOM 47997 O WAT 4580 125.100 71.513 101.785 1.00 0.00 O ATOM 47998 H1 WAT 4580 125.376 71.164 102.632 1.00 0.00 H ATOM 47999 H2 WAT 4580 125.880 71.450 101.234 1.00 0.00 H TER 48001 WAT 4580 ATOM 48001 O WAT 4581 116.265 9.298 104.803 1.00 0.00 O ATOM 48002 H1 WAT 4581 116.578 8.547 105.307 1.00 0.00 H ATOM 48003 H2 WAT 4581 117.050 9.644 104.377 1.00 0.00 H TER 48005 WAT 4581 ATOM 48005 O WAT 4582 91.316 105.320 89.179 1.00 0.00 O ATOM 48006 H1 WAT 4582 90.772 104.804 89.774 1.00 0.00 H ATOM 48007 H2 WAT 4582 91.835 104.671 88.705 1.00 0.00 H TER 48009 WAT 4582 ATOM 48009 O WAT 4583 31.849 79.993 0.520 1.00 0.00 O ATOM 48010 H1 WAT 4583 31.917 80.870 0.895 1.00 0.00 H ATOM 48011 H2 WAT 4583 31.393 79.481 1.188 1.00 0.00 H TER 48013 WAT 4583 ATOM 48013 O WAT 4584 35.771 72.388 124.689 1.00 0.00 O ATOM 48014 H1 WAT 4584 35.547 71.861 125.456 1.00 0.00 H ATOM 48015 H2 WAT 4584 34.973 72.393 124.160 1.00 0.00 H TER 48017 WAT 4584 ATOM 48017 O WAT 4585 65.723 38.590 99.792 1.00 0.00 O ATOM 48018 H1 WAT 4585 65.214 38.157 99.106 1.00 0.00 H ATOM 48019 H2 WAT 4585 66.619 38.279 99.658 1.00 0.00 H TER 48021 WAT 4585 ATOM 48021 O WAT 4586 15.994 106.332 108.671 1.00 0.00 O ATOM 48022 H1 WAT 4586 15.769 106.751 109.502 1.00 0.00 H ATOM 48023 H2 WAT 4586 15.240 106.501 108.106 1.00 0.00 H TER 48025 WAT 4586 ATOM 48025 O WAT 4587 68.320 119.013 7.469 1.00 0.00 O ATOM 48026 H1 WAT 4587 69.137 119.512 7.483 1.00 0.00 H ATOM 48027 H2 WAT 4587 68.189 118.743 8.378 1.00 0.00 H TER 48029 WAT 4587 ATOM 48029 O WAT 4588 86.876 4.791 70.509 1.00 0.00 O ATOM 48030 H1 WAT 4588 86.660 5.719 70.422 1.00 0.00 H ATOM 48031 H2 WAT 4588 87.780 4.783 70.823 1.00 0.00 H TER 48033 WAT 4588 ATOM 48033 O WAT 4589 8.194 45.419 103.649 1.00 0.00 O ATOM 48034 H1 WAT 4589 8.714 45.809 104.351 1.00 0.00 H ATOM 48035 H2 WAT 4589 8.081 46.125 103.014 1.00 0.00 H TER 48037 WAT 4589 ATOM 48037 O WAT 4590 101.181 12.837 1.639 1.00 0.00 O ATOM 48038 H1 WAT 4590 101.598 12.151 2.159 1.00 0.00 H ATOM 48039 H2 WAT 4590 100.261 12.575 1.591 1.00 0.00 H TER 48041 WAT 4590 ATOM 48041 O WAT 4591 69.853 99.533 99.363 1.00 0.00 O ATOM 48042 H1 WAT 4591 70.453 99.595 100.106 1.00 0.00 H ATOM 48043 H2 WAT 4591 69.485 100.412 99.278 1.00 0.00 H TER 48045 WAT 4591 ATOM 48045 O WAT 4592 14.460 89.587 12.759 1.00 0.00 O ATOM 48046 H1 WAT 4592 14.269 89.245 13.632 1.00 0.00 H ATOM 48047 H2 WAT 4592 15.118 88.988 12.406 1.00 0.00 H TER 48049 WAT 4592 ATOM 48049 O WAT 4593 34.310 22.189 76.366 1.00 0.00 O ATOM 48050 H1 WAT 4593 34.274 23.085 76.031 1.00 0.00 H ATOM 48051 H2 WAT 4593 35.003 21.770 75.856 1.00 0.00 H TER 48053 WAT 4593 ATOM 48053 O WAT 4594 14.798 4.619 86.465 1.00 0.00 O ATOM 48054 H1 WAT 4594 13.960 4.197 86.274 1.00 0.00 H ATOM 48055 H2 WAT 4594 14.654 5.542 86.258 1.00 0.00 H TER 48057 WAT 4594 ATOM 48057 O WAT 4595 60.792 50.700 93.294 1.00 0.00 O ATOM 48058 H1 WAT 4595 61.572 50.212 93.032 1.00 0.00 H ATOM 48059 H2 WAT 4595 60.206 50.640 92.539 1.00 0.00 H TER 48061 WAT 4595 ATOM 48061 O WAT 4596 130.210 92.945 143.523 1.00 0.00 O ATOM 48062 H1 WAT 4596 130.709 92.344 142.970 1.00 0.00 H ATOM 48063 H2 WAT 4596 129.304 92.644 143.448 1.00 0.00 H TER 48065 WAT 4596 ATOM 48065 O WAT 4597 29.584 140.520 50.161 1.00 0.00 O ATOM 48066 H1 WAT 4597 29.146 141.214 49.669 1.00 0.00 H ATOM 48067 H2 WAT 4597 30.144 140.985 50.783 1.00 0.00 H TER 48069 WAT 4597 ATOM 48069 O WAT 4598 95.553 46.714 70.696 1.00 0.00 O ATOM 48070 H1 WAT 4598 95.454 45.969 71.289 1.00 0.00 H ATOM 48071 H2 WAT 4598 96.243 47.246 71.092 1.00 0.00 H TER 48073 WAT 4598 ATOM 48073 O WAT 4599 2.941 107.204 62.925 1.00 0.00 O ATOM 48074 H1 WAT 4599 3.582 106.717 62.406 1.00 0.00 H ATOM 48075 H2 WAT 4599 2.159 106.653 62.919 1.00 0.00 H TER 48077 WAT 4599 ATOM 48077 O WAT 4600 65.613 99.415 116.579 1.00 0.00 O ATOM 48078 H1 WAT 4600 65.128 99.866 117.270 1.00 0.00 H ATOM 48079 H2 WAT 4600 65.948 100.119 116.023 1.00 0.00 H TER 48081 WAT 4600 ATOM 48081 O WAT 4601 71.330 134.624 93.213 1.00 0.00 O ATOM 48082 H1 WAT 4601 71.964 135.339 93.165 1.00 0.00 H ATOM 48083 H2 WAT 4601 71.783 133.934 93.697 1.00 0.00 H TER 48085 WAT 4601 ATOM 48085 O WAT 4602 74.459 127.821 84.266 1.00 0.00 O ATOM 48086 H1 WAT 4602 73.547 127.823 84.558 1.00 0.00 H ATOM 48087 H2 WAT 4602 74.412 127.589 83.338 1.00 0.00 H TER 48089 WAT 4602 ATOM 48089 O WAT 4603 41.274 142.146 91.467 1.00 0.00 O ATOM 48090 H1 WAT 4603 41.247 142.276 90.519 1.00 0.00 H ATOM 48091 H2 WAT 4603 41.812 142.868 91.792 1.00 0.00 H TER 48093 WAT 4603 ATOM 48093 O WAT 4604 82.735 87.109 142.619 1.00 0.00 O ATOM 48094 H1 WAT 4604 82.507 86.228 142.323 1.00 0.00 H ATOM 48095 H2 WAT 4604 83.131 86.977 143.481 1.00 0.00 H TER 48097 WAT 4604 ATOM 48097 O WAT 4605 135.572 102.007 152.653 1.00 0.00 O ATOM 48098 H1 WAT 4605 135.789 102.152 151.732 1.00 0.00 H ATOM 48099 H2 WAT 4605 136.415 102.044 153.106 1.00 0.00 H TER 48101 WAT 4605 ATOM 48101 O WAT 4606 41.499 123.011 10.004 1.00 0.00 O ATOM 48102 H1 WAT 4606 41.865 123.843 10.305 1.00 0.00 H ATOM 48103 H2 WAT 4606 42.223 122.389 10.083 1.00 0.00 H TER 48105 WAT 4606 ATOM 48105 O WAT 4607 39.694 40.018 72.748 1.00 0.00 O ATOM 48106 H1 WAT 4607 40.486 39.973 73.284 1.00 0.00 H ATOM 48107 H2 WAT 4607 39.042 40.428 73.316 1.00 0.00 H TER 48109 WAT 4607 ATOM 48109 O WAT 4608 132.439 140.257 97.904 1.00 0.00 O ATOM 48110 H1 WAT 4608 133.341 139.952 98.004 1.00 0.00 H ATOM 48111 H2 WAT 4608 132.286 140.245 96.959 1.00 0.00 H TER 48113 WAT 4608 ATOM 48113 O WAT 4609 34.628 19.001 1.761 1.00 0.00 O ATOM 48114 H1 WAT 4609 34.062 18.455 2.306 1.00 0.00 H ATOM 48115 H2 WAT 4609 35.182 18.377 1.291 1.00 0.00 H TER 48117 WAT 4609 ATOM 48117 O WAT 4610 31.727 60.301 3.030 1.00 0.00 O ATOM 48118 H1 WAT 4610 30.927 59.779 2.958 1.00 0.00 H ATOM 48119 H2 WAT 4610 32.216 60.103 2.232 1.00 0.00 H TER 48121 WAT 4610 ATOM 48121 O WAT 4611 87.583 3.149 153.057 1.00 0.00 O ATOM 48122 H1 WAT 4611 87.892 2.731 152.253 1.00 0.00 H ATOM 48123 H2 WAT 4611 86.632 3.184 152.958 1.00 0.00 H TER 48125 WAT 4611 ATOM 48125 O WAT 4612 15.530 62.361 103.614 1.00 0.00 O ATOM 48126 H1 WAT 4612 15.766 61.741 104.304 1.00 0.00 H ATOM 48127 H2 WAT 4612 16.304 62.916 103.516 1.00 0.00 H TER 48129 WAT 4612 ATOM 48129 O WAT 4613 104.222 136.147 143.336 1.00 0.00 O ATOM 48130 H1 WAT 4613 104.891 135.481 143.496 1.00 0.00 H ATOM 48131 H2 WAT 4613 103.828 136.302 144.194 1.00 0.00 H TER 48133 WAT 4613 ATOM 48133 O WAT 4614 91.008 22.147 146.937 1.00 0.00 O ATOM 48134 H1 WAT 4614 91.026 23.088 146.764 1.00 0.00 H ATOM 48135 H2 WAT 4614 91.657 22.018 147.630 1.00 0.00 H TER 48137 WAT 4614 ATOM 48137 O WAT 4615 2.827 58.710 131.602 1.00 0.00 O ATOM 48138 H1 WAT 4615 3.464 59.374 131.868 1.00 0.00 H ATOM 48139 H2 WAT 4615 1.995 59.181 131.557 1.00 0.00 H TER 48141 WAT 4615 ATOM 48141 O WAT 4616 123.814 36.969 96.390 1.00 0.00 O ATOM 48142 H1 WAT 4616 123.984 36.350 95.681 1.00 0.00 H ATOM 48143 H2 WAT 4616 124.366 37.724 96.186 1.00 0.00 H TER 48145 WAT 4616 ATOM 48145 O WAT 4617 128.859 45.423 140.353 1.00 0.00 O ATOM 48146 H1 WAT 4617 128.283 44.661 140.302 1.00 0.00 H ATOM 48147 H2 WAT 4617 129.364 45.397 139.540 1.00 0.00 H TER 48149 WAT 4617 ATOM 48149 O WAT 4618 11.768 71.678 74.062 1.00 0.00 O ATOM 48150 H1 WAT 4618 11.308 70.842 74.139 1.00 0.00 H ATOM 48151 H2 WAT 4618 12.682 71.468 74.255 1.00 0.00 H TER 48153 WAT 4618 ATOM 48153 O WAT 4619 117.033 129.176 78.011 1.00 0.00 O ATOM 48154 H1 WAT 4619 116.500 128.777 78.699 1.00 0.00 H ATOM 48155 H2 WAT 4619 117.720 128.532 77.837 1.00 0.00 H TER 48157 WAT 4619 ATOM 48157 O WAT 4620 58.441 84.382 138.442 1.00 0.00 O ATOM 48158 H1 WAT 4620 59.108 84.130 137.804 1.00 0.00 H ATOM 48159 H2 WAT 4620 58.830 85.116 138.918 1.00 0.00 H TER 48161 WAT 4620 ATOM 48161 O WAT 4621 95.110 139.069 8.599 1.00 0.00 O ATOM 48162 H1 WAT 4621 95.027 138.536 7.809 1.00 0.00 H ATOM 48163 H2 WAT 4621 95.301 138.440 9.294 1.00 0.00 H TER 48165 WAT 4621 ATOM 48165 O WAT 4622 14.701 71.157 143.180 1.00 0.00 O ATOM 48166 H1 WAT 4622 14.189 70.856 143.931 1.00 0.00 H ATOM 48167 H2 WAT 4622 15.563 70.757 143.302 1.00 0.00 H TER 48169 WAT 4622 ATOM 48169 O WAT 4623 10.749 143.412 84.129 1.00 0.00 O ATOM 48170 H1 WAT 4623 10.608 142.496 84.369 1.00 0.00 H ATOM 48171 H2 WAT 4623 11.624 143.425 83.739 1.00 0.00 H TER 48173 WAT 4623 ATOM 48173 O WAT 4624 86.617 137.352 62.889 1.00 0.00 O ATOM 48174 H1 WAT 4624 86.306 138.204 62.582 1.00 0.00 H ATOM 48175 H2 WAT 4624 85.861 136.773 62.793 1.00 0.00 H TER 48177 WAT 4624 ATOM 48177 O WAT 4625 107.438 84.925 141.340 1.00 0.00 O ATOM 48178 H1 WAT 4625 107.986 84.252 141.745 1.00 0.00 H ATOM 48179 H2 WAT 4625 106.546 84.589 141.421 1.00 0.00 H TER 48181 WAT 4625 ATOM 48181 O WAT 4626 64.765 32.451 89.041 1.00 0.00 O ATOM 48182 H1 WAT 4626 65.522 32.057 88.609 1.00 0.00 H ATOM 48183 H2 WAT 4626 64.127 32.576 88.339 1.00 0.00 H TER 48185 WAT 4626 ATOM 48185 O WAT 4627 73.178 40.201 111.345 1.00 0.00 O ATOM 48186 H1 WAT 4627 74.087 40.011 111.576 1.00 0.00 H ATOM 48187 H2 WAT 4627 73.106 41.153 111.417 1.00 0.00 H TER 48189 WAT 4627 ATOM 48189 O WAT 4628 59.272 141.375 1.809 1.00 0.00 O ATOM 48190 H1 WAT 4628 59.303 142.285 2.103 1.00 0.00 H ATOM 48191 H2 WAT 4628 58.983 140.884 2.578 1.00 0.00 H TER 48193 WAT 4628 ATOM 48193 O WAT 4629 115.710 44.832 108.802 1.00 0.00 O ATOM 48194 H1 WAT 4629 116.091 43.975 108.610 1.00 0.00 H ATOM 48195 H2 WAT 4629 115.683 45.278 107.955 1.00 0.00 H TER 48197 WAT 4629 ATOM 48197 O WAT 4630 115.467 78.026 128.394 1.00 0.00 O ATOM 48198 H1 WAT 4630 115.251 78.893 128.739 1.00 0.00 H ATOM 48199 H2 WAT 4630 116.362 78.115 128.066 1.00 0.00 H TER 48201 WAT 4630 ATOM 48201 O WAT 4631 107.426 4.758 104.523 1.00 0.00 O ATOM 48202 H1 WAT 4631 106.948 5.194 103.817 1.00 0.00 H ATOM 48203 H2 WAT 4631 108.148 5.352 104.725 1.00 0.00 H TER 48205 WAT 4631 ATOM 48205 O WAT 4632 124.647 35.640 114.021 1.00 0.00 O ATOM 48206 H1 WAT 4632 125.002 35.359 113.178 1.00 0.00 H ATOM 48207 H2 WAT 4632 123.805 35.190 114.089 1.00 0.00 H TER 48209 WAT 4632 ATOM 48209 O WAT 4633 98.157 3.626 149.202 1.00 0.00 O ATOM 48210 H1 WAT 4633 98.200 2.677 149.321 1.00 0.00 H ATOM 48211 H2 WAT 4633 97.344 3.771 148.719 1.00 0.00 H TER 48213 WAT 4633 ATOM 48213 O WAT 4634 38.477 44.852 141.253 1.00 0.00 O ATOM 48214 H1 WAT 4634 39.025 45.359 141.853 1.00 0.00 H ATOM 48215 H2 WAT 4634 38.387 43.998 141.675 1.00 0.00 H TER 48217 WAT 4634 ATOM 48217 O WAT 4635 70.346 27.382 143.531 1.00 0.00 O ATOM 48218 H1 WAT 4635 69.719 28.102 143.591 1.00 0.00 H ATOM 48219 H2 WAT 4635 70.356 27.151 142.602 1.00 0.00 H TER 48221 WAT 4635 ATOM 48221 O WAT 4636 12.643 74.449 111.520 1.00 0.00 O ATOM 48222 H1 WAT 4636 12.266 74.880 110.753 1.00 0.00 H ATOM 48223 H2 WAT 4636 13.563 74.714 111.515 1.00 0.00 H TER 48225 WAT 4636 ATOM 48225 O WAT 4637 3.403 26.438 53.821 1.00 0.00 O ATOM 48226 H1 WAT 4637 3.870 25.605 53.879 1.00 0.00 H ATOM 48227 H2 WAT 4637 4.060 27.098 54.044 1.00 0.00 H TER 48229 WAT 4637 ATOM 48229 O WAT 4638 17.427 20.251 123.227 1.00 0.00 O ATOM 48230 H1 WAT 4638 16.840 19.610 122.825 1.00 0.00 H ATOM 48231 H2 WAT 4638 18.074 19.722 123.694 1.00 0.00 H TER 48233 WAT 4638 ATOM 48233 O WAT 4639 72.404 21.321 50.633 1.00 0.00 O ATOM 48234 H1 WAT 4639 73.237 20.973 50.316 1.00 0.00 H ATOM 48235 H2 WAT 4639 72.065 20.640 51.213 1.00 0.00 H TER 48237 WAT 4639 ATOM 48237 O WAT 4640 1.128 30.000 123.204 1.00 0.00 O ATOM 48238 H1 WAT 4640 1.320 30.247 122.299 1.00 0.00 H ATOM 48239 H2 WAT 4640 1.101 29.044 123.191 1.00 0.00 H TER 48241 WAT 4640 ATOM 48241 O WAT 4641 110.805 74.014 109.147 1.00 0.00 O ATOM 48242 H1 WAT 4641 109.977 74.192 108.701 1.00 0.00 H ATOM 48243 H2 WAT 4641 111.360 73.621 108.474 1.00 0.00 H TER 48245 WAT 4641 ATOM 48245 O WAT 4642 98.269 145.092 61.365 1.00 0.00 O ATOM 48246 H1 WAT 4642 97.382 145.447 61.305 1.00 0.00 H ATOM 48247 H2 WAT 4642 98.507 144.889 60.460 1.00 0.00 H TER 48249 WAT 4642 ATOM 48249 O WAT 4643 41.094 96.686 157.634 1.00 0.00 O ATOM 48250 H1 WAT 4643 40.445 96.858 158.317 1.00 0.00 H ATOM 48251 H2 WAT 4643 41.722 97.404 157.715 1.00 0.00 H TER 48253 WAT 4643 ATOM 48253 O WAT 4644 126.111 108.043 110.432 1.00 0.00 O ATOM 48254 H1 WAT 4644 125.314 108.473 110.121 1.00 0.00 H ATOM 48255 H2 WAT 4644 126.531 107.714 109.637 1.00 0.00 H TER 48257 WAT 4644 ATOM 48257 O WAT 4645 63.236 117.563 55.400 1.00 0.00 O ATOM 48258 H1 WAT 4645 62.719 116.759 55.455 1.00 0.00 H ATOM 48259 H2 WAT 4645 62.609 118.233 55.128 1.00 0.00 H TER 48261 WAT 4645 ATOM 48261 O WAT 4646 42.044 65.416 57.285 1.00 0.00 O ATOM 48262 H1 WAT 4646 42.090 66.371 57.332 1.00 0.00 H ATOM 48263 H2 WAT 4646 41.924 65.136 58.192 1.00 0.00 H TER 48265 WAT 4646 ATOM 48265 O WAT 4647 112.818 101.835 109.259 1.00 0.00 O ATOM 48266 H1 WAT 4647 113.703 101.559 109.495 1.00 0.00 H ATOM 48267 H2 WAT 4647 112.354 101.020 109.071 1.00 0.00 H TER 48269 WAT 4647 ATOM 48269 O WAT 4648 13.709 92.745 105.730 1.00 0.00 O ATOM 48270 H1 WAT 4648 13.141 93.516 105.732 1.00 0.00 H ATOM 48271 H2 WAT 4648 14.597 93.102 105.733 1.00 0.00 H TER 48273 WAT 4648 ATOM 48273 O WAT 4649 118.883 117.590 109.699 1.00 0.00 O ATOM 48274 H1 WAT 4649 118.765 116.703 109.358 1.00 0.00 H ATOM 48275 H2 WAT 4649 118.706 117.513 110.636 1.00 0.00 H TER 48277 WAT 4649 ATOM 48277 O WAT 4650 95.649 5.944 9.824 1.00 0.00 O ATOM 48278 H1 WAT 4650 94.970 5.874 10.494 1.00 0.00 H ATOM 48279 H2 WAT 4650 95.190 6.278 9.053 1.00 0.00 H TER 48281 WAT 4650 ATOM 48281 O WAT 4651 20.772 127.973 61.343 1.00 0.00 O ATOM 48282 H1 WAT 4651 20.728 128.197 62.273 1.00 0.00 H ATOM 48283 H2 WAT 4651 20.639 127.025 61.319 1.00 0.00 H TER 48285 WAT 4651 ATOM 48285 O WAT 4652 114.762 71.716 8.566 1.00 0.00 O ATOM 48286 H1 WAT 4652 114.427 72.004 7.717 1.00 0.00 H ATOM 48287 H2 WAT 4652 114.191 72.141 9.206 1.00 0.00 H TER 48289 WAT 4652 ATOM 48289 O WAT 4653 121.838 4.389 72.379 1.00 0.00 O ATOM 48290 H1 WAT 4653 122.440 4.044 73.038 1.00 0.00 H ATOM 48291 H2 WAT 4653 122.233 4.142 71.542 1.00 0.00 H TER 48293 WAT 4653 ATOM 48293 O WAT 4654 81.092 116.559 121.349 1.00 0.00 O ATOM 48294 H1 WAT 4654 80.471 115.855 121.536 1.00 0.00 H ATOM 48295 H2 WAT 4654 81.501 116.748 122.193 1.00 0.00 H TER 48297 WAT 4654 ATOM 48297 O WAT 4655 73.026 76.971 126.035 1.00 0.00 O ATOM 48298 H1 WAT 4655 72.444 77.624 126.422 1.00 0.00 H ATOM 48299 H2 WAT 4655 73.213 77.306 125.157 1.00 0.00 H TER 48301 WAT 4655 ATOM 48301 O WAT 4656 103.076 89.567 114.622 1.00 0.00 O ATOM 48302 H1 WAT 4656 102.754 89.192 113.802 1.00 0.00 H ATOM 48303 H2 WAT 4656 104.029 89.505 114.557 1.00 0.00 H TER 48305 WAT 4656 ATOM 48305 O WAT 4657 70.743 127.838 132.616 1.00 0.00 O ATOM 48306 H1 WAT 4657 70.488 128.717 132.898 1.00 0.00 H ATOM 48307 H2 WAT 4657 71.427 127.578 133.233 1.00 0.00 H TER 48309 WAT 4657 ATOM 48309 O WAT 4658 27.680 142.981 25.130 1.00 0.00 O ATOM 48310 H1 WAT 4658 28.101 142.129 25.020 1.00 0.00 H ATOM 48311 H2 WAT 4658 26.874 142.791 25.609 1.00 0.00 H TER 48313 WAT 4658 ATOM 48313 O WAT 4659 0.673 110.622 62.840 1.00 0.00 O ATOM 48314 H1 WAT 4659 0.167 110.913 62.082 1.00 0.00 H ATOM 48315 H2 WAT 4659 1.470 110.247 62.466 1.00 0.00 H TER 48317 WAT 4659 ATOM 48317 O WAT 4660 48.892 55.688 12.424 1.00 0.00 O ATOM 48318 H1 WAT 4660 48.771 55.621 11.477 1.00 0.00 H ATOM 48319 H2 WAT 4660 48.574 56.564 12.644 1.00 0.00 H TER 48321 WAT 4660 ATOM 48321 O WAT 4661 110.114 79.444 124.209 1.00 0.00 O ATOM 48322 H1 WAT 4661 109.853 80.272 123.807 1.00 0.00 H ATOM 48323 H2 WAT 4661 109.300 79.081 124.560 1.00 0.00 H TER 48325 WAT 4661 ATOM 48325 O WAT 4662 9.037 68.239 147.105 1.00 0.00 O ATOM 48326 H1 WAT 4662 8.403 68.698 146.554 1.00 0.00 H ATOM 48327 H2 WAT 4662 8.503 67.695 147.684 1.00 0.00 H TER 48329 WAT 4662 ATOM 48329 O WAT 4663 70.156 108.517 109.026 1.00 0.00 O ATOM 48330 H1 WAT 4663 70.012 108.561 108.081 1.00 0.00 H ATOM 48331 H2 WAT 4663 71.108 108.475 109.121 1.00 0.00 H TER 48333 WAT 4663 ATOM 48333 O WAT 4664 56.066 32.155 81.547 1.00 0.00 O ATOM 48334 H1 WAT 4664 57.008 32.158 81.718 1.00 0.00 H ATOM 48335 H2 WAT 4664 55.991 31.921 80.622 1.00 0.00 H TER 48337 WAT 4664 ATOM 48337 O WAT 4665 57.010 27.899 123.757 1.00 0.00 O ATOM 48338 H1 WAT 4665 57.722 27.288 123.946 1.00 0.00 H ATOM 48339 H2 WAT 4665 57.445 28.665 123.383 1.00 0.00 H TER 48341 WAT 4665 ATOM 48341 O WAT 4666 69.552 32.495 131.426 1.00 0.00 O ATOM 48342 H1 WAT 4666 70.025 32.028 130.737 1.00 0.00 H ATOM 48343 H2 WAT 4666 68.905 31.865 131.742 1.00 0.00 H TER 48345 WAT 4666 ATOM 48345 O WAT 4667 136.385 97.450 129.170 1.00 0.00 O ATOM 48346 H1 WAT 4667 136.264 97.375 128.223 1.00 0.00 H ATOM 48347 H2 WAT 4667 137.198 97.945 129.269 1.00 0.00 H TER 48349 WAT 4667 ATOM 48349 O WAT 4668 3.000 21.678 118.975 1.00 0.00 O ATOM 48350 H1 WAT 4668 3.779 22.087 118.599 1.00 0.00 H ATOM 48351 H2 WAT 4668 2.688 22.310 119.623 1.00 0.00 H TER 48353 WAT 4668 ATOM 48353 O WAT 4669 69.768 115.379 139.961 1.00 0.00 O ATOM 48354 H1 WAT 4669 69.679 115.070 139.060 1.00 0.00 H ATOM 48355 H2 WAT 4669 69.251 114.761 140.479 1.00 0.00 H TER 48357 WAT 4669 ATOM 48357 O WAT 4670 115.629 94.999 14.727 1.00 0.00 O ATOM 48358 H1 WAT 4670 115.469 95.911 14.967 1.00 0.00 H ATOM 48359 H2 WAT 4670 115.416 94.502 15.517 1.00 0.00 H TER 48361 WAT 4670 ATOM 48361 O WAT 4671 27.104 34.757 153.757 1.00 0.00 O ATOM 48362 H1 WAT 4671 27.684 34.184 154.258 1.00 0.00 H ATOM 48363 H2 WAT 4671 26.223 34.444 153.960 1.00 0.00 H TER 48365 WAT 4671 ATOM 48365 O WAT 4672 84.544 48.451 105.078 1.00 0.00 O ATOM 48366 H1 WAT 4672 85.312 47.938 105.331 1.00 0.00 H ATOM 48367 H2 WAT 4672 84.241 48.848 105.895 1.00 0.00 H TER 48369 WAT 4672 ATOM 48369 O WAT 4673 14.709 9.049 25.913 1.00 0.00 O ATOM 48370 H1 WAT 4673 14.988 8.322 26.470 1.00 0.00 H ATOM 48371 H2 WAT 4673 14.342 9.690 26.521 1.00 0.00 H TER 48373 WAT 4673 ATOM 48373 O WAT 4674 134.260 79.224 4.833 1.00 0.00 O ATOM 48374 H1 WAT 4674 133.871 79.692 5.572 1.00 0.00 H ATOM 48375 H2 WAT 4674 134.400 78.335 5.160 1.00 0.00 H TER 48377 WAT 4674 ATOM 48377 O WAT 4675 55.799 40.469 127.977 1.00 0.00 O ATOM 48378 H1 WAT 4675 55.469 39.767 128.538 1.00 0.00 H ATOM 48379 H2 WAT 4675 56.709 40.227 127.801 1.00 0.00 H TER 48381 WAT 4675 ATOM 48381 O WAT 4676 73.801 95.362 103.124 1.00 0.00 O ATOM 48382 H1 WAT 4676 74.273 95.820 102.429 1.00 0.00 H ATOM 48383 H2 WAT 4676 74.431 95.303 103.843 1.00 0.00 H TER 48385 WAT 4676 ATOM 48385 O WAT 4677 130.748 9.008 75.718 1.00 0.00 O ATOM 48386 H1 WAT 4677 130.434 9.268 76.584 1.00 0.00 H ATOM 48387 H2 WAT 4677 130.692 9.807 75.193 1.00 0.00 H TER 48389 WAT 4677 ATOM 48389 O WAT 4678 59.573 79.019 83.560 1.00 0.00 O ATOM 48390 H1 WAT 4678 59.781 79.884 83.205 1.00 0.00 H ATOM 48391 H2 WAT 4678 60.363 78.759 84.035 1.00 0.00 H TER 48393 WAT 4678 ATOM 48393 O WAT 4679 58.253 86.457 6.793 1.00 0.00 O ATOM 48394 H1 WAT 4679 57.380 86.276 7.143 1.00 0.00 H ATOM 48395 H2 WAT 4679 58.852 86.076 7.435 1.00 0.00 H TER 48397 WAT 4679 ATOM 48397 O WAT 4680 95.075 40.418 148.686 1.00 0.00 O ATOM 48398 H1 WAT 4680 95.436 40.214 149.549 1.00 0.00 H ATOM 48399 H2 WAT 4680 95.649 41.102 148.342 1.00 0.00 H TER 48401 WAT 4680 ATOM 48401 O WAT 4681 84.501 109.919 96.232 1.00 0.00 O ATOM 48402 H1 WAT 4681 84.850 109.031 96.304 1.00 0.00 H ATOM 48403 H2 WAT 4681 83.585 109.797 95.983 1.00 0.00 H TER 48405 WAT 4681 ATOM 48405 O WAT 4682 95.295 90.857 131.816 1.00 0.00 O ATOM 48406 H1 WAT 4682 94.408 91.115 131.565 1.00 0.00 H ATOM 48407 H2 WAT 4682 95.850 91.571 131.502 1.00 0.00 H TER 48409 WAT 4682 ATOM 48409 O WAT 4683 52.346 50.768 135.232 1.00 0.00 O ATOM 48410 H1 WAT 4683 52.097 49.948 135.659 1.00 0.00 H ATOM 48411 H2 WAT 4683 52.966 50.505 134.552 1.00 0.00 H TER 48413 WAT 4683 ATOM 48413 O WAT 4684 75.931 64.973 144.388 1.00 0.00 O ATOM 48414 H1 WAT 4684 76.062 65.921 144.394 1.00 0.00 H ATOM 48415 H2 WAT 4684 75.487 64.797 143.558 1.00 0.00 H TER 48417 WAT 4684 ATOM 48417 O WAT 4685 79.943 92.857 61.745 1.00 0.00 O ATOM 48418 H1 WAT 4685 80.287 93.407 61.042 1.00 0.00 H ATOM 48419 H2 WAT 4685 79.114 92.522 61.404 1.00 0.00 H TER 48421 WAT 4685 ATOM 48421 O WAT 4686 143.889 2.214 60.774 1.00 0.00 O ATOM 48422 H1 WAT 4686 143.742 1.325 61.097 1.00 0.00 H ATOM 48423 H2 WAT 4686 143.030 2.633 60.829 1.00 0.00 H TER 48425 WAT 4686 ATOM 48425 O WAT 4687 3.536 71.207 154.511 1.00 0.00 O ATOM 48426 H1 WAT 4687 3.202 70.350 154.246 1.00 0.00 H ATOM 48427 H2 WAT 4687 2.981 71.834 154.047 1.00 0.00 H TER 48429 WAT 4687 ATOM 48429 O WAT 4688 27.377 97.840 8.374 1.00 0.00 O ATOM 48430 H1 WAT 4688 26.795 97.884 9.133 1.00 0.00 H ATOM 48431 H2 WAT 4688 26.896 98.286 7.677 1.00 0.00 H TER 48433 WAT 4688 ATOM 48433 O WAT 4689 36.512 49.839 140.363 1.00 0.00 O ATOM 48434 H1 WAT 4689 35.807 49.767 141.006 1.00 0.00 H ATOM 48435 H2 WAT 4689 36.092 49.647 139.524 1.00 0.00 H TER 48437 WAT 4689 ATOM 48437 O WAT 4690 51.167 31.861 1.272 1.00 0.00 O ATOM 48438 H1 WAT 4690 51.753 31.346 1.827 1.00 0.00 H ATOM 48439 H2 WAT 4690 51.307 32.765 1.552 1.00 0.00 H TER 48441 WAT 4690 ATOM 48441 O WAT 4691 66.022 69.206 5.270 1.00 0.00 O ATOM 48442 H1 WAT 4691 66.222 69.353 4.345 1.00 0.00 H ATOM 48443 H2 WAT 4691 66.736 68.652 5.584 1.00 0.00 H TER 48445 WAT 4691 ATOM 48445 O WAT 4692 137.668 113.955 63.308 1.00 0.00 O ATOM 48446 H1 WAT 4692 138.550 114.297 63.161 1.00 0.00 H ATOM 48447 H2 WAT 4692 137.180 114.697 63.665 1.00 0.00 H TER 48449 WAT 4692 ATOM 48449 O WAT 4693 58.110 77.222 18.915 1.00 0.00 O ATOM 48450 H1 WAT 4693 57.204 77.440 19.134 1.00 0.00 H ATOM 48451 H2 WAT 4693 58.633 77.877 19.377 1.00 0.00 H TER 48453 WAT 4693 ATOM 48453 O WAT 4694 33.377 129.435 103.734 1.00 0.00 O ATOM 48454 H1 WAT 4694 33.067 128.930 104.486 1.00 0.00 H ATOM 48455 H2 WAT 4694 34.330 129.341 103.760 1.00 0.00 H TER 48457 WAT 4694 ATOM 48457 O WAT 4695 14.847 127.287 136.577 1.00 0.00 O ATOM 48458 H1 WAT 4695 14.399 127.340 135.733 1.00 0.00 H ATOM 48459 H2 WAT 4695 14.365 127.890 137.142 1.00 0.00 H TER 48461 WAT 4695 ATOM 48461 O WAT 4696 119.524 87.629 23.836 1.00 0.00 O ATOM 48462 H1 WAT 4696 120.092 88.384 23.990 1.00 0.00 H ATOM 48463 H2 WAT 4696 118.896 87.930 23.180 1.00 0.00 H TER 48465 WAT 4696 ATOM 48465 O WAT 4697 50.954 104.491 75.557 1.00 0.00 O ATOM 48466 H1 WAT 4697 50.188 104.623 76.115 1.00 0.00 H ATOM 48467 H2 WAT 4697 50.614 104.550 74.665 1.00 0.00 H TER 48469 WAT 4697 ATOM 48469 O WAT 4698 35.954 139.030 112.653 1.00 0.00 O ATOM 48470 H1 WAT 4698 36.270 139.429 111.843 1.00 0.00 H ATOM 48471 H2 WAT 4698 35.311 139.652 112.992 1.00 0.00 H TER 48473 WAT 4698 ATOM 48473 O WAT 4699 16.207 28.430 80.586 1.00 0.00 O ATOM 48474 H1 WAT 4699 15.920 28.612 79.691 1.00 0.00 H ATOM 48475 H2 WAT 4699 15.816 27.582 80.795 1.00 0.00 H TER 48477 WAT 4699 ATOM 48477 O WAT 4700 24.195 16.860 66.933 1.00 0.00 O ATOM 48478 H1 WAT 4700 24.447 16.220 66.268 1.00 0.00 H ATOM 48479 H2 WAT 4700 24.673 16.591 67.718 1.00 0.00 H TER 48481 WAT 4700 ATOM 48481 O WAT 4701 4.985 34.176 79.318 1.00 0.00 O ATOM 48482 H1 WAT 4701 5.416 34.669 78.620 1.00 0.00 H ATOM 48483 H2 WAT 4701 4.506 34.836 79.817 1.00 0.00 H TER 48485 WAT 4701 ATOM 48485 O WAT 4702 126.221 16.402 139.471 1.00 0.00 O ATOM 48486 H1 WAT 4702 125.688 17.068 139.906 1.00 0.00 H ATOM 48487 H2 WAT 4702 127.066 16.443 139.918 1.00 0.00 H TER 48489 WAT 4702 ATOM 48489 O WAT 4703 74.871 124.345 11.517 1.00 0.00 O ATOM 48490 H1 WAT 4703 74.501 123.683 10.932 1.00 0.00 H ATOM 48491 H2 WAT 4703 74.246 124.403 12.239 1.00 0.00 H TER 48493 WAT 4703 ATOM 48493 O WAT 4704 120.818 107.028 80.651 1.00 0.00 O ATOM 48494 H1 WAT 4704 120.763 106.133 80.315 1.00 0.00 H ATOM 48495 H2 WAT 4704 121.104 107.548 79.900 1.00 0.00 H TER 48497 WAT 4704 ATOM 48497 O WAT 4705 2.822 121.464 83.257 1.00 0.00 O ATOM 48498 H1 WAT 4705 2.935 121.953 82.442 1.00 0.00 H ATOM 48499 H2 WAT 4705 2.390 120.652 82.991 1.00 0.00 H TER 48501 WAT 4705 ATOM 48501 O WAT 4706 73.320 104.596 145.477 1.00 0.00 O ATOM 48502 H1 WAT 4706 73.772 103.966 146.038 1.00 0.00 H ATOM 48503 H2 WAT 4706 73.529 104.316 144.586 1.00 0.00 H TER 48505 WAT 4706 ATOM 48505 O WAT 4707 102.913 54.388 113.418 1.00 0.00 O ATOM 48506 H1 WAT 4707 103.110 55.062 114.068 1.00 0.00 H ATOM 48507 H2 WAT 4707 103.314 54.708 112.610 1.00 0.00 H TER 48509 WAT 4707 ATOM 48509 O WAT 4708 10.903 43.158 0.804 1.00 0.00 O ATOM 48510 H1 WAT 4708 11.039 42.629 0.018 1.00 0.00 H ATOM 48511 H2 WAT 4708 10.684 42.523 1.486 1.00 0.00 H TER 48513 WAT 4708 ATOM 48513 O WAT 4709 77.611 12.185 95.889 1.00 0.00 O ATOM 48514 H1 WAT 4709 77.218 12.902 96.387 1.00 0.00 H ATOM 48515 H2 WAT 4709 78.549 12.255 96.069 1.00 0.00 H TER 48517 WAT 4709 ATOM 48517 O WAT 4710 102.693 131.855 7.025 1.00 0.00 O ATOM 48518 H1 WAT 4710 102.180 132.491 7.524 1.00 0.00 H ATOM 48519 H2 WAT 4710 103.012 131.236 7.682 1.00 0.00 H TER 48521 WAT 4710 ATOM 48521 O WAT 4711 54.164 18.885 129.854 1.00 0.00 O ATOM 48522 H1 WAT 4711 54.644 18.391 130.520 1.00 0.00 H ATOM 48523 H2 WAT 4711 54.571 18.628 129.027 1.00 0.00 H TER 48525 WAT 4711 ATOM 48525 O WAT 4712 74.264 104.621 22.197 1.00 0.00 O ATOM 48526 H1 WAT 4712 74.760 103.899 21.813 1.00 0.00 H ATOM 48527 H2 WAT 4712 74.329 104.481 23.142 1.00 0.00 H TER 48529 WAT 4712 ATOM 48529 O WAT 4713 39.492 99.687 151.807 1.00 0.00 O ATOM 48530 H1 WAT 4713 40.410 99.454 151.949 1.00 0.00 H ATOM 48531 H2 WAT 4713 39.192 99.078 151.133 1.00 0.00 H TER 48533 WAT 4713 ATOM 48533 O WAT 4714 12.078 137.748 119.557 1.00 0.00 O ATOM 48534 H1 WAT 4714 12.783 137.466 118.974 1.00 0.00 H ATOM 48535 H2 WAT 4714 11.544 136.964 119.684 1.00 0.00 H TER 48537 WAT 4714 ATOM 48537 O WAT 4715 97.623 71.068 119.740 1.00 0.00 O ATOM 48538 H1 WAT 4715 97.098 70.845 118.971 1.00 0.00 H ATOM 48539 H2 WAT 4715 98.525 71.073 119.421 1.00 0.00 H TER 48541 WAT 4715 ATOM 48541 O WAT 4716 140.702 38.216 68.579 1.00 0.00 O ATOM 48542 H1 WAT 4716 140.046 38.209 69.276 1.00 0.00 H ATOM 48543 H2 WAT 4716 140.375 38.858 67.948 1.00 0.00 H TER 48545 WAT 4716 ATOM 48545 O WAT 4717 47.659 36.181 14.242 1.00 0.00 O ATOM 48546 H1 WAT 4717 47.914 35.931 13.354 1.00 0.00 H ATOM 48547 H2 WAT 4717 48.274 36.874 14.482 1.00 0.00 H TER 48549 WAT 4717 ATOM 48549 O WAT 4718 77.101 34.620 63.107 1.00 0.00 O ATOM 48550 H1 WAT 4718 77.219 33.747 63.481 1.00 0.00 H ATOM 48551 H2 WAT 4718 76.332 34.538 62.544 1.00 0.00 H TER 48553 WAT 4718 ATOM 48553 O WAT 4719 1.108 114.972 14.693 1.00 0.00 O ATOM 48554 H1 WAT 4719 1.140 115.776 15.210 1.00 0.00 H ATOM 48555 H2 WAT 4719 0.388 114.470 15.075 1.00 0.00 H TER 48557 WAT 4719 ATOM 48557 O WAT 4720 64.875 25.747 63.382 1.00 0.00 O ATOM 48558 H1 WAT 4720 65.755 25.840 63.745 1.00 0.00 H ATOM 48559 H2 WAT 4720 64.844 24.848 63.054 1.00 0.00 H TER 48561 WAT 4720 ATOM 48561 O WAT 4721 128.018 11.571 82.848 1.00 0.00 O ATOM 48562 H1 WAT 4721 128.046 11.419 81.903 1.00 0.00 H ATOM 48563 H2 WAT 4721 127.707 10.743 83.214 1.00 0.00 H TER 48565 WAT 4721 ATOM 48565 O WAT 4722 134.634 94.574 83.950 1.00 0.00 O ATOM 48566 H1 WAT 4722 133.827 94.154 83.655 1.00 0.00 H ATOM 48567 H2 WAT 4722 135.239 94.475 83.214 1.00 0.00 H TER 48569 WAT 4722 ATOM 48569 O WAT 4723 140.119 101.858 21.856 1.00 0.00 O ATOM 48570 H1 WAT 4723 139.562 102.511 22.279 1.00 0.00 H ATOM 48571 H2 WAT 4723 140.028 102.036 20.920 1.00 0.00 H TER 48573 WAT 4723 ATOM 48573 O WAT 4724 39.818 17.271 133.118 1.00 0.00 O ATOM 48574 H1 WAT 4724 38.956 17.501 132.770 1.00 0.00 H ATOM 48575 H2 WAT 4724 40.360 17.130 132.341 1.00 0.00 H TER 48577 WAT 4724 ATOM 48577 O WAT 4725 115.384 25.892 85.268 1.00 0.00 O ATOM 48578 H1 WAT 4725 116.066 25.393 85.718 1.00 0.00 H ATOM 48579 H2 WAT 4725 115.408 25.571 84.366 1.00 0.00 H TER 48581 WAT 4725 ATOM 48581 O WAT 4726 34.960 82.810 75.600 1.00 0.00 O ATOM 48582 H1 WAT 4726 35.594 83.400 76.007 1.00 0.00 H ATOM 48583 H2 WAT 4726 35.097 81.971 76.040 1.00 0.00 H TER 48585 WAT 4726 ATOM 48585 O WAT 4727 38.789 7.426 71.102 1.00 0.00 O ATOM 48586 H1 WAT 4727 38.070 8.057 71.059 1.00 0.00 H ATOM 48587 H2 WAT 4727 39.375 7.775 71.773 1.00 0.00 H TER 48589 WAT 4727 ATOM 48589 O WAT 4728 119.787 110.239 112.953 1.00 0.00 O ATOM 48590 H1 WAT 4728 119.134 109.539 112.921 1.00 0.00 H ATOM 48591 H2 WAT 4728 120.398 109.964 113.637 1.00 0.00 H TER 48593 WAT 4728 ATOM 48593 O WAT 4729 104.603 116.262 86.512 1.00 0.00 O ATOM 48594 H1 WAT 4729 105.416 116.432 86.987 1.00 0.00 H ATOM 48595 H2 WAT 4729 104.823 115.556 85.904 1.00 0.00 H TER 48597 WAT 4729 ATOM 48597 O WAT 4730 83.161 63.554 69.605 1.00 0.00 O ATOM 48598 H1 WAT 4730 82.463 62.918 69.761 1.00 0.00 H ATOM 48599 H2 WAT 4730 82.868 64.346 70.054 1.00 0.00 H TER 48601 WAT 4730 ATOM 48601 O WAT 4731 113.135 19.725 73.634 1.00 0.00 O ATOM 48602 H1 WAT 4731 113.167 19.006 74.264 1.00 0.00 H ATOM 48603 H2 WAT 4731 113.470 19.347 72.821 1.00 0.00 H TER 48605 WAT 4731 ATOM 48605 O WAT 4732 114.516 79.047 58.898 1.00 0.00 O ATOM 48606 H1 WAT 4732 115.108 78.732 59.581 1.00 0.00 H ATOM 48607 H2 WAT 4732 113.727 78.514 59.000 1.00 0.00 H TER 48609 WAT 4732 ATOM 48609 O WAT 4733 17.861 19.220 14.691 1.00 0.00 O ATOM 48610 H1 WAT 4733 18.388 19.560 15.414 1.00 0.00 H ATOM 48611 H2 WAT 4733 17.833 18.274 14.839 1.00 0.00 H TER 48613 WAT 4733 ATOM 48613 O WAT 4734 53.634 61.385 156.937 1.00 0.00 O ATOM 48614 H1 WAT 4734 53.644 61.031 156.048 1.00 0.00 H ATOM 48615 H2 WAT 4734 52.983 60.857 157.398 1.00 0.00 H TER 48617 WAT 4734 ATOM 48617 O WAT 4735 80.381 27.983 10.238 1.00 0.00 O ATOM 48618 H1 WAT 4735 79.594 27.748 9.747 1.00 0.00 H ATOM 48619 H2 WAT 4735 80.937 27.205 10.187 1.00 0.00 H TER 48621 WAT 4735 ATOM 48621 O WAT 4736 72.905 49.688 107.076 1.00 0.00 O ATOM 48622 H1 WAT 4736 73.721 50.136 107.298 1.00 0.00 H ATOM 48623 H2 WAT 4736 72.218 50.314 107.306 1.00 0.00 H TER 48625 WAT 4736 ATOM 48625 O WAT 4737 2.229 129.850 146.295 1.00 0.00 O ATOM 48626 H1 WAT 4737 2.315 129.297 147.071 1.00 0.00 H ATOM 48627 H2 WAT 4737 1.291 129.854 146.106 1.00 0.00 H TER 48629 WAT 4737 ATOM 48629 O WAT 4738 124.538 65.205 131.961 1.00 0.00 O ATOM 48630 H1 WAT 4738 125.056 64.652 131.376 1.00 0.00 H ATOM 48631 H2 WAT 4738 125.186 65.649 132.507 1.00 0.00 H TER 48633 WAT 4738 ATOM 48633 O WAT 4739 108.500 75.535 123.231 1.00 0.00 O ATOM 48634 H1 WAT 4739 109.154 75.164 123.824 1.00 0.00 H ATOM 48635 H2 WAT 4739 108.868 75.406 122.357 1.00 0.00 H TER 48637 WAT 4739 ATOM 48637 O WAT 4740 8.491 23.680 74.655 1.00 0.00 O ATOM 48638 H1 WAT 4740 7.967 23.887 73.881 1.00 0.00 H ATOM 48639 H2 WAT 4740 9.241 24.273 74.602 1.00 0.00 H TER 48641 WAT 4740 ATOM 48641 O WAT 4741 3.942 124.927 22.148 1.00 0.00 O ATOM 48642 H1 WAT 4741 3.681 124.008 22.098 1.00 0.00 H ATOM 48643 H2 WAT 4741 3.145 125.389 22.409 1.00 0.00 H TER 48645 WAT 4741 ATOM 48645 O WAT 4742 41.705 0.314 58.132 1.00 0.00 O ATOM 48646 H1 WAT 4742 41.281 1.156 57.964 1.00 0.00 H ATOM 48647 H2 WAT 4742 42.579 0.406 57.752 1.00 0.00 H TER 48649 WAT 4742 ATOM 48649 O WAT 4743 65.621 58.374 123.000 1.00 0.00 O ATOM 48650 H1 WAT 4743 65.388 58.985 122.301 1.00 0.00 H ATOM 48651 H2 WAT 4743 65.595 57.513 122.583 1.00 0.00 H TER 48653 WAT 4743 ATOM 48653 O WAT 4744 62.341 20.855 96.785 1.00 0.00 O ATOM 48654 H1 WAT 4744 63.042 20.808 97.436 1.00 0.00 H ATOM 48655 H2 WAT 4744 62.391 20.021 96.319 1.00 0.00 H TER 48657 WAT 4744 ATOM 48657 O WAT 4745 120.716 84.537 -0.228 1.00 0.00 O ATOM 48658 H1 WAT 4745 121.123 85.403 -0.222 1.00 0.00 H ATOM 48659 H2 WAT 4745 120.576 84.331 0.696 1.00 0.00 H TER 48661 WAT 4745 ATOM 48661 O WAT 4746 20.411 28.998 141.137 1.00 0.00 O ATOM 48662 H1 WAT 4746 20.262 28.085 141.382 1.00 0.00 H ATOM 48663 H2 WAT 4746 21.339 29.146 141.316 1.00 0.00 H TER 48665 WAT 4746 ATOM 48665 O WAT 4747 87.722 69.508 74.618 1.00 0.00 O ATOM 48666 H1 WAT 4747 87.603 68.681 75.084 1.00 0.00 H ATOM 48667 H2 WAT 4747 87.869 69.251 73.708 1.00 0.00 H TER 48669 WAT 4747 ATOM 48669 O WAT 4748 80.296 122.980 10.437 1.00 0.00 O ATOM 48670 H1 WAT 4748 79.925 122.136 10.176 1.00 0.00 H ATOM 48671 H2 WAT 4748 79.617 123.383 10.978 1.00 0.00 H TER 48673 WAT 4748 ATOM 48673 O WAT 4749 65.263 125.400 68.077 1.00 0.00 O ATOM 48674 H1 WAT 4749 65.701 125.317 67.229 1.00 0.00 H ATOM 48675 H2 WAT 4749 65.178 126.344 68.210 1.00 0.00 H TER 48677 WAT 4749 ATOM 48677 O WAT 4750 10.405 40.402 134.089 1.00 0.00 O ATOM 48678 H1 WAT 4750 9.710 39.890 134.503 1.00 0.00 H ATOM 48679 H2 WAT 4750 11.014 40.599 134.800 1.00 0.00 H TER 48681 WAT 4750 ATOM 48681 O WAT 4751 25.981 106.393 97.653 1.00 0.00 O ATOM 48682 H1 WAT 4751 26.263 105.496 97.476 1.00 0.00 H ATOM 48683 H2 WAT 4751 25.026 106.342 97.686 1.00 0.00 H TER 48685 WAT 4751 ATOM 48685 O WAT 4752 139.611 133.747 13.080 1.00 0.00 O ATOM 48686 H1 WAT 4752 139.666 132.858 12.731 1.00 0.00 H ATOM 48687 H2 WAT 4752 139.083 134.224 12.439 1.00 0.00 H TER 48689 WAT 4752 ATOM 48689 O WAT 4753 74.284 77.567 90.817 1.00 0.00 O ATOM 48690 H1 WAT 4753 74.164 77.447 91.759 1.00 0.00 H ATOM 48691 H2 WAT 4753 73.673 76.948 90.417 1.00 0.00 H TER 48693 WAT 4753 ATOM 48693 O WAT 4754 98.397 32.971 122.436 1.00 0.00 O ATOM 48694 H1 WAT 4754 97.923 33.656 122.906 1.00 0.00 H ATOM 48695 H2 WAT 4754 98.233 33.158 121.511 1.00 0.00 H TER 48697 WAT 4754 ATOM 48697 O WAT 4755 64.384 5.612 153.122 1.00 0.00 O ATOM 48698 H1 WAT 4755 63.744 6.257 152.822 1.00 0.00 H ATOM 48699 H2 WAT 4755 64.936 6.092 153.740 1.00 0.00 H TER 48701 WAT 4755 ATOM 48701 O WAT 4756 25.930 120.642 142.028 1.00 0.00 O ATOM 48702 H1 WAT 4756 26.042 119.817 141.555 1.00 0.00 H ATOM 48703 H2 WAT 4756 25.526 121.230 141.391 1.00 0.00 H TER 48705 WAT 4756 ATOM 48705 O WAT 4757 17.490 118.966 143.170 1.00 0.00 O ATOM 48706 H1 WAT 4757 17.668 118.953 142.229 1.00 0.00 H ATOM 48707 H2 WAT 4757 16.539 119.053 143.232 1.00 0.00 H TER 48709 WAT 4757 ATOM 48709 O WAT 4758 73.069 138.297 132.710 1.00 0.00 O ATOM 48710 H1 WAT 4758 72.627 137.847 133.430 1.00 0.00 H ATOM 48711 H2 WAT 4758 73.891 138.606 133.090 1.00 0.00 H TER 48713 WAT 4758 ATOM 48713 O WAT 4759 94.037 130.137 77.204 1.00 0.00 O ATOM 48714 H1 WAT 4759 94.291 129.289 76.840 1.00 0.00 H ATOM 48715 H2 WAT 4759 93.082 130.100 77.253 1.00 0.00 H TER 48717 WAT 4759 ATOM 48717 O WAT 4760 70.053 144.570 140.632 1.00 0.00 O ATOM 48718 H1 WAT 4760 69.418 144.923 140.008 1.00 0.00 H ATOM 48719 H2 WAT 4760 70.783 145.189 140.607 1.00 0.00 H TER 48721 WAT 4760 ATOM 48721 O WAT 4761 11.749 101.206 80.537 1.00 0.00 O ATOM 48722 H1 WAT 4761 11.929 101.866 81.206 1.00 0.00 H ATOM 48723 H2 WAT 4761 11.182 101.651 79.907 1.00 0.00 H TER 48725 WAT 4761 ATOM 48725 O WAT 4762 16.648 99.468 101.218 1.00 0.00 O ATOM 48726 H1 WAT 4762 15.848 99.633 100.720 1.00 0.00 H ATOM 48727 H2 WAT 4762 17.274 99.151 100.568 1.00 0.00 H TER 48729 WAT 4762 ATOM 48729 O WAT 4763 97.525 58.818 84.402 1.00 0.00 O ATOM 48730 H1 WAT 4763 98.068 59.212 83.719 1.00 0.00 H ATOM 48731 H2 WAT 4763 96.631 58.891 84.068 1.00 0.00 H TER 48733 WAT 4763 ATOM 48733 O WAT 4764 67.304 59.360 89.995 1.00 0.00 O ATOM 48734 H1 WAT 4764 67.073 60.122 90.526 1.00 0.00 H ATOM 48735 H2 WAT 4764 67.489 59.720 89.127 1.00 0.00 H TER 48737 WAT 4764 ATOM 48737 O WAT 4765 132.172 91.374 13.767 1.00 0.00 O ATOM 48738 H1 WAT 4765 132.972 91.430 14.289 1.00 0.00 H ATOM 48739 H2 WAT 4765 131.775 92.242 13.844 1.00 0.00 H TER 48741 WAT 4765 ATOM 48741 O WAT 4766 65.403 41.310 132.784 1.00 0.00 O ATOM 48742 H1 WAT 4766 64.513 40.959 132.810 1.00 0.00 H ATOM 48743 H2 WAT 4766 65.915 40.633 132.341 1.00 0.00 H TER 48745 WAT 4766 ATOM 48745 O WAT 4767 81.018 114.695 84.875 1.00 0.00 O ATOM 48746 H1 WAT 4767 81.043 113.872 84.388 1.00 0.00 H ATOM 48747 H2 WAT 4767 80.308 114.579 85.506 1.00 0.00 H TER 48749 WAT 4767 ATOM 48749 O WAT 4768 82.897 73.862 153.415 1.00 0.00 O ATOM 48750 H1 WAT 4768 83.725 74.066 153.850 1.00 0.00 H ATOM 48751 H2 WAT 4768 82.352 73.480 154.103 1.00 0.00 H TER 48753 WAT 4768 ATOM 48753 O WAT 4769 34.670 42.308 143.836 1.00 0.00 O ATOM 48754 H1 WAT 4769 34.167 41.682 143.315 1.00 0.00 H ATOM 48755 H2 WAT 4769 34.584 43.136 143.363 1.00 0.00 H TER 48757 WAT 4769 ATOM 48757 O WAT 4770 112.568 55.435 113.880 1.00 0.00 O ATOM 48758 H1 WAT 4770 112.761 55.833 113.031 1.00 0.00 H ATOM 48759 H2 WAT 4770 113.321 55.660 114.427 1.00 0.00 H TER 48761 WAT 4770 ATOM 48761 O WAT 4771 27.299 87.585 58.463 1.00 0.00 O ATOM 48762 H1 WAT 4771 27.721 87.810 57.634 1.00 0.00 H ATOM 48763 H2 WAT 4771 28.026 87.421 59.064 1.00 0.00 H TER 48765 WAT 4771 ATOM 48765 O WAT 4772 109.989 3.586 92.574 1.00 0.00 O ATOM 48766 H1 WAT 4772 109.364 4.200 92.188 1.00 0.00 H ATOM 48767 H2 WAT 4772 109.670 2.723 92.311 1.00 0.00 H TER 48769 WAT 4772 ATOM 48769 O WAT 4773 67.974 138.454 87.567 1.00 0.00 O ATOM 48770 H1 WAT 4773 67.034 138.395 87.397 1.00 0.00 H ATOM 48771 H2 WAT 4773 68.191 139.371 87.398 1.00 0.00 H TER 48773 WAT 4773 ATOM 48773 O WAT 4774 114.402 47.847 27.989 1.00 0.00 O ATOM 48774 H1 WAT 4774 113.789 47.245 27.569 1.00 0.00 H ATOM 48775 H2 WAT 4774 113.906 48.659 28.097 1.00 0.00 H TER 48777 WAT 4774 ATOM 48777 O WAT 4775 79.078 60.705 4.762 1.00 0.00 O ATOM 48778 H1 WAT 4775 78.420 60.975 5.403 1.00 0.00 H ATOM 48779 H2 WAT 4775 79.062 59.748 4.791 1.00 0.00 H TER 48781 WAT 4775 ATOM 48781 O WAT 4776 62.178 56.275 9.128 1.00 0.00 O ATOM 48782 H1 WAT 4776 61.947 56.677 8.290 1.00 0.00 H ATOM 48783 H2 WAT 4776 62.303 55.349 8.923 1.00 0.00 H TER 48785 WAT 4776 ATOM 48785 O WAT 4777 125.875 63.969 22.596 1.00 0.00 O ATOM 48786 H1 WAT 4777 126.493 63.434 23.093 1.00 0.00 H ATOM 48787 H2 WAT 4777 126.412 64.662 22.212 1.00 0.00 H TER 48789 WAT 4777 ATOM 48789 O WAT 4778 71.692 10.288 138.763 1.00 0.00 O ATOM 48790 H1 WAT 4778 71.111 10.661 138.099 1.00 0.00 H ATOM 48791 H2 WAT 4778 71.806 9.376 138.497 1.00 0.00 H TER 48793 WAT 4778 ATOM 48793 O WAT 4779 125.866 102.293 9.013 1.00 0.00 O ATOM 48794 H1 WAT 4779 126.355 101.944 8.268 1.00 0.00 H ATOM 48795 H2 WAT 4779 124.973 102.398 8.684 1.00 0.00 H TER 48797 WAT 4779 ATOM 48797 O WAT 4780 112.976 118.684 125.140 1.00 0.00 O ATOM 48798 H1 WAT 4780 113.045 119.616 125.349 1.00 0.00 H ATOM 48799 H2 WAT 4780 112.043 118.488 125.228 1.00 0.00 H TER 48801 WAT 4780 ATOM 48801 O WAT 4781 78.191 138.817 100.888 1.00 0.00 O ATOM 48802 H1 WAT 4781 78.648 138.813 100.048 1.00 0.00 H ATOM 48803 H2 WAT 4781 78.007 137.895 101.066 1.00 0.00 H TER 48805 WAT 4781 ATOM 48805 O WAT 4782 119.541 1.268 133.471 1.00 0.00 O ATOM 48806 H1 WAT 4782 119.831 0.356 133.441 1.00 0.00 H ATOM 48807 H2 WAT 4782 120.318 1.757 133.741 1.00 0.00 H TER 48809 WAT 4782 ATOM 48809 O WAT 4783 49.511 35.689 157.250 1.00 0.00 O ATOM 48810 H1 WAT 4783 49.343 36.009 158.136 1.00 0.00 H ATOM 48811 H2 WAT 4783 50.160 34.995 157.365 1.00 0.00 H TER 48813 WAT 4783 ATOM 48813 O WAT 4784 72.763 23.127 90.725 1.00 0.00 O ATOM 48814 H1 WAT 4784 72.945 23.197 89.788 1.00 0.00 H ATOM 48815 H2 WAT 4784 71.929 22.659 90.772 1.00 0.00 H TER 48817 WAT 4784 ATOM 48817 O WAT 4785 140.109 108.167 27.549 1.00 0.00 O ATOM 48818 H1 WAT 4785 140.659 107.688 26.930 1.00 0.00 H ATOM 48819 H2 WAT 4785 140.119 109.070 27.229 1.00 0.00 H TER 48821 WAT 4785 ATOM 48821 O WAT 4786 26.746 35.081 87.731 1.00 0.00 O ATOM 48822 H1 WAT 4786 25.979 34.514 87.807 1.00 0.00 H ATOM 48823 H2 WAT 4786 26.446 35.933 88.049 1.00 0.00 H TER 48825 WAT 4786 ATOM 48825 O WAT 4787 134.374 128.582 115.053 1.00 0.00 O ATOM 48826 H1 WAT 4787 134.566 127.648 114.967 1.00 0.00 H ATOM 48827 H2 WAT 4787 134.496 128.935 114.172 1.00 0.00 H TER 48829 WAT 4787 ATOM 48829 O WAT 4788 49.741 118.721 150.995 1.00 0.00 O ATOM 48830 H1 WAT 4788 49.478 118.828 151.909 1.00 0.00 H ATOM 48831 H2 WAT 4788 50.161 117.861 150.965 1.00 0.00 H TER 48833 WAT 4788 ATOM 48833 O WAT 4789 13.656 80.268 113.706 1.00 0.00 O ATOM 48834 H1 WAT 4789 13.025 80.153 112.996 1.00 0.00 H ATOM 48835 H2 WAT 4789 13.456 81.132 114.067 1.00 0.00 H TER 48837 WAT 4789 ATOM 48837 O WAT 4790 29.018 28.084 91.114 1.00 0.00 O ATOM 48838 H1 WAT 4790 29.718 27.800 91.701 1.00 0.00 H ATOM 48839 H2 WAT 4790 29.274 28.966 90.845 1.00 0.00 H TER 48841 WAT 4790 ATOM 48841 O WAT 4791 119.931 135.293 122.905 1.00 0.00 O ATOM 48842 H1 WAT 4791 119.547 135.164 122.038 1.00 0.00 H ATOM 48843 H2 WAT 4791 120.873 135.200 122.766 1.00 0.00 H TER 48845 WAT 4791 ATOM 48845 O WAT 4792 95.136 111.771 22.589 1.00 0.00 O ATOM 48846 H1 WAT 4792 95.462 111.857 23.485 1.00 0.00 H ATOM 48847 H2 WAT 4792 95.838 111.319 22.121 1.00 0.00 H TER 48849 WAT 4792 ATOM 48849 O WAT 4793 20.002 77.488 150.961 1.00 0.00 O ATOM 48850 H1 WAT 4793 19.453 77.559 151.742 1.00 0.00 H ATOM 48851 H2 WAT 4793 19.381 77.469 150.232 1.00 0.00 H TER 48853 WAT 4793 ATOM 48853 O WAT 4794 3.985 61.954 152.382 1.00 0.00 O ATOM 48854 H1 WAT 4794 4.502 61.167 152.554 1.00 0.00 H ATOM 48855 H2 WAT 4794 3.607 61.809 151.515 1.00 0.00 H TER 48857 WAT 4794 ATOM 48857 O WAT 4795 2.116 112.574 19.126 1.00 0.00 O ATOM 48858 H1 WAT 4795 3.008 112.898 19.256 1.00 0.00 H ATOM 48859 H2 WAT 4795 2.228 111.650 18.901 1.00 0.00 H TER 48861 WAT 4795 ATOM 48861 O WAT 4796 69.376 63.714 158.612 1.00 0.00 O ATOM 48862 H1 WAT 4796 68.516 63.513 158.242 1.00 0.00 H ATOM 48863 H2 WAT 4796 69.199 64.366 159.290 1.00 0.00 H TER 48865 WAT 4796 ATOM 48865 O WAT 4797 122.881 49.571 149.319 1.00 0.00 O ATOM 48866 H1 WAT 4797 122.359 49.042 149.922 1.00 0.00 H ATOM 48867 H2 WAT 4797 123.102 48.972 148.605 1.00 0.00 H TER 48869 WAT 4797 ATOM 48869 O WAT 4798 76.014 2.049 87.362 1.00 0.00 O ATOM 48870 H1 WAT 4798 76.298 2.571 88.112 1.00 0.00 H ATOM 48871 H2 WAT 4798 75.835 1.182 87.727 1.00 0.00 H TER 48873 WAT 4798 ATOM 48873 O WAT 4799 60.102 15.185 87.609 1.00 0.00 O ATOM 48874 H1 WAT 4799 60.138 14.238 87.473 1.00 0.00 H ATOM 48875 H2 WAT 4799 59.895 15.543 86.745 1.00 0.00 H TER 48877 WAT 4799 ATOM 48877 O WAT 4800 24.446 56.008 71.935 1.00 0.00 O ATOM 48878 H1 WAT 4800 24.080 56.335 71.114 1.00 0.00 H ATOM 48879 H2 WAT 4800 24.358 56.740 72.545 1.00 0.00 H TER 48881 WAT 4800 ATOM 48881 O WAT 4801 143.928 22.379 14.239 1.00 0.00 O ATOM 48882 H1 WAT 4801 143.434 21.974 13.527 1.00 0.00 H ATOM 48883 H2 WAT 4801 143.261 22.787 14.792 1.00 0.00 H TER 48885 WAT 4801 ATOM 48885 O WAT 4802 86.668 34.484 93.398 1.00 0.00 O ATOM 48886 H1 WAT 4802 85.939 34.158 93.926 1.00 0.00 H ATOM 48887 H2 WAT 4802 86.444 35.397 93.218 1.00 0.00 H TER 48889 WAT 4802 ATOM 48889 O WAT 4803 58.151 103.349 94.459 1.00 0.00 O ATOM 48890 H1 WAT 4803 57.424 102.747 94.615 1.00 0.00 H ATOM 48891 H2 WAT 4803 57.742 104.214 94.424 1.00 0.00 H TER 48893 WAT 4803 ATOM 48893 O WAT 4804 93.581 48.642 71.093 1.00 0.00 O ATOM 48894 H1 WAT 4804 94.218 47.960 70.879 1.00 0.00 H ATOM 48895 H2 WAT 4804 93.399 49.071 70.257 1.00 0.00 H TER 48897 WAT 4804 ATOM 48897 O WAT 4805 69.668 124.942 70.604 1.00 0.00 O ATOM 48898 H1 WAT 4805 70.283 124.227 70.766 1.00 0.00 H ATOM 48899 H2 WAT 4805 68.856 124.506 70.346 1.00 0.00 H TER 48901 WAT 4805 ATOM 48901 O WAT 4806 99.677 99.753 126.487 1.00 0.00 O ATOM 48902 H1 WAT 4806 99.450 99.559 127.397 1.00 0.00 H ATOM 48903 H2 WAT 4806 100.437 100.332 126.549 1.00 0.00 H TER 48905 WAT 4806 ATOM 48905 O WAT 4807 84.892 134.328 69.115 1.00 0.00 O ATOM 48906 H1 WAT 4807 84.679 135.262 69.117 1.00 0.00 H ATOM 48907 H2 WAT 4807 84.070 133.896 68.887 1.00 0.00 H TER 48909 WAT 4807 ATOM 48909 O WAT 4808 36.139 89.430 12.985 1.00 0.00 O ATOM 48910 H1 WAT 4808 35.751 90.092 12.413 1.00 0.00 H ATOM 48911 H2 WAT 4808 35.397 88.901 13.278 1.00 0.00 H TER 48913 WAT 4808 ATOM 48913 O WAT 4809 42.454 78.816 114.520 1.00 0.00 O ATOM 48914 H1 WAT 4809 42.139 79.687 114.761 1.00 0.00 H ATOM 48915 H2 WAT 4809 42.509 78.836 113.565 1.00 0.00 H TER 48917 WAT 4809 ATOM 48917 O WAT 4810 15.050 44.308 155.516 1.00 0.00 O ATOM 48918 H1 WAT 4810 14.699 44.592 154.672 1.00 0.00 H ATOM 48919 H2 WAT 4810 15.248 45.122 155.979 1.00 0.00 H TER 48921 WAT 4810 ATOM 48921 O WAT 4811 83.703 87.558 22.579 1.00 0.00 O ATOM 48922 H1 WAT 4811 84.494 87.889 22.155 1.00 0.00 H ATOM 48923 H2 WAT 4811 84.025 86.968 23.260 1.00 0.00 H TER 48925 WAT 4811 ATOM 48925 O WAT 4812 54.257 51.055 67.199 1.00 0.00 O ATOM 48926 H1 WAT 4812 54.979 50.458 67.398 1.00 0.00 H ATOM 48927 H2 WAT 4812 54.681 51.899 67.043 1.00 0.00 H TER 48929 WAT 4812 ATOM 48929 O WAT 4813 92.002 118.494 95.030 1.00 0.00 O ATOM 48930 H1 WAT 4813 92.956 118.415 95.033 1.00 0.00 H ATOM 48931 H2 WAT 4813 91.739 118.197 94.159 1.00 0.00 H TER 48933 WAT 4813 ATOM 48933 O WAT 4814 59.171 1.963 128.976 1.00 0.00 O ATOM 48934 H1 WAT 4814 59.310 1.657 129.872 1.00 0.00 H ATOM 48935 H2 WAT 4814 60.052 2.059 128.615 1.00 0.00 H TER 48937 WAT 4814 ATOM 48937 O WAT 4815 34.794 46.798 145.606 1.00 0.00 O ATOM 48938 H1 WAT 4815 34.319 47.544 145.971 1.00 0.00 H ATOM 48939 H2 WAT 4815 34.170 46.386 145.009 1.00 0.00 H TER 48941 WAT 4815 ATOM 48941 O WAT 4816 90.588 19.687 19.613 1.00 0.00 O ATOM 48942 H1 WAT 4816 91.272 19.495 18.973 1.00 0.00 H ATOM 48943 H2 WAT 4816 90.885 19.260 20.417 1.00 0.00 H TER 48945 WAT 4816 ATOM 48945 O WAT 4817 5.253 52.940 112.256 1.00 0.00 O ATOM 48946 H1 WAT 4817 4.625 53.630 112.042 1.00 0.00 H ATOM 48947 H2 WAT 4817 5.349 52.443 111.443 1.00 0.00 H TER 48949 WAT 4817 ATOM 48949 O WAT 4818 110.416 100.471 83.123 1.00 0.00 O ATOM 48950 H1 WAT 4818 110.027 100.121 82.322 1.00 0.00 H ATOM 48951 H2 WAT 4818 109.744 101.050 83.483 1.00 0.00 H TER 48953 WAT 4818 ATOM 48953 O WAT 4819 35.609 122.627 126.238 1.00 0.00 O ATOM 48954 H1 WAT 4819 34.982 123.342 126.128 1.00 0.00 H ATOM 48955 H2 WAT 4819 36.457 123.062 126.323 1.00 0.00 H TER 48957 WAT 4819 ATOM 48957 O WAT 4820 108.803 27.810 151.950 1.00 0.00 O ATOM 48958 H1 WAT 4820 109.633 28.211 152.209 1.00 0.00 H ATOM 48959 H2 WAT 4820 108.658 28.116 151.055 1.00 0.00 H TER 48961 WAT 4820 ATOM 48961 O WAT 4821 23.272 76.855 2.103 1.00 0.00 O ATOM 48962 H1 WAT 4821 23.116 77.264 1.252 1.00 0.00 H ATOM 48963 H2 WAT 4821 22.503 77.084 2.624 1.00 0.00 H TER 48965 WAT 4821 ATOM 48965 O WAT 4822 7.557 32.255 12.507 1.00 0.00 O ATOM 48966 H1 WAT 4822 7.737 31.315 12.502 1.00 0.00 H ATOM 48967 H2 WAT 4822 6.603 32.316 12.445 1.00 0.00 H TER 48969 WAT 4822 ATOM 48969 O WAT 4823 64.149 42.138 138.199 1.00 0.00 O ATOM 48970 H1 WAT 4823 64.719 42.225 137.435 1.00 0.00 H ATOM 48971 H2 WAT 4823 63.776 41.260 138.120 1.00 0.00 H TER 48973 WAT 4823 ATOM 48973 O WAT 4824 33.004 124.538 118.808 1.00 0.00 O ATOM 48974 H1 WAT 4824 32.976 123.769 118.238 1.00 0.00 H ATOM 48975 H2 WAT 4824 33.787 125.013 118.530 1.00 0.00 H TER 48977 WAT 4824 ATOM 48977 O WAT 4825 102.306 96.155 153.150 1.00 0.00 O ATOM 48978 H1 WAT 4825 102.287 97.050 153.490 1.00 0.00 H ATOM 48979 H2 WAT 4825 101.386 95.895 153.109 1.00 0.00 H TER 48981 WAT 4825 ATOM 48981 O WAT 4826 120.445 127.386 95.492 1.00 0.00 O ATOM 48982 H1 WAT 4826 121.189 126.936 95.091 1.00 0.00 H ATOM 48983 H2 WAT 4826 119.978 127.779 94.755 1.00 0.00 H TER 48985 WAT 4826 ATOM 48985 O WAT 4827 145.911 99.733 10.175 1.00 0.00 O ATOM 48986 H1 WAT 4827 146.237 99.728 11.075 1.00 0.00 H ATOM 48987 H2 WAT 4827 145.474 98.887 10.074 1.00 0.00 H TER 48989 WAT 4827 ATOM 48989 O WAT 4828 44.123 4.031 61.720 1.00 0.00 O ATOM 48990 H1 WAT 4828 43.286 3.600 61.549 1.00 0.00 H ATOM 48991 H2 WAT 4828 44.492 4.189 60.851 1.00 0.00 H TER 48993 WAT 4828 ATOM 48993 O WAT 4829 57.431 85.310 62.399 1.00 0.00 O ATOM 48994 H1 WAT 4829 57.030 84.533 62.009 1.00 0.00 H ATOM 48995 H2 WAT 4829 58.366 85.212 62.220 1.00 0.00 H TER 48997 WAT 4829 ATOM 48997 O WAT 4830 58.244 80.352 79.876 1.00 0.00 O ATOM 48998 H1 WAT 4830 58.174 79.409 79.725 1.00 0.00 H ATOM 48999 H2 WAT 4830 57.666 80.743 79.221 1.00 0.00 H TER 49001 WAT 4830 ATOM 49001 O WAT 4831 130.219 133.213 119.295 1.00 0.00 O ATOM 49002 H1 WAT 4831 131.038 133.026 119.754 1.00 0.00 H ATOM 49003 H2 WAT 4831 130.463 133.841 118.615 1.00 0.00 H TER 49005 WAT 4831 ATOM 49005 O WAT 4832 -0.147 126.181 102.242 1.00 0.00 O ATOM 49006 H1 WAT 4832 0.445 125.440 102.117 1.00 0.00 H ATOM 49007 H2 WAT 4832 -0.134 126.342 103.185 1.00 0.00 H TER 49009 WAT 4832 ATOM 49009 O WAT 4833 117.667 98.697 90.803 1.00 0.00 O ATOM 49010 H1 WAT 4833 117.908 98.777 89.880 1.00 0.00 H ATOM 49011 H2 WAT 4833 116.732 98.490 90.789 1.00 0.00 H TER 49013 WAT 4833 ATOM 49013 O WAT 4834 9.429 98.791 61.845 1.00 0.00 O ATOM 49014 H1 WAT 4834 9.843 99.044 62.670 1.00 0.00 H ATOM 49015 H2 WAT 4834 9.271 97.851 61.935 1.00 0.00 H TER 49017 WAT 4834 ATOM 49017 O WAT 4835 135.020 63.850 69.216 1.00 0.00 O ATOM 49018 H1 WAT 4835 135.131 63.826 70.167 1.00 0.00 H ATOM 49019 H2 WAT 4835 135.742 63.321 68.877 1.00 0.00 H TER 49021 WAT 4835 ATOM 49021 O WAT 4836 103.268 94.463 94.887 1.00 0.00 O ATOM 49022 H1 WAT 4836 103.891 94.946 94.343 1.00 0.00 H ATOM 49023 H2 WAT 4836 102.422 94.600 94.461 1.00 0.00 H TER 49025 WAT 4836 ATOM 49025 O WAT 4837 9.732 22.135 91.683 1.00 0.00 O ATOM 49026 H1 WAT 4837 9.890 21.255 91.342 1.00 0.00 H ATOM 49027 H2 WAT 4837 8.915 22.058 92.176 1.00 0.00 H TER 49029 WAT 4837 ATOM 49029 O WAT 4838 65.171 100.850 18.160 1.00 0.00 O ATOM 49030 H1 WAT 4838 65.277 100.288 18.927 1.00 0.00 H ATOM 49031 H2 WAT 4838 66.027 101.263 18.045 1.00 0.00 H TER 49033 WAT 4838 ATOM 49033 O WAT 4839 127.093 104.315 72.487 1.00 0.00 O ATOM 49034 H1 WAT 4839 127.005 104.516 73.419 1.00 0.00 H ATOM 49035 H2 WAT 4839 127.883 103.778 72.432 1.00 0.00 H TER 49037 WAT 4839 ATOM 49037 O WAT 4840 0.766 79.671 72.208 1.00 0.00 O ATOM 49038 H1 WAT 4840 0.684 78.873 71.686 1.00 0.00 H ATOM 49039 H2 WAT 4840 0.030 80.216 71.928 1.00 0.00 H TER 49041 WAT 4840 ATOM 49041 O WAT 4841 25.376 132.438 108.026 1.00 0.00 O ATOM 49042 H1 WAT 4841 25.811 132.882 108.754 1.00 0.00 H ATOM 49043 H2 WAT 4841 25.341 133.095 107.331 1.00 0.00 H TER 49045 WAT 4841 ATOM 49045 O WAT 4842 64.338 110.153 95.649 1.00 0.00 O ATOM 49046 H1 WAT 4842 64.793 109.548 96.236 1.00 0.00 H ATOM 49047 H2 WAT 4842 63.555 110.412 96.134 1.00 0.00 H TER 49049 WAT 4842 ATOM 49049 O WAT 4843 77.146 56.782 129.441 1.00 0.00 O ATOM 49050 H1 WAT 4843 77.274 55.941 129.002 1.00 0.00 H ATOM 49051 H2 WAT 4843 76.274 57.066 129.166 1.00 0.00 H TER 49053 WAT 4843 ATOM 49053 O WAT 4844 63.036 6.510 72.095 1.00 0.00 O ATOM 49054 H1 WAT 4844 63.463 5.691 71.843 1.00 0.00 H ATOM 49055 H2 WAT 4844 63.588 6.863 72.793 1.00 0.00 H TER 49057 WAT 4844 ATOM 49057 O WAT 4845 31.516 132.177 148.460 1.00 0.00 O ATOM 49058 H1 WAT 4845 31.169 132.736 147.765 1.00 0.00 H ATOM 49059 H2 WAT 4845 30.904 132.290 149.187 1.00 0.00 H TER 49061 WAT 4845 ATOM 49061 O WAT 4846 72.445 6.724 114.720 1.00 0.00 O ATOM 49062 H1 WAT 4846 73.175 7.297 114.955 1.00 0.00 H ATOM 49063 H2 WAT 4846 72.552 6.574 113.780 1.00 0.00 H TER 49065 WAT 4846 ATOM 49065 O WAT 4847 125.462 65.428 62.220 1.00 0.00 O ATOM 49066 H1 WAT 4847 125.266 64.546 62.537 1.00 0.00 H ATOM 49067 H2 WAT 4847 125.682 65.307 61.296 1.00 0.00 H TER 49069 WAT 4847 ATOM 49069 O WAT 4848 14.549 52.407 69.050 1.00 0.00 O ATOM 49070 H1 WAT 4848 14.345 51.770 69.735 1.00 0.00 H ATOM 49071 H2 WAT 4848 14.972 53.130 69.514 1.00 0.00 H TER 49073 WAT 4848 ATOM 49073 O WAT 4849 48.000 143.346 85.401 1.00 0.00 O ATOM 49074 H1 WAT 4849 47.993 142.826 84.597 1.00 0.00 H ATOM 49075 H2 WAT 4849 47.173 143.827 85.383 1.00 0.00 H TER 49077 WAT 4849 ATOM 49077 O WAT 4850 136.743 74.156 125.321 1.00 0.00 O ATOM 49078 H1 WAT 4850 137.652 73.869 125.406 1.00 0.00 H ATOM 49079 H2 WAT 4850 136.428 73.719 124.530 1.00 0.00 H TER 49081 WAT 4850 ATOM 49081 O WAT 4851 102.661 80.067 156.826 1.00 0.00 O ATOM 49082 H1 WAT 4851 102.143 79.768 156.078 1.00 0.00 H ATOM 49083 H2 WAT 4851 102.198 80.843 157.142 1.00 0.00 H TER 49085 WAT 4851 ATOM 49085 O WAT 4852 145.300 80.489 16.563 1.00 0.00 O ATOM 49086 H1 WAT 4852 145.349 79.616 16.953 1.00 0.00 H ATOM 49087 H2 WAT 4852 146.211 80.728 16.395 1.00 0.00 H TER 49089 WAT 4852 ATOM 49089 O WAT 4853 101.438 52.665 0.847 1.00 0.00 O ATOM 49090 H1 WAT 4853 101.824 53.528 0.997 1.00 0.00 H ATOM 49091 H2 WAT 4853 100.556 52.730 1.211 1.00 0.00 H TER 49093 WAT 4853 ATOM 49093 O WAT 4854 12.424 42.818 149.132 1.00 0.00 O ATOM 49094 H1 WAT 4854 12.267 42.088 148.534 1.00 0.00 H ATOM 49095 H2 WAT 4854 12.735 42.405 149.938 1.00 0.00 H TER 49097 WAT 4854 ATOM 49097 O WAT 4855 35.971 36.302 141.755 1.00 0.00 O ATOM 49098 H1 WAT 4855 35.741 35.976 142.625 1.00 0.00 H ATOM 49099 H2 WAT 4855 36.465 35.586 141.354 1.00 0.00 H TER 49101 WAT 4855 ATOM 49101 O WAT 4856 -0.237 81.070 111.681 1.00 0.00 O ATOM 49102 H1 WAT 4856 0.447 80.406 111.772 1.00 0.00 H ATOM 49103 H2 WAT 4856 0.212 81.827 111.304 1.00 0.00 H TER 49105 WAT 4856 ATOM 49105 O WAT 4857 105.363 66.755 18.969 1.00 0.00 O ATOM 49106 H1 WAT 4857 106.083 66.817 18.341 1.00 0.00 H ATOM 49107 H2 WAT 4857 104.628 67.188 18.534 1.00 0.00 H TER 49109 WAT 4857 ATOM 49109 O WAT 4858 135.642 55.018 103.696 1.00 0.00 O ATOM 49110 H1 WAT 4858 134.859 55.547 103.852 1.00 0.00 H ATOM 49111 H2 WAT 4858 135.355 54.117 103.840 1.00 0.00 H TER 49113 WAT 4858 ATOM 49113 O WAT 4859 144.629 119.250 128.238 1.00 0.00 O ATOM 49114 H1 WAT 4859 144.567 118.858 127.367 1.00 0.00 H ATOM 49115 H2 WAT 4859 144.851 120.166 128.074 1.00 0.00 H TER 49117 WAT 4859 ATOM 49117 O WAT 4860 22.722 36.590 105.125 1.00 0.00 O ATOM 49118 H1 WAT 4860 22.465 35.705 105.384 1.00 0.00 H ATOM 49119 H2 WAT 4860 22.017 36.885 104.549 1.00 0.00 H TER 49121 WAT 4860 ATOM 49121 O WAT 4861 126.143 109.973 69.517 1.00 0.00 O ATOM 49122 H1 WAT 4861 127.071 109.753 69.436 1.00 0.00 H ATOM 49123 H2 WAT 4861 125.931 109.784 70.430 1.00 0.00 H TER 49125 WAT 4861 ATOM 49125 O WAT 4862 30.088 131.685 115.365 1.00 0.00 O ATOM 49126 H1 WAT 4862 29.859 131.680 116.294 1.00 0.00 H ATOM 49127 H2 WAT 4862 31.019 131.464 115.347 1.00 0.00 H TER 49129 WAT 4862 ATOM 49129 O WAT 4863 81.918 28.578 131.700 1.00 0.00 O ATOM 49130 H1 WAT 4863 81.302 27.851 131.615 1.00 0.00 H ATOM 49131 H2 WAT 4863 81.446 29.334 131.353 1.00 0.00 H TER 49133 WAT 4863 ATOM 49133 O WAT 4864 79.484 79.207 61.941 1.00 0.00 O ATOM 49134 H1 WAT 4864 80.386 78.889 61.991 1.00 0.00 H ATOM 49135 H2 WAT 4864 79.504 79.876 61.256 1.00 0.00 H TER 49137 WAT 4864 ATOM 49137 O WAT 4865 78.582 4.886 143.891 1.00 0.00 O ATOM 49138 H1 WAT 4865 79.035 5.409 143.229 1.00 0.00 H ATOM 49139 H2 WAT 4865 77.747 5.334 144.021 1.00 0.00 H TER 49141 WAT 4865 ATOM 49141 O WAT 4866 65.085 102.904 109.715 1.00 0.00 O ATOM 49142 H1 WAT 4866 65.186 103.130 108.790 1.00 0.00 H ATOM 49143 H2 WAT 4866 65.681 103.498 110.172 1.00 0.00 H TER 49145 WAT 4866 ATOM 49145 O WAT 4867 97.080 90.448 111.534 1.00 0.00 O ATOM 49146 H1 WAT 4867 96.858 89.532 111.370 1.00 0.00 H ATOM 49147 H2 WAT 4867 98.014 90.508 111.333 1.00 0.00 H TER 49149 WAT 4867 ATOM 49149 O WAT 4868 74.705 92.911 72.810 1.00 0.00 O ATOM 49150 H1 WAT 4868 75.499 92.381 72.742 1.00 0.00 H ATOM 49151 H2 WAT 4868 74.024 92.292 73.072 1.00 0.00 H TER 49153 WAT 4868 ATOM 49153 O WAT 4869 98.796 123.272 153.727 1.00 0.00 O ATOM 49154 H1 WAT 4869 98.668 123.623 152.846 1.00 0.00 H ATOM 49155 H2 WAT 4869 98.165 122.555 153.793 1.00 0.00 H TER 49157 WAT 4869 ATOM 49157 O WAT 4870 78.053 73.646 82.467 1.00 0.00 O ATOM 49158 H1 WAT 4870 77.615 74.423 82.813 1.00 0.00 H ATOM 49159 H2 WAT 4870 78.771 73.483 83.080 1.00 0.00 H TER 49161 WAT 4870 ATOM 49161 O WAT 4871 135.632 25.354 141.051 1.00 0.00 O ATOM 49162 H1 WAT 4871 134.894 25.815 140.652 1.00 0.00 H ATOM 49163 H2 WAT 4871 135.529 24.446 140.766 1.00 0.00 H TER 49165 WAT 4871 ATOM 49165 O WAT 4872 97.655 44.973 61.998 1.00 0.00 O ATOM 49166 H1 WAT 4872 97.875 44.125 61.612 1.00 0.00 H ATOM 49167 H2 WAT 4872 97.623 45.574 61.253 1.00 0.00 H TER 49169 WAT 4872 ATOM 49169 O WAT 4873 112.965 65.207 152.238 1.00 0.00 O ATOM 49170 H1 WAT 4873 113.767 64.743 151.998 1.00 0.00 H ATOM 49171 H2 WAT 4873 112.397 64.528 152.604 1.00 0.00 H TER 49173 WAT 4873 ATOM 49173 O WAT 4874 5.464 34.181 150.042 1.00 0.00 O ATOM 49174 H1 WAT 4874 5.646 33.247 149.935 1.00 0.00 H ATOM 49175 H2 WAT 4874 6.306 34.609 149.883 1.00 0.00 H TER 49177 WAT 4874 ATOM 49177 O WAT 4875 93.148 141.060 59.312 1.00 0.00 O ATOM 49178 H1 WAT 4875 92.228 141.173 59.550 1.00 0.00 H ATOM 49179 H2 WAT 4875 93.161 140.269 58.774 1.00 0.00 H TER 49181 WAT 4875 ATOM 49181 O WAT 4876 59.350 27.024 75.115 1.00 0.00 O ATOM 49182 H1 WAT 4876 60.054 27.403 74.588 1.00 0.00 H ATOM 49183 H2 WAT 4876 58.937 26.383 74.537 1.00 0.00 H TER 49185 WAT 4876 ATOM 49185 O WAT 4877 42.849 143.327 20.864 1.00 0.00 O ATOM 49186 H1 WAT 4877 43.741 143.314 21.212 1.00 0.00 H ATOM 49187 H2 WAT 4877 42.545 144.221 21.022 1.00 0.00 H TER 49189 WAT 4877 ATOM 49189 O WAT 4878 94.448 122.830 75.568 1.00 0.00 O ATOM 49190 H1 WAT 4878 95.135 123.187 76.131 1.00 0.00 H ATOM 49191 H2 WAT 4878 93.728 122.629 76.166 1.00 0.00 H TER 49193 WAT 4878 ATOM 49193 O WAT 4879 63.284 69.888 8.346 1.00 0.00 O ATOM 49194 H1 WAT 4879 63.167 69.162 7.733 1.00 0.00 H ATOM 49195 H2 WAT 4879 64.234 69.982 8.427 1.00 0.00 H TER 49197 WAT 4879 ATOM 49197 O WAT 4880 87.276 1.861 150.060 1.00 0.00 O ATOM 49198 H1 WAT 4880 87.522 1.752 149.141 1.00 0.00 H ATOM 49199 H2 WAT 4880 86.783 1.068 150.271 1.00 0.00 H TER 49201 WAT 4880 ATOM 49201 O WAT 4881 127.613 80.314 85.201 1.00 0.00 O ATOM 49202 H1 WAT 4881 127.839 80.252 86.129 1.00 0.00 H ATOM 49203 H2 WAT 4881 128.082 81.089 84.891 1.00 0.00 H TER 49205 WAT 4881 ATOM 49205 O WAT 4882 140.518 14.471 99.641 1.00 0.00 O ATOM 49206 H1 WAT 4882 141.170 14.724 98.988 1.00 0.00 H ATOM 49207 H2 WAT 4882 140.007 15.267 99.790 1.00 0.00 H TER 49209 WAT 4882 ATOM 49209 O WAT 4883 44.126 130.323 119.934 1.00 0.00 O ATOM 49210 H1 WAT 4883 43.578 131.108 119.929 1.00 0.00 H ATOM 49211 H2 WAT 4883 45.013 130.649 119.779 1.00 0.00 H TER 49213 WAT 4883 ATOM 49213 O WAT 4884 58.695 61.817 12.250 1.00 0.00 O ATOM 49214 H1 WAT 4884 59.165 62.648 12.184 1.00 0.00 H ATOM 49215 H2 WAT 4884 59.248 61.191 11.782 1.00 0.00 H TER 49217 WAT 4884 ATOM 49217 O WAT 4885 136.513 1.103 101.952 1.00 0.00 O ATOM 49218 H1 WAT 4885 136.190 1.659 101.243 1.00 0.00 H ATOM 49219 H2 WAT 4885 137.362 1.479 102.184 1.00 0.00 H TER 49221 WAT 4885 ATOM 49221 O WAT 4886 82.764 136.058 78.706 1.00 0.00 O ATOM 49222 H1 WAT 4886 82.210 136.838 78.731 1.00 0.00 H ATOM 49223 H2 WAT 4886 83.468 136.245 79.327 1.00 0.00 H TER 49225 WAT 4886 ATOM 49225 O WAT 4887 31.065 118.011 119.046 1.00 0.00 O ATOM 49226 H1 WAT 4887 30.888 118.404 119.900 1.00 0.00 H ATOM 49227 H2 WAT 4887 30.230 118.063 118.580 1.00 0.00 H TER 49229 WAT 4887 ATOM 49229 O WAT 4888 14.516 46.330 92.900 1.00 0.00 O ATOM 49230 H1 WAT 4888 15.417 46.463 92.604 1.00 0.00 H ATOM 49231 H2 WAT 4888 14.046 47.104 92.589 1.00 0.00 H TER 49233 WAT 4888 ATOM 49233 O WAT 4889 91.405 140.104 96.621 1.00 0.00 O ATOM 49234 H1 WAT 4889 91.571 139.314 97.136 1.00 0.00 H ATOM 49235 H2 WAT 4889 92.199 140.628 96.723 1.00 0.00 H TER 49237 WAT 4889 ATOM 49237 O WAT 4890 72.167 126.121 125.941 1.00 0.00 O ATOM 49238 H1 WAT 4890 71.550 126.295 125.230 1.00 0.00 H ATOM 49239 H2 WAT 4890 72.944 125.773 125.504 1.00 0.00 H TER 49241 WAT 4890 ATOM 49241 O WAT 4891 91.541 58.865 87.475 1.00 0.00 O ATOM 49242 H1 WAT 4891 91.642 59.307 86.632 1.00 0.00 H ATOM 49243 H2 WAT 4891 91.049 59.485 88.013 1.00 0.00 H TER 49245 WAT 4891 ATOM 49245 O WAT 4892 59.163 71.575 99.447 1.00 0.00 O ATOM 49246 H1 WAT 4892 58.951 70.807 99.977 1.00 0.00 H ATOM 49247 H2 WAT 4892 59.620 71.221 98.683 1.00 0.00 H TER 49249 WAT 4892 ATOM 49249 O WAT 4893 54.975 134.027 87.096 1.00 0.00 O ATOM 49250 H1 WAT 4893 54.083 133.874 86.785 1.00 0.00 H ATOM 49251 H2 WAT 4893 54.866 134.550 87.890 1.00 0.00 H TER 49253 WAT 4893 ATOM 49253 O WAT 4894 1.609 2.355 13.884 1.00 0.00 O ATOM 49254 H1 WAT 4894 1.184 2.137 14.713 1.00 0.00 H ATOM 49255 H2 WAT 4894 2.364 1.769 13.840 1.00 0.00 H TER 49257 WAT 4894 ATOM 49257 O WAT 4895 77.483 115.003 92.770 1.00 0.00 O ATOM 49258 H1 WAT 4895 78.261 115.507 92.531 1.00 0.00 H ATOM 49259 H2 WAT 4895 77.779 114.425 93.473 1.00 0.00 H TER 49261 WAT 4895 ATOM 49261 O WAT 4896 3.556 17.850 10.057 1.00 0.00 O ATOM 49262 H1 WAT 4896 4.186 17.316 9.573 1.00 0.00 H ATOM 49263 H2 WAT 4896 2.890 17.228 10.350 1.00 0.00 H TER 49265 WAT 4896 ATOM 49265 O WAT 4897 42.732 63.594 116.783 1.00 0.00 O ATOM 49266 H1 WAT 4897 43.162 63.008 117.406 1.00 0.00 H ATOM 49267 H2 WAT 4897 43.143 64.445 116.930 1.00 0.00 H TER 49269 WAT 4897 ATOM 49269 O WAT 4898 45.271 71.291 145.691 1.00 0.00 O ATOM 49270 H1 WAT 4898 44.476 70.771 145.575 1.00 0.00 H ATOM 49271 H2 WAT 4898 44.988 72.052 146.198 1.00 0.00 H TER 49273 WAT 4898 ATOM 49273 O WAT 4899 15.356 139.158 9.429 1.00 0.00 O ATOM 49274 H1 WAT 4899 15.146 138.448 8.821 1.00 0.00 H ATOM 49275 H2 WAT 4899 14.550 139.293 9.926 1.00 0.00 H TER 49277 WAT 4899 ATOM 49277 O WAT 4900 9.122 144.495 88.327 1.00 0.00 O ATOM 49278 H1 WAT 4900 9.792 144.527 87.644 1.00 0.00 H ATOM 49279 H2 WAT 4900 9.459 145.065 89.019 1.00 0.00 H TER 49281 WAT 4900 ATOM 49281 O WAT 4901 4.522 18.543 128.546 1.00 0.00 O ATOM 49282 H1 WAT 4901 5.323 18.395 128.043 1.00 0.00 H ATOM 49283 H2 WAT 4901 4.206 17.665 128.758 1.00 0.00 H TER 49285 WAT 4901 ATOM 49285 O WAT 4902 28.858 30.659 66.575 1.00 0.00 O ATOM 49286 H1 WAT 4902 29.170 31.547 66.399 1.00 0.00 H ATOM 49287 H2 WAT 4902 29.416 30.346 67.287 1.00 0.00 H TER 49289 WAT 4902 ATOM 49289 O WAT 4903 44.907 9.599 16.487 1.00 0.00 O ATOM 49290 H1 WAT 4903 44.988 9.370 15.562 1.00 0.00 H ATOM 49291 H2 WAT 4903 45.213 8.821 16.954 1.00 0.00 H TER 49293 WAT 4903 ATOM 49293 O WAT 4904 10.045 104.151 115.651 1.00 0.00 O ATOM 49294 H1 WAT 4904 10.511 103.320 115.553 1.00 0.00 H ATOM 49295 H2 WAT 4904 10.657 104.809 115.323 1.00 0.00 H TER 49297 WAT 4904 ATOM 49297 O WAT 4905 7.543 61.029 56.692 1.00 0.00 O ATOM 49298 H1 WAT 4905 7.980 60.273 57.084 1.00 0.00 H ATOM 49299 H2 WAT 4905 7.535 61.688 57.386 1.00 0.00 H TER 49301 WAT 4905 ATOM 49301 O WAT 4906 39.167 64.024 14.089 1.00 0.00 O ATOM 49302 H1 WAT 4906 39.664 63.241 13.849 1.00 0.00 H ATOM 49303 H2 WAT 4906 39.120 63.993 15.045 1.00 0.00 H TER 49305 WAT 4906 ATOM 49305 O WAT 4907 99.969 57.051 19.059 1.00 0.00 O ATOM 49306 H1 WAT 4907 100.172 57.111 19.993 1.00 0.00 H ATOM 49307 H2 WAT 4907 100.758 57.369 18.621 1.00 0.00 H TER 49309 WAT 4907 ATOM 49309 O WAT 4908 144.946 96.410 12.988 1.00 0.00 O ATOM 49310 H1 WAT 4908 145.394 95.742 12.469 1.00 0.00 H ATOM 49311 H2 WAT 4908 144.420 95.913 13.614 1.00 0.00 H TER 49313 WAT 4908 ATOM 49313 O WAT 4909 84.256 91.639 73.044 1.00 0.00 O ATOM 49314 H1 WAT 4909 84.526 91.786 73.950 1.00 0.00 H ATOM 49315 H2 WAT 4909 84.037 90.708 73.007 1.00 0.00 H TER 49317 WAT 4909 ATOM 49317 O WAT 4910 48.563 18.996 20.763 1.00 0.00 O ATOM 49318 H1 WAT 4910 49.385 18.872 20.289 1.00 0.00 H ATOM 49319 H2 WAT 4910 48.796 18.874 21.684 1.00 0.00 H TER 49321 WAT 4910 ATOM 49321 O WAT 4911 108.659 2.557 131.794 1.00 0.00 O ATOM 49322 H1 WAT 4911 108.333 3.077 132.529 1.00 0.00 H ATOM 49323 H2 WAT 4911 109.539 2.292 132.060 1.00 0.00 H TER 49325 WAT 4911 ATOM 49325 O WAT 4912 99.407 130.947 119.027 1.00 0.00 O ATOM 49326 H1 WAT 4912 99.372 130.270 119.703 1.00 0.00 H ATOM 49327 H2 WAT 4912 98.686 130.731 118.435 1.00 0.00 H TER 49329 WAT 4912 ATOM 49329 O WAT 4913 90.890 112.253 14.720 1.00 0.00 O ATOM 49330 H1 WAT 4913 91.123 112.828 13.991 1.00 0.00 H ATOM 49331 H2 WAT 4913 90.354 112.800 15.294 1.00 0.00 H TER 49333 WAT 4913 ATOM 49333 O WAT 4914 122.891 94.904 74.542 1.00 0.00 O ATOM 49334 H1 WAT 4914 123.054 95.753 74.131 1.00 0.00 H ATOM 49335 H2 WAT 4914 122.228 94.493 73.988 1.00 0.00 H TER 49337 WAT 4914 ATOM 49337 O WAT 4915 38.332 99.953 68.780 1.00 0.00 O ATOM 49338 H1 WAT 4915 38.267 99.478 69.608 1.00 0.00 H ATOM 49339 H2 WAT 4915 39.030 99.505 68.301 1.00 0.00 H TER 49341 WAT 4915 ATOM 49341 O WAT 4916 96.843 2.214 59.450 1.00 0.00 O ATOM 49342 H1 WAT 4916 96.326 2.527 58.708 1.00 0.00 H ATOM 49343 H2 WAT 4916 97.627 1.834 59.054 1.00 0.00 H TER 49345 WAT 4916 ATOM 49345 O WAT 4917 126.239 116.111 67.288 1.00 0.00 O ATOM 49346 H1 WAT 4917 126.098 115.744 68.161 1.00 0.00 H ATOM 49347 H2 WAT 4917 126.868 116.820 67.425 1.00 0.00 H TER 49349 WAT 4917 ATOM 49349 O WAT 4918 66.565 87.556 5.604 1.00 0.00 O ATOM 49350 H1 WAT 4918 66.740 86.623 5.733 1.00 0.00 H ATOM 49351 H2 WAT 4918 66.926 87.977 6.384 1.00 0.00 H TER 49353 WAT 4918 ATOM 49353 O WAT 4919 35.791 135.864 143.996 1.00 0.00 O ATOM 49354 H1 WAT 4919 35.993 135.358 143.209 1.00 0.00 H ATOM 49355 H2 WAT 4919 35.408 135.227 144.599 1.00 0.00 H TER 49357 WAT 4919 ATOM 49357 O WAT 4920 105.015 60.894 13.191 1.00 0.00 O ATOM 49358 H1 WAT 4920 105.487 60.063 13.140 1.00 0.00 H ATOM 49359 H2 WAT 4920 105.353 61.313 13.982 1.00 0.00 H TER 49361 WAT 4920 ATOM 49361 O WAT 4921 74.535 140.522 129.498 1.00 0.00 O ATOM 49362 H1 WAT 4921 74.463 139.703 129.007 1.00 0.00 H ATOM 49363 H2 WAT 4921 73.649 140.686 129.822 1.00 0.00 H TER 49365 WAT 4921 ATOM 49365 O WAT 4922 70.920 106.148 19.912 1.00 0.00 O ATOM 49366 H1 WAT 4922 70.021 106.333 20.183 1.00 0.00 H ATOM 49367 H2 WAT 4922 71.425 106.897 20.229 1.00 0.00 H TER 49369 WAT 4922 ATOM 49369 O WAT 4923 53.044 10.776 129.493 1.00 0.00 O ATOM 49370 H1 WAT 4923 53.443 10.501 128.667 1.00 0.00 H ATOM 49371 H2 WAT 4923 52.110 10.602 129.377 1.00 0.00 H TER 49373 WAT 4923 ATOM 49373 O WAT 4924 127.043 96.551 143.046 1.00 0.00 O ATOM 49374 H1 WAT 4924 126.902 96.257 143.946 1.00 0.00 H ATOM 49375 H2 WAT 4924 126.732 95.825 142.505 1.00 0.00 H TER 49377 WAT 4924 ATOM 49377 O WAT 4925 133.599 143.984 64.314 1.00 0.00 O ATOM 49378 H1 WAT 4925 133.871 144.473 63.537 1.00 0.00 H ATOM 49379 H2 WAT 4925 133.911 144.511 65.050 1.00 0.00 H TER 49381 WAT 4925 ATOM 49381 O WAT 4926 131.917 51.725 18.501 1.00 0.00 O ATOM 49382 H1 WAT 4926 132.663 51.433 19.025 1.00 0.00 H ATOM 49383 H2 WAT 4926 131.629 52.533 18.925 1.00 0.00 H TER 49385 WAT 4926 ATOM 49385 O WAT 4927 80.651 126.285 151.913 1.00 0.00 O ATOM 49386 H1 WAT 4927 80.828 125.351 151.804 1.00 0.00 H ATOM 49387 H2 WAT 4927 79.696 126.350 151.914 1.00 0.00 H TER 49389 WAT 4927 ATOM 49389 O WAT 4928 121.633 21.470 23.398 1.00 0.00 O ATOM 49390 H1 WAT 4928 121.520 20.544 23.613 1.00 0.00 H ATOM 49391 H2 WAT 4928 122.016 21.854 24.186 1.00 0.00 H TER 49393 WAT 4928 ATOM 49393 O WAT 4929 133.119 37.920 10.928 1.00 0.00 O ATOM 49394 H1 WAT 4929 132.461 38.198 10.291 1.00 0.00 H ATOM 49395 H2 WAT 4929 132.637 37.370 11.546 1.00 0.00 H TER 49397 WAT 4929 ATOM 49397 O WAT 4930 129.909 75.258 99.461 1.00 0.00 O ATOM 49398 H1 WAT 4930 130.511 74.965 100.145 1.00 0.00 H ATOM 49399 H2 WAT 4930 129.039 75.069 99.812 1.00 0.00 H TER 49401 WAT 4930 ATOM 49401 O WAT 4931 6.044 135.158 73.250 1.00 0.00 O ATOM 49402 H1 WAT 4931 5.697 135.625 72.490 1.00 0.00 H ATOM 49403 H2 WAT 4931 5.527 135.483 73.988 1.00 0.00 H TER 49405 WAT 4931 ATOM 49405 O WAT 4932 70.071 6.912 86.260 1.00 0.00 O ATOM 49406 H1 WAT 4932 70.179 7.383 85.434 1.00 0.00 H ATOM 49407 H2 WAT 4932 70.268 6.001 86.044 1.00 0.00 H TER 49409 WAT 4932 ATOM 49409 O WAT 4933 67.230 112.548 126.895 1.00 0.00 O ATOM 49410 H1 WAT 4933 68.018 112.586 127.437 1.00 0.00 H ATOM 49411 H2 WAT 4933 66.608 113.125 127.336 1.00 0.00 H TER 49413 WAT 4933 ATOM 49413 O WAT 4934 68.887 127.089 5.135 1.00 0.00 O ATOM 49414 H1 WAT 4934 69.356 127.424 5.898 1.00 0.00 H ATOM 49415 H2 WAT 4934 69.550 126.609 4.638 1.00 0.00 H TER 49417 WAT 4934 ATOM 49417 O WAT 4935 76.926 123.006 122.596 1.00 0.00 O ATOM 49418 H1 WAT 4935 76.668 122.329 121.971 1.00 0.00 H ATOM 49419 H2 WAT 4935 77.809 123.258 122.326 1.00 0.00 H TER 49421 WAT 4935 ATOM 49421 O WAT 4936 1.970 15.708 133.583 1.00 0.00 O ATOM 49422 H1 WAT 4936 2.866 15.397 133.714 1.00 0.00 H ATOM 49423 H2 WAT 4936 1.605 15.115 132.926 1.00 0.00 H TER 49425 WAT 4936 ATOM 49425 O WAT 4937 138.893 126.811 141.201 1.00 0.00 O ATOM 49426 H1 WAT 4937 138.589 126.024 141.653 1.00 0.00 H ATOM 49427 H2 WAT 4937 138.361 127.518 141.567 1.00 0.00 H TER 49429 WAT 4937 ATOM 49429 O WAT 4938 91.413 86.763 134.845 1.00 0.00 O ATOM 49430 H1 WAT 4938 90.996 86.710 133.985 1.00 0.00 H ATOM 49431 H2 WAT 4938 92.311 86.467 134.694 1.00 0.00 H TER 49433 WAT 4938 ATOM 49433 O WAT 4939 126.728 7.120 142.797 1.00 0.00 O ATOM 49434 H1 WAT 4939 126.977 6.780 141.937 1.00 0.00 H ATOM 49435 H2 WAT 4939 126.203 7.897 142.605 1.00 0.00 H TER 49437 WAT 4939 ATOM 49437 O WAT 4940 8.049 80.340 157.918 1.00 0.00 O ATOM 49438 H1 WAT 4940 8.351 79.688 157.285 1.00 0.00 H ATOM 49439 H2 WAT 4940 8.385 80.030 158.759 1.00 0.00 H TER 49441 WAT 4940 ATOM 49441 O WAT 4941 103.700 37.187 25.592 1.00 0.00 O ATOM 49442 H1 WAT 4941 104.456 37.749 25.420 1.00 0.00 H ATOM 49443 H2 WAT 4941 103.998 36.590 26.279 1.00 0.00 H TER 49445 WAT 4941 ATOM 49445 O WAT 4942 75.001 135.558 113.803 1.00 0.00 O ATOM 49446 H1 WAT 4942 74.186 135.110 113.578 1.00 0.00 H ATOM 49447 H2 WAT 4942 75.686 134.915 113.619 1.00 0.00 H TER 49449 WAT 4942 ATOM 49449 O WAT 4943 21.958 72.345 97.007 1.00 0.00 O ATOM 49450 H1 WAT 4943 22.045 73.166 97.493 1.00 0.00 H ATOM 49451 H2 WAT 4943 21.152 71.953 97.343 1.00 0.00 H TER 49453 WAT 4943 ATOM 49453 O WAT 4944 55.537 57.536 97.696 1.00 0.00 O ATOM 49454 H1 WAT 4944 55.457 57.745 98.627 1.00 0.00 H ATOM 49455 H2 WAT 4944 55.869 58.340 97.297 1.00 0.00 H TER 49457 WAT 4944 ATOM 49457 O WAT 4945 51.127 80.544 93.683 1.00 0.00 O ATOM 49458 H1 WAT 4945 51.525 79.849 93.159 1.00 0.00 H ATOM 49459 H2 WAT 4945 50.298 80.173 93.984 1.00 0.00 H TER 49461 WAT 4945 ATOM 49461 O WAT 4946 20.396 132.981 106.291 1.00 0.00 O ATOM 49462 H1 WAT 4946 21.305 132.959 105.992 1.00 0.00 H ATOM 49463 H2 WAT 4946 20.240 132.107 106.649 1.00 0.00 H TER 49465 WAT 4946 ATOM 49465 O WAT 4947 93.902 115.332 69.798 1.00 0.00 O ATOM 49466 H1 WAT 4947 94.745 115.776 69.710 1.00 0.00 H ATOM 49467 H2 WAT 4947 93.350 115.956 70.268 1.00 0.00 H TER 49469 WAT 4947 ATOM 49469 O WAT 4948 104.460 6.154 111.289 1.00 0.00 O ATOM 49470 H1 WAT 4948 104.495 7.065 110.997 1.00 0.00 H ATOM 49471 H2 WAT 4948 105.365 5.940 111.516 1.00 0.00 H TER 49473 WAT 4948 ATOM 49473 O WAT 4949 53.026 36.918 67.410 1.00 0.00 O ATOM 49474 H1 WAT 4949 52.292 36.662 66.852 1.00 0.00 H ATOM 49475 H2 WAT 4949 53.800 36.586 66.955 1.00 0.00 H TER 49477 WAT 4949 ATOM 49477 O WAT 4950 13.462 108.859 85.581 1.00 0.00 O ATOM 49478 H1 WAT 4950 14.356 108.520 85.626 1.00 0.00 H ATOM 49479 H2 WAT 4950 13.325 109.286 86.427 1.00 0.00 H TER 49481 WAT 4950 ATOM 49481 O WAT 4951 16.926 125.019 81.392 1.00 0.00 O ATOM 49482 H1 WAT 4951 17.817 124.676 81.456 1.00 0.00 H ATOM 49483 H2 WAT 4951 16.370 124.240 81.373 1.00 0.00 H TER 49485 WAT 4951 ATOM 49485 O WAT 4952 73.081 43.598 92.482 1.00 0.00 O ATOM 49486 H1 WAT 4952 72.322 43.788 93.032 1.00 0.00 H ATOM 49487 H2 WAT 4952 73.241 44.412 92.004 1.00 0.00 H TER 49489 WAT 4952 ATOM 49489 O WAT 4953 78.224 113.391 94.671 1.00 0.00 O ATOM 49490 H1 WAT 4953 78.971 113.360 95.270 1.00 0.00 H ATOM 49491 H2 WAT 4953 77.880 112.498 94.672 1.00 0.00 H TER 49493 WAT 4953 ATOM 49493 O WAT 4954 8.651 80.221 142.511 1.00 0.00 O ATOM 49494 H1 WAT 4954 9.032 80.364 143.378 1.00 0.00 H ATOM 49495 H2 WAT 4954 8.293 79.334 142.551 1.00 0.00 H TER 49497 WAT 4954 ATOM 49497 O WAT 4955 86.976 45.438 94.106 1.00 0.00 O ATOM 49498 H1 WAT 4955 87.546 46.061 94.558 1.00 0.00 H ATOM 49499 H2 WAT 4955 87.486 44.628 94.073 1.00 0.00 H TER 49501 WAT 4955 ATOM 49501 O WAT 4956 98.244 9.515 154.061 1.00 0.00 O ATOM 49502 H1 WAT 4956 97.802 9.705 153.233 1.00 0.00 H ATOM 49503 H2 WAT 4956 98.873 10.228 154.166 1.00 0.00 H TER 49505 WAT 4956 ATOM 49505 O WAT 4957 22.230 23.078 124.410 1.00 0.00 O ATOM 49506 H1 WAT 4957 22.149 23.922 123.965 1.00 0.00 H ATOM 49507 H2 WAT 4957 22.426 22.456 123.710 1.00 0.00 H TER 49509 WAT 4957 ATOM 49509 O WAT 4958 53.829 60.068 11.698 1.00 0.00 O ATOM 49510 H1 WAT 4958 52.899 60.229 11.539 1.00 0.00 H ATOM 49511 H2 WAT 4958 54.242 60.183 10.843 1.00 0.00 H TER 49513 WAT 4958 ATOM 49513 O WAT 4959 69.397 117.559 2.800 1.00 0.00 O ATOM 49514 H1 WAT 4959 68.605 117.202 2.398 1.00 0.00 H ATOM 49515 H2 WAT 4959 69.929 117.853 2.060 1.00 0.00 H TER 49517 WAT 4959 ATOM 49517 O WAT 4960 110.846 121.495 63.116 1.00 0.00 O ATOM 49518 H1 WAT 4960 111.563 121.694 63.717 1.00 0.00 H ATOM 49519 H2 WAT 4960 111.260 121.459 62.253 1.00 0.00 H TER 49521 WAT 4960 ATOM 49521 O WAT 4961 27.619 3.646 8.480 1.00 0.00 O ATOM 49522 H1 WAT 4961 28.440 3.893 8.054 1.00 0.00 H ATOM 49523 H2 WAT 4961 27.872 3.413 9.373 1.00 0.00 H TER 49525 WAT 4961 ATOM 49525 O WAT 4962 23.473 106.359 10.128 1.00 0.00 O ATOM 49526 H1 WAT 4962 24.182 107.000 10.162 1.00 0.00 H ATOM 49527 H2 WAT 4962 23.458 106.065 9.217 1.00 0.00 H TER 49529 WAT 4962 ATOM 49529 O WAT 4963 109.920 1.487 10.457 1.00 0.00 O ATOM 49530 H1 WAT 4963 109.806 1.965 9.636 1.00 0.00 H ATOM 49531 H2 WAT 4963 110.860 1.313 10.504 1.00 0.00 H TER 49533 WAT 4963 ATOM 49533 O WAT 4964 25.994 63.586 110.670 1.00 0.00 O ATOM 49534 H1 WAT 4964 26.021 64.541 110.730 1.00 0.00 H ATOM 49535 H2 WAT 4964 25.505 63.311 111.445 1.00 0.00 H TER 49537 WAT 4964 ATOM 49537 O WAT 4965 66.124 34.050 92.486 1.00 0.00 O ATOM 49538 H1 WAT 4965 65.824 34.266 93.369 1.00 0.00 H ATOM 49539 H2 WAT 4965 65.589 34.598 91.911 1.00 0.00 H TER 49541 WAT 4965 ATOM 49541 O WAT 4966 86.719 113.553 103.247 1.00 0.00 O ATOM 49542 H1 WAT 4966 86.105 113.697 102.527 1.00 0.00 H ATOM 49543 H2 WAT 4966 87.294 112.854 102.936 1.00 0.00 H TER 49545 WAT 4966 ATOM 49545 O WAT 4967 11.421 108.379 89.949 1.00 0.00 O ATOM 49546 H1 WAT 4967 10.857 109.072 90.293 1.00 0.00 H ATOM 49547 H2 WAT 4967 10.913 107.988 89.238 1.00 0.00 H TER 49549 WAT 4967 ATOM 49549 O WAT 4968 113.845 143.015 11.088 1.00 0.00 O ATOM 49550 H1 WAT 4968 113.132 142.844 11.703 1.00 0.00 H ATOM 49551 H2 WAT 4968 114.590 142.532 11.445 1.00 0.00 H TER 49553 WAT 4968 ATOM 49553 O WAT 4969 127.261 65.600 114.208 1.00 0.00 O ATOM 49554 H1 WAT 4969 128.098 65.458 114.650 1.00 0.00 H ATOM 49555 H2 WAT 4969 126.685 64.922 114.561 1.00 0.00 H TER 49557 WAT 4969 ATOM 49557 O WAT 4970 111.405 112.654 155.958 1.00 0.00 O ATOM 49558 H1 WAT 4970 111.281 113.495 155.518 1.00 0.00 H ATOM 49559 H2 WAT 4970 112.283 112.376 155.701 1.00 0.00 H TER 49561 WAT 4970 ATOM 49561 O WAT 4971 3.986 17.235 118.991 1.00 0.00 O ATOM 49562 H1 WAT 4971 3.789 17.942 118.377 1.00 0.00 H ATOM 49563 H2 WAT 4971 3.368 16.541 118.764 1.00 0.00 H TER 49565 WAT 4971 ATOM 49565 O WAT 4972 42.562 77.133 101.206 1.00 0.00 O ATOM 49566 H1 WAT 4972 41.667 76.795 101.229 1.00 0.00 H ATOM 49567 H2 WAT 4972 43.059 76.464 100.735 1.00 0.00 H TER 49569 WAT 4972 ATOM 49569 O WAT 4973 72.420 14.323 156.991 1.00 0.00 O ATOM 49570 H1 WAT 4973 71.822 13.599 157.173 1.00 0.00 H ATOM 49571 H2 WAT 4973 72.846 14.498 157.831 1.00 0.00 H TER 49573 WAT 4973 ATOM 49573 O WAT 4974 59.171 120.679 144.167 1.00 0.00 O ATOM 49574 H1 WAT 4974 59.258 121.469 144.700 1.00 0.00 H ATOM 49575 H2 WAT 4974 58.300 120.343 144.378 1.00 0.00 H TER 49577 WAT 4974 ATOM 49577 O WAT 4975 116.887 58.545 19.295 1.00 0.00 O ATOM 49578 H1 WAT 4975 116.049 58.254 19.656 1.00 0.00 H ATOM 49579 H2 WAT 4975 117.383 58.849 20.055 1.00 0.00 H TER 49581 WAT 4975 ATOM 49581 O WAT 4976 79.568 101.420 99.219 1.00 0.00 O ATOM 49582 H1 WAT 4976 79.494 101.417 98.265 1.00 0.00 H ATOM 49583 H2 WAT 4976 80.393 100.967 99.397 1.00 0.00 H TER 49585 WAT 4976 ATOM 49585 O WAT 4977 5.103 106.632 137.005 1.00 0.00 O ATOM 49586 H1 WAT 4977 5.445 106.287 137.830 1.00 0.00 H ATOM 49587 H2 WAT 4977 5.180 107.582 137.094 1.00 0.00 H TER 49589 WAT 4977 ATOM 49589 O WAT 4978 130.720 30.005 60.986 1.00 0.00 O ATOM 49590 H1 WAT 4978 131.361 30.230 61.660 1.00 0.00 H ATOM 49591 H2 WAT 4978 131.242 29.867 60.195 1.00 0.00 H TER 49593 WAT 4978 ATOM 49593 O WAT 4979 112.561 -0.211 72.808 1.00 0.00 O ATOM 49594 H1 WAT 4979 112.657 0.516 73.423 1.00 0.00 H ATOM 49595 H2 WAT 4979 112.127 0.174 72.046 1.00 0.00 H TER 49597 WAT 4979 ATOM 49597 O WAT 4980 20.685 143.910 111.894 1.00 0.00 O ATOM 49598 H1 WAT 4980 19.850 144.369 111.802 1.00 0.00 H ATOM 49599 H2 WAT 4980 20.684 143.591 112.797 1.00 0.00 H TER 49601 WAT 4980 ATOM 49601 O WAT 4981 45.439 62.038 125.779 1.00 0.00 O ATOM 49602 H1 WAT 4981 46.165 62.659 125.711 1.00 0.00 H ATOM 49603 H2 WAT 4981 45.325 61.907 126.721 1.00 0.00 H TER 49605 WAT 4981 ATOM 49605 O WAT 4982 128.931 127.121 16.514 1.00 0.00 O ATOM 49606 H1 WAT 4982 129.741 126.741 16.855 1.00 0.00 H ATOM 49607 H2 WAT 4982 128.279 126.429 16.619 1.00 0.00 H TER 49609 WAT 4982 ATOM 49609 O WAT 4983 57.024 51.544 17.620 1.00 0.00 O ATOM 49610 H1 WAT 4983 56.182 51.340 17.211 1.00 0.00 H ATOM 49611 H2 WAT 4983 57.420 50.690 17.791 1.00 0.00 H TER 49613 WAT 4983 ATOM 49613 O WAT 4984 71.983 86.696 134.630 1.00 0.00 O ATOM 49614 H1 WAT 4984 71.245 87.281 134.461 1.00 0.00 H ATOM 49615 H2 WAT 4984 71.815 86.344 135.504 1.00 0.00 H TER 49617 WAT 4984 ATOM 49617 O WAT 4985 40.483 39.414 17.318 1.00 0.00 O ATOM 49618 H1 WAT 4985 40.683 40.349 17.361 1.00 0.00 H ATOM 49619 H2 WAT 4985 41.295 39.009 17.013 1.00 0.00 H TER 49621 WAT 4985 ATOM 49621 O WAT 4986 32.299 109.267 99.258 1.00 0.00 O ATOM 49622 H1 WAT 4986 31.769 109.266 100.055 1.00 0.00 H ATOM 49623 H2 WAT 4986 31.665 109.162 98.549 1.00 0.00 H TER 49625 WAT 4986 ATOM 49625 O WAT 4987 50.808 85.294 85.408 1.00 0.00 O ATOM 49626 H1 WAT 4987 50.669 85.830 86.189 1.00 0.00 H ATOM 49627 H2 WAT 4987 49.964 85.307 84.956 1.00 0.00 H TER 49629 WAT 4987 ATOM 49629 O WAT 4988 114.015 68.379 81.906 1.00 0.00 O ATOM 49630 H1 WAT 4988 113.676 68.452 81.013 1.00 0.00 H ATOM 49631 H2 WAT 4988 113.236 68.414 82.461 1.00 0.00 H TER 49633 WAT 4988 ATOM 49633 O WAT 4989 111.422 7.129 96.919 1.00 0.00 O ATOM 49634 H1 WAT 4989 110.530 6.926 97.201 1.00 0.00 H ATOM 49635 H2 WAT 4989 111.361 7.206 95.967 1.00 0.00 H TER 49637 WAT 4989 ATOM 49637 O WAT 4990 74.300 26.912 118.564 1.00 0.00 O ATOM 49638 H1 WAT 4990 73.350 26.911 118.449 1.00 0.00 H ATOM 49639 H2 WAT 4990 74.472 27.667 119.125 1.00 0.00 H TER 49641 WAT 4990 ATOM 49641 O WAT 4991 87.280 90.665 102.710 1.00 0.00 O ATOM 49642 H1 WAT 4991 87.550 89.866 103.163 1.00 0.00 H ATOM 49643 H2 WAT 4991 86.483 90.939 103.164 1.00 0.00 H TER 49645 WAT 4991 ATOM 49645 O WAT 4992 71.343 37.266 96.984 1.00 0.00 O ATOM 49646 H1 WAT 4992 71.422 37.603 97.876 1.00 0.00 H ATOM 49647 H2 WAT 4992 71.323 36.315 97.087 1.00 0.00 H TER 49649 WAT 4992 ATOM 49649 O WAT 4993 113.115 103.445 126.102 1.00 0.00 O ATOM 49650 H1 WAT 4993 114.038 103.638 125.938 1.00 0.00 H ATOM 49651 H2 WAT 4993 112.721 104.298 126.288 1.00 0.00 H TER 49653 WAT 4993 ATOM 49653 O WAT 4994 64.494 10.006 116.010 1.00 0.00 O ATOM 49654 H1 WAT 4994 63.963 10.290 116.754 1.00 0.00 H ATOM 49655 H2 WAT 4994 65.371 9.884 116.374 1.00 0.00 H TER 49657 WAT 4994 ATOM 49657 O WAT 4995 42.092 17.126 83.092 1.00 0.00 O ATOM 49658 H1 WAT 4995 41.673 16.713 82.337 1.00 0.00 H ATOM 49659 H2 WAT 4995 42.994 17.281 82.811 1.00 0.00 H TER 49661 WAT 4995 ATOM 49661 O WAT 4996 48.057 69.317 110.018 1.00 0.00 O ATOM 49662 H1 WAT 4996 48.013 70.145 109.540 1.00 0.00 H ATOM 49663 H2 WAT 4996 47.178 68.946 109.937 1.00 0.00 H TER 49665 WAT 4996 ATOM 49665 O WAT 4997 14.884 102.079 132.483 1.00 0.00 O ATOM 49666 H1 WAT 4997 15.816 102.119 132.700 1.00 0.00 H ATOM 49667 H2 WAT 4997 14.814 101.349 131.867 1.00 0.00 H TER 49669 WAT 4997 ATOM 49669 O WAT 4998 2.116 37.311 128.571 1.00 0.00 O ATOM 49670 H1 WAT 4998 1.339 37.673 128.144 1.00 0.00 H ATOM 49671 H2 WAT 4998 2.553 36.807 127.885 1.00 0.00 H TER 49673 WAT 4998 ATOM 49673 O WAT 4999 109.970 70.376 76.993 1.00 0.00 O ATOM 49674 H1 WAT 4999 109.099 70.773 76.974 1.00 0.00 H ATOM 49675 H2 WAT 4999 109.804 69.435 77.038 1.00 0.00 H TER 49677 WAT 4999 ATOM 49677 O WAT 5000 74.659 131.091 0.529 1.00 0.00 O ATOM 49678 H1 WAT 5000 74.447 131.732 1.207 1.00 0.00 H ATOM 49679 H2 WAT 5000 74.210 131.413 -0.253 1.00 0.00 H TER 49681 WAT 5000 ATOM 49681 O WAT 5001 111.120 36.983 81.384 1.00 0.00 O ATOM 49682 H1 WAT 5001 112.076 37.016 81.358 1.00 0.00 H ATOM 49683 H2 WAT 5001 110.896 37.241 82.278 1.00 0.00 H TER 49685 WAT 5001 ATOM 49685 O WAT 5002 96.928 52.276 153.677 1.00 0.00 O ATOM 49686 H1 WAT 5002 96.059 51.901 153.537 1.00 0.00 H ATOM 49687 H2 WAT 5002 97.370 52.178 152.833 1.00 0.00 H TER 49689 WAT 5002 ATOM 49689 O WAT 5003 106.808 40.850 137.565 1.00 0.00 O ATOM 49690 H1 WAT 5003 107.414 40.159 137.298 1.00 0.00 H ATOM 49691 H2 WAT 5003 105.959 40.412 137.628 1.00 0.00 H TER 49693 WAT 5003 ATOM 49693 O WAT 5004 33.997 79.611 67.779 1.00 0.00 O ATOM 49694 H1 WAT 5004 34.174 79.414 68.699 1.00 0.00 H ATOM 49695 H2 WAT 5004 33.827 80.553 67.764 1.00 0.00 H TER 49697 WAT 5004 ATOM 49697 O WAT 5005 94.219 94.060 115.352 1.00 0.00 O ATOM 49698 H1 WAT 5005 94.602 93.268 114.975 1.00 0.00 H ATOM 49699 H2 WAT 5005 94.284 93.931 116.298 1.00 0.00 H TER 49701 WAT 5005 ATOM 49701 O WAT 5006 111.471 125.704 3.054 1.00 0.00 O ATOM 49702 H1 WAT 5006 111.284 126.189 3.858 1.00 0.00 H ATOM 49703 H2 WAT 5006 111.866 124.885 3.355 1.00 0.00 H TER 49705 WAT 5006 ATOM 49705 O WAT 5007 142.366 15.186 83.836 1.00 0.00 O ATOM 49706 H1 WAT 5007 141.976 15.955 84.253 1.00 0.00 H ATOM 49707 H2 WAT 5007 141.891 14.444 84.210 1.00 0.00 H TER 49709 WAT 5007 ATOM 49709 O WAT 5008 53.508 128.222 75.058 1.00 0.00 O ATOM 49710 H1 WAT 5008 53.307 127.453 75.592 1.00 0.00 H ATOM 49711 H2 WAT 5008 54.094 127.894 74.376 1.00 0.00 H TER 49713 WAT 5008 ATOM 49713 O WAT 5009 29.368 54.834 146.181 1.00 0.00 O ATOM 49714 H1 WAT 5009 29.348 55.586 145.588 1.00 0.00 H ATOM 49715 H2 WAT 5009 29.044 54.104 145.653 1.00 0.00 H TER 49717 WAT 5009 ATOM 49717 O WAT 5010 14.459 21.706 133.232 1.00 0.00 O ATOM 49718 H1 WAT 5010 14.723 21.416 134.106 1.00 0.00 H ATOM 49719 H2 WAT 5010 15.216 22.191 132.902 1.00 0.00 H TER 49721 WAT 5010 ATOM 49721 O WAT 5011 74.129 64.395 105.942 1.00 0.00 O ATOM 49722 H1 WAT 5011 74.627 63.781 105.402 1.00 0.00 H ATOM 49723 H2 WAT 5011 74.741 64.659 106.630 1.00 0.00 H TER 49725 WAT 5011 ATOM 49725 O WAT 5012 17.793 72.464 81.062 1.00 0.00 O ATOM 49726 H1 WAT 5012 18.009 72.131 81.933 1.00 0.00 H ATOM 49727 H2 WAT 5012 17.921 73.410 81.128 1.00 0.00 H TER 49729 WAT 5012 ATOM 49729 O WAT 5013 61.259 134.635 105.761 1.00 0.00 O ATOM 49730 H1 WAT 5013 60.532 135.241 105.615 1.00 0.00 H ATOM 49731 H2 WAT 5013 61.998 135.031 105.300 1.00 0.00 H TER 49733 WAT 5013 ATOM 49733 O WAT 5014 145.273 21.123 119.064 1.00 0.00 O ATOM 49734 H1 WAT 5014 144.478 21.345 119.548 1.00 0.00 H ATOM 49735 H2 WAT 5014 145.808 21.916 119.105 1.00 0.00 H TER 49737 WAT 5014 ATOM 49737 O WAT 5015 99.412 119.380 65.389 1.00 0.00 O ATOM 49738 H1 WAT 5015 99.077 120.245 65.622 1.00 0.00 H ATOM 49739 H2 WAT 5015 100.361 119.497 65.336 1.00 0.00 H TER 49741 WAT 5015 ATOM 49741 O WAT 5016 126.364 82.610 118.941 1.00 0.00 O ATOM 49742 H1 WAT 5016 126.777 81.922 118.419 1.00 0.00 H ATOM 49743 H2 WAT 5016 127.078 83.212 119.152 1.00 0.00 H TER 49745 WAT 5016 ATOM 49745 O WAT 5017 54.353 36.035 74.764 1.00 0.00 O ATOM 49746 H1 WAT 5017 54.251 35.399 74.055 1.00 0.00 H ATOM 49747 H2 WAT 5017 54.940 36.701 74.406 1.00 0.00 H TER 49749 WAT 5017 ATOM 49749 O WAT 5018 92.044 110.567 9.189 1.00 0.00 O ATOM 49750 H1 WAT 5018 92.170 111.385 8.708 1.00 0.00 H ATOM 49751 H2 WAT 5018 91.687 109.961 8.541 1.00 0.00 H TER 49753 WAT 5018 ATOM 49753 O WAT 5019 60.071 142.128 139.633 1.00 0.00 O ATOM 49754 H1 WAT 5019 60.900 142.139 140.112 1.00 0.00 H ATOM 49755 H2 WAT 5019 59.594 141.383 139.998 1.00 0.00 H TER 49757 WAT 5019 ATOM 49757 O WAT 5020 104.227 62.605 4.801 1.00 0.00 O ATOM 49758 H1 WAT 5020 104.161 63.432 5.279 1.00 0.00 H ATOM 49759 H2 WAT 5020 103.600 62.027 5.234 1.00 0.00 H TER 49761 WAT 5020 ATOM 49761 O WAT 5021 42.887 43.093 152.871 1.00 0.00 O ATOM 49762 H1 WAT 5021 43.664 42.626 152.563 1.00 0.00 H ATOM 49763 H2 WAT 5021 43.085 44.016 152.714 1.00 0.00 H TER 49765 WAT 5021 ATOM 49765 O WAT 5022 67.958 83.926 129.345 1.00 0.00 O ATOM 49766 H1 WAT 5022 67.717 84.117 130.251 1.00 0.00 H ATOM 49767 H2 WAT 5022 68.686 83.308 129.416 1.00 0.00 H TER 49769 WAT 5022 ATOM 49769 O WAT 5023 143.252 97.467 82.220 1.00 0.00 O ATOM 49770 H1 WAT 5023 143.164 97.482 83.173 1.00 0.00 H ATOM 49771 H2 WAT 5023 142.353 97.529 81.895 1.00 0.00 H TER 49773 WAT 5023 ATOM 49773 O WAT 5024 121.084 45.678 15.548 1.00 0.00 O ATOM 49774 H1 WAT 5024 122.031 45.688 15.416 1.00 0.00 H ATOM 49775 H2 WAT 5024 120.778 44.934 15.029 1.00 0.00 H TER 49777 WAT 5024 ATOM 49777 O WAT 5025 54.130 66.585 97.457 1.00 0.00 O ATOM 49778 H1 WAT 5025 53.320 66.692 96.959 1.00 0.00 H ATOM 49779 H2 WAT 5025 53.860 66.656 98.372 1.00 0.00 H TER 49781 WAT 5025 ATOM 49781 O WAT 5026 2.101 106.254 70.853 1.00 0.00 O ATOM 49782 H1 WAT 5026 2.407 107.160 70.870 1.00 0.00 H ATOM 49783 H2 WAT 5026 1.151 106.320 70.950 1.00 0.00 H TER 49785 WAT 5026 ATOM 49785 O WAT 5027 89.966 79.447 114.491 1.00 0.00 O ATOM 49786 H1 WAT 5027 90.211 79.702 115.380 1.00 0.00 H ATOM 49787 H2 WAT 5027 89.017 79.567 114.460 1.00 0.00 H TER 49789 WAT 5027 ATOM 49789 O WAT 5028 105.133 135.187 53.505 1.00 0.00 O ATOM 49790 H1 WAT 5028 104.352 135.734 53.589 1.00 0.00 H ATOM 49791 H2 WAT 5028 104.805 134.290 53.574 1.00 0.00 H TER 49793 WAT 5028 ATOM 49793 O WAT 5029 24.447 129.645 87.459 1.00 0.00 O ATOM 49794 H1 WAT 5029 24.641 130.173 86.685 1.00 0.00 H ATOM 49795 H2 WAT 5029 23.612 129.222 87.258 1.00 0.00 H TER 49797 WAT 5029 ATOM 49797 O WAT 5030 95.851 18.066 5.119 1.00 0.00 O ATOM 49798 H1 WAT 5030 96.530 18.740 5.124 1.00 0.00 H ATOM 49799 H2 WAT 5030 95.718 17.867 4.192 1.00 0.00 H TER 49801 WAT 5030 ATOM 49801 O WAT 5031 122.867 105.830 122.875 1.00 0.00 O ATOM 49802 H1 WAT 5031 122.986 105.446 123.744 1.00 0.00 H ATOM 49803 H2 WAT 5031 122.116 106.416 122.973 1.00 0.00 H TER 49805 WAT 5031 ATOM 49805 O WAT 5032 123.655 25.835 137.572 1.00 0.00 O ATOM 49806 H1 WAT 5032 123.990 25.599 138.437 1.00 0.00 H ATOM 49807 H2 WAT 5032 122.888 26.380 137.754 1.00 0.00 H TER 49809 WAT 5032 ATOM 49809 O WAT 5033 71.114 13.647 119.927 1.00 0.00 O ATOM 49810 H1 WAT 5033 71.656 14.423 119.792 1.00 0.00 H ATOM 49811 H2 WAT 5033 71.518 12.974 119.380 1.00 0.00 H TER 49813 WAT 5033 ATOM 49813 O WAT 5034 21.980 127.625 138.950 1.00 0.00 O ATOM 49814 H1 WAT 5034 21.547 126.814 139.219 1.00 0.00 H ATOM 49815 H2 WAT 5034 22.283 128.017 139.769 1.00 0.00 H TER 49817 WAT 5034 ATOM 49817 O WAT 5035 67.512 69.894 104.649 1.00 0.00 O ATOM 49818 H1 WAT 5035 67.540 70.102 105.583 1.00 0.00 H ATOM 49819 H2 WAT 5035 66.626 69.561 104.504 1.00 0.00 H TER 49821 WAT 5035 ATOM 49821 O WAT 5036 136.758 24.613 156.962 1.00 0.00 O ATOM 49822 H1 WAT 5036 135.886 24.976 156.811 1.00 0.00 H ATOM 49823 H2 WAT 5036 137.234 24.788 156.150 1.00 0.00 H TER 49825 WAT 5036 ATOM 49825 O WAT 5037 117.164 76.739 141.193 1.00 0.00 O ATOM 49826 H1 WAT 5037 117.520 76.950 140.330 1.00 0.00 H ATOM 49827 H2 WAT 5037 117.919 76.440 141.698 1.00 0.00 H TER 49829 WAT 5037 ATOM 49829 O WAT 5038 71.204 44.894 90.253 1.00 0.00 O ATOM 49830 H1 WAT 5038 70.520 44.268 90.494 1.00 0.00 H ATOM 49831 H2 WAT 5038 72.001 44.366 90.194 1.00 0.00 H TER 49833 WAT 5038 ATOM 49833 O WAT 5039 135.756 79.584 18.716 1.00 0.00 O ATOM 49834 H1 WAT 5039 134.931 79.215 19.029 1.00 0.00 H ATOM 49835 H2 WAT 5039 136.008 80.215 19.390 1.00 0.00 H TER 49837 WAT 5039 ATOM 49837 O WAT 5040 22.977 35.360 66.972 1.00 0.00 O ATOM 49838 H1 WAT 5040 23.654 35.078 67.587 1.00 0.00 H ATOM 49839 H2 WAT 5040 22.767 36.255 67.239 1.00 0.00 H TER 49841 WAT 5040 ATOM 49841 O WAT 5041 124.716 33.203 65.631 1.00 0.00 O ATOM 49842 H1 WAT 5041 125.053 33.676 66.392 1.00 0.00 H ATOM 49843 H2 WAT 5041 125.198 33.569 64.889 1.00 0.00 H TER 49845 WAT 5041 ATOM 49845 O WAT 5042 90.716 51.226 121.396 1.00 0.00 O ATOM 49846 H1 WAT 5042 89.785 51.011 121.457 1.00 0.00 H ATOM 49847 H2 WAT 5042 90.832 51.962 121.997 1.00 0.00 H TER 49849 WAT 5042 ATOM 49849 O WAT 5043 85.235 142.695 151.450 1.00 0.00 O ATOM 49850 H1 WAT 5043 85.144 142.116 150.693 1.00 0.00 H ATOM 49851 H2 WAT 5043 85.469 143.544 151.076 1.00 0.00 H TER 49853 WAT 5043 ATOM 49853 O WAT 5044 14.073 39.408 80.964 1.00 0.00 O ATOM 49854 H1 WAT 5044 14.955 39.151 81.233 1.00 0.00 H ATOM 49855 H2 WAT 5044 13.522 39.200 81.718 1.00 0.00 H TER 49857 WAT 5044 ATOM 49857 O WAT 5045 42.785 14.716 111.255 1.00 0.00 O ATOM 49858 H1 WAT 5045 43.552 14.346 110.818 1.00 0.00 H ATOM 49859 H2 WAT 5045 42.985 14.646 112.188 1.00 0.00 H TER 49861 WAT 5045 ATOM 49861 O WAT 5046 83.319 137.702 139.796 1.00 0.00 O ATOM 49862 H1 WAT 5046 83.576 137.467 138.905 1.00 0.00 H ATOM 49863 H2 WAT 5046 83.551 136.936 140.322 1.00 0.00 H TER 49865 WAT 5046 ATOM 49865 O WAT 5047 108.228 140.624 82.454 1.00 0.00 O ATOM 49866 H1 WAT 5047 107.484 140.910 82.985 1.00 0.00 H ATOM 49867 H2 WAT 5047 108.057 139.698 82.282 1.00 0.00 H TER 49869 WAT 5047 ATOM 49869 O WAT 5048 34.918 24.984 96.978 1.00 0.00 O ATOM 49870 H1 WAT 5048 35.613 24.602 97.514 1.00 0.00 H ATOM 49871 H2 WAT 5048 34.914 25.911 97.216 1.00 0.00 H TER 49873 WAT 5048 ATOM 49873 O WAT 5049 36.915 22.645 154.430 1.00 0.00 O ATOM 49874 H1 WAT 5049 37.419 23.150 153.792 1.00 0.00 H ATOM 49875 H2 WAT 5049 36.120 22.392 153.961 1.00 0.00 H TER 49877 WAT 5049 ATOM 49877 O WAT 5050 130.505 76.907 85.162 1.00 0.00 O ATOM 49878 H1 WAT 5050 130.410 77.664 85.740 1.00 0.00 H ATOM 49879 H2 WAT 5050 130.696 77.284 84.303 1.00 0.00 H TER 49881 WAT 5050 ATOM 49881 O WAT 5051 45.349 72.658 108.525 1.00 0.00 O ATOM 49882 H1 WAT 5051 44.599 73.008 108.043 1.00 0.00 H ATOM 49883 H2 WAT 5051 45.563 73.339 109.163 1.00 0.00 H TER 49885 WAT 5051 ATOM 49885 O WAT 5052 64.847 124.330 134.519 1.00 0.00 O ATOM 49886 H1 WAT 5052 65.475 124.330 133.796 1.00 0.00 H ATOM 49887 H2 WAT 5052 65.370 124.108 135.289 1.00 0.00 H TER 49889 WAT 5052 ATOM 49889 O WAT 5053 5.157 17.752 63.680 1.00 0.00 O ATOM 49890 H1 WAT 5053 4.972 17.800 64.618 1.00 0.00 H ATOM 49891 H2 WAT 5053 5.249 16.816 63.501 1.00 0.00 H TER 49893 WAT 5053 ATOM 49893 O WAT 5054 100.793 38.310 140.701 1.00 0.00 O ATOM 49894 H1 WAT 5054 100.435 38.146 141.573 1.00 0.00 H ATOM 49895 H2 WAT 5054 100.050 38.641 140.196 1.00 0.00 H TER 49897 WAT 5054 ATOM 49897 O WAT 5055 141.480 115.847 65.096 1.00 0.00 O ATOM 49898 H1 WAT 5055 141.674 116.230 64.241 1.00 0.00 H ATOM 49899 H2 WAT 5055 140.831 116.437 65.481 1.00 0.00 H TER 49901 WAT 5055 ATOM 49901 O WAT 5056 67.974 126.271 76.618 1.00 0.00 O ATOM 49902 H1 WAT 5056 68.028 127.093 76.131 1.00 0.00 H ATOM 49903 H2 WAT 5056 67.320 125.755 76.145 1.00 0.00 H TER 49905 WAT 5056 ATOM 49905 O WAT 5057 27.702 101.317 138.198 1.00 0.00 O ATOM 49906 H1 WAT 5057 26.982 100.777 137.870 1.00 0.00 H ATOM 49907 H2 WAT 5057 27.661 102.116 137.673 1.00 0.00 H TER 49909 WAT 5057 ATOM 49909 O WAT 5058 28.583 105.249 143.453 1.00 0.00 O ATOM 49910 H1 WAT 5058 29.070 106.052 143.266 1.00 0.00 H ATOM 49911 H2 WAT 5058 28.503 104.815 142.603 1.00 0.00 H TER 49913 WAT 5058 ATOM 49913 O WAT 5059 34.999 67.549 2.624 1.00 0.00 O ATOM 49914 H1 WAT 5059 34.809 67.626 3.559 1.00 0.00 H ATOM 49915 H2 WAT 5059 34.840 66.627 2.422 1.00 0.00 H TER 49917 WAT 5059 ATOM 49917 O WAT 5060 97.274 87.551 150.412 1.00 0.00 O ATOM 49918 H1 WAT 5060 97.089 87.763 151.327 1.00 0.00 H ATOM 49919 H2 WAT 5060 98.205 87.745 150.305 1.00 0.00 H TER 49921 WAT 5060 ATOM 49921 O WAT 5061 84.709 108.796 153.151 1.00 0.00 O ATOM 49922 H1 WAT 5061 84.558 108.258 153.928 1.00 0.00 H ATOM 49923 H2 WAT 5061 84.539 109.692 153.444 1.00 0.00 H TER 49925 WAT 5061 ATOM 49925 O WAT 5062 22.049 107.269 23.298 1.00 0.00 O ATOM 49926 H1 WAT 5062 22.133 107.008 24.215 1.00 0.00 H ATOM 49927 H2 WAT 5062 21.625 108.127 23.331 1.00 0.00 H TER 49929 WAT 5062 ATOM 49929 O WAT 5063 33.403 122.559 137.431 1.00 0.00 O ATOM 49930 H1 WAT 5063 32.547 122.791 137.072 1.00 0.00 H ATOM 49931 H2 WAT 5063 33.627 123.290 138.008 1.00 0.00 H TER 49933 WAT 5063 ATOM 49933 O WAT 5064 112.114 39.329 109.374 1.00 0.00 O ATOM 49934 H1 WAT 5064 112.071 40.162 109.845 1.00 0.00 H ATOM 49935 H2 WAT 5064 111.247 38.941 109.495 1.00 0.00 H TER 49937 WAT 5064 ATOM 49937 O WAT 5065 64.926 52.127 59.822 1.00 0.00 O ATOM 49938 H1 WAT 5065 65.745 52.016 60.305 1.00 0.00 H ATOM 49939 H2 WAT 5065 65.063 51.649 59.004 1.00 0.00 H TER 49941 WAT 5065 ATOM 49941 O WAT 5066 15.483 65.094 96.782 1.00 0.00 O ATOM 49942 H1 WAT 5066 15.454 64.461 96.065 1.00 0.00 H ATOM 49943 H2 WAT 5066 15.578 65.943 96.350 1.00 0.00 H TER 49945 WAT 5066 ATOM 49945 O WAT 5067 27.975 105.194 105.098 1.00 0.00 O ATOM 49946 H1 WAT 5067 27.584 105.700 104.385 1.00 0.00 H ATOM 49947 H2 WAT 5067 27.687 105.640 105.894 1.00 0.00 H TER 49949 WAT 5067 ATOM 49949 O WAT 5068 31.416 25.695 121.539 1.00 0.00 O ATOM 49950 H1 WAT 5068 31.016 25.691 120.669 1.00 0.00 H ATOM 49951 H2 WAT 5068 31.203 24.837 121.905 1.00 0.00 H TER 49953 WAT 5068 ATOM 49953 O WAT 5069 132.922 63.481 80.952 1.00 0.00 O ATOM 49954 H1 WAT 5069 132.432 63.831 80.207 1.00 0.00 H ATOM 49955 H2 WAT 5069 132.539 63.914 81.715 1.00 0.00 H TER 49957 WAT 5069 ATOM 49957 O WAT 5070 40.087 132.587 150.687 1.00 0.00 O ATOM 49958 H1 WAT 5070 40.854 132.020 150.614 1.00 0.00 H ATOM 49959 H2 WAT 5070 40.443 133.442 150.932 1.00 0.00 H TER 49961 WAT 5070 ATOM 49961 O WAT 5071 113.323 76.986 87.970 1.00 0.00 O ATOM 49962 H1 WAT 5071 112.972 76.156 87.647 1.00 0.00 H ATOM 49963 H2 WAT 5071 114.262 76.937 87.787 1.00 0.00 H TER 49965 WAT 5071 ATOM 49965 O WAT 5072 116.937 23.457 99.788 1.00 0.00 O ATOM 49966 H1 WAT 5072 117.212 22.909 99.053 1.00 0.00 H ATOM 49967 H2 WAT 5072 116.186 23.947 99.454 1.00 0.00 H TER 49969 WAT 5072 ATOM 49969 O WAT 5073 80.377 15.758 90.073 1.00 0.00 O ATOM 49970 H1 WAT 5073 80.410 14.845 90.360 1.00 0.00 H ATOM 49971 H2 WAT 5073 79.451 15.918 89.888 1.00 0.00 H TER 49973 WAT 5073 ATOM 49973 O WAT 5074 44.350 20.967 107.420 1.00 0.00 O ATOM 49974 H1 WAT 5074 44.069 20.362 108.107 1.00 0.00 H ATOM 49975 H2 WAT 5074 44.378 20.431 106.627 1.00 0.00 H TER 49977 WAT 5074 ATOM 49977 O WAT 5075 103.228 92.206 79.320 1.00 0.00 O ATOM 49978 H1 WAT 5075 102.556 91.942 78.692 1.00 0.00 H ATOM 49979 H2 WAT 5075 103.612 92.997 78.941 1.00 0.00 H TER 49981 WAT 5075 ATOM 49981 O WAT 5076 75.261 66.002 149.449 1.00 0.00 O ATOM 49982 H1 WAT 5076 76.110 66.316 149.758 1.00 0.00 H ATOM 49983 H2 WAT 5076 75.100 65.206 149.956 1.00 0.00 H TER 49985 WAT 5076 ATOM 49985 O WAT 5077 23.982 33.533 76.423 1.00 0.00 O ATOM 49986 H1 WAT 5077 24.391 32.769 76.018 1.00 0.00 H ATOM 49987 H2 WAT 5077 23.056 33.459 76.194 1.00 0.00 H TER 49989 WAT 5077 ATOM 49989 O WAT 5078 134.983 35.458 69.284 1.00 0.00 O ATOM 49990 H1 WAT 5078 134.545 34.665 68.976 1.00 0.00 H ATOM 49991 H2 WAT 5078 134.274 36.085 69.428 1.00 0.00 H TER 49993 WAT 5078 ATOM 49993 O WAT 5079 69.407 143.026 125.137 1.00 0.00 O ATOM 49994 H1 WAT 5079 68.665 143.485 124.744 1.00 0.00 H ATOM 49995 H2 WAT 5079 70.126 143.162 124.520 1.00 0.00 H TER 49997 WAT 5079 ATOM 49997 O WAT 5080 132.760 116.386 108.685 1.00 0.00 O ATOM 49998 H1 WAT 5080 132.373 117.026 109.282 1.00 0.00 H ATOM 49999 H2 WAT 5080 133.705 116.501 108.789 1.00 0.00 H TER 50001 WAT 5080 ATOM 50001 O WAT 5081 99.657 137.007 112.058 1.00 0.00 O ATOM 50002 H1 WAT 5081 99.480 136.923 111.121 1.00 0.00 H ATOM 50003 H2 WAT 5081 98.815 137.253 112.440 1.00 0.00 H TER 50005 WAT 5081 ATOM 50005 O WAT 5082 77.705 20.458 80.161 1.00 0.00 O ATOM 50006 H1 WAT 5082 77.734 19.590 79.758 1.00 0.00 H ATOM 50007 H2 WAT 5082 78.468 20.479 80.739 1.00 0.00 H TER 50009 WAT 5082 ATOM 50009 O WAT 5083 136.782 12.356 21.104 1.00 0.00 O ATOM 50010 H1 WAT 5083 136.910 13.276 21.333 1.00 0.00 H ATOM 50011 H2 WAT 5083 137.643 11.956 21.227 1.00 0.00 H TER 50013 WAT 5083 ATOM 50013 O WAT 5084 83.383 31.166 136.393 1.00 0.00 O ATOM 50014 H1 WAT 5084 83.868 30.653 135.746 1.00 0.00 H ATOM 50015 H2 WAT 5084 83.954 31.909 136.587 1.00 0.00 H TER 50017 WAT 5084 ATOM 50017 O WAT 5085 23.602 48.207 69.517 1.00 0.00 O ATOM 50018 H1 WAT 5085 24.235 47.575 69.857 1.00 0.00 H ATOM 50019 H2 WAT 5085 23.157 47.743 68.808 1.00 0.00 H TER 50021 WAT 5085 ATOM 50021 O WAT 5086 65.941 19.692 80.823 1.00 0.00 O ATOM 50022 H1 WAT 5086 66.455 18.912 81.033 1.00 0.00 H ATOM 50023 H2 WAT 5086 66.278 20.366 81.413 1.00 0.00 H TER 50025 WAT 5086 ATOM 50025 O WAT 5087 120.468 123.599 89.535 1.00 0.00 O ATOM 50026 H1 WAT 5087 121.148 123.310 88.925 1.00 0.00 H ATOM 50027 H2 WAT 5087 119.715 123.044 89.334 1.00 0.00 H TER 50029 WAT 5087 ATOM 50029 O WAT 5088 10.964 57.308 74.330 1.00 0.00 O ATOM 50030 H1 WAT 5088 11.494 57.590 75.076 1.00 0.00 H ATOM 50031 H2 WAT 5088 11.165 57.942 73.641 1.00 0.00 H TER 50033 WAT 5088 ATOM 50033 O WAT 5089 108.197 136.056 133.826 1.00 0.00 O ATOM 50034 H1 WAT 5089 108.229 136.799 134.429 1.00 0.00 H ATOM 50035 H2 WAT 5089 108.850 135.444 134.166 1.00 0.00 H TER 50037 WAT 5089 ATOM 50037 O WAT 5090 127.657 50.449 126.729 1.00 0.00 O ATOM 50038 H1 WAT 5090 127.986 51.282 126.390 1.00 0.00 H ATOM 50039 H2 WAT 5090 128.432 49.890 126.782 1.00 0.00 H TER 50041 WAT 5090 ATOM 50041 O WAT 5091 94.488 3.587 121.633 1.00 0.00 O ATOM 50042 H1 WAT 5091 93.629 3.314 121.309 1.00 0.00 H ATOM 50043 H2 WAT 5091 95.076 2.876 121.380 1.00 0.00 H TER 50045 WAT 5091 ATOM 50045 O WAT 5092 13.851 18.198 127.838 1.00 0.00 O ATOM 50046 H1 WAT 5092 13.882 17.803 128.709 1.00 0.00 H ATOM 50047 H2 WAT 5092 14.396 17.627 127.296 1.00 0.00 H TER 50049 WAT 5092 ATOM 50049 O WAT 5093 58.217 72.057 20.623 1.00 0.00 O ATOM 50050 H1 WAT 5093 58.311 72.894 20.168 1.00 0.00 H ATOM 50051 H2 WAT 5093 57.980 71.435 19.934 1.00 0.00 H TER 50053 WAT 5093 ATOM 50053 O WAT 5094 94.055 133.030 22.906 1.00 0.00 O ATOM 50054 H1 WAT 5094 93.116 133.006 23.087 1.00 0.00 H ATOM 50055 H2 WAT 5094 94.226 132.223 22.420 1.00 0.00 H TER 50057 WAT 5094 ATOM 50057 O WAT 5095 1.200 9.207 140.027 1.00 0.00 O ATOM 50058 H1 WAT 5095 0.262 9.175 140.217 1.00 0.00 H ATOM 50059 H2 WAT 5095 1.578 9.676 140.771 1.00 0.00 H TER 50061 WAT 5095 ATOM 50061 O WAT 5096 127.695 91.989 8.478 1.00 0.00 O ATOM 50062 H1 WAT 5096 127.309 91.910 9.351 1.00 0.00 H ATOM 50063 H2 WAT 5096 127.380 91.218 8.007 1.00 0.00 H TER 50065 WAT 5096 ATOM 50065 O WAT 5097 56.144 141.586 155.285 1.00 0.00 O ATOM 50066 H1 WAT 5097 56.846 140.956 155.446 1.00 0.00 H ATOM 50067 H2 WAT 5097 56.353 141.965 154.431 1.00 0.00 H TER 50069 WAT 5097 ATOM 50069 O WAT 5098 5.830 34.635 108.092 1.00 0.00 O ATOM 50070 H1 WAT 5098 5.984 34.658 109.036 1.00 0.00 H ATOM 50071 H2 WAT 5098 6.641 34.283 107.725 1.00 0.00 H TER 50073 WAT 5098 ATOM 50073 O WAT 5099 106.677 39.498 73.469 1.00 0.00 O ATOM 50074 H1 WAT 5099 107.586 39.734 73.284 1.00 0.00 H ATOM 50075 H2 WAT 5099 106.439 38.894 72.766 1.00 0.00 H TER 50077 WAT 5099 ATOM 50077 O WAT 5100 44.858 74.438 89.118 1.00 0.00 O ATOM 50078 H1 WAT 5100 45.009 73.754 88.465 1.00 0.00 H ATOM 50079 H2 WAT 5100 44.893 73.979 89.957 1.00 0.00 H TER 50081 WAT 5100 ATOM 50081 O WAT 5101 42.359 47.191 131.589 1.00 0.00 O ATOM 50082 H1 WAT 5101 43.045 47.277 130.927 1.00 0.00 H ATOM 50083 H2 WAT 5101 42.244 46.246 131.692 1.00 0.00 H TER 50085 WAT 5101 ATOM 50085 O WAT 5102 46.502 10.414 136.133 1.00 0.00 O ATOM 50086 H1 WAT 5102 46.852 11.268 135.877 1.00 0.00 H ATOM 50087 H2 WAT 5102 46.733 10.329 137.057 1.00 0.00 H TER 50089 WAT 5102 ATOM 50089 O WAT 5103 97.786 123.113 116.639 1.00 0.00 O ATOM 50090 H1 WAT 5103 98.616 122.641 116.576 1.00 0.00 H ATOM 50091 H2 WAT 5103 97.887 123.674 117.408 1.00 0.00 H TER 50093 WAT 5103 ATOM 50093 O WAT 5104 35.344 41.568 119.773 1.00 0.00 O ATOM 50094 H1 WAT 5104 34.632 40.988 120.042 1.00 0.00 H ATOM 50095 H2 WAT 5104 36.131 41.172 120.147 1.00 0.00 H TER 50097 WAT 5104 ATOM 50097 O WAT 5105 8.397 127.030 135.215 1.00 0.00 O ATOM 50098 H1 WAT 5105 8.174 126.535 134.426 1.00 0.00 H ATOM 50099 H2 WAT 5105 8.952 126.436 135.721 1.00 0.00 H TER 50101 WAT 5105 ATOM 50101 O WAT 5106 36.706 3.644 131.507 1.00 0.00 O ATOM 50102 H1 WAT 5106 36.864 3.005 130.811 1.00 0.00 H ATOM 50103 H2 WAT 5106 36.780 3.139 132.317 1.00 0.00 H TER 50105 WAT 5106 ATOM 50105 O WAT 5107 102.129 104.193 61.213 1.00 0.00 O ATOM 50106 H1 WAT 5107 101.468 104.876 61.101 1.00 0.00 H ATOM 50107 H2 WAT 5107 102.448 104.020 60.327 1.00 0.00 H TER 50109 WAT 5107 ATOM 50109 O WAT 5108 70.322 68.999 91.807 1.00 0.00 O ATOM 50110 H1 WAT 5108 69.763 68.556 91.169 1.00 0.00 H ATOM 50111 H2 WAT 5108 69.740 69.621 92.244 1.00 0.00 H TER 50113 WAT 5108 ATOM 50113 O WAT 5109 54.720 6.326 63.148 1.00 0.00 O ATOM 50114 H1 WAT 5109 54.430 6.246 62.239 1.00 0.00 H ATOM 50115 H2 WAT 5109 55.178 5.504 63.326 1.00 0.00 H TER 50117 WAT 5109 ATOM 50117 O WAT 5110 112.037 91.079 94.279 1.00 0.00 O ATOM 50118 H1 WAT 5110 112.537 90.306 94.017 1.00 0.00 H ATOM 50119 H2 WAT 5110 112.647 91.808 94.168 1.00 0.00 H TER 50121 WAT 5110 ATOM 50121 O WAT 5111 81.394 97.533 17.385 1.00 0.00 O ATOM 50122 H1 WAT 5111 81.397 97.400 18.333 1.00 0.00 H ATOM 50123 H2 WAT 5111 81.085 96.700 17.028 1.00 0.00 H TER 50125 WAT 5111 ATOM 50125 O WAT 5112 68.424 22.519 107.516 1.00 0.00 O ATOM 50126 H1 WAT 5112 69.040 23.185 107.212 1.00 0.00 H ATOM 50127 H2 WAT 5112 67.668 23.016 107.828 1.00 0.00 H TER 50129 WAT 5112 ATOM 50129 O WAT 5113 86.811 65.363 82.370 1.00 0.00 O ATOM 50130 H1 WAT 5113 86.844 64.575 82.912 1.00 0.00 H ATOM 50131 H2 WAT 5113 86.458 65.063 81.532 1.00 0.00 H TER 50133 WAT 5113 ATOM 50133 O WAT 5114 36.286 142.083 136.377 1.00 0.00 O ATOM 50134 H1 WAT 5114 35.399 142.254 136.695 1.00 0.00 H ATOM 50135 H2 WAT 5114 36.220 142.168 135.426 1.00 0.00 H TER 50137 WAT 5114 ATOM 50137 O WAT 5115 71.901 142.692 133.158 1.00 0.00 O ATOM 50138 H1 WAT 5115 70.966 142.870 133.254 1.00 0.00 H ATOM 50139 H2 WAT 5115 72.262 143.499 132.790 1.00 0.00 H TER 50141 WAT 5115 ATOM 50141 O WAT 5116 126.383 124.716 139.283 1.00 0.00 O ATOM 50142 H1 WAT 5116 126.090 124.117 138.596 1.00 0.00 H ATOM 50143 H2 WAT 5116 126.132 124.284 140.100 1.00 0.00 H TER 50145 WAT 5116 ATOM 50145 O WAT 5117 35.427 116.330 92.809 1.00 0.00 O ATOM 50146 H1 WAT 5117 36.308 116.702 92.806 1.00 0.00 H ATOM 50147 H2 WAT 5117 35.565 115.387 92.718 1.00 0.00 H TER 50149 WAT 5117 ATOM 50149 O WAT 5118 20.100 10.987 119.542 1.00 0.00 O ATOM 50150 H1 WAT 5118 20.334 10.659 120.410 1.00 0.00 H ATOM 50151 H2 WAT 5118 20.764 10.618 118.959 1.00 0.00 H TER 50153 WAT 5118 ATOM 50153 O WAT 5119 145.044 53.409 112.460 1.00 0.00 O ATOM 50154 H1 WAT 5119 145.117 53.356 113.413 1.00 0.00 H ATOM 50155 H2 WAT 5119 145.550 52.663 112.139 1.00 0.00 H TER 50157 WAT 5119 ATOM 50157 O WAT 5120 88.528 116.821 77.709 1.00 0.00 O ATOM 50158 H1 WAT 5120 88.541 117.616 78.242 1.00 0.00 H ATOM 50159 H2 WAT 5120 89.233 116.282 78.066 1.00 0.00 H TER 50161 WAT 5120 ATOM 50161 O WAT 5121 41.760 79.188 80.161 1.00 0.00 O ATOM 50162 H1 WAT 5121 41.351 79.524 79.363 1.00 0.00 H ATOM 50163 H2 WAT 5121 41.047 79.152 80.799 1.00 0.00 H TER 50165 WAT 5121 ATOM 50165 O WAT 5122 46.226 107.412 126.580 1.00 0.00 O ATOM 50166 H1 WAT 5122 45.348 107.189 126.269 1.00 0.00 H ATOM 50167 H2 WAT 5122 46.815 106.927 126.001 1.00 0.00 H TER 50169 WAT 5122 ATOM 50169 O WAT 5123 58.978 30.432 135.933 1.00 0.00 O ATOM 50170 H1 WAT 5123 58.199 30.341 135.385 1.00 0.00 H ATOM 50171 H2 WAT 5123 58.652 30.349 136.829 1.00 0.00 H TER 50173 WAT 5123 ATOM 50173 O WAT 5124 36.109 126.762 8.444 1.00 0.00 O ATOM 50174 H1 WAT 5124 35.160 126.797 8.324 1.00 0.00 H ATOM 50175 H2 WAT 5124 36.356 125.888 8.142 1.00 0.00 H TER 50177 WAT 5124 ATOM 50177 O WAT 5125 83.852 116.369 1.194 1.00 0.00 O ATOM 50178 H1 WAT 5125 83.670 117.292 1.017 1.00 0.00 H ATOM 50179 H2 WAT 5125 83.283 116.150 1.932 1.00 0.00 H TER 50181 WAT 5125 ATOM 50181 O WAT 5126 38.597 6.600 145.442 1.00 0.00 O ATOM 50182 H1 WAT 5126 38.154 6.463 146.279 1.00 0.00 H ATOM 50183 H2 WAT 5126 38.482 5.774 144.972 1.00 0.00 H TER 50185 WAT 5126 ATOM 50185 O WAT 5127 113.569 39.251 74.539 1.00 0.00 O ATOM 50186 H1 WAT 5127 112.983 38.570 74.868 1.00 0.00 H ATOM 50187 H2 WAT 5127 113.285 40.048 74.987 1.00 0.00 H TER 50189 WAT 5127 ATOM 50189 O WAT 5128 70.910 51.451 107.839 1.00 0.00 O ATOM 50190 H1 WAT 5128 70.131 51.359 108.387 1.00 0.00 H ATOM 50191 H2 WAT 5128 70.899 52.366 107.558 1.00 0.00 H TER 50193 WAT 5128 ATOM 50193 O WAT 5129 4.614 69.150 147.069 1.00 0.00 O ATOM 50194 H1 WAT 5129 5.417 69.427 146.628 1.00 0.00 H ATOM 50195 H2 WAT 5129 4.198 69.967 147.345 1.00 0.00 H TER 50197 WAT 5129 ATOM 50197 O WAT 5130 78.116 22.677 146.919 1.00 0.00 O ATOM 50198 H1 WAT 5130 77.755 23.428 146.448 1.00 0.00 H ATOM 50199 H2 WAT 5130 78.486 23.051 147.719 1.00 0.00 H TER 50201 WAT 5130 ATOM 50201 O WAT 5131 25.072 97.711 158.908 1.00 0.00 O ATOM 50202 H1 WAT 5131 25.944 97.792 159.293 1.00 0.00 H ATOM 50203 H2 WAT 5131 25.234 97.545 157.979 1.00 0.00 H TER 50205 WAT 5131 ATOM 50205 O WAT 5132 105.242 69.103 137.451 1.00 0.00 O ATOM 50206 H1 WAT 5132 105.120 68.696 136.593 1.00 0.00 H ATOM 50207 H2 WAT 5132 106.020 68.677 137.810 1.00 0.00 H TER 50209 WAT 5132 ATOM 50209 O WAT 5133 83.806 8.927 143.142 1.00 0.00 O ATOM 50210 H1 WAT 5133 84.081 8.941 142.225 1.00 0.00 H ATOM 50211 H2 WAT 5133 84.622 8.836 143.635 1.00 0.00 H TER 50213 WAT 5133 ATOM 50213 O WAT 5134 110.313 83.238 106.714 1.00 0.00 O ATOM 50214 H1 WAT 5134 109.911 82.487 106.278 1.00 0.00 H ATOM 50215 H2 WAT 5134 110.667 82.881 107.529 1.00 0.00 H TER 50217 WAT 5134 ATOM 50217 O WAT 5135 64.889 85.350 91.780 1.00 0.00 O ATOM 50218 H1 WAT 5135 65.790 85.185 91.504 1.00 0.00 H ATOM 50219 H2 WAT 5135 64.678 86.208 91.412 1.00 0.00 H TER 50221 WAT 5135 ATOM 50221 O WAT 5136 95.190 141.824 56.722 1.00 0.00 O ATOM 50222 H1 WAT 5136 95.899 141.196 56.860 1.00 0.00 H ATOM 50223 H2 WAT 5136 94.506 141.320 56.281 1.00 0.00 H TER 50225 WAT 5136 ATOM 50225 O WAT 5137 26.969 39.755 2.939 1.00 0.00 O ATOM 50226 H1 WAT 5137 27.333 38.872 2.870 1.00 0.00 H ATOM 50227 H2 WAT 5137 26.021 39.623 2.943 1.00 0.00 H TER 50229 WAT 5137 ATOM 50229 O WAT 5138 52.216 97.761 95.596 1.00 0.00 O ATOM 50230 H1 WAT 5138 51.275 97.837 95.436 1.00 0.00 H ATOM 50231 H2 WAT 5138 52.348 96.840 95.820 1.00 0.00 H TER 50233 WAT 5138 ATOM 50233 O WAT 5139 83.077 114.870 128.960 1.00 0.00 O ATOM 50234 H1 WAT 5139 83.354 114.414 129.755 1.00 0.00 H ATOM 50235 H2 WAT 5139 82.233 115.259 129.190 1.00 0.00 H TER 50237 WAT 5139 ATOM 50237 O WAT 5140 81.888 25.052 89.811 1.00 0.00 O ATOM 50238 H1 WAT 5140 81.909 25.961 90.111 1.00 0.00 H ATOM 50239 H2 WAT 5140 81.351 24.598 90.461 1.00 0.00 H TER 50241 WAT 5140 ATOM 50241 O WAT 5141 69.462 106.373 23.583 1.00 0.00 O ATOM 50242 H1 WAT 5141 70.229 106.937 23.479 1.00 0.00 H ATOM 50243 H2 WAT 5141 68.745 106.870 23.190 1.00 0.00 H TER 50245 WAT 5141 ATOM 50245 O WAT 5142 27.662 41.023 67.269 1.00 0.00 O ATOM 50246 H1 WAT 5142 27.311 41.080 68.158 1.00 0.00 H ATOM 50247 H2 WAT 5142 26.917 41.228 66.704 1.00 0.00 H TER 50249 WAT 5142 ATOM 50249 O WAT 5143 49.670 122.307 5.112 1.00 0.00 O ATOM 50250 H1 WAT 5143 49.583 123.161 4.688 1.00 0.00 H ATOM 50251 H2 WAT 5143 48.837 121.867 4.937 1.00 0.00 H TER 50253 WAT 5143 ATOM 50253 O WAT 5144 60.779 78.659 134.068 1.00 0.00 O ATOM 50254 H1 WAT 5144 60.314 79.464 134.298 1.00 0.00 H ATOM 50255 H2 WAT 5144 61.373 78.919 133.363 1.00 0.00 H TER 50257 WAT 5144 ATOM 50257 O WAT 5145 71.285 81.890 61.420 1.00 0.00 O ATOM 50258 H1 WAT 5145 71.494 81.988 60.491 1.00 0.00 H ATOM 50259 H2 WAT 5145 71.978 81.326 61.763 1.00 0.00 H TER 50261 WAT 5145 ATOM 50261 O WAT 5146 47.660 117.329 112.619 1.00 0.00 O ATOM 50262 H1 WAT 5146 47.306 117.363 111.730 1.00 0.00 H ATOM 50263 H2 WAT 5146 47.856 116.403 112.763 1.00 0.00 H TER 50265 WAT 5146 ATOM 50265 O WAT 5147 71.338 47.895 100.879 1.00 0.00 O ATOM 50266 H1 WAT 5147 71.421 47.762 99.935 1.00 0.00 H ATOM 50267 H2 WAT 5147 70.834 47.140 101.183 1.00 0.00 H TER 50269 WAT 5147 ATOM 50269 O WAT 5148 3.271 99.070 11.344 1.00 0.00 O ATOM 50270 H1 WAT 5148 3.878 99.367 12.022 1.00 0.00 H ATOM 50271 H2 WAT 5148 2.441 98.944 11.804 1.00 0.00 H TER 50273 WAT 5148 ATOM 50273 O WAT 5149 73.269 42.188 158.881 1.00 0.00 O ATOM 50274 H1 WAT 5149 73.326 41.728 158.043 1.00 0.00 H ATOM 50275 H2 WAT 5149 74.156 42.509 159.039 1.00 0.00 H TER 50277 WAT 5149 ATOM 50277 O WAT 5150 132.340 37.390 141.298 1.00 0.00 O ATOM 50278 H1 WAT 5150 132.930 37.969 141.781 1.00 0.00 H ATOM 50279 H2 WAT 5150 131.608 37.242 141.897 1.00 0.00 H TER 50281 WAT 5150 ATOM 50281 O WAT 5151 17.830 38.131 78.911 1.00 0.00 O ATOM 50282 H1 WAT 5151 17.646 38.103 79.850 1.00 0.00 H ATOM 50283 H2 WAT 5151 18.719 37.786 78.831 1.00 0.00 H TER 50285 WAT 5151 ATOM 50285 O WAT 5152 63.975 16.848 66.297 1.00 0.00 O ATOM 50286 H1 WAT 5152 63.255 17.301 65.858 1.00 0.00 H ATOM 50287 H2 WAT 5152 63.834 17.021 67.228 1.00 0.00 H TER 50289 WAT 5152 ATOM 50289 O WAT 5153 109.606 83.077 0.383 1.00 0.00 O ATOM 50290 H1 WAT 5153 110.447 83.423 0.083 1.00 0.00 H ATOM 50291 H2 WAT 5153 108.976 83.769 0.180 1.00 0.00 H TER 50293 WAT 5153 ATOM 50293 O WAT 5154 33.620 125.655 136.028 1.00 0.00 O ATOM 50294 H1 WAT 5154 34.184 124.911 135.818 1.00 0.00 H ATOM 50295 H2 WAT 5154 33.888 126.339 135.414 1.00 0.00 H TER 50297 WAT 5154 ATOM 50297 O WAT 5155 114.732 2.896 63.997 1.00 0.00 O ATOM 50298 H1 WAT 5155 114.297 3.489 63.384 1.00 0.00 H ATOM 50299 H2 WAT 5155 114.024 2.555 64.544 1.00 0.00 H TER 50301 WAT 5155 ATOM 50301 O WAT 5156 44.141 73.328 97.984 1.00 0.00 O ATOM 50302 H1 WAT 5156 43.886 73.486 98.893 1.00 0.00 H ATOM 50303 H2 WAT 5156 43.364 73.558 97.474 1.00 0.00 H TER 50305 WAT 5156 ATOM 50305 O WAT 5157 28.320 92.024 102.610 1.00 0.00 O ATOM 50306 H1 WAT 5157 27.648 91.393 102.353 1.00 0.00 H ATOM 50307 H2 WAT 5157 28.199 92.132 103.553 1.00 0.00 H TER 50309 WAT 5157 ATOM 50309 O WAT 5158 54.198 24.152 107.410 1.00 0.00 O ATOM 50310 H1 WAT 5158 53.697 24.588 108.099 1.00 0.00 H ATOM 50311 H2 WAT 5158 53.874 24.540 106.597 1.00 0.00 H TER 50313 WAT 5158 ATOM 50313 O WAT 5159 138.112 127.908 8.000 1.00 0.00 O ATOM 50314 H1 WAT 5159 138.930 127.434 8.150 1.00 0.00 H ATOM 50315 H2 WAT 5159 137.696 127.947 8.861 1.00 0.00 H TER 50317 WAT 5159 ATOM 50317 O WAT 5160 65.308 94.818 11.310 1.00 0.00 O ATOM 50318 H1 WAT 5160 64.839 95.387 11.920 1.00 0.00 H ATOM 50319 H2 WAT 5160 65.113 93.931 11.612 1.00 0.00 H TER 50321 WAT 5160 ATOM 50321 O WAT 5161 100.609 100.038 121.621 1.00 0.00 O ATOM 50322 H1 WAT 5161 100.234 99.408 122.236 1.00 0.00 H ATOM 50323 H2 WAT 5161 100.726 99.542 120.811 1.00 0.00 H TER 50325 WAT 5161 ATOM 50325 O WAT 5162 53.725 137.648 132.498 1.00 0.00 O ATOM 50326 H1 WAT 5162 54.457 137.253 132.970 1.00 0.00 H ATOM 50327 H2 WAT 5162 53.191 136.904 132.219 1.00 0.00 H TER 50329 WAT 5162 ATOM 50329 O WAT 5163 36.240 6.533 155.303 1.00 0.00 O ATOM 50330 H1 WAT 5163 36.502 5.819 155.884 1.00 0.00 H ATOM 50331 H2 WAT 5163 35.297 6.414 155.188 1.00 0.00 H TER 50333 WAT 5163 ATOM 50333 O WAT 5164 124.415 18.251 140.635 1.00 0.00 O ATOM 50334 H1 WAT 5164 123.677 18.313 140.029 1.00 0.00 H ATOM 50335 H2 WAT 5164 124.659 19.160 140.809 1.00 0.00 H TER 50337 WAT 5164 ATOM 50337 O WAT 5165 20.842 21.593 64.692 1.00 0.00 O ATOM 50338 H1 WAT 5165 21.740 21.872 64.869 1.00 0.00 H ATOM 50339 H2 WAT 5165 20.644 21.956 63.829 1.00 0.00 H TER 50341 WAT 5165 ATOM 50341 O WAT 5166 94.460 62.848 123.812 1.00 0.00 O ATOM 50342 H1 WAT 5166 94.392 61.904 123.952 1.00 0.00 H ATOM 50343 H2 WAT 5166 94.924 63.172 124.585 1.00 0.00 H TER 50345 WAT 5166 ATOM 50345 O WAT 5167 91.276 143.736 135.019 1.00 0.00 O ATOM 50346 H1 WAT 5167 90.401 143.683 134.634 1.00 0.00 H ATOM 50347 H2 WAT 5167 91.837 143.264 134.405 1.00 0.00 H TER 50349 WAT 5167 ATOM 50349 O WAT 5168 38.559 113.355 89.902 1.00 0.00 O ATOM 50350 H1 WAT 5168 38.768 113.413 90.834 1.00 0.00 H ATOM 50351 H2 WAT 5168 38.930 112.517 89.625 1.00 0.00 H TER 50353 WAT 5168 ATOM 50353 O WAT 5169 89.037 138.236 139.033 1.00 0.00 O ATOM 50354 H1 WAT 5169 88.332 138.756 138.647 1.00 0.00 H ATOM 50355 H2 WAT 5169 89.454 137.806 138.287 1.00 0.00 H TER 50357 WAT 5169 ATOM 50357 O WAT 5170 40.476 23.969 15.334 1.00 0.00 O ATOM 50358 H1 WAT 5170 41.035 23.532 15.977 1.00 0.00 H ATOM 50359 H2 WAT 5170 39.742 23.368 15.208 1.00 0.00 H TER 50361 WAT 5170 ATOM 50361 O WAT 5171 112.084 42.907 23.989 1.00 0.00 O ATOM 50362 H1 WAT 5171 112.200 42.011 23.672 1.00 0.00 H ATOM 50363 H2 WAT 5171 112.813 43.393 23.605 1.00 0.00 H TER 50365 WAT 5171 ATOM 50365 O WAT 5172 139.992 84.543 98.662 1.00 0.00 O ATOM 50366 H1 WAT 5172 139.374 83.936 98.257 1.00 0.00 H ATOM 50367 H2 WAT 5172 140.184 85.183 97.977 1.00 0.00 H TER 50369 WAT 5172 ATOM 50369 O WAT 5173 87.195 100.780 62.074 1.00 0.00 O ATOM 50370 H1 WAT 5173 87.969 100.308 62.382 1.00 0.00 H ATOM 50371 H2 WAT 5173 86.577 100.728 62.803 1.00 0.00 H TER 50373 WAT 5173 ATOM 50373 O WAT 5174 71.652 127.705 138.055 1.00 0.00 O ATOM 50374 H1 WAT 5174 70.765 127.721 138.415 1.00 0.00 H ATOM 50375 H2 WAT 5174 72.122 127.077 138.605 1.00 0.00 H TER 50377 WAT 5174 ATOM 50377 O WAT 5175 57.569 20.559 155.924 1.00 0.00 O ATOM 50378 H1 WAT 5175 57.564 20.256 155.017 1.00 0.00 H ATOM 50379 H2 WAT 5175 58.455 20.372 156.235 1.00 0.00 H TER 50381 WAT 5175 ATOM 50381 O WAT 5176 19.344 118.515 103.784 1.00 0.00 O ATOM 50382 H1 WAT 5176 18.828 117.766 103.488 1.00 0.00 H ATOM 50383 H2 WAT 5176 19.183 119.192 103.127 1.00 0.00 H TER 50385 WAT 5176 ATOM 50385 O WAT 5177 14.335 20.453 65.474 1.00 0.00 O ATOM 50386 H1 WAT 5177 13.971 20.869 64.692 1.00 0.00 H ATOM 50387 H2 WAT 5177 15.283 20.531 65.367 1.00 0.00 H TER 50389 WAT 5177 ATOM 50389 O WAT 5178 74.337 58.112 129.660 1.00 0.00 O ATOM 50390 H1 WAT 5178 73.392 57.966 129.706 1.00 0.00 H ATOM 50391 H2 WAT 5178 74.453 58.692 128.907 1.00 0.00 H TER 50393 WAT 5178 ATOM 50393 O WAT 5179 62.628 127.288 16.338 1.00 0.00 O ATOM 50394 H1 WAT 5179 63.234 126.658 16.727 1.00 0.00 H ATOM 50395 H2 WAT 5179 62.156 127.659 17.083 1.00 0.00 H TER 50397 WAT 5179 ATOM 50397 O WAT 5180 117.994 105.650 145.492 1.00 0.00 O ATOM 50398 H1 WAT 5180 118.127 106.465 145.008 1.00 0.00 H ATOM 50399 H2 WAT 5180 118.473 105.777 146.311 1.00 0.00 H TER 50401 WAT 5180 ATOM 50401 O WAT 5181 38.022 67.772 154.123 1.00 0.00 O ATOM 50402 H1 WAT 5181 37.087 67.895 154.285 1.00 0.00 H ATOM 50403 H2 WAT 5181 38.453 68.315 154.784 1.00 0.00 H TER 50405 WAT 5181 ATOM 50405 O WAT 5182 41.787 5.814 156.755 1.00 0.00 O ATOM 50406 H1 WAT 5182 42.132 6.483 156.164 1.00 0.00 H ATOM 50407 H2 WAT 5182 42.535 5.565 157.299 1.00 0.00 H TER 50409 WAT 5182 ATOM 50409 O WAT 5183 124.004 76.458 110.275 1.00 0.00 O ATOM 50410 H1 WAT 5183 124.656 76.981 109.808 1.00 0.00 H ATOM 50411 H2 WAT 5183 123.257 77.047 110.381 1.00 0.00 H TER 50413 WAT 5183 ATOM 50413 O WAT 5184 111.561 91.260 10.755 1.00 0.00 O ATOM 50414 H1 WAT 5184 111.030 90.698 10.190 1.00 0.00 H ATOM 50415 H2 WAT 5184 112.428 90.855 10.749 1.00 0.00 H TER 50417 WAT 5184 ATOM 50417 O WAT 5185 100.790 127.686 78.097 1.00 0.00 O ATOM 50418 H1 WAT 5185 100.446 127.189 77.355 1.00 0.00 H ATOM 50419 H2 WAT 5185 101.731 127.743 77.933 1.00 0.00 H TER 50421 WAT 5185 ATOM 50421 O WAT 5186 106.367 20.890 140.806 1.00 0.00 O ATOM 50422 H1 WAT 5186 106.734 20.450 141.573 1.00 0.00 H ATOM 50423 H2 WAT 5186 107.100 21.382 140.438 1.00 0.00 H TER 50425 WAT 5186 ATOM 50425 O WAT 5187 137.326 19.696 80.084 1.00 0.00 O ATOM 50426 H1 WAT 5187 137.799 19.485 79.279 1.00 0.00 H ATOM 50427 H2 WAT 5187 137.086 18.845 80.451 1.00 0.00 H TER 50429 WAT 5187 ATOM 50429 O WAT 5188 143.763 4.250 22.396 1.00 0.00 O ATOM 50430 H1 WAT 5188 144.120 3.561 21.836 1.00 0.00 H ATOM 50431 H2 WAT 5188 143.845 3.902 23.284 1.00 0.00 H TER 50433 WAT 5188 ATOM 50433 O WAT 5189 65.146 65.393 67.922 1.00 0.00 O ATOM 50434 H1 WAT 5189 64.975 66.326 67.797 1.00 0.00 H ATOM 50435 H2 WAT 5189 64.959 64.999 67.070 1.00 0.00 H TER 50437 WAT 5189 ATOM 50437 O WAT 5190 54.860 142.911 9.015 1.00 0.00 O ATOM 50438 H1 WAT 5190 55.018 143.643 8.420 1.00 0.00 H ATOM 50439 H2 WAT 5190 53.908 142.807 9.019 1.00 0.00 H TER 50441 WAT 5190 ATOM 50441 O WAT 5191 25.539 39.955 10.068 1.00 0.00 O ATOM 50442 H1 WAT 5191 25.289 40.352 10.902 1.00 0.00 H ATOM 50443 H2 WAT 5191 25.632 39.023 10.265 1.00 0.00 H TER 50445 WAT 5191 ATOM 50445 O WAT 5192 52.031 43.802 136.993 1.00 0.00 O ATOM 50446 H1 WAT 5192 52.720 44.448 136.842 1.00 0.00 H ATOM 50447 H2 WAT 5192 51.743 43.964 137.891 1.00 0.00 H TER 50449 WAT 5192 ATOM 50449 O WAT 5193 123.655 8.794 94.436 1.00 0.00 O ATOM 50450 H1 WAT 5193 124.101 7.951 94.347 1.00 0.00 H ATOM 50451 H2 WAT 5193 122.750 8.564 94.647 1.00 0.00 H TER 50453 WAT 5193 ATOM 50453 O WAT 5194 93.514 119.541 6.160 1.00 0.00 O ATOM 50454 H1 WAT 5194 93.657 118.604 6.300 1.00 0.00 H ATOM 50455 H2 WAT 5194 94.385 119.889 5.967 1.00 0.00 H TER 50457 WAT 5194 ATOM 50457 O WAT 5195 53.441 12.150 126.920 1.00 0.00 O ATOM 50458 H1 WAT 5195 54.155 12.467 127.473 1.00 0.00 H ATOM 50459 H2 WAT 5195 52.688 12.686 127.170 1.00 0.00 H TER 50461 WAT 5195 ATOM 50461 O WAT 5196 40.679 80.445 84.496 1.00 0.00 O ATOM 50462 H1 WAT 5196 41.237 79.668 84.532 1.00 0.00 H ATOM 50463 H2 WAT 5196 41.278 81.177 84.643 1.00 0.00 H TER 50465 WAT 5196 ATOM 50465 O WAT 5197 25.510 18.538 153.292 1.00 0.00 O ATOM 50466 H1 WAT 5197 25.358 18.854 154.183 1.00 0.00 H ATOM 50467 H2 WAT 5197 25.999 19.243 152.868 1.00 0.00 H TER 50469 WAT 5197 ATOM 50469 O WAT 5198 20.470 74.257 87.778 1.00 0.00 O ATOM 50470 H1 WAT 5198 21.058 74.933 87.439 1.00 0.00 H ATOM 50471 H2 WAT 5198 20.073 74.652 88.554 1.00 0.00 H TER 50473 WAT 5198 ATOM 50473 O WAT 5199 130.809 139.706 92.531 1.00 0.00 O ATOM 50474 H1 WAT 5199 131.296 139.598 93.348 1.00 0.00 H ATOM 50475 H2 WAT 5199 130.570 138.816 92.275 1.00 0.00 H TER 50477 WAT 5199 ATOM 50477 O WAT 5200 46.080 89.066 149.463 1.00 0.00 O ATOM 50478 H1 WAT 5200 46.710 88.809 148.790 1.00 0.00 H ATOM 50479 H2 WAT 5200 45.951 88.274 149.985 1.00 0.00 H TER 50481 WAT 5200 ATOM 50481 O WAT 5201 132.399 126.755 93.904 1.00 0.00 O ATOM 50482 H1 WAT 5201 131.952 126.353 93.160 1.00 0.00 H ATOM 50483 H2 WAT 5201 133.262 126.994 93.565 1.00 0.00 H TER 50485 WAT 5201 ATOM 50485 O WAT 5202 87.712 81.987 102.138 1.00 0.00 O ATOM 50486 H1 WAT 5202 86.956 81.795 102.694 1.00 0.00 H ATOM 50487 H2 WAT 5202 88.427 82.147 102.753 1.00 0.00 H TER 50489 WAT 5202 ATOM 50489 O WAT 5203 61.262 110.574 64.651 1.00 0.00 O ATOM 50490 H1 WAT 5203 60.536 109.956 64.568 1.00 0.00 H ATOM 50491 H2 WAT 5203 61.189 110.911 65.544 1.00 0.00 H TER 50493 WAT 5203 ATOM 50493 O WAT 5204 106.238 3.720 133.127 1.00 0.00 O ATOM 50494 H1 WAT 5204 105.957 3.852 134.033 1.00 0.00 H ATOM 50495 H2 WAT 5204 105.429 3.534 132.651 1.00 0.00 H TER 50497 WAT 5204 ATOM 50497 O WAT 5205 123.252 49.529 133.899 1.00 0.00 O ATOM 50498 H1 WAT 5205 122.696 49.969 134.541 1.00 0.00 H ATOM 50499 H2 WAT 5205 123.459 50.207 133.256 1.00 0.00 H TER 50501 WAT 5205 ATOM 50501 O WAT 5206 89.087 11.583 79.208 1.00 0.00 O ATOM 50502 H1 WAT 5206 88.650 12.352 79.573 1.00 0.00 H ATOM 50503 H2 WAT 5206 89.102 10.952 79.928 1.00 0.00 H TER 50505 WAT 5206 ATOM 50505 O WAT 5207 49.983 44.198 65.435 1.00 0.00 O ATOM 50506 H1 WAT 5207 50.864 44.032 65.770 1.00 0.00 H ATOM 50507 H2 WAT 5207 50.088 44.942 64.842 1.00 0.00 H TER 50509 WAT 5207 ATOM 50509 O WAT 5208 58.321 113.026 111.582 1.00 0.00 O ATOM 50510 H1 WAT 5208 58.662 112.170 111.326 1.00 0.00 H ATOM 50511 H2 WAT 5208 58.221 113.501 110.757 1.00 0.00 H TER 50513 WAT 5208 ATOM 50513 O WAT 5209 62.296 106.358 153.651 1.00 0.00 O ATOM 50514 H1 WAT 5209 62.469 107.252 153.356 1.00 0.00 H ATOM 50515 H2 WAT 5209 63.003 106.167 154.267 1.00 0.00 H TER 50517 WAT 5209 ATOM 50517 O WAT 5210 74.696 84.477 117.629 1.00 0.00 O ATOM 50518 H1 WAT 5210 75.058 83.591 117.603 1.00 0.00 H ATOM 50519 H2 WAT 5210 75.431 85.029 117.893 1.00 0.00 H TER 50521 WAT 5210 ATOM 50521 O WAT 5211 28.978 108.217 7.247 1.00 0.00 O ATOM 50522 H1 WAT 5211 29.701 108.610 6.757 1.00 0.00 H ATOM 50523 H2 WAT 5211 28.723 107.455 6.727 1.00 0.00 H TER 50525 WAT 5211 ATOM 50525 O WAT 5212 96.287 85.795 15.945 1.00 0.00 O ATOM 50526 H1 WAT 5212 95.341 85.868 16.076 1.00 0.00 H ATOM 50527 H2 WAT 5212 96.518 84.950 16.332 1.00 0.00 H TER 50529 WAT 5212 ATOM 50529 O WAT 5213 70.713 41.579 155.587 1.00 0.00 O ATOM 50530 H1 WAT 5213 70.567 42.415 155.145 1.00 0.00 H ATOM 50531 H2 WAT 5213 70.630 41.783 156.518 1.00 0.00 H TER 50533 WAT 5213 ATOM 50533 O WAT 5214 104.305 129.309 18.470 1.00 0.00 O ATOM 50534 H1 WAT 5214 105.031 129.087 19.053 1.00 0.00 H ATOM 50535 H2 WAT 5214 103.748 128.530 18.474 1.00 0.00 H TER 50537 WAT 5214 ATOM 50537 O WAT 5215 106.997 98.489 67.062 1.00 0.00 O ATOM 50538 H1 WAT 5215 106.587 98.475 67.926 1.00 0.00 H ATOM 50539 H2 WAT 5215 106.371 98.953 66.506 1.00 0.00 H TER 50541 WAT 5215 ATOM 50541 O WAT 5216 59.299 42.983 113.647 1.00 0.00 O ATOM 50542 H1 WAT 5216 60.249 42.866 113.641 1.00 0.00 H ATOM 50543 H2 WAT 5216 59.120 43.527 112.880 1.00 0.00 H TER 50545 WAT 5216 ATOM 50545 O WAT 5217 78.273 132.343 157.699 1.00 0.00 O ATOM 50546 H1 WAT 5217 78.646 132.533 156.838 1.00 0.00 H ATOM 50547 H2 WAT 5217 77.562 132.977 157.797 1.00 0.00 H TER 50549 WAT 5217 ATOM 50549 O WAT 5218 123.929 143.281 86.708 1.00 0.00 O ATOM 50550 H1 WAT 5218 123.765 142.376 86.445 1.00 0.00 H ATOM 50551 H2 WAT 5218 123.602 143.806 85.977 1.00 0.00 H TER 50553 WAT 5218 ATOM 50553 O WAT 5219 98.428 66.568 121.114 1.00 0.00 O ATOM 50554 H1 WAT 5219 98.218 66.988 120.279 1.00 0.00 H ATOM 50555 H2 WAT 5219 98.211 67.226 121.774 1.00 0.00 H TER 50557 WAT 5219 ATOM 50557 O WAT 5220 24.941 118.683 126.420 1.00 0.00 O ATOM 50558 H1 WAT 5220 24.524 119.535 126.547 1.00 0.00 H ATOM 50559 H2 WAT 5220 24.745 118.453 125.512 1.00 0.00 H TER 50561 WAT 5220 ATOM 50561 O WAT 5221 65.770 69.168 156.802 1.00 0.00 O ATOM 50562 H1 WAT 5221 65.444 68.896 157.660 1.00 0.00 H ATOM 50563 H2 WAT 5221 66.550 68.631 156.661 1.00 0.00 H TER 50565 WAT 5221 ATOM 50565 O WAT 5222 111.310 39.318 143.902 1.00 0.00 O ATOM 50566 H1 WAT 5222 110.804 38.832 143.251 1.00 0.00 H ATOM 50567 H2 WAT 5222 112.186 38.936 143.859 1.00 0.00 H TER 50569 WAT 5222 ATOM 50569 O WAT 5223 40.849 28.008 115.312 1.00 0.00 O ATOM 50570 H1 WAT 5223 41.250 28.875 115.256 1.00 0.00 H ATOM 50571 H2 WAT 5223 40.905 27.660 114.421 1.00 0.00 H TER 50573 WAT 5223 ATOM 50573 O WAT 5224 142.087 61.393 72.393 1.00 0.00 O ATOM 50574 H1 WAT 5224 142.258 61.223 71.467 1.00 0.00 H ATOM 50575 H2 WAT 5224 142.596 60.728 72.857 1.00 0.00 H TER 50577 WAT 5224 ATOM 50577 O WAT 5225 8.648 56.409 107.932 1.00 0.00 O ATOM 50578 H1 WAT 5225 9.371 56.690 108.493 1.00 0.00 H ATOM 50579 H2 WAT 5225 8.342 55.592 108.326 1.00 0.00 H TER 50581 WAT 5225 ATOM 50581 O WAT 5226 87.129 68.853 6.746 1.00 0.00 O ATOM 50582 H1 WAT 5226 87.874 69.336 6.388 1.00 0.00 H ATOM 50583 H2 WAT 5226 86.965 69.260 7.596 1.00 0.00 H TER 50585 WAT 5226 ATOM 50585 O WAT 5227 11.395 54.967 124.634 1.00 0.00 O ATOM 50586 H1 WAT 5227 11.416 54.011 124.668 1.00 0.00 H ATOM 50587 H2 WAT 5227 10.468 55.183 124.533 1.00 0.00 H TER 50589 WAT 5227 ATOM 50589 O WAT 5228 21.187 132.290 87.329 1.00 0.00 O ATOM 50590 H1 WAT 5228 21.383 131.651 86.643 1.00 0.00 H ATOM 50591 H2 WAT 5228 21.480 131.870 88.137 1.00 0.00 H TER 50593 WAT 5228 ATOM 50593 O WAT 5229 141.323 104.153 114.631 1.00 0.00 O ATOM 50594 H1 WAT 5229 141.318 104.666 113.823 1.00 0.00 H ATOM 50595 H2 WAT 5229 140.624 103.510 114.512 1.00 0.00 H TER 50597 WAT 5229 ATOM 50597 O WAT 5230 67.534 16.161 22.271 1.00 0.00 O ATOM 50598 H1 WAT 5230 67.962 15.948 23.100 1.00 0.00 H ATOM 50599 H2 WAT 5230 67.412 17.110 22.301 1.00 0.00 H TER 50601 WAT 5230 ATOM 50601 O WAT 5231 72.420 11.768 1.973 1.00 0.00 O ATOM 50602 H1 WAT 5231 73.367 11.774 1.838 1.00 0.00 H ATOM 50603 H2 WAT 5231 72.312 11.869 2.919 1.00 0.00 H TER 50605 WAT 5231 ATOM 50605 O WAT 5232 70.004 140.762 144.898 1.00 0.00 O ATOM 50606 H1 WAT 5232 70.159 141.227 144.076 1.00 0.00 H ATOM 50607 H2 WAT 5232 70.339 139.879 144.740 1.00 0.00 H TER 50609 WAT 5232 ATOM 50609 O WAT 5233 16.052 118.774 129.414 1.00 0.00 O ATOM 50610 H1 WAT 5233 16.030 118.088 128.747 1.00 0.00 H ATOM 50611 H2 WAT 5233 15.233 119.255 129.291 1.00 0.00 H TER 50613 WAT 5233 ATOM 50613 O WAT 5234 50.529 56.335 156.221 1.00 0.00 O ATOM 50614 H1 WAT 5234 50.370 56.289 157.163 1.00 0.00 H ATOM 50615 H2 WAT 5234 50.615 57.270 156.037 1.00 0.00 H TER 50617 WAT 5234 ATOM 50617 O WAT 5235 107.089 144.853 87.024 1.00 0.00 O ATOM 50618 H1 WAT 5235 106.850 143.974 86.730 1.00 0.00 H ATOM 50619 H2 WAT 5235 106.414 145.083 87.662 1.00 0.00 H TER 50621 WAT 5235 ATOM 50621 O WAT 5236 102.410 85.498 11.653 1.00 0.00 O ATOM 50622 H1 WAT 5236 103.043 85.510 10.935 1.00 0.00 H ATOM 50623 H2 WAT 5236 102.709 86.188 12.247 1.00 0.00 H TER 50625 WAT 5236 ATOM 50625 O WAT 5237 128.595 28.823 140.621 1.00 0.00 O ATOM 50626 H1 WAT 5237 127.658 28.966 140.488 1.00 0.00 H ATOM 50627 H2 WAT 5237 128.867 28.300 139.868 1.00 0.00 H TER 50629 WAT 5237 ATOM 50629 O WAT 5238 109.337 75.675 93.687 1.00 0.00 O ATOM 50630 H1 WAT 5238 109.817 75.702 92.859 1.00 0.00 H ATOM 50631 H2 WAT 5238 109.284 74.744 93.902 1.00 0.00 H TER 50633 WAT 5238 ATOM 50633 O WAT 5239 127.027 39.133 58.246 1.00 0.00 O ATOM 50634 H1 WAT 5239 126.938 38.204 58.031 1.00 0.00 H ATOM 50635 H2 WAT 5239 127.854 39.394 57.841 1.00 0.00 H TER 50637 WAT 5239 ATOM 50637 O WAT 5240 52.909 142.257 105.079 1.00 0.00 O ATOM 50638 H1 WAT 5240 53.415 142.218 105.891 1.00 0.00 H ATOM 50639 H2 WAT 5240 52.484 141.401 105.021 1.00 0.00 H TER 50641 WAT 5240 ATOM 50641 O WAT 5241 10.755 141.929 99.915 1.00 0.00 O ATOM 50642 H1 WAT 5241 10.885 142.587 100.598 1.00 0.00 H ATOM 50643 H2 WAT 5241 10.402 142.421 99.173 1.00 0.00 H TER 50645 WAT 5241 ATOM 50645 O WAT 5242 7.621 132.111 3.953 1.00 0.00 O ATOM 50646 H1 WAT 5242 7.506 132.004 4.898 1.00 0.00 H ATOM 50647 H2 WAT 5242 7.591 133.057 3.814 1.00 0.00 H TER 50649 WAT 5242 ATOM 50649 O WAT 5243 74.025 123.306 8.742 1.00 0.00 O ATOM 50650 H1 WAT 5243 74.270 122.381 8.770 1.00 0.00 H ATOM 50651 H2 WAT 5243 73.122 123.324 9.059 1.00 0.00 H TER 50653 WAT 5243 ATOM 50653 O WAT 5244 44.468 51.052 90.448 1.00 0.00 O ATOM 50654 H1 WAT 5244 44.621 50.948 89.509 1.00 0.00 H ATOM 50655 H2 WAT 5244 43.772 50.426 90.648 1.00 0.00 H TER 50657 WAT 5244 ATOM 50657 O WAT 5245 141.936 65.788 88.952 1.00 0.00 O ATOM 50658 H1 WAT 5245 142.565 65.796 89.673 1.00 0.00 H ATOM 50659 H2 WAT 5245 142.191 65.034 88.420 1.00 0.00 H TER 50661 WAT 5245 ATOM 50661 O WAT 5246 134.023 81.657 135.507 1.00 0.00 O ATOM 50662 H1 WAT 5246 134.889 81.306 135.712 1.00 0.00 H ATOM 50663 H2 WAT 5246 134.130 82.073 134.651 1.00 0.00 H TER 50665 WAT 5246 ATOM 50665 O WAT 5247 89.471 80.157 27.900 1.00 0.00 O ATOM 50666 H1 WAT 5247 88.636 79.708 28.033 1.00 0.00 H ATOM 50667 H2 WAT 5247 89.226 81.043 27.632 1.00 0.00 H TER 50669 WAT 5247 ATOM 50669 O WAT 5248 97.942 19.556 65.947 1.00 0.00 O ATOM 50670 H1 WAT 5248 97.615 20.412 65.671 1.00 0.00 H ATOM 50671 H2 WAT 5248 97.790 19.534 66.892 1.00 0.00 H TER 50673 WAT 5248 ATOM 50673 O WAT 5249 40.148 109.276 14.235 1.00 0.00 O ATOM 50674 H1 WAT 5249 39.221 109.108 14.069 1.00 0.00 H ATOM 50675 H2 WAT 5249 40.169 110.160 14.600 1.00 0.00 H TER 50677 WAT 5249 ATOM 50677 O WAT 5250 1.537 130.103 142.461 1.00 0.00 O ATOM 50678 H1 WAT 5250 0.781 130.314 141.913 1.00 0.00 H ATOM 50679 H2 WAT 5250 2.029 129.458 141.953 1.00 0.00 H TER 50681 WAT 5250 ATOM 50681 O WAT 5251 118.185 56.818 11.436 1.00 0.00 O ATOM 50682 H1 WAT 5251 118.085 55.886 11.631 1.00 0.00 H ATOM 50683 H2 WAT 5251 118.884 57.111 12.021 1.00 0.00 H TER 50685 WAT 5251 ATOM 50685 O WAT 5252 140.409 65.221 101.721 1.00 0.00 O ATOM 50686 H1 WAT 5252 140.116 65.753 100.981 1.00 0.00 H ATOM 50687 H2 WAT 5252 141.136 65.716 102.099 1.00 0.00 H TER 50689 WAT 5252 ATOM 50689 O WAT 5253 124.925 87.657 137.880 1.00 0.00 O ATOM 50690 H1 WAT 5253 124.847 88.452 137.352 1.00 0.00 H ATOM 50691 H2 WAT 5253 124.032 87.477 138.174 1.00 0.00 H TER 50693 WAT 5253 ATOM 50693 O WAT 5254 128.336 104.333 62.510 1.00 0.00 O ATOM 50694 H1 WAT 5254 128.604 104.118 61.616 1.00 0.00 H ATOM 50695 H2 WAT 5254 128.413 105.286 62.561 1.00 0.00 H TER 50697 WAT 5254 ATOM 50697 O WAT 5255 11.718 22.268 129.991 1.00 0.00 O ATOM 50698 H1 WAT 5255 11.938 23.199 130.017 1.00 0.00 H ATOM 50699 H2 WAT 5255 12.560 21.825 129.893 1.00 0.00 H TER 50701 WAT 5255 ATOM 50701 O WAT 5256 101.545 140.617 85.332 1.00 0.00 O ATOM 50702 H1 WAT 5256 100.789 140.820 84.781 1.00 0.00 H ATOM 50703 H2 WAT 5256 102.051 141.429 85.352 1.00 0.00 H TER 50705 WAT 5256 ATOM 50705 O WAT 5257 41.037 44.274 15.551 1.00 0.00 O ATOM 50706 H1 WAT 5257 41.498 44.774 14.878 1.00 0.00 H ATOM 50707 H2 WAT 5257 40.111 44.460 15.396 1.00 0.00 H TER 50709 WAT 5257 ATOM 50709 O WAT 5258 132.139 110.078 20.307 1.00 0.00 O ATOM 50710 H1 WAT 5258 131.428 109.973 20.940 1.00 0.00 H ATOM 50711 H2 WAT 5258 132.781 109.412 20.554 1.00 0.00 H TER 50713 WAT 5258 ATOM 50713 O WAT 5259 26.732 134.940 109.406 1.00 0.00 O ATOM 50714 H1 WAT 5259 27.457 135.347 108.932 1.00 0.00 H ATOM 50715 H2 WAT 5259 27.104 134.701 110.254 1.00 0.00 H TER 50717 WAT 5259 ATOM 50717 O WAT 5260 142.893 38.459 107.572 1.00 0.00 O ATOM 50718 H1 WAT 5260 143.264 38.002 108.327 1.00 0.00 H ATOM 50719 H2 WAT 5260 143.548 39.120 107.347 1.00 0.00 H TER 50721 WAT 5260 ATOM 50721 O WAT 5261 50.386 40.515 151.146 1.00 0.00 O ATOM 50722 H1 WAT 5261 50.499 41.236 150.527 1.00 0.00 H ATOM 50723 H2 WAT 5261 50.599 39.730 150.642 1.00 0.00 H TER 50725 WAT 5261 ATOM 50725 O WAT 5262 95.275 83.168 154.147 1.00 0.00 O ATOM 50726 H1 WAT 5262 94.429 82.724 154.211 1.00 0.00 H ATOM 50727 H2 WAT 5262 95.807 82.768 154.835 1.00 0.00 H TER 50729 WAT 5262 ATOM 50729 O WAT 5263 64.287 106.759 136.675 1.00 0.00 O ATOM 50730 H1 WAT 5263 63.760 107.543 136.521 1.00 0.00 H ATOM 50731 H2 WAT 5263 65.190 107.046 136.536 1.00 0.00 H TER 50733 WAT 5263 ATOM 50733 O WAT 5264 20.843 15.858 101.818 1.00 0.00 O ATOM 50734 H1 WAT 5264 19.983 15.628 102.168 1.00 0.00 H ATOM 50735 H2 WAT 5264 21.018 15.192 101.153 1.00 0.00 H TER 50737 WAT 5264 ATOM 50737 O WAT 5265 90.316 94.186 26.060 1.00 0.00 O ATOM 50738 H1 WAT 5265 89.840 93.390 26.298 1.00 0.00 H ATOM 50739 H2 WAT 5265 91.008 93.884 25.472 1.00 0.00 H TER 50741 WAT 5265 ATOM 50741 O WAT 5266 104.840 142.960 153.013 1.00 0.00 O ATOM 50742 H1 WAT 5266 104.198 142.965 153.723 1.00 0.00 H ATOM 50743 H2 WAT 5266 104.390 143.380 152.280 1.00 0.00 H TER 50745 WAT 5266 ATOM 50745 O WAT 5267 118.985 57.324 5.442 1.00 0.00 O ATOM 50746 H1 WAT 5267 119.401 57.891 6.092 1.00 0.00 H ATOM 50747 H2 WAT 5267 118.873 56.486 5.892 1.00 0.00 H TER 50749 WAT 5267 ATOM 50749 O WAT 5268 8.649 140.533 135.478 1.00 0.00 O ATOM 50750 H1 WAT 5268 8.990 139.934 134.814 1.00 0.00 H ATOM 50751 H2 WAT 5268 7.736 140.675 135.226 1.00 0.00 H TER 50753 WAT 5268 ATOM 50753 O WAT 5269 84.110 79.511 97.190 1.00 0.00 O ATOM 50754 H1 WAT 5269 83.861 80.362 97.551 1.00 0.00 H ATOM 50755 H2 WAT 5269 85.057 79.573 97.064 1.00 0.00 H TER 50757 WAT 5269 ATOM 50757 O WAT 5270 108.158 21.858 99.278 1.00 0.00 O ATOM 50758 H1 WAT 5270 109.006 21.957 99.711 1.00 0.00 H ATOM 50759 H2 WAT 5270 108.321 21.233 98.572 1.00 0.00 H TER 50761 WAT 5270 ATOM 50761 O WAT 5271 7.765 26.156 103.858 1.00 0.00 O ATOM 50762 H1 WAT 5271 7.816 26.338 102.920 1.00 0.00 H ATOM 50763 H2 WAT 5271 7.042 25.534 103.944 1.00 0.00 H TER 50765 WAT 5271 ATOM 50765 O WAT 5272 113.368 67.045 72.085 1.00 0.00 O ATOM 50766 H1 WAT 5272 112.833 66.793 72.838 1.00 0.00 H ATOM 50767 H2 WAT 5272 114.167 67.405 72.469 1.00 0.00 H TER 50769 WAT 5272 ATOM 50769 O WAT 5273 121.363 14.320 154.406 1.00 0.00 O ATOM 50770 H1 WAT 5273 121.326 14.129 153.469 1.00 0.00 H ATOM 50771 H2 WAT 5273 122.240 14.044 154.672 1.00 0.00 H TER 50773 WAT 5273 ATOM 50773 O WAT 5274 128.051 143.389 144.562 1.00 0.00 O ATOM 50774 H1 WAT 5274 127.430 142.926 145.124 1.00 0.00 H ATOM 50775 H2 WAT 5274 127.699 143.283 143.678 1.00 0.00 H TER 50777 WAT 5274 ATOM 50777 O WAT 5275 101.495 63.032 145.112 1.00 0.00 O ATOM 50778 H1 WAT 5275 100.666 62.707 144.759 1.00 0.00 H ATOM 50779 H2 WAT 5275 101.963 63.371 144.348 1.00 0.00 H TER 50781 WAT 5275 ATOM 50781 O WAT 5276 54.539 69.402 88.631 1.00 0.00 O ATOM 50782 H1 WAT 5276 54.798 68.521 88.361 1.00 0.00 H ATOM 50783 H2 WAT 5276 54.649 69.403 89.582 1.00 0.00 H TER 50785 WAT 5276 ATOM 50785 O WAT 5277 13.074 32.457 12.314 1.00 0.00 O ATOM 50786 H1 WAT 5277 12.554 31.681 12.526 1.00 0.00 H ATOM 50787 H2 WAT 5277 13.980 32.149 12.327 1.00 0.00 H TER 50789 WAT 5277 ATOM 50789 O WAT 5278 6.306 34.288 119.051 1.00 0.00 O ATOM 50790 H1 WAT 5278 5.472 34.756 119.092 1.00 0.00 H ATOM 50791 H2 WAT 5278 6.188 33.648 118.349 1.00 0.00 H TER 50793 WAT 5278 ATOM 50793 O WAT 5279 90.049 76.751 4.667 1.00 0.00 O ATOM 50794 H1 WAT 5279 90.192 77.691 4.779 1.00 0.00 H ATOM 50795 H2 WAT 5279 90.554 76.346 5.372 1.00 0.00 H TER 50797 WAT 5279 ATOM 50797 O WAT 5280 34.704 94.175 26.360 1.00 0.00 O ATOM 50798 H1 WAT 5280 35.512 93.676 26.237 1.00 0.00 H ATOM 50799 H2 WAT 5280 34.154 93.926 25.618 1.00 0.00 H TER 50801 WAT 5280 ATOM 50801 O WAT 5281 124.731 120.634 5.773 1.00 0.00 O ATOM 50802 H1 WAT 5281 124.098 120.063 5.339 1.00 0.00 H ATOM 50803 H2 WAT 5281 124.379 120.754 6.655 1.00 0.00 H TER 50805 WAT 5281 ATOM 50805 O WAT 5282 4.930 46.203 133.028 1.00 0.00 O ATOM 50806 H1 WAT 5282 4.206 45.716 133.421 1.00 0.00 H ATOM 50807 H2 WAT 5282 5.553 46.327 133.744 1.00 0.00 H TER 50809 WAT 5282 ATOM 50809 O WAT 5283 49.488 22.381 65.899 1.00 0.00 O ATOM 50810 H1 WAT 5283 49.106 21.972 65.123 1.00 0.00 H ATOM 50811 H2 WAT 5283 49.953 23.147 65.562 1.00 0.00 H TER 50813 WAT 5283 ATOM 50813 O WAT 5284 67.754 70.116 72.523 1.00 0.00 O ATOM 50814 H1 WAT 5284 68.470 70.752 72.506 1.00 0.00 H ATOM 50815 H2 WAT 5284 67.725 69.765 71.633 1.00 0.00 H TER 50817 WAT 5284 ATOM 50817 O WAT 5285 120.952 61.890 15.929 1.00 0.00 O ATOM 50818 H1 WAT 5285 120.218 61.516 15.442 1.00 0.00 H ATOM 50819 H2 WAT 5285 121.653 61.243 15.841 1.00 0.00 H TER 50821 WAT 5285 ATOM 50821 O WAT 5286 92.858 108.757 12.913 1.00 0.00 O ATOM 50822 H1 WAT 5286 91.945 109.035 12.845 1.00 0.00 H ATOM 50823 H2 WAT 5286 93.134 108.616 12.008 1.00 0.00 H TER 50825 WAT 5286 ATOM 50825 O WAT 5287 94.106 111.578 121.485 1.00 0.00 O ATOM 50826 H1 WAT 5287 94.727 112.267 121.249 1.00 0.00 H ATOM 50827 H2 WAT 5287 94.094 111.583 122.442 1.00 0.00 H TER 50829 WAT 5287 ATOM 50829 O WAT 5288 28.756 98.060 120.845 1.00 0.00 O ATOM 50830 H1 WAT 5288 29.606 97.886 121.248 1.00 0.00 H ATOM 50831 H2 WAT 5288 28.968 98.377 119.967 1.00 0.00 H TER 50833 WAT 5288 ATOM 50833 O WAT 5289 83.125 3.239 1.892 1.00 0.00 O ATOM 50834 H1 WAT 5289 82.291 3.645 2.127 1.00 0.00 H ATOM 50835 H2 WAT 5289 82.995 2.926 0.996 1.00 0.00 H TER 50837 WAT 5289 ATOM 50837 O WAT 5290 61.708 66.843 145.960 1.00 0.00 O ATOM 50838 H1 WAT 5290 61.881 65.901 145.983 1.00 0.00 H ATOM 50839 H2 WAT 5290 61.601 67.089 146.878 1.00 0.00 H TER 50841 WAT 5290 ATOM 50841 O WAT 5291 66.467 31.053 149.712 1.00 0.00 O ATOM 50842 H1 WAT 5291 66.209 31.816 149.195 1.00 0.00 H ATOM 50843 H2 WAT 5291 67.032 30.548 149.128 1.00 0.00 H TER 50845 WAT 5291 ATOM 50845 O WAT 5292 56.126 73.619 116.830 1.00 0.00 O ATOM 50846 H1 WAT 5292 56.943 73.138 116.957 1.00 0.00 H ATOM 50847 H2 WAT 5292 55.725 73.645 117.699 1.00 0.00 H TER 50849 WAT 5292 ATOM 50849 O WAT 5293 130.781 139.287 6.077 1.00 0.00 O ATOM 50850 H1 WAT 5293 130.533 139.790 6.852 1.00 0.00 H ATOM 50851 H2 WAT 5293 129.958 139.150 5.607 1.00 0.00 H TER 50853 WAT 5293 ATOM 50853 O WAT 5294 46.898 118.289 83.748 1.00 0.00 O ATOM 50854 H1 WAT 5294 46.435 117.613 84.244 1.00 0.00 H ATOM 50855 H2 WAT 5294 46.484 119.109 84.017 1.00 0.00 H TER 50857 WAT 5294 ATOM 50857 O WAT 5295 5.478 145.997 85.512 1.00 0.00 O ATOM 50858 H1 WAT 5295 5.568 145.132 85.112 1.00 0.00 H ATOM 50859 H2 WAT 5295 6.367 146.234 85.774 1.00 0.00 H TER 50861 WAT 5295 ATOM 50861 O WAT 5296 2.463 80.651 68.364 1.00 0.00 O ATOM 50862 H1 WAT 5296 2.770 81.426 67.893 1.00 0.00 H ATOM 50863 H2 WAT 5296 1.594 80.892 68.682 1.00 0.00 H TER 50865 WAT 5296 ATOM 50865 O WAT 5297 66.618 89.466 89.837 1.00 0.00 O ATOM 50866 H1 WAT 5297 66.827 90.110 90.514 1.00 0.00 H ATOM 50867 H2 WAT 5297 67.412 88.938 89.756 1.00 0.00 H TER 50869 WAT 5297 ATOM 50869 O WAT 5298 138.246 70.658 4.887 1.00 0.00 O ATOM 50870 H1 WAT 5298 139.117 70.272 4.977 1.00 0.00 H ATOM 50871 H2 WAT 5298 137.738 69.997 4.417 1.00 0.00 H TER 50873 WAT 5298 ATOM 50873 O WAT 5299 106.350 115.625 11.975 1.00 0.00 O ATOM 50874 H1 WAT 5299 107.259 115.326 11.953 1.00 0.00 H ATOM 50875 H2 WAT 5299 106.292 116.157 12.769 1.00 0.00 H TER 50877 WAT 5299 ATOM 50877 O WAT 5300 37.247 45.198 144.269 1.00 0.00 O ATOM 50878 H1 WAT 5300 37.152 45.725 145.063 1.00 0.00 H ATOM 50879 H2 WAT 5300 37.275 44.295 144.583 1.00 0.00 H TER 50881 WAT 5300 ATOM 50881 O WAT 5301 136.434 122.857 145.028 1.00 0.00 O ATOM 50882 H1 WAT 5301 137.266 122.892 144.555 1.00 0.00 H ATOM 50883 H2 WAT 5301 136.685 122.766 145.948 1.00 0.00 H TER 50885 WAT 5301 ATOM 50885 O WAT 5302 136.315 51.839 61.051 1.00 0.00 O ATOM 50886 H1 WAT 5302 136.734 51.059 60.687 1.00 0.00 H ATOM 50887 H2 WAT 5302 137.040 52.369 61.382 1.00 0.00 H TER 50889 WAT 5302 ATOM 50889 O WAT 5303 46.408 38.131 12.409 1.00 0.00 O ATOM 50890 H1 WAT 5303 45.999 38.620 13.122 1.00 0.00 H ATOM 50891 H2 WAT 5303 45.925 37.305 12.377 1.00 0.00 H TER 50893 WAT 5303 ATOM 50893 O WAT 5304 56.993 50.481 82.096 1.00 0.00 O ATOM 50894 H1 WAT 5304 57.473 50.625 82.912 1.00 0.00 H ATOM 50895 H2 WAT 5304 56.086 50.700 82.311 1.00 0.00 H TER 50897 WAT 5304 ATOM 50897 O WAT 5305 91.178 10.150 132.550 1.00 0.00 O ATOM 50898 H1 WAT 5305 90.784 10.388 133.390 1.00 0.00 H ATOM 50899 H2 WAT 5305 90.571 9.513 132.174 1.00 0.00 H TER 50901 WAT 5305 ATOM 50901 O WAT 5306 78.377 138.605 156.393 1.00 0.00 O ATOM 50902 H1 WAT 5306 78.927 137.848 156.192 1.00 0.00 H ATOM 50903 H2 WAT 5306 78.994 139.283 156.667 1.00 0.00 H TER 50905 WAT 5306 ATOM 50905 O WAT 5307 55.127 49.377 20.877 1.00 0.00 O ATOM 50906 H1 WAT 5307 54.856 49.939 21.603 1.00 0.00 H ATOM 50907 H2 WAT 5307 54.461 49.520 20.203 1.00 0.00 H TER 50909 WAT 5307 ATOM 50909 O WAT 5308 134.204 96.025 70.335 1.00 0.00 O ATOM 50910 H1 WAT 5308 134.113 95.235 70.868 1.00 0.00 H ATOM 50911 H2 WAT 5308 133.800 96.716 70.859 1.00 0.00 H TER 50913 WAT 5308 ATOM 50913 O WAT 5309 63.390 49.220 68.679 1.00 0.00 O ATOM 50914 H1 WAT 5309 63.190 48.779 69.505 1.00 0.00 H ATOM 50915 H2 WAT 5309 62.685 48.954 68.089 1.00 0.00 H TER 50917 WAT 5309 ATOM 50917 O WAT 5310 35.716 130.995 91.436 1.00 0.00 O ATOM 50918 H1 WAT 5310 36.522 130.730 91.878 1.00 0.00 H ATOM 50919 H2 WAT 5310 35.988 131.693 90.839 1.00 0.00 H TER 50921 WAT 5310 ATOM 50921 O WAT 5311 81.825 123.290 141.171 1.00 0.00 O ATOM 50922 H1 WAT 5311 82.408 123.761 141.766 1.00 0.00 H ATOM 50923 H2 WAT 5311 82.268 122.457 141.010 1.00 0.00 H TER 50925 WAT 5311 ATOM 50925 O WAT 5312 101.289 130.840 137.007 1.00 0.00 O ATOM 50926 H1 WAT 5312 100.359 130.869 136.782 1.00 0.00 H ATOM 50927 H2 WAT 5312 101.715 130.501 136.220 1.00 0.00 H TER 50929 WAT 5312 ATOM 50929 O WAT 5313 86.888 118.137 145.151 1.00 0.00 O ATOM 50930 H1 WAT 5313 86.124 118.475 145.619 1.00 0.00 H ATOM 50931 H2 WAT 5313 87.631 118.365 145.708 1.00 0.00 H TER 50933 WAT 5313 ATOM 50933 O WAT 5314 12.921 73.764 150.926 1.00 0.00 O ATOM 50934 H1 WAT 5314 12.108 73.364 151.232 1.00 0.00 H ATOM 50935 H2 WAT 5314 12.780 74.705 151.033 1.00 0.00 H TER 50937 WAT 5314 ATOM 50937 O WAT 5315 123.042 6.269 9.842 1.00 0.00 O ATOM 50938 H1 WAT 5315 122.695 5.911 9.025 1.00 0.00 H ATOM 50939 H2 WAT 5315 123.884 5.828 9.958 1.00 0.00 H TER 50941 WAT 5315 ATOM 50941 O WAT 5316 114.611 28.810 91.602 1.00 0.00 O ATOM 50942 H1 WAT 5316 114.800 28.550 92.504 1.00 0.00 H ATOM 50943 H2 WAT 5316 114.234 29.686 91.680 1.00 0.00 H TER 50945 WAT 5316 ATOM 50945 O WAT 5317 79.099 98.095 59.110 1.00 0.00 O ATOM 50946 H1 WAT 5317 79.014 97.276 59.597 1.00 0.00 H ATOM 50947 H2 WAT 5317 78.601 97.948 58.305 1.00 0.00 H TER 50949 WAT 5317 ATOM 50949 O WAT 5318 0.541 3.494 94.149 1.00 0.00 O ATOM 50950 H1 WAT 5318 -0.122 3.633 93.473 1.00 0.00 H ATOM 50951 H2 WAT 5318 1.226 4.131 93.948 1.00 0.00 H TER 50953 WAT 5318 ATOM 50953 O WAT 5319 46.077 9.076 13.729 1.00 0.00 O ATOM 50954 H1 WAT 5319 45.712 8.301 13.303 1.00 0.00 H ATOM 50955 H2 WAT 5319 46.081 9.746 13.045 1.00 0.00 H TER 50957 WAT 5319 ATOM 50957 O WAT 5320 124.187 140.619 27.468 1.00 0.00 O ATOM 50958 H1 WAT 5320 125.118 140.617 27.692 1.00 0.00 H ATOM 50959 H2 WAT 5320 124.059 141.436 26.985 1.00 0.00 H TER 50961 WAT 5320 ATOM 50961 O WAT 5321 5.215 76.544 86.387 1.00 0.00 O ATOM 50962 H1 WAT 5321 5.431 76.440 85.461 1.00 0.00 H ATOM 50963 H2 WAT 5321 4.444 75.992 86.517 1.00 0.00 H TER 50965 WAT 5321 ATOM 50965 O WAT 5322 11.218 72.721 144.001 1.00 0.00 O ATOM 50966 H1 WAT 5322 10.620 72.727 143.254 1.00 0.00 H ATOM 50967 H2 WAT 5322 11.850 73.413 143.806 1.00 0.00 H TER 50969 WAT 5322 ATOM 50969 O WAT 5323 40.289 121.812 142.360 1.00 0.00 O ATOM 50970 H1 WAT 5323 40.409 122.622 142.856 1.00 0.00 H ATOM 50971 H2 WAT 5323 39.339 121.714 142.288 1.00 0.00 H TER 50973 WAT 5323 ATOM 50973 O WAT 5324 107.861 82.133 97.665 1.00 0.00 O ATOM 50974 H1 WAT 5324 107.196 82.565 97.129 1.00 0.00 H ATOM 50975 H2 WAT 5324 108.259 81.489 97.079 1.00 0.00 H TER 50977 WAT 5324 ATOM 50977 O WAT 5325 14.551 68.584 97.098 1.00 0.00 O ATOM 50978 H1 WAT 5325 14.679 68.301 98.003 1.00 0.00 H ATOM 50979 H2 WAT 5325 13.649 68.905 97.073 1.00 0.00 H TER 50981 WAT 5325 ATOM 50981 O WAT 5326 66.532 17.684 71.039 1.00 0.00 O ATOM 50982 H1 WAT 5326 66.099 18.489 70.756 1.00 0.00 H ATOM 50983 H2 WAT 5326 66.841 17.280 70.228 1.00 0.00 H TER 50985 WAT 5326 ATOM 50985 O WAT 5327 87.161 110.162 78.870 1.00 0.00 O ATOM 50986 H1 WAT 5327 86.285 110.165 78.484 1.00 0.00 H ATOM 50987 H2 WAT 5327 87.233 109.307 79.295 1.00 0.00 H TER 50989 WAT 5327 ATOM 50989 O WAT 5328 32.531 57.905 86.052 1.00 0.00 O ATOM 50990 H1 WAT 5328 33.082 57.341 86.595 1.00 0.00 H ATOM 50991 H2 WAT 5328 32.345 57.380 85.273 1.00 0.00 H TER 50993 WAT 5328 ATOM 50993 O WAT 5329 77.853 137.466 11.467 1.00 0.00 O ATOM 50994 H1 WAT 5329 77.208 136.931 11.004 1.00 0.00 H ATOM 50995 H2 WAT 5329 77.791 138.327 11.054 1.00 0.00 H TER 50997 WAT 5329 ATOM 50997 O WAT 5330 14.064 38.964 95.245 1.00 0.00 O ATOM 50998 H1 WAT 5330 14.131 39.838 95.629 1.00 0.00 H ATOM 50999 H2 WAT 5330 13.128 38.765 95.266 1.00 0.00 H TER 51001 WAT 5330 ATOM 51001 O WAT 5331 53.522 34.174 12.685 1.00 0.00 O ATOM 51002 H1 WAT 5331 52.675 34.459 13.027 1.00 0.00 H ATOM 51003 H2 WAT 5331 54.136 34.852 12.969 1.00 0.00 H TER 51005 WAT 5331 ATOM 51005 O WAT 5332 73.354 59.727 117.722 1.00 0.00 O ATOM 51006 H1 WAT 5332 73.191 60.160 116.885 1.00 0.00 H ATOM 51007 H2 WAT 5332 72.482 59.544 118.072 1.00 0.00 H TER 51009 WAT 5332 ATOM 51009 O WAT 5333 136.534 88.534 16.815 1.00 0.00 O ATOM 51010 H1 WAT 5333 136.591 88.194 17.708 1.00 0.00 H ATOM 51011 H2 WAT 5333 137.442 88.716 16.570 1.00 0.00 H TER 51013 WAT 5333 ATOM 51013 O WAT 5334 109.189 49.226 79.875 1.00 0.00 O ATOM 51014 H1 WAT 5334 108.826 49.622 79.083 1.00 0.00 H ATOM 51015 H2 WAT 5334 110.020 48.843 79.592 1.00 0.00 H TER 51017 WAT 5334 ATOM 51017 O WAT 5335 26.833 91.711 68.491 1.00 0.00 O ATOM 51018 H1 WAT 5335 27.112 90.986 67.931 1.00 0.00 H ATOM 51019 H2 WAT 5335 27.470 92.405 68.319 1.00 0.00 H TER 51021 WAT 5335 ATOM 51021 O WAT 5336 77.628 112.100 103.562 1.00 0.00 O ATOM 51022 H1 WAT 5336 77.884 112.642 104.309 1.00 0.00 H ATOM 51023 H2 WAT 5336 76.706 111.895 103.720 1.00 0.00 H TER 51025 WAT 5336 ATOM 51025 O WAT 5337 65.236 80.887 7.468 1.00 0.00 O ATOM 51026 H1 WAT 5337 65.842 80.301 7.015 1.00 0.00 H ATOM 51027 H2 WAT 5337 65.727 81.200 8.227 1.00 0.00 H TER 51029 WAT 5337 ATOM 51029 O WAT 5338 67.181 46.526 125.418 1.00 0.00 O ATOM 51030 H1 WAT 5338 67.754 45.762 125.356 1.00 0.00 H ATOM 51031 H2 WAT 5338 66.501 46.369 124.762 1.00 0.00 H TER 51033 WAT 5338 ATOM 51033 O WAT 5339 74.403 56.189 103.205 1.00 0.00 O ATOM 51034 H1 WAT 5339 75.337 56.348 103.069 1.00 0.00 H ATOM 51035 H2 WAT 5339 74.017 56.270 102.333 1.00 0.00 H TER 51037 WAT 5339 ATOM 51037 O WAT 5340 56.717 63.217 68.043 1.00 0.00 O ATOM 51038 H1 WAT 5340 56.732 62.818 68.913 1.00 0.00 H ATOM 51039 H2 WAT 5340 56.866 62.486 67.442 1.00 0.00 H TER 51041 WAT 5340 ATOM 51041 O WAT 5341 50.861 40.960 134.294 1.00 0.00 O ATOM 51042 H1 WAT 5341 50.906 40.800 133.352 1.00 0.00 H ATOM 51043 H2 WAT 5341 51.215 40.164 134.690 1.00 0.00 H TER 51045 WAT 5341 ATOM 51045 O WAT 5342 29.754 76.906 143.327 1.00 0.00 O ATOM 51046 H1 WAT 5342 29.032 77.112 142.733 1.00 0.00 H ATOM 51047 H2 WAT 5342 30.255 76.230 142.871 1.00 0.00 H TER 51049 WAT 5342 ATOM 51049 O WAT 5343 26.328 119.656 96.489 1.00 0.00 O ATOM 51050 H1 WAT 5343 26.074 118.881 95.989 1.00 0.00 H ATOM 51051 H2 WAT 5343 25.733 119.664 97.238 1.00 0.00 H TER 51053 WAT 5343 ATOM 51053 O WAT 5344 90.029 56.930 147.198 1.00 0.00 O ATOM 51054 H1 WAT 5344 90.323 56.076 146.881 1.00 0.00 H ATOM 51055 H2 WAT 5344 90.280 57.542 146.506 1.00 0.00 H TER 51057 WAT 5344 ATOM 51057 O WAT 5345 116.794 86.168 71.794 1.00 0.00 O ATOM 51058 H1 WAT 5345 116.523 85.673 71.021 1.00 0.00 H ATOM 51059 H2 WAT 5345 116.104 86.821 71.914 1.00 0.00 H TER 51061 WAT 5345 ATOM 51061 O WAT 5346 69.001 93.967 113.971 1.00 0.00 O ATOM 51062 H1 WAT 5346 68.220 94.336 114.383 1.00 0.00 H ATOM 51063 H2 WAT 5346 68.856 93.021 113.987 1.00 0.00 H TER 51065 WAT 5346 ATOM 51065 O WAT 5347 43.342 138.618 67.217 1.00 0.00 O ATOM 51066 H1 WAT 5347 43.376 137.821 66.688 1.00 0.00 H ATOM 51067 H2 WAT 5347 42.415 138.859 67.227 1.00 0.00 H TER 51069 WAT 5347 ATOM 51069 O WAT 5348 139.187 98.809 7.797 1.00 0.00 O ATOM 51070 H1 WAT 5348 138.260 99.037 7.725 1.00 0.00 H ATOM 51071 H2 WAT 5348 139.240 98.270 8.586 1.00 0.00 H TER 51073 WAT 5348 ATOM 51073 O WAT 5349 30.224 138.163 73.966 1.00 0.00 O ATOM 51074 H1 WAT 5349 30.050 138.650 73.161 1.00 0.00 H ATOM 51075 H2 WAT 5349 30.212 137.244 73.698 1.00 0.00 H TER 51077 WAT 5349 ATOM 51077 O WAT 5350 31.025 134.281 62.521 1.00 0.00 O ATOM 51078 H1 WAT 5350 31.004 134.134 63.467 1.00 0.00 H ATOM 51079 H2 WAT 5350 31.687 133.669 62.198 1.00 0.00 H TER 51081 WAT 5350 ATOM 51081 O WAT 5351 82.483 95.030 113.219 1.00 0.00 O ATOM 51082 H1 WAT 5351 82.150 94.309 113.753 1.00 0.00 H ATOM 51083 H2 WAT 5351 81.912 95.044 112.451 1.00 0.00 H TER 51085 WAT 5351 ATOM 51085 O WAT 5352 77.469 95.010 131.323 1.00 0.00 O ATOM 51086 H1 WAT 5352 77.428 94.843 132.265 1.00 0.00 H ATOM 51087 H2 WAT 5352 77.156 95.910 131.226 1.00 0.00 H TER 51089 WAT 5352 ATOM 51089 O WAT 5353 115.959 125.387 87.322 1.00 0.00 O ATOM 51090 H1 WAT 5353 115.013 125.525 87.275 1.00 0.00 H ATOM 51091 H2 WAT 5353 116.067 124.440 87.241 1.00 0.00 H TER 51093 WAT 5353 ATOM 51093 O WAT 5354 141.032 27.593 76.507 1.00 0.00 O ATOM 51094 H1 WAT 5354 140.231 27.313 76.064 1.00 0.00 H ATOM 51095 H2 WAT 5354 140.995 28.549 76.487 1.00 0.00 H TER 51097 WAT 5354 ATOM 51097 O WAT 5355 135.765 140.701 14.788 1.00 0.00 O ATOM 51098 H1 WAT 5355 134.918 140.968 14.431 1.00 0.00 H ATOM 51099 H2 WAT 5355 135.550 140.051 15.456 1.00 0.00 H TER 51101 WAT 5355 ATOM 51101 O WAT 5356 124.630 116.607 114.403 1.00 0.00 O ATOM 51102 H1 WAT 5356 125.328 117.242 114.562 1.00 0.00 H ATOM 51103 H2 WAT 5356 124.613 116.502 113.452 1.00 0.00 H TER 51105 WAT 5356 ATOM 51105 O WAT 5357 53.113 39.235 120.976 1.00 0.00 O ATOM 51106 H1 WAT 5357 54.015 39.281 120.659 1.00 0.00 H ATOM 51107 H2 WAT 5357 52.788 38.395 120.650 1.00 0.00 H TER 51109 WAT 5357 ATOM 51109 O WAT 5358 137.178 77.961 69.697 1.00 0.00 O ATOM 51110 H1 WAT 5358 136.679 78.749 69.480 1.00 0.00 H ATOM 51111 H2 WAT 5358 136.717 77.584 70.446 1.00 0.00 H TER 51113 WAT 5358 ATOM 51113 O WAT 5359 96.041 34.385 147.120 1.00 0.00 O ATOM 51114 H1 WAT 5359 96.391 34.573 147.991 1.00 0.00 H ATOM 51115 H2 WAT 5359 96.712 33.843 146.704 1.00 0.00 H TER 51117 WAT 5359 ATOM 51117 O WAT 5360 107.792 20.910 15.391 1.00 0.00 O ATOM 51118 H1 WAT 5360 107.948 20.718 16.315 1.00 0.00 H ATOM 51119 H2 WAT 5360 108.505 20.468 14.930 1.00 0.00 H TER 51121 WAT 5360 ATOM 51121 O WAT 5361 58.377 21.083 146.940 1.00 0.00 O ATOM 51122 H1 WAT 5361 58.678 20.751 146.093 1.00 0.00 H ATOM 51123 H2 WAT 5361 57.434 21.203 146.828 1.00 0.00 H TER 51125 WAT 5361 ATOM 51125 O WAT 5362 131.702 108.614 120.118 1.00 0.00 O ATOM 51126 H1 WAT 5362 132.229 108.372 119.357 1.00 0.00 H ATOM 51127 H2 WAT 5362 132.304 108.547 120.858 1.00 0.00 H TER 51129 WAT 5362 ATOM 51129 O WAT 5363 57.990 3.100 142.175 1.00 0.00 O ATOM 51130 H1 WAT 5363 58.224 2.406 141.559 1.00 0.00 H ATOM 51131 H2 WAT 5363 57.041 3.022 142.274 1.00 0.00 H TER 51133 WAT 5363 ATOM 51133 O WAT 5364 110.565 83.086 115.804 1.00 0.00 O ATOM 51134 H1 WAT 5364 109.945 83.639 115.329 1.00 0.00 H ATOM 51135 H2 WAT 5364 110.467 82.221 115.406 1.00 0.00 H TER 51137 WAT 5364 ATOM 51137 O WAT 5365 33.299 37.317 100.834 1.00 0.00 O ATOM 51138 H1 WAT 5365 33.507 38.060 101.400 1.00 0.00 H ATOM 51139 H2 WAT 5365 33.953 36.655 101.057 1.00 0.00 H TER 51141 WAT 5365 ATOM 51141 O WAT 5366 19.081 38.668 111.880 1.00 0.00 O ATOM 51142 H1 WAT 5366 19.522 39.507 112.015 1.00 0.00 H ATOM 51143 H2 WAT 5366 19.600 38.231 111.205 1.00 0.00 H TER 51145 WAT 5366 ATOM 51145 O WAT 5367 44.711 102.896 90.781 1.00 0.00 O ATOM 51146 H1 WAT 5367 45.373 103.195 90.158 1.00 0.00 H ATOM 51147 H2 WAT 5367 44.275 103.697 91.071 1.00 0.00 H TER 51149 WAT 5367 ATOM 51149 O WAT 5368 81.368 38.804 108.367 1.00 0.00 O ATOM 51150 H1 WAT 5368 80.608 38.243 108.521 1.00 0.00 H ATOM 51151 H2 WAT 5368 81.751 38.932 109.235 1.00 0.00 H TER 51153 WAT 5368 ATOM 51153 O WAT 5369 71.291 8.338 1.586 1.00 0.00 O ATOM 51154 H1 WAT 5369 71.412 7.405 1.764 1.00 0.00 H ATOM 51155 H2 WAT 5369 72.180 8.685 1.515 1.00 0.00 H TER 51157 WAT 5369 ATOM 51157 O WAT 5370 21.393 75.038 63.519 1.00 0.00 O ATOM 51158 H1 WAT 5370 21.490 75.387 62.633 1.00 0.00 H ATOM 51159 H2 WAT 5370 22.243 75.194 63.932 1.00 0.00 H TER 51161 WAT 5370 ATOM 51161 O WAT 5371 5.517 46.751 128.300 1.00 0.00 O ATOM 51162 H1 WAT 5371 6.047 46.408 127.580 1.00 0.00 H ATOM 51163 H2 WAT 5371 5.096 45.978 128.677 1.00 0.00 H TER 51165 WAT 5371 ATOM 51165 O WAT 5372 9.419 110.929 120.266 1.00 0.00 O ATOM 51166 H1 WAT 5372 10.108 110.485 120.762 1.00 0.00 H ATOM 51167 H2 WAT 5372 9.390 111.812 120.636 1.00 0.00 H TER 51169 WAT 5372 ATOM 51169 O WAT 5373 98.776 127.719 62.062 1.00 0.00 O ATOM 51170 H1 WAT 5373 97.935 127.947 61.665 1.00 0.00 H ATOM 51171 H2 WAT 5373 99.428 127.991 61.415 1.00 0.00 H TER 51173 WAT 5373 ATOM 51173 O WAT 5374 52.378 10.814 80.113 1.00 0.00 O ATOM 51174 H1 WAT 5374 51.879 10.395 79.412 1.00 0.00 H ATOM 51175 H2 WAT 5374 51.726 11.311 80.607 1.00 0.00 H TER 51177 WAT 5374 ATOM 51177 O WAT 5375 60.204 120.741 127.218 1.00 0.00 O ATOM 51178 H1 WAT 5375 59.537 120.267 127.715 1.00 0.00 H ATOM 51179 H2 WAT 5375 59.743 121.058 126.441 1.00 0.00 H TER 51181 WAT 5375 ATOM 51181 O WAT 5376 105.034 129.902 118.720 1.00 0.00 O ATOM 51182 H1 WAT 5376 104.834 129.647 119.621 1.00 0.00 H ATOM 51183 H2 WAT 5376 105.211 130.841 118.771 1.00 0.00 H TER 51185 WAT 5376 ATOM 51185 O WAT 5377 2.584 20.629 2.485 1.00 0.00 O ATOM 51186 H1 WAT 5377 3.357 20.342 2.971 1.00 0.00 H ATOM 51187 H2 WAT 5377 2.927 20.927 1.643 1.00 0.00 H TER 51189 WAT 5377 ATOM 51189 O WAT 5378 30.548 63.285 88.786 1.00 0.00 O ATOM 51190 H1 WAT 5378 30.658 63.270 87.835 1.00 0.00 H ATOM 51191 H2 WAT 5378 30.036 64.075 88.956 1.00 0.00 H TER 51193 WAT 5378 ATOM 51193 O WAT 5379 31.371 133.472 23.441 1.00 0.00 O ATOM 51194 H1 WAT 5379 31.115 134.123 22.788 1.00 0.00 H ATOM 51195 H2 WAT 5379 30.590 133.356 23.982 1.00 0.00 H TER 51197 WAT 5379 ATOM 51197 O WAT 5380 28.426 111.131 144.206 1.00 0.00 O ATOM 51198 H1 WAT 5380 27.800 110.548 143.777 1.00 0.00 H ATOM 51199 H2 WAT 5380 28.023 111.337 145.049 1.00 0.00 H TER 51201 WAT 5380 ATOM 51201 O WAT 5381 112.171 98.279 3.890 1.00 0.00 O ATOM 51202 H1 WAT 5381 112.939 98.096 3.348 1.00 0.00 H ATOM 51203 H2 WAT 5381 112.019 99.217 3.780 1.00 0.00 H TER 51205 WAT 5381 ATOM 51205 O WAT 5382 134.754 126.424 135.112 1.00 0.00 O ATOM 51206 H1 WAT 5382 135.694 126.518 135.265 1.00 0.00 H ATOM 51207 H2 WAT 5382 134.608 125.478 135.093 1.00 0.00 H TER 51209 WAT 5382 ATOM 51209 O WAT 5383 58.731 15.709 114.539 1.00 0.00 O ATOM 51210 H1 WAT 5383 57.821 15.693 114.243 1.00 0.00 H ATOM 51211 H2 WAT 5383 58.985 16.630 114.483 1.00 0.00 H TER 51213 WAT 5383 ATOM 51213 O WAT 5384 8.937 57.611 136.521 1.00 0.00 O ATOM 51214 H1 WAT 5384 8.710 58.078 137.325 1.00 0.00 H ATOM 51215 H2 WAT 5384 9.582 56.959 136.797 1.00 0.00 H TER 51217 WAT 5384 ATOM 51217 O WAT 5385 29.813 68.331 80.473 1.00 0.00 O ATOM 51218 H1 WAT 5385 29.419 68.493 81.330 1.00 0.00 H ATOM 51219 H2 WAT 5385 30.577 67.785 80.660 1.00 0.00 H TER 51221 WAT 5385 ATOM 51221 O WAT 5386 45.967 131.435 102.090 1.00 0.00 O ATOM 51222 H1 WAT 5386 46.301 130.563 101.880 1.00 0.00 H ATOM 51223 H2 WAT 5386 45.015 131.333 102.088 1.00 0.00 H TER 51225 WAT 5386 ATOM 51225 O WAT 5387 88.728 94.790 116.896 1.00 0.00 O ATOM 51226 H1 WAT 5387 88.802 95.744 116.862 1.00 0.00 H ATOM 51227 H2 WAT 5387 89.271 94.481 116.170 1.00 0.00 H TER 51229 WAT 5387 ATOM 51229 O WAT 5388 19.654 47.235 9.990 1.00 0.00 O ATOM 51230 H1 WAT 5388 19.186 47.150 9.159 1.00 0.00 H ATOM 51231 H2 WAT 5388 20.556 46.993 9.783 1.00 0.00 H TER 51233 WAT 5388 ATOM 51233 O WAT 5389 90.429 142.960 95.207 1.00 0.00 O ATOM 51234 H1 WAT 5389 90.023 142.169 94.852 1.00 0.00 H ATOM 51235 H2 WAT 5389 90.247 143.637 94.555 1.00 0.00 H TER 51237 WAT 5389 ATOM 51237 O WAT 5390 51.677 107.916 106.533 1.00 0.00 O ATOM 51238 H1 WAT 5390 52.385 107.853 107.175 1.00 0.00 H ATOM 51239 H2 WAT 5390 50.933 108.254 107.030 1.00 0.00 H TER 51241 WAT 5390 ATOM 51241 O WAT 5391 31.362 93.548 58.631 1.00 0.00 O ATOM 51242 H1 WAT 5391 32.271 93.504 58.926 1.00 0.00 H ATOM 51243 H2 WAT 5391 30.861 93.730 59.426 1.00 0.00 H TER 51245 WAT 5391 ATOM 51245 O WAT 5392 54.311 21.359 125.261 1.00 0.00 O ATOM 51246 H1 WAT 5392 54.706 20.635 124.775 1.00 0.00 H ATOM 51247 H2 WAT 5392 54.811 22.129 124.990 1.00 0.00 H TER 51249 WAT 5392 ATOM 51249 O WAT 5393 39.810 138.056 93.655 1.00 0.00 O ATOM 51250 H1 WAT 5393 39.211 138.177 94.392 1.00 0.00 H ATOM 51251 H2 WAT 5393 40.284 137.250 93.861 1.00 0.00 H TER 51253 WAT 5393 ATOM 51253 O WAT 5394 145.134 30.726 92.082 1.00 0.00 O ATOM 51254 H1 WAT 5394 145.489 30.636 91.198 1.00 0.00 H ATOM 51255 H2 WAT 5394 145.015 31.669 92.198 1.00 0.00 H TER 51257 WAT 5394 ATOM 51257 O WAT 5395 86.997 38.275 99.608 1.00 0.00 O ATOM 51258 H1 WAT 5395 86.302 37.723 99.250 1.00 0.00 H ATOM 51259 H2 WAT 5395 87.269 38.824 98.872 1.00 0.00 H TER 51261 WAT 5395 ATOM 51261 O WAT 5396 24.925 82.739 68.104 1.00 0.00 O ATOM 51262 H1 WAT 5396 24.466 83.483 67.715 1.00 0.00 H ATOM 51263 H2 WAT 5396 25.824 82.817 67.782 1.00 0.00 H TER 51265 WAT 5396 ATOM 51265 O WAT 5397 142.324 131.532 143.946 1.00 0.00 O ATOM 51266 H1 WAT 5397 142.846 131.777 143.182 1.00 0.00 H ATOM 51267 H2 WAT 5397 142.968 131.380 144.638 1.00 0.00 H TER 51269 WAT 5397 ATOM 51269 O WAT 5398 65.959 33.740 109.486 1.00 0.00 O ATOM 51270 H1 WAT 5398 66.079 34.688 109.426 1.00 0.00 H ATOM 51271 H2 WAT 5398 66.551 33.381 108.825 1.00 0.00 H TER 51273 WAT 5398 ATOM 51273 O WAT 5399 92.637 69.790 101.358 1.00 0.00 O ATOM 51274 H1 WAT 5399 93.180 70.439 100.910 1.00 0.00 H ATOM 51275 H2 WAT 5399 93.225 69.050 101.511 1.00 0.00 H TER 51277 WAT 5399 ATOM 51277 O WAT 5400 126.827 86.586 119.649 1.00 0.00 O ATOM 51278 H1 WAT 5400 127.191 87.470 119.588 1.00 0.00 H ATOM 51279 H2 WAT 5400 125.908 86.689 119.401 1.00 0.00 H TER 51281 WAT 5400 ATOM 51281 O WAT 5401 52.015 73.366 135.135 1.00 0.00 O ATOM 51282 H1 WAT 5401 51.592 73.786 134.387 1.00 0.00 H ATOM 51283 H2 WAT 5401 51.407 73.501 135.862 1.00 0.00 H TER 51285 WAT 5401 ATOM 51285 O WAT 5402 1.719 81.216 134.788 1.00 0.00 O ATOM 51286 H1 WAT 5402 0.940 81.427 135.302 1.00 0.00 H ATOM 51287 H2 WAT 5402 1.480 81.439 133.888 1.00 0.00 H TER 51289 WAT 5402 ATOM 51289 O WAT 5403 65.869 47.894 142.276 1.00 0.00 O ATOM 51290 H1 WAT 5403 66.463 47.150 142.374 1.00 0.00 H ATOM 51291 H2 WAT 5403 65.409 47.727 141.453 1.00 0.00 H TER 51293 WAT 5403 ATOM 51293 O WAT 5404 34.680 32.594 135.865 1.00 0.00 O ATOM 51294 H1 WAT 5404 34.391 33.505 135.801 1.00 0.00 H ATOM 51295 H2 WAT 5404 33.869 32.087 135.886 1.00 0.00 H TER 51297 WAT 5404 ATOM 51297 O WAT 5405 22.177 132.804 76.698 1.00 0.00 O ATOM 51298 H1 WAT 5405 22.158 133.736 76.481 1.00 0.00 H ATOM 51299 H2 WAT 5405 21.278 132.507 76.554 1.00 0.00 H TER 51301 WAT 5405 ATOM 51301 O WAT 5406 114.962 77.784 108.788 1.00 0.00 O ATOM 51302 H1 WAT 5406 115.459 78.602 108.754 1.00 0.00 H ATOM 51303 H2 WAT 5406 115.421 77.252 109.438 1.00 0.00 H TER 51305 WAT 5406 ATOM 51305 O WAT 5407 143.902 85.733 132.903 1.00 0.00 O ATOM 51306 H1 WAT 5407 144.805 85.432 133.009 1.00 0.00 H ATOM 51307 H2 WAT 5407 143.752 86.310 133.651 1.00 0.00 H TER 51309 WAT 5407 ATOM 51309 O WAT 5408 128.652 137.329 136.030 1.00 0.00 O ATOM 51310 H1 WAT 5408 129.465 137.622 136.442 1.00 0.00 H ATOM 51311 H2 WAT 5408 127.982 137.917 136.379 1.00 0.00 H TER 51313 WAT 5408 ATOM 51313 O WAT 5409 99.070 21.443 82.686 1.00 0.00 O ATOM 51314 H1 WAT 5409 99.505 22.018 82.057 1.00 0.00 H ATOM 51315 H2 WAT 5409 99.727 21.288 83.364 1.00 0.00 H TER 51317 WAT 5409 ATOM 51317 O WAT 5410 66.626 104.736 147.134 1.00 0.00 O ATOM 51318 H1 WAT 5410 66.663 105.635 147.461 1.00 0.00 H ATOM 51319 H2 WAT 5410 67.296 104.702 146.451 1.00 0.00 H TER 51321 WAT 5410 ATOM 51321 O WAT 5411 67.709 30.642 7.275 1.00 0.00 O ATOM 51322 H1 WAT 5411 67.345 31.527 7.239 1.00 0.00 H ATOM 51323 H2 WAT 5411 67.360 30.272 8.086 1.00 0.00 H TER 51325 WAT 5411 ATOM 51325 O WAT 5412 49.411 19.765 75.131 1.00 0.00 O ATOM 51326 H1 WAT 5412 49.466 20.719 75.092 1.00 0.00 H ATOM 51327 H2 WAT 5412 50.309 19.479 75.298 1.00 0.00 H TER 51329 WAT 5412 ATOM 51329 O WAT 5413 143.830 107.621 156.574 1.00 0.00 O ATOM 51330 H1 WAT 5413 143.475 108.501 156.451 1.00 0.00 H ATOM 51331 H2 WAT 5413 144.137 107.363 155.704 1.00 0.00 H TER 51333 WAT 5413 ATOM 51333 O WAT 5414 8.022 144.863 130.345 1.00 0.00 O ATOM 51334 H1 WAT 5414 8.485 145.114 129.546 1.00 0.00 H ATOM 51335 H2 WAT 5414 8.460 144.063 130.635 1.00 0.00 H TER 51337 WAT 5414 ATOM 51337 O WAT 5415 115.501 45.116 118.638 1.00 0.00 O ATOM 51338 H1 WAT 5415 116.136 45.410 117.984 1.00 0.00 H ATOM 51339 H2 WAT 5415 115.672 45.668 119.401 1.00 0.00 H TER 51341 WAT 5415 ATOM 51341 O WAT 5416 2.324 136.149 11.305 1.00 0.00 O ATOM 51342 H1 WAT 5416 1.959 136.608 10.549 1.00 0.00 H ATOM 51343 H2 WAT 5416 1.924 135.280 11.274 1.00 0.00 H TER 51345 WAT 5416 ATOM 51345 O WAT 5417 54.515 132.745 56.977 1.00 0.00 O ATOM 51346 H1 WAT 5417 54.591 132.569 56.039 1.00 0.00 H ATOM 51347 H2 WAT 5417 55.319 133.216 57.198 1.00 0.00 H TER 51349 WAT 5417 ATOM 51349 O WAT 5418 30.975 51.294 147.102 1.00 0.00 O ATOM 51350 H1 WAT 5418 30.407 50.943 147.788 1.00 0.00 H ATOM 51351 H2 WAT 5418 31.681 51.732 147.576 1.00 0.00 H TER 51353 WAT 5418 ATOM 51353 O WAT 5419 122.121 105.088 18.206 1.00 0.00 O ATOM 51354 H1 WAT 5419 121.299 105.364 17.800 1.00 0.00 H ATOM 51355 H2 WAT 5419 122.001 105.270 19.138 1.00 0.00 H TER 51357 WAT 5419 ATOM 51357 O WAT 5420 14.521 108.419 134.864 1.00 0.00 O ATOM 51358 H1 WAT 5420 15.319 108.690 134.410 1.00 0.00 H ATOM 51359 H2 WAT 5420 13.880 108.287 134.165 1.00 0.00 H TER 51361 WAT 5420 ATOM 51361 O WAT 5421 35.704 74.245 96.851 1.00 0.00 O ATOM 51362 H1 WAT 5421 35.185 74.905 96.390 1.00 0.00 H ATOM 51363 H2 WAT 5421 35.837 73.551 96.206 1.00 0.00 H TER 51365 WAT 5421 ATOM 51365 O WAT 5422 16.579 9.323 61.462 1.00 0.00 O ATOM 51366 H1 WAT 5422 16.491 9.875 60.684 1.00 0.00 H ATOM 51367 H2 WAT 5422 17.175 8.624 61.194 1.00 0.00 H TER 51369 WAT 5422 ATOM 51369 O WAT 5423 41.187 138.899 130.113 1.00 0.00 O ATOM 51370 H1 WAT 5423 40.639 139.651 130.339 1.00 0.00 H ATOM 51371 H2 WAT 5423 40.654 138.390 129.503 1.00 0.00 H TER 51373 WAT 5423 ATOM 51373 O WAT 5424 5.011 101.857 81.962 1.00 0.00 O ATOM 51374 H1 WAT 5424 4.214 101.328 81.960 1.00 0.00 H ATOM 51375 H2 WAT 5424 5.527 101.517 81.232 1.00 0.00 H TER 51377 WAT 5424 ATOM 51377 O WAT 5425 81.835 145.475 1.614 1.00 0.00 O ATOM 51378 H1 WAT 5425 82.539 145.547 2.259 1.00 0.00 H ATOM 51379 H2 WAT 5425 82.240 145.038 0.865 1.00 0.00 H TER 51381 WAT 5425 ATOM 51381 O WAT 5426 109.149 19.322 83.539 1.00 0.00 O ATOM 51382 H1 WAT 5426 110.084 19.512 83.623 1.00 0.00 H ATOM 51383 H2 WAT 5426 108.768 19.625 84.363 1.00 0.00 H TER 51385 WAT 5426 ATOM 51385 O WAT 5427 59.614 31.002 15.669 1.00 0.00 O ATOM 51386 H1 WAT 5427 59.469 31.904 15.384 1.00 0.00 H ATOM 51387 H2 WAT 5427 60.010 31.086 16.536 1.00 0.00 H TER 51389 WAT 5427 ATOM 51389 O WAT 5428 22.688 129.504 65.470 1.00 0.00 O ATOM 51390 H1 WAT 5428 22.195 130.315 65.343 1.00 0.00 H ATOM 51391 H2 WAT 5428 22.118 128.820 65.118 1.00 0.00 H TER 51393 WAT 5428 ATOM 51393 O WAT 5429 84.725 1.954 104.165 1.00 0.00 O ATOM 51394 H1 WAT 5429 84.006 2.267 103.615 1.00 0.00 H ATOM 51395 H2 WAT 5429 85.506 2.367 103.795 1.00 0.00 H TER 51397 WAT 5429 ATOM 51397 O WAT 5430 142.580 31.926 89.141 1.00 0.00 O ATOM 51398 H1 WAT 5430 143.332 31.690 88.598 1.00 0.00 H ATOM 51399 H2 WAT 5430 142.694 32.860 89.316 1.00 0.00 H TER 51401 WAT 5430 ATOM 51401 O WAT 5431 141.794 83.027 9.126 1.00 0.00 O ATOM 51402 H1 WAT 5431 142.018 83.371 8.262 1.00 0.00 H ATOM 51403 H2 WAT 5431 141.726 82.081 8.997 1.00 0.00 H TER 51405 WAT 5431 ATOM 51405 O WAT 5432 97.449 133.105 9.332 1.00 0.00 O ATOM 51406 H1 WAT 5432 97.645 133.074 8.395 1.00 0.00 H ATOM 51407 H2 WAT 5432 98.059 132.482 9.725 1.00 0.00 H TER 51409 WAT 5432 ATOM 51409 O WAT 5433 62.171 33.185 148.651 1.00 0.00 O ATOM 51410 H1 WAT 5433 62.340 33.393 147.733 1.00 0.00 H ATOM 51411 H2 WAT 5433 62.750 32.447 148.841 1.00 0.00 H TER 51413 WAT 5433 ATOM 51413 O WAT 5434 90.192 77.689 101.760 1.00 0.00 O ATOM 51414 H1 WAT 5434 91.103 77.874 101.989 1.00 0.00 H ATOM 51415 H2 WAT 5434 89.688 77.992 102.516 1.00 0.00 H TER 51417 WAT 5434 ATOM 51417 O WAT 5435 115.024 36.525 125.323 1.00 0.00 O ATOM 51418 H1 WAT 5435 115.059 36.372 124.379 1.00 0.00 H ATOM 51419 H2 WAT 5435 115.111 35.654 125.710 1.00 0.00 H TER 51421 WAT 5435 ATOM 51421 O WAT 5436 80.247 82.879 68.405 1.00 0.00 O ATOM 51422 H1 WAT 5436 80.254 83.476 67.657 1.00 0.00 H ATOM 51423 H2 WAT 5436 79.334 82.869 68.695 1.00 0.00 H TER 51425 WAT 5436 ATOM 51425 O WAT 5437 133.350 125.113 127.285 1.00 0.00 O ATOM 51426 H1 WAT 5437 133.977 124.808 127.941 1.00 0.00 H ATOM 51427 H2 WAT 5437 133.883 125.297 126.512 1.00 0.00 H TER 51429 WAT 5437 ATOM 51429 O WAT 5438 139.415 28.334 87.944 1.00 0.00 O ATOM 51430 H1 WAT 5438 139.014 28.162 88.796 1.00 0.00 H ATOM 51431 H2 WAT 5438 140.325 28.056 88.048 1.00 0.00 H TER 51433 WAT 5438 ATOM 51433 O WAT 5439 111.179 91.369 4.225 1.00 0.00 O ATOM 51434 H1 WAT 5439 112.061 91.658 4.461 1.00 0.00 H ATOM 51435 H2 WAT 5439 110.812 91.030 5.041 1.00 0.00 H TER 51437 WAT 5439 ATOM 51437 O WAT 5440 50.477 118.609 116.992 1.00 0.00 O ATOM 51438 H1 WAT 5440 50.881 117.953 116.424 1.00 0.00 H ATOM 51439 H2 WAT 5440 49.748 118.956 116.477 1.00 0.00 H TER 51441 WAT 5440 ATOM 51441 O WAT 5441 23.581 114.031 145.701 1.00 0.00 O ATOM 51442 H1 WAT 5441 22.960 114.551 145.192 1.00 0.00 H ATOM 51443 H2 WAT 5441 23.122 113.845 146.521 1.00 0.00 H TER 51445 WAT 5441 ATOM 51445 O WAT 5442 28.385 53.013 82.860 1.00 0.00 O ATOM 51446 H1 WAT 5442 27.740 52.467 83.309 1.00 0.00 H ATOM 51447 H2 WAT 5442 28.671 52.483 82.115 1.00 0.00 H TER 51449 WAT 5442 ATOM 51449 O WAT 5443 65.635 74.200 70.470 1.00 0.00 O ATOM 51450 H1 WAT 5443 65.542 74.997 70.991 1.00 0.00 H ATOM 51451 H2 WAT 5443 65.605 73.490 71.110 1.00 0.00 H TER 51453 WAT 5443 ATOM 51453 O WAT 5444 139.587 95.800 117.486 1.00 0.00 O ATOM 51454 H1 WAT 5444 139.840 96.445 118.147 1.00 0.00 H ATOM 51455 H2 WAT 5444 138.998 95.203 117.947 1.00 0.00 H TER 51457 WAT 5444 ATOM 51457 O WAT 5445 39.089 49.846 120.118 1.00 0.00 O ATOM 51458 H1 WAT 5445 38.590 49.077 119.844 1.00 0.00 H ATOM 51459 H2 WAT 5445 39.050 49.829 121.075 1.00 0.00 H TER 51461 WAT 5445 ATOM 51461 O WAT 5446 30.394 62.621 76.356 1.00 0.00 O ATOM 51462 H1 WAT 5446 29.471 62.382 76.277 1.00 0.00 H ATOM 51463 H2 WAT 5446 30.455 63.070 77.199 1.00 0.00 H TER 51465 WAT 5446 ATOM 51465 O WAT 5447 38.133 119.880 146.102 1.00 0.00 O ATOM 51466 H1 WAT 5447 37.914 119.105 145.586 1.00 0.00 H ATOM 51467 H2 WAT 5447 38.790 119.574 146.728 1.00 0.00 H TER 51469 WAT 5447 ATOM 51469 O WAT 5448 22.366 122.444 13.151 1.00 0.00 O ATOM 51470 H1 WAT 5448 22.360 121.842 13.895 1.00 0.00 H ATOM 51471 H2 WAT 5448 23.290 122.524 12.915 1.00 0.00 H TER 51473 WAT 5448 ATOM 51473 O WAT 5449 120.780 9.490 11.460 1.00 0.00 O ATOM 51474 H1 WAT 5449 121.356 8.750 11.653 1.00 0.00 H ATOM 51475 H2 WAT 5449 119.919 9.094 11.324 1.00 0.00 H TER 51477 WAT 5449 ATOM 51477 O WAT 5450 39.361 49.626 102.086 1.00 0.00 O ATOM 51478 H1 WAT 5450 39.687 50.514 101.941 1.00 0.00 H ATOM 51479 H2 WAT 5450 39.108 49.611 103.009 1.00 0.00 H TER 51481 WAT 5450 ATOM 51481 O WAT 5451 60.950 84.960 19.319 1.00 0.00 O ATOM 51482 H1 WAT 5451 61.747 85.455 19.128 1.00 0.00 H ATOM 51483 H2 WAT 5451 61.261 84.082 19.539 1.00 0.00 H TER 51485 WAT 5451 ATOM 51485 O WAT 5452 2.922 33.393 73.479 1.00 0.00 O ATOM 51486 H1 WAT 5452 3.808 33.207 73.169 1.00 0.00 H ATOM 51487 H2 WAT 5452 2.393 33.433 72.682 1.00 0.00 H TER 51489 WAT 5452 ATOM 51489 O WAT 5453 36.302 3.603 67.257 1.00 0.00 O ATOM 51490 H1 WAT 5453 35.830 4.347 67.631 1.00 0.00 H ATOM 51491 H2 WAT 5453 36.971 3.391 67.908 1.00 0.00 H TER 51493 WAT 5453 ATOM 51493 O WAT 5454 2.732 124.653 93.421 1.00 0.00 O ATOM 51494 H1 WAT 5454 2.240 124.904 92.639 1.00 0.00 H ATOM 51495 H2 WAT 5454 3.060 123.775 93.226 1.00 0.00 H TER 51497 WAT 5454 ATOM 51497 O WAT 5455 24.097 10.900 122.431 1.00 0.00 O ATOM 51498 H1 WAT 5455 24.108 10.753 123.377 1.00 0.00 H ATOM 51499 H2 WAT 5455 24.866 10.430 122.107 1.00 0.00 H TER 51501 WAT 5455 ATOM 51501 O WAT 5456 112.746 123.415 3.651 1.00 0.00 O ATOM 51502 H1 WAT 5456 112.541 122.743 4.301 1.00 0.00 H ATOM 51503 H2 WAT 5456 113.616 123.729 3.896 1.00 0.00 H TER 51505 WAT 5456 ATOM 51505 O WAT 5457 51.173 104.407 8.291 1.00 0.00 O ATOM 51506 H1 WAT 5457 51.019 105.313 8.025 1.00 0.00 H ATOM 51507 H2 WAT 5457 50.551 104.257 9.003 1.00 0.00 H TER 51509 WAT 5457 ATOM 51509 O WAT 5458 73.788 59.717 89.762 1.00 0.00 O ATOM 51510 H1 WAT 5458 73.873 60.661 89.631 1.00 0.00 H ATOM 51511 H2 WAT 5458 72.884 59.520 89.516 1.00 0.00 H TER 51513 WAT 5458 ATOM 51513 O WAT 5459 141.305 70.520 91.774 1.00 0.00 O ATOM 51514 H1 WAT 5459 141.931 70.316 91.079 1.00 0.00 H ATOM 51515 H2 WAT 5459 140.484 70.696 91.314 1.00 0.00 H TER 51517 WAT 5459 ATOM 51517 O WAT 5460 9.350 114.680 64.708 1.00 0.00 O ATOM 51518 H1 WAT 5460 8.416 114.887 64.720 1.00 0.00 H ATOM 51519 H2 WAT 5460 9.529 114.438 63.799 1.00 0.00 H TER 51521 WAT 5460 ATOM 51521 O WAT 5461 109.262 92.404 105.825 1.00 0.00 O ATOM 51522 H1 WAT 5461 109.770 92.816 105.126 1.00 0.00 H ATOM 51523 H2 WAT 5461 109.668 92.717 106.633 1.00 0.00 H TER 51525 WAT 5461 ATOM 51525 O WAT 5462 21.950 134.818 13.029 1.00 0.00 O ATOM 51526 H1 WAT 5462 22.514 134.052 13.139 1.00 0.00 H ATOM 51527 H2 WAT 5462 21.062 134.461 13.015 1.00 0.00 H TER 51529 WAT 5462 ATOM 51529 O WAT 5463 88.460 60.969 22.333 1.00 0.00 O ATOM 51530 H1 WAT 5463 88.320 60.143 21.869 1.00 0.00 H ATOM 51531 H2 WAT 5463 89.030 60.737 23.066 1.00 0.00 H TER 51533 WAT 5463 ATOM 51533 O WAT 5464 55.165 105.760 149.006 1.00 0.00 O ATOM 51534 H1 WAT 5464 55.296 105.032 149.613 1.00 0.00 H ATOM 51535 H2 WAT 5464 54.218 105.898 149.000 1.00 0.00 H TER 51537 WAT 5464 ATOM 51537 O WAT 5465 141.277 9.579 110.462 1.00 0.00 O ATOM 51538 H1 WAT 5465 140.695 9.055 109.912 1.00 0.00 H ATOM 51539 H2 WAT 5465 141.854 10.026 109.843 1.00 0.00 H TER 51541 WAT 5465 ATOM 51541 O WAT 5466 118.077 134.676 120.336 1.00 0.00 O ATOM 51542 H1 WAT 5466 117.598 134.073 119.768 1.00 0.00 H ATOM 51543 H2 WAT 5466 117.647 135.521 120.203 1.00 0.00 H TER 51545 WAT 5466 ATOM 51545 O WAT 5467 10.368 43.829 139.860 1.00 0.00 O ATOM 51546 H1 WAT 5467 11.179 43.336 139.738 1.00 0.00 H ATOM 51547 H2 WAT 5467 9.727 43.171 140.132 1.00 0.00 H TER 51549 WAT 5467 ATOM 51549 O WAT 5468 48.777 80.321 124.420 1.00 0.00 O ATOM 51550 H1 WAT 5468 49.412 79.639 124.201 1.00 0.00 H ATOM 51551 H2 WAT 5468 47.956 79.847 124.557 1.00 0.00 H TER 51553 WAT 5468 ATOM 51553 O WAT 5469 80.528 136.568 21.194 1.00 0.00 O ATOM 51554 H1 WAT 5469 81.177 136.543 21.897 1.00 0.00 H ATOM 51555 H2 WAT 5469 81.003 136.270 20.419 1.00 0.00 H TER 51557 WAT 5469 ATOM 51557 O WAT 5470 99.857 3.151 63.405 1.00 0.00 O ATOM 51558 H1 WAT 5470 99.828 4.007 63.833 1.00 0.00 H ATOM 51559 H2 WAT 5470 100.711 3.129 62.972 1.00 0.00 H TER 51561 WAT 5470 ATOM 51561 O WAT 5471 140.881 127.241 143.284 1.00 0.00 O ATOM 51562 H1 WAT 5471 140.438 128.000 143.664 1.00 0.00 H ATOM 51563 H2 WAT 5471 140.312 126.967 142.565 1.00 0.00 H TER 51565 WAT 5471 ATOM 51565 O WAT 5472 37.166 52.809 117.015 1.00 0.00 O ATOM 51566 H1 WAT 5472 38.058 52.676 116.694 1.00 0.00 H ATOM 51567 H2 WAT 5472 36.685 52.039 116.712 1.00 0.00 H TER 51569 WAT 5472 ATOM 51569 O WAT 5473 110.008 135.046 9.689 1.00 0.00 O ATOM 51570 H1 WAT 5473 110.328 134.247 9.269 1.00 0.00 H ATOM 51571 H2 WAT 5473 110.099 135.722 9.017 1.00 0.00 H TER 51573 WAT 5473 ATOM 51573 O WAT 5474 97.577 110.329 110.390 1.00 0.00 O ATOM 51574 H1 WAT 5474 97.102 110.840 111.045 1.00 0.00 H ATOM 51575 H2 WAT 5474 97.791 109.509 110.836 1.00 0.00 H TER 51577 WAT 5474 ATOM 51577 O WAT 5475 2.604 77.880 100.527 1.00 0.00 O ATOM 51578 H1 WAT 5475 2.524 77.193 101.189 1.00 0.00 H ATOM 51579 H2 WAT 5475 3.542 77.930 100.345 1.00 0.00 H TER 51581 WAT 5475 ATOM 51581 O WAT 5476 54.100 90.251 100.992 1.00 0.00 O ATOM 51582 H1 WAT 5476 53.213 90.598 100.890 1.00 0.00 H ATOM 51583 H2 WAT 5476 54.669 91.012 100.881 1.00 0.00 H TER 51585 WAT 5476 ATOM 51585 O WAT 5477 100.695 84.978 88.535 1.00 0.00 O ATOM 51586 H1 WAT 5477 100.295 85.531 87.865 1.00 0.00 H ATOM 51587 H2 WAT 5477 101.505 85.432 88.768 1.00 0.00 H TER 51589 WAT 5477 ATOM 51589 O WAT 5478 62.875 70.703 84.131 1.00 0.00 O ATOM 51590 H1 WAT 5478 61.938 70.509 84.158 1.00 0.00 H ATOM 51591 H2 WAT 5478 63.167 70.360 83.287 1.00 0.00 H TER 51593 WAT 5478 ATOM 51593 O WAT 5479 40.234 56.919 125.103 1.00 0.00 O ATOM 51594 H1 WAT 5479 39.482 57.061 125.678 1.00 0.00 H ATOM 51595 H2 WAT 5479 40.715 57.746 125.128 1.00 0.00 H TER 51597 WAT 5479 ATOM 51597 O WAT 5480 5.840 65.630 134.962 1.00 0.00 O ATOM 51598 H1 WAT 5480 6.443 66.372 134.914 1.00 0.00 H ATOM 51599 H2 WAT 5480 6.046 65.104 134.189 1.00 0.00 H TER 51601 WAT 5480 ATOM 51601 O WAT 5481 43.755 141.424 53.688 1.00 0.00 O ATOM 51602 H1 WAT 5481 44.003 141.882 52.885 1.00 0.00 H ATOM 51603 H2 WAT 5481 42.861 141.123 53.525 1.00 0.00 H TER 51605 WAT 5481 ATOM 51605 O WAT 5482 19.191 67.693 89.515 1.00 0.00 O ATOM 51606 H1 WAT 5482 19.898 67.063 89.369 1.00 0.00 H ATOM 51607 H2 WAT 5482 19.525 68.515 89.155 1.00 0.00 H TER 51609 WAT 5482 ATOM 51609 O WAT 5483 77.136 5.865 5.651 1.00 0.00 O ATOM 51610 H1 WAT 5483 77.232 6.220 6.535 1.00 0.00 H ATOM 51611 H2 WAT 5483 76.402 6.353 5.276 1.00 0.00 H TER 51613 WAT 5483 ATOM 51613 O WAT 5484 81.775 39.280 137.912 1.00 0.00 O ATOM 51614 H1 WAT 5484 81.870 39.392 136.966 1.00 0.00 H ATOM 51615 H2 WAT 5484 82.005 38.365 138.069 1.00 0.00 H TER 51617 WAT 5484 ATOM 51617 O WAT 5485 76.273 86.734 118.188 1.00 0.00 O ATOM 51618 H1 WAT 5485 75.972 87.302 117.479 1.00 0.00 H ATOM 51619 H2 WAT 5485 77.171 87.019 118.358 1.00 0.00 H TER 51621 WAT 5485 ATOM 51621 O WAT 5486 23.284 113.404 108.707 1.00 0.00 O ATOM 51622 H1 WAT 5486 24.010 113.743 108.183 1.00 0.00 H ATOM 51623 H2 WAT 5486 23.368 112.452 108.645 1.00 0.00 H TER 51625 WAT 5486 ATOM 51625 O WAT 5487 21.910 79.705 84.347 1.00 0.00 O ATOM 51626 H1 WAT 5487 21.657 80.282 83.627 1.00 0.00 H ATOM 51627 H2 WAT 5487 21.598 78.839 84.082 1.00 0.00 H TER 51629 WAT 5487 ATOM 51629 O WAT 5488 91.965 34.081 60.147 1.00 0.00 O ATOM 51630 H1 WAT 5488 91.158 34.014 60.657 1.00 0.00 H ATOM 51631 H2 WAT 5488 91.688 33.942 59.241 1.00 0.00 H TER 51633 WAT 5488 ATOM 51633 O WAT 5489 71.318 66.151 125.906 1.00 0.00 O ATOM 51634 H1 WAT 5489 72.141 66.019 125.436 1.00 0.00 H ATOM 51635 H2 WAT 5489 71.377 65.566 126.662 1.00 0.00 H TER 51637 WAT 5489 ATOM 51637 O WAT 5490 12.783 86.608 83.215 1.00 0.00 O ATOM 51638 H1 WAT 5490 12.360 86.946 84.004 1.00 0.00 H ATOM 51639 H2 WAT 5490 13.244 85.822 83.508 1.00 0.00 H TER 51641 WAT 5490 ATOM 51641 O WAT 5491 74.317 73.852 136.631 1.00 0.00 O ATOM 51642 H1 WAT 5491 74.929 73.128 136.496 1.00 0.00 H ATOM 51643 H2 WAT 5491 73.619 73.478 137.169 1.00 0.00 H TER 51645 WAT 5491 ATOM 51645 O WAT 5492 142.385 4.312 81.132 1.00 0.00 O ATOM 51646 H1 WAT 5492 142.908 4.971 80.675 1.00 0.00 H ATOM 51647 H2 WAT 5492 141.630 4.169 80.562 1.00 0.00 H TER 51649 WAT 5492 ATOM 51649 O WAT 5493 112.256 134.374 23.558 1.00 0.00 O ATOM 51650 H1 WAT 5493 113.197 134.411 23.729 1.00 0.00 H ATOM 51651 H2 WAT 5493 111.993 135.290 23.465 1.00 0.00 H TER 51653 WAT 5493 ATOM 51653 O WAT 5494 138.074 110.068 101.927 1.00 0.00 O ATOM 51654 H1 WAT 5494 137.297 109.727 102.371 1.00 0.00 H ATOM 51655 H2 WAT 5494 137.778 110.255 101.037 1.00 0.00 H TER 51657 WAT 5494 ATOM 51657 O WAT 5495 22.666 34.471 63.136 1.00 0.00 O ATOM 51658 H1 WAT 5495 21.996 34.963 63.611 1.00 0.00 H ATOM 51659 H2 WAT 5495 22.907 35.039 62.405 1.00 0.00 H TER 51661 WAT 5495 ATOM 51661 O WAT 5496 38.229 113.249 0.868 1.00 0.00 O ATOM 51662 H1 WAT 5496 38.298 113.164 1.819 1.00 0.00 H ATOM 51663 H2 WAT 5496 37.551 113.911 0.735 1.00 0.00 H TER 51665 WAT 5496 ATOM 51665 O WAT 5497 40.099 46.182 30.806 1.00 0.00 O ATOM 51666 H1 WAT 5497 40.039 47.120 30.988 1.00 0.00 H ATOM 51667 H2 WAT 5497 39.494 46.040 30.078 1.00 0.00 H TER 51669 WAT 5497 ATOM 51669 O WAT 5498 69.895 96.336 151.334 1.00 0.00 O ATOM 51670 H1 WAT 5498 69.603 97.218 151.565 1.00 0.00 H ATOM 51671 H2 WAT 5498 70.842 96.354 151.467 1.00 0.00 H TER 51673 WAT 5498 ATOM 51673 O WAT 5499 100.166 90.276 74.883 1.00 0.00 O ATOM 51674 H1 WAT 5499 99.480 90.543 74.272 1.00 0.00 H ATOM 51675 H2 WAT 5499 99.715 89.727 75.525 1.00 0.00 H TER 51677 WAT 5499 ATOM 51677 O WAT 5500 5.737 22.205 145.593 1.00 0.00 O ATOM 51678 H1 WAT 5500 6.327 22.162 144.841 1.00 0.00 H ATOM 51679 H2 WAT 5500 5.754 23.124 145.860 1.00 0.00 H TER 51681 WAT 5500 ATOM 51681 O WAT 5501 17.294 18.368 21.961 1.00 0.00 O ATOM 51682 H1 WAT 5501 18.187 18.651 21.764 1.00 0.00 H ATOM 51683 H2 WAT 5501 17.167 17.585 21.425 1.00 0.00 H TER 51685 WAT 5501 ATOM 51685 O WAT 5502 137.320 0.913 124.778 1.00 0.00 O ATOM 51686 H1 WAT 5502 137.244 1.862 124.680 1.00 0.00 H ATOM 51687 H2 WAT 5502 138.237 0.723 124.579 1.00 0.00 H TER 51689 WAT 5502 ATOM 51689 O WAT 5503 95.858 134.832 98.009 1.00 0.00 O ATOM 51690 H1 WAT 5503 96.771 134.669 97.771 1.00 0.00 H ATOM 51691 H2 WAT 5503 95.507 135.342 97.279 1.00 0.00 H TER 51693 WAT 5503 ATOM 51693 O WAT 5504 15.033 64.994 15.462 1.00 0.00 O ATOM 51694 H1 WAT 5504 14.246 64.561 15.132 1.00 0.00 H ATOM 51695 H2 WAT 5504 15.709 64.788 14.816 1.00 0.00 H TER 51697 WAT 5504 ATOM 51697 O WAT 5505 76.433 116.028 10.179 1.00 0.00 O ATOM 51698 H1 WAT 5505 75.568 116.365 10.410 1.00 0.00 H ATOM 51699 H2 WAT 5505 76.775 115.663 10.995 1.00 0.00 H TER 51701 WAT 5505 ATOM 51701 O WAT 5506 38.251 0.504 101.488 1.00 0.00 O ATOM 51702 H1 WAT 5506 38.492 0.706 102.392 1.00 0.00 H ATOM 51703 H2 WAT 5506 37.395 0.081 101.558 1.00 0.00 H TER 51705 WAT 5506 ATOM 51705 O WAT 5507 73.115 94.705 117.539 1.00 0.00 O ATOM 51706 H1 WAT 5507 73.747 95.071 116.920 1.00 0.00 H ATOM 51707 H2 WAT 5507 73.513 94.845 118.398 1.00 0.00 H TER 51709 WAT 5507 ATOM 51709 O WAT 5508 21.730 77.705 140.670 1.00 0.00 O ATOM 51710 H1 WAT 5508 22.678 77.817 140.594 1.00 0.00 H ATOM 51711 H2 WAT 5508 21.471 78.310 141.365 1.00 0.00 H TER 51713 WAT 5508 ATOM 51713 O WAT 5509 2.272 69.873 127.730 1.00 0.00 O ATOM 51714 H1 WAT 5509 1.880 70.725 127.922 1.00 0.00 H ATOM 51715 H2 WAT 5509 2.619 69.963 126.843 1.00 0.00 H TER 51717 WAT 5509 ATOM 51717 O WAT 5510 20.729 91.776 116.273 1.00 0.00 O ATOM 51718 H1 WAT 5510 21.435 91.197 115.984 1.00 0.00 H ATOM 51719 H2 WAT 5510 19.927 91.326 116.008 1.00 0.00 H TER 51721 WAT 5510 ATOM 51721 O WAT 5511 120.688 86.288 6.049 1.00 0.00 O ATOM 51722 H1 WAT 5511 120.033 85.881 6.617 1.00 0.00 H ATOM 51723 H2 WAT 5511 121.477 86.336 6.589 1.00 0.00 H TER 51725 WAT 5511 ATOM 51725 O WAT 5512 92.880 65.213 100.464 1.00 0.00 O ATOM 51726 H1 WAT 5512 92.502 64.350 100.294 1.00 0.00 H ATOM 51727 H2 WAT 5512 92.282 65.825 100.035 1.00 0.00 H TER 51729 WAT 5512 ATOM 51729 O WAT 5513 6.406 97.937 1.904 1.00 0.00 O ATOM 51730 H1 WAT 5513 5.581 98.000 1.423 1.00 0.00 H ATOM 51731 H2 WAT 5513 6.713 98.842 1.973 1.00 0.00 H TER 51733 WAT 5513 ATOM 51733 O WAT 5514 8.945 136.980 147.423 1.00 0.00 O ATOM 51734 H1 WAT 5514 8.079 136.773 147.774 1.00 0.00 H ATOM 51735 H2 WAT 5514 9.517 136.993 148.190 1.00 0.00 H TER 51737 WAT 5514 ATOM 51737 O WAT 5515 10.766 89.939 85.710 1.00 0.00 O ATOM 51738 H1 WAT 5515 10.390 89.573 84.910 1.00 0.00 H ATOM 51739 H2 WAT 5515 10.440 89.373 86.409 1.00 0.00 H TER 51741 WAT 5515 ATOM 51741 O WAT 5516 72.375 52.527 149.661 1.00 0.00 O ATOM 51742 H1 WAT 5516 72.902 51.868 150.112 1.00 0.00 H ATOM 51743 H2 WAT 5516 72.223 52.158 148.791 1.00 0.00 H TER 51745 WAT 5516 ATOM 51745 O WAT 5517 61.890 124.878 14.680 1.00 0.00 O ATOM 51746 H1 WAT 5517 62.249 125.629 15.151 1.00 0.00 H ATOM 51747 H2 WAT 5517 62.365 124.125 15.031 1.00 0.00 H TER 51749 WAT 5517 ATOM 51749 O WAT 5518 124.466 123.498 153.287 1.00 0.00 O ATOM 51750 H1 WAT 5518 124.895 123.657 154.128 1.00 0.00 H ATOM 51751 H2 WAT 5518 125.112 123.009 152.777 1.00 0.00 H TER 51753 WAT 5518 ATOM 51753 O WAT 5519 19.299 61.891 73.104 1.00 0.00 O ATOM 51754 H1 WAT 5519 19.425 61.752 74.042 1.00 0.00 H ATOM 51755 H2 WAT 5519 19.781 61.175 72.689 1.00 0.00 H TER 51757 WAT 5519 ATOM 51757 O WAT 5520 66.580 82.098 14.757 1.00 0.00 O ATOM 51758 H1 WAT 5520 65.836 82.696 14.688 1.00 0.00 H ATOM 51759 H2 WAT 5520 66.509 81.537 13.985 1.00 0.00 H TER 51761 WAT 5520 ATOM 51761 O WAT 5521 100.175 81.624 81.654 1.00 0.00 O ATOM 51762 H1 WAT 5521 100.023 81.021 82.382 1.00 0.00 H ATOM 51763 H2 WAT 5521 100.257 82.483 82.068 1.00 0.00 H TER 51765 WAT 5521 ATOM 51765 O WAT 5522 2.623 77.378 121.117 1.00 0.00 O ATOM 51766 H1 WAT 5522 2.211 76.677 120.611 1.00 0.00 H ATOM 51767 H2 WAT 5522 2.520 77.107 122.029 1.00 0.00 H TER 51769 WAT 5522 ATOM 51769 O WAT 5523 81.603 55.343 103.300 1.00 0.00 O ATOM 51770 H1 WAT 5523 82.209 55.831 103.858 1.00 0.00 H ATOM 51771 H2 WAT 5523 80.742 55.708 103.503 1.00 0.00 H TER 51773 WAT 5523 ATOM 51773 O WAT 5524 73.036 62.205 149.364 1.00 0.00 O ATOM 51774 H1 WAT 5524 72.644 61.430 149.767 1.00 0.00 H ATOM 51775 H2 WAT 5524 73.590 62.577 150.050 1.00 0.00 H TER 51777 WAT 5524 ATOM 51777 O WAT 5525 112.648 18.437 126.629 1.00 0.00 O ATOM 51778 H1 WAT 5525 113.470 18.225 126.186 1.00 0.00 H ATOM 51779 H2 WAT 5525 111.967 18.135 126.029 1.00 0.00 H TER 51781 WAT 5525 ATOM 51781 O WAT 5526 129.650 64.396 92.952 1.00 0.00 O ATOM 51782 H1 WAT 5526 130.292 64.341 93.661 1.00 0.00 H ATOM 51783 H2 WAT 5526 128.879 63.943 93.293 1.00 0.00 H TER 51785 WAT 5526 ATOM 51785 O WAT 5527 76.001 13.046 155.519 1.00 0.00 O ATOM 51786 H1 WAT 5527 76.861 13.381 155.266 1.00 0.00 H ATOM 51787 H2 WAT 5527 76.118 12.097 155.566 1.00 0.00 H TER 51789 WAT 5527 ATOM 51789 O WAT 5528 47.010 91.027 92.239 1.00 0.00 O ATOM 51790 H1 WAT 5528 46.645 91.796 91.801 1.00 0.00 H ATOM 51791 H2 WAT 5528 47.168 90.401 91.531 1.00 0.00 H TER 51793 WAT 5528 ATOM 51793 O WAT 5529 46.794 78.574 137.410 1.00 0.00 O ATOM 51794 H1 WAT 5529 47.547 78.340 137.953 1.00 0.00 H ATOM 51795 H2 WAT 5529 46.770 77.901 136.731 1.00 0.00 H TER 51797 WAT 5529 ATOM 51797 O WAT 5530 77.225 11.506 77.266 1.00 0.00 O ATOM 51798 H1 WAT 5530 76.772 10.673 77.402 1.00 0.00 H ATOM 51799 H2 WAT 5530 78.154 11.280 77.296 1.00 0.00 H TER 51801 WAT 5530 ATOM 51801 O WAT 5531 104.227 14.949 120.904 1.00 0.00 O ATOM 51802 H1 WAT 5531 104.286 14.526 120.047 1.00 0.00 H ATOM 51803 H2 WAT 5531 103.739 14.328 121.444 1.00 0.00 H TER 51805 WAT 5531 ATOM 51805 O WAT 5532 111.260 35.432 26.995 1.00 0.00 O ATOM 51806 H1 WAT 5532 112.146 35.266 26.672 1.00 0.00 H ATOM 51807 H2 WAT 5532 110.745 35.597 26.205 1.00 0.00 H TER 51809 WAT 5532 ATOM 51809 O WAT 5533 45.323 77.638 22.831 1.00 0.00 O ATOM 51810 H1 WAT 5533 45.928 77.553 23.567 1.00 0.00 H ATOM 51811 H2 WAT 5533 44.955 78.517 22.924 1.00 0.00 H TER 51813 WAT 5533 ATOM 51813 O WAT 5534 23.586 69.106 122.704 1.00 0.00 O ATOM 51814 H1 WAT 5534 23.582 68.239 122.298 1.00 0.00 H ATOM 51815 H2 WAT 5534 22.709 69.452 122.538 1.00 0.00 H TER 51817 WAT 5534 ATOM 51817 O WAT 5535 25.324 131.966 102.673 1.00 0.00 O ATOM 51818 H1 WAT 5535 24.520 132.270 102.252 1.00 0.00 H ATOM 51819 H2 WAT 5535 25.242 131.012 102.686 1.00 0.00 H TER 51821 WAT 5535 ATOM 51821 O WAT 5536 113.935 38.430 92.097 1.00 0.00 O ATOM 51822 H1 WAT 5536 114.767 38.327 91.634 1.00 0.00 H ATOM 51823 H2 WAT 5536 113.890 37.672 92.680 1.00 0.00 H TER 51825 WAT 5536 ATOM 51825 O WAT 5537 18.906 108.652 99.613 1.00 0.00 O ATOM 51826 H1 WAT 5537 18.724 108.648 100.553 1.00 0.00 H ATOM 51827 H2 WAT 5537 19.591 107.993 99.499 1.00 0.00 H TER 51829 WAT 5537 ATOM 51829 O WAT 5538 125.486 117.548 5.814 1.00 0.00 O ATOM 51830 H1 WAT 5538 125.696 118.479 5.888 1.00 0.00 H ATOM 51831 H2 WAT 5538 124.651 117.528 5.346 1.00 0.00 H TER 51833 WAT 5538 ATOM 51833 O WAT 5539 79.001 42.764 17.057 1.00 0.00 O ATOM 51834 H1 WAT 5539 79.356 42.022 17.546 1.00 0.00 H ATOM 51835 H2 WAT 5539 78.885 42.431 16.167 1.00 0.00 H TER 51837 WAT 5539 ATOM 51837 O WAT 5540 98.034 71.495 136.332 1.00 0.00 O ATOM 51838 H1 WAT 5540 97.751 72.408 136.283 1.00 0.00 H ATOM 51839 H2 WAT 5540 97.466 71.103 136.995 1.00 0.00 H TER 51841 WAT 5540 ATOM 51841 O WAT 5541 131.603 103.086 145.715 1.00 0.00 O ATOM 51842 H1 WAT 5541 131.684 103.645 144.942 1.00 0.00 H ATOM 51843 H2 WAT 5541 131.021 103.571 146.301 1.00 0.00 H TER 51845 WAT 5541 ATOM 51845 O WAT 5542 107.013 141.273 98.911 1.00 0.00 O ATOM 51846 H1 WAT 5542 106.255 141.021 99.438 1.00 0.00 H ATOM 51847 H2 WAT 5542 106.717 141.179 98.006 1.00 0.00 H TER 51849 WAT 5542 ATOM 51849 O WAT 5543 26.463 37.039 95.380 1.00 0.00 O ATOM 51850 H1 WAT 5543 26.942 37.623 95.967 1.00 0.00 H ATOM 51851 H2 WAT 5543 26.137 37.611 94.686 1.00 0.00 H TER 51853 WAT 5543 ATOM 51853 O WAT 5544 2.102 93.161 129.608 1.00 0.00 O ATOM 51854 H1 WAT 5544 1.472 92.624 130.088 1.00 0.00 H ATOM 51855 H2 WAT 5544 2.900 93.122 130.135 1.00 0.00 H TER 51857 WAT 5544 ATOM 51857 O WAT 5545 74.015 39.304 99.277 1.00 0.00 O ATOM 51858 H1 WAT 5545 73.772 39.810 98.502 1.00 0.00 H ATOM 51859 H2 WAT 5545 74.558 39.901 99.793 1.00 0.00 H TER 51861 WAT 5545 ATOM 51861 O WAT 5546 44.449 13.193 101.949 1.00 0.00 O ATOM 51862 H1 WAT 5546 43.742 12.696 102.362 1.00 0.00 H ATOM 51863 H2 WAT 5546 44.119 14.091 101.909 1.00 0.00 H TER 51865 WAT 5546 ATOM 51865 O WAT 5547 29.682 39.673 10.356 1.00 0.00 O ATOM 51866 H1 WAT 5547 29.851 40.502 10.803 1.00 0.00 H ATOM 51867 H2 WAT 5547 29.143 39.914 9.602 1.00 0.00 H TER 51869 WAT 5547 ATOM 51869 O WAT 5548 120.879 29.586 114.147 1.00 0.00 O ATOM 51870 H1 WAT 5548 120.006 29.440 113.782 1.00 0.00 H ATOM 51871 H2 WAT 5548 121.100 28.761 114.579 1.00 0.00 H TER 51873 WAT 5548 ATOM 51873 O WAT 5549 102.417 103.633 144.027 1.00 0.00 O ATOM 51874 H1 WAT 5549 102.851 103.376 144.840 1.00 0.00 H ATOM 51875 H2 WAT 5549 103.134 103.853 143.432 1.00 0.00 H TER 51877 WAT 5549 ATOM 51877 O WAT 5550 103.229 45.536 99.278 1.00 0.00 O ATOM 51878 H1 WAT 5550 102.360 45.524 99.680 1.00 0.00 H ATOM 51879 H2 WAT 5550 103.301 46.407 98.888 1.00 0.00 H TER 51881 WAT 5550 ATOM 51881 O WAT 5551 65.258 121.387 103.901 1.00 0.00 O ATOM 51882 H1 WAT 5551 64.450 121.018 104.259 1.00 0.00 H ATOM 51883 H2 WAT 5551 64.963 122.075 103.305 1.00 0.00 H TER 51885 WAT 5551 ATOM 51885 O WAT 5552 5.008 58.886 151.297 1.00 0.00 O ATOM 51886 H1 WAT 5552 5.064 58.851 150.342 1.00 0.00 H ATOM 51887 H2 WAT 5552 4.233 58.365 151.511 1.00 0.00 H TER 51889 WAT 5552 ATOM 51889 O WAT 5553 57.970 2.399 90.719 1.00 0.00 O ATOM 51890 H1 WAT 5553 57.498 2.587 89.907 1.00 0.00 H ATOM 51891 H2 WAT 5553 58.524 1.648 90.506 1.00 0.00 H TER 51893 WAT 5553 ATOM 51893 O WAT 5554 6.204 1.026 89.173 1.00 0.00 O ATOM 51894 H1 WAT 5554 6.002 0.106 89.004 1.00 0.00 H ATOM 51895 H2 WAT 5554 6.812 1.006 89.912 1.00 0.00 H TER 51897 WAT 5554 ATOM 51897 O WAT 5555 117.942 24.916 125.372 1.00 0.00 O ATOM 51898 H1 WAT 5555 117.490 25.389 126.071 1.00 0.00 H ATOM 51899 H2 WAT 5555 118.872 25.064 125.546 1.00 0.00 H TER 51901 WAT 5555 ATOM 51901 O WAT 5556 3.649 104.852 72.666 1.00 0.00 O ATOM 51902 H1 WAT 5556 3.247 105.410 72.000 1.00 0.00 H ATOM 51903 H2 WAT 5556 3.211 104.007 72.566 1.00 0.00 H TER 51905 WAT 5556 ATOM 51905 O WAT 5557 39.332 72.998 112.981 1.00 0.00 O ATOM 51906 H1 WAT 5557 40.036 72.367 112.824 1.00 0.00 H ATOM 51907 H2 WAT 5557 38.544 72.561 112.658 1.00 0.00 H TER 51909 WAT 5557 ATOM 51909 O WAT 5558 48.269 72.209 103.568 1.00 0.00 O ATOM 51910 H1 WAT 5558 48.594 72.053 102.682 1.00 0.00 H ATOM 51911 H2 WAT 5558 48.959 72.722 103.989 1.00 0.00 H TER 51913 WAT 5558 ATOM 51913 O WAT 5559 1.370 132.888 126.520 1.00 0.00 O ATOM 51914 H1 WAT 5559 1.555 133.718 126.080 1.00 0.00 H ATOM 51915 H2 WAT 5559 1.496 132.224 125.842 1.00 0.00 H TER 51917 WAT 5559 ATOM 51917 O WAT 5560 35.074 117.836 80.848 1.00 0.00 O ATOM 51918 H1 WAT 5560 34.916 118.780 80.846 1.00 0.00 H ATOM 51919 H2 WAT 5560 36.019 117.751 80.969 1.00 0.00 H TER 51921 WAT 5560 ATOM 51921 O WAT 5561 74.628 145.658 26.721 1.00 0.00 O ATOM 51922 H1 WAT 5561 74.260 144.976 27.283 1.00 0.00 H ATOM 51923 H2 WAT 5561 74.806 145.214 25.892 1.00 0.00 H TER 51925 WAT 5561 ATOM 51925 O WAT 5562 86.797 117.528 152.567 1.00 0.00 O ATOM 51926 H1 WAT 5562 85.977 117.659 153.043 1.00 0.00 H ATOM 51927 H2 WAT 5562 87.475 117.844 153.165 1.00 0.00 H TER 51929 WAT 5562 ATOM 51929 O WAT 5563 122.730 29.637 64.524 1.00 0.00 O ATOM 51930 H1 WAT 5563 122.549 30.330 63.890 1.00 0.00 H ATOM 51931 H2 WAT 5563 123.437 29.986 65.066 1.00 0.00 H TER 51933 WAT 5563 ATOM 51933 O WAT 5564 40.316 122.421 110.062 1.00 0.00 O ATOM 51934 H1 WAT 5564 40.786 121.592 109.977 1.00 0.00 H ATOM 51935 H2 WAT 5564 40.472 122.694 110.966 1.00 0.00 H TER 51937 WAT 5564 ATOM 51937 O WAT 5565 109.316 29.133 108.211 1.00 0.00 O ATOM 51938 H1 WAT 5565 109.758 28.484 108.758 1.00 0.00 H ATOM 51939 H2 WAT 5565 108.620 28.643 107.774 1.00 0.00 H TER 51941 WAT 5565 ATOM 51941 O WAT 5566 25.398 71.828 134.408 1.00 0.00 O ATOM 51942 H1 WAT 5566 26.131 71.683 135.007 1.00 0.00 H ATOM 51943 H2 WAT 5566 24.619 71.736 134.956 1.00 0.00 H TER 51945 WAT 5566 ATOM 51945 O WAT 5567 123.822 100.245 63.078 1.00 0.00 O ATOM 51946 H1 WAT 5567 122.945 100.077 62.734 1.00 0.00 H ATOM 51947 H2 WAT 5567 124.287 99.417 62.962 1.00 0.00 H TER 51949 WAT 5567 ATOM 51949 O WAT 5568 0.382 6.651 134.601 1.00 0.00 O ATOM 51950 H1 WAT 5568 1.025 7.329 134.811 1.00 0.00 H ATOM 51951 H2 WAT 5568 0.323 6.664 133.646 1.00 0.00 H TER 51953 WAT 5568 ATOM 51953 O WAT 5569 86.853 87.827 156.600 1.00 0.00 O ATOM 51954 H1 WAT 5569 87.274 87.237 155.975 1.00 0.00 H ATOM 51955 H2 WAT 5569 86.801 87.320 157.410 1.00 0.00 H TER 51957 WAT 5569 ATOM 51957 O WAT 5570 88.800 99.600 126.408 1.00 0.00 O ATOM 51958 H1 WAT 5570 89.434 98.928 126.659 1.00 0.00 H ATOM 51959 H2 WAT 5570 89.204 100.424 126.679 1.00 0.00 H TER 51961 WAT 5570 ATOM 51961 O WAT 5571 20.788 39.922 56.977 1.00 0.00 O ATOM 51962 H1 WAT 5571 20.718 39.729 57.912 1.00 0.00 H ATOM 51963 H2 WAT 5571 20.347 39.189 56.548 1.00 0.00 H TER 51965 WAT 5571 ATOM 51965 O WAT 5572 91.445 99.654 118.725 1.00 0.00 O ATOM 51966 H1 WAT 5572 91.080 98.808 118.984 1.00 0.00 H ATOM 51967 H2 WAT 5572 92.374 99.480 118.577 1.00 0.00 H TER 51969 WAT 5572 ATOM 51969 O WAT 5573 88.373 89.496 17.682 1.00 0.00 O ATOM 51970 H1 WAT 5573 87.797 90.220 17.437 1.00 0.00 H ATOM 51971 H2 WAT 5573 88.806 89.794 18.481 1.00 0.00 H TER 51973 WAT 5573 ATOM 51973 O WAT 5574 56.794 47.446 64.569 1.00 0.00 O ATOM 51974 H1 WAT 5574 55.895 47.608 64.281 1.00 0.00 H ATOM 51975 H2 WAT 5574 57.302 48.155 64.176 1.00 0.00 H TER 51977 WAT 5574 ATOM 51977 O WAT 5575 107.608 24.854 22.121 1.00 0.00 O ATOM 51978 H1 WAT 5575 106.949 25.105 21.474 1.00 0.00 H ATOM 51979 H2 WAT 5575 107.293 25.231 22.943 1.00 0.00 H TER 51981 WAT 5575 ATOM 51981 O WAT 5576 142.852 63.092 142.655 1.00 0.00 O ATOM 51982 H1 WAT 5576 143.025 62.253 143.081 1.00 0.00 H ATOM 51983 H2 WAT 5576 142.694 63.699 143.378 1.00 0.00 H TER 51985 WAT 5576 ATOM 51985 O WAT 5577 16.195 137.233 115.099 1.00 0.00 O ATOM 51986 H1 WAT 5577 16.380 136.439 115.601 1.00 0.00 H ATOM 51987 H2 WAT 5577 16.991 137.384 114.589 1.00 0.00 H TER 51989 WAT 5577 ATOM 51989 O WAT 5578 69.383 82.302 19.948 1.00 0.00 O ATOM 51990 H1 WAT 5578 69.845 81.593 19.500 1.00 0.00 H ATOM 51991 H2 WAT 5578 68.931 81.873 20.674 1.00 0.00 H TER 51993 WAT 5578 ATOM 51993 O WAT 5579 122.040 37.440 79.469 1.00 0.00 O ATOM 51994 H1 WAT 5579 121.444 36.691 79.480 1.00 0.00 H ATOM 51995 H2 WAT 5579 122.757 37.168 78.896 1.00 0.00 H TER 51997 WAT 5579 ATOM 51997 O WAT 5580 133.115 9.152 103.384 1.00 0.00 O ATOM 51998 H1 WAT 5580 133.146 9.575 104.243 1.00 0.00 H ATOM 51999 H2 WAT 5580 132.182 9.097 103.178 1.00 0.00 H TER 52001 WAT 5580 ATOM 52001 O WAT 5581 73.275 3.074 138.846 1.00 0.00 O ATOM 52002 H1 WAT 5581 72.836 2.284 138.532 1.00 0.00 H ATOM 52003 H2 WAT 5581 73.905 2.756 139.494 1.00 0.00 H TER 52005 WAT 5581 ATOM 52005 O WAT 5582 52.537 104.826 155.942 1.00 0.00 O ATOM 52006 H1 WAT 5582 52.991 104.771 156.783 1.00 0.00 H ATOM 52007 H2 WAT 5582 53.230 105.002 155.307 1.00 0.00 H TER 52009 WAT 5582 ATOM 52009 O WAT 5583 134.857 105.879 148.131 1.00 0.00 O ATOM 52010 H1 WAT 5583 133.912 105.755 148.210 1.00 0.00 H ATOM 52011 H2 WAT 5583 135.058 106.586 148.744 1.00 0.00 H TER 52013 WAT 5583 ATOM 52013 O WAT 5584 22.248 105.074 127.934 1.00 0.00 O ATOM 52014 H1 WAT 5584 22.250 104.753 128.836 1.00 0.00 H ATOM 52015 H2 WAT 5584 22.158 104.285 127.400 1.00 0.00 H TER 52017 WAT 5584 ATOM 52017 O WAT 5585 61.562 36.938 60.357 1.00 0.00 O ATOM 52018 H1 WAT 5585 62.065 36.908 59.543 1.00 0.00 H ATOM 52019 H2 WAT 5585 60.674 37.163 60.082 1.00 0.00 H TER 52021 WAT 5585 ATOM 52021 O WAT 5586 141.300 31.721 91.738 1.00 0.00 O ATOM 52022 H1 WAT 5586 140.528 31.161 91.825 1.00 0.00 H ATOM 52023 H2 WAT 5586 141.682 31.472 90.896 1.00 0.00 H TER 52025 WAT 5586 ATOM 52025 O WAT 5587 22.043 141.842 61.976 1.00 0.00 O ATOM 52026 H1 WAT 5587 22.979 141.654 61.899 1.00 0.00 H ATOM 52027 H2 WAT 5587 21.703 141.732 61.088 1.00 0.00 H TER 52029 WAT 5587 ATOM 52029 O WAT 5588 106.134 120.362 119.212 1.00 0.00 O ATOM 52030 H1 WAT 5588 106.585 119.911 118.498 1.00 0.00 H ATOM 52031 H2 WAT 5588 105.635 121.055 118.780 1.00 0.00 H TER 52033 WAT 5588 ATOM 52033 O WAT 5589 26.748 3.026 129.095 1.00 0.00 O ATOM 52034 H1 WAT 5589 26.612 3.656 129.803 1.00 0.00 H ATOM 52035 H2 WAT 5589 26.646 3.539 128.294 1.00 0.00 H TER 52037 WAT 5589 ATOM 52037 O WAT 5590 113.610 112.116 82.185 1.00 0.00 O ATOM 52038 H1 WAT 5590 112.860 112.256 81.607 1.00 0.00 H ATOM 52039 H2 WAT 5590 113.655 111.166 82.294 1.00 0.00 H TER 52041 WAT 5590 ATOM 52041 O WAT 5591 73.036 95.624 15.663 1.00 0.00 O ATOM 52042 H1 WAT 5591 72.606 95.272 14.883 1.00 0.00 H ATOM 52043 H2 WAT 5591 72.321 95.783 16.279 1.00 0.00 H TER 52045 WAT 5591 ATOM 52045 O WAT 5592 61.614 121.761 117.421 1.00 0.00 O ATOM 52046 H1 WAT 5592 61.419 120.835 117.560 1.00 0.00 H ATOM 52047 H2 WAT 5592 62.250 121.767 116.706 1.00 0.00 H TER 52049 WAT 5592 ATOM 52049 O WAT 5593 102.212 25.573 101.309 1.00 0.00 O ATOM 52050 H1 WAT 5593 102.230 25.868 100.398 1.00 0.00 H ATOM 52051 H2 WAT 5593 102.910 24.921 101.364 1.00 0.00 H TER 52053 WAT 5593 ATOM 52053 O WAT 5594 95.982 54.724 90.668 1.00 0.00 O ATOM 52054 H1 WAT 5594 95.367 55.361 91.032 1.00 0.00 H ATOM 52055 H2 WAT 5594 95.748 54.668 89.742 1.00 0.00 H TER 52057 WAT 5594 ATOM 52057 O WAT 5595 48.473 99.077 75.668 1.00 0.00 O ATOM 52058 H1 WAT 5595 48.163 99.217 74.773 1.00 0.00 H ATOM 52059 H2 WAT 5595 47.674 98.996 76.188 1.00 0.00 H TER 52061 WAT 5595 ATOM 52061 O WAT 5596 134.457 130.821 71.231 1.00 0.00 O ATOM 52062 H1 WAT 5596 134.385 131.724 70.923 1.00 0.00 H ATOM 52063 H2 WAT 5596 133.743 130.725 71.862 1.00 0.00 H TER 52065 WAT 5596 ATOM 52065 O WAT 5597 54.345 133.027 6.838 1.00 0.00 O ATOM 52066 H1 WAT 5597 53.764 132.390 7.253 1.00 0.00 H ATOM 52067 H2 WAT 5597 55.225 132.683 6.991 1.00 0.00 H TER 52069 WAT 5597 ATOM 52069 O WAT 5598 126.513 115.816 80.298 1.00 0.00 O ATOM 52070 H1 WAT 5598 126.990 115.952 79.480 1.00 0.00 H ATOM 52071 H2 WAT 5598 127.178 115.515 80.917 1.00 0.00 H TER 52073 WAT 5598 ATOM 52073 O WAT 5599 125.525 48.785 100.236 1.00 0.00 O ATOM 52074 H1 WAT 5599 125.803 49.286 101.002 1.00 0.00 H ATOM 52075 H2 WAT 5599 124.611 48.562 100.413 1.00 0.00 H TER 52077 WAT 5599 ATOM 52077 O WAT 5600 114.924 38.450 128.097 1.00 0.00 O ATOM 52078 H1 WAT 5600 114.653 39.105 128.741 1.00 0.00 H ATOM 52079 H2 WAT 5600 115.879 38.430 128.164 1.00 0.00 H TER 52081 WAT 5600 ATOM 52081 O WAT 5601 9.585 84.681 80.288 1.00 0.00 O ATOM 52082 H1 WAT 5601 9.698 84.174 81.092 1.00 0.00 H ATOM 52083 H2 WAT 5601 8.883 84.232 79.818 1.00 0.00 H TER 52085 WAT 5601 ATOM 52085 O WAT 5602 85.244 46.044 1.711 1.00 0.00 O ATOM 52086 H1 WAT 5602 86.033 45.789 1.232 1.00 0.00 H ATOM 52087 H2 WAT 5602 85.439 46.920 2.044 1.00 0.00 H TER 52089 WAT 5602 ATOM 52089 O WAT 5603 55.070 62.060 5.232 1.00 0.00 O ATOM 52090 H1 WAT 5603 54.635 62.859 4.936 1.00 0.00 H ATOM 52091 H2 WAT 5603 54.368 61.530 5.609 1.00 0.00 H TER 52093 WAT 5603 ATOM 52093 O WAT 5604 63.655 116.655 91.494 1.00 0.00 O ATOM 52094 H1 WAT 5604 64.605 116.763 91.443 1.00 0.00 H ATOM 52095 H2 WAT 5604 63.530 115.912 92.084 1.00 0.00 H TER 52097 WAT 5604 ATOM 52097 O WAT 5605 11.353 113.329 83.937 1.00 0.00 O ATOM 52098 H1 WAT 5605 11.979 113.105 83.248 1.00 0.00 H ATOM 52099 H2 WAT 5605 10.896 114.102 83.603 1.00 0.00 H TER 52101 WAT 5605 ATOM 52101 O WAT 5606 135.809 95.102 23.819 1.00 0.00 O ATOM 52102 H1 WAT 5606 136.091 94.258 24.174 1.00 0.00 H ATOM 52103 H2 WAT 5606 136.237 95.157 22.965 1.00 0.00 H TER 52105 WAT 5606 ATOM 52105 O WAT 5607 51.079 66.455 19.488 1.00 0.00 O ATOM 52106 H1 WAT 5607 51.182 65.516 19.333 1.00 0.00 H ATOM 52107 H2 WAT 5607 51.055 66.841 18.612 1.00 0.00 H TER 52109 WAT 5607 ATOM 52109 O WAT 5608 49.072 4.152 134.804 1.00 0.00 O ATOM 52110 H1 WAT 5608 49.658 3.421 134.606 1.00 0.00 H ATOM 52111 H2 WAT 5608 48.649 3.903 135.626 1.00 0.00 H TER 52113 WAT 5608 ATOM 52113 O WAT 5609 12.432 45.825 129.245 1.00 0.00 O ATOM 52114 H1 WAT 5609 12.563 46.409 128.497 1.00 0.00 H ATOM 52115 H2 WAT 5609 12.449 46.404 130.007 1.00 0.00 H TER 52117 WAT 5609 ATOM 52117 O WAT 5610 8.619 130.471 143.990 1.00 0.00 O ATOM 52118 H1 WAT 5610 9.001 131.347 143.935 1.00 0.00 H ATOM 52119 H2 WAT 5610 7.686 130.606 143.821 1.00 0.00 H TER 52121 WAT 5610 ATOM 52121 O WAT 5611 4.243 114.911 7.155 1.00 0.00 O ATOM 52122 H1 WAT 5611 3.584 115.045 7.837 1.00 0.00 H ATOM 52123 H2 WAT 5611 4.907 115.577 7.330 1.00 0.00 H TER 52125 WAT 5611 ATOM 52125 O WAT 5612 104.940 141.643 103.086 1.00 0.00 O ATOM 52126 H1 WAT 5612 104.658 141.036 102.401 1.00 0.00 H ATOM 52127 H2 WAT 5612 104.159 142.161 103.282 1.00 0.00 H TER 52129 WAT 5612 ATOM 52129 O WAT 5613 102.852 46.582 69.489 1.00 0.00 O ATOM 52130 H1 WAT 5613 103.113 46.309 68.609 1.00 0.00 H ATOM 52131 H2 WAT 5613 102.767 47.534 69.429 1.00 0.00 H TER 52133 WAT 5613 ATOM 52133 O WAT 5614 71.768 17.001 15.039 1.00 0.00 O ATOM 52134 H1 WAT 5614 72.674 17.303 14.979 1.00 0.00 H ATOM 52135 H2 WAT 5614 71.385 17.530 15.739 1.00 0.00 H TER 52137 WAT 5614 ATOM 52137 O WAT 5615 51.257 13.276 147.563 1.00 0.00 O ATOM 52138 H1 WAT 5615 51.678 12.786 146.857 1.00 0.00 H ATOM 52139 H2 WAT 5615 50.526 13.727 147.140 1.00 0.00 H TER 52141 WAT 5615 ATOM 52141 O WAT 5616 61.078 106.802 143.828 1.00 0.00 O ATOM 52142 H1 WAT 5616 60.843 106.634 144.740 1.00 0.00 H ATOM 52143 H2 WAT 5616 60.251 107.034 143.405 1.00 0.00 H TER 52145 WAT 5616 ATOM 52145 O WAT 5617 4.228 104.992 103.126 1.00 0.00 O ATOM 52146 H1 WAT 5617 4.103 105.497 102.323 1.00 0.00 H ATOM 52147 H2 WAT 5617 3.970 105.589 103.828 1.00 0.00 H TER 52149 WAT 5617 ATOM 52149 O WAT 5618 65.421 38.359 23.209 1.00 0.00 O ATOM 52150 H1 WAT 5618 65.779 37.679 23.779 1.00 0.00 H ATOM 52151 H2 WAT 5618 65.833 39.168 23.513 1.00 0.00 H TER 52153 WAT 5618 ATOM 52153 O WAT 5619 86.579 47.462 83.311 1.00 0.00 O ATOM 52154 H1 WAT 5619 86.304 47.812 84.158 1.00 0.00 H ATOM 52155 H2 WAT 5619 87.364 46.950 83.508 1.00 0.00 H TER 52157 WAT 5619 ATOM 52157 O WAT 5620 70.920 18.246 12.872 1.00 0.00 O ATOM 52158 H1 WAT 5620 70.416 17.685 12.283 1.00 0.00 H ATOM 52159 H2 WAT 5620 71.178 17.669 13.590 1.00 0.00 H TER 52161 WAT 5620 ATOM 52161 O WAT 5621 38.759 135.422 67.443 1.00 0.00 O ATOM 52162 H1 WAT 5621 38.581 134.663 66.887 1.00 0.00 H ATOM 52163 H2 WAT 5621 39.231 136.030 66.874 1.00 0.00 H TER 52165 WAT 5621 ATOM 52165 O WAT 5622 71.333 11.569 23.942 1.00 0.00 O ATOM 52166 H1 WAT 5622 71.613 12.197 24.608 1.00 0.00 H ATOM 52167 H2 WAT 5622 70.444 11.325 24.201 1.00 0.00 H TER 52169 WAT 5622 ATOM 52169 O WAT 5623 21.563 26.961 23.494 1.00 0.00 O ATOM 52170 H1 WAT 5623 20.712 26.523 23.472 1.00 0.00 H ATOM 52171 H2 WAT 5623 22.041 26.592 22.750 1.00 0.00 H TER 52173 WAT 5623 ATOM 52173 O WAT 5624 94.808 119.327 146.482 1.00 0.00 O ATOM 52174 H1 WAT 5624 94.440 119.308 145.599 1.00 0.00 H ATOM 52175 H2 WAT 5624 94.386 120.076 146.903 1.00 0.00 H TER 52177 WAT 5624 ATOM 52177 O WAT 5625 37.805 43.358 18.555 1.00 0.00 O ATOM 52178 H1 WAT 5625 38.555 43.228 19.135 1.00 0.00 H ATOM 52179 H2 WAT 5625 37.493 42.474 18.365 1.00 0.00 H TER 52181 WAT 5625 ATOM 52181 O WAT 5626 13.472 70.016 2.063 1.00 0.00 O ATOM 52182 H1 WAT 5626 14.057 69.336 1.729 1.00 0.00 H ATOM 52183 H2 WAT 5626 13.692 70.087 2.992 1.00 0.00 H TER 52185 WAT 5626 ATOM 52185 O WAT 5627 114.334 61.850 99.011 1.00 0.00 O ATOM 52186 H1 WAT 5627 114.071 61.671 98.108 1.00 0.00 H ATOM 52187 H2 WAT 5627 115.262 61.618 99.040 1.00 0.00 H TER 52189 WAT 5627 ATOM 52189 O WAT 5628 56.917 19.762 6.321 1.00 0.00 O ATOM 52190 H1 WAT 5628 57.738 19.562 6.770 1.00 0.00 H ATOM 52191 H2 WAT 5628 56.255 19.258 6.796 1.00 0.00 H TER 52193 WAT 5628 ATOM 52193 O WAT 5629 51.293 13.212 54.809 1.00 0.00 O ATOM 52194 H1 WAT 5629 50.853 14.001 55.125 1.00 0.00 H ATOM 52195 H2 WAT 5629 51.737 13.491 54.008 1.00 0.00 H TER 52197 WAT 5629 ATOM 52197 O WAT 5630 18.016 31.835 6.028 1.00 0.00 O ATOM 52198 H1 WAT 5630 18.279 31.084 5.496 1.00 0.00 H ATOM 52199 H2 WAT 5630 17.354 32.282 5.501 1.00 0.00 H TER 52201 WAT 5630 ATOM 52201 O WAT 5631 143.567 30.425 15.227 1.00 0.00 O ATOM 52202 H1 WAT 5631 143.873 30.027 16.042 1.00 0.00 H ATOM 52203 H2 WAT 5631 144.368 30.664 14.762 1.00 0.00 H TER 52205 WAT 5631 ATOM 52205 O WAT 5632 22.228 111.939 99.008 1.00 0.00 O ATOM 52206 H1 WAT 5632 22.094 111.896 98.061 1.00 0.00 H ATOM 52207 H2 WAT 5632 23.170 111.818 99.122 1.00 0.00 H TER 52209 WAT 5632 ATOM 52209 O WAT 5633 63.497 142.190 108.531 1.00 0.00 O ATOM 52210 H1 WAT 5633 64.066 142.854 108.919 1.00 0.00 H ATOM 52211 H2 WAT 5633 62.615 142.555 108.607 1.00 0.00 H TER 52213 WAT 5633 ATOM 52213 O WAT 5634 74.249 110.007 57.966 1.00 0.00 O ATOM 52214 H1 WAT 5634 74.710 110.734 57.549 1.00 0.00 H ATOM 52215 H2 WAT 5634 73.383 110.006 57.558 1.00 0.00 H TER 52217 WAT 5634 ATOM 52217 O WAT 5635 45.026 134.050 68.310 1.00 0.00 O ATOM 52218 H1 WAT 5635 44.086 134.168 68.168 1.00 0.00 H ATOM 52219 H2 WAT 5635 45.233 134.635 69.038 1.00 0.00 H TER 52221 WAT 5635 ATOM 52221 O WAT 5636 21.275 1.786 132.944 1.00 0.00 O ATOM 52222 H1 WAT 5636 21.475 1.751 133.880 1.00 0.00 H ATOM 52223 H2 WAT 5636 22.056 2.171 132.546 1.00 0.00 H TER 52225 WAT 5636 ATOM 52225 O WAT 5637 25.054 80.277 21.228 1.00 0.00 O ATOM 52226 H1 WAT 5637 25.492 79.743 20.565 1.00 0.00 H ATOM 52227 H2 WAT 5637 24.210 80.500 20.837 1.00 0.00 H TER 52229 WAT 5637 ATOM 52229 O WAT 5638 85.768 106.737 74.647 1.00 0.00 O ATOM 52230 H1 WAT 5638 85.278 107.383 74.139 1.00 0.00 H ATOM 52231 H2 WAT 5638 86.093 106.115 73.996 1.00 0.00 H TER 52233 WAT 5638 ATOM 52233 O WAT 5639 78.057 132.103 57.538 1.00 0.00 O ATOM 52234 H1 WAT 5639 77.465 131.467 57.136 1.00 0.00 H ATOM 52235 H2 WAT 5639 78.873 131.621 57.669 1.00 0.00 H TER 52237 WAT 5639 ATOM 52237 O WAT 5640 56.965 19.102 1.446 1.00 0.00 O ATOM 52238 H1 WAT 5640 57.618 18.449 1.701 1.00 0.00 H ATOM 52239 H2 WAT 5640 57.219 19.893 1.922 1.00 0.00 H TER 52241 WAT 5640 ATOM 52241 O WAT 5641 41.766 36.892 69.291 1.00 0.00 O ATOM 52242 H1 WAT 5641 41.910 37.260 70.163 1.00 0.00 H ATOM 52243 H2 WAT 5641 41.765 35.944 69.429 1.00 0.00 H TER 52245 WAT 5641 ATOM 52245 O WAT 5642 128.741 99.787 84.660 1.00 0.00 O ATOM 52246 H1 WAT 5642 129.435 99.199 84.958 1.00 0.00 H ATOM 52247 H2 WAT 5642 128.706 99.656 83.713 1.00 0.00 H TER 52249 WAT 5642 ATOM 52249 O WAT 5643 92.731 100.660 5.421 1.00 0.00 O ATOM 52250 H1 WAT 5643 92.185 101.027 4.727 1.00 0.00 H ATOM 52251 H2 WAT 5643 93.524 100.367 4.972 1.00 0.00 H TER 52253 WAT 5643 ATOM 52253 O WAT 5644 80.648 16.389 113.787 1.00 0.00 O ATOM 52254 H1 WAT 5644 80.229 15.529 113.822 1.00 0.00 H ATOM 52255 H2 WAT 5644 80.159 16.921 114.414 1.00 0.00 H TER 52257 WAT 5644 ATOM 52257 O WAT 5645 136.269 54.857 18.859 1.00 0.00 O ATOM 52258 H1 WAT 5645 136.081 55.330 19.670 1.00 0.00 H ATOM 52259 H2 WAT 5645 136.015 53.953 19.045 1.00 0.00 H TER 52261 WAT 5645 ATOM 52261 O WAT 5646 29.790 97.853 10.526 1.00 0.00 O ATOM 52262 H1 WAT 5646 30.439 97.251 10.890 1.00 0.00 H ATOM 52263 H2 WAT 5646 29.421 97.384 9.778 1.00 0.00 H TER 52265 WAT 5646 ATOM 52265 O WAT 5647 140.547 105.946 61.321 1.00 0.00 O ATOM 52266 H1 WAT 5647 140.718 105.783 60.393 1.00 0.00 H ATOM 52267 H2 WAT 5647 140.851 106.841 61.467 1.00 0.00 H TER 52269 WAT 5647 ATOM 52269 O WAT 5648 97.712 124.737 103.251 1.00 0.00 O ATOM 52270 H1 WAT 5648 97.140 125.184 103.875 1.00 0.00 H ATOM 52271 H2 WAT 5648 97.969 123.930 103.698 1.00 0.00 H TER 52273 WAT 5648 ATOM 52273 O WAT 5649 4.137 73.880 12.595 1.00 0.00 O ATOM 52274 H1 WAT 5649 4.853 74.060 13.205 1.00 0.00 H ATOM 52275 H2 WAT 5649 3.977 74.717 12.160 1.00 0.00 H TER 52277 WAT 5649 ATOM 52277 O WAT 5650 83.817 49.952 2.177 1.00 0.00 O ATOM 52278 H1 WAT 5650 83.849 50.294 3.071 1.00 0.00 H ATOM 52279 H2 WAT 5650 82.883 49.901 1.974 1.00 0.00 H TER 52281 WAT 5650 ATOM 52281 O WAT 5651 99.692 39.920 9.745 1.00 0.00 O ATOM 52282 H1 WAT 5651 100.005 40.436 9.002 1.00 0.00 H ATOM 52283 H2 WAT 5651 100.486 39.549 10.130 1.00 0.00 H TER 52285 WAT 5651 ATOM 52285 O WAT 5652 127.564 107.240 112.486 1.00 0.00 O ATOM 52286 H1 WAT 5652 127.010 107.738 111.883 1.00 0.00 H ATOM 52287 H2 WAT 5652 128.202 107.877 112.806 1.00 0.00 H TER 52289 WAT 5652 ATOM 52289 O WAT 5653 115.894 55.329 63.676 1.00 0.00 O ATOM 52290 H1 WAT 5653 115.687 55.698 64.535 1.00 0.00 H ATOM 52291 H2 WAT 5653 116.290 54.479 63.869 1.00 0.00 H TER 52293 WAT 5653 ATOM 52293 O WAT 5654 31.058 47.185 62.557 1.00 0.00 O ATOM 52294 H1 WAT 5654 30.625 48.030 62.684 1.00 0.00 H ATOM 52295 H2 WAT 5654 31.832 47.389 62.032 1.00 0.00 H TER 52297 WAT 5654 ATOM 52297 O WAT 5655 21.555 73.246 156.191 1.00 0.00 O ATOM 52298 H1 WAT 5655 22.278 73.087 155.584 1.00 0.00 H ATOM 52299 H2 WAT 5655 21.867 73.953 156.756 1.00 0.00 H TER 52301 WAT 5655 ATOM 52301 O WAT 5656 144.443 13.792 75.863 1.00 0.00 O ATOM 52302 H1 WAT 5656 145.178 14.396 75.756 1.00 0.00 H ATOM 52303 H2 WAT 5656 143.666 14.332 75.720 1.00 0.00 H TER 52305 WAT 5656 ATOM 52305 O WAT 5657 34.489 29.609 80.989 1.00 0.00 O ATOM 52306 H1 WAT 5657 35.301 30.038 81.260 1.00 0.00 H ATOM 52307 H2 WAT 5657 33.853 30.322 80.922 1.00 0.00 H TER 52309 WAT 5657 ATOM 52309 O WAT 5658 97.520 125.779 78.713 1.00 0.00 O ATOM 52310 H1 WAT 5658 97.577 126.673 79.049 1.00 0.00 H ATOM 52311 H2 WAT 5658 97.818 125.231 79.440 1.00 0.00 H TER 52313 WAT 5658 ATOM 52313 O WAT 5659 49.950 15.888 54.867 1.00 0.00 O ATOM 52314 H1 WAT 5659 50.686 16.466 54.665 1.00 0.00 H ATOM 52315 H2 WAT 5659 49.660 15.563 54.015 1.00 0.00 H TER 52317 WAT 5659 ATOM 52317 O WAT 5660 114.288 106.615 98.549 1.00 0.00 O ATOM 52318 H1 WAT 5660 113.720 106.244 99.224 1.00 0.00 H ATOM 52319 H2 WAT 5660 114.824 105.879 98.256 1.00 0.00 H TER 52321 WAT 5660 ATOM 52321 O WAT 5661 20.219 107.920 96.713 1.00 0.00 O ATOM 52322 H1 WAT 5661 20.728 107.718 95.927 1.00 0.00 H ATOM 52323 H2 WAT 5661 20.281 108.871 96.801 1.00 0.00 H TER 52325 WAT 5661 ATOM 52325 O WAT 5662 0.983 56.090 90.428 1.00 0.00 O ATOM 52326 H1 WAT 5662 0.993 55.908 91.367 1.00 0.00 H ATOM 52327 H2 WAT 5662 1.058 55.230 90.016 1.00 0.00 H TER 52329 WAT 5662 ATOM 52329 O WAT 5663 61.887 30.117 84.510 1.00 0.00 O ATOM 52330 H1 WAT 5663 62.408 30.726 85.032 1.00 0.00 H ATOM 52331 H2 WAT 5663 61.974 29.277 84.962 1.00 0.00 H TER 52333 WAT 5663 ATOM 52333 O WAT 5664 103.018 98.447 123.506 1.00 0.00 O ATOM 52334 H1 WAT 5664 103.678 98.712 122.864 1.00 0.00 H ATOM 52335 H2 WAT 5664 102.573 99.261 123.742 1.00 0.00 H TER 52337 WAT 5664 ATOM 52337 O WAT 5665 45.316 30.432 113.001 1.00 0.00 O ATOM 52338 H1 WAT 5665 44.770 29.654 113.120 1.00 0.00 H ATOM 52339 H2 WAT 5665 45.867 30.226 112.247 1.00 0.00 H TER 52341 WAT 5665 ATOM 52341 O WAT 5666 30.717 36.401 76.044 1.00 0.00 O ATOM 52342 H1 WAT 5666 30.096 36.837 75.461 1.00 0.00 H ATOM 52343 H2 WAT 5666 30.830 35.529 75.665 1.00 0.00 H TER 52345 WAT 5666 ATOM 52345 O WAT 5667 75.671 142.500 21.738 1.00 0.00 O ATOM 52346 H1 WAT 5667 75.814 141.624 21.378 1.00 0.00 H ATOM 52347 H2 WAT 5667 74.797 142.459 22.126 1.00 0.00 H TER 52349 WAT 5667 ATOM 52349 O WAT 5668 99.954 83.283 154.236 1.00 0.00 O ATOM 52350 H1 WAT 5668 100.662 83.024 153.646 1.00 0.00 H ATOM 52351 H2 WAT 5668 99.968 84.240 154.220 1.00 0.00 H TER 52353 WAT 5668 ATOM 52353 O WAT 5669 50.099 130.193 108.574 1.00 0.00 O ATOM 52354 H1 WAT 5669 50.784 130.681 109.032 1.00 0.00 H ATOM 52355 H2 WAT 5669 49.801 130.788 107.886 1.00 0.00 H TER 52357 WAT 5669 ATOM 52357 O WAT 5670 95.252 76.159 19.061 1.00 0.00 O ATOM 52358 H1 WAT 5670 95.703 76.106 18.219 1.00 0.00 H ATOM 52359 H2 WAT 5670 94.439 76.627 18.869 1.00 0.00 H TER 52361 WAT 5670 ATOM 52361 O WAT 5671 43.838 39.811 98.084 1.00 0.00 O ATOM 52362 H1 WAT 5671 43.705 40.343 97.299 1.00 0.00 H ATOM 52363 H2 WAT 5671 43.478 38.954 97.856 1.00 0.00 H TER 52365 WAT 5671 ATOM 52365 O WAT 5672 128.402 83.441 122.008 1.00 0.00 O ATOM 52366 H1 WAT 5672 127.948 84.246 122.258 1.00 0.00 H ATOM 52367 H2 WAT 5672 128.818 83.651 121.172 1.00 0.00 H TER 52369 WAT 5672 ATOM 52369 O WAT 5673 58.078 73.777 74.688 1.00 0.00 O ATOM 52370 H1 WAT 5673 58.585 73.305 74.028 1.00 0.00 H ATOM 52371 H2 WAT 5673 57.454 73.130 75.019 1.00 0.00 H TER 52373 WAT 5673 ATOM 52373 O WAT 5674 83.662 103.729 105.150 1.00 0.00 O ATOM 52374 H1 WAT 5674 83.785 103.676 106.097 1.00 0.00 H ATOM 52375 H2 WAT 5674 83.923 102.867 104.826 1.00 0.00 H TER 52377 WAT 5674 ATOM 52377 O WAT 5675 125.621 61.917 20.702 1.00 0.00 O ATOM 52378 H1 WAT 5675 125.772 62.698 21.233 1.00 0.00 H ATOM 52379 H2 WAT 5675 125.950 61.195 21.239 1.00 0.00 H TER 52381 WAT 5675 ATOM 52381 O WAT 5676 72.249 30.317 8.868 1.00 0.00 O ATOM 52382 H1 WAT 5676 72.434 30.781 9.684 1.00 0.00 H ATOM 52383 H2 WAT 5676 73.107 30.034 8.553 1.00 0.00 H TER 52385 WAT 5676 ATOM 52385 O WAT 5677 59.360 45.165 152.593 1.00 0.00 O ATOM 52386 H1 WAT 5677 58.420 44.995 152.535 1.00 0.00 H ATOM 52387 H2 WAT 5677 59.767 44.397 152.191 1.00 0.00 H TER 52389 WAT 5677 ATOM 52389 O WAT 5678 54.937 104.371 97.855 1.00 0.00 O ATOM 52390 H1 WAT 5678 55.104 103.440 97.999 1.00 0.00 H ATOM 52391 H2 WAT 5678 55.738 104.806 98.147 1.00 0.00 H TER 52393 WAT 5678 ATOM 52393 O WAT 5679 71.594 35.738 69.747 1.00 0.00 O ATOM 52394 H1 WAT 5679 72.125 35.293 70.407 1.00 0.00 H ATOM 52395 H2 WAT 5679 72.231 36.101 69.132 1.00 0.00 H TER 52397 WAT 5679 ATOM 52397 O WAT 5680 91.377 50.779 11.477 1.00 0.00 O ATOM 52398 H1 WAT 5680 91.523 51.424 10.785 1.00 0.00 H ATOM 52399 H2 WAT 5680 90.538 50.375 11.253 1.00 0.00 H TER 52401 WAT 5680 ATOM 52401 O WAT 5681 79.189 115.857 142.674 1.00 0.00 O ATOM 52402 H1 WAT 5681 79.051 115.613 143.589 1.00 0.00 H ATOM 52403 H2 WAT 5681 80.008 115.425 142.432 1.00 0.00 H TER 52405 WAT 5681 ATOM 52405 O WAT 5682 141.457 56.662 8.413 1.00 0.00 O ATOM 52406 H1 WAT 5682 141.053 56.978 7.605 1.00 0.00 H ATOM 52407 H2 WAT 5682 142.302 56.307 8.136 1.00 0.00 H TER 52409 WAT 5682 ATOM 52409 O WAT 5683 110.494 144.520 110.430 1.00 0.00 O ATOM 52410 H1 WAT 5683 111.235 145.090 110.634 1.00 0.00 H ATOM 52411 H2 WAT 5683 110.533 143.830 111.092 1.00 0.00 H TER 52413 WAT 5683 ATOM 52413 O WAT 5684 138.464 18.846 73.038 1.00 0.00 O ATOM 52414 H1 WAT 5684 139.281 18.457 72.728 1.00 0.00 H ATOM 52415 H2 WAT 5684 138.128 18.220 73.679 1.00 0.00 H TER 52417 WAT 5684 ATOM 52417 O WAT 5685 138.391 26.026 140.973 1.00 0.00 O ATOM 52418 H1 WAT 5685 137.452 26.101 141.144 1.00 0.00 H ATOM 52419 H2 WAT 5685 138.462 26.034 140.018 1.00 0.00 H TER 52421 WAT 5685 ATOM 52421 O WAT 5686 80.141 121.677 1.281 1.00 0.00 O ATOM 52422 H1 WAT 5686 80.435 121.507 0.386 1.00 0.00 H ATOM 52423 H2 WAT 5686 79.359 122.219 1.176 1.00 0.00 H TER 52425 WAT 5686 ATOM 52425 O WAT 5687 36.861 11.927 15.535 1.00 0.00 O ATOM 52426 H1 WAT 5687 37.260 12.756 15.800 1.00 0.00 H ATOM 52427 H2 WAT 5687 36.338 12.149 14.764 1.00 0.00 H TER 52429 WAT 5687 ATOM 52429 O WAT 5688 107.543 25.372 121.978 1.00 0.00 O ATOM 52430 H1 WAT 5688 107.072 26.117 122.350 1.00 0.00 H ATOM 52431 H2 WAT 5688 107.335 24.642 122.560 1.00 0.00 H TER 52433 WAT 5688 ATOM 52433 O WAT 5689 138.850 13.851 73.252 1.00 0.00 O ATOM 52434 H1 WAT 5689 138.307 13.982 74.029 1.00 0.00 H ATOM 52435 H2 WAT 5689 138.575 13.001 72.908 1.00 0.00 H TER 52437 WAT 5689 ATOM 52437 O WAT 5690 60.824 130.891 0.596 1.00 0.00 O ATOM 52438 H1 WAT 5690 60.422 130.329 -0.067 1.00 0.00 H ATOM 52439 H2 WAT 5690 61.305 131.549 0.092 1.00 0.00 H TER 52441 WAT 5690 ATOM 52441 O WAT 5691 132.059 25.859 88.567 1.00 0.00 O ATOM 52442 H1 WAT 5691 132.692 25.373 89.096 1.00 0.00 H ATOM 52443 H2 WAT 5691 131.566 26.379 89.202 1.00 0.00 H TER 52445 WAT 5691 ATOM 52445 O WAT 5692 71.308 54.483 89.685 1.00 0.00 O ATOM 52446 H1 WAT 5692 72.011 54.555 89.039 1.00 0.00 H ATOM 52447 H2 WAT 5692 70.685 53.871 89.294 1.00 0.00 H TER 52449 WAT 5692 ATOM 52449 O WAT 5693 108.742 38.143 64.088 1.00 0.00 O ATOM 52450 H1 WAT 5693 108.082 38.206 63.398 1.00 0.00 H ATOM 52451 H2 WAT 5693 109.411 37.560 63.729 1.00 0.00 H TER 52453 WAT 5693 ATOM 52453 O WAT 5694 74.436 70.976 142.507 1.00 0.00 O ATOM 52454 H1 WAT 5694 74.375 70.355 141.781 1.00 0.00 H ATOM 52455 H2 WAT 5694 75.251 71.453 142.348 1.00 0.00 H TER 52457 WAT 5694 ATOM 52457 O WAT 5695 134.458 112.435 10.858 1.00 0.00 O ATOM 52458 H1 WAT 5695 135.308 112.796 11.112 1.00 0.00 H ATOM 52459 H2 WAT 5695 133.955 112.412 11.672 1.00 0.00 H TER 52461 WAT 5695 ATOM 52461 O WAT 5696 114.257 57.324 70.550 1.00 0.00 O ATOM 52462 H1 WAT 5696 113.854 57.592 71.376 1.00 0.00 H ATOM 52463 H2 WAT 5696 114.611 56.453 70.728 1.00 0.00 H TER 52465 WAT 5696 ATOM 52465 O WAT 5697 66.341 142.281 1.273 1.00 0.00 O ATOM 52466 H1 WAT 5697 66.279 141.337 1.418 1.00 0.00 H ATOM 52467 H2 WAT 5697 67.023 142.572 1.878 1.00 0.00 H TER 52469 WAT 5697 ATOM 52469 O WAT 5698 22.174 34.615 2.854 1.00 0.00 O ATOM 52470 H1 WAT 5698 22.136 34.590 3.810 1.00 0.00 H ATOM 52471 H2 WAT 5698 22.192 35.547 2.639 1.00 0.00 H TER 52473 WAT 5698 ATOM 52473 O WAT 5699 61.129 22.098 16.848 1.00 0.00 O ATOM 52474 H1 WAT 5699 61.026 21.176 17.083 1.00 0.00 H ATOM 52475 H2 WAT 5699 60.497 22.238 16.142 1.00 0.00 H TER 52477 WAT 5699 ATOM 52477 O WAT 5700 63.549 30.988 21.991 1.00 0.00 O ATOM 52478 H1 WAT 5700 64.185 31.702 21.929 1.00 0.00 H ATOM 52479 H2 WAT 5700 62.747 31.409 22.301 1.00 0.00 H TER 52481 WAT 5700 ATOM 52481 O WAT 5701 129.486 38.501 3.767 1.00 0.00 O ATOM 52482 H1 WAT 5701 129.654 37.598 3.499 1.00 0.00 H ATOM 52483 H2 WAT 5701 128.905 38.848 3.089 1.00 0.00 H TER 52485 WAT 5701 ATOM 52485 O WAT 5702 76.339 116.776 96.013 1.00 0.00 O ATOM 52486 H1 WAT 5702 75.679 117.309 95.571 1.00 0.00 H ATOM 52487 H2 WAT 5702 77.135 116.904 95.497 1.00 0.00 H TER 52489 WAT 5702 ATOM 52489 O WAT 5703 105.322 108.536 90.489 1.00 0.00 O ATOM 52490 H1 WAT 5703 105.971 108.573 91.191 1.00 0.00 H ATOM 52491 H2 WAT 5703 104.512 108.846 90.895 1.00 0.00 H TER 52493 WAT 5703 ATOM 52493 O WAT 5704 10.983 50.686 118.094 1.00 0.00 O ATOM 52494 H1 WAT 5704 10.572 50.275 117.333 1.00 0.00 H ATOM 52495 H2 WAT 5704 11.042 49.984 118.742 1.00 0.00 H TER 52497 WAT 5704 ATOM 52497 O WAT 5705 115.194 116.421 87.512 1.00 0.00 O ATOM 52498 H1 WAT 5705 114.990 116.171 86.611 1.00 0.00 H ATOM 52499 H2 WAT 5705 115.990 115.932 87.722 1.00 0.00 H TER 52501 WAT 5705 ATOM 52501 O WAT 5706 126.933 34.372 13.681 1.00 0.00 O ATOM 52502 H1 WAT 5706 126.415 33.568 13.668 1.00 0.00 H ATOM 52503 H2 WAT 5706 126.342 35.033 14.043 1.00 0.00 H TER 52505 WAT 5706 ATOM 52505 O WAT 5707 136.069 76.515 13.974 1.00 0.00 O ATOM 52506 H1 WAT 5707 136.800 75.905 13.877 1.00 0.00 H ATOM 52507 H2 WAT 5707 136.484 77.358 14.156 1.00 0.00 H TER 52509 WAT 5707 ATOM 52509 O WAT 5708 3.465 62.537 137.548 1.00 0.00 O ATOM 52510 H1 WAT 5708 3.849 63.407 137.658 1.00 0.00 H ATOM 52511 H2 WAT 5708 3.932 62.162 136.801 1.00 0.00 H TER 52513 WAT 5708 ATOM 52513 O WAT 5709 145.156 87.488 7.684 1.00 0.00 O ATOM 52514 H1 WAT 5709 145.941 87.791 8.141 1.00 0.00 H ATOM 52515 H2 WAT 5709 145.473 86.806 7.091 1.00 0.00 H TER 52517 WAT 5709 ATOM 52517 O WAT 5710 15.449 70.527 64.992 1.00 0.00 O ATOM 52518 H1 WAT 5710 15.957 71.315 64.800 1.00 0.00 H ATOM 52519 H2 WAT 5710 15.330 70.544 65.942 1.00 0.00 H TER 52521 WAT 5710 ATOM 52521 O WAT 5711 143.967 123.501 87.720 1.00 0.00 O ATOM 52522 H1 WAT 5711 143.464 123.959 87.047 1.00 0.00 H ATOM 52523 H2 WAT 5711 143.790 122.574 87.562 1.00 0.00 H TER 52525 WAT 5711 ATOM 52525 O WAT 5712 113.782 20.670 99.889 1.00 0.00 O ATOM 52526 H1 WAT 5712 113.497 21.295 99.222 1.00 0.00 H ATOM 52527 H2 WAT 5712 114.032 21.215 100.635 1.00 0.00 H TER 52529 WAT 5712 ATOM 52529 O WAT 5713 44.858 13.914 148.273 1.00 0.00 O ATOM 52530 H1 WAT 5713 45.368 13.955 149.083 1.00 0.00 H ATOM 52531 H2 WAT 5713 45.515 13.887 147.578 1.00 0.00 H TER 52533 WAT 5713 ATOM 52533 O WAT 5714 71.579 95.090 113.966 1.00 0.00 O ATOM 52534 H1 WAT 5714 71.916 95.129 113.071 1.00 0.00 H ATOM 52535 H2 WAT 5714 70.685 94.761 113.870 1.00 0.00 H TER 52537 WAT 5714 ATOM 52537 O WAT 5715 56.780 68.177 72.060 1.00 0.00 O ATOM 52538 H1 WAT 5715 57.058 67.307 71.773 1.00 0.00 H ATOM 52539 H2 WAT 5715 56.953 68.186 73.002 1.00 0.00 H TER 52541 WAT 5715 ATOM 52541 O WAT 5716 26.568 122.974 92.105 1.00 0.00 O ATOM 52542 H1 WAT 5716 27.427 123.125 92.498 1.00 0.00 H ATOM 52543 H2 WAT 5716 26.034 122.629 92.821 1.00 0.00 H TER 52545 WAT 5716 ATOM 52545 O WAT 5717 51.828 125.667 9.572 1.00 0.00 O ATOM 52546 H1 WAT 5717 52.630 125.322 9.965 1.00 0.00 H ATOM 52547 H2 WAT 5717 51.161 125.012 9.777 1.00 0.00 H TER 52549 WAT 5717 ATOM 52549 O WAT 5718 42.143 119.807 85.882 1.00 0.00 O ATOM 52550 H1 WAT 5718 42.997 120.120 85.584 1.00 0.00 H ATOM 52551 H2 WAT 5718 41.544 120.530 85.693 1.00 0.00 H TER 52553 WAT 5718 ATOM 52553 O WAT 5719 100.295 37.782 125.186 1.00 0.00 O ATOM 52554 H1 WAT 5719 100.584 36.870 125.209 1.00 0.00 H ATOM 52555 H2 WAT 5719 99.853 37.915 126.024 1.00 0.00 H TER 52557 WAT 5719 ATOM 52557 O WAT 5720 93.621 126.617 154.538 1.00 0.00 O ATOM 52558 H1 WAT 5720 93.680 125.985 153.822 1.00 0.00 H ATOM 52559 H2 WAT 5720 93.134 127.353 154.169 1.00 0.00 H TER 52561 WAT 5720 ATOM 52561 O WAT 5721 67.511 144.298 67.835 1.00 0.00 O ATOM 52562 H1 WAT 5721 67.205 143.652 67.198 1.00 0.00 H ATOM 52563 H2 WAT 5721 67.286 145.143 67.445 1.00 0.00 H TER 52565 WAT 5721 ATOM 52565 O WAT 5722 125.828 102.248 141.356 1.00 0.00 O ATOM 52566 H1 WAT 5722 126.061 102.922 141.995 1.00 0.00 H ATOM 52567 H2 WAT 5722 126.267 101.458 141.671 1.00 0.00 H TER 52569 WAT 5722 ATOM 52569 O WAT 5723 126.865 27.413 121.991 1.00 0.00 O ATOM 52570 H1 WAT 5723 125.933 27.549 121.822 1.00 0.00 H ATOM 52571 H2 WAT 5723 126.960 26.464 122.064 1.00 0.00 H TER 52573 WAT 5723 ATOM 52573 O WAT 5724 37.642 109.911 132.246 1.00 0.00 O ATOM 52574 H1 WAT 5724 36.708 109.723 132.162 1.00 0.00 H ATOM 52575 H2 WAT 5724 37.900 109.490 133.066 1.00 0.00 H TER 52577 WAT 5724 ATOM 52577 O WAT 5725 118.769 101.119 120.530 1.00 0.00 O ATOM 52578 H1 WAT 5725 118.684 101.309 121.465 1.00 0.00 H ATOM 52579 H2 WAT 5725 117.908 101.321 120.165 1.00 0.00 H TER 52581 WAT 5725 ATOM 52581 O WAT 5726 81.813 145.654 102.666 1.00 0.00 O ATOM 52582 H1 WAT 5726 80.956 145.229 102.694 1.00 0.00 H ATOM 52583 H2 WAT 5726 82.154 145.564 103.556 1.00 0.00 H TER 52585 WAT 5726 ATOM 52585 O WAT 5727 135.543 38.962 101.157 1.00 0.00 O ATOM 52586 H1 WAT 5727 135.127 39.138 100.312 1.00 0.00 H ATOM 52587 H2 WAT 5727 135.209 38.103 101.414 1.00 0.00 H TER 52589 WAT 5727 ATOM 52589 O WAT 5728 101.943 91.464 129.200 1.00 0.00 O ATOM 52590 H1 WAT 5728 101.058 91.638 128.880 1.00 0.00 H ATOM 52591 H2 WAT 5728 101.854 91.453 130.153 1.00 0.00 H TER 52593 WAT 5728 ATOM 52593 O WAT 5729 57.378 68.251 151.408 1.00 0.00 O ATOM 52594 H1 WAT 5729 57.770 67.495 151.845 1.00 0.00 H ATOM 52595 H2 WAT 5729 56.453 68.022 151.318 1.00 0.00 H TER 52597 WAT 5729 ATOM 52597 O WAT 5730 131.973 121.075 143.414 1.00 0.00 O ATOM 52598 H1 WAT 5730 131.073 120.901 143.136 1.00 0.00 H ATOM 52599 H2 WAT 5730 132.145 121.970 143.123 1.00 0.00 H TER 52601 WAT 5730 ATOM 52601 O WAT 5731 122.770 47.526 84.148 1.00 0.00 O ATOM 52602 H1 WAT 5731 122.683 48.287 83.574 1.00 0.00 H ATOM 52603 H2 WAT 5731 123.281 46.898 83.638 1.00 0.00 H TER 52605 WAT 5731 ATOM 52605 O WAT 5732 49.347 93.870 11.638 1.00 0.00 O ATOM 52606 H1 WAT 5732 48.731 94.601 11.605 1.00 0.00 H ATOM 52607 H2 WAT 5732 49.314 93.569 12.546 1.00 0.00 H TER 52609 WAT 5732 ATOM 52609 O WAT 5733 112.933 99.522 67.681 1.00 0.00 O ATOM 52610 H1 WAT 5733 113.152 99.865 66.814 1.00 0.00 H ATOM 52611 H2 WAT 5733 113.136 98.588 67.627 1.00 0.00 H TER 52613 WAT 5733 ATOM 52613 O WAT 5734 109.968 24.862 1.411 1.00 0.00 O ATOM 52614 H1 WAT 5734 109.488 24.582 0.632 1.00 0.00 H ATOM 52615 H2 WAT 5734 109.289 25.027 2.065 1.00 0.00 H TER 52617 WAT 5734 ATOM 52617 O WAT 5735 42.098 32.179 68.797 1.00 0.00 O ATOM 52618 H1 WAT 5735 41.331 31.623 68.663 1.00 0.00 H ATOM 52619 H2 WAT 5735 41.763 32.941 69.269 1.00 0.00 H TER 52621 WAT 5735 ATOM 52621 O WAT 5736 1.944 126.412 141.420 1.00 0.00 O ATOM 52622 H1 WAT 5736 1.093 126.414 141.858 1.00 0.00 H ATOM 52623 H2 WAT 5736 2.566 126.170 142.107 1.00 0.00 H TER 52625 WAT 5736 ATOM 52625 O WAT 5737 9.931 91.736 139.618 1.00 0.00 O ATOM 52626 H1 WAT 5737 9.391 92.524 139.674 1.00 0.00 H ATOM 52627 H2 WAT 5737 9.401 91.118 139.114 1.00 0.00 H TER 52629 WAT 5737 ATOM 52629 O WAT 5738 102.105 115.473 63.512 1.00 0.00 O ATOM 52630 H1 WAT 5738 102.025 116.228 62.928 1.00 0.00 H ATOM 52631 H2 WAT 5738 101.463 115.636 64.203 1.00 0.00 H TER 52633 WAT 5738 ATOM 52633 O WAT 5739 126.511 143.820 6.932 1.00 0.00 O ATOM 52634 H1 WAT 5739 127.252 144.208 7.397 1.00 0.00 H ATOM 52635 H2 WAT 5739 125.791 143.850 7.562 1.00 0.00 H TER 52637 WAT 5739 ATOM 52637 O WAT 5740 103.466 71.547 137.877 1.00 0.00 O ATOM 52638 H1 WAT 5740 102.627 71.699 137.441 1.00 0.00 H ATOM 52639 H2 WAT 5740 103.565 70.595 137.880 1.00 0.00 H TER 52641 WAT 5740 ATOM 52641 O WAT 5741 12.069 1.746 102.424 1.00 0.00 O ATOM 52642 H1 WAT 5741 11.123 1.615 102.359 1.00 0.00 H ATOM 52643 H2 WAT 5741 12.179 2.330 103.174 1.00 0.00 H TER 52645 WAT 5741 ATOM 52645 O WAT 5742 18.595 141.766 83.954 1.00 0.00 O ATOM 52646 H1 WAT 5742 18.627 142.146 84.832 1.00 0.00 H ATOM 52647 H2 WAT 5742 18.514 142.519 83.369 1.00 0.00 H TER 52649 WAT 5742 ATOM 52649 O WAT 5743 136.109 75.316 135.718 1.00 0.00 O ATOM 52650 H1 WAT 5743 135.279 75.165 136.169 1.00 0.00 H ATOM 52651 H2 WAT 5743 136.738 75.479 136.421 1.00 0.00 H TER 52653 WAT 5743 ATOM 52653 O WAT 5744 3.835 28.176 119.421 1.00 0.00 O ATOM 52654 H1 WAT 5744 4.317 27.608 118.820 1.00 0.00 H ATOM 52655 H2 WAT 5744 4.257 28.040 120.269 1.00 0.00 H TER 52657 WAT 5744 ATOM 52657 O WAT 5745 6.995 66.902 62.596 1.00 0.00 O ATOM 52658 H1 WAT 5745 7.659 66.301 62.259 1.00 0.00 H ATOM 52659 H2 WAT 5745 7.414 67.762 62.568 1.00 0.00 H TER 52661 WAT 5745 ATOM 52661 O WAT 5746 128.664 58.336 156.457 1.00 0.00 O ATOM 52662 H1 WAT 5746 128.770 58.893 157.229 1.00 0.00 H ATOM 52663 H2 WAT 5746 128.901 57.459 156.760 1.00 0.00 H TER 52665 WAT 5746 ATOM 52665 O WAT 5747 96.096 78.118 94.690 1.00 0.00 O ATOM 52666 H1 WAT 5747 95.703 78.767 94.106 1.00 0.00 H ATOM 52667 H2 WAT 5747 95.357 77.763 95.185 1.00 0.00 H TER 52669 WAT 5747 ATOM 52669 O WAT 5748 40.660 24.059 116.614 1.00 0.00 O ATOM 52670 H1 WAT 5748 41.117 23.523 115.965 1.00 0.00 H ATOM 52671 H2 WAT 5748 41.192 24.851 116.687 1.00 0.00 H TER 52673 WAT 5748 ATOM 52673 O WAT 5749 9.484 141.846 7.972 1.00 0.00 O ATOM 52674 H1 WAT 5749 10.151 142.371 8.413 1.00 0.00 H ATOM 52675 H2 WAT 5749 9.920 141.516 7.186 1.00 0.00 H TER 52677 WAT 5749 ATOM 52677 O WAT 5750 98.830 126.484 72.201 1.00 0.00 O ATOM 52678 H1 WAT 5750 98.133 126.038 72.682 1.00 0.00 H ATOM 52679 H2 WAT 5750 98.825 127.377 72.547 1.00 0.00 H TER 52681 WAT 5750 ATOM 52681 O WAT 5751 107.322 38.872 70.254 1.00 0.00 O ATOM 52682 H1 WAT 5751 107.549 39.769 70.499 1.00 0.00 H ATOM 52683 H2 WAT 5751 107.999 38.334 70.664 1.00 0.00 H TER 52685 WAT 5751 ATOM 52685 O WAT 5752 86.471 17.480 108.428 1.00 0.00 O ATOM 52686 H1 WAT 5752 86.241 16.560 108.302 1.00 0.00 H ATOM 52687 H2 WAT 5752 86.538 17.835 107.541 1.00 0.00 H TER 52689 WAT 5752 ATOM 52689 O WAT 5753 115.532 79.652 72.988 1.00 0.00 O ATOM 52690 H1 WAT 5753 115.954 80.488 73.186 1.00 0.00 H ATOM 52691 H2 WAT 5753 114.935 79.851 72.266 1.00 0.00 H TER 52693 WAT 5753 ATOM 52693 O WAT 5754 86.935 63.789 113.146 1.00 0.00 O ATOM 52694 H1 WAT 5754 87.321 64.627 112.890 1.00 0.00 H ATOM 52695 H2 WAT 5754 87.090 63.732 114.088 1.00 0.00 H TER 52697 WAT 5754 ATOM 52697 O WAT 5755 9.066 124.451 14.227 1.00 0.00 O ATOM 52698 H1 WAT 5755 9.431 125.334 14.172 1.00 0.00 H ATOM 52699 H2 WAT 5755 9.413 124.099 15.047 1.00 0.00 H TER 52701 WAT 5755 ATOM 52701 O WAT 5756 37.388 36.724 10.809 1.00 0.00 O ATOM 52702 H1 WAT 5756 36.761 36.119 11.206 1.00 0.00 H ATOM 52703 H2 WAT 5756 38.213 36.544 11.260 1.00 0.00 H TER 52705 WAT 5756 ATOM 52705 O WAT 5757 65.496 76.002 99.179 1.00 0.00 O ATOM 52706 H1 WAT 5757 66.073 75.548 98.564 1.00 0.00 H ATOM 52707 H2 WAT 5757 66.091 76.445 99.783 1.00 0.00 H TER 52709 WAT 5757 ATOM 52709 O WAT 5758 127.888 142.568 123.468 1.00 0.00 O ATOM 52710 H1 WAT 5758 128.822 142.714 123.622 1.00 0.00 H ATOM 52711 H2 WAT 5758 127.860 141.924 122.761 1.00 0.00 H TER 52713 WAT 5758 ATOM 52713 O WAT 5759 41.910 98.310 109.779 1.00 0.00 O ATOM 52714 H1 WAT 5759 41.826 99.071 110.353 1.00 0.00 H ATOM 52715 H2 WAT 5759 41.242 98.443 109.106 1.00 0.00 H TER 52717 WAT 5759 ATOM 52717 O WAT 5760 77.796 145.675 119.931 1.00 0.00 O ATOM 52718 H1 WAT 5760 76.989 146.116 120.196 1.00 0.00 H ATOM 52719 H2 WAT 5760 77.588 144.742 119.985 1.00 0.00 H TER 52721 WAT 5760 ATOM 52721 O WAT 5761 111.903 54.433 146.220 1.00 0.00 O ATOM 52722 H1 WAT 5761 112.491 53.983 145.614 1.00 0.00 H ATOM 52723 H2 WAT 5761 112.423 55.158 146.565 1.00 0.00 H TER 52725 WAT 5761 ATOM 52725 O WAT 5762 61.597 134.489 19.389 1.00 0.00 O ATOM 52726 H1 WAT 5762 61.489 135.355 19.781 1.00 0.00 H ATOM 52727 H2 WAT 5762 62.525 134.444 19.158 1.00 0.00 H TER 52729 WAT 5762 ATOM 52729 O WAT 5763 61.868 71.390 78.625 1.00 0.00 O ATOM 52730 H1 WAT 5763 62.498 71.177 77.937 1.00 0.00 H ATOM 52731 H2 WAT 5763 61.395 72.151 78.290 1.00 0.00 H TER 52733 WAT 5763 ATOM 52733 O WAT 5764 134.273 70.075 142.781 1.00 0.00 O ATOM 52734 H1 WAT 5764 133.325 69.956 142.832 1.00 0.00 H ATOM 52735 H2 WAT 5764 134.454 70.152 141.845 1.00 0.00 H TER 52737 WAT 5764 ATOM 52737 O WAT 5765 143.254 74.095 79.029 1.00 0.00 O ATOM 52738 H1 WAT 5765 143.275 74.215 79.978 1.00 0.00 H ATOM 52739 H2 WAT 5765 142.636 74.756 78.718 1.00 0.00 H TER 52741 WAT 5765 ATOM 52741 O WAT 5766 14.251 122.571 9.379 1.00 0.00 O ATOM 52742 H1 WAT 5766 14.020 121.660 9.198 1.00 0.00 H ATOM 52743 H2 WAT 5766 15.129 122.526 9.757 1.00 0.00 H TER 52745 WAT 5766 ATOM 52745 O WAT 5767 51.817 42.152 55.947 1.00 0.00 O ATOM 52746 H1 WAT 5767 52.608 42.668 56.106 1.00 0.00 H ATOM 52747 H2 WAT 5767 52.104 41.447 55.367 1.00 0.00 H TER 52749 WAT 5767 ATOM 52749 O WAT 5768 4.981 26.489 81.846 1.00 0.00 O ATOM 52750 H1 WAT 5768 5.507 27.206 82.201 1.00 0.00 H ATOM 52751 H2 WAT 5768 4.118 26.875 81.701 1.00 0.00 H TER 52753 WAT 5768 ATOM 52753 O WAT 5769 137.292 66.126 19.401 1.00 0.00 O ATOM 52754 H1 WAT 5769 137.814 66.344 20.173 1.00 0.00 H ATOM 52755 H2 WAT 5769 136.386 66.155 19.708 1.00 0.00 H TER 52757 WAT 5769 ATOM 52757 O WAT 5770 97.931 131.496 87.825 1.00 0.00 O ATOM 52758 H1 WAT 5770 98.882 131.560 87.738 1.00 0.00 H ATOM 52759 H2 WAT 5770 97.628 131.236 86.955 1.00 0.00 H TER 52761 WAT 5770 ATOM 52761 O WAT 5771 102.726 1.952 11.086 1.00 0.00 O ATOM 52762 H1 WAT 5771 102.380 1.850 10.199 1.00 0.00 H ATOM 52763 H2 WAT 5771 103.402 2.624 11.004 1.00 0.00 H TER 52765 WAT 5771 ATOM 52765 O WAT 5772 16.790 23.916 129.636 1.00 0.00 O ATOM 52766 H1 WAT 5772 15.868 23.920 129.893 1.00 0.00 H ATOM 52767 H2 WAT 5772 17.270 23.931 130.464 1.00 0.00 H TER 52769 WAT 5772 ATOM 52769 O WAT 5773 32.240 91.251 138.830 1.00 0.00 O ATOM 52770 H1 WAT 5773 32.958 90.678 138.561 1.00 0.00 H ATOM 52771 H2 WAT 5773 31.877 90.830 139.609 1.00 0.00 H TER 52773 WAT 5773 ATOM 52773 O WAT 5774 107.291 112.854 153.483 1.00 0.00 O ATOM 52774 H1 WAT 5774 106.844 112.817 154.328 1.00 0.00 H ATOM 52775 H2 WAT 5774 107.832 112.065 153.463 1.00 0.00 H TER 52777 WAT 5774 ATOM 52777 O WAT 5775 2.022 116.998 117.102 1.00 0.00 O ATOM 52778 H1 WAT 5775 1.773 117.360 117.953 1.00 0.00 H ATOM 52779 H2 WAT 5775 2.248 116.087 117.286 1.00 0.00 H TER 52781 WAT 5775 ATOM 52781 O WAT 5776 95.295 28.917 66.753 1.00 0.00 O ATOM 52782 H1 WAT 5776 94.398 28.950 66.419 1.00 0.00 H ATOM 52783 H2 WAT 5776 95.685 29.746 66.476 1.00 0.00 H TER 52785 WAT 5776 ATOM 52785 O WAT 5777 58.655 126.473 19.532 1.00 0.00 O ATOM 52786 H1 WAT 5777 57.812 126.923 19.585 1.00 0.00 H ATOM 52787 H2 WAT 5777 59.252 127.125 19.164 1.00 0.00 H TER 52789 WAT 5777 ATOM 52789 O WAT 5778 11.639 0.997 157.756 1.00 0.00 O ATOM 52790 H1 WAT 5778 12.553 1.269 157.673 1.00 0.00 H ATOM 52791 H2 WAT 5778 11.654 0.053 157.593 1.00 0.00 H TER 52793 WAT 5778 ATOM 52793 O WAT 5779 1.637 139.457 125.654 1.00 0.00 O ATOM 52794 H1 WAT 5779 1.323 138.607 125.347 1.00 0.00 H ATOM 52795 H2 WAT 5779 1.588 140.023 124.884 1.00 0.00 H TER 52797 WAT 5779 ATOM 52797 O WAT 5780 131.000 121.496 123.859 1.00 0.00 O ATOM 52798 H1 WAT 5780 131.929 121.482 124.087 1.00 0.00 H ATOM 52799 H2 WAT 5780 130.704 122.371 124.109 1.00 0.00 H TER 52801 WAT 5780 ATOM 52801 O WAT 5781 119.498 42.453 111.546 1.00 0.00 O ATOM 52802 H1 WAT 5781 118.791 42.754 112.117 1.00 0.00 H ATOM 52803 H2 WAT 5781 119.335 42.894 110.712 1.00 0.00 H TER 52805 WAT 5781 ATOM 52805 O WAT 5782 130.710 119.191 64.423 1.00 0.00 O ATOM 52806 H1 WAT 5782 131.131 119.767 65.062 1.00 0.00 H ATOM 52807 H2 WAT 5782 130.924 119.578 63.574 1.00 0.00 H TER 52809 WAT 5782 ATOM 52809 O WAT 5783 143.782 12.164 155.293 1.00 0.00 O ATOM 52810 H1 WAT 5783 144.204 11.609 154.636 1.00 0.00 H ATOM 52811 H2 WAT 5783 143.466 11.551 155.957 1.00 0.00 H TER 52813 WAT 5783 ATOM 52813 O WAT 5784 120.372 136.959 85.632 1.00 0.00 O ATOM 52814 H1 WAT 5784 121.248 136.876 85.255 1.00 0.00 H ATOM 52815 H2 WAT 5784 119.847 136.311 85.163 1.00 0.00 H TER 52817 WAT 5784 ATOM 52817 O WAT 5785 141.943 11.399 61.052 1.00 0.00 O ATOM 52818 H1 WAT 5785 141.628 12.134 61.578 1.00 0.00 H ATOM 52819 H2 WAT 5785 142.067 11.766 60.177 1.00 0.00 H TER 52821 WAT 5785 ATOM 52821 O WAT 5786 75.094 103.222 93.064 1.00 0.00 O ATOM 52822 H1 WAT 5786 74.843 102.801 92.242 1.00 0.00 H ATOM 52823 H2 WAT 5786 75.870 103.736 92.843 1.00 0.00 H TER 52825 WAT 5786 ATOM 52825 O WAT 5787 56.652 105.352 115.779 1.00 0.00 O ATOM 52826 H1 WAT 5787 56.934 104.866 115.004 1.00 0.00 H ATOM 52827 H2 WAT 5787 56.202 106.121 115.429 1.00 0.00 H TER 52829 WAT 5787 ATOM 52829 O WAT 5788 102.936 19.998 128.656 1.00 0.00 O ATOM 52830 H1 WAT 5788 103.803 19.853 129.036 1.00 0.00 H ATOM 52831 H2 WAT 5788 102.818 19.272 128.044 1.00 0.00 H TER 52833 WAT 5788 ATOM 52833 O WAT 5789 78.276 52.285 120.737 1.00 0.00 O ATOM 52834 H1 WAT 5789 78.168 53.207 120.969 1.00 0.00 H ATOM 52835 H2 WAT 5789 78.573 52.300 119.827 1.00 0.00 H TER 52837 WAT 5789 ATOM 52837 O WAT 5790 28.687 141.696 124.821 1.00 0.00 O ATOM 52838 H1 WAT 5790 28.063 141.340 125.454 1.00 0.00 H ATOM 52839 H2 WAT 5790 29.421 142.001 125.355 1.00 0.00 H TER 52841 WAT 5790 ATOM 52841 O WAT 5791 43.760 106.912 132.782 1.00 0.00 O ATOM 52842 H1 WAT 5791 44.273 107.683 133.024 1.00 0.00 H ATOM 52843 H2 WAT 5791 44.278 106.484 132.101 1.00 0.00 H TER 52845 WAT 5791 ATOM 52845 O WAT 5792 58.178 27.354 77.821 1.00 0.00 O ATOM 52846 H1 WAT 5792 58.206 28.308 77.895 1.00 0.00 H ATOM 52847 H2 WAT 5792 58.404 27.178 76.907 1.00 0.00 H TER 52849 WAT 5792 ATOM 52849 O WAT 5793 145.037 68.046 78.169 1.00 0.00 O ATOM 52850 H1 WAT 5793 144.584 68.859 77.945 1.00 0.00 H ATOM 52851 H2 WAT 5793 145.639 68.293 78.871 1.00 0.00 H TER 52853 WAT 5793 ATOM 52853 O WAT 5794 15.499 81.120 127.607 1.00 0.00 O ATOM 52854 H1 WAT 5794 14.615 81.453 127.761 1.00 0.00 H ATOM 52855 H2 WAT 5794 15.396 80.169 127.588 1.00 0.00 H TER 52857 WAT 5794 ATOM 52857 O WAT 5795 80.254 7.938 145.926 1.00 0.00 O ATOM 52858 H1 WAT 5795 80.751 7.533 145.215 1.00 0.00 H ATOM 52859 H2 WAT 5795 79.770 7.213 146.322 1.00 0.00 H TER 52861 WAT 5795 ATOM 52861 O WAT 5796 20.136 93.986 124.445 1.00 0.00 O ATOM 52862 H1 WAT 5796 19.280 93.610 124.242 1.00 0.00 H ATOM 52863 H2 WAT 5796 20.222 93.890 125.393 1.00 0.00 H TER 52865 WAT 5796 ATOM 52865 O WAT 5797 112.480 103.765 111.193 1.00 0.00 O ATOM 52866 H1 WAT 5797 112.350 103.059 110.559 1.00 0.00 H ATOM 52867 H2 WAT 5797 111.718 104.333 111.079 1.00 0.00 H TER 52869 WAT 5797 ATOM 52869 O WAT 5798 53.044 63.790 11.450 1.00 0.00 O ATOM 52870 H1 WAT 5798 52.975 64.658 11.847 1.00 0.00 H ATOM 52871 H2 WAT 5798 53.768 63.370 11.916 1.00 0.00 H TER 52873 WAT 5798 ATOM 52873 O WAT 5799 103.598 38.298 71.994 1.00 0.00 O ATOM 52874 H1 WAT 5799 103.829 38.064 72.893 1.00 0.00 H ATOM 52875 H2 WAT 5799 103.077 37.559 71.680 1.00 0.00 H TER 52877 WAT 5799 ATOM 52877 O WAT 5800 117.956 30.222 78.006 1.00 0.00 O ATOM 52878 H1 WAT 5800 118.670 29.871 77.474 1.00 0.00 H ATOM 52879 H2 WAT 5800 118.384 30.545 78.798 1.00 0.00 H TER 52881 WAT 5800 ATOM 52881 O WAT 5801 25.989 22.634 127.511 1.00 0.00 O ATOM 52882 H1 WAT 5801 25.627 22.028 128.157 1.00 0.00 H ATOM 52883 H2 WAT 5801 26.875 22.310 127.348 1.00 0.00 H TER 52885 WAT 5801 ATOM 52885 O WAT 5802 143.947 120.344 148.434 1.00 0.00 O ATOM 52886 H1 WAT 5802 143.147 120.172 147.938 1.00 0.00 H ATOM 52887 H2 WAT 5802 143.734 120.087 149.331 1.00 0.00 H TER 52889 WAT 5802 ATOM 52889 O WAT 5803 2.393 55.149 136.805 1.00 0.00 O ATOM 52890 H1 WAT 5803 2.159 55.960 136.355 1.00 0.00 H ATOM 52891 H2 WAT 5803 3.291 55.292 137.104 1.00 0.00 H TER 52893 WAT 5803 ATOM 52893 O WAT 5804 0.043 78.154 24.872 1.00 0.00 O ATOM 52894 H1 WAT 5804 0.133 77.949 25.802 1.00 0.00 H ATOM 52895 H2 WAT 5804 0.539 77.466 24.426 1.00 0.00 H TER 52897 WAT 5804 ATOM 52897 O WAT 5805 104.459 142.348 147.195 1.00 0.00 O ATOM 52898 H1 WAT 5805 105.395 142.186 147.316 1.00 0.00 H ATOM 52899 H2 WAT 5805 104.420 143.092 146.594 1.00 0.00 H TER 52901 WAT 5805 ATOM 52901 O WAT 5806 66.968 135.221 123.630 1.00 0.00 O ATOM 52902 H1 WAT 5806 66.923 136.175 123.563 1.00 0.00 H ATOM 52903 H2 WAT 5806 66.257 134.907 123.072 1.00 0.00 H TER 52905 WAT 5806 ATOM 52905 O WAT 5807 34.013 92.979 6.732 1.00 0.00 O ATOM 52906 H1 WAT 5807 33.221 92.480 6.932 1.00 0.00 H ATOM 52907 H2 WAT 5807 34.261 92.693 5.853 1.00 0.00 H TER 52909 WAT 5807 ATOM 52909 O WAT 5808 61.528 121.097 3.829 1.00 0.00 O ATOM 52910 H1 WAT 5808 61.829 121.994 3.684 1.00 0.00 H ATOM 52911 H2 WAT 5808 60.885 121.172 4.534 1.00 0.00 H TER 52913 WAT 5808 ATOM 52913 O WAT 5809 44.779 74.101 84.996 1.00 0.00 O ATOM 52914 H1 WAT 5809 44.790 73.379 84.368 1.00 0.00 H ATOM 52915 H2 WAT 5809 43.949 74.001 85.462 1.00 0.00 H TER 52917 WAT 5809 ATOM 52917 O WAT 5810 38.688 17.444 102.640 1.00 0.00 O ATOM 52918 H1 WAT 5810 37.974 17.875 103.110 1.00 0.00 H ATOM 52919 H2 WAT 5810 38.519 17.637 101.718 1.00 0.00 H TER 52921 WAT 5810 ATOM 52921 O WAT 5811 81.864 118.135 77.455 1.00 0.00 O ATOM 52922 H1 WAT 5811 82.384 118.600 76.800 1.00 0.00 H ATOM 52923 H2 WAT 5811 82.172 118.479 78.294 1.00 0.00 H TER 52925 WAT 5811 ATOM 52925 O WAT 5812 132.594 83.242 137.097 1.00 0.00 O ATOM 52926 H1 WAT 5812 133.020 82.663 136.465 1.00 0.00 H ATOM 52927 H2 WAT 5812 133.291 83.826 137.395 1.00 0.00 H TER 52929 WAT 5812 ATOM 52929 O WAT 5813 41.990 12.781 82.437 1.00 0.00 O ATOM 52930 H1 WAT 5813 42.391 12.713 83.304 1.00 0.00 H ATOM 52931 H2 WAT 5813 41.674 11.897 82.250 1.00 0.00 H TER 52933 WAT 5813 ATOM 52933 O WAT 5814 129.595 44.621 82.484 1.00 0.00 O ATOM 52934 H1 WAT 5814 129.963 45.377 82.027 1.00 0.00 H ATOM 52935 H2 WAT 5814 129.686 44.834 83.413 1.00 0.00 H TER 52937 WAT 5814 ATOM 52937 O WAT 5815 139.670 112.570 21.959 1.00 0.00 O ATOM 52938 H1 WAT 5815 139.514 112.570 22.903 1.00 0.00 H ATOM 52939 H2 WAT 5815 140.537 112.177 21.859 1.00 0.00 H TER 52941 WAT 5815 ATOM 52941 O WAT 5816 121.327 108.577 19.961 1.00 0.00 O ATOM 52942 H1 WAT 5816 121.974 107.927 19.688 1.00 0.00 H ATOM 52943 H2 WAT 5816 121.759 109.419 19.822 1.00 0.00 H TER 52945 WAT 5816 ATOM 52945 O WAT 5817 14.559 118.011 75.523 1.00 0.00 O ATOM 52946 H1 WAT 5817 13.826 118.284 76.075 1.00 0.00 H ATOM 52947 H2 WAT 5817 14.263 118.182 74.629 1.00 0.00 H TER 52949 WAT 5817 ATOM 52949 O WAT 5818 53.121 71.482 14.270 1.00 0.00 O ATOM 52950 H1 WAT 5818 52.361 71.663 14.823 1.00 0.00 H ATOM 52951 H2 WAT 5818 52.999 70.576 13.985 1.00 0.00 H TER 52953 WAT 5818 ATOM 52953 O WAT 5819 117.021 108.795 156.806 1.00 0.00 O ATOM 52954 H1 WAT 5819 116.748 109.710 156.751 1.00 0.00 H ATOM 52955 H2 WAT 5819 116.530 108.356 156.112 1.00 0.00 H TER 52957 WAT 5819 ATOM 52957 O WAT 5820 99.574 38.198 23.479 1.00 0.00 O ATOM 52958 H1 WAT 5820 100.525 38.306 23.472 1.00 0.00 H ATOM 52959 H2 WAT 5820 99.231 39.092 23.490 1.00 0.00 H TER 52961 WAT 5820 ATOM 52961 O WAT 5821 118.892 117.721 104.242 1.00 0.00 O ATOM 52962 H1 WAT 5821 119.773 117.747 103.869 1.00 0.00 H ATOM 52963 H2 WAT 5821 118.445 118.474 103.855 1.00 0.00 H TER 52965 WAT 5821 ATOM 52965 O WAT 5822 91.268 114.248 150.182 1.00 0.00 O ATOM 52966 H1 WAT 5822 90.361 114.151 149.892 1.00 0.00 H ATOM 52967 H2 WAT 5822 91.258 115.024 150.742 1.00 0.00 H TER 52969 WAT 5822 ATOM 52969 O WAT 5823 63.984 19.542 3.098 1.00 0.00 O ATOM 52970 H1 WAT 5823 63.049 19.361 3.203 1.00 0.00 H ATOM 52971 H2 WAT 5823 64.154 20.275 3.689 1.00 0.00 H TER 52973 WAT 5823 ATOM 52973 O WAT 5824 10.533 143.357 60.499 1.00 0.00 O ATOM 52974 H1 WAT 5824 10.690 144.282 60.307 1.00 0.00 H ATOM 52975 H2 WAT 5824 9.991 143.050 59.772 1.00 0.00 H TER 52977 WAT 5824 ATOM 52977 O WAT 5825 3.035 18.362 75.770 1.00 0.00 O ATOM 52978 H1 WAT 5825 3.444 19.224 75.852 1.00 0.00 H ATOM 52979 H2 WAT 5825 2.264 18.408 76.334 1.00 0.00 H TER 52981 WAT 5825 ATOM 52981 O WAT 5826 130.818 140.962 146.462 1.00 0.00 O ATOM 52982 H1 WAT 5826 130.119 140.913 147.114 1.00 0.00 H ATOM 52983 H2 WAT 5826 131.062 141.888 146.442 1.00 0.00 H TER 52985 WAT 5826 ATOM 52985 O WAT 5827 113.163 54.844 123.399 1.00 0.00 O ATOM 52986 H1 WAT 5827 112.874 53.937 123.303 1.00 0.00 H ATOM 52987 H2 WAT 5827 112.492 55.252 123.946 1.00 0.00 H TER 52989 WAT 5827 ATOM 52989 O WAT 5828 2.371 61.713 150.116 1.00 0.00 O ATOM 52990 H1 WAT 5828 2.289 62.666 150.124 1.00 0.00 H ATOM 52991 H2 WAT 5828 1.541 61.398 150.475 1.00 0.00 H TER 52993 WAT 5828 ATOM 52993 O WAT 5829 79.563 124.733 8.304 1.00 0.00 O ATOM 52994 H1 WAT 5829 79.525 125.679 8.441 1.00 0.00 H ATOM 52995 H2 WAT 5829 80.068 124.403 9.047 1.00 0.00 H TER 52997 WAT 5829 ATOM 52997 O WAT 5830 72.633 48.491 82.242 1.00 0.00 O ATOM 52998 H1 WAT 5830 71.777 48.361 81.833 1.00 0.00 H ATOM 52999 H2 WAT 5830 72.951 49.316 81.875 1.00 0.00 H TER 53001 WAT 5830 ATOM 53001 O WAT 5831 40.465 60.296 16.392 1.00 0.00 O ATOM 53002 H1 WAT 5831 40.395 60.828 15.600 1.00 0.00 H ATOM 53003 H2 WAT 5831 41.345 59.922 16.352 1.00 0.00 H TER 53005 WAT 5831 ATOM 53005 O WAT 5832 36.241 69.686 10.671 1.00 0.00 O ATOM 53006 H1 WAT 5832 35.411 69.913 10.251 1.00 0.00 H ATOM 53007 H2 WAT 5832 36.747 70.498 10.654 1.00 0.00 H TER 53009 WAT 5832 ATOM 53009 O WAT 5833 115.543 68.349 145.869 1.00 0.00 O ATOM 53010 H1 WAT 5833 115.751 68.664 144.990 1.00 0.00 H ATOM 53011 H2 WAT 5833 114.909 67.645 145.728 1.00 0.00 H TER 53013 WAT 5833 ATOM 53013 O WAT 5834 133.235 128.614 125.071 1.00 0.00 O ATOM 53014 H1 WAT 5834 133.417 128.460 124.144 1.00 0.00 H ATOM 53015 H2 WAT 5834 132.442 128.107 125.247 1.00 0.00 H TER 53017 WAT 5834 ATOM 53017 O WAT 5835 59.831 144.502 153.637 1.00 0.00 O ATOM 53018 H1 WAT 5835 60.180 145.392 153.692 1.00 0.00 H ATOM 53019 H2 WAT 5835 60.585 143.938 153.809 1.00 0.00 H TER 53021 WAT 5835 ATOM 53021 O WAT 5836 78.119 29.359 84.528 1.00 0.00 O ATOM 53022 H1 WAT 5836 78.433 29.988 83.879 1.00 0.00 H ATOM 53023 H2 WAT 5836 78.417 29.711 85.367 1.00 0.00 H TER 53025 WAT 5836 ATOM 53025 O WAT 5837 133.203 104.973 137.696 1.00 0.00 O ATOM 53026 H1 WAT 5837 132.877 104.306 137.091 1.00 0.00 H ATOM 53027 H2 WAT 5837 132.596 105.707 137.592 1.00 0.00 H TER 53029 WAT 5837 ATOM 53029 O WAT 5838 33.732 137.494 13.860 1.00 0.00 O ATOM 53030 H1 WAT 5838 34.213 136.739 13.521 1.00 0.00 H ATOM 53031 H2 WAT 5838 33.614 138.063 13.100 1.00 0.00 H TER 53033 WAT 5838 ATOM 53033 O WAT 5839 109.518 126.297 94.395 1.00 0.00 O ATOM 53034 H1 WAT 5839 109.682 125.465 93.952 1.00 0.00 H ATOM 53035 H2 WAT 5839 110.256 126.852 94.144 1.00 0.00 H TER 53037 WAT 5839 ATOM 53037 O WAT 5840 121.075 43.476 144.030 1.00 0.00 O ATOM 53038 H1 WAT 5840 121.431 44.226 144.506 1.00 0.00 H ATOM 53039 H2 WAT 5840 121.845 43.013 143.701 1.00 0.00 H TER 53041 WAT 5840 ATOM 53041 O WAT 5841 108.047 35.779 78.251 1.00 0.00 O ATOM 53042 H1 WAT 5841 107.181 35.805 78.658 1.00 0.00 H ATOM 53043 H2 WAT 5841 108.016 36.460 77.579 1.00 0.00 H TER 53045 WAT 5841 ATOM 53045 O WAT 5842 26.757 120.490 105.247 1.00 0.00 O ATOM 53046 H1 WAT 5842 27.177 119.699 105.585 1.00 0.00 H ATOM 53047 H2 WAT 5842 27.484 121.060 104.998 1.00 0.00 H TER 53049 WAT 5842 ATOM 53049 O WAT 5843 105.599 116.356 58.213 1.00 0.00 O ATOM 53050 H1 WAT 5843 106.163 117.121 58.326 1.00 0.00 H ATOM 53051 H2 WAT 5843 104.986 116.399 58.947 1.00 0.00 H TER 53053 WAT 5843 ATOM 53053 O WAT 5844 117.162 129.938 59.141 1.00 0.00 O ATOM 53054 H1 WAT 5844 116.597 129.885 58.370 1.00 0.00 H ATOM 53055 H2 WAT 5844 116.948 130.783 59.537 1.00 0.00 H TER 53057 WAT 5844 ATOM 53057 O WAT 5845 26.169 22.441 135.645 1.00 0.00 O ATOM 53058 H1 WAT 5845 25.221 22.563 135.694 1.00 0.00 H ATOM 53059 H2 WAT 5845 26.521 23.328 135.571 1.00 0.00 H TER 53061 WAT 5845 ATOM 53061 O WAT 5846 85.906 10.574 155.768 1.00 0.00 O ATOM 53062 H1 WAT 5846 86.023 9.746 155.302 1.00 0.00 H ATOM 53063 H2 WAT 5846 85.297 10.366 156.476 1.00 0.00 H TER 53065 WAT 5846 ATOM 53065 O WAT 5847 129.538 88.478 155.397 1.00 0.00 O ATOM 53066 H1 WAT 5847 129.623 88.554 154.446 1.00 0.00 H ATOM 53067 H2 WAT 5847 129.059 87.660 155.529 1.00 0.00 H TER 53069 WAT 5847 ATOM 53069 O WAT 5848 6.978 142.435 137.365 1.00 0.00 O ATOM 53070 H1 WAT 5848 6.169 142.910 137.556 1.00 0.00 H ATOM 53071 H2 WAT 5848 6.705 141.716 136.794 1.00 0.00 H TER 53073 WAT 5848 ATOM 53073 O WAT 5849 99.148 38.025 107.860 1.00 0.00 O ATOM 53074 H1 WAT 5849 99.401 37.513 108.629 1.00 0.00 H ATOM 53075 H2 WAT 5849 99.973 38.203 107.409 1.00 0.00 H TER 53077 WAT 5849 ATOM 53077 O WAT 5850 4.070 133.016 148.555 1.00 0.00 O ATOM 53078 H1 WAT 5850 4.124 132.401 149.287 1.00 0.00 H ATOM 53079 H2 WAT 5850 4.796 132.770 147.981 1.00 0.00 H TER 53081 WAT 5850 ATOM 53081 O WAT 5851 93.732 45.421 135.872 1.00 0.00 O ATOM 53082 H1 WAT 5851 92.870 45.132 136.172 1.00 0.00 H ATOM 53083 H2 WAT 5851 93.727 45.253 134.930 1.00 0.00 H TER 53085 WAT 5851 ATOM 53085 O WAT 5852 131.595 57.464 63.641 1.00 0.00 O ATOM 53086 H1 WAT 5852 132.384 57.763 64.093 1.00 0.00 H ATOM 53087 H2 WAT 5852 131.920 56.921 62.923 1.00 0.00 H TER 53089 WAT 5852 ATOM 53089 O WAT 5853 137.015 83.128 78.547 1.00 0.00 O ATOM 53090 H1 WAT 5853 136.685 82.397 78.025 1.00 0.00 H ATOM 53091 H2 WAT 5853 137.089 83.852 77.924 1.00 0.00 H TER 53093 WAT 5853 ATOM 53093 O WAT 5854 78.640 2.281 2.492 1.00 0.00 O ATOM 53094 H1 WAT 5854 79.314 2.961 2.506 1.00 0.00 H ATOM 53095 H2 WAT 5854 79.128 1.462 2.400 1.00 0.00 H TER 53097 WAT 5854 ATOM 53097 O WAT 5855 0.921 102.845 129.574 1.00 0.00 O ATOM 53098 H1 WAT 5855 1.247 101.991 129.291 1.00 0.00 H ATOM 53099 H2 WAT 5855 1.221 103.452 128.897 1.00 0.00 H TER 53101 WAT 5855 ATOM 53101 O WAT 5856 118.719 38.023 16.501 1.00 0.00 O ATOM 53102 H1 WAT 5856 118.598 38.306 17.407 1.00 0.00 H ATOM 53103 H2 WAT 5856 118.449 38.777 15.976 1.00 0.00 H TER 53105 WAT 5856 ATOM 53105 O WAT 5857 95.890 13.330 135.140 1.00 0.00 O ATOM 53106 H1 WAT 5857 95.359 12.600 134.821 1.00 0.00 H ATOM 53107 H2 WAT 5857 96.714 12.926 135.411 1.00 0.00 H TER 53109 WAT 5857 ATOM 53109 O WAT 5858 40.135 66.161 142.832 1.00 0.00 O ATOM 53110 H1 WAT 5858 40.057 65.441 143.457 1.00 0.00 H ATOM 53111 H2 WAT 5858 40.527 65.762 142.055 1.00 0.00 H TER 53113 WAT 5858 ATOM 53113 O WAT 5859 16.631 65.443 125.740 1.00 0.00 O ATOM 53114 H1 WAT 5859 16.946 65.980 125.013 1.00 0.00 H ATOM 53115 H2 WAT 5859 17.424 65.188 126.211 1.00 0.00 H TER 53117 WAT 5859 ATOM 53117 O WAT 5860 90.430 118.936 9.390 1.00 0.00 O ATOM 53118 H1 WAT 5860 90.961 119.560 8.895 1.00 0.00 H ATOM 53119 H2 WAT 5860 89.728 118.688 8.788 1.00 0.00 H TER 53121 WAT 5860 ATOM 53121 O WAT 5861 61.715 4.746 150.889 1.00 0.00 O ATOM 53122 H1 WAT 5861 61.263 5.435 151.377 1.00 0.00 H ATOM 53123 H2 WAT 5861 61.324 4.777 150.016 1.00 0.00 H TER 53125 WAT 5861 ATOM 53125 O WAT 5862 117.274 116.579 139.538 1.00 0.00 O ATOM 53126 H1 WAT 5862 118.114 116.279 139.190 1.00 0.00 H ATOM 53127 H2 WAT 5862 116.621 116.055 139.075 1.00 0.00 H TER 53129 WAT 5862 ATOM 53129 O WAT 5863 17.673 136.490 6.526 1.00 0.00 O ATOM 53130 H1 WAT 5863 17.892 135.564 6.629 1.00 0.00 H ATOM 53131 H2 WAT 5863 17.847 136.874 7.385 1.00 0.00 H TER 53133 WAT 5863 ATOM 53133 O WAT 5864 120.636 5.583 141.197 1.00 0.00 O ATOM 53134 H1 WAT 5864 120.756 6.487 140.905 1.00 0.00 H ATOM 53135 H2 WAT 5864 120.125 5.658 142.003 1.00 0.00 H TER 53137 WAT 5864 ATOM 53137 O WAT 5865 28.193 142.889 71.889 1.00 0.00 O ATOM 53138 H1 WAT 5865 28.637 143.406 72.561 1.00 0.00 H ATOM 53139 H2 WAT 5865 28.625 143.137 71.072 1.00 0.00 H TER 53141 WAT 5865 ATOM 53141 O WAT 5866 110.104 104.347 127.602 1.00 0.00 O ATOM 53142 H1 WAT 5866 110.538 103.906 128.332 1.00 0.00 H ATOM 53143 H2 WAT 5866 109.969 105.243 127.911 1.00 0.00 H TER 53145 WAT 5866 ATOM 53145 O WAT 5867 69.120 15.807 5.353 1.00 0.00 O ATOM 53146 H1 WAT 5867 69.110 15.170 6.067 1.00 0.00 H ATOM 53147 H2 WAT 5867 69.861 15.544 4.807 1.00 0.00 H TER 53149 WAT 5867 ATOM 53149 O WAT 5868 133.954 100.942 4.186 1.00 0.00 O ATOM 53150 H1 WAT 5868 133.652 100.342 3.504 1.00 0.00 H ATOM 53151 H2 WAT 5868 134.218 100.372 4.908 1.00 0.00 H TER 53153 WAT 5868 ATOM 53153 O WAT 5869 52.505 123.342 93.619 1.00 0.00 O ATOM 53154 H1 WAT 5869 51.760 123.411 94.216 1.00 0.00 H ATOM 53155 H2 WAT 5869 52.875 122.477 93.795 1.00 0.00 H TER 53157 WAT 5869 ATOM 53157 O WAT 5870 86.082 95.068 64.434 1.00 0.00 O ATOM 53158 H1 WAT 5870 86.063 95.858 64.975 1.00 0.00 H ATOM 53159 H2 WAT 5870 86.090 95.395 63.534 1.00 0.00 H TER 53161 WAT 5870 ATOM 53161 O WAT 5871 86.787 107.049 136.519 1.00 0.00 O ATOM 53162 H1 WAT 5871 86.606 106.691 137.389 1.00 0.00 H ATOM 53163 H2 WAT 5871 85.923 107.162 136.123 1.00 0.00 H TER 53165 WAT 5871 ATOM 53165 O WAT 5872 123.584 35.161 143.080 1.00 0.00 O ATOM 53166 H1 WAT 5872 123.381 35.372 143.991 1.00 0.00 H ATOM 53167 H2 WAT 5872 124.528 35.004 143.075 1.00 0.00 H TER 53169 WAT 5872 ATOM 53169 O WAT 5873 106.330 108.266 2.244 1.00 0.00 O ATOM 53170 H1 WAT 5873 105.841 108.205 3.064 1.00 0.00 H ATOM 53171 H2 WAT 5873 107.246 108.327 2.515 1.00 0.00 H TER 53173 WAT 5873 ATOM 53173 O WAT 5874 99.795 66.740 69.185 1.00 0.00 O ATOM 53174 H1 WAT 5874 100.408 67.368 69.569 1.00 0.00 H ATOM 53175 H2 WAT 5874 100.216 66.460 68.373 1.00 0.00 H TER 53177 WAT 5874 ATOM 53177 O WAT 5875 4.829 51.416 150.683 1.00 0.00 O ATOM 53178 H1 WAT 5875 5.702 51.803 150.622 1.00 0.00 H ATOM 53179 H2 WAT 5875 4.270 52.131 150.988 1.00 0.00 H TER 53181 WAT 5875 ATOM 53181 O WAT 5876 103.405 39.861 141.410 1.00 0.00 O ATOM 53182 H1 WAT 5876 103.863 39.573 140.621 1.00 0.00 H ATOM 53183 H2 WAT 5876 102.480 39.701 141.222 1.00 0.00 H TER 53185 WAT 5876 ATOM 53185 O WAT 5877 120.392 57.097 144.842 1.00 0.00 O ATOM 53186 H1 WAT 5877 120.155 56.498 145.550 1.00 0.00 H ATOM 53187 H2 WAT 5877 121.179 57.541 145.156 1.00 0.00 H TER 53189 WAT 5877 ATOM 53189 O WAT 5878 89.946 21.133 128.403 1.00 0.00 O ATOM 53190 H1 WAT 5878 90.164 20.644 129.197 1.00 0.00 H ATOM 53191 H2 WAT 5878 90.791 21.414 128.054 1.00 0.00 H TER 53193 WAT 5878 ATOM 53193 O WAT 5879 122.030 64.793 119.762 1.00 0.00 O ATOM 53194 H1 WAT 5879 122.516 65.409 119.214 1.00 0.00 H ATOM 53195 H2 WAT 5879 121.190 64.685 119.316 1.00 0.00 H TER 53197 WAT 5879 ATOM 53197 O WAT 5880 125.604 29.333 3.768 1.00 0.00 O ATOM 53198 H1 WAT 5880 124.899 29.874 3.413 1.00 0.00 H ATOM 53199 H2 WAT 5880 125.268 29.022 4.608 1.00 0.00 H TER 53201 WAT 5880 ATOM 53201 O WAT 5881 93.467 97.791 15.762 1.00 0.00 O ATOM 53202 H1 WAT 5881 93.434 98.711 15.499 1.00 0.00 H ATOM 53203 H2 WAT 5881 94.340 97.681 16.139 1.00 0.00 H TER 53205 WAT 5881 ATOM 53205 O WAT 5882 46.727 8.388 93.655 1.00 0.00 O ATOM 53206 H1 WAT 5882 46.321 7.890 94.364 1.00 0.00 H ATOM 53207 H2 WAT 5882 47.034 7.722 93.040 1.00 0.00 H TER 53209 WAT 5882 ATOM 53209 O WAT 5883 100.360 73.499 117.713 1.00 0.00 O ATOM 53210 H1 WAT 5883 100.148 72.602 117.455 1.00 0.00 H ATOM 53211 H2 WAT 5883 101.261 73.626 117.416 1.00 0.00 H TER 53213 WAT 5883 ATOM 53213 O WAT 5884 3.032 69.517 131.705 1.00 0.00 O ATOM 53214 H1 WAT 5884 2.390 68.978 132.168 1.00 0.00 H ATOM 53215 H2 WAT 5884 3.363 68.950 131.009 1.00 0.00 H TER 53217 WAT 5884 ATOM 53217 O WAT 5885 13.080 55.396 117.405 1.00 0.00 O ATOM 53218 H1 WAT 5885 12.534 56.182 117.416 1.00 0.00 H ATOM 53219 H2 WAT 5885 13.921 55.694 117.057 1.00 0.00 H TER 53221 WAT 5885 ATOM 53221 O WAT 5886 114.241 55.505 83.319 1.00 0.00 O ATOM 53222 H1 WAT 5886 114.561 54.989 84.058 1.00 0.00 H ATOM 53223 H2 WAT 5886 114.945 55.460 82.672 1.00 0.00 H TER 53225 WAT 5886 ATOM 53225 O WAT 5887 112.345 129.391 143.043 1.00 0.00 O ATOM 53226 H1 WAT 5887 111.624 129.826 143.498 1.00 0.00 H ATOM 53227 H2 WAT 5887 112.486 128.582 143.535 1.00 0.00 H TER 53229 WAT 5887 ATOM 53229 O WAT 5888 43.736 110.237 9.203 1.00 0.00 O ATOM 53230 H1 WAT 5888 43.819 109.594 9.907 1.00 0.00 H ATOM 53231 H2 WAT 5888 44.008 111.064 9.600 1.00 0.00 H TER 53233 WAT 5888 ATOM 53233 O WAT 5889 110.707 133.712 131.335 1.00 0.00 O ATOM 53234 H1 WAT 5889 111.319 134.054 130.684 1.00 0.00 H ATOM 53235 H2 WAT 5889 110.322 132.940 130.919 1.00 0.00 H TER 53237 WAT 5889 ATOM 53237 O WAT 5890 18.731 27.114 18.926 1.00 0.00 O ATOM 53238 H1 WAT 5890 18.579 26.217 19.222 1.00 0.00 H ATOM 53239 H2 WAT 5890 18.246 27.657 19.547 1.00 0.00 H TER 53241 WAT 5890 ATOM 53241 O WAT 5891 32.514 101.454 119.416 1.00 0.00 O ATOM 53242 H1 WAT 5891 31.877 102.104 119.119 1.00 0.00 H ATOM 53243 H2 WAT 5891 32.625 101.638 120.349 1.00 0.00 H TER 53245 WAT 5891 ATOM 53245 O WAT 5892 43.585 131.336 144.408 1.00 0.00 O ATOM 53246 H1 WAT 5892 42.852 130.908 143.966 1.00 0.00 H ATOM 53247 H2 WAT 5892 44.342 131.152 143.852 1.00 0.00 H TER 53249 WAT 5892 ATOM 53249 O WAT 5893 122.960 25.605 80.689 1.00 0.00 O ATOM 53250 H1 WAT 5893 122.351 26.062 81.270 1.00 0.00 H ATOM 53251 H2 WAT 5893 122.762 25.948 79.817 1.00 0.00 H TER 53253 WAT 5893 ATOM 53253 O WAT 5894 36.988 91.342 68.188 1.00 0.00 O ATOM 53254 H1 WAT 5894 37.701 90.823 68.559 1.00 0.00 H ATOM 53255 H2 WAT 5894 36.204 91.029 68.637 1.00 0.00 H TER 53257 WAT 5894 ATOM 53257 O WAT 5895 117.367 84.212 65.778 1.00 0.00 O ATOM 53258 H1 WAT 5895 118.199 84.412 66.207 1.00 0.00 H ATOM 53259 H2 WAT 5895 116.834 83.811 66.464 1.00 0.00 H TER 53261 WAT 5895 ATOM 53261 O WAT 5896 70.683 112.225 10.557 1.00 0.00 O ATOM 53262 H1 WAT 5896 69.771 111.943 10.633 1.00 0.00 H ATOM 53263 H2 WAT 5896 70.654 112.966 9.952 1.00 0.00 H TER 53265 WAT 5896 ATOM 53265 O WAT 5897 52.707 43.426 66.342 1.00 0.00 O ATOM 53266 H1 WAT 5897 52.586 43.508 67.288 1.00 0.00 H ATOM 53267 H2 WAT 5897 52.499 42.511 66.152 1.00 0.00 H TER 53269 WAT 5897 ATOM 53269 O WAT 5898 2.288 137.163 86.748 1.00 0.00 O ATOM 53270 H1 WAT 5898 1.703 136.874 86.048 1.00 0.00 H ATOM 53271 H2 WAT 5898 3.023 137.573 86.293 1.00 0.00 H TER 53273 WAT 5898 ATOM 53273 O WAT 5899 45.030 90.538 113.484 1.00 0.00 O ATOM 53274 H1 WAT 5899 45.787 91.102 113.642 1.00 0.00 H ATOM 53275 H2 WAT 5899 44.501 91.020 112.848 1.00 0.00 H TER 53277 WAT 5899 ATOM 53277 O WAT 5900 62.762 73.650 7.362 1.00 0.00 O ATOM 53278 H1 WAT 5900 63.490 73.956 7.903 1.00 0.00 H ATOM 53279 H2 WAT 5900 62.407 72.900 7.838 1.00 0.00 H TER 53281 WAT 5900 ATOM 53281 O WAT 5901 100.401 31.020 116.779 1.00 0.00 O ATOM 53282 H1 WAT 5901 99.557 31.463 116.865 1.00 0.00 H ATOM 53283 H2 WAT 5901 100.219 30.109 117.010 1.00 0.00 H TER 53285 WAT 5901 ATOM 53285 O WAT 5902 1.733 127.864 134.966 1.00 0.00 O ATOM 53286 H1 WAT 5902 0.887 127.452 134.791 1.00 0.00 H ATOM 53287 H2 WAT 5902 1.697 128.101 135.893 1.00 0.00 H TER 53289 WAT 5902 ATOM 53289 O WAT 5903 58.830 103.541 111.869 1.00 0.00 O ATOM 53290 H1 WAT 5903 59.368 104.210 112.293 1.00 0.00 H ATOM 53291 H2 WAT 5903 59.434 102.816 111.707 1.00 0.00 H TER 53293 WAT 5903 ATOM 53293 O WAT 5904 130.260 24.630 100.734 1.00 0.00 O ATOM 53294 H1 WAT 5904 130.214 25.380 100.142 1.00 0.00 H ATOM 53295 H2 WAT 5904 130.271 25.016 101.610 1.00 0.00 H TER 53297 WAT 5904 ATOM 53297 O WAT 5905 142.279 124.517 130.966 1.00 0.00 O ATOM 53298 H1 WAT 5905 143.197 124.708 130.777 1.00 0.00 H ATOM 53299 H2 WAT 5905 142.309 123.821 131.622 1.00 0.00 H TER 53301 WAT 5905 ATOM 53301 O WAT 5906 104.345 17.898 84.944 1.00 0.00 O ATOM 53302 H1 WAT 5906 104.299 18.824 84.707 1.00 0.00 H ATOM 53303 H2 WAT 5906 103.503 17.537 84.667 1.00 0.00 H TER 53305 WAT 5906 ATOM 53305 O WAT 5907 95.402 141.000 127.183 1.00 0.00 O ATOM 53306 H1 WAT 5907 95.029 140.573 126.411 1.00 0.00 H ATOM 53307 H2 WAT 5907 94.707 140.957 127.840 1.00 0.00 H TER 53309 WAT 5907 ATOM 53309 O WAT 5908 80.127 109.191 141.895 1.00 0.00 O ATOM 53310 H1 WAT 5908 79.764 110.075 141.834 1.00 0.00 H ATOM 53311 H2 WAT 5908 79.848 108.761 141.087 1.00 0.00 H TER 53313 WAT 5908 ATOM 53313 O WAT 5909 84.458 53.682 71.799 1.00 0.00 O ATOM 53314 H1 WAT 5909 85.065 52.981 72.038 1.00 0.00 H ATOM 53315 H2 WAT 5909 84.952 54.227 71.186 1.00 0.00 H TER 53317 WAT 5909 ATOM 53317 O WAT 5910 13.814 26.918 144.676 1.00 0.00 O ATOM 53318 H1 WAT 5910 14.085 26.595 145.535 1.00 0.00 H ATOM 53319 H2 WAT 5910 14.414 26.496 144.061 1.00 0.00 H TER 53321 WAT 5910 ATOM 53321 O WAT 5911 75.046 81.065 131.744 1.00 0.00 O ATOM 53322 H1 WAT 5911 75.988 80.992 131.592 1.00 0.00 H ATOM 53323 H2 WAT 5911 74.706 80.188 131.566 1.00 0.00 H TER 53325 WAT 5911 ATOM 53325 O WAT 5912 31.407 26.436 3.214 1.00 0.00 O ATOM 53326 H1 WAT 5912 30.946 27.192 2.849 1.00 0.00 H ATOM 53327 H2 WAT 5912 31.132 25.701 2.667 1.00 0.00 H TER 53329 WAT 5912 ATOM 53329 O WAT 5913 78.248 29.485 15.435 1.00 0.00 O ATOM 53330 H1 WAT 5913 78.767 30.048 16.009 1.00 0.00 H ATOM 53331 H2 WAT 5913 78.846 29.248 14.726 1.00 0.00 H TER 53333 WAT 5913 ATOM 53333 O WAT 5914 99.866 138.485 71.317 1.00 0.00 O ATOM 53334 H1 WAT 5914 100.010 137.543 71.229 1.00 0.00 H ATOM 53335 H2 WAT 5914 99.577 138.765 70.448 1.00 0.00 H TER 53337 WAT 5914 ATOM 53337 O WAT 5915 0.544 92.041 151.946 1.00 0.00 O ATOM 53338 H1 WAT 5915 0.330 91.644 151.102 1.00 0.00 H ATOM 53339 H2 WAT 5915 0.216 91.418 152.594 1.00 0.00 H TER 53341 WAT 5915 ATOM 53341 O WAT 5916 44.588 18.532 130.370 1.00 0.00 O ATOM 53342 H1 WAT 5916 44.377 17.604 130.268 1.00 0.00 H ATOM 53343 H2 WAT 5916 44.443 18.710 131.299 1.00 0.00 H TER 53345 WAT 5916 ATOM 53345 O WAT 5917 139.853 22.322 140.987 1.00 0.00 O ATOM 53346 H1 WAT 5917 139.537 22.728 141.794 1.00 0.00 H ATOM 53347 H2 WAT 5917 139.440 21.459 140.975 1.00 0.00 H TER 53349 WAT 5917 ATOM 53349 O WAT 5918 20.038 132.730 119.695 1.00 0.00 O ATOM 53350 H1 WAT 5918 20.826 132.660 120.234 1.00 0.00 H ATOM 53351 H2 WAT 5918 20.279 132.321 118.864 1.00 0.00 H TER 53353 WAT 5918 ATOM 53353 O WAT 5919 130.598 111.809 26.742 1.00 0.00 O ATOM 53354 H1 WAT 5919 131.367 111.719 27.304 1.00 0.00 H ATOM 53355 H2 WAT 5919 130.581 112.737 26.507 1.00 0.00 H TER 53357 WAT 5919 ATOM 53357 O WAT 5920 79.772 78.601 81.103 1.00 0.00 O ATOM 53358 H1 WAT 5920 80.632 78.620 80.684 1.00 0.00 H ATOM 53359 H2 WAT 5920 79.186 79.010 80.467 1.00 0.00 H TER 53361 WAT 5920 ATOM 53361 O WAT 5921 138.294 11.622 104.462 1.00 0.00 O ATOM 53362 H1 WAT 5921 138.830 12.055 105.125 1.00 0.00 H ATOM 53363 H2 WAT 5921 138.669 11.906 103.628 1.00 0.00 H TER 53365 WAT 5921 ATOM 53365 O WAT 5922 2.772 13.331 89.710 1.00 0.00 O ATOM 53366 H1 WAT 5922 1.975 12.852 89.937 1.00 0.00 H ATOM 53367 H2 WAT 5922 2.526 13.856 88.948 1.00 0.00 H TER 53369 WAT 5922 ATOM 53369 O WAT 5923 45.012 23.012 72.451 1.00 0.00 O ATOM 53370 H1 WAT 5923 44.062 22.909 72.510 1.00 0.00 H ATOM 53371 H2 WAT 5923 45.364 22.221 72.859 1.00 0.00 H TER 53373 WAT 5923 ATOM 53373 O WAT 5924 40.993 131.567 129.483 1.00 0.00 O ATOM 53374 H1 WAT 5924 41.138 132.092 130.270 1.00 0.00 H ATOM 53375 H2 WAT 5924 40.499 132.143 128.899 1.00 0.00 H TER 53377 WAT 5924 ATOM 53377 O WAT 5925 57.492 25.077 104.119 1.00 0.00 O ATOM 53378 H1 WAT 5925 58.186 24.646 103.620 1.00 0.00 H ATOM 53379 H2 WAT 5925 56.692 24.892 103.626 1.00 0.00 H TER 53381 WAT 5925 ATOM 53381 O WAT 5926 113.245 5.429 57.572 1.00 0.00 O ATOM 53382 H1 WAT 5926 113.561 6.280 57.267 1.00 0.00 H ATOM 53383 H2 WAT 5926 112.292 5.496 57.522 1.00 0.00 H TER 53385 WAT 5926 ATOM 53385 O WAT 5927 36.287 98.974 131.710 1.00 0.00 O ATOM 53386 H1 WAT 5927 35.443 99.219 132.089 1.00 0.00 H ATOM 53387 H2 WAT 5927 36.882 98.932 132.459 1.00 0.00 H TER 53389 WAT 5927 ATOM 53389 O WAT 5928 5.960 144.239 81.599 1.00 0.00 O ATOM 53390 H1 WAT 5928 5.154 143.734 81.488 1.00 0.00 H ATOM 53391 H2 WAT 5928 5.754 145.101 81.237 1.00 0.00 H TER 53393 WAT 5928 ATOM 53393 O WAT 5929 126.040 26.619 78.627 1.00 0.00 O ATOM 53394 H1 WAT 5929 125.885 26.971 79.504 1.00 0.00 H ATOM 53395 H2 WAT 5929 126.383 27.360 78.129 1.00 0.00 H TER 53397 WAT 5929 ATOM 53397 O WAT 5930 14.967 142.192 2.986 1.00 0.00 O ATOM 53398 H1 WAT 5930 14.762 142.820 3.677 1.00 0.00 H ATOM 53399 H2 WAT 5930 15.841 141.869 3.207 1.00 0.00 H TER 53401 WAT 5930 ATOM 53401 O WAT 5931 18.577 114.909 18.093 1.00 0.00 O ATOM 53402 H1 WAT 5931 18.709 114.185 18.705 1.00 0.00 H ATOM 53403 H2 WAT 5931 17.775 114.682 17.622 1.00 0.00 H TER 53405 WAT 5931 ATOM 53405 O WAT 5932 132.236 127.331 157.852 1.00 0.00 O ATOM 53406 H1 WAT 5932 132.829 128.073 157.971 1.00 0.00 H ATOM 53407 H2 WAT 5932 131.361 127.705 157.954 1.00 0.00 H TER 53409 WAT 5932 ATOM 53409 O WAT 5933 104.700 0.382 19.289 1.00 0.00 O ATOM 53410 H1 WAT 5933 105.429 -0.065 18.859 1.00 0.00 H ATOM 53411 H2 WAT 5933 104.562 -0.108 20.099 1.00 0.00 H TER 53413 WAT 5933 ATOM 53413 O WAT 5934 85.901 15.967 83.169 1.00 0.00 O ATOM 53414 H1 WAT 5934 85.166 15.584 82.690 1.00 0.00 H ATOM 53415 H2 WAT 5934 85.502 16.368 83.941 1.00 0.00 H TER 53417 WAT 5934 ATOM 53417 O WAT 5935 129.942 87.127 114.647 1.00 0.00 O ATOM 53418 H1 WAT 5935 129.136 86.701 114.939 1.00 0.00 H ATOM 53419 H2 WAT 5935 130.168 86.680 113.831 1.00 0.00 H TER 53421 WAT 5935 ATOM 53421 O WAT 5936 0.789 88.065 150.428 1.00 0.00 O ATOM 53422 H1 WAT 5936 0.764 88.160 149.475 1.00 0.00 H ATOM 53423 H2 WAT 5936 0.398 87.207 150.593 1.00 0.00 H TER 53425 WAT 5936 ATOM 53425 O WAT 5937 120.576 79.101 79.014 1.00 0.00 O ATOM 53426 H1 WAT 5937 120.299 78.397 79.600 1.00 0.00 H ATOM 53427 H2 WAT 5937 121.517 78.966 78.907 1.00 0.00 H TER 53429 WAT 5937 ATOM 53429 O WAT 5938 104.822 111.359 141.846 1.00 0.00 O ATOM 53430 H1 WAT 5938 104.050 111.388 142.411 1.00 0.00 H ATOM 53431 H2 WAT 5938 105.408 112.024 142.208 1.00 0.00 H TER 53433 WAT 5938 ATOM 53433 O WAT 5939 60.358 84.076 134.302 1.00 0.00 O ATOM 53434 H1 WAT 5939 60.288 85.030 134.301 1.00 0.00 H ATOM 53435 H2 WAT 5939 59.614 83.781 133.777 1.00 0.00 H TER 53437 WAT 5939 ATOM 53437 O WAT 5940 33.403 115.363 102.302 1.00 0.00 O ATOM 53438 H1 WAT 5940 33.265 116.246 101.962 1.00 0.00 H ATOM 53439 H2 WAT 5940 34.340 115.324 102.493 1.00 0.00 H TER 53441 WAT 5940 ATOM 53441 O WAT 5941 109.328 40.026 125.823 1.00 0.00 O ATOM 53442 H1 WAT 5941 108.717 40.665 126.190 1.00 0.00 H ATOM 53443 H2 WAT 5941 109.995 39.916 126.500 1.00 0.00 H TER 53445 WAT 5941 ATOM 53445 O WAT 5942 125.686 107.814 103.824 1.00 0.00 O ATOM 53446 H1 WAT 5942 125.238 107.995 102.998 1.00 0.00 H ATOM 53447 H2 WAT 5942 125.418 106.924 104.052 1.00 0.00 H TER 53449 WAT 5942 ATOM 53449 O WAT 5943 116.108 12.279 140.430 1.00 0.00 O ATOM 53450 H1 WAT 5943 116.496 12.133 139.567 1.00 0.00 H ATOM 53451 H2 WAT 5943 116.744 11.912 141.044 1.00 0.00 H TER 53453 WAT 5943 ATOM 53453 O WAT 5944 88.870 7.282 93.797 1.00 0.00 O ATOM 53454 H1 WAT 5944 88.166 7.685 94.305 1.00 0.00 H ATOM 53455 H2 WAT 5944 89.002 7.876 93.058 1.00 0.00 H TER 53457 WAT 5944 ATOM 53457 O WAT 5945 55.551 98.825 7.436 1.00 0.00 O ATOM 53458 H1 WAT 5945 55.846 97.978 7.101 1.00 0.00 H ATOM 53459 H2 WAT 5945 54.628 98.872 7.187 1.00 0.00 H TER 53461 WAT 5945 ATOM 53461 O WAT 5946 102.713 74.157 150.987 1.00 0.00 O ATOM 53462 H1 WAT 5946 102.842 75.102 150.903 1.00 0.00 H ATOM 53463 H2 WAT 5946 102.794 73.824 150.093 1.00 0.00 H TER 53465 WAT 5946 ATOM 53465 O WAT 5947 44.258 81.925 125.137 1.00 0.00 O ATOM 53466 H1 WAT 5947 44.495 82.695 125.653 1.00 0.00 H ATOM 53467 H2 WAT 5947 45.074 81.433 125.051 1.00 0.00 H TER 53469 WAT 5947 ATOM 53469 O WAT 5948 30.225 111.567 66.540 1.00 0.00 O ATOM 53470 H1 WAT 5948 29.486 111.342 67.105 1.00 0.00 H ATOM 53471 H2 WAT 5948 30.620 112.333 66.955 1.00 0.00 H TER 53473 WAT 5948 ATOM 53473 O WAT 5949 19.047 50.532 103.107 1.00 0.00 O ATOM 53474 H1 WAT 5949 19.392 49.684 102.825 1.00 0.00 H ATOM 53475 H2 WAT 5949 18.649 50.902 102.319 1.00 0.00 H TER 53477 WAT 5949 ATOM 53477 O WAT 5950 114.343 137.012 133.698 1.00 0.00 O ATOM 53478 H1 WAT 5950 115.079 136.457 133.956 1.00 0.00 H ATOM 53479 H2 WAT 5950 113.614 136.710 134.240 1.00 0.00 H TER 53481 WAT 5950 ATOM 53481 O WAT 5951 121.912 28.990 155.706 1.00 0.00 O ATOM 53482 H1 WAT 5951 121.927 28.184 156.222 1.00 0.00 H ATOM 53483 H2 WAT 5951 122.271 28.737 154.856 1.00 0.00 H TER 53485 WAT 5951 ATOM 53485 O WAT 5952 17.752 37.104 132.494 1.00 0.00 O ATOM 53486 H1 WAT 5952 16.885 37.164 132.093 1.00 0.00 H ATOM 53487 H2 WAT 5952 18.343 36.927 131.763 1.00 0.00 H TER 53489 WAT 5952 ATOM 53489 O WAT 5953 109.311 136.035 131.306 1.00 0.00 O ATOM 53490 H1 WAT 5953 109.676 135.160 131.173 1.00 0.00 H ATOM 53491 H2 WAT 5953 108.928 136.004 132.182 1.00 0.00 H TER 53493 WAT 5953 ATOM 53493 O WAT 5954 101.138 9.274 73.312 1.00 0.00 O ATOM 53494 H1 WAT 5954 101.231 9.948 73.986 1.00 0.00 H ATOM 53495 H2 WAT 5954 101.211 8.447 73.788 1.00 0.00 H TER 53497 WAT 5954 ATOM 53497 O WAT 5955 138.206 68.537 99.814 1.00 0.00 O ATOM 53498 H1 WAT 5955 138.015 68.306 100.723 1.00 0.00 H ATOM 53499 H2 WAT 5955 138.939 67.971 99.572 1.00 0.00 H TER 53501 WAT 5955 ATOM 53501 O WAT 5956 9.389 112.269 1.609 1.00 0.00 O ATOM 53502 H1 WAT 5956 9.758 111.751 0.893 1.00 0.00 H ATOM 53503 H2 WAT 5956 9.348 113.161 1.263 1.00 0.00 H TER 53505 WAT 5956 ATOM 53505 O WAT 5957 125.732 120.562 89.866 1.00 0.00 O ATOM 53506 H1 WAT 5957 126.374 119.852 89.848 1.00 0.00 H ATOM 53507 H2 WAT 5957 125.996 121.105 90.608 1.00 0.00 H TER 53509 WAT 5957 ATOM 53509 O WAT 5958 0.112 106.600 65.518 1.00 0.00 O ATOM 53510 H1 WAT 5958 -0.298 105.776 65.780 1.00 0.00 H ATOM 53511 H2 WAT 5958 0.884 106.672 66.079 1.00 0.00 H TER 53513 WAT 5958 ATOM 53513 O WAT 5959 10.869 52.032 112.847 1.00 0.00 O ATOM 53514 H1 WAT 5959 11.071 51.127 113.083 1.00 0.00 H ATOM 53515 H2 WAT 5959 11.155 52.546 113.602 1.00 0.00 H TER 53517 WAT 5959 ATOM 53517 O WAT 5960 54.641 19.717 82.934 1.00 0.00 O ATOM 53518 H1 WAT 5960 54.449 20.467 82.372 1.00 0.00 H ATOM 53519 H2 WAT 5960 54.082 19.843 83.701 1.00 0.00 H TER 53521 WAT 5960 ATOM 53521 O WAT 5961 27.528 71.841 67.306 1.00 0.00 O ATOM 53522 H1 WAT 5961 27.386 72.753 67.559 1.00 0.00 H ATOM 53523 H2 WAT 5961 28.398 71.630 67.647 1.00 0.00 H TER 53525 WAT 5961 ATOM 53525 O WAT 5962 66.589 121.756 109.022 1.00 0.00 O ATOM 53526 H1 WAT 5962 66.191 121.274 108.297 1.00 0.00 H ATOM 53527 H2 WAT 5962 66.040 121.547 109.778 1.00 0.00 H TER 53529 WAT 5962 ATOM 53529 O WAT 5963 70.034 31.049 71.198 1.00 0.00 O ATOM 53530 H1 WAT 5963 69.590 31.896 71.223 1.00 0.00 H ATOM 53531 H2 WAT 5963 70.017 30.742 72.105 1.00 0.00 H TER 53533 WAT 5963 ATOM 53533 O WAT 5964 135.373 111.731 22.754 1.00 0.00 O ATOM 53534 H1 WAT 5964 134.866 111.029 22.345 1.00 0.00 H ATOM 53535 H2 WAT 5964 134.728 112.238 23.246 1.00 0.00 H TER 53537 WAT 5964 ATOM 53537 O WAT 5965 58.841 143.570 118.595 1.00 0.00 O ATOM 53538 H1 WAT 5965 59.428 144.289 118.361 1.00 0.00 H ATOM 53539 H2 WAT 5965 59.081 143.348 119.495 1.00 0.00 H TER 53541 WAT 5965 ATOM 53541 O WAT 5966 140.509 112.894 99.546 1.00 0.00 O ATOM 53542 H1 WAT 5966 141.242 113.496 99.671 1.00 0.00 H ATOM 53543 H2 WAT 5966 140.919 112.033 99.457 1.00 0.00 H TER 53545 WAT 5966 ATOM 53545 O WAT 5967 1.757 103.807 5.201 1.00 0.00 O ATOM 53546 H1 WAT 5967 2.707 103.815 5.318 1.00 0.00 H ATOM 53547 H2 WAT 5967 1.508 104.732 5.205 1.00 0.00 H TER 53549 WAT 5967 ATOM 53549 O WAT 5968 70.895 39.246 81.084 1.00 0.00 O ATOM 53550 H1 WAT 5968 71.277 39.768 80.379 1.00 0.00 H ATOM 53551 H2 WAT 5968 71.614 39.118 81.703 1.00 0.00 H TER 53553 WAT 5968 ATOM 53553 O WAT 5969 126.187 55.182 23.183 1.00 0.00 O ATOM 53554 H1 WAT 5969 126.203 54.965 24.115 1.00 0.00 H ATOM 53555 H2 WAT 5969 125.266 55.101 22.934 1.00 0.00 H TER 53557 WAT 5969 ATOM 53557 O WAT 5970 103.524 42.267 142.894 1.00 0.00 O ATOM 53558 H1 WAT 5970 103.673 41.448 142.422 1.00 0.00 H ATOM 53559 H2 WAT 5970 104.351 42.438 143.345 1.00 0.00 H TER 53561 WAT 5970 ATOM 53561 O WAT 5971 46.737 81.177 29.539 1.00 0.00 O ATOM 53562 H1 WAT 5971 46.946 80.859 28.661 1.00 0.00 H ATOM 53563 H2 WAT 5971 46.042 80.594 29.845 1.00 0.00 H TER 53565 WAT 5971 ATOM 53565 O WAT 5972 104.737 47.245 60.812 1.00 0.00 O ATOM 53566 H1 WAT 5972 103.858 46.868 60.816 1.00 0.00 H ATOM 53567 H2 WAT 5972 105.000 47.232 59.891 1.00 0.00 H TER 53569 WAT 5972 ATOM 53569 O WAT 5973 10.815 76.018 143.499 1.00 0.00 O ATOM 53570 H1 WAT 5973 10.265 75.239 143.577 1.00 0.00 H ATOM 53571 H2 WAT 5973 10.795 76.233 142.567 1.00 0.00 H TER 53573 WAT 5973 ATOM 53573 O WAT 5974 51.276 88.311 132.448 1.00 0.00 O ATOM 53574 H1 WAT 5974 50.677 89.049 132.564 1.00 0.00 H ATOM 53575 H2 WAT 5974 52.128 88.716 132.290 1.00 0.00 H TER 53577 WAT 5974 ATOM 53577 O WAT 5975 140.645 111.630 138.894 1.00 0.00 O ATOM 53578 H1 WAT 5975 141.006 111.478 139.768 1.00 0.00 H ATOM 53579 H2 WAT 5975 139.885 111.049 138.845 1.00 0.00 H TER 53581 WAT 5975 ATOM 53581 O WAT 5976 111.757 29.827 78.083 1.00 0.00 O ATOM 53582 H1 WAT 5976 112.703 29.700 78.144 1.00 0.00 H ATOM 53583 H2 WAT 5976 111.554 30.456 78.775 1.00 0.00 H TER 53585 WAT 5976 ATOM 53585 O WAT 5977 85.153 40.306 100.224 1.00 0.00 O ATOM 53586 H1 WAT 5977 85.264 40.683 99.351 1.00 0.00 H ATOM 53587 H2 WAT 5977 84.495 40.861 100.642 1.00 0.00 H TER 53589 WAT 5977 ATOM 53589 O WAT 5978 66.306 125.612 123.966 1.00 0.00 O ATOM 53590 H1 WAT 5978 65.359 125.476 123.926 1.00 0.00 H ATOM 53591 H2 WAT 5978 66.644 125.176 123.184 1.00 0.00 H TER 53593 WAT 5978 ATOM 53593 O WAT 5979 142.627 28.366 74.303 1.00 0.00 O ATOM 53594 H1 WAT 5979 142.392 28.159 75.208 1.00 0.00 H ATOM 53595 H2 WAT 5979 142.983 27.548 73.955 1.00 0.00 H TER 53597 WAT 5979 ATOM 53597 O WAT 5980 13.977 108.360 103.863 1.00 0.00 O ATOM 53598 H1 WAT 5980 14.523 109.144 103.922 1.00 0.00 H ATOM 53599 H2 WAT 5980 13.082 108.695 103.805 1.00 0.00 H TER 53601 WAT 5980 ATOM 53601 O WAT 5981 30.192 86.147 22.992 1.00 0.00 O ATOM 53602 H1 WAT 5981 30.050 86.455 23.887 1.00 0.00 H ATOM 53603 H2 WAT 5981 31.071 86.453 22.770 1.00 0.00 H TER 53605 WAT 5981 ATOM 53605 O WAT 5982 42.172 48.342 75.669 1.00 0.00 O ATOM 53606 H1 WAT 5982 41.938 47.415 75.701 1.00 0.00 H ATOM 53607 H2 WAT 5982 42.881 48.388 75.028 1.00 0.00 H TER 53609 WAT 5982 ATOM 53609 O WAT 5983 110.598 85.030 101.880 1.00 0.00 O ATOM 53610 H1 WAT 5983 110.435 85.837 101.392 1.00 0.00 H ATOM 53611 H2 WAT 5983 110.860 84.396 101.213 1.00 0.00 H TER 53613 WAT 5983 ATOM 53613 O WAT 5984 140.955 66.158 126.091 1.00 0.00 O ATOM 53614 H1 WAT 5984 140.307 66.760 125.726 1.00 0.00 H ATOM 53615 H2 WAT 5984 141.312 65.700 125.331 1.00 0.00 H TER 53617 WAT 5984 ATOM 53617 O WAT 5985 126.711 18.470 85.066 1.00 0.00 O ATOM 53618 H1 WAT 5985 125.858 18.890 84.957 1.00 0.00 H ATOM 53619 H2 WAT 5985 127.342 19.140 84.802 1.00 0.00 H TER 53621 WAT 5985 ATOM 53621 O WAT 5986 21.790 123.948 146.818 1.00 0.00 O ATOM 53622 H1 WAT 5986 21.036 123.401 146.597 1.00 0.00 H ATOM 53623 H2 WAT 5986 22.521 123.551 146.345 1.00 0.00 H TER 53625 WAT 5986 ATOM 53625 O WAT 5987 126.131 125.080 54.775 1.00 0.00 O ATOM 53626 H1 WAT 5987 126.762 124.792 54.115 1.00 0.00 H ATOM 53627 H2 WAT 5987 125.640 124.289 54.997 1.00 0.00 H TER 53629 WAT 5987 ATOM 53629 O WAT 5988 111.173 4.422 109.800 1.00 0.00 O ATOM 53630 H1 WAT 5988 111.141 3.915 110.611 1.00 0.00 H ATOM 53631 H2 WAT 5988 110.320 4.276 109.392 1.00 0.00 H TER 53633 WAT 5988 ATOM 53633 O WAT 5989 12.339 57.882 111.180 1.00 0.00 O ATOM 53634 H1 WAT 5989 11.789 57.279 110.678 1.00 0.00 H ATOM 53635 H2 WAT 5989 11.776 58.639 111.343 1.00 0.00 H TER 53637 WAT 5989 ATOM 53637 O WAT 5990 88.521 134.680 67.174 1.00 0.00 O ATOM 53638 H1 WAT 5990 88.521 135.005 68.074 1.00 0.00 H ATOM 53639 H2 WAT 5990 87.619 134.800 66.876 1.00 0.00 H TER 53641 WAT 5990 ATOM 53641 O WAT 5991 127.657 96.529 106.621 1.00 0.00 O ATOM 53642 H1 WAT 5991 128.098 95.718 106.875 1.00 0.00 H ATOM 53643 H2 WAT 5991 128.018 96.737 105.759 1.00 0.00 H TER 53645 WAT 5991 ATOM 53645 O WAT 5992 126.931 42.659 58.210 1.00 0.00 O ATOM 53646 H1 WAT 5992 126.573 43.545 58.161 1.00 0.00 H ATOM 53647 H2 WAT 5992 127.065 42.506 59.145 1.00 0.00 H TER 53649 WAT 5992 ATOM 53649 O WAT 5993 79.392 16.503 57.655 1.00 0.00 O ATOM 53650 H1 WAT 5993 78.547 16.942 57.559 1.00 0.00 H ATOM 53651 H2 WAT 5993 79.304 15.699 57.142 1.00 0.00 H TER 53653 WAT 5993 ATOM 53653 O WAT 5994 37.373 138.841 16.932 1.00 0.00 O ATOM 53654 H1 WAT 5994 37.716 138.085 17.409 1.00 0.00 H ATOM 53655 H2 WAT 5994 37.851 139.588 17.291 1.00 0.00 H TER 53657 WAT 5994 ATOM 53657 O WAT 5995 128.142 145.939 94.971 1.00 0.00 O ATOM 53658 H1 WAT 5995 128.707 145.181 94.820 1.00 0.00 H ATOM 53659 H2 WAT 5995 127.273 145.649 94.693 1.00 0.00 H TER 53661 WAT 5995 ATOM 53661 O WAT 5996 101.324 46.473 64.936 1.00 0.00 O ATOM 53662 H1 WAT 5996 101.042 47.184 64.361 1.00 0.00 H ATOM 53663 H2 WAT 5996 101.029 45.677 64.494 1.00 0.00 H TER 53665 WAT 5996 ATOM 53665 O WAT 5997 1.450 73.096 81.175 1.00 0.00 O ATOM 53666 H1 WAT 5997 1.701 73.994 81.388 1.00 0.00 H ATOM 53667 H2 WAT 5997 1.828 72.940 80.310 1.00 0.00 H TER 53669 WAT 5997 ATOM 53669 O WAT 5998 80.008 31.042 83.046 1.00 0.00 O ATOM 53670 H1 WAT 5998 80.574 31.788 82.846 1.00 0.00 H ATOM 53671 H2 WAT 5998 80.001 30.524 82.241 1.00 0.00 H TER 53673 WAT 5998 ATOM 53673 O WAT 5999 8.536 139.530 98.104 1.00 0.00 O ATOM 53674 H1 WAT 5999 8.624 140.462 98.301 1.00 0.00 H ATOM 53675 H2 WAT 5999 9.405 139.267 97.800 1.00 0.00 H TER 53677 WAT 5999 ATOM 53677 O WAT 6000 82.305 108.715 57.834 1.00 0.00 O ATOM 53678 H1 WAT 6000 82.953 108.351 57.230 1.00 0.00 H ATOM 53679 H2 WAT 6000 81.479 108.675 57.352 1.00 0.00 H TER 53681 WAT 6000 ATOM 53681 O WAT 6001 48.796 30.709 95.447 1.00 0.00 O ATOM 53682 H1 WAT 6001 48.272 30.794 94.651 1.00 0.00 H ATOM 53683 H2 WAT 6001 49.399 29.988 95.262 1.00 0.00 H TER 53685 WAT 6001 ATOM 53685 O WAT 6002 109.340 32.845 97.697 1.00 0.00 O ATOM 53686 H1 WAT 6002 108.913 33.170 98.490 1.00 0.00 H ATOM 53687 H2 WAT 6002 109.542 33.634 97.194 1.00 0.00 H TER 53689 WAT 6002 ATOM 53689 O WAT 6003 127.605 39.479 147.982 1.00 0.00 O ATOM 53690 H1 WAT 6003 127.522 38.561 147.726 1.00 0.00 H ATOM 53691 H2 WAT 6003 127.556 39.963 147.157 1.00 0.00 H TER 53693 WAT 6003 ATOM 53693 O WAT 6004 60.707 100.388 147.894 1.00 0.00 O ATOM 53694 H1 WAT 6004 61.379 100.951 147.510 1.00 0.00 H ATOM 53695 H2 WAT 6004 61.069 99.504 147.828 1.00 0.00 H TER 53697 WAT 6004 ATOM 53697 O WAT 6005 116.407 127.185 103.324 1.00 0.00 O ATOM 53698 H1 WAT 6005 115.803 127.676 103.881 1.00 0.00 H ATOM 53699 H2 WAT 6005 116.330 126.280 103.627 1.00 0.00 H TER 53701 WAT 6005 ATOM 53701 O WAT 6006 130.193 13.944 97.823 1.00 0.00 O ATOM 53702 H1 WAT 6006 130.147 13.296 97.120 1.00 0.00 H ATOM 53703 H2 WAT 6006 130.076 14.785 97.382 1.00 0.00 H TER 53705 WAT 6006 ATOM 53705 O WAT 6007 109.907 46.766 107.228 1.00 0.00 O ATOM 53706 H1 WAT 6007 110.279 47.343 107.895 1.00 0.00 H ATOM 53707 H2 WAT 6007 109.855 47.311 106.442 1.00 0.00 H TER 53709 WAT 6007 ATOM 53709 O WAT 6008 103.537 13.795 115.658 1.00 0.00 O ATOM 53710 H1 WAT 6008 102.816 14.421 115.715 1.00 0.00 H ATOM 53711 H2 WAT 6008 103.181 13.063 115.155 1.00 0.00 H TER 53713 WAT 6008 ATOM 53713 O WAT 6009 18.153 12.581 70.630 1.00 0.00 O ATOM 53714 H1 WAT 6009 18.256 12.436 69.690 1.00 0.00 H ATOM 53715 H2 WAT 6009 17.323 12.155 70.848 1.00 0.00 H TER 53717 WAT 6009 ATOM 53717 O WAT 6010 139.714 112.960 73.190 1.00 0.00 O ATOM 53718 H1 WAT 6010 139.265 113.514 73.829 1.00 0.00 H ATOM 53719 H2 WAT 6010 140.353 113.541 72.776 1.00 0.00 H TER 53721 WAT 6010 ATOM 53721 O WAT 6011 15.040 43.707 89.581 1.00 0.00 O ATOM 53722 H1 WAT 6011 14.923 44.604 89.270 1.00 0.00 H ATOM 53723 H2 WAT 6011 14.391 43.198 89.094 1.00 0.00 H TER 53725 WAT 6011 ATOM 53725 O WAT 6012 74.895 83.630 91.522 1.00 0.00 O ATOM 53726 H1 WAT 6012 75.271 82.830 91.155 1.00 0.00 H ATOM 53727 H2 WAT 6012 75.404 83.791 92.316 1.00 0.00 H TER 53729 WAT 6012 ATOM 53729 O WAT 6013 107.154 50.539 13.384 1.00 0.00 O ATOM 53730 H1 WAT 6013 106.490 50.046 13.865 1.00 0.00 H ATOM 53731 H2 WAT 6013 107.018 51.448 13.651 1.00 0.00 H TER 53733 WAT 6013 ATOM 53733 O WAT 6014 71.362 43.331 134.682 1.00 0.00 O ATOM 53734 H1 WAT 6014 71.002 42.726 135.330 1.00 0.00 H ATOM 53735 H2 WAT 6014 71.859 42.773 134.083 1.00 0.00 H TER 53737 WAT 6014 ATOM 53737 O WAT 6015 97.659 117.395 19.837 1.00 0.00 O ATOM 53738 H1 WAT 6015 98.504 116.945 19.863 1.00 0.00 H ATOM 53739 H2 WAT 6015 97.214 117.115 20.636 1.00 0.00 H TER 53741 WAT 6015 ATOM 53741 O WAT 6016 132.144 144.026 90.886 1.00 0.00 O ATOM 53742 H1 WAT 6016 132.662 144.108 90.086 1.00 0.00 H ATOM 53743 H2 WAT 6016 132.146 143.089 91.079 1.00 0.00 H TER 53745 WAT 6016 ATOM 53745 O WAT 6017 15.934 42.826 102.000 1.00 0.00 O ATOM 53746 H1 WAT 6017 16.577 42.119 101.942 1.00 0.00 H ATOM 53747 H2 WAT 6017 15.757 42.912 102.937 1.00 0.00 H TER 53749 WAT 6017 ATOM 53749 O WAT 6018 46.723 134.604 5.026 1.00 0.00 O ATOM 53750 H1 WAT 6018 46.086 134.974 5.637 1.00 0.00 H ATOM 53751 H2 WAT 6018 46.534 133.666 5.022 1.00 0.00 H TER 53753 WAT 6018 ATOM 53753 O WAT 6019 100.742 23.441 133.413 1.00 0.00 O ATOM 53754 H1 WAT 6019 100.048 23.110 132.844 1.00 0.00 H ATOM 53755 H2 WAT 6019 100.398 24.267 133.755 1.00 0.00 H TER 53757 WAT 6019 ATOM 53757 O WAT 6020 132.323 121.628 136.651 1.00 0.00 O ATOM 53758 H1 WAT 6020 132.288 122.234 137.390 1.00 0.00 H ATOM 53759 H2 WAT 6020 132.263 120.760 137.050 1.00 0.00 H TER 53761 WAT 6020 ATOM 53761 O WAT 6021 78.678 44.021 9.887 1.00 0.00 O ATOM 53762 H1 WAT 6021 78.765 44.454 10.736 1.00 0.00 H ATOM 53763 H2 WAT 6021 77.779 44.206 9.615 1.00 0.00 H TER 53765 WAT 6021 ATOM 53765 O WAT 6022 79.833 73.954 103.063 1.00 0.00 O ATOM 53766 H1 WAT 6022 79.758 74.811 103.482 1.00 0.00 H ATOM 53767 H2 WAT 6022 79.091 73.454 103.405 1.00 0.00 H TER 53769 WAT 6022 ATOM 53769 O WAT 6023 41.809 133.714 154.319 1.00 0.00 O ATOM 53770 H1 WAT 6023 42.599 134.185 154.582 1.00 0.00 H ATOM 53771 H2 WAT 6023 41.993 132.799 154.531 1.00 0.00 H TER 53773 WAT 6023 ATOM 53773 O WAT 6024 6.877 78.643 17.694 1.00 0.00 O ATOM 53774 H1 WAT 6024 6.212 78.645 18.383 1.00 0.00 H ATOM 53775 H2 WAT 6024 7.336 79.476 17.802 1.00 0.00 H TER 53777 WAT 6024 ATOM 53777 O WAT 6025 7.347 58.700 11.722 1.00 0.00 O ATOM 53778 H1 WAT 6025 8.280 58.698 11.507 1.00 0.00 H ATOM 53779 H2 WAT 6025 7.254 59.393 12.376 1.00 0.00 H TER 53781 WAT 6025 ATOM 53781 O WAT 6026 53.626 14.550 93.060 1.00 0.00 O ATOM 53782 H1 WAT 6026 52.716 14.321 93.250 1.00 0.00 H ATOM 53783 H2 WAT 6026 53.570 15.384 92.593 1.00 0.00 H TER 53785 WAT 6026 ATOM 53785 O WAT 6027 81.677 137.576 98.042 1.00 0.00 O ATOM 53786 H1 WAT 6027 82.114 137.184 98.798 1.00 0.00 H ATOM 53787 H2 WAT 6027 81.274 138.373 98.387 1.00 0.00 H TER 53789 WAT 6027 ATOM 53789 O WAT 6028 9.128 106.704 77.765 1.00 0.00 O ATOM 53790 H1 WAT 6028 9.035 106.717 78.717 1.00 0.00 H ATOM 53791 H2 WAT 6028 8.230 106.744 77.436 1.00 0.00 H TER 53793 WAT 6028 ATOM 53793 O WAT 6029 125.148 140.911 118.773 1.00 0.00 O ATOM 53794 H1 WAT 6029 125.335 140.682 119.683 1.00 0.00 H ATOM 53795 H2 WAT 6029 125.708 141.667 118.597 1.00 0.00 H TER 53797 WAT 6029 ATOM 53797 O WAT 6030 133.704 26.815 139.947 1.00 0.00 O ATOM 53798 H1 WAT 6030 134.210 27.548 140.297 1.00 0.00 H ATOM 53799 H2 WAT 6030 132.803 26.998 140.211 1.00 0.00 H TER 53801 WAT 6030 ATOM 53801 O WAT 6031 132.014 93.957 69.102 1.00 0.00 O ATOM 53802 H1 WAT 6031 132.318 94.641 69.698 1.00 0.00 H ATOM 53803 H2 WAT 6031 131.808 93.217 69.673 1.00 0.00 H TER 53805 WAT 6031 ATOM 53805 O WAT 6032 4.757 55.499 7.442 1.00 0.00 O ATOM 53806 H1 WAT 6032 5.379 55.865 6.812 1.00 0.00 H ATOM 53807 H2 WAT 6032 5.029 55.862 8.285 1.00 0.00 H TER 53809 WAT 6032 ATOM 53809 O WAT 6033 84.929 67.097 127.134 1.00 0.00 O ATOM 53810 H1 WAT 6033 85.517 66.562 127.668 1.00 0.00 H ATOM 53811 H2 WAT 6033 84.571 66.487 126.488 1.00 0.00 H TER 53813 WAT 6033 ATOM 53813 O WAT 6034 12.593 115.415 10.993 1.00 0.00 O ATOM 53814 H1 WAT 6034 12.934 115.661 10.133 1.00 0.00 H ATOM 53815 H2 WAT 6034 12.583 114.458 10.983 1.00 0.00 H TER 53817 WAT 6034 ATOM 53817 O WAT 6035 52.335 93.718 104.046 1.00 0.00 O ATOM 53818 H1 WAT 6035 51.395 93.541 104.009 1.00 0.00 H ATOM 53819 H2 WAT 6035 52.730 93.024 103.519 1.00 0.00 H TER 53821 WAT 6035 ATOM 53821 O WAT 6036 73.280 45.162 13.860 1.00 0.00 O ATOM 53822 H1 WAT 6036 72.590 45.804 13.697 1.00 0.00 H ATOM 53823 H2 WAT 6036 72.960 44.357 13.452 1.00 0.00 H TER 53825 WAT 6036 ATOM 53825 O WAT 6037 115.103 34.016 152.986 1.00 0.00 O ATOM 53826 H1 WAT 6037 115.805 34.589 152.680 1.00 0.00 H ATOM 53827 H2 WAT 6037 114.376 34.609 153.179 1.00 0.00 H TER 53829 WAT 6037 ATOM 53829 O WAT 6038 59.165 74.728 64.768 1.00 0.00 O ATOM 53830 H1 WAT 6038 59.092 75.237 63.960 1.00 0.00 H ATOM 53831 H2 WAT 6038 59.347 75.379 65.445 1.00 0.00 H TER 53833 WAT 6038 ATOM 53833 O WAT 6039 84.137 10.765 5.578 1.00 0.00 O ATOM 53834 H1 WAT 6039 83.910 11.234 6.381 1.00 0.00 H ATOM 53835 H2 WAT 6039 84.739 10.078 5.864 1.00 0.00 H TER 53837 WAT 6039 ATOM 53837 O WAT 6040 102.167 112.176 111.357 1.00 0.00 O ATOM 53838 H1 WAT 6040 102.276 111.280 111.038 1.00 0.00 H ATOM 53839 H2 WAT 6040 101.224 112.268 111.492 1.00 0.00 H TER 53841 WAT 6040 ATOM 53841 O WAT 6041 98.051 60.169 70.986 1.00 0.00 O ATOM 53842 H1 WAT 6041 97.502 59.534 70.527 1.00 0.00 H ATOM 53843 H2 WAT 6041 97.653 61.017 70.790 1.00 0.00 H TER 53845 WAT 6041 ATOM 53845 O WAT 6042 14.970 42.297 69.534 1.00 0.00 O ATOM 53846 H1 WAT 6042 15.703 42.219 70.146 1.00 0.00 H ATOM 53847 H2 WAT 6042 15.181 43.067 69.005 1.00 0.00 H TER 53849 WAT 6042 ATOM 53849 O WAT 6043 135.619 21.953 127.399 1.00 0.00 O ATOM 53850 H1 WAT 6043 136.227 22.614 127.730 1.00 0.00 H ATOM 53851 H2 WAT 6043 136.174 21.203 127.185 1.00 0.00 H TER 53853 WAT 6043 ATOM 53853 O WAT 6044 86.829 42.854 59.329 1.00 0.00 O ATOM 53854 H1 WAT 6044 87.464 43.552 59.487 1.00 0.00 H ATOM 53855 H2 WAT 6044 85.985 43.242 59.559 1.00 0.00 H TER 53857 WAT 6044 ATOM 53857 O WAT 6045 15.724 80.674 75.976 1.00 0.00 O ATOM 53858 H1 WAT 6045 15.317 81.167 76.689 1.00 0.00 H ATOM 53859 H2 WAT 6045 15.584 79.757 76.209 1.00 0.00 H TER 53861 WAT 6045 ATOM 53861 O WAT 6046 126.262 25.547 114.754 1.00 0.00 O ATOM 53862 H1 WAT 6046 127.068 25.476 114.243 1.00 0.00 H ATOM 53863 H2 WAT 6046 126.548 25.467 115.664 1.00 0.00 H TER 53865 WAT 6046 ATOM 53865 O WAT 6047 142.944 30.195 57.663 1.00 0.00 O ATOM 53866 H1 WAT 6047 142.619 30.842 57.037 1.00 0.00 H ATOM 53867 H2 WAT 6047 142.869 29.358 57.204 1.00 0.00 H TER 53869 WAT 6047 ATOM 53869 O WAT 6048 58.483 68.430 77.059 1.00 0.00 O ATOM 53870 H1 WAT 6048 57.924 68.097 77.761 1.00 0.00 H ATOM 53871 H2 WAT 6048 58.593 69.359 77.260 1.00 0.00 H TER 53873 WAT 6048 ATOM 53873 O WAT 6049 109.046 84.667 94.226 1.00 0.00 O ATOM 53874 H1 WAT 6049 109.715 84.102 93.840 1.00 0.00 H ATOM 53875 H2 WAT 6049 109.176 84.581 95.170 1.00 0.00 H TER 53877 WAT 6049 ATOM 53877 O WAT 6050 42.889 105.186 6.927 1.00 0.00 O ATOM 53878 H1 WAT 6050 43.347 105.725 7.571 1.00 0.00 H ATOM 53879 H2 WAT 6050 42.480 105.817 6.335 1.00 0.00 H TER 53881 WAT 6050 ATOM 53881 O WAT 6051 124.089 62.633 3.227 1.00 0.00 O ATOM 53882 H1 WAT 6051 124.741 63.009 2.636 1.00 0.00 H ATOM 53883 H2 WAT 6051 124.460 62.753 4.101 1.00 0.00 H TER 53885 WAT 6051 ATOM 53885 O WAT 6052 139.202 51.920 108.918 1.00 0.00 O ATOM 53886 H1 WAT 6052 138.796 52.532 108.304 1.00 0.00 H ATOM 53887 H2 WAT 6052 140.106 52.226 108.998 1.00 0.00 H TER 53889 WAT 6052 ATOM 53889 O WAT 6053 126.134 9.101 78.512 1.00 0.00 O ATOM 53890 H1 WAT 6053 126.449 9.824 77.969 1.00 0.00 H ATOM 53891 H2 WAT 6053 126.300 8.318 77.987 1.00 0.00 H TER 53893 WAT 6053 ATOM 53893 O WAT 6054 76.728 91.186 71.795 1.00 0.00 O ATOM 53894 H1 WAT 6054 77.340 90.759 72.396 1.00 0.00 H ATOM 53895 H2 WAT 6054 77.160 92.006 71.556 1.00 0.00 H TER 53897 WAT 6054 ATOM 53897 O WAT 6055 61.523 53.031 152.482 1.00 0.00 O ATOM 53898 H1 WAT 6055 61.929 52.220 152.177 1.00 0.00 H ATOM 53899 H2 WAT 6055 60.782 53.166 151.891 1.00 0.00 H TER 53901 WAT 6055 ATOM 53901 O WAT 6056 132.044 98.976 144.006 1.00 0.00 O ATOM 53902 H1 WAT 6056 131.796 99.830 143.651 1.00 0.00 H ATOM 53903 H2 WAT 6056 131.400 98.369 143.641 1.00 0.00 H TER 53905 WAT 6056 ATOM 53905 O WAT 6057 97.967 18.818 85.823 1.00 0.00 O ATOM 53906 H1 WAT 6057 98.472 18.294 86.444 1.00 0.00 H ATOM 53907 H2 WAT 6057 98.460 18.761 85.004 1.00 0.00 H TER 53909 WAT 6057 ATOM 53909 O WAT 6058 131.446 99.001 75.081 1.00 0.00 O ATOM 53910 H1 WAT 6058 130.522 99.039 75.329 1.00 0.00 H ATOM 53911 H2 WAT 6058 131.809 99.835 75.382 1.00 0.00 H TER 53913 WAT 6058 ATOM 53913 O WAT 6059 6.607 61.385 3.398 1.00 0.00 O ATOM 53914 H1 WAT 6059 6.668 62.026 4.106 1.00 0.00 H ATOM 53915 H2 WAT 6059 5.696 61.091 3.418 1.00 0.00 H TER 53917 WAT 6059 ATOM 53917 O WAT 6060 57.182 141.412 123.145 1.00 0.00 O ATOM 53918 H1 WAT 6060 58.091 141.114 123.186 1.00 0.00 H ATOM 53919 H2 WAT 6060 56.674 140.611 123.020 1.00 0.00 H TER 53921 WAT 6060 ATOM 53921 O WAT 6061 89.003 126.656 100.330 1.00 0.00 O ATOM 53922 H1 WAT 6061 88.878 126.440 99.406 1.00 0.00 H ATOM 53923 H2 WAT 6061 89.403 125.872 100.708 1.00 0.00 H TER 53925 WAT 6061 ATOM 53925 O WAT 6062 112.051 128.058 24.295 1.00 0.00 O ATOM 53926 H1 WAT 6062 112.092 127.329 23.677 1.00 0.00 H ATOM 53927 H2 WAT 6062 111.557 127.714 25.039 1.00 0.00 H TER 53929 WAT 6062 ATOM 53929 O WAT 6063 127.392 124.868 59.730 1.00 0.00 O ATOM 53930 H1 WAT 6063 127.901 124.144 60.095 1.00 0.00 H ATOM 53931 H2 WAT 6063 126.488 124.673 59.976 1.00 0.00 H TER 53933 WAT 6063 ATOM 53933 O WAT 6064 104.333 17.265 65.162 1.00 0.00 O ATOM 53934 H1 WAT 6064 104.484 17.597 64.277 1.00 0.00 H ATOM 53935 H2 WAT 6064 103.696 17.873 65.540 1.00 0.00 H TER 53937 WAT 6064 ATOM 53937 O WAT 6065 61.232 50.048 9.589 1.00 0.00 O ATOM 53938 H1 WAT 6065 61.003 49.814 10.488 1.00 0.00 H ATOM 53939 H2 WAT 6065 60.503 49.718 9.063 1.00 0.00 H TER 53941 WAT 6065 ATOM 53941 O WAT 6066 42.597 85.166 118.471 1.00 0.00 O ATOM 53942 H1 WAT 6066 41.761 85.617 118.585 1.00 0.00 H ATOM 53943 H2 WAT 6066 42.999 85.183 119.340 1.00 0.00 H TER 53945 WAT 6066 ATOM 53945 O WAT 6067 1.203 61.577 92.971 1.00 0.00 O ATOM 53946 H1 WAT 6067 0.974 60.648 92.994 1.00 0.00 H ATOM 53947 H2 WAT 6067 2.106 61.593 92.653 1.00 0.00 H TER 53949 WAT 6067 ATOM 53949 O WAT 6068 119.914 65.030 73.931 1.00 0.00 O ATOM 53950 H1 WAT 6068 120.836 65.286 73.955 1.00 0.00 H ATOM 53951 H2 WAT 6068 119.910 64.188 73.477 1.00 0.00 H TER 53953 WAT 6068 ATOM 53953 O WAT 6069 100.038 39.526 67.769 1.00 0.00 O ATOM 53954 H1 WAT 6069 99.378 38.964 67.362 1.00 0.00 H ATOM 53955 H2 WAT 6069 100.806 39.442 67.204 1.00 0.00 H TER 53957 WAT 6069 ATOM 53957 O WAT 6070 4.776 65.676 6.283 1.00 0.00 O ATOM 53958 H1 WAT 6070 4.072 65.196 6.718 1.00 0.00 H ATOM 53959 H2 WAT 6070 5.402 65.869 6.981 1.00 0.00 H TER 53961 WAT 6070 ATOM 53961 O WAT 6071 13.751 48.374 135.576 1.00 0.00 O ATOM 53962 H1 WAT 6071 13.033 47.779 135.790 1.00 0.00 H ATOM 53963 H2 WAT 6071 13.318 49.174 135.276 1.00 0.00 H TER 53965 WAT 6071 ATOM 53965 O WAT 6072 22.006 140.554 156.927 1.00 0.00 O ATOM 53966 H1 WAT 6072 22.803 140.504 157.454 1.00 0.00 H ATOM 53967 H2 WAT 6072 21.419 139.907 157.318 1.00 0.00 H TER 53969 WAT 6072 ATOM 53969 O WAT 6073 139.888 79.833 1.221 1.00 0.00 O ATOM 53970 H1 WAT 6073 140.809 80.004 1.022 1.00 0.00 H ATOM 53971 H2 WAT 6073 139.890 79.542 2.133 1.00 0.00 H TER 53973 WAT 6073 ATOM 53973 O WAT 6074 135.186 1.075 151.349 1.00 0.00 O ATOM 53974 H1 WAT 6074 134.898 1.987 151.329 1.00 0.00 H ATOM 53975 H2 WAT 6074 135.362 0.899 152.273 1.00 0.00 H TER 53977 WAT 6074 ATOM 53977 O WAT 6075 66.789 47.231 64.163 1.00 0.00 O ATOM 53978 H1 WAT 6075 67.252 48.043 64.369 1.00 0.00 H ATOM 53979 H2 WAT 6075 67.462 46.659 63.792 1.00 0.00 H TER 53981 WAT 6075 ATOM 53981 O WAT 6076 15.055 82.396 77.849 1.00 0.00 O ATOM 53982 H1 WAT 6076 15.570 82.988 77.302 1.00 0.00 H ATOM 53983 H2 WAT 6076 14.620 82.970 78.479 1.00 0.00 H TER 53985 WAT 6076 ATOM 53985 O WAT 6077 58.945 86.890 19.603 1.00 0.00 O ATOM 53986 H1 WAT 6077 59.664 86.320 19.332 1.00 0.00 H ATOM 53987 H2 WAT 6077 59.357 87.545 20.166 1.00 0.00 H TER 53989 WAT 6077 ATOM 53989 O WAT 6078 23.719 24.875 110.986 1.00 0.00 O ATOM 53990 H1 WAT 6078 24.342 24.194 111.241 1.00 0.00 H ATOM 53991 H2 WAT 6078 23.052 24.412 110.479 1.00 0.00 H TER 53993 WAT 6078 ATOM 53993 O WAT 6079 64.562 23.178 62.656 1.00 0.00 O ATOM 53994 H1 WAT 6079 64.711 22.516 61.980 1.00 0.00 H ATOM 53995 H2 WAT 6079 63.771 22.885 63.108 1.00 0.00 H TER 53997 WAT 6079 ATOM 53997 O WAT 6080 29.134 108.849 125.359 1.00 0.00 O ATOM 53998 H1 WAT 6080 29.058 109.710 125.771 1.00 0.00 H ATOM 53999 H2 WAT 6080 28.648 108.262 125.938 1.00 0.00 H TER 54001 WAT 6080 ATOM 54001 O WAT 6081 56.399 19.994 109.160 1.00 0.00 O ATOM 54002 H1 WAT 6081 56.824 19.627 108.385 1.00 0.00 H ATOM 54003 H2 WAT 6081 56.398 20.939 109.008 1.00 0.00 H TER 54005 WAT 6081 ATOM 54005 O WAT 6082 113.239 59.075 9.245 1.00 0.00 O ATOM 54006 H1 WAT 6082 113.474 59.503 10.069 1.00 0.00 H ATOM 54007 H2 WAT 6082 113.997 59.215 8.678 1.00 0.00 H TER 54009 WAT 6082 ATOM 54009 O WAT 6083 26.392 105.776 119.633 1.00 0.00 O ATOM 54010 H1 WAT 6083 26.036 106.298 118.914 1.00 0.00 H ATOM 54011 H2 WAT 6083 25.999 106.153 120.420 1.00 0.00 H TER 54013 WAT 6083 ATOM 54013 O WAT 6084 107.916 6.240 78.301 1.00 0.00 O ATOM 54014 H1 WAT 6084 107.946 6.383 79.247 1.00 0.00 H ATOM 54015 H2 WAT 6084 106.985 6.280 78.082 1.00 0.00 H TER 54017 WAT 6084 ATOM 54017 O WAT 6085 118.377 1.058 16.416 1.00 0.00 O ATOM 54018 H1 WAT 6085 119.148 1.088 16.982 1.00 0.00 H ATOM 54019 H2 WAT 6085 117.999 0.193 16.572 1.00 0.00 H TER 54021 WAT 6085 ATOM 54021 O WAT 6086 5.112 40.723 79.046 1.00 0.00 O ATOM 54022 H1 WAT 6086 5.888 41.060 79.493 1.00 0.00 H ATOM 54023 H2 WAT 6086 5.352 40.721 78.119 1.00 0.00 H TER 54025 WAT 6086 ATOM 54025 O WAT 6087 137.537 22.067 143.704 1.00 0.00 O ATOM 54026 H1 WAT 6087 137.842 21.251 144.102 1.00 0.00 H ATOM 54027 H2 WAT 6087 136.651 22.184 144.045 1.00 0.00 H TER 54029 WAT 6087 ATOM 54029 O WAT 6088 32.505 135.967 2.751 1.00 0.00 O ATOM 54030 H1 WAT 6088 33.231 135.720 3.324 1.00 0.00 H ATOM 54031 H2 WAT 6088 31.885 135.241 2.824 1.00 0.00 H TER 54033 WAT 6088 ATOM 54033 O WAT 6089 137.233 123.521 23.727 1.00 0.00 O ATOM 54034 H1 WAT 6089 136.854 124.195 23.163 1.00 0.00 H ATOM 54035 H2 WAT 6089 138.029 123.247 23.272 1.00 0.00 H TER 54037 WAT 6089 ATOM 54037 O WAT 6090 21.331 122.381 119.619 1.00 0.00 O ATOM 54038 H1 WAT 6090 20.696 122.445 120.333 1.00 0.00 H ATOM 54039 H2 WAT 6090 20.839 121.991 118.896 1.00 0.00 H TER 54041 WAT 6090 ATOM 54041 O WAT 6091 98.840 35.927 12.243 1.00 0.00 O ATOM 54042 H1 WAT 6091 98.961 35.198 11.634 1.00 0.00 H ATOM 54043 H2 WAT 6091 98.412 36.606 11.722 1.00 0.00 H TER 54045 WAT 6091 ATOM 54045 O WAT 6092 38.670 10.845 72.435 1.00 0.00 O ATOM 54046 H1 WAT 6092 39.230 10.270 72.955 1.00 0.00 H ATOM 54047 H2 WAT 6092 37.941 11.060 73.016 1.00 0.00 H TER 54049 WAT 6092 ATOM 54049 O WAT 6093 130.779 49.128 66.143 1.00 0.00 O ATOM 54050 H1 WAT 6093 130.779 50.006 66.524 1.00 0.00 H ATOM 54051 H2 WAT 6093 130.207 48.618 66.716 1.00 0.00 H TER 54053 WAT 6093 ATOM 54053 O WAT 6094 53.712 64.283 132.094 1.00 0.00 O ATOM 54054 H1 WAT 6094 53.858 64.166 133.032 1.00 0.00 H ATOM 54055 H2 WAT 6094 53.974 65.188 131.922 1.00 0.00 H TER 54057 WAT 6094 ATOM 54057 O WAT 6095 31.494 120.301 9.890 1.00 0.00 O ATOM 54058 H1 WAT 6095 30.916 119.573 9.660 1.00 0.00 H ATOM 54059 H2 WAT 6095 31.307 120.472 10.813 1.00 0.00 H TER 54061 WAT 6095 ATOM 54061 O WAT 6096 99.918 69.063 18.264 1.00 0.00 O ATOM 54062 H1 WAT 6096 100.268 68.773 17.421 1.00 0.00 H ATOM 54063 H2 WAT 6096 100.324 68.480 18.905 1.00 0.00 H TER 54065 WAT 6096 ATOM 54065 O WAT 6097 116.969 32.135 90.649 1.00 0.00 O ATOM 54066 H1 WAT 6097 117.144 32.457 89.765 1.00 0.00 H ATOM 54067 H2 WAT 6097 117.141 31.194 90.600 1.00 0.00 H TER 54069 WAT 6097 ATOM 54069 O WAT 6098 41.110 82.489 125.876 1.00 0.00 O ATOM 54070 H1 WAT 6098 41.478 82.064 125.101 1.00 0.00 H ATOM 54071 H2 WAT 6098 40.170 82.533 125.701 1.00 0.00 H TER 54073 WAT 6098 ATOM 54073 O WAT 6099 141.690 10.425 119.486 1.00 0.00 O ATOM 54074 H1 WAT 6099 141.663 9.476 119.607 1.00 0.00 H ATOM 54075 H2 WAT 6099 140.843 10.641 119.095 1.00 0.00 H TER 54077 WAT 6099 ATOM 54077 O WAT 6100 31.996 88.815 55.307 1.00 0.00 O ATOM 54078 H1 WAT 6100 31.387 89.532 55.130 1.00 0.00 H ATOM 54079 H2 WAT 6100 32.731 88.975 54.716 1.00 0.00 H TER 54081 WAT 6100 ATOM 54081 O WAT 6101 80.927 80.091 86.208 1.00 0.00 O ATOM 54082 H1 WAT 6101 81.235 79.186 86.256 1.00 0.00 H ATOM 54083 H2 WAT 6101 80.944 80.301 85.274 1.00 0.00 H TER 54085 WAT 6101 ATOM 54085 O WAT 6102 91.254 42.039 107.086 1.00 0.00 O ATOM 54086 H1 WAT 6102 90.902 42.927 107.144 1.00 0.00 H ATOM 54087 H2 WAT 6102 91.787 42.043 106.292 1.00 0.00 H TER 54089 WAT 6102 ATOM 54089 O WAT 6103 74.444 57.527 11.916 1.00 0.00 O ATOM 54090 H1 WAT 6103 75.293 57.920 11.714 1.00 0.00 H ATOM 54091 H2 WAT 6103 73.849 57.893 11.261 1.00 0.00 H TER 54093 WAT 6103 ATOM 54093 O WAT 6104 74.293 1.420 83.887 1.00 0.00 O ATOM 54094 H1 WAT 6104 75.229 1.484 84.077 1.00 0.00 H ATOM 54095 H2 WAT 6104 74.241 0.831 83.134 1.00 0.00 H TER 54097 WAT 6104 ATOM 54097 O WAT 6105 5.653 40.835 133.689 1.00 0.00 O ATOM 54098 H1 WAT 6105 5.370 40.564 132.816 1.00 0.00 H ATOM 54099 H2 WAT 6105 5.617 41.791 133.668 1.00 0.00 H TER 54101 WAT 6105 ATOM 54101 O WAT 6106 61.493 141.004 97.018 1.00 0.00 O ATOM 54102 H1 WAT 6106 62.200 141.444 96.545 1.00 0.00 H ATOM 54103 H2 WAT 6106 60.698 141.457 96.735 1.00 0.00 H TER 54105 WAT 6106 ATOM 54105 O WAT 6107 28.655 128.861 125.167 1.00 0.00 O ATOM 54106 H1 WAT 6107 28.746 127.919 125.305 1.00 0.00 H ATOM 54107 H2 WAT 6107 28.007 128.939 124.466 1.00 0.00 H TER 54109 WAT 6107 ATOM 54109 O WAT 6108 136.497 115.051 103.978 1.00 0.00 O ATOM 54110 H1 WAT 6108 136.096 115.082 103.109 1.00 0.00 H ATOM 54111 H2 WAT 6108 136.513 115.964 104.267 1.00 0.00 H TER 54113 WAT 6108 ATOM 54113 O WAT 6109 52.679 127.489 88.483 1.00 0.00 O ATOM 54114 H1 WAT 6109 52.851 127.571 89.421 1.00 0.00 H ATOM 54115 H2 WAT 6109 52.476 128.380 88.198 1.00 0.00 H TER 54117 WAT 6109 ATOM 54117 O WAT 6110 74.799 16.084 8.980 1.00 0.00 O ATOM 54118 H1 WAT 6110 75.695 16.261 8.692 1.00 0.00 H ATOM 54119 H2 WAT 6110 74.419 16.951 9.124 1.00 0.00 H TER 54121 WAT 6110 ATOM 54121 O WAT 6111 92.272 138.363 6.843 1.00 0.00 O ATOM 54122 H1 WAT 6111 92.156 139.027 7.523 1.00 0.00 H ATOM 54123 H2 WAT 6111 91.490 138.441 6.297 1.00 0.00 H TER 54125 WAT 6111 ATOM 54125 O WAT 6112 4.369 54.523 86.745 1.00 0.00 O ATOM 54126 H1 WAT 6112 4.353 55.325 87.266 1.00 0.00 H ATOM 54127 H2 WAT 6112 5.120 54.034 87.080 1.00 0.00 H TER 54129 WAT 6112 ATOM 54129 O WAT 6113 61.449 1.140 133.822 1.00 0.00 O ATOM 54130 H1 WAT 6113 60.831 0.824 134.481 1.00 0.00 H ATOM 54131 H2 WAT 6113 61.447 0.462 133.146 1.00 0.00 H TER 54133 WAT 6113 ATOM 54133 O WAT 6114 19.599 7.501 155.188 1.00 0.00 O ATOM 54134 H1 WAT 6114 19.933 8.182 155.773 1.00 0.00 H ATOM 54135 H2 WAT 6114 19.433 6.753 155.761 1.00 0.00 H TER 54137 WAT 6114 ATOM 54137 O WAT 6115 56.747 133.234 97.892 1.00 0.00 O ATOM 54138 H1 WAT 6115 56.142 133.202 98.633 1.00 0.00 H ATOM 54139 H2 WAT 6115 56.224 132.949 97.143 1.00 0.00 H TER 54141 WAT 6115 ATOM 54141 O WAT 6116 34.513 125.422 74.198 1.00 0.00 O ATOM 54142 H1 WAT 6116 35.227 126.058 74.248 1.00 0.00 H ATOM 54143 H2 WAT 6116 33.720 125.956 74.158 1.00 0.00 H TER 54145 WAT 6116 ATOM 54145 O WAT 6117 137.218 131.645 106.192 1.00 0.00 O ATOM 54146 H1 WAT 6117 136.606 131.533 105.465 1.00 0.00 H ATOM 54147 H2 WAT 6117 137.203 132.584 106.376 1.00 0.00 H TER 54149 WAT 6117 ATOM 54149 O WAT 6118 129.514 43.869 126.080 1.00 0.00 O ATOM 54150 H1 WAT 6118 128.587 44.106 126.057 1.00 0.00 H ATOM 54151 H2 WAT 6118 129.646 43.342 125.291 1.00 0.00 H TER 54153 WAT 6118 ATOM 54153 O WAT 6119 24.425 104.269 74.093 1.00 0.00 O ATOM 54154 H1 WAT 6119 25.334 104.180 73.808 1.00 0.00 H ATOM 54155 H2 WAT 6119 24.345 105.185 74.357 1.00 0.00 H TER 54157 WAT 6119 ATOM 54157 O WAT 6120 72.103 120.472 109.105 1.00 0.00 O ATOM 54158 H1 WAT 6120 72.155 120.831 108.219 1.00 0.00 H ATOM 54159 H2 WAT 6120 71.394 120.961 109.521 1.00 0.00 H TER 54161 WAT 6120 ATOM 54161 O WAT 6121 71.316 10.735 141.487 1.00 0.00 O ATOM 54162 H1 WAT 6121 71.218 11.677 141.347 1.00 0.00 H ATOM 54163 H2 WAT 6121 71.462 10.376 140.612 1.00 0.00 H TER 54165 WAT 6121 ATOM 54165 O WAT 6122 53.178 1.654 158.970 1.00 0.00 O ATOM 54166 H1 WAT 6122 53.907 1.500 158.368 1.00 0.00 H ATOM 54167 H2 WAT 6122 52.426 1.240 158.545 1.00 0.00 H TER 54169 WAT 6122 ATOM 54169 O WAT 6123 134.771 51.240 109.584 1.00 0.00 O ATOM 54170 H1 WAT 6123 135.101 50.347 109.680 1.00 0.00 H ATOM 54171 H2 WAT 6123 133.896 51.215 109.971 1.00 0.00 H TER 54173 WAT 6123 ATOM 54173 O WAT 6124 51.305 141.144 82.734 1.00 0.00 O ATOM 54174 H1 WAT 6124 52.086 141.655 82.521 1.00 0.00 H ATOM 54175 H2 WAT 6124 50.672 141.379 82.055 1.00 0.00 H TER 54177 WAT 6124 ATOM 54177 O WAT 6125 28.424 124.515 74.341 1.00 0.00 O ATOM 54178 H1 WAT 6125 28.996 124.356 75.091 1.00 0.00 H ATOM 54179 H2 WAT 6125 27.672 124.980 74.708 1.00 0.00 H TER 54181 WAT 6125 ATOM 54181 O WAT 6126 48.180 28.099 90.088 1.00 0.00 O ATOM 54182 H1 WAT 6126 47.868 28.943 89.761 1.00 0.00 H ATOM 54183 H2 WAT 6126 48.691 27.736 89.365 1.00 0.00 H TER 54185 WAT 6126 ATOM 54185 O WAT 6127 77.065 1.740 20.435 1.00 0.00 O ATOM 54186 H1 WAT 6127 76.818 0.901 20.046 1.00 0.00 H ATOM 54187 H2 WAT 6127 76.697 2.396 19.843 1.00 0.00 H TER 54189 WAT 6127 ATOM 54189 O WAT 6128 124.112 136.872 132.572 1.00 0.00 O ATOM 54190 H1 WAT 6128 124.805 137.263 132.040 1.00 0.00 H ATOM 54191 H2 WAT 6128 123.826 137.579 133.149 1.00 0.00 H TER 54193 WAT 6128 ATOM 54193 O WAT 6129 94.066 58.760 142.200 1.00 0.00 O ATOM 54194 H1 WAT 6129 95.019 58.807 142.119 1.00 0.00 H ATOM 54195 H2 WAT 6129 93.905 57.927 142.644 1.00 0.00 H TER 54197 WAT 6129 ATOM 54197 O WAT 6130 23.958 88.331 152.437 1.00 0.00 O ATOM 54198 H1 WAT 6130 23.335 89.022 152.658 1.00 0.00 H ATOM 54199 H2 WAT 6130 24.814 88.758 152.476 1.00 0.00 H TER 54201 WAT 6130 ATOM 54201 O WAT 6131 66.112 95.420 110.231 1.00 0.00 O ATOM 54202 H1 WAT 6131 66.842 95.368 110.848 1.00 0.00 H ATOM 54203 H2 WAT 6131 65.334 95.485 110.785 1.00 0.00 H TER 54205 WAT 6131 ATOM 54205 O WAT 6132 108.416 118.029 14.581 1.00 0.00 O ATOM 54206 H1 WAT 6132 108.250 118.717 15.225 1.00 0.00 H ATOM 54207 H2 WAT 6132 107.854 117.304 14.855 1.00 0.00 H TER 54209 WAT 6132 ATOM 54209 O WAT 6133 102.941 53.752 24.249 1.00 0.00 O ATOM 54210 H1 WAT 6133 102.181 53.276 24.584 1.00 0.00 H ATOM 54211 H2 WAT 6133 102.866 53.684 23.297 1.00 0.00 H TER 54213 WAT 6133 ATOM 54213 O WAT 6134 88.038 75.419 122.626 1.00 0.00 O ATOM 54214 H1 WAT 6134 88.438 74.856 121.963 1.00 0.00 H ATOM 54215 H2 WAT 6134 88.755 75.974 122.932 1.00 0.00 H TER 54217 WAT 6134 ATOM 54217 O WAT 6135 58.255 9.929 118.889 1.00 0.00 O ATOM 54218 H1 WAT 6135 58.625 10.275 119.701 1.00 0.00 H ATOM 54219 H2 WAT 6135 57.954 9.050 119.119 1.00 0.00 H TER 54221 WAT 6135 ATOM 54221 O WAT 6136 127.189 118.013 145.211 1.00 0.00 O ATOM 54222 H1 WAT 6136 127.286 118.485 144.384 1.00 0.00 H ATOM 54223 H2 WAT 6136 127.827 117.301 145.156 1.00 0.00 H TER 54225 WAT 6136 ATOM 54225 O WAT 6137 126.538 15.731 120.546 1.00 0.00 O ATOM 54226 H1 WAT 6137 126.094 15.932 119.722 1.00 0.00 H ATOM 54227 H2 WAT 6137 125.926 15.167 121.017 1.00 0.00 H TER 54229 WAT 6137 ATOM 54229 O WAT 6138 34.757 39.389 131.483 1.00 0.00 O ATOM 54230 H1 WAT 6138 34.190 39.953 132.009 1.00 0.00 H ATOM 54231 H2 WAT 6138 35.215 39.990 130.896 1.00 0.00 H TER 54233 WAT 6138 ATOM 54233 O WAT 6139 43.927 88.839 137.365 1.00 0.00 O ATOM 54234 H1 WAT 6139 44.247 89.114 136.506 1.00 0.00 H ATOM 54235 H2 WAT 6139 44.249 87.943 137.465 1.00 0.00 H TER 54237 WAT 6139 ATOM 54237 O WAT 6140 26.224 102.570 132.967 1.00 0.00 O ATOM 54238 H1 WAT 6140 27.003 102.109 132.655 1.00 0.00 H ATOM 54239 H2 WAT 6140 26.167 102.343 133.896 1.00 0.00 H TER 54241 WAT 6140 ATOM 54241 O WAT 6141 106.291 127.872 148.623 1.00 0.00 O ATOM 54242 H1 WAT 6141 105.862 127.093 148.979 1.00 0.00 H ATOM 54243 H2 WAT 6141 107.187 127.825 148.956 1.00 0.00 H TER 54245 WAT 6141 ATOM 54245 O WAT 6142 141.362 6.290 68.136 1.00 0.00 O ATOM 54246 H1 WAT 6142 141.112 6.376 67.215 1.00 0.00 H ATOM 54247 H2 WAT 6142 142.096 5.676 68.128 1.00 0.00 H TER 54249 WAT 6142 ATOM 54249 O WAT 6143 25.310 10.171 107.408 1.00 0.00 O ATOM 54250 H1 WAT 6143 26.106 9.689 107.187 1.00 0.00 H ATOM 54251 H2 WAT 6143 24.601 9.545 107.260 1.00 0.00 H TER 54253 WAT 6143 ATOM 54253 O WAT 6144 8.421 4.475 104.447 1.00 0.00 O ATOM 54254 H1 WAT 6144 8.161 4.669 103.546 1.00 0.00 H ATOM 54255 H2 WAT 6144 7.669 4.015 104.819 1.00 0.00 H TER 54257 WAT 6144 ATOM 54257 O WAT 6145 77.788 66.088 147.067 1.00 0.00 O ATOM 54258 H1 WAT 6145 77.468 65.268 147.444 1.00 0.00 H ATOM 54259 H2 WAT 6145 77.012 66.646 147.014 1.00 0.00 H TER 54261 WAT 6145 ATOM 54261 O WAT 6146 27.959 27.659 106.362 1.00 0.00 O ATOM 54262 H1 WAT 6146 28.738 27.786 105.821 1.00 0.00 H ATOM 54263 H2 WAT 6146 28.249 27.079 107.067 1.00 0.00 H TER 54265 WAT 6146 ATOM 54265 O WAT 6147 39.572 122.001 77.614 1.00 0.00 O ATOM 54266 H1 WAT 6147 39.825 121.946 76.692 1.00 0.00 H ATOM 54267 H2 WAT 6147 39.028 121.227 77.759 1.00 0.00 H TER 54269 WAT 6147 ATOM 54269 O WAT 6148 123.551 42.476 98.927 1.00 0.00 O ATOM 54270 H1 WAT 6148 123.972 42.702 99.757 1.00 0.00 H ATOM 54271 H2 WAT 6148 124.273 42.218 98.355 1.00 0.00 H TER 54273 WAT 6148 ATOM 54273 O WAT 6149 107.985 118.585 109.372 1.00 0.00 O ATOM 54274 H1 WAT 6149 108.929 118.466 109.270 1.00 0.00 H ATOM 54275 H2 WAT 6149 107.601 117.805 108.972 1.00 0.00 H TER 54277 WAT 6149 ATOM 54277 O WAT 6150 27.204 87.023 104.809 1.00 0.00 O ATOM 54278 H1 WAT 6150 27.395 86.195 105.251 1.00 0.00 H ATOM 54279 H2 WAT 6150 27.056 86.778 103.896 1.00 0.00 H TER 54281 WAT 6150 ATOM 54281 O WAT 6151 28.501 80.921 76.758 1.00 0.00 O ATOM 54282 H1 WAT 6151 28.370 81.438 75.963 1.00 0.00 H ATOM 54283 H2 WAT 6151 28.033 80.103 76.592 1.00 0.00 H TER 54285 WAT 6151 ATOM 54285 O WAT 6152 131.290 22.459 113.550 1.00 0.00 O ATOM 54286 H1 WAT 6152 132.078 22.624 114.067 1.00 0.00 H ATOM 54287 H2 WAT 6152 131.001 21.589 113.825 1.00 0.00 H TER 54289 WAT 6152 ATOM 54289 O WAT 6153 143.220 60.088 140.430 1.00 0.00 O ATOM 54290 H1 WAT 6153 143.459 60.143 141.355 1.00 0.00 H ATOM 54291 H2 WAT 6153 143.321 60.982 140.103 1.00 0.00 H TER 54293 WAT 6153 ATOM 54293 O WAT 6154 104.982 132.185 15.503 1.00 0.00 O ATOM 54294 H1 WAT 6154 105.576 131.459 15.692 1.00 0.00 H ATOM 54295 H2 WAT 6154 105.020 132.736 16.285 1.00 0.00 H TER 54297 WAT 6154 ATOM 54297 O WAT 6155 144.193 99.669 2.020 1.00 0.00 O ATOM 54298 H1 WAT 6155 144.733 100.318 1.569 1.00 0.00 H ATOM 54299 H2 WAT 6155 144.521 99.668 2.919 1.00 0.00 H TER 54301 WAT 6155 ATOM 54301 O WAT 6156 14.480 53.992 60.504 1.00 0.00 O ATOM 54302 H1 WAT 6156 14.639 53.967 59.560 1.00 0.00 H ATOM 54303 H2 WAT 6156 15.164 53.437 60.877 1.00 0.00 H TER 54305 WAT 6156 ATOM 54305 O WAT 6157 77.609 32.258 142.651 1.00 0.00 O ATOM 54306 H1 WAT 6157 76.969 32.232 141.939 1.00 0.00 H ATOM 54307 H2 WAT 6157 78.279 32.870 142.348 1.00 0.00 H TER 54309 WAT 6157 ATOM 54309 O WAT 6158 25.931 77.445 0.262 1.00 0.00 O ATOM 54310 H1 WAT 6158 25.091 77.876 0.108 1.00 0.00 H ATOM 54311 H2 WAT 6158 26.585 78.103 0.027 1.00 0.00 H TER 54313 WAT 6158 ATOM 54313 O WAT 6159 47.290 79.629 6.131 1.00 0.00 O ATOM 54314 H1 WAT 6159 46.706 79.486 6.876 1.00 0.00 H ATOM 54315 H2 WAT 6159 46.753 79.431 5.364 1.00 0.00 H TER 54317 WAT 6159 ATOM 54317 O WAT 6160 84.304 27.095 1.310 1.00 0.00 O ATOM 54318 H1 WAT 6160 83.738 26.390 0.997 1.00 0.00 H ATOM 54319 H2 WAT 6160 83.745 27.611 1.892 1.00 0.00 H TER 54321 WAT 6160 ATOM 54321 O WAT 6161 87.522 105.949 90.951 1.00 0.00 O ATOM 54322 H1 WAT 6161 87.300 106.035 91.878 1.00 0.00 H ATOM 54323 H2 WAT 6161 88.302 106.493 90.839 1.00 0.00 H TER 54325 WAT 6161 ATOM 54325 O WAT 6162 111.344 124.076 58.841 1.00 0.00 O ATOM 54326 H1 WAT 6162 111.656 124.320 59.713 1.00 0.00 H ATOM 54327 H2 WAT 6162 110.785 123.315 58.992 1.00 0.00 H TER 54329 WAT 6162 ATOM 54329 O WAT 6163 70.727 84.993 60.347 1.00 0.00 O ATOM 54330 H1 WAT 6163 70.167 85.224 59.607 1.00 0.00 H ATOM 54331 H2 WAT 6163 71.533 85.489 60.201 1.00 0.00 H TER 54333 WAT 6163 ATOM 54333 O WAT 6164 17.623 45.895 108.062 1.00 0.00 O ATOM 54334 H1 WAT 6164 17.452 46.793 107.778 1.00 0.00 H ATOM 54335 H2 WAT 6164 18.502 45.928 108.441 1.00 0.00 H TER 54337 WAT 6164 ATOM 54337 O WAT 6165 126.708 30.141 128.400 1.00 0.00 O ATOM 54338 H1 WAT 6165 126.028 30.348 129.042 1.00 0.00 H ATOM 54339 H2 WAT 6165 127.032 29.280 128.663 1.00 0.00 H TER 54341 WAT 6165 ATOM 54341 O WAT 6166 112.207 26.708 75.639 1.00 0.00 O ATOM 54342 H1 WAT 6166 112.816 26.946 76.338 1.00 0.00 H ATOM 54343 H2 WAT 6166 111.443 26.356 76.096 1.00 0.00 H TER 54345 WAT 6166 ATOM 54345 O WAT 6167 56.157 117.773 129.563 1.00 0.00 O ATOM 54346 H1 WAT 6167 55.369 117.280 129.334 1.00 0.00 H ATOM 54347 H2 WAT 6167 55.875 118.368 130.257 1.00 0.00 H TER 54349 WAT 6167 ATOM 54349 O WAT 6168 68.195 130.783 62.479 1.00 0.00 O ATOM 54350 H1 WAT 6168 67.380 130.923 61.997 1.00 0.00 H ATOM 54351 H2 WAT 6168 68.114 129.897 62.833 1.00 0.00 H TER 54353 WAT 6168 ATOM 54353 O WAT 6169 120.143 86.652 155.872 1.00 0.00 O ATOM 54354 H1 WAT 6169 120.203 87.341 156.535 1.00 0.00 H ATOM 54355 H2 WAT 6169 119.436 86.085 156.180 1.00 0.00 H TER 54357 WAT 6169 ATOM 54357 O WAT 6170 46.320 36.991 157.971 1.00 0.00 O ATOM 54358 H1 WAT 6170 45.720 37.637 158.344 1.00 0.00 H ATOM 54359 H2 WAT 6170 46.456 36.356 158.674 1.00 0.00 H TER 54361 WAT 6170 ATOM 54361 O WAT 6171 112.170 93.625 83.114 1.00 0.00 O ATOM 54362 H1 WAT 6171 112.190 94.548 82.863 1.00 0.00 H ATOM 54363 H2 WAT 6171 111.252 93.455 83.327 1.00 0.00 H TER 54365 WAT 6171 ATOM 54365 O WAT 6172 33.697 56.673 79.271 1.00 0.00 O ATOM 54366 H1 WAT 6172 33.209 56.217 78.585 1.00 0.00 H ATOM 54367 H2 WAT 6172 34.403 56.070 79.504 1.00 0.00 H TER 54369 WAT 6172 ATOM 54369 O WAT 6173 44.932 50.601 25.812 1.00 0.00 O ATOM 54370 H1 WAT 6173 45.409 50.786 25.003 1.00 0.00 H ATOM 54371 H2 WAT 6173 44.495 51.426 26.026 1.00 0.00 H TER 54373 WAT 6173 ATOM 54373 O WAT 6174 84.908 58.623 124.873 1.00 0.00 O ATOM 54374 H1 WAT 6174 85.534 59.138 125.383 1.00 0.00 H ATOM 54375 H2 WAT 6174 84.112 58.619 125.406 1.00 0.00 H TER 54377 WAT 6174 ATOM 54377 O WAT 6175 3.390 1.030 73.902 1.00 0.00 O ATOM 54378 H1 WAT 6175 4.094 0.396 74.040 1.00 0.00 H ATOM 54379 H2 WAT 6175 3.837 1.875 73.842 1.00 0.00 H TER 54381 WAT 6175 ATOM 54381 O WAT 6176 47.392 64.502 102.670 1.00 0.00 O ATOM 54382 H1 WAT 6176 47.385 63.670 102.197 1.00 0.00 H ATOM 54383 H2 WAT 6176 47.119 65.149 102.019 1.00 0.00 H TER 54385 WAT 6176 ATOM 54385 O WAT 6177 130.387 18.306 76.879 1.00 0.00 O ATOM 54386 H1 WAT 6177 131.226 17.854 76.791 1.00 0.00 H ATOM 54387 H2 WAT 6177 130.616 19.174 77.211 1.00 0.00 H TER 54389 WAT 6177 ATOM 54389 O WAT 6178 127.928 13.617 7.753 1.00 0.00 O ATOM 54390 H1 WAT 6178 128.716 13.994 7.361 1.00 0.00 H ATOM 54391 H2 WAT 6178 127.376 14.373 7.955 1.00 0.00 H TER 54393 WAT 6178 ATOM 54393 O WAT 6179 117.959 70.567 90.579 1.00 0.00 O ATOM 54394 H1 WAT 6179 117.781 70.860 91.473 1.00 0.00 H ATOM 54395 H2 WAT 6179 118.752 71.040 90.326 1.00 0.00 H TER 54397 WAT 6179 ATOM 54397 O WAT 6180 98.089 86.340 101.617 1.00 0.00 O ATOM 54398 H1 WAT 6180 97.478 85.789 101.128 1.00 0.00 H ATOM 54399 H2 WAT 6180 98.925 86.230 101.165 1.00 0.00 H TER 54401 WAT 6180 ATOM 54401 O WAT 6181 31.721 13.938 123.212 1.00 0.00 O ATOM 54402 H1 WAT 6181 30.792 13.742 123.091 1.00 0.00 H ATOM 54403 H2 WAT 6181 32.066 13.181 123.685 1.00 0.00 H TER 54405 WAT 6181 ATOM 54405 O WAT 6182 40.134 135.744 12.386 1.00 0.00 O ATOM 54406 H1 WAT 6182 41.085 135.850 12.408 1.00 0.00 H ATOM 54407 H2 WAT 6182 39.851 135.936 13.280 1.00 0.00 H TER 54409 WAT 6182 ATOM 54409 O WAT 6183 76.762 123.176 107.521 1.00 0.00 O ATOM 54410 H1 WAT 6183 76.963 123.624 106.699 1.00 0.00 H ATOM 54411 H2 WAT 6183 76.777 123.869 108.181 1.00 0.00 H TER 54413 WAT 6183 ATOM 54413 O WAT 6184 9.332 99.852 149.831 1.00 0.00 O ATOM 54414 H1 WAT 6184 8.447 100.084 150.112 1.00 0.00 H ATOM 54415 H2 WAT 6184 9.216 99.483 148.955 1.00 0.00 H TER 54417 WAT 6184 ATOM 54417 O WAT 6185 113.483 38.953 96.791 1.00 0.00 O ATOM 54418 H1 WAT 6185 113.305 39.085 97.723 1.00 0.00 H ATOM 54419 H2 WAT 6185 112.634 38.720 96.416 1.00 0.00 H TER 54421 WAT 6185 ATOM 54421 O WAT 6186 127.544 134.550 128.878 1.00 0.00 O ATOM 54422 H1 WAT 6186 127.503 135.362 129.382 1.00 0.00 H ATOM 54423 H2 WAT 6186 127.103 133.903 129.429 1.00 0.00 H TER 54425 WAT 6186 ATOM 54425 O WAT 6187 75.810 66.197 103.883 1.00 0.00 O ATOM 54426 H1 WAT 6187 75.472 65.390 104.272 1.00 0.00 H ATOM 54427 H2 WAT 6187 75.084 66.531 103.356 1.00 0.00 H TER 54429 WAT 6187 ATOM 54429 O WAT 6188 3.063 61.392 77.294 1.00 0.00 O ATOM 54430 H1 WAT 6188 2.747 61.810 76.493 1.00 0.00 H ATOM 54431 H2 WAT 6188 3.991 61.226 77.128 1.00 0.00 H TER 54433 WAT 6188 ATOM 54433 O WAT 6189 71.698 104.917 10.769 1.00 0.00 O ATOM 54434 H1 WAT 6189 71.375 104.892 9.868 1.00 0.00 H ATOM 54435 H2 WAT 6189 71.731 105.848 10.986 1.00 0.00 H TER 54437 WAT 6189 ATOM 54437 O WAT 6190 36.578 83.228 156.907 1.00 0.00 O ATOM 54438 H1 WAT 6190 36.854 83.896 156.279 1.00 0.00 H ATOM 54439 H2 WAT 6190 36.155 82.556 156.373 1.00 0.00 H TER 54441 WAT 6190 ATOM 54441 O WAT 6191 140.355 98.589 133.790 1.00 0.00 O ATOM 54442 H1 WAT 6191 140.878 97.919 133.351 1.00 0.00 H ATOM 54443 H2 WAT 6191 140.928 98.928 134.478 1.00 0.00 H TER 54445 WAT 6191 ATOM 54445 O WAT 6192 10.576 8.786 157.341 1.00 0.00 O ATOM 54446 H1 WAT 6192 10.154 8.803 158.200 1.00 0.00 H ATOM 54447 H2 WAT 6192 10.570 7.862 157.089 1.00 0.00 H TER 54449 WAT 6192 ATOM 54449 O WAT 6193 23.058 43.177 152.774 1.00 0.00 O ATOM 54450 H1 WAT 6193 23.370 43.947 153.249 1.00 0.00 H ATOM 54451 H2 WAT 6193 23.337 42.435 153.310 1.00 0.00 H TER 54453 WAT 6193 ATOM 54453 O WAT 6194 71.987 115.775 108.055 1.00 0.00 O ATOM 54454 H1 WAT 6194 71.355 115.907 107.349 1.00 0.00 H ATOM 54455 H2 WAT 6194 72.829 115.683 107.610 1.00 0.00 H TER 54457 WAT 6194 ATOM 54457 O WAT 6195 103.221 6.065 12.974 1.00 0.00 O ATOM 54458 H1 WAT 6195 103.058 6.986 13.177 1.00 0.00 H ATOM 54459 H2 WAT 6195 103.795 5.762 13.678 1.00 0.00 H TER 54461 WAT 6195 ATOM 54461 O WAT 6196 140.179 101.933 65.030 1.00 0.00 O ATOM 54462 H1 WAT 6196 139.222 101.960 65.035 1.00 0.00 H ATOM 54463 H2 WAT 6196 140.445 102.812 65.299 1.00 0.00 H TER 54465 WAT 6196 ATOM 54465 O WAT 6197 57.691 98.197 11.698 1.00 0.00 O ATOM 54466 H1 WAT 6197 57.505 98.383 12.618 1.00 0.00 H ATOM 54467 H2 WAT 6197 57.230 98.885 11.217 1.00 0.00 H TER 54469 WAT 6197 ATOM 54469 O WAT 6198 123.394 59.918 69.245 1.00 0.00 O ATOM 54470 H1 WAT 6198 123.918 60.703 69.406 1.00 0.00 H ATOM 54471 H2 WAT 6198 122.746 60.193 68.596 1.00 0.00 H TER 54473 WAT 6198 ATOM 54473 O WAT 6199 47.690 37.394 131.632 1.00 0.00 O ATOM 54474 H1 WAT 6199 48.608 37.661 131.676 1.00 0.00 H ATOM 54475 H2 WAT 6199 47.286 38.024 131.035 1.00 0.00 H TER 54477 WAT 6199 ATOM 54477 O WAT 6200 140.580 92.534 64.282 1.00 0.00 O ATOM 54478 H1 WAT 6200 141.355 92.515 64.843 1.00 0.00 H ATOM 54479 H2 WAT 6200 140.619 91.712 63.792 1.00 0.00 H TER 54481 WAT 6200 ATOM 54481 O WAT 6201 82.494 134.670 86.072 1.00 0.00 O ATOM 54482 H1 WAT 6201 83.303 134.697 85.560 1.00 0.00 H ATOM 54483 H2 WAT 6201 82.757 134.307 86.917 1.00 0.00 H TER 54485 WAT 6201 ATOM 54485 O WAT 6202 135.395 14.277 93.611 1.00 0.00 O ATOM 54486 H1 WAT 6202 134.620 13.739 93.772 1.00 0.00 H ATOM 54487 H2 WAT 6202 135.200 15.111 94.038 1.00 0.00 H TER 54489 WAT 6202 ATOM 54489 O WAT 6203 71.846 132.416 78.193 1.00 0.00 O ATOM 54490 H1 WAT 6203 71.767 132.298 77.247 1.00 0.00 H ATOM 54491 H2 WAT 6203 72.777 132.285 78.374 1.00 0.00 H TER 54493 WAT 6203 ATOM 54493 O WAT 6204 68.028 74.377 9.663 1.00 0.00 O ATOM 54494 H1 WAT 6204 67.208 74.616 9.231 1.00 0.00 H ATOM 54495 H2 WAT 6204 67.993 73.423 9.732 1.00 0.00 H TER 54497 WAT 6204 ATOM 54497 O WAT 6205 17.418 53.847 131.817 1.00 0.00 O ATOM 54498 H1 WAT 6205 17.162 54.253 130.989 1.00 0.00 H ATOM 54499 H2 WAT 6205 18.212 54.314 132.077 1.00 0.00 H TER 54501 WAT 6205 ATOM 54501 O WAT 6206 96.414 115.393 141.417 1.00 0.00 O ATOM 54502 H1 WAT 6206 96.407 115.965 142.185 1.00 0.00 H ATOM 54503 H2 WAT 6206 96.285 114.514 141.772 1.00 0.00 H TER 54505 WAT 6206 ATOM 54505 O WAT 6207 99.237 67.566 94.814 1.00 0.00 O ATOM 54506 H1 WAT 6207 99.731 67.524 93.995 1.00 0.00 H ATOM 54507 H2 WAT 6207 99.869 67.883 95.459 1.00 0.00 H TER 54509 WAT 6207 ATOM 54509 O WAT 6208 71.169 17.053 23.652 1.00 0.00 O ATOM 54510 H1 WAT 6208 70.626 17.842 23.663 1.00 0.00 H ATOM 54511 H2 WAT 6208 70.602 16.367 24.003 1.00 0.00 H TER 54513 WAT 6208 ATOM 54513 O WAT 6209 98.191 118.083 71.881 1.00 0.00 O ATOM 54514 H1 WAT 6209 98.713 117.864 71.109 1.00 0.00 H ATOM 54515 H2 WAT 6209 97.549 118.718 71.564 1.00 0.00 H TER 54517 WAT 6209 ATOM 54517 O WAT 6210 29.873 45.392 13.115 1.00 0.00 O ATOM 54518 H1 WAT 6210 30.456 45.872 12.527 1.00 0.00 H ATOM 54519 H2 WAT 6210 30.375 44.619 13.372 1.00 0.00 H TER 54521 WAT 6210 ATOM 54521 O WAT 6211 12.326 114.328 70.293 1.00 0.00 O ATOM 54522 H1 WAT 6211 12.909 113.842 69.709 1.00 0.00 H ATOM 54523 H2 WAT 6211 11.513 114.421 69.796 1.00 0.00 H TER 54525 WAT 6211 ATOM 54525 O WAT 6212 25.653 123.235 62.260 1.00 0.00 O ATOM 54526 H1 WAT 6212 26.284 123.468 61.579 1.00 0.00 H ATOM 54527 H2 WAT 6212 25.051 123.978 62.293 1.00 0.00 H TER 54529 WAT 6212 ATOM 54529 O WAT 6213 32.944 5.944 75.336 1.00 0.00 O ATOM 54530 H1 WAT 6213 33.080 5.970 74.389 1.00 0.00 H ATOM 54531 H2 WAT 6213 33.806 5.737 75.696 1.00 0.00 H TER 54533 WAT 6213 ATOM 54533 O WAT 6214 97.064 20.000 60.354 1.00 0.00 O ATOM 54534 H1 WAT 6214 97.907 20.031 59.903 1.00 0.00 H ATOM 54535 H2 WAT 6214 97.112 19.214 60.898 1.00 0.00 H TER 54537 WAT 6214 ATOM 54537 O WAT 6215 81.144 10.980 79.976 1.00 0.00 O ATOM 54538 H1 WAT 6215 80.888 11.803 80.392 1.00 0.00 H ATOM 54539 H2 WAT 6215 80.661 10.970 79.149 1.00 0.00 H TER 54541 WAT 6215 ATOM 54541 O WAT 6216 138.845 6.728 18.531 1.00 0.00 O ATOM 54542 H1 WAT 6216 139.325 7.556 18.544 1.00 0.00 H ATOM 54543 H2 WAT 6216 139.165 6.253 19.297 1.00 0.00 H TER 54545 WAT 6216 ATOM 54545 O WAT 6217 122.474 124.444 107.476 1.00 0.00 O ATOM 54546 H1 WAT 6217 122.732 124.823 108.316 1.00 0.00 H ATOM 54547 H2 WAT 6217 122.319 125.199 106.909 1.00 0.00 H TER 54549 WAT 6217 ATOM 54549 O WAT 6218 109.006 96.066 11.094 1.00 0.00 O ATOM 54550 H1 WAT 6218 109.329 95.994 11.993 1.00 0.00 H ATOM 54551 H2 WAT 6218 109.188 96.973 10.846 1.00 0.00 H TER 54553 WAT 6218 ATOM 54553 O WAT 6219 7.995 33.874 131.246 1.00 0.00 O ATOM 54554 H1 WAT 6219 7.610 33.041 131.520 1.00 0.00 H ATOM 54555 H2 WAT 6219 8.784 33.626 130.764 1.00 0.00 H TER 54557 WAT 6219 ATOM 54557 O WAT 6220 104.725 27.660 150.909 1.00 0.00 O ATOM 54558 H1 WAT 6220 105.218 27.805 151.717 1.00 0.00 H ATOM 54559 H2 WAT 6220 104.846 28.466 150.407 1.00 0.00 H TER 54561 WAT 6220 ATOM 54561 O WAT 6221 23.848 137.238 86.642 1.00 0.00 O ATOM 54562 H1 WAT 6221 23.926 138.171 86.445 1.00 0.00 H ATOM 54563 H2 WAT 6221 24.027 137.175 87.580 1.00 0.00 H TER 54565 WAT 6221 ATOM 54565 O WAT 6222 55.761 22.130 6.513 1.00 0.00 O ATOM 54566 H1 WAT 6222 56.089 21.235 6.600 1.00 0.00 H ATOM 54567 H2 WAT 6222 55.121 22.220 7.219 1.00 0.00 H TER 54569 WAT 6222 ATOM 54569 O WAT 6223 45.402 100.409 91.835 1.00 0.00 O ATOM 54570 H1 WAT 6223 45.290 101.356 91.756 1.00 0.00 H ATOM 54571 H2 WAT 6223 46.168 100.212 91.297 1.00 0.00 H TER 54573 WAT 6223 ATOM 54573 O WAT 6224 131.124 37.712 120.953 1.00 0.00 O ATOM 54574 H1 WAT 6224 131.262 36.766 121.004 1.00 0.00 H ATOM 54575 H2 WAT 6224 131.239 37.921 120.026 1.00 0.00 H TER 54577 WAT 6224 ATOM 54577 O WAT 6225 117.336 93.170 82.218 1.00 0.00 O ATOM 54578 H1 WAT 6225 116.535 93.056 81.706 1.00 0.00 H ATOM 54579 H2 WAT 6225 117.052 93.631 83.007 1.00 0.00 H TER 54581 WAT 6225 ATOM 54581 O WAT 6226 40.404 96.046 85.359 1.00 0.00 O ATOM 54582 H1 WAT 6226 40.671 95.732 84.495 1.00 0.00 H ATOM 54583 H2 WAT 6226 39.549 95.643 85.507 1.00 0.00 H TER 54585 WAT 6226 ATOM 54585 O WAT 6227 24.640 46.480 125.924 1.00 0.00 O ATOM 54586 H1 WAT 6227 24.824 45.941 125.155 1.00 0.00 H ATOM 54587 H2 WAT 6227 25.487 46.858 126.160 1.00 0.00 H TER 54589 WAT 6227 ATOM 54589 O WAT 6228 105.859 36.787 71.122 1.00 0.00 O ATOM 54590 H1 WAT 6228 104.968 37.111 70.990 1.00 0.00 H ATOM 54591 H2 WAT 6228 106.407 37.375 70.603 1.00 0.00 H TER 54593 WAT 6228 ATOM 54593 O WAT 6229 140.889 57.080 125.851 1.00 0.00 O ATOM 54594 H1 WAT 6229 139.997 57.137 126.193 1.00 0.00 H ATOM 54595 H2 WAT 6229 141.000 56.157 125.623 1.00 0.00 H TER 54597 WAT 6229 ATOM 54597 O WAT 6230 115.782 27.824 119.068 1.00 0.00 O ATOM 54598 H1 WAT 6230 114.951 27.475 119.389 1.00 0.00 H ATOM 54599 H2 WAT 6230 115.854 27.486 118.175 1.00 0.00 H TER 54601 WAT 6230 ATOM 54601 O WAT 6231 36.642 25.589 65.302 1.00 0.00 O ATOM 54602 H1 WAT 6231 35.743 25.534 64.976 1.00 0.00 H ATOM 54603 H2 WAT 6231 37.185 25.529 64.516 1.00 0.00 H TER 54605 WAT 6231 ATOM 54605 O WAT 6232 42.442 23.587 8.453 1.00 0.00 O ATOM 54606 H1 WAT 6232 42.300 23.214 9.323 1.00 0.00 H ATOM 54607 H2 WAT 6232 42.489 22.828 7.872 1.00 0.00 H TER 54609 WAT 6232 ATOM 54609 O WAT 6233 9.941 68.670 93.286 1.00 0.00 O ATOM 54610 H1 WAT 6233 9.405 69.220 92.715 1.00 0.00 H ATOM 54611 H2 WAT 6233 9.776 67.778 92.982 1.00 0.00 H TER 54613 WAT 6233 ATOM 54613 O WAT 6234 62.778 133.781 100.682 1.00 0.00 O ATOM 54614 H1 WAT 6234 62.111 134.398 100.381 1.00 0.00 H ATOM 54615 H2 WAT 6234 63.390 133.713 99.948 1.00 0.00 H TER 54617 WAT 6234 ATOM 54617 O WAT 6235 3.423 64.230 129.192 1.00 0.00 O ATOM 54618 H1 WAT 6235 2.751 64.368 129.859 1.00 0.00 H ATOM 54619 H2 WAT 6235 2.965 63.783 128.480 1.00 0.00 H TER 54621 WAT 6235 ATOM 54621 O WAT 6236 87.095 92.662 150.731 1.00 0.00 O ATOM 54622 H1 WAT 6236 86.357 93.042 150.255 1.00 0.00 H ATOM 54623 H2 WAT 6236 87.251 93.269 151.454 1.00 0.00 H TER 54625 WAT 6236 ATOM 54625 O WAT 6237 51.716 52.576 114.438 1.00 0.00 O ATOM 54626 H1 WAT 6237 51.002 52.457 115.065 1.00 0.00 H ATOM 54627 H2 WAT 6237 51.964 53.496 114.530 1.00 0.00 H TER 54629 WAT 6237 ATOM 54629 O WAT 6238 1.954 78.543 110.671 1.00 0.00 O ATOM 54630 H1 WAT 6238 1.488 78.039 111.339 1.00 0.00 H ATOM 54631 H2 WAT 6238 1.491 78.348 109.857 1.00 0.00 H TER 54633 WAT 6238 ATOM 54633 O WAT 6239 135.403 121.281 118.154 1.00 0.00 O ATOM 54634 H1 WAT 6239 136.342 121.096 118.122 1.00 0.00 H ATOM 54635 H2 WAT 6239 135.047 120.845 117.380 1.00 0.00 H TER 54637 WAT 6239 ATOM 54637 O WAT 6240 101.693 0.803 85.096 1.00 0.00 O ATOM 54638 H1 WAT 6240 102.230 0.163 84.628 1.00 0.00 H ATOM 54639 H2 WAT 6240 102.325 1.417 85.470 1.00 0.00 H TER 54641 WAT 6240 ATOM 54641 O WAT 6241 26.801 70.814 113.505 1.00 0.00 O ATOM 54642 H1 WAT 6241 27.255 71.645 113.362 1.00 0.00 H ATOM 54643 H2 WAT 6241 26.128 71.018 114.155 1.00 0.00 H TER 54645 WAT 6241 ATOM 54645 O WAT 6242 21.739 58.649 74.265 1.00 0.00 O ATOM 54646 H1 WAT 6242 21.297 59.026 73.504 1.00 0.00 H ATOM 54647 H2 WAT 6242 21.979 59.405 74.802 1.00 0.00 H TER 54649 WAT 6242 ATOM 54649 O WAT 6243 27.444 115.698 108.642 1.00 0.00 O ATOM 54650 H1 WAT 6243 26.591 115.343 108.394 1.00 0.00 H ATOM 54651 H2 WAT 6243 28.076 115.150 108.177 1.00 0.00 H TER 54653 WAT 6243 ATOM 54653 O WAT 6244 84.615 100.542 150.064 1.00 0.00 O ATOM 54654 H1 WAT 6244 84.258 100.683 150.941 1.00 0.00 H ATOM 54655 H2 WAT 6244 84.749 99.596 150.009 1.00 0.00 H TER 54657 WAT 6244 ATOM 54657 O WAT 6245 62.549 62.948 109.175 1.00 0.00 O ATOM 54658 H1 WAT 6245 62.227 62.234 108.624 1.00 0.00 H ATOM 54659 H2 WAT 6245 63.483 62.766 109.281 1.00 0.00 H TER 54661 WAT 6245 ATOM 54661 O WAT 6246 14.207 123.357 13.871 1.00 0.00 O ATOM 54662 H1 WAT 6246 13.916 124.090 13.328 1.00 0.00 H ATOM 54663 H2 WAT 6246 13.482 122.732 13.838 1.00 0.00 H TER 54665 WAT 6246 ATOM 54665 O WAT 6247 61.199 107.135 10.262 1.00 0.00 O ATOM 54666 H1 WAT 6247 60.329 107.483 10.462 1.00 0.00 H ATOM 54667 H2 WAT 6247 61.409 107.495 9.400 1.00 0.00 H TER 54669 WAT 6247 ATOM 54669 O WAT 6248 75.389 0.888 131.179 1.00 0.00 O ATOM 54670 H1 WAT 6248 75.713 1.034 132.068 1.00 0.00 H ATOM 54671 H2 WAT 6248 74.487 1.208 131.198 1.00 0.00 H TER 54673 WAT 6248 ATOM 54673 O WAT 6249 133.331 92.059 6.053 1.00 0.00 O ATOM 54674 H1 WAT 6249 133.451 92.088 7.003 1.00 0.00 H ATOM 54675 H2 WAT 6249 132.452 91.699 5.934 1.00 0.00 H TER 54677 WAT 6249 ATOM 54677 O WAT 6250 94.604 96.013 84.166 1.00 0.00 O ATOM 54678 H1 WAT 6250 95.344 95.430 83.997 1.00 0.00 H ATOM 54679 H2 WAT 6250 93.950 95.766 83.512 1.00 0.00 H TER 54681 WAT 6250 ATOM 54681 O WAT 6251 18.754 15.146 157.380 1.00 0.00 O ATOM 54682 H1 WAT 6251 19.682 15.127 157.612 1.00 0.00 H ATOM 54683 H2 WAT 6251 18.736 15.501 156.491 1.00 0.00 H TER 54685 WAT 6251 ATOM 54685 O WAT 6252 140.417 143.624 112.742 1.00 0.00 O ATOM 54686 H1 WAT 6252 140.024 142.768 112.916 1.00 0.00 H ATOM 54687 H2 WAT 6252 140.927 143.496 111.943 1.00 0.00 H TER 54689 WAT 6252 ATOM 54689 O WAT 6253 76.021 85.299 97.012 1.00 0.00 O ATOM 54690 H1 WAT 6253 75.537 84.790 97.662 1.00 0.00 H ATOM 54691 H2 WAT 6253 76.719 85.724 97.512 1.00 0.00 H TER 54693 WAT 6253 ATOM 54693 O WAT 6254 28.127 133.271 54.454 1.00 0.00 O ATOM 54694 H1 WAT 6254 28.727 133.994 54.270 1.00 0.00 H ATOM 54695 H2 WAT 6254 28.696 132.511 54.571 1.00 0.00 H TER 54697 WAT 6254 ATOM 54697 O WAT 6255 57.912 134.416 113.455 1.00 0.00 O ATOM 54698 H1 WAT 6255 58.685 134.979 113.426 1.00 0.00 H ATOM 54699 H2 WAT 6255 57.591 134.403 112.554 1.00 0.00 H TER 54701 WAT 6255 ATOM 54701 O WAT 6256 1.733 27.881 135.736 1.00 0.00 O ATOM 54702 H1 WAT 6256 0.998 27.279 135.615 1.00 0.00 H ATOM 54703 H2 WAT 6256 1.869 28.268 134.871 1.00 0.00 H TER 54705 WAT 6256 ATOM 54705 O WAT 6257 127.111 67.967 0.574 1.00 0.00 O ATOM 54706 H1 WAT 6257 127.988 67.886 0.947 1.00 0.00 H ATOM 54707 H2 WAT 6257 127.236 67.832 -0.365 1.00 0.00 H TER 54709 WAT 6257 ATOM 54709 O WAT 6258 70.935 96.569 116.302 1.00 0.00 O ATOM 54710 H1 WAT 6258 71.552 96.146 116.899 1.00 0.00 H ATOM 54711 H2 WAT 6258 71.013 96.075 115.486 1.00 0.00 H TER 54713 WAT 6258 ATOM 54713 O WAT 6259 138.495 26.996 75.510 1.00 0.00 O ATOM 54714 H1 WAT 6259 138.033 27.780 75.214 1.00 0.00 H ATOM 54715 H2 WAT 6259 138.739 26.542 74.703 1.00 0.00 H TER 54717 WAT 6259 ATOM 54717 O WAT 6260 17.956 99.805 19.444 1.00 0.00 O ATOM 54718 H1 WAT 6260 17.520 99.022 19.778 1.00 0.00 H ATOM 54719 H2 WAT 6260 18.105 99.620 18.517 1.00 0.00 H TER 54721 WAT 6260 ATOM 54721 O WAT 6261 19.842 4.849 4.489 1.00 0.00 O ATOM 54722 H1 WAT 6261 20.737 4.679 4.782 1.00 0.00 H ATOM 54723 H2 WAT 6261 19.726 4.278 3.729 1.00 0.00 H TER 54725 WAT 6261 ATOM 54725 O WAT 6262 83.983 120.894 86.930 1.00 0.00 O ATOM 54726 H1 WAT 6262 83.774 121.068 87.848 1.00 0.00 H ATOM 54727 H2 WAT 6262 84.838 120.466 86.955 1.00 0.00 H TER 54729 WAT 6262 ATOM 54729 O WAT 6263 108.215 132.333 69.929 1.00 0.00 O ATOM 54730 H1 WAT 6263 108.481 131.866 69.137 1.00 0.00 H ATOM 54731 H2 WAT 6263 108.849 133.045 70.012 1.00 0.00 H TER 54733 WAT 6263 ATOM 54733 O WAT 6264 23.387 2.725 67.958 1.00 0.00 O ATOM 54734 H1 WAT 6264 22.838 3.426 67.605 1.00 0.00 H ATOM 54735 H2 WAT 6264 22.882 1.926 67.804 1.00 0.00 H TER 54737 WAT 6264 ATOM 54737 O WAT 6265 20.271 139.393 104.169 1.00 0.00 O ATOM 54738 H1 WAT 6265 20.880 139.178 104.876 1.00 0.00 H ATOM 54739 H2 WAT 6265 20.542 138.834 103.441 1.00 0.00 H TER 54741 WAT 6265 ATOM 54741 O WAT 6266 115.736 1.586 133.943 1.00 0.00 O ATOM 54742 H1 WAT 6266 116.247 1.381 133.160 1.00 0.00 H ATOM 54743 H2 WAT 6266 116.378 1.930 134.564 1.00 0.00 H TER 54745 WAT 6266 ATOM 54745 O WAT 6267 115.422 48.955 101.878 1.00 0.00 O ATOM 54746 H1 WAT 6267 116.367 49.083 101.796 1.00 0.00 H ATOM 54747 H2 WAT 6267 115.325 48.361 102.622 1.00 0.00 H TER 54749 WAT 6267 ATOM 54749 O WAT 6268 53.954 123.246 13.971 1.00 0.00 O ATOM 54750 H1 WAT 6268 53.735 122.394 13.592 1.00 0.00 H ATOM 54751 H2 WAT 6268 54.227 123.047 14.866 1.00 0.00 H TER 54753 WAT 6268 ATOM 54753 O WAT 6269 18.795 55.868 69.651 1.00 0.00 O ATOM 54754 H1 WAT 6269 19.101 56.422 70.369 1.00 0.00 H ATOM 54755 H2 WAT 6269 19.480 55.208 69.549 1.00 0.00 H TER 54757 WAT 6269 ATOM 54757 O WAT 6270 5.339 138.171 125.759 1.00 0.00 O ATOM 54758 H1 WAT 6270 6.194 138.177 126.189 1.00 0.00 H ATOM 54759 H2 WAT 6270 5.024 137.273 125.866 1.00 0.00 H TER 54761 WAT 6270 ATOM 54761 O WAT 6271 54.269 127.652 135.402 1.00 0.00 O ATOM 54762 H1 WAT 6271 54.675 128.503 135.569 1.00 0.00 H ATOM 54763 H2 WAT 6271 54.971 127.123 135.022 1.00 0.00 H TER 54765 WAT 6271 ATOM 54765 O WAT 6272 122.519 46.643 132.971 1.00 0.00 O ATOM 54766 H1 WAT 6272 122.084 47.041 132.218 1.00 0.00 H ATOM 54767 H2 WAT 6272 123.002 47.363 133.377 1.00 0.00 H TER 54769 WAT 6272 ATOM 54769 O WAT 6273 50.782 24.070 99.709 1.00 0.00 O ATOM 54770 H1 WAT 6273 51.607 23.603 99.576 1.00 0.00 H ATOM 54771 H2 WAT 6273 50.150 23.601 99.164 1.00 0.00 H TER 54773 WAT 6273 ATOM 54773 O WAT 6274 29.263 64.151 97.385 1.00 0.00 O ATOM 54774 H1 WAT 6274 28.328 64.313 97.510 1.00 0.00 H ATOM 54775 H2 WAT 6274 29.644 65.022 97.273 1.00 0.00 H TER 54777 WAT 6274 ATOM 54777 O WAT 6275 86.118 14.324 126.838 1.00 0.00 O ATOM 54778 H1 WAT 6275 86.527 15.185 126.929 1.00 0.00 H ATOM 54779 H2 WAT 6275 86.852 13.720 126.732 1.00 0.00 H TER 54781 WAT 6275 ATOM 54781 O WAT 6276 34.844 1.808 97.530 1.00 0.00 O ATOM 54782 H1 WAT 6276 35.350 2.260 96.855 1.00 0.00 H ATOM 54783 H2 WAT 6276 35.240 2.090 98.355 1.00 0.00 H TER 54785 WAT 6276 ATOM 54785 O WAT 6277 109.624 86.611 87.198 1.00 0.00 O ATOM 54786 H1 WAT 6277 110.478 86.529 87.623 1.00 0.00 H ATOM 54787 H2 WAT 6277 108.996 86.606 87.921 1.00 0.00 H TER 54789 WAT 6277 ATOM 54789 O WAT 6278 37.516 22.035 95.372 1.00 0.00 O ATOM 54790 H1 WAT 6278 38.467 21.929 95.367 1.00 0.00 H ATOM 54791 H2 WAT 6278 37.197 21.360 94.772 1.00 0.00 H TER 54793 WAT 6278 ATOM 54793 O WAT 6279 53.314 50.764 143.844 1.00 0.00 O ATOM 54794 H1 WAT 6279 53.714 50.244 143.147 1.00 0.00 H ATOM 54795 H2 WAT 6279 53.420 50.231 144.632 1.00 0.00 H TER 54797 WAT 6279 ATOM 54797 O WAT 6280 39.075 67.375 108.338 1.00 0.00 O ATOM 54798 H1 WAT 6280 39.146 68.152 107.783 1.00 0.00 H ATOM 54799 H2 WAT 6280 38.561 66.757 107.818 1.00 0.00 H TER 54801 WAT 6280 ATOM 54801 O WAT 6281 123.390 129.169 1.548 1.00 0.00 O ATOM 54802 H1 WAT 6281 122.633 129.740 1.415 1.00 0.00 H ATOM 54803 H2 WAT 6281 123.951 129.333 0.790 1.00 0.00 H TER 54805 WAT 6281 ATOM 54805 O WAT 6282 98.909 114.670 80.346 1.00 0.00 O ATOM 54806 H1 WAT 6282 99.165 113.789 80.072 1.00 0.00 H ATOM 54807 H2 WAT 6282 99.638 115.227 80.073 1.00 0.00 H TER 54809 WAT 6282 ATOM 54809 O WAT 6283 7.075 115.064 123.165 1.00 0.00 O ATOM 54810 H1 WAT 6283 7.568 115.414 122.423 1.00 0.00 H ATOM 54811 H2 WAT 6283 7.588 114.312 123.461 1.00 0.00 H TER 54813 WAT 6283 ATOM 54813 O WAT 6284 118.214 63.768 77.286 1.00 0.00 O ATOM 54814 H1 WAT 6284 118.699 63.119 76.776 1.00 0.00 H ATOM 54815 H2 WAT 6284 117.340 63.775 76.896 1.00 0.00 H TER 54817 WAT 6284 ATOM 54817 O WAT 6285 31.097 123.441 113.041 1.00 0.00 O ATOM 54818 H1 WAT 6285 30.812 123.227 112.152 1.00 0.00 H ATOM 54819 H2 WAT 6285 31.952 123.856 112.925 1.00 0.00 H TER 54821 WAT 6285 ATOM 54821 O WAT 6286 114.666 126.637 77.908 1.00 0.00 O ATOM 54822 H1 WAT 6286 115.010 126.968 78.737 1.00 0.00 H ATOM 54823 H2 WAT 6286 114.087 125.918 78.158 1.00 0.00 H TER 54825 WAT 6286 ATOM 54825 O WAT 6287 71.369 125.482 7.246 1.00 0.00 O ATOM 54826 H1 WAT 6287 70.664 124.860 7.422 1.00 0.00 H ATOM 54827 H2 WAT 6287 72.171 124.966 7.330 1.00 0.00 H TER 54829 WAT 6287 ATOM 54829 O WAT 6288 112.108 17.934 94.211 1.00 0.00 O ATOM 54830 H1 WAT 6288 113.003 17.661 94.412 1.00 0.00 H ATOM 54831 H2 WAT 6288 111.791 18.333 95.021 1.00 0.00 H TER 54833 WAT 6288 ATOM 54833 O WAT 6289 20.954 36.612 61.009 1.00 0.00 O ATOM 54834 H1 WAT 6289 20.770 36.858 61.916 1.00 0.00 H ATOM 54835 H2 WAT 6289 21.898 36.458 60.989 1.00 0.00 H TER 54837 WAT 6289 ATOM 54837 O WAT 6290 114.474 131.473 82.388 1.00 0.00 O ATOM 54838 H1 WAT 6290 113.716 131.927 82.756 1.00 0.00 H ATOM 54839 H2 WAT 6290 114.121 130.649 82.054 1.00 0.00 H TER 54841 WAT 6290 ATOM 54841 O WAT 6291 39.488 82.581 102.221 1.00 0.00 O ATOM 54842 H1 WAT 6291 39.812 82.992 101.420 1.00 0.00 H ATOM 54843 H2 WAT 6291 40.275 82.258 102.660 1.00 0.00 H TER 54845 WAT 6291 ATOM 54845 O WAT 6292 58.692 22.553 101.860 1.00 0.00 O ATOM 54846 H1 WAT 6292 59.199 21.923 101.348 1.00 0.00 H ATOM 54847 H2 WAT 6292 59.125 23.393 101.703 1.00 0.00 H TER 54849 WAT 6292 ATOM 54849 O WAT 6293 28.674 80.230 141.607 1.00 0.00 O ATOM 54850 H1 WAT 6293 28.982 80.610 142.429 1.00 0.00 H ATOM 54851 H2 WAT 6293 28.262 80.961 141.145 1.00 0.00 H TER 54853 WAT 6293 ATOM 54853 O WAT 6294 67.674 54.665 140.940 1.00 0.00 O ATOM 54854 H1 WAT 6294 67.935 54.053 140.252 1.00 0.00 H ATOM 54855 H2 WAT 6294 67.475 55.478 140.476 1.00 0.00 H TER 54857 WAT 6294 ATOM 54857 O WAT 6295 82.045 108.526 114.742 1.00 0.00 O ATOM 54858 H1 WAT 6295 81.399 107.819 114.759 1.00 0.00 H ATOM 54859 H2 WAT 6295 82.669 108.296 115.430 1.00 0.00 H TER 54861 WAT 6295 ATOM 54861 O WAT 6296 80.268 108.744 98.807 1.00 0.00 O ATOM 54862 H1 WAT 6296 80.746 109.184 99.509 1.00 0.00 H ATOM 54863 H2 WAT 6296 79.756 109.440 98.393 1.00 0.00 H TER 54865 WAT 6296 ATOM 54865 O WAT 6297 99.350 144.271 13.332 1.00 0.00 O ATOM 54866 H1 WAT 6297 99.064 143.417 13.655 1.00 0.00 H ATOM 54867 H2 WAT 6297 98.990 144.326 12.447 1.00 0.00 H TER 54869 WAT 6297 ATOM 54869 O WAT 6298 117.504 71.039 111.954 1.00 0.00 O ATOM 54870 H1 WAT 6298 116.859 71.436 112.540 1.00 0.00 H ATOM 54871 H2 WAT 6298 117.385 70.097 112.070 1.00 0.00 H TER 54873 WAT 6298 ATOM 54873 O WAT 6299 88.176 86.253 145.159 1.00 0.00 O ATOM 54874 H1 WAT 6299 87.593 86.152 145.911 1.00 0.00 H ATOM 54875 H2 WAT 6299 87.590 86.278 144.403 1.00 0.00 H TER 54877 WAT 6299 ATOM 54877 O WAT 6300 94.965 105.219 129.534 1.00 0.00 O ATOM 54878 H1 WAT 6300 94.431 105.853 129.054 1.00 0.00 H ATOM 54879 H2 WAT 6300 95.592 104.896 128.887 1.00 0.00 H TER 54881 WAT 6300 ATOM 54881 O WAT 6301 86.148 28.164 148.811 1.00 0.00 O ATOM 54882 H1 WAT 6301 86.349 27.287 149.136 1.00 0.00 H ATOM 54883 H2 WAT 6301 85.304 28.067 148.368 1.00 0.00 H TER 54885 WAT 6301 ATOM 54885 O WAT 6302 109.268 123.865 14.039 1.00 0.00 O ATOM 54886 H1 WAT 6302 109.091 124.556 13.400 1.00 0.00 H ATOM 54887 H2 WAT 6302 108.559 123.943 14.678 1.00 0.00 H TER 54889 WAT 6302 ATOM 54889 O WAT 6303 97.598 68.447 69.038 1.00 0.00 O ATOM 54890 H1 WAT 6303 98.288 67.823 69.263 1.00 0.00 H ATOM 54891 H2 WAT 6303 97.817 68.738 68.153 1.00 0.00 H TER 54893 WAT 6303 ATOM 54893 O WAT 6304 78.346 109.399 59.945 1.00 0.00 O ATOM 54894 H1 WAT 6304 78.419 110.272 59.560 1.00 0.00 H ATOM 54895 H2 WAT 6304 78.347 109.553 60.890 1.00 0.00 H TER 54897 WAT 6304 ATOM 54897 O WAT 6305 81.601 19.141 92.834 1.00 0.00 O ATOM 54898 H1 WAT 6305 82.115 19.946 92.895 1.00 0.00 H ATOM 54899 H2 WAT 6305 81.578 18.803 93.729 1.00 0.00 H TER 54901 WAT 6305 ATOM 54901 O WAT 6306 116.547 89.721 73.247 1.00 0.00 O ATOM 54902 H1 WAT 6306 117.405 89.426 73.552 1.00 0.00 H ATOM 54903 H2 WAT 6306 116.473 90.618 73.571 1.00 0.00 H TER 54905 WAT 6306 ATOM 54905 O WAT 6307 97.308 62.908 113.523 1.00 0.00 O ATOM 54906 H1 WAT 6307 97.807 63.190 114.290 1.00 0.00 H ATOM 54907 H2 WAT 6307 97.747 63.327 112.783 1.00 0.00 H TER 54909 WAT 6307 ATOM 54909 O WAT 6308 28.373 45.422 9.762 1.00 0.00 O ATOM 54910 H1 WAT 6308 28.556 44.718 9.140 1.00 0.00 H ATOM 54911 H2 WAT 6308 29.235 45.693 10.078 1.00 0.00 H TER 54913 WAT 6308 ATOM 54913 O WAT 6309 105.302 126.819 68.212 1.00 0.00 O ATOM 54914 H1 WAT 6309 105.214 127.187 67.333 1.00 0.00 H ATOM 54915 H2 WAT 6309 104.408 126.796 68.553 1.00 0.00 H TER 54917 WAT 6309 ATOM 54917 O WAT 6310 44.365 142.293 73.288 1.00 0.00 O ATOM 54918 H1 WAT 6310 45.290 142.451 73.100 1.00 0.00 H ATOM 54919 H2 WAT 6310 44.295 142.384 74.239 1.00 0.00 H TER 54921 WAT 6310 ATOM 54921 O WAT 6311 140.185 136.616 8.239 1.00 0.00 O ATOM 54922 H1 WAT 6311 139.840 136.824 9.107 1.00 0.00 H ATOM 54923 H2 WAT 6311 140.174 135.659 8.200 1.00 0.00 H TER 54925 WAT 6311 ATOM 54925 O WAT 6312 108.269 108.798 132.864 1.00 0.00 O ATOM 54926 H1 WAT 6312 108.007 107.926 133.159 1.00 0.00 H ATOM 54927 H2 WAT 6312 109.209 108.838 133.037 1.00 0.00 H TER 54929 WAT 6312 ATOM 54929 O WAT 6313 32.703 6.575 127.677 1.00 0.00 O ATOM 54930 H1 WAT 6313 33.283 7.106 128.222 1.00 0.00 H ATOM 54931 H2 WAT 6313 33.257 5.861 127.361 1.00 0.00 H TER 54933 WAT 6313 ATOM 54933 O WAT 6314 143.605 59.268 96.838 1.00 0.00 O ATOM 54934 H1 WAT 6314 142.693 59.002 96.720 1.00 0.00 H ATOM 54935 H2 WAT 6314 144.070 58.452 97.022 1.00 0.00 H TER 54937 WAT 6314 ATOM 54937 O WAT 6315 50.646 28.865 143.026 1.00 0.00 O ATOM 54938 H1 WAT 6315 50.947 28.275 143.717 1.00 0.00 H ATOM 54939 H2 WAT 6315 51.397 28.949 142.438 1.00 0.00 H TER 54941 WAT 6315 ATOM 54941 O WAT 6316 57.773 110.236 69.124 1.00 0.00 O ATOM 54942 H1 WAT 6316 57.313 109.432 68.879 1.00 0.00 H ATOM 54943 H2 WAT 6316 58.686 110.069 68.891 1.00 0.00 H TER 54945 WAT 6316 ATOM 54945 O WAT 6317 107.864 93.518 7.998 1.00 0.00 O ATOM 54946 H1 WAT 6317 107.363 94.216 8.421 1.00 0.00 H ATOM 54947 H2 WAT 6317 108.538 93.286 8.636 1.00 0.00 H TER 54949 WAT 6317 ATOM 54949 O WAT 6318 95.179 35.010 79.141 1.00 0.00 O ATOM 54950 H1 WAT 6318 95.887 34.375 79.250 1.00 0.00 H ATOM 54951 H2 WAT 6318 95.483 35.790 79.604 1.00 0.00 H TER 54953 WAT 6318 ATOM 54953 O WAT 6319 144.928 23.294 24.757 1.00 0.00 O ATOM 54954 H1 WAT 6319 145.369 22.485 25.016 1.00 0.00 H ATOM 54955 H2 WAT 6319 145.314 23.516 23.909 1.00 0.00 H TER 54957 WAT 6319 ATOM 54957 O WAT 6320 56.163 128.741 63.866 1.00 0.00 O ATOM 54958 H1 WAT 6320 56.978 129.083 63.499 1.00 0.00 H ATOM 54959 H2 WAT 6320 55.859 129.429 64.457 1.00 0.00 H TER 54961 WAT 6320 ATOM 54961 O WAT 6321 51.307 47.383 97.985 1.00 0.00 O ATOM 54962 H1 WAT 6321 51.206 48.099 98.612 1.00 0.00 H ATOM 54963 H2 WAT 6321 50.766 47.640 97.238 1.00 0.00 H TER 54965 WAT 6321 ATOM 54965 O WAT 6322 29.225 80.289 104.561 1.00 0.00 O ATOM 54966 H1 WAT 6322 29.336 79.971 103.665 1.00 0.00 H ATOM 54967 H2 WAT 6322 29.806 79.737 105.084 1.00 0.00 H TER 54969 WAT 6322 ATOM 54969 O WAT 6323 12.566 102.137 23.922 1.00 0.00 O ATOM 54970 H1 WAT 6323 12.504 101.390 24.518 1.00 0.00 H ATOM 54971 H2 WAT 6323 11.675 102.484 23.880 1.00 0.00 H TER 54973 WAT 6323 ATOM 54973 O WAT 6324 129.780 96.742 59.640 1.00 0.00 O ATOM 54974 H1 WAT 6324 130.713 96.915 59.764 1.00 0.00 H ATOM 54975 H2 WAT 6324 129.341 97.398 60.182 1.00 0.00 H TER 54977 WAT 6324 ATOM 54977 O WAT 6325 42.346 27.863 155.440 1.00 0.00 O ATOM 54978 H1 WAT 6325 42.448 28.229 154.562 1.00 0.00 H ATOM 54979 H2 WAT 6325 42.958 28.363 155.980 1.00 0.00 H TER 54981 WAT 6325 ATOM 54981 O WAT 6326 140.284 93.130 22.746 1.00 0.00 O ATOM 54982 H1 WAT 6326 139.757 92.896 23.511 1.00 0.00 H ATOM 54983 H2 WAT 6326 139.845 93.897 22.379 1.00 0.00 H TER 54985 WAT 6326 ATOM 54985 O WAT 6327 118.136 121.623 58.663 1.00 0.00 O ATOM 54986 H1 WAT 6327 118.848 122.211 58.918 1.00 0.00 H ATOM 54987 H2 WAT 6327 118.464 120.747 58.867 1.00 0.00 H TER 54989 WAT 6327 ATOM 54989 O WAT 6328 17.774 110.555 106.597 1.00 0.00 O ATOM 54990 H1 WAT 6328 17.801 110.723 107.539 1.00 0.00 H ATOM 54991 H2 WAT 6328 17.288 111.297 106.235 1.00 0.00 H TER 54993 WAT 6328 ATOM 54993 O WAT 6329 133.021 24.600 144.222 1.00 0.00 O ATOM 54994 H1 WAT 6329 133.193 24.083 145.009 1.00 0.00 H ATOM 54995 H2 WAT 6329 133.481 25.426 144.372 1.00 0.00 H TER 54997 WAT 6329 ATOM 54997 O WAT 6330 94.264 1.927 21.416 1.00 0.00 O ATOM 54998 H1 WAT 6330 93.630 1.267 21.137 1.00 0.00 H ATOM 54999 H2 WAT 6330 93.731 2.685 21.656 1.00 0.00 H TER 55001 WAT 6330 ATOM 55001 O WAT 6331 29.797 129.908 74.862 1.00 0.00 O ATOM 55002 H1 WAT 6331 30.313 129.358 75.450 1.00 0.00 H ATOM 55003 H2 WAT 6331 28.965 129.444 74.768 1.00 0.00 H TER 55005 WAT 6331 ATOM 55005 O WAT 6332 140.351 68.665 77.702 1.00 0.00 O ATOM 55006 H1 WAT 6332 140.887 69.171 78.312 1.00 0.00 H ATOM 55007 H2 WAT 6332 140.395 69.155 76.881 1.00 0.00 H TER 55009 WAT 6332 ATOM 55009 O WAT 6333 75.558 64.812 156.942 1.00 0.00 O ATOM 55010 H1 WAT 6333 76.057 64.985 157.741 1.00 0.00 H ATOM 55011 H2 WAT 6333 74.649 64.986 157.185 1.00 0.00 H TER 55013 WAT 6333 ATOM 55013 O WAT 6334 145.069 84.168 7.906 1.00 0.00 O ATOM 55014 H1 WAT 6334 145.469 83.301 7.973 1.00 0.00 H ATOM 55015 H2 WAT 6334 145.250 84.582 8.749 1.00 0.00 H TER 55017 WAT 6334 ATOM 55017 O WAT 6335 130.526 98.971 110.708 1.00 0.00 O ATOM 55018 H1 WAT 6335 130.038 98.686 109.936 1.00 0.00 H ATOM 55019 H2 WAT 6335 130.650 98.172 111.220 1.00 0.00 H TER 55021 WAT 6335 ATOM 55021 O WAT 6336 88.744 123.538 79.827 1.00 0.00 O ATOM 55022 H1 WAT 6336 88.985 124.416 80.122 1.00 0.00 H ATOM 55023 H2 WAT 6336 88.871 123.561 78.879 1.00 0.00 H TER 55025 WAT 6336 ATOM 55025 O WAT 6337 143.014 83.291 133.135 1.00 0.00 O ATOM 55026 H1 WAT 6337 143.129 84.210 132.891 1.00 0.00 H ATOM 55027 H2 WAT 6337 143.014 83.295 134.092 1.00 0.00 H TER 55029 WAT 6337 ATOM 55029 O WAT 6338 125.642 145.906 142.409 1.00 0.00 O ATOM 55030 H1 WAT 6338 125.024 145.920 143.140 1.00 0.00 H ATOM 55031 H2 WAT 6338 125.170 145.461 141.705 1.00 0.00 H TER 55033 WAT 6338 ATOM 55033 O WAT 6339 57.918 134.207 155.037 1.00 0.00 O ATOM 55034 H1 WAT 6339 57.952 133.529 155.712 1.00 0.00 H ATOM 55035 H2 WAT 6339 56.994 134.453 154.990 1.00 0.00 H TER 55037 WAT 6339 ATOM 55037 O WAT 6340 89.965 35.601 106.412 1.00 0.00 O ATOM 55038 H1 WAT 6340 89.923 36.184 107.170 1.00 0.00 H ATOM 55039 H2 WAT 6340 89.058 35.328 106.271 1.00 0.00 H TER 55041 WAT 6340 ATOM 55041 O WAT 6341 144.179 60.497 142.883 1.00 0.00 O ATOM 55042 H1 WAT 6341 144.901 61.073 142.631 1.00 0.00 H ATOM 55043 H2 WAT 6341 144.593 59.648 143.038 1.00 0.00 H TER 55045 WAT 6341 ATOM 55045 O WAT 6342 34.703 100.043 126.873 1.00 0.00 O ATOM 55046 H1 WAT 6342 35.397 100.290 127.484 1.00 0.00 H ATOM 55047 H2 WAT 6342 35.154 99.905 126.040 1.00 0.00 H TER 55049 WAT 6342 ATOM 55049 O WAT 6343 134.747 1.937 104.138 1.00 0.00 O ATOM 55050 H1 WAT 6343 135.104 1.799 103.261 1.00 0.00 H ATOM 55051 H2 WAT 6343 134.519 2.866 104.162 1.00 0.00 H TER 55053 WAT 6343 ATOM 55053 O WAT 6344 60.746 109.296 81.880 1.00 0.00 O ATOM 55054 H1 WAT 6344 61.528 109.620 82.328 1.00 0.00 H ATOM 55055 H2 WAT 6344 60.376 108.650 82.482 1.00 0.00 H TER 55057 WAT 6344 ATOM 55057 O WAT 6345 37.244 39.822 21.547 1.00 0.00 O ATOM 55058 H1 WAT 6345 37.934 39.161 21.484 1.00 0.00 H ATOM 55059 H2 WAT 6345 37.661 40.562 21.987 1.00 0.00 H TER 55061 WAT 6345 ATOM 55061 O WAT 6346 64.526 80.846 28.417 1.00 0.00 O ATOM 55062 H1 WAT 6346 63.729 81.259 28.085 1.00 0.00 H ATOM 55063 H2 WAT 6346 64.253 80.412 29.225 1.00 0.00 H TER 55065 WAT 6346 ATOM 55065 O WAT 6347 38.502 97.895 82.279 1.00 0.00 O ATOM 55066 H1 WAT 6347 37.802 97.978 82.927 1.00 0.00 H ATOM 55067 H2 WAT 6347 38.915 97.054 82.479 1.00 0.00 H TER 55069 WAT 6347 ATOM 55069 O WAT 6348 88.949 86.847 12.342 1.00 0.00 O ATOM 55070 H1 WAT 6348 88.403 86.314 12.919 1.00 0.00 H ATOM 55071 H2 WAT 6348 88.709 86.569 11.459 1.00 0.00 H TER 55073 WAT 6348 ATOM 55073 O WAT 6349 87.367 62.079 123.070 1.00 0.00 O ATOM 55074 H1 WAT 6349 87.721 61.874 122.205 1.00 0.00 H ATOM 55075 H2 WAT 6349 87.480 61.272 123.572 1.00 0.00 H TER 55077 WAT 6349 ATOM 55077 O WAT 6350 45.256 72.019 13.103 1.00 0.00 O ATOM 55078 H1 WAT 6350 44.364 71.837 12.808 1.00 0.00 H ATOM 55079 H2 WAT 6350 45.331 72.973 13.064 1.00 0.00 H TER 55081 WAT 6350 ATOM 55081 O WAT 6351 11.192 43.397 108.895 1.00 0.00 O ATOM 55082 H1 WAT 6351 11.538 43.911 108.165 1.00 0.00 H ATOM 55083 H2 WAT 6351 11.773 42.639 108.950 1.00 0.00 H TER 55085 WAT 6351 ATOM 55085 O WAT 6352 29.667 4.403 79.618 1.00 0.00 O ATOM 55086 H1 WAT 6352 30.196 5.142 79.919 1.00 0.00 H ATOM 55087 H2 WAT 6352 29.764 4.411 78.666 1.00 0.00 H TER 55089 WAT 6352 ATOM 55089 O WAT 6353 50.836 84.661 124.123 1.00 0.00 O ATOM 55090 H1 WAT 6353 50.619 85.509 123.735 1.00 0.00 H ATOM 55091 H2 WAT 6353 51.342 84.210 123.447 1.00 0.00 H TER 55093 WAT 6353 ATOM 55093 O WAT 6354 97.020 129.631 117.927 1.00 0.00 O ATOM 55094 H1 WAT 6354 96.504 129.868 117.156 1.00 0.00 H ATOM 55095 H2 WAT 6354 96.430 129.781 118.665 1.00 0.00 H TER 55097 WAT 6354 ATOM 55097 O WAT 6355 132.704 28.651 11.438 1.00 0.00 O ATOM 55098 H1 WAT 6355 133.600 28.685 11.102 1.00 0.00 H ATOM 55099 H2 WAT 6355 132.406 29.561 11.418 1.00 0.00 H TER 55101 WAT 6355 ATOM 55101 O WAT 6356 136.745 59.711 100.149 1.00 0.00 O ATOM 55102 H1 WAT 6356 135.846 60.032 100.076 1.00 0.00 H ATOM 55103 H2 WAT 6356 137.284 60.501 100.130 1.00 0.00 H TER 55105 WAT 6356 ATOM 55105 O WAT 6357 34.617 51.275 132.649 1.00 0.00 O ATOM 55106 H1 WAT 6357 35.149 51.734 132.000 1.00 0.00 H ATOM 55107 H2 WAT 6357 34.693 50.351 132.411 1.00 0.00 H TER 55109 WAT 6357 ATOM 55109 O WAT 6358 140.765 8.342 123.365 1.00 0.00 O ATOM 55110 H1 WAT 6358 140.103 8.852 123.833 1.00 0.00 H ATOM 55111 H2 WAT 6358 141.119 7.746 124.025 1.00 0.00 H TER 55113 WAT 6358 ATOM 55113 O WAT 6359 135.263 65.171 122.125 1.00 0.00 O ATOM 55114 H1 WAT 6359 134.983 64.831 122.975 1.00 0.00 H ATOM 55115 H2 WAT 6359 134.604 65.828 121.901 1.00 0.00 H TER 55117 WAT 6359 ATOM 55117 O WAT 6360 126.758 70.402 15.659 1.00 0.00 O ATOM 55118 H1 WAT 6360 127.329 70.387 14.890 1.00 0.00 H ATOM 55119 H2 WAT 6360 127.337 70.193 16.391 1.00 0.00 H TER 55121 WAT 6360 ATOM 55121 O WAT 6361 95.458 115.007 125.503 1.00 0.00 O ATOM 55122 H1 WAT 6361 94.861 114.747 126.205 1.00 0.00 H ATOM 55123 H2 WAT 6361 96.331 114.925 125.889 1.00 0.00 H TER 55125 WAT 6361 ATOM 55125 O WAT 6362 0.653 138.949 57.903 1.00 0.00 O ATOM 55126 H1 WAT 6362 0.142 139.395 58.579 1.00 0.00 H ATOM 55127 H2 WAT 6362 1.293 139.600 57.617 1.00 0.00 H TER 55129 WAT 6362 ATOM 55129 O WAT 6363 104.030 128.221 66.180 1.00 0.00 O ATOM 55130 H1 WAT 6363 103.262 127.755 65.850 1.00 0.00 H ATOM 55131 H2 WAT 6363 104.617 128.281 65.426 1.00 0.00 H TER 55133 WAT 6363 ATOM 55133 O WAT 6364 20.667 110.667 120.145 1.00 0.00 O ATOM 55134 H1 WAT 6364 21.234 110.237 119.505 1.00 0.00 H ATOM 55135 H2 WAT 6364 19.845 110.178 120.103 1.00 0.00 H TER 55137 WAT 6364 ATOM 55137 O WAT 6365 111.005 86.855 60.481 1.00 0.00 O ATOM 55138 H1 WAT 6365 111.467 87.605 60.856 1.00 0.00 H ATOM 55139 H2 WAT 6365 111.234 86.123 61.055 1.00 0.00 H TER 55141 WAT 6365 ATOM 55141 O WAT 6366 113.931 75.737 73.076 1.00 0.00 O ATOM 55142 H1 WAT 6366 114.636 76.313 72.782 1.00 0.00 H ATOM 55143 H2 WAT 6366 113.810 75.959 73.999 1.00 0.00 H TER 55145 WAT 6366 ATOM 55145 O WAT 6367 80.758 79.814 83.326 1.00 0.00 O ATOM 55146 H1 WAT 6367 80.382 79.347 82.580 1.00 0.00 H ATOM 55147 H2 WAT 6367 81.698 79.832 83.147 1.00 0.00 H TER 55149 WAT 6367 ATOM 55149 O WAT 6368 4.967 18.026 87.516 1.00 0.00 O ATOM 55150 H1 WAT 6368 4.276 18.248 86.891 1.00 0.00 H ATOM 55151 H2 WAT 6368 5.775 18.313 87.091 1.00 0.00 H TER 55153 WAT 6368 ATOM 55153 O WAT 6369 63.393 78.836 120.779 1.00 0.00 O ATOM 55154 H1 WAT 6369 63.527 78.150 120.124 1.00 0.00 H ATOM 55155 H2 WAT 6369 62.446 78.971 120.793 1.00 0.00 H TER 55157 WAT 6369 ATOM 55157 O WAT 6370 43.203 135.799 92.178 1.00 0.00 O ATOM 55158 H1 WAT 6370 42.627 136.385 91.687 1.00 0.00 H ATOM 55159 H2 WAT 6370 43.127 134.956 91.730 1.00 0.00 H TER 55161 WAT 6370 ATOM 55161 O WAT 6371 125.227 14.621 59.534 1.00 0.00 O ATOM 55162 H1 WAT 6371 125.889 14.106 59.995 1.00 0.00 H ATOM 55163 H2 WAT 6371 124.474 14.628 60.125 1.00 0.00 H TER 55165 WAT 6371 ATOM 55165 O WAT 6372 41.447 7.045 120.804 1.00 0.00 O ATOM 55166 H1 WAT 6372 41.160 7.579 120.063 1.00 0.00 H ATOM 55167 H2 WAT 6372 41.977 7.639 121.336 1.00 0.00 H TER 55169 WAT 6372 ATOM 55169 O WAT 6373 68.634 64.376 120.080 1.00 0.00 O ATOM 55170 H1 WAT 6373 68.676 64.233 121.026 1.00 0.00 H ATOM 55171 H2 WAT 6373 67.775 64.771 119.934 1.00 0.00 H TER 55173 WAT 6373 ATOM 55173 O WAT 6374 2.118 66.578 109.076 1.00 0.00 O ATOM 55174 H1 WAT 6374 1.783 67.086 109.815 1.00 0.00 H ATOM 55175 H2 WAT 6374 1.335 66.214 108.661 1.00 0.00 H TER 55177 WAT 6374 ATOM 55177 O WAT 6375 119.704 117.184 151.365 1.00 0.00 O ATOM 55178 H1 WAT 6375 118.922 117.736 151.374 1.00 0.00 H ATOM 55179 H2 WAT 6375 119.402 116.346 151.013 1.00 0.00 H TER 55181 WAT 6375 ATOM 55181 O WAT 6376 117.858 1.374 118.447 1.00 0.00 O ATOM 55182 H1 WAT 6376 117.718 1.776 117.590 1.00 0.00 H ATOM 55183 H2 WAT 6376 118.234 2.073 118.981 1.00 0.00 H TER 55185 WAT 6376 ATOM 55185 O WAT 6377 53.750 116.125 101.076 1.00 0.00 O ATOM 55186 H1 WAT 6377 52.960 116.232 101.606 1.00 0.00 H ATOM 55187 H2 WAT 6377 53.666 116.783 100.386 1.00 0.00 H TER 55189 WAT 6377 ATOM 55189 O WAT 6378 72.356 10.710 155.950 1.00 0.00 O ATOM 55190 H1 WAT 6378 72.162 9.948 156.497 1.00 0.00 H ATOM 55191 H2 WAT 6378 71.516 11.161 155.862 1.00 0.00 H TER 55193 WAT 6378 ATOM 55193 O WAT 6379 63.861 57.482 28.165 1.00 0.00 O ATOM 55194 H1 WAT 6379 63.760 57.601 29.110 1.00 0.00 H ATOM 55195 H2 WAT 6379 63.337 58.183 27.778 1.00 0.00 H TER 55197 WAT 6379 ATOM 55197 O WAT 6380 66.152 46.726 19.818 1.00 0.00 O ATOM 55198 H1 WAT 6380 65.258 47.036 19.959 1.00 0.00 H ATOM 55199 H2 WAT 6380 66.066 46.044 19.151 1.00 0.00 H TER 55201 WAT 6380 ATOM 55201 O WAT 6381 2.014 94.964 110.045 1.00 0.00 O ATOM 55202 H1 WAT 6381 1.825 95.304 110.920 1.00 0.00 H ATOM 55203 H2 WAT 6381 2.787 95.452 109.762 1.00 0.00 H TER 55205 WAT 6381 ATOM 55205 O WAT 6382 78.061 93.573 69.883 1.00 0.00 O ATOM 55206 H1 WAT 6382 77.963 94.521 69.790 1.00 0.00 H ATOM 55207 H2 WAT 6382 78.729 93.337 69.239 1.00 0.00 H TER 55209 WAT 6382 ATOM 55209 O WAT 6383 106.153 41.739 25.912 1.00 0.00 O ATOM 55210 H1 WAT 6383 105.339 41.292 25.685 1.00 0.00 H ATOM 55211 H2 WAT 6383 106.745 41.037 26.183 1.00 0.00 H TER 55213 WAT 6383 ATOM 55213 O WAT 6384 69.323 143.296 154.370 1.00 0.00 O ATOM 55214 H1 WAT 6384 69.713 142.475 154.671 1.00 0.00 H ATOM 55215 H2 WAT 6384 69.576 143.357 153.449 1.00 0.00 H TER 55217 WAT 6384 ATOM 55217 O WAT 6385 57.101 62.467 121.682 1.00 0.00 O ATOM 55218 H1 WAT 6385 57.133 62.036 122.536 1.00 0.00 H ATOM 55219 H2 WAT 6385 56.253 62.215 121.317 1.00 0.00 H TER 55221 WAT 6385 ATOM 55221 O WAT 6386 34.121 6.521 56.620 1.00 0.00 O ATOM 55222 H1 WAT 6386 33.650 7.230 57.058 1.00 0.00 H ATOM 55223 H2 WAT 6386 35.041 6.781 56.666 1.00 0.00 H TER 55225 WAT 6386 ATOM 55225 O WAT 6387 91.811 123.272 114.489 1.00 0.00 O ATOM 55226 H1 WAT 6387 92.540 123.888 114.558 1.00 0.00 H ATOM 55227 H2 WAT 6387 91.381 123.501 113.665 1.00 0.00 H TER 55229 WAT 6387 ATOM 55229 O WAT 6388 66.993 51.765 65.965 1.00 0.00 O ATOM 55230 H1 WAT 6388 67.351 50.928 65.672 1.00 0.00 H ATOM 55231 H2 WAT 6388 66.117 51.551 66.286 1.00 0.00 H TER 55233 WAT 6388 ATOM 55233 O WAT 6389 92.784 72.323 104.085 1.00 0.00 O ATOM 55234 H1 WAT 6389 91.863 72.279 103.829 1.00 0.00 H ATOM 55235 H2 WAT 6389 93.140 73.051 103.574 1.00 0.00 H TER 55237 WAT 6389 ATOM 55237 O WAT 6390 95.926 116.524 86.485 1.00 0.00 O ATOM 55238 H1 WAT 6390 96.546 117.036 87.004 1.00 0.00 H ATOM 55239 H2 WAT 6390 96.150 115.613 86.674 1.00 0.00 H TER 55241 WAT 6390 ATOM 55241 O WAT 6391 40.156 24.885 158.642 1.00 0.00 O ATOM 55242 H1 WAT 6391 39.744 24.028 158.753 1.00 0.00 H ATOM 55243 H2 WAT 6391 39.800 25.216 157.818 1.00 0.00 H TER 55245 WAT 6391 ATOM 55245 O WAT 6392 39.667 112.844 135.628 1.00 0.00 O ATOM 55246 H1 WAT 6392 38.977 112.225 135.867 1.00 0.00 H ATOM 55247 H2 WAT 6392 40.373 112.668 136.250 1.00 0.00 H TER 55249 WAT 6392 ATOM 55249 O WAT 6393 107.505 102.399 120.184 1.00 0.00 O ATOM 55250 H1 WAT 6393 107.553 101.445 120.127 1.00 0.00 H ATOM 55251 H2 WAT 6393 108.021 102.619 120.960 1.00 0.00 H TER 55253 WAT 6393 ATOM 55253 O WAT 6394 84.369 135.236 130.917 1.00 0.00 O ATOM 55254 H1 WAT 6394 84.422 135.227 131.873 1.00 0.00 H ATOM 55255 H2 WAT 6394 85.277 135.151 130.627 1.00 0.00 H TER 55257 WAT 6394 ATOM 55257 O WAT 6395 6.052 3.191 15.512 1.00 0.00 O ATOM 55258 H1 WAT 6395 6.745 3.850 15.459 1.00 0.00 H ATOM 55259 H2 WAT 6395 5.287 3.618 15.126 1.00 0.00 H TER 55261 WAT 6395 ATOM 55261 O WAT 6396 143.087 81.677 144.534 1.00 0.00 O ATOM 55262 H1 WAT 6396 142.158 81.616 144.757 1.00 0.00 H ATOM 55263 H2 WAT 6396 143.113 81.566 143.584 1.00 0.00 H TER 55265 WAT 6396 ATOM 55265 O WAT 6397 46.288 33.044 67.847 1.00 0.00 O ATOM 55266 H1 WAT 6397 46.225 32.801 66.923 1.00 0.00 H ATOM 55267 H2 WAT 6397 46.128 33.988 67.857 1.00 0.00 H TER 55269 WAT 6397 ATOM 55269 O WAT 6398 130.907 62.680 6.646 1.00 0.00 O ATOM 55270 H1 WAT 6398 131.176 63.171 7.423 1.00 0.00 H ATOM 55271 H2 WAT 6398 131.613 62.049 6.506 1.00 0.00 H TER 55273 WAT 6398 ATOM 55273 O WAT 6399 61.359 111.158 93.603 1.00 0.00 O ATOM 55274 H1 WAT 6399 61.262 110.895 94.519 1.00 0.00 H ATOM 55275 H2 WAT 6399 62.245 111.517 93.550 1.00 0.00 H TER 55277 WAT 6399 ATOM 55277 O WAT 6400 129.833 53.691 131.331 1.00 0.00 O ATOM 55278 H1 WAT 6400 130.410 54.101 130.686 1.00 0.00 H ATOM 55279 H2 WAT 6400 129.145 54.339 131.483 1.00 0.00 H TER 55281 WAT 6400 ATOM 55281 O WAT 6401 87.850 15.459 9.015 1.00 0.00 O ATOM 55282 H1 WAT 6401 87.491 16.038 9.688 1.00 0.00 H ATOM 55283 H2 WAT 6401 87.668 14.576 9.336 1.00 0.00 H TER 55285 WAT 6401 ATOM 55285 O WAT 6402 44.828 140.216 107.581 1.00 0.00 O ATOM 55286 H1 WAT 6402 44.013 139.715 107.610 1.00 0.00 H ATOM 55287 H2 WAT 6402 45.200 140.020 106.721 1.00 0.00 H TER 55289 WAT 6402 ATOM 55289 O WAT 6403 84.933 144.568 21.269 1.00 0.00 O ATOM 55290 H1 WAT 6403 84.987 145.256 20.606 1.00 0.00 H ATOM 55291 H2 WAT 6403 85.614 144.791 21.903 1.00 0.00 H TER 55293 WAT 6403 ATOM 55293 O WAT 6404 93.066 34.858 64.048 1.00 0.00 O ATOM 55294 H1 WAT 6404 93.781 35.458 64.258 1.00 0.00 H ATOM 55295 H2 WAT 6404 92.330 35.430 63.828 1.00 0.00 H TER 55297 WAT 6404 ATOM 55297 O WAT 6405 93.704 101.452 109.080 1.00 0.00 O ATOM 55298 H1 WAT 6405 94.151 102.219 109.437 1.00 0.00 H ATOM 55299 H2 WAT 6405 93.678 100.830 109.808 1.00 0.00 H TER 55301 WAT 6405 ATOM 55301 O WAT 6406 76.021 15.302 74.285 1.00 0.00 O ATOM 55302 H1 WAT 6406 76.183 14.358 74.301 1.00 0.00 H ATOM 55303 H2 WAT 6406 75.167 15.391 73.862 1.00 0.00 H TER 55305 WAT 6406 ATOM 55305 O WAT 6407 83.790 110.366 108.265 1.00 0.00 O ATOM 55306 H1 WAT 6407 83.737 110.912 109.049 1.00 0.00 H ATOM 55307 H2 WAT 6407 82.917 110.422 107.875 1.00 0.00 H TER 55309 WAT 6407 ATOM 55309 O WAT 6408 34.491 111.004 141.542 1.00 0.00 O ATOM 55310 H1 WAT 6408 34.589 111.834 142.008 1.00 0.00 H ATOM 55311 H2 WAT 6408 34.314 111.257 140.636 1.00 0.00 H TER 55313 WAT 6408 ATOM 55313 O WAT 6409 60.117 59.506 70.252 1.00 0.00 O ATOM 55314 H1 WAT 6409 59.662 58.698 70.490 1.00 0.00 H ATOM 55315 H2 WAT 6409 59.438 60.056 69.861 1.00 0.00 H TER 55317 WAT 6409 ATOM 55317 O WAT 6410 45.786 24.797 62.048 1.00 0.00 O ATOM 55318 H1 WAT 6410 46.719 24.583 62.080 1.00 0.00 H ATOM 55319 H2 WAT 6410 45.618 25.000 61.128 1.00 0.00 H TER 55321 WAT 6410 ATOM 55321 O WAT 6411 43.552 28.748 67.666 1.00 0.00 O ATOM 55322 H1 WAT 6411 43.993 29.377 68.237 1.00 0.00 H ATOM 55323 H2 WAT 6411 43.788 27.892 68.024 1.00 0.00 H TER 55325 WAT 6411 ATOM 55325 O WAT 6412 51.392 5.378 85.809 1.00 0.00 O ATOM 55326 H1 WAT 6412 51.720 5.309 84.912 1.00 0.00 H ATOM 55327 H2 WAT 6412 51.467 4.491 86.160 1.00 0.00 H TER 55329 WAT 6412 ATOM 55329 O WAT 6413 120.421 72.273 18.585 1.00 0.00 O ATOM 55330 H1 WAT 6413 120.173 71.370 18.390 1.00 0.00 H ATOM 55331 H2 WAT 6413 119.833 72.536 19.294 1.00 0.00 H TER 55333 WAT 6413 ATOM 55333 O WAT 6414 18.665 68.895 125.373 1.00 0.00 O ATOM 55334 H1 WAT 6414 18.495 69.772 125.717 1.00 0.00 H ATOM 55335 H2 WAT 6414 18.059 68.805 124.638 1.00 0.00 H TER 55337 WAT 6414 ATOM 55337 O WAT 6415 83.506 17.500 145.451 1.00 0.00 O ATOM 55338 H1 WAT 6415 83.208 17.643 144.552 1.00 0.00 H ATOM 55339 H2 WAT 6415 82.708 17.548 145.978 1.00 0.00 H TER 55341 WAT 6415 ATOM 55341 O WAT 6416 48.507 22.209 108.985 1.00 0.00 O ATOM 55342 H1 WAT 6416 48.136 21.990 108.130 1.00 0.00 H ATOM 55343 H2 WAT 6416 49.394 22.512 108.791 1.00 0.00 H TER 55345 WAT 6416 ATOM 55345 O WAT 6417 91.977 97.705 141.266 1.00 0.00 O ATOM 55346 H1 WAT 6417 91.709 98.597 141.048 1.00 0.00 H ATOM 55347 H2 WAT 6417 92.180 97.737 142.201 1.00 0.00 H TER 55349 WAT 6417 ATOM 55349 O WAT 6418 12.720 120.872 111.517 1.00 0.00 O ATOM 55350 H1 WAT 6418 13.300 120.112 111.565 1.00 0.00 H ATOM 55351 H2 WAT 6418 13.295 121.598 111.273 1.00 0.00 H TER 55353 WAT 6418 ATOM 55353 O WAT 6419 23.992 55.591 17.716 1.00 0.00 O ATOM 55354 H1 WAT 6419 23.369 55.400 18.418 1.00 0.00 H ATOM 55355 H2 WAT 6419 24.486 54.778 17.608 1.00 0.00 H TER 55357 WAT 6419 ATOM 55357 O WAT 6420 29.252 113.292 135.242 1.00 0.00 O ATOM 55358 H1 WAT 6420 28.715 113.301 134.449 1.00 0.00 H ATOM 55359 H2 WAT 6420 29.927 113.951 135.081 1.00 0.00 H TER 55361 WAT 6420 ATOM 55361 O WAT 6421 20.306 38.467 7.120 1.00 0.00 O ATOM 55362 H1 WAT 6421 20.288 37.519 6.988 1.00 0.00 H ATOM 55363 H2 WAT 6421 21.086 38.619 7.654 1.00 0.00 H TER 55365 WAT 6421 ATOM 55365 O WAT 6422 17.599 1.858 80.314 1.00 0.00 O ATOM 55366 H1 WAT 6422 17.586 0.912 80.168 1.00 0.00 H ATOM 55367 H2 WAT 6422 16.863 2.190 79.800 1.00 0.00 H TER 55369 WAT 6422 ATOM 55369 O WAT 6423 16.726 33.837 100.731 1.00 0.00 O ATOM 55370 H1 WAT 6423 16.884 33.582 99.822 1.00 0.00 H ATOM 55371 H2 WAT 6423 17.192 34.667 100.831 1.00 0.00 H TER 55373 WAT 6423 ATOM 55373 O WAT 6424 1.079 19.581 73.678 1.00 0.00 O ATOM 55374 H1 WAT 6424 0.580 19.612 74.495 1.00 0.00 H ATOM 55375 H2 WAT 6424 0.518 20.020 73.039 1.00 0.00 H TER 55377 WAT 6424 ATOM 55377 O WAT 6425 26.460 124.689 136.760 1.00 0.00 O ATOM 55378 H1 WAT 6425 26.672 124.249 137.583 1.00 0.00 H ATOM 55379 H2 WAT 6425 26.613 125.617 136.938 1.00 0.00 H TER 55381 WAT 6425 ATOM 55381 O WAT 6426 73.044 72.544 93.582 1.00 0.00 O ATOM 55382 H1 WAT 6426 73.130 71.598 93.463 1.00 0.00 H ATOM 55383 H2 WAT 6426 72.168 72.748 93.257 1.00 0.00 H TER 55385 WAT 6426 ATOM 55385 O WAT 6427 122.244 25.842 7.796 1.00 0.00 O ATOM 55386 H1 WAT 6427 122.768 25.314 8.398 1.00 0.00 H ATOM 55387 H2 WAT 6427 122.369 26.742 8.097 1.00 0.00 H TER 55389 WAT 6427 ATOM 55389 O WAT 6428 3.439 92.999 127.134 1.00 0.00 O ATOM 55390 H1 WAT 6428 3.156 93.818 126.727 1.00 0.00 H ATOM 55391 H2 WAT 6428 2.931 92.945 127.943 1.00 0.00 H TER 55393 WAT 6428 ATOM 55393 O WAT 6429 25.836 30.488 130.109 1.00 0.00 O ATOM 55394 H1 WAT 6429 25.674 29.593 130.407 1.00 0.00 H ATOM 55395 H2 WAT 6429 26.595 30.776 130.616 1.00 0.00 H TER 55397 WAT 6429 ATOM 55397 O WAT 6430 68.114 6.889 106.144 1.00 0.00 O ATOM 55398 H1 WAT 6430 67.762 7.779 106.177 1.00 0.00 H ATOM 55399 H2 WAT 6430 67.810 6.481 106.955 1.00 0.00 H TER 55401 WAT 6430 ATOM 55401 O WAT 6431 139.935 38.734 80.967 1.00 0.00 O ATOM 55402 H1 WAT 6431 139.851 39.657 81.205 1.00 0.00 H ATOM 55403 H2 WAT 6431 140.238 38.306 81.768 1.00 0.00 H TER 55405 WAT 6431 ATOM 55405 O WAT 6432 72.208 129.592 57.720 1.00 0.00 O ATOM 55406 H1 WAT 6432 71.949 129.212 58.560 1.00 0.00 H ATOM 55407 H2 WAT 6432 72.461 130.491 57.931 1.00 0.00 H TER 55409 WAT 6432 ATOM 55409 O WAT 6433 84.508 112.876 116.361 1.00 0.00 O ATOM 55410 H1 WAT 6433 84.181 113.001 117.252 1.00 0.00 H ATOM 55411 H2 WAT 6433 83.822 112.373 115.923 1.00 0.00 H TER 55413 WAT 6433 ATOM 55413 O WAT 6434 26.728 59.423 10.481 1.00 0.00 O ATOM 55414 H1 WAT 6434 26.269 60.091 10.992 1.00 0.00 H ATOM 55415 H2 WAT 6434 26.525 58.600 10.926 1.00 0.00 H TER 55417 WAT 6434 ATOM 55417 O WAT 6435 138.849 28.699 122.886 1.00 0.00 O ATOM 55418 H1 WAT 6435 139.127 27.796 122.733 1.00 0.00 H ATOM 55419 H2 WAT 6435 138.494 28.693 123.775 1.00 0.00 H TER 55421 WAT 6435 ATOM 55421 O WAT 6436 85.425 49.538 17.422 1.00 0.00 O ATOM 55422 H1 WAT 6436 85.925 50.134 17.980 1.00 0.00 H ATOM 55423 H2 WAT 6436 85.572 49.862 16.534 1.00 0.00 H TER 55425 WAT 6436 ATOM 55425 O WAT 6437 134.526 79.366 64.490 1.00 0.00 O ATOM 55426 H1 WAT 6437 134.382 79.672 63.594 1.00 0.00 H ATOM 55427 H2 WAT 6437 133.924 78.629 64.591 1.00 0.00 H TER 55429 WAT 6437 ATOM 55429 O WAT 6438 2.657 12.787 78.926 1.00 0.00 O ATOM 55430 H1 WAT 6438 2.855 11.850 78.935 1.00 0.00 H ATOM 55431 H2 WAT 6438 2.810 13.072 79.827 1.00 0.00 H TER 55433 WAT 6438 ATOM 55433 O WAT 6439 86.152 109.123 2.506 1.00 0.00 O ATOM 55434 H1 WAT 6439 86.413 108.231 2.276 1.00 0.00 H ATOM 55435 H2 WAT 6439 86.912 109.483 2.964 1.00 0.00 H TER 55437 WAT 6439 ATOM 55437 O WAT 6440 123.450 132.987 90.199 1.00 0.00 O ATOM 55438 H1 WAT 6440 123.199 132.074 90.343 1.00 0.00 H ATOM 55439 H2 WAT 6440 124.308 132.936 89.779 1.00 0.00 H TER 55441 WAT 6440 ATOM 55441 O WAT 6441 47.865 117.119 96.345 1.00 0.00 O ATOM 55442 H1 WAT 6441 47.758 116.427 95.692 1.00 0.00 H ATOM 55443 H2 WAT 6441 48.526 116.779 96.948 1.00 0.00 H TER 55445 WAT 6441 ATOM 55445 O WAT 6442 97.479 94.981 125.746 1.00 0.00 O ATOM 55446 H1 WAT 6442 97.827 94.447 125.032 1.00 0.00 H ATOM 55447 H2 WAT 6442 97.177 95.783 125.319 1.00 0.00 H TER 55449 WAT 6442 ATOM 55449 O WAT 6443 1.606 88.839 22.160 1.00 0.00 O ATOM 55450 H1 WAT 6443 1.718 88.826 21.209 1.00 0.00 H ATOM 55451 H2 WAT 6443 2.026 88.034 22.462 1.00 0.00 H TER 55453 WAT 6443 ATOM 55453 O WAT 6444 2.705 68.527 153.588 1.00 0.00 O ATOM 55454 H1 WAT 6444 2.161 68.591 152.803 1.00 0.00 H ATOM 55455 H2 WAT 6444 2.977 67.610 153.618 1.00 0.00 H TER 55457 WAT 6444 ATOM 55457 O WAT 6445 38.666 143.778 116.387 1.00 0.00 O ATOM 55458 H1 WAT 6445 37.862 143.499 115.949 1.00 0.00 H ATOM 55459 H2 WAT 6445 39.365 143.537 115.780 1.00 0.00 H TER 55461 WAT 6445 ATOM 55461 O WAT 6446 14.579 54.984 1.142 1.00 0.00 O ATOM 55462 H1 WAT 6446 14.769 55.433 1.966 1.00 0.00 H ATOM 55463 H2 WAT 6446 15.425 54.636 0.859 1.00 0.00 H TER 55465 WAT 6446 ATOM 55465 O WAT 6447 47.507 124.515 94.412 1.00 0.00 O ATOM 55466 H1 WAT 6447 47.191 125.365 94.720 1.00 0.00 H ATOM 55467 H2 WAT 6447 46.997 123.876 94.910 1.00 0.00 H TER 55469 WAT 6447 ATOM 55469 O WAT 6448 43.953 73.166 77.318 1.00 0.00 O ATOM 55470 H1 WAT 6448 44.736 72.770 77.702 1.00 0.00 H ATOM 55471 H2 WAT 6448 43.353 73.274 78.055 1.00 0.00 H TER 55473 WAT 6448 ATOM 55473 O WAT 6449 145.594 29.630 137.009 1.00 0.00 O ATOM 55474 H1 WAT 6449 145.571 29.433 137.946 1.00 0.00 H ATOM 55475 H2 WAT 6449 146.281 29.062 136.662 1.00 0.00 H TER 55477 WAT 6449 ATOM 55477 O WAT 6450 21.073 92.602 97.234 1.00 0.00 O ATOM 55478 H1 WAT 6450 20.117 92.595 97.201 1.00 0.00 H ATOM 55479 H2 WAT 6450 21.346 92.285 96.373 1.00 0.00 H TER 55481 WAT 6450 ATOM 55481 O WAT 6451 141.473 101.619 119.428 1.00 0.00 O ATOM 55482 H1 WAT 6451 141.097 101.386 120.277 1.00 0.00 H ATOM 55483 H2 WAT 6451 140.855 102.250 119.057 1.00 0.00 H TER 55485 WAT 6451 ATOM 55485 O WAT 6452 103.170 35.370 119.692 1.00 0.00 O ATOM 55486 H1 WAT 6452 103.016 35.454 120.632 1.00 0.00 H ATOM 55487 H2 WAT 6452 104.052 35.719 119.561 1.00 0.00 H TER 55489 WAT 6452 ATOM 55489 O WAT 6453 44.297 12.705 155.918 1.00 0.00 O ATOM 55490 H1 WAT 6453 44.602 11.985 155.365 1.00 0.00 H ATOM 55491 H2 WAT 6453 43.493 12.376 156.319 1.00 0.00 H TER 55493 WAT 6453 ATOM 55493 O WAT 6454 33.891 144.376 77.504 1.00 0.00 O ATOM 55494 H1 WAT 6454 33.369 144.674 76.759 1.00 0.00 H ATOM 55495 H2 WAT 6454 34.641 143.931 77.109 1.00 0.00 H TER 55497 WAT 6454 ATOM 55497 O WAT 6455 122.910 54.449 103.830 1.00 0.00 O ATOM 55498 H1 WAT 6455 123.575 55.080 103.556 1.00 0.00 H ATOM 55499 H2 WAT 6455 122.957 54.452 104.786 1.00 0.00 H TER 55501 WAT 6455 ATOM 55501 O WAT 6456 90.435 127.155 89.074 1.00 0.00 O ATOM 55502 H1 WAT 6456 90.515 126.241 89.344 1.00 0.00 H ATOM 55503 H2 WAT 6456 90.907 127.646 89.747 1.00 0.00 H TER 55505 WAT 6456 ATOM 55505 O WAT 6457 105.343 92.450 139.820 1.00 0.00 O ATOM 55506 H1 WAT 6457 105.118 91.520 139.856 1.00 0.00 H ATOM 55507 H2 WAT 6457 106.162 92.517 140.312 1.00 0.00 H TER 55509 WAT 6457 ATOM 55509 O WAT 6458 87.026 8.646 148.796 1.00 0.00 O ATOM 55510 H1 WAT 6458 87.939 8.594 148.513 1.00 0.00 H ATOM 55511 H2 WAT 6458 86.584 9.126 148.096 1.00 0.00 H TER 55513 WAT 6458 ATOM 55513 O WAT 6459 114.695 0.430 93.943 1.00 0.00 O ATOM 55514 H1 WAT 6459 113.856 0.040 94.189 1.00 0.00 H ATOM 55515 H2 WAT 6459 114.727 1.255 94.426 1.00 0.00 H TER 55517 WAT 6459 ATOM 55517 O WAT 6460 141.806 84.885 138.145 1.00 0.00 O ATOM 55518 H1 WAT 6460 141.004 85.352 137.910 1.00 0.00 H ATOM 55519 H2 WAT 6460 142.073 84.446 137.338 1.00 0.00 H TER 55521 WAT 6460 ATOM 55521 O WAT 6461 6.926 21.006 72.291 1.00 0.00 O ATOM 55522 H1 WAT 6461 7.478 20.790 73.043 1.00 0.00 H ATOM 55523 H2 WAT 6461 6.874 21.962 72.300 1.00 0.00 H TER 55525 WAT 6461 ATOM 55525 O WAT 6462 83.717 139.223 154.662 1.00 0.00 O ATOM 55526 H1 WAT 6462 82.956 139.150 154.086 1.00 0.00 H ATOM 55527 H2 WAT 6462 84.461 138.992 154.105 1.00 0.00 H TER 55529 WAT 6462 ATOM 55529 O WAT 6463 118.884 21.801 9.365 1.00 0.00 O ATOM 55530 H1 WAT 6463 118.227 21.142 9.591 1.00 0.00 H ATOM 55531 H2 WAT 6463 119.708 21.438 9.689 1.00 0.00 H TER 55533 WAT 6463 ATOM 55533 O WAT 6464 23.763 125.148 62.940 1.00 0.00 O ATOM 55534 H1 WAT 6464 23.138 124.808 63.580 1.00 0.00 H ATOM 55535 H2 WAT 6464 23.703 126.099 63.029 1.00 0.00 H TER 55537 WAT 6464 ATOM 55537 O WAT 6465 17.626 83.246 0.420 1.00 0.00 O ATOM 55538 H1 WAT 6465 17.882 82.342 0.241 1.00 0.00 H ATOM 55539 H2 WAT 6465 18.394 83.635 0.839 1.00 0.00 H TER 55541 WAT 6465 ATOM 55541 O WAT 6466 104.399 36.339 62.888 1.00 0.00 O ATOM 55542 H1 WAT 6466 105.117 36.035 63.444 1.00 0.00 H ATOM 55543 H2 WAT 6466 104.399 37.290 62.998 1.00 0.00 H TER 55545 WAT 6466 ATOM 55545 O WAT 6467 12.577 62.096 130.824 1.00 0.00 O ATOM 55546 H1 WAT 6467 13.300 62.587 130.434 1.00 0.00 H ATOM 55547 H2 WAT 6467 12.265 62.653 131.537 1.00 0.00 H TER 55549 WAT 6467 ATOM 55549 O WAT 6468 142.084 64.831 123.670 1.00 0.00 O ATOM 55550 H1 WAT 6468 141.844 64.551 122.787 1.00 0.00 H ATOM 55551 H2 WAT 6468 142.417 64.039 124.091 1.00 0.00 H TER 55553 WAT 6468 ATOM 55553 O WAT 6469 114.584 49.317 11.981 1.00 0.00 O ATOM 55554 H1 WAT 6469 114.993 48.534 11.611 1.00 0.00 H ATOM 55555 H2 WAT 6469 113.873 48.981 12.527 1.00 0.00 H TER 55557 WAT 6469 ATOM 55557 O WAT 6470 105.758 82.714 150.077 1.00 0.00 O ATOM 55558 H1 WAT 6470 105.164 81.963 150.057 1.00 0.00 H ATOM 55559 H2 WAT 6470 106.461 82.479 149.472 1.00 0.00 H TER 55561 WAT 6470 ATOM 55561 O WAT 6471 0.148 115.529 151.766 1.00 0.00 O ATOM 55562 H1 WAT 6471 -0.349 115.353 150.967 1.00 0.00 H ATOM 55563 H2 WAT 6471 0.810 114.838 151.793 1.00 0.00 H TER 55565 WAT 6471 ATOM 55565 O WAT 6472 62.882 102.501 55.972 1.00 0.00 O ATOM 55566 H1 WAT 6472 63.141 101.973 56.727 1.00 0.00 H ATOM 55567 H2 WAT 6472 62.885 103.401 56.296 1.00 0.00 H TER 55569 WAT 6472 ATOM 55569 O WAT 6473 63.497 98.394 110.637 1.00 0.00 O ATOM 55570 H1 WAT 6473 63.330 97.645 110.065 1.00 0.00 H ATOM 55571 H2 WAT 6473 63.150 98.127 111.488 1.00 0.00 H TER 55573 WAT 6473 ATOM 55573 O WAT 6474 21.373 57.059 137.460 1.00 0.00 O ATOM 55574 H1 WAT 6474 20.498 57.164 137.834 1.00 0.00 H ATOM 55575 H2 WAT 6474 21.560 57.903 137.048 1.00 0.00 H TER 55577 WAT 6474 ATOM 55577 O WAT 6475 18.591 38.625 134.724 1.00 0.00 O ATOM 55578 H1 WAT 6475 18.189 38.236 133.947 1.00 0.00 H ATOM 55579 H2 WAT 6475 19.453 38.213 134.780 1.00 0.00 H TER 55581 WAT 6475 ATOM 55581 O WAT 6476 72.279 131.867 140.238 1.00 0.00 O ATOM 55582 H1 WAT 6476 71.867 131.663 139.399 1.00 0.00 H ATOM 55583 H2 WAT 6476 73.101 132.298 140.003 1.00 0.00 H TER 55585 WAT 6476 ATOM 55585 O WAT 6477 17.927 119.067 151.395 1.00 0.00 O ATOM 55586 H1 WAT 6477 17.077 119.089 150.956 1.00 0.00 H ATOM 55587 H2 WAT 6477 18.295 118.214 151.163 1.00 0.00 H TER 55589 WAT 6477 ATOM 55589 O WAT 6478 21.778 67.892 66.009 1.00 0.00 O ATOM 55590 H1 WAT 6478 22.300 67.143 65.720 1.00 0.00 H ATOM 55591 H2 WAT 6478 22.142 68.637 65.530 1.00 0.00 H TER 55593 WAT 6478 ATOM 55593 O WAT 6479 85.126 12.306 133.265 1.00 0.00 O ATOM 55594 H1 WAT 6479 84.567 12.605 132.548 1.00 0.00 H ATOM 55595 H2 WAT 6479 85.609 11.565 132.898 1.00 0.00 H TER 55597 WAT 6479 ATOM 55597 O WAT 6480 17.566 88.076 118.843 1.00 0.00 O ATOM 55598 H1 WAT 6480 16.731 87.612 118.891 1.00 0.00 H ATOM 55599 H2 WAT 6480 17.336 88.952 118.532 1.00 0.00 H TER 55601 WAT 6480 ATOM 55601 O WAT 6481 125.620 103.845 117.114 1.00 0.00 O ATOM 55602 H1 WAT 6481 126.340 103.821 117.745 1.00 0.00 H ATOM 55603 H2 WAT 6481 124.919 104.313 117.567 1.00 0.00 H TER 55605 WAT 6481 ATOM 55605 O WAT 6482 23.608 19.566 65.320 1.00 0.00 O ATOM 55606 H1 WAT 6482 23.400 20.488 65.168 1.00 0.00 H ATOM 55607 H2 WAT 6482 24.304 19.371 64.693 1.00 0.00 H TER 55609 WAT 6482 ATOM 55609 O WAT 6483 18.898 120.145 88.274 1.00 0.00 O ATOM 55610 H1 WAT 6483 18.756 120.962 88.752 1.00 0.00 H ATOM 55611 H2 WAT 6483 19.418 120.401 87.512 1.00 0.00 H TER 55613 WAT 6483 ATOM 55613 O WAT 6484 93.834 90.269 60.072 1.00 0.00 O ATOM 55614 H1 WAT 6484 94.261 91.015 60.493 1.00 0.00 H ATOM 55615 H2 WAT 6484 94.130 90.306 59.162 1.00 0.00 H TER 55617 WAT 6484 ATOM 55617 O WAT 6485 71.840 65.667 79.206 1.00 0.00 O ATOM 55618 H1 WAT 6485 71.100 65.184 78.839 1.00 0.00 H ATOM 55619 H2 WAT 6485 71.928 65.330 80.098 1.00 0.00 H TER 55621 WAT 6485 ATOM 55621 O WAT 6486 128.086 62.670 64.663 1.00 0.00 O ATOM 55622 H1 WAT 6486 127.857 62.717 63.735 1.00 0.00 H ATOM 55623 H2 WAT 6486 127.609 61.907 64.989 1.00 0.00 H TER 55625 WAT 6486 ATOM 55625 O WAT 6487 22.109 122.600 27.701 1.00 0.00 O ATOM 55626 H1 WAT 6487 21.964 123.447 27.280 1.00 0.00 H ATOM 55627 H2 WAT 6487 23.044 122.590 27.905 1.00 0.00 H TER 55629 WAT 6487 ATOM 55629 O WAT 6488 0.635 99.270 74.940 1.00 0.00 O ATOM 55630 H1 WAT 6488 1.452 99.326 75.436 1.00 0.00 H ATOM 55631 H2 WAT 6488 0.779 99.830 74.177 1.00 0.00 H TER 55633 WAT 6488 ATOM 55633 O WAT 6489 86.625 129.918 111.814 1.00 0.00 O ATOM 55634 H1 WAT 6489 86.743 129.828 112.760 1.00 0.00 H ATOM 55635 H2 WAT 6489 87.417 129.536 111.437 1.00 0.00 H TER 55637 WAT 6489 ATOM 55637 O WAT 6490 89.966 130.578 63.168 1.00 0.00 O ATOM 55638 H1 WAT 6490 89.034 130.604 62.952 1.00 0.00 H ATOM 55639 H2 WAT 6490 90.283 131.459 62.968 1.00 0.00 H TER 55641 WAT 6490 ATOM 55641 O WAT 6491 19.896 47.664 140.143 1.00 0.00 O ATOM 55642 H1 WAT 6491 19.882 48.531 140.550 1.00 0.00 H ATOM 55643 H2 WAT 6491 20.175 47.827 139.242 1.00 0.00 H TER 55645 WAT 6491 ATOM 55645 O WAT 6492 41.631 55.503 98.291 1.00 0.00 O ATOM 55646 H1 WAT 6492 41.768 55.155 99.172 1.00 0.00 H ATOM 55647 H2 WAT 6492 42.293 55.066 97.755 1.00 0.00 H TER 55649 WAT 6492 ATOM 55649 O WAT 6493 9.335 32.046 143.909 1.00 0.00 O ATOM 55650 H1 WAT 6493 9.593 32.594 143.168 1.00 0.00 H ATOM 55651 H2 WAT 6493 10.161 31.797 144.324 1.00 0.00 H TER 55653 WAT 6493 ATOM 55653 O WAT 6494 42.591 77.638 11.058 1.00 0.00 O ATOM 55654 H1 WAT 6494 41.708 77.741 10.705 1.00 0.00 H ATOM 55655 H2 WAT 6494 42.754 78.451 11.536 1.00 0.00 H TER 55657 WAT 6494 ATOM 55657 O WAT 6495 82.235 73.020 25.436 1.00 0.00 O ATOM 55658 H1 WAT 6495 81.541 72.363 25.385 1.00 0.00 H ATOM 55659 H2 WAT 6495 82.683 72.830 26.261 1.00 0.00 H TER 55661 WAT 6495 ATOM 55661 O WAT 6496 91.265 132.178 138.093 1.00 0.00 O ATOM 55662 H1 WAT 6496 91.486 131.379 137.615 1.00 0.00 H ATOM 55663 H2 WAT 6496 90.353 132.352 137.862 1.00 0.00 H TER 55665 WAT 6496 ATOM 55665 O WAT 6497 68.073 120.032 1.410 1.00 0.00 O ATOM 55666 H1 WAT 6497 68.380 120.258 2.289 1.00 0.00 H ATOM 55667 H2 WAT 6497 68.767 119.480 1.049 1.00 0.00 H TER 55669 WAT 6497 ATOM 55669 O WAT 6498 26.395 140.995 126.330 1.00 0.00 O ATOM 55670 H1 WAT 6498 26.272 140.104 126.658 1.00 0.00 H ATOM 55671 H2 WAT 6498 25.536 141.245 125.989 1.00 0.00 H TER 55673 WAT 6498 ATOM 55673 O WAT 6499 65.799 38.789 141.697 1.00 0.00 O ATOM 55674 H1 WAT 6499 65.104 38.254 142.081 1.00 0.00 H ATOM 55675 H2 WAT 6499 66.135 38.260 140.973 1.00 0.00 H TER 55677 WAT 6499 ATOM 55677 O WAT 6500 62.482 66.574 135.991 1.00 0.00 O ATOM 55678 H1 WAT 6500 63.304 66.087 136.052 1.00 0.00 H ATOM 55679 H2 WAT 6500 62.478 67.134 136.768 1.00 0.00 H TER 55681 WAT 6500 ATOM 55681 O WAT 6501 122.522 16.018 3.226 1.00 0.00 O ATOM 55682 H1 WAT 6501 122.211 16.702 3.819 1.00 0.00 H ATOM 55683 H2 WAT 6501 122.500 16.425 2.360 1.00 0.00 H TER 55685 WAT 6501 ATOM 55685 O WAT 6502 93.989 101.703 83.777 1.00 0.00 O ATOM 55686 H1 WAT 6502 94.200 100.770 83.812 1.00 0.00 H ATOM 55687 H2 WAT 6502 94.264 101.979 82.903 1.00 0.00 H TER 55689 WAT 6502 ATOM 55689 O WAT 6503 122.918 78.091 8.646 1.00 0.00 O ATOM 55690 H1 WAT 6503 122.555 78.305 9.505 1.00 0.00 H ATOM 55691 H2 WAT 6503 123.865 78.064 8.786 1.00 0.00 H TER 55693 WAT 6503 ATOM 55693 O WAT 6504 58.868 4.027 14.409 1.00 0.00 O ATOM 55694 H1 WAT 6504 59.496 4.563 14.894 1.00 0.00 H ATOM 55695 H2 WAT 6504 58.648 4.554 13.640 1.00 0.00 H TER 55697 WAT 6504 ATOM 55697 O WAT 6505 109.030 103.795 5.009 1.00 0.00 O ATOM 55698 H1 WAT 6505 108.351 103.643 5.666 1.00 0.00 H ATOM 55699 H2 WAT 6505 108.782 104.622 4.595 1.00 0.00 H TER 55701 WAT 6505 ATOM 55701 O WAT 6506 5.027 39.411 151.160 1.00 0.00 O ATOM 55702 H1 WAT 6506 4.618 39.414 150.295 1.00 0.00 H ATOM 55703 H2 WAT 6506 5.014 40.328 151.434 1.00 0.00 H TER 55705 WAT 6506 ATOM 55705 O WAT 6507 45.107 55.884 128.725 1.00 0.00 O ATOM 55706 H1 WAT 6507 44.260 56.328 128.680 1.00 0.00 H ATOM 55707 H2 WAT 6507 44.973 55.177 129.357 1.00 0.00 H TER 55709 WAT 6507 ATOM 55709 O WAT 6508 67.046 110.677 104.824 1.00 0.00 O ATOM 55710 H1 WAT 6508 67.164 110.182 105.635 1.00 0.00 H ATOM 55711 H2 WAT 6508 66.916 110.009 104.152 1.00 0.00 H TER 55713 WAT 6508 ATOM 55713 O WAT 6509 35.141 29.051 132.449 1.00 0.00 O ATOM 55714 H1 WAT 6509 34.589 29.703 132.017 1.00 0.00 H ATOM 55715 H2 WAT 6509 35.412 29.470 133.266 1.00 0.00 H TER 55717 WAT 6509 ATOM 55717 O WAT 6510 111.886 84.275 158.176 1.00 0.00 O ATOM 55718 H1 WAT 6510 111.974 84.594 157.278 1.00 0.00 H ATOM 55719 H2 WAT 6510 112.780 84.274 158.518 1.00 0.00 H TER 55721 WAT 6510 ATOM 55721 O WAT 6511 129.361 121.871 120.633 1.00 0.00 O ATOM 55722 H1 WAT 6511 130.200 121.415 120.575 1.00 0.00 H ATOM 55723 H2 WAT 6511 128.960 121.744 119.773 1.00 0.00 H TER 55725 WAT 6511 ATOM 55725 O WAT 6512 17.798 12.885 61.044 1.00 0.00 O ATOM 55726 H1 WAT 6512 18.513 12.483 61.538 1.00 0.00 H ATOM 55727 H2 WAT 6512 17.296 13.369 61.700 1.00 0.00 H TER 55729 WAT 6512 ATOM 55729 O WAT 6513 110.564 14.508 53.309 1.00 0.00 O ATOM 55730 H1 WAT 6513 110.919 14.172 52.486 1.00 0.00 H ATOM 55731 H2 WAT 6513 109.886 15.129 53.041 1.00 0.00 H TER 55733 WAT 6513 ATOM 55733 O WAT 6514 24.899 27.046 103.277 1.00 0.00 O ATOM 55734 H1 WAT 6514 25.102 27.514 104.087 1.00 0.00 H ATOM 55735 H2 WAT 6514 24.016 27.336 103.049 1.00 0.00 H TER 55737 WAT 6514 ATOM 55737 O WAT 6515 108.061 53.112 127.576 1.00 0.00 O ATOM 55738 H1 WAT 6515 108.938 53.101 127.960 1.00 0.00 H ATOM 55739 H2 WAT 6515 107.606 52.382 127.997 1.00 0.00 H TER 55741 WAT 6515 ATOM 55741 O WAT 6516 7.649 87.152 84.517 1.00 0.00 O ATOM 55742 H1 WAT 6516 8.174 86.395 84.777 1.00 0.00 H ATOM 55743 H2 WAT 6516 6.779 86.792 84.342 1.00 0.00 H TER 55745 WAT 6516 ATOM 55745 O WAT 6517 86.391 91.368 142.061 1.00 0.00 O ATOM 55746 H1 WAT 6517 86.973 91.921 141.541 1.00 0.00 H ATOM 55747 H2 WAT 6517 86.154 90.651 141.473 1.00 0.00 H TER 55749 WAT 6517 ATOM 55749 O WAT 6518 43.683 99.948 1.646 1.00 0.00 O ATOM 55750 H1 WAT 6518 43.895 99.030 1.477 1.00 0.00 H ATOM 55751 H2 WAT 6518 42.899 99.917 2.194 1.00 0.00 H TER 55753 WAT 6518 ATOM 55753 O WAT 6519 83.461 134.362 157.357 1.00 0.00 O ATOM 55754 H1 WAT 6519 83.380 135.225 156.950 1.00 0.00 H ATOM 55755 H2 WAT 6519 82.781 134.350 158.030 1.00 0.00 H TER 55757 WAT 6519 ATOM 55757 O WAT 6520 76.159 124.388 92.027 1.00 0.00 O ATOM 55758 H1 WAT 6520 75.991 123.454 92.154 1.00 0.00 H ATOM 55759 H2 WAT 6520 76.522 124.682 92.862 1.00 0.00 H TER 55761 WAT 6520 ATOM 55761 O WAT 6521 81.452 77.923 103.423 1.00 0.00 O ATOM 55762 H1 WAT 6521 82.151 77.539 102.894 1.00 0.00 H ATOM 55763 H2 WAT 6521 81.894 78.243 104.209 1.00 0.00 H TER 55765 WAT 6521 ATOM 55765 O WAT 6522 144.657 114.973 115.536 1.00 0.00 O ATOM 55766 H1 WAT 6522 144.673 114.333 116.248 1.00 0.00 H ATOM 55767 H2 WAT 6522 145.573 115.064 115.274 1.00 0.00 H TER 55769 WAT 6522 ATOM 55769 O WAT 6523 1.752 110.055 158.383 1.00 0.00 O ATOM 55770 H1 WAT 6523 2.009 110.405 159.236 1.00 0.00 H ATOM 55771 H2 WAT 6523 1.407 110.812 157.909 1.00 0.00 H TER 55773 WAT 6523 ATOM 55773 O WAT 6524 16.147 91.246 114.358 1.00 0.00 O ATOM 55774 H1 WAT 6524 15.877 90.505 113.815 1.00 0.00 H ATOM 55775 H2 WAT 6524 16.935 90.939 114.807 1.00 0.00 H TER 55777 WAT 6524 ATOM 55777 O WAT 6525 50.967 111.668 98.688 1.00 0.00 O ATOM 55778 H1 WAT 6525 51.466 111.155 99.323 1.00 0.00 H ATOM 55779 H2 WAT 6525 50.350 111.044 98.306 1.00 0.00 H TER 55781 WAT 6525 ATOM 55781 O WAT 6526 34.747 28.843 149.233 1.00 0.00 O ATOM 55782 H1 WAT 6526 34.359 29.431 148.586 1.00 0.00 H ATOM 55783 H2 WAT 6526 34.731 29.342 150.050 1.00 0.00 H TER 55785 WAT 6526 ATOM 55785 O WAT 6527 48.962 37.297 118.454 1.00 0.00 O ATOM 55786 H1 WAT 6527 48.523 37.680 119.214 1.00 0.00 H ATOM 55787 H2 WAT 6527 49.780 36.943 118.804 1.00 0.00 H TER 55789 WAT 6527 ATOM 55789 O WAT 6528 52.412 19.196 157.213 1.00 0.00 O ATOM 55790 H1 WAT 6528 51.506 19.292 157.506 1.00 0.00 H ATOM 55791 H2 WAT 6528 52.508 18.261 157.032 1.00 0.00 H TER 55793 WAT 6528 ATOM 55793 O WAT 6529 47.758 49.685 80.287 1.00 0.00 O ATOM 55794 H1 WAT 6529 47.643 48.874 79.791 1.00 0.00 H ATOM 55795 H2 WAT 6529 47.254 50.337 79.799 1.00 0.00 H TER 55797 WAT 6529 ATOM 55797 O WAT 6530 39.788 118.766 77.017 1.00 0.00 O ATOM 55798 H1 WAT 6530 39.713 119.054 77.927 1.00 0.00 H ATOM 55799 H2 WAT 6530 39.000 118.244 76.866 1.00 0.00 H TER 55801 WAT 6530 ATOM 55801 O WAT 6531 62.500 122.627 73.132 1.00 0.00 O ATOM 55802 H1 WAT 6531 63.094 122.636 73.883 1.00 0.00 H ATOM 55803 H2 WAT 6531 63.078 122.655 72.370 1.00 0.00 H TER 55805 WAT 6531 ATOM 55805 O WAT 6532 54.759 62.799 16.904 1.00 0.00 O ATOM 55806 H1 WAT 6532 54.887 62.184 16.182 1.00 0.00 H ATOM 55807 H2 WAT 6532 54.924 62.282 17.692 1.00 0.00 H TER 55809 WAT 6532 ATOM 55809 O WAT 6533 120.277 28.729 85.638 1.00 0.00 O ATOM 55810 H1 WAT 6533 120.969 29.032 85.050 1.00 0.00 H ATOM 55811 H2 WAT 6533 120.061 27.852 85.321 1.00 0.00 H TER 55813 WAT 6533 ATOM 55813 O WAT 6534 13.067 62.767 95.593 1.00 0.00 O ATOM 55814 H1 WAT 6534 12.532 62.503 94.844 1.00 0.00 H ATOM 55815 H2 WAT 6534 13.895 63.052 95.206 1.00 0.00 H TER 55817 WAT 6534 ATOM 55817 O WAT 6535 139.422 114.381 117.507 1.00 0.00 O ATOM 55818 H1 WAT 6535 138.518 114.398 117.192 1.00 0.00 H ATOM 55819 H2 WAT 6535 139.918 114.854 116.839 1.00 0.00 H TER 55821 WAT 6535 ATOM 55821 O WAT 6536 37.880 87.377 90.194 1.00 0.00 O ATOM 55822 H1 WAT 6536 37.485 86.900 90.924 1.00 0.00 H ATOM 55823 H2 WAT 6536 38.681 86.891 89.996 1.00 0.00 H TER 55825 WAT 6536 ATOM 55825 O WAT 6537 38.874 81.773 135.707 1.00 0.00 O ATOM 55826 H1 WAT 6537 38.706 81.408 134.838 1.00 0.00 H ATOM 55827 H2 WAT 6537 39.212 82.652 135.536 1.00 0.00 H TER 55829 WAT 6537 ATOM 55829 O WAT 6538 77.594 0.361 113.641 1.00 0.00 O ATOM 55830 H1 WAT 6538 77.003 0.818 114.239 1.00 0.00 H ATOM 55831 H2 WAT 6538 77.053 -0.322 113.245 1.00 0.00 H TER 55833 WAT 6538 ATOM 55833 O WAT 6539 61.955 35.840 81.973 1.00 0.00 O ATOM 55834 H1 WAT 6539 62.042 35.136 81.330 1.00 0.00 H ATOM 55835 H2 WAT 6539 61.144 35.638 82.440 1.00 0.00 H TER 55837 WAT 6539 ATOM 55837 O WAT 6540 86.480 64.634 92.283 1.00 0.00 O ATOM 55838 H1 WAT 6540 87.026 64.768 91.508 1.00 0.00 H ATOM 55839 H2 WAT 6540 86.187 63.725 92.216 1.00 0.00 H TER 55841 WAT 6540 ATOM 55841 O WAT 6541 65.416 29.867 77.962 1.00 0.00 O ATOM 55842 H1 WAT 6541 65.045 30.685 78.292 1.00 0.00 H ATOM 55843 H2 WAT 6541 65.283 29.240 78.674 1.00 0.00 H TER 55845 WAT 6541 ATOM 55845 O WAT 6542 134.542 47.709 20.722 1.00 0.00 O ATOM 55846 H1 WAT 6542 134.357 47.574 21.651 1.00 0.00 H ATOM 55847 H2 WAT 6542 135.227 47.072 20.519 1.00 0.00 H TER 55849 WAT 6542 ATOM 55849 O WAT 6543 86.456 2.867 52.189 1.00 0.00 O ATOM 55850 H1 WAT 6543 87.231 3.167 52.663 1.00 0.00 H ATOM 55851 H2 WAT 6543 85.749 2.910 52.832 1.00 0.00 H TER 55853 WAT 6543 ATOM 55853 O WAT 6544 22.735 73.235 55.993 1.00 0.00 O ATOM 55854 H1 WAT 6544 23.030 72.325 55.987 1.00 0.00 H ATOM 55855 H2 WAT 6544 23.504 73.738 55.725 1.00 0.00 H TER 55857 WAT 6544 ATOM 55857 O WAT 6545 73.083 51.226 141.284 1.00 0.00 O ATOM 55858 H1 WAT 6545 72.431 50.585 141.567 1.00 0.00 H ATOM 55859 H2 WAT 6545 73.609 50.762 140.632 1.00 0.00 H TER 55861 WAT 6545 ATOM 55861 O WAT 6546 47.151 121.948 1.891 1.00 0.00 O ATOM 55862 H1 WAT 6546 46.906 121.337 1.196 1.00 0.00 H ATOM 55863 H2 WAT 6546 46.694 122.759 1.669 1.00 0.00 H TER 55865 WAT 6546 ATOM 55865 O WAT 6547 105.587 5.009 73.733 1.00 0.00 O ATOM 55866 H1 WAT 6547 105.612 4.975 72.777 1.00 0.00 H ATOM 55867 H2 WAT 6547 106.403 5.446 73.979 1.00 0.00 H TER 55869 WAT 6547 ATOM 55869 O WAT 6548 104.723 80.992 5.111 1.00 0.00 O ATOM 55870 H1 WAT 6548 104.609 81.321 6.003 1.00 0.00 H ATOM 55871 H2 WAT 6548 105.623 81.226 4.883 1.00 0.00 H TER 55873 WAT 6548 ATOM 55873 O WAT 6549 95.556 135.213 143.103 1.00 0.00 O ATOM 55874 H1 WAT 6549 95.462 135.161 144.054 1.00 0.00 H ATOM 55875 H2 WAT 6549 96.472 135.458 142.966 1.00 0.00 H TER 55877 WAT 6549 ATOM 55877 O WAT 6550 9.666 142.800 158.201 1.00 0.00 O ATOM 55878 H1 WAT 6550 9.107 142.731 157.427 1.00 0.00 H ATOM 55879 H2 WAT 6550 10.303 142.093 158.101 1.00 0.00 H TER 55881 WAT 6550 ATOM 55881 O WAT 6551 52.853 69.171 127.660 1.00 0.00 O ATOM 55882 H1 WAT 6551 52.557 69.808 128.310 1.00 0.00 H ATOM 55883 H2 WAT 6551 53.260 69.699 126.974 1.00 0.00 H TER 55885 WAT 6551 ATOM 55885 O WAT 6552 140.878 124.397 125.452 1.00 0.00 O ATOM 55886 H1 WAT 6552 141.539 124.122 124.817 1.00 0.00 H ATOM 55887 H2 WAT 6552 140.466 125.163 125.053 1.00 0.00 H TER 55889 WAT 6552 ATOM 55889 O WAT 6553 55.524 41.463 117.596 1.00 0.00 O ATOM 55890 H1 WAT 6553 55.239 40.626 117.230 1.00 0.00 H ATOM 55891 H2 WAT 6553 55.625 42.035 116.835 1.00 0.00 H TER 55893 WAT 6553 ATOM 55893 O WAT 6554 30.746 108.449 136.022 1.00 0.00 O ATOM 55894 H1 WAT 6554 29.856 108.799 136.048 1.00 0.00 H ATOM 55895 H2 WAT 6554 30.771 107.803 136.728 1.00 0.00 H TER 55897 WAT 6554 ATOM 55897 O WAT 6555 57.570 11.655 98.265 1.00 0.00 O ATOM 55898 H1 WAT 6555 57.547 12.182 99.063 1.00 0.00 H ATOM 55899 H2 WAT 6555 58.475 11.723 97.959 1.00 0.00 H TER 55901 WAT 6555 ATOM 55901 O WAT 6556 130.861 51.760 114.661 1.00 0.00 O ATOM 55902 H1 WAT 6556 130.854 52.715 114.595 1.00 0.00 H ATOM 55903 H2 WAT 6556 130.013 51.539 115.046 1.00 0.00 H TER 55905 WAT 6556 ATOM 55905 O WAT 6557 105.198 85.252 150.353 1.00 0.00 O ATOM 55906 H1 WAT 6557 105.431 85.447 149.446 1.00 0.00 H ATOM 55907 H2 WAT 6557 105.390 84.320 150.455 1.00 0.00 H TER 55909 WAT 6557 ATOM 55909 O WAT 6558 139.606 134.701 137.441 1.00 0.00 O ATOM 55910 H1 WAT 6558 140.107 134.715 138.256 1.00 0.00 H ATOM 55911 H2 WAT 6558 140.166 134.231 136.823 1.00 0.00 H TER 55913 WAT 6558 ATOM 55913 O WAT 6559 145.663 132.833 77.148 1.00 0.00 O ATOM 55914 H1 WAT 6559 146.565 133.075 77.353 1.00 0.00 H ATOM 55915 H2 WAT 6559 145.276 133.630 76.787 1.00 0.00 H TER 55917 WAT 6559 ATOM 55917 O WAT 6560 60.254 30.071 149.592 1.00 0.00 O ATOM 55918 H1 WAT 6560 60.487 29.371 150.202 1.00 0.00 H ATOM 55919 H2 WAT 6560 59.754 30.692 150.122 1.00 0.00 H TER 55921 WAT 6560 ATOM 55921 O WAT 6561 80.388 83.126 89.095 1.00 0.00 O ATOM 55922 H1 WAT 6561 80.430 82.185 88.926 1.00 0.00 H ATOM 55923 H2 WAT 6561 80.186 83.513 88.243 1.00 0.00 H TER 55925 WAT 6561 ATOM 55925 O WAT 6562 0.966 106.755 126.288 1.00 0.00 O ATOM 55926 H1 WAT 6562 0.169 106.227 126.249 1.00 0.00 H ATOM 55927 H2 WAT 6562 1.513 106.416 125.579 1.00 0.00 H TER 55929 WAT 6562 ATOM 55929 O WAT 6563 36.518 127.474 73.861 1.00 0.00 O ATOM 55930 H1 WAT 6563 37.183 127.405 74.546 1.00 0.00 H ATOM 55931 H2 WAT 6563 36.997 127.321 73.046 1.00 0.00 H TER 55933 WAT 6563 ATOM 55933 O WAT 6564 140.915 47.614 96.710 1.00 0.00 O ATOM 55934 H1 WAT 6564 141.519 48.355 96.752 1.00 0.00 H ATOM 55935 H2 WAT 6564 141.447 46.856 96.953 1.00 0.00 H TER 55937 WAT 6564 ATOM 55937 O WAT 6565 72.143 93.758 152.572 1.00 0.00 O ATOM 55938 H1 WAT 6565 72.591 94.574 152.350 1.00 0.00 H ATOM 55939 H2 WAT 6565 72.043 93.304 151.736 1.00 0.00 H TER 55941 WAT 6565 ATOM 55941 O WAT 6566 90.317 96.140 125.478 1.00 0.00 O ATOM 55942 H1 WAT 6566 90.662 97.031 125.540 1.00 0.00 H ATOM 55943 H2 WAT 6566 89.718 96.063 126.221 1.00 0.00 H TER 55945 WAT 6566 ATOM 55945 O WAT 6567 145.084 139.257 112.932 1.00 0.00 O ATOM 55946 H1 WAT 6567 145.598 139.567 113.678 1.00 0.00 H ATOM 55947 H2 WAT 6567 145.517 139.637 112.168 1.00 0.00 H TER 55949 WAT 6567 ATOM 55949 O WAT 6568 78.472 112.442 124.948 1.00 0.00 O ATOM 55950 H1 WAT 6568 78.430 111.580 124.533 1.00 0.00 H ATOM 55951 H2 WAT 6568 77.562 112.736 124.982 1.00 0.00 H TER 55953 WAT 6568 ATOM 55953 O WAT 6569 40.756 142.916 15.899 1.00 0.00 O ATOM 55954 H1 WAT 6569 39.958 142.514 15.556 1.00 0.00 H ATOM 55955 H2 WAT 6569 40.558 143.852 15.929 1.00 0.00 H TER 55957 WAT 6569 ATOM 55957 O WAT 6570 51.923 101.244 81.523 1.00 0.00 O ATOM 55958 H1 WAT 6570 52.284 102.062 81.864 1.00 0.00 H ATOM 55959 H2 WAT 6570 51.153 101.077 82.068 1.00 0.00 H TER 55961 WAT 6570 ATOM 55961 O WAT 6571 86.577 14.045 90.368 1.00 0.00 O ATOM 55962 H1 WAT 6571 86.483 13.174 89.983 1.00 0.00 H ATOM 55963 H2 WAT 6571 87.344 13.974 90.937 1.00 0.00 H TER 55965 WAT 6571 ATOM 55965 O WAT 6572 83.276 104.757 134.403 1.00 0.00 O ATOM 55966 H1 WAT 6572 82.344 104.934 134.278 1.00 0.00 H ATOM 55967 H2 WAT 6572 83.672 105.622 134.508 1.00 0.00 H TER 55969 WAT 6572 ATOM 55969 O WAT 6573 44.105 20.409 149.354 1.00 0.00 O ATOM 55970 H1 WAT 6573 43.184 20.239 149.153 1.00 0.00 H ATOM 55971 H2 WAT 6573 44.536 19.563 149.235 1.00 0.00 H TER 55973 WAT 6573 ATOM 55973 O WAT 6574 124.367 50.167 121.081 1.00 0.00 O ATOM 55974 H1 WAT 6574 124.932 50.312 120.322 1.00 0.00 H ATOM 55975 H2 WAT 6574 123.922 49.341 120.893 1.00 0.00 H TER 55977 WAT 6574 ATOM 55977 O WAT 6575 10.686 98.052 10.690 1.00 0.00 O ATOM 55978 H1 WAT 6575 10.878 97.264 10.182 1.00 0.00 H ATOM 55979 H2 WAT 6575 9.755 98.214 10.538 1.00 0.00 H TER 55981 WAT 6575 ATOM 55981 O WAT 6576 114.408 104.266 155.506 1.00 0.00 O ATOM 55982 H1 WAT 6576 114.161 103.370 155.733 1.00 0.00 H ATOM 55983 H2 WAT 6576 113.935 104.811 156.134 1.00 0.00 H TER 55985 WAT 6576 ATOM 55985 O WAT 6577 75.118 108.832 139.799 1.00 0.00 O ATOM 55986 H1 WAT 6577 75.125 107.882 139.912 1.00 0.00 H ATOM 55987 H2 WAT 6577 74.409 108.994 139.176 1.00 0.00 H TER 55989 WAT 6577 ATOM 55989 O WAT 6578 128.062 15.743 152.011 1.00 0.00 O ATOM 55990 H1 WAT 6578 127.545 15.343 151.312 1.00 0.00 H ATOM 55991 H2 WAT 6578 128.739 15.095 152.209 1.00 0.00 H TER 55993 WAT 6578 ATOM 55993 O WAT 6579 66.784 119.304 143.706 1.00 0.00 O ATOM 55994 H1 WAT 6579 66.486 118.444 143.409 1.00 0.00 H ATOM 55995 H2 WAT 6579 66.261 119.482 144.488 1.00 0.00 H TER 55997 WAT 6579 ATOM 55997 O WAT 6580 118.102 128.466 64.192 1.00 0.00 O ATOM 55998 H1 WAT 6580 118.699 128.546 63.448 1.00 0.00 H ATOM 55999 H2 WAT 6580 117.619 129.293 64.201 1.00 0.00 H TER 56001 WAT 6580 ATOM 56001 O WAT 6581 91.902 56.613 7.409 1.00 0.00 O ATOM 56002 H1 WAT 6581 91.930 57.441 6.930 1.00 0.00 H ATOM 56003 H2 WAT 6581 92.666 56.128 7.095 1.00 0.00 H TER 56005 WAT 6581 ATOM 56005 O WAT 6582 48.485 116.825 19.564 1.00 0.00 O ATOM 56006 H1 WAT 6582 48.182 116.240 20.258 1.00 0.00 H ATOM 56007 H2 WAT 6582 47.858 117.549 19.569 1.00 0.00 H TER 56009 WAT 6582 ATOM 56009 O WAT 6583 23.075 25.638 15.123 1.00 0.00 O ATOM 56010 H1 WAT 6583 23.686 26.193 14.639 1.00 0.00 H ATOM 56011 H2 WAT 6583 22.866 24.926 14.517 1.00 0.00 H TER 56013 WAT 6583 ATOM 56013 O WAT 6584 43.729 47.455 92.881 1.00 0.00 O ATOM 56014 H1 WAT 6584 44.402 46.942 92.434 1.00 0.00 H ATOM 56015 H2 WAT 6584 44.202 48.199 93.252 1.00 0.00 H TER 56017 WAT 6584 ATOM 56017 O WAT 6585 13.839 42.196 157.067 1.00 0.00 O ATOM 56018 H1 WAT 6585 14.155 42.876 156.471 1.00 0.00 H ATOM 56019 H2 WAT 6585 13.953 42.570 157.940 1.00 0.00 H TER 56021 WAT 6585 ATOM 56021 O WAT 6586 129.273 5.972 131.701 1.00 0.00 O ATOM 56022 H1 WAT 6586 128.573 6.392 131.201 1.00 0.00 H ATOM 56023 H2 WAT 6586 128.824 5.549 132.433 1.00 0.00 H TER 56025 WAT 6586 ATOM 56025 O WAT 6587 29.526 53.638 118.596 1.00 0.00 O ATOM 56026 H1 WAT 6587 29.700 53.876 117.686 1.00 0.00 H ATOM 56027 H2 WAT 6587 30.387 53.644 119.014 1.00 0.00 H TER 56029 WAT 6587 ATOM 56029 O WAT 6588 37.004 77.479 143.465 1.00 0.00 O ATOM 56030 H1 WAT 6588 36.465 78.022 142.890 1.00 0.00 H ATOM 56031 H2 WAT 6588 36.373 76.988 143.992 1.00 0.00 H TER 56033 WAT 6588 ATOM 56033 O WAT 6589 120.988 49.166 4.303 1.00 0.00 O ATOM 56034 H1 WAT 6589 120.097 49.174 4.652 1.00 0.00 H ATOM 56035 H2 WAT 6589 120.931 49.668 3.489 1.00 0.00 H TER 56037 WAT 6589 ATOM 56037 O WAT 6590 69.614 17.591 7.450 1.00 0.00 O ATOM 56038 H1 WAT 6590 69.406 17.046 6.691 1.00 0.00 H ATOM 56039 H2 WAT 6590 69.479 18.488 7.145 1.00 0.00 H TER 56041 WAT 6590 ATOM 56041 O WAT 6591 13.966 119.084 102.479 1.00 0.00 O ATOM 56042 H1 WAT 6591 14.410 118.472 101.893 1.00 0.00 H ATOM 56043 H2 WAT 6591 13.862 119.882 101.960 1.00 0.00 H TER 56045 WAT 6591 ATOM 56045 O WAT 6592 134.077 17.262 108.110 1.00 0.00 O ATOM 56046 H1 WAT 6592 134.671 18.004 107.994 1.00 0.00 H ATOM 56047 H2 WAT 6592 133.879 17.258 109.046 1.00 0.00 H TER 56049 WAT 6592 ATOM 56049 O WAT 6593 0.715 12.257 136.046 1.00 0.00 O ATOM 56050 H1 WAT 6593 0.228 11.538 136.449 1.00 0.00 H ATOM 56051 H2 WAT 6593 1.239 11.840 135.364 1.00 0.00 H TER 56053 WAT 6593 ATOM 56053 O WAT 6594 36.338 9.392 5.205 1.00 0.00 O ATOM 56054 H1 WAT 6594 36.962 10.070 4.945 1.00 0.00 H ATOM 56055 H2 WAT 6594 35.697 9.852 5.748 1.00 0.00 H TER 56057 WAT 6594 ATOM 56057 O WAT 6595 64.591 90.974 111.245 1.00 0.00 O ATOM 56058 H1 WAT 6595 65.331 90.670 110.720 1.00 0.00 H ATOM 56059 H2 WAT 6595 63.831 90.862 110.673 1.00 0.00 H TER 56061 WAT 6595 ATOM 56061 O WAT 6596 65.824 68.792 111.382 1.00 0.00 O ATOM 56062 H1 WAT 6596 65.401 68.641 112.227 1.00 0.00 H ATOM 56063 H2 WAT 6596 66.758 68.845 111.588 1.00 0.00 H TER 56065 WAT 6596 ATOM 56065 O WAT 6597 78.696 48.754 24.462 1.00 0.00 O ATOM 56066 H1 WAT 6597 77.911 48.913 23.939 1.00 0.00 H ATOM 56067 H2 WAT 6597 78.436 48.074 25.084 1.00 0.00 H TER 56069 WAT 6597 ATOM 56069 O WAT 6598 0.288 143.094 131.633 1.00 0.00 O ATOM 56070 H1 WAT 6598 1.189 143.223 131.930 1.00 0.00 H ATOM 56071 H2 WAT 6598 -0.200 142.887 132.430 1.00 0.00 H TER 56073 WAT 6598 ATOM 56073 O WAT 6599 69.671 134.939 108.762 1.00 0.00 O ATOM 56074 H1 WAT 6599 69.957 134.026 108.777 1.00 0.00 H ATOM 56075 H2 WAT 6599 68.723 134.895 108.885 1.00 0.00 H TER 56077 WAT 6599 ATOM 56077 O WAT 6600 82.846 7.835 92.150 1.00 0.00 O ATOM 56078 H1 WAT 6600 82.041 7.531 91.731 1.00 0.00 H ATOM 56079 H2 WAT 6600 83.353 7.037 92.300 1.00 0.00 H TER 56081 WAT 6600 ATOM 56081 O WAT 6601 49.796 132.729 70.032 1.00 0.00 O ATOM 56082 H1 WAT 6601 48.878 132.770 70.302 1.00 0.00 H ATOM 56083 H2 WAT 6601 50.070 131.838 70.252 1.00 0.00 H TER 56085 WAT 6601 ATOM 56085 O WAT 6602 126.676 100.169 114.858 1.00 0.00 O ATOM 56086 H1 WAT 6602 126.321 99.366 114.476 1.00 0.00 H ATOM 56087 H2 WAT 6602 127.256 99.865 115.557 1.00 0.00 H TER 56089 WAT 6602 ATOM 56089 O WAT 6603 119.933 45.994 112.505 1.00 0.00 O ATOM 56090 H1 WAT 6603 119.851 46.197 111.573 1.00 0.00 H ATOM 56091 H2 WAT 6603 120.472 45.203 112.531 1.00 0.00 H TER 56093 WAT 6603 ATOM 56093 O WAT 6604 100.823 127.464 136.091 1.00 0.00 O ATOM 56094 H1 WAT 6604 101.214 128.223 135.660 1.00 0.00 H ATOM 56095 H2 WAT 6604 100.697 126.827 135.388 1.00 0.00 H TER 56097 WAT 6604 ATOM 56097 O WAT 6605 102.423 63.210 83.922 1.00 0.00 O ATOM 56098 H1 WAT 6605 101.673 62.747 83.549 1.00 0.00 H ATOM 56099 H2 WAT 6605 102.533 62.826 84.792 1.00 0.00 H TER 56101 WAT 6605 ATOM 56101 O WAT 6606 49.493 62.378 146.739 1.00 0.00 O ATOM 56102 H1 WAT 6606 48.562 62.190 146.614 1.00 0.00 H ATOM 56103 H2 WAT 6606 49.787 62.707 145.889 1.00 0.00 H TER 56105 WAT 6606 ATOM 56105 O WAT 6607 100.303 49.878 150.227 1.00 0.00 O ATOM 56106 H1 WAT 6607 100.974 49.977 150.903 1.00 0.00 H ATOM 56107 H2 WAT 6607 99.483 49.794 150.715 1.00 0.00 H TER 56109 WAT 6607 ATOM 56109 O WAT 6608 102.077 59.041 11.253 1.00 0.00 O ATOM 56110 H1 WAT 6608 101.783 58.735 10.394 1.00 0.00 H ATOM 56111 H2 WAT 6608 102.911 58.593 11.394 1.00 0.00 H TER 56113 WAT 6608 ATOM 56113 O WAT 6609 121.279 66.869 95.987 1.00 0.00 O ATOM 56114 H1 WAT 6609 121.614 66.267 96.652 1.00 0.00 H ATOM 56115 H2 WAT 6609 120.432 67.156 96.329 1.00 0.00 H TER 56117 WAT 6609 ATOM 56117 O WAT 6610 87.669 88.986 134.157 1.00 0.00 O ATOM 56118 H1 WAT 6610 87.052 88.886 134.882 1.00 0.00 H ATOM 56119 H2 WAT 6610 88.521 89.093 134.580 1.00 0.00 H TER 56121 WAT 6610 ATOM 56121 O WAT 6611 108.021 98.214 133.629 1.00 0.00 O ATOM 56122 H1 WAT 6611 108.466 98.566 132.858 1.00 0.00 H ATOM 56123 H2 WAT 6611 107.548 97.449 133.303 1.00 0.00 H TER 56125 WAT 6611 ATOM 56125 O WAT 6612 56.147 82.331 12.786 1.00 0.00 O ATOM 56126 H1 WAT 6612 56.720 82.451 13.544 1.00 0.00 H ATOM 56127 H2 WAT 6612 56.340 83.079 12.220 1.00 0.00 H TER 56129 WAT 6612 ATOM 56129 O WAT 6613 57.493 54.082 110.614 1.00 0.00 O ATOM 56130 H1 WAT 6613 56.841 54.781 110.653 1.00 0.00 H ATOM 56131 H2 WAT 6613 58.153 54.403 109.999 1.00 0.00 H TER 56133 WAT 6613 ATOM 56133 O WAT 6614 69.171 34.883 130.141 1.00 0.00 O ATOM 56134 H1 WAT 6614 69.343 34.128 130.702 1.00 0.00 H ATOM 56135 H2 WAT 6614 68.372 35.271 130.499 1.00 0.00 H TER 56137 WAT 6614 ATOM 56137 O WAT 6615 92.610 140.423 137.353 1.00 0.00 O ATOM 56138 H1 WAT 6615 92.907 139.516 137.431 1.00 0.00 H ATOM 56139 H2 WAT 6615 91.894 140.387 136.719 1.00 0.00 H TER 56141 WAT 6615 ATOM 56141 O WAT 6616 45.551 129.694 60.313 1.00 0.00 O ATOM 56142 H1 WAT 6616 44.741 129.374 59.916 1.00 0.00 H ATOM 56143 H2 WAT 6616 46.222 129.079 60.016 1.00 0.00 H TER 56145 WAT 6616 ATOM 56145 O WAT 6617 40.973 43.440 67.568 1.00 0.00 O ATOM 56146 H1 WAT 6617 40.966 43.872 66.714 1.00 0.00 H ATOM 56147 H2 WAT 6617 40.093 43.582 67.916 1.00 0.00 H TER 56149 WAT 6617 ATOM 56149 O WAT 6618 11.965 130.744 5.119 1.00 0.00 O ATOM 56150 H1 WAT 6618 11.285 130.071 5.112 1.00 0.00 H ATOM 56151 H2 WAT 6618 11.941 131.099 6.008 1.00 0.00 H TER 56153 WAT 6618 ATOM 56153 O WAT 6619 41.079 9.545 68.836 1.00 0.00 O ATOM 56154 H1 WAT 6619 41.139 8.795 68.244 1.00 0.00 H ATOM 56155 H2 WAT 6619 41.807 10.111 68.580 1.00 0.00 H TER 56157 WAT 6619 ATOM 56157 O WAT 6620 125.296 2.396 67.677 1.00 0.00 O ATOM 56158 H1 WAT 6620 124.484 2.891 67.571 1.00 0.00 H ATOM 56159 H2 WAT 6620 125.196 1.643 67.095 1.00 0.00 H TER 56161 WAT 6620 ATOM 56161 O WAT 6621 50.903 137.769 4.587 1.00 0.00 O ATOM 56162 H1 WAT 6621 50.196 137.218 4.923 1.00 0.00 H ATOM 56163 H2 WAT 6621 51.283 138.173 5.368 1.00 0.00 H TER 56165 WAT 6621 ATOM 56165 O WAT 6622 99.217 73.338 13.729 1.00 0.00 O ATOM 56166 H1 WAT 6622 98.677 74.129 13.731 1.00 0.00 H ATOM 56167 H2 WAT 6622 100.013 73.592 13.263 1.00 0.00 H TER 56169 WAT 6622 ATOM 56169 O WAT 6623 86.986 94.338 153.152 1.00 0.00 O ATOM 56170 H1 WAT 6623 86.458 94.701 153.863 1.00 0.00 H ATOM 56171 H2 WAT 6623 87.364 93.539 153.517 1.00 0.00 H TER 56173 WAT 6623 ATOM 56173 O WAT 6624 63.016 35.814 90.556 1.00 0.00 O ATOM 56174 H1 WAT 6624 62.667 36.683 90.754 1.00 0.00 H ATOM 56175 H2 WAT 6624 63.915 35.976 90.271 1.00 0.00 H TER 56177 WAT 6624 ATOM 56177 O WAT 6625 7.482 141.579 1.450 1.00 0.00 O ATOM 56178 H1 WAT 6625 7.224 141.827 2.338 1.00 0.00 H ATOM 56179 H2 WAT 6625 7.376 142.381 0.937 1.00 0.00 H TER 56181 WAT 6625 ATOM 56181 O WAT 6626 31.305 35.473 19.699 1.00 0.00 O ATOM 56182 H1 WAT 6626 31.358 35.598 20.646 1.00 0.00 H ATOM 56183 H2 WAT 6626 30.944 34.593 19.592 1.00 0.00 H TER 56185 WAT 6626 ATOM 56185 O WAT 6627 33.061 95.235 104.918 1.00 0.00 O ATOM 56186 H1 WAT 6627 33.181 95.553 104.023 1.00 0.00 H ATOM 56187 H2 WAT 6627 33.895 94.819 105.138 1.00 0.00 H TER 56189 WAT 6627 ATOM 56189 O WAT 6628 69.493 127.132 95.751 1.00 0.00 O ATOM 56190 H1 WAT 6628 70.242 127.708 95.596 1.00 0.00 H ATOM 56191 H2 WAT 6628 68.753 127.589 95.351 1.00 0.00 H TER 56193 WAT 6628 ATOM 56193 O WAT 6629 13.884 121.543 69.362 1.00 0.00 O ATOM 56194 H1 WAT 6629 14.423 122.330 69.289 1.00 0.00 H ATOM 56195 H2 WAT 6629 14.227 120.955 68.688 1.00 0.00 H TER 56197 WAT 6629 ATOM 56197 O WAT 6630 104.896 36.492 117.815 1.00 0.00 O ATOM 56198 H1 WAT 6630 104.688 37.374 117.507 1.00 0.00 H ATOM 56199 H2 WAT 6630 105.676 36.243 117.319 1.00 0.00 H TER 56201 WAT 6630 ATOM 56201 O WAT 6631 91.146 97.457 23.692 1.00 0.00 O ATOM 56202 H1 WAT 6631 91.242 98.405 23.598 1.00 0.00 H ATOM 56203 H2 WAT 6631 91.607 97.249 24.504 1.00 0.00 H TER 56205 WAT 6631 ATOM 56205 O WAT 6632 26.354 27.913 133.538 1.00 0.00 O ATOM 56206 H1 WAT 6632 26.128 27.655 132.645 1.00 0.00 H ATOM 56207 H2 WAT 6632 26.338 27.096 134.036 1.00 0.00 H TER 56209 WAT 6632 ATOM 56209 O WAT 6633 139.489 71.435 81.789 1.00 0.00 O ATOM 56210 H1 WAT 6633 139.397 72.387 81.825 1.00 0.00 H ATOM 56211 H2 WAT 6633 140.397 71.272 82.043 1.00 0.00 H TER 56213 WAT 6633 ATOM 56213 O WAT 6634 63.056 142.132 1.382 1.00 0.00 O ATOM 56214 H1 WAT 6634 63.151 141.561 0.620 1.00 0.00 H ATOM 56215 H2 WAT 6634 62.746 141.552 2.078 1.00 0.00 H TER 56217 WAT 6634 ATOM 56217 O WAT 6635 60.076 93.935 7.490 1.00 0.00 O ATOM 56218 H1 WAT 6635 59.633 93.191 7.083 1.00 0.00 H ATOM 56219 H2 WAT 6635 60.901 94.013 7.012 1.00 0.00 H TER 56221 WAT 6635 ATOM 56221 O WAT 6636 9.050 132.464 157.275 1.00 0.00 O ATOM 56222 H1 WAT 6636 8.403 132.451 157.980 1.00 0.00 H ATOM 56223 H2 WAT 6636 9.398 133.356 157.285 1.00 0.00 H TER 56225 WAT 6636 ATOM 56225 O WAT 6637 4.609 135.604 126.793 1.00 0.00 O ATOM 56226 H1 WAT 6637 4.369 135.908 127.668 1.00 0.00 H ATOM 56227 H2 WAT 6637 5.359 135.026 126.937 1.00 0.00 H TER 56229 WAT 6637 ATOM 56229 O WAT 6638 83.024 3.317 136.804 1.00 0.00 O ATOM 56230 H1 WAT 6638 83.786 3.618 137.300 1.00 0.00 H ATOM 56231 H2 WAT 6638 83.070 3.800 135.978 1.00 0.00 H TER 56233 WAT 6638 ATOM 56233 O WAT 6639 0.994 23.251 8.668 1.00 0.00 O ATOM 56234 H1 WAT 6639 0.548 24.042 8.971 1.00 0.00 H ATOM 56235 H2 WAT 6639 0.354 22.816 8.105 1.00 0.00 H TER 56237 WAT 6639 ATOM 56237 O WAT 6640 84.921 106.183 104.915 1.00 0.00 O ATOM 56238 H1 WAT 6640 84.959 105.231 104.820 1.00 0.00 H ATOM 56239 H2 WAT 6640 84.306 106.328 105.634 1.00 0.00 H TER 56241 WAT 6640 ATOM 56241 O WAT 6641 65.244 28.106 62.108 1.00 0.00 O ATOM 56242 H1 WAT 6641 64.946 27.227 62.343 1.00 0.00 H ATOM 56243 H2 WAT 6641 64.728 28.335 61.335 1.00 0.00 H TER 56245 WAT 6641 ATOM 56245 O WAT 6642 40.105 103.085 81.270 1.00 0.00 O ATOM 56246 H1 WAT 6642 40.657 103.343 80.532 1.00 0.00 H ATOM 56247 H2 WAT 6642 40.505 102.278 81.597 1.00 0.00 H TER 56249 WAT 6642 ATOM 56249 O WAT 6643 40.232 52.601 106.890 1.00 0.00 O ATOM 56250 H1 WAT 6643 39.506 52.727 107.501 1.00 0.00 H ATOM 56251 H2 WAT 6643 40.292 53.430 106.415 1.00 0.00 H TER 56253 WAT 6643 ATOM 56253 O WAT 6644 19.198 17.239 126.520 1.00 0.00 O ATOM 56254 H1 WAT 6644 18.710 17.931 126.967 1.00 0.00 H ATOM 56255 H2 WAT 6644 19.708 16.820 127.213 1.00 0.00 H TER 56257 WAT 6644 ATOM 56257 O WAT 6645 135.326 67.579 131.966 1.00 0.00 O ATOM 56258 H1 WAT 6645 135.751 68.401 132.211 1.00 0.00 H ATOM 56259 H2 WAT 6645 136.018 67.067 131.548 1.00 0.00 H TER 56261 WAT 6645 ATOM 56261 O WAT 6646 66.564 31.473 70.421 1.00 0.00 O ATOM 56262 H1 WAT 6646 66.994 32.037 71.063 1.00 0.00 H ATOM 56263 H2 WAT 6646 66.513 32.009 69.629 1.00 0.00 H TER 56265 WAT 6646 ATOM 56265 O WAT 6647 130.236 107.173 153.490 1.00 0.00 O ATOM 56266 H1 WAT 6647 130.580 107.897 154.013 1.00 0.00 H ATOM 56267 H2 WAT 6647 130.016 107.569 152.647 1.00 0.00 H TER 56269 WAT 6647 ATOM 56269 O WAT 6648 140.997 133.641 98.474 1.00 0.00 O ATOM 56270 H1 WAT 6648 140.175 133.257 98.167 1.00 0.00 H ATOM 56271 H2 WAT 6648 141.402 134.001 97.685 1.00 0.00 H TER 56273 WAT 6648 ATOM 56273 O WAT 6649 45.207 37.605 146.019 1.00 0.00 O ATOM 56274 H1 WAT 6649 45.421 38.520 145.837 1.00 0.00 H ATOM 56275 H2 WAT 6649 45.471 37.134 145.229 1.00 0.00 H TER 56277 WAT 6649 ATOM 56277 O WAT 6650 90.017 36.348 28.342 1.00 0.00 O ATOM 56278 H1 WAT 6650 90.535 35.565 28.152 1.00 0.00 H ATOM 56279 H2 WAT 6650 90.101 36.466 29.288 1.00 0.00 H TER 56281 WAT 6650 ATOM 56281 O WAT 6651 55.784 100.635 62.756 1.00 0.00 O ATOM 56282 H1 WAT 6651 56.197 99.857 63.131 1.00 0.00 H ATOM 56283 H2 WAT 6651 56.517 101.187 62.483 1.00 0.00 H TER 56285 WAT 6651 ATOM 56285 O WAT 6652 19.626 145.588 91.553 1.00 0.00 O ATOM 56286 H1 WAT 6652 18.822 145.072 91.615 1.00 0.00 H ATOM 56287 H2 WAT 6652 20.325 144.965 91.752 1.00 0.00 H TER 56289 WAT 6652 ATOM 56289 O WAT 6653 63.172 117.973 64.798 1.00 0.00 O ATOM 56290 H1 WAT 6653 63.583 118.426 65.534 1.00 0.00 H ATOM 56291 H2 WAT 6653 63.824 117.331 64.517 1.00 0.00 H TER 56293 WAT 6653 ATOM 56293 O WAT 6654 32.688 83.016 142.667 1.00 0.00 O ATOM 56294 H1 WAT 6654 32.968 82.105 142.753 1.00 0.00 H ATOM 56295 H2 WAT 6654 32.281 83.060 141.802 1.00 0.00 H TER 56297 WAT 6654 ATOM 56297 O WAT 6655 123.008 23.354 104.427 1.00 0.00 O ATOM 56298 H1 WAT 6655 123.856 23.735 104.656 1.00 0.00 H ATOM 56299 H2 WAT 6655 122.473 24.103 104.164 1.00 0.00 H TER 56301 WAT 6655 ATOM 56301 O WAT 6656 61.089 59.395 78.878 1.00 0.00 O ATOM 56302 H1 WAT 6656 61.235 58.596 79.385 1.00 0.00 H ATOM 56303 H2 WAT 6656 61.681 60.038 79.268 1.00 0.00 H TER 56305 WAT 6656 ATOM 56305 O WAT 6657 12.618 14.363 104.084 1.00 0.00 O ATOM 56306 H1 WAT 6657 11.847 13.799 104.030 1.00 0.00 H ATOM 56307 H2 WAT 6657 13.137 14.133 103.314 1.00 0.00 H TER 56309 WAT 6657 ATOM 56309 O WAT 6658 66.389 132.512 5.378 1.00 0.00 O ATOM 56310 H1 WAT 6658 65.744 132.220 6.022 1.00 0.00 H ATOM 56311 H2 WAT 6658 66.205 131.988 4.599 1.00 0.00 H TER 56313 WAT 6658 ATOM 56313 O WAT 6659 40.643 119.898 18.567 1.00 0.00 O ATOM 56314 H1 WAT 6659 41.250 119.997 19.301 1.00 0.00 H ATOM 56315 H2 WAT 6659 40.418 118.967 18.566 1.00 0.00 H TER 56317 WAT 6659 ATOM 56317 O WAT 6660 142.554 76.110 21.072 1.00 0.00 O ATOM 56318 H1 WAT 6660 142.758 75.699 21.912 1.00 0.00 H ATOM 56319 H2 WAT 6660 141.662 75.823 20.875 1.00 0.00 H TER 56321 WAT 6660 ATOM 56321 O WAT 6661 79.979 82.529 148.771 1.00 0.00 O ATOM 56322 H1 WAT 6661 79.978 83.011 149.598 1.00 0.00 H ATOM 56323 H2 WAT 6661 79.385 83.023 148.206 1.00 0.00 H TER 56325 WAT 6661 ATOM 56325 O WAT 6662 84.945 125.380 106.892 1.00 0.00 O ATOM 56326 H1 WAT 6662 85.178 124.453 106.944 1.00 0.00 H ATOM 56327 H2 WAT 6662 84.443 125.456 106.081 1.00 0.00 H TER 56329 WAT 6662 ATOM 56329 O WAT 6663 145.181 79.240 134.035 1.00 0.00 O ATOM 56330 H1 WAT 6663 144.775 78.430 133.727 1.00 0.00 H ATOM 56331 H2 WAT 6663 144.992 79.879 133.348 1.00 0.00 H TER 56333 WAT 6663 ATOM 56333 O WAT 6664 86.601 70.515 84.766 1.00 0.00 O ATOM 56334 H1 WAT 6664 86.913 69.613 84.689 1.00 0.00 H ATOM 56335 H2 WAT 6664 87.131 71.005 84.137 1.00 0.00 H TER 56337 WAT 6664 ATOM 56337 O WAT 6665 82.981 130.623 157.219 1.00 0.00 O ATOM 56338 H1 WAT 6665 82.445 130.938 157.946 1.00 0.00 H ATOM 56339 H2 WAT 6665 83.223 129.731 157.468 1.00 0.00 H TER 56341 WAT 6665 ATOM 56341 O WAT 6666 87.132 31.459 114.588 1.00 0.00 O ATOM 56342 H1 WAT 6666 86.194 31.605 114.467 1.00 0.00 H ATOM 56343 H2 WAT 6666 87.533 31.810 113.793 1.00 0.00 H TER 56345 WAT 6666 ATOM 56345 O WAT 6667 88.890 91.987 27.016 1.00 0.00 O ATOM 56346 H1 WAT 6667 88.306 91.934 26.259 1.00 0.00 H ATOM 56347 H2 WAT 6667 88.301 92.039 27.769 1.00 0.00 H TER 56349 WAT 6667 ATOM 56349 O WAT 6668 128.713 3.738 8.672 1.00 0.00 O ATOM 56350 H1 WAT 6668 128.257 3.489 9.476 1.00 0.00 H ATOM 56351 H2 WAT 6668 129.639 3.597 8.868 1.00 0.00 H TER 56353 WAT 6668 ATOM 56353 O WAT 6669 37.642 79.096 100.056 1.00 0.00 O ATOM 56354 H1 WAT 6669 38.240 78.354 100.135 1.00 0.00 H ATOM 56355 H2 WAT 6669 37.516 79.204 99.113 1.00 0.00 H TER 56357 WAT 6669 ATOM 56357 O WAT 6670 9.007 56.280 156.758 1.00 0.00 O ATOM 56358 H1 WAT 6670 9.818 56.783 156.682 1.00 0.00 H ATOM 56359 H2 WAT 6670 9.264 55.478 157.211 1.00 0.00 H TER 56361 WAT 6670 ATOM 56361 O WAT 6671 33.004 117.466 100.307 1.00 0.00 O ATOM 56362 H1 WAT 6671 33.206 116.661 99.829 1.00 0.00 H ATOM 56363 H2 WAT 6671 33.514 118.143 99.863 1.00 0.00 H TER 56365 WAT 6671 ATOM 56365 O WAT 6672 108.497 144.951 98.667 1.00 0.00 O ATOM 56366 H1 WAT 6672 108.894 144.082 98.609 1.00 0.00 H ATOM 56367 H2 WAT 6672 108.653 145.344 97.808 1.00 0.00 H TER 56369 WAT 6672 ATOM 56369 O WAT 6673 41.680 118.415 132.372 1.00 0.00 O ATOM 56370 H1 WAT 6673 41.970 117.665 131.854 1.00 0.00 H ATOM 56371 H2 WAT 6673 40.730 118.433 132.256 1.00 0.00 H TER 56373 WAT 6673 ATOM 56373 O WAT 6674 104.090 137.849 139.691 1.00 0.00 O ATOM 56374 H1 WAT 6674 103.604 138.619 139.986 1.00 0.00 H ATOM 56375 H2 WAT 6674 103.872 137.170 140.330 1.00 0.00 H TER 56377 WAT 6674 ATOM 56377 O WAT 6675 18.986 99.578 107.443 1.00 0.00 O ATOM 56378 H1 WAT 6675 18.943 100.240 108.133 1.00 0.00 H ATOM 56379 H2 WAT 6675 19.644 99.911 106.832 1.00 0.00 H TER 56381 WAT 6675 ATOM 56381 O WAT 6676 56.049 71.788 69.280 1.00 0.00 O ATOM 56382 H1 WAT 6676 55.441 72.411 69.680 1.00 0.00 H ATOM 56383 H2 WAT 6676 55.843 71.819 68.346 1.00 0.00 H TER 56385 WAT 6676 ATOM 56385 O WAT 6677 14.370 46.490 65.162 1.00 0.00 O ATOM 56386 H1 WAT 6677 13.958 45.974 64.469 1.00 0.00 H ATOM 56387 H2 WAT 6677 13.645 46.753 65.728 1.00 0.00 H TER 56389 WAT 6677 ATOM 56389 O WAT 6678 125.285 24.551 105.544 1.00 0.00 O ATOM 56390 H1 WAT 6678 124.640 25.142 105.933 1.00 0.00 H ATOM 56391 H2 WAT 6678 125.217 23.748 106.061 1.00 0.00 H TER 56393 WAT 6678 ATOM 56393 O WAT 6679 144.906 130.062 126.523 1.00 0.00 O ATOM 56394 H1 WAT 6679 145.548 129.831 127.194 1.00 0.00 H ATOM 56395 H2 WAT 6679 144.503 130.869 126.845 1.00 0.00 H TER 56397 WAT 6679 ATOM 56397 O WAT 6680 29.816 24.920 7.962 1.00 0.00 O ATOM 56398 H1 WAT 6680 30.583 24.409 7.707 1.00 0.00 H ATOM 56399 H2 WAT 6680 29.093 24.529 7.471 1.00 0.00 H TER 56401 WAT 6680 ATOM 56401 O WAT 6681 2.915 127.286 119.123 1.00 0.00 O ATOM 56402 H1 WAT 6681 3.526 127.763 118.561 1.00 0.00 H ATOM 56403 H2 WAT 6681 3.235 126.384 119.112 1.00 0.00 H TER 56405 WAT 6681 ATOM 56405 O WAT 6682 127.446 115.768 7.097 1.00 0.00 O ATOM 56406 H1 WAT 6682 127.626 115.933 8.022 1.00 0.00 H ATOM 56407 H2 WAT 6682 126.560 116.103 6.962 1.00 0.00 H TER 56409 WAT 6682 ATOM 56409 O WAT 6683 127.274 66.456 22.366 1.00 0.00 O ATOM 56410 H1 WAT 6683 126.697 66.827 23.033 1.00 0.00 H ATOM 56411 H2 WAT 6683 127.951 65.997 22.862 1.00 0.00 H TER 56413 WAT 6683 ATOM 56413 O WAT 6684 11.983 75.440 6.863 1.00 0.00 O ATOM 56414 H1 WAT 6684 11.662 75.594 7.751 1.00 0.00 H ATOM 56415 H2 WAT 6684 12.936 75.424 6.952 1.00 0.00 H TER 56417 WAT 6684 ATOM 56417 O WAT 6685 25.525 97.907 77.666 1.00 0.00 O ATOM 56418 H1 WAT 6685 25.648 98.119 76.741 1.00 0.00 H ATOM 56419 H2 WAT 6685 24.590 97.721 77.748 1.00 0.00 H TER 56421 WAT 6685 ATOM 56421 O WAT 6686 119.080 141.875 135.274 1.00 0.00 O ATOM 56422 H1 WAT 6686 119.016 142.709 135.739 1.00 0.00 H ATOM 56423 H2 WAT 6686 118.420 141.935 134.582 1.00 0.00 H TER 56425 WAT 6686 ATOM 56425 O WAT 6687 135.351 77.306 133.656 1.00 0.00 O ATOM 56426 H1 WAT 6687 135.837 78.130 133.684 1.00 0.00 H ATOM 56427 H2 WAT 6687 135.647 76.827 134.430 1.00 0.00 H TER 56429 WAT 6687 ATOM 56429 O WAT 6688 54.869 26.523 75.486 1.00 0.00 O ATOM 56430 H1 WAT 6688 54.046 26.050 75.604 1.00 0.00 H ATOM 56431 H2 WAT 6688 54.687 27.149 74.784 1.00 0.00 H TER 56433 WAT 6688 ATOM 56433 O WAT 6689 94.911 43.623 148.799 1.00 0.00 O ATOM 56434 H1 WAT 6689 94.683 44.546 148.691 1.00 0.00 H ATOM 56435 H2 WAT 6689 94.094 43.154 148.630 1.00 0.00 H TER 56437 WAT 6689 ATOM 56437 O WAT 6690 75.634 136.283 145.226 1.00 0.00 O ATOM 56438 H1 WAT 6690 76.412 135.914 144.808 1.00 0.00 H ATOM 56439 H2 WAT 6690 75.327 136.951 144.613 1.00 0.00 H TER 56441 WAT 6690 ATOM 56441 O WAT 6691 118.702 26.028 98.147 1.00 0.00 O ATOM 56442 H1 WAT 6691 118.258 25.277 98.540 1.00 0.00 H ATOM 56443 H2 WAT 6691 118.608 26.727 98.793 1.00 0.00 H TER 56445 WAT 6691 ATOM 56445 O WAT 6692 121.972 29.346 1.366 1.00 0.00 O ATOM 56446 H1 WAT 6692 122.822 29.787 1.355 1.00 0.00 H ATOM 56447 H2 WAT 6692 121.333 30.057 1.318 1.00 0.00 H TER 56449 WAT 6692 ATOM 56449 O WAT 6693 131.276 33.388 2.530 1.00 0.00 O ATOM 56450 H1 WAT 6693 130.577 33.411 3.184 1.00 0.00 H ATOM 56451 H2 WAT 6693 130.819 33.428 1.690 1.00 0.00 H TER 56453 WAT 6693 ATOM 56453 O WAT 6694 108.399 51.252 147.714 1.00 0.00 O ATOM 56454 H1 WAT 6694 107.756 51.951 147.830 1.00 0.00 H ATOM 56455 H2 WAT 6694 108.237 50.653 148.443 1.00 0.00 H TER 56457 WAT 6694 ATOM 56457 O WAT 6695 32.064 89.033 101.102 1.00 0.00 O ATOM 56458 H1 WAT 6695 32.624 88.788 101.839 1.00 0.00 H ATOM 56459 H2 WAT 6695 32.160 88.312 100.479 1.00 0.00 H TER 56461 WAT 6695 ATOM 56461 O WAT 6696 74.955 132.897 135.700 1.00 0.00 O ATOM 56462 H1 WAT 6696 74.027 132.738 135.870 1.00 0.00 H ATOM 56463 H2 WAT 6696 75.155 133.695 136.191 1.00 0.00 H TER 56465 WAT 6696 ATOM 56465 O WAT 6697 61.407 9.857 76.699 1.00 0.00 O ATOM 56466 H1 WAT 6697 62.120 9.918 77.335 1.00 0.00 H ATOM 56467 H2 WAT 6697 61.619 10.517 76.038 1.00 0.00 H TER 56469 WAT 6697 ATOM 56469 O WAT 6698 109.310 98.094 94.886 1.00 0.00 O ATOM 56470 H1 WAT 6698 109.732 98.053 95.744 1.00 0.00 H ATOM 56471 H2 WAT 6698 109.234 99.030 94.702 1.00 0.00 H TER 56473 WAT 6698 ATOM 56473 O WAT 6699 125.423 72.629 132.142 1.00 0.00 O ATOM 56474 H1 WAT 6699 124.872 71.921 131.810 1.00 0.00 H ATOM 56475 H2 WAT 6699 126.199 72.613 131.582 1.00 0.00 H TER 56477 WAT 6699 ATOM 56477 O WAT 6700 84.403 66.571 72.372 1.00 0.00 O ATOM 56478 H1 WAT 6700 84.293 67.435 71.977 1.00 0.00 H ATOM 56479 H2 WAT 6700 83.612 66.092 72.124 1.00 0.00 H TER 56481 WAT 6700 ATOM 56481 O WAT 6701 3.598 64.067 56.043 1.00 0.00 O ATOM 56482 H1 WAT 6701 3.914 64.913 55.727 1.00 0.00 H ATOM 56483 H2 WAT 6701 2.644 64.139 56.006 1.00 0.00 H TER 56485 WAT 6701 ATOM 56485 O WAT 6702 57.755 124.335 81.133 1.00 0.00 O ATOM 56486 H1 WAT 6702 57.946 124.772 80.303 1.00 0.00 H ATOM 56487 H2 WAT 6702 58.521 124.511 81.679 1.00 0.00 H TER 56489 WAT 6702 ATOM 56489 O WAT 6703 75.917 36.836 8.359 1.00 0.00 O ATOM 56490 H1 WAT 6703 75.621 37.183 9.200 1.00 0.00 H ATOM 56491 H2 WAT 6703 75.134 36.444 7.972 1.00 0.00 H TER 56493 WAT 6703 ATOM 56493 O WAT 6704 38.763 37.984 141.587 1.00 0.00 O ATOM 56494 H1 WAT 6704 39.040 37.512 142.372 1.00 0.00 H ATOM 56495 H2 WAT 6704 38.092 37.424 141.196 1.00 0.00 H TER 56497 WAT 6704 ATOM 56497 O WAT 6705 130.296 61.850 120.443 1.00 0.00 O ATOM 56498 H1 WAT 6705 129.953 61.133 119.910 1.00 0.00 H ATOM 56499 H2 WAT 6705 129.706 62.583 120.269 1.00 0.00 H TER 56501 WAT 6705 ATOM 56501 O WAT 6706 39.320 17.754 4.659 1.00 0.00 O ATOM 56502 H1 WAT 6706 39.245 17.808 5.611 1.00 0.00 H ATOM 56503 H2 WAT 6706 39.929 18.454 4.426 1.00 0.00 H TER 56505 WAT 6706 ATOM 56505 O WAT 6707 101.622 63.479 150.130 1.00 0.00 O ATOM 56506 H1 WAT 6707 101.669 64.214 149.519 1.00 0.00 H ATOM 56507 H2 WAT 6707 101.867 62.716 149.606 1.00 0.00 H TER 56509 WAT 6707 ATOM 56509 O WAT 6708 0.945 15.349 110.132 1.00 0.00 O ATOM 56510 H1 WAT 6708 1.137 15.519 111.054 1.00 0.00 H ATOM 56511 H2 WAT 6708 0.943 16.214 109.723 1.00 0.00 H TER 56513 WAT 6708 ATOM 56513 O WAT 6709 1.127 13.791 131.553 1.00 0.00 O ATOM 56514 H1 WAT 6709 0.628 13.299 132.206 1.00 0.00 H ATOM 56515 H2 WAT 6709 0.473 14.330 131.108 1.00 0.00 H TER 56517 WAT 6709 ATOM 56517 O WAT 6710 23.931 30.452 121.578 1.00 0.00 O ATOM 56518 H1 WAT 6710 24.501 30.448 120.809 1.00 0.00 H ATOM 56519 H2 WAT 6710 24.532 30.475 122.322 1.00 0.00 H TER 56521 WAT 6710 ATOM 56521 O WAT 6711 114.170 80.820 153.437 1.00 0.00 O ATOM 56522 H1 WAT 6711 114.504 81.342 152.708 1.00 0.00 H ATOM 56523 H2 WAT 6711 114.291 79.912 153.158 1.00 0.00 H TER 56525 WAT 6711 ATOM 56525 O WAT 6712 59.715 96.553 99.021 1.00 0.00 O ATOM 56526 H1 WAT 6712 60.067 97.296 99.511 1.00 0.00 H ATOM 56527 H2 WAT 6712 59.510 95.900 99.691 1.00 0.00 H TER 56529 WAT 6712 ATOM 56529 O WAT 6713 110.719 2.358 145.447 1.00 0.00 O ATOM 56530 H1 WAT 6713 109.812 2.335 145.142 1.00 0.00 H ATOM 56531 H2 WAT 6713 110.713 1.847 146.256 1.00 0.00 H TER 56533 WAT 6713 ATOM 56533 O WAT 6714 6.234 141.119 156.541 1.00 0.00 O ATOM 56534 H1 WAT 6714 5.707 141.698 157.092 1.00 0.00 H ATOM 56535 H2 WAT 6714 5.759 141.080 155.711 1.00 0.00 H TER 56537 WAT 6714 ATOM 56537 O WAT 6715 48.065 68.437 96.288 1.00 0.00 O ATOM 56538 H1 WAT 6715 48.157 68.240 97.220 1.00 0.00 H ATOM 56539 H2 WAT 6715 48.847 68.946 96.073 1.00 0.00 H TER 56541 WAT 6715 ATOM 56541 O WAT 6716 122.076 89.170 73.700 1.00 0.00 O ATOM 56542 H1 WAT 6716 122.607 88.384 73.825 1.00 0.00 H ATOM 56543 H2 WAT 6716 121.204 88.924 74.009 1.00 0.00 H TER 56545 WAT 6716 ATOM 56545 O WAT 6717 50.832 22.404 18.131 1.00 0.00 O ATOM 56546 H1 WAT 6717 51.026 23.231 18.573 1.00 0.00 H ATOM 56547 H2 WAT 6717 49.930 22.204 18.382 1.00 0.00 H TER 56549 WAT 6717 ATOM 56549 O WAT 6718 79.410 126.027 126.365 1.00 0.00 O ATOM 56550 H1 WAT 6718 80.085 126.704 126.400 1.00 0.00 H ATOM 56551 H2 WAT 6718 79.811 125.267 126.788 1.00 0.00 H TER 56553 WAT 6718 ATOM 56553 O WAT 6719 68.270 61.994 116.446 1.00 0.00 O ATOM 56554 H1 WAT 6719 67.739 62.337 117.165 1.00 0.00 H ATOM 56555 H2 WAT 6719 69.112 62.440 116.537 1.00 0.00 H TER 56557 WAT 6719 ATOM 56557 O WAT 6720 51.058 13.450 94.019 1.00 0.00 O ATOM 56558 H1 WAT 6720 50.606 13.324 94.853 1.00 0.00 H ATOM 56559 H2 WAT 6720 50.358 13.636 93.393 1.00 0.00 H TER 56561 WAT 6720 ATOM 56561 O WAT 6721 108.135 63.090 125.301 1.00 0.00 O ATOM 56562 H1 WAT 6721 107.838 63.209 124.399 1.00 0.00 H ATOM 56563 H2 WAT 6721 107.531 62.445 125.669 1.00 0.00 H TER 56565 WAT 6721 ATOM 56565 O WAT 6722 86.729 65.088 24.022 1.00 0.00 O ATOM 56566 H1 WAT 6722 87.480 64.526 24.213 1.00 0.00 H ATOM 56567 H2 WAT 6722 87.072 65.753 23.426 1.00 0.00 H TER 56569 WAT 6722 ATOM 56569 O WAT 6723 43.186 95.386 99.516 1.00 0.00 O ATOM 56570 H1 WAT 6723 43.805 94.792 99.942 1.00 0.00 H ATOM 56571 H2 WAT 6723 42.730 94.838 98.877 1.00 0.00 H TER 56573 WAT 6723 ATOM 56573 O WAT 6724 29.076 130.716 61.470 1.00 0.00 O ATOM 56574 H1 WAT 6724 28.716 131.549 61.164 1.00 0.00 H ATOM 56575 H2 WAT 6724 28.704 130.063 60.878 1.00 0.00 H TER 56577 WAT 6724 ATOM 56577 O WAT 6725 96.443 30.619 73.046 1.00 0.00 O ATOM 56578 H1 WAT 6725 96.607 31.044 73.888 1.00 0.00 H ATOM 56579 H2 WAT 6725 95.701 30.037 73.212 1.00 0.00 H TER 56581 WAT 6725 ATOM 56581 O WAT 6726 0.113 110.361 82.330 1.00 0.00 O ATOM 56582 H1 WAT 6726 -0.752 110.391 81.922 1.00 0.00 H ATOM 56583 H2 WAT 6726 0.726 110.453 81.600 1.00 0.00 H TER 56585 WAT 6726 ATOM 56585 O WAT 6727 54.262 132.357 155.181 1.00 0.00 O ATOM 56586 H1 WAT 6727 53.655 132.279 154.446 1.00 0.00 H ATOM 56587 H2 WAT 6727 54.580 133.259 155.134 1.00 0.00 H TER 56589 WAT 6727 ATOM 56589 O WAT 6728 82.610 57.529 84.136 1.00 0.00 O ATOM 56590 H1 WAT 6728 82.221 57.432 83.266 1.00 0.00 H ATOM 56591 H2 WAT 6728 82.717 58.474 84.246 1.00 0.00 H TER 56593 WAT 6728 ATOM 56593 O WAT 6729 145.403 125.554 2.856 1.00 0.00 O ATOM 56594 H1 WAT 6729 145.150 124.684 3.165 1.00 0.00 H ATOM 56595 H2 WAT 6729 146.241 125.726 3.286 1.00 0.00 H TER 56597 WAT 6729 ATOM 56597 O WAT 6730 22.897 58.821 19.188 1.00 0.00 O ATOM 56598 H1 WAT 6730 22.201 59.066 19.798 1.00 0.00 H ATOM 56599 H2 WAT 6730 22.449 58.332 18.497 1.00 0.00 H TER 56601 WAT 6730 ATOM 56601 O WAT 6731 93.134 22.157 136.451 1.00 0.00 O ATOM 56602 H1 WAT 6731 92.193 22.307 136.358 1.00 0.00 H ATOM 56603 H2 WAT 6731 93.420 22.816 137.083 1.00 0.00 H TER 56605 WAT 6731 ATOM 56605 O WAT 6732 37.912 78.174 85.244 1.00 0.00 O ATOM 56606 H1 WAT 6732 37.351 77.403 85.162 1.00 0.00 H ATOM 56607 H2 WAT 6732 37.591 78.777 84.574 1.00 0.00 H TER 56609 WAT 6732 ATOM 56609 O WAT 6733 135.751 96.852 60.261 1.00 0.00 O ATOM 56610 H1 WAT 6733 136.067 96.400 61.042 1.00 0.00 H ATOM 56611 H2 WAT 6733 136.024 97.762 60.383 1.00 0.00 H TER 56613 WAT 6733 ATOM 56613 O WAT 6734 140.344 102.653 72.823 1.00 0.00 O ATOM 56614 H1 WAT 6734 141.041 102.428 72.207 1.00 0.00 H ATOM 56615 H2 WAT 6734 139.577 102.808 72.271 1.00 0.00 H TER 56617 WAT 6734 ATOM 56617 O WAT 6735 53.300 58.233 7.708 1.00 0.00 O ATOM 56618 H1 WAT 6735 53.910 58.914 7.993 1.00 0.00 H ATOM 56619 H2 WAT 6735 53.741 57.411 7.922 1.00 0.00 H TER 56621 WAT 6735 ATOM 56621 O WAT 6736 18.838 40.082 128.369 1.00 0.00 O ATOM 56622 H1 WAT 6736 19.544 40.616 128.733 1.00 0.00 H ATOM 56623 H2 WAT 6736 18.073 40.302 128.901 1.00 0.00 H TER 56625 WAT 6736 ATOM 56625 O WAT 6737 127.791 57.203 12.221 1.00 0.00 O ATOM 56626 H1 WAT 6737 128.129 57.271 13.114 1.00 0.00 H ATOM 56627 H2 WAT 6737 127.242 56.419 12.232 1.00 0.00 H TER 56629 WAT 6737 ATOM 56629 O WAT 6738 39.137 15.175 150.516 1.00 0.00 O ATOM 56630 H1 WAT 6738 38.379 15.758 150.557 1.00 0.00 H ATOM 56631 H2 WAT 6738 38.840 14.433 149.990 1.00 0.00 H TER 56633 WAT 6738 ATOM 56633 O WAT 6739 2.997 45.191 141.640 1.00 0.00 O ATOM 56634 H1 WAT 6739 3.951 45.264 141.608 1.00 0.00 H ATOM 56635 H2 WAT 6739 2.724 45.885 142.238 1.00 0.00 H TER 56637 WAT 6739 ATOM 56637 O WAT 6740 76.831 12.087 23.141 1.00 0.00 O ATOM 56638 H1 WAT 6740 77.157 12.477 22.330 1.00 0.00 H ATOM 56639 H2 WAT 6740 76.490 11.233 22.875 1.00 0.00 H TER 56641 WAT 6740 ATOM 56641 O WAT 6741 54.934 37.639 158.151 1.00 0.00 O ATOM 56642 H1 WAT 6741 54.965 37.586 157.195 1.00 0.00 H ATOM 56643 H2 WAT 6741 54.299 38.333 158.331 1.00 0.00 H TER 56645 WAT 6741 ATOM 56645 O WAT 6742 39.282 17.322 112.785 1.00 0.00 O ATOM 56646 H1 WAT 6742 38.426 17.564 112.431 1.00 0.00 H ATOM 56647 H2 WAT 6742 39.087 16.934 113.638 1.00 0.00 H TER 56649 WAT 6742 ATOM 56649 O WAT 6743 49.371 139.550 123.223 1.00 0.00 O ATOM 56650 H1 WAT 6743 49.191 140.337 123.737 1.00 0.00 H ATOM 56651 H2 WAT 6743 48.733 138.909 123.537 1.00 0.00 H TER 56653 WAT 6743 ATOM 56653 O WAT 6744 81.720 119.021 146.548 1.00 0.00 O ATOM 56654 H1 WAT 6744 81.405 119.323 145.697 1.00 0.00 H ATOM 56655 H2 WAT 6744 82.010 118.122 146.391 1.00 0.00 H TER 56657 WAT 6744 ATOM 56657 O WAT 6745 124.231 7.832 115.702 1.00 0.00 O ATOM 56658 H1 WAT 6745 124.885 7.769 116.398 1.00 0.00 H ATOM 56659 H2 WAT 6745 123.402 7.963 116.163 1.00 0.00 H TER 56661 WAT 6745 ATOM 56661 O WAT 6746 78.529 66.534 5.048 1.00 0.00 O ATOM 56662 H1 WAT 6746 79.438 66.594 5.340 1.00 0.00 H ATOM 56663 H2 WAT 6746 78.589 66.402 4.102 1.00 0.00 H TER 56665 WAT 6746 ATOM 56665 O WAT 6747 104.515 68.670 73.349 1.00 0.00 O ATOM 56666 H1 WAT 6747 105.400 68.885 73.055 1.00 0.00 H ATOM 56667 H2 WAT 6747 104.025 69.486 73.251 1.00 0.00 H TER 56669 WAT 6747 ATOM 56669 O WAT 6748 100.216 120.423 111.249 1.00 0.00 O ATOM 56670 H1 WAT 6748 100.260 119.658 111.822 1.00 0.00 H ATOM 56671 H2 WAT 6748 100.411 120.080 110.377 1.00 0.00 H TER 56673 WAT 6748 ATOM 56673 O WAT 6749 72.963 36.734 146.213 1.00 0.00 O ATOM 56674 H1 WAT 6749 72.271 37.338 146.482 1.00 0.00 H ATOM 56675 H2 WAT 6749 73.590 37.283 145.742 1.00 0.00 H TER 56677 WAT 6749 ATOM 56677 O WAT 6750 24.751 145.165 11.085 1.00 0.00 O ATOM 56678 H1 WAT 6750 25.029 146.000 11.461 1.00 0.00 H ATOM 56679 H2 WAT 6750 24.310 145.404 10.270 1.00 0.00 H TER 56681 WAT 6750 ATOM 56681 O WAT 6751 9.029 75.873 104.629 1.00 0.00 O ATOM 56682 H1 WAT 6751 9.690 75.623 103.983 1.00 0.00 H ATOM 56683 H2 WAT 6751 8.232 75.429 104.341 1.00 0.00 H TER 56685 WAT 6751 ATOM 56685 O WAT 6752 62.681 132.818 93.340 1.00 0.00 O ATOM 56686 H1 WAT 6752 62.576 133.508 93.994 1.00 0.00 H ATOM 56687 H2 WAT 6752 62.716 132.008 93.849 1.00 0.00 H TER 56689 WAT 6752 ATOM 56689 O WAT 6753 142.164 111.395 5.038 1.00 0.00 O ATOM 56690 H1 WAT 6753 142.757 110.661 5.199 1.00 0.00 H ATOM 56691 H2 WAT 6753 142.537 111.843 4.279 1.00 0.00 H TER 56693 WAT 6753 ATOM 56693 O WAT 6754 32.838 20.241 74.400 1.00 0.00 O ATOM 56694 H1 WAT 6754 33.269 20.805 73.757 1.00 0.00 H ATOM 56695 H2 WAT 6754 32.865 20.743 75.215 1.00 0.00 H TER 56697 WAT 6754 ATOM 56697 O WAT 6755 110.275 93.549 9.839 1.00 0.00 O ATOM 56698 H1 WAT 6755 110.935 93.151 10.406 1.00 0.00 H ATOM 56699 H2 WAT 6755 110.036 94.363 10.284 1.00 0.00 H TER 56701 WAT 6755 ATOM 56701 O WAT 6756 28.115 25.521 71.365 1.00 0.00 O ATOM 56702 H1 WAT 6756 28.030 26.462 71.210 1.00 0.00 H ATOM 56703 H2 WAT 6756 28.927 25.277 70.919 1.00 0.00 H TER 56705 WAT 6756 ATOM 56705 O WAT 6757 41.569 39.756 94.021 1.00 0.00 O ATOM 56706 H1 WAT 6757 41.768 38.834 93.857 1.00 0.00 H ATOM 56707 H2 WAT 6757 41.160 40.060 93.212 1.00 0.00 H TER 56709 WAT 6757 ATOM 56709 O WAT 6758 14.380 70.170 85.906 1.00 0.00 O ATOM 56710 H1 WAT 6758 13.620 69.628 86.115 1.00 0.00 H ATOM 56711 H2 WAT 6758 14.184 71.020 86.300 1.00 0.00 H TER 56713 WAT 6758 ATOM 56713 O WAT 6759 57.283 94.955 111.709 1.00 0.00 O ATOM 56714 H1 WAT 6759 57.437 94.344 110.988 1.00 0.00 H ATOM 56715 H2 WAT 6759 57.731 95.757 111.442 1.00 0.00 H TER 56717 WAT 6759 ATOM 56717 O WAT 6760 85.187 26.970 119.452 1.00 0.00 O ATOM 56718 H1 WAT 6760 84.461 27.556 119.239 1.00 0.00 H ATOM 56719 H2 WAT 6760 85.751 26.997 118.680 1.00 0.00 H TER 56721 WAT 6760 ATOM 56721 O WAT 6761 42.559 1.928 134.240 1.00 0.00 O ATOM 56722 H1 WAT 6761 42.264 1.157 133.756 1.00 0.00 H ATOM 56723 H2 WAT 6761 43.094 2.415 133.612 1.00 0.00 H TER 56725 WAT 6761 ATOM 56725 O WAT 6762 113.783 50.530 7.439 1.00 0.00 O ATOM 56726 H1 WAT 6762 113.475 50.858 8.284 1.00 0.00 H ATOM 56727 H2 WAT 6762 114.327 49.774 7.660 1.00 0.00 H TER 56729 WAT 6762 ATOM 56729 O WAT 6763 110.745 31.331 82.140 1.00 0.00 O ATOM 56730 H1 WAT 6763 110.986 31.784 81.332 1.00 0.00 H ATOM 56731 H2 WAT 6763 110.930 30.409 81.961 1.00 0.00 H TER 56733 WAT 6763 ATOM 56733 O WAT 6764 48.685 101.305 130.432 1.00 0.00 O ATOM 56734 H1 WAT 6764 49.501 101.290 130.933 1.00 0.00 H ATOM 56735 H2 WAT 6764 48.955 101.536 129.543 1.00 0.00 H TER 56737 WAT 6764 ATOM 56737 O WAT 6765 54.759 102.377 120.819 1.00 0.00 O ATOM 56738 H1 WAT 6765 55.533 102.266 120.266 1.00 0.00 H ATOM 56739 H2 WAT 6765 54.403 101.493 120.912 1.00 0.00 H TER 56741 WAT 6765 ATOM 56741 O WAT 6766 144.248 123.226 3.675 1.00 0.00 O ATOM 56742 H1 WAT 6766 143.570 123.136 3.005 1.00 0.00 H ATOM 56743 H2 WAT 6766 143.827 122.928 4.482 1.00 0.00 H TER 56745 WAT 6766 ATOM 56745 O WAT 6767 109.389 49.268 84.096 1.00 0.00 O ATOM 56746 H1 WAT 6767 108.944 49.267 83.248 1.00 0.00 H ATOM 56747 H2 WAT 6767 109.342 48.359 84.393 1.00 0.00 H TER 56749 WAT 6767 ATOM 56749 O WAT 6768 135.844 70.759 144.960 1.00 0.00 O ATOM 56750 H1 WAT 6768 135.395 71.579 145.166 1.00 0.00 H ATOM 56751 H2 WAT 6768 135.436 70.462 144.146 1.00 0.00 H TER 56753 WAT 6768 ATOM 56753 O WAT 6769 105.724 25.351 94.814 1.00 0.00 O ATOM 56754 H1 WAT 6769 105.679 26.216 95.220 1.00 0.00 H ATOM 56755 H2 WAT 6769 106.486 24.936 95.218 1.00 0.00 H TER 56757 WAT 6769 ATOM 56757 O WAT 6770 132.628 70.800 134.522 1.00 0.00 O ATOM 56758 H1 WAT 6770 132.368 71.627 134.116 1.00 0.00 H ATOM 56759 H2 WAT 6770 131.957 70.638 135.185 1.00 0.00 H TER 56761 WAT 6770 ATOM 56761 O WAT 6771 19.266 36.037 154.388 1.00 0.00 O ATOM 56762 H1 WAT 6771 19.155 36.468 153.540 1.00 0.00 H ATOM 56763 H2 WAT 6771 18.374 35.846 154.678 1.00 0.00 H TER 56765 WAT 6771 ATOM 56765 O WAT 6772 15.962 64.435 76.242 1.00 0.00 O ATOM 56766 H1 WAT 6772 15.866 63.617 76.730 1.00 0.00 H ATOM 56767 H2 WAT 6772 15.337 64.358 75.521 1.00 0.00 H TER 56769 WAT 6772 ATOM 56769 O WAT 6773 78.319 141.032 124.480 1.00 0.00 O ATOM 56770 H1 WAT 6773 78.915 140.745 125.171 1.00 0.00 H ATOM 56771 H2 WAT 6773 77.467 141.098 124.911 1.00 0.00 H TER 56773 WAT 6773 ATOM 56773 O WAT 6774 35.800 16.750 136.366 1.00 0.00 O ATOM 56774 H1 WAT 6774 36.086 17.250 135.602 1.00 0.00 H ATOM 56775 H2 WAT 6774 36.384 15.991 136.388 1.00 0.00 H TER 56777 WAT 6774 ATOM 56777 O WAT 6775 123.522 15.830 130.440 1.00 0.00 O ATOM 56778 H1 WAT 6775 122.740 16.331 130.673 1.00 0.00 H ATOM 56779 H2 WAT 6775 123.920 16.327 129.725 1.00 0.00 H TER 56781 WAT 6775 ATOM 56781 O WAT 6776 6.234 59.379 112.925 1.00 0.00 O ATOM 56782 H1 WAT 6776 7.058 59.516 113.392 1.00 0.00 H ATOM 56783 H2 WAT 6776 6.392 59.739 112.052 1.00 0.00 H TER 56785 WAT 6776 ATOM 56785 O WAT 6777 136.122 64.696 54.997 1.00 0.00 O ATOM 56786 H1 WAT 6777 136.134 63.915 54.443 1.00 0.00 H ATOM 56787 H2 WAT 6777 136.481 64.402 55.834 1.00 0.00 H TER 56789 WAT 6777 ATOM 56789 O WAT 6778 67.076 134.277 101.771 1.00 0.00 O ATOM 56790 H1 WAT 6778 66.495 135.021 101.611 1.00 0.00 H ATOM 56791 H2 WAT 6778 67.936 134.577 101.476 1.00 0.00 H TER 56793 WAT 6778 ATOM 56793 O WAT 6779 50.771 111.799 125.771 1.00 0.00 O ATOM 56794 H1 WAT 6779 50.509 111.139 125.129 1.00 0.00 H ATOM 56795 H2 WAT 6779 50.363 112.608 125.463 1.00 0.00 H TER 56797 WAT 6779 ATOM 56797 O WAT 6780 124.787 14.693 2.394 1.00 0.00 O ATOM 56798 H1 WAT 6780 125.328 15.355 1.963 1.00 0.00 H ATOM 56799 H2 WAT 6780 123.988 15.160 2.638 1.00 0.00 H TER 56801 WAT 6780 ATOM 56801 O WAT 6781 100.546 45.306 118.357 1.00 0.00 O ATOM 56802 H1 WAT 6781 101.477 45.090 118.408 1.00 0.00 H ATOM 56803 H2 WAT 6781 100.101 44.459 118.392 1.00 0.00 H TER 56805 WAT 6781 ATOM 56805 O WAT 6782 139.648 4.043 91.336 1.00 0.00 O ATOM 56806 H1 WAT 6782 140.535 4.398 91.274 1.00 0.00 H ATOM 56807 H2 WAT 6782 139.460 4.034 92.275 1.00 0.00 H TER 56809 WAT 6782 ATOM 56809 O WAT 6783 28.362 52.124 72.667 1.00 0.00 O ATOM 56810 H1 WAT 6783 27.907 51.403 72.231 1.00 0.00 H ATOM 56811 H2 WAT 6783 29.289 51.893 72.609 1.00 0.00 H TER 56813 WAT 6783 ATOM 56813 O WAT 6784 125.722 142.792 63.949 1.00 0.00 O ATOM 56814 H1 WAT 6784 125.532 141.886 63.706 1.00 0.00 H ATOM 56815 H2 WAT 6784 125.867 143.239 63.115 1.00 0.00 H TER 56817 WAT 6784 ATOM 56817 O WAT 6785 12.743 8.871 140.821 1.00 0.00 O ATOM 56818 H1 WAT 6785 12.381 8.597 139.978 1.00 0.00 H ATOM 56819 H2 WAT 6785 12.229 9.642 141.063 1.00 0.00 H TER 56821 WAT 6785 ATOM 56821 O WAT 6786 81.027 127.907 103.239 1.00 0.00 O ATOM 56822 H1 WAT 6786 81.960 128.039 103.075 1.00 0.00 H ATOM 56823 H2 WAT 6786 80.592 128.547 102.675 1.00 0.00 H TER 56825 WAT 6786 ATOM 56825 O WAT 6787 141.071 74.258 64.164 1.00 0.00 O ATOM 56826 H1 WAT 6787 140.256 74.447 63.699 1.00 0.00 H ATOM 56827 H2 WAT 6787 140.906 73.427 64.609 1.00 0.00 H TER 56829 WAT 6787 ATOM 56829 O WAT 6788 58.873 26.027 140.542 1.00 0.00 O ATOM 56830 H1 WAT 6788 58.494 26.301 139.707 1.00 0.00 H ATOM 56831 H2 WAT 6788 59.817 26.136 140.424 1.00 0.00 H TER 56833 WAT 6788 ATOM 56833 O WAT 6789 45.603 91.301 79.581 1.00 0.00 O ATOM 56834 H1 WAT 6789 45.464 91.751 80.414 1.00 0.00 H ATOM 56835 H2 WAT 6789 45.267 91.908 78.921 1.00 0.00 H TER 56837 WAT 6789 ATOM 56837 O WAT 6790 105.653 69.489 109.014 1.00 0.00 O ATOM 56838 H1 WAT 6790 106.212 68.744 108.795 1.00 0.00 H ATOM 56839 H2 WAT 6790 106.202 70.046 109.566 1.00 0.00 H TER 56841 WAT 6790 ATOM 56841 O WAT 6791 33.887 48.777 115.426 1.00 0.00 O ATOM 56842 H1 WAT 6791 33.390 48.770 116.244 1.00 0.00 H ATOM 56843 H2 WAT 6791 34.388 47.962 115.443 1.00 0.00 H TER 56845 WAT 6791 ATOM 56845 O WAT 6792 128.656 111.759 85.667 1.00 0.00 O ATOM 56846 H1 WAT 6792 129.390 112.369 85.734 1.00 0.00 H ATOM 56847 H2 WAT 6792 128.801 111.130 86.373 1.00 0.00 H TER 56849 WAT 6792 ATOM 56849 O WAT 6793 37.069 124.158 151.843 1.00 0.00 O ATOM 56850 H1 WAT 6793 36.652 124.497 151.051 1.00 0.00 H ATOM 56851 H2 WAT 6793 37.343 124.940 152.322 1.00 0.00 H TER 56853 WAT 6793 ATOM 56853 O WAT 6794 77.638 74.087 60.379 1.00 0.00 O ATOM 56854 H1 WAT 6794 76.817 73.668 60.123 1.00 0.00 H ATOM 56855 H2 WAT 6794 77.474 75.024 60.271 1.00 0.00 H TER 56857 WAT 6794 ATOM 56857 O WAT 6795 127.880 115.111 105.008 1.00 0.00 O ATOM 56858 H1 WAT 6795 128.200 115.592 104.244 1.00 0.00 H ATOM 56859 H2 WAT 6795 126.968 114.908 104.798 1.00 0.00 H TER 56861 WAT 6795 ATOM 56861 O WAT 6796 9.113 125.452 76.936 1.00 0.00 O ATOM 56862 H1 WAT 6796 10.022 125.643 77.167 1.00 0.00 H ATOM 56863 H2 WAT 6796 8.628 125.575 77.752 1.00 0.00 H TER 56865 WAT 6796 ATOM 56865 O WAT 6797 90.635 112.414 58.711 1.00 0.00 O ATOM 56866 H1 WAT 6797 91.409 112.143 58.218 1.00 0.00 H ATOM 56867 H2 WAT 6797 90.167 111.598 58.889 1.00 0.00 H TER 56869 WAT 6797 ATOM 56869 O WAT 6798 122.867 101.478 110.423 1.00 0.00 O ATOM 56870 H1 WAT 6798 122.163 101.616 109.789 1.00 0.00 H ATOM 56871 H2 WAT 6798 123.198 100.602 110.227 1.00 0.00 H TER 56873 WAT 6798 ATOM 56873 O WAT 6799 97.571 18.414 8.476 1.00 0.00 O ATOM 56874 H1 WAT 6799 98.011 18.065 9.251 1.00 0.00 H ATOM 56875 H2 WAT 6799 97.222 19.259 8.759 1.00 0.00 H TER 56877 WAT 6799 ATOM 56877 O WAT 6800 131.835 63.908 151.583 1.00 0.00 O ATOM 56878 H1 WAT 6800 131.397 64.758 151.628 1.00 0.00 H ATOM 56879 H2 WAT 6800 132.068 63.710 152.491 1.00 0.00 H TER 56881 WAT 6800 ATOM 56881 O WAT 6801 71.290 54.223 116.478 1.00 0.00 O ATOM 56882 H1 WAT 6801 70.429 54.233 116.897 1.00 0.00 H ATOM 56883 H2 WAT 6801 71.729 55.004 116.814 1.00 0.00 H TER 56885 WAT 6801 ATOM 56885 O WAT 6802 110.501 10.338 144.799 1.00 0.00 O ATOM 56886 H1 WAT 6802 111.183 10.719 145.352 1.00 0.00 H ATOM 56887 H2 WAT 6802 110.438 9.428 145.088 1.00 0.00 H TER 56889 WAT 6802 ATOM 56889 O WAT 6803 117.995 2.486 63.616 1.00 0.00 O ATOM 56890 H1 WAT 6803 118.392 2.320 62.761 1.00 0.00 H ATOM 56891 H2 WAT 6803 117.158 2.905 63.414 1.00 0.00 H TER 56893 WAT 6803 ATOM 56893 O WAT 6804 73.055 61.546 101.265 1.00 0.00 O ATOM 56894 H1 WAT 6804 72.620 62.251 100.786 1.00 0.00 H ATOM 56895 H2 WAT 6804 73.192 61.901 102.143 1.00 0.00 H TER 56897 WAT 6804 ATOM 56897 O WAT 6805 109.299 74.310 139.762 1.00 0.00 O ATOM 56898 H1 WAT 6805 109.837 75.097 139.684 1.00 0.00 H ATOM 56899 H2 WAT 6805 108.756 74.466 140.535 1.00 0.00 H TER 56901 WAT 6805 ATOM 56901 O WAT 6806 44.959 113.129 62.610 1.00 0.00 O ATOM 56902 H1 WAT 6806 44.679 114.012 62.369 1.00 0.00 H ATOM 56903 H2 WAT 6806 44.456 112.925 63.399 1.00 0.00 H TER 56905 WAT 6806 ATOM 56905 O WAT 6807 135.422 67.805 1.484 1.00 0.00 O ATOM 56906 H1 WAT 6807 135.361 68.636 1.011 1.00 0.00 H ATOM 56907 H2 WAT 6807 135.704 67.173 0.822 1.00 0.00 H TER 56909 WAT 6807 ATOM 56909 O WAT 6808 55.604 63.171 92.235 1.00 0.00 O ATOM 56910 H1 WAT 6808 56.096 62.865 92.997 1.00 0.00 H ATOM 56911 H2 WAT 6808 55.964 64.039 92.050 1.00 0.00 H TER 56913 WAT 6808 ATOM 56913 O WAT 6809 6.362 75.096 14.373 1.00 0.00 O ATOM 56914 H1 WAT 6809 6.345 74.873 15.303 1.00 0.00 H ATOM 56915 H2 WAT 6809 6.253 76.047 14.352 1.00 0.00 H TER 56917 WAT 6809 ATOM 56917 O WAT 6810 108.342 140.275 155.205 1.00 0.00 O ATOM 56918 H1 WAT 6810 108.496 140.061 154.285 1.00 0.00 H ATOM 56919 H2 WAT 6810 108.165 139.432 155.621 1.00 0.00 H TER 56921 WAT 6810 ATOM 56921 O WAT 6811 28.062 139.647 20.291 1.00 0.00 O ATOM 56922 H1 WAT 6811 28.806 140.163 20.604 1.00 0.00 H ATOM 56923 H2 WAT 6811 28.384 138.746 20.280 1.00 0.00 H TER 56925 WAT 6811 ATOM 56925 O WAT 6812 13.737 51.133 148.953 1.00 0.00 O ATOM 56926 H1 WAT 6812 14.248 51.104 149.762 1.00 0.00 H ATOM 56927 H2 WAT 6812 13.268 51.966 148.995 1.00 0.00 H TER 56929 WAT 6812 ATOM 56929 O WAT 6813 110.408 5.329 138.316 1.00 0.00 O ATOM 56930 H1 WAT 6813 111.077 5.940 138.622 1.00 0.00 H ATOM 56931 H2 WAT 6813 109.795 5.872 137.821 1.00 0.00 H TER 56933 WAT 6813 ATOM 56933 O WAT 6814 142.594 11.161 112.634 1.00 0.00 O ATOM 56934 H1 WAT 6814 142.007 10.633 112.092 1.00 0.00 H ATOM 56935 H2 WAT 6814 142.092 11.336 113.430 1.00 0.00 H TER 56937 WAT 6814 ATOM 56937 O WAT 6815 21.990 138.633 11.845 1.00 0.00 O ATOM 56938 H1 WAT 6815 21.704 138.289 12.691 1.00 0.00 H ATOM 56939 H2 WAT 6815 21.179 138.887 11.403 1.00 0.00 H TER 56941 WAT 6815 ATOM 56941 O WAT 6816 99.067 73.488 148.276 1.00 0.00 O ATOM 56942 H1 WAT 6816 98.768 72.740 148.793 1.00 0.00 H ATOM 56943 H2 WAT 6816 100.003 73.553 148.468 1.00 0.00 H TER 56945 WAT 6816 ATOM 56945 O WAT 6817 20.129 3.626 71.910 1.00 0.00 O ATOM 56946 H1 WAT 6817 20.804 3.963 71.321 1.00 0.00 H ATOM 56947 H2 WAT 6817 19.605 4.394 72.139 1.00 0.00 H TER 56949 WAT 6817 ATOM 56949 O WAT 6818 36.342 93.232 144.230 1.00 0.00 O ATOM 56950 H1 WAT 6818 36.363 92.688 143.443 1.00 0.00 H ATOM 56951 H2 WAT 6818 37.258 93.457 144.390 1.00 0.00 H TER 56953 WAT 6818 ATOM 56953 O WAT 6819 93.520 99.982 14.067 1.00 0.00 O ATOM 56954 H1 WAT 6819 92.751 100.523 14.243 1.00 0.00 H ATOM 56955 H2 WAT 6819 93.325 99.550 13.236 1.00 0.00 H TER 56957 WAT 6819 ATOM 56957 O WAT 6820 124.183 95.108 83.709 1.00 0.00 O ATOM 56958 H1 WAT 6820 125.132 95.026 83.613 1.00 0.00 H ATOM 56959 H2 WAT 6820 123.904 94.263 84.061 1.00 0.00 H TER 56961 WAT 6820 ATOM 56961 O WAT 6821 126.333 74.347 80.502 1.00 0.00 O ATOM 56962 H1 WAT 6821 126.663 73.809 79.782 1.00 0.00 H ATOM 56963 H2 WAT 6821 125.794 75.013 80.075 1.00 0.00 H TER 56965 WAT 6821 ATOM 56965 O WAT 6822 127.327 6.543 158.068 1.00 0.00 O ATOM 56966 H1 WAT 6822 127.797 6.056 157.392 1.00 0.00 H ATOM 56967 H2 WAT 6822 127.894 7.288 158.265 1.00 0.00 H TER 56969 WAT 6822 ATOM 56969 O WAT 6823 77.469 29.026 148.116 1.00 0.00 O ATOM 56970 H1 WAT 6823 77.777 28.210 148.508 1.00 0.00 H ATOM 56971 H2 WAT 6823 76.792 29.340 148.715 1.00 0.00 H TER 56973 WAT 6823 ATOM 56973 O WAT 6824 140.823 83.598 105.515 1.00 0.00 O ATOM 56974 H1 WAT 6824 140.895 83.169 106.368 1.00 0.00 H ATOM 56975 H2 WAT 6824 141.652 83.405 105.079 1.00 0.00 H TER 56977 WAT 6824 ATOM 56977 O WAT 6825 65.281 95.612 97.553 1.00 0.00 O ATOM 56978 H1 WAT 6825 64.706 95.373 96.825 1.00 0.00 H ATOM 56979 H2 WAT 6825 66.107 95.857 97.135 1.00 0.00 H TER 56981 WAT 6825 ATOM 56981 O WAT 6826 126.057 35.399 1.886 1.00 0.00 O ATOM 56982 H1 WAT 6826 126.498 35.889 1.192 1.00 0.00 H ATOM 56983 H2 WAT 6826 126.686 34.723 2.139 1.00 0.00 H TER 56985 WAT 6826 ATOM 56985 O WAT 6827 4.814 81.338 69.980 1.00 0.00 O ATOM 56986 H1 WAT 6827 4.034 81.216 69.438 1.00 0.00 H ATOM 56987 H2 WAT 6827 4.690 80.740 70.717 1.00 0.00 H TER 56989 WAT 6827 ATOM 56989 O WAT 6828 95.126 22.561 146.055 1.00 0.00 O ATOM 56990 H1 WAT 6828 95.874 21.973 145.950 1.00 0.00 H ATOM 56991 H2 WAT 6828 95.341 23.320 145.513 1.00 0.00 H TER 56993 WAT 6828 ATOM 56993 O WAT 6829 99.800 110.918 68.286 1.00 0.00 O ATOM 56994 H1 WAT 6829 99.351 110.898 67.441 1.00 0.00 H ATOM 56995 H2 WAT 6829 100.600 110.411 68.144 1.00 0.00 H TER 56997 WAT 6829 ATOM 56997 O WAT 6830 92.740 18.787 85.325 1.00 0.00 O ATOM 56998 H1 WAT 6830 93.594 18.392 85.498 1.00 0.00 H ATOM 56999 H2 WAT 6830 92.773 19.634 85.770 1.00 0.00 H TER 57001 WAT 6830 ATOM 57001 O WAT 6831 43.445 144.231 65.432 1.00 0.00 O ATOM 57002 H1 WAT 6831 42.692 144.528 64.922 1.00 0.00 H ATOM 57003 H2 WAT 6831 43.062 143.770 66.179 1.00 0.00 H TER 57005 WAT 6831 ATOM 57005 O WAT 6832 81.450 130.664 65.001 1.00 0.00 O ATOM 57006 H1 WAT 6832 82.020 129.968 64.673 1.00 0.00 H ATOM 57007 H2 WAT 6832 81.655 131.420 64.451 1.00 0.00 H TER 57009 WAT 6832 ATOM 57009 O WAT 6833 109.214 40.884 101.588 1.00 0.00 O ATOM 57010 H1 WAT 6833 108.948 41.709 101.182 1.00 0.00 H ATOM 57011 H2 WAT 6833 108.812 40.208 101.043 1.00 0.00 H TER 57013 WAT 6833 ATOM 57013 O WAT 6834 53.025 127.258 0.452 1.00 0.00 O ATOM 57014 H1 WAT 6834 53.959 127.050 0.460 1.00 0.00 H ATOM 57015 H2 WAT 6834 52.689 126.885 1.267 1.00 0.00 H TER 57017 WAT 6834 ATOM 57017 O WAT 6835 60.149 143.517 78.608 1.00 0.00 O ATOM 57018 H1 WAT 6835 59.297 143.591 79.037 1.00 0.00 H ATOM 57019 H2 WAT 6835 59.986 142.961 77.846 1.00 0.00 H TER 57021 WAT 6835 ATOM 57021 O WAT 6836 91.313 85.885 64.187 1.00 0.00 O ATOM 57022 H1 WAT 6836 90.726 86.335 64.796 1.00 0.00 H ATOM 57023 H2 WAT 6836 91.152 86.309 63.344 1.00 0.00 H TER 57025 WAT 6836 ATOM 57025 O WAT 6837 11.531 56.320 95.367 1.00 0.00 O ATOM 57026 H1 WAT 6837 11.416 56.454 96.308 1.00 0.00 H ATOM 57027 H2 WAT 6837 12.165 56.988 95.106 1.00 0.00 H TER 57029 WAT 6837 ATOM 57029 O WAT 6838 10.834 51.737 62.293 1.00 0.00 O ATOM 57030 H1 WAT 6838 11.165 52.082 61.464 1.00 0.00 H ATOM 57031 H2 WAT 6838 11.510 51.961 62.932 1.00 0.00 H TER 57033 WAT 6838 ATOM 57033 O WAT 6839 67.850 76.642 148.002 1.00 0.00 O ATOM 57034 H1 WAT 6839 66.949 76.967 148.026 1.00 0.00 H ATOM 57035 H2 WAT 6839 67.814 75.879 147.425 1.00 0.00 H TER 57037 WAT 6839 ATOM 57037 O WAT 6840 143.967 118.526 24.803 1.00 0.00 O ATOM 57038 H1 WAT 6840 144.232 119.393 24.495 1.00 0.00 H ATOM 57039 H2 WAT 6840 144.602 117.928 24.409 1.00 0.00 H TER 57041 WAT 6840 ATOM 57041 O WAT 6841 53.810 46.372 100.181 1.00 0.00 O ATOM 57042 H1 WAT 6841 54.580 46.544 99.639 1.00 0.00 H ATOM 57043 H2 WAT 6841 53.991 45.529 100.596 1.00 0.00 H TER 57045 WAT 6841 ATOM 57045 O WAT 6842 82.573 77.902 86.767 1.00 0.00 O ATOM 57046 H1 WAT 6842 83.425 77.821 86.338 1.00 0.00 H ATOM 57047 H2 WAT 6842 82.297 76.999 86.923 1.00 0.00 H TER 57049 WAT 6842 ATOM 57049 O WAT 6843 61.776 103.683 75.345 1.00 0.00 O ATOM 57050 H1 WAT 6843 61.145 104.394 75.236 1.00 0.00 H ATOM 57051 H2 WAT 6843 62.080 103.494 74.458 1.00 0.00 H TER 57053 WAT 6843 ATOM 57053 O WAT 6844 35.373 37.439 116.442 1.00 0.00 O ATOM 57054 H1 WAT 6844 34.560 37.102 116.819 1.00 0.00 H ATOM 57055 H2 WAT 6844 35.959 36.683 116.420 1.00 0.00 H TER 57057 WAT 6844 ATOM 57057 O WAT 6845 137.810 76.909 128.865 1.00 0.00 O ATOM 57058 H1 WAT 6845 138.213 76.843 127.999 1.00 0.00 H ATOM 57059 H2 WAT 6845 137.931 76.041 129.252 1.00 0.00 H TER 57061 WAT 6845 ATOM 57061 O WAT 6846 134.198 132.654 117.433 1.00 0.00 O ATOM 57062 H1 WAT 6846 133.667 131.877 117.609 1.00 0.00 H ATOM 57063 H2 WAT 6846 134.962 132.556 118.001 1.00 0.00 H TER 57065 WAT 6846 ATOM 57065 O WAT 6847 69.682 76.724 9.110 1.00 0.00 O ATOM 57066 H1 WAT 6847 70.481 76.775 9.635 1.00 0.00 H ATOM 57067 H2 WAT 6847 69.175 76.019 9.513 1.00 0.00 H TER 57069 WAT 6847 ATOM 57069 O WAT 6848 21.973 96.659 72.351 1.00 0.00 O ATOM 57070 H1 WAT 6848 22.826 96.281 72.137 1.00 0.00 H ATOM 57071 H2 WAT 6848 22.122 97.142 73.164 1.00 0.00 H TER 57073 WAT 6848 ATOM 57073 O WAT 6849 67.615 93.762 94.760 1.00 0.00 O ATOM 57074 H1 WAT 6849 67.026 93.288 95.347 1.00 0.00 H ATOM 57075 H2 WAT 6849 67.087 93.937 93.981 1.00 0.00 H TER 57077 WAT 6849 ATOM 57077 O WAT 6850 20.369 16.428 20.487 1.00 0.00 O ATOM 57078 H1 WAT 6850 20.489 16.172 21.402 1.00 0.00 H ATOM 57079 H2 WAT 6850 21.049 17.083 20.331 1.00 0.00 H TER 57081 WAT 6850 ATOM 57081 O WAT 6851 139.302 108.801 138.243 1.00 0.00 O ATOM 57082 H1 WAT 6851 139.113 108.642 137.318 1.00 0.00 H ATOM 57083 H2 WAT 6851 140.215 108.533 138.350 1.00 0.00 H TER 57085 WAT 6851 ATOM 57085 O WAT 6852 145.539 61.558 22.421 1.00 0.00 O ATOM 57086 H1 WAT 6852 145.777 62.484 22.463 1.00 0.00 H ATOM 57087 H2 WAT 6852 145.336 61.321 23.326 1.00 0.00 H TER 57089 WAT 6852 ATOM 57089 O WAT 6853 101.737 38.344 6.073 1.00 0.00 O ATOM 57090 H1 WAT 6853 101.240 38.522 6.872 1.00 0.00 H ATOM 57091 H2 WAT 6853 101.627 37.404 5.928 1.00 0.00 H TER 57093 WAT 6853 ATOM 57093 O WAT 6854 141.600 57.334 85.193 1.00 0.00 O ATOM 57094 H1 WAT 6854 141.055 57.375 84.407 1.00 0.00 H ATOM 57095 H2 WAT 6854 142.489 57.494 84.877 1.00 0.00 H TER 57097 WAT 6854 ATOM 57097 O WAT 6855 107.240 56.305 121.996 1.00 0.00 O ATOM 57098 H1 WAT 6855 106.955 57.022 122.563 1.00 0.00 H ATOM 57099 H2 WAT 6855 107.864 55.812 122.529 1.00 0.00 H TER 57101 WAT 6855 ATOM 57101 O WAT 6856 77.518 27.793 123.236 1.00 0.00 O ATOM 57102 H1 WAT 6856 77.476 26.871 122.979 1.00 0.00 H ATOM 57103 H2 WAT 6856 78.454 27.974 123.323 1.00 0.00 H TER 57105 WAT 6856 ATOM 57105 O WAT 6857 31.105 15.525 147.718 1.00 0.00 O ATOM 57106 H1 WAT 6857 31.830 14.902 147.675 1.00 0.00 H ATOM 57107 H2 WAT 6857 31.518 16.357 147.949 1.00 0.00 H TER 57109 WAT 6857 ATOM 57109 O WAT 6858 45.803 118.773 96.845 1.00 0.00 O ATOM 57110 H1 WAT 6858 46.428 119.322 97.320 1.00 0.00 H ATOM 57111 H2 WAT 6858 46.172 117.891 96.897 1.00 0.00 H TER 57113 WAT 6858 ATOM 57113 O WAT 6859 11.983 139.237 61.647 1.00 0.00 O ATOM 57114 H1 WAT 6859 12.419 139.242 62.499 1.00 0.00 H ATOM 57115 H2 WAT 6859 11.211 138.685 61.776 1.00 0.00 H TER 57117 WAT 6859 ATOM 57117 O WAT 6860 117.746 45.604 19.337 1.00 0.00 O ATOM 57118 H1 WAT 6860 117.644 46.183 18.582 1.00 0.00 H ATOM 57119 H2 WAT 6860 118.571 45.145 19.178 1.00 0.00 H TER 57121 WAT 6860 ATOM 57121 O WAT 6861 44.585 75.453 138.954 1.00 0.00 O ATOM 57122 H1 WAT 6861 44.478 75.185 139.867 1.00 0.00 H ATOM 57123 H2 WAT 6861 44.843 76.373 139.004 1.00 0.00 H TER 57125 WAT 6861 ATOM 57125 O WAT 6862 66.257 67.221 99.318 1.00 0.00 O ATOM 57126 H1 WAT 6862 65.905 68.092 99.499 1.00 0.00 H ATOM 57127 H2 WAT 6862 66.945 67.100 99.972 1.00 0.00 H TER 57129 WAT 6862 ATOM 57129 O WAT 6863 92.067 20.250 94.863 1.00 0.00 O ATOM 57130 H1 WAT 6863 92.255 20.820 94.117 1.00 0.00 H ATOM 57131 H2 WAT 6863 91.465 20.758 95.407 1.00 0.00 H TER 57133 WAT 6863 ATOM 57133 O WAT 6864 90.142 15.479 11.317 1.00 0.00 O ATOM 57134 H1 WAT 6864 90.712 14.721 11.185 1.00 0.00 H ATOM 57135 H2 WAT 6864 89.979 15.812 10.434 1.00 0.00 H TER 57137 WAT 6864 ATOM 57137 O WAT 6865 18.840 95.361 0.717 1.00 0.00 O ATOM 57138 H1 WAT 6865 18.395 95.256 -0.124 1.00 0.00 H ATOM 57139 H2 WAT 6865 19.037 94.467 0.997 1.00 0.00 H TER 57141 WAT 6865 ATOM 57141 O WAT 6866 62.698 64.016 84.222 1.00 0.00 O ATOM 57142 H1 WAT 6866 63.635 63.834 84.146 1.00 0.00 H ATOM 57143 H2 WAT 6866 62.643 64.969 84.280 1.00 0.00 H TER 57145 WAT 6866 ATOM 57145 O WAT 6867 100.256 87.019 10.854 1.00 0.00 O ATOM 57146 H1 WAT 6867 100.804 86.327 11.224 1.00 0.00 H ATOM 57147 H2 WAT 6867 99.584 87.174 11.518 1.00 0.00 H TER 57149 WAT 6867 ATOM 57149 O WAT 6868 62.208 113.301 3.657 1.00 0.00 O ATOM 57150 H1 WAT 6868 61.765 112.453 3.658 1.00 0.00 H ATOM 57151 H2 WAT 6868 62.979 113.169 4.209 1.00 0.00 H TER 57153 WAT 6868 ATOM 57153 O WAT 6869 41.718 86.212 70.258 1.00 0.00 O ATOM 57154 H1 WAT 6869 40.963 86.769 70.449 1.00 0.00 H ATOM 57155 H2 WAT 6869 41.381 85.319 70.333 1.00 0.00 H TER 57157 WAT 6869 ATOM 57157 O WAT 6870 46.956 29.781 13.017 1.00 0.00 O ATOM 57158 H1 WAT 6870 47.176 30.713 13.024 1.00 0.00 H ATOM 57159 H2 WAT 6870 46.057 29.750 12.689 1.00 0.00 H TER 57161 WAT 6870 ATOM 57161 O WAT 6871 17.543 131.535 110.085 1.00 0.00 O ATOM 57162 H1 WAT 6871 17.676 130.820 110.707 1.00 0.00 H ATOM 57163 H2 WAT 6871 16.985 132.158 110.551 1.00 0.00 H TER 57165 WAT 6871 ATOM 57165 O WAT 6872 46.873 144.546 10.706 1.00 0.00 O ATOM 57166 H1 WAT 6872 47.360 144.538 11.530 1.00 0.00 H ATOM 57167 H2 WAT 6872 47.232 145.290 10.223 1.00 0.00 H TER 57169 WAT 6872 ATOM 57169 O WAT 6873 93.093 49.738 68.515 1.00 0.00 O ATOM 57170 H1 WAT 6873 92.143 49.854 68.499 1.00 0.00 H ATOM 57171 H2 WAT 6873 93.396 50.136 67.699 1.00 0.00 H TER 57173 WAT 6873 ATOM 57173 O WAT 6874 139.718 99.598 71.011 1.00 0.00 O ATOM 57174 H1 WAT 6874 140.097 98.822 70.599 1.00 0.00 H ATOM 57175 H2 WAT 6874 139.385 100.119 70.280 1.00 0.00 H TER 57177 WAT 6874 ATOM 57177 O WAT 6875 108.357 45.095 77.945 1.00 0.00 O ATOM 57178 H1 WAT 6875 107.644 45.245 78.565 1.00 0.00 H ATOM 57179 H2 WAT 6875 109.138 45.416 78.397 1.00 0.00 H TER 57181 WAT 6875 ATOM 57181 O WAT 6876 125.668 98.016 149.169 1.00 0.00 O ATOM 57182 H1 WAT 6876 126.289 98.062 148.441 1.00 0.00 H ATOM 57183 H2 WAT 6876 124.873 97.650 148.782 1.00 0.00 H TER 57185 WAT 6876 ATOM 57185 O WAT 6877 137.124 6.361 71.441 1.00 0.00 O ATOM 57186 H1 WAT 6877 137.025 6.674 70.542 1.00 0.00 H ATOM 57187 H2 WAT 6877 136.331 6.659 71.887 1.00 0.00 H TER 57189 WAT 6877 ATOM 57189 O WAT 6878 56.516 118.709 120.325 1.00 0.00 O ATOM 57190 H1 WAT 6878 57.068 117.972 120.587 1.00 0.00 H ATOM 57191 H2 WAT 6878 56.025 118.933 121.116 1.00 0.00 H TER 57193 WAT 6878 ATOM 57193 O WAT 6879 74.111 28.868 156.929 1.00 0.00 O ATOM 57194 H1 WAT 6879 74.745 28.741 157.634 1.00 0.00 H ATOM 57195 H2 WAT 6879 74.517 28.459 156.164 1.00 0.00 H TER 57197 WAT 6879 ATOM 57197 O WAT 6880 125.408 84.124 80.314 1.00 0.00 O ATOM 57198 H1 WAT 6880 124.710 83.489 80.153 1.00 0.00 H ATOM 57199 H2 WAT 6880 125.341 84.743 79.587 1.00 0.00 H TER 57201 WAT 6880 ATOM 57201 O WAT 6881 92.922 58.258 66.558 1.00 0.00 O ATOM 57202 H1 WAT 6881 92.135 57.899 66.968 1.00 0.00 H ATOM 57203 H2 WAT 6881 92.982 57.804 65.717 1.00 0.00 H TER 57205 WAT 6881 ATOM 57205 O WAT 6882 137.954 1.222 150.791 1.00 0.00 O ATOM 57206 H1 WAT 6882 137.054 0.896 150.810 1.00 0.00 H ATOM 57207 H2 WAT 6882 138.218 1.143 149.874 1.00 0.00 H TER 57209 WAT 6882 ATOM 57209 O WAT 6883 103.955 125.283 75.300 1.00 0.00 O ATOM 57210 H1 WAT 6883 104.762 125.291 75.814 1.00 0.00 H ATOM 57211 H2 WAT 6883 103.290 124.952 75.904 1.00 0.00 H TER 57213 WAT 6883 ATOM 57213 O WAT 6884 7.337 108.398 20.037 1.00 0.00 O ATOM 57214 H1 WAT 6884 7.097 109.292 19.790 1.00 0.00 H ATOM 57215 H2 WAT 6884 8.118 108.208 19.518 1.00 0.00 H TER 57217 WAT 6884 ATOM 57217 O WAT 6885 64.568 81.242 0.972 1.00 0.00 O ATOM 57218 H1 WAT 6885 64.003 81.906 1.367 1.00 0.00 H ATOM 57219 H2 WAT 6885 64.609 81.483 0.046 1.00 0.00 H TER 57221 WAT 6885 ATOM 57221 O WAT 6886 7.943 97.315 15.114 1.00 0.00 O ATOM 57222 H1 WAT 6886 8.712 97.105 15.643 1.00 0.00 H ATOM 57223 H2 WAT 6886 7.210 97.269 15.727 1.00 0.00 H TER 57225 WAT 6886 ATOM 57225 O WAT 6887 129.990 141.515 7.817 1.00 0.00 O ATOM 57226 H1 WAT 6887 129.633 141.467 8.704 1.00 0.00 H ATOM 57227 H2 WAT 6887 130.084 142.452 7.647 1.00 0.00 H TER 57229 WAT 6887 ATOM 57229 O WAT 6888 98.440 54.944 18.236 1.00 0.00 O ATOM 57230 H1 WAT 6888 98.838 54.470 17.506 1.00 0.00 H ATOM 57231 H2 WAT 6888 99.070 55.632 18.447 1.00 0.00 H TER 57233 WAT 6888 ATOM 57233 O WAT 6889 98.969 50.981 88.492 1.00 0.00 O ATOM 57234 H1 WAT 6889 99.662 51.015 87.834 1.00 0.00 H ATOM 57235 H2 WAT 6889 99.025 50.096 88.853 1.00 0.00 H TER 57237 WAT 6889 ATOM 57237 O WAT 6890 50.799 99.439 113.283 1.00 0.00 O ATOM 57238 H1 WAT 6890 50.913 99.492 112.334 1.00 0.00 H ATOM 57239 H2 WAT 6890 50.889 100.343 113.587 1.00 0.00 H TER 57241 WAT 6890 ATOM 57241 O WAT 6891 134.902 10.561 123.809 1.00 0.00 O ATOM 57242 H1 WAT 6891 135.607 9.981 123.521 1.00 0.00 H ATOM 57243 H2 WAT 6891 134.119 10.217 123.380 1.00 0.00 H TER 57245 WAT 6891 ATOM 57245 O WAT 6892 4.554 96.849 120.083 1.00 0.00 O ATOM 57246 H1 WAT 6892 3.805 97.129 119.557 1.00 0.00 H ATOM 57247 H2 WAT 6892 4.909 96.095 119.612 1.00 0.00 H TER 57249 WAT 6892 ATOM 57249 O WAT 6893 63.091 76.464 147.002 1.00 0.00 O ATOM 57250 H1 WAT 6893 63.834 76.327 146.415 1.00 0.00 H ATOM 57251 H2 WAT 6893 62.902 75.595 147.357 1.00 0.00 H TER 57253 WAT 6893 ATOM 57253 O WAT 6894 114.186 39.272 143.201 1.00 0.00 O ATOM 57254 H1 WAT 6894 114.420 40.200 143.194 1.00 0.00 H ATOM 57255 H2 WAT 6894 114.789 38.868 142.577 1.00 0.00 H TER 57257 WAT 6894 ATOM 57257 O WAT 6895 122.095 7.460 12.350 1.00 0.00 O ATOM 57258 H1 WAT 6895 122.464 7.175 11.514 1.00 0.00 H ATOM 57259 H2 WAT 6895 121.698 6.670 12.718 1.00 0.00 H TER 57261 WAT 6895 ATOM 57261 O WAT 6896 8.461 69.293 63.068 1.00 0.00 O ATOM 57262 H1 WAT 6896 8.167 69.945 63.705 1.00 0.00 H ATOM 57263 H2 WAT 6896 9.267 68.938 63.443 1.00 0.00 H TER 57265 WAT 6896 ATOM 57265 O WAT 6897 11.942 136.401 71.176 1.00 0.00 O ATOM 57266 H1 WAT 6897 12.362 136.197 72.011 1.00 0.00 H ATOM 57267 H2 WAT 6897 12.253 137.279 70.959 1.00 0.00 H TER 57269 WAT 6897 ATOM 57269 O WAT 6898 123.278 39.449 111.178 1.00 0.00 O ATOM 57270 H1 WAT 6898 122.511 38.892 111.314 1.00 0.00 H ATOM 57271 H2 WAT 6898 123.886 39.193 111.872 1.00 0.00 H TER 57273 WAT 6898 ATOM 57273 O WAT 6899 141.791 105.317 78.606 1.00 0.00 O ATOM 57274 H1 WAT 6899 142.585 104.790 78.518 1.00 0.00 H ATOM 57275 H2 WAT 6899 141.114 104.805 78.164 1.00 0.00 H TER 57277 WAT 6899 ATOM 57277 O WAT 6900 79.601 45.709 144.332 1.00 0.00 O ATOM 57278 H1 WAT 6900 79.160 46.360 144.878 1.00 0.00 H ATOM 57279 H2 WAT 6900 79.726 44.957 144.910 1.00 0.00 H TER 57281 WAT 6900 ATOM 57281 O WAT 6901 33.839 84.453 70.225 1.00 0.00 O ATOM 57282 H1 WAT 6901 33.071 83.993 69.884 1.00 0.00 H ATOM 57283 H2 WAT 6901 34.474 83.759 70.403 1.00 0.00 H TER 57285 WAT 6901 ATOM 57285 O WAT 6902 70.781 93.467 130.382 1.00 0.00 O ATOM 57286 H1 WAT 6902 69.898 93.801 130.226 1.00 0.00 H ATOM 57287 H2 WAT 6902 71.158 93.370 129.508 1.00 0.00 H TER 57289 WAT 6902 ATOM 57289 O WAT 6903 65.872 89.511 19.920 1.00 0.00 O ATOM 57290 H1 WAT 6903 66.018 88.598 19.672 1.00 0.00 H ATOM 57291 H2 WAT 6903 66.427 89.642 20.689 1.00 0.00 H TER 57293 WAT 6903 ATOM 57293 O WAT 6904 24.349 14.997 0.306 1.00 0.00 O ATOM 57294 H1 WAT 6904 24.864 14.203 0.447 1.00 0.00 H ATOM 57295 H2 WAT 6904 24.527 15.240 -0.602 1.00 0.00 H TER 57297 WAT 6904 ATOM 57297 O WAT 6905 24.215 69.307 74.507 1.00 0.00 O ATOM 57298 H1 WAT 6905 24.648 68.456 74.576 1.00 0.00 H ATOM 57299 H2 WAT 6905 24.330 69.705 75.370 1.00 0.00 H TER 57301 WAT 6905 ATOM 57301 O WAT 6906 62.732 98.876 22.426 1.00 0.00 O ATOM 57302 H1 WAT 6906 63.620 99.203 22.569 1.00 0.00 H ATOM 57303 H2 WAT 6906 62.168 99.520 22.853 1.00 0.00 H TER 57305 WAT 6906 ATOM 57305 O WAT 6907 40.853 12.215 15.821 1.00 0.00 O ATOM 57306 H1 WAT 6907 41.755 12.078 15.531 1.00 0.00 H ATOM 57307 H2 WAT 6907 40.520 12.906 15.248 1.00 0.00 H TER 57309 WAT 6907 ATOM 57309 O WAT 6908 29.339 82.958 109.674 1.00 0.00 O ATOM 57310 H1 WAT 6908 29.815 82.516 110.377 1.00 0.00 H ATOM 57311 H2 WAT 6908 29.675 82.561 108.871 1.00 0.00 H TER 57313 WAT 6908 ATOM 57313 O WAT 6909 62.965 43.499 132.572 1.00 0.00 O ATOM 57314 H1 WAT 6909 63.209 43.790 133.450 1.00 0.00 H ATOM 57315 H2 WAT 6909 62.726 42.579 132.681 1.00 0.00 H TER 57317 WAT 6909 ATOM 57317 O WAT 6910 5.683 121.742 157.256 1.00 0.00 O ATOM 57318 H1 WAT 6910 5.881 122.025 156.363 1.00 0.00 H ATOM 57319 H2 WAT 6910 6.540 121.657 157.675 1.00 0.00 H TER 57321 WAT 6910 ATOM 57321 O WAT 6911 12.792 142.987 149.600 1.00 0.00 O ATOM 57322 H1 WAT 6911 12.197 142.238 149.643 1.00 0.00 H ATOM 57323 H2 WAT 6911 12.520 143.550 150.325 1.00 0.00 H TER 57325 WAT 6911 ATOM 57325 O WAT 6912 42.066 134.039 104.831 1.00 0.00 O ATOM 57326 H1 WAT 6912 41.397 133.999 105.514 1.00 0.00 H ATOM 57327 H2 WAT 6912 41.598 133.824 104.024 1.00 0.00 H TER 57329 WAT 6912 ATOM 57329 O WAT 6913 91.527 125.524 57.972 1.00 0.00 O ATOM 57330 H1 WAT 6913 91.146 126.062 57.278 1.00 0.00 H ATOM 57331 H2 WAT 6913 92.467 125.697 57.921 1.00 0.00 H TER 57333 WAT 6913 ATOM 57333 O WAT 6914 12.119 39.888 72.979 1.00 0.00 O ATOM 57334 H1 WAT 6914 11.643 40.170 73.760 1.00 0.00 H ATOM 57335 H2 WAT 6914 12.885 40.462 72.946 1.00 0.00 H TER 57337 WAT 6914 ATOM 57337 O WAT 6915 99.820 78.660 119.011 1.00 0.00 O ATOM 57338 H1 WAT 6915 100.539 79.245 118.773 1.00 0.00 H ATOM 57339 H2 WAT 6915 100.028 77.835 118.573 1.00 0.00 H TER 57341 WAT 6915 ATOM 57341 O WAT 6916 140.308 103.572 0.426 1.00 0.00 O ATOM 57342 H1 WAT 6916 139.694 103.877 -0.242 1.00 0.00 H ATOM 57343 H2 WAT 6916 140.826 102.898 -0.014 1.00 0.00 H TER 57345 WAT 6916 ATOM 57345 O WAT 6917 39.762 67.174 138.700 1.00 0.00 O ATOM 57346 H1 WAT 6917 39.999 68.051 138.399 1.00 0.00 H ATOM 57347 H2 WAT 6917 38.831 67.237 138.914 1.00 0.00 H TER 57349 WAT 6917 ATOM 57349 O WAT 6918 94.471 35.408 156.669 1.00 0.00 O ATOM 57350 H1 WAT 6918 94.493 34.592 157.168 1.00 0.00 H ATOM 57351 H2 WAT 6918 94.613 35.138 155.761 1.00 0.00 H TER 57353 WAT 6918 ATOM 57353 O WAT 6919 83.103 31.144 6.753 1.00 0.00 O ATOM 57354 H1 WAT 6919 84.039 31.331 6.684 1.00 0.00 H ATOM 57355 H2 WAT 6919 82.846 30.877 5.870 1.00 0.00 H TER 57357 WAT 6919 ATOM 57357 O WAT 6920 51.071 112.718 142.853 1.00 0.00 O ATOM 57358 H1 WAT 6920 51.254 113.351 142.158 1.00 0.00 H ATOM 57359 H2 WAT 6920 51.260 111.867 142.458 1.00 0.00 H TER 57361 WAT 6920 ATOM 57361 O WAT 6921 42.633 5.725 59.119 1.00 0.00 O ATOM 57362 H1 WAT 6921 42.074 5.498 59.862 1.00 0.00 H ATOM 57363 H2 WAT 6921 42.581 4.966 58.539 1.00 0.00 H TER 57365 WAT 6921 ATOM 57365 O WAT 6922 19.035 109.543 149.937 1.00 0.00 O ATOM 57366 H1 WAT 6922 19.691 110.208 150.148 1.00 0.00 H ATOM 57367 H2 WAT 6922 18.249 110.044 149.716 1.00 0.00 H TER 57369 WAT 6922 ATOM 57369 O WAT 6923 106.522 100.757 72.958 1.00 0.00 O ATOM 57370 H1 WAT 6923 106.445 100.486 73.873 1.00 0.00 H ATOM 57371 H2 WAT 6923 107.354 100.383 72.667 1.00 0.00 H TER 57373 WAT 6923 ATOM 57373 O WAT 6924 72.366 56.795 109.094 1.00 0.00 O ATOM 57374 H1 WAT 6924 72.744 57.665 108.968 1.00 0.00 H ATOM 57375 H2 WAT 6924 72.062 56.538 108.224 1.00 0.00 H TER 57377 WAT 6924 ATOM 57377 O WAT 6925 63.862 46.663 143.639 1.00 0.00 O ATOM 57378 H1 WAT 6925 63.561 47.131 144.418 1.00 0.00 H ATOM 57379 H2 WAT 6925 64.674 47.105 143.393 1.00 0.00 H TER 57381 WAT 6925 ATOM 57381 O WAT 6926 40.057 12.992 71.183 1.00 0.00 O ATOM 57382 H1 WAT 6926 40.970 12.708 71.149 1.00 0.00 H ATOM 57383 H2 WAT 6926 39.583 12.236 71.528 1.00 0.00 H TER 57385 WAT 6926 ATOM 57385 O WAT 6927 101.192 119.833 108.638 1.00 0.00 O ATOM 57386 H1 WAT 6927 102.136 119.984 108.683 1.00 0.00 H ATOM 57387 H2 WAT 6927 101.065 119.359 107.816 1.00 0.00 H TER 57389 WAT 6927 ATOM 57389 O WAT 6928 29.046 28.857 112.617 1.00 0.00 O ATOM 57390 H1 WAT 6928 29.368 28.140 112.070 1.00 0.00 H ATOM 57391 H2 WAT 6928 28.644 29.467 111.999 1.00 0.00 H TER 57393 WAT 6928 ATOM 57393 O WAT 6929 50.086 9.064 113.282 1.00 0.00 O ATOM 57394 H1 WAT 6929 49.556 8.998 114.076 1.00 0.00 H ATOM 57395 H2 WAT 6929 49.897 9.938 112.940 1.00 0.00 H TER 57397 WAT 6929 ATOM 57397 O WAT 6930 97.399 136.045 149.242 1.00 0.00 O ATOM 57398 H1 WAT 6930 97.822 136.758 148.764 1.00 0.00 H ATOM 57399 H2 WAT 6930 96.463 136.174 149.087 1.00 0.00 H TER 57401 WAT 6930 ATOM 57401 O WAT 6931 6.451 62.042 65.469 1.00 0.00 O ATOM 57402 H1 WAT 6931 5.924 62.721 65.047 1.00 0.00 H ATOM 57403 H2 WAT 6931 7.194 62.515 65.845 1.00 0.00 H TER 57405 WAT 6931 ATOM 57405 O WAT 6932 33.207 86.760 81.261 1.00 0.00 O ATOM 57406 H1 WAT 6932 32.813 86.460 80.442 1.00 0.00 H ATOM 57407 H2 WAT 6932 33.932 86.154 81.414 1.00 0.00 H TER 57409 WAT 6932 ATOM 57409 O WAT 6933 44.155 140.285 154.657 1.00 0.00 O ATOM 57410 H1 WAT 6933 43.778 139.486 155.026 1.00 0.00 H ATOM 57411 H2 WAT 6933 44.683 140.650 155.367 1.00 0.00 H TER 57413 WAT 6933 ATOM 57413 O WAT 6934 11.787 54.439 141.618 1.00 0.00 O ATOM 57414 H1 WAT 6934 12.360 55.032 142.103 1.00 0.00 H ATOM 57415 H2 WAT 6934 11.576 53.745 142.243 1.00 0.00 H TER 57417 WAT 6934 ATOM 57417 O WAT 6935 46.594 68.006 128.628 1.00 0.00 O ATOM 57418 H1 WAT 6935 46.846 68.807 129.087 1.00 0.00 H ATOM 57419 H2 WAT 6935 47.021 67.304 129.120 1.00 0.00 H TER 57421 WAT 6935 ATOM 57421 O WAT 6936 98.923 110.602 24.152 1.00 0.00 O ATOM 57422 H1 WAT 6936 98.593 111.486 24.311 1.00 0.00 H ATOM 57423 H2 WAT 6936 99.443 110.396 24.929 1.00 0.00 H TER 57425 WAT 6936 ATOM 57425 O WAT 6937 79.227 122.339 150.069 1.00 0.00 O ATOM 57426 H1 WAT 6937 79.947 122.589 150.648 1.00 0.00 H ATOM 57427 H2 WAT 6937 79.646 122.173 149.224 1.00 0.00 H TER 57429 WAT 6937 ATOM 57429 O WAT 6938 24.505 18.754 15.720 1.00 0.00 O ATOM 57430 H1 WAT 6938 23.921 18.098 15.341 1.00 0.00 H ATOM 57431 H2 WAT 6938 24.704 18.420 16.595 1.00 0.00 H TER 57433 WAT 6938 ATOM 57433 O WAT 6939 28.981 72.106 110.142 1.00 0.00 O ATOM 57434 H1 WAT 6939 29.118 73.050 110.068 1.00 0.00 H ATOM 57435 H2 WAT 6939 29.584 71.727 109.502 1.00 0.00 H TER 57437 WAT 6939 ATOM 57437 O WAT 6940 12.147 53.681 77.692 1.00 0.00 O ATOM 57438 H1 WAT 6940 13.104 53.652 77.711 1.00 0.00 H ATOM 57439 H2 WAT 6940 11.931 54.585 77.922 1.00 0.00 H TER 57441 WAT 6940 ATOM 57441 O WAT 6941 74.784 16.200 2.801 1.00 0.00 O ATOM 57442 H1 WAT 6941 75.619 15.806 3.054 1.00 0.00 H ATOM 57443 H2 WAT 6941 74.261 16.188 3.603 1.00 0.00 H TER 57445 WAT 6941 ATOM 57445 O WAT 6942 100.542 37.688 136.944 1.00 0.00 O ATOM 57446 H1 WAT 6942 101.417 37.300 136.985 1.00 0.00 H ATOM 57447 H2 WAT 6942 100.402 37.863 136.013 1.00 0.00 H TER 57449 WAT 6942 ATOM 57449 O WAT 6943 33.961 61.667 128.318 1.00 0.00 O ATOM 57450 H1 WAT 6943 33.262 61.153 128.722 1.00 0.00 H ATOM 57451 H2 WAT 6943 33.832 61.549 127.377 1.00 0.00 H TER 57453 WAT 6943 ATOM 57453 O WAT 6944 32.686 107.592 116.755 1.00 0.00 O ATOM 57454 H1 WAT 6944 31.785 107.319 116.926 1.00 0.00 H ATOM 57455 H2 WAT 6944 33.105 107.590 117.616 1.00 0.00 H TER 57457 WAT 6944 ATOM 57457 O WAT 6945 26.317 38.816 130.878 1.00 0.00 O ATOM 57458 H1 WAT 6945 26.832 38.247 131.450 1.00 0.00 H ATOM 57459 H2 WAT 6945 25.665 38.236 130.486 1.00 0.00 H TER 57461 WAT 6945 ATOM 57461 O WAT 6946 102.356 77.019 113.292 1.00 0.00 O ATOM 57462 H1 WAT 6946 101.608 76.527 113.630 1.00 0.00 H ATOM 57463 H2 WAT 6946 102.556 76.604 112.452 1.00 0.00 H TER 57465 WAT 6946 ATOM 57465 O WAT 6947 48.456 0.944 81.375 1.00 0.00 O ATOM 57466 H1 WAT 6947 47.761 0.823 82.021 1.00 0.00 H ATOM 57467 H2 WAT 6947 48.006 1.276 80.598 1.00 0.00 H TER 57469 WAT 6947 ATOM 57469 O WAT 6948 143.887 46.826 94.507 1.00 0.00 O ATOM 57470 H1 WAT 6948 143.535 46.340 95.252 1.00 0.00 H ATOM 57471 H2 WAT 6948 144.834 46.820 94.642 1.00 0.00 H TER 57473 WAT 6948 ATOM 57473 O WAT 6949 135.719 92.924 19.418 1.00 0.00 O ATOM 57474 H1 WAT 6949 136.239 92.282 18.935 1.00 0.00 H ATOM 57475 H2 WAT 6949 134.840 92.848 19.046 1.00 0.00 H TER 57477 WAT 6949 ATOM 57477 O WAT 6950 56.320 112.613 113.375 1.00 0.00 O ATOM 57478 H1 WAT 6950 55.891 113.463 113.471 1.00 0.00 H ATOM 57479 H2 WAT 6950 57.004 112.762 112.723 1.00 0.00 H TER 57481 WAT 6950 ATOM 57481 O WAT 6951 51.919 66.471 75.889 1.00 0.00 O ATOM 57482 H1 WAT 6951 51.072 66.805 76.186 1.00 0.00 H ATOM 57483 H2 WAT 6951 51.862 66.491 74.934 1.00 0.00 H TER 57485 WAT 6951 ATOM 57485 O WAT 6952 12.329 0.438 105.600 1.00 0.00 O ATOM 57486 H1 WAT 6952 12.371 1.241 106.118 1.00 0.00 H ATOM 57487 H2 WAT 6952 13.227 0.300 105.299 1.00 0.00 H TER 57489 WAT 6952 ATOM 57489 O WAT 6953 28.545 60.230 1.315 1.00 0.00 O ATOM 57490 H1 WAT 6953 28.008 60.031 0.549 1.00 0.00 H ATOM 57491 H2 WAT 6953 28.053 60.904 1.785 1.00 0.00 H TER 57493 WAT 6953 ATOM 57493 O WAT 6954 54.661 102.265 92.980 1.00 0.00 O ATOM 57494 H1 WAT 6954 54.561 102.716 93.818 1.00 0.00 H ATOM 57495 H2 WAT 6954 53.972 102.631 92.427 1.00 0.00 H TER 57497 WAT 6954 ATOM 57497 O WAT 6955 64.388 66.336 0.999 1.00 0.00 O ATOM 57498 H1 WAT 6955 63.770 66.073 1.681 1.00 0.00 H ATOM 57499 H2 WAT 6955 64.122 67.225 0.765 1.00 0.00 H TER 57501 WAT 6955 ATOM 57501 O WAT 6956 129.951 124.421 78.783 1.00 0.00 O ATOM 57502 H1 WAT 6956 130.206 123.737 78.163 1.00 0.00 H ATOM 57503 H2 WAT 6956 130.587 124.348 79.495 1.00 0.00 H TER 57505 WAT 6956 ATOM 57505 O WAT 6957 128.749 133.609 113.273 1.00 0.00 O ATOM 57506 H1 WAT 6957 128.887 134.075 112.448 1.00 0.00 H ATOM 57507 H2 WAT 6957 129.530 133.802 113.791 1.00 0.00 H TER 57509 WAT 6957 ATOM 57509 O WAT 6958 105.055 98.907 69.315 1.00 0.00 O ATOM 57510 H1 WAT 6958 104.215 98.466 69.440 1.00 0.00 H ATOM 57511 H2 WAT 6958 105.670 98.409 69.853 1.00 0.00 H TER 57513 WAT 6958 ATOM 57513 O WAT 6959 14.627 119.317 88.641 1.00 0.00 O ATOM 57514 H1 WAT 6959 15.243 119.234 87.913 1.00 0.00 H ATOM 57515 H2 WAT 6959 14.841 120.159 89.042 1.00 0.00 H TER 57517 WAT 6959 ATOM 57517 O WAT 6960 97.289 145.210 23.153 1.00 0.00 O ATOM 57518 H1 WAT 6960 97.372 146.164 23.131 1.00 0.00 H ATOM 57519 H2 WAT 6960 96.545 145.021 22.581 1.00 0.00 H TER 57521 WAT 6960 ATOM 57521 O WAT 6961 82.463 86.870 124.012 1.00 0.00 O ATOM 57522 H1 WAT 6961 81.921 86.722 124.787 1.00 0.00 H ATOM 57523 H2 WAT 6961 82.398 87.811 123.850 1.00 0.00 H TER 57525 WAT 6961 ATOM 57525 O WAT 6962 13.100 98.410 76.220 1.00 0.00 O ATOM 57526 H1 WAT 6962 13.021 97.509 75.906 1.00 0.00 H ATOM 57527 H2 WAT 6962 12.196 98.717 76.296 1.00 0.00 H TER 57529 WAT 6962 ATOM 57529 O WAT 6963 2.596 89.438 118.391 1.00 0.00 O ATOM 57530 H1 WAT 6963 2.567 89.065 117.511 1.00 0.00 H ATOM 57531 H2 WAT 6963 3.221 88.890 118.864 1.00 0.00 H TER 57533 WAT 6963 ATOM 57533 O WAT 6964 142.443 33.826 92.927 1.00 0.00 O ATOM 57534 H1 WAT 6964 142.028 32.964 92.886 1.00 0.00 H ATOM 57535 H2 WAT 6964 142.582 33.981 93.862 1.00 0.00 H TER 57537 WAT 6964 ATOM 57537 O WAT 6965 26.590 86.868 4.915 1.00 0.00 O ATOM 57538 H1 WAT 6965 26.240 86.044 4.575 1.00 0.00 H ATOM 57539 H2 WAT 6965 25.820 87.425 5.030 1.00 0.00 H TER 57541 WAT 6965 ATOM 57541 O WAT 6966 117.570 5.478 90.824 1.00 0.00 O ATOM 57542 H1 WAT 6966 116.705 5.184 91.110 1.00 0.00 H ATOM 57543 H2 WAT 6966 117.658 6.356 91.195 1.00 0.00 H TER 57545 WAT 6966 ATOM 57545 O WAT 6967 24.179 74.527 138.205 1.00 0.00 O ATOM 57546 H1 WAT 6967 24.125 73.610 137.935 1.00 0.00 H ATOM 57547 H2 WAT 6967 23.312 74.884 138.014 1.00 0.00 H TER 57549 WAT 6967 ATOM 57549 O WAT 6968 41.645 7.978 15.817 1.00 0.00 O ATOM 57550 H1 WAT 6968 42.188 8.175 15.053 1.00 0.00 H ATOM 57551 H2 WAT 6968 40.865 7.557 15.454 1.00 0.00 H TER 57553 WAT 6968 ATOM 57553 O WAT 6969 39.547 40.478 157.709 1.00 0.00 O ATOM 57554 H1 WAT 6969 39.532 41.426 157.576 1.00 0.00 H ATOM 57555 H2 WAT 6969 40.447 40.222 157.510 1.00 0.00 H TER 57557 WAT 6969 ATOM 57557 O WAT 6970 54.179 87.649 102.515 1.00 0.00 O ATOM 57558 H1 WAT 6970 53.931 88.494 102.140 1.00 0.00 H ATOM 57559 H2 WAT 6970 54.071 87.027 101.796 1.00 0.00 H TER 57561 WAT 6970 ATOM 57561 O WAT 6971 23.085 128.260 7.160 1.00 0.00 O ATOM 57562 H1 WAT 6971 22.377 128.893 7.041 1.00 0.00 H ATOM 57563 H2 WAT 6971 22.918 127.873 8.019 1.00 0.00 H TER 57565 WAT 6971 ATOM 57565 O WAT 6972 52.721 107.714 141.179 1.00 0.00 O ATOM 57566 H1 WAT 6972 52.171 106.940 141.066 1.00 0.00 H ATOM 57567 H2 WAT 6972 52.102 108.430 141.320 1.00 0.00 H TER 57569 WAT 6972 ATOM 57569 O WAT 6973 119.394 50.493 1.010 1.00 0.00 O ATOM 57570 H1 WAT 6973 119.334 50.913 1.868 1.00 0.00 H ATOM 57571 H2 WAT 6973 118.491 50.254 0.797 1.00 0.00 H TER 57573 WAT 6973 ATOM 57573 O WAT 6974 25.964 76.716 102.469 1.00 0.00 O ATOM 57574 H1 WAT 6974 26.010 77.672 102.481 1.00 0.00 H ATOM 57575 H2 WAT 6974 26.876 76.432 102.406 1.00 0.00 H TER 57577 WAT 6974 ATOM 57577 O WAT 6975 67.699 108.563 0.159 1.00 0.00 O ATOM 57578 H1 WAT 6975 67.324 109.324 -0.284 1.00 0.00 H ATOM 57579 H2 WAT 6975 67.485 108.695 1.083 1.00 0.00 H TER 57581 WAT 6975 ATOM 57581 O WAT 6976 21.692 120.674 2.274 1.00 0.00 O ATOM 57582 H1 WAT 6976 22.439 121.082 1.837 1.00 0.00 H ATOM 57583 H2 WAT 6976 21.161 120.320 1.561 1.00 0.00 H TER 57585 WAT 6976 ATOM 57585 O WAT 6977 76.286 88.004 4.985 1.00 0.00 O ATOM 57586 H1 WAT 6977 77.130 88.243 4.602 1.00 0.00 H ATOM 57587 H2 WAT 6977 75.775 87.668 4.249 1.00 0.00 H TER 57589 WAT 6977 ATOM 57589 O WAT 6978 5.476 21.197 124.897 1.00 0.00 O ATOM 57590 H1 WAT 6978 5.423 20.496 124.247 1.00 0.00 H ATOM 57591 H2 WAT 6978 5.440 22.003 124.382 1.00 0.00 H TER 57593 WAT 6978 ATOM 57593 O WAT 6979 69.120 119.279 152.980 1.00 0.00 O ATOM 57594 H1 WAT 6979 69.870 119.398 153.562 1.00 0.00 H ATOM 57595 H2 WAT 6979 68.437 119.837 153.352 1.00 0.00 H TER 57597 WAT 6979 ATOM 57597 O WAT 6980 55.192 137.291 110.914 1.00 0.00 O ATOM 57598 H1 WAT 6980 56.047 136.869 110.999 1.00 0.00 H ATOM 57599 H2 WAT 6980 55.219 138.015 111.541 1.00 0.00 H TER 57601 WAT 6980 ATOM 57601 O WAT 6981 69.243 69.925 146.428 1.00 0.00 O ATOM 57602 H1 WAT 6981 69.371 70.627 145.791 1.00 0.00 H ATOM 57603 H2 WAT 6981 68.606 70.278 147.050 1.00 0.00 H TER 57605 WAT 6981 ATOM 57605 O WAT 6982 100.363 30.324 3.502 1.00 0.00 O ATOM 57606 H1 WAT 6982 99.501 30.739 3.461 1.00 0.00 H ATOM 57607 H2 WAT 6982 100.650 30.456 4.405 1.00 0.00 H TER 57609 WAT 6982 ATOM 57609 O WAT 6983 48.051 104.568 19.515 1.00 0.00 O ATOM 57610 H1 WAT 6983 48.311 104.227 20.371 1.00 0.00 H ATOM 57611 H2 WAT 6983 47.443 103.914 19.171 1.00 0.00 H TER 57613 WAT 6983 ATOM 57613 O WAT 6984 7.310 40.871 103.994 1.00 0.00 O ATOM 57614 H1 WAT 6984 7.084 41.436 103.255 1.00 0.00 H ATOM 57615 H2 WAT 6984 6.571 40.960 104.597 1.00 0.00 H TER 57617 WAT 6984 ATOM 57617 O WAT 6985 3.839 107.595 122.131 1.00 0.00 O ATOM 57618 H1 WAT 6985 3.616 106.685 121.933 1.00 0.00 H ATOM 57619 H2 WAT 6985 4.641 107.758 121.634 1.00 0.00 H TER 57621 WAT 6985 ATOM 57621 O WAT 6986 26.390 54.487 102.513 1.00 0.00 O ATOM 57622 H1 WAT 6986 25.782 54.230 101.820 1.00 0.00 H ATOM 57623 H2 WAT 6986 25.932 55.180 102.989 1.00 0.00 H TER 57625 WAT 6986 ATOM 57625 O WAT 6987 33.882 54.221 18.922 1.00 0.00 O ATOM 57626 H1 WAT 6987 33.240 54.693 19.453 1.00 0.00 H ATOM 57627 H2 WAT 6987 33.801 53.310 19.202 1.00 0.00 H TER 57629 WAT 6987 ATOM 57629 O WAT 6988 66.356 114.844 114.492 1.00 0.00 O ATOM 57630 H1 WAT 6988 66.569 115.397 113.741 1.00 0.00 H ATOM 57631 H2 WAT 6988 66.887 115.195 115.207 1.00 0.00 H TER 57633 WAT 6988 ATOM 57633 O WAT 6989 26.353 15.484 112.487 1.00 0.00 O ATOM 57634 H1 WAT 6989 25.491 15.337 112.099 1.00 0.00 H ATOM 57635 H2 WAT 6989 26.168 15.759 113.385 1.00 0.00 H TER 57637 WAT 6989 ATOM 57637 O WAT 6990 63.277 72.587 112.768 1.00 0.00 O ATOM 57638 H1 WAT 6990 62.525 73.152 112.594 1.00 0.00 H ATOM 57639 H2 WAT 6990 63.726 73.005 113.503 1.00 0.00 H TER 57641 WAT 6990 ATOM 57641 O WAT 6991 55.083 65.699 4.763 1.00 0.00 O ATOM 57642 H1 WAT 6991 55.167 65.395 3.859 1.00 0.00 H ATOM 57643 H2 WAT 6991 55.443 66.586 4.751 1.00 0.00 H TER 57645 WAT 6991 ATOM 57645 O WAT 6992 100.699 110.105 -0.161 1.00 0.00 O ATOM 57646 H1 WAT 6992 99.868 109.822 0.222 1.00 0.00 H ATOM 57647 H2 WAT 6992 101.362 109.815 0.466 1.00 0.00 H TER 57649 WAT 6992 ATOM 57649 O WAT 6993 96.078 112.833 71.371 1.00 0.00 O ATOM 57650 H1 WAT 6993 95.591 113.654 71.440 1.00 0.00 H ATOM 57651 H2 WAT 6993 95.965 112.564 70.459 1.00 0.00 H TER 57653 WAT 6993 ATOM 57653 O WAT 6994 34.441 144.450 113.475 1.00 0.00 O ATOM 57654 H1 WAT 6994 34.684 144.682 112.578 1.00 0.00 H ATOM 57655 H2 WAT 6994 35.190 143.954 113.805 1.00 0.00 H TER 57657 WAT 6994 ATOM 57657 O WAT 6995 106.167 23.592 81.808 1.00 0.00 O ATOM 57658 H1 WAT 6995 106.567 23.167 82.566 1.00 0.00 H ATOM 57659 H2 WAT 6995 105.367 23.091 81.646 1.00 0.00 H TER 57661 WAT 6995 ATOM 57661 O WAT 6996 26.633 22.917 21.470 1.00 0.00 O ATOM 57662 H1 WAT 6996 26.661 22.613 20.563 1.00 0.00 H ATOM 57663 H2 WAT 6996 26.010 22.331 21.900 1.00 0.00 H TER 57665 WAT 6996 ATOM 57665 O WAT 6997 128.590 42.910 138.013 1.00 0.00 O ATOM 57666 H1 WAT 6997 128.395 42.130 138.532 1.00 0.00 H ATOM 57667 H2 WAT 6997 127.855 43.500 138.182 1.00 0.00 H TER 57669 WAT 6997 ATOM 57669 O WAT 6998 96.680 34.307 24.531 1.00 0.00 O ATOM 57670 H1 WAT 6998 95.735 34.462 24.544 1.00 0.00 H ATOM 57671 H2 WAT 6998 96.781 33.488 24.047 1.00 0.00 H TER 57673 WAT 6998 ATOM 57673 O WAT 6999 28.973 107.250 96.508 1.00 0.00 O ATOM 57674 H1 WAT 6999 29.756 107.796 96.581 1.00 0.00 H ATOM 57675 H2 WAT 6999 28.718 107.077 97.414 1.00 0.00 H TER 57677 WAT 6999 ATOM 57677 O WAT 7000 27.991 23.816 65.077 1.00 0.00 O ATOM 57678 H1 WAT 7000 27.226 23.305 65.339 1.00 0.00 H ATOM 57679 H2 WAT 7000 28.572 23.784 65.837 1.00 0.00 H TER 57681 WAT 7000 ATOM 57681 O WAT 7001 105.265 67.666 11.123 1.00 0.00 O ATOM 57682 H1 WAT 7001 105.912 66.992 10.912 1.00 0.00 H ATOM 57683 H2 WAT 7001 105.785 68.408 11.431 1.00 0.00 H TER 57685 WAT 7001 ATOM 57685 O WAT 7002 53.252 111.583 74.254 1.00 0.00 O ATOM 57686 H1 WAT 7002 52.565 112.019 74.758 1.00 0.00 H ATOM 57687 H2 WAT 7002 53.160 110.656 74.476 1.00 0.00 H TER 57689 WAT 7002 ATOM 57689 O WAT 7003 40.825 128.089 69.876 1.00 0.00 O ATOM 57690 H1 WAT 7003 41.028 128.989 70.131 1.00 0.00 H ATOM 57691 H2 WAT 7003 40.751 128.122 68.922 1.00 0.00 H TER 57693 WAT 7003 ATOM 57693 O WAT 7004 68.951 25.679 20.064 1.00 0.00 O ATOM 57694 H1 WAT 7004 68.797 26.112 19.224 1.00 0.00 H ATOM 57695 H2 WAT 7004 69.784 25.223 19.949 1.00 0.00 H TER 57697 WAT 7004 ATOM 57697 O WAT 7005 18.838 62.621 83.476 1.00 0.00 O ATOM 57698 H1 WAT 7005 19.010 62.852 82.563 1.00 0.00 H ATOM 57699 H2 WAT 7005 19.526 61.994 83.698 1.00 0.00 H TER 57701 WAT 7005 ATOM 57701 O WAT 7006 134.891 144.344 8.182 1.00 0.00 O ATOM 57702 H1 WAT 7006 134.933 144.482 9.129 1.00 0.00 H ATOM 57703 H2 WAT 7006 135.086 143.414 8.067 1.00 0.00 H TER 57705 WAT 7006 ATOM 57705 O WAT 7007 93.097 32.722 18.738 1.00 0.00 O ATOM 57706 H1 WAT 7007 93.093 32.901 19.678 1.00 0.00 H ATOM 57707 H2 WAT 7007 93.926 33.085 18.428 1.00 0.00 H TER 57709 WAT 7007 ATOM 57709 O WAT 7008 44.112 97.452 98.071 1.00 0.00 O ATOM 57710 H1 WAT 7008 44.302 96.963 97.271 1.00 0.00 H ATOM 57711 H2 WAT 7008 43.979 96.779 98.738 1.00 0.00 H TER 57713 WAT 7008 ATOM 57713 O WAT 7009 131.104 66.986 111.973 1.00 0.00 O ATOM 57714 H1 WAT 7009 130.474 67.545 112.428 1.00 0.00 H ATOM 57715 H2 WAT 7009 131.807 67.582 111.711 1.00 0.00 H TER 57717 WAT 7009 ATOM 57717 O WAT 7010 0.652 104.816 77.844 1.00 0.00 O ATOM 57718 H1 WAT 7010 1.017 105.700 77.803 1.00 0.00 H ATOM 57719 H2 WAT 7010 1.020 104.368 77.083 1.00 0.00 H TER 57721 WAT 7010 ATOM 57721 O WAT 7011 136.575 79.989 3.648 1.00 0.00 O ATOM 57722 H1 WAT 7011 136.874 79.088 3.524 1.00 0.00 H ATOM 57723 H2 WAT 7011 135.736 79.902 4.101 1.00 0.00 H TER 57725 WAT 7011 ATOM 57725 O WAT 7012 96.542 116.493 17.643 1.00 0.00 O ATOM 57726 H1 WAT 7012 95.597 116.637 17.698 1.00 0.00 H ATOM 57727 H2 WAT 7012 96.869 116.713 18.515 1.00 0.00 H TER 57729 WAT 7012 ATOM 57729 O WAT 7013 77.190 106.155 139.755 1.00 0.00 O ATOM 57730 H1 WAT 7013 77.088 105.916 138.834 1.00 0.00 H ATOM 57731 H2 WAT 7013 77.961 106.722 139.772 1.00 0.00 H TER 57733 WAT 7013 ATOM 57733 O WAT 7014 90.130 8.224 71.549 1.00 0.00 O ATOM 57734 H1 WAT 7014 90.162 8.324 70.598 1.00 0.00 H ATOM 57735 H2 WAT 7014 89.761 9.050 71.863 1.00 0.00 H TER 57737 WAT 7014 ATOM 57737 O WAT 7015 58.745 46.652 56.724 1.00 0.00 O ATOM 57738 H1 WAT 7015 58.408 47.358 57.276 1.00 0.00 H ATOM 57739 H2 WAT 7015 58.304 45.866 57.045 1.00 0.00 H TER 57741 WAT 7015 ATOM 57741 O WAT 7016 127.095 1.986 101.141 1.00 0.00 O ATOM 57742 H1 WAT 7016 126.462 1.841 100.437 1.00 0.00 H ATOM 57743 H2 WAT 7016 127.099 1.164 101.632 1.00 0.00 H TER 57745 WAT 7016 ATOM 57745 O WAT 7017 122.743 9.349 83.443 1.00 0.00 O ATOM 57746 H1 WAT 7017 123.563 9.800 83.642 1.00 0.00 H ATOM 57747 H2 WAT 7017 122.677 8.665 84.109 1.00 0.00 H TER 57749 WAT 7017 ATOM 57749 O WAT 7018 102.222 119.961 72.249 1.00 0.00 O ATOM 57750 H1 WAT 7018 102.058 120.827 72.622 1.00 0.00 H ATOM 57751 H2 WAT 7018 101.885 120.018 71.355 1.00 0.00 H TER 57753 WAT 7018 ATOM 57753 O WAT 7019 121.357 5.066 130.886 1.00 0.00 O ATOM 57754 H1 WAT 7019 120.590 5.111 131.456 1.00 0.00 H ATOM 57755 H2 WAT 7019 121.452 4.135 130.686 1.00 0.00 H TER 57757 WAT 7019 ATOM 57757 O WAT 7020 81.784 34.037 102.783 1.00 0.00 O ATOM 57758 H1 WAT 7020 82.230 34.878 102.879 1.00 0.00 H ATOM 57759 H2 WAT 7020 82.219 33.461 103.413 1.00 0.00 H TER 57761 WAT 7020 ATOM 57761 O WAT 7021 29.473 55.534 150.450 1.00 0.00 O ATOM 57762 H1 WAT 7021 29.728 56.051 151.213 1.00 0.00 H ATOM 57763 H2 WAT 7021 28.676 55.957 150.129 1.00 0.00 H TER 57765 WAT 7021 ATOM 57765 O WAT 7022 28.841 43.242 155.872 1.00 0.00 O ATOM 57766 H1 WAT 7022 28.429 44.069 155.621 1.00 0.00 H ATOM 57767 H2 WAT 7022 29.344 43.455 156.659 1.00 0.00 H TER 57769 WAT 7022 ATOM 57769 O WAT 7023 74.320 108.557 4.534 1.00 0.00 O ATOM 57770 H1 WAT 7023 73.508 108.126 4.268 1.00 0.00 H ATOM 57771 H2 WAT 7023 74.908 108.442 3.787 1.00 0.00 H TER 57773 WAT 7023 ATOM 57773 O WAT 7024 78.790 92.325 142.888 1.00 0.00 O ATOM 57774 H1 WAT 7024 79.283 91.661 143.370 1.00 0.00 H ATOM 57775 H2 WAT 7024 79.462 92.896 142.513 1.00 0.00 H TER 57777 WAT 7024 ATOM 57777 O WAT 7025 137.824 70.276 127.420 1.00 0.00 O ATOM 57778 H1 WAT 7025 137.384 70.930 127.963 1.00 0.00 H ATOM 57779 H2 WAT 7025 138.166 70.772 126.677 1.00 0.00 H TER 57781 WAT 7025 ATOM 57781 O WAT 7026 135.391 18.248 149.604 1.00 0.00 O ATOM 57782 H1 WAT 7026 135.389 17.379 150.005 1.00 0.00 H ATOM 57783 H2 WAT 7026 136.267 18.591 149.779 1.00 0.00 H TER 57785 WAT 7026 ATOM 57785 O WAT 7027 9.845 115.870 11.493 1.00 0.00 O ATOM 57786 H1 WAT 7027 9.585 116.676 11.048 1.00 0.00 H ATOM 57787 H2 WAT 7027 10.678 115.630 11.087 1.00 0.00 H TER 57789 WAT 7027 ATOM 57789 O WAT 7028 123.553 107.638 133.612 1.00 0.00 O ATOM 57790 H1 WAT 7028 122.700 107.881 133.253 1.00 0.00 H ATOM 57791 H2 WAT 7028 124.158 107.733 132.877 1.00 0.00 H TER 57793 WAT 7028 ATOM 57793 O WAT 7029 36.235 101.529 9.446 1.00 0.00 O ATOM 57794 H1 WAT 7029 35.858 100.649 9.458 1.00 0.00 H ATOM 57795 H2 WAT 7029 36.794 101.539 8.669 1.00 0.00 H TER 57797 WAT 7029 ATOM 57797 O WAT 7030 89.034 24.036 99.692 1.00 0.00 O ATOM 57798 H1 WAT 7030 88.526 24.347 100.441 1.00 0.00 H ATOM 57799 H2 WAT 7030 88.549 23.276 99.372 1.00 0.00 H TER 57801 WAT 7030 ATOM 57801 O WAT 7031 32.355 110.615 137.040 1.00 0.00 O ATOM 57802 H1 WAT 7031 31.695 110.858 137.689 1.00 0.00 H ATOM 57803 H2 WAT 7031 31.980 109.859 136.588 1.00 0.00 H TER 57805 WAT 7031 ATOM 57805 O WAT 7032 23.128 54.758 136.943 1.00 0.00 O ATOM 57806 H1 WAT 7032 23.335 54.383 137.799 1.00 0.00 H ATOM 57807 H2 WAT 7032 22.601 55.532 137.143 1.00 0.00 H TER 57809 WAT 7032 ATOM 57809 O WAT 7033 21.832 40.955 158.760 1.00 0.00 O ATOM 57810 H1 WAT 7033 21.425 40.148 159.074 1.00 0.00 H ATOM 57811 H2 WAT 7033 21.537 41.035 157.853 1.00 0.00 H TER 57813 WAT 7033 ATOM 57813 O WAT 7034 59.884 7.919 157.959 1.00 0.00 O ATOM 57814 H1 WAT 7034 58.969 8.161 157.816 1.00 0.00 H ATOM 57815 H2 WAT 7034 60.270 7.913 157.084 1.00 0.00 H TER 57817 WAT 7034 ATOM 57817 O WAT 7035 138.618 24.673 154.649 1.00 0.00 O ATOM 57818 H1 WAT 7035 139.340 25.299 154.594 1.00 0.00 H ATOM 57819 H2 WAT 7035 139.023 23.868 154.972 1.00 0.00 H TER 57821 WAT 7035 ATOM 57821 O WAT 7036 60.935 53.142 61.693 1.00 0.00 O ATOM 57822 H1 WAT 7036 60.454 53.969 61.676 1.00 0.00 H ATOM 57823 H2 WAT 7036 61.059 52.918 60.771 1.00 0.00 H TER 57825 WAT 7036 ATOM 57825 O WAT 7037 55.048 36.870 126.609 1.00 0.00 O ATOM 57826 H1 WAT 7037 54.812 35.982 126.877 1.00 0.00 H ATOM 57827 H2 WAT 7037 55.893 37.031 127.029 1.00 0.00 H TER 57829 WAT 7037 ATOM 57829 O WAT 7038 112.255 75.446 115.237 1.00 0.00 O ATOM 57830 H1 WAT 7038 112.003 76.252 114.786 1.00 0.00 H ATOM 57831 H2 WAT 7038 111.580 74.813 114.992 1.00 0.00 H TER 57833 WAT 7038 ATOM 57833 O WAT 7039 116.087 2.877 1.600 1.00 0.00 O ATOM 57834 H1 WAT 7039 115.181 2.822 1.904 1.00 0.00 H ATOM 57835 H2 WAT 7039 116.563 2.256 2.152 1.00 0.00 H TER 57837 WAT 7039 ATOM 57837 O WAT 7040 24.970 28.814 157.841 1.00 0.00 O ATOM 57838 H1 WAT 7040 25.229 29.472 157.195 1.00 0.00 H ATOM 57839 H2 WAT 7040 25.532 28.987 158.596 1.00 0.00 H TER 57841 WAT 7040 ATOM 57841 O WAT 7041 64.913 32.639 120.624 1.00 0.00 O ATOM 57842 H1 WAT 7041 64.254 32.031 120.960 1.00 0.00 H ATOM 57843 H2 WAT 7041 65.422 32.120 120.001 1.00 0.00 H TER 57845 WAT 7041 ATOM 57845 O WAT 7042 55.322 76.069 77.519 1.00 0.00 O ATOM 57846 H1 WAT 7042 55.993 76.170 76.845 1.00 0.00 H ATOM 57847 H2 WAT 7042 55.638 76.596 78.253 1.00 0.00 H TER 57849 WAT 7042 ATOM 57849 O WAT 7043 118.117 137.613 82.623 1.00 0.00 O ATOM 57850 H1 WAT 7043 118.326 138.204 81.900 1.00 0.00 H ATOM 57851 H2 WAT 7043 118.772 136.918 82.561 1.00 0.00 H TER 57853 WAT 7043 ATOM 57853 O WAT 7044 63.272 37.645 127.642 1.00 0.00 O ATOM 57854 H1 WAT 7044 63.823 38.205 127.095 1.00 0.00 H ATOM 57855 H2 WAT 7044 62.531 37.416 127.081 1.00 0.00 H TER 57857 WAT 7044 ATOM 57857 O WAT 7045 99.580 9.682 80.205 1.00 0.00 O ATOM 57858 H1 WAT 7045 98.690 9.464 80.483 1.00 0.00 H ATOM 57859 H2 WAT 7045 100.143 9.148 80.766 1.00 0.00 H TER 57861 WAT 7045 ATOM 57861 O WAT 7046 115.857 107.208 82.656 1.00 0.00 O ATOM 57862 H1 WAT 7046 116.797 107.386 82.681 1.00 0.00 H ATOM 57863 H2 WAT 7046 115.729 106.709 81.849 1.00 0.00 H TER 57865 WAT 7046 ATOM 57865 O WAT 7047 122.606 135.254 118.756 1.00 0.00 O ATOM 57866 H1 WAT 7047 123.168 134.491 118.619 1.00 0.00 H ATOM 57867 H2 WAT 7047 122.389 135.553 117.873 1.00 0.00 H TER 57869 WAT 7047 ATOM 57869 O WAT 7048 3.262 37.014 146.967 1.00 0.00 O ATOM 57870 H1 WAT 7048 2.422 37.241 147.367 1.00 0.00 H ATOM 57871 H2 WAT 7048 3.183 37.308 146.060 1.00 0.00 H TER 57873 WAT 7048 ATOM 57873 O WAT 7049 103.173 92.717 126.740 1.00 0.00 O ATOM 57874 H1 WAT 7049 102.929 92.990 127.625 1.00 0.00 H ATOM 57875 H2 WAT 7049 102.897 91.802 126.687 1.00 0.00 H TER 57877 WAT 7049 ATOM 57877 O WAT 7050 0.709 76.926 4.074 1.00 0.00 O ATOM 57878 H1 WAT 7050 0.188 77.496 4.639 1.00 0.00 H ATOM 57879 H2 WAT 7050 0.145 76.758 3.319 1.00 0.00 H TER 57881 WAT 7050 ATOM 57881 O WAT 7051 58.994 57.489 126.313 1.00 0.00 O ATOM 57882 H1 WAT 7051 59.698 57.018 126.759 1.00 0.00 H ATOM 57883 H2 WAT 7051 58.501 56.807 125.857 1.00 0.00 H TER 57885 WAT 7051 ATOM 57885 O WAT 7052 43.877 14.072 90.904 1.00 0.00 O ATOM 57886 H1 WAT 7052 44.731 14.297 91.273 1.00 0.00 H ATOM 57887 H2 WAT 7052 43.265 14.179 91.633 1.00 0.00 H TER 57889 WAT 7052 ATOM 57889 O WAT 7053 52.935 21.278 77.208 1.00 0.00 O ATOM 57890 H1 WAT 7053 52.773 20.679 76.479 1.00 0.00 H ATOM 57891 H2 WAT 7053 52.113 21.757 77.312 1.00 0.00 H TER 57893 WAT 7053 ATOM 57893 O WAT 7054 25.590 137.078 91.364 1.00 0.00 O ATOM 57894 H1 WAT 7054 25.030 136.724 92.055 1.00 0.00 H ATOM 57895 H2 WAT 7054 26.093 137.769 91.794 1.00 0.00 H TER 57897 WAT 7054 ATOM 57897 O WAT 7055 133.972 20.838 87.404 1.00 0.00 O ATOM 57898 H1 WAT 7055 134.054 21.527 88.063 1.00 0.00 H ATOM 57899 H2 WAT 7055 134.498 20.115 87.746 1.00 0.00 H TER 57901 WAT 7055 ATOM 57901 O WAT 7056 90.320 54.453 127.856 1.00 0.00 O ATOM 57902 H1 WAT 7056 90.220 55.329 128.229 1.00 0.00 H ATOM 57903 H2 WAT 7056 89.514 54.312 127.359 1.00 0.00 H TER 57905 WAT 7056 ATOM 57905 O WAT 7057 39.106 16.845 93.899 1.00 0.00 O ATOM 57906 H1 WAT 7057 39.454 16.787 93.009 1.00 0.00 H ATOM 57907 H2 WAT 7057 38.269 17.297 93.800 1.00 0.00 H TER 57909 WAT 7057 ATOM 57909 O WAT 7058 71.207 7.042 108.612 1.00 0.00 O ATOM 57910 H1 WAT 7058 71.317 7.479 107.768 1.00 0.00 H ATOM 57911 H2 WAT 7058 70.675 7.648 109.128 1.00 0.00 H TER 57913 WAT 7058 ATOM 57913 O WAT 7059 55.250 8.537 122.812 1.00 0.00 O ATOM 57914 H1 WAT 7059 54.310 8.541 122.630 1.00 0.00 H ATOM 57915 H2 WAT 7059 55.320 8.185 123.700 1.00 0.00 H TER 57917 WAT 7059 ATOM 57917 O WAT 7060 71.131 89.609 23.647 1.00 0.00 O ATOM 57918 H1 WAT 7060 71.987 89.951 23.906 1.00 0.00 H ATOM 57919 H2 WAT 7060 70.544 90.363 23.704 1.00 0.00 H TER 57921 WAT 7060 ATOM 57921 O WAT 7061 30.404 20.081 115.710 1.00 0.00 O ATOM 57922 H1 WAT 7061 29.682 20.689 115.869 1.00 0.00 H ATOM 57923 H2 WAT 7061 31.176 20.641 115.629 1.00 0.00 H TER 57925 WAT 7061 ATOM 57925 O WAT 7062 27.313 83.986 82.012 1.00 0.00 O ATOM 57926 H1 WAT 7062 26.979 84.857 82.226 1.00 0.00 H ATOM 57927 H2 WAT 7062 26.560 83.525 81.643 1.00 0.00 H TER 57929 WAT 7062 ATOM 57929 O WAT 7063 64.547 28.529 73.194 1.00 0.00 O ATOM 57930 H1 WAT 7063 64.792 27.908 73.880 1.00 0.00 H ATOM 57931 H2 WAT 7063 64.302 29.324 73.667 1.00 0.00 H TER 57933 WAT 7063 ATOM 57933 O WAT 7064 119.834 38.107 93.741 1.00 0.00 O ATOM 57934 H1 WAT 7064 120.492 38.443 94.349 1.00 0.00 H ATOM 57935 H2 WAT 7064 119.202 38.820 93.654 1.00 0.00 H TER 57937 WAT 7064 ATOM 57937 O WAT 7065 112.725 58.035 155.465 1.00 0.00 O ATOM 57938 H1 WAT 7065 113.444 57.862 154.857 1.00 0.00 H ATOM 57939 H2 WAT 7065 111.935 57.821 154.968 1.00 0.00 H TER 57941 WAT 7065 ATOM 57941 O WAT 7066 10.608 132.714 3.711 1.00 0.00 O ATOM 57942 H1 WAT 7066 9.821 132.681 4.255 1.00 0.00 H ATOM 57943 H2 WAT 7066 11.246 132.175 4.179 1.00 0.00 H TER 57945 WAT 7066 ATOM 57945 O WAT 7067 110.230 98.643 78.330 1.00 0.00 O ATOM 57946 H1 WAT 7067 110.355 99.265 77.613 1.00 0.00 H ATOM 57947 H2 WAT 7067 109.946 99.182 79.068 1.00 0.00 H TER 57949 WAT 7067 ATOM 57949 O WAT 7068 110.724 44.373 137.153 1.00 0.00 O ATOM 57950 H1 WAT 7068 110.494 44.665 138.035 1.00 0.00 H ATOM 57951 H2 WAT 7068 110.825 43.425 137.233 1.00 0.00 H TER 57953 WAT 7068 ATOM 57953 O WAT 7069 29.960 9.632 140.106 1.00 0.00 O ATOM 57954 H1 WAT 7069 29.415 10.290 139.676 1.00 0.00 H ATOM 57955 H2 WAT 7069 30.217 10.037 140.934 1.00 0.00 H TER 57957 WAT 7069 ATOM 57957 O WAT 7070 103.262 102.618 135.548 1.00 0.00 O ATOM 57958 H1 WAT 7070 104.036 102.989 135.124 1.00 0.00 H ATOM 57959 H2 WAT 7070 102.691 102.364 134.822 1.00 0.00 H TER 57961 WAT 7070 ATOM 57961 O WAT 7071 71.710 28.249 76.907 1.00 0.00 O ATOM 57962 H1 WAT 7071 72.433 27.946 77.456 1.00 0.00 H ATOM 57963 H2 WAT 7071 71.333 28.984 77.392 1.00 0.00 H TER 57965 WAT 7071 ATOM 57965 O WAT 7072 134.948 76.578 87.420 1.00 0.00 O ATOM 57966 H1 WAT 7072 135.892 76.688 87.305 1.00 0.00 H ATOM 57967 H2 WAT 7072 134.598 76.562 86.530 1.00 0.00 H TER 57969 WAT 7072 ATOM 57969 O WAT 7073 97.791 55.383 124.650 1.00 0.00 O ATOM 57970 H1 WAT 7073 98.625 55.730 124.333 1.00 0.00 H ATOM 57971 H2 WAT 7073 97.978 54.469 124.865 1.00 0.00 H TER 57973 WAT 7073 ATOM 57973 O WAT 7074 68.711 12.618 22.625 1.00 0.00 O ATOM 57974 H1 WAT 7074 68.684 12.882 23.545 1.00 0.00 H ATOM 57975 H2 WAT 7074 69.627 12.733 22.371 1.00 0.00 H TER 57977 WAT 7074 ATOM 57977 O WAT 7075 68.986 46.566 129.110 1.00 0.00 O ATOM 57978 H1 WAT 7075 69.274 45.782 128.643 1.00 0.00 H ATOM 57979 H2 WAT 7075 69.755 46.843 129.608 1.00 0.00 H TER 57981 WAT 7075 ATOM 57981 O WAT 7076 67.743 113.059 100.266 1.00 0.00 O ATOM 57982 H1 WAT 7076 67.389 112.859 101.132 1.00 0.00 H ATOM 57983 H2 WAT 7076 67.236 113.815 99.968 1.00 0.00 H TER 57985 WAT 7076 ATOM 57985 O WAT 7077 141.892 43.440 93.632 1.00 0.00 O ATOM 57986 H1 WAT 7077 142.208 43.267 94.519 1.00 0.00 H ATOM 57987 H2 WAT 7077 141.192 44.083 93.748 1.00 0.00 H TER 57989 WAT 7077 ATOM 57989 O WAT 7078 110.661 87.594 155.294 1.00 0.00 O ATOM 57990 H1 WAT 7078 110.543 87.970 154.421 1.00 0.00 H ATOM 57991 H2 WAT 7078 111.275 88.186 155.728 1.00 0.00 H TER 57993 WAT 7078 ATOM 57993 O WAT 7079 35.135 143.269 69.568 1.00 0.00 O ATOM 57994 H1 WAT 7079 35.858 143.671 70.050 1.00 0.00 H ATOM 57995 H2 WAT 7079 34.469 143.955 69.518 1.00 0.00 H TER 57997 WAT 7079 ATOM 57997 O WAT 7080 4.700 46.579 115.855 1.00 0.00 O ATOM 57998 H1 WAT 7080 5.403 45.992 115.576 1.00 0.00 H ATOM 57999 H2 WAT 7080 4.132 46.653 115.087 1.00 0.00 H TER 58001 WAT 7080 ATOM 58001 O WAT 7081 77.691 139.813 92.329 1.00 0.00 O ATOM 58002 H1 WAT 7081 77.672 140.673 92.748 1.00 0.00 H ATOM 58003 H2 WAT 7081 78.593 139.715 92.023 1.00 0.00 H TER 58005 WAT 7081 ATOM 58005 O WAT 7082 67.209 81.439 9.447 1.00 0.00 O ATOM 58006 H1 WAT 7082 68.007 80.921 9.548 1.00 0.00 H ATOM 58007 H2 WAT 7082 67.433 82.297 9.810 1.00 0.00 H TER 58009 WAT 7082 ATOM 58009 O WAT 7083 33.002 27.933 69.783 1.00 0.00 O ATOM 58010 H1 WAT 7083 33.003 27.497 68.931 1.00 0.00 H ATOM 58011 H2 WAT 7083 33.157 28.855 69.581 1.00 0.00 H TER 58013 WAT 7083 ATOM 58013 O WAT 7084 83.937 89.455 75.757 1.00 0.00 O ATOM 58014 H1 WAT 7084 83.828 89.701 76.676 1.00 0.00 H ATOM 58015 H2 WAT 7084 83.044 89.366 75.426 1.00 0.00 H TER 58017 WAT 7084 ATOM 58017 O WAT 7085 85.378 134.614 62.618 1.00 0.00 O ATOM 58018 H1 WAT 7085 85.966 134.149 63.214 1.00 0.00 H ATOM 58019 H2 WAT 7085 85.774 134.502 61.754 1.00 0.00 H TER 58021 WAT 7085 ATOM 58021 O WAT 7086 83.930 110.927 84.542 1.00 0.00 O ATOM 58022 H1 WAT 7086 83.555 110.201 84.044 1.00 0.00 H ATOM 58023 H2 WAT 7086 84.312 110.514 85.316 1.00 0.00 H TER 58025 WAT 7086 ATOM 58025 O WAT 7087 76.255 10.078 155.551 1.00 0.00 O ATOM 58026 H1 WAT 7087 77.068 9.967 156.043 1.00 0.00 H ATOM 58027 H2 WAT 7087 76.184 9.283 155.022 1.00 0.00 H TER 58029 WAT 7087 ATOM 58029 O WAT 7088 26.802 70.193 96.276 1.00 0.00 O ATOM 58030 H1 WAT 7088 26.316 70.846 95.773 1.00 0.00 H ATOM 58031 H2 WAT 7088 26.498 70.309 97.176 1.00 0.00 H TER 58033 WAT 7088 ATOM 58033 O WAT 7089 42.214 122.244 117.118 1.00 0.00 O ATOM 58034 H1 WAT 7089 42.521 121.751 117.879 1.00 0.00 H ATOM 58035 H2 WAT 7089 41.395 122.645 117.406 1.00 0.00 H TER 58037 WAT 7089 ATOM 58037 O WAT 7090 73.820 144.371 10.089 1.00 0.00 O ATOM 58038 H1 WAT 7090 74.714 144.040 10.177 1.00 0.00 H ATOM 58039 H2 WAT 7090 73.737 145.026 10.782 1.00 0.00 H TER 58041 WAT 7090 ATOM 58041 O WAT 7091 93.642 53.397 99.878 1.00 0.00 O ATOM 58042 H1 WAT 7091 93.290 52.516 100.005 1.00 0.00 H ATOM 58043 H2 WAT 7091 94.034 53.622 100.722 1.00 0.00 H TER 58045 WAT 7091 ATOM 58045 O WAT 7092 141.460 56.616 136.790 1.00 0.00 O ATOM 58046 H1 WAT 7092 141.411 57.548 136.577 1.00 0.00 H ATOM 58047 H2 WAT 7092 142.380 56.469 137.011 1.00 0.00 H TER 58049 WAT 7092 ATOM 58049 O WAT 7093 9.842 137.963 75.767 1.00 0.00 O ATOM 58050 H1 WAT 7093 9.631 137.672 74.880 1.00 0.00 H ATOM 58051 H2 WAT 7093 9.002 137.960 76.227 1.00 0.00 H TER 58053 WAT 7093 ATOM 58053 O WAT 7094 35.234 22.817 8.073 1.00 0.00 O ATOM 58054 H1 WAT 7094 35.243 23.589 7.507 1.00 0.00 H ATOM 58055 H2 WAT 7094 34.990 22.097 7.493 1.00 0.00 H TER 58057 WAT 7094 ATOM 58057 O WAT 7095 42.921 44.428 4.930 1.00 0.00 O ATOM 58058 H1 WAT 7095 42.136 44.649 4.428 1.00 0.00 H ATOM 58059 H2 WAT 7095 42.600 43.883 5.649 1.00 0.00 H TER 58061 WAT 7095 ATOM 58061 O WAT 7096 74.906 95.349 10.465 1.00 0.00 O ATOM 58062 H1 WAT 7096 75.192 95.850 11.228 1.00 0.00 H ATOM 58063 H2 WAT 7096 75.447 95.676 9.746 1.00 0.00 H TER 58065 WAT 7096 ATOM 58065 O WAT 7097 40.526 28.855 137.105 1.00 0.00 O ATOM 58066 H1 WAT 7097 40.288 27.966 137.369 1.00 0.00 H ATOM 58067 H2 WAT 7097 40.351 28.880 136.164 1.00 0.00 H TER 58069 WAT 7097 ATOM 58069 O WAT 7098 129.268 138.377 62.759 1.00 0.00 O ATOM 58070 H1 WAT 7098 129.371 139.251 62.383 1.00 0.00 H ATOM 58071 H2 WAT 7098 128.996 137.830 62.023 1.00 0.00 H TER 58073 WAT 7098 ATOM 58073 O WAT 7099 127.309 65.774 129.700 1.00 0.00 O ATOM 58074 H1 WAT 7099 127.367 66.714 129.531 1.00 0.00 H ATOM 58075 H2 WAT 7099 127.971 65.610 130.371 1.00 0.00 H TER 58077 WAT 7099 ATOM 58077 O WAT 7100 143.367 12.374 151.530 1.00 0.00 O ATOM 58078 H1 WAT 7100 143.994 12.089 152.194 1.00 0.00 H ATOM 58079 H2 WAT 7100 142.539 12.462 152.003 1.00 0.00 H TER 58081 WAT 7100 ATOM 58081 O WAT 7101 63.032 29.174 76.765 1.00 0.00 O ATOM 58082 H1 WAT 7101 62.820 28.341 77.186 1.00 0.00 H ATOM 58083 H2 WAT 7101 63.879 29.422 77.136 1.00 0.00 H TER 58085 WAT 7101 ATOM 58085 O WAT 7102 19.915 3.402 123.998 1.00 0.00 O ATOM 58086 H1 WAT 7102 19.968 3.586 124.936 1.00 0.00 H ATOM 58087 H2 WAT 7102 20.805 3.149 123.753 1.00 0.00 H TER 58089 WAT 7102 ATOM 58089 O WAT 7103 139.123 91.658 100.929 1.00 0.00 O ATOM 58090 H1 WAT 7103 139.103 92.610 101.028 1.00 0.00 H ATOM 58091 H2 WAT 7103 139.909 91.488 100.410 1.00 0.00 H TER 58093 WAT 7103 ATOM 58093 O WAT 7104 53.587 33.473 101.666 1.00 0.00 O ATOM 58094 H1 WAT 7104 53.204 33.312 100.803 1.00 0.00 H ATOM 58095 H2 WAT 7104 54.390 32.953 101.672 1.00 0.00 H TER 58097 WAT 7104 ATOM 58097 O WAT 7105 53.571 79.005 116.287 1.00 0.00 O ATOM 58098 H1 WAT 7105 53.070 79.739 115.930 1.00 0.00 H ATOM 58099 H2 WAT 7105 52.969 78.578 116.896 1.00 0.00 H TER 58101 WAT 7105 ATOM 58101 O WAT 7106 104.479 55.237 26.013 1.00 0.00 O ATOM 58102 H1 WAT 7106 103.864 54.762 25.454 1.00 0.00 H ATOM 58103 H2 WAT 7106 104.230 56.156 25.917 1.00 0.00 H TER 58105 WAT 7106 ATOM 58105 O WAT 7107 8.079 80.092 89.000 1.00 0.00 O ATOM 58106 H1 WAT 7107 7.844 81.005 88.835 1.00 0.00 H ATOM 58107 H2 WAT 7107 7.251 79.616 88.936 1.00 0.00 H TER 58109 WAT 7107 ATOM 58109 O WAT 7108 139.191 61.223 60.346 1.00 0.00 O ATOM 58110 H1 WAT 7108 139.795 61.005 61.056 1.00 0.00 H ATOM 58111 H2 WAT 7108 139.758 61.412 59.598 1.00 0.00 H TER 58113 WAT 7108 ATOM 58113 O WAT 7109 102.263 39.190 111.863 1.00 0.00 O ATOM 58114 H1 WAT 7109 101.619 39.862 112.087 1.00 0.00 H ATOM 58115 H2 WAT 7109 102.362 39.261 110.914 1.00 0.00 H TER 58117 WAT 7109 ATOM 58117 O WAT 7110 133.139 57.159 55.484 1.00 0.00 O ATOM 58118 H1 WAT 7110 132.325 56.661 55.407 1.00 0.00 H ATOM 58119 H2 WAT 7110 132.898 57.934 55.992 1.00 0.00 H TER 58121 WAT 7110 ATOM 58121 O WAT 7111 121.633 94.895 140.029 1.00 0.00 O ATOM 58122 H1 WAT 7111 122.405 94.834 140.591 1.00 0.00 H ATOM 58123 H2 WAT 7111 121.986 95.071 139.156 1.00 0.00 H TER 58125 WAT 7111 ATOM 58125 O WAT 7112 20.037 21.089 79.571 1.00 0.00 O ATOM 58126 H1 WAT 7112 20.426 20.919 78.713 1.00 0.00 H ATOM 58127 H2 WAT 7112 19.578 20.278 79.791 1.00 0.00 H TER 58129 WAT 7112 ATOM 58129 O WAT 7113 63.946 12.174 133.826 1.00 0.00 O ATOM 58130 H1 WAT 7113 63.239 12.770 134.075 1.00 0.00 H ATOM 58131 H2 WAT 7113 64.192 12.451 132.943 1.00 0.00 H TER 58133 WAT 7113 ATOM 58133 O WAT 7114 116.132 43.374 129.378 1.00 0.00 O ATOM 58134 H1 WAT 7114 115.691 43.938 130.012 1.00 0.00 H ATOM 58135 H2 WAT 7114 115.531 42.640 129.251 1.00 0.00 H TER 58137 WAT 7114 ATOM 58137 O WAT 7115 7.713 51.701 67.981 1.00 0.00 O ATOM 58138 H1 WAT 7115 7.987 50.935 67.477 1.00 0.00 H ATOM 58139 H2 WAT 7115 7.841 51.446 68.895 1.00 0.00 H TER 58141 WAT 7115 ATOM 58141 O WAT 7116 104.777 124.894 111.273 1.00 0.00 O ATOM 58142 H1 WAT 7116 104.179 125.640 111.222 1.00 0.00 H ATOM 58143 H2 WAT 7116 105.529 125.153 110.740 1.00 0.00 H TER 58145 WAT 7116 ATOM 58145 O WAT 7117 92.497 84.190 25.515 1.00 0.00 O ATOM 58146 H1 WAT 7117 93.097 83.851 24.850 1.00 0.00 H ATOM 58147 H2 WAT 7117 92.288 85.076 25.219 1.00 0.00 H TER 58149 WAT 7117 ATOM 58149 O WAT 7118 79.301 34.362 95.667 1.00 0.00 O ATOM 58150 H1 WAT 7118 79.816 33.966 96.371 1.00 0.00 H ATOM 58151 H2 WAT 7118 79.260 35.291 95.894 1.00 0.00 H TER 58153 WAT 7118 ATOM 58153 O WAT 7119 17.452 51.307 2.554 1.00 0.00 O ATOM 58154 H1 WAT 7119 17.873 52.107 2.871 1.00 0.00 H ATOM 58155 H2 WAT 7119 18.175 50.696 2.412 1.00 0.00 H TER 58157 WAT 7119 ATOM 58157 O WAT 7120 86.016 124.445 68.041 1.00 0.00 O ATOM 58158 H1 WAT 7120 85.887 124.011 68.884 1.00 0.00 H ATOM 58159 H2 WAT 7120 85.291 125.066 67.977 1.00 0.00 H TER 58161 WAT 7120 ATOM 58161 O WAT 7121 132.807 106.536 93.113 1.00 0.00 O ATOM 58162 H1 WAT 7121 132.808 107.480 93.273 1.00 0.00 H ATOM 58163 H2 WAT 7121 131.889 106.323 92.943 1.00 0.00 H TER 58165 WAT 7121 ATOM 58165 O WAT 7122 117.039 27.043 19.286 1.00 0.00 O ATOM 58166 H1 WAT 7122 117.370 26.906 18.398 1.00 0.00 H ATOM 58167 H2 WAT 7122 117.495 26.390 19.816 1.00 0.00 H TER 58169 WAT 7122 ATOM 58169 O WAT 7123 136.843 10.397 100.859 1.00 0.00 O ATOM 58170 H1 WAT 7123 137.184 9.509 100.960 1.00 0.00 H ATOM 58171 H2 WAT 7123 137.616 10.931 100.674 1.00 0.00 H TER 58173 WAT 7123 ATOM 58173 O WAT 7124 145.058 67.035 153.172 1.00 0.00 O ATOM 58174 H1 WAT 7124 144.141 66.820 153.003 1.00 0.00 H ATOM 58175 H2 WAT 7124 145.315 67.589 152.434 1.00 0.00 H TER 58177 WAT 7124 ATOM 58177 O WAT 7125 15.196 114.508 110.099 1.00 0.00 O ATOM 58178 H1 WAT 7125 14.585 113.822 110.369 1.00 0.00 H ATOM 58179 H2 WAT 7125 15.946 114.406 110.685 1.00 0.00 H TER 58181 WAT 7125 ATOM 58181 O WAT 7126 0.058 83.672 104.630 1.00 0.00 O ATOM 58182 H1 WAT 7126 0.219 84.615 104.666 1.00 0.00 H ATOM 58183 H2 WAT 7126 0.868 83.304 104.278 1.00 0.00 H TER 58185 WAT 7126 ATOM 58185 O WAT 7127 48.430 90.671 77.111 1.00 0.00 O ATOM 58186 H1 WAT 7127 48.642 91.458 76.611 1.00 0.00 H ATOM 58187 H2 WAT 7127 48.704 89.947 76.547 1.00 0.00 H TER 58189 WAT 7127 ATOM 58189 O WAT 7128 24.524 45.684 59.694 1.00 0.00 O ATOM 58190 H1 WAT 7128 25.288 45.689 59.118 1.00 0.00 H ATOM 58191 H2 WAT 7128 24.885 45.809 60.572 1.00 0.00 H TER 58193 WAT 7128 ATOM 58193 O WAT 7129 130.338 86.026 100.999 1.00 0.00 O ATOM 58194 H1 WAT 7129 130.169 85.130 101.290 1.00 0.00 H ATOM 58195 H2 WAT 7129 130.542 86.504 101.803 1.00 0.00 H TER 58197 WAT 7129 ATOM 58197 O WAT 7130 56.171 65.504 17.204 1.00 0.00 O ATOM 58198 H1 WAT 7130 55.769 64.641 17.301 1.00 0.00 H ATOM 58199 H2 WAT 7130 55.813 66.017 17.929 1.00 0.00 H TER 58201 WAT 7130 ATOM 58201 O WAT 7131 53.259 21.589 66.065 1.00 0.00 O ATOM 58202 H1 WAT 7131 54.034 21.566 65.504 1.00 0.00 H ATOM 58203 H2 WAT 7131 53.038 20.669 66.206 1.00 0.00 H TER 58205 WAT 7131 ATOM 58205 O WAT 7132 128.383 138.866 7.965 1.00 0.00 O ATOM 58206 H1 WAT 7132 129.090 138.302 8.280 1.00 0.00 H ATOM 58207 H2 WAT 7132 127.740 138.863 8.674 1.00 0.00 H TER 58209 WAT 7132 ATOM 58209 O WAT 7133 135.204 52.898 6.677 1.00 0.00 O ATOM 58210 H1 WAT 7133 135.963 53.079 6.123 1.00 0.00 H ATOM 58211 H2 WAT 7133 135.576 52.701 7.537 1.00 0.00 H TER 58213 WAT 7133 ATOM 58213 O WAT 7134 4.081 117.129 65.063 1.00 0.00 O ATOM 58214 H1 WAT 7134 4.531 117.378 65.870 1.00 0.00 H ATOM 58215 H2 WAT 7134 4.414 117.737 64.404 1.00 0.00 H TER 58217 WAT 7134 ATOM 58217 O WAT 7135 101.913 93.524 112.020 1.00 0.00 O ATOM 58218 H1 WAT 7135 100.998 93.446 112.289 1.00 0.00 H ATOM 58219 H2 WAT 7135 102.410 93.437 112.833 1.00 0.00 H TER 58221 WAT 7135 ATOM 58221 O WAT 7136 28.995 73.028 118.307 1.00 0.00 O ATOM 58222 H1 WAT 7136 29.479 72.694 119.063 1.00 0.00 H ATOM 58223 H2 WAT 7136 29.638 73.543 117.820 1.00 0.00 H TER 58225 WAT 7136 ATOM 58225 O WAT 7137 101.176 116.090 73.236 1.00 0.00 O ATOM 58226 H1 WAT 7137 100.277 116.402 73.344 1.00 0.00 H ATOM 58227 H2 WAT 7137 101.292 115.446 73.935 1.00 0.00 H TER 58229 WAT 7137 ATOM 58229 O WAT 7138 57.208 66.871 28.748 1.00 0.00 O ATOM 58230 H1 WAT 7138 56.310 66.619 28.529 1.00 0.00 H ATOM 58231 H2 WAT 7138 57.743 66.138 28.444 1.00 0.00 H TER 58233 WAT 7138 ATOM 58233 O WAT 7139 0.476 140.522 68.708 1.00 0.00 O ATOM 58234 H1 WAT 7139 0.820 140.195 67.877 1.00 0.00 H ATOM 58235 H2 WAT 7139 1.128 141.157 69.005 1.00 0.00 H TER 58237 WAT 7139 ATOM 58237 O WAT 7140 27.241 135.935 62.083 1.00 0.00 O ATOM 58238 H1 WAT 7140 27.370 135.931 63.031 1.00 0.00 H ATOM 58239 H2 WAT 7140 27.728 135.171 61.772 1.00 0.00 H TER 58241 WAT 7140 ATOM 58241 O WAT 7141 140.021 82.977 3.234 1.00 0.00 O ATOM 58242 H1 WAT 7141 139.244 82.927 3.790 1.00 0.00 H ATOM 58243 H2 WAT 7141 140.434 82.118 3.322 1.00 0.00 H TER 58245 WAT 7141 ATOM 58245 O WAT 7142 122.332 71.535 14.868 1.00 0.00 O ATOM 58246 H1 WAT 7142 121.919 70.784 15.295 1.00 0.00 H ATOM 58247 H2 WAT 7142 123.069 71.759 15.437 1.00 0.00 H TER 58249 WAT 7142 ATOM 58249 O WAT 7143 99.104 38.315 97.874 1.00 0.00 O ATOM 58250 H1 WAT 7143 99.579 38.969 97.361 1.00 0.00 H ATOM 58251 H2 WAT 7143 99.272 37.488 97.424 1.00 0.00 H TER 58253 WAT 7143 ATOM 58253 O WAT 7144 119.819 32.379 129.161 1.00 0.00 O ATOM 58254 H1 WAT 7144 119.958 33.085 129.792 1.00 0.00 H ATOM 58255 H2 WAT 7144 119.852 31.579 129.685 1.00 0.00 H TER 58257 WAT 7144 ATOM 58257 O WAT 7145 89.421 11.027 154.117 1.00 0.00 O ATOM 58258 H1 WAT 7145 89.024 11.796 154.525 1.00 0.00 H ATOM 58259 H2 WAT 7145 88.716 10.380 154.089 1.00 0.00 H TER 58261 WAT 7145 ATOM 58261 O WAT 7146 93.233 143.295 121.016 1.00 0.00 O ATOM 58262 H1 WAT 7146 93.372 143.656 121.891 1.00 0.00 H ATOM 58263 H2 WAT 7146 92.312 143.473 120.827 1.00 0.00 H TER 58265 WAT 7146 ATOM 58265 O WAT 7147 38.686 145.281 112.685 1.00 0.00 O ATOM 58266 H1 WAT 7147 39.583 145.562 112.867 1.00 0.00 H ATOM 58267 H2 WAT 7147 38.464 145.710 111.859 1.00 0.00 H TER 58269 WAT 7147 ATOM 58269 O WAT 7148 7.630 26.763 66.336 1.00 0.00 O ATOM 58270 H1 WAT 7148 7.500 26.778 65.388 1.00 0.00 H ATOM 58271 H2 WAT 7148 7.951 25.880 66.520 1.00 0.00 H TER 58273 WAT 7148 ATOM 58273 O WAT 7149 92.133 30.757 133.636 1.00 0.00 O ATOM 58274 H1 WAT 7149 92.796 30.087 133.804 1.00 0.00 H ATOM 58275 H2 WAT 7149 92.262 31.402 134.330 1.00 0.00 H TER 58277 WAT 7149 ATOM 58277 O WAT 7150 77.390 31.491 71.514 1.00 0.00 O ATOM 58278 H1 WAT 7150 77.514 30.542 71.520 1.00 0.00 H ATOM 58279 H2 WAT 7150 77.490 31.740 70.595 1.00 0.00 H TER 58281 WAT 7150 ATOM 58281 O WAT 7151 7.698 14.525 89.378 1.00 0.00 O ATOM 58282 H1 WAT 7151 7.363 13.869 88.767 1.00 0.00 H ATOM 58283 H2 WAT 7151 7.777 15.323 88.854 1.00 0.00 H TER 58285 WAT 7151 ATOM 58285 O WAT 7152 120.888 4.163 5.743 1.00 0.00 O ATOM 58286 H1 WAT 7152 120.177 4.633 5.307 1.00 0.00 H ATOM 58287 H2 WAT 7152 121.418 3.814 5.027 1.00 0.00 H TER 58289 WAT 7152 ATOM 58289 O WAT 7153 45.147 42.290 81.795 1.00 0.00 O ATOM 58290 H1 WAT 7153 45.622 42.028 82.584 1.00 0.00 H ATOM 58291 H2 WAT 7153 44.469 41.622 81.690 1.00 0.00 H TER 58293 WAT 7153 ATOM 58293 O WAT 7154 33.375 96.005 132.248 1.00 0.00 O ATOM 58294 H1 WAT 7154 33.521 95.115 132.569 1.00 0.00 H ATOM 58295 H2 WAT 7154 34.080 96.152 131.618 1.00 0.00 H TER 58297 WAT 7154 ATOM 58297 O WAT 7155 116.513 62.346 0.383 1.00 0.00 O ATOM 58298 H1 WAT 7155 116.386 62.803 1.215 1.00 0.00 H ATOM 58299 H2 WAT 7155 116.593 61.424 0.626 1.00 0.00 H TER 58301 WAT 7155 ATOM 58301 O WAT 7156 40.235 86.145 77.597 1.00 0.00 O ATOM 58302 H1 WAT 7156 41.152 86.384 77.733 1.00 0.00 H ATOM 58303 H2 WAT 7156 39.999 85.647 78.380 1.00 0.00 H TER 58305 WAT 7156 ATOM 58305 O WAT 7157 60.613 29.117 13.673 1.00 0.00 O ATOM 58306 H1 WAT 7157 60.594 29.709 14.425 1.00 0.00 H ATOM 58307 H2 WAT 7157 61.536 29.077 13.424 1.00 0.00 H TER 58309 WAT 7157 ATOM 58309 O WAT 7158 72.803 103.003 66.260 1.00 0.00 O ATOM 58310 H1 WAT 7158 72.278 103.309 65.520 1.00 0.00 H ATOM 58311 H2 WAT 7158 72.161 102.662 66.883 1.00 0.00 H TER 58313 WAT 7158 ATOM 58313 O WAT 7159 117.427 10.207 67.423 1.00 0.00 O ATOM 58314 H1 WAT 7159 117.838 10.939 66.963 1.00 0.00 H ATOM 58315 H2 WAT 7159 117.956 9.446 67.186 1.00 0.00 H TER 58317 WAT 7159 ATOM 58317 O WAT 7160 76.291 95.720 24.798 1.00 0.00 O ATOM 58318 H1 WAT 7160 75.456 95.436 25.168 1.00 0.00 H ATOM 58319 H2 WAT 7160 76.902 95.693 25.535 1.00 0.00 H TER 58321 WAT 7160 ATOM 58321 O WAT 7161 15.039 7.556 145.019 1.00 0.00 O ATOM 58322 H1 WAT 7161 14.684 7.329 144.160 1.00 0.00 H ATOM 58323 H2 WAT 7161 15.032 8.513 145.037 1.00 0.00 H TER 58325 WAT 7161 ATOM 58325 O WAT 7162 19.513 70.390 115.032 1.00 0.00 O ATOM 58326 H1 WAT 7162 19.752 69.587 115.496 1.00 0.00 H ATOM 58327 H2 WAT 7162 18.560 70.435 115.107 1.00 0.00 H TER 58329 WAT 7162 ATOM 58329 O WAT 7163 37.225 114.965 110.640 1.00 0.00 O ATOM 58330 H1 WAT 7163 36.895 115.748 110.198 1.00 0.00 H ATOM 58331 H2 WAT 7163 38.063 114.785 110.215 1.00 0.00 H TER 58333 WAT 7163 ATOM 58333 O WAT 7164 14.766 86.200 72.948 1.00 0.00 O ATOM 58334 H1 WAT 7164 14.590 86.411 72.031 1.00 0.00 H ATOM 58335 H2 WAT 7164 13.900 86.085 73.338 1.00 0.00 H TER 58337 WAT 7164 ATOM 58337 O WAT 7165 99.897 1.064 111.520 1.00 0.00 O ATOM 58338 H1 WAT 7165 100.391 1.564 112.170 1.00 0.00 H ATOM 58339 H2 WAT 7165 99.029 0.957 111.909 1.00 0.00 H TER 58341 WAT 7165 ATOM 58341 O WAT 7166 20.414 115.452 74.031 1.00 0.00 O ATOM 58342 H1 WAT 7166 20.989 115.160 74.739 1.00 0.00 H ATOM 58343 H2 WAT 7166 19.562 115.571 74.450 1.00 0.00 H TER 58345 WAT 7166 ATOM 58345 O WAT 7167 126.841 132.515 108.474 1.00 0.00 O ATOM 58346 H1 WAT 7167 127.036 132.310 109.389 1.00 0.00 H ATOM 58347 H2 WAT 7167 127.502 133.161 108.227 1.00 0.00 H TER 58349 WAT 7167 ATOM 58349 O WAT 7168 97.530 64.370 136.129 1.00 0.00 O ATOM 58350 H1 WAT 7168 97.604 64.139 135.203 1.00 0.00 H ATOM 58351 H2 WAT 7168 97.254 63.559 136.556 1.00 0.00 H TER 58353 WAT 7168 ATOM 58353 O WAT 7169 137.242 91.094 107.791 1.00 0.00 O ATOM 58354 H1 WAT 7169 136.426 91.355 108.219 1.00 0.00 H ATOM 58355 H2 WAT 7169 137.911 91.648 108.193 1.00 0.00 H TER 58357 WAT 7169 ATOM 58357 O WAT 7170 135.141 113.678 151.804 1.00 0.00 O ATOM 58358 H1 WAT 7170 134.413 113.145 152.124 1.00 0.00 H ATOM 58359 H2 WAT 7170 135.726 113.053 151.378 1.00 0.00 H TER 58361 WAT 7170 ATOM 58361 O WAT 7171 18.926 45.030 77.521 1.00 0.00 O ATOM 58362 H1 WAT 7171 19.530 45.772 77.552 1.00 0.00 H ATOM 58363 H2 WAT 7171 19.467 44.272 77.741 1.00 0.00 H TER 58365 WAT 7171 ATOM 58365 O WAT 7172 9.866 111.394 147.544 1.00 0.00 O ATOM 58366 H1 WAT 7172 9.073 110.863 147.618 1.00 0.00 H ATOM 58367 H2 WAT 7172 9.670 112.189 148.040 1.00 0.00 H TER 58369 WAT 7172 ATOM 58369 O WAT 7173 65.968 90.045 82.284 1.00 0.00 O ATOM 58370 H1 WAT 7173 65.372 89.296 82.255 1.00 0.00 H ATOM 58371 H2 WAT 7173 66.170 90.226 81.366 1.00 0.00 H TER 58373 WAT 7173 ATOM 58373 O WAT 7174 54.314 117.301 91.669 1.00 0.00 O ATOM 58374 H1 WAT 7174 55.157 117.682 91.916 1.00 0.00 H ATOM 58375 H2 WAT 7174 54.501 116.799 90.876 1.00 0.00 H TER 58377 WAT 7174 ATOM 58377 O WAT 7175 76.596 90.905 141.823 1.00 0.00 O ATOM 58378 H1 WAT 7175 77.277 91.481 142.171 1.00 0.00 H ATOM 58379 H2 WAT 7175 77.025 90.054 141.733 1.00 0.00 H TER 58381 WAT 7175 ATOM 58381 O WAT 7176 143.763 23.783 148.838 1.00 0.00 O ATOM 58382 H1 WAT 7176 143.881 23.225 148.070 1.00 0.00 H ATOM 58383 H2 WAT 7176 144.631 23.826 149.239 1.00 0.00 H TER 58385 WAT 7176 ATOM 58385 O WAT 7177 89.269 132.320 112.324 1.00 0.00 O ATOM 58386 H1 WAT 7177 88.518 131.907 112.751 1.00 0.00 H ATOM 58387 H2 WAT 7177 89.788 132.676 113.045 1.00 0.00 H TER 58389 WAT 7177 ATOM 58389 O WAT 7178 117.225 39.194 3.927 1.00 0.00 O ATOM 58390 H1 WAT 7178 117.103 38.660 4.712 1.00 0.00 H ATOM 58391 H2 WAT 7178 117.623 38.599 3.292 1.00 0.00 H TER 58393 WAT 7178 ATOM 58393 O WAT 7179 134.168 142.911 99.213 1.00 0.00 O ATOM 58394 H1 WAT 7179 134.807 143.581 99.457 1.00 0.00 H ATOM 58395 H2 WAT 7179 133.529 143.376 98.672 1.00 0.00 H TER 58397 WAT 7179 ATOM 58397 O WAT 7180 65.885 136.262 136.766 1.00 0.00 O ATOM 58398 H1 WAT 7180 65.049 136.376 136.315 1.00 0.00 H ATOM 58399 H2 WAT 7180 66.116 137.140 137.067 1.00 0.00 H TER 58401 WAT 7180 ATOM 58401 O WAT 7181 145.613 76.667 92.296 1.00 0.00 O ATOM 58402 H1 WAT 7181 145.614 77.307 93.008 1.00 0.00 H ATOM 58403 H2 WAT 7181 145.725 75.822 92.733 1.00 0.00 H TER 58405 WAT 7181 ATOM 58405 O WAT 7182 74.290 18.944 9.619 1.00 0.00 O ATOM 58406 H1 WAT 7182 73.490 19.164 9.143 1.00 0.00 H ATOM 58407 H2 WAT 7182 74.025 18.924 10.538 1.00 0.00 H TER 58409 WAT 7182 ATOM 58409 O WAT 7183 109.342 91.635 12.882 1.00 0.00 O ATOM 58410 H1 WAT 7183 110.009 91.676 12.197 1.00 0.00 H ATOM 58411 H2 WAT 7183 109.599 92.314 13.506 1.00 0.00 H TER 58413 WAT 7183 ATOM 58413 O WAT 7184 77.687 56.398 69.206 1.00 0.00 O ATOM 58414 H1 WAT 7184 78.602 56.327 68.932 1.00 0.00 H ATOM 58415 H2 WAT 7184 77.300 57.018 68.588 1.00 0.00 H TER 58417 WAT 7184 ATOM 58417 O WAT 7185 115.817 33.120 86.241 1.00 0.00 O ATOM 58418 H1 WAT 7185 115.238 33.881 86.203 1.00 0.00 H ATOM 58419 H2 WAT 7185 115.387 32.521 86.851 1.00 0.00 H TER 58421 WAT 7185 ATOM 58421 O WAT 7186 123.738 13.938 114.748 1.00 0.00 O ATOM 58422 H1 WAT 7186 124.474 14.002 115.358 1.00 0.00 H ATOM 58423 H2 WAT 7186 124.110 14.173 113.898 1.00 0.00 H TER 58425 WAT 7186 ATOM 58425 O WAT 7187 24.669 119.785 154.057 1.00 0.00 O ATOM 58426 H1 WAT 7187 24.576 120.670 154.410 1.00 0.00 H ATOM 58427 H2 WAT 7187 24.591 119.896 153.110 1.00 0.00 H TER 58429 WAT 7187 ATOM 58429 O WAT 7188 18.690 1.622 148.066 1.00 0.00 O ATOM 58430 H1 WAT 7188 19.566 1.996 147.970 1.00 0.00 H ATOM 58431 H2 WAT 7188 18.098 2.367 147.962 1.00 0.00 H TER 58433 WAT 7188 ATOM 58433 O WAT 7189 27.564 2.602 77.191 1.00 0.00 O ATOM 58434 H1 WAT 7189 28.296 2.256 76.681 1.00 0.00 H ATOM 58435 H2 WAT 7189 27.169 1.831 77.598 1.00 0.00 H TER 58437 WAT 7189 ATOM 58437 O WAT 7190 67.518 116.475 78.863 1.00 0.00 O ATOM 58438 H1 WAT 7190 67.413 116.697 79.788 1.00 0.00 H ATOM 58439 H2 WAT 7190 66.958 115.709 78.735 1.00 0.00 H TER 58441 WAT 7190 ATOM 58441 O WAT 7191 124.684 122.188 2.616 1.00 0.00 O ATOM 58442 H1 WAT 7191 124.877 123.106 2.425 1.00 0.00 H ATOM 58443 H2 WAT 7191 124.444 121.813 1.769 1.00 0.00 H TER 58445 WAT 7191 ATOM 58445 O WAT 7192 122.327 98.659 76.609 1.00 0.00 O ATOM 58446 H1 WAT 7192 122.294 97.767 76.956 1.00 0.00 H ATOM 58447 H2 WAT 7192 121.590 98.707 76.001 1.00 0.00 H TER 58449 WAT 7192 ATOM 58449 O WAT 7193 83.052 81.505 111.562 1.00 0.00 O ATOM 58450 H1 WAT 7193 83.997 81.358 111.605 1.00 0.00 H ATOM 58451 H2 WAT 7193 82.702 80.701 111.178 1.00 0.00 H TER 58453 WAT 7193 ATOM 58453 O WAT 7194 119.001 41.338 4.417 1.00 0.00 O ATOM 58454 H1 WAT 7194 119.909 41.074 4.268 1.00 0.00 H ATOM 58455 H2 WAT 7194 118.501 40.525 4.348 1.00 0.00 H TER 58457 WAT 7194 ATOM 58457 O WAT 7195 60.339 12.470 144.048 1.00 0.00 O ATOM 58458 H1 WAT 7195 61.228 12.753 144.260 1.00 0.00 H ATOM 58459 H2 WAT 7195 60.411 12.089 143.173 1.00 0.00 H TER 58461 WAT 7195 ATOM 58461 O WAT 7196 36.545 41.077 138.862 1.00 0.00 O ATOM 58462 H1 WAT 7196 36.821 40.786 139.731 1.00 0.00 H ATOM 58463 H2 WAT 7196 36.577 40.287 138.323 1.00 0.00 H TER 58465 WAT 7196 ATOM 58465 O WAT 7197 114.104 60.851 19.993 1.00 0.00 O ATOM 58466 H1 WAT 7197 114.354 60.037 19.556 1.00 0.00 H ATOM 58467 H2 WAT 7197 114.503 60.790 20.860 1.00 0.00 H TER 58469 WAT 7197 ATOM 58469 O WAT 7198 62.831 49.154 57.475 1.00 0.00 O ATOM 58470 H1 WAT 7198 62.154 49.793 57.250 1.00 0.00 H ATOM 58471 H2 WAT 7198 63.648 49.556 57.180 1.00 0.00 H TER 58473 WAT 7198 ATOM 58473 O WAT 7199 100.903 34.708 157.055 1.00 0.00 O ATOM 58474 H1 WAT 7199 101.551 34.118 157.439 1.00 0.00 H ATOM 58475 H2 WAT 7199 101.248 34.909 156.185 1.00 0.00 H TER 58477 WAT 7199 ATOM 58477 O WAT 7200 101.165 59.389 6.530 1.00 0.00 O ATOM 58478 H1 WAT 7200 101.786 59.108 5.858 1.00 0.00 H ATOM 58479 H2 WAT 7200 101.378 58.852 7.293 1.00 0.00 H TER 58481 WAT 7200 ATOM 58481 O WAT 7201 116.030 83.836 77.655 1.00 0.00 O ATOM 58482 H1 WAT 7201 115.417 83.584 76.964 1.00 0.00 H ATOM 58483 H2 WAT 7201 116.888 83.826 77.230 1.00 0.00 H TER 58485 WAT 7201 ATOM 58485 O WAT 7202 121.923 40.531 150.498 1.00 0.00 O ATOM 58486 H1 WAT 7202 122.139 40.376 151.418 1.00 0.00 H ATOM 58487 H2 WAT 7202 122.451 39.893 150.018 1.00 0.00 H TER 58489 WAT 7202 ATOM 58489 O WAT 7203 47.792 46.872 79.093 1.00 0.00 O ATOM 58490 H1 WAT 7203 46.942 46.901 79.532 1.00 0.00 H ATOM 58491 H2 WAT 7203 47.604 47.129 78.190 1.00 0.00 H TER 58493 WAT 7203 ATOM 58493 O WAT 7204 74.317 128.533 11.712 1.00 0.00 O ATOM 58494 H1 WAT 7204 74.144 127.742 12.222 1.00 0.00 H ATOM 58495 H2 WAT 7204 74.184 128.266 10.803 1.00 0.00 H TER 58497 WAT 7204 ATOM 58497 O WAT 7205 51.391 140.241 3.071 1.00 0.00 O ATOM 58498 H1 WAT 7205 52.137 139.699 2.812 1.00 0.00 H ATOM 58499 H2 WAT 7205 50.685 139.615 3.231 1.00 0.00 H TER 58501 WAT 7205 ATOM 58501 O WAT 7206 27.912 18.768 102.298 1.00 0.00 O ATOM 58502 H1 WAT 7206 28.788 19.146 102.370 1.00 0.00 H ATOM 58503 H2 WAT 7206 27.340 19.403 102.728 1.00 0.00 H TER 58505 WAT 7206 ATOM 58505 O WAT 7207 58.897 8.086 77.605 1.00 0.00 O ATOM 58506 H1 WAT 7207 58.028 8.323 77.928 1.00 0.00 H ATOM 58507 H2 WAT 7207 59.351 8.922 77.505 1.00 0.00 H TER 58509 WAT 7207 ATOM 58509 O WAT 7208 19.703 107.252 88.574 1.00 0.00 O ATOM 58510 H1 WAT 7208 20.043 106.535 89.108 1.00 0.00 H ATOM 58511 H2 WAT 7208 20.081 107.106 87.707 1.00 0.00 H TER 58513 WAT 7208 ATOM 58513 O WAT 7209 63.760 76.503 154.499 1.00 0.00 O ATOM 58514 H1 WAT 7209 64.447 76.199 155.092 1.00 0.00 H ATOM 58515 H2 WAT 7209 63.228 75.726 154.330 1.00 0.00 H TER 58517 WAT 7209 ATOM 58517 O WAT 7210 10.386 55.160 105.012 1.00 0.00 O ATOM 58518 H1 WAT 7210 9.450 55.354 104.967 1.00 0.00 H ATOM 58519 H2 WAT 7210 10.448 54.228 104.806 1.00 0.00 H TER 58521 WAT 7210 ATOM 58521 O WAT 7211 30.262 81.780 129.297 1.00 0.00 O ATOM 58522 H1 WAT 7211 30.566 82.642 129.579 1.00 0.00 H ATOM 58523 H2 WAT 7211 29.884 81.931 128.430 1.00 0.00 H TER 58525 WAT 7211 ATOM 58525 O WAT 7212 73.843 108.599 100.265 1.00 0.00 O ATOM 58526 H1 WAT 7212 74.647 109.100 100.127 1.00 0.00 H ATOM 58527 H2 WAT 7212 74.014 107.752 99.854 1.00 0.00 H TER 58529 WAT 7212 ATOM 58529 O WAT 7213 38.224 29.885 157.194 1.00 0.00 O ATOM 58530 H1 WAT 7213 38.203 29.509 158.074 1.00 0.00 H ATOM 58531 H2 WAT 7213 38.435 29.147 156.623 1.00 0.00 H TER 58533 WAT 7213 ATOM 58533 O WAT 7214 1.500 100.554 140.977 1.00 0.00 O ATOM 58534 H1 WAT 7214 1.664 99.909 140.289 1.00 0.00 H ATOM 58535 H2 WAT 7214 2.349 100.671 141.402 1.00 0.00 H TER 58537 WAT 7214 ATOM 58537 O WAT 7215 142.663 125.593 65.459 1.00 0.00 O ATOM 58538 H1 WAT 7215 142.916 124.813 64.965 1.00 0.00 H ATOM 58539 H2 WAT 7215 142.539 125.279 66.355 1.00 0.00 H TER 58541 WAT 7215 ATOM 58541 O WAT 7216 79.015 91.352 113.783 1.00 0.00 O ATOM 58542 H1 WAT 7216 79.333 90.694 113.165 1.00 0.00 H ATOM 58543 H2 WAT 7216 78.916 92.146 113.258 1.00 0.00 H TER 58545 WAT 7216 ATOM 58545 O WAT 7217 37.513 55.762 89.329 1.00 0.00 O ATOM 58546 H1 WAT 7217 36.916 55.107 88.966 1.00 0.00 H ATOM 58547 H2 WAT 7217 38.345 55.300 89.426 1.00 0.00 H TER 58549 WAT 7217 ATOM 58549 O WAT 7218 19.216 143.058 60.213 1.00 0.00 O ATOM 58550 H1 WAT 7218 18.931 143.690 59.553 1.00 0.00 H ATOM 58551 H2 WAT 7218 19.856 142.510 59.759 1.00 0.00 H TER 58553 WAT 7218 ATOM 58553 O WAT 7219 42.549 45.463 127.503 1.00 0.00 O ATOM 58554 H1 WAT 7219 41.809 45.963 127.156 1.00 0.00 H ATOM 58555 H2 WAT 7219 42.187 44.596 127.687 1.00 0.00 H TER 58557 WAT 7219 ATOM 58557 O WAT 7220 51.276 69.529 106.102 1.00 0.00 O ATOM 58558 H1 WAT 7220 51.054 68.600 106.044 1.00 0.00 H ATOM 58559 H2 WAT 7220 50.437 69.982 106.016 1.00 0.00 H TER 58561 WAT 7220 ATOM 58561 O WAT 7221 11.019 120.422 95.313 1.00 0.00 O ATOM 58562 H1 WAT 7221 10.205 119.933 95.436 1.00 0.00 H ATOM 58563 H2 WAT 7221 10.895 121.225 95.819 1.00 0.00 H TER 58565 WAT 7221 ATOM 58565 O WAT 7222 108.183 127.655 14.833 1.00 0.00 O ATOM 58566 H1 WAT 7222 107.387 127.723 15.359 1.00 0.00 H ATOM 58567 H2 WAT 7222 108.741 127.049 15.321 1.00 0.00 H TER 58569 WAT 7222 ATOM 58569 O WAT 7223 3.018 90.258 68.632 1.00 0.00 O ATOM 58570 H1 WAT 7223 2.171 89.991 68.275 1.00 0.00 H ATOM 58571 H2 WAT 7223 2.799 90.841 69.358 1.00 0.00 H TER 58573 WAT 7223 ATOM 58573 O WAT 7224 28.335 84.546 137.811 1.00 0.00 O ATOM 58574 H1 WAT 7224 29.058 84.550 137.184 1.00 0.00 H ATOM 58575 H2 WAT 7224 27.923 85.404 137.708 1.00 0.00 H TER 58577 WAT 7224 ATOM 58577 O WAT 7225 121.698 9.474 131.328 1.00 0.00 O ATOM 58578 H1 WAT 7225 121.740 10.423 131.450 1.00 0.00 H ATOM 58579 H2 WAT 7225 122.566 9.161 131.583 1.00 0.00 H TER 58581 WAT 7225 ATOM 58581 O WAT 7226 89.921 35.139 138.090 1.00 0.00 O ATOM 58582 H1 WAT 7226 90.238 36.017 137.880 1.00 0.00 H ATOM 58583 H2 WAT 7226 89.581 35.214 138.982 1.00 0.00 H TER 58585 WAT 7226 ATOM 58585 O WAT 7227 118.421 114.700 75.750 1.00 0.00 O ATOM 58586 H1 WAT 7227 118.546 113.993 76.383 1.00 0.00 H ATOM 58587 H2 WAT 7227 118.622 114.302 74.903 1.00 0.00 H TER 58589 WAT 7227 ATOM 58589 O WAT 7228 53.690 60.168 115.882 1.00 0.00 O ATOM 58590 H1 WAT 7228 54.102 59.502 115.332 1.00 0.00 H ATOM 58591 H2 WAT 7228 53.616 60.935 115.314 1.00 0.00 H TER 58593 WAT 7228 ATOM 58593 O WAT 7229 50.892 67.074 88.758 1.00 0.00 O ATOM 58594 H1 WAT 7229 50.989 67.605 87.967 1.00 0.00 H ATOM 58595 H2 WAT 7229 49.972 66.812 88.759 1.00 0.00 H TER 58597 WAT 7229 ATOM 58597 O WAT 7230 42.047 114.873 68.417 1.00 0.00 O ATOM 58598 H1 WAT 7230 41.946 115.819 68.523 1.00 0.00 H ATOM 58599 H2 WAT 7230 42.874 114.670 68.854 1.00 0.00 H TER 58601 WAT 7230 ATOM 58601 O WAT 7231 114.895 53.061 80.917 1.00 0.00 O ATOM 58602 H1 WAT 7231 114.218 52.678 80.360 1.00 0.00 H ATOM 58603 H2 WAT 7231 115.719 52.773 80.525 1.00 0.00 H TER 58605 WAT 7231 ATOM 58605 O WAT 7232 108.172 33.994 15.836 1.00 0.00 O ATOM 58606 H1 WAT 7232 108.178 33.561 16.689 1.00 0.00 H ATOM 58607 H2 WAT 7232 108.426 33.309 15.217 1.00 0.00 H TER 58609 WAT 7232 ATOM 58609 O WAT 7233 24.411 122.621 22.706 1.00 0.00 O ATOM 58610 H1 WAT 7233 24.875 121.965 22.185 1.00 0.00 H ATOM 58611 H2 WAT 7233 24.210 122.174 23.528 1.00 0.00 H TER 58613 WAT 7233 ATOM 58613 O WAT 7234 47.085 32.723 131.378 1.00 0.00 O ATOM 58614 H1 WAT 7234 47.553 33.477 131.020 1.00 0.00 H ATOM 58615 H2 WAT 7234 46.854 32.986 132.269 1.00 0.00 H TER 58617 WAT 7234 ATOM 58617 O WAT 7235 64.161 17.730 125.677 1.00 0.00 O ATOM 58618 H1 WAT 7235 63.336 17.264 125.814 1.00 0.00 H ATOM 58619 H2 WAT 7235 64.378 17.568 124.759 1.00 0.00 H TER 58621 WAT 7235 ATOM 58621 O WAT 7236 105.473 73.379 120.779 1.00 0.00 O ATOM 58622 H1 WAT 7236 105.970 73.173 119.987 1.00 0.00 H ATOM 58623 H2 WAT 7236 105.207 74.291 120.665 1.00 0.00 H TER 58625 WAT 7236 ATOM 58625 O WAT 7237 16.640 11.059 106.491 1.00 0.00 O ATOM 58626 H1 WAT 7237 16.111 11.853 106.565 1.00 0.00 H ATOM 58627 H2 WAT 7237 16.233 10.565 105.779 1.00 0.00 H TER 58629 WAT 7237 ATOM 58629 O WAT 7238 2.402 11.635 93.587 1.00 0.00 O ATOM 58630 H1 WAT 7238 2.887 10.909 93.194 1.00 0.00 H ATOM 58631 H2 WAT 7238 1.504 11.312 93.661 1.00 0.00 H TER 58633 WAT 7238 ATOM 58633 O WAT 7239 109.767 32.659 20.578 1.00 0.00 O ATOM 58634 H1 WAT 7239 110.206 32.817 21.414 1.00 0.00 H ATOM 58635 H2 WAT 7239 110.274 31.957 20.170 1.00 0.00 H TER 58637 WAT 7239 ATOM 58637 O WAT 7240 41.401 45.223 82.169 1.00 0.00 O ATOM 58638 H1 WAT 7240 40.630 44.761 81.841 1.00 0.00 H ATOM 58639 H2 WAT 7240 42.098 44.991 81.555 1.00 0.00 H TER 58641 WAT 7240 ATOM 58641 O WAT 7241 98.519 67.285 158.821 1.00 0.00 O ATOM 58642 H1 WAT 7241 98.177 68.076 158.404 1.00 0.00 H ATOM 58643 H2 WAT 7241 99.194 66.970 158.219 1.00 0.00 H TER 58645 WAT 7241 ATOM 58645 O WAT 7242 43.386 26.562 5.109 1.00 0.00 O ATOM 58646 H1 WAT 7242 44.331 26.716 5.121 1.00 0.00 H ATOM 58647 H2 WAT 7242 43.296 25.644 4.854 1.00 0.00 H TER 58649 WAT 7242 ATOM 58649 O WAT 7243 83.119 33.516 117.104 1.00 0.00 O ATOM 58650 H1 WAT 7243 83.132 32.797 117.735 1.00 0.00 H ATOM 58651 H2 WAT 7243 82.191 33.726 116.999 1.00 0.00 H TER 58653 WAT 7243 ATOM 58653 O WAT 7244 114.431 101.538 20.034 1.00 0.00 O ATOM 58654 H1 WAT 7244 114.071 102.367 19.718 1.00 0.00 H ATOM 58655 H2 WAT 7244 113.693 100.929 20.004 1.00 0.00 H TER 58657 WAT 7244 ATOM 58657 O WAT 7245 116.534 2.669 141.161 1.00 0.00 O ATOM 58658 H1 WAT 7245 116.077 1.878 140.874 1.00 0.00 H ATOM 58659 H2 WAT 7245 116.085 2.926 141.966 1.00 0.00 H TER 58661 WAT 7245 ATOM 58661 O WAT 7246 70.802 87.540 5.317 1.00 0.00 O ATOM 58662 H1 WAT 7246 71.149 86.876 4.721 1.00 0.00 H ATOM 58663 H2 WAT 7246 70.127 87.989 4.809 1.00 0.00 H TER 58665 WAT 7246 ATOM 58665 O WAT 7247 71.567 117.707 150.691 1.00 0.00 O ATOM 58666 H1 WAT 7247 72.076 117.660 149.881 1.00 0.00 H ATOM 58667 H2 WAT 7247 71.378 118.638 150.801 1.00 0.00 H TER 58669 WAT 7247 ATOM 58669 O WAT 7248 141.868 145.227 99.612 1.00 0.00 O ATOM 58670 H1 WAT 7248 142.352 145.481 98.825 1.00 0.00 H ATOM 58671 H2 WAT 7248 141.724 144.286 99.511 1.00 0.00 H TER 58673 WAT 7248 ATOM 58673 O WAT 7249 62.895 75.969 80.382 1.00 0.00 O ATOM 58674 H1 WAT 7249 62.582 76.164 81.266 1.00 0.00 H ATOM 58675 H2 WAT 7249 62.364 76.526 79.812 1.00 0.00 H TER 58677 WAT 7249 ATOM 58677 O WAT 7250 61.881 111.760 139.782 1.00 0.00 O ATOM 58678 H1 WAT 7250 62.355 112.155 140.513 1.00 0.00 H ATOM 58679 H2 WAT 7250 62.533 111.688 139.085 1.00 0.00 H TER 58681 WAT 7250 ATOM 58681 O WAT 7251 144.504 51.512 115.396 1.00 0.00 O ATOM 58682 H1 WAT 7251 143.656 51.081 115.504 1.00 0.00 H ATOM 58683 H2 WAT 7251 145.147 50.823 115.563 1.00 0.00 H TER 58685 WAT 7251 ATOM 58685 O WAT 7252 119.700 137.498 115.616 1.00 0.00 O ATOM 58686 H1 WAT 7252 119.691 138.242 116.218 1.00 0.00 H ATOM 58687 H2 WAT 7252 120.544 137.074 115.771 1.00 0.00 H TER 58689 WAT 7252 ATOM 58689 O WAT 7253 143.625 102.694 64.383 1.00 0.00 O ATOM 58690 H1 WAT 7253 143.142 101.870 64.455 1.00 0.00 H ATOM 58691 H2 WAT 7253 144.494 102.493 64.731 1.00 0.00 H TER 58693 WAT 7253 ATOM 58693 O WAT 7254 3.420 90.725 102.453 1.00 0.00 O ATOM 58694 H1 WAT 7254 2.763 90.501 103.112 1.00 0.00 H ATOM 58695 H2 WAT 7254 3.372 91.678 102.381 1.00 0.00 H TER 58697 WAT 7254 ATOM 58697 O WAT 7255 61.697 136.750 155.511 1.00 0.00 O ATOM 58698 H1 WAT 7255 61.362 136.229 156.241 1.00 0.00 H ATOM 58699 H2 WAT 7255 61.869 136.111 154.820 1.00 0.00 H TER 58701 WAT 7255 ATOM 58701 O WAT 7256 114.766 45.755 100.404 1.00 0.00 O ATOM 58702 H1 WAT 7256 114.278 44.997 100.083 1.00 0.00 H ATOM 58703 H2 WAT 7256 115.652 45.630 100.064 1.00 0.00 H TER 58705 WAT 7256 ATOM 58705 O WAT 7257 97.687 135.111 123.058 1.00 0.00 O ATOM 58706 H1 WAT 7257 98.272 134.356 122.986 1.00 0.00 H ATOM 58707 H2 WAT 7257 96.909 134.859 122.561 1.00 0.00 H TER 58709 WAT 7257 ATOM 58709 O WAT 7258 97.520 25.126 125.510 1.00 0.00 O ATOM 58710 H1 WAT 7258 98.269 24.537 125.429 1.00 0.00 H ATOM 58711 H2 WAT 7258 97.908 25.997 125.592 1.00 0.00 H TER 58713 WAT 7258 ATOM 58713 O WAT 7259 55.964 65.506 149.333 1.00 0.00 O ATOM 58714 H1 WAT 7259 55.560 66.333 149.598 1.00 0.00 H ATOM 58715 H2 WAT 7259 55.705 64.885 150.014 1.00 0.00 H TER 58717 WAT 7259 ATOM 58717 O WAT 7260 106.290 112.847 111.202 1.00 0.00 O ATOM 58718 H1 WAT 7260 106.096 112.008 110.783 1.00 0.00 H ATOM 58719 H2 WAT 7260 106.912 112.630 111.896 1.00 0.00 H TER 58721 WAT 7260 ATOM 58721 O WAT 7261 137.226 45.012 11.731 1.00 0.00 O ATOM 58722 H1 WAT 7261 136.613 45.477 12.300 1.00 0.00 H ATOM 58723 H2 WAT 7261 138.057 45.033 12.206 1.00 0.00 H TER 58725 WAT 7261 ATOM 58725 O WAT 7262 17.522 7.519 142.731 1.00 0.00 O ATOM 58726 H1 WAT 7262 16.938 6.885 143.147 1.00 0.00 H ATOM 58727 H2 WAT 7262 16.948 8.240 142.471 1.00 0.00 H TER 58729 WAT 7262 ATOM 58729 O WAT 7263 137.011 8.224 57.960 1.00 0.00 O ATOM 58730 H1 WAT 7263 136.983 8.826 58.704 1.00 0.00 H ATOM 58731 H2 WAT 7263 137.552 8.673 57.310 1.00 0.00 H TER 58733 WAT 7263 ATOM 58733 O WAT 7264 83.526 16.862 63.979 1.00 0.00 O ATOM 58734 H1 WAT 7264 83.243 16.164 64.570 1.00 0.00 H ATOM 58735 H2 WAT 7264 82.968 16.763 63.208 1.00 0.00 H TER 58737 WAT 7264 ATOM 58737 O WAT 7265 8.668 10.044 105.336 1.00 0.00 O ATOM 58738 H1 WAT 7265 8.335 9.371 104.742 1.00 0.00 H ATOM 58739 H2 WAT 7265 9.620 9.956 105.289 1.00 0.00 H TER 58741 WAT 7265 ATOM 58741 O WAT 7266 24.542 67.932 140.515 1.00 0.00 O ATOM 58742 H1 WAT 7266 24.408 68.066 141.453 1.00 0.00 H ATOM 58743 H2 WAT 7266 24.640 66.985 140.419 1.00 0.00 H TER 58745 WAT 7266 ATOM 58745 O WAT 7267 77.421 132.616 140.503 1.00 0.00 O ATOM 58746 H1 WAT 7267 77.378 133.022 139.637 1.00 0.00 H ATOM 58747 H2 WAT 7267 78.187 133.015 140.916 1.00 0.00 H TER 58749 WAT 7267 ATOM 58749 O WAT 7268 3.814 62.490 157.737 1.00 0.00 O ATOM 58750 H1 WAT 7268 3.016 62.046 158.025 1.00 0.00 H ATOM 58751 H2 WAT 7268 4.239 61.863 157.151 1.00 0.00 H TER 58753 WAT 7268 ATOM 58753 O WAT 7269 22.131 139.453 132.875 1.00 0.00 O ATOM 58754 H1 WAT 7269 22.475 139.959 133.611 1.00 0.00 H ATOM 58755 H2 WAT 7269 22.773 139.579 132.177 1.00 0.00 H TER 58757 WAT 7269 ATOM 58757 O WAT 7270 44.455 14.128 81.477 1.00 0.00 O ATOM 58758 H1 WAT 7270 43.535 13.925 81.645 1.00 0.00 H ATOM 58759 H2 WAT 7270 44.905 13.286 81.557 1.00 0.00 H TER 58761 WAT 7270 ATOM 58761 O WAT 7271 139.988 94.827 27.050 1.00 0.00 O ATOM 58762 H1 WAT 7271 139.137 95.265 27.060 1.00 0.00 H ATOM 58763 H2 WAT 7271 140.545 95.398 26.523 1.00 0.00 H TER 58765 WAT 7271 ATOM 58765 O WAT 7272 123.929 136.082 11.105 1.00 0.00 O ATOM 58766 H1 WAT 7272 123.462 135.900 11.920 1.00 0.00 H ATOM 58767 H2 WAT 7272 123.248 136.379 10.500 1.00 0.00 H TER 58769 WAT 7272 ATOM 58769 O WAT 7273 33.771 59.509 100.251 1.00 0.00 O ATOM 58770 H1 WAT 7273 33.481 58.803 100.828 1.00 0.00 H ATOM 58771 H2 WAT 7273 33.852 59.096 99.391 1.00 0.00 H TER 58773 WAT 7273 ATOM 58773 O WAT 7274 101.373 23.636 106.679 1.00 0.00 O ATOM 58774 H1 WAT 7274 101.273 24.523 106.334 1.00 0.00 H ATOM 58775 H2 WAT 7274 101.085 23.067 105.965 1.00 0.00 H TER 58777 WAT 7274 ATOM 58777 O WAT 7275 1.669 104.562 87.581 1.00 0.00 O ATOM 58778 H1 WAT 7275 2.001 103.682 87.762 1.00 0.00 H ATOM 58779 H2 WAT 7275 2.400 105.142 87.794 1.00 0.00 H TER 58781 WAT 7275 ATOM 58781 O WAT 7276 51.881 128.177 107.900 1.00 0.00 O ATOM 58782 H1 WAT 7276 51.177 128.786 108.121 1.00 0.00 H ATOM 58783 H2 WAT 7276 52.685 128.663 108.082 1.00 0.00 H TER 58785 WAT 7276 ATOM 58785 O WAT 7277 71.932 28.229 65.911 1.00 0.00 O ATOM 58786 H1 WAT 7277 72.567 28.943 65.969 1.00 0.00 H ATOM 58787 H2 WAT 7277 71.784 28.116 64.972 1.00 0.00 H TER 58789 WAT 7277 ATOM 58789 O WAT 7278 75.063 27.409 94.137 1.00 0.00 O ATOM 58790 H1 WAT 7278 74.379 27.270 93.482 1.00 0.00 H ATOM 58791 H2 WAT 7278 75.501 28.213 93.858 1.00 0.00 H TER 58793 WAT 7278 ATOM 58793 O WAT 7279 61.254 109.800 126.719 1.00 0.00 O ATOM 58794 H1 WAT 7279 61.591 108.975 126.369 1.00 0.00 H ATOM 58795 H2 WAT 7279 62.020 110.372 126.762 1.00 0.00 H TER 58797 WAT 7279 ATOM 58797 O WAT 7280 31.740 101.682 79.293 1.00 0.00 O ATOM 58798 H1 WAT 7280 32.607 101.290 79.397 1.00 0.00 H ATOM 58799 H2 WAT 7280 31.398 101.298 78.486 1.00 0.00 H TER 58801 WAT 7280 ATOM 58801 O WAT 7281 124.642 133.183 118.860 1.00 0.00 O ATOM 58802 H1 WAT 7281 125.308 133.856 118.998 1.00 0.00 H ATOM 58803 H2 WAT 7281 124.707 132.969 117.929 1.00 0.00 H TER 58805 WAT 7281 ATOM 58805 O WAT 7282 61.372 59.846 5.163 1.00 0.00 O ATOM 58806 H1 WAT 7282 62.233 60.113 4.842 1.00 0.00 H ATOM 58807 H2 WAT 7282 61.371 60.102 6.086 1.00 0.00 H TER 58809 WAT 7282 ATOM 58809 O WAT 7283 122.496 83.889 137.483 1.00 0.00 O ATOM 58810 H1 WAT 7283 122.565 83.933 136.529 1.00 0.00 H ATOM 58811 H2 WAT 7283 121.746 84.445 137.695 1.00 0.00 H TER 58813 WAT 7283 ATOM 58813 O WAT 7284 7.681 144.757 0.405 1.00 0.00 O ATOM 58814 H1 WAT 7284 8.415 144.198 0.150 1.00 0.00 H ATOM 58815 H2 WAT 7284 7.969 145.177 1.216 1.00 0.00 H TER 58817 WAT 7284 ATOM 58817 O WAT 7285 24.614 121.520 127.847 1.00 0.00 O ATOM 58818 H1 WAT 7285 24.429 122.383 127.478 1.00 0.00 H ATOM 58819 H2 WAT 7285 25.105 121.702 128.648 1.00 0.00 H TER 58821 WAT 7285 ATOM 58821 O WAT 7286 41.724 73.446 81.976 1.00 0.00 O ATOM 58822 H1 WAT 7286 41.412 74.156 82.537 1.00 0.00 H ATOM 58823 H2 WAT 7286 41.082 72.746 82.098 1.00 0.00 H TER 58825 WAT 7286 ATOM 58825 O WAT 7287 34.159 93.640 107.722 1.00 0.00 O ATOM 58826 H1 WAT 7287 33.919 92.718 107.631 1.00 0.00 H ATOM 58827 H2 WAT 7287 33.382 94.053 108.098 1.00 0.00 H TER 58829 WAT 7287 ATOM 58829 O WAT 7288 136.098 109.341 16.205 1.00 0.00 O ATOM 58830 H1 WAT 7288 135.966 108.765 15.452 1.00 0.00 H ATOM 58831 H2 WAT 7288 137.042 109.316 16.363 1.00 0.00 H TER 58833 WAT 7288 ATOM 58833 O WAT 7289 80.601 105.504 148.705 1.00 0.00 O ATOM 58834 H1 WAT 7289 80.198 105.858 147.913 1.00 0.00 H ATOM 58835 H2 WAT 7289 81.316 106.110 148.902 1.00 0.00 H TER 58837 WAT 7289 ATOM 58837 O WAT 7290 86.859 39.223 2.203 1.00 0.00 O ATOM 58838 H1 WAT 7290 86.450 39.933 1.709 1.00 0.00 H ATOM 58839 H2 WAT 7290 87.316 38.703 1.542 1.00 0.00 H TER 58841 WAT 7290 ATOM 58841 O WAT 7291 55.705 73.250 29.553 1.00 0.00 O ATOM 58842 H1 WAT 7291 54.814 73.037 29.274 1.00 0.00 H ATOM 58843 H2 WAT 7291 55.958 72.524 30.123 1.00 0.00 H TER 58845 WAT 7291 ATOM 58845 O WAT 7292 144.915 143.359 104.252 1.00 0.00 O ATOM 58846 H1 WAT 7292 145.007 143.757 105.118 1.00 0.00 H ATOM 58847 H2 WAT 7292 145.801 143.081 104.020 1.00 0.00 H TER 58849 WAT 7292 ATOM 58849 O WAT 7293 52.085 17.703 88.367 1.00 0.00 O ATOM 58850 H1 WAT 7293 52.200 17.046 87.681 1.00 0.00 H ATOM 58851 H2 WAT 7293 51.685 18.449 87.920 1.00 0.00 H TER 58853 WAT 7293 ATOM 58853 O WAT 7294 10.248 50.656 11.400 1.00 0.00 O ATOM 58854 H1 WAT 7294 10.317 50.786 10.454 1.00 0.00 H ATOM 58855 H2 WAT 7294 10.245 49.705 11.512 1.00 0.00 H TER 58857 WAT 7294 ATOM 58857 O WAT 7295 63.166 48.184 64.782 1.00 0.00 O ATOM 58858 H1 WAT 7295 63.064 47.298 64.436 1.00 0.00 H ATOM 58859 H2 WAT 7295 62.516 48.244 65.483 1.00 0.00 H TER 58861 WAT 7295 ATOM 58861 O WAT 7296 19.618 53.974 64.470 1.00 0.00 O ATOM 58862 H1 WAT 7296 19.771 54.907 64.622 1.00 0.00 H ATOM 58863 H2 WAT 7296 19.640 53.582 65.342 1.00 0.00 H TER 58865 WAT 7296 ATOM 58865 O WAT 7297 110.549 95.045 77.810 1.00 0.00 O ATOM 58866 H1 WAT 7297 111.183 94.473 77.378 1.00 0.00 H ATOM 58867 H2 WAT 7297 111.075 95.762 78.164 1.00 0.00 H TER 58869 WAT 7297 ATOM 58869 O WAT 7298 0.373 58.655 66.038 1.00 0.00 O ATOM 58870 H1 WAT 7298 -0.482 58.328 66.318 1.00 0.00 H ATOM 58871 H2 WAT 7298 0.316 59.604 66.153 1.00 0.00 H TER 58873 WAT 7298 ATOM 58873 O WAT 7299 16.207 40.208 89.603 1.00 0.00 O ATOM 58874 H1 WAT 7299 15.361 40.163 90.049 1.00 0.00 H ATOM 58875 H2 WAT 7299 16.745 39.552 90.046 1.00 0.00 H TER 58877 WAT 7299 ATOM 58877 O WAT 7300 109.198 7.463 87.794 1.00 0.00 O ATOM 58878 H1 WAT 7300 109.236 7.526 86.840 1.00 0.00 H ATOM 58879 H2 WAT 7300 109.980 6.963 88.032 1.00 0.00 H TER 58881 WAT 7300 ATOM 58881 O WAT 7301 30.156 27.603 7.050 1.00 0.00 O ATOM 58882 H1 WAT 7301 29.545 27.738 6.326 1.00 0.00 H ATOM 58883 H2 WAT 7301 29.831 26.822 7.496 1.00 0.00 H TER 58885 WAT 7301 ATOM 58885 O WAT 7302 33.654 7.001 10.819 1.00 0.00 O ATOM 58886 H1 WAT 7302 32.791 7.062 11.230 1.00 0.00 H ATOM 58887 H2 WAT 7302 33.566 6.293 10.181 1.00 0.00 H TER 58889 WAT 7302 ATOM 58889 O WAT 7303 91.639 115.745 28.316 1.00 0.00 O ATOM 58890 H1 WAT 7303 92.470 115.284 28.427 1.00 0.00 H ATOM 58891 H2 WAT 7303 91.492 115.751 27.371 1.00 0.00 H TER 58893 WAT 7303 ATOM 58893 O WAT 7304 74.965 45.933 132.531 1.00 0.00 O ATOM 58894 H1 WAT 7304 75.681 45.396 132.191 1.00 0.00 H ATOM 58895 H2 WAT 7304 74.656 45.458 133.303 1.00 0.00 H TER 58897 WAT 7304 ATOM 58897 O WAT 7305 10.868 81.053 131.980 1.00 0.00 O ATOM 58898 H1 WAT 7305 10.942 80.231 132.464 1.00 0.00 H ATOM 58899 H2 WAT 7305 10.838 80.788 131.061 1.00 0.00 H TER 58901 WAT 7305 ATOM 58901 O WAT 7306 92.292 74.426 135.340 1.00 0.00 O ATOM 58902 H1 WAT 7306 91.341 74.464 135.435 1.00 0.00 H ATOM 58903 H2 WAT 7306 92.443 74.524 134.399 1.00 0.00 H TER 58905 WAT 7306 ATOM 58905 O WAT 7307 73.907 50.100 121.862 1.00 0.00 O ATOM 58906 H1 WAT 7307 74.123 49.493 121.155 1.00 0.00 H ATOM 58907 H2 WAT 7307 74.452 50.869 121.693 1.00 0.00 H TER 58909 WAT 7307 ATOM 58909 O WAT 7308 34.102 33.002 82.873 1.00 0.00 O ATOM 58910 H1 WAT 7308 35.033 33.033 82.654 1.00 0.00 H ATOM 58911 H2 WAT 7308 33.766 33.860 82.611 1.00 0.00 H TER 58913 WAT 7308 ATOM 58913 O WAT 7309 111.599 1.407 5.401 1.00 0.00 O ATOM 58914 H1 WAT 7309 111.046 1.987 5.925 1.00 0.00 H ATOM 58915 H2 WAT 7309 111.564 1.776 4.518 1.00 0.00 H TER 58917 WAT 7309 ATOM 58917 O WAT 7310 75.554 19.386 17.247 1.00 0.00 O ATOM 58918 H1 WAT 7310 74.706 19.827 17.285 1.00 0.00 H ATOM 58919 H2 WAT 7310 75.666 19.006 18.119 1.00 0.00 H TER 58921 WAT 7310 ATOM 58921 O WAT 7311 60.645 118.513 102.037 1.00 0.00 O ATOM 58922 H1 WAT 7311 60.817 118.843 101.155 1.00 0.00 H ATOM 58923 H2 WAT 7311 61.011 117.629 102.038 1.00 0.00 H TER 58925 WAT 7311 ATOM 58925 O WAT 7312 116.513 42.395 3.788 1.00 0.00 O ATOM 58926 H1 WAT 7312 116.384 43.152 4.359 1.00 0.00 H ATOM 58927 H2 WAT 7312 117.347 42.021 4.073 1.00 0.00 H TER 58929 WAT 7312 ATOM 58929 O WAT 7313 72.391 50.140 5.612 1.00 0.00 O ATOM 58930 H1 WAT 7313 72.995 50.084 4.871 1.00 0.00 H ATOM 58931 H2 WAT 7313 71.570 49.775 5.281 1.00 0.00 H TER 58933 WAT 7313 ATOM 58933 O WAT 7314 128.883 145.631 92.039 1.00 0.00 O ATOM 58934 H1 WAT 7314 129.622 145.571 92.643 1.00 0.00 H ATOM 58935 H2 WAT 7314 128.983 144.874 91.461 1.00 0.00 H TER 58937 WAT 7314 ATOM 58937 O WAT 7315 32.727 101.004 153.641 1.00 0.00 O ATOM 58938 H1 WAT 7315 31.800 101.055 153.875 1.00 0.00 H ATOM 58939 H2 WAT 7315 33.188 101.315 154.420 1.00 0.00 H TER 58941 WAT 7315 ATOM 58941 O WAT 7316 63.178 49.131 116.362 1.00 0.00 O ATOM 58942 H1 WAT 7316 63.953 48.624 116.120 1.00 0.00 H ATOM 58943 H2 WAT 7316 63.112 49.029 117.311 1.00 0.00 H TER 58945 WAT 7316 ATOM 58945 O WAT 7317 94.500 79.954 156.531 1.00 0.00 O ATOM 58946 H1 WAT 7317 94.498 79.006 156.666 1.00 0.00 H ATOM 58947 H2 WAT 7317 95.150 80.095 155.842 1.00 0.00 H TER 58949 WAT 7317 ATOM 58949 O WAT 7318 94.655 44.626 88.231 1.00 0.00 O ATOM 58950 H1 WAT 7318 94.833 44.990 87.364 1.00 0.00 H ATOM 58951 H2 WAT 7318 94.799 43.685 88.131 1.00 0.00 H TER 58953 WAT 7318 ATOM 58953 O WAT 7319 45.257 104.491 102.670 1.00 0.00 O ATOM 58954 H1 WAT 7319 44.533 104.288 102.078 1.00 0.00 H ATOM 58955 H2 WAT 7319 44.977 104.148 103.519 1.00 0.00 H TER 58957 WAT 7319 ATOM 58957 O WAT 7320 59.072 40.134 81.969 1.00 0.00 O ATOM 58958 H1 WAT 7320 58.415 39.843 82.601 1.00 0.00 H ATOM 58959 H2 WAT 7320 58.959 41.084 81.927 1.00 0.00 H TER 58961 WAT 7320 ATOM 58961 O WAT 7321 13.149 21.402 8.028 1.00 0.00 O ATOM 58962 H1 WAT 7321 12.868 20.554 8.371 1.00 0.00 H ATOM 58963 H2 WAT 7321 13.078 21.311 7.078 1.00 0.00 H TER 58965 WAT 7321 ATOM 58965 O WAT 7322 79.279 52.668 118.093 1.00 0.00 O ATOM 58966 H1 WAT 7322 79.141 53.348 117.433 1.00 0.00 H ATOM 58967 H2 WAT 7322 79.767 51.985 117.634 1.00 0.00 H TER 58969 WAT 7322 ATOM 58969 O WAT 7323 101.920 79.057 17.822 1.00 0.00 O ATOM 58970 H1 WAT 7323 101.025 79.062 18.161 1.00 0.00 H ATOM 58971 H2 WAT 7323 102.237 79.948 17.969 1.00 0.00 H TER 58973 WAT 7323 ATOM 58973 O WAT 7324 100.738 114.576 146.322 1.00 0.00 O ATOM 58974 H1 WAT 7324 100.970 113.679 146.562 1.00 0.00 H ATOM 58975 H2 WAT 7324 100.681 115.041 147.157 1.00 0.00 H TER 58977 WAT 7324 ATOM 58977 O WAT 7325 60.218 48.762 99.604 1.00 0.00 O ATOM 58978 H1 WAT 7325 60.983 49.318 99.457 1.00 0.00 H ATOM 58979 H2 WAT 7325 59.829 48.656 98.736 1.00 0.00 H TER 58981 WAT 7325 ATOM 58981 O WAT 7326 127.716 81.211 79.009 1.00 0.00 O ATOM 58982 H1 WAT 7326 127.339 81.366 79.874 1.00 0.00 H ATOM 58983 H2 WAT 7326 127.575 80.278 78.850 1.00 0.00 H TER 58985 WAT 7326 ATOM 58985 O WAT 7327 11.000 112.795 140.876 1.00 0.00 O ATOM 58986 H1 WAT 7327 10.304 112.907 141.523 1.00 0.00 H ATOM 58987 H2 WAT 7327 11.810 112.862 141.380 1.00 0.00 H TER 58989 WAT 7327 ATOM 58989 O WAT 7328 53.419 1.286 140.263 1.00 0.00 O ATOM 58990 H1 WAT 7328 54.057 1.427 139.563 1.00 0.00 H ATOM 58991 H2 WAT 7328 53.329 0.335 140.318 1.00 0.00 H TER 58993 WAT 7328 ATOM 58993 O WAT 7329 117.078 140.371 106.011 1.00 0.00 O ATOM 58994 H1 WAT 7329 117.624 140.603 105.260 1.00 0.00 H ATOM 58995 H2 WAT 7329 117.315 141.007 106.686 1.00 0.00 H TER 58997 WAT 7329 ATOM 58997 O WAT 7330 10.112 50.761 135.377 1.00 0.00 O ATOM 58998 H1 WAT 7330 10.269 50.347 136.225 1.00 0.00 H ATOM 58999 H2 WAT 7330 10.962 51.120 135.125 1.00 0.00 H TER 59001 WAT 7330 ATOM 59001 O WAT 7331 40.301 124.741 97.409 1.00 0.00 O ATOM 59002 H1 WAT 7331 40.748 125.309 98.036 1.00 0.00 H ATOM 59003 H2 WAT 7331 39.822 125.344 96.840 1.00 0.00 H TER 59005 WAT 7331 ATOM 59005 O WAT 7332 27.809 73.105 64.115 1.00 0.00 O ATOM 59006 H1 WAT 7332 27.267 73.861 64.343 1.00 0.00 H ATOM 59007 H2 WAT 7332 27.897 73.153 63.163 1.00 0.00 H TER 59009 WAT 7332 ATOM 59009 O WAT 7333 84.070 6.818 81.127 1.00 0.00 O ATOM 59010 H1 WAT 7333 84.971 6.799 80.806 1.00 0.00 H ATOM 59011 H2 WAT 7333 83.925 7.729 81.382 1.00 0.00 H TER 59013 WAT 7333 ATOM 59013 O WAT 7334 2.290 25.048 138.971 1.00 0.00 O ATOM 59014 H1 WAT 7334 1.476 25.444 139.281 1.00 0.00 H ATOM 59015 H2 WAT 7334 2.961 25.707 139.150 1.00 0.00 H TER 59017 WAT 7334 ATOM 59017 O WAT 7335 121.541 16.027 23.906 1.00 0.00 O ATOM 59018 H1 WAT 7335 120.962 16.662 24.327 1.00 0.00 H ATOM 59019 H2 WAT 7335 121.437 15.228 24.422 1.00 0.00 H TER 59021 WAT 7335 ATOM 59021 O WAT 7336 64.674 120.385 120.396 1.00 0.00 O ATOM 59022 H1 WAT 7336 64.704 121.264 120.016 1.00 0.00 H ATOM 59023 H2 WAT 7336 63.947 120.418 121.018 1.00 0.00 H TER 59025 WAT 7336 ATOM 59025 O WAT 7337 74.509 26.774 96.731 1.00 0.00 O ATOM 59026 H1 WAT 7337 74.542 27.570 97.261 1.00 0.00 H ATOM 59027 H2 WAT 7337 74.502 27.088 95.827 1.00 0.00 H TER 59029 WAT 7337 ATOM 59029 O WAT 7338 103.929 124.711 136.747 1.00 0.00 O ATOM 59030 H1 WAT 7338 103.646 125.490 137.225 1.00 0.00 H ATOM 59031 H2 WAT 7338 103.119 124.327 136.412 1.00 0.00 H TER 59033 WAT 7338 ATOM 59033 O WAT 7339 112.387 74.036 68.764 1.00 0.00 O ATOM 59034 H1 WAT 7339 112.045 73.144 68.711 1.00 0.00 H ATOM 59035 H2 WAT 7339 111.632 74.568 69.014 1.00 0.00 H TER 59037 WAT 7339 ATOM 59037 O WAT 7340 56.983 60.872 66.305 1.00 0.00 O ATOM 59038 H1 WAT 7340 57.632 60.216 66.048 1.00 0.00 H ATOM 59039 H2 WAT 7340 56.145 60.411 66.255 1.00 0.00 H TER 59041 WAT 7340 ATOM 59041 O WAT 7341 77.910 36.207 148.611 1.00 0.00 O ATOM 59042 H1 WAT 7341 78.250 37.008 149.011 1.00 0.00 H ATOM 59043 H2 WAT 7341 77.706 36.458 147.710 1.00 0.00 H TER 59045 WAT 7341 ATOM 59045 O WAT 7342 107.019 5.575 82.132 1.00 0.00 O ATOM 59046 H1 WAT 7342 107.001 5.380 83.070 1.00 0.00 H ATOM 59047 H2 WAT 7342 107.809 6.102 82.012 1.00 0.00 H TER 59049 WAT 7342 ATOM 59049 O WAT 7343 137.819 45.562 150.166 1.00 0.00 O ATOM 59050 H1 WAT 7343 137.502 45.530 151.068 1.00 0.00 H ATOM 59051 H2 WAT 7343 137.874 44.645 149.898 1.00 0.00 H TER 59053 WAT 7343 ATOM 59053 O WAT 7344 83.378 35.997 132.228 1.00 0.00 O ATOM 59054 H1 WAT 7344 82.892 36.423 132.934 1.00 0.00 H ATOM 59055 H2 WAT 7344 83.411 35.075 132.484 1.00 0.00 H TER 59057 WAT 7344 ATOM 59057 O WAT 7345 103.917 110.843 60.640 1.00 0.00 O ATOM 59058 H1 WAT 7345 103.329 110.936 61.390 1.00 0.00 H ATOM 59059 H2 WAT 7345 104.759 111.173 60.953 1.00 0.00 H TER 59061 WAT 7345 ATOM 59061 O WAT 7346 25.528 118.906 13.400 1.00 0.00 O ATOM 59062 H1 WAT 7346 25.351 119.072 12.474 1.00 0.00 H ATOM 59063 H2 WAT 7346 25.811 119.752 13.746 1.00 0.00 H TER 59065 WAT 7346 ATOM 59065 O WAT 7347 89.984 62.519 70.054 1.00 0.00 O ATOM 59066 H1 WAT 7347 89.196 62.364 70.573 1.00 0.00 H ATOM 59067 H2 WAT 7347 90.459 61.689 70.085 1.00 0.00 H TER 59069 WAT 7347 ATOM 59069 O WAT 7348 60.182 20.469 98.735 1.00 0.00 O ATOM 59070 H1 WAT 7348 59.415 20.450 98.162 1.00 0.00 H ATOM 59071 H2 WAT 7348 60.873 20.856 98.197 1.00 0.00 H TER 59073 WAT 7348 ATOM 59073 O WAT 7349 77.576 33.546 59.941 1.00 0.00 O ATOM 59074 H1 WAT 7349 76.702 33.636 59.562 1.00 0.00 H ATOM 59075 H2 WAT 7349 77.762 32.608 59.894 1.00 0.00 H TER 59077 WAT 7349 ATOM 59077 O WAT 7350 106.624 90.765 13.051 1.00 0.00 O ATOM 59078 H1 WAT 7350 107.481 91.135 12.838 1.00 0.00 H ATOM 59079 H2 WAT 7350 106.608 90.732 14.007 1.00 0.00 H TER 59081 WAT 7350 ATOM 59081 O WAT 7351 25.632 30.639 10.969 1.00 0.00 O ATOM 59082 H1 WAT 7351 25.271 30.064 11.644 1.00 0.00 H ATOM 59083 H2 WAT 7351 24.895 30.810 10.382 1.00 0.00 H TER 59085 WAT 7351 ATOM 59085 O WAT 7352 21.186 50.945 92.645 1.00 0.00 O ATOM 59086 H1 WAT 7352 21.248 51.133 91.709 1.00 0.00 H ATOM 59087 H2 WAT 7352 21.343 50.003 92.711 1.00 0.00 H TER 59089 WAT 7352 ATOM 59089 O WAT 7353 92.703 94.017 152.833 1.00 0.00 O ATOM 59090 H1 WAT 7353 92.195 93.521 152.190 1.00 0.00 H ATOM 59091 H2 WAT 7353 92.045 94.489 153.344 1.00 0.00 H TER 59093 WAT 7353 ATOM 59093 O WAT 7354 90.803 71.330 84.486 1.00 0.00 O ATOM 59094 H1 WAT 7354 91.688 71.543 84.783 1.00 0.00 H ATOM 59095 H2 WAT 7354 90.229 71.742 85.131 1.00 0.00 H TER 59097 WAT 7354 ATOM 59097 O WAT 7355 83.093 133.210 151.991 1.00 0.00 O ATOM 59098 H1 WAT 7355 82.141 133.130 151.928 1.00 0.00 H ATOM 59099 H2 WAT 7355 83.271 133.227 152.931 1.00 0.00 H TER 59101 WAT 7355 ATOM 59101 O WAT 7356 29.496 111.191 108.678 1.00 0.00 O ATOM 59102 H1 WAT 7356 30.430 111.333 108.521 1.00 0.00 H ATOM 59103 H2 WAT 7356 29.062 111.623 107.942 1.00 0.00 H TER 59105 WAT 7356 ATOM 59105 O WAT 7357 2.175 68.193 5.611 1.00 0.00 O ATOM 59106 H1 WAT 7357 3.102 68.431 5.646 1.00 0.00 H ATOM 59107 H2 WAT 7357 1.998 67.795 6.463 1.00 0.00 H TER 59109 WAT 7357 ATOM 59109 O WAT 7358 123.366 64.300 24.201 1.00 0.00 O ATOM 59110 H1 WAT 7358 123.692 64.829 24.930 1.00 0.00 H ATOM 59111 H2 WAT 7358 124.156 63.991 23.758 1.00 0.00 H TER 59113 WAT 7358 ATOM 59113 O WAT 7359 49.122 40.737 4.708 1.00 0.00 O ATOM 59114 H1 WAT 7359 48.359 41.316 4.713 1.00 0.00 H ATOM 59115 H2 WAT 7359 49.549 40.896 5.549 1.00 0.00 H TER 59117 WAT 7359 ATOM 59117 O WAT 7360 40.456 141.957 102.046 1.00 0.00 O ATOM 59118 H1 WAT 7360 41.315 141.686 102.369 1.00 0.00 H ATOM 59119 H2 WAT 7360 40.468 142.912 102.107 1.00 0.00 H TER 59121 WAT 7360 ATOM 59121 O WAT 7361 35.190 128.106 134.494 1.00 0.00 O ATOM 59122 H1 WAT 7361 36.072 127.958 134.835 1.00 0.00 H ATOM 59123 H2 WAT 7361 35.249 127.875 133.567 1.00 0.00 H TER 59125 WAT 7361 ATOM 59125 O WAT 7362 23.256 131.544 136.558 1.00 0.00 O ATOM 59126 H1 WAT 7362 23.734 130.891 136.047 1.00 0.00 H ATOM 59127 H2 WAT 7362 22.835 131.041 137.256 1.00 0.00 H TER 59129 WAT 7362 ATOM 59129 O WAT 7363 108.997 23.029 103.470 1.00 0.00 O ATOM 59130 H1 WAT 7363 108.450 23.146 104.247 1.00 0.00 H ATOM 59131 H2 WAT 7363 108.586 23.578 102.803 1.00 0.00 H TER 59133 WAT 7363 ATOM 59133 O WAT 7364 80.191 73.541 137.661 1.00 0.00 O ATOM 59134 H1 WAT 7364 80.253 73.030 138.469 1.00 0.00 H ATOM 59135 H2 WAT 7364 79.866 72.920 137.010 1.00 0.00 H TER 59137 WAT 7364 ATOM 59137 O WAT 7365 76.753 54.070 125.900 1.00 0.00 O ATOM 59138 H1 WAT 7365 76.912 53.324 125.321 1.00 0.00 H ATOM 59139 H2 WAT 7365 75.883 53.907 126.266 1.00 0.00 H TER 59141 WAT 7365 ATOM 59141 O WAT 7366 94.089 119.420 108.715 1.00 0.00 O ATOM 59142 H1 WAT 7366 93.443 118.759 108.965 1.00 0.00 H ATOM 59143 H2 WAT 7366 94.169 119.329 107.765 1.00 0.00 H TER 59145 WAT 7366 ATOM 59145 O WAT 7367 16.568 37.718 122.132 1.00 0.00 O ATOM 59146 H1 WAT 7367 17.325 37.293 121.728 1.00 0.00 H ATOM 59147 H2 WAT 7367 15.949 37.006 122.291 1.00 0.00 H TER 59149 WAT 7367 ATOM 59149 O WAT 7368 34.877 13.034 4.520 1.00 0.00 O ATOM 59150 H1 WAT 7368 34.441 12.464 3.886 1.00 0.00 H ATOM 59151 H2 WAT 7368 34.860 13.901 4.114 1.00 0.00 H TER 59153 WAT 7368 ATOM 59153 O WAT 7369 35.312 119.758 147.672 1.00 0.00 O ATOM 59154 H1 WAT 7369 34.448 119.690 147.265 1.00 0.00 H ATOM 59155 H2 WAT 7369 35.607 120.644 147.461 1.00 0.00 H TER 59157 WAT 7369 ATOM 59157 O WAT 7370 94.809 136.163 12.657 1.00 0.00 O ATOM 59158 H1 WAT 7370 95.399 136.405 13.372 1.00 0.00 H ATOM 59159 H2 WAT 7370 94.753 135.209 12.705 1.00 0.00 H TER 59161 WAT 7370 ATOM 59161 O WAT 7371 99.850 137.444 135.066 1.00 0.00 O ATOM 59162 H1 WAT 7371 99.044 136.934 134.992 1.00 0.00 H ATOM 59163 H2 WAT 7371 99.830 138.034 134.313 1.00 0.00 H TER 59165 WAT 7371 ATOM 59165 O WAT 7372 92.368 52.852 145.939 1.00 0.00 O ATOM 59166 H1 WAT 7372 92.108 52.010 146.311 1.00 0.00 H ATOM 59167 H2 WAT 7372 92.102 52.800 145.020 1.00 0.00 H TER 59169 WAT 7372 ATOM 59169 O WAT 7373 19.627 54.094 116.781 1.00 0.00 O ATOM 59170 H1 WAT 7373 19.177 54.141 117.625 1.00 0.00 H ATOM 59171 H2 WAT 7373 19.841 53.167 116.675 1.00 0.00 H TER 59173 WAT 7373 ATOM 59173 O WAT 7374 108.300 24.243 95.214 1.00 0.00 O ATOM 59174 H1 WAT 7374 108.796 24.627 94.491 1.00 0.00 H ATOM 59175 H2 WAT 7374 108.230 23.315 94.991 1.00 0.00 H TER 59177 WAT 7374 ATOM 59177 O WAT 7375 43.106 2.983 12.963 1.00 0.00 O ATOM 59178 H1 WAT 7375 44.058 3.077 12.923 1.00 0.00 H ATOM 59179 H2 WAT 7375 42.945 2.529 13.791 1.00 0.00 H TER 59181 WAT 7375 ATOM 59181 O WAT 7376 139.657 129.892 76.529 1.00 0.00 O ATOM 59182 H1 WAT 7376 139.470 130.181 77.422 1.00 0.00 H ATOM 59183 H2 WAT 7376 138.797 129.708 76.152 1.00 0.00 H TER 59185 WAT 7376 ATOM 59185 O WAT 7377 36.609 52.436 111.687 1.00 0.00 O ATOM 59186 H1 WAT 7377 37.490 52.375 111.317 1.00 0.00 H ATOM 59187 H2 WAT 7377 36.680 53.110 112.362 1.00 0.00 H TER 59189 WAT 7377 ATOM 59189 O WAT 7378 134.977 66.161 157.534 1.00 0.00 O ATOM 59190 H1 WAT 7378 134.882 65.246 157.268 1.00 0.00 H ATOM 59191 H2 WAT 7378 135.921 66.320 157.510 1.00 0.00 H TER 59193 WAT 7378 ATOM 59193 O WAT 7379 47.019 74.111 74.594 1.00 0.00 O ATOM 59194 H1 WAT 7379 47.845 73.829 74.200 1.00 0.00 H ATOM 59195 H2 WAT 7379 46.749 74.865 74.070 1.00 0.00 H TER 59197 WAT 7379 ATOM 59197 O WAT 7380 92.648 22.642 59.266 1.00 0.00 O ATOM 59198 H1 WAT 7380 92.297 22.367 58.419 1.00 0.00 H ATOM 59199 H2 WAT 7380 93.538 22.290 59.283 1.00 0.00 H TER 59201 WAT 7380 ATOM 59201 O WAT 7381 114.419 11.097 142.268 1.00 0.00 O ATOM 59202 H1 WAT 7381 114.809 11.480 141.482 1.00 0.00 H ATOM 59203 H2 WAT 7381 114.974 11.404 142.985 1.00 0.00 H TER 59205 WAT 7381 ATOM 59205 O WAT 7382 98.207 21.988 106.255 1.00 0.00 O ATOM 59206 H1 WAT 7382 98.805 22.379 105.617 1.00 0.00 H ATOM 59207 H2 WAT 7382 97.365 21.948 105.801 1.00 0.00 H TER 59209 WAT 7382 ATOM 59209 O WAT 7383 115.916 61.100 69.247 1.00 0.00 O ATOM 59210 H1 WAT 7383 116.350 60.649 69.972 1.00 0.00 H ATOM 59211 H2 WAT 7383 116.381 61.933 69.170 1.00 0.00 H TER 59213 WAT 7383 ATOM 59213 O WAT 7384 117.133 59.465 0.894 1.00 0.00 O ATOM 59214 H1 WAT 7384 117.934 59.380 1.411 1.00 0.00 H ATOM 59215 H2 WAT 7384 116.495 58.916 1.350 1.00 0.00 H TER 59217 WAT 7384 ATOM 59217 O WAT 7385 77.765 127.129 96.614 1.00 0.00 O ATOM 59218 H1 WAT 7385 78.049 126.375 97.130 1.00 0.00 H ATOM 59219 H2 WAT 7385 77.550 126.765 95.755 1.00 0.00 H TER 59221 WAT 7385 ATOM 59221 O WAT 7386 98.039 93.866 77.481 1.00 0.00 O ATOM 59222 H1 WAT 7386 97.899 93.333 76.698 1.00 0.00 H ATOM 59223 H2 WAT 7386 98.223 94.743 77.144 1.00 0.00 H TER 59225 WAT 7386 ATOM 59225 O WAT 7387 104.522 108.184 18.618 1.00 0.00 O ATOM 59226 H1 WAT 7387 104.751 107.312 18.298 1.00 0.00 H ATOM 59227 H2 WAT 7387 103.584 108.134 18.802 1.00 0.00 H TER 59229 WAT 7387 ATOM 59229 O WAT 7388 14.059 10.049 101.005 1.00 0.00 O ATOM 59230 H1 WAT 7388 14.267 9.140 101.218 1.00 0.00 H ATOM 59231 H2 WAT 7388 14.441 10.185 100.137 1.00 0.00 H TER 59233 WAT 7388 ATOM 59233 O WAT 7389 128.214 91.106 1.079 1.00 0.00 O ATOM 59234 H1 WAT 7389 128.980 90.968 0.522 1.00 0.00 H ATOM 59235 H2 WAT 7389 128.118 92.057 1.124 1.00 0.00 H TER 59237 WAT 7389 ATOM 59237 O WAT 7390 55.464 78.702 11.192 1.00 0.00 O ATOM 59238 H1 WAT 7390 54.985 78.039 11.690 1.00 0.00 H ATOM 59239 H2 WAT 7390 54.832 79.409 11.065 1.00 0.00 H TER 59241 WAT 7390 ATOM 59241 O WAT 7391 35.430 54.420 102.184 1.00 0.00 O ATOM 59242 H1 WAT 7391 36.349 54.568 102.408 1.00 0.00 H ATOM 59243 H2 WAT 7391 35.373 53.480 102.013 1.00 0.00 H TER 59245 WAT 7391 ATOM 59245 O WAT 7392 51.009 120.519 111.047 1.00 0.00 O ATOM 59246 H1 WAT 7392 51.915 120.454 111.349 1.00 0.00 H ATOM 59247 H2 WAT 7392 50.516 119.960 111.648 1.00 0.00 H TER 59249 WAT 7392 ATOM 59249 O WAT 7393 17.308 132.488 128.749 1.00 0.00 O ATOM 59250 H1 WAT 7393 17.694 132.431 129.623 1.00 0.00 H ATOM 59251 H2 WAT 7393 16.592 131.853 128.761 1.00 0.00 H TER 59253 WAT 7393 ATOM 59253 O WAT 7394 34.817 127.919 151.438 1.00 0.00 O ATOM 59254 H1 WAT 7394 34.194 127.284 151.085 1.00 0.00 H ATOM 59255 H2 WAT 7394 34.500 128.765 151.122 1.00 0.00 H TER 59257 WAT 7394 ATOM 59257 O WAT 7395 40.993 20.277 8.305 1.00 0.00 O ATOM 59258 H1 WAT 7395 40.276 20.606 7.763 1.00 0.00 H ATOM 59259 H2 WAT 7395 41.746 20.247 7.715 1.00 0.00 H TER 59261 WAT 7395 ATOM 59261 O WAT 7396 72.707 80.993 74.305 1.00 0.00 O ATOM 59262 H1 WAT 7396 73.522 81.267 74.726 1.00 0.00 H ATOM 59263 H2 WAT 7396 72.168 80.658 75.022 1.00 0.00 H TER 59265 WAT 7396 ATOM 59265 O WAT 7397 42.915 48.813 103.110 1.00 0.00 O ATOM 59266 H1 WAT 7397 42.978 49.143 102.213 1.00 0.00 H ATOM 59267 H2 WAT 7397 42.470 49.511 103.591 1.00 0.00 H TER 59269 WAT 7397 ATOM 59269 O WAT 7398 115.276 143.087 151.252 1.00 0.00 O ATOM 59270 H1 WAT 7398 115.018 143.764 150.626 1.00 0.00 H ATOM 59271 H2 WAT 7398 116.222 143.199 151.349 1.00 0.00 H TER 59273 WAT 7398 ATOM 59273 O WAT 7399 6.534 38.124 103.326 1.00 0.00 O ATOM 59274 H1 WAT 7399 6.788 39.046 103.282 1.00 0.00 H ATOM 59275 H2 WAT 7399 7.159 37.676 102.755 1.00 0.00 H TER 59277 WAT 7399 ATOM 59277 O WAT 7400 141.024 88.136 150.718 1.00 0.00 O ATOM 59278 H1 WAT 7400 141.891 88.483 150.930 1.00 0.00 H ATOM 59279 H2 WAT 7400 140.414 88.756 151.117 1.00 0.00 H TER 59281 WAT 7400 ATOM 59281 O WAT 7401 117.960 25.076 21.163 1.00 0.00 O ATOM 59282 H1 WAT 7401 118.739 25.607 21.331 1.00 0.00 H ATOM 59283 H2 WAT 7401 117.405 25.215 21.931 1.00 0.00 H TER 59285 WAT 7401 ATOM 59285 O WAT 7402 115.191 64.542 98.274 1.00 0.00 O ATOM 59286 H1 WAT 7402 115.496 64.555 97.366 1.00 0.00 H ATOM 59287 H2 WAT 7402 114.685 63.733 98.345 1.00 0.00 H TER 59289 WAT 7402 ATOM 59289 O WAT 7403 11.961 28.242 140.863 1.00 0.00 O ATOM 59290 H1 WAT 7403 11.054 27.937 140.852 1.00 0.00 H ATOM 59291 H2 WAT 7403 12.042 28.722 141.687 1.00 0.00 H TER 59293 WAT 7403 ATOM 59293 O WAT 7404 43.199 113.068 75.731 1.00 0.00 O ATOM 59294 H1 WAT 7404 44.127 113.065 75.500 1.00 0.00 H ATOM 59295 H2 WAT 7404 42.929 112.153 75.651 1.00 0.00 H TER 59297 WAT 7404 ATOM 59297 O WAT 7405 126.824 15.092 149.761 1.00 0.00 O ATOM 59298 H1 WAT 7405 126.849 15.573 148.934 1.00 0.00 H ATOM 59299 H2 WAT 7405 127.195 14.235 149.552 1.00 0.00 H TER 59301 WAT 7405 ATOM 59301 O WAT 7406 94.388 98.825 89.404 1.00 0.00 O ATOM 59302 H1 WAT 7406 94.415 99.150 88.504 1.00 0.00 H ATOM 59303 H2 WAT 7406 94.685 99.564 89.935 1.00 0.00 H TER 59305 WAT 7406 ATOM 59305 O WAT 7407 108.809 97.588 90.773 1.00 0.00 O ATOM 59306 H1 WAT 7407 109.729 97.374 90.931 1.00 0.00 H ATOM 59307 H2 WAT 7407 108.655 97.327 89.865 1.00 0.00 H TER 59309 WAT 7407 ATOM 59309 O WAT 7408 119.570 81.762 85.596 1.00 0.00 O ATOM 59310 H1 WAT 7408 120.476 81.485 85.458 1.00 0.00 H ATOM 59311 H2 WAT 7408 119.395 82.376 84.883 1.00 0.00 H TER 59313 WAT 7408 ATOM 59313 O WAT 7409 85.745 44.277 82.294 1.00 0.00 O ATOM 59314 H1 WAT 7409 85.377 44.698 83.071 1.00 0.00 H ATOM 59315 H2 WAT 7409 86.164 43.484 82.627 1.00 0.00 H TER 59317 WAT 7409 ATOM 59317 O WAT 7410 142.648 99.500 138.010 1.00 0.00 O ATOM 59318 H1 WAT 7410 142.570 98.701 138.531 1.00 0.00 H ATOM 59319 H2 WAT 7410 143.343 99.999 138.440 1.00 0.00 H TER 59321 WAT 7410 ATOM 59321 O WAT 7411 124.156 15.772 127.207 1.00 0.00 O ATOM 59322 H1 WAT 7411 124.430 14.937 127.586 1.00 0.00 H ATOM 59323 H2 WAT 7411 123.200 15.752 127.248 1.00 0.00 H TER 59325 WAT 7411 ATOM 59325 O WAT 7412 57.184 8.708 114.741 1.00 0.00 O ATOM 59326 H1 WAT 7412 57.173 8.346 115.627 1.00 0.00 H ATOM 59327 H2 WAT 7412 58.072 9.050 114.633 1.00 0.00 H TER 59329 WAT 7412 ATOM 59329 O WAT 7413 28.840 89.203 69.835 1.00 0.00 O ATOM 59330 H1 WAT 7413 29.220 88.336 69.973 1.00 0.00 H ATOM 59331 H2 WAT 7413 27.897 89.069 69.927 1.00 0.00 H TER 59333 WAT 7413 ATOM 59333 O WAT 7414 82.395 135.137 96.561 1.00 0.00 O ATOM 59334 H1 WAT 7414 82.347 136.051 96.841 1.00 0.00 H ATOM 59335 H2 WAT 7414 81.523 134.785 96.741 1.00 0.00 H TER 59337 WAT 7414 ATOM 59337 O WAT 7415 5.192 93.603 115.141 1.00 0.00 O ATOM 59338 H1 WAT 7415 6.035 93.284 115.464 1.00 0.00 H ATOM 59339 H2 WAT 7415 5.421 94.248 114.472 1.00 0.00 H TER 59341 WAT 7415 ATOM 59341 O WAT 7416 91.679 75.742 104.494 1.00 0.00 O ATOM 59342 H1 WAT 7416 90.755 75.714 104.740 1.00 0.00 H ATOM 59343 H2 WAT 7416 91.797 76.610 104.106 1.00 0.00 H TER 59345 WAT 7416 ATOM 59345 O WAT 7417 78.817 31.473 152.020 1.00 0.00 O ATOM 59346 H1 WAT 7417 79.500 32.117 151.835 1.00 0.00 H ATOM 59347 H2 WAT 7417 78.114 31.686 151.406 1.00 0.00 H TER 59349 WAT 7417 ATOM 59349 O WAT 7418 14.182 1.305 75.319 1.00 0.00 O ATOM 59350 H1 WAT 7418 14.887 1.950 75.384 1.00 0.00 H ATOM 59351 H2 WAT 7418 13.453 1.700 75.797 1.00 0.00 H TER 59353 WAT 7418 ATOM 59353 O WAT 7419 4.662 142.628 158.310 1.00 0.00 O ATOM 59354 H1 WAT 7419 3.862 142.329 158.742 1.00 0.00 H ATOM 59355 H2 WAT 7419 4.354 143.188 157.597 1.00 0.00 H TER 59357 WAT 7419 ATOM 59357 O WAT 7420 59.065 131.847 58.153 1.00 0.00 O ATOM 59358 H1 WAT 7420 58.916 131.542 59.049 1.00 0.00 H ATOM 59359 H2 WAT 7420 58.218 131.742 57.721 1.00 0.00 H TER 59361 WAT 7420 ATOM 59361 O WAT 7421 98.407 85.269 126.176 1.00 0.00 O ATOM 59362 H1 WAT 7421 98.786 85.256 127.055 1.00 0.00 H ATOM 59363 H2 WAT 7421 98.407 86.193 125.929 1.00 0.00 H TER 59365 WAT 7421 ATOM 59365 O WAT 7422 121.834 1.787 143.828 1.00 0.00 O ATOM 59366 H1 WAT 7422 121.097 2.348 144.071 1.00 0.00 H ATOM 59367 H2 WAT 7422 122.439 1.853 144.567 1.00 0.00 H TER 59369 WAT 7422 ATOM 59369 O WAT 7423 28.438 130.434 81.546 1.00 0.00 O ATOM 59370 H1 WAT 7423 29.287 130.030 81.727 1.00 0.00 H ATOM 59371 H2 WAT 7423 28.394 131.179 82.145 1.00 0.00 H TER 59373 WAT 7423 ATOM 59373 O WAT 7424 50.550 46.694 80.260 1.00 0.00 O ATOM 59374 H1 WAT 7424 50.900 46.378 79.427 1.00 0.00 H ATOM 59375 H2 WAT 7424 49.601 46.693 80.136 1.00 0.00 H TER 59377 WAT 7424 ATOM 59377 O WAT 7425 41.371 140.551 3.832 1.00 0.00 O ATOM 59378 H1 WAT 7425 40.504 140.760 4.181 1.00 0.00 H ATOM 59379 H2 WAT 7425 41.915 141.297 4.083 1.00 0.00 H TER 59381 WAT 7425 ATOM 59381 O WAT 7426 11.519 47.437 138.973 1.00 0.00 O ATOM 59382 H1 WAT 7426 11.782 46.977 138.176 1.00 0.00 H ATOM 59383 H2 WAT 7426 12.276 47.361 139.554 1.00 0.00 H TER 59385 WAT 7426 ATOM 59385 O WAT 7427 24.615 95.305 93.573 1.00 0.00 O ATOM 59386 H1 WAT 7427 24.182 94.464 93.713 1.00 0.00 H ATOM 59387 H2 WAT 7427 23.975 95.955 93.863 1.00 0.00 H TER 59389 WAT 7427 ATOM 59389 O WAT 7428 82.083 8.538 94.599 1.00 0.00 O ATOM 59390 H1 WAT 7428 82.289 8.281 93.700 1.00 0.00 H ATOM 59391 H2 WAT 7428 82.602 9.328 94.747 1.00 0.00 H TER 59393 WAT 7428 ATOM 59393 O WAT 7429 25.910 59.745 83.789 1.00 0.00 O ATOM 59394 H1 WAT 7429 26.566 60.256 83.316 1.00 0.00 H ATOM 59395 H2 WAT 7429 26.224 58.843 83.735 1.00 0.00 H TER 59397 WAT 7429 ATOM 59397 O WAT 7430 68.375 40.256 71.944 1.00 0.00 O ATOM 59398 H1 WAT 7430 67.510 40.107 71.560 1.00 0.00 H ATOM 59399 H2 WAT 7430 68.220 40.262 72.888 1.00 0.00 H TER 59401 WAT 7430 ATOM 59401 O WAT 7431 129.232 134.199 86.151 1.00 0.00 O ATOM 59402 H1 WAT 7431 129.421 133.851 85.279 1.00 0.00 H ATOM 59403 H2 WAT 7431 129.785 134.977 86.223 1.00 0.00 H TER 59405 WAT 7431 ATOM 59405 O WAT 7432 56.317 49.705 7.675 1.00 0.00 O ATOM 59406 H1 WAT 7432 56.533 50.618 7.486 1.00 0.00 H ATOM 59407 H2 WAT 7432 57.134 49.229 7.527 1.00 0.00 H TER 59409 WAT 7432 ATOM 59409 O WAT 7433 98.469 46.328 75.952 1.00 0.00 O ATOM 59410 H1 WAT 7433 98.976 46.851 75.330 1.00 0.00 H ATOM 59411 H2 WAT 7433 98.966 46.381 76.769 1.00 0.00 H TER 59413 WAT 7433 ATOM 59413 O WAT 7434 46.523 16.557 108.561 1.00 0.00 O ATOM 59414 H1 WAT 7434 46.002 15.823 108.885 1.00 0.00 H ATOM 59415 H2 WAT 7434 47.389 16.182 108.396 1.00 0.00 H TER 59417 WAT 7434 ATOM 59417 O WAT 7435 1.955 38.910 4.843 1.00 0.00 O ATOM 59418 H1 WAT 7435 2.644 39.539 5.056 1.00 0.00 H ATOM 59419 H2 WAT 7435 2.138 38.651 3.940 1.00 0.00 H TER 59421 WAT 7435 ATOM 59421 O WAT 7436 54.995 123.043 78.710 1.00 0.00 O ATOM 59422 H1 WAT 7436 54.658 122.823 79.578 1.00 0.00 H ATOM 59423 H2 WAT 7436 55.046 123.999 78.707 1.00 0.00 H TER 59425 WAT 7436 ATOM 59425 O WAT 7437 29.733 104.667 112.721 1.00 0.00 O ATOM 59426 H1 WAT 7437 29.794 105.173 113.532 1.00 0.00 H ATOM 59427 H2 WAT 7437 28.883 104.229 112.776 1.00 0.00 H TER 59429 WAT 7437 ATOM 59429 O WAT 7438 39.305 46.240 158.032 1.00 0.00 O ATOM 59430 H1 WAT 7438 38.780 46.212 157.232 1.00 0.00 H ATOM 59431 H2 WAT 7438 39.397 47.173 158.226 1.00 0.00 H TER 59433 WAT 7438 ATOM 59433 O WAT 7439 116.497 111.716 128.514 1.00 0.00 O ATOM 59434 H1 WAT 7439 116.925 111.218 127.817 1.00 0.00 H ATOM 59435 H2 WAT 7439 115.649 111.962 128.146 1.00 0.00 H TER 59437 WAT 7439 ATOM 59437 O WAT 7440 1.927 133.441 96.431 1.00 0.00 O ATOM 59438 H1 WAT 7440 2.716 133.269 95.918 1.00 0.00 H ATOM 59439 H2 WAT 7440 2.227 133.990 97.155 1.00 0.00 H TER 59441 WAT 7440 ATOM 59441 O WAT 7441 145.382 62.750 103.068 1.00 0.00 O ATOM 59442 H1 WAT 7441 146.303 63.004 103.020 1.00 0.00 H ATOM 59443 H2 WAT 7441 145.400 61.796 103.145 1.00 0.00 H TER 59445 WAT 7441 ATOM 59445 O WAT 7442 108.824 64.381 84.608 1.00 0.00 O ATOM 59446 H1 WAT 7442 108.868 64.131 85.531 1.00 0.00 H ATOM 59447 H2 WAT 7442 109.661 64.096 84.243 1.00 0.00 H TER 59449 WAT 7442 ATOM 59449 O WAT 7443 143.645 33.965 126.987 1.00 0.00 O ATOM 59450 H1 WAT 7443 143.251 33.699 127.817 1.00 0.00 H ATOM 59451 H2 WAT 7443 143.123 33.519 126.320 1.00 0.00 H TER 59453 WAT 7443 ATOM 59453 O WAT 7444 115.905 50.325 155.832 1.00 0.00 O ATOM 59454 H1 WAT 7444 116.450 50.868 155.262 1.00 0.00 H ATOM 59455 H2 WAT 7444 115.719 50.882 156.588 1.00 0.00 H TER 59457 WAT 7444 ATOM 59457 O WAT 7445 139.357 74.357 121.872 1.00 0.00 O ATOM 59458 H1 WAT 7445 139.234 74.737 121.002 1.00 0.00 H ATOM 59459 H2 WAT 7445 138.808 74.891 122.447 1.00 0.00 H TER 59461 WAT 7445 ATOM 59461 O WAT 7446 138.714 132.791 15.555 1.00 0.00 O ATOM 59462 H1 WAT 7446 138.976 133.117 14.695 1.00 0.00 H ATOM 59463 H2 WAT 7446 138.821 133.542 16.139 1.00 0.00 H TER 59465 WAT 7446 ATOM 59465 O WAT 7447 44.453 92.475 14.891 1.00 0.00 O ATOM 59466 H1 WAT 7447 44.887 92.964 14.192 1.00 0.00 H ATOM 59467 H2 WAT 7447 44.677 91.561 14.720 1.00 0.00 H TER 59469 WAT 7447 ATOM 59469 O WAT 7448 105.646 98.631 111.395 1.00 0.00 O ATOM 59470 H1 WAT 7448 105.671 97.926 110.747 1.00 0.00 H ATOM 59471 H2 WAT 7448 104.915 98.403 111.968 1.00 0.00 H TER 59473 WAT 7448 ATOM 59473 O WAT 7449 96.559 12.416 92.978 1.00 0.00 O ATOM 59474 H1 WAT 7449 96.522 13.184 92.408 1.00 0.00 H ATOM 59475 H2 WAT 7449 97.477 12.358 93.243 1.00 0.00 H TER 59477 WAT 7449 ATOM 59477 O WAT 7450 14.554 16.699 112.734 1.00 0.00 O ATOM 59478 H1 WAT 7450 14.863 17.499 113.159 1.00 0.00 H ATOM 59479 H2 WAT 7450 13.617 16.842 112.606 1.00 0.00 H TER 59481 WAT 7450 ATOM 59481 O WAT 7451 30.180 9.365 158.042 1.00 0.00 O ATOM 59482 H1 WAT 7451 30.620 10.051 158.544 1.00 0.00 H ATOM 59483 H2 WAT 7451 30.756 9.209 157.294 1.00 0.00 H TER 59485 WAT 7451 ATOM 59485 O WAT 7452 73.750 56.876 148.191 1.00 0.00 O ATOM 59486 H1 WAT 7452 73.227 56.160 147.829 1.00 0.00 H ATOM 59487 H2 WAT 7452 73.658 57.585 147.555 1.00 0.00 H TER 59489 WAT 7452 ATOM 59489 O WAT 7453 144.125 102.285 128.793 1.00 0.00 O ATOM 59490 H1 WAT 7453 144.111 102.136 129.738 1.00 0.00 H ATOM 59491 H2 WAT 7453 145.036 102.132 128.540 1.00 0.00 H TER 59493 WAT 7453 ATOM 59493 O WAT 7454 28.456 48.746 95.220 1.00 0.00 O ATOM 59494 H1 WAT 7454 28.384 48.354 94.350 1.00 0.00 H ATOM 59495 H2 WAT 7454 27.928 48.180 95.782 1.00 0.00 H TER 59497 WAT 7454 ATOM 59497 O WAT 7455 125.740 103.510 123.913 1.00 0.00 O ATOM 59498 H1 WAT 7455 126.331 104.086 123.428 1.00 0.00 H ATOM 59499 H2 WAT 7455 126.302 102.806 124.235 1.00 0.00 H TER 59501 WAT 7455 ATOM 59501 O WAT 7456 62.728 72.654 133.984 1.00 0.00 O ATOM 59502 H1 WAT 7456 62.103 72.643 133.259 1.00 0.00 H ATOM 59503 H2 WAT 7456 63.312 71.916 133.808 1.00 0.00 H TER 59505 WAT 7456 ATOM 59505 O WAT 7457 6.441 118.116 139.836 1.00 0.00 O ATOM 59506 H1 WAT 7457 6.854 117.310 140.144 1.00 0.00 H ATOM 59507 H2 WAT 7457 6.869 118.811 140.335 1.00 0.00 H TER 59509 WAT 7457 ATOM 59509 O WAT 7458 121.687 56.953 158.261 1.00 0.00 O ATOM 59510 H1 WAT 7458 121.456 56.499 157.450 1.00 0.00 H ATOM 59511 H2 WAT 7458 122.160 56.299 158.775 1.00 0.00 H TER 59513 WAT 7458 ATOM 59513 O WAT 7459 39.795 53.144 16.364 1.00 0.00 O ATOM 59514 H1 WAT 7459 39.837 54.081 16.555 1.00 0.00 H ATOM 59515 H2 WAT 7459 40.150 53.065 15.478 1.00 0.00 H TER 59517 WAT 7459 ATOM 59517 O WAT 7460 66.817 109.678 147.573 1.00 0.00 O ATOM 59518 H1 WAT 7460 67.432 109.951 148.254 1.00 0.00 H ATOM 59519 H2 WAT 7460 67.138 108.821 147.291 1.00 0.00 H TER 59521 WAT 7460 ATOM 59521 O WAT 7461 86.408 125.420 117.187 1.00 0.00 O ATOM 59522 H1 WAT 7461 85.840 126.129 116.888 1.00 0.00 H ATOM 59523 H2 WAT 7461 85.989 125.097 117.984 1.00 0.00 H TER 59525 WAT 7461 ATOM 59525 O WAT 7462 87.490 48.748 157.490 1.00 0.00 O ATOM 59526 H1 WAT 7462 87.366 49.675 157.287 1.00 0.00 H ATOM 59527 H2 WAT 7462 87.375 48.693 158.438 1.00 0.00 H TER 59529 WAT 7462 ATOM 59529 O WAT 7463 74.352 48.492 94.521 1.00 0.00 O ATOM 59530 H1 WAT 7463 73.631 47.989 94.900 1.00 0.00 H ATOM 59531 H2 WAT 7463 74.684 47.939 93.814 1.00 0.00 H TER 59533 WAT 7463 ATOM 59533 O WAT 7464 63.986 139.018 154.095 1.00 0.00 O ATOM 59534 H1 WAT 7464 64.134 139.066 155.039 1.00 0.00 H ATOM 59535 H2 WAT 7464 63.037 139.100 153.997 1.00 0.00 H TER 59537 WAT 7464 ATOM 59537 O WAT 7465 6.729 70.861 125.697 1.00 0.00 O ATOM 59538 H1 WAT 7465 6.761 71.283 124.838 1.00 0.00 H ATOM 59539 H2 WAT 7465 7.644 70.680 125.909 1.00 0.00 H TER 59541 WAT 7465 ATOM 59541 O WAT 7466 51.246 98.537 65.394 1.00 0.00 O ATOM 59542 H1 WAT 7466 51.151 99.048 66.198 1.00 0.00 H ATOM 59543 H2 WAT 7466 50.874 99.095 64.711 1.00 0.00 H TER 59545 WAT 7466 ATOM 59545 O WAT 7467 100.779 24.540 151.014 1.00 0.00 O ATOM 59546 H1 WAT 7467 101.298 25.343 151.076 1.00 0.00 H ATOM 59547 H2 WAT 7467 100.941 24.218 150.127 1.00 0.00 H TER 59549 WAT 7467 ATOM 59549 O WAT 7468 16.984 128.318 139.467 1.00 0.00 O ATOM 59550 H1 WAT 7468 16.564 128.762 138.730 1.00 0.00 H ATOM 59551 H2 WAT 7468 17.154 127.432 139.148 1.00 0.00 H TER 59553 WAT 7468 ATOM 59553 O WAT 7469 80.991 135.872 130.707 1.00 0.00 O ATOM 59554 H1 WAT 7469 81.395 136.560 131.235 1.00 0.00 H ATOM 59555 H2 WAT 7469 81.064 135.083 131.245 1.00 0.00 H TER 59557 WAT 7469 ATOM 59557 O WAT 7470 137.244 67.749 121.638 1.00 0.00 O ATOM 59558 H1 WAT 7470 136.306 67.773 121.448 1.00 0.00 H ATOM 59559 H2 WAT 7470 137.578 68.581 121.301 1.00 0.00 H TER 59561 WAT 7470 ATOM 59561 O WAT 7471 95.552 81.958 124.896 1.00 0.00 O ATOM 59562 H1 WAT 7471 94.631 82.220 124.873 1.00 0.00 H ATOM 59563 H2 WAT 7471 95.532 81.035 125.149 1.00 0.00 H TER 59565 WAT 7471 ATOM 59565 O WAT 7472 28.801 43.824 67.749 1.00 0.00 O ATOM 59566 H1 WAT 7472 28.565 42.918 67.949 1.00 0.00 H ATOM 59567 H2 WAT 7472 29.184 43.784 66.873 1.00 0.00 H TER 59569 WAT 7472 ATOM 59569 O WAT 7473 7.765 12.680 123.778 1.00 0.00 O ATOM 59570 H1 WAT 7473 8.235 13.330 124.300 1.00 0.00 H ATOM 59571 H2 WAT 7473 8.266 11.873 123.892 1.00 0.00 H TER 59573 WAT 7473 ATOM 59573 O WAT 7474 145.460 98.300 121.570 1.00 0.00 O ATOM 59574 H1 WAT 7474 144.795 97.640 121.373 1.00 0.00 H ATOM 59575 H2 WAT 7474 146.255 97.971 121.150 1.00 0.00 H TER 59577 WAT 7474 ATOM 59577 O WAT 7475 30.222 63.694 143.159 1.00 0.00 O ATOM 59578 H1 WAT 7475 30.604 64.162 143.902 1.00 0.00 H ATOM 59579 H2 WAT 7475 29.381 64.126 143.011 1.00 0.00 H TER 59581 WAT 7475 ATOM 59581 O WAT 7476 70.596 84.245 125.307 1.00 0.00 O ATOM 59582 H1 WAT 7476 69.986 84.630 124.678 1.00 0.00 H ATOM 59583 H2 WAT 7476 71.100 84.988 125.637 1.00 0.00 H TER 59585 WAT 7476 ATOM 59585 O WAT 7477 61.702 61.179 71.714 1.00 0.00 O ATOM 59586 H1 WAT 7477 62.577 60.795 71.778 1.00 0.00 H ATOM 59587 H2 WAT 7477 61.161 60.482 71.345 1.00 0.00 H TER 59589 WAT 7477 ATOM 59589 O WAT 7478 115.046 52.892 105.353 1.00 0.00 O ATOM 59590 H1 WAT 7478 115.970 53.064 105.535 1.00 0.00 H ATOM 59591 H2 WAT 7478 114.693 53.742 105.088 1.00 0.00 H TER 59593 WAT 7478 ATOM 59593 O WAT 7479 96.683 67.134 20.195 1.00 0.00 O ATOM 59594 H1 WAT 7479 96.188 66.605 20.821 1.00 0.00 H ATOM 59595 H2 WAT 7479 97.553 66.736 20.181 1.00 0.00 H TER 59597 WAT 7479 ATOM 59597 O WAT 7480 34.012 87.691 13.698 1.00 0.00 O ATOM 59598 H1 WAT 7480 33.536 88.290 14.274 1.00 0.00 H ATOM 59599 H2 WAT 7480 34.227 86.943 14.256 1.00 0.00 H TER 59601 WAT 7480 ATOM 59601 O WAT 7481 21.681 69.933 157.271 1.00 0.00 O ATOM 59602 H1 WAT 7481 21.009 70.614 157.286 1.00 0.00 H ATOM 59603 H2 WAT 7481 21.338 69.246 157.842 1.00 0.00 H TER 59605 WAT 7481 ATOM 59605 O WAT 7482 115.024 113.150 98.264 1.00 0.00 O ATOM 59606 H1 WAT 7482 115.846 113.063 97.782 1.00 0.00 H ATOM 59607 H2 WAT 7482 114.740 114.049 98.095 1.00 0.00 H TER 59609 WAT 7482 ATOM 59609 O WAT 7483 53.985 140.001 65.660 1.00 0.00 O ATOM 59610 H1 WAT 7483 54.375 140.415 66.430 1.00 0.00 H ATOM 59611 H2 WAT 7483 53.043 140.020 65.828 1.00 0.00 H TER 59613 WAT 7483 ATOM 59613 O WAT 7484 18.266 40.715 119.840 1.00 0.00 O ATOM 59614 H1 WAT 7484 17.642 40.989 120.512 1.00 0.00 H ATOM 59615 H2 WAT 7484 18.148 39.768 119.775 1.00 0.00 H TER 59617 WAT 7484 ATOM 59617 O WAT 7485 104.226 92.577 101.254 1.00 0.00 O ATOM 59618 H1 WAT 7485 104.185 92.690 102.204 1.00 0.00 H ATOM 59619 H2 WAT 7485 103.529 91.951 101.057 1.00 0.00 H TER 59621 WAT 7485 ATOM 59621 O WAT 7486 47.348 59.126 73.687 1.00 0.00 O ATOM 59622 H1 WAT 7486 47.187 60.054 73.514 1.00 0.00 H ATOM 59623 H2 WAT 7486 48.278 59.005 73.498 1.00 0.00 H TER 59625 WAT 7486 ATOM 59625 O WAT 7487 123.080 132.149 10.298 1.00 0.00 O ATOM 59626 H1 WAT 7487 123.205 131.267 10.647 1.00 0.00 H ATOM 59627 H2 WAT 7487 123.850 132.635 10.592 1.00 0.00 H TER 59629 WAT 7487 ATOM 59629 O WAT 7488 34.307 6.106 66.243 1.00 0.00 O ATOM 59630 H1 WAT 7488 33.365 6.140 66.410 1.00 0.00 H ATOM 59631 H2 WAT 7488 34.499 6.928 65.790 1.00 0.00 H TER 59633 WAT 7488 ATOM 59633 O WAT 7489 83.258 93.434 137.958 1.00 0.00 O ATOM 59634 H1 WAT 7489 83.265 94.322 138.316 1.00 0.00 H ATOM 59635 H2 WAT 7489 84.043 93.390 137.412 1.00 0.00 H TER 59637 WAT 7489 ATOM 59637 O WAT 7490 27.031 87.031 97.062 1.00 0.00 O ATOM 59638 H1 WAT 7490 27.847 87.527 97.133 1.00 0.00 H ATOM 59639 H2 WAT 7490 27.297 86.117 97.161 1.00 0.00 H TER 59641 WAT 7490 ATOM 59641 O WAT 7491 89.115 87.035 65.590 1.00 0.00 O ATOM 59642 H1 WAT 7491 89.203 87.412 66.466 1.00 0.00 H ATOM 59643 H2 WAT 7491 88.469 86.337 65.693 1.00 0.00 H TER 59645 WAT 7491 ATOM 59645 O WAT 7492 144.499 5.318 70.473 1.00 0.00 O ATOM 59646 H1 WAT 7492 145.034 5.989 70.047 1.00 0.00 H ATOM 59647 H2 WAT 7492 144.473 5.581 71.393 1.00 0.00 H TER 59649 WAT 7492 ATOM 59649 O WAT 7493 97.612 75.938 25.327 1.00 0.00 O ATOM 59650 H1 WAT 7493 96.920 76.312 25.872 1.00 0.00 H ATOM 59651 H2 WAT 7493 97.630 75.011 25.564 1.00 0.00 H TER 59653 WAT 7493 ATOM 59653 O WAT 7494 114.713 74.770 145.082 1.00 0.00 O ATOM 59654 H1 WAT 7494 114.498 74.265 145.866 1.00 0.00 H ATOM 59655 H2 WAT 7494 115.424 75.348 145.356 1.00 0.00 H TER 59657 WAT 7494 ATOM 59657 O WAT 7495 35.917 115.300 2.130 1.00 0.00 O ATOM 59658 H1 WAT 7495 36.305 115.827 1.431 1.00 0.00 H ATOM 59659 H2 WAT 7495 35.446 114.605 1.672 1.00 0.00 H TER 59661 WAT 7495 ATOM 59661 O WAT 7496 128.395 106.754 116.900 1.00 0.00 O ATOM 59662 H1 WAT 7496 127.605 106.857 116.369 1.00 0.00 H ATOM 59663 H2 WAT 7496 128.500 107.598 117.340 1.00 0.00 H TER 59665 WAT 7496 ATOM 59665 O WAT 7497 126.684 84.278 60.219 1.00 0.00 O ATOM 59666 H1 WAT 7497 127.401 83.784 59.821 1.00 0.00 H ATOM 59667 H2 WAT 7497 125.995 83.628 60.358 1.00 0.00 H TER 59669 WAT 7497 ATOM 59669 O WAT 7498 129.233 106.788 65.098 1.00 0.00 O ATOM 59670 H1 WAT 7498 129.098 106.749 64.151 1.00 0.00 H ATOM 59671 H2 WAT 7498 130.184 106.793 65.204 1.00 0.00 H TER 59673 WAT 7498 ATOM 59673 O WAT 7499 132.384 115.041 112.445 1.00 0.00 O ATOM 59674 H1 WAT 7499 133.188 115.065 111.927 1.00 0.00 H ATOM 59675 H2 WAT 7499 131.850 114.365 112.028 1.00 0.00 H TER 59677 WAT 7499 ATOM 59677 O WAT 7500 90.134 124.549 119.346 1.00 0.00 O ATOM 59678 H1 WAT 7500 90.194 124.939 118.473 1.00 0.00 H ATOM 59679 H2 WAT 7500 89.399 123.939 119.285 1.00 0.00 H TER 59681 WAT 7500 ATOM 59681 O WAT 7501 122.294 10.732 112.824 1.00 0.00 O ATOM 59682 H1 WAT 7501 123.108 11.006 112.400 1.00 0.00 H ATOM 59683 H2 WAT 7501 122.161 11.372 113.523 1.00 0.00 H TER 59685 WAT 7501 ATOM 59685 O WAT 7502 1.110 87.088 80.854 1.00 0.00 O ATOM 59686 H1 WAT 7502 1.743 87.621 81.335 1.00 0.00 H ATOM 59687 H2 WAT 7502 1.341 87.213 79.933 1.00 0.00 H TER 59689 WAT 7502 ATOM 59689 O WAT 7503 36.230 44.515 134.928 1.00 0.00 O ATOM 59690 H1 WAT 7503 36.013 44.384 134.005 1.00 0.00 H ATOM 59691 H2 WAT 7503 35.902 45.391 135.130 1.00 0.00 H TER 59693 WAT 7503 ATOM 59693 O WAT 7504 120.897 61.184 3.179 1.00 0.00 O ATOM 59694 H1 WAT 7504 121.104 62.047 2.821 1.00 0.00 H ATOM 59695 H2 WAT 7504 121.527 61.062 3.889 1.00 0.00 H TER 59697 WAT 7504 ATOM 59697 O WAT 7505 67.670 79.637 142.021 1.00 0.00 O ATOM 59698 H1 WAT 7505 68.217 80.084 141.375 1.00 0.00 H ATOM 59699 H2 WAT 7505 66.953 79.262 141.509 1.00 0.00 H TER 59701 WAT 7505 ATOM 59701 O WAT 7506 4.630 73.491 136.371 1.00 0.00 O ATOM 59702 H1 WAT 7506 4.705 72.538 136.331 1.00 0.00 H ATOM 59703 H2 WAT 7506 5.509 73.791 136.601 1.00 0.00 H TER 59705 WAT 7506 ATOM 59705 O WAT 7507 74.678 48.292 119.880 1.00 0.00 O ATOM 59706 H1 WAT 7507 74.650 47.697 120.629 1.00 0.00 H ATOM 59707 H2 WAT 7507 75.547 48.159 119.501 1.00 0.00 H TER 59709 WAT 7507 ATOM 59709 O WAT 7508 11.917 76.247 151.987 1.00 0.00 O ATOM 59710 H1 WAT 7508 12.575 76.810 151.580 1.00 0.00 H ATOM 59711 H2 WAT 7508 11.159 76.817 152.113 1.00 0.00 H TER 59713 WAT 7508 ATOM 59713 O WAT 7509 87.897 142.775 70.060 1.00 0.00 O ATOM 59714 H1 WAT 7509 87.938 142.453 69.160 1.00 0.00 H ATOM 59715 H2 WAT 7509 87.081 143.274 70.099 1.00 0.00 H TER 59717 WAT 7509 ATOM 59717 O WAT 7510 129.097 145.039 52.982 1.00 0.00 O ATOM 59718 H1 WAT 7510 129.137 145.992 52.898 1.00 0.00 H ATOM 59719 H2 WAT 7510 129.941 144.796 53.364 1.00 0.00 H TER 59721 WAT 7510 ATOM 59721 O WAT 7511 139.515 73.049 113.713 1.00 0.00 O ATOM 59722 H1 WAT 7511 139.879 72.549 112.983 1.00 0.00 H ATOM 59723 H2 WAT 7511 139.322 72.391 114.381 1.00 0.00 H TER 59725 WAT 7511 ATOM 59725 O WAT 7512 68.201 29.993 13.983 1.00 0.00 O ATOM 59726 H1 WAT 7512 68.328 29.737 14.896 1.00 0.00 H ATOM 59727 H2 WAT 7512 69.079 30.205 13.668 1.00 0.00 H TER 59729 WAT 7512 ATOM 59729 O WAT 7513 123.834 4.487 109.241 1.00 0.00 O ATOM 59730 H1 WAT 7513 124.071 4.840 110.099 1.00 0.00 H ATOM 59731 H2 WAT 7513 123.583 5.256 108.728 1.00 0.00 H TER 59733 WAT 7513 ATOM 59733 O WAT 7514 63.360 98.916 128.452 1.00 0.00 O ATOM 59734 H1 WAT 7514 64.052 99.511 128.740 1.00 0.00 H ATOM 59735 H2 WAT 7514 62.583 99.470 128.378 1.00 0.00 H TER 59737 WAT 7514 ATOM 59737 O WAT 7515 92.842 11.791 139.841 1.00 0.00 O ATOM 59738 H1 WAT 7515 93.691 11.819 140.282 1.00 0.00 H ATOM 59739 H2 WAT 7515 92.972 12.298 139.039 1.00 0.00 H TER 59741 WAT 7515 ATOM 59741 O WAT 7516 42.581 64.056 107.462 1.00 0.00 O ATOM 59742 H1 WAT 7516 43.155 63.819 106.734 1.00 0.00 H ATOM 59743 H2 WAT 7516 42.311 64.954 107.271 1.00 0.00 H TER 59745 WAT 7516 ATOM 59745 O WAT 7517 60.876 79.112 94.399 1.00 0.00 O ATOM 59746 H1 WAT 7517 61.644 79.297 93.859 1.00 0.00 H ATOM 59747 H2 WAT 7517 60.515 79.975 94.606 1.00 0.00 H TER 59749 WAT 7517 ATOM 59749 O WAT 7518 61.644 6.876 117.273 1.00 0.00 O ATOM 59750 H1 WAT 7518 61.614 5.941 117.475 1.00 0.00 H ATOM 59751 H2 WAT 7518 62.572 7.104 117.337 1.00 0.00 H TER 59753 WAT 7518 ATOM 59753 O WAT 7519 21.205 55.523 126.714 1.00 0.00 O ATOM 59754 H1 WAT 7519 21.508 54.726 126.278 1.00 0.00 H ATOM 59755 H2 WAT 7519 20.584 55.213 127.373 1.00 0.00 H TER 59757 WAT 7519 ATOM 59757 O WAT 7520 114.428 1.083 125.068 1.00 0.00 O ATOM 59758 H1 WAT 7520 113.579 0.777 124.749 1.00 0.00 H ATOM 59759 H2 WAT 7520 114.983 1.104 124.289 1.00 0.00 H TER 59761 WAT 7520 ATOM 59761 O WAT 7521 129.894 41.901 72.543 1.00 0.00 O ATOM 59762 H1 WAT 7521 130.479 42.274 73.202 1.00 0.00 H ATOM 59763 H2 WAT 7521 130.278 41.049 72.337 1.00 0.00 H TER 59765 WAT 7521 ATOM 59765 O WAT 7522 138.155 60.954 103.605 1.00 0.00 O ATOM 59766 H1 WAT 7522 138.702 61.471 103.014 1.00 0.00 H ATOM 59767 H2 WAT 7522 138.611 60.990 104.446 1.00 0.00 H TER 59769 WAT 7522 ATOM 59769 O WAT 7523 25.917 72.981 117.004 1.00 0.00 O ATOM 59770 H1 WAT 7523 26.441 72.277 117.387 1.00 0.00 H ATOM 59771 H2 WAT 7523 26.560 73.567 116.603 1.00 0.00 H TER 59773 WAT 7523 ATOM 59773 O WAT 7524 42.356 6.764 107.637 1.00 0.00 O ATOM 59774 H1 WAT 7524 41.530 6.310 107.804 1.00 0.00 H ATOM 59775 H2 WAT 7524 42.863 6.150 107.107 1.00 0.00 H TER 59777 WAT 7524 ATOM 59777 O WAT 7525 64.079 92.075 127.403 1.00 0.00 O ATOM 59778 H1 WAT 7525 63.669 91.227 127.233 1.00 0.00 H ATOM 59779 H2 WAT 7525 63.415 92.717 127.149 1.00 0.00 H TER 59781 WAT 7525 ATOM 59781 O WAT 7526 50.969 94.443 135.179 1.00 0.00 O ATOM 59782 H1 WAT 7526 50.129 94.852 135.385 1.00 0.00 H ATOM 59783 H2 WAT 7526 50.807 93.504 135.272 1.00 0.00 H TER 59785 WAT 7526 ATOM 59785 O WAT 7527 57.237 95.145 58.470 1.00 0.00 O ATOM 59786 H1 WAT 7527 57.700 94.721 59.192 1.00 0.00 H ATOM 59787 H2 WAT 7527 57.925 95.579 57.966 1.00 0.00 H TER 59789 WAT 7527 ATOM 59789 O WAT 7528 142.750 99.747 90.638 1.00 0.00 O ATOM 59790 H1 WAT 7528 142.290 99.069 90.143 1.00 0.00 H ATOM 59791 H2 WAT 7528 142.633 100.543 90.120 1.00 0.00 H TER 59793 WAT 7528 ATOM 59793 O WAT 7529 36.403 17.816 113.221 1.00 0.00 O ATOM 59794 H1 WAT 7529 36.084 16.919 113.131 1.00 0.00 H ATOM 59795 H2 WAT 7529 37.006 17.783 113.964 1.00 0.00 H TER 59797 WAT 7529 ATOM 59797 O WAT 7530 59.569 145.929 85.880 1.00 0.00 O ATOM 59798 H1 WAT 7530 59.894 145.365 86.582 1.00 0.00 H ATOM 59799 H2 WAT 7530 58.894 145.407 85.446 1.00 0.00 H TER 59801 WAT 7530 ATOM 59801 O WAT 7531 54.471 87.214 148.239 1.00 0.00 O ATOM 59802 H1 WAT 7531 54.420 87.267 149.194 1.00 0.00 H ATOM 59803 H2 WAT 7531 54.048 86.383 148.022 1.00 0.00 H TER 59805 WAT 7531 ATOM 59805 O WAT 7532 14.104 32.078 122.403 1.00 0.00 O ATOM 59806 H1 WAT 7532 15.044 32.114 122.578 1.00 0.00 H ATOM 59807 H2 WAT 7532 14.026 32.268 121.468 1.00 0.00 H TER 59809 WAT 7532 ATOM 59809 O WAT 7533 35.598 34.750 78.463 1.00 0.00 O ATOM 59810 H1 WAT 7533 35.361 35.498 77.916 1.00 0.00 H ATOM 59811 H2 WAT 7533 36.533 34.865 78.634 1.00 0.00 H TER 59813 WAT 7533 ATOM 59813 O WAT 7534 34.357 74.454 152.548 1.00 0.00 O ATOM 59814 H1 WAT 7534 34.943 74.512 151.793 1.00 0.00 H ATOM 59815 H2 WAT 7534 33.481 74.574 152.181 1.00 0.00 H TER 59817 WAT 7534 ATOM 59817 O WAT 7535 70.507 24.039 106.669 1.00 0.00 O ATOM 59818 H1 WAT 7535 70.720 23.362 106.026 1.00 0.00 H ATOM 59819 H2 WAT 7535 70.177 24.770 106.146 1.00 0.00 H TER 59821 WAT 7535 ATOM 59821 O WAT 7536 100.419 59.395 2.663 1.00 0.00 O ATOM 59822 H1 WAT 7536 99.540 59.772 2.701 1.00 0.00 H ATOM 59823 H2 WAT 7536 100.412 58.705 3.327 1.00 0.00 H TER 59825 WAT 7536 ATOM 59825 O WAT 7537 115.080 122.523 141.312 1.00 0.00 O ATOM 59826 H1 WAT 7537 115.430 123.064 142.020 1.00 0.00 H ATOM 59827 H2 WAT 7537 115.847 122.281 140.793 1.00 0.00 H TER 59829 WAT 7537 ATOM 59829 O WAT 7538 7.584 43.479 149.561 1.00 0.00 O ATOM 59830 H1 WAT 7538 7.697 44.382 149.857 1.00 0.00 H ATOM 59831 H2 WAT 7538 7.902 43.481 148.659 1.00 0.00 H TER 59833 WAT 7538 ATOM 59833 O WAT 7539 86.262 76.371 138.232 1.00 0.00 O ATOM 59834 H1 WAT 7539 85.451 75.968 138.542 1.00 0.00 H ATOM 59835 H2 WAT 7539 86.446 75.932 137.402 1.00 0.00 H TER 59837 WAT 7539 ATOM 59837 O WAT 7540 115.803 85.910 5.860 1.00 0.00 O ATOM 59838 H1 WAT 7540 114.980 86.077 6.319 1.00 0.00 H ATOM 59839 H2 WAT 7540 115.586 85.234 5.218 1.00 0.00 H TER 59841 WAT 7540 ATOM 59841 O WAT 7541 63.750 69.388 23.482 1.00 0.00 O ATOM 59842 H1 WAT 7541 63.115 68.812 23.908 1.00 0.00 H ATOM 59843 H2 WAT 7541 63.964 70.043 24.147 1.00 0.00 H TER 59845 WAT 7541 ATOM 59845 O WAT 7542 101.853 144.768 73.856 1.00 0.00 O ATOM 59846 H1 WAT 7542 102.410 145.306 74.419 1.00 0.00 H ATOM 59847 H2 WAT 7542 101.056 144.630 74.369 1.00 0.00 H TER 59849 WAT 7542 ATOM 59849 O WAT 7543 81.699 107.092 88.865 1.00 0.00 O ATOM 59850 H1 WAT 7543 80.938 107.622 88.627 1.00 0.00 H ATOM 59851 H2 WAT 7543 82.417 107.720 88.936 1.00 0.00 H TER 59853 WAT 7543 ATOM 59853 O WAT 7544 90.238 21.576 152.387 1.00 0.00 O ATOM 59854 H1 WAT 7544 90.747 21.889 151.639 1.00 0.00 H ATOM 59855 H2 WAT 7544 90.475 22.168 153.101 1.00 0.00 H TER 59857 WAT 7544 ATOM 59857 O WAT 7545 3.438 39.456 127.888 1.00 0.00 O ATOM 59858 H1 WAT 7545 4.372 39.249 127.899 1.00 0.00 H ATOM 59859 H2 WAT 7545 3.014 38.669 128.230 1.00 0.00 H TER 59861 WAT 7545 ATOM 59861 O WAT 7546 31.466 59.454 145.829 1.00 0.00 O ATOM 59862 H1 WAT 7546 31.654 58.523 145.709 1.00 0.00 H ATOM 59863 H2 WAT 7546 31.142 59.745 144.976 1.00 0.00 H TER 59865 WAT 7546 ATOM 59865 O WAT 7547 27.533 123.730 96.952 1.00 0.00 O ATOM 59866 H1 WAT 7547 27.798 124.629 97.147 1.00 0.00 H ATOM 59867 H2 WAT 7547 28.300 123.201 97.175 1.00 0.00 H TER 59869 WAT 7547 ATOM 59869 O WAT 7548 34.966 118.657 139.208 1.00 0.00 O ATOM 59870 H1 WAT 7548 35.876 118.916 139.355 1.00 0.00 H ATOM 59871 H2 WAT 7548 35.006 118.048 138.471 1.00 0.00 H TER 59873 WAT 7548 ATOM 59873 O WAT 7549 6.969 108.894 102.980 1.00 0.00 O ATOM 59874 H1 WAT 7549 7.028 108.342 102.200 1.00 0.00 H ATOM 59875 H2 WAT 7549 6.033 108.937 103.173 1.00 0.00 H TER 59877 WAT 7549 ATOM 59877 O WAT 7550 61.594 40.332 105.565 1.00 0.00 O ATOM 59878 H1 WAT 7550 62.528 40.144 105.469 1.00 0.00 H ATOM 59879 H2 WAT 7550 61.548 41.286 105.629 1.00 0.00 H TER 59881 WAT 7550 ATOM 59881 O WAT 7551 81.149 48.847 157.916 1.00 0.00 O ATOM 59882 H1 WAT 7551 81.960 48.339 157.894 1.00 0.00 H ATOM 59883 H2 WAT 7551 81.438 49.755 158.004 1.00 0.00 H TER 59885 WAT 7551 ATOM 59885 O WAT 7552 89.709 34.063 114.639 1.00 0.00 O ATOM 59886 H1 WAT 7552 90.240 34.815 114.902 1.00 0.00 H ATOM 59887 H2 WAT 7552 88.860 34.213 115.055 1.00 0.00 H TER 59889 WAT 7552 ATOM 59889 O WAT 7553 89.031 119.529 65.127 1.00 0.00 O ATOM 59890 H1 WAT 7553 88.076 119.499 65.190 1.00 0.00 H ATOM 59891 H2 WAT 7553 89.329 118.795 65.664 1.00 0.00 H TER 59893 WAT 7553 ATOM 59893 O WAT 7554 107.446 46.637 83.275 1.00 0.00 O ATOM 59894 H1 WAT 7554 107.397 47.583 83.133 1.00 0.00 H ATOM 59895 H2 WAT 7554 108.180 46.351 82.732 1.00 0.00 H TER 59897 WAT 7554 ATOM 59897 O WAT 7555 43.210 62.301 130.773 1.00 0.00 O ATOM 59898 H1 WAT 7555 42.745 62.502 129.961 1.00 0.00 H ATOM 59899 H2 WAT 7555 42.638 61.685 131.230 1.00 0.00 H TER 59901 WAT 7555 ATOM 59901 O WAT 7556 28.013 145.772 100.309 1.00 0.00 O ATOM 59902 H1 WAT 7556 27.564 145.557 101.127 1.00 0.00 H ATOM 59903 H2 WAT 7556 28.902 146.004 100.578 1.00 0.00 H TER 59905 WAT 7556 ATOM 59905 O WAT 7557 139.968 7.330 94.166 1.00 0.00 O ATOM 59906 H1 WAT 7557 140.552 6.793 94.702 1.00 0.00 H ATOM 59907 H2 WAT 7557 140.512 7.612 93.430 1.00 0.00 H TER 59909 WAT 7557 ATOM 59909 O WAT 7558 122.248 41.254 115.529 1.00 0.00 O ATOM 59910 H1 WAT 7558 121.333 41.368 115.270 1.00 0.00 H ATOM 59911 H2 WAT 7558 122.237 41.317 116.484 1.00 0.00 H TER 59913 WAT 7558 ATOM 59913 O WAT 7559 115.824 30.827 110.346 1.00 0.00 O ATOM 59914 H1 WAT 7559 115.662 30.030 109.842 1.00 0.00 H ATOM 59915 H2 WAT 7559 114.952 31.133 110.597 1.00 0.00 H TER 59917 WAT 7559 ATOM 59917 O WAT 7560 18.367 58.045 51.523 1.00 0.00 O ATOM 59918 H1 WAT 7560 17.983 58.528 50.791 1.00 0.00 H ATOM 59919 H2 WAT 7560 19.077 58.606 51.834 1.00 0.00 H TER 59921 WAT 7560 ATOM 59921 O WAT 7561 22.104 127.293 84.014 1.00 0.00 O ATOM 59922 H1 WAT 7561 23.040 127.124 83.913 1.00 0.00 H ATOM 59923 H2 WAT 7561 21.679 126.585 83.531 1.00 0.00 H TER 59925 WAT 7561 ATOM 59925 O WAT 7562 133.784 83.014 147.779 1.00 0.00 O ATOM 59926 H1 WAT 7562 134.416 83.501 147.249 1.00 0.00 H ATOM 59927 H2 WAT 7562 133.569 82.247 147.249 1.00 0.00 H TER 59929 WAT 7562 ATOM 59929 O WAT 7563 21.411 37.432 12.013 1.00 0.00 O ATOM 59930 H1 WAT 7563 21.065 37.395 12.905 1.00 0.00 H ATOM 59931 H2 WAT 7563 22.019 36.695 11.962 1.00 0.00 H TER 59933 WAT 7563 ATOM 59933 O WAT 7564 96.381 78.725 17.919 1.00 0.00 O ATOM 59934 H1 WAT 7564 96.536 77.793 17.763 1.00 0.00 H ATOM 59935 H2 WAT 7564 95.552 78.907 17.475 1.00 0.00 H TER 59937 WAT 7564 ATOM 59937 O WAT 7565 42.160 96.177 139.562 1.00 0.00 O ATOM 59938 H1 WAT 7565 41.519 96.057 138.861 1.00 0.00 H ATOM 59939 H2 WAT 7565 41.715 96.736 140.199 1.00 0.00 H TER 59941 WAT 7565 ATOM 59941 O WAT 7566 116.829 63.202 142.105 1.00 0.00 O ATOM 59942 H1 WAT 7566 117.414 62.850 141.434 1.00 0.00 H ATOM 59943 H2 WAT 7566 117.415 63.616 142.739 1.00 0.00 H TER 59945 WAT 7566 ATOM 59945 O WAT 7567 107.501 4.759 98.760 1.00 0.00 O ATOM 59946 H1 WAT 7567 106.587 5.040 98.805 1.00 0.00 H ATOM 59947 H2 WAT 7567 107.459 3.861 98.433 1.00 0.00 H TER 59949 WAT 7567 ATOM 59949 O WAT 7568 119.591 141.400 158.499 1.00 0.00 O ATOM 59950 H1 WAT 7568 119.821 141.117 159.383 1.00 0.00 H ATOM 59951 H2 WAT 7568 120.360 141.880 158.193 1.00 0.00 H TER 59953 WAT 7568 ATOM 59953 O WAT 7569 125.657 3.076 143.862 1.00 0.00 O ATOM 59954 H1 WAT 7569 125.377 2.891 142.966 1.00 0.00 H ATOM 59955 H2 WAT 7569 125.146 2.474 144.403 1.00 0.00 H TER 59957 WAT 7569 ATOM 59957 O WAT 7570 118.335 5.123 11.786 1.00 0.00 O ATOM 59958 H1 WAT 7570 117.674 4.432 11.804 1.00 0.00 H ATOM 59959 H2 WAT 7570 118.294 5.470 10.895 1.00 0.00 H TER 59961 WAT 7570 ATOM 59961 O WAT 7571 61.782 26.696 107.445 1.00 0.00 O ATOM 59962 H1 WAT 7571 62.494 26.834 106.821 1.00 0.00 H ATOM 59963 H2 WAT 7571 62.178 26.186 108.152 1.00 0.00 H TER 59965 WAT 7571 ATOM 59965 O WAT 7572 5.049 37.178 69.348 1.00 0.00 O ATOM 59966 H1 WAT 7572 5.546 36.749 68.652 1.00 0.00 H ATOM 59967 H2 WAT 7572 4.982 36.518 70.037 1.00 0.00 H TER 59969 WAT 7572 ATOM 59969 O WAT 7573 65.905 65.750 145.098 1.00 0.00 O ATOM 59970 H1 WAT 7573 66.570 66.438 145.109 1.00 0.00 H ATOM 59971 H2 WAT 7573 65.475 65.818 145.951 1.00 0.00 H TER 59973 WAT 7573 ATOM 59973 O WAT 7574 140.319 0.727 145.038 1.00 0.00 O ATOM 59974 H1 WAT 7574 140.742 1.398 144.503 1.00 0.00 H ATOM 59975 H2 WAT 7574 140.044 0.058 144.411 1.00 0.00 H TER 59977 WAT 7574 ATOM 59977 O WAT 7575 100.852 57.036 80.604 1.00 0.00 O ATOM 59978 H1 WAT 7575 101.168 57.104 79.703 1.00 0.00 H ATOM 59979 H2 WAT 7575 100.826 57.941 80.917 1.00 0.00 H TER 59981 WAT 7575 ATOM 59981 O WAT 7576 133.878 66.222 67.746 1.00 0.00 O ATOM 59982 H1 WAT 7576 133.532 65.844 66.937 1.00 0.00 H ATOM 59983 H2 WAT 7576 134.237 65.476 68.225 1.00 0.00 H TER 59985 WAT 7576 ATOM 59985 O WAT 7577 56.209 43.729 87.704 1.00 0.00 O ATOM 59986 H1 WAT 7577 55.621 43.226 88.267 1.00 0.00 H ATOM 59987 H2 WAT 7577 56.919 44.004 88.284 1.00 0.00 H TER 59989 WAT 7577 ATOM 59989 O WAT 7578 98.435 128.402 141.346 1.00 0.00 O ATOM 59990 H1 WAT 7578 97.886 128.125 140.612 1.00 0.00 H ATOM 59991 H2 WAT 7578 99.317 128.122 141.104 1.00 0.00 H TER 59993 WAT 7578 ATOM 59993 O WAT 7579 38.864 103.309 104.227 1.00 0.00 O ATOM 59994 H1 WAT 7579 38.381 104.022 104.644 1.00 0.00 H ATOM 59995 H2 WAT 7579 39.622 103.735 103.827 1.00 0.00 H TER 59997 WAT 7579 ATOM 59997 O WAT 7580 81.471 67.197 73.958 1.00 0.00 O ATOM 59998 H1 WAT 7580 81.050 67.056 73.110 1.00 0.00 H ATOM 59999 H2 WAT 7580 81.898 66.364 74.155 1.00 0.00 H TER 60001 WAT 7580 ATOM 60001 O WAT 7581 87.713 54.339 16.872 1.00 0.00 O ATOM 60002 H1 WAT 7581 88.271 53.846 17.474 1.00 0.00 H ATOM 60003 H2 WAT 7581 87.670 55.217 17.250 1.00 0.00 H TER 60005 WAT 7581 ATOM 60005 O WAT 7582 76.559 20.224 5.064 1.00 0.00 O ATOM 60006 H1 WAT 7582 75.983 20.928 4.764 1.00 0.00 H ATOM 60007 H2 WAT 7582 76.855 19.798 4.260 1.00 0.00 H TER 60009 WAT 7582 ATOM 60009 O WAT 7583 90.111 85.435 114.640 1.00 0.00 O ATOM 60010 H1 WAT 7583 90.258 84.736 115.277 1.00 0.00 H ATOM 60011 H2 WAT 7583 90.230 85.014 113.789 1.00 0.00 H TER 60013 WAT 7583 ATOM 60013 O WAT 7584 22.259 6.605 17.983 1.00 0.00 O ATOM 60014 H1 WAT 7584 22.770 6.693 18.787 1.00 0.00 H ATOM 60015 H2 WAT 7584 22.595 7.293 17.409 1.00 0.00 H TER 60017 WAT 7584 ATOM 60017 O WAT 7585 75.480 72.500 59.829 1.00 0.00 O ATOM 60018 H1 WAT 7585 75.457 72.483 58.872 1.00 0.00 H ATOM 60019 H2 WAT 7585 74.950 73.262 60.067 1.00 0.00 H TER 60021 WAT 7585 ATOM 60021 O WAT 7586 98.350 135.124 10.864 1.00 0.00 O ATOM 60022 H1 WAT 7586 97.644 135.766 10.788 1.00 0.00 H ATOM 60023 H2 WAT 7586 98.131 134.452 10.218 1.00 0.00 H TER 60025 WAT 7586 ATOM 60025 O WAT 7587 64.351 85.883 7.465 1.00 0.00 O ATOM 60026 H1 WAT 7587 65.013 85.478 6.906 1.00 0.00 H ATOM 60027 H2 WAT 7587 64.853 86.304 8.164 1.00 0.00 H TER 60029 WAT 7587 ATOM 60029 O WAT 7588 126.372 134.674 84.038 1.00 0.00 O ATOM 60030 H1 WAT 7588 126.947 135.259 83.544 1.00 0.00 H ATOM 60031 H2 WAT 7588 125.631 134.516 83.454 1.00 0.00 H TER 60033 WAT 7588 ATOM 60033 O WAT 7589 98.694 100.707 81.158 1.00 0.00 O ATOM 60034 H1 WAT 7589 98.312 101.226 80.451 1.00 0.00 H ATOM 60035 H2 WAT 7589 99.343 100.152 80.725 1.00 0.00 H TER 60037 WAT 7589 ATOM 60037 O WAT 7590 144.232 22.721 134.089 1.00 0.00 O ATOM 60038 H1 WAT 7590 143.587 22.286 134.646 1.00 0.00 H ATOM 60039 H2 WAT 7590 145.011 22.798 134.640 1.00 0.00 H TER 60041 WAT 7590 ATOM 60041 O WAT 7591 84.483 19.819 104.366 1.00 0.00 O ATOM 60042 H1 WAT 7591 84.805 19.705 103.471 1.00 0.00 H ATOM 60043 H2 WAT 7591 84.130 20.709 104.382 1.00 0.00 H TER 60045 WAT 7591 ATOM 60045 O WAT 7592 22.368 113.843 106.099 1.00 0.00 O ATOM 60046 H1 WAT 7592 22.401 113.740 107.050 1.00 0.00 H ATOM 60047 H2 WAT 7592 22.132 112.975 105.772 1.00 0.00 H TER 60049 WAT 7592 ATOM 60049 O WAT 7593 95.451 7.285 139.009 1.00 0.00 O ATOM 60050 H1 WAT 7593 95.449 6.365 138.745 1.00 0.00 H ATOM 60051 H2 WAT 7593 96.339 7.587 138.821 1.00 0.00 H TER 60053 WAT 7593 ATOM 60053 O WAT 7594 66.040 84.438 19.730 1.00 0.00 O ATOM 60054 H1 WAT 7594 66.546 85.191 19.424 1.00 0.00 H ATOM 60055 H2 WAT 7594 65.486 84.789 20.428 1.00 0.00 H TER 60057 WAT 7594 ATOM 60057 O WAT 7595 33.883 104.412 110.791 1.00 0.00 O ATOM 60058 H1 WAT 7595 33.659 104.490 111.719 1.00 0.00 H ATOM 60059 H2 WAT 7595 33.822 105.306 110.455 1.00 0.00 H TER 60061 WAT 7595 ATOM 60061 O WAT 7596 50.672 8.996 157.966 1.00 0.00 O ATOM 60062 H1 WAT 7596 49.755 8.762 157.824 1.00 0.00 H ATOM 60063 H2 WAT 7596 50.932 8.491 158.736 1.00 0.00 H TER 60065 WAT 7596 ATOM 60065 O WAT 7597 35.633 44.327 118.619 1.00 0.00 O ATOM 60066 H1 WAT 7597 36.555 44.303 118.874 1.00 0.00 H ATOM 60067 H2 WAT 7597 35.400 43.410 118.477 1.00 0.00 H TER 60069 WAT 7597 ATOM 60069 O WAT 7598 13.072 16.332 11.296 1.00 0.00 O ATOM 60070 H1 WAT 7598 12.765 15.658 11.902 1.00 0.00 H ATOM 60071 H2 WAT 7598 12.401 16.366 10.615 1.00 0.00 H TER 60073 WAT 7598 ATOM 60073 O WAT 7599 119.307 124.077 80.520 1.00 0.00 O ATOM 60074 H1 WAT 7599 119.424 125.027 80.513 1.00 0.00 H ATOM 60075 H2 WAT 7599 119.030 123.864 79.629 1.00 0.00 H TER 60077 WAT 7599 ATOM 60077 O WAT 7600 63.296 53.726 19.664 1.00 0.00 O ATOM 60078 H1 WAT 7600 63.023 52.809 19.640 1.00 0.00 H ATOM 60079 H2 WAT 7600 63.821 53.799 20.461 1.00 0.00 H TER 60081 WAT 7600 ATOM 60081 O WAT 7601 122.519 55.975 74.704 1.00 0.00 O ATOM 60082 H1 WAT 7601 122.567 55.967 73.748 1.00 0.00 H ATOM 60083 H2 WAT 7601 121.694 56.420 74.899 1.00 0.00 H TER 60085 WAT 7601 ATOM 60085 O WAT 7602 82.905 30.205 22.414 1.00 0.00 O ATOM 60086 H1 WAT 7602 82.956 30.616 23.276 1.00 0.00 H ATOM 60087 H2 WAT 7602 82.965 30.934 21.797 1.00 0.00 H TER 60089 WAT 7602 ATOM 60089 O WAT 7603 14.018 142.351 105.877 1.00 0.00 O ATOM 60090 H1 WAT 7603 13.556 142.044 106.657 1.00 0.00 H ATOM 60091 H2 WAT 7603 14.520 141.592 105.581 1.00 0.00 H TER 60093 WAT 7603 ATOM 60093 O WAT 7604 12.753 116.154 59.747 1.00 0.00 O ATOM 60094 H1 WAT 7604 12.581 115.431 60.350 1.00 0.00 H ATOM 60095 H2 WAT 7604 13.649 116.006 59.445 1.00 0.00 H TER 60097 WAT 7604 ATOM 60097 O WAT 7605 128.756 122.427 2.446 1.00 0.00 O ATOM 60098 H1 WAT 7605 128.506 122.942 1.679 1.00 0.00 H ATOM 60099 H2 WAT 7605 129.700 122.301 2.353 1.00 0.00 H TER 60101 WAT 7605 ATOM 60101 O WAT 7606 84.209 57.626 9.447 1.00 0.00 O ATOM 60102 H1 WAT 7606 84.749 58.188 8.892 1.00 0.00 H ATOM 60103 H2 WAT 7606 83.311 57.809 9.173 1.00 0.00 H TER 60105 WAT 7606 ATOM 60105 O WAT 7607 69.429 110.287 14.319 1.00 0.00 O ATOM 60106 H1 WAT 7607 69.262 109.687 15.046 1.00 0.00 H ATOM 60107 H2 WAT 7607 69.155 111.143 14.648 1.00 0.00 H TER 60109 WAT 7607 ATOM 60109 O WAT 7608 28.376 126.816 131.828 1.00 0.00 O ATOM 60110 H1 WAT 7608 28.120 125.896 131.761 1.00 0.00 H ATOM 60111 H2 WAT 7608 29.210 126.798 132.297 1.00 0.00 H TER 60113 WAT 7608 ATOM 60113 O WAT 7609 82.383 44.177 100.049 1.00 0.00 O ATOM 60114 H1 WAT 7609 82.026 45.065 100.075 1.00 0.00 H ATOM 60115 H2 WAT 7609 83.058 44.211 99.371 1.00 0.00 H TER 60117 WAT 7609 ATOM 60117 O WAT 7610 117.172 11.501 158.128 1.00 0.00 O ATOM 60118 H1 WAT 7610 117.482 11.285 159.007 1.00 0.00 H ATOM 60119 H2 WAT 7610 117.815 12.126 157.793 1.00 0.00 H TER 60121 WAT 7610 ATOM 60121 O WAT 7611 23.621 55.485 85.334 1.00 0.00 O ATOM 60122 H1 WAT 7611 23.161 55.723 84.530 1.00 0.00 H ATOM 60123 H2 WAT 7611 23.038 54.863 85.769 1.00 0.00 H TER 60125 WAT 7611 ATOM 60125 O WAT 7612 44.468 111.343 5.275 1.00 0.00 O ATOM 60126 H1 WAT 7612 44.431 110.551 5.811 1.00 0.00 H ATOM 60127 H2 WAT 7612 44.472 112.061 5.908 1.00 0.00 H TER 60129 WAT 7612 ATOM 60129 O WAT 7613 99.289 32.029 138.838 1.00 0.00 O ATOM 60130 H1 WAT 7613 98.559 32.532 139.199 1.00 0.00 H ATOM 60131 H2 WAT 7613 98.951 31.137 138.763 1.00 0.00 H TER 60133 WAT 7613 ATOM 60133 O WAT 7614 110.702 29.701 95.185 1.00 0.00 O ATOM 60134 H1 WAT 7614 109.923 29.516 94.661 1.00 0.00 H ATOM 60135 H2 WAT 7614 111.171 28.867 95.220 1.00 0.00 H TER 60137 WAT 7614 ATOM 60137 O WAT 7615 120.317 27.329 59.762 1.00 0.00 O ATOM 60138 H1 WAT 7615 119.903 26.673 59.200 1.00 0.00 H ATOM 60139 H2 WAT 7615 119.606 27.651 60.316 1.00 0.00 H TER 60141 WAT 7615 ATOM 60141 O WAT 7616 5.727 92.087 143.914 1.00 0.00 O ATOM 60142 H1 WAT 7616 6.463 91.706 143.433 1.00 0.00 H ATOM 60143 H2 WAT 7616 5.798 91.716 144.794 1.00 0.00 H TER 60145 WAT 7616 ATOM 60145 O WAT 7617 140.852 81.918 93.956 1.00 0.00 O ATOM 60146 H1 WAT 7617 139.989 82.298 93.794 1.00 0.00 H ATOM 60147 H2 WAT 7617 141.312 82.580 94.472 1.00 0.00 H TER 60149 WAT 7617 ATOM 60149 O WAT 7618 74.366 25.133 9.036 1.00 0.00 O ATOM 60150 H1 WAT 7618 74.816 24.667 9.741 1.00 0.00 H ATOM 60151 H2 WAT 7618 73.443 25.117 9.289 1.00 0.00 H TER 60153 WAT 7618 ATOM 60153 O WAT 7619 1.179 81.713 85.505 1.00 0.00 O ATOM 60154 H1 WAT 7619 0.941 81.783 84.580 1.00 0.00 H ATOM 60155 H2 WAT 7619 2.125 81.858 85.520 1.00 0.00 H TER 60157 WAT 7619 ATOM 60157 O WAT 7620 85.987 80.620 17.329 1.00 0.00 O ATOM 60158 H1 WAT 7620 85.222 80.760 16.771 1.00 0.00 H ATOM 60159 H2 WAT 7620 86.341 79.778 17.042 1.00 0.00 H TER 60161 WAT 7620 ATOM 60161 O WAT 7621 96.930 75.460 79.415 1.00 0.00 O ATOM 60162 H1 WAT 7621 96.564 75.505 78.531 1.00 0.00 H ATOM 60163 H2 WAT 7621 96.975 74.524 79.608 1.00 0.00 H TER 60165 WAT 7621 ATOM 60165 O WAT 7622 59.855 91.381 12.401 1.00 0.00 O ATOM 60166 H1 WAT 7622 59.906 91.887 11.591 1.00 0.00 H ATOM 60167 H2 WAT 7622 60.694 91.537 12.835 1.00 0.00 H TER 60169 WAT 7622 ATOM 60169 O WAT 7623 52.954 122.411 88.968 1.00 0.00 O ATOM 60170 H1 WAT 7623 53.333 123.181 88.542 1.00 0.00 H ATOM 60171 H2 WAT 7623 52.171 122.742 89.408 1.00 0.00 H TER 60173 WAT 7623 ATOM 60173 O WAT 7624 125.768 13.367 83.749 1.00 0.00 O ATOM 60174 H1 WAT 7624 125.348 13.103 84.568 1.00 0.00 H ATOM 60175 H2 WAT 7624 126.110 12.553 83.382 1.00 0.00 H TER 60177 WAT 7624 ATOM 60177 O WAT 7625 58.047 78.562 73.024 1.00 0.00 O ATOM 60178 H1 WAT 7625 58.835 78.048 72.849 1.00 0.00 H ATOM 60179 H2 WAT 7625 57.591 78.595 72.183 1.00 0.00 H TER 60181 WAT 7625 ATOM 60181 O WAT 7626 93.208 42.721 72.601 1.00 0.00 O ATOM 60182 H1 WAT 7626 93.921 42.256 73.038 1.00 0.00 H ATOM 60183 H2 WAT 7626 93.320 43.634 72.865 1.00 0.00 H TER 60185 WAT 7626 ATOM 60185 O WAT 7627 76.153 100.302 13.916 1.00 0.00 O ATOM 60186 H1 WAT 7627 76.511 100.638 14.738 1.00 0.00 H ATOM 60187 H2 WAT 7627 75.973 101.084 13.395 1.00 0.00 H TER 60189 WAT 7627 ATOM 60189 O WAT 7628 31.895 21.407 110.181 1.00 0.00 O ATOM 60190 H1 WAT 7628 32.046 21.788 111.046 1.00 0.00 H ATOM 60191 H2 WAT 7628 32.513 20.678 110.128 1.00 0.00 H TER 60193 WAT 7628 ATOM 60193 O WAT 7629 93.984 91.372 63.467 1.00 0.00 O ATOM 60194 H1 WAT 7629 94.639 91.681 64.093 1.00 0.00 H ATOM 60195 H2 WAT 7629 94.357 91.578 62.609 1.00 0.00 H TER 60197 WAT 7629 ATOM 60197 O WAT 7630 104.098 14.750 99.208 1.00 0.00 O ATOM 60198 H1 WAT 7630 103.322 14.192 99.155 1.00 0.00 H ATOM 60199 H2 WAT 7630 104.553 14.607 98.379 1.00 0.00 H TER 60201 WAT 7630 ATOM 60201 O WAT 7631 43.677 75.509 81.861 1.00 0.00 O ATOM 60202 H1 WAT 7631 43.291 74.684 82.154 1.00 0.00 H ATOM 60203 H2 WAT 7631 44.342 75.249 81.223 1.00 0.00 H TER 60205 WAT 7631 ATOM 60205 O WAT 7632 44.943 97.077 136.331 1.00 0.00 O ATOM 60206 H1 WAT 7632 44.116 97.465 136.616 1.00 0.00 H ATOM 60207 H2 WAT 7632 44.978 96.231 136.776 1.00 0.00 H TER 60209 WAT 7632 ATOM 60209 O WAT 7633 27.518 130.835 9.843 1.00 0.00 O ATOM 60210 H1 WAT 7633 27.963 131.571 9.423 1.00 0.00 H ATOM 60211 H2 WAT 7633 26.909 130.513 9.178 1.00 0.00 H TER 60213 WAT 7633 ATOM 60213 O WAT 7634 43.543 70.903 65.651 1.00 0.00 O ATOM 60214 H1 WAT 7634 43.806 70.778 66.563 1.00 0.00 H ATOM 60215 H2 WAT 7634 44.335 71.215 65.214 1.00 0.00 H TER 60217 WAT 7634 ATOM 60217 O WAT 7635 48.814 137.889 86.236 1.00 0.00 O ATOM 60218 H1 WAT 7635 48.383 137.292 86.847 1.00 0.00 H ATOM 60219 H2 WAT 7635 49.173 137.318 85.557 1.00 0.00 H TER 60221 WAT 7635 ATOM 60221 O WAT 7636 33.389 12.967 83.385 1.00 0.00 O ATOM 60222 H1 WAT 7636 32.822 13.350 82.716 1.00 0.00 H ATOM 60223 H2 WAT 7636 33.022 13.272 84.214 1.00 0.00 H TER 60225 WAT 7636 ATOM 60225 O WAT 7637 65.233 90.796 15.980 1.00 0.00 O ATOM 60226 H1 WAT 7637 65.697 90.149 15.448 1.00 0.00 H ATOM 60227 H2 WAT 7637 65.135 91.554 15.403 1.00 0.00 H TER 60229 WAT 7637 ATOM 60229 O WAT 7638 53.828 112.638 52.863 1.00 0.00 O ATOM 60230 H1 WAT 7638 54.172 112.004 53.493 1.00 0.00 H ATOM 60231 H2 WAT 7638 53.342 113.267 53.396 1.00 0.00 H TER 60233 WAT 7638 ATOM 60233 O WAT 7639 104.355 37.798 130.362 1.00 0.00 O ATOM 60234 H1 WAT 7639 103.757 38.537 130.479 1.00 0.00 H ATOM 60235 H2 WAT 7639 104.705 37.633 131.238 1.00 0.00 H TER 60237 WAT 7639 ATOM 60237 O WAT 7640 28.136 31.036 93.683 1.00 0.00 O ATOM 60238 H1 WAT 7640 28.991 31.012 93.254 1.00 0.00 H ATOM 60239 H2 WAT 7640 28.284 31.541 94.483 1.00 0.00 H TER 60241 WAT 7640 ATOM 60241 O WAT 7641 145.331 145.732 131.393 1.00 0.00 O ATOM 60242 H1 WAT 7641 145.801 144.928 131.613 1.00 0.00 H ATOM 60243 H2 WAT 7641 145.400 145.796 130.440 1.00 0.00 H TER 60245 WAT 7641 ATOM 60245 O WAT 7642 38.213 25.886 112.775 1.00 0.00 O ATOM 60246 H1 WAT 7642 38.171 25.770 113.724 1.00 0.00 H ATOM 60247 H2 WAT 7642 39.015 26.389 112.631 1.00 0.00 H TER 60249 WAT 7642 ATOM 60249 O WAT 7643 73.716 86.068 107.329 1.00 0.00 O ATOM 60250 H1 WAT 7643 74.430 86.107 107.965 1.00 0.00 H ATOM 60251 H2 WAT 7643 73.029 86.619 107.705 1.00 0.00 H TER 60253 WAT 7643 ATOM 60253 O WAT 7644 95.691 88.251 60.864 1.00 0.00 O ATOM 60254 H1 WAT 7644 94.891 88.755 61.017 1.00 0.00 H ATOM 60255 H2 WAT 7644 96.205 88.794 60.266 1.00 0.00 H TER 60257 WAT 7644 ATOM 60257 O WAT 7645 2.547 109.810 18.784 1.00 0.00 O ATOM 60258 H1 WAT 7645 2.167 108.957 18.995 1.00 0.00 H ATOM 60259 H2 WAT 7645 3.343 109.855 19.314 1.00 0.00 H TER 60261 WAT 7645 ATOM 60261 O WAT 7646 73.792 32.305 106.744 1.00 0.00 O ATOM 60262 H1 WAT 7646 73.911 32.321 105.795 1.00 0.00 H ATOM 60263 H2 WAT 7646 74.620 32.630 107.096 1.00 0.00 H TER 60265 WAT 7646 ATOM 60265 O WAT 7647 76.420 80.469 63.616 1.00 0.00 O ATOM 60266 H1 WAT 7647 75.994 80.330 64.462 1.00 0.00 H ATOM 60267 H2 WAT 7647 77.322 80.701 63.837 1.00 0.00 H TER 60269 WAT 7647 ATOM 60269 O WAT 7648 29.826 67.257 63.664 1.00 0.00 O ATOM 60270 H1 WAT 7648 30.283 67.219 64.505 1.00 0.00 H ATOM 60271 H2 WAT 7648 30.191 66.529 63.161 1.00 0.00 H TER 60273 WAT 7648 ATOM 60273 O WAT 7649 86.532 72.942 152.429 1.00 0.00 O ATOM 60274 H1 WAT 7649 86.069 72.309 152.979 1.00 0.00 H ATOM 60275 H2 WAT 7649 86.510 72.557 151.553 1.00 0.00 H TER 60277 WAT 7649 ATOM 60277 O WAT 7650 106.889 27.220 1.273 1.00 0.00 O ATOM 60278 H1 WAT 7650 106.611 28.038 1.684 1.00 0.00 H ATOM 60279 H2 WAT 7650 107.208 26.684 1.999 1.00 0.00 H TER 60281 WAT 7650 ATOM 60281 O WAT 7651 100.734 15.360 52.695 1.00 0.00 O ATOM 60282 H1 WAT 7651 99.861 15.384 52.302 1.00 0.00 H ATOM 60283 H2 WAT 7651 101.206 14.699 52.190 1.00 0.00 H TER 60285 WAT 7651 ATOM 60285 O WAT 7652 49.482 20.135 84.117 1.00 0.00 O ATOM 60286 H1 WAT 7652 50.263 20.658 83.932 1.00 0.00 H ATOM 60287 H2 WAT 7652 49.811 19.242 84.220 1.00 0.00 H TER 60289 WAT 7652 ATOM 60289 O WAT 7653 124.221 142.527 126.250 1.00 0.00 O ATOM 60290 H1 WAT 7653 124.327 142.932 127.111 1.00 0.00 H ATOM 60291 H2 WAT 7653 123.623 141.795 126.402 1.00 0.00 H TER 60293 WAT 7653 ATOM 60293 O WAT 7654 16.997 39.792 17.018 1.00 0.00 O ATOM 60294 H1 WAT 7654 17.229 39.867 17.943 1.00 0.00 H ATOM 60295 H2 WAT 7654 16.051 39.649 17.018 1.00 0.00 H TER 60297 WAT 7654 ATOM 60297 O WAT 7655 21.422 7.005 145.629 1.00 0.00 O ATOM 60298 H1 WAT 7655 20.603 6.938 146.119 1.00 0.00 H ATOM 60299 H2 WAT 7655 21.973 6.308 145.985 1.00 0.00 H TER 60301 WAT 7655 ATOM 60301 O WAT 7656 24.853 106.105 127.115 1.00 0.00 O ATOM 60302 H1 WAT 7656 24.575 106.832 126.557 1.00 0.00 H ATOM 60303 H2 WAT 7656 24.039 105.756 127.476 1.00 0.00 H TER 60305 WAT 7656 ATOM 60305 O WAT 7657 93.785 106.351 9.204 1.00 0.00 O ATOM 60306 H1 WAT 7657 93.556 106.449 8.279 1.00 0.00 H ATOM 60307 H2 WAT 7657 94.695 106.055 9.195 1.00 0.00 H TER 60309 WAT 7657 ATOM 60309 O WAT 7658 0.567 122.877 7.372 1.00 0.00 O ATOM 60310 H1 WAT 7658 0.776 123.787 7.585 1.00 0.00 H ATOM 60311 H2 WAT 7658 -0.357 122.895 7.126 1.00 0.00 H TER 60313 WAT 7658 ATOM 60313 O WAT 7659 70.523 45.294 144.457 1.00 0.00 O ATOM 60314 H1 WAT 7659 71.107 45.839 143.929 1.00 0.00 H ATOM 60315 H2 WAT 7659 71.086 44.599 144.797 1.00 0.00 H TER 60317 WAT 7659 ATOM 60317 O WAT 7660 53.534 8.292 2.754 1.00 0.00 O ATOM 60318 H1 WAT 7660 53.073 8.852 3.379 1.00 0.00 H ATOM 60319 H2 WAT 7660 54.036 8.901 2.213 1.00 0.00 H TER 60321 WAT 7660 ATOM 60321 O WAT 7661 104.385 75.632 156.537 1.00 0.00 O ATOM 60322 H1 WAT 7661 103.902 75.802 155.728 1.00 0.00 H ATOM 60323 H2 WAT 7661 104.619 74.705 156.486 1.00 0.00 H TER 60325 WAT 7661 ATOM 60325 O WAT 7662 139.484 80.491 112.743 1.00 0.00 O ATOM 60326 H1 WAT 7662 140.259 80.103 112.337 1.00 0.00 H ATOM 60327 H2 WAT 7662 139.750 80.668 113.646 1.00 0.00 H TER 60329 WAT 7662 ATOM 60329 O WAT 7663 24.046 141.211 88.220 1.00 0.00 O ATOM 60330 H1 WAT 7663 24.147 140.677 87.433 1.00 0.00 H ATOM 60331 H2 WAT 7663 23.529 140.667 88.814 1.00 0.00 H TER 60333 WAT 7663 ATOM 60333 O WAT 7664 65.267 126.419 86.498 1.00 0.00 O ATOM 60334 H1 WAT 7664 64.449 126.899 86.373 1.00 0.00 H ATOM 60335 H2 WAT 7664 65.416 126.442 87.443 1.00 0.00 H TER 60337 WAT 7664 ATOM 60337 O WAT 7665 75.999 128.009 117.932 1.00 0.00 O ATOM 60338 H1 WAT 7665 76.082 127.064 118.058 1.00 0.00 H ATOM 60339 H2 WAT 7665 75.232 128.253 118.450 1.00 0.00 H TER 60341 WAT 7665 ATOM 60341 O WAT 7666 41.844 55.817 55.907 1.00 0.00 O ATOM 60342 H1 WAT 7666 42.481 55.600 55.226 1.00 0.00 H ATOM 60343 H2 WAT 7666 42.090 56.696 56.194 1.00 0.00 H TER 60345 WAT 7666 ATOM 60345 O WAT 7667 46.941 124.648 119.064 1.00 0.00 O ATOM 60346 H1 WAT 7667 46.628 123.746 119.130 1.00 0.00 H ATOM 60347 H2 WAT 7667 47.801 124.574 118.650 1.00 0.00 H TER 60349 WAT 7667 ATOM 60349 O WAT 7668 15.826 107.386 85.383 1.00 0.00 O ATOM 60350 H1 WAT 7668 15.977 106.698 86.031 1.00 0.00 H ATOM 60351 H2 WAT 7668 15.869 106.935 84.540 1.00 0.00 H TER 60353 WAT 7668 ATOM 60353 O WAT 7669 29.213 32.388 79.503 1.00 0.00 O ATOM 60354 H1 WAT 7669 28.933 32.229 80.404 1.00 0.00 H ATOM 60355 H2 WAT 7669 29.282 31.515 79.115 1.00 0.00 H TER 60357 WAT 7669 ATOM 60357 O WAT 7670 23.202 66.112 122.397 1.00 0.00 O ATOM 60358 H1 WAT 7670 23.110 66.054 123.348 1.00 0.00 H ATOM 60359 H2 WAT 7670 22.303 66.092 122.067 1.00 0.00 H TER 60361 WAT 7670 ATOM 60361 O WAT 7671 132.564 41.058 123.877 1.00 0.00 O ATOM 60362 H1 WAT 7671 132.037 41.830 123.671 1.00 0.00 H ATOM 60363 H2 WAT 7671 131.948 40.327 123.827 1.00 0.00 H TER 60365 WAT 7671 ATOM 60365 O WAT 7672 27.295 36.572 135.272 1.00 0.00 O ATOM 60366 H1 WAT 7672 26.644 35.872 135.219 1.00 0.00 H ATOM 60367 H2 WAT 7672 26.919 37.204 135.884 1.00 0.00 H TER 60369 WAT 7672 ATOM 60369 O WAT 7673 33.875 10.882 128.231 1.00 0.00 O ATOM 60370 H1 WAT 7673 34.562 10.339 127.844 1.00 0.00 H ATOM 60371 H2 WAT 7673 34.299 11.724 128.394 1.00 0.00 H TER 60373 WAT 7673 ATOM 60373 O WAT 7674 101.203 22.565 56.712 1.00 0.00 O ATOM 60374 H1 WAT 7674 101.161 23.414 57.151 1.00 0.00 H ATOM 60375 H2 WAT 7674 101.947 22.121 57.119 1.00 0.00 H TER 60377 WAT 7674 ATOM 60377 O WAT 7675 19.856 142.929 2.572 1.00 0.00 O ATOM 60378 H1 WAT 7675 19.004 142.858 3.004 1.00 0.00 H ATOM 60379 H2 WAT 7675 19.655 142.881 1.637 1.00 0.00 H TER 60381 WAT 7675 ATOM 60381 O WAT 7676 122.469 128.007 78.940 1.00 0.00 O ATOM 60382 H1 WAT 7676 123.050 127.519 79.523 1.00 0.00 H ATOM 60383 H2 WAT 7676 122.974 128.113 78.133 1.00 0.00 H TER 60385 WAT 7676 ATOM 60385 O WAT 7677 8.749 75.994 67.465 1.00 0.00 O ATOM 60386 H1 WAT 7677 7.996 75.889 66.883 1.00 0.00 H ATOM 60387 H2 WAT 7677 8.366 76.212 68.315 1.00 0.00 H TER 60389 WAT 7677 ATOM 60389 O WAT 7678 3.665 71.530 92.718 1.00 0.00 O ATOM 60390 H1 WAT 7678 4.029 71.158 91.914 1.00 0.00 H ATOM 60391 H2 WAT 7678 4.431 71.779 93.235 1.00 0.00 H TER 60393 WAT 7678 ATOM 60393 O WAT 7679 96.432 81.821 5.648 1.00 0.00 O ATOM 60394 H1 WAT 7679 96.128 81.981 6.542 1.00 0.00 H ATOM 60395 H2 WAT 7679 96.854 80.963 5.689 1.00 0.00 H TER 60397 WAT 7679 ATOM 60397 O WAT 7680 22.591 140.909 135.113 1.00 0.00 O ATOM 60398 H1 WAT 7680 23.356 141.344 135.491 1.00 0.00 H ATOM 60399 H2 WAT 7680 21.883 141.546 135.205 1.00 0.00 H TER 60401 WAT 7680 ATOM 60401 O WAT 7681 90.900 49.272 8.598 1.00 0.00 O ATOM 60402 H1 WAT 7681 90.408 48.602 9.073 1.00 0.00 H ATOM 60403 H2 WAT 7681 91.787 49.215 8.953 1.00 0.00 H TER 60405 WAT 7681 ATOM 60405 O WAT 7682 63.261 121.474 100.364 1.00 0.00 O ATOM 60406 H1 WAT 7682 62.356 121.164 100.390 1.00 0.00 H ATOM 60407 H2 WAT 7682 63.773 120.702 100.124 1.00 0.00 H TER 60409 WAT 7682 ATOM 60409 O WAT 7683 85.557 56.345 73.434 1.00 0.00 O ATOM 60410 H1 WAT 7683 84.779 56.129 73.948 1.00 0.00 H ATOM 60411 H2 WAT 7683 85.499 55.782 72.663 1.00 0.00 H TER 60413 WAT 7683 ATOM 60413 O WAT 7684 130.354 39.519 138.650 1.00 0.00 O ATOM 60414 H1 WAT 7684 129.951 39.335 137.802 1.00 0.00 H ATOM 60415 H2 WAT 7684 131.187 39.046 138.627 1.00 0.00 H TER 60417 WAT 7684 ATOM 60417 O WAT 7685 133.072 17.089 58.825 1.00 0.00 O ATOM 60418 H1 WAT 7685 132.664 16.255 58.594 1.00 0.00 H ATOM 60419 H2 WAT 7685 132.352 17.719 58.815 1.00 0.00 H TER 60421 WAT 7685 ATOM 60421 O WAT 7686 17.033 133.289 150.984 1.00 0.00 O ATOM 60422 H1 WAT 7686 16.604 133.799 151.671 1.00 0.00 H ATOM 60423 H2 WAT 7686 16.319 132.818 150.554 1.00 0.00 H TER 60425 WAT 7686 ATOM 60425 O WAT 7687 72.171 104.679 92.696 1.00 0.00 O ATOM 60426 H1 WAT 7687 72.761 103.928 92.635 1.00 0.00 H ATOM 60427 H2 WAT 7687 72.124 105.020 91.803 1.00 0.00 H TER 60429 WAT 7687 ATOM 60429 O WAT 7688 40.117 20.038 71.826 1.00 0.00 O ATOM 60430 H1 WAT 7688 40.092 19.797 72.752 1.00 0.00 H ATOM 60431 H2 WAT 7688 40.653 19.358 71.416 1.00 0.00 H TER 60433 WAT 7688 ATOM 60433 O WAT 7689 127.317 2.983 11.028 1.00 0.00 O ATOM 60434 H1 WAT 7689 126.382 3.079 11.210 1.00 0.00 H ATOM 60435 H2 WAT 7689 127.572 2.188 11.496 1.00 0.00 H TER 60437 WAT 7689 ATOM 60437 O WAT 7690 87.860 58.235 3.749 1.00 0.00 O ATOM 60438 H1 WAT 7690 88.783 58.468 3.846 1.00 0.00 H ATOM 60439 H2 WAT 7690 87.386 59.028 4.001 1.00 0.00 H TER 60441 WAT 7690 ATOM 60441 O WAT 7691 12.120 27.886 109.619 1.00 0.00 O ATOM 60442 H1 WAT 7691 12.469 27.019 109.826 1.00 0.00 H ATOM 60443 H2 WAT 7691 12.140 28.358 110.452 1.00 0.00 H TER 60445 WAT 7691 ATOM 60445 O WAT 7692 89.172 133.767 132.747 1.00 0.00 O ATOM 60446 H1 WAT 7692 89.413 132.849 132.870 1.00 0.00 H ATOM 60447 H2 WAT 7692 89.987 134.249 132.887 1.00 0.00 H TER 60449 WAT 7692 ATOM 60449 O WAT 7693 133.082 38.684 6.890 1.00 0.00 O ATOM 60450 H1 WAT 7693 132.728 39.465 6.465 1.00 0.00 H ATOM 60451 H2 WAT 7693 134.026 38.836 6.923 1.00 0.00 H TER 60453 WAT 7693 ATOM 60453 O WAT 7694 100.170 98.463 138.519 1.00 0.00 O ATOM 60454 H1 WAT 7694 99.905 99.379 138.597 1.00 0.00 H ATOM 60455 H2 WAT 7694 100.960 98.486 137.980 1.00 0.00 H TER 60457 WAT 7694 ATOM 60457 O WAT 7695 67.868 128.305 82.684 1.00 0.00 O ATOM 60458 H1 WAT 7695 67.596 127.470 83.065 1.00 0.00 H ATOM 60459 H2 WAT 7695 67.478 128.967 83.255 1.00 0.00 H TER 60461 WAT 7695 ATOM 60461 O WAT 7696 33.311 0.038 13.574 1.00 0.00 O ATOM 60462 H1 WAT 7696 32.861 -0.719 13.948 1.00 0.00 H ATOM 60463 H2 WAT 7696 32.653 0.733 13.576 1.00 0.00 H TER 60465 WAT 7696 ATOM 60465 O WAT 7697 143.139 101.712 100.102 1.00 0.00 O ATOM 60466 H1 WAT 7697 142.356 101.887 99.580 1.00 0.00 H ATOM 60467 H2 WAT 7697 143.743 102.419 99.872 1.00 0.00 H TER 60469 WAT 7697 ATOM 60469 O WAT 7698 72.940 14.586 76.748 1.00 0.00 O ATOM 60470 H1 WAT 7698 72.704 15.393 77.206 1.00 0.00 H ATOM 60471 H2 WAT 7698 73.403 14.064 77.403 1.00 0.00 H TER 60473 WAT 7698 ATOM 60473 O WAT 7699 9.666 11.149 58.930 1.00 0.00 O ATOM 60474 H1 WAT 7699 9.933 10.299 59.279 1.00 0.00 H ATOM 60475 H2 WAT 7699 10.431 11.710 59.052 1.00 0.00 H TER 60477 WAT 7699 ATOM 60477 O WAT 7700 112.711 11.794 90.665 1.00 0.00 O ATOM 60478 H1 WAT 7700 112.803 12.228 91.514 1.00 0.00 H ATOM 60479 H2 WAT 7700 113.269 11.019 90.731 1.00 0.00 H TER 60481 WAT 7700 ATOM 60481 O WAT 7701 72.780 12.623 151.510 1.00 0.00 O ATOM 60482 H1 WAT 7701 73.073 13.515 151.696 1.00 0.00 H ATOM 60483 H2 WAT 7701 73.339 12.069 152.054 1.00 0.00 H TER 60485 WAT 7701 ATOM 60485 O WAT 7702 118.990 57.415 70.960 1.00 0.00 O ATOM 60486 H1 WAT 7702 118.929 56.962 70.119 1.00 0.00 H ATOM 60487 H2 WAT 7702 119.922 57.610 71.060 1.00 0.00 H TER 60489 WAT 7702 ATOM 60489 O WAT 7703 121.212 58.679 6.178 1.00 0.00 O ATOM 60490 H1 WAT 7703 121.368 58.200 5.364 1.00 0.00 H ATOM 60491 H2 WAT 7703 121.770 59.454 6.112 1.00 0.00 H TER 60493 WAT 7703 ATOM 60493 O WAT 7704 45.705 94.997 112.933 1.00 0.00 O ATOM 60494 H1 WAT 7704 45.138 95.631 112.494 1.00 0.00 H ATOM 60495 H2 WAT 7704 45.743 94.253 112.332 1.00 0.00 H TER 60497 WAT 7704 ATOM 60497 O WAT 7705 37.179 6.123 97.200 1.00 0.00 O ATOM 60498 H1 WAT 7705 37.576 6.974 97.013 1.00 0.00 H ATOM 60499 H2 WAT 7705 36.317 6.334 97.559 1.00 0.00 H TER 60501 WAT 7705 ATOM 60501 O WAT 7706 123.865 53.168 80.625 1.00 0.00 O ATOM 60502 H1 WAT 7706 123.918 52.803 79.742 1.00 0.00 H ATOM 60503 H2 WAT 7706 124.755 53.464 80.816 1.00 0.00 H TER 60505 WAT 7706 ATOM 60505 O WAT 7707 66.858 91.680 61.809 1.00 0.00 O ATOM 60506 H1 WAT 7707 66.666 91.408 62.707 1.00 0.00 H ATOM 60507 H2 WAT 7707 67.814 91.685 61.760 1.00 0.00 H TER 60509 WAT 7707 ATOM 60509 O WAT 7708 83.031 41.782 101.533 1.00 0.00 O ATOM 60510 H1 WAT 7708 82.682 42.294 100.804 1.00 0.00 H ATOM 60511 H2 WAT 7708 83.277 42.435 102.189 1.00 0.00 H TER 60513 WAT 7708 ATOM 60513 O WAT 7709 135.591 32.565 21.487 1.00 0.00 O ATOM 60514 H1 WAT 7709 135.679 33.222 22.178 1.00 0.00 H ATOM 60515 H2 WAT 7709 136.304 32.760 20.879 1.00 0.00 H TER 60517 WAT 7709 ATOM 60517 O WAT 7710 102.509 68.146 143.266 1.00 0.00 O ATOM 60518 H1 WAT 7710 103.037 67.583 143.832 1.00 0.00 H ATOM 60519 H2 WAT 7710 102.271 68.889 143.822 1.00 0.00 H TER 60521 WAT 7710 ATOM 60521 O WAT 7711 36.643 25.338 9.356 1.00 0.00 O ATOM 60522 H1 WAT 7711 36.096 26.071 9.074 1.00 0.00 H ATOM 60523 H2 WAT 7711 37.504 25.727 9.510 1.00 0.00 H TER 60525 WAT 7711 ATOM 60525 O WAT 7712 101.383 15.263 109.696 1.00 0.00 O ATOM 60526 H1 WAT 7712 101.453 16.082 110.186 1.00 0.00 H ATOM 60527 H2 WAT 7712 101.847 14.621 110.234 1.00 0.00 H TER 60529 WAT 7712 ATOM 60529 O WAT 7713 135.082 15.759 150.724 1.00 0.00 O ATOM 60530 H1 WAT 7713 134.924 14.966 150.211 1.00 0.00 H ATOM 60531 H2 WAT 7713 135.821 15.535 151.289 1.00 0.00 H TER 60533 WAT 7713 ATOM 60533 O WAT 7714 30.102 7.741 85.203 1.00 0.00 O ATOM 60534 H1 WAT 7714 29.477 8.325 84.773 1.00 0.00 H ATOM 60535 H2 WAT 7714 29.607 7.351 85.924 1.00 0.00 H TER 60537 WAT 7714 ATOM 60537 O WAT 7715 12.259 104.037 59.141 1.00 0.00 O ATOM 60538 H1 WAT 7715 13.037 104.107 58.588 1.00 0.00 H ATOM 60539 H2 WAT 7715 12.423 104.643 59.864 1.00 0.00 H TER 60541 WAT 7715 ATOM 60541 O WAT 7716 51.504 111.695 108.345 1.00 0.00 O ATOM 60542 H1 WAT 7716 51.368 112.491 108.859 1.00 0.00 H ATOM 60543 H2 WAT 7716 52.378 111.395 108.595 1.00 0.00 H TER 60545 WAT 7716 ATOM 60545 O WAT 7717 135.676 39.013 116.577 1.00 0.00 O ATOM 60546 H1 WAT 7717 135.452 38.270 117.137 1.00 0.00 H ATOM 60547 H2 WAT 7717 136.524 38.779 116.198 1.00 0.00 H TER 60549 WAT 7717 ATOM 60549 O WAT 7718 116.007 113.238 124.688 1.00 0.00 O ATOM 60550 H1 WAT 7718 115.550 113.871 124.134 1.00 0.00 H ATOM 60551 H2 WAT 7718 116.117 112.468 124.131 1.00 0.00 H TER 60553 WAT 7718 ATOM 60553 O WAT 7719 123.774 115.467 7.878 1.00 0.00 O ATOM 60554 H1 WAT 7719 123.635 115.342 6.939 1.00 0.00 H ATOM 60555 H2 WAT 7719 124.419 114.800 8.115 1.00 0.00 H TER 60557 WAT 7719 ATOM 60557 O WAT 7720 55.471 37.598 155.361 1.00 0.00 O ATOM 60558 H1 WAT 7720 54.928 38.266 154.943 1.00 0.00 H ATOM 60559 H2 WAT 7720 56.278 37.588 154.847 1.00 0.00 H TER 60561 WAT 7720 ATOM 60561 O WAT 7721 135.397 85.298 75.109 1.00 0.00 O ATOM 60562 H1 WAT 7721 135.548 84.398 74.821 1.00 0.00 H ATOM 60563 H2 WAT 7721 136.107 85.475 75.726 1.00 0.00 H TER 60565 WAT 7721 ATOM 60565 O WAT 7722 64.243 22.651 1.657 1.00 0.00 O ATOM 60566 H1 WAT 7722 63.684 22.102 1.106 1.00 0.00 H ATOM 60567 H2 WAT 7722 65.004 22.102 1.848 1.00 0.00 H TER 60569 WAT 7722 ATOM 60569 O WAT 7723 29.128 28.496 135.754 1.00 0.00 O ATOM 60570 H1 WAT 7723 29.049 27.802 136.408 1.00 0.00 H ATOM 60571 H2 WAT 7723 30.007 28.384 135.391 1.00 0.00 H TER 60573 WAT 7723 ATOM 60573 O WAT 7724 28.741 6.371 87.166 1.00 0.00 O ATOM 60574 H1 WAT 7724 27.886 6.743 87.381 1.00 0.00 H ATOM 60575 H2 WAT 7724 29.247 6.449 87.975 1.00 0.00 H TER 60577 WAT 7724 ATOM 60577 O WAT 7725 134.882 79.743 80.137 1.00 0.00 O ATOM 60578 H1 WAT 7725 133.986 80.066 80.041 1.00 0.00 H ATOM 60579 H2 WAT 7725 134.942 79.015 79.518 1.00 0.00 H TER 60581 WAT 7725 ATOM 60581 O WAT 7726 124.151 131.187 141.004 1.00 0.00 O ATOM 60582 H1 WAT 7726 123.980 131.030 140.075 1.00 0.00 H ATOM 60583 H2 WAT 7726 123.525 131.868 141.251 1.00 0.00 H TER 60585 WAT 7726 ATOM 60585 O WAT 7727 125.675 142.300 78.902 1.00 0.00 O ATOM 60586 H1 WAT 7727 126.315 142.371 78.194 1.00 0.00 H ATOM 60587 H2 WAT 7727 126.031 142.847 79.603 1.00 0.00 H TER 60589 WAT 7727 ATOM 60589 O WAT 7728 43.967 108.821 69.853 1.00 0.00 O ATOM 60590 H1 WAT 7728 44.101 108.212 69.126 1.00 0.00 H ATOM 60591 H2 WAT 7728 43.614 109.610 69.443 1.00 0.00 H TER 60593 WAT 7728 ATOM 60593 O WAT 7729 62.224 14.906 65.197 1.00 0.00 O ATOM 60594 H1 WAT 7729 62.933 15.059 65.821 1.00 0.00 H ATOM 60595 H2 WAT 7729 62.354 15.571 64.520 1.00 0.00 H TER 60597 WAT 7729 ATOM 60597 O WAT 7730 72.237 126.248 10.136 1.00 0.00 O ATOM 60598 H1 WAT 7730 71.299 126.090 10.030 1.00 0.00 H ATOM 60599 H2 WAT 7730 72.409 126.051 11.057 1.00 0.00 H TER 60601 WAT 7730 ATOM 60601 O WAT 7731 132.566 89.745 133.144 1.00 0.00 O ATOM 60602 H1 WAT 7731 132.208 89.801 132.258 1.00 0.00 H ATOM 60603 H2 WAT 7731 131.991 89.128 133.596 1.00 0.00 H TER 60605 WAT 7731 ATOM 60605 O WAT 7732 13.700 61.646 134.584 1.00 0.00 O ATOM 60606 H1 WAT 7732 13.718 62.095 135.429 1.00 0.00 H ATOM 60607 H2 WAT 7732 12.994 61.005 134.669 1.00 0.00 H TER 60609 WAT 7732 ATOM 60609 O WAT 7733 55.521 123.695 122.111 1.00 0.00 O ATOM 60610 H1 WAT 7733 55.757 123.427 121.223 1.00 0.00 H ATOM 60611 H2 WAT 7733 54.587 123.497 122.180 1.00 0.00 H TER 60613 WAT 7733 ATOM 60613 O WAT 7734 53.158 0.304 5.451 1.00 0.00 O ATOM 60614 H1 WAT 7734 53.351 0.233 4.516 1.00 0.00 H ATOM 60615 H2 WAT 7734 52.953 1.229 5.584 1.00 0.00 H TER 60617 WAT 7734 ATOM 60617 O WAT 7735 88.209 85.314 77.852 1.00 0.00 O ATOM 60618 H1 WAT 7735 87.906 84.712 77.173 1.00 0.00 H ATOM 60619 H2 WAT 7735 87.524 85.981 77.904 1.00 0.00 H TER 60621 WAT 7735 ATOM 60621 O WAT 7736 78.603 54.825 121.669 1.00 0.00 O ATOM 60622 H1 WAT 7736 78.187 55.450 121.075 1.00 0.00 H ATOM 60623 H2 WAT 7736 79.515 54.792 121.380 1.00 0.00 H TER 60625 WAT 7736 ATOM 60625 O WAT 7737 110.450 145.588 7.407 1.00 0.00 O ATOM 60626 H1 WAT 7737 110.918 145.929 8.169 1.00 0.00 H ATOM 60627 H2 WAT 7737 110.746 146.134 6.679 1.00 0.00 H TER 60629 WAT 7737 ATOM 60629 O WAT 7738 93.283 18.693 122.511 1.00 0.00 O ATOM 60630 H1 WAT 7738 93.771 17.947 122.162 1.00 0.00 H ATOM 60631 H2 WAT 7738 93.850 19.447 122.350 1.00 0.00 H TER 60633 WAT 7738 ATOM 60633 O WAT 7739 128.807 6.465 85.564 1.00 0.00 O ATOM 60634 H1 WAT 7739 128.199 5.937 86.082 1.00 0.00 H ATOM 60635 H2 WAT 7739 128.397 6.523 84.701 1.00 0.00 H TER 60637 WAT 7739 ATOM 60637 O WAT 7740 2.981 106.641 152.210 1.00 0.00 O ATOM 60638 H1 WAT 7740 2.029 106.614 152.112 1.00 0.00 H ATOM 60639 H2 WAT 7740 3.314 106.629 151.312 1.00 0.00 H TER 60641 WAT 7740 ATOM 60641 O WAT 7741 21.274 53.843 124.265 1.00 0.00 O ATOM 60642 H1 WAT 7741 20.782 54.655 124.144 1.00 0.00 H ATOM 60643 H2 WAT 7741 21.400 53.504 123.379 1.00 0.00 H TER 60645 WAT 7741 ATOM 60645 O WAT 7742 78.720 127.255 0.403 1.00 0.00 O ATOM 60646 H1 WAT 7742 77.864 126.854 0.256 1.00 0.00 H ATOM 60647 H2 WAT 7742 78.720 128.033 -0.154 1.00 0.00 H TER 60649 WAT 7742 ATOM 60649 O WAT 7743 2.842 52.993 129.250 1.00 0.00 O ATOM 60650 H1 WAT 7743 2.782 53.111 130.198 1.00 0.00 H ATOM 60651 H2 WAT 7743 2.343 53.724 128.886 1.00 0.00 H TER 60653 WAT 7743 ATOM 60653 O WAT 7744 75.975 39.997 82.420 1.00 0.00 O ATOM 60654 H1 WAT 7744 75.159 40.471 82.259 1.00 0.00 H ATOM 60655 H2 WAT 7744 76.358 40.432 83.181 1.00 0.00 H TER 60657 WAT 7744 ATOM 60657 O WAT 7745 118.147 115.497 108.177 1.00 0.00 O ATOM 60658 H1 WAT 7745 118.272 114.779 107.556 1.00 0.00 H ATOM 60659 H2 WAT 7745 117.203 115.516 108.334 1.00 0.00 H TER 60661 WAT 7745 ATOM 60661 O WAT 7746 26.623 77.386 91.487 1.00 0.00 O ATOM 60662 H1 WAT 7746 25.853 77.764 91.062 1.00 0.00 H ATOM 60663 H2 WAT 7746 26.890 76.672 90.907 1.00 0.00 H TER 60665 WAT 7746 ATOM 60665 O WAT 7747 13.660 65.779 93.136 1.00 0.00 O ATOM 60666 H1 WAT 7747 14.066 66.592 93.438 1.00 0.00 H ATOM 60667 H2 WAT 7747 13.346 65.981 92.255 1.00 0.00 H TER 60669 WAT 7747 ATOM 60669 O WAT 7748 103.082 82.908 72.609 1.00 0.00 O ATOM 60670 H1 WAT 7748 103.215 82.984 73.553 1.00 0.00 H ATOM 60671 H2 WAT 7748 102.603 82.086 72.499 1.00 0.00 H TER 60673 WAT 7748 ATOM 60673 O WAT 7749 104.935 79.421 111.913 1.00 0.00 O ATOM 60674 H1 WAT 7749 104.230 79.494 111.270 1.00 0.00 H ATOM 60675 H2 WAT 7749 104.841 80.200 112.461 1.00 0.00 H TER 60677 WAT 7749 ATOM 60677 O WAT 7750 69.360 64.326 81.460 1.00 0.00 O ATOM 60678 H1 WAT 7750 68.642 63.866 81.895 1.00 0.00 H ATOM 60679 H2 WAT 7750 69.640 64.987 82.093 1.00 0.00 H TER 60681 WAT 7750 ATOM 60681 O WAT 7751 1.959 137.477 13.643 1.00 0.00 O ATOM 60682 H1 WAT 7751 2.667 137.250 14.247 1.00 0.00 H ATOM 60683 H2 WAT 7751 2.114 136.926 12.876 1.00 0.00 H TER 60685 WAT 7751 ATOM 60685 O WAT 7752 0.783 78.157 107.878 1.00 0.00 O ATOM 60686 H1 WAT 7752 0.259 78.942 107.724 1.00 0.00 H ATOM 60687 H2 WAT 7752 0.144 77.486 108.119 1.00 0.00 H TER 60689 WAT 7752 ATOM 60689 O WAT 7753 116.916 59.218 86.535 1.00 0.00 O ATOM 60690 H1 WAT 7753 116.452 58.388 86.426 1.00 0.00 H ATOM 60691 H2 WAT 7753 116.322 59.874 86.169 1.00 0.00 H TER 60693 WAT 7753 ATOM 60693 O WAT 7754 96.427 16.642 96.720 1.00 0.00 O ATOM 60694 H1 WAT 7754 96.612 17.431 96.210 1.00 0.00 H ATOM 60695 H2 WAT 7754 96.875 16.785 97.553 1.00 0.00 H TER 60697 WAT 7754 ATOM 60697 O WAT 7755 26.917 45.126 128.254 1.00 0.00 O ATOM 60698 H1 WAT 7755 27.614 45.783 128.252 1.00 0.00 H ATOM 60699 H2 WAT 7755 27.315 44.355 128.657 1.00 0.00 H TER 60701 WAT 7755 ATOM 60701 O WAT 7756 102.229 144.778 157.381 1.00 0.00 O ATOM 60702 H1 WAT 7756 102.626 144.466 156.568 1.00 0.00 H ATOM 60703 H2 WAT 7756 102.899 145.335 157.777 1.00 0.00 H TER 60705 WAT 7756 ATOM 60705 O WAT 7757 24.133 114.302 92.157 1.00 0.00 O ATOM 60706 H1 WAT 7757 24.163 114.913 91.421 1.00 0.00 H ATOM 60707 H2 WAT 7757 25.046 114.214 92.432 1.00 0.00 H TER 60709 WAT 7757 ATOM 60709 O WAT 7758 119.954 43.613 74.055 1.00 0.00 O ATOM 60710 H1 WAT 7758 120.264 42.782 74.415 1.00 0.00 H ATOM 60711 H2 WAT 7758 119.537 43.374 73.227 1.00 0.00 H TER 60713 WAT 7758 ATOM 60713 O WAT 7759 72.296 48.947 23.252 1.00 0.00 O ATOM 60714 H1 WAT 7759 71.499 49.476 23.267 1.00 0.00 H ATOM 60715 H2 WAT 7759 72.114 48.223 23.852 1.00 0.00 H TER 60717 WAT 7759 ATOM 60717 O WAT 7760 95.032 72.171 77.970 1.00 0.00 O ATOM 60718 H1 WAT 7760 95.629 71.495 77.647 1.00 0.00 H ATOM 60719 H2 WAT 7760 94.732 72.621 77.181 1.00 0.00 H TER 60721 WAT 7760 ATOM 60721 O WAT 7761 50.864 78.173 75.592 1.00 0.00 O ATOM 60722 H1 WAT 7761 51.431 77.668 76.175 1.00 0.00 H ATOM 60723 H2 WAT 7761 50.246 78.610 76.178 1.00 0.00 H TER 60725 WAT 7761 ATOM 60725 O WAT 7762 96.925 110.732 144.295 1.00 0.00 O ATOM 60726 H1 WAT 7762 97.781 111.157 144.334 1.00 0.00 H ATOM 60727 H2 WAT 7762 97.004 110.095 143.585 1.00 0.00 H TER 60729 WAT 7762 ATOM 60729 O WAT 7763 132.446 5.125 133.417 1.00 0.00 O ATOM 60730 H1 WAT 7763 131.593 5.555 133.478 1.00 0.00 H ATOM 60731 H2 WAT 7763 133.053 5.737 133.833 1.00 0.00 H TER 60733 WAT 7763 ATOM 60733 O WAT 7764 62.531 5.934 92.239 1.00 0.00 O ATOM 60734 H1 WAT 7764 62.531 6.731 91.709 1.00 0.00 H ATOM 60735 H2 WAT 7764 62.338 5.233 91.617 1.00 0.00 H TER 60737 WAT 7764 ATOM 60737 O WAT 7765 96.949 53.464 12.309 1.00 0.00 O ATOM 60738 H1 WAT 7765 96.035 53.289 12.084 1.00 0.00 H ATOM 60739 H2 WAT 7765 96.913 54.230 12.881 1.00 0.00 H TER 60741 WAT 7765 ATOM 60741 O WAT 7766 18.030 118.859 140.317 1.00 0.00 O ATOM 60742 H1 WAT 7766 17.739 119.174 139.461 1.00 0.00 H ATOM 60743 H2 WAT 7766 18.462 118.025 140.132 1.00 0.00 H TER 60745 WAT 7766 ATOM 60745 O WAT 7767 120.874 116.760 3.712 1.00 0.00 O ATOM 60746 H1 WAT 7767 120.411 116.139 4.274 1.00 0.00 H ATOM 60747 H2 WAT 7767 120.761 116.414 2.827 1.00 0.00 H TER 60749 WAT 7767 ATOM 60749 O WAT 7768 27.082 104.658 64.160 1.00 0.00 O ATOM 60750 H1 WAT 7768 27.380 104.603 63.253 1.00 0.00 H ATOM 60751 H2 WAT 7768 26.667 103.811 64.328 1.00 0.00 H TER 60753 WAT 7768 ATOM 60753 O WAT 7769 97.946 42.691 129.586 1.00 0.00 O ATOM 60754 H1 WAT 7769 98.022 43.059 128.706 1.00 0.00 H ATOM 60755 H2 WAT 7769 98.295 43.371 130.161 1.00 0.00 H TER 60757 WAT 7769 ATOM 60757 O WAT 7770 80.730 94.414 59.175 1.00 0.00 O ATOM 60758 H1 WAT 7770 79.913 94.762 58.816 1.00 0.00 H ATOM 60759 H2 WAT 7770 81.224 95.190 59.441 1.00 0.00 H TER 60761 WAT 7770 ATOM 60761 O WAT 7771 70.928 30.942 122.044 1.00 0.00 O ATOM 60762 H1 WAT 7771 70.469 30.430 122.710 1.00 0.00 H ATOM 60763 H2 WAT 7771 71.643 31.365 122.519 1.00 0.00 H TER 60765 WAT 7771 ATOM 60765 O WAT 7772 131.247 116.389 75.879 1.00 0.00 O ATOM 60766 H1 WAT 7772 132.162 116.275 75.621 1.00 0.00 H ATOM 60767 H2 WAT 7772 131.233 117.221 76.352 1.00 0.00 H TER 60769 WAT 7772 ATOM 60769 O WAT 7773 49.288 113.908 71.267 1.00 0.00 O ATOM 60770 H1 WAT 7773 50.007 114.361 71.709 1.00 0.00 H ATOM 60771 H2 WAT 7773 49.570 113.844 70.355 1.00 0.00 H TER 60773 WAT 7773 ATOM 60773 O WAT 7774 27.801 50.352 65.210 1.00 0.00 O ATOM 60774 H1 WAT 7774 28.367 49.789 64.682 1.00 0.00 H ATOM 60775 H2 WAT 7774 28.406 50.875 65.735 1.00 0.00 H TER 60777 WAT 7774 ATOM 60777 O WAT 7775 71.050 138.237 135.096 1.00 0.00 O ATOM 60778 H1 WAT 7775 70.970 139.189 135.043 1.00 0.00 H ATOM 60779 H2 WAT 7775 70.475 137.909 134.404 1.00 0.00 H TER 60781 WAT 7775 ATOM 60781 O WAT 7776 95.236 127.132 151.456 1.00 0.00 O ATOM 60782 H1 WAT 7776 94.417 127.416 151.049 1.00 0.00 H ATOM 60783 H2 WAT 7776 95.037 126.270 151.819 1.00 0.00 H TER 60785 WAT 7776 ATOM 60785 O WAT 7777 96.653 100.406 87.240 1.00 0.00 O ATOM 60786 H1 WAT 7777 96.887 100.850 88.055 1.00 0.00 H ATOM 60787 H2 WAT 7777 97.316 99.723 87.140 1.00 0.00 H TER 60789 WAT 7777 ATOM 60789 O WAT 7778 66.779 82.843 76.317 1.00 0.00 O ATOM 60790 H1 WAT 7778 67.665 82.485 76.261 1.00 0.00 H ATOM 60791 H2 WAT 7778 66.267 82.311 75.708 1.00 0.00 H TER 60793 WAT 7778 ATOM 60793 O WAT 7779 104.235 9.384 110.863 1.00 0.00 O ATOM 60794 H1 WAT 7779 103.306 9.451 111.081 1.00 0.00 H ATOM 60795 H2 WAT 7779 104.297 9.720 109.969 1.00 0.00 H TER 60797 WAT 7779 ATOM 60797 O WAT 7780 55.445 5.844 71.259 1.00 0.00 O ATOM 60798 H1 WAT 7780 55.318 6.723 70.901 1.00 0.00 H ATOM 60799 H2 WAT 7780 55.367 5.958 72.206 1.00 0.00 H TER 60801 WAT 7780 ATOM 60801 O WAT 7781 117.131 92.243 13.457 1.00 0.00 O ATOM 60802 H1 WAT 7781 117.453 92.612 12.635 1.00 0.00 H ATOM 60803 H2 WAT 7781 116.720 92.981 13.907 1.00 0.00 H TER 60805 WAT 7781 ATOM 60805 O WAT 7782 114.962 108.384 0.234 1.00 0.00 O ATOM 60806 H1 WAT 7782 115.153 107.552 0.669 1.00 0.00 H ATOM 60807 H2 WAT 7782 115.756 108.581 -0.263 1.00 0.00 H TER 60809 WAT 7782 ATOM 60809 O WAT 7783 11.184 89.614 125.522 1.00 0.00 O ATOM 60810 H1 WAT 7783 10.766 90.373 125.929 1.00 0.00 H ATOM 60811 H2 WAT 7783 11.505 89.940 124.681 1.00 0.00 H TER 60813 WAT 7783 ATOM 60813 O WAT 7784 64.943 119.521 66.884 1.00 0.00 O ATOM 60814 H1 WAT 7784 65.679 119.161 66.389 1.00 0.00 H ATOM 60815 H2 WAT 7784 65.176 120.439 67.025 1.00 0.00 H TER 60817 WAT 7784 ATOM 60817 O WAT 7785 52.571 21.807 139.529 1.00 0.00 O ATOM 60818 H1 WAT 7785 51.814 22.162 139.997 1.00 0.00 H ATOM 60819 H2 WAT 7785 52.685 22.392 138.780 1.00 0.00 H TER 60821 WAT 7785 ATOM 60821 O WAT 7786 114.858 13.321 84.705 1.00 0.00 O ATOM 60822 H1 WAT 7786 114.820 13.172 83.761 1.00 0.00 H ATOM 60823 H2 WAT 7786 114.662 12.468 85.091 1.00 0.00 H TER 60825 WAT 7786 ATOM 60825 O WAT 7787 143.796 75.195 72.961 1.00 0.00 O ATOM 60826 H1 WAT 7787 143.846 76.103 73.260 1.00 0.00 H ATOM 60827 H2 WAT 7787 144.703 74.887 72.978 1.00 0.00 H TER 60829 WAT 7787 ATOM 60829 O WAT 7788 4.114 80.640 87.107 1.00 0.00 O ATOM 60830 H1 WAT 7788 3.766 81.530 87.149 1.00 0.00 H ATOM 60831 H2 WAT 7788 3.367 80.080 87.320 1.00 0.00 H TER 60833 WAT 7788 ATOM 60833 O WAT 7789 9.363 13.003 85.024 1.00 0.00 O ATOM 60834 H1 WAT 7789 9.664 12.122 85.249 1.00 0.00 H ATOM 60835 H2 WAT 7789 9.959 13.587 85.492 1.00 0.00 H TER 60837 WAT 7789 ATOM 60837 O WAT 7790 40.110 74.593 115.291 1.00 0.00 O ATOM 60838 H1 WAT 7790 39.737 74.008 114.630 1.00 0.00 H ATOM 60839 H2 WAT 7790 39.761 74.269 116.121 1.00 0.00 H TER 60841 WAT 7790 ATOM 60841 O WAT 7791 66.503 27.964 157.833 1.00 0.00 O ATOM 60842 H1 WAT 7791 67.335 28.410 157.993 1.00 0.00 H ATOM 60843 H2 WAT 7791 66.474 27.845 156.884 1.00 0.00 H TER 60845 WAT 7791 ATOM 60845 O WAT 7792 33.244 93.583 127.686 1.00 0.00 O ATOM 60846 H1 WAT 7792 34.193 93.552 127.572 1.00 0.00 H ATOM 60847 H2 WAT 7792 32.927 92.774 127.285 1.00 0.00 H TER 60849 WAT 7792 ATOM 60849 O WAT 7793 96.777 132.252 126.801 1.00 0.00 O ATOM 60850 H1 WAT 7793 97.647 131.996 126.495 1.00 0.00 H ATOM 60851 H2 WAT 7793 96.230 132.229 126.015 1.00 0.00 H TER 60853 WAT 7793 ATOM 60853 O WAT 7794 22.065 118.754 109.209 1.00 0.00 O ATOM 60854 H1 WAT 7794 21.321 119.347 109.098 1.00 0.00 H ATOM 60855 H2 WAT 7794 21.995 118.142 108.476 1.00 0.00 H TER 60857 WAT 7794 ATOM 60857 O WAT 7795 138.425 94.143 97.601 1.00 0.00 O ATOM 60858 H1 WAT 7795 139.317 94.117 97.254 1.00 0.00 H ATOM 60859 H2 WAT 7795 138.179 95.067 97.560 1.00 0.00 H TER 60861 WAT 7795 ATOM 60861 O WAT 7796 9.681 87.224 134.199 1.00 0.00 O ATOM 60862 H1 WAT 7796 10.504 87.404 134.654 1.00 0.00 H ATOM 60863 H2 WAT 7796 9.015 87.265 134.886 1.00 0.00 H TER 60865 WAT 7796 ATOM 60865 O WAT 7797 20.349 110.746 96.933 1.00 0.00 O ATOM 60866 H1 WAT 7797 19.475 111.132 96.987 1.00 0.00 H ATOM 60867 H2 WAT 7797 20.644 110.946 96.044 1.00 0.00 H TER 60869 WAT 7797 ATOM 60869 O WAT 7798 44.730 44.445 88.461 1.00 0.00 O ATOM 60870 H1 WAT 7798 44.910 43.550 88.750 1.00 0.00 H ATOM 60871 H2 WAT 7798 45.448 44.652 87.862 1.00 0.00 H TER 60873 WAT 7798 ATOM 60873 O WAT 7799 104.395 15.026 85.874 1.00 0.00 O ATOM 60874 H1 WAT 7799 103.887 14.934 86.680 1.00 0.00 H ATOM 60875 H2 WAT 7799 103.761 15.330 85.225 1.00 0.00 H TER 60877 WAT 7799 ATOM 60877 O WAT 7800 11.419 93.484 74.563 1.00 0.00 O ATOM 60878 H1 WAT 7800 11.014 94.067 73.921 1.00 0.00 H ATOM 60879 H2 WAT 7800 12.226 93.188 74.141 1.00 0.00 H TER 60881 WAT 7800 ATOM 60881 O WAT 7801 144.687 65.612 90.073 1.00 0.00 O ATOM 60882 H1 WAT 7801 145.096 64.767 90.257 1.00 0.00 H ATOM 60883 H2 WAT 7801 144.908 65.792 89.159 1.00 0.00 H TER 60885 WAT 7801 ATOM 60885 O WAT 7802 48.619 118.149 4.104 1.00 0.00 O ATOM 60886 H1 WAT 7802 49.450 118.405 3.704 1.00 0.00 H ATOM 60887 H2 WAT 7802 48.855 117.865 4.987 1.00 0.00 H TER 60889 WAT 7802 ATOM 60889 O WAT 7803 15.749 1.043 135.064 1.00 0.00 O ATOM 60890 H1 WAT 7803 15.605 1.978 134.919 1.00 0.00 H ATOM 60891 H2 WAT 7803 15.900 0.968 136.007 1.00 0.00 H TER 60893 WAT 7803 ATOM 60893 O WAT 7804 49.135 71.937 146.652 1.00 0.00 O ATOM 60894 H1 WAT 7804 49.907 72.502 146.648 1.00 0.00 H ATOM 60895 H2 WAT 7804 48.714 72.101 145.807 1.00 0.00 H TER 60897 WAT 7804 ATOM 60897 O WAT 7805 64.665 0.917 124.203 1.00 0.00 O ATOM 60898 H1 WAT 7805 64.056 0.195 124.356 1.00 0.00 H ATOM 60899 H2 WAT 7805 64.944 1.184 125.079 1.00 0.00 H TER 60901 WAT 7805 ATOM 60901 O WAT 7806 8.210 39.238 79.485 1.00 0.00 O ATOM 60902 H1 WAT 7806 8.080 38.306 79.662 1.00 0.00 H ATOM 60903 H2 WAT 7806 7.994 39.338 78.557 1.00 0.00 H TER 60905 WAT 7806 ATOM 60905 O WAT 7807 80.417 102.369 57.988 1.00 0.00 O ATOM 60906 H1 WAT 7807 80.710 103.120 58.504 1.00 0.00 H ATOM 60907 H2 WAT 7807 79.894 101.849 58.598 1.00 0.00 H TER 60909 WAT 7807 ATOM 60909 O WAT 7808 52.558 110.844 4.175 1.00 0.00 O ATOM 60910 H1 WAT 7808 52.411 110.884 5.120 1.00 0.00 H ATOM 60911 H2 WAT 7808 52.437 109.920 3.953 1.00 0.00 H TER 60913 WAT 7808 ATOM 60913 O WAT 7809 0.833 31.127 144.492 1.00 0.00 O ATOM 60914 H1 WAT 7809 1.663 31.543 144.727 1.00 0.00 H ATOM 60915 H2 WAT 7809 0.229 31.857 144.357 1.00 0.00 H TER 60917 WAT 7809 ATOM 60917 O WAT 7810 119.172 51.648 104.179 1.00 0.00 O ATOM 60918 H1 WAT 7810 120.019 51.263 104.406 1.00 0.00 H ATOM 60919 H2 WAT 7810 118.557 50.916 104.224 1.00 0.00 H TER 60921 WAT 7810 ATOM 60921 O WAT 7811 120.295 137.223 11.891 1.00 0.00 O ATOM 60922 H1 WAT 7811 120.507 136.329 11.622 1.00 0.00 H ATOM 60923 H2 WAT 7811 120.148 137.161 12.835 1.00 0.00 H TER 60925 WAT 7811 ATOM 60925 O WAT 7812 81.233 48.554 130.896 1.00 0.00 O ATOM 60926 H1 WAT 7812 81.700 48.335 130.090 1.00 0.00 H ATOM 60927 H2 WAT 7812 81.343 47.784 131.454 1.00 0.00 H TER 60929 WAT 7812 ATOM 60929 O WAT 7813 113.228 44.495 76.983 1.00 0.00 O ATOM 60930 H1 WAT 7813 112.340 44.391 76.641 1.00 0.00 H ATOM 60931 H2 WAT 7813 113.796 44.308 76.236 1.00 0.00 H TER 60933 WAT 7813 ATOM 60933 O WAT 7814 54.509 135.237 60.818 1.00 0.00 O ATOM 60934 H1 WAT 7814 53.816 135.324 60.164 1.00 0.00 H ATOM 60935 H2 WAT 7814 54.049 135.242 61.658 1.00 0.00 H TER 60937 WAT 7814 ATOM 60937 O WAT 7815 60.072 116.081 86.393 1.00 0.00 O ATOM 60938 H1 WAT 7815 59.414 116.584 86.872 1.00 0.00 H ATOM 60939 H2 WAT 7815 59.963 115.183 86.707 1.00 0.00 H TER 60941 WAT 7815 ATOM 60941 O WAT 7816 34.694 59.043 148.496 1.00 0.00 O ATOM 60942 H1 WAT 7816 35.179 59.014 147.672 1.00 0.00 H ATOM 60943 H2 WAT 7816 34.681 59.970 148.734 1.00 0.00 H TER 60945 WAT 7816 ATOM 60945 O WAT 7817 0.648 114.301 144.098 1.00 0.00 O ATOM 60946 H1 WAT 7817 0.309 113.714 143.422 1.00 0.00 H ATOM 60947 H2 WAT 7817 1.598 114.186 144.060 1.00 0.00 H TER 60949 WAT 7817 ATOM 60949 O WAT 7818 71.826 42.237 69.892 1.00 0.00 O ATOM 60950 H1 WAT 7818 71.871 43.120 70.258 1.00 0.00 H ATOM 60951 H2 WAT 7818 70.930 42.159 69.562 1.00 0.00 H TER 60953 WAT 7818 ATOM 60953 O WAT 7819 42.815 63.878 0.693 1.00 0.00 O ATOM 60954 H1 WAT 7819 42.521 63.305 -0.016 1.00 0.00 H ATOM 60955 H2 WAT 7819 43.458 64.457 0.282 1.00 0.00 H TER 60957 WAT 7819 ATOM 60957 O WAT 7820 90.864 33.529 135.584 1.00 0.00 O ATOM 60958 H1 WAT 7820 91.053 34.313 135.069 1.00 0.00 H ATOM 60959 H2 WAT 7820 90.471 33.862 136.391 1.00 0.00 H TER 60961 WAT 7820 ATOM 60961 O WAT 7821 105.641 74.484 92.400 1.00 0.00 O ATOM 60962 H1 WAT 7821 104.883 74.030 92.769 1.00 0.00 H ATOM 60963 H2 WAT 7821 105.279 75.017 91.692 1.00 0.00 H TER 60965 WAT 7821 ATOM 60965 O WAT 7822 112.889 39.425 89.678 1.00 0.00 O ATOM 60966 H1 WAT 7822 113.406 39.131 90.428 1.00 0.00 H ATOM 60967 H2 WAT 7822 112.194 38.772 89.596 1.00 0.00 H TER 60969 WAT 7822 ATOM 60969 O WAT 7823 35.584 84.560 129.235 1.00 0.00 O ATOM 60970 H1 WAT 7823 35.292 84.518 128.325 1.00 0.00 H ATOM 60971 H2 WAT 7823 36.517 84.766 129.177 1.00 0.00 H TER 60973 WAT 7823 ATOM 60973 O WAT 7824 121.595 5.077 113.153 1.00 0.00 O ATOM 60974 H1 WAT 7824 121.622 6.034 113.162 1.00 0.00 H ATOM 60975 H2 WAT 7824 120.795 4.866 112.673 1.00 0.00 H TER 60977 WAT 7824 ATOM 60977 O WAT 7825 110.254 1.961 156.034 1.00 0.00 O ATOM 60978 H1 WAT 7825 110.238 2.785 156.519 1.00 0.00 H ATOM 60979 H2 WAT 7825 109.389 1.578 156.184 1.00 0.00 H TER 60981 WAT 7825 ATOM 60981 O WAT 7826 97.380 136.088 153.983 1.00 0.00 O ATOM 60982 H1 WAT 7826 97.900 135.820 154.741 1.00 0.00 H ATOM 60983 H2 WAT 7826 96.591 136.477 154.359 1.00 0.00 H TER 60985 WAT 7826 ATOM 60985 O WAT 7827 61.112 126.337 60.543 1.00 0.00 O ATOM 60986 H1 WAT 7827 60.379 126.901 60.791 1.00 0.00 H ATOM 60987 H2 WAT 7827 61.766 126.937 60.186 1.00 0.00 H TER 60989 WAT 7827 ATOM 60989 O WAT 7828 57.264 93.195 109.406 1.00 0.00 O ATOM 60990 H1 WAT 7828 56.457 92.683 109.355 1.00 0.00 H ATOM 60991 H2 WAT 7828 57.071 93.996 108.920 1.00 0.00 H TER 60993 WAT 7828 ATOM 60993 O WAT 7829 61.125 38.985 3.364 1.00 0.00 O ATOM 60994 H1 WAT 7829 60.456 38.745 4.005 1.00 0.00 H ATOM 60995 H2 WAT 7829 61.868 39.277 3.892 1.00 0.00 H TER 60997 WAT 7829 ATOM 60997 O WAT 7830 73.794 141.425 151.631 1.00 0.00 O ATOM 60998 H1 WAT 7830 73.825 142.372 151.497 1.00 0.00 H ATOM 60999 H2 WAT 7830 74.706 141.174 151.783 1.00 0.00 H TER 61001 WAT 7830 ATOM 61001 O WAT 7831 79.699 29.096 81.117 1.00 0.00 O ATOM 61002 H1 WAT 7831 79.975 28.789 80.253 1.00 0.00 H ATOM 61003 H2 WAT 7831 80.065 28.455 81.727 1.00 0.00 H TER 61005 WAT 7831 ATOM 61005 O WAT 7832 113.240 116.955 66.031 1.00 0.00 O ATOM 61006 H1 WAT 7832 113.660 117.738 65.677 1.00 0.00 H ATOM 61007 H2 WAT 7832 113.498 116.253 65.433 1.00 0.00 H TER 61009 WAT 7832 ATOM 61009 O WAT 7833 126.155 13.354 144.822 1.00 0.00 O ATOM 61010 H1 WAT 7833 126.325 14.224 145.181 1.00 0.00 H ATOM 61011 H2 WAT 7833 125.214 13.347 144.645 1.00 0.00 H TER 61013 WAT 7833 ATOM 61013 O WAT 7834 121.075 43.630 85.936 1.00 0.00 O ATOM 61014 H1 WAT 7834 120.838 44.481 85.568 1.00 0.00 H ATOM 61015 H2 WAT 7834 121.899 43.789 86.397 1.00 0.00 H TER 61017 WAT 7834 ATOM 61017 O WAT 7835 144.789 130.342 61.171 1.00 0.00 O ATOM 61018 H1 WAT 7835 143.908 130.717 61.163 1.00 0.00 H ATOM 61019 H2 WAT 7835 144.646 129.397 61.215 1.00 0.00 H TER 61021 WAT 7835 ATOM 61021 O WAT 7836 122.660 11.278 116.657 1.00 0.00 O ATOM 61022 H1 WAT 7836 123.477 11.131 116.182 1.00 0.00 H ATOM 61023 H2 WAT 7836 122.103 11.750 116.037 1.00 0.00 H TER 61025 WAT 7836 ATOM 61025 O WAT 7837 98.242 99.392 129.263 1.00 0.00 O ATOM 61026 H1 WAT 7837 97.308 99.256 129.104 1.00 0.00 H ATOM 61027 H2 WAT 7837 98.596 98.511 129.381 1.00 0.00 H TER 61029 WAT 7837 ATOM 61029 O WAT 7838 98.420 92.737 86.825 1.00 0.00 O ATOM 61030 H1 WAT 7838 98.255 91.994 86.245 1.00 0.00 H ATOM 61031 H2 WAT 7838 98.087 92.456 87.677 1.00 0.00 H TER 61033 WAT 7838 ATOM 61033 O WAT 7839 123.251 68.685 6.189 1.00 0.00 O ATOM 61034 H1 WAT 7839 123.265 69.622 5.997 1.00 0.00 H ATOM 61035 H2 WAT 7839 124.109 68.369 5.905 1.00 0.00 H TER 61037 WAT 7839 ATOM 61037 O WAT 7840 133.796 67.620 129.502 1.00 0.00 O ATOM 61038 H1 WAT 7840 133.931 68.470 129.083 1.00 0.00 H ATOM 61039 H2 WAT 7840 134.327 67.659 130.298 1.00 0.00 H TER 61041 WAT 7840 ATOM 61041 O WAT 7841 53.917 142.298 125.261 1.00 0.00 O ATOM 61042 H1 WAT 7841 53.418 141.693 124.712 1.00 0.00 H ATOM 61043 H2 WAT 7841 53.372 142.422 126.038 1.00 0.00 H TER 61045 WAT 7841 ATOM 61045 O WAT 7842 79.489 145.223 76.227 1.00 0.00 O ATOM 61046 H1 WAT 7842 78.990 144.589 76.742 1.00 0.00 H ATOM 61047 H2 WAT 7842 78.926 145.996 76.189 1.00 0.00 H TER 61049 WAT 7842 ATOM 61049 O WAT 7843 8.743 96.393 130.966 1.00 0.00 O ATOM 61050 H1 WAT 7843 8.726 96.839 130.119 1.00 0.00 H ATOM 61051 H2 WAT 7843 8.309 97.000 131.565 1.00 0.00 H TER 61053 WAT 7843 ATOM 61053 O WAT 7844 101.434 115.783 149.651 1.00 0.00 O ATOM 61054 H1 WAT 7844 101.238 116.423 150.335 1.00 0.00 H ATOM 61055 H2 WAT 7844 101.928 116.277 148.996 1.00 0.00 H TER 61057 WAT 7844 ATOM 61057 O WAT 7845 24.436 89.996 72.240 1.00 0.00 O ATOM 61058 H1 WAT 7845 25.022 89.813 72.974 1.00 0.00 H ATOM 61059 H2 WAT 7845 24.860 89.582 71.487 1.00 0.00 H TER 61061 WAT 7845 ATOM 61061 O WAT 7846 135.614 86.425 1.597 1.00 0.00 O ATOM 61062 H1 WAT 7846 135.993 86.805 2.389 1.00 0.00 H ATOM 61063 H2 WAT 7846 136.335 86.415 0.967 1.00 0.00 H TER 61065 WAT 7846 ATOM 61065 O WAT 7847 36.426 94.061 131.070 1.00 0.00 O ATOM 61066 H1 WAT 7847 35.600 93.580 131.015 1.00 0.00 H ATOM 61067 H2 WAT 7847 36.177 94.977 130.951 1.00 0.00 H TER 61069 WAT 7847 ATOM 61069 O WAT 7848 54.668 13.066 11.700 1.00 0.00 O ATOM 61070 H1 WAT 7848 55.246 13.046 12.463 1.00 0.00 H ATOM 61071 H2 WAT 7848 54.979 13.810 11.184 1.00 0.00 H TER 61073 WAT 7848 ATOM 61073 O WAT 7849 85.100 11.599 106.597 1.00 0.00 O ATOM 61074 H1 WAT 7849 84.474 12.243 106.266 1.00 0.00 H ATOM 61075 H2 WAT 7849 85.448 11.177 105.811 1.00 0.00 H TER 61077 WAT 7849 ATOM 61077 O WAT 7850 133.034 14.717 135.272 1.00 0.00 O ATOM 61078 H1 WAT 7850 132.286 14.457 135.809 1.00 0.00 H ATOM 61079 H2 WAT 7850 133.131 14.007 134.637 1.00 0.00 H TER 61081 WAT 7850 ATOM 61081 O WAT 7851 131.945 132.892 72.495 1.00 0.00 O ATOM 61082 H1 WAT 7851 132.046 131.978 72.763 1.00 0.00 H ATOM 61083 H2 WAT 7851 132.772 133.307 72.743 1.00 0.00 H TER 61085 WAT 7851 ATOM 61085 O WAT 7852 61.305 52.136 128.042 1.00 0.00 O ATOM 61086 H1 WAT 7852 61.922 52.279 128.760 1.00 0.00 H ATOM 61087 H2 WAT 7852 60.485 51.897 128.474 1.00 0.00 H TER 61089 WAT 7852 ATOM 61089 O WAT 7853 69.343 136.668 94.239 1.00 0.00 O ATOM 61090 H1 WAT 7853 68.507 136.439 94.645 1.00 0.00 H ATOM 61091 H2 WAT 7853 69.830 135.844 94.212 1.00 0.00 H TER 61093 WAT 7853 ATOM 61093 O WAT 7854 15.395 76.838 112.759 1.00 0.00 O ATOM 61094 H1 WAT 7854 15.399 77.453 113.492 1.00 0.00 H ATOM 61095 H2 WAT 7854 15.497 77.389 111.983 1.00 0.00 H TER 61097 WAT 7854 ATOM 61097 O WAT 7855 51.333 2.392 117.821 1.00 0.00 O ATOM 61098 H1 WAT 7855 51.381 2.665 118.737 1.00 0.00 H ATOM 61099 H2 WAT 7855 50.545 2.819 117.485 1.00 0.00 H TER 61101 WAT 7855 ATOM 61101 O WAT 7856 38.338 110.600 69.378 1.00 0.00 O ATOM 61102 H1 WAT 7856 37.520 110.337 69.800 1.00 0.00 H ATOM 61103 H2 WAT 7856 38.825 111.055 70.065 1.00 0.00 H TER 61105 WAT 7856 ATOM 61105 O WAT 7857 55.657 6.597 13.506 1.00 0.00 O ATOM 61106 H1 WAT 7857 55.706 6.076 14.308 1.00 0.00 H ATOM 61107 H2 WAT 7857 56.460 7.118 13.510 1.00 0.00 H TER 61109 WAT 7857 ATOM 61109 O WAT 7858 75.844 19.010 74.956 1.00 0.00 O ATOM 61110 H1 WAT 7858 76.720 19.239 74.644 1.00 0.00 H ATOM 61111 H2 WAT 7858 75.995 18.336 75.618 1.00 0.00 H TER 61113 WAT 7858 ATOM 61113 O WAT 7859 121.914 22.111 10.289 1.00 0.00 O ATOM 61114 H1 WAT 7859 121.547 22.982 10.443 1.00 0.00 H ATOM 61115 H2 WAT 7859 121.880 21.682 11.144 1.00 0.00 H TER 61117 WAT 7859 ATOM 61117 O WAT 7860 123.293 139.129 144.079 1.00 0.00 O ATOM 61118 H1 WAT 7860 124.135 138.727 144.295 1.00 0.00 H ATOM 61119 H2 WAT 7860 123.289 139.953 144.566 1.00 0.00 H TER 61121 WAT 7860 ATOM 61121 O WAT 7861 118.874 31.714 68.857 1.00 0.00 O ATOM 61122 H1 WAT 7861 117.984 31.962 68.606 1.00 0.00 H ATOM 61123 H2 WAT 7861 119.304 32.544 69.063 1.00 0.00 H TER 61125 WAT 7861 ATOM 61125 O WAT 7862 3.331 79.699 136.468 1.00 0.00 O ATOM 61126 H1 WAT 7862 3.329 78.752 136.327 1.00 0.00 H ATOM 61127 H2 WAT 7862 2.730 80.040 135.805 1.00 0.00 H TER 61129 WAT 7862 ATOM 61129 O WAT 7863 12.833 51.017 134.688 1.00 0.00 O ATOM 61130 H1 WAT 7863 12.795 50.646 133.806 1.00 0.00 H ATOM 61131 H2 WAT 7863 13.489 51.711 134.628 1.00 0.00 H TER 61133 WAT 7863 ATOM 61133 O WAT 7864 144.452 84.578 29.617 1.00 0.00 O ATOM 61134 H1 WAT 7864 144.104 85.241 30.213 1.00 0.00 H ATOM 61135 H2 WAT 7864 144.013 83.768 29.877 1.00 0.00 H TER 61137 WAT 7864 ATOM 61137 O WAT 7865 133.773 97.236 146.757 1.00 0.00 O ATOM 61138 H1 WAT 7865 133.769 98.106 147.158 1.00 0.00 H ATOM 61139 H2 WAT 7865 134.185 97.369 145.903 1.00 0.00 H TER 61141 WAT 7865 ATOM 61141 O WAT 7866 77.408 25.864 132.249 1.00 0.00 O ATOM 61142 H1 WAT 7866 77.726 25.400 133.023 1.00 0.00 H ATOM 61143 H2 WAT 7866 77.304 25.181 131.586 1.00 0.00 H TER 61145 WAT 7866 ATOM 61145 O WAT 7867 29.781 129.665 132.607 1.00 0.00 O ATOM 61146 H1 WAT 7867 29.079 129.844 131.982 1.00 0.00 H ATOM 61147 H2 WAT 7867 30.194 130.515 132.755 1.00 0.00 H TER 61149 WAT 7867 ATOM 61149 O WAT 7868 42.616 3.076 97.541 1.00 0.00 O ATOM 61150 H1 WAT 7868 43.240 3.264 98.243 1.00 0.00 H ATOM 61151 H2 WAT 7868 42.157 3.904 97.400 1.00 0.00 H TER 61153 WAT 7868 ATOM 61153 O WAT 7869 27.212 9.216 62.051 1.00 0.00 O ATOM 61154 H1 WAT 7869 26.771 10.057 62.169 1.00 0.00 H ATOM 61155 H2 WAT 7869 26.622 8.713 61.489 1.00 0.00 H TER 61157 WAT 7869 ATOM 61157 O WAT 7870 107.483 133.836 156.817 1.00 0.00 O ATOM 61158 H1 WAT 7870 108.425 134.006 156.827 1.00 0.00 H ATOM 61159 H2 WAT 7870 107.086 134.672 157.062 1.00 0.00 H TER 61161 WAT 7870 ATOM 61161 O WAT 7871 70.964 24.944 95.773 1.00 0.00 O ATOM 61162 H1 WAT 7871 71.737 24.452 96.050 1.00 0.00 H ATOM 61163 H2 WAT 7871 70.913 24.799 94.828 1.00 0.00 H TER 61165 WAT 7871 ATOM 61165 O WAT 7872 36.937 135.269 14.975 1.00 0.00 O ATOM 61166 H1 WAT 7872 36.655 134.946 14.119 1.00 0.00 H ATOM 61167 H2 WAT 7872 36.169 135.162 15.536 1.00 0.00 H TER 61169 WAT 7872 ATOM 61169 O WAT 7873 61.098 37.263 66.539 1.00 0.00 O ATOM 61170 H1 WAT 7873 61.851 36.725 66.296 1.00 0.00 H ATOM 61171 H2 WAT 7873 60.775 37.612 65.709 1.00 0.00 H TER 61173 WAT 7873 ATOM 61173 O WAT 7874 24.980 102.812 76.389 1.00 0.00 O ATOM 61174 H1 WAT 7874 24.713 103.379 75.666 1.00 0.00 H ATOM 61175 H2 WAT 7874 25.425 103.398 77.001 1.00 0.00 H TER 61177 WAT 7874 ATOM 61177 O WAT 7875 28.325 88.592 4.000 1.00 0.00 O ATOM 61178 H1 WAT 7875 29.207 88.221 3.969 1.00 0.00 H ATOM 61179 H2 WAT 7875 27.769 87.867 4.284 1.00 0.00 H TER 61181 WAT 7875 ATOM 61181 O WAT 7876 1.943 88.505 86.568 1.00 0.00 O ATOM 61182 H1 WAT 7876 1.014 88.517 86.338 1.00 0.00 H ATOM 61183 H2 WAT 7876 1.954 88.364 87.514 1.00 0.00 H TER 61185 WAT 7876 ATOM 61185 O WAT 7877 25.522 78.110 105.016 1.00 0.00 O ATOM 61186 H1 WAT 7877 25.204 77.460 104.389 1.00 0.00 H ATOM 61187 H2 WAT 7877 24.793 78.232 105.625 1.00 0.00 H TER 61189 WAT 7877 ATOM 61189 O WAT 7878 70.632 123.073 133.377 1.00 0.00 O ATOM 61190 H1 WAT 7878 70.717 122.475 134.120 1.00 0.00 H ATOM 61191 H2 WAT 7878 70.935 122.565 132.624 1.00 0.00 H TER 61193 WAT 7878 ATOM 61193 O WAT 7879 145.013 129.878 98.568 1.00 0.00 O ATOM 61194 H1 WAT 7879 144.120 130.184 98.407 1.00 0.00 H ATOM 61195 H2 WAT 7879 145.478 130.057 97.751 1.00 0.00 H TER 61197 WAT 7879 ATOM 61197 O WAT 7880 144.794 130.474 2.522 1.00 0.00 O ATOM 61198 H1 WAT 7880 143.922 130.867 2.554 1.00 0.00 H ATOM 61199 H2 WAT 7880 145.163 130.776 1.692 1.00 0.00 H TER 61201 WAT 7880 ATOM 61201 O WAT 7881 133.198 59.991 137.716 1.00 0.00 O ATOM 61202 H1 WAT 7881 133.882 60.660 137.720 1.00 0.00 H ATOM 61203 H2 WAT 7881 133.605 59.230 138.131 1.00 0.00 H TER 61205 WAT 7881 ATOM 61205 O WAT 7882 59.770 34.323 79.530 1.00 0.00 O ATOM 61206 H1 WAT 7882 60.010 34.411 78.608 1.00 0.00 H ATOM 61207 H2 WAT 7882 59.149 35.035 79.685 1.00 0.00 H TER 61209 WAT 7882 ATOM 61209 O WAT 7883 88.074 91.343 94.638 1.00 0.00 O ATOM 61210 H1 WAT 7883 88.863 90.839 94.439 1.00 0.00 H ATOM 61211 H2 WAT 7883 87.372 90.878 94.182 1.00 0.00 H TER 61213 WAT 7883 ATOM 61213 O WAT 7884 82.094 55.610 5.501 1.00 0.00 O ATOM 61214 H1 WAT 7884 82.630 56.028 6.176 1.00 0.00 H ATOM 61215 H2 WAT 7884 82.709 55.063 5.012 1.00 0.00 H TER 61217 WAT 7884 ATOM 61217 O WAT 7885 95.195 84.872 65.046 1.00 0.00 O ATOM 61218 H1 WAT 7885 94.307 84.732 65.375 1.00 0.00 H ATOM 61219 H2 WAT 7885 95.103 85.570 64.397 1.00 0.00 H TER 61221 WAT 7885 ATOM 61221 O WAT 7886 44.392 130.579 108.503 1.00 0.00 O ATOM 61222 H1 WAT 7886 44.814 131.425 108.650 1.00 0.00 H ATOM 61223 H2 WAT 7886 45.099 129.939 108.591 1.00 0.00 H TER 61225 WAT 7886 ATOM 61225 O WAT 7887 73.768 96.357 120.001 1.00 0.00 O ATOM 61226 H1 WAT 7887 74.181 96.043 120.805 1.00 0.00 H ATOM 61227 H2 WAT 7887 73.049 96.913 120.302 1.00 0.00 H TER 61229 WAT 7887 ATOM 61229 O WAT 7888 12.170 14.464 131.748 1.00 0.00 O ATOM 61230 H1 WAT 7888 12.129 14.822 132.635 1.00 0.00 H ATOM 61231 H2 WAT 7888 13.055 14.671 131.447 1.00 0.00 H TER 61233 WAT 7888 ATOM 61233 O WAT 7889 144.150 116.059 7.725 1.00 0.00 O ATOM 61234 H1 WAT 7889 143.545 116.790 7.851 1.00 0.00 H ATOM 61235 H2 WAT 7889 144.955 116.467 7.404 1.00 0.00 H TER 61237 WAT 7889 ATOM 61237 O WAT 7890 114.504 120.057 137.313 1.00 0.00 O ATOM 61238 H1 WAT 7890 113.640 120.192 137.702 1.00 0.00 H ATOM 61239 H2 WAT 7890 114.327 119.615 136.483 1.00 0.00 H TER 61241 WAT 7890 ATOM 61241 O WAT 7891 32.573 25.843 157.888 1.00 0.00 O ATOM 61242 H1 WAT 7891 31.749 25.356 157.863 1.00 0.00 H ATOM 61243 H2 WAT 7891 33.139 25.327 158.462 1.00 0.00 H TER 61245 WAT 7891 ATOM 61245 O WAT 7892 74.781 117.078 101.925 1.00 0.00 O ATOM 61246 H1 WAT 7892 75.236 116.781 101.137 1.00 0.00 H ATOM 61247 H2 WAT 7892 75.324 117.792 102.260 1.00 0.00 H TER 61249 WAT 7892 ATOM 61249 O WAT 7893 48.589 122.479 125.569 1.00 0.00 O ATOM 61250 H1 WAT 7893 48.930 122.204 124.717 1.00 0.00 H ATOM 61251 H2 WAT 7893 47.814 123.001 125.360 1.00 0.00 H TER 61253 WAT 7893 ATOM 61253 O WAT 7894 41.799 101.526 18.113 1.00 0.00 O ATOM 61254 H1 WAT 7894 42.291 102.136 18.663 1.00 0.00 H ATOM 61255 H2 WAT 7894 42.403 101.300 17.406 1.00 0.00 H TER 61257 WAT 7894 ATOM 61257 O WAT 7895 129.301 8.150 152.746 1.00 0.00 O ATOM 61258 H1 WAT 7895 128.749 8.732 153.268 1.00 0.00 H ATOM 61259 H2 WAT 7895 128.686 7.544 152.332 1.00 0.00 H TER 61261 WAT 7895 ATOM 61261 O WAT 7896 112.994 16.897 57.140 1.00 0.00 O ATOM 61262 H1 WAT 7896 113.924 17.069 57.290 1.00 0.00 H ATOM 61263 H2 WAT 7896 112.912 16.834 56.189 1.00 0.00 H TER 61265 WAT 7896 ATOM 61265 O WAT 7897 97.545 60.382 98.418 1.00 0.00 O ATOM 61266 H1 WAT 7897 97.017 59.757 97.921 1.00 0.00 H ATOM 61267 H2 WAT 7897 97.590 60.010 99.300 1.00 0.00 H TER 61269 WAT 7897 ATOM 61269 O WAT 7898 86.493 116.718 1.716 1.00 0.00 O ATOM 61270 H1 WAT 7898 87.056 116.648 0.945 1.00 0.00 H ATOM 61271 H2 WAT 7898 85.717 116.203 1.493 1.00 0.00 H TER 61273 WAT 7898 ATOM 61273 O WAT 7899 94.471 49.510 14.949 1.00 0.00 O ATOM 61274 H1 WAT 7899 95.323 49.751 15.313 1.00 0.00 H ATOM 61275 H2 WAT 7899 93.919 49.353 15.715 1.00 0.00 H TER 61277 WAT 7899 ATOM 61277 O WAT 7900 84.081 117.854 126.884 1.00 0.00 O ATOM 61278 H1 WAT 7900 83.514 117.284 126.365 1.00 0.00 H ATOM 61279 H2 WAT 7900 84.969 117.588 126.645 1.00 0.00 H TER 61281 WAT 7900 ATOM 61281 O WAT 7901 125.497 92.925 86.898 1.00 0.00 O ATOM 61282 H1 WAT 7901 125.983 92.788 86.085 1.00 0.00 H ATOM 61283 H2 WAT 7901 125.312 92.043 87.219 1.00 0.00 H TER 61285 WAT 7901 ATOM 61285 O WAT 7902 18.077 129.589 56.528 1.00 0.00 O ATOM 61286 H1 WAT 7902 17.204 129.285 56.778 1.00 0.00 H ATOM 61287 H2 WAT 7902 18.008 130.544 56.534 1.00 0.00 H TER 61289 WAT 7902 ATOM 61289 O WAT 7903 11.298 52.354 151.998 1.00 0.00 O ATOM 61290 H1 WAT 7903 10.750 52.869 152.591 1.00 0.00 H ATOM 61291 H2 WAT 7903 11.889 52.993 151.602 1.00 0.00 H TER 61293 WAT 7903 ATOM 61293 O WAT 7904 63.037 20.299 23.381 1.00 0.00 O ATOM 61294 H1 WAT 7904 62.816 19.877 22.551 1.00 0.00 H ATOM 61295 H2 WAT 7904 62.199 20.613 23.720 1.00 0.00 H TER 61297 WAT 7904 ATOM 61297 O WAT 7905 112.563 138.537 125.900 1.00 0.00 O ATOM 61298 H1 WAT 7905 112.344 137.748 126.395 1.00 0.00 H ATOM 61299 H2 WAT 7905 112.050 139.231 126.315 1.00 0.00 H TER 61301 WAT 7905 ATOM 61301 O WAT 7906 19.924 135.225 115.629 1.00 0.00 O ATOM 61302 H1 WAT 7906 19.077 135.049 115.219 1.00 0.00 H ATOM 61303 H2 WAT 7906 20.500 134.539 115.291 1.00 0.00 H TER 61305 WAT 7906 ATOM 61305 O WAT 7907 80.650 106.867 143.605 1.00 0.00 O ATOM 61306 H1 WAT 7907 80.595 107.780 143.322 1.00 0.00 H ATOM 61307 H2 WAT 7907 81.565 106.750 143.860 1.00 0.00 H TER 61309 WAT 7907 ATOM 61309 O WAT 7908 8.047 81.494 62.382 1.00 0.00 O ATOM 61310 H1 WAT 7908 7.361 81.064 61.871 1.00 0.00 H ATOM 61311 H2 WAT 7908 8.864 81.135 62.036 1.00 0.00 H TER 61313 WAT 7908 ATOM 61313 O WAT 7909 101.310 125.125 141.232 1.00 0.00 O ATOM 61314 H1 WAT 7909 100.786 125.923 141.297 1.00 0.00 H ATOM 61315 H2 WAT 7909 102.208 125.437 141.119 1.00 0.00 H TER 61317 WAT 7909 ATOM 61317 O WAT 7910 131.377 30.010 101.942 1.00 0.00 O ATOM 61318 H1 WAT 7910 132.145 30.353 102.399 1.00 0.00 H ATOM 61319 H2 WAT 7910 131.233 30.622 101.220 1.00 0.00 H TER 61321 WAT 7910 ATOM 61321 O WAT 7911 34.434 8.939 81.668 1.00 0.00 O ATOM 61322 H1 WAT 7911 35.157 9.510 81.928 1.00 0.00 H ATOM 61323 H2 WAT 7911 33.654 9.365 82.021 1.00 0.00 H TER 61325 WAT 7911 ATOM 61325 O WAT 7912 41.936 65.951 11.510 1.00 0.00 O ATOM 61326 H1 WAT 7912 41.123 65.948 12.015 1.00 0.00 H ATOM 61327 H2 WAT 7912 41.889 65.160 10.973 1.00 0.00 H TER 61329 WAT 7912 ATOM 61329 O WAT 7913 110.724 139.651 82.918 1.00 0.00 O ATOM 61330 H1 WAT 7913 111.419 140.283 83.101 1.00 0.00 H ATOM 61331 H2 WAT 7913 109.997 140.183 82.594 1.00 0.00 H TER 61333 WAT 7913 ATOM 61333 O WAT 7914 76.822 23.782 77.543 1.00 0.00 O ATOM 61334 H1 WAT 7914 77.218 24.318 78.230 1.00 0.00 H ATOM 61335 H2 WAT 7914 75.941 24.143 77.436 1.00 0.00 H TER 61337 WAT 7914 ATOM 61337 O WAT 7915 129.253 108.762 142.626 1.00 0.00 O ATOM 61338 H1 WAT 7915 128.446 108.751 142.111 1.00 0.00 H ATOM 61339 H2 WAT 7915 129.388 109.686 142.838 1.00 0.00 H TER 61341 WAT 7915 ATOM 61341 O WAT 7916 19.323 60.018 135.513 1.00 0.00 O ATOM 61342 H1 WAT 7916 20.266 60.177 135.556 1.00 0.00 H ATOM 61343 H2 WAT 7916 19.218 59.388 134.800 1.00 0.00 H TER 61345 WAT 7916 ATOM 61345 O WAT 7917 102.503 7.077 19.718 1.00 0.00 O ATOM 61346 H1 WAT 7917 101.884 7.581 20.245 1.00 0.00 H ATOM 61347 H2 WAT 7917 103.336 7.538 19.820 1.00 0.00 H TER 61349 WAT 7917 ATOM 61349 O WAT 7918 25.026 101.354 8.743 1.00 0.00 O ATOM 61350 H1 WAT 7918 25.538 102.076 8.378 1.00 0.00 H ATOM 61351 H2 WAT 7918 25.015 100.694 8.051 1.00 0.00 H TER 61353 WAT 7918 ATOM 61353 O WAT 7919 87.283 43.591 0.461 1.00 0.00 O ATOM 61354 H1 WAT 7919 87.157 44.273 -0.198 1.00 0.00 H ATOM 61355 H2 WAT 7919 87.633 42.846 -0.028 1.00 0.00 H TER 61357 WAT 7919 ATOM 61357 O WAT 7920 126.184 64.646 59.496 1.00 0.00 O ATOM 61358 H1 WAT 7920 125.609 63.913 59.714 1.00 0.00 H ATOM 61359 H2 WAT 7920 127.064 64.331 59.705 1.00 0.00 H TER 61361 WAT 7920 ATOM 61361 O WAT 7921 33.045 105.551 155.693 1.00 0.00 O ATOM 61362 H1 WAT 7921 33.377 104.759 155.270 1.00 0.00 H ATOM 61363 H2 WAT 7921 33.398 105.513 156.582 1.00 0.00 H TER 61365 WAT 7921 ATOM 61365 O WAT 7922 85.578 5.032 121.986 1.00 0.00 O ATOM 61366 H1 WAT 7922 84.709 5.222 122.341 1.00 0.00 H ATOM 61367 H2 WAT 7922 85.413 4.444 121.249 1.00 0.00 H TER 61369 WAT 7922 ATOM 61369 O WAT 7923 21.877 86.557 68.161 1.00 0.00 O ATOM 61370 H1 WAT 7923 22.478 85.952 67.727 1.00 0.00 H ATOM 61371 H2 WAT 7923 21.916 86.311 69.086 1.00 0.00 H TER 61373 WAT 7923 ATOM 61373 O WAT 7924 5.108 99.078 6.766 1.00 0.00 O ATOM 61374 H1 WAT 7924 5.254 98.927 5.832 1.00 0.00 H ATOM 61375 H2 WAT 7924 5.011 98.202 7.138 1.00 0.00 H TER 61377 WAT 7924 ATOM 61377 O WAT 7925 80.164 120.773 123.636 1.00 0.00 O ATOM 61378 H1 WAT 7925 80.159 120.222 124.418 1.00 0.00 H ATOM 61379 H2 WAT 7925 79.949 121.649 123.958 1.00 0.00 H TER 61381 WAT 7925 ATOM 61381 O WAT 7926 123.514 12.644 140.762 1.00 0.00 O ATOM 61382 H1 WAT 7926 123.565 11.735 140.467 1.00 0.00 H ATOM 61383 H2 WAT 7926 122.656 12.945 140.464 1.00 0.00 H TER 61385 WAT 7926 ATOM 61385 O WAT 7927 103.151 68.391 20.629 1.00 0.00 O ATOM 61386 H1 WAT 7927 102.244 68.089 20.669 1.00 0.00 H ATOM 61387 H2 WAT 7927 103.647 67.723 21.102 1.00 0.00 H TER 61389 WAT 7927 ATOM 61389 O WAT 7928 99.246 124.201 137.069 1.00 0.00 O ATOM 61390 H1 WAT 7928 98.733 123.414 137.249 1.00 0.00 H ATOM 61391 H2 WAT 7928 99.537 124.500 137.930 1.00 0.00 H TER 61393 WAT 7928 ATOM 61393 O WAT 7929 103.602 131.691 120.999 1.00 0.00 O ATOM 61394 H1 WAT 7929 103.111 131.464 120.209 1.00 0.00 H ATOM 61395 H2 WAT 7929 103.214 131.149 121.686 1.00 0.00 H TER 61397 WAT 7929 ATOM 61397 O WAT 7930 140.008 45.203 136.814 1.00 0.00 O ATOM 61398 H1 WAT 7930 139.385 44.504 137.012 1.00 0.00 H ATOM 61399 H2 WAT 7930 139.606 45.685 136.091 1.00 0.00 H TER 61401 WAT 7930 ATOM 61401 O WAT 7931 78.719 35.912 91.550 1.00 0.00 O ATOM 61402 H1 WAT 7931 78.058 36.564 91.783 1.00 0.00 H ATOM 61403 H2 WAT 7931 79.101 36.239 90.735 1.00 0.00 H TER 61405 WAT 7931 ATOM 61405 O WAT 7932 34.148 21.893 4.090 1.00 0.00 O ATOM 61406 H1 WAT 7932 34.224 22.837 3.952 1.00 0.00 H ATOM 61407 H2 WAT 7932 33.443 21.620 3.503 1.00 0.00 H TER 61409 WAT 7932 ATOM 61409 O WAT 7933 144.051 36.970 100.147 1.00 0.00 O ATOM 61410 H1 WAT 7933 143.143 37.227 99.987 1.00 0.00 H ATOM 61411 H2 WAT 7933 144.203 36.240 99.546 1.00 0.00 H TER 61413 WAT 7933 ATOM 61413 O WAT 7934 110.260 20.245 1.084 1.00 0.00 O ATOM 61414 H1 WAT 7934 111.165 20.556 1.116 1.00 0.00 H ATOM 61415 H2 WAT 7934 109.761 20.914 1.552 1.00 0.00 H TER 61417 WAT 7934 ATOM 61417 O WAT 7935 77.572 71.115 80.114 1.00 0.00 O ATOM 61418 H1 WAT 7935 76.754 70.889 80.557 1.00 0.00 H ATOM 61419 H2 WAT 7935 78.224 71.139 80.815 1.00 0.00 H TER 61421 WAT 7935 ATOM 61421 O WAT 7936 124.942 124.059 99.098 1.00 0.00 O ATOM 61422 H1 WAT 7936 124.141 123.537 99.055 1.00 0.00 H ATOM 61423 H2 WAT 7936 125.034 124.280 100.025 1.00 0.00 H TER 61425 WAT 7936 ATOM 61425 O WAT 7937 8.947 4.640 123.897 1.00 0.00 O ATOM 61426 H1 WAT 7937 8.636 4.355 123.037 1.00 0.00 H ATOM 61427 H2 WAT 7937 8.276 5.250 124.204 1.00 0.00 H TER 61429 WAT 7937 ATOM 61429 O WAT 7938 34.856 18.696 138.390 1.00 0.00 O ATOM 61430 H1 WAT 7938 35.389 19.441 138.668 1.00 0.00 H ATOM 61431 H2 WAT 7938 35.294 18.368 137.605 1.00 0.00 H TER 61433 WAT 7938 ATOM 61433 O WAT 7939 57.701 25.470 116.786 1.00 0.00 O ATOM 61434 H1 WAT 7939 58.454 25.479 116.196 1.00 0.00 H ATOM 61435 H2 WAT 7939 56.941 25.484 116.204 1.00 0.00 H TER 61437 WAT 7939 ATOM 61437 O WAT 7940 87.517 113.784 105.862 1.00 0.00 O ATOM 61438 H1 WAT 7940 87.259 114.656 106.163 1.00 0.00 H ATOM 61439 H2 WAT 7940 87.150 113.716 104.981 1.00 0.00 H TER 61441 WAT 7940 ATOM 61441 O WAT 7941 8.266 135.776 88.980 1.00 0.00 O ATOM 61442 H1 WAT 7941 8.753 134.980 88.765 1.00 0.00 H ATOM 61443 H2 WAT 7941 8.934 136.461 89.023 1.00 0.00 H TER 61445 WAT 7941 ATOM 61445 O WAT 7942 21.852 52.889 130.235 1.00 0.00 O ATOM 61446 H1 WAT 7942 21.515 51.993 130.241 1.00 0.00 H ATOM 61447 H2 WAT 7942 22.800 52.788 130.154 1.00 0.00 H TER 61449 WAT 7942 ATOM 61449 O WAT 7943 7.245 133.006 139.107 1.00 0.00 O ATOM 61450 H1 WAT 7943 7.808 132.368 139.547 1.00 0.00 H ATOM 61451 H2 WAT 7943 7.598 133.857 139.366 1.00 0.00 H TER 61453 WAT 7943 ATOM 61453 O WAT 7944 87.939 127.853 103.936 1.00 0.00 O ATOM 61454 H1 WAT 7944 87.425 128.073 103.159 1.00 0.00 H ATOM 61455 H2 WAT 7944 88.309 126.992 103.742 1.00 0.00 H TER 61457 WAT 7944 ATOM 61457 O WAT 7945 118.827 21.918 89.100 1.00 0.00 O ATOM 61458 H1 WAT 7945 119.267 22.746 89.295 1.00 0.00 H ATOM 61459 H2 WAT 7945 117.902 22.151 89.022 1.00 0.00 H TER 61461 WAT 7945 ATOM 61461 O WAT 7946 1.707 8.161 156.102 1.00 0.00 O ATOM 61462 H1 WAT 7946 0.765 8.221 156.261 1.00 0.00 H ATOM 61463 H2 WAT 7946 2.107 8.507 156.899 1.00 0.00 H TER 61465 WAT 7946 ATOM 61465 O WAT 7947 141.890 69.709 119.980 1.00 0.00 O ATOM 61466 H1 WAT 7947 141.692 69.566 119.055 1.00 0.00 H ATOM 61467 H2 WAT 7947 141.472 70.546 120.188 1.00 0.00 H TER 61469 WAT 7947 ATOM 61469 O WAT 7948 130.571 88.565 138.030 1.00 0.00 O ATOM 61470 H1 WAT 7948 130.907 88.897 138.863 1.00 0.00 H ATOM 61471 H2 WAT 7948 129.974 89.248 137.723 1.00 0.00 H TER 61473 WAT 7948 ATOM 61473 O WAT 7949 88.399 77.971 11.815 1.00 0.00 O ATOM 61474 H1 WAT 7949 87.898 77.163 11.704 1.00 0.00 H ATOM 61475 H2 WAT 7949 88.181 78.497 11.046 1.00 0.00 H TER 61477 WAT 7949 ATOM 61477 O WAT 7950 33.889 73.259 9.155 1.00 0.00 O ATOM 61478 H1 WAT 7950 34.337 73.367 9.994 1.00 0.00 H ATOM 61479 H2 WAT 7950 32.995 73.556 9.321 1.00 0.00 H TER 61481 WAT 7950 ATOM 61481 O WAT 7951 64.744 84.871 112.626 1.00 0.00 O ATOM 61482 H1 WAT 7951 64.470 84.387 113.405 1.00 0.00 H ATOM 61483 H2 WAT 7951 63.974 84.864 112.057 1.00 0.00 H TER 61485 WAT 7951 ATOM 61485 O WAT 7952 124.368 38.428 146.645 1.00 0.00 O ATOM 61486 H1 WAT 7952 124.000 37.557 146.495 1.00 0.00 H ATOM 61487 H2 WAT 7952 124.282 38.566 147.588 1.00 0.00 H TER 61489 WAT 7952 ATOM 61489 O WAT 7953 59.104 104.248 97.301 1.00 0.00 O ATOM 61490 H1 WAT 7953 58.496 103.908 96.645 1.00 0.00 H ATOM 61491 H2 WAT 7953 59.949 103.863 97.066 1.00 0.00 H TER 61493 WAT 7953 ATOM 61493 O WAT 7954 101.383 86.267 75.223 1.00 0.00 O ATOM 61494 H1 WAT 7954 101.937 86.465 75.978 1.00 0.00 H ATOM 61495 H2 WAT 7954 101.426 87.056 74.682 1.00 0.00 H TER 61497 WAT 7954 ATOM 61497 O WAT 7955 134.575 99.631 153.671 1.00 0.00 O ATOM 61498 H1 WAT 7955 133.877 99.172 153.203 1.00 0.00 H ATOM 61499 H2 WAT 7955 134.780 100.383 153.117 1.00 0.00 H TER 61501 WAT 7955 ATOM 61501 O WAT 7956 48.975 82.289 87.528 1.00 0.00 O ATOM 61502 H1 WAT 7956 49.351 82.174 86.655 1.00 0.00 H ATOM 61503 H2 WAT 7956 49.692 82.644 88.053 1.00 0.00 H TER 61505 WAT 7956 ATOM 61505 O WAT 7957 94.019 138.475 112.093 1.00 0.00 O ATOM 61506 H1 WAT 7957 93.628 137.604 112.026 1.00 0.00 H ATOM 61507 H2 WAT 7957 93.858 138.742 112.998 1.00 0.00 H TER 61509 WAT 7957 ATOM 61509 O WAT 7958 5.822 113.743 3.044 1.00 0.00 O ATOM 61510 H1 WAT 7958 6.691 113.984 3.368 1.00 0.00 H ATOM 61511 H2 WAT 7958 5.925 112.846 2.727 1.00 0.00 H TER 61513 WAT 7958 ATOM 61513 O WAT 7959 45.498 18.505 63.329 1.00 0.00 O ATOM 61514 H1 WAT 7959 45.833 18.049 64.101 1.00 0.00 H ATOM 61515 H2 WAT 7959 45.832 19.398 63.414 1.00 0.00 H TER 61517 WAT 7959 ATOM 61517 O WAT 7960 72.786 74.412 129.361 1.00 0.00 O ATOM 61518 H1 WAT 7960 73.240 73.616 129.638 1.00 0.00 H ATOM 61519 H2 WAT 7960 72.494 74.222 128.469 1.00 0.00 H TER 61521 WAT 7960 ATOM 61521 O WAT 7961 112.714 34.638 0.335 1.00 0.00 O ATOM 61522 H1 WAT 7961 113.242 34.422 -0.433 1.00 0.00 H ATOM 61523 H2 WAT 7961 112.501 35.565 0.226 1.00 0.00 H TER 61525 WAT 7961 ATOM 61525 O WAT 7962 34.174 127.880 12.381 1.00 0.00 O ATOM 61526 H1 WAT 7962 33.894 128.794 12.428 1.00 0.00 H ATOM 61527 H2 WAT 7962 34.252 127.606 13.294 1.00 0.00 H TER 61529 WAT 7962 ATOM 61529 O WAT 7963 92.538 125.203 72.129 1.00 0.00 O ATOM 61530 H1 WAT 7963 92.520 125.615 72.992 1.00 0.00 H ATOM 61531 H2 WAT 7963 91.884 125.683 71.621 1.00 0.00 H TER 61533 WAT 7963 ATOM 61533 O WAT 7964 115.148 115.348 155.728 1.00 0.00 O ATOM 61534 H1 WAT 7964 115.614 116.129 155.431 1.00 0.00 H ATOM 61535 H2 WAT 7964 115.606 115.086 156.527 1.00 0.00 H TER 61537 WAT 7964 ATOM 61537 O WAT 7965 5.335 138.245 122.964 1.00 0.00 O ATOM 61538 H1 WAT 7965 6.252 138.517 122.916 1.00 0.00 H ATOM 61539 H2 WAT 7965 5.204 138.008 123.882 1.00 0.00 H TER 61541 WAT 7965 ATOM 61541 O WAT 7966 0.653 31.060 7.369 1.00 0.00 O ATOM 61542 H1 WAT 7966 1.167 30.643 6.677 1.00 0.00 H ATOM 61543 H2 WAT 7966 1.307 31.437 7.958 1.00 0.00 H TER 61545 WAT 7966 ATOM 61545 O WAT 7967 139.034 104.985 120.610 1.00 0.00 O ATOM 61546 H1 WAT 7967 138.439 104.272 120.377 1.00 0.00 H ATOM 61547 H2 WAT 7967 138.660 105.357 121.409 1.00 0.00 H TER 61549 WAT 7967 ATOM 61549 O WAT 7968 66.572 62.391 140.336 1.00 0.00 O ATOM 61550 H1 WAT 7968 65.824 62.987 140.363 1.00 0.00 H ATOM 61551 H2 WAT 7968 67.297 62.931 140.020 1.00 0.00 H TER 61553 WAT 7968 ATOM 61553 O WAT 7969 115.053 104.237 78.867 1.00 0.00 O ATOM 61554 H1 WAT 7969 115.236 104.169 79.805 1.00 0.00 H ATOM 61555 H2 WAT 7969 114.148 103.940 78.778 1.00 0.00 H TER 61557 WAT 7969 ATOM 61557 O WAT 7970 124.001 65.123 84.588 1.00 0.00 O ATOM 61558 H1 WAT 7970 124.493 65.836 84.180 1.00 0.00 H ATOM 61559 H2 WAT 7970 123.083 65.368 84.471 1.00 0.00 H TER 61561 WAT 7970 ATOM 61561 O WAT 7971 42.613 142.819 4.917 1.00 0.00 O ATOM 61562 H1 WAT 7971 42.396 143.751 4.905 1.00 0.00 H ATOM 61563 H2 WAT 7971 43.562 142.793 4.796 1.00 0.00 H TER 61565 WAT 7971 ATOM 61565 O WAT 7972 30.730 35.248 16.679 1.00 0.00 O ATOM 61566 H1 WAT 7972 31.514 35.150 16.138 1.00 0.00 H ATOM 61567 H2 WAT 7972 30.470 34.351 16.888 1.00 0.00 H TER 61569 WAT 7972 ATOM 61569 O WAT 7973 46.107 92.077 125.447 1.00 0.00 O ATOM 61570 H1 WAT 7973 45.356 92.624 125.214 1.00 0.00 H ATOM 61571 H2 WAT 7973 46.825 92.419 124.914 1.00 0.00 H TER 61573 WAT 7973 ATOM 61573 O WAT 7974 72.835 66.916 87.215 1.00 0.00 O ATOM 61574 H1 WAT 7974 73.109 67.320 86.392 1.00 0.00 H ATOM 61575 H2 WAT 7974 72.329 67.596 87.659 1.00 0.00 H TER 61577 WAT 7974 ATOM 61577 O WAT 7975 128.985 112.100 74.682 1.00 0.00 O ATOM 61578 H1 WAT 7975 129.563 111.365 74.477 1.00 0.00 H ATOM 61579 H2 WAT 7975 128.409 112.171 73.920 1.00 0.00 H TER 61581 WAT 7975 ATOM 61581 O WAT 7976 50.686 64.718 94.211 1.00 0.00 O ATOM 61582 H1 WAT 7976 51.486 64.242 93.990 1.00 0.00 H ATOM 61583 H2 WAT 7976 50.940 65.640 94.182 1.00 0.00 H TER 61585 WAT 7976 ATOM 61585 O WAT 7977 20.216 139.849 91.712 1.00 0.00 O ATOM 61586 H1 WAT 7977 19.492 140.268 91.248 1.00 0.00 H ATOM 61587 H2 WAT 7977 19.799 139.175 92.249 1.00 0.00 H TER 61589 WAT 7977 ATOM 61589 O WAT 7978 26.379 141.537 134.100 1.00 0.00 O ATOM 61590 H1 WAT 7978 27.217 141.236 134.451 1.00 0.00 H ATOM 61591 H2 WAT 7978 25.844 141.711 134.874 1.00 0.00 H TER 61593 WAT 7978 ATOM 61593 O WAT 7979 14.140 108.882 141.551 1.00 0.00 O ATOM 61594 H1 WAT 7979 14.980 109.272 141.309 1.00 0.00 H ATOM 61595 H2 WAT 7979 13.507 109.288 140.960 1.00 0.00 H TER 61597 WAT 7979 ATOM 61597 O WAT 7980 48.703 0.480 151.342 1.00 0.00 O ATOM 61598 H1 WAT 7980 49.372 1.090 151.030 1.00 0.00 H ATOM 61599 H2 WAT 7980 49.153 -0.363 151.392 1.00 0.00 H TER 61601 WAT 7980 ATOM 61601 O WAT 7981 118.768 138.126 102.932 1.00 0.00 O ATOM 61602 H1 WAT 7981 118.209 137.349 102.909 1.00 0.00 H ATOM 61603 H2 WAT 7981 118.229 138.820 102.554 1.00 0.00 H TER 61605 WAT 7981 ATOM 61605 O WAT 7982 140.006 101.110 121.722 1.00 0.00 O ATOM 61606 H1 WAT 7982 139.359 100.859 121.063 1.00 0.00 H ATOM 61607 H2 WAT 7982 139.492 101.270 122.514 1.00 0.00 H TER 61609 WAT 7982 ATOM 61609 O WAT 7983 24.858 27.179 91.675 1.00 0.00 O ATOM 61610 H1 WAT 7983 24.732 26.873 92.573 1.00 0.00 H ATOM 61611 H2 WAT 7983 25.808 27.195 91.558 1.00 0.00 H TER 61613 WAT 7983 ATOM 61613 O WAT 7984 6.998 110.299 77.736 1.00 0.00 O ATOM 61614 H1 WAT 7984 6.781 111.231 77.708 1.00 0.00 H ATOM 61615 H2 WAT 7984 6.325 109.881 77.199 1.00 0.00 H TER 61617 WAT 7984 ATOM 61617 O WAT 7985 67.623 141.908 107.898 1.00 0.00 O ATOM 61618 H1 WAT 7985 66.941 141.451 108.392 1.00 0.00 H ATOM 61619 H2 WAT 7985 67.725 141.392 107.098 1.00 0.00 H TER 61621 WAT 7985 ATOM 61621 O WAT 7986 96.707 124.458 110.026 1.00 0.00 O ATOM 61622 H1 WAT 7986 97.440 123.941 110.361 1.00 0.00 H ATOM 61623 H2 WAT 7986 96.625 125.185 110.643 1.00 0.00 H TER 61625 WAT 7986 ATOM 61625 O WAT 7987 22.659 127.100 125.492 1.00 0.00 O ATOM 61626 H1 WAT 7987 22.695 128.038 125.679 1.00 0.00 H ATOM 61627 H2 WAT 7987 23.267 126.978 124.763 1.00 0.00 H TER 61629 WAT 7987 ATOM 61629 O WAT 7988 72.215 92.926 92.390 1.00 0.00 O ATOM 61630 H1 WAT 7988 71.321 92.832 92.720 1.00 0.00 H ATOM 61631 H2 WAT 7988 72.602 92.057 92.496 1.00 0.00 H TER 61633 WAT 7988 ATOM 61633 O WAT 7989 9.678 28.330 56.850 1.00 0.00 O ATOM 61634 H1 WAT 7989 8.913 27.770 56.721 1.00 0.00 H ATOM 61635 H2 WAT 7989 10.352 27.741 57.189 1.00 0.00 H TER 61637 WAT 7989 ATOM 61637 O WAT 7990 65.023 22.946 12.617 1.00 0.00 O ATOM 61638 H1 WAT 7990 65.964 23.077 12.500 1.00 0.00 H ATOM 61639 H2 WAT 7990 64.763 22.403 11.872 1.00 0.00 H TER 61641 WAT 7990 ATOM 61641 O WAT 7991 2.982 143.083 80.100 1.00 0.00 O ATOM 61642 H1 WAT 7991 3.046 142.811 81.016 1.00 0.00 H ATOM 61643 H2 WAT 7991 2.382 143.828 80.113 1.00 0.00 H TER 61645 WAT 7991 ATOM 61645 O WAT 7992 39.413 86.613 59.911 1.00 0.00 O ATOM 61646 H1 WAT 7992 40.241 86.945 59.563 1.00 0.00 H ATOM 61647 H2 WAT 7992 39.671 85.937 60.538 1.00 0.00 H TER 61649 WAT 7992 ATOM 61649 O WAT 7993 4.510 36.724 104.812 1.00 0.00 O ATOM 61650 H1 WAT 7993 4.330 36.925 105.730 1.00 0.00 H ATOM 61651 H2 WAT 7993 5.178 37.359 104.554 1.00 0.00 H TER 61653 WAT 7993 ATOM 61653 O WAT 7994 66.515 2.878 121.566 1.00 0.00 O ATOM 61654 H1 WAT 7994 66.267 3.767 121.818 1.00 0.00 H ATOM 61655 H2 WAT 7994 67.291 2.992 121.017 1.00 0.00 H TER 61657 WAT 7994 ATOM 61657 O WAT 7995 90.291 66.988 119.828 1.00 0.00 O ATOM 61658 H1 WAT 7995 89.762 67.640 119.367 1.00 0.00 H ATOM 61659 H2 WAT 7995 89.661 66.323 120.107 1.00 0.00 H TER 61661 WAT 7995 ATOM 61661 O WAT 7996 38.862 89.712 21.596 1.00 0.00 O ATOM 61662 H1 WAT 7996 39.382 90.185 22.246 1.00 0.00 H ATOM 61663 H2 WAT 7996 38.290 89.145 22.114 1.00 0.00 H TER 61665 WAT 7996 ATOM 61665 O WAT 7997 27.688 46.514 136.579 1.00 0.00 O ATOM 61666 H1 WAT 7997 27.432 45.703 136.140 1.00 0.00 H ATOM 61667 H2 WAT 7997 27.028 47.152 136.309 1.00 0.00 H TER 61669 WAT 7997 ATOM 61669 O WAT 7998 59.815 80.099 148.064 1.00 0.00 O ATOM 61670 H1 WAT 7998 60.199 80.523 147.296 1.00 0.00 H ATOM 61671 H2 WAT 7998 60.435 80.278 148.771 1.00 0.00 H TER 61673 WAT 7998 ATOM 61673 O WAT 7999 127.178 121.470 111.913 1.00 0.00 O ATOM 61674 H1 WAT 7999 126.517 121.143 112.523 1.00 0.00 H ATOM 61675 H2 WAT 7999 127.534 122.249 112.340 1.00 0.00 H TER 61677 WAT 7999 ATOM 61677 O WAT 8000 121.501 36.934 22.457 1.00 0.00 O ATOM 61678 H1 WAT 8000 121.615 37.621 23.113 1.00 0.00 H ATOM 61679 H2 WAT 8000 121.362 37.406 21.636 1.00 0.00 H TER 61681 WAT 8000 ATOM 61681 O WAT 8001 129.304 5.576 123.755 1.00 0.00 O ATOM 61682 H1 WAT 8001 129.926 5.101 124.306 1.00 0.00 H ATOM 61683 H2 WAT 8001 129.142 4.990 123.016 1.00 0.00 H TER 61685 WAT 8001 ATOM 61685 O WAT 8002 34.677 122.484 151.985 1.00 0.00 O ATOM 61686 H1 WAT 8002 34.140 122.912 151.318 1.00 0.00 H ATOM 61687 H2 WAT 8002 35.494 122.983 151.992 1.00 0.00 H TER 61689 WAT 8002 ATOM 61689 O WAT 8003 126.331 53.856 129.306 1.00 0.00 O ATOM 61690 H1 WAT 8003 127.025 53.967 128.656 1.00 0.00 H ATOM 61691 H2 WAT 8003 125.598 54.369 128.963 1.00 0.00 H TER 61693 WAT 8003 ATOM 61693 O WAT 8004 49.772 108.259 125.928 1.00 0.00 O ATOM 61694 H1 WAT 8004 49.342 107.962 126.730 1.00 0.00 H ATOM 61695 H2 WAT 8004 49.600 107.565 125.293 1.00 0.00 H TER 61697 WAT 8004 ATOM 61697 O WAT 8005 15.759 30.803 64.523 1.00 0.00 O ATOM 61698 H1 WAT 8005 15.054 31.341 64.883 1.00 0.00 H ATOM 61699 H2 WAT 8005 15.849 31.101 63.618 1.00 0.00 H TER 61701 WAT 8005 ATOM 61701 O WAT 8006 56.240 45.444 12.568 1.00 0.00 O ATOM 61702 H1 WAT 8006 55.561 46.117 12.508 1.00 0.00 H ATOM 61703 H2 WAT 8006 55.831 44.735 13.063 1.00 0.00 H TER 61705 WAT 8006 ATOM 61705 O WAT 8007 19.494 130.115 142.685 1.00 0.00 O ATOM 61706 H1 WAT 8007 20.157 129.457 142.894 1.00 0.00 H ATOM 61707 H2 WAT 8007 19.138 130.375 143.534 1.00 0.00 H TER 61709 WAT 8007 ATOM 61709 O WAT 8008 48.552 76.620 95.755 1.00 0.00 O ATOM 61710 H1 WAT 8008 47.853 76.543 96.404 1.00 0.00 H ATOM 61711 H2 WAT 8008 48.206 77.228 95.101 1.00 0.00 H TER 61713 WAT 8008 ATOM 61713 O WAT 8009 54.355 3.594 90.373 1.00 0.00 O ATOM 61714 H1 WAT 8009 54.446 3.501 89.424 1.00 0.00 H ATOM 61715 H2 WAT 8009 53.560 4.115 90.487 1.00 0.00 H TER 61717 WAT 8009 ATOM 61717 O WAT 8010 70.509 114.573 137.282 1.00 0.00 O ATOM 61718 H1 WAT 8010 71.124 114.299 137.963 1.00 0.00 H ATOM 61719 H2 WAT 8010 70.117 113.757 136.971 1.00 0.00 H TER 61721 WAT 8010 ATOM 61721 O WAT 8011 137.786 78.385 109.605 1.00 0.00 O ATOM 61722 H1 WAT 8011 138.669 78.506 109.255 1.00 0.00 H ATOM 61723 H2 WAT 8011 137.207 78.652 108.891 1.00 0.00 H TER 61725 WAT 8011 ATOM 61725 O WAT 8012 13.234 82.535 90.024 1.00 0.00 O ATOM 61726 H1 WAT 8012 13.560 83.220 90.607 1.00 0.00 H ATOM 61727 H2 WAT 8012 12.597 82.980 89.464 1.00 0.00 H TER 61729 WAT 8012 ATOM 61729 O WAT 8013 94.575 28.522 76.290 1.00 0.00 O ATOM 61730 H1 WAT 8013 93.939 29.235 76.338 1.00 0.00 H ATOM 61731 H2 WAT 8013 94.045 27.725 76.319 1.00 0.00 H TER 61733 WAT 8013 ATOM 61733 O WAT 8014 24.824 4.135 154.280 1.00 0.00 O ATOM 61734 H1 WAT 8014 25.421 4.528 154.916 1.00 0.00 H ATOM 61735 H2 WAT 8014 24.002 4.024 154.759 1.00 0.00 H TER 61737 WAT 8014 ATOM 61737 O WAT 8015 94.905 39.291 6.221 1.00 0.00 O ATOM 61738 H1 WAT 8015 95.359 40.107 6.012 1.00 0.00 H ATOM 61739 H2 WAT 8015 94.043 39.570 6.530 1.00 0.00 H TER 61741 WAT 8015 ATOM 61741 O WAT 8016 100.630 132.897 107.308 1.00 0.00 O ATOM 61742 H1 WAT 8016 100.568 133.011 106.360 1.00 0.00 H ATOM 61743 H2 WAT 8016 99.809 133.254 107.647 1.00 0.00 H TER 61745 WAT 8016 ATOM 61745 O WAT 8017 5.538 22.491 18.461 1.00 0.00 O ATOM 61746 H1 WAT 8017 5.487 23.252 19.039 1.00 0.00 H ATOM 61747 H2 WAT 8017 6.046 21.848 18.956 1.00 0.00 H TER 61749 WAT 8017 ATOM 61749 O WAT 8018 44.241 36.857 95.328 1.00 0.00 O ATOM 61750 H1 WAT 8018 43.695 37.096 96.078 1.00 0.00 H ATOM 61751 H2 WAT 8018 44.585 37.690 95.007 1.00 0.00 H TER 61753 WAT 8018 ATOM 61753 O WAT 8019 135.424 123.311 20.599 1.00 0.00 O ATOM 61754 H1 WAT 8019 136.133 122.668 20.626 1.00 0.00 H ATOM 61755 H2 WAT 8019 135.728 124.025 21.159 1.00 0.00 H TER 61757 WAT 8019 ATOM 61757 O WAT 8020 99.010 112.684 29.036 1.00 0.00 O ATOM 61758 H1 WAT 8020 99.355 113.013 28.206 1.00 0.00 H ATOM 61759 H2 WAT 8020 99.511 111.886 29.205 1.00 0.00 H TER 61761 WAT 8020 ATOM 61761 O WAT 8021 7.906 76.419 101.266 1.00 0.00 O ATOM 61762 H1 WAT 8021 7.879 76.690 100.348 1.00 0.00 H ATOM 61763 H2 WAT 8021 8.822 76.524 101.520 1.00 0.00 H TER 61765 WAT 8021 ATOM 61765 O WAT 8022 93.950 104.962 91.444 1.00 0.00 O ATOM 61766 H1 WAT 8022 93.097 105.250 91.770 1.00 0.00 H ATOM 61767 H2 WAT 8022 94.344 105.753 91.076 1.00 0.00 H TER 61769 WAT 8022 ATOM 61769 O WAT 8023 21.213 144.692 61.671 1.00 0.00 O ATOM 61770 H1 WAT 8023 21.650 143.904 61.993 1.00 0.00 H ATOM 61771 H2 WAT 8023 20.433 144.366 61.222 1.00 0.00 H TER 61773 WAT 8023 ATOM 61773 O WAT 8024 17.071 42.105 81.860 1.00 0.00 O ATOM 61774 H1 WAT 8024 16.122 42.228 81.885 1.00 0.00 H ATOM 61775 H2 WAT 8024 17.414 42.944 81.554 1.00 0.00 H TER 61777 WAT 8024 ATOM 61777 O WAT 8025 130.019 18.033 7.312 1.00 0.00 O ATOM 61778 H1 WAT 8025 129.955 18.669 6.600 1.00 0.00 H ATOM 61779 H2 WAT 8025 129.227 17.502 7.232 1.00 0.00 H TER 61781 WAT 8025 ATOM 61781 O WAT 8026 45.777 139.985 152.126 1.00 0.00 O ATOM 61782 H1 WAT 8026 45.099 140.203 152.767 1.00 0.00 H ATOM 61783 H2 WAT 8026 46.504 140.569 152.339 1.00 0.00 H TER 61785 WAT 8026 ATOM 61785 O WAT 8027 127.319 38.971 87.035 1.00 0.00 O ATOM 61786 H1 WAT 8027 127.102 38.765 87.944 1.00 0.00 H ATOM 61787 H2 WAT 8027 128.258 39.154 87.049 1.00 0.00 H TER 61789 WAT 8027 ATOM 61789 O WAT 8028 121.874 113.312 96.450 1.00 0.00 O ATOM 61790 H1 WAT 8028 122.559 113.384 95.785 1.00 0.00 H ATOM 61791 H2 WAT 8028 121.915 114.141 96.927 1.00 0.00 H TER 61793 WAT 8028 ATOM 61793 O WAT 8029 101.532 36.519 112.887 1.00 0.00 O ATOM 61794 H1 WAT 8029 101.760 37.364 112.500 1.00 0.00 H ATOM 61795 H2 WAT 8029 102.071 35.885 112.414 1.00 0.00 H TER 61797 WAT 8029 ATOM 61797 O WAT 8030 33.178 115.751 81.256 1.00 0.00 O ATOM 61798 H1 WAT 8030 32.598 116.227 80.662 1.00 0.00 H ATOM 61799 H2 WAT 8030 33.751 116.425 81.622 1.00 0.00 H TER 61801 WAT 8030 ATOM 61801 O WAT 8031 107.861 48.127 89.963 1.00 0.00 O ATOM 61802 H1 WAT 8031 108.777 48.138 89.687 1.00 0.00 H ATOM 61803 H2 WAT 8031 107.661 49.041 90.165 1.00 0.00 H TER 61805 WAT 8031 ATOM 61805 O WAT 8032 68.979 113.727 150.228 1.00 0.00 O ATOM 61806 H1 WAT 8032 69.036 114.641 150.505 1.00 0.00 H ATOM 61807 H2 WAT 8032 69.482 113.246 150.885 1.00 0.00 H TER 61809 WAT 8032 ATOM 61809 O WAT 8033 8.144 88.723 145.642 1.00 0.00 O ATOM 61810 H1 WAT 8033 7.550 88.097 145.228 1.00 0.00 H ATOM 61811 H2 WAT 8033 7.566 89.363 146.058 1.00 0.00 H TER 61813 WAT 8033 ATOM 61813 O WAT 8034 15.190 27.700 102.784 1.00 0.00 O ATOM 61814 H1 WAT 8034 15.561 26.840 102.983 1.00 0.00 H ATOM 61815 H2 WAT 8034 14.843 27.611 101.896 1.00 0.00 H TER 61817 WAT 8034 ATOM 61817 O WAT 8035 116.413 38.945 74.496 1.00 0.00 O ATOM 61818 H1 WAT 8035 115.480 39.159 74.506 1.00 0.00 H ATOM 61819 H2 WAT 8035 116.445 38.023 74.243 1.00 0.00 H TER 61821 WAT 8035 ATOM 61821 O WAT 8036 22.328 6.052 75.567 1.00 0.00 O ATOM 61822 H1 WAT 8036 23.224 5.731 75.464 1.00 0.00 H ATOM 61823 H2 WAT 8036 21.845 5.304 75.920 1.00 0.00 H TER 61825 WAT 8036 ATOM 61825 O WAT 8037 56.489 37.175 148.331 1.00 0.00 O ATOM 61826 H1 WAT 8037 57.049 37.236 147.557 1.00 0.00 H ATOM 61827 H2 WAT 8037 55.817 36.538 148.091 1.00 0.00 H TER 61829 WAT 8037 ATOM 61829 O WAT 8038 76.455 75.107 74.483 1.00 0.00 O ATOM 61830 H1 WAT 8038 76.488 75.677 73.716 1.00 0.00 H ATOM 61831 H2 WAT 8038 76.352 75.706 75.223 1.00 0.00 H TER 61833 WAT 8038 ATOM 61833 O WAT 8039 100.372 70.177 85.858 1.00 0.00 O ATOM 61834 H1 WAT 8039 99.904 70.998 86.017 1.00 0.00 H ATOM 61835 H2 WAT 8039 100.908 70.353 85.085 1.00 0.00 H TER 61837 WAT 8039 ATOM 61837 O WAT 8040 100.606 103.946 14.085 1.00 0.00 O ATOM 61838 H1 WAT 8040 100.718 103.916 15.036 1.00 0.00 H ATOM 61839 H2 WAT 8040 101.339 103.436 13.741 1.00 0.00 H TER 61841 WAT 8040 ATOM 61841 O WAT 8041 34.452 59.863 7.104 1.00 0.00 O ATOM 61842 H1 WAT 8041 34.110 60.017 7.985 1.00 0.00 H ATOM 61843 H2 WAT 8041 33.702 59.527 6.612 1.00 0.00 H TER 61845 WAT 8041 ATOM 61845 O WAT 8042 1.183 103.552 55.078 1.00 0.00 O ATOM 61846 H1 WAT 8042 1.702 103.296 55.840 1.00 0.00 H ATOM 61847 H2 WAT 8042 1.093 102.747 54.568 1.00 0.00 H TER 61849 WAT 8042 ATOM 61849 O WAT 8043 27.564 74.362 115.401 1.00 0.00 O ATOM 61850 H1 WAT 8043 27.977 75.224 115.436 1.00 0.00 H ATOM 61851 H2 WAT 8043 28.056 73.888 114.730 1.00 0.00 H TER 61853 WAT 8043 ATOM 61853 O WAT 8044 118.681 121.924 133.727 1.00 0.00 O ATOM 61854 H1 WAT 8044 117.841 122.352 133.894 1.00 0.00 H ATOM 61855 H2 WAT 8044 118.493 121.287 133.038 1.00 0.00 H TER 61857 WAT 8044 ATOM 61857 O WAT 8045 7.549 38.469 150.103 1.00 0.00 O ATOM 61858 H1 WAT 8045 6.639 38.501 150.396 1.00 0.00 H ATOM 61859 H2 WAT 8045 7.819 39.386 150.058 1.00 0.00 H TER 61861 WAT 8045 ATOM 61861 O WAT 8046 38.078 47.674 108.593 1.00 0.00 O ATOM 61862 H1 WAT 8046 37.483 46.953 108.389 1.00 0.00 H ATOM 61863 H2 WAT 8046 38.796 47.577 107.967 1.00 0.00 H TER 61865 WAT 8046 ATOM 61865 O WAT 8047 133.864 29.869 123.392 1.00 0.00 O ATOM 61866 H1 WAT 8047 132.909 29.891 123.454 1.00 0.00 H ATOM 61867 H2 WAT 8047 134.064 30.362 122.596 1.00 0.00 H TER 61869 WAT 8047 ATOM 61869 O WAT 8048 134.164 83.668 78.012 1.00 0.00 O ATOM 61870 H1 WAT 8048 134.044 84.466 77.497 1.00 0.00 H ATOM 61871 H2 WAT 8048 135.013 83.784 78.439 1.00 0.00 H TER 61873 WAT 8048 ATOM 61873 O WAT 8049 101.962 9.131 98.004 1.00 0.00 O ATOM 61874 H1 WAT 8049 102.652 9.056 97.344 1.00 0.00 H ATOM 61875 H2 WAT 8049 102.387 9.555 98.748 1.00 0.00 H TER 61877 WAT 8049 ATOM 61877 O WAT 8050 79.167 117.619 85.229 1.00 0.00 O ATOM 61878 H1 WAT 8050 79.034 116.982 85.930 1.00 0.00 H ATOM 61879 H2 WAT 8050 78.410 117.504 84.654 1.00 0.00 H TER 61881 WAT 8050 ATOM 61881 O WAT 8051 111.145 60.171 143.037 1.00 0.00 O ATOM 61882 H1 WAT 8051 110.278 60.212 143.440 1.00 0.00 H ATOM 61883 H2 WAT 8051 111.459 61.075 143.053 1.00 0.00 H TER 61885 WAT 8051 ATOM 61885 O WAT 8052 67.436 1.022 112.697 1.00 0.00 O ATOM 61886 H1 WAT 8052 67.970 0.246 112.868 1.00 0.00 H ATOM 61887 H2 WAT 8052 67.544 1.564 113.479 1.00 0.00 H TER 61889 WAT 8052 ATOM 61889 O WAT 8053 79.427 125.933 81.919 1.00 0.00 O ATOM 61890 H1 WAT 8053 79.802 125.755 82.782 1.00 0.00 H ATOM 61891 H2 WAT 8053 80.145 126.327 81.423 1.00 0.00 H TER 61893 WAT 8053 ATOM 61893 O WAT 8054 11.392 29.380 4.818 1.00 0.00 O ATOM 61894 H1 WAT 8054 12.166 29.922 4.668 1.00 0.00 H ATOM 61895 H2 WAT 8054 11.497 28.641 4.219 1.00 0.00 H TER 61897 WAT 8054 ATOM 61897 O WAT 8055 77.432 111.749 148.053 1.00 0.00 O ATOM 61898 H1 WAT 8055 77.566 112.486 147.458 1.00 0.00 H ATOM 61899 H2 WAT 8055 78.266 111.657 148.512 1.00 0.00 H TER 61901 WAT 8055 ATOM 61901 O WAT 8056 112.398 50.587 106.080 1.00 0.00 O ATOM 61902 H1 WAT 8056 111.853 50.948 105.382 1.00 0.00 H ATOM 61903 H2 WAT 8056 112.444 51.285 106.734 1.00 0.00 H TER 61905 WAT 8056 ATOM 61905 O WAT 8057 2.465 100.466 3.319 1.00 0.00 O ATOM 61906 H1 WAT 8057 3.190 99.910 3.032 1.00 0.00 H ATOM 61907 H2 WAT 8057 2.428 100.342 4.267 1.00 0.00 H TER 61909 WAT 8057 ATOM 61909 O WAT 8058 140.636 53.466 122.670 1.00 0.00 O ATOM 61910 H1 WAT 8058 141.199 54.078 122.196 1.00 0.00 H ATOM 61911 H2 WAT 8058 140.439 53.911 123.494 1.00 0.00 H TER 61913 WAT 8058 ATOM 61913 O WAT 8059 85.756 45.824 5.240 1.00 0.00 O ATOM 61914 H1 WAT 8059 86.500 46.414 5.114 1.00 0.00 H ATOM 61915 H2 WAT 8059 84.989 46.358 5.034 1.00 0.00 H TER 61917 WAT 8059 ATOM 61917 O WAT 8060 43.592 121.118 77.324 1.00 0.00 O ATOM 61918 H1 WAT 8060 42.711 121.087 77.699 1.00 0.00 H ATOM 61919 H2 WAT 8060 44.011 120.314 77.631 1.00 0.00 H TER 61921 WAT 8060 ATOM 61921 O WAT 8061 4.540 118.997 147.245 1.00 0.00 O ATOM 61922 H1 WAT 8061 4.764 118.909 146.319 1.00 0.00 H ATOM 61923 H2 WAT 8061 5.358 119.263 147.665 1.00 0.00 H TER 61925 WAT 8061 ATOM 61925 O WAT 8062 140.099 83.855 108.815 1.00 0.00 O ATOM 61926 H1 WAT 8062 139.455 83.149 108.873 1.00 0.00 H ATOM 61927 H2 WAT 8062 140.934 83.436 109.023 1.00 0.00 H TER 61929 WAT 8062 ATOM 61929 O WAT 8063 52.934 10.683 139.538 1.00 0.00 O ATOM 61930 H1 WAT 8063 52.519 10.835 138.690 1.00 0.00 H ATOM 61931 H2 WAT 8063 53.107 11.560 139.881 1.00 0.00 H TER 61933 WAT 8063 ATOM 61933 O WAT 8064 3.411 8.836 68.034 1.00 0.00 O ATOM 61934 H1 WAT 8064 2.925 9.497 67.541 1.00 0.00 H ATOM 61935 H2 WAT 8064 4.162 8.628 67.480 1.00 0.00 H TER 61937 WAT 8064 ATOM 61937 O WAT 8065 76.946 96.603 153.505 1.00 0.00 O ATOM 61938 H1 WAT 8065 77.598 97.282 153.678 1.00 0.00 H ATOM 61939 H2 WAT 8065 77.428 95.781 153.586 1.00 0.00 H TER 61941 WAT 8065 ATOM 61941 O WAT 8066 78.991 31.452 126.341 1.00 0.00 O ATOM 61942 H1 WAT 8066 79.408 30.641 126.633 1.00 0.00 H ATOM 61943 H2 WAT 8066 78.262 31.162 125.792 1.00 0.00 H TER 61945 WAT 8066 ATOM 61945 O WAT 8067 140.310 24.502 3.937 1.00 0.00 O ATOM 61946 H1 WAT 8067 140.194 25.283 4.478 1.00 0.00 H ATOM 61947 H2 WAT 8067 140.824 23.906 4.482 1.00 0.00 H TER 61949 WAT 8067 ATOM 61949 O WAT 8068 13.092 110.353 2.080 1.00 0.00 O ATOM 61950 H1 WAT 8068 13.432 110.979 2.719 1.00 0.00 H ATOM 61951 H2 WAT 8068 13.717 110.387 1.356 1.00 0.00 H TER 61953 WAT 8068 ATOM 61953 O WAT 8069 102.986 126.337 120.603 1.00 0.00 O ATOM 61954 H1 WAT 8069 102.351 126.372 121.318 1.00 0.00 H ATOM 61955 H2 WAT 8069 103.424 127.187 120.629 1.00 0.00 H TER 61957 WAT 8069 ATOM 61957 O WAT 8070 15.854 100.882 86.246 1.00 0.00 O ATOM 61958 H1 WAT 8070 15.972 101.473 85.502 1.00 0.00 H ATOM 61959 H2 WAT 8070 15.320 100.166 85.900 1.00 0.00 H TER 61961 WAT 8070 ATOM 61961 O WAT 8071 139.181 117.343 9.095 1.00 0.00 O ATOM 61962 H1 WAT 8071 139.228 116.402 9.263 1.00 0.00 H ATOM 61963 H2 WAT 8071 139.019 117.732 9.955 1.00 0.00 H TER 61965 WAT 8071 ATOM 61965 O WAT 8072 124.932 63.254 149.792 1.00 0.00 O ATOM 61966 H1 WAT 8072 125.434 64.063 149.694 1.00 0.00 H ATOM 61967 H2 WAT 8072 124.508 63.338 150.647 1.00 0.00 H TER 61969 WAT 8072 ATOM 61969 O WAT 8073 13.644 19.647 25.500 1.00 0.00 O ATOM 61970 H1 WAT 8073 13.695 20.554 25.197 1.00 0.00 H ATOM 61971 H2 WAT 8073 14.461 19.249 25.199 1.00 0.00 H TER 61973 WAT 8073 ATOM 61973 O WAT 8074 133.597 23.221 146.797 1.00 0.00 O ATOM 61974 H1 WAT 8074 132.756 22.797 146.969 1.00 0.00 H ATOM 61975 H2 WAT 8074 134.146 22.977 147.542 1.00 0.00 H TER 61977 WAT 8074 ATOM 61977 O WAT 8075 68.423 122.565 103.087 1.00 0.00 O ATOM 61978 H1 WAT 8075 68.569 122.780 104.008 1.00 0.00 H ATOM 61979 H2 WAT 8075 68.869 121.728 102.962 1.00 0.00 H TER 61981 WAT 8075 ATOM 61981 O WAT 8076 17.637 141.297 17.715 1.00 0.00 O ATOM 61982 H1 WAT 8076 17.598 141.578 18.630 1.00 0.00 H ATOM 61983 H2 WAT 8076 16.729 141.338 17.414 1.00 0.00 H TER 61985 WAT 8076 ATOM 61985 O WAT 8077 37.142 72.640 147.356 1.00 0.00 O ATOM 61986 H1 WAT 8077 36.414 73.064 147.809 1.00 0.00 H ATOM 61987 H2 WAT 8077 36.725 72.109 146.678 1.00 0.00 H TER 61989 WAT 8077 ATOM 61989 O WAT 8078 45.770 141.981 95.668 1.00 0.00 O ATOM 61990 H1 WAT 8078 45.763 142.666 96.336 1.00 0.00 H ATOM 61991 H2 WAT 8078 46.693 141.742 95.580 1.00 0.00 H TER 61993 WAT 8078 ATOM 61993 O WAT 8079 24.702 126.879 69.372 1.00 0.00 O ATOM 61994 H1 WAT 8079 24.525 126.244 68.677 1.00 0.00 H ATOM 61995 H2 WAT 8079 23.892 127.383 69.448 1.00 0.00 H TER 61997 WAT 8079 ATOM 61997 O WAT 8080 133.293 65.849 108.569 1.00 0.00 O ATOM 61998 H1 WAT 8080 134.247 65.920 108.533 1.00 0.00 H ATOM 61999 H2 WAT 8080 133.076 65.195 107.905 1.00 0.00 H TER 62001 WAT 8080 ATOM 62001 O WAT 8081 100.789 97.959 134.446 1.00 0.00 O ATOM 62002 H1 WAT 8081 100.636 97.073 134.117 1.00 0.00 H ATOM 62003 H2 WAT 8081 101.150 98.433 133.697 1.00 0.00 H TER 62005 WAT 8081 ATOM 62005 O WAT 8082 80.583 120.718 129.243 1.00 0.00 O ATOM 62006 H1 WAT 8082 79.801 120.507 128.732 1.00 0.00 H ATOM 62007 H2 WAT 8082 81.046 119.885 129.328 1.00 0.00 H TER 62009 WAT 8082 ATOM 62009 O WAT 8083 85.230 28.290 143.979 1.00 0.00 O ATOM 62010 H1 WAT 8083 85.809 28.172 144.732 1.00 0.00 H ATOM 62011 H2 WAT 8083 84.356 28.090 144.316 1.00 0.00 H TER 62013 WAT 8083 ATOM 62013 O WAT 8084 15.786 104.183 128.922 1.00 0.00 O ATOM 62014 H1 WAT 8084 16.045 104.821 128.256 1.00 0.00 H ATOM 62015 H2 WAT 8084 16.283 103.394 128.704 1.00 0.00 H TER 62017 WAT 8084 ATOM 62017 O WAT 8085 131.261 81.110 62.804 1.00 0.00 O ATOM 62018 H1 WAT 8085 130.999 80.322 63.280 1.00 0.00 H ATOM 62019 H2 WAT 8085 131.189 81.814 63.448 1.00 0.00 H TER 62021 WAT 8085 ATOM 62021 O WAT 8086 17.538 20.805 25.614 1.00 0.00 O ATOM 62022 H1 WAT 8086 18.083 21.360 26.171 1.00 0.00 H ATOM 62023 H2 WAT 8086 17.769 21.061 24.721 1.00 0.00 H TER 62025 WAT 8086 ATOM 62025 O WAT 8087 91.384 47.181 152.510 1.00 0.00 O ATOM 62026 H1 WAT 8087 92.095 47.797 152.689 1.00 0.00 H ATOM 62027 H2 WAT 8087 91.762 46.549 151.900 1.00 0.00 H TER 62029 WAT 8087 ATOM 62029 O WAT 8088 138.633 67.152 1.420 1.00 0.00 O ATOM 62030 H1 WAT 8088 139.536 67.126 1.103 1.00 0.00 H ATOM 62031 H2 WAT 8088 138.493 66.292 1.816 1.00 0.00 H TER 62033 WAT 8088 ATOM 62033 O WAT 8089 89.716 103.677 70.439 1.00 0.00 O ATOM 62034 H1 WAT 8089 90.183 103.712 71.273 1.00 0.00 H ATOM 62035 H2 WAT 8089 88.878 103.264 70.651 1.00 0.00 H TER 62037 WAT 8089 ATOM 62037 O WAT 8090 100.124 65.183 9.117 1.00 0.00 O ATOM 62038 H1 WAT 8090 99.258 64.795 9.248 1.00 0.00 H ATOM 62039 H2 WAT 8090 99.947 66.034 8.716 1.00 0.00 H TER 62041 WAT 8090 ATOM 62041 O WAT 8091 40.209 122.791 75.004 1.00 0.00 O ATOM 62042 H1 WAT 8091 40.260 121.861 74.783 1.00 0.00 H ATOM 62043 H2 WAT 8091 40.558 123.240 74.235 1.00 0.00 H TER 62045 WAT 8091 ATOM 62045 O WAT 8092 102.949 104.350 152.263 1.00 0.00 O ATOM 62046 H1 WAT 8092 102.347 105.016 152.593 1.00 0.00 H ATOM 62047 H2 WAT 8092 102.933 103.662 152.928 1.00 0.00 H TER 62049 WAT 8092 ATOM 62049 O WAT 8093 95.619 133.072 62.269 1.00 0.00 O ATOM 62050 H1 WAT 8093 96.028 132.397 61.728 1.00 0.00 H ATOM 62051 H2 WAT 8093 95.107 133.596 61.653 1.00 0.00 H TER 62053 WAT 8093 ATOM 62053 O WAT 8094 91.419 89.542 137.718 1.00 0.00 O ATOM 62054 H1 WAT 8094 91.583 90.185 138.408 1.00 0.00 H ATOM 62055 H2 WAT 8094 92.216 89.551 137.188 1.00 0.00 H TER 62057 WAT 8094 ATOM 62057 O WAT 8095 13.672 125.939 65.218 1.00 0.00 O ATOM 62058 H1 WAT 8095 13.343 125.666 64.361 1.00 0.00 H ATOM 62059 H2 WAT 8095 14.308 126.628 65.021 1.00 0.00 H TER 62061 WAT 8095 ATOM 62061 O WAT 8096 52.418 102.918 101.808 1.00 0.00 O ATOM 62062 H1 WAT 8096 51.810 102.834 102.542 1.00 0.00 H ATOM 62063 H2 WAT 8096 52.170 103.740 101.384 1.00 0.00 H TER 62065 WAT 8096 ATOM 62065 O WAT 8097 31.901 74.905 104.470 1.00 0.00 O ATOM 62066 H1 WAT 8097 32.624 74.296 104.619 1.00 0.00 H ATOM 62067 H2 WAT 8097 31.299 74.744 105.197 1.00 0.00 H TER 62069 WAT 8097 ATOM 62069 O WAT 8098 85.719 50.936 72.344 1.00 0.00 O ATOM 62070 H1 WAT 8098 86.550 51.230 72.717 1.00 0.00 H ATOM 62071 H2 WAT 8098 85.850 50.986 71.398 1.00 0.00 H TER 62073 WAT 8098 ATOM 62073 O WAT 8099 9.905 21.533 148.800 1.00 0.00 O ATOM 62074 H1 WAT 8099 10.027 21.468 149.747 1.00 0.00 H ATOM 62075 H2 WAT 8099 9.593 22.427 148.660 1.00 0.00 H TER 62077 WAT 8099 ATOM 62077 O WAT 8100 94.891 125.570 91.692 1.00 0.00 O ATOM 62078 H1 WAT 8100 95.472 125.656 90.936 1.00 0.00 H ATOM 62079 H2 WAT 8100 94.751 124.627 91.780 1.00 0.00 H TER 62081 WAT 8100 ATOM 62081 O WAT 8101 73.547 112.709 131.437 1.00 0.00 O ATOM 62082 H1 WAT 8101 73.895 111.936 130.992 1.00 0.00 H ATOM 62083 H2 WAT 8101 74.194 112.907 132.114 1.00 0.00 H TER 62085 WAT 8101 ATOM 62085 O WAT 8102 69.621 116.690 135.704 1.00 0.00 O ATOM 62086 H1 WAT 8102 70.206 116.165 136.249 1.00 0.00 H ATOM 62087 H2 WAT 8102 70.206 117.173 135.120 1.00 0.00 H TER 62089 WAT 8102 ATOM 62089 O WAT 8103 65.347 101.657 84.199 1.00 0.00 O ATOM 62090 H1 WAT 8103 65.335 102.109 85.043 1.00 0.00 H ATOM 62091 H2 WAT 8103 65.471 100.735 84.422 1.00 0.00 H TER 62093 WAT 8103 ATOM 62093 O WAT 8104 109.731 36.262 119.926 1.00 0.00 O ATOM 62094 H1 WAT 8104 109.291 37.067 120.197 1.00 0.00 H ATOM 62095 H2 WAT 8104 110.647 36.515 119.816 1.00 0.00 H TER 62097 WAT 8104 ATOM 62097 O WAT 8105 10.723 68.203 124.295 1.00 0.00 O ATOM 62098 H1 WAT 8105 9.787 68.170 124.095 1.00 0.00 H ATOM 62099 H2 WAT 8105 10.938 67.314 124.577 1.00 0.00 H TER 62101 WAT 8105 ATOM 62101 O WAT 8106 5.119 115.130 156.350 1.00 0.00 O ATOM 62102 H1 WAT 8106 5.127 115.892 156.930 1.00 0.00 H ATOM 62103 H2 WAT 8106 4.307 115.218 155.851 1.00 0.00 H TER 62105 WAT 8106 ATOM 62105 O WAT 8107 140.855 69.523 3.960 1.00 0.00 O ATOM 62106 H1 WAT 8107 140.680 68.594 3.809 1.00 0.00 H ATOM 62107 H2 WAT 8107 141.501 69.534 4.666 1.00 0.00 H TER 62109 WAT 8107 ATOM 62109 O WAT 8108 124.264 48.950 24.244 1.00 0.00 O ATOM 62110 H1 WAT 8108 123.902 49.253 25.077 1.00 0.00 H ATOM 62111 H2 WAT 8108 124.360 48.004 24.355 1.00 0.00 H TER 62113 WAT 8108 ATOM 62113 O WAT 8109 121.682 70.894 141.687 1.00 0.00 O ATOM 62114 H1 WAT 8109 121.863 71.709 142.156 1.00 0.00 H ATOM 62115 H2 WAT 8109 121.169 70.371 142.303 1.00 0.00 H TER 62117 WAT 8109 ATOM 62117 O WAT 8110 62.852 47.998 109.933 1.00 0.00 O ATOM 62118 H1 WAT 8110 63.393 47.235 109.731 1.00 0.00 H ATOM 62119 H2 WAT 8110 62.099 47.920 109.348 1.00 0.00 H TER 62121 WAT 8110 ATOM 62121 O WAT 8111 69.552 106.041 110.916 1.00 0.00 O ATOM 62122 H1 WAT 8111 69.628 106.924 110.554 1.00 0.00 H ATOM 62123 H2 WAT 8111 69.830 105.465 110.203 1.00 0.00 H TER 62125 WAT 8111 ATOM 62125 O WAT 8112 66.764 40.381 146.225 1.00 0.00 O ATOM 62126 H1 WAT 8112 66.843 40.612 145.300 1.00 0.00 H ATOM 62127 H2 WAT 8112 67.606 39.983 146.445 1.00 0.00 H TER 62129 WAT 8112 ATOM 62129 O WAT 8113 119.404 6.338 109.056 1.00 0.00 O ATOM 62130 H1 WAT 8113 120.212 6.839 109.174 1.00 0.00 H ATOM 62131 H2 WAT 8113 118.713 7.000 109.042 1.00 0.00 H TER 62133 WAT 8113 ATOM 62133 O WAT 8114 41.423 111.355 138.286 1.00 0.00 O ATOM 62134 H1 WAT 8114 42.152 111.937 138.502 1.00 0.00 H ATOM 62135 H2 WAT 8114 40.673 111.729 138.749 1.00 0.00 H TER 62137 WAT 8114 ATOM 62137 O WAT 8115 98.895 102.035 26.056 1.00 0.00 O ATOM 62138 H1 WAT 8115 99.773 101.708 25.862 1.00 0.00 H ATOM 62139 H2 WAT 8115 98.313 101.309 25.829 1.00 0.00 H TER 62141 WAT 8115 ATOM 62141 O WAT 8116 14.558 25.746 8.446 1.00 0.00 O ATOM 62142 H1 WAT 8116 14.887 24.850 8.366 1.00 0.00 H ATOM 62143 H2 WAT 8116 14.137 25.770 9.305 1.00 0.00 H TER 62145 WAT 8116 ATOM 62145 O WAT 8117 32.315 82.504 126.379 1.00 0.00 O ATOM 62146 H1 WAT 8117 32.645 81.638 126.620 1.00 0.00 H ATOM 62147 H2 WAT 8117 31.376 82.461 126.560 1.00 0.00 H TER 62149 WAT 8117 ATOM 62149 O WAT 8118 120.719 134.965 26.220 1.00 0.00 O ATOM 62150 H1 WAT 8118 121.274 134.370 26.725 1.00 0.00 H ATOM 62151 H2 WAT 8118 119.835 134.806 26.552 1.00 0.00 H TER 62153 WAT 8118 ATOM 62153 O WAT 8119 108.003 89.290 0.448 1.00 0.00 O ATOM 62154 H1 WAT 8119 108.346 88.994 -0.396 1.00 0.00 H ATOM 62155 H2 WAT 8119 108.751 89.705 0.878 1.00 0.00 H TER 62157 WAT 8119 ATOM 62157 O WAT 8120 113.250 116.311 136.545 1.00 0.00 O ATOM 62158 H1 WAT 8120 112.544 116.946 136.663 1.00 0.00 H ATOM 62159 H2 WAT 8120 112.826 115.553 136.143 1.00 0.00 H TER 62161 WAT 8120 ATOM 62161 O WAT 8121 141.161 46.072 118.538 1.00 0.00 O ATOM 62162 H1 WAT 8121 140.503 46.538 118.022 1.00 0.00 H ATOM 62163 H2 WAT 8121 141.411 46.691 119.224 1.00 0.00 H TER 62165 WAT 8121 ATOM 62165 O WAT 8122 102.577 10.934 55.996 1.00 0.00 O ATOM 62166 H1 WAT 8122 101.689 10.788 55.669 1.00 0.00 H ATOM 62167 H2 WAT 8122 102.937 11.608 55.420 1.00 0.00 H TER 62169 WAT 8122 ATOM 62169 O WAT 8123 74.490 25.441 77.305 1.00 0.00 O ATOM 62170 H1 WAT 8123 74.705 26.372 77.343 1.00 0.00 H ATOM 62171 H2 WAT 8123 74.345 25.191 78.218 1.00 0.00 H TER 62173 WAT 8123 ATOM 62173 O WAT 8124 59.787 86.717 80.346 1.00 0.00 O ATOM 62174 H1 WAT 8124 58.865 86.777 80.095 1.00 0.00 H ATOM 62175 H2 WAT 8124 60.080 85.883 79.980 1.00 0.00 H TER 62177 WAT 8124 ATOM 62177 O WAT 8125 108.083 102.635 125.868 1.00 0.00 O ATOM 62178 H1 WAT 8125 107.347 102.875 126.430 1.00 0.00 H ATOM 62179 H2 WAT 8125 108.829 103.109 126.234 1.00 0.00 H TER 62181 WAT 8125 ATOM 62181 O WAT 8126 103.781 3.280 98.176 1.00 0.00 O ATOM 62182 H1 WAT 8126 104.418 3.272 97.462 1.00 0.00 H ATOM 62183 H2 WAT 8126 102.933 3.354 97.739 1.00 0.00 H TER 62185 WAT 8126 ATOM 62185 O WAT 8127 15.093 78.342 115.043 1.00 0.00 O ATOM 62186 H1 WAT 8127 14.410 77.870 115.520 1.00 0.00 H ATOM 62187 H2 WAT 8127 14.620 79.009 114.546 1.00 0.00 H TER 62189 WAT 8127 ATOM 62189 O WAT 8128 94.557 134.246 85.197 1.00 0.00 O ATOM 62190 H1 WAT 8128 93.664 133.906 85.141 1.00 0.00 H ATOM 62191 H2 WAT 8128 94.475 135.172 84.971 1.00 0.00 H TER 62193 WAT 8128 ATOM 62193 O WAT 8129 89.632 40.556 27.079 1.00 0.00 O ATOM 62194 H1 WAT 8129 89.129 40.521 26.265 1.00 0.00 H ATOM 62195 H2 WAT 8129 89.929 41.464 27.139 1.00 0.00 H TER 62197 WAT 8129 ATOM 62197 O WAT 8130 6.686 48.896 85.624 1.00 0.00 O ATOM 62198 H1 WAT 8130 5.904 49.079 85.102 1.00 0.00 H ATOM 62199 H2 WAT 8130 7.155 49.730 85.652 1.00 0.00 H TER 62201 WAT 8130 ATOM 62201 O WAT 8131 0.146 115.489 10.080 1.00 0.00 O ATOM 62202 H1 WAT 8131 1.073 115.565 9.852 1.00 0.00 H ATOM 62203 H2 WAT 8131 -0.317 115.663 9.260 1.00 0.00 H TER 62205 WAT 8131 ATOM 62205 O WAT 8132 38.726 45.792 86.640 1.00 0.00 O ATOM 62206 H1 WAT 8132 38.421 45.077 87.199 1.00 0.00 H ATOM 62207 H2 WAT 8132 38.891 45.379 85.793 1.00 0.00 H TER 62209 WAT 8132 ATOM 62209 O WAT 8133 35.950 144.348 129.884 1.00 0.00 O ATOM 62210 H1 WAT 8133 35.056 144.351 130.226 1.00 0.00 H ATOM 62211 H2 WAT 8133 36.493 144.602 130.631 1.00 0.00 H TER 62213 WAT 8133 ATOM 62213 O WAT 8134 12.158 130.626 127.355 1.00 0.00 O ATOM 62214 H1 WAT 8134 12.095 131.214 126.602 1.00 0.00 H ATOM 62215 H2 WAT 8134 11.572 131.010 128.007 1.00 0.00 H TER 62217 WAT 8134 ATOM 62217 O WAT 8135 92.400 121.358 78.858 1.00 0.00 O ATOM 62218 H1 WAT 8135 93.089 120.705 78.980 1.00 0.00 H ATOM 62219 H2 WAT 8135 91.702 121.083 79.453 1.00 0.00 H TER 62221 WAT 8135 ATOM 62221 O WAT 8136 114.366 130.033 99.391 1.00 0.00 O ATOM 62222 H1 WAT 8136 114.863 129.338 98.961 1.00 0.00 H ATOM 62223 H2 WAT 8136 113.606 129.587 99.766 1.00 0.00 H TER 62225 WAT 8136 ATOM 62225 O WAT 8137 88.671 85.299 141.431 1.00 0.00 O ATOM 62226 H1 WAT 8137 88.786 86.230 141.620 1.00 0.00 H ATOM 62227 H2 WAT 8137 88.335 84.929 142.248 1.00 0.00 H TER 62229 WAT 8137 ATOM 62229 O WAT 8138 55.054 137.015 100.034 1.00 0.00 O ATOM 62230 H1 WAT 8138 54.415 137.350 100.663 1.00 0.00 H ATOM 62231 H2 WAT 8138 55.846 137.525 100.203 1.00 0.00 H TER 62233 WAT 8138 ATOM 62233 O WAT 8139 103.145 114.998 20.787 1.00 0.00 O ATOM 62234 H1 WAT 8139 102.712 114.168 20.986 1.00 0.00 H ATOM 62235 H2 WAT 8139 102.785 115.615 21.424 1.00 0.00 H TER 62237 WAT 8139 ATOM 62237 O WAT 8140 101.889 53.076 133.009 1.00 0.00 O ATOM 62238 H1 WAT 8140 102.441 52.714 132.316 1.00 0.00 H ATOM 62239 H2 WAT 8140 102.161 53.991 133.078 1.00 0.00 H TER 62241 WAT 8140 ATOM 62241 O WAT 8141 94.467 94.294 22.847 1.00 0.00 O ATOM 62242 H1 WAT 8141 94.258 95.157 22.490 1.00 0.00 H ATOM 62243 H2 WAT 8141 93.791 94.137 23.506 1.00 0.00 H TER 62245 WAT 8141 ATOM 62245 O WAT 8142 119.743 96.480 4.326 1.00 0.00 O ATOM 62246 H1 WAT 8142 119.376 95.598 4.391 1.00 0.00 H ATOM 62247 H2 WAT 8142 119.987 96.570 3.405 1.00 0.00 H TER 62249 WAT 8142 ATOM 62249 O WAT 8143 118.486 81.909 70.234 1.00 0.00 O ATOM 62250 H1 WAT 8143 118.643 81.649 71.142 1.00 0.00 H ATOM 62251 H2 WAT 8143 118.954 81.256 69.713 1.00 0.00 H TER 62253 WAT 8143 ATOM 62253 O WAT 8144 129.375 42.079 56.857 1.00 0.00 O ATOM 62254 H1 WAT 8144 128.609 42.610 57.075 1.00 0.00 H ATOM 62255 H2 WAT 8144 129.078 41.175 56.967 1.00 0.00 H TER 62257 WAT 8144 ATOM 62257 O WAT 8145 69.045 135.880 98.719 1.00 0.00 O ATOM 62258 H1 WAT 8145 68.522 136.617 98.404 1.00 0.00 H ATOM 62259 H2 WAT 8145 69.886 135.973 98.271 1.00 0.00 H TER 62261 WAT 8145 ATOM 62261 O WAT 8146 100.534 48.948 8.292 1.00 0.00 O ATOM 62262 H1 WAT 8146 99.880 48.266 8.140 1.00 0.00 H ATOM 62263 H2 WAT 8146 101.370 48.529 8.088 1.00 0.00 H TER 62265 WAT 8146 ATOM 62265 O WAT 8147 98.673 86.496 130.963 1.00 0.00 O ATOM 62266 H1 WAT 8147 98.022 86.616 130.271 1.00 0.00 H ATOM 62267 H2 WAT 8147 98.954 87.384 131.184 1.00 0.00 H TER 62269 WAT 8147 ATOM 62269 O WAT 8148 42.893 142.427 7.696 1.00 0.00 O ATOM 62270 H1 WAT 8148 43.461 143.173 7.892 1.00 0.00 H ATOM 62271 H2 WAT 8148 42.545 142.614 6.824 1.00 0.00 H TER 62273 WAT 8148 ATOM 62273 O WAT 8149 109.138 132.462 141.080 1.00 0.00 O ATOM 62274 H1 WAT 8149 109.298 131.803 140.405 1.00 0.00 H ATOM 62275 H2 WAT 8149 109.500 133.270 140.717 1.00 0.00 H TER 62277 WAT 8149 ATOM 62277 O WAT 8150 10.802 67.649 138.199 1.00 0.00 O ATOM 62278 H1 WAT 8150 9.996 67.922 137.762 1.00 0.00 H ATOM 62279 H2 WAT 8150 10.577 66.820 138.621 1.00 0.00 H TER 62281 WAT 8150 ATOM 62281 O WAT 8151 13.572 70.527 89.520 1.00 0.00 O ATOM 62282 H1 WAT 8151 14.461 70.196 89.391 1.00 0.00 H ATOM 62283 H2 WAT 8151 13.668 71.228 90.165 1.00 0.00 H TER 62285 WAT 8151 ATOM 62285 O WAT 8152 132.652 15.459 78.968 1.00 0.00 O ATOM 62286 H1 WAT 8152 132.636 14.765 78.308 1.00 0.00 H ATOM 62287 H2 WAT 8152 131.801 15.888 78.885 1.00 0.00 H TER 62289 WAT 8152 ATOM 62289 O WAT 8153 47.059 137.202 64.664 1.00 0.00 O ATOM 62290 H1 WAT 8153 47.892 137.408 65.087 1.00 0.00 H ATOM 62291 H2 WAT 8153 46.769 136.394 65.086 1.00 0.00 H TER 62293 WAT 8153 ATOM 62293 O WAT 8154 142.416 32.123 105.224 1.00 0.00 O ATOM 62294 H1 WAT 8154 141.961 32.910 104.922 1.00 0.00 H ATOM 62295 H2 WAT 8154 141.782 31.417 105.099 1.00 0.00 H TER 62297 WAT 8154 ATOM 62297 O WAT 8155 73.233 9.924 73.652 1.00 0.00 O ATOM 62298 H1 WAT 8155 73.633 9.213 74.152 1.00 0.00 H ATOM 62299 H2 WAT 8155 73.710 10.707 73.927 1.00 0.00 H TER 62301 WAT 8155 ATOM 62301 O WAT 8156 116.648 118.824 129.259 1.00 0.00 O ATOM 62302 H1 WAT 8156 116.181 119.075 130.056 1.00 0.00 H ATOM 62303 H2 WAT 8156 116.053 119.063 128.547 1.00 0.00 H TER 62305 WAT 8156 ATOM 62305 O WAT 8157 134.740 58.631 25.545 1.00 0.00 O ATOM 62306 H1 WAT 8157 134.246 58.588 26.364 1.00 0.00 H ATOM 62307 H2 WAT 8157 134.964 59.557 25.448 1.00 0.00 H TER 62309 WAT 8157 ATOM 62309 O WAT 8158 106.169 32.611 0.405 1.00 0.00 O ATOM 62310 H1 WAT 8158 106.526 32.903 -0.434 1.00 0.00 H ATOM 62311 H2 WAT 8158 105.626 31.854 0.183 1.00 0.00 H TER 62313 WAT 8158 ATOM 62313 O WAT 8159 109.588 86.822 13.135 1.00 0.00 O ATOM 62314 H1 WAT 8159 109.597 86.004 12.637 1.00 0.00 H ATOM 62315 H2 WAT 8159 108.707 87.172 13.004 1.00 0.00 H TER 62317 WAT 8159 ATOM 62317 O WAT 8160 99.468 90.669 59.883 1.00 0.00 O ATOM 62318 H1 WAT 8160 98.703 90.347 59.407 1.00 0.00 H ATOM 62319 H2 WAT 8160 100.120 90.839 59.203 1.00 0.00 H TER 62321 WAT 8160 ATOM 62321 O WAT 8161 115.745 132.234 98.678 1.00 0.00 O ATOM 62322 H1 WAT 8161 115.185 131.493 98.910 1.00 0.00 H ATOM 62323 H2 WAT 8161 116.152 132.494 99.504 1.00 0.00 H TER 62325 WAT 8161 ATOM 62325 O WAT 8162 3.093 53.579 117.078 1.00 0.00 O ATOM 62326 H1 WAT 8162 2.978 53.608 116.128 1.00 0.00 H ATOM 62327 H2 WAT 8162 2.218 53.394 117.420 1.00 0.00 H TER 62329 WAT 8162 ATOM 62329 O WAT 8163 19.393 84.465 92.715 1.00 0.00 O ATOM 62330 H1 WAT 8163 20.150 84.260 93.264 1.00 0.00 H ATOM 62331 H2 WAT 8163 18.778 83.751 92.879 1.00 0.00 H TER 62333 WAT 8163 ATOM 62333 O WAT 8164 104.803 54.523 106.796 1.00 0.00 O ATOM 62334 H1 WAT 8164 105.150 53.688 107.111 1.00 0.00 H ATOM 62335 H2 WAT 8164 105.073 55.160 107.457 1.00 0.00 H TER 62337 WAT 8164 ATOM 62337 O WAT 8165 19.963 115.419 99.170 1.00 0.00 O ATOM 62338 H1 WAT 8165 19.478 116.228 99.004 1.00 0.00 H ATOM 62339 H2 WAT 8165 20.668 115.426 98.523 1.00 0.00 H TER 62341 WAT 8165 ATOM 62341 O WAT 8166 14.099 41.515 152.954 1.00 0.00 O ATOM 62342 H1 WAT 8166 14.445 40.625 152.881 1.00 0.00 H ATOM 62343 H2 WAT 8166 14.873 42.076 152.923 1.00 0.00 H TER 62345 WAT 8166 ATOM 62345 O WAT 8167 18.242 0.305 128.403 1.00 0.00 O ATOM 62346 H1 WAT 8167 17.290 0.323 128.509 1.00 0.00 H ATOM 62347 H2 WAT 8167 18.387 0.574 127.497 1.00 0.00 H TER 62349 WAT 8167 ATOM 62349 O WAT 8168 80.964 94.548 74.490 1.00 0.00 O ATOM 62350 H1 WAT 8168 81.535 94.433 75.250 1.00 0.00 H ATOM 62351 H2 WAT 8168 80.081 94.583 74.858 1.00 0.00 H TER 62353 WAT 8168 ATOM 62353 O WAT 8169 28.497 117.063 80.210 1.00 0.00 O ATOM 62354 H1 WAT 8169 29.330 117.353 79.839 1.00 0.00 H ATOM 62355 H2 WAT 8169 28.011 117.873 80.368 1.00 0.00 H TER 62357 WAT 8169 ATOM 62357 O WAT 8170 16.933 36.075 76.900 1.00 0.00 O ATOM 62358 H1 WAT 8170 16.237 35.598 77.352 1.00 0.00 H ATOM 62359 H2 WAT 8170 17.038 36.881 77.404 1.00 0.00 H TER 62361 WAT 8170 ATOM 62361 O WAT 8171 115.564 75.371 107.421 1.00 0.00 O ATOM 62362 H1 WAT 8171 115.340 76.233 107.772 1.00 0.00 H ATOM 62363 H2 WAT 8171 116.334 75.528 106.875 1.00 0.00 H TER 62365 WAT 8171 ATOM 62365 O WAT 8172 47.438 144.622 77.463 1.00 0.00 O ATOM 62366 H1 WAT 8172 46.961 144.486 76.645 1.00 0.00 H ATOM 62367 H2 WAT 8172 47.446 143.761 77.882 1.00 0.00 H TER 62369 WAT 8172 ATOM 62369 O WAT 8173 12.985 132.741 62.792 1.00 0.00 O ATOM 62370 H1 WAT 8173 13.074 132.556 63.727 1.00 0.00 H ATOM 62371 H2 WAT 8173 12.040 132.780 62.645 1.00 0.00 H TER 62373 WAT 8173 ATOM 62373 O WAT 8174 60.215 107.443 5.710 1.00 0.00 O ATOM 62374 H1 WAT 8174 60.634 107.941 5.009 1.00 0.00 H ATOM 62375 H2 WAT 8174 60.669 107.721 6.506 1.00 0.00 H TER 62377 WAT 8174 ATOM 62377 O WAT 8175 83.269 86.477 158.049 1.00 0.00 O ATOM 62378 H1 WAT 8175 83.834 85.980 157.457 1.00 0.00 H ATOM 62379 H2 WAT 8175 83.826 87.186 158.372 1.00 0.00 H TER 62381 WAT 8175 ATOM 62381 O WAT 8176 9.529 121.980 12.868 1.00 0.00 O ATOM 62382 H1 WAT 8176 9.456 122.861 13.236 1.00 0.00 H ATOM 62383 H2 WAT 8176 9.449 121.398 13.623 1.00 0.00 H TER 62385 WAT 8176 ATOM 62385 O WAT 8177 10.597 49.325 112.898 1.00 0.00 O ATOM 62386 H1 WAT 8177 10.283 49.442 112.002 1.00 0.00 H ATOM 62387 H2 WAT 8177 11.146 48.542 112.859 1.00 0.00 H TER 62389 WAT 8177 ATOM 62389 O WAT 8178 127.806 130.351 107.166 1.00 0.00 O ATOM 62390 H1 WAT 8178 128.667 130.296 107.579 1.00 0.00 H ATOM 62391 H2 WAT 8178 127.388 131.105 107.582 1.00 0.00 H TER 62393 WAT 8178 ATOM 62393 O WAT 8179 120.810 142.777 5.161 1.00 0.00 O ATOM 62394 H1 WAT 8179 121.591 142.728 4.609 1.00 0.00 H ATOM 62395 H2 WAT 8179 120.081 142.648 4.555 1.00 0.00 H TER 62397 WAT 8179 ATOM 62397 O WAT 8180 114.186 83.920 98.000 1.00 0.00 O ATOM 62398 H1 WAT 8180 114.150 84.681 98.579 1.00 0.00 H ATOM 62399 H2 WAT 8180 114.554 83.223 98.543 1.00 0.00 H TER 62401 WAT 8180 ATOM 62401 O WAT 8181 101.274 129.179 63.310 1.00 0.00 O ATOM 62402 H1 WAT 8181 101.403 128.823 62.431 1.00 0.00 H ATOM 62403 H2 WAT 8181 101.854 129.939 63.347 1.00 0.00 H TER 62405 WAT 8181 ATOM 62405 O WAT 8182 145.290 25.648 111.168 1.00 0.00 O ATOM 62406 H1 WAT 8182 145.310 24.735 110.884 1.00 0.00 H ATOM 62407 H2 WAT 8182 145.410 25.606 112.117 1.00 0.00 H TER 62409 WAT 8182 ATOM 62409 O WAT 8183 110.670 103.147 2.169 1.00 0.00 O ATOM 62410 H1 WAT 8183 110.471 102.235 1.960 1.00 0.00 H ATOM 62411 H2 WAT 8183 110.899 103.136 3.098 1.00 0.00 H TER 62413 WAT 8183 ATOM 62413 O WAT 8184 138.860 98.780 111.284 1.00 0.00 O ATOM 62414 H1 WAT 8184 138.298 98.817 112.058 1.00 0.00 H ATOM 62415 H2 WAT 8184 139.483 98.078 111.473 1.00 0.00 H TER 62417 WAT 8184 ATOM 62417 O WAT 8185 15.982 70.441 140.416 1.00 0.00 O ATOM 62418 H1 WAT 8185 15.428 69.703 140.669 1.00 0.00 H ATOM 62419 H2 WAT 8185 15.412 70.998 139.886 1.00 0.00 H TER 62421 WAT 8185 ATOM 62421 O WAT 8186 29.366 106.637 151.698 1.00 0.00 O ATOM 62422 H1 WAT 8186 29.245 105.935 151.060 1.00 0.00 H ATOM 62423 H2 WAT 8186 29.686 106.194 152.484 1.00 0.00 H TER 62425 WAT 8186 ATOM 62425 O WAT 8187 120.143 90.175 80.902 1.00 0.00 O ATOM 62426 H1 WAT 8187 119.634 89.771 81.605 1.00 0.00 H ATOM 62427 H2 WAT 8187 119.620 90.929 80.630 1.00 0.00 H TER 62429 WAT 8187 ATOM 62429 O WAT 8188 123.542 64.781 89.474 1.00 0.00 O ATOM 62430 H1 WAT 8188 124.164 65.503 89.564 1.00 0.00 H ATOM 62431 H2 WAT 8188 123.801 64.340 88.666 1.00 0.00 H TER 62433 WAT 8188 ATOM 62433 O WAT 8189 95.894 91.038 102.009 1.00 0.00 O ATOM 62434 H1 WAT 8189 95.957 91.313 101.095 1.00 0.00 H ATOM 62435 H2 WAT 8189 96.525 90.323 102.088 1.00 0.00 H TER 62437 WAT 8189 ATOM 62437 O WAT 8190 120.835 19.017 23.943 1.00 0.00 O ATOM 62438 H1 WAT 8190 120.533 18.473 23.216 1.00 0.00 H ATOM 62439 H2 WAT 8190 120.049 19.178 24.465 1.00 0.00 H TER 62441 WAT 8190 ATOM 62441 O WAT 8191 23.499 90.323 20.874 1.00 0.00 O ATOM 62442 H1 WAT 8191 24.158 89.899 20.324 1.00 0.00 H ATOM 62443 H2 WAT 8191 23.934 91.109 21.206 1.00 0.00 H TER 62445 WAT 8191 ATOM 62445 O WAT 8192 25.822 115.162 154.940 1.00 0.00 O ATOM 62446 H1 WAT 8192 25.266 114.842 154.229 1.00 0.00 H ATOM 62447 H2 WAT 8192 25.215 115.336 155.659 1.00 0.00 H TER 62449 WAT 8192 ATOM 62449 O WAT 8193 133.819 6.681 153.921 1.00 0.00 O ATOM 62450 H1 WAT 8193 132.929 7.003 154.058 1.00 0.00 H ATOM 62451 H2 WAT 8193 134.129 6.453 154.797 1.00 0.00 H TER 62453 WAT 8193 ATOM 62453 O WAT 8194 40.963 5.074 154.152 1.00 0.00 O ATOM 62454 H1 WAT 8194 40.280 5.740 154.081 1.00 0.00 H ATOM 62455 H2 WAT 8194 41.166 5.038 155.087 1.00 0.00 H TER 62457 WAT 8194 ATOM 62457 O WAT 8195 114.419 144.395 119.871 1.00 0.00 O ATOM 62458 H1 WAT 8195 115.266 144.825 119.991 1.00 0.00 H ATOM 62459 H2 WAT 8195 113.853 145.077 119.508 1.00 0.00 H TER 62461 WAT 8195 ATOM 62461 O WAT 8196 1.778 129.157 26.358 1.00 0.00 O ATOM 62462 H1 WAT 8196 1.958 129.799 27.044 1.00 0.00 H ATOM 62463 H2 WAT 8196 1.091 129.559 25.827 1.00 0.00 H TER 62465 WAT 8196 ATOM 62465 O WAT 8197 110.916 21.402 62.283 1.00 0.00 O ATOM 62466 H1 WAT 8197 110.995 21.724 61.385 1.00 0.00 H ATOM 62467 H2 WAT 8197 111.776 21.031 62.481 1.00 0.00 H TER 62469 WAT 8197 ATOM 62469 O WAT 8198 32.758 138.180 86.158 1.00 0.00 O ATOM 62470 H1 WAT 8198 32.398 138.726 86.857 1.00 0.00 H ATOM 62471 H2 WAT 8198 33.190 137.459 86.617 1.00 0.00 H TER 62473 WAT 8198 ATOM 62473 O WAT 8199 47.258 100.556 81.369 1.00 0.00 O ATOM 62474 H1 WAT 8199 48.000 100.593 81.973 1.00 0.00 H ATOM 62475 H2 WAT 8199 47.212 101.434 80.993 1.00 0.00 H TER 62477 WAT 8199 ATOM 62477 O WAT 8200 68.019 10.764 9.436 1.00 0.00 O ATOM 62478 H1 WAT 8200 68.543 10.221 10.025 1.00 0.00 H ATOM 62479 H2 WAT 8200 67.657 10.147 8.800 1.00 0.00 H TER 62481 WAT 8200 ATOM 62481 O WAT 8201 136.627 98.126 2.912 1.00 0.00 O ATOM 62482 H1 WAT 8201 137.576 98.090 3.038 1.00 0.00 H ATOM 62483 H2 WAT 8201 136.267 97.695 3.687 1.00 0.00 H TER 62485 WAT 8201 ATOM 62485 O WAT 8202 41.271 130.102 78.293 1.00 0.00 O ATOM 62486 H1 WAT 8202 40.878 129.229 78.290 1.00 0.00 H ATOM 62487 H2 WAT 8202 42.005 130.032 78.904 1.00 0.00 H TER 62489 WAT 8202 ATOM 62489 O WAT 8203 39.054 60.456 122.791 1.00 0.00 O ATOM 62490 H1 WAT 8203 38.518 59.702 122.545 1.00 0.00 H ATOM 62491 H2 WAT 8203 39.739 60.090 123.351 1.00 0.00 H TER 62493 WAT 8203 ATOM 62493 O WAT 8204 49.656 26.245 126.993 1.00 0.00 O ATOM 62494 H1 WAT 8204 49.167 27.053 127.151 1.00 0.00 H ATOM 62495 H2 WAT 8204 49.426 25.998 126.097 1.00 0.00 H TER 62497 WAT 8204 ATOM 62497 O WAT 8205 84.468 93.383 91.675 1.00 0.00 O ATOM 62498 H1 WAT 8205 84.306 92.944 92.511 1.00 0.00 H ATOM 62499 H2 WAT 8205 84.191 94.288 91.823 1.00 0.00 H TER 62501 WAT 8205 ATOM 62501 O WAT 8206 79.779 114.731 51.389 1.00 0.00 O ATOM 62502 H1 WAT 8206 79.480 115.523 51.836 1.00 0.00 H ATOM 62503 H2 WAT 8206 79.075 114.098 51.527 1.00 0.00 H TER 62505 WAT 8206 ATOM 62505 O WAT 8207 68.449 78.911 96.974 1.00 0.00 O ATOM 62506 H1 WAT 8207 68.962 78.130 96.767 1.00 0.00 H ATOM 62507 H2 WAT 8207 67.558 78.692 96.697 1.00 0.00 H TER 62509 WAT 8207 ATOM 62509 O WAT 8208 14.094 94.616 63.788 1.00 0.00 O ATOM 62510 H1 WAT 8208 14.216 94.139 62.967 1.00 0.00 H ATOM 62511 H2 WAT 8208 14.961 94.967 63.992 1.00 0.00 H TER 62513 WAT 8208 ATOM 62513 O WAT 8209 118.597 107.914 82.553 1.00 0.00 O ATOM 62514 H1 WAT 8209 118.594 108.866 82.653 1.00 0.00 H ATOM 62515 H2 WAT 8209 119.282 107.743 81.906 1.00 0.00 H TER 62517 WAT 8209 ATOM 62517 O WAT 8210 21.567 10.278 79.180 1.00 0.00 O ATOM 62518 H1 WAT 8210 21.214 9.405 79.008 1.00 0.00 H ATOM 62519 H2 WAT 8210 22.515 10.173 79.099 1.00 0.00 H TER 62521 WAT 8210 ATOM 62521 O WAT 8211 84.422 14.513 67.362 1.00 0.00 O ATOM 62522 H1 WAT 8211 85.354 14.619 67.172 1.00 0.00 H ATOM 62523 H2 WAT 8211 84.127 15.388 67.615 1.00 0.00 H TER 62525 WAT 8211 ATOM 62525 O WAT 8212 84.676 111.652 30.495 1.00 0.00 O ATOM 62526 H1 WAT 8212 84.303 112.484 30.205 1.00 0.00 H ATOM 62527 H2 WAT 8212 83.990 111.255 31.032 1.00 0.00 H TER 62529 WAT 8212 ATOM 62529 O WAT 8213 113.664 81.157 114.600 1.00 0.00 O ATOM 62530 H1 WAT 8213 113.820 82.048 114.287 1.00 0.00 H ATOM 62531 H2 WAT 8213 114.532 80.755 114.623 1.00 0.00 H TER 62533 WAT 8213 ATOM 62533 O WAT 8214 126.314 62.468 126.916 1.00 0.00 O ATOM 62534 H1 WAT 8214 126.526 62.317 125.994 1.00 0.00 H ATOM 62535 H2 WAT 8214 126.096 61.600 127.256 1.00 0.00 H TER 62537 WAT 8214 ATOM 62537 O WAT 8215 93.656 17.390 118.656 1.00 0.00 O ATOM 62538 H1 WAT 8215 93.727 17.001 119.528 1.00 0.00 H ATOM 62539 H2 WAT 8215 93.248 16.708 118.123 1.00 0.00 H TER 62541 WAT 8215 ATOM 62541 O WAT 8216 131.035 67.070 8.054 1.00 0.00 O ATOM 62542 H1 WAT 8216 130.873 66.129 8.118 1.00 0.00 H ATOM 62543 H2 WAT 8216 131.581 67.166 7.274 1.00 0.00 H TER 62545 WAT 8216 ATOM 62545 O WAT 8217 122.810 73.698 18.417 1.00 0.00 O ATOM 62546 H1 WAT 8217 122.084 73.080 18.329 1.00 0.00 H ATOM 62547 H2 WAT 8217 122.994 73.719 19.356 1.00 0.00 H TER 62549 WAT 8217 ATOM 62549 O WAT 8218 11.673 64.939 109.598 1.00 0.00 O ATOM 62550 H1 WAT 8218 12.281 64.410 109.083 1.00 0.00 H ATOM 62551 H2 WAT 8218 12.188 65.698 109.873 1.00 0.00 H TER 62553 WAT 8218 ATOM 62553 O WAT 8219 12.718 72.291 106.129 1.00 0.00 O ATOM 62554 H1 WAT 8219 13.459 71.716 105.936 1.00 0.00 H ATOM 62555 H2 WAT 8219 12.064 71.714 106.524 1.00 0.00 H TER 62557 WAT 8219 ATOM 62557 O WAT 8220 138.690 51.137 142.779 1.00 0.00 O ATOM 62558 H1 WAT 8220 139.434 50.540 142.699 1.00 0.00 H ATOM 62559 H2 WAT 8220 138.481 51.381 141.877 1.00 0.00 H TER 62561 WAT 8220 ATOM 62561 O WAT 8221 30.179 35.282 97.831 1.00 0.00 O ATOM 62562 H1 WAT 8221 30.057 34.963 98.726 1.00 0.00 H ATOM 62563 H2 WAT 8221 31.101 35.535 97.791 1.00 0.00 H TER 62565 WAT 8221 ATOM 62565 O WAT 8222 115.755 8.818 150.702 1.00 0.00 O ATOM 62566 H1 WAT 8222 115.672 9.759 150.551 1.00 0.00 H ATOM 62567 H2 WAT 8222 115.696 8.722 151.652 1.00 0.00 H TER 62569 WAT 8222 ATOM 62569 O WAT 8223 5.506 23.754 150.376 1.00 0.00 O ATOM 62570 H1 WAT 8223 4.796 24.376 150.217 1.00 0.00 H ATOM 62571 H2 WAT 8223 5.162 23.165 151.047 1.00 0.00 H TER 62573 WAT 8223 ATOM 62573 O WAT 8224 107.042 117.818 112.846 1.00 0.00 O ATOM 62574 H1 WAT 8224 106.814 118.489 112.202 1.00 0.00 H ATOM 62575 H2 WAT 8224 106.296 117.218 112.841 1.00 0.00 H TER 62577 WAT 8224 ATOM 62577 O WAT 8225 52.345 89.874 141.746 1.00 0.00 O ATOM 62578 H1 WAT 8225 53.240 89.571 141.591 1.00 0.00 H ATOM 62579 H2 WAT 8225 51.975 89.230 142.349 1.00 0.00 H TER 62581 WAT 8225 ATOM 62581 O WAT 8226 100.019 5.903 109.646 1.00 0.00 O ATOM 62582 H1 WAT 8226 99.488 5.515 108.950 1.00 0.00 H ATOM 62583 H2 WAT 8226 100.864 5.458 109.580 1.00 0.00 H TER 62585 WAT 8226 ATOM 62585 O WAT 8227 116.084 40.972 121.213 1.00 0.00 O ATOM 62586 H1 WAT 8227 116.223 41.234 120.303 1.00 0.00 H ATOM 62587 H2 WAT 8227 116.731 40.283 121.365 1.00 0.00 H TER 62589 WAT 8227 ATOM 62589 O WAT 8228 58.319 86.871 16.871 1.00 0.00 O ATOM 62590 H1 WAT 8228 58.364 87.147 17.786 1.00 0.00 H ATOM 62591 H2 WAT 8228 58.835 87.524 16.398 1.00 0.00 H TER 62593 WAT 8228 ATOM 62593 O WAT 8229 119.312 84.963 95.868 1.00 0.00 O ATOM 62594 H1 WAT 8229 120.186 85.104 96.231 1.00 0.00 H ATOM 62595 H2 WAT 8229 119.280 84.025 95.679 1.00 0.00 H TER 62597 WAT 8229 ATOM 62597 O WAT 8230 98.509 62.816 4.857 1.00 0.00 O ATOM 62598 H1 WAT 8230 99.234 63.139 5.391 1.00 0.00 H ATOM 62599 H2 WAT 8230 98.393 63.484 4.180 1.00 0.00 H TER 62601 WAT 8230 ATOM 62601 O WAT 8231 140.165 53.949 82.216 1.00 0.00 O ATOM 62602 H1 WAT 8231 139.902 53.093 82.554 1.00 0.00 H ATOM 62603 H2 WAT 8231 140.790 53.751 81.519 1.00 0.00 H TER 62605 WAT 8231 ATOM 62605 O WAT 8232 78.354 42.394 150.920 1.00 0.00 O ATOM 62606 H1 WAT 8232 78.998 42.112 151.570 1.00 0.00 H ATOM 62607 H2 WAT 8232 77.865 43.093 151.355 1.00 0.00 H TER 62609 WAT 8232 ATOM 62609 O WAT 8233 96.435 109.204 11.237 1.00 0.00 O ATOM 62610 H1 WAT 8233 96.741 108.383 11.622 1.00 0.00 H ATOM 62611 H2 WAT 8233 95.533 109.023 10.972 1.00 0.00 H TER 62613 WAT 8233 ATOM 62613 O WAT 8234 42.209 18.336 96.149 1.00 0.00 O ATOM 62614 H1 WAT 8234 42.361 18.888 96.917 1.00 0.00 H ATOM 62615 H2 WAT 8234 42.222 18.944 95.411 1.00 0.00 H TER 62617 WAT 8234 ATOM 62617 O WAT 8235 103.101 28.713 74.934 1.00 0.00 O ATOM 62618 H1 WAT 8235 103.206 28.342 74.057 1.00 0.00 H ATOM 62619 H2 WAT 8235 103.643 28.158 75.495 1.00 0.00 H TER 62621 WAT 8235 ATOM 62621 O WAT 8236 55.111 63.169 84.999 1.00 0.00 O ATOM 62622 H1 WAT 8236 55.927 62.975 85.459 1.00 0.00 H ATOM 62623 H2 WAT 8236 55.358 63.810 84.332 1.00 0.00 H TER 62625 WAT 8236 ATOM 62625 O WAT 8237 44.850 35.073 113.410 1.00 0.00 O ATOM 62626 H1 WAT 8237 45.549 34.479 113.138 1.00 0.00 H ATOM 62627 H2 WAT 8237 44.062 34.721 112.996 1.00 0.00 H TER 62629 WAT 8237 ATOM 62629 O WAT 8238 94.774 141.176 153.467 1.00 0.00 O ATOM 62630 H1 WAT 8238 95.450 141.678 153.012 1.00 0.00 H ATOM 62631 H2 WAT 8238 95.241 140.729 154.173 1.00 0.00 H TER 62633 WAT 8238 ATOM 62633 O WAT 8239 96.827 19.595 147.340 1.00 0.00 O ATOM 62634 H1 WAT 8239 96.735 18.667 147.557 1.00 0.00 H ATOM 62635 H2 WAT 8239 97.554 19.624 146.718 1.00 0.00 H TER 62637 WAT 8239 ATOM 62637 O WAT 8240 95.179 25.565 157.811 1.00 0.00 O ATOM 62638 H1 WAT 8240 96.111 25.772 157.748 1.00 0.00 H ATOM 62639 H2 WAT 8240 95.146 24.768 158.340 1.00 0.00 H TER 62641 WAT 8240 ATOM 62641 O WAT 8241 97.812 10.069 99.108 1.00 0.00 O ATOM 62642 H1 WAT 8241 97.943 9.554 98.312 1.00 0.00 H ATOM 62643 H2 WAT 8241 96.918 10.404 99.032 1.00 0.00 H TER 62645 WAT 8241 ATOM 62645 O WAT 8242 9.526 66.791 156.664 1.00 0.00 O ATOM 62646 H1 WAT 8242 9.070 66.213 156.051 1.00 0.00 H ATOM 62647 H2 WAT 8242 9.988 67.415 156.105 1.00 0.00 H TER 62649 WAT 8242 ATOM 62649 O WAT 8243 119.698 56.078 111.015 1.00 0.00 O ATOM 62650 H1 WAT 8243 118.902 56.306 110.534 1.00 0.00 H ATOM 62651 H2 WAT 8243 119.698 56.666 111.771 1.00 0.00 H TER 62653 WAT 8243 ATOM 62653 O WAT 8244 121.243 35.149 13.357 1.00 0.00 O ATOM 62654 H1 WAT 8244 121.468 35.904 13.901 1.00 0.00 H ATOM 62655 H2 WAT 8244 122.079 34.855 12.996 1.00 0.00 H TER 62657 WAT 8244 ATOM 62657 O WAT 8245 86.043 35.785 156.719 1.00 0.00 O ATOM 62658 H1 WAT 8245 85.422 36.313 157.220 1.00 0.00 H ATOM 62659 H2 WAT 8245 85.498 35.145 156.261 1.00 0.00 H TER 62661 WAT 8245 ATOM 62661 O WAT 8246 116.212 50.033 3.343 1.00 0.00 O ATOM 62662 H1 WAT 8246 116.918 49.991 3.988 1.00 0.00 H ATOM 62663 H2 WAT 8246 116.653 49.947 2.498 1.00 0.00 H TER 62665 WAT 8246 ATOM 62665 O WAT 8247 99.535 54.070 87.049 1.00 0.00 O ATOM 62666 H1 WAT 8247 99.732 53.245 87.493 1.00 0.00 H ATOM 62667 H2 WAT 8247 100.383 54.504 86.961 1.00 0.00 H TER 62669 WAT 8247 ATOM 62669 O WAT 8248 78.006 54.297 128.370 1.00 0.00 O ATOM 62670 H1 WAT 8248 78.712 53.755 128.722 1.00 0.00 H ATOM 62671 H2 WAT 8248 77.611 53.760 127.683 1.00 0.00 H TER 62673 WAT 8248 ATOM 62673 O WAT 8249 68.685 101.781 13.094 1.00 0.00 O ATOM 62674 H1 WAT 8249 67.797 102.119 13.210 1.00 0.00 H ATOM 62675 H2 WAT 8249 69.168 102.507 12.700 1.00 0.00 H TER 62677 WAT 8249 ATOM 62677 O WAT 8250 137.848 46.779 60.872 1.00 0.00 O ATOM 62678 H1 WAT 8250 137.328 46.479 61.618 1.00 0.00 H ATOM 62679 H2 WAT 8250 137.586 47.692 60.750 1.00 0.00 H TER 62681 WAT 8250 ATOM 62681 O WAT 8251 63.748 2.571 61.714 1.00 0.00 O ATOM 62682 H1 WAT 8251 64.657 2.316 61.550 1.00 0.00 H ATOM 62683 H2 WAT 8251 63.760 3.528 61.693 1.00 0.00 H TER 62685 WAT 8251 ATOM 62685 O WAT 8252 116.351 136.383 90.943 1.00 0.00 O ATOM 62686 H1 WAT 8252 116.272 137.335 91.006 1.00 0.00 H ATOM 62687 H2 WAT 8252 117.229 136.193 91.271 1.00 0.00 H TER 62689 WAT 8252 ATOM 62689 O WAT 8253 20.699 21.154 71.002 1.00 0.00 O ATOM 62690 H1 WAT 8253 20.334 21.214 70.120 1.00 0.00 H ATOM 62691 H2 WAT 8253 20.599 22.034 71.363 1.00 0.00 H TER 62693 WAT 8253 ATOM 62693 O WAT 8254 0.394 34.154 4.840 1.00 0.00 O ATOM 62694 H1 WAT 8254 0.887 34.128 5.660 1.00 0.00 H ATOM 62695 H2 WAT 8254 0.480 33.271 4.481 1.00 0.00 H TER 62697 WAT 8254 ATOM 62697 O WAT 8255 126.800 128.756 150.774 1.00 0.00 O ATOM 62698 H1 WAT 8255 126.055 129.346 150.892 1.00 0.00 H ATOM 62699 H2 WAT 8255 126.507 127.924 151.147 1.00 0.00 H TER 62701 WAT 8255 ATOM 62701 O WAT 8256 34.068 48.822 7.511 1.00 0.00 O ATOM 62702 H1 WAT 8256 33.250 48.698 7.029 1.00 0.00 H ATOM 62703 H2 WAT 8256 34.247 49.760 7.442 1.00 0.00 H TER 62705 WAT 8256 ATOM 62705 O WAT 8257 102.063 54.620 89.382 1.00 0.00 O ATOM 62706 H1 WAT 8257 101.866 53.974 90.060 1.00 0.00 H ATOM 62707 H2 WAT 8257 101.632 55.421 89.682 1.00 0.00 H TER 62709 WAT 8257 ATOM 62709 O WAT 8258 94.777 60.237 92.275 1.00 0.00 O ATOM 62710 H1 WAT 8258 94.722 59.443 91.743 1.00 0.00 H ATOM 62711 H2 WAT 8258 94.401 60.922 91.722 1.00 0.00 H TER 62713 WAT 8258 ATOM 62713 O WAT 8259 97.929 133.885 13.437 1.00 0.00 O ATOM 62714 H1 WAT 8259 98.124 134.273 12.585 1.00 0.00 H ATOM 62715 H2 WAT 8259 98.430 133.069 13.450 1.00 0.00 H TER 62717 WAT 8259 ATOM 62717 O WAT 8260 135.026 91.229 150.714 1.00 0.00 O ATOM 62718 H1 WAT 8260 135.612 91.708 151.301 1.00 0.00 H ATOM 62719 H2 WAT 8260 135.322 91.466 149.835 1.00 0.00 H TER 62721 WAT 8260 ATOM 62721 O WAT 8261 71.980 35.733 10.138 1.00 0.00 O ATOM 62722 H1 WAT 8261 72.683 36.375 10.239 1.00 0.00 H ATOM 62723 H2 WAT 8261 71.545 35.718 10.991 1.00 0.00 H TER 62725 WAT 8261 ATOM 62725 O WAT 8262 142.021 40.873 109.141 1.00 0.00 O ATOM 62726 H1 WAT 8262 141.754 39.988 108.895 1.00 0.00 H ATOM 62727 H2 WAT 8262 142.653 40.745 109.848 1.00 0.00 H TER 62729 WAT 8262 ATOM 62729 O WAT 8263 62.947 57.895 92.152 1.00 0.00 O ATOM 62730 H1 WAT 8263 63.552 57.216 92.451 1.00 0.00 H ATOM 62731 H2 WAT 8263 63.100 57.953 91.209 1.00 0.00 H TER 62733 WAT 8263 ATOM 62733 O WAT 8264 133.651 112.308 15.658 1.00 0.00 O ATOM 62734 H1 WAT 8264 133.523 111.832 16.479 1.00 0.00 H ATOM 62735 H2 WAT 8264 134.546 112.095 15.395 1.00 0.00 H TER 62737 WAT 8264 ATOM 62737 O WAT 8265 27.868 128.067 140.561 1.00 0.00 O ATOM 62738 H1 WAT 8265 27.191 127.818 141.191 1.00 0.00 H ATOM 62739 H2 WAT 8265 28.288 128.834 140.951 1.00 0.00 H TER 62741 WAT 8265 ATOM 62741 O WAT 8266 24.893 46.467 27.340 1.00 0.00 O ATOM 62742 H1 WAT 8266 23.950 46.367 27.210 1.00 0.00 H ATOM 62743 H2 WAT 8266 25.181 47.006 26.604 1.00 0.00 H TER 62745 WAT 8266 ATOM 62745 O WAT 8267 40.428 123.870 153.522 1.00 0.00 O ATOM 62746 H1 WAT 8267 41.256 123.489 153.229 1.00 0.00 H ATOM 62747 H2 WAT 8267 40.663 124.743 153.836 1.00 0.00 H TER 62749 WAT 8267 ATOM 62749 O WAT 8268 80.384 38.539 104.591 1.00 0.00 O ATOM 62750 H1 WAT 8268 79.516 38.278 104.896 1.00 0.00 H ATOM 62751 H2 WAT 8268 80.980 38.235 105.275 1.00 0.00 H TER 62753 WAT 8268 ATOM 62753 O WAT 8269 34.284 104.418 63.707 1.00 0.00 O ATOM 62754 H1 WAT 8269 33.396 104.395 63.351 1.00 0.00 H ATOM 62755 H2 WAT 8269 34.336 105.256 64.167 1.00 0.00 H TER 62757 WAT 8269 ATOM 62757 O WAT 8270 85.500 95.518 16.483 1.00 0.00 O ATOM 62758 H1 WAT 8270 86.379 95.836 16.279 1.00 0.00 H ATOM 62759 H2 WAT 8270 84.970 95.782 15.731 1.00 0.00 H TER 62761 WAT 8270 ATOM 62761 O WAT 8271 53.571 115.528 155.496 1.00 0.00 O ATOM 62762 H1 WAT 8271 54.229 114.833 155.470 1.00 0.00 H ATOM 62763 H2 WAT 8271 53.988 116.268 155.056 1.00 0.00 H TER 62765 WAT 8271 ATOM 62765 O WAT 8272 67.941 109.757 76.096 1.00 0.00 O ATOM 62766 H1 WAT 8272 68.843 109.522 75.879 1.00 0.00 H ATOM 62767 H2 WAT 8272 67.406 109.125 75.616 1.00 0.00 H TER 62769 WAT 8272 ATOM 62769 O WAT 8273 110.184 35.907 24.469 1.00 0.00 O ATOM 62770 H1 WAT 8273 109.269 35.689 24.294 1.00 0.00 H ATOM 62771 H2 WAT 8273 110.325 36.737 24.013 1.00 0.00 H TER 62773 WAT 8273 ATOM 62773 O WAT 8274 15.491 64.683 57.003 1.00 0.00 O ATOM 62774 H1 WAT 8274 15.643 64.847 56.073 1.00 0.00 H ATOM 62775 H2 WAT 8274 15.170 65.518 57.344 1.00 0.00 H TER 62777 WAT 8274 ATOM 62777 O WAT 8275 69.816 16.625 101.543 1.00 0.00 O ATOM 62778 H1 WAT 8275 70.104 16.745 100.638 1.00 0.00 H ATOM 62779 H2 WAT 8275 68.989 17.105 101.596 1.00 0.00 H TER 62781 WAT 8275 ATOM 62781 O WAT 8276 125.983 135.318 105.716 1.00 0.00 O ATOM 62782 H1 WAT 8276 126.312 134.559 105.235 1.00 0.00 H ATOM 62783 H2 WAT 8276 125.036 135.185 105.754 1.00 0.00 H TER 62785 WAT 8276 ATOM 62785 O WAT 8277 50.379 54.416 139.445 1.00 0.00 O ATOM 62786 H1 WAT 8277 50.439 55.360 139.295 1.00 0.00 H ATOM 62787 H2 WAT 8277 50.887 54.027 138.733 1.00 0.00 H TER 62789 WAT 8277 ATOM 62789 O WAT 8278 112.064 144.835 131.376 1.00 0.00 O ATOM 62790 H1 WAT 8278 112.134 143.900 131.570 1.00 0.00 H ATOM 62791 H2 WAT 8278 112.545 144.946 130.555 1.00 0.00 H TER 62793 WAT 8278 ATOM 62793 O WAT 8279 31.160 47.727 2.373 1.00 0.00 O ATOM 62794 H1 WAT 8279 31.001 47.163 3.130 1.00 0.00 H ATOM 62795 H2 WAT 8279 32.001 47.431 2.026 1.00 0.00 H TER 62797 WAT 8279 ATOM 62797 O WAT 8280 93.109 126.911 7.371 1.00 0.00 O ATOM 62798 H1 WAT 8280 93.500 126.743 6.513 1.00 0.00 H ATOM 62799 H2 WAT 8280 93.827 127.264 7.896 1.00 0.00 H TER 62801 WAT 8280 ATOM 62801 O WAT 8281 80.615 128.602 133.210 1.00 0.00 O ATOM 62802 H1 WAT 8281 81.365 128.235 132.742 1.00 0.00 H ATOM 62803 H2 WAT 8281 79.903 128.588 132.570 1.00 0.00 H TER 62805 WAT 8281 ATOM 62805 O WAT 8282 26.030 112.977 113.780 1.00 0.00 O ATOM 62806 H1 WAT 8282 26.214 113.688 113.166 1.00 0.00 H ATOM 62807 H2 WAT 8282 25.113 112.755 113.622 1.00 0.00 H TER 62809 WAT 8282 ATOM 62809 O WAT 8283 144.699 108.463 88.097 1.00 0.00 O ATOM 62810 H1 WAT 8283 145.376 108.645 88.749 1.00 0.00 H ATOM 62811 H2 WAT 8283 145.157 107.991 87.402 1.00 0.00 H TER 62813 WAT 8283 ATOM 62813 O WAT 8284 38.227 57.760 127.020 1.00 0.00 O ATOM 62814 H1 WAT 8284 37.450 57.274 127.297 1.00 0.00 H ATOM 62815 H2 WAT 8284 37.978 58.680 127.106 1.00 0.00 H TER 62817 WAT 8284 ATOM 62817 O WAT 8285 83.130 114.281 61.788 1.00 0.00 O ATOM 62818 H1 WAT 8285 83.590 113.763 61.127 1.00 0.00 H ATOM 62819 H2 WAT 8285 83.657 115.075 61.879 1.00 0.00 H TER 62821 WAT 8285 ATOM 62821 O WAT 8286 133.736 97.771 8.116 1.00 0.00 O ATOM 62822 H1 WAT 8286 133.239 97.004 7.830 1.00 0.00 H ATOM 62823 H2 WAT 8286 133.069 98.403 8.384 1.00 0.00 H TER 62825 WAT 8286 ATOM 62825 O WAT 8287 121.702 19.159 96.872 1.00 0.00 O ATOM 62826 H1 WAT 8287 122.272 18.967 96.127 1.00 0.00 H ATOM 62827 H2 WAT 8287 121.085 18.427 96.896 1.00 0.00 H TER 62829 WAT 8287 ATOM 62829 O WAT 8288 121.239 135.772 62.961 1.00 0.00 O ATOM 62830 H1 WAT 8288 121.150 135.744 63.914 1.00 0.00 H ATOM 62831 H2 WAT 8288 120.616 136.442 62.681 1.00 0.00 H TER 62833 WAT 8288 ATOM 62833 O WAT 8289 40.659 0.632 115.677 1.00 0.00 O ATOM 62834 H1 WAT 8289 41.148 1.111 116.346 1.00 0.00 H ATOM 62835 H2 WAT 8289 39.744 0.860 115.839 1.00 0.00 H TER 62837 WAT 8289 ATOM 62837 O WAT 8290 131.182 62.192 136.958 1.00 0.00 O ATOM 62838 H1 WAT 8290 131.749 61.517 137.331 1.00 0.00 H ATOM 62839 H2 WAT 8290 131.162 61.997 136.021 1.00 0.00 H TER 62841 WAT 8290 ATOM 62841 O WAT 8291 30.499 70.921 17.725 1.00 0.00 O ATOM 62842 H1 WAT 8291 30.291 71.032 18.653 1.00 0.00 H ATOM 62843 H2 WAT 8291 31.238 71.509 17.572 1.00 0.00 H TER 62845 WAT 8291 ATOM 62845 O WAT 8292 118.033 2.553 135.515 1.00 0.00 O ATOM 62846 H1 WAT 8292 118.468 2.254 134.716 1.00 0.00 H ATOM 62847 H2 WAT 8292 118.249 1.887 136.168 1.00 0.00 H TER 62849 WAT 8292 ATOM 62849 O WAT 8293 42.426 64.096 145.240 1.00 0.00 O ATOM 62850 H1 WAT 8293 41.730 64.659 145.580 1.00 0.00 H ATOM 62851 H2 WAT 8293 42.058 63.213 145.274 1.00 0.00 H TER 62853 WAT 8293 ATOM 62853 O WAT 8294 35.729 34.041 89.425 1.00 0.00 O ATOM 62854 H1 WAT 8294 35.448 34.787 88.896 1.00 0.00 H ATOM 62855 H2 WAT 8294 34.915 33.664 89.759 1.00 0.00 H TER 62857 WAT 8294 ATOM 62857 O WAT 8295 143.332 77.150 25.172 1.00 0.00 O ATOM 62858 H1 WAT 8295 142.815 77.920 24.932 1.00 0.00 H ATOM 62859 H2 WAT 8295 144.234 77.469 25.207 1.00 0.00 H TER 62861 WAT 8295 ATOM 62861 O WAT 8296 141.423 25.305 21.138 1.00 0.00 O ATOM 62862 H1 WAT 8296 141.066 25.719 21.923 1.00 0.00 H ATOM 62863 H2 WAT 8296 142.372 25.366 21.246 1.00 0.00 H TER 62865 WAT 8296 ATOM 62865 O WAT 8297 91.810 57.264 108.334 1.00 0.00 O ATOM 62866 H1 WAT 8297 91.219 56.560 108.601 1.00 0.00 H ATOM 62867 H2 WAT 8297 91.376 58.065 108.628 1.00 0.00 H TER 62869 WAT 8297 ATOM 62869 O WAT 8298 63.124 115.667 78.773 1.00 0.00 O ATOM 62870 H1 WAT 8298 63.040 115.342 77.877 1.00 0.00 H ATOM 62871 H2 WAT 8298 63.877 115.196 79.129 1.00 0.00 H TER 62873 WAT 8298 ATOM 62873 O WAT 8299 1.948 103.942 80.176 1.00 0.00 O ATOM 62874 H1 WAT 8299 1.460 104.385 79.482 1.00 0.00 H ATOM 62875 H2 WAT 8299 1.318 103.335 80.563 1.00 0.00 H TER 62877 WAT 8299 ATOM 62877 O WAT 8300 112.971 64.760 61.734 1.00 0.00 O ATOM 62878 H1 WAT 8300 112.435 64.030 61.425 1.00 0.00 H ATOM 62879 H2 WAT 8300 113.841 64.382 61.862 1.00 0.00 H TER 62881 WAT 8300 ATOM 62881 O WAT 8301 119.504 131.173 157.887 1.00 0.00 O ATOM 62882 H1 WAT 8301 119.544 130.286 157.531 1.00 0.00 H ATOM 62883 H2 WAT 8301 120.239 131.629 157.478 1.00 0.00 H TER 62885 WAT 8301 ATOM 62885 O WAT 8302 90.687 25.724 110.391 1.00 0.00 O ATOM 62886 H1 WAT 8302 91.525 26.063 110.078 1.00 0.00 H ATOM 62887 H2 WAT 8302 90.059 26.419 110.194 1.00 0.00 H TER 62889 WAT 8302 ATOM 62889 O WAT 8303 18.776 27.250 120.749 1.00 0.00 O ATOM 62890 H1 WAT 8303 18.877 26.851 121.613 1.00 0.00 H ATOM 62891 H2 WAT 8303 19.156 26.612 120.144 1.00 0.00 H TER 62893 WAT 8303 ATOM 62893 O WAT 8304 138.808 114.530 68.814 1.00 0.00 O ATOM 62894 H1 WAT 8304 138.750 113.782 68.220 1.00 0.00 H ATOM 62895 H2 WAT 8304 138.004 114.489 69.331 1.00 0.00 H TER 62897 WAT 8304 ATOM 62897 O WAT 8305 26.312 18.643 134.318 1.00 0.00 O ATOM 62898 H1 WAT 8305 27.257 18.793 134.288 1.00 0.00 H ATOM 62899 H2 WAT 8305 26.220 17.759 134.674 1.00 0.00 H TER 62901 WAT 8305 ATOM 62901 O WAT 8306 92.137 124.140 99.546 1.00 0.00 O ATOM 62902 H1 WAT 8306 91.488 123.850 100.187 1.00 0.00 H ATOM 62903 H2 WAT 8306 91.704 124.848 99.069 1.00 0.00 H TER 62905 WAT 8306 ATOM 62905 O WAT 8307 24.252 60.517 104.632 1.00 0.00 O ATOM 62906 H1 WAT 8307 23.578 60.425 103.959 1.00 0.00 H ATOM 62907 H2 WAT 8307 24.444 61.454 104.653 1.00 0.00 H TER 62909 WAT 8307 ATOM 62909 O WAT 8308 139.372 39.946 93.365 1.00 0.00 O ATOM 62910 H1 WAT 8308 139.595 40.259 94.242 1.00 0.00 H ATOM 62911 H2 WAT 8308 138.778 40.611 93.017 1.00 0.00 H TER 62913 WAT 8308 ATOM 62913 O WAT 8309 117.083 18.904 15.400 1.00 0.00 O ATOM 62914 H1 WAT 8309 117.004 19.309 16.263 1.00 0.00 H ATOM 62915 H2 WAT 8309 117.977 18.561 15.377 1.00 0.00 H TER 62917 WAT 8309 ATOM 62917 O WAT 8310 37.960 91.706 2.458 1.00 0.00 O ATOM 62918 H1 WAT 8310 38.917 91.685 2.482 1.00 0.00 H ATOM 62919 H2 WAT 8310 37.699 90.787 2.523 1.00 0.00 H TER 62921 WAT 8310 ATOM 62921 O WAT 8311 96.718 18.638 106.697 1.00 0.00 O ATOM 62922 H1 WAT 8311 97.239 18.116 106.087 1.00 0.00 H ATOM 62923 H2 WAT 8311 95.859 18.707 106.280 1.00 0.00 H TER 62925 WAT 8311 ATOM 62925 O WAT 8312 70.220 133.343 96.522 1.00 0.00 O ATOM 62926 H1 WAT 8312 69.341 133.362 96.900 1.00 0.00 H ATOM 62927 H2 WAT 8312 70.623 134.161 96.813 1.00 0.00 H TER 62929 WAT 8312 ATOM 62929 O WAT 8313 85.210 110.337 25.774 1.00 0.00 O ATOM 62930 H1 WAT 8313 85.314 110.306 26.725 1.00 0.00 H ATOM 62931 H2 WAT 8313 84.628 109.604 25.574 1.00 0.00 H TER 62933 WAT 8313 ATOM 62933 O WAT 8314 71.212 40.998 78.847 1.00 0.00 O ATOM 62934 H1 WAT 8314 71.243 41.950 78.943 1.00 0.00 H ATOM 62935 H2 WAT 8314 70.619 40.850 78.111 1.00 0.00 H TER 62937 WAT 8314 ATOM 62937 O WAT 8315 83.501 106.225 102.576 1.00 0.00 O ATOM 62938 H1 WAT 8315 83.921 106.183 103.436 1.00 0.00 H ATOM 62939 H2 WAT 8315 82.755 105.629 102.645 1.00 0.00 H TER 62941 WAT 8315 ATOM 62941 O WAT 8316 36.009 130.467 61.350 1.00 0.00 O ATOM 62942 H1 WAT 8316 36.858 130.702 60.977 1.00 0.00 H ATOM 62943 H2 WAT 8316 35.772 129.650 60.912 1.00 0.00 H TER 62945 WAT 8316 ATOM 62945 O WAT 8317 31.692 117.570 26.636 1.00 0.00 O ATOM 62946 H1 WAT 8317 31.769 118.481 26.353 1.00 0.00 H ATOM 62947 H2 WAT 8317 30.925 117.238 26.168 1.00 0.00 H TER 62949 WAT 8317 ATOM 62949 O WAT 8318 103.616 60.460 100.717 1.00 0.00 O ATOM 62950 H1 WAT 8318 103.819 61.380 100.546 1.00 0.00 H ATOM 62951 H2 WAT 8318 103.321 60.119 99.873 1.00 0.00 H TER 62953 WAT 8318 ATOM 62953 O WAT 8319 79.399 12.196 84.660 1.00 0.00 O ATOM 62954 H1 WAT 8319 80.028 12.840 84.986 1.00 0.00 H ATOM 62955 H2 WAT 8319 78.670 12.239 85.278 1.00 0.00 H TER 62957 WAT 8319 ATOM 62957 O WAT 8320 118.400 10.501 59.238 1.00 0.00 O ATOM 62958 H1 WAT 8320 118.388 9.934 58.467 1.00 0.00 H ATOM 62959 H2 WAT 8320 117.476 10.624 59.458 1.00 0.00 H TER 62961 WAT 8320 ATOM 62961 O WAT 8321 66.527 123.521 5.781 1.00 0.00 O ATOM 62962 H1 WAT 8321 66.939 122.701 5.509 1.00 0.00 H ATOM 62963 H2 WAT 8321 67.066 123.831 6.508 1.00 0.00 H TER 62965 WAT 8321 ATOM 62965 O WAT 8322 72.526 105.768 62.385 1.00 0.00 O ATOM 62966 H1 WAT 8322 72.256 106.594 61.983 1.00 0.00 H ATOM 62967 H2 WAT 8322 73.287 105.491 61.876 1.00 0.00 H TER 62969 WAT 8322 ATOM 62969 O WAT 8323 12.098 97.160 134.717 1.00 0.00 O ATOM 62970 H1 WAT 8323 13.038 97.295 134.598 1.00 0.00 H ATOM 62971 H2 WAT 8323 11.969 97.198 135.665 1.00 0.00 H TER 62973 WAT 8323 ATOM 62973 O WAT 8324 99.857 44.005 15.567 1.00 0.00 O ATOM 62974 H1 WAT 8324 98.949 43.745 15.721 1.00 0.00 H ATOM 62975 H2 WAT 8324 99.830 44.961 15.528 1.00 0.00 H TER 62977 WAT 8324 ATOM 62977 O WAT 8325 52.015 69.330 111.223 1.00 0.00 O ATOM 62978 H1 WAT 8325 52.424 70.044 110.734 1.00 0.00 H ATOM 62979 H2 WAT 8325 51.980 68.603 110.601 1.00 0.00 H TER 62981 WAT 8325 ATOM 62981 O WAT 8326 41.685 50.874 157.705 1.00 0.00 O ATOM 62982 H1 WAT 8326 41.999 50.599 156.844 1.00 0.00 H ATOM 62983 H2 WAT 8326 42.477 50.952 158.236 1.00 0.00 H TER 62985 WAT 8326 ATOM 62985 O WAT 8327 33.963 119.397 10.433 1.00 0.00 O ATOM 62986 H1 WAT 8327 34.094 118.669 9.826 1.00 0.00 H ATOM 62987 H2 WAT 8327 33.133 119.789 10.162 1.00 0.00 H TER 62989 WAT 8327 ATOM 62989 O WAT 8328 121.643 45.146 95.843 1.00 0.00 O ATOM 62990 H1 WAT 8328 121.122 44.427 95.483 1.00 0.00 H ATOM 62991 H2 WAT 8328 121.881 44.852 96.722 1.00 0.00 H TER 62993 WAT 8328 ATOM 62993 O WAT 8329 30.192 132.389 67.921 1.00 0.00 O ATOM 62994 H1 WAT 8329 29.877 132.953 68.627 1.00 0.00 H ATOM 62995 H2 WAT 8329 31.144 132.391 68.020 1.00 0.00 H TER 62997 WAT 8329 ATOM 62997 O WAT 8330 42.153 66.463 97.248 1.00 0.00 O ATOM 62998 H1 WAT 8330 42.129 67.389 97.488 1.00 0.00 H ATOM 62999 H2 WAT 8330 43.082 66.234 97.267 1.00 0.00 H TER 63001 WAT 8330 ATOM 63001 O WAT 8331 29.898 39.116 150.458 1.00 0.00 O ATOM 63002 H1 WAT 8331 29.671 39.774 151.115 1.00 0.00 H ATOM 63003 H2 WAT 8331 30.197 39.624 149.704 1.00 0.00 H TER 63005 WAT 8331 ATOM 63005 O WAT 8332 108.242 15.519 114.024 1.00 0.00 O ATOM 63006 H1 WAT 8332 107.427 15.018 114.048 1.00 0.00 H ATOM 63007 H2 WAT 8332 108.352 15.753 113.102 1.00 0.00 H TER 63009 WAT 8332 ATOM 63009 O WAT 8333 76.979 56.483 102.194 1.00 0.00 O ATOM 63010 H1 WAT 8333 76.703 55.820 101.560 1.00 0.00 H ATOM 63011 H2 WAT 8333 77.067 57.285 101.678 1.00 0.00 H TER 63013 WAT 8333 ATOM 63013 O WAT 8334 64.250 127.969 55.188 1.00 0.00 O ATOM 63014 H1 WAT 8334 63.520 127.604 55.689 1.00 0.00 H ATOM 63015 H2 WAT 8334 63.886 128.749 54.769 1.00 0.00 H TER 63017 WAT 8334 ATOM 63017 O WAT 8335 125.277 129.039 118.770 1.00 0.00 O ATOM 63018 H1 WAT 8335 125.793 129.590 118.181 1.00 0.00 H ATOM 63019 H2 WAT 8335 124.420 128.974 118.347 1.00 0.00 H TER 63021 WAT 8335 ATOM 63021 O WAT 8336 14.774 32.712 112.102 1.00 0.00 O ATOM 63022 H1 WAT 8336 15.615 32.588 111.662 1.00 0.00 H ATOM 63023 H2 WAT 8336 14.661 33.662 112.139 1.00 0.00 H TER 63025 WAT 8336 ATOM 63025 O WAT 8337 53.559 128.806 156.767 1.00 0.00 O ATOM 63026 H1 WAT 8337 53.411 129.750 156.819 1.00 0.00 H ATOM 63027 H2 WAT 8337 53.209 128.463 157.589 1.00 0.00 H TER 63029 WAT 8337 ATOM 63029 O WAT 8338 39.872 76.729 103.455 1.00 0.00 O ATOM 63030 H1 WAT 8338 39.061 76.499 103.910 1.00 0.00 H ATOM 63031 H2 WAT 8338 39.969 77.670 103.601 1.00 0.00 H TER 63033 WAT 8338 ATOM 63033 O WAT 8339 32.606 71.088 115.591 1.00 0.00 O ATOM 63034 H1 WAT 8339 32.697 70.453 114.881 1.00 0.00 H ATOM 63035 H2 WAT 8339 32.947 70.635 116.362 1.00 0.00 H TER 63037 WAT 8339 ATOM 63037 O WAT 8340 71.428 27.356 9.196 1.00 0.00 O ATOM 63038 H1 WAT 8340 71.871 28.203 9.134 1.00 0.00 H ATOM 63039 H2 WAT 8340 70.605 27.549 9.645 1.00 0.00 H TER 63041 WAT 8340 ATOM 63041 O WAT 8341 104.260 96.564 20.404 1.00 0.00 O ATOM 63042 H1 WAT 8341 103.946 96.020 21.126 1.00 0.00 H ATOM 63043 H2 WAT 8341 104.721 97.285 20.830 1.00 0.00 H TER 63045 WAT 8341 ATOM 63045 O WAT 8342 43.858 97.833 156.517 1.00 0.00 O ATOM 63046 H1 WAT 8342 43.567 98.722 156.314 1.00 0.00 H ATOM 63047 H2 WAT 8342 44.778 97.932 156.763 1.00 0.00 H TER 63049 WAT 8342 ATOM 63049 O WAT 8343 19.601 100.173 77.405 1.00 0.00 O ATOM 63050 H1 WAT 8343 20.328 100.706 77.084 1.00 0.00 H ATOM 63051 H2 WAT 8343 18.828 100.724 77.284 1.00 0.00 H TER 63053 WAT 8343 ATOM 63053 O WAT 8344 77.090 12.272 74.378 1.00 0.00 O ATOM 63054 H1 WAT 8344 77.082 12.130 75.324 1.00 0.00 H ATOM 63055 H2 WAT 8344 76.985 11.398 74.003 1.00 0.00 H TER 63057 WAT 8344 ATOM 63057 O WAT 8345 105.579 64.188 90.335 1.00 0.00 O ATOM 63058 H1 WAT 8345 105.295 65.051 90.636 1.00 0.00 H ATOM 63059 H2 WAT 8345 106.367 64.004 90.846 1.00 0.00 H TER 63061 WAT 8345 ATOM 63061 O WAT 8346 91.671 37.280 143.953 1.00 0.00 O ATOM 63062 H1 WAT 8346 91.208 37.381 143.121 1.00 0.00 H ATOM 63063 H2 WAT 8346 91.500 36.375 144.214 1.00 0.00 H TER 63065 WAT 8346 ATOM 63065 O WAT 8347 105.251 112.025 106.957 1.00 0.00 O ATOM 63066 H1 WAT 8347 104.350 112.348 106.949 1.00 0.00 H ATOM 63067 H2 WAT 8347 105.275 111.362 106.268 1.00 0.00 H TER 63069 WAT 8347 ATOM 63069 O WAT 8348 118.377 115.999 118.013 1.00 0.00 O ATOM 63070 H1 WAT 8348 119.068 116.345 117.448 1.00 0.00 H ATOM 63071 H2 WAT 8348 118.567 116.368 118.876 1.00 0.00 H TER 63073 WAT 8348 ATOM 63073 O WAT 8349 39.937 83.947 85.786 1.00 0.00 O ATOM 63074 H1 WAT 8349 40.367 84.758 86.057 1.00 0.00 H ATOM 63075 H2 WAT 8349 40.552 83.256 86.033 1.00 0.00 H TER 63077 WAT 8349 ATOM 63077 O WAT 8350 90.809 136.828 68.013 1.00 0.00 O ATOM 63078 H1 WAT 8350 90.464 137.720 68.052 1.00 0.00 H ATOM 63079 H2 WAT 8350 90.618 136.459 68.875 1.00 0.00 H TER 63081 WAT 8350 ATOM 63081 O WAT 8351 21.293 110.379 17.571 1.00 0.00 O ATOM 63082 H1 WAT 8351 20.887 110.986 18.189 1.00 0.00 H ATOM 63083 H2 WAT 8351 22.172 110.233 17.920 1.00 0.00 H TER 63085 WAT 8351 ATOM 63085 O WAT 8352 141.216 18.036 75.729 1.00 0.00 O ATOM 63086 H1 WAT 8352 140.595 18.747 75.578 1.00 0.00 H ATOM 63087 H2 WAT 8352 141.901 18.427 76.272 1.00 0.00 H TER 63089 WAT 8352 ATOM 63089 O WAT 8353 51.954 75.468 88.621 1.00 0.00 O ATOM 63090 H1 WAT 8353 51.693 76.339 88.323 1.00 0.00 H ATOM 63091 H2 WAT 8353 52.499 75.125 87.913 1.00 0.00 H TER 63093 WAT 8353 ATOM 63093 O WAT 8354 41.672 133.818 115.433 1.00 0.00 O ATOM 63094 H1 WAT 8354 41.394 134.636 115.843 1.00 0.00 H ATOM 63095 H2 WAT 8354 42.246 134.091 114.717 1.00 0.00 H TER 63097 WAT 8354 ATOM 63097 O WAT 8355 24.311 126.063 146.039 1.00 0.00 O ATOM 63098 H1 WAT 8355 24.983 126.742 145.981 1.00 0.00 H ATOM 63099 H2 WAT 8355 23.715 126.373 146.721 1.00 0.00 H TER 63101 WAT 8355 ATOM 63101 O WAT 8356 133.823 108.531 11.776 1.00 0.00 O ATOM 63102 H1 WAT 8356 133.301 108.573 12.578 1.00 0.00 H ATOM 63103 H2 WAT 8356 133.778 107.612 11.510 1.00 0.00 H TER 63105 WAT 8356 ATOM 63105 O WAT 8357 118.126 133.845 17.313 1.00 0.00 O ATOM 63106 H1 WAT 8357 117.627 133.033 17.389 1.00 0.00 H ATOM 63107 H2 WAT 8357 117.869 134.357 18.080 1.00 0.00 H TER 63109 WAT 8357 ATOM 63109 O WAT 8358 44.457 14.375 85.732 1.00 0.00 O ATOM 63110 H1 WAT 8358 45.158 14.929 85.390 1.00 0.00 H ATOM 63111 H2 WAT 8358 44.336 14.671 86.634 1.00 0.00 H TER 63113 WAT 8358 ATOM 63113 O WAT 8359 87.817 143.821 90.953 1.00 0.00 O ATOM 63114 H1 WAT 8359 87.049 143.516 91.436 1.00 0.00 H ATOM 63115 H2 WAT 8359 87.498 144.566 90.443 1.00 0.00 H TER 63117 WAT 8359 ATOM 63117 O WAT 8360 4.197 102.720 119.165 1.00 0.00 O ATOM 63118 H1 WAT 8360 4.900 102.731 119.815 1.00 0.00 H ATOM 63119 H2 WAT 8360 3.714 101.915 119.349 1.00 0.00 H TER 63121 WAT 8360 ATOM 63121 O WAT 8361 113.851 34.112 156.369 1.00 0.00 O ATOM 63122 H1 WAT 8361 114.459 33.570 155.866 1.00 0.00 H ATOM 63123 H2 WAT 8361 113.005 33.673 156.274 1.00 0.00 H TER 63125 WAT 8361 ATOM 63125 O WAT 8362 77.620 34.798 114.354 1.00 0.00 O ATOM 63126 H1 WAT 8362 77.473 34.957 115.286 1.00 0.00 H ATOM 63127 H2 WAT 8362 77.523 35.658 113.946 1.00 0.00 H TER 63129 WAT 8362 ATOM 63129 O WAT 8363 120.256 55.404 151.715 1.00 0.00 O ATOM 63130 H1 WAT 8363 120.891 54.934 152.255 1.00 0.00 H ATOM 63131 H2 WAT 8363 119.409 55.213 152.118 1.00 0.00 H TER 63133 WAT 8363 ATOM 63133 O WAT 8364 33.399 64.137 22.040 1.00 0.00 O ATOM 63134 H1 WAT 8364 32.831 64.535 21.380 1.00 0.00 H ATOM 63135 H2 WAT 8364 34.131 63.777 21.540 1.00 0.00 H TER 63137 WAT 8364 ATOM 63137 O WAT 8365 1.353 100.856 84.929 1.00 0.00 O ATOM 63138 H1 WAT 8365 2.022 101.524 85.079 1.00 0.00 H ATOM 63139 H2 WAT 8365 1.837 100.103 84.592 1.00 0.00 H TER 63141 WAT 8365 ATOM 63141 O WAT 8366 82.917 17.797 105.705 1.00 0.00 O ATOM 63142 H1 WAT 8366 83.316 18.452 105.131 1.00 0.00 H ATOM 63143 H2 WAT 8366 83.483 17.030 105.622 1.00 0.00 H TER 63145 WAT 8366 ATOM 63145 O WAT 8367 115.386 18.646 149.891 1.00 0.00 O ATOM 63146 H1 WAT 8367 116.048 18.048 149.543 1.00 0.00 H ATOM 63147 H2 WAT 8367 115.716 19.519 149.676 1.00 0.00 H TER 63149 WAT 8367 ATOM 63149 O WAT 8368 130.706 44.438 13.510 1.00 0.00 O ATOM 63150 H1 WAT 8368 131.246 44.683 14.262 1.00 0.00 H ATOM 63151 H2 WAT 8368 131.017 43.567 13.265 1.00 0.00 H TER 63153 WAT 8368 ATOM 63153 O WAT 8369 137.067 97.597 152.976 1.00 0.00 O ATOM 63154 H1 WAT 8369 136.288 98.144 152.883 1.00 0.00 H ATOM 63155 H2 WAT 8369 137.710 97.994 152.389 1.00 0.00 H TER 63157 WAT 8369 ATOM 63157 O WAT 8370 70.707 99.926 104.370 1.00 0.00 O ATOM 63158 H1 WAT 8370 69.873 99.458 104.314 1.00 0.00 H ATOM 63159 H2 WAT 8370 70.510 100.704 104.892 1.00 0.00 H TER 63161 WAT 8370 ATOM 63161 O WAT 8371 63.264 114.572 93.664 1.00 0.00 O ATOM 63162 H1 WAT 8371 63.641 113.693 93.682 1.00 0.00 H ATOM 63163 H2 WAT 8371 63.313 114.872 94.572 1.00 0.00 H TER 63165 WAT 8371 ATOM 63165 O WAT 8372 85.327 144.338 2.061 1.00 0.00 O ATOM 63166 H1 WAT 8372 84.548 143.897 2.400 1.00 0.00 H ATOM 63167 H2 WAT 8372 85.237 145.245 2.355 1.00 0.00 H TER 63169 WAT 8372 ATOM 63169 O WAT 8373 54.036 76.833 90.489 1.00 0.00 O ATOM 63170 H1 WAT 8373 53.479 76.206 90.027 1.00 0.00 H ATOM 63171 H2 WAT 8373 53.425 77.471 90.856 1.00 0.00 H TER 63173 WAT 8373 ATOM 63173 O WAT 8374 69.850 28.452 102.008 1.00 0.00 O ATOM 63174 H1 WAT 8374 70.426 28.139 102.706 1.00 0.00 H ATOM 63175 H2 WAT 8374 70.071 27.907 101.253 1.00 0.00 H TER 63177 WAT 8374 ATOM 63177 O WAT 8375 85.808 88.598 64.078 1.00 0.00 O ATOM 63178 H1 WAT 8375 86.119 87.854 63.563 1.00 0.00 H ATOM 63179 H2 WAT 8375 85.369 89.163 63.442 1.00 0.00 H TER 63181 WAT 8375 ATOM 63181 O WAT 8376 114.562 105.022 91.028 1.00 0.00 O ATOM 63182 H1 WAT 8376 114.458 105.972 90.973 1.00 0.00 H ATOM 63183 H2 WAT 8376 113.921 104.675 90.408 1.00 0.00 H TER 63185 WAT 8376 ATOM 63185 O WAT 8377 109.600 131.905 119.691 1.00 0.00 O ATOM 63186 H1 WAT 8377 110.191 132.488 119.213 1.00 0.00 H ATOM 63187 H2 WAT 8377 108.840 132.450 119.895 1.00 0.00 H TER 63189 WAT 8377 ATOM 63189 O WAT 8378 79.026 35.957 118.088 1.00 0.00 O ATOM 63190 H1 WAT 8378 78.873 36.210 118.999 1.00 0.00 H ATOM 63191 H2 WAT 8378 79.014 36.784 117.606 1.00 0.00 H TER 63193 WAT 8378 ATOM 63193 O WAT 8379 2.788 17.025 13.943 1.00 0.00 O ATOM 63194 H1 WAT 8379 2.444 16.383 14.564 1.00 0.00 H ATOM 63195 H2 WAT 8379 3.663 16.702 13.726 1.00 0.00 H TER 63197 WAT 8379 ATOM 63197 O WAT 8380 80.947 40.058 3.149 1.00 0.00 O ATOM 63198 H1 WAT 8380 80.139 40.553 3.012 1.00 0.00 H ATOM 63199 H2 WAT 8380 80.726 39.424 3.831 1.00 0.00 H TER 63201 WAT 8380 ATOM 63201 O WAT 8381 60.239 47.045 154.495 1.00 0.00 O ATOM 63202 H1 WAT 8381 60.185 46.333 153.858 1.00 0.00 H ATOM 63203 H2 WAT 8381 59.917 46.661 155.311 1.00 0.00 H TER 63205 WAT 8381 ATOM 63205 O WAT 8382 71.893 73.373 3.836 1.00 0.00 O ATOM 63206 H1 WAT 8382 72.329 73.390 4.688 1.00 0.00 H ATOM 63207 H2 WAT 8382 72.593 73.179 3.213 1.00 0.00 H TER 63209 WAT 8382 ATOM 63209 O WAT 8383 5.083 26.173 154.694 1.00 0.00 O ATOM 63210 H1 WAT 8383 4.180 26.070 154.994 1.00 0.00 H ATOM 63211 H2 WAT 8383 5.003 26.421 153.773 1.00 0.00 H TER 63213 WAT 8383 ATOM 63213 O WAT 8384 14.180 32.943 109.265 1.00 0.00 O ATOM 63214 H1 WAT 8384 13.408 33.494 109.394 1.00 0.00 H ATOM 63215 H2 WAT 8384 14.582 32.887 110.131 1.00 0.00 H TER 63217 WAT 8384 ATOM 63217 O WAT 8385 5.915 115.507 93.312 1.00 0.00 O ATOM 63218 H1 WAT 8385 5.733 114.966 92.543 1.00 0.00 H ATOM 63219 H2 WAT 8385 5.172 115.351 93.895 1.00 0.00 H TER 63221 WAT 8385 ATOM 63221 O WAT 8386 135.597 88.014 32.467 1.00 0.00 O ATOM 63222 H1 WAT 8386 136.385 88.331 32.908 1.00 0.00 H ATOM 63223 H2 WAT 8386 135.880 87.224 32.008 1.00 0.00 H TER 63225 WAT 8386 ATOM 63225 O WAT 8387 145.081 104.471 95.153 1.00 0.00 O ATOM 63226 H1 WAT 8387 144.594 104.106 95.891 1.00 0.00 H ATOM 63227 H2 WAT 8387 145.997 104.434 95.428 1.00 0.00 H TER 63229 WAT 8387 ATOM 63229 O WAT 8388 89.504 145.660 20.615 1.00 0.00 O ATOM 63230 H1 WAT 8388 88.905 146.387 20.445 1.00 0.00 H ATOM 63231 H2 WAT 8388 89.481 145.548 21.566 1.00 0.00 H TER 63233 WAT 8388 ATOM 63233 O WAT 8389 6.847 23.516 62.508 1.00 0.00 O ATOM 63234 H1 WAT 8389 6.085 23.907 62.081 1.00 0.00 H ATOM 63235 H2 WAT 8389 7.443 23.306 61.789 1.00 0.00 H TER 63237 WAT 8389 ATOM 63237 O WAT 8390 124.234 90.674 14.249 1.00 0.00 O ATOM 63238 H1 WAT 8390 124.910 91.309 14.487 1.00 0.00 H ATOM 63239 H2 WAT 8390 123.431 91.191 14.186 1.00 0.00 H TER 63241 WAT 8390 ATOM 63241 O WAT 8391 4.390 135.659 147.746 1.00 0.00 O ATOM 63242 H1 WAT 8391 4.359 134.770 148.100 1.00 0.00 H ATOM 63243 H2 WAT 8391 5.300 135.932 147.861 1.00 0.00 H TER 63245 WAT 8391 ATOM 63245 O WAT 8392 61.923 55.928 131.405 1.00 0.00 O ATOM 63246 H1 WAT 8392 62.504 55.615 132.098 1.00 0.00 H ATOM 63247 H2 WAT 8392 61.042 55.809 131.759 1.00 0.00 H TER 63249 WAT 8392 ATOM 63249 O WAT 8393 136.554 52.360 98.821 1.00 0.00 O ATOM 63250 H1 WAT 8393 136.220 53.256 98.777 1.00 0.00 H ATOM 63251 H2 WAT 8393 137.285 52.407 99.438 1.00 0.00 H TER 63253 WAT 8393 ATOM 63253 O WAT 8394 4.149 132.476 133.941 1.00 0.00 O ATOM 63254 H1 WAT 8394 4.302 131.868 133.218 1.00 0.00 H ATOM 63255 H2 WAT 8394 3.702 131.950 134.605 1.00 0.00 H TER 63257 WAT 8394 ATOM 63257 O WAT 8395 104.618 51.544 138.848 1.00 0.00 O ATOM 63258 H1 WAT 8395 105.077 50.932 138.273 1.00 0.00 H ATOM 63259 H2 WAT 8395 105.109 52.362 138.768 1.00 0.00 H TER 63261 WAT 8395 ATOM 63261 O WAT 8396 129.457 120.495 142.951 1.00 0.00 O ATOM 63262 H1 WAT 8396 129.013 121.280 142.630 1.00 0.00 H ATOM 63263 H2 WAT 8396 128.872 119.775 142.715 1.00 0.00 H TER 63265 WAT 8396 ATOM 63265 O WAT 8397 133.355 84.404 157.750 1.00 0.00 O ATOM 63266 H1 WAT 8397 132.860 83.609 157.552 1.00 0.00 H ATOM 63267 H2 WAT 8397 133.736 84.241 158.613 1.00 0.00 H TER 63269 WAT 8397 ATOM 63269 O WAT 8398 105.220 42.249 126.627 1.00 0.00 O ATOM 63270 H1 WAT 8398 105.074 41.402 126.206 1.00 0.00 H ATOM 63271 H2 WAT 8398 104.372 42.690 126.579 1.00 0.00 H TER 63273 WAT 8398 ATOM 63273 O WAT 8399 100.858 101.713 12.161 1.00 0.00 O ATOM 63274 H1 WAT 8399 100.607 101.156 11.424 1.00 0.00 H ATOM 63275 H2 WAT 8399 101.424 101.160 12.698 1.00 0.00 H TER 63277 WAT 8399 ATOM 63277 O WAT 8400 131.526 21.235 96.587 1.00 0.00 O ATOM 63278 H1 WAT 8400 131.092 22.076 96.447 1.00 0.00 H ATOM 63279 H2 WAT 8400 130.942 20.759 97.176 1.00 0.00 H TER 63281 WAT 8400 ATOM 63281 O WAT 8401 129.155 80.886 14.157 1.00 0.00 O ATOM 63282 H1 WAT 8401 128.569 80.559 14.840 1.00 0.00 H ATOM 63283 H2 WAT 8401 128.595 81.424 13.599 1.00 0.00 H TER 63285 WAT 8401 ATOM 63285 O WAT 8402 109.852 83.622 142.478 1.00 0.00 O ATOM 63286 H1 WAT 8402 110.183 82.781 142.792 1.00 0.00 H ATOM 63287 H2 WAT 8402 109.792 84.164 143.265 1.00 0.00 H TER 63289 WAT 8402 ATOM 63289 O WAT 8403 33.830 102.624 91.333 1.00 0.00 O ATOM 63290 H1 WAT 8403 33.612 103.546 91.195 1.00 0.00 H ATOM 63291 H2 WAT 8403 33.561 102.191 90.523 1.00 0.00 H TER 63293 WAT 8403 ATOM 63293 O WAT 8404 69.369 63.810 65.249 1.00 0.00 O ATOM 63294 H1 WAT 8404 68.421 63.816 65.121 1.00 0.00 H ATOM 63295 H2 WAT 8404 69.711 64.344 64.532 1.00 0.00 H TER 63297 WAT 8404 ATOM 63297 O WAT 8405 17.854 8.488 12.609 1.00 0.00 O ATOM 63298 H1 WAT 8405 17.137 9.120 12.567 1.00 0.00 H ATOM 63299 H2 WAT 8405 18.588 8.982 12.975 1.00 0.00 H TER 63301 WAT 8405 ATOM 63301 O WAT 8406 11.930 81.901 76.739 1.00 0.00 O ATOM 63302 H1 WAT 8406 12.026 81.440 77.572 1.00 0.00 H ATOM 63303 H2 WAT 8406 12.637 81.559 76.192 1.00 0.00 H TER 63305 WAT 8406 ATOM 63305 O WAT 8407 36.458 112.968 71.698 1.00 0.00 O ATOM 63306 H1 WAT 8407 35.996 112.213 72.063 1.00 0.00 H ATOM 63307 H2 WAT 8407 35.772 113.491 71.282 1.00 0.00 H TER 63309 WAT 8407 ATOM 63309 O WAT 8408 71.185 119.365 94.065 1.00 0.00 O ATOM 63310 H1 WAT 8408 71.657 119.203 93.248 1.00 0.00 H ATOM 63311 H2 WAT 8408 71.776 119.916 94.577 1.00 0.00 H TER 63313 WAT 8408 ATOM 63313 O WAT 8409 145.283 41.730 109.211 1.00 0.00 O ATOM 63314 H1 WAT 8409 144.853 42.586 109.204 1.00 0.00 H ATOM 63315 H2 WAT 8409 146.192 41.917 108.978 1.00 0.00 H TER 63317 WAT 8409 ATOM 63317 O WAT 8410 106.430 109.398 143.041 1.00 0.00 O ATOM 63318 H1 WAT 8410 106.363 109.575 143.979 1.00 0.00 H ATOM 63319 H2 WAT 8410 105.996 110.143 142.625 1.00 0.00 H TER 63321 WAT 8410 ATOM 63321 O WAT 8411 12.552 144.211 1.456 1.00 0.00 O ATOM 63322 H1 WAT 8411 12.234 143.320 1.606 1.00 0.00 H ATOM 63323 H2 WAT 8411 12.653 144.272 0.506 1.00 0.00 H TER 63325 WAT 8411 ATOM 63325 O WAT 8412 31.230 40.507 142.421 1.00 0.00 O ATOM 63326 H1 WAT 8412 31.001 40.162 143.284 1.00 0.00 H ATOM 63327 H2 WAT 8412 32.184 40.579 142.437 1.00 0.00 H TER 63329 WAT 8412 ATOM 63329 O WAT 8413 129.518 130.316 6.995 1.00 0.00 O ATOM 63330 H1 WAT 8413 128.744 129.934 7.409 1.00 0.00 H ATOM 63331 H2 WAT 8413 129.412 131.260 7.114 1.00 0.00 H TER 63333 WAT 8413 ATOM 63333 O WAT 8414 92.207 138.575 0.511 1.00 0.00 O ATOM 63334 H1 WAT 8414 92.268 139.529 0.566 1.00 0.00 H ATOM 63335 H2 WAT 8414 92.940 138.258 1.038 1.00 0.00 H TER 63337 WAT 8414 ATOM 63337 O WAT 8415 31.733 87.605 65.901 1.00 0.00 O ATOM 63338 H1 WAT 8415 31.161 87.443 65.150 1.00 0.00 H ATOM 63339 H2 WAT 8415 32.178 86.770 66.047 1.00 0.00 H TER 63341 WAT 8415 ATOM 63341 O WAT 8416 86.293 134.695 81.814 1.00 0.00 O ATOM 63342 H1 WAT 8416 86.905 135.425 81.910 1.00 0.00 H ATOM 63343 H2 WAT 8416 85.666 134.813 82.527 1.00 0.00 H TER 63345 WAT 8416 ATOM 63345 O WAT 8417 25.116 30.032 124.350 1.00 0.00 O ATOM 63346 H1 WAT 8417 25.894 29.747 124.831 1.00 0.00 H ATOM 63347 H2 WAT 8417 24.478 30.245 125.031 1.00 0.00 H TER 63349 WAT 8417 ATOM 63349 O WAT 8418 103.456 72.361 88.706 1.00 0.00 O ATOM 63350 H1 WAT 8418 102.993 72.517 87.883 1.00 0.00 H ATOM 63351 H2 WAT 8418 102.764 72.325 89.366 1.00 0.00 H TER 63353 WAT 8418 ATOM 63353 O WAT 8419 133.141 75.427 112.764 1.00 0.00 O ATOM 63354 H1 WAT 8419 133.118 74.737 112.102 1.00 0.00 H ATOM 63355 H2 WAT 8419 132.565 76.109 112.419 1.00 0.00 H TER 63357 WAT 8419 ATOM 63357 O WAT 8420 56.111 1.782 71.120 1.00 0.00 O ATOM 63358 H1 WAT 8420 55.169 1.610 71.114 1.00 0.00 H ATOM 63359 H2 WAT 8420 56.265 2.298 70.329 1.00 0.00 H TER 63361 WAT 8420 ATOM 63361 O WAT 8421 95.850 53.707 132.594 1.00 0.00 O ATOM 63362 H1 WAT 8421 94.956 53.932 132.338 1.00 0.00 H ATOM 63363 H2 WAT 8421 95.759 53.316 133.463 1.00 0.00 H TER 63365 WAT 8421 ATOM 63365 O WAT 8422 65.953 55.883 148.098 1.00 0.00 O ATOM 63366 H1 WAT 8422 66.548 55.436 147.497 1.00 0.00 H ATOM 63367 H2 WAT 8422 66.297 55.682 148.969 1.00 0.00 H TER 63369 WAT 8422 ATOM 63369 O WAT 8423 58.000 8.365 140.803 1.00 0.00 O ATOM 63370 H1 WAT 8423 58.006 9.235 140.404 1.00 0.00 H ATOM 63371 H2 WAT 8423 58.384 7.794 140.138 1.00 0.00 H TER 63373 WAT 8423 ATOM 63373 O WAT 8424 50.228 99.807 67.646 1.00 0.00 O ATOM 63374 H1 WAT 8424 50.223 100.557 67.051 1.00 0.00 H ATOM 63375 H2 WAT 8424 49.355 99.425 67.558 1.00 0.00 H TER 63377 WAT 8424 ATOM 63377 O WAT 8425 69.438 42.694 113.005 1.00 0.00 O ATOM 63378 H1 WAT 8425 69.549 42.906 112.078 1.00 0.00 H ATOM 63379 H2 WAT 8425 68.819 41.964 113.011 1.00 0.00 H TER 63381 WAT 8425 ATOM 63381 O WAT 8426 70.260 138.525 73.739 1.00 0.00 O ATOM 63382 H1 WAT 8426 70.484 139.141 73.040 1.00 0.00 H ATOM 63383 H2 WAT 8426 70.598 137.683 73.433 1.00 0.00 H TER 63385 WAT 8426 ATOM 63385 O WAT 8427 108.941 69.511 143.151 1.00 0.00 O ATOM 63386 H1 WAT 8427 109.701 69.712 143.697 1.00 0.00 H ATOM 63387 H2 WAT 8427 108.219 69.413 143.772 1.00 0.00 H TER 63389 WAT 8427 ATOM 63389 O WAT 8428 50.271 91.568 135.837 1.00 0.00 O ATOM 63390 H1 WAT 8428 49.757 90.773 135.978 1.00 0.00 H ATOM 63391 H2 WAT 8428 50.933 91.550 136.528 1.00 0.00 H TER 63393 WAT 8428 ATOM 63393 O WAT 8429 101.004 121.668 101.721 1.00 0.00 O ATOM 63394 H1 WAT 8429 101.222 122.510 102.121 1.00 0.00 H ATOM 63395 H2 WAT 8429 101.751 121.105 101.926 1.00 0.00 H TER 63397 WAT 8429 ATOM 63397 O WAT 8430 13.148 11.814 83.897 1.00 0.00 O ATOM 63398 H1 WAT 8430 12.892 12.727 83.767 1.00 0.00 H ATOM 63399 H2 WAT 8430 14.105 11.836 83.934 1.00 0.00 H TER 63401 WAT 8430 ATOM 63401 O WAT 8431 88.314 108.090 20.201 1.00 0.00 O ATOM 63402 H1 WAT 8431 87.461 108.507 20.080 1.00 0.00 H ATOM 63403 H2 WAT 8431 88.616 108.405 21.053 1.00 0.00 H TER 63405 WAT 8431 ATOM 63405 O WAT 8432 24.938 113.548 102.559 1.00 0.00 O ATOM 63406 H1 WAT 8432 24.840 112.737 102.060 1.00 0.00 H ATOM 63407 H2 WAT 8432 25.356 114.155 101.949 1.00 0.00 H TER 63409 WAT 8432 ATOM 63409 O WAT 8433 136.672 66.519 14.413 1.00 0.00 O ATOM 63410 H1 WAT 8433 137.415 67.014 14.069 1.00 0.00 H ATOM 63411 H2 WAT 8433 136.627 66.765 15.337 1.00 0.00 H TER 63413 WAT 8433 ATOM 63413 O WAT 8434 110.722 114.779 99.531 1.00 0.00 O ATOM 63414 H1 WAT 8434 111.164 114.159 98.951 1.00 0.00 H ATOM 63415 H2 WAT 8434 111.242 114.767 100.335 1.00 0.00 H TER 63417 WAT 8434 ATOM 63417 O WAT 8435 11.933 7.105 8.406 1.00 0.00 O ATOM 63418 H1 WAT 8435 12.690 6.583 8.675 1.00 0.00 H ATOM 63419 H2 WAT 8435 11.807 6.886 7.483 1.00 0.00 H TER 63421 WAT 8435 ATOM 63421 O WAT 8436 1.578 30.525 82.110 1.00 0.00 O ATOM 63422 H1 WAT 8436 2.424 30.960 82.211 1.00 0.00 H ATOM 63423 H2 WAT 8436 1.798 29.619 81.893 1.00 0.00 H TER 63425 WAT 8436 ATOM 63425 O WAT 8437 131.711 100.390 63.393 1.00 0.00 O ATOM 63426 H1 WAT 8437 131.408 99.640 63.906 1.00 0.00 H ATOM 63427 H2 WAT 8437 131.381 100.226 62.510 1.00 0.00 H TER 63429 WAT 8437 ATOM 63429 O WAT 8438 105.761 123.592 12.998 1.00 0.00 O ATOM 63430 H1 WAT 8438 105.517 124.402 12.551 1.00 0.00 H ATOM 63431 H2 WAT 8438 105.049 122.984 12.798 1.00 0.00 H TER 63433 WAT 8438 ATOM 63433 O WAT 8439 114.935 109.112 116.409 1.00 0.00 O ATOM 63434 H1 WAT 8439 114.444 109.902 116.182 1.00 0.00 H ATOM 63435 H2 WAT 8439 114.602 108.443 115.812 1.00 0.00 H TER 63437 WAT 8439 ATOM 63437 O WAT 8440 120.280 31.708 103.242 1.00 0.00 O ATOM 63438 H1 WAT 8440 119.327 31.615 103.214 1.00 0.00 H ATOM 63439 H2 WAT 8440 120.470 31.956 104.146 1.00 0.00 H TER 63441 WAT 8440 ATOM 63441 O WAT 8441 73.577 40.312 108.443 1.00 0.00 O ATOM 63442 H1 WAT 8441 73.749 41.179 108.074 1.00 0.00 H ATOM 63443 H2 WAT 8441 73.543 40.457 109.389 1.00 0.00 H TER 63445 WAT 8441 ATOM 63445 O WAT 8442 143.636 140.588 86.670 1.00 0.00 O ATOM 63446 H1 WAT 8442 143.087 140.725 85.898 1.00 0.00 H ATOM 63447 H2 WAT 8442 144.517 140.828 86.382 1.00 0.00 H TER 63449 WAT 8442 ATOM 63449 O WAT 8443 62.958 10.076 16.278 1.00 0.00 O ATOM 63450 H1 WAT 8443 63.602 9.734 16.899 1.00 0.00 H ATOM 63451 H2 WAT 8443 63.482 10.488 15.592 1.00 0.00 H TER 63453 WAT 8443 ATOM 63453 O WAT 8444 14.959 44.714 72.796 1.00 0.00 O ATOM 63454 H1 WAT 8444 15.187 45.208 72.009 1.00 0.00 H ATOM 63455 H2 WAT 8444 15.500 45.098 73.485 1.00 0.00 H TER 63457 WAT 8444 ATOM 63457 O WAT 8445 54.777 141.925 149.001 1.00 0.00 O ATOM 63458 H1 WAT 8445 55.618 141.778 149.434 1.00 0.00 H ATOM 63459 H2 WAT 8445 54.744 141.262 148.311 1.00 0.00 H TER 63461 WAT 8445 ATOM 63461 O WAT 8446 75.340 24.805 120.421 1.00 0.00 O ATOM 63462 H1 WAT 8446 75.816 25.552 120.784 1.00 0.00 H ATOM 63463 H2 WAT 8446 74.617 25.197 119.931 1.00 0.00 H TER 63465 WAT 8446 ATOM 63465 O WAT 8447 114.719 1.761 146.718 1.00 0.00 O ATOM 63466 H1 WAT 8447 115.167 1.057 146.248 1.00 0.00 H ATOM 63467 H2 WAT 8447 115.177 1.818 147.556 1.00 0.00 H TER 63469 WAT 8447 ATOM 63469 O WAT 8448 14.386 71.938 0.429 1.00 0.00 O ATOM 63470 H1 WAT 8448 13.883 71.259 0.878 1.00 0.00 H ATOM 63471 H2 WAT 8448 13.851 72.170 -0.330 1.00 0.00 H TER 63473 WAT 8448 ATOM 63473 O WAT 8449 94.798 6.660 108.063 1.00 0.00 O ATOM 63474 H1 WAT 8449 95.178 6.275 107.273 1.00 0.00 H ATOM 63475 H2 WAT 8449 94.786 5.942 108.697 1.00 0.00 H TER 63477 WAT 8449 ATOM 63477 O WAT 8450 71.640 27.701 95.853 1.00 0.00 O ATOM 63478 H1 WAT 8450 70.760 27.957 96.127 1.00 0.00 H ATOM 63479 H2 WAT 8450 71.671 26.756 95.999 1.00 0.00 H TER 63481 WAT 8450 ATOM 63481 O WAT 8451 7.964 111.207 64.261 1.00 0.00 O ATOM 63482 H1 WAT 8451 7.414 110.645 63.714 1.00 0.00 H ATOM 63483 H2 WAT 8451 8.859 110.940 64.054 1.00 0.00 H TER 63485 WAT 8451 ATOM 63485 O WAT 8452 141.207 23.915 93.801 1.00 0.00 O ATOM 63486 H1 WAT 8452 140.630 24.339 94.437 1.00 0.00 H ATOM 63487 H2 WAT 8452 141.310 24.561 93.103 1.00 0.00 H TER 63489 WAT 8452 ATOM 63489 O WAT 8453 103.611 117.835 14.217 1.00 0.00 O ATOM 63490 H1 WAT 8453 104.527 117.571 14.310 1.00 0.00 H ATOM 63491 H2 WAT 8453 103.170 117.436 14.967 1.00 0.00 H TER 63493 WAT 8453 ATOM 63493 O WAT 8454 112.019 52.563 137.553 1.00 0.00 O ATOM 63494 H1 WAT 8454 112.743 52.839 138.115 1.00 0.00 H ATOM 63495 H2 WAT 8454 112.288 52.820 136.671 1.00 0.00 H TER 63497 WAT 8454 ATOM 63497 O WAT 8455 141.704 43.362 119.562 1.00 0.00 O ATOM 63498 H1 WAT 8455 141.905 43.459 120.492 1.00 0.00 H ATOM 63499 H2 WAT 8455 141.453 44.241 119.278 1.00 0.00 H TER 63501 WAT 8455 ATOM 63501 O WAT 8456 140.655 48.278 2.865 1.00 0.00 O ATOM 63502 H1 WAT 8456 141.280 48.641 3.493 1.00 0.00 H ATOM 63503 H2 WAT 8456 140.526 48.977 2.225 1.00 0.00 H TER 63505 WAT 8456 ATOM 63505 O WAT 8457 131.141 5.218 144.498 1.00 0.00 O ATOM 63506 H1 WAT 8457 131.045 5.419 143.567 1.00 0.00 H ATOM 63507 H2 WAT 8457 130.269 5.362 144.865 1.00 0.00 H TER 63509 WAT 8457 ATOM 63509 O WAT 8458 76.517 110.505 107.653 1.00 0.00 O ATOM 63510 H1 WAT 8458 76.113 110.649 108.509 1.00 0.00 H ATOM 63511 H2 WAT 8458 77.381 110.911 107.724 1.00 0.00 H TER 63513 WAT 8458 ATOM 63513 O WAT 8459 87.083 18.602 93.317 1.00 0.00 O ATOM 63514 H1 WAT 8459 86.773 18.978 94.142 1.00 0.00 H ATOM 63515 H2 WAT 8459 87.240 19.360 92.753 1.00 0.00 H TER 63517 WAT 8459 ATOM 63517 O WAT 8460 116.516 36.392 77.084 1.00 0.00 O ATOM 63518 H1 WAT 8460 116.725 36.222 76.165 1.00 0.00 H ATOM 63519 H2 WAT 8460 115.576 36.223 77.150 1.00 0.00 H TER 63521 WAT 8460 ATOM 63521 O WAT 8461 36.633 26.684 94.701 1.00 0.00 O ATOM 63522 H1 WAT 8461 36.684 26.383 93.793 1.00 0.00 H ATOM 63523 H2 WAT 8461 36.418 25.897 95.201 1.00 0.00 H TER 63525 WAT 8461 ATOM 63525 O WAT 8462 82.070 30.160 101.405 1.00 0.00 O ATOM 63526 H1 WAT 8462 81.519 30.546 102.085 1.00 0.00 H ATOM 63527 H2 WAT 8462 82.612 30.886 101.095 1.00 0.00 H TER 63529 WAT 8462 ATOM 63529 O WAT 8463 101.657 129.222 97.001 1.00 0.00 O ATOM 63530 H1 WAT 8463 102.060 128.657 97.660 1.00 0.00 H ATOM 63531 H2 WAT 8463 100.942 129.658 97.463 1.00 0.00 H TER 63533 WAT 8463 ATOM 63533 O WAT 8464 92.089 31.229 73.270 1.00 0.00 O ATOM 63534 H1 WAT 8464 92.168 31.883 72.575 1.00 0.00 H ATOM 63535 H2 WAT 8464 92.892 30.713 73.206 1.00 0.00 H TER 63537 WAT 8464 ATOM 63537 O WAT 8465 75.861 9.203 77.663 1.00 0.00 O ATOM 63538 H1 WAT 8465 75.109 8.746 77.286 1.00 0.00 H ATOM 63539 H2 WAT 8465 75.903 8.891 78.567 1.00 0.00 H TER 63541 WAT 8465 ATOM 63541 O WAT 8466 63.186 84.021 135.786 1.00 0.00 O ATOM 63542 H1 WAT 8466 63.782 83.313 135.543 1.00 0.00 H ATOM 63543 H2 WAT 8466 62.743 83.702 136.572 1.00 0.00 H TER 63545 WAT 8466 ATOM 63545 O WAT 8467 20.815 136.411 142.659 1.00 0.00 O ATOM 63546 H1 WAT 8467 20.464 137.154 143.151 1.00 0.00 H ATOM 63547 H2 WAT 8467 20.911 135.716 143.310 1.00 0.00 H TER 63549 WAT 8467 ATOM 63549 O WAT 8468 0.562 134.540 144.233 1.00 0.00 O ATOM 63550 H1 WAT 8468 -0.008 133.906 144.666 1.00 0.00 H ATOM 63551 H2 WAT 8468 1.108 134.012 143.650 1.00 0.00 H TER 63553 WAT 8468 ATOM 63553 O WAT 8469 71.546 143.661 107.937 1.00 0.00 O ATOM 63554 H1 WAT 8469 70.729 143.355 108.331 1.00 0.00 H ATOM 63555 H2 WAT 8469 71.323 144.508 107.551 1.00 0.00 H TER 63557 WAT 8469 ATOM 63557 O WAT 8470 19.296 139.253 135.730 1.00 0.00 O ATOM 63558 H1 WAT 8470 18.979 139.595 136.566 1.00 0.00 H ATOM 63559 H2 WAT 8470 18.797 139.734 135.070 1.00 0.00 H TER 63561 WAT 8470 ATOM 63561 O WAT 8471 14.331 62.928 84.755 1.00 0.00 O ATOM 63562 H1 WAT 8471 14.044 63.037 85.662 1.00 0.00 H ATOM 63563 H2 WAT 8471 13.593 63.240 84.231 1.00 0.00 H TER 63565 WAT 8471 ATOM 63565 O WAT 8472 70.599 27.148 104.524 1.00 0.00 O ATOM 63566 H1 WAT 8472 71.400 26.653 104.693 1.00 0.00 H ATOM 63567 H2 WAT 8472 70.436 27.626 105.337 1.00 0.00 H TER 63569 WAT 8472 ATOM 63569 O WAT 8473 92.252 52.313 71.621 1.00 0.00 O ATOM 63570 H1 WAT 8473 91.356 52.402 71.947 1.00 0.00 H ATOM 63571 H2 WAT 8473 92.656 53.163 71.797 1.00 0.00 H TER 63573 WAT 8473 ATOM 63573 O WAT 8474 93.668 49.164 60.138 1.00 0.00 O ATOM 63574 H1 WAT 8474 93.032 49.016 59.439 1.00 0.00 H ATOM 63575 H2 WAT 8474 94.346 48.505 59.990 1.00 0.00 H TER 63577 WAT 8474 ATOM 63577 O WAT 8475 73.755 55.398 83.299 1.00 0.00 O ATOM 63578 H1 WAT 8475 73.092 54.720 83.429 1.00 0.00 H ATOM 63579 H2 WAT 8475 73.400 55.949 82.602 1.00 0.00 H TER 63581 WAT 8475 ATOM 63581 O WAT 8476 59.895 35.043 132.633 1.00 0.00 O ATOM 63582 H1 WAT 8476 59.509 34.576 133.374 1.00 0.00 H ATOM 63583 H2 WAT 8476 59.618 35.951 132.752 1.00 0.00 H TER 63585 WAT 8476 ATOM 63585 O WAT 8477 12.118 118.989 137.298 1.00 0.00 O ATOM 63586 H1 WAT 8477 12.355 119.789 137.767 1.00 0.00 H ATOM 63587 H2 WAT 8477 11.395 118.620 137.804 1.00 0.00 H TER 63589 WAT 8477 ATOM 63589 O WAT 8478 100.623 37.267 65.547 1.00 0.00 O ATOM 63590 H1 WAT 8478 99.903 37.253 64.916 1.00 0.00 H ATOM 63591 H2 WAT 8478 100.394 36.593 66.187 1.00 0.00 H TER 63593 WAT 8478 ATOM 63593 O WAT 8479 62.326 52.157 54.774 1.00 0.00 O ATOM 63594 H1 WAT 8479 63.016 52.757 55.058 1.00 0.00 H ATOM 63595 H2 WAT 8479 62.762 51.307 54.704 1.00 0.00 H TER 63597 WAT 8479 ATOM 63597 O WAT 8480 43.223 94.883 134.063 1.00 0.00 O ATOM 63598 H1 WAT 8480 43.442 95.812 133.992 1.00 0.00 H ATOM 63599 H2 WAT 8480 42.267 94.859 134.024 1.00 0.00 H TER 63601 WAT 8480 ATOM 63601 O WAT 8481 64.797 28.304 67.593 1.00 0.00 O ATOM 63602 H1 WAT 8481 64.898 27.442 67.998 1.00 0.00 H ATOM 63603 H2 WAT 8481 65.023 28.164 66.673 1.00 0.00 H TER 63605 WAT 8481 ATOM 63605 O WAT 8482 121.051 40.140 136.776 1.00 0.00 O ATOM 63606 H1 WAT 8482 121.287 40.564 135.951 1.00 0.00 H ATOM 63607 H2 WAT 8482 120.290 39.601 136.559 1.00 0.00 H TER 63609 WAT 8482 ATOM 63609 O WAT 8483 56.351 19.275 136.550 1.00 0.00 O ATOM 63610 H1 WAT 8483 57.076 19.425 137.157 1.00 0.00 H ATOM 63611 H2 WAT 8483 55.583 19.180 137.112 1.00 0.00 H TER 63613 WAT 8483 ATOM 63613 O WAT 8484 120.201 115.632 93.673 1.00 0.00 O ATOM 63614 H1 WAT 8484 121.075 116.009 93.779 1.00 0.00 H ATOM 63615 H2 WAT 8484 119.866 116.026 92.868 1.00 0.00 H TER 63617 WAT 8484 ATOM 63617 O WAT 8485 101.572 78.009 70.840 1.00 0.00 O ATOM 63618 H1 WAT 8485 101.126 77.749 70.035 1.00 0.00 H ATOM 63619 H2 WAT 8485 102.496 78.062 70.595 1.00 0.00 H TER 63621 WAT 8485 ATOM 63621 O WAT 8486 105.825 5.766 4.197 1.00 0.00 O ATOM 63622 H1 WAT 8486 105.686 6.426 4.876 1.00 0.00 H ATOM 63623 H2 WAT 8486 106.758 5.826 3.991 1.00 0.00 H TER 63625 WAT 8486 ATOM 63625 O WAT 8487 38.543 89.397 5.151 1.00 0.00 O ATOM 63626 H1 WAT 8487 38.800 90.145 5.689 1.00 0.00 H ATOM 63627 H2 WAT 8487 38.554 88.653 5.753 1.00 0.00 H TER 63629 WAT 8487 ATOM 63629 O WAT 8488 77.966 67.441 56.911 1.00 0.00 O ATOM 63630 H1 WAT 8488 77.867 68.384 56.782 1.00 0.00 H ATOM 63631 H2 WAT 8488 78.714 67.202 56.364 1.00 0.00 H TER 63633 WAT 8488 ATOM 63633 O WAT 8489 39.932 114.407 62.101 1.00 0.00 O ATOM 63634 H1 WAT 8489 40.081 115.334 61.915 1.00 0.00 H ATOM 63635 H2 WAT 8489 39.105 114.204 61.664 1.00 0.00 H TER 63637 WAT 8489 ATOM 63637 O WAT 8490 14.673 47.819 75.045 1.00 0.00 O ATOM 63638 H1 WAT 8490 14.204 48.296 74.360 1.00 0.00 H ATOM 63639 H2 WAT 8490 15.591 47.854 74.775 1.00 0.00 H TER 63641 WAT 8490 ATOM 63641 O WAT 8491 57.761 67.713 20.629 1.00 0.00 O ATOM 63642 H1 WAT 8491 57.500 66.840 20.333 1.00 0.00 H ATOM 63643 H2 WAT 8491 57.250 67.859 21.425 1.00 0.00 H TER 63645 WAT 8491 ATOM 63645 O WAT 8492 41.985 48.151 1.946 1.00 0.00 O ATOM 63646 H1 WAT 8492 42.934 48.027 1.941 1.00 0.00 H ATOM 63647 H2 WAT 8492 41.685 47.670 2.717 1.00 0.00 H TER 63649 WAT 8492 ATOM 63649 O WAT 8493 117.063 119.959 142.240 1.00 0.00 O ATOM 63650 H1 WAT 8493 117.527 119.125 142.322 1.00 0.00 H ATOM 63651 H2 WAT 8493 116.754 119.972 141.334 1.00 0.00 H TER 63653 WAT 8493 ATOM 63653 O WAT 8494 27.915 97.056 112.053 1.00 0.00 O ATOM 63654 H1 WAT 8494 27.639 97.677 111.379 1.00 0.00 H ATOM 63655 H2 WAT 8494 28.762 97.386 112.351 1.00 0.00 H TER 63657 WAT 8494 ATOM 63657 O WAT 8495 42.759 29.768 105.803 1.00 0.00 O ATOM 63658 H1 WAT 8495 43.021 29.861 104.887 1.00 0.00 H ATOM 63659 H2 WAT 8495 42.683 28.823 105.935 1.00 0.00 H TER 63661 WAT 8495 ATOM 63661 O WAT 8496 13.865 137.198 92.632 1.00 0.00 O ATOM 63662 H1 WAT 8496 14.728 137.117 93.038 1.00 0.00 H ATOM 63663 H2 WAT 8496 13.637 138.122 92.736 1.00 0.00 H TER 63665 WAT 8496 ATOM 63665 O WAT 8497 89.704 123.938 101.322 1.00 0.00 O ATOM 63666 H1 WAT 8497 89.808 123.709 102.245 1.00 0.00 H ATOM 63667 H2 WAT 8497 89.543 123.102 100.884 1.00 0.00 H TER 63669 WAT 8497 ATOM 63669 O WAT 8498 53.266 37.805 109.609 1.00 0.00 O ATOM 63670 H1 WAT 8498 54.132 37.745 109.206 1.00 0.00 H ATOM 63671 H2 WAT 8498 53.411 38.299 110.416 1.00 0.00 H TER 63673 WAT 8498 ATOM 63673 O WAT 8499 26.554 59.850 154.906 1.00 0.00 O ATOM 63674 H1 WAT 8499 26.607 59.711 153.961 1.00 0.00 H ATOM 63675 H2 WAT 8499 25.677 60.208 155.047 1.00 0.00 H TER 63677 WAT 8499 ATOM 63677 O WAT 8500 81.582 51.811 92.721 1.00 0.00 O ATOM 63678 H1 WAT 8500 81.977 51.260 93.396 1.00 0.00 H ATOM 63679 H2 WAT 8500 81.150 51.193 92.131 1.00 0.00 H TER 63681 WAT 8500 ATOM 63681 O WAT 8501 103.610 96.075 97.382 1.00 0.00 O ATOM 63682 H1 WAT 8501 103.487 95.633 96.542 1.00 0.00 H ATOM 63683 H2 WAT 8501 103.080 95.569 97.998 1.00 0.00 H TER 63685 WAT 8501 ATOM 63685 O WAT 8502 6.974 145.372 141.538 1.00 0.00 O ATOM 63686 H1 WAT 8502 6.360 145.478 140.811 1.00 0.00 H ATOM 63687 H2 WAT 8502 6.520 144.796 142.153 1.00 0.00 H TER 63689 WAT 8502 ATOM 63689 O WAT 8503 129.659 26.216 103.407 1.00 0.00 O ATOM 63690 H1 WAT 8503 129.024 26.291 104.119 1.00 0.00 H ATOM 63691 H2 WAT 8503 129.442 26.937 102.816 1.00 0.00 H TER 63693 WAT 8503 ATOM 63693 O WAT 8504 19.385 138.575 88.798 1.00 0.00 O ATOM 63694 H1 WAT 8504 19.789 138.931 88.006 1.00 0.00 H ATOM 63695 H2 WAT 8504 18.683 138.010 88.475 1.00 0.00 H TER 63697 WAT 8504 ATOM 63697 O WAT 8505 40.725 87.243 65.725 1.00 0.00 O ATOM 63698 H1 WAT 8505 40.427 87.570 66.574 1.00 0.00 H ATOM 63699 H2 WAT 8505 40.245 87.768 65.084 1.00 0.00 H TER 63701 WAT 8505 ATOM 63701 O WAT 8506 21.156 111.047 150.951 1.00 0.00 O ATOM 63702 H1 WAT 8506 21.157 111.970 151.204 1.00 0.00 H ATOM 63703 H2 WAT 8506 21.543 110.593 151.700 1.00 0.00 H TER 63705 WAT 8506 ATOM 63705 O WAT 8507 7.471 26.786 12.288 1.00 0.00 O ATOM 63706 H1 WAT 8507 7.970 26.068 12.676 1.00 0.00 H ATOM 63707 H2 WAT 8507 6.559 26.498 12.337 1.00 0.00 H TER 63709 WAT 8507 ATOM 63709 O WAT 8508 113.667 45.804 123.157 1.00 0.00 O ATOM 63710 H1 WAT 8508 113.405 46.723 123.217 1.00 0.00 H ATOM 63711 H2 WAT 8508 114.274 45.679 123.887 1.00 0.00 H TER 63713 WAT 8508 ATOM 63713 O WAT 8509 67.484 18.166 92.950 1.00 0.00 O ATOM 63714 H1 WAT 8509 67.656 18.867 92.321 1.00 0.00 H ATOM 63715 H2 WAT 8509 66.605 17.858 92.730 1.00 0.00 H TER 63717 WAT 8509 ATOM 63717 O WAT 8510 31.212 106.569 137.985 1.00 0.00 O ATOM 63718 H1 WAT 8510 31.758 105.796 137.846 1.00 0.00 H ATOM 63719 H2 WAT 8510 31.503 106.920 138.826 1.00 0.00 H TER 63721 WAT 8510 ATOM 63721 O WAT 8511 64.551 132.186 63.538 1.00 0.00 O ATOM 63722 H1 WAT 8511 64.551 132.936 62.943 1.00 0.00 H ATOM 63723 H2 WAT 8511 64.448 131.426 62.965 1.00 0.00 H TER 63725 WAT 8511 ATOM 63725 O WAT 8512 119.432 72.269 103.280 1.00 0.00 O ATOM 63726 H1 WAT 8512 120.202 72.425 102.733 1.00 0.00 H ATOM 63727 H2 WAT 8512 119.578 72.807 104.058 1.00 0.00 H TER 63729 WAT 8512 ATOM 63729 O WAT 8513 52.602 93.345 10.093 1.00 0.00 O ATOM 63730 H1 WAT 8513 53.125 93.802 9.434 1.00 0.00 H ATOM 63731 H2 WAT 8513 52.211 92.610 9.622 1.00 0.00 H TER 63733 WAT 8513 ATOM 63733 O WAT 8514 129.920 112.827 2.574 1.00 0.00 O ATOM 63734 H1 WAT 8514 130.492 112.066 2.478 1.00 0.00 H ATOM 63735 H2 WAT 8514 129.915 113.234 1.707 1.00 0.00 H TER 63737 WAT 8514 ATOM 63737 O WAT 8515 92.571 126.451 104.064 1.00 0.00 O ATOM 63738 H1 WAT 8515 92.671 127.267 104.554 1.00 0.00 H ATOM 63739 H2 WAT 8515 91.638 126.245 104.130 1.00 0.00 H TER 63741 WAT 8515 ATOM 63741 O WAT 8516 83.923 144.904 93.314 1.00 0.00 O ATOM 63742 H1 WAT 8516 84.020 144.638 94.228 1.00 0.00 H ATOM 63743 H2 WAT 8516 83.086 144.526 93.042 1.00 0.00 H TER 63745 WAT 8516 ATOM 63745 O WAT 8517 95.361 128.669 74.352 1.00 0.00 O ATOM 63746 H1 WAT 8517 95.188 127.910 74.909 1.00 0.00 H ATOM 63747 H2 WAT 8517 95.786 128.304 73.575 1.00 0.00 H TER 63749 WAT 8517 ATOM 63749 O WAT 8518 87.570 61.718 71.823 1.00 0.00 O ATOM 63750 H1 WAT 8518 86.813 62.226 71.531 1.00 0.00 H ATOM 63751 H2 WAT 8518 87.286 60.806 71.756 1.00 0.00 H TER 63753 WAT 8518 ATOM 63753 O WAT 8519 119.803 109.718 93.431 1.00 0.00 O ATOM 63754 H1 WAT 8519 119.770 110.674 93.382 1.00 0.00 H ATOM 63755 H2 WAT 8519 118.965 109.431 93.067 1.00 0.00 H TER 63757 WAT 8519 ATOM 63757 O WAT 8520 137.459 41.256 19.473 1.00 0.00 O ATOM 63758 H1 WAT 8520 136.816 41.965 19.469 1.00 0.00 H ATOM 63759 H2 WAT 8520 138.278 41.673 19.206 1.00 0.00 H TER 63761 WAT 8520 ATOM 63761 O WAT 8521 139.954 87.962 75.264 1.00 0.00 O ATOM 63762 H1 WAT 8521 140.348 87.672 74.441 1.00 0.00 H ATOM 63763 H2 WAT 8521 139.061 88.212 75.026 1.00 0.00 H TER 63765 WAT 8521 ATOM 63765 O WAT 8522 19.405 64.512 134.778 1.00 0.00 O ATOM 63766 H1 WAT 8522 20.341 64.671 134.896 1.00 0.00 H ATOM 63767 H2 WAT 8522 18.990 65.344 135.004 1.00 0.00 H TER 63769 WAT 8522 ATOM 63769 O WAT 8523 134.680 53.817 110.166 1.00 0.00 O ATOM 63770 H1 WAT 8523 134.428 52.940 109.878 1.00 0.00 H ATOM 63771 H2 WAT 8523 134.892 54.283 109.357 1.00 0.00 H TER 63773 WAT 8523 ATOM 63773 O WAT 8524 58.593 144.871 128.007 1.00 0.00 O ATOM 63774 H1 WAT 8524 58.660 145.825 128.035 1.00 0.00 H ATOM 63775 H2 WAT 8524 57.664 144.699 127.855 1.00 0.00 H TER 63777 WAT 8524 ATOM 63777 O WAT 8525 81.513 51.799 158.676 1.00 0.00 O ATOM 63778 H1 WAT 8525 82.211 52.442 158.552 1.00 0.00 H ATOM 63779 H2 WAT 8525 80.897 51.973 157.965 1.00 0.00 H TER 63781 WAT 8525 ATOM 63781 O WAT 8526 92.540 98.456 152.900 1.00 0.00 O ATOM 63782 H1 WAT 8526 92.153 97.848 152.270 1.00 0.00 H ATOM 63783 H2 WAT 8526 92.168 98.197 153.743 1.00 0.00 H TER 63785 WAT 8526 ATOM 63785 O WAT 8527 128.212 116.859 9.558 1.00 0.00 O ATOM 63786 H1 WAT 8527 128.230 117.814 9.630 1.00 0.00 H ATOM 63787 H2 WAT 8527 128.863 116.559 10.192 1.00 0.00 H TER 63789 WAT 8527 ATOM 63789 O WAT 8528 11.843 62.330 7.891 1.00 0.00 O ATOM 63790 H1 WAT 8528 12.709 62.285 7.485 1.00 0.00 H ATOM 63791 H2 WAT 8528 12.021 62.382 8.830 1.00 0.00 H TER 63793 WAT 8528 ATOM 63793 O WAT 8529 22.978 92.644 94.391 1.00 0.00 O ATOM 63794 H1 WAT 8529 23.029 92.265 93.514 1.00 0.00 H ATOM 63795 H2 WAT 8529 23.781 92.355 94.824 1.00 0.00 H TER 63797 WAT 8529 ATOM 63797 O WAT 8530 142.430 48.037 67.690 1.00 0.00 O ATOM 63798 H1 WAT 8530 143.180 48.473 68.095 1.00 0.00 H ATOM 63799 H2 WAT 8530 142.815 47.328 67.175 1.00 0.00 H TER 63801 WAT 8530 ATOM 63801 O WAT 8531 55.929 95.699 75.370 1.00 0.00 O ATOM 63802 H1 WAT 8531 55.600 94.921 74.920 1.00 0.00 H ATOM 63803 H2 WAT 8531 55.272 95.883 76.042 1.00 0.00 H TER 63805 WAT 8531 ATOM 63805 O WAT 8532 132.817 26.337 109.498 1.00 0.00 O ATOM 63806 H1 WAT 8532 132.044 25.907 109.133 1.00 0.00 H ATOM 63807 H2 WAT 8532 133.395 25.616 109.751 1.00 0.00 H TER 63809 WAT 8532 ATOM 63809 O WAT 8533 67.297 44.015 95.788 1.00 0.00 O ATOM 63810 H1 WAT 8533 66.465 44.178 95.342 1.00 0.00 H ATOM 63811 H2 WAT 8533 67.802 43.489 95.167 1.00 0.00 H TER 63813 WAT 8533 ATOM 63813 O WAT 8534 143.744 54.073 157.505 1.00 0.00 O ATOM 63814 H1 WAT 8534 143.134 54.782 157.304 1.00 0.00 H ATOM 63815 H2 WAT 8534 144.125 54.316 158.349 1.00 0.00 H TER 63817 WAT 8534 ATOM 63817 O WAT 8535 38.808 117.373 102.534 1.00 0.00 O ATOM 63818 H1 WAT 8535 38.615 117.588 103.447 1.00 0.00 H ATOM 63819 H2 WAT 8535 38.026 116.916 102.225 1.00 0.00 H TER 63821 WAT 8535 ATOM 63821 O WAT 8536 143.943 84.390 144.413 1.00 0.00 O ATOM 63822 H1 WAT 8536 143.524 83.558 144.632 1.00 0.00 H ATOM 63823 H2 WAT 8536 143.231 85.030 144.439 1.00 0.00 H TER 63825 WAT 8536 ATOM 63825 O WAT 8537 90.590 23.137 63.951 1.00 0.00 O ATOM 63826 H1 WAT 8537 90.966 23.890 63.495 1.00 0.00 H ATOM 63827 H2 WAT 8537 90.452 22.485 63.264 1.00 0.00 H TER 63829 WAT 8537 ATOM 63829 O WAT 8538 43.016 142.167 98.732 1.00 0.00 O ATOM 63830 H1 WAT 8538 42.111 141.898 98.891 1.00 0.00 H ATOM 63831 H2 WAT 8538 43.073 142.266 97.782 1.00 0.00 H TER 63833 WAT 8538 ATOM 63833 O WAT 8539 10.947 141.105 56.751 1.00 0.00 O ATOM 63834 H1 WAT 8539 10.993 140.555 57.533 1.00 0.00 H ATOM 63835 H2 WAT 8539 10.757 140.493 56.039 1.00 0.00 H TER 63837 WAT 8539 ATOM 63837 O WAT 8540 64.757 20.793 105.187 1.00 0.00 O ATOM 63838 H1 WAT 8540 64.579 19.904 104.884 1.00 0.00 H ATOM 63839 H2 WAT 8540 64.159 20.920 105.924 1.00 0.00 H TER 63841 WAT 8540 ATOM 63841 O WAT 8541 112.398 19.895 148.129 1.00 0.00 O ATOM 63842 H1 WAT 8541 112.455 18.953 148.291 1.00 0.00 H ATOM 63843 H2 WAT 8541 113.147 20.086 147.564 1.00 0.00 H TER 63845 WAT 8541 ATOM 63845 O WAT 8542 143.681 25.768 19.166 1.00 0.00 O ATOM 63846 H1 WAT 8542 143.720 25.842 20.119 1.00 0.00 H ATOM 63847 H2 WAT 8542 143.747 26.670 18.852 1.00 0.00 H TER 63849 WAT 8542 ATOM 63849 O WAT 8543 57.046 132.498 71.906 1.00 0.00 O ATOM 63850 H1 WAT 8543 56.696 132.639 72.786 1.00 0.00 H ATOM 63851 H2 WAT 8543 57.195 133.380 71.564 1.00 0.00 H TER 63853 WAT 8543 ATOM 63853 O WAT 8544 142.592 102.706 68.565 1.00 0.00 O ATOM 63854 H1 WAT 8544 142.591 101.974 67.948 1.00 0.00 H ATOM 63855 H2 WAT 8544 142.508 102.295 69.425 1.00 0.00 H TER 63857 WAT 8544 ATOM 63857 O WAT 8545 85.587 48.528 85.977 1.00 0.00 O ATOM 63858 H1 WAT 8545 86.168 48.902 86.640 1.00 0.00 H ATOM 63859 H2 WAT 8545 85.271 47.713 86.367 1.00 0.00 H TER 63861 WAT 8545 ATOM 63861 O WAT 8546 58.392 128.800 120.697 1.00 0.00 O ATOM 63862 H1 WAT 8546 59.199 128.712 120.189 1.00 0.00 H ATOM 63863 H2 WAT 8546 58.014 127.921 120.700 1.00 0.00 H TER 63865 WAT 8546 ATOM 63865 O WAT 8547 95.393 34.054 141.939 1.00 0.00 O ATOM 63866 H1 WAT 8547 95.124 33.805 142.823 1.00 0.00 H ATOM 63867 H2 WAT 8547 94.771 33.606 141.365 1.00 0.00 H TER 63869 WAT 8547 ATOM 63869 O WAT 8548 85.620 120.323 105.780 1.00 0.00 O ATOM 63870 H1 WAT 8548 85.759 120.430 104.839 1.00 0.00 H ATOM 63871 H2 WAT 8548 86.226 119.627 106.034 1.00 0.00 H TER 63873 WAT 8548 ATOM 63873 O WAT 8549 52.720 76.994 127.967 1.00 0.00 O ATOM 63874 H1 WAT 8549 52.837 77.934 127.829 1.00 0.00 H ATOM 63875 H2 WAT 8549 52.178 76.933 128.754 1.00 0.00 H TER 63877 WAT 8549 ATOM 63877 O WAT 8550 5.845 11.429 91.582 1.00 0.00 O ATOM 63878 H1 WAT 8550 5.902 12.364 91.777 1.00 0.00 H ATOM 63879 H2 WAT 8550 5.244 11.375 90.839 1.00 0.00 H TER 63881 WAT 8550 ATOM 63881 O WAT 8551 80.959 67.417 1.555 1.00 0.00 O ATOM 63882 H1 WAT 8551 80.502 68.048 0.999 1.00 0.00 H ATOM 63883 H2 WAT 8551 80.922 67.800 2.432 1.00 0.00 H TER 63885 WAT 8551 ATOM 63885 O WAT 8552 137.428 13.061 77.781 1.00 0.00 O ATOM 63886 H1 WAT 8552 136.822 12.322 77.719 1.00 0.00 H ATOM 63887 H2 WAT 8552 138.112 12.760 78.379 1.00 0.00 H TER 63889 WAT 8552 ATOM 63889 O WAT 8553 64.944 139.232 62.757 1.00 0.00 O ATOM 63890 H1 WAT 8553 64.359 138.525 62.484 1.00 0.00 H ATOM 63891 H2 WAT 8553 65.773 138.795 62.950 1.00 0.00 H TER 63893 WAT 8553 ATOM 63893 O WAT 8554 60.289 12.008 97.609 1.00 0.00 O ATOM 63894 H1 WAT 8554 60.661 11.127 97.574 1.00 0.00 H ATOM 63895 H2 WAT 8554 60.153 12.247 96.692 1.00 0.00 H TER 63897 WAT 8554 ATOM 63897 O WAT 8555 44.371 54.355 22.842 1.00 0.00 O ATOM 63898 H1 WAT 8555 44.322 54.627 23.758 1.00 0.00 H ATOM 63899 H2 WAT 8555 44.955 54.995 22.433 1.00 0.00 H TER 63901 WAT 8555 ATOM 63901 O WAT 8556 15.242 58.007 59.765 1.00 0.00 O ATOM 63902 H1 WAT 8556 15.218 58.539 60.561 1.00 0.00 H ATOM 63903 H2 WAT 8556 16.050 57.500 59.841 1.00 0.00 H TER 63905 WAT 8556 ATOM 63905 O WAT 8557 142.463 29.622 65.187 1.00 0.00 O ATOM 63906 H1 WAT 8557 143.200 29.012 65.209 1.00 0.00 H ATOM 63907 H2 WAT 8557 141.857 29.243 64.550 1.00 0.00 H TER 63909 WAT 8557 ATOM 63909 O WAT 8558 52.314 19.195 5.858 1.00 0.00 O ATOM 63910 H1 WAT 8558 52.936 19.143 5.133 1.00 0.00 H ATOM 63911 H2 WAT 8558 52.127 18.283 6.080 1.00 0.00 H TER 63913 WAT 8558 ATOM 63913 O WAT 8559 46.719 16.939 65.517 1.00 0.00 O ATOM 63914 H1 WAT 8559 47.515 17.301 65.127 1.00 0.00 H ATOM 63915 H2 WAT 8559 46.462 17.581 66.178 1.00 0.00 H TER 63917 WAT 8559 ATOM 63917 O WAT 8560 99.363 25.192 89.048 1.00 0.00 O ATOM 63918 H1 WAT 8560 98.470 24.916 88.844 1.00 0.00 H ATOM 63919 H2 WAT 8560 99.393 26.114 88.793 1.00 0.00 H TER 63921 WAT 8560 ATOM 63921 O WAT 8561 121.376 36.937 8.815 1.00 0.00 O ATOM 63922 H1 WAT 8561 121.639 37.662 8.248 1.00 0.00 H ATOM 63923 H2 WAT 8561 120.792 36.408 8.272 1.00 0.00 H TER 63925 WAT 8561 ATOM 63925 O WAT 8562 18.214 87.704 128.448 1.00 0.00 O ATOM 63926 H1 WAT 8562 18.731 88.290 127.896 1.00 0.00 H ATOM 63927 H2 WAT 8562 18.423 86.826 128.127 1.00 0.00 H TER 63929 WAT 8562 ATOM 63929 O WAT 8563 95.007 63.733 154.801 1.00 0.00 O ATOM 63930 H1 WAT 8563 95.652 63.366 154.197 1.00 0.00 H ATOM 63931 H2 WAT 8563 94.177 63.676 154.328 1.00 0.00 H TER 63933 WAT 8563 ATOM 63933 O WAT 8564 122.303 133.461 140.872 1.00 0.00 O ATOM 63934 H1 WAT 8564 122.139 134.310 140.462 1.00 0.00 H ATOM 63935 H2 WAT 8564 121.933 132.825 140.259 1.00 0.00 H TER 63937 WAT 8564 ATOM 63937 O WAT 8565 140.897 8.699 104.174 1.00 0.00 O ATOM 63938 H1 WAT 8565 140.775 9.071 103.300 1.00 0.00 H ATOM 63939 H2 WAT 8565 140.009 8.532 104.489 1.00 0.00 H TER 63941 WAT 8565 ATOM 63941 O WAT 8566 53.059 109.747 65.934 1.00 0.00 O ATOM 63942 H1 WAT 8566 53.609 109.307 65.285 1.00 0.00 H ATOM 63943 H2 WAT 8566 52.238 109.255 65.924 1.00 0.00 H TER 63945 WAT 8566 ATOM 63945 O WAT 8567 28.712 9.244 149.142 1.00 0.00 O ATOM 63946 H1 WAT 8567 27.961 9.716 148.782 1.00 0.00 H ATOM 63947 H2 WAT 8567 28.684 9.429 150.081 1.00 0.00 H TER 63949 WAT 8567 ATOM 63949 O WAT 8568 20.565 143.520 101.013 1.00 0.00 O ATOM 63950 H1 WAT 8568 19.991 143.933 100.367 1.00 0.00 H ATOM 63951 H2 WAT 8568 20.493 144.079 101.787 1.00 0.00 H TER 63953 WAT 8568 ATOM 63953 O WAT 8569 2.407 21.496 146.474 1.00 0.00 O ATOM 63954 H1 WAT 8569 2.129 21.970 145.690 1.00 0.00 H ATOM 63955 H2 WAT 8569 3.095 20.907 146.167 1.00 0.00 H TER 63957 WAT 8569 ATOM 63957 O WAT 8570 108.636 103.028 122.779 1.00 0.00 O ATOM 63958 H1 WAT 8570 108.261 103.276 123.624 1.00 0.00 H ATOM 63959 H2 WAT 8570 109.572 102.928 122.952 1.00 0.00 H TER 63961 WAT 8570 ATOM 63961 O WAT 8571 132.901 56.798 71.117 1.00 0.00 O ATOM 63962 H1 WAT 8571 132.123 57.000 70.597 1.00 0.00 H ATOM 63963 H2 WAT 8571 133.615 56.776 70.481 1.00 0.00 H TER 63965 WAT 8571 ATOM 63965 O WAT 8572 139.898 49.687 77.036 1.00 0.00 O ATOM 63966 H1 WAT 8572 139.433 48.906 77.337 1.00 0.00 H ATOM 63967 H2 WAT 8572 139.628 49.790 76.123 1.00 0.00 H TER 63969 WAT 8572 ATOM 63969 O WAT 8573 2.705 113.292 131.055 1.00 0.00 O ATOM 63970 H1 WAT 8573 2.306 113.946 130.482 1.00 0.00 H ATOM 63971 H2 WAT 8573 1.966 112.783 131.388 1.00 0.00 H TER 63973 WAT 8573 ATOM 63973 O WAT 8574 127.641 18.916 102.686 1.00 0.00 O ATOM 63974 H1 WAT 8574 127.479 19.671 103.250 1.00 0.00 H ATOM 63975 H2 WAT 8574 127.693 18.174 103.288 1.00 0.00 H TER 63977 WAT 8574 ATOM 63977 O WAT 8575 97.314 124.963 139.963 1.00 0.00 O ATOM 63978 H1 WAT 8575 96.948 125.227 140.807 1.00 0.00 H ATOM 63979 H2 WAT 8575 96.605 124.487 139.531 1.00 0.00 H TER 63981 WAT 8575 ATOM 63981 O WAT 8576 126.556 86.514 12.712 1.00 0.00 O ATOM 63982 H1 WAT 8576 126.967 87.205 13.231 1.00 0.00 H ATOM 63983 H2 WAT 8576 127.236 86.242 12.095 1.00 0.00 H TER 63985 WAT 8576 ATOM 63985 O WAT 8577 17.131 100.316 151.976 1.00 0.00 O ATOM 63986 H1 WAT 8577 18.035 100.004 152.010 1.00 0.00 H ATOM 63987 H2 WAT 8577 16.691 99.852 152.689 1.00 0.00 H TER 63989 WAT 8577 ATOM 63989 O WAT 8578 36.299 111.089 55.222 1.00 0.00 O ATOM 63990 H1 WAT 8578 37.123 111.555 55.082 1.00 0.00 H ATOM 63991 H2 WAT 8578 35.963 111.439 56.047 1.00 0.00 H TER 63993 WAT 8578 ATOM 63993 O WAT 8579 76.318 26.750 6.032 1.00 0.00 O ATOM 63994 H1 WAT 8579 75.969 26.179 6.716 1.00 0.00 H ATOM 63995 H2 WAT 8579 76.234 26.240 5.227 1.00 0.00 H TER 63997 WAT 8579 ATOM 63997 O WAT 8580 96.957 110.188 15.031 1.00 0.00 O ATOM 63998 H1 WAT 8580 96.595 110.066 15.909 1.00 0.00 H ATOM 63999 H2 WAT 8580 97.643 109.525 14.960 1.00 0.00 H TER 64001 WAT 8580 ATOM 64001 O WAT 8581 120.003 102.637 82.318 1.00 0.00 O ATOM 64002 H1 WAT 8581 120.593 101.960 81.988 1.00 0.00 H ATOM 64003 H2 WAT 8581 120.342 102.847 83.188 1.00 0.00 H TER 64005 WAT 8581 ATOM 64005 O WAT 8582 103.077 94.157 10.087 1.00 0.00 O ATOM 64006 H1 WAT 8582 102.541 93.426 10.394 1.00 0.00 H ATOM 64007 H2 WAT 8582 103.759 94.251 10.752 1.00 0.00 H TER 64009 WAT 8582 ATOM 64009 O WAT 8583 32.757 26.076 103.667 1.00 0.00 O ATOM 64010 H1 WAT 8583 33.398 26.675 104.050 1.00 0.00 H ATOM 64011 H2 WAT 8583 32.224 25.789 104.409 1.00 0.00 H TER 64013 WAT 8583 ATOM 64013 O WAT 8584 104.714 102.076 16.496 1.00 0.00 O ATOM 64014 H1 WAT 8584 104.401 101.193 16.696 1.00 0.00 H ATOM 64015 H2 WAT 8584 104.409 102.242 15.604 1.00 0.00 H TER 64017 WAT 8584 ATOM 64017 O WAT 8585 5.178 95.211 87.731 1.00 0.00 O ATOM 64018 H1 WAT 8585 4.683 94.819 87.011 1.00 0.00 H ATOM 64019 H2 WAT 8585 5.298 96.124 87.470 1.00 0.00 H TER 64021 WAT 8585 ATOM 64021 O WAT 8586 49.356 129.274 155.410 1.00 0.00 O ATOM 64022 H1 WAT 8586 49.120 129.927 154.751 1.00 0.00 H ATOM 64023 H2 WAT 8586 48.811 128.516 155.202 1.00 0.00 H TER 64025 WAT 8586 ATOM 64025 O WAT 8587 2.581 65.911 79.097 1.00 0.00 O ATOM 64026 H1 WAT 8587 2.845 66.312 78.269 1.00 0.00 H ATOM 64027 H2 WAT 8587 3.305 66.098 79.695 1.00 0.00 H TER 64029 WAT 8587 ATOM 64029 O WAT 8588 78.801 68.048 120.184 1.00 0.00 O ATOM 64030 H1 WAT 8588 78.829 67.746 119.276 1.00 0.00 H ATOM 64031 H2 WAT 8588 78.497 67.288 120.680 1.00 0.00 H TER 64033 WAT 8588 ATOM 64033 O WAT 8589 28.455 143.198 151.994 1.00 0.00 O ATOM 64034 H1 WAT 8589 27.739 143.493 152.556 1.00 0.00 H ATOM 64035 H2 WAT 8589 28.845 142.464 152.469 1.00 0.00 H TER 64037 WAT 8589 ATOM 64037 O WAT 8590 128.423 35.343 87.641 1.00 0.00 O ATOM 64038 H1 WAT 8590 128.267 35.737 86.783 1.00 0.00 H ATOM 64039 H2 WAT 8590 128.951 35.990 88.109 1.00 0.00 H TER 64041 WAT 8590 ATOM 64041 O WAT 8591 36.553 141.598 152.161 1.00 0.00 O ATOM 64042 H1 WAT 8591 35.709 141.165 152.032 1.00 0.00 H ATOM 64043 H2 WAT 8591 36.533 142.344 151.562 1.00 0.00 H TER 64045 WAT 8591 ATOM 64045 O WAT 8592 24.865 33.065 157.626 1.00 0.00 O ATOM 64046 H1 WAT 8592 24.355 32.675 158.335 1.00 0.00 H ATOM 64047 H2 WAT 8592 25.127 32.322 157.082 1.00 0.00 H TER 64049 WAT 8592 ATOM 64049 O WAT 8593 113.875 114.213 130.383 1.00 0.00 O ATOM 64050 H1 WAT 8593 114.349 114.930 129.962 1.00 0.00 H ATOM 64051 H2 WAT 8593 113.704 114.527 131.270 1.00 0.00 H TER 64053 WAT 8593 ATOM 64053 O WAT 8594 66.807 8.756 136.752 1.00 0.00 O ATOM 64054 H1 WAT 8594 66.035 9.313 136.655 1.00 0.00 H ATOM 64055 H2 WAT 8594 66.571 8.139 137.445 1.00 0.00 H TER 64057 WAT 8594 ATOM 64057 O WAT 8595 120.890 64.396 64.024 1.00 0.00 O ATOM 64058 H1 WAT 8595 120.358 64.985 64.559 1.00 0.00 H ATOM 64059 H2 WAT 8595 120.273 63.735 63.710 1.00 0.00 H TER 64061 WAT 8595 ATOM 64061 O WAT 8596 103.508 110.706 94.026 1.00 0.00 O ATOM 64062 H1 WAT 8596 102.736 110.195 94.269 1.00 0.00 H ATOM 64063 H2 WAT 8596 103.642 111.302 94.763 1.00 0.00 H TER 64065 WAT 8596 ATOM 64065 O WAT 8597 72.509 110.206 152.629 1.00 0.00 O ATOM 64066 H1 WAT 8597 73.418 110.079 152.356 1.00 0.00 H ATOM 64067 H2 WAT 8597 72.276 109.390 153.071 1.00 0.00 H TER 64069 WAT 8597 ATOM 64069 O WAT 8598 130.303 44.199 108.780 1.00 0.00 O ATOM 64070 H1 WAT 8598 130.157 44.911 108.158 1.00 0.00 H ATOM 64071 H2 WAT 8598 130.116 44.585 109.636 1.00 0.00 H TER 64073 WAT 8598 ATOM 64073 O WAT 8599 58.787 32.307 81.960 1.00 0.00 O ATOM 64074 H1 WAT 8599 58.757 32.012 82.870 1.00 0.00 H ATOM 64075 H2 WAT 8599 59.221 31.594 81.491 1.00 0.00 H TER 64077 WAT 8599 ATOM 64077 O WAT 8600 138.871 128.872 0.681 1.00 0.00 O ATOM 64078 H1 WAT 8600 138.283 128.266 1.131 1.00 0.00 H ATOM 64079 H2 WAT 8600 139.739 128.478 0.773 1.00 0.00 H TER 64081 WAT 8600 ATOM 64081 O WAT 8601 144.250 53.564 15.858 1.00 0.00 O ATOM 64082 H1 WAT 8601 144.225 54.380 15.359 1.00 0.00 H ATOM 64083 H2 WAT 8601 143.334 53.291 15.917 1.00 0.00 H TER 64085 WAT 8601 ATOM 64085 O WAT 8602 3.330 17.515 122.278 1.00 0.00 O ATOM 64086 H1 WAT 8602 2.902 18.259 121.856 1.00 0.00 H ATOM 64087 H2 WAT 8602 4.074 17.899 122.743 1.00 0.00 H TER 64089 WAT 8602 ATOM 64089 O WAT 8603 16.104 97.729 93.177 1.00 0.00 O ATOM 64090 H1 WAT 8603 15.317 98.230 92.961 1.00 0.00 H ATOM 64091 H2 WAT 8603 16.756 98.022 92.541 1.00 0.00 H TER 64093 WAT 8603 ATOM 64093 O WAT 8604 109.666 55.660 73.401 1.00 0.00 O ATOM 64094 H1 WAT 8604 109.314 55.713 74.290 1.00 0.00 H ATOM 64095 H2 WAT 8604 109.560 56.543 73.049 1.00 0.00 H TER 64097 WAT 8604 ATOM 64097 O WAT 8605 140.476 90.356 10.184 1.00 0.00 O ATOM 64098 H1 WAT 8605 139.886 90.030 10.864 1.00 0.00 H ATOM 64099 H2 WAT 8605 141.249 89.796 10.248 1.00 0.00 H TER 64101 WAT 8605 ATOM 64101 O WAT 8606 47.022 74.561 14.162 1.00 0.00 O ATOM 64102 H1 WAT 8606 47.263 74.552 15.089 1.00 0.00 H ATOM 64103 H2 WAT 8606 47.725 74.079 13.727 1.00 0.00 H TER 64105 WAT 8606 ATOM 64105 O WAT 8607 8.094 68.506 150.711 1.00 0.00 O ATOM 64106 H1 WAT 8607 7.833 69.416 150.573 1.00 0.00 H ATOM 64107 H2 WAT 8607 7.818 68.310 151.606 1.00 0.00 H TER 64109 WAT 8607 ATOM 64109 O WAT 8608 123.317 9.132 90.770 1.00 0.00 O ATOM 64110 H1 WAT 8608 123.483 8.233 90.486 1.00 0.00 H ATOM 64111 H2 WAT 8608 123.047 9.589 89.973 1.00 0.00 H TER 64113 WAT 8608 ATOM 64113 O WAT 8609 122.621 3.605 3.737 1.00 0.00 O ATOM 64114 H1 WAT 8609 122.856 4.308 3.132 1.00 0.00 H ATOM 64115 H2 WAT 8609 123.410 3.464 4.260 1.00 0.00 H TER 64117 WAT 8609 ATOM 64117 O WAT 8610 82.825 139.148 2.959 1.00 0.00 O ATOM 64118 H1 WAT 8610 81.914 138.868 2.867 1.00 0.00 H ATOM 64119 H2 WAT 8610 83.130 139.267 2.059 1.00 0.00 H TER 64121 WAT 8610 ATOM 64121 O WAT 8611 61.458 64.640 19.293 1.00 0.00 O ATOM 64122 H1 WAT 8611 61.443 63.741 19.621 1.00 0.00 H ATOM 64123 H2 WAT 8611 61.697 65.170 20.053 1.00 0.00 H TER 64125 WAT 8611 ATOM 64125 O WAT 8612 46.753 130.638 89.654 1.00 0.00 O ATOM 64126 H1 WAT 8612 47.385 130.231 90.247 1.00 0.00 H ATOM 64127 H2 WAT 8612 46.239 129.906 89.313 1.00 0.00 H TER 64129 WAT 8612 ATOM 64129 O WAT 8613 66.427 139.820 149.557 1.00 0.00 O ATOM 64130 H1 WAT 8613 65.804 139.317 150.081 1.00 0.00 H ATOM 64131 H2 WAT 8613 66.541 139.303 148.759 1.00 0.00 H TER 64133 WAT 8613 ATOM 64133 O WAT 8614 81.961 102.272 156.189 1.00 0.00 O ATOM 64134 H1 WAT 8614 82.890 102.100 156.031 1.00 0.00 H ATOM 64135 H2 WAT 8614 81.529 101.438 156.009 1.00 0.00 H TER 64137 WAT 8614 ATOM 64137 O WAT 8615 103.978 127.743 110.589 1.00 0.00 O ATOM 64138 H1 WAT 8615 104.795 128.227 110.709 1.00 0.00 H ATOM 64139 H2 WAT 8615 103.305 128.421 110.520 1.00 0.00 H TER 64141 WAT 8615 ATOM 64141 O WAT 8616 20.135 25.608 125.952 1.00 0.00 O ATOM 64142 H1 WAT 8616 20.634 24.822 126.173 1.00 0.00 H ATOM 64143 H2 WAT 8616 20.463 26.276 126.554 1.00 0.00 H TER 64145 WAT 8616 ATOM 64145 O WAT 8617 135.937 28.045 19.444 1.00 0.00 O ATOM 64146 H1 WAT 8617 135.215 27.531 19.807 1.00 0.00 H ATOM 64147 H2 WAT 8617 135.664 28.955 19.558 1.00 0.00 H TER 64149 WAT 8617 ATOM 64149 O WAT 8618 38.265 70.381 0.545 1.00 0.00 O ATOM 64150 H1 WAT 8618 37.559 70.077 -0.026 1.00 0.00 H ATOM 64151 H2 WAT 8618 38.606 71.162 0.108 1.00 0.00 H TER 64153 WAT 8618 ATOM 64153 O WAT 8619 54.123 55.417 139.832 1.00 0.00 O ATOM 64154 H1 WAT 8619 54.790 55.320 140.512 1.00 0.00 H ATOM 64155 H2 WAT 8619 54.227 54.640 139.282 1.00 0.00 H TER 64157 WAT 8619 ATOM 64157 O WAT 8620 95.175 24.044 9.028 1.00 0.00 O ATOM 64158 H1 WAT 8620 96.029 24.376 9.304 1.00 0.00 H ATOM 64159 H2 WAT 8620 94.594 24.236 9.764 1.00 0.00 H TER 64161 WAT 8620 ATOM 64161 O WAT 8621 134.784 139.847 129.434 1.00 0.00 O ATOM 64162 H1 WAT 8621 134.570 139.218 128.744 1.00 0.00 H ATOM 64163 H2 WAT 8621 134.258 139.568 130.183 1.00 0.00 H TER 64165 WAT 8621 ATOM 64165 O WAT 8622 120.758 137.361 14.725 1.00 0.00 O ATOM 64166 H1 WAT 8622 120.857 138.304 14.855 1.00 0.00 H ATOM 64167 H2 WAT 8622 120.148 137.088 15.410 1.00 0.00 H TER 64169 WAT 8622 ATOM 64169 O WAT 8623 43.325 76.249 59.250 1.00 0.00 O ATOM 64170 H1 WAT 8623 43.732 77.064 59.542 1.00 0.00 H ATOM 64171 H2 WAT 8623 43.376 76.285 58.294 1.00 0.00 H TER 64173 WAT 8623 ATOM 64173 O WAT 8624 135.476 90.710 66.480 1.00 0.00 O ATOM 64174 H1 WAT 8624 134.682 90.802 67.007 1.00 0.00 H ATOM 64175 H2 WAT 8624 135.201 90.934 65.591 1.00 0.00 H TER 64177 WAT 8624 ATOM 64177 O WAT 8625 144.594 4.069 76.569 1.00 0.00 O ATOM 64178 H1 WAT 8625 145.065 4.773 77.015 1.00 0.00 H ATOM 64179 H2 WAT 8625 143.670 4.258 76.732 1.00 0.00 H TER 64181 WAT 8625 ATOM 64181 O WAT 8626 115.914 122.824 133.485 1.00 0.00 O ATOM 64182 H1 WAT 8626 115.295 122.250 133.032 1.00 0.00 H ATOM 64183 H2 WAT 8626 115.621 122.820 134.396 1.00 0.00 H TER 64185 WAT 8626 ATOM 64185 O WAT 8627 1.586 128.258 76.715 1.00 0.00 O ATOM 64186 H1 WAT 8627 2.004 127.733 76.032 1.00 0.00 H ATOM 64187 H2 WAT 8627 0.672 127.973 76.710 1.00 0.00 H TER 64189 WAT 8627 ATOM 64189 O WAT 8628 139.872 64.511 91.954 1.00 0.00 O ATOM 64190 H1 WAT 8628 139.546 65.268 91.467 1.00 0.00 H ATOM 64191 H2 WAT 8628 140.480 64.882 92.594 1.00 0.00 H TER 64193 WAT 8628 ATOM 64193 O WAT 8629 141.049 61.558 149.586 1.00 0.00 O ATOM 64194 H1 WAT 8629 140.843 61.306 148.686 1.00 0.00 H ATOM 64195 H2 WAT 8629 141.396 62.447 149.512 1.00 0.00 H TER 64197 WAT 8629 ATOM 64197 O WAT 8630 93.674 130.648 83.201 1.00 0.00 O ATOM 64198 H1 WAT 8630 92.794 130.998 83.337 1.00 0.00 H ATOM 64199 H2 WAT 8630 93.610 130.147 82.387 1.00 0.00 H TER 64201 WAT 8630 ATOM 64201 O WAT 8631 101.329 59.301 157.263 1.00 0.00 O ATOM 64202 H1 WAT 8631 101.078 60.016 157.848 1.00 0.00 H ATOM 64203 H2 WAT 8631 100.675 59.322 156.565 1.00 0.00 H TER 64205 WAT 8631 ATOM 64205 O WAT 8632 81.462 72.347 79.081 1.00 0.00 O ATOM 64206 H1 WAT 8632 80.972 72.066 79.853 1.00 0.00 H ATOM 64207 H2 WAT 8632 80.914 72.085 78.341 1.00 0.00 H TER 64209 WAT 8632 ATOM 64209 O WAT 8633 38.301 92.760 123.122 1.00 0.00 O ATOM 64210 H1 WAT 8633 37.555 92.209 122.886 1.00 0.00 H ATOM 64211 H2 WAT 8633 38.990 92.506 122.507 1.00 0.00 H TER 64213 WAT 8633 ATOM 64213 O WAT 8634 50.535 24.065 79.861 1.00 0.00 O ATOM 64214 H1 WAT 8634 50.030 24.772 79.459 1.00 0.00 H ATOM 64215 H2 WAT 8634 51.415 24.428 79.963 1.00 0.00 H TER 64217 WAT 8634 ATOM 64217 O WAT 8635 5.024 66.988 107.059 1.00 0.00 O ATOM 64218 H1 WAT 8635 4.524 66.178 107.160 1.00 0.00 H ATOM 64219 H2 WAT 8635 4.822 67.286 106.172 1.00 0.00 H TER 64221 WAT 8635 ATOM 64221 O WAT 8636 104.870 83.306 141.620 1.00 0.00 O ATOM 64222 H1 WAT 8636 105.194 82.735 140.923 1.00 0.00 H ATOM 64223 H2 WAT 8636 103.978 83.527 141.353 1.00 0.00 H TER 64225 WAT 8636 ATOM 64225 O WAT 8637 59.844 109.621 78.799 1.00 0.00 O ATOM 64226 H1 WAT 8637 60.267 109.787 79.641 1.00 0.00 H ATOM 64227 H2 WAT 8637 60.037 110.400 78.277 1.00 0.00 H TER 64229 WAT 8637 ATOM 64229 O WAT 8638 52.788 101.796 67.680 1.00 0.00 O ATOM 64230 H1 WAT 8638 53.540 101.212 67.578 1.00 0.00 H ATOM 64231 H2 WAT 8638 53.151 102.588 68.076 1.00 0.00 H TER 64233 WAT 8638 ATOM 64233 O WAT 8639 38.806 79.427 117.733 1.00 0.00 O ATOM 64234 H1 WAT 8639 39.488 78.845 118.068 1.00 0.00 H ATOM 64235 H2 WAT 8639 37.985 78.985 117.951 1.00 0.00 H TER 64237 WAT 8639 ATOM 64237 O WAT 8640 30.275 67.577 75.094 1.00 0.00 O ATOM 64238 H1 WAT 8640 29.480 67.543 74.562 1.00 0.00 H ATOM 64239 H2 WAT 8640 30.786 68.292 74.716 1.00 0.00 H TER 64241 WAT 8640 ATOM 64241 O WAT 8641 124.485 47.459 59.930 1.00 0.00 O ATOM 64242 H1 WAT 8641 123.569 47.450 59.653 1.00 0.00 H ATOM 64243 H2 WAT 8641 124.861 48.222 59.492 1.00 0.00 H TER 64245 WAT 8641 ATOM 64245 O WAT 8642 124.639 43.505 152.286 1.00 0.00 O ATOM 64246 H1 WAT 8642 123.871 43.677 151.741 1.00 0.00 H ATOM 64247 H2 WAT 8642 124.306 43.526 153.183 1.00 0.00 H TER 64249 WAT 8642 ATOM 64249 O WAT 8643 53.590 17.123 142.584 1.00 0.00 O ATOM 64250 H1 WAT 8643 54.416 17.353 143.008 1.00 0.00 H ATOM 64251 H2 WAT 8643 53.843 16.835 141.707 1.00 0.00 H TER 64253 WAT 8643 ATOM 64253 O WAT 8644 65.346 9.650 26.859 1.00 0.00 O ATOM 64254 H1 WAT 8644 65.665 9.311 27.695 1.00 0.00 H ATOM 64255 H2 WAT 8644 66.081 10.154 26.508 1.00 0.00 H TER 64257 WAT 8644 ATOM 64257 O WAT 8645 32.702 43.347 158.475 1.00 0.00 O ATOM 64258 H1 WAT 8645 32.358 42.782 159.166 1.00 0.00 H ATOM 64259 H2 WAT 8645 33.127 42.747 157.863 1.00 0.00 H TER 64261 WAT 8645 ATOM 64261 O WAT 8646 127.910 16.030 100.366 1.00 0.00 O ATOM 64262 H1 WAT 8646 128.541 16.099 101.083 1.00 0.00 H ATOM 64263 H2 WAT 8646 128.152 16.736 99.766 1.00 0.00 H TER 64265 WAT 8646 ATOM 64265 O WAT 8647 71.235 47.003 92.082 1.00 0.00 O ATOM 64266 H1 WAT 8647 71.308 46.143 91.668 1.00 0.00 H ATOM 64267 H2 WAT 8647 71.845 47.557 91.595 1.00 0.00 H TER 64269 WAT 8647 ATOM 64269 O WAT 8648 19.472 82.988 122.542 1.00 0.00 O ATOM 64270 H1 WAT 8648 18.747 82.363 122.543 1.00 0.00 H ATOM 64271 H2 WAT 8648 19.980 82.766 123.323 1.00 0.00 H TER 64273 WAT 8648 ATOM 64273 O WAT 8649 31.545 143.486 133.175 1.00 0.00 O ATOM 64274 H1 WAT 8649 31.162 143.478 132.297 1.00 0.00 H ATOM 64275 H2 WAT 8649 32.489 143.455 133.024 1.00 0.00 H TER 64277 WAT 8649 ATOM 64277 O WAT 8650 141.687 8.979 126.460 1.00 0.00 O ATOM 64278 H1 WAT 8650 141.823 8.165 125.976 1.00 0.00 H ATOM 64279 H2 WAT 8650 140.766 9.194 126.312 1.00 0.00 H TER 64281 WAT 8650 ATOM 64281 O WAT 8651 73.212 3.425 67.779 1.00 0.00 O ATOM 64282 H1 WAT 8651 72.278 3.228 67.853 1.00 0.00 H ATOM 64283 H2 WAT 8651 73.413 3.289 66.853 1.00 0.00 H TER 64285 WAT 8651 ATOM 64285 O WAT 8652 89.169 98.694 136.819 1.00 0.00 O ATOM 64286 H1 WAT 8652 89.351 99.616 137.002 1.00 0.00 H ATOM 64287 H2 WAT 8652 89.711 98.489 136.057 1.00 0.00 H TER 64289 WAT 8652 ATOM 64289 O WAT 8653 32.938 113.510 145.624 1.00 0.00 O ATOM 64290 H1 WAT 8653 32.097 113.365 146.059 1.00 0.00 H ATOM 64291 H2 WAT 8653 33.572 113.042 146.167 1.00 0.00 H TER 64293 WAT 8653 ATOM 64293 O WAT 8654 18.591 15.785 144.816 1.00 0.00 O ATOM 64294 H1 WAT 8654 17.979 15.107 145.103 1.00 0.00 H ATOM 64295 H2 WAT 8654 18.036 16.535 144.604 1.00 0.00 H TER 64297 WAT 8654 ATOM 64297 O WAT 8655 88.729 75.096 147.746 1.00 0.00 O ATOM 64298 H1 WAT 8655 89.376 74.394 147.689 1.00 0.00 H ATOM 64299 H2 WAT 8655 88.883 75.629 146.966 1.00 0.00 H TER 64301 WAT 8655 ATOM 64301 O WAT 8656 75.110 100.689 155.490 1.00 0.00 O ATOM 64302 H1 WAT 8656 75.897 100.908 155.989 1.00 0.00 H ATOM 64303 H2 WAT 8656 74.458 100.470 156.155 1.00 0.00 H TER 64305 WAT 8656 ATOM 64305 O WAT 8657 31.671 104.745 67.440 1.00 0.00 O ATOM 64306 H1 WAT 8657 31.427 104.253 68.224 1.00 0.00 H ATOM 64307 H2 WAT 8657 30.867 104.783 66.921 1.00 0.00 H TER 64309 WAT 8657 ATOM 64309 O WAT 8658 40.616 90.069 148.575 1.00 0.00 O ATOM 64310 H1 WAT 8658 40.101 89.486 149.132 1.00 0.00 H ATOM 64311 H2 WAT 8658 40.742 89.577 147.764 1.00 0.00 H TER 64313 WAT 8658 ATOM 64313 O WAT 8659 11.260 144.663 86.702 1.00 0.00 O ATOM 64314 H1 WAT 8659 10.977 144.245 85.889 1.00 0.00 H ATOM 64315 H2 WAT 8659 11.984 145.232 86.439 1.00 0.00 H TER 64317 WAT 8659 ATOM 64317 O WAT 8660 115.265 34.860 64.031 1.00 0.00 O ATOM 64318 H1 WAT 8660 114.637 35.544 63.798 1.00 0.00 H ATOM 64319 H2 WAT 8660 115.700 34.643 63.206 1.00 0.00 H TER 64321 WAT 8660 ATOM 64321 O WAT 8661 105.615 132.025 2.583 1.00 0.00 O ATOM 64322 H1 WAT 8661 105.875 131.935 1.666 1.00 0.00 H ATOM 64323 H2 WAT 8661 105.935 132.891 2.838 1.00 0.00 H TER 64325 WAT 8661 ATOM 64325 O WAT 8662 139.912 12.028 19.638 1.00 0.00 O ATOM 64326 H1 WAT 8662 139.844 12.874 20.082 1.00 0.00 H ATOM 64327 H2 WAT 8662 140.738 12.077 19.156 1.00 0.00 H TER 64329 WAT 8662 ATOM 64329 O WAT 8663 41.942 126.292 110.256 1.00 0.00 O ATOM 64330 H1 WAT 8663 41.096 126.449 109.837 1.00 0.00 H ATOM 64331 H2 WAT 8663 42.196 125.417 109.961 1.00 0.00 H TER 64333 WAT 8663 ATOM 64333 O WAT 8664 128.839 6.588 109.355 1.00 0.00 O ATOM 64334 H1 WAT 8664 129.682 6.558 108.901 1.00 0.00 H ATOM 64335 H2 WAT 8664 128.509 5.691 109.306 1.00 0.00 H TER 64337 WAT 8664 ATOM 64337 O WAT 8665 21.479 80.450 103.285 1.00 0.00 O ATOM 64338 H1 WAT 8665 22.107 80.062 102.675 1.00 0.00 H ATOM 64339 H2 WAT 8665 20.734 79.849 103.277 1.00 0.00 H TER 64341 WAT 8665 ATOM 64341 O WAT 8666 134.926 58.723 116.517 1.00 0.00 O ATOM 64342 H1 WAT 8666 134.844 59.674 116.449 1.00 0.00 H ATOM 64343 H2 WAT 8666 134.383 58.384 115.806 1.00 0.00 H TER 64345 WAT 8666 ATOM 64345 O WAT 8667 46.841 3.746 4.031 1.00 0.00 O ATOM 64346 H1 WAT 8667 46.279 4.171 4.679 1.00 0.00 H ATOM 64347 H2 WAT 8667 46.430 2.896 3.878 1.00 0.00 H TER 64349 WAT 8667 ATOM 64349 O WAT 8668 27.734 141.781 4.748 1.00 0.00 O ATOM 64350 H1 WAT 8668 27.772 141.727 3.793 1.00 0.00 H ATOM 64351 H2 WAT 8668 27.672 140.871 5.037 1.00 0.00 H TER 64353 WAT 8668 ATOM 64353 O WAT 8669 121.020 128.210 97.912 1.00 0.00 O ATOM 64354 H1 WAT 8669 121.733 127.594 98.082 1.00 0.00 H ATOM 64355 H2 WAT 8669 120.605 127.881 97.115 1.00 0.00 H TER 64357 WAT 8669 ATOM 64357 O WAT 8670 118.591 20.111 25.464 1.00 0.00 O ATOM 64358 H1 WAT 8670 118.131 20.385 24.670 1.00 0.00 H ATOM 64359 H2 WAT 8670 119.205 20.823 25.642 1.00 0.00 H TER 64361 WAT 8670 ATOM 64361 O WAT 8671 107.259 74.754 145.880 1.00 0.00 O ATOM 64362 H1 WAT 8671 106.895 75.639 145.864 1.00 0.00 H ATOM 64363 H2 WAT 8671 107.060 74.429 146.758 1.00 0.00 H TER 64365 WAT 8671 ATOM 64365 O WAT 8672 79.215 113.395 86.537 1.00 0.00 O ATOM 64366 H1 WAT 8672 78.303 113.426 86.247 1.00 0.00 H ATOM 64367 H2 WAT 8672 79.209 113.820 87.394 1.00 0.00 H TER 64369 WAT 8672 ATOM 64369 O WAT 8673 4.955 74.481 140.762 1.00 0.00 O ATOM 64370 H1 WAT 8673 4.412 74.660 139.994 1.00 0.00 H ATOM 64371 H2 WAT 8673 4.573 75.020 141.455 1.00 0.00 H TER 64373 WAT 8673 ATOM 64373 O WAT 8674 97.630 87.068 142.151 1.00 0.00 O ATOM 64374 H1 WAT 8674 97.531 87.600 142.941 1.00 0.00 H ATOM 64375 H2 WAT 8674 96.891 87.322 141.598 1.00 0.00 H TER 64377 WAT 8674 ATOM 64377 O WAT 8675 53.587 47.298 11.691 1.00 0.00 O ATOM 64378 H1 WAT 8675 54.107 48.102 11.696 1.00 0.00 H ATOM 64379 H2 WAT 8675 52.822 47.511 11.157 1.00 0.00 H TER 64381 WAT 8675 ATOM 64381 O WAT 8676 80.794 54.781 96.115 1.00 0.00 O ATOM 64382 H1 WAT 8676 80.624 54.924 95.184 1.00 0.00 H ATOM 64383 H2 WAT 8676 80.533 53.873 96.270 1.00 0.00 H TER 64385 WAT 8676 ATOM 64385 O WAT 8677 51.152 100.524 85.282 1.00 0.00 O ATOM 64386 H1 WAT 8677 51.757 101.076 85.778 1.00 0.00 H ATOM 64387 H2 WAT 8677 51.553 99.655 85.299 1.00 0.00 H TER 64389 WAT 8677 ATOM 64389 O WAT 8678 25.859 66.020 21.579 1.00 0.00 O ATOM 64390 H1 WAT 8678 26.393 66.815 21.590 1.00 0.00 H ATOM 64391 H2 WAT 8678 26.495 65.305 21.569 1.00 0.00 H TER 64393 WAT 8678 ATOM 64393 O WAT 8679 114.036 52.162 114.396 1.00 0.00 O ATOM 64394 H1 WAT 8679 113.234 51.721 114.675 1.00 0.00 H ATOM 64395 H2 WAT 8679 114.651 52.019 115.115 1.00 0.00 H TER 64397 WAT 8679 ATOM 64397 O WAT 8680 42.343 69.912 151.773 1.00 0.00 O ATOM 64398 H1 WAT 8680 41.551 69.744 152.285 1.00 0.00 H ATOM 64399 H2 WAT 8680 42.590 70.808 152.002 1.00 0.00 H TER 64401 WAT 8680 ATOM 64401 O WAT 8681 51.502 35.616 14.066 1.00 0.00 O ATOM 64402 H1 WAT 8681 50.858 36.318 13.981 1.00 0.00 H ATOM 64403 H2 WAT 8681 52.068 35.896 14.785 1.00 0.00 H TER 64405 WAT 8681 ATOM 64405 O WAT 8682 99.275 62.490 151.025 1.00 0.00 O ATOM 64406 H1 WAT 8682 99.782 61.775 151.409 1.00 0.00 H ATOM 64407 H2 WAT 8682 99.932 63.074 150.647 1.00 0.00 H TER 64409 WAT 8682 ATOM 64409 O WAT 8683 133.007 20.233 6.883 1.00 0.00 O ATOM 64410 H1 WAT 8683 133.659 20.903 6.673 1.00 0.00 H ATOM 64411 H2 WAT 8683 132.462 20.633 7.560 1.00 0.00 H TER 64413 WAT 8683 ATOM 64413 O WAT 8684 112.816 0.826 118.920 1.00 0.00 O ATOM 64414 H1 WAT 8684 112.960 0.748 117.977 1.00 0.00 H ATOM 64415 H2 WAT 8684 113.250 1.643 119.162 1.00 0.00 H TER 64417 WAT 8684 ATOM 64417 O WAT 8685 42.281 1.022 82.763 1.00 0.00 O ATOM 64418 H1 WAT 8685 41.472 0.616 82.451 1.00 0.00 H ATOM 64419 H2 WAT 8685 42.038 1.437 83.590 1.00 0.00 H TER 64421 WAT 8685 ATOM 64421 O WAT 8686 116.551 139.544 133.225 1.00 0.00 O ATOM 64422 H1 WAT 8686 116.831 140.262 132.657 1.00 0.00 H ATOM 64423 H2 WAT 8686 115.662 139.780 133.489 1.00 0.00 H TER 64425 WAT 8686 ATOM 64425 O WAT 8687 127.604 97.879 19.894 1.00 0.00 O ATOM 64426 H1 WAT 8687 128.042 98.149 20.702 1.00 0.00 H ATOM 64427 H2 WAT 8687 127.563 98.677 19.367 1.00 0.00 H TER 64429 WAT 8687 ATOM 64429 O WAT 8688 137.169 32.119 2.501 1.00 0.00 O ATOM 64430 H1 WAT 8688 136.707 31.469 3.030 1.00 0.00 H ATOM 64431 H2 WAT 8688 137.760 31.604 1.952 1.00 0.00 H TER 64433 WAT 8688 ATOM 64433 O WAT 8689 107.668 86.655 16.480 1.00 0.00 O ATOM 64434 H1 WAT 8689 106.854 86.482 16.007 1.00 0.00 H ATOM 64435 H2 WAT 8689 107.479 87.430 17.008 1.00 0.00 H TER 64437 WAT 8689 ATOM 64437 O WAT 8690 40.236 34.274 69.128 1.00 0.00 O ATOM 64438 H1 WAT 8690 39.381 34.576 69.435 1.00 0.00 H ATOM 64439 H2 WAT 8690 40.184 34.337 68.175 1.00 0.00 H TER 64441 WAT 8690 ATOM 64441 O WAT 8691 61.738 67.835 158.168 1.00 0.00 O ATOM 64442 H1 WAT 8691 61.179 68.578 158.394 1.00 0.00 H ATOM 64443 H2 WAT 8691 61.770 67.840 157.212 1.00 0.00 H TER 64445 WAT 8691 ATOM 64445 O WAT 8692 27.519 140.611 156.963 1.00 0.00 O ATOM 64446 H1 WAT 8692 28.032 139.892 157.332 1.00 0.00 H ATOM 64447 H2 WAT 8692 27.312 141.168 157.714 1.00 0.00 H TER 64449 WAT 8692 ATOM 64449 O WAT 8693 21.949 142.712 78.876 1.00 0.00 O ATOM 64450 H1 WAT 8693 22.895 142.708 79.020 1.00 0.00 H ATOM 64451 H2 WAT 8693 21.844 142.429 77.967 1.00 0.00 H TER 64453 WAT 8693 ATOM 64453 O WAT 8694 107.652 45.728 17.255 1.00 0.00 O ATOM 64454 H1 WAT 8694 108.542 45.436 17.059 1.00 0.00 H ATOM 64455 H2 WAT 8694 107.092 45.017 16.945 1.00 0.00 H TER 64457 WAT 8694 ATOM 64457 O WAT 8695 63.627 143.608 132.504 1.00 0.00 O ATOM 64458 H1 WAT 8695 64.169 143.400 131.743 1.00 0.00 H ATOM 64459 H2 WAT 8695 64.196 144.135 133.066 1.00 0.00 H TER 64461 WAT 8695 ATOM 64461 O WAT 8696 116.215 95.920 99.049 1.00 0.00 O ATOM 64462 H1 WAT 8696 115.525 95.316 98.774 1.00 0.00 H ATOM 64463 H2 WAT 8696 116.221 96.600 98.375 1.00 0.00 H TER 64465 WAT 8696 ATOM 64465 O WAT 8697 88.991 72.519 119.106 1.00 0.00 O ATOM 64466 H1 WAT 8697 89.386 72.190 118.299 1.00 0.00 H ATOM 64467 H2 WAT 8697 88.049 72.492 118.940 1.00 0.00 H TER 64469 WAT 8697 ATOM 64469 O WAT 8698 58.092 1.677 132.930 1.00 0.00 O ATOM 64470 H1 WAT 8698 58.323 1.930 133.824 1.00 0.00 H ATOM 64471 H2 WAT 8698 57.323 2.209 132.722 1.00 0.00 H TER 64473 WAT 8698 ATOM 64473 O WAT 8699 6.256 18.046 0.372 1.00 0.00 O ATOM 64474 H1 WAT 8699 6.590 18.915 0.150 1.00 0.00 H ATOM 64475 H2 WAT 8699 6.622 17.863 1.237 1.00 0.00 H TER 64477 WAT 8699 ATOM 64477 O WAT 8700 109.586 38.225 100.193 1.00 0.00 O ATOM 64478 H1 WAT 8700 110.340 37.932 100.705 1.00 0.00 H ATOM 64479 H2 WAT 8700 109.500 37.571 99.498 1.00 0.00 H TER 64481 WAT 8700 ATOM 64481 O WAT 8701 72.300 85.274 144.931 1.00 0.00 O ATOM 64482 H1 WAT 8701 72.031 84.461 145.359 1.00 0.00 H ATOM 64483 H2 WAT 8701 72.086 85.960 145.563 1.00 0.00 H TER 64485 WAT 8701 ATOM 64485 O WAT 8702 100.039 63.000 82.249 1.00 0.00 O ATOM 64486 H1 WAT 8702 99.345 63.558 82.600 1.00 0.00 H ATOM 64487 H2 WAT 8702 100.147 63.292 81.344 1.00 0.00 H TER 64489 WAT 8702 ATOM 64489 O WAT 8703 35.859 34.928 118.926 1.00 0.00 O ATOM 64490 H1 WAT 8703 36.256 34.986 118.057 1.00 0.00 H ATOM 64491 H2 WAT 8703 36.472 34.398 119.435 1.00 0.00 H TER 64493 WAT 8703 ATOM 64493 O WAT 8704 119.175 20.531 81.197 1.00 0.00 O ATOM 64494 H1 WAT 8704 119.844 19.947 80.841 1.00 0.00 H ATOM 64495 H2 WAT 8704 119.570 21.401 81.157 1.00 0.00 H TER 64497 WAT 8704 ATOM 64497 O WAT 8705 131.991 111.670 134.600 1.00 0.00 O ATOM 64498 H1 WAT 8705 132.626 111.714 133.885 1.00 0.00 H ATOM 64499 H2 WAT 8705 132.236 112.388 135.183 1.00 0.00 H TER 64501 WAT 8705 ATOM 64501 O WAT 8706 87.964 69.280 153.057 1.00 0.00 O ATOM 64502 H1 WAT 8706 87.483 68.804 153.734 1.00 0.00 H ATOM 64503 H2 WAT 8706 88.178 70.121 153.461 1.00 0.00 H TER 64505 WAT 8706 ATOM 64505 O WAT 8707 105.017 114.062 84.732 1.00 0.00 O ATOM 64506 H1 WAT 8707 104.152 114.194 84.345 1.00 0.00 H ATOM 64507 H2 WAT 8707 105.628 114.213 84.011 1.00 0.00 H TER 64509 WAT 8707 ATOM 64509 O WAT 8708 53.235 133.859 4.447 1.00 0.00 O ATOM 64510 H1 WAT 8708 53.707 133.436 5.164 1.00 0.00 H ATOM 64511 H2 WAT 8708 52.311 133.699 4.641 1.00 0.00 H TER 64513 WAT 8708 ATOM 64513 O WAT 8709 5.988 47.832 158.794 1.00 0.00 O ATOM 64514 H1 WAT 8709 5.649 48.298 158.029 1.00 0.00 H ATOM 64515 H2 WAT 8709 5.215 47.430 159.191 1.00 0.00 H TER 64517 WAT 8709 ATOM 64517 O WAT 8710 32.806 123.320 100.336 1.00 0.00 O ATOM 64518 H1 WAT 8710 33.427 123.883 100.799 1.00 0.00 H ATOM 64519 H2 WAT 8710 32.175 123.927 99.949 1.00 0.00 H TER 64521 WAT 8710 ATOM 64521 O WAT 8711 106.779 16.336 69.647 1.00 0.00 O ATOM 64522 H1 WAT 8711 106.521 16.411 68.729 1.00 0.00 H ATOM 64523 H2 WAT 8711 107.065 15.427 69.742 1.00 0.00 H TER 64525 WAT 8711 ATOM 64525 O WAT 8712 127.229 116.190 3.756 1.00 0.00 O ATOM 64526 H1 WAT 8712 128.165 116.389 3.743 1.00 0.00 H ATOM 64527 H2 WAT 8712 126.974 116.296 4.672 1.00 0.00 H TER 64529 WAT 8712 ATOM 64529 O WAT 8713 80.081 21.029 20.992 1.00 0.00 O ATOM 64530 H1 WAT 8713 80.581 21.652 20.465 1.00 0.00 H ATOM 64531 H2 WAT 8713 79.165 21.241 20.808 1.00 0.00 H TER 64533 WAT 8713 ATOM 64533 O WAT 8714 109.432 42.981 123.706 1.00 0.00 O ATOM 64534 H1 WAT 8714 110.132 43.572 123.983 1.00 0.00 H ATOM 64535 H2 WAT 8714 109.833 42.112 123.718 1.00 0.00 H TER 64537 WAT 8714 ATOM 64537 O WAT 8715 80.796 126.941 146.005 1.00 0.00 O ATOM 64538 H1 WAT 8715 80.766 126.517 146.862 1.00 0.00 H ATOM 64539 H2 WAT 8715 80.343 127.775 146.133 1.00 0.00 H TER 64541 WAT 8715 ATOM 64541 O WAT 8716 66.541 44.475 153.435 1.00 0.00 O ATOM 64542 H1 WAT 8716 66.694 44.927 154.265 1.00 0.00 H ATOM 64543 H2 WAT 8716 66.798 43.569 153.605 1.00 0.00 H TER 64545 WAT 8716 ATOM 64545 O WAT 8717 28.520 14.386 70.358 1.00 0.00 O ATOM 64546 H1 WAT 8717 28.292 14.345 71.287 1.00 0.00 H ATOM 64547 H2 WAT 8717 28.782 13.493 70.136 1.00 0.00 H TER 64549 WAT 8717 ATOM 64549 O WAT 8718 79.995 61.910 17.519 1.00 0.00 O ATOM 64550 H1 WAT 8718 80.286 60.998 17.517 1.00 0.00 H ATOM 64551 H2 WAT 8718 79.557 62.019 18.364 1.00 0.00 H TER 64553 WAT 8718 ATOM 64553 O WAT 8719 70.114 19.107 109.959 1.00 0.00 O ATOM 64554 H1 WAT 8719 69.858 20.027 110.022 1.00 0.00 H ATOM 64555 H2 WAT 8719 70.815 19.098 109.307 1.00 0.00 H TER 64557 WAT 8719 ATOM 64557 O WAT 8720 108.009 72.179 70.122 1.00 0.00 O ATOM 64558 H1 WAT 8720 107.159 71.740 70.128 1.00 0.00 H ATOM 64559 H2 WAT 8720 108.041 72.627 69.276 1.00 0.00 H TER 64561 WAT 8720 ATOM 64561 O WAT 8721 12.205 141.503 91.571 1.00 0.00 O ATOM 64562 H1 WAT 8721 11.924 141.008 90.802 1.00 0.00 H ATOM 64563 H2 WAT 8721 12.865 140.947 91.986 1.00 0.00 H TER 64565 WAT 8721 ATOM 64565 O WAT 8722 40.987 16.632 2.789 1.00 0.00 O ATOM 64566 H1 WAT 8722 40.982 15.785 2.344 1.00 0.00 H ATOM 64567 H2 WAT 8722 40.347 16.535 3.495 1.00 0.00 H TER 64569 WAT 8722 ATOM 64569 O WAT 8723 59.755 40.208 112.171 1.00 0.00 O ATOM 64570 H1 WAT 8723 58.860 40.453 112.406 1.00 0.00 H ATOM 64571 H2 WAT 8723 60.204 40.108 113.010 1.00 0.00 H TER 64573 WAT 8723 ATOM 64573 O WAT 8724 105.065 138.306 135.960 1.00 0.00 O ATOM 64574 H1 WAT 8724 105.707 137.623 136.153 1.00 0.00 H ATOM 64575 H2 WAT 8724 104.218 137.865 136.025 1.00 0.00 H TER 64577 WAT 8724 ATOM 64577 O WAT 8725 57.817 138.279 144.346 1.00 0.00 O ATOM 64578 H1 WAT 8725 56.969 138.304 143.902 1.00 0.00 H ATOM 64579 H2 WAT 8725 57.638 137.847 145.181 1.00 0.00 H TER 64581 WAT 8725 ATOM 64581 O WAT 8726 22.921 107.965 107.635 1.00 0.00 O ATOM 64582 H1 WAT 8726 22.348 107.588 108.302 1.00 0.00 H ATOM 64583 H2 WAT 8726 22.569 107.642 106.806 1.00 0.00 H TER 64585 WAT 8726 ATOM 64585 O WAT 8727 87.965 22.621 155.079 1.00 0.00 O ATOM 64586 H1 WAT 8727 88.821 22.615 154.651 1.00 0.00 H ATOM 64587 H2 WAT 8727 87.937 21.800 155.571 1.00 0.00 H TER 64589 WAT 8727 ATOM 64589 O WAT 8728 91.854 24.997 132.270 1.00 0.00 O ATOM 64590 H1 WAT 8728 91.053 25.514 132.186 1.00 0.00 H ATOM 64591 H2 WAT 8728 92.335 25.167 131.460 1.00 0.00 H TER 64593 WAT 8728 ATOM 64593 O WAT 8729 88.791 9.389 64.673 1.00 0.00 O ATOM 64594 H1 WAT 8729 88.832 10.219 65.147 1.00 0.00 H ATOM 64595 H2 WAT 8729 87.878 9.111 64.755 1.00 0.00 H TER 64597 WAT 8729 ATOM 64597 O WAT 8730 1.741 47.905 128.517 1.00 0.00 O ATOM 64598 H1 WAT 8730 0.928 48.256 128.151 1.00 0.00 H ATOM 64599 H2 WAT 8730 2.434 48.325 128.006 1.00 0.00 H TER 64601 WAT 8730 ATOM 64601 O WAT 8731 138.631 50.618 105.634 1.00 0.00 O ATOM 64602 H1 WAT 8731 139.504 50.229 105.581 1.00 0.00 H ATOM 64603 H2 WAT 8731 138.079 49.922 105.991 1.00 0.00 H TER 64605 WAT 8731 ATOM 64605 O WAT 8732 111.169 115.360 9.713 1.00 0.00 O ATOM 64606 H1 WAT 8732 111.484 114.573 9.269 1.00 0.00 H ATOM 64607 H2 WAT 8732 111.808 116.035 9.486 1.00 0.00 H TER 64609 WAT 8732 ATOM 64609 O WAT 8733 62.690 130.088 75.462 1.00 0.00 O ATOM 64610 H1 WAT 8733 62.331 129.209 75.340 1.00 0.00 H ATOM 64611 H2 WAT 8733 63.636 129.976 75.361 1.00 0.00 H TER 64613 WAT 8733 ATOM 64613 O WAT 8734 41.068 107.472 155.197 1.00 0.00 O ATOM 64614 H1 WAT 8734 40.902 108.412 155.277 1.00 0.00 H ATOM 64615 H2 WAT 8734 40.567 107.079 155.912 1.00 0.00 H TER 64617 WAT 8734 ATOM 64617 O WAT 8735 128.151 43.512 14.545 1.00 0.00 O ATOM 64618 H1 WAT 8735 128.985 43.438 14.080 1.00 0.00 H ATOM 64619 H2 WAT 8735 128.386 43.865 15.403 1.00 0.00 H TER 64621 WAT 8735 ATOM 64621 O WAT 8736 96.769 141.891 66.754 1.00 0.00 O ATOM 64622 H1 WAT 8736 97.660 142.023 66.431 1.00 0.00 H ATOM 64623 H2 WAT 8736 96.279 141.591 65.988 1.00 0.00 H TER 64625 WAT 8736 ATOM 64625 O WAT 8737 105.855 83.002 119.600 1.00 0.00 O ATOM 64626 H1 WAT 8737 105.864 82.394 120.339 1.00 0.00 H ATOM 64627 H2 WAT 8737 105.280 82.588 118.956 1.00 0.00 H TER 64629 WAT 8737 ATOM 64629 O WAT 8738 121.336 120.707 156.734 1.00 0.00 O ATOM 64630 H1 WAT 8738 120.970 119.998 157.262 1.00 0.00 H ATOM 64631 H2 WAT 8738 120.604 121.005 156.193 1.00 0.00 H TER 64633 WAT 8738 ATOM 64633 O WAT 8739 142.138 135.041 138.720 1.00 0.00 O ATOM 64634 H1 WAT 8739 141.848 135.402 139.558 1.00 0.00 H ATOM 64635 H2 WAT 8739 142.236 134.103 138.884 1.00 0.00 H TER 64637 WAT 8739 ATOM 64637 O WAT 8740 125.518 61.353 13.930 1.00 0.00 O ATOM 64638 H1 WAT 8740 126.190 61.715 13.352 1.00 0.00 H ATOM 64639 H2 WAT 8740 125.275 60.522 13.522 1.00 0.00 H TER 64641 WAT 8740 ATOM 64641 O WAT 8741 72.720 22.996 117.348 1.00 0.00 O ATOM 64642 H1 WAT 8741 72.747 22.113 116.981 1.00 0.00 H ATOM 64643 H2 WAT 8741 71.872 23.344 117.072 1.00 0.00 H TER 64645 WAT 8741 ATOM 64645 O WAT 8742 142.979 22.126 76.182 1.00 0.00 O ATOM 64646 H1 WAT 8742 142.826 21.702 77.026 1.00 0.00 H ATOM 64647 H2 WAT 8742 142.129 22.492 75.939 1.00 0.00 H TER 64649 WAT 8742 ATOM 64649 O WAT 8743 122.318 27.925 109.178 1.00 0.00 O ATOM 64650 H1 WAT 8743 122.443 28.527 108.445 1.00 0.00 H ATOM 64651 H2 WAT 8743 122.684 28.387 109.932 1.00 0.00 H TER 64653 WAT 8743 ATOM 64653 O WAT 8744 8.794 70.990 55.561 1.00 0.00 O ATOM 64654 H1 WAT 8744 9.500 70.890 54.922 1.00 0.00 H ATOM 64655 H2 WAT 8744 9.236 71.252 56.368 1.00 0.00 H TER 64657 WAT 8744 ATOM 64657 O WAT 8745 87.698 94.811 83.780 1.00 0.00 O ATOM 64658 H1 WAT 8745 87.257 94.297 83.103 1.00 0.00 H ATOM 64659 H2 WAT 8745 88.585 94.453 83.812 1.00 0.00 H TER 64661 WAT 8745 ATOM 64661 O WAT 8746 70.310 13.619 18.466 1.00 0.00 O ATOM 64662 H1 WAT 8746 69.866 14.186 19.097 1.00 0.00 H ATOM 64663 H2 WAT 8746 70.937 14.194 18.028 1.00 0.00 H TER 64665 WAT 8746 ATOM 64665 O WAT 8747 62.101 43.034 69.712 1.00 0.00 O ATOM 64666 H1 WAT 8747 61.164 42.851 69.641 1.00 0.00 H ATOM 64667 H2 WAT 8747 62.282 43.639 68.993 1.00 0.00 H TER 64669 WAT 8747 ATOM 64669 O WAT 8748 37.092 22.145 88.377 1.00 0.00 O ATOM 64670 H1 WAT 8748 37.959 21.789 88.183 1.00 0.00 H ATOM 64671 H2 WAT 8748 37.049 22.164 89.333 1.00 0.00 H TER 64673 WAT 8748 ATOM 64673 O WAT 8749 13.908 131.732 154.242 1.00 0.00 O ATOM 64674 H1 WAT 8749 14.524 132.169 154.829 1.00 0.00 H ATOM 64675 H2 WAT 8749 13.652 130.938 154.712 1.00 0.00 H TER 64677 WAT 8749 ATOM 64677 O WAT 8750 67.918 94.458 102.314 1.00 0.00 O ATOM 64678 H1 WAT 8750 67.563 94.242 101.452 1.00 0.00 H ATOM 64679 H2 WAT 8750 68.777 94.037 102.331 1.00 0.00 H TER 64681 WAT 8750 ATOM 64681 O WAT 8751 76.572 13.992 114.270 1.00 0.00 O ATOM 64682 H1 WAT 8751 75.964 14.575 113.816 1.00 0.00 H ATOM 64683 H2 WAT 8751 76.251 13.112 114.073 1.00 0.00 H TER 64685 WAT 8751 ATOM 64685 O WAT 8752 39.289 111.995 98.484 1.00 0.00 O ATOM 64686 H1 WAT 8752 39.854 111.274 98.764 1.00 0.00 H ATOM 64687 H2 WAT 8752 38.623 112.057 99.169 1.00 0.00 H TER 64689 WAT 8752 ATOM 64689 O WAT 8753 54.418 18.390 89.713 1.00 0.00 O ATOM 64690 H1 WAT 8753 53.746 18.286 89.040 1.00 0.00 H ATOM 64691 H2 WAT 8753 55.243 18.231 89.254 1.00 0.00 H TER 64693 WAT 8753 ATOM 64693 O WAT 8754 91.783 7.750 91.598 1.00 0.00 O ATOM 64694 H1 WAT 8754 90.987 8.273 91.695 1.00 0.00 H ATOM 64695 H2 WAT 8754 92.494 8.352 91.820 1.00 0.00 H TER 64697 WAT 8754 ATOM 64697 O WAT 8755 65.307 18.743 132.922 1.00 0.00 O ATOM 64698 H1 WAT 8755 64.766 19.180 133.579 1.00 0.00 H ATOM 64699 H2 WAT 8755 66.206 18.948 133.177 1.00 0.00 H TER 64701 WAT 8755 ATOM 64701 O WAT 8756 31.282 1.109 77.677 1.00 0.00 O ATOM 64702 H1 WAT 8756 32.092 1.028 78.180 1.00 0.00 H ATOM 64703 H2 WAT 8756 31.423 1.871 77.115 1.00 0.00 H TER 64705 WAT 8756 ATOM 64705 O WAT 8757 137.028 100.779 23.049 1.00 0.00 O ATOM 64706 H1 WAT 8757 137.501 99.963 22.886 1.00 0.00 H ATOM 64707 H2 WAT 8757 137.661 101.336 23.502 1.00 0.00 H TER 64709 WAT 8757 ATOM 64709 O WAT 8758 35.371 105.158 140.401 1.00 0.00 O ATOM 64710 H1 WAT 8758 35.524 105.581 141.247 1.00 0.00 H ATOM 64711 H2 WAT 8758 36.246 105.042 140.030 1.00 0.00 H TER 64713 WAT 8758 ATOM 64713 O WAT 8759 88.143 18.218 18.648 1.00 0.00 O ATOM 64714 H1 WAT 8759 88.760 18.741 19.161 1.00 0.00 H ATOM 64715 H2 WAT 8759 87.553 17.839 19.299 1.00 0.00 H TER 64717 WAT 8759 ATOM 64717 O WAT 8760 35.777 119.326 88.469 1.00 0.00 O ATOM 64718 H1 WAT 8760 35.643 118.530 88.982 1.00 0.00 H ATOM 64719 H2 WAT 8760 35.365 119.140 87.625 1.00 0.00 H TER 64721 WAT 8760 ATOM 64721 O WAT 8761 144.859 137.256 65.991 1.00 0.00 O ATOM 64722 H1 WAT 8761 144.160 137.844 65.705 1.00 0.00 H ATOM 64723 H2 WAT 8761 144.407 136.564 66.474 1.00 0.00 H TER 64725 WAT 8761 ATOM 64725 O WAT 8762 80.549 7.568 152.217 1.00 0.00 O ATOM 64726 H1 WAT 8762 81.028 6.775 152.458 1.00 0.00 H ATOM 64727 H2 WAT 8762 80.099 7.829 153.021 1.00 0.00 H TER 64729 WAT 8762 ATOM 64729 O WAT 8763 19.450 122.986 75.797 1.00 0.00 O ATOM 64730 H1 WAT 8763 19.155 123.370 74.971 1.00 0.00 H ATOM 64731 H2 WAT 8763 20.163 122.398 75.546 1.00 0.00 H TER 64733 WAT 8763 ATOM 64733 O WAT 8764 134.702 12.537 127.922 1.00 0.00 O ATOM 64734 H1 WAT 8764 135.453 12.148 127.473 1.00 0.00 H ATOM 64735 H2 WAT 8764 134.270 11.798 128.350 1.00 0.00 H TER 64737 WAT 8764 ATOM 64737 O WAT 8765 59.178 142.359 96.046 1.00 0.00 O ATOM 64738 H1 WAT 8765 58.300 142.063 95.803 1.00 0.00 H ATOM 64739 H2 WAT 8765 59.039 143.219 96.443 1.00 0.00 H TER 64741 WAT 8765 ATOM 64741 O WAT 8766 57.590 129.339 96.290 1.00 0.00 O ATOM 64742 H1 WAT 8766 57.262 128.465 96.081 1.00 0.00 H ATOM 64743 H2 WAT 8766 57.069 129.927 95.742 1.00 0.00 H TER 64745 WAT 8766 ATOM 64745 O WAT 8767 130.218 105.879 76.675 1.00 0.00 O ATOM 64746 H1 WAT 8767 129.710 106.621 76.348 1.00 0.00 H ATOM 64747 H2 WAT 8767 130.197 105.976 77.627 1.00 0.00 H TER 64749 WAT 8767 ATOM 64749 O WAT 8768 99.780 142.493 108.654 1.00 0.00 O ATOM 64750 H1 WAT 8768 99.052 142.040 109.081 1.00 0.00 H ATOM 64751 H2 WAT 8768 99.685 143.406 108.924 1.00 0.00 H TER 64753 WAT 8768 ATOM 64753 O WAT 8769 10.692 116.725 75.943 1.00 0.00 O ATOM 64754 H1 WAT 8769 10.262 116.255 75.229 1.00 0.00 H ATOM 64755 H2 WAT 8769 11.430 116.166 76.188 1.00 0.00 H TER 64757 WAT 8769 ATOM 64757 O WAT 8770 120.506 0.725 69.188 1.00 0.00 O ATOM 64758 H1 WAT 8770 119.744 0.147 69.136 1.00 0.00 H ATOM 64759 H2 WAT 8770 120.265 1.486 68.660 1.00 0.00 H TER 64761 WAT 8770 ATOM 64761 O WAT 8771 28.356 73.842 98.981 1.00 0.00 O ATOM 64762 H1 WAT 8771 27.718 74.131 99.633 1.00 0.00 H ATOM 64763 H2 WAT 8771 29.191 74.190 99.293 1.00 0.00 H TER 64765 WAT 8771 ATOM 64765 O WAT 8772 7.380 59.636 14.577 1.00 0.00 O ATOM 64766 H1 WAT 8772 8.302 59.664 14.833 1.00 0.00 H ATOM 64767 H2 WAT 8772 7.021 60.469 14.882 1.00 0.00 H TER 64769 WAT 8772 ATOM 64769 O WAT 8773 132.858 63.288 147.435 1.00 0.00 O ATOM 64770 H1 WAT 8773 133.252 63.500 148.281 1.00 0.00 H ATOM 64771 H2 WAT 8773 133.579 63.358 146.810 1.00 0.00 H TER 64773 WAT 8773 ATOM 64773 O WAT 8774 118.675 112.743 114.533 1.00 0.00 O ATOM 64774 H1 WAT 8774 119.263 113.482 114.373 1.00 0.00 H ATOM 64775 H2 WAT 8774 119.090 112.005 114.086 1.00 0.00 H TER 64777 WAT 8774 ATOM 64777 O WAT 8775 56.308 125.707 109.037 1.00 0.00 O ATOM 64778 H1 WAT 8775 55.681 124.984 109.055 1.00 0.00 H ATOM 64779 H2 WAT 8775 55.949 126.352 109.646 1.00 0.00 H TER 64781 WAT 8775 ATOM 64781 O WAT 8776 24.060 67.804 154.301 1.00 0.00 O ATOM 64782 H1 WAT 8776 24.323 66.885 154.242 1.00 0.00 H ATOM 64783 H2 WAT 8776 24.120 68.011 155.233 1.00 0.00 H TER 64785 WAT 8776 ATOM 64785 O WAT 8777 15.275 52.173 132.980 1.00 0.00 O ATOM 64786 H1 WAT 8777 15.979 52.447 132.392 1.00 0.00 H ATOM 64787 H2 WAT 8777 15.649 52.257 133.857 1.00 0.00 H TER 64789 WAT 8777 ATOM 64789 O WAT 8778 4.192 3.302 56.758 1.00 0.00 O ATOM 64790 H1 WAT 8778 4.845 3.994 56.860 1.00 0.00 H ATOM 64791 H2 WAT 8778 4.536 2.570 57.269 1.00 0.00 H TER 64793 WAT 8778 ATOM 64793 O WAT 8779 30.101 116.966 105.029 1.00 0.00 O ATOM 64794 H1 WAT 8779 30.151 116.928 105.984 1.00 0.00 H ATOM 64795 H2 WAT 8779 29.209 116.687 104.824 1.00 0.00 H TER 64797 WAT 8779 ATOM 64797 O WAT 8780 126.430 42.749 112.849 1.00 0.00 O ATOM 64798 H1 WAT 8780 125.643 42.213 112.751 1.00 0.00 H ATOM 64799 H2 WAT 8780 126.444 43.300 112.066 1.00 0.00 H TER 64801 WAT 8780 ATOM 64801 O WAT 8781 115.179 138.704 9.143 1.00 0.00 O ATOM 64802 H1 WAT 8781 115.916 138.673 9.752 1.00 0.00 H ATOM 64803 H2 WAT 8781 114.443 139.012 9.673 1.00 0.00 H TER 64805 WAT 8781 ATOM 64805 O WAT 8782 30.506 50.132 102.701 1.00 0.00 O ATOM 64806 H1 WAT 8782 29.600 49.928 102.471 1.00 0.00 H ATOM 64807 H2 WAT 8782 30.480 51.042 102.996 1.00 0.00 H TER 64809 WAT 8782 ATOM 64809 O WAT 8783 78.210 79.892 79.414 1.00 0.00 O ATOM 64810 H1 WAT 8783 77.667 79.852 78.627 1.00 0.00 H ATOM 64811 H2 WAT 8783 77.633 80.259 80.085 1.00 0.00 H TER 64813 WAT 8783 ATOM 64813 O WAT 8784 5.830 11.960 106.041 1.00 0.00 O ATOM 64814 H1 WAT 8784 6.556 11.784 106.639 1.00 0.00 H ATOM 64815 H2 WAT 8784 5.244 12.532 106.536 1.00 0.00 H TER 64817 WAT 8784 ATOM 64817 O WAT 8785 52.211 4.181 100.526 1.00 0.00 O ATOM 64818 H1 WAT 8785 52.199 3.405 101.086 1.00 0.00 H ATOM 64819 H2 WAT 8785 52.247 4.917 101.137 1.00 0.00 H TER 64821 WAT 8785 ATOM 64821 O WAT 8786 17.995 134.116 157.359 1.00 0.00 O ATOM 64822 H1 WAT 8786 17.741 134.746 158.033 1.00 0.00 H ATOM 64823 H2 WAT 8786 18.269 133.340 157.847 1.00 0.00 H TER 64825 WAT 8786 ATOM 64825 O WAT 8787 82.932 40.450 88.156 1.00 0.00 O ATOM 64826 H1 WAT 8787 83.136 39.694 87.606 1.00 0.00 H ATOM 64827 H2 WAT 8787 82.453 41.045 87.579 1.00 0.00 H TER 64829 WAT 8787 ATOM 64829 O WAT 8788 15.601 86.368 17.276 1.00 0.00 O ATOM 64830 H1 WAT 8788 15.422 87.078 16.660 1.00 0.00 H ATOM 64831 H2 WAT 8788 14.740 85.996 17.469 1.00 0.00 H TER 64833 WAT 8788 ATOM 64833 O WAT 8789 42.608 115.987 95.955 1.00 0.00 O ATOM 64834 H1 WAT 8789 41.754 116.132 95.549 1.00 0.00 H ATOM 64835 H2 WAT 8789 43.156 115.651 95.246 1.00 0.00 H TER 64837 WAT 8789 ATOM 64837 O WAT 8790 51.922 31.742 133.215 1.00 0.00 O ATOM 64838 H1 WAT 8790 51.652 30.863 133.484 1.00 0.00 H ATOM 64839 H2 WAT 8790 51.151 32.287 133.373 1.00 0.00 H TER 64841 WAT 8790 ATOM 64841 O WAT 8791 21.614 137.334 99.124 1.00 0.00 O ATOM 64842 H1 WAT 8791 22.402 137.794 99.416 1.00 0.00 H ATOM 64843 H2 WAT 8791 21.482 137.632 98.224 1.00 0.00 H TER 64845 WAT 8791 ATOM 64845 O WAT 8792 108.556 77.442 6.625 1.00 0.00 O ATOM 64846 H1 WAT 8792 109.255 77.450 5.972 1.00 0.00 H ATOM 64847 H2 WAT 8792 107.788 77.125 6.149 1.00 0.00 H TER 64849 WAT 8792 ATOM 64849 O WAT 8793 108.681 101.083 4.110 1.00 0.00 O ATOM 64850 H1 WAT 8793 109.105 100.645 4.848 1.00 0.00 H ATOM 64851 H2 WAT 8793 108.555 101.984 4.406 1.00 0.00 H TER 64853 WAT 8793 ATOM 64853 O WAT 8794 15.648 128.355 11.583 1.00 0.00 O ATOM 64854 H1 WAT 8794 15.473 128.792 10.749 1.00 0.00 H ATOM 64855 H2 WAT 8794 16.531 127.997 11.485 1.00 0.00 H TER 64857 WAT 8794 ATOM 64857 O WAT 8795 36.673 144.870 135.066 1.00 0.00 O ATOM 64858 H1 WAT 8795 35.762 145.154 134.989 1.00 0.00 H ATOM 64859 H2 WAT 8795 36.710 144.409 135.904 1.00 0.00 H TER 64861 WAT 8795 ATOM 64861 O WAT 8796 16.097 102.343 94.310 1.00 0.00 O ATOM 64862 H1 WAT 8796 16.303 101.640 94.926 1.00 0.00 H ATOM 64863 H2 WAT 8796 15.830 103.077 94.865 1.00 0.00 H TER 64865 WAT 8796 ATOM 64865 O WAT 8797 135.665 131.946 3.067 1.00 0.00 O ATOM 64866 H1 WAT 8797 134.732 131.733 3.043 1.00 0.00 H ATOM 64867 H2 WAT 8797 135.691 132.891 3.218 1.00 0.00 H TER 64869 WAT 8797 ATOM 64869 O WAT 8798 17.460 132.120 64.220 1.00 0.00 O ATOM 64870 H1 WAT 8798 17.625 132.732 63.503 1.00 0.00 H ATOM 64871 H2 WAT 8798 17.570 132.646 65.013 1.00 0.00 H TER 64873 WAT 8798 ATOM 64873 O WAT 8799 59.845 106.239 90.327 1.00 0.00 O ATOM 64874 H1 WAT 8799 59.128 106.858 90.191 1.00 0.00 H ATOM 64875 H2 WAT 8799 60.152 106.030 89.445 1.00 0.00 H TER 64877 WAT 8799 ATOM 64877 O WAT 8800 23.297 46.654 76.398 1.00 0.00 O ATOM 64878 H1 WAT 8800 23.115 46.018 77.090 1.00 0.00 H ATOM 64879 H2 WAT 8800 24.070 47.128 76.705 1.00 0.00 H TER 64881 WAT 8800 ATOM 64881 O WAT 8801 68.794 22.676 153.239 1.00 0.00 O ATOM 64882 H1 WAT 8801 69.659 22.569 153.635 1.00 0.00 H ATOM 64883 H2 WAT 8801 68.188 22.318 153.888 1.00 0.00 H TER 64885 WAT 8801 ATOM 64885 O WAT 8802 112.626 7.035 135.810 1.00 0.00 O ATOM 64886 H1 WAT 8802 113.500 6.657 135.721 1.00 0.00 H ATOM 64887 H2 WAT 8802 112.516 7.165 136.753 1.00 0.00 H TER 64889 WAT 8802 ATOM 64889 O WAT 8803 30.109 66.493 128.660 1.00 0.00 O ATOM 64890 H1 WAT 8803 29.197 66.726 128.487 1.00 0.00 H ATOM 64891 H2 WAT 8803 30.602 66.920 127.959 1.00 0.00 H TER 64893 WAT 8803 ATOM 64893 O WAT 8804 133.423 33.194 117.213 1.00 0.00 O ATOM 64894 H1 WAT 8804 132.628 33.482 117.661 1.00 0.00 H ATOM 64895 H2 WAT 8804 133.935 33.994 117.096 1.00 0.00 H TER 64897 WAT 8804 ATOM 64897 O WAT 8805 106.704 103.637 79.211 1.00 0.00 O ATOM 64898 H1 WAT 8805 107.515 103.610 78.702 1.00 0.00 H ATOM 64899 H2 WAT 8805 106.860 104.309 79.874 1.00 0.00 H TER 64901 WAT 8805 ATOM 64901 O WAT 8806 136.214 58.001 27.872 1.00 0.00 O ATOM 64902 H1 WAT 8806 136.259 58.120 26.924 1.00 0.00 H ATOM 64903 H2 WAT 8806 137.057 57.611 28.105 1.00 0.00 H TER 64905 WAT 8806 ATOM 64905 O WAT 8807 94.426 65.224 104.422 1.00 0.00 O ATOM 64906 H1 WAT 8807 93.792 65.941 104.436 1.00 0.00 H ATOM 64907 H2 WAT 8807 94.987 65.414 103.670 1.00 0.00 H TER 64909 WAT 8807 ATOM 64909 O WAT 8808 71.335 54.127 106.778 1.00 0.00 O ATOM 64910 H1 WAT 8808 71.277 55.039 106.493 1.00 0.00 H ATOM 64911 H2 WAT 8808 72.265 53.913 106.708 1.00 0.00 H TER 64913 WAT 8808 ATOM 64913 O WAT 8809 18.344 16.881 74.865 1.00 0.00 O ATOM 64914 H1 WAT 8809 19.161 16.521 74.519 1.00 0.00 H ATOM 64915 H2 WAT 8809 17.952 17.341 74.123 1.00 0.00 H TER 64917 WAT 8809 ATOM 64917 O WAT 8810 10.943 120.588 67.518 1.00 0.00 O ATOM 64918 H1 WAT 8810 11.738 121.064 67.276 1.00 0.00 H ATOM 64919 H2 WAT 8810 10.670 120.984 68.346 1.00 0.00 H TER 64921 WAT 8810 ATOM 64921 O WAT 8811 105.801 137.583 70.491 1.00 0.00 O ATOM 64922 H1 WAT 8811 106.413 138.080 71.035 1.00 0.00 H ATOM 64923 H2 WAT 8811 105.363 136.991 71.103 1.00 0.00 H TER 64925 WAT 8811 ATOM 64925 O WAT 8812 6.237 98.291 122.473 1.00 0.00 O ATOM 64926 H1 WAT 8812 6.989 98.040 123.009 1.00 0.00 H ATOM 64927 H2 WAT 8812 5.968 97.480 122.041 1.00 0.00 H TER 64929 WAT 8812 ATOM 64929 O WAT 8813 38.975 118.323 72.955 1.00 0.00 O ATOM 64930 H1 WAT 8813 39.337 117.440 72.888 1.00 0.00 H ATOM 64931 H2 WAT 8813 38.342 118.377 72.239 1.00 0.00 H TER 64933 WAT 8813 ATOM 64933 O WAT 8814 142.921 68.929 155.093 1.00 0.00 O ATOM 64934 H1 WAT 8814 142.074 68.516 154.925 1.00 0.00 H ATOM 64935 H2 WAT 8814 142.900 69.151 156.024 1.00 0.00 H TER 64937 WAT 8814 ATOM 64937 O WAT 8815 27.881 71.245 139.735 1.00 0.00 O ATOM 64938 H1 WAT 8815 27.564 72.077 139.383 1.00 0.00 H ATOM 64939 H2 WAT 8815 27.413 70.579 139.231 1.00 0.00 H TER 64941 WAT 8815 ATOM 64941 O WAT 8816 53.739 93.490 69.816 1.00 0.00 O ATOM 64942 H1 WAT 8816 54.037 94.111 70.481 1.00 0.00 H ATOM 64943 H2 WAT 8816 53.629 94.019 69.026 1.00 0.00 H TER 64945 WAT 8816 ATOM 64945 O WAT 8817 125.504 51.939 103.703 1.00 0.00 O ATOM 64946 H1 WAT 8817 124.726 51.964 103.146 1.00 0.00 H ATOM 64947 H2 WAT 8817 126.094 52.588 103.320 1.00 0.00 H TER 64949 WAT 8817 ATOM 64949 O WAT 8818 123.071 78.830 125.090 1.00 0.00 O ATOM 64950 H1 WAT 8818 123.786 78.201 124.990 1.00 0.00 H ATOM 64951 H2 WAT 8818 122.915 79.158 124.205 1.00 0.00 H TER 64953 WAT 8818 ATOM 64953 O WAT 8819 18.948 40.580 95.148 1.00 0.00 O ATOM 64954 H1 WAT 8819 18.563 41.383 94.797 1.00 0.00 H ATOM 64955 H2 WAT 8819 18.288 40.242 95.753 1.00 0.00 H TER 64957 WAT 8819 ATOM 64957 O WAT 8820 12.456 132.541 152.057 1.00 0.00 O ATOM 64958 H1 WAT 8820 11.591 132.726 152.422 1.00 0.00 H ATOM 64959 H2 WAT 8820 12.959 132.196 152.795 1.00 0.00 H TER 64961 WAT 8820 ATOM 64961 O WAT 8821 66.679 51.610 9.467 1.00 0.00 O ATOM 64962 H1 WAT 8821 66.806 52.324 10.091 1.00 0.00 H ATOM 64963 H2 WAT 8821 67.542 51.204 9.388 1.00 0.00 H TER 64965 WAT 8821 ATOM 64965 O WAT 8822 100.366 23.942 122.134 1.00 0.00 O ATOM 64966 H1 WAT 8822 100.083 24.854 122.205 1.00 0.00 H ATOM 64967 H2 WAT 8822 101.296 23.996 121.913 1.00 0.00 H TER 64969 WAT 8822 ATOM 64969 O WAT 8823 24.541 73.225 105.090 1.00 0.00 O ATOM 64970 H1 WAT 8823 24.026 73.548 104.351 1.00 0.00 H ATOM 64971 H2 WAT 8823 24.768 74.011 105.586 1.00 0.00 H TER 64973 WAT 8823 ATOM 64973 O WAT 8824 129.844 62.305 67.734 1.00 0.00 O ATOM 64974 H1 WAT 8824 130.652 62.457 68.224 1.00 0.00 H ATOM 64975 H2 WAT 8824 129.993 62.728 66.889 1.00 0.00 H TER 64977 WAT 8824 ATOM 64977 O WAT 8825 88.764 132.664 0.386 1.00 0.00 O ATOM 64978 H1 WAT 8825 88.709 132.058 -0.353 1.00 0.00 H ATOM 64979 H2 WAT 8825 87.870 132.986 0.498 1.00 0.00 H TER 64981 WAT 8825 ATOM 64981 O WAT 8826 41.275 30.343 83.740 1.00 0.00 O ATOM 64982 H1 WAT 8826 41.008 29.525 84.158 1.00 0.00 H ATOM 64983 H2 WAT 8826 41.558 30.901 84.465 1.00 0.00 H TER 64985 WAT 8826 ATOM 64985 O WAT 8827 107.932 100.060 129.091 1.00 0.00 O ATOM 64986 H1 WAT 8827 108.667 99.951 128.488 1.00 0.00 H ATOM 64987 H2 WAT 8827 108.039 100.944 129.441 1.00 0.00 H TER 64989 WAT 8827 ATOM 64989 O WAT 8828 70.766 21.645 134.598 1.00 0.00 O ATOM 64990 H1 WAT 8828 71.651 21.285 134.664 1.00 0.00 H ATOM 64991 H2 WAT 8828 70.209 20.988 135.016 1.00 0.00 H TER 64993 WAT 8828 ATOM 64993 O WAT 8829 12.763 30.730 58.443 1.00 0.00 O ATOM 64994 H1 WAT 8829 12.342 30.917 57.604 1.00 0.00 H ATOM 64995 H2 WAT 8829 13.591 31.209 58.407 1.00 0.00 H TER 64997 WAT 8829 ATOM 64997 O WAT 8830 100.073 100.644 150.988 1.00 0.00 O ATOM 64998 H1 WAT 8830 100.099 101.100 150.147 1.00 0.00 H ATOM 64999 H2 WAT 8830 100.986 100.420 151.167 1.00 0.00 H TER 65001 WAT 8830 ATOM 65001 O WAT 8831 68.011 56.051 27.027 1.00 0.00 O ATOM 65002 H1 WAT 8831 68.958 56.146 27.125 1.00 0.00 H ATOM 65003 H2 WAT 8831 67.701 56.935 26.827 1.00 0.00 H TER 65005 WAT 8831 ATOM 65005 O WAT 8832 65.098 68.698 62.534 1.00 0.00 O ATOM 65006 H1 WAT 8832 64.473 69.407 62.690 1.00 0.00 H ATOM 65007 H2 WAT 8832 65.814 69.112 62.054 1.00 0.00 H TER 65009 WAT 8832 ATOM 65009 O WAT 8833 1.747 111.805 88.648 1.00 0.00 O ATOM 65010 H1 WAT 8833 0.877 112.188 88.532 1.00 0.00 H ATOM 65011 H2 WAT 8833 1.889 111.288 87.855 1.00 0.00 H TER 65013 WAT 8833 ATOM 65013 O WAT 8834 22.793 82.068 139.189 1.00 0.00 O ATOM 65014 H1 WAT 8834 23.085 82.251 138.296 1.00 0.00 H ATOM 65015 H2 WAT 8834 22.248 81.286 139.108 1.00 0.00 H TER 65017 WAT 8834 ATOM 65017 O WAT 8835 66.333 14.200 136.142 1.00 0.00 O ATOM 65018 H1 WAT 8835 67.276 14.171 136.307 1.00 0.00 H ATOM 65019 H2 WAT 8835 66.259 14.486 135.231 1.00 0.00 H TER 65021 WAT 8835 ATOM 65021 O WAT 8836 8.381 122.995 76.099 1.00 0.00 O ATOM 65022 H1 WAT 8836 8.788 123.784 76.456 1.00 0.00 H ATOM 65023 H2 WAT 8836 9.105 122.377 75.997 1.00 0.00 H TER 65025 WAT 8836 ATOM 65025 O WAT 8837 145.120 43.144 112.665 1.00 0.00 O ATOM 65026 H1 WAT 8837 144.365 42.609 112.421 1.00 0.00 H ATOM 65027 H2 WAT 8837 145.086 43.892 112.069 1.00 0.00 H TER 65029 WAT 8837 ATOM 65029 O WAT 8838 145.541 139.421 78.411 1.00 0.00 O ATOM 65030 H1 WAT 8838 145.840 138.838 79.108 1.00 0.00 H ATOM 65031 H2 WAT 8838 146.182 140.131 78.401 1.00 0.00 H TER 65033 WAT 8838 ATOM 65033 O WAT 8839 26.162 54.598 3.032 1.00 0.00 O ATOM 65034 H1 WAT 8839 26.943 54.142 2.718 1.00 0.00 H ATOM 65035 H2 WAT 8839 26.110 54.371 3.960 1.00 0.00 H TER 65037 WAT 8839 ATOM 65037 O WAT 8840 61.360 40.440 24.509 1.00 0.00 O ATOM 65038 H1 WAT 8840 61.662 39.545 24.666 1.00 0.00 H ATOM 65039 H2 WAT 8840 61.306 40.831 25.381 1.00 0.00 H TER 65041 WAT 8840 ATOM 65041 O WAT 8841 144.075 52.327 140.034 1.00 0.00 O ATOM 65042 H1 WAT 8841 143.562 52.313 140.842 1.00 0.00 H ATOM 65043 H2 WAT 8841 143.817 51.529 139.572 1.00 0.00 H TER 65045 WAT 8841 ATOM 65045 O WAT 8842 22.490 64.087 115.985 1.00 0.00 O ATOM 65046 H1 WAT 8842 22.328 63.143 115.960 1.00 0.00 H ATOM 65047 H2 WAT 8842 21.618 64.477 116.048 1.00 0.00 H TER 65049 WAT 8842 ATOM 65049 O WAT 8843 131.859 126.738 76.994 1.00 0.00 O ATOM 65050 H1 WAT 8843 131.723 127.677 77.116 1.00 0.00 H ATOM 65051 H2 WAT 8843 131.151 126.327 77.490 1.00 0.00 H TER 65053 WAT 8843 ATOM 65053 O WAT 8844 95.646 31.754 87.429 1.00 0.00 O ATOM 65054 H1 WAT 8844 96.264 31.715 86.699 1.00 0.00 H ATOM 65055 H2 WAT 8844 95.568 32.687 87.627 1.00 0.00 H TER 65057 WAT 8844 ATOM 65057 O WAT 8845 103.893 89.161 102.086 1.00 0.00 O ATOM 65058 H1 WAT 8845 104.842 89.197 101.972 1.00 0.00 H ATOM 65059 H2 WAT 8845 103.542 89.245 101.199 1.00 0.00 H TER 65061 WAT 8845 ATOM 65061 O WAT 8846 139.850 81.743 156.397 1.00 0.00 O ATOM 65062 H1 WAT 8846 139.311 81.632 157.180 1.00 0.00 H ATOM 65063 H2 WAT 8846 139.478 81.132 155.761 1.00 0.00 H TER 65065 WAT 8846 ATOM 65065 O WAT 8847 112.739 103.508 0.534 1.00 0.00 O ATOM 65066 H1 WAT 8847 111.874 103.376 0.920 1.00 0.00 H ATOM 65067 H2 WAT 8847 113.022 102.631 0.274 1.00 0.00 H TER 65069 WAT 8847 ATOM 65069 O WAT 8848 109.730 119.276 115.115 1.00 0.00 O ATOM 65070 H1 WAT 8848 110.246 118.484 115.264 1.00 0.00 H ATOM 65071 H2 WAT 8848 109.806 119.439 114.175 1.00 0.00 H TER 65073 WAT 8848 ATOM 65073 O WAT 8849 10.045 79.090 99.480 1.00 0.00 O ATOM 65074 H1 WAT 8849 10.361 79.985 99.352 1.00 0.00 H ATOM 65075 H2 WAT 8849 10.797 78.537 99.269 1.00 0.00 H TER 65077 WAT 8849 ATOM 65077 O WAT 8850 43.870 31.351 15.786 1.00 0.00 O ATOM 65078 H1 WAT 8850 44.819 31.443 15.871 1.00 0.00 H ATOM 65079 H2 WAT 8850 43.513 32.100 16.262 1.00 0.00 H TER 65081 WAT 8850 ATOM 65081 O WAT 8851 89.663 130.997 132.826 1.00 0.00 O ATOM 65082 H1 WAT 8851 89.002 130.492 132.352 1.00 0.00 H ATOM 65083 H2 WAT 8851 90.453 130.458 132.782 1.00 0.00 H TER 65085 WAT 8851 ATOM 65085 O WAT 8852 139.105 36.711 83.004 1.00 0.00 O ATOM 65086 H1 WAT 8852 138.679 37.503 83.333 1.00 0.00 H ATOM 65087 H2 WAT 8852 139.577 36.363 83.760 1.00 0.00 H TER 65089 WAT 8852 ATOM 65089 O WAT 8853 8.094 75.329 72.899 1.00 0.00 O ATOM 65090 H1 WAT 8853 8.367 75.503 71.998 1.00 0.00 H ATOM 65091 H2 WAT 8853 8.692 74.646 73.202 1.00 0.00 H TER 65093 WAT 8853 ATOM 65093 O WAT 8854 122.536 38.598 85.705 1.00 0.00 O ATOM 65094 H1 WAT 8854 121.641 38.720 86.023 1.00 0.00 H ATOM 65095 H2 WAT 8854 122.960 38.070 86.381 1.00 0.00 H TER 65097 WAT 8854 ATOM 65097 O WAT 8855 90.531 18.430 100.459 1.00 0.00 O ATOM 65098 H1 WAT 8855 90.478 18.373 99.505 1.00 0.00 H ATOM 65099 H2 WAT 8855 89.952 17.736 100.774 1.00 0.00 H TER 65101 WAT 8855 ATOM 65101 O WAT 8856 61.820 55.299 80.907 1.00 0.00 O ATOM 65102 H1 WAT 8856 62.772 55.217 80.842 1.00 0.00 H ATOM 65103 H2 WAT 8856 61.504 55.126 80.020 1.00 0.00 H TER 65105 WAT 8856 ATOM 65105 O WAT 8857 143.895 101.940 131.479 1.00 0.00 O ATOM 65106 H1 WAT 8857 143.013 102.054 131.832 1.00 0.00 H ATOM 65107 H2 WAT 8857 144.475 102.151 132.210 1.00 0.00 H TER 65109 WAT 8857 ATOM 65109 O WAT 8858 47.615 123.437 89.427 1.00 0.00 O ATOM 65110 H1 WAT 8858 47.722 122.988 90.266 1.00 0.00 H ATOM 65111 H2 WAT 8858 47.136 122.813 88.881 1.00 0.00 H TER 65113 WAT 8858 ATOM 65113 O WAT 8859 21.792 35.454 92.918 1.00 0.00 O ATOM 65114 H1 WAT 8859 21.540 35.618 92.009 1.00 0.00 H ATOM 65115 H2 WAT 8859 21.942 36.326 93.285 1.00 0.00 H TER 65117 WAT 8859 ATOM 65117 O WAT 8860 142.773 115.530 4.859 1.00 0.00 O ATOM 65118 H1 WAT 8860 142.953 116.293 5.409 1.00 0.00 H ATOM 65119 H2 WAT 8860 143.183 114.799 5.322 1.00 0.00 H TER 65121 WAT 8860 ATOM 65121 O WAT 8861 66.700 123.357 105.565 1.00 0.00 O ATOM 65122 H1 WAT 8861 66.592 124.307 105.614 1.00 0.00 H ATOM 65123 H2 WAT 8861 66.313 123.115 104.723 1.00 0.00 H TER 65125 WAT 8861 ATOM 65125 O WAT 8862 37.147 27.644 7.608 1.00 0.00 O ATOM 65126 H1 WAT 8862 36.410 28.221 7.810 1.00 0.00 H ATOM 65127 H2 WAT 8862 37.826 28.231 7.275 1.00 0.00 H TER 65129 WAT 8862 ATOM 65129 O WAT 8863 42.368 10.507 115.045 1.00 0.00 O ATOM 65130 H1 WAT 8863 42.795 11.206 114.549 1.00 0.00 H ATOM 65131 H2 WAT 8863 41.440 10.586 114.821 1.00 0.00 H TER 65133 WAT 8863 ATOM 65133 O WAT 8864 52.753 64.045 158.111 1.00 0.00 O ATOM 65134 H1 WAT 8864 52.671 63.093 158.070 1.00 0.00 H ATOM 65135 H2 WAT 8864 52.963 64.307 157.214 1.00 0.00 H TER 65137 WAT 8864 ATOM 65137 O WAT 8865 61.775 11.096 111.845 1.00 0.00 O ATOM 65138 H1 WAT 8865 62.233 10.276 111.660 1.00 0.00 H ATOM 65139 H2 WAT 8865 61.122 11.168 111.149 1.00 0.00 H TER 65141 WAT 8865 ATOM 65141 O WAT 8866 8.327 38.993 135.301 1.00 0.00 O ATOM 65142 H1 WAT 8866 8.013 39.776 135.754 1.00 0.00 H ATOM 65143 H2 WAT 8866 7.709 38.869 134.581 1.00 0.00 H TER 65145 WAT 8866 ATOM 65145 O WAT 8867 24.489 26.091 157.933 1.00 0.00 O ATOM 65146 H1 WAT 8867 24.766 27.007 157.899 1.00 0.00 H ATOM 65147 H2 WAT 8867 23.767 26.082 158.561 1.00 0.00 H TER 65149 WAT 8867 ATOM 65149 O WAT 8868 42.519 16.624 134.024 1.00 0.00 O ATOM 65150 H1 WAT 8868 42.486 15.866 133.441 1.00 0.00 H ATOM 65151 H2 WAT 8868 41.604 16.883 134.133 1.00 0.00 H TER 65153 WAT 8868 ATOM 65153 O WAT 8869 21.674 75.961 137.925 1.00 0.00 O ATOM 65154 H1 WAT 8869 21.749 76.876 138.197 1.00 0.00 H ATOM 65155 H2 WAT 8869 21.263 76.000 137.061 1.00 0.00 H TER 65157 WAT 8869 ATOM 65157 O WAT 8870 144.739 56.030 128.403 1.00 0.00 O ATOM 65158 H1 WAT 8870 144.313 55.232 128.717 1.00 0.00 H ATOM 65159 H2 WAT 8870 145.610 56.008 128.799 1.00 0.00 H TER 65161 WAT 8870 ATOM 65161 O WAT 8871 59.798 4.509 90.413 1.00 0.00 O ATOM 65162 H1 WAT 8871 59.474 4.881 89.593 1.00 0.00 H ATOM 65163 H2 WAT 8871 59.265 3.724 90.546 1.00 0.00 H TER 65165 WAT 8871 ATOM 65165 O WAT 8872 129.208 99.519 113.303 1.00 0.00 O ATOM 65166 H1 WAT 8872 128.256 99.435 113.249 1.00 0.00 H ATOM 65167 H2 WAT 8872 129.499 99.536 112.391 1.00 0.00 H TER 65169 WAT 8872 ATOM 65169 O WAT 8873 6.076 43.502 138.261 1.00 0.00 O ATOM 65170 H1 WAT 8873 6.983 43.806 138.239 1.00 0.00 H ATOM 65171 H2 WAT 8873 6.117 42.655 138.704 1.00 0.00 H TER 65173 WAT 8873 ATOM 65173 O WAT 8874 107.285 2.355 71.777 1.00 0.00 O ATOM 65174 H1 WAT 8874 107.558 2.952 71.081 1.00 0.00 H ATOM 65175 H2 WAT 8874 106.423 2.043 71.500 1.00 0.00 H TER 65177 WAT 8874 ATOM 65177 O WAT 8875 41.663 11.989 11.650 1.00 0.00 O ATOM 65178 H1 WAT 8875 41.051 11.608 12.279 1.00 0.00 H ATOM 65179 H2 WAT 8875 41.574 12.934 11.772 1.00 0.00 H TER 65181 WAT 8875 ATOM 65181 O WAT 8876 119.248 80.431 117.321 1.00 0.00 O ATOM 65182 H1 WAT 8876 118.884 79.580 117.562 1.00 0.00 H ATOM 65183 H2 WAT 8876 120.073 80.484 117.803 1.00 0.00 H TER 65185 WAT 8876 ATOM 65185 O WAT 8877 67.879 25.982 136.961 1.00 0.00 O ATOM 65186 H1 WAT 8877 67.206 26.332 137.544 1.00 0.00 H ATOM 65187 H2 WAT 8877 67.778 25.032 137.021 1.00 0.00 H TER 65189 WAT 8877 ATOM 65189 O WAT 8878 129.108 52.835 72.107 1.00 0.00 O ATOM 65190 H1 WAT 8878 128.221 53.133 71.903 1.00 0.00 H ATOM 65191 H2 WAT 8878 129.257 53.127 73.006 1.00 0.00 H TER 65193 WAT 8878 ATOM 65193 O WAT 8879 66.340 87.374 152.779 1.00 0.00 O ATOM 65194 H1 WAT 8879 66.087 87.474 151.861 1.00 0.00 H ATOM 65195 H2 WAT 8879 66.754 86.512 152.821 1.00 0.00 H TER 65197 WAT 8879 ATOM 65197 O WAT 8880 43.777 26.703 75.850 1.00 0.00 O ATOM 65198 H1 WAT 8880 43.957 26.105 75.125 1.00 0.00 H ATOM 65199 H2 WAT 8880 42.823 26.705 75.928 1.00 0.00 H TER 65201 WAT 8880 ATOM 65201 O WAT 8881 118.985 77.461 114.280 1.00 0.00 O ATOM 65202 H1 WAT 8881 118.272 77.667 113.675 1.00 0.00 H ATOM 65203 H2 WAT 8881 119.617 76.976 113.749 1.00 0.00 H TER 65205 WAT 8881 ATOM 65205 O WAT 8882 4.177 25.974 132.645 1.00 0.00 O ATOM 65206 H1 WAT 8882 4.398 26.894 132.497 1.00 0.00 H ATOM 65207 H2 WAT 8882 3.248 25.986 132.878 1.00 0.00 H TER 65209 WAT 8882 ATOM 65209 O WAT 8883 97.208 129.925 85.378 1.00 0.00 O ATOM 65210 H1 WAT 8883 97.324 130.552 84.664 1.00 0.00 H ATOM 65211 H2 WAT 8883 97.024 129.094 84.941 1.00 0.00 H TER 65213 WAT 8883 ATOM 65213 O WAT 8884 141.386 0.950 154.815 1.00 0.00 O ATOM 65214 H1 WAT 8884 140.696 1.597 154.672 1.00 0.00 H ATOM 65215 H2 WAT 8884 141.077 0.430 155.557 1.00 0.00 H TER 65217 WAT 8884 ATOM 65217 O WAT 8885 89.035 77.524 108.398 1.00 0.00 O ATOM 65218 H1 WAT 8885 89.696 77.789 109.037 1.00 0.00 H ATOM 65219 H2 WAT 8885 88.527 78.319 108.236 1.00 0.00 H TER 65221 WAT 8885 ATOM 65221 O WAT 8886 142.381 115.422 148.329 1.00 0.00 O ATOM 65222 H1 WAT 8886 141.856 115.722 149.070 1.00 0.00 H ATOM 65223 H2 WAT 8886 141.819 114.793 147.877 1.00 0.00 H TER 65225 WAT 8886 ATOM 65225 O WAT 8887 40.573 129.485 109.498 1.00 0.00 O ATOM 65226 H1 WAT 8887 41.026 129.774 108.706 1.00 0.00 H ATOM 65227 H2 WAT 8887 40.007 128.771 109.204 1.00 0.00 H TER 65229 WAT 8887 ATOM 65229 O WAT 8888 56.265 137.751 141.713 1.00 0.00 O ATOM 65230 H1 WAT 8888 56.660 136.918 141.970 1.00 0.00 H ATOM 65231 H2 WAT 8888 55.958 137.605 140.818 1.00 0.00 H TER 65233 WAT 8888 ATOM 65233 O WAT 8889 72.675 137.816 19.703 1.00 0.00 O ATOM 65234 H1 WAT 8889 73.486 137.640 19.226 1.00 0.00 H ATOM 65235 H2 WAT 8889 72.912 138.493 20.337 1.00 0.00 H TER 65237 WAT 8889 ATOM 65237 O WAT 8890 77.467 38.462 98.097 1.00 0.00 O ATOM 65238 H1 WAT 8890 78.276 38.189 97.665 1.00 0.00 H ATOM 65239 H2 WAT 8890 77.636 39.363 98.375 1.00 0.00 H TER 65241 WAT 8890 ATOM 65241 O WAT 8891 144.933 22.056 143.550 1.00 0.00 O ATOM 65242 H1 WAT 8891 144.912 21.117 143.733 1.00 0.00 H ATOM 65243 H2 WAT 8891 145.054 22.113 142.602 1.00 0.00 H TER 65245 WAT 8891 ATOM 65245 O WAT 8892 54.385 30.701 59.354 1.00 0.00 O ATOM 65246 H1 WAT 8892 54.339 30.750 58.399 1.00 0.00 H ATOM 65247 H2 WAT 8892 53.519 30.391 59.620 1.00 0.00 H TER 65249 WAT 8892 ATOM 65249 O WAT 8893 62.566 61.486 123.093 1.00 0.00 O ATOM 65250 H1 WAT 8893 62.188 62.311 122.789 1.00 0.00 H ATOM 65251 H2 WAT 8893 63.228 61.747 123.734 1.00 0.00 H TER 65253 WAT 8893 ATOM 65253 O WAT 8894 57.935 17.414 75.355 1.00 0.00 O ATOM 65254 H1 WAT 8894 58.060 17.543 76.295 1.00 0.00 H ATOM 65255 H2 WAT 8894 57.104 16.943 75.286 1.00 0.00 H TER 65257 WAT 8894 ATOM 65257 O WAT 8895 35.237 48.673 61.554 1.00 0.00 O ATOM 65258 H1 WAT 8895 34.887 48.535 62.434 1.00 0.00 H ATOM 65259 H2 WAT 8895 35.761 49.471 61.627 1.00 0.00 H TER 65261 WAT 8895 ATOM 65261 O WAT 8896 36.349 15.890 70.794 1.00 0.00 O ATOM 65262 H1 WAT 8896 36.652 15.120 71.276 1.00 0.00 H ATOM 65263 H2 WAT 8896 36.357 16.596 71.441 1.00 0.00 H TER 65265 WAT 8896 ATOM 65265 O WAT 8897 21.015 47.285 117.191 1.00 0.00 O ATOM 65266 H1 WAT 8897 20.366 47.754 117.716 1.00 0.00 H ATOM 65267 H2 WAT 8897 20.931 47.660 116.315 1.00 0.00 H TER 65269 WAT 8897 ATOM 65269 O WAT 8898 144.732 74.595 83.231 1.00 0.00 O ATOM 65270 H1 WAT 8898 144.232 74.677 84.043 1.00 0.00 H ATOM 65271 H2 WAT 8898 144.974 73.670 83.191 1.00 0.00 H TER 65273 WAT 8898 ATOM 65273 O WAT 8899 100.410 76.283 152.430 1.00 0.00 O ATOM 65274 H1 WAT 8899 100.002 76.026 153.257 1.00 0.00 H ATOM 65275 H2 WAT 8899 101.339 76.086 152.549 1.00 0.00 H TER 65277 WAT 8899 ATOM 65277 O WAT 8900 4.692 1.166 105.099 1.00 0.00 O ATOM 65278 H1 WAT 8900 3.781 1.416 105.253 1.00 0.00 H ATOM 65279 H2 WAT 8900 4.846 1.378 104.179 1.00 0.00 H TER 65281 WAT 8900 ATOM 65281 O WAT 8901 105.724 102.777 11.645 1.00 0.00 O ATOM 65282 H1 WAT 8901 105.760 101.904 11.255 1.00 0.00 H ATOM 65283 H2 WAT 8901 105.537 103.360 10.909 1.00 0.00 H TER 65285 WAT 8901 ATOM 65285 O WAT 8902 46.991 125.354 14.275 1.00 0.00 O ATOM 65286 H1 WAT 8902 47.416 124.935 15.023 1.00 0.00 H ATOM 65287 H2 WAT 8902 47.169 124.768 13.539 1.00 0.00 H TER 65289 WAT 8902 ATOM 65289 O WAT 8903 42.935 93.702 81.108 1.00 0.00 O ATOM 65290 H1 WAT 8903 42.156 93.199 81.344 1.00 0.00 H ATOM 65291 H2 WAT 8903 42.762 94.582 81.442 1.00 0.00 H TER 65293 WAT 8903 ATOM 65293 O WAT 8904 25.488 12.567 73.378 1.00 0.00 O ATOM 65294 H1 WAT 8904 25.824 12.848 74.229 1.00 0.00 H ATOM 65295 H2 WAT 8904 26.233 12.137 72.957 1.00 0.00 H TER 65297 WAT 8904 ATOM 65297 O WAT 8905 69.702 88.517 18.951 1.00 0.00 O ATOM 65298 H1 WAT 8905 69.870 88.678 18.022 1.00 0.00 H ATOM 65299 H2 WAT 8905 69.838 89.368 19.369 1.00 0.00 H TER 65301 WAT 8905 ATOM 65301 O WAT 8906 105.486 12.298 64.454 1.00 0.00 O ATOM 65302 H1 WAT 8906 106.315 11.922 64.750 1.00 0.00 H ATOM 65303 H2 WAT 8906 104.930 12.296 65.233 1.00 0.00 H TER 65305 WAT 8906 ATOM 65305 O WAT 8907 72.633 21.394 101.824 1.00 0.00 O ATOM 65306 H1 WAT 8907 72.750 20.871 102.617 1.00 0.00 H ATOM 65307 H2 WAT 8907 71.967 20.923 101.323 1.00 0.00 H TER 65309 WAT 8907 ATOM 65309 O WAT 8908 122.034 19.191 155.545 1.00 0.00 O ATOM 65310 H1 WAT 8908 121.477 19.339 156.309 1.00 0.00 H ATOM 65311 H2 WAT 8908 122.315 20.067 155.280 1.00 0.00 H TER 65313 WAT 8908 ATOM 65313 O WAT 8909 135.244 142.771 84.747 1.00 0.00 O ATOM 65314 H1 WAT 8909 135.232 142.421 83.856 1.00 0.00 H ATOM 65315 H2 WAT 8909 134.792 143.611 84.681 1.00 0.00 H TER 65317 WAT 8909 ATOM 65317 O WAT 8910 127.196 33.770 103.404 1.00 0.00 O ATOM 65318 H1 WAT 8910 127.258 34.480 104.043 1.00 0.00 H ATOM 65319 H2 WAT 8910 127.980 33.243 103.553 1.00 0.00 H TER 65321 WAT 8910 ATOM 65321 O WAT 8911 64.688 129.171 93.788 1.00 0.00 O ATOM 65322 H1 WAT 8911 64.024 129.249 93.103 1.00 0.00 H ATOM 65323 H2 WAT 8911 64.602 128.271 94.103 1.00 0.00 H TER 65325 WAT 8911 ATOM 65325 O WAT 8912 1.424 89.938 104.682 1.00 0.00 O ATOM 65326 H1 WAT 8912 2.089 89.653 105.309 1.00 0.00 H ATOM 65327 H2 WAT 8912 1.113 90.775 105.028 1.00 0.00 H TER 65329 WAT 8912 ATOM 65329 O WAT 8913 31.522 63.135 3.370 1.00 0.00 O ATOM 65330 H1 WAT 8913 31.532 63.186 4.326 1.00 0.00 H ATOM 65331 H2 WAT 8913 31.522 62.197 3.180 1.00 0.00 H TER 65333 WAT 8913 ATOM 65333 O WAT 8914 24.694 137.329 152.394 1.00 0.00 O ATOM 65334 H1 WAT 8914 24.765 136.841 151.573 1.00 0.00 H ATOM 65335 H2 WAT 8914 25.576 137.304 152.763 1.00 0.00 H TER 65337 WAT 8914 ATOM 65337 O WAT 8915 12.822 71.807 56.049 1.00 0.00 O ATOM 65338 H1 WAT 8915 13.243 70.961 56.201 1.00 0.00 H ATOM 65339 H2 WAT 8915 12.124 71.848 56.703 1.00 0.00 H TER 65341 WAT 8915 ATOM 65341 O WAT 8916 98.989 114.690 87.752 1.00 0.00 O ATOM 65342 H1 WAT 8916 99.592 113.999 88.026 1.00 0.00 H ATOM 65343 H2 WAT 8916 98.308 114.694 88.425 1.00 0.00 H TER 65345 WAT 8916 ATOM 65345 O WAT 8917 64.482 110.054 71.332 1.00 0.00 O ATOM 65346 H1 WAT 8917 64.724 110.757 70.729 1.00 0.00 H ATOM 65347 H2 WAT 8917 65.120 110.118 72.043 1.00 0.00 H TER 65349 WAT 8917 ATOM 65349 O WAT 8918 2.847 119.054 86.875 1.00 0.00 O ATOM 65350 H1 WAT 8918 2.797 118.725 87.772 1.00 0.00 H ATOM 65351 H2 WAT 8918 2.941 120.002 86.972 1.00 0.00 H TER 65353 WAT 8918 ATOM 65353 O WAT 8919 13.059 102.053 151.478 1.00 0.00 O ATOM 65354 H1 WAT 8919 12.631 101.822 152.302 1.00 0.00 H ATOM 65355 H2 WAT 8919 12.663 101.470 150.831 1.00 0.00 H TER 65357 WAT 8919 ATOM 65357 O WAT 8920 133.048 30.091 130.978 1.00 0.00 O ATOM 65358 H1 WAT 8920 133.269 30.923 130.561 1.00 0.00 H ATOM 65359 H2 WAT 8920 133.394 30.170 131.867 1.00 0.00 H TER 65361 WAT 8920 ATOM 65361 O WAT 8921 145.320 142.015 21.372 1.00 0.00 O ATOM 65362 H1 WAT 8921 146.026 142.517 20.966 1.00 0.00 H ATOM 65363 H2 WAT 8921 145.168 142.451 22.211 1.00 0.00 H TER 65365 WAT 8921 ATOM 65365 O WAT 8922 119.349 89.353 90.234 1.00 0.00 O ATOM 65366 H1 WAT 8922 119.455 90.237 89.882 1.00 0.00 H ATOM 65367 H2 WAT 8922 119.615 88.776 89.518 1.00 0.00 H TER 65369 WAT 8922 ATOM 65369 O WAT 8923 13.846 11.257 108.622 1.00 0.00 O ATOM 65370 H1 WAT 8923 13.996 12.175 108.848 1.00 0.00 H ATOM 65371 H2 WAT 8923 14.568 10.786 109.037 1.00 0.00 H TER 65373 WAT 8923 ATOM 65373 O WAT 8924 34.628 65.288 78.855 1.00 0.00 O ATOM 65374 H1 WAT 8924 34.003 65.821 78.363 1.00 0.00 H ATOM 65375 H2 WAT 8924 34.127 64.961 79.602 1.00 0.00 H TER 65377 WAT 8924 ATOM 65377 O WAT 8925 54.076 113.961 7.870 1.00 0.00 O ATOM 65378 H1 WAT 8925 54.611 113.202 8.101 1.00 0.00 H ATOM 65379 H2 WAT 8925 54.684 114.558 7.433 1.00 0.00 H TER 65381 WAT 8925 ATOM 65381 O WAT 8926 134.292 105.809 10.887 1.00 0.00 O ATOM 65382 H1 WAT 8926 133.739 105.036 10.996 1.00 0.00 H ATOM 65383 H2 WAT 8926 135.078 105.617 11.399 1.00 0.00 H TER 65385 WAT 8926 ATOM 65385 O WAT 8927 58.234 20.085 138.764 1.00 0.00 O ATOM 65386 H1 WAT 8927 58.833 19.369 138.979 1.00 0.00 H ATOM 65387 H2 WAT 8927 58.604 20.478 137.974 1.00 0.00 H TER 65389 WAT 8927 ATOM 65389 O WAT 8928 56.053 52.685 113.584 1.00 0.00 O ATOM 65390 H1 WAT 8928 55.343 52.832 114.209 1.00 0.00 H ATOM 65391 H2 WAT 8928 55.610 52.466 112.765 1.00 0.00 H TER 65393 WAT 8928 ATOM 65393 O WAT 8929 141.186 93.637 143.310 1.00 0.00 O ATOM 65394 H1 WAT 8929 142.073 93.953 143.486 1.00 0.00 H ATOM 65395 H2 WAT 8929 140.710 93.793 144.125 1.00 0.00 H TER 65397 WAT 8929 ATOM 65397 O WAT 8930 142.575 2.154 7.090 1.00 0.00 O ATOM 65398 H1 WAT 8930 142.933 2.607 7.853 1.00 0.00 H ATOM 65399 H2 WAT 8930 141.685 2.497 7.004 1.00 0.00 H TER 65401 WAT 8930 ATOM 65401 O WAT 8931 73.764 75.785 13.852 1.00 0.00 O ATOM 65402 H1 WAT 8931 72.844 75.541 13.752 1.00 0.00 H ATOM 65403 H2 WAT 8931 73.802 76.699 13.569 1.00 0.00 H TER 65405 WAT 8931 ATOM 65405 O WAT 8932 11.532 100.829 14.412 1.00 0.00 O ATOM 65406 H1 WAT 8932 11.336 100.029 14.899 1.00 0.00 H ATOM 65407 H2 WAT 8932 10.679 101.241 14.275 1.00 0.00 H TER 65409 WAT 8932 ATOM 65409 O WAT 8933 34.551 110.576 111.569 1.00 0.00 O ATOM 65410 H1 WAT 8933 33.773 111.040 111.879 1.00 0.00 H ATOM 65411 H2 WAT 8933 35.016 110.328 112.368 1.00 0.00 H TER 65413 WAT 8933 ATOM 65413 O WAT 8934 17.919 25.413 10.584 1.00 0.00 O ATOM 65414 H1 WAT 8934 17.262 25.561 11.264 1.00 0.00 H ATOM 65415 H2 WAT 8934 18.202 24.509 10.716 1.00 0.00 H TER 65417 WAT 8934 ATOM 65417 O WAT 8935 36.929 44.883 62.153 1.00 0.00 O ATOM 65418 H1 WAT 8935 37.415 44.319 61.552 1.00 0.00 H ATOM 65419 H2 WAT 8935 37.152 45.773 61.881 1.00 0.00 H TER 65421 WAT 8935 ATOM 65421 O WAT 8936 142.157 55.132 62.592 1.00 0.00 O ATOM 65422 H1 WAT 8936 141.995 55.321 61.668 1.00 0.00 H ATOM 65423 H2 WAT 8936 143.086 54.907 62.631 1.00 0.00 H TER 65425 WAT 8936 ATOM 65425 O WAT 8937 130.157 122.464 62.573 1.00 0.00 O ATOM 65426 H1 WAT 8937 130.613 121.630 62.462 1.00 0.00 H ATOM 65427 H2 WAT 8937 130.794 123.124 62.299 1.00 0.00 H TER 65429 WAT 8937 ATOM 65429 O WAT 8938 138.301 31.037 64.348 1.00 0.00 O ATOM 65430 H1 WAT 8938 139.250 31.127 64.442 1.00 0.00 H ATOM 65431 H2 WAT 8938 138.032 31.824 63.874 1.00 0.00 H TER 65433 WAT 8938 ATOM 65433 O WAT 8939 114.730 136.802 140.317 1.00 0.00 O ATOM 65434 H1 WAT 8939 115.282 136.035 140.467 1.00 0.00 H ATOM 65435 H2 WAT 8939 114.375 136.674 139.438 1.00 0.00 H TER 65437 WAT 8939 ATOM 65437 O WAT 8940 97.580 64.329 57.630 1.00 0.00 O ATOM 65438 H1 WAT 8940 97.297 65.242 57.679 1.00 0.00 H ATOM 65439 H2 WAT 8940 98.205 64.233 58.348 1.00 0.00 H TER 65441 WAT 8940 ATOM 65441 O WAT 8941 2.152 27.165 114.106 1.00 0.00 O ATOM 65442 H1 WAT 8941 1.679 27.481 114.876 1.00 0.00 H ATOM 65443 H2 WAT 8941 3.065 27.399 114.272 1.00 0.00 H TER 65445 WAT 8941 ATOM 65445 O WAT 8942 23.833 95.163 0.153 1.00 0.00 O ATOM 65446 H1 WAT 8942 22.950 95.509 0.282 1.00 0.00 H ATOM 65447 H2 WAT 8942 24.412 95.889 0.388 1.00 0.00 H TER 65449 WAT 8942 ATOM 65449 O WAT 8943 4.276 91.499 3.242 1.00 0.00 O ATOM 65450 H1 WAT 8943 4.422 90.982 4.035 1.00 0.00 H ATOM 65451 H2 WAT 8943 3.639 90.991 2.739 1.00 0.00 H TER 65453 WAT 8943 ATOM 65453 O WAT 8944 65.213 143.239 7.667 1.00 0.00 O ATOM 65454 H1 WAT 8944 66.132 143.506 7.686 1.00 0.00 H ATOM 65455 H2 WAT 8944 64.921 143.320 8.575 1.00 0.00 H TER 65457 WAT 8944 ATOM 65457 O WAT 8945 32.623 135.368 18.952 1.00 0.00 O ATOM 65458 H1 WAT 8945 31.880 135.065 19.474 1.00 0.00 H ATOM 65459 H2 WAT 8945 33.360 135.369 19.563 1.00 0.00 H TER 65461 WAT 8945 ATOM 65461 O WAT 8946 38.615 106.337 92.468 1.00 0.00 O ATOM 65462 H1 WAT 8946 37.668 106.228 92.553 1.00 0.00 H ATOM 65463 H2 WAT 8946 38.981 105.803 93.173 1.00 0.00 H TER 65465 WAT 8946 ATOM 65465 O WAT 8947 20.164 129.683 121.345 1.00 0.00 O ATOM 65466 H1 WAT 8947 20.601 128.909 120.990 1.00 0.00 H ATOM 65467 H2 WAT 8947 19.505 129.908 120.688 1.00 0.00 H TER 65469 WAT 8947 ATOM 65469 O WAT 8948 91.964 28.456 146.772 1.00 0.00 O ATOM 65470 H1 WAT 8948 91.146 28.224 146.334 1.00 0.00 H ATOM 65471 H2 WAT 8948 91.942 27.971 147.596 1.00 0.00 H TER 65473 WAT 8948 ATOM 65473 O WAT 8949 79.310 65.403 112.577 1.00 0.00 O ATOM 65474 H1 WAT 8949 78.653 64.749 112.814 1.00 0.00 H ATOM 65475 H2 WAT 8949 78.801 66.163 112.296 1.00 0.00 H TER 65477 WAT 8949 ATOM 65477 O WAT 8950 30.477 6.689 100.578 1.00 0.00 O ATOM 65478 H1 WAT 8950 30.388 5.793 100.254 1.00 0.00 H ATOM 65479 H2 WAT 8950 31.333 6.975 100.260 1.00 0.00 H TER 65481 WAT 8950 ATOM 65481 O WAT 8951 21.450 68.275 125.193 1.00 0.00 O ATOM 65482 H1 WAT 8951 20.576 68.665 125.202 1.00 0.00 H ATOM 65483 H2 WAT 8951 21.971 68.842 125.761 1.00 0.00 H TER 65485 WAT 8951 ATOM 65485 O WAT 8952 45.448 95.358 7.391 1.00 0.00 O ATOM 65486 H1 WAT 8952 45.411 96.140 7.941 1.00 0.00 H ATOM 65487 H2 WAT 8952 45.394 95.693 6.495 1.00 0.00 H TER 65489 WAT 8952 ATOM 65489 O WAT 8953 140.026 0.940 109.611 1.00 0.00 O ATOM 65490 H1 WAT 8953 139.781 0.505 110.428 1.00 0.00 H ATOM 65491 H2 WAT 8953 140.743 0.409 109.263 1.00 0.00 H TER 65493 WAT 8953 ATOM 65493 O WAT 8954 41.756 8.023 90.428 1.00 0.00 O ATOM 65494 H1 WAT 8954 41.708 7.295 89.809 1.00 0.00 H ATOM 65495 H2 WAT 8954 41.294 8.739 89.993 1.00 0.00 H TER 65497 WAT 8954 ATOM 65497 O WAT 8955 89.550 133.756 106.529 1.00 0.00 O ATOM 65498 H1 WAT 8955 89.466 132.806 106.450 1.00 0.00 H ATOM 65499 H2 WAT 8955 88.789 134.104 106.066 1.00 0.00 H TER 65501 WAT 8955 ATOM 65501 O WAT 8956 133.556 88.783 124.845 1.00 0.00 O ATOM 65502 H1 WAT 8956 133.270 88.531 125.723 1.00 0.00 H ATOM 65503 H2 WAT 8956 132.762 88.739 124.312 1.00 0.00 H TER 65505 WAT 8956 ATOM 65505 O WAT 8957 100.841 6.213 93.799 1.00 0.00 O ATOM 65506 H1 WAT 8957 100.076 5.779 93.422 1.00 0.00 H ATOM 65507 H2 WAT 8957 100.584 7.133 93.869 1.00 0.00 H TER 65509 WAT 8957 ATOM 65509 O WAT 8958 40.837 124.906 89.810 1.00 0.00 O ATOM 65510 H1 WAT 8958 40.281 124.882 89.031 1.00 0.00 H ATOM 65511 H2 WAT 8958 40.993 123.986 90.022 1.00 0.00 H TER 65513 WAT 8958 ATOM 65513 O WAT 8959 89.722 114.647 65.896 1.00 0.00 O ATOM 65514 H1 WAT 8959 90.405 114.858 65.259 1.00 0.00 H ATOM 65515 H2 WAT 8959 88.952 114.444 65.365 1.00 0.00 H TER 65517 WAT 8959 ATOM 65517 O WAT 8960 80.648 116.684 127.285 1.00 0.00 O ATOM 65518 H1 WAT 8960 79.723 116.709 127.039 1.00 0.00 H ATOM 65519 H2 WAT 8960 81.020 117.477 126.898 1.00 0.00 H TER 65521 WAT 8960 ATOM 65521 O WAT 8961 142.323 53.905 112.895 1.00 0.00 O ATOM 65522 H1 WAT 8961 141.847 54.696 112.645 1.00 0.00 H ATOM 65523 H2 WAT 8961 143.240 54.109 112.712 1.00 0.00 H TER 65525 WAT 8961 ATOM 65525 O WAT 8962 63.568 91.452 82.861 1.00 0.00 O ATOM 65526 H1 WAT 8962 62.915 91.342 82.170 1.00 0.00 H ATOM 65527 H2 WAT 8962 64.197 90.746 82.710 1.00 0.00 H TER 65529 WAT 8962 ATOM 65529 O WAT 8963 10.258 64.696 82.726 1.00 0.00 O ATOM 65530 H1 WAT 8963 9.662 64.493 83.446 1.00 0.00 H ATOM 65531 H2 WAT 8963 10.943 65.232 83.125 1.00 0.00 H TER 65533 WAT 8963 ATOM 65533 O WAT 8964 134.848 25.024 67.815 1.00 0.00 O ATOM 65534 H1 WAT 8964 135.599 25.433 67.385 1.00 0.00 H ATOM 65535 H2 WAT 8964 134.876 25.355 68.713 1.00 0.00 H TER 65537 WAT 8964 ATOM 65537 O WAT 8965 110.920 77.985 94.714 1.00 0.00 O ATOM 65538 H1 WAT 8965 110.303 77.328 94.391 1.00 0.00 H ATOM 65539 H2 WAT 8965 111.628 77.476 95.108 1.00 0.00 H TER 65541 WAT 8965 ATOM 65541 O WAT 8966 74.086 77.169 64.294 1.00 0.00 O ATOM 65542 H1 WAT 8966 74.728 77.307 64.990 1.00 0.00 H ATOM 65543 H2 WAT 8966 74.181 77.933 63.725 1.00 0.00 H TER 65545 WAT 8966 ATOM 65545 O WAT 8967 96.598 71.076 138.820 1.00 0.00 O ATOM 65546 H1 WAT 8967 96.600 70.408 139.506 1.00 0.00 H ATOM 65547 H2 WAT 8967 97.048 71.824 139.212 1.00 0.00 H TER 65549 WAT 8967 ATOM 65549 O WAT 8968 125.646 60.767 148.832 1.00 0.00 O ATOM 65550 H1 WAT 8968 125.434 60.781 147.899 1.00 0.00 H ATOM 65551 H2 WAT 8968 125.365 61.623 149.155 1.00 0.00 H TER 65553 WAT 8968 ATOM 65553 O WAT 8969 131.372 84.025 143.432 1.00 0.00 O ATOM 65554 H1 WAT 8969 131.216 84.212 142.506 1.00 0.00 H ATOM 65555 H2 WAT 8969 131.848 83.194 143.432 1.00 0.00 H TER 65557 WAT 8969 ATOM 65557 O WAT 8970 49.622 8.122 83.232 1.00 0.00 O ATOM 65558 H1 WAT 8970 49.151 7.333 83.501 1.00 0.00 H ATOM 65559 H2 WAT 8970 49.317 8.291 82.341 1.00 0.00 H TER 65561 WAT 8970 ATOM 65561 O WAT 8971 15.381 7.082 54.345 1.00 0.00 O ATOM 65562 H1 WAT 8971 15.179 6.831 53.443 1.00 0.00 H ATOM 65563 H2 WAT 8971 16.294 6.822 54.467 1.00 0.00 H TER 65565 WAT 8971 ATOM 65565 O WAT 8972 66.101 50.856 2.535 1.00 0.00 O ATOM 65566 H1 WAT 8972 66.918 50.742 2.048 1.00 0.00 H ATOM 65567 H2 WAT 8972 66.225 51.670 3.024 1.00 0.00 H TER 65569 WAT 8972 ATOM 65569 O WAT 8973 118.080 102.867 12.921 1.00 0.00 O ATOM 65570 H1 WAT 8973 117.454 103.544 12.667 1.00 0.00 H ATOM 65571 H2 WAT 8973 118.291 103.066 13.833 1.00 0.00 H TER 65573 WAT 8973 ATOM 65573 O WAT 8974 94.914 20.661 157.795 1.00 0.00 O ATOM 65574 H1 WAT 8974 95.737 20.341 158.163 1.00 0.00 H ATOM 65575 H2 WAT 8974 94.239 20.135 158.223 1.00 0.00 H TER 65577 WAT 8974 ATOM 65577 O WAT 8975 62.245 120.434 90.294 1.00 0.00 O ATOM 65578 H1 WAT 8975 62.659 119.603 90.059 1.00 0.00 H ATOM 65579 H2 WAT 8975 61.861 120.750 89.476 1.00 0.00 H TER 65581 WAT 8975 ATOM 65581 O WAT 8976 60.157 12.826 26.307 1.00 0.00 O ATOM 65582 H1 WAT 8976 59.576 13.586 26.353 1.00 0.00 H ATOM 65583 H2 WAT 8976 59.699 12.208 25.738 1.00 0.00 H TER 65585 WAT 8976 ATOM 65585 O WAT 8977 97.254 26.319 84.134 1.00 0.00 O ATOM 65586 H1 WAT 8977 97.577 25.426 84.014 1.00 0.00 H ATOM 65587 H2 WAT 8977 96.317 26.215 84.299 1.00 0.00 H TER 65589 WAT 8977 ATOM 65589 O WAT 8978 18.887 53.649 12.158 1.00 0.00 O ATOM 65590 H1 WAT 8978 19.525 53.107 11.694 1.00 0.00 H ATOM 65591 H2 WAT 8978 19.056 53.477 13.085 1.00 0.00 H TER 65593 WAT 8978 ATOM 65593 O WAT 8979 125.708 70.786 117.654 1.00 0.00 O ATOM 65594 H1 WAT 8979 124.944 70.381 118.063 1.00 0.00 H ATOM 65595 H2 WAT 8979 126.276 71.022 118.388 1.00 0.00 H TER 65597 WAT 8979 ATOM 65597 O WAT 8980 3.290 62.258 146.081 1.00 0.00 O ATOM 65598 H1 WAT 8980 2.727 62.989 146.336 1.00 0.00 H ATOM 65599 H2 WAT 8980 2.866 61.887 145.308 1.00 0.00 H TER 65601 WAT 8980 ATOM 65601 O WAT 8981 51.395 2.651 8.751 1.00 0.00 O ATOM 65602 H1 WAT 8981 50.839 2.069 8.233 1.00 0.00 H ATOM 65603 H2 WAT 8981 50.783 3.249 9.179 1.00 0.00 H TER 65605 WAT 8981 ATOM 65605 O WAT 8982 145.821 19.287 113.685 1.00 0.00 O ATOM 65606 H1 WAT 8982 146.021 19.160 114.612 1.00 0.00 H ATOM 65607 H2 WAT 8982 145.344 18.496 113.433 1.00 0.00 H TER 65609 WAT 8982 ATOM 65609 O WAT 8983 97.479 6.979 113.390 1.00 0.00 O ATOM 65610 H1 WAT 8983 98.323 6.664 113.065 1.00 0.00 H ATOM 65611 H2 WAT 8983 97.283 7.743 112.846 1.00 0.00 H TER 65613 WAT 8983 ATOM 65613 O WAT 8984 136.596 101.710 88.777 1.00 0.00 O ATOM 65614 H1 WAT 8984 136.891 101.486 87.894 1.00 0.00 H ATOM 65615 H2 WAT 8984 135.748 101.275 88.863 1.00 0.00 H TER 65617 WAT 8984 ATOM 65617 O WAT 8985 71.533 90.086 77.252 1.00 0.00 O ATOM 65618 H1 WAT 8985 70.924 89.790 76.575 1.00 0.00 H ATOM 65619 H2 WAT 8985 71.042 90.743 77.745 1.00 0.00 H TER 65621 WAT 8985 ATOM 65621 O WAT 8986 75.381 128.099 98.033 1.00 0.00 O ATOM 65622 H1 WAT 8986 76.065 127.560 97.635 1.00 0.00 H ATOM 65623 H2 WAT 8986 74.571 127.616 97.871 1.00 0.00 H TER 65625 WAT 8986 ATOM 65625 O WAT 8987 39.601 109.107 86.253 1.00 0.00 O ATOM 65626 H1 WAT 8987 39.544 108.311 86.780 1.00 0.00 H ATOM 65627 H2 WAT 8987 38.925 109.001 85.583 1.00 0.00 H TER 65629 WAT 8987 ATOM 65629 O WAT 8988 12.453 108.365 150.950 1.00 0.00 O ATOM 65630 H1 WAT 8988 13.010 109.120 150.761 1.00 0.00 H ATOM 65631 H2 WAT 8988 11.564 108.719 150.955 1.00 0.00 H TER 65633 WAT 8988 ATOM 65633 O WAT 8989 46.409 8.121 89.757 1.00 0.00 O ATOM 65634 H1 WAT 8989 46.488 8.827 89.116 1.00 0.00 H ATOM 65635 H2 WAT 8989 46.319 7.327 89.230 1.00 0.00 H TER 65637 WAT 8989 ATOM 65637 O WAT 8990 63.744 89.183 2.388 1.00 0.00 O ATOM 65638 H1 WAT 8990 64.584 89.635 2.312 1.00 0.00 H ATOM 65639 H2 WAT 8990 63.934 88.412 2.922 1.00 0.00 H TER 65641 WAT 8990 ATOM 65641 O WAT 8991 74.923 113.638 145.895 1.00 0.00 O ATOM 65642 H1 WAT 8991 74.434 114.133 146.553 1.00 0.00 H ATOM 65643 H2 WAT 8991 74.568 112.751 145.950 1.00 0.00 H TER 65645 WAT 8991 ATOM 65645 O WAT 8992 90.542 142.527 72.738 1.00 0.00 O ATOM 65646 H1 WAT 8992 90.068 141.696 72.772 1.00 0.00 H ATOM 65647 H2 WAT 8992 90.995 142.578 73.580 1.00 0.00 H TER 65649 WAT 8992 ATOM 65649 O WAT 8993 118.446 103.910 148.165 1.00 0.00 O ATOM 65650 H1 WAT 8993 118.935 103.260 147.662 1.00 0.00 H ATOM 65651 H2 WAT 8993 118.849 104.747 147.931 1.00 0.00 H TER 65653 WAT 8993 ATOM 65653 O WAT 8994 125.403 76.968 114.100 1.00 0.00 O ATOM 65654 H1 WAT 8994 125.142 77.234 114.982 1.00 0.00 H ATOM 65655 H2 WAT 8994 125.679 77.781 113.677 1.00 0.00 H TER 65657 WAT 8994 ATOM 65657 O WAT 8995 126.697 106.945 83.740 1.00 0.00 O ATOM 65658 H1 WAT 8995 127.115 106.472 83.021 1.00 0.00 H ATOM 65659 H2 WAT 8995 126.209 107.649 83.312 1.00 0.00 H TER 65661 WAT 8995 ATOM 65661 O WAT 8996 73.838 13.397 66.596 1.00 0.00 O ATOM 65662 H1 WAT 8996 74.112 12.880 65.838 1.00 0.00 H ATOM 65663 H2 WAT 8996 74.590 13.369 67.188 1.00 0.00 H TER 65665 WAT 8996 ATOM 65665 O WAT 8997 69.310 39.302 115.254 1.00 0.00 O ATOM 65666 H1 WAT 8997 69.076 39.454 114.339 1.00 0.00 H ATOM 65667 H2 WAT 8997 69.075 38.387 115.412 1.00 0.00 H TER 65669 WAT 8997 ATOM 65669 O WAT 8998 14.736 120.998 141.253 1.00 0.00 O ATOM 65670 H1 WAT 8998 15.518 121.433 140.913 1.00 0.00 H ATOM 65671 H2 WAT 8998 14.449 121.553 141.978 1.00 0.00 H TER 65673 WAT 8998 ATOM 65673 O WAT 8999 100.943 81.153 149.652 1.00 0.00 O ATOM 65674 H1 WAT 8999 100.811 80.440 149.027 1.00 0.00 H ATOM 65675 H2 WAT 8999 101.378 81.839 149.144 1.00 0.00 H TER 65677 WAT 8999 ATOM 65677 O WAT 9000 46.530 16.104 125.734 1.00 0.00 O ATOM 65678 H1 WAT 9000 45.870 16.784 125.867 1.00 0.00 H ATOM 65679 H2 WAT 9000 46.803 15.859 126.618 1.00 0.00 H TER 65681 WAT 9000 ATOM 65681 O WAT 9001 49.696 129.130 100.929 1.00 0.00 O ATOM 65682 H1 WAT 9001 49.519 128.247 100.606 1.00 0.00 H ATOM 65683 H2 WAT 9001 49.733 129.671 100.140 1.00 0.00 H TER 65685 WAT 9001 ATOM 65685 O WAT 9002 74.368 100.820 140.265 1.00 0.00 O ATOM 65686 H1 WAT 9002 73.521 100.655 139.851 1.00 0.00 H ATOM 65687 H2 WAT 9002 74.599 99.987 140.678 1.00 0.00 H TER 65689 WAT 9002 ATOM 65689 O WAT 9003 19.951 133.166 8.802 1.00 0.00 O ATOM 65690 H1 WAT 9003 20.804 133.397 9.168 1.00 0.00 H ATOM 65691 H2 WAT 9003 19.320 133.463 9.458 1.00 0.00 H TER 65693 WAT 9003 ATOM 65693 O WAT 9004 135.421 17.247 93.451 1.00 0.00 O ATOM 65694 H1 WAT 9004 135.102 17.700 92.670 1.00 0.00 H ATOM 65695 H2 WAT 9004 135.121 17.787 94.181 1.00 0.00 H TER 65697 WAT 9004 ATOM 65697 O WAT 9005 33.677 118.686 86.381 1.00 0.00 O ATOM 65698 H1 WAT 9005 32.833 118.852 85.962 1.00 0.00 H ATOM 65699 H2 WAT 9005 34.273 118.501 85.655 1.00 0.00 H TER 65701 WAT 9005 ATOM 65701 O WAT 9006 49.038 22.208 138.276 1.00 0.00 O ATOM 65702 H1 WAT 9006 49.559 21.422 138.113 1.00 0.00 H ATOM 65703 H2 WAT 9006 49.470 22.632 139.017 1.00 0.00 H TER 65705 WAT 9006 ATOM 65705 O WAT 9007 87.110 112.594 147.794 1.00 0.00 O ATOM 65706 H1 WAT 9007 87.313 112.336 146.894 1.00 0.00 H ATOM 65707 H2 WAT 9007 87.370 113.514 147.842 1.00 0.00 H TER 65709 WAT 9007 ATOM 65709 O WAT 9008 4.404 62.149 24.716 1.00 0.00 O ATOM 65710 H1 WAT 9008 3.766 61.551 25.106 1.00 0.00 H ATOM 65711 H2 WAT 9008 3.935 62.557 23.987 1.00 0.00 H TER 65713 WAT 9008 ATOM 65713 O WAT 9009 139.697 91.403 93.375 1.00 0.00 O ATOM 65714 H1 WAT 9009 140.447 91.812 93.807 1.00 0.00 H ATOM 65715 H2 WAT 9009 139.261 92.123 92.919 1.00 0.00 H TER 65717 WAT 9009 ATOM 65717 O WAT 9010 55.598 94.402 104.499 1.00 0.00 O ATOM 65718 H1 WAT 9010 55.092 94.257 103.699 1.00 0.00 H ATOM 65719 H2 WAT 9010 55.441 95.321 104.718 1.00 0.00 H TER 65721 WAT 9010 ATOM 65721 O WAT 9011 22.822 75.839 93.852 1.00 0.00 O ATOM 65722 H1 WAT 9011 22.781 75.705 92.906 1.00 0.00 H ATOM 65723 H2 WAT 9011 22.316 76.637 94.003 1.00 0.00 H TER 65725 WAT 9011 ATOM 65725 O WAT 9012 106.818 35.677 149.360 1.00 0.00 O ATOM 65726 H1 WAT 9012 107.753 35.620 149.163 1.00 0.00 H ATOM 65727 H2 WAT 9012 106.745 35.367 150.263 1.00 0.00 H TER 65729 WAT 9012 ATOM 65729 O WAT 9013 19.983 87.440 0.937 1.00 0.00 O ATOM 65730 H1 WAT 9013 20.829 87.672 0.554 1.00 0.00 H ATOM 65731 H2 WAT 9013 20.070 86.515 1.168 1.00 0.00 H TER 65733 WAT 9013 ATOM 65733 O WAT 9014 10.234 125.741 2.084 1.00 0.00 O ATOM 65734 H1 WAT 9014 9.423 126.236 2.201 1.00 0.00 H ATOM 65735 H2 WAT 9014 10.301 125.610 1.139 1.00 0.00 H TER 65737 WAT 9014 ATOM 65737 O WAT 9015 6.780 82.151 56.983 1.00 0.00 O ATOM 65738 H1 WAT 9015 6.699 81.198 57.035 1.00 0.00 H ATOM 65739 H2 WAT 9015 6.281 82.474 57.733 1.00 0.00 H TER 65741 WAT 9015 ATOM 65741 O WAT 9016 129.546 132.951 144.570 1.00 0.00 O ATOM 65742 H1 WAT 9016 129.063 133.677 144.174 1.00 0.00 H ATOM 65743 H2 WAT 9016 129.148 132.840 145.433 1.00 0.00 H TER 65745 WAT 9016 ATOM 65745 O WAT 9017 83.703 38.299 86.524 1.00 0.00 O ATOM 65746 H1 WAT 9017 83.331 37.643 85.934 1.00 0.00 H ATOM 65747 H2 WAT 9017 84.542 37.927 86.797 1.00 0.00 H TER 65749 WAT 9017 ATOM 65749 O WAT 9018 81.765 78.621 144.040 1.00 0.00 O ATOM 65750 H1 WAT 9018 81.137 79.129 143.525 1.00 0.00 H ATOM 65751 H2 WAT 9018 82.599 78.742 143.587 1.00 0.00 H TER 65753 WAT 9018 ATOM 65753 O WAT 9019 91.642 145.022 139.066 1.00 0.00 O ATOM 65754 H1 WAT 9019 91.620 145.972 139.176 1.00 0.00 H ATOM 65755 H2 WAT 9019 91.934 144.688 139.914 1.00 0.00 H TER 65757 WAT 9019 ATOM 65757 O WAT 9020 35.511 41.342 68.767 1.00 0.00 O ATOM 65758 H1 WAT 9020 35.776 41.580 69.655 1.00 0.00 H ATOM 65759 H2 WAT 9020 34.976 42.078 68.470 1.00 0.00 H TER 65761 WAT 9020 ATOM 65761 O WAT 9021 72.906 101.042 128.248 1.00 0.00 O ATOM 65762 H1 WAT 9021 72.611 100.293 127.730 1.00 0.00 H ATOM 65763 H2 WAT 9021 72.589 100.861 129.133 1.00 0.00 H TER 65765 WAT 9021 ATOM 65765 O WAT 9022 69.206 6.461 28.368 1.00 0.00 O ATOM 65766 H1 WAT 9022 68.520 5.803 28.480 1.00 0.00 H ATOM 65767 H2 WAT 9022 68.812 7.274 28.683 1.00 0.00 H TER 65769 WAT 9022 ATOM 65769 O WAT 9023 13.718 1.427 141.105 1.00 0.00 O ATOM 65770 H1 WAT 9023 13.285 1.183 140.287 1.00 0.00 H ATOM 65771 H2 WAT 9023 13.882 2.366 141.018 1.00 0.00 H TER 65773 WAT 9023 ATOM 65773 O WAT 9024 30.333 86.027 86.847 1.00 0.00 O ATOM 65774 H1 WAT 9024 30.596 86.849 87.261 1.00 0.00 H ATOM 65775 H2 WAT 9024 30.799 85.351 87.339 1.00 0.00 H TER 65777 WAT 9024 ATOM 65777 O WAT 9025 123.613 31.975 76.005 1.00 0.00 O ATOM 65778 H1 WAT 9025 124.042 32.437 75.285 1.00 0.00 H ATOM 65779 H2 WAT 9025 124.190 32.114 76.756 1.00 0.00 H TER 65781 WAT 9025 ATOM 65781 O WAT 9026 20.319 143.156 69.337 1.00 0.00 O ATOM 65782 H1 WAT 9026 20.384 143.560 70.203 1.00 0.00 H ATOM 65783 H2 WAT 9026 21.195 143.252 68.962 1.00 0.00 H TER 65785 WAT 9026 ATOM 65785 O WAT 9027 14.379 141.905 81.024 1.00 0.00 O ATOM 65786 H1 WAT 9027 14.736 141.122 81.444 1.00 0.00 H ATOM 65787 H2 WAT 9027 13.755 142.254 81.660 1.00 0.00 H TER 65789 WAT 9027 ATOM 65789 O WAT 9028 18.187 57.122 8.562 1.00 0.00 O ATOM 65790 H1 WAT 9028 18.883 56.635 9.004 1.00 0.00 H ATOM 65791 H2 WAT 9028 18.650 57.762 8.021 1.00 0.00 H TER 65793 WAT 9028 ATOM 65793 O WAT 9029 3.144 131.783 66.557 1.00 0.00 O ATOM 65794 H1 WAT 9029 2.496 131.476 67.190 1.00 0.00 H ATOM 65795 H2 WAT 9029 3.213 132.724 66.723 1.00 0.00 H TER 65797 WAT 9029 ATOM 65797 O WAT 9030 45.514 75.155 120.708 1.00 0.00 O ATOM 65798 H1 WAT 9030 46.371 74.755 120.854 1.00 0.00 H ATOM 65799 H2 WAT 9030 44.904 74.601 121.196 1.00 0.00 H TER 65801 WAT 9030 ATOM 65801 O WAT 9031 32.157 117.328 6.509 1.00 0.00 O ATOM 65802 H1 WAT 9031 31.394 117.797 6.845 1.00 0.00 H ATOM 65803 H2 WAT 9031 32.828 117.447 7.182 1.00 0.00 H TER 65805 WAT 9031 ATOM 65805 O WAT 9032 21.544 133.191 114.617 1.00 0.00 O ATOM 65806 H1 WAT 9032 21.891 132.847 113.794 1.00 0.00 H ATOM 65807 H2 WAT 9032 21.460 132.422 115.181 1.00 0.00 H TER 65809 WAT 9032 ATOM 65809 O WAT 9033 26.360 112.368 67.622 1.00 0.00 O ATOM 65810 H1 WAT 9033 25.676 112.113 67.003 1.00 0.00 H ATOM 65811 H2 WAT 9033 25.915 112.408 68.468 1.00 0.00 H TER 65813 WAT 9033 ATOM 65813 O WAT 9034 112.287 85.737 21.456 1.00 0.00 O ATOM 65814 H1 WAT 9034 112.447 86.314 22.202 1.00 0.00 H ATOM 65815 H2 WAT 9034 112.953 85.985 20.815 1.00 0.00 H TER 65817 WAT 9034 ATOM 65817 O WAT 9035 56.065 0.815 92.533 1.00 0.00 O ATOM 65818 H1 WAT 9035 55.253 0.997 92.060 1.00 0.00 H ATOM 65819 H2 WAT 9035 56.756 1.148 91.961 1.00 0.00 H TER 65821 WAT 9035 ATOM 65821 O WAT 9036 5.178 43.659 71.531 1.00 0.00 O ATOM 65822 H1 WAT 9036 5.978 43.470 72.020 1.00 0.00 H ATOM 65823 H2 WAT 9036 4.562 42.980 71.807 1.00 0.00 H TER 65825 WAT 9036 ATOM 65825 O WAT 9037 38.617 114.123 100.602 1.00 0.00 O ATOM 65826 H1 WAT 9037 38.176 114.650 101.268 1.00 0.00 H ATOM 65827 H2 WAT 9037 39.268 114.712 100.221 1.00 0.00 H TER 65829 WAT 9037 ATOM 65829 O WAT 9038 103.517 116.711 105.888 1.00 0.00 O ATOM 65830 H1 WAT 9038 103.568 116.400 106.791 1.00 0.00 H ATOM 65831 H2 WAT 9038 104.333 116.415 105.485 1.00 0.00 H TER 65833 WAT 9038 ATOM 65833 O WAT 9039 100.577 26.650 132.580 1.00 0.00 O ATOM 65834 H1 WAT 9039 100.741 27.543 132.277 1.00 0.00 H ATOM 65835 H2 WAT 9039 99.868 26.334 132.019 1.00 0.00 H TER 65837 WAT 9039 ATOM 65837 O WAT 9040 78.056 86.113 77.255 1.00 0.00 O ATOM 65838 H1 WAT 9040 78.459 85.273 77.475 1.00 0.00 H ATOM 65839 H2 WAT 9040 77.557 86.351 78.036 1.00 0.00 H TER 65841 WAT 9040 ATOM 65841 O WAT 9041 37.331 119.111 -0.136 1.00 0.00 O ATOM 65842 H1 WAT 9041 37.298 120.062 -0.246 1.00 0.00 H ATOM 65843 H2 WAT 9041 37.277 118.978 0.810 1.00 0.00 H TER 65845 WAT 9041 ATOM 65845 O WAT 9042 47.201 118.819 123.587 1.00 0.00 O ATOM 65846 H1 WAT 9042 47.198 119.213 124.459 1.00 0.00 H ATOM 65847 H2 WAT 9042 47.155 119.564 122.988 1.00 0.00 H TER 65849 WAT 9042 ATOM 65849 O WAT 9043 83.270 61.171 115.306 1.00 0.00 O ATOM 65850 H1 WAT 9043 82.405 61.218 115.715 1.00 0.00 H ATOM 65851 H2 WAT 9043 83.825 61.722 115.857 1.00 0.00 H TER 65853 WAT 9043 ATOM 65853 O WAT 9044 107.062 136.833 90.786 1.00 0.00 O ATOM 65854 H1 WAT 9044 107.726 137.249 91.336 1.00 0.00 H ATOM 65855 H2 WAT 9044 107.451 135.996 90.533 1.00 0.00 H TER 65857 WAT 9044 ATOM 65857 O WAT 9045 137.689 22.299 87.689 1.00 0.00 O ATOM 65858 H1 WAT 9045 137.200 22.348 88.510 1.00 0.00 H ATOM 65859 H2 WAT 9045 138.263 21.541 87.797 1.00 0.00 H TER 65861 WAT 9045 ATOM 65861 O WAT 9046 54.711 121.916 103.280 1.00 0.00 O ATOM 65862 H1 WAT 9046 54.557 122.069 102.348 1.00 0.00 H ATOM 65863 H2 WAT 9046 54.397 122.713 103.708 1.00 0.00 H TER 65865 WAT 9046 ATOM 65865 O WAT 9047 76.824 101.932 151.529 1.00 0.00 O ATOM 65866 H1 WAT 9047 76.770 102.817 151.168 1.00 0.00 H ATOM 65867 H2 WAT 9047 77.592 101.548 151.107 1.00 0.00 H TER 65869 WAT 9047 ATOM 65869 O WAT 9048 6.460 122.519 83.873 1.00 0.00 O ATOM 65870 H1 WAT 9048 5.809 121.959 84.297 1.00 0.00 H ATOM 65871 H2 WAT 9048 7.273 122.016 83.918 1.00 0.00 H TER 65873 WAT 9048 ATOM 65873 O WAT 9049 8.417 68.843 137.207 1.00 0.00 O ATOM 65874 H1 WAT 9049 8.166 68.488 136.354 1.00 0.00 H ATOM 65875 H2 WAT 9049 8.757 69.716 137.012 1.00 0.00 H TER 65877 WAT 9049 ATOM 65877 O WAT 9050 145.562 107.110 130.023 1.00 0.00 O ATOM 65878 H1 WAT 9050 145.818 107.603 129.244 1.00 0.00 H ATOM 65879 H2 WAT 9050 146.360 107.062 130.549 1.00 0.00 H TER 65881 WAT 9050 ATOM 65881 O WAT 9051 30.684 89.371 73.062 1.00 0.00 O ATOM 65882 H1 WAT 9051 30.233 88.547 73.245 1.00 0.00 H ATOM 65883 H2 WAT 9051 29.980 90.009 72.946 1.00 0.00 H TER 65885 WAT 9051 ATOM 65885 O WAT 9052 37.097 108.755 103.940 1.00 0.00 O ATOM 65886 H1 WAT 9052 37.901 108.775 103.422 1.00 0.00 H ATOM 65887 H2 WAT 9052 36.414 108.518 103.313 1.00 0.00 H TER 65889 WAT 9052 ATOM 65889 O WAT 9053 48.659 63.704 16.522 1.00 0.00 O ATOM 65890 H1 WAT 9053 47.749 63.994 16.589 1.00 0.00 H ATOM 65891 H2 WAT 9053 48.604 62.831 16.135 1.00 0.00 H TER 65893 WAT 9053 ATOM 65893 O WAT 9054 35.563 65.071 152.500 1.00 0.00 O ATOM 65894 H1 WAT 9054 36.378 64.668 152.200 1.00 0.00 H ATOM 65895 H2 WAT 9054 35.099 64.365 152.950 1.00 0.00 H TER 65897 WAT 9054 ATOM 65897 O WAT 9055 27.262 67.955 87.370 1.00 0.00 O ATOM 65898 H1 WAT 9055 27.408 68.771 87.848 1.00 0.00 H ATOM 65899 H2 WAT 9055 26.757 67.411 87.974 1.00 0.00 H TER 65901 WAT 9055 ATOM 65901 O WAT 9056 37.108 72.212 68.591 1.00 0.00 O ATOM 65902 H1 WAT 9056 37.054 72.691 69.418 1.00 0.00 H ATOM 65903 H2 WAT 9056 38.029 72.276 68.338 1.00 0.00 H TER 65905 WAT 9056 ATOM 65905 O WAT 9057 67.068 12.128 120.072 1.00 0.00 O ATOM 65906 H1 WAT 9057 67.961 12.162 119.729 1.00 0.00 H ATOM 65907 H2 WAT 9057 66.627 12.874 119.665 1.00 0.00 H TER 65909 WAT 9057 ATOM 65909 O WAT 9058 86.591 64.870 116.197 1.00 0.00 O ATOM 65910 H1 WAT 9058 86.469 65.759 115.864 1.00 0.00 H ATOM 65911 H2 WAT 9058 87.491 64.857 116.522 1.00 0.00 H TER 65913 WAT 9058 ATOM 65913 O WAT 9059 108.116 107.922 125.396 1.00 0.00 O ATOM 65914 H1 WAT 9059 107.570 107.137 125.436 1.00 0.00 H ATOM 65915 H2 WAT 9059 107.958 108.278 124.522 1.00 0.00 H TER 65917 WAT 9059 ATOM 65917 O WAT 9060 37.380 82.440 13.224 1.00 0.00 O ATOM 65918 H1 WAT 9060 37.298 83.393 13.263 1.00 0.00 H ATOM 65919 H2 WAT 9060 36.554 82.144 12.840 1.00 0.00 H TER 65921 WAT 9060 ATOM 65921 O WAT 9061 27.238 61.248 124.943 1.00 0.00 O ATOM 65922 H1 WAT 9061 26.316 61.412 124.747 1.00 0.00 H ATOM 65923 H2 WAT 9061 27.252 61.048 125.878 1.00 0.00 H TER 65925 WAT 9061 ATOM 65925 O WAT 9062 39.516 126.357 125.739 1.00 0.00 O ATOM 65926 H1 WAT 9062 40.438 126.100 125.744 1.00 0.00 H ATOM 65927 H2 WAT 9062 39.520 127.270 126.027 1.00 0.00 H TER 65929 WAT 9062 ATOM 65929 O WAT 9063 28.674 110.926 58.636 1.00 0.00 O ATOM 65930 H1 WAT 9063 29.147 110.160 58.963 1.00 0.00 H ATOM 65931 H2 WAT 9063 27.844 110.575 58.313 1.00 0.00 H TER 65933 WAT 9063 ATOM 65933 O WAT 9064 65.175 45.911 23.308 1.00 0.00 O ATOM 65934 H1 WAT 9064 64.390 45.999 22.767 1.00 0.00 H ATOM 65935 H2 WAT 9064 65.635 46.743 23.199 1.00 0.00 H TER 65937 WAT 9064 ATOM 65937 O WAT 9065 70.021 134.601 122.911 1.00 0.00 O ATOM 65938 H1 WAT 9065 70.308 134.993 123.736 1.00 0.00 H ATOM 65939 H2 WAT 9065 69.106 134.867 122.824 1.00 0.00 H TER 65941 WAT 9065 ATOM 65941 O WAT 9066 124.113 68.168 80.648 1.00 0.00 O ATOM 65942 H1 WAT 9066 124.464 68.985 80.295 1.00 0.00 H ATOM 65943 H2 WAT 9066 124.434 68.139 81.549 1.00 0.00 H TER 65945 WAT 9066 ATOM 65945 O WAT 9067 56.399 104.627 73.087 1.00 0.00 O ATOM 65946 H1 WAT 9067 56.681 104.719 72.177 1.00 0.00 H ATOM 65947 H2 WAT 9067 55.550 104.189 73.032 1.00 0.00 H TER 65949 WAT 9067 ATOM 65949 O WAT 9068 74.834 20.353 140.244 1.00 0.00 O ATOM 65950 H1 WAT 9068 75.626 20.871 140.385 1.00 0.00 H ATOM 65951 H2 WAT 9068 74.402 20.339 141.099 1.00 0.00 H TER 65953 WAT 9068 ATOM 65953 O WAT 9069 71.066 131.003 158.291 1.00 0.00 O ATOM 65954 H1 WAT 9069 71.476 131.830 158.545 1.00 0.00 H ATOM 65955 H2 WAT 9069 70.176 131.245 158.034 1.00 0.00 H TER 65957 WAT 9069 ATOM 65957 O WAT 9070 58.055 131.573 113.670 1.00 0.00 O ATOM 65958 H1 WAT 9070 57.905 131.204 112.800 1.00 0.00 H ATOM 65959 H2 WAT 9070 57.683 132.454 113.623 1.00 0.00 H TER 65961 WAT 9070 ATOM 65961 O WAT 9071 120.693 71.395 132.990 1.00 0.00 O ATOM 65962 H1 WAT 9071 121.198 71.054 133.729 1.00 0.00 H ATOM 65963 H2 WAT 9071 120.841 70.764 132.286 1.00 0.00 H TER 65965 WAT 9071 ATOM 65965 O WAT 9072 35.954 85.263 109.420 1.00 0.00 O ATOM 65966 H1 WAT 9072 35.953 84.326 109.222 1.00 0.00 H ATOM 65967 H2 WAT 9072 36.094 85.307 110.366 1.00 0.00 H TER 65969 WAT 9072 ATOM 65969 O WAT 9073 41.108 20.794 23.019 1.00 0.00 O ATOM 65970 H1 WAT 9073 41.930 20.446 23.366 1.00 0.00 H ATOM 65971 H2 WAT 9073 41.378 21.471 22.398 1.00 0.00 H TER 65973 WAT 9073 ATOM 65973 O WAT 9074 122.635 106.181 13.847 1.00 0.00 O ATOM 65974 H1 WAT 9074 122.596 105.661 14.649 1.00 0.00 H ATOM 65975 H2 WAT 9074 122.690 107.087 14.152 1.00 0.00 H TER 65977 WAT 9074 ATOM 65977 O WAT 9075 94.363 31.745 107.614 1.00 0.00 O ATOM 65978 H1 WAT 9075 94.786 32.231 106.907 1.00 0.00 H ATOM 65979 H2 WAT 9075 93.931 32.417 108.142 1.00 0.00 H TER 65981 WAT 9075 ATOM 65981 O WAT 9076 62.802 57.923 17.345 1.00 0.00 O ATOM 65982 H1 WAT 9076 63.531 57.906 16.725 1.00 0.00 H ATOM 65983 H2 WAT 9076 62.796 58.819 17.683 1.00 0.00 H TER 65985 WAT 9076 ATOM 65985 O WAT 9077 0.620 120.882 126.036 1.00 0.00 O ATOM 65986 H1 WAT 9077 0.766 119.950 125.870 1.00 0.00 H ATOM 65987 H2 WAT 9077 -0.227 121.068 125.630 1.00 0.00 H TER 65989 WAT 9077 ATOM 65989 O WAT 9078 105.837 27.262 80.267 1.00 0.00 O ATOM 65990 H1 WAT 9078 105.500 28.114 80.544 1.00 0.00 H ATOM 65991 H2 WAT 9078 106.786 27.381 80.226 1.00 0.00 H TER 65993 WAT 9078 ATOM 65993 O WAT 9079 82.305 75.960 77.170 1.00 0.00 O ATOM 65994 H1 WAT 9079 82.567 75.246 76.589 1.00 0.00 H ATOM 65995 H2 WAT 9079 82.879 75.871 77.931 1.00 0.00 H TER 65997 WAT 9079 ATOM 65997 O WAT 9080 117.140 119.316 79.371 1.00 0.00 O ATOM 65998 H1 WAT 9080 116.456 119.036 79.979 1.00 0.00 H ATOM 65999 H2 WAT 9080 116.925 118.876 78.548 1.00 0.00 H TER 66001 WAT 9080 ATOM 66001 O WAT 9081 124.734 22.467 74.739 1.00 0.00 O ATOM 66002 H1 WAT 9081 124.165 21.699 74.787 1.00 0.00 H ATOM 66003 H2 WAT 9081 124.779 22.789 75.639 1.00 0.00 H TER 66005 WAT 9081 ATOM 66005 O WAT 9082 61.704 136.554 101.471 1.00 0.00 O ATOM 66006 H1 WAT 9082 62.298 135.821 101.307 1.00 0.00 H ATOM 66007 H2 WAT 9082 60.837 136.152 101.528 1.00 0.00 H TER 66009 WAT 9082 ATOM 66009 O WAT 9083 73.209 48.462 128.991 1.00 0.00 O ATOM 66010 H1 WAT 9083 72.452 48.196 128.469 1.00 0.00 H ATOM 66011 H2 WAT 9083 73.029 48.116 129.866 1.00 0.00 H TER 66013 WAT 9083 ATOM 66013 O WAT 9084 97.804 119.910 139.062 1.00 0.00 O ATOM 66014 H1 WAT 9084 97.041 119.333 139.020 1.00 0.00 H ATOM 66015 H2 WAT 9084 97.534 120.625 139.637 1.00 0.00 H TER 66017 WAT 9084 ATOM 66017 O WAT 9085 5.241 133.565 13.191 1.00 0.00 O ATOM 66018 H1 WAT 9085 4.340 133.248 13.128 1.00 0.00 H ATOM 66019 H2 WAT 9085 5.203 134.462 12.859 1.00 0.00 H TER 66021 WAT 9085 ATOM 66021 O WAT 9086 41.701 76.101 153.268 1.00 0.00 O ATOM 66022 H1 WAT 9086 41.313 76.762 153.841 1.00 0.00 H ATOM 66023 H2 WAT 9086 42.338 76.584 152.742 1.00 0.00 H TER 66025 WAT 9086 ATOM 66025 O WAT 9087 49.149 117.517 89.067 1.00 0.00 O ATOM 66026 H1 WAT 9087 48.952 118.446 89.185 1.00 0.00 H ATOM 66027 H2 WAT 9087 49.438 117.446 88.158 1.00 0.00 H TER 66029 WAT 9087 ATOM 66029 O WAT 9088 52.489 106.868 24.397 1.00 0.00 O ATOM 66030 H1 WAT 9088 52.465 107.366 23.580 1.00 0.00 H ATOM 66031 H2 WAT 9088 51.770 106.241 24.317 1.00 0.00 H TER 66033 WAT 9088 ATOM 66033 O WAT 9089 78.698 68.809 11.314 1.00 0.00 O ATOM 66034 H1 WAT 9089 78.771 68.491 10.414 1.00 0.00 H ATOM 66035 H2 WAT 9089 79.586 68.742 11.664 1.00 0.00 H TER 66037 WAT 9089 ATOM 66037 O WAT 9090 104.671 142.087 109.909 1.00 0.00 O ATOM 66038 H1 WAT 9090 104.259 141.958 109.054 1.00 0.00 H ATOM 66039 H2 WAT 9090 103.937 142.140 110.522 1.00 0.00 H TER 66041 WAT 9090 ATOM 66041 O WAT 9091 130.787 137.576 119.177 1.00 0.00 O ATOM 66042 H1 WAT 9091 130.409 136.929 119.773 1.00 0.00 H ATOM 66043 H2 WAT 9091 130.141 138.281 119.148 1.00 0.00 H TER 66045 WAT 9091 ATOM 66045 O WAT 9092 18.600 33.398 115.197 1.00 0.00 O ATOM 66046 H1 WAT 9092 17.882 33.904 115.579 1.00 0.00 H ATOM 66047 H2 WAT 9092 18.779 32.714 115.842 1.00 0.00 H TER 66049 WAT 9092 ATOM 66049 O WAT 9093 73.186 107.450 87.498 1.00 0.00 O ATOM 66050 H1 WAT 9093 72.380 107.872 87.796 1.00 0.00 H ATOM 66051 H2 WAT 9093 73.083 107.380 86.549 1.00 0.00 H TER 66053 WAT 9093 ATOM 66053 O WAT 9094 16.411 65.863 133.890 1.00 0.00 O ATOM 66054 H1 WAT 9094 17.028 66.568 134.086 1.00 0.00 H ATOM 66055 H2 WAT 9094 16.717 65.501 133.058 1.00 0.00 H TER 66057 WAT 9094 ATOM 66057 O WAT 9095 30.074 7.236 71.647 1.00 0.00 O ATOM 66058 H1 WAT 9095 29.142 7.386 71.488 1.00 0.00 H ATOM 66059 H2 WAT 9095 30.494 8.062 71.407 1.00 0.00 H TER 66061 WAT 9095 ATOM 66061 O WAT 9096 10.443 127.132 110.344 1.00 0.00 O ATOM 66062 H1 WAT 9096 10.979 127.911 110.493 1.00 0.00 H ATOM 66063 H2 WAT 9096 10.214 127.172 109.416 1.00 0.00 H TER 66065 WAT 9096 ATOM 66065 O WAT 9097 89.924 56.994 70.349 1.00 0.00 O ATOM 66066 H1 WAT 9097 90.301 57.049 69.471 1.00 0.00 H ATOM 66067 H2 WAT 9097 88.993 56.827 70.200 1.00 0.00 H TER 66069 WAT 9097 ATOM 66069 O WAT 9098 22.975 75.305 10.798 1.00 0.00 O ATOM 66070 H1 WAT 9098 23.008 76.257 10.702 1.00 0.00 H ATOM 66071 H2 WAT 9098 23.846 75.066 11.115 1.00 0.00 H TER 66073 WAT 9098 ATOM 66073 O WAT 9099 106.564 34.834 12.534 1.00 0.00 O ATOM 66074 H1 WAT 9099 106.420 33.941 12.847 1.00 0.00 H ATOM 66075 H2 WAT 9099 106.496 35.377 13.320 1.00 0.00 H TER 66077 WAT 9099 ATOM 66077 O WAT 9100 109.347 6.778 98.744 1.00 0.00 O ATOM 66078 H1 WAT 9100 110.217 6.769 99.144 1.00 0.00 H ATOM 66079 H2 WAT 9100 108.870 6.080 99.192 1.00 0.00 H TER 66081 WAT 9100 ATOM 66081 O WAT 9101 53.437 86.674 129.345 1.00 0.00 O ATOM 66082 H1 WAT 9101 53.472 87.542 128.943 1.00 0.00 H ATOM 66083 H2 WAT 9101 54.297 86.293 129.168 1.00 0.00 H TER 66085 WAT 9101 ATOM 66085 O WAT 9102 111.481 105.424 116.936 1.00 0.00 O ATOM 66086 H1 WAT 9102 111.077 105.776 116.143 1.00 0.00 H ATOM 66087 H2 WAT 9102 111.408 106.132 117.577 1.00 0.00 H TER 66089 WAT 9102 ATOM 66089 O WAT 9103 131.244 52.028 67.251 1.00 0.00 O ATOM 66090 H1 WAT 9103 131.981 51.945 66.645 1.00 0.00 H ATOM 66091 H2 WAT 9103 131.645 51.999 68.120 1.00 0.00 H TER 66093 WAT 9103 ATOM 66093 O WAT 9104 10.386 3.364 140.958 1.00 0.00 O ATOM 66094 H1 WAT 9104 9.601 3.775 141.321 1.00 0.00 H ATOM 66095 H2 WAT 9104 10.588 2.654 141.567 1.00 0.00 H TER 66097 WAT 9104 ATOM 66097 O WAT 9105 43.689 144.633 145.614 1.00 0.00 O ATOM 66098 H1 WAT 9105 43.254 145.215 146.237 1.00 0.00 H ATOM 66099 H2 WAT 9105 44.273 144.099 146.153 1.00 0.00 H TER 66101 WAT 9105 ATOM 66101 O WAT 9106 127.335 8.520 57.586 1.00 0.00 O ATOM 66102 H1 WAT 9106 127.448 7.607 57.322 1.00 0.00 H ATOM 66103 H2 WAT 9106 126.791 8.903 56.898 1.00 0.00 H TER 66105 WAT 9106 ATOM 66105 O WAT 9107 32.613 106.418 158.513 1.00 0.00 O ATOM 66106 H1 WAT 9107 31.806 106.526 158.010 1.00 0.00 H ATOM 66107 H2 WAT 9107 32.423 106.821 159.360 1.00 0.00 H TER 66109 WAT 9107 ATOM 66109 O WAT 9108 80.996 28.394 149.421 1.00 0.00 O ATOM 66110 H1 WAT 9108 81.624 27.775 149.794 1.00 0.00 H ATOM 66111 H2 WAT 9108 80.919 29.083 150.081 1.00 0.00 H TER 66113 WAT 9108 ATOM 66113 O WAT 9109 31.645 124.050 86.677 1.00 0.00 O ATOM 66114 H1 WAT 9109 32.266 123.331 86.564 1.00 0.00 H ATOM 66115 H2 WAT 9109 31.945 124.505 87.463 1.00 0.00 H TER 66117 WAT 9109 ATOM 66117 O WAT 9110 43.473 41.152 146.554 1.00 0.00 O ATOM 66118 H1 WAT 9110 43.927 40.871 147.349 1.00 0.00 H ATOM 66119 H2 WAT 9110 44.090 40.965 145.847 1.00 0.00 H TER 66121 WAT 9110 ATOM 66121 O WAT 9111 55.063 111.220 61.958 1.00 0.00 O ATOM 66122 H1 WAT 9111 54.716 112.038 62.313 1.00 0.00 H ATOM 66123 H2 WAT 9111 54.789 111.221 61.040 1.00 0.00 H TER 66125 WAT 9111 ATOM 66125 O WAT 9112 5.296 141.066 75.981 1.00 0.00 O ATOM 66126 H1 WAT 9112 6.199 140.861 75.735 1.00 0.00 H ATOM 66127 H2 WAT 9112 4.924 141.477 75.201 1.00 0.00 H TER 66129 WAT 9112 ATOM 66129 O WAT 9113 69.996 76.814 90.502 1.00 0.00 O ATOM 66130 H1 WAT 9113 70.114 77.058 89.584 1.00 0.00 H ATOM 66131 H2 WAT 9113 70.104 77.635 90.983 1.00 0.00 H TER 66133 WAT 9113 ATOM 66133 O WAT 9114 63.378 17.084 69.258 1.00 0.00 O ATOM 66134 H1 WAT 9114 63.429 16.130 69.308 1.00 0.00 H ATOM 66135 H2 WAT 9114 63.230 17.363 70.162 1.00 0.00 H TER 66137 WAT 9114 ATOM 66137 O WAT 9115 24.228 73.862 74.786 1.00 0.00 O ATOM 66138 H1 WAT 9115 23.803 73.063 74.472 1.00 0.00 H ATOM 66139 H2 WAT 9115 25.136 73.780 74.495 1.00 0.00 H TER 66141 WAT 9115 ATOM 66141 O WAT 9116 111.776 129.098 100.158 1.00 0.00 O ATOM 66142 H1 WAT 9116 112.036 128.733 101.004 1.00 0.00 H ATOM 66143 H2 WAT 9116 111.637 128.333 99.600 1.00 0.00 H TER 66145 WAT 9116 ATOM 66145 O WAT 9117 31.439 9.383 70.818 1.00 0.00 O ATOM 66146 H1 WAT 9117 31.488 8.910 69.987 1.00 0.00 H ATOM 66147 H2 WAT 9117 32.278 9.206 71.244 1.00 0.00 H TER 66149 WAT 9117 ATOM 66149 O WAT 9118 25.743 44.406 68.824 1.00 0.00 O ATOM 66150 H1 WAT 9118 26.684 44.260 68.725 1.00 0.00 H ATOM 66151 H2 WAT 9118 25.502 44.936 68.064 1.00 0.00 H TER 66153 WAT 9118 ATOM 66153 O WAT 9119 23.433 61.703 148.619 1.00 0.00 O ATOM 66154 H1 WAT 9119 22.743 61.227 149.080 1.00 0.00 H ATOM 66155 H2 WAT 9119 24.147 61.765 149.253 1.00 0.00 H TER 66157 WAT 9119 ATOM 66157 O WAT 9120 1.327 68.522 79.923 1.00 0.00 O ATOM 66158 H1 WAT 9120 1.260 68.630 80.872 1.00 0.00 H ATOM 66159 H2 WAT 9120 1.703 67.649 79.808 1.00 0.00 H TER 66161 WAT 9120 ATOM 66161 O WAT 9121 92.271 118.877 111.014 1.00 0.00 O ATOM 66162 H1 WAT 9121 93.069 118.565 111.443 1.00 0.00 H ATOM 66163 H2 WAT 9121 92.117 119.741 111.396 1.00 0.00 H TER 66165 WAT 9121 ATOM 66165 O WAT 9122 42.962 92.741 107.180 1.00 0.00 O ATOM 66166 H1 WAT 9122 43.616 93.040 106.547 1.00 0.00 H ATOM 66167 H2 WAT 9122 43.294 91.898 107.487 1.00 0.00 H TER 66169 WAT 9122 ATOM 66169 O WAT 9123 47.258 108.430 135.431 1.00 0.00 O ATOM 66170 H1 WAT 9123 47.396 107.612 135.908 1.00 0.00 H ATOM 66171 H2 WAT 9123 48.137 108.707 135.171 1.00 0.00 H TER 66173 WAT 9123 ATOM 66173 O WAT 9124 7.487 142.483 4.502 1.00 0.00 O ATOM 66174 H1 WAT 9124 6.910 143.220 4.305 1.00 0.00 H ATOM 66175 H2 WAT 9124 8.036 142.795 5.221 1.00 0.00 H TER 66177 WAT 9124 ATOM 66177 O WAT 9125 11.615 13.027 80.513 1.00 0.00 O ATOM 66178 H1 WAT 9125 11.587 13.796 79.943 1.00 0.00 H ATOM 66179 H2 WAT 9125 12.444 12.600 80.297 1.00 0.00 H TER 66181 WAT 9125 ATOM 66181 O WAT 9126 124.546 88.605 110.769 1.00 0.00 O ATOM 66182 H1 WAT 9126 124.844 88.159 111.562 1.00 0.00 H ATOM 66183 H2 WAT 9126 124.815 88.027 110.055 1.00 0.00 H TER 66185 WAT 9126 ATOM 66185 O WAT 9127 2.300 1.867 103.368 1.00 0.00 O ATOM 66186 H1 WAT 9127 1.722 1.413 102.754 1.00 0.00 H ATOM 66187 H2 WAT 9127 1.962 2.762 103.398 1.00 0.00 H TER 66189 WAT 9127 ATOM 66189 O WAT 9128 13.014 53.357 103.031 1.00 0.00 O ATOM 66190 H1 WAT 9128 13.467 52.690 102.517 1.00 0.00 H ATOM 66191 H2 WAT 9128 12.108 53.051 103.075 1.00 0.00 H TER 66193 WAT 9128 ATOM 66193 O WAT 9129 124.197 66.412 152.230 1.00 0.00 O ATOM 66194 H1 WAT 9129 124.953 65.928 152.563 1.00 0.00 H ATOM 66195 H2 WAT 9129 123.474 65.786 152.273 1.00 0.00 H TER 66197 WAT 9129 ATOM 66197 O WAT 9130 99.670 108.928 144.594 1.00 0.00 O ATOM 66198 H1 WAT 9130 100.297 108.611 143.943 1.00 0.00 H ATOM 66199 H2 WAT 9130 100.037 109.758 144.896 1.00 0.00 H TER 66201 WAT 9130 ATOM 66201 O WAT 9131 46.358 106.706 105.507 1.00 0.00 O ATOM 66202 H1 WAT 9131 46.533 105.845 105.886 1.00 0.00 H ATOM 66203 H2 WAT 9131 46.598 107.324 106.198 1.00 0.00 H TER 66205 WAT 9131 ATOM 66205 O WAT 9132 121.552 65.751 18.327 1.00 0.00 O ATOM 66206 H1 WAT 9132 122.396 65.384 18.589 1.00 0.00 H ATOM 66207 H2 WAT 9132 121.728 66.682 18.187 1.00 0.00 H TER 66209 WAT 9132 ATOM 66209 O WAT 9133 15.020 103.317 3.233 1.00 0.00 O ATOM 66210 H1 WAT 9133 14.451 102.664 2.825 1.00 0.00 H ATOM 66211 H2 WAT 9133 15.137 103.987 2.559 1.00 0.00 H TER 66213 WAT 9133 ATOM 66213 O WAT 9134 95.129 104.082 93.928 1.00 0.00 O ATOM 66214 H1 WAT 9134 94.628 104.379 93.169 1.00 0.00 H ATOM 66215 H2 WAT 9134 94.475 103.695 94.510 1.00 0.00 H TER 66217 WAT 9134 ATOM 66217 O WAT 9135 127.749 143.299 127.647 1.00 0.00 O ATOM 66218 H1 WAT 9135 127.409 143.927 128.284 1.00 0.00 H ATOM 66219 H2 WAT 9135 127.987 143.832 126.888 1.00 0.00 H TER 66221 WAT 9135 ATOM 66221 O WAT 9136 145.218 34.173 88.854 1.00 0.00 O ATOM 66222 H1 WAT 9136 146.168 34.092 88.764 1.00 0.00 H ATOM 66223 H2 WAT 9136 145.057 34.066 89.791 1.00 0.00 H TER 66225 WAT 9136 ATOM 66225 O WAT 9137 98.446 97.018 2.933 1.00 0.00 O ATOM 66226 H1 WAT 9137 98.234 97.892 3.262 1.00 0.00 H ATOM 66227 H2 WAT 9137 99.386 96.925 3.091 1.00 0.00 H TER 66229 WAT 9137 ATOM 66229 O WAT 9138 23.243 30.796 80.633 1.00 0.00 O ATOM 66230 H1 WAT 9138 23.764 31.385 80.088 1.00 0.00 H ATOM 66231 H2 WAT 9138 23.170 31.250 81.473 1.00 0.00 H TER 66233 WAT 9138 ATOM 66233 O WAT 9139 95.700 82.467 101.078 1.00 0.00 O ATOM 66234 H1 WAT 9139 95.414 83.380 101.111 1.00 0.00 H ATOM 66235 H2 WAT 9139 95.826 82.222 101.994 1.00 0.00 H TER 66237 WAT 9139 ATOM 66237 O WAT 9140 95.878 116.726 157.452 1.00 0.00 O ATOM 66238 H1 WAT 9140 95.875 116.767 158.408 1.00 0.00 H ATOM 66239 H2 WAT 9140 95.298 117.438 157.180 1.00 0.00 H TER 66241 WAT 9140 ATOM 66241 O WAT 9141 40.934 71.153 111.851 1.00 0.00 O ATOM 66242 H1 WAT 9141 40.744 70.509 112.533 1.00 0.00 H ATOM 66243 H2 WAT 9141 41.021 70.635 111.051 1.00 0.00 H TER 66245 WAT 9141 ATOM 66245 O WAT 9142 80.879 38.620 101.027 1.00 0.00 O ATOM 66246 H1 WAT 9142 80.392 37.849 100.736 1.00 0.00 H ATOM 66247 H2 WAT 9142 80.209 39.211 101.370 1.00 0.00 H TER 66249 WAT 9142 ATOM 66249 O WAT 9143 62.807 6.932 80.629 1.00 0.00 O ATOM 66250 H1 WAT 9143 63.193 6.344 81.278 1.00 0.00 H ATOM 66251 H2 WAT 9143 63.411 7.673 80.587 1.00 0.00 H TER 66253 WAT 9143 ATOM 66253 O WAT 9144 127.667 65.382 149.340 1.00 0.00 O ATOM 66254 H1 WAT 9144 128.332 65.929 148.921 1.00 0.00 H ATOM 66255 H2 WAT 9144 127.851 64.497 149.024 1.00 0.00 H TER 66257 WAT 9144 ATOM 66257 O WAT 9145 88.111 57.241 1.178 1.00 0.00 O ATOM 66258 H1 WAT 9145 87.983 57.380 2.117 1.00 0.00 H ATOM 66259 H2 WAT 9145 88.318 56.310 1.100 1.00 0.00 H TER 66261 WAT 9145 ATOM 66261 O WAT 9146 27.650 58.118 135.842 1.00 0.00 O ATOM 66262 H1 WAT 9146 27.785 59.016 136.146 1.00 0.00 H ATOM 66263 H2 WAT 9146 27.368 58.214 134.932 1.00 0.00 H TER 66265 WAT 9146 ATOM 66265 O WAT 9147 81.700 5.092 89.926 1.00 0.00 O ATOM 66266 H1 WAT 9147 81.865 6.014 90.122 1.00 0.00 H ATOM 66267 H2 WAT 9147 80.905 4.881 90.416 1.00 0.00 H TER 66269 WAT 9147 ATOM 66269 O WAT 9148 70.362 97.442 111.835 1.00 0.00 O ATOM 66270 H1 WAT 9148 69.569 97.879 112.146 1.00 0.00 H ATOM 66271 H2 WAT 9148 70.373 97.609 110.892 1.00 0.00 H TER 66273 WAT 9148 ATOM 66273 O WAT 9149 8.679 130.273 116.156 1.00 0.00 O ATOM 66274 H1 WAT 9149 9.375 130.699 115.656 1.00 0.00 H ATOM 66275 H2 WAT 9149 8.679 130.725 117.000 1.00 0.00 H TER 66277 WAT 9149 ATOM 66277 O WAT 9150 39.353 104.714 133.425 1.00 0.00 O ATOM 66278 H1 WAT 9150 39.672 105.198 134.187 1.00 0.00 H ATOM 66279 H2 WAT 9150 38.779 105.332 132.971 1.00 0.00 H TER 66281 WAT 9150 ATOM 66281 O WAT 9151 58.484 3.728 4.797 1.00 0.00 O ATOM 66282 H1 WAT 9151 58.630 3.272 3.968 1.00 0.00 H ATOM 66283 H2 WAT 9151 57.947 4.485 4.562 1.00 0.00 H TER 66285 WAT 9151 ATOM 66285 O WAT 9152 97.027 73.075 81.171 1.00 0.00 O ATOM 66286 H1 WAT 9152 96.561 72.353 81.594 1.00 0.00 H ATOM 66287 H2 WAT 9152 97.321 73.626 81.896 1.00 0.00 H TER 66289 WAT 9152 ATOM 66289 O WAT 9153 18.930 65.537 66.577 1.00 0.00 O ATOM 66290 H1 WAT 9153 18.150 65.321 67.087 1.00 0.00 H ATOM 66291 H2 WAT 9153 18.787 66.439 66.290 1.00 0.00 H TER 66293 WAT 9153 ATOM 66293 O WAT 9154 66.721 130.514 123.048 1.00 0.00 O ATOM 66294 H1 WAT 9154 65.877 130.567 123.495 1.00 0.00 H ATOM 66295 H2 WAT 9154 66.738 129.634 122.671 1.00 0.00 H TER 66297 WAT 9154 ATOM 66297 O WAT 9155 127.138 32.606 80.686 1.00 0.00 O ATOM 66298 H1 WAT 9155 126.563 32.441 81.433 1.00 0.00 H ATOM 66299 H2 WAT 9155 128.003 32.320 80.982 1.00 0.00 H TER 66301 WAT 9155 ATOM 66301 O WAT 9156 118.797 10.133 104.109 1.00 0.00 O ATOM 66302 H1 WAT 9156 119.249 9.720 104.844 1.00 0.00 H ATOM 66303 H2 WAT 9156 119.086 9.640 103.341 1.00 0.00 H TER 66305 WAT 9156 ATOM 66305 O WAT 9157 83.769 0.472 17.581 1.00 0.00 O ATOM 66306 H1 WAT 9157 82.978 1.001 17.684 1.00 0.00 H ATOM 66307 H2 WAT 9157 84.326 0.730 18.315 1.00 0.00 H TER 66309 WAT 9157 ATOM 66309 O WAT 9158 14.282 6.042 107.019 1.00 0.00 O ATOM 66310 H1 WAT 9158 14.469 5.315 106.425 1.00 0.00 H ATOM 66311 H2 WAT 9158 14.089 6.779 106.440 1.00 0.00 H TER 66313 WAT 9158 ATOM 66313 O WAT 9159 103.775 34.089 94.039 1.00 0.00 O ATOM 66314 H1 WAT 9159 103.970 34.797 94.654 1.00 0.00 H ATOM 66315 H2 WAT 9159 103.053 34.426 93.508 1.00 0.00 H TER 66317 WAT 9159 ATOM 66317 O WAT 9160 125.628 140.714 114.771 1.00 0.00 O ATOM 66318 H1 WAT 9160 125.026 141.288 115.245 1.00 0.00 H ATOM 66319 H2 WAT 9160 126.193 141.312 114.282 1.00 0.00 H TER 66321 WAT 9160 ATOM 66321 O WAT 9161 68.749 93.126 90.020 1.00 0.00 O ATOM 66322 H1 WAT 9161 68.715 93.831 90.667 1.00 0.00 H ATOM 66323 H2 WAT 9161 69.666 93.097 89.747 1.00 0.00 H TER 66325 WAT 9161 ATOM 66325 O WAT 9162 77.129 19.350 85.916 1.00 0.00 O ATOM 66326 H1 WAT 9162 77.189 20.306 85.932 1.00 0.00 H ATOM 66327 H2 WAT 9162 77.178 19.092 86.837 1.00 0.00 H TER 66329 WAT 9162 ATOM 66329 O WAT 9163 57.590 0.830 154.464 1.00 0.00 O ATOM 66330 H1 WAT 9163 56.662 0.612 154.553 1.00 0.00 H ATOM 66331 H2 WAT 9163 57.987 0.520 155.278 1.00 0.00 H TER 66333 WAT 9163 ATOM 66333 O WAT 9164 61.649 140.903 10.792 1.00 0.00 O ATOM 66334 H1 WAT 9164 60.958 140.253 10.661 1.00 0.00 H ATOM 66335 H2 WAT 9164 62.194 140.536 11.488 1.00 0.00 H TER 66337 WAT 9164 ATOM 66337 O WAT 9165 131.724 40.933 140.909 1.00 0.00 O ATOM 66338 H1 WAT 9165 130.900 40.958 141.395 1.00 0.00 H ATOM 66339 H2 WAT 9165 131.506 40.486 140.091 1.00 0.00 H TER 66341 WAT 9165 ATOM 66341 O WAT 9166 80.757 76.738 145.709 1.00 0.00 O ATOM 66342 H1 WAT 9166 81.295 77.257 145.112 1.00 0.00 H ATOM 66343 H2 WAT 9166 81.041 77.006 146.583 1.00 0.00 H TER 66345 WAT 9166 ATOM 66345 O WAT 9167 18.748 3.886 141.121 1.00 0.00 O ATOM 66346 H1 WAT 9167 19.415 4.479 141.467 1.00 0.00 H ATOM 66347 H2 WAT 9167 18.542 4.236 140.254 1.00 0.00 H TER 66349 WAT 9167 ATOM 66349 O WAT 9168 103.798 126.453 140.841 1.00 0.00 O ATOM 66350 H1 WAT 9168 103.422 126.566 139.969 1.00 0.00 H ATOM 66351 H2 WAT 9168 104.534 125.855 140.709 1.00 0.00 H TER 66353 WAT 9168 ATOM 66353 O WAT 9169 54.219 77.681 154.565 1.00 0.00 O ATOM 66354 H1 WAT 9169 53.492 77.761 153.946 1.00 0.00 H ATOM 66355 H2 WAT 9169 54.283 76.742 154.738 1.00 0.00 H TER 66357 WAT 9169 ATOM 66357 O WAT 9170 110.455 49.091 2.017 1.00 0.00 O ATOM 66358 H1 WAT 9170 110.375 49.899 2.524 1.00 0.00 H ATOM 66359 H2 WAT 9170 110.066 49.301 1.168 1.00 0.00 H TER 66361 WAT 9170 ATOM 66361 O WAT 9171 44.939 25.608 96.261 1.00 0.00 O ATOM 66362 H1 WAT 9171 45.203 26.281 96.888 1.00 0.00 H ATOM 66363 H2 WAT 9171 44.855 24.812 96.786 1.00 0.00 H TER 66365 WAT 9171 ATOM 66365 O WAT 9172 105.223 103.008 64.378 1.00 0.00 O ATOM 66366 H1 WAT 9172 105.449 103.886 64.072 1.00 0.00 H ATOM 66367 H2 WAT 9172 104.760 102.609 63.642 1.00 0.00 H TER 66369 WAT 9172 ATOM 66369 O WAT 9173 39.782 66.167 69.194 1.00 0.00 O ATOM 66370 H1 WAT 9173 38.837 66.205 69.043 1.00 0.00 H ATOM 66371 H2 WAT 9173 40.134 66.900 68.691 1.00 0.00 H TER 66373 WAT 9173 ATOM 66373 O WAT 9174 126.798 129.115 139.884 1.00 0.00 O ATOM 66374 H1 WAT 9174 127.684 128.753 139.872 1.00 0.00 H ATOM 66375 H2 WAT 9174 126.802 129.733 140.615 1.00 0.00 H TER 66377 WAT 9174 ATOM 66377 O WAT 9175 83.955 126.203 67.257 1.00 0.00 O ATOM 66378 H1 WAT 9175 83.942 126.668 68.093 1.00 0.00 H ATOM 66379 H2 WAT 9175 84.439 126.783 66.669 1.00 0.00 H TER 66381 WAT 9175 ATOM 66381 O WAT 9176 143.003 13.137 103.889 1.00 0.00 O ATOM 66382 H1 WAT 9176 143.496 12.400 103.530 1.00 0.00 H ATOM 66383 H2 WAT 9176 142.869 13.722 103.143 1.00 0.00 H TER 66385 WAT 9176 ATOM 66385 O WAT 9177 28.938 119.783 101.705 1.00 0.00 O ATOM 66386 H1 WAT 9177 28.002 119.586 101.723 1.00 0.00 H ATOM 66387 H2 WAT 9177 29.326 119.062 101.208 1.00 0.00 H TER 66389 WAT 9177 ATOM 66389 O WAT 9178 79.701 112.040 149.468 1.00 0.00 O ATOM 66390 H1 WAT 9178 80.383 112.531 149.010 1.00 0.00 H ATOM 66391 H2 WAT 9178 80.083 111.175 149.612 1.00 0.00 H TER 66393 WAT 9178 ATOM 66393 O WAT 9179 111.496 27.655 7.434 1.00 0.00 O ATOM 66394 H1 WAT 9179 110.767 27.327 6.907 1.00 0.00 H ATOM 66395 H2 WAT 9179 112.115 26.926 7.466 1.00 0.00 H TER 66397 WAT 9179 ATOM 66397 O WAT 9180 107.582 133.574 120.681 1.00 0.00 O ATOM 66398 H1 WAT 9180 107.689 134.524 120.631 1.00 0.00 H ATOM 66399 H2 WAT 9180 107.088 133.347 119.894 1.00 0.00 H TER 66401 WAT 9180 ATOM 66401 O WAT 9181 55.442 139.872 151.457 1.00 0.00 O ATOM 66402 H1 WAT 9181 54.642 140.397 151.419 1.00 0.00 H ATOM 66403 H2 WAT 9181 56.016 140.354 152.052 1.00 0.00 H TER 66405 WAT 9181 ATOM 66405 O WAT 9182 33.335 17.971 4.277 1.00 0.00 O ATOM 66406 H1 WAT 9182 34.291 18.006 4.319 1.00 0.00 H ATOM 66407 H2 WAT 9182 33.071 17.625 5.130 1.00 0.00 H TER 66409 WAT 9182 ATOM 66409 O WAT 9183 102.820 107.721 119.554 1.00 0.00 O ATOM 66410 H1 WAT 9183 101.874 107.693 119.697 1.00 0.00 H ATOM 66411 H2 WAT 9183 102.974 107.092 118.848 1.00 0.00 H TER 66413 WAT 9183 ATOM 66413 O WAT 9184 29.694 21.889 155.343 1.00 0.00 O ATOM 66414 H1 WAT 9184 30.596 21.905 155.024 1.00 0.00 H ATOM 66415 H2 WAT 9184 29.160 21.993 154.555 1.00 0.00 H TER 66417 WAT 9184 ATOM 66417 O WAT 9185 95.885 47.838 111.965 1.00 0.00 O ATOM 66418 H1 WAT 9185 95.543 47.626 111.096 1.00 0.00 H ATOM 66419 H2 WAT 9185 96.434 48.609 111.826 1.00 0.00 H TER 66421 WAT 9185 ATOM 66421 O WAT 9186 86.379 64.830 2.261 1.00 0.00 O ATOM 66422 H1 WAT 9186 86.597 65.638 2.725 1.00 0.00 H ATOM 66423 H2 WAT 9186 87.151 64.646 1.726 1.00 0.00 H TER 66425 WAT 9186 ATOM 66425 O WAT 9187 73.952 17.563 115.043 1.00 0.00 O ATOM 66426 H1 WAT 9187 73.544 18.423 115.140 1.00 0.00 H ATOM 66427 H2 WAT 9187 73.482 17.155 114.317 1.00 0.00 H TER 66429 WAT 9187 ATOM 66429 O WAT 9188 130.859 144.209 64.758 1.00 0.00 O ATOM 66430 H1 WAT 9188 130.735 144.976 65.317 1.00 0.00 H ATOM 66431 H2 WAT 9188 131.804 144.169 64.612 1.00 0.00 H TER 66433 WAT 9188 ATOM 66433 O WAT 9189 76.223 54.851 100.062 1.00 0.00 O ATOM 66434 H1 WAT 9189 75.599 54.147 99.887 1.00 0.00 H ATOM 66435 H2 WAT 9189 76.062 55.491 99.368 1.00 0.00 H TER 66437 WAT 9189 ATOM 66437 O WAT 9190 107.715 89.219 88.534 1.00 0.00 O ATOM 66438 H1 WAT 9190 107.260 89.397 89.357 1.00 0.00 H ATOM 66439 H2 WAT 9190 107.357 88.382 88.239 1.00 0.00 H TER 66441 WAT 9190 ATOM 66441 O WAT 9191 24.426 68.395 90.274 1.00 0.00 O ATOM 66442 H1 WAT 9191 24.293 68.336 89.328 1.00 0.00 H ATOM 66443 H2 WAT 9191 23.643 67.996 90.652 1.00 0.00 H TER 66445 WAT 9191 ATOM 66445 O WAT 9192 26.501 9.876 111.196 1.00 0.00 O ATOM 66446 H1 WAT 9192 26.506 10.406 111.993 1.00 0.00 H ATOM 66447 H2 WAT 9192 27.136 10.303 110.620 1.00 0.00 H TER 66449 WAT 9192 ATOM 66449 O WAT 9193 11.752 125.378 130.812 1.00 0.00 O ATOM 66450 H1 WAT 9193 11.251 124.679 130.391 1.00 0.00 H ATOM 66451 H2 WAT 9193 11.981 125.024 131.672 1.00 0.00 H TER 66453 WAT 9193 ATOM 66453 O WAT 9194 122.254 54.407 17.609 1.00 0.00 O ATOM 66454 H1 WAT 9194 123.005 54.336 17.019 1.00 0.00 H ATOM 66455 H2 WAT 9194 122.364 55.257 18.035 1.00 0.00 H TER 66457 WAT 9194 ATOM 66457 O WAT 9195 131.757 137.585 98.709 1.00 0.00 O ATOM 66458 H1 WAT 9195 132.111 138.464 98.575 1.00 0.00 H ATOM 66459 H2 WAT 9195 130.900 137.731 99.111 1.00 0.00 H TER 66461 WAT 9195 ATOM 66461 O WAT 9196 0.158 96.610 142.574 1.00 0.00 O ATOM 66462 H1 WAT 9196 -0.137 96.055 143.296 1.00 0.00 H ATOM 66463 H2 WAT 9196 0.973 96.206 142.277 1.00 0.00 H TER 66465 WAT 9196 ATOM 66465 O WAT 9197 96.617 104.080 62.484 1.00 0.00 O ATOM 66466 H1 WAT 9197 96.134 104.878 62.271 1.00 0.00 H ATOM 66467 H2 WAT 9197 97.499 104.384 62.699 1.00 0.00 H TER 66469 WAT 9197 ATOM 66469 O WAT 9198 110.778 141.338 8.982 1.00 0.00 O ATOM 66470 H1 WAT 9198 111.620 141.719 8.732 1.00 0.00 H ATOM 66471 H2 WAT 9198 110.783 141.352 9.939 1.00 0.00 H TER 66473 WAT 9198 ATOM 66473 O WAT 9199 113.022 48.287 95.685 1.00 0.00 O ATOM 66474 H1 WAT 9199 113.329 47.676 96.355 1.00 0.00 H ATOM 66475 H2 WAT 9199 113.520 49.088 95.845 1.00 0.00 H TER 66477 WAT 9199 ATOM 66477 O WAT 9200 36.750 113.203 145.246 1.00 0.00 O ATOM 66478 H1 WAT 9200 36.428 114.072 145.486 1.00 0.00 H ATOM 66479 H2 WAT 9200 37.689 113.237 145.429 1.00 0.00 H TER 66481 WAT 9200 ATOM 66481 O WAT 9201 43.833 131.241 128.401 1.00 0.00 O ATOM 66482 H1 WAT 9201 43.689 130.988 127.489 1.00 0.00 H ATOM 66483 H2 WAT 9201 42.953 131.343 128.763 1.00 0.00 H TER 66485 WAT 9201 ATOM 66485 O WAT 9202 44.344 131.809 61.743 1.00 0.00 O ATOM 66486 H1 WAT 9202 44.742 131.145 61.179 1.00 0.00 H ATOM 66487 H2 WAT 9202 44.160 132.542 61.155 1.00 0.00 H TER 66489 WAT 9202 ATOM 66489 O WAT 9203 80.138 66.881 148.097 1.00 0.00 O ATOM 66490 H1 WAT 9203 79.264 66.569 147.861 1.00 0.00 H ATOM 66491 H2 WAT 9203 80.008 67.796 148.344 1.00 0.00 H TER 66493 WAT 9203 ATOM 66493 O WAT 9204 71.599 67.047 18.537 1.00 0.00 O ATOM 66494 H1 WAT 9204 71.901 67.033 19.445 1.00 0.00 H ATOM 66495 H2 WAT 9204 72.283 67.523 18.065 1.00 0.00 H TER 66497 WAT 9204 ATOM 66497 O WAT 9205 109.346 70.356 95.793 1.00 0.00 O ATOM 66498 H1 WAT 9205 109.217 70.105 96.708 1.00 0.00 H ATOM 66499 H2 WAT 9205 109.016 71.253 95.742 1.00 0.00 H TER 66501 WAT 9205 ATOM 66501 O WAT 9206 72.624 133.024 69.093 1.00 0.00 O ATOM 66502 H1 WAT 9206 73.229 132.329 69.354 1.00 0.00 H ATOM 66503 H2 WAT 9206 72.376 132.800 68.196 1.00 0.00 H TER 66505 WAT 9206 ATOM 66505 O WAT 9207 139.451 8.125 145.065 1.00 0.00 O ATOM 66506 H1 WAT 9207 139.573 8.919 145.586 1.00 0.00 H ATOM 66507 H2 WAT 9207 138.655 8.291 144.559 1.00 0.00 H TER 66509 WAT 9207 ATOM 66509 O WAT 9208 28.514 12.867 112.546 1.00 0.00 O ATOM 66510 H1 WAT 9208 28.736 13.764 112.795 1.00 0.00 H ATOM 66511 H2 WAT 9208 27.787 12.632 113.123 1.00 0.00 H TER 66513 WAT 9208 ATOM 66513 O WAT 9209 50.500 23.804 70.493 1.00 0.00 O ATOM 66514 H1 WAT 9209 49.952 23.872 71.275 1.00 0.00 H ATOM 66515 H2 WAT 9209 51.397 23.811 70.828 1.00 0.00 H TER 66517 WAT 9209 ATOM 66517 O WAT 9210 1.369 109.446 139.294 1.00 0.00 O ATOM 66518 H1 WAT 9210 1.492 110.310 138.901 1.00 0.00 H ATOM 66519 H2 WAT 9210 1.051 109.628 140.178 1.00 0.00 H TER 66521 WAT 9210 ATOM 66521 O WAT 9211 137.358 118.137 70.929 1.00 0.00 O ATOM 66522 H1 WAT 9211 137.976 117.616 71.443 1.00 0.00 H ATOM 66523 H2 WAT 9211 137.141 118.878 71.494 1.00 0.00 H TER 66525 WAT 9211 ATOM 66525 O WAT 9212 119.999 22.518 156.373 1.00 0.00 O ATOM 66526 H1 WAT 9212 120.909 22.689 156.130 1.00 0.00 H ATOM 66527 H2 WAT 9212 120.002 21.618 156.698 1.00 0.00 H TER 66529 WAT 9212 ATOM 66529 O WAT 9213 100.721 53.594 116.123 1.00 0.00 O ATOM 66530 H1 WAT 9213 101.404 53.029 116.485 1.00 0.00 H ATOM 66531 H2 WAT 9213 100.896 53.608 115.182 1.00 0.00 H TER 66533 WAT 9213 ATOM 66533 O WAT 9214 106.500 26.086 127.469 1.00 0.00 O ATOM 66534 H1 WAT 9214 105.729 25.530 127.349 1.00 0.00 H ATOM 66535 H2 WAT 9214 106.442 26.384 128.377 1.00 0.00 H TER 66537 WAT 9214 ATOM 66537 O WAT 9215 81.291 99.871 95.496 1.00 0.00 O ATOM 66538 H1 WAT 9215 81.612 99.027 95.180 1.00 0.00 H ATOM 66539 H2 WAT 9215 81.296 100.434 94.722 1.00 0.00 H TER 66541 WAT 9215 ATOM 66541 O WAT 9216 133.519 31.081 81.486 1.00 0.00 O ATOM 66542 H1 WAT 9216 132.875 31.359 80.834 1.00 0.00 H ATOM 66543 H2 WAT 9216 133.638 31.846 82.047 1.00 0.00 H TER 66545 WAT 9216 ATOM 66545 O WAT 9217 116.618 21.784 65.079 1.00 0.00 O ATOM 66546 H1 WAT 9217 116.221 22.404 64.467 1.00 0.00 H ATOM 66547 H2 WAT 9217 117.051 21.139 64.518 1.00 0.00 H TER 66549 WAT 9217 ATOM 66549 O WAT 9218 20.545 79.823 133.962 1.00 0.00 O ATOM 66550 H1 WAT 9218 20.111 80.216 134.719 1.00 0.00 H ATOM 66551 H2 WAT 9218 20.153 78.953 133.886 1.00 0.00 H TER 66553 WAT 9218 ATOM 66553 O WAT 9219 6.980 87.533 158.014 1.00 0.00 O ATOM 66554 H1 WAT 9219 6.693 86.630 158.146 1.00 0.00 H ATOM 66555 H2 WAT 9219 6.330 87.906 157.418 1.00 0.00 H TER 66557 WAT 9219 ATOM 66557 O WAT 9220 62.275 127.664 10.497 1.00 0.00 O ATOM 66558 H1 WAT 9220 62.830 128.428 10.337 1.00 0.00 H ATOM 66559 H2 WAT 9220 61.434 127.893 10.101 1.00 0.00 H TER 66561 WAT 9220 ATOM 66561 O WAT 9221 144.254 55.105 146.240 1.00 0.00 O ATOM 66562 H1 WAT 9221 144.724 54.272 146.223 1.00 0.00 H ATOM 66563 H2 WAT 9221 144.435 55.465 147.108 1.00 0.00 H TER 66565 WAT 9221 ATOM 66565 O WAT 9222 17.558 54.470 90.043 1.00 0.00 O ATOM 66566 H1 WAT 9222 16.896 53.780 89.991 1.00 0.00 H ATOM 66567 H2 WAT 9222 18.075 54.247 90.817 1.00 0.00 H TER 66569 WAT 9222 ATOM 66569 O WAT 9223 62.557 18.116 148.572 1.00 0.00 O ATOM 66570 H1 WAT 9223 63.290 18.287 147.981 1.00 0.00 H ATOM 66571 H2 WAT 9223 62.374 18.964 148.977 1.00 0.00 H TER 66573 WAT 9223 ATOM 66573 O WAT 9224 103.583 81.516 127.873 1.00 0.00 O ATOM 66574 H1 WAT 9224 103.838 80.599 127.764 1.00 0.00 H ATOM 66575 H2 WAT 9224 102.631 81.491 127.963 1.00 0.00 H TER 66577 WAT 9224 ATOM 66577 O WAT 9225 112.607 71.144 96.663 1.00 0.00 O ATOM 66578 H1 WAT 9225 112.218 70.915 95.819 1.00 0.00 H ATOM 66579 H2 WAT 9225 113.503 71.406 96.451 1.00 0.00 H TER 66581 WAT 9225 ATOM 66581 O WAT 9226 74.976 121.461 150.002 1.00 0.00 O ATOM 66582 H1 WAT 9226 75.392 122.271 149.707 1.00 0.00 H ATOM 66583 H2 WAT 9226 74.297 121.748 150.611 1.00 0.00 H TER 66585 WAT 9226 ATOM 66585 O WAT 9227 38.266 53.960 103.410 1.00 0.00 O ATOM 66586 H1 WAT 9227 38.779 53.380 102.847 1.00 0.00 H ATOM 66587 H2 WAT 9227 37.596 53.393 103.790 1.00 0.00 H TER 66589 WAT 9227 ATOM 66589 O WAT 9228 143.864 22.569 156.386 1.00 0.00 O ATOM 66590 H1 WAT 9228 143.555 22.300 155.520 1.00 0.00 H ATOM 66591 H2 WAT 9228 143.512 23.452 156.502 1.00 0.00 H TER 66593 WAT 9228 ATOM 66593 O WAT 9229 17.277 129.152 116.672 1.00 0.00 O ATOM 66594 H1 WAT 9229 17.675 129.923 116.265 1.00 0.00 H ATOM 66595 H2 WAT 9229 16.335 129.301 116.595 1.00 0.00 H TER 66597 WAT 9229 ATOM 66597 O WAT 9230 36.257 93.638 8.427 1.00 0.00 O ATOM 66598 H1 WAT 9230 36.851 94.199 7.927 1.00 0.00 H ATOM 66599 H2 WAT 9230 35.600 93.358 7.790 1.00 0.00 H TER 66601 WAT 9230 ATOM 66601 O WAT 9231 12.054 103.159 82.534 1.00 0.00 O ATOM 66602 H1 WAT 9231 12.706 103.488 83.153 1.00 0.00 H ATOM 66603 H2 WAT 9231 11.876 103.901 81.957 1.00 0.00 H TER 66605 WAT 9231 ATOM 66605 O WAT 9232 13.000 61.974 87.135 1.00 0.00 O ATOM 66606 H1 WAT 9232 13.343 61.749 87.999 1.00 0.00 H ATOM 66607 H2 WAT 9232 13.134 61.185 86.610 1.00 0.00 H TER 66609 WAT 9232 ATOM 66609 O WAT 9233 5.268 113.428 131.375 1.00 0.00 O ATOM 66610 H1 WAT 9233 5.655 113.174 130.538 1.00 0.00 H ATOM 66611 H2 WAT 9233 4.324 113.361 131.233 1.00 0.00 H TER 66613 WAT 9233 ATOM 66613 O WAT 9234 125.909 59.795 22.425 1.00 0.00 O ATOM 66614 H1 WAT 9234 126.125 60.038 23.325 1.00 0.00 H ATOM 66615 H2 WAT 9234 126.336 58.948 22.296 1.00 0.00 H TER 66617 WAT 9234 ATOM 66617 O WAT 9235 89.419 110.200 133.952 1.00 0.00 O ATOM 66618 H1 WAT 9235 89.782 109.448 133.484 1.00 0.00 H ATOM 66619 H2 WAT 9235 90.164 110.570 134.425 1.00 0.00 H TER 66621 WAT 9235 ATOM 66621 O WAT 9236 94.031 127.989 89.248 1.00 0.00 O ATOM 66622 H1 WAT 9236 93.881 127.043 89.254 1.00 0.00 H ATOM 66623 H2 WAT 9236 94.774 128.109 88.656 1.00 0.00 H TER 66625 WAT 9236 ATOM 66625 O WAT 9237 77.138 107.635 129.816 1.00 0.00 O ATOM 66626 H1 WAT 9237 77.349 108.265 129.128 1.00 0.00 H ATOM 66627 H2 WAT 9237 76.746 108.162 130.512 1.00 0.00 H TER 66629 WAT 9237 ATOM 66629 O WAT 9238 116.671 0.214 64.397 1.00 0.00 O ATOM 66630 H1 WAT 9238 117.336 0.852 64.136 1.00 0.00 H ATOM 66631 H2 WAT 9238 117.063 -0.636 64.196 1.00 0.00 H TER 66633 WAT 9238 ATOM 66633 O WAT 9239 31.220 13.240 90.348 1.00 0.00 O ATOM 66634 H1 WAT 9239 30.680 13.885 89.889 1.00 0.00 H ATOM 66635 H2 WAT 9239 32.023 13.712 90.566 1.00 0.00 H TER 66637 WAT 9239 ATOM 66637 O WAT 9240 2.387 2.214 82.588 1.00 0.00 O ATOM 66638 H1 WAT 9240 3.322 2.308 82.774 1.00 0.00 H ATOM 66639 H2 WAT 9240 2.124 3.068 82.247 1.00 0.00 H TER 66641 WAT 9240 ATOM 66641 O WAT 9241 99.157 76.257 158.250 1.00 0.00 O ATOM 66642 H1 WAT 9241 98.346 76.758 158.337 1.00 0.00 H ATOM 66643 H2 WAT 9241 98.873 75.390 157.958 1.00 0.00 H TER 66645 WAT 9241 ATOM 66645 O WAT 9242 96.943 57.662 156.907 1.00 0.00 O ATOM 66646 H1 WAT 9242 96.657 57.816 157.808 1.00 0.00 H ATOM 66647 H2 WAT 9242 97.162 56.730 156.882 1.00 0.00 H TER 66649 WAT 9242 ATOM 66649 O WAT 9243 36.531 102.106 59.638 1.00 0.00 O ATOM 66650 H1 WAT 9243 36.948 102.077 60.499 1.00 0.00 H ATOM 66651 H2 WAT 9243 36.687 101.238 59.266 1.00 0.00 H TER 66653 WAT 9243 ATOM 66653 O WAT 9244 94.581 37.035 54.330 1.00 0.00 O ATOM 66654 H1 WAT 9244 94.956 36.166 54.476 1.00 0.00 H ATOM 66655 H2 WAT 9244 94.754 37.510 55.143 1.00 0.00 H TER 66657 WAT 9244 ATOM 66657 O WAT 9245 107.929 11.022 6.560 1.00 0.00 O ATOM 66658 H1 WAT 9245 107.361 11.631 6.088 1.00 0.00 H ATOM 66659 H2 WAT 9245 107.846 11.279 7.478 1.00 0.00 H TER 66661 WAT 9245 ATOM 66661 O WAT 9246 25.739 119.615 92.544 1.00 0.00 O ATOM 66662 H1 WAT 9246 25.087 119.364 91.889 1.00 0.00 H ATOM 66663 H2 WAT 9246 25.856 118.829 93.078 1.00 0.00 H TER 66665 WAT 9246 ATOM 66665 O WAT 9247 48.738 128.370 110.146 1.00 0.00 O ATOM 66666 H1 WAT 9247 47.845 128.551 109.852 1.00 0.00 H ATOM 66667 H2 WAT 9247 49.289 128.932 109.602 1.00 0.00 H TER 66669 WAT 9247 ATOM 66669 O WAT 9248 132.965 138.623 120.646 1.00 0.00 O ATOM 66670 H1 WAT 9248 132.092 138.621 120.252 1.00 0.00 H ATOM 66671 H2 WAT 9248 133.504 139.120 120.030 1.00 0.00 H TER 66673 WAT 9248 ATOM 66673 O WAT 9249 4.608 68.866 1.467 1.00 0.00 O ATOM 66674 H1 WAT 9249 3.829 69.321 1.787 1.00 0.00 H ATOM 66675 H2 WAT 9249 5.341 69.334 1.867 1.00 0.00 H TER 66677 WAT 9249 ATOM 66677 O WAT 9250 7.346 65.428 82.989 1.00 0.00 O ATOM 66678 H1 WAT 9250 6.687 64.936 83.478 1.00 0.00 H ATOM 66679 H2 WAT 9250 7.693 64.800 82.356 1.00 0.00 H TER 66681 WAT 9250 ATOM 66681 O WAT 9251 74.455 6.301 62.089 1.00 0.00 O ATOM 66682 H1 WAT 9251 75.061 6.842 62.595 1.00 0.00 H ATOM 66683 H2 WAT 9251 73.629 6.354 62.569 1.00 0.00 H TER 66685 WAT 9251 ATOM 66685 O WAT 9252 83.210 71.018 121.301 1.00 0.00 O ATOM 66686 H1 WAT 9252 83.211 70.067 121.407 1.00 0.00 H ATOM 66687 H2 WAT 9252 82.915 71.158 120.401 1.00 0.00 H TER 66689 WAT 9252 ATOM 66689 O WAT 9253 73.086 2.680 130.869 1.00 0.00 O ATOM 66690 H1 WAT 9253 72.794 2.944 129.997 1.00 0.00 H ATOM 66691 H2 WAT 9253 73.502 3.463 131.230 1.00 0.00 H TER 66693 WAT 9253 ATOM 66693 O WAT 9254 118.803 89.904 136.982 1.00 0.00 O ATOM 66694 H1 WAT 9254 118.410 89.167 137.450 1.00 0.00 H ATOM 66695 H2 WAT 9254 118.276 90.660 137.240 1.00 0.00 H TER 66697 WAT 9254 ATOM 66697 O WAT 9255 130.808 137.666 102.898 1.00 0.00 O ATOM 66698 H1 WAT 9255 131.738 137.863 103.013 1.00 0.00 H ATOM 66699 H2 WAT 9255 130.526 137.334 103.750 1.00 0.00 H TER 66701 WAT 9255 ATOM 66701 O WAT 9256 102.392 17.986 92.276 1.00 0.00 O ATOM 66702 H1 WAT 9256 102.725 17.624 91.455 1.00 0.00 H ATOM 66703 H2 WAT 9256 102.092 17.223 92.770 1.00 0.00 H TER 66705 WAT 9256 ATOM 66705 O WAT 9257 40.987 21.286 118.876 1.00 0.00 O ATOM 66706 H1 WAT 9257 41.742 21.765 118.535 1.00 0.00 H ATOM 66707 H2 WAT 9257 40.325 21.960 119.030 1.00 0.00 H TER 66709 WAT 9257 ATOM 66709 O WAT 9258 53.021 92.842 64.549 1.00 0.00 O ATOM 66710 H1 WAT 9258 52.451 93.533 64.886 1.00 0.00 H ATOM 66711 H2 WAT 9258 52.595 92.552 63.743 1.00 0.00 H TER 66713 WAT 9258 ATOM 66713 O WAT 9259 92.914 13.733 67.191 1.00 0.00 O ATOM 66714 H1 WAT 9259 92.922 13.071 67.882 1.00 0.00 H ATOM 66715 H2 WAT 9259 93.821 13.776 66.890 1.00 0.00 H TER 66717 WAT 9259 ATOM 66717 O WAT 9260 45.056 41.988 89.661 1.00 0.00 O ATOM 66718 H1 WAT 9260 44.429 42.021 90.383 1.00 0.00 H ATOM 66719 H2 WAT 9260 44.531 41.738 88.900 1.00 0.00 H TER 66721 WAT 9260 ATOM 66721 O WAT 9261 94.158 51.465 153.194 1.00 0.00 O ATOM 66722 H1 WAT 9261 94.430 51.638 152.293 1.00 0.00 H ATOM 66723 H2 WAT 9261 93.805 52.300 153.503 1.00 0.00 H TER 66725 WAT 9261 ATOM 66725 O WAT 9262 38.174 22.034 15.418 1.00 0.00 O ATOM 66726 H1 WAT 9262 37.678 22.605 14.832 1.00 0.00 H ATOM 66727 H2 WAT 9262 38.159 22.484 16.262 1.00 0.00 H TER 66729 WAT 9262 ATOM 66729 O WAT 9263 102.748 115.456 80.888 1.00 0.00 O ATOM 66730 H1 WAT 9263 102.735 115.108 79.997 1.00 0.00 H ATOM 66731 H2 WAT 9263 102.586 116.393 80.782 1.00 0.00 H TER 66733 WAT 9263 ATOM 66733 O WAT 9264 0.180 39.856 136.832 1.00 0.00 O ATOM 66734 H1 WAT 9264 1.084 40.064 137.068 1.00 0.00 H ATOM 66735 H2 WAT 9264 0.044 38.969 137.165 1.00 0.00 H TER 66737 WAT 9264 ATOM 66737 O WAT 9265 52.308 53.291 109.649 1.00 0.00 O ATOM 66738 H1 WAT 9265 53.223 53.328 109.370 1.00 0.00 H ATOM 66739 H2 WAT 9265 52.241 53.950 110.339 1.00 0.00 H TER 66741 WAT 9265 ATOM 66741 O WAT 9266 137.498 23.678 16.072 1.00 0.00 O ATOM 66742 H1 WAT 9266 137.962 24.006 15.302 1.00 0.00 H ATOM 66743 H2 WAT 9266 136.738 24.255 16.157 1.00 0.00 H TER 66745 WAT 9266 ATOM 66745 O WAT 9267 72.230 57.505 66.577 1.00 0.00 O ATOM 66746 H1 WAT 9267 71.710 57.228 65.823 1.00 0.00 H ATOM 66747 H2 WAT 9267 73.113 57.628 66.227 1.00 0.00 H TER 66749 WAT 9267 ATOM 66749 O WAT 9268 77.204 17.313 142.392 1.00 0.00 O ATOM 66750 H1 WAT 9268 76.260 17.178 142.467 1.00 0.00 H ATOM 66751 H2 WAT 9268 77.343 17.526 141.469 1.00 0.00 H TER 66753 WAT 9268 ATOM 66753 O WAT 9269 111.585 19.291 96.627 1.00 0.00 O ATOM 66754 H1 WAT 9269 112.258 19.863 96.259 1.00 0.00 H ATOM 66755 H2 WAT 9269 112.067 18.688 97.194 1.00 0.00 H TER 66757 WAT 9269 ATOM 66757 O WAT 9270 143.269 142.308 149.332 1.00 0.00 O ATOM 66758 H1 WAT 9270 142.362 142.551 149.520 1.00 0.00 H ATOM 66759 H2 WAT 9270 143.574 141.884 150.134 1.00 0.00 H TER 66761 WAT 9270 ATOM 66761 O WAT 9271 76.318 103.864 122.892 1.00 0.00 O ATOM 66762 H1 WAT 9271 76.053 104.730 123.201 1.00 0.00 H ATOM 66763 H2 WAT 9271 76.905 103.536 123.573 1.00 0.00 H TER 66765 WAT 9271 ATOM 66765 O WAT 9272 89.566 112.975 75.852 1.00 0.00 O ATOM 66766 H1 WAT 9272 90.101 112.306 75.423 1.00 0.00 H ATOM 66767 H2 WAT 9272 89.769 113.783 75.381 1.00 0.00 H TER 66769 WAT 9272 ATOM 66769 O WAT 9273 127.750 91.128 147.239 1.00 0.00 O ATOM 66770 H1 WAT 9273 128.637 91.417 147.026 1.00 0.00 H ATOM 66771 H2 WAT 9273 127.827 90.181 147.353 1.00 0.00 H TER 66773 WAT 9273 ATOM 66773 O WAT 9274 71.414 96.337 106.921 1.00 0.00 O ATOM 66774 H1 WAT 9274 71.209 96.349 107.856 1.00 0.00 H ATOM 66775 H2 WAT 9274 71.531 97.258 106.689 1.00 0.00 H TER 66777 WAT 9274 ATOM 66777 O WAT 9275 83.997 26.060 134.401 1.00 0.00 O ATOM 66778 H1 WAT 9275 83.520 25.682 133.662 1.00 0.00 H ATOM 66779 H2 WAT 9275 83.669 26.957 134.464 1.00 0.00 H TER 66781 WAT 9275 ATOM 66781 O WAT 9276 84.430 94.876 145.026 1.00 0.00 O ATOM 66782 H1 WAT 9276 83.799 95.454 145.456 1.00 0.00 H ATOM 66783 H2 WAT 9276 85.217 95.412 144.927 1.00 0.00 H TER 66785 WAT 9276 ATOM 66785 O WAT 9277 14.139 89.428 138.918 1.00 0.00 O ATOM 66786 H1 WAT 9277 14.245 90.046 139.641 1.00 0.00 H ATOM 66787 H2 WAT 9277 14.874 88.823 139.010 1.00 0.00 H TER 66789 WAT 9277 ATOM 66789 O WAT 9278 17.862 117.711 110.406 1.00 0.00 O ATOM 66790 H1 WAT 9278 18.453 118.453 110.527 1.00 0.00 H ATOM 66791 H2 WAT 9278 17.001 118.109 110.274 1.00 0.00 H TER 66793 WAT 9278 ATOM 66793 O WAT 9279 131.200 40.780 15.847 1.00 0.00 O ATOM 66794 H1 WAT 9279 132.038 41.071 16.206 1.00 0.00 H ATOM 66795 H2 WAT 9279 130.543 41.253 16.358 1.00 0.00 H TER 66797 WAT 9279 ATOM 66797 O WAT 9280 91.136 25.681 101.909 1.00 0.00 O ATOM 66798 H1 WAT 9280 90.753 26.497 101.587 1.00 0.00 H ATOM 66799 H2 WAT 9280 91.567 25.300 101.144 1.00 0.00 H TER 66801 WAT 9280 ATOM 66801 O WAT 9281 71.625 23.579 10.005 1.00 0.00 O ATOM 66802 H1 WAT 9281 72.362 23.090 9.638 1.00 0.00 H ATOM 66803 H2 WAT 9281 70.911 23.438 9.383 1.00 0.00 H TER 66805 WAT 9281 ATOM 66805 O WAT 9282 43.573 142.067 158.361 1.00 0.00 O ATOM 66806 H1 WAT 9282 43.607 141.112 158.302 1.00 0.00 H ATOM 66807 H2 WAT 9282 42.895 142.321 157.735 1.00 0.00 H TER 66809 WAT 9282 ATOM 66809 O WAT 9283 119.957 82.419 92.482 1.00 0.00 O ATOM 66810 H1 WAT 9283 119.359 82.999 92.011 1.00 0.00 H ATOM 66811 H2 WAT 9283 120.825 82.793 92.328 1.00 0.00 H TER 66813 WAT 9283 ATOM 66813 O WAT 9284 4.639 96.901 69.972 1.00 0.00 O ATOM 66814 H1 WAT 9284 4.592 95.947 70.035 1.00 0.00 H ATOM 66815 H2 WAT 9284 4.840 97.071 69.051 1.00 0.00 H TER 66817 WAT 9284 ATOM 66817 O WAT 9285 114.447 38.477 110.744 1.00 0.00 O ATOM 66818 H1 WAT 9285 114.453 37.537 110.558 1.00 0.00 H ATOM 66819 H2 WAT 9285 113.753 38.826 110.184 1.00 0.00 H TER 66821 WAT 9285 ATOM 66821 O WAT 9286 119.745 22.087 139.497 1.00 0.00 O ATOM 66822 H1 WAT 9286 120.495 22.014 140.087 1.00 0.00 H ATOM 66823 H2 WAT 9286 118.983 21.946 140.059 1.00 0.00 H TER 66825 WAT 9286 ATOM 66825 O WAT 9287 8.651 101.063 87.394 1.00 0.00 O ATOM 66826 H1 WAT 9287 9.587 100.890 87.496 1.00 0.00 H ATOM 66827 H2 WAT 9287 8.603 101.728 86.707 1.00 0.00 H TER 66829 WAT 9287 ATOM 66829 O WAT 9288 81.796 54.129 144.967 1.00 0.00 O ATOM 66830 H1 WAT 9288 81.983 53.250 145.297 1.00 0.00 H ATOM 66831 H2 WAT 9288 80.963 54.039 144.504 1.00 0.00 H TER 66833 WAT 9288 ATOM 66833 O WAT 9289 17.273 71.635 118.147 1.00 0.00 O ATOM 66834 H1 WAT 9289 16.351 71.835 117.984 1.00 0.00 H ATOM 66835 H2 WAT 9289 17.464 70.898 117.568 1.00 0.00 H TER 66837 WAT 9289 ATOM 66837 O WAT 9290 30.510 142.111 76.717 1.00 0.00 O ATOM 66838 H1 WAT 9290 30.109 142.938 76.984 1.00 0.00 H ATOM 66839 H2 WAT 9290 31.323 142.065 77.221 1.00 0.00 H TER 66841 WAT 9290 ATOM 66841 O WAT 9291 64.301 145.355 152.630 1.00 0.00 O ATOM 66842 H1 WAT 9291 63.828 144.523 152.618 1.00 0.00 H ATOM 66843 H2 WAT 9291 65.112 145.176 152.154 1.00 0.00 H TER 66845 WAT 9291 ATOM 66845 O WAT 9292 134.009 102.301 62.783 1.00 0.00 O ATOM 66846 H1 WAT 9292 133.522 101.581 62.383 1.00 0.00 H ATOM 66847 H2 WAT 9292 134.881 102.246 62.393 1.00 0.00 H TER 66849 WAT 9292 ATOM 66849 O WAT 9293 47.924 124.834 139.509 1.00 0.00 O ATOM 66850 H1 WAT 9293 48.052 125.665 139.967 1.00 0.00 H ATOM 66851 H2 WAT 9293 48.427 124.927 138.700 1.00 0.00 H TER 66853 WAT 9293 ATOM 66853 O WAT 9294 124.152 29.197 94.948 1.00 0.00 O ATOM 66854 H1 WAT 9294 125.106 29.276 94.940 1.00 0.00 H ATOM 66855 H2 WAT 9294 123.985 28.276 94.747 1.00 0.00 H TER 66857 WAT 9294 ATOM 66857 O WAT 9295 55.117 21.170 70.176 1.00 0.00 O ATOM 66858 H1 WAT 9295 54.648 21.837 69.675 1.00 0.00 H ATOM 66859 H2 WAT 9295 54.675 20.350 69.956 1.00 0.00 H TER 66861 WAT 9295 ATOM 66861 O WAT 9296 142.690 69.063 1.788 1.00 0.00 O ATOM 66862 H1 WAT 9296 142.129 69.392 2.490 1.00 0.00 H ATOM 66863 H2 WAT 9296 143.302 69.778 1.614 1.00 0.00 H TER 66865 WAT 9296 ATOM 66865 O WAT 9297 73.674 1.849 3.592 1.00 0.00 O ATOM 66866 H1 WAT 9297 74.095 2.631 3.948 1.00 0.00 H ATOM 66867 H2 WAT 9297 74.381 1.207 3.523 1.00 0.00 H TER 66869 WAT 9297 ATOM 66869 O WAT 9298 133.992 21.876 102.308 1.00 0.00 O ATOM 66870 H1 WAT 9298 133.737 22.129 101.421 1.00 0.00 H ATOM 66871 H2 WAT 9298 134.197 22.703 102.743 1.00 0.00 H TER 66873 WAT 9298 ATOM 66873 O WAT 9299 30.271 4.118 76.750 1.00 0.00 O ATOM 66874 H1 WAT 9299 29.629 4.786 76.508 1.00 0.00 H ATOM 66875 H2 WAT 9299 30.970 4.213 76.103 1.00 0.00 H TER 66877 WAT 9299 ATOM 66877 O WAT 9300 93.823 131.331 144.606 1.00 0.00 O ATOM 66878 H1 WAT 9300 94.226 131.749 145.367 1.00 0.00 H ATOM 66879 H2 WAT 9300 92.913 131.627 144.624 1.00 0.00 H TER 66881 WAT 9300 ATOM 66881 O WAT 9301 120.945 15.338 12.560 1.00 0.00 O ATOM 66882 H1 WAT 9301 121.241 15.560 13.443 1.00 0.00 H ATOM 66883 H2 WAT 9301 120.137 15.837 12.446 1.00 0.00 H TER 66885 WAT 9301 ATOM 66885 O WAT 9302 58.999 79.298 104.942 1.00 0.00 O ATOM 66886 H1 WAT 9302 58.844 79.129 105.871 1.00 0.00 H ATOM 66887 H2 WAT 9302 58.129 79.472 104.582 1.00 0.00 H TER 66889 WAT 9302 ATOM 66889 O WAT 9303 61.794 43.971 59.082 1.00 0.00 O ATOM 66890 H1 WAT 9303 62.479 44.009 59.749 1.00 0.00 H ATOM 66891 H2 WAT 9303 61.877 44.799 58.607 1.00 0.00 H TER 66893 WAT 9303 ATOM 66893 O WAT 9304 7.907 4.581 146.199 1.00 0.00 O ATOM 66894 H1 WAT 9304 8.181 5.486 146.054 1.00 0.00 H ATOM 66895 H2 WAT 9304 6.958 4.595 146.075 1.00 0.00 H TER 66897 WAT 9304 ATOM 66897 O WAT 9305 0.317 21.278 90.268 1.00 0.00 O ATOM 66898 H1 WAT 9305 -0.586 21.594 90.308 1.00 0.00 H ATOM 66899 H2 WAT 9305 0.744 21.855 89.635 1.00 0.00 H TER 66901 WAT 9305 ATOM 66901 O WAT 9306 38.244 114.488 118.599 1.00 0.00 O ATOM 66902 H1 WAT 9306 37.886 114.647 119.473 1.00 0.00 H ATOM 66903 H2 WAT 9306 38.775 115.263 118.414 1.00 0.00 H TER 66905 WAT 9306 ATOM 66905 O WAT 9307 111.917 85.014 133.543 1.00 0.00 O ATOM 66906 H1 WAT 9307 112.545 84.339 133.800 1.00 0.00 H ATOM 66907 H2 WAT 9307 112.410 85.588 132.956 1.00 0.00 H TER 66909 WAT 9307 ATOM 66909 O WAT 9308 82.806 94.435 21.600 1.00 0.00 O ATOM 66910 H1 WAT 9308 82.501 94.549 20.700 1.00 0.00 H ATOM 66911 H2 WAT 9308 82.478 95.206 22.063 1.00 0.00 H TER 66913 WAT 9308 ATOM 66913 O WAT 9309 69.742 123.982 113.503 1.00 0.00 O ATOM 66914 H1 WAT 9309 70.252 123.871 112.701 1.00 0.00 H ATOM 66915 H2 WAT 9309 69.954 124.866 113.801 1.00 0.00 H TER 66917 WAT 9309 ATOM 66917 O WAT 9310 142.841 82.565 101.160 1.00 0.00 O ATOM 66918 H1 WAT 9310 143.577 81.955 101.097 1.00 0.00 H ATOM 66919 H2 WAT 9310 142.761 82.935 100.281 1.00 0.00 H TER 66921 WAT 9310 ATOM 66921 O WAT 9311 4.479 132.276 0.401 1.00 0.00 O ATOM 66922 H1 WAT 9311 4.158 132.716 1.188 1.00 0.00 H ATOM 66923 H2 WAT 9311 5.343 132.659 0.247 1.00 0.00 H TER 66925 WAT 9311 ATOM 66925 O WAT 9312 26.929 131.689 63.157 1.00 0.00 O ATOM 66926 H1 WAT 9312 27.609 131.084 62.863 1.00 0.00 H ATOM 66927 H2 WAT 9312 26.161 131.135 63.301 1.00 0.00 H TER 66929 WAT 9312 ATOM 66929 O WAT 9313 75.898 7.342 16.985 1.00 0.00 O ATOM 66930 H1 WAT 9313 75.803 6.804 17.771 1.00 0.00 H ATOM 66931 H2 WAT 9313 75.566 8.202 17.242 1.00 0.00 H TER 66933 WAT 9313 ATOM 66933 O WAT 9314 5.145 124.129 8.380 1.00 0.00 O ATOM 66934 H1 WAT 9314 4.500 123.839 7.734 1.00 0.00 H ATOM 66935 H2 WAT 9314 5.990 124.005 7.947 1.00 0.00 H TER 66937 WAT 9314 ATOM 66937 O WAT 9315 46.577 34.245 107.223 1.00 0.00 O ATOM 66938 H1 WAT 9315 47.207 34.548 106.568 1.00 0.00 H ATOM 66939 H2 WAT 9315 45.778 34.737 107.032 1.00 0.00 H TER 66941 WAT 9315 ATOM 66941 O WAT 9316 14.160 56.740 153.473 1.00 0.00 O ATOM 66942 H1 WAT 9316 13.286 56.647 153.852 1.00 0.00 H ATOM 66943 H2 WAT 9316 14.002 57.046 152.580 1.00 0.00 H TER 66945 WAT 9316 ATOM 66945 O WAT 9317 36.895 133.252 12.578 1.00 0.00 O ATOM 66946 H1 WAT 9317 36.961 132.797 13.417 1.00 0.00 H ATOM 66947 H2 WAT 9317 37.764 133.162 12.188 1.00 0.00 H TER 66949 WAT 9317 ATOM 66949 O WAT 9318 140.776 69.069 53.833 1.00 0.00 O ATOM 66950 H1 WAT 9318 141.693 69.334 53.755 1.00 0.00 H ATOM 66951 H2 WAT 9318 140.710 68.277 53.298 1.00 0.00 H TER 66953 WAT 9318 ATOM 66953 O WAT 9319 109.087 30.997 113.601 1.00 0.00 O ATOM 66954 H1 WAT 9319 108.918 31.656 114.274 1.00 0.00 H ATOM 66955 H2 WAT 9319 108.358 30.383 113.679 1.00 0.00 H TER 66957 WAT 9319 ATOM 66957 O WAT 9320 29.349 85.981 25.736 1.00 0.00 O ATOM 66958 H1 WAT 9320 29.787 86.210 26.555 1.00 0.00 H ATOM 66959 H2 WAT 9320 28.810 86.744 25.530 1.00 0.00 H TER 66961 WAT 9320 ATOM 66961 O WAT 9321 104.301 2.340 100.873 1.00 0.00 O ATOM 66962 H1 WAT 9321 103.947 2.794 101.638 1.00 0.00 H ATOM 66963 H2 WAT 9321 104.018 2.871 100.128 1.00 0.00 H TER 66965 WAT 9321 ATOM 66965 O WAT 9322 136.571 113.567 99.245 1.00 0.00 O ATOM 66966 H1 WAT 9322 136.904 112.739 99.591 1.00 0.00 H ATOM 66967 H2 WAT 9322 135.903 113.309 98.609 1.00 0.00 H TER 66969 WAT 9322 ATOM 66969 O WAT 9323 10.634 126.874 119.116 1.00 0.00 O ATOM 66970 H1 WAT 9323 10.524 127.521 118.419 1.00 0.00 H ATOM 66971 H2 WAT 9323 9.992 127.127 119.779 1.00 0.00 H TER 66973 WAT 9323 ATOM 66973 O WAT 9324 10.229 8.443 108.241 1.00 0.00 O ATOM 66974 H1 WAT 9324 10.893 7.902 108.668 1.00 0.00 H ATOM 66975 H2 WAT 9324 9.617 7.815 107.859 1.00 0.00 H TER 66977 WAT 9324 ATOM 66977 O WAT 9325 97.364 133.674 81.752 1.00 0.00 O ATOM 66978 H1 WAT 9325 96.963 132.831 81.537 1.00 0.00 H ATOM 66979 H2 WAT 9325 96.706 134.123 82.283 1.00 0.00 H TER 66981 WAT 9325 ATOM 66981 O WAT 9326 56.205 37.830 4.275 1.00 0.00 O ATOM 66982 H1 WAT 9326 57.093 37.763 4.627 1.00 0.00 H ATOM 66983 H2 WAT 9326 55.956 36.927 4.079 1.00 0.00 H TER 66985 WAT 9326 ATOM 66985 O WAT 9327 71.768 129.638 142.147 1.00 0.00 O ATOM 66986 H1 WAT 9327 72.110 128.815 141.797 1.00 0.00 H ATOM 66987 H2 WAT 9327 72.045 130.300 141.514 1.00 0.00 H TER 66989 WAT 9327 ATOM 66989 O WAT 9328 28.341 27.188 68.069 1.00 0.00 O ATOM 66990 H1 WAT 9328 28.014 27.375 67.189 1.00 0.00 H ATOM 66991 H2 WAT 9328 27.608 27.403 68.647 1.00 0.00 H TER 66993 WAT 9328 ATOM 66993 O WAT 9329 7.793 71.956 83.225 1.00 0.00 O ATOM 66994 H1 WAT 9329 7.762 71.116 83.682 1.00 0.00 H ATOM 66995 H2 WAT 9329 7.423 71.773 82.362 1.00 0.00 H TER 66997 WAT 9329 ATOM 66997 O WAT 9330 124.864 138.038 2.358 1.00 0.00 O ATOM 66998 H1 WAT 9330 124.117 138.509 2.725 1.00 0.00 H ATOM 66999 H2 WAT 9330 125.431 138.724 2.005 1.00 0.00 H TER 67001 WAT 9330 ATOM 67001 O WAT 9331 123.333 115.269 133.726 1.00 0.00 O ATOM 67002 H1 WAT 9331 123.113 114.606 133.072 1.00 0.00 H ATOM 67003 H2 WAT 9331 122.905 116.066 133.412 1.00 0.00 H TER 67005 WAT 9331 ATOM 67005 O WAT 9332 55.990 8.918 151.960 1.00 0.00 O ATOM 67006 H1 WAT 9332 56.391 9.290 151.175 1.00 0.00 H ATOM 67007 H2 WAT 9332 55.416 9.611 152.288 1.00 0.00 H TER 67009 WAT 9332 ATOM 67009 O WAT 9333 63.645 21.542 10.354 1.00 0.00 O ATOM 67010 H1 WAT 9333 64.576 21.371 10.208 1.00 0.00 H ATOM 67011 H2 WAT 9333 63.452 21.122 11.191 1.00 0.00 H TER 67013 WAT 9333 ATOM 67013 O WAT 9334 143.084 99.526 149.596 1.00 0.00 O ATOM 67014 H1 WAT 9334 142.408 99.326 148.949 1.00 0.00 H ATOM 67015 H2 WAT 9334 143.064 98.785 150.201 1.00 0.00 H TER 67017 WAT 9334 ATOM 67017 O WAT 9335 143.151 20.987 101.915 1.00 0.00 O ATOM 67018 H1 WAT 9335 142.826 20.799 101.035 1.00 0.00 H ATOM 67019 H2 WAT 9335 143.008 20.176 102.402 1.00 0.00 H TER 67021 WAT 9335 ATOM 67021 O WAT 9336 40.727 86.170 94.232 1.00 0.00 O ATOM 67022 H1 WAT 9336 41.462 85.674 93.871 1.00 0.00 H ATOM 67023 H2 WAT 9336 41.032 86.457 95.093 1.00 0.00 H TER 67025 WAT 9336 ATOM 67025 O WAT 9337 124.993 26.024 109.531 1.00 0.00 O ATOM 67026 H1 WAT 9337 124.324 25.643 110.099 1.00 0.00 H ATOM 67027 H2 WAT 9337 124.498 26.445 108.828 1.00 0.00 H TER 67029 WAT 9337 ATOM 67029 O WAT 9338 4.817 140.306 97.129 1.00 0.00 O ATOM 67030 H1 WAT 9338 5.640 140.757 96.941 1.00 0.00 H ATOM 67031 H2 WAT 9338 4.374 140.251 96.282 1.00 0.00 H TER 67033 WAT 9338 ATOM 67033 O WAT 9339 82.720 10.654 65.662 1.00 0.00 O ATOM 67034 H1 WAT 9339 83.042 10.259 66.472 1.00 0.00 H ATOM 67035 H2 WAT 9339 81.767 10.640 65.751 1.00 0.00 H TER 67037 WAT 9339 ATOM 67037 O WAT 9340 59.728 2.795 112.554 1.00 0.00 O ATOM 67038 H1 WAT 9340 60.309 3.520 112.325 1.00 0.00 H ATOM 67039 H2 WAT 9340 59.189 2.665 111.773 1.00 0.00 H TER 67041 WAT 9340 ATOM 67041 O WAT 9341 144.735 96.120 140.000 1.00 0.00 O ATOM 67042 H1 WAT 9341 145.239 96.316 140.790 1.00 0.00 H ATOM 67043 H2 WAT 9341 143.838 95.998 140.312 1.00 0.00 H TER 67045 WAT 9341 ATOM 67045 O WAT 9342 21.177 130.107 138.041 1.00 0.00 O ATOM 67046 H1 WAT 9342 20.553 130.379 138.713 1.00 0.00 H ATOM 67047 H2 WAT 9342 21.372 129.194 138.251 1.00 0.00 H TER 67049 WAT 9342 ATOM 67049 O WAT 9343 104.350 52.340 158.233 1.00 0.00 O ATOM 67050 H1 WAT 9343 103.730 52.540 158.934 1.00 0.00 H ATOM 67051 H2 WAT 9343 104.566 51.416 158.360 1.00 0.00 H TER 67053 WAT 9343 ATOM 67053 O WAT 9344 38.281 96.817 156.019 1.00 0.00 O ATOM 67054 H1 WAT 9344 38.051 97.443 156.706 1.00 0.00 H ATOM 67055 H2 WAT 9344 37.809 97.125 155.246 1.00 0.00 H TER 67057 WAT 9344 ATOM 67057 O WAT 9345 55.423 70.956 15.812 1.00 0.00 O ATOM 67058 H1 WAT 9345 55.698 71.730 16.304 1.00 0.00 H ATOM 67059 H2 WAT 9345 54.620 71.228 15.368 1.00 0.00 H TER 67061 WAT 9345 ATOM 67061 O WAT 9346 11.107 30.021 137.698 1.00 0.00 O ATOM 67062 H1 WAT 9346 11.946 29.783 137.304 1.00 0.00 H ATOM 67063 H2 WAT 9346 11.186 30.958 137.881 1.00 0.00 H TER 67065 WAT 9346 ATOM 67065 O WAT 9347 115.363 55.450 21.067 1.00 0.00 O ATOM 67066 H1 WAT 9347 114.754 54.849 20.640 1.00 0.00 H ATOM 67067 H2 WAT 9347 116.057 55.587 20.422 1.00 0.00 H TER 67069 WAT 9347 ATOM 67069 O WAT 9348 60.163 121.680 77.979 1.00 0.00 O ATOM 67070 H1 WAT 9348 60.714 121.298 78.663 1.00 0.00 H ATOM 67071 H2 WAT 9348 59.343 121.892 78.424 1.00 0.00 H TER 67073 WAT 9348 ATOM 67073 O WAT 9349 32.183 145.377 106.595 1.00 0.00 O ATOM 67074 H1 WAT 9349 31.800 144.728 107.185 1.00 0.00 H ATOM 67075 H2 WAT 9349 32.279 144.915 105.761 1.00 0.00 H TER 67077 WAT 9349 ATOM 67077 O WAT 9350 135.434 20.962 64.010 1.00 0.00 O ATOM 67078 H1 WAT 9350 135.275 21.614 63.327 1.00 0.00 H ATOM 67079 H2 WAT 9350 135.557 21.476 64.808 1.00 0.00 H TER 67081 WAT 9350 ATOM 67081 O WAT 9351 17.750 81.863 25.642 1.00 0.00 O ATOM 67082 H1 WAT 9351 17.223 82.363 26.265 1.00 0.00 H ATOM 67083 H2 WAT 9351 18.234 82.528 25.150 1.00 0.00 H TER 67085 WAT 9351 ATOM 67085 O WAT 9352 58.593 31.353 158.871 1.00 0.00 O ATOM 67086 H1 WAT 9352 58.660 30.533 158.382 1.00 0.00 H ATOM 67087 H2 WAT 9352 58.056 31.919 158.317 1.00 0.00 H TER 67089 WAT 9352 ATOM 67089 O WAT 9353 103.811 19.960 114.493 1.00 0.00 O ATOM 67090 H1 WAT 9353 103.506 20.176 113.612 1.00 0.00 H ATOM 67091 H2 WAT 9353 103.470 20.664 115.044 1.00 0.00 H TER 67093 WAT 9353 ATOM 67093 O WAT 9354 101.306 27.621 65.516 1.00 0.00 O ATOM 67094 H1 WAT 9354 100.607 27.902 66.106 1.00 0.00 H ATOM 67095 H2 WAT 9354 101.223 26.668 65.483 1.00 0.00 H TER 67097 WAT 9354 ATOM 67097 O WAT 9355 127.172 1.629 137.483 1.00 0.00 O ATOM 67098 H1 WAT 9355 127.135 0.771 137.905 1.00 0.00 H ATOM 67099 H2 WAT 9355 126.639 1.531 136.694 1.00 0.00 H TER 67101 WAT 9355 ATOM 67101 O WAT 9356 29.753 140.616 84.560 1.00 0.00 O ATOM 67102 H1 WAT 9356 29.513 141.482 84.231 1.00 0.00 H ATOM 67103 H2 WAT 9356 29.710 140.047 83.792 1.00 0.00 H TER 67105 WAT 9356 ATOM 67105 O WAT 9357 41.791 118.462 64.024 1.00 0.00 O ATOM 67106 H1 WAT 9357 41.315 118.977 64.676 1.00 0.00 H ATOM 67107 H2 WAT 9357 41.895 119.055 63.280 1.00 0.00 H TER 67109 WAT 9357 ATOM 67109 O WAT 9358 79.261 51.978 157.019 1.00 0.00 O ATOM 67110 H1 WAT 9358 79.625 51.530 156.256 1.00 0.00 H ATOM 67111 H2 WAT 9358 78.703 51.322 157.438 1.00 0.00 H TER 67113 WAT 9358 ATOM 67113 O WAT 9359 130.906 54.784 12.037 1.00 0.00 O ATOM 67114 H1 WAT 9359 131.095 55.613 11.599 1.00 0.00 H ATOM 67115 H2 WAT 9359 131.711 54.275 11.945 1.00 0.00 H TER 67117 WAT 9359 ATOM 67117 O WAT 9360 18.960 83.202 146.355 1.00 0.00 O ATOM 67118 H1 WAT 9360 18.783 84.143 146.331 1.00 0.00 H ATOM 67119 H2 WAT 9360 18.397 82.870 147.053 1.00 0.00 H TER 67121 WAT 9360 ATOM 67121 O WAT 9361 90.143 47.202 10.520 1.00 0.00 O ATOM 67122 H1 WAT 9361 90.565 46.615 11.147 1.00 0.00 H ATOM 67123 H2 WAT 9361 89.830 46.624 9.824 1.00 0.00 H TER 67125 WAT 9361 ATOM 67125 O WAT 9362 26.864 54.930 14.091 1.00 0.00 O ATOM 67126 H1 WAT 9362 27.079 54.516 13.255 1.00 0.00 H ATOM 67127 H2 WAT 9362 25.924 55.103 14.037 1.00 0.00 H TER 67129 WAT 9362 ATOM 67129 O WAT 9363 97.381 7.606 157.415 1.00 0.00 O ATOM 67130 H1 WAT 9363 96.607 8.025 157.039 1.00 0.00 H ATOM 67131 H2 WAT 9363 97.094 6.717 157.626 1.00 0.00 H TER 67133 WAT 9363 ATOM 67133 O WAT 9364 25.350 132.414 91.880 1.00 0.00 O ATOM 67134 H1 WAT 9364 25.510 132.526 90.943 1.00 0.00 H ATOM 67135 H2 WAT 9364 24.536 131.912 91.926 1.00 0.00 H TER 67137 WAT 9364 ATOM 67137 O WAT 9365 114.347 75.872 80.639 1.00 0.00 O ATOM 67138 H1 WAT 9365 114.046 75.382 81.404 1.00 0.00 H ATOM 67139 H2 WAT 9365 115.034 76.446 80.978 1.00 0.00 H TER 67141 WAT 9365 ATOM 67141 O WAT 9366 92.477 133.873 135.764 1.00 0.00 O ATOM 67142 H1 WAT 9366 91.899 133.110 135.730 1.00 0.00 H ATOM 67143 H2 WAT 9366 92.240 134.387 134.991 1.00 0.00 H TER 67145 WAT 9366 ATOM 67145 O WAT 9367 138.809 16.824 66.692 1.00 0.00 O ATOM 67146 H1 WAT 9367 138.910 15.891 66.877 1.00 0.00 H ATOM 67147 H2 WAT 9367 139.671 17.101 66.381 1.00 0.00 H TER 67149 WAT 9367 ATOM 67149 O WAT 9368 84.254 24.368 84.267 1.00 0.00 O ATOM 67150 H1 WAT 9368 83.744 24.500 85.066 1.00 0.00 H ATOM 67151 H2 WAT 9368 83.669 24.647 83.561 1.00 0.00 H TER 67153 WAT 9368 ATOM 67153 O WAT 9369 19.353 69.913 108.811 1.00 0.00 O ATOM 67154 H1 WAT 9369 19.194 69.057 109.208 1.00 0.00 H ATOM 67155 H2 WAT 9369 20.278 69.894 108.563 1.00 0.00 H TER 67157 WAT 9369 ATOM 67157 O WAT 9370 44.023 63.005 12.633 1.00 0.00 O ATOM 67158 H1 WAT 9370 44.121 63.831 13.108 1.00 0.00 H ATOM 67159 H2 WAT 9370 43.539 62.440 13.234 1.00 0.00 H TER 67161 WAT 9370 ATOM 67161 O WAT 9371 33.733 66.832 86.203 1.00 0.00 O ATOM 67162 H1 WAT 9371 34.660 66.780 86.433 1.00 0.00 H ATOM 67163 H2 WAT 9371 33.567 67.768 86.085 1.00 0.00 H TER 67165 WAT 9371 ATOM 67165 O WAT 9372 1.556 56.270 158.031 1.00 0.00 O ATOM 67166 H1 WAT 9372 1.575 56.495 158.961 1.00 0.00 H ATOM 67167 H2 WAT 9372 2.465 56.358 157.744 1.00 0.00 H TER 67169 WAT 9372 ATOM 67169 O WAT 9373 108.566 71.844 158.086 1.00 0.00 O ATOM 67170 H1 WAT 9373 108.417 72.789 158.129 1.00 0.00 H ATOM 67171 H2 WAT 9373 108.943 71.701 157.218 1.00 0.00 H TER 67173 WAT 9373 ATOM 67173 O WAT 9374 55.566 63.259 12.653 1.00 0.00 O ATOM 67174 H1 WAT 9374 55.647 64.209 12.569 1.00 0.00 H ATOM 67175 H2 WAT 9374 56.304 62.911 12.154 1.00 0.00 H TER 67177 WAT 9374 ATOM 67177 O WAT 9375 32.693 20.108 105.194 1.00 0.00 O ATOM 67178 H1 WAT 9375 32.590 21.000 105.525 1.00 0.00 H ATOM 67179 H2 WAT 9375 32.465 20.169 104.266 1.00 0.00 H TER 67181 WAT 9375 ATOM 67181 O WAT 9376 103.710 82.231 117.770 1.00 0.00 O ATOM 67182 H1 WAT 9376 103.135 82.990 117.667 1.00 0.00 H ATOM 67183 H2 WAT 9376 103.128 81.476 117.679 1.00 0.00 H TER 67185 WAT 9376 ATOM 67185 O WAT 9377 108.959 86.517 2.462 1.00 0.00 O ATOM 67186 H1 WAT 9377 109.818 86.934 2.391 1.00 0.00 H ATOM 67187 H2 WAT 9377 108.732 86.282 1.562 1.00 0.00 H TER 67189 WAT 9377 ATOM 67189 O WAT 9378 109.661 5.870 117.084 1.00 0.00 O ATOM 67190 H1 WAT 9378 109.627 6.019 116.139 1.00 0.00 H ATOM 67191 H2 WAT 9378 110.120 6.635 117.431 1.00 0.00 H TER 67193 WAT 9378 ATOM 67193 O WAT 9379 55.404 76.288 120.794 1.00 0.00 O ATOM 67194 H1 WAT 9379 54.937 76.956 120.292 1.00 0.00 H ATOM 67195 H2 WAT 9379 55.784 76.765 121.532 1.00 0.00 H TER 67197 WAT 9379 ATOM 67197 O WAT 9380 71.343 54.275 127.129 1.00 0.00 O ATOM 67198 H1 WAT 9380 70.585 54.118 126.565 1.00 0.00 H ATOM 67199 H2 WAT 9380 71.784 55.027 126.733 1.00 0.00 H TER 67201 WAT 9380 ATOM 67201 O WAT 9381 51.142 96.575 108.825 1.00 0.00 O ATOM 67202 H1 WAT 9381 51.799 95.900 108.657 1.00 0.00 H ATOM 67203 H2 WAT 9381 50.766 96.762 107.964 1.00 0.00 H TER 67205 WAT 9381 ATOM 67205 O WAT 9382 46.287 126.829 69.871 1.00 0.00 O ATOM 67206 H1 WAT 9382 45.395 126.602 70.133 1.00 0.00 H ATOM 67207 H2 WAT 9382 46.820 126.639 70.644 1.00 0.00 H TER 67209 WAT 9382 ATOM 67209 O WAT 9383 75.498 78.952 129.524 1.00 0.00 O ATOM 67210 H1 WAT 9383 74.995 78.623 130.269 1.00 0.00 H ATOM 67211 H2 WAT 9383 75.093 79.794 129.316 1.00 0.00 H TER 67213 WAT 9383 ATOM 67213 O WAT 9384 116.859 30.134 62.059 1.00 0.00 O ATOM 67214 H1 WAT 9384 117.570 29.499 61.968 1.00 0.00 H ATOM 67215 H2 WAT 9384 116.088 29.682 61.717 1.00 0.00 H TER 67217 WAT 9384 ATOM 67217 O WAT 9385 43.040 26.987 92.034 1.00 0.00 O ATOM 67218 H1 WAT 9385 43.884 26.861 91.600 1.00 0.00 H ATOM 67219 H2 WAT 9385 42.534 27.522 91.423 1.00 0.00 H TER 67221 WAT 9385 ATOM 67221 O WAT 9386 62.104 11.635 64.849 1.00 0.00 O ATOM 67222 H1 WAT 9386 62.201 11.121 65.651 1.00 0.00 H ATOM 67223 H2 WAT 9386 61.374 12.227 65.031 1.00 0.00 H TER 67225 WAT 9386 ATOM 67225 O WAT 9387 126.475 42.638 116.966 1.00 0.00 O ATOM 67226 H1 WAT 9387 127.123 42.338 116.329 1.00 0.00 H ATOM 67227 H2 WAT 9387 126.629 43.579 117.041 1.00 0.00 H TER 67229 WAT 9387 ATOM 67229 O WAT 9388 136.390 97.856 126.427 1.00 0.00 O ATOM 67230 H1 WAT 9388 136.087 98.763 126.474 1.00 0.00 H ATOM 67231 H2 WAT 9388 135.591 97.344 126.296 1.00 0.00 H TER 67233 WAT 9388 ATOM 67233 O WAT 9389 77.279 61.465 10.255 1.00 0.00 O ATOM 67234 H1 WAT 9389 77.845 61.912 9.625 1.00 0.00 H ATOM 67235 H2 WAT 9389 76.514 62.035 10.336 1.00 0.00 H TER 67237 WAT 9389 ATOM 67237 O WAT 9390 45.685 95.085 2.247 1.00 0.00 O ATOM 67238 H1 WAT 9390 46.339 94.570 2.720 1.00 0.00 H ATOM 67239 H2 WAT 9390 44.952 94.483 2.120 1.00 0.00 H TER 67241 WAT 9390 ATOM 67241 O WAT 9391 99.639 86.697 86.491 1.00 0.00 O ATOM 67242 H1 WAT 9391 98.962 87.070 85.927 1.00 0.00 H ATOM 67243 H2 WAT 9391 100.349 86.465 85.893 1.00 0.00 H TER 67245 WAT 9391 ATOM 67245 O WAT 9392 93.915 31.238 70.158 1.00 0.00 O ATOM 67246 H1 WAT 9392 94.782 30.852 70.288 1.00 0.00 H ATOM 67247 H2 WAT 9392 93.314 30.494 70.191 1.00 0.00 H TER 67249 WAT 9392 ATOM 67249 O WAT 9393 122.237 52.755 73.838 1.00 0.00 O ATOM 67250 H1 WAT 9393 121.993 53.526 74.350 1.00 0.00 H ATOM 67251 H2 WAT 9393 121.825 52.023 74.296 1.00 0.00 H TER 67253 WAT 9393 ATOM 67253 O WAT 9394 24.840 141.924 61.428 1.00 0.00 O ATOM 67254 H1 WAT 9394 25.515 142.219 60.817 1.00 0.00 H ATOM 67255 H2 WAT 9394 25.096 141.029 61.654 1.00 0.00 H TER 67257 WAT 9394 ATOM 67257 O WAT 9395 128.508 34.963 76.771 1.00 0.00 O ATOM 67258 H1 WAT 9395 128.213 34.724 75.892 1.00 0.00 H ATOM 67259 H2 WAT 9395 127.869 34.556 77.357 1.00 0.00 H TER 67261 WAT 9395 ATOM 67261 O WAT 9396 40.806 134.004 123.322 1.00 0.00 O ATOM 67262 H1 WAT 9396 40.587 134.767 123.856 1.00 0.00 H ATOM 67263 H2 WAT 9396 41.097 133.346 123.953 1.00 0.00 H TER 67265 WAT 9396 ATOM 67265 O WAT 9397 142.753 17.079 149.327 1.00 0.00 O ATOM 67266 H1 WAT 9397 143.133 16.400 149.885 1.00 0.00 H ATOM 67267 H2 WAT 9397 143.320 17.839 149.454 1.00 0.00 H TER 67269 WAT 9397 ATOM 67269 O WAT 9398 81.907 133.416 75.055 1.00 0.00 O ATOM 67270 H1 WAT 9398 81.896 134.327 75.349 1.00 0.00 H ATOM 67271 H2 WAT 9398 82.312 133.449 74.189 1.00 0.00 H TER 67273 WAT 9398 ATOM 67273 O WAT 9399 67.048 105.871 127.115 1.00 0.00 O ATOM 67274 H1 WAT 9399 67.780 105.259 127.033 1.00 0.00 H ATOM 67275 H2 WAT 9399 66.911 105.955 128.059 1.00 0.00 H TER 67277 WAT 9399 ATOM 67277 O WAT 9400 104.551 106.041 31.426 1.00 0.00 O ATOM 67278 H1 WAT 9400 105.505 105.971 31.433 1.00 0.00 H ATOM 67279 H2 WAT 9400 104.309 105.931 30.506 1.00 0.00 H TER 67281 WAT 9400 ATOM 67281 O WAT 9401 47.639 59.204 119.240 1.00 0.00 O ATOM 67282 H1 WAT 9401 47.513 59.521 120.134 1.00 0.00 H ATOM 67283 H2 WAT 9401 46.981 58.517 119.133 1.00 0.00 H TER 67285 WAT 9401 ATOM 67285 O WAT 9402 52.050 16.137 72.510 1.00 0.00 O ATOM 67286 H1 WAT 9402 52.492 16.801 73.039 1.00 0.00 H ATOM 67287 H2 WAT 9402 51.576 15.601 73.146 1.00 0.00 H TER 67289 WAT 9402 ATOM 67289 O WAT 9403 138.922 4.970 68.530 1.00 0.00 O ATOM 67290 H1 WAT 9403 139.700 5.513 68.404 1.00 0.00 H ATOM 67291 H2 WAT 9403 138.207 5.598 68.634 1.00 0.00 H TER 67293 WAT 9403 ATOM 67293 O WAT 9404 16.610 19.138 6.295 1.00 0.00 O ATOM 67294 H1 WAT 9404 16.666 18.256 5.928 1.00 0.00 H ATOM 67295 H2 WAT 9404 16.379 19.001 7.214 1.00 0.00 H TER 67297 WAT 9404 ATOM 67297 O WAT 9405 109.317 51.437 0.453 1.00 0.00 O ATOM 67298 H1 WAT 9405 109.572 51.964 1.210 1.00 0.00 H ATOM 67299 H2 WAT 9405 109.604 51.949 -0.303 1.00 0.00 H TER 67301 WAT 9405 ATOM 67301 O WAT 9406 35.411 50.163 23.202 1.00 0.00 O ATOM 67302 H1 WAT 9406 35.326 50.280 24.148 1.00 0.00 H ATOM 67303 H2 WAT 9406 34.588 50.496 22.845 1.00 0.00 H TER 67305 WAT 9406 ATOM 67305 O WAT 9407 137.901 118.533 11.371 1.00 0.00 O ATOM 67306 H1 WAT 9407 137.334 119.001 10.758 1.00 0.00 H ATOM 67307 H2 WAT 9407 138.222 119.211 11.965 1.00 0.00 H TER 67309 WAT 9407 ATOM 67309 O WAT 9408 138.356 6.298 1.590 1.00 0.00 O ATOM 67310 H1 WAT 9408 139.206 6.175 2.012 1.00 0.00 H ATOM 67311 H2 WAT 9408 137.881 6.887 2.175 1.00 0.00 H TER 67313 WAT 9408 ATOM 67313 O WAT 9409 61.079 4.698 22.200 1.00 0.00 O ATOM 67314 H1 WAT 9409 61.220 3.755 22.284 1.00 0.00 H ATOM 67315 H2 WAT 9409 60.310 4.875 22.743 1.00 0.00 H TER 67317 WAT 9409 ATOM 67317 O WAT 9410 127.643 34.781 91.268 1.00 0.00 O ATOM 67318 H1 WAT 9410 127.040 35.227 90.674 1.00 0.00 H ATOM 67319 H2 WAT 9410 127.936 34.012 90.780 1.00 0.00 H TER 67321 WAT 9410 ATOM 67321 O WAT 9411 77.036 44.249 86.487 1.00 0.00 O ATOM 67322 H1 WAT 9411 76.512 44.802 85.906 1.00 0.00 H ATOM 67323 H2 WAT 9411 77.843 44.087 85.999 1.00 0.00 H TER 67325 WAT 9411 ATOM 67325 O WAT 9412 99.322 70.256 5.068 1.00 0.00 O ATOM 67326 H1 WAT 9412 99.331 70.224 4.112 1.00 0.00 H ATOM 67327 H2 WAT 9412 100.072 70.805 5.297 1.00 0.00 H TER 67329 WAT 9412 ATOM 67329 O WAT 9413 62.000 96.311 129.017 1.00 0.00 O ATOM 67330 H1 WAT 9413 62.198 97.212 128.764 1.00 0.00 H ATOM 67331 H2 WAT 9413 62.855 95.914 129.183 1.00 0.00 H TER 67333 WAT 9413 ATOM 67333 O WAT 9414 134.517 63.493 144.810 1.00 0.00 O ATOM 67334 H1 WAT 9414 135.365 63.936 144.769 1.00 0.00 H ATOM 67335 H2 WAT 9414 133.918 64.081 144.349 1.00 0.00 H TER 67337 WAT 9414 ATOM 67337 O WAT 9415 54.569 86.315 107.319 1.00 0.00 O ATOM 67338 H1 WAT 9415 55.114 86.964 106.875 1.00 0.00 H ATOM 67339 H2 WAT 9415 53.962 86.010 106.645 1.00 0.00 H TER 67341 WAT 9415 ATOM 67341 O WAT 9416 104.312 88.708 87.227 1.00 0.00 O ATOM 67342 H1 WAT 9416 104.681 89.297 86.569 1.00 0.00 H ATOM 67343 H2 WAT 9416 104.061 89.284 87.950 1.00 0.00 H TER 67345 WAT 9416 ATOM 67345 O WAT 9417 76.353 103.023 139.998 1.00 0.00 O ATOM 67346 H1 WAT 9417 75.785 102.347 139.627 1.00 0.00 H ATOM 67347 H2 WAT 9417 76.363 103.716 139.338 1.00 0.00 H TER 67349 WAT 9417 ATOM 67349 O WAT 9418 140.455 130.900 135.273 1.00 0.00 O ATOM 67350 H1 WAT 9418 140.350 130.300 136.012 1.00 0.00 H ATOM 67351 H2 WAT 9418 139.582 131.270 135.140 1.00 0.00 H TER 67353 WAT 9418 ATOM 67353 O WAT 9419 24.236 120.147 110.328 1.00 0.00 O ATOM 67354 H1 WAT 9419 25.063 120.038 110.797 1.00 0.00 H ATOM 67355 H2 WAT 9419 23.563 120.015 110.995 1.00 0.00 H TER 67357 WAT 9419 ATOM 67357 O WAT 9420 56.918 73.025 17.233 1.00 0.00 O ATOM 67358 H1 WAT 9420 56.103 73.014 17.735 1.00 0.00 H ATOM 67359 H2 WAT 9420 56.712 73.540 16.453 1.00 0.00 H TER 67361 WAT 9420 ATOM 67361 O WAT 9421 23.313 81.587 7.910 1.00 0.00 O ATOM 67362 H1 WAT 9421 23.286 81.081 7.098 1.00 0.00 H ATOM 67363 H2 WAT 9421 22.467 82.033 7.941 1.00 0.00 H TER 67365 WAT 9421 ATOM 67365 O WAT 9422 91.869 35.924 115.282 1.00 0.00 O ATOM 67366 H1 WAT 9422 92.793 35.787 115.076 1.00 0.00 H ATOM 67367 H2 WAT 9422 91.795 35.710 116.212 1.00 0.00 H TER 67369 WAT 9422 ATOM 67369 O WAT 9423 119.759 141.957 74.462 1.00 0.00 O ATOM 67370 H1 WAT 9423 119.827 142.382 73.608 1.00 0.00 H ATOM 67371 H2 WAT 9423 119.736 142.680 75.089 1.00 0.00 H TER 67373 WAT 9423 ATOM 67373 O WAT 9424 19.042 90.692 81.830 1.00 0.00 O ATOM 67374 H1 WAT 9424 19.917 90.358 82.026 1.00 0.00 H ATOM 67375 H2 WAT 9424 19.197 91.524 81.383 1.00 0.00 H TER 67377 WAT 9424 ATOM 67377 O WAT 9425 127.359 16.507 129.978 1.00 0.00 O ATOM 67378 H1 WAT 9425 126.962 17.091 130.625 1.00 0.00 H ATOM 67379 H2 WAT 9425 127.509 17.064 129.214 1.00 0.00 H TER 67381 WAT 9425 ATOM 67381 O WAT 9426 18.452 109.383 138.405 1.00 0.00 O ATOM 67382 H1 WAT 9426 17.586 109.744 138.598 1.00 0.00 H ATOM 67383 H2 WAT 9426 18.273 108.527 138.016 1.00 0.00 H TER 67385 WAT 9426 ATOM 67385 O WAT 9427 131.137 22.138 1.597 1.00 0.00 O ATOM 67386 H1 WAT 9427 131.586 22.043 2.437 1.00 0.00 H ATOM 67387 H2 WAT 9427 130.450 22.782 1.764 1.00 0.00 H TER 67389 WAT 9427 ATOM 67389 O WAT 9428 60.358 138.745 0.711 1.00 0.00 O ATOM 67390 H1 WAT 9428 59.668 138.164 0.393 1.00 0.00 H ATOM 67391 H2 WAT 9428 59.902 139.553 0.945 1.00 0.00 H TER 67393 WAT 9428 ATOM 67393 O WAT 9429 98.083 123.718 80.952 1.00 0.00 O ATOM 67394 H1 WAT 9429 97.286 123.244 81.191 1.00 0.00 H ATOM 67395 H2 WAT 9429 98.134 124.436 81.583 1.00 0.00 H TER 67397 WAT 9429 ATOM 67397 O WAT 9430 38.867 79.412 114.885 1.00 0.00 O ATOM 67398 H1 WAT 9430 38.866 79.338 115.839 1.00 0.00 H ATOM 67399 H2 WAT 9430 39.406 78.679 114.589 1.00 0.00 H TER 67401 WAT 9430 ATOM 67401 O WAT 9431 53.758 98.862 89.493 1.00 0.00 O ATOM 67402 H1 WAT 9431 53.598 99.003 88.560 1.00 0.00 H ATOM 67403 H2 WAT 9431 53.756 97.911 89.595 1.00 0.00 H TER 67405 WAT 9431 ATOM 67405 O WAT 9432 85.993 52.418 22.799 1.00 0.00 O ATOM 67406 H1 WAT 9432 86.142 52.997 23.546 1.00 0.00 H ATOM 67407 H2 WAT 9432 85.747 53.007 22.085 1.00 0.00 H TER 67409 WAT 9432 ATOM 67409 O WAT 9433 34.338 134.678 138.732 1.00 0.00 O ATOM 67410 H1 WAT 9433 34.473 133.736 138.627 1.00 0.00 H ATOM 67411 H2 WAT 9433 34.593 135.052 137.889 1.00 0.00 H TER 67413 WAT 9433 ATOM 67413 O WAT 9434 57.364 33.555 156.991 1.00 0.00 O ATOM 67414 H1 WAT 9434 56.803 33.999 156.355 1.00 0.00 H ATOM 67415 H2 WAT 9434 57.814 34.265 157.450 1.00 0.00 H TER 67417 WAT 9434 ATOM 67417 O WAT 9435 132.263 71.225 112.020 1.00 0.00 O ATOM 67418 H1 WAT 9435 131.667 71.973 112.054 1.00 0.00 H ATOM 67419 H2 WAT 9435 132.539 71.180 111.104 1.00 0.00 H TER 67421 WAT 9435 ATOM 67421 O WAT 9436 77.189 120.648 69.650 1.00 0.00 O ATOM 67422 H1 WAT 9436 77.303 120.371 70.559 1.00 0.00 H ATOM 67423 H2 WAT 9436 76.241 120.720 69.539 1.00 0.00 H TER 67425 WAT 9436 ATOM 67425 O WAT 9437 22.775 65.004 68.604 1.00 0.00 O ATOM 67426 H1 WAT 9437 23.726 65.012 68.704 1.00 0.00 H ATOM 67427 H2 WAT 9437 22.536 65.927 68.513 1.00 0.00 H TER 67429 WAT 9437 ATOM 67429 O WAT 9438 58.897 92.357 99.385 1.00 0.00 O ATOM 67430 H1 WAT 9438 58.894 93.219 99.800 1.00 0.00 H ATOM 67431 H2 WAT 9438 58.591 91.761 100.068 1.00 0.00 H TER 67433 WAT 9438 ATOM 67433 O WAT 9439 69.386 21.677 109.868 1.00 0.00 O ATOM 67434 H1 WAT 9439 68.759 22.158 110.407 1.00 0.00 H ATOM 67435 H2 WAT 9439 69.217 21.979 108.975 1.00 0.00 H TER 67437 WAT 9439 ATOM 67437 O WAT 9440 10.584 48.971 14.475 1.00 0.00 O ATOM 67438 H1 WAT 9440 9.748 49.012 14.011 1.00 0.00 H ATOM 67439 H2 WAT 9440 10.374 48.554 15.311 1.00 0.00 H TER 67441 WAT 9440 ATOM 67441 O WAT 9441 26.407 38.090 137.412 1.00 0.00 O ATOM 67442 H1 WAT 9441 26.106 38.794 137.986 1.00 0.00 H ATOM 67443 H2 WAT 9441 26.260 37.290 137.916 1.00 0.00 H TER 67445 WAT 9441 ATOM 67445 O WAT 9442 72.821 1.894 78.558 1.00 0.00 O ATOM 67446 H1 WAT 9442 71.960 1.911 78.975 1.00 0.00 H ATOM 67447 H2 WAT 9442 73.418 2.227 79.228 1.00 0.00 H TER 67449 WAT 9442 ATOM 67449 O WAT 9443 132.860 144.488 74.773 1.00 0.00 O ATOM 67450 H1 WAT 9443 132.733 144.987 75.580 1.00 0.00 H ATOM 67451 H2 WAT 9443 133.756 144.691 74.504 1.00 0.00 H TER 67453 WAT 9443 ATOM 67453 O WAT 9444 34.364 67.270 106.322 1.00 0.00 O ATOM 67454 H1 WAT 9444 33.968 67.419 105.464 1.00 0.00 H ATOM 67455 H2 WAT 9444 33.654 67.426 106.944 1.00 0.00 H TER 67457 WAT 9444 ATOM 67457 O WAT 9445 142.020 55.908 98.251 1.00 0.00 O ATOM 67458 H1 WAT 9445 141.162 55.699 98.618 1.00 0.00 H ATOM 67459 H2 WAT 9445 141.826 56.311 97.404 1.00 0.00 H TER 67461 WAT 9445 ATOM 67461 O WAT 9446 0.708 99.908 70.700 1.00 0.00 O ATOM 67462 H1 WAT 9446 0.261 99.454 69.986 1.00 0.00 H ATOM 67463 H2 WAT 9446 1.287 100.531 70.263 1.00 0.00 H TER 67465 WAT 9446 ATOM 67465 O WAT 9447 128.077 37.123 97.755 1.00 0.00 O ATOM 67466 H1 WAT 9447 127.895 37.825 98.379 1.00 0.00 H ATOM 67467 H2 WAT 9447 127.568 36.378 98.076 1.00 0.00 H TER 67469 WAT 9447 ATOM 67469 O WAT 9448 53.209 62.851 114.509 1.00 0.00 O ATOM 67470 H1 WAT 9448 53.988 63.407 114.551 1.00 0.00 H ATOM 67471 H2 WAT 9448 52.491 63.425 114.773 1.00 0.00 H TER 67473 WAT 9448 ATOM 67473 O WAT 9449 89.722 92.096 22.245 1.00 0.00 O ATOM 67474 H1 WAT 9449 89.607 93.025 22.445 1.00 0.00 H ATOM 67475 H2 WAT 9449 90.544 91.859 22.675 1.00 0.00 H TER 67477 WAT 9449 ATOM 67477 O WAT 9450 17.195 18.150 72.529 1.00 0.00 O ATOM 67478 H1 WAT 9450 16.433 18.275 73.095 1.00 0.00 H ATOM 67479 H2 WAT 9450 16.857 18.276 71.642 1.00 0.00 H TER 67481 WAT 9450 ATOM 67481 O WAT 9451 143.372 4.530 103.874 1.00 0.00 O ATOM 67482 H1 WAT 9451 142.616 3.991 103.641 1.00 0.00 H ATOM 67483 H2 WAT 9451 143.128 5.415 103.603 1.00 0.00 H TER 67485 WAT 9451 ATOM 67485 O WAT 9452 107.260 112.588 95.079 1.00 0.00 O ATOM 67486 H1 WAT 9452 107.643 113.398 95.416 1.00 0.00 H ATOM 67487 H2 WAT 9452 107.996 112.123 94.681 1.00 0.00 H TER 67489 WAT 9452 ATOM 67489 O WAT 9453 133.194 66.654 94.044 1.00 0.00 O ATOM 67490 H1 WAT 9453 132.902 67.388 94.585 1.00 0.00 H ATOM 67491 H2 WAT 9453 132.635 65.923 94.309 1.00 0.00 H TER 67493 WAT 9453 ATOM 67493 O WAT 9454 110.098 92.948 74.104 1.00 0.00 O ATOM 67494 H1 WAT 9454 109.537 92.962 74.879 1.00 0.00 H ATOM 67495 H2 WAT 9454 110.140 93.862 73.823 1.00 0.00 H TER 67497 WAT 9454 ATOM 67497 O WAT 9455 129.323 127.868 149.181 1.00 0.00 O ATOM 67498 H1 WAT 9455 129.564 128.256 150.022 1.00 0.00 H ATOM 67499 H2 WAT 9455 128.900 127.041 149.411 1.00 0.00 H TER 67501 WAT 9455 ATOM 67501 O WAT 9456 124.304 140.295 75.582 1.00 0.00 O ATOM 67502 H1 WAT 9456 123.997 140.988 76.167 1.00 0.00 H ATOM 67503 H2 WAT 9456 123.773 139.533 75.815 1.00 0.00 H TER 67505 WAT 9456 ATOM 67505 O WAT 9457 51.107 108.315 147.135 1.00 0.00 O ATOM 67506 H1 WAT 9457 51.697 108.969 146.760 1.00 0.00 H ATOM 67507 H2 WAT 9457 50.343 108.817 147.420 1.00 0.00 H TER 67509 WAT 9457 ATOM 67509 O WAT 9458 96.166 13.717 12.279 1.00 0.00 O ATOM 67510 H1 WAT 9458 96.531 13.524 13.142 1.00 0.00 H ATOM 67511 H2 WAT 9458 95.592 14.469 12.424 1.00 0.00 H TER 67513 WAT 9458 ATOM 67513 O WAT 9459 28.720 2.166 120.043 1.00 0.00 O ATOM 67514 H1 WAT 9459 28.493 2.933 119.518 1.00 0.00 H ATOM 67515 H2 WAT 9459 28.256 2.296 120.870 1.00 0.00 H TER 67517 WAT 9459 ATOM 67517 O WAT 9460 86.620 95.322 106.381 1.00 0.00 O ATOM 67518 H1 WAT 9460 86.404 95.296 107.314 1.00 0.00 H ATOM 67519 H2 WAT 9460 85.888 94.877 105.954 1.00 0.00 H TER 67521 WAT 9460 ATOM 67521 O WAT 9461 21.982 142.312 142.048 1.00 0.00 O ATOM 67522 H1 WAT 9461 22.308 142.208 141.155 1.00 0.00 H ATOM 67523 H2 WAT 9461 21.053 142.517 141.942 1.00 0.00 H TER 67525 WAT 9461 ATOM 67525 O WAT 9462 70.910 1.789 4.457 1.00 0.00 O ATOM 67526 H1 WAT 9462 70.572 2.038 3.596 1.00 0.00 H ATOM 67527 H2 WAT 9462 71.846 1.647 4.314 1.00 0.00 H TER 67529 WAT 9462 ATOM 67529 O WAT 9463 125.124 122.548 118.150 1.00 0.00 O ATOM 67530 H1 WAT 9463 125.390 123.135 118.858 1.00 0.00 H ATOM 67531 H2 WAT 9463 125.792 121.862 118.144 1.00 0.00 H TER 67533 WAT 9463 ATOM 67533 O WAT 9464 64.654 45.081 134.729 1.00 0.00 O ATOM 67534 H1 WAT 9464 64.904 45.989 134.895 1.00 0.00 H ATOM 67535 H2 WAT 9464 65.470 44.651 134.472 1.00 0.00 H TER 67537 WAT 9464 ATOM 67537 O WAT 9465 143.033 58.489 104.553 1.00 0.00 O ATOM 67538 H1 WAT 9465 142.423 58.160 103.892 1.00 0.00 H ATOM 67539 H2 WAT 9465 142.817 57.995 105.344 1.00 0.00 H TER 67541 WAT 9465 ATOM 67541 O WAT 9466 77.232 134.644 128.957 1.00 0.00 O ATOM 67542 H1 WAT 9466 77.569 133.958 128.382 1.00 0.00 H ATOM 67543 H2 WAT 9466 77.360 134.301 129.841 1.00 0.00 H TER 67545 WAT 9466 ATOM 67545 O WAT 9467 105.515 84.550 76.420 1.00 0.00 O ATOM 67546 H1 WAT 9467 106.017 83.899 76.911 1.00 0.00 H ATOM 67547 H2 WAT 9467 105.619 85.360 76.921 1.00 0.00 H TER 67549 WAT 9467 ATOM 67549 O WAT 9468 58.049 5.157 128.528 1.00 0.00 O ATOM 67550 H1 WAT 9468 57.215 4.690 128.572 1.00 0.00 H ATOM 67551 H2 WAT 9468 58.709 4.485 128.701 1.00 0.00 H TER 67553 WAT 9468 ATOM 67553 O WAT 9469 86.546 112.578 108.591 1.00 0.00 O ATOM 67554 H1 WAT 9469 86.596 112.601 107.636 1.00 0.00 H ATOM 67555 H2 WAT 9469 86.149 111.730 108.790 1.00 0.00 H TER 67557 WAT 9469 ATOM 67557 O WAT 9470 131.289 132.108 90.607 1.00 0.00 O ATOM 67558 H1 WAT 9470 130.459 132.371 90.208 1.00 0.00 H ATOM 67559 H2 WAT 9470 131.299 132.553 91.454 1.00 0.00 H TER 67561 WAT 9470 ATOM 67561 O WAT 9471 103.754 1.247 127.870 1.00 0.00 O ATOM 67562 H1 WAT 9471 104.216 2.082 127.793 1.00 0.00 H ATOM 67563 H2 WAT 9471 104.053 0.884 128.704 1.00 0.00 H TER 67565 WAT 9471 ATOM 67565 O WAT 9472 34.221 46.460 108.268 1.00 0.00 O ATOM 67566 H1 WAT 9472 34.576 47.285 108.597 1.00 0.00 H ATOM 67567 H2 WAT 9472 33.814 46.690 107.433 1.00 0.00 H TER 67569 WAT 9472 ATOM 67569 O WAT 9473 25.754 114.464 62.667 1.00 0.00 O ATOM 67570 H1 WAT 9473 26.015 113.642 63.084 1.00 0.00 H ATOM 67571 H2 WAT 9473 26.214 115.141 63.164 1.00 0.00 H TER 67573 WAT 9473 ATOM 67573 O WAT 9474 119.235 85.981 141.757 1.00 0.00 O ATOM 67574 H1 WAT 9474 119.926 85.319 141.736 1.00 0.00 H ATOM 67575 H2 WAT 9474 119.530 86.655 141.144 1.00 0.00 H TER 67577 WAT 9474 ATOM 67577 O WAT 9475 129.515 120.052 5.094 1.00 0.00 O ATOM 67578 H1 WAT 9475 128.568 120.128 4.978 1.00 0.00 H ATOM 67579 H2 WAT 9475 129.831 119.705 4.260 1.00 0.00 H TER 67581 WAT 9475 ATOM 67581 O WAT 9476 19.371 137.558 122.726 1.00 0.00 O ATOM 67582 H1 WAT 9476 19.156 136.628 122.789 1.00 0.00 H ATOM 67583 H2 WAT 9476 20.186 137.582 122.225 1.00 0.00 H TER 67585 WAT 9476 ATOM 67585 O WAT 9477 33.078 138.017 129.662 1.00 0.00 O ATOM 67586 H1 WAT 9477 32.229 138.430 129.817 1.00 0.00 H ATOM 67587 H2 WAT 9477 33.373 137.742 130.530 1.00 0.00 H TER 67589 WAT 9477 ATOM 67589 O WAT 9478 3.301 84.643 82.859 1.00 0.00 O ATOM 67590 H1 WAT 9478 3.885 84.570 82.105 1.00 0.00 H ATOM 67591 H2 WAT 9478 2.507 85.046 82.509 1.00 0.00 H TER 67593 WAT 9478 ATOM 67593 O WAT 9479 26.106 90.896 122.865 1.00 0.00 O ATOM 67594 H1 WAT 9479 25.320 91.418 123.026 1.00 0.00 H ATOM 67595 H2 WAT 9479 26.005 90.581 121.967 1.00 0.00 H TER 67597 WAT 9479 ATOM 67597 O WAT 9480 124.670 101.243 158.707 1.00 0.00 O ATOM 67598 H1 WAT 9480 125.336 100.593 158.481 1.00 0.00 H ATOM 67599 H2 WAT 9480 124.969 102.049 158.286 1.00 0.00 H TER 67601 WAT 9480 ATOM 67601 O WAT 9481 13.549 81.962 150.496 1.00 0.00 O ATOM 67602 H1 WAT 9481 14.254 81.759 151.112 1.00 0.00 H ATOM 67603 H2 WAT 9481 13.973 81.964 149.638 1.00 0.00 H TER 67605 WAT 9481 ATOM 67605 O WAT 9482 32.419 128.300 155.258 1.00 0.00 O ATOM 67606 H1 WAT 9482 33.336 128.100 155.072 1.00 0.00 H ATOM 67607 H2 WAT 9482 32.392 129.255 155.327 1.00 0.00 H TER 67609 WAT 9482 ATOM 67609 O WAT 9483 105.736 132.485 122.563 1.00 0.00 O ATOM 67610 H1 WAT 9483 106.482 132.817 122.064 1.00 0.00 H ATOM 67611 H2 WAT 9483 105.137 132.142 121.899 1.00 0.00 H TER 67613 WAT 9483 ATOM 67613 O WAT 9484 46.032 35.702 79.674 1.00 0.00 O ATOM 67614 H1 WAT 9484 46.273 36.197 78.891 1.00 0.00 H ATOM 67615 H2 WAT 9484 45.658 36.355 80.265 1.00 0.00 H TER 67617 WAT 9484 ATOM 67617 O WAT 9485 48.094 127.123 12.109 1.00 0.00 O ATOM 67618 H1 WAT 9485 48.085 126.474 12.813 1.00 0.00 H ATOM 67619 H2 WAT 9485 49.008 127.158 11.827 1.00 0.00 H TER 67621 WAT 9485 ATOM 67621 O WAT 9486 43.433 28.816 98.939 1.00 0.00 O ATOM 67622 H1 WAT 9486 43.571 29.666 98.522 1.00 0.00 H ATOM 67623 H2 WAT 9486 42.831 28.357 98.354 1.00 0.00 H TER 67625 WAT 9486 ATOM 67625 O WAT 9487 105.951 124.639 1.124 1.00 0.00 O ATOM 67626 H1 WAT 9487 106.460 123.938 0.715 1.00 0.00 H ATOM 67627 H2 WAT 9487 106.608 125.255 1.447 1.00 0.00 H TER 67629 WAT 9487 ATOM 67629 O WAT 9488 92.053 40.838 155.130 1.00 0.00 O ATOM 67630 H1 WAT 9488 91.157 40.513 155.037 1.00 0.00 H ATOM 67631 H2 WAT 9488 92.096 41.593 154.543 1.00 0.00 H TER 67633 WAT 9488 ATOM 67633 O WAT 9489 46.177 28.529 78.573 1.00 0.00 O ATOM 67634 H1 WAT 9489 45.342 28.972 78.721 1.00 0.00 H ATOM 67635 H2 WAT 9489 46.614 28.553 79.425 1.00 0.00 H TER 67637 WAT 9489 ATOM 67637 O WAT 9490 96.100 106.633 72.211 1.00 0.00 O ATOM 67638 H1 WAT 9490 95.923 106.091 71.442 1.00 0.00 H ATOM 67639 H2 WAT 9490 97.028 106.492 72.396 1.00 0.00 H TER 67641 WAT 9490 ATOM 67641 O WAT 9491 128.177 3.825 127.857 1.00 0.00 O ATOM 67642 H1 WAT 9491 128.454 3.176 127.210 1.00 0.00 H ATOM 67643 H2 WAT 9491 128.909 3.880 128.470 1.00 0.00 H TER 67645 WAT 9491 ATOM 67645 O WAT 9492 134.571 35.299 142.173 1.00 0.00 O ATOM 67646 H1 WAT 9492 133.674 35.458 141.880 1.00 0.00 H ATOM 67647 H2 WAT 9492 134.537 35.418 143.123 1.00 0.00 H TER 67649 WAT 9492 ATOM 67649 O WAT 9493 15.266 15.244 131.734 1.00 0.00 O ATOM 67650 H1 WAT 9493 15.144 14.395 131.309 1.00 0.00 H ATOM 67651 H2 WAT 9493 16.168 15.225 132.053 1.00 0.00 H TER 67653 WAT 9493 ATOM 67653 O WAT 9494 133.320 129.850 121.227 1.00 0.00 O ATOM 67654 H1 WAT 9494 133.494 129.604 120.318 1.00 0.00 H ATOM 67655 H2 WAT 9494 132.366 129.822 121.304 1.00 0.00 H TER 67657 WAT 9494 ATOM 67657 O WAT 9495 36.818 64.395 110.973 1.00 0.00 O ATOM 67658 H1 WAT 9495 36.174 64.735 110.353 1.00 0.00 H ATOM 67659 H2 WAT 9495 36.433 63.580 111.296 1.00 0.00 H TER 67661 WAT 9495 ATOM 67661 O WAT 9496 84.506 13.060 87.179 1.00 0.00 O ATOM 67662 H1 WAT 9496 85.005 13.850 86.972 1.00 0.00 H ATOM 67663 H2 WAT 9496 83.779 13.370 87.719 1.00 0.00 H TER 67665 WAT 9496 ATOM 67665 O WAT 9497 22.019 143.178 121.353 1.00 0.00 O ATOM 67666 H1 WAT 9497 22.877 143.393 120.986 1.00 0.00 H ATOM 67667 H2 WAT 9497 21.640 142.560 120.728 1.00 0.00 H TER 67669 WAT 9497 ATOM 67669 O WAT 9498 4.359 35.405 71.270 1.00 0.00 O ATOM 67670 H1 WAT 9498 3.714 34.708 71.150 1.00 0.00 H ATOM 67671 H2 WAT 9498 5.155 34.949 71.543 1.00 0.00 H TER 67673 WAT 9498 ATOM 67673 O WAT 9499 86.185 89.343 140.317 1.00 0.00 O ATOM 67674 H1 WAT 9499 86.833 89.425 139.616 1.00 0.00 H ATOM 67675 H2 WAT 9499 86.094 88.400 140.450 1.00 0.00 H TER 67677 WAT 9499 ATOM 67677 O WAT 9500 53.676 102.221 17.088 1.00 0.00 O ATOM 67678 H1 WAT 9500 53.999 102.251 16.187 1.00 0.00 H ATOM 67679 H2 WAT 9500 54.462 102.095 17.620 1.00 0.00 H TER 67681 WAT 9500 ATOM 67681 O WAT 9501 128.361 132.921 76.759 1.00 0.00 O ATOM 67682 H1 WAT 9501 128.035 133.691 76.293 1.00 0.00 H ATOM 67683 H2 WAT 9501 128.243 133.133 77.684 1.00 0.00 H TER 67685 WAT 9501 ATOM 67685 O WAT 9502 144.471 66.131 20.778 1.00 0.00 O ATOM 67686 H1 WAT 9502 144.452 65.177 20.847 1.00 0.00 H ATOM 67687 H2 WAT 9502 144.991 66.415 21.530 1.00 0.00 H TER 67689 WAT 9502 ATOM 67689 O WAT 9503 36.727 5.159 114.169 1.00 0.00 O ATOM 67690 H1 WAT 9503 36.931 6.051 113.886 1.00 0.00 H ATOM 67691 H2 WAT 9503 37.581 4.764 114.348 1.00 0.00 H TER 67693 WAT 9503 ATOM 67693 O WAT 9504 105.298 135.147 110.125 1.00 0.00 O ATOM 67694 H1 WAT 9504 104.448 135.416 110.474 1.00 0.00 H ATOM 67695 H2 WAT 9504 105.935 135.657 110.627 1.00 0.00 H TER 67697 WAT 9504 ATOM 67697 O WAT 9505 2.887 70.013 119.008 1.00 0.00 O ATOM 67698 H1 WAT 9505 1.988 69.717 118.868 1.00 0.00 H ATOM 67699 H2 WAT 9505 2.797 70.910 119.330 1.00 0.00 H TER 67701 WAT 9505 ATOM 67701 O WAT 9506 125.955 92.317 149.357 1.00 0.00 O ATOM 67702 H1 WAT 9506 125.366 91.592 149.566 1.00 0.00 H ATOM 67703 H2 WAT 9506 126.375 92.056 148.537 1.00 0.00 H TER 67705 WAT 9506 ATOM 67705 O WAT 9507 77.369 136.834 137.209 1.00 0.00 O ATOM 67706 H1 WAT 9507 78.101 137.209 137.699 1.00 0.00 H ATOM 67707 H2 WAT 9507 77.630 136.914 136.291 1.00 0.00 H TER 67709 WAT 9507 ATOM 67709 O WAT 9508 106.804 111.242 1.702 1.00 0.00 O ATOM 67710 H1 WAT 9508 107.165 110.361 1.808 1.00 0.00 H ATOM 67711 H2 WAT 9508 106.831 111.400 0.759 1.00 0.00 H TER 67713 WAT 9508 ATOM 67713 O WAT 9509 121.754 126.472 19.053 1.00 0.00 O ATOM 67714 H1 WAT 9509 122.219 127.235 18.711 1.00 0.00 H ATOM 67715 H2 WAT 9509 122.193 125.723 18.651 1.00 0.00 H TER 67717 WAT 9509 ATOM 67717 O WAT 9510 93.438 2.553 67.115 1.00 0.00 O ATOM 67718 H1 WAT 9510 93.601 3.060 67.911 1.00 0.00 H ATOM 67719 H2 WAT 9510 94.108 1.870 67.125 1.00 0.00 H TER 67721 WAT 9510 ATOM 67721 O WAT 9511 81.131 76.940 111.187 1.00 0.00 O ATOM 67722 H1 WAT 9511 81.895 77.512 111.116 1.00 0.00 H ATOM 67723 H2 WAT 9511 81.226 76.321 110.462 1.00 0.00 H TER 67725 WAT 9511 ATOM 67725 O WAT 9512 107.030 38.498 109.948 1.00 0.00 O ATOM 67726 H1 WAT 9512 106.680 37.962 110.660 1.00 0.00 H ATOM 67727 H2 WAT 9512 106.486 38.275 109.192 1.00 0.00 H TER 67729 WAT 9512 ATOM 67729 O WAT 9513 44.546 140.167 7.033 1.00 0.00 O ATOM 67730 H1 WAT 9513 43.986 140.899 7.294 1.00 0.00 H ATOM 67731 H2 WAT 9513 45.327 140.582 6.666 1.00 0.00 H TER 67733 WAT 9513 ATOM 67733 O WAT 9514 48.493 46.187 11.366 1.00 0.00 O ATOM 67734 H1 WAT 9514 48.272 46.759 12.100 1.00 0.00 H ATOM 67735 H2 WAT 9514 49.223 46.627 10.930 1.00 0.00 H TER 67737 WAT 9514 ATOM 67737 O WAT 9515 61.277 89.901 148.557 1.00 0.00 O ATOM 67738 H1 WAT 9515 62.066 89.934 149.099 1.00 0.00 H ATOM 67739 H2 WAT 9515 60.675 90.518 148.973 1.00 0.00 H TER 67741 WAT 9515 ATOM 67741 O WAT 9516 4.265 117.131 75.504 1.00 0.00 O ATOM 67742 H1 WAT 9516 3.513 117.714 75.398 1.00 0.00 H ATOM 67743 H2 WAT 9516 4.995 117.610 75.112 1.00 0.00 H TER 67745 WAT 9516 ATOM 67745 O WAT 9517 101.546 23.047 111.744 1.00 0.00 O ATOM 67746 H1 WAT 9517 102.106 22.333 111.439 1.00 0.00 H ATOM 67747 H2 WAT 9517 101.217 23.452 110.942 1.00 0.00 H TER 67749 WAT 9517 ATOM 67749 O WAT 9518 60.142 113.132 106.391 1.00 0.00 O ATOM 67750 H1 WAT 9518 59.239 112.817 106.336 1.00 0.00 H ATOM 67751 H2 WAT 9518 60.478 113.054 105.498 1.00 0.00 H TER 67753 WAT 9518 ATOM 67753 O WAT 9519 63.521 64.681 92.938 1.00 0.00 O ATOM 67754 H1 WAT 9519 62.733 64.857 93.452 1.00 0.00 H ATOM 67755 H2 WAT 9519 63.443 65.253 92.175 1.00 0.00 H TER 67757 WAT 9519 ATOM 67757 O WAT 9520 72.874 79.055 83.118 1.00 0.00 O ATOM 67758 H1 WAT 9520 72.851 79.731 83.795 1.00 0.00 H ATOM 67759 H2 WAT 9520 73.262 79.490 82.358 1.00 0.00 H TER 67761 WAT 9520 ATOM 67761 O WAT 9521 0.579 136.428 95.771 1.00 0.00 O ATOM 67762 H1 WAT 9521 1.388 136.902 95.578 1.00 0.00 H ATOM 67763 H2 WAT 9521 0.862 135.530 95.944 1.00 0.00 H TER 67765 WAT 9521 ATOM 67765 O WAT 9522 145.532 59.924 102.602 1.00 0.00 O ATOM 67766 H1 WAT 9522 145.461 59.133 103.137 1.00 0.00 H ATOM 67767 H2 WAT 9522 146.412 59.881 102.227 1.00 0.00 H TER 67769 WAT 9522 ATOM 67769 O WAT 9523 25.722 84.682 64.747 1.00 0.00 O ATOM 67770 H1 WAT 9523 25.815 85.527 64.306 1.00 0.00 H ATOM 67771 H2 WAT 9523 25.235 84.141 64.126 1.00 0.00 H TER 67773 WAT 9523 ATOM 67773 O WAT 9524 144.219 55.245 100.171 1.00 0.00 O ATOM 67774 H1 WAT 9524 143.319 55.163 99.856 1.00 0.00 H ATOM 67775 H2 WAT 9524 144.645 54.433 99.895 1.00 0.00 H TER 67777 WAT 9524 ATOM 67777 O WAT 9525 140.750 106.921 0.963 1.00 0.00 O ATOM 67778 H1 WAT 9525 140.497 107.662 1.514 1.00 0.00 H ATOM 67779 H2 WAT 9525 140.632 107.236 0.067 1.00 0.00 H TER 67781 WAT 9525 ATOM 67781 O WAT 9526 134.416 94.152 96.674 1.00 0.00 O ATOM 67782 H1 WAT 9526 135.138 93.783 96.165 1.00 0.00 H ATOM 67783 H2 WAT 9526 134.502 95.099 96.561 1.00 0.00 H TER 67785 WAT 9526 ATOM 67785 O WAT 9527 110.351 64.098 105.885 1.00 0.00 O ATOM 67786 H1 WAT 9527 109.913 63.296 105.599 1.00 0.00 H ATOM 67787 H2 WAT 9527 111.263 63.839 106.016 1.00 0.00 H TER 67789 WAT 9527 ATOM 67789 O WAT 9528 113.581 13.977 114.939 1.00 0.00 O ATOM 67790 H1 WAT 9528 113.783 14.580 114.224 1.00 0.00 H ATOM 67791 H2 WAT 9528 112.722 14.258 115.255 1.00 0.00 H TER 67793 WAT 9528 ATOM 67793 O WAT 9529 0.511 115.003 71.476 1.00 0.00 O ATOM 67794 H1 WAT 9529 0.030 115.575 72.074 1.00 0.00 H ATOM 67795 H2 WAT 9529 0.087 115.134 70.627 1.00 0.00 H TER 67797 WAT 9529 ATOM 67797 O WAT 9530 91.952 104.116 117.661 1.00 0.00 O ATOM 67798 H1 WAT 9530 91.181 104.167 117.096 1.00 0.00 H ATOM 67799 H2 WAT 9530 91.895 103.251 118.067 1.00 0.00 H TER 67801 WAT 9530 ATOM 67801 O WAT 9531 105.405 112.506 58.518 1.00 0.00 O ATOM 67802 H1 WAT 9531 105.307 113.008 57.709 1.00 0.00 H ATOM 67803 H2 WAT 9531 106.070 111.848 58.312 1.00 0.00 H TER 67805 WAT 9531 ATOM 67805 O WAT 9532 131.670 78.318 78.411 1.00 0.00 O ATOM 67806 H1 WAT 9532 132.068 78.080 77.574 1.00 0.00 H ATOM 67807 H2 WAT 9532 131.750 77.528 78.947 1.00 0.00 H TER 67809 WAT 9532 ATOM 67809 O WAT 9533 130.609 100.289 130.957 1.00 0.00 O ATOM 67810 H1 WAT 9533 129.807 100.426 130.454 1.00 0.00 H ATOM 67811 H2 WAT 9533 131.029 99.537 130.538 1.00 0.00 H TER 67813 WAT 9533 ATOM 67813 O WAT 9534 95.549 102.714 81.676 1.00 0.00 O ATOM 67814 H1 WAT 9534 96.081 102.746 80.881 1.00 0.00 H ATOM 67815 H2 WAT 9534 96.169 102.488 82.370 1.00 0.00 H TER 67817 WAT 9534 ATOM 67817 O WAT 9535 95.209 113.578 79.717 1.00 0.00 O ATOM 67818 H1 WAT 9535 96.159 113.632 79.821 1.00 0.00 H ATOM 67819 H2 WAT 9535 94.861 113.784 80.585 1.00 0.00 H TER 67821 WAT 9535 ATOM 67821 O WAT 9536 134.640 63.902 23.920 1.00 0.00 O ATOM 67822 H1 WAT 9536 134.378 64.712 24.357 1.00 0.00 H ATOM 67823 H2 WAT 9536 135.532 64.072 23.616 1.00 0.00 H TER 67825 WAT 9536 ATOM 67825 O WAT 9537 72.233 110.682 99.358 1.00 0.00 O ATOM 67826 H1 WAT 9537 72.485 111.362 99.983 1.00 0.00 H ATOM 67827 H2 WAT 9537 72.596 109.875 99.724 1.00 0.00 H TER 67829 WAT 9537 ATOM 67829 O WAT 9538 37.198 85.457 120.999 1.00 0.00 O ATOM 67830 H1 WAT 9538 37.862 84.966 121.483 1.00 0.00 H ATOM 67831 H2 WAT 9538 37.366 86.372 121.224 1.00 0.00 H TER 67833 WAT 9538 ATOM 67833 O WAT 9539 122.324 137.954 107.089 1.00 0.00 O ATOM 67834 H1 WAT 9539 121.579 138.555 107.082 1.00 0.00 H ATOM 67835 H2 WAT 9539 122.154 137.370 107.829 1.00 0.00 H TER 67837 WAT 9539 ATOM 67837 O WAT 9540 5.306 74.271 133.774 1.00 0.00 O ATOM 67838 H1 WAT 9540 4.900 74.057 134.614 1.00 0.00 H ATOM 67839 H2 WAT 9540 5.346 73.436 133.308 1.00 0.00 H TER 67841 WAT 9540 ATOM 67841 O WAT 9541 88.203 58.446 132.112 1.00 0.00 O ATOM 67842 H1 WAT 9541 87.391 58.015 132.377 1.00 0.00 H ATOM 67843 H2 WAT 9541 88.770 57.731 131.821 1.00 0.00 H TER 67845 WAT 9541 ATOM 67845 O WAT 9542 75.895 37.359 22.269 1.00 0.00 O ATOM 67846 H1 WAT 9542 75.202 36.698 22.265 1.00 0.00 H ATOM 67847 H2 WAT 9542 76.666 36.900 21.937 1.00 0.00 H TER 67849 WAT 9542 ATOM 67849 O WAT 9543 15.298 21.029 4.808 1.00 0.00 O ATOM 67850 H1 WAT 9543 15.564 20.352 5.430 1.00 0.00 H ATOM 67851 H2 WAT 9543 15.646 20.733 3.968 1.00 0.00 H TER 67853 WAT 9543 ATOM 67853 O WAT 9544 96.581 122.149 64.236 1.00 0.00 O ATOM 67854 H1 WAT 9544 96.819 121.393 63.698 1.00 0.00 H ATOM 67855 H2 WAT 9544 96.345 122.828 63.604 1.00 0.00 H TER 67857 WAT 9544 ATOM 67857 O WAT 9545 16.609 46.263 144.116 1.00 0.00 O ATOM 67858 H1 WAT 9545 16.734 46.635 143.243 1.00 0.00 H ATOM 67859 H2 WAT 9545 16.267 45.383 143.955 1.00 0.00 H TER 67861 WAT 9545 ATOM 67861 O WAT 9546 94.679 119.341 136.649 1.00 0.00 O ATOM 67862 H1 WAT 9546 93.925 118.975 136.186 1.00 0.00 H ATOM 67863 H2 WAT 9546 95.412 119.223 136.044 1.00 0.00 H TER 67865 WAT 9546 ATOM 67865 O WAT 9547 73.215 125.110 157.393 1.00 0.00 O ATOM 67866 H1 WAT 9547 72.628 124.859 158.106 1.00 0.00 H ATOM 67867 H2 WAT 9547 74.039 124.666 157.593 1.00 0.00 H TER 67869 WAT 9547 ATOM 67869 O WAT 9548 49.036 122.579 51.758 1.00 0.00 O ATOM 67870 H1 WAT 9548 48.555 121.855 51.355 1.00 0.00 H ATOM 67871 H2 WAT 9548 48.356 123.198 52.025 1.00 0.00 H TER 67873 WAT 9548 ATOM 67873 O WAT 9549 120.210 24.433 89.760 1.00 0.00 O ATOM 67874 H1 WAT 9549 120.058 25.355 89.552 1.00 0.00 H ATOM 67875 H2 WAT 9549 120.872 24.151 89.128 1.00 0.00 H TER 67877 WAT 9549 ATOM 67877 O WAT 9550 64.096 95.877 13.511 1.00 0.00 O ATOM 67878 H1 WAT 9550 63.169 96.052 13.670 1.00 0.00 H ATOM 67879 H2 WAT 9550 64.556 96.423 14.150 1.00 0.00 H TER 67881 WAT 9550 ATOM 67881 O WAT 9551 28.650 28.112 21.492 1.00 0.00 O ATOM 67882 H1 WAT 9551 28.913 28.416 20.623 1.00 0.00 H ATOM 67883 H2 WAT 9551 28.452 28.914 21.976 1.00 0.00 H TER 67885 WAT 9551 ATOM 67885 O WAT 9552 17.166 78.283 57.112 1.00 0.00 O ATOM 67886 H1 WAT 9552 16.286 77.934 56.971 1.00 0.00 H ATOM 67887 H2 WAT 9552 17.679 77.940 56.380 1.00 0.00 H TER 67889 WAT 9552 ATOM 67889 O WAT 9553 72.002 33.270 144.336 1.00 0.00 O ATOM 67890 H1 WAT 9553 71.768 32.653 143.642 1.00 0.00 H ATOM 67891 H2 WAT 9553 71.175 33.688 144.574 1.00 0.00 H TER 67893 WAT 9553 ATOM 67893 O WAT 9554 128.762 122.734 92.373 1.00 0.00 O ATOM 67894 H1 WAT 9554 128.856 123.340 93.108 1.00 0.00 H ATOM 67895 H2 WAT 9554 129.661 122.554 92.095 1.00 0.00 H TER 67897 WAT 9554 ATOM 67897 O WAT 9555 56.583 108.368 8.229 1.00 0.00 O ATOM 67898 H1 WAT 9555 56.146 109.191 8.446 1.00 0.00 H ATOM 67899 H2 WAT 9555 56.038 107.693 8.633 1.00 0.00 H TER 67901 WAT 9555 ATOM 67901 O WAT 9556 112.320 118.099 106.670 1.00 0.00 O ATOM 67902 H1 WAT 9556 111.472 118.035 106.231 1.00 0.00 H ATOM 67903 H2 WAT 9556 112.958 118.121 105.957 1.00 0.00 H TER 67905 WAT 9556 ATOM 67905 O WAT 9557 74.362 114.884 120.479 1.00 0.00 O ATOM 67906 H1 WAT 9557 73.620 114.939 119.876 1.00 0.00 H ATOM 67907 H2 WAT 9557 73.963 114.896 121.349 1.00 0.00 H TER 67909 WAT 9557 ATOM 67909 O WAT 9558 134.180 44.663 110.902 1.00 0.00 O ATOM 67910 H1 WAT 9558 135.063 45.032 110.925 1.00 0.00 H ATOM 67911 H2 WAT 9558 134.255 43.898 110.333 1.00 0.00 H TER 67913 WAT 9558 ATOM 67913 O WAT 9559 18.126 0.143 121.277 1.00 0.00 O ATOM 67914 H1 WAT 9559 18.999 0.040 120.897 1.00 0.00 H ATOM 67915 H2 WAT 9559 17.772 0.926 120.855 1.00 0.00 H TER 67917 WAT 9559 ATOM 67917 O WAT 9560 77.607 68.472 83.892 1.00 0.00 O ATOM 67918 H1 WAT 9560 77.550 69.409 84.078 1.00 0.00 H ATOM 67919 H2 WAT 9560 77.384 68.049 84.721 1.00 0.00 H TER 67921 WAT 9560 ATOM 67921 O WAT 9561 45.132 17.509 15.394 1.00 0.00 O ATOM 67922 H1 WAT 9561 45.393 18.407 15.189 1.00 0.00 H ATOM 67923 H2 WAT 9561 44.647 17.582 16.216 1.00 0.00 H TER 67925 WAT 9561 ATOM 67925 O WAT 9562 30.951 94.346 154.109 1.00 0.00 O ATOM 67926 H1 WAT 9562 31.302 93.494 153.848 1.00 0.00 H ATOM 67927 H2 WAT 9562 31.679 94.777 154.557 1.00 0.00 H TER 67929 WAT 9562 ATOM 67929 O WAT 9563 11.221 6.506 87.110 1.00 0.00 O ATOM 67930 H1 WAT 9563 11.612 6.651 86.248 1.00 0.00 H ATOM 67931 H2 WAT 9563 11.965 6.498 87.712 1.00 0.00 H TER 67933 WAT 9563 ATOM 67933 O WAT 9564 67.026 136.357 114.921 1.00 0.00 O ATOM 67934 H1 WAT 9564 67.329 135.750 115.597 1.00 0.00 H ATOM 67935 H2 WAT 9564 66.233 136.747 115.289 1.00 0.00 H TER 67937 WAT 9564 ATOM 67937 O WAT 9565 113.472 31.037 2.486 1.00 0.00 O ATOM 67938 H1 WAT 9565 113.856 30.187 2.274 1.00 0.00 H ATOM 67939 H2 WAT 9565 112.675 31.079 1.956 1.00 0.00 H TER 67941 WAT 9565 ATOM 67941 O WAT 9566 47.696 91.812 19.495 1.00 0.00 O ATOM 67942 H1 WAT 9566 46.794 92.109 19.383 1.00 0.00 H ATOM 67943 H2 WAT 9566 48.044 91.761 18.605 1.00 0.00 H TER 67945 WAT 9566 ATOM 67945 O WAT 9567 45.520 61.100 118.172 1.00 0.00 O ATOM 67946 H1 WAT 9567 46.106 60.388 118.427 1.00 0.00 H ATOM 67947 H2 WAT 9567 45.926 61.477 117.391 1.00 0.00 H TER 67949 WAT 9567 ATOM 67949 O WAT 9568 129.997 139.504 123.537 1.00 0.00 O ATOM 67950 H1 WAT 9568 129.836 140.055 122.772 1.00 0.00 H ATOM 67951 H2 WAT 9568 130.950 139.498 123.631 1.00 0.00 H TER 67953 WAT 9568 ATOM 67953 O WAT 9569 51.437 96.621 116.822 1.00 0.00 O ATOM 67954 H1 WAT 9569 51.855 97.481 116.868 1.00 0.00 H ATOM 67955 H2 WAT 9569 52.142 96.002 117.014 1.00 0.00 H TER 67957 WAT 9569 ATOM 67957 O WAT 9570 43.526 77.643 151.930 1.00 0.00 O ATOM 67958 H1 WAT 9570 43.593 77.511 150.984 1.00 0.00 H ATOM 67959 H2 WAT 9570 43.480 78.593 152.037 1.00 0.00 H TER 67961 WAT 9570 ATOM 67961 O WAT 9571 5.865 56.031 158.673 1.00 0.00 O ATOM 67962 H1 WAT 9571 6.050 55.327 158.051 1.00 0.00 H ATOM 67963 H2 WAT 9571 6.697 56.178 159.123 1.00 0.00 H TER 67965 WAT 9571 ATOM 67965 O WAT 9572 98.397 129.127 109.753 1.00 0.00 O ATOM 67966 H1 WAT 9572 98.543 129.205 110.695 1.00 0.00 H ATOM 67967 H2 WAT 9572 99.049 129.707 109.360 1.00 0.00 H TER 67969 WAT 9572 ATOM 67969 O WAT 9573 102.799 78.243 61.047 1.00 0.00 O ATOM 67970 H1 WAT 9573 102.355 77.724 60.376 1.00 0.00 H ATOM 67971 H2 WAT 9573 102.114 78.806 61.407 1.00 0.00 H TER 67973 WAT 9573 ATOM 67973 O WAT 9574 129.860 81.068 81.969 1.00 0.00 O ATOM 67974 H1 WAT 9574 130.741 81.343 82.220 1.00 0.00 H ATOM 67975 H2 WAT 9574 129.280 81.574 82.537 1.00 0.00 H TER 67977 WAT 9574 ATOM 67977 O WAT 9575 138.192 19.476 149.874 1.00 0.00 O ATOM 67978 H1 WAT 9575 138.689 18.768 150.284 1.00 0.00 H ATOM 67979 H2 WAT 9575 137.985 20.072 150.594 1.00 0.00 H TER 67981 WAT 9575 ATOM 67981 O WAT 9576 59.382 142.260 116.027 1.00 0.00 O ATOM 67982 H1 WAT 9576 59.093 141.362 116.189 1.00 0.00 H ATOM 67983 H2 WAT 9576 59.229 142.713 116.857 1.00 0.00 H TER 67985 WAT 9576 ATOM 67985 O WAT 9577 8.363 63.934 66.543 1.00 0.00 O ATOM 67986 H1 WAT 9577 7.979 64.759 66.244 1.00 0.00 H ATOM 67987 H2 WAT 9577 9.290 64.135 66.671 1.00 0.00 H TER 67989 WAT 9577 ATOM 67989 O WAT 9578 11.002 106.460 146.755 1.00 0.00 O ATOM 67990 H1 WAT 9578 11.764 107.008 146.942 1.00 0.00 H ATOM 67991 H2 WAT 9578 11.114 105.692 147.315 1.00 0.00 H TER 67993 WAT 9578 ATOM 67993 O WAT 9579 23.444 110.634 106.944 1.00 0.00 O ATOM 67994 H1 WAT 9579 23.717 110.469 106.042 1.00 0.00 H ATOM 67995 H2 WAT 9579 23.078 109.800 107.239 1.00 0.00 H TER 67997 WAT 9579 ATOM 67997 O WAT 9580 0.768 11.994 101.692 1.00 0.00 O ATOM 67998 H1 WAT 9580 1.474 12.501 102.092 1.00 0.00 H ATOM 67999 H2 WAT 9580 1.206 11.237 101.304 1.00 0.00 H TER 68001 WAT 9580 ATOM 68001 O WAT 9581 43.204 121.523 107.400 1.00 0.00 O ATOM 68002 H1 WAT 9581 42.833 121.983 106.647 1.00 0.00 H ATOM 68003 H2 WAT 9581 42.764 120.673 107.404 1.00 0.00 H TER 68005 WAT 9581 ATOM 68005 O WAT 9582 58.189 125.154 141.037 1.00 0.00 O ATOM 68006 H1 WAT 9582 58.919 124.606 140.750 1.00 0.00 H ATOM 68007 H2 WAT 9582 57.480 124.534 141.214 1.00 0.00 H TER 68009 WAT 9582 ATOM 68009 O WAT 9583 55.621 137.002 58.260 1.00 0.00 O ATOM 68010 H1 WAT 9583 54.768 137.137 58.673 1.00 0.00 H ATOM 68011 H2 WAT 9583 55.627 137.608 57.519 1.00 0.00 H TER 68013 WAT 9583 ATOM 68013 O WAT 9584 37.218 39.352 11.771 1.00 0.00 O ATOM 68014 H1 WAT 9584 37.316 38.430 11.537 1.00 0.00 H ATOM 68015 H2 WAT 9584 38.064 39.745 11.558 1.00 0.00 H TER 68017 WAT 9584 ATOM 68017 O WAT 9585 97.952 10.428 107.910 1.00 0.00 O ATOM 68018 H1 WAT 9585 98.370 9.846 108.545 1.00 0.00 H ATOM 68019 H2 WAT 9585 97.765 9.865 107.158 1.00 0.00 H TER 68021 WAT 9585 ATOM 68021 O WAT 9586 29.154 111.255 16.098 1.00 0.00 O ATOM 68022 H1 WAT 9586 29.111 111.285 17.054 1.00 0.00 H ATOM 68023 H2 WAT 9586 29.263 112.169 15.835 1.00 0.00 H TER 68025 WAT 9586 ATOM 68025 O WAT 9587 26.869 137.432 18.437 1.00 0.00 O ATOM 68026 H1 WAT 9587 27.136 136.785 19.089 1.00 0.00 H ATOM 68027 H2 WAT 9587 26.433 136.921 17.755 1.00 0.00 H TER 68029 WAT 9587 ATOM 68029 O WAT 9588 26.367 98.758 128.684 1.00 0.00 O ATOM 68030 H1 WAT 9588 26.220 97.995 129.243 1.00 0.00 H ATOM 68031 H2 WAT 9588 25.693 98.693 128.007 1.00 0.00 H TER 68033 WAT 9588 ATOM 68033 O WAT 9589 96.334 18.672 125.168 1.00 0.00 O ATOM 68034 H1 WAT 9589 96.391 17.751 125.423 1.00 0.00 H ATOM 68035 H2 WAT 9589 95.501 18.970 125.533 1.00 0.00 H TER 68037 WAT 9589 ATOM 68037 O WAT 9590 128.646 108.556 73.541 1.00 0.00 O ATOM 68038 H1 WAT 9590 128.453 108.173 74.396 1.00 0.00 H ATOM 68039 H2 WAT 9590 129.276 109.252 73.727 1.00 0.00 H TER 68041 WAT 9590 ATOM 68041 O WAT 9591 121.466 135.006 158.510 1.00 0.00 O ATOM 68042 H1 WAT 9591 122.024 135.395 159.184 1.00 0.00 H ATOM 68043 H2 WAT 9591 121.397 135.681 157.836 1.00 0.00 H TER 68045 WAT 9591 ATOM 68045 O WAT 9592 65.549 76.505 5.595 1.00 0.00 O ATOM 68046 H1 WAT 9592 66.057 77.299 5.763 1.00 0.00 H ATOM 68047 H2 WAT 9592 65.556 76.035 6.428 1.00 0.00 H TER 68049 WAT 9592 ATOM 68049 O WAT 9593 37.035 74.357 90.828 1.00 0.00 O ATOM 68050 H1 WAT 9593 37.976 74.523 90.768 1.00 0.00 H ATOM 68051 H2 WAT 9593 36.944 73.423 90.639 1.00 0.00 H TER 68053 WAT 9593 ATOM 68053 O WAT 9594 37.377 18.463 125.347 1.00 0.00 O ATOM 68054 H1 WAT 9594 38.306 18.251 125.259 1.00 0.00 H ATOM 68055 H2 WAT 9594 37.118 18.770 124.479 1.00 0.00 H TER 68057 WAT 9594 ATOM 68057 O WAT 9595 140.556 9.025 158.101 1.00 0.00 O ATOM 68058 H1 WAT 9595 139.922 9.666 158.424 1.00 0.00 H ATOM 68059 H2 WAT 9595 140.035 8.413 157.582 1.00 0.00 H TER 68061 WAT 9595 ATOM 68061 O WAT 9596 110.465 21.131 77.439 1.00 0.00 O ATOM 68062 H1 WAT 9596 110.218 21.652 76.675 1.00 0.00 H ATOM 68063 H2 WAT 9596 111.176 21.626 77.846 1.00 0.00 H TER 68065 WAT 9596 ATOM 68065 O WAT 9597 83.256 0.973 115.815 1.00 0.00 O ATOM 68066 H1 WAT 9597 83.685 1.300 115.024 1.00 0.00 H ATOM 68067 H2 WAT 9597 82.712 1.702 116.111 1.00 0.00 H TER 68069 WAT 9597 ATOM 68069 O WAT 9598 86.064 30.768 124.353 1.00 0.00 O ATOM 68070 H1 WAT 9598 86.189 31.645 123.991 1.00 0.00 H ATOM 68071 H2 WAT 9598 86.504 30.795 125.202 1.00 0.00 H TER 68073 WAT 9598 ATOM 68073 O WAT 9599 4.922 89.467 137.453 1.00 0.00 O ATOM 68074 H1 WAT 9599 5.753 89.893 137.244 1.00 0.00 H ATOM 68075 H2 WAT 9599 4.977 89.280 138.390 1.00 0.00 H TER 68077 WAT 9599 ATOM 68077 O WAT 9600 45.066 13.975 144.863 1.00 0.00 O ATOM 68078 H1 WAT 9600 45.730 13.310 145.046 1.00 0.00 H ATOM 68079 H2 WAT 9600 44.286 13.476 144.621 1.00 0.00 H TER 68081 WAT 9600 ATOM 68081 O WAT 9601 99.787 12.554 5.626 1.00 0.00 O ATOM 68082 H1 WAT 9601 100.596 13.024 5.831 1.00 0.00 H ATOM 68083 H2 WAT 9601 99.292 12.562 6.445 1.00 0.00 H TER 68085 WAT 9601 ATOM 68085 O WAT 9602 75.818 73.970 4.990 1.00 0.00 O ATOM 68086 H1 WAT 9602 75.344 73.160 5.183 1.00 0.00 H ATOM 68087 H2 WAT 9602 75.336 74.648 5.463 1.00 0.00 H TER 68089 WAT 9602 ATOM 68089 O WAT 9603 9.881 38.736 68.493 1.00 0.00 O ATOM 68090 H1 WAT 9603 9.627 37.873 68.819 1.00 0.00 H ATOM 68091 H2 WAT 9603 10.137 39.222 69.277 1.00 0.00 H TER 68093 WAT 9603 ATOM 68093 O WAT 9604 60.947 32.841 122.693 1.00 0.00 O ATOM 68094 H1 WAT 9604 60.031 32.748 122.955 1.00 0.00 H ATOM 68095 H2 WAT 9604 60.909 33.229 121.819 1.00 0.00 H TER 68097 WAT 9604 ATOM 68097 O WAT 9605 107.521 26.588 115.264 1.00 0.00 O ATOM 68098 H1 WAT 9605 106.564 26.559 115.255 1.00 0.00 H ATOM 68099 H2 WAT 9605 107.754 26.510 116.189 1.00 0.00 H TER 68101 WAT 9605 ATOM 68101 O WAT 9606 141.796 134.953 105.805 1.00 0.00 O ATOM 68102 H1 WAT 9606 142.500 134.351 106.043 1.00 0.00 H ATOM 68103 H2 WAT 9606 141.282 134.475 105.153 1.00 0.00 H TER 68105 WAT 9606 ATOM 68105 O WAT 9607 85.773 101.251 96.123 1.00 0.00 O ATOM 68106 H1 WAT 9607 84.820 101.253 96.212 1.00 0.00 H ATOM 68107 H2 WAT 9607 85.928 100.980 95.218 1.00 0.00 H TER 68109 WAT 9607 ATOM 68109 O WAT 9608 69.451 135.500 1.218 1.00 0.00 O ATOM 68110 H1 WAT 9608 69.572 135.634 2.158 1.00 0.00 H ATOM 68111 H2 WAT 9608 69.421 134.549 1.114 1.00 0.00 H TER 68113 WAT 9608 ATOM 68113 O WAT 9609 116.375 124.316 103.895 1.00 0.00 O ATOM 68114 H1 WAT 9609 116.876 124.459 103.092 1.00 0.00 H ATOM 68115 H2 WAT 9609 115.541 123.955 103.596 1.00 0.00 H TER 68117 WAT 9609 ATOM 68117 O WAT 9610 19.556 38.098 156.107 1.00 0.00 O ATOM 68118 H1 WAT 9610 20.442 38.249 155.778 1.00 0.00 H ATOM 68119 H2 WAT 9610 19.173 37.477 155.488 1.00 0.00 H TER 68121 WAT 9610 ATOM 68121 O WAT 9611 69.450 122.078 116.692 1.00 0.00 O ATOM 68122 H1 WAT 9611 69.408 121.426 115.992 1.00 0.00 H ATOM 68123 H2 WAT 9611 68.536 122.296 116.872 1.00 0.00 H TER 68125 WAT 9611 ATOM 68125 O WAT 9612 123.074 21.389 1.042 1.00 0.00 O ATOM 68126 H1 WAT 9612 122.148 21.203 1.198 1.00 0.00 H ATOM 68127 H2 WAT 9612 123.394 21.729 1.877 1.00 0.00 H TER 68129 WAT 9612 ATOM 68129 O WAT 9613 77.482 26.796 112.383 1.00 0.00 O ATOM 68130 H1 WAT 9613 78.059 27.437 112.798 1.00 0.00 H ATOM 68131 H2 WAT 9613 77.584 26.005 112.912 1.00 0.00 H TER 68133 WAT 9613 ATOM 68133 O WAT 9614 63.970 42.178 67.290 1.00 0.00 O ATOM 68134 H1 WAT 9614 64.040 43.121 67.443 1.00 0.00 H ATOM 68135 H2 WAT 9614 63.258 41.895 67.864 1.00 0.00 H TER 68137 WAT 9614 ATOM 68137 O WAT 9615 107.374 127.346 12.177 1.00 0.00 O ATOM 68138 H1 WAT 9615 107.138 128.213 11.848 1.00 0.00 H ATOM 68139 H2 WAT 9615 107.353 127.437 13.130 1.00 0.00 H TER 68141 WAT 9615 ATOM 68141 O WAT 9616 101.037 124.542 86.396 1.00 0.00 O ATOM 68142 H1 WAT 9616 101.905 124.396 86.772 1.00 0.00 H ATOM 68143 H2 WAT 9616 100.979 125.491 86.287 1.00 0.00 H TER 68145 WAT 9616 ATOM 68145 O WAT 9617 77.547 46.776 148.692 1.00 0.00 O ATOM 68146 H1 WAT 9617 78.151 46.036 148.748 1.00 0.00 H ATOM 68147 H2 WAT 9617 77.066 46.755 149.519 1.00 0.00 H TER 68149 WAT 9617 ATOM 68149 O WAT 9618 70.963 88.069 155.172 1.00 0.00 O ATOM 68150 H1 WAT 9618 71.813 87.841 155.548 1.00 0.00 H ATOM 68151 H2 WAT 9618 70.959 89.026 155.150 1.00 0.00 H TER 68153 WAT 9618 ATOM 68153 O WAT 9619 68.911 58.440 158.478 1.00 0.00 O ATOM 68154 H1 WAT 9619 68.103 58.085 158.109 1.00 0.00 H ATOM 68155 H2 WAT 9619 69.273 58.987 157.781 1.00 0.00 H TER 68157 WAT 9619 ATOM 68157 O WAT 9620 3.519 61.299 89.055 1.00 0.00 O ATOM 68158 H1 WAT 9620 2.764 61.828 88.800 1.00 0.00 H ATOM 68159 H2 WAT 9620 4.259 61.703 88.603 1.00 0.00 H TER 68161 WAT 9620 ATOM 68161 O WAT 9621 88.290 130.883 90.879 1.00 0.00 O ATOM 68162 H1 WAT 9621 88.659 130.413 91.627 1.00 0.00 H ATOM 68163 H2 WAT 9621 88.147 130.207 90.217 1.00 0.00 H TER 68165 WAT 9621 ATOM 68165 O WAT 9622 51.455 4.378 80.319 1.00 0.00 O ATOM 68166 H1 WAT 9622 50.915 5.163 80.413 1.00 0.00 H ATOM 68167 H2 WAT 9622 51.069 3.748 80.927 1.00 0.00 H TER 68169 WAT 9622 ATOM 68169 O WAT 9623 92.723 112.923 21.370 1.00 0.00 O ATOM 68170 H1 WAT 9623 93.493 112.396 21.582 1.00 0.00 H ATOM 68171 H2 WAT 9623 92.186 112.893 22.162 1.00 0.00 H TER 68173 WAT 9623 ATOM 68173 O WAT 9624 58.853 11.562 131.500 1.00 0.00 O ATOM 68174 H1 WAT 9624 59.601 11.537 132.097 1.00 0.00 H ATOM 68175 H2 WAT 9624 59.156 12.085 130.758 1.00 0.00 H TER 68177 WAT 9624 ATOM 68177 O WAT 9625 24.560 41.096 147.814 1.00 0.00 O ATOM 68178 H1 WAT 9625 23.818 40.591 148.148 1.00 0.00 H ATOM 68179 H2 WAT 9625 24.204 41.971 147.660 1.00 0.00 H TER 68181 WAT 9625 ATOM 68181 O WAT 9626 35.220 109.952 86.550 1.00 0.00 O ATOM 68182 H1 WAT 9626 35.663 109.408 85.899 1.00 0.00 H ATOM 68183 H2 WAT 9626 34.294 109.724 86.463 1.00 0.00 H TER 68185 WAT 9626 ATOM 68185 O WAT 9627 17.622 125.128 65.339 1.00 0.00 O ATOM 68186 H1 WAT 9627 17.918 125.910 64.874 1.00 0.00 H ATOM 68187 H2 WAT 9627 16.910 124.783 64.799 1.00 0.00 H TER 68189 WAT 9627 ATOM 68189 O WAT 9628 115.248 108.013 128.259 1.00 0.00 O ATOM 68190 H1 WAT 9628 115.017 108.934 128.132 1.00 0.00 H ATOM 68191 H2 WAT 9628 114.489 107.530 127.931 1.00 0.00 H TER 68193 WAT 9628 ATOM 68193 O WAT 9629 131.985 79.719 134.981 1.00 0.00 O ATOM 68194 H1 WAT 9629 132.604 80.427 135.155 1.00 0.00 H ATOM 68195 H2 WAT 9629 131.315 79.815 135.659 1.00 0.00 H TER 68197 WAT 9629 ATOM 68197 O WAT 9630 34.073 26.274 129.544 1.00 0.00 O ATOM 68198 H1 WAT 9630 33.286 26.811 129.447 1.00 0.00 H ATOM 68199 H2 WAT 9630 34.797 26.889 129.432 1.00 0.00 H TER 68201 WAT 9630 ATOM 68201 O WAT 9631 58.031 22.259 19.262 1.00 0.00 O ATOM 68202 H1 WAT 9631 58.906 21.947 19.490 1.00 0.00 H ATOM 68203 H2 WAT 9631 57.518 22.143 20.062 1.00 0.00 H TER 68205 WAT 9631 ATOM 68205 O WAT 9632 123.975 88.458 0.451 1.00 0.00 O ATOM 68206 H1 WAT 9632 124.312 88.681 -0.417 1.00 0.00 H ATOM 68207 H2 WAT 9632 124.749 88.192 0.948 1.00 0.00 H TER 68209 WAT 9632 ATOM 68209 O WAT 9633 86.363 57.995 158.017 1.00 0.00 O ATOM 68210 H1 WAT 9633 85.433 58.085 158.225 1.00 0.00 H ATOM 68211 H2 WAT 9633 86.757 57.661 158.823 1.00 0.00 H TER 68213 WAT 9633 ATOM 68213 O WAT 9634 71.644 25.406 132.385 1.00 0.00 O ATOM 68214 H1 WAT 9634 71.989 25.084 133.218 1.00 0.00 H ATOM 68215 H2 WAT 9634 72.408 25.757 131.928 1.00 0.00 H TER 68217 WAT 9634 ATOM 68217 O WAT 9635 7.040 68.728 81.949 1.00 0.00 O ATOM 68218 H1 WAT 9635 7.478 68.949 82.771 1.00 0.00 H ATOM 68219 H2 WAT 9635 6.946 69.565 81.495 1.00 0.00 H TER 68221 WAT 9635 ATOM 68221 O WAT 9636 88.421 110.530 120.879 1.00 0.00 O ATOM 68222 H1 WAT 9636 87.942 110.911 121.615 1.00 0.00 H ATOM 68223 H2 WAT 9636 87.937 109.731 120.667 1.00 0.00 H TER 68225 WAT 9636 ATOM 68225 O WAT 9637 14.427 34.087 136.768 1.00 0.00 O ATOM 68226 H1 WAT 9637 13.851 34.276 137.508 1.00 0.00 H ATOM 68227 H2 WAT 9637 15.264 34.485 137.008 1.00 0.00 H TER 68229 WAT 9637 ATOM 68229 O WAT 9638 39.284 41.713 138.071 1.00 0.00 O ATOM 68230 H1 WAT 9638 38.442 41.660 138.522 1.00 0.00 H ATOM 68231 H2 WAT 9638 39.077 42.099 137.220 1.00 0.00 H TER 68233 WAT 9638 ATOM 68233 O WAT 9639 57.445 5.793 146.106 1.00 0.00 O ATOM 68234 H1 WAT 9639 58.038 6.487 146.395 1.00 0.00 H ATOM 68235 H2 WAT 9639 58.011 5.163 145.662 1.00 0.00 H TER 68237 WAT 9639 ATOM 68237 O WAT 9640 126.813 81.773 110.219 1.00 0.00 O ATOM 68238 H1 WAT 9640 127.220 80.942 109.975 1.00 0.00 H ATOM 68239 H2 WAT 9640 127.095 82.386 109.540 1.00 0.00 H TER 68241 WAT 9640 ATOM 68241 O WAT 9641 86.843 114.924 129.835 1.00 0.00 O ATOM 68242 H1 WAT 9641 87.309 115.648 129.417 1.00 0.00 H ATOM 68243 H2 WAT 9641 86.246 114.601 129.160 1.00 0.00 H TER 68245 WAT 9641 ATOM 68245 O WAT 9642 17.437 80.927 121.017 1.00 0.00 O ATOM 68246 H1 WAT 9642 17.856 80.436 120.310 1.00 0.00 H ATOM 68247 H2 WAT 9642 17.399 81.827 120.692 1.00 0.00 H TER 68249 WAT 9642 ATOM 68249 O WAT 9643 112.745 17.919 117.163 1.00 0.00 O ATOM 68250 H1 WAT 9643 113.165 17.063 117.247 1.00 0.00 H ATOM 68251 H2 WAT 9643 112.220 17.850 116.365 1.00 0.00 H TER 68253 WAT 9643 ATOM 68253 O WAT 9644 18.840 44.444 133.777 1.00 0.00 O ATOM 68254 H1 WAT 9644 18.904 44.207 132.852 1.00 0.00 H ATOM 68255 H2 WAT 9644 18.275 43.772 134.158 1.00 0.00 H TER 68257 WAT 9644 ATOM 68257 O WAT 9645 100.376 100.618 66.738 1.00 0.00 O ATOM 68258 H1 WAT 9645 100.558 101.503 66.425 1.00 0.00 H ATOM 68259 H2 WAT 9645 99.516 100.683 67.154 1.00 0.00 H TER 68261 WAT 9645 ATOM 68261 O WAT 9646 22.300 84.997 112.837 1.00 0.00 O ATOM 68262 H1 WAT 9646 21.678 85.720 112.756 1.00 0.00 H ATOM 68263 H2 WAT 9646 21.765 84.208 112.742 1.00 0.00 H TER 68265 WAT 9646 ATOM 68265 O WAT 9647 85.593 118.227 69.377 1.00 0.00 O ATOM 68266 H1 WAT 9647 85.851 118.617 70.213 1.00 0.00 H ATOM 68267 H2 WAT 9647 84.911 118.809 69.042 1.00 0.00 H TER 68269 WAT 9647 ATOM 68269 O WAT 9648 127.882 106.965 12.647 1.00 0.00 O ATOM 68270 H1 WAT 9648 127.218 106.503 13.159 1.00 0.00 H ATOM 68271 H2 WAT 9648 127.389 107.613 12.144 1.00 0.00 H TER 68273 WAT 9648 ATOM 68273 O WAT 9649 19.142 35.035 90.316 1.00 0.00 O ATOM 68274 H1 WAT 9649 18.597 34.458 89.781 1.00 0.00 H ATOM 68275 H2 WAT 9649 18.825 34.902 91.209 1.00 0.00 H TER 68277 WAT 9649 ATOM 68277 O WAT 9650 36.442 117.719 23.380 1.00 0.00 O ATOM 68278 H1 WAT 9650 36.357 118.481 23.953 1.00 0.00 H ATOM 68279 H2 WAT 9650 37.314 117.806 22.995 1.00 0.00 H TER 68281 WAT 9650 ATOM 68281 O WAT 9651 66.600 91.486 107.297 1.00 0.00 O ATOM 68282 H1 WAT 9651 65.927 91.167 106.695 1.00 0.00 H ATOM 68283 H2 WAT 9651 66.226 92.283 107.673 1.00 0.00 H TER 68285 WAT 9651 ATOM 68285 O WAT 9652 132.502 65.687 143.403 1.00 0.00 O ATOM 68286 H1 WAT 9652 131.732 65.156 143.197 1.00 0.00 H ATOM 68287 H2 WAT 9652 132.264 66.153 144.205 1.00 0.00 H TER 68289 WAT 9652 ATOM 68289 O WAT 9653 105.993 55.503 62.394 1.00 0.00 O ATOM 68290 H1 WAT 9653 106.214 54.625 62.084 1.00 0.00 H ATOM 68291 H2 WAT 9653 106.813 55.992 62.336 1.00 0.00 H TER 68293 WAT 9653 ATOM 68293 O WAT 9654 101.918 25.643 73.976 1.00 0.00 O ATOM 68294 H1 WAT 9654 101.382 26.399 74.216 1.00 0.00 H ATOM 68295 H2 WAT 9654 102.743 26.021 73.670 1.00 0.00 H TER 68297 WAT 9654 ATOM 68297 O WAT 9655 54.184 11.141 76.900 1.00 0.00 O ATOM 68298 H1 WAT 9655 54.524 11.418 77.751 1.00 0.00 H ATOM 68299 H2 WAT 9655 53.878 10.246 77.044 1.00 0.00 H TER 68301 WAT 9655 ATOM 68301 O WAT 9656 42.322 24.939 138.436 1.00 0.00 O ATOM 68302 H1 WAT 9656 42.907 25.185 139.153 1.00 0.00 H ATOM 68303 H2 WAT 9656 42.058 24.041 138.639 1.00 0.00 H TER 68305 WAT 9656 ATOM 68305 O WAT 9657 122.966 42.544 89.561 1.00 0.00 O ATOM 68306 H1 WAT 9657 123.162 42.760 88.649 1.00 0.00 H ATOM 68307 H2 WAT 9657 123.729 42.051 89.860 1.00 0.00 H TER 68309 WAT 9657 ATOM 68309 O WAT 9658 55.782 88.202 114.200 1.00 0.00 O ATOM 68310 H1 WAT 9658 56.463 88.843 113.996 1.00 0.00 H ATOM 68311 H2 WAT 9658 55.812 88.114 115.152 1.00 0.00 H TER 68313 WAT 9658 ATOM 68313 O WAT 9659 79.328 3.595 70.073 1.00 0.00 O ATOM 68314 H1 WAT 9659 79.583 3.242 69.221 1.00 0.00 H ATOM 68315 H2 WAT 9659 78.714 4.299 69.866 1.00 0.00 H TER 68317 WAT 9659 ATOM 68317 O WAT 9660 107.370 142.465 146.259 1.00 0.00 O ATOM 68318 H1 WAT 9660 107.130 143.134 145.618 1.00 0.00 H ATOM 68319 H2 WAT 9660 107.775 141.770 145.740 1.00 0.00 H TER 68321 WAT 9660 ATOM 68321 O WAT 9661 144.023 85.130 26.843 1.00 0.00 O ATOM 68322 H1 WAT 9661 144.152 84.966 27.777 1.00 0.00 H ATOM 68323 H2 WAT 9661 143.122 84.855 26.674 1.00 0.00 H TER 68325 WAT 9661 ATOM 68325 O WAT 9662 121.875 92.356 22.823 1.00 0.00 O ATOM 68326 H1 WAT 9662 121.514 91.550 23.192 1.00 0.00 H ATOM 68327 H2 WAT 9662 121.183 92.688 22.252 1.00 0.00 H TER 68329 WAT 9662 ATOM 68329 O WAT 9663 58.129 95.903 7.951 1.00 0.00 O ATOM 68330 H1 WAT 9663 57.823 96.024 8.850 1.00 0.00 H ATOM 68331 H2 WAT 9663 58.812 95.236 8.017 1.00 0.00 H TER 68333 WAT 9663 ATOM 68333 O WAT 9664 14.341 47.405 15.629 1.00 0.00 O ATOM 68334 H1 WAT 9664 13.709 47.339 14.914 1.00 0.00 H ATOM 68335 H2 WAT 9664 14.057 48.170 16.130 1.00 0.00 H TER 68337 WAT 9664 ATOM 68337 O WAT 9665 106.309 5.816 118.534 1.00 0.00 O ATOM 68338 H1 WAT 9665 106.153 5.199 119.249 1.00 0.00 H ATOM 68339 H2 WAT 9665 105.929 5.393 117.764 1.00 0.00 H TER 68341 WAT 9665 ATOM 68341 O WAT 9666 134.862 125.077 74.441 1.00 0.00 O ATOM 68342 H1 WAT 9666 135.687 124.956 73.970 1.00 0.00 H ATOM 68343 H2 WAT 9666 135.103 125.017 75.365 1.00 0.00 H TER 68345 WAT 9666 ATOM 68345 O WAT 9667 74.478 19.123 84.940 1.00 0.00 O ATOM 68346 H1 WAT 9667 75.410 19.111 85.159 1.00 0.00 H ATOM 68347 H2 WAT 9667 74.441 19.530 84.075 1.00 0.00 H TER 68349 WAT 9667 ATOM 68349 O WAT 9668 44.982 29.485 10.210 1.00 0.00 O ATOM 68350 H1 WAT 9668 44.747 29.860 11.059 1.00 0.00 H ATOM 68351 H2 WAT 9668 44.145 29.360 9.763 1.00 0.00 H TER 68353 WAT 9668 ATOM 68353 O WAT 9669 63.849 82.286 72.483 1.00 0.00 O ATOM 68354 H1 WAT 9669 62.994 82.241 72.911 1.00 0.00 H ATOM 68355 H2 WAT 9669 63.780 83.032 71.887 1.00 0.00 H TER 68357 WAT 9669 ATOM 68357 O WAT 9670 127.980 8.390 80.954 1.00 0.00 O ATOM 68358 H1 WAT 9670 127.284 8.496 80.306 1.00 0.00 H ATOM 68359 H2 WAT 9670 128.176 7.453 80.945 1.00 0.00 H TER 68361 WAT 9670 ATOM 68361 O WAT 9671 110.385 21.300 138.768 1.00 0.00 O ATOM 68362 H1 WAT 9671 111.285 21.175 139.070 1.00 0.00 H ATOM 68363 H2 WAT 9671 109.873 20.672 139.277 1.00 0.00 H TER 68365 WAT 9671 ATOM 68365 O WAT 9672 113.540 57.031 111.807 1.00 0.00 O ATOM 68366 H1 WAT 9672 114.197 57.581 112.233 1.00 0.00 H ATOM 68367 H2 WAT 9672 113.706 57.139 110.871 1.00 0.00 H TER 68369 WAT 9672 ATOM 68369 O WAT 9673 9.660 77.872 153.348 1.00 0.00 O ATOM 68370 H1 WAT 9673 8.899 78.242 152.901 1.00 0.00 H ATOM 68371 H2 WAT 9673 9.650 78.277 154.215 1.00 0.00 H TER 68373 WAT 9673 ATOM 68373 O WAT 9674 84.448 73.602 106.308 1.00 0.00 O ATOM 68374 H1 WAT 9674 83.790 73.204 106.877 1.00 0.00 H ATOM 68375 H2 WAT 9674 83.947 74.172 105.725 1.00 0.00 H TER 68377 WAT 9674 ATOM 68377 O WAT 9675 67.297 127.815 120.002 1.00 0.00 O ATOM 68378 H1 WAT 9675 67.776 128.599 120.272 1.00 0.00 H ATOM 68379 H2 WAT 9675 67.955 127.120 120.005 1.00 0.00 H TER 68381 WAT 9675 ATOM 68381 O WAT 9676 77.298 80.329 66.701 1.00 0.00 O ATOM 68382 H1 WAT 9676 77.527 80.433 67.625 1.00 0.00 H ATOM 68383 H2 WAT 9676 78.124 80.102 66.274 1.00 0.00 H TER 68385 WAT 9676 ATOM 68385 O WAT 9677 7.475 69.608 24.570 1.00 0.00 O ATOM 68386 H1 WAT 9677 7.653 68.687 24.377 1.00 0.00 H ATOM 68387 H2 WAT 9677 8.218 70.080 24.195 1.00 0.00 H TER 68389 WAT 9677 ATOM 68389 O WAT 9678 122.205 72.311 136.813 1.00 0.00 O ATOM 68390 H1 WAT 9678 121.469 71.737 136.602 1.00 0.00 H ATOM 68391 H2 WAT 9678 122.072 73.082 136.261 1.00 0.00 H TER 68393 WAT 9678 ATOM 68393 O WAT 9679 65.818 97.800 151.236 1.00 0.00 O ATOM 68394 H1 WAT 9679 66.167 97.694 152.121 1.00 0.00 H ATOM 68395 H2 WAT 9679 66.588 97.761 150.668 1.00 0.00 H TER 68397 WAT 9679 ATOM 68397 O WAT 9680 132.176 111.400 89.817 1.00 0.00 O ATOM 68398 H1 WAT 9680 131.961 110.895 89.032 1.00 0.00 H ATOM 68399 H2 WAT 9680 132.137 112.313 89.532 1.00 0.00 H TER 68401 WAT 9680 ATOM 68401 O WAT 9681 115.490 86.438 94.652 1.00 0.00 O ATOM 68402 H1 WAT 9681 114.994 87.235 94.838 1.00 0.00 H ATOM 68403 H2 WAT 9681 116.138 86.705 94.000 1.00 0.00 H TER 68405 WAT 9681 ATOM 68405 O WAT 9682 105.101 95.807 15.854 1.00 0.00 O ATOM 68406 H1 WAT 9682 105.478 94.950 16.052 1.00 0.00 H ATOM 68407 H2 WAT 9682 104.492 95.972 16.574 1.00 0.00 H TER 68409 WAT 9682 ATOM 68409 O WAT 9683 131.689 117.163 151.018 1.00 0.00 O ATOM 68410 H1 WAT 9683 131.886 117.598 151.848 1.00 0.00 H ATOM 68411 H2 WAT 9683 131.716 116.229 151.225 1.00 0.00 H TER 68413 WAT 9683 ATOM 68413 O WAT 9684 16.061 125.593 142.727 1.00 0.00 O ATOM 68414 H1 WAT 9684 15.460 126.027 143.332 1.00 0.00 H ATOM 68415 H2 WAT 9684 16.744 126.243 142.561 1.00 0.00 H TER 68417 WAT 9684 ATOM 68417 O WAT 9685 95.652 122.635 144.327 1.00 0.00 O ATOM 68418 H1 WAT 9685 95.884 121.715 144.200 1.00 0.00 H ATOM 68419 H2 WAT 9685 96.227 122.932 145.032 1.00 0.00 H TER 68421 WAT 9685 ATOM 68421 O WAT 9686 15.659 74.595 120.538 1.00 0.00 O ATOM 68422 H1 WAT 9686 15.199 75.151 121.166 1.00 0.00 H ATOM 68423 H2 WAT 9686 16.157 73.983 121.080 1.00 0.00 H TER 68425 WAT 9686 ATOM 68425 O WAT 9687 7.974 86.655 77.893 1.00 0.00 O ATOM 68426 H1 WAT 9687 8.723 87.251 77.928 1.00 0.00 H ATOM 68427 H2 WAT 9687 8.294 85.897 77.403 1.00 0.00 H TER 68429 WAT 9687 ATOM 68429 O WAT 9688 67.270 44.343 22.367 1.00 0.00 O ATOM 68430 H1 WAT 9688 67.158 43.818 23.159 1.00 0.00 H ATOM 68431 H2 WAT 9688 66.588 45.012 22.424 1.00 0.00 H TER 68433 WAT 9688 ATOM 68433 O WAT 9689 117.088 135.806 124.725 1.00 0.00 O ATOM 68434 H1 WAT 9689 116.654 135.484 125.516 1.00 0.00 H ATOM 68435 H2 WAT 9689 116.508 135.544 124.010 1.00 0.00 H TER 68437 WAT 9689 ATOM 68437 O WAT 9690 106.634 88.379 2.952 1.00 0.00 O ATOM 68438 H1 WAT 9690 105.830 88.000 2.598 1.00 0.00 H ATOM 68439 H2 WAT 9690 107.321 88.086 2.353 1.00 0.00 H TER 68441 WAT 9690 ATOM 68441 O WAT 9691 93.704 115.755 141.438 1.00 0.00 O ATOM 68442 H1 WAT 9691 94.643 115.646 141.285 1.00 0.00 H ATOM 68443 H2 WAT 9691 93.313 114.943 141.113 1.00 0.00 H TER 68445 WAT 9691 ATOM 68445 O WAT 9692 32.171 67.213 8.211 1.00 0.00 O ATOM 68446 H1 WAT 9692 31.279 66.945 8.433 1.00 0.00 H ATOM 68447 H2 WAT 9692 32.708 66.875 8.928 1.00 0.00 H TER 68449 WAT 9692 ATOM 68449 O WAT 9693 114.778 82.086 88.702 1.00 0.00 O ATOM 68450 H1 WAT 9693 114.518 82.930 88.332 1.00 0.00 H ATOM 68451 H2 WAT 9693 115.359 81.705 88.043 1.00 0.00 H TER 68453 WAT 9693 ATOM 68453 O WAT 9694 137.054 14.377 125.735 1.00 0.00 O ATOM 68454 H1 WAT 9694 137.015 15.099 126.362 1.00 0.00 H ATOM 68455 H2 WAT 9694 137.796 13.846 126.026 1.00 0.00 H TER 68457 WAT 9694 ATOM 68457 O WAT 9695 113.992 103.746 64.515 1.00 0.00 O ATOM 68458 H1 WAT 9695 114.594 103.646 63.777 1.00 0.00 H ATOM 68459 H2 WAT 9695 113.296 104.311 64.181 1.00 0.00 H TER 68461 WAT 9695 ATOM 68461 O WAT 9696 145.513 102.759 101.421 1.00 0.00 O ATOM 68462 H1 WAT 9696 146.360 103.067 101.743 1.00 0.00 H ATOM 68463 H2 WAT 9696 144.874 103.140 102.024 1.00 0.00 H TER 68465 WAT 9696 ATOM 68465 O WAT 9697 110.673 92.929 126.192 1.00 0.00 O ATOM 68466 H1 WAT 9697 110.355 92.380 126.908 1.00 0.00 H ATOM 68467 H2 WAT 9697 111.532 92.566 125.974 1.00 0.00 H TER 68469 WAT 9697 ATOM 68469 O WAT 9698 98.849 124.831 58.869 1.00 0.00 O ATOM 68470 H1 WAT 9698 98.760 124.652 59.805 1.00 0.00 H ATOM 68471 H2 WAT 9698 98.231 124.232 58.451 1.00 0.00 H TER 68473 WAT 9698 ATOM 68473 O WAT 9699 20.073 41.813 132.383 1.00 0.00 O ATOM 68474 H1 WAT 9699 20.458 41.482 133.195 1.00 0.00 H ATOM 68475 H2 WAT 9699 20.526 41.331 131.690 1.00 0.00 H TER 68477 WAT 9699 ATOM 68477 O WAT 9700 107.837 30.919 96.451 1.00 0.00 O ATOM 68478 H1 WAT 9700 108.032 30.053 96.808 1.00 0.00 H ATOM 68479 H2 WAT 9700 108.264 31.528 97.053 1.00 0.00 H TER 68481 WAT 9700 ATOM 68481 O WAT 9701 56.729 93.226 18.561 1.00 0.00 O ATOM 68482 H1 WAT 9701 57.624 93.047 18.848 1.00 0.00 H ATOM 68483 H2 WAT 9701 56.748 93.089 17.614 1.00 0.00 H TER 68485 WAT 9701 ATOM 68485 O WAT 9702 118.726 35.160 71.476 1.00 0.00 O ATOM 68486 H1 WAT 9702 117.783 35.232 71.621 1.00 0.00 H ATOM 68487 H2 WAT 9702 119.100 35.894 71.963 1.00 0.00 H TER 68489 WAT 9702 ATOM 68489 O WAT 9703 118.669 42.325 20.617 1.00 0.00 O ATOM 68490 H1 WAT 9703 117.921 41.803 20.328 1.00 0.00 H ATOM 68491 H2 WAT 9703 119.406 41.715 20.605 1.00 0.00 H TER 68493 WAT 9703 ATOM 68493 O WAT 9704 51.089 55.274 99.910 1.00 0.00 O ATOM 68494 H1 WAT 9704 51.727 55.858 100.319 1.00 0.00 H ATOM 68495 H2 WAT 9704 50.239 55.657 100.128 1.00 0.00 H TER 68497 WAT 9704 ATOM 68497 O WAT 9705 74.607 83.394 3.591 1.00 0.00 O ATOM 68498 H1 WAT 9705 74.580 83.941 4.375 1.00 0.00 H ATOM 68499 H2 WAT 9705 74.469 82.504 3.915 1.00 0.00 H TER 68501 WAT 9705 ATOM 68501 O WAT 9706 105.617 12.727 151.589 1.00 0.00 O ATOM 68502 H1 WAT 9706 104.951 13.382 151.796 1.00 0.00 H ATOM 68503 H2 WAT 9706 106.047 12.549 152.425 1.00 0.00 H TER 68505 WAT 9706 ATOM 68505 O WAT 9707 37.743 14.234 109.235 1.00 0.00 O ATOM 68506 H1 WAT 9707 38.466 14.606 109.741 1.00 0.00 H ATOM 68507 H2 WAT 9707 37.720 13.312 109.493 1.00 0.00 H TER 68509 WAT 9707 ATOM 68509 O WAT 9708 56.800 99.539 133.795 1.00 0.00 O ATOM 68510 H1 WAT 9708 56.062 99.713 134.378 1.00 0.00 H ATOM 68511 H2 WAT 9708 57.147 98.698 134.092 1.00 0.00 H TER 68513 WAT 9708 ATOM 68513 O WAT 9709 96.911 138.863 128.123 1.00 0.00 O ATOM 68514 H1 WAT 9709 97.566 138.879 127.424 1.00 0.00 H ATOM 68515 H2 WAT 9709 96.352 139.620 127.945 1.00 0.00 H TER 68517 WAT 9709 ATOM 68517 O WAT 9710 57.314 45.851 5.817 1.00 0.00 O ATOM 68518 H1 WAT 9710 56.519 46.334 6.044 1.00 0.00 H ATOM 68519 H2 WAT 9710 57.092 44.935 5.986 1.00 0.00 H TER 68521 WAT 9710 ATOM 68521 O WAT 9711 127.926 2.914 87.822 1.00 0.00 O ATOM 68522 H1 WAT 9711 128.695 2.584 88.286 1.00 0.00 H ATOM 68523 H2 WAT 9711 128.189 2.927 86.902 1.00 0.00 H TER 68525 WAT 9711 ATOM 68525 O WAT 9712 34.397 111.440 64.528 1.00 0.00 O ATOM 68526 H1 WAT 9712 35.294 111.107 64.564 1.00 0.00 H ATOM 68527 H2 WAT 9712 33.975 111.075 65.306 1.00 0.00 H TER 68529 WAT 9712 ATOM 68529 O WAT 9713 3.317 45.498 156.898 1.00 0.00 O ATOM 68530 H1 WAT 9713 3.205 44.608 156.564 1.00 0.00 H ATOM 68531 H2 WAT 9713 2.813 46.045 156.295 1.00 0.00 H TER 68533 WAT 9713 ATOM 68533 O WAT 9714 69.212 141.620 115.746 1.00 0.00 O ATOM 68534 H1 WAT 9714 69.729 141.518 116.545 1.00 0.00 H ATOM 68535 H2 WAT 9714 69.512 142.449 115.371 1.00 0.00 H TER 68537 WAT 9714 ATOM 68537 O WAT 9715 2.000 129.327 151.144 1.00 0.00 O ATOM 68538 H1 WAT 9715 1.743 128.493 151.538 1.00 0.00 H ATOM 68539 H2 WAT 9715 1.178 129.806 151.041 1.00 0.00 H TER 68541 WAT 9715 ATOM 68541 O WAT 9716 10.499 47.713 11.733 1.00 0.00 O ATOM 68542 H1 WAT 9716 11.348 47.893 11.330 1.00 0.00 H ATOM 68543 H2 WAT 9716 9.893 47.647 10.995 1.00 0.00 H TER 68545 WAT 9716 ATOM 68545 O WAT 9717 15.581 0.629 93.973 1.00 0.00 O ATOM 68546 H1 WAT 9717 16.256 0.699 94.647 1.00 0.00 H ATOM 68547 H2 WAT 9717 15.566 1.491 93.558 1.00 0.00 H TER 68549 WAT 9717 ATOM 68549 O WAT 9718 46.201 105.929 23.123 1.00 0.00 O ATOM 68550 H1 WAT 9718 47.094 105.849 22.789 1.00 0.00 H ATOM 68551 H2 WAT 9718 46.222 105.487 23.971 1.00 0.00 H TER 68553 WAT 9718 ATOM 68553 O WAT 9719 16.655 110.735 124.516 1.00 0.00 O ATOM 68554 H1 WAT 9719 17.380 110.881 125.124 1.00 0.00 H ATOM 68555 H2 WAT 9719 15.983 111.359 124.791 1.00 0.00 H TER 68557 WAT 9719 ATOM 68557 O WAT 9720 48.835 32.139 77.978 1.00 0.00 O ATOM 68558 H1 WAT 9720 49.526 31.599 78.360 1.00 0.00 H ATOM 68559 H2 WAT 9720 48.024 31.677 78.192 1.00 0.00 H TER 68561 WAT 9720 ATOM 68561 O WAT 9721 4.872 83.791 147.025 1.00 0.00 O ATOM 68562 H1 WAT 9721 4.990 83.861 147.973 1.00 0.00 H ATOM 68563 H2 WAT 9721 4.435 84.606 146.777 1.00 0.00 H TER 68565 WAT 9721 ATOM 68565 O WAT 9722 79.620 14.614 5.426 1.00 0.00 O ATOM 68566 H1 WAT 9722 80.111 14.640 4.604 1.00 0.00 H ATOM 68567 H2 WAT 9722 79.292 13.716 5.481 1.00 0.00 H TER 68569 WAT 9722 ATOM 68569 O WAT 9723 81.265 104.572 112.243 1.00 0.00 O ATOM 68570 H1 WAT 9723 82.185 104.829 112.176 1.00 0.00 H ATOM 68571 H2 WAT 9723 81.188 103.807 111.674 1.00 0.00 H TER 68573 WAT 9723 ATOM 68573 O WAT 9724 120.753 102.554 102.328 1.00 0.00 O ATOM 68574 H1 WAT 9724 120.713 103.276 101.702 1.00 0.00 H ATOM 68575 H2 WAT 9724 120.630 101.768 101.796 1.00 0.00 H TER 68577 WAT 9724 ATOM 68577 O WAT 9725 24.806 31.431 146.343 1.00 0.00 O ATOM 68578 H1 WAT 9725 24.648 32.085 145.662 1.00 0.00 H ATOM 68579 H2 WAT 9725 25.500 31.809 146.882 1.00 0.00 H TER 68581 WAT 9725 ATOM 68581 O WAT 9726 141.107 130.905 73.971 1.00 0.00 O ATOM 68582 H1 WAT 9726 140.402 130.677 73.364 1.00 0.00 H ATOM 68583 H2 WAT 9726 140.819 130.558 74.815 1.00 0.00 H TER 68585 WAT 9726 ATOM 68585 O WAT 9727 77.309 95.865 83.146 1.00 0.00 O ATOM 68586 H1 WAT 9727 76.771 96.084 82.385 1.00 0.00 H ATOM 68587 H2 WAT 9727 78.209 95.907 82.824 1.00 0.00 H TER 68589 WAT 9727 ATOM 68589 O WAT 9728 140.533 123.782 154.271 1.00 0.00 O ATOM 68590 H1 WAT 9728 140.655 123.768 153.322 1.00 0.00 H ATOM 68591 H2 WAT 9728 140.478 122.859 154.518 1.00 0.00 H TER 68593 WAT 9728 ATOM 68593 O WAT 9729 0.072 66.733 73.958 1.00 0.00 O ATOM 68594 H1 WAT 9729 -0.683 66.433 73.452 1.00 0.00 H ATOM 68595 H2 WAT 9729 0.818 66.614 73.370 1.00 0.00 H TER 68597 WAT 9729 ATOM 68597 O WAT 9730 87.970 128.833 88.963 1.00 0.00 O ATOM 68598 H1 WAT 9730 88.001 129.491 88.269 1.00 0.00 H ATOM 68599 H2 WAT 9730 88.695 128.240 88.764 1.00 0.00 H TER 68601 WAT 9730 ATOM 68601 O WAT 9731 75.246 32.902 3.700 1.00 0.00 O ATOM 68602 H1 WAT 9731 75.383 32.357 2.925 1.00 0.00 H ATOM 68603 H2 WAT 9731 76.129 33.133 3.990 1.00 0.00 H TER 68605 WAT 9731 ATOM 68605 O WAT 9732 75.860 90.889 75.070 1.00 0.00 O ATOM 68606 H1 WAT 9732 76.600 91.406 74.752 1.00 0.00 H ATOM 68607 H2 WAT 9732 75.886 90.087 74.547 1.00 0.00 H TER 68609 WAT 9732 ATOM 68609 O WAT 9733 137.658 96.419 26.713 1.00 0.00 O ATOM 68610 H1 WAT 9733 137.636 96.978 27.489 1.00 0.00 H ATOM 68611 H2 WAT 9733 136.959 95.781 26.858 1.00 0.00 H TER 68613 WAT 9733 ATOM 68613 O WAT 9734 113.080 52.712 65.435 1.00 0.00 O ATOM 68614 H1 WAT 9734 113.791 52.278 65.906 1.00 0.00 H ATOM 68615 H2 WAT 9734 112.440 52.017 65.275 1.00 0.00 H TER 68617 WAT 9734 ATOM 68617 O WAT 9735 0.376 82.305 150.799 1.00 0.00 O ATOM 68618 H1 WAT 9735 0.694 81.775 150.067 1.00 0.00 H ATOM 68619 H2 WAT 9735 -0.566 82.383 150.646 1.00 0.00 H TER 68621 WAT 9735 ATOM 68621 O WAT 9736 62.304 51.706 144.491 1.00 0.00 O ATOM 68622 H1 WAT 9736 62.298 51.249 145.332 1.00 0.00 H ATOM 68623 H2 WAT 9736 61.866 51.105 143.889 1.00 0.00 H TER 68625 WAT 9736 ATOM 68625 O WAT 9737 132.795 137.576 155.673 1.00 0.00 O ATOM 68626 H1 WAT 9737 132.901 138.245 154.997 1.00 0.00 H ATOM 68627 H2 WAT 9737 132.609 136.772 155.188 1.00 0.00 H TER 68629 WAT 9737 ATOM 68629 O WAT 9738 22.363 54.214 72.677 1.00 0.00 O ATOM 68630 H1 WAT 9738 23.032 53.530 72.703 1.00 0.00 H ATOM 68631 H2 WAT 9738 22.852 55.023 72.530 1.00 0.00 H TER 68633 WAT 9738 ATOM 68633 O WAT 9739 26.443 72.603 103.211 1.00 0.00 O ATOM 68634 H1 WAT 9739 25.778 72.894 103.835 1.00 0.00 H ATOM 68635 H2 WAT 9739 26.373 73.219 102.482 1.00 0.00 H TER 68637 WAT 9739 ATOM 68637 O WAT 9740 128.461 137.590 90.373 1.00 0.00 O ATOM 68638 H1 WAT 9740 128.532 136.704 90.727 1.00 0.00 H ATOM 68639 H2 WAT 9740 127.544 137.672 90.113 1.00 0.00 H TER 68641 WAT 9740 ATOM 68641 O WAT 9741 113.890 93.789 110.810 1.00 0.00 O ATOM 68642 H1 WAT 9741 113.749 94.605 110.330 1.00 0.00 H ATOM 68643 H2 WAT 9741 113.469 93.119 110.271 1.00 0.00 H TER 68645 WAT 9741 ATOM 68645 O WAT 9742 131.636 14.393 120.711 1.00 0.00 O ATOM 68646 H1 WAT 9742 130.756 14.053 120.548 1.00 0.00 H ATOM 68647 H2 WAT 9742 131.492 15.265 121.077 1.00 0.00 H TER 68649 WAT 9742 ATOM 68649 O WAT 9743 77.513 5.410 123.648 1.00 0.00 O ATOM 68650 H1 WAT 9743 76.699 4.982 123.916 1.00 0.00 H ATOM 68651 H2 WAT 9743 78.154 5.138 124.305 1.00 0.00 H TER 68653 WAT 9743 ATOM 68653 O WAT 9744 118.345 34.414 147.864 1.00 0.00 O ATOM 68654 H1 WAT 9744 118.222 33.967 148.701 1.00 0.00 H ATOM 68655 H2 WAT 9744 118.350 33.711 147.215 1.00 0.00 H TER 68657 WAT 9744 ATOM 68657 O WAT 9745 110.334 82.692 139.317 1.00 0.00 O ATOM 68658 H1 WAT 9745 111.209 82.708 139.705 1.00 0.00 H ATOM 68659 H2 WAT 9745 110.491 82.680 138.373 1.00 0.00 H TER 68661 WAT 9745 ATOM 68661 O WAT 9746 45.766 118.244 100.172 1.00 0.00 O ATOM 68662 H1 WAT 9746 46.640 118.463 100.494 1.00 0.00 H ATOM 68663 H2 WAT 9746 45.533 117.441 100.638 1.00 0.00 H TER 68665 WAT 9746 ATOM 68665 O WAT 9747 85.091 63.750 123.176 1.00 0.00 O ATOM 68666 H1 WAT 9747 85.860 63.221 123.390 1.00 0.00 H ATOM 68667 H2 WAT 9747 85.443 64.504 122.703 1.00 0.00 H TER 68669 WAT 9747 ATOM 68669 O WAT 9748 2.289 18.378 55.301 1.00 0.00 O ATOM 68670 H1 WAT 9748 2.769 18.566 56.107 1.00 0.00 H ATOM 68671 H2 WAT 9748 1.924 17.504 55.438 1.00 0.00 H TER 68673 WAT 9748 ATOM 68673 O WAT 9749 27.041 2.761 70.614 1.00 0.00 O ATOM 68674 H1 WAT 9749 27.211 1.893 70.979 1.00 0.00 H ATOM 68675 H2 WAT 9749 26.093 2.869 70.682 1.00 0.00 H TER 68677 WAT 9749 ATOM 68677 O WAT 9750 73.562 15.425 71.826 1.00 0.00 O ATOM 68678 H1 WAT 9750 72.718 15.202 72.218 1.00 0.00 H ATOM 68679 H2 WAT 9750 73.696 16.345 72.052 1.00 0.00 H TER 68681 WAT 9750 ATOM 68681 O WAT 9751 140.603 112.642 77.898 1.00 0.00 O ATOM 68682 H1 WAT 9751 140.286 112.104 77.172 1.00 0.00 H ATOM 68683 H2 WAT 9751 139.915 112.578 78.561 1.00 0.00 H TER 68685 WAT 9751 ATOM 68685 O WAT 9752 74.936 99.886 92.547 1.00 0.00 O ATOM 68686 H1 WAT 9752 75.119 100.536 91.868 1.00 0.00 H ATOM 68687 H2 WAT 9752 75.776 99.755 92.986 1.00 0.00 H TER 68689 WAT 9752 ATOM 68689 O WAT 9753 27.809 36.469 118.195 1.00 0.00 O ATOM 68690 H1 WAT 9753 27.869 36.229 117.270 1.00 0.00 H ATOM 68691 H2 WAT 9753 28.232 37.326 118.247 1.00 0.00 H TER 68693 WAT 9753 ATOM 68693 O WAT 9754 34.962 127.545 154.171 1.00 0.00 O ATOM 68694 H1 WAT 9754 34.453 126.737 154.107 1.00 0.00 H ATOM 68695 H2 WAT 9754 34.835 127.976 153.326 1.00 0.00 H TER 68697 WAT 9754 ATOM 68697 O WAT 9755 33.538 2.857 103.764 1.00 0.00 O ATOM 68698 H1 WAT 9755 33.553 2.638 104.696 1.00 0.00 H ATOM 68699 H2 WAT 9755 32.786 3.442 103.668 1.00 0.00 H TER 68701 WAT 9755 ATOM 68701 O WAT 9756 111.143 15.287 64.610 1.00 0.00 O ATOM 68702 H1 WAT 9756 110.200 15.427 64.531 1.00 0.00 H ATOM 68703 H2 WAT 9756 111.430 15.940 65.249 1.00 0.00 H TER 68705 WAT 9756 ATOM 68705 O WAT 9757 55.023 144.874 7.079 1.00 0.00 O ATOM 68706 H1 WAT 9757 54.499 144.515 6.363 1.00 0.00 H ATOM 68707 H2 WAT 9757 55.927 144.813 6.768 1.00 0.00 H TER 68709 WAT 9757 ATOM 68709 O WAT 9758 142.198 101.407 71.010 1.00 0.00 O ATOM 68710 H1 WAT 9758 141.719 100.591 71.156 1.00 0.00 H ATOM 68711 H2 WAT 9758 143.089 101.217 71.303 1.00 0.00 H TER 68713 WAT 9758 ATOM 68713 O WAT 9759 11.989 126.319 152.779 1.00 0.00 O ATOM 68714 H1 WAT 9759 12.775 126.471 152.254 1.00 0.00 H ATOM 68715 H2 WAT 9759 11.406 127.043 152.552 1.00 0.00 H TER 68717 WAT 9759 ATOM 68717 O WAT 9760 99.217 123.301 7.398 1.00 0.00 O ATOM 68718 H1 WAT 9760 98.564 123.955 7.644 1.00 0.00 H ATOM 68719 H2 WAT 9760 98.990 122.528 7.915 1.00 0.00 H TER 68721 WAT 9760 ATOM 68721 O WAT 9761 85.409 72.827 19.946 1.00 0.00 O ATOM 68722 H1 WAT 9761 84.927 73.548 20.353 1.00 0.00 H ATOM 68723 H2 WAT 9761 84.820 72.076 20.017 1.00 0.00 H TER 68725 WAT 9761 ATOM 68725 O WAT 9762 83.478 86.022 87.954 1.00 0.00 O ATOM 68726 H1 WAT 9762 83.033 85.716 88.744 1.00 0.00 H ATOM 68727 H2 WAT 9762 82.981 85.633 87.234 1.00 0.00 H TER 68729 WAT 9762 ATOM 68729 O WAT 9763 117.901 116.677 100.241 1.00 0.00 O ATOM 68730 H1 WAT 9763 118.399 116.303 99.515 1.00 0.00 H ATOM 68731 H2 WAT 9763 117.685 115.927 100.795 1.00 0.00 H TER 68733 WAT 9763 ATOM 68733 O WAT 9764 43.425 25.505 2.402 1.00 0.00 O ATOM 68734 H1 WAT 9764 43.531 26.179 3.074 1.00 0.00 H ATOM 68735 H2 WAT 9764 44.047 25.750 1.717 1.00 0.00 H TER 68737 WAT 9764 ATOM 68737 O WAT 9765 116.680 83.780 127.422 1.00 0.00 O ATOM 68738 H1 WAT 9765 117.136 83.351 128.146 1.00 0.00 H ATOM 68739 H2 WAT 9765 116.793 84.716 127.588 1.00 0.00 H TER 68741 WAT 9765 ATOM 68741 O WAT 9766 87.551 125.020 152.838 1.00 0.00 O ATOM 68742 H1 WAT 9766 87.381 125.069 151.897 1.00 0.00 H ATOM 68743 H2 WAT 9766 87.464 125.922 153.145 1.00 0.00 H TER 68745 WAT 9766 ATOM 68745 O WAT 9767 139.310 69.764 70.608 1.00 0.00 O ATOM 68746 H1 WAT 9767 140.231 69.539 70.739 1.00 0.00 H ATOM 68747 H2 WAT 9767 138.828 69.088 71.085 1.00 0.00 H TER 68749 WAT 9767 ATOM 68749 O WAT 9768 113.146 43.226 66.602 1.00 0.00 O ATOM 68750 H1 WAT 9768 114.047 43.398 66.874 1.00 0.00 H ATOM 68751 H2 WAT 9768 112.651 43.980 66.922 1.00 0.00 H TER 68753 WAT 9768 ATOM 68753 O WAT 9769 131.588 6.665 121.764 1.00 0.00 O ATOM 68754 H1 WAT 9769 131.111 6.798 122.583 1.00 0.00 H ATOM 68755 H2 WAT 9769 131.933 5.775 121.830 1.00 0.00 H TER 68757 WAT 9769 ATOM 68757 O WAT 9770 90.516 59.788 109.189 1.00 0.00 O ATOM 68758 H1 WAT 9770 89.897 60.138 108.548 1.00 0.00 H ATOM 68759 H2 WAT 9770 91.323 60.278 109.036 1.00 0.00 H TER 68761 WAT 9770 ATOM 68761 O WAT 9771 132.012 23.061 127.559 1.00 0.00 O ATOM 68762 H1 WAT 9771 132.591 22.418 127.967 1.00 0.00 H ATOM 68763 H2 WAT 9771 131.215 23.037 128.088 1.00 0.00 H TER 68765 WAT 9771 ATOM 68765 O WAT 9772 95.999 63.807 130.854 1.00 0.00 O ATOM 68766 H1 WAT 9772 95.612 63.187 130.236 1.00 0.00 H ATOM 68767 H2 WAT 9772 95.946 63.366 131.701 1.00 0.00 H TER 68769 WAT 9772 ATOM 68769 O WAT 9773 81.482 48.896 120.332 1.00 0.00 O ATOM 68770 H1 WAT 9773 81.413 49.786 119.986 1.00 0.00 H ATOM 68771 H2 WAT 9773 82.065 48.978 121.087 1.00 0.00 H TER 68773 WAT 9773 ATOM 68773 O WAT 9774 87.794 108.280 23.048 1.00 0.00 O ATOM 68774 H1 WAT 9774 88.176 107.468 23.380 1.00 0.00 H ATOM 68775 H2 WAT 9774 88.023 108.938 23.704 1.00 0.00 H TER 68777 WAT 9774 ATOM 68777 O WAT 9775 36.318 11.266 154.285 1.00 0.00 O ATOM 68778 H1 WAT 9775 35.496 11.553 153.888 1.00 0.00 H ATOM 68779 H2 WAT 9775 36.996 11.592 153.693 1.00 0.00 H TER 68781 WAT 9775 ATOM 68781 O WAT 9776 79.563 21.882 66.398 1.00 0.00 O ATOM 68782 H1 WAT 9776 79.079 22.353 67.077 1.00 0.00 H ATOM 68783 H2 WAT 9776 79.971 21.150 66.860 1.00 0.00 H TER 68785 WAT 9776 ATOM 68785 O WAT 9777 17.550 127.489 114.026 1.00 0.00 O ATOM 68786 H1 WAT 9777 18.489 127.409 113.856 1.00 0.00 H ATOM 68787 H2 WAT 9777 17.466 127.359 114.971 1.00 0.00 H TER 68789 WAT 9777 ATOM 68789 O WAT 9778 76.200 76.701 121.330 1.00 0.00 O ATOM 68790 H1 WAT 9778 76.781 76.057 120.926 1.00 0.00 H ATOM 68791 H2 WAT 9778 75.379 76.621 120.844 1.00 0.00 H TER 68793 WAT 9778 ATOM 68793 O WAT 9779 111.083 13.916 121.616 1.00 0.00 O ATOM 68794 H1 WAT 9779 111.178 13.508 120.755 1.00 0.00 H ATOM 68795 H2 WAT 9779 111.338 13.232 122.235 1.00 0.00 H TER 68797 WAT 9779 ATOM 68797 O WAT 9780 119.929 113.582 111.719 1.00 0.00 O ATOM 68798 H1 WAT 9780 119.065 113.224 111.518 1.00 0.00 H ATOM 68799 H2 WAT 9780 119.830 114.527 111.602 1.00 0.00 H TER 68801 WAT 9780 ATOM 68801 O WAT 9781 35.891 133.597 114.671 1.00 0.00 O ATOM 68802 H1 WAT 9781 35.091 134.026 114.974 1.00 0.00 H ATOM 68803 H2 WAT 9781 35.734 133.426 113.742 1.00 0.00 H TER 68805 WAT 9781 ATOM 68805 O WAT 9782 125.907 94.087 75.269 1.00 0.00 O ATOM 68806 H1 WAT 9782 126.332 94.398 74.470 1.00 0.00 H ATOM 68807 H2 WAT 9782 124.971 94.198 75.102 1.00 0.00 H TER 68809 WAT 9782 ATOM 68809 O WAT 9783 143.661 102.748 81.025 1.00 0.00 O ATOM 68810 H1 WAT 9783 143.872 102.976 80.120 1.00 0.00 H ATOM 68811 H2 WAT 9783 143.419 101.823 80.989 1.00 0.00 H TER 68813 WAT 9783 ATOM 68813 O WAT 9784 95.245 46.458 121.698 1.00 0.00 O ATOM 68814 H1 WAT 9784 95.389 47.049 122.437 1.00 0.00 H ATOM 68815 H2 WAT 9784 94.470 45.952 121.943 1.00 0.00 H TER 68817 WAT 9784 ATOM 68817 O WAT 9785 114.081 36.594 55.145 1.00 0.00 O ATOM 68818 H1 WAT 9785 113.398 37.202 55.429 1.00 0.00 H ATOM 68819 H2 WAT 9785 114.164 36.750 54.204 1.00 0.00 H TER 68821 WAT 9785 ATOM 68821 O WAT 9786 117.657 16.884 115.006 1.00 0.00 O ATOM 68822 H1 WAT 9786 118.244 16.575 114.316 1.00 0.00 H ATOM 68823 H2 WAT 9786 117.540 16.125 115.578 1.00 0.00 H TER 68825 WAT 9786 ATOM 68825 O WAT 9787 28.150 130.504 98.969 1.00 0.00 O ATOM 68826 H1 WAT 9787 27.920 129.858 99.636 1.00 0.00 H ATOM 68827 H2 WAT 9787 29.083 130.668 99.105 1.00 0.00 H TER 68829 WAT 9787 ATOM 68829 O WAT 9788 68.876 45.182 76.304 1.00 0.00 O ATOM 68830 H1 WAT 9788 69.009 46.032 76.721 1.00 0.00 H ATOM 68831 H2 WAT 9788 69.705 44.720 76.430 1.00 0.00 H TER 68833 WAT 9788 ATOM 68833 O WAT 9789 35.105 138.149 19.415 1.00 0.00 O ATOM 68834 H1 WAT 9789 35.696 137.428 19.634 1.00 0.00 H ATOM 68835 H2 WAT 9789 35.041 138.125 18.461 1.00 0.00 H TER 68837 WAT 9789 ATOM 68837 O WAT 9790 34.668 106.775 119.052 1.00 0.00 O ATOM 68838 H1 WAT 9790 35.337 106.646 118.380 1.00 0.00 H ATOM 68839 H2 WAT 9790 34.757 106.014 119.627 1.00 0.00 H TER 68841 WAT 9790 ATOM 68841 O WAT 9791 111.785 88.430 13.370 1.00 0.00 O ATOM 68842 H1 WAT 9791 111.073 87.812 13.203 1.00 0.00 H ATOM 68843 H2 WAT 9791 112.505 87.886 13.690 1.00 0.00 H TER 68845 WAT 9791 ATOM 68845 O WAT 9792 7.443 48.502 122.925 1.00 0.00 O ATOM 68846 H1 WAT 9792 7.351 47.652 122.494 1.00 0.00 H ATOM 68847 H2 WAT 9792 7.537 49.127 122.206 1.00 0.00 H TER 68849 WAT 9792 ATOM 68849 O WAT 9793 126.486 25.896 101.771 1.00 0.00 O ATOM 68850 H1 WAT 9793 126.057 26.338 101.039 1.00 0.00 H ATOM 68851 H2 WAT 9793 126.519 26.556 102.464 1.00 0.00 H TER 68853 WAT 9793 ATOM 68853 O WAT 9794 47.647 63.848 139.801 1.00 0.00 O ATOM 68854 H1 WAT 9794 46.839 63.556 139.380 1.00 0.00 H ATOM 68855 H2 WAT 9794 47.361 64.229 140.631 1.00 0.00 H TER 68857 WAT 9794 ATOM 68857 O WAT 9795 100.550 118.788 126.037 1.00 0.00 O ATOM 68858 H1 WAT 9795 99.795 118.611 125.476 1.00 0.00 H ATOM 68859 H2 WAT 9795 100.945 117.929 126.185 1.00 0.00 H TER 68861 WAT 9795 ATOM 68861 O WAT 9796 137.013 128.854 142.213 1.00 0.00 O ATOM 68862 H1 WAT 9796 136.629 129.223 141.418 1.00 0.00 H ATOM 68863 H2 WAT 9796 136.263 128.546 142.722 1.00 0.00 H TER 68865 WAT 9796 ATOM 68865 O WAT 9797 13.887 74.271 118.632 1.00 0.00 O ATOM 68866 H1 WAT 9797 14.486 74.173 119.372 1.00 0.00 H ATOM 68867 H2 WAT 9797 13.055 74.528 119.030 1.00 0.00 H TER 68869 WAT 9797 ATOM 68869 O WAT 9798 68.667 124.414 7.597 1.00 0.00 O ATOM 68870 H1 WAT 9798 68.568 123.935 8.420 1.00 0.00 H ATOM 68871 H2 WAT 9798 68.397 125.308 7.806 1.00 0.00 H TER 68873 WAT 9798 ATOM 68873 O WAT 9799 73.146 63.919 120.871 1.00 0.00 O ATOM 68874 H1 WAT 9799 72.577 64.670 121.036 1.00 0.00 H ATOM 68875 H2 WAT 9799 73.446 64.039 119.970 1.00 0.00 H TER 68877 WAT 9799 ATOM 68877 O WAT 9800 12.488 140.240 21.325 1.00 0.00 O ATOM 68878 H1 WAT 9800 11.769 139.614 21.241 1.00 0.00 H ATOM 68879 H2 WAT 9800 12.389 140.601 22.206 1.00 0.00 H TER 68881 WAT 9800 ATOM 68881 O WAT 9801 89.886 142.640 145.497 1.00 0.00 O ATOM 68882 H1 WAT 9801 89.853 141.713 145.734 1.00 0.00 H ATOM 68883 H2 WAT 9801 90.730 142.744 145.056 1.00 0.00 H TER 68885 WAT 9801 ATOM 68885 O WAT 9802 72.675 117.321 0.467 1.00 0.00 O ATOM 68886 H1 WAT 9802 73.499 117.606 0.070 1.00 0.00 H ATOM 68887 H2 WAT 9802 72.937 116.891 1.280 1.00 0.00 H TER 68889 WAT 9802 ATOM 68889 O WAT 9803 138.114 99.720 90.699 1.00 0.00 O ATOM 68890 H1 WAT 9803 137.382 100.315 90.539 1.00 0.00 H ATOM 68891 H2 WAT 9803 138.063 99.525 91.635 1.00 0.00 H TER 68893 WAT 9803 ATOM 68893 O WAT 9804 124.268 14.968 151.464 1.00 0.00 O ATOM 68894 H1 WAT 9804 124.489 15.625 152.125 1.00 0.00 H ATOM 68895 H2 WAT 9804 125.090 14.813 150.998 1.00 0.00 H TER 68897 WAT 9804 ATOM 68897 O WAT 9805 7.455 65.232 143.981 1.00 0.00 O ATOM 68898 H1 WAT 9805 6.758 65.444 144.602 1.00 0.00 H ATOM 68899 H2 WAT 9805 7.277 65.789 143.223 1.00 0.00 H TER 68901 WAT 9805 ATOM 68901 O WAT 9806 133.344 36.259 94.785 1.00 0.00 O ATOM 68902 H1 WAT 9806 134.191 35.983 94.433 1.00 0.00 H ATOM 68903 H2 WAT 9806 133.226 37.149 94.454 1.00 0.00 H TER 68905 WAT 9806 ATOM 68905 O WAT 9807 137.517 13.665 112.157 1.00 0.00 O ATOM 68906 H1 WAT 9807 137.864 14.256 112.826 1.00 0.00 H ATOM 68907 H2 WAT 9807 136.634 13.454 112.459 1.00 0.00 H TER 68909 WAT 9807 ATOM 68909 O WAT 9808 38.344 84.356 0.109 1.00 0.00 O ATOM 68910 H1 WAT 9808 37.622 84.049 -0.439 1.00 0.00 H ATOM 68911 H2 WAT 9808 37.928 84.615 0.931 1.00 0.00 H TER 68913 WAT 9808 ATOM 68913 O WAT 9809 76.396 10.885 114.907 1.00 0.00 O ATOM 68914 H1 WAT 9809 77.227 10.471 114.673 1.00 0.00 H ATOM 68915 H2 WAT 9809 75.937 10.224 115.426 1.00 0.00 H TER 68917 WAT 9809 ATOM 68917 O WAT 9810 131.657 17.278 146.236 1.00 0.00 O ATOM 68918 H1 WAT 9810 131.214 17.027 147.047 1.00 0.00 H ATOM 68919 H2 WAT 9810 131.871 16.447 145.813 1.00 0.00 H TER 68921 WAT 9810 ATOM 68921 O WAT 9811 19.828 124.900 2.630 1.00 0.00 O ATOM 68922 H1 WAT 9811 20.447 124.228 2.915 1.00 0.00 H ATOM 68923 H2 WAT 9811 19.943 125.614 3.258 1.00 0.00 H TER 68925 WAT 9811 ATOM 68925 O WAT 9812 31.225 141.565 129.787 1.00 0.00 O ATOM 68926 H1 WAT 9812 32.060 141.219 129.471 1.00 0.00 H ATOM 68927 H2 WAT 9812 30.676 140.790 129.908 1.00 0.00 H TER 68929 WAT 9812 ATOM 68929 O WAT 9813 113.800 38.540 78.439 1.00 0.00 O ATOM 68930 H1 WAT 9813 112.849 38.534 78.329 1.00 0.00 H ATOM 68931 H2 WAT 9813 114.052 39.452 78.298 1.00 0.00 H TER 68933 WAT 9813 ATOM 68933 O WAT 9814 132.244 9.728 4.914 1.00 0.00 O ATOM 68934 H1 WAT 9814 131.634 9.031 4.672 1.00 0.00 H ATOM 68935 H2 WAT 9814 133.090 9.287 4.996 1.00 0.00 H TER 68937 WAT 9814 ATOM 68937 O WAT 9815 24.620 9.338 19.976 1.00 0.00 O ATOM 68938 H1 WAT 9815 24.143 8.528 20.153 1.00 0.00 H ATOM 68939 H2 WAT 9815 25.497 9.049 19.723 1.00 0.00 H TER 68941 WAT 9815 ATOM 68941 O WAT 9816 3.157 136.786 149.844 1.00 0.00 O ATOM 68942 H1 WAT 9816 3.651 136.493 149.078 1.00 0.00 H ATOM 68943 H2 WAT 9816 3.806 137.228 150.392 1.00 0.00 H TER 68945 WAT 9816 ATOM 68945 O WAT 9817 74.673 27.576 111.563 1.00 0.00 O ATOM 68946 H1 WAT 9817 75.348 27.890 112.163 1.00 0.00 H ATOM 68947 H2 WAT 9817 73.850 27.872 111.952 1.00 0.00 H TER 68949 WAT 9817 ATOM 68949 O WAT 9818 94.612 4.039 104.916 1.00 0.00 O ATOM 68950 H1 WAT 9818 94.279 4.367 104.080 1.00 0.00 H ATOM 68951 H2 WAT 9818 94.886 3.141 104.729 1.00 0.00 H TER 68953 WAT 9818 ATOM 68953 O WAT 9819 23.765 105.628 118.006 1.00 0.00 O ATOM 68954 H1 WAT 9819 23.443 105.185 117.221 1.00 0.00 H ATOM 68955 H2 WAT 9819 23.931 106.527 117.723 1.00 0.00 H TER 68957 WAT 9819 ATOM 68957 O WAT 9820 64.884 53.257 98.484 1.00 0.00 O ATOM 68958 H1 WAT 9820 65.506 53.774 97.971 1.00 0.00 H ATOM 68959 H2 WAT 9820 64.117 53.175 97.917 1.00 0.00 H TER 68961 WAT 9820 ATOM 68961 O WAT 9821 13.588 144.986 73.575 1.00 0.00 O ATOM 68962 H1 WAT 9821 13.645 145.507 72.774 1.00 0.00 H ATOM 68963 H2 WAT 9821 13.659 145.626 74.283 1.00 0.00 H TER 68965 WAT 9821 ATOM 68965 O WAT 9822 44.993 58.437 146.018 1.00 0.00 O ATOM 68966 H1 WAT 9822 45.821 58.631 145.579 1.00 0.00 H ATOM 68967 H2 WAT 9822 44.820 59.208 146.557 1.00 0.00 H TER 68969 WAT 9822 ATOM 68969 O WAT 9823 81.653 57.890 141.074 1.00 0.00 O ATOM 68970 H1 WAT 9823 81.678 58.801 141.365 1.00 0.00 H ATOM 68971 H2 WAT 9823 82.298 57.845 140.369 1.00 0.00 H TER 68973 WAT 9823 ATOM 68973 O WAT 9824 77.315 120.673 65.379 1.00 0.00 O ATOM 68974 H1 WAT 9824 77.871 120.412 64.644 1.00 0.00 H ATOM 68975 H2 WAT 9824 76.574 120.069 65.343 1.00 0.00 H TER 68977 WAT 9824 ATOM 68977 O WAT 9825 45.780 45.918 147.720 1.00 0.00 O ATOM 68978 H1 WAT 9825 46.018 46.313 146.881 1.00 0.00 H ATOM 68979 H2 WAT 9825 44.957 45.463 147.546 1.00 0.00 H TER 68981 WAT 9825 ATOM 68981 O WAT 9826 140.782 106.555 58.605 1.00 0.00 O ATOM 68982 H1 WAT 9826 140.369 106.241 57.801 1.00 0.00 H ATOM 68983 H2 WAT 9826 141.700 106.295 58.519 1.00 0.00 H TER 68985 WAT 9826 ATOM 68985 O WAT 9827 20.602 51.548 116.836 1.00 0.00 O ATOM 68986 H1 WAT 9827 20.959 51.433 115.955 1.00 0.00 H ATOM 68987 H2 WAT 9827 21.275 52.042 117.304 1.00 0.00 H TER 68989 WAT 9827 ATOM 68989 O WAT 9828 71.600 14.636 9.378 1.00 0.00 O ATOM 68990 H1 WAT 9828 70.960 13.963 9.610 1.00 0.00 H ATOM 68991 H2 WAT 9828 72.348 14.461 9.948 1.00 0.00 H TER 68993 WAT 9828 ATOM 68993 O WAT 9829 80.407 13.487 17.382 1.00 0.00 O ATOM 68994 H1 WAT 9829 81.227 13.056 17.623 1.00 0.00 H ATOM 68995 H2 WAT 9829 80.109 13.905 18.190 1.00 0.00 H TER 68997 WAT 9829 ATOM 68997 O WAT 9830 71.284 38.719 135.232 1.00 0.00 O ATOM 68998 H1 WAT 9830 71.405 37.866 135.649 1.00 0.00 H ATOM 68999 H2 WAT 9830 71.664 38.614 134.359 1.00 0.00 H TER 69001 WAT 9830 ATOM 69001 O WAT 9831 9.282 143.790 145.121 1.00 0.00 O ATOM 69002 H1 WAT 9831 9.050 142.904 144.845 1.00 0.00 H ATOM 69003 H2 WAT 9831 10.209 143.876 144.901 1.00 0.00 H TER 69005 WAT 9831 ATOM 69005 O WAT 9832 142.870 12.123 12.683 1.00 0.00 O ATOM 69006 H1 WAT 9832 142.102 12.692 12.638 1.00 0.00 H ATOM 69007 H2 WAT 9832 143.615 12.720 12.619 1.00 0.00 H TER 69009 WAT 9832 ATOM 69009 O WAT 9833 91.231 141.624 64.300 1.00 0.00 O ATOM 69010 H1 WAT 9833 91.363 142.511 63.965 1.00 0.00 H ATOM 69011 H2 WAT 9833 90.485 141.289 63.802 1.00 0.00 H TER 69013 WAT 9833 ATOM 69013 O WAT 9834 49.652 143.223 106.436 1.00 0.00 O ATOM 69014 H1 WAT 9834 49.997 142.347 106.265 1.00 0.00 H ATOM 69015 H2 WAT 9834 49.408 143.208 107.361 1.00 0.00 H TER 69017 WAT 9834 ATOM 69017 O WAT 9835 133.762 140.752 0.095 1.00 0.00 O ATOM 69018 H1 WAT 9835 134.532 141.269 0.330 1.00 0.00 H ATOM 69019 H2 WAT 9835 134.087 139.854 0.030 1.00 0.00 H TER 69021 WAT 9835 ATOM 69021 O WAT 9836 7.127 55.652 83.517 1.00 0.00 O ATOM 69022 H1 WAT 9836 6.726 54.783 83.544 1.00 0.00 H ATOM 69023 H2 WAT 9836 6.410 56.240 83.281 1.00 0.00 H TER 69025 WAT 9836 ATOM 69025 O WAT 9837 37.979 47.475 63.813 1.00 0.00 O ATOM 69026 H1 WAT 9837 38.364 48.155 63.260 1.00 0.00 H ATOM 69027 H2 WAT 9837 38.721 47.101 64.287 1.00 0.00 H TER 69029 WAT 9837 ATOM 69029 O WAT 9838 104.269 122.632 23.777 1.00 0.00 O ATOM 69030 H1 WAT 9838 104.746 123.356 24.184 1.00 0.00 H ATOM 69031 H2 WAT 9838 104.950 122.095 23.371 1.00 0.00 H TER 69033 WAT 9838 ATOM 69033 O WAT 9839 86.364 87.094 108.287 1.00 0.00 O ATOM 69034 H1 WAT 9839 85.533 87.018 108.757 1.00 0.00 H ATOM 69035 H2 WAT 9839 86.743 86.216 108.328 1.00 0.00 H TER 69037 WAT 9839 ATOM 69037 O WAT 9840 47.248 121.174 98.428 1.00 0.00 O ATOM 69038 H1 WAT 9840 47.876 120.983 99.125 1.00 0.00 H ATOM 69039 H2 WAT 9840 46.394 121.138 98.859 1.00 0.00 H TER 69041 WAT 9840 ATOM 69041 O WAT 9841 120.149 52.265 128.169 1.00 0.00 O ATOM 69042 H1 WAT 9841 120.982 51.969 128.536 1.00 0.00 H ATOM 69043 H2 WAT 9841 119.731 52.747 128.883 1.00 0.00 H TER 69045 WAT 9841 ATOM 69045 O WAT 9842 73.647 15.726 99.928 1.00 0.00 O ATOM 69046 H1 WAT 9842 73.074 15.219 99.352 1.00 0.00 H ATOM 69047 H2 WAT 9842 73.516 16.635 99.657 1.00 0.00 H TER 69049 WAT 9842 ATOM 69049 O WAT 9843 29.478 99.559 143.084 1.00 0.00 O ATOM 69050 H1 WAT 9843 29.157 100.385 143.444 1.00 0.00 H ATOM 69051 H2 WAT 9843 30.194 99.813 142.501 1.00 0.00 H TER 69053 WAT 9843 ATOM 69053 O WAT 9844 58.880 79.328 24.286 1.00 0.00 O ATOM 69054 H1 WAT 9844 59.395 78.598 24.630 1.00 0.00 H ATOM 69055 H2 WAT 9844 58.103 78.916 23.908 1.00 0.00 H TER 69057 WAT 9844 ATOM 69057 O WAT 9845 18.782 16.039 65.512 1.00 0.00 O ATOM 69058 H1 WAT 9845 18.520 16.167 64.600 1.00 0.00 H ATOM 69059 H2 WAT 9845 18.066 16.418 66.022 1.00 0.00 H TER 69061 WAT 9845 ATOM 69061 O WAT 9846 37.698 137.951 115.907 1.00 0.00 O ATOM 69062 H1 WAT 9846 37.177 137.702 116.670 1.00 0.00 H ATOM 69063 H2 WAT 9846 37.574 137.232 115.287 1.00 0.00 H TER 69065 WAT 9846 ATOM 69065 O WAT 9847 7.993 141.215 74.858 1.00 0.00 O ATOM 69066 H1 WAT 9847 8.270 141.959 74.322 1.00 0.00 H ATOM 69067 H2 WAT 9847 8.624 141.191 75.578 1.00 0.00 H TER 69069 WAT 9847 ATOM 69069 O WAT 9848 32.129 88.786 78.100 1.00 0.00 O ATOM 69070 H1 WAT 9848 31.978 88.806 79.045 1.00 0.00 H ATOM 69071 H2 WAT 9848 31.559 88.087 77.781 1.00 0.00 H TER 69073 WAT 9848 ATOM 69073 O WAT 9849 24.456 63.066 14.051 1.00 0.00 O ATOM 69074 H1 WAT 9849 24.880 63.620 13.395 1.00 0.00 H ATOM 69075 H2 WAT 9849 24.572 63.538 14.875 1.00 0.00 H TER 69077 WAT 9849 ATOM 69077 O WAT 9850 93.737 112.456 66.589 1.00 0.00 O ATOM 69078 H1 WAT 9850 94.353 112.662 65.886 1.00 0.00 H ATOM 69079 H2 WAT 9850 92.961 112.125 66.138 1.00 0.00 H TER 69081 WAT 9850 ATOM 69081 O WAT 9851 82.738 89.900 23.680 1.00 0.00 O ATOM 69082 H1 WAT 9851 82.806 89.018 23.316 1.00 0.00 H ATOM 69083 H2 WAT 9851 82.467 89.765 24.588 1.00 0.00 H TER 69085 WAT 9851 ATOM 69085 O WAT 9852 63.953 121.735 133.440 1.00 0.00 O ATOM 69086 H1 WAT 9852 63.013 121.704 133.264 1.00 0.00 H ATOM 69087 H2 WAT 9852 64.124 122.649 133.669 1.00 0.00 H TER 69089 WAT 9852 ATOM 69089 O WAT 9853 99.719 119.408 144.772 1.00 0.00 O ATOM 69090 H1 WAT 9853 99.646 120.344 144.958 1.00 0.00 H ATOM 69091 H2 WAT 9853 100.553 119.319 144.311 1.00 0.00 H TER 69093 WAT 9853 ATOM 69093 O WAT 9854 143.977 87.417 14.496 1.00 0.00 O ATOM 69094 H1 WAT 9854 143.107 87.815 14.516 1.00 0.00 H ATOM 69095 H2 WAT 9854 144.064 87.076 13.605 1.00 0.00 H TER 69097 WAT 9854 ATOM 69097 O WAT 9855 63.348 0.252 135.698 1.00 0.00 O ATOM 69098 H1 WAT 9855 62.874 0.893 135.168 1.00 0.00 H ATOM 69099 H2 WAT 9855 62.687 -0.398 135.934 1.00 0.00 H TER 69101 WAT 9855 ATOM 69101 O WAT 9856 68.418 20.013 0.859 1.00 0.00 O ATOM 69102 H1 WAT 9856 69.081 20.583 1.248 1.00 0.00 H ATOM 69103 H2 WAT 9856 68.651 19.973 -0.069 1.00 0.00 H TER 69105 WAT 9856 ATOM 69105 O WAT 9857 76.789 54.233 150.539 1.00 0.00 O ATOM 69106 H1 WAT 9857 77.343 53.705 149.963 1.00 0.00 H ATOM 69107 H2 WAT 9857 77.392 54.854 150.947 1.00 0.00 H TER 69109 WAT 9857 ATOM 69109 O WAT 9858 102.856 94.484 5.508 1.00 0.00 O ATOM 69110 H1 WAT 9858 103.520 93.883 5.847 1.00 0.00 H ATOM 69111 H2 WAT 9858 103.067 95.326 5.913 1.00 0.00 H TER 69113 WAT 9858 ATOM 69113 O WAT 9859 96.600 1.923 145.014 1.00 0.00 O ATOM 69114 H1 WAT 9859 95.778 2.301 144.702 1.00 0.00 H ATOM 69115 H2 WAT 9859 97.268 2.288 144.433 1.00 0.00 H TER 69117 WAT 9859 ATOM 69117 O WAT 9860 140.476 99.255 127.774 1.00 0.00 O ATOM 69118 H1 WAT 9860 141.354 99.168 128.144 1.00 0.00 H ATOM 69119 H2 WAT 9860 140.622 99.550 126.876 1.00 0.00 H TER 69121 WAT 9860 ATOM 69121 O WAT 9861 37.890 91.659 128.636 1.00 0.00 O ATOM 69122 H1 WAT 9861 38.222 90.837 128.276 1.00 0.00 H ATOM 69123 H2 WAT 9861 38.590 91.969 129.211 1.00 0.00 H TER 69125 WAT 9861 ATOM 69125 O WAT 9862 90.571 59.149 103.002 1.00 0.00 O ATOM 69126 H1 WAT 9862 90.656 59.425 103.915 1.00 0.00 H ATOM 69127 H2 WAT 9862 90.613 58.193 103.036 1.00 0.00 H TER 69129 WAT 9862 ATOM 69129 O WAT 9863 61.536 42.072 62.331 1.00 0.00 O ATOM 69130 H1 WAT 9863 60.647 41.815 62.576 1.00 0.00 H ATOM 69131 H2 WAT 9863 61.640 41.748 61.436 1.00 0.00 H TER 69133 WAT 9863 ATOM 69133 O WAT 9864 34.132 56.787 63.332 1.00 0.00 O ATOM 69134 H1 WAT 9864 33.766 57.671 63.362 1.00 0.00 H ATOM 69135 H2 WAT 9864 34.000 56.443 64.215 1.00 0.00 H TER 69137 WAT 9864 ATOM 69137 O WAT 9865 73.053 45.396 152.318 1.00 0.00 O ATOM 69138 H1 WAT 9865 73.112 46.344 152.194 1.00 0.00 H ATOM 69139 H2 WAT 9865 73.675 45.033 151.688 1.00 0.00 H TER 69141 WAT 9865 ATOM 69141 O WAT 9866 101.121 84.041 82.566 1.00 0.00 O ATOM 69142 H1 WAT 9866 100.981 84.503 83.393 1.00 0.00 H ATOM 69143 H2 WAT 9866 100.580 84.514 81.933 1.00 0.00 H TER 69145 WAT 9866 ATOM 69145 O WAT 9867 80.256 50.393 116.481 1.00 0.00 O ATOM 69146 H1 WAT 9867 81.090 49.928 116.553 1.00 0.00 H ATOM 69147 H2 WAT 9867 80.399 51.036 115.786 1.00 0.00 H TER 69149 WAT 9867 ATOM 69149 O WAT 9868 84.505 29.638 57.602 1.00 0.00 O ATOM 69150 H1 WAT 9868 85.099 30.253 58.032 1.00 0.00 H ATOM 69151 H2 WAT 9868 83.636 30.021 57.721 1.00 0.00 H TER 69153 WAT 9868 ATOM 69153 O WAT 9869 129.532 22.564 12.724 1.00 0.00 O ATOM 69154 H1 WAT 9869 129.292 22.879 13.595 1.00 0.00 H ATOM 69155 H2 WAT 9869 128.695 22.439 12.276 1.00 0.00 H TER 69157 WAT 9869 ATOM 69157 O WAT 9870 26.144 142.124 83.629 1.00 0.00 O ATOM 69158 H1 WAT 9870 25.765 141.870 84.471 1.00 0.00 H ATOM 69159 H2 WAT 9870 27.076 142.243 83.812 1.00 0.00 H TER 69161 WAT 9870 ATOM 69161 O WAT 9871 120.841 120.304 153.361 1.00 0.00 O ATOM 69162 H1 WAT 9871 121.250 120.996 153.881 1.00 0.00 H ATOM 69163 H2 WAT 9871 120.108 120.736 152.922 1.00 0.00 H TER 69165 WAT 9871 ATOM 69165 O WAT 9872 90.730 80.851 14.900 1.00 0.00 O ATOM 69166 H1 WAT 9872 89.895 80.453 14.655 1.00 0.00 H ATOM 69167 H2 WAT 9872 90.866 81.542 14.252 1.00 0.00 H TER 69169 WAT 9872 ATOM 69169 O WAT 9873 132.381 45.384 145.484 1.00 0.00 O ATOM 69170 H1 WAT 9873 131.534 45.788 145.295 1.00 0.00 H ATOM 69171 H2 WAT 9873 132.619 44.935 144.673 1.00 0.00 H TER 69173 WAT 9873 ATOM 69173 O WAT 9874 126.853 59.473 118.587 1.00 0.00 O ATOM 69174 H1 WAT 9874 125.972 59.801 118.765 1.00 0.00 H ATOM 69175 H2 WAT 9874 126.846 58.574 118.915 1.00 0.00 H TER 69177 WAT 9874 ATOM 69177 O WAT 9875 91.942 111.488 146.720 1.00 0.00 O ATOM 69178 H1 WAT 9875 92.067 112.412 146.933 1.00 0.00 H ATOM 69179 H2 WAT 9875 91.033 111.307 146.960 1.00 0.00 H TER 69181 WAT 9875 ATOM 69181 O WAT 9876 116.764 12.794 110.704 1.00 0.00 O ATOM 69182 H1 WAT 9876 117.354 13.250 111.305 1.00 0.00 H ATOM 69183 H2 WAT 9876 116.821 13.292 109.889 1.00 0.00 H TER 69185 WAT 9876 ATOM 69185 O WAT 9877 49.103 4.850 122.486 1.00 0.00 O ATOM 69186 H1 WAT 9877 48.408 4.899 123.142 1.00 0.00 H ATOM 69187 H2 WAT 9877 49.644 5.622 122.651 1.00 0.00 H TER 69189 WAT 9877 ATOM 69189 O WAT 9878 46.879 126.544 124.877 1.00 0.00 O ATOM 69190 H1 WAT 9878 46.461 127.207 124.327 1.00 0.00 H ATOM 69191 H2 WAT 9878 46.714 125.718 124.423 1.00 0.00 H TER 69193 WAT 9878 ATOM 69193 O WAT 9879 23.038 76.045 132.897 1.00 0.00 O ATOM 69194 H1 WAT 9879 23.159 76.855 133.393 1.00 0.00 H ATOM 69195 H2 WAT 9879 23.891 75.612 132.934 1.00 0.00 H TER 69197 WAT 9879 ATOM 69197 O WAT 9880 132.581 144.343 97.585 1.00 0.00 O ATOM 69198 H1 WAT 9880 132.261 143.956 96.770 1.00 0.00 H ATOM 69199 H2 WAT 9880 131.905 144.136 98.230 1.00 0.00 H TER 69201 WAT 9880 ATOM 69201 O WAT 9881 93.862 66.231 152.622 1.00 0.00 O ATOM 69202 H1 WAT 9881 93.477 65.381 152.832 1.00 0.00 H ATOM 69203 H2 WAT 9881 93.329 66.565 151.900 1.00 0.00 H TER 69205 WAT 9881 ATOM 69205 O WAT 9882 10.978 65.308 123.985 1.00 0.00 O ATOM 69206 H1 WAT 9882 10.081 65.286 123.652 1.00 0.00 H ATOM 69207 H2 WAT 9882 11.524 65.182 123.209 1.00 0.00 H TER 69209 WAT 9882 ATOM 69209 O WAT 9883 143.103 46.822 8.081 1.00 0.00 O ATOM 69210 H1 WAT 9883 143.345 46.354 8.881 1.00 0.00 H ATOM 69211 H2 WAT 9883 143.938 47.012 7.653 1.00 0.00 H TER 69213 WAT 9883 ATOM 69213 O WAT 9884 6.848 71.156 80.695 1.00 0.00 O ATOM 69214 H1 WAT 9884 7.689 71.167 80.239 1.00 0.00 H ATOM 69215 H2 WAT 9884 6.196 71.190 79.995 1.00 0.00 H TER 69217 WAT 9884 ATOM 69217 O WAT 9885 86.737 25.343 97.798 1.00 0.00 O ATOM 69218 H1 WAT 9885 86.258 24.629 97.378 1.00 0.00 H ATOM 69219 H2 WAT 9885 86.578 25.220 98.734 1.00 0.00 H TER 69221 WAT 9885 ATOM 69221 O WAT 9886 57.892 96.344 137.307 1.00 0.00 O ATOM 69222 H1 WAT 9886 58.580 96.474 136.654 1.00 0.00 H ATOM 69223 H2 WAT 9886 57.084 96.591 136.857 1.00 0.00 H TER 69225 WAT 9886 ATOM 69225 O WAT 9887 80.965 135.541 71.590 1.00 0.00 O ATOM 69226 H1 WAT 9887 80.692 136.122 72.301 1.00 0.00 H ATOM 69227 H2 WAT 9887 80.281 135.635 70.928 1.00 0.00 H TER 69229 WAT 9887 ATOM 69229 O WAT 9888 76.324 35.644 97.493 1.00 0.00 O ATOM 69230 H1 WAT 9888 75.454 36.023 97.624 1.00 0.00 H ATOM 69231 H2 WAT 9888 76.898 36.161 98.058 1.00 0.00 H TER 69233 WAT 9888 ATOM 69233 O WAT 9889 62.593 2.920 85.696 1.00 0.00 O ATOM 69234 H1 WAT 9889 62.984 2.193 86.180 1.00 0.00 H ATOM 69235 H2 WAT 9889 62.017 2.501 85.057 1.00 0.00 H TER 69237 WAT 9889 ATOM 69237 O WAT 9890 22.007 136.378 140.069 1.00 0.00 O ATOM 69238 H1 WAT 9890 21.692 136.424 140.972 1.00 0.00 H ATOM 69239 H2 WAT 9890 21.409 136.942 139.578 1.00 0.00 H TER 69241 WAT 9890 ATOM 69241 O WAT 9891 95.581 127.017 81.774 1.00 0.00 O ATOM 69242 H1 WAT 9891 94.801 127.443 82.127 1.00 0.00 H ATOM 69243 H2 WAT 9891 96.285 127.274 82.369 1.00 0.00 H TER 69245 WAT 9891 ATOM 69245 O WAT 9892 127.385 126.222 7.361 1.00 0.00 O ATOM 69246 H1 WAT 9892 126.570 125.728 7.447 1.00 0.00 H ATOM 69247 H2 WAT 9892 127.542 126.579 8.235 1.00 0.00 H TER 69249 WAT 9892 ATOM 69249 O WAT 9893 6.728 107.911 26.392 1.00 0.00 O ATOM 69250 H1 WAT 9893 7.358 107.697 27.081 1.00 0.00 H ATOM 69251 H2 WAT 9893 5.879 107.910 26.836 1.00 0.00 H TER 69253 WAT 9893 ATOM 69253 O WAT 9894 82.956 108.490 83.355 1.00 0.00 O ATOM 69254 H1 WAT 9894 82.255 107.900 83.634 1.00 0.00 H ATOM 69255 H2 WAT 9894 82.588 108.963 82.609 1.00 0.00 H TER 69257 WAT 9894 ATOM 69257 O WAT 9895 1.704 103.695 112.719 1.00 0.00 O ATOM 69258 H1 WAT 9895 2.054 104.580 112.827 1.00 0.00 H ATOM 69259 H2 WAT 9895 2.203 103.162 113.337 1.00 0.00 H TER 69261 WAT 9895 ATOM 69261 O WAT 9896 75.541 95.068 68.841 1.00 0.00 O ATOM 69262 H1 WAT 9896 76.418 95.417 68.999 1.00 0.00 H ATOM 69263 H2 WAT 9896 75.315 94.611 69.652 1.00 0.00 H TER 69265 WAT 9896 ATOM 69265 O WAT 9897 143.545 10.673 91.883 1.00 0.00 O ATOM 69266 H1 WAT 9897 143.554 10.777 90.931 1.00 0.00 H ATOM 69267 H2 WAT 9897 142.887 9.996 92.043 1.00 0.00 H TER 69269 WAT 9897 ATOM 69269 O WAT 9898 115.972 110.520 15.494 1.00 0.00 O ATOM 69270 H1 WAT 9898 115.861 110.204 16.391 1.00 0.00 H ATOM 69271 H2 WAT 9898 115.594 109.831 14.948 1.00 0.00 H TER 69273 WAT 9898 ATOM 69273 O WAT 9899 67.091 6.634 134.028 1.00 0.00 O ATOM 69274 H1 WAT 9899 67.482 7.443 134.357 1.00 0.00 H ATOM 69275 H2 WAT 9899 66.152 6.742 134.181 1.00 0.00 H TER 69277 WAT 9899 ATOM 69277 O WAT 9900 48.258 37.089 126.102 1.00 0.00 O ATOM 69278 H1 WAT 9900 47.486 37.389 125.622 1.00 0.00 H ATOM 69279 H2 WAT 9900 48.960 37.089 125.451 1.00 0.00 H TER 69281 WAT 9900 ATOM 69281 O WAT 9901 77.939 121.884 146.765 1.00 0.00 O ATOM 69282 H1 WAT 9901 78.661 121.306 147.010 1.00 0.00 H ATOM 69283 H2 WAT 9901 77.735 121.644 145.861 1.00 0.00 H TER 69285 WAT 9901 ATOM 69285 O WAT 9902 3.920 139.016 114.002 1.00 0.00 O ATOM 69286 H1 WAT 9902 3.916 138.069 113.866 1.00 0.00 H ATOM 69287 H2 WAT 9902 3.626 139.130 114.906 1.00 0.00 H TER 69289 WAT 9902 ATOM 69289 O WAT 9903 105.561 59.082 140.732 1.00 0.00 O ATOM 69290 H1 WAT 9903 105.383 60.020 140.657 1.00 0.00 H ATOM 69291 H2 WAT 9903 104.928 58.670 140.143 1.00 0.00 H TER 69293 WAT 9903 ATOM 69293 O WAT 9904 94.794 59.211 83.599 1.00 0.00 O ATOM 69294 H1 WAT 9904 93.918 58.992 83.918 1.00 0.00 H ATOM 69295 H2 WAT 9904 94.820 58.855 82.711 1.00 0.00 H TER 69297 WAT 9904 ATOM 69297 O WAT 9905 13.358 65.919 59.412 1.00 0.00 O ATOM 69298 H1 WAT 9905 14.050 66.350 58.911 1.00 0.00 H ATOM 69299 H2 WAT 9905 12.556 66.374 59.155 1.00 0.00 H TER 69301 WAT 9905 ATOM 69301 O WAT 9906 12.636 141.541 153.056 1.00 0.00 O ATOM 69302 H1 WAT 9906 13.437 141.429 152.542 1.00 0.00 H ATOM 69303 H2 WAT 9906 12.326 142.417 152.828 1.00 0.00 H TER 69305 WAT 9906 ATOM 69305 O WAT 9907 80.613 6.583 115.570 1.00 0.00 O ATOM 69306 H1 WAT 9907 80.394 5.716 115.912 1.00 0.00 H ATOM 69307 H2 WAT 9907 79.853 6.831 115.044 1.00 0.00 H TER 69309 WAT 9907 ATOM 69309 O WAT 9908 51.492 99.772 73.183 1.00 0.00 O ATOM 69310 H1 WAT 9908 51.735 98.976 73.656 1.00 0.00 H ATOM 69311 H2 WAT 9908 51.044 100.311 73.834 1.00 0.00 H TER 69313 WAT 9908 ATOM 69313 O WAT 9909 2.261 6.413 67.556 1.00 0.00 O ATOM 69314 H1 WAT 9909 2.954 5.774 67.722 1.00 0.00 H ATOM 69315 H2 WAT 9909 2.678 7.262 67.705 1.00 0.00 H TER 69317 WAT 9909 ATOM 69317 O WAT 9910 44.595 1.448 102.807 1.00 0.00 O ATOM 69318 H1 WAT 9910 44.981 0.943 103.522 1.00 0.00 H ATOM 69319 H2 WAT 9910 44.854 0.979 102.014 1.00 0.00 H TER 69321 WAT 9910 ATOM 69321 O WAT 9911 109.147 67.688 122.071 1.00 0.00 O ATOM 69322 H1 WAT 9911 108.757 68.255 121.405 1.00 0.00 H ATOM 69323 H2 WAT 9911 108.494 67.003 122.215 1.00 0.00 H TER 69325 WAT 9911 ATOM 69325 O WAT 9912 88.395 99.399 146.622 1.00 0.00 O ATOM 69326 H1 WAT 9912 88.660 99.440 147.541 1.00 0.00 H ATOM 69327 H2 WAT 9912 87.608 98.854 146.624 1.00 0.00 H TER 69329 WAT 9912 ATOM 69329 O WAT 9913 88.471 88.117 152.637 1.00 0.00 O ATOM 69330 H1 WAT 9913 88.940 87.609 151.975 1.00 0.00 H ATOM 69331 H2 WAT 9913 87.782 88.569 152.150 1.00 0.00 H TER 69333 WAT 9913 ATOM 69333 O WAT 9914 79.666 30.668 6.212 1.00 0.00 O ATOM 69334 H1 WAT 9914 78.990 30.175 5.746 1.00 0.00 H ATOM 69335 H2 WAT 9914 80.457 30.545 5.687 1.00 0.00 H TER 69337 WAT 9914 ATOM 69337 O WAT 9915 15.204 83.326 1.637 1.00 0.00 O ATOM 69338 H1 WAT 9915 16.014 83.280 1.130 1.00 0.00 H ATOM 69339 H2 WAT 9915 14.539 83.592 1.003 1.00 0.00 H TER 69341 WAT 9915 ATOM 69341 O WAT 9916 88.620 84.716 104.809 1.00 0.00 O ATOM 69342 H1 WAT 9916 88.224 84.959 103.971 1.00 0.00 H ATOM 69343 H2 WAT 9916 89.172 83.962 104.603 1.00 0.00 H TER 69345 WAT 9916 ATOM 69345 O WAT 9917 107.429 128.375 151.714 1.00 0.00 O ATOM 69346 H1 WAT 9917 107.605 128.748 152.578 1.00 0.00 H ATOM 69347 H2 WAT 9917 106.610 128.786 151.437 1.00 0.00 H TER 69349 WAT 9917 ATOM 69349 O WAT 9918 52.380 83.981 137.093 1.00 0.00 O ATOM 69350 H1 WAT 9918 53.205 83.525 137.265 1.00 0.00 H ATOM 69351 H2 WAT 9918 52.099 83.653 136.239 1.00 0.00 H TER 69353 WAT 9918 ATOM 69353 O WAT 9919 126.824 36.638 85.317 1.00 0.00 O ATOM 69354 H1 WAT 9919 127.171 36.783 84.437 1.00 0.00 H ATOM 69355 H2 WAT 9919 126.924 37.483 85.756 1.00 0.00 H TER 69357 WAT 9919 ATOM 69357 O WAT 9920 6.914 41.029 110.901 1.00 0.00 O ATOM 69358 H1 WAT 9920 7.776 40.776 110.569 1.00 0.00 H ATOM 69359 H2 WAT 9920 6.985 41.971 111.056 1.00 0.00 H TER 69361 WAT 9920 ATOM 69361 O WAT 9921 0.728 99.709 79.547 1.00 0.00 O ATOM 69362 H1 WAT 9921 -0.200 99.722 79.778 1.00 0.00 H ATOM 69363 H2 WAT 9921 1.151 100.236 80.224 1.00 0.00 H TER 69365 WAT 9921 ATOM 69365 O WAT 9922 127.791 16.451 6.865 1.00 0.00 O ATOM 69366 H1 WAT 9922 127.072 16.179 7.435 1.00 0.00 H ATOM 69367 H2 WAT 9922 127.660 15.951 6.059 1.00 0.00 H TER 69369 WAT 9922 ATOM 69369 O WAT 9923 42.483 114.001 2.181 1.00 0.00 O ATOM 69370 H1 WAT 9923 41.769 114.571 2.469 1.00 0.00 H ATOM 69371 H2 WAT 9923 42.619 114.234 1.263 1.00 0.00 H TER 69373 WAT 9923 ATOM 69373 O WAT 9924 84.678 106.359 15.497 1.00 0.00 O ATOM 69374 H1 WAT 9924 85.186 106.032 16.239 1.00 0.00 H ATOM 69375 H2 WAT 9924 84.923 105.788 14.768 1.00 0.00 H TER 69377 WAT 9924 ATOM 69377 O WAT 9925 0.550 88.898 11.642 1.00 0.00 O ATOM 69378 H1 WAT 9925 -0.058 88.171 11.506 1.00 0.00 H ATOM 69379 H2 WAT 9925 0.456 89.117 12.569 1.00 0.00 H TER 69381 WAT 9925 ATOM 69381 O WAT 9926 98.496 96.535 7.265 1.00 0.00 O ATOM 69382 H1 WAT 9926 98.396 95.663 6.882 1.00 0.00 H ATOM 69383 H2 WAT 9926 98.450 96.388 8.210 1.00 0.00 H TER 69385 WAT 9926 ATOM 69385 O WAT 9927 81.199 95.368 132.660 1.00 0.00 O ATOM 69386 H1 WAT 9927 80.828 94.534 132.948 1.00 0.00 H ATOM 69387 H2 WAT 9927 81.429 95.821 133.471 1.00 0.00 H TER 69389 WAT 9927 ATOM 69389 O WAT 9928 6.500 56.047 117.670 1.00 0.00 O ATOM 69390 H1 WAT 9928 6.745 55.210 118.065 1.00 0.00 H ATOM 69391 H2 WAT 9928 6.205 56.582 118.407 1.00 0.00 H TER 69393 WAT 9928 ATOM 69393 O WAT 9929 114.060 80.744 14.562 1.00 0.00 O ATOM 69394 H1 WAT 9929 113.653 80.309 15.311 1.00 0.00 H ATOM 69395 H2 WAT 9929 113.697 81.629 14.572 1.00 0.00 H TER 69397 WAT 9929 ATOM 69397 O WAT 9930 78.917 130.235 140.080 1.00 0.00 O ATOM 69398 H1 WAT 9930 79.743 130.328 140.555 1.00 0.00 H ATOM 69399 H2 WAT 9930 78.320 130.843 140.516 1.00 0.00 H TER 69401 WAT 9930 ATOM 69401 O WAT 9931 55.961 92.849 135.287 1.00 0.00 O ATOM 69402 H1 WAT 9931 56.315 92.644 136.153 1.00 0.00 H ATOM 69403 H2 WAT 9931 55.308 93.529 135.451 1.00 0.00 H TER 69405 WAT 9931 ATOM 69405 O WAT 9932 113.897 136.189 144.352 1.00 0.00 O ATOM 69406 H1 WAT 9932 114.537 136.491 144.997 1.00 0.00 H ATOM 69407 H2 WAT 9932 114.040 135.244 144.298 1.00 0.00 H TER 69409 WAT 9932 ATOM 69409 O WAT 9933 125.506 145.141 97.608 1.00 0.00 O ATOM 69410 H1 WAT 9933 124.603 144.866 97.767 1.00 0.00 H ATOM 69411 H2 WAT 9933 125.578 145.188 96.655 1.00 0.00 H TER 69413 WAT 9933 ATOM 69413 O WAT 9934 76.341 57.657 78.188 1.00 0.00 O ATOM 69414 H1 WAT 9934 76.489 57.445 77.267 1.00 0.00 H ATOM 69415 H2 WAT 9934 76.123 58.589 78.187 1.00 0.00 H TER 69417 WAT 9934 ATOM 69417 O WAT 9935 1.384 60.770 107.172 1.00 0.00 O ATOM 69418 H1 WAT 9935 1.117 61.023 108.056 1.00 0.00 H ATOM 69419 H2 WAT 9935 1.099 61.497 106.619 1.00 0.00 H TER 69421 WAT 9935 ATOM 69421 O WAT 9936 143.236 95.709 120.286 1.00 0.00 O ATOM 69422 H1 WAT 9936 143.953 95.106 120.087 1.00 0.00 H ATOM 69423 H2 WAT 9936 143.220 96.315 119.545 1.00 0.00 H TER 69425 WAT 9936 ATOM 69425 O WAT 9937 34.700 93.896 78.155 1.00 0.00 O ATOM 69426 H1 WAT 9937 34.936 94.515 77.464 1.00 0.00 H ATOM 69427 H2 WAT 9937 35.354 94.041 78.840 1.00 0.00 H TER 69429 WAT 9937 ATOM 69429 O WAT 9938 36.473 55.481 117.080 1.00 0.00 O ATOM 69430 H1 WAT 9938 36.583 54.563 116.832 1.00 0.00 H ATOM 69431 H2 WAT 9938 37.343 55.757 117.368 1.00 0.00 H TER 69433 WAT 9938 ATOM 69433 O WAT 9939 89.180 39.757 118.871 1.00 0.00 O ATOM 69434 H1 WAT 9939 89.444 40.206 118.068 1.00 0.00 H ATOM 69435 H2 WAT 9939 89.980 39.334 119.183 1.00 0.00 H TER 69437 WAT 9939 ATOM 69437 O WAT 9940 20.811 41.948 139.413 1.00 0.00 O ATOM 69438 H1 WAT 9940 20.039 41.681 138.915 1.00 0.00 H ATOM 69439 H2 WAT 9940 21.025 41.184 139.949 1.00 0.00 H TER 69441 WAT 9940 ATOM 69441 O WAT 9941 26.845 102.588 83.729 1.00 0.00 O ATOM 69442 H1 WAT 9941 25.897 102.622 83.859 1.00 0.00 H ATOM 69443 H2 WAT 9941 26.952 102.333 82.813 1.00 0.00 H TER 69445 WAT 9941 ATOM 69445 O WAT 9942 2.569 122.429 0.803 1.00 0.00 O ATOM 69446 H1 WAT 9942 2.076 121.651 0.544 1.00 0.00 H ATOM 69447 H2 WAT 9942 2.006 122.867 1.442 1.00 0.00 H TER 69449 WAT 9942 ATOM 69449 O WAT 9943 23.998 82.510 96.513 1.00 0.00 O ATOM 69450 H1 WAT 9943 24.111 81.961 97.289 1.00 0.00 H ATOM 69451 H2 WAT 9943 24.323 81.974 95.790 1.00 0.00 H TER 69453 WAT 9943 ATOM 69453 O WAT 9944 71.990 133.531 0.426 1.00 0.00 O ATOM 69454 H1 WAT 9944 71.872 133.878 -0.458 1.00 0.00 H ATOM 69455 H2 WAT 9944 72.816 133.911 0.725 1.00 0.00 H TER 69457 WAT 9944 ATOM 69457 O WAT 9945 87.901 83.388 70.755 1.00 0.00 O ATOM 69458 H1 WAT 9945 87.331 82.881 71.333 1.00 0.00 H ATOM 69459 H2 WAT 9945 88.348 84.002 71.337 1.00 0.00 H TER 69461 WAT 9945 ATOM 69461 O WAT 9946 144.878 29.603 113.850 1.00 0.00 O ATOM 69462 H1 WAT 9946 144.810 29.109 113.033 1.00 0.00 H ATOM 69463 H2 WAT 9946 143.999 29.562 114.228 1.00 0.00 H TER 69465 WAT 9946 ATOM 69465 O WAT 9947 94.081 54.708 136.417 1.00 0.00 O ATOM 69466 H1 WAT 9947 94.460 54.693 137.296 1.00 0.00 H ATOM 69467 H2 WAT 9947 93.146 54.856 136.562 1.00 0.00 H TER 69469 WAT 9947 ATOM 69469 O WAT 9948 21.200 38.116 98.880 1.00 0.00 O ATOM 69470 H1 WAT 9948 21.528 37.898 99.752 1.00 0.00 H ATOM 69471 H2 WAT 9948 21.774 37.639 98.282 1.00 0.00 H TER 69473 WAT 9948 ATOM 69473 O WAT 9949 6.530 8.195 20.149 1.00 0.00 O ATOM 69474 H1 WAT 9949 6.006 7.704 19.515 1.00 0.00 H ATOM 69475 H2 WAT 9949 7.159 7.557 20.485 1.00 0.00 H TER 69477 WAT 9949 ATOM 69477 O WAT 9950 124.269 68.314 99.243 1.00 0.00 O ATOM 69478 H1 WAT 9950 124.412 67.510 99.742 1.00 0.00 H ATOM 69479 H2 WAT 9950 125.145 68.584 98.967 1.00 0.00 H TER 69481 WAT 9950 ATOM 69481 O WAT 9951 59.003 25.866 123.910 1.00 0.00 O ATOM 69482 H1 WAT 9951 59.312 26.270 124.720 1.00 0.00 H ATOM 69483 H2 WAT 9951 59.800 25.575 123.467 1.00 0.00 H TER 69485 WAT 9951 ATOM 69485 O WAT 9952 16.087 112.512 89.057 1.00 0.00 O ATOM 69486 H1 WAT 9952 15.696 111.809 89.576 1.00 0.00 H ATOM 69487 H2 WAT 9952 15.730 113.315 89.435 1.00 0.00 H TER 69489 WAT 9952 ATOM 69489 O WAT 9953 138.165 103.151 30.586 1.00 0.00 O ATOM 69490 H1 WAT 9953 137.923 102.449 29.982 1.00 0.00 H ATOM 69491 H2 WAT 9953 137.414 103.229 31.175 1.00 0.00 H TER 69493 WAT 9953 ATOM 69493 O WAT 9954 72.952 71.113 81.403 1.00 0.00 O ATOM 69494 H1 WAT 9954 73.899 71.235 81.328 1.00 0.00 H ATOM 69495 H2 WAT 9954 72.581 71.963 81.167 1.00 0.00 H TER 69497 WAT 9954 ATOM 69497 O WAT 9955 11.770 50.699 100.719 1.00 0.00 O ATOM 69498 H1 WAT 9955 12.571 50.828 101.226 1.00 0.00 H ATOM 69499 H2 WAT 9955 11.732 49.755 100.565 1.00 0.00 H TER 69501 WAT 9955 ATOM 69501 O WAT 9956 5.766 69.060 155.071 1.00 0.00 O ATOM 69502 H1 WAT 9956 5.658 69.401 154.183 1.00 0.00 H ATOM 69503 H2 WAT 9956 6.297 69.720 155.517 1.00 0.00 H TER 69505 WAT 9956 ATOM 69505 O WAT 9957 86.218 131.125 135.020 1.00 0.00 O ATOM 69506 H1 WAT 9957 87.033 130.624 134.990 1.00 0.00 H ATOM 69507 H2 WAT 9957 86.274 131.719 134.271 1.00 0.00 H TER 69509 WAT 9957 ATOM 69509 O WAT 9958 56.192 74.500 138.005 1.00 0.00 O ATOM 69510 H1 WAT 9958 56.900 74.666 138.627 1.00 0.00 H ATOM 69511 H2 WAT 9958 56.268 73.569 137.797 1.00 0.00 H TER 69513 WAT 9958 ATOM 69513 O WAT 9959 58.326 88.691 99.263 1.00 0.00 O ATOM 69514 H1 WAT 9959 58.663 88.748 100.157 1.00 0.00 H ATOM 69515 H2 WAT 9959 58.391 87.762 99.041 1.00 0.00 H TER 69517 WAT 9959 ATOM 69517 O WAT 9960 81.741 81.638 91.398 1.00 0.00 O ATOM 69518 H1 WAT 9960 81.204 81.961 90.675 1.00 0.00 H ATOM 69519 H2 WAT 9960 81.402 80.760 91.575 1.00 0.00 H TER 69521 WAT 9960 ATOM 69521 O WAT 9961 64.806 87.019 146.135 1.00 0.00 O ATOM 69522 H1 WAT 9961 64.455 87.909 146.110 1.00 0.00 H ATOM 69523 H2 WAT 9961 64.520 86.671 146.980 1.00 0.00 H TER 69525 WAT 9961 ATOM 69525 O WAT 9962 18.185 8.055 82.670 1.00 0.00 O ATOM 69526 H1 WAT 9962 18.777 8.766 82.424 1.00 0.00 H ATOM 69527 H2 WAT 9962 17.361 8.492 82.883 1.00 0.00 H TER 69529 WAT 9962 ATOM 69529 O WAT 9963 138.396 20.330 137.686 1.00 0.00 O ATOM 69530 H1 WAT 9963 138.742 21.058 138.203 1.00 0.00 H ATOM 69531 H2 WAT 9963 137.745 20.733 137.111 1.00 0.00 H TER 69533 WAT 9963 ATOM 69533 O WAT 9964 43.722 60.647 71.639 1.00 0.00 O ATOM 69534 H1 WAT 9964 43.756 61.447 72.163 1.00 0.00 H ATOM 69535 H2 WAT 9964 43.141 60.862 70.910 1.00 0.00 H TER 69537 WAT 9964 ATOM 69537 O WAT 9965 15.431 92.881 144.583 1.00 0.00 O ATOM 69538 H1 WAT 9965 14.559 92.941 144.974 1.00 0.00 H ATOM 69539 H2 WAT 9965 15.894 92.243 145.126 1.00 0.00 H TER 69541 WAT 9965 ATOM 69541 O WAT 9966 5.327 107.063 126.522 1.00 0.00 O ATOM 69542 H1 WAT 9966 4.657 107.182 127.195 1.00 0.00 H ATOM 69543 H2 WAT 9966 5.655 107.946 126.351 1.00 0.00 H TER 69545 WAT 9966 ATOM 69545 O WAT 9967 48.074 109.689 60.124 1.00 0.00 O ATOM 69546 H1 WAT 9967 47.139 109.505 60.208 1.00 0.00 H ATOM 69547 H2 WAT 9967 48.113 110.575 59.764 1.00 0.00 H TER 69549 WAT 9967 ATOM 69549 O WAT 9968 62.679 132.678 60.922 1.00 0.00 O ATOM 69550 H1 WAT 9968 62.600 133.494 61.417 1.00 0.00 H ATOM 69551 H2 WAT 9968 62.102 132.065 61.377 1.00 0.00 H TER 69553 WAT 9968 ATOM 69553 O WAT 9969 145.258 82.938 147.407 1.00 0.00 O ATOM 69554 H1 WAT 9969 145.132 82.773 146.472 1.00 0.00 H ATOM 69555 H2 WAT 9969 144.382 82.861 147.784 1.00 0.00 H TER 69557 WAT 9969 ATOM 69557 O WAT 9970 8.409 12.170 96.027 1.00 0.00 O ATOM 69558 H1 WAT 9970 7.740 12.666 95.556 1.00 0.00 H ATOM 69559 H2 WAT 9970 8.785 12.800 96.642 1.00 0.00 H TER 69561 WAT 9970 ATOM 69561 O WAT 9971 117.774 4.658 57.537 1.00 0.00 O ATOM 69562 H1 WAT 9971 118.099 3.963 56.965 1.00 0.00 H ATOM 69563 H2 WAT 9971 117.230 4.204 58.181 1.00 0.00 H TER 69565 WAT 9971 ATOM 69565 O WAT 9972 72.779 58.697 83.792 1.00 0.00 O ATOM 69566 H1 WAT 9972 72.171 58.007 84.055 1.00 0.00 H ATOM 69567 H2 WAT 9972 73.510 58.619 84.405 1.00 0.00 H TER 69569 WAT 9972 ATOM 69569 O WAT 9973 105.973 124.054 135.168 1.00 0.00 O ATOM 69570 H1 WAT 9973 105.729 123.259 134.695 1.00 0.00 H ATOM 69571 H2 WAT 9973 105.273 124.177 135.809 1.00 0.00 H TER 69573 WAT 9973 ATOM 69573 O WAT 9974 44.820 59.375 89.338 1.00 0.00 O ATOM 69574 H1 WAT 9974 43.923 59.045 89.285 1.00 0.00 H ATOM 69575 H2 WAT 9974 44.771 60.102 89.959 1.00 0.00 H TER 69577 WAT 9974 ATOM 69577 O WAT 9975 120.810 15.033 69.474 1.00 0.00 O ATOM 69578 H1 WAT 9975 121.622 15.186 69.957 1.00 0.00 H ATOM 69579 H2 WAT 9975 120.291 15.823 69.622 1.00 0.00 H TER 69581 WAT 9975 ATOM 69581 O WAT 9976 35.345 122.723 94.781 1.00 0.00 O ATOM 69582 H1 WAT 9976 35.852 123.186 94.115 1.00 0.00 H ATOM 69583 H2 WAT 9976 35.653 121.818 94.730 1.00 0.00 H TER 69585 WAT 9976 ATOM 69585 O WAT 9977 47.617 81.804 127.214 1.00 0.00 O ATOM 69586 H1 WAT 9977 47.286 82.682 127.020 1.00 0.00 H ATOM 69587 H2 WAT 9977 47.513 81.323 126.393 1.00 0.00 H TER 69589 WAT 9977 ATOM 69589 O WAT 9978 46.583 142.599 128.157 1.00 0.00 O ATOM 69590 H1 WAT 9978 46.751 141.708 128.463 1.00 0.00 H ATOM 69591 H2 WAT 9978 46.792 143.154 128.909 1.00 0.00 H TER 69593 WAT 9978 ATOM 69593 O WAT 9979 107.841 105.245 67.364 1.00 0.00 O ATOM 69594 H1 WAT 9979 108.381 105.425 66.594 1.00 0.00 H ATOM 69595 H2 WAT 9979 108.471 105.117 68.073 1.00 0.00 H TER 69597 WAT 9979 ATOM 69597 O WAT 9980 92.267 93.785 71.428 1.00 0.00 O ATOM 69598 H1 WAT 9980 93.131 94.075 71.136 1.00 0.00 H ATOM 69599 H2 WAT 9980 91.683 94.508 71.201 1.00 0.00 H TER 69601 WAT 9980 ATOM 69601 O WAT 9981 63.860 1.832 130.442 1.00 0.00 O ATOM 69602 H1 WAT 9981 63.330 1.052 130.603 1.00 0.00 H ATOM 69603 H2 WAT 9981 64.703 1.637 130.851 1.00 0.00 H TER 69605 WAT 9981 ATOM 69605 O WAT 9982 43.893 131.851 105.268 1.00 0.00 O ATOM 69606 H1 WAT 9982 43.207 132.469 105.014 1.00 0.00 H ATOM 69607 H2 WAT 9982 44.660 132.399 105.433 1.00 0.00 H TER 69609 WAT 9982 ATOM 69609 O WAT 9983 88.057 119.707 115.975 1.00 0.00 O ATOM 69610 H1 WAT 9983 88.817 120.202 116.280 1.00 0.00 H ATOM 69611 H2 WAT 9983 87.575 120.323 115.424 1.00 0.00 H TER 69613 WAT 9983 ATOM 69613 O WAT 9984 29.305 1.862 142.449 1.00 0.00 O ATOM 69614 H1 WAT 9984 29.778 1.383 143.129 1.00 0.00 H ATOM 69615 H2 WAT 9984 29.896 2.574 142.203 1.00 0.00 H TER 69617 WAT 9984 ATOM 69617 O WAT 9985 22.227 113.699 148.357 1.00 0.00 O ATOM 69618 H1 WAT 9985 21.523 113.921 148.966 1.00 0.00 H ATOM 69619 H2 WAT 9985 22.938 113.387 148.917 1.00 0.00 H TER 69621 WAT 9985 ATOM 69621 O WAT 9986 22.495 134.786 98.173 1.00 0.00 O ATOM 69622 H1 WAT 9986 23.364 134.596 98.526 1.00 0.00 H ATOM 69623 H2 WAT 9986 22.114 135.405 98.796 1.00 0.00 H TER 69625 WAT 9986 ATOM 69625 O WAT 9987 25.936 65.275 157.475 1.00 0.00 O ATOM 69626 H1 WAT 9987 26.007 64.916 156.591 1.00 0.00 H ATOM 69627 H2 WAT 9987 25.480 66.109 157.357 1.00 0.00 H TER 69629 WAT 9987 ATOM 69629 O WAT 9988 7.341 106.532 135.225 1.00 0.00 O ATOM 69630 H1 WAT 9988 7.144 107.462 135.342 1.00 0.00 H ATOM 69631 H2 WAT 9988 6.553 106.081 135.528 1.00 0.00 H TER 69633 WAT 9988 ATOM 69633 O WAT 9989 78.674 88.214 15.263 1.00 0.00 O ATOM 69634 H1 WAT 9989 79.621 88.137 15.374 1.00 0.00 H ATOM 69635 H2 WAT 9989 78.319 88.097 16.145 1.00 0.00 H TER 69637 WAT 9989 ATOM 69637 O WAT 9990 58.450 50.226 143.318 1.00 0.00 O ATOM 69638 H1 WAT 9990 58.009 49.997 142.500 1.00 0.00 H ATOM 69639 H2 WAT 9990 58.847 51.079 143.146 1.00 0.00 H TER 69641 WAT 9990 ATOM 69641 O WAT 9991 36.896 117.055 123.581 1.00 0.00 O ATOM 69642 H1 WAT 9991 36.503 117.169 122.716 1.00 0.00 H ATOM 69643 H2 WAT 9991 36.453 117.700 124.132 1.00 0.00 H TER 69645 WAT 9991 ATOM 69645 O WAT 9992 79.011 58.822 126.899 1.00 0.00 O ATOM 69646 H1 WAT 9992 79.138 57.887 126.741 1.00 0.00 H ATOM 69647 H2 WAT 9992 79.056 58.913 127.851 1.00 0.00 H TER 69649 WAT 9992 ATOM 69649 O WAT 9993 22.975 105.065 133.253 1.00 0.00 O ATOM 69650 H1 WAT 9993 22.102 104.702 133.108 1.00 0.00 H ATOM 69651 H2 WAT 9993 22.854 105.708 133.951 1.00 0.00 H TER 69653 WAT 9993 ATOM 69653 O WAT 9994 126.398 143.692 81.312 1.00 0.00 O ATOM 69654 H1 WAT 9994 126.370 144.595 81.628 1.00 0.00 H ATOM 69655 H2 WAT 9994 127.313 143.431 81.415 1.00 0.00 H TER 69657 WAT 9994 ATOM 69657 O WAT 9995 59.315 122.928 5.976 1.00 0.00 O ATOM 69658 H1 WAT 9995 59.496 123.144 5.062 1.00 0.00 H ATOM 69659 H2 WAT 9995 59.437 121.980 6.027 1.00 0.00 H TER 69661 WAT 9995 ATOM 69661 O WAT 9996 61.301 60.614 139.992 1.00 0.00 O ATOM 69662 H1 WAT 9996 61.396 61.489 140.369 1.00 0.00 H ATOM 69663 H2 WAT 9996 60.705 60.161 140.588 1.00 0.00 H TER 69665 WAT 9996 ATOM 69665 O WAT 9997 81.246 133.359 19.460 1.00 0.00 O ATOM 69666 H1 WAT 9997 81.909 133.202 20.131 1.00 0.00 H ATOM 69667 H2 WAT 9997 81.383 134.269 19.196 1.00 0.00 H TER 69669 WAT 9997 ATOM 69669 O WAT 9998 53.158 5.550 65.945 1.00 0.00 O ATOM 69670 H1 WAT 9998 52.666 5.744 65.147 1.00 0.00 H ATOM 69671 H2 WAT 9998 52.504 5.579 66.643 1.00 0.00 H TER 69673 WAT 9998 ATOM 69673 O WAT 9999 7.680 86.593 59.898 1.00 0.00 O ATOM 69674 H1 WAT 9999 6.877 86.180 59.582 1.00 0.00 H ATOM 69675 H2 WAT 9999 7.585 87.516 59.661 1.00 0.00 H TER 69677 WAT 9999 ATOM 69677 O WAT 0 6.392 18.373 12.525 1.00 0.00 O ATOM 69678 H1 WAT 0 6.577 18.891 13.309 1.00 0.00 H ATOM 69679 H2 WAT 0 5.565 18.725 12.195 1.00 0.00 H TER 69681 WAT 0 ATOM 69681 O WAT 1 110.092 4.528 19.595 1.00 0.00 O ATOM 69682 H1 WAT 1 110.004 5.478 19.678 1.00 0.00 H ATOM 69683 H2 WAT 1 110.593 4.266 20.367 1.00 0.00 H TER 69685 WAT 1 ATOM 69685 O WAT 2 50.096 78.436 135.948 1.00 0.00 O ATOM 69686 H1 WAT 2 49.739 78.250 136.816 1.00 0.00 H ATOM 69687 H2 WAT 2 50.820 79.040 136.112 1.00 0.00 H TER 69689 WAT 2 ATOM 69689 O WAT 3 73.926 124.230 78.802 1.00 0.00 O ATOM 69690 H1 WAT 3 73.684 124.303 79.726 1.00 0.00 H ATOM 69691 H2 WAT 3 74.859 124.015 78.815 1.00 0.00 H TER 69693 WAT 3 ATOM 69693 O WAT 4 70.351 26.065 150.467 1.00 0.00 O ATOM 69694 H1 WAT 4 69.786 26.694 150.916 1.00 0.00 H ATOM 69695 H2 WAT 4 70.786 26.578 149.786 1.00 0.00 H TER 69697 WAT 4 ATOM 69697 O WAT 5 15.806 40.071 115.096 1.00 0.00 O ATOM 69698 H1 WAT 5 15.483 40.354 115.951 1.00 0.00 H ATOM 69699 H2 WAT 5 16.738 39.903 115.235 1.00 0.00 H TER 69701 WAT 5 ATOM 69701 O WAT 6 108.661 28.816 74.228 1.00 0.00 O ATOM 69702 H1 WAT 6 108.232 29.671 74.213 1.00 0.00 H ATOM 69703 H2 WAT 6 108.008 28.214 73.871 1.00 0.00 H TER 69705 WAT 6 ATOM 69705 O WAT 7 116.654 82.001 117.346 1.00 0.00 O ATOM 69706 H1 WAT 7 117.594 81.927 117.177 1.00 0.00 H ATOM 69707 H2 WAT 7 116.418 82.865 117.009 1.00 0.00 H TER 69709 WAT 7 ATOM 69709 O WAT 8 20.355 128.150 64.305 1.00 0.00 O ATOM 69710 H1 WAT 8 19.667 128.814 64.348 1.00 0.00 H ATOM 69711 H2 WAT 8 20.402 127.796 65.194 1.00 0.00 H TER 69713 WAT 8 ATOM 69713 O WAT 9 82.382 59.771 152.775 1.00 0.00 O ATOM 69714 H1 WAT 9 83.002 59.147 152.398 1.00 0.00 H ATOM 69715 H2 WAT 9 81.639 59.235 153.051 1.00 0.00 H TER 69717 WAT 9 ATOM 69717 O WAT 10 108.200 121.736 127.971 1.00 0.00 O ATOM 69718 H1 WAT 10 107.796 122.406 128.523 1.00 0.00 H ATOM 69719 H2 WAT 10 108.102 120.925 128.469 1.00 0.00 H TER 69721 WAT 10 ATOM 69721 O WAT 11 4.005 80.302 150.149 1.00 0.00 O ATOM 69722 H1 WAT 11 3.733 80.912 150.836 1.00 0.00 H ATOM 69723 H2 WAT 11 4.931 80.497 150.008 1.00 0.00 H TER 69725 WAT 11 ATOM 69725 O WAT 12 135.641 52.175 20.227 1.00 0.00 O ATOM 69726 H1 WAT 12 134.848 51.724 20.515 1.00 0.00 H ATOM 69727 H2 WAT 12 136.058 52.468 21.038 1.00 0.00 H TER 69729 WAT 12 ATOM 69729 O WAT 13 142.302 83.205 16.134 1.00 0.00 O ATOM 69730 H1 WAT 13 142.837 83.955 16.393 1.00 0.00 H ATOM 69731 H2 WAT 13 142.665 82.933 15.291 1.00 0.00 H TER 69733 WAT 13 ATOM 69733 O WAT 14 94.901 58.416 130.622 1.00 0.00 O ATOM 69734 H1 WAT 14 95.768 58.321 130.227 1.00 0.00 H ATOM 69735 H2 WAT 14 94.976 57.979 131.471 1.00 0.00 H TER 69737 WAT 14 ATOM 69737 O WAT 15 104.174 47.473 20.867 1.00 0.00 O ATOM 69738 H1 WAT 15 103.369 46.956 20.867 1.00 0.00 H ATOM 69739 H2 WAT 15 104.502 47.408 21.764 1.00 0.00 H TER 69741 WAT 15 ATOM 69741 O WAT 16 16.867 106.151 150.819 1.00 0.00 O ATOM 69742 H1 WAT 16 17.625 106.667 151.091 1.00 0.00 H ATOM 69743 H2 WAT 16 16.506 106.628 150.072 1.00 0.00 H TER 69745 WAT 16 ATOM 69745 O WAT 17 84.806 10.022 91.640 1.00 0.00 O ATOM 69746 H1 WAT 17 84.013 9.625 91.280 1.00 0.00 H ATOM 69747 H2 WAT 17 85.159 10.546 90.921 1.00 0.00 H TER 69749 WAT 17 ATOM 69749 O WAT 18 88.830 132.979 137.264 1.00 0.00 O ATOM 69750 H1 WAT 18 88.570 133.899 137.211 1.00 0.00 H ATOM 69751 H2 WAT 18 88.055 132.531 137.603 1.00 0.00 H TER 69753 WAT 18 ATOM 69753 O WAT 19 11.306 68.894 115.653 1.00 0.00 O ATOM 69754 H1 WAT 19 12.233 68.668 115.570 1.00 0.00 H ATOM 69755 H2 WAT 19 11.139 69.489 114.923 1.00 0.00 H TER 69757 WAT 19 ATOM 69757 O WAT 20 122.895 25.965 152.132 1.00 0.00 O ATOM 69758 H1 WAT 20 122.132 25.572 152.557 1.00 0.00 H ATOM 69759 H2 WAT 20 123.102 25.370 151.412 1.00 0.00 H TER 69761 WAT 20 ATOM 69761 O WAT 21 118.426 20.850 71.911 1.00 0.00 O ATOM 69762 H1 WAT 21 117.962 20.887 71.075 1.00 0.00 H ATOM 69763 H2 WAT 21 117.886 21.368 72.508 1.00 0.00 H TER 69765 WAT 21 ATOM 69765 O WAT 22 28.023 46.348 131.585 1.00 0.00 O ATOM 69766 H1 WAT 22 27.992 45.526 132.075 1.00 0.00 H ATOM 69767 H2 WAT 22 28.626 46.901 132.082 1.00 0.00 H TER 69769 WAT 22 ATOM 69769 O WAT 23 49.296 59.579 88.416 1.00 0.00 O ATOM 69770 H1 WAT 23 49.280 59.158 87.556 1.00 0.00 H ATOM 69771 H2 WAT 23 48.620 59.125 88.918 1.00 0.00 H TER 69773 WAT 23 ATOM 69773 O WAT 24 39.303 6.027 158.461 1.00 0.00 O ATOM 69774 H1 WAT 24 39.912 6.238 157.753 1.00 0.00 H ATOM 69775 H2 WAT 24 39.142 6.865 158.895 1.00 0.00 H TER 69777 WAT 24 ATOM 69777 O WAT 25 117.160 36.682 126.973 1.00 0.00 O ATOM 69778 H1 WAT 25 116.304 36.809 126.563 1.00 0.00 H ATOM 69779 H2 WAT 25 117.608 36.058 126.401 1.00 0.00 H TER 69781 WAT 25 ATOM 69781 O WAT 26 143.387 27.264 136.260 1.00 0.00 O ATOM 69782 H1 WAT 26 144.058 26.599 136.411 1.00 0.00 H ATOM 69783 H2 WAT 26 143.109 27.527 137.138 1.00 0.00 H TER 69785 WAT 26 ATOM 69785 O WAT 27 125.634 138.392 125.888 1.00 0.00 O ATOM 69786 H1 WAT 27 125.912 139.305 125.961 1.00 0.00 H ATOM 69787 H2 WAT 27 126.444 137.888 125.974 1.00 0.00 H TER 69789 WAT 27 ATOM 69789 O WAT 28 55.757 95.716 157.568 1.00 0.00 O ATOM 69790 H1 WAT 28 56.246 94.971 157.918 1.00 0.00 H ATOM 69791 H2 WAT 28 56.393 96.190 157.032 1.00 0.00 H TER 69793 WAT 28 ATOM 69793 O WAT 29 25.859 139.308 121.698 1.00 0.00 O ATOM 69794 H1 WAT 29 26.385 139.150 120.914 1.00 0.00 H ATOM 69795 H2 WAT 29 26.181 140.144 122.037 1.00 0.00 H TER 69797 WAT 29 ATOM 69797 O WAT 30 123.938 113.866 91.431 1.00 0.00 O ATOM 69798 H1 WAT 30 123.584 112.981 91.344 1.00 0.00 H ATOM 69799 H2 WAT 30 124.775 113.746 91.879 1.00 0.00 H TER 69801 WAT 30 ATOM 69801 O WAT 31 7.072 96.507 125.210 1.00 0.00 O ATOM 69802 H1 WAT 31 7.890 96.691 125.671 1.00 0.00 H ATOM 69803 H2 WAT 31 6.387 96.745 125.835 1.00 0.00 H TER 69805 WAT 31 ATOM 69805 O WAT 32 94.200 21.316 82.590 1.00 0.00 O ATOM 69806 H1 WAT 32 93.505 21.450 83.234 1.00 0.00 H ATOM 69807 H2 WAT 32 93.877 20.608 82.032 1.00 0.00 H TER 69809 WAT 32 ATOM 69809 O WAT 33 11.761 140.184 78.564 1.00 0.00 O ATOM 69810 H1 WAT 33 12.490 139.729 78.143 1.00 0.00 H ATOM 69811 H2 WAT 33 11.293 139.498 79.039 1.00 0.00 H TER 69813 WAT 33 ATOM 69813 O WAT 34 50.011 1.025 7.265 1.00 0.00 O ATOM 69814 H1 WAT 34 50.144 1.642 6.545 1.00 0.00 H ATOM 69815 H2 WAT 34 50.090 0.162 6.858 1.00 0.00 H TER 69817 WAT 34 ATOM 69817 O WAT 35 98.837 57.495 99.352 1.00 0.00 O ATOM 69818 H1 WAT 35 98.470 56.648 99.604 1.00 0.00 H ATOM 69819 H2 WAT 35 98.598 58.082 100.070 1.00 0.00 H TER 69821 WAT 35 ATOM 69821 O WAT 36 142.381 87.002 106.306 1.00 0.00 O ATOM 69822 H1 WAT 36 141.482 86.941 106.631 1.00 0.00 H ATOM 69823 H2 WAT 36 142.806 86.207 106.628 1.00 0.00 H TER 69825 WAT 36 ATOM 69825 O WAT 37 105.643 54.611 154.359 1.00 0.00 O ATOM 69826 H1 WAT 37 105.125 53.834 154.568 1.00 0.00 H ATOM 69827 H2 WAT 37 106.153 54.778 155.152 1.00 0.00 H TER 69829 WAT 37 ATOM 69829 O WAT 38 90.867 126.011 4.681 1.00 0.00 O ATOM 69830 H1 WAT 38 91.293 126.867 4.728 1.00 0.00 H ATOM 69831 H2 WAT 38 91.311 125.485 5.347 1.00 0.00 H TER 69833 WAT 38 ATOM 69833 O WAT 39 37.893 94.234 68.980 1.00 0.00 O ATOM 69834 H1 WAT 39 37.508 93.452 68.585 1.00 0.00 H ATOM 69835 H2 WAT 39 37.813 94.090 69.923 1.00 0.00 H TER 69837 WAT 39 ATOM 69837 O WAT 40 16.197 49.790 141.823 1.00 0.00 O ATOM 69838 H1 WAT 40 16.632 50.476 141.316 1.00 0.00 H ATOM 69839 H2 WAT 40 15.283 49.828 141.542 1.00 0.00 H TER 69841 WAT 40 ATOM 69841 O WAT 41 0.378 117.315 16.267 1.00 0.00 O ATOM 69842 H1 WAT 41 0.538 118.208 15.963 1.00 0.00 H ATOM 69843 H2 WAT 41 0.856 117.255 17.094 1.00 0.00 H TER 69845 WAT 41 ATOM 69845 O WAT 42 68.905 142.137 79.151 1.00 0.00 O ATOM 69846 H1 WAT 42 69.239 142.440 78.307 1.00 0.00 H ATOM 69847 H2 WAT 42 68.836 142.932 79.681 1.00 0.00 H TER 69849 WAT 42 ATOM 69849 O WAT 43 129.833 140.097 12.813 1.00 0.00 O ATOM 69850 H1 WAT 43 130.245 140.624 13.498 1.00 0.00 H ATOM 69851 H2 WAT 43 129.415 140.738 12.237 1.00 0.00 H TER 69853 WAT 43 ATOM 69853 O WAT 44 132.914 9.013 69.450 1.00 0.00 O ATOM 69854 H1 WAT 44 132.410 9.711 69.868 1.00 0.00 H ATOM 69855 H2 WAT 44 133.827 9.275 69.566 1.00 0.00 H TER 69857 WAT 44 ATOM 69857 O WAT 45 69.275 15.524 148.526 1.00 0.00 O ATOM 69858 H1 WAT 45 69.752 15.522 147.696 1.00 0.00 H ATOM 69859 H2 WAT 45 69.752 16.146 149.075 1.00 0.00 H TER 69861 WAT 45 ATOM 69861 O WAT 46 37.982 110.423 116.968 1.00 0.00 O ATOM 69862 H1 WAT 46 37.598 110.910 116.239 1.00 0.00 H ATOM 69863 H2 WAT 46 37.498 110.723 117.738 1.00 0.00 H TER 69865 WAT 46 ATOM 69865 O WAT 47 34.180 2.124 60.845 1.00 0.00 O ATOM 69866 H1 WAT 47 34.105 2.068 61.798 1.00 0.00 H ATOM 69867 H2 WAT 47 34.961 2.658 60.697 1.00 0.00 H TER 69869 WAT 47 ATOM 69869 O WAT 48 27.720 64.453 125.218 1.00 0.00 O ATOM 69870 H1 WAT 48 27.731 65.024 124.451 1.00 0.00 H ATOM 69871 H2 WAT 48 27.941 63.587 124.876 1.00 0.00 H TER 69873 WAT 48 ATOM 69873 O WAT 49 133.914 46.921 135.269 1.00 0.00 O ATOM 69874 H1 WAT 49 134.307 46.525 136.047 1.00 0.00 H ATOM 69875 H2 WAT 49 134.468 46.628 134.546 1.00 0.00 H TER 69877 WAT 49 ATOM 69877 O WAT 50 111.015 32.802 23.063 1.00 0.00 O ATOM 69878 H1 WAT 50 111.701 32.497 23.656 1.00 0.00 H ATOM 69879 H2 WAT 50 110.360 33.198 23.638 1.00 0.00 H TER 69881 WAT 50 ATOM 69881 O WAT 51 50.000 56.913 5.997 1.00 0.00 O ATOM 69882 H1 WAT 51 50.539 56.123 6.036 1.00 0.00 H ATOM 69883 H2 WAT 51 50.616 57.613 5.784 1.00 0.00 H TER 69885 WAT 51 ATOM 69885 O WAT 52 113.447 45.046 95.676 1.00 0.00 O ATOM 69886 H1 WAT 52 113.110 44.336 95.131 1.00 0.00 H ATOM 69887 H2 WAT 52 114.192 45.392 95.185 1.00 0.00 H TER 69889 WAT 52 ATOM 69889 O WAT 53 35.191 99.641 116.558 1.00 0.00 O ATOM 69890 H1 WAT 53 35.970 99.705 117.110 1.00 0.00 H ATOM 69891 H2 WAT 53 35.493 99.899 115.687 1.00 0.00 H TER 69893 WAT 53 ATOM 69893 O WAT 54 92.058 125.804 121.699 1.00 0.00 O ATOM 69894 H1 WAT 54 92.542 125.363 121.000 1.00 0.00 H ATOM 69895 H2 WAT 54 92.217 126.736 121.548 1.00 0.00 H TER 69897 WAT 54 ATOM 69897 O WAT 55 24.091 133.637 127.522 1.00 0.00 O ATOM 69898 H1 WAT 55 24.190 134.094 126.686 1.00 0.00 H ATOM 69899 H2 WAT 55 24.367 132.739 127.338 1.00 0.00 H TER 69901 WAT 55 ATOM 69901 O WAT 56 121.884 25.551 92.215 1.00 0.00 O ATOM 69902 H1 WAT 56 122.291 25.460 91.354 1.00 0.00 H ATOM 69903 H2 WAT 56 121.487 24.697 92.384 1.00 0.00 H TER 69905 WAT 56 ATOM 69905 O WAT 57 73.686 56.510 78.672 1.00 0.00 O ATOM 69906 H1 WAT 57 73.289 56.931 77.910 1.00 0.00 H ATOM 69907 H2 WAT 57 74.562 56.893 78.728 1.00 0.00 H TER 69909 WAT 57 ATOM 69909 O WAT 58 83.479 45.013 133.736 1.00 0.00 O ATOM 69910 H1 WAT 58 83.196 45.136 134.642 1.00 0.00 H ATOM 69911 H2 WAT 58 84.281 45.530 133.663 1.00 0.00 H TER 69913 WAT 58 ATOM 69913 O WAT 59 82.034 114.865 57.370 1.00 0.00 O ATOM 69914 H1 WAT 59 82.603 115.319 57.991 1.00 0.00 H ATOM 69915 H2 WAT 59 82.037 115.422 56.591 1.00 0.00 H TER 69917 WAT 59 ATOM 69917 O WAT 60 144.254 69.766 67.824 1.00 0.00 O ATOM 69918 H1 WAT 60 144.364 70.476 67.192 1.00 0.00 H ATOM 69919 H2 WAT 60 144.202 70.206 68.672 1.00 0.00 H TER 69921 WAT 60 ATOM 69921 O WAT 61 86.348 130.698 3.597 1.00 0.00 O ATOM 69922 H1 WAT 61 86.448 131.629 3.401 1.00 0.00 H ATOM 69923 H2 WAT 61 85.743 130.375 2.929 1.00 0.00 H TER 69925 WAT 61 ATOM 69925 O WAT 62 19.880 73.679 98.794 1.00 0.00 O ATOM 69926 H1 WAT 62 20.448 74.156 99.399 1.00 0.00 H ATOM 69927 H2 WAT 62 19.491 72.986 99.327 1.00 0.00 H TER 69929 WAT 62 ATOM 69929 O WAT 63 139.722 126.191 69.796 1.00 0.00 O ATOM 69930 H1 WAT 63 139.132 126.908 70.032 1.00 0.00 H ATOM 69931 H2 WAT 63 139.150 125.524 69.417 1.00 0.00 H TER 69933 WAT 63 ATOM 69933 O WAT 64 145.721 0.882 11.682 1.00 0.00 O ATOM 69934 H1 WAT 64 145.759 -0.038 11.946 1.00 0.00 H ATOM 69935 H2 WAT 64 146.171 1.351 12.385 1.00 0.00 H TER 69937 WAT 64 ATOM 69937 O WAT 65 9.279 45.919 16.597 1.00 0.00 O ATOM 69938 H1 WAT 65 9.515 46.744 17.021 1.00 0.00 H ATOM 69939 H2 WAT 65 8.805 45.431 17.271 1.00 0.00 H TER 69941 WAT 65 ATOM 69941 O WAT 66 70.179 101.128 88.299 1.00 0.00 O ATOM 69942 H1 WAT 66 70.220 101.270 87.353 1.00 0.00 H ATOM 69943 H2 WAT 66 71.095 101.076 88.573 1.00 0.00 H TER 69945 WAT 66 ATOM 69945 O WAT 67 43.121 126.005 79.728 1.00 0.00 O ATOM 69946 H1 WAT 67 42.955 125.079 79.902 1.00 0.00 H ATOM 69947 H2 WAT 67 43.723 126.004 78.984 1.00 0.00 H TER 69949 WAT 67 ATOM 69949 O WAT 68 21.002 33.570 9.977 1.00 0.00 O ATOM 69950 H1 WAT 68 20.467 33.406 9.200 1.00 0.00 H ATOM 69951 H2 WAT 68 21.013 32.733 10.441 1.00 0.00 H TER 69953 WAT 68 ATOM 69953 O WAT 69 135.141 38.779 98.576 1.00 0.00 O ATOM 69954 H1 WAT 69 134.971 39.536 98.017 1.00 0.00 H ATOM 69955 H2 WAT 69 135.572 38.147 98.000 1.00 0.00 H TER 69957 WAT 69 ATOM 69957 O WAT 70 39.152 24.695 102.745 1.00 0.00 O ATOM 69958 H1 WAT 70 39.926 24.216 103.040 1.00 0.00 H ATOM 69959 H2 WAT 70 38.456 24.037 102.726 1.00 0.00 H TER 69961 WAT 70 ATOM 69961 O WAT 71 25.782 0.139 88.841 1.00 0.00 O ATOM 69962 H1 WAT 71 25.717 0.748 88.106 1.00 0.00 H ATOM 69963 H2 WAT 71 25.927 0.698 89.604 1.00 0.00 H TER 69965 WAT 71 ATOM 69965 O WAT 72 40.222 59.667 106.615 1.00 0.00 O ATOM 69966 H1 WAT 72 40.490 60.425 107.134 1.00 0.00 H ATOM 69967 H2 WAT 72 40.834 59.652 105.879 1.00 0.00 H TER 69969 WAT 72 ATOM 69969 O WAT 73 99.682 57.818 75.736 1.00 0.00 O ATOM 69970 H1 WAT 73 100.455 57.430 76.147 1.00 0.00 H ATOM 69971 H2 WAT 73 99.969 58.044 74.851 1.00 0.00 H TER 69973 WAT 73 ATOM 69973 O WAT 74 8.188 83.747 123.841 1.00 0.00 O ATOM 69974 H1 WAT 74 7.455 83.928 124.430 1.00 0.00 H ATOM 69975 H2 WAT 74 7.806 83.791 122.964 1.00 0.00 H TER 69977 WAT 74 ATOM 69977 O WAT 75 15.254 32.625 144.039 1.00 0.00 O ATOM 69978 H1 WAT 75 15.855 33.362 144.146 1.00 0.00 H ATOM 69979 H2 WAT 75 15.023 32.371 144.933 1.00 0.00 H TER 69981 WAT 75 ATOM 69981 O WAT 76 17.630 140.788 148.851 1.00 0.00 O ATOM 69982 H1 WAT 76 17.678 140.411 149.729 1.00 0.00 H ATOM 69983 H2 WAT 76 16.698 140.769 148.633 1.00 0.00 H TER 69985 WAT 76 ATOM 69985 O WAT 77 78.738 137.705 79.133 1.00 0.00 O ATOM 69986 H1 WAT 77 79.576 137.523 79.558 1.00 0.00 H ATOM 69987 H2 WAT 77 78.594 138.640 79.280 1.00 0.00 H TER 69989 WAT 77 ATOM 69989 O WAT 78 135.857 107.859 150.010 1.00 0.00 O ATOM 69990 H1 WAT 78 135.278 108.513 150.400 1.00 0.00 H ATOM 69991 H2 WAT 78 136.516 108.371 149.542 1.00 0.00 H TER 69993 WAT 78 ATOM 69993 O WAT 79 72.859 112.680 6.737 1.00 0.00 O ATOM 69994 H1 WAT 79 73.563 112.642 7.385 1.00 0.00 H ATOM 69995 H2 WAT 79 73.286 112.470 5.907 1.00 0.00 H TER 69997 WAT 79 ATOM 69997 O WAT 80 37.656 105.139 107.290 1.00 0.00 O ATOM 69998 H1 WAT 80 37.922 105.682 106.548 1.00 0.00 H ATOM 69999 H2 WAT 80 37.210 105.744 107.882 1.00 0.00 H TER 70001 WAT 80 ATOM 70001 O WAT 81 25.945 40.027 145.705 1.00 0.00 O ATOM 70002 H1 WAT 81 25.225 40.515 146.104 1.00 0.00 H ATOM 70003 H2 WAT 81 25.544 39.213 145.401 1.00 0.00 H TER 70005 WAT 81 ATOM 70005 O WAT 82 9.380 16.465 66.765 1.00 0.00 O ATOM 70006 H1 WAT 82 9.942 17.227 66.628 1.00 0.00 H ATOM 70007 H2 WAT 82 9.300 16.067 65.899 1.00 0.00 H TER 70009 WAT 82 ATOM 70009 O WAT 83 47.526 93.686 80.961 1.00 0.00 O ATOM 70010 H1 WAT 83 48.180 94.375 80.848 1.00 0.00 H ATOM 70011 H2 WAT 83 47.967 92.888 80.669 1.00 0.00 H TER 70013 WAT 83 ATOM 70013 O WAT 84 118.824 77.943 123.739 1.00 0.00 O ATOM 70014 H1 WAT 84 117.906 77.808 123.975 1.00 0.00 H ATOM 70015 H2 WAT 84 119.015 78.837 124.020 1.00 0.00 H TER 70017 WAT 84 ATOM 70017 O WAT 85 81.718 139.866 139.922 1.00 0.00 O ATOM 70018 H1 WAT 85 82.143 139.025 140.090 1.00 0.00 H ATOM 70019 H2 WAT 85 81.771 140.333 140.755 1.00 0.00 H TER 70021 WAT 85 ATOM 70021 O WAT 86 59.696 101.674 150.119 1.00 0.00 O ATOM 70022 H1 WAT 86 60.008 101.198 149.350 1.00 0.00 H ATOM 70023 H2 WAT 86 60.490 101.872 150.617 1.00 0.00 H TER 70025 WAT 86 ATOM 70025 O WAT 87 70.516 91.392 125.442 1.00 0.00 O ATOM 70026 H1 WAT 87 70.728 92.114 126.035 1.00 0.00 H ATOM 70027 H2 WAT 87 71.347 90.933 125.318 1.00 0.00 H TER 70029 WAT 87 ATOM 70029 O WAT 88 95.493 72.001 20.003 1.00 0.00 O ATOM 70030 H1 WAT 88 95.814 72.647 19.374 1.00 0.00 H ATOM 70031 H2 WAT 88 96.285 71.583 20.342 1.00 0.00 H TER 70033 WAT 88 ATOM 70033 O WAT 89 52.733 27.093 134.496 1.00 0.00 O ATOM 70034 H1 WAT 89 51.893 26.655 134.366 1.00 0.00 H ATOM 70035 H2 WAT 89 53.265 26.455 134.973 1.00 0.00 H TER 70037 WAT 89 ATOM 70037 O WAT 90 1.518 120.027 96.044 1.00 0.00 O ATOM 70038 H1 WAT 90 2.308 120.011 95.504 1.00 0.00 H ATOM 70039 H2 WAT 90 1.088 120.851 95.814 1.00 0.00 H TER 70041 WAT 90 ATOM 70041 O WAT 91 105.192 25.594 117.668 1.00 0.00 O ATOM 70042 H1 WAT 91 105.050 24.942 116.982 1.00 0.00 H ATOM 70043 H2 WAT 91 104.901 25.164 118.472 1.00 0.00 H TER 70045 WAT 91 ATOM 70045 O WAT 92 98.578 134.454 102.399 1.00 0.00 O ATOM 70046 H1 WAT 92 97.981 133.737 102.184 1.00 0.00 H ATOM 70047 H2 WAT 92 98.094 135.246 102.167 1.00 0.00 H TER 70049 WAT 92 ATOM 70049 O WAT 93 4.755 77.188 124.653 1.00 0.00 O ATOM 70050 H1 WAT 93 4.129 76.472 124.760 1.00 0.00 H ATOM 70051 H2 WAT 93 5.600 76.753 124.543 1.00 0.00 H TER 70053 WAT 93 ATOM 70053 O WAT 94 142.216 95.403 154.446 1.00 0.00 O ATOM 70054 H1 WAT 94 142.810 94.652 154.447 1.00 0.00 H ATOM 70055 H2 WAT 94 142.545 95.969 155.145 1.00 0.00 H TER 70057 WAT 94 ATOM 70057 O WAT 95 26.769 119.418 120.262 1.00 0.00 O ATOM 70058 H1 WAT 95 26.037 119.182 119.691 1.00 0.00 H ATOM 70059 H2 WAT 95 27.168 118.581 120.498 1.00 0.00 H TER 70061 WAT 95 ATOM 70061 O WAT 96 98.385 112.194 19.923 1.00 0.00 O ATOM 70062 H1 WAT 96 99.288 112.509 19.977 1.00 0.00 H ATOM 70063 H2 WAT 96 97.855 112.938 20.211 1.00 0.00 H TER 70065 WAT 96 ATOM 70065 O WAT 97 114.846 51.398 16.060 1.00 0.00 O ATOM 70066 H1 WAT 97 114.590 51.781 16.899 1.00 0.00 H ATOM 70067 H2 WAT 97 114.726 50.456 16.180 1.00 0.00 H TER 70069 WAT 97 ATOM 70069 O WAT 98 52.339 15.982 118.984 1.00 0.00 O ATOM 70070 H1 WAT 98 52.363 15.527 118.142 1.00 0.00 H ATOM 70071 H2 WAT 98 52.525 15.300 119.630 1.00 0.00 H TER 70073 WAT 98 ATOM 70073 O WAT 99 121.978 47.195 90.102 1.00 0.00 O ATOM 70074 H1 WAT 99 121.494 46.805 89.374 1.00 0.00 H ATOM 70075 H2 WAT 99 122.115 46.472 90.713 1.00 0.00 H TER 70077 WAT 99 ATOM 70077 O WAT 100 105.481 32.496 149.707 1.00 0.00 O ATOM 70078 H1 WAT 100 106.262 32.550 150.259 1.00 0.00 H ATOM 70079 H2 WAT 100 104.758 32.714 150.295 1.00 0.00 H TER 70081 WAT 100 ATOM 70081 O WAT 101 59.559 85.588 84.172 1.00 0.00 O ATOM 70082 H1 WAT 101 60.400 86.044 84.134 1.00 0.00 H ATOM 70083 H2 WAT 101 59.620 85.040 84.954 1.00 0.00 H TER 70085 WAT 101 ATOM 70085 O WAT 102 13.199 5.950 99.209 1.00 0.00 O ATOM 70086 H1 WAT 102 12.963 5.165 99.703 1.00 0.00 H ATOM 70087 H2 WAT 102 12.362 6.314 98.922 1.00 0.00 H TER 70089 WAT 102 ATOM 70089 O WAT 103 22.235 73.583 5.896 1.00 0.00 O ATOM 70090 H1 WAT 103 21.768 72.837 5.519 1.00 0.00 H ATOM 70091 H2 WAT 103 23.040 73.646 5.383 1.00 0.00 H TER 70093 WAT 103 ATOM 70093 O WAT 104 51.490 132.157 62.257 1.00 0.00 O ATOM 70094 H1 WAT 104 51.836 131.660 61.516 1.00 0.00 H ATOM 70095 H2 WAT 104 51.334 131.499 62.934 1.00 0.00 H TER 70097 WAT 104 ATOM 70097 O WAT 105 19.572 49.653 81.787 1.00 0.00 O ATOM 70098 H1 WAT 105 20.277 49.403 82.385 1.00 0.00 H ATOM 70099 H2 WAT 105 18.790 49.680 82.337 1.00 0.00 H TER 70101 WAT 105 ATOM 70101 O WAT 106 119.350 79.634 102.217 1.00 0.00 O ATOM 70102 H1 WAT 106 119.966 79.353 102.894 1.00 0.00 H ATOM 70103 H2 WAT 106 118.488 79.423 102.575 1.00 0.00 H TER 70105 WAT 106 ATOM 70105 O WAT 107 121.252 61.208 128.200 1.00 0.00 O ATOM 70106 H1 WAT 107 120.943 62.101 128.051 1.00 0.00 H ATOM 70107 H2 WAT 107 121.342 60.836 127.323 1.00 0.00 H TER 70109 WAT 107 ATOM 70109 O WAT 108 103.568 120.323 95.106 1.00 0.00 O ATOM 70110 H1 WAT 108 103.260 120.746 95.908 1.00 0.00 H ATOM 70111 H2 WAT 108 103.813 121.048 94.532 1.00 0.00 H TER 70113 WAT 108 ATOM 70113 O WAT 109 82.487 58.054 144.037 1.00 0.00 O ATOM 70114 H1 WAT 109 82.218 57.582 143.249 1.00 0.00 H ATOM 70115 H2 WAT 109 83.383 57.758 144.200 1.00 0.00 H TER 70117 WAT 109 ATOM 70117 O WAT 110 142.462 65.304 135.184 1.00 0.00 O ATOM 70118 H1 WAT 110 141.793 64.704 135.514 1.00 0.00 H ATOM 70119 H2 WAT 110 142.223 65.450 134.269 1.00 0.00 H TER 70121 WAT 110 ATOM 70121 O WAT 111 114.935 48.791 133.205 1.00 0.00 O ATOM 70122 H1 WAT 111 114.893 48.709 134.158 1.00 0.00 H ATOM 70123 H2 WAT 111 114.028 48.691 132.916 1.00 0.00 H TER 70125 WAT 111 ATOM 70125 O WAT 112 123.406 145.238 100.736 1.00 0.00 O ATOM 70126 H1 WAT 112 123.248 146.172 100.870 1.00 0.00 H ATOM 70127 H2 WAT 112 123.349 144.857 101.612 1.00 0.00 H TER 70129 WAT 112 ATOM 70129 O WAT 113 120.380 87.161 76.946 1.00 0.00 O ATOM 70130 H1 WAT 113 119.591 86.823 76.522 1.00 0.00 H ATOM 70131 H2 WAT 113 120.966 86.407 76.999 1.00 0.00 H TER 70133 WAT 113 ATOM 70133 O WAT 114 37.030 11.419 23.033 1.00 0.00 O ATOM 70134 H1 WAT 114 37.827 11.907 23.238 1.00 0.00 H ATOM 70135 H2 WAT 114 37.124 10.595 23.511 1.00 0.00 H TER 70137 WAT 114 ATOM 70137 O WAT 115 72.355 22.841 97.466 1.00 0.00 O ATOM 70138 H1 WAT 115 72.596 23.200 98.320 1.00 0.00 H ATOM 70139 H2 WAT 115 73.130 22.357 97.182 1.00 0.00 H TER 70141 WAT 115 ATOM 70141 O WAT 116 133.545 115.883 25.884 1.00 0.00 O ATOM 70142 H1 WAT 116 133.326 115.165 26.479 1.00 0.00 H ATOM 70143 H2 WAT 116 133.485 116.670 26.426 1.00 0.00 H TER 70145 WAT 116 ATOM 70145 O WAT 117 55.686 7.179 84.005 1.00 0.00 O ATOM 70146 H1 WAT 117 56.120 7.352 83.170 1.00 0.00 H ATOM 70147 H2 WAT 117 55.606 6.226 84.041 1.00 0.00 H TER 70149 WAT 117 ATOM 70149 O WAT 118 107.032 78.214 66.511 1.00 0.00 O ATOM 70150 H1 WAT 118 107.159 78.165 65.563 1.00 0.00 H ATOM 70151 H2 WAT 118 107.802 77.782 66.879 1.00 0.00 H TER 70153 WAT 118 ATOM 70153 O WAT 119 114.117 131.670 95.411 1.00 0.00 O ATOM 70154 H1 WAT 119 113.439 132.038 94.846 1.00 0.00 H ATOM 70155 H2 WAT 119 114.686 132.412 95.617 1.00 0.00 H TER 70157 WAT 119 ATOM 70157 O WAT 120 63.365 2.637 52.036 1.00 0.00 O ATOM 70158 H1 WAT 120 62.628 3.035 51.573 1.00 0.00 H ATOM 70159 H2 WAT 120 64.007 3.342 52.115 1.00 0.00 H TER 70161 WAT 120 ATOM 70161 O WAT 121 135.817 22.064 116.254 1.00 0.00 O ATOM 70162 H1 WAT 121 136.695 21.733 116.442 1.00 0.00 H ATOM 70163 H2 WAT 121 135.885 23.010 116.380 1.00 0.00 H TER 70165 WAT 121 ATOM 70165 O WAT 122 110.157 60.966 97.293 1.00 0.00 O ATOM 70166 H1 WAT 122 110.061 60.305 96.607 1.00 0.00 H ATOM 70167 H2 WAT 122 110.303 60.461 98.093 1.00 0.00 H TER 70169 WAT 122 ATOM 70169 O WAT 123 99.962 110.532 80.522 1.00 0.00 O ATOM 70170 H1 WAT 123 100.324 109.912 81.155 1.00 0.00 H ATOM 70171 H2 WAT 123 99.237 110.952 80.986 1.00 0.00 H TER 70173 WAT 123 ATOM 70173 O WAT 124 14.339 32.684 146.637 1.00 0.00 O ATOM 70174 H1 WAT 124 13.571 33.164 146.947 1.00 0.00 H ATOM 70175 H2 WAT 124 14.917 32.639 147.398 1.00 0.00 H TER 70177 WAT 124 ATOM 70177 O WAT 125 77.875 117.930 69.942 1.00 0.00 O ATOM 70178 H1 WAT 125 77.460 118.783 69.819 1.00 0.00 H ATOM 70179 H2 WAT 125 77.283 117.311 69.515 1.00 0.00 H TER 70181 WAT 125 ATOM 70181 O WAT 126 31.786 130.845 83.109 1.00 0.00 O ATOM 70182 H1 WAT 126 31.266 130.198 83.585 1.00 0.00 H ATOM 70183 H2 WAT 126 32.117 131.433 83.788 1.00 0.00 H TER 70185 WAT 126 ATOM 70185 O WAT 127 54.463 14.413 111.439 1.00 0.00 O ATOM 70186 H1 WAT 127 55.342 14.605 111.110 1.00 0.00 H ATOM 70187 H2 WAT 127 54.372 13.466 111.339 1.00 0.00 H TER 70189 WAT 127 ATOM 70189 O WAT 128 72.317 10.974 11.388 1.00 0.00 O ATOM 70190 H1 WAT 128 72.764 10.249 11.826 1.00 0.00 H ATOM 70191 H2 WAT 128 71.707 11.311 12.043 1.00 0.00 H TER 70193 WAT 128 ATOM 70193 O WAT 129 4.768 83.317 55.635 1.00 0.00 O ATOM 70194 H1 WAT 129 5.540 82.985 56.093 1.00 0.00 H ATOM 70195 H2 WAT 129 4.035 82.841 56.025 1.00 0.00 H TER 70197 WAT 129 ATOM 70197 O WAT 130 2.273 90.117 139.046 1.00 0.00 O ATOM 70198 H1 WAT 130 2.058 89.942 138.129 1.00 0.00 H ATOM 70199 H2 WAT 130 3.183 89.835 139.136 1.00 0.00 H TER 70201 WAT 130 ATOM 70201 O WAT 131 122.804 139.549 66.710 1.00 0.00 O ATOM 70202 H1 WAT 131 123.335 139.947 67.400 1.00 0.00 H ATOM 70203 H2 WAT 131 122.898 138.607 66.849 1.00 0.00 H TER 70205 WAT 131 ATOM 70205 O WAT 132 40.171 73.427 124.366 1.00 0.00 O ATOM 70206 H1 WAT 132 41.020 73.154 124.712 1.00 0.00 H ATOM 70207 H2 WAT 132 40.162 74.378 124.476 1.00 0.00 H TER 70209 WAT 132 ATOM 70209 O WAT 133 43.589 6.332 63.146 1.00 0.00 O ATOM 70210 H1 WAT 133 44.065 5.707 62.600 1.00 0.00 H ATOM 70211 H2 WAT 133 42.691 6.002 63.160 1.00 0.00 H TER 70213 WAT 133 ATOM 70213 O WAT 134 59.245 136.407 153.808 1.00 0.00 O ATOM 70214 H1 WAT 134 58.786 135.764 154.348 1.00 0.00 H ATOM 70215 H2 WAT 134 58.625 137.131 153.719 1.00 0.00 H TER 70217 WAT 134 ATOM 70217 O WAT 135 95.952 5.130 119.477 1.00 0.00 O ATOM 70218 H1 WAT 135 95.285 4.808 120.085 1.00 0.00 H ATOM 70219 H2 WAT 135 96.567 5.612 120.030 1.00 0.00 H TER 70221 WAT 135 ATOM 70221 O WAT 136 125.514 56.118 54.104 1.00 0.00 O ATOM 70222 H1 WAT 136 126.387 55.741 54.212 1.00 0.00 H ATOM 70223 H2 WAT 136 125.652 56.887 53.551 1.00 0.00 H TER 70225 WAT 136 ATOM 70225 O WAT 137 146.095 26.172 80.903 1.00 0.00 O ATOM 70226 H1 WAT 137 145.849 25.402 81.416 1.00 0.00 H ATOM 70227 H2 WAT 137 145.439 26.215 80.207 1.00 0.00 H TER 70229 WAT 137 ATOM 70229 O WAT 138 50.379 28.029 91.939 1.00 0.00 O ATOM 70230 H1 WAT 138 49.521 28.073 91.518 1.00 0.00 H ATOM 70231 H2 WAT 138 50.700 27.150 91.738 1.00 0.00 H TER 70233 WAT 138 ATOM 70233 O WAT 139 106.302 9.844 122.289 1.00 0.00 O ATOM 70234 H1 WAT 139 106.174 8.895 122.281 1.00 0.00 H ATOM 70235 H2 WAT 139 106.862 10.017 121.533 1.00 0.00 H TER 70237 WAT 139 ATOM 70237 O WAT 140 120.951 67.531 22.499 1.00 0.00 O ATOM 70238 H1 WAT 140 120.681 66.644 22.738 1.00 0.00 H ATOM 70239 H2 WAT 140 120.462 67.722 21.699 1.00 0.00 H TER 70241 WAT 140 ATOM 70241 O WAT 141 22.464 74.213 18.466 1.00 0.00 O ATOM 70242 H1 WAT 141 22.178 74.356 19.369 1.00 0.00 H ATOM 70243 H2 WAT 141 23.253 73.677 18.547 1.00 0.00 H TER 70245 WAT 141 ATOM 70245 O WAT 142 144.678 120.136 108.240 1.00 0.00 O ATOM 70246 H1 WAT 142 145.012 120.816 108.825 1.00 0.00 H ATOM 70247 H2 WAT 142 144.982 120.398 107.371 1.00 0.00 H TER 70249 WAT 142 ATOM 70249 O WAT 143 72.615 47.459 104.710 1.00 0.00 O ATOM 70250 H1 WAT 143 72.968 48.126 105.299 1.00 0.00 H ATOM 70251 H2 WAT 143 72.356 47.944 103.926 1.00 0.00 H TER 70253 WAT 143 ATOM 70253 O WAT 144 20.803 83.737 7.988 1.00 0.00 O ATOM 70254 H1 WAT 144 20.002 83.730 7.463 1.00 0.00 H ATOM 70255 H2 WAT 144 20.674 84.452 8.611 1.00 0.00 H TER 70257 WAT 144 ATOM 70257 O WAT 145 128.549 35.386 105.719 1.00 0.00 O ATOM 70258 H1 WAT 145 127.899 36.042 105.970 1.00 0.00 H ATOM 70259 H2 WAT 145 128.570 34.775 106.456 1.00 0.00 H TER 70261 WAT 145 ATOM 70261 O WAT 146 124.972 12.478 80.835 1.00 0.00 O ATOM 70262 H1 WAT 146 124.727 11.568 80.668 1.00 0.00 H ATOM 70263 H2 WAT 146 124.137 12.945 80.884 1.00 0.00 H TER 70265 WAT 146 ATOM 70265 O WAT 147 7.432 17.976 106.504 1.00 0.00 O ATOM 70266 H1 WAT 147 7.496 18.904 106.727 1.00 0.00 H ATOM 70267 H2 WAT 147 7.752 17.520 107.282 1.00 0.00 H TER 70269 WAT 147 ATOM 70269 O WAT 148 58.793 92.723 93.392 1.00 0.00 O ATOM 70270 H1 WAT 148 59.231 93.396 92.872 1.00 0.00 H ATOM 70271 H2 WAT 148 59.506 92.227 93.793 1.00 0.00 H TER 70273 WAT 148 ATOM 70273 O WAT 149 54.181 23.490 75.840 1.00 0.00 O ATOM 70274 H1 WAT 149 53.751 22.669 76.082 1.00 0.00 H ATOM 70275 H2 WAT 149 54.293 23.955 76.670 1.00 0.00 H TER 70277 WAT 149 ATOM 70277 O WAT 150 74.335 93.328 75.613 1.00 0.00 O ATOM 70278 H1 WAT 150 74.730 92.603 76.098 1.00 0.00 H ATOM 70279 H2 WAT 150 74.440 93.087 74.693 1.00 0.00 H TER 70281 WAT 150 ATOM 70281 O WAT 151 110.625 104.431 124.712 1.00 0.00 O ATOM 70282 H1 WAT 151 110.572 104.680 125.634 1.00 0.00 H ATOM 70283 H2 WAT 151 111.179 103.651 124.705 1.00 0.00 H TER 70285 WAT 151 ATOM 70285 O WAT 152 37.217 122.447 110.110 1.00 0.00 O ATOM 70286 H1 WAT 152 38.164 122.363 110.225 1.00 0.00 H ATOM 70287 H2 WAT 152 37.073 122.281 109.179 1.00 0.00 H TER 70289 WAT 152 ATOM 70289 O WAT 153 92.897 140.214 110.318 1.00 0.00 O ATOM 70290 H1 WAT 153 93.496 139.811 110.947 1.00 0.00 H ATOM 70291 H2 WAT 153 93.350 140.144 109.478 1.00 0.00 H TER 70293 WAT 153 ATOM 70293 O WAT 154 36.111 47.134 84.872 1.00 0.00 O ATOM 70294 H1 WAT 154 35.761 46.525 85.522 1.00 0.00 H ATOM 70295 H2 WAT 154 35.492 47.864 84.868 1.00 0.00 H TER 70297 WAT 154 ATOM 70297 O WAT 155 111.677 117.643 7.263 1.00 0.00 O ATOM 70298 H1 WAT 155 112.388 117.441 6.655 1.00 0.00 H ATOM 70299 H2 WAT 155 112.007 118.377 7.782 1.00 0.00 H TER 70301 WAT 155 ATOM 70301 O WAT 156 47.563 139.017 83.709 1.00 0.00 O ATOM 70302 H1 WAT 156 46.729 139.407 83.972 1.00 0.00 H ATOM 70303 H2 WAT 156 48.056 138.933 84.525 1.00 0.00 H TER 70305 WAT 156 ATOM 70305 O WAT 157 124.905 39.907 115.902 1.00 0.00 O ATOM 70306 H1 WAT 157 125.662 40.420 116.184 1.00 0.00 H ATOM 70307 H2 WAT 157 124.184 40.536 115.882 1.00 0.00 H TER 70309 WAT 157 ATOM 70309 O WAT 158 47.816 137.737 139.174 1.00 0.00 O ATOM 70310 H1 WAT 158 48.212 136.969 138.762 1.00 0.00 H ATOM 70311 H2 WAT 158 47.758 138.383 138.470 1.00 0.00 H TER 70313 WAT 158 ATOM 70313 O WAT 159 124.492 106.548 85.634 1.00 0.00 O ATOM 70314 H1 WAT 159 124.199 107.448 85.492 1.00 0.00 H ATOM 70315 H2 WAT 159 125.330 106.494 85.174 1.00 0.00 H TER 70317 WAT 159 ATOM 70317 O WAT 160 100.660 133.030 104.246 1.00 0.00 O ATOM 70318 H1 WAT 160 99.741 132.988 104.509 1.00 0.00 H ATOM 70319 H2 WAT 160 100.904 133.947 104.375 1.00 0.00 H TER 70321 WAT 160 ATOM 70321 O WAT 161 59.744 7.511 143.752 1.00 0.00 O ATOM 70322 H1 WAT 161 60.613 7.686 143.390 1.00 0.00 H ATOM 70323 H2 WAT 161 59.165 7.502 142.991 1.00 0.00 H TER 70325 WAT 161 ATOM 70325 O WAT 162 138.877 3.743 147.055 1.00 0.00 O ATOM 70326 H1 WAT 162 139.081 4.235 146.260 1.00 0.00 H ATOM 70327 H2 WAT 162 139.612 3.921 147.642 1.00 0.00 H TER 70329 WAT 162 ATOM 70329 O WAT 163 84.166 82.431 84.221 1.00 0.00 O ATOM 70330 H1 WAT 163 84.044 83.211 83.679 1.00 0.00 H ATOM 70331 H2 WAT 163 85.052 82.520 84.571 1.00 0.00 H TER 70333 WAT 163 ATOM 70333 O WAT 164 80.838 139.917 84.065 1.00 0.00 O ATOM 70334 H1 WAT 164 81.692 139.627 84.387 1.00 0.00 H ATOM 70335 H2 WAT 164 81.026 140.324 83.220 1.00 0.00 H TER 70337 WAT 164 ATOM 70337 O WAT 165 6.841 124.433 118.640 1.00 0.00 O ATOM 70338 H1 WAT 165 6.661 123.633 118.146 1.00 0.00 H ATOM 70339 H2 WAT 165 7.783 124.570 118.539 1.00 0.00 H TER 70341 WAT 165 ATOM 70341 O WAT 166 61.489 124.992 109.714 1.00 0.00 O ATOM 70342 H1 WAT 166 61.345 125.514 110.504 1.00 0.00 H ATOM 70343 H2 WAT 166 60.609 124.777 109.406 1.00 0.00 H TER 70345 WAT 166 ATOM 70345 O WAT 167 111.677 133.815 14.703 1.00 0.00 O ATOM 70346 H1 WAT 167 112.363 133.259 15.073 1.00 0.00 H ATOM 70347 H2 WAT 167 110.994 133.203 14.429 1.00 0.00 H TER 70349 WAT 167 ATOM 70349 O WAT 168 47.502 96.265 21.149 1.00 0.00 O ATOM 70350 H1 WAT 168 48.086 95.560 20.870 1.00 0.00 H ATOM 70351 H2 WAT 168 47.772 97.020 20.625 1.00 0.00 H TER 70353 WAT 168 ATOM 70353 O WAT 169 45.157 37.774 63.897 1.00 0.00 O ATOM 70354 H1 WAT 169 45.821 37.660 63.217 1.00 0.00 H ATOM 70355 H2 WAT 169 45.617 38.219 64.609 1.00 0.00 H TER 70357 WAT 169 ATOM 70357 O WAT 170 3.836 5.878 3.445 1.00 0.00 O ATOM 70358 H1 WAT 170 4.685 5.473 3.624 1.00 0.00 H ATOM 70359 H2 WAT 170 4.034 6.590 2.836 1.00 0.00 H TER 70361 WAT 170 ATOM 70361 O WAT 171 99.112 58.364 117.318 1.00 0.00 O ATOM 70362 H1 WAT 171 99.348 57.463 117.539 1.00 0.00 H ATOM 70363 H2 WAT 171 99.532 58.521 116.473 1.00 0.00 H TER 70365 WAT 171 ATOM 70365 O WAT 172 88.593 4.897 113.437 1.00 0.00 O ATOM 70366 H1 WAT 172 88.357 5.080 112.528 1.00 0.00 H ATOM 70367 H2 WAT 172 87.765 4.949 113.914 1.00 0.00 H TER 70369 WAT 172 ATOM 70369 O WAT 173 124.497 46.927 75.235 1.00 0.00 O ATOM 70370 H1 WAT 173 124.052 46.131 74.946 1.00 0.00 H ATOM 70371 H2 WAT 173 124.547 46.842 76.187 1.00 0.00 H TER 70373 WAT 173 ATOM 70373 O WAT 174 17.447 47.255 74.890 1.00 0.00 O ATOM 70374 H1 WAT 174 17.418 46.318 75.084 1.00 0.00 H ATOM 70375 H2 WAT 174 17.766 47.657 75.699 1.00 0.00 H TER 70377 WAT 174 ATOM 70377 O WAT 175 30.857 100.649 91.852 1.00 0.00 O ATOM 70378 H1 WAT 175 30.328 100.300 92.569 1.00 0.00 H ATOM 70379 H2 WAT 175 31.734 100.301 92.009 1.00 0.00 H TER 70381 WAT 175 ATOM 70381 O WAT 176 24.432 19.235 122.764 1.00 0.00 O ATOM 70382 H1 WAT 176 24.295 18.579 122.080 1.00 0.00 H ATOM 70383 H2 WAT 176 24.184 18.791 123.575 1.00 0.00 H TER 70385 WAT 176 ATOM 70385 O WAT 177 116.476 113.035 116.528 1.00 0.00 O ATOM 70386 H1 WAT 177 116.626 113.177 117.463 1.00 0.00 H ATOM 70387 H2 WAT 177 117.353 113.005 116.146 1.00 0.00 H TER 70389 WAT 177 ATOM 70389 O WAT 178 67.785 55.112 132.771 1.00 0.00 O ATOM 70390 H1 WAT 178 68.424 54.486 133.111 1.00 0.00 H ATOM 70391 H2 WAT 178 67.271 54.610 132.138 1.00 0.00 H TER 70393 WAT 178 ATOM 70393 O WAT 179 107.137 33.575 126.509 1.00 0.00 O ATOM 70394 H1 WAT 179 106.337 33.196 126.872 1.00 0.00 H ATOM 70395 H2 WAT 179 106.962 33.651 125.571 1.00 0.00 H TER 70397 WAT 179 ATOM 70397 O WAT 180 55.964 104.347 79.991 1.00 0.00 O ATOM 70398 H1 WAT 180 55.639 104.432 79.095 1.00 0.00 H ATOM 70399 H2 WAT 180 55.684 105.153 80.426 1.00 0.00 H TER 70401 WAT 180 ATOM 70401 O WAT 181 129.475 43.389 114.679 1.00 0.00 O ATOM 70402 H1 WAT 181 130.388 43.334 114.962 1.00 0.00 H ATOM 70403 H2 WAT 181 129.150 42.491 114.741 1.00 0.00 H TER 70405 WAT 181 ATOM 70405 O WAT 182 113.720 45.119 92.275 1.00 0.00 O ATOM 70406 H1 WAT 182 113.739 44.163 92.259 1.00 0.00 H ATOM 70407 H2 WAT 182 112.881 45.349 91.874 1.00 0.00 H TER 70409 WAT 182 ATOM 70409 O WAT 183 37.056 89.250 63.098 1.00 0.00 O ATOM 70410 H1 WAT 183 37.304 90.154 63.294 1.00 0.00 H ATOM 70411 H2 WAT 183 37.366 89.105 62.204 1.00 0.00 H TER 70413 WAT 183 ATOM 70413 O WAT 184 4.329 9.174 144.329 1.00 0.00 O ATOM 70414 H1 WAT 184 4.824 8.998 145.129 1.00 0.00 H ATOM 70415 H2 WAT 184 3.417 9.019 144.574 1.00 0.00 H TER 70417 WAT 184 ATOM 70417 O WAT 185 41.745 70.797 79.813 1.00 0.00 O ATOM 70418 H1 WAT 185 41.163 70.165 79.389 1.00 0.00 H ATOM 70419 H2 WAT 185 41.444 71.649 79.497 1.00 0.00 H TER 70421 WAT 185 ATOM 70421 O WAT 186 70.760 13.512 141.073 1.00 0.00 O ATOM 70422 H1 WAT 186 71.565 14.025 141.003 1.00 0.00 H ATOM 70423 H2 WAT 186 70.139 14.098 141.507 1.00 0.00 H TER 70425 WAT 186 ATOM 70425 O WAT 187 89.573 34.597 126.190 1.00 0.00 O ATOM 70426 H1 WAT 187 88.723 34.231 126.435 1.00 0.00 H ATOM 70427 H2 WAT 187 89.877 34.038 125.474 1.00 0.00 H TER 70429 WAT 187 ATOM 70429 O WAT 188 63.882 53.223 102.921 1.00 0.00 O ATOM 70430 H1 WAT 188 64.760 52.880 102.755 1.00 0.00 H ATOM 70431 H2 WAT 188 63.293 52.562 102.558 1.00 0.00 H TER 70433 WAT 188 ATOM 70433 O WAT 189 105.807 32.238 13.573 1.00 0.00 O ATOM 70434 H1 WAT 189 106.101 31.335 13.694 1.00 0.00 H ATOM 70435 H2 WAT 189 105.334 32.446 14.379 1.00 0.00 H TER 70437 WAT 189 ATOM 70437 O WAT 190 89.766 28.326 144.909 1.00 0.00 O ATOM 70438 H1 WAT 190 88.984 28.452 145.446 1.00 0.00 H ATOM 70439 H2 WAT 190 89.909 29.174 144.490 1.00 0.00 H TER 70441 WAT 190 ATOM 70441 O WAT 191 21.013 34.120 105.935 1.00 0.00 O ATOM 70442 H1 WAT 191 21.372 34.283 106.807 1.00 0.00 H ATOM 70443 H2 WAT 191 21.499 33.361 105.614 1.00 0.00 H TER 70445 WAT 191 ATOM 70445 O WAT 192 38.949 144.773 89.249 1.00 0.00 O ATOM 70446 H1 WAT 192 39.673 144.178 89.054 1.00 0.00 H ATOM 70447 H2 WAT 192 38.897 144.783 90.204 1.00 0.00 H TER 70449 WAT 192 ATOM 70449 O WAT 193 91.005 66.400 98.787 1.00 0.00 O ATOM 70450 H1 WAT 193 90.811 67.336 98.736 1.00 0.00 H ATOM 70451 H2 WAT 193 91.491 66.212 97.984 1.00 0.00 H TER 70453 WAT 193 ATOM 70453 O WAT 194 110.546 137.040 140.593 1.00 0.00 O ATOM 70454 H1 WAT 194 109.706 136.657 140.846 1.00 0.00 H ATOM 70455 H2 WAT 194 111.198 136.406 140.892 1.00 0.00 H TER 70457 WAT 194 ATOM 70457 O WAT 195 98.075 61.671 63.059 1.00 0.00 O ATOM 70458 H1 WAT 195 98.728 61.100 62.654 1.00 0.00 H ATOM 70459 H2 WAT 195 98.568 62.447 63.326 1.00 0.00 H TER 70461 WAT 195 ATOM 70461 O WAT 196 47.866 123.965 105.194 1.00 0.00 O ATOM 70462 H1 WAT 196 46.955 124.255 105.222 1.00 0.00 H ATOM 70463 H2 WAT 196 48.366 124.712 105.523 1.00 0.00 H TER 70465 WAT 196 ATOM 70465 O WAT 197 39.362 20.900 104.966 1.00 0.00 O ATOM 70466 H1 WAT 197 39.833 20.455 104.262 1.00 0.00 H ATOM 70467 H2 WAT 197 39.689 20.493 105.769 1.00 0.00 H TER 70469 WAT 197 ATOM 70469 O WAT 198 48.261 139.280 97.235 1.00 0.00 O ATOM 70470 H1 WAT 198 49.204 139.195 97.096 1.00 0.00 H ATOM 70471 H2 WAT 198 47.868 138.794 96.510 1.00 0.00 H TER 70473 WAT 198 ATOM 70473 O WAT 199 135.224 35.156 144.789 1.00 0.00 O ATOM 70474 H1 WAT 199 135.248 34.875 145.703 1.00 0.00 H ATOM 70475 H2 WAT 199 136.143 35.185 144.522 1.00 0.00 H TER 70477 WAT 199 ATOM 70477 O WAT 200 78.404 111.049 17.905 1.00 0.00 O ATOM 70478 H1 WAT 200 78.421 110.222 18.385 1.00 0.00 H ATOM 70479 H2 WAT 200 78.868 111.665 18.472 1.00 0.00 H TER 70481 WAT 200 ATOM 70481 O WAT 201 99.014 9.158 131.316 1.00 0.00 O ATOM 70482 H1 WAT 201 99.337 10.054 131.409 1.00 0.00 H ATOM 70483 H2 WAT 201 98.099 9.202 131.596 1.00 0.00 H TER 70485 WAT 201 ATOM 70485 O WAT 202 88.758 142.074 126.071 1.00 0.00 O ATOM 70486 H1 WAT 202 88.551 142.974 126.324 1.00 0.00 H ATOM 70487 H2 WAT 202 88.092 141.850 125.421 1.00 0.00 H TER 70489 WAT 202 ATOM 70489 O WAT 203 138.854 72.388 134.253 1.00 0.00 O ATOM 70490 H1 WAT 203 137.994 72.718 134.514 1.00 0.00 H ATOM 70491 H2 WAT 203 138.925 71.536 134.682 1.00 0.00 H TER 70493 WAT 203 ATOM 70493 O WAT 204 106.773 21.151 10.846 1.00 0.00 O ATOM 70494 H1 WAT 204 106.362 20.313 10.633 1.00 0.00 H ATOM 70495 H2 WAT 204 107.128 21.461 10.012 1.00 0.00 H TER 70497 WAT 204 ATOM 70497 O WAT 205 143.001 48.470 101.036 1.00 0.00 O ATOM 70498 H1 WAT 205 142.512 47.649 100.985 1.00 0.00 H ATOM 70499 H2 WAT 205 143.014 48.683 101.970 1.00 0.00 H TER 70501 WAT 205 ATOM 70501 O WAT 206 53.415 32.911 130.904 1.00 0.00 O ATOM 70502 H1 WAT 206 53.069 32.595 131.739 1.00 0.00 H ATOM 70503 H2 WAT 206 53.506 32.123 130.369 1.00 0.00 H TER 70505 WAT 206 ATOM 70505 O WAT 207 132.912 77.099 134.791 1.00 0.00 O ATOM 70506 H1 WAT 207 133.757 77.110 134.343 1.00 0.00 H ATOM 70507 H2 WAT 207 132.653 78.019 134.839 1.00 0.00 H TER 70509 WAT 207 ATOM 70509 O WAT 208 51.876 108.049 117.820 1.00 0.00 O ATOM 70510 H1 WAT 208 52.327 107.417 118.379 1.00 0.00 H ATOM 70511 H2 WAT 208 51.954 108.880 118.288 1.00 0.00 H TER 70513 WAT 208 ATOM 70513 O WAT 209 117.033 95.885 11.951 1.00 0.00 O ATOM 70514 H1 WAT 209 116.744 96.772 11.738 1.00 0.00 H ATOM 70515 H2 WAT 209 116.702 95.731 12.836 1.00 0.00 H TER 70517 WAT 209 ATOM 70517 O WAT 210 22.292 13.320 149.772 1.00 0.00 O ATOM 70518 H1 WAT 210 21.700 13.639 149.090 1.00 0.00 H ATOM 70519 H2 WAT 210 21.850 12.550 150.131 1.00 0.00 H TER 70521 WAT 210 ATOM 70521 O WAT 211 43.762 57.780 77.282 1.00 0.00 O ATOM 70522 H1 WAT 211 43.706 58.521 77.886 1.00 0.00 H ATOM 70523 H2 WAT 211 44.214 58.131 76.515 1.00 0.00 H TER 70525 WAT 211 ATOM 70525 O WAT 212 71.143 105.368 122.843 1.00 0.00 O ATOM 70526 H1 WAT 212 70.293 104.928 122.820 1.00 0.00 H ATOM 70527 H2 WAT 212 71.762 104.709 122.530 1.00 0.00 H TER 70529 WAT 212 ATOM 70529 O WAT 213 144.849 100.013 56.183 1.00 0.00 O ATOM 70530 H1 WAT 213 144.839 100.890 56.565 1.00 0.00 H ATOM 70531 H2 WAT 213 143.926 99.803 56.040 1.00 0.00 H TER 70533 WAT 213 ATOM 70533 O WAT 214 69.074 19.643 69.029 1.00 0.00 O ATOM 70534 H1 WAT 214 68.745 19.047 69.703 1.00 0.00 H ATOM 70535 H2 WAT 214 70.012 19.458 68.985 1.00 0.00 H TER 70537 WAT 214 ATOM 70537 O WAT 215 140.777 65.538 119.932 1.00 0.00 O ATOM 70538 H1 WAT 215 140.475 66.202 119.312 1.00 0.00 H ATOM 70539 H2 WAT 215 140.851 66.004 120.765 1.00 0.00 H TER 70541 WAT 215 ATOM 70541 O WAT 216 3.419 19.622 14.801 1.00 0.00 O ATOM 70542 H1 WAT 216 3.564 18.695 14.989 1.00 0.00 H ATOM 70543 H2 WAT 216 3.576 19.703 13.860 1.00 0.00 H TER 70545 WAT 216 ATOM 70545 O WAT 217 92.710 46.541 124.332 1.00 0.00 O ATOM 70546 H1 WAT 217 93.432 45.952 124.552 1.00 0.00 H ATOM 70547 H2 WAT 217 93.039 47.061 123.600 1.00 0.00 H TER 70549 WAT 217 ATOM 70549 O WAT 218 134.375 142.705 138.399 1.00 0.00 O ATOM 70550 H1 WAT 218 133.544 143.177 138.354 1.00 0.00 H ATOM 70551 H2 WAT 218 134.267 141.972 137.793 1.00 0.00 H TER 70553 WAT 218 ATOM 70553 O WAT 219 77.135 90.382 144.990 1.00 0.00 O ATOM 70554 H1 WAT 219 76.973 91.304 144.790 1.00 0.00 H ATOM 70555 H2 WAT 219 77.542 90.033 144.198 1.00 0.00 H TER 70557 WAT 219 ATOM 70557 O WAT 220 86.856 99.324 90.328 1.00 0.00 O ATOM 70558 H1 WAT 220 87.726 98.998 90.096 1.00 0.00 H ATOM 70559 H2 WAT 220 86.961 99.681 91.210 1.00 0.00 H TER 70561 WAT 220 ATOM 70561 O WAT 221 102.809 100.318 74.831 1.00 0.00 O ATOM 70562 H1 WAT 221 103.215 100.600 75.650 1.00 0.00 H ATOM 70563 H2 WAT 221 103.537 99.996 74.301 1.00 0.00 H TER 70565 WAT 221 ATOM 70565 O WAT 222 22.488 2.803 100.739 1.00 0.00 O ATOM 70566 H1 WAT 222 23.167 2.296 101.185 1.00 0.00 H ATOM 70567 H2 WAT 222 22.138 3.382 101.416 1.00 0.00 H TER 70569 WAT 222 ATOM 70569 O WAT 223 33.968 128.141 70.064 1.00 0.00 O ATOM 70570 H1 WAT 223 34.772 128.114 69.544 1.00 0.00 H ATOM 70571 H2 WAT 223 34.270 128.251 70.965 1.00 0.00 H TER 70573 WAT 223 ATOM 70573 O WAT 224 106.872 53.158 83.708 1.00 0.00 O ATOM 70574 H1 WAT 224 106.951 53.785 82.989 1.00 0.00 H ATOM 70575 H2 WAT 224 107.708 53.218 84.171 1.00 0.00 H TER 70577 WAT 224 ATOM 70577 O WAT 225 38.697 94.664 140.074 1.00 0.00 O ATOM 70578 H1 WAT 225 39.232 94.408 139.322 1.00 0.00 H ATOM 70579 H2 WAT 225 38.418 95.557 139.875 1.00 0.00 H TER 70581 WAT 225 ATOM 70581 O WAT 226 15.411 66.092 155.179 1.00 0.00 O ATOM 70582 H1 WAT 226 14.916 66.369 154.408 1.00 0.00 H ATOM 70583 H2 WAT 226 14.747 65.959 155.855 1.00 0.00 H TER 70585 WAT 226 ATOM 70585 O WAT 227 43.804 41.718 92.031 1.00 0.00 O ATOM 70586 H1 WAT 227 43.529 41.071 92.680 1.00 0.00 H ATOM 70587 H2 WAT 227 43.322 42.511 92.265 1.00 0.00 H TER 70589 WAT 227 ATOM 70589 O WAT 228 15.989 135.800 158.634 1.00 0.00 O ATOM 70590 H1 WAT 228 15.110 135.888 158.267 1.00 0.00 H ATOM 70591 H2 WAT 228 15.893 135.155 159.334 1.00 0.00 H TER 70593 WAT 228 ATOM 70593 O WAT 229 29.477 113.710 58.690 1.00 0.00 O ATOM 70594 H1 WAT 229 28.771 114.349 58.598 1.00 0.00 H ATOM 70595 H2 WAT 229 29.053 112.935 59.059 1.00 0.00 H TER 70597 WAT 229 ATOM 70597 O WAT 230 86.500 100.146 14.875 1.00 0.00 O ATOM 70598 H1 WAT 230 86.374 99.756 14.011 1.00 0.00 H ATOM 70599 H2 WAT 230 87.343 99.804 15.172 1.00 0.00 H TER 70601 WAT 230 ATOM 70601 O WAT 231 115.078 36.587 156.638 1.00 0.00 O ATOM 70602 H1 WAT 231 114.888 37.153 155.889 1.00 0.00 H ATOM 70603 H2 WAT 231 114.529 35.815 156.500 1.00 0.00 H TER 70605 WAT 231 ATOM 70605 O WAT 232 84.923 27.633 73.381 1.00 0.00 O ATOM 70606 H1 WAT 232 84.370 28.167 72.812 1.00 0.00 H ATOM 70607 H2 WAT 232 84.311 27.056 73.838 1.00 0.00 H TER 70609 WAT 232 ATOM 70609 O WAT 233 51.905 94.026 126.021 1.00 0.00 O ATOM 70610 H1 WAT 233 51.218 94.684 126.125 1.00 0.00 H ATOM 70611 H2 WAT 233 52.395 94.059 126.842 1.00 0.00 H TER 70613 WAT 233 ATOM 70613 O WAT 234 102.229 70.269 145.116 1.00 0.00 O ATOM 70614 H1 WAT 234 102.048 71.183 145.334 1.00 0.00 H ATOM 70615 H2 WAT 234 103.067 70.082 145.539 1.00 0.00 H TER 70617 WAT 234 ATOM 70617 O WAT 235 108.325 3.169 5.808 1.00 0.00 O ATOM 70618 H1 WAT 235 108.697 3.956 5.411 1.00 0.00 H ATOM 70619 H2 WAT 235 107.691 2.852 5.165 1.00 0.00 H TER 70621 WAT 235 ATOM 70621 O WAT 236 87.386 32.428 154.250 1.00 0.00 O ATOM 70622 H1 WAT 236 87.300 32.915 153.431 1.00 0.00 H ATOM 70623 H2 WAT 236 88.122 32.843 154.700 1.00 0.00 H TER 70625 WAT 236 ATOM 70625 O WAT 237 125.310 95.100 138.968 1.00 0.00 O ATOM 70626 H1 WAT 237 124.817 94.420 138.509 1.00 0.00 H ATOM 70627 H2 WAT 237 126.072 95.260 138.411 1.00 0.00 H TER 70629 WAT 237 ATOM 70629 O WAT 238 32.526 134.053 72.263 1.00 0.00 O ATOM 70630 H1 WAT 238 32.094 133.206 72.375 1.00 0.00 H ATOM 70631 H2 WAT 238 33.429 133.900 72.539 1.00 0.00 H TER 70633 WAT 238 ATOM 70633 O WAT 239 28.564 37.628 80.115 1.00 0.00 O ATOM 70634 H1 WAT 239 27.759 37.577 79.601 1.00 0.00 H ATOM 70635 H2 WAT 239 28.294 38.021 80.945 1.00 0.00 H TER 70637 WAT 239 ATOM 70637 O WAT 240 30.008 57.017 152.680 1.00 0.00 O ATOM 70638 H1 WAT 240 30.854 57.067 153.125 1.00 0.00 H ATOM 70639 H2 WAT 240 29.643 57.898 152.758 1.00 0.00 H TER 70641 WAT 240 ATOM 70641 O WAT 241 111.256 101.491 64.036 1.00 0.00 O ATOM 70642 H1 WAT 241 111.126 100.543 64.046 1.00 0.00 H ATOM 70643 H2 WAT 241 110.664 101.821 64.712 1.00 0.00 H TER 70645 WAT 241 ATOM 70645 O WAT 242 111.407 8.747 150.690 1.00 0.00 O ATOM 70646 H1 WAT 242 111.540 7.802 150.767 1.00 0.00 H ATOM 70647 H2 WAT 242 110.621 8.921 151.208 1.00 0.00 H TER 70649 WAT 242 ATOM 70649 O WAT 243 124.613 111.074 92.145 1.00 0.00 O ATOM 70650 H1 WAT 243 125.547 110.971 91.960 1.00 0.00 H ATOM 70651 H2 WAT 243 124.573 111.258 93.083 1.00 0.00 H TER 70653 WAT 243 ATOM 70653 O WAT 244 31.182 5.650 91.768 1.00 0.00 O ATOM 70654 H1 WAT 244 31.838 4.956 91.708 1.00 0.00 H ATOM 70655 H2 WAT 244 30.477 5.268 92.292 1.00 0.00 H TER 70657 WAT 244 ATOM 70657 O WAT 245 133.889 72.431 116.422 1.00 0.00 O ATOM 70658 H1 WAT 245 134.720 72.330 116.887 1.00 0.00 H ATOM 70659 H2 WAT 245 133.430 71.604 116.569 1.00 0.00 H TER 70661 WAT 245 ATOM 70661 O WAT 246 122.516 76.535 95.274 1.00 0.00 O ATOM 70662 H1 WAT 246 123.422 76.823 95.164 1.00 0.00 H ATOM 70663 H2 WAT 246 122.208 76.367 94.383 1.00 0.00 H TER 70665 WAT 246 ATOM 70665 O WAT 247 101.127 89.753 133.968 1.00 0.00 O ATOM 70666 H1 WAT 247 101.847 89.188 134.251 1.00 0.00 H ATOM 70667 H2 WAT 247 100.955 90.317 134.722 1.00 0.00 H TER 70669 WAT 247 ATOM 70669 O WAT 248 53.363 131.923 83.878 1.00 0.00 O ATOM 70670 H1 WAT 248 52.718 132.626 83.954 1.00 0.00 H ATOM 70671 H2 WAT 248 54.009 132.258 83.256 1.00 0.00 H TER 70673 WAT 248 ATOM 70673 O WAT 249 128.490 71.699 153.626 1.00 0.00 O ATOM 70674 H1 WAT 249 129.060 72.257 154.155 1.00 0.00 H ATOM 70675 H2 WAT 249 128.829 71.785 152.735 1.00 0.00 H TER 70677 WAT 249 ATOM 70677 O WAT 250 12.784 97.447 66.447 1.00 0.00 O ATOM 70678 H1 WAT 250 12.362 97.330 65.596 1.00 0.00 H ATOM 70679 H2 WAT 250 12.155 97.094 67.076 1.00 0.00 H TER 70681 WAT 250 ATOM 70681 O WAT 251 85.851 28.044 141.163 1.00 0.00 O ATOM 70682 H1 WAT 251 86.780 28.104 140.942 1.00 0.00 H ATOM 70683 H2 WAT 251 85.804 28.315 142.080 1.00 0.00 H TER 70685 WAT 251 ATOM 70685 O WAT 252 96.612 69.154 111.021 1.00 0.00 O ATOM 70686 H1 WAT 252 96.846 68.377 110.513 1.00 0.00 H ATOM 70687 H2 WAT 252 96.645 68.863 111.933 1.00 0.00 H TER 70689 WAT 252 ATOM 70689 O WAT 253 134.772 105.818 82.873 1.00 0.00 O ATOM 70690 H1 WAT 253 133.881 105.482 82.771 1.00 0.00 H ATOM 70691 H2 WAT 253 135.199 105.192 83.457 1.00 0.00 H TER 70693 WAT 253 ATOM 70693 O WAT 254 96.881 106.751 122.126 1.00 0.00 O ATOM 70694 H1 WAT 254 96.434 106.993 122.937 1.00 0.00 H ATOM 70695 H2 WAT 254 97.812 106.789 122.344 1.00 0.00 H TER 70697 WAT 254 ATOM 70697 O WAT 255 83.143 76.610 156.524 1.00 0.00 O ATOM 70698 H1 WAT 255 82.685 77.198 155.924 1.00 0.00 H ATOM 70699 H2 WAT 255 82.490 75.950 156.758 1.00 0.00 H TER 70701 WAT 255 ATOM 70701 O WAT 256 128.696 13.679 115.147 1.00 0.00 O ATOM 70702 H1 WAT 256 129.359 13.938 114.507 1.00 0.00 H ATOM 70703 H2 WAT 256 128.184 13.004 114.702 1.00 0.00 H TER 70705 WAT 256 ATOM 70705 O WAT 257 97.650 40.754 75.288 1.00 0.00 O ATOM 70706 H1 WAT 257 97.763 41.554 75.802 1.00 0.00 H ATOM 70707 H2 WAT 257 98.532 40.388 75.219 1.00 0.00 H TER 70709 WAT 257 ATOM 70709 O WAT 258 16.188 114.737 158.238 1.00 0.00 O ATOM 70710 H1 WAT 258 16.775 115.474 158.407 1.00 0.00 H ATOM 70711 H2 WAT 258 15.584 114.737 158.980 1.00 0.00 H TER 70713 WAT 258 ATOM 70713 O WAT 259 41.052 133.405 102.323 1.00 0.00 O ATOM 70714 H1 WAT 259 41.300 134.104 101.717 1.00 0.00 H ATOM 70715 H2 WAT 259 40.233 133.059 101.967 1.00 0.00 H TER 70717 WAT 259 ATOM 70717 O WAT 260 74.185 92.978 88.785 1.00 0.00 O ATOM 70718 H1 WAT 260 74.212 92.601 87.905 1.00 0.00 H ATOM 70719 H2 WAT 260 75.086 92.914 89.101 1.00 0.00 H TER 70721 WAT 260 ATOM 70721 O WAT 261 31.485 105.399 63.579 1.00 0.00 O ATOM 70722 H1 WAT 261 32.120 105.884 64.107 1.00 0.00 H ATOM 70723 H2 WAT 261 30.918 106.075 63.206 1.00 0.00 H TER 70725 WAT 261 ATOM 70725 O WAT 262 28.492 128.063 2.913 1.00 0.00 O ATOM 70726 H1 WAT 262 28.122 128.834 2.481 1.00 0.00 H ATOM 70727 H2 WAT 262 28.220 127.328 2.364 1.00 0.00 H TER 70729 WAT 262 ATOM 70729 O WAT 263 19.118 22.905 11.859 1.00 0.00 O ATOM 70730 H1 WAT 263 19.557 22.752 12.696 1.00 0.00 H ATOM 70731 H2 WAT 263 19.034 22.034 11.470 1.00 0.00 H TER 70733 WAT 263 ATOM 70733 O WAT 264 136.757 44.932 4.215 1.00 0.00 O ATOM 70734 H1 WAT 264 137.607 45.141 3.830 1.00 0.00 H ATOM 70735 H2 WAT 264 136.519 44.089 3.828 1.00 0.00 H TER 70737 WAT 264 ATOM 70737 O WAT 265 11.543 70.172 59.525 1.00 0.00 O ATOM 70738 H1 WAT 265 11.475 69.326 59.082 1.00 0.00 H ATOM 70739 H2 WAT 265 11.794 69.953 60.422 1.00 0.00 H TER 70741 WAT 265 ATOM 70741 O WAT 266 101.841 75.569 76.672 1.00 0.00 O ATOM 70742 H1 WAT 266 102.757 75.846 76.659 1.00 0.00 H ATOM 70743 H2 WAT 266 101.386 76.222 76.140 1.00 0.00 H TER 70745 WAT 266 ATOM 70745 O WAT 267 21.541 70.598 105.278 1.00 0.00 O ATOM 70746 H1 WAT 267 22.401 70.571 105.698 1.00 0.00 H ATOM 70747 H2 WAT 267 21.196 69.711 105.382 1.00 0.00 H TER 70749 WAT 267 ATOM 70749 O WAT 268 130.420 70.550 87.165 1.00 0.00 O ATOM 70750 H1 WAT 268 130.496 71.483 86.961 1.00 0.00 H ATOM 70751 H2 WAT 268 131.323 70.235 87.186 1.00 0.00 H TER 70753 WAT 268 ATOM 70753 O WAT 269 97.813 67.806 118.589 1.00 0.00 O ATOM 70754 H1 WAT 269 98.027 67.802 117.656 1.00 0.00 H ATOM 70755 H2 WAT 269 98.419 68.441 118.971 1.00 0.00 H TER 70757 WAT 269 ATOM 70757 O WAT 270 25.874 111.360 117.044 1.00 0.00 O ATOM 70758 H1 WAT 270 25.626 112.266 116.858 1.00 0.00 H ATOM 70759 H2 WAT 270 25.246 110.834 116.549 1.00 0.00 H TER 70761 WAT 270 ATOM 70761 O WAT 271 27.544 40.462 105.680 1.00 0.00 O ATOM 70762 H1 WAT 271 28.020 39.793 105.187 1.00 0.00 H ATOM 70763 H2 WAT 271 27.820 41.290 105.287 1.00 0.00 H TER 70765 WAT 271 ATOM 70765 O WAT 272 12.303 21.413 74.876 1.00 0.00 O ATOM 70766 H1 WAT 272 11.623 21.741 75.464 1.00 0.00 H ATOM 70767 H2 WAT 272 12.000 20.542 74.620 1.00 0.00 H TER 70769 WAT 272 ATOM 70769 O WAT 273 9.264 17.300 132.244 1.00 0.00 O ATOM 70770 H1 WAT 273 10.101 17.603 132.595 1.00 0.00 H ATOM 70771 H2 WAT 273 9.494 16.849 131.431 1.00 0.00 H TER 70773 WAT 273 ATOM 70773 O WAT 274 116.847 45.642 78.999 1.00 0.00 O ATOM 70774 H1 WAT 274 117.040 44.705 79.023 1.00 0.00 H ATOM 70775 H2 WAT 274 116.739 45.841 78.070 1.00 0.00 H TER 70777 WAT 274 ATOM 70777 O WAT 275 18.196 127.197 142.962 1.00 0.00 O ATOM 70778 H1 WAT 275 18.263 128.115 142.698 1.00 0.00 H ATOM 70779 H2 WAT 275 17.806 127.227 143.836 1.00 0.00 H TER 70781 WAT 275 ATOM 70781 O WAT 276 110.777 117.080 132.047 1.00 0.00 O ATOM 70782 H1 WAT 276 110.571 117.706 132.741 1.00 0.00 H ATOM 70783 H2 WAT 276 109.970 116.581 131.926 1.00 0.00 H TER 70785 WAT 276 ATOM 70785 O WAT 277 114.034 20.438 58.660 1.00 0.00 O ATOM 70786 H1 WAT 277 113.750 21.299 58.965 1.00 0.00 H ATOM 70787 H2 WAT 277 113.221 19.967 58.478 1.00 0.00 H TER 70789 WAT 277 ATOM 70789 O WAT 278 51.336 99.441 98.236 1.00 0.00 O ATOM 70790 H1 WAT 278 51.915 99.510 97.477 1.00 0.00 H ATOM 70791 H2 WAT 278 51.635 98.655 98.694 1.00 0.00 H TER 70793 WAT 278 ATOM 70793 O WAT 279 3.060 144.859 105.846 1.00 0.00 O ATOM 70794 H1 WAT 279 2.919 145.248 106.709 1.00 0.00 H ATOM 70795 H2 WAT 279 3.722 145.418 105.437 1.00 0.00 H TER 70797 WAT 279 ATOM 70797 O WAT 280 53.461 106.540 119.735 1.00 0.00 O ATOM 70798 H1 WAT 280 52.832 105.870 119.469 1.00 0.00 H ATOM 70799 H2 WAT 280 53.136 106.852 120.580 1.00 0.00 H TER 70801 WAT 280 ATOM 70801 O WAT 281 137.132 108.389 96.103 1.00 0.00 O ATOM 70802 H1 WAT 281 136.494 109.002 95.737 1.00 0.00 H ATOM 70803 H2 WAT 281 137.497 107.939 95.341 1.00 0.00 H TER 70805 WAT 281 ATOM 70805 O WAT 282 73.990 2.744 134.906 1.00 0.00 O ATOM 70806 H1 WAT 282 73.887 1.792 134.884 1.00 0.00 H ATOM 70807 H2 WAT 282 73.109 3.083 134.748 1.00 0.00 H TER 70809 WAT 282 ATOM 70809 O WAT 283 87.528 118.456 108.238 1.00 0.00 O ATOM 70810 H1 WAT 283 86.583 118.604 108.253 1.00 0.00 H ATOM 70811 H2 WAT 283 87.774 118.382 109.160 1.00 0.00 H TER 70813 WAT 283 ATOM 70813 O WAT 284 101.455 139.390 149.881 1.00 0.00 O ATOM 70814 H1 WAT 284 101.274 138.498 150.174 1.00 0.00 H ATOM 70815 H2 WAT 284 101.864 139.282 149.022 1.00 0.00 H TER 70817 WAT 284 ATOM 70817 O WAT 285 40.394 65.545 0.589 1.00 0.00 O ATOM 70818 H1 WAT 285 40.389 66.480 0.796 1.00 0.00 H ATOM 70819 H2 WAT 285 41.302 65.274 0.726 1.00 0.00 H TER 70821 WAT 285 ATOM 70821 O WAT 286 25.599 86.250 72.796 1.00 0.00 O ATOM 70822 H1 WAT 286 24.810 86.763 72.969 1.00 0.00 H ATOM 70823 H2 WAT 286 26.268 86.643 73.357 1.00 0.00 H TER 70825 WAT 286 ATOM 70825 O WAT 287 111.691 43.948 70.383 1.00 0.00 O ATOM 70826 H1 WAT 287 110.989 44.522 70.076 1.00 0.00 H ATOM 70827 H2 WAT 287 111.526 43.848 71.320 1.00 0.00 H TER 70829 WAT 287 ATOM 70829 O WAT 288 57.901 79.025 85.658 1.00 0.00 O ATOM 70830 H1 WAT 288 57.449 79.865 85.743 1.00 0.00 H ATOM 70831 H2 WAT 288 58.461 79.131 84.890 1.00 0.00 H TER 70833 WAT 288 ATOM 70833 O WAT 289 60.361 98.186 121.964 1.00 0.00 O ATOM 70834 H1 WAT 289 61.150 98.727 121.980 1.00 0.00 H ATOM 70835 H2 WAT 289 60.258 97.884 122.866 1.00 0.00 H TER 70837 WAT 289 ATOM 70837 O WAT 290 41.815 6.735 7.134 1.00 0.00 O ATOM 70838 H1 WAT 290 41.608 6.870 8.059 1.00 0.00 H ATOM 70839 H2 WAT 290 42.421 5.995 7.130 1.00 0.00 H TER 70841 WAT 290 ATOM 70841 O WAT 291 35.339 119.681 100.150 1.00 0.00 O ATOM 70842 H1 WAT 291 35.746 120.305 100.750 1.00 0.00 H ATOM 70843 H2 WAT 291 35.285 120.149 99.317 1.00 0.00 H TER 70845 WAT 291 ATOM 70845 O WAT 292 106.520 20.444 114.751 1.00 0.00 O ATOM 70846 H1 WAT 292 106.683 21.161 115.364 1.00 0.00 H ATOM 70847 H2 WAT 292 105.566 20.381 114.704 1.00 0.00 H TER 70849 WAT 292 ATOM 70849 O WAT 293 35.900 18.440 77.186 1.00 0.00 O ATOM 70850 H1 WAT 293 36.827 18.280 77.011 1.00 0.00 H ATOM 70851 H2 WAT 293 35.457 18.202 76.372 1.00 0.00 H TER 70853 WAT 293 ATOM 70853 O WAT 294 111.602 112.772 2.747 1.00 0.00 O ATOM 70854 H1 WAT 294 110.878 112.314 2.322 1.00 0.00 H ATOM 70855 H2 WAT 294 112.058 112.092 3.243 1.00 0.00 H TER 70857 WAT 294 ATOM 70857 O WAT 295 69.016 36.196 115.218 1.00 0.00 O ATOM 70858 H1 WAT 295 68.497 35.397 115.310 1.00 0.00 H ATOM 70859 H2 WAT 295 69.283 36.204 114.299 1.00 0.00 H TER 70861 WAT 295 ATOM 70861 O WAT 296 72.020 107.378 97.160 1.00 0.00 O ATOM 70862 H1 WAT 296 71.709 107.058 96.313 1.00 0.00 H ATOM 70863 H2 WAT 296 72.716 107.997 96.941 1.00 0.00 H TER 70865 WAT 296 ATOM 70865 O WAT 297 142.154 43.580 122.644 1.00 0.00 O ATOM 70866 H1 WAT 297 142.444 44.445 122.933 1.00 0.00 H ATOM 70867 H2 WAT 297 142.013 43.091 123.455 1.00 0.00 H TER 70869 WAT 297 ATOM 70869 O WAT 298 29.359 99.564 4.883 1.00 0.00 O ATOM 70870 H1 WAT 298 30.259 99.276 4.732 1.00 0.00 H ATOM 70871 H2 WAT 298 29.369 99.924 5.770 1.00 0.00 H TER 70873 WAT 298 ATOM 70873 O WAT 299 144.792 108.241 91.988 1.00 0.00 O ATOM 70874 H1 WAT 299 145.366 108.761 91.424 1.00 0.00 H ATOM 70875 H2 WAT 299 144.442 107.562 91.411 1.00 0.00 H TER 70877 WAT 299 ATOM 70877 O WAT 300 68.434 12.775 139.626 1.00 0.00 O ATOM 70878 H1 WAT 300 67.697 12.775 140.237 1.00 0.00 H ATOM 70879 H2 WAT 300 69.102 13.309 140.056 1.00 0.00 H TER 70881 WAT 300 ATOM 70881 O WAT 301 47.667 115.867 13.929 1.00 0.00 O ATOM 70882 H1 WAT 301 48.251 116.259 14.578 1.00 0.00 H ATOM 70883 H2 WAT 301 48.006 114.979 13.808 1.00 0.00 H TER 70885 WAT 301 ATOM 70885 O WAT 302 116.340 20.954 69.665 1.00 0.00 O ATOM 70886 H1 WAT 302 116.672 21.422 68.899 1.00 0.00 H ATOM 70887 H2 WAT 302 115.714 20.324 69.307 1.00 0.00 H TER 70889 WAT 302 ATOM 70889 O WAT 303 40.603 34.798 109.462 1.00 0.00 O ATOM 70890 H1 WAT 303 41.187 34.069 109.252 1.00 0.00 H ATOM 70891 H2 WAT 303 40.250 34.580 110.324 1.00 0.00 H TER 70893 WAT 303 ATOM 70893 O WAT 304 135.442 13.255 149.161 1.00 0.00 O ATOM 70894 H1 WAT 304 136.301 13.158 149.574 1.00 0.00 H ATOM 70895 H2 WAT 304 135.608 13.114 148.229 1.00 0.00 H TER 70897 WAT 304 ATOM 70897 O WAT 305 61.760 68.476 78.553 1.00 0.00 O ATOM 70898 H1 WAT 305 61.403 67.878 79.209 1.00 0.00 H ATOM 70899 H2 WAT 305 61.333 69.314 78.735 1.00 0.00 H TER 70901 WAT 305 ATOM 70901 O WAT 306 75.775 126.955 86.490 1.00 0.00 O ATOM 70902 H1 WAT 306 75.457 127.142 85.607 1.00 0.00 H ATOM 70903 H2 WAT 306 76.445 127.620 86.649 1.00 0.00 H TER 70905 WAT 306 ATOM 70905 O WAT 307 30.249 64.156 126.924 1.00 0.00 O ATOM 70906 H1 WAT 307 30.155 64.837 127.590 1.00 0.00 H ATOM 70907 H2 WAT 307 29.484 64.266 126.359 1.00 0.00 H TER 70909 WAT 307 ATOM 70909 O WAT 308 79.376 86.447 157.800 1.00 0.00 O ATOM 70910 H1 WAT 308 80.108 85.913 158.107 1.00 0.00 H ATOM 70911 H2 WAT 308 79.105 86.947 158.570 1.00 0.00 H TER 70913 WAT 308 ATOM 70913 O WAT 309 71.434 11.894 65.949 1.00 0.00 O ATOM 70914 H1 WAT 309 70.771 12.518 65.653 1.00 0.00 H ATOM 70915 H2 WAT 309 72.119 12.439 66.337 1.00 0.00 H TER 70917 WAT 309 ATOM 70917 O WAT 310 142.863 8.336 89.330 1.00 0.00 O ATOM 70918 H1 WAT 310 142.976 8.025 88.432 1.00 0.00 H ATOM 70919 H2 WAT 310 143.255 9.209 89.333 1.00 0.00 H TER 70921 WAT 310 ATOM 70921 O WAT 311 74.504 12.012 64.227 1.00 0.00 O ATOM 70922 H1 WAT 311 74.092 12.520 63.529 1.00 0.00 H ATOM 70923 H2 WAT 311 74.987 11.323 63.769 1.00 0.00 H TER 70925 WAT 311 ATOM 70925 O WAT 312 18.122 85.451 122.287 1.00 0.00 O ATOM 70926 H1 WAT 312 18.622 86.108 121.803 1.00 0.00 H ATOM 70927 H2 WAT 312 18.685 84.677 122.293 1.00 0.00 H TER 70929 WAT 312 ATOM 70929 O WAT 313 134.046 114.760 156.409 1.00 0.00 O ATOM 70930 H1 WAT 313 134.770 114.530 155.826 1.00 0.00 H ATOM 70931 H2 WAT 313 134.126 115.706 156.527 1.00 0.00 H TER 70933 WAT 313 ATOM 70933 O WAT 314 53.476 69.405 98.757 1.00 0.00 O ATOM 70934 H1 WAT 314 53.051 69.868 98.036 1.00 0.00 H ATOM 70935 H2 WAT 314 52.761 68.958 99.211 1.00 0.00 H TER 70937 WAT 314 ATOM 70937 O WAT 315 90.887 59.476 71.338 1.00 0.00 O ATOM 70938 H1 WAT 315 90.552 58.630 71.041 1.00 0.00 H ATOM 70939 H2 WAT 315 90.469 59.614 72.189 1.00 0.00 H TER 70941 WAT 315 ATOM 70941 O WAT 316 144.241 27.067 123.418 1.00 0.00 O ATOM 70942 H1 WAT 316 143.922 26.692 124.239 1.00 0.00 H ATOM 70943 H2 WAT 316 144.101 28.009 123.515 1.00 0.00 H TER 70945 WAT 316 ATOM 70945 O WAT 317 23.724 19.878 101.222 1.00 0.00 O ATOM 70946 H1 WAT 317 24.033 18.972 101.247 1.00 0.00 H ATOM 70947 H2 WAT 317 24.511 20.403 101.366 1.00 0.00 H TER 70949 WAT 317 ATOM 70949 O WAT 318 44.312 122.632 64.388 1.00 0.00 O ATOM 70950 H1 WAT 318 43.626 122.972 63.813 1.00 0.00 H ATOM 70951 H2 WAT 318 43.987 122.797 65.273 1.00 0.00 H TER 70953 WAT 318 ATOM 70953 O WAT 319 83.740 23.236 135.625 1.00 0.00 O ATOM 70954 H1 WAT 319 83.742 24.058 135.135 1.00 0.00 H ATOM 70955 H2 WAT 319 83.683 23.504 136.542 1.00 0.00 H TER 70957 WAT 319 ATOM 70957 O WAT 320 3.600 83.675 71.113 1.00 0.00 O ATOM 70958 H1 WAT 320 4.046 84.403 70.681 1.00 0.00 H ATOM 70959 H2 WAT 320 4.021 82.892 70.758 1.00 0.00 H TER 70961 WAT 320 ATOM 70961 O WAT 321 51.764 94.416 73.103 1.00 0.00 O ATOM 70962 H1 WAT 321 52.013 94.111 73.975 1.00 0.00 H ATOM 70963 H2 WAT 321 50.839 94.185 73.023 1.00 0.00 H TER 70965 WAT 321 ATOM 70965 O WAT 322 117.160 27.643 78.784 1.00 0.00 O ATOM 70966 H1 WAT 322 117.665 27.770 77.980 1.00 0.00 H ATOM 70967 H2 WAT 322 116.665 28.455 78.886 1.00 0.00 H TER 70969 WAT 322 ATOM 70969 O WAT 323 1.497 52.140 96.647 1.00 0.00 O ATOM 70970 H1 WAT 323 1.449 51.738 95.779 1.00 0.00 H ATOM 70971 H2 WAT 323 2.101 52.874 96.537 1.00 0.00 H TER 70973 WAT 323 ATOM 70973 O WAT 324 32.277 84.962 12.091 1.00 0.00 O ATOM 70974 H1 WAT 324 33.219 84.909 11.932 1.00 0.00 H ATOM 70975 H2 WAT 324 32.202 85.362 12.957 1.00 0.00 H TER 70977 WAT 324 ATOM 70977 O WAT 325 132.171 70.655 83.715 1.00 0.00 O ATOM 70978 H1 WAT 325 132.532 71.081 84.493 1.00 0.00 H ATOM 70979 H2 WAT 325 131.283 71.006 83.641 1.00 0.00 H TER 70981 WAT 325 ATOM 70981 O WAT 326 63.624 39.096 78.982 1.00 0.00 O ATOM 70982 H1 WAT 326 62.850 39.364 79.477 1.00 0.00 H ATOM 70983 H2 WAT 326 63.693 39.739 78.277 1.00 0.00 H TER 70985 WAT 326 ATOM 70985 O WAT 327 136.829 21.320 0.847 1.00 0.00 O ATOM 70986 H1 WAT 327 137.029 21.534 -0.064 1.00 0.00 H ATOM 70987 H2 WAT 327 136.483 22.133 1.215 1.00 0.00 H TER 70989 WAT 327 ATOM 70989 O WAT 328 27.187 13.661 147.372 1.00 0.00 O ATOM 70990 H1 WAT 328 27.293 14.192 146.582 1.00 0.00 H ATOM 70991 H2 WAT 328 26.608 14.178 147.932 1.00 0.00 H TER 70993 WAT 328 ATOM 70993 O WAT 329 54.077 68.958 1.712 1.00 0.00 O ATOM 70994 H1 WAT 329 53.775 68.716 0.837 1.00 0.00 H ATOM 70995 H2 WAT 329 54.070 69.915 1.712 1.00 0.00 H TER 70997 WAT 329 ATOM 70997 O WAT 330 8.021 105.169 129.403 1.00 0.00 O ATOM 70998 H1 WAT 330 7.181 105.087 129.854 1.00 0.00 H ATOM 70999 H2 WAT 330 7.787 105.305 128.485 1.00 0.00 H TER 71001 WAT 330 ATOM 71001 O WAT 331 120.812 21.316 136.984 1.00 0.00 O ATOM 71002 H1 WAT 331 120.485 21.608 137.835 1.00 0.00 H ATOM 71003 H2 WAT 331 121.100 22.119 136.550 1.00 0.00 H TER 71005 WAT 331 ATOM 71005 O WAT 332 85.889 98.493 147.399 1.00 0.00 O ATOM 71006 H1 WAT 332 84.962 98.547 147.167 1.00 0.00 H ATOM 71007 H2 WAT 332 86.062 97.555 147.478 1.00 0.00 H TER 71009 WAT 332 ATOM 71009 O WAT 333 16.561 115.879 11.952 1.00 0.00 O ATOM 71010 H1 WAT 333 16.673 115.979 12.897 1.00 0.00 H ATOM 71011 H2 WAT 333 17.378 116.210 11.578 1.00 0.00 H TER 71013 WAT 333 ATOM 71013 O WAT 334 9.293 11.715 80.285 1.00 0.00 O ATOM 71014 H1 WAT 334 9.511 10.881 79.867 1.00 0.00 H ATOM 71015 H2 WAT 334 10.138 12.145 80.414 1.00 0.00 H TER 71017 WAT 334 ATOM 71017 O WAT 335 16.609 98.093 70.348 1.00 0.00 O ATOM 71018 H1 WAT 335 16.309 97.368 69.800 1.00 0.00 H ATOM 71019 H2 WAT 335 16.112 98.000 71.161 1.00 0.00 H TER 71021 WAT 335 ATOM 71021 O WAT 336 59.813 81.813 119.901 1.00 0.00 O ATOM 71022 H1 WAT 336 60.281 82.308 120.574 1.00 0.00 H ATOM 71023 H2 WAT 336 59.938 80.897 120.146 1.00 0.00 H TER 71025 WAT 336 ATOM 71025 O WAT 337 12.675 72.924 65.276 1.00 0.00 O ATOM 71026 H1 WAT 337 11.884 73.054 65.799 1.00 0.00 H ATOM 71027 H2 WAT 337 12.516 73.420 64.473 1.00 0.00 H TER 71029 WAT 337 ATOM 71029 O WAT 338 120.703 49.211 60.884 1.00 0.00 O ATOM 71030 H1 WAT 338 121.376 48.878 60.290 1.00 0.00 H ATOM 71031 H2 WAT 338 120.110 49.707 60.319 1.00 0.00 H TER 71033 WAT 338 ATOM 71033 O WAT 339 67.915 36.154 139.335 1.00 0.00 O ATOM 71034 H1 WAT 339 68.241 36.010 140.223 1.00 0.00 H ATOM 71035 H2 WAT 339 68.096 35.332 138.878 1.00 0.00 H TER 71037 WAT 339 ATOM 71037 O WAT 340 35.342 86.966 19.269 1.00 0.00 O ATOM 71038 H1 WAT 340 35.456 87.912 19.352 1.00 0.00 H ATOM 71039 H2 WAT 340 35.546 86.623 20.139 1.00 0.00 H TER 71041 WAT 340 ATOM 71041 O WAT 341 129.209 109.016 118.412 1.00 0.00 O ATOM 71042 H1 WAT 341 129.159 109.936 118.153 1.00 0.00 H ATOM 71043 H2 WAT 341 129.787 109.013 119.175 1.00 0.00 H TER 71045 WAT 341 ATOM 71045 O WAT 342 46.064 5.946 79.978 1.00 0.00 O ATOM 71046 H1 WAT 342 45.952 6.625 80.643 1.00 0.00 H ATOM 71047 H2 WAT 342 46.462 5.213 80.449 1.00 0.00 H TER 71049 WAT 342 ATOM 71049 O WAT 343 11.909 87.910 89.505 1.00 0.00 O ATOM 71050 H1 WAT 343 11.214 88.259 88.947 1.00 0.00 H ATOM 71051 H2 WAT 343 11.455 87.609 90.293 1.00 0.00 H TER 71053 WAT 343 ATOM 71053 O WAT 344 33.446 98.409 149.204 1.00 0.00 O ATOM 71054 H1 WAT 344 33.466 98.826 148.343 1.00 0.00 H ATOM 71055 H2 WAT 344 32.632 98.719 149.601 1.00 0.00 H TER 71057 WAT 344 ATOM 71057 O WAT 345 116.402 76.045 110.349 1.00 0.00 O ATOM 71058 H1 WAT 345 115.716 75.418 110.577 1.00 0.00 H ATOM 71059 H2 WAT 345 116.416 76.661 111.081 1.00 0.00 H TER 71061 WAT 345 ATOM 71061 O WAT 346 94.102 72.757 73.145 1.00 0.00 O ATOM 71062 H1 WAT 346 94.218 71.836 73.382 1.00 0.00 H ATOM 71063 H2 WAT 346 93.338 72.761 72.568 1.00 0.00 H TER 71065 WAT 346 ATOM 71065 O WAT 347 90.679 118.833 108.691 1.00 0.00 O ATOM 71066 H1 WAT 347 90.532 117.998 108.247 1.00 0.00 H ATOM 71067 H2 WAT 347 91.082 118.593 109.526 1.00 0.00 H TER 71069 WAT 347 ATOM 71069 O WAT 348 128.993 60.120 74.742 1.00 0.00 O ATOM 71070 H1 WAT 348 129.725 60.068 74.127 1.00 0.00 H ATOM 71071 H2 WAT 348 129.397 60.357 75.576 1.00 0.00 H TER 71073 WAT 348 ATOM 71073 O WAT 349 95.211 67.491 93.948 1.00 0.00 O ATOM 71074 H1 WAT 349 95.978 68.061 93.901 1.00 0.00 H ATOM 71075 H2 WAT 349 95.236 67.128 94.833 1.00 0.00 H TER 71077 WAT 349 ATOM 71077 O WAT 350 115.555 115.884 111.071 1.00 0.00 O ATOM 71078 H1 WAT 350 115.310 116.071 110.164 1.00 0.00 H ATOM 71079 H2 WAT 350 114.813 116.197 111.589 1.00 0.00 H TER 71081 WAT 350 ATOM 71081 O WAT 351 19.850 121.049 117.895 1.00 0.00 O ATOM 71082 H1 WAT 351 19.214 120.581 118.437 1.00 0.00 H ATOM 71083 H2 WAT 351 19.338 121.378 117.156 1.00 0.00 H TER 71085 WAT 351 ATOM 71085 O WAT 352 80.380 38.304 62.496 1.00 0.00 O ATOM 71086 H1 WAT 352 80.248 39.026 63.110 1.00 0.00 H ATOM 71087 H2 WAT 352 80.145 38.669 61.643 1.00 0.00 H TER 71089 WAT 352 ATOM 71089 O WAT 353 8.732 27.580 1.842 1.00 0.00 O ATOM 71090 H1 WAT 353 8.848 27.143 0.999 1.00 0.00 H ATOM 71091 H2 WAT 353 7.858 27.315 2.130 1.00 0.00 H TER 71093 WAT 353 ATOM 71093 O WAT 354 29.973 43.011 131.108 1.00 0.00 O ATOM 71094 H1 WAT 354 30.424 42.218 130.821 1.00 0.00 H ATOM 71095 H2 WAT 354 30.402 43.719 130.627 1.00 0.00 H TER 71097 WAT 354 ATOM 71097 O WAT 355 138.791 52.687 2.358 1.00 0.00 O ATOM 71098 H1 WAT 355 138.097 53.044 1.804 1.00 0.00 H ATOM 71099 H2 WAT 355 139.464 53.367 2.368 1.00 0.00 H TER 71101 WAT 355 ATOM 71101 O WAT 356 131.104 74.189 93.673 1.00 0.00 O ATOM 71102 H1 WAT 356 131.556 74.986 93.949 1.00 0.00 H ATOM 71103 H2 WAT 356 130.257 74.494 93.350 1.00 0.00 H TER 71105 WAT 356 ATOM 71105 O WAT 357 4.820 118.715 5.430 1.00 0.00 O ATOM 71106 H1 WAT 357 5.139 119.596 5.627 1.00 0.00 H ATOM 71107 H2 WAT 357 4.282 118.826 4.646 1.00 0.00 H TER 71109 WAT 357 ATOM 71109 O WAT 358 99.208 100.072 2.070 1.00 0.00 O ATOM 71110 H1 WAT 358 100.037 100.395 2.422 1.00 0.00 H ATOM 71111 H2 WAT 358 99.461 99.517 1.332 1.00 0.00 H TER 71113 WAT 358 ATOM 71113 O WAT 359 14.047 94.835 82.158 1.00 0.00 O ATOM 71114 H1 WAT 359 14.117 93.884 82.243 1.00 0.00 H ATOM 71115 H2 WAT 359 13.685 95.124 82.996 1.00 0.00 H TER 71117 WAT 359 ATOM 71117 O WAT 360 111.306 64.662 70.581 1.00 0.00 O ATOM 71118 H1 WAT 360 110.855 65.054 71.329 1.00 0.00 H ATOM 71119 H2 WAT 360 111.460 63.754 70.843 1.00 0.00 H TER 71121 WAT 360 ATOM 71121 O WAT 361 125.114 50.010 152.940 1.00 0.00 O ATOM 71122 H1 WAT 361 124.306 50.456 152.687 1.00 0.00 H ATOM 71123 H2 WAT 361 124.834 49.129 153.189 1.00 0.00 H TER 71125 WAT 361 ATOM 71125 O WAT 362 33.222 39.346 103.183 1.00 0.00 O ATOM 71126 H1 WAT 362 33.578 40.230 103.085 1.00 0.00 H ATOM 71127 H2 WAT 362 32.313 39.482 103.451 1.00 0.00 H TER 71129 WAT 362 ATOM 71129 O WAT 363 126.489 116.524 117.331 1.00 0.00 O ATOM 71130 H1 WAT 363 125.708 116.048 117.047 1.00 0.00 H ATOM 71131 H2 WAT 363 127.209 116.103 116.861 1.00 0.00 H TER 71133 WAT 363 ATOM 71133 O WAT 364 89.848 3.569 150.140 1.00 0.00 O ATOM 71134 H1 WAT 364 89.119 3.012 149.868 1.00 0.00 H ATOM 71135 H2 WAT 364 90.118 3.213 150.987 1.00 0.00 H TER 71137 WAT 364 ATOM 71137 O WAT 365 29.106 9.380 124.632 1.00 0.00 O ATOM 71138 H1 WAT 365 29.246 10.200 125.106 1.00 0.00 H ATOM 71139 H2 WAT 365 28.209 9.443 124.305 1.00 0.00 H TER 71141 WAT 365 ATOM 71141 O WAT 366 54.095 106.689 101.467 1.00 0.00 O ATOM 71142 H1 WAT 366 53.657 107.196 102.151 1.00 0.00 H ATOM 71143 H2 WAT 366 53.383 106.256 100.997 1.00 0.00 H TER 71145 WAT 366 ATOM 71145 O WAT 367 82.463 78.405 80.661 1.00 0.00 O ATOM 71146 H1 WAT 367 82.679 78.858 79.847 1.00 0.00 H ATOM 71147 H2 WAT 367 82.403 79.102 81.315 1.00 0.00 H TER 71149 WAT 367 ATOM 71149 O WAT 368 31.271 24.034 98.718 1.00 0.00 O ATOM 71150 H1 WAT 368 31.527 23.556 97.929 1.00 0.00 H ATOM 71151 H2 WAT 368 30.380 24.333 98.539 1.00 0.00 H TER 71153 WAT 368 ATOM 71153 O WAT 369 71.181 16.351 91.274 1.00 0.00 O ATOM 71154 H1 WAT 369 70.423 15.955 91.703 1.00 0.00 H ATOM 71155 H2 WAT 369 70.860 17.192 90.948 1.00 0.00 H TER 71157 WAT 369 ATOM 71157 O WAT 370 32.705 43.071 24.783 1.00 0.00 O ATOM 71158 H1 WAT 370 33.506 43.492 24.471 1.00 0.00 H ATOM 71159 H2 WAT 370 32.206 43.778 25.192 1.00 0.00 H TER 71161 WAT 370 ATOM 71161 O WAT 371 106.829 45.425 3.482 1.00 0.00 O ATOM 71162 H1 WAT 371 106.540 45.762 4.330 1.00 0.00 H ATOM 71163 H2 WAT 371 107.470 44.748 3.699 1.00 0.00 H TER 71165 WAT 371 ATOM 71165 O WAT 372 21.215 8.039 116.550 1.00 0.00 O ATOM 71166 H1 WAT 372 20.291 7.790 116.567 1.00 0.00 H ATOM 71167 H2 WAT 372 21.685 7.211 116.450 1.00 0.00 H TER 71169 WAT 372 ATOM 71169 O WAT 373 115.887 7.354 11.938 1.00 0.00 O ATOM 71170 H1 WAT 373 115.285 7.226 11.205 1.00 0.00 H ATOM 71171 H2 WAT 373 115.793 6.562 12.467 1.00 0.00 H TER 71173 WAT 373 ATOM 71173 O WAT 374 135.310 109.494 130.207 1.00 0.00 O ATOM 71174 H1 WAT 374 135.833 110.172 130.635 1.00 0.00 H ATOM 71175 H2 WAT 374 134.440 109.883 130.118 1.00 0.00 H TER 71177 WAT 374 ATOM 71177 O WAT 375 21.809 127.108 132.287 1.00 0.00 O ATOM 71178 H1 WAT 375 21.688 126.576 131.500 1.00 0.00 H ATOM 71179 H2 WAT 375 21.938 127.997 131.958 1.00 0.00 H TER 71181 WAT 375 ATOM 71181 O WAT 376 52.910 127.807 120.883 1.00 0.00 O ATOM 71182 H1 WAT 376 53.688 128.288 121.167 1.00 0.00 H ATOM 71183 H2 WAT 376 52.478 127.550 121.698 1.00 0.00 H TER 71185 WAT 376 ATOM 71185 O WAT 377 2.781 92.961 120.596 1.00 0.00 O ATOM 71186 H1 WAT 377 3.310 92.598 119.886 1.00 0.00 H ATOM 71187 H2 WAT 377 2.257 92.222 120.906 1.00 0.00 H TER 71189 WAT 377 ATOM 71189 O WAT 378 93.190 103.157 87.645 1.00 0.00 O ATOM 71190 H1 WAT 378 93.874 102.905 87.025 1.00 0.00 H ATOM 71191 H2 WAT 378 93.611 103.101 88.503 1.00 0.00 H TER 71193 WAT 378 ATOM 71193 O WAT 379 133.183 141.814 118.858 1.00 0.00 O ATOM 71194 H1 WAT 379 133.899 142.431 118.703 1.00 0.00 H ATOM 71195 H2 WAT 379 132.912 141.538 117.982 1.00 0.00 H TER 71197 WAT 379 ATOM 71197 O WAT 380 41.988 86.796 153.765 1.00 0.00 O ATOM 71198 H1 WAT 380 42.302 86.835 152.862 1.00 0.00 H ATOM 71199 H2 WAT 380 42.107 85.882 154.020 1.00 0.00 H TER 71201 WAT 380 ATOM 71201 O WAT 381 12.535 53.021 67.032 1.00 0.00 O ATOM 71202 H1 WAT 381 13.186 52.997 67.734 1.00 0.00 H ATOM 71203 H2 WAT 381 12.718 52.241 66.509 1.00 0.00 H TER 71205 WAT 381 ATOM 71205 O WAT 382 21.806 46.036 141.585 1.00 0.00 O ATOM 71206 H1 WAT 382 22.552 45.675 141.106 1.00 0.00 H ATOM 71207 H2 WAT 382 21.530 46.791 141.066 1.00 0.00 H TER 71209 WAT 382 ATOM 71209 O WAT 383 79.270 141.191 129.381 1.00 0.00 O ATOM 71210 H1 WAT 383 78.415 141.574 129.184 1.00 0.00 H ATOM 71211 H2 WAT 383 79.665 141.797 130.007 1.00 0.00 H TER 71213 WAT 383 ATOM 71213 O WAT 384 61.554 91.997 18.965 1.00 0.00 O ATOM 71214 H1 WAT 384 61.936 91.351 19.559 1.00 0.00 H ATOM 71215 H2 WAT 384 62.292 92.546 18.701 1.00 0.00 H TER 71217 WAT 384 ATOM 71217 O WAT 385 27.919 123.077 134.358 1.00 0.00 O ATOM 71218 H1 WAT 385 27.829 123.595 135.158 1.00 0.00 H ATOM 71219 H2 WAT 385 27.070 122.647 134.254 1.00 0.00 H TER 71221 WAT 385 ATOM 71221 O WAT 386 102.965 114.633 3.096 1.00 0.00 O ATOM 71222 H1 WAT 386 102.289 113.971 2.950 1.00 0.00 H ATOM 71223 H2 WAT 386 103.763 114.129 3.258 1.00 0.00 H TER 71225 WAT 386 ATOM 71225 O WAT 387 70.662 38.323 122.233 1.00 0.00 O ATOM 71226 H1 WAT 387 70.465 39.260 122.260 1.00 0.00 H ATOM 71227 H2 WAT 387 71.260 38.225 121.493 1.00 0.00 H TER 71229 WAT 387 ATOM 71229 O WAT 388 27.415 20.580 99.100 1.00 0.00 O ATOM 71230 H1 WAT 388 28.280 20.924 99.320 1.00 0.00 H ATOM 71231 H2 WAT 388 26.868 20.808 99.852 1.00 0.00 H TER 71233 WAT 388 ATOM 71233 O WAT 389 21.493 102.030 76.410 1.00 0.00 O ATOM 71234 H1 WAT 389 22.169 101.967 75.735 1.00 0.00 H ATOM 71235 H2 WAT 389 21.980 102.129 77.228 1.00 0.00 H TER 71237 WAT 389 ATOM 71237 O WAT 390 80.034 53.603 70.032 1.00 0.00 O ATOM 71238 H1 WAT 390 80.472 54.319 70.491 1.00 0.00 H ATOM 71239 H2 WAT 390 80.643 52.868 70.098 1.00 0.00 H TER 71241 WAT 390 ATOM 71241 O WAT 391 131.114 141.261 110.064 1.00 0.00 O ATOM 71242 H1 WAT 391 130.327 141.739 109.803 1.00 0.00 H ATOM 71243 H2 WAT 391 131.399 141.690 110.870 1.00 0.00 H TER 71245 WAT 391 ATOM 71245 O WAT 392 17.889 59.907 76.841 1.00 0.00 O ATOM 71246 H1 WAT 392 18.504 59.880 77.575 1.00 0.00 H ATOM 71247 H2 WAT 392 17.726 58.987 76.632 1.00 0.00 H TER 71249 WAT 392 ATOM 71249 O WAT 393 77.183 42.789 120.070 1.00 0.00 O ATOM 71250 H1 WAT 393 77.824 42.259 120.544 1.00 0.00 H ATOM 71251 H2 WAT 393 76.432 42.843 120.662 1.00 0.00 H TER 71253 WAT 393 ATOM 71253 O WAT 394 92.454 141.954 133.261 1.00 0.00 O ATOM 71254 H1 WAT 394 93.025 141.712 132.532 1.00 0.00 H ATOM 71255 H2 WAT 394 91.634 141.493 133.087 1.00 0.00 H TER 71257 WAT 394 ATOM 71257 O WAT 395 57.441 139.569 90.618 1.00 0.00 O ATOM 71258 H1 WAT 395 56.721 138.963 90.444 1.00 0.00 H ATOM 71259 H2 WAT 395 57.903 139.639 89.782 1.00 0.00 H TER 71261 WAT 395 ATOM 71261 O WAT 396 50.551 63.561 91.044 1.00 0.00 O ATOM 71262 H1 WAT 396 49.704 63.626 91.485 1.00 0.00 H ATOM 71263 H2 WAT 396 50.354 63.136 90.209 1.00 0.00 H TER 71265 WAT 396 ATOM 71265 O WAT 397 29.120 114.637 93.910 1.00 0.00 O ATOM 71266 H1 WAT 397 29.827 114.011 94.063 1.00 0.00 H ATOM 71267 H2 WAT 397 28.343 114.094 93.777 1.00 0.00 H TER 71269 WAT 397 ATOM 71269 O WAT 398 112.375 47.913 132.068 1.00 0.00 O ATOM 71270 H1 WAT 398 111.837 47.122 132.046 1.00 0.00 H ATOM 71271 H2 WAT 398 112.002 48.476 131.389 1.00 0.00 H TER 71273 WAT 398 ATOM 71273 O WAT 399 119.871 6.808 80.812 1.00 0.00 O ATOM 71274 H1 WAT 399 119.181 7.295 80.362 1.00 0.00 H ATOM 71275 H2 WAT 399 119.477 5.958 81.006 1.00 0.00 H TER 71277 WAT 399 ATOM 71277 O WAT 400 66.039 128.279 140.261 1.00 0.00 O ATOM 71278 H1 WAT 400 65.957 128.913 139.549 1.00 0.00 H ATOM 71279 H2 WAT 400 66.029 127.427 139.825 1.00 0.00 H TER 71281 WAT 400 ATOM 71281 O WAT 401 47.115 26.124 94.734 1.00 0.00 O ATOM 71282 H1 WAT 401 46.327 25.955 95.250 1.00 0.00 H ATOM 71283 H2 WAT 401 47.007 27.022 94.420 1.00 0.00 H TER 71285 WAT 401 ATOM 71285 O WAT 402 13.329 30.616 118.084 1.00 0.00 O ATOM 71286 H1 WAT 402 12.789 31.032 117.412 1.00 0.00 H ATOM 71287 H2 WAT 402 12.698 30.224 118.689 1.00 0.00 H TER 71289 WAT 402 ATOM 71289 O WAT 403 110.582 42.649 147.406 1.00 0.00 O ATOM 71290 H1 WAT 403 109.632 42.537 147.439 1.00 0.00 H ATOM 71291 H2 WAT 403 110.730 43.214 146.648 1.00 0.00 H TER 71293 WAT 403 ATOM 71293 O WAT 404 66.331 13.969 67.797 1.00 0.00 O ATOM 71294 H1 WAT 404 65.497 13.518 67.929 1.00 0.00 H ATOM 71295 H2 WAT 404 66.295 14.279 66.893 1.00 0.00 H TER 71297 WAT 404 ATOM 71297 O WAT 405 25.012 62.173 150.786 1.00 0.00 O ATOM 71298 H1 WAT 405 25.867 61.875 151.097 1.00 0.00 H ATOM 71299 H2 WAT 405 24.424 62.030 151.528 1.00 0.00 H TER 71301 WAT 405 ATOM 71301 O WAT 406 124.828 95.757 70.819 1.00 0.00 O ATOM 71302 H1 WAT 406 124.704 96.211 69.985 1.00 0.00 H ATOM 71303 H2 WAT 406 124.390 96.313 71.462 1.00 0.00 H TER 71305 WAT 406 ATOM 71305 O WAT 407 4.037 117.144 69.567 1.00 0.00 O ATOM 71306 H1 WAT 407 3.300 116.548 69.431 1.00 0.00 H ATOM 71307 H2 WAT 407 4.630 116.663 70.145 1.00 0.00 H TER 71309 WAT 407 ATOM 71309 O WAT 408 14.763 45.045 2.121 1.00 0.00 O ATOM 71310 H1 WAT 408 15.300 45.658 1.620 1.00 0.00 H ATOM 71311 H2 WAT 408 14.151 45.601 2.603 1.00 0.00 H TER 71313 WAT 408 ATOM 71313 O WAT 409 97.190 49.735 105.569 1.00 0.00 O ATOM 71314 H1 WAT 409 96.621 50.045 104.865 1.00 0.00 H ATOM 71315 H2 WAT 409 96.653 49.801 106.358 1.00 0.00 H TER 71317 WAT 409 ATOM 71317 O WAT 410 132.406 34.557 133.233 1.00 0.00 O ATOM 71318 H1 WAT 410 131.660 34.059 133.567 1.00 0.00 H ATOM 71319 H2 WAT 410 133.173 34.104 133.584 1.00 0.00 H TER 71321 WAT 410 ATOM 71321 O WAT 411 112.443 53.383 6.218 1.00 0.00 O ATOM 71322 H1 WAT 411 112.978 52.677 5.856 1.00 0.00 H ATOM 71323 H2 WAT 411 112.600 53.343 7.162 1.00 0.00 H TER 71325 WAT 411 ATOM 71325 O WAT 412 49.773 110.362 19.920 1.00 0.00 O ATOM 71326 H1 WAT 412 49.596 111.128 19.373 1.00 0.00 H ATOM 71327 H2 WAT 412 50.165 110.722 20.716 1.00 0.00 H TER 71329 WAT 412 ATOM 71329 O WAT 413 57.223 114.806 78.166 1.00 0.00 O ATOM 71330 H1 WAT 413 58.072 115.179 77.928 1.00 0.00 H ATOM 71331 H2 WAT 413 57.398 113.874 78.292 1.00 0.00 H TER 71333 WAT 413 ATOM 71333 O WAT 414 115.262 124.275 4.173 1.00 0.00 O ATOM 71334 H1 WAT 414 115.581 125.174 4.088 1.00 0.00 H ATOM 71335 H2 WAT 414 115.571 123.992 5.033 1.00 0.00 H TER 71337 WAT 414 ATOM 71337 O WAT 415 32.683 126.329 150.541 1.00 0.00 O ATOM 71338 H1 WAT 415 32.040 125.676 150.816 1.00 0.00 H ATOM 71339 H2 WAT 415 32.158 127.058 150.210 1.00 0.00 H TER 71341 WAT 415 ATOM 71341 O WAT 416 123.716 30.239 121.812 1.00 0.00 O ATOM 71342 H1 WAT 416 124.558 30.492 121.434 1.00 0.00 H ATOM 71343 H2 WAT 416 123.068 30.520 121.166 1.00 0.00 H TER 71345 WAT 416 ATOM 71345 O WAT 417 4.854 0.637 79.941 1.00 0.00 O ATOM 71346 H1 WAT 417 4.064 0.147 80.169 1.00 0.00 H ATOM 71347 H2 WAT 417 4.587 1.194 79.210 1.00 0.00 H TER 71349 WAT 417 ATOM 71349 O WAT 418 49.320 47.739 120.425 1.00 0.00 O ATOM 71350 H1 WAT 418 49.468 48.577 119.988 1.00 0.00 H ATOM 71351 H2 WAT 418 50.076 47.205 120.181 1.00 0.00 H TER 71353 WAT 418 ATOM 71353 O WAT 419 144.484 52.035 93.248 1.00 0.00 O ATOM 71354 H1 WAT 419 144.245 51.122 93.408 1.00 0.00 H ATOM 71355 H2 WAT 419 144.885 52.029 92.379 1.00 0.00 H TER 71357 WAT 419 ATOM 71357 O WAT 420 98.426 70.777 122.656 1.00 0.00 O ATOM 71358 H1 WAT 420 97.773 71.051 123.300 1.00 0.00 H ATOM 71359 H2 WAT 420 97.960 70.796 121.820 1.00 0.00 H TER 71361 WAT 420 ATOM 71361 O WAT 421 84.369 107.302 122.799 1.00 0.00 O ATOM 71362 H1 WAT 421 85.223 107.715 122.924 1.00 0.00 H ATOM 71363 H2 WAT 421 84.566 106.465 122.380 1.00 0.00 H TER 71365 WAT 421 ATOM 71365 O WAT 422 136.320 100.209 19.381 1.00 0.00 O ATOM 71366 H1 WAT 422 136.481 100.991 19.910 1.00 0.00 H ATOM 71367 H2 WAT 422 135.817 100.526 18.631 1.00 0.00 H TER 71369 WAT 422 ATOM 71369 O WAT 423 34.548 45.184 91.322 1.00 0.00 O ATOM 71370 H1 WAT 423 33.866 44.979 91.961 1.00 0.00 H ATOM 71371 H2 WAT 423 34.852 46.058 91.567 1.00 0.00 H TER 71373 WAT 423 ATOM 71373 O WAT 424 115.104 14.319 13.506 1.00 0.00 O ATOM 71374 H1 WAT 424 114.608 15.137 13.536 1.00 0.00 H ATOM 71375 H2 WAT 424 115.013 14.017 12.602 1.00 0.00 H TER 71377 WAT 424 ATOM 71377 O WAT 425 18.215 103.688 100.344 1.00 0.00 O ATOM 71378 H1 WAT 425 18.882 103.057 100.615 1.00 0.00 H ATOM 71379 H2 WAT 425 17.443 103.458 100.862 1.00 0.00 H TER 71381 WAT 425 ATOM 71381 O WAT 426 57.230 94.007 0.296 1.00 0.00 O ATOM 71382 H1 WAT 426 56.968 94.004 1.216 1.00 0.00 H ATOM 71383 H2 WAT 426 58.187 94.034 0.319 1.00 0.00 H TER 71385 WAT 426 ATOM 71385 O WAT 427 78.570 116.799 109.401 1.00 0.00 O ATOM 71386 H1 WAT 427 79.069 116.821 108.584 1.00 0.00 H ATOM 71387 H2 WAT 427 77.657 116.883 109.126 1.00 0.00 H TER 71389 WAT 427 ATOM 71389 O WAT 428 33.043 38.169 19.393 1.00 0.00 O ATOM 71390 H1 WAT 428 33.271 38.077 20.318 1.00 0.00 H ATOM 71391 H2 WAT 428 32.485 37.413 19.208 1.00 0.00 H TER 71393 WAT 428 ATOM 71393 O WAT 429 22.050 78.536 91.560 1.00 0.00 O ATOM 71394 H1 WAT 429 21.585 77.951 90.962 1.00 0.00 H ATOM 71395 H2 WAT 429 22.959 78.513 91.259 1.00 0.00 H TER 71397 WAT 429 ATOM 71397 O WAT 430 121.528 8.056 17.638 1.00 0.00 O ATOM 71398 H1 WAT 430 121.153 8.137 16.761 1.00 0.00 H ATOM 71399 H2 WAT 430 121.425 8.927 18.023 1.00 0.00 H TER 71401 WAT 430 ATOM 71401 O WAT 431 106.657 123.877 129.083 1.00 0.00 O ATOM 71402 H1 WAT 431 106.262 124.742 128.973 1.00 0.00 H ATOM 71403 H2 WAT 431 106.583 123.698 130.021 1.00 0.00 H TER 71405 WAT 431 ATOM 71405 O WAT 432 9.154 16.971 15.436 1.00 0.00 O ATOM 71406 H1 WAT 432 8.272 17.321 15.313 1.00 0.00 H ATOM 71407 H2 WAT 432 9.720 17.572 14.950 1.00 0.00 H TER 71409 WAT 432 ATOM 71409 O WAT 433 131.121 128.458 95.620 1.00 0.00 O ATOM 71410 H1 WAT 433 131.483 127.748 95.091 1.00 0.00 H ATOM 71411 H2 WAT 433 130.427 128.044 96.134 1.00 0.00 H TER 71413 WAT 433 ATOM 71413 O WAT 434 58.987 12.658 79.357 1.00 0.00 O ATOM 71414 H1 WAT 434 59.567 13.398 79.533 1.00 0.00 H ATOM 71415 H2 WAT 434 58.214 13.050 78.950 1.00 0.00 H TER 71417 WAT 434 ATOM 71417 O WAT 435 57.288 99.567 94.590 1.00 0.00 O ATOM 71418 H1 WAT 435 56.529 99.008 94.424 1.00 0.00 H ATOM 71419 H2 WAT 435 57.006 100.151 95.294 1.00 0.00 H TER 71421 WAT 435 ATOM 71421 O WAT 436 141.870 56.301 4.982 1.00 0.00 O ATOM 71422 H1 WAT 436 142.647 55.860 4.636 1.00 0.00 H ATOM 71423 H2 WAT 436 141.222 56.229 4.282 1.00 0.00 H TER 71425 WAT 436 ATOM 71425 O WAT 437 56.531 88.200 23.494 1.00 0.00 O ATOM 71426 H1 WAT 437 56.450 89.146 23.369 1.00 0.00 H ATOM 71427 H2 WAT 437 57.410 88.080 23.853 1.00 0.00 H TER 71429 WAT 437 ATOM 71429 O WAT 438 9.855 60.366 151.782 1.00 0.00 O ATOM 71430 H1 WAT 438 9.825 59.688 152.458 1.00 0.00 H ATOM 71431 H2 WAT 438 8.952 60.430 151.468 1.00 0.00 H TER 71433 WAT 438 ATOM 71433 O WAT 439 44.321 138.917 94.897 1.00 0.00 O ATOM 71434 H1 WAT 439 43.898 139.773 94.849 1.00 0.00 H ATOM 71435 H2 WAT 439 45.156 139.086 95.335 1.00 0.00 H TER 71437 WAT 439 ATOM 71437 O WAT 440 135.350 18.512 87.957 1.00 0.00 O ATOM 71438 H1 WAT 440 135.468 18.457 88.905 1.00 0.00 H ATOM 71439 H2 WAT 440 136.222 18.353 87.597 1.00 0.00 H TER 71441 WAT 440 ATOM 71441 O WAT 441 41.190 93.117 75.752 1.00 0.00 O ATOM 71442 H1 WAT 441 41.500 93.958 76.089 1.00 0.00 H ATOM 71443 H2 WAT 441 40.512 92.847 76.371 1.00 0.00 H TER 71445 WAT 441 ATOM 71445 O WAT 442 12.045 23.351 88.857 1.00 0.00 O ATOM 71446 H1 WAT 442 11.834 22.585 88.322 1.00 0.00 H ATOM 71447 H2 WAT 442 11.404 24.011 88.594 1.00 0.00 H TER 71449 WAT 442 ATOM 71449 O WAT 443 22.475 124.551 118.204 1.00 0.00 O ATOM 71450 H1 WAT 443 23.029 124.903 118.901 1.00 0.00 H ATOM 71451 H2 WAT 443 21.996 123.833 118.618 1.00 0.00 H TER 71453 WAT 443 ATOM 71453 O WAT 444 59.889 134.603 78.943 1.00 0.00 O ATOM 71454 H1 WAT 444 59.953 133.963 79.652 1.00 0.00 H ATOM 71455 H2 WAT 444 60.206 135.420 79.328 1.00 0.00 H TER 71457 WAT 444 ATOM 71457 O WAT 445 119.121 95.879 98.162 1.00 0.00 O ATOM 71458 H1 WAT 445 119.325 96.346 97.351 1.00 0.00 H ATOM 71459 H2 WAT 445 118.183 96.019 98.289 1.00 0.00 H TER 71461 WAT 445 ATOM 71461 O WAT 446 141.017 137.230 13.038 1.00 0.00 O ATOM 71462 H1 WAT 446 141.433 136.394 13.249 1.00 0.00 H ATOM 71463 H2 WAT 446 140.423 137.393 13.770 1.00 0.00 H TER 71465 WAT 446 ATOM 71465 O WAT 447 125.753 116.156 134.879 1.00 0.00 O ATOM 71466 H1 WAT 447 124.981 115.775 134.460 1.00 0.00 H ATOM 71467 H2 WAT 447 125.677 115.901 135.798 1.00 0.00 H TER 71469 WAT 447 ATOM 71469 O WAT 448 57.727 119.142 78.545 1.00 0.00 O ATOM 71470 H1 WAT 448 56.886 119.121 79.001 1.00 0.00 H ATOM 71471 H2 WAT 448 58.137 119.957 78.836 1.00 0.00 H TER 71473 WAT 448 ATOM 71473 O WAT 449 58.640 85.777 126.592 1.00 0.00 O ATOM 71474 H1 WAT 449 57.999 85.190 126.992 1.00 0.00 H ATOM 71475 H2 WAT 449 59.409 85.227 126.442 1.00 0.00 H TER 71477 WAT 449 ATOM 71477 O WAT 450 29.722 130.747 64.617 1.00 0.00 O ATOM 71478 H1 WAT 450 30.609 131.089 64.724 1.00 0.00 H ATOM 71479 H2 WAT 450 29.631 130.606 63.674 1.00 0.00 H TER 71481 WAT 450 ATOM 71481 O WAT 451 18.264 100.341 155.153 1.00 0.00 O ATOM 71482 H1 WAT 451 18.334 99.437 154.848 1.00 0.00 H ATOM 71483 H2 WAT 451 19.099 100.512 155.588 1.00 0.00 H TER 71485 WAT 451 ATOM 71485 O WAT 452 138.742 125.649 9.940 1.00 0.00 O ATOM 71486 H1 WAT 452 138.278 125.188 10.638 1.00 0.00 H ATOM 71487 H2 WAT 452 138.113 125.689 9.219 1.00 0.00 H TER 71489 WAT 452 ATOM 71489 O WAT 453 95.343 73.907 141.767 1.00 0.00 O ATOM 71490 H1 WAT 453 96.156 73.427 141.924 1.00 0.00 H ATOM 71491 H2 WAT 453 95.624 74.806 141.596 1.00 0.00 H TER 71493 WAT 453 ATOM 71493 O WAT 454 130.869 120.115 158.124 1.00 0.00 O ATOM 71494 H1 WAT 454 129.981 120.466 158.195 1.00 0.00 H ATOM 71495 H2 WAT 454 130.956 119.867 157.204 1.00 0.00 H TER 71497 WAT 454 ATOM 71497 O WAT 455 43.544 28.244 113.372 1.00 0.00 O ATOM 71498 H1 WAT 455 43.966 27.975 114.188 1.00 0.00 H ATOM 71499 H2 WAT 455 43.944 27.691 112.702 1.00 0.00 H TER 71501 WAT 455 ATOM 71501 O WAT 456 93.203 69.083 92.227 1.00 0.00 O ATOM 71502 H1 WAT 456 93.082 69.830 92.813 1.00 0.00 H ATOM 71503 H2 WAT 456 93.830 68.521 92.681 1.00 0.00 H TER 71505 WAT 456 ATOM 71505 O WAT 457 45.674 94.315 127.476 1.00 0.00 O ATOM 71506 H1 WAT 457 45.999 93.487 127.123 1.00 0.00 H ATOM 71507 H2 WAT 457 44.899 94.071 127.983 1.00 0.00 H TER 71509 WAT 457 ATOM 71509 O WAT 458 79.694 87.440 12.280 1.00 0.00 O ATOM 71510 H1 WAT 458 80.418 87.039 12.760 1.00 0.00 H ATOM 71511 H2 WAT 458 79.213 87.936 12.943 1.00 0.00 H TER 71513 WAT 458 ATOM 71513 O WAT 459 142.555 33.439 133.651 1.00 0.00 O ATOM 71514 H1 WAT 459 142.429 34.101 134.331 1.00 0.00 H ATOM 71515 H2 WAT 459 143.214 33.815 133.069 1.00 0.00 H TER 71517 WAT 459 ATOM 71517 O WAT 460 119.392 26.865 2.070 1.00 0.00 O ATOM 71518 H1 WAT 460 120.328 26.896 1.876 1.00 0.00 H ATOM 71519 H2 WAT 460 119.279 26.064 2.581 1.00 0.00 H TER 71521 WAT 460 ATOM 71521 O WAT 461 79.383 122.926 55.865 1.00 0.00 O ATOM 71522 H1 WAT 461 80.214 122.879 56.337 1.00 0.00 H ATOM 71523 H2 WAT 461 79.521 123.607 55.206 1.00 0.00 H TER 71525 WAT 461 ATOM 71525 O WAT 462 137.313 81.739 72.186 1.00 0.00 O ATOM 71526 H1 WAT 462 137.843 81.204 71.595 1.00 0.00 H ATOM 71527 H2 WAT 462 137.421 82.633 71.862 1.00 0.00 H TER 71529 WAT 462 ATOM 71529 O WAT 463 99.810 16.945 72.850 1.00 0.00 O ATOM 71530 H1 WAT 463 99.402 16.094 72.691 1.00 0.00 H ATOM 71531 H2 WAT 463 100.419 17.059 72.120 1.00 0.00 H TER 71533 WAT 463 ATOM 71533 O WAT 464 126.783 65.068 18.926 1.00 0.00 O ATOM 71534 H1 WAT 464 126.500 64.692 18.092 1.00 0.00 H ATOM 71535 H2 WAT 464 126.011 65.009 19.489 1.00 0.00 H TER 71537 WAT 464 ATOM 71537 O WAT 465 63.126 100.264 65.513 1.00 0.00 O ATOM 71538 H1 WAT 465 63.553 99.588 66.040 1.00 0.00 H ATOM 71539 H2 WAT 465 62.711 99.782 64.797 1.00 0.00 H TER 71541 WAT 465 ATOM 71541 O WAT 466 33.011 13.638 147.952 1.00 0.00 O ATOM 71542 H1 WAT 466 32.850 12.967 147.287 1.00 0.00 H ATOM 71543 H2 WAT 466 32.639 13.273 148.755 1.00 0.00 H TER 71545 WAT 466 ATOM 71545 O WAT 467 42.160 12.699 103.408 1.00 0.00 O ATOM 71546 H1 WAT 467 41.907 11.916 102.919 1.00 0.00 H ATOM 71547 H2 WAT 467 41.427 12.856 104.004 1.00 0.00 H TER 71549 WAT 467 ATOM 71549 O WAT 468 58.220 63.404 2.740 1.00 0.00 O ATOM 71550 H1 WAT 468 58.866 62.939 2.208 1.00 0.00 H ATOM 71551 H2 WAT 468 58.347 64.327 2.518 1.00 0.00 H TER 71553 WAT 468 ATOM 71553 O WAT 469 33.300 126.296 59.127 1.00 0.00 O ATOM 71554 H1 WAT 469 32.902 126.660 58.336 1.00 0.00 H ATOM 71555 H2 WAT 469 32.903 126.790 59.844 1.00 0.00 H TER 71557 WAT 469 ATOM 71557 O WAT 470 124.217 90.235 65.454 1.00 0.00 O ATOM 71558 H1 WAT 470 123.744 89.404 65.506 1.00 0.00 H ATOM 71559 H2 WAT 470 124.509 90.287 64.544 1.00 0.00 H TER 71561 WAT 470 ATOM 71561 O WAT 471 35.181 15.230 112.946 1.00 0.00 O ATOM 71562 H1 WAT 471 34.859 15.353 112.053 1.00 0.00 H ATOM 71563 H2 WAT 471 34.441 15.475 113.502 1.00 0.00 H TER 71565 WAT 471 ATOM 71565 O WAT 472 78.030 63.490 143.690 1.00 0.00 O ATOM 71566 H1 WAT 472 78.318 63.748 142.815 1.00 0.00 H ATOM 71567 H2 WAT 472 77.317 64.094 143.895 1.00 0.00 H TER 71569 WAT 472 ATOM 71569 O WAT 473 108.034 14.129 106.415 1.00 0.00 O ATOM 71570 H1 WAT 473 107.825 14.363 107.320 1.00 0.00 H ATOM 71571 H2 WAT 473 108.694 14.770 106.149 1.00 0.00 H TER 71573 WAT 473 ATOM 71573 O WAT 474 77.453 73.570 135.617 1.00 0.00 O ATOM 71574 H1 WAT 474 76.742 73.985 135.129 1.00 0.00 H ATOM 71575 H2 WAT 474 78.249 73.962 135.259 1.00 0.00 H TER 71577 WAT 474 ATOM 71577 O WAT 475 120.564 12.538 114.840 1.00 0.00 O ATOM 71578 H1 WAT 475 119.762 12.042 114.677 1.00 0.00 H ATOM 71579 H2 WAT 475 120.300 13.227 115.449 1.00 0.00 H TER 71581 WAT 475 ATOM 71581 O WAT 476 144.617 125.911 12.383 1.00 0.00 O ATOM 71582 H1 WAT 476 144.098 126.440 11.777 1.00 0.00 H ATOM 71583 H2 WAT 476 144.926 125.175 11.854 1.00 0.00 H TER 71585 WAT 476 ATOM 71585 O WAT 477 50.295 67.053 68.381 1.00 0.00 O ATOM 71586 H1 WAT 477 50.970 67.662 68.682 1.00 0.00 H ATOM 71587 H2 WAT 477 50.731 66.200 68.369 1.00 0.00 H TER 71589 WAT 477 ATOM 71589 O WAT 478 123.605 52.486 139.693 1.00 0.00 O ATOM 71590 H1 WAT 478 123.010 51.850 140.089 1.00 0.00 H ATOM 71591 H2 WAT 478 123.445 52.409 138.752 1.00 0.00 H TER 71593 WAT 478 ATOM 71593 O WAT 479 95.428 33.014 118.044 1.00 0.00 O ATOM 71594 H1 WAT 479 95.005 32.609 117.287 1.00 0.00 H ATOM 71595 H2 WAT 479 94.953 32.665 118.798 1.00 0.00 H TER 71597 WAT 479 ATOM 71597 O WAT 480 136.108 50.452 126.685 1.00 0.00 O ATOM 71598 H1 WAT 480 135.554 50.351 125.912 1.00 0.00 H ATOM 71599 H2 WAT 480 135.926 49.676 127.214 1.00 0.00 H TER 71601 WAT 480 ATOM 71601 O WAT 481 6.379 112.684 156.681 1.00 0.00 O ATOM 71602 H1 WAT 481 6.204 113.592 156.927 1.00 0.00 H ATOM 71603 H2 WAT 481 6.052 112.169 157.419 1.00 0.00 H TER 71605 WAT 481 ATOM 71605 O WAT 482 65.758 97.958 142.132 1.00 0.00 O ATOM 71606 H1 WAT 482 64.884 97.704 142.429 1.00 0.00 H ATOM 71607 H2 WAT 482 65.634 98.819 141.734 1.00 0.00 H TER 71609 WAT 482 ATOM 71609 O WAT 483 119.827 34.103 99.906 1.00 0.00 O ATOM 71610 H1 WAT 483 118.970 33.723 99.714 1.00 0.00 H ATOM 71611 H2 WAT 483 119.962 34.752 99.216 1.00 0.00 H TER 71613 WAT 483 ATOM 71613 O WAT 484 75.205 38.516 131.570 1.00 0.00 O ATOM 71614 H1 WAT 484 75.115 39.324 131.064 1.00 0.00 H ATOM 71615 H2 WAT 484 75.766 38.758 132.308 1.00 0.00 H TER 71617 WAT 484 ATOM 71617 O WAT 485 102.814 75.933 154.428 1.00 0.00 O ATOM 71618 H1 WAT 485 102.486 75.071 154.173 1.00 0.00 H ATOM 71619 H2 WAT 485 102.124 76.298 154.982 1.00 0.00 H TER 71621 WAT 485 ATOM 71621 O WAT 486 137.728 44.910 71.059 1.00 0.00 O ATOM 71622 H1 WAT 486 138.324 44.228 71.368 1.00 0.00 H ATOM 71623 H2 WAT 486 137.016 44.432 70.633 1.00 0.00 H TER 71625 WAT 486 ATOM 71625 O WAT 487 126.321 141.363 157.414 1.00 0.00 O ATOM 71626 H1 WAT 487 127.147 141.783 157.175 1.00 0.00 H ATOM 71627 H2 WAT 487 126.087 140.840 156.648 1.00 0.00 H TER 71629 WAT 487 ATOM 71629 O WAT 488 130.077 138.239 111.086 1.00 0.00 O ATOM 71630 H1 WAT 488 129.527 139.022 111.086 1.00 0.00 H ATOM 71631 H2 WAT 488 130.944 138.556 110.834 1.00 0.00 H TER 71633 WAT 488 ATOM 71633 O WAT 489 61.538 30.832 137.906 1.00 0.00 O ATOM 71634 H1 WAT 489 62.367 30.938 138.374 1.00 0.00 H ATOM 71635 H2 WAT 489 61.779 30.398 137.088 1.00 0.00 H TER 71637 WAT 489 ATOM 71637 O WAT 490 129.450 15.328 131.202 1.00 0.00 O ATOM 71638 H1 WAT 490 128.787 15.776 130.676 1.00 0.00 H ATOM 71639 H2 WAT 490 130.043 14.939 130.560 1.00 0.00 H TER 71641 WAT 490 ATOM 71641 O WAT 491 51.612 88.879 122.065 1.00 0.00 O ATOM 71642 H1 WAT 491 50.869 89.480 122.126 1.00 0.00 H ATOM 71643 H2 WAT 491 51.215 88.008 122.066 1.00 0.00 H TER 71645 WAT 491 ATOM 71645 O WAT 492 52.932 0.355 99.895 1.00 0.00 O ATOM 71646 H1 WAT 492 53.600 0.614 99.260 1.00 0.00 H ATOM 71647 H2 WAT 492 52.126 0.295 99.383 1.00 0.00 H TER 71649 WAT 492 ATOM 71649 O WAT 493 16.076 49.612 96.305 1.00 0.00 O ATOM 71650 H1 WAT 493 16.740 49.313 95.684 1.00 0.00 H ATOM 71651 H2 WAT 493 15.966 50.542 96.108 1.00 0.00 H TER 71653 WAT 493 ATOM 71653 O WAT 494 16.585 25.992 13.025 1.00 0.00 O ATOM 71654 H1 WAT 494 16.141 26.784 13.328 1.00 0.00 H ATOM 71655 H2 WAT 494 15.896 25.329 12.993 1.00 0.00 H TER 71657 WAT 494 ATOM 71657 O WAT 495 18.733 129.501 77.614 1.00 0.00 O ATOM 71658 H1 WAT 495 18.298 129.285 78.438 1.00 0.00 H ATOM 71659 H2 WAT 495 18.968 130.424 77.701 1.00 0.00 H TER 71661 WAT 495 ATOM 71661 O WAT 496 81.363 57.397 15.322 1.00 0.00 O ATOM 71662 H1 WAT 496 81.477 56.603 15.844 1.00 0.00 H ATOM 71663 H2 WAT 496 82.241 57.597 14.996 1.00 0.00 H TER 71665 WAT 496 ATOM 71665 O WAT 497 76.701 51.741 74.798 1.00 0.00 O ATOM 71666 H1 WAT 497 77.181 52.251 75.452 1.00 0.00 H ATOM 71667 H2 WAT 497 75.795 51.749 75.106 1.00 0.00 H TER 71669 WAT 497 ATOM 71669 O WAT 498 71.184 58.730 142.559 1.00 0.00 O ATOM 71670 H1 WAT 498 72.104 58.888 142.772 1.00 0.00 H ATOM 71671 H2 WAT 498 70.772 58.546 143.403 1.00 0.00 H TER 71673 WAT 498 ATOM 71673 O WAT 499 44.294 138.539 9.292 1.00 0.00 O ATOM 71674 H1 WAT 499 44.692 139.125 9.935 1.00 0.00 H ATOM 71675 H2 WAT 499 44.317 139.032 8.472 1.00 0.00 H TER 71677 WAT 499 ATOM 71677 O WAT 500 56.311 34.243 100.518 1.00 0.00 O ATOM 71678 H1 WAT 500 56.304 33.289 100.437 1.00 0.00 H ATOM 71679 H2 WAT 500 57.016 34.528 99.937 1.00 0.00 H TER 71681 WAT 500 ATOM 71681 O WAT 501 53.697 48.670 91.744 1.00 0.00 O ATOM 71682 H1 WAT 501 52.819 48.678 91.363 1.00 0.00 H ATOM 71683 H2 WAT 501 54.122 49.448 91.383 1.00 0.00 H TER 71685 WAT 501 ATOM 71685 O WAT 502 115.815 86.230 145.059 1.00 0.00 O ATOM 71686 H1 WAT 502 116.724 86.363 144.790 1.00 0.00 H ATOM 71687 H2 WAT 502 115.461 85.620 144.412 1.00 0.00 H TER 71689 WAT 502 ATOM 71689 O WAT 503 140.209 19.112 101.752 1.00 0.00 O ATOM 71690 H1 WAT 503 140.189 18.677 102.605 1.00 0.00 H ATOM 71691 H2 WAT 503 139.647 19.879 101.861 1.00 0.00 H TER 71693 WAT 503 ATOM 71693 O WAT 504 48.960 55.699 126.514 1.00 0.00 O ATOM 71694 H1 WAT 504 49.074 54.971 127.126 1.00 0.00 H ATOM 71695 H2 WAT 504 48.723 56.443 127.068 1.00 0.00 H TER 71697 WAT 504 ATOM 71697 O WAT 505 9.111 25.298 4.647 1.00 0.00 O ATOM 71698 H1 WAT 505 9.899 25.828 4.528 1.00 0.00 H ATOM 71699 H2 WAT 505 9.303 24.751 5.409 1.00 0.00 H TER 71701 WAT 505 ATOM 71701 O WAT 506 119.302 4.569 111.558 1.00 0.00 O ATOM 71702 H1 WAT 506 119.780 3.865 111.119 1.00 0.00 H ATOM 71703 H2 WAT 506 118.968 5.113 110.844 1.00 0.00 H TER 71705 WAT 506 ATOM 71705 O WAT 507 115.840 126.473 18.393 1.00 0.00 O ATOM 71706 H1 WAT 507 115.707 126.201 17.485 1.00 0.00 H ATOM 71707 H2 WAT 507 116.604 125.974 18.683 1.00 0.00 H TER 71709 WAT 507 ATOM 71709 O WAT 508 120.590 131.980 9.104 1.00 0.00 O ATOM 71710 H1 WAT 508 120.585 131.267 8.465 1.00 0.00 H ATOM 71711 H2 WAT 508 121.487 131.995 9.438 1.00 0.00 H TER 71713 WAT 508 ATOM 71713 O WAT 509 111.811 111.380 12.029 1.00 0.00 O ATOM 71714 H1 WAT 509 112.312 112.161 12.263 1.00 0.00 H ATOM 71715 H2 WAT 509 111.681 110.920 12.858 1.00 0.00 H TER 71717 WAT 509 ATOM 71717 O WAT 510 87.261 131.266 114.324 1.00 0.00 O ATOM 71718 H1 WAT 510 86.378 131.617 114.442 1.00 0.00 H ATOM 71719 H2 WAT 510 87.338 130.581 114.988 1.00 0.00 H TER 71721 WAT 510 ATOM 71721 O WAT 511 127.541 83.150 112.498 1.00 0.00 O ATOM 71722 H1 WAT 511 126.796 83.395 113.046 1.00 0.00 H ATOM 71723 H2 WAT 511 127.169 82.566 111.836 1.00 0.00 H TER 71725 WAT 511 ATOM 71725 O WAT 512 86.262 5.427 74.674 1.00 0.00 O ATOM 71726 H1 WAT 512 85.680 6.184 74.747 1.00 0.00 H ATOM 71727 H2 WAT 512 86.526 5.240 75.575 1.00 0.00 H TER 71729 WAT 512 ATOM 71729 O WAT 513 134.487 85.368 150.703 1.00 0.00 O ATOM 71730 H1 WAT 513 133.957 85.922 151.276 1.00 0.00 H ATOM 71731 H2 WAT 513 135.374 85.436 151.057 1.00 0.00 H TER 71733 WAT 513 ATOM 71733 O WAT 514 62.297 24.467 86.618 1.00 0.00 O ATOM 71734 H1 WAT 514 61.435 24.555 87.026 1.00 0.00 H ATOM 71735 H2 WAT 514 62.900 24.364 87.354 1.00 0.00 H TER 71737 WAT 514 ATOM 71737 O WAT 515 69.206 104.763 115.908 1.00 0.00 O ATOM 71738 H1 WAT 515 69.144 104.599 114.967 1.00 0.00 H ATOM 71739 H2 WAT 515 68.641 104.100 116.304 1.00 0.00 H TER 71741 WAT 515 ATOM 71741 O WAT 516 143.507 81.851 18.188 1.00 0.00 O ATOM 71742 H1 WAT 516 143.032 82.164 17.419 1.00 0.00 H ATOM 71743 H2 WAT 516 144.091 81.172 17.849 1.00 0.00 H TER 71745 WAT 516 ATOM 71745 O WAT 517 38.147 94.061 4.403 1.00 0.00 O ATOM 71746 H1 WAT 517 38.856 94.082 3.761 1.00 0.00 H ATOM 71747 H2 WAT 517 37.526 94.721 4.095 1.00 0.00 H TER 71749 WAT 517 ATOM 71749 O WAT 518 130.221 122.887 135.369 1.00 0.00 O ATOM 71750 H1 WAT 518 129.496 122.352 135.045 1.00 0.00 H ATOM 71751 H2 WAT 518 130.840 122.255 135.734 1.00 0.00 H TER 71753 WAT 518 ATOM 71753 O WAT 519 132.704 93.596 94.682 1.00 0.00 O ATOM 71754 H1 WAT 519 133.377 93.863 95.308 1.00 0.00 H ATOM 71755 H2 WAT 519 132.549 92.672 94.877 1.00 0.00 H TER 71757 WAT 519 ATOM 71757 O WAT 520 72.208 32.349 5.712 1.00 0.00 O ATOM 71758 H1 WAT 520 71.519 32.191 6.357 1.00 0.00 H ATOM 71759 H2 WAT 520 72.354 31.496 5.303 1.00 0.00 H TER 71761 WAT 520 ATOM 71761 O WAT 521 12.865 115.790 104.449 1.00 0.00 O ATOM 71762 H1 WAT 521 12.818 115.980 105.386 1.00 0.00 H ATOM 71763 H2 WAT 521 12.386 116.507 104.034 1.00 0.00 H TER 71765 WAT 521 ATOM 71765 O WAT 522 71.409 101.456 157.992 1.00 0.00 O ATOM 71766 H1 WAT 522 70.880 101.242 157.224 1.00 0.00 H ATOM 71767 H2 WAT 522 70.794 101.421 158.725 1.00 0.00 H TER 71769 WAT 522 ATOM 71769 O WAT 523 126.925 127.978 127.184 1.00 0.00 O ATOM 71770 H1 WAT 523 126.752 127.270 126.564 1.00 0.00 H ATOM 71771 H2 WAT 523 126.118 128.054 127.693 1.00 0.00 H TER 71773 WAT 523 ATOM 71773 O WAT 524 125.136 92.923 7.578 1.00 0.00 O ATOM 71774 H1 WAT 524 124.700 92.836 8.425 1.00 0.00 H ATOM 71775 H2 WAT 524 126.069 92.859 7.781 1.00 0.00 H TER 71777 WAT 524 ATOM 71777 O WAT 525 7.810 43.519 120.363 1.00 0.00 O ATOM 71778 H1 WAT 525 8.763 43.434 120.335 1.00 0.00 H ATOM 71779 H2 WAT 525 7.485 42.686 120.020 1.00 0.00 H TER 71781 WAT 525 ATOM 71781 O WAT 526 139.719 121.486 146.050 1.00 0.00 O ATOM 71782 H1 WAT 526 140.072 122.376 146.016 1.00 0.00 H ATOM 71783 H2 WAT 526 140.372 120.988 146.541 1.00 0.00 H TER 71785 WAT 526 ATOM 71785 O WAT 527 20.013 94.189 101.000 1.00 0.00 O ATOM 71786 H1 WAT 527 19.719 95.063 101.257 1.00 0.00 H ATOM 71787 H2 WAT 527 19.270 93.815 100.527 1.00 0.00 H TER 71789 WAT 527 ATOM 71789 O WAT 528 86.342 27.221 126.768 1.00 0.00 O ATOM 71790 H1 WAT 528 85.986 27.041 127.638 1.00 0.00 H ATOM 71791 H2 WAT 528 86.117 26.447 126.251 1.00 0.00 H TER 71793 WAT 528 ATOM 71793 O WAT 529 106.901 109.639 13.077 1.00 0.00 O ATOM 71794 H1 WAT 529 107.377 108.812 13.002 1.00 0.00 H ATOM 71795 H2 WAT 529 105.982 109.381 13.152 1.00 0.00 H TER 71797 WAT 529 ATOM 71797 O WAT 530 65.516 37.419 83.898 1.00 0.00 O ATOM 71798 H1 WAT 530 66.369 37.851 83.943 1.00 0.00 H ATOM 71799 H2 WAT 530 64.957 38.040 83.432 1.00 0.00 H TER 71801 WAT 530 ATOM 71801 O WAT 531 35.329 138.313 147.574 1.00 0.00 O ATOM 71802 H1 WAT 531 34.615 137.717 147.348 1.00 0.00 H ATOM 71803 H2 WAT 531 35.689 137.958 148.387 1.00 0.00 H TER 71805 WAT 531 ATOM 71805 O WAT 532 75.258 135.936 131.991 1.00 0.00 O ATOM 71806 H1 WAT 532 74.676 136.330 132.641 1.00 0.00 H ATOM 71807 H2 WAT 532 76.012 136.525 131.957 1.00 0.00 H TER 71809 WAT 532 ATOM 71809 O WAT 533 76.648 65.856 80.159 1.00 0.00 O ATOM 71810 H1 WAT 533 77.091 66.700 80.068 1.00 0.00 H ATOM 71811 H2 WAT 533 75.758 66.018 79.848 1.00 0.00 H TER 71813 WAT 533 ATOM 71813 O WAT 534 36.565 109.090 138.494 1.00 0.00 O ATOM 71814 H1 WAT 534 36.072 108.390 138.923 1.00 0.00 H ATOM 71815 H2 WAT 534 37.043 108.650 137.792 1.00 0.00 H TER 71817 WAT 534 ATOM 71817 O WAT 535 106.402 26.084 82.752 1.00 0.00 O ATOM 71818 H1 WAT 535 106.443 25.208 82.370 1.00 0.00 H ATOM 71819 H2 WAT 535 106.087 26.642 82.041 1.00 0.00 H TER 71821 WAT 535 ATOM 71821 O WAT 536 33.359 3.027 118.522 1.00 0.00 O ATOM 71822 H1 WAT 536 32.808 3.785 118.327 1.00 0.00 H ATOM 71823 H2 WAT 536 32.788 2.434 119.009 1.00 0.00 H TER 71825 WAT 536 ATOM 71825 O WAT 537 38.642 41.781 104.590 1.00 0.00 O ATOM 71826 H1 WAT 537 39.101 41.119 105.107 1.00 0.00 H ATOM 71827 H2 WAT 537 37.772 41.410 104.444 1.00 0.00 H TER 71829 WAT 537 ATOM 71829 O WAT 538 140.386 68.098 137.008 1.00 0.00 O ATOM 71830 H1 WAT 538 141.062 68.603 137.460 1.00 0.00 H ATOM 71831 H2 WAT 538 139.910 67.653 137.709 1.00 0.00 H TER 71833 WAT 538 ATOM 71833 O WAT 539 39.897 34.893 103.038 1.00 0.00 O ATOM 71834 H1 WAT 539 39.854 35.842 102.924 1.00 0.00 H ATOM 71835 H2 WAT 539 39.267 34.707 103.735 1.00 0.00 H TER 71837 WAT 539 ATOM 71837 O WAT 540 118.152 18.830 75.615 1.00 0.00 O ATOM 71838 H1 WAT 540 118.493 19.577 76.108 1.00 0.00 H ATOM 71839 H2 WAT 540 118.571 18.068 76.015 1.00 0.00 H TER 71841 WAT 540 ATOM 71841 O WAT 541 6.602 71.025 53.469 1.00 0.00 O ATOM 71842 H1 WAT 541 6.722 71.955 53.660 1.00 0.00 H ATOM 71843 H2 WAT 541 5.779 70.984 52.981 1.00 0.00 H TER 71845 WAT 541 ATOM 71845 O WAT 542 68.447 96.357 125.269 1.00 0.00 O ATOM 71846 H1 WAT 542 68.371 95.549 124.761 1.00 0.00 H ATOM 71847 H2 WAT 542 69.134 96.855 124.826 1.00 0.00 H TER 71849 WAT 542 ATOM 71849 O WAT 543 57.977 83.301 133.248 1.00 0.00 O ATOM 71850 H1 WAT 543 57.249 82.687 133.153 1.00 0.00 H ATOM 71851 H2 WAT 543 57.939 83.842 132.459 1.00 0.00 H TER 71853 WAT 543 ATOM 71853 O WAT 544 85.899 97.768 114.464 1.00 0.00 O ATOM 71854 H1 WAT 544 86.433 98.475 114.101 1.00 0.00 H ATOM 71855 H2 WAT 544 85.361 98.194 115.132 1.00 0.00 H TER 71857 WAT 544 ATOM 71857 O WAT 545 62.457 140.391 101.944 1.00 0.00 O ATOM 71858 H1 WAT 545 62.648 140.288 101.011 1.00 0.00 H ATOM 71859 H2 WAT 545 62.628 139.528 102.320 1.00 0.00 H TER 71861 WAT 545 ATOM 71861 O WAT 546 65.863 91.545 95.237 1.00 0.00 O ATOM 71862 H1 WAT 546 66.374 91.183 95.961 1.00 0.00 H ATOM 71863 H2 WAT 546 65.889 90.867 94.563 1.00 0.00 H TER 71865 WAT 546 ATOM 71865 O WAT 547 45.544 85.914 110.562 1.00 0.00 O ATOM 71866 H1 WAT 547 45.233 86.756 110.894 1.00 0.00 H ATOM 71867 H2 WAT 547 46.151 86.143 109.858 1.00 0.00 H TER 71869 WAT 547 ATOM 71869 O WAT 548 80.398 13.666 144.870 1.00 0.00 O ATOM 71870 H1 WAT 548 81.166 14.064 144.460 1.00 0.00 H ATOM 71871 H2 WAT 548 79.957 13.206 144.155 1.00 0.00 H TER 71873 WAT 548 ATOM 71873 O WAT 549 67.178 108.490 120.417 1.00 0.00 O ATOM 71874 H1 WAT 549 67.730 107.940 119.862 1.00 0.00 H ATOM 71875 H2 WAT 549 67.133 108.021 121.250 1.00 0.00 H TER 71877 WAT 549 ATOM 71877 O WAT 550 55.769 39.070 120.109 1.00 0.00 O ATOM 71878 H1 WAT 550 56.379 39.806 120.152 1.00 0.00 H ATOM 71879 H2 WAT 550 56.005 38.520 120.857 1.00 0.00 H TER 71881 WAT 550 ATOM 71881 O WAT 551 10.465 135.717 120.842 1.00 0.00 O ATOM 71882 H1 WAT 551 10.457 135.553 121.785 1.00 0.00 H ATOM 71883 H2 WAT 551 10.856 134.929 120.466 1.00 0.00 H TER 71885 WAT 551 ATOM 71885 O WAT 552 107.266 33.836 21.487 1.00 0.00 O ATOM 71886 H1 WAT 552 107.510 34.106 22.372 1.00 0.00 H ATOM 71887 H2 WAT 552 106.862 32.976 21.602 1.00 0.00 H TER 71889 WAT 552 ATOM 71889 O WAT 553 43.295 139.284 121.473 1.00 0.00 O ATOM 71890 H1 WAT 553 43.356 140.210 121.235 1.00 0.00 H ATOM 71891 H2 WAT 553 44.091 139.113 121.976 1.00 0.00 H TER 71893 WAT 553 ATOM 71893 O WAT 554 63.605 139.231 137.849 1.00 0.00 O ATOM 71894 H1 WAT 554 64.463 139.621 137.683 1.00 0.00 H ATOM 71895 H2 WAT 554 63.448 138.667 137.091 1.00 0.00 H TER 71897 WAT 554 ATOM 71897 O WAT 555 131.846 105.463 98.460 1.00 0.00 O ATOM 71898 H1 WAT 555 131.802 106.396 98.668 1.00 0.00 H ATOM 71899 H2 WAT 555 132.299 105.426 97.618 1.00 0.00 H TER 71901 WAT 555 ATOM 71901 O WAT 556 64.335 81.603 141.264 1.00 0.00 O ATOM 71902 H1 WAT 556 64.975 82.314 141.207 1.00 0.00 H ATOM 71903 H2 WAT 556 64.148 81.377 140.353 1.00 0.00 H TER 71905 WAT 556 ATOM 71905 O WAT 557 8.964 40.884 150.679 1.00 0.00 O ATOM 71906 H1 WAT 557 8.168 41.408 150.590 1.00 0.00 H ATOM 71907 H2 WAT 557 8.963 40.599 151.593 1.00 0.00 H TER 71909 WAT 557 ATOM 71909 O WAT 558 94.982 74.108 98.240 1.00 0.00 O ATOM 71910 H1 WAT 558 95.832 73.816 97.910 1.00 0.00 H ATOM 71911 H2 WAT 558 95.196 74.775 98.893 1.00 0.00 H TER 71913 WAT 558 ATOM 71913 O WAT 559 126.697 77.024 127.668 1.00 0.00 O ATOM 71914 H1 WAT 559 126.462 76.286 127.106 1.00 0.00 H ATOM 71915 H2 WAT 559 125.876 77.274 128.091 1.00 0.00 H TER 71917 WAT 559 ATOM 71917 O WAT 560 10.646 24.273 140.749 1.00 0.00 O ATOM 71918 H1 WAT 560 11.293 24.827 141.187 1.00 0.00 H ATOM 71919 H2 WAT 560 10.987 23.384 140.845 1.00 0.00 H TER 71921 WAT 560 ATOM 71921 O WAT 561 138.436 92.449 128.859 1.00 0.00 O ATOM 71922 H1 WAT 561 138.720 93.363 128.874 1.00 0.00 H ATOM 71923 H2 WAT 561 139.198 91.966 128.540 1.00 0.00 H TER 71925 WAT 561 ATOM 71925 O WAT 562 59.896 87.058 113.332 1.00 0.00 O ATOM 71926 H1 WAT 562 60.369 87.890 113.326 1.00 0.00 H ATOM 71927 H2 WAT 562 59.327 87.111 114.100 1.00 0.00 H TER 71929 WAT 562 ATOM 71929 O WAT 563 53.125 94.823 157.549 1.00 0.00 O ATOM 71930 H1 WAT 563 54.007 95.124 157.331 1.00 0.00 H ATOM 71931 H2 WAT 563 53.257 94.176 158.241 1.00 0.00 H TER 71933 WAT 563 ATOM 71933 O WAT 564 55.899 34.304 115.150 1.00 0.00 O ATOM 71934 H1 WAT 564 55.468 34.983 114.631 1.00 0.00 H ATOM 71935 H2 WAT 564 55.189 33.892 115.642 1.00 0.00 H TER 71937 WAT 564 ATOM 71937 O WAT 565 75.991 64.583 71.820 1.00 0.00 O ATOM 71938 H1 WAT 565 76.179 65.431 72.220 1.00 0.00 H ATOM 71939 H2 WAT 565 75.928 63.978 72.559 1.00 0.00 H TER 71941 WAT 565 ATOM 71941 O WAT 566 121.734 18.013 81.896 1.00 0.00 O ATOM 71942 H1 WAT 566 122.396 17.436 82.276 1.00 0.00 H ATOM 71943 H2 WAT 566 121.324 17.487 81.209 1.00 0.00 H TER 71945 WAT 566 ATOM 71945 O WAT 567 89.337 91.859 149.259 1.00 0.00 O ATOM 71946 H1 WAT 567 88.980 91.813 148.372 1.00 0.00 H ATOM 71947 H2 WAT 567 88.567 91.917 149.824 1.00 0.00 H TER 71949 WAT 567 ATOM 71949 O WAT 568 130.463 67.912 108.369 1.00 0.00 O ATOM 71950 H1 WAT 568 130.882 67.073 108.562 1.00 0.00 H ATOM 71951 H2 WAT 568 131.171 68.463 108.037 1.00 0.00 H TER 71953 WAT 568 ATOM 71953 O WAT 569 129.457 88.939 133.708 1.00 0.00 O ATOM 71954 H1 WAT 569 129.986 88.156 133.857 1.00 0.00 H ATOM 71955 H2 WAT 569 128.559 88.659 133.883 1.00 0.00 H TER 71957 WAT 569 ATOM 71957 O WAT 570 82.083 1.120 96.174 1.00 0.00 O ATOM 71958 H1 WAT 570 81.524 1.896 96.206 1.00 0.00 H ATOM 71959 H2 WAT 570 82.859 1.363 96.679 1.00 0.00 H TER 71961 WAT 570 ATOM 71961 O WAT 571 139.459 45.100 66.811 1.00 0.00 O ATOM 71962 H1 WAT 571 139.973 45.465 66.091 1.00 0.00 H ATOM 71963 H2 WAT 571 138.559 45.366 66.621 1.00 0.00 H TER 71965 WAT 571 ATOM 71965 O WAT 572 96.590 102.427 121.125 1.00 0.00 O ATOM 71966 H1 WAT 572 97.091 101.836 120.562 1.00 0.00 H ATOM 71967 H2 WAT 572 96.792 103.302 120.794 1.00 0.00 H TER 71969 WAT 572 ATOM 71969 O WAT 573 139.823 54.189 91.068 1.00 0.00 O ATOM 71970 H1 WAT 573 139.694 53.405 90.533 1.00 0.00 H ATOM 71971 H2 WAT 573 140.529 54.664 90.630 1.00 0.00 H TER 71973 WAT 573 ATOM 71973 O WAT 574 87.140 41.794 8.774 1.00 0.00 O ATOM 71974 H1 WAT 574 86.752 41.273 9.477 1.00 0.00 H ATOM 71975 H2 WAT 574 87.160 42.686 9.120 1.00 0.00 H TER 71977 WAT 574 ATOM 71977 O WAT 575 7.045 75.663 57.923 1.00 0.00 O ATOM 71978 H1 WAT 575 6.480 75.755 57.155 1.00 0.00 H ATOM 71979 H2 WAT 575 7.897 75.989 57.634 1.00 0.00 H TER 71981 WAT 575 ATOM 71981 O WAT 576 143.851 133.304 105.909 1.00 0.00 O ATOM 71982 H1 WAT 576 144.601 133.885 105.783 1.00 0.00 H ATOM 71983 H2 WAT 576 144.202 132.425 105.769 1.00 0.00 H TER 71985 WAT 576 ATOM 71985 O WAT 577 112.313 11.943 145.971 1.00 0.00 O ATOM 71986 H1 WAT 577 112.015 12.649 146.544 1.00 0.00 H ATOM 71987 H2 WAT 577 113.229 11.807 146.215 1.00 0.00 H TER 71989 WAT 577 ATOM 71989 O WAT 578 113.426 94.831 60.436 1.00 0.00 O ATOM 71990 H1 WAT 578 112.896 94.282 61.013 1.00 0.00 H ATOM 71991 H2 WAT 578 113.991 94.214 59.970 1.00 0.00 H TER 71993 WAT 578 ATOM 71993 O WAT 579 10.802 122.510 138.138 1.00 0.00 O ATOM 71994 H1 WAT 579 11.422 121.925 138.573 1.00 0.00 H ATOM 71995 H2 WAT 579 11.346 123.056 137.570 1.00 0.00 H TER 71997 WAT 579 ATOM 71997 O WAT 580 65.131 58.396 150.308 1.00 0.00 O ATOM 71998 H1 WAT 580 64.763 58.139 149.463 1.00 0.00 H ATOM 71999 H2 WAT 580 64.424 58.241 150.934 1.00 0.00 H TER 72001 WAT 580 ATOM 72001 O WAT 581 29.715 55.437 71.831 1.00 0.00 O ATOM 72002 H1 WAT 581 30.366 55.934 71.336 1.00 0.00 H ATOM 72003 H2 WAT 581 29.338 54.833 71.192 1.00 0.00 H TER 72005 WAT 581 ATOM 72005 O WAT 582 138.193 41.370 108.597 1.00 0.00 O ATOM 72006 H1 WAT 582 138.363 40.801 109.348 1.00 0.00 H ATOM 72007 H2 WAT 582 139.035 41.428 108.146 1.00 0.00 H TER 72009 WAT 582 ATOM 72009 O WAT 583 69.406 34.868 7.264 1.00 0.00 O ATOM 72010 H1 WAT 583 69.967 34.300 7.792 1.00 0.00 H ATOM 72011 H2 WAT 583 68.549 34.443 7.284 1.00 0.00 H TER 72013 WAT 583 ATOM 72013 O WAT 584 104.661 32.402 138.018 1.00 0.00 O ATOM 72014 H1 WAT 584 103.827 32.734 138.351 1.00 0.00 H ATOM 72015 H2 WAT 584 105.080 32.001 138.779 1.00 0.00 H TER 72017 WAT 584 ATOM 72017 O WAT 585 1.795 34.670 58.417 1.00 0.00 O ATOM 72018 H1 WAT 585 1.039 35.256 58.402 1.00 0.00 H ATOM 72019 H2 WAT 585 2.517 35.218 58.725 1.00 0.00 H TER 72021 WAT 585 ATOM 72021 O WAT 586 94.393 130.562 93.702 1.00 0.00 O ATOM 72022 H1 WAT 586 93.482 130.373 93.926 1.00 0.00 H ATOM 72023 H2 WAT 586 94.588 129.971 92.974 1.00 0.00 H TER 72025 WAT 586 ATOM 72025 O WAT 587 117.168 5.887 115.666 1.00 0.00 O ATOM 72026 H1 WAT 587 117.901 6.259 115.174 1.00 0.00 H ATOM 72027 H2 WAT 587 116.565 5.570 114.993 1.00 0.00 H TER 72029 WAT 587 ATOM 72029 O WAT 588 119.541 98.077 12.216 1.00 0.00 O ATOM 72030 H1 WAT 588 120.179 98.420 11.590 1.00 0.00 H ATOM 72031 H2 WAT 588 118.695 98.190 11.781 1.00 0.00 H TER 72033 WAT 588 ATOM 72033 O WAT 589 67.019 140.179 80.171 1.00 0.00 O ATOM 72034 H1 WAT 589 67.527 140.989 80.218 1.00 0.00 H ATOM 72035 H2 WAT 589 67.348 139.735 79.389 1.00 0.00 H TER 72037 WAT 589 ATOM 72037 O WAT 590 140.212 68.742 93.510 1.00 0.00 O ATOM 72038 H1 WAT 590 140.640 69.202 92.788 1.00 0.00 H ATOM 72039 H2 WAT 590 139.346 68.517 93.171 1.00 0.00 H TER 72041 WAT 590 ATOM 72041 O WAT 591 78.279 26.800 96.266 1.00 0.00 O ATOM 72042 H1 WAT 591 78.054 27.098 95.385 1.00 0.00 H ATOM 72043 H2 WAT 591 77.694 26.059 96.425 1.00 0.00 H TER 72045 WAT 591 ATOM 72045 O WAT 592 63.734 95.000 111.661 1.00 0.00 O ATOM 72046 H1 WAT 592 62.933 94.823 111.166 1.00 0.00 H ATOM 72047 H2 WAT 592 63.865 94.215 112.193 1.00 0.00 H TER 72049 WAT 592 ATOM 72049 O WAT 593 115.248 121.777 80.716 1.00 0.00 O ATOM 72050 H1 WAT 593 114.742 122.535 81.007 1.00 0.00 H ATOM 72051 H2 WAT 593 115.251 121.843 79.761 1.00 0.00 H TER 72053 WAT 593 ATOM 72053 O WAT 594 18.134 100.720 93.272 1.00 0.00 O ATOM 72054 H1 WAT 594 17.921 100.250 92.466 1.00 0.00 H ATOM 72055 H2 WAT 594 17.335 101.203 93.486 1.00 0.00 H TER 72057 WAT 594 ATOM 72057 O WAT 595 13.866 93.246 125.680 1.00 0.00 O ATOM 72058 H1 WAT 595 13.969 92.539 125.044 1.00 0.00 H ATOM 72059 H2 WAT 595 13.178 93.801 125.312 1.00 0.00 H TER 72061 WAT 595 ATOM 72061 O WAT 596 105.999 70.286 83.402 1.00 0.00 O ATOM 72062 H1 WAT 596 106.178 69.356 83.541 1.00 0.00 H ATOM 72063 H2 WAT 596 105.658 70.335 82.509 1.00 0.00 H TER 72065 WAT 596 ATOM 72065 O WAT 597 28.162 12.022 116.416 1.00 0.00 O ATOM 72066 H1 WAT 597 28.376 12.127 117.343 1.00 0.00 H ATOM 72067 H2 WAT 597 27.443 12.636 116.265 1.00 0.00 H TER 72069 WAT 597 ATOM 72069 O WAT 598 102.763 68.296 9.722 1.00 0.00 O ATOM 72070 H1 WAT 598 102.175 68.859 10.225 1.00 0.00 H ATOM 72071 H2 WAT 598 103.364 67.934 10.374 1.00 0.00 H TER 72073 WAT 598 ATOM 72073 O WAT 599 119.682 125.925 74.192 1.00 0.00 O ATOM 72074 H1 WAT 599 119.890 125.990 75.124 1.00 0.00 H ATOM 72075 H2 WAT 599 120.527 125.770 73.769 1.00 0.00 H TER 72077 WAT 599 ATOM 72077 O WAT 600 21.778 59.899 61.050 1.00 0.00 O ATOM 72078 H1 WAT 600 21.589 59.617 61.945 1.00 0.00 H ATOM 72079 H2 WAT 600 22.282 59.178 60.672 1.00 0.00 H TER 72081 WAT 600 ATOM 72081 O WAT 601 45.505 56.758 14.869 1.00 0.00 O ATOM 72082 H1 WAT 601 45.404 57.615 15.284 1.00 0.00 H ATOM 72083 H2 WAT 601 46.128 56.293 15.427 1.00 0.00 H TER 72085 WAT 601 ATOM 72085 O WAT 602 51.723 73.912 70.359 1.00 0.00 O ATOM 72086 H1 WAT 602 52.552 73.945 69.880 1.00 0.00 H ATOM 72087 H2 WAT 602 51.256 73.168 69.979 1.00 0.00 H TER 72089 WAT 602 ATOM 72089 O WAT 603 51.607 49.175 155.326 1.00 0.00 O ATOM 72090 H1 WAT 603 52.245 49.296 156.029 1.00 0.00 H ATOM 72091 H2 WAT 603 51.888 49.782 154.640 1.00 0.00 H TER 72093 WAT 603 ATOM 72093 O WAT 604 15.662 39.573 7.443 1.00 0.00 O ATOM 72094 H1 WAT 604 16.485 39.200 7.760 1.00 0.00 H ATOM 72095 H2 WAT 604 15.648 40.461 7.800 1.00 0.00 H TER 72097 WAT 604 ATOM 72097 O WAT 605 93.456 120.645 154.947 1.00 0.00 O ATOM 72098 H1 WAT 605 93.950 121.465 154.971 1.00 0.00 H ATOM 72099 H2 WAT 605 93.880 120.091 155.603 1.00 0.00 H TER 72101 WAT 605 ATOM 72101 O WAT 606 100.768 4.213 78.576 1.00 0.00 O ATOM 72102 H1 WAT 606 101.433 4.553 79.175 1.00 0.00 H ATOM 72103 H2 WAT 606 101.264 3.899 77.820 1.00 0.00 H TER 72105 WAT 606 ATOM 72105 O WAT 607 92.113 15.193 125.917 1.00 0.00 O ATOM 72106 H1 WAT 607 92.398 15.006 126.812 1.00 0.00 H ATOM 72107 H2 WAT 607 92.452 14.461 125.401 1.00 0.00 H TER 72109 WAT 607 ATOM 72109 O WAT 608 93.415 122.467 133.805 1.00 0.00 O ATOM 72110 H1 WAT 608 93.297 122.744 134.714 1.00 0.00 H ATOM 72111 H2 WAT 608 93.179 123.236 133.287 1.00 0.00 H TER 72113 WAT 608 ATOM 72113 O WAT 609 31.922 134.013 131.518 1.00 0.00 O ATOM 72114 H1 WAT 609 32.785 134.419 131.592 1.00 0.00 H ATOM 72115 H2 WAT 609 31.900 133.365 132.222 1.00 0.00 H TER 72117 WAT 609 ATOM 72117 O WAT 610 15.683 138.014 66.284 1.00 0.00 O ATOM 72118 H1 WAT 610 15.704 137.693 67.185 1.00 0.00 H ATOM 72119 H2 WAT 610 14.946 137.554 65.883 1.00 0.00 H TER 72121 WAT 610 ATOM 72121 O WAT 611 98.759 10.123 143.634 1.00 0.00 O ATOM 72122 H1 WAT 611 98.071 9.893 143.009 1.00 0.00 H ATOM 72123 H2 WAT 611 98.351 10.008 144.492 1.00 0.00 H TER 72125 WAT 611 ATOM 72125 O WAT 612 44.464 108.313 72.592 1.00 0.00 O ATOM 72126 H1 WAT 612 44.406 108.483 71.652 1.00 0.00 H ATOM 72127 H2 WAT 612 45.376 108.501 72.813 1.00 0.00 H TER 72129 WAT 612 ATOM 72129 O WAT 613 52.557 20.319 136.247 1.00 0.00 O ATOM 72130 H1 WAT 613 52.881 19.847 135.480 1.00 0.00 H ATOM 72131 H2 WAT 613 53.289 20.876 136.512 1.00 0.00 H TER 72133 WAT 613 ATOM 72133 O WAT 614 122.657 71.793 82.205 1.00 0.00 O ATOM 72134 H1 WAT 614 122.087 72.230 82.838 1.00 0.00 H ATOM 72135 H2 WAT 614 122.737 70.898 82.534 1.00 0.00 H TER 72137 WAT 614 ATOM 72137 O WAT 615 131.688 50.464 80.391 1.00 0.00 O ATOM 72138 H1 WAT 615 132.189 49.667 80.565 1.00 0.00 H ATOM 72139 H2 WAT 615 132.341 51.164 80.401 1.00 0.00 H TER 72141 WAT 615 ATOM 72141 O WAT 616 138.216 110.049 114.147 1.00 0.00 O ATOM 72142 H1 WAT 616 137.836 110.914 113.995 1.00 0.00 H ATOM 72143 H2 WAT 616 138.364 109.695 113.271 1.00 0.00 H TER 72145 WAT 616 ATOM 72145 O WAT 617 62.802 101.856 139.042 1.00 0.00 O ATOM 72146 H1 WAT 617 62.815 100.907 138.917 1.00 0.00 H ATOM 72147 H2 WAT 617 63.722 102.117 138.988 1.00 0.00 H TER 72149 WAT 617 ATOM 72149 O WAT 618 125.674 3.263 121.648 1.00 0.00 O ATOM 72150 H1 WAT 618 124.761 3.062 121.853 1.00 0.00 H ATOM 72151 H2 WAT 618 126.051 2.424 121.384 1.00 0.00 H TER 72153 WAT 618 ATOM 72153 O WAT 619 9.748 75.057 85.366 1.00 0.00 O ATOM 72154 H1 WAT 619 10.667 75.219 85.154 1.00 0.00 H ATOM 72155 H2 WAT 619 9.301 75.066 84.520 1.00 0.00 H TER 72157 WAT 619 ATOM 72157 O WAT 620 123.910 5.127 82.376 1.00 0.00 O ATOM 72158 H1 WAT 620 123.985 4.829 81.470 1.00 0.00 H ATOM 72159 H2 WAT 620 122.991 4.982 82.601 1.00 0.00 H TER 72161 WAT 620 ATOM 72161 O WAT 621 89.256 32.435 138.484 1.00 0.00 O ATOM 72162 H1 WAT 621 88.331 32.593 138.674 1.00 0.00 H ATOM 72163 H2 WAT 621 89.676 33.286 138.612 1.00 0.00 H TER 72165 WAT 621 ATOM 72165 O WAT 622 19.276 105.038 65.631 1.00 0.00 O ATOM 72166 H1 WAT 622 19.211 105.990 65.548 1.00 0.00 H ATOM 72167 H2 WAT 622 18.759 104.830 66.409 1.00 0.00 H TER 72169 WAT 622 ATOM 72169 O WAT 623 51.782 88.807 90.205 1.00 0.00 O ATOM 72170 H1 WAT 623 51.799 89.604 90.734 1.00 0.00 H ATOM 72171 H2 WAT 623 52.700 88.545 90.137 1.00 0.00 H TER 72173 WAT 623 ATOM 72173 O WAT 624 132.383 126.987 136.885 1.00 0.00 O ATOM 72174 H1 WAT 624 131.587 126.625 136.496 1.00 0.00 H ATOM 72175 H2 WAT 624 133.048 126.891 136.203 1.00 0.00 H TER 72177 WAT 624 ATOM 72177 O WAT 625 36.113 127.577 100.723 1.00 0.00 O ATOM 72178 H1 WAT 625 36.884 127.708 101.275 1.00 0.00 H ATOM 72179 H2 WAT 625 35.636 128.405 100.777 1.00 0.00 H TER 72181 WAT 625 ATOM 72181 O WAT 626 86.796 26.441 89.784 1.00 0.00 O ATOM 72182 H1 WAT 626 85.859 26.294 89.654 1.00 0.00 H ATOM 72183 H2 WAT 626 87.172 26.371 88.907 1.00 0.00 H TER 72185 WAT 626 ATOM 72185 O WAT 627 23.370 53.145 96.265 1.00 0.00 O ATOM 72186 H1 WAT 627 23.456 52.741 95.401 1.00 0.00 H ATOM 72187 H2 WAT 627 23.093 52.429 96.837 1.00 0.00 H TER 72189 WAT 627 ATOM 72189 O WAT 628 144.904 23.113 74.700 1.00 0.00 O ATOM 72190 H1 WAT 628 144.831 22.499 73.969 1.00 0.00 H ATOM 72191 H2 WAT 628 144.231 22.828 75.319 1.00 0.00 H TER 72193 WAT 628 ATOM 72193 O WAT 629 138.405 9.726 120.665 1.00 0.00 O ATOM 72194 H1 WAT 629 137.575 10.203 120.698 1.00 0.00 H ATOM 72195 H2 WAT 629 138.745 9.898 119.786 1.00 0.00 H TER 72197 WAT 629 ATOM 72197 O WAT 630 125.409 128.735 121.819 1.00 0.00 O ATOM 72198 H1 WAT 630 125.544 128.763 120.872 1.00 0.00 H ATOM 72199 H2 WAT 630 125.318 129.653 122.075 1.00 0.00 H TER 72201 WAT 630 ATOM 72201 O WAT 631 52.452 114.744 53.969 1.00 0.00 O ATOM 72202 H1 WAT 631 53.154 114.758 54.619 1.00 0.00 H ATOM 72203 H2 WAT 631 52.697 115.420 53.337 1.00 0.00 H TER 72205 WAT 631 ATOM 72205 O WAT 632 115.639 100.837 102.009 1.00 0.00 O ATOM 72206 H1 WAT 632 115.666 100.199 102.722 1.00 0.00 H ATOM 72207 H2 WAT 632 116.355 101.442 102.203 1.00 0.00 H TER 72209 WAT 632 ATOM 72209 O WAT 633 69.401 125.553 99.867 1.00 0.00 O ATOM 72210 H1 WAT 633 68.589 125.322 99.415 1.00 0.00 H ATOM 72211 H2 WAT 633 69.471 126.502 99.764 1.00 0.00 H TER 72213 WAT 633 ATOM 72213 O WAT 634 54.163 110.673 108.390 1.00 0.00 O ATOM 72214 H1 WAT 634 54.536 109.936 107.907 1.00 0.00 H ATOM 72215 H2 WAT 634 54.579 110.628 109.252 1.00 0.00 H TER 72217 WAT 634 ATOM 72217 O WAT 635 32.519 2.410 99.123 1.00 0.00 O ATOM 72218 H1 WAT 635 31.899 1.851 98.654 1.00 0.00 H ATOM 72219 H2 WAT 635 33.244 2.531 98.510 1.00 0.00 H TER 72221 WAT 635 ATOM 72221 O WAT 636 97.503 109.726 116.480 1.00 0.00 O ATOM 72222 H1 WAT 636 97.756 110.618 116.242 1.00 0.00 H ATOM 72223 H2 WAT 636 98.301 109.211 116.362 1.00 0.00 H TER 72225 WAT 636 ATOM 72225 O WAT 637 28.540 117.191 95.313 1.00 0.00 O ATOM 72226 H1 WAT 637 29.224 117.809 95.053 1.00 0.00 H ATOM 72227 H2 WAT 637 28.794 116.366 94.901 1.00 0.00 H TER 72229 WAT 637 ATOM 72229 O WAT 638 38.861 133.319 65.623 1.00 0.00 O ATOM 72230 H1 WAT 638 39.771 133.136 65.857 1.00 0.00 H ATOM 72231 H2 WAT 638 38.915 133.772 64.782 1.00 0.00 H TER 72233 WAT 638 ATOM 72233 O WAT 639 134.027 5.748 21.202 1.00 0.00 O ATOM 72234 H1 WAT 639 134.581 5.300 20.562 1.00 0.00 H ATOM 72235 H2 WAT 639 133.376 6.209 20.674 1.00 0.00 H TER 72237 WAT 639 ATOM 72237 O WAT 640 52.689 107.955 84.146 1.00 0.00 O ATOM 72238 H1 WAT 640 53.099 108.705 84.576 1.00 0.00 H ATOM 72239 H2 WAT 640 52.587 108.228 83.234 1.00 0.00 H TER 72241 WAT 640 ATOM 72241 O WAT 641 77.145 49.887 78.542 1.00 0.00 O ATOM 72242 H1 WAT 641 77.970 49.939 79.024 1.00 0.00 H ATOM 72243 H2 WAT 641 77.392 49.561 77.677 1.00 0.00 H TER 72245 WAT 641 ATOM 72245 O WAT 642 5.639 62.625 68.313 1.00 0.00 O ATOM 72246 H1 WAT 642 5.337 63.526 68.199 1.00 0.00 H ATOM 72247 H2 WAT 642 5.619 62.253 67.431 1.00 0.00 H TER 72249 WAT 642 ATOM 72249 O WAT 643 116.317 4.722 8.057 1.00 0.00 O ATOM 72250 H1 WAT 643 116.183 4.770 7.110 1.00 0.00 H ATOM 72251 H2 WAT 643 115.433 4.706 8.423 1.00 0.00 H TER 72253 WAT 643 ATOM 72253 O WAT 644 98.946 75.216 154.581 1.00 0.00 O ATOM 72254 H1 WAT 644 98.042 75.303 154.884 1.00 0.00 H ATOM 72255 H2 WAT 644 99.468 75.642 155.261 1.00 0.00 H TER 72257 WAT 644 ATOM 72257 O WAT 645 61.539 86.514 150.330 1.00 0.00 O ATOM 72258 H1 WAT 645 60.717 86.508 149.839 1.00 0.00 H ATOM 72259 H2 WAT 645 61.500 87.315 150.853 1.00 0.00 H TER 72261 WAT 645 ATOM 72261 O WAT 646 96.471 101.574 124.071 1.00 0.00 O ATOM 72262 H1 WAT 646 96.884 101.866 124.884 1.00 0.00 H ATOM 72263 H2 WAT 646 96.424 102.362 123.530 1.00 0.00 H TER 72265 WAT 646 ATOM 72265 O WAT 647 104.204 44.186 141.043 1.00 0.00 O ATOM 72266 H1 WAT 647 104.968 43.670 140.786 1.00 0.00 H ATOM 72267 H2 WAT 647 103.828 43.706 141.781 1.00 0.00 H TER 72269 WAT 647 ATOM 72269 O WAT 648 88.441 35.062 90.269 1.00 0.00 O ATOM 72270 H1 WAT 648 88.779 35.726 89.669 1.00 0.00 H ATOM 72271 H2 WAT 648 88.709 34.229 89.881 1.00 0.00 H TER 72273 WAT 648 ATOM 72273 O WAT 649 126.258 90.561 122.452 1.00 0.00 O ATOM 72274 H1 WAT 649 126.763 89.997 123.037 1.00 0.00 H ATOM 72275 H2 WAT 649 126.709 91.405 122.484 1.00 0.00 H TER 72277 WAT 649 ATOM 72277 O WAT 650 134.955 109.748 146.549 1.00 0.00 O ATOM 72278 H1 WAT 650 135.566 109.258 147.099 1.00 0.00 H ATOM 72279 H2 WAT 650 135.465 110.494 146.231 1.00 0.00 H TER 72281 WAT 650 ATOM 72281 O WAT 651 26.542 91.321 12.197 1.00 0.00 O ATOM 72282 H1 WAT 651 25.912 91.895 12.633 1.00 0.00 H ATOM 72283 H2 WAT 651 26.466 90.487 12.659 1.00 0.00 H TER 72285 WAT 651 ATOM 72285 O WAT 652 1.999 26.002 5.057 1.00 0.00 O ATOM 72286 H1 WAT 652 1.109 25.781 4.782 1.00 0.00 H ATOM 72287 H2 WAT 652 2.022 26.959 5.047 1.00 0.00 H TER 72289 WAT 652 ATOM 72289 O WAT 653 13.876 121.567 152.044 1.00 0.00 O ATOM 72290 H1 WAT 653 14.574 121.868 152.624 1.00 0.00 H ATOM 72291 H2 WAT 653 13.598 120.730 152.416 1.00 0.00 H TER 72293 WAT 653 ATOM 72293 O WAT 654 45.580 42.004 152.987 1.00 0.00 O ATOM 72294 H1 WAT 654 45.699 41.453 153.760 1.00 0.00 H ATOM 72295 H2 WAT 654 46.009 41.522 152.280 1.00 0.00 H TER 72297 WAT 654 ATOM 72297 O WAT 655 52.589 16.913 54.549 1.00 0.00 O ATOM 72298 H1 WAT 655 53.278 17.572 54.629 1.00 0.00 H ATOM 72299 H2 WAT 655 52.841 16.227 55.167 1.00 0.00 H TER 72301 WAT 655 ATOM 72301 O WAT 656 142.743 97.990 105.068 1.00 0.00 O ATOM 72302 H1 WAT 656 142.030 97.956 105.706 1.00 0.00 H ATOM 72303 H2 WAT 656 143.529 97.793 105.576 1.00 0.00 H TER 72305 WAT 656 ATOM 72305 O WAT 657 34.813 85.085 98.984 1.00 0.00 O ATOM 72306 H1 WAT 657 34.218 85.770 98.679 1.00 0.00 H ATOM 72307 H2 WAT 657 34.922 84.509 98.228 1.00 0.00 H TER 72309 WAT 657 ATOM 72309 O WAT 658 124.975 70.954 3.378 1.00 0.00 O ATOM 72310 H1 WAT 658 125.182 70.862 2.448 1.00 0.00 H ATOM 72311 H2 WAT 658 124.048 70.727 3.441 1.00 0.00 H TER 72313 WAT 658 ATOM 72313 O WAT 659 19.088 21.942 138.762 1.00 0.00 O ATOM 72314 H1 WAT 659 19.544 21.614 139.537 1.00 0.00 H ATOM 72315 H2 WAT 659 19.704 21.800 138.044 1.00 0.00 H TER 72317 WAT 659 ATOM 72317 O WAT 660 21.912 83.129 58.664 1.00 0.00 O ATOM 72318 H1 WAT 660 22.386 82.768 59.414 1.00 0.00 H ATOM 72319 H2 WAT 660 21.019 82.799 58.764 1.00 0.00 H TER 72321 WAT 660 ATOM 72321 O WAT 661 77.613 116.983 78.813 1.00 0.00 O ATOM 72322 H1 WAT 661 77.802 117.263 79.709 1.00 0.00 H ATOM 72323 H2 WAT 661 78.413 116.541 78.527 1.00 0.00 H TER 72325 WAT 661 ATOM 72325 O WAT 662 113.724 62.381 138.918 1.00 0.00 O ATOM 72326 H1 WAT 662 112.833 62.675 138.728 1.00 0.00 H ATOM 72327 H2 WAT 662 114.258 62.770 138.225 1.00 0.00 H TER 72329 WAT 662 ATOM 72329 O WAT 663 35.585 25.335 87.310 1.00 0.00 O ATOM 72330 H1 WAT 663 36.479 24.993 87.303 1.00 0.00 H ATOM 72331 H2 WAT 663 35.097 24.720 87.857 1.00 0.00 H TER 72333 WAT 663 ATOM 72333 O WAT 664 69.517 31.140 95.993 1.00 0.00 O ATOM 72334 H1 WAT 664 69.927 31.391 95.165 1.00 0.00 H ATOM 72335 H2 WAT 664 69.232 30.237 95.855 1.00 0.00 H TER 72337 WAT 664 ATOM 72337 O WAT 665 2.218 141.050 0.537 1.00 0.00 O ATOM 72338 H1 WAT 665 1.442 140.964 -0.017 1.00 0.00 H ATOM 72339 H2 WAT 665 2.764 140.300 0.301 1.00 0.00 H TER 72341 WAT 665 ATOM 72341 O WAT 666 128.798 53.761 77.323 1.00 0.00 O ATOM 72342 H1 WAT 666 127.890 53.677 77.611 1.00 0.00 H ATOM 72343 H2 WAT 666 129.271 53.097 77.824 1.00 0.00 H TER 72345 WAT 666 ATOM 72345 O WAT 667 129.709 18.938 110.209 1.00 0.00 O ATOM 72346 H1 WAT 667 129.024 19.569 109.990 1.00 0.00 H ATOM 72347 H2 WAT 667 129.487 18.157 109.702 1.00 0.00 H TER 72349 WAT 667 ATOM 72349 O WAT 668 29.403 123.728 12.794 1.00 0.00 O ATOM 72350 H1 WAT 668 30.347 123.814 12.925 1.00 0.00 H ATOM 72351 H2 WAT 668 29.294 123.707 11.843 1.00 0.00 H TER 72353 WAT 668 ATOM 72353 O WAT 669 25.549 96.185 21.304 1.00 0.00 O ATOM 72354 H1 WAT 669 25.310 96.781 20.594 1.00 0.00 H ATOM 72355 H2 WAT 669 26.498 96.282 21.388 1.00 0.00 H TER 72357 WAT 669 ATOM 72357 O WAT 670 31.453 31.312 121.302 1.00 0.00 O ATOM 72358 H1 WAT 670 32.292 31.188 121.745 1.00 0.00 H ATOM 72359 H2 WAT 670 31.199 30.433 121.019 1.00 0.00 H TER 72361 WAT 670 ATOM 72361 O WAT 671 130.228 116.059 6.404 1.00 0.00 O ATOM 72362 H1 WAT 671 129.293 116.029 6.606 1.00 0.00 H ATOM 72363 H2 WAT 671 130.263 116.234 5.463 1.00 0.00 H TER 72365 WAT 671 ATOM 72365 O WAT 672 58.479 88.237 155.626 1.00 0.00 O ATOM 72366 H1 WAT 672 58.088 89.107 155.709 1.00 0.00 H ATOM 72367 H2 WAT 672 59.114 88.190 156.341 1.00 0.00 H TER 72369 WAT 672 ATOM 72369 O WAT 673 59.678 7.261 106.671 1.00 0.00 O ATOM 72370 H1 WAT 673 59.696 6.318 106.836 1.00 0.00 H ATOM 72371 H2 WAT 673 60.471 7.593 107.092 1.00 0.00 H TER 72373 WAT 673 ATOM 72373 O WAT 674 47.305 48.463 105.932 1.00 0.00 O ATOM 72374 H1 WAT 674 48.182 48.842 105.869 1.00 0.00 H ATOM 72375 H2 WAT 674 46.820 48.860 105.209 1.00 0.00 H TER 72377 WAT 674 ATOM 72377 O WAT 675 32.800 114.218 90.521 1.00 0.00 O ATOM 72378 H1 WAT 675 33.126 114.902 89.936 1.00 0.00 H ATOM 72379 H2 WAT 675 31.973 114.563 90.856 1.00 0.00 H TER 72381 WAT 675 ATOM 72381 O WAT 676 67.369 65.995 151.117 1.00 0.00 O ATOM 72382 H1 WAT 676 66.979 66.536 151.803 1.00 0.00 H ATOM 72383 H2 WAT 676 66.743 65.282 150.990 1.00 0.00 H TER 72385 WAT 676 ATOM 72385 O WAT 677 145.009 10.844 153.181 1.00 0.00 O ATOM 72386 H1 WAT 677 144.945 9.892 153.110 1.00 0.00 H ATOM 72387 H2 WAT 677 145.948 11.024 153.154 1.00 0.00 H TER 72389 WAT 677 ATOM 72389 O WAT 678 -0.001 130.418 103.542 1.00 0.00 O ATOM 72390 H1 WAT 678 -0.164 130.373 102.600 1.00 0.00 H ATOM 72391 H2 WAT 678 0.552 131.190 103.653 1.00 0.00 H TER 72393 WAT 678 ATOM 72393 O WAT 679 26.096 114.146 116.415 1.00 0.00 O ATOM 72394 H1 WAT 679 26.121 113.998 115.470 1.00 0.00 H ATOM 72395 H2 WAT 679 27.017 114.204 116.672 1.00 0.00 H TER 72397 WAT 679 ATOM 72397 O WAT 680 75.765 107.297 146.773 1.00 0.00 O ATOM 72398 H1 WAT 680 75.937 108.064 147.319 1.00 0.00 H ATOM 72399 H2 WAT 680 76.236 106.585 147.205 1.00 0.00 H TER 72401 WAT 680 ATOM 72401 O WAT 681 16.144 128.683 149.738 1.00 0.00 O ATOM 72402 H1 WAT 681 16.203 127.749 149.940 1.00 0.00 H ATOM 72403 H2 WAT 681 15.254 128.927 149.994 1.00 0.00 H TER 72405 WAT 681 ATOM 72405 O WAT 682 86.194 65.785 77.771 1.00 0.00 O ATOM 72406 H1 WAT 682 85.907 66.550 78.270 1.00 0.00 H ATOM 72407 H2 WAT 682 86.566 65.197 78.428 1.00 0.00 H TER 72409 WAT 682 ATOM 72409 O WAT 683 28.833 142.542 95.924 1.00 0.00 O ATOM 72410 H1 WAT 683 29.011 141.930 96.638 1.00 0.00 H ATOM 72411 H2 WAT 683 28.218 143.173 96.298 1.00 0.00 H TER 72413 WAT 683 ATOM 72413 O WAT 684 1.129 6.019 150.900 1.00 0.00 O ATOM 72414 H1 WAT 684 1.993 5.648 151.081 1.00 0.00 H ATOM 72415 H2 WAT 684 0.520 5.437 151.355 1.00 0.00 H TER 72417 WAT 684 ATOM 72417 O WAT 685 41.879 121.756 69.903 1.00 0.00 O ATOM 72418 H1 WAT 685 41.082 121.655 70.424 1.00 0.00 H ATOM 72419 H2 WAT 685 41.740 122.563 69.407 1.00 0.00 H TER 72421 WAT 685 ATOM 72421 O WAT 686 86.126 60.536 116.450 1.00 0.00 O ATOM 72422 H1 WAT 686 85.919 61.469 116.491 1.00 0.00 H ATOM 72423 H2 WAT 686 85.470 60.171 115.856 1.00 0.00 H TER 72425 WAT 686 ATOM 72425 O WAT 687 128.345 71.974 1.331 1.00 0.00 O ATOM 72426 H1 WAT 687 127.486 72.369 1.482 1.00 0.00 H ATOM 72427 H2 WAT 687 128.319 71.685 0.419 1.00 0.00 H TER 72429 WAT 687 ATOM 72429 O WAT 688 57.051 5.658 100.253 1.00 0.00 O ATOM 72430 H1 WAT 688 57.914 5.924 99.937 1.00 0.00 H ATOM 72431 H2 WAT 688 56.616 5.293 99.483 1.00 0.00 H TER 72433 WAT 688 ATOM 72433 O WAT 689 32.008 145.014 125.077 1.00 0.00 O ATOM 72434 H1 WAT 689 32.908 145.340 125.069 1.00 0.00 H ATOM 72435 H2 WAT 689 32.012 144.285 124.456 1.00 0.00 H TER 72437 WAT 689 ATOM 72437 O WAT 690 11.392 30.140 96.621 1.00 0.00 O ATOM 72438 H1 WAT 690 11.286 30.233 97.568 1.00 0.00 H ATOM 72439 H2 WAT 690 11.632 29.222 96.496 1.00 0.00 H TER 72441 WAT 690 ATOM 72441 O WAT 691 25.446 98.567 86.142 1.00 0.00 O ATOM 72442 H1 WAT 691 25.006 97.723 86.036 1.00 0.00 H ATOM 72443 H2 WAT 691 25.036 99.134 85.489 1.00 0.00 H TER 72445 WAT 691 ATOM 72445 O WAT 692 22.151 36.038 157.071 1.00 0.00 O ATOM 72446 H1 WAT 692 22.098 36.824 156.528 1.00 0.00 H ATOM 72447 H2 WAT 692 23.045 36.042 157.412 1.00 0.00 H TER 72449 WAT 692 ATOM 72449 O WAT 693 28.676 115.351 130.442 1.00 0.00 O ATOM 72450 H1 WAT 693 28.612 116.177 129.962 1.00 0.00 H ATOM 72451 H2 WAT 693 29.552 115.365 130.826 1.00 0.00 H TER 72453 WAT 693 ATOM 72453 O WAT 694 42.336 8.672 130.091 1.00 0.00 O ATOM 72454 H1 WAT 694 43.062 8.442 130.671 1.00 0.00 H ATOM 72455 H2 WAT 694 41.918 9.421 130.517 1.00 0.00 H TER 72457 WAT 694 ATOM 72457 O WAT 695 74.485 102.962 87.000 1.00 0.00 O ATOM 72458 H1 WAT 695 75.136 102.262 86.955 1.00 0.00 H ATOM 72459 H2 WAT 695 74.707 103.446 87.795 1.00 0.00 H TER 72461 WAT 695 ATOM 72461 O WAT 696 101.509 134.958 5.595 1.00 0.00 O ATOM 72462 H1 WAT 696 101.710 134.883 6.527 1.00 0.00 H ATOM 72463 H2 WAT 696 101.430 135.899 5.441 1.00 0.00 H TER 72465 WAT 696 ATOM 72465 O WAT 697 4.071 110.155 80.929 1.00 0.00 O ATOM 72466 H1 WAT 697 4.330 109.404 80.395 1.00 0.00 H ATOM 72467 H2 WAT 697 4.795 110.774 80.840 1.00 0.00 H TER 72469 WAT 697 ATOM 72469 O WAT 698 61.377 48.179 66.849 1.00 0.00 O ATOM 72470 H1 WAT 698 61.135 47.437 67.403 1.00 0.00 H ATOM 72471 H2 WAT 698 60.616 48.759 66.879 1.00 0.00 H TER 72473 WAT 698 ATOM 72473 O WAT 699 100.122 111.677 70.820 1.00 0.00 O ATOM 72474 H1 WAT 699 99.753 111.401 69.982 1.00 0.00 H ATOM 72475 H2 WAT 699 99.538 112.374 71.121 1.00 0.00 H TER 72477 WAT 699 ATOM 72477 O WAT 700 39.682 1.305 123.187 1.00 0.00 O ATOM 72478 H1 WAT 700 39.353 0.918 122.376 1.00 0.00 H ATOM 72479 H2 WAT 700 40.342 0.685 123.497 1.00 0.00 H TER 72481 WAT 700 ATOM 72481 O WAT 701 133.120 5.335 4.095 1.00 0.00 O ATOM 72482 H1 WAT 701 132.475 4.629 4.053 1.00 0.00 H ATOM 72483 H2 WAT 701 133.701 5.086 4.813 1.00 0.00 H TER 72485 WAT 701 ATOM 72485 O WAT 702 81.037 139.573 146.548 1.00 0.00 O ATOM 72486 H1 WAT 702 81.609 140.159 146.051 1.00 0.00 H ATOM 72487 H2 WAT 702 80.813 138.878 145.929 1.00 0.00 H TER 72489 WAT 702 ATOM 72489 O WAT 703 122.968 128.726 117.275 1.00 0.00 O ATOM 72490 H1 WAT 703 123.075 128.840 116.331 1.00 0.00 H ATOM 72491 H2 WAT 703 122.504 127.894 117.365 1.00 0.00 H TER 72493 WAT 703 ATOM 72493 O WAT 704 55.422 64.787 140.350 1.00 0.00 O ATOM 72494 H1 WAT 704 56.018 64.694 139.608 1.00 0.00 H ATOM 72495 H2 WAT 704 55.440 65.721 140.557 1.00 0.00 H TER 72497 WAT 704 ATOM 72497 O WAT 705 65.526 123.004 9.584 1.00 0.00 O ATOM 72498 H1 WAT 705 64.921 123.668 9.253 1.00 0.00 H ATOM 72499 H2 WAT 705 65.163 122.174 9.276 1.00 0.00 H TER 72501 WAT 705 ATOM 72501 O WAT 706 62.840 50.943 12.616 1.00 0.00 O ATOM 72502 H1 WAT 706 62.864 51.849 12.309 1.00 0.00 H ATOM 72503 H2 WAT 706 62.458 50.453 11.888 1.00 0.00 H TER 72505 WAT 706 ATOM 72505 O WAT 707 21.530 52.125 126.257 1.00 0.00 O ATOM 72506 H1 WAT 707 21.492 51.174 126.159 1.00 0.00 H ATOM 72507 H2 WAT 707 21.663 52.452 125.368 1.00 0.00 H TER 72509 WAT 707 ATOM 72509 O WAT 708 14.350 30.731 113.926 1.00 0.00 O ATOM 72510 H1 WAT 708 15.286 30.633 114.100 1.00 0.00 H ATOM 72511 H2 WAT 708 14.292 31.497 113.355 1.00 0.00 H TER 72513 WAT 708 ATOM 72513 O WAT 709 37.408 92.364 18.237 1.00 0.00 O ATOM 72514 H1 WAT 709 37.904 92.341 19.056 1.00 0.00 H ATOM 72515 H2 WAT 709 37.596 91.523 17.820 1.00 0.00 H TER 72517 WAT 709 ATOM 72517 O WAT 710 100.509 138.027 63.364 1.00 0.00 O ATOM 72518 H1 WAT 710 100.331 137.179 63.772 1.00 0.00 H ATOM 72519 H2 WAT 710 99.820 138.602 63.697 1.00 0.00 H TER 72521 WAT 710 ATOM 72521 O WAT 711 58.128 113.556 5.086 1.00 0.00 O ATOM 72522 H1 WAT 711 57.965 112.665 5.397 1.00 0.00 H ATOM 72523 H2 WAT 711 57.854 113.545 4.170 1.00 0.00 H TER 72525 WAT 711 ATOM 72525 O WAT 712 88.455 71.702 153.952 1.00 0.00 O ATOM 72526 H1 WAT 712 89.363 71.748 153.652 1.00 0.00 H ATOM 72527 H2 WAT 712 87.966 72.225 153.317 1.00 0.00 H TER 72529 WAT 712 ATOM 72529 O WAT 713 47.650 6.061 92.183 1.00 0.00 O ATOM 72530 H1 WAT 713 47.436 5.135 92.069 1.00 0.00 H ATOM 72531 H2 WAT 713 48.365 6.220 91.566 1.00 0.00 H TER 72533 WAT 713 ATOM 72533 O WAT 714 71.028 56.115 76.998 1.00 0.00 O ATOM 72534 H1 WAT 714 70.670 56.621 77.728 1.00 0.00 H ATOM 72535 H2 WAT 714 70.454 56.321 76.260 1.00 0.00 H TER 72537 WAT 714 ATOM 72537 O WAT 715 13.225 111.766 68.602 1.00 0.00 O ATOM 72538 H1 WAT 715 14.146 111.517 68.529 1.00 0.00 H ATOM 72539 H2 WAT 715 12.815 111.402 67.818 1.00 0.00 H TER 72541 WAT 715 ATOM 72541 O WAT 716 57.500 107.171 5.951 1.00 0.00 O ATOM 72542 H1 WAT 716 58.429 107.098 6.170 1.00 0.00 H ATOM 72543 H2 WAT 716 57.099 107.551 6.733 1.00 0.00 H TER 72545 WAT 716 ATOM 72545 O WAT 717 34.575 108.642 78.378 1.00 0.00 O ATOM 72546 H1 WAT 717 33.827 109.142 78.053 1.00 0.00 H ATOM 72547 H2 WAT 717 34.696 108.950 79.276 1.00 0.00 H TER 72549 WAT 717 ATOM 72549 O WAT 718 84.889 2.538 75.528 1.00 0.00 O ATOM 72550 H1 WAT 718 84.509 2.270 74.692 1.00 0.00 H ATOM 72551 H2 WAT 718 84.361 3.288 75.801 1.00 0.00 H TER 72553 WAT 718 ATOM 72553 O WAT 719 63.262 98.153 16.933 1.00 0.00 O ATOM 72554 H1 WAT 719 63.532 97.510 17.590 1.00 0.00 H ATOM 72555 H2 WAT 719 63.236 98.984 17.408 1.00 0.00 H TER 72557 WAT 719 ATOM 72557 O WAT 720 97.676 66.313 6.793 1.00 0.00 O ATOM 72558 H1 WAT 720 98.588 66.597 6.843 1.00 0.00 H ATOM 72559 H2 WAT 720 97.277 66.898 6.149 1.00 0.00 H TER 72561 WAT 720 ATOM 72561 O WAT 721 14.287 124.592 99.452 1.00 0.00 O ATOM 72562 H1 WAT 721 14.419 123.762 98.993 1.00 0.00 H ATOM 72563 H2 WAT 721 13.453 124.920 99.118 1.00 0.00 H TER 72565 WAT 721 ATOM 72565 O WAT 722 43.668 75.959 77.195 1.00 0.00 O ATOM 72566 H1 WAT 722 42.962 76.147 77.813 1.00 0.00 H ATOM 72567 H2 WAT 722 43.963 75.079 77.428 1.00 0.00 H TER 72569 WAT 722 ATOM 72569 O WAT 723 20.082 3.184 13.643 1.00 0.00 O ATOM 72570 H1 WAT 723 19.501 2.427 13.710 1.00 0.00 H ATOM 72571 H2 WAT 723 19.736 3.686 12.905 1.00 0.00 H TER 72573 WAT 723 ATOM 72573 O WAT 724 99.450 82.153 129.579 1.00 0.00 O ATOM 72574 H1 WAT 724 99.980 81.601 129.004 1.00 0.00 H ATOM 72575 H2 WAT 724 99.367 81.646 130.387 1.00 0.00 H TER 72577 WAT 724 ATOM 72577 O WAT 725 110.400 52.891 93.408 1.00 0.00 O ATOM 72578 H1 WAT 725 110.944 52.958 94.193 1.00 0.00 H ATOM 72579 H2 WAT 725 110.115 53.788 93.237 1.00 0.00 H TER 72581 WAT 725 ATOM 72581 O WAT 726 145.233 52.558 125.168 1.00 0.00 O ATOM 72582 H1 WAT 726 145.822 52.159 124.528 1.00 0.00 H ATOM 72583 H2 WAT 726 145.549 53.458 125.256 1.00 0.00 H TER 72585 WAT 726 ATOM 72585 O WAT 727 117.934 124.781 101.515 1.00 0.00 O ATOM 72586 H1 WAT 727 117.724 124.019 100.976 1.00 0.00 H ATOM 72587 H2 WAT 727 118.848 124.651 101.768 1.00 0.00 H TER 72589 WAT 727 ATOM 72589 O WAT 728 135.495 80.830 85.071 1.00 0.00 O ATOM 72590 H1 WAT 728 136.312 80.336 85.010 1.00 0.00 H ATOM 72591 H2 WAT 728 135.460 81.337 84.259 1.00 0.00 H TER 72593 WAT 728 ATOM 72593 O WAT 729 132.785 83.142 150.899 1.00 0.00 O ATOM 72594 H1 WAT 729 132.245 83.563 150.230 1.00 0.00 H ATOM 72595 H2 WAT 729 133.484 83.773 151.074 1.00 0.00 H TER 72597 WAT 729 ATOM 72597 O WAT 730 44.168 111.896 117.548 1.00 0.00 O ATOM 72598 H1 WAT 730 43.446 111.850 118.175 1.00 0.00 H ATOM 72599 H2 WAT 730 44.919 112.182 118.069 1.00 0.00 H TER 72601 WAT 730 ATOM 72601 O WAT 731 12.780 103.918 7.696 1.00 0.00 O ATOM 72602 H1 WAT 731 13.067 104.820 7.835 1.00 0.00 H ATOM 72603 H2 WAT 731 11.971 103.843 8.202 1.00 0.00 H TER 72605 WAT 731 ATOM 72605 O WAT 732 30.560 87.429 138.059 1.00 0.00 O ATOM 72606 H1 WAT 732 31.259 87.960 137.675 1.00 0.00 H ATOM 72607 H2 WAT 732 30.983 86.961 138.779 1.00 0.00 H TER 72609 WAT 732 ATOM 72609 O WAT 733 30.864 49.009 70.730 1.00 0.00 O ATOM 72610 H1 WAT 733 31.662 49.268 70.269 1.00 0.00 H ATOM 72611 H2 WAT 733 30.917 48.054 70.783 1.00 0.00 H TER 72613 WAT 733 ATOM 72613 O WAT 734 2.778 135.254 137.145 1.00 0.00 O ATOM 72614 H1 WAT 734 3.261 134.625 137.682 1.00 0.00 H ATOM 72615 H2 WAT 734 2.234 135.734 137.769 1.00 0.00 H TER 72617 WAT 734 ATOM 72617 O WAT 735 99.660 110.861 91.729 1.00 0.00 O ATOM 72618 H1 WAT 735 100.127 111.551 92.201 1.00 0.00 H ATOM 72619 H2 WAT 735 99.476 110.198 92.395 1.00 0.00 H TER 72621 WAT 735 ATOM 72621 O WAT 736 142.202 49.918 13.345 1.00 0.00 O ATOM 72622 H1 WAT 736 142.031 49.329 12.610 1.00 0.00 H ATOM 72623 H2 WAT 736 141.715 50.714 13.133 1.00 0.00 H TER 72625 WAT 736 ATOM 72625 O WAT 737 102.915 83.929 75.242 1.00 0.00 O ATOM 72626 H1 WAT 737 103.653 84.006 75.846 1.00 0.00 H ATOM 72627 H2 WAT 737 102.578 84.821 75.159 1.00 0.00 H TER 72629 WAT 737 ATOM 72629 O WAT 738 18.490 40.203 116.361 1.00 0.00 O ATOM 72630 H1 WAT 738 17.889 39.466 116.474 1.00 0.00 H ATOM 72631 H2 WAT 738 17.983 40.968 116.632 1.00 0.00 H TER 72633 WAT 738 ATOM 72633 O WAT 739 23.429 34.614 142.989 1.00 0.00 O ATOM 72634 H1 WAT 739 22.968 33.789 142.838 1.00 0.00 H ATOM 72635 H2 WAT 739 22.976 35.010 143.734 1.00 0.00 H TER 72637 WAT 739 ATOM 72637 O WAT 740 140.587 102.576 83.852 1.00 0.00 O ATOM 72638 H1 WAT 740 141.447 102.992 83.791 1.00 0.00 H ATOM 72639 H2 WAT 740 140.759 101.647 83.698 1.00 0.00 H TER 72641 WAT 740 ATOM 72641 O WAT 741 89.554 56.144 20.892 1.00 0.00 O ATOM 72642 H1 WAT 741 89.849 55.484 21.520 1.00 0.00 H ATOM 72643 H2 WAT 741 89.408 55.656 20.082 1.00 0.00 H TER 72645 WAT 741 ATOM 72645 O WAT 742 73.856 23.065 84.975 1.00 0.00 O ATOM 72646 H1 WAT 742 74.075 23.098 85.906 1.00 0.00 H ATOM 72647 H2 WAT 742 74.148 23.909 84.630 1.00 0.00 H TER 72649 WAT 742 ATOM 72649 O WAT 743 142.116 100.155 64.668 1.00 0.00 O ATOM 72650 H1 WAT 743 141.812 99.574 63.970 1.00 0.00 H ATOM 72651 H2 WAT 743 141.494 100.883 64.661 1.00 0.00 H TER 72653 WAT 743 ATOM 72653 O WAT 744 70.513 93.919 11.277 1.00 0.00 O ATOM 72654 H1 WAT 744 70.812 94.012 12.182 1.00 0.00 H ATOM 72655 H2 WAT 744 71.319 93.892 10.761 1.00 0.00 H TER 72657 WAT 744 ATOM 72657 O WAT 745 3.317 132.582 110.150 1.00 0.00 O ATOM 72658 H1 WAT 745 2.608 133.110 109.781 1.00 0.00 H ATOM 72659 H2 WAT 745 3.283 132.760 111.090 1.00 0.00 H TER 72661 WAT 745 ATOM 72661 O WAT 746 11.876 99.197 90.341 1.00 0.00 O ATOM 72662 H1 WAT 746 12.612 98.837 90.836 1.00 0.00 H ATOM 72663 H2 WAT 746 11.482 99.840 90.931 1.00 0.00 H TER 72665 WAT 746 ATOM 72665 O WAT 747 1.366 56.453 85.619 1.00 0.00 O ATOM 72666 H1 WAT 747 1.270 57.327 85.240 1.00 0.00 H ATOM 72667 H2 WAT 747 2.024 56.026 85.070 1.00 0.00 H TER 72669 WAT 747 ATOM 72669 O WAT 748 116.038 26.652 116.416 1.00 0.00 O ATOM 72670 H1 WAT 748 115.128 26.825 116.176 1.00 0.00 H ATOM 72671 H2 WAT 748 116.006 25.827 116.900 1.00 0.00 H TER 72673 WAT 748 ATOM 72673 O WAT 749 92.410 121.284 11.515 1.00 0.00 O ATOM 72674 H1 WAT 749 92.204 121.049 10.610 1.00 0.00 H ATOM 72675 H2 WAT 749 93.096 121.948 11.439 1.00 0.00 H TER 72677 WAT 749 ATOM 72677 O WAT 750 63.328 19.645 81.706 1.00 0.00 O ATOM 72678 H1 WAT 750 64.167 19.585 81.249 1.00 0.00 H ATOM 72679 H2 WAT 750 62.703 19.900 81.028 1.00 0.00 H TER 72681 WAT 750 ATOM 72681 O WAT 751 117.573 115.420 135.351 1.00 0.00 O ATOM 72682 H1 WAT 751 116.740 115.498 135.816 1.00 0.00 H ATOM 72683 H2 WAT 751 117.326 115.187 134.456 1.00 0.00 H TER 72685 WAT 751 ATOM 72685 O WAT 752 80.966 53.454 75.975 1.00 0.00 O ATOM 72686 H1 WAT 752 80.614 52.608 75.698 1.00 0.00 H ATOM 72687 H2 WAT 752 81.807 53.523 75.524 1.00 0.00 H TER 72689 WAT 752 ATOM 72689 O WAT 753 66.990 29.773 110.634 1.00 0.00 O ATOM 72690 H1 WAT 753 67.036 29.432 111.528 1.00 0.00 H ATOM 72691 H2 WAT 753 66.847 28.999 110.090 1.00 0.00 H TER 72693 WAT 753 ATOM 72693 O WAT 754 77.638 102.688 113.716 1.00 0.00 O ATOM 72694 H1 WAT 754 76.754 102.870 114.034 1.00 0.00 H ATOM 72695 H2 WAT 754 78.180 102.681 114.504 1.00 0.00 H TER 72697 WAT 754 ATOM 72697 O WAT 755 76.350 56.811 149.134 1.00 0.00 O ATOM 72698 H1 WAT 755 75.482 56.601 148.789 1.00 0.00 H ATOM 72699 H2 WAT 755 76.534 56.112 149.761 1.00 0.00 H TER 72701 WAT 755 ATOM 72701 O WAT 756 91.829 33.892 9.142 1.00 0.00 O ATOM 72702 H1 WAT 756 91.811 33.780 8.191 1.00 0.00 H ATOM 72703 H2 WAT 756 90.999 33.521 9.441 1.00 0.00 H TER 72705 WAT 756 ATOM 72705 O WAT 757 136.521 91.213 17.303 1.00 0.00 O ATOM 72706 H1 WAT 757 136.508 90.255 17.307 1.00 0.00 H ATOM 72707 H2 WAT 757 137.446 91.440 17.207 1.00 0.00 H TER 72709 WAT 757 ATOM 72709 O WAT 758 132.176 36.972 100.212 1.00 0.00 O ATOM 72710 H1 WAT 758 131.888 37.871 100.054 1.00 0.00 H ATOM 72711 H2 WAT 758 132.891 37.057 100.842 1.00 0.00 H TER 72713 WAT 758 ATOM 72713 O WAT 759 62.368 102.418 146.354 1.00 0.00 O ATOM 72714 H1 WAT 759 61.968 102.029 145.576 1.00 0.00 H ATOM 72715 H2 WAT 759 63.286 102.543 146.114 1.00 0.00 H TER 72717 WAT 759 ATOM 72717 O WAT 760 120.643 83.255 2.201 1.00 0.00 O ATOM 72718 H1 WAT 760 120.827 83.931 2.854 1.00 0.00 H ATOM 72719 H2 WAT 760 120.373 82.493 2.714 1.00 0.00 H TER 72721 WAT 760 ATOM 72721 O WAT 761 4.331 4.225 20.066 1.00 0.00 O ATOM 72722 H1 WAT 761 3.604 4.831 20.208 1.00 0.00 H ATOM 72723 H2 WAT 761 4.983 4.477 20.719 1.00 0.00 H TER 72725 WAT 761 ATOM 72725 O WAT 762 19.526 133.530 137.799 1.00 0.00 O ATOM 72726 H1 WAT 762 19.277 132.774 137.268 1.00 0.00 H ATOM 72727 H2 WAT 762 20.357 133.823 137.424 1.00 0.00 H TER 72729 WAT 762 ATOM 72729 O WAT 763 58.499 57.426 86.877 1.00 0.00 O ATOM 72730 H1 WAT 763 57.966 58.217 86.960 1.00 0.00 H ATOM 72731 H2 WAT 763 59.195 57.670 86.267 1.00 0.00 H TER 72733 WAT 763 ATOM 72733 O WAT 764 28.480 56.801 114.945 1.00 0.00 O ATOM 72734 H1 WAT 764 29.361 56.895 114.583 1.00 0.00 H ATOM 72735 H2 WAT 764 28.486 57.345 115.733 1.00 0.00 H TER 72737 WAT 764 ATOM 72737 O WAT 765 106.412 73.139 95.625 1.00 0.00 O ATOM 72738 H1 WAT 765 105.844 73.905 95.705 1.00 0.00 H ATOM 72739 H2 WAT 765 106.895 73.111 96.451 1.00 0.00 H TER 72741 WAT 765 ATOM 72741 O WAT 766 144.416 127.969 140.438 1.00 0.00 O ATOM 72742 H1 WAT 766 143.515 127.942 140.114 1.00 0.00 H ATOM 72743 H2 WAT 766 144.955 127.880 139.652 1.00 0.00 H TER 72745 WAT 766 ATOM 72745 O WAT 767 25.425 79.922 70.255 1.00 0.00 O ATOM 72746 H1 WAT 767 25.142 79.976 69.342 1.00 0.00 H ATOM 72747 H2 WAT 767 24.698 79.493 70.707 1.00 0.00 H TER 72749 WAT 767 ATOM 72749 O WAT 768 4.871 123.456 129.837 1.00 0.00 O ATOM 72750 H1 WAT 768 4.196 123.999 130.246 1.00 0.00 H ATOM 72751 H2 WAT 768 5.683 123.944 129.971 1.00 0.00 H TER 72753 WAT 768 ATOM 72753 O WAT 769 90.094 93.341 113.004 1.00 0.00 O ATOM 72754 H1 WAT 769 90.110 94.121 112.450 1.00 0.00 H ATOM 72755 H2 WAT 769 90.472 92.651 112.459 1.00 0.00 H TER 72757 WAT 769 ATOM 72757 O WAT 770 90.838 99.796 145.337 1.00 0.00 O ATOM 72758 H1 WAT 770 90.055 99.398 145.718 1.00 0.00 H ATOM 72759 H2 WAT 770 91.200 99.116 144.769 1.00 0.00 H TER 72761 WAT 770 ATOM 72761 O WAT 771 126.420 105.956 138.977 1.00 0.00 O ATOM 72762 H1 WAT 771 126.063 106.071 139.857 1.00 0.00 H ATOM 72763 H2 WAT 771 125.803 106.415 138.407 1.00 0.00 H TER 72765 WAT 771 ATOM 72765 O WAT 772 57.863 69.957 105.989 1.00 0.00 O ATOM 72766 H1 WAT 772 58.610 69.360 105.974 1.00 0.00 H ATOM 72767 H2 WAT 772 57.394 69.734 106.794 1.00 0.00 H TER 72769 WAT 772 ATOM 72769 O WAT 773 103.969 19.325 9.181 1.00 0.00 O ATOM 72770 H1 WAT 773 103.503 19.845 9.836 1.00 0.00 H ATOM 72771 H2 WAT 773 103.622 18.439 9.288 1.00 0.00 H TER 72773 WAT 773 ATOM 72773 O WAT 774 25.660 75.730 12.084 1.00 0.00 O ATOM 72774 H1 WAT 774 26.412 75.995 11.554 1.00 0.00 H ATOM 72775 H2 WAT 774 26.011 75.077 12.689 1.00 0.00 H TER 72777 WAT 774 ATOM 72777 O WAT 775 141.087 59.625 144.498 1.00 0.00 O ATOM 72778 H1 WAT 775 140.520 60.392 144.413 1.00 0.00 H ATOM 72779 H2 WAT 775 141.819 59.926 145.037 1.00 0.00 H TER 72781 WAT 775 ATOM 72781 O WAT 776 39.382 31.066 68.087 1.00 0.00 O ATOM 72782 H1 WAT 776 38.487 31.371 68.240 1.00 0.00 H ATOM 72783 H2 WAT 776 39.623 31.449 67.243 1.00 0.00 H TER 72785 WAT 776 ATOM 72785 O WAT 777 94.726 40.765 67.137 1.00 0.00 O ATOM 72786 H1 WAT 777 94.067 41.350 66.764 1.00 0.00 H ATOM 72787 H2 WAT 777 95.459 40.807 66.522 1.00 0.00 H TER 72789 WAT 777 ATOM 72789 O WAT 778 24.352 137.487 114.541 1.00 0.00 O ATOM 72790 H1 WAT 778 25.245 137.145 114.587 1.00 0.00 H ATOM 72791 H2 WAT 778 23.837 136.765 114.182 1.00 0.00 H TER 72793 WAT 778 ATOM 72793 O WAT 779 26.910 62.915 118.077 1.00 0.00 O ATOM 72794 H1 WAT 779 27.664 63.130 117.528 1.00 0.00 H ATOM 72795 H2 WAT 779 26.528 63.763 118.303 1.00 0.00 H TER 72797 WAT 779 ATOM 72797 O WAT 780 110.982 134.226 150.495 1.00 0.00 O ATOM 72798 H1 WAT 780 110.088 134.232 150.156 1.00 0.00 H ATOM 72799 H2 WAT 780 111.370 133.428 150.134 1.00 0.00 H TER 72801 WAT 780 ATOM 72801 O WAT 781 114.257 127.062 117.460 1.00 0.00 O ATOM 72802 H1 WAT 781 114.046 126.860 116.549 1.00 0.00 H ATOM 72803 H2 WAT 781 113.599 127.706 117.722 1.00 0.00 H TER 72805 WAT 781 ATOM 72805 O WAT 782 77.620 26.394 84.148 1.00 0.00 O ATOM 72806 H1 WAT 782 77.230 26.692 83.327 1.00 0.00 H ATOM 72807 H2 WAT 782 77.927 27.195 84.573 1.00 0.00 H TER 72809 WAT 782 ATOM 72809 O WAT 783 124.875 56.527 137.746 1.00 0.00 O ATOM 72810 H1 WAT 783 123.970 56.226 137.836 1.00 0.00 H ATOM 72811 H2 WAT 783 125.089 56.901 138.600 1.00 0.00 H TER 72813 WAT 783 ATOM 72813 O WAT 784 87.052 24.434 108.131 1.00 0.00 O ATOM 72814 H1 WAT 784 86.806 23.612 107.708 1.00 0.00 H ATOM 72815 H2 WAT 784 87.215 24.194 109.043 1.00 0.00 H TER 72817 WAT 784 ATOM 72817 O WAT 785 115.577 106.777 26.655 1.00 0.00 O ATOM 72818 H1 WAT 785 114.901 107.425 26.459 1.00 0.00 H ATOM 72819 H2 WAT 785 115.093 106.013 26.970 1.00 0.00 H TER 72821 WAT 785 ATOM 72821 O WAT 786 29.582 37.507 69.627 1.00 0.00 O ATOM 72822 H1 WAT 786 30.285 38.023 69.233 1.00 0.00 H ATOM 72823 H2 WAT 786 29.259 36.956 68.914 1.00 0.00 H TER 72825 WAT 786 ATOM 72825 O WAT 787 34.396 100.603 73.090 1.00 0.00 O ATOM 72826 H1 WAT 787 33.938 100.967 72.333 1.00 0.00 H ATOM 72827 H2 WAT 787 34.386 99.657 72.944 1.00 0.00 H TER 72829 WAT 787 ATOM 72829 O WAT 788 88.523 117.734 90.779 1.00 0.00 O ATOM 72830 H1 WAT 788 89.167 117.340 91.367 1.00 0.00 H ATOM 72831 H2 WAT 788 89.036 118.311 90.213 1.00 0.00 H TER 72833 WAT 788 ATOM 72833 O WAT 789 32.204 100.524 64.505 1.00 0.00 O ATOM 72834 H1 WAT 789 32.484 100.671 63.602 1.00 0.00 H ATOM 72835 H2 WAT 789 32.452 101.326 64.966 1.00 0.00 H TER 72837 WAT 789 ATOM 72837 O WAT 790 134.083 26.871 150.415 1.00 0.00 O ATOM 72838 H1 WAT 790 134.662 26.274 150.889 1.00 0.00 H ATOM 72839 H2 WAT 790 133.807 27.509 151.074 1.00 0.00 H TER 72841 WAT 790 ATOM 72841 O WAT 791 59.264 43.687 104.706 1.00 0.00 O ATOM 72842 H1 WAT 791 58.416 43.353 104.999 1.00 0.00 H ATOM 72843 H2 WAT 791 59.523 44.310 105.385 1.00 0.00 H TER 72845 WAT 791 ATOM 72845 O WAT 792 29.557 2.129 157.211 1.00 0.00 O ATOM 72846 H1 WAT 792 28.642 1.867 157.307 1.00 0.00 H ATOM 72847 H2 WAT 792 29.563 2.706 156.447 1.00 0.00 H TER 72849 WAT 792 ATOM 72849 O WAT 793 62.032 33.600 102.806 1.00 0.00 O ATOM 72850 H1 WAT 793 62.781 33.011 102.714 1.00 0.00 H ATOM 72851 H2 WAT 793 61.276 33.067 102.559 1.00 0.00 H TER 72853 WAT 793 ATOM 72853 O WAT 794 145.602 110.922 129.740 1.00 0.00 O ATOM 72854 H1 WAT 794 146.003 110.166 129.312 1.00 0.00 H ATOM 72855 H2 WAT 794 144.858 110.559 130.220 1.00 0.00 H TER 72857 WAT 794 ATOM 72857 O WAT 795 57.829 90.000 140.252 1.00 0.00 O ATOM 72858 H1 WAT 795 57.433 89.604 139.477 1.00 0.00 H ATOM 72859 H2 WAT 795 58.001 89.262 140.837 1.00 0.00 H TER 72861 WAT 795 ATOM 72861 O WAT 796 59.834 106.970 19.807 1.00 0.00 O ATOM 72862 H1 WAT 796 59.467 107.214 18.957 1.00 0.00 H ATOM 72863 H2 WAT 796 59.670 106.030 19.877 1.00 0.00 H TER 72865 WAT 796 ATOM 72865 O WAT 797 83.293 41.464 85.122 1.00 0.00 O ATOM 72866 H1 WAT 797 82.466 41.009 84.962 1.00 0.00 H ATOM 72867 H2 WAT 797 83.959 40.891 84.742 1.00 0.00 H TER 72869 WAT 797 ATOM 72869 O WAT 798 57.765 105.802 118.767 1.00 0.00 O ATOM 72870 H1 WAT 798 57.135 105.444 119.393 1.00 0.00 H ATOM 72871 H2 WAT 798 57.520 105.410 117.929 1.00 0.00 H TER 72873 WAT 798 ATOM 72873 O WAT 799 16.045 79.958 87.538 1.00 0.00 O ATOM 72874 H1 WAT 799 15.204 79.819 87.102 1.00 0.00 H ATOM 72875 H2 WAT 799 15.873 79.759 88.459 1.00 0.00 H TER 72877 WAT 799 ATOM 72877 O WAT 800 82.609 130.939 103.323 1.00 0.00 O ATOM 72878 H1 WAT 800 82.192 130.950 104.184 1.00 0.00 H ATOM 72879 H2 WAT 800 82.344 131.765 102.918 1.00 0.00 H TER 72881 WAT 800 ATOM 72881 O WAT 801 129.680 75.383 111.348 1.00 0.00 O ATOM 72882 H1 WAT 801 128.831 75.738 111.614 1.00 0.00 H ATOM 72883 H2 WAT 801 130.312 76.053 111.610 1.00 0.00 H TER 72885 WAT 801 ATOM 72885 O WAT 802 84.544 31.188 127.808 1.00 0.00 O ATOM 72886 H1 WAT 802 83.968 30.539 127.404 1.00 0.00 H ATOM 72887 H2 WAT 802 85.426 30.921 127.547 1.00 0.00 H TER 72889 WAT 802 ATOM 72889 O WAT 803 21.373 40.625 111.684 1.00 0.00 O ATOM 72890 H1 WAT 803 21.114 41.198 110.962 1.00 0.00 H ATOM 72891 H2 WAT 803 22.034 40.046 111.305 1.00 0.00 H TER 72893 WAT 803 ATOM 72893 O WAT 804 66.607 6.010 13.182 1.00 0.00 O ATOM 72894 H1 WAT 804 67.201 5.351 13.541 1.00 0.00 H ATOM 72895 H2 WAT 804 66.727 6.773 13.748 1.00 0.00 H TER 72897 WAT 804 ATOM 72897 O WAT 805 95.718 52.042 95.872 1.00 0.00 O ATOM 72898 H1 WAT 805 96.514 51.895 95.361 1.00 0.00 H ATOM 72899 H2 WAT 805 96.030 52.171 96.768 1.00 0.00 H TER 72901 WAT 805 ATOM 72901 O WAT 806 130.203 80.135 147.850 1.00 0.00 O ATOM 72902 H1 WAT 806 129.450 79.767 147.388 1.00 0.00 H ATOM 72903 H2 WAT 806 130.167 81.072 147.658 1.00 0.00 H TER 72905 WAT 806 ATOM 72905 O WAT 807 68.735 57.702 9.875 1.00 0.00 O ATOM 72906 H1 WAT 807 69.323 58.325 10.302 1.00 0.00 H ATOM 72907 H2 WAT 807 68.003 58.237 9.566 1.00 0.00 H TER 72909 WAT 807 ATOM 72909 O WAT 808 71.384 38.309 99.495 1.00 0.00 O ATOM 72910 H1 WAT 808 70.751 39.026 99.443 1.00 0.00 H ATOM 72911 H2 WAT 808 72.238 38.740 99.450 1.00 0.00 H TER 72913 WAT 808 ATOM 72913 O WAT 809 73.530 116.270 125.383 1.00 0.00 O ATOM 72914 H1 WAT 809 74.141 116.991 125.534 1.00 0.00 H ATOM 72915 H2 WAT 809 72.795 116.453 125.968 1.00 0.00 H TER 72917 WAT 809 ATOM 72917 O WAT 810 16.722 84.639 116.508 1.00 0.00 O ATOM 72918 H1 WAT 810 16.643 83.909 115.893 1.00 0.00 H ATOM 72919 H2 WAT 810 15.936 84.581 117.050 1.00 0.00 H TER 72921 WAT 810 ATOM 72921 O WAT 811 23.676 100.565 151.093 1.00 0.00 O ATOM 72922 H1 WAT 811 23.203 100.781 151.896 1.00 0.00 H ATOM 72923 H2 WAT 811 24.394 101.198 151.061 1.00 0.00 H TER 72925 WAT 811 ATOM 72925 O WAT 812 11.065 128.185 137.962 1.00 0.00 O ATOM 72926 H1 WAT 812 10.613 127.612 138.581 1.00 0.00 H ATOM 72927 H2 WAT 812 11.820 128.515 138.449 1.00 0.00 H TER 72929 WAT 812 ATOM 72929 O WAT 813 65.271 58.551 75.226 1.00 0.00 O ATOM 72930 H1 WAT 813 64.570 58.017 75.601 1.00 0.00 H ATOM 72931 H2 WAT 813 66.063 58.256 75.674 1.00 0.00 H TER 72933 WAT 813 ATOM 72933 O WAT 814 47.557 24.594 4.838 1.00 0.00 O ATOM 72934 H1 WAT 814 47.184 25.474 4.779 1.00 0.00 H ATOM 72935 H2 WAT 814 48.032 24.591 5.669 1.00 0.00 H TER 72937 WAT 814 ATOM 72937 O WAT 815 121.542 69.941 120.959 1.00 0.00 O ATOM 72938 H1 WAT 815 121.677 69.020 121.184 1.00 0.00 H ATOM 72939 H2 WAT 815 121.097 70.311 121.721 1.00 0.00 H TER 72941 WAT 815 ATOM 72941 O WAT 816 80.798 12.480 101.023 1.00 0.00 O ATOM 72942 H1 WAT 816 80.516 11.659 101.427 1.00 0.00 H ATOM 72943 H2 WAT 816 80.018 12.805 100.572 1.00 0.00 H TER 72945 WAT 816 ATOM 72945 O WAT 817 72.968 139.944 153.821 1.00 0.00 O ATOM 72946 H1 WAT 817 73.401 140.567 153.238 1.00 0.00 H ATOM 72947 H2 WAT 817 72.627 139.267 153.237 1.00 0.00 H TER 72949 WAT 817 ATOM 72949 O WAT 818 9.063 65.495 61.537 1.00 0.00 O ATOM 72950 H1 WAT 818 8.814 65.284 60.637 1.00 0.00 H ATOM 72951 H2 WAT 818 9.734 66.172 61.447 1.00 0.00 H TER 72953 WAT 818 ATOM 72953 O WAT 819 73.388 78.532 67.568 1.00 0.00 O ATOM 72954 H1 WAT 819 72.507 78.473 67.938 1.00 0.00 H ATOM 72955 H2 WAT 819 73.970 78.377 68.312 1.00 0.00 H TER 72957 WAT 819 ATOM 72957 O WAT 820 80.328 123.819 118.413 1.00 0.00 O ATOM 72958 H1 WAT 820 81.041 123.586 119.009 1.00 0.00 H ATOM 72959 H2 WAT 820 80.645 123.560 117.548 1.00 0.00 H TER 72961 WAT 820 ATOM 72961 O WAT 821 65.768 139.760 114.582 1.00 0.00 O ATOM 72962 H1 WAT 821 64.952 140.177 114.859 1.00 0.00 H ATOM 72963 H2 WAT 821 66.384 140.485 114.478 1.00 0.00 H TER 72965 WAT 821 ATOM 72965 O WAT 822 26.918 120.433 7.821 1.00 0.00 O ATOM 72966 H1 WAT 822 27.307 121.056 7.207 1.00 0.00 H ATOM 72967 H2 WAT 822 26.775 120.941 8.619 1.00 0.00 H TER 72969 WAT 822 ATOM 72969 O WAT 823 128.792 104.313 142.623 1.00 0.00 O ATOM 72970 H1 WAT 823 128.257 104.993 143.032 1.00 0.00 H ATOM 72971 H2 WAT 823 129.694 104.568 142.817 1.00 0.00 H TER 72973 WAT 823 ATOM 72973 O WAT 824 53.431 146.096 109.679 1.00 0.00 O ATOM 72974 H1 WAT 824 52.862 145.512 109.179 1.00 0.00 H ATOM 72975 H2 WAT 824 54.090 145.518 110.063 1.00 0.00 H TER 72977 WAT 824 ATOM 72977 O WAT 825 133.620 100.272 112.144 1.00 0.00 O ATOM 72978 H1 WAT 825 134.117 100.834 112.739 1.00 0.00 H ATOM 72979 H2 WAT 825 132.756 100.683 112.094 1.00 0.00 H TER 72981 WAT 825 ATOM 72981 O WAT 826 137.233 131.228 139.841 1.00 0.00 O ATOM 72982 H1 WAT 826 136.303 131.021 139.931 1.00 0.00 H ATOM 72983 H2 WAT 826 137.277 131.815 139.086 1.00 0.00 H TER 72985 WAT 826 ATOM 72985 O WAT 827 137.266 114.786 17.584 1.00 0.00 O ATOM 72986 H1 WAT 827 137.649 114.314 16.844 1.00 0.00 H ATOM 72987 H2 WAT 827 137.998 114.919 18.187 1.00 0.00 H TER 72989 WAT 827 ATOM 72989 O WAT 828 22.713 80.969 19.632 1.00 0.00 O ATOM 72990 H1 WAT 828 22.321 81.794 19.919 1.00 0.00 H ATOM 72991 H2 WAT 828 22.481 80.903 18.705 1.00 0.00 H TER 72993 WAT 828 ATOM 72993 O WAT 829 78.154 94.277 17.042 1.00 0.00 O ATOM 72994 H1 WAT 829 77.765 93.755 16.340 1.00 0.00 H ATOM 72995 H2 WAT 829 77.538 94.998 17.173 1.00 0.00 H TER 72997 WAT 829 ATOM 72997 O WAT 830 71.468 102.758 69.129 1.00 0.00 O ATOM 72998 H1 WAT 830 71.232 101.855 69.344 1.00 0.00 H ATOM 72999 H2 WAT 830 71.977 103.058 69.882 1.00 0.00 H TER 73001 WAT 830 ATOM 73001 O WAT 831 38.668 142.614 132.734 1.00 0.00 O ATOM 73002 H1 WAT 831 38.412 143.478 132.413 1.00 0.00 H ATOM 73003 H2 WAT 831 39.282 142.796 133.446 1.00 0.00 H TER 73005 WAT 831 ATOM 73005 O WAT 832 121.139 26.974 19.676 1.00 0.00 O ATOM 73006 H1 WAT 832 122.069 27.123 19.848 1.00 0.00 H ATOM 73007 H2 WAT 832 120.789 26.653 20.507 1.00 0.00 H TER 73009 WAT 832 ATOM 73009 O WAT 833 10.334 71.309 107.595 1.00 0.00 O ATOM 73010 H1 WAT 833 10.116 72.036 107.012 1.00 0.00 H ATOM 73011 H2 WAT 833 9.517 71.116 108.054 1.00 0.00 H TER 73013 WAT 833 ATOM 73013 O WAT 834 121.222 140.159 135.105 1.00 0.00 O ATOM 73014 H1 WAT 834 120.434 140.696 135.191 1.00 0.00 H ATOM 73015 H2 WAT 834 121.475 139.959 136.007 1.00 0.00 H TER 73017 WAT 834 ATOM 73017 O WAT 835 67.632 124.787 65.012 1.00 0.00 O ATOM 73018 H1 WAT 835 67.353 124.294 64.240 1.00 0.00 H ATOM 73019 H2 WAT 835 68.474 124.400 65.252 1.00 0.00 H TER 73021 WAT 835 ATOM 73021 O WAT 836 102.753 44.426 19.093 1.00 0.00 O ATOM 73022 H1 WAT 836 102.292 43.915 18.428 1.00 0.00 H ATOM 73023 H2 WAT 836 103.429 43.833 19.423 1.00 0.00 H TER 73025 WAT 836 ATOM 73025 O WAT 837 140.857 99.252 0.744 1.00 0.00 O ATOM 73026 H1 WAT 837 141.507 98.597 0.489 1.00 0.00 H ATOM 73027 H2 WAT 837 141.360 99.916 1.216 1.00 0.00 H TER 73029 WAT 837 ATOM 73029 O WAT 838 29.119 14.481 83.481 1.00 0.00 O ATOM 73030 H1 WAT 838 29.330 13.928 82.729 1.00 0.00 H ATOM 73031 H2 WAT 838 29.674 15.254 83.373 1.00 0.00 H TER 73033 WAT 838 ATOM 73033 O WAT 839 53.090 117.299 88.992 1.00 0.00 O ATOM 73034 H1 WAT 839 52.439 116.621 88.811 1.00 0.00 H ATOM 73035 H2 WAT 839 52.714 117.807 89.711 1.00 0.00 H TER 73037 WAT 839 ATOM 73037 O WAT 840 95.211 132.271 146.842 1.00 0.00 O ATOM 73038 H1 WAT 840 96.070 132.109 147.232 1.00 0.00 H ATOM 73039 H2 WAT 840 95.225 133.199 146.608 1.00 0.00 H TER 73041 WAT 840 ATOM 73041 O WAT 841 86.307 119.649 62.753 1.00 0.00 O ATOM 73042 H1 WAT 841 86.505 118.843 63.230 1.00 0.00 H ATOM 73043 H2 WAT 841 85.719 119.373 62.050 1.00 0.00 H TER 73045 WAT 841 ATOM 73045 O WAT 842 56.992 139.844 134.355 1.00 0.00 O ATOM 73046 H1 WAT 842 56.938 139.616 133.427 1.00 0.00 H ATOM 73047 H2 WAT 842 57.927 139.812 134.556 1.00 0.00 H TER 73049 WAT 842 ATOM 73049 O WAT 843 59.839 21.754 141.122 1.00 0.00 O ATOM 73050 H1 WAT 843 58.946 21.972 141.389 1.00 0.00 H ATOM 73051 H2 WAT 843 60.394 22.330 141.647 1.00 0.00 H TER 73053 WAT 843 ATOM 73053 O WAT 844 28.654 103.763 95.254 1.00 0.00 O ATOM 73054 H1 WAT 844 27.769 104.074 95.063 1.00 0.00 H ATOM 73055 H2 WAT 844 29.227 104.376 94.793 1.00 0.00 H TER 73057 WAT 844 ATOM 73057 O WAT 845 65.973 15.096 65.212 1.00 0.00 O ATOM 73058 H1 WAT 845 66.789 15.456 64.865 1.00 0.00 H ATOM 73059 H2 WAT 845 65.578 15.821 65.697 1.00 0.00 H TER 73061 WAT 845 ATOM 73061 O WAT 846 127.442 28.080 144.729 1.00 0.00 O ATOM 73062 H1 WAT 846 127.750 27.432 145.363 1.00 0.00 H ATOM 73063 H2 WAT 846 128.138 28.736 144.700 1.00 0.00 H TER 73065 WAT 846 ATOM 73065 O WAT 847 20.493 99.523 87.827 1.00 0.00 O ATOM 73066 H1 WAT 847 20.366 99.785 88.739 1.00 0.00 H ATOM 73067 H2 WAT 847 19.608 99.483 87.465 1.00 0.00 H TER 73069 WAT 847 ATOM 73069 O WAT 848 143.374 98.912 59.225 1.00 0.00 O ATOM 73070 H1 WAT 848 143.329 99.619 58.582 1.00 0.00 H ATOM 73071 H2 WAT 848 143.873 98.222 58.787 1.00 0.00 H TER 73073 WAT 848 ATOM 73073 O WAT 849 58.960 138.921 151.283 1.00 0.00 O ATOM 73074 H1 WAT 849 59.291 139.301 150.469 1.00 0.00 H ATOM 73075 H2 WAT 849 58.478 138.142 151.006 1.00 0.00 H TER 73077 WAT 849 ATOM 73077 O WAT 850 133.143 58.293 130.555 1.00 0.00 O ATOM 73078 H1 WAT 850 134.037 58.211 130.887 1.00 0.00 H ATOM 73079 H2 WAT 850 132.614 57.774 131.161 1.00 0.00 H TER 73081 WAT 850 ATOM 73081 O WAT 851 54.451 141.362 145.929 1.00 0.00 O ATOM 73082 H1 WAT 851 54.301 142.054 145.284 1.00 0.00 H ATOM 73083 H2 WAT 851 55.315 141.013 145.708 1.00 0.00 H TER 73085 WAT 851 ATOM 73085 O WAT 852 62.311 5.087 17.943 1.00 0.00 O ATOM 73086 H1 WAT 852 61.820 5.215 17.131 1.00 0.00 H ATOM 73087 H2 WAT 852 61.858 4.371 18.387 1.00 0.00 H TER 73089 WAT 852 ATOM 73089 O WAT 853 23.310 109.335 158.164 1.00 0.00 O ATOM 73090 H1 WAT 853 22.749 108.924 157.507 1.00 0.00 H ATOM 73091 H2 WAT 853 22.938 109.061 159.002 1.00 0.00 H TER 73093 WAT 853 ATOM 73093 O WAT 854 85.549 83.610 13.353 1.00 0.00 O ATOM 73094 H1 WAT 854 85.059 84.416 13.517 1.00 0.00 H ATOM 73095 H2 WAT 854 86.397 83.908 13.025 1.00 0.00 H TER 73097 WAT 854 ATOM 73097 O WAT 855 38.253 11.827 129.108 1.00 0.00 O ATOM 73098 H1 WAT 855 37.457 12.264 128.803 1.00 0.00 H ATOM 73099 H2 WAT 855 38.085 11.641 130.032 1.00 0.00 H TER 73101 WAT 855 ATOM 73101 O WAT 856 69.859 102.523 73.915 1.00 0.00 O ATOM 73102 H1 WAT 856 69.131 103.042 74.259 1.00 0.00 H ATOM 73103 H2 WAT 856 70.641 102.934 74.284 1.00 0.00 H TER 73105 WAT 856 ATOM 73105 O WAT 857 132.808 21.190 135.229 1.00 0.00 O ATOM 73106 H1 WAT 857 133.375 21.501 135.935 1.00 0.00 H ATOM 73107 H2 WAT 857 132.186 20.605 135.662 1.00 0.00 H TER 73109 WAT 857 ATOM 73109 O WAT 858 37.354 128.516 143.422 1.00 0.00 O ATOM 73110 H1 WAT 858 37.707 129.318 143.038 1.00 0.00 H ATOM 73111 H2 WAT 858 37.988 127.839 143.187 1.00 0.00 H TER 73113 WAT 858 ATOM 73113 O WAT 859 81.903 128.608 71.292 1.00 0.00 O ATOM 73114 H1 WAT 859 81.016 128.815 70.997 1.00 0.00 H ATOM 73115 H2 WAT 859 81.782 128.218 72.158 1.00 0.00 H TER 73117 WAT 859 ATOM 73117 O WAT 860 136.405 69.714 20.017 1.00 0.00 O ATOM 73118 H1 WAT 860 136.342 70.647 20.221 1.00 0.00 H ATOM 73119 H2 WAT 860 137.346 69.538 19.990 1.00 0.00 H TER 73121 WAT 860 ATOM 73121 O WAT 861 134.920 103.831 7.081 1.00 0.00 O ATOM 73122 H1 WAT 861 134.634 104.666 7.452 1.00 0.00 H ATOM 73123 H2 WAT 861 134.383 103.175 7.525 1.00 0.00 H TER 73125 WAT 861 ATOM 73125 O WAT 862 131.930 69.494 138.915 1.00 0.00 O ATOM 73126 H1 WAT 862 131.958 69.011 138.089 1.00 0.00 H ATOM 73127 H2 WAT 862 131.422 70.281 138.715 1.00 0.00 H TER 73129 WAT 862 ATOM 73129 O WAT 863 57.616 99.598 77.033 1.00 0.00 O ATOM 73130 H1 WAT 863 57.768 99.325 77.938 1.00 0.00 H ATOM 73131 H2 WAT 863 58.357 100.168 76.827 1.00 0.00 H TER 73133 WAT 863 ATOM 73133 O WAT 864 115.888 121.959 153.526 1.00 0.00 O ATOM 73134 H1 WAT 864 115.593 122.413 152.736 1.00 0.00 H ATOM 73135 H2 WAT 864 115.775 121.030 153.324 1.00 0.00 H TER 73137 WAT 864 ATOM 73137 O WAT 865 100.088 22.065 97.052 1.00 0.00 O ATOM 73138 H1 WAT 865 99.246 22.196 97.488 1.00 0.00 H ATOM 73139 H2 WAT 865 100.425 21.250 97.423 1.00 0.00 H TER 73141 WAT 865 ATOM 73141 O WAT 866 20.379 132.621 66.953 1.00 0.00 O ATOM 73142 H1 WAT 866 20.922 132.398 66.197 1.00 0.00 H ATOM 73143 H2 WAT 866 20.999 132.709 67.677 1.00 0.00 H TER 73145 WAT 866 ATOM 73145 O WAT 867 2.374 113.166 13.058 1.00 0.00 O ATOM 73146 H1 WAT 867 1.770 113.617 13.649 1.00 0.00 H ATOM 73147 H2 WAT 867 2.857 112.564 13.623 1.00 0.00 H TER 73149 WAT 867 ATOM 73149 O WAT 868 115.432 32.810 56.461 1.00 0.00 O ATOM 73150 H1 WAT 868 115.074 32.082 55.952 1.00 0.00 H ATOM 73151 H2 WAT 868 114.753 33.484 56.425 1.00 0.00 H TER 73153 WAT 868 ATOM 73153 O WAT 869 27.265 75.744 97.205 1.00 0.00 O ATOM 73154 H1 WAT 869 27.732 75.681 96.372 1.00 0.00 H ATOM 73155 H2 WAT 869 27.623 75.031 97.734 1.00 0.00 H TER 73157 WAT 869 ATOM 73157 O WAT 870 41.187 138.959 75.791 1.00 0.00 O ATOM 73158 H1 WAT 870 40.656 138.295 75.350 1.00 0.00 H ATOM 73159 H2 WAT 870 40.676 139.765 75.711 1.00 0.00 H TER 73161 WAT 870 ATOM 73161 O WAT 871 16.750 62.304 147.275 1.00 0.00 O ATOM 73162 H1 WAT 871 16.020 62.905 147.426 1.00 0.00 H ATOM 73163 H2 WAT 871 16.663 62.046 146.357 1.00 0.00 H TER 73165 WAT 871 ATOM 73165 O WAT 872 94.772 55.203 20.967 1.00 0.00 O ATOM 73166 H1 WAT 872 95.452 54.724 21.441 1.00 0.00 H ATOM 73167 H2 WAT 872 94.191 55.536 21.651 1.00 0.00 H TER 73169 WAT 872 ATOM 73169 O WAT 873 87.434 140.336 1.438 1.00 0.00 O ATOM 73170 H1 WAT 873 87.577 139.403 1.284 1.00 0.00 H ATOM 73171 H2 WAT 873 86.517 140.480 1.206 1.00 0.00 H TER 73173 WAT 873 ATOM 73173 O WAT 874 103.942 9.883 0.993 1.00 0.00 O ATOM 73174 H1 WAT 874 104.479 10.486 1.508 1.00 0.00 H ATOM 73175 H2 WAT 874 104.213 9.012 1.284 1.00 0.00 H TER 73177 WAT 874 ATOM 73177 O WAT 875 72.077 141.570 130.533 1.00 0.00 O ATOM 73178 H1 WAT 875 71.997 141.815 131.455 1.00 0.00 H ATOM 73179 H2 WAT 875 71.605 142.255 130.061 1.00 0.00 H TER 73181 WAT 875 ATOM 73181 O WAT 876 23.078 25.708 123.234 1.00 0.00 O ATOM 73182 H1 WAT 876 23.465 26.205 123.956 1.00 0.00 H ATOM 73183 H2 WAT 876 23.822 25.277 122.814 1.00 0.00 H TER 73185 WAT 876 ATOM 73185 O WAT 877 72.990 30.742 130.397 1.00 0.00 O ATOM 73186 H1 WAT 877 72.206 30.845 129.857 1.00 0.00 H ATOM 73187 H2 WAT 877 72.815 29.964 130.927 1.00 0.00 H TER 73189 WAT 877 ATOM 73189 O WAT 878 105.952 92.949 0.595 1.00 0.00 O ATOM 73190 H1 WAT 878 105.482 92.319 1.142 1.00 0.00 H ATOM 73191 H2 WAT 878 106.862 92.884 0.884 1.00 0.00 H TER 73193 WAT 878 ATOM 73193 O WAT 879 116.835 33.889 104.030 1.00 0.00 O ATOM 73194 H1 WAT 879 116.134 34.423 104.403 1.00 0.00 H ATOM 73195 H2 WAT 879 117.503 34.521 103.765 1.00 0.00 H TER 73197 WAT 879 ATOM 73197 O WAT 880 72.509 12.188 100.405 1.00 0.00 O ATOM 73198 H1 WAT 880 72.585 11.242 100.533 1.00 0.00 H ATOM 73199 H2 WAT 880 73.113 12.382 99.688 1.00 0.00 H TER 73201 WAT 880 ATOM 73201 O WAT 881 54.303 41.793 5.470 1.00 0.00 O ATOM 73202 H1 WAT 881 53.994 41.618 6.359 1.00 0.00 H ATOM 73203 H2 WAT 881 53.775 42.535 5.174 1.00 0.00 H TER 73205 WAT 881 ATOM 73205 O WAT 882 15.107 26.845 69.077 1.00 0.00 O ATOM 73206 H1 WAT 882 14.530 26.406 68.452 1.00 0.00 H ATOM 73207 H2 WAT 882 15.901 27.037 68.577 1.00 0.00 H TER 73209 WAT 882 ATOM 73209 O WAT 883 80.432 44.455 154.260 1.00 0.00 O ATOM 73210 H1 WAT 883 79.949 43.712 154.619 1.00 0.00 H ATOM 73211 H2 WAT 883 81.197 44.541 154.830 1.00 0.00 H TER 73213 WAT 883 ATOM 73213 O WAT 884 108.425 9.294 130.038 1.00 0.00 O ATOM 73214 H1 WAT 884 109.257 9.267 129.565 1.00 0.00 H ATOM 73215 H2 WAT 884 107.908 8.586 129.654 1.00 0.00 H TER 73217 WAT 884 ATOM 73217 O WAT 885 7.060 130.429 123.878 1.00 0.00 O ATOM 73218 H1 WAT 885 6.643 129.575 123.996 1.00 0.00 H ATOM 73219 H2 WAT 885 7.733 130.462 124.557 1.00 0.00 H TER 73221 WAT 885 ATOM 73221 O WAT 886 32.189 45.761 148.874 1.00 0.00 O ATOM 73222 H1 WAT 886 32.096 46.523 149.446 1.00 0.00 H ATOM 73223 H2 WAT 886 33.134 45.641 148.786 1.00 0.00 H TER 73225 WAT 886 ATOM 73225 O WAT 887 126.568 139.533 10.092 1.00 0.00 O ATOM 73226 H1 WAT 887 126.548 140.490 10.110 1.00 0.00 H ATOM 73227 H2 WAT 887 125.700 139.282 9.777 1.00 0.00 H TER 73229 WAT 887 ATOM 73229 O WAT 888 8.369 104.590 93.415 1.00 0.00 O ATOM 73230 H1 WAT 888 7.651 105.029 92.959 1.00 0.00 H ATOM 73231 H2 WAT 888 7.997 104.337 94.260 1.00 0.00 H TER 73233 WAT 888 ATOM 73233 O WAT 889 136.088 58.429 73.008 1.00 0.00 O ATOM 73234 H1 WAT 889 135.863 57.520 72.810 1.00 0.00 H ATOM 73235 H2 WAT 889 136.288 58.428 73.944 1.00 0.00 H TER 73237 WAT 889 ATOM 73237 O WAT 890 38.264 74.184 121.892 1.00 0.00 O ATOM 73238 H1 WAT 890 37.746 73.390 121.760 1.00 0.00 H ATOM 73239 H2 WAT 890 37.827 74.638 122.612 1.00 0.00 H TER 73241 WAT 890 ATOM 73241 O WAT 891 51.150 0.372 148.537 1.00 0.00 O ATOM 73242 H1 WAT 891 50.397 0.939 148.372 1.00 0.00 H ATOM 73243 H2 WAT 891 50.885 -0.483 148.198 1.00 0.00 H TER 73245 WAT 891 ATOM 73245 O WAT 892 89.222 84.519 61.658 1.00 0.00 O ATOM 73246 H1 WAT 892 90.025 83.999 61.634 1.00 0.00 H ATOM 73247 H2 WAT 892 88.600 84.027 61.122 1.00 0.00 H TER 73249 WAT 892 ATOM 73249 O WAT 893 1.776 85.394 89.915 1.00 0.00 O ATOM 73250 H1 WAT 893 2.017 85.541 90.829 1.00 0.00 H ATOM 73251 H2 WAT 893 2.611 85.264 89.465 1.00 0.00 H TER 73253 WAT 893 ATOM 73253 O WAT 894 103.396 0.442 78.082 1.00 0.00 O ATOM 73254 H1 WAT 894 102.775 0.034 78.685 1.00 0.00 H ATOM 73255 H2 WAT 894 103.933 1.007 78.637 1.00 0.00 H TER 73257 WAT 894 ATOM 73257 O WAT 895 63.195 49.916 7.402 1.00 0.00 O ATOM 73258 H1 WAT 895 62.477 49.563 6.877 1.00 0.00 H ATOM 73259 H2 WAT 895 62.768 50.286 8.175 1.00 0.00 H TER 73261 WAT 895 ATOM 73261 O WAT 896 140.067 81.986 118.943 1.00 0.00 O ATOM 73262 H1 WAT 896 139.915 82.230 119.856 1.00 0.00 H ATOM 73263 H2 WAT 896 140.200 82.819 118.491 1.00 0.00 H TER 73265 WAT 896 ATOM 73265 O WAT 897 136.883 115.124 87.808 1.00 0.00 O ATOM 73266 H1 WAT 897 137.802 114.970 87.590 1.00 0.00 H ATOM 73267 H2 WAT 897 136.665 115.943 87.363 1.00 0.00 H TER 73269 WAT 897 ATOM 73269 O WAT 898 22.277 53.493 12.973 1.00 0.00 O ATOM 73270 H1 WAT 898 21.818 53.083 12.240 1.00 0.00 H ATOM 73271 H2 WAT 898 22.248 52.838 13.670 1.00 0.00 H TER 73273 WAT 898 ATOM 73273 O WAT 899 66.205 38.473 0.171 1.00 0.00 O ATOM 73274 H1 WAT 899 66.902 39.099 -0.026 1.00 0.00 H ATOM 73275 H2 WAT 899 66.495 37.656 -0.235 1.00 0.00 H TER 73277 WAT 899 ATOM 73277 O WAT 900 101.321 18.024 123.071 1.00 0.00 O ATOM 73278 H1 WAT 900 100.565 17.833 123.627 1.00 0.00 H ATOM 73279 H2 WAT 900 102.070 17.685 123.561 1.00 0.00 H TER 73281 WAT 900 ATOM 73281 O WAT 901 25.095 76.806 8.088 1.00 0.00 O ATOM 73282 H1 WAT 901 24.246 77.079 8.437 1.00 0.00 H ATOM 73283 H2 WAT 901 24.998 75.867 7.932 1.00 0.00 H TER 73285 WAT 901 ATOM 73285 O WAT 902 50.516 139.121 15.930 1.00 0.00 O ATOM 73286 H1 WAT 902 50.035 139.758 16.459 1.00 0.00 H ATOM 73287 H2 WAT 902 51.335 139.564 15.708 1.00 0.00 H TER 73289 WAT 902 ATOM 73289 O WAT 903 22.817 78.890 70.744 1.00 0.00 O ATOM 73290 H1 WAT 903 22.582 78.034 70.385 1.00 0.00 H ATOM 73291 H2 WAT 903 23.063 78.709 71.651 1.00 0.00 H TER 73293 WAT 903 ATOM 73293 O WAT 904 50.482 114.334 11.714 1.00 0.00 O ATOM 73294 H1 WAT 904 51.320 113.964 11.436 1.00 0.00 H ATOM 73295 H2 WAT 904 50.579 114.463 12.658 1.00 0.00 H TER 73297 WAT 904 ATOM 73297 O WAT 905 54.078 18.066 73.634 1.00 0.00 O ATOM 73298 H1 WAT 905 54.607 18.583 73.027 1.00 0.00 H ATOM 73299 H2 WAT 905 54.685 17.413 73.984 1.00 0.00 H TER 73301 WAT 905 ATOM 73301 O WAT 906 26.225 124.048 79.741 1.00 0.00 O ATOM 73302 H1 WAT 906 26.586 124.156 78.861 1.00 0.00 H ATOM 73303 H2 WAT 906 26.055 124.941 80.042 1.00 0.00 H TER 73305 WAT 906 ATOM 73305 O WAT 907 59.989 134.822 150.249 1.00 0.00 O ATOM 73306 H1 WAT 907 59.851 133.984 149.808 1.00 0.00 H ATOM 73307 H2 WAT 907 60.568 135.309 149.662 1.00 0.00 H TER 73309 WAT 907 ATOM 73309 O WAT 908 12.972 134.300 129.792 1.00 0.00 O ATOM 73310 H1 WAT 908 13.413 133.670 130.362 1.00 0.00 H ATOM 73311 H2 WAT 908 13.684 134.790 129.380 1.00 0.00 H TER 73313 WAT 908 ATOM 73313 O WAT 909 117.035 12.233 120.374 1.00 0.00 O ATOM 73314 H1 WAT 909 117.684 11.794 119.825 1.00 0.00 H ATOM 73315 H2 WAT 909 116.212 12.136 119.895 1.00 0.00 H TER 73317 WAT 909 ATOM 73317 O WAT 910 71.514 52.528 69.638 1.00 0.00 O ATOM 73318 H1 WAT 910 70.578 52.707 69.547 1.00 0.00 H ATOM 73319 H2 WAT 910 71.660 51.745 69.108 1.00 0.00 H TER 73321 WAT 910 ATOM 73321 O WAT 911 52.271 105.921 87.129 1.00 0.00 O ATOM 73322 H1 WAT 911 51.469 106.279 87.509 1.00 0.00 H ATOM 73323 H2 WAT 911 52.037 105.719 86.223 1.00 0.00 H TER 73325 WAT 911 ATOM 73325 O WAT 912 86.843 144.261 124.390 1.00 0.00 O ATOM 73326 H1 WAT 912 86.280 143.688 124.911 1.00 0.00 H ATOM 73327 H2 WAT 912 86.365 144.385 123.570 1.00 0.00 H TER 73329 WAT 912 ATOM 73329 O WAT 913 37.336 27.788 148.815 1.00 0.00 O ATOM 73330 H1 WAT 913 36.452 28.141 148.915 1.00 0.00 H ATOM 73331 H2 WAT 913 37.207 26.846 148.707 1.00 0.00 H TER 73333 WAT 913 ATOM 73333 O WAT 914 107.535 49.260 8.069 1.00 0.00 O ATOM 73334 H1 WAT 914 107.150 50.129 8.180 1.00 0.00 H ATOM 73335 H2 WAT 914 107.385 49.047 7.148 1.00 0.00 H TER 73337 WAT 914 ATOM 73337 O WAT 915 121.348 109.039 15.770 1.00 0.00 O ATOM 73338 H1 WAT 915 121.984 109.605 16.208 1.00 0.00 H ATOM 73339 H2 WAT 915 121.633 109.020 14.857 1.00 0.00 H TER 73341 WAT 915 ATOM 73341 O WAT 916 63.586 40.880 70.516 1.00 0.00 O ATOM 73342 H1 WAT 916 63.304 41.791 70.437 1.00 0.00 H ATOM 73343 H2 WAT 916 63.054 40.525 71.229 1.00 0.00 H TER 73345 WAT 916 ATOM 73345 O WAT 917 35.857 128.743 15.724 1.00 0.00 O ATOM 73346 H1 WAT 917 35.428 127.917 15.499 1.00 0.00 H ATOM 73347 H2 WAT 917 35.207 129.415 15.519 1.00 0.00 H TER 73349 WAT 917 ATOM 73349 O WAT 918 47.033 41.331 79.417 1.00 0.00 O ATOM 73350 H1 WAT 918 47.245 41.164 78.498 1.00 0.00 H ATOM 73351 H2 WAT 918 46.969 42.284 79.479 1.00 0.00 H TER 73353 WAT 918 ATOM 73353 O WAT 919 61.217 119.891 79.883 1.00 0.00 O ATOM 73354 H1 WAT 919 60.961 119.576 80.750 1.00 0.00 H ATOM 73355 H2 WAT 919 60.818 119.270 79.275 1.00 0.00 H TER 73357 WAT 919 ATOM 73357 O WAT 920 23.754 58.337 120.339 1.00 0.00 O ATOM 73358 H1 WAT 920 24.538 57.995 119.910 1.00 0.00 H ATOM 73359 H2 WAT 920 23.867 58.107 121.262 1.00 0.00 H TER 73361 WAT 920 ATOM 73361 O WAT 921 119.416 125.257 135.543 1.00 0.00 O ATOM 73362 H1 WAT 921 119.184 124.334 135.437 1.00 0.00 H ATOM 73363 H2 WAT 921 118.708 125.622 136.074 1.00 0.00 H TER 73365 WAT 921 ATOM 73365 O WAT 922 142.506 112.184 69.438 1.00 0.00 O ATOM 73366 H1 WAT 922 143.153 112.140 68.734 1.00 0.00 H ATOM 73367 H2 WAT 922 141.721 111.781 69.067 1.00 0.00 H TER 73369 WAT 922 ATOM 73369 O WAT 923 138.399 59.035 130.006 1.00 0.00 O ATOM 73370 H1 WAT 923 139.085 58.392 129.824 1.00 0.00 H ATOM 73371 H2 WAT 923 137.858 58.624 130.680 1.00 0.00 H TER 73373 WAT 923 ATOM 73373 O WAT 924 91.328 131.076 147.545 1.00 0.00 O ATOM 73374 H1 WAT 924 90.414 131.214 147.792 1.00 0.00 H ATOM 73375 H2 WAT 924 91.831 131.484 148.251 1.00 0.00 H TER 73377 WAT 924 ATOM 73377 O WAT 925 32.751 135.374 10.565 1.00 0.00 O ATOM 73378 H1 WAT 925 33.325 135.992 10.113 1.00 0.00 H ATOM 73379 H2 WAT 925 33.267 135.070 11.312 1.00 0.00 H TER 73381 WAT 925 ATOM 73381 O WAT 926 123.585 26.375 107.056 1.00 0.00 O ATOM 73382 H1 WAT 926 122.945 27.065 106.881 1.00 0.00 H ATOM 73383 H2 WAT 926 123.058 25.616 107.304 1.00 0.00 H TER 73385 WAT 926 ATOM 73385 O WAT 927 71.212 93.339 127.584 1.00 0.00 O ATOM 73386 H1 WAT 927 70.286 93.458 127.793 1.00 0.00 H ATOM 73387 H2 WAT 927 71.445 94.114 127.073 1.00 0.00 H TER 73389 WAT 927 ATOM 73389 O WAT 928 3.866 116.878 17.414 1.00 0.00 O ATOM 73390 H1 WAT 928 4.646 116.647 17.919 1.00 0.00 H ATOM 73391 H2 WAT 928 3.137 116.730 18.017 1.00 0.00 H TER 73393 WAT 928 ATOM 73393 O WAT 929 134.486 1.824 110.850 1.00 0.00 O ATOM 73394 H1 WAT 929 134.246 2.750 110.828 1.00 0.00 H ATOM 73395 H2 WAT 929 134.388 1.573 111.769 1.00 0.00 H TER 73397 WAT 929 ATOM 73397 O WAT 930 135.648 82.828 95.982 1.00 0.00 O ATOM 73398 H1 WAT 930 134.990 82.595 96.637 1.00 0.00 H ATOM 73399 H2 WAT 930 135.985 81.987 95.673 1.00 0.00 H TER 73401 WAT 930 ATOM 73401 O WAT 931 121.626 2.119 130.528 1.00 0.00 O ATOM 73402 H1 WAT 931 122.366 2.459 130.025 1.00 0.00 H ATOM 73403 H2 WAT 931 120.901 2.097 129.903 1.00 0.00 H TER 73405 WAT 931 ATOM 73405 O WAT 932 43.707 3.348 2.251 1.00 0.00 O ATOM 73406 H1 WAT 932 42.875 2.939 2.490 1.00 0.00 H ATOM 73407 H2 WAT 932 43.559 3.696 1.372 1.00 0.00 H TER 73409 WAT 932 ATOM 73409 O WAT 933 35.492 47.836 153.415 1.00 0.00 O ATOM 73410 H1 WAT 933 36.227 47.416 152.968 1.00 0.00 H ATOM 73411 H2 WAT 933 34.999 48.263 152.714 1.00 0.00 H TER 73413 WAT 933 ATOM 73413 O WAT 934 12.293 58.758 56.159 1.00 0.00 O ATOM 73414 H1 WAT 934 12.706 58.929 55.313 1.00 0.00 H ATOM 73415 H2 WAT 934 11.636 58.088 55.975 1.00 0.00 H TER 73417 WAT 934 ATOM 73417 O WAT 935 18.062 73.231 11.771 1.00 0.00 O ATOM 73418 H1 WAT 935 18.062 73.402 12.713 1.00 0.00 H ATOM 73419 H2 WAT 935 18.958 73.422 11.493 1.00 0.00 H TER 73421 WAT 935 ATOM 73421 O WAT 936 118.562 141.435 65.924 1.00 0.00 O ATOM 73422 H1 WAT 936 118.455 142.108 65.251 1.00 0.00 H ATOM 73423 H2 WAT 936 119.212 140.834 65.560 1.00 0.00 H TER 73425 WAT 936 ATOM 73425 O WAT 937 66.856 103.402 14.701 1.00 0.00 O ATOM 73426 H1 WAT 937 67.480 104.125 14.631 1.00 0.00 H ATOM 73427 H2 WAT 937 65.997 103.823 14.661 1.00 0.00 H TER 73429 WAT 937 ATOM 73429 O WAT 938 101.928 7.816 122.108 1.00 0.00 O ATOM 73430 H1 WAT 938 102.817 7.903 121.764 1.00 0.00 H ATOM 73431 H2 WAT 938 102.049 7.518 123.010 1.00 0.00 H TER 73433 WAT 938 ATOM 73433 O WAT 939 129.841 96.507 142.124 1.00 0.00 O ATOM 73434 H1 WAT 939 130.211 96.178 142.944 1.00 0.00 H ATOM 73435 H2 WAT 939 128.899 96.553 142.288 1.00 0.00 H TER 73437 WAT 939 ATOM 73437 O WAT 940 144.104 102.745 9.989 1.00 0.00 O ATOM 73438 H1 WAT 940 143.487 103.457 9.822 1.00 0.00 H ATOM 73439 H2 WAT 940 144.958 103.107 9.754 1.00 0.00 H TER 73441 WAT 940 ATOM 73441 O WAT 941 28.236 21.337 27.548 1.00 0.00 O ATOM 73442 H1 WAT 941 28.921 20.731 27.265 1.00 0.00 H ATOM 73443 H2 WAT 941 27.431 20.821 27.513 1.00 0.00 H TER 73445 WAT 941 ATOM 73445 O WAT 942 45.831 27.345 131.974 1.00 0.00 O ATOM 73446 H1 WAT 942 46.311 26.787 131.363 1.00 0.00 H ATOM 73447 H2 WAT 942 45.291 26.738 132.480 1.00 0.00 H TER 73449 WAT 942 ATOM 73449 O WAT 943 75.134 111.935 72.508 1.00 0.00 O ATOM 73450 H1 WAT 943 75.343 112.854 72.342 1.00 0.00 H ATOM 73451 H2 WAT 943 75.265 111.826 73.450 1.00 0.00 H TER 73453 WAT 943 ATOM 73453 O WAT 944 54.096 129.725 138.657 1.00 0.00 O ATOM 73454 H1 WAT 944 54.800 129.796 139.302 1.00 0.00 H ATOM 73455 H2 WAT 944 54.530 129.859 137.814 1.00 0.00 H TER 73457 WAT 944 ATOM 73457 O WAT 945 117.800 54.670 145.188 1.00 0.00 O ATOM 73458 H1 WAT 945 117.077 54.374 145.741 1.00 0.00 H ATOM 73459 H2 WAT 945 117.557 55.560 144.932 1.00 0.00 H TER 73461 WAT 945 ATOM 73461 O WAT 946 65.874 90.368 133.713 1.00 0.00 O ATOM 73462 H1 WAT 946 66.810 90.372 133.909 1.00 0.00 H ATOM 73463 H2 WAT 946 65.630 89.442 133.729 1.00 0.00 H TER 73465 WAT 946 ATOM 73465 O WAT 947 64.926 97.949 9.633 1.00 0.00 O ATOM 73466 H1 WAT 947 65.648 97.586 10.145 1.00 0.00 H ATOM 73467 H2 WAT 947 64.399 97.188 9.388 1.00 0.00 H TER 73469 WAT 947 ATOM 73469 O WAT 948 10.831 120.769 86.301 1.00 0.00 O ATOM 73470 H1 WAT 948 11.267 120.782 87.153 1.00 0.00 H ATOM 73471 H2 WAT 948 11.530 120.573 85.677 1.00 0.00 H TER 73473 WAT 948 ATOM 73473 O WAT 949 109.616 111.912 17.973 1.00 0.00 O ATOM 73474 H1 WAT 949 108.890 112.322 17.504 1.00 0.00 H ATOM 73475 H2 WAT 949 109.790 112.501 18.708 1.00 0.00 H TER 73477 WAT 949 ATOM 73477 O WAT 950 129.137 55.640 151.146 1.00 0.00 O ATOM 73478 H1 WAT 950 129.879 56.036 151.602 1.00 0.00 H ATOM 73479 H2 WAT 950 128.590 56.382 150.888 1.00 0.00 H TER 73481 WAT 950 ATOM 73481 O WAT 951 145.657 82.251 136.526 1.00 0.00 O ATOM 73482 H1 WAT 951 145.486 82.125 137.459 1.00 0.00 H ATOM 73483 H2 WAT 951 146.111 83.092 136.477 1.00 0.00 H TER 73485 WAT 951 ATOM 73485 O WAT 952 20.706 126.926 4.288 1.00 0.00 O ATOM 73486 H1 WAT 952 20.228 126.627 5.061 1.00 0.00 H ATOM 73487 H2 WAT 952 21.626 126.910 4.554 1.00 0.00 H TER 73489 WAT 952 ATOM 73489 O WAT 953 11.630 101.320 10.548 1.00 0.00 O ATOM 73490 H1 WAT 953 11.502 100.436 10.206 1.00 0.00 H ATOM 73491 H2 WAT 953 10.866 101.475 11.104 1.00 0.00 H TER 73493 WAT 953 ATOM 73493 O WAT 954 17.341 140.585 113.604 1.00 0.00 O ATOM 73494 H1 WAT 954 17.481 141.525 113.717 1.00 0.00 H ATOM 73495 H2 WAT 954 16.819 140.327 114.363 1.00 0.00 H TER 73497 WAT 954 ATOM 73497 O WAT 955 9.625 102.857 141.470 1.00 0.00 O ATOM 73498 H1 WAT 955 9.214 102.565 142.283 1.00 0.00 H ATOM 73499 H2 WAT 955 9.519 103.808 141.475 1.00 0.00 H TER 73501 WAT 955 ATOM 73501 O WAT 956 89.556 141.541 151.372 1.00 0.00 O ATOM 73502 H1 WAT 956 88.895 141.469 152.061 1.00 0.00 H ATOM 73503 H2 WAT 956 90.240 140.923 151.630 1.00 0.00 H TER 73505 WAT 956 ATOM 73505 O WAT 957 137.920 96.281 146.158 1.00 0.00 O ATOM 73506 H1 WAT 957 137.317 96.030 146.857 1.00 0.00 H ATOM 73507 H2 WAT 957 137.856 97.235 146.117 1.00 0.00 H TER 73509 WAT 957 ATOM 73509 O WAT 958 35.316 90.738 138.197 1.00 0.00 O ATOM 73510 H1 WAT 958 35.636 91.608 138.437 1.00 0.00 H ATOM 73511 H2 WAT 958 35.515 90.659 137.264 1.00 0.00 H TER 73513 WAT 958 ATOM 73513 O WAT 959 3.826 75.529 103.683 1.00 0.00 O ATOM 73514 H1 WAT 959 3.540 76.422 103.875 1.00 0.00 H ATOM 73515 H2 WAT 959 3.166 74.972 104.095 1.00 0.00 H TER 73517 WAT 959 ATOM 73517 O WAT 960 81.913 109.425 18.477 1.00 0.00 O ATOM 73518 H1 WAT 960 81.648 108.508 18.544 1.00 0.00 H ATOM 73519 H2 WAT 960 81.497 109.850 19.226 1.00 0.00 H TER 73521 WAT 960 ATOM 73521 O WAT 961 71.381 27.499 108.967 1.00 0.00 O ATOM 73522 H1 WAT 961 70.893 27.532 108.144 1.00 0.00 H ATOM 73523 H2 WAT 961 72.090 28.132 108.850 1.00 0.00 H TER 73525 WAT 961 ATOM 73525 O WAT 962 101.015 133.287 85.776 1.00 0.00 O ATOM 73526 H1 WAT 962 101.060 133.139 84.832 1.00 0.00 H ATOM 73527 H2 WAT 962 100.117 133.583 85.930 1.00 0.00 H TER 73529 WAT 962 ATOM 73529 O WAT 963 75.151 95.863 93.537 1.00 0.00 O ATOM 73530 H1 WAT 963 75.150 96.363 92.721 1.00 0.00 H ATOM 73531 H2 WAT 963 74.345 95.348 93.502 1.00 0.00 H TER 73533 WAT 963 ATOM 73533 O WAT 964 13.169 83.260 27.075 1.00 0.00 O ATOM 73534 H1 WAT 964 13.156 83.877 26.344 1.00 0.00 H ATOM 73535 H2 WAT 964 13.054 82.402 26.667 1.00 0.00 H TER 73537 WAT 964 ATOM 73537 O WAT 965 69.305 50.514 134.882 1.00 0.00 O ATOM 73538 H1 WAT 965 70.215 50.362 134.629 1.00 0.00 H ATOM 73539 H2 WAT 965 69.361 50.906 135.753 1.00 0.00 H TER 73541 WAT 965 ATOM 73541 O WAT 966 32.673 119.140 114.123 1.00 0.00 O ATOM 73542 H1 WAT 966 32.319 118.282 114.360 1.00 0.00 H ATOM 73543 H2 WAT 966 33.540 118.951 113.766 1.00 0.00 H TER 73545 WAT 966 ATOM 73545 O WAT 967 60.482 44.467 131.768 1.00 0.00 O ATOM 73546 H1 WAT 967 61.380 44.458 132.100 1.00 0.00 H ATOM 73547 H2 WAT 967 60.286 45.394 131.631 1.00 0.00 H TER 73549 WAT 967 ATOM 73549 O WAT 968 126.599 119.053 134.642 1.00 0.00 O ATOM 73550 H1 WAT 968 126.531 118.143 134.929 1.00 0.00 H ATOM 73551 H2 WAT 968 126.798 118.995 133.707 1.00 0.00 H TER 73553 WAT 968 ATOM 73553 O WAT 969 61.106 143.577 149.241 1.00 0.00 O ATOM 73554 H1 WAT 969 61.050 143.719 148.296 1.00 0.00 H ATOM 73555 H2 WAT 969 60.418 144.132 149.608 1.00 0.00 H TER 73557 WAT 969 ATOM 73557 O WAT 970 141.127 14.818 71.412 1.00 0.00 O ATOM 73558 H1 WAT 970 140.200 14.982 71.585 1.00 0.00 H ATOM 73559 H2 WAT 970 141.204 14.861 70.459 1.00 0.00 H TER 73561 WAT 970 ATOM 73561 O WAT 971 95.155 143.708 138.938 1.00 0.00 O ATOM 73562 H1 WAT 971 94.734 143.852 139.785 1.00 0.00 H ATOM 73563 H2 WAT 971 94.449 143.813 138.299 1.00 0.00 H TER 73565 WAT 971 ATOM 73565 O WAT 972 13.794 50.256 70.572 1.00 0.00 O ATOM 73566 H1 WAT 972 14.248 49.859 69.828 1.00 0.00 H ATOM 73567 H2 WAT 972 12.865 50.136 70.376 1.00 0.00 H TER 73569 WAT 972 ATOM 73569 O WAT 973 143.596 144.026 88.893 1.00 0.00 O ATOM 73570 H1 WAT 973 142.981 143.499 89.403 1.00 0.00 H ATOM 73571 H2 WAT 973 143.187 144.102 88.030 1.00 0.00 H TER 73573 WAT 973 ATOM 73573 O WAT 974 68.407 107.463 146.990 1.00 0.00 O ATOM 73574 H1 WAT 974 69.277 107.850 146.891 1.00 0.00 H ATOM 73575 H2 WAT 974 68.361 106.799 146.302 1.00 0.00 H TER 73577 WAT 974 ATOM 73577 O WAT 975 104.503 87.601 91.118 1.00 0.00 O ATOM 73578 H1 WAT 975 104.748 86.677 91.180 1.00 0.00 H ATOM 73579 H2 WAT 975 103.733 87.682 91.681 1.00 0.00 H TER 73581 WAT 975 ATOM 73581 O WAT 976 35.703 17.789 148.470 1.00 0.00 O ATOM 73582 H1 WAT 976 36.070 18.245 147.712 1.00 0.00 H ATOM 73583 H2 WAT 976 35.552 16.896 148.162 1.00 0.00 H TER 73585 WAT 976 ATOM 73585 O WAT 977 109.926 5.321 74.206 1.00 0.00 O ATOM 73586 H1 WAT 977 109.337 6.070 74.296 1.00 0.00 H ATOM 73587 H2 WAT 977 110.175 5.322 73.282 1.00 0.00 H TER 73589 WAT 977 ATOM 73589 O WAT 978 32.175 38.027 82.013 1.00 0.00 O ATOM 73590 H1 WAT 978 31.647 37.664 81.302 1.00 0.00 H ATOM 73591 H2 WAT 978 32.008 38.969 81.979 1.00 0.00 H TER 73593 WAT 978 ATOM 73593 O WAT 979 62.772 133.757 13.964 1.00 0.00 O ATOM 73594 H1 WAT 979 63.241 133.525 13.162 1.00 0.00 H ATOM 73595 H2 WAT 979 63.017 134.667 14.130 1.00 0.00 H TER 73597 WAT 979 ATOM 73597 O WAT 980 122.995 143.436 104.969 1.00 0.00 O ATOM 73598 H1 WAT 980 123.576 143.592 104.225 1.00 0.00 H ATOM 73599 H2 WAT 980 122.746 144.311 105.266 1.00 0.00 H TER 73601 WAT 980 ATOM 73601 O WAT 981 37.150 35.446 81.510 1.00 0.00 O ATOM 73602 H1 WAT 981 36.264 35.685 81.236 1.00 0.00 H ATOM 73603 H2 WAT 981 37.391 36.114 82.151 1.00 0.00 H TER 73605 WAT 981 ATOM 73605 O WAT 982 130.850 86.733 76.266 1.00 0.00 O ATOM 73606 H1 WAT 982 130.052 86.358 76.637 1.00 0.00 H ATOM 73607 H2 WAT 982 131.284 85.997 75.835 1.00 0.00 H TER 73609 WAT 982 ATOM 73609 O WAT 983 120.392 11.217 91.259 1.00 0.00 O ATOM 73610 H1 WAT 983 121.169 11.741 91.064 1.00 0.00 H ATOM 73611 H2 WAT 983 120.635 10.709 92.032 1.00 0.00 H TER 73613 WAT 983 ATOM 73613 O WAT 984 85.612 9.408 123.207 1.00 0.00 O ATOM 73614 H1 WAT 984 86.436 8.934 123.095 1.00 0.00 H ATOM 73615 H2 WAT 984 85.499 9.473 124.155 1.00 0.00 H TER 73617 WAT 984 ATOM 73617 O WAT 985 118.047 102.900 135.836 1.00 0.00 O ATOM 73618 H1 WAT 985 118.960 103.175 135.752 1.00 0.00 H ATOM 73619 H2 WAT 985 118.071 102.180 136.467 1.00 0.00 H TER 73621 WAT 985 ATOM 73621 O WAT 986 72.080 7.151 66.515 1.00 0.00 O ATOM 73622 H1 WAT 986 72.867 7.029 67.046 1.00 0.00 H ATOM 73623 H2 WAT 986 71.527 6.401 66.731 1.00 0.00 H TER 73625 WAT 986 ATOM 73625 O WAT 987 11.925 124.469 136.525 1.00 0.00 O ATOM 73626 H1 WAT 987 12.206 124.359 135.616 1.00 0.00 H ATOM 73627 H2 WAT 987 12.578 125.056 136.907 1.00 0.00 H TER 73629 WAT 987 ATOM 73629 O WAT 988 118.660 91.587 116.947 1.00 0.00 O ATOM 73630 H1 WAT 988 118.177 92.029 117.645 1.00 0.00 H ATOM 73631 H2 WAT 988 118.970 92.295 116.383 1.00 0.00 H TER 73633 WAT 988 ATOM 73633 O WAT 989 138.380 52.761 85.070 1.00 0.00 O ATOM 73634 H1 WAT 989 138.802 52.277 84.360 1.00 0.00 H ATOM 73635 H2 WAT 989 137.961 53.505 84.638 1.00 0.00 H TER 73637 WAT 989 ATOM 73637 O WAT 990 143.406 85.112 78.031 1.00 0.00 O ATOM 73638 H1 WAT 990 143.526 85.820 78.664 1.00 0.00 H ATOM 73639 H2 WAT 990 143.914 85.386 77.267 1.00 0.00 H TER 73641 WAT 990 ATOM 73641 O WAT 991 21.365 19.039 156.126 1.00 0.00 O ATOM 73642 H1 WAT 991 20.889 19.821 155.844 1.00 0.00 H ATOM 73643 H2 WAT 991 21.262 19.026 157.077 1.00 0.00 H TER 73645 WAT 991 ATOM 73645 O WAT 992 87.141 134.664 90.328 1.00 0.00 O ATOM 73646 H1 WAT 992 86.349 135.106 90.635 1.00 0.00 H ATOM 73647 H2 WAT 992 87.233 133.908 90.909 1.00 0.00 H TER 73649 WAT 992 ATOM 73649 O WAT 993 75.322 77.566 145.494 1.00 0.00 O ATOM 73650 H1 WAT 993 76.265 77.662 145.627 1.00 0.00 H ATOM 73651 H2 WAT 993 74.945 78.362 145.870 1.00 0.00 H TER 73653 WAT 993 ATOM 73653 O WAT 994 142.453 124.951 14.290 1.00 0.00 O ATOM 73654 H1 WAT 994 142.752 124.694 15.162 1.00 0.00 H ATOM 73655 H2 WAT 994 143.248 125.230 13.836 1.00 0.00 H TER 73657 WAT 994 ATOM 73657 O WAT 995 76.607 66.929 155.129 1.00 0.00 O ATOM 73658 H1 WAT 995 76.336 66.127 155.576 1.00 0.00 H ATOM 73659 H2 WAT 995 77.299 67.290 155.683 1.00 0.00 H TER 73661 WAT 995 ATOM 73661 O WAT 996 121.716 6.115 144.790 1.00 0.00 O ATOM 73662 H1 WAT 996 122.620 6.274 144.519 1.00 0.00 H ATOM 73663 H2 WAT 996 121.645 6.536 145.647 1.00 0.00 H TER 73665 WAT 996 ATOM 73665 O WAT 997 116.182 106.835 138.684 1.00 0.00 O ATOM 73666 H1 WAT 997 115.361 107.328 138.695 1.00 0.00 H ATOM 73667 H2 WAT 997 116.785 107.385 138.185 1.00 0.00 H TER 73669 WAT 997 ATOM 73669 O WAT 998 116.881 113.254 119.554 1.00 0.00 O ATOM 73670 H1 WAT 998 117.216 114.032 120.000 1.00 0.00 H ATOM 73671 H2 WAT 998 115.991 113.151 119.890 1.00 0.00 H TER 73673 WAT 998 ATOM 73673 O WAT 999 52.031 42.601 91.657 1.00 0.00 O ATOM 73674 H1 WAT 999 52.144 41.657 91.771 1.00 0.00 H ATOM 73675 H2 WAT 999 52.789 42.871 91.139 1.00 0.00 H TER 73677 WAT 999 ATOM 73677 O WAT 1000 3.744 111.728 90.685 1.00 0.00 O ATOM 73678 H1 WAT 1000 3.152 112.045 90.003 1.00 0.00 H ATOM 73679 H2 WAT 1000 3.874 110.802 90.477 1.00 0.00 H TER 73681 WAT 1000 ATOM 73681 O WAT 1001 96.113 74.193 11.058 1.00 0.00 O ATOM 73682 H1 WAT 1001 96.378 73.323 11.357 1.00 0.00 H ATOM 73683 H2 WAT 1001 95.476 74.487 11.710 1.00 0.00 H TER 73685 WAT 1001 ATOM 73685 O WAT 1002 137.621 127.077 144.626 1.00 0.00 O ATOM 73686 H1 WAT 1002 138.093 127.435 143.874 1.00 0.00 H ATOM 73687 H2 WAT 1002 137.273 127.846 145.078 1.00 0.00 H TER 73689 WAT 1002 ATOM 73689 O WAT 1003 69.442 109.916 18.492 1.00 0.00 O ATOM 73690 H1 WAT 1003 68.733 109.842 17.853 1.00 0.00 H ATOM 73691 H2 WAT 1003 69.041 109.665 19.324 1.00 0.00 H TER 73693 WAT 1003 ATOM 73693 O WAT 1004 38.877 112.596 3.659 1.00 0.00 O ATOM 73694 H1 WAT 1004 37.950 112.455 3.852 1.00 0.00 H ATOM 73695 H2 WAT 1004 39.202 111.734 3.401 1.00 0.00 H TER 73697 WAT 1004 ATOM 73697 O WAT 1005 16.858 87.573 13.124 1.00 0.00 O ATOM 73698 H1 WAT 1005 16.484 86.826 12.657 1.00 0.00 H ATOM 73699 H2 WAT 1005 17.734 87.673 12.752 1.00 0.00 H TER 73701 WAT 1005 ATOM 73701 O WAT 1006 80.667 122.374 100.869 1.00 0.00 O ATOM 73702 H1 WAT 1006 81.512 122.012 101.137 1.00 0.00 H ATOM 73703 H2 WAT 1006 80.742 123.312 101.045 1.00 0.00 H TER 73705 WAT 1006 ATOM 73705 O WAT 1007 93.035 27.017 141.831 1.00 0.00 O ATOM 73706 H1 WAT 1007 92.763 27.933 141.767 1.00 0.00 H ATOM 73707 H2 WAT 1007 92.411 26.544 141.280 1.00 0.00 H TER 73709 WAT 1007 ATOM 73709 O WAT 1008 133.723 98.551 139.158 1.00 0.00 O ATOM 73710 H1 WAT 1008 133.130 97.955 138.702 1.00 0.00 H ATOM 73711 H2 WAT 1008 133.275 99.397 139.137 1.00 0.00 H TER 73713 WAT 1008 ATOM 73713 O WAT 1009 141.140 132.622 87.111 1.00 0.00 O ATOM 73714 H1 WAT 1009 142.015 133.010 87.115 1.00 0.00 H ATOM 73715 H2 WAT 1009 140.730 132.949 87.912 1.00 0.00 H TER 73717 WAT 1009 ATOM 73717 O WAT 1010 48.798 49.797 20.799 1.00 0.00 O ATOM 73718 H1 WAT 1010 48.696 49.515 19.890 1.00 0.00 H ATOM 73719 H2 WAT 1010 49.724 49.650 20.994 1.00 0.00 H TER 73721 WAT 1010 ATOM 73721 O WAT 1011 95.890 19.744 12.029 1.00 0.00 O ATOM 73722 H1 WAT 1011 96.233 20.304 11.332 1.00 0.00 H ATOM 73723 H2 WAT 1011 95.777 18.889 11.616 1.00 0.00 H TER 73725 WAT 1011 ATOM 73725 O WAT 1012 46.913 18.725 102.848 1.00 0.00 O ATOM 73726 H1 WAT 1012 47.020 18.901 103.783 1.00 0.00 H ATOM 73727 H2 WAT 1012 46.705 17.791 102.803 1.00 0.00 H TER 73729 WAT 1012 ATOM 73729 O WAT 1013 66.210 112.830 76.617 1.00 0.00 O ATOM 73730 H1 WAT 1013 66.660 112.256 77.236 1.00 0.00 H ATOM 73731 H2 WAT 1013 65.751 112.233 76.027 1.00 0.00 H TER 73733 WAT 1013 ATOM 73733 O WAT 1014 110.372 49.240 95.576 1.00 0.00 O ATOM 73734 H1 WAT 1014 111.187 48.875 95.919 1.00 0.00 H ATOM 73735 H2 WAT 1014 110.211 50.015 96.114 1.00 0.00 H TER 73737 WAT 1014 ATOM 73737 O WAT 1015 53.172 125.646 119.195 1.00 0.00 O ATOM 73738 H1 WAT 1015 52.576 125.752 118.453 1.00 0.00 H ATOM 73739 H2 WAT 1015 52.933 126.352 119.796 1.00 0.00 H TER 73741 WAT 1015 ATOM 73741 O WAT 1016 51.502 40.597 119.207 1.00 0.00 O ATOM 73742 H1 WAT 1016 52.079 40.309 119.915 1.00 0.00 H ATOM 73743 H2 WAT 1016 50.735 40.030 119.277 1.00 0.00 H TER 73745 WAT 1016 ATOM 73745 O WAT 1017 40.564 75.835 83.474 1.00 0.00 O ATOM 73746 H1 WAT 1017 40.791 76.237 84.312 1.00 0.00 H ATOM 73747 H2 WAT 1017 40.350 76.574 82.904 1.00 0.00 H TER 73749 WAT 1017 ATOM 73749 O WAT 1018 20.922 20.643 125.386 1.00 0.00 O ATOM 73750 H1 WAT 1018 20.380 19.966 124.981 1.00 0.00 H ATOM 73751 H2 WAT 1018 20.700 21.443 124.911 1.00 0.00 H TER 73753 WAT 1018 ATOM 73753 O WAT 1019 106.899 46.838 87.494 1.00 0.00 O ATOM 73754 H1 WAT 1019 107.683 46.936 86.954 1.00 0.00 H ATOM 73755 H2 WAT 1019 107.180 47.092 88.373 1.00 0.00 H TER 73757 WAT 1019 ATOM 73757 O WAT 1020 54.981 119.602 154.163 1.00 0.00 O ATOM 73758 H1 WAT 1020 55.835 119.698 154.583 1.00 0.00 H ATOM 73759 H2 WAT 1020 54.350 119.811 154.851 1.00 0.00 H TER 73761 WAT 1020 ATOM 73761 O WAT 1021 57.155 15.703 150.621 1.00 0.00 O ATOM 73762 H1 WAT 1021 56.257 15.919 150.871 1.00 0.00 H ATOM 73763 H2 WAT 1021 57.314 16.217 149.829 1.00 0.00 H TER 73765 WAT 1021 ATOM 73765 O WAT 1022 24.312 104.951 108.052 1.00 0.00 O ATOM 73766 H1 WAT 1022 24.662 104.252 108.604 1.00 0.00 H ATOM 73767 H2 WAT 1022 24.913 105.684 108.184 1.00 0.00 H TER 73769 WAT 1022 ATOM 73769 O WAT 1023 35.270 67.158 111.064 1.00 0.00 O ATOM 73770 H1 WAT 1023 35.344 66.535 111.787 1.00 0.00 H ATOM 73771 H2 WAT 1023 36.175 67.381 110.847 1.00 0.00 H TER 73773 WAT 1023 ATOM 73773 O WAT 1024 96.761 59.466 133.214 1.00 0.00 O ATOM 73774 H1 WAT 1024 96.441 58.572 133.091 1.00 0.00 H ATOM 73775 H2 WAT 1024 95.980 60.014 133.130 1.00 0.00 H TER 73777 WAT 1024 ATOM 73777 O WAT 1025 40.614 66.189 92.243 1.00 0.00 O ATOM 73778 H1 WAT 1025 40.994 66.512 93.060 1.00 0.00 H ATOM 73779 H2 WAT 1025 41.285 66.361 91.582 1.00 0.00 H TER 73781 WAT 1025 ATOM 73781 O WAT 1026 16.948 119.997 81.029 1.00 0.00 O ATOM 73782 H1 WAT 1026 17.717 120.363 81.466 1.00 0.00 H ATOM 73783 H2 WAT 1026 16.629 119.325 81.631 1.00 0.00 H TER 73785 WAT 1026 ATOM 73785 O WAT 1027 78.309 118.918 92.513 1.00 0.00 O ATOM 73786 H1 WAT 1027 77.852 118.675 91.708 1.00 0.00 H ATOM 73787 H2 WAT 1027 79.235 118.929 92.269 1.00 0.00 H TER 73789 WAT 1027 ATOM 73789 O WAT 1028 113.904 30.392 64.472 1.00 0.00 O ATOM 73790 H1 WAT 1028 114.500 29.646 64.399 1.00 0.00 H ATOM 73791 H2 WAT 1028 113.144 30.046 64.939 1.00 0.00 H TER 73793 WAT 1028 ATOM 73793 O WAT 1029 60.274 125.276 88.152 1.00 0.00 O ATOM 73794 H1 WAT 1029 60.902 124.565 88.026 1.00 0.00 H ATOM 73795 H2 WAT 1029 59.893 125.415 87.285 1.00 0.00 H TER 73797 WAT 1029 ATOM 73797 O WAT 1030 77.840 60.342 109.726 1.00 0.00 O ATOM 73798 H1 WAT 1030 78.239 60.808 108.992 1.00 0.00 H ATOM 73799 H2 WAT 1030 77.294 60.998 110.158 1.00 0.00 H TER 73801 WAT 1030 ATOM 73801 O WAT 1031 100.416 43.721 1.238 1.00 0.00 O ATOM 73802 H1 WAT 1031 99.994 44.449 1.696 1.00 0.00 H ATOM 73803 H2 WAT 1031 99.724 43.350 0.691 1.00 0.00 H TER 73805 WAT 1031 ATOM 73805 O WAT 1032 6.695 74.532 154.482 1.00 0.00 O ATOM 73806 H1 WAT 1032 6.656 75.176 155.190 1.00 0.00 H ATOM 73807 H2 WAT 1032 6.255 74.958 153.747 1.00 0.00 H TER 73809 WAT 1032 ATOM 73809 O WAT 1033 74.420 131.196 78.622 1.00 0.00 O ATOM 73810 H1 WAT 1033 75.153 131.570 79.111 1.00 0.00 H ATOM 73811 H2 WAT 1033 74.827 130.778 77.863 1.00 0.00 H TER 73813 WAT 1033 ATOM 73813 O WAT 1034 107.653 124.823 72.009 1.00 0.00 O ATOM 73814 H1 WAT 1034 108.574 124.694 72.236 1.00 0.00 H ATOM 73815 H2 WAT 1034 107.403 125.624 72.470 1.00 0.00 H TER 73817 WAT 1034 ATOM 73817 O WAT 1035 145.204 143.336 147.431 1.00 0.00 O ATOM 73818 H1 WAT 1035 146.035 143.530 147.865 1.00 0.00 H ATOM 73819 H2 WAT 1035 144.596 143.158 148.149 1.00 0.00 H TER 73821 WAT 1035 ATOM 73821 O WAT 1036 57.599 95.556 91.674 1.00 0.00 O ATOM 73822 H1 WAT 1036 56.824 95.902 91.231 1.00 0.00 H ATOM 73823 H2 WAT 1036 58.318 96.103 91.360 1.00 0.00 H TER 73825 WAT 1036 ATOM 73825 O WAT 1037 131.250 140.051 106.515 1.00 0.00 O ATOM 73826 H1 WAT 1037 131.792 139.420 106.988 1.00 0.00 H ATOM 73827 H2 WAT 1037 131.813 140.370 105.810 1.00 0.00 H TER 73829 WAT 1037 ATOM 73829 O WAT 1038 51.823 32.521 148.048 1.00 0.00 O ATOM 73830 H1 WAT 1038 51.104 32.895 148.558 1.00 0.00 H ATOM 73831 H2 WAT 1038 51.792 32.988 147.213 1.00 0.00 H TER 73833 WAT 1038 ATOM 73833 O WAT 1039 101.191 78.456 26.562 1.00 0.00 O ATOM 73834 H1 WAT 1039 100.794 79.297 26.791 1.00 0.00 H ATOM 73835 H2 WAT 1039 102.120 78.654 26.445 1.00 0.00 H TER 73837 WAT 1039 ATOM 73837 O WAT 1040 113.924 21.877 17.430 1.00 0.00 O ATOM 73838 H1 WAT 1040 113.964 21.572 16.523 1.00 0.00 H ATOM 73839 H2 WAT 1040 114.763 22.316 17.573 1.00 0.00 H TER 73841 WAT 1040 ATOM 73841 O WAT 1041 67.095 70.349 75.560 1.00 0.00 O ATOM 73842 H1 WAT 1041 67.058 71.305 75.549 1.00 0.00 H ATOM 73843 H2 WAT 1041 67.332 70.108 74.665 1.00 0.00 H TER 73845 WAT 1041 ATOM 73845 O WAT 1042 138.268 77.459 11.704 1.00 0.00 O ATOM 73846 H1 WAT 1042 137.862 78.116 12.270 1.00 0.00 H ATOM 73847 H2 WAT 1042 139.067 77.206 12.166 1.00 0.00 H TER 73849 WAT 1042 ATOM 73849 O WAT 1043 9.405 41.987 57.181 1.00 0.00 O ATOM 73850 H1 WAT 1043 8.952 42.793 57.431 1.00 0.00 H ATOM 73851 H2 WAT 1043 10.100 41.891 57.832 1.00 0.00 H TER 73853 WAT 1043 ATOM 73853 O WAT 1044 100.767 83.778 102.869 1.00 0.00 O ATOM 73854 H1 WAT 1044 100.524 83.626 101.956 1.00 0.00 H ATOM 73855 H2 WAT 1044 99.932 83.852 103.330 1.00 0.00 H TER 73857 WAT 1044 ATOM 73857 O WAT 1045 76.122 22.075 108.734 1.00 0.00 O ATOM 73858 H1 WAT 1045 75.984 21.138 108.874 1.00 0.00 H ATOM 73859 H2 WAT 1045 75.242 22.452 108.753 1.00 0.00 H TER 73861 WAT 1045 ATOM 73861 O WAT 1046 67.176 123.814 69.409 1.00 0.00 O ATOM 73862 H1 WAT 1046 66.873 123.153 70.032 1.00 0.00 H ATOM 73863 H2 WAT 1046 66.483 124.473 69.403 1.00 0.00 H TER 73865 WAT 1046 ATOM 73865 O WAT 1047 97.623 0.414 108.990 1.00 0.00 O ATOM 73866 H1 WAT 1047 96.747 0.466 108.608 1.00 0.00 H ATOM 73867 H2 WAT 1047 97.547 -0.249 109.676 1.00 0.00 H TER 73869 WAT 1047 ATOM 73869 O WAT 1048 91.481 105.442 105.474 1.00 0.00 O ATOM 73870 H1 WAT 1048 91.695 106.145 104.861 1.00 0.00 H ATOM 73871 H2 WAT 1048 91.484 104.648 104.939 1.00 0.00 H TER 73873 WAT 1048 ATOM 73873 O WAT 1049 81.500 68.890 26.768 1.00 0.00 O ATOM 73874 H1 WAT 1049 81.253 69.714 26.348 1.00 0.00 H ATOM 73875 H2 WAT 1049 80.816 68.274 26.508 1.00 0.00 H TER 73877 WAT 1049 ATOM 73877 O WAT 1050 123.841 90.897 87.882 1.00 0.00 O ATOM 73878 H1 WAT 1050 122.920 91.018 87.652 1.00 0.00 H ATOM 73879 H2 WAT 1050 123.882 91.093 88.818 1.00 0.00 H TER 73881 WAT 1050 ATOM 73881 O WAT 1051 61.936 55.445 16.201 1.00 0.00 O ATOM 73882 H1 WAT 1051 62.100 56.338 16.506 1.00 0.00 H ATOM 73883 H2 WAT 1051 61.608 54.984 16.973 1.00 0.00 H TER 73885 WAT 1051 ATOM 73885 O WAT 1052 90.188 132.269 100.647 1.00 0.00 O ATOM 73886 H1 WAT 1052 90.165 131.364 100.960 1.00 0.00 H ATOM 73887 H2 WAT 1052 90.103 132.799 101.439 1.00 0.00 H TER 73889 WAT 1052 ATOM 73889 O WAT 1053 15.992 145.354 117.945 1.00 0.00 O ATOM 73890 H1 WAT 1053 15.135 145.775 118.010 1.00 0.00 H ATOM 73891 H2 WAT 1053 16.058 144.822 118.739 1.00 0.00 H TER 73893 WAT 1053 ATOM 73893 O WAT 1054 54.493 11.372 67.239 1.00 0.00 O ATOM 73894 H1 WAT 1054 53.808 10.843 66.830 1.00 0.00 H ATOM 73895 H2 WAT 1054 54.171 12.271 67.177 1.00 0.00 H TER 73897 WAT 1054 ATOM 73897 O WAT 1055 135.836 138.112 18.417 1.00 0.00 O ATOM 73898 H1 WAT 1055 135.864 138.359 19.342 1.00 0.00 H ATOM 73899 H2 WAT 1055 136.699 138.351 18.079 1.00 0.00 H TER 73901 WAT 1055 ATOM 73901 O WAT 1056 128.668 85.421 134.532 1.00 0.00 O ATOM 73902 H1 WAT 1056 129.518 85.451 134.971 1.00 0.00 H ATOM 73903 H2 WAT 1056 128.047 85.730 135.192 1.00 0.00 H TER 73905 WAT 1056 ATOM 73905 O WAT 1057 115.846 85.159 1.579 1.00 0.00 O ATOM 73906 H1 WAT 1057 116.072 86.088 1.519 1.00 0.00 H ATOM 73907 H2 WAT 1057 115.471 84.948 0.724 1.00 0.00 H TER 73909 WAT 1057 ATOM 73909 O WAT 1058 116.286 136.749 6.983 1.00 0.00 O ATOM 73910 H1 WAT 1058 116.798 137.482 7.323 1.00 0.00 H ATOM 73911 H2 WAT 1058 115.380 136.969 7.201 1.00 0.00 H TER 73913 WAT 1058 ATOM 73913 O WAT 1059 104.213 106.039 113.017 1.00 0.00 O ATOM 73914 H1 WAT 1059 103.261 106.135 113.015 1.00 0.00 H ATOM 73915 H2 WAT 1059 104.474 106.215 112.113 1.00 0.00 H TER 73917 WAT 1059 ATOM 73917 O WAT 1060 34.158 117.453 8.418 1.00 0.00 O ATOM 73918 H1 WAT 1060 34.718 117.772 7.710 1.00 0.00 H ATOM 73919 H2 WAT 1060 34.110 116.508 8.278 1.00 0.00 H TER 73921 WAT 1060 ATOM 73921 O WAT 1061 133.595 31.005 115.263 1.00 0.00 O ATOM 73922 H1 WAT 1061 134.503 30.704 115.277 1.00 0.00 H ATOM 73923 H2 WAT 1061 133.624 31.873 115.665 1.00 0.00 H TER 73925 WAT 1061 ATOM 73925 O WAT 1062 110.199 87.435 114.457 1.00 0.00 O ATOM 73926 H1 WAT 1062 110.480 87.820 113.627 1.00 0.00 H ATOM 73927 H2 WAT 1062 111.004 87.095 114.848 1.00 0.00 H TER 73929 WAT 1062 ATOM 73929 O WAT 1063 71.727 134.348 5.077 1.00 0.00 O ATOM 73930 H1 WAT 1063 71.326 133.945 5.847 1.00 0.00 H ATOM 73931 H2 WAT 1063 71.861 133.621 4.469 1.00 0.00 H TER 73933 WAT 1063 ATOM 73933 O WAT 1064 118.769 40.277 96.800 1.00 0.00 O ATOM 73934 H1 WAT 1064 118.219 39.684 97.312 1.00 0.00 H ATOM 73935 H2 WAT 1064 118.494 41.153 97.071 1.00 0.00 H TER 73937 WAT 1064 ATOM 73937 O WAT 1065 43.035 27.844 70.842 1.00 0.00 O ATOM 73938 H1 WAT 1065 42.701 27.149 71.410 1.00 0.00 H ATOM 73939 H2 WAT 1065 42.281 28.104 70.313 1.00 0.00 H TER 73941 WAT 1065 ATOM 73941 O WAT 1066 51.044 27.973 101.023 1.00 0.00 O ATOM 73942 H1 WAT 1066 51.343 28.540 101.734 1.00 0.00 H ATOM 73943 H2 WAT 1066 50.127 28.215 100.894 1.00 0.00 H TER 73945 WAT 1066 ATOM 73945 O WAT 1067 35.815 49.156 98.389 1.00 0.00 O ATOM 73946 H1 WAT 1067 36.209 49.697 99.074 1.00 0.00 H ATOM 73947 H2 WAT 1067 35.375 49.782 97.813 1.00 0.00 H TER 73949 WAT 1067 ATOM 73949 O WAT 1068 130.290 63.170 77.203 1.00 0.00 O ATOM 73950 H1 WAT 1068 129.465 63.392 76.770 1.00 0.00 H ATOM 73951 H2 WAT 1068 130.107 63.278 78.136 1.00 0.00 H TER 73953 WAT 1068 ATOM 73953 O WAT 1069 120.647 39.191 69.748 1.00 0.00 O ATOM 73954 H1 WAT 1069 120.262 39.852 69.172 1.00 0.00 H ATOM 73955 H2 WAT 1069 120.996 38.529 69.152 1.00 0.00 H TER 73957 WAT 1069 ATOM 73957 O WAT 1070 134.588 39.126 20.906 1.00 0.00 O ATOM 73958 H1 WAT 1070 135.027 38.453 20.385 1.00 0.00 H ATOM 73959 H2 WAT 1070 134.171 39.696 20.260 1.00 0.00 H TER 73961 WAT 1070 ATOM 73961 O WAT 1071 132.830 87.525 136.662 1.00 0.00 O ATOM 73962 H1 WAT 1071 133.283 87.186 137.433 1.00 0.00 H ATOM 73963 H2 WAT 1071 132.010 87.882 137.003 1.00 0.00 H TER 73965 WAT 1071 ATOM 73965 O WAT 1072 14.332 70.076 115.193 1.00 0.00 O ATOM 73966 H1 WAT 1072 14.201 70.911 115.642 1.00 0.00 H ATOM 73967 H2 WAT 1072 14.486 70.317 114.279 1.00 0.00 H TER 73969 WAT 1072 ATOM 73969 O WAT 1073 120.939 12.687 127.878 1.00 0.00 O ATOM 73970 H1 WAT 1073 121.672 12.891 128.459 1.00 0.00 H ATOM 73971 H2 WAT 1073 120.761 13.508 127.419 1.00 0.00 H TER 73973 WAT 1073 ATOM 73973 O WAT 1074 141.432 137.036 64.269 1.00 0.00 O ATOM 73974 H1 WAT 1074 141.417 137.849 63.763 1.00 0.00 H ATOM 73975 H2 WAT 1074 141.396 136.343 63.609 1.00 0.00 H TER 73977 WAT 1074 ATOM 73977 O WAT 1075 87.691 9.697 88.462 1.00 0.00 O ATOM 73978 H1 WAT 1075 87.735 9.199 87.646 1.00 0.00 H ATOM 73979 H2 WAT 1075 87.154 9.157 89.043 1.00 0.00 H TER 73981 WAT 1075 ATOM 73981 O WAT 1076 48.432 69.070 115.093 1.00 0.00 O ATOM 73982 H1 WAT 1076 48.098 68.224 115.392 1.00 0.00 H ATOM 73983 H2 WAT 1076 48.527 68.969 114.146 1.00 0.00 H TER 73985 WAT 1076 ATOM 73985 O WAT 1077 31.217 74.146 143.817 1.00 0.00 O ATOM 73986 H1 WAT 1077 30.744 73.479 144.314 1.00 0.00 H ATOM 73987 H2 WAT 1077 31.002 74.969 144.257 1.00 0.00 H TER 73989 WAT 1077 ATOM 73989 O WAT 1078 29.987 50.717 107.092 1.00 0.00 O ATOM 73990 H1 WAT 1078 29.988 50.696 108.049 1.00 0.00 H ATOM 73991 H2 WAT 1078 30.609 51.409 106.867 1.00 0.00 H TER 73993 WAT 1078 ATOM 73993 O WAT 1079 28.046 66.340 69.086 1.00 0.00 O ATOM 73994 H1 WAT 1079 27.118 66.114 69.025 1.00 0.00 H ATOM 73995 H2 WAT 1079 28.060 67.297 69.083 1.00 0.00 H TER 73997 WAT 1079 ATOM 73997 O WAT 1080 -0.145 105.218 135.500 1.00 0.00 O ATOM 73998 H1 WAT 1080 0.032 104.308 135.262 1.00 0.00 H ATOM 73999 H2 WAT 1080 0.416 105.380 136.259 1.00 0.00 H TER 74001 WAT 1080 ATOM 74001 O WAT 1081 24.353 53.704 10.782 1.00 0.00 O ATOM 74002 H1 WAT 1081 23.755 53.214 11.346 1.00 0.00 H ATOM 74003 H2 WAT 1081 24.452 53.155 10.004 1.00 0.00 H TER 74005 WAT 1081 ATOM 74005 O WAT 1082 85.813 107.283 10.609 1.00 0.00 O ATOM 74006 H1 WAT 1082 85.203 106.557 10.477 1.00 0.00 H ATOM 74007 H2 WAT 1082 86.678 106.893 10.486 1.00 0.00 H TER 74009 WAT 1082 ATOM 74009 O WAT 1083 45.295 49.608 104.599 1.00 0.00 O ATOM 74010 H1 WAT 1083 44.583 49.264 104.059 1.00 0.00 H ATOM 74011 H2 WAT 1083 45.837 50.108 103.989 1.00 0.00 H TER 74013 WAT 1083 ATOM 74013 O WAT 1084 96.172 99.946 116.973 1.00 0.00 O ATOM 74014 H1 WAT 1084 95.601 99.178 116.967 1.00 0.00 H ATOM 74015 H2 WAT 1084 96.913 99.697 116.420 1.00 0.00 H TER 74017 WAT 1084 ATOM 74017 O WAT 1085 14.098 63.237 12.652 1.00 0.00 O ATOM 74018 H1 WAT 1085 13.566 63.460 13.416 1.00 0.00 H ATOM 74019 H2 WAT 1085 14.925 62.924 13.019 1.00 0.00 H TER 74021 WAT 1085 ATOM 74021 O WAT 1086 50.011 76.424 91.396 1.00 0.00 O ATOM 74022 H1 WAT 1086 49.884 76.460 90.448 1.00 0.00 H ATOM 74023 H2 WAT 1086 49.252 75.942 91.722 1.00 0.00 H TER 74025 WAT 1086 ATOM 74025 O WAT 1087 120.855 11.070 125.530 1.00 0.00 O ATOM 74026 H1 WAT 1087 121.178 11.468 126.339 1.00 0.00 H ATOM 74027 H2 WAT 1087 121.647 10.851 125.039 1.00 0.00 H TER 74029 WAT 1087 ATOM 74029 O WAT 1088 36.664 15.107 92.939 1.00 0.00 O ATOM 74030 H1 WAT 1088 37.605 15.283 92.918 1.00 0.00 H ATOM 74031 H2 WAT 1088 36.594 14.161 92.815 1.00 0.00 H TER 74033 WAT 1088 ATOM 74033 O WAT 1089 33.220 20.731 137.828 1.00 0.00 O ATOM 74034 H1 WAT 1089 33.754 19.945 137.939 1.00 0.00 H ATOM 74035 H2 WAT 1089 32.480 20.444 137.293 1.00 0.00 H TER 74037 WAT 1089 ATOM 74037 O WAT 1090 63.838 12.941 68.364 1.00 0.00 O ATOM 74038 H1 WAT 1090 64.006 12.667 69.266 1.00 0.00 H ATOM 74039 H2 WAT 1090 63.595 12.134 67.910 1.00 0.00 H TER 74041 WAT 1090 ATOM 74041 O WAT 1091 99.090 45.406 96.891 1.00 0.00 O ATOM 74042 H1 WAT 1091 98.248 45.631 96.494 1.00 0.00 H ATOM 74043 H2 WAT 1091 99.494 46.251 97.089 1.00 0.00 H TER 74045 WAT 1091 ATOM 74045 O WAT 1092 1.840 41.078 129.756 1.00 0.00 O ATOM 74046 H1 WAT 1092 2.182 40.484 129.088 1.00 0.00 H ATOM 74047 H2 WAT 1092 2.618 41.487 130.135 1.00 0.00 H TER 74049 WAT 1092 ATOM 74049 O WAT 1093 72.349 106.595 71.943 1.00 0.00 O ATOM 74050 H1 WAT 1093 72.649 106.143 72.732 1.00 0.00 H ATOM 74051 H2 WAT 1093 72.753 106.113 71.222 1.00 0.00 H TER 74053 WAT 1093 ATOM 74053 O WAT 1094 60.516 34.287 130.108 1.00 0.00 O ATOM 74054 H1 WAT 1094 59.988 33.564 129.770 1.00 0.00 H ATOM 74055 H2 WAT 1094 60.003 34.637 130.837 1.00 0.00 H TER 74057 WAT 1094 ATOM 74057 O WAT 1095 128.784 127.854 97.105 1.00 0.00 O ATOM 74058 H1 WAT 1095 128.304 127.641 97.905 1.00 0.00 H ATOM 74059 H2 WAT 1095 128.271 127.452 96.404 1.00 0.00 H TER 74061 WAT 1095 ATOM 74061 O WAT 1096 38.749 20.756 100.427 1.00 0.00 O ATOM 74062 H1 WAT 1096 39.082 19.859 100.393 1.00 0.00 H ATOM 74063 H2 WAT 1096 37.905 20.715 99.978 1.00 0.00 H TER 74065 WAT 1096 ATOM 74065 O WAT 1097 68.861 46.657 117.468 1.00 0.00 O ATOM 74066 H1 WAT 1097 68.678 47.284 116.768 1.00 0.00 H ATOM 74067 H2 WAT 1097 68.937 47.194 118.257 1.00 0.00 H TER 74069 WAT 1097 ATOM 74069 O WAT 1098 26.875 64.052 91.082 1.00 0.00 O ATOM 74070 H1 WAT 1098 26.807 64.751 90.433 1.00 0.00 H ATOM 74071 H2 WAT 1098 25.971 63.780 91.238 1.00 0.00 H TER 74073 WAT 1098 ATOM 74073 O WAT 1099 3.429 110.563 148.629 1.00 0.00 O ATOM 74074 H1 WAT 1099 3.279 111.273 148.004 1.00 0.00 H ATOM 74075 H2 WAT 1099 2.934 110.821 149.407 1.00 0.00 H TER 74077 WAT 1099 ATOM 74077 O WAT 1100 28.064 53.650 64.649 1.00 0.00 O ATOM 74078 H1 WAT 1100 28.077 52.693 64.672 1.00 0.00 H ATOM 74079 H2 WAT 1100 28.345 53.915 65.524 1.00 0.00 H TER 74081 WAT 1100 ATOM 74081 O WAT 1101 38.018 34.882 22.717 1.00 0.00 O ATOM 74082 H1 WAT 1101 37.281 34.482 22.255 1.00 0.00 H ATOM 74083 H2 WAT 1101 38.777 34.363 22.452 1.00 0.00 H TER 74085 WAT 1101 ATOM 74085 O WAT 1102 46.068 121.979 119.433 1.00 0.00 O ATOM 74086 H1 WAT 1102 45.268 121.490 119.237 1.00 0.00 H ATOM 74087 H2 WAT 1102 46.325 121.679 120.305 1.00 0.00 H TER 74089 WAT 1102 ATOM 74089 O WAT 1103 56.457 72.800 131.637 1.00 0.00 O ATOM 74090 H1 WAT 1103 57.280 72.587 132.077 1.00 0.00 H ATOM 74091 H2 WAT 1103 56.027 71.954 131.512 1.00 0.00 H TER 74093 WAT 1103 ATOM 74093 O WAT 1104 45.197 11.338 139.695 1.00 0.00 O ATOM 74094 H1 WAT 1104 44.635 12.096 139.538 1.00 0.00 H ATOM 74095 H2 WAT 1104 45.741 11.592 140.441 1.00 0.00 H TER 74097 WAT 1104 ATOM 74097 O WAT 1105 69.991 81.160 78.575 1.00 0.00 O ATOM 74098 H1 WAT 1105 69.406 81.555 79.221 1.00 0.00 H ATOM 74099 H2 WAT 1105 69.901 80.217 78.716 1.00 0.00 H TER 74101 WAT 1105 ATOM 74101 O WAT 1106 132.433 12.380 138.335 1.00 0.00 O ATOM 74102 H1 WAT 1106 132.709 13.216 138.710 1.00 0.00 H ATOM 74103 H2 WAT 1106 131.595 12.571 137.914 1.00 0.00 H TER 74105 WAT 1106 ATOM 74105 O WAT 1107 132.774 46.482 130.400 1.00 0.00 O ATOM 74106 H1 WAT 1107 132.542 47.036 131.145 1.00 0.00 H ATOM 74107 H2 WAT 1107 132.156 45.752 130.442 1.00 0.00 H TER 74109 WAT 1107 ATOM 74109 O WAT 1108 70.950 80.191 119.733 1.00 0.00 O ATOM 74110 H1 WAT 1108 71.786 79.803 119.474 1.00 0.00 H ATOM 74111 H2 WAT 1108 70.387 80.080 118.966 1.00 0.00 H TER 74113 WAT 1108 ATOM 74113 O WAT 1109 37.883 47.876 126.129 1.00 0.00 O ATOM 74114 H1 WAT 1109 37.674 47.858 127.063 1.00 0.00 H ATOM 74115 H2 WAT 1109 37.470 47.088 125.775 1.00 0.00 H TER 74117 WAT 1109 ATOM 74117 O WAT 1110 5.708 129.953 14.764 1.00 0.00 O ATOM 74118 H1 WAT 1110 6.262 129.392 14.220 1.00 0.00 H ATOM 74119 H2 WAT 1110 6.324 130.441 15.310 1.00 0.00 H TER 74121 WAT 1110 ATOM 74121 O WAT 1111 32.038 91.493 12.028 1.00 0.00 O ATOM 74122 H1 WAT 1111 31.292 91.355 11.445 1.00 0.00 H ATOM 74123 H2 WAT 1111 31.690 92.031 12.739 1.00 0.00 H TER 74125 WAT 1111 ATOM 74125 O WAT 1112 126.669 38.890 119.820 1.00 0.00 O ATOM 74126 H1 WAT 1112 127.196 39.187 120.562 1.00 0.00 H ATOM 74127 H2 WAT 1112 125.805 38.717 120.193 1.00 0.00 H TER 74129 WAT 1112 ATOM 74129 O WAT 1113 27.642 126.435 1.018 1.00 0.00 O ATOM 74130 H1 WAT 1113 27.546 125.485 0.946 1.00 0.00 H ATOM 74131 H2 WAT 1113 28.114 126.689 0.225 1.00 0.00 H TER 74133 WAT 1113 ATOM 74133 O WAT 1114 60.474 11.906 147.258 1.00 0.00 O ATOM 74134 H1 WAT 1114 60.931 11.066 147.220 1.00 0.00 H ATOM 74135 H2 WAT 1114 60.547 12.260 146.372 1.00 0.00 H TER 74137 WAT 1114 ATOM 74137 O WAT 1115 141.508 47.681 80.908 1.00 0.00 O ATOM 74138 H1 WAT 1115 141.887 47.517 80.045 1.00 0.00 H ATOM 74139 H2 WAT 1115 140.620 47.989 80.724 1.00 0.00 H TER 74141 WAT 1115 ATOM 74141 O WAT 1116 137.148 38.332 62.691 1.00 0.00 O ATOM 74142 H1 WAT 1116 136.684 38.622 63.476 1.00 0.00 H ATOM 74143 H2 WAT 1116 136.884 38.955 62.013 1.00 0.00 H TER 74145 WAT 1116 ATOM 74145 O WAT 1117 143.484 52.865 19.441 1.00 0.00 O ATOM 74146 H1 WAT 1117 142.989 52.280 20.014 1.00 0.00 H ATOM 74147 H2 WAT 1117 144.400 52.636 19.598 1.00 0.00 H TER 74149 WAT 1117 ATOM 74149 O WAT 1118 26.936 28.030 118.996 1.00 0.00 O ATOM 74150 H1 WAT 1118 27.111 27.097 119.118 1.00 0.00 H ATOM 74151 H2 WAT 1118 25.986 28.108 119.077 1.00 0.00 H TER 74153 WAT 1118 ATOM 74153 O WAT 1119 0.706 58.781 92.838 1.00 0.00 O ATOM 74154 H1 WAT 1119 0.121 58.598 93.573 1.00 0.00 H ATOM 74155 H2 WAT 1119 1.489 58.261 93.020 1.00 0.00 H TER 74157 WAT 1119 ATOM 74157 O WAT 1120 43.705 86.362 56.650 1.00 0.00 O ATOM 74158 H1 WAT 1120 43.528 87.184 57.108 1.00 0.00 H ATOM 74159 H2 WAT 1120 43.697 86.598 55.723 1.00 0.00 H TER 74161 WAT 1120 ATOM 74161 O WAT 1121 77.646 105.211 118.306 1.00 0.00 O ATOM 74162 H1 WAT 1121 77.816 106.081 117.946 1.00 0.00 H ATOM 74163 H2 WAT 1121 77.640 105.341 119.254 1.00 0.00 H TER 74165 WAT 1121 ATOM 74165 O WAT 1122 101.712 112.084 121.519 1.00 0.00 O ATOM 74166 H1 WAT 1122 101.571 112.021 120.575 1.00 0.00 H ATOM 74167 H2 WAT 1122 102.448 111.496 121.691 1.00 0.00 H TER 74169 WAT 1122 ATOM 74169 O WAT 1123 92.803 9.836 9.428 1.00 0.00 O ATOM 74170 H1 WAT 1123 93.108 10.699 9.148 1.00 0.00 H ATOM 74171 H2 WAT 1123 93.410 9.582 10.123 1.00 0.00 H TER 74173 WAT 1123 ATOM 74173 O WAT 1124 28.950 30.992 127.362 1.00 0.00 O ATOM 74174 H1 WAT 1124 28.550 31.635 127.946 1.00 0.00 H ATOM 74175 H2 WAT 1124 29.888 31.174 127.411 1.00 0.00 H TER 74177 WAT 1124 ATOM 74177 O WAT 1125 65.905 55.318 70.073 1.00 0.00 O ATOM 74178 H1 WAT 1125 66.367 56.133 69.879 1.00 0.00 H ATOM 74179 H2 WAT 1125 65.938 55.245 71.027 1.00 0.00 H TER 74181 WAT 1125 ATOM 74181 O WAT 1126 53.239 112.020 13.834 1.00 0.00 O ATOM 74182 H1 WAT 1126 52.812 111.658 14.611 1.00 0.00 H ATOM 74183 H2 WAT 1126 53.544 112.884 14.110 1.00 0.00 H TER 74185 WAT 1126 ATOM 74185 O WAT 1127 110.462 131.570 109.528 1.00 0.00 O ATOM 74186 H1 WAT 1127 111.397 131.636 109.337 1.00 0.00 H ATOM 74187 H2 WAT 1127 110.111 131.024 108.825 1.00 0.00 H TER 74189 WAT 1127 ATOM 74189 O WAT 1128 78.052 29.547 143.851 1.00 0.00 O ATOM 74190 H1 WAT 1128 78.576 29.849 144.593 1.00 0.00 H ATOM 74191 H2 WAT 1128 78.199 30.203 143.170 1.00 0.00 H TER 74193 WAT 1128 ATOM 74193 O WAT 1129 140.533 56.817 92.984 1.00 0.00 O ATOM 74194 H1 WAT 1129 139.828 57.429 92.773 1.00 0.00 H ATOM 74195 H2 WAT 1129 140.682 56.334 92.172 1.00 0.00 H TER 74197 WAT 1129 ATOM 74197 O WAT 1130 36.850 57.846 124.603 1.00 0.00 O ATOM 74198 H1 WAT 1130 37.331 57.939 125.426 1.00 0.00 H ATOM 74199 H2 WAT 1130 36.686 56.907 124.526 1.00 0.00 H TER 74201 WAT 1130 ATOM 74201 O WAT 1131 62.265 74.909 119.801 1.00 0.00 O ATOM 74202 H1 WAT 1131 62.633 74.281 120.423 1.00 0.00 H ATOM 74203 H2 WAT 1131 62.356 74.482 118.948 1.00 0.00 H TER 74205 WAT 1131 ATOM 74205 O WAT 1132 3.065 136.987 4.397 1.00 0.00 O ATOM 74206 H1 WAT 1132 3.443 137.860 4.293 1.00 0.00 H ATOM 74207 H2 WAT 1132 2.134 137.146 4.554 1.00 0.00 H TER 74209 WAT 1132 ATOM 74209 O WAT 1133 96.493 105.016 9.371 1.00 0.00 O ATOM 74210 H1 WAT 1133 96.911 105.040 10.232 1.00 0.00 H ATOM 74211 H2 WAT 1133 96.947 105.689 8.865 1.00 0.00 H TER 74213 WAT 1133 ATOM 74213 O WAT 1134 9.144 24.446 138.452 1.00 0.00 O ATOM 74214 H1 WAT 1134 8.886 25.366 138.397 1.00 0.00 H ATOM 74215 H2 WAT 1134 9.852 24.434 139.097 1.00 0.00 H TER 74217 WAT 1134 ATOM 74217 O WAT 1135 61.064 91.625 95.135 1.00 0.00 O ATOM 74218 H1 WAT 1135 61.416 90.778 94.860 1.00 0.00 H ATOM 74219 H2 WAT 1135 61.710 92.263 94.831 1.00 0.00 H TER 74221 WAT 1135 ATOM 74221 O WAT 1136 51.285 115.406 4.518 1.00 0.00 O ATOM 74222 H1 WAT 1136 52.189 115.546 4.800 1.00 0.00 H ATOM 74223 H2 WAT 1136 51.258 114.488 4.249 1.00 0.00 H TER 74225 WAT 1136 ATOM 74225 O WAT 1137 145.707 122.745 81.035 1.00 0.00 O ATOM 74226 H1 WAT 1137 145.652 123.305 80.261 1.00 0.00 H ATOM 74227 H2 WAT 1137 145.988 123.332 81.736 1.00 0.00 H TER 74229 WAT 1137 ATOM 74229 O WAT 1138 69.191 137.838 133.133 1.00 0.00 O ATOM 74230 H1 WAT 1138 68.715 138.588 133.490 1.00 0.00 H ATOM 74231 H2 WAT 1138 69.367 138.078 132.223 1.00 0.00 H TER 74233 WAT 1138 ATOM 74233 O WAT 1139 90.014 65.905 148.738 1.00 0.00 O ATOM 74234 H1 WAT 1139 90.731 66.125 149.333 1.00 0.00 H ATOM 74235 H2 WAT 1139 89.816 66.726 148.287 1.00 0.00 H TER 74237 WAT 1139 ATOM 74237 O WAT 1140 58.456 54.528 64.188 1.00 0.00 O ATOM 74238 H1 WAT 1140 59.191 54.748 64.760 1.00 0.00 H ATOM 74239 H2 WAT 1140 58.761 54.750 63.309 1.00 0.00 H TER 74241 WAT 1140 ATOM 74241 O WAT 1141 72.486 17.116 110.211 1.00 0.00 O ATOM 74242 H1 WAT 1141 72.955 16.430 109.736 1.00 0.00 H ATOM 74243 H2 WAT 1141 72.783 17.932 109.809 1.00 0.00 H TER 74245 WAT 1141 ATOM 74245 O WAT 1142 96.079 39.893 126.727 1.00 0.00 O ATOM 74246 H1 WAT 1142 96.070 39.797 125.775 1.00 0.00 H ATOM 74247 H2 WAT 1142 96.872 39.436 127.006 1.00 0.00 H TER 74249 WAT 1142 ATOM 74249 O WAT 1143 99.469 77.858 60.213 1.00 0.00 O ATOM 74250 H1 WAT 1143 99.582 78.164 61.112 1.00 0.00 H ATOM 74251 H2 WAT 1143 99.915 78.515 59.678 1.00 0.00 H TER 74253 WAT 1143 ATOM 74253 O WAT 1144 107.503 119.632 66.847 1.00 0.00 O ATOM 74254 H1 WAT 1144 107.170 119.157 67.608 1.00 0.00 H ATOM 74255 H2 WAT 1144 107.098 120.497 66.908 1.00 0.00 H TER 74257 WAT 1144 ATOM 74257 O WAT 1145 77.088 14.895 86.473 1.00 0.00 O ATOM 74258 H1 WAT 1145 77.214 13.950 86.391 1.00 0.00 H ATOM 74259 H2 WAT 1145 76.899 15.190 85.583 1.00 0.00 H TER 74261 WAT 1145 ATOM 74261 O WAT 1146 105.452 77.362 135.975 1.00 0.00 O ATOM 74262 H1 WAT 1146 105.146 77.094 136.842 1.00 0.00 H ATOM 74263 H2 WAT 1146 104.651 77.467 135.461 1.00 0.00 H TER 74265 WAT 1146 ATOM 74265 O WAT 1147 10.873 72.334 88.585 1.00 0.00 O ATOM 74266 H1 WAT 1147 10.635 71.462 88.899 1.00 0.00 H ATOM 74267 H2 WAT 1147 10.209 72.913 88.960 1.00 0.00 H TER 74269 WAT 1147 ATOM 74269 O WAT 1148 85.554 145.275 81.669 1.00 0.00 O ATOM 74270 H1 WAT 1148 85.661 145.945 82.345 1.00 0.00 H ATOM 74271 H2 WAT 1148 85.432 145.770 80.859 1.00 0.00 H TER 74273 WAT 1148 ATOM 74273 O WAT 1149 57.753 67.567 63.436 1.00 0.00 O ATOM 74274 H1 WAT 1149 58.064 67.742 62.547 1.00 0.00 H ATOM 74275 H2 WAT 1149 58.321 68.096 63.997 1.00 0.00 H TER 74277 WAT 1149 ATOM 74277 O WAT 1150 83.181 14.965 134.089 1.00 0.00 O ATOM 74278 H1 WAT 1150 82.852 15.706 134.599 1.00 0.00 H ATOM 74279 H2 WAT 1150 84.064 15.228 133.828 1.00 0.00 H TER 74281 WAT 1150 ATOM 74281 O WAT 1151 49.159 135.814 5.582 1.00 0.00 O ATOM 74282 H1 WAT 1151 48.270 135.612 5.289 1.00 0.00 H ATOM 74283 H2 WAT 1151 49.674 135.046 5.334 1.00 0.00 H TER 74285 WAT 1151 ATOM 74285 O WAT 1152 80.358 80.624 117.099 1.00 0.00 O ATOM 74286 H1 WAT 1152 79.915 81.471 117.151 1.00 0.00 H ATOM 74287 H2 WAT 1152 81.276 80.823 117.281 1.00 0.00 H TER 74289 WAT 1152 ATOM 74289 O WAT 1153 138.519 23.768 115.809 1.00 0.00 O ATOM 74290 H1 WAT 1153 139.368 23.459 115.493 1.00 0.00 H ATOM 74291 H2 WAT 1153 138.275 24.464 115.200 1.00 0.00 H TER 74293 WAT 1153 ATOM 74293 O WAT 1154 20.040 62.962 78.030 1.00 0.00 O ATOM 74294 H1 WAT 1154 19.415 63.508 77.553 1.00 0.00 H ATOM 74295 H2 WAT 1154 20.843 63.482 78.052 1.00 0.00 H TER 74297 WAT 1154 ATOM 74297 O WAT 1155 65.842 11.959 84.764 1.00 0.00 O ATOM 74298 H1 WAT 1155 64.893 12.038 84.863 1.00 0.00 H ATOM 74299 H2 WAT 1155 66.200 12.637 85.336 1.00 0.00 H TER 74301 WAT 1155 ATOM 74301 O WAT 1156 41.823 76.682 85.943 1.00 0.00 O ATOM 74302 H1 WAT 1156 42.299 77.400 85.524 1.00 0.00 H ATOM 74303 H2 WAT 1156 42.435 75.946 85.924 1.00 0.00 H TER 74305 WAT 1156 ATOM 74305 O WAT 1157 29.085 11.721 55.437 1.00 0.00 O ATOM 74306 H1 WAT 1157 29.578 10.916 55.594 1.00 0.00 H ATOM 74307 H2 WAT 1157 28.180 11.493 55.650 1.00 0.00 H TER 74309 WAT 1157 ATOM 74309 O WAT 1158 66.894 32.259 67.767 1.00 0.00 O ATOM 74310 H1 WAT 1158 67.835 32.159 67.911 1.00 0.00 H ATOM 74311 H2 WAT 1158 66.756 33.206 67.738 1.00 0.00 H TER 74313 WAT 1158 ATOM 74313 O WAT 1159 138.721 112.865 102.218 1.00 0.00 O ATOM 74314 H1 WAT 1159 139.387 112.726 101.544 1.00 0.00 H ATOM 74315 H2 WAT 1159 138.398 111.987 102.420 1.00 0.00 H TER 74317 WAT 1159 ATOM 74317 O WAT 1160 26.764 90.672 130.509 1.00 0.00 O ATOM 74318 H1 WAT 1160 25.891 90.850 130.158 1.00 0.00 H ATOM 74319 H2 WAT 1160 26.766 91.087 131.371 1.00 0.00 H TER 74321 WAT 1160 ATOM 74321 O WAT 1161 85.348 56.974 102.303 1.00 0.00 O ATOM 74322 H1 WAT 1161 84.575 56.610 102.733 1.00 0.00 H ATOM 74323 H2 WAT 1161 86.062 56.390 102.559 1.00 0.00 H TER 74325 WAT 1161 ATOM 74325 O WAT 1162 136.816 92.807 28.882 1.00 0.00 O ATOM 74326 H1 WAT 1162 136.607 93.511 28.268 1.00 0.00 H ATOM 74327 H2 WAT 1162 136.047 92.237 28.863 1.00 0.00 H TER 74329 WAT 1162 ATOM 74329 O WAT 1163 58.799 28.703 119.966 1.00 0.00 O ATOM 74330 H1 WAT 1163 58.981 29.284 119.228 1.00 0.00 H ATOM 74331 H2 WAT 1163 57.955 28.304 119.754 1.00 0.00 H TER 74333 WAT 1163 ATOM 74333 O WAT 1164 64.539 65.207 15.863 1.00 0.00 O ATOM 74334 H1 WAT 1164 64.327 66.133 15.976 1.00 0.00 H ATOM 74335 H2 WAT 1164 63.689 64.768 15.837 1.00 0.00 H TER 74337 WAT 1164 ATOM 74337 O WAT 1165 2.371 33.530 106.592 1.00 0.00 O ATOM 74338 H1 WAT 1165 3.299 33.355 106.750 1.00 0.00 H ATOM 74339 H2 WAT 1165 2.015 32.690 106.304 1.00 0.00 H TER 74341 WAT 1165 ATOM 74341 O WAT 1166 90.717 115.159 137.611 1.00 0.00 O ATOM 74342 H1 WAT 1166 91.654 115.208 137.800 1.00 0.00 H ATOM 74343 H2 WAT 1166 90.481 114.252 137.806 1.00 0.00 H TER 74345 WAT 1166 ATOM 74345 O WAT 1167 55.374 57.439 71.752 1.00 0.00 O ATOM 74346 H1 WAT 1167 55.117 56.550 71.994 1.00 0.00 H ATOM 74347 H2 WAT 1167 54.606 57.974 71.953 1.00 0.00 H TER 74349 WAT 1167 ATOM 74349 O WAT 1168 118.301 63.502 152.714 1.00 0.00 O ATOM 74350 H1 WAT 1168 119.099 63.758 153.175 1.00 0.00 H ATOM 74351 H2 WAT 1168 118.582 62.816 152.109 1.00 0.00 H TER 74353 WAT 1168 ATOM 74353 O WAT 1169 3.085 21.777 16.654 1.00 0.00 O ATOM 74354 H1 WAT 1169 2.920 21.239 15.880 1.00 0.00 H ATOM 74355 H2 WAT 1169 3.640 21.231 17.211 1.00 0.00 H TER 74357 WAT 1169 ATOM 74357 O WAT 1170 129.840 89.338 92.020 1.00 0.00 O ATOM 74358 H1 WAT 1170 130.347 89.432 92.827 1.00 0.00 H ATOM 74359 H2 WAT 1170 130.363 88.749 91.476 1.00 0.00 H TER 74361 WAT 1170 ATOM 74361 O WAT 1171 122.102 16.797 59.906 1.00 0.00 O ATOM 74362 H1 WAT 1171 121.151 16.711 59.847 1.00 0.00 H ATOM 74363 H2 WAT 1171 122.342 17.331 59.148 1.00 0.00 H TER 74365 WAT 1171 ATOM 74365 O WAT 1172 59.839 24.155 108.421 1.00 0.00 O ATOM 74366 H1 WAT 1172 59.082 24.157 107.835 1.00 0.00 H ATOM 74367 H2 WAT 1172 59.599 23.549 109.121 1.00 0.00 H TER 74369 WAT 1172 ATOM 74369 O WAT 1173 14.848 111.497 158.464 1.00 0.00 O ATOM 74370 H1 WAT 1173 14.467 112.349 158.251 1.00 0.00 H ATOM 74371 H2 WAT 1173 15.742 111.698 158.744 1.00 0.00 H TER 74373 WAT 1173 ATOM 74373 O WAT 1174 45.271 6.329 146.261 1.00 0.00 O ATOM 74374 H1 WAT 1174 45.072 5.993 145.387 1.00 0.00 H ATOM 74375 H2 WAT 1174 45.427 7.264 146.129 1.00 0.00 H TER 74377 WAT 1174 ATOM 74377 O WAT 1175 72.265 142.197 78.711 1.00 0.00 O ATOM 74378 H1 WAT 1175 71.709 142.769 78.182 1.00 0.00 H ATOM 74379 H2 WAT 1175 72.371 142.665 79.539 1.00 0.00 H TER 74381 WAT 1175 ATOM 74381 O WAT 1176 30.847 102.414 116.212 1.00 0.00 O ATOM 74382 H1 WAT 1176 30.817 103.122 116.855 1.00 0.00 H ATOM 74383 H2 WAT 1176 31.351 102.775 115.482 1.00 0.00 H TER 74385 WAT 1176 ATOM 74385 O WAT 1177 116.935 34.033 157.872 1.00 0.00 O ATOM 74386 H1 WAT 1177 117.258 34.876 157.555 1.00 0.00 H ATOM 74387 H2 WAT 1177 116.597 33.596 157.090 1.00 0.00 H TER 74389 WAT 1177 ATOM 74389 O WAT 1178 65.977 2.991 17.428 1.00 0.00 O ATOM 74390 H1 WAT 1178 65.148 3.142 16.974 1.00 0.00 H ATOM 74391 H2 WAT 1178 66.554 3.686 17.112 1.00 0.00 H TER 74393 WAT 1178 ATOM 74393 O WAT 1179 89.706 32.332 78.768 1.00 0.00 O ATOM 74394 H1 WAT 1179 89.766 33.186 78.341 1.00 0.00 H ATOM 74395 H2 WAT 1179 89.387 32.527 79.649 1.00 0.00 H TER 74397 WAT 1179 ATOM 74397 O WAT 1180 98.963 106.454 16.544 1.00 0.00 O ATOM 74398 H1 WAT 1180 99.137 106.810 17.415 1.00 0.00 H ATOM 74399 H2 WAT 1180 99.761 106.635 16.047 1.00 0.00 H TER 74401 WAT 1180 ATOM 74401 O WAT 1181 105.158 26.496 132.699 1.00 0.00 O ATOM 74402 H1 WAT 1181 104.367 26.390 132.170 1.00 0.00 H ATOM 74403 H2 WAT 1181 105.105 27.391 133.033 1.00 0.00 H TER 74405 WAT 1181 ATOM 74405 O WAT 1182 80.736 70.844 150.944 1.00 0.00 O ATOM 74406 H1 WAT 1182 81.470 70.932 151.551 1.00 0.00 H ATOM 74407 H2 WAT 1182 80.636 71.715 150.560 1.00 0.00 H TER 74409 WAT 1182 ATOM 74409 O WAT 1183 92.102 133.777 99.122 1.00 0.00 O ATOM 74410 H1 WAT 1183 92.823 133.753 99.751 1.00 0.00 H ATOM 74411 H2 WAT 1183 91.380 133.336 99.568 1.00 0.00 H TER 74413 WAT 1183 ATOM 74413 O WAT 1184 33.548 74.297 89.960 1.00 0.00 O ATOM 74414 H1 WAT 1184 32.877 73.624 89.843 1.00 0.00 H ATOM 74415 H2 WAT 1184 33.781 74.560 89.069 1.00 0.00 H TER 74417 WAT 1184 ATOM 74417 O WAT 1185 71.269 49.469 111.755 1.00 0.00 O ATOM 74418 H1 WAT 1185 71.907 49.538 111.045 1.00 0.00 H ATOM 74419 H2 WAT 1185 71.684 48.890 112.394 1.00 0.00 H TER 74421 WAT 1185 ATOM 74421 O WAT 1186 121.187 3.786 117.433 1.00 0.00 O ATOM 74422 H1 WAT 1186 121.670 2.965 117.338 1.00 0.00 H ATOM 74423 H2 WAT 1186 120.351 3.528 117.822 1.00 0.00 H TER 74425 WAT 1186 ATOM 74425 O WAT 1187 16.535 116.966 19.734 1.00 0.00 O ATOM 74426 H1 WAT 1187 16.291 116.762 20.637 1.00 0.00 H ATOM 74427 H2 WAT 1187 17.070 116.222 19.457 1.00 0.00 H TER 74429 WAT 1187 ATOM 74429 O WAT 1188 29.160 80.305 148.909 1.00 0.00 O ATOM 74430 H1 WAT 1188 28.817 80.069 149.771 1.00 0.00 H ATOM 74431 H2 WAT 1188 30.106 80.367 149.036 1.00 0.00 H TER 74433 WAT 1188 ATOM 74433 O WAT 1189 113.057 49.246 151.441 1.00 0.00 O ATOM 74434 H1 WAT 1189 112.308 49.838 151.379 1.00 0.00 H ATOM 74435 H2 WAT 1189 112.743 48.422 151.068 1.00 0.00 H TER 74437 WAT 1189 ATOM 74437 O WAT 1190 34.969 37.163 68.405 1.00 0.00 O ATOM 74438 H1 WAT 1190 35.151 37.008 69.332 1.00 0.00 H ATOM 74439 H2 WAT 1190 35.776 36.908 67.957 1.00 0.00 H TER 74441 WAT 1190 ATOM 74441 O WAT 1191 105.640 9.634 82.014 1.00 0.00 O ATOM 74442 H1 WAT 1191 106.282 10.326 82.176 1.00 0.00 H ATOM 74443 H2 WAT 1191 104.796 10.086 82.018 1.00 0.00 H TER 74445 WAT 1191 ATOM 74445 O WAT 1192 80.326 111.080 93.413 1.00 0.00 O ATOM 74446 H1 WAT 1192 79.703 111.059 92.687 1.00 0.00 H ATOM 74447 H2 WAT 1192 80.943 110.374 93.221 1.00 0.00 H TER 74449 WAT 1192 ATOM 74449 O WAT 1193 47.766 32.712 98.171 1.00 0.00 O ATOM 74450 H1 WAT 1193 47.309 33.495 98.478 1.00 0.00 H ATOM 74451 H2 WAT 1193 47.959 32.893 97.251 1.00 0.00 H TER 74453 WAT 1193 ATOM 74453 O WAT 1194 143.736 16.068 156.993 1.00 0.00 O ATOM 74454 H1 WAT 1194 144.543 16.292 157.458 1.00 0.00 H ATOM 74455 H2 WAT 1194 143.057 16.092 157.668 1.00 0.00 H TER 74457 WAT 1194 ATOM 74457 O WAT 1195 114.166 133.506 144.329 1.00 0.00 O ATOM 74458 H1 WAT 1195 114.642 133.018 143.657 1.00 0.00 H ATOM 74459 H2 WAT 1195 114.365 133.046 145.145 1.00 0.00 H TER 74461 WAT 1195 ATOM 74461 O WAT 1196 94.110 114.517 28.404 1.00 0.00 O ATOM 74462 H1 WAT 1196 93.839 113.716 27.956 1.00 0.00 H ATOM 74463 H2 WAT 1196 94.532 114.211 29.208 1.00 0.00 H TER 74465 WAT 1196 ATOM 74465 O WAT 1197 107.424 10.425 111.853 1.00 0.00 O ATOM 74466 H1 WAT 1197 108.143 10.967 112.176 1.00 0.00 H ATOM 74467 H2 WAT 1197 106.794 10.408 112.573 1.00 0.00 H TER 74469 WAT 1197 ATOM 74469 O WAT 1198 141.655 48.250 74.118 1.00 0.00 O ATOM 74470 H1 WAT 1198 140.931 48.185 73.496 1.00 0.00 H ATOM 74471 H2 WAT 1198 141.284 47.958 74.950 1.00 0.00 H TER 74473 WAT 1198 ATOM 74473 O WAT 1199 128.325 30.550 124.857 1.00 0.00 O ATOM 74474 H1 WAT 1199 128.591 31.136 124.148 1.00 0.00 H ATOM 74475 H2 WAT 1199 127.992 31.134 125.538 1.00 0.00 H TER 74477 WAT 1199 ATOM 74477 O WAT 1200 99.121 28.677 136.047 1.00 0.00 O ATOM 74478 H1 WAT 1200 99.957 28.588 136.503 1.00 0.00 H ATOM 74479 H2 WAT 1200 98.850 29.579 136.218 1.00 0.00 H TER 74481 WAT 1200 ATOM 74481 O WAT 1201 81.106 69.730 74.844 1.00 0.00 O ATOM 74482 H1 WAT 1201 81.006 70.397 74.164 1.00 0.00 H ATOM 74483 H2 WAT 1201 81.205 68.910 74.361 1.00 0.00 H TER 74485 WAT 1201 ATOM 74485 O WAT 1202 101.447 2.617 0.968 1.00 0.00 O ATOM 74486 H1 WAT 1202 101.967 1.891 1.314 1.00 0.00 H ATOM 74487 H2 WAT 1202 101.978 3.395 1.140 1.00 0.00 H TER 74489 WAT 1202 ATOM 74489 O WAT 1203 126.984 73.112 84.373 1.00 0.00 O ATOM 74490 H1 WAT 1203 126.283 73.081 83.722 1.00 0.00 H ATOM 74491 H2 WAT 1203 127.335 74.000 84.304 1.00 0.00 H TER 74493 WAT 1203 ATOM 74493 O WAT 1204 103.062 114.486 69.194 1.00 0.00 O ATOM 74494 H1 WAT 1204 102.440 114.365 68.476 1.00 0.00 H ATOM 74495 H2 WAT 1204 102.765 115.279 69.638 1.00 0.00 H TER 74497 WAT 1204 ATOM 74497 O WAT 1205 131.692 37.149 85.038 1.00 0.00 O ATOM 74498 H1 WAT 1205 131.067 37.800 85.358 1.00 0.00 H ATOM 74499 H2 WAT 1205 132.445 37.232 85.622 1.00 0.00 H TER 74501 WAT 1205 ATOM 74501 O WAT 1206 140.848 64.356 128.520 1.00 0.00 O ATOM 74502 H1 WAT 1206 140.829 64.834 127.691 1.00 0.00 H ATOM 74503 H2 WAT 1206 140.384 63.539 128.335 1.00 0.00 H TER 74505 WAT 1206 ATOM 74505 O WAT 1207 4.703 137.658 156.106 1.00 0.00 O ATOM 74506 H1 WAT 1207 4.759 136.729 156.328 1.00 0.00 H ATOM 74507 H2 WAT 1207 5.439 137.807 155.513 1.00 0.00 H TER 74509 WAT 1207 ATOM 74509 O WAT 1208 132.200 133.415 97.360 1.00 0.00 O ATOM 74510 H1 WAT 1208 133.035 133.385 97.827 1.00 0.00 H ATOM 74511 H2 WAT 1208 132.261 132.712 96.714 1.00 0.00 H TER 74513 WAT 1208 ATOM 74513 O WAT 1209 106.854 99.779 123.833 1.00 0.00 O ATOM 74514 H1 WAT 1209 107.397 99.041 124.112 1.00 0.00 H ATOM 74515 H2 WAT 1209 106.149 99.379 123.325 1.00 0.00 H TER 74517 WAT 1209 ATOM 74517 O WAT 1210 60.545 22.617 128.364 1.00 0.00 O ATOM 74518 H1 WAT 1210 61.374 23.044 128.151 1.00 0.00 H ATOM 74519 H2 WAT 1210 60.796 21.752 128.686 1.00 0.00 H TER 74521 WAT 1210 ATOM 74521 O WAT 1211 1.846 15.680 113.001 1.00 0.00 O ATOM 74522 H1 WAT 1211 2.754 15.550 112.725 1.00 0.00 H ATOM 74523 H2 WAT 1211 1.897 16.349 113.683 1.00 0.00 H TER 74525 WAT 1211 ATOM 74525 O WAT 1212 91.445 70.627 15.254 1.00 0.00 O ATOM 74526 H1 WAT 1212 92.312 70.754 14.868 1.00 0.00 H ATOM 74527 H2 WAT 1212 91.039 69.950 14.713 1.00 0.00 H TER 74529 WAT 1212 ATOM 74529 O WAT 1213 4.881 56.827 82.759 1.00 0.00 O ATOM 74530 H1 WAT 1213 4.545 56.903 81.866 1.00 0.00 H ATOM 74531 H2 WAT 1213 4.132 56.524 83.272 1.00 0.00 H TER 74533 WAT 1213 ATOM 74533 O WAT 1214 55.674 47.940 132.971 1.00 0.00 O ATOM 74534 H1 WAT 1214 55.153 47.307 133.466 1.00 0.00 H ATOM 74535 H2 WAT 1214 55.137 48.732 132.954 1.00 0.00 H TER 74537 WAT 1214 ATOM 74537 O WAT 1215 81.508 43.059 146.110 1.00 0.00 O ATOM 74538 H1 WAT 1215 82.339 43.470 145.871 1.00 0.00 H ATOM 74539 H2 WAT 1215 81.536 42.200 145.688 1.00 0.00 H TER 74541 WAT 1215 ATOM 74541 O WAT 1216 9.595 93.874 132.265 1.00 0.00 O ATOM 74542 H1 WAT 1216 10.548 93.824 132.193 1.00 0.00 H ATOM 74543 H2 WAT 1216 9.366 94.704 131.846 1.00 0.00 H TER 74545 WAT 1216 ATOM 74545 O WAT 1217 126.559 50.998 87.934 1.00 0.00 O ATOM 74546 H1 WAT 1217 126.848 50.507 87.166 1.00 0.00 H ATOM 74547 H2 WAT 1217 125.619 51.122 87.800 1.00 0.00 H TER 74549 WAT 1217 ATOM 74549 O WAT 1218 67.852 13.978 121.957 1.00 0.00 O ATOM 74550 H1 WAT 1218 67.122 14.186 122.540 1.00 0.00 H ATOM 74551 H2 WAT 1218 67.591 13.163 121.528 1.00 0.00 H TER 74553 WAT 1218 ATOM 74553 O WAT 1219 133.775 92.031 75.527 1.00 0.00 O ATOM 74554 H1 WAT 1219 133.464 92.488 76.309 1.00 0.00 H ATOM 74555 H2 WAT 1219 132.980 91.699 75.111 1.00 0.00 H TER 74557 WAT 1219 ATOM 74557 O WAT 1220 45.039 44.909 71.169 1.00 0.00 O ATOM 74558 H1 WAT 1220 44.478 44.653 70.437 1.00 0.00 H ATOM 74559 H2 WAT 1220 45.602 44.149 71.317 1.00 0.00 H TER 74561 WAT 1220 ATOM 74561 O WAT 1221 105.847 38.462 107.398 1.00 0.00 O ATOM 74562 H1 WAT 1221 105.125 37.929 107.064 1.00 0.00 H ATOM 74563 H2 WAT 1221 106.351 38.697 106.619 1.00 0.00 H TER 74565 WAT 1221 ATOM 74565 O WAT 1222 20.663 128.026 12.427 1.00 0.00 O ATOM 74566 H1 WAT 1222 20.507 128.921 12.126 1.00 0.00 H ATOM 74567 H2 WAT 1222 21.573 127.848 12.189 1.00 0.00 H TER 74569 WAT 1222 ATOM 74569 O WAT 1223 96.340 16.949 148.361 1.00 0.00 O ATOM 74570 H1 WAT 1223 96.553 16.019 148.282 1.00 0.00 H ATOM 74571 H2 WAT 1223 95.535 17.055 147.852 1.00 0.00 H TER 74573 WAT 1223 ATOM 74573 O WAT 1224 46.744 35.723 139.234 1.00 0.00 O ATOM 74574 H1 WAT 1224 47.334 36.281 139.741 1.00 0.00 H ATOM 74575 H2 WAT 1224 47.225 34.902 139.125 1.00 0.00 H TER 74577 WAT 1224 ATOM 74577 O WAT 1225 30.241 130.718 57.403 1.00 0.00 O ATOM 74578 H1 WAT 1225 30.180 129.765 57.472 1.00 0.00 H ATOM 74579 H2 WAT 1225 30.308 130.886 56.463 1.00 0.00 H TER 74581 WAT 1225 ATOM 74581 O WAT 1226 72.278 90.496 12.989 1.00 0.00 O ATOM 74582 H1 WAT 1226 73.121 90.816 13.310 1.00 0.00 H ATOM 74583 H2 WAT 1226 72.131 89.683 13.473 1.00 0.00 H TER 74585 WAT 1226 ATOM 74585 O WAT 1227 38.950 65.827 85.625 1.00 0.00 O ATOM 74586 H1 WAT 1227 39.475 65.146 86.044 1.00 0.00 H ATOM 74587 H2 WAT 1227 39.518 66.182 84.942 1.00 0.00 H TER 74589 WAT 1227 ATOM 74589 O WAT 1228 97.648 56.686 93.208 1.00 0.00 O ATOM 74590 H1 WAT 1228 96.918 56.068 93.223 1.00 0.00 H ATOM 74591 H2 WAT 1228 97.390 57.378 93.817 1.00 0.00 H TER 74593 WAT 1228 ATOM 74593 O WAT 1229 39.517 33.521 19.268 1.00 0.00 O ATOM 74594 H1 WAT 1229 39.704 33.527 20.207 1.00 0.00 H ATOM 74595 H2 WAT 1229 39.249 34.419 19.072 1.00 0.00 H TER 74597 WAT 1229 ATOM 74597 O WAT 1230 107.861 57.180 78.043 1.00 0.00 O ATOM 74598 H1 WAT 1230 108.387 56.779 77.351 1.00 0.00 H ATOM 74599 H2 WAT 1230 107.914 58.120 77.868 1.00 0.00 H TER 74601 WAT 1230 ATOM 74601 O WAT 1231 8.398 32.850 128.009 1.00 0.00 O ATOM 74602 H1 WAT 1231 8.582 33.709 128.388 1.00 0.00 H ATOM 74603 H2 WAT 1231 7.573 32.581 128.413 1.00 0.00 H TER 74605 WAT 1231 ATOM 74605 O WAT 1232 51.208 44.365 150.770 1.00 0.00 O ATOM 74606 H1 WAT 1232 51.628 45.039 151.304 1.00 0.00 H ATOM 74607 H2 WAT 1232 50.472 44.063 151.301 1.00 0.00 H TER 74609 WAT 1232 ATOM 74609 O WAT 1233 26.983 18.642 97.270 1.00 0.00 O ATOM 74610 H1 WAT 1233 27.843 18.226 97.210 1.00 0.00 H ATOM 74611 H2 WAT 1233 27.080 19.292 97.966 1.00 0.00 H TER 74613 WAT 1233 ATOM 74613 O WAT 1234 10.792 76.748 117.770 1.00 0.00 O ATOM 74614 H1 WAT 1234 10.294 77.497 118.098 1.00 0.00 H ATOM 74615 H2 WAT 1234 10.731 76.096 118.468 1.00 0.00 H TER 74617 WAT 1234 ATOM 74617 O WAT 1235 53.776 93.840 128.034 1.00 0.00 O ATOM 74618 H1 WAT 1235 54.655 93.840 127.656 1.00 0.00 H ATOM 74619 H2 WAT 1235 53.736 94.647 128.547 1.00 0.00 H TER 74621 WAT 1235 ATOM 74621 O WAT 1236 33.762 139.182 5.776 1.00 0.00 O ATOM 74622 H1 WAT 1236 32.901 139.600 5.799 1.00 0.00 H ATOM 74623 H2 WAT 1236 34.372 139.899 5.600 1.00 0.00 H TER 74625 WAT 1236 ATOM 74625 O WAT 1237 109.334 31.932 75.699 1.00 0.00 O ATOM 74626 H1 WAT 1237 109.026 31.954 74.793 1.00 0.00 H ATOM 74627 H2 WAT 1237 108.631 31.497 76.181 1.00 0.00 H TER 74629 WAT 1237 ATOM 74629 O WAT 1238 122.657 5.734 157.260 1.00 0.00 O ATOM 74630 H1 WAT 1238 123.454 6.222 157.468 1.00 0.00 H ATOM 74631 H2 WAT 1238 122.023 6.020 157.919 1.00 0.00 H TER 74633 WAT 1238 ATOM 74633 O WAT 1239 38.616 40.718 115.888 1.00 0.00 O ATOM 74634 H1 WAT 1239 37.971 40.065 115.616 1.00 0.00 H ATOM 74635 H2 WAT 1239 39.373 40.204 116.171 1.00 0.00 H TER 74637 WAT 1239 ATOM 74637 O WAT 1240 71.391 84.888 128.732 1.00 0.00 O ATOM 74638 H1 WAT 1240 70.876 84.113 128.507 1.00 0.00 H ATOM 74639 H2 WAT 1240 72.298 84.627 128.572 1.00 0.00 H TER 74641 WAT 1240 ATOM 74641 O WAT 1241 63.865 64.733 131.725 1.00 0.00 O ATOM 74642 H1 WAT 1241 63.001 64.892 132.105 1.00 0.00 H ATOM 74643 H2 WAT 1241 64.479 65.082 132.370 1.00 0.00 H TER 74645 WAT 1241 ATOM 74645 O WAT 1242 136.830 13.859 142.470 1.00 0.00 O ATOM 74646 H1 WAT 1242 135.997 13.485 142.183 1.00 0.00 H ATOM 74647 H2 WAT 1242 136.837 14.741 142.100 1.00 0.00 H TER 74649 WAT 1242 ATOM 74649 O WAT 1243 51.259 40.262 86.863 1.00 0.00 O ATOM 74650 H1 WAT 1243 51.703 41.058 87.156 1.00 0.00 H ATOM 74651 H2 WAT 1243 50.329 40.444 86.993 1.00 0.00 H TER 74653 WAT 1243 ATOM 74653 O WAT 1244 14.775 117.504 114.011 1.00 0.00 O ATOM 74654 H1 WAT 1244 13.932 117.079 114.168 1.00 0.00 H ATOM 74655 H2 WAT 1244 15.262 116.879 113.473 1.00 0.00 H TER 74657 WAT 1244 ATOM 74657 O WAT 1245 50.533 71.073 101.878 1.00 0.00 O ATOM 74658 H1 WAT 1245 51.135 70.561 102.417 1.00 0.00 H ATOM 74659 H2 WAT 1245 51.034 71.850 101.632 1.00 0.00 H TER 74661 WAT 1245 ATOM 74661 O WAT 1246 143.813 34.701 85.388 1.00 0.00 O ATOM 74662 H1 WAT 1246 144.770 34.711 85.383 1.00 0.00 H ATOM 74663 H2 WAT 1246 143.564 35.291 84.676 1.00 0.00 H TER 74665 WAT 1246 ATOM 74665 O WAT 1247 135.252 137.546 7.776 1.00 0.00 O ATOM 74666 H1 WAT 1247 134.416 137.636 8.235 1.00 0.00 H ATOM 74667 H2 WAT 1247 135.782 138.275 8.099 1.00 0.00 H TER 74669 WAT 1247 ATOM 74669 O WAT 1248 64.229 25.200 68.218 1.00 0.00 O ATOM 74670 H1 WAT 1248 63.650 25.288 68.975 1.00 0.00 H ATOM 74671 H2 WAT 1248 63.743 24.647 67.607 1.00 0.00 H TER 74673 WAT 1248 ATOM 74673 O WAT 1249 112.030 113.715 15.978 1.00 0.00 O ATOM 74674 H1 WAT 1249 112.889 113.320 15.830 1.00 0.00 H ATOM 74675 H2 WAT 1249 112.072 114.054 16.872 1.00 0.00 H TER 74677 WAT 1249 ATOM 74677 O WAT 1250 58.791 3.729 25.497 1.00 0.00 O ATOM 74678 H1 WAT 1250 59.545 3.163 25.330 1.00 0.00 H ATOM 74679 H2 WAT 1250 59.173 4.556 25.791 1.00 0.00 H TER 74681 WAT 1250 ATOM 74681 O WAT 1251 39.141 49.600 122.955 1.00 0.00 O ATOM 74682 H1 WAT 1251 38.228 49.421 122.731 1.00 0.00 H ATOM 74683 H2 WAT 1251 39.570 48.745 122.917 1.00 0.00 H TER 74685 WAT 1251 ATOM 74685 O WAT 1252 50.328 22.626 140.872 1.00 0.00 O ATOM 74686 H1 WAT 1252 49.792 22.341 141.612 1.00 0.00 H ATOM 74687 H2 WAT 1252 50.623 23.504 141.113 1.00 0.00 H TER 74689 WAT 1252 ATOM 74689 O WAT 1253 66.315 118.136 140.824 1.00 0.00 O ATOM 74690 H1 WAT 1253 67.086 117.701 140.460 1.00 0.00 H ATOM 74691 H2 WAT 1253 65.711 118.213 140.086 1.00 0.00 H TER 74693 WAT 1253 ATOM 74693 O WAT 1254 50.701 63.819 75.180 1.00 0.00 O ATOM 74694 H1 WAT 1254 51.183 64.545 75.576 1.00 0.00 H ATOM 74695 H2 WAT 1254 50.260 63.395 75.916 1.00 0.00 H TER 74697 WAT 1254 ATOM 74697 O WAT 1255 139.344 82.445 153.114 1.00 0.00 O ATOM 74698 H1 WAT 1255 139.251 81.634 153.614 1.00 0.00 H ATOM 74699 H2 WAT 1255 140.273 82.665 153.185 1.00 0.00 H TER 74701 WAT 1255 ATOM 74701 O WAT 1256 125.995 100.123 26.170 1.00 0.00 O ATOM 74702 H1 WAT 1256 126.738 99.961 25.589 1.00 0.00 H ATOM 74703 H2 WAT 1256 126.187 100.969 26.574 1.00 0.00 H TER 74705 WAT 1256 ATOM 74705 O WAT 1257 33.443 106.845 99.662 1.00 0.00 O ATOM 74706 H1 WAT 1257 33.128 107.746 99.583 1.00 0.00 H ATOM 74707 H2 WAT 1257 34.163 106.787 99.034 1.00 0.00 H TER 74709 WAT 1257 ATOM 74709 O WAT 1258 141.544 0.631 121.379 1.00 0.00 O ATOM 74710 H1 WAT 1258 141.942 1.499 121.319 1.00 0.00 H ATOM 74711 H2 WAT 1258 140.958 0.584 120.623 1.00 0.00 H TER 74713 WAT 1258 ATOM 74713 O WAT 1259 63.994 36.703 63.212 1.00 0.00 O ATOM 74714 H1 WAT 1259 63.576 36.215 63.921 1.00 0.00 H ATOM 74715 H2 WAT 1259 64.473 36.041 62.715 1.00 0.00 H TER 74717 WAT 1259 ATOM 74717 O WAT 1260 31.478 63.300 83.815 1.00 0.00 O ATOM 74718 H1 WAT 1260 32.341 62.915 83.661 1.00 0.00 H ATOM 74719 H2 WAT 1260 30.931 62.562 84.084 1.00 0.00 H TER 74721 WAT 1260 ATOM 74721 O WAT 1261 88.738 29.663 130.386 1.00 0.00 O ATOM 74722 H1 WAT 1261 89.535 29.544 129.870 1.00 0.00 H ATOM 74723 H2 WAT 1261 89.046 29.994 131.229 1.00 0.00 H TER 74725 WAT 1261 ATOM 74725 O WAT 1262 11.423 57.777 98.029 1.00 0.00 O ATOM 74726 H1 WAT 1262 11.656 58.524 98.581 1.00 0.00 H ATOM 74727 H2 WAT 1262 11.494 57.019 98.609 1.00 0.00 H TER 74729 WAT 1262 ATOM 74729 O WAT 1263 2.006 123.960 77.089 1.00 0.00 O ATOM 74730 H1 WAT 1263 2.175 123.030 76.939 1.00 0.00 H ATOM 74731 H2 WAT 1263 2.828 124.298 77.444 1.00 0.00 H TER 74733 WAT 1263 ATOM 74733 O WAT 1264 115.265 56.473 153.701 1.00 0.00 O ATOM 74734 H1 WAT 1264 114.664 55.799 154.017 1.00 0.00 H ATOM 74735 H2 WAT 1264 114.700 57.117 153.274 1.00 0.00 H TER 74737 WAT 1264 ATOM 74737 O WAT 1265 65.742 128.138 150.427 1.00 0.00 O ATOM 74738 H1 WAT 1265 65.731 127.599 151.217 1.00 0.00 H ATOM 74739 H2 WAT 1265 66.652 128.420 150.341 1.00 0.00 H TER 74741 WAT 1265 ATOM 74741 O WAT 1266 30.839 85.853 111.691 1.00 0.00 O ATOM 74742 H1 WAT 1266 30.460 85.938 110.817 1.00 0.00 H ATOM 74743 H2 WAT 1266 30.177 85.378 112.194 1.00 0.00 H TER 74745 WAT 1266 ATOM 74745 O WAT 1267 102.648 90.568 91.837 1.00 0.00 O ATOM 74746 H1 WAT 1267 101.715 90.770 91.897 1.00 0.00 H ATOM 74747 H2 WAT 1267 102.738 89.718 92.267 1.00 0.00 H TER 74749 WAT 1267 ATOM 74749 O WAT 1268 64.574 139.040 131.424 1.00 0.00 O ATOM 74750 H1 WAT 1268 64.361 139.559 130.649 1.00 0.00 H ATOM 74751 H2 WAT 1268 65.293 139.516 131.840 1.00 0.00 H TER 74753 WAT 1268 ATOM 74753 O WAT 1269 141.714 138.420 141.162 1.00 0.00 O ATOM 74754 H1 WAT 1269 141.739 138.403 140.205 1.00 0.00 H ATOM 74755 H2 WAT 1269 142.632 138.360 141.427 1.00 0.00 H TER 74757 WAT 1269 ATOM 74757 O WAT 1270 132.373 72.698 150.237 1.00 0.00 O ATOM 74758 H1 WAT 1270 132.821 73.227 150.896 1.00 0.00 H ATOM 74759 H2 WAT 1270 132.041 71.942 150.721 1.00 0.00 H TER 74761 WAT 1270 ATOM 74761 O WAT 1271 91.720 7.220 148.777 1.00 0.00 O ATOM 74762 H1 WAT 1271 92.496 7.011 148.257 1.00 0.00 H ATOM 74763 H2 WAT 1271 91.786 8.161 148.938 1.00 0.00 H TER 74765 WAT 1271 ATOM 74765 O WAT 1272 64.270 99.007 80.898 1.00 0.00 O ATOM 74766 H1 WAT 1272 64.168 98.380 80.183 1.00 0.00 H ATOM 74767 H2 WAT 1272 63.409 99.036 81.317 1.00 0.00 H TER 74769 WAT 1272 ATOM 74769 O WAT 1273 72.789 66.746 21.132 1.00 0.00 O ATOM 74770 H1 WAT 1273 72.370 65.909 21.332 1.00 0.00 H ATOM 74771 H2 WAT 1273 73.017 67.110 21.987 1.00 0.00 H TER 74773 WAT 1273 ATOM 74773 O WAT 1274 6.676 111.220 17.228 1.00 0.00 O ATOM 74774 H1 WAT 1274 7.354 110.677 16.827 1.00 0.00 H ATOM 74775 H2 WAT 1274 6.969 111.343 18.130 1.00 0.00 H TER 74777 WAT 1274 ATOM 74777 O WAT 1275 136.790 84.261 125.136 1.00 0.00 O ATOM 74778 H1 WAT 1275 135.961 84.729 125.228 1.00 0.00 H ATOM 74779 H2 WAT 1275 137.190 84.310 126.004 1.00 0.00 H TER 74781 WAT 1275 ATOM 74781 O WAT 1276 93.482 72.517 10.832 1.00 0.00 O ATOM 74782 H1 WAT 1276 93.874 72.873 11.630 1.00 0.00 H ATOM 74783 H2 WAT 1276 94.199 72.052 10.400 1.00 0.00 H TER 74785 WAT 1276 ATOM 74785 O WAT 1277 73.745 115.807 136.610 1.00 0.00 O ATOM 74786 H1 WAT 1277 74.109 114.923 136.664 1.00 0.00 H ATOM 74787 H2 WAT 1277 73.253 115.913 137.424 1.00 0.00 H TER 74789 WAT 1277 ATOM 74789 O WAT 1278 14.426 90.847 120.590 1.00 0.00 O ATOM 74790 H1 WAT 1278 15.086 91.513 120.782 1.00 0.00 H ATOM 74791 H2 WAT 1278 13.597 91.250 120.846 1.00 0.00 H TER 74793 WAT 1278 ATOM 74793 O WAT 1279 99.732 41.610 126.902 1.00 0.00 O ATOM 74794 H1 WAT 1279 100.215 42.005 127.628 1.00 0.00 H ATOM 74795 H2 WAT 1279 100.403 41.406 126.251 1.00 0.00 H TER 74797 WAT 1279 ATOM 74797 O WAT 1280 28.514 101.966 144.027 1.00 0.00 O ATOM 74798 H1 WAT 1280 28.015 101.849 144.835 1.00 0.00 H ATOM 74799 H2 WAT 1280 27.910 101.706 143.331 1.00 0.00 H TER 74801 WAT 1280 ATOM 74801 O WAT 1281 59.628 108.907 111.908 1.00 0.00 O ATOM 74802 H1 WAT 1281 59.815 109.760 112.299 1.00 0.00 H ATOM 74803 H2 WAT 1281 60.060 108.935 111.054 1.00 0.00 H TER 74805 WAT 1281 ATOM 74805 O WAT 1282 93.247 50.347 100.138 1.00 0.00 O ATOM 74806 H1 WAT 1282 94.167 50.259 100.387 1.00 0.00 H ATOM 74807 H2 WAT 1282 92.784 50.461 100.967 1.00 0.00 H TER 74809 WAT 1282 ATOM 74809 O WAT 1283 116.636 112.261 92.324 1.00 0.00 O ATOM 74810 H1 WAT 1283 116.328 112.666 93.134 1.00 0.00 H ATOM 74811 H2 WAT 1283 115.838 111.967 91.885 1.00 0.00 H TER 74813 WAT 1283 ATOM 74813 O WAT 1284 16.335 123.426 151.678 1.00 0.00 O ATOM 74814 H1 WAT 1284 16.930 122.758 152.020 1.00 0.00 H ATOM 74815 H2 WAT 1284 16.902 124.171 151.476 1.00 0.00 H TER 74817 WAT 1284 ATOM 74817 O WAT 1285 110.955 60.164 149.674 1.00 0.00 O ATOM 74818 H1 WAT 1285 110.415 60.943 149.541 1.00 0.00 H ATOM 74819 H2 WAT 1285 110.696 59.570 148.970 1.00 0.00 H TER 74821 WAT 1285 ATOM 74821 O WAT 1286 87.557 33.769 97.366 1.00 0.00 O ATOM 74822 H1 WAT 1286 87.568 33.523 96.441 1.00 0.00 H ATOM 74823 H2 WAT 1286 86.628 33.866 97.577 1.00 0.00 H TER 74825 WAT 1286 ATOM 74825 O WAT 1287 124.060 52.175 98.726 1.00 0.00 O ATOM 74826 H1 WAT 1287 123.537 51.472 98.340 1.00 0.00 H ATOM 74827 H2 WAT 1287 124.312 52.722 97.982 1.00 0.00 H TER 74829 WAT 1287 ATOM 74829 O WAT 1288 52.073 8.390 76.139 1.00 0.00 O ATOM 74830 H1 WAT 1288 52.830 8.246 76.707 1.00 0.00 H ATOM 74831 H2 WAT 1288 51.400 8.743 76.721 1.00 0.00 H TER 74833 WAT 1288 ATOM 74833 O WAT 1289 136.414 84.138 109.946 1.00 0.00 O ATOM 74834 H1 WAT 1289 135.685 83.870 110.507 1.00 0.00 H ATOM 74835 H2 WAT 1289 137.081 84.454 110.555 1.00 0.00 H TER 74837 WAT 1289 ATOM 74837 O WAT 1290 79.601 137.680 73.448 1.00 0.00 O ATOM 74838 H1 WAT 1290 79.015 138.051 72.788 1.00 0.00 H ATOM 74839 H2 WAT 1290 80.387 138.225 73.404 1.00 0.00 H TER 74841 WAT 1290 ATOM 74841 O WAT 1291 140.799 117.378 139.308 1.00 0.00 O ATOM 74842 H1 WAT 1291 141.112 116.485 139.167 1.00 0.00 H ATOM 74843 H2 WAT 1291 140.030 117.454 138.743 1.00 0.00 H TER 74845 WAT 1291 ATOM 74845 O WAT 1292 83.382 82.038 22.231 1.00 0.00 O ATOM 74846 H1 WAT 1292 83.969 81.606 22.852 1.00 0.00 H ATOM 74847 H2 WAT 1292 83.880 82.073 21.415 1.00 0.00 H TER 74849 WAT 1292 ATOM 74849 O WAT 1293 122.406 16.531 134.908 1.00 0.00 O ATOM 74850 H1 WAT 1293 122.515 15.961 135.669 1.00 0.00 H ATOM 74851 H2 WAT 1293 122.352 17.413 135.275 1.00 0.00 H TER 74853 WAT 1293 ATOM 74853 O WAT 1294 99.440 11.394 146.770 1.00 0.00 O ATOM 74854 H1 WAT 1294 99.393 10.453 146.940 1.00 0.00 H ATOM 74855 H2 WAT 1294 100.367 11.610 146.873 1.00 0.00 H TER 74857 WAT 1294 ATOM 74857 O WAT 1295 32.665 130.435 58.877 1.00 0.00 O ATOM 74858 H1 WAT 1295 32.975 129.582 58.572 1.00 0.00 H ATOM 74859 H2 WAT 1295 31.956 130.662 58.275 1.00 0.00 H TER 74861 WAT 1295 ATOM 74861 O WAT 1296 103.883 55.228 131.613 1.00 0.00 O ATOM 74862 H1 WAT 1296 103.507 55.328 132.488 1.00 0.00 H ATOM 74863 H2 WAT 1296 104.806 55.456 131.721 1.00 0.00 H TER 74865 WAT 1296 ATOM 74865 O WAT 1297 60.084 103.882 143.892 1.00 0.00 O ATOM 74866 H1 WAT 1297 60.894 104.232 143.520 1.00 0.00 H ATOM 74867 H2 WAT 1297 60.137 102.939 143.736 1.00 0.00 H TER 74869 WAT 1297 ATOM 74869 O WAT 1298 62.656 119.416 97.791 1.00 0.00 O ATOM 74870 H1 WAT 1298 62.718 120.371 97.804 1.00 0.00 H ATOM 74871 H2 WAT 1298 63.202 119.151 97.051 1.00 0.00 H TER 74873 WAT 1298 ATOM 74873 O WAT 1299 76.606 121.426 79.824 1.00 0.00 O ATOM 74874 H1 WAT 1299 77.084 121.017 79.102 1.00 0.00 H ATOM 74875 H2 WAT 1299 77.199 122.103 80.150 1.00 0.00 H TER 74877 WAT 1299 ATOM 74877 O WAT 1300 53.106 2.326 76.732 1.00 0.00 O ATOM 74878 H1 WAT 1300 52.947 3.240 76.497 1.00 0.00 H ATOM 74879 H2 WAT 1300 53.303 2.350 77.668 1.00 0.00 H TER 74881 WAT 1300 ATOM 74881 O WAT 1301 102.361 43.608 90.628 1.00 0.00 O ATOM 74882 H1 WAT 1301 102.698 44.411 91.025 1.00 0.00 H ATOM 74883 H2 WAT 1301 101.518 43.463 91.058 1.00 0.00 H TER 74885 WAT 1301 ATOM 74885 O WAT 1302 7.694 76.166 121.494 1.00 0.00 O ATOM 74886 H1 WAT 1302 8.288 76.889 121.291 1.00 0.00 H ATOM 74887 H2 WAT 1302 7.522 76.255 122.432 1.00 0.00 H TER 74889 WAT 1302 ATOM 74889 O WAT 1303 32.003 98.533 16.624 1.00 0.00 O ATOM 74890 H1 WAT 1303 31.084 98.610 16.882 1.00 0.00 H ATOM 74891 H2 WAT 1303 32.492 98.751 17.418 1.00 0.00 H TER 74893 WAT 1303 ATOM 74893 O WAT 1304 136.267 61.328 12.671 1.00 0.00 O ATOM 74894 H1 WAT 1304 136.453 62.210 12.994 1.00 0.00 H ATOM 74895 H2 WAT 1304 136.596 61.328 11.772 1.00 0.00 H TER 74897 WAT 1304 ATOM 74897 O WAT 1305 142.871 40.623 3.422 1.00 0.00 O ATOM 74898 H1 WAT 1305 142.579 40.666 4.332 1.00 0.00 H ATOM 74899 H2 WAT 1305 143.811 40.452 3.479 1.00 0.00 H TER 74901 WAT 1305 ATOM 74901 O WAT 1306 29.744 90.267 64.265 1.00 0.00 O ATOM 74902 H1 WAT 1306 29.058 90.375 64.924 1.00 0.00 H ATOM 74903 H2 WAT 1306 29.305 89.839 63.531 1.00 0.00 H TER 74905 WAT 1306 ATOM 74905 O WAT 1307 95.124 103.566 12.215 1.00 0.00 O ATOM 74906 H1 WAT 1307 94.780 102.867 11.659 1.00 0.00 H ATOM 74907 H2 WAT 1307 94.403 103.777 12.808 1.00 0.00 H TER 74909 WAT 1307 ATOM 74909 O WAT 1308 116.318 74.394 132.516 1.00 0.00 O ATOM 74910 H1 WAT 1308 116.903 73.640 132.585 1.00 0.00 H ATOM 74911 H2 WAT 1308 116.135 74.471 131.580 1.00 0.00 H TER 74913 WAT 1308 ATOM 74913 O WAT 1309 89.070 36.838 55.568 1.00 0.00 O ATOM 74914 H1 WAT 1309 89.864 37.344 55.396 1.00 0.00 H ATOM 74915 H2 WAT 1309 89.382 36.044 56.002 1.00 0.00 H TER 74917 WAT 1309 ATOM 74917 O WAT 1310 49.429 135.725 148.127 1.00 0.00 O ATOM 74918 H1 WAT 1310 48.593 135.786 148.591 1.00 0.00 H ATOM 74919 H2 WAT 1310 49.257 136.118 147.272 1.00 0.00 H TER 74921 WAT 1310 ATOM 74921 O WAT 1311 52.703 23.057 68.246 1.00 0.00 O ATOM 74922 H1 WAT 1311 52.641 22.573 67.423 1.00 0.00 H ATOM 74923 H2 WAT 1311 52.038 23.741 68.173 1.00 0.00 H TER 74925 WAT 1311 ATOM 74925 O WAT 1312 30.409 17.816 132.815 1.00 0.00 O ATOM 74926 H1 WAT 1312 29.812 17.162 132.451 1.00 0.00 H ATOM 74927 H2 WAT 1312 29.845 18.398 133.324 1.00 0.00 H TER 74929 WAT 1312 ATOM 74929 O WAT 1313 141.115 8.419 62.136 1.00 0.00 O ATOM 74930 H1 WAT 1313 141.683 7.776 61.711 1.00 0.00 H ATOM 74931 H2 WAT 1313 141.684 8.864 62.764 1.00 0.00 H TER 74933 WAT 1313 ATOM 74933 O WAT 1314 52.127 19.646 142.120 1.00 0.00 O ATOM 74934 H1 WAT 1314 52.664 18.860 142.221 1.00 0.00 H ATOM 74935 H2 WAT 1314 51.371 19.494 142.686 1.00 0.00 H TER 74937 WAT 1314 ATOM 74937 O WAT 1315 139.191 104.142 8.036 1.00 0.00 O ATOM 74938 H1 WAT 1315 139.808 103.418 8.141 1.00 0.00 H ATOM 74939 H2 WAT 1315 139.325 104.442 7.137 1.00 0.00 H TER 74941 WAT 1315 ATOM 74941 O WAT 1316 66.572 70.796 26.869 1.00 0.00 O ATOM 74942 H1 WAT 1316 65.714 70.825 26.447 1.00 0.00 H ATOM 74943 H2 WAT 1316 66.503 71.416 27.595 1.00 0.00 H TER 74945 WAT 1316 ATOM 74945 O WAT 1317 74.643 130.453 149.104 1.00 0.00 O ATOM 74946 H1 WAT 1317 75.127 131.277 149.070 1.00 0.00 H ATOM 74947 H2 WAT 1317 74.957 129.958 148.348 1.00 0.00 H TER 74949 WAT 1317 ATOM 74949 O WAT 1318 37.631 67.360 96.956 1.00 0.00 O ATOM 74950 H1 WAT 1318 37.465 66.441 97.167 1.00 0.00 H ATOM 74951 H2 WAT 1318 36.760 67.738 96.834 1.00 0.00 H TER 74953 WAT 1318 ATOM 74953 O WAT 1319 91.620 7.844 82.755 1.00 0.00 O ATOM 74954 H1 WAT 1319 92.478 7.549 83.059 1.00 0.00 H ATOM 74955 H2 WAT 1319 91.355 8.506 83.393 1.00 0.00 H TER 74957 WAT 1319 ATOM 74957 O WAT 1320 130.968 79.895 18.046 1.00 0.00 O ATOM 74958 H1 WAT 1320 130.747 80.580 17.416 1.00 0.00 H ATOM 74959 H2 WAT 1320 130.228 79.879 18.653 1.00 0.00 H TER 74961 WAT 1320 ATOM 74961 O WAT 1321 21.879 85.185 5.986 1.00 0.00 O ATOM 74962 H1 WAT 1321 21.381 84.861 6.736 1.00 0.00 H ATOM 74963 H2 WAT 1321 22.772 84.877 6.139 1.00 0.00 H TER 74965 WAT 1321 ATOM 74965 O WAT 1322 139.588 24.163 78.675 1.00 0.00 O ATOM 74966 H1 WAT 1322 139.767 23.641 77.893 1.00 0.00 H ATOM 74967 H2 WAT 1322 140.390 24.665 78.817 1.00 0.00 H TER 74969 WAT 1322 ATOM 74969 O WAT 1323 68.278 112.318 155.969 1.00 0.00 O ATOM 74970 H1 WAT 1323 69.073 111.785 155.955 1.00 0.00 H ATOM 74971 H2 WAT 1323 68.470 113.018 156.593 1.00 0.00 H TER 74973 WAT 1323 ATOM 74973 O WAT 1324 4.776 16.318 103.341 1.00 0.00 O ATOM 74974 H1 WAT 1324 5.297 16.831 102.723 1.00 0.00 H ATOM 74975 H2 WAT 1324 5.190 15.455 103.344 1.00 0.00 H TER 74977 WAT 1324 ATOM 74977 O WAT 1325 112.993 125.626 126.970 1.00 0.00 O ATOM 74978 H1 WAT 1325 113.735 126.131 126.638 1.00 0.00 H ATOM 74979 H2 WAT 1325 112.222 126.096 126.653 1.00 0.00 H TER 74981 WAT 1325 ATOM 74981 O WAT 1326 0.560 34.351 120.584 1.00 0.00 O ATOM 74982 H1 WAT 1326 -0.298 34.408 120.164 1.00 0.00 H ATOM 74983 H2 WAT 1326 0.382 34.502 121.513 1.00 0.00 H TER 74985 WAT 1326 ATOM 74985 O WAT 1327 123.366 130.955 86.454 1.00 0.00 O ATOM 74986 H1 WAT 1327 123.343 131.892 86.262 1.00 0.00 H ATOM 74987 H2 WAT 1327 122.472 130.743 86.723 1.00 0.00 H TER 74989 WAT 1327 ATOM 74989 O WAT 1328 138.728 29.201 156.779 1.00 0.00 O ATOM 74990 H1 WAT 1328 138.847 28.812 155.912 1.00 0.00 H ATOM 74991 H2 WAT 1328 137.781 29.309 156.865 1.00 0.00 H TER 74993 WAT 1328 ATOM 74993 O WAT 1329 105.056 43.307 68.545 1.00 0.00 O ATOM 74994 H1 WAT 1329 104.450 42.571 68.636 1.00 0.00 H ATOM 74995 H2 WAT 1329 104.638 43.884 67.906 1.00 0.00 H TER 74997 WAT 1329 ATOM 74997 O WAT 1330 140.837 60.076 108.859 1.00 0.00 O ATOM 74998 H1 WAT 1330 141.430 60.054 108.109 1.00 0.00 H ATOM 74999 H2 WAT 1330 141.262 59.527 109.518 1.00 0.00 H TER 75001 WAT 1330 ATOM 75001 O WAT 1331 37.612 115.813 158.266 1.00 0.00 O ATOM 75002 H1 WAT 1331 38.434 115.901 158.748 1.00 0.00 H ATOM 75003 H2 WAT 1331 37.712 116.395 157.513 1.00 0.00 H TER 75005 WAT 1331 ATOM 75005 O WAT 1332 107.877 10.761 157.866 1.00 0.00 O ATOM 75006 H1 WAT 1332 107.979 10.856 158.813 1.00 0.00 H ATOM 75007 H2 WAT 1332 108.647 11.194 157.498 1.00 0.00 H TER 75009 WAT 1332 ATOM 75009 O WAT 1333 77.141 16.136 14.714 1.00 0.00 O ATOM 75010 H1 WAT 1333 76.793 16.898 14.252 1.00 0.00 H ATOM 75011 H2 WAT 1333 76.384 15.765 15.168 1.00 0.00 H TER 75013 WAT 1333 ATOM 75013 O WAT 1334 65.877 6.766 69.644 1.00 0.00 O ATOM 75014 H1 WAT 1334 65.193 7.200 69.134 1.00 0.00 H ATOM 75015 H2 WAT 1334 66.488 7.467 69.871 1.00 0.00 H TER 75017 WAT 1334 ATOM 75017 O WAT 1335 72.602 111.070 66.945 1.00 0.00 O ATOM 75018 H1 WAT 1335 72.612 110.415 67.642 1.00 0.00 H ATOM 75019 H2 WAT 1335 73.524 111.191 66.717 1.00 0.00 H TER 75021 WAT 1335 ATOM 75021 O WAT 1336 17.252 10.780 119.556 1.00 0.00 O ATOM 75022 H1 WAT 1336 18.188 10.578 119.582 1.00 0.00 H ATOM 75023 H2 WAT 1336 17.010 10.912 120.472 1.00 0.00 H TER 75025 WAT 1336 ATOM 75025 O WAT 1337 9.048 46.430 115.626 1.00 0.00 O ATOM 75026 H1 WAT 1337 8.227 45.940 115.671 1.00 0.00 H ATOM 75027 H2 WAT 1337 9.697 45.847 116.020 1.00 0.00 H TER 75029 WAT 1337 ATOM 75029 O WAT 1338 12.557 82.940 85.312 1.00 0.00 O ATOM 75030 H1 WAT 1338 11.877 82.825 84.648 1.00 0.00 H ATOM 75031 H2 WAT 1338 12.152 83.499 85.975 1.00 0.00 H TER 75033 WAT 1338 ATOM 75033 O WAT 1339 64.208 140.826 57.703 1.00 0.00 O ATOM 75034 H1 WAT 1339 64.188 140.588 56.776 1.00 0.00 H ATOM 75035 H2 WAT 1339 64.337 139.995 58.160 1.00 0.00 H TER 75037 WAT 1339 ATOM 75037 O WAT 1340 51.019 49.607 87.886 1.00 0.00 O ATOM 75038 H1 WAT 1340 51.400 50.370 87.451 1.00 0.00 H ATOM 75039 H2 WAT 1340 51.725 48.960 87.897 1.00 0.00 H TER 75041 WAT 1340 ATOM 75041 O WAT 1341 90.653 45.206 74.323 1.00 0.00 O ATOM 75042 H1 WAT 1341 90.053 45.884 74.632 1.00 0.00 H ATOM 75043 H2 WAT 1341 91.525 45.554 74.508 1.00 0.00 H TER 75045 WAT 1341 ATOM 75045 O WAT 1342 1.786 130.635 7.099 1.00 0.00 O ATOM 75046 H1 WAT 1342 1.108 129.974 6.955 1.00 0.00 H ATOM 75047 H2 WAT 1342 1.795 130.765 8.048 1.00 0.00 H TER 75049 WAT 1342 ATOM 75049 O WAT 1343 91.280 102.829 144.771 1.00 0.00 O ATOM 75050 H1 WAT 1343 91.104 102.018 145.249 1.00 0.00 H ATOM 75051 H2 WAT 1343 90.417 103.222 144.641 1.00 0.00 H TER 75053 WAT 1343 ATOM 75053 O WAT 1344 95.189 81.560 79.472 1.00 0.00 O ATOM 75054 H1 WAT 1344 94.964 82.075 80.246 1.00 0.00 H ATOM 75055 H2 WAT 1344 96.002 81.114 79.708 1.00 0.00 H TER 75057 WAT 1344 ATOM 75057 O WAT 1345 93.061 95.909 25.463 1.00 0.00 O ATOM 75058 H1 WAT 1345 93.403 95.679 26.327 1.00 0.00 H ATOM 75059 H2 WAT 1345 92.675 95.097 25.135 1.00 0.00 H TER 75061 WAT 1345 ATOM 75061 O WAT 1346 10.292 102.322 146.065 1.00 0.00 O ATOM 75062 H1 WAT 1346 9.649 103.012 146.227 1.00 0.00 H ATOM 75063 H2 WAT 1346 10.812 102.646 145.330 1.00 0.00 H TER 75065 WAT 1346 ATOM 75065 O WAT 1347 38.297 50.618 24.125 1.00 0.00 O ATOM 75066 H1 WAT 1347 37.590 50.781 24.749 1.00 0.00 H ATOM 75067 H2 WAT 1347 39.051 50.392 24.670 1.00 0.00 H TER 75069 WAT 1347 ATOM 75069 O WAT 1348 140.990 34.373 149.301 1.00 0.00 O ATOM 75070 H1 WAT 1348 140.127 34.732 149.095 1.00 0.00 H ATOM 75071 H2 WAT 1348 141.176 34.688 150.186 1.00 0.00 H TER 75073 WAT 1348 ATOM 75073 O WAT 1349 100.646 66.834 116.636 1.00 0.00 O ATOM 75074 H1 WAT 1349 101.140 66.183 116.139 1.00 0.00 H ATOM 75075 H2 WAT 1349 100.666 66.514 117.538 1.00 0.00 H TER 75077 WAT 1349 ATOM 75077 O WAT 1350 113.509 103.387 144.881 1.00 0.00 O ATOM 75078 H1 WAT 1350 113.852 103.253 145.765 1.00 0.00 H ATOM 75079 H2 WAT 1350 112.724 103.920 145.008 1.00 0.00 H TER 75081 WAT 1350 ATOM 75081 O WAT 1351 144.095 141.547 151.745 1.00 0.00 O ATOM 75082 H1 WAT 1351 143.429 141.881 152.346 1.00 0.00 H ATOM 75083 H2 WAT 1351 144.211 140.632 152.001 1.00 0.00 H TER 75085 WAT 1351 ATOM 75085 O WAT 1352 143.874 52.062 106.684 1.00 0.00 O ATOM 75086 H1 WAT 1352 144.025 52.302 107.598 1.00 0.00 H ATOM 75087 H2 WAT 1352 144.523 51.381 106.504 1.00 0.00 H TER 75089 WAT 1352 ATOM 75089 O WAT 1353 103.953 119.262 88.655 1.00 0.00 O ATOM 75090 H1 WAT 1353 103.439 118.803 87.991 1.00 0.00 H ATOM 75091 H2 WAT 1353 103.649 120.169 88.610 1.00 0.00 H TER 75093 WAT 1353 ATOM 75093 O WAT 1354 142.695 28.822 96.293 1.00 0.00 O ATOM 75094 H1 WAT 1354 142.190 29.383 96.881 1.00 0.00 H ATOM 75095 H2 WAT 1354 142.746 29.316 95.475 1.00 0.00 H TER 75097 WAT 1354 ATOM 75097 O WAT 1355 97.235 123.051 146.527 1.00 0.00 O ATOM 75098 H1 WAT 1355 97.040 122.294 147.080 1.00 0.00 H ATOM 75099 H2 WAT 1355 98.125 122.895 146.212 1.00 0.00 H TER 75101 WAT 1355 ATOM 75101 O WAT 1356 137.018 49.304 133.710 1.00 0.00 O ATOM 75102 H1 WAT 1356 136.833 48.707 134.436 1.00 0.00 H ATOM 75103 H2 WAT 1356 137.966 49.433 133.742 1.00 0.00 H TER 75105 WAT 1356 ATOM 75105 O WAT 1357 142.958 117.832 78.733 1.00 0.00 O ATOM 75106 H1 WAT 1357 143.583 118.052 79.424 1.00 0.00 H ATOM 75107 H2 WAT 1357 142.432 117.123 79.103 1.00 0.00 H TER 75109 WAT 1357 ATOM 75109 O WAT 1358 142.142 2.880 2.539 1.00 0.00 O ATOM 75110 H1 WAT 1358 141.364 2.332 2.636 1.00 0.00 H ATOM 75111 H2 WAT 1358 142.571 2.840 3.394 1.00 0.00 H TER 75113 WAT 1358 ATOM 75113 O WAT 1359 36.297 75.648 85.174 1.00 0.00 O ATOM 75114 H1 WAT 1359 37.013 75.017 85.100 1.00 0.00 H ATOM 75115 H2 WAT 1359 35.572 75.144 85.544 1.00 0.00 H TER 75117 WAT 1359 ATOM 75117 O WAT 1360 142.096 97.818 15.682 1.00 0.00 O ATOM 75118 H1 WAT 1360 141.727 98.168 16.493 1.00 0.00 H ATOM 75119 H2 WAT 1360 143.031 98.018 15.739 1.00 0.00 H TER 75121 WAT 1360 ATOM 75121 O WAT 1361 15.648 44.476 85.787 1.00 0.00 O ATOM 75122 H1 WAT 1361 15.182 44.874 85.051 1.00 0.00 H ATOM 75123 H2 WAT 1361 15.557 45.110 86.499 1.00 0.00 H TER 75125 WAT 1361 ATOM 75125 O WAT 1362 140.959 137.581 152.899 1.00 0.00 O ATOM 75126 H1 WAT 1362 140.123 137.283 152.541 1.00 0.00 H ATOM 75127 H2 WAT 1362 141.317 138.158 152.225 1.00 0.00 H TER 75129 WAT 1362 ATOM 75129 O WAT 1363 84.807 81.500 101.409 1.00 0.00 O ATOM 75130 H1 WAT 1363 84.167 81.639 100.712 1.00 0.00 H ATOM 75131 H2 WAT 1363 85.422 80.863 101.046 1.00 0.00 H TER 75133 WAT 1363 ATOM 75133 O WAT 1364 24.199 35.490 113.463 1.00 0.00 O ATOM 75134 H1 WAT 1364 23.663 36.272 113.597 1.00 0.00 H ATOM 75135 H2 WAT 1364 23.870 34.861 114.105 1.00 0.00 H TER 75137 WAT 1364 ATOM 75137 O WAT 1365 139.204 27.917 127.361 1.00 0.00 O ATOM 75138 H1 WAT 1365 138.598 28.168 128.058 1.00 0.00 H ATOM 75139 H2 WAT 1365 138.692 28.000 126.557 1.00 0.00 H TER 75141 WAT 1365 ATOM 75141 O WAT 1366 130.277 69.505 91.930 1.00 0.00 O ATOM 75142 H1 WAT 1366 129.491 70.011 92.135 1.00 0.00 H ATOM 75143 H2 WAT 1366 130.993 70.137 91.998 1.00 0.00 H TER 75145 WAT 1366 ATOM 75145 O WAT 1367 39.992 52.966 78.074 1.00 0.00 O ATOM 75146 H1 WAT 1367 39.960 53.909 77.911 1.00 0.00 H ATOM 75147 H2 WAT 1367 40.914 52.785 78.257 1.00 0.00 H TER 75149 WAT 1367 ATOM 75149 O WAT 1368 3.926 76.184 3.615 1.00 0.00 O ATOM 75150 H1 WAT 1368 3.324 75.549 3.227 1.00 0.00 H ATOM 75151 H2 WAT 1368 4.793 75.899 3.327 1.00 0.00 H TER 75153 WAT 1368 ATOM 75153 O WAT 1369 104.119 144.079 1.760 1.00 0.00 O ATOM 75154 H1 WAT 1369 104.659 143.822 2.508 1.00 0.00 H ATOM 75155 H2 WAT 1369 103.942 145.009 1.901 1.00 0.00 H TER 75157 WAT 1369 ATOM 75157 O WAT 1370 99.415 97.821 156.013 1.00 0.00 O ATOM 75158 H1 WAT 1370 100.201 97.309 155.819 1.00 0.00 H ATOM 75159 H2 WAT 1370 98.728 97.166 156.133 1.00 0.00 H TER 75161 WAT 1370 ATOM 75161 O WAT 1371 31.961 89.120 97.757 1.00 0.00 O ATOM 75162 H1 WAT 1371 31.807 89.857 98.349 1.00 0.00 H ATOM 75163 H2 WAT 1371 32.203 88.396 98.334 1.00 0.00 H TER 75165 WAT 1371 ATOM 75165 O WAT 1372 111.341 20.490 70.144 1.00 0.00 O ATOM 75166 H1 WAT 1372 110.614 20.372 69.533 1.00 0.00 H ATOM 75167 H2 WAT 1372 110.941 20.881 70.920 1.00 0.00 H TER 75169 WAT 1372 ATOM 75169 O WAT 1373 102.814 5.090 133.341 1.00 0.00 O ATOM 75170 H1 WAT 1373 102.159 5.717 133.034 1.00 0.00 H ATOM 75171 H2 WAT 1373 102.309 4.431 133.818 1.00 0.00 H TER 75173 WAT 1373 ATOM 75173 O WAT 1374 6.161 127.467 145.918 1.00 0.00 O ATOM 75174 H1 WAT 1374 6.170 127.840 146.799 1.00 0.00 H ATOM 75175 H2 WAT 1374 5.798 126.589 146.032 1.00 0.00 H TER 75177 WAT 1374 ATOM 75177 O WAT 1375 94.725 75.985 69.343 1.00 0.00 O ATOM 75178 H1 WAT 1375 95.180 75.403 69.952 1.00 0.00 H ATOM 75179 H2 WAT 1375 93.930 76.245 69.809 1.00 0.00 H TER 75181 WAT 1375 ATOM 75181 O WAT 1376 27.660 23.972 74.544 1.00 0.00 O ATOM 75182 H1 WAT 1376 27.223 24.061 73.697 1.00 0.00 H ATOM 75183 H2 WAT 1376 27.113 23.356 75.032 1.00 0.00 H TER 75185 WAT 1376 ATOM 75185 O WAT 1377 25.312 143.074 113.594 1.00 0.00 O ATOM 75186 H1 WAT 1377 25.748 142.758 114.385 1.00 0.00 H ATOM 75187 H2 WAT 1377 24.706 143.746 113.907 1.00 0.00 H TER 75189 WAT 1377 ATOM 75189 O WAT 1378 141.900 9.753 82.519 1.00 0.00 O ATOM 75190 H1 WAT 1378 142.133 10.577 82.091 1.00 0.00 H ATOM 75191 H2 WAT 1378 142.687 9.213 82.443 1.00 0.00 H TER 75193 WAT 1378 ATOM 75193 O WAT 1379 131.431 116.846 14.279 1.00 0.00 O ATOM 75194 H1 WAT 1379 130.991 116.307 14.936 1.00 0.00 H ATOM 75195 H2 WAT 1379 131.000 117.698 14.341 1.00 0.00 H TER 75197 WAT 1379 ATOM 75197 O WAT 1380 75.592 93.506 151.173 1.00 0.00 O ATOM 75198 H1 WAT 1380 75.420 92.577 151.021 1.00 0.00 H ATOM 75199 H2 WAT 1380 75.537 93.905 150.305 1.00 0.00 H TER 75201 WAT 1380 ATOM 75201 O WAT 1381 141.187 106.904 143.360 1.00 0.00 O ATOM 75202 H1 WAT 1381 140.336 107.340 143.311 1.00 0.00 H ATOM 75203 H2 WAT 1381 141.451 106.790 142.447 1.00 0.00 H TER 75205 WAT 1381 ATOM 75205 O WAT 1382 39.331 29.300 144.453 1.00 0.00 O ATOM 75206 H1 WAT 1382 39.551 28.382 144.295 1.00 0.00 H ATOM 75207 H2 WAT 1382 38.719 29.277 145.189 1.00 0.00 H TER 75209 WAT 1382 ATOM 75209 O WAT 1383 108.660 145.248 81.402 1.00 0.00 O ATOM 75210 H1 WAT 1383 109.390 145.315 82.017 1.00 0.00 H ATOM 75211 H2 WAT 1383 107.899 145.061 81.953 1.00 0.00 H TER 75213 WAT 1383 ATOM 75213 O WAT 1384 99.772 47.929 103.001 1.00 0.00 O ATOM 75214 H1 WAT 1384 100.172 48.626 102.481 1.00 0.00 H ATOM 75215 H2 WAT 1384 100.510 47.502 103.437 1.00 0.00 H TER 75217 WAT 1384 ATOM 75217 O WAT 1385 71.301 34.768 109.973 1.00 0.00 O ATOM 75218 H1 WAT 1385 71.008 33.857 109.984 1.00 0.00 H ATOM 75219 H2 WAT 1385 70.594 35.241 109.535 1.00 0.00 H TER 75221 WAT 1385 ATOM 75221 O WAT 1386 54.488 63.084 106.038 1.00 0.00 O ATOM 75222 H1 WAT 1386 53.732 62.502 105.955 1.00 0.00 H ATOM 75223 H2 WAT 1386 54.236 63.874 105.561 1.00 0.00 H TER 75225 WAT 1386 ATOM 75225 O WAT 1387 11.123 88.400 16.339 1.00 0.00 O ATOM 75226 H1 WAT 1387 10.557 87.991 15.685 1.00 0.00 H ATOM 75227 H2 WAT 1387 11.526 89.137 15.879 1.00 0.00 H TER 75229 WAT 1387 ATOM 75229 O WAT 1388 63.185 114.068 65.417 1.00 0.00 O ATOM 75230 H1 WAT 1388 62.732 113.690 64.662 1.00 0.00 H ATOM 75231 H2 WAT 1388 62.493 114.495 65.922 1.00 0.00 H TER 75233 WAT 1388 ATOM 75233 O WAT 1389 34.445 40.437 113.320 1.00 0.00 O ATOM 75234 H1 WAT 1389 34.344 39.899 112.535 1.00 0.00 H ATOM 75235 H2 WAT 1389 33.575 40.441 113.721 1.00 0.00 H TER 75237 WAT 1389 ATOM 75237 O WAT 1390 145.707 74.492 94.146 1.00 0.00 O ATOM 75238 H1 WAT 1390 145.336 73.612 94.083 1.00 0.00 H ATOM 75239 H2 WAT 1390 145.294 74.870 94.923 1.00 0.00 H TER 75241 WAT 1390 ATOM 75241 O WAT 1391 89.545 17.793 61.952 1.00 0.00 O ATOM 75242 H1 WAT 1391 88.656 17.835 61.599 1.00 0.00 H ATOM 75243 H2 WAT 1391 90.009 18.509 61.516 1.00 0.00 H TER 75245 WAT 1391 ATOM 75245 O WAT 1392 25.813 140.031 114.386 1.00 0.00 O ATOM 75246 H1 WAT 1392 25.536 140.570 115.126 1.00 0.00 H ATOM 75247 H2 WAT 1392 25.047 139.496 114.179 1.00 0.00 H TER 75249 WAT 1392 ATOM 75249 O WAT 1393 133.385 139.782 17.714 1.00 0.00 O ATOM 75250 H1 WAT 1393 134.064 139.107 17.695 1.00 0.00 H ATOM 75251 H2 WAT 1393 133.255 139.963 18.645 1.00 0.00 H TER 75253 WAT 1393 ATOM 75253 O WAT 1394 138.050 132.461 69.134 1.00 0.00 O ATOM 75254 H1 WAT 1394 138.200 133.143 68.479 1.00 0.00 H ATOM 75255 H2 WAT 1394 137.787 131.694 68.625 1.00 0.00 H TER 75257 WAT 1394 ATOM 75257 O WAT 1395 26.619 101.408 129.589 1.00 0.00 O ATOM 75258 H1 WAT 1395 27.098 101.066 130.344 1.00 0.00 H ATOM 75259 H2 WAT 1395 26.549 100.663 128.992 1.00 0.00 H TER 75261 WAT 1395 ATOM 75261 O WAT 1396 120.314 114.362 84.779 1.00 0.00 O ATOM 75262 H1 WAT 1396 120.454 114.429 83.834 1.00 0.00 H ATOM 75263 H2 WAT 1396 120.895 115.024 85.154 1.00 0.00 H TER 75265 WAT 1396 ATOM 75265 O WAT 1397 44.942 142.313 125.796 1.00 0.00 O ATOM 75266 H1 WAT 1397 44.082 142.622 126.080 1.00 0.00 H ATOM 75267 H2 WAT 1397 45.508 142.450 126.556 1.00 0.00 H TER 75269 WAT 1397 ATOM 75269 O WAT 1398 5.305 127.695 64.783 1.00 0.00 O ATOM 75270 H1 WAT 1398 5.688 126.823 64.689 1.00 0.00 H ATOM 75271 H2 WAT 1398 4.984 127.911 63.907 1.00 0.00 H TER 75273 WAT 1398 ATOM 75273 O WAT 1399 121.395 54.140 126.794 1.00 0.00 O ATOM 75274 H1 WAT 1399 122.168 53.861 126.303 1.00 0.00 H ATOM 75275 H2 WAT 1399 121.060 53.335 127.189 1.00 0.00 H TER 75277 WAT 1399 ATOM 75277 O WAT 1400 25.303 48.247 77.708 1.00 0.00 O ATOM 75278 H1 WAT 1400 25.989 47.802 78.205 1.00 0.00 H ATOM 75279 H2 WAT 1400 25.761 48.636 76.963 1.00 0.00 H TER 75281 WAT 1400 ATOM 75281 O WAT 1401 72.736 23.734 100.162 1.00 0.00 O ATOM 75282 H1 WAT 1401 72.564 22.898 100.594 1.00 0.00 H ATOM 75283 H2 WAT 1401 72.420 24.393 100.780 1.00 0.00 H TER 75285 WAT 1401 ATOM 75285 O WAT 1402 92.676 87.759 2.791 1.00 0.00 O ATOM 75286 H1 WAT 1402 92.860 88.093 1.913 1.00 0.00 H ATOM 75287 H2 WAT 1402 92.737 88.529 3.358 1.00 0.00 H TER 75289 WAT 1402 ATOM 75289 O WAT 1403 7.847 31.855 99.993 1.00 0.00 O ATOM 75290 H1 WAT 1403 7.821 32.809 100.066 1.00 0.00 H ATOM 75291 H2 WAT 1403 6.938 31.602 99.832 1.00 0.00 H TER 75293 WAT 1403 ATOM 75293 O WAT 1404 3.967 97.124 109.937 1.00 0.00 O ATOM 75294 H1 WAT 1404 3.726 97.831 110.535 1.00 0.00 H ATOM 75295 H2 WAT 1404 3.916 97.519 109.067 1.00 0.00 H TER 75297 WAT 1404 ATOM 75297 O WAT 1405 132.190 40.696 80.976 1.00 0.00 O ATOM 75298 H1 WAT 1405 131.396 40.844 80.463 1.00 0.00 H ATOM 75299 H2 WAT 1405 132.249 39.744 81.058 1.00 0.00 H TER 75301 WAT 1405 ATOM 75301 O WAT 1406 84.411 141.745 94.361 1.00 0.00 O ATOM 75302 H1 WAT 1406 84.251 142.336 95.097 1.00 0.00 H ATOM 75303 H2 WAT 1406 85.300 141.421 94.503 1.00 0.00 H TER 75305 WAT 1406 ATOM 75305 O WAT 1407 115.668 138.318 97.941 1.00 0.00 O ATOM 75306 H1 WAT 1407 115.471 138.076 98.846 1.00 0.00 H ATOM 75307 H2 WAT 1407 114.884 138.776 97.640 1.00 0.00 H TER 75309 WAT 1407 ATOM 75309 O WAT 1408 128.882 40.815 115.436 1.00 0.00 O ATOM 75310 H1 WAT 1408 128.443 40.115 115.921 1.00 0.00 H ATOM 75311 H2 WAT 1408 129.607 40.378 114.990 1.00 0.00 H TER 75313 WAT 1408 ATOM 75313 O WAT 1409 122.869 118.922 12.745 1.00 0.00 O ATOM 75314 H1 WAT 1409 122.774 119.868 12.855 1.00 0.00 H ATOM 75315 H2 WAT 1409 123.694 118.712 13.182 1.00 0.00 H TER 75317 WAT 1409 ATOM 75317 O WAT 1410 25.958 67.576 14.547 1.00 0.00 O ATOM 75318 H1 WAT 1410 26.734 67.879 15.018 1.00 0.00 H ATOM 75319 H2 WAT 1410 25.336 67.343 15.236 1.00 0.00 H TER 75321 WAT 1410 ATOM 75321 O WAT 1411 113.089 4.308 62.422 1.00 0.00 O ATOM 75322 H1 WAT 1411 112.265 3.914 62.136 1.00 0.00 H ATOM 75323 H2 WAT 1411 113.328 4.905 61.713 1.00 0.00 H TER 75325 WAT 1411 ATOM 75325 O WAT 1412 27.664 116.184 136.317 1.00 0.00 O ATOM 75326 H1 WAT 1412 27.543 117.032 135.890 1.00 0.00 H ATOM 75327 H2 WAT 1412 26.931 115.653 136.006 1.00 0.00 H TER 75329 WAT 1412 ATOM 75329 O WAT 1413 144.864 53.326 95.735 1.00 0.00 O ATOM 75330 H1 WAT 1413 145.691 52.913 95.985 1.00 0.00 H ATOM 75331 H2 WAT 1413 144.673 52.973 94.866 1.00 0.00 H TER 75333 WAT 1413 ATOM 75333 O WAT 1414 78.038 122.091 118.277 1.00 0.00 O ATOM 75334 H1 WAT 1414 78.846 122.547 118.511 1.00 0.00 H ATOM 75335 H2 WAT 1414 78.235 121.165 118.422 1.00 0.00 H TER 75337 WAT 1414 ATOM 75337 O WAT 1415 82.903 115.774 157.281 1.00 0.00 O ATOM 75338 H1 WAT 1415 83.534 115.785 158.001 1.00 0.00 H ATOM 75339 H2 WAT 1415 82.674 116.694 157.148 1.00 0.00 H TER 75341 WAT 1415 ATOM 75341 O WAT 1416 97.573 90.460 80.269 1.00 0.00 O ATOM 75342 H1 WAT 1416 97.987 91.322 80.219 1.00 0.00 H ATOM 75343 H2 WAT 1416 97.126 90.458 81.115 1.00 0.00 H TER 75345 WAT 1416 ATOM 75345 O WAT 1417 33.347 122.371 16.691 1.00 0.00 O ATOM 75346 H1 WAT 1417 33.185 123.292 16.484 1.00 0.00 H ATOM 75347 H2 WAT 1417 33.758 122.389 17.556 1.00 0.00 H TER 75349 WAT 1417 ATOM 75349 O WAT 1418 68.272 21.984 150.721 1.00 0.00 O ATOM 75350 H1 WAT 1418 68.358 22.002 151.674 1.00 0.00 H ATOM 75351 H2 WAT 1418 68.525 21.094 150.474 1.00 0.00 H TER 75353 WAT 1418 ATOM 75353 O WAT 1419 79.054 111.196 69.298 1.00 0.00 O ATOM 75354 H1 WAT 1419 78.109 111.132 69.157 1.00 0.00 H ATOM 75355 H2 WAT 1419 79.382 111.643 68.518 1.00 0.00 H TER 75357 WAT 1419 ATOM 75357 O WAT 1420 87.446 110.222 131.747 1.00 0.00 O ATOM 75358 H1 WAT 1420 88.193 110.496 132.279 1.00 0.00 H ATOM 75359 H2 WAT 1420 87.020 111.040 131.493 1.00 0.00 H TER 75361 WAT 1420 ATOM 75361 O WAT 1421 87.479 57.211 144.889 1.00 0.00 O ATOM 75362 H1 WAT 1421 87.547 57.736 145.687 1.00 0.00 H ATOM 75363 H2 WAT 1421 87.484 57.853 144.179 1.00 0.00 H TER 75365 WAT 1421 ATOM 75365 O WAT 1422 70.157 118.356 158.887 1.00 0.00 O ATOM 75366 H1 WAT 1422 69.918 118.841 158.097 1.00 0.00 H ATOM 75367 H2 WAT 1422 71.111 118.294 158.851 1.00 0.00 H TER 75369 WAT 1422 ATOM 75369 O WAT 1423 138.793 51.300 157.109 1.00 0.00 O ATOM 75370 H1 WAT 1423 139.400 51.192 157.841 1.00 0.00 H ATOM 75371 H2 WAT 1423 138.929 52.200 156.815 1.00 0.00 H TER 75373 WAT 1423 ATOM 75373 O WAT 1424 93.552 2.671 76.685 1.00 0.00 O ATOM 75374 H1 WAT 1424 93.193 3.347 77.259 1.00 0.00 H ATOM 75375 H2 WAT 1424 93.115 2.814 75.845 1.00 0.00 H TER 75377 WAT 1424 ATOM 75377 O WAT 1425 122.350 17.304 0.897 1.00 0.00 O ATOM 75378 H1 WAT 1425 123.176 17.787 0.906 1.00 0.00 H ATOM 75379 H2 WAT 1425 122.412 16.737 0.129 1.00 0.00 H TER 75381 WAT 1425 ATOM 75381 O WAT 1426 36.424 141.011 52.093 1.00 0.00 O ATOM 75382 H1 WAT 1426 35.740 140.503 51.658 1.00 0.00 H ATOM 75383 H2 WAT 1426 36.666 140.485 52.856 1.00 0.00 H TER 75385 WAT 1426 ATOM 75385 O WAT 1427 28.622 125.091 145.938 1.00 0.00 O ATOM 75386 H1 WAT 1427 28.119 125.594 145.297 1.00 0.00 H ATOM 75387 H2 WAT 1427 29.189 124.530 145.409 1.00 0.00 H TER 75389 WAT 1427 ATOM 75389 O WAT 1428 74.768 22.236 20.625 1.00 0.00 O ATOM 75390 H1 WAT 1428 75.645 21.881 20.479 1.00 0.00 H ATOM 75391 H2 WAT 1428 74.806 23.123 20.266 1.00 0.00 H TER 75393 WAT 1428 ATOM 75393 O WAT 1429 69.197 76.475 96.000 1.00 0.00 O ATOM 75394 H1 WAT 1429 70.139 76.339 96.106 1.00 0.00 H ATOM 75395 H2 WAT 1429 68.990 76.067 95.159 1.00 0.00 H TER 75397 WAT 1429 ATOM 75397 O WAT 1430 140.443 62.528 17.477 1.00 0.00 O ATOM 75398 H1 WAT 1430 139.630 62.783 17.913 1.00 0.00 H ATOM 75399 H2 WAT 1430 140.934 63.345 17.389 1.00 0.00 H TER 75401 WAT 1430 ATOM 75401 O WAT 1431 128.239 95.779 18.027 1.00 0.00 O ATOM 75402 H1 WAT 1431 127.992 96.560 18.523 1.00 0.00 H ATOM 75403 H2 WAT 1431 129.082 96.003 17.633 1.00 0.00 H TER 75405 WAT 1431 ATOM 75405 O WAT 1432 8.961 46.776 108.996 1.00 0.00 O ATOM 75406 H1 WAT 1432 8.585 47.310 109.696 1.00 0.00 H ATOM 75407 H2 WAT 1432 8.770 47.265 108.195 1.00 0.00 H TER 75409 WAT 1432 ATOM 75409 O WAT 1433 38.855 4.989 20.411 1.00 0.00 O ATOM 75410 H1 WAT 1433 39.709 5.024 20.842 1.00 0.00 H ATOM 75411 H2 WAT 1433 39.056 4.781 19.499 1.00 0.00 H TER 75413 WAT 1433 ATOM 75413 O WAT 1434 7.706 121.398 132.420 1.00 0.00 O ATOM 75414 H1 WAT 1434 8.236 121.745 133.137 1.00 0.00 H ATOM 75415 H2 WAT 1434 8.282 121.434 131.657 1.00 0.00 H TER 75417 WAT 1434 ATOM 75417 O WAT 1435 23.861 120.640 72.919 1.00 0.00 O ATOM 75418 H1 WAT 1435 24.439 120.559 73.677 1.00 0.00 H ATOM 75419 H2 WAT 1435 23.800 119.751 72.568 1.00 0.00 H TER 75421 WAT 1435 ATOM 75421 O WAT 1436 95.195 131.471 124.659 1.00 0.00 O ATOM 75422 H1 WAT 1436 94.517 130.795 124.660 1.00 0.00 H ATOM 75423 H2 WAT 1436 95.290 131.714 123.739 1.00 0.00 H TER 75425 WAT 1436 ATOM 75425 O WAT 1437 15.244 145.235 86.232 1.00 0.00 O ATOM 75426 H1 WAT 1437 15.948 145.471 86.837 1.00 0.00 H ATOM 75427 H2 WAT 1437 15.640 144.596 85.641 1.00 0.00 H TER 75429 WAT 1437 ATOM 75429 O WAT 1438 63.744 25.923 155.286 1.00 0.00 O ATOM 75430 H1 WAT 1438 62.914 25.930 154.809 1.00 0.00 H ATOM 75431 H2 WAT 1438 63.564 25.409 156.073 1.00 0.00 H TER 75433 WAT 1438 ATOM 75433 O WAT 1439 120.081 65.423 1.617 1.00 0.00 O ATOM 75434 H1 WAT 1439 120.393 64.962 2.396 1.00 0.00 H ATOM 75435 H2 WAT 1439 119.291 65.879 1.908 1.00 0.00 H TER 75437 WAT 1439 ATOM 75437 O WAT 1440 24.654 32.559 109.456 1.00 0.00 O ATOM 75438 H1 WAT 1440 24.108 33.083 110.042 1.00 0.00 H ATOM 75439 H2 WAT 1440 24.062 31.889 109.113 1.00 0.00 H TER 75441 WAT 1440 ATOM 75441 O WAT 1441 51.525 85.384 141.050 1.00 0.00 O ATOM 75442 H1 WAT 1441 50.748 85.934 140.948 1.00 0.00 H ATOM 75443 H2 WAT 1441 51.211 84.494 140.892 1.00 0.00 H TER 75445 WAT 1441 ATOM 75445 O WAT 1442 117.333 110.345 85.732 1.00 0.00 O ATOM 75446 H1 WAT 1442 116.407 110.103 85.722 1.00 0.00 H ATOM 75447 H2 WAT 1442 117.571 110.415 84.807 1.00 0.00 H TER 75449 WAT 1442 ATOM 75449 O WAT 1443 134.311 117.635 156.571 1.00 0.00 O ATOM 75450 H1 WAT 1443 135.016 117.434 155.955 1.00 0.00 H ATOM 75451 H2 WAT 1443 134.695 118.266 157.178 1.00 0.00 H TER 75453 WAT 1443 ATOM 75453 O WAT 1444 124.061 89.036 16.533 1.00 0.00 O ATOM 75454 H1 WAT 1444 124.167 89.732 15.884 1.00 0.00 H ATOM 75455 H2 WAT 1444 124.835 89.110 17.092 1.00 0.00 H TER 75457 WAT 1444 ATOM 75457 O WAT 1445 30.517 123.028 110.313 1.00 0.00 O ATOM 75458 H1 WAT 1445 29.808 122.387 110.258 1.00 0.00 H ATOM 75459 H2 WAT 1445 31.315 122.514 110.186 1.00 0.00 H TER 75461 WAT 1445 ATOM 75461 O WAT 1446 62.307 116.843 110.211 1.00 0.00 O ATOM 75462 H1 WAT 1446 61.937 117.160 111.035 1.00 0.00 H ATOM 75463 H2 WAT 1446 61.614 116.987 109.566 1.00 0.00 H TER 75465 WAT 1446 ATOM 75465 O WAT 1447 23.672 141.136 125.297 1.00 0.00 O ATOM 75466 H1 WAT 1447 23.848 140.199 125.208 1.00 0.00 H ATOM 75467 H2 WAT 1447 23.157 141.208 126.100 1.00 0.00 H TER 75469 WAT 1447 ATOM 75469 O WAT 1448 145.325 89.987 17.679 1.00 0.00 O ATOM 75470 H1 WAT 1448 144.524 90.362 18.044 1.00 0.00 H ATOM 75471 H2 WAT 1448 145.122 89.840 16.755 1.00 0.00 H TER 75473 WAT 1448 ATOM 75473 O WAT 1449 142.898 144.526 86.111 1.00 0.00 O ATOM 75474 H1 WAT 1449 143.383 144.596 85.289 1.00 0.00 H ATOM 75475 H2 WAT 1449 142.596 145.418 86.287 1.00 0.00 H TER 75477 WAT 1449 ATOM 75477 O WAT 1450 96.160 17.972 118.025 1.00 0.00 O ATOM 75478 H1 WAT 1450 96.441 18.206 118.910 1.00 0.00 H ATOM 75479 H2 WAT 1450 95.222 17.801 118.109 1.00 0.00 H TER 75481 WAT 1450 ATOM 75481 O WAT 1451 143.735 67.766 157.684 1.00 0.00 O ATOM 75482 H1 WAT 1451 142.888 67.488 158.033 1.00 0.00 H ATOM 75483 H2 WAT 1451 143.787 68.698 157.895 1.00 0.00 H TER 75485 WAT 1451 ATOM 75485 O WAT 1452 131.462 14.608 14.048 1.00 0.00 O ATOM 75486 H1 WAT 1452 130.927 15.221 14.553 1.00 0.00 H ATOM 75487 H2 WAT 1452 131.148 14.701 13.149 1.00 0.00 H TER 75489 WAT 1452 ATOM 75489 O WAT 1453 2.479 94.693 135.721 1.00 0.00 O ATOM 75490 H1 WAT 1453 1.693 95.236 135.657 1.00 0.00 H ATOM 75491 H2 WAT 1453 2.623 94.591 136.662 1.00 0.00 H TER 75493 WAT 1453 ATOM 75493 O WAT 1454 126.664 141.107 6.488 1.00 0.00 O ATOM 75494 H1 WAT 1454 127.135 140.631 7.171 1.00 0.00 H ATOM 75495 H2 WAT 1454 126.696 142.022 6.768 1.00 0.00 H TER 75497 WAT 1454 ATOM 75497 O WAT 1455 2.232 43.714 61.923 1.00 0.00 O ATOM 75498 H1 WAT 1455 2.394 42.957 61.360 1.00 0.00 H ATOM 75499 H2 WAT 1455 3.049 43.833 62.407 1.00 0.00 H TER 75501 WAT 1455 ATOM 75501 O WAT 1456 26.462 8.963 14.222 1.00 0.00 O ATOM 75502 H1 WAT 1456 26.498 9.919 14.263 1.00 0.00 H ATOM 75503 H2 WAT 1456 25.876 8.715 14.937 1.00 0.00 H TER 75505 WAT 1456 ATOM 75505 O WAT 1457 92.545 76.361 91.781 1.00 0.00 O ATOM 75506 H1 WAT 1457 92.413 76.140 90.859 1.00 0.00 H ATOM 75507 H2 WAT 1457 92.554 75.515 92.231 1.00 0.00 H TER 75509 WAT 1457 ATOM 75509 O WAT 1458 64.374 71.793 122.893 1.00 0.00 O ATOM 75510 H1 WAT 1458 64.673 71.490 123.750 1.00 0.00 H ATOM 75511 H2 WAT 1458 65.150 72.186 122.493 1.00 0.00 H TER 75513 WAT 1458 ATOM 75513 O WAT 1459 61.743 20.755 67.753 1.00 0.00 O ATOM 75514 H1 WAT 1459 61.985 20.287 68.552 1.00 0.00 H ATOM 75515 H2 WAT 1459 62.300 21.533 67.753 1.00 0.00 H TER 75517 WAT 1459 ATOM 75517 O WAT 1460 35.829 105.310 100.796 1.00 0.00 O ATOM 75518 H1 WAT 1460 36.687 105.111 100.421 1.00 0.00 H ATOM 75519 H2 WAT 1460 35.204 105.028 100.128 1.00 0.00 H TER 75521 WAT 1460 ATOM 75521 O WAT 1461 13.512 12.960 14.054 1.00 0.00 O ATOM 75522 H1 WAT 1461 13.098 12.317 14.630 1.00 0.00 H ATOM 75523 H2 WAT 1461 14.406 12.638 13.940 1.00 0.00 H TER 75525 WAT 1461 ATOM 75525 O WAT 1462 143.132 94.945 1.832 1.00 0.00 O ATOM 75526 H1 WAT 1462 142.356 94.818 1.287 1.00 0.00 H ATOM 75527 H2 WAT 1462 142.796 94.960 2.728 1.00 0.00 H TER 75529 WAT 1462 ATOM 75529 O WAT 1463 111.911 121.090 60.491 1.00 0.00 O ATOM 75530 H1 WAT 1463 111.129 121.425 60.053 1.00 0.00 H ATOM 75531 H2 WAT 1463 111.955 120.170 60.230 1.00 0.00 H TER 75533 WAT 1463 ATOM 75533 O WAT 1464 34.525 2.677 76.141 1.00 0.00 O ATOM 75534 H1 WAT 1464 35.157 2.236 75.574 1.00 0.00 H ATOM 75535 H2 WAT 1464 34.846 3.576 76.205 1.00 0.00 H TER 75537 WAT 1464 ATOM 75537 O WAT 1465 115.005 93.012 148.582 1.00 0.00 O ATOM 75538 H1 WAT 1465 114.620 93.150 147.716 1.00 0.00 H ATOM 75539 H2 WAT 1465 114.355 93.361 149.192 1.00 0.00 H TER 75541 WAT 1465 ATOM 75541 O WAT 1466 78.338 68.093 79.464 1.00 0.00 O ATOM 75542 H1 WAT 1466 79.116 68.105 78.906 1.00 0.00 H ATOM 75543 H2 WAT 1466 77.875 68.901 79.244 1.00 0.00 H TER 75545 WAT 1466 ATOM 75545 O WAT 1467 62.475 143.709 81.610 1.00 0.00 O ATOM 75546 H1 WAT 1467 62.586 143.395 82.508 1.00 0.00 H ATOM 75547 H2 WAT 1467 62.886 144.573 81.606 1.00 0.00 H TER 75549 WAT 1467 ATOM 75549 O WAT 1468 53.873 93.346 16.374 1.00 0.00 O ATOM 75550 H1 WAT 1468 54.445 92.579 16.405 1.00 0.00 H ATOM 75551 H2 WAT 1468 53.012 93.013 16.625 1.00 0.00 H TER 75553 WAT 1468 ATOM 75553 O WAT 1469 79.394 112.688 106.023 1.00 0.00 O ATOM 75554 H1 WAT 1469 79.510 113.494 106.526 1.00 0.00 H ATOM 75555 H2 WAT 1469 80.181 112.176 106.206 1.00 0.00 H TER 75557 WAT 1469 ATOM 75557 O WAT 1470 72.172 122.483 115.712 1.00 0.00 O ATOM 75558 H1 WAT 1470 71.248 122.527 115.955 1.00 0.00 H ATOM 75559 H2 WAT 1470 72.165 122.360 114.762 1.00 0.00 H TER 75561 WAT 1470 ATOM 75561 O WAT 1471 75.839 6.268 140.697 1.00 0.00 O ATOM 75562 H1 WAT 1471 76.410 6.503 141.428 1.00 0.00 H ATOM 75563 H2 WAT 1471 75.424 7.092 140.444 1.00 0.00 H TER 75565 WAT 1471 ATOM 75565 O WAT 1472 96.874 24.131 74.217 1.00 0.00 O ATOM 75566 H1 WAT 1472 96.880 24.091 73.261 1.00 0.00 H ATOM 75567 H2 WAT 1472 97.739 23.815 74.476 1.00 0.00 H TER 75569 WAT 1472 ATOM 75569 O WAT 1473 17.106 42.531 94.174 1.00 0.00 O ATOM 75570 H1 WAT 1473 17.150 42.482 93.219 1.00 0.00 H ATOM 75571 H2 WAT 1473 17.093 43.469 94.366 1.00 0.00 H TER 75573 WAT 1473 ATOM 75573 O WAT 1474 12.402 5.830 6.045 1.00 0.00 O ATOM 75574 H1 WAT 1474 12.327 5.153 6.716 1.00 0.00 H ATOM 75575 H2 WAT 1474 13.343 5.987 5.967 1.00 0.00 H TER 75577 WAT 1474 ATOM 75577 O WAT 1475 130.420 56.770 109.532 1.00 0.00 O ATOM 75578 H1 WAT 1475 130.056 57.160 108.738 1.00 0.00 H ATOM 75579 H2 WAT 1475 131.361 56.933 109.469 1.00 0.00 H TER 75581 WAT 1475 ATOM 75581 O WAT 1476 80.744 36.946 130.661 1.00 0.00 O ATOM 75582 H1 WAT 1476 81.641 36.768 130.379 1.00 0.00 H ATOM 75583 H2 WAT 1476 80.282 37.177 129.855 1.00 0.00 H TER 75585 WAT 1476 ATOM 75585 O WAT 1477 13.352 35.623 132.621 1.00 0.00 O ATOM 75586 H1 WAT 1477 13.223 35.395 133.542 1.00 0.00 H ATOM 75587 H2 WAT 1477 12.685 36.286 132.443 1.00 0.00 H TER 75589 WAT 1477 ATOM 75589 O WAT 1478 57.252 15.287 143.281 1.00 0.00 O ATOM 75590 H1 WAT 1478 56.804 14.833 142.568 1.00 0.00 H ATOM 75591 H2 WAT 1478 58.168 15.321 143.005 1.00 0.00 H TER 75593 WAT 1478 ATOM 75593 O WAT 1479 103.789 133.777 90.265 1.00 0.00 O ATOM 75594 H1 WAT 1479 102.979 133.324 90.499 1.00 0.00 H ATOM 75595 H2 WAT 1479 104.125 133.294 89.510 1.00 0.00 H TER 75597 WAT 1479 ATOM 75597 O WAT 1480 111.599 86.538 68.399 1.00 0.00 O ATOM 75598 H1 WAT 1480 111.008 85.786 68.427 1.00 0.00 H ATOM 75599 H2 WAT 1480 111.343 87.015 67.609 1.00 0.00 H TER 75601 WAT 1480 ATOM 75601 O WAT 1481 72.365 81.957 131.095 1.00 0.00 O ATOM 75602 H1 WAT 1481 71.908 82.692 131.505 1.00 0.00 H ATOM 75603 H2 WAT 1481 73.293 82.152 131.220 1.00 0.00 H TER 75605 WAT 1481 ATOM 75605 O WAT 1482 134.531 37.713 126.977 1.00 0.00 O ATOM 75606 H1 WAT 1482 133.930 37.348 126.328 1.00 0.00 H ATOM 75607 H2 WAT 1482 135.218 38.132 126.459 1.00 0.00 H TER 75609 WAT 1482 ATOM 75609 O WAT 1483 103.642 50.390 94.068 1.00 0.00 O ATOM 75610 H1 WAT 1483 103.515 50.839 93.232 1.00 0.00 H ATOM 75611 H2 WAT 1483 104.514 50.001 94.000 1.00 0.00 H TER 75613 WAT 1483 ATOM 75613 O WAT 1484 41.900 91.733 141.836 1.00 0.00 O ATOM 75614 H1 WAT 1484 42.336 91.412 141.046 1.00 0.00 H ATOM 75615 H2 WAT 1484 42.293 92.591 141.994 1.00 0.00 H TER 75617 WAT 1484 ATOM 75617 O WAT 1485 43.976 42.374 0.066 1.00 0.00 O ATOM 75618 H1 WAT 1485 44.198 43.259 -0.222 1.00 0.00 H ATOM 75619 H2 WAT 1485 44.801 42.014 0.392 1.00 0.00 H TER 75621 WAT 1485 ATOM 75621 O WAT 1486 69.822 87.618 150.180 1.00 0.00 O ATOM 75622 H1 WAT 1486 69.171 88.214 150.551 1.00 0.00 H ATOM 75623 H2 WAT 1486 70.435 88.190 149.719 1.00 0.00 H TER 75625 WAT 1486 ATOM 75625 O WAT 1487 68.619 137.726 111.717 1.00 0.00 O ATOM 75626 H1 WAT 1487 69.378 137.161 111.860 1.00 0.00 H ATOM 75627 H2 WAT 1487 67.909 137.297 112.195 1.00 0.00 H TER 75629 WAT 1487 ATOM 75629 O WAT 1488 81.104 11.997 87.943 1.00 0.00 O ATOM 75630 H1 WAT 1488 81.200 12.938 87.793 1.00 0.00 H ATOM 75631 H2 WAT 1488 81.773 11.597 87.388 1.00 0.00 H TER 75633 WAT 1488 ATOM 75633 O WAT 1489 50.516 26.210 131.956 1.00 0.00 O ATOM 75634 H1 WAT 1489 50.587 25.839 132.836 1.00 0.00 H ATOM 75635 H2 WAT 1489 51.338 25.969 131.528 1.00 0.00 H TER 75637 WAT 1489 ATOM 75637 O WAT 1490 118.970 5.297 4.096 1.00 0.00 O ATOM 75638 H1 WAT 1490 118.555 5.226 3.236 1.00 0.00 H ATOM 75639 H2 WAT 1490 118.278 5.066 4.715 1.00 0.00 H TER 75641 WAT 1490 ATOM 75641 O WAT 1491 26.986 34.025 79.750 1.00 0.00 O ATOM 75642 H1 WAT 1491 26.766 34.423 78.907 1.00 0.00 H ATOM 75643 H2 WAT 1491 27.886 33.717 79.641 1.00 0.00 H TER 75645 WAT 1491 ATOM 75645 O WAT 1492 6.833 120.166 123.283 1.00 0.00 O ATOM 75646 H1 WAT 1492 6.422 119.741 122.531 1.00 0.00 H ATOM 75647 H2 WAT 1492 7.667 120.494 122.947 1.00 0.00 H TER 75649 WAT 1492 ATOM 75649 O WAT 1493 86.990 26.565 67.129 1.00 0.00 O ATOM 75650 H1 WAT 1493 86.563 25.731 67.325 1.00 0.00 H ATOM 75651 H2 WAT 1493 87.926 26.379 67.210 1.00 0.00 H TER 75653 WAT 1493 ATOM 75653 O WAT 1494 109.321 8.850 78.020 1.00 0.00 O ATOM 75654 H1 WAT 1494 109.852 9.151 78.758 1.00 0.00 H ATOM 75655 H2 WAT 1494 109.048 7.966 78.266 1.00 0.00 H TER 75657 WAT 1494 ATOM 75657 O WAT 1495 123.048 146.000 92.943 1.00 0.00 O ATOM 75658 H1 WAT 1495 123.519 145.769 92.142 1.00 0.00 H ATOM 75659 H2 WAT 1495 122.150 145.710 92.784 1.00 0.00 H TER 75661 WAT 1495 ATOM 75661 O WAT 1496 88.156 50.928 90.269 1.00 0.00 O ATOM 75662 H1 WAT 1496 87.709 51.120 89.444 1.00 0.00 H ATOM 75663 H2 WAT 1496 87.626 51.364 90.936 1.00 0.00 H TER 75665 WAT 1496 ATOM 75665 O WAT 1497 38.670 7.684 107.451 1.00 0.00 O ATOM 75666 H1 WAT 1497 38.403 7.587 106.537 1.00 0.00 H ATOM 75667 H2 WAT 1497 39.012 6.823 107.693 1.00 0.00 H TER 75669 WAT 1497 ATOM 75669 O WAT 1498 19.602 54.908 146.276 1.00 0.00 O ATOM 75670 H1 WAT 1498 20.521 54.766 146.052 1.00 0.00 H ATOM 75671 H2 WAT 1498 19.605 55.702 146.811 1.00 0.00 H TER 75673 WAT 1498 ATOM 75673 O WAT 1499 36.240 140.903 9.143 1.00 0.00 O ATOM 75674 H1 WAT 1499 36.944 141.372 8.695 1.00 0.00 H ATOM 75675 H2 WAT 1499 36.034 141.449 9.902 1.00 0.00 H TER 75677 WAT 1499 ATOM 75677 O WAT 1500 11.982 29.608 66.923 1.00 0.00 O ATOM 75678 H1 WAT 1500 12.004 28.833 67.484 1.00 0.00 H ATOM 75679 H2 WAT 1500 11.536 29.316 66.128 1.00 0.00 H TER 75681 WAT 1500 ATOM 75681 O WAT 1501 90.404 134.712 92.570 1.00 0.00 O ATOM 75682 H1 WAT 1501 89.601 134.954 93.031 1.00 0.00 H ATOM 75683 H2 WAT 1501 90.116 134.104 91.889 1.00 0.00 H TER 75685 WAT 1501 ATOM 75685 O WAT 1502 43.497 14.171 14.391 1.00 0.00 O ATOM 75686 H1 WAT 1502 43.099 15.041 14.433 1.00 0.00 H ATOM 75687 H2 WAT 1502 44.438 14.335 14.445 1.00 0.00 H TER 75689 WAT 1502 ATOM 75689 O WAT 1503 127.853 126.716 93.931 1.00 0.00 O ATOM 75690 H1 WAT 1503 128.233 127.083 93.133 1.00 0.00 H ATOM 75691 H2 WAT 1503 126.958 127.056 93.950 1.00 0.00 H TER 75693 WAT 1503 ATOM 75693 O WAT 1504 58.662 98.678 118.269 1.00 0.00 O ATOM 75694 H1 WAT 1504 58.582 97.828 118.703 1.00 0.00 H ATOM 75695 H2 WAT 1504 57.767 98.902 118.015 1.00 0.00 H TER 75697 WAT 1504 ATOM 75697 O WAT 1505 141.720 32.727 99.158 1.00 0.00 O ATOM 75698 H1 WAT 1505 142.404 32.863 98.503 1.00 0.00 H ATOM 75699 H2 WAT 1505 142.180 32.772 99.997 1.00 0.00 H TER 75701 WAT 1505 ATOM 75701 O WAT 1506 129.385 114.023 158.853 1.00 0.00 O ATOM 75702 H1 WAT 1506 129.999 114.754 158.776 1.00 0.00 H ATOM 75703 H2 WAT 1506 129.564 113.479 158.086 1.00 0.00 H TER 75705 WAT 1506 ATOM 75705 O WAT 1507 112.155 131.204 133.305 1.00 0.00 O ATOM 75706 H1 WAT 1507 112.253 130.379 133.780 1.00 0.00 H ATOM 75707 H2 WAT 1507 111.646 130.973 132.527 1.00 0.00 H TER 75709 WAT 1507 ATOM 75709 O WAT 1508 123.530 139.012 121.738 1.00 0.00 O ATOM 75710 H1 WAT 1508 123.445 138.443 120.974 1.00 0.00 H ATOM 75711 H2 WAT 1508 122.695 139.479 121.783 1.00 0.00 H TER 75713 WAT 1508 ATOM 75713 O WAT 1509 127.209 72.479 104.965 1.00 0.00 O ATOM 75714 H1 WAT 1509 127.056 72.987 105.761 1.00 0.00 H ATOM 75715 H2 WAT 1509 128.142 72.267 104.992 1.00 0.00 H TER 75717 WAT 1509 ATOM 75717 O WAT 1510 65.538 115.017 21.782 1.00 0.00 O ATOM 75718 H1 WAT 1510 65.976 115.768 22.183 1.00 0.00 H ATOM 75719 H2 WAT 1510 65.388 115.285 20.875 1.00 0.00 H TER 75721 WAT 1510 ATOM 75721 O WAT 1511 63.644 3.595 133.243 1.00 0.00 O ATOM 75722 H1 WAT 1511 64.597 3.540 133.166 1.00 0.00 H ATOM 75723 H2 WAT 1511 63.315 3.168 132.452 1.00 0.00 H TER 75725 WAT 1511 ATOM 75725 O WAT 1512 49.915 90.626 14.395 1.00 0.00 O ATOM 75726 H1 WAT 1512 50.865 90.741 14.433 1.00 0.00 H ATOM 75727 H2 WAT 1512 49.756 90.236 13.536 1.00 0.00 H TER 75729 WAT 1512 ATOM 75729 O WAT 1513 48.487 51.624 137.856 1.00 0.00 O ATOM 75730 H1 WAT 1513 48.448 52.437 137.352 1.00 0.00 H ATOM 75731 H2 WAT 1513 48.045 50.979 137.304 1.00 0.00 H TER 75733 WAT 1513 ATOM 75733 O WAT 1514 17.082 138.916 110.845 1.00 0.00 O ATOM 75734 H1 WAT 1514 16.521 139.690 110.794 1.00 0.00 H ATOM 75735 H2 WAT 1514 17.865 139.156 110.349 1.00 0.00 H TER 75737 WAT 1514 ATOM 75737 O WAT 1515 77.871 18.678 78.019 1.00 0.00 O ATOM 75738 H1 WAT 1515 77.314 19.435 77.835 1.00 0.00 H ATOM 75739 H2 WAT 1515 77.449 17.953 77.558 1.00 0.00 H TER 75741 WAT 1515 ATOM 75741 O WAT 1516 116.206 77.987 99.087 1.00 0.00 O ATOM 75742 H1 WAT 1516 116.983 77.659 99.538 1.00 0.00 H ATOM 75743 H2 WAT 1516 116.525 78.258 98.226 1.00 0.00 H TER 75745 WAT 1516 ATOM 75745 O WAT 1517 61.603 139.236 81.019 1.00 0.00 O ATOM 75746 H1 WAT 1517 61.337 140.152 80.939 1.00 0.00 H ATOM 75747 H2 WAT 1517 62.476 139.206 80.627 1.00 0.00 H TER 75749 WAT 1517 ATOM 75749 O WAT 1518 111.693 36.616 69.976 1.00 0.00 O ATOM 75750 H1 WAT 1518 111.882 36.427 69.057 1.00 0.00 H ATOM 75751 H2 WAT 1518 111.879 37.550 70.071 1.00 0.00 H TER 75753 WAT 1518 ATOM 75753 O WAT 1519 55.952 114.244 108.873 1.00 0.00 O ATOM 75754 H1 WAT 1519 56.356 113.410 108.633 1.00 0.00 H ATOM 75755 H2 WAT 1519 56.661 114.747 109.274 1.00 0.00 H TER 75757 WAT 1519 ATOM 75757 O WAT 1520 80.806 26.105 135.362 1.00 0.00 O ATOM 75758 H1 WAT 1520 81.634 26.160 134.885 1.00 0.00 H ATOM 75759 H2 WAT 1520 81.056 26.168 136.284 1.00 0.00 H TER 75761 WAT 1520 ATOM 75761 O WAT 1521 70.806 72.846 122.754 1.00 0.00 O ATOM 75762 H1 WAT 1521 70.027 73.250 122.373 1.00 0.00 H ATOM 75763 H2 WAT 1521 70.463 72.205 123.376 1.00 0.00 H TER 75765 WAT 1521 ATOM 75765 O WAT 1522 9.649 88.083 157.120 1.00 0.00 O ATOM 75766 H1 WAT 1522 8.838 87.975 157.617 1.00 0.00 H ATOM 75767 H2 WAT 1522 10.285 88.395 157.763 1.00 0.00 H TER 75769 WAT 1522 ATOM 75769 O WAT 1523 132.114 53.324 117.446 1.00 0.00 O ATOM 75770 H1 WAT 1523 131.623 53.180 118.255 1.00 0.00 H ATOM 75771 H2 WAT 1523 132.691 52.564 117.378 1.00 0.00 H TER 75773 WAT 1523 ATOM 75773 O WAT 1524 129.279 140.003 73.942 1.00 0.00 O ATOM 75774 H1 WAT 1524 129.852 140.448 74.566 1.00 0.00 H ATOM 75775 H2 WAT 1524 128.601 139.600 74.484 1.00 0.00 H TER 75777 WAT 1524 ATOM 75777 O WAT 1525 129.067 68.873 85.332 1.00 0.00 O ATOM 75778 H1 WAT 1525 129.552 68.071 85.530 1.00 0.00 H ATOM 75779 H2 WAT 1525 129.566 69.567 85.762 1.00 0.00 H TER 75781 WAT 1525 ATOM 75781 O WAT 1526 54.473 98.151 143.646 1.00 0.00 O ATOM 75782 H1 WAT 1526 53.652 98.637 143.716 1.00 0.00 H ATOM 75783 H2 WAT 1526 54.616 98.057 142.704 1.00 0.00 H TER 75785 WAT 1526 ATOM 75785 O WAT 1527 1.466 80.277 115.790 1.00 0.00 O ATOM 75786 H1 WAT 1527 2.178 80.613 115.247 1.00 0.00 H ATOM 75787 H2 WAT 1527 0.750 80.116 115.175 1.00 0.00 H TER 75789 WAT 1527 ATOM 75789 O WAT 1528 23.994 55.273 58.591 1.00 0.00 O ATOM 75790 H1 WAT 1528 23.661 54.666 57.931 1.00 0.00 H ATOM 75791 H2 WAT 1528 24.774 54.843 58.941 1.00 0.00 H TER 75793 WAT 1528 ATOM 75793 O WAT 1529 56.604 72.110 83.583 1.00 0.00 O ATOM 75794 H1 WAT 1529 55.976 72.508 82.980 1.00 0.00 H ATOM 75795 H2 WAT 1529 56.634 72.711 84.327 1.00 0.00 H TER 75797 WAT 1529 ATOM 75797 O WAT 1530 87.422 69.453 129.945 1.00 0.00 O ATOM 75798 H1 WAT 1530 87.309 69.068 130.814 1.00 0.00 H ATOM 75799 H2 WAT 1530 86.592 69.897 129.770 1.00 0.00 H TER 75801 WAT 1530 ATOM 75801 O WAT 1531 130.258 9.076 78.492 1.00 0.00 O ATOM 75802 H1 WAT 1531 129.836 8.219 78.546 1.00 0.00 H ATOM 75803 H2 WAT 1531 130.070 9.490 79.334 1.00 0.00 H TER 75805 WAT 1531 ATOM 75805 O WAT 1532 34.557 63.716 146.127 1.00 0.00 O ATOM 75806 H1 WAT 1532 34.598 63.610 145.176 1.00 0.00 H ATOM 75807 H2 WAT 1532 35.455 63.565 146.424 1.00 0.00 H TER 75809 WAT 1532 ATOM 75809 O WAT 1533 119.160 9.398 101.213 1.00 0.00 O ATOM 75810 H1 WAT 1533 120.102 9.560 101.269 1.00 0.00 H ATOM 75811 H2 WAT 1533 118.792 10.227 100.908 1.00 0.00 H TER 75813 WAT 1533 ATOM 75813 O WAT 1534 63.343 7.269 9.546 1.00 0.00 O ATOM 75814 H1 WAT 1534 63.558 7.299 8.614 1.00 0.00 H ATOM 75815 H2 WAT 1534 63.210 6.340 9.732 1.00 0.00 H TER 75817 WAT 1534 ATOM 75817 O WAT 1535 40.552 78.035 122.992 1.00 0.00 O ATOM 75818 H1 WAT 1535 39.712 78.475 122.861 1.00 0.00 H ATOM 75819 H2 WAT 1535 40.633 77.446 122.242 1.00 0.00 H TER 75821 WAT 1535 ATOM 75821 O WAT 1536 34.012 38.676 66.202 1.00 0.00 O ATOM 75822 H1 WAT 1536 34.822 39.170 66.075 1.00 0.00 H ATOM 75823 H2 WAT 1536 34.126 38.241 67.047 1.00 0.00 H TER 75825 WAT 1536 ATOM 75825 O WAT 1537 131.968 69.117 71.674 1.00 0.00 O ATOM 75826 H1 WAT 1537 131.395 68.480 72.101 1.00 0.00 H ATOM 75827 H2 WAT 1537 132.698 68.597 71.339 1.00 0.00 H TER 75829 WAT 1537 ATOM 75829 O WAT 1538 63.601 107.000 106.338 1.00 0.00 O ATOM 75830 H1 WAT 1538 62.848 107.096 106.921 1.00 0.00 H ATOM 75831 H2 WAT 1538 64.354 107.236 106.880 1.00 0.00 H TER 75833 WAT 1538 ATOM 75833 O WAT 1539 142.647 144.768 132.758 1.00 0.00 O ATOM 75834 H1 WAT 1539 143.475 144.943 132.311 1.00 0.00 H ATOM 75835 H2 WAT 1539 142.222 145.624 132.819 1.00 0.00 H TER 75837 WAT 1539 ATOM 75837 O WAT 1540 82.819 121.501 78.311 1.00 0.00 O ATOM 75838 H1 WAT 1540 82.755 120.858 77.606 1.00 0.00 H ATOM 75839 H2 WAT 1540 83.724 121.810 78.273 1.00 0.00 H TER 75841 WAT 1540 ATOM 75841 O WAT 1541 133.141 137.540 90.673 1.00 0.00 O ATOM 75842 H1 WAT 1541 132.752 137.296 91.513 1.00 0.00 H ATOM 75843 H2 WAT 1541 133.280 136.707 90.222 1.00 0.00 H TER 75845 WAT 1541 ATOM 75845 O WAT 1542 49.054 50.663 109.806 1.00 0.00 O ATOM 75846 H1 WAT 1542 50.005 50.668 109.914 1.00 0.00 H ATOM 75847 H2 WAT 1542 48.741 51.332 110.415 1.00 0.00 H TER 75849 WAT 1542 ATOM 75849 O WAT 1543 142.789 72.284 110.700 1.00 0.00 O ATOM 75850 H1 WAT 1543 142.328 73.122 110.746 1.00 0.00 H ATOM 75851 H2 WAT 1543 143.664 72.474 111.038 1.00 0.00 H TER 75853 WAT 1543 ATOM 75853 O WAT 1544 87.974 58.728 63.702 1.00 0.00 O ATOM 75854 H1 WAT 1544 87.288 58.933 64.337 1.00 0.00 H ATOM 75855 H2 WAT 1544 87.926 57.778 63.596 1.00 0.00 H TER 75857 WAT 1544 ATOM 75857 O WAT 1545 127.344 44.050 1.807 1.00 0.00 O ATOM 75858 H1 WAT 1545 128.169 43.620 2.030 1.00 0.00 H ATOM 75859 H2 WAT 1545 127.008 44.373 2.643 1.00 0.00 H TER 75861 WAT 1545 ATOM 75861 O WAT 1546 67.456 86.753 19.106 1.00 0.00 O ATOM 75862 H1 WAT 1546 67.956 86.034 18.720 1.00 0.00 H ATOM 75863 H2 WAT 1546 68.040 87.509 19.046 1.00 0.00 H TER 75865 WAT 1546 ATOM 75865 O WAT 1547 144.078 45.781 133.779 1.00 0.00 O ATOM 75866 H1 WAT 1547 144.742 46.468 133.719 1.00 0.00 H ATOM 75867 H2 WAT 1547 143.567 46.010 134.555 1.00 0.00 H TER 75869 WAT 1547 ATOM 75869 O WAT 1548 69.720 2.759 140.396 1.00 0.00 O ATOM 75870 H1 WAT 1548 70.176 3.556 140.666 1.00 0.00 H ATOM 75871 H2 WAT 1548 69.606 2.261 141.205 1.00 0.00 H TER 75873 WAT 1548 ATOM 75873 O WAT 1549 53.035 118.177 147.080 1.00 0.00 O ATOM 75874 H1 WAT 1549 52.238 117.647 147.077 1.00 0.00 H ATOM 75875 H2 WAT 1549 52.778 118.999 146.664 1.00 0.00 H TER 75877 WAT 1549 ATOM 75877 O WAT 1550 115.973 10.357 12.214 1.00 0.00 O ATOM 75878 H1 WAT 1550 115.059 10.158 12.418 1.00 0.00 H ATOM 75879 H2 WAT 1550 115.941 10.770 11.351 1.00 0.00 H TER 75881 WAT 1550 ATOM 75881 O WAT 1551 84.916 1.665 97.592 1.00 0.00 O ATOM 75882 H1 WAT 1551 84.402 1.960 98.344 1.00 0.00 H ATOM 75883 H2 WAT 1551 85.437 0.936 97.929 1.00 0.00 H TER 75885 WAT 1551 ATOM 75885 O WAT 1552 108.623 124.933 107.347 1.00 0.00 O ATOM 75886 H1 WAT 1552 107.950 124.288 107.128 1.00 0.00 H ATOM 75887 H2 WAT 1552 109.140 124.515 108.035 1.00 0.00 H TER 75889 WAT 1552 ATOM 75889 O WAT 1553 22.839 117.991 3.670 1.00 0.00 O ATOM 75890 H1 WAT 1553 22.208 118.500 4.179 1.00 0.00 H ATOM 75891 H2 WAT 1553 23.684 118.401 3.857 1.00 0.00 H TER 75893 WAT 1553 ATOM 75893 O WAT 1554 51.035 100.004 106.302 1.00 0.00 O ATOM 75894 H1 WAT 1554 51.494 99.165 106.264 1.00 0.00 H ATOM 75895 H2 WAT 1554 51.615 100.572 106.809 1.00 0.00 H TER 75897 WAT 1554 ATOM 75897 O WAT 1555 116.870 135.405 158.552 1.00 0.00 O ATOM 75898 H1 WAT 1555 116.267 135.230 159.275 1.00 0.00 H ATOM 75899 H2 WAT 1555 116.926 136.359 158.512 1.00 0.00 H TER 75901 WAT 1555 ATOM 75901 O WAT 1556 106.600 0.971 93.668 1.00 0.00 O ATOM 75902 H1 WAT 1556 106.197 0.115 93.518 1.00 0.00 H ATOM 75903 H2 WAT 1556 105.937 1.600 93.384 1.00 0.00 H TER 75905 WAT 1556 ATOM 75905 O WAT 1557 26.949 65.234 114.518 1.00 0.00 O ATOM 75906 H1 WAT 1557 26.066 64.905 114.350 1.00 0.00 H ATOM 75907 H2 WAT 1557 26.914 66.156 114.263 1.00 0.00 H TER 75909 WAT 1557 ATOM 75909 O WAT 1558 119.810 132.990 137.186 1.00 0.00 O ATOM 75910 H1 WAT 1558 119.343 133.764 137.502 1.00 0.00 H ATOM 75911 H2 WAT 1558 119.205 132.582 136.567 1.00 0.00 H TER 75913 WAT 1558 ATOM 75913 O WAT 1559 62.814 45.920 126.950 1.00 0.00 O ATOM 75914 H1 WAT 1559 62.591 45.284 127.630 1.00 0.00 H ATOM 75915 H2 WAT 1559 62.172 46.622 127.059 1.00 0.00 H TER 75917 WAT 1559 ATOM 75917 O WAT 1560 29.058 13.264 122.616 1.00 0.00 O ATOM 75918 H1 WAT 1560 28.900 13.711 121.784 1.00 0.00 H ATOM 75919 H2 WAT 1560 29.199 12.349 122.374 1.00 0.00 H TER 75921 WAT 1560 ATOM 75921 O WAT 1561 95.748 110.173 82.029 1.00 0.00 O ATOM 75922 H1 WAT 1561 96.034 109.775 82.851 1.00 0.00 H ATOM 75923 H2 WAT 1561 95.011 109.633 81.745 1.00 0.00 H TER 75925 WAT 1561 ATOM 75925 O WAT 1562 120.367 83.759 71.165 1.00 0.00 O ATOM 75926 H1 WAT 1562 119.751 83.182 70.715 1.00 0.00 H ATOM 75927 H2 WAT 1562 121.176 83.251 71.218 1.00 0.00 H TER 75929 WAT 1562 ATOM 75929 O WAT 1563 45.376 136.215 137.141 1.00 0.00 O ATOM 75930 H1 WAT 1563 45.236 136.516 138.039 1.00 0.00 H ATOM 75931 H2 WAT 1563 45.021 136.918 136.595 1.00 0.00 H TER 75933 WAT 1563 ATOM 75933 O WAT 1564 35.246 6.952 59.638 1.00 0.00 O ATOM 75934 H1 WAT 1564 34.897 7.814 59.865 1.00 0.00 H ATOM 75935 H2 WAT 1564 35.727 7.095 58.823 1.00 0.00 H TER 75937 WAT 1564 ATOM 75937 O WAT 1565 78.466 77.715 110.399 1.00 0.00 O ATOM 75938 H1 WAT 1565 79.423 77.735 110.421 1.00 0.00 H ATOM 75939 H2 WAT 1565 78.205 77.715 111.320 1.00 0.00 H TER 75941 WAT 1565 ATOM 75941 O WAT 1566 72.063 68.671 82.168 1.00 0.00 O ATOM 75942 H1 WAT 1566 72.525 69.502 82.278 1.00 0.00 H ATOM 75943 H2 WAT 1566 71.983 68.565 81.220 1.00 0.00 H TER 75945 WAT 1566 ATOM 75945 O WAT 1567 83.041 92.543 134.515 1.00 0.00 O ATOM 75946 H1 WAT 1567 83.476 92.364 133.682 1.00 0.00 H ATOM 75947 H2 WAT 1567 83.278 91.803 135.073 1.00 0.00 H TER 75949 WAT 1567 ATOM 75949 O WAT 1568 33.173 28.058 17.843 1.00 0.00 O ATOM 75950 H1 WAT 1568 33.502 28.826 18.309 1.00 0.00 H ATOM 75951 H2 WAT 1568 33.759 27.349 18.107 1.00 0.00 H TER 75953 WAT 1568 ATOM 75953 O WAT 1569 134.479 66.853 24.550 1.00 0.00 O ATOM 75954 H1 WAT 1569 135.275 67.078 24.069 1.00 0.00 H ATOM 75955 H2 WAT 1569 133.770 67.004 23.925 1.00 0.00 H TER 75957 WAT 1569 ATOM 75957 O WAT 1570 106.027 32.584 87.239 1.00 0.00 O ATOM 75958 H1 WAT 1570 106.526 32.797 86.451 1.00 0.00 H ATOM 75959 H2 WAT 1570 106.364 33.184 87.905 1.00 0.00 H TER 75961 WAT 1570 ATOM 75961 O WAT 1571 137.277 124.367 11.900 1.00 0.00 O ATOM 75962 H1 WAT 1571 136.858 123.533 12.113 1.00 0.00 H ATOM 75963 H2 WAT 1571 137.598 124.695 12.740 1.00 0.00 H TER 75965 WAT 1571 ATOM 75965 O WAT 1572 37.480 114.576 103.291 1.00 0.00 O ATOM 75966 H1 WAT 1572 37.545 113.624 103.223 1.00 0.00 H ATOM 75967 H2 WAT 1572 37.923 114.789 104.113 1.00 0.00 H TER 75969 WAT 1572 ATOM 75969 O WAT 1573 68.573 22.074 76.657 1.00 0.00 O ATOM 75970 H1 WAT 1573 68.153 21.709 75.878 1.00 0.00 H ATOM 75971 H2 WAT 1573 68.840 22.955 76.394 1.00 0.00 H TER 75973 WAT 1573 ATOM 75973 O WAT 1574 117.554 92.325 10.618 1.00 0.00 O ATOM 75974 H1 WAT 1574 118.168 91.693 10.246 1.00 0.00 H ATOM 75975 H2 WAT 1574 117.813 93.164 10.237 1.00 0.00 H TER 75977 WAT 1574 ATOM 75977 O WAT 1575 78.317 22.679 152.078 1.00 0.00 O ATOM 75978 H1 WAT 1575 78.764 22.074 152.670 1.00 0.00 H ATOM 75979 H2 WAT 1575 77.478 22.256 151.893 1.00 0.00 H TER 75981 WAT 1575 ATOM 75981 O WAT 1576 36.399 52.067 104.688 1.00 0.00 O ATOM 75982 H1 WAT 1576 35.706 51.452 104.448 1.00 0.00 H ATOM 75983 H2 WAT 1576 36.453 52.007 105.641 1.00 0.00 H TER 75985 WAT 1576 ATOM 75985 O WAT 1577 26.850 129.062 94.233 1.00 0.00 O ATOM 75986 H1 WAT 1577 27.626 129.613 94.123 1.00 0.00 H ATOM 75987 H2 WAT 1577 26.491 128.975 93.351 1.00 0.00 H TER 75989 WAT 1577 ATOM 75989 O WAT 1578 19.875 56.563 65.113 1.00 0.00 O ATOM 75990 H1 WAT 1578 19.335 56.585 65.904 1.00 0.00 H ATOM 75991 H2 WAT 1578 19.442 57.168 64.511 1.00 0.00 H TER 75993 WAT 1578 ATOM 75993 O WAT 1579 112.849 140.123 101.857 1.00 0.00 O ATOM 75994 H1 WAT 1579 112.364 139.675 101.163 1.00 0.00 H ATOM 75995 H2 WAT 1579 112.462 140.998 101.893 1.00 0.00 H TER 75997 WAT 1579 ATOM 75997 O WAT 1580 90.642 48.354 64.649 1.00 0.00 O ATOM 75998 H1 WAT 1580 91.265 47.629 64.692 1.00 0.00 H ATOM 75999 H2 WAT 1580 90.711 48.678 63.751 1.00 0.00 H TER 76001 WAT 1580 ATOM 76001 O WAT 1581 18.248 10.786 63.494 1.00 0.00 O ATOM 76002 H1 WAT 1581 17.454 11.295 63.653 1.00 0.00 H ATOM 76003 H2 WAT 1581 18.012 10.189 62.783 1.00 0.00 H TER 76005 WAT 1581 ATOM 76005 O WAT 1582 133.967 23.625 153.654 1.00 0.00 O ATOM 76006 H1 WAT 1582 133.599 24.193 154.331 1.00 0.00 H ATOM 76007 H2 WAT 1582 133.759 22.738 153.946 1.00 0.00 H TER 76009 WAT 1582 ATOM 76009 O WAT 1583 115.582 82.341 141.113 1.00 0.00 O ATOM 76010 H1 WAT 1583 114.672 82.123 141.311 1.00 0.00 H ATOM 76011 H2 WAT 1583 116.041 81.501 141.136 1.00 0.00 H TER 76013 WAT 1583 ATOM 76013 O WAT 1584 40.304 81.293 67.013 1.00 0.00 O ATOM 76014 H1 WAT 1584 40.152 81.070 67.932 1.00 0.00 H ATOM 76015 H2 WAT 1584 41.042 80.742 66.752 1.00 0.00 H TER 76017 WAT 1584 ATOM 76017 O WAT 1585 118.999 93.320 151.611 1.00 0.00 O ATOM 76018 H1 WAT 1585 118.322 92.645 151.635 1.00 0.00 H ATOM 76019 H2 WAT 1585 119.746 92.928 152.064 1.00 0.00 H TER 76021 WAT 1585 ATOM 76021 O WAT 1586 138.434 15.730 113.737 1.00 0.00 O ATOM 76022 H1 WAT 1586 139.315 15.361 113.671 1.00 0.00 H ATOM 76023 H2 WAT 1586 138.390 16.372 113.028 1.00 0.00 H TER 76025 WAT 1586 ATOM 76025 O WAT 1587 13.755 88.887 1.691 1.00 0.00 O ATOM 76026 H1 WAT 1587 14.021 89.768 1.426 1.00 0.00 H ATOM 76027 H2 WAT 1587 14.269 88.304 1.133 1.00 0.00 H TER 76029 WAT 1587 ATOM 76029 O WAT 1588 67.950 113.501 124.321 1.00 0.00 O ATOM 76030 H1 WAT 1588 67.250 113.753 123.719 1.00 0.00 H ATOM 76031 H2 WAT 1588 67.498 113.073 125.048 1.00 0.00 H TER 76033 WAT 1588 ATOM 76033 O WAT 1589 23.356 107.077 97.539 1.00 0.00 O ATOM 76034 H1 WAT 1589 22.731 106.438 97.197 1.00 0.00 H ATOM 76035 H2 WAT 1589 23.371 107.773 96.883 1.00 0.00 H TER 76037 WAT 1589 ATOM 76037 O WAT 1590 78.754 120.151 127.350 1.00 0.00 O ATOM 76038 H1 WAT 1590 78.281 119.638 128.004 1.00 0.00 H ATOM 76039 H2 WAT 1590 78.089 120.726 126.969 1.00 0.00 H TER 76041 WAT 1590 ATOM 76041 O WAT 1591 99.726 18.356 88.034 1.00 0.00 O ATOM 76042 H1 WAT 1591 100.580 18.424 87.606 1.00 0.00 H ATOM 76043 H2 WAT 1591 99.868 18.715 88.910 1.00 0.00 H TER 76045 WAT 1591 ATOM 76045 O WAT 1592 22.059 42.397 90.438 1.00 0.00 O ATOM 76046 H1 WAT 1592 22.996 42.567 90.537 1.00 0.00 H ATOM 76047 H2 WAT 1592 21.930 42.314 89.493 1.00 0.00 H TER 76049 WAT 1592 ATOM 76049 O WAT 1593 78.744 52.928 67.583 1.00 0.00 O ATOM 76050 H1 WAT 1593 77.859 53.235 67.386 1.00 0.00 H ATOM 76051 H2 WAT 1593 79.067 53.538 68.247 1.00 0.00 H TER 76053 WAT 1593 ATOM 76053 O WAT 1594 92.373 60.826 120.738 1.00 0.00 O ATOM 76054 H1 WAT 1594 92.210 60.534 121.635 1.00 0.00 H ATOM 76055 H2 WAT 1594 93.318 60.971 120.701 1.00 0.00 H TER 76057 WAT 1594 ATOM 76057 O WAT 1595 7.217 11.110 6.262 1.00 0.00 O ATOM 76058 H1 WAT 1595 6.922 11.987 6.017 1.00 0.00 H ATOM 76059 H2 WAT 1595 8.160 11.119 6.093 1.00 0.00 H TER 76061 WAT 1595 ATOM 76061 O WAT 1596 122.601 62.404 110.744 1.00 0.00 O ATOM 76062 H1 WAT 1596 122.895 62.896 111.510 1.00 0.00 H ATOM 76063 H2 WAT 1596 121.655 62.547 110.715 1.00 0.00 H TER 76065 WAT 1596 ATOM 76065 O WAT 1597 24.291 63.356 144.723 1.00 0.00 O ATOM 76066 H1 WAT 1597 24.366 62.478 145.096 1.00 0.00 H ATOM 76067 H2 WAT 1597 23.559 63.293 144.109 1.00 0.00 H TER 76069 WAT 1597 ATOM 76069 O WAT 1598 114.130 115.502 9.283 1.00 0.00 O ATOM 76070 H1 WAT 1598 114.425 116.374 9.544 1.00 0.00 H ATOM 76071 H2 WAT 1598 114.463 115.393 8.392 1.00 0.00 H TER 76073 WAT 1598 ATOM 76073 O WAT 1599 84.489 139.381 99.590 1.00 0.00 O ATOM 76074 H1 WAT 1599 84.068 138.533 99.732 1.00 0.00 H ATOM 76075 H2 WAT 1599 83.768 140.011 99.602 1.00 0.00 H TER 76077 WAT 1599 ATOM 76077 O WAT 1600 37.052 123.364 92.791 1.00 0.00 O ATOM 76078 H1 WAT 1600 37.041 122.735 92.070 1.00 0.00 H ATOM 76079 H2 WAT 1600 37.909 123.785 92.729 1.00 0.00 H TER 76081 WAT 1600 ATOM 76081 O WAT 1601 67.524 7.740 79.851 1.00 0.00 O ATOM 76082 H1 WAT 1601 67.320 8.424 80.488 1.00 0.00 H ATOM 76083 H2 WAT 1601 66.937 7.019 80.078 1.00 0.00 H TER 76085 WAT 1601 ATOM 76085 O WAT 1602 104.306 68.927 132.199 1.00 0.00 O ATOM 76086 H1 WAT 1602 105.190 68.559 132.195 1.00 0.00 H ATOM 76087 H2 WAT 1602 103.772 68.270 131.753 1.00 0.00 H TER 76089 WAT 1602 ATOM 76089 O WAT 1603 70.608 33.110 114.372 1.00 0.00 O ATOM 76090 H1 WAT 1603 71.207 33.478 115.022 1.00 0.00 H ATOM 76091 H2 WAT 1603 70.418 33.839 113.781 1.00 0.00 H TER 76093 WAT 1603 ATOM 76093 O WAT 1604 67.225 123.487 156.431 1.00 0.00 O ATOM 76094 H1 WAT 1604 67.362 122.817 155.761 1.00 0.00 H ATOM 76095 H2 WAT 1604 68.034 123.482 156.943 1.00 0.00 H TER 76097 WAT 1604 ATOM 76097 O WAT 1605 120.872 32.390 18.952 1.00 0.00 O ATOM 76098 H1 WAT 1605 120.941 31.902 19.773 1.00 0.00 H ATOM 76099 H2 WAT 1605 121.678 32.904 18.911 1.00 0.00 H TER 76101 WAT 1605 ATOM 76101 O WAT 1606 101.293 78.028 15.166 1.00 0.00 O ATOM 76102 H1 WAT 1606 101.517 78.380 16.027 1.00 0.00 H ATOM 76103 H2 WAT 1606 100.713 78.686 14.782 1.00 0.00 H TER 76105 WAT 1606 ATOM 76105 O WAT 1607 67.903 75.706 19.767 1.00 0.00 O ATOM 76106 H1 WAT 1607 67.613 75.498 18.879 1.00 0.00 H ATOM 76107 H2 WAT 1607 68.735 75.242 19.862 1.00 0.00 H TER 76109 WAT 1607 ATOM 76109 O WAT 1608 143.628 9.433 8.720 1.00 0.00 O ATOM 76110 H1 WAT 1608 143.737 8.750 9.382 1.00 0.00 H ATOM 76111 H2 WAT 1608 143.135 10.122 9.166 1.00 0.00 H TER 76113 WAT 1608 ATOM 76113 O WAT 1609 81.955 34.306 87.364 1.00 0.00 O ATOM 76114 H1 WAT 1609 81.102 33.897 87.511 1.00 0.00 H ATOM 76115 H2 WAT 1609 82.005 35.000 88.020 1.00 0.00 H TER 76117 WAT 1609 ATOM 76117 O WAT 1610 103.517 17.873 141.155 1.00 0.00 O ATOM 76118 H1 WAT 1610 103.693 17.243 140.456 1.00 0.00 H ATOM 76119 H2 WAT 1610 104.190 17.697 141.812 1.00 0.00 H TER 76121 WAT 1610 ATOM 76121 O WAT 1611 91.380 0.937 155.636 1.00 0.00 O ATOM 76122 H1 WAT 1611 92.297 0.835 155.381 1.00 0.00 H ATOM 76123 H2 WAT 1611 91.257 1.883 155.713 1.00 0.00 H TER 76125 WAT 1611 ATOM 76125 O WAT 1612 92.478 30.316 76.044 1.00 0.00 O ATOM 76126 H1 WAT 1612 92.554 30.289 75.091 1.00 0.00 H ATOM 76127 H2 WAT 1612 91.637 29.898 76.230 1.00 0.00 H TER 76129 WAT 1612 ATOM 76129 O WAT 1613 65.314 59.745 145.182 1.00 0.00 O ATOM 76130 H1 WAT 1613 65.790 60.314 144.576 1.00 0.00 H ATOM 76131 H2 WAT 1613 65.414 60.168 146.035 1.00 0.00 H TER 76133 WAT 1613 ATOM 76133 O WAT 1614 0.328 29.299 62.878 1.00 0.00 O ATOM 76134 H1 WAT 1614 0.465 28.830 62.054 1.00 0.00 H ATOM 76135 H2 WAT 1614 1.208 29.539 63.167 1.00 0.00 H TER 76137 WAT 1614 ATOM 76137 O WAT 1615 108.680 100.331 90.135 1.00 0.00 O ATOM 76138 H1 WAT 1615 108.675 99.404 90.372 1.00 0.00 H ATOM 76139 H2 WAT 1615 108.688 100.793 90.974 1.00 0.00 H TER 76141 WAT 1615 ATOM 76141 O WAT 1616 127.950 99.084 150.400 1.00 0.00 O ATOM 76142 H1 WAT 1616 127.069 98.714 150.342 1.00 0.00 H ATOM 76143 H2 WAT 1616 127.852 99.844 150.974 1.00 0.00 H TER 76145 WAT 1616 ATOM 76145 O WAT 1617 30.602 94.248 106.145 1.00 0.00 O ATOM 76146 H1 WAT 1617 30.279 94.816 106.844 1.00 0.00 H ATOM 76147 H2 WAT 1617 31.252 94.780 105.685 1.00 0.00 H TER 76149 WAT 1617 ATOM 76149 O WAT 1618 100.117 116.202 106.582 1.00 0.00 O ATOM 76150 H1 WAT 1618 100.556 116.027 107.414 1.00 0.00 H ATOM 76151 H2 WAT 1618 99.212 116.396 106.824 1.00 0.00 H TER 76153 WAT 1618 ATOM 76153 O WAT 1619 15.165 139.127 123.563 1.00 0.00 O ATOM 76154 H1 WAT 1619 14.342 139.212 123.082 1.00 0.00 H ATOM 76155 H2 WAT 1619 15.039 139.657 124.350 1.00 0.00 H TER 76157 WAT 1619 ATOM 76157 O WAT 1620 47.682 11.792 53.615 1.00 0.00 O ATOM 76158 H1 WAT 1620 47.380 11.081 54.180 1.00 0.00 H ATOM 76159 H2 WAT 1620 48.622 11.638 53.518 1.00 0.00 H TER 76161 WAT 1620 ATOM 76161 O WAT 1621 130.037 37.964 12.386 1.00 0.00 O ATOM 76162 H1 WAT 1621 130.627 37.956 13.140 1.00 0.00 H ATOM 76163 H2 WAT 1621 130.146 37.100 11.989 1.00 0.00 H TER 76165 WAT 1621 ATOM 76165 O WAT 1622 48.015 83.194 90.696 1.00 0.00 O ATOM 76166 H1 WAT 1622 48.180 82.288 90.960 1.00 0.00 H ATOM 76167 H2 WAT 1622 47.968 83.679 91.519 1.00 0.00 H TER 76169 WAT 1622 ATOM 76169 O WAT 1623 58.007 44.868 127.398 1.00 0.00 O ATOM 76170 H1 WAT 1623 57.937 44.501 126.516 1.00 0.00 H ATOM 76171 H2 WAT 1623 58.449 44.187 127.905 1.00 0.00 H TER 76173 WAT 1623 ATOM 76173 O WAT 1624 11.548 43.959 79.271 1.00 0.00 O ATOM 76174 H1 WAT 1624 12.163 43.478 78.717 1.00 0.00 H ATOM 76175 H2 WAT 1624 10.834 44.203 78.681 1.00 0.00 H TER 76177 WAT 1624 ATOM 76177 O WAT 1625 21.309 67.169 62.228 1.00 0.00 O ATOM 76178 H1 WAT 1625 20.924 66.896 61.395 1.00 0.00 H ATOM 76179 H2 WAT 1625 20.855 66.643 62.886 1.00 0.00 H TER 76181 WAT 1625 ATOM 76181 O WAT 1626 68.796 118.187 100.054 1.00 0.00 O ATOM 76182 H1 WAT 1626 67.857 118.144 100.235 1.00 0.00 H ATOM 76183 H2 WAT 1626 69.108 118.923 100.579 1.00 0.00 H TER 76185 WAT 1626 ATOM 76185 O WAT 1627 89.351 145.679 101.622 1.00 0.00 O ATOM 76186 H1 WAT 1627 89.723 144.898 101.212 1.00 0.00 H ATOM 76187 H2 WAT 1627 89.161 145.410 102.521 1.00 0.00 H TER 76189 WAT 1627 ATOM 76189 O WAT 1628 26.391 80.225 118.694 1.00 0.00 O ATOM 76190 H1 WAT 1628 27.016 80.177 119.417 1.00 0.00 H ATOM 76191 H2 WAT 1628 26.192 81.158 118.610 1.00 0.00 H TER 76193 WAT 1628 ATOM 76193 O WAT 1629 75.852 134.231 61.913 1.00 0.00 O ATOM 76194 H1 WAT 1629 74.968 134.071 61.583 1.00 0.00 H ATOM 76195 H2 WAT 1629 76.386 133.550 61.504 1.00 0.00 H TER 76197 WAT 1629 ATOM 76197 O WAT 1630 69.957 31.059 62.369 1.00 0.00 O ATOM 76198 H1 WAT 1630 69.142 30.750 61.973 1.00 0.00 H ATOM 76199 H2 WAT 1630 70.557 31.166 61.631 1.00 0.00 H TER 76201 WAT 1630 ATOM 76201 O WAT 1631 118.515 81.353 1.413 1.00 0.00 O ATOM 76202 H1 WAT 1631 117.580 81.396 1.210 1.00 0.00 H ATOM 76203 H2 WAT 1631 118.767 82.261 1.579 1.00 0.00 H TER 76205 WAT 1631 ATOM 76205 O WAT 1632 23.219 91.142 136.868 1.00 0.00 O ATOM 76206 H1 WAT 1632 23.081 91.715 137.622 1.00 0.00 H ATOM 76207 H2 WAT 1632 22.472 90.544 136.881 1.00 0.00 H TER 76209 WAT 1632 ATOM 76209 O WAT 1633 137.414 74.126 116.513 1.00 0.00 O ATOM 76210 H1 WAT 1633 137.202 74.330 115.602 1.00 0.00 H ATOM 76211 H2 WAT 1633 136.947 73.310 116.691 1.00 0.00 H TER 76213 WAT 1633 ATOM 76213 O WAT 1634 137.904 33.573 109.510 1.00 0.00 O ATOM 76214 H1 WAT 1634 137.097 34.009 109.781 1.00 0.00 H ATOM 76215 H2 WAT 1634 137.997 33.795 108.583 1.00 0.00 H TER 76217 WAT 1634 ATOM 76217 O WAT 1635 64.749 131.283 110.964 1.00 0.00 O ATOM 76218 H1 WAT 1635 64.036 131.921 110.962 1.00 0.00 H ATOM 76219 H2 WAT 1635 64.396 130.527 110.494 1.00 0.00 H TER 76221 WAT 1635 ATOM 76221 O WAT 1636 33.047 1.162 67.104 1.00 0.00 O ATOM 76222 H1 WAT 1636 32.155 1.245 66.768 1.00 0.00 H ATOM 76223 H2 WAT 1636 33.554 0.841 66.358 1.00 0.00 H TER 76225 WAT 1636 ATOM 76225 O WAT 1637 83.328 4.464 144.683 1.00 0.00 O ATOM 76226 H1 WAT 1637 82.782 5.237 144.545 1.00 0.00 H ATOM 76227 H2 WAT 1637 82.735 3.817 145.066 1.00 0.00 H TER 76229 WAT 1637 ATOM 76229 O WAT 1638 4.320 107.726 68.224 1.00 0.00 O ATOM 76230 H1 WAT 1638 4.861 107.055 68.640 1.00 0.00 H ATOM 76231 H2 WAT 1638 4.109 108.337 68.930 1.00 0.00 H TER 76233 WAT 1638 ATOM 76233 O WAT 1639 41.896 86.656 123.049 1.00 0.00 O ATOM 76234 H1 WAT 1639 41.311 87.389 122.857 1.00 0.00 H ATOM 76235 H2 WAT 1639 42.087 86.739 123.983 1.00 0.00 H TER 76237 WAT 1639 ATOM 76237 O WAT 1640 31.100 97.732 122.664 1.00 0.00 O ATOM 76238 H1 WAT 1640 30.509 97.897 123.398 1.00 0.00 H ATOM 76239 H2 WAT 1640 31.881 98.247 122.864 1.00 0.00 H TER 76241 WAT 1640 ATOM 76241 O WAT 1641 39.034 100.745 91.157 1.00 0.00 O ATOM 76242 H1 WAT 1641 38.858 100.099 90.473 1.00 0.00 H ATOM 76243 H2 WAT 1641 39.856 101.157 90.891 1.00 0.00 H TER 76245 WAT 1641 ATOM 76245 O WAT 1642 44.460 51.800 97.631 1.00 0.00 O ATOM 76246 H1 WAT 1642 43.973 50.979 97.564 1.00 0.00 H ATOM 76247 H2 WAT 1642 44.057 52.372 96.979 1.00 0.00 H TER 76249 WAT 1642 ATOM 76249 O WAT 1643 9.023 90.220 105.303 1.00 0.00 O ATOM 76250 H1 WAT 1643 9.875 90.075 104.892 1.00 0.00 H ATOM 76251 H2 WAT 1643 9.223 90.708 106.102 1.00 0.00 H TER 76253 WAT 1643 ATOM 76253 O WAT 1644 7.854 10.318 82.297 1.00 0.00 O ATOM 76254 H1 WAT 1644 8.401 10.640 81.581 1.00 0.00 H ATOM 76255 H2 WAT 1644 7.206 11.009 82.433 1.00 0.00 H TER 76257 WAT 1644 ATOM 76257 O WAT 1645 87.906 123.033 142.144 1.00 0.00 O ATOM 76258 H1 WAT 1645 88.268 123.600 141.463 1.00 0.00 H ATOM 76259 H2 WAT 1645 88.666 122.762 142.659 1.00 0.00 H TER 76261 WAT 1645 ATOM 76261 O WAT 1646 69.066 87.299 142.655 1.00 0.00 O ATOM 76262 H1 WAT 1646 68.636 87.840 141.992 1.00 0.00 H ATOM 76263 H2 WAT 1646 68.377 87.108 143.291 1.00 0.00 H TER 76265 WAT 1646 ATOM 76265 O WAT 1647 51.064 83.794 107.555 1.00 0.00 O ATOM 76266 H1 WAT 1647 50.305 83.308 107.233 1.00 0.00 H ATOM 76267 H2 WAT 1647 51.282 84.395 106.843 1.00 0.00 H TER 76269 WAT 1647 ATOM 76269 O WAT 1648 129.768 28.346 75.524 1.00 0.00 O ATOM 76270 H1 WAT 1648 129.351 27.484 75.525 1.00 0.00 H ATOM 76271 H2 WAT 1648 130.603 28.207 75.078 1.00 0.00 H TER 76273 WAT 1648 ATOM 76273 O WAT 1649 116.868 114.499 90.598 1.00 0.00 O ATOM 76274 H1 WAT 1649 116.147 115.084 90.830 1.00 0.00 H ATOM 76275 H2 WAT 1649 116.688 113.693 91.081 1.00 0.00 H TER 76277 WAT 1649 ATOM 76277 O WAT 1650 32.012 30.327 102.634 1.00 0.00 O ATOM 76278 H1 WAT 1650 32.298 29.492 102.264 1.00 0.00 H ATOM 76279 H2 WAT 1650 32.636 30.967 102.294 1.00 0.00 H TER 76281 WAT 1650 ATOM 76281 O WAT 1651 116.252 46.378 83.619 1.00 0.00 O ATOM 76282 H1 WAT 1651 116.864 45.660 83.458 1.00 0.00 H ATOM 76283 H2 WAT 1651 116.049 46.720 82.749 1.00 0.00 H TER 76285 WAT 1651 ATOM 76285 O WAT 1652 18.886 50.600 22.438 1.00 0.00 O ATOM 76286 H1 WAT 1652 19.784 50.323 22.257 1.00 0.00 H ATOM 76287 H2 WAT 1652 18.982 51.412 22.935 1.00 0.00 H TER 76289 WAT 1652 ATOM 76289 O WAT 1653 114.163 91.239 156.612 1.00 0.00 O ATOM 76290 H1 WAT 1653 113.868 91.105 155.712 1.00 0.00 H ATOM 76291 H2 WAT 1653 113.523 91.845 156.985 1.00 0.00 H TER 76293 WAT 1653 ATOM 76293 O WAT 1654 30.624 61.773 155.522 1.00 0.00 O ATOM 76294 H1 WAT 1654 31.258 62.423 155.825 1.00 0.00 H ATOM 76295 H2 WAT 1654 30.530 61.168 156.258 1.00 0.00 H TER 76297 WAT 1654 ATOM 76297 O WAT 1655 74.973 30.505 135.938 1.00 0.00 O ATOM 76298 H1 WAT 1655 74.257 31.137 135.998 1.00 0.00 H ATOM 76299 H2 WAT 1655 74.653 29.838 135.330 1.00 0.00 H TER 76301 WAT 1655 ATOM 76301 O WAT 1656 109.308 143.786 147.668 1.00 0.00 O ATOM 76302 H1 WAT 1656 108.500 143.341 147.412 1.00 0.00 H ATOM 76303 H2 WAT 1656 109.148 144.075 148.566 1.00 0.00 H TER 76305 WAT 1656 ATOM 76305 O WAT 1657 102.785 143.795 154.563 1.00 0.00 O ATOM 76306 H1 WAT 1657 103.131 144.506 154.024 1.00 0.00 H ATOM 76307 H2 WAT 1657 101.961 143.553 154.141 1.00 0.00 H TER 76309 WAT 1657 ATOM 76309 O WAT 1658 29.666 126.973 92.682 1.00 0.00 O ATOM 76310 H1 WAT 1658 29.240 126.704 93.496 1.00 0.00 H ATOM 76311 H2 WAT 1658 29.732 127.925 92.750 1.00 0.00 H TER 76313 WAT 1658 ATOM 76313 O WAT 1659 46.092 102.506 67.647 1.00 0.00 O ATOM 76314 H1 WAT 1659 45.459 102.739 66.968 1.00 0.00 H ATOM 76315 H2 WAT 1659 45.772 102.944 68.435 1.00 0.00 H TER 76317 WAT 1659 ATOM 76317 O WAT 1660 44.717 80.418 71.566 1.00 0.00 O ATOM 76318 H1 WAT 1660 44.308 80.742 70.764 1.00 0.00 H ATOM 76319 H2 WAT 1660 44.200 79.647 71.804 1.00 0.00 H TER 76321 WAT 1660 ATOM 76321 O WAT 1661 48.389 58.648 1.181 1.00 0.00 O ATOM 76322 H1 WAT 1661 47.516 58.256 1.191 1.00 0.00 H ATOM 76323 H2 WAT 1661 48.926 58.024 0.693 1.00 0.00 H TER 76325 WAT 1661 ATOM 76325 O WAT 1662 141.165 136.417 86.055 1.00 0.00 O ATOM 76326 H1 WAT 1662 142.111 136.279 86.006 1.00 0.00 H ATOM 76327 H2 WAT 1662 140.998 137.145 85.456 1.00 0.00 H TER 76329 WAT 1662 ATOM 76329 O WAT 1663 65.075 26.644 95.553 1.00 0.00 O ATOM 76330 H1 WAT 1663 65.685 26.374 96.239 1.00 0.00 H ATOM 76331 H2 WAT 1663 65.209 27.588 95.471 1.00 0.00 H TER 76333 WAT 1663 ATOM 76333 O WAT 1664 64.841 76.384 25.851 1.00 0.00 O ATOM 76334 H1 WAT 1664 64.807 75.850 25.057 1.00 0.00 H ATOM 76335 H2 WAT 1664 63.942 76.690 25.973 1.00 0.00 H TER 76337 WAT 1664 ATOM 76337 O WAT 1665 59.415 141.481 6.441 1.00 0.00 O ATOM 76338 H1 WAT 1665 59.896 140.691 6.689 1.00 0.00 H ATOM 76339 H2 WAT 1665 58.800 141.623 7.160 1.00 0.00 H TER 76341 WAT 1665 ATOM 76341 O WAT 1666 6.552 107.877 152.755 1.00 0.00 O ATOM 76342 H1 WAT 1666 6.050 108.647 152.486 1.00 0.00 H ATOM 76343 H2 WAT 1666 6.833 107.475 151.933 1.00 0.00 H TER 76345 WAT 1666 ATOM 76345 O WAT 1667 39.931 33.525 112.300 1.00 0.00 O ATOM 76346 H1 WAT 1667 39.693 32.771 111.761 1.00 0.00 H ATOM 76347 H2 WAT 1667 39.173 33.661 112.869 1.00 0.00 H TER 76349 WAT 1667 ATOM 76349 O WAT 1668 134.433 134.286 79.514 1.00 0.00 O ATOM 76350 H1 WAT 1668 135.091 133.760 79.059 1.00 0.00 H ATOM 76351 H2 WAT 1668 134.530 134.046 80.436 1.00 0.00 H TER 76353 WAT 1668 ATOM 76353 O WAT 1669 90.040 49.659 106.620 1.00 0.00 O ATOM 76354 H1 WAT 1669 89.141 49.402 106.824 1.00 0.00 H ATOM 76355 H2 WAT 1669 90.553 48.861 106.754 1.00 0.00 H TER 76357 WAT 1669 ATOM 76357 O WAT 1670 125.302 19.606 71.998 1.00 0.00 O ATOM 76358 H1 WAT 1670 125.693 18.929 72.550 1.00 0.00 H ATOM 76359 H2 WAT 1670 125.318 19.236 71.116 1.00 0.00 H TER 76361 WAT 1670 ATOM 76361 O WAT 1671 50.102 56.740 0.144 1.00 0.00 O ATOM 76362 H1 WAT 1671 50.936 56.939 0.568 1.00 0.00 H ATOM 76363 H2 WAT 1671 49.896 55.849 0.425 1.00 0.00 H TER 76365 WAT 1671 ATOM 76365 O WAT 1672 62.366 19.452 123.305 1.00 0.00 O ATOM 76366 H1 WAT 1672 61.849 19.084 124.022 1.00 0.00 H ATOM 76367 H2 WAT 1672 63.090 18.836 123.191 1.00 0.00 H TER 76369 WAT 1672 ATOM 76369 O WAT 1673 55.234 118.498 79.927 1.00 0.00 O ATOM 76370 H1 WAT 1673 54.982 117.603 79.699 1.00 0.00 H ATOM 76371 H2 WAT 1673 54.410 118.927 80.160 1.00 0.00 H TER 76373 WAT 1673 ATOM 76373 O WAT 1674 137.972 64.729 113.629 1.00 0.00 O ATOM 76374 H1 WAT 1674 137.857 65.243 112.830 1.00 0.00 H ATOM 76375 H2 WAT 1674 138.870 64.402 113.577 1.00 0.00 H TER 76377 WAT 1674 ATOM 76377 O WAT 1675 11.199 123.283 10.110 1.00 0.00 O ATOM 76378 H1 WAT 1675 10.429 122.725 10.002 1.00 0.00 H ATOM 76379 H2 WAT 1675 11.942 122.696 9.972 1.00 0.00 H TER 76381 WAT 1675 ATOM 76381 O WAT 1676 78.715 129.733 157.972 1.00 0.00 O ATOM 76382 H1 WAT 1676 78.112 130.469 157.873 1.00 0.00 H ATOM 76383 H2 WAT 1676 78.925 129.473 157.075 1.00 0.00 H TER 76385 WAT 1676 ATOM 76385 O WAT 1677 69.406 62.420 89.172 1.00 0.00 O ATOM 76386 H1 WAT 1677 69.062 63.308 89.080 1.00 0.00 H ATOM 76387 H2 WAT 1677 69.991 62.467 89.928 1.00 0.00 H TER 76389 WAT 1677 ATOM 76389 O WAT 1678 52.065 33.908 95.395 1.00 0.00 O ATOM 76390 H1 WAT 1678 52.578 33.531 94.681 1.00 0.00 H ATOM 76391 H2 WAT 1678 52.717 34.168 96.047 1.00 0.00 H TER 76393 WAT 1678 ATOM 76393 O WAT 1679 86.397 124.618 89.884 1.00 0.00 O ATOM 76394 H1 WAT 1679 87.263 124.993 90.044 1.00 0.00 H ATOM 76395 H2 WAT 1679 86.572 123.715 89.618 1.00 0.00 H TER 76397 WAT 1679 ATOM 76397 O WAT 1680 36.880 95.529 84.203 1.00 0.00 O ATOM 76398 H1 WAT 1680 36.469 96.380 84.052 1.00 0.00 H ATOM 76399 H2 WAT 1680 36.312 94.905 83.751 1.00 0.00 H TER 76401 WAT 1680 ATOM 76401 O WAT 1681 52.889 114.170 69.079 1.00 0.00 O ATOM 76402 H1 WAT 1681 52.907 113.520 68.377 1.00 0.00 H ATOM 76403 H2 WAT 1681 53.444 114.882 68.761 1.00 0.00 H TER 76405 WAT 1681 ATOM 76405 O WAT 1682 7.756 39.358 128.669 1.00 0.00 O ATOM 76406 H1 WAT 1682 7.307 40.099 129.076 1.00 0.00 H ATOM 76407 H2 WAT 1682 7.149 38.626 128.771 1.00 0.00 H TER 76409 WAT 1682 ATOM 76409 O WAT 1683 50.066 48.257 103.673 1.00 0.00 O ATOM 76410 H1 WAT 1683 50.633 47.697 103.144 1.00 0.00 H ATOM 76411 H2 WAT 1683 49.246 48.300 103.181 1.00 0.00 H TER 76413 WAT 1683 ATOM 76413 O WAT 1684 124.901 88.705 124.828 1.00 0.00 O ATOM 76414 H1 WAT 1684 124.510 89.156 124.080 1.00 0.00 H ATOM 76415 H2 WAT 1684 125.791 88.497 124.544 1.00 0.00 H TER 76417 WAT 1684 ATOM 76417 O WAT 1685 9.263 69.937 89.257 1.00 0.00 O ATOM 76418 H1 WAT 1685 8.616 70.048 88.561 1.00 0.00 H ATOM 76419 H2 WAT 1685 9.335 68.989 89.369 1.00 0.00 H TER 76421 WAT 1685 ATOM 76421 O WAT 1686 11.273 34.776 60.731 1.00 0.00 O ATOM 76422 H1 WAT 1686 10.933 35.274 59.988 1.00 0.00 H ATOM 76423 H2 WAT 1686 11.039 33.868 60.538 1.00 0.00 H TER 76425 WAT 1686 ATOM 76425 O WAT 1687 0.965 137.682 148.388 1.00 0.00 O ATOM 76426 H1 WAT 1687 0.666 136.977 147.814 1.00 0.00 H ATOM 76427 H2 WAT 1687 1.673 137.290 148.900 1.00 0.00 H TER 76429 WAT 1687 ATOM 76429 O WAT 1688 3.871 124.244 25.262 1.00 0.00 O ATOM 76430 H1 WAT 1688 3.015 124.198 24.836 1.00 0.00 H ATOM 76431 H2 WAT 1688 3.807 124.998 25.847 1.00 0.00 H TER 76433 WAT 1688 ATOM 76433 O WAT 1689 111.655 134.478 95.123 1.00 0.00 O ATOM 76434 H1 WAT 1689 111.046 135.113 94.748 1.00 0.00 H ATOM 76435 H2 WAT 1689 111.513 134.538 96.067 1.00 0.00 H TER 76437 WAT 1689 ATOM 76437 O WAT 1690 51.320 28.525 103.786 1.00 0.00 O ATOM 76438 H1 WAT 1690 50.836 29.231 104.215 1.00 0.00 H ATOM 76439 H2 WAT 1690 50.670 27.833 103.657 1.00 0.00 H TER 76441 WAT 1690 ATOM 76441 O WAT 1691 43.669 31.862 59.307 1.00 0.00 O ATOM 76442 H1 WAT 1691 43.548 32.385 58.515 1.00 0.00 H ATOM 76443 H2 WAT 1691 42.790 31.555 59.528 1.00 0.00 H TER 76445 WAT 1691 ATOM 76445 O WAT 1692 94.278 9.835 104.194 1.00 0.00 O ATOM 76446 H1 WAT 1692 95.193 9.920 103.925 1.00 0.00 H ATOM 76447 H2 WAT 1692 94.314 9.336 105.010 1.00 0.00 H TER 76449 WAT 1692 ATOM 76449 O WAT 1693 47.720 19.945 12.773 1.00 0.00 O ATOM 76450 H1 WAT 1693 48.391 19.401 13.186 1.00 0.00 H ATOM 76451 H2 WAT 1693 46.929 19.779 13.286 1.00 0.00 H TER 76453 WAT 1693 ATOM 76453 O WAT 1694 47.442 129.449 69.870 1.00 0.00 O ATOM 76454 H1 WAT 1694 48.188 129.023 69.449 1.00 0.00 H ATOM 76455 H2 WAT 1694 46.761 128.778 69.888 1.00 0.00 H TER 76457 WAT 1694 ATOM 76457 O WAT 1695 8.585 142.625 63.869 1.00 0.00 O ATOM 76458 H1 WAT 1695 7.731 142.204 63.776 1.00 0.00 H ATOM 76459 H2 WAT 1695 8.954 142.244 64.665 1.00 0.00 H TER 76461 WAT 1695 ATOM 76461 O WAT 1696 65.329 143.501 126.909 1.00 0.00 O ATOM 76462 H1 WAT 1696 65.719 143.342 126.049 1.00 0.00 H ATOM 76463 H2 WAT 1696 64.893 142.678 127.131 1.00 0.00 H TER 76465 WAT 1696 ATOM 76465 O WAT 1697 13.769 95.190 10.687 1.00 0.00 O ATOM 76466 H1 WAT 1697 13.948 94.757 11.522 1.00 0.00 H ATOM 76467 H2 WAT 1697 13.140 94.616 10.250 1.00 0.00 H TER 76469 WAT 1697 ATOM 76469 O WAT 1698 22.863 109.795 140.051 1.00 0.00 O ATOM 76470 H1 WAT 1698 23.486 109.102 139.833 1.00 0.00 H ATOM 76471 H2 WAT 1698 22.227 109.372 140.628 1.00 0.00 H TER 76473 WAT 1698 ATOM 76473 O WAT 1699 2.205 27.913 81.526 1.00 0.00 O ATOM 76474 H1 WAT 1699 1.541 27.242 81.365 1.00 0.00 H ATOM 76475 H2 WAT 1699 2.612 28.058 80.672 1.00 0.00 H TER 76477 WAT 1699 ATOM 76477 O WAT 1700 144.170 30.115 126.263 1.00 0.00 O ATOM 76478 H1 WAT 1700 144.738 29.348 126.327 1.00 0.00 H ATOM 76479 H2 WAT 1700 143.365 29.856 126.712 1.00 0.00 H TER 76481 WAT 1700 ATOM 76481 O WAT 1701 102.964 144.346 130.172 1.00 0.00 O ATOM 76482 H1 WAT 1701 102.884 144.251 129.223 1.00 0.00 H ATOM 76483 H2 WAT 1701 103.664 144.988 130.291 1.00 0.00 H TER 76485 WAT 1701 ATOM 76485 O WAT 1702 132.413 1.764 72.820 1.00 0.00 O ATOM 76486 H1 WAT 1702 131.697 1.373 72.319 1.00 0.00 H ATOM 76487 H2 WAT 1702 132.595 2.590 72.373 1.00 0.00 H TER 76489 WAT 1702 ATOM 76489 O WAT 1703 30.439 93.366 119.941 1.00 0.00 O ATOM 76490 H1 WAT 1703 29.937 94.178 119.878 1.00 0.00 H ATOM 76491 H2 WAT 1703 29.776 92.674 119.940 1.00 0.00 H TER 76493 WAT 1703 ATOM 76493 O WAT 1704 124.967 112.525 60.641 1.00 0.00 O ATOM 76494 H1 WAT 1704 124.115 112.956 60.582 1.00 0.00 H ATOM 76495 H2 WAT 1704 125.000 112.183 61.535 1.00 0.00 H TER 76497 WAT 1704 ATOM 76497 O WAT 1705 93.260 113.543 59.809 1.00 0.00 O ATOM 76498 H1 WAT 1705 92.430 113.196 59.481 1.00 0.00 H ATOM 76499 H2 WAT 1705 93.005 114.233 60.422 1.00 0.00 H TER 76501 WAT 1705 ATOM 76501 O WAT 1706 9.141 133.780 130.329 1.00 0.00 O ATOM 76502 H1 WAT 1706 9.268 134.354 131.084 1.00 0.00 H ATOM 76503 H2 WAT 1706 8.251 133.967 130.032 1.00 0.00 H TER 76505 WAT 1706 ATOM 76505 O WAT 1707 10.161 43.367 69.089 1.00 0.00 O ATOM 76506 H1 WAT 1707 10.714 42.586 69.097 1.00 0.00 H ATOM 76507 H2 WAT 1707 10.495 43.890 68.360 1.00 0.00 H TER 76509 WAT 1707 ATOM 76509 O WAT 1708 101.242 81.967 97.266 1.00 0.00 O ATOM 76510 H1 WAT 1708 100.951 81.314 97.903 1.00 0.00 H ATOM 76511 H2 WAT 1708 100.885 81.662 96.431 1.00 0.00 H TER 76513 WAT 1708 ATOM 76513 O WAT 1709 51.101 8.245 106.631 1.00 0.00 O ATOM 76514 H1 WAT 1709 50.972 8.948 107.269 1.00 0.00 H ATOM 76515 H2 WAT 1709 50.700 8.575 105.827 1.00 0.00 H TER 76517 WAT 1709 ATOM 76517 O WAT 1710 66.932 61.468 133.688 1.00 0.00 O ATOM 76518 H1 WAT 1710 67.004 60.622 133.247 1.00 0.00 H ATOM 76519 H2 WAT 1710 65.998 61.564 133.873 1.00 0.00 H TER 76521 WAT 1710 ATOM 76521 O WAT 1711 106.837 27.106 72.638 1.00 0.00 O ATOM 76522 H1 WAT 1711 106.664 27.456 71.764 1.00 0.00 H ATOM 76523 H2 WAT 1711 107.458 26.392 72.492 1.00 0.00 H TER 76525 WAT 1711 ATOM 76525 O WAT 1712 77.859 51.743 124.761 1.00 0.00 O ATOM 76526 H1 WAT 1712 78.519 51.339 124.197 1.00 0.00 H ATOM 76527 H2 WAT 1712 77.030 51.367 124.467 1.00 0.00 H TER 76529 WAT 1712 ATOM 76529 O WAT 1713 126.133 102.830 13.271 1.00 0.00 O ATOM 76530 H1 WAT 1713 125.797 103.372 12.557 1.00 0.00 H ATOM 76531 H2 WAT 1713 126.781 102.261 12.855 1.00 0.00 H TER 76533 WAT 1713 ATOM 76533 O WAT 1714 106.710 84.210 14.032 1.00 0.00 O ATOM 76534 H1 WAT 1714 106.093 84.888 14.308 1.00 0.00 H ATOM 76535 H2 WAT 1714 106.212 83.394 14.093 1.00 0.00 H TER 76537 WAT 1714 ATOM 76537 O WAT 1715 131.923 38.751 97.139 1.00 0.00 O ATOM 76538 H1 WAT 1715 132.242 37.853 97.226 1.00 0.00 H ATOM 76539 H2 WAT 1715 131.297 38.854 97.857 1.00 0.00 H TER 76541 WAT 1715 ATOM 76541 O WAT 1716 31.730 118.435 84.167 1.00 0.00 O ATOM 76542 H1 WAT 1716 30.839 118.706 84.388 1.00 0.00 H ATOM 76543 H2 WAT 1716 31.664 117.491 84.025 1.00 0.00 H TER 76545 WAT 1716 ATOM 76545 O WAT 1717 14.975 24.339 138.477 1.00 0.00 O ATOM 76546 H1 WAT 1717 14.338 23.634 138.370 1.00 0.00 H ATOM 76547 H2 WAT 1717 14.451 25.101 138.722 1.00 0.00 H TER 76549 WAT 1717 ATOM 76549 O WAT 1718 60.755 14.879 80.095 1.00 0.00 O ATOM 76550 H1 WAT 1718 60.759 14.916 81.051 1.00 0.00 H ATOM 76551 H2 WAT 1718 60.813 15.793 79.820 1.00 0.00 H TER 76553 WAT 1718 ATOM 76553 O WAT 1719 42.744 53.043 15.559 1.00 0.00 O ATOM 76554 H1 WAT 1719 43.502 52.693 16.026 1.00 0.00 H ATOM 76555 H2 WAT 1719 41.997 52.827 16.118 1.00 0.00 H TER 76557 WAT 1719 ATOM 76557 O WAT 1720 75.780 36.763 64.008 1.00 0.00 O ATOM 76558 H1 WAT 1720 76.494 36.142 63.863 1.00 0.00 H ATOM 76559 H2 WAT 1720 75.641 37.171 63.153 1.00 0.00 H TER 76561 WAT 1720 ATOM 76561 O WAT 1721 17.444 76.751 128.094 1.00 0.00 O ATOM 76562 H1 WAT 1721 17.741 76.873 127.192 1.00 0.00 H ATOM 76563 H2 WAT 1721 18.180 77.047 128.630 1.00 0.00 H TER 76565 WAT 1721 ATOM 76565 O WAT 1722 95.407 23.144 90.051 1.00 0.00 O ATOM 76566 H1 WAT 1722 94.526 23.518 90.053 1.00 0.00 H ATOM 76567 H2 WAT 1722 95.609 23.002 90.976 1.00 0.00 H TER 76569 WAT 1722 ATOM 76569 O WAT 1723 113.455 69.670 12.415 1.00 0.00 O ATOM 76570 H1 WAT 1723 113.319 69.228 11.577 1.00 0.00 H ATOM 76571 H2 WAT 1723 113.360 68.979 13.069 1.00 0.00 H TER 76573 WAT 1723 ATOM 76573 O WAT 1724 45.827 46.173 91.602 1.00 0.00 O ATOM 76574 H1 WAT 1724 46.185 45.395 91.174 1.00 0.00 H ATOM 76575 H2 WAT 1724 45.989 46.884 90.981 1.00 0.00 H TER 76577 WAT 1724 ATOM 76577 O WAT 1725 77.392 42.730 28.331 1.00 0.00 O ATOM 76578 H1 WAT 1725 76.535 42.663 27.909 1.00 0.00 H ATOM 76579 H2 WAT 1725 77.392 43.597 28.736 1.00 0.00 H TER 76581 WAT 1725 ATOM 76581 O WAT 1726 17.260 24.381 74.238 1.00 0.00 O ATOM 76582 H1 WAT 1726 17.092 23.446 74.348 1.00 0.00 H ATOM 76583 H2 WAT 1726 17.010 24.565 73.332 1.00 0.00 H TER 76585 WAT 1726 ATOM 76585 O WAT 1727 37.003 33.307 98.608 1.00 0.00 O ATOM 76586 H1 WAT 1727 37.316 33.211 97.708 1.00 0.00 H ATOM 76587 H2 WAT 1727 36.828 34.243 98.701 1.00 0.00 H TER 76589 WAT 1727 ATOM 76589 O WAT 1728 17.662 76.320 119.362 1.00 0.00 O ATOM 76590 H1 WAT 1728 17.018 75.835 119.878 1.00 0.00 H ATOM 76591 H2 WAT 1728 17.667 75.881 118.511 1.00 0.00 H TER 76593 WAT 1728 ATOM 76593 O WAT 1729 54.586 37.731 103.819 1.00 0.00 O ATOM 76594 H1 WAT 1729 55.061 36.986 104.186 1.00 0.00 H ATOM 76595 H2 WAT 1729 53.664 37.478 103.872 1.00 0.00 H TER 76597 WAT 1729 ATOM 76597 O WAT 1730 15.418 72.923 4.814 1.00 0.00 O ATOM 76598 H1 WAT 1730 15.307 71.994 4.614 1.00 0.00 H ATOM 76599 H2 WAT 1730 15.025 73.030 5.681 1.00 0.00 H TER 76601 WAT 1730 ATOM 76601 O WAT 1731 88.535 117.729 119.916 1.00 0.00 O ATOM 76602 H1 WAT 1731 88.218 118.517 119.475 1.00 0.00 H ATOM 76603 H2 WAT 1731 89.076 117.289 119.259 1.00 0.00 H TER 76605 WAT 1731 ATOM 76605 O WAT 1732 95.588 24.104 150.822 1.00 0.00 O ATOM 76606 H1 WAT 1732 95.627 23.148 150.793 1.00 0.00 H ATOM 76607 H2 WAT 1732 94.774 24.297 151.286 1.00 0.00 H TER 76609 WAT 1732 ATOM 76609 O WAT 1733 125.982 30.423 105.700 1.00 0.00 O ATOM 76610 H1 WAT 1733 125.220 30.130 106.198 1.00 0.00 H ATOM 76611 H2 WAT 1733 126.064 29.786 104.990 1.00 0.00 H TER 76613 WAT 1733 ATOM 76613 O WAT 1734 28.391 131.876 130.544 1.00 0.00 O ATOM 76614 H1 WAT 1734 28.610 132.703 130.974 1.00 0.00 H ATOM 76615 H2 WAT 1734 27.642 132.087 129.987 1.00 0.00 H TER 76617 WAT 1734 ATOM 76617 O WAT 1735 16.625 39.096 72.046 1.00 0.00 O ATOM 76618 H1 WAT 1735 16.403 38.522 72.778 1.00 0.00 H ATOM 76619 H2 WAT 1735 16.304 38.632 71.272 1.00 0.00 H TER 76621 WAT 1735 ATOM 76621 O WAT 1736 3.169 19.693 150.381 1.00 0.00 O ATOM 76622 H1 WAT 1736 2.506 20.260 150.774 1.00 0.00 H ATOM 76623 H2 WAT 1736 2.729 18.851 150.269 1.00 0.00 H TER 76625 WAT 1736 ATOM 76625 O WAT 1737 5.996 112.786 126.488 1.00 0.00 O ATOM 76626 H1 WAT 1737 5.777 113.302 125.712 1.00 0.00 H ATOM 76627 H2 WAT 1737 6.914 112.543 126.362 1.00 0.00 H TER 76629 WAT 1737 ATOM 76629 O WAT 1738 42.775 12.159 136.047 1.00 0.00 O ATOM 76630 H1 WAT 1738 43.502 12.717 136.325 1.00 0.00 H ATOM 76631 H2 WAT 1738 43.176 11.303 135.892 1.00 0.00 H TER 76633 WAT 1738 ATOM 76633 O WAT 1739 145.798 26.120 139.611 1.00 0.00 O ATOM 76634 H1 WAT 1739 145.047 25.865 140.147 1.00 0.00 H ATOM 76635 H2 WAT 1739 145.892 27.060 139.761 1.00 0.00 H TER 76637 WAT 1739 ATOM 76637 O WAT 1740 83.068 8.598 106.354 1.00 0.00 O ATOM 76638 H1 WAT 1740 82.619 8.059 105.703 1.00 0.00 H ATOM 76639 H2 WAT 1740 82.667 9.463 106.266 1.00 0.00 H TER 76641 WAT 1740 ATOM 76641 O WAT 1741 29.961 23.998 16.557 1.00 0.00 O ATOM 76642 H1 WAT 1741 29.347 24.716 16.712 1.00 0.00 H ATOM 76643 H2 WAT 1741 30.064 23.582 17.413 1.00 0.00 H TER 76645 WAT 1741 ATOM 76645 O WAT 1742 79.699 77.926 5.257 1.00 0.00 O ATOM 76646 H1 WAT 1742 79.208 77.119 5.416 1.00 0.00 H ATOM 76647 H2 WAT 1742 80.144 78.102 6.086 1.00 0.00 H TER 76649 WAT 1742 ATOM 76649 O WAT 1743 137.087 119.944 158.240 1.00 0.00 O ATOM 76650 H1 WAT 1743 137.572 119.120 158.236 1.00 0.00 H ATOM 76651 H2 WAT 1743 136.280 119.745 158.715 1.00 0.00 H TER 76653 WAT 1743 ATOM 76653 O WAT 1744 10.009 15.590 130.095 1.00 0.00 O ATOM 76654 H1 WAT 1744 10.594 14.970 130.530 1.00 0.00 H ATOM 76655 H2 WAT 1744 10.572 16.062 129.482 1.00 0.00 H TER 76657 WAT 1744 ATOM 76657 O WAT 1745 67.121 71.905 17.880 1.00 0.00 O ATOM 76658 H1 WAT 1745 66.252 71.891 18.282 1.00 0.00 H ATOM 76659 H2 WAT 1745 67.718 72.083 18.606 1.00 0.00 H TER 76661 WAT 1745 ATOM 76661 O WAT 1746 68.727 121.088 21.290 1.00 0.00 O ATOM 76662 H1 WAT 1746 69.467 120.484 21.359 1.00 0.00 H ATOM 76663 H2 WAT 1746 69.119 121.916 21.011 1.00 0.00 H TER 76665 WAT 1746 ATOM 76665 O WAT 1747 53.432 115.819 139.071 1.00 0.00 O ATOM 76666 H1 WAT 1747 52.753 116.176 138.499 1.00 0.00 H ATOM 76667 H2 WAT 1747 54.091 115.470 138.471 1.00 0.00 H TER 76669 WAT 1747 ATOM 76669 O WAT 1748 143.803 16.018 144.055 1.00 0.00 O ATOM 76670 H1 WAT 1748 144.733 16.227 143.968 1.00 0.00 H ATOM 76671 H2 WAT 1748 143.519 16.505 144.828 1.00 0.00 H TER 76673 WAT 1748 ATOM 76673 O WAT 1749 29.622 130.851 91.254 1.00 0.00 O ATOM 76674 H1 WAT 1749 29.564 130.676 90.315 1.00 0.00 H ATOM 76675 H2 WAT 1749 30.356 130.314 91.553 1.00 0.00 H TER 76677 WAT 1749 ATOM 76677 O WAT 1750 106.278 88.573 71.384 1.00 0.00 O ATOM 76678 H1 WAT 1750 106.420 89.508 71.234 1.00 0.00 H ATOM 76679 H2 WAT 1750 106.400 88.171 70.523 1.00 0.00 H TER 76681 WAT 1750 ATOM 76681 O WAT 1751 123.589 28.845 20.477 1.00 0.00 O ATOM 76682 H1 WAT 1751 124.262 28.184 20.311 1.00 0.00 H ATOM 76683 H2 WAT 1751 123.996 29.451 21.096 1.00 0.00 H TER 76685 WAT 1751 ATOM 76685 O WAT 1752 85.060 139.117 59.933 1.00 0.00 O ATOM 76686 H1 WAT 1752 84.847 139.800 59.297 1.00 0.00 H ATOM 76687 H2 WAT 1752 84.211 138.835 60.274 1.00 0.00 H TER 76689 WAT 1752 ATOM 76689 O WAT 1753 70.395 75.048 141.755 1.00 0.00 O ATOM 76690 H1 WAT 1753 70.747 75.097 142.643 1.00 0.00 H ATOM 76691 H2 WAT 1753 69.928 75.875 141.636 1.00 0.00 H TER 76693 WAT 1753 ATOM 76693 O WAT 1754 40.630 144.936 80.559 1.00 0.00 O ATOM 76694 H1 WAT 1754 39.678 144.868 80.484 1.00 0.00 H ATOM 76695 H2 WAT 1754 40.878 145.572 79.888 1.00 0.00 H TER 76697 WAT 1754 ATOM 76697 O WAT 1755 31.471 68.291 19.563 1.00 0.00 O ATOM 76698 H1 WAT 1755 31.449 67.541 20.158 1.00 0.00 H ATOM 76699 H2 WAT 1755 32.059 68.916 19.989 1.00 0.00 H TER 76701 WAT 1755 ATOM 76701 O WAT 1756 76.862 59.888 14.454 1.00 0.00 O ATOM 76702 H1 WAT 1756 76.176 59.599 15.055 1.00 0.00 H ATOM 76703 H2 WAT 1756 76.616 59.508 13.610 1.00 0.00 H TER 76705 WAT 1756 ATOM 76705 O WAT 1757 66.359 25.409 120.322 1.00 0.00 O ATOM 76706 H1 WAT 1757 66.284 24.519 120.666 1.00 0.00 H ATOM 76707 H2 WAT 1757 65.688 25.460 119.641 1.00 0.00 H TER 76709 WAT 1757 ATOM 76709 O WAT 1758 21.988 48.657 88.373 1.00 0.00 O ATOM 76710 H1 WAT 1758 22.935 48.640 88.234 1.00 0.00 H ATOM 76711 H2 WAT 1758 21.873 48.362 89.276 1.00 0.00 H TER 76713 WAT 1758 ATOM 76713 O WAT 1759 120.150 79.736 139.289 1.00 0.00 O ATOM 76714 H1 WAT 1759 119.451 79.083 139.259 1.00 0.00 H ATOM 76715 H2 WAT 1759 119.721 80.530 139.609 1.00 0.00 H TER 76717 WAT 1759 ATOM 76717 O WAT 1760 38.470 83.445 88.768 1.00 0.00 O ATOM 76718 H1 WAT 1760 38.579 82.919 89.560 1.00 0.00 H ATOM 76719 H2 WAT 1760 38.893 82.931 88.079 1.00 0.00 H TER 76721 WAT 1760 ATOM 76721 O WAT 1761 78.722 91.712 100.501 1.00 0.00 O ATOM 76722 H1 WAT 1761 78.894 90.947 99.953 1.00 0.00 H ATOM 76723 H2 WAT 1761 78.002 92.164 100.061 1.00 0.00 H TER 76725 WAT 1761 ATOM 76725 O WAT 1762 76.172 114.253 137.105 1.00 0.00 O ATOM 76726 H1 WAT 1762 77.110 114.371 137.254 1.00 0.00 H ATOM 76727 H2 WAT 1762 75.943 113.479 137.620 1.00 0.00 H TER 76729 WAT 1762 ATOM 76729 O WAT 1763 0.263 69.831 22.117 1.00 0.00 O ATOM 76730 H1 WAT 1763 0.495 70.335 22.897 1.00 0.00 H ATOM 76731 H2 WAT 1763 0.167 68.932 22.432 1.00 0.00 H TER 76733 WAT 1763 ATOM 76733 O WAT 1764 79.431 109.611 24.039 1.00 0.00 O ATOM 76734 H1 WAT 1764 78.829 109.442 23.314 1.00 0.00 H ATOM 76735 H2 WAT 1764 80.302 109.529 23.650 1.00 0.00 H TER 76737 WAT 1764 ATOM 76737 O WAT 1765 45.237 89.653 14.656 1.00 0.00 O ATOM 76738 H1 WAT 1765 45.855 89.816 15.368 1.00 0.00 H ATOM 76739 H2 WAT 1765 45.787 89.404 13.913 1.00 0.00 H TER 76741 WAT 1765 ATOM 76741 O WAT 1766 99.154 136.980 109.280 1.00 0.00 O ATOM 76742 H1 WAT 1766 98.983 136.087 108.983 1.00 0.00 H ATOM 76743 H2 WAT 1766 99.982 137.217 108.860 1.00 0.00 H TER 76745 WAT 1766 ATOM 76745 O WAT 1767 83.655 108.868 13.333 1.00 0.00 O ATOM 76746 H1 WAT 1767 84.170 109.512 12.847 1.00 0.00 H ATOM 76747 H2 WAT 1767 83.384 108.230 12.672 1.00 0.00 H TER 76749 WAT 1767 ATOM 76749 O WAT 1768 44.955 34.587 142.722 1.00 0.00 O ATOM 76750 H1 WAT 1768 45.030 33.821 143.291 1.00 0.00 H ATOM 76751 H2 WAT 1768 45.159 34.257 141.847 1.00 0.00 H TER 76753 WAT 1768 ATOM 76753 O WAT 1769 139.303 20.694 4.982 1.00 0.00 O ATOM 76754 H1 WAT 1769 139.088 21.594 5.230 1.00 0.00 H ATOM 76755 H2 WAT 1769 139.284 20.208 5.806 1.00 0.00 H TER 76757 WAT 1769 ATOM 76757 O WAT 1770 12.718 121.590 101.336 1.00 0.00 O ATOM 76758 H1 WAT 1770 11.924 121.463 101.855 1.00 0.00 H ATOM 76759 H2 WAT 1770 12.956 122.506 101.482 1.00 0.00 H TER 76761 WAT 1770 ATOM 76761 O WAT 1771 66.179 63.803 92.755 1.00 0.00 O ATOM 76762 H1 WAT 1771 66.737 64.544 92.518 1.00 0.00 H ATOM 76763 H2 WAT 1771 65.295 64.169 92.785 1.00 0.00 H TER 76765 WAT 1771 ATOM 76765 O WAT 1772 130.398 68.399 124.923 1.00 0.00 O ATOM 76766 H1 WAT 1772 130.987 68.070 125.602 1.00 0.00 H ATOM 76767 H2 WAT 1772 129.893 69.087 125.358 1.00 0.00 H TER 76769 WAT 1772 ATOM 76769 O WAT 1773 15.564 39.585 105.431 1.00 0.00 O ATOM 76770 H1 WAT 1773 14.795 39.034 105.573 1.00 0.00 H ATOM 76771 H2 WAT 1773 15.216 40.475 105.384 1.00 0.00 H TER 76773 WAT 1773 ATOM 76773 O WAT 1774 132.381 124.253 23.361 1.00 0.00 O ATOM 76774 H1 WAT 1774 131.888 124.754 24.010 1.00 0.00 H ATOM 76775 H2 WAT 1774 132.713 124.911 22.751 1.00 0.00 H TER 76777 WAT 1774 ATOM 76777 O WAT 1775 30.504 127.209 146.929 1.00 0.00 O ATOM 76778 H1 WAT 1775 30.114 127.961 146.484 1.00 0.00 H ATOM 76779 H2 WAT 1775 30.138 126.448 146.479 1.00 0.00 H TER 76781 WAT 1775 ATOM 76781 O WAT 1776 49.421 86.388 96.247 1.00 0.00 O ATOM 76782 H1 WAT 1776 49.459 85.448 96.072 1.00 0.00 H ATOM 76783 H2 WAT 1776 49.777 86.794 95.457 1.00 0.00 H TER 76785 WAT 1776 ATOM 76785 O WAT 1777 93.965 57.997 100.142 1.00 0.00 O ATOM 76786 H1 WAT 1777 93.310 57.483 99.669 1.00 0.00 H ATOM 76787 H2 WAT 1777 93.452 58.587 100.695 1.00 0.00 H TER 76789 WAT 1777 ATOM 76789 O WAT 1778 143.775 94.830 14.891 1.00 0.00 O ATOM 76790 H1 WAT 1778 143.956 94.396 15.725 1.00 0.00 H ATOM 76791 H2 WAT 1778 142.826 94.956 14.888 1.00 0.00 H TER 76793 WAT 1778 ATOM 76793 O WAT 1779 141.377 140.321 118.552 1.00 0.00 O ATOM 76794 H1 WAT 1779 141.452 140.873 119.330 1.00 0.00 H ATOM 76795 H2 WAT 1779 142.109 139.709 118.620 1.00 0.00 H TER 76797 WAT 1779 ATOM 76797 O WAT 1780 62.459 17.396 135.145 1.00 0.00 O ATOM 76798 H1 WAT 1780 61.965 16.650 135.485 1.00 0.00 H ATOM 76799 H2 WAT 1780 63.299 17.025 134.875 1.00 0.00 H TER 76801 WAT 1780 ATOM 76801 O WAT 1781 63.785 14.684 137.695 1.00 0.00 O ATOM 76802 H1 WAT 1781 63.848 13.829 138.121 1.00 0.00 H ATOM 76803 H2 WAT 1781 64.421 14.643 136.981 1.00 0.00 H TER 76805 WAT 1781 ATOM 76805 O WAT 1782 128.388 31.472 61.303 1.00 0.00 O ATOM 76806 H1 WAT 1782 127.709 31.386 60.634 1.00 0.00 H ATOM 76807 H2 WAT 1782 129.093 30.897 61.004 1.00 0.00 H TER 76809 WAT 1782 ATOM 76809 O WAT 1783 45.446 77.538 154.226 1.00 0.00 O ATOM 76810 H1 WAT 1783 45.412 78.275 154.835 1.00 0.00 H ATOM 76811 H2 WAT 1783 44.979 77.847 153.449 1.00 0.00 H TER 76813 WAT 1783 ATOM 76813 O WAT 1784 95.166 84.895 26.815 1.00 0.00 O ATOM 76814 H1 WAT 1784 94.804 84.210 26.253 1.00 0.00 H ATOM 76815 H2 WAT 1784 94.474 85.554 26.864 1.00 0.00 H TER 76817 WAT 1784 ATOM 76817 O WAT 1785 53.021 16.442 13.921 1.00 0.00 O ATOM 76818 H1 WAT 1785 53.827 16.586 14.415 1.00 0.00 H ATOM 76819 H2 WAT 1785 52.342 16.877 14.436 1.00 0.00 H TER 76821 WAT 1785 ATOM 76821 O WAT 1786 2.882 68.282 68.805 1.00 0.00 O ATOM 76822 H1 WAT 1786 3.697 67.846 68.554 1.00 0.00 H ATOM 76823 H2 WAT 1786 2.609 68.752 68.018 1.00 0.00 H TER 76825 WAT 1786 ATOM 76825 O WAT 1787 89.606 87.993 139.450 1.00 0.00 O ATOM 76826 H1 WAT 1787 89.623 87.037 139.397 1.00 0.00 H ATOM 76827 H2 WAT 1787 90.480 88.263 139.166 1.00 0.00 H TER 76829 WAT 1787 ATOM 76829 O WAT 1788 116.705 100.532 13.231 1.00 0.00 O ATOM 76830 H1 WAT 1788 117.274 100.074 13.849 1.00 0.00 H ATOM 76831 H2 WAT 1788 117.213 101.296 12.958 1.00 0.00 H TER 76833 WAT 1788 ATOM 76833 O WAT 1789 60.302 19.914 75.535 1.00 0.00 O ATOM 76834 H1 WAT 1789 61.139 20.371 75.453 1.00 0.00 H ATOM 76835 H2 WAT 1789 59.993 20.136 76.413 1.00 0.00 H TER 76837 WAT 1789 ATOM 76837 O WAT 1790 42.856 71.878 121.566 1.00 0.00 O ATOM 76838 H1 WAT 1790 42.061 71.369 121.413 1.00 0.00 H ATOM 76839 H2 WAT 1790 42.543 72.713 121.916 1.00 0.00 H TER 76841 WAT 1790 ATOM 76841 O WAT 1791 79.156 122.956 110.949 1.00 0.00 O ATOM 76842 H1 WAT 1791 78.335 123.089 111.422 1.00 0.00 H ATOM 76843 H2 WAT 1791 79.242 123.731 110.395 1.00 0.00 H TER 76845 WAT 1791 ATOM 76845 O WAT 1792 128.300 103.524 149.479 1.00 0.00 O ATOM 76846 H1 WAT 1792 127.391 103.291 149.287 1.00 0.00 H ATOM 76847 H2 WAT 1792 128.752 102.684 149.556 1.00 0.00 H TER 76849 WAT 1792 ATOM 76849 O WAT 1793 88.327 54.936 151.373 1.00 0.00 O ATOM 76850 H1 WAT 1793 88.496 54.734 150.453 1.00 0.00 H ATOM 76851 H2 WAT 1793 87.737 54.242 151.666 1.00 0.00 H TER 76853 WAT 1793 ATOM 76853 O WAT 1794 106.149 34.373 96.660 1.00 0.00 O ATOM 76854 H1 WAT 1794 105.937 35.304 96.730 1.00 0.00 H ATOM 76855 H2 WAT 1794 107.075 34.356 96.417 1.00 0.00 H TER 76857 WAT 1794 ATOM 76857 O WAT 1795 39.774 75.012 68.303 1.00 0.00 O ATOM 76858 H1 WAT 1795 39.512 74.461 67.566 1.00 0.00 H ATOM 76859 H2 WAT 1795 39.889 75.882 67.921 1.00 0.00 H TER 76861 WAT 1795 ATOM 76861 O WAT 1796 108.731 22.883 23.928 1.00 0.00 O ATOM 76862 H1 WAT 1796 108.876 23.641 24.494 1.00 0.00 H ATOM 76863 H2 WAT 1796 108.375 23.252 23.119 1.00 0.00 H TER 76865 WAT 1796 ATOM 76865 O WAT 1797 131.867 126.601 139.581 1.00 0.00 O ATOM 76866 H1 WAT 1797 131.025 127.055 139.550 1.00 0.00 H ATOM 76867 H2 WAT 1797 132.165 126.588 138.671 1.00 0.00 H TER 76869 WAT 1797 ATOM 76869 O WAT 1798 97.125 99.863 106.981 1.00 0.00 O ATOM 76870 H1 WAT 1798 96.713 99.085 107.357 1.00 0.00 H ATOM 76871 H2 WAT 1798 97.620 100.246 107.705 1.00 0.00 H TER 76873 WAT 1798 ATOM 76873 O WAT 1799 27.291 127.733 151.246 1.00 0.00 O ATOM 76874 H1 WAT 1799 27.865 127.296 150.617 1.00 0.00 H ATOM 76875 H2 WAT 1799 26.492 127.917 150.752 1.00 0.00 H TER 76877 WAT 1799 ATOM 76877 O WAT 1800 130.535 112.081 23.551 1.00 0.00 O ATOM 76878 H1 WAT 1800 131.237 111.955 24.188 1.00 0.00 H ATOM 76879 H2 WAT 1800 130.984 112.344 22.747 1.00 0.00 H TER 76881 WAT 1800 ATOM 76881 O WAT 1801 44.969 47.849 99.008 1.00 0.00 O ATOM 76882 H1 WAT 1801 45.663 47.600 98.397 1.00 0.00 H ATOM 76883 H2 WAT 1801 44.807 47.057 99.521 1.00 0.00 H TER 76885 WAT 1801 ATOM 76885 O WAT 1802 75.489 98.365 66.858 1.00 0.00 O ATOM 76886 H1 WAT 1802 74.881 99.071 66.639 1.00 0.00 H ATOM 76887 H2 WAT 1802 74.931 97.595 66.970 1.00 0.00 H TER 76889 WAT 1802 ATOM 76889 O WAT 1803 139.929 50.689 95.271 1.00 0.00 O ATOM 76890 H1 WAT 1803 139.613 49.962 95.808 1.00 0.00 H ATOM 76891 H2 WAT 1803 140.883 50.630 95.325 1.00 0.00 H TER 76893 WAT 1803 ATOM 76893 O WAT 1804 69.232 115.262 88.715 1.00 0.00 O ATOM 76894 H1 WAT 1804 69.754 115.561 87.971 1.00 0.00 H ATOM 76895 H2 WAT 1804 68.764 114.494 88.387 1.00 0.00 H TER 76897 WAT 1804 ATOM 76897 O WAT 1805 6.872 67.502 120.822 1.00 0.00 O ATOM 76898 H1 WAT 1805 6.153 66.998 121.202 1.00 0.00 H ATOM 76899 H2 WAT 1805 7.550 66.852 120.638 1.00 0.00 H TER 76901 WAT 1805 ATOM 76901 O WAT 1806 75.069 108.904 74.801 1.00 0.00 O ATOM 76902 H1 WAT 1806 74.419 108.443 75.331 1.00 0.00 H ATOM 76903 H2 WAT 1806 74.910 108.599 73.908 1.00 0.00 H TER 76905 WAT 1806 ATOM 76905 O WAT 1807 20.318 139.528 86.321 1.00 0.00 O ATOM 76906 H1 WAT 1807 20.662 139.183 85.497 1.00 0.00 H ATOM 76907 H2 WAT 1807 20.928 140.226 86.562 1.00 0.00 H TER 76909 WAT 1807 ATOM 76909 O WAT 1808 74.234 26.052 65.118 1.00 0.00 O ATOM 76910 H1 WAT 1808 74.952 25.467 64.876 1.00 0.00 H ATOM 76911 H2 WAT 1808 74.011 25.800 66.014 1.00 0.00 H TER 76913 WAT 1808 ATOM 76913 O WAT 1809 143.396 65.994 73.300 1.00 0.00 O ATOM 76914 H1 WAT 1809 143.224 65.202 73.809 1.00 0.00 H ATOM 76915 H2 WAT 1809 142.844 66.663 73.704 1.00 0.00 H TER 76917 WAT 1809 ATOM 76917 O WAT 1810 134.929 37.560 119.006 1.00 0.00 O ATOM 76918 H1 WAT 1810 133.974 37.623 119.026 1.00 0.00 H ATOM 76919 H2 WAT 1810 135.141 36.917 119.683 1.00 0.00 H TER 76921 WAT 1810 ATOM 76921 O WAT 1811 89.357 30.201 126.502 1.00 0.00 O ATOM 76922 H1 WAT 1811 89.731 30.992 126.114 1.00 0.00 H ATOM 76923 H2 WAT 1811 89.863 30.064 127.302 1.00 0.00 H TER 76925 WAT 1811 ATOM 76925 O WAT 1812 121.151 89.714 70.962 1.00 0.00 O ATOM 76926 H1 WAT 1812 120.386 89.140 70.931 1.00 0.00 H ATOM 76927 H2 WAT 1812 121.497 89.605 71.848 1.00 0.00 H TER 76929 WAT 1812 ATOM 76929 O WAT 1813 69.046 119.106 136.690 1.00 0.00 O ATOM 76930 H1 WAT 1813 68.148 119.244 136.390 1.00 0.00 H ATOM 76931 H2 WAT 1813 69.238 118.196 136.461 1.00 0.00 H TER 76933 WAT 1813 ATOM 76933 O WAT 1814 43.123 47.566 154.394 1.00 0.00 O ATOM 76934 H1 WAT 1814 44.046 47.471 154.631 1.00 0.00 H ATOM 76935 H2 WAT 1814 42.654 47.496 155.225 1.00 0.00 H TER 76937 WAT 1814 ATOM 76937 O WAT 1815 34.239 21.866 153.338 1.00 0.00 O ATOM 76938 H1 WAT 1815 34.062 21.149 152.730 1.00 0.00 H ATOM 76939 H2 WAT 1815 33.716 21.658 154.112 1.00 0.00 H TER 76941 WAT 1815 ATOM 76941 O WAT 1816 69.134 71.843 157.638 1.00 0.00 O ATOM 76942 H1 WAT 1816 70.004 71.575 157.340 1.00 0.00 H ATOM 76943 H2 WAT 1816 68.587 71.796 156.854 1.00 0.00 H TER 76945 WAT 1816 ATOM 76945 O WAT 1817 120.793 123.165 19.074 1.00 0.00 O ATOM 76946 H1 WAT 1817 120.384 122.335 19.318 1.00 0.00 H ATOM 76947 H2 WAT 1817 121.733 122.986 19.096 1.00 0.00 H TER 76949 WAT 1817 ATOM 76949 O WAT 1818 58.470 100.237 146.283 1.00 0.00 O ATOM 76950 H1 WAT 1818 59.387 100.187 146.554 1.00 0.00 H ATOM 76951 H2 WAT 1818 58.452 99.822 145.421 1.00 0.00 H TER 76953 WAT 1818 ATOM 76953 O WAT 1819 67.947 60.803 136.242 1.00 0.00 O ATOM 76954 H1 WAT 1819 67.751 60.776 135.306 1.00 0.00 H ATOM 76955 H2 WAT 1819 68.571 60.089 136.376 1.00 0.00 H TER 76957 WAT 1819 ATOM 76957 O WAT 1820 48.156 9.284 147.017 1.00 0.00 O ATOM 76958 H1 WAT 1820 48.062 8.471 146.520 1.00 0.00 H ATOM 76959 H2 WAT 1820 49.012 9.625 146.758 1.00 0.00 H TER 76961 WAT 1820 ATOM 76961 O WAT 1821 66.368 68.538 136.001 1.00 0.00 O ATOM 76962 H1 WAT 1821 66.729 67.792 136.481 1.00 0.00 H ATOM 76963 H2 WAT 1821 66.142 68.183 135.141 1.00 0.00 H TER 76965 WAT 1821 ATOM 76965 O WAT 1822 40.988 4.367 121.104 1.00 0.00 O ATOM 76966 H1 WAT 1822 41.396 5.230 121.028 1.00 0.00 H ATOM 76967 H2 WAT 1822 40.521 4.249 120.277 1.00 0.00 H TER 76969 WAT 1822 ATOM 76969 O WAT 1823 34.607 135.810 105.522 1.00 0.00 O ATOM 76970 H1 WAT 1823 34.610 135.391 106.383 1.00 0.00 H ATOM 76971 H2 WAT 1823 34.560 136.747 105.712 1.00 0.00 H TER 76973 WAT 1823 ATOM 76973 O WAT 1824 116.335 23.415 121.237 1.00 0.00 O ATOM 76974 H1 WAT 1824 115.757 22.653 121.271 1.00 0.00 H ATOM 76975 H2 WAT 1824 116.128 23.908 122.032 1.00 0.00 H TER 76977 WAT 1824 ATOM 76977 O WAT 1825 21.893 99.640 114.689 1.00 0.00 O ATOM 76978 H1 WAT 1825 21.526 98.885 115.150 1.00 0.00 H ATOM 76979 H2 WAT 1825 22.395 100.107 115.356 1.00 0.00 H TER 76981 WAT 1825 ATOM 76981 O WAT 1826 100.808 127.840 140.099 1.00 0.00 O ATOM 76982 H1 WAT 1826 101.044 128.767 140.100 1.00 0.00 H ATOM 76983 H2 WAT 1826 101.315 127.464 139.379 1.00 0.00 H TER 76985 WAT 1826 ATOM 76985 O WAT 1827 124.790 17.531 115.484 1.00 0.00 O ATOM 76986 H1 WAT 1827 123.942 17.812 115.141 1.00 0.00 H ATOM 76987 H2 WAT 1827 125.401 17.680 114.762 1.00 0.00 H TER 76989 WAT 1827 ATOM 76989 O WAT 1828 65.613 17.998 143.874 1.00 0.00 O ATOM 76990 H1 WAT 1828 65.385 17.072 143.946 1.00 0.00 H ATOM 76991 H2 WAT 1828 65.369 18.236 142.979 1.00 0.00 H TER 76993 WAT 1828 ATOM 76993 O WAT 1829 39.677 138.208 142.944 1.00 0.00 O ATOM 76994 H1 WAT 1829 39.755 139.121 142.666 1.00 0.00 H ATOM 76995 H2 WAT 1829 40.536 137.828 142.760 1.00 0.00 H TER 76997 WAT 1829 ATOM 76997 O WAT 1830 80.636 130.312 16.438 1.00 0.00 O ATOM 76998 H1 WAT 1830 80.413 129.383 16.490 1.00 0.00 H ATOM 76999 H2 WAT 1830 81.351 130.423 17.065 1.00 0.00 H TER 77001 WAT 1830 ATOM 77001 O WAT 1831 68.486 104.561 123.390 1.00 0.00 O ATOM 77002 H1 WAT 1831 67.698 104.028 123.490 1.00 0.00 H ATOM 77003 H2 WAT 1831 68.593 104.994 124.237 1.00 0.00 H TER 77005 WAT 1831 ATOM 77005 O WAT 1832 134.923 16.202 137.646 1.00 0.00 O ATOM 77006 H1 WAT 1832 135.729 16.118 138.155 1.00 0.00 H ATOM 77007 H2 WAT 1832 134.995 15.528 136.971 1.00 0.00 H TER 77009 WAT 1832 ATOM 77009 O WAT 1833 26.205 129.327 80.664 1.00 0.00 O ATOM 77010 H1 WAT 1833 27.038 129.673 80.982 1.00 0.00 H ATOM 77011 H2 WAT 1833 25.553 129.961 80.960 1.00 0.00 H TER 77013 WAT 1833 ATOM 77013 O WAT 1834 130.570 87.995 71.150 1.00 0.00 O ATOM 77014 H1 WAT 1834 131.363 88.400 71.501 1.00 0.00 H ATOM 77015 H2 WAT 1834 130.670 88.056 70.200 1.00 0.00 H TER 77017 WAT 1834 ATOM 77017 O WAT 1835 53.688 94.396 86.571 1.00 0.00 O ATOM 77018 H1 WAT 1835 53.896 93.601 87.063 1.00 0.00 H ATOM 77019 H2 WAT 1835 54.538 94.728 86.283 1.00 0.00 H TER 77021 WAT 1835 ATOM 77021 O WAT 1836 95.455 85.921 58.394 1.00 0.00 O ATOM 77022 H1 WAT 1836 95.768 85.282 59.034 1.00 0.00 H ATOM 77023 H2 WAT 1836 94.506 85.937 58.515 1.00 0.00 H TER 77025 WAT 1836 ATOM 77025 O WAT 1837 81.125 126.535 122.882 1.00 0.00 O ATOM 77026 H1 WAT 1837 80.490 125.831 122.754 1.00 0.00 H ATOM 77027 H2 WAT 1837 81.457 126.400 123.769 1.00 0.00 H TER 77029 WAT 1837 ATOM 77029 O WAT 1838 134.875 60.723 71.782 1.00 0.00 O ATOM 77030 H1 WAT 1838 134.283 61.381 72.148 1.00 0.00 H ATOM 77031 H2 WAT 1838 135.052 60.129 72.510 1.00 0.00 H TER 77033 WAT 1838 ATOM 77033 O WAT 1839 22.205 107.922 16.517 1.00 0.00 O ATOM 77034 H1 WAT 1839 22.333 107.209 17.141 1.00 0.00 H ATOM 77035 H2 WAT 1839 21.634 108.540 16.972 1.00 0.00 H TER 77037 WAT 1839 ATOM 77037 O WAT 1840 8.655 18.278 97.296 1.00 0.00 O ATOM 77038 H1 WAT 1840 7.846 18.059 97.759 1.00 0.00 H ATOM 77039 H2 WAT 1840 9.264 17.578 97.534 1.00 0.00 H TER 77041 WAT 1840 ATOM 77041 O WAT 1841 40.185 38.547 12.000 1.00 0.00 O ATOM 77042 H1 WAT 1841 40.241 39.452 11.692 1.00 0.00 H ATOM 77043 H2 WAT 1841 39.604 38.588 12.760 1.00 0.00 H TER 77045 WAT 1841 ATOM 77045 O WAT 1842 46.269 74.383 101.338 1.00 0.00 O ATOM 77046 H1 WAT 1842 47.189 74.585 101.512 1.00 0.00 H ATOM 77047 H2 WAT 1842 45.943 74.023 102.162 1.00 0.00 H TER 77049 WAT 1842 ATOM 77049 O WAT 1843 59.474 16.578 126.892 1.00 0.00 O ATOM 77050 H1 WAT 1843 58.890 15.820 126.926 1.00 0.00 H ATOM 77051 H2 WAT 1843 58.909 17.325 127.088 1.00 0.00 H TER 77053 WAT 1843 ATOM 77053 O WAT 1844 120.762 112.190 72.232 1.00 0.00 O ATOM 77054 H1 WAT 1844 121.385 111.591 71.822 1.00 0.00 H ATOM 77055 H2 WAT 1844 119.903 111.855 71.975 1.00 0.00 H TER 77057 WAT 1844 ATOM 77057 O WAT 1845 1.625 16.597 124.557 1.00 0.00 O ATOM 77058 H1 WAT 1845 0.991 15.997 124.165 1.00 0.00 H ATOM 77059 H2 WAT 1845 2.290 16.720 123.879 1.00 0.00 H TER 77061 WAT 1845 ATOM 77061 O WAT 1846 97.520 21.424 53.192 1.00 0.00 O ATOM 77062 H1 WAT 1846 97.128 22.181 52.756 1.00 0.00 H ATOM 77063 H2 WAT 1846 98.458 21.614 53.204 1.00 0.00 H TER 77065 WAT 1846 ATOM 77065 O WAT 1847 126.782 30.694 155.562 1.00 0.00 O ATOM 77066 H1 WAT 1847 126.120 30.547 154.886 1.00 0.00 H ATOM 77067 H2 WAT 1847 126.599 30.027 156.224 1.00 0.00 H TER 77069 WAT 1847 ATOM 77069 O WAT 1848 107.428 93.803 122.113 1.00 0.00 O ATOM 77070 H1 WAT 1848 107.787 94.684 122.007 1.00 0.00 H ATOM 77071 H2 WAT 1848 108.137 93.304 122.520 1.00 0.00 H TER 77073 WAT 1848 ATOM 77073 O WAT 1849 37.428 88.556 60.436 1.00 0.00 O ATOM 77074 H1 WAT 1849 37.267 88.734 59.510 1.00 0.00 H ATOM 77075 H2 WAT 1849 38.176 87.958 60.439 1.00 0.00 H TER 77077 WAT 1849 ATOM 77077 O WAT 1850 143.498 57.567 78.063 1.00 0.00 O ATOM 77078 H1 WAT 1850 144.257 57.809 78.595 1.00 0.00 H ATOM 77079 H2 WAT 1850 142.754 57.966 78.513 1.00 0.00 H TER 77081 WAT 1850 ATOM 77081 O WAT 1851 86.116 19.746 81.421 1.00 0.00 O ATOM 77082 H1 WAT 1851 86.954 19.285 81.399 1.00 0.00 H ATOM 77083 H2 WAT 1851 86.278 20.511 81.973 1.00 0.00 H TER 77085 WAT 1851 ATOM 77085 O WAT 1852 91.645 129.569 117.332 1.00 0.00 O ATOM 77086 H1 WAT 1852 90.793 129.918 117.592 1.00 0.00 H ATOM 77087 H2 WAT 1852 92.072 130.293 116.876 1.00 0.00 H TER 77089 WAT 1852 ATOM 77089 O WAT 1853 90.057 84.996 101.001 1.00 0.00 O ATOM 77090 H1 WAT 1853 90.897 85.343 101.302 1.00 0.00 H ATOM 77091 H2 WAT 1853 89.421 85.328 101.634 1.00 0.00 H TER 77093 WAT 1853 ATOM 77093 O WAT 1854 54.659 36.054 89.810 1.00 0.00 O ATOM 77094 H1 WAT 1854 54.805 35.982 90.753 1.00 0.00 H ATOM 77095 H2 WAT 1854 54.516 36.989 89.661 1.00 0.00 H TER 77097 WAT 1854 ATOM 77097 O WAT 1855 40.471 49.040 149.301 1.00 0.00 O ATOM 77098 H1 WAT 1855 40.708 49.754 149.893 1.00 0.00 H ATOM 77099 H2 WAT 1855 41.256 48.494 149.258 1.00 0.00 H TER 77101 WAT 1855 ATOM 77101 O WAT 1856 134.149 8.505 134.276 1.00 0.00 O ATOM 77102 H1 WAT 1856 134.023 8.386 133.335 1.00 0.00 H ATOM 77103 H2 WAT 1856 133.676 9.312 134.481 1.00 0.00 H TER 77105 WAT 1856 ATOM 77105 O WAT 1857 131.535 108.001 99.805 1.00 0.00 O ATOM 77106 H1 WAT 1857 130.742 107.787 100.297 1.00 0.00 H ATOM 77107 H2 WAT 1857 131.364 108.871 99.443 1.00 0.00 H TER 77109 WAT 1857 ATOM 77109 O WAT 1858 14.314 46.838 21.009 1.00 0.00 O ATOM 77110 H1 WAT 1858 14.444 46.509 20.120 1.00 0.00 H ATOM 77111 H2 WAT 1858 14.480 46.081 21.571 1.00 0.00 H TER 77113 WAT 1858 ATOM 77113 O WAT 1859 49.751 22.016 81.504 1.00 0.00 O ATOM 77114 H1 WAT 1859 49.930 22.665 80.823 1.00 0.00 H ATOM 77115 H2 WAT 1859 50.093 22.411 82.306 1.00 0.00 H TER 77117 WAT 1859 ATOM 77117 O WAT 1860 82.537 96.726 153.097 1.00 0.00 O ATOM 77118 H1 WAT 1860 83.436 97.053 153.131 1.00 0.00 H ATOM 77119 H2 WAT 1860 82.619 95.784 153.241 1.00 0.00 H TER 77121 WAT 1860 ATOM 77121 O WAT 1861 103.781 60.232 82.801 1.00 0.00 O ATOM 77122 H1 WAT 1861 103.135 60.496 83.455 1.00 0.00 H ATOM 77123 H2 WAT 1861 103.289 59.693 82.181 1.00 0.00 H TER 77125 WAT 1861 ATOM 77125 O WAT 1862 38.556 144.078 137.915 1.00 0.00 O ATOM 77126 H1 WAT 1862 39.025 143.962 138.741 1.00 0.00 H ATOM 77127 H2 WAT 1862 39.094 143.622 137.268 1.00 0.00 H TER 77129 WAT 1862 ATOM 77129 O WAT 1863 61.978 59.324 14.315 1.00 0.00 O ATOM 77130 H1 WAT 1863 61.114 58.966 14.519 1.00 0.00 H ATOM 77131 H2 WAT 1863 61.976 59.430 13.364 1.00 0.00 H TER 77133 WAT 1863 ATOM 77133 O WAT 1864 114.225 89.702 122.405 1.00 0.00 O ATOM 77134 H1 WAT 1864 113.795 90.493 122.731 1.00 0.00 H ATOM 77135 H2 WAT 1864 113.593 89.002 122.566 1.00 0.00 H TER 77137 WAT 1864 ATOM 77137 O WAT 1865 19.283 41.403 87.629 1.00 0.00 O ATOM 77138 H1 WAT 1865 18.909 42.201 88.003 1.00 0.00 H ATOM 77139 H2 WAT 1865 18.825 41.291 86.796 1.00 0.00 H TER 77141 WAT 1865 ATOM 77141 O WAT 1866 126.449 52.496 84.550 1.00 0.00 O ATOM 77142 H1 WAT 1866 126.132 53.132 85.191 1.00 0.00 H ATOM 77143 H2 WAT 1866 127.400 52.498 84.660 1.00 0.00 H TER 77145 WAT 1866 ATOM 77145 O WAT 1867 54.954 109.173 154.932 1.00 0.00 O ATOM 77146 H1 WAT 1867 54.525 109.226 155.786 1.00 0.00 H ATOM 77147 H2 WAT 1867 55.833 109.521 155.083 1.00 0.00 H TER 77149 WAT 1867 ATOM 77149 O WAT 1868 20.156 60.249 125.502 1.00 0.00 O ATOM 77150 H1 WAT 1868 20.760 60.882 125.113 1.00 0.00 H ATOM 77151 H2 WAT 1868 19.289 60.539 125.217 1.00 0.00 H TER 77153 WAT 1868 ATOM 77153 O WAT 1869 98.936 23.960 146.945 1.00 0.00 O ATOM 77154 H1 WAT 1869 99.758 24.052 147.428 1.00 0.00 H ATOM 77155 H2 WAT 1869 98.296 24.444 147.467 1.00 0.00 H TER 77157 WAT 1869 ATOM 77157 O WAT 1870 136.810 2.837 15.117 1.00 0.00 O ATOM 77158 H1 WAT 1870 137.039 2.875 16.045 1.00 0.00 H ATOM 77159 H2 WAT 1870 136.097 2.200 15.071 1.00 0.00 H TER 77161 WAT 1870 ATOM 77161 O WAT 1871 96.659 15.991 126.071 1.00 0.00 O ATOM 77162 H1 WAT 1871 96.937 16.376 126.902 1.00 0.00 H ATOM 77163 H2 WAT 1871 96.269 15.152 126.314 1.00 0.00 H TER 77165 WAT 1871 ATOM 77165 O WAT 1872 99.939 74.176 143.549 1.00 0.00 O ATOM 77166 H1 WAT 1872 100.199 74.765 142.841 1.00 0.00 H ATOM 77167 H2 WAT 1872 99.242 73.640 143.172 1.00 0.00 H TER 77169 WAT 1872 ATOM 77169 O WAT 1873 42.300 30.914 115.161 1.00 0.00 O ATOM 77170 H1 WAT 1873 42.301 31.005 114.208 1.00 0.00 H ATOM 77171 H2 WAT 1873 43.145 30.515 115.365 1.00 0.00 H TER 77173 WAT 1873 ATOM 77173 O WAT 1874 12.527 3.347 88.885 1.00 0.00 O ATOM 77174 H1 WAT 1874 12.981 2.525 89.069 1.00 0.00 H ATOM 77175 H2 WAT 1874 11.598 3.114 88.891 1.00 0.00 H TER 77177 WAT 1874 ATOM 77177 O WAT 1875 81.414 142.172 77.730 1.00 0.00 O ATOM 77178 H1 WAT 1875 81.251 142.680 76.935 1.00 0.00 H ATOM 77179 H2 WAT 1875 80.684 141.554 77.773 1.00 0.00 H TER 77181 WAT 1875 ATOM 77181 O WAT 1876 119.731 55.277 19.644 1.00 0.00 O ATOM 77182 H1 WAT 1876 120.157 55.699 18.898 1.00 0.00 H ATOM 77183 H2 WAT 1876 120.083 55.730 20.410 1.00 0.00 H TER 77185 WAT 1876 ATOM 77185 O WAT 1877 123.989 32.451 16.539 1.00 0.00 O ATOM 77186 H1 WAT 1877 123.412 33.098 16.944 1.00 0.00 H ATOM 77187 H2 WAT 1877 123.906 31.676 17.095 1.00 0.00 H TER 77189 WAT 1877 ATOM 77189 O WAT 1878 98.358 12.443 8.231 1.00 0.00 O ATOM 77190 H1 WAT 1878 97.642 11.812 8.168 1.00 0.00 H ATOM 77191 H2 WAT 1878 97.925 13.296 8.247 1.00 0.00 H TER 77193 WAT 1878 ATOM 77193 O WAT 1879 68.955 13.622 137.008 1.00 0.00 O ATOM 77194 H1 WAT 1879 68.751 13.382 137.912 1.00 0.00 H ATOM 77195 H2 WAT 1879 69.781 14.103 137.069 1.00 0.00 H TER 77197 WAT 1879 ATOM 77197 O WAT 1880 23.468 128.015 141.396 1.00 0.00 O ATOM 77198 H1 WAT 1880 24.359 127.809 141.679 1.00 0.00 H ATOM 77199 H2 WAT 1880 22.924 127.831 142.161 1.00 0.00 H TER 77201 WAT 1880 ATOM 77201 O WAT 1881 38.141 89.254 123.605 1.00 0.00 O ATOM 77202 H1 WAT 1881 37.769 88.861 122.816 1.00 0.00 H ATOM 77203 H2 WAT 1881 38.019 88.590 124.284 1.00 0.00 H TER 77205 WAT 1881 ATOM 77205 O WAT 1882 126.677 102.470 103.103 1.00 0.00 O ATOM 77206 H1 WAT 1882 126.243 101.880 103.719 1.00 0.00 H ATOM 77207 H2 WAT 1882 127.285 101.908 102.621 1.00 0.00 H TER 77209 WAT 1882 ATOM 77209 O WAT 1883 133.075 115.338 7.350 1.00 0.00 O ATOM 77210 H1 WAT 1883 133.534 116.036 6.884 1.00 0.00 H ATOM 77211 H2 WAT 1883 132.205 115.316 6.951 1.00 0.00 H TER 77213 WAT 1883 ATOM 77213 O WAT 1884 121.925 98.749 3.386 1.00 0.00 O ATOM 77214 H1 WAT 1884 121.418 98.284 2.721 1.00 0.00 H ATOM 77215 H2 WAT 1884 121.267 99.181 3.930 1.00 0.00 H TER 77217 WAT 1884 ATOM 77217 O WAT 1885 140.325 70.104 75.339 1.00 0.00 O ATOM 77218 H1 WAT 1885 140.713 70.977 75.277 1.00 0.00 H ATOM 77219 H2 WAT 1885 139.521 70.161 74.823 1.00 0.00 H TER 77221 WAT 1885 ATOM 77221 O WAT 1886 87.991 113.289 132.426 1.00 0.00 O ATOM 77222 H1 WAT 1886 87.958 114.108 131.931 1.00 0.00 H ATOM 77223 H2 WAT 1886 88.868 112.944 132.260 1.00 0.00 H TER 77225 WAT 1886 ATOM 77225 O WAT 1887 21.656 52.042 110.717 1.00 0.00 O ATOM 77226 H1 WAT 1887 20.838 52.267 110.274 1.00 0.00 H ATOM 77227 H2 WAT 1887 21.871 51.167 110.394 1.00 0.00 H TER 77229 WAT 1887 ATOM 77229 O WAT 1888 122.138 45.393 12.091 1.00 0.00 O ATOM 77230 H1 WAT 1888 121.603 46.105 11.739 1.00 0.00 H ATOM 77231 H2 WAT 1888 122.708 45.141 11.365 1.00 0.00 H TER 77233 WAT 1888 ATOM 77233 O WAT 1889 53.785 54.251 11.812 1.00 0.00 O ATOM 77234 H1 WAT 1889 52.985 54.776 11.809 1.00 0.00 H ATOM 77235 H2 WAT 1889 54.095 54.292 12.717 1.00 0.00 H TER 77237 WAT 1889 ATOM 77237 O WAT 1890 104.578 103.485 114.215 1.00 0.00 O ATOM 77238 H1 WAT 1890 104.035 102.895 113.692 1.00 0.00 H ATOM 77239 H2 WAT 1890 104.554 104.316 113.741 1.00 0.00 H TER 77241 WAT 1890 ATOM 77241 O WAT 1891 34.181 16.935 151.831 1.00 0.00 O ATOM 77242 H1 WAT 1891 34.904 16.549 151.336 1.00 0.00 H ATOM 77243 H2 WAT 1891 34.423 16.806 152.748 1.00 0.00 H TER 77245 WAT 1891 ATOM 77245 O WAT 1892 120.454 9.825 69.170 1.00 0.00 O ATOM 77246 H1 WAT 1892 121.350 9.951 69.483 1.00 0.00 H ATOM 77247 H2 WAT 1892 120.028 10.669 69.318 1.00 0.00 H TER 77249 WAT 1892 ATOM 77249 O WAT 1893 136.195 43.988 135.659 1.00 0.00 O ATOM 77250 H1 WAT 1893 135.347 43.549 135.590 1.00 0.00 H ATOM 77251 H2 WAT 1893 136.647 43.764 134.846 1.00 0.00 H TER 77253 WAT 1893 ATOM 77253 O WAT 1894 144.672 70.423 99.663 1.00 0.00 O ATOM 77254 H1 WAT 1894 144.862 71.221 99.170 1.00 0.00 H ATOM 77255 H2 WAT 1894 145.353 70.389 100.335 1.00 0.00 H TER 77257 WAT 1894 ATOM 77257 O WAT 1895 64.430 122.569 118.739 1.00 0.00 O ATOM 77258 H1 WAT 1895 64.619 123.405 119.167 1.00 0.00 H ATOM 77259 H2 WAT 1895 63.497 122.615 118.527 1.00 0.00 H TER 77261 WAT 1895 ATOM 77261 O WAT 1896 13.184 106.264 110.874 1.00 0.00 O ATOM 77262 H1 WAT 1896 12.448 105.916 110.370 1.00 0.00 H ATOM 77263 H2 WAT 1896 13.301 105.640 111.590 1.00 0.00 H TER 77265 WAT 1896 ATOM 77265 O WAT 1897 87.980 86.058 83.391 1.00 0.00 O ATOM 77266 H1 WAT 1897 88.449 85.570 84.069 1.00 0.00 H ATOM 77267 H2 WAT 1897 88.238 85.637 82.571 1.00 0.00 H TER 77269 WAT 1897 ATOM 77269 O WAT 1898 93.845 20.362 118.988 1.00 0.00 O ATOM 77270 H1 WAT 1898 93.487 19.488 118.829 1.00 0.00 H ATOM 77271 H2 WAT 1898 94.396 20.538 118.226 1.00 0.00 H TER 77273 WAT 1898 ATOM 77273 O WAT 1899 54.517 20.934 57.070 1.00 0.00 O ATOM 77274 H1 WAT 1899 55.209 21.373 56.575 1.00 0.00 H ATOM 77275 H2 WAT 1899 54.531 20.031 56.752 1.00 0.00 H TER 77277 WAT 1899 ATOM 77277 O WAT 1900 79.496 57.132 71.874 1.00 0.00 O ATOM 77278 H1 WAT 1900 78.962 56.347 71.753 1.00 0.00 H ATOM 77279 H2 WAT 1900 80.397 56.809 71.883 1.00 0.00 H TER 77281 WAT 1900 ATOM 77281 O WAT 1901 91.684 115.165 153.271 1.00 0.00 O ATOM 77282 H1 WAT 1901 92.222 114.566 153.788 1.00 0.00 H ATOM 77283 H2 WAT 1901 90.793 114.825 153.362 1.00 0.00 H TER 77285 WAT 1901 ATOM 77285 O WAT 1902 34.369 115.028 60.287 1.00 0.00 O ATOM 77286 H1 WAT 1902 34.574 114.164 60.643 1.00 0.00 H ATOM 77287 H2 WAT 1902 35.200 115.502 60.314 1.00 0.00 H TER 77289 WAT 1902 ATOM 77289 O WAT 1903 134.825 80.042 12.351 1.00 0.00 O ATOM 77290 H1 WAT 1903 135.135 80.833 12.792 1.00 0.00 H ATOM 77291 H2 WAT 1903 134.229 79.635 12.980 1.00 0.00 H TER 77293 WAT 1903 ATOM 77293 O WAT 1904 115.426 115.106 137.430 1.00 0.00 O ATOM 77294 H1 WAT 1904 114.577 115.348 137.061 1.00 0.00 H ATOM 77295 H2 WAT 1904 115.337 114.178 137.647 1.00 0.00 H TER 77297 WAT 1904 ATOM 77297 O WAT 1905 89.038 89.278 26.757 1.00 0.00 O ATOM 77298 H1 WAT 1905 89.789 88.985 27.273 1.00 0.00 H ATOM 77299 H2 WAT 1905 89.156 90.224 26.678 1.00 0.00 H TER 77301 WAT 1905 ATOM 77301 O WAT 1906 126.752 32.293 141.435 1.00 0.00 O ATOM 77302 H1 WAT 1906 125.890 32.003 141.136 1.00 0.00 H ATOM 77303 H2 WAT 1906 126.892 31.820 142.255 1.00 0.00 H TER 77305 WAT 1906 ATOM 77305 O WAT 1907 132.288 77.318 30.525 1.00 0.00 O ATOM 77306 H1 WAT 1907 132.686 77.627 31.339 1.00 0.00 H ATOM 77307 H2 WAT 1907 132.911 76.678 30.181 1.00 0.00 H TER 77309 WAT 1907 ATOM 77309 O WAT 1908 77.112 25.211 126.221 1.00 0.00 O ATOM 77310 H1 WAT 1908 77.768 25.878 126.424 1.00 0.00 H ATOM 77311 H2 WAT 1908 77.563 24.379 126.361 1.00 0.00 H TER 77313 WAT 1908 ATOM 77313 O WAT 1909 2.120 66.783 122.573 1.00 0.00 O ATOM 77314 H1 WAT 1909 2.125 66.193 123.326 1.00 0.00 H ATOM 77315 H2 WAT 1909 1.252 67.187 122.590 1.00 0.00 H TER 77317 WAT 1909 ATOM 77317 O WAT 1910 104.580 110.766 66.818 1.00 0.00 O ATOM 77318 H1 WAT 1910 104.656 111.289 67.616 1.00 0.00 H ATOM 77319 H2 WAT 1910 104.983 109.927 67.043 1.00 0.00 H TER 77321 WAT 1910 ATOM 77321 O WAT 1911 97.894 30.136 0.818 1.00 0.00 O ATOM 77322 H1 WAT 1911 97.503 30.590 0.072 1.00 0.00 H ATOM 77323 H2 WAT 1911 97.379 30.424 1.571 1.00 0.00 H TER 77325 WAT 1911 ATOM 77325 O WAT 1912 19.211 20.061 143.158 1.00 0.00 O ATOM 77326 H1 WAT 1912 18.715 19.243 143.183 1.00 0.00 H ATOM 77327 H2 WAT 1912 20.018 19.867 143.635 1.00 0.00 H TER 77329 WAT 1912 ATOM 77329 O WAT 1913 134.907 108.079 6.186 1.00 0.00 O ATOM 77330 H1 WAT 1913 134.431 107.585 6.854 1.00 0.00 H ATOM 77331 H2 WAT 1913 135.704 108.372 6.628 1.00 0.00 H TER 77333 WAT 1913 ATOM 77333 O WAT 1914 24.290 37.703 26.364 1.00 0.00 O ATOM 77334 H1 WAT 1914 24.471 37.185 25.580 1.00 0.00 H ATOM 77335 H2 WAT 1914 24.070 38.573 26.031 1.00 0.00 H TER 77337 WAT 1914 ATOM 77337 O WAT 1915 141.485 97.271 70.233 1.00 0.00 O ATOM 77338 H1 WAT 1915 141.292 97.233 71.169 1.00 0.00 H ATOM 77339 H2 WAT 1915 142.434 97.393 70.189 1.00 0.00 H TER 77341 WAT 1915 ATOM 77341 O WAT 1916 14.542 51.548 80.205 1.00 0.00 O ATOM 77342 H1 WAT 1916 14.131 50.697 80.358 1.00 0.00 H ATOM 77343 H2 WAT 1916 15.448 51.338 79.977 1.00 0.00 H TER 77345 WAT 1916 ATOM 77345 O WAT 1917 26.848 80.207 135.527 1.00 0.00 O ATOM 77346 H1 WAT 1917 27.058 80.843 136.211 1.00 0.00 H ATOM 77347 H2 WAT 1917 25.918 80.347 135.347 1.00 0.00 H TER 77349 WAT 1917 ATOM 77349 O WAT 1918 2.410 135.491 125.114 1.00 0.00 O ATOM 77350 H1 WAT 1918 2.754 134.861 124.481 1.00 0.00 H ATOM 77351 H2 WAT 1918 3.119 135.607 125.746 1.00 0.00 H TER 77353 WAT 1918 ATOM 77353 O WAT 1919 18.849 22.809 106.508 1.00 0.00 O ATOM 77354 H1 WAT 1919 19.285 23.310 107.198 1.00 0.00 H ATOM 77355 H2 WAT 1919 18.933 23.356 105.726 1.00 0.00 H TER 77357 WAT 1919 ATOM 77357 O WAT 1920 67.478 122.931 128.921 1.00 0.00 O ATOM 77358 H1 WAT 1920 66.987 122.739 128.122 1.00 0.00 H ATOM 77359 H2 WAT 1920 67.518 123.887 128.954 1.00 0.00 H TER 77361 WAT 1920 ATOM 77361 O WAT 1921 143.932 6.529 138.572 1.00 0.00 O ATOM 77362 H1 WAT 1921 143.294 6.158 139.181 1.00 0.00 H ATOM 77363 H2 WAT 1921 144.737 6.039 138.741 1.00 0.00 H TER 77365 WAT 1921 ATOM 77365 O WAT 1922 59.628 108.349 151.635 1.00 0.00 O ATOM 77366 H1 WAT 1922 60.075 108.424 152.478 1.00 0.00 H ATOM 77367 H2 WAT 1922 58.771 107.981 151.849 1.00 0.00 H TER 77369 WAT 1922 ATOM 77369 O WAT 1923 130.813 4.133 125.325 1.00 0.00 O ATOM 77370 H1 WAT 1923 131.183 4.475 126.139 1.00 0.00 H ATOM 77371 H2 WAT 1923 131.534 3.654 124.916 1.00 0.00 H TER 77373 WAT 1923 ATOM 77373 O WAT 1924 19.035 138.030 14.165 1.00 0.00 O ATOM 77374 H1 WAT 1924 19.885 137.598 14.245 1.00 0.00 H ATOM 77375 H2 WAT 1924 18.596 137.853 14.997 1.00 0.00 H TER 77377 WAT 1924 ATOM 77377 O WAT 1925 82.724 127.673 131.463 1.00 0.00 O ATOM 77378 H1 WAT 1925 82.871 127.969 130.565 1.00 0.00 H ATOM 77379 H2 WAT 1925 82.929 126.738 131.444 1.00 0.00 H TER 77381 WAT 1925 ATOM 77381 O WAT 1926 59.154 25.668 90.411 1.00 0.00 O ATOM 77382 H1 WAT 1926 59.967 25.420 89.972 1.00 0.00 H ATOM 77383 H2 WAT 1926 58.505 25.712 89.709 1.00 0.00 H TER 77385 WAT 1926 ATOM 77385 O WAT 1927 84.398 117.546 74.153 1.00 0.00 O ATOM 77386 H1 WAT 1927 84.888 117.450 73.336 1.00 0.00 H ATOM 77387 H2 WAT 1927 84.990 117.214 74.828 1.00 0.00 H TER 77389 WAT 1927 ATOM 77389 O WAT 1928 53.288 13.262 23.035 1.00 0.00 O ATOM 77390 H1 WAT 1928 52.406 13.588 22.857 1.00 0.00 H ATOM 77391 H2 WAT 1928 53.629 13.011 22.177 1.00 0.00 H TER 77393 WAT 1928 ATOM 77393 O WAT 1929 77.763 9.160 8.401 1.00 0.00 O ATOM 77394 H1 WAT 1929 77.658 9.397 9.322 1.00 0.00 H ATOM 77395 H2 WAT 1929 76.879 9.211 8.038 1.00 0.00 H TER 77397 WAT 1929 ATOM 77397 O WAT 1930 105.862 82.603 104.582 1.00 0.00 O ATOM 77398 H1 WAT 1930 105.676 81.677 104.427 1.00 0.00 H ATOM 77399 H2 WAT 1930 105.015 83.038 104.485 1.00 0.00 H TER 77401 WAT 1930 ATOM 77401 O WAT 1931 71.794 93.694 76.819 1.00 0.00 O ATOM 77402 H1 WAT 1931 72.674 93.690 76.442 1.00 0.00 H ATOM 77403 H2 WAT 1931 71.370 94.459 76.430 1.00 0.00 H TER 77405 WAT 1931 ATOM 77405 O WAT 1932 103.114 140.436 140.282 1.00 0.00 O ATOM 77406 H1 WAT 1932 102.520 140.161 140.981 1.00 0.00 H ATOM 77407 H2 WAT 1932 102.701 141.215 139.911 1.00 0.00 H TER 77409 WAT 1932 ATOM 77409 O WAT 1933 102.697 101.778 8.871 1.00 0.00 O ATOM 77410 H1 WAT 1933 102.161 101.148 9.353 1.00 0.00 H ATOM 77411 H2 WAT 1933 102.718 102.554 9.432 1.00 0.00 H TER 77413 WAT 1933 ATOM 77413 O WAT 1934 132.914 29.353 136.260 1.00 0.00 O ATOM 77414 H1 WAT 1934 132.330 28.632 136.024 1.00 0.00 H ATOM 77415 H2 WAT 1934 132.745 29.502 137.190 1.00 0.00 H TER 77417 WAT 1934 ATOM 77417 O WAT 1935 24.249 133.540 85.080 1.00 0.00 O ATOM 77418 H1 WAT 1935 24.489 132.663 84.782 1.00 0.00 H ATOM 77419 H2 WAT 1935 23.879 133.404 85.952 1.00 0.00 H TER 77421 WAT 1935 ATOM 77421 O WAT 1936 132.829 111.187 28.104 1.00 0.00 O ATOM 77422 H1 WAT 1936 133.021 110.659 28.879 1.00 0.00 H ATOM 77423 H2 WAT 1936 133.456 110.884 27.447 1.00 0.00 H TER 77425 WAT 1936 ATOM 77425 O WAT 1937 81.055 133.959 127.252 1.00 0.00 O ATOM 77426 H1 WAT 1937 80.245 133.556 127.566 1.00 0.00 H ATOM 77427 H2 WAT 1937 81.712 133.714 127.903 1.00 0.00 H TER 77429 WAT 1937 ATOM 77429 O WAT 1938 18.597 99.602 1.575 1.00 0.00 O ATOM 77430 H1 WAT 1938 18.089 98.860 1.903 1.00 0.00 H ATOM 77431 H2 WAT 1938 18.257 99.755 0.693 1.00 0.00 H TER 77433 WAT 1938 ATOM 77433 O WAT 1939 34.030 38.857 12.792 1.00 0.00 O ATOM 77434 H1 WAT 1939 33.844 38.275 12.055 1.00 0.00 H ATOM 77435 H2 WAT 1939 34.783 38.459 13.229 1.00 0.00 H TER 77437 WAT 1939 ATOM 77437 O WAT 1940 82.204 75.396 20.116 1.00 0.00 O ATOM 77438 H1 WAT 1940 83.101 75.705 19.988 1.00 0.00 H ATOM 77439 H2 WAT 1940 81.659 76.066 19.704 1.00 0.00 H TER 77441 WAT 1940 ATOM 77441 O WAT 1941 62.884 4.508 10.140 1.00 0.00 O ATOM 77442 H1 WAT 1941 63.422 4.003 10.750 1.00 0.00 H ATOM 77443 H2 WAT 1941 62.770 3.930 9.385 1.00 0.00 H TER 77445 WAT 1941 ATOM 77445 O WAT 1942 25.822 78.206 94.742 1.00 0.00 O ATOM 77446 H1 WAT 1942 25.448 77.337 94.594 1.00 0.00 H ATOM 77447 H2 WAT 1942 26.689 78.166 94.339 1.00 0.00 H TER 77449 WAT 1942 ATOM 77449 O WAT 1943 12.740 34.843 117.801 1.00 0.00 O ATOM 77450 H1 WAT 1943 12.666 35.788 117.935 1.00 0.00 H ATOM 77451 H2 WAT 1943 11.838 34.524 117.841 1.00 0.00 H TER 77453 WAT 1943 ATOM 77453 O WAT 1944 15.808 25.986 86.111 1.00 0.00 O ATOM 77454 H1 WAT 1944 16.210 26.119 85.253 1.00 0.00 H ATOM 77455 H2 WAT 1944 16.371 26.469 86.717 1.00 0.00 H TER 77457 WAT 1944 ATOM 77457 O WAT 1945 94.950 38.911 81.267 1.00 0.00 O ATOM 77458 H1 WAT 1945 95.220 39.512 80.573 1.00 0.00 H ATOM 77459 H2 WAT 1945 94.168 38.481 80.920 1.00 0.00 H TER 77461 WAT 1945 ATOM 77461 O WAT 1946 86.229 69.587 147.274 1.00 0.00 O ATOM 77462 H1 WAT 1946 87.110 69.892 147.057 1.00 0.00 H ATOM 77463 H2 WAT 1946 85.673 69.952 146.586 1.00 0.00 H TER 77465 WAT 1946 ATOM 77465 O WAT 1947 133.489 95.277 135.998 1.00 0.00 O ATOM 77466 H1 WAT 1947 133.634 95.169 136.938 1.00 0.00 H ATOM 77467 H2 WAT 1947 132.625 95.685 135.935 1.00 0.00 H TER 77469 WAT 1947 ATOM 77469 O WAT 1948 40.701 107.147 115.229 1.00 0.00 O ATOM 77470 H1 WAT 1948 40.291 107.579 115.978 1.00 0.00 H ATOM 77471 H2 WAT 1948 39.967 106.869 114.681 1.00 0.00 H TER 77473 WAT 1948 ATOM 77473 O WAT 1949 135.688 58.280 10.943 1.00 0.00 O ATOM 77474 H1 WAT 1949 135.797 59.126 10.509 1.00 0.00 H ATOM 77475 H2 WAT 1949 135.614 58.496 11.873 1.00 0.00 H TER 77477 WAT 1949 ATOM 77477 O WAT 1950 106.360 126.299 104.994 1.00 0.00 O ATOM 77478 H1 WAT 1950 106.702 126.778 104.239 1.00 0.00 H ATOM 77479 H2 WAT 1950 106.394 126.930 105.713 1.00 0.00 H TER 77481 WAT 1950 ATOM 77481 O WAT 1951 135.313 90.138 118.219 1.00 0.00 O ATOM 77482 H1 WAT 1951 135.441 90.972 117.766 1.00 0.00 H ATOM 77483 H2 WAT 1951 135.141 90.383 119.128 1.00 0.00 H TER 77485 WAT 1951 ATOM 77485 O WAT 1952 28.614 43.505 109.519 1.00 0.00 O ATOM 77486 H1 WAT 1952 28.964 42.966 108.809 1.00 0.00 H ATOM 77487 H2 WAT 1952 28.276 42.875 110.155 1.00 0.00 H TER 77489 WAT 1952 ATOM 77489 O WAT 1953 49.837 42.546 89.590 1.00 0.00 O ATOM 77490 H1 WAT 1953 49.784 41.610 89.394 1.00 0.00 H ATOM 77491 H2 WAT 1953 50.584 42.624 90.183 1.00 0.00 H TER 77493 WAT 1953 ATOM 77493 O WAT 1954 90.038 49.395 55.159 1.00 0.00 O ATOM 77494 H1 WAT 1954 90.617 48.648 55.308 1.00 0.00 H ATOM 77495 H2 WAT 1954 89.662 49.582 56.019 1.00 0.00 H TER 77497 WAT 1954 ATOM 77497 O WAT 1955 74.368 59.067 15.687 1.00 0.00 O ATOM 77498 H1 WAT 1955 73.695 58.467 15.363 1.00 0.00 H ATOM 77499 H2 WAT 1955 74.167 59.902 15.265 1.00 0.00 H TER 77501 WAT 1955 ATOM 77501 O WAT 1956 145.811 119.921 58.762 1.00 0.00 O ATOM 77502 H1 WAT 1956 145.281 119.949 57.966 1.00 0.00 H ATOM 77503 H2 WAT 1956 146.267 119.080 58.718 1.00 0.00 H TER 77505 WAT 1956 ATOM 77505 O WAT 1957 94.368 35.465 131.316 1.00 0.00 O ATOM 77506 H1 WAT 1957 94.790 36.306 131.142 1.00 0.00 H ATOM 77507 H2 WAT 1957 94.968 35.014 131.910 1.00 0.00 H TER 77509 WAT 1957 ATOM 77509 O WAT 1958 126.827 62.276 124.136 1.00 0.00 O ATOM 77510 H1 WAT 1958 126.115 61.796 123.714 1.00 0.00 H ATOM 77511 H2 WAT 1958 127.623 61.846 123.824 1.00 0.00 H TER 77513 WAT 1958 ATOM 77513 O WAT 1959 101.235 71.807 6.178 1.00 0.00 O ATOM 77514 H1 WAT 1959 102.021 71.754 6.721 1.00 0.00 H ATOM 77515 H2 WAT 1959 101.563 71.780 5.279 1.00 0.00 H TER 77517 WAT 1959 ATOM 77517 O WAT 1960 90.569 101.196 130.190 1.00 0.00 O ATOM 77518 H1 WAT 1960 90.844 100.311 129.954 1.00 0.00 H ATOM 77519 H2 WAT 1960 90.462 101.646 129.352 1.00 0.00 H TER 77521 WAT 1960 ATOM 77521 O WAT 1961 49.714 10.680 93.919 1.00 0.00 O ATOM 77522 H1 WAT 1961 50.233 11.248 93.350 1.00 0.00 H ATOM 77523 H2 WAT 1961 48.877 10.586 93.465 1.00 0.00 H TER 77525 WAT 1961 ATOM 77525 O WAT 1962 100.808 60.936 70.557 1.00 0.00 O ATOM 77526 H1 WAT 1962 100.000 60.437 70.671 1.00 0.00 H ATOM 77527 H2 WAT 1962 101.487 60.271 70.446 1.00 0.00 H TER 77529 WAT 1962 ATOM 77529 O WAT 1963 124.522 84.772 111.101 1.00 0.00 O ATOM 77530 H1 WAT 1963 124.892 84.697 110.222 1.00 0.00 H ATOM 77531 H2 WAT 1963 123.645 84.395 111.026 1.00 0.00 H TER 77533 WAT 1963 ATOM 77533 O WAT 1964 35.227 117.902 143.072 1.00 0.00 O ATOM 77534 H1 WAT 1964 35.337 118.847 142.971 1.00 0.00 H ATOM 77535 H2 WAT 1964 34.743 117.803 143.892 1.00 0.00 H TER 77537 WAT 1964 ATOM 77537 O WAT 1965 16.616 80.163 116.647 1.00 0.00 O ATOM 77538 H1 WAT 1965 17.134 79.766 117.347 1.00 0.00 H ATOM 77539 H2 WAT 1965 16.197 79.422 116.209 1.00 0.00 H TER 77541 WAT 1965 ATOM 77541 O WAT 1966 133.102 50.341 3.293 1.00 0.00 O ATOM 77542 H1 WAT 1966 132.146 50.285 3.287 1.00 0.00 H ATOM 77543 H2 WAT 1966 133.328 50.474 4.213 1.00 0.00 H TER 77545 WAT 1966 ATOM 77545 O WAT 1967 91.538 112.970 63.360 1.00 0.00 O ATOM 77546 H1 WAT 1967 91.277 112.636 64.218 1.00 0.00 H ATOM 77547 H2 WAT 1967 90.789 112.788 62.794 1.00 0.00 H TER 77549 WAT 1967 ATOM 77549 O WAT 1968 82.170 91.198 90.823 1.00 0.00 O ATOM 77550 H1 WAT 1968 82.965 91.675 91.062 1.00 0.00 H ATOM 77551 H2 WAT 1968 82.471 90.521 90.217 1.00 0.00 H TER 77553 WAT 1968 ATOM 77553 O WAT 1969 127.183 132.612 104.876 1.00 0.00 O ATOM 77554 H1 WAT 1969 126.857 131.979 104.237 1.00 0.00 H ATOM 77555 H2 WAT 1969 127.295 132.104 105.680 1.00 0.00 H TER 77557 WAT 1969 ATOM 77557 O WAT 1970 115.654 57.955 146.122 1.00 0.00 O ATOM 77558 H1 WAT 1970 116.330 57.824 145.458 1.00 0.00 H ATOM 77559 H2 WAT 1970 115.085 58.632 145.754 1.00 0.00 H TER 77561 WAT 1970 ATOM 77561 O WAT 1971 114.017 129.875 140.167 1.00 0.00 O ATOM 77562 H1 WAT 1971 114.108 129.449 141.020 1.00 0.00 H ATOM 77563 H2 WAT 1971 114.889 129.819 139.778 1.00 0.00 H TER 77565 WAT 1971 ATOM 77565 O WAT 1972 50.391 62.370 129.955 1.00 0.00 O ATOM 77566 H1 WAT 1972 51.202 62.168 129.490 1.00 0.00 H ATOM 77567 H2 WAT 1972 50.514 61.994 130.826 1.00 0.00 H TER 77569 WAT 1972 ATOM 77569 O WAT 1973 14.743 80.310 120.848 1.00 0.00 O ATOM 77570 H1 WAT 1973 14.728 80.084 119.918 1.00 0.00 H ATOM 77571 H2 WAT 1973 15.673 80.410 121.055 1.00 0.00 H TER 77573 WAT 1973 ATOM 77573 O WAT 1974 107.390 143.593 70.916 1.00 0.00 O ATOM 77574 H1 WAT 1974 107.806 143.760 70.070 1.00 0.00 H ATOM 77575 H2 WAT 1974 106.750 144.298 71.012 1.00 0.00 H TER 77577 WAT 1974 ATOM 77577 O WAT 1975 61.514 8.149 12.653 1.00 0.00 O ATOM 77578 H1 WAT 1975 61.091 7.397 12.240 1.00 0.00 H ATOM 77579 H2 WAT 1975 62.246 7.774 13.143 1.00 0.00 H TER 77581 WAT 1975 ATOM 77581 O WAT 1976 13.176 116.640 151.144 1.00 0.00 O ATOM 77582 H1 WAT 1976 14.082 116.333 151.111 1.00 0.00 H ATOM 77583 H2 WAT 1976 13.017 117.010 150.276 1.00 0.00 H TER 77585 WAT 1976 ATOM 77585 O WAT 1977 124.607 10.832 131.779 1.00 0.00 O ATOM 77586 H1 WAT 1977 124.597 11.665 132.251 1.00 0.00 H ATOM 77587 H2 WAT 1977 125.252 10.959 131.083 1.00 0.00 H TER 77589 WAT 1977 ATOM 77589 O WAT 1978 73.543 122.911 123.839 1.00 0.00 O ATOM 77590 H1 WAT 1978 72.776 122.768 124.393 1.00 0.00 H ATOM 77591 H2 WAT 1978 73.203 122.869 122.945 1.00 0.00 H TER 77593 WAT 1978 ATOM 77593 O WAT 1979 55.561 112.540 131.859 1.00 0.00 O ATOM 77594 H1 WAT 1979 54.661 112.743 131.604 1.00 0.00 H ATOM 77595 H2 WAT 1979 56.102 113.042 131.249 1.00 0.00 H TER 77597 WAT 1979 ATOM 77597 O WAT 1980 79.605 117.070 64.336 1.00 0.00 O ATOM 77598 H1 WAT 1980 79.585 117.881 63.827 1.00 0.00 H ATOM 77599 H2 WAT 1980 78.885 117.162 64.960 1.00 0.00 H TER 77601 WAT 1980 ATOM 77601 O WAT 1981 12.172 46.639 81.968 1.00 0.00 O ATOM 77602 H1 WAT 1981 12.383 47.512 82.299 1.00 0.00 H ATOM 77603 H2 WAT 1981 12.397 46.674 81.039 1.00 0.00 H TER 77605 WAT 1981 ATOM 77605 O WAT 1982 99.043 75.536 136.190 1.00 0.00 O ATOM 77606 H1 WAT 1982 98.255 75.945 136.546 1.00 0.00 H ATOM 77607 H2 WAT 1982 99.631 76.268 136.005 1.00 0.00 H TER 77609 WAT 1982 ATOM 77609 O WAT 1983 32.605 72.479 2.572 1.00 0.00 O ATOM 77610 H1 WAT 1983 32.314 71.590 2.779 1.00 0.00 H ATOM 77611 H2 WAT 1983 32.347 72.998 3.333 1.00 0.00 H TER 77613 WAT 1983 ATOM 77613 O WAT 1984 14.880 96.188 8.258 1.00 0.00 O ATOM 77614 H1 WAT 1984 15.832 96.190 8.364 1.00 0.00 H ATOM 77615 H2 WAT 1984 14.543 95.998 9.133 1.00 0.00 H TER 77617 WAT 1984 ATOM 77617 O WAT 1985 44.148 30.042 103.090 1.00 0.00 O ATOM 77618 H1 WAT 1985 44.057 29.228 102.594 1.00 0.00 H ATOM 77619 H2 WAT 1985 43.861 30.725 102.483 1.00 0.00 H TER 77621 WAT 1985 ATOM 77621 O WAT 1986 137.232 119.798 81.122 1.00 0.00 O ATOM 77622 H1 WAT 1986 137.642 120.539 80.676 1.00 0.00 H ATOM 77623 H2 WAT 1986 137.709 119.721 81.948 1.00 0.00 H TER 77625 WAT 1986 ATOM 77625 O WAT 1987 48.430 55.730 9.588 1.00 0.00 O ATOM 77626 H1 WAT 1987 47.473 55.695 9.609 1.00 0.00 H ATOM 77627 H2 WAT 1987 48.630 56.457 8.998 1.00 0.00 H TER 77629 WAT 1987 ATOM 77629 O WAT 1988 144.100 106.434 89.867 1.00 0.00 O ATOM 77630 H1 WAT 1988 144.851 105.843 89.825 1.00 0.00 H ATOM 77631 H2 WAT 1988 144.181 106.981 89.086 1.00 0.00 H TER 77633 WAT 1988 ATOM 77633 O WAT 1989 8.038 16.443 108.915 1.00 0.00 O ATOM 77634 H1 WAT 1989 8.925 16.688 109.180 1.00 0.00 H ATOM 77635 H2 WAT 1989 8.163 15.726 108.293 1.00 0.00 H TER 77637 WAT 1989 ATOM 77637 O WAT 1990 124.592 3.942 100.175 1.00 0.00 O ATOM 77638 H1 WAT 1990 125.464 4.257 100.413 1.00 0.00 H ATOM 77639 H2 WAT 1990 124.757 3.176 99.624 1.00 0.00 H TER 77641 WAT 1990 ATOM 77641 O WAT 1991 57.619 64.053 9.972 1.00 0.00 O ATOM 77642 H1 WAT 1991 56.934 64.526 9.501 1.00 0.00 H ATOM 77643 H2 WAT 1991 58.305 64.704 10.116 1.00 0.00 H TER 77645 WAT 1991 ATOM 77645 O WAT 1992 25.280 115.853 140.347 1.00 0.00 O ATOM 77646 H1 WAT 1992 25.866 116.600 140.228 1.00 0.00 H ATOM 77647 H2 WAT 1992 24.749 115.835 139.551 1.00 0.00 H TER 77649 WAT 1992 ATOM 77649 O WAT 1993 34.236 45.710 70.046 1.00 0.00 O ATOM 77650 H1 WAT 1993 33.660 46.305 69.566 1.00 0.00 H ATOM 77651 H2 WAT 1993 34.989 45.588 69.468 1.00 0.00 H TER 77653 WAT 1993 ATOM 77653 O WAT 1994 37.097 32.228 107.394 1.00 0.00 O ATOM 77654 H1 WAT 1994 37.143 31.373 107.822 1.00 0.00 H ATOM 77655 H2 WAT 1994 37.243 32.040 106.467 1.00 0.00 H TER 77657 WAT 1994 ATOM 77657 O WAT 1995 114.322 133.069 77.067 1.00 0.00 O ATOM 77658 H1 WAT 1995 114.332 132.971 78.020 1.00 0.00 H ATOM 77659 H2 WAT 1995 114.795 133.885 76.905 1.00 0.00 H TER 77661 WAT 1995 ATOM 77661 O WAT 1996 37.260 63.837 85.064 1.00 0.00 O ATOM 77662 H1 WAT 1996 37.827 64.594 85.210 1.00 0.00 H ATOM 77663 H2 WAT 1996 37.622 63.155 85.630 1.00 0.00 H TER 77665 WAT 1996 ATOM 77665 O WAT 1997 141.986 119.810 21.554 1.00 0.00 O ATOM 77666 H1 WAT 1997 141.223 119.753 22.129 1.00 0.00 H ATOM 77667 H2 WAT 1997 142.128 118.912 21.254 1.00 0.00 H TER 77669 WAT 1997 ATOM 77669 O WAT 1998 63.860 104.826 126.027 1.00 0.00 O ATOM 77670 H1 WAT 1998 64.565 104.297 126.399 1.00 0.00 H ATOM 77671 H2 WAT 1998 63.863 104.608 125.095 1.00 0.00 H TER 77673 WAT 1998 ATOM 77673 O WAT 1999 108.822 111.278 65.549 1.00 0.00 O ATOM 77674 H1 WAT 1999 109.406 110.535 65.697 1.00 0.00 H ATOM 77675 H2 WAT 1999 108.152 110.941 64.955 1.00 0.00 H TER 77677 WAT 1999 ATOM 77677 O WAT 2000 33.530 16.805 14.984 1.00 0.00 O ATOM 77678 H1 WAT 2000 33.230 17.491 14.387 1.00 0.00 H ATOM 77679 H2 WAT 2000 34.081 17.263 15.618 1.00 0.00 H TER 77681 WAT 2000 ATOM 77681 O WAT 2001 145.364 23.206 81.421 1.00 0.00 O ATOM 77682 H1 WAT 2001 145.990 22.484 81.468 1.00 0.00 H ATOM 77683 H2 WAT 2001 144.507 22.783 81.451 1.00 0.00 H TER 77685 WAT 2001 ATOM 77685 O WAT 2002 103.641 37.335 68.726 1.00 0.00 O ATOM 77686 H1 WAT 2002 103.431 37.498 67.807 1.00 0.00 H ATOM 77687 H2 WAT 2002 104.597 37.289 68.750 1.00 0.00 H TER 77689 WAT 2002 ATOM 77689 O WAT 2003 15.736 5.947 124.581 1.00 0.00 O ATOM 77690 H1 WAT 2003 15.188 6.165 125.335 1.00 0.00 H ATOM 77691 H2 WAT 2003 16.238 5.182 124.862 1.00 0.00 H TER 77693 WAT 2003 ATOM 77693 O WAT 2004 26.728 110.589 18.016 1.00 0.00 O ATOM 77694 H1 WAT 2004 26.584 110.690 17.075 1.00 0.00 H ATOM 77695 H2 WAT 2004 26.959 109.667 18.124 1.00 0.00 H TER 77697 WAT 2004 ATOM 77697 O WAT 2005 109.827 86.429 134.546 1.00 0.00 O ATOM 77698 H1 WAT 2005 110.383 85.834 134.043 1.00 0.00 H ATOM 77699 H2 WAT 2005 110.170 86.380 135.438 1.00 0.00 H TER 77701 WAT 2005 ATOM 77701 O WAT 2006 76.927 105.366 54.909 1.00 0.00 O ATOM 77702 H1 WAT 2006 77.690 105.104 55.424 1.00 0.00 H ATOM 77703 H2 WAT 2006 76.762 104.622 54.330 1.00 0.00 H TER 77705 WAT 2006 ATOM 77705 O WAT 2007 141.830 15.421 22.651 1.00 0.00 O ATOM 77706 H1 WAT 2007 142.468 15.861 22.089 1.00 0.00 H ATOM 77707 H2 WAT 2007 141.148 15.121 22.051 1.00 0.00 H TER 77709 WAT 2007 ATOM 77709 O WAT 2008 145.809 42.354 156.495 1.00 0.00 O ATOM 77710 H1 WAT 2008 145.465 42.097 155.640 1.00 0.00 H ATOM 77711 H2 WAT 2008 145.169 42.015 157.122 1.00 0.00 H TER 77713 WAT 2008 ATOM 77713 O WAT 2009 68.543 18.713 51.114 1.00 0.00 O ATOM 77714 H1 WAT 2009 68.104 18.157 50.470 1.00 0.00 H ATOM 77715 H2 WAT 2009 68.028 19.520 51.125 1.00 0.00 H TER 77717 WAT 2009 ATOM 77717 O WAT 2010 94.037 23.844 138.346 1.00 0.00 O ATOM 77718 H1 WAT 2010 94.243 23.383 139.159 1.00 0.00 H ATOM 77719 H2 WAT 2010 94.119 24.771 138.569 1.00 0.00 H TER 77721 WAT 2010 ATOM 77721 O WAT 2011 124.888 51.224 156.153 1.00 0.00 O ATOM 77722 H1 WAT 2011 124.841 50.284 155.980 1.00 0.00 H ATOM 77723 H2 WAT 2011 125.151 51.287 157.071 1.00 0.00 H TER 77725 WAT 2011 ATOM 77725 O WAT 2012 5.880 44.718 86.856 1.00 0.00 O ATOM 77726 H1 WAT 2012 5.937 44.092 87.578 1.00 0.00 H ATOM 77727 H2 WAT 2012 6.718 45.181 86.874 1.00 0.00 H TER 77729 WAT 2012 ATOM 77729 O WAT 2013 66.113 114.979 93.022 1.00 0.00 O ATOM 77730 H1 WAT 2013 65.177 114.992 93.224 1.00 0.00 H ATOM 77731 H2 WAT 2013 66.278 115.822 92.600 1.00 0.00 H TER 77733 WAT 2013 ATOM 77733 O WAT 2014 131.374 62.589 20.156 1.00 0.00 O ATOM 77734 H1 WAT 2014 131.595 63.120 20.922 1.00 0.00 H ATOM 77735 H2 WAT 2014 130.432 62.711 20.044 1.00 0.00 H TER 77737 WAT 2014 ATOM 77737 O WAT 2015 84.961 63.279 77.320 1.00 0.00 O ATOM 77738 H1 WAT 2015 84.017 63.302 77.166 1.00 0.00 H ATOM 77739 H2 WAT 2015 85.277 64.125 77.003 1.00 0.00 H TER 77741 WAT 2015 ATOM 77741 O WAT 2016 84.747 138.686 146.374 1.00 0.00 O ATOM 77742 H1 WAT 2016 84.798 139.604 146.639 1.00 0.00 H ATOM 77743 H2 WAT 2016 84.069 138.312 146.938 1.00 0.00 H TER 77745 WAT 2016 ATOM 77745 O WAT 2017 92.370 108.779 151.558 1.00 0.00 O ATOM 77746 H1 WAT 2017 91.549 108.294 151.636 1.00 0.00 H ATOM 77747 H2 WAT 2017 93.003 108.131 151.249 1.00 0.00 H TER 77749 WAT 2017 ATOM 77749 O WAT 2018 19.055 52.585 112.965 1.00 0.00 O ATOM 77750 H1 WAT 2018 18.968 53.338 112.380 1.00 0.00 H ATOM 77751 H2 WAT 2018 18.856 51.829 112.413 1.00 0.00 H TER 77753 WAT 2018 ATOM 77753 O WAT 2019 3.051 34.178 67.375 1.00 0.00 O ATOM 77754 H1 WAT 2019 3.957 34.256 67.075 1.00 0.00 H ATOM 77755 H2 WAT 2019 2.870 33.238 67.348 1.00 0.00 H TER 77757 WAT 2019 ATOM 77757 O WAT 2020 67.844 94.734 3.372 1.00 0.00 O ATOM 77758 H1 WAT 2020 68.687 95.188 3.355 1.00 0.00 H ATOM 77759 H2 WAT 2020 67.730 94.474 4.286 1.00 0.00 H TER 77761 WAT 2020 ATOM 77761 O WAT 2021 79.119 1.450 93.242 1.00 0.00 O ATOM 77762 H1 WAT 2021 80.049 1.674 93.248 1.00 0.00 H ATOM 77763 H2 WAT 2021 79.004 0.921 92.453 1.00 0.00 H TER 77765 WAT 2021 ATOM 77765 O WAT 2022 59.515 66.163 144.712 1.00 0.00 O ATOM 77766 H1 WAT 2022 60.133 66.683 145.225 1.00 0.00 H ATOM 77767 H2 WAT 2022 59.165 65.525 145.334 1.00 0.00 H TER 77769 WAT 2022 ATOM 77769 O WAT 2023 19.968 56.077 55.849 1.00 0.00 O ATOM 77770 H1 WAT 2023 19.338 56.275 55.156 1.00 0.00 H ATOM 77771 H2 WAT 2023 20.280 55.196 55.643 1.00 0.00 H TER 77773 WAT 2023 ATOM 77773 O WAT 2024 43.389 141.250 147.389 1.00 0.00 O ATOM 77774 H1 WAT 2024 43.289 142.098 147.821 1.00 0.00 H ATOM 77775 H2 WAT 2024 43.794 140.690 148.051 1.00 0.00 H TER 77777 WAT 2024 ATOM 77777 O WAT 2025 43.523 73.735 100.518 1.00 0.00 O ATOM 77778 H1 WAT 2025 42.916 74.082 101.172 1.00 0.00 H ATOM 77779 H2 WAT 2025 44.346 74.193 100.689 1.00 0.00 H TER 77781 WAT 2025 ATOM 77781 O WAT 2026 73.709 17.868 78.261 1.00 0.00 O ATOM 77782 H1 WAT 2026 72.974 17.394 77.873 1.00 0.00 H ATOM 77783 H2 WAT 2026 73.347 18.722 78.494 1.00 0.00 H TER 77785 WAT 2026 ATOM 77785 O WAT 2027 75.677 94.397 135.912 1.00 0.00 O ATOM 77786 H1 WAT 2027 75.060 93.881 135.393 1.00 0.00 H ATOM 77787 H2 WAT 2027 76.414 94.553 135.321 1.00 0.00 H TER 77789 WAT 2027 ATOM 77789 O WAT 2028 66.973 91.106 76.744 1.00 0.00 O ATOM 77790 H1 WAT 2028 66.223 90.728 76.285 1.00 0.00 H ATOM 77791 H2 WAT 2028 67.270 90.410 77.330 1.00 0.00 H TER 77793 WAT 2028 ATOM 77793 O WAT 2029 143.615 32.875 11.734 1.00 0.00 O ATOM 77794 H1 WAT 2029 143.187 33.505 11.155 1.00 0.00 H ATOM 77795 H2 WAT 2029 143.459 32.025 11.321 1.00 0.00 H TER 77797 WAT 2029 ATOM 77797 O WAT 2030 28.826 88.506 145.432 1.00 0.00 O ATOM 77798 H1 WAT 2030 29.005 88.242 144.530 1.00 0.00 H ATOM 77799 H2 WAT 2030 29.459 89.202 145.608 1.00 0.00 H TER 77801 WAT 2030 ATOM 77801 O WAT 2031 8.184 66.278 149.065 1.00 0.00 O ATOM 77802 H1 WAT 2031 8.282 66.903 149.784 1.00 0.00 H ATOM 77803 H2 WAT 2031 9.030 65.835 149.015 1.00 0.00 H TER 77805 WAT 2031 ATOM 77805 O WAT 2032 91.639 75.776 62.891 1.00 0.00 O ATOM 77806 H1 WAT 2032 91.919 76.522 63.420 1.00 0.00 H ATOM 77807 H2 WAT 2032 91.522 76.136 62.012 1.00 0.00 H TER 77809 WAT 2032 ATOM 77809 O WAT 2033 36.887 107.234 52.549 1.00 0.00 O ATOM 77810 H1 WAT 2033 36.649 107.853 53.239 1.00 0.00 H ATOM 77811 H2 WAT 2033 37.101 106.426 53.015 1.00 0.00 H TER 77813 WAT 2033 ATOM 77813 O WAT 2034 32.928 127.542 94.539 1.00 0.00 O ATOM 77814 H1 WAT 2034 32.544 127.161 95.329 1.00 0.00 H ATOM 77815 H2 WAT 2034 32.955 126.818 93.913 1.00 0.00 H TER 77817 WAT 2034 ATOM 77817 O WAT 2035 79.849 59.732 102.484 1.00 0.00 O ATOM 77818 H1 WAT 2035 80.611 60.204 102.148 1.00 0.00 H ATOM 77819 H2 WAT 2035 79.098 60.215 102.140 1.00 0.00 H TER 77821 WAT 2035 ATOM 77821 O WAT 2036 6.492 101.484 74.296 1.00 0.00 O ATOM 77822 H1 WAT 2036 7.400 101.202 74.405 1.00 0.00 H ATOM 77823 H2 WAT 2036 5.991 100.670 74.249 1.00 0.00 H TER 77825 WAT 2036 ATOM 77825 O WAT 2037 71.270 128.397 117.205 1.00 0.00 O ATOM 77826 H1 WAT 2037 71.570 128.546 116.308 1.00 0.00 H ATOM 77827 H2 WAT 2037 70.525 128.989 117.310 1.00 0.00 H TER 77829 WAT 2037 ATOM 77829 O WAT 2038 92.256 2.496 18.527 1.00 0.00 O ATOM 77830 H1 WAT 2038 91.307 2.533 18.409 1.00 0.00 H ATOM 77831 H2 WAT 2038 92.481 3.337 18.925 1.00 0.00 H TER 77833 WAT 2038 ATOM 77833 O WAT 2039 42.304 68.726 124.329 1.00 0.00 O ATOM 77834 H1 WAT 2039 42.505 68.290 123.500 1.00 0.00 H ATOM 77835 H2 WAT 2039 41.363 68.898 124.287 1.00 0.00 H TER 77837 WAT 2039 ATOM 77837 O WAT 2040 7.855 51.230 115.040 1.00 0.00 O ATOM 77838 H1 WAT 2040 8.595 50.646 115.206 1.00 0.00 H ATOM 77839 H2 WAT 2040 8.160 52.091 115.328 1.00 0.00 H TER 77841 WAT 2040 ATOM 77841 O WAT 2041 98.351 114.728 134.488 1.00 0.00 O ATOM 77842 H1 WAT 2041 98.554 115.563 134.065 1.00 0.00 H ATOM 77843 H2 WAT 2041 99.150 114.211 134.391 1.00 0.00 H TER 77845 WAT 2041 ATOM 77845 O WAT 2042 33.197 76.365 83.144 1.00 0.00 O ATOM 77846 H1 WAT 2042 33.275 76.799 83.993 1.00 0.00 H ATOM 77847 H2 WAT 2042 32.364 76.679 82.791 1.00 0.00 H TER 77849 WAT 2042 ATOM 77849 O WAT 2043 54.725 84.471 26.015 1.00 0.00 O ATOM 77850 H1 WAT 2043 54.118 83.732 25.985 1.00 0.00 H ATOM 77851 H2 WAT 2043 54.866 84.703 25.097 1.00 0.00 H TER 77853 WAT 2043 ATOM 77853 O WAT 2044 104.313 139.666 87.621 1.00 0.00 O ATOM 77854 H1 WAT 2044 103.848 140.115 88.327 1.00 0.00 H ATOM 77855 H2 WAT 2044 104.547 140.362 87.008 1.00 0.00 H TER 77857 WAT 2044 ATOM 77857 O WAT 2045 20.663 91.370 74.782 1.00 0.00 O ATOM 77858 H1 WAT 2045 21.448 91.283 75.322 1.00 0.00 H ATOM 77859 H2 WAT 2045 19.944 91.428 75.412 1.00 0.00 H TER 77861 WAT 2045 ATOM 77861 O WAT 2046 31.290 11.737 16.431 1.00 0.00 O ATOM 77862 H1 WAT 2046 30.903 12.085 15.627 1.00 0.00 H ATOM 77863 H2 WAT 2046 31.395 12.502 16.996 1.00 0.00 H TER 77865 WAT 2046 ATOM 77865 O WAT 2047 106.329 53.758 138.230 1.00 0.00 O ATOM 77866 H1 WAT 2047 107.014 54.232 138.701 1.00 0.00 H ATOM 77867 H2 WAT 2047 105.887 54.430 137.710 1.00 0.00 H TER 77869 WAT 2047 ATOM 77869 O WAT 2048 134.061 83.106 129.152 1.00 0.00 O ATOM 77870 H1 WAT 2048 133.819 82.575 128.393 1.00 0.00 H ATOM 77871 H2 WAT 2048 133.400 82.897 129.811 1.00 0.00 H TER 77873 WAT 2048 ATOM 77873 O WAT 2049 89.645 107.342 146.549 1.00 0.00 O ATOM 77874 H1 WAT 2049 89.662 108.292 146.666 1.00 0.00 H ATOM 77875 H2 WAT 2049 90.501 107.131 146.177 1.00 0.00 H TER 77877 WAT 2049 ATOM 77877 O WAT 2050 52.809 74.854 103.420 1.00 0.00 O ATOM 77878 H1 WAT 2050 53.531 74.237 103.538 1.00 0.00 H ATOM 77879 H2 WAT 2050 52.211 74.412 102.817 1.00 0.00 H TER 77881 WAT 2050 ATOM 77881 O WAT 2051 105.473 136.017 147.578 1.00 0.00 O ATOM 77882 H1 WAT 2051 106.346 136.102 147.194 1.00 0.00 H ATOM 77883 H2 WAT 2051 105.320 135.073 147.618 1.00 0.00 H TER 77885 WAT 2051 ATOM 77885 O WAT 2052 18.201 47.930 113.051 1.00 0.00 O ATOM 77886 H1 WAT 2052 17.519 48.175 113.677 1.00 0.00 H ATOM 77887 H2 WAT 2052 17.747 47.393 112.401 1.00 0.00 H TER 77889 WAT 2052 ATOM 77889 O WAT 2053 10.677 134.013 75.075 1.00 0.00 O ATOM 77890 H1 WAT 2053 10.568 133.841 76.010 1.00 0.00 H ATOM 77891 H2 WAT 2053 11.191 134.819 75.037 1.00 0.00 H TER 77893 WAT 2053 ATOM 77893 O WAT 2054 44.551 40.247 67.505 1.00 0.00 O ATOM 77894 H1 WAT 2054 45.273 40.089 66.897 1.00 0.00 H ATOM 77895 H2 WAT 2054 44.456 41.199 67.522 1.00 0.00 H TER 77897 WAT 2054 ATOM 77897 O WAT 2055 29.699 20.041 1.342 1.00 0.00 O ATOM 77898 H1 WAT 2055 29.341 20.053 0.454 1.00 0.00 H ATOM 77899 H2 WAT 2055 28.933 20.125 1.910 1.00 0.00 H TER 77901 WAT 2055 ATOM 77901 O WAT 2056 27.595 113.575 11.357 1.00 0.00 O ATOM 77902 H1 WAT 2056 27.912 114.010 10.566 1.00 0.00 H ATOM 77903 H2 WAT 2056 27.653 112.641 11.157 1.00 0.00 H TER 77905 WAT 2056 ATOM 77905 O WAT 2057 78.481 47.657 145.959 1.00 0.00 O ATOM 77906 H1 WAT 2057 78.192 47.455 146.849 1.00 0.00 H ATOM 77907 H2 WAT 2057 77.876 48.335 145.659 1.00 0.00 H TER 77909 WAT 2057 ATOM 77909 O WAT 2058 97.399 99.509 98.648 1.00 0.00 O ATOM 77910 H1 WAT 2058 97.314 98.588 98.895 1.00 0.00 H ATOM 77911 H2 WAT 2058 96.586 99.914 98.950 1.00 0.00 H TER 77913 WAT 2058 ATOM 77913 O WAT 2059 19.230 62.188 157.848 1.00 0.00 O ATOM 77914 H1 WAT 2059 18.327 61.966 157.618 1.00 0.00 H ATOM 77915 H2 WAT 2059 19.222 62.265 158.802 1.00 0.00 H TER 77917 WAT 2059 ATOM 77917 O WAT 2060 14.974 2.018 146.043 1.00 0.00 O ATOM 77918 H1 WAT 2060 15.273 2.757 146.573 1.00 0.00 H ATOM 77919 H2 WAT 2060 14.522 2.421 145.302 1.00 0.00 H TER 77921 WAT 2060 ATOM 77921 O WAT 2061 80.747 75.995 100.077 1.00 0.00 O ATOM 77922 H1 WAT 2061 80.109 76.699 99.965 1.00 0.00 H ATOM 77923 H2 WAT 2061 81.543 76.437 100.371 1.00 0.00 H TER 77925 WAT 2061 ATOM 77925 O WAT 2062 74.694 78.011 134.202 1.00 0.00 O ATOM 77926 H1 WAT 2062 75.149 78.500 134.888 1.00 0.00 H ATOM 77927 H2 WAT 2062 74.098 77.431 134.676 1.00 0.00 H TER 77929 WAT 2062 ATOM 77929 O WAT 2063 92.022 58.255 13.221 1.00 0.00 O ATOM 77930 H1 WAT 2063 92.000 59.192 13.416 1.00 0.00 H ATOM 77931 H2 WAT 2063 91.140 57.946 13.424 1.00 0.00 H TER 77933 WAT 2063 ATOM 77933 O WAT 2064 46.387 30.577 142.099 1.00 0.00 O ATOM 77934 H1 WAT 2064 46.713 29.859 141.555 1.00 0.00 H ATOM 77935 H2 WAT 2064 45.561 30.832 141.688 1.00 0.00 H TER 77937 WAT 2064 ATOM 77937 O WAT 2065 133.670 88.496 93.253 1.00 0.00 O ATOM 77938 H1 WAT 2065 132.825 88.163 92.950 1.00 0.00 H ATOM 77939 H2 WAT 2065 133.887 89.195 92.637 1.00 0.00 H TER 77941 WAT 2065 ATOM 77941 O WAT 2066 140.625 118.473 66.644 1.00 0.00 O ATOM 77942 H1 WAT 2066 139.836 118.289 67.155 1.00 0.00 H ATOM 77943 H2 WAT 2066 140.397 119.243 66.122 1.00 0.00 H TER 77945 WAT 2066 ATOM 77945 O WAT 2067 34.039 71.075 142.652 1.00 0.00 O ATOM 77946 H1 WAT 2067 34.219 71.870 142.150 1.00 0.00 H ATOM 77947 H2 WAT 2067 34.650 71.113 143.388 1.00 0.00 H TER 77949 WAT 2067 ATOM 77949 O WAT 2068 16.389 82.655 6.369 1.00 0.00 O ATOM 77950 H1 WAT 2068 17.056 82.314 5.772 1.00 0.00 H ATOM 77951 H2 WAT 2068 16.888 83.050 7.085 1.00 0.00 H TER 77953 WAT 2068 ATOM 77953 O WAT 2069 110.776 125.096 131.335 1.00 0.00 O ATOM 77954 H1 WAT 2069 109.939 124.867 131.739 1.00 0.00 H ATOM 77955 H2 WAT 2069 110.668 124.865 130.413 1.00 0.00 H TER 77957 WAT 2069 ATOM 77957 O WAT 2070 8.336 114.071 110.699 1.00 0.00 O ATOM 77958 H1 WAT 2070 7.714 113.360 110.853 1.00 0.00 H ATOM 77959 H2 WAT 2070 8.269 114.249 109.760 1.00 0.00 H TER 77961 WAT 2070 ATOM 77961 O WAT 2071 55.477 109.215 5.633 1.00 0.00 O ATOM 77962 H1 WAT 2071 54.829 109.011 6.307 1.00 0.00 H ATOM 77963 H2 WAT 2071 56.102 108.491 5.675 1.00 0.00 H TER 77965 WAT 2071 ATOM 77965 O WAT 2072 98.380 56.847 67.676 1.00 0.00 O ATOM 77966 H1 WAT 2072 98.985 57.471 67.277 1.00 0.00 H ATOM 77967 H2 WAT 2072 97.673 56.757 67.037 1.00 0.00 H TER 77969 WAT 2072 ATOM 77969 O WAT 2073 81.880 131.087 130.345 1.00 0.00 O ATOM 77970 H1 WAT 2073 80.927 131.140 130.423 1.00 0.00 H ATOM 77971 H2 WAT 2073 82.177 130.828 131.217 1.00 0.00 H TER 77973 WAT 2073 ATOM 77973 O WAT 2074 70.345 2.841 151.066 1.00 0.00 O ATOM 77974 H1 WAT 2074 69.951 3.713 151.079 1.00 0.00 H ATOM 77975 H2 WAT 2074 70.075 2.468 150.227 1.00 0.00 H TER 77977 WAT 2074 ATOM 77977 O WAT 2075 0.773 72.167 115.773 1.00 0.00 O ATOM 77978 H1 WAT 2075 1.590 72.319 116.247 1.00 0.00 H ATOM 77979 H2 WAT 2075 0.297 72.994 115.847 1.00 0.00 H TER 77981 WAT 2075 ATOM 77981 O WAT 2076 111.742 121.359 155.241 1.00 0.00 O ATOM 77982 H1 WAT 2076 110.890 120.933 155.150 1.00 0.00 H ATOM 77983 H2 WAT 2076 111.685 121.834 156.070 1.00 0.00 H TER 77985 WAT 2076 ATOM 77985 O WAT 2077 138.604 98.446 151.022 1.00 0.00 O ATOM 77986 H1 WAT 2077 139.077 97.940 150.361 1.00 0.00 H ATOM 77987 H2 WAT 2077 137.938 98.923 150.528 1.00 0.00 H TER 77989 WAT 2077 ATOM 77989 O WAT 2078 8.668 118.679 143.624 1.00 0.00 O ATOM 77990 H1 WAT 2078 9.256 119.081 142.985 1.00 0.00 H ATOM 77991 H2 WAT 2078 8.212 119.417 144.027 1.00 0.00 H TER 77993 WAT 2078 ATOM 77993 O WAT 2079 45.336 106.471 130.387 1.00 0.00 O ATOM 77994 H1 WAT 2079 44.967 105.823 129.787 1.00 0.00 H ATOM 77995 H2 WAT 2079 45.027 107.312 130.050 1.00 0.00 H TER 77997 WAT 2079 ATOM 77997 O WAT 2080 3.338 21.948 108.156 1.00 0.00 O ATOM 77998 H1 WAT 2080 2.414 21.720 108.058 1.00 0.00 H ATOM 77999 H2 WAT 2080 3.343 22.661 108.795 1.00 0.00 H TER 78001 WAT 2080 ATOM 78001 O WAT 2081 61.783 112.038 99.257 1.00 0.00 O ATOM 78002 H1 WAT 2081 61.176 111.416 98.856 1.00 0.00 H ATOM 78003 H2 WAT 2081 62.568 111.521 99.441 1.00 0.00 H TER 78005 WAT 2081 ATOM 78005 O WAT 2082 125.279 145.302 94.617 1.00 0.00 O ATOM 78006 H1 WAT 2082 124.709 145.404 93.855 1.00 0.00 H ATOM 78007 H2 WAT 2082 125.316 144.357 94.764 1.00 0.00 H TER 78009 WAT 2082 ATOM 78009 O WAT 2083 90.540 97.728 81.115 1.00 0.00 O ATOM 78010 H1 WAT 2083 91.057 97.154 81.680 1.00 0.00 H ATOM 78011 H2 WAT 2083 90.878 98.606 81.292 1.00 0.00 H TER 78013 WAT 2083 ATOM 78013 O WAT 2084 85.711 60.863 107.739 1.00 0.00 O ATOM 78014 H1 WAT 2084 85.087 61.485 108.113 1.00 0.00 H ATOM 78015 H2 WAT 2084 85.397 60.714 106.847 1.00 0.00 H TER 78017 WAT 2084 ATOM 78017 O WAT 2085 136.755 97.050 117.784 1.00 0.00 O ATOM 78018 H1 WAT 2085 137.154 96.196 117.954 1.00 0.00 H ATOM 78019 H2 WAT 2085 135.819 96.909 117.926 1.00 0.00 H TER 78021 WAT 2085 ATOM 78021 O WAT 2086 8.180 19.890 136.572 1.00 0.00 O ATOM 78022 H1 WAT 2086 9.060 19.567 136.381 1.00 0.00 H ATOM 78023 H2 WAT 2086 8.237 20.836 136.441 1.00 0.00 H TER 78025 WAT 2086 ATOM 78025 O WAT 2087 133.265 61.338 89.644 1.00 0.00 O ATOM 78026 H1 WAT 2087 132.613 61.912 90.046 1.00 0.00 H ATOM 78027 H2 WAT 2087 134.001 61.916 89.441 1.00 0.00 H TER 78029 WAT 2087 ATOM 78029 O WAT 2088 12.321 140.152 89.019 1.00 0.00 O ATOM 78030 H1 WAT 2088 11.801 139.399 88.736 1.00 0.00 H ATOM 78031 H2 WAT 2088 12.359 140.720 88.249 1.00 0.00 H TER 78033 WAT 2088 ATOM 78033 O WAT 2089 140.916 115.402 106.179 1.00 0.00 O ATOM 78034 H1 WAT 2089 141.407 115.411 105.357 1.00 0.00 H ATOM 78035 H2 WAT 2089 140.134 114.885 105.985 1.00 0.00 H TER 78037 WAT 2089 ATOM 78037 O WAT 2090 68.896 106.452 9.458 1.00 0.00 O ATOM 78038 H1 WAT 2090 69.468 106.781 10.151 1.00 0.00 H ATOM 78039 H2 WAT 2090 68.630 107.234 8.974 1.00 0.00 H TER 78041 WAT 2090 ATOM 78041 O WAT 2091 9.991 122.773 92.669 1.00 0.00 O ATOM 78042 H1 WAT 2091 10.224 123.067 93.550 1.00 0.00 H ATOM 78043 H2 WAT 2091 9.335 122.090 92.811 1.00 0.00 H TER 78045 WAT 2091 ATOM 78045 O WAT 2092 72.268 29.844 141.341 1.00 0.00 O ATOM 78046 H1 WAT 2092 72.059 30.284 140.517 1.00 0.00 H ATOM 78047 H2 WAT 2092 73.151 30.145 141.556 1.00 0.00 H TER 78049 WAT 2092 ATOM 78049 O WAT 2093 4.207 83.686 129.414 1.00 0.00 O ATOM 78050 H1 WAT 2093 5.080 83.294 129.382 1.00 0.00 H ATOM 78051 H2 WAT 2093 4.078 83.907 130.336 1.00 0.00 H TER 78053 WAT 2093 ATOM 78053 O WAT 2094 142.869 84.659 81.695 1.00 0.00 O ATOM 78054 H1 WAT 2094 142.755 85.575 81.947 1.00 0.00 H ATOM 78055 H2 WAT 2094 142.770 84.171 82.513 1.00 0.00 H TER 78057 WAT 2094 ATOM 78057 O WAT 2095 130.074 97.076 156.150 1.00 0.00 O ATOM 78058 H1 WAT 2095 129.482 96.928 155.413 1.00 0.00 H ATOM 78059 H2 WAT 2095 130.949 96.935 155.787 1.00 0.00 H TER 78061 WAT 2095 ATOM 78061 O WAT 2096 56.277 18.140 143.313 1.00 0.00 O ATOM 78062 H1 WAT 2096 56.505 18.350 142.407 1.00 0.00 H ATOM 78063 H2 WAT 2096 57.009 17.610 143.627 1.00 0.00 H TER 78065 WAT 2096 ATOM 78065 O WAT 2097 51.274 141.362 75.127 1.00 0.00 O ATOM 78066 H1 WAT 2097 51.278 142.249 75.486 1.00 0.00 H ATOM 78067 H2 WAT 2097 52.130 141.269 74.708 1.00 0.00 H TER 78069 WAT 2097 ATOM 78069 O WAT 2098 30.806 63.547 139.482 1.00 0.00 O ATOM 78070 H1 WAT 2098 29.969 63.948 139.717 1.00 0.00 H ATOM 78071 H2 WAT 2098 31.464 64.107 139.893 1.00 0.00 H TER 78073 WAT 2098 ATOM 78073 O WAT 2099 106.210 78.900 126.757 1.00 0.00 O ATOM 78074 H1 WAT 2099 106.788 79.361 127.365 1.00 0.00 H ATOM 78075 H2 WAT 2099 106.786 78.619 126.046 1.00 0.00 H TER 78077 WAT 2099 ATOM 78077 O WAT 2100 45.260 78.059 88.497 1.00 0.00 O ATOM 78078 H1 WAT 2100 45.788 78.835 88.307 1.00 0.00 H ATOM 78079 H2 WAT 2100 45.270 77.557 87.682 1.00 0.00 H TER 78081 WAT 2100 ATOM 78081 O WAT 2101 5.132 105.647 158.346 1.00 0.00 O ATOM 78082 H1 WAT 2101 5.541 105.069 157.702 1.00 0.00 H ATOM 78083 H2 WAT 2101 5.551 105.416 159.175 1.00 0.00 H TER 78085 WAT 2101 ATOM 78085 O WAT 2102 2.902 29.324 139.986 1.00 0.00 O ATOM 78086 H1 WAT 2102 3.437 28.532 140.021 1.00 0.00 H ATOM 78087 H2 WAT 2102 3.026 29.659 139.098 1.00 0.00 H TER 78089 WAT 2102 ATOM 78089 O WAT 2103 104.058 24.831 153.291 1.00 0.00 O ATOM 78090 H1 WAT 2103 104.996 24.647 153.333 1.00 0.00 H ATOM 78091 H2 WAT 2103 103.960 25.676 153.729 1.00 0.00 H TER 78093 WAT 2103 ATOM 78093 O WAT 2104 6.581 31.520 77.829 1.00 0.00 O ATOM 78094 H1 WAT 2104 7.155 32.217 77.511 1.00 0.00 H ATOM 78095 H2 WAT 2104 6.832 31.403 78.745 1.00 0.00 H TER 78097 WAT 2104 ATOM 78097 O WAT 2105 8.488 29.699 23.167 1.00 0.00 O ATOM 78098 H1 WAT 2105 7.633 29.364 23.437 1.00 0.00 H ATOM 78099 H2 WAT 2105 8.992 29.748 23.979 1.00 0.00 H TER 78101 WAT 2105 ATOM 78101 O WAT 2106 0.462 98.814 90.418 1.00 0.00 O ATOM 78102 H1 WAT 2106 0.697 99.298 91.210 1.00 0.00 H ATOM 78103 H2 WAT 2106 -0.108 99.410 89.933 1.00 0.00 H TER 78105 WAT 2106 ATOM 78105 O WAT 2107 85.421 41.277 97.619 1.00 0.00 O ATOM 78106 H1 WAT 2107 85.056 42.148 97.771 1.00 0.00 H ATOM 78107 H2 WAT 2107 85.942 41.371 96.822 1.00 0.00 H TER 78109 WAT 2107 ATOM 78109 O WAT 2108 143.247 67.649 9.408 1.00 0.00 O ATOM 78110 H1 WAT 2108 143.128 66.700 9.446 1.00 0.00 H ATOM 78111 H2 WAT 2108 142.750 67.922 8.637 1.00 0.00 H TER 78113 WAT 2108 ATOM 78113 O WAT 2109 38.932 15.837 69.815 1.00 0.00 O ATOM 78114 H1 WAT 2109 38.043 15.628 70.102 1.00 0.00 H ATOM 78115 H2 WAT 2109 39.259 15.022 69.435 1.00 0.00 H TER 78117 WAT 2109 ATOM 78117 O WAT 2110 110.412 117.792 89.019 1.00 0.00 O ATOM 78118 H1 WAT 2110 110.011 118.500 88.516 1.00 0.00 H ATOM 78119 H2 WAT 2110 110.872 118.236 89.732 1.00 0.00 H TER 78121 WAT 2110 ATOM 78121 O WAT 2111 56.198 55.067 141.595 1.00 0.00 O ATOM 78122 H1 WAT 2111 56.814 54.686 140.970 1.00 0.00 H ATOM 78123 H2 WAT 2111 56.365 54.598 142.413 1.00 0.00 H TER 78125 WAT 2111 ATOM 78125 O WAT 2112 70.276 104.827 76.425 1.00 0.00 O ATOM 78126 H1 WAT 2112 70.702 105.518 76.932 1.00 0.00 H ATOM 78127 H2 WAT 2112 70.937 104.138 76.357 1.00 0.00 H TER 78129 WAT 2112 ATOM 78129 O WAT 2113 91.403 48.817 58.303 1.00 0.00 O ATOM 78130 H1 WAT 2113 91.401 48.513 57.395 1.00 0.00 H ATOM 78131 H2 WAT 2113 91.227 49.756 58.241 1.00 0.00 H TER 78133 WAT 2113 ATOM 78133 O WAT 2114 53.863 69.425 136.476 1.00 0.00 O ATOM 78134 H1 WAT 2114 53.093 69.960 136.284 1.00 0.00 H ATOM 78135 H2 WAT 2114 54.544 70.059 136.703 1.00 0.00 H TER 78137 WAT 2114 ATOM 78137 O WAT 2115 27.591 65.180 75.666 1.00 0.00 O ATOM 78138 H1 WAT 2115 28.523 65.149 75.451 1.00 0.00 H ATOM 78139 H2 WAT 2115 27.237 65.862 75.096 1.00 0.00 H TER 78141 WAT 2115 ATOM 78141 O WAT 2116 67.615 62.131 69.264 1.00 0.00 O ATOM 78142 H1 WAT 2116 67.708 63.081 69.345 1.00 0.00 H ATOM 78143 H2 WAT 2116 66.734 61.948 69.588 1.00 0.00 H TER 78145 WAT 2116 ATOM 78145 O WAT 2117 100.800 51.504 154.423 1.00 0.00 O ATOM 78146 H1 WAT 2117 100.886 52.450 154.305 1.00 0.00 H ATOM 78147 H2 WAT 2117 101.306 51.315 155.213 1.00 0.00 H TER 78149 WAT 2117 ATOM 78149 O WAT 2118 141.040 45.694 82.721 1.00 0.00 O ATOM 78150 H1 WAT 2118 140.863 44.888 82.237 1.00 0.00 H ATOM 78151 H2 WAT 2118 141.134 46.365 82.044 1.00 0.00 H TER 78153 WAT 2118 ATOM 78153 O WAT 2119 20.319 25.221 80.268 1.00 0.00 O ATOM 78154 H1 WAT 2119 20.804 24.912 79.503 1.00 0.00 H ATOM 78155 H2 WAT 2119 20.597 24.643 80.978 1.00 0.00 H TER 78157 WAT 2119 ATOM 78157 O WAT 2120 71.493 77.498 137.732 1.00 0.00 O ATOM 78158 H1 WAT 2120 71.443 78.312 138.234 1.00 0.00 H ATOM 78159 H2 WAT 2120 71.604 76.815 138.394 1.00 0.00 H TER 78161 WAT 2120 ATOM 78161 O WAT 2121 85.205 37.188 2.882 1.00 0.00 O ATOM 78162 H1 WAT 2121 85.687 36.399 2.633 1.00 0.00 H ATOM 78163 H2 WAT 2121 85.725 37.909 2.527 1.00 0.00 H TER 78165 WAT 2121 ATOM 78165 O WAT 2122 84.429 142.108 154.561 1.00 0.00 O ATOM 78166 H1 WAT 2122 84.534 141.159 154.494 1.00 0.00 H ATOM 78167 H2 WAT 2122 84.500 142.421 153.659 1.00 0.00 H TER 78169 WAT 2122 ATOM 78169 O WAT 2123 37.977 103.340 85.462 1.00 0.00 O ATOM 78170 H1 WAT 2123 38.494 103.871 84.857 1.00 0.00 H ATOM 78171 H2 WAT 2123 38.131 102.438 85.181 1.00 0.00 H TER 78173 WAT 2123 ATOM 78173 O WAT 2124 20.333 111.328 106.332 1.00 0.00 O ATOM 78174 H1 WAT 2124 20.490 111.036 107.230 1.00 0.00 H ATOM 78175 H2 WAT 2124 19.420 111.095 106.161 1.00 0.00 H TER 78177 WAT 2124 ATOM 78177 O WAT 2125 95.660 18.342 150.472 1.00 0.00 O ATOM 78178 H1 WAT 2125 95.890 17.704 149.798 1.00 0.00 H ATOM 78179 H2 WAT 2125 96.480 18.507 150.937 1.00 0.00 H TER 78181 WAT 2125 ATOM 78181 O WAT 2126 4.378 25.939 69.751 1.00 0.00 O ATOM 78182 H1 WAT 2126 4.453 25.930 68.797 1.00 0.00 H ATOM 78183 H2 WAT 2126 5.056 26.550 70.039 1.00 0.00 H TER 78185 WAT 2126 ATOM 78185 O WAT 2127 45.954 33.225 57.417 1.00 0.00 O ATOM 78186 H1 WAT 2127 46.129 32.284 57.426 1.00 0.00 H ATOM 78187 H2 WAT 2127 45.148 33.314 56.907 1.00 0.00 H TER 78189 WAT 2127 ATOM 78189 O WAT 2128 94.453 123.384 155.450 1.00 0.00 O ATOM 78190 H1 WAT 2128 95.253 123.714 155.860 1.00 0.00 H ATOM 78191 H2 WAT 2128 93.769 123.540 156.101 1.00 0.00 H TER 78193 WAT 2128 ATOM 78193 O WAT 2129 107.150 90.617 119.433 1.00 0.00 O ATOM 78194 H1 WAT 2129 107.417 91.436 119.015 1.00 0.00 H ATOM 78195 H2 WAT 2129 106.657 90.891 120.206 1.00 0.00 H TER 78197 WAT 2129 ATOM 78197 O WAT 2130 33.954 127.432 85.891 1.00 0.00 O ATOM 78198 H1 WAT 2130 33.622 126.806 85.248 1.00 0.00 H ATOM 78199 H2 WAT 2130 34.059 126.920 86.693 1.00 0.00 H TER 78201 WAT 2130 ATOM 78201 O WAT 2131 24.935 53.658 106.330 1.00 0.00 O ATOM 78202 H1 WAT 2131 24.971 53.449 107.263 1.00 0.00 H ATOM 78203 H2 WAT 2131 25.844 53.832 106.088 1.00 0.00 H TER 78205 WAT 2131 ATOM 78205 O WAT 2132 37.122 42.946 150.339 1.00 0.00 O ATOM 78206 H1 WAT 2132 37.454 42.513 151.126 1.00 0.00 H ATOM 78207 H2 WAT 2132 37.062 42.246 149.689 1.00 0.00 H TER 78209 WAT 2132 ATOM 78209 O WAT 2133 64.463 57.499 116.560 1.00 0.00 O ATOM 78210 H1 WAT 2133 64.428 56.674 116.075 1.00 0.00 H ATOM 78211 H2 WAT 2133 65.335 57.508 116.954 1.00 0.00 H TER 78213 WAT 2133 ATOM 78213 O WAT 2134 135.951 76.953 152.636 1.00 0.00 O ATOM 78214 H1 WAT 2134 136.430 76.605 153.389 1.00 0.00 H ATOM 78215 H2 WAT 2134 136.202 77.876 152.598 1.00 0.00 H TER 78217 WAT 2134 ATOM 78217 O WAT 2135 74.404 26.084 59.837 1.00 0.00 O ATOM 78218 H1 WAT 2135 74.700 25.547 60.572 1.00 0.00 H ATOM 78219 H2 WAT 2135 73.646 26.560 60.179 1.00 0.00 H TER 78221 WAT 2135 ATOM 78221 O WAT 2136 117.068 19.087 97.211 1.00 0.00 O ATOM 78222 H1 WAT 2136 117.590 19.687 97.744 1.00 0.00 H ATOM 78223 H2 WAT 2136 116.363 18.802 97.793 1.00 0.00 H TER 78225 WAT 2136 ATOM 78225 O WAT 2137 99.493 52.359 23.726 1.00 0.00 O ATOM 78226 H1 WAT 2137 98.580 52.075 23.668 1.00 0.00 H ATOM 78227 H2 WAT 2137 99.539 53.131 23.162 1.00 0.00 H TER 78229 WAT 2137 ATOM 78229 O WAT 2138 139.993 46.400 10.449 1.00 0.00 O ATOM 78230 H1 WAT 2138 140.061 45.784 9.719 1.00 0.00 H ATOM 78231 H2 WAT 2138 140.063 45.852 11.231 1.00 0.00 H TER 78233 WAT 2138 ATOM 78233 O WAT 2139 108.832 16.683 156.226 1.00 0.00 O ATOM 78234 H1 WAT 2139 108.469 17.563 156.318 1.00 0.00 H ATOM 78235 H2 WAT 2139 109.733 16.761 156.541 1.00 0.00 H TER 78237 WAT 2139 ATOM 78237 O WAT 2140 89.422 49.121 3.519 1.00 0.00 O ATOM 78238 H1 WAT 2140 89.685 48.830 2.646 1.00 0.00 H ATOM 78239 H2 WAT 2140 90.246 49.319 3.964 1.00 0.00 H TER 78241 WAT 2140 ATOM 78241 O WAT 2141 107.366 96.543 120.788 1.00 0.00 O ATOM 78242 H1 WAT 2141 108.014 97.242 120.874 1.00 0.00 H ATOM 78243 H2 WAT 2141 107.104 96.570 119.868 1.00 0.00 H TER 78245 WAT 2141 ATOM 78245 O WAT 2142 76.078 104.665 64.063 1.00 0.00 O ATOM 78246 H1 WAT 2142 75.584 105.396 64.434 1.00 0.00 H ATOM 78247 H2 WAT 2142 76.900 104.657 64.554 1.00 0.00 H TER 78249 WAT 2142 ATOM 78249 O WAT 2143 26.224 7.297 88.404 1.00 0.00 O ATOM 78250 H1 WAT 2143 26.261 7.769 89.236 1.00 0.00 H ATOM 78251 H2 WAT 2143 25.929 7.951 87.770 1.00 0.00 H TER 78253 WAT 2143 ATOM 78253 O WAT 2144 56.532 135.195 152.393 1.00 0.00 O ATOM 78254 H1 WAT 2144 57.143 134.613 152.844 1.00 0.00 H ATOM 78255 H2 WAT 2144 55.954 134.607 151.907 1.00 0.00 H TER 78257 WAT 2144 ATOM 78257 O WAT 2145 111.717 90.597 97.298 1.00 0.00 O ATOM 78258 H1 WAT 2145 111.184 89.805 97.370 1.00 0.00 H ATOM 78259 H2 WAT 2145 111.404 91.024 96.500 1.00 0.00 H TER 78261 WAT 2145 ATOM 78261 O WAT 2146 134.547 10.189 92.716 1.00 0.00 O ATOM 78262 H1 WAT 2146 134.434 10.630 91.874 1.00 0.00 H ATOM 78263 H2 WAT 2146 134.160 10.788 93.354 1.00 0.00 H TER 78265 WAT 2146 ATOM 78265 O WAT 2147 91.773 40.759 93.285 1.00 0.00 O ATOM 78266 H1 WAT 2147 92.483 41.355 93.522 1.00 0.00 H ATOM 78267 H2 WAT 2147 92.125 39.886 93.456 1.00 0.00 H TER 78269 WAT 2147 ATOM 78269 O WAT 2148 79.751 29.060 105.383 1.00 0.00 O ATOM 78270 H1 WAT 2148 80.681 29.287 105.362 1.00 0.00 H ATOM 78271 H2 WAT 2148 79.306 29.841 105.056 1.00 0.00 H TER 78273 WAT 2148 ATOM 78273 O WAT 2149 11.804 72.544 22.141 1.00 0.00 O ATOM 78274 H1 WAT 2149 12.728 72.743 21.991 1.00 0.00 H ATOM 78275 H2 WAT 2149 11.613 71.825 21.538 1.00 0.00 H TER 78277 WAT 2149 ATOM 78277 O WAT 2150 59.513 89.965 74.929 1.00 0.00 O ATOM 78278 H1 WAT 2150 59.805 89.831 74.027 1.00 0.00 H ATOM 78279 H2 WAT 2150 60.266 90.363 75.367 1.00 0.00 H TER 78281 WAT 2150 ATOM 78281 O WAT 2151 21.539 89.926 85.085 1.00 0.00 O ATOM 78282 H1 WAT 2151 21.663 89.837 86.030 1.00 0.00 H ATOM 78283 H2 WAT 2151 20.610 89.739 84.947 1.00 0.00 H TER 78285 WAT 2151 ATOM 78285 O WAT 2152 51.388 81.607 119.901 1.00 0.00 O ATOM 78286 H1 WAT 2152 52.330 81.772 119.949 1.00 0.00 H ATOM 78287 H2 WAT 2152 51.287 81.004 119.164 1.00 0.00 H TER 78289 WAT 2152 ATOM 78289 O WAT 2153 30.707 106.424 78.417 1.00 0.00 O ATOM 78290 H1 WAT 2153 30.788 107.199 78.974 1.00 0.00 H ATOM 78291 H2 WAT 2153 31.103 105.719 78.929 1.00 0.00 H TER 78293 WAT 2153 ATOM 78293 O WAT 2154 57.559 38.162 11.804 1.00 0.00 O ATOM 78294 H1 WAT 2154 58.306 38.445 11.276 1.00 0.00 H ATOM 78295 H2 WAT 2154 56.837 38.096 11.180 1.00 0.00 H TER 78297 WAT 2154 ATOM 78297 O WAT 2155 143.746 56.281 81.255 1.00 0.00 O ATOM 78298 H1 WAT 2155 144.025 55.440 81.615 1.00 0.00 H ATOM 78299 H2 WAT 2155 142.813 56.333 81.464 1.00 0.00 H TER 78301 WAT 2155 ATOM 78301 O WAT 2156 94.215 42.354 144.824 1.00 0.00 O ATOM 78302 H1 WAT 2156 93.729 43.137 145.080 1.00 0.00 H ATOM 78303 H2 WAT 2156 94.874 42.246 145.510 1.00 0.00 H TER 78305 WAT 2156 ATOM 78305 O WAT 2157 141.216 105.581 108.151 1.00 0.00 O ATOM 78306 H1 WAT 2157 141.953 105.344 107.587 1.00 0.00 H ATOM 78307 H2 WAT 2157 141.079 106.514 107.988 1.00 0.00 H TER 78309 WAT 2157 ATOM 78309 O WAT 2158 139.905 1.392 2.449 1.00 0.00 O ATOM 78310 H1 WAT 2158 140.446 0.608 2.364 1.00 0.00 H ATOM 78311 H2 WAT 2158 139.581 1.557 1.563 1.00 0.00 H TER 78313 WAT 2158 ATOM 78313 O WAT 2159 132.956 132.061 152.275 1.00 0.00 O ATOM 78314 H1 WAT 2159 133.218 132.941 152.004 1.00 0.00 H ATOM 78315 H2 WAT 2159 131.999 132.092 152.294 1.00 0.00 H TER 78317 WAT 2159 ATOM 78317 O WAT 2160 0.870 139.968 110.375 1.00 0.00 O ATOM 78318 H1 WAT 2160 0.501 140.503 109.672 1.00 0.00 H ATOM 78319 H2 WAT 2160 1.715 139.674 110.035 1.00 0.00 H TER 78321 WAT 2160 ATOM 78321 O WAT 2161 144.631 35.296 154.363 1.00 0.00 O ATOM 78322 H1 WAT 2161 144.600 34.566 154.982 1.00 0.00 H ATOM 78323 H2 WAT 2161 145.507 35.665 154.472 1.00 0.00 H TER 78325 WAT 2161 ATOM 78325 O WAT 2162 75.183 111.858 75.296 1.00 0.00 O ATOM 78326 H1 WAT 2162 75.273 110.908 75.372 1.00 0.00 H ATOM 78327 H2 WAT 2162 75.999 112.205 75.656 1.00 0.00 H TER 78329 WAT 2162 ATOM 78329 O WAT 2163 116.661 104.518 153.917 1.00 0.00 O ATOM 78330 H1 WAT 2163 116.365 104.499 153.007 1.00 0.00 H ATOM 78331 H2 WAT 2163 115.885 104.281 154.426 1.00 0.00 H TER 78333 WAT 2163 ATOM 78333 O WAT 2164 73.765 21.885 158.205 1.00 0.00 O ATOM 78334 H1 WAT 2164 73.605 21.870 159.149 1.00 0.00 H ATOM 78335 H2 WAT 2164 73.238 21.163 157.862 1.00 0.00 H TER 78337 WAT 2164 ATOM 78337 O WAT 2165 61.399 53.369 69.256 1.00 0.00 O ATOM 78338 H1 WAT 2165 62.354 53.319 69.217 1.00 0.00 H ATOM 78339 H2 WAT 2165 61.202 54.297 69.128 1.00 0.00 H TER 78341 WAT 2165 ATOM 78341 O WAT 2166 30.405 45.357 73.509 1.00 0.00 O ATOM 78342 H1 WAT 2166 31.177 45.889 73.701 1.00 0.00 H ATOM 78343 H2 WAT 2166 29.875 45.905 72.930 1.00 0.00 H TER 78345 WAT 2166 ATOM 78345 O WAT 2167 95.516 11.738 108.687 1.00 0.00 O ATOM 78346 H1 WAT 2167 95.323 12.275 107.919 1.00 0.00 H ATOM 78347 H2 WAT 2167 96.415 11.439 108.551 1.00 0.00 H TER 78349 WAT 2167 ATOM 78349 O WAT 2168 14.878 116.050 135.349 1.00 0.00 O ATOM 78350 H1 WAT 2168 14.074 116.048 134.828 1.00 0.00 H ATOM 78351 H2 WAT 2168 14.846 116.874 135.835 1.00 0.00 H TER 78353 WAT 2168 ATOM 78353 O WAT 2169 106.189 21.427 144.590 1.00 0.00 O ATOM 78354 H1 WAT 2169 106.672 21.240 143.784 1.00 0.00 H ATOM 78355 H2 WAT 2169 106.037 20.567 144.982 1.00 0.00 H TER 78357 WAT 2169 ATOM 78357 O WAT 2170 128.539 51.010 0.967 1.00 0.00 O ATOM 78358 H1 WAT 2170 128.019 50.211 0.877 1.00 0.00 H ATOM 78359 H2 WAT 2170 128.735 51.271 0.068 1.00 0.00 H TER 78361 WAT 2170 ATOM 78361 O WAT 2171 70.062 74.731 111.643 1.00 0.00 O ATOM 78362 H1 WAT 2171 70.568 74.765 112.454 1.00 0.00 H ATOM 78363 H2 WAT 2171 69.268 74.249 111.876 1.00 0.00 H TER 78365 WAT 2171 ATOM 78365 O WAT 2172 1.857 18.250 106.252 1.00 0.00 O ATOM 78366 H1 WAT 2172 0.998 17.878 106.048 1.00 0.00 H ATOM 78367 H2 WAT 2172 2.027 17.979 107.154 1.00 0.00 H TER 78369 WAT 2172 ATOM 78369 O WAT 2173 18.368 7.289 3.786 1.00 0.00 O ATOM 78370 H1 WAT 2173 18.701 6.392 3.804 1.00 0.00 H ATOM 78371 H2 WAT 2173 18.597 7.648 4.644 1.00 0.00 H TER 78373 WAT 2173 ATOM 78373 O WAT 2174 131.713 125.270 84.015 1.00 0.00 O ATOM 78374 H1 WAT 2174 132.467 125.321 83.428 1.00 0.00 H ATOM 78375 H2 WAT 2174 131.248 124.480 83.739 1.00 0.00 H TER 78377 WAT 2174 ATOM 78377 O WAT 2175 58.209 124.660 116.206 1.00 0.00 O ATOM 78378 H1 WAT 2175 58.732 123.929 115.876 1.00 0.00 H ATOM 78379 H2 WAT 2175 57.930 125.129 115.419 1.00 0.00 H TER 78381 WAT 2175 ATOM 78381 O WAT 2176 39.289 108.935 52.818 1.00 0.00 O ATOM 78382 H1 WAT 2176 38.526 108.363 52.737 1.00 0.00 H ATOM 78383 H2 WAT 2176 39.073 109.700 52.284 1.00 0.00 H TER 78385 WAT 2176 ATOM 78385 O WAT 2177 51.171 71.552 73.464 1.00 0.00 O ATOM 78386 H1 WAT 2177 50.973 70.671 73.147 1.00 0.00 H ATOM 78387 H2 WAT 2177 52.125 71.616 73.411 1.00 0.00 H TER 78389 WAT 2177 ATOM 78389 O WAT 2178 103.741 139.573 154.081 1.00 0.00 O ATOM 78390 H1 WAT 2178 103.766 139.869 153.171 1.00 0.00 H ATOM 78391 H2 WAT 2178 103.007 138.959 154.113 1.00 0.00 H TER 78393 WAT 2178 ATOM 78393 O WAT 2179 113.287 36.644 138.068 1.00 0.00 O ATOM 78394 H1 WAT 2179 113.792 36.096 137.467 1.00 0.00 H ATOM 78395 H2 WAT 2179 113.914 36.901 138.743 1.00 0.00 H TER 78397 WAT 2179 ATOM 78397 O WAT 2180 22.455 99.346 79.602 1.00 0.00 O ATOM 78398 H1 WAT 2180 21.798 98.888 80.126 1.00 0.00 H ATOM 78399 H2 WAT 2180 22.454 98.887 78.762 1.00 0.00 H TER 78401 WAT 2180 ATOM 78401 O WAT 2181 62.480 95.373 154.914 1.00 0.00 O ATOM 78402 H1 WAT 2181 62.247 95.653 154.029 1.00 0.00 H ATOM 78403 H2 WAT 2181 63.386 95.074 154.840 1.00 0.00 H TER 78405 WAT 2181 ATOM 78405 O WAT 2182 98.338 90.892 72.978 1.00 0.00 O ATOM 78406 H1 WAT 2182 98.106 90.045 72.596 1.00 0.00 H ATOM 78407 H2 WAT 2182 98.618 91.422 72.231 1.00 0.00 H TER 78409 WAT 2182 ATOM 78409 O WAT 2183 80.639 143.740 87.143 1.00 0.00 O ATOM 78410 H1 WAT 2183 80.340 143.657 88.049 1.00 0.00 H ATOM 78411 H2 WAT 2183 79.961 143.305 86.627 1.00 0.00 H TER 78413 WAT 2183 ATOM 78413 O WAT 2184 55.635 8.304 119.949 1.00 0.00 O ATOM 78414 H1 WAT 2184 54.962 8.930 119.684 1.00 0.00 H ATOM 78415 H2 WAT 2184 55.742 8.449 120.889 1.00 0.00 H TER 78417 WAT 2184 ATOM 78417 O WAT 2185 28.429 11.591 119.387 1.00 0.00 O ATOM 78418 H1 WAT 2185 29.215 11.049 119.325 1.00 0.00 H ATOM 78419 H2 WAT 2185 27.804 11.052 119.873 1.00 0.00 H TER 78421 WAT 2185 ATOM 78421 O WAT 2186 75.127 51.392 108.545 1.00 0.00 O ATOM 78422 H1 WAT 2186 74.669 51.245 109.372 1.00 0.00 H ATOM 78423 H2 WAT 2186 75.602 52.213 108.676 1.00 0.00 H TER 78425 WAT 2186 ATOM 78425 O WAT 2187 0.295 7.466 124.997 1.00 0.00 O ATOM 78426 H1 WAT 2187 0.516 8.395 125.064 1.00 0.00 H ATOM 78427 H2 WAT 2187 -0.174 7.272 125.808 1.00 0.00 H TER 78429 WAT 2187 ATOM 78429 O WAT 2188 111.367 42.191 79.512 1.00 0.00 O ATOM 78430 H1 WAT 2188 111.802 41.653 80.173 1.00 0.00 H ATOM 78431 H2 WAT 2188 110.435 42.119 79.720 1.00 0.00 H TER 78433 WAT 2188 ATOM 78433 O WAT 2189 21.289 27.877 79.963 1.00 0.00 O ATOM 78434 H1 WAT 2189 22.223 27.881 80.175 1.00 0.00 H ATOM 78435 H2 WAT 2189 21.005 26.982 80.149 1.00 0.00 H TER 78437 WAT 2189 ATOM 78437 O WAT 2190 90.096 128.254 86.565 1.00 0.00 O ATOM 78438 H1 WAT 2190 90.988 128.378 86.241 1.00 0.00 H ATOM 78439 H2 WAT 2190 90.157 127.500 87.152 1.00 0.00 H TER 78441 WAT 2190 ATOM 78441 O WAT 2191 41.850 52.516 69.548 1.00 0.00 O ATOM 78442 H1 WAT 2191 41.610 52.005 68.774 1.00 0.00 H ATOM 78443 H2 WAT 2191 41.047 52.555 70.067 1.00 0.00 H TER 78445 WAT 2191 ATOM 78445 O WAT 2192 34.730 55.144 119.595 1.00 0.00 O ATOM 78446 H1 WAT 2192 35.294 55.369 118.855 1.00 0.00 H ATOM 78447 H2 WAT 2192 35.126 55.593 120.342 1.00 0.00 H TER 78449 WAT 2192 ATOM 78449 O WAT 2193 60.278 18.389 114.948 1.00 0.00 O ATOM 78450 H1 WAT 2193 60.910 17.674 115.021 1.00 0.00 H ATOM 78451 H2 WAT 2193 60.080 18.628 115.854 1.00 0.00 H TER 78453 WAT 2193 ATOM 78453 O WAT 2194 20.134 127.175 128.922 1.00 0.00 O ATOM 78454 H1 WAT 2194 20.899 126.600 128.922 1.00 0.00 H ATOM 78455 H2 WAT 2194 19.693 126.987 128.093 1.00 0.00 H TER 78457 WAT 2194 ATOM 78457 O WAT 2195 78.299 19.420 73.779 1.00 0.00 O ATOM 78458 H1 WAT 2195 78.592 19.536 72.875 1.00 0.00 H ATOM 78459 H2 WAT 2195 78.674 20.164 74.250 1.00 0.00 H TER 78461 WAT 2195 ATOM 78461 O WAT 2196 129.592 95.795 84.425 1.00 0.00 O ATOM 78462 H1 WAT 2196 129.316 95.523 85.300 1.00 0.00 H ATOM 78463 H2 WAT 2196 130.543 95.880 84.490 1.00 0.00 H TER 78465 WAT 2196 ATOM 78465 O WAT 2197 41.622 94.199 54.676 1.00 0.00 O ATOM 78466 H1 WAT 2197 40.720 93.877 54.688 1.00 0.00 H ATOM 78467 H2 WAT 2197 41.620 94.890 54.013 1.00 0.00 H TER 78469 WAT 2197 ATOM 78469 O WAT 2198 90.842 89.001 118.868 1.00 0.00 O ATOM 78470 H1 WAT 2198 90.251 89.727 119.067 1.00 0.00 H ATOM 78471 H2 WAT 2198 91.203 89.215 118.007 1.00 0.00 H TER 78473 WAT 2198 ATOM 78473 O WAT 2199 98.743 85.708 77.863 1.00 0.00 O ATOM 78474 H1 WAT 2199 99.501 86.248 78.084 1.00 0.00 H ATOM 78475 H2 WAT 2199 98.806 85.582 76.916 1.00 0.00 H TER 78477 WAT 2199 ATOM 78477 O WAT 2200 26.728 51.148 84.056 1.00 0.00 O ATOM 78478 H1 WAT 2200 25.871 51.543 84.212 1.00 0.00 H ATOM 78479 H2 WAT 2200 26.558 50.448 83.425 1.00 0.00 H TER 78481 WAT 2200 ATOM 78481 O WAT 2201 89.046 117.358 150.812 1.00 0.00 O ATOM 78482 H1 WAT 2201 88.305 117.224 151.403 1.00 0.00 H ATOM 78483 H2 WAT 2201 89.288 118.276 150.935 1.00 0.00 H TER 78485 WAT 2201 ATOM 78485 O WAT 2202 29.540 143.106 59.465 1.00 0.00 O ATOM 78486 H1 WAT 2202 29.363 142.195 59.232 1.00 0.00 H ATOM 78487 H2 WAT 2202 29.963 143.473 58.689 1.00 0.00 H TER 78489 WAT 2202 ATOM 78489 O WAT 2203 65.512 138.221 11.188 1.00 0.00 O ATOM 78490 H1 WAT 2203 65.419 138.644 10.334 1.00 0.00 H ATOM 78491 H2 WAT 2203 64.623 137.953 11.421 1.00 0.00 H TER 78493 WAT 2203 ATOM 78493 O WAT 2204 56.245 4.886 9.640 1.00 0.00 O ATOM 78494 H1 WAT 2204 55.321 4.669 9.758 1.00 0.00 H ATOM 78495 H2 WAT 2204 56.238 5.757 9.242 1.00 0.00 H TER 78497 WAT 2204 ATOM 78497 O WAT 2205 134.383 63.961 104.947 1.00 0.00 O ATOM 78498 H1 WAT 2205 134.423 63.250 104.307 1.00 0.00 H ATOM 78499 H2 WAT 2205 135.225 63.922 105.401 1.00 0.00 H TER 78501 WAT 2205 ATOM 78501 O WAT 2206 33.410 143.126 66.093 1.00 0.00 O ATOM 78502 H1 WAT 2206 33.408 143.731 65.350 1.00 0.00 H ATOM 78503 H2 WAT 2206 34.158 143.402 66.623 1.00 0.00 H TER 78505 WAT 2206 ATOM 78505 O WAT 2207 130.297 134.058 156.624 1.00 0.00 O ATOM 78506 H1 WAT 2207 130.499 133.821 157.529 1.00 0.00 H ATOM 78507 H2 WAT 2207 129.825 134.888 156.694 1.00 0.00 H TER 78509 WAT 2207 ATOM 78509 O WAT 2208 75.838 135.332 3.319 1.00 0.00 O ATOM 78510 H1 WAT 2208 76.062 134.597 3.890 1.00 0.00 H ATOM 78511 H2 WAT 2208 74.994 135.641 3.648 1.00 0.00 H TER 78513 WAT 2208 ATOM 78513 O WAT 2209 48.969 49.114 23.931 1.00 0.00 O ATOM 78514 H1 WAT 2209 48.787 49.362 24.837 1.00 0.00 H ATOM 78515 H2 WAT 2209 49.638 49.735 23.643 1.00 0.00 H TER 78517 WAT 2209 ATOM 78517 O WAT 2210 43.900 69.557 1.856 1.00 0.00 O ATOM 78518 H1 WAT 2210 43.442 69.507 1.016 1.00 0.00 H ATOM 78519 H2 WAT 2210 44.824 69.450 1.631 1.00 0.00 H TER 78521 WAT 2210 ATOM 78521 O WAT 2211 61.965 92.178 117.274 1.00 0.00 O ATOM 78522 H1 WAT 2211 62.204 92.064 118.194 1.00 0.00 H ATOM 78523 H2 WAT 2211 62.207 91.350 116.859 1.00 0.00 H TER 78525 WAT 2211 ATOM 78525 O WAT 2212 88.690 65.615 105.819 1.00 0.00 O ATOM 78526 H1 WAT 2212 87.765 65.841 105.719 1.00 0.00 H ATOM 78527 H2 WAT 2212 89.115 66.003 105.054 1.00 0.00 H TER 78529 WAT 2212 ATOM 78529 O WAT 2213 43.332 76.494 24.725 1.00 0.00 O ATOM 78530 H1 WAT 2213 44.019 75.870 24.959 1.00 0.00 H ATOM 78531 H2 WAT 2213 43.719 77.028 24.031 1.00 0.00 H TER 78533 WAT 2213 ATOM 78533 O WAT 2214 59.131 110.672 12.135 1.00 0.00 O ATOM 78534 H1 WAT 2214 59.848 111.203 11.788 1.00 0.00 H ATOM 78535 H2 WAT 2214 58.339 111.149 11.887 1.00 0.00 H TER 78537 WAT 2214 ATOM 78537 O WAT 2215 18.288 30.254 12.818 1.00 0.00 O ATOM 78538 H1 WAT 2215 18.244 29.542 12.180 1.00 0.00 H ATOM 78539 H2 WAT 2215 19.074 30.068 13.331 1.00 0.00 H TER 78541 WAT 2215 ATOM 78541 O WAT 2216 48.311 60.051 107.886 1.00 0.00 O ATOM 78542 H1 WAT 2216 47.362 60.016 107.770 1.00 0.00 H ATOM 78543 H2 WAT 2216 48.636 59.266 107.445 1.00 0.00 H TER 78545 WAT 2216 ATOM 78545 O WAT 2217 121.108 1.667 17.541 1.00 0.00 O ATOM 78546 H1 WAT 2217 120.937 2.533 17.912 1.00 0.00 H ATOM 78547 H2 WAT 2217 121.866 1.796 16.971 1.00 0.00 H TER 78549 WAT 2217 ATOM 78549 O WAT 2218 109.149 39.206 21.957 1.00 0.00 O ATOM 78550 H1 WAT 2218 109.862 38.926 22.531 1.00 0.00 H ATOM 78551 H2 WAT 2218 108.649 39.830 22.483 1.00 0.00 H TER 78553 WAT 2218 ATOM 78553 O WAT 2219 103.199 32.950 116.689 1.00 0.00 O ATOM 78554 H1 WAT 2219 102.925 33.866 116.631 1.00 0.00 H ATOM 78555 H2 WAT 2219 104.142 32.972 116.526 1.00 0.00 H TER 78557 WAT 2219 ATOM 78557 O WAT 2220 124.649 88.640 156.029 1.00 0.00 O ATOM 78558 H1 WAT 2220 124.778 87.755 156.372 1.00 0.00 H ATOM 78559 H2 WAT 2220 124.495 88.514 155.093 1.00 0.00 H TER 78561 WAT 2220 ATOM 78561 O WAT 2221 44.899 42.787 110.974 1.00 0.00 O ATOM 78562 H1 WAT 2221 45.454 43.419 110.515 1.00 0.00 H ATOM 78563 H2 WAT 2221 44.020 42.948 110.632 1.00 0.00 H TER 78565 WAT 2221 ATOM 78565 O WAT 2222 91.274 51.795 137.075 1.00 0.00 O ATOM 78566 H1 WAT 2222 91.793 51.250 136.484 1.00 0.00 H ATOM 78567 H2 WAT 2222 90.369 51.524 136.917 1.00 0.00 H TER 78569 WAT 2222 ATOM 78569 O WAT 2223 53.536 87.212 78.959 1.00 0.00 O ATOM 78570 H1 WAT 2223 54.361 86.921 78.570 1.00 0.00 H ATOM 78571 H2 WAT 2223 53.067 86.401 79.157 1.00 0.00 H TER 78573 WAT 2223 ATOM 78573 O WAT 2224 79.719 43.678 76.698 1.00 0.00 O ATOM 78574 H1 WAT 2224 79.276 44.323 77.249 1.00 0.00 H ATOM 78575 H2 WAT 2224 79.319 42.842 76.938 1.00 0.00 H TER 78577 WAT 2224 ATOM 78577 O WAT 2225 35.524 14.715 14.212 1.00 0.00 O ATOM 78578 H1 WAT 2225 34.747 14.231 13.934 1.00 0.00 H ATOM 78579 H2 WAT 2225 35.389 15.600 13.872 1.00 0.00 H TER 78581 WAT 2225 ATOM 78581 O WAT 2226 8.979 21.229 101.218 1.00 0.00 O ATOM 78582 H1 WAT 2226 9.799 21.012 101.663 1.00 0.00 H ATOM 78583 H2 WAT 2226 8.888 22.175 101.331 1.00 0.00 H TER 78585 WAT 2226 ATOM 78585 O WAT 2227 1.415 23.887 128.608 1.00 0.00 O ATOM 78586 H1 WAT 2227 1.986 23.142 128.796 1.00 0.00 H ATOM 78587 H2 WAT 2227 1.801 24.614 129.098 1.00 0.00 H TER 78589 WAT 2227 ATOM 78589 O WAT 2228 40.331 69.162 113.981 1.00 0.00 O ATOM 78590 H1 WAT 2228 40.290 69.724 114.755 1.00 0.00 H ATOM 78591 H2 WAT 2228 41.103 68.614 114.125 1.00 0.00 H TER 78593 WAT 2228 ATOM 78593 O WAT 2229 108.873 100.398 152.111 1.00 0.00 O ATOM 78594 H1 WAT 2229 108.099 100.830 152.472 1.00 0.00 H ATOM 78595 H2 WAT 2229 108.605 99.487 151.991 1.00 0.00 H TER 78597 WAT 2229 ATOM 78597 O WAT 2230 113.931 52.369 111.680 1.00 0.00 O ATOM 78598 H1 WAT 2230 114.056 52.282 112.625 1.00 0.00 H ATOM 78599 H2 WAT 2230 114.817 52.348 111.318 1.00 0.00 H TER 78601 WAT 2230 ATOM 78601 O WAT 2231 83.886 48.465 132.406 1.00 0.00 O ATOM 78602 H1 WAT 2231 84.267 47.952 133.118 1.00 0.00 H ATOM 78603 H2 WAT 2231 84.185 48.027 131.609 1.00 0.00 H TER 78605 WAT 2231 ATOM 78605 O WAT 2232 132.311 110.285 98.258 1.00 0.00 O ATOM 78606 H1 WAT 2232 131.973 110.784 99.002 1.00 0.00 H ATOM 78607 H2 WAT 2232 133.089 109.844 98.599 1.00 0.00 H TER 78609 WAT 2232 ATOM 78609 O WAT 2233 69.930 99.092 144.483 1.00 0.00 O ATOM 78610 H1 WAT 2233 70.133 99.430 145.355 1.00 0.00 H ATOM 78611 H2 WAT 2233 70.324 99.725 143.883 1.00 0.00 H TER 78613 WAT 2233 ATOM 78613 O WAT 2234 141.078 85.498 1.299 1.00 0.00 O ATOM 78614 H1 WAT 2234 141.644 84.727 1.263 1.00 0.00 H ATOM 78615 H2 WAT 2234 141.259 85.966 0.483 1.00 0.00 H TER 78617 WAT 2234 ATOM 78617 O WAT 2235 37.092 35.354 116.349 1.00 0.00 O ATOM 78618 H1 WAT 2235 37.985 35.698 116.315 1.00 0.00 H ATOM 78619 H2 WAT 2235 37.033 34.767 115.596 1.00 0.00 H TER 78621 WAT 2235 ATOM 78621 O WAT 2236 6.686 59.291 143.692 1.00 0.00 O ATOM 78622 H1 WAT 2236 7.330 59.879 143.297 1.00 0.00 H ATOM 78623 H2 WAT 2236 7.160 58.862 144.405 1.00 0.00 H TER 78625 WAT 2236 ATOM 78625 O WAT 2237 138.084 31.945 17.177 1.00 0.00 O ATOM 78626 H1 WAT 2237 137.286 31.483 16.922 1.00 0.00 H ATOM 78627 H2 WAT 2237 138.772 31.281 17.125 1.00 0.00 H TER 78629 WAT 2237 ATOM 78629 O WAT 2238 145.595 116.487 139.477 1.00 0.00 O ATOM 78630 H1 WAT 2238 145.751 116.950 138.654 1.00 0.00 H ATOM 78631 H2 WAT 2238 145.154 117.129 140.034 1.00 0.00 H TER 78633 WAT 2238 ATOM 78633 O WAT 2239 8.001 130.597 154.679 1.00 0.00 O ATOM 78634 H1 WAT 2239 8.028 131.275 155.354 1.00 0.00 H ATOM 78635 H2 WAT 2239 7.520 129.875 155.085 1.00 0.00 H TER 78637 WAT 2239 ATOM 78637 O WAT 2240 94.755 98.893 103.270 1.00 0.00 O ATOM 78638 H1 WAT 2240 94.857 99.842 103.347 1.00 0.00 H ATOM 78639 H2 WAT 2240 95.042 98.692 102.379 1.00 0.00 H TER 78641 WAT 2240 ATOM 78641 O WAT 2241 55.043 74.179 127.133 1.00 0.00 O ATOM 78642 H1 WAT 2241 54.186 74.154 126.708 1.00 0.00 H ATOM 78643 H2 WAT 2241 54.889 74.643 127.956 1.00 0.00 H TER 78645 WAT 2241 ATOM 78645 O WAT 2242 49.456 82.337 65.974 1.00 0.00 O ATOM 78646 H1 WAT 2242 48.578 82.708 65.888 1.00 0.00 H ATOM 78647 H2 WAT 2242 49.371 81.675 66.660 1.00 0.00 H TER 78649 WAT 2242 ATOM 78649 O WAT 2243 84.693 54.788 154.164 1.00 0.00 O ATOM 78650 H1 WAT 2243 84.633 54.764 153.209 1.00 0.00 H ATOM 78651 H2 WAT 2243 83.925 54.303 154.464 1.00 0.00 H TER 78653 WAT 2243 ATOM 78653 O WAT 2244 65.739 123.855 93.319 1.00 0.00 O ATOM 78654 H1 WAT 2244 65.906 123.749 94.256 1.00 0.00 H ATOM 78655 H2 WAT 2244 65.061 123.209 93.122 1.00 0.00 H TER 78657 WAT 2244 ATOM 78657 O WAT 2245 132.998 132.054 76.395 1.00 0.00 O ATOM 78658 H1 WAT 2245 132.572 131.973 77.249 1.00 0.00 H ATOM 78659 H2 WAT 2245 132.514 132.750 75.951 1.00 0.00 H TER 78661 WAT 2245 ATOM 78661 O WAT 2246 74.079 19.544 151.029 1.00 0.00 O ATOM 78662 H1 WAT 2246 74.606 20.337 150.935 1.00 0.00 H ATOM 78663 H2 WAT 2246 74.018 19.408 151.975 1.00 0.00 H TER 78665 WAT 2246 ATOM 78665 O WAT 2247 75.489 134.779 73.787 1.00 0.00 O ATOM 78666 H1 WAT 2247 75.906 134.393 74.557 1.00 0.00 H ATOM 78667 H2 WAT 2247 75.364 135.699 74.017 1.00 0.00 H TER 78669 WAT 2247 ATOM 78669 O WAT 2248 108.179 88.965 5.323 1.00 0.00 O ATOM 78670 H1 WAT 2248 108.183 89.851 5.688 1.00 0.00 H ATOM 78671 H2 WAT 2248 107.575 89.014 4.582 1.00 0.00 H TER 78673 WAT 2248 ATOM 78673 O WAT 2249 87.687 66.666 75.431 1.00 0.00 O ATOM 78674 H1 WAT 2249 87.268 66.418 76.255 1.00 0.00 H ATOM 78675 H2 WAT 2249 87.892 65.833 75.006 1.00 0.00 H TER 78677 WAT 2249 ATOM 78677 O WAT 2250 125.704 46.593 16.212 1.00 0.00 O ATOM 78678 H1 WAT 2250 124.905 46.565 15.686 1.00 0.00 H ATOM 78679 H2 WAT 2250 126.170 47.368 15.899 1.00 0.00 H TER 78681 WAT 2250 ATOM 78681 O WAT 2251 81.369 48.154 2.430 1.00 0.00 O ATOM 78682 H1 WAT 2251 81.787 47.806 1.642 1.00 0.00 H ATOM 78683 H2 WAT 2251 81.128 47.379 2.936 1.00 0.00 H TER 78685 WAT 2251 ATOM 78685 O WAT 2252 50.401 44.686 134.834 1.00 0.00 O ATOM 78686 H1 WAT 2252 50.807 44.171 135.532 1.00 0.00 H ATOM 78687 H2 WAT 2252 50.063 44.033 134.221 1.00 0.00 H TER 78689 WAT 2252 ATOM 78689 O WAT 2253 29.906 70.068 129.281 1.00 0.00 O ATOM 78690 H1 WAT 2253 30.671 69.533 129.494 1.00 0.00 H ATOM 78691 H2 WAT 2253 29.160 69.552 129.588 1.00 0.00 H TER 78693 WAT 2253 ATOM 78693 O WAT 2254 31.643 140.581 80.299 1.00 0.00 O ATOM 78694 H1 WAT 2254 31.985 140.915 79.469 1.00 0.00 H ATOM 78695 H2 WAT 2254 31.276 139.725 80.079 1.00 0.00 H TER 78697 WAT 2254 ATOM 78697 O WAT 2255 94.399 37.218 103.714 1.00 0.00 O ATOM 78698 H1 WAT 2255 94.107 37.839 104.382 1.00 0.00 H ATOM 78699 H2 WAT 2255 95.303 37.472 103.531 1.00 0.00 H TER 78701 WAT 2255 ATOM 78701 O WAT 2256 50.655 128.538 143.181 1.00 0.00 O ATOM 78702 H1 WAT 2256 51.555 128.258 143.351 1.00 0.00 H ATOM 78703 H2 WAT 2256 50.392 128.995 143.980 1.00 0.00 H TER 78705 WAT 2256 ATOM 78705 O WAT 2257 16.113 100.103 119.703 1.00 0.00 O ATOM 78706 H1 WAT 2257 16.353 101.000 119.471 1.00 0.00 H ATOM 78707 H2 WAT 2257 16.067 99.643 118.865 1.00 0.00 H TER 78709 WAT 2257 ATOM 78709 O WAT 2258 31.126 19.453 89.236 1.00 0.00 O ATOM 78710 H1 WAT 2258 30.348 19.114 89.678 1.00 0.00 H ATOM 78711 H2 WAT 2258 31.763 19.582 89.940 1.00 0.00 H TER 78713 WAT 2258 ATOM 78713 O WAT 2259 38.378 97.634 137.316 1.00 0.00 O ATOM 78714 H1 WAT 2259 39.217 97.472 136.885 1.00 0.00 H ATOM 78715 H2 WAT 2259 38.099 98.488 136.985 1.00 0.00 H TER 78717 WAT 2259 ATOM 78717 O WAT 2260 136.607 77.513 157.295 1.00 0.00 O ATOM 78718 H1 WAT 2260 136.387 77.247 158.188 1.00 0.00 H ATOM 78719 H2 WAT 2260 136.562 78.469 157.312 1.00 0.00 H TER 78721 WAT 2260 ATOM 78721 O WAT 2261 29.696 144.703 126.732 1.00 0.00 O ATOM 78722 H1 WAT 2261 29.718 143.750 126.656 1.00 0.00 H ATOM 78723 H2 WAT 2261 30.430 145.003 126.195 1.00 0.00 H TER 78725 WAT 2261 ATOM 78725 O WAT 2262 75.671 23.098 99.323 1.00 0.00 O ATOM 78726 H1 WAT 2262 74.782 23.404 99.504 1.00 0.00 H ATOM 78727 H2 WAT 2262 76.018 23.728 98.692 1.00 0.00 H TER 78729 WAT 2262 ATOM 78729 O WAT 2263 73.990 85.711 151.227 1.00 0.00 O ATOM 78730 H1 WAT 2263 74.739 86.300 151.134 1.00 0.00 H ATOM 78731 H2 WAT 2263 74.115 85.298 152.081 1.00 0.00 H TER 78733 WAT 2263 ATOM 78733 O WAT 2264 12.975 63.243 107.892 1.00 0.00 O ATOM 78734 H1 WAT 2264 13.793 62.892 108.243 1.00 0.00 H ATOM 78735 H2 WAT 2264 13.206 63.567 107.022 1.00 0.00 H TER 78737 WAT 2264 ATOM 78737 O WAT 2265 42.097 51.555 154.907 1.00 0.00 O ATOM 78738 H1 WAT 2265 42.967 51.262 155.178 1.00 0.00 H ATOM 78739 H2 WAT 2265 41.913 51.056 154.112 1.00 0.00 H TER 78741 WAT 2265 ATOM 78741 O WAT 2266 25.988 65.109 119.166 1.00 0.00 O ATOM 78742 H1 WAT 2266 25.866 64.696 120.020 1.00 0.00 H ATOM 78743 H2 WAT 2266 26.543 65.868 119.343 1.00 0.00 H TER 78745 WAT 2266 ATOM 78745 O WAT 2267 129.377 32.515 119.896 1.00 0.00 O ATOM 78746 H1 WAT 2267 128.759 32.280 120.588 1.00 0.00 H ATOM 78747 H2 WAT 2267 128.825 32.711 119.139 1.00 0.00 H TER 78749 WAT 2267 ATOM 78749 O WAT 2268 109.077 89.183 107.799 1.00 0.00 O ATOM 78750 H1 WAT 2268 109.549 89.674 107.126 1.00 0.00 H ATOM 78751 H2 WAT 2268 108.442 88.659 107.311 1.00 0.00 H TER 78753 WAT 2268 ATOM 78753 O WAT 2269 8.191 143.574 73.654 1.00 0.00 O ATOM 78754 H1 WAT 2269 9.019 144.019 73.835 1.00 0.00 H ATOM 78755 H2 WAT 2269 8.184 143.460 72.703 1.00 0.00 H TER 78757 WAT 2269 ATOM 78757 O WAT 2270 79.495 142.941 131.701 1.00 0.00 O ATOM 78758 H1 WAT 2270 79.567 143.758 132.196 1.00 0.00 H ATOM 78759 H2 WAT 2270 79.946 142.293 132.242 1.00 0.00 H TER 78761 WAT 2270 ATOM 78761 O WAT 2271 19.733 90.173 23.744 1.00 0.00 O ATOM 78762 H1 WAT 2271 18.908 90.655 23.808 1.00 0.00 H ATOM 78763 H2 WAT 2271 19.565 89.348 24.199 1.00 0.00 H TER 78765 WAT 2271 ATOM 78765 O WAT 2272 61.084 64.189 94.483 1.00 0.00 O ATOM 78766 H1 WAT 2272 61.667 63.702 95.066 1.00 0.00 H ATOM 78767 H2 WAT 2272 60.555 64.730 95.070 1.00 0.00 H TER 78769 WAT 2272 ATOM 78769 O WAT 2273 53.965 31.124 155.419 1.00 0.00 O ATOM 78770 H1 WAT 2273 54.311 30.731 156.221 1.00 0.00 H ATOM 78771 H2 WAT 2273 53.302 30.505 155.116 1.00 0.00 H TER 78773 WAT 2273 ATOM 78773 O WAT 2274 91.922 32.236 80.823 1.00 0.00 O ATOM 78774 H1 WAT 2274 91.451 32.404 80.006 1.00 0.00 H ATOM 78775 H2 WAT 2274 92.251 33.094 81.091 1.00 0.00 H TER 78777 WAT 2274 ATOM 78777 O WAT 2275 44.669 134.762 61.036 1.00 0.00 O ATOM 78778 H1 WAT 2275 44.605 135.330 61.804 1.00 0.00 H ATOM 78779 H2 WAT 2275 45.607 134.722 60.846 1.00 0.00 H TER 78781 WAT 2275 ATOM 78781 O WAT 2276 2.117 28.818 156.721 1.00 0.00 O ATOM 78782 H1 WAT 2276 1.550 29.517 157.045 1.00 0.00 H ATOM 78783 H2 WAT 2276 2.970 29.236 156.602 1.00 0.00 H TER 78785 WAT 2276 ATOM 78785 O WAT 2277 127.412 109.653 120.553 1.00 0.00 O ATOM 78786 H1 WAT 2277 127.533 110.602 120.549 1.00 0.00 H ATOM 78787 H2 WAT 2277 127.785 109.360 119.722 1.00 0.00 H TER 78789 WAT 2277 ATOM 78789 O WAT 2278 72.674 13.762 25.667 1.00 0.00 O ATOM 78790 H1 WAT 2278 72.533 14.683 25.886 1.00 0.00 H ATOM 78791 H2 WAT 2278 73.436 13.768 25.088 1.00 0.00 H TER 78793 WAT 2278 ATOM 78793 O WAT 2279 137.142 21.440 82.483 1.00 0.00 O ATOM 78794 H1 WAT 2279 137.258 21.336 81.538 1.00 0.00 H ATOM 78795 H2 WAT 2279 136.201 21.335 82.622 1.00 0.00 H TER 78797 WAT 2279 ATOM 78797 O WAT 2280 132.598 28.423 95.675 1.00 0.00 O ATOM 78798 H1 WAT 2280 132.028 29.152 95.429 1.00 0.00 H ATOM 78799 H2 WAT 2280 132.911 28.650 96.551 1.00 0.00 H TER 78801 WAT 2280 ATOM 78801 O WAT 2281 84.441 67.313 9.849 1.00 0.00 O ATOM 78802 H1 WAT 2281 84.240 67.065 10.752 1.00 0.00 H ATOM 78803 H2 WAT 2281 83.594 67.303 9.404 1.00 0.00 H TER 78805 WAT 2281 ATOM 78805 O WAT 2282 16.772 3.822 147.765 1.00 0.00 O ATOM 78806 H1 WAT 2282 16.594 4.710 147.454 1.00 0.00 H ATOM 78807 H2 WAT 2282 16.182 3.707 148.510 1.00 0.00 H TER 78809 WAT 2282 ATOM 78809 O WAT 2283 18.017 100.173 137.573 1.00 0.00 O ATOM 78810 H1 WAT 2283 17.738 101.003 137.186 1.00 0.00 H ATOM 78811 H2 WAT 2283 17.206 99.769 137.883 1.00 0.00 H TER 78813 WAT 2283 ATOM 78813 O WAT 2284 107.039 60.378 149.024 1.00 0.00 O ATOM 78814 H1 WAT 2284 107.436 61.123 149.475 1.00 0.00 H ATOM 78815 H2 WAT 2284 107.282 59.619 149.555 1.00 0.00 H TER 78817 WAT 2284 ATOM 78817 O WAT 2285 113.497 35.154 86.843 1.00 0.00 O ATOM 78818 H1 WAT 2285 112.780 35.156 87.477 1.00 0.00 H ATOM 78819 H2 WAT 2285 113.147 35.622 86.084 1.00 0.00 H TER 78821 WAT 2285 ATOM 78821 O WAT 2286 126.839 140.410 18.348 1.00 0.00 O ATOM 78822 H1 WAT 2286 126.400 140.265 19.186 1.00 0.00 H ATOM 78823 H2 WAT 2286 127.772 140.339 18.552 1.00 0.00 H TER 78825 WAT 2286 ATOM 78825 O WAT 2287 122.471 113.414 140.800 1.00 0.00 O ATOM 78826 H1 WAT 2287 121.982 112.869 140.184 1.00 0.00 H ATOM 78827 H2 WAT 2287 122.866 114.095 140.256 1.00 0.00 H TER 78829 WAT 2287 ATOM 78829 O WAT 2288 33.333 46.732 16.745 1.00 0.00 O ATOM 78830 H1 WAT 2288 32.812 46.483 17.509 1.00 0.00 H ATOM 78831 H2 WAT 2288 34.096 47.178 17.112 1.00 0.00 H TER 78833 WAT 2288 ATOM 78833 O WAT 2289 131.467 127.552 133.968 1.00 0.00 O ATOM 78834 H1 WAT 2289 132.240 128.090 134.135 1.00 0.00 H ATOM 78835 H2 WAT 2289 131.752 126.921 133.307 1.00 0.00 H TER 78837 WAT 2289 ATOM 78837 O WAT 2290 78.792 82.192 129.339 1.00 0.00 O ATOM 78838 H1 WAT 2290 77.934 82.515 129.062 1.00 0.00 H ATOM 78839 H2 WAT 2290 79.019 81.528 128.688 1.00 0.00 H TER 78841 WAT 2290 ATOM 78841 O WAT 2291 125.656 123.400 141.562 1.00 0.00 O ATOM 78842 H1 WAT 2291 125.701 122.855 142.348 1.00 0.00 H ATOM 78843 H2 WAT 2291 125.099 124.137 141.813 1.00 0.00 H TER 78845 WAT 2291 ATOM 78845 O WAT 2292 13.146 129.079 63.794 1.00 0.00 O ATOM 78846 H1 WAT 2292 13.976 128.689 64.068 1.00 0.00 H ATOM 78847 H2 WAT 2292 13.302 129.368 62.895 1.00 0.00 H TER 78849 WAT 2292 ATOM 78849 O WAT 2293 128.670 98.558 108.346 1.00 0.00 O ATOM 78850 H1 WAT 2293 128.770 99.371 107.851 1.00 0.00 H ATOM 78851 H2 WAT 2293 128.307 97.936 107.715 1.00 0.00 H TER 78853 WAT 2293 ATOM 78853 O WAT 2294 130.665 94.891 153.111 1.00 0.00 O ATOM 78854 H1 WAT 2294 130.189 95.453 152.500 1.00 0.00 H ATOM 78855 H2 WAT 2294 130.262 94.029 153.007 1.00 0.00 H TER 78857 WAT 2294 ATOM 78857 O WAT 2295 106.895 122.908 105.254 1.00 0.00 O ATOM 78858 H1 WAT 2295 107.694 123.218 104.828 1.00 0.00 H ATOM 78859 H2 WAT 2295 107.164 122.119 105.724 1.00 0.00 H TER 78861 WAT 2295 ATOM 78861 O WAT 2296 88.833 105.588 18.926 1.00 0.00 O ATOM 78862 H1 WAT 2296 88.488 106.389 19.320 1.00 0.00 H ATOM 78863 H2 WAT 2296 89.765 105.765 18.801 1.00 0.00 H TER 78865 WAT 2296 ATOM 78865 O WAT 2297 6.734 39.585 125.535 1.00 0.00 O ATOM 78866 H1 WAT 2297 6.766 40.516 125.756 1.00 0.00 H ATOM 78867 H2 WAT 2297 7.264 39.161 126.210 1.00 0.00 H TER 78869 WAT 2297 ATOM 78869 O WAT 2298 123.536 90.234 123.010 1.00 0.00 O ATOM 78870 H1 WAT 2298 122.885 90.934 123.048 1.00 0.00 H ATOM 78871 H2 WAT 2298 124.365 90.685 122.849 1.00 0.00 H TER 78873 WAT 2298 ATOM 78873 O WAT 2299 48.975 140.304 6.327 1.00 0.00 O ATOM 78874 H1 WAT 2299 48.562 139.650 5.763 1.00 0.00 H ATOM 78875 H2 WAT 2299 49.463 140.866 5.725 1.00 0.00 H TER 78877 WAT 2299 ATOM 78877 O WAT 2300 51.236 138.830 87.370 1.00 0.00 O ATOM 78878 H1 WAT 2300 50.943 139.687 87.061 1.00 0.00 H ATOM 78879 H2 WAT 2300 50.500 138.245 87.188 1.00 0.00 H TER 78881 WAT 2300 ATOM 78881 O WAT 2301 57.823 64.947 129.699 1.00 0.00 O ATOM 78882 H1 WAT 2301 57.455 64.691 128.853 1.00 0.00 H ATOM 78883 H2 WAT 2301 57.199 65.583 130.049 1.00 0.00 H TER 78885 WAT 2301 ATOM 78885 O WAT 2302 129.430 124.359 94.575 1.00 0.00 O ATOM 78886 H1 WAT 2302 130.356 124.594 94.640 1.00 0.00 H ATOM 78887 H2 WAT 2302 128.989 125.180 94.361 1.00 0.00 H TER 78889 WAT 2302 ATOM 78889 O WAT 2303 55.356 97.718 83.187 1.00 0.00 O ATOM 78890 H1 WAT 2303 55.363 98.189 82.354 1.00 0.00 H ATOM 78891 H2 WAT 2303 56.280 97.564 83.383 1.00 0.00 H TER 78893 WAT 2303 ATOM 78893 O WAT 2304 70.394 0.346 92.059 1.00 0.00 O ATOM 78894 H1 WAT 2304 70.735 -0.534 92.221 1.00 0.00 H ATOM 78895 H2 WAT 2304 70.324 0.740 92.929 1.00 0.00 H TER 78897 WAT 2304 ATOM 78897 O WAT 2305 44.541 144.537 7.899 1.00 0.00 O ATOM 78898 H1 WAT 2305 44.541 145.342 8.416 1.00 0.00 H ATOM 78899 H2 WAT 2305 45.257 144.654 7.274 1.00 0.00 H TER 78901 WAT 2305 ATOM 78901 O WAT 2306 52.487 108.107 0.949 1.00 0.00 O ATOM 78902 H1 WAT 2306 51.954 108.520 1.629 1.00 0.00 H ATOM 78903 H2 WAT 2306 53.125 107.582 1.432 1.00 0.00 H TER 78905 WAT 2306 ATOM 78905 O WAT 2307 77.137 63.579 148.410 1.00 0.00 O ATOM 78906 H1 WAT 2307 77.391 63.510 149.331 1.00 0.00 H ATOM 78907 H2 WAT 2307 76.376 63.004 148.328 1.00 0.00 H TER 78909 WAT 2307 ATOM 78909 O WAT 2308 29.296 93.055 85.985 1.00 0.00 O ATOM 78910 H1 WAT 2308 28.640 93.748 85.919 1.00 0.00 H ATOM 78911 H2 WAT 2308 29.782 93.106 85.162 1.00 0.00 H TER 78913 WAT 2308 ATOM 78913 O WAT 2309 140.864 88.440 87.039 1.00 0.00 O ATOM 78914 H1 WAT 2309 140.837 89.386 86.893 1.00 0.00 H ATOM 78915 H2 WAT 2309 141.699 88.289 87.482 1.00 0.00 H TER 78917 WAT 2309 ATOM 78917 O WAT 2310 46.500 105.135 112.432 1.00 0.00 O ATOM 78918 H1 WAT 2310 46.081 104.410 112.896 1.00 0.00 H ATOM 78919 H2 WAT 2310 46.198 105.920 112.889 1.00 0.00 H TER 78921 WAT 2310 ATOM 78921 O WAT 2311 16.266 58.931 116.516 1.00 0.00 O ATOM 78922 H1 WAT 2311 15.989 59.634 115.928 1.00 0.00 H ATOM 78923 H2 WAT 2311 15.813 59.114 117.338 1.00 0.00 H TER 78925 WAT 2311 ATOM 78925 O WAT 2312 97.280 58.691 95.071 1.00 0.00 O ATOM 78926 H1 WAT 2312 98.229 58.571 95.104 1.00 0.00 H ATOM 78927 H2 WAT 2312 96.996 58.599 95.981 1.00 0.00 H TER 78929 WAT 2312 ATOM 78929 O WAT 2313 59.865 103.962 133.100 1.00 0.00 O ATOM 78930 H1 WAT 2313 60.062 104.802 133.512 1.00 0.00 H ATOM 78931 H2 WAT 2313 58.909 103.936 133.054 1.00 0.00 H TER 78933 WAT 2313 ATOM 78933 O WAT 2314 26.553 11.039 113.892 1.00 0.00 O ATOM 78934 H1 WAT 2314 26.852 10.349 114.483 1.00 0.00 H ATOM 78935 H2 WAT 2314 25.626 11.152 114.105 1.00 0.00 H TER 78937 WAT 2314 ATOM 78937 O WAT 2315 48.564 131.589 153.598 1.00 0.00 O ATOM 78938 H1 WAT 2315 48.781 132.482 153.331 1.00 0.00 H ATOM 78939 H2 WAT 2315 48.186 131.190 152.814 1.00 0.00 H TER 78941 WAT 2315 ATOM 78941 O WAT 2316 120.043 90.953 113.037 1.00 0.00 O ATOM 78942 H1 WAT 2316 119.173 91.026 113.430 1.00 0.00 H ATOM 78943 H2 WAT 2316 120.155 91.771 112.552 1.00 0.00 H TER 78945 WAT 2316 ATOM 78945 O WAT 2317 19.342 99.963 14.667 1.00 0.00 O ATOM 78946 H1 WAT 2317 18.767 99.359 15.137 1.00 0.00 H ATOM 78947 H2 WAT 2317 18.845 100.780 14.624 1.00 0.00 H TER 78949 WAT 2317 ATOM 78949 O WAT 2318 1.890 2.698 148.207 1.00 0.00 O ATOM 78950 H1 WAT 2318 1.833 2.046 147.509 1.00 0.00 H ATOM 78951 H2 WAT 2318 2.802 2.660 148.496 1.00 0.00 H TER 78953 WAT 2318 ATOM 78953 O WAT 2319 137.366 76.170 123.392 1.00 0.00 O ATOM 78954 H1 WAT 2319 137.199 77.105 123.508 1.00 0.00 H ATOM 78955 H2 WAT 2319 137.122 75.777 124.230 1.00 0.00 H TER 78957 WAT 2319 ATOM 78957 O WAT 2320 52.514 55.640 77.752 1.00 0.00 O ATOM 78958 H1 WAT 2320 53.265 55.521 77.170 1.00 0.00 H ATOM 78959 H2 WAT 2320 52.580 56.548 78.047 1.00 0.00 H TER 78961 WAT 2320 ATOM 78961 O WAT 2321 19.965 120.021 146.625 1.00 0.00 O ATOM 78962 H1 WAT 2321 19.014 119.930 146.686 1.00 0.00 H ATOM 78963 H2 WAT 2321 20.211 119.477 145.877 1.00 0.00 H TER 78965 WAT 2321 ATOM 78965 O WAT 2322 99.722 142.136 80.881 1.00 0.00 O ATOM 78966 H1 WAT 2322 99.019 142.680 81.235 1.00 0.00 H ATOM 78967 H2 WAT 2322 100.421 142.194 81.532 1.00 0.00 H TER 78969 WAT 2322 ATOM 78969 O WAT 2323 43.799 125.010 10.610 1.00 0.00 O ATOM 78970 H1 WAT 2323 44.101 125.908 10.750 1.00 0.00 H ATOM 78971 H2 WAT 2323 44.055 124.809 9.710 1.00 0.00 H TER 78973 WAT 2323 ATOM 78973 O WAT 2324 7.471 68.345 14.871 1.00 0.00 O ATOM 78974 H1 WAT 2324 6.979 69.151 15.026 1.00 0.00 H ATOM 78975 H2 WAT 2324 8.195 68.382 15.496 1.00 0.00 H TER 78977 WAT 2324 ATOM 78977 O WAT 2325 101.407 50.981 87.227 1.00 0.00 O ATOM 78978 H1 WAT 2325 101.320 51.196 86.298 1.00 0.00 H ATOM 78979 H2 WAT 2325 102.115 51.545 87.538 1.00 0.00 H TER 78981 WAT 2325 ATOM 78981 O WAT 2326 12.391 32.561 156.046 1.00 0.00 O ATOM 78982 H1 WAT 2326 12.432 33.044 156.872 1.00 0.00 H ATOM 78983 H2 WAT 2326 13.283 32.241 155.912 1.00 0.00 H TER 78985 WAT 2326 ATOM 78985 O WAT 2327 46.539 112.959 16.798 1.00 0.00 O ATOM 78986 H1 WAT 2327 46.101 113.807 16.726 1.00 0.00 H ATOM 78987 H2 WAT 2327 45.829 112.319 16.770 1.00 0.00 H TER 78989 WAT 2327 ATOM 78989 O WAT 2328 88.466 35.698 149.094 1.00 0.00 O ATOM 78990 H1 WAT 2328 87.632 35.322 149.377 1.00 0.00 H ATOM 78991 H2 WAT 2328 88.223 36.363 148.450 1.00 0.00 H TER 78993 WAT 2328 ATOM 78993 O WAT 2329 7.775 140.453 78.532 1.00 0.00 O ATOM 78994 H1 WAT 2329 7.536 141.363 78.708 1.00 0.00 H ATOM 78995 H2 WAT 2329 8.565 140.307 79.053 1.00 0.00 H TER 78997 WAT 2329 ATOM 78997 O WAT 2330 110.308 114.633 76.220 1.00 0.00 O ATOM 78998 H1 WAT 2330 110.677 115.012 75.423 1.00 0.00 H ATOM 78999 H2 WAT 2330 110.391 115.326 76.876 1.00 0.00 H TER 79001 WAT 2330 ATOM 79001 O WAT 2331 116.946 124.893 117.454 1.00 0.00 O ATOM 79002 H1 WAT 2331 116.274 125.531 117.213 1.00 0.00 H ATOM 79003 H2 WAT 2331 117.685 125.424 117.752 1.00 0.00 H TER 79005 WAT 2331 ATOM 79005 O WAT 2332 94.191 12.471 9.176 1.00 0.00 O ATOM 79006 H1 WAT 2332 94.211 12.514 10.132 1.00 0.00 H ATOM 79007 H2 WAT 2332 94.924 11.900 8.947 1.00 0.00 H TER 79009 WAT 2332 ATOM 79009 O WAT 2333 135.402 29.876 109.392 1.00 0.00 O ATOM 79010 H1 WAT 2333 134.635 29.375 109.113 1.00 0.00 H ATOM 79011 H2 WAT 2333 135.310 29.944 110.342 1.00 0.00 H TER 79013 WAT 2333 ATOM 79013 O WAT 2334 68.456 69.309 124.996 1.00 0.00 O ATOM 79014 H1 WAT 2334 69.315 69.092 125.358 1.00 0.00 H ATOM 79015 H2 WAT 2334 68.476 68.959 124.105 1.00 0.00 H TER 79017 WAT 2334 ATOM 79017 O WAT 2335 116.688 53.766 156.223 1.00 0.00 O ATOM 79018 H1 WAT 2335 116.801 54.675 155.945 1.00 0.00 H ATOM 79019 H2 WAT 2335 117.541 53.361 156.067 1.00 0.00 H TER 79021 WAT 2335 ATOM 79021 O WAT 2336 33.848 73.293 105.793 1.00 0.00 O ATOM 79022 H1 WAT 2336 33.771 72.364 106.011 1.00 0.00 H ATOM 79023 H2 WAT 2336 33.587 73.749 106.593 1.00 0.00 H TER 79025 WAT 2336 ATOM 79025 O WAT 2337 91.139 117.227 148.920 1.00 0.00 O ATOM 79026 H1 WAT 2337 92.072 117.073 149.066 1.00 0.00 H ATOM 79027 H2 WAT 2337 90.736 117.091 149.777 1.00 0.00 H TER 79029 WAT 2337 ATOM 79029 O WAT 2338 21.700 40.495 94.845 1.00 0.00 O ATOM 79030 H1 WAT 2338 22.146 40.359 95.681 1.00 0.00 H ATOM 79031 H2 WAT 2338 20.777 40.593 95.079 1.00 0.00 H TER 79033 WAT 2338 ATOM 79033 O WAT 2339 59.633 8.397 21.440 1.00 0.00 O ATOM 79034 H1 WAT 2339 59.931 7.658 20.910 1.00 0.00 H ATOM 79035 H2 WAT 2339 60.367 9.011 21.429 1.00 0.00 H TER 79037 WAT 2339 ATOM 79037 O WAT 2340 52.764 39.184 1.454 1.00 0.00 O ATOM 79038 H1 WAT 2340 53.451 39.241 2.119 1.00 0.00 H ATOM 79039 H2 WAT 2340 51.965 39.441 1.913 1.00 0.00 H TER 79041 WAT 2340 ATOM 79041 O WAT 2341 57.687 129.132 1.224 1.00 0.00 O ATOM 79042 H1 WAT 2341 57.213 129.794 1.727 1.00 0.00 H ATOM 79043 H2 WAT 2341 57.004 128.549 0.892 1.00 0.00 H TER 79045 WAT 2341 ATOM 79045 O WAT 2342 15.062 88.562 143.073 1.00 0.00 O ATOM 79046 H1 WAT 2342 15.391 88.395 143.957 1.00 0.00 H ATOM 79047 H2 WAT 2342 14.883 87.692 142.716 1.00 0.00 H TER 79049 WAT 2342 ATOM 79049 O WAT 2343 59.020 118.061 110.113 1.00 0.00 O ATOM 79050 H1 WAT 2343 59.172 118.746 109.462 1.00 0.00 H ATOM 79051 H2 WAT 2343 58.088 118.130 110.319 1.00 0.00 H TER 79053 WAT 2343 ATOM 79053 O WAT 2344 113.592 139.299 81.780 1.00 0.00 O ATOM 79054 H1 WAT 2344 112.745 138.853 81.802 1.00 0.00 H ATOM 79055 H2 WAT 2344 114.095 138.893 82.485 1.00 0.00 H TER 79057 WAT 2344 ATOM 79057 O WAT 2345 73.642 135.595 76.250 1.00 0.00 O ATOM 79058 H1 WAT 2345 72.883 135.628 76.833 1.00 0.00 H ATOM 79059 H2 WAT 2345 74.273 135.041 76.709 1.00 0.00 H TER 79061 WAT 2345 ATOM 79061 O WAT 2346 4.776 76.113 131.574 1.00 0.00 O ATOM 79062 H1 WAT 2346 4.285 75.592 130.939 1.00 0.00 H ATOM 79063 H2 WAT 2346 5.012 75.491 132.263 1.00 0.00 H TER 79065 WAT 2346 ATOM 79065 O WAT 2347 107.430 53.131 14.122 1.00 0.00 O ATOM 79066 H1 WAT 2347 107.510 53.475 13.232 1.00 0.00 H ATOM 79067 H2 WAT 2347 106.487 53.101 14.283 1.00 0.00 H TER 79069 WAT 2347 ATOM 79069 O WAT 2348 56.855 145.596 11.023 1.00 0.00 O ATOM 79070 H1 WAT 2348 57.479 146.293 10.819 1.00 0.00 H ATOM 79071 H2 WAT 2348 56.138 145.727 10.402 1.00 0.00 H TER 79073 WAT 2348 ATOM 79073 O WAT 2349 99.963 83.375 117.904 1.00 0.00 O ATOM 79074 H1 WAT 2349 99.479 82.614 117.583 1.00 0.00 H ATOM 79075 H2 WAT 2349 99.308 83.899 118.365 1.00 0.00 H TER 79077 WAT 2349 ATOM 79077 O WAT 2350 28.963 103.388 2.517 1.00 0.00 O ATOM 79078 H1 WAT 2350 28.411 102.892 3.122 1.00 0.00 H ATOM 79079 H2 WAT 2350 28.381 104.055 2.153 1.00 0.00 H TER 79081 WAT 2350 ATOM 79081 O WAT 2351 128.126 120.546 131.730 1.00 0.00 O ATOM 79082 H1 WAT 2351 128.066 121.500 131.701 1.00 0.00 H ATOM 79083 H2 WAT 2351 128.658 120.363 132.505 1.00 0.00 H TER 79085 WAT 2351 ATOM 79085 O WAT 2352 5.832 31.505 149.767 1.00 0.00 O ATOM 79086 H1 WAT 2352 4.946 31.185 149.940 1.00 0.00 H ATOM 79087 H2 WAT 2352 6.398 30.938 150.290 1.00 0.00 H TER 79089 WAT 2352 ATOM 79089 O WAT 2353 87.470 90.295 29.637 1.00 0.00 O ATOM 79090 H1 WAT 2353 87.590 89.460 29.184 1.00 0.00 H ATOM 79091 H2 WAT 2353 88.340 90.511 29.975 1.00 0.00 H TER 79093 WAT 2353 ATOM 79093 O WAT 2354 130.979 78.167 82.741 1.00 0.00 O ATOM 79094 H1 WAT 2354 130.810 79.078 82.982 1.00 0.00 H ATOM 79095 H2 WAT 2354 131.916 78.140 82.549 1.00 0.00 H TER 79097 WAT 2354 ATOM 79097 O WAT 2355 100.875 21.984 135.950 1.00 0.00 O ATOM 79098 H1 WAT 2355 101.248 22.253 135.110 1.00 0.00 H ATOM 79099 H2 WAT 2355 100.533 22.793 136.331 1.00 0.00 H TER 79101 WAT 2355 ATOM 79101 O WAT 2356 95.887 63.602 80.774 1.00 0.00 O ATOM 79102 H1 WAT 2356 95.386 62.829 80.513 1.00 0.00 H ATOM 79103 H2 WAT 2356 96.582 63.668 80.119 1.00 0.00 H TER 79105 WAT 2356 ATOM 79105 O WAT 2357 4.866 69.801 96.463 1.00 0.00 O ATOM 79106 H1 WAT 2357 3.916 69.917 96.429 1.00 0.00 H ATOM 79107 H2 WAT 2357 5.110 69.557 95.571 1.00 0.00 H TER 79109 WAT 2357 ATOM 79109 O WAT 2358 132.442 80.810 79.160 1.00 0.00 O ATOM 79110 H1 WAT 2358 132.194 79.970 78.775 1.00 0.00 H ATOM 79111 H2 WAT 2358 131.805 81.432 78.807 1.00 0.00 H TER 79113 WAT 2358 ATOM 79113 O WAT 2359 89.584 134.556 140.337 1.00 0.00 O ATOM 79114 H1 WAT 2359 89.716 133.686 140.712 1.00 0.00 H ATOM 79115 H2 WAT 2359 90.062 134.535 139.508 1.00 0.00 H TER 79117 WAT 2359 ATOM 79117 O WAT 2360 98.507 108.971 128.083 1.00 0.00 O ATOM 79118 H1 WAT 2360 97.557 109.019 128.194 1.00 0.00 H ATOM 79119 H2 WAT 2360 98.766 109.863 127.850 1.00 0.00 H TER 79121 WAT 2360 ATOM 79121 O WAT 2361 68.875 108.879 94.880 1.00 0.00 O ATOM 79122 H1 WAT 2361 69.695 108.502 95.200 1.00 0.00 H ATOM 79123 H2 WAT 2361 68.191 108.378 95.327 1.00 0.00 H TER 79125 WAT 2361 ATOM 79125 O WAT 2362 133.140 10.451 136.379 1.00 0.00 O ATOM 79126 H1 WAT 2362 134.050 10.317 136.114 1.00 0.00 H ATOM 79127 H2 WAT 2362 133.155 11.262 136.887 1.00 0.00 H TER 79129 WAT 2362 ATOM 79129 O WAT 2363 83.071 125.994 100.215 1.00 0.00 O ATOM 79130 H1 WAT 2363 82.231 125.734 100.594 1.00 0.00 H ATOM 79131 H2 WAT 2363 83.720 125.482 100.697 1.00 0.00 H TER 79133 WAT 2363 ATOM 79133 O WAT 2364 84.492 141.178 58.224 1.00 0.00 O ATOM 79134 H1 WAT 2364 85.220 141.127 57.605 1.00 0.00 H ATOM 79135 H2 WAT 2364 84.697 141.934 58.774 1.00 0.00 H TER 79137 WAT 2364 ATOM 79137 O WAT 2365 95.832 49.376 0.540 1.00 0.00 O ATOM 79138 H1 WAT 2365 95.567 50.243 0.847 1.00 0.00 H ATOM 79139 H2 WAT 2365 95.754 49.424 -0.413 1.00 0.00 H TER 79141 WAT 2365 ATOM 79141 O WAT 2366 64.525 12.053 150.406 1.00 0.00 O ATOM 79142 H1 WAT 2366 64.063 12.506 149.701 1.00 0.00 H ATOM 79143 H2 WAT 2366 64.869 12.755 150.958 1.00 0.00 H TER 79145 WAT 2366 ATOM 79145 O WAT 2367 123.042 38.304 52.148 1.00 0.00 O ATOM 79146 H1 WAT 2367 123.724 38.372 52.817 1.00 0.00 H ATOM 79147 H2 WAT 2367 122.534 39.110 52.241 1.00 0.00 H TER 79149 WAT 2367 ATOM 79149 O WAT 2368 32.505 127.107 3.115 1.00 0.00 O ATOM 79150 H1 WAT 2368 32.876 127.973 2.946 1.00 0.00 H ATOM 79151 H2 WAT 2368 31.699 127.282 3.601 1.00 0.00 H TER 79153 WAT 2368 ATOM 79153 O WAT 2369 12.409 56.636 105.817 1.00 0.00 O ATOM 79154 H1 WAT 2369 12.876 56.714 104.986 1.00 0.00 H ATOM 79155 H2 WAT 2369 11.576 56.224 105.586 1.00 0.00 H TER 79157 WAT 2369 ATOM 79157 O WAT 2370 55.061 141.343 67.848 1.00 0.00 O ATOM 79158 H1 WAT 2370 55.506 142.095 67.456 1.00 0.00 H ATOM 79159 H2 WAT 2370 54.217 141.689 68.138 1.00 0.00 H TER 79161 WAT 2370 ATOM 79161 O WAT 2371 34.540 55.341 150.277 1.00 0.00 O ATOM 79162 H1 WAT 2371 33.657 55.395 149.913 1.00 0.00 H ATOM 79163 H2 WAT 2371 34.458 54.743 151.020 1.00 0.00 H TER 79165 WAT 2371 ATOM 79165 O WAT 2372 14.339 42.449 82.606 1.00 0.00 O ATOM 79166 H1 WAT 2372 14.025 43.337 82.776 1.00 0.00 H ATOM 79167 H2 WAT 2372 13.656 42.054 82.064 1.00 0.00 H TER 79169 WAT 2372 ATOM 79169 O WAT 2373 115.524 130.152 128.960 1.00 0.00 O ATOM 79170 H1 WAT 2373 115.448 130.366 128.030 1.00 0.00 H ATOM 79171 H2 WAT 2373 114.978 130.803 129.401 1.00 0.00 H TER 79173 WAT 2373 ATOM 79173 O WAT 2374 13.393 56.958 125.178 1.00 0.00 O ATOM 79174 H1 WAT 2374 14.150 56.518 125.566 1.00 0.00 H ATOM 79175 H2 WAT 2374 12.694 56.304 125.210 1.00 0.00 H TER 79177 WAT 2374 ATOM 79177 O WAT 2375 103.870 105.823 155.462 1.00 0.00 O ATOM 79178 H1 WAT 2375 104.605 106.073 156.021 1.00 0.00 H ATOM 79179 H2 WAT 2375 104.063 106.228 154.616 1.00 0.00 H TER 79181 WAT 2375 ATOM 79181 O WAT 2376 62.062 5.734 86.728 1.00 0.00 O ATOM 79182 H1 WAT 2376 62.481 6.433 86.227 1.00 0.00 H ATOM 79183 H2 WAT 2376 62.439 4.928 86.376 1.00 0.00 H TER 79185 WAT 2376 ATOM 79185 O WAT 2377 116.887 51.248 147.632 1.00 0.00 O ATOM 79186 H1 WAT 2377 116.552 51.995 147.136 1.00 0.00 H ATOM 79187 H2 WAT 2377 116.104 50.766 147.898 1.00 0.00 H TER 79189 WAT 2377 ATOM 79189 O WAT 2378 60.100 119.201 57.426 1.00 0.00 O ATOM 79190 H1 WAT 2378 60.626 119.361 56.642 1.00 0.00 H ATOM 79191 H2 WAT 2378 60.090 120.042 57.883 1.00 0.00 H TER 79193 WAT 2378 ATOM 79193 O WAT 2379 45.622 108.465 12.731 1.00 0.00 O ATOM 79194 H1 WAT 2379 45.248 109.298 13.019 1.00 0.00 H ATOM 79195 H2 WAT 2379 45.420 107.854 13.441 1.00 0.00 H TER 79197 WAT 2379 ATOM 79197 O WAT 2380 25.051 0.552 121.764 1.00 0.00 O ATOM 79198 H1 WAT 2380 24.103 0.542 121.632 1.00 0.00 H ATOM 79199 H2 WAT 2380 25.202 -0.081 122.466 1.00 0.00 H TER 79201 WAT 2380 ATOM 79201 O WAT 2381 97.307 1.867 125.254 1.00 0.00 O ATOM 79202 H1 WAT 2381 96.859 2.558 124.766 1.00 0.00 H ATOM 79203 H2 WAT 2381 98.208 2.178 125.339 1.00 0.00 H TER 79205 WAT 2381 ATOM 79205 O WAT 2382 29.490 113.207 4.320 1.00 0.00 O ATOM 79206 H1 WAT 2382 29.628 114.040 4.769 1.00 0.00 H ATOM 79207 H2 WAT 2382 29.073 113.447 3.493 1.00 0.00 H TER 79209 WAT 2382 ATOM 79209 O WAT 2383 28.464 34.991 108.799 1.00 0.00 O ATOM 79210 H1 WAT 2383 27.874 35.723 108.620 1.00 0.00 H ATOM 79211 H2 WAT 2383 29.265 35.207 108.323 1.00 0.00 H TER 79213 WAT 2383 ATOM 79213 O WAT 2384 106.519 11.612 12.588 1.00 0.00 O ATOM 79214 H1 WAT 2384 106.203 11.340 13.450 1.00 0.00 H ATOM 79215 H2 WAT 2384 105.981 12.372 12.365 1.00 0.00 H TER 79217 WAT 2384 ATOM 79217 O WAT 2385 43.905 27.076 83.525 1.00 0.00 O ATOM 79218 H1 WAT 2385 44.296 26.204 83.581 1.00 0.00 H ATOM 79219 H2 WAT 2385 43.064 26.935 83.091 1.00 0.00 H TER 79221 WAT 2385 ATOM 79221 O WAT 2386 79.701 4.585 158.454 1.00 0.00 O ATOM 79222 H1 WAT 2386 80.117 4.361 157.621 1.00 0.00 H ATOM 79223 H2 WAT 2386 79.695 5.543 158.469 1.00 0.00 H TER 79225 WAT 2386 ATOM 79225 O WAT 2387 100.811 88.704 70.523 1.00 0.00 O ATOM 79226 H1 WAT 2387 101.442 89.008 69.871 1.00 0.00 H ATOM 79227 H2 WAT 2387 100.514 87.856 70.194 1.00 0.00 H TER 79229 WAT 2387 ATOM 79229 O WAT 2388 1.732 25.742 62.185 1.00 0.00 O ATOM 79230 H1 WAT 2388 1.490 26.197 61.379 1.00 0.00 H ATOM 79231 H2 WAT 2388 2.625 25.434 62.028 1.00 0.00 H TER 79233 WAT 2388 ATOM 79233 O WAT 2389 61.140 44.885 0.273 1.00 0.00 O ATOM 79234 H1 WAT 2389 61.682 45.620 0.560 1.00 0.00 H ATOM 79235 H2 WAT 2389 60.516 45.272 -0.340 1.00 0.00 H TER 79237 WAT 2389 ATOM 79237 O WAT 2390 26.858 58.567 5.570 1.00 0.00 O ATOM 79238 H1 WAT 2390 27.730 58.943 5.693 1.00 0.00 H ATOM 79239 H2 WAT 2390 26.293 59.079 6.149 1.00 0.00 H TER 79241 WAT 2390 ATOM 79241 O WAT 2391 6.076 136.225 83.873 1.00 0.00 O ATOM 79242 H1 WAT 2391 5.553 135.439 84.029 1.00 0.00 H ATOM 79243 H2 WAT 2391 6.001 136.381 82.932 1.00 0.00 H TER 79245 WAT 2391 ATOM 79245 O WAT 2392 64.361 90.789 88.346 1.00 0.00 O ATOM 79246 H1 WAT 2392 64.975 91.205 87.741 1.00 0.00 H ATOM 79247 H2 WAT 2392 64.917 90.311 88.961 1.00 0.00 H TER 79249 WAT 2392 ATOM 79249 O WAT 2393 125.329 88.227 131.914 1.00 0.00 O ATOM 79250 H1 WAT 2393 124.574 87.642 131.971 1.00 0.00 H ATOM 79251 H2 WAT 2393 125.149 88.778 131.152 1.00 0.00 H TER 79253 WAT 2393 ATOM 79253 O WAT 2394 88.658 129.647 134.897 1.00 0.00 O ATOM 79254 H1 WAT 2394 89.008 129.933 135.741 1.00 0.00 H ATOM 79255 H2 WAT 2394 88.980 130.296 134.272 1.00 0.00 H TER 79257 WAT 2394 ATOM 79257 O WAT 2395 40.664 57.473 65.429 1.00 0.00 O ATOM 79258 H1 WAT 2395 39.771 57.157 65.567 1.00 0.00 H ATOM 79259 H2 WAT 2395 41.218 56.714 65.612 1.00 0.00 H TER 79261 WAT 2395 ATOM 79261 O WAT 2396 131.634 110.500 103.787 1.00 0.00 O ATOM 79262 H1 WAT 2396 131.516 111.401 103.487 1.00 0.00 H ATOM 79263 H2 WAT 2396 132.134 110.078 103.089 1.00 0.00 H TER 79265 WAT 2396 ATOM 79265 O WAT 2397 45.838 40.084 145.079 1.00 0.00 O ATOM 79266 H1 WAT 2397 46.615 40.090 145.638 1.00 0.00 H ATOM 79267 H2 WAT 2397 46.185 40.084 144.187 1.00 0.00 H TER 79269 WAT 2397 ATOM 79269 O WAT 2398 124.420 125.359 104.498 1.00 0.00 O ATOM 79270 H1 WAT 2398 125.240 125.746 104.189 1.00 0.00 H ATOM 79271 H2 WAT 2398 124.694 124.603 105.018 1.00 0.00 H TER 79273 WAT 2398 ATOM 79273 O WAT 2399 59.338 90.462 64.683 1.00 0.00 O ATOM 79274 H1 WAT 2399 59.567 91.047 65.405 1.00 0.00 H ATOM 79275 H2 WAT 2399 60.180 90.191 64.317 1.00 0.00 H TER 79277 WAT 2399 ATOM 79277 O WAT 2400 44.615 67.419 79.631 1.00 0.00 O ATOM 79278 H1 WAT 2400 45.143 66.746 79.201 1.00 0.00 H ATOM 79279 H2 WAT 2400 43.809 66.968 79.882 1.00 0.00 H TER 79281 WAT 2400 ATOM 79281 O WAT 2401 121.664 18.402 70.505 1.00 0.00 O ATOM 79282 H1 WAT 2401 120.770 18.498 70.177 1.00 0.00 H ATOM 79283 H2 WAT 2401 121.722 19.027 71.228 1.00 0.00 H TER 79285 WAT 2401 ATOM 79285 O WAT 2402 119.682 61.561 113.159 1.00 0.00 O ATOM 79286 H1 WAT 2402 119.871 62.345 113.675 1.00 0.00 H ATOM 79287 H2 WAT 2402 119.734 61.856 112.249 1.00 0.00 H TER 79289 WAT 2402 ATOM 79289 O WAT 2403 48.913 82.449 106.782 1.00 0.00 O ATOM 79290 H1 WAT 2403 48.351 82.987 106.225 1.00 0.00 H ATOM 79291 H2 WAT 2403 49.398 81.895 106.170 1.00 0.00 H TER 79293 WAT 2403 ATOM 79293 O WAT 2404 51.813 27.705 67.589 1.00 0.00 O ATOM 79294 H1 WAT 2404 52.076 28.092 68.423 1.00 0.00 H ATOM 79295 H2 WAT 2404 51.130 27.075 67.821 1.00 0.00 H TER 79297 WAT 2404 ATOM 79297 O WAT 2405 13.213 48.431 130.815 1.00 0.00 O ATOM 79298 H1 WAT 2405 14.117 48.505 131.121 1.00 0.00 H ATOM 79299 H2 WAT 2405 13.287 48.370 129.862 1.00 0.00 H TER 79301 WAT 2405 ATOM 79301 O WAT 2406 83.877 15.874 20.633 1.00 0.00 O ATOM 79302 H1 WAT 2406 83.819 15.450 21.489 1.00 0.00 H ATOM 79303 H2 WAT 2406 84.762 16.238 20.605 1.00 0.00 H TER 79305 WAT 2406 ATOM 79305 O WAT 2407 24.010 113.342 133.564 1.00 0.00 O ATOM 79306 H1 WAT 2407 23.258 112.752 133.529 1.00 0.00 H ATOM 79307 H2 WAT 2407 24.501 113.060 134.336 1.00 0.00 H TER 79309 WAT 2407 ATOM 79309 O WAT 2408 76.294 111.262 81.222 1.00 0.00 O ATOM 79310 H1 WAT 2408 76.992 110.619 81.102 1.00 0.00 H ATOM 79311 H2 WAT 2408 75.901 111.353 80.354 1.00 0.00 H TER 79313 WAT 2408 ATOM 79313 O WAT 2409 43.437 128.208 100.252 1.00 0.00 O ATOM 79314 H1 WAT 2409 43.416 128.999 100.792 1.00 0.00 H ATOM 79315 H2 WAT 2409 44.233 127.753 100.526 1.00 0.00 H TER 79317 WAT 2409 ATOM 79317 O WAT 2410 77.867 32.961 68.994 1.00 0.00 O ATOM 79318 H1 WAT 2410 77.178 33.472 68.568 1.00 0.00 H ATOM 79319 H2 WAT 2410 78.428 32.670 68.275 1.00 0.00 H TER 79321 WAT 2410 ATOM 79321 O WAT 2411 9.549 121.635 148.157 1.00 0.00 O ATOM 79322 H1 WAT 2411 9.515 122.580 148.308 1.00 0.00 H ATOM 79323 H2 WAT 2411 9.212 121.522 147.269 1.00 0.00 H TER 79325 WAT 2411 ATOM 79325 O WAT 2412 8.684 133.732 100.899 1.00 0.00 O ATOM 79326 H1 WAT 2412 8.480 134.666 100.931 1.00 0.00 H ATOM 79327 H2 WAT 2412 9.197 133.626 100.098 1.00 0.00 H TER 79329 WAT 2412 ATOM 79329 O WAT 2413 86.629 63.429 84.715 1.00 0.00 O ATOM 79330 H1 WAT 2413 87.347 63.889 85.150 1.00 0.00 H ATOM 79331 H2 WAT 2413 85.841 63.894 84.996 1.00 0.00 H TER 79333 WAT 2413 ATOM 79333 O WAT 2414 135.437 67.947 65.724 1.00 0.00 O ATOM 79334 H1 WAT 2414 135.096 67.079 65.939 1.00 0.00 H ATOM 79335 H2 WAT 2414 135.027 68.164 64.886 1.00 0.00 H TER 79337 WAT 2414 ATOM 79337 O WAT 2415 122.923 24.840 74.017 1.00 0.00 O ATOM 79338 H1 WAT 2415 122.047 24.463 74.093 1.00 0.00 H ATOM 79339 H2 WAT 2415 123.511 24.085 74.027 1.00 0.00 H TER 79341 WAT 2415 ATOM 79341 O WAT 2416 20.265 126.346 149.666 1.00 0.00 O ATOM 79342 H1 WAT 2416 19.861 125.604 150.116 1.00 0.00 H ATOM 79343 H2 WAT 2416 21.032 126.559 150.198 1.00 0.00 H TER 79345 WAT 2416 ATOM 79345 O WAT 2417 23.113 60.111 1.788 1.00 0.00 O ATOM 79346 H1 WAT 2417 22.446 60.761 2.011 1.00 0.00 H ATOM 79347 H2 WAT 2417 22.918 59.364 2.353 1.00 0.00 H TER 79349 WAT 2417 ATOM 79349 O WAT 2418 114.212 24.776 127.315 1.00 0.00 O ATOM 79350 H1 WAT 2418 114.227 24.022 127.905 1.00 0.00 H ATOM 79351 H2 WAT 2418 115.079 25.171 127.409 1.00 0.00 H TER 79353 WAT 2418 ATOM 79353 O WAT 2419 3.870 5.285 151.762 1.00 0.00 O ATOM 79354 H1 WAT 2419 4.511 4.951 151.134 1.00 0.00 H ATOM 79355 H2 WAT 2419 3.678 4.537 152.328 1.00 0.00 H TER 79357 WAT 2419 ATOM 79357 O WAT 2420 104.217 99.012 24.429 1.00 0.00 O ATOM 79358 H1 WAT 2420 105.026 98.502 24.395 1.00 0.00 H ATOM 79359 H2 WAT 2420 103.618 98.476 24.949 1.00 0.00 H TER 79361 WAT 2420 ATOM 79361 O WAT 2421 110.781 58.660 102.153 1.00 0.00 O ATOM 79362 H1 WAT 2421 111.356 58.140 102.714 1.00 0.00 H ATOM 79363 H2 WAT 2421 110.716 59.506 102.597 1.00 0.00 H TER 79365 WAT 2421 ATOM 79365 O WAT 2422 22.030 119.292 26.307 1.00 0.00 O ATOM 79366 H1 WAT 2422 21.158 119.440 26.671 1.00 0.00 H ATOM 79367 H2 WAT 2422 21.880 119.157 25.371 1.00 0.00 H TER 79369 WAT 2422 ATOM 79369 O WAT 2423 7.872 38.572 65.173 1.00 0.00 O ATOM 79370 H1 WAT 2423 8.474 38.825 64.473 1.00 0.00 H ATOM 79371 H2 WAT 2423 8.183 37.713 65.457 1.00 0.00 H TER 79373 WAT 2423 ATOM 79373 O WAT 2424 132.881 40.365 127.530 1.00 0.00 O ATOM 79374 H1 WAT 2424 133.083 40.889 126.755 1.00 0.00 H ATOM 79375 H2 WAT 2424 133.535 39.666 127.524 1.00 0.00 H TER 79377 WAT 2424 ATOM 79377 O WAT 2425 83.249 106.799 149.194 1.00 0.00 O ATOM 79378 H1 WAT 2425 83.025 107.201 150.034 1.00 0.00 H ATOM 79379 H2 WAT 2425 84.203 106.855 149.148 1.00 0.00 H TER 79381 WAT 2425 ATOM 79381 O WAT 2426 95.858 104.650 147.390 1.00 0.00 O ATOM 79382 H1 WAT 2426 95.889 104.670 148.346 1.00 0.00 H ATOM 79383 H2 WAT 2426 95.202 105.307 147.158 1.00 0.00 H TER 79385 WAT 2426 ATOM 79385 O WAT 2427 89.652 27.738 79.021 1.00 0.00 O ATOM 79386 H1 WAT 2427 88.767 27.826 79.373 1.00 0.00 H ATOM 79387 H2 WAT 2427 89.965 26.902 79.366 1.00 0.00 H TER 79389 WAT 2427 ATOM 79389 O WAT 2428 19.726 123.880 151.432 1.00 0.00 O ATOM 79390 H1 WAT 2428 19.529 122.947 151.521 1.00 0.00 H ATOM 79391 H2 WAT 2428 20.680 123.919 151.379 1.00 0.00 H TER 79393 WAT 2428 ATOM 79393 O WAT 2429 141.216 102.443 132.536 1.00 0.00 O ATOM 79394 H1 WAT 2429 140.650 101.675 132.461 1.00 0.00 H ATOM 79395 H2 WAT 2429 140.745 103.134 132.070 1.00 0.00 H TER 79397 WAT 2429 ATOM 79397 O WAT 2430 38.435 70.929 144.344 1.00 0.00 O ATOM 79398 H1 WAT 2430 39.211 71.196 143.852 1.00 0.00 H ATOM 79399 H2 WAT 2430 38.365 69.987 144.188 1.00 0.00 H TER 79401 WAT 2430 ATOM 79401 O WAT 2431 99.797 35.765 99.721 1.00 0.00 O ATOM 79402 H1 WAT 2431 98.841 35.791 99.751 1.00 0.00 H ATOM 79403 H2 WAT 2431 100.009 35.835 98.790 1.00 0.00 H TER 79405 WAT 2431 ATOM 79405 O WAT 2432 33.364 26.201 117.809 1.00 0.00 O ATOM 79406 H1 WAT 2432 33.710 26.641 117.032 1.00 0.00 H ATOM 79407 H2 WAT 2432 33.309 26.891 118.470 1.00 0.00 H TER 79409 WAT 2432 ATOM 79409 O WAT 2433 59.165 38.035 59.115 1.00 0.00 O ATOM 79410 H1 WAT 2433 58.415 38.555 59.402 1.00 0.00 H ATOM 79411 H2 WAT 2433 58.779 37.234 58.760 1.00 0.00 H TER 79413 WAT 2433 ATOM 79413 O WAT 2434 34.340 74.113 120.745 1.00 0.00 O ATOM 79414 H1 WAT 2434 34.536 75.013 120.484 1.00 0.00 H ATOM 79415 H2 WAT 2434 33.476 73.938 120.371 1.00 0.00 H TER 79417 WAT 2434 ATOM 79417 O WAT 2435 27.562 34.343 56.588 1.00 0.00 O ATOM 79418 H1 WAT 2435 26.701 34.087 56.257 1.00 0.00 H ATOM 79419 H2 WAT 2435 27.974 33.518 56.845 1.00 0.00 H TER 79421 WAT 2435 ATOM 79421 O WAT 2436 53.951 48.482 101.895 1.00 0.00 O ATOM 79422 H1 WAT 2436 53.018 48.692 101.870 1.00 0.00 H ATOM 79423 H2 WAT 2436 54.029 47.675 101.387 1.00 0.00 H TER 79425 WAT 2436 ATOM 79425 O WAT 2437 115.959 48.518 25.529 1.00 0.00 O ATOM 79426 H1 WAT 2437 116.245 49.431 25.501 1.00 0.00 H ATOM 79427 H2 WAT 2437 115.461 48.448 26.343 1.00 0.00 H TER 79429 WAT 2437 ATOM 79429 O WAT 2438 25.324 95.913 120.356 1.00 0.00 O ATOM 79430 H1 WAT 2438 24.933 96.221 119.538 1.00 0.00 H ATOM 79431 H2 WAT 2438 26.184 95.581 120.100 1.00 0.00 H TER 79433 WAT 2438 ATOM 79433 O WAT 2439 78.220 30.702 60.188 1.00 0.00 O ATOM 79434 H1 WAT 2439 77.606 29.970 60.129 1.00 0.00 H ATOM 79435 H2 WAT 2439 78.717 30.665 59.371 1.00 0.00 H TER 79437 WAT 2439 ATOM 79437 O WAT 2440 9.792 41.706 105.019 1.00 0.00 O ATOM 79438 H1 WAT 2440 9.790 42.657 105.129 1.00 0.00 H ATOM 79439 H2 WAT 2440 8.905 41.498 104.725 1.00 0.00 H TER 79441 WAT 2440 ATOM 79441 O WAT 2441 62.017 0.901 112.243 1.00 0.00 O ATOM 79442 H1 WAT 2441 62.879 1.279 112.420 1.00 0.00 H ATOM 79443 H2 WAT 2441 61.398 1.587 112.494 1.00 0.00 H TER 79445 WAT 2441 ATOM 79445 O WAT 2442 29.162 144.126 122.125 1.00 0.00 O ATOM 79446 H1 WAT 2442 29.026 145.054 122.317 1.00 0.00 H ATOM 79447 H2 WAT 2442 29.438 144.108 121.209 1.00 0.00 H TER 79449 WAT 2442 ATOM 79449 O WAT 2443 89.180 108.529 136.491 1.00 0.00 O ATOM 79450 H1 WAT 2443 88.459 107.932 136.688 1.00 0.00 H ATOM 79451 H2 WAT 2443 88.989 108.853 135.610 1.00 0.00 H TER 79453 WAT 2443 ATOM 79453 O WAT 2444 21.055 39.012 116.797 1.00 0.00 O ATOM 79454 H1 WAT 2444 20.919 38.316 117.440 1.00 0.00 H ATOM 79455 H2 WAT 2444 20.367 39.650 116.985 1.00 0.00 H TER 79457 WAT 2444 ATOM 79457 O WAT 2445 135.173 88.758 135.753 1.00 0.00 O ATOM 79458 H1 WAT 2445 134.331 88.528 136.146 1.00 0.00 H ATOM 79459 H2 WAT 2445 135.027 89.621 135.365 1.00 0.00 H TER 79461 WAT 2445 ATOM 79461 O WAT 2446 12.643 63.805 57.100 1.00 0.00 O ATOM 79462 H1 WAT 2446 12.141 64.610 57.227 1.00 0.00 H ATOM 79463 H2 WAT 2446 13.557 64.086 57.131 1.00 0.00 H TER 79465 WAT 2446 ATOM 79465 O WAT 2447 49.469 45.461 116.232 1.00 0.00 O ATOM 79466 H1 WAT 2447 49.971 46.107 116.729 1.00 0.00 H ATOM 79467 H2 WAT 2447 48.588 45.504 116.603 1.00 0.00 H TER 79469 WAT 2447 ATOM 79469 O WAT 2448 7.523 70.226 97.356 1.00 0.00 O ATOM 79470 H1 WAT 2448 6.644 69.983 97.067 1.00 0.00 H ATOM 79471 H2 WAT 2448 7.483 70.174 98.311 1.00 0.00 H TER 79473 WAT 2448 ATOM 79473 O WAT 2449 34.363 129.959 95.509 1.00 0.00 O ATOM 79474 H1 WAT 2449 34.163 130.639 94.866 1.00 0.00 H ATOM 79475 H2 WAT 2449 33.922 129.177 95.177 1.00 0.00 H TER 79477 WAT 2449 ATOM 79477 O WAT 2450 143.262 111.868 118.481 1.00 0.00 O ATOM 79478 H1 WAT 2450 143.389 111.018 118.062 1.00 0.00 H ATOM 79479 H2 WAT 2450 142.364 112.113 118.259 1.00 0.00 H TER 79481 WAT 2450 ATOM 79481 O WAT 2451 115.307 52.606 150.699 1.00 0.00 O ATOM 79482 H1 WAT 2451 114.856 52.958 149.932 1.00 0.00 H ATOM 79483 H2 WAT 2451 115.566 51.721 150.440 1.00 0.00 H TER 79485 WAT 2451 ATOM 79485 O WAT 2452 65.746 25.626 128.749 1.00 0.00 O ATOM 79486 H1 WAT 2452 66.487 25.182 128.336 1.00 0.00 H ATOM 79487 H2 WAT 2452 65.572 26.378 128.184 1.00 0.00 H TER 79489 WAT 2452 ATOM 79489 O WAT 2453 139.937 51.027 83.229 1.00 0.00 O ATOM 79490 H1 WAT 2453 140.451 50.660 83.948 1.00 0.00 H ATOM 79491 H2 WAT 2453 139.228 50.398 83.096 1.00 0.00 H TER 79493 WAT 2453 ATOM 79493 O WAT 2454 54.538 82.557 114.303 1.00 0.00 O ATOM 79494 H1 WAT 2454 54.187 83.385 113.976 1.00 0.00 H ATOM 79495 H2 WAT 2454 55.460 82.741 114.480 1.00 0.00 H TER 79497 WAT 2454 ATOM 79497 O WAT 2455 82.704 143.497 98.409 1.00 0.00 O ATOM 79498 H1 WAT 2455 83.091 144.053 99.085 1.00 0.00 H ATOM 79499 H2 WAT 2455 82.011 144.034 98.025 1.00 0.00 H TER 79501 WAT 2455 ATOM 79501 O WAT 2456 118.166 73.181 109.905 1.00 0.00 O ATOM 79502 H1 WAT 2456 118.245 72.357 110.386 1.00 0.00 H ATOM 79503 H2 WAT 2456 117.589 73.720 110.446 1.00 0.00 H TER 79505 WAT 2456 ATOM 79505 O WAT 2457 103.259 43.144 84.785 1.00 0.00 O ATOM 79506 H1 WAT 2457 102.313 43.214 84.912 1.00 0.00 H ATOM 79507 H2 WAT 2457 103.528 42.439 85.374 1.00 0.00 H TER 79509 WAT 2457 ATOM 79509 O WAT 2458 29.557 49.688 113.583 1.00 0.00 O ATOM 79510 H1 WAT 2458 29.639 49.897 114.513 1.00 0.00 H ATOM 79511 H2 WAT 2458 30.290 49.099 113.403 1.00 0.00 H TER 79513 WAT 2458 ATOM 79513 O WAT 2459 120.561 62.130 7.505 1.00 0.00 O ATOM 79514 H1 WAT 2459 120.379 63.016 7.193 1.00 0.00 H ATOM 79515 H2 WAT 2459 119.792 61.897 8.025 1.00 0.00 H TER 79517 WAT 2459 ATOM 79517 O WAT 2460 72.165 26.842 158.503 1.00 0.00 O ATOM 79518 H1 WAT 2460 72.515 26.970 159.384 1.00 0.00 H ATOM 79519 H2 WAT 2460 72.679 27.434 157.953 1.00 0.00 H TER 79521 WAT 2460 ATOM 79521 O WAT 2461 71.237 42.890 101.924 1.00 0.00 O ATOM 79522 H1 WAT 2461 70.767 42.643 102.720 1.00 0.00 H ATOM 79523 H2 WAT 2461 72.160 42.749 102.136 1.00 0.00 H TER 79525 WAT 2461 ATOM 79525 O WAT 2462 57.875 22.922 12.301 1.00 0.00 O ATOM 79526 H1 WAT 2462 58.567 23.137 11.676 1.00 0.00 H ATOM 79527 H2 WAT 2462 57.187 23.564 12.127 1.00 0.00 H TER 79529 WAT 2462 ATOM 79529 O WAT 2463 123.378 44.563 110.068 1.00 0.00 O ATOM 79530 H1 WAT 2463 123.184 44.024 109.301 1.00 0.00 H ATOM 79531 H2 WAT 2463 122.819 44.206 110.759 1.00 0.00 H TER 79533 WAT 2463 ATOM 79533 O WAT 2464 121.373 53.822 140.911 1.00 0.00 O ATOM 79534 H1 WAT 2464 122.125 53.638 141.475 1.00 0.00 H ATOM 79535 H2 WAT 2464 120.923 54.549 141.343 1.00 0.00 H TER 79537 WAT 2464 ATOM 79537 O WAT 2465 116.113 93.597 63.384 1.00 0.00 O ATOM 79538 H1 WAT 2465 115.368 93.272 62.879 1.00 0.00 H ATOM 79539 H2 WAT 2465 116.753 92.886 63.352 1.00 0.00 H TER 79541 WAT 2465 ATOM 79541 O WAT 2466 17.678 6.198 85.934 1.00 0.00 O ATOM 79542 H1 WAT 2466 16.988 5.927 86.539 1.00 0.00 H ATOM 79543 H2 WAT 2466 17.306 6.050 85.065 1.00 0.00 H TER 79545 WAT 2466 ATOM 79545 O WAT 2467 79.563 133.603 141.649 1.00 0.00 O ATOM 79546 H1 WAT 2467 79.359 134.538 141.627 1.00 0.00 H ATOM 79547 H2 WAT 2467 80.046 133.482 142.466 1.00 0.00 H TER 79549 WAT 2467 ATOM 79549 O WAT 2468 21.373 30.093 155.795 1.00 0.00 O ATOM 79550 H1 WAT 2468 21.387 29.234 156.219 1.00 0.00 H ATOM 79551 H2 WAT 2468 22.049 30.038 155.121 1.00 0.00 H TER 79553 WAT 2468 ATOM 79553 O WAT 2469 76.750 86.277 151.901 1.00 0.00 O ATOM 79554 H1 WAT 2469 76.794 86.153 152.849 1.00 0.00 H ATOM 79555 H2 WAT 2469 77.035 85.439 151.537 1.00 0.00 H TER 79557 WAT 2469 ATOM 79557 O WAT 2470 118.724 106.008 85.009 1.00 0.00 O ATOM 79558 H1 WAT 2470 117.840 106.159 85.344 1.00 0.00 H ATOM 79559 H2 WAT 2470 118.855 106.698 84.359 1.00 0.00 H TER 79561 WAT 2470 ATOM 79561 O WAT 2471 16.288 113.828 73.545 1.00 0.00 O ATOM 79562 H1 WAT 2471 15.343 113.924 73.663 1.00 0.00 H ATOM 79563 H2 WAT 2471 16.514 114.477 72.878 1.00 0.00 H TER 79565 WAT 2471 ATOM 79565 O WAT 2472 136.827 8.317 156.161 1.00 0.00 O ATOM 79566 H1 WAT 2472 136.517 8.688 156.987 1.00 0.00 H ATOM 79567 H2 WAT 2472 136.405 8.849 155.486 1.00 0.00 H TER 79569 WAT 2472 ATOM 79569 O WAT 2473 23.034 48.347 12.919 1.00 0.00 O ATOM 79570 H1 WAT 2473 23.346 49.190 13.249 1.00 0.00 H ATOM 79571 H2 WAT 2473 23.064 47.766 13.680 1.00 0.00 H TER 79573 WAT 2473 ATOM 79573 O WAT 2474 71.718 91.701 150.926 1.00 0.00 O ATOM 79574 H1 WAT 2474 71.622 90.897 150.415 1.00 0.00 H ATOM 79575 H2 WAT 2474 71.133 91.580 151.674 1.00 0.00 H TER 79577 WAT 2474 ATOM 79577 O WAT 2475 43.087 33.178 66.193 1.00 0.00 O ATOM 79578 H1 WAT 2475 43.551 33.863 66.674 1.00 0.00 H ATOM 79579 H2 WAT 2475 42.788 32.570 66.869 1.00 0.00 H TER 79581 WAT 2475 ATOM 79581 O WAT 2476 40.594 100.732 119.436 1.00 0.00 O ATOM 79582 H1 WAT 2476 41.286 101.270 119.819 1.00 0.00 H ATOM 79583 H2 WAT 2476 41.050 100.158 118.820 1.00 0.00 H TER 79585 WAT 2476 ATOM 79585 O WAT 2477 132.820 56.320 144.141 1.00 0.00 O ATOM 79586 H1 WAT 2477 131.988 56.627 143.779 1.00 0.00 H ATOM 79587 H2 WAT 2477 132.680 55.388 144.306 1.00 0.00 H TER 79589 WAT 2477 ATOM 79589 O WAT 2478 1.942 68.329 138.994 1.00 0.00 O ATOM 79590 H1 WAT 2478 1.269 67.683 139.208 1.00 0.00 H ATOM 79591 H2 WAT 2478 2.438 67.931 138.279 1.00 0.00 H TER 79593 WAT 2478 ATOM 79593 O WAT 2479 29.614 26.478 111.305 1.00 0.00 O ATOM 79594 H1 WAT 2479 29.182 25.652 111.522 1.00 0.00 H ATOM 79595 H2 WAT 2479 30.548 26.292 111.401 1.00 0.00 H TER 79597 WAT 2479 ATOM 79597 O WAT 2480 92.777 97.819 70.522 1.00 0.00 O ATOM 79598 H1 WAT 2480 93.492 97.187 70.449 1.00 0.00 H ATOM 79599 H2 WAT 2480 92.917 98.243 71.368 1.00 0.00 H TER 79601 WAT 2480 ATOM 79601 O WAT 2481 118.077 134.128 146.381 1.00 0.00 O ATOM 79602 H1 WAT 2481 117.460 133.427 146.594 1.00 0.00 H ATOM 79603 H2 WAT 2481 118.321 133.963 145.470 1.00 0.00 H TER 79605 WAT 2481 ATOM 79605 O WAT 2482 64.824 4.176 86.983 1.00 0.00 O ATOM 79606 H1 WAT 2482 64.252 3.500 86.619 1.00 0.00 H ATOM 79607 H2 WAT 2482 65.325 4.495 86.233 1.00 0.00 H TER 79609 WAT 2482 ATOM 79609 O WAT 2483 43.861 101.274 145.634 1.00 0.00 O ATOM 79610 H1 WAT 2483 43.513 101.749 144.879 1.00 0.00 H ATOM 79611 H2 WAT 2483 43.124 100.747 145.944 1.00 0.00 H TER 79613 WAT 2483 ATOM 79613 O WAT 2484 86.595 103.638 103.408 1.00 0.00 O ATOM 79614 H1 WAT 2484 86.152 104.254 102.824 1.00 0.00 H ATOM 79615 H2 WAT 2484 87.303 104.148 103.802 1.00 0.00 H TER 79617 WAT 2484 ATOM 79617 O WAT 2485 51.219 12.154 104.324 1.00 0.00 O ATOM 79618 H1 WAT 2485 52.003 11.929 103.823 1.00 0.00 H ATOM 79619 H2 WAT 2485 51.168 13.108 104.274 1.00 0.00 H TER 79621 WAT 2485 ATOM 79621 O WAT 2486 25.364 94.190 65.733 1.00 0.00 O ATOM 79622 H1 WAT 2486 25.773 93.347 65.538 1.00 0.00 H ATOM 79623 H2 WAT 2486 26.089 94.815 65.729 1.00 0.00 H TER 79625 WAT 2486 ATOM 79625 O WAT 2487 60.332 20.226 12.900 1.00 0.00 O ATOM 79626 H1 WAT 2487 60.138 19.310 13.100 1.00 0.00 H ATOM 79627 H2 WAT 2487 59.848 20.723 13.559 1.00 0.00 H TER 79629 WAT 2487 ATOM 79629 O WAT 2488 60.751 67.272 63.342 1.00 0.00 O ATOM 79630 H1 WAT 2488 60.398 67.793 64.063 1.00 0.00 H ATOM 79631 H2 WAT 2488 60.452 67.723 62.552 1.00 0.00 H TER 79633 WAT 2488 ATOM 79633 O WAT 2489 49.835 52.478 116.386 1.00 0.00 O ATOM 79634 H1 WAT 2489 49.572 51.653 116.793 1.00 0.00 H ATOM 79635 H2 WAT 2489 49.010 52.897 116.141 1.00 0.00 H TER 79637 WAT 2489 ATOM 79637 O WAT 2490 84.590 22.366 105.516 1.00 0.00 O ATOM 79638 H1 WAT 2490 85.135 22.765 104.838 1.00 0.00 H ATOM 79639 H2 WAT 2490 85.155 22.333 106.288 1.00 0.00 H TER 79641 WAT 2490 ATOM 79641 O WAT 2491 128.183 121.559 109.228 1.00 0.00 O ATOM 79642 H1 WAT 2491 128.011 121.543 110.170 1.00 0.00 H ATOM 79643 H2 WAT 2491 128.978 121.037 109.122 1.00 0.00 H TER 79645 WAT 2491 ATOM 79645 O WAT 2492 116.326 139.426 110.473 1.00 0.00 O ATOM 79646 H1 WAT 2492 116.447 138.591 110.926 1.00 0.00 H ATOM 79647 H2 WAT 2492 117.188 139.841 110.503 1.00 0.00 H TER 79649 WAT 2492 ATOM 79649 O WAT 2493 6.337 2.073 2.008 1.00 0.00 O ATOM 79650 H1 WAT 2493 5.530 2.557 2.185 1.00 0.00 H ATOM 79651 H2 WAT 2493 6.879 2.220 2.782 1.00 0.00 H TER 79653 WAT 2493 ATOM 79653 O WAT 2494 115.579 65.605 127.451 1.00 0.00 O ATOM 79654 H1 WAT 2494 114.869 66.156 127.121 1.00 0.00 H ATOM 79655 H2 WAT 2494 115.986 66.127 128.142 1.00 0.00 H TER 79657 WAT 2494 ATOM 79657 O WAT 2495 34.294 24.709 75.195 1.00 0.00 O ATOM 79658 H1 WAT 2495 35.096 24.883 74.703 1.00 0.00 H ATOM 79659 H2 WAT 2495 33.627 25.240 74.760 1.00 0.00 H TER 79661 WAT 2495 ATOM 79661 O WAT 2496 93.190 96.100 111.688 1.00 0.00 O ATOM 79662 H1 WAT 2496 93.408 95.430 111.039 1.00 0.00 H ATOM 79663 H2 WAT 2496 92.287 95.904 111.939 1.00 0.00 H TER 79665 WAT 2496 ATOM 79665 O WAT 2497 86.878 141.028 124.170 1.00 0.00 O ATOM 79666 H1 WAT 2497 86.281 141.150 123.432 1.00 0.00 H ATOM 79667 H2 WAT 2497 86.817 140.095 124.376 1.00 0.00 H TER 79669 WAT 2497 ATOM 79669 O WAT 2498 110.020 52.532 105.506 1.00 0.00 O ATOM 79670 H1 WAT 2498 109.092 52.764 105.527 1.00 0.00 H ATOM 79671 H2 WAT 2498 110.462 53.268 105.929 1.00 0.00 H TER 79673 WAT 2498 ATOM 79673 O WAT 2499 141.611 20.281 59.459 1.00 0.00 O ATOM 79674 H1 WAT 2499 140.661 20.400 59.481 1.00 0.00 H ATOM 79675 H2 WAT 2499 141.965 21.126 59.735 1.00 0.00 H TER 79677 WAT 2499 ATOM 79677 O WAT 2500 74.141 138.566 87.372 1.00 0.00 O ATOM 79678 H1 WAT 2500 74.694 137.786 87.425 1.00 0.00 H ATOM 79679 H2 WAT 2500 74.759 139.293 87.295 1.00 0.00 H TER 79681 WAT 2500 ATOM 79681 O WAT 2501 68.824 96.796 61.939 1.00 0.00 O ATOM 79682 H1 WAT 2501 69.324 96.518 61.172 1.00 0.00 H ATOM 79683 H2 WAT 2501 68.145 96.128 62.038 1.00 0.00 H TER 79685 WAT 2501 ATOM 79685 O WAT 2502 33.731 9.025 143.696 1.00 0.00 O ATOM 79686 H1 WAT 2502 33.760 8.772 144.618 1.00 0.00 H ATOM 79687 H2 WAT 2502 34.590 9.412 143.526 1.00 0.00 H TER 79689 WAT 2502 ATOM 79689 O WAT 2503 25.602 127.050 97.942 1.00 0.00 O ATOM 79690 H1 WAT 2503 26.301 126.423 98.126 1.00 0.00 H ATOM 79691 H2 WAT 2503 25.070 126.625 97.269 1.00 0.00 H TER 79693 WAT 2503 ATOM 79693 O WAT 2504 90.665 69.859 133.476 1.00 0.00 O ATOM 79694 H1 WAT 2504 90.915 70.782 133.531 1.00 0.00 H ATOM 79695 H2 WAT 2504 91.447 69.419 133.143 1.00 0.00 H TER 79697 WAT 2504 ATOM 79697 O WAT 2505 30.584 1.932 12.583 1.00 0.00 O ATOM 79698 H1 WAT 2505 30.380 2.442 13.367 1.00 0.00 H ATOM 79699 H2 WAT 2505 29.804 2.013 12.035 1.00 0.00 H TER 79701 WAT 2505 ATOM 79701 O WAT 2506 36.815 60.653 3.714 1.00 0.00 O ATOM 79702 H1 WAT 2506 37.604 61.082 4.047 1.00 0.00 H ATOM 79703 H2 WAT 2506 36.759 60.932 2.800 1.00 0.00 H TER 79705 WAT 2506 ATOM 79705 O WAT 2507 55.383 80.008 68.045 1.00 0.00 O ATOM 79706 H1 WAT 2507 54.464 79.898 68.286 1.00 0.00 H ATOM 79707 H2 WAT 2507 55.440 80.907 67.721 1.00 0.00 H TER 79709 WAT 2507 ATOM 79709 O WAT 2508 37.308 143.884 127.161 1.00 0.00 O ATOM 79710 H1 WAT 2508 37.934 144.606 127.231 1.00 0.00 H ATOM 79711 H2 WAT 2508 36.966 143.777 128.049 1.00 0.00 H TER 79713 WAT 2508 ATOM 79713 O WAT 2509 21.462 84.965 130.109 1.00 0.00 O ATOM 79714 H1 WAT 2509 21.363 85.854 129.768 1.00 0.00 H ATOM 79715 H2 WAT 2509 20.749 84.869 130.740 1.00 0.00 H TER 79717 WAT 2509 ATOM 79717 O WAT 2510 57.416 113.180 2.079 1.00 0.00 O ATOM 79718 H1 WAT 2510 56.512 113.016 1.808 1.00 0.00 H ATOM 79719 H2 WAT 2510 57.534 114.122 1.960 1.00 0.00 H TER 79721 WAT 2510 ATOM 79721 O WAT 2511 102.212 19.691 18.831 1.00 0.00 O ATOM 79722 H1 WAT 2511 102.834 20.245 18.359 1.00 0.00 H ATOM 79723 H2 WAT 2511 102.540 19.675 19.730 1.00 0.00 H TER 79725 WAT 2511 ATOM 79725 O WAT 2512 139.424 94.978 66.440 1.00 0.00 O ATOM 79726 H1 WAT 2512 139.998 95.568 65.952 1.00 0.00 H ATOM 79727 H2 WAT 2512 139.827 94.913 67.306 1.00 0.00 H TER 79729 WAT 2512 ATOM 79729 O WAT 2513 87.626 27.627 122.528 1.00 0.00 O ATOM 79730 H1 WAT 2513 86.677 27.613 122.652 1.00 0.00 H ATOM 79731 H2 WAT 2513 87.984 27.507 123.408 1.00 0.00 H TER 79733 WAT 2513 ATOM 79733 O WAT 2514 24.764 42.949 63.439 1.00 0.00 O ATOM 79734 H1 WAT 2514 25.014 42.421 64.198 1.00 0.00 H ATOM 79735 H2 WAT 2514 25.254 42.567 62.710 1.00 0.00 H TER 79737 WAT 2514 ATOM 79737 O WAT 2515 81.459 51.467 62.268 1.00 0.00 O ATOM 79738 H1 WAT 2515 80.773 51.987 62.687 1.00 0.00 H ATOM 79739 H2 WAT 2515 81.096 50.582 62.228 1.00 0.00 H TER 79741 WAT 2515 ATOM 79741 O WAT 2516 102.673 80.097 122.143 1.00 0.00 O ATOM 79742 H1 WAT 2516 101.861 80.601 122.196 1.00 0.00 H ATOM 79743 H2 WAT 2516 103.365 80.740 122.298 1.00 0.00 H TER 79745 WAT 2516 ATOM 79745 O WAT 2517 52.631 61.545 112.172 1.00 0.00 O ATOM 79746 H1 WAT 2517 52.968 62.218 111.580 1.00 0.00 H ATOM 79747 H2 WAT 2517 52.746 61.916 113.047 1.00 0.00 H TER 79749 WAT 2517 ATOM 79749 O WAT 2518 34.948 65.600 125.125 1.00 0.00 O ATOM 79750 H1 WAT 2518 35.256 65.315 125.985 1.00 0.00 H ATOM 79751 H2 WAT 2518 35.382 66.441 124.982 1.00 0.00 H TER 79753 WAT 2518 ATOM 79753 O WAT 2519 91.583 140.364 80.030 1.00 0.00 O ATOM 79754 H1 WAT 2519 91.477 140.850 79.213 1.00 0.00 H ATOM 79755 H2 WAT 2519 90.947 139.652 79.970 1.00 0.00 H TER 79757 WAT 2519 ATOM 79757 O WAT 2520 70.671 71.861 128.627 1.00 0.00 O ATOM 79758 H1 WAT 2520 71.416 72.456 128.540 1.00 0.00 H ATOM 79759 H2 WAT 2520 71.065 70.990 128.683 1.00 0.00 H TER 79761 WAT 2520 ATOM 79761 O WAT 2521 121.172 112.033 133.735 1.00 0.00 O ATOM 79762 H1 WAT 2521 121.391 112.323 134.621 1.00 0.00 H ATOM 79763 H2 WAT 2521 121.718 111.259 133.595 1.00 0.00 H TER 79765 WAT 2521 ATOM 79765 O WAT 2522 132.195 51.674 125.514 1.00 0.00 O ATOM 79766 H1 WAT 2522 131.843 51.609 124.626 1.00 0.00 H ATOM 79767 H2 WAT 2522 132.704 50.871 125.629 1.00 0.00 H TER 79769 WAT 2522 ATOM 79769 O WAT 2523 57.820 30.136 76.915 1.00 0.00 O ATOM 79770 H1 WAT 2523 57.471 30.511 77.724 1.00 0.00 H ATOM 79771 H2 WAT 2523 58.673 30.557 76.804 1.00 0.00 H TER 79773 WAT 2523 ATOM 79773 O WAT 2524 26.574 14.353 116.883 1.00 0.00 O ATOM 79774 H1 WAT 2524 27.335 14.904 117.069 1.00 0.00 H ATOM 79775 H2 WAT 2524 26.122 14.804 116.170 1.00 0.00 H TER 79777 WAT 2524 ATOM 79777 O WAT 2525 47.056 140.195 18.479 1.00 0.00 O ATOM 79778 H1 WAT 2525 46.588 140.962 18.808 1.00 0.00 H ATOM 79779 H2 WAT 2525 46.365 139.587 18.217 1.00 0.00 H TER 79781 WAT 2525 ATOM 79781 O WAT 2526 18.421 6.512 107.145 1.00 0.00 O ATOM 79782 H1 WAT 2526 18.521 7.377 106.747 1.00 0.00 H ATOM 79783 H2 WAT 2526 17.567 6.545 107.577 1.00 0.00 H TER 79785 WAT 2526 ATOM 79785 O WAT 2527 83.766 55.265 132.158 1.00 0.00 O ATOM 79786 H1 WAT 2527 83.186 55.113 131.412 1.00 0.00 H ATOM 79787 H2 WAT 2527 83.984 56.195 132.106 1.00 0.00 H TER 79789 WAT 2527 ATOM 79789 O WAT 2528 74.829 116.909 71.024 1.00 0.00 O ATOM 79790 H1 WAT 2528 73.925 117.185 71.175 1.00 0.00 H ATOM 79791 H2 WAT 2528 75.322 117.295 71.748 1.00 0.00 H TER 79793 WAT 2528 ATOM 79793 O WAT 2529 4.883 110.771 20.175 1.00 0.00 O ATOM 79794 H1 WAT 2529 5.785 110.956 19.913 1.00 0.00 H ATOM 79795 H2 WAT 2529 4.667 111.465 20.797 1.00 0.00 H TER 79797 WAT 2529 ATOM 79797 O WAT 2530 51.016 20.205 87.300 1.00 0.00 O ATOM 79798 H1 WAT 2530 50.117 19.883 87.238 1.00 0.00 H ATOM 79799 H2 WAT 2530 50.929 21.092 87.651 1.00 0.00 H TER 79801 WAT 2530 ATOM 79801 O WAT 2531 79.671 44.281 108.113 1.00 0.00 O ATOM 79802 H1 WAT 2531 78.910 44.414 108.678 1.00 0.00 H ATOM 79803 H2 WAT 2531 79.785 43.331 108.083 1.00 0.00 H TER 79805 WAT 2531 ATOM 79805 O WAT 2532 27.965 42.823 129.274 1.00 0.00 O ATOM 79806 H1 WAT 2532 28.458 42.496 128.520 1.00 0.00 H ATOM 79807 H2 WAT 2532 28.546 42.677 130.020 1.00 0.00 H TER 79809 WAT 2532 ATOM 79809 O WAT 2533 64.880 139.644 121.509 1.00 0.00 O ATOM 79810 H1 WAT 2533 65.759 139.969 121.704 1.00 0.00 H ATOM 79811 H2 WAT 2533 64.981 139.153 120.694 1.00 0.00 H TER 79813 WAT 2533 ATOM 79813 O WAT 2534 110.633 126.183 26.256 1.00 0.00 O ATOM 79814 H1 WAT 2534 110.800 125.566 26.969 1.00 0.00 H ATOM 79815 H2 WAT 2534 109.680 126.184 26.158 1.00 0.00 H TER 79817 WAT 2534 ATOM 79817 O WAT 2535 124.358 111.941 97.358 1.00 0.00 O ATOM 79818 H1 WAT 2535 124.921 111.170 97.422 1.00 0.00 H ATOM 79819 H2 WAT 2535 124.933 112.676 97.569 1.00 0.00 H TER 79821 WAT 2535 ATOM 79821 O WAT 2536 16.564 48.185 88.924 1.00 0.00 O ATOM 79822 H1 WAT 2536 17.160 48.121 88.178 1.00 0.00 H ATOM 79823 H2 WAT 2536 15.783 48.611 88.570 1.00 0.00 H TER 79825 WAT 2536 ATOM 79825 O WAT 2537 16.155 103.522 79.263 1.00 0.00 O ATOM 79826 H1 WAT 2537 15.593 103.019 79.852 1.00 0.00 H ATOM 79827 H2 WAT 2537 16.758 103.986 79.844 1.00 0.00 H TER 79829 WAT 2537 ATOM 79829 O WAT 2538 3.118 75.654 93.422 1.00 0.00 O ATOM 79830 H1 WAT 2538 3.071 74.776 93.800 1.00 0.00 H ATOM 79831 H2 WAT 2538 2.612 76.201 94.023 1.00 0.00 H TER 79833 WAT 2538 ATOM 79833 O WAT 2539 129.746 106.175 93.055 1.00 0.00 O ATOM 79834 H1 WAT 2539 129.564 105.360 92.587 1.00 0.00 H ATOM 79835 H2 WAT 2539 129.539 106.864 92.424 1.00 0.00 H TER 79837 WAT 2539 ATOM 79837 O WAT 2540 56.858 14.266 109.771 1.00 0.00 O ATOM 79838 H1 WAT 2540 57.478 14.720 109.201 1.00 0.00 H ATOM 79839 H2 WAT 2540 57.409 13.769 110.376 1.00 0.00 H TER 79841 WAT 2540 ATOM 79841 O WAT 2541 35.591 68.297 125.005 1.00 0.00 O ATOM 79842 H1 WAT 2541 34.895 68.585 125.595 1.00 0.00 H ATOM 79843 H2 WAT 2541 36.391 68.360 125.528 1.00 0.00 H TER 79845 WAT 2541 ATOM 79845 O WAT 2542 65.367 100.556 111.818 1.00 0.00 O ATOM 79846 H1 WAT 2542 65.407 99.600 111.803 1.00 0.00 H ATOM 79847 H2 WAT 2542 65.964 100.832 111.123 1.00 0.00 H TER 79849 WAT 2542 ATOM 79849 O WAT 2543 141.915 43.499 14.986 1.00 0.00 O ATOM 79850 H1 WAT 2543 141.880 43.125 15.867 1.00 0.00 H ATOM 79851 H2 WAT 2543 141.228 43.038 14.503 1.00 0.00 H TER 79853 WAT 2543 ATOM 79853 O WAT 2544 96.552 19.867 88.660 1.00 0.00 O ATOM 79854 H1 WAT 2544 96.120 20.349 87.955 1.00 0.00 H ATOM 79855 H2 WAT 2544 96.657 20.510 89.361 1.00 0.00 H TER 79857 WAT 2544 ATOM 79857 O WAT 2545 2.366 99.447 67.427 1.00 0.00 O ATOM 79858 H1 WAT 2545 1.420 99.369 67.545 1.00 0.00 H ATOM 79859 H2 WAT 2545 2.704 98.573 67.621 1.00 0.00 H TER 79861 WAT 2545 ATOM 79861 O WAT 2546 46.107 87.314 58.075 1.00 0.00 O ATOM 79862 H1 WAT 2546 45.794 88.035 58.622 1.00 0.00 H ATOM 79863 H2 WAT 2546 45.315 86.960 57.669 1.00 0.00 H TER 79865 WAT 2546 ATOM 79865 O WAT 2547 112.107 42.476 83.465 1.00 0.00 O ATOM 79866 H1 WAT 2547 112.078 42.726 84.389 1.00 0.00 H ATOM 79867 H2 WAT 2547 112.919 42.863 83.138 1.00 0.00 H TER 79869 WAT 2547 ATOM 79869 O WAT 2548 82.252 87.016 17.762 1.00 0.00 O ATOM 79870 H1 WAT 2548 81.841 86.459 18.423 1.00 0.00 H ATOM 79871 H2 WAT 2548 83.187 86.979 17.964 1.00 0.00 H TER 79873 WAT 2548 ATOM 79873 O WAT 2549 9.029 88.782 93.196 1.00 0.00 O ATOM 79874 H1 WAT 2549 9.787 88.290 93.510 1.00 0.00 H ATOM 79875 H2 WAT 2549 9.403 89.562 92.786 1.00 0.00 H TER 79877 WAT 2549 ATOM 79877 O WAT 2550 58.179 110.249 85.155 1.00 0.00 O ATOM 79878 H1 WAT 2550 58.255 111.169 84.901 1.00 0.00 H ATOM 79879 H2 WAT 2550 57.519 110.245 85.848 1.00 0.00 H TER 79881 WAT 2550 ATOM 79881 O WAT 2551 7.311 127.287 89.096 1.00 0.00 O ATOM 79882 H1 WAT 2551 7.097 127.572 89.984 1.00 0.00 H ATOM 79883 H2 WAT 2551 7.534 128.094 88.632 1.00 0.00 H TER 79885 WAT 2551 ATOM 79885 O WAT 2552 38.746 129.932 113.280 1.00 0.00 O ATOM 79886 H1 WAT 2552 39.396 129.277 113.530 1.00 0.00 H ATOM 79887 H2 WAT 2552 38.906 130.667 113.871 1.00 0.00 H TER 79889 WAT 2552 ATOM 79889 O WAT 2553 132.391 85.177 98.822 1.00 0.00 O ATOM 79890 H1 WAT 2553 131.585 85.305 99.322 1.00 0.00 H ATOM 79891 H2 WAT 2553 132.414 85.915 98.212 1.00 0.00 H TER 79893 WAT 2553 ATOM 79893 O WAT 2554 135.105 134.160 137.986 1.00 0.00 O ATOM 79894 H1 WAT 2554 135.125 135.116 138.025 1.00 0.00 H ATOM 79895 H2 WAT 2554 134.950 133.886 138.890 1.00 0.00 H TER 79897 WAT 2554 ATOM 79897 O WAT 2555 68.729 94.019 98.735 1.00 0.00 O ATOM 79898 H1 WAT 2555 67.881 94.111 99.168 1.00 0.00 H ATOM 79899 H2 WAT 2555 69.155 94.867 98.858 1.00 0.00 H TER 79901 WAT 2555 ATOM 79901 O WAT 2556 35.460 17.832 92.258 1.00 0.00 O ATOM 79902 H1 WAT 2556 35.344 17.982 91.319 1.00 0.00 H ATOM 79903 H2 WAT 2556 35.496 16.880 92.346 1.00 0.00 H TER 79905 WAT 2556 ATOM 79905 O WAT 2557 12.424 105.004 78.378 1.00 0.00 O ATOM 79906 H1 WAT 2557 13.324 105.142 78.084 1.00 0.00 H ATOM 79907 H2 WAT 2557 12.296 104.057 78.322 1.00 0.00 H TER 79909 WAT 2557 ATOM 79909 O WAT 2558 137.059 128.175 89.428 1.00 0.00 O ATOM 79910 H1 WAT 2558 136.698 127.372 89.052 1.00 0.00 H ATOM 79911 H2 WAT 2558 137.443 128.637 88.683 1.00 0.00 H TER 79913 WAT 2558 ATOM 79913 O WAT 2559 114.386 59.013 83.987 1.00 0.00 O ATOM 79914 H1 WAT 2559 114.750 58.811 83.126 1.00 0.00 H ATOM 79915 H2 WAT 2559 115.064 59.534 84.418 1.00 0.00 H TER 79917 WAT 2559 ATOM 79917 O WAT 2560 64.044 120.650 1.697 1.00 0.00 O ATOM 79918 H1 WAT 2560 64.219 120.808 2.625 1.00 0.00 H ATOM 79919 H2 WAT 2560 63.962 121.524 1.316 1.00 0.00 H TER 79921 WAT 2560 ATOM 79921 O WAT 2561 56.993 124.655 6.600 1.00 0.00 O ATOM 79922 H1 WAT 2561 57.111 124.982 7.492 1.00 0.00 H ATOM 79923 H2 WAT 2561 57.782 124.142 6.426 1.00 0.00 H TER 79925 WAT 2561 ATOM 79925 O WAT 2562 104.900 42.303 101.083 1.00 0.00 O ATOM 79926 H1 WAT 2562 104.696 43.216 101.283 1.00 0.00 H ATOM 79927 H2 WAT 2562 105.261 41.954 101.898 1.00 0.00 H TER 79929 WAT 2562 ATOM 79929 O WAT 2563 12.045 65.901 12.618 1.00 0.00 O ATOM 79930 H1 WAT 2563 11.642 65.772 11.759 1.00 0.00 H ATOM 79931 H2 WAT 2563 12.230 65.015 12.930 1.00 0.00 H TER 79933 WAT 2563 ATOM 79933 O WAT 2564 21.059 96.502 58.734 1.00 0.00 O ATOM 79934 H1 WAT 2564 20.177 96.800 58.514 1.00 0.00 H ATOM 79935 H2 WAT 2564 21.184 95.714 58.204 1.00 0.00 H TER 79937 WAT 2564 ATOM 79937 O WAT 2565 122.628 79.550 59.982 1.00 0.00 O ATOM 79938 H1 WAT 2565 122.839 79.037 59.202 1.00 0.00 H ATOM 79939 H2 WAT 2565 122.883 78.990 60.714 1.00 0.00 H TER 79941 WAT 2565 ATOM 79941 O WAT 2566 74.642 74.648 67.813 1.00 0.00 O ATOM 79942 H1 WAT 2566 74.678 75.545 67.481 1.00 0.00 H ATOM 79943 H2 WAT 2566 74.647 74.745 68.765 1.00 0.00 H TER 79945 WAT 2566 ATOM 79945 O WAT 2567 23.025 108.294 132.711 1.00 0.00 O ATOM 79946 H1 WAT 2567 22.991 108.178 133.661 1.00 0.00 H ATOM 79947 H2 WAT 2567 23.945 108.478 132.525 1.00 0.00 H TER 79949 WAT 2567 ATOM 79949 O WAT 2568 53.743 86.257 142.197 1.00 0.00 O ATOM 79950 H1 WAT 2568 53.996 87.047 141.720 1.00 0.00 H ATOM 79951 H2 WAT 2568 52.954 85.950 141.751 1.00 0.00 H TER 79953 WAT 2568 ATOM 79953 O WAT 2569 49.438 75.265 10.241 1.00 0.00 O ATOM 79954 H1 WAT 2569 50.242 74.830 9.956 1.00 0.00 H ATOM 79955 H2 WAT 2569 49.739 76.066 10.671 1.00 0.00 H TER 79957 WAT 2569 ATOM 79957 O WAT 2570 96.796 49.232 81.248 1.00 0.00 O ATOM 79958 H1 WAT 2570 96.269 48.608 80.749 1.00 0.00 H ATOM 79959 H2 WAT 2570 97.530 49.442 80.670 1.00 0.00 H TER 79961 WAT 2570 ATOM 79961 O WAT 2571 62.493 17.114 92.103 1.00 0.00 O ATOM 79962 H1 WAT 2571 62.692 17.405 91.213 1.00 0.00 H ATOM 79963 H2 WAT 2571 62.113 17.883 92.527 1.00 0.00 H TER 79965 WAT 2571 ATOM 79965 O WAT 2572 66.427 143.335 85.938 1.00 0.00 O ATOM 79966 H1 WAT 2572 66.626 144.269 86.006 1.00 0.00 H ATOM 79967 H2 WAT 2572 66.283 143.188 85.003 1.00 0.00 H TER 79969 WAT 2572 ATOM 79969 O WAT 2573 70.453 23.992 130.172 1.00 0.00 O ATOM 79970 H1 WAT 2573 70.179 23.242 130.701 1.00 0.00 H ATOM 79971 H2 WAT 2573 70.784 24.626 130.809 1.00 0.00 H TER 79973 WAT 2573 ATOM 79973 O WAT 2574 26.828 96.738 87.903 1.00 0.00 O ATOM 79974 H1 WAT 2574 26.147 96.080 88.041 1.00 0.00 H ATOM 79975 H2 WAT 2574 26.362 97.492 87.541 1.00 0.00 H TER 79977 WAT 2574 ATOM 79977 O WAT 2575 19.869 29.256 90.841 1.00 0.00 O ATOM 79978 H1 WAT 2575 20.502 29.562 91.491 1.00 0.00 H ATOM 79979 H2 WAT 2575 20.398 28.795 90.190 1.00 0.00 H TER 79981 WAT 2575 ATOM 79981 O WAT 2576 83.925 86.386 145.059 1.00 0.00 O ATOM 79982 H1 WAT 2576 83.853 86.929 145.844 1.00 0.00 H ATOM 79983 H2 WAT 2576 83.825 85.490 145.378 1.00 0.00 H TER 79985 WAT 2576 ATOM 79985 O WAT 2577 42.826 44.875 58.491 1.00 0.00 O ATOM 79986 H1 WAT 2577 43.600 45.205 58.949 1.00 0.00 H ATOM 79987 H2 WAT 2577 43.113 44.765 57.585 1.00 0.00 H TER 79989 WAT 2577 ATOM 79989 O WAT 2578 30.455 -0.250 88.381 1.00 0.00 O ATOM 79990 H1 WAT 2578 30.572 0.204 87.547 1.00 0.00 H ATOM 79991 H2 WAT 2578 30.356 0.451 89.025 1.00 0.00 H TER 79993 WAT 2578 ATOM 79993 O WAT 2579 119.544 99.675 4.702 1.00 0.00 O ATOM 79994 H1 WAT 2579 119.571 100.477 5.223 1.00 0.00 H ATOM 79995 H2 WAT 2579 119.160 99.022 5.288 1.00 0.00 H TER 79997 WAT 2579 ATOM 79997 O WAT 2580 138.843 115.885 13.333 1.00 0.00 O ATOM 79998 H1 WAT 2580 139.241 115.429 12.590 1.00 0.00 H ATOM 79999 H2 WAT 2580 139.451 116.598 13.529 1.00 0.00 H TER 80001 WAT 2580 ATOM 80001 O WAT 2581 119.156 56.299 130.043 1.00 0.00 O ATOM 80002 H1 WAT 2581 119.672 56.698 129.343 1.00 0.00 H ATOM 80003 H2 WAT 2581 119.577 56.596 130.850 1.00 0.00 H TER 80005 WAT 2581 ATOM 80005 O WAT 2582 65.044 134.956 1.948 1.00 0.00 O ATOM 80006 H1 WAT 2582 65.361 135.131 2.834 1.00 0.00 H ATOM 80007 H2 WAT 2582 65.587 134.231 1.639 1.00 0.00 H TER 80009 WAT 2582 ATOM 80009 O WAT 2583 40.561 4.441 101.617 1.00 0.00 O ATOM 80010 H1 WAT 2583 41.298 3.856 101.445 1.00 0.00 H ATOM 80011 H2 WAT 2583 39.880 3.871 101.973 1.00 0.00 H TER 80013 WAT 2583 ATOM 80013 O WAT 2584 117.552 107.839 123.527 1.00 0.00 O ATOM 80014 H1 WAT 2584 117.092 108.678 123.539 1.00 0.00 H ATOM 80015 H2 WAT 2584 117.007 107.259 124.059 1.00 0.00 H TER 80017 WAT 2584 ATOM 80017 O WAT 2585 29.663 21.025 108.350 1.00 0.00 O ATOM 80018 H1 WAT 2585 30.391 20.833 108.941 1.00 0.00 H ATOM 80019 H2 WAT 2585 29.985 20.774 107.484 1.00 0.00 H TER 80021 WAT 2585 ATOM 80021 O WAT 2586 12.271 124.044 58.833 1.00 0.00 O ATOM 80022 H1 WAT 2586 12.835 123.690 59.520 1.00 0.00 H ATOM 80023 H2 WAT 2586 12.549 124.955 58.740 1.00 0.00 H TER 80025 WAT 2586 ATOM 80025 O WAT 2587 87.167 48.601 25.240 1.00 0.00 O ATOM 80026 H1 WAT 2587 87.705 47.908 24.856 1.00 0.00 H ATOM 80027 H2 WAT 2587 86.339 48.171 25.453 1.00 0.00 H TER 80029 WAT 2587 ATOM 80029 O WAT 2588 71.298 145.003 1.387 1.00 0.00 O ATOM 80030 H1 WAT 2588 71.345 144.644 0.501 1.00 0.00 H ATOM 80031 H2 WAT 2588 70.401 144.823 1.670 1.00 0.00 H TER 80033 WAT 2588 ATOM 80033 O WAT 2589 5.623 6.102 18.447 1.00 0.00 O ATOM 80034 H1 WAT 2589 5.131 6.632 17.820 1.00 0.00 H ATOM 80035 H2 WAT 2589 4.964 5.542 18.857 1.00 0.00 H TER 80037 WAT 2589 ATOM 80037 O WAT 2590 30.747 39.623 21.017 1.00 0.00 O ATOM 80038 H1 WAT 2590 31.381 39.384 20.340 1.00 0.00 H ATOM 80039 H2 WAT 2590 30.202 38.842 21.121 1.00 0.00 H TER 80041 WAT 2590 ATOM 80041 O WAT 2591 126.064 132.717 125.735 1.00 0.00 O ATOM 80042 H1 WAT 2591 126.179 132.364 126.617 1.00 0.00 H ATOM 80043 H2 WAT 2591 126.463 132.064 125.161 1.00 0.00 H TER 80045 WAT 2591 ATOM 80045 O WAT 2592 5.140 41.562 99.734 1.00 0.00 O ATOM 80046 H1 WAT 2592 4.641 42.185 99.206 1.00 0.00 H ATOM 80047 H2 WAT 2592 4.478 41.090 100.238 1.00 0.00 H TER 80049 WAT 2592 ATOM 80049 O WAT 2593 5.872 0.283 15.317 1.00 0.00 O ATOM 80050 H1 WAT 2593 6.321 1.128 15.352 1.00 0.00 H ATOM 80051 H2 WAT 2593 6.575 -0.356 15.197 1.00 0.00 H TER 80053 WAT 2593 ATOM 80053 O WAT 2594 48.530 39.921 143.787 1.00 0.00 O ATOM 80054 H1 WAT 2594 48.826 39.172 144.305 1.00 0.00 H ATOM 80055 H2 WAT 2594 49.236 40.563 143.871 1.00 0.00 H TER 80057 WAT 2594 ATOM 80057 O WAT 2595 124.552 144.789 114.765 1.00 0.00 O ATOM 80058 H1 WAT 2595 124.511 145.016 113.836 1.00 0.00 H ATOM 80059 H2 WAT 2595 124.017 143.999 114.842 1.00 0.00 H TER 80061 WAT 2595 ATOM 80061 O WAT 2596 52.085 63.624 71.102 1.00 0.00 O ATOM 80062 H1 WAT 2596 52.825 64.100 71.477 1.00 0.00 H ATOM 80063 H2 WAT 2596 51.313 64.049 71.475 1.00 0.00 H TER 80065 WAT 2596 ATOM 80065 O WAT 2597 97.321 134.786 69.092 1.00 0.00 O ATOM 80066 H1 WAT 2597 97.538 134.371 68.257 1.00 0.00 H ATOM 80067 H2 WAT 2597 97.763 135.635 69.059 1.00 0.00 H TER 80069 WAT 2597 ATOM 80069 O WAT 2598 0.177 32.724 83.280 1.00 0.00 O ATOM 80070 H1 WAT 2598 0.084 33.533 82.776 1.00 0.00 H ATOM 80071 H2 WAT 2598 0.566 32.102 82.665 1.00 0.00 H TER 80073 WAT 2598 ATOM 80073 O WAT 2599 116.642 24.324 118.307 1.00 0.00 O ATOM 80074 H1 WAT 2599 116.104 24.016 119.036 1.00 0.00 H ATOM 80075 H2 WAT 2599 117.443 24.647 118.719 1.00 0.00 H TER 80077 WAT 2599 ATOM 80077 O WAT 2600 20.516 109.214 20.044 1.00 0.00 O ATOM 80078 H1 WAT 2600 20.281 108.572 19.374 1.00 0.00 H ATOM 80079 H2 WAT 2600 19.824 109.138 20.701 1.00 0.00 H TER 80081 WAT 2600 ATOM 80081 O WAT 2601 12.595 22.184 116.773 1.00 0.00 O ATOM 80082 H1 WAT 2601 12.289 23.024 116.431 1.00 0.00 H ATOM 80083 H2 WAT 2601 13.300 22.414 117.379 1.00 0.00 H TER 80085 WAT 2601 ATOM 80085 O WAT 2602 16.798 37.041 74.115 1.00 0.00 O ATOM 80086 H1 WAT 2602 17.230 36.292 73.704 1.00 0.00 H ATOM 80087 H2 WAT 2602 17.069 37.001 75.032 1.00 0.00 H TER 80089 WAT 2602 ATOM 80089 O WAT 2603 6.404 141.196 100.931 1.00 0.00 O ATOM 80090 H1 WAT 2603 5.460 141.042 100.970 1.00 0.00 H ATOM 80091 H2 WAT 2603 6.790 140.321 100.959 1.00 0.00 H TER 80093 WAT 2603 ATOM 80093 O WAT 2604 86.637 24.225 141.189 1.00 0.00 O ATOM 80094 H1 WAT 2604 85.997 24.937 141.164 1.00 0.00 H ATOM 80095 H2 WAT 2604 87.294 24.472 140.538 1.00 0.00 H TER 80097 WAT 2604 ATOM 80097 O WAT 2605 60.300 2.430 87.343 1.00 0.00 O ATOM 80098 H1 WAT 2605 60.931 2.914 86.810 1.00 0.00 H ATOM 80099 H2 WAT 2605 59.968 1.747 86.760 1.00 0.00 H TER 80101 WAT 2605 ATOM 80101 O WAT 2606 3.993 105.729 60.746 1.00 0.00 O ATOM 80102 H1 WAT 2606 4.121 104.936 61.266 1.00 0.00 H ATOM 80103 H2 WAT 2606 3.347 105.481 60.085 1.00 0.00 H TER 80105 WAT 2606 ATOM 80105 O WAT 2607 8.409 25.304 142.055 1.00 0.00 O ATOM 80106 H1 WAT 2607 9.146 24.828 141.672 1.00 0.00 H ATOM 80107 H2 WAT 2607 8.343 26.104 141.533 1.00 0.00 H TER 80109 WAT 2607 ATOM 80109 O WAT 2608 71.529 93.689 1.978 1.00 0.00 O ATOM 80110 H1 WAT 2608 71.438 93.452 2.901 1.00 0.00 H ATOM 80111 H2 WAT 2608 72.355 94.170 1.935 1.00 0.00 H TER 80113 WAT 2608 ATOM 80113 O WAT 2609 73.890 117.272 20.831 1.00 0.00 O ATOM 80114 H1 WAT 2609 74.071 118.184 21.059 1.00 0.00 H ATOM 80115 H2 WAT 2609 73.133 117.317 20.247 1.00 0.00 H TER 80117 WAT 2609 ATOM 80117 O WAT 2610 71.146 5.652 92.683 1.00 0.00 O ATOM 80118 H1 WAT 2610 70.657 5.482 93.489 1.00 0.00 H ATOM 80119 H2 WAT 2610 70.858 6.522 92.408 1.00 0.00 H TER 80121 WAT 2610 ATOM 80121 O WAT 2611 90.773 71.192 143.502 1.00 0.00 O ATOM 80122 H1 WAT 2611 91.040 71.502 142.637 1.00 0.00 H ATOM 80123 H2 WAT 2611 89.817 71.172 143.465 1.00 0.00 H TER 80125 WAT 2611 ATOM 80125 O WAT 2612 125.330 16.018 118.042 1.00 0.00 O ATOM 80126 H1 WAT 2612 125.463 16.618 117.308 1.00 0.00 H ATOM 80127 H2 WAT 2612 125.653 15.175 117.723 1.00 0.00 H TER 80129 WAT 2612 ATOM 80129 O WAT 2613 23.827 125.082 67.737 1.00 0.00 O ATOM 80130 H1 WAT 2613 23.062 124.988 67.170 1.00 0.00 H ATOM 80131 H2 WAT 2613 23.942 124.217 68.130 1.00 0.00 H TER 80133 WAT 2613 ATOM 80133 O WAT 2614 38.908 99.968 10.005 1.00 0.00 O ATOM 80134 H1 WAT 2614 39.577 100.319 9.418 1.00 0.00 H ATOM 80135 H2 WAT 2614 38.201 100.613 9.975 1.00 0.00 H TER 80137 WAT 2614 ATOM 80137 O WAT 2615 59.931 51.782 74.580 1.00 0.00 O ATOM 80138 H1 WAT 2615 59.646 50.873 74.490 1.00 0.00 H ATOM 80139 H2 WAT 2615 60.512 51.926 73.833 1.00 0.00 H TER 80141 WAT 2615 ATOM 80141 O WAT 2616 91.308 32.323 92.035 1.00 0.00 O ATOM 80142 H1 WAT 2616 91.686 31.568 92.485 1.00 0.00 H ATOM 80143 H2 WAT 2616 90.394 32.080 91.886 1.00 0.00 H TER 80145 WAT 2616 ATOM 80145 O WAT 2617 67.925 82.358 52.105 1.00 0.00 O ATOM 80146 H1 WAT 2617 68.420 83.074 52.503 1.00 0.00 H ATOM 80147 H2 WAT 2617 67.051 82.721 51.965 1.00 0.00 H TER 80149 WAT 2617 ATOM 80149 O WAT 2618 104.993 90.895 82.282 1.00 0.00 O ATOM 80150 H1 WAT 2618 105.334 91.529 81.651 1.00 0.00 H ATOM 80151 H2 WAT 2618 104.050 90.880 82.121 1.00 0.00 H TER 80153 WAT 2618 ATOM 80153 O WAT 2619 11.378 114.773 144.972 1.00 0.00 O ATOM 80154 H1 WAT 2619 11.866 114.880 145.788 1.00 0.00 H ATOM 80155 H2 WAT 2619 10.553 115.234 145.123 1.00 0.00 H TER 80157 WAT 2619 ATOM 80157 O WAT 2620 89.832 117.072 83.374 1.00 0.00 O ATOM 80158 H1 WAT 2620 89.664 116.989 84.312 1.00 0.00 H ATOM 80159 H2 WAT 2620 90.093 116.194 83.098 1.00 0.00 H TER 80161 WAT 2620 ATOM 80161 O WAT 2621 48.413 119.048 109.386 1.00 0.00 O ATOM 80162 H1 WAT 2621 48.438 119.642 108.636 1.00 0.00 H ATOM 80163 H2 WAT 2621 49.254 118.593 109.360 1.00 0.00 H TER 80165 WAT 2621 ATOM 80165 O WAT 2622 81.065 24.586 105.793 1.00 0.00 O ATOM 80166 H1 WAT 2622 81.124 23.648 105.612 1.00 0.00 H ATOM 80167 H2 WAT 2622 81.802 24.969 105.318 1.00 0.00 H TER 80169 WAT 2622 ATOM 80169 O WAT 2623 60.033 132.278 152.256 1.00 0.00 O ATOM 80170 H1 WAT 2623 59.206 131.855 152.487 1.00 0.00 H ATOM 80171 H2 WAT 2623 59.806 133.202 152.144 1.00 0.00 H TER 80173 WAT 2623 ATOM 80173 O WAT 2624 46.384 81.960 101.403 1.00 0.00 O ATOM 80174 H1 WAT 2624 45.456 81.818 101.217 1.00 0.00 H ATOM 80175 H2 WAT 2624 46.760 82.224 100.564 1.00 0.00 H TER 80177 WAT 2624 ATOM 80177 O WAT 2625 91.397 57.586 58.578 1.00 0.00 O ATOM 80178 H1 WAT 2625 91.892 56.767 58.603 1.00 0.00 H ATOM 80179 H2 WAT 2625 91.046 57.628 57.689 1.00 0.00 H TER 80181 WAT 2625 ATOM 80181 O WAT 2626 2.551 102.363 91.025 1.00 0.00 O ATOM 80182 H1 WAT 2626 2.083 103.186 90.882 1.00 0.00 H ATOM 80183 H2 WAT 2626 2.651 101.988 90.150 1.00 0.00 H TER 80185 WAT 2626 ATOM 80185 O WAT 2627 61.063 143.193 143.929 1.00 0.00 O ATOM 80186 H1 WAT 2627 61.501 143.698 143.243 1.00 0.00 H ATOM 80187 H2 WAT 2627 61.366 142.295 143.795 1.00 0.00 H TER 80189 WAT 2627 ATOM 80189 O WAT 2628 23.743 19.379 68.465 1.00 0.00 O ATOM 80190 H1 WAT 2628 23.537 20.165 67.958 1.00 0.00 H ATOM 80191 H2 WAT 2628 24.309 18.865 67.889 1.00 0.00 H TER 80193 WAT 2628 ATOM 80193 O WAT 2629 3.261 96.061 98.164 1.00 0.00 O ATOM 80194 H1 WAT 2629 3.179 96.800 98.766 1.00 0.00 H ATOM 80195 H2 WAT 2629 3.371 96.464 97.303 1.00 0.00 H TER 80197 WAT 2629 ATOM 80197 O WAT 2630 74.943 94.728 156.403 1.00 0.00 O ATOM 80198 H1 WAT 2630 74.430 94.134 156.952 1.00 0.00 H ATOM 80199 H2 WAT 2630 75.115 94.227 155.605 1.00 0.00 H TER 80201 WAT 2630 ATOM 80201 O WAT 2631 83.303 106.564 107.320 1.00 0.00 O ATOM 80202 H1 WAT 2631 83.317 105.675 107.674 1.00 0.00 H ATOM 80203 H2 WAT 2631 82.381 106.819 107.350 1.00 0.00 H TER 80205 WAT 2631 ATOM 80205 O WAT 2632 7.710 78.399 25.631 1.00 0.00 O ATOM 80206 H1 WAT 2632 8.449 78.103 25.099 1.00 0.00 H ATOM 80207 H2 WAT 2632 6.939 78.046 25.187 1.00 0.00 H TER 80209 WAT 2632 ATOM 80209 O WAT 2633 83.724 21.692 84.818 1.00 0.00 O ATOM 80210 H1 WAT 2633 83.537 21.750 85.755 1.00 0.00 H ATOM 80211 H2 WAT 2633 83.788 22.603 84.531 1.00 0.00 H TER 80213 WAT 2633 ATOM 80213 O WAT 2634 8.401 27.288 73.504 1.00 0.00 O ATOM 80214 H1 WAT 2634 7.992 28.152 73.539 1.00 0.00 H ATOM 80215 H2 WAT 2634 7.853 26.740 74.066 1.00 0.00 H TER 80217 WAT 2634 ATOM 80217 O WAT 2635 136.927 108.940 72.411 1.00 0.00 O ATOM 80218 H1 WAT 2635 137.533 109.583 72.044 1.00 0.00 H ATOM 80219 H2 WAT 2635 136.221 109.464 72.788 1.00 0.00 H TER 80221 WAT 2635 ATOM 80221 O WAT 2636 89.220 22.300 138.936 1.00 0.00 O ATOM 80222 H1 WAT 2636 89.710 22.190 139.751 1.00 0.00 H ATOM 80223 H2 WAT 2636 88.727 21.486 138.841 1.00 0.00 H TER 80225 WAT 2636 ATOM 80225 O WAT 2637 107.303 23.229 90.968 1.00 0.00 O ATOM 80226 H1 WAT 2637 106.437 23.017 91.316 1.00 0.00 H ATOM 80227 H2 WAT 2637 107.881 22.563 91.340 1.00 0.00 H TER 80229 WAT 2637 ATOM 80229 O WAT 2638 93.601 50.757 80.045 1.00 0.00 O ATOM 80230 H1 WAT 2638 93.012 50.381 79.390 1.00 0.00 H ATOM 80231 H2 WAT 2638 93.499 50.191 80.810 1.00 0.00 H TER 80233 WAT 2638 ATOM 80233 O WAT 2639 80.497 60.115 12.093 1.00 0.00 O ATOM 80234 H1 WAT 2639 80.124 60.996 12.100 1.00 0.00 H ATOM 80235 H2 WAT 2639 79.903 59.598 12.637 1.00 0.00 H TER 80237 WAT 2639 ATOM 80237 O WAT 2640 29.801 17.155 7.396 1.00 0.00 O ATOM 80238 H1 WAT 2640 29.673 18.081 7.602 1.00 0.00 H ATOM 80239 H2 WAT 2640 29.508 17.068 6.489 1.00 0.00 H TER 80241 WAT 2640 ATOM 80241 O WAT 2641 78.782 109.871 132.908 1.00 0.00 O ATOM 80242 H1 WAT 2641 79.021 110.229 132.053 1.00 0.00 H ATOM 80243 H2 WAT 2641 77.894 109.535 132.788 1.00 0.00 H TER 80245 WAT 2641 ATOM 80245 O WAT 2642 124.773 9.375 56.110 1.00 0.00 O ATOM 80246 H1 WAT 2642 125.221 10.121 55.712 1.00 0.00 H ATOM 80247 H2 WAT 2642 124.200 9.763 56.771 1.00 0.00 H TER 80249 WAT 2642 ATOM 80249 O WAT 2643 40.109 123.600 54.244 1.00 0.00 O ATOM 80250 H1 WAT 2643 40.190 123.410 53.309 1.00 0.00 H ATOM 80251 H2 WAT 2643 39.298 124.104 54.315 1.00 0.00 H TER 80253 WAT 2643 ATOM 80253 O WAT 2644 27.637 32.489 112.942 1.00 0.00 O ATOM 80254 H1 WAT 2644 27.586 32.415 111.989 1.00 0.00 H ATOM 80255 H2 WAT 2644 27.343 33.380 113.129 1.00 0.00 H TER 80257 WAT 2644 ATOM 80257 O WAT 2645 61.999 71.601 11.936 1.00 0.00 O ATOM 80258 H1 WAT 2645 62.684 71.397 12.572 1.00 0.00 H ATOM 80259 H2 WAT 2645 61.853 72.542 12.035 1.00 0.00 H TER 80261 WAT 2645 ATOM 80261 O WAT 2646 124.809 130.177 88.765 1.00 0.00 O ATOM 80262 H1 WAT 2646 124.334 129.719 89.458 1.00 0.00 H ATOM 80263 H2 WAT 2646 124.136 130.408 88.125 1.00 0.00 H TER 80265 WAT 2646 ATOM 80265 O WAT 2647 38.914 142.282 83.804 1.00 0.00 O ATOM 80266 H1 WAT 2647 39.577 141.626 84.017 1.00 0.00 H ATOM 80267 H2 WAT 2647 38.116 141.776 83.652 1.00 0.00 H TER 80269 WAT 2647 ATOM 80269 O WAT 2648 122.589 124.761 123.391 1.00 0.00 O ATOM 80270 H1 WAT 2648 122.821 125.688 123.345 1.00 0.00 H ATOM 80271 H2 WAT 2648 123.424 124.311 123.515 1.00 0.00 H TER 80273 WAT 2648 ATOM 80273 O WAT 2649 142.475 46.885 125.640 1.00 0.00 O ATOM 80274 H1 WAT 2649 141.670 46.385 125.503 1.00 0.00 H ATOM 80275 H2 WAT 2649 142.270 47.761 125.315 1.00 0.00 H TER 80277 WAT 2649 ATOM 80277 O WAT 2650 25.262 119.112 135.156 1.00 0.00 O ATOM 80278 H1 WAT 2650 24.801 118.274 135.211 1.00 0.00 H ATOM 80279 H2 WAT 2650 24.839 119.570 134.430 1.00 0.00 H TER 80281 WAT 2650 ATOM 80281 O WAT 2651 127.752 83.429 108.042 1.00 0.00 O ATOM 80282 H1 WAT 2651 127.556 82.631 107.551 1.00 0.00 H ATOM 80283 H2 WAT 2651 128.681 83.352 108.262 1.00 0.00 H TER 80285 WAT 2651 ATOM 80285 O WAT 2652 28.483 61.081 136.372 1.00 0.00 O ATOM 80286 H1 WAT 2652 27.971 61.176 135.569 1.00 0.00 H ATOM 80287 H2 WAT 2652 27.932 61.463 137.055 1.00 0.00 H TER 80289 WAT 2652 ATOM 80289 O WAT 2653 129.195 89.484 77.389 1.00 0.00 O ATOM 80290 H1 WAT 2653 129.653 89.862 78.139 1.00 0.00 H ATOM 80291 H2 WAT 2653 129.885 89.071 76.869 1.00 0.00 H TER 80293 WAT 2653 ATOM 80293 O WAT 2654 36.873 36.913 106.880 1.00 0.00 O ATOM 80294 H1 WAT 2654 37.079 36.182 106.297 1.00 0.00 H ATOM 80295 H2 WAT 2654 36.998 37.693 106.339 1.00 0.00 H TER 80297 WAT 2654 ATOM 80297 O WAT 2655 13.958 68.059 107.285 1.00 0.00 O ATOM 80298 H1 WAT 2655 14.139 68.637 106.544 1.00 0.00 H ATOM 80299 H2 WAT 2655 13.033 67.832 107.192 1.00 0.00 H TER 80301 WAT 2655 ATOM 80301 O WAT 2656 94.574 76.295 118.704 1.00 0.00 O ATOM 80302 H1 WAT 2656 93.824 75.701 118.726 1.00 0.00 H ATOM 80303 H2 WAT 2656 94.960 76.227 119.577 1.00 0.00 H TER 80305 WAT 2656 ATOM 80305 O WAT 2657 24.461 96.004 101.889 1.00 0.00 O ATOM 80306 H1 WAT 2657 24.740 95.088 101.885 1.00 0.00 H ATOM 80307 H2 WAT 2657 23.519 95.968 101.724 1.00 0.00 H TER 80309 WAT 2657 ATOM 80309 O WAT 2658 138.271 70.688 146.498 1.00 0.00 O ATOM 80310 H1 WAT 2658 138.942 70.131 146.102 1.00 0.00 H ATOM 80311 H2 WAT 2658 137.630 70.824 145.801 1.00 0.00 H TER 80313 WAT 2658 ATOM 80313 O WAT 2659 29.840 6.266 148.180 1.00 0.00 O ATOM 80314 H1 WAT 2659 30.051 5.890 149.035 1.00 0.00 H ATOM 80315 H2 WAT 2659 29.231 6.978 148.375 1.00 0.00 H TER 80317 WAT 2659 ATOM 80317 O WAT 2660 10.970 131.458 70.896 1.00 0.00 O ATOM 80318 H1 WAT 2660 10.331 131.359 71.602 1.00 0.00 H ATOM 80319 H2 WAT 2660 11.390 130.601 70.831 1.00 0.00 H TER 80321 WAT 2660 ATOM 80321 O WAT 2661 112.765 11.579 66.013 1.00 0.00 O ATOM 80322 H1 WAT 2661 112.925 12.037 65.188 1.00 0.00 H ATOM 80323 H2 WAT 2661 112.594 12.278 66.645 1.00 0.00 H TER 80325 WAT 2661 ATOM 80325 O WAT 2662 137.899 7.931 137.388 1.00 0.00 O ATOM 80326 H1 WAT 2662 138.590 8.557 137.601 1.00 0.00 H ATOM 80327 H2 WAT 2662 138.033 7.732 136.461 1.00 0.00 H TER 80329 WAT 2662 ATOM 80329 O WAT 2663 20.159 14.441 111.060 1.00 0.00 O ATOM 80330 H1 WAT 2663 20.586 15.290 110.944 1.00 0.00 H ATOM 80331 H2 WAT 2663 19.408 14.626 111.623 1.00 0.00 H TER 80333 WAT 2663 ATOM 80333 O WAT 2664 54.551 58.278 142.164 1.00 0.00 O ATOM 80334 H1 WAT 2664 54.115 58.958 142.677 1.00 0.00 H ATOM 80335 H2 WAT 2664 54.750 57.590 142.799 1.00 0.00 H TER 80337 WAT 2664 ATOM 80337 O WAT 2665 133.838 38.783 155.418 1.00 0.00 O ATOM 80338 H1 WAT 2665 133.793 39.606 154.931 1.00 0.00 H ATOM 80339 H2 WAT 2665 134.710 38.786 155.812 1.00 0.00 H TER 80341 WAT 2665 ATOM 80341 O WAT 2666 121.669 11.005 96.172 1.00 0.00 O ATOM 80342 H1 WAT 2666 121.278 11.846 96.407 1.00 0.00 H ATOM 80343 H2 WAT 2666 121.066 10.353 96.530 1.00 0.00 H TER 80345 WAT 2666 ATOM 80345 O WAT 2667 88.112 72.252 0.843 1.00 0.00 O ATOM 80346 H1 WAT 2667 88.017 73.014 1.416 1.00 0.00 H ATOM 80347 H2 WAT 2667 88.133 72.618 -0.041 1.00 0.00 H TER 80349 WAT 2667 ATOM 80349 O WAT 2668 107.580 55.520 86.736 1.00 0.00 O ATOM 80350 H1 WAT 2668 108.154 55.067 86.118 1.00 0.00 H ATOM 80351 H2 WAT 2668 107.791 56.447 86.622 1.00 0.00 H TER 80353 WAT 2668 ATOM 80353 O WAT 2669 84.049 65.329 16.420 1.00 0.00 O ATOM 80354 H1 WAT 2669 84.696 65.242 17.120 1.00 0.00 H ATOM 80355 H2 WAT 2669 83.433 65.987 16.743 1.00 0.00 H TER 80357 WAT 2669 ATOM 80357 O WAT 2670 0.514 104.454 105.124 1.00 0.00 O ATOM 80358 H1 WAT 2670 0.441 104.894 105.971 1.00 0.00 H ATOM 80359 H2 WAT 2670 -0.278 104.711 104.652 1.00 0.00 H TER 80361 WAT 2670 ATOM 80361 O WAT 2671 126.584 125.930 16.888 1.00 0.00 O ATOM 80362 H1 WAT 2671 126.600 124.983 16.746 1.00 0.00 H ATOM 80363 H2 WAT 2671 126.644 126.030 17.838 1.00 0.00 H TER 80365 WAT 2671 ATOM 80365 O WAT 2672 47.589 45.840 104.208 1.00 0.00 O ATOM 80366 H1 WAT 2672 48.179 45.413 103.587 1.00 0.00 H ATOM 80367 H2 WAT 2672 47.530 46.744 103.901 1.00 0.00 H TER 80369 WAT 2672 ATOM 80369 O WAT 2673 65.107 87.357 114.422 1.00 0.00 O ATOM 80370 H1 WAT 2673 64.324 86.892 114.718 1.00 0.00 H ATOM 80371 H2 WAT 2673 65.610 86.699 113.943 1.00 0.00 H TER 80373 WAT 2673 ATOM 80373 O WAT 2674 139.121 60.977 15.226 1.00 0.00 O ATOM 80374 H1 WAT 2674 139.415 61.468 15.994 1.00 0.00 H ATOM 80375 H2 WAT 2674 138.170 60.930 15.321 1.00 0.00 H TER 80377 WAT 2674 ATOM 80377 O WAT 2675 44.445 36.196 155.941 1.00 0.00 O ATOM 80378 H1 WAT 2675 43.959 35.603 156.514 1.00 0.00 H ATOM 80379 H2 WAT 2675 45.279 36.334 156.391 1.00 0.00 H TER 80381 WAT 2675 ATOM 80381 O WAT 2676 5.818 143.405 68.403 1.00 0.00 O ATOM 80382 H1 WAT 2676 6.655 143.868 68.438 1.00 0.00 H ATOM 80383 H2 WAT 2676 6.047 142.515 68.136 1.00 0.00 H TER 80385 WAT 2676 ATOM 80385 O WAT 2677 125.642 114.138 146.606 1.00 0.00 O ATOM 80386 H1 WAT 2677 125.499 113.508 145.900 1.00 0.00 H ATOM 80387 H2 WAT 2677 125.096 114.889 146.372 1.00 0.00 H TER 80389 WAT 2677 ATOM 80389 O WAT 2678 73.749 119.853 132.533 1.00 0.00 O ATOM 80390 H1 WAT 2678 73.086 120.479 132.241 1.00 0.00 H ATOM 80391 H2 WAT 2678 74.568 120.348 132.521 1.00 0.00 H TER 80393 WAT 2678 ATOM 80393 O WAT 2679 42.374 130.424 19.047 1.00 0.00 O ATOM 80394 H1 WAT 2679 42.668 131.302 18.804 1.00 0.00 H ATOM 80395 H2 WAT 2679 41.626 130.255 18.474 1.00 0.00 H TER 80397 WAT 2679 ATOM 80397 O WAT 2680 17.606 120.425 94.943 1.00 0.00 O ATOM 80398 H1 WAT 2680 17.216 119.931 95.664 1.00 0.00 H ATOM 80399 H2 WAT 2680 18.047 121.161 95.369 1.00 0.00 H TER 80401 WAT 2680 ATOM 80401 O WAT 2681 130.593 52.532 119.976 1.00 0.00 O ATOM 80402 H1 WAT 2681 131.349 51.948 120.036 1.00 0.00 H ATOM 80403 H2 WAT 2681 129.997 52.090 119.370 1.00 0.00 H TER 80405 WAT 2681 ATOM 80405 O WAT 2682 40.397 65.002 118.147 1.00 0.00 O ATOM 80406 H1 WAT 2682 40.975 64.513 117.560 1.00 0.00 H ATOM 80407 H2 WAT 2682 39.750 64.359 118.437 1.00 0.00 H TER 80409 WAT 2682 ATOM 80409 O WAT 2683 37.657 61.051 146.945 1.00 0.00 O ATOM 80410 H1 WAT 2683 38.317 60.406 147.199 1.00 0.00 H ATOM 80411 H2 WAT 2683 37.296 61.364 147.774 1.00 0.00 H TER 80413 WAT 2683 ATOM 80413 O WAT 2684 82.065 116.293 23.553 1.00 0.00 O ATOM 80414 H1 WAT 2684 81.385 116.961 23.640 1.00 0.00 H ATOM 80415 H2 WAT 2684 81.652 115.489 23.869 1.00 0.00 H TER 80417 WAT 2684 ATOM 80417 O WAT 2685 25.711 48.409 25.504 1.00 0.00 O ATOM 80418 H1 WAT 2685 25.192 48.211 24.724 1.00 0.00 H ATOM 80419 H2 WAT 2685 25.796 49.362 25.499 1.00 0.00 H TER 80421 WAT 2685 ATOM 80421 O WAT 2686 28.765 49.847 2.082 1.00 0.00 O ATOM 80422 H1 WAT 2686 29.637 49.455 2.034 1.00 0.00 H ATOM 80423 H2 WAT 2686 28.463 49.872 1.174 1.00 0.00 H TER 80425 WAT 2686 ATOM 80425 O WAT 2687 37.031 66.815 139.312 1.00 0.00 O ATOM 80426 H1 WAT 2687 36.211 67.248 139.549 1.00 0.00 H ATOM 80427 H2 WAT 2687 37.175 66.175 140.009 1.00 0.00 H TER 80429 WAT 2687 ATOM 80429 O WAT 2688 86.878 114.379 120.981 1.00 0.00 O ATOM 80430 H1 WAT 2688 86.955 114.530 121.923 1.00 0.00 H ATOM 80431 H2 WAT 2688 86.334 115.101 120.667 1.00 0.00 H TER 80433 WAT 2688 ATOM 80433 O WAT 2689 102.627 125.100 146.261 1.00 0.00 O ATOM 80434 H1 WAT 2689 101.844 124.744 146.682 1.00 0.00 H ATOM 80435 H2 WAT 2689 102.558 126.046 146.390 1.00 0.00 H TER 80437 WAT 2689 ATOM 80437 O WAT 2690 54.204 109.039 63.392 1.00 0.00 O ATOM 80438 H1 WAT 2690 54.588 109.771 62.908 1.00 0.00 H ATOM 80439 H2 WAT 2690 54.773 108.295 63.191 1.00 0.00 H TER 80441 WAT 2690 ATOM 80441 O WAT 2691 58.334 138.935 127.038 1.00 0.00 O ATOM 80442 H1 WAT 2691 57.383 138.887 127.136 1.00 0.00 H ATOM 80443 H2 WAT 2691 58.662 139.016 127.934 1.00 0.00 H TER 80445 WAT 2691 ATOM 80445 O WAT 2692 129.475 103.624 153.040 1.00 0.00 O ATOM 80446 H1 WAT 2692 129.371 104.301 152.371 1.00 0.00 H ATOM 80447 H2 WAT 2692 130.049 104.021 153.695 1.00 0.00 H TER 80449 WAT 2692 ATOM 80449 O WAT 2693 68.616 104.019 7.741 1.00 0.00 O ATOM 80450 H1 WAT 2693 68.556 104.718 8.392 1.00 0.00 H ATOM 80451 H2 WAT 2693 69.392 103.519 7.998 1.00 0.00 H TER 80453 WAT 2693 ATOM 80453 O WAT 2694 0.860 67.034 125.964 1.00 0.00 O ATOM 80454 H1 WAT 2694 0.736 67.658 126.679 1.00 0.00 H ATOM 80455 H2 WAT 2694 -0.009 66.939 125.574 1.00 0.00 H TER 80457 WAT 2694 ATOM 80457 O WAT 2695 80.977 44.409 151.468 1.00 0.00 O ATOM 80458 H1 WAT 2695 80.852 44.201 152.394 1.00 0.00 H ATOM 80459 H2 WAT 2695 81.235 43.578 151.069 1.00 0.00 H TER 80461 WAT 2695 ATOM 80461 O WAT 2696 133.920 144.950 66.971 1.00 0.00 O ATOM 80462 H1 WAT 2696 134.171 144.224 67.542 1.00 0.00 H ATOM 80463 H2 WAT 2696 134.529 145.654 67.196 1.00 0.00 H TER 80465 WAT 2696 ATOM 80465 O WAT 2697 17.729 141.877 70.034 1.00 0.00 O ATOM 80466 H1 WAT 2697 18.570 142.315 69.901 1.00 0.00 H ATOM 80467 H2 WAT 2697 17.882 141.285 70.771 1.00 0.00 H TER 80469 WAT 2697 ATOM 80469 O WAT 2698 1.815 69.579 100.591 1.00 0.00 O ATOM 80470 H1 WAT 2698 2.660 69.309 100.949 1.00 0.00 H ATOM 80471 H2 WAT 2698 1.188 68.960 100.965 1.00 0.00 H TER 80473 WAT 2698 ATOM 80473 O WAT 2699 42.574 99.219 106.251 1.00 0.00 O ATOM 80474 H1 WAT 2699 42.582 98.263 106.283 1.00 0.00 H ATOM 80475 H2 WAT 2699 41.822 99.434 105.700 1.00 0.00 H TER 80477 WAT 2699 ATOM 80477 O WAT 2700 102.951 6.234 79.764 1.00 0.00 O ATOM 80478 H1 WAT 2700 102.198 6.767 79.508 1.00 0.00 H ATOM 80479 H2 WAT 2700 103.557 6.854 80.169 1.00 0.00 H TER 80481 WAT 2700 ATOM 80481 O WAT 2701 142.548 23.828 110.239 1.00 0.00 O ATOM 80482 H1 WAT 2701 142.424 22.880 110.197 1.00 0.00 H ATOM 80483 H2 WAT 2701 142.992 24.048 109.419 1.00 0.00 H TER 80485 WAT 2701 ATOM 80485 O WAT 2702 67.257 127.997 137.452 1.00 0.00 O ATOM 80486 H1 WAT 2702 67.582 127.600 136.644 1.00 0.00 H ATOM 80487 H2 WAT 2702 66.344 127.715 137.507 1.00 0.00 H TER 80489 WAT 2702 ATOM 80489 O WAT 2703 91.867 138.279 61.805 1.00 0.00 O ATOM 80490 H1 WAT 2703 92.614 138.790 62.115 1.00 0.00 H ATOM 80491 H2 WAT 2703 92.237 137.682 61.155 1.00 0.00 H TER 80493 WAT 2703 ATOM 80493 O WAT 2704 113.246 67.030 150.043 1.00 0.00 O ATOM 80494 H1 WAT 2704 114.169 67.233 150.193 1.00 0.00 H ATOM 80495 H2 WAT 2704 112.953 66.629 150.861 1.00 0.00 H TER 80497 WAT 2704 ATOM 80497 O WAT 2705 19.934 87.896 115.447 1.00 0.00 O ATOM 80498 H1 WAT 2705 19.904 87.524 114.566 1.00 0.00 H ATOM 80499 H2 WAT 2705 19.808 87.147 116.028 1.00 0.00 H TER 80501 WAT 2705 ATOM 80501 O WAT 2706 123.029 6.054 1.986 1.00 0.00 O ATOM 80502 H1 WAT 2706 123.598 6.515 1.370 1.00 0.00 H ATOM 80503 H2 WAT 2706 122.142 6.289 1.716 1.00 0.00 H TER 80505 WAT 2706 ATOM 80505 O WAT 2707 140.220 103.152 87.120 1.00 0.00 O ATOM 80506 H1 WAT 2707 140.462 103.024 86.203 1.00 0.00 H ATOM 80507 H2 WAT 2707 140.761 103.886 87.410 1.00 0.00 H TER 80509 WAT 2707 ATOM 80509 O WAT 2708 115.459 18.061 21.585 1.00 0.00 O ATOM 80510 H1 WAT 2708 116.390 18.282 21.612 1.00 0.00 H ATOM 80511 H2 WAT 2708 115.147 18.440 20.763 1.00 0.00 H TER 80513 WAT 2708 ATOM 80513 O WAT 2709 1.107 18.875 142.090 1.00 0.00 O ATOM 80514 H1 WAT 2709 0.966 18.798 141.146 1.00 0.00 H ATOM 80515 H2 WAT 2709 1.920 19.374 142.170 1.00 0.00 H TER 80517 WAT 2709 ATOM 80517 O WAT 2710 19.668 34.825 158.096 1.00 0.00 O ATOM 80518 H1 WAT 2710 19.305 34.333 157.359 1.00 0.00 H ATOM 80519 H2 WAT 2710 20.350 35.371 157.707 1.00 0.00 H TER 80521 WAT 2710 ATOM 80521 O WAT 2711 113.874 105.083 7.774 1.00 0.00 O ATOM 80522 H1 WAT 2711 114.200 104.464 7.121 1.00 0.00 H ATOM 80523 H2 WAT 2711 114.031 105.944 7.387 1.00 0.00 H TER 80525 WAT 2711 ATOM 80525 O WAT 2712 25.491 21.808 132.778 1.00 0.00 O ATOM 80526 H1 WAT 2712 24.684 21.294 132.796 1.00 0.00 H ATOM 80527 H2 WAT 2712 25.928 21.597 133.603 1.00 0.00 H TER 80529 WAT 2712 ATOM 80529 O WAT 2713 24.107 45.273 133.979 1.00 0.00 O ATOM 80530 H1 WAT 2713 23.940 44.709 133.224 1.00 0.00 H ATOM 80531 H2 WAT 2713 24.202 46.150 133.607 1.00 0.00 H TER 80533 WAT 2713 ATOM 80533 O WAT 2714 70.600 112.492 131.397 1.00 0.00 O ATOM 80534 H1 WAT 2714 70.478 112.220 130.488 1.00 0.00 H ATOM 80535 H2 WAT 2714 71.531 112.708 131.459 1.00 0.00 H TER 80537 WAT 2714 ATOM 80537 O WAT 2715 131.660 87.269 17.220 1.00 0.00 O ATOM 80538 H1 WAT 2715 132.320 86.730 17.657 1.00 0.00 H ATOM 80539 H2 WAT 2715 131.525 86.843 16.374 1.00 0.00 H TER 80541 WAT 2715 ATOM 80541 O WAT 2716 8.795 141.795 92.188 1.00 0.00 O ATOM 80542 H1 WAT 2716 8.659 140.878 92.427 1.00 0.00 H ATOM 80543 H2 WAT 2716 9.742 141.875 92.077 1.00 0.00 H TER 80545 WAT 2716 ATOM 80545 O WAT 2717 29.112 91.416 11.105 1.00 0.00 O ATOM 80546 H1 WAT 2717 29.124 91.193 10.174 1.00 0.00 H ATOM 80547 H2 WAT 2717 28.190 91.354 11.355 1.00 0.00 H TER 80549 WAT 2717 ATOM 80549 O WAT 2718 2.885 90.884 132.239 1.00 0.00 O ATOM 80550 H1 WAT 2718 3.646 91.203 131.754 1.00 0.00 H ATOM 80551 H2 WAT 2718 2.577 91.646 132.729 1.00 0.00 H TER 80553 WAT 2718 ATOM 80553 O WAT 2719 130.514 103.143 117.054 1.00 0.00 O ATOM 80554 H1 WAT 2719 130.431 103.256 116.107 1.00 0.00 H ATOM 80555 H2 WAT 2719 129.775 103.629 117.419 1.00 0.00 H TER 80557 WAT 2719 ATOM 80557 O WAT 2720 112.868 41.124 9.891 1.00 0.00 O ATOM 80558 H1 WAT 2720 112.767 40.722 10.753 1.00 0.00 H ATOM 80559 H2 WAT 2720 112.179 41.788 9.854 1.00 0.00 H TER 80561 WAT 2720 ATOM 80561 O WAT 2721 5.082 47.584 3.851 1.00 0.00 O ATOM 80562 H1 WAT 2721 5.181 48.254 3.174 1.00 0.00 H ATOM 80563 H2 WAT 2721 4.717 46.830 3.389 1.00 0.00 H TER 80565 WAT 2721 ATOM 80565 O WAT 2722 68.823 75.706 54.912 1.00 0.00 O ATOM 80566 H1 WAT 2722 68.654 76.121 54.066 1.00 0.00 H ATOM 80567 H2 WAT 2722 69.292 76.370 55.415 1.00 0.00 H TER 80569 WAT 2722 ATOM 80569 O WAT 2723 18.021 20.238 112.087 1.00 0.00 O ATOM 80570 H1 WAT 2723 18.755 20.614 112.573 1.00 0.00 H ATOM 80571 H2 WAT 2723 17.450 19.871 112.761 1.00 0.00 H TER 80573 WAT 2723 ATOM 80573 O WAT 2724 50.282 38.659 112.538 1.00 0.00 O ATOM 80574 H1 WAT 2724 50.234 38.632 113.494 1.00 0.00 H ATOM 80575 H2 WAT 2724 50.786 39.450 112.346 1.00 0.00 H TER 80577 WAT 2724 ATOM 80577 O WAT 2725 114.286 3.106 119.826 1.00 0.00 O ATOM 80578 H1 WAT 2725 114.332 3.797 119.165 1.00 0.00 H ATOM 80579 H2 WAT 2725 113.938 3.542 120.604 1.00 0.00 H TER 80581 WAT 2725 ATOM 80581 O WAT 2726 60.960 98.970 63.905 1.00 0.00 O ATOM 80582 H1 WAT 2726 61.202 99.121 62.991 1.00 0.00 H ATOM 80583 H2 WAT 2726 60.143 99.455 64.019 1.00 0.00 H TER 80585 WAT 2726 ATOM 80585 O WAT 2727 16.569 16.784 67.041 1.00 0.00 O ATOM 80586 H1 WAT 2727 15.728 16.977 66.626 1.00 0.00 H ATOM 80587 H2 WAT 2727 16.875 17.631 67.366 1.00 0.00 H TER 80589 WAT 2727 ATOM 80589 O WAT 2728 128.019 102.377 75.754 1.00 0.00 O ATOM 80590 H1 WAT 2728 128.459 102.628 76.566 1.00 0.00 H ATOM 80591 H2 WAT 2728 128.414 101.538 75.517 1.00 0.00 H TER 80593 WAT 2728 ATOM 80593 O WAT 2729 115.090 34.538 91.843 1.00 0.00 O ATOM 80594 H1 WAT 2729 115.123 34.608 90.889 1.00 0.00 H ATOM 80595 H2 WAT 2729 115.745 33.874 92.058 1.00 0.00 H TER 80597 WAT 2729 ATOM 80597 O WAT 2730 75.963 20.021 105.227 1.00 0.00 O ATOM 80598 H1 WAT 2730 76.724 19.581 105.605 1.00 0.00 H ATOM 80599 H2 WAT 2730 75.498 19.331 104.754 1.00 0.00 H TER 80601 WAT 2730 ATOM 80601 O WAT 2731 54.832 141.841 11.612 1.00 0.00 O ATOM 80602 H1 WAT 2731 54.893 142.227 10.738 1.00 0.00 H ATOM 80603 H2 WAT 2731 55.718 141.913 11.967 1.00 0.00 H TER 80605 WAT 2731 ATOM 80605 O WAT 2732 98.644 101.715 13.856 1.00 0.00 O ATOM 80606 H1 WAT 2732 99.502 101.735 13.431 1.00 0.00 H ATOM 80607 H2 WAT 2732 98.484 100.788 14.030 1.00 0.00 H TER 80609 WAT 2732 ATOM 80609 O WAT 2733 62.705 92.093 62.391 1.00 0.00 O ATOM 80610 H1 WAT 2733 61.859 92.530 62.485 1.00 0.00 H ATOM 80611 H2 WAT 2733 62.879 92.107 61.450 1.00 0.00 H TER 80613 WAT 2733 ATOM 80613 O WAT 2734 6.779 97.544 64.094 1.00 0.00 O ATOM 80614 H1 WAT 2734 7.644 97.632 64.493 1.00 0.00 H ATOM 80615 H2 WAT 2734 6.644 98.370 63.629 1.00 0.00 H TER 80617 WAT 2734 ATOM 80617 O WAT 2735 9.519 115.989 156.769 1.00 0.00 O ATOM 80618 H1 WAT 2735 8.660 116.409 156.738 1.00 0.00 H ATOM 80619 H2 WAT 2735 10.142 116.712 156.693 1.00 0.00 H TER 80621 WAT 2735 ATOM 80621 O WAT 2736 53.882 138.403 121.300 1.00 0.00 O ATOM 80622 H1 WAT 2736 52.985 138.719 121.198 1.00 0.00 H ATOM 80623 H2 WAT 2736 54.046 137.888 120.509 1.00 0.00 H TER 80625 WAT 2736 ATOM 80625 O WAT 2737 7.104 43.706 10.369 1.00 0.00 O ATOM 80626 H1 WAT 2737 7.976 44.013 10.121 1.00 0.00 H ATOM 80627 H2 WAT 2737 7.148 43.603 11.320 1.00 0.00 H TER 80629 WAT 2737 ATOM 80629 O WAT 2738 62.803 66.877 25.263 1.00 0.00 O ATOM 80630 H1 WAT 2738 62.017 66.477 25.634 1.00 0.00 H ATOM 80631 H2 WAT 2738 63.502 66.249 25.450 1.00 0.00 H TER 80633 WAT 2738 ATOM 80633 O WAT 2739 80.870 97.910 137.289 1.00 0.00 O ATOM 80634 H1 WAT 2739 80.804 97.950 138.243 1.00 0.00 H ATOM 80635 H2 WAT 2739 81.117 98.797 137.028 1.00 0.00 H TER 80637 WAT 2739 ATOM 80637 O WAT 2740 13.877 18.436 104.525 1.00 0.00 O ATOM 80638 H1 WAT 2740 13.882 17.837 105.272 1.00 0.00 H ATOM 80639 H2 WAT 2740 13.001 18.346 104.151 1.00 0.00 H TER 80641 WAT 2740 ATOM 80641 O WAT 2741 25.021 143.788 63.535 1.00 0.00 O ATOM 80642 H1 WAT 2741 25.692 144.311 63.096 1.00 0.00 H ATOM 80643 H2 WAT 2741 24.642 143.251 62.840 1.00 0.00 H TER 80645 WAT 2741 ATOM 80645 O WAT 2742 137.622 111.921 109.868 1.00 0.00 O ATOM 80646 H1 WAT 2742 138.226 111.308 109.447 1.00 0.00 H ATOM 80647 H2 WAT 2742 137.980 112.043 110.747 1.00 0.00 H TER 80649 WAT 2742 ATOM 80649 O WAT 2743 116.396 74.908 3.218 1.00 0.00 O ATOM 80650 H1 WAT 2743 116.975 74.252 2.830 1.00 0.00 H ATOM 80651 H2 WAT 2743 115.514 74.569 3.068 1.00 0.00 H TER 80653 WAT 2743 ATOM 80653 O WAT 2744 71.834 142.433 9.865 1.00 0.00 O ATOM 80654 H1 WAT 2744 72.510 142.994 10.245 1.00 0.00 H ATOM 80655 H2 WAT 2744 72.293 141.624 9.638 1.00 0.00 H TER 80657 WAT 2744 ATOM 80657 O WAT 2745 102.547 119.193 144.581 1.00 0.00 O ATOM 80658 H1 WAT 2745 102.608 118.239 144.616 1.00 0.00 H ATOM 80659 H2 WAT 2745 103.038 119.493 145.345 1.00 0.00 H TER 80661 WAT 2745 ATOM 80661 O WAT 2746 125.362 134.265 64.995 1.00 0.00 O ATOM 80662 H1 WAT 2746 125.139 134.294 64.065 1.00 0.00 H ATOM 80663 H2 WAT 2746 126.314 134.160 65.010 1.00 0.00 H TER 80665 WAT 2746 ATOM 80665 O WAT 2747 31.422 75.321 87.097 1.00 0.00 O ATOM 80666 H1 WAT 2747 30.973 75.448 86.261 1.00 0.00 H ATOM 80667 H2 WAT 2747 31.147 76.067 87.631 1.00 0.00 H TER 80669 WAT 2747 ATOM 80669 O WAT 2748 16.014 132.335 82.154 1.00 0.00 O ATOM 80670 H1 WAT 2748 16.506 132.706 82.887 1.00 0.00 H ATOM 80671 H2 WAT 2748 16.442 132.690 81.374 1.00 0.00 H TER 80673 WAT 2748 ATOM 80673 O WAT 2749 52.965 42.630 84.816 1.00 0.00 O ATOM 80674 H1 WAT 2749 52.200 43.029 84.400 1.00 0.00 H ATOM 80675 H2 WAT 2749 52.874 42.847 85.743 1.00 0.00 H TER 80677 WAT 2749 ATOM 80677 O WAT 2750 67.833 40.883 136.503 1.00 0.00 O ATOM 80678 H1 WAT 2750 67.599 40.388 135.717 1.00 0.00 H ATOM 80679 H2 WAT 2750 67.265 40.529 137.187 1.00 0.00 H TER 80681 WAT 2750 ATOM 80681 O WAT 2751 3.082 131.653 13.231 1.00 0.00 O ATOM 80682 H1 WAT 2751 3.620 131.323 12.512 1.00 0.00 H ATOM 80683 H2 WAT 2751 2.374 132.132 12.800 1.00 0.00 H TER 80685 WAT 2751 ATOM 80685 O WAT 2752 142.504 15.196 10.171 1.00 0.00 O ATOM 80686 H1 WAT 2752 142.130 14.934 11.012 1.00 0.00 H ATOM 80687 H2 WAT 2752 142.793 16.098 10.308 1.00 0.00 H TER 80689 WAT 2752 ATOM 80689 O WAT 2753 133.550 95.213 0.237 1.00 0.00 O ATOM 80690 H1 WAT 2753 133.930 95.524 1.059 1.00 0.00 H ATOM 80691 H2 WAT 2753 132.641 95.010 0.456 1.00 0.00 H TER 80693 WAT 2753 ATOM 80693 O WAT 2754 90.974 137.278 88.195 1.00 0.00 O ATOM 80694 H1 WAT 2754 90.229 137.108 88.771 1.00 0.00 H ATOM 80695 H2 WAT 2754 91.727 137.323 88.783 1.00 0.00 H TER 80697 WAT 2754 ATOM 80697 O WAT 2755 49.287 19.594 152.953 1.00 0.00 O ATOM 80698 H1 WAT 2755 50.136 19.311 153.292 1.00 0.00 H ATOM 80699 H2 WAT 2755 48.761 19.764 153.734 1.00 0.00 H TER 80701 WAT 2755 ATOM 80701 O WAT 2756 83.715 118.220 82.909 1.00 0.00 O ATOM 80702 H1 WAT 2756 82.998 118.241 83.544 1.00 0.00 H ATOM 80703 H2 WAT 2756 83.804 119.128 82.619 1.00 0.00 H TER 80705 WAT 2756 ATOM 80705 O WAT 2757 15.317 139.995 144.452 1.00 0.00 O ATOM 80706 H1 WAT 2757 15.416 140.397 145.316 1.00 0.00 H ATOM 80707 H2 WAT 2757 14.695 139.281 144.591 1.00 0.00 H TER 80709 WAT 2757 ATOM 80709 O WAT 2758 126.657 1.572 118.446 1.00 0.00 O ATOM 80710 H1 WAT 2758 126.684 1.219 119.335 1.00 0.00 H ATOM 80711 H2 WAT 2758 125.930 2.194 118.457 1.00 0.00 H TER 80713 WAT 2758 ATOM 80713 O WAT 2759 136.932 95.536 78.633 1.00 0.00 O ATOM 80714 H1 WAT 2759 136.813 94.713 78.160 1.00 0.00 H ATOM 80715 H2 WAT 2759 137.230 95.271 79.504 1.00 0.00 H TER 80717 WAT 2759 ATOM 80717 O WAT 2760 142.312 63.501 74.144 1.00 0.00 O ATOM 80718 H1 WAT 2760 142.499 63.011 74.945 1.00 0.00 H ATOM 80719 H2 WAT 2760 142.419 62.860 73.441 1.00 0.00 H TER 80721 WAT 2760 ATOM 80721 O WAT 2761 115.733 63.816 76.541 1.00 0.00 O ATOM 80722 H1 WAT 2761 115.222 64.485 76.997 1.00 0.00 H ATOM 80723 H2 WAT 2761 115.937 64.209 75.692 1.00 0.00 H TER 80725 WAT 2761 ATOM 80725 O WAT 2762 122.120 95.994 77.227 1.00 0.00 O ATOM 80726 H1 WAT 2762 122.538 95.632 76.446 1.00 0.00 H ATOM 80727 H2 WAT 2762 122.439 95.447 77.945 1.00 0.00 H TER 80729 WAT 2762 ATOM 80729 O WAT 2763 102.758 36.818 154.610 1.00 0.00 O ATOM 80730 H1 WAT 2763 103.531 37.341 154.394 1.00 0.00 H ATOM 80731 H2 WAT 2763 102.409 36.545 153.762 1.00 0.00 H TER 80733 WAT 2763 ATOM 80733 O WAT 2764 34.004 18.941 129.046 1.00 0.00 O ATOM 80734 H1 WAT 2764 34.774 19.420 128.737 1.00 0.00 H ATOM 80735 H2 WAT 2764 33.287 19.571 128.977 1.00 0.00 H TER 80737 WAT 2764 ATOM 80737 O WAT 2765 99.327 25.248 153.297 1.00 0.00 O ATOM 80738 H1 WAT 2765 98.474 24.812 153.305 1.00 0.00 H ATOM 80739 H2 WAT 2765 99.806 24.821 152.586 1.00 0.00 H TER 80741 WAT 2765 ATOM 80741 O WAT 2766 137.456 139.075 150.175 1.00 0.00 O ATOM 80742 H1 WAT 2766 137.380 138.499 150.936 1.00 0.00 H ATOM 80743 H2 WAT 2766 138.273 138.810 149.754 1.00 0.00 H TER 80745 WAT 2766 ATOM 80745 O WAT 2767 85.902 46.904 91.911 1.00 0.00 O ATOM 80746 H1 WAT 2767 86.044 47.738 92.360 1.00 0.00 H ATOM 80747 H2 WAT 2767 86.238 46.245 92.518 1.00 0.00 H TER 80749 WAT 2767 ATOM 80749 O WAT 2768 98.266 102.900 86.478 1.00 0.00 O ATOM 80750 H1 WAT 2768 97.938 102.459 87.262 1.00 0.00 H ATOM 80751 H2 WAT 2768 97.737 102.543 85.764 1.00 0.00 H TER 80753 WAT 2768 ATOM 80753 O WAT 2769 15.053 136.828 13.422 1.00 0.00 O ATOM 80754 H1 WAT 2769 14.678 137.634 13.067 1.00 0.00 H ATOM 80755 H2 WAT 2769 14.979 136.195 12.709 1.00 0.00 H TER 80757 WAT 2769 ATOM 80757 O WAT 2770 80.428 139.143 67.340 1.00 0.00 O ATOM 80758 H1 WAT 2770 80.835 138.297 67.156 1.00 0.00 H ATOM 80759 H2 WAT 2770 79.713 139.207 66.707 1.00 0.00 H TER 80761 WAT 2770 ATOM 80761 O WAT 2771 101.309 35.711 58.254 1.00 0.00 O ATOM 80762 H1 WAT 2771 101.889 35.692 57.493 1.00 0.00 H ATOM 80763 H2 WAT 2771 100.576 35.147 58.010 1.00 0.00 H TER 80765 WAT 2771 ATOM 80765 O WAT 2772 127.595 9.271 94.485 1.00 0.00 O ATOM 80766 H1 WAT 2772 128.366 9.426 95.032 1.00 0.00 H ATOM 80767 H2 WAT 2772 126.854 9.364 95.084 1.00 0.00 H TER 80769 WAT 2772 ATOM 80769 O WAT 2773 52.571 96.620 14.336 1.00 0.00 O ATOM 80770 H1 WAT 2773 53.518 96.543 14.452 1.00 0.00 H ATOM 80771 H2 WAT 2773 52.398 96.195 13.496 1.00 0.00 H TER 80773 WAT 2773 ATOM 80773 O WAT 2774 127.444 92.790 127.998 1.00 0.00 O ATOM 80774 H1 WAT 2774 126.731 92.242 127.669 1.00 0.00 H ATOM 80775 H2 WAT 2774 127.604 93.421 127.297 1.00 0.00 H TER 80777 WAT 2774 ATOM 80777 O WAT 2775 60.747 34.997 11.552 1.00 0.00 O ATOM 80778 H1 WAT 2775 60.805 35.605 10.815 1.00 0.00 H ATOM 80779 H2 WAT 2775 60.792 34.129 11.151 1.00 0.00 H TER 80781 WAT 2775 ATOM 80781 O WAT 2776 21.834 97.323 25.603 1.00 0.00 O ATOM 80782 H1 WAT 2776 22.712 97.464 25.956 1.00 0.00 H ATOM 80783 H2 WAT 2776 21.631 98.134 25.136 1.00 0.00 H TER 80785 WAT 2776 ATOM 80785 O WAT 2777 118.592 133.744 104.653 1.00 0.00 O ATOM 80786 H1 WAT 2777 119.293 133.520 104.041 1.00 0.00 H ATOM 80787 H2 WAT 2777 119.043 134.137 105.401 1.00 0.00 H TER 80789 WAT 2777 ATOM 80789 O WAT 2778 0.687 37.128 6.474 1.00 0.00 O ATOM 80790 H1 WAT 2778 1.065 37.790 5.895 1.00 0.00 H ATOM 80791 H2 WAT 2778 1.432 36.591 6.742 1.00 0.00 H TER 80793 WAT 2778 ATOM 80793 O WAT 2779 49.640 95.797 29.143 1.00 0.00 O ATOM 80794 H1 WAT 2779 49.648 95.525 30.061 1.00 0.00 H ATOM 80795 H2 WAT 2779 50.091 96.641 29.140 1.00 0.00 H TER 80797 WAT 2779 ATOM 80797 O WAT 2780 145.079 67.665 62.061 1.00 0.00 O ATOM 80798 H1 WAT 2780 145.275 68.195 61.288 1.00 0.00 H ATOM 80799 H2 WAT 2780 144.467 68.198 62.568 1.00 0.00 H TER 80801 WAT 2780 ATOM 80801 O WAT 2781 33.980 34.249 122.258 1.00 0.00 O ATOM 80802 H1 WAT 2781 33.203 34.423 121.727 1.00 0.00 H ATOM 80803 H2 WAT 2781 34.444 33.557 121.786 1.00 0.00 H TER 80805 WAT 2781 ATOM 80805 O WAT 2782 114.048 104.783 27.406 1.00 0.00 O ATOM 80806 H1 WAT 2782 113.327 104.826 28.035 1.00 0.00 H ATOM 80807 H2 WAT 2782 113.819 104.056 26.828 1.00 0.00 H TER 80809 WAT 2782 ATOM 80809 O WAT 2783 52.580 42.673 14.842 1.00 0.00 O ATOM 80810 H1 WAT 2783 52.735 41.891 15.372 1.00 0.00 H ATOM 80811 H2 WAT 2783 52.090 43.259 15.418 1.00 0.00 H TER 80813 WAT 2783 ATOM 80813 O WAT 2784 39.342 101.696 16.841 1.00 0.00 O ATOM 80814 H1 WAT 2784 39.432 101.536 15.902 1.00 0.00 H ATOM 80815 H2 WAT 2784 40.180 101.418 17.213 1.00 0.00 H TER 80817 WAT 2784 ATOM 80817 O WAT 2785 66.917 2.983 156.348 1.00 0.00 O ATOM 80818 H1 WAT 2785 66.829 2.041 156.494 1.00 0.00 H ATOM 80819 H2 WAT 2785 66.973 3.073 155.397 1.00 0.00 H TER 80821 WAT 2785 ATOM 80821 O WAT 2786 110.404 52.539 58.962 1.00 0.00 O ATOM 80822 H1 WAT 2786 109.980 51.859 59.486 1.00 0.00 H ATOM 80823 H2 WAT 2786 110.691 53.191 59.602 1.00 0.00 H TER 80825 WAT 2786 ATOM 80825 O WAT 2787 143.853 88.246 76.634 1.00 0.00 O ATOM 80826 H1 WAT 2787 144.417 88.148 75.867 1.00 0.00 H ATOM 80827 H2 WAT 2787 143.122 88.781 76.326 1.00 0.00 H TER 80829 WAT 2787 ATOM 80829 O WAT 2788 27.342 44.230 5.689 1.00 0.00 O ATOM 80830 H1 WAT 2788 26.938 45.019 6.048 1.00 0.00 H ATOM 80831 H2 WAT 2788 26.606 43.648 5.501 1.00 0.00 H TER 80833 WAT 2788 ATOM 80833 O WAT 2789 132.890 17.132 128.023 1.00 0.00 O ATOM 80834 H1 WAT 2789 132.156 16.524 128.118 1.00 0.00 H ATOM 80835 H2 WAT 2789 132.569 17.803 127.420 1.00 0.00 H TER 80837 WAT 2789 ATOM 80837 O WAT 2790 114.326 55.464 130.448 1.00 0.00 O ATOM 80838 H1 WAT 2790 114.089 55.325 129.531 1.00 0.00 H ATOM 80839 H2 WAT 2790 115.234 55.765 130.417 1.00 0.00 H TER 80841 WAT 2790 ATOM 80841 O WAT 2791 85.431 41.285 92.263 1.00 0.00 O ATOM 80842 H1 WAT 2791 85.344 42.094 91.759 1.00 0.00 H ATOM 80843 H2 WAT 2791 84.586 41.183 92.701 1.00 0.00 H TER 80845 WAT 2791 ATOM 80845 O WAT 2792 117.311 87.025 17.308 1.00 0.00 O ATOM 80846 H1 WAT 2792 117.580 87.692 16.676 1.00 0.00 H ATOM 80847 H2 WAT 2792 117.914 87.134 18.043 1.00 0.00 H TER 80849 WAT 2792 ATOM 80849 O WAT 2793 51.750 57.582 75.503 1.00 0.00 O ATOM 80850 H1 WAT 2793 51.203 58.045 76.138 1.00 0.00 H ATOM 80851 H2 WAT 2793 51.567 56.656 75.660 1.00 0.00 H TER 80853 WAT 2793 ATOM 80853 O WAT 2794 88.082 77.736 89.431 1.00 0.00 O ATOM 80854 H1 WAT 2794 88.007 76.796 89.592 1.00 0.00 H ATOM 80855 H2 WAT 2794 88.764 78.029 90.036 1.00 0.00 H TER 80857 WAT 2794 ATOM 80857 O WAT 2795 32.298 66.940 114.982 1.00 0.00 O ATOM 80858 H1 WAT 2795 32.490 67.716 114.454 1.00 0.00 H ATOM 80859 H2 WAT 2795 31.486 67.156 115.439 1.00 0.00 H TER 80861 WAT 2795 ATOM 80861 O WAT 2796 17.504 145.107 18.748 1.00 0.00 O ATOM 80862 H1 WAT 2796 16.611 145.364 18.980 1.00 0.00 H ATOM 80863 H2 WAT 2796 17.676 144.330 19.280 1.00 0.00 H TER 80865 WAT 2796 ATOM 80865 O WAT 2797 20.759 106.932 63.505 1.00 0.00 O ATOM 80866 H1 WAT 2797 20.628 106.051 63.154 1.00 0.00 H ATOM 80867 H2 WAT 2797 20.838 107.489 62.731 1.00 0.00 H TER 80869 WAT 2797 ATOM 80869 O WAT 2798 34.007 32.273 85.571 1.00 0.00 O ATOM 80870 H1 WAT 2798 33.936 32.628 84.685 1.00 0.00 H ATOM 80871 H2 WAT 2798 34.819 31.766 85.561 1.00 0.00 H TER 80873 WAT 2798 ATOM 80873 O WAT 2799 112.110 67.007 136.212 1.00 0.00 O ATOM 80874 H1 WAT 2799 112.080 66.898 135.262 1.00 0.00 H ATOM 80875 H2 WAT 2799 111.803 67.902 136.360 1.00 0.00 H TER 80877 WAT 2799 ATOM 80877 O WAT 2800 82.417 102.157 99.261 1.00 0.00 O ATOM 80878 H1 WAT 2800 82.894 102.083 98.435 1.00 0.00 H ATOM 80879 H2 WAT 2800 81.996 103.016 99.218 1.00 0.00 H TER 80881 WAT 2800 ATOM 80881 O WAT 2801 91.402 83.075 143.029 1.00 0.00 O ATOM 80882 H1 WAT 2801 91.961 83.472 143.697 1.00 0.00 H ATOM 80883 H2 WAT 2801 90.766 82.559 143.525 1.00 0.00 H TER 80885 WAT 2801 ATOM 80885 O WAT 2802 118.973 42.427 155.000 1.00 0.00 O ATOM 80886 H1 WAT 2802 118.191 42.562 154.465 1.00 0.00 H ATOM 80887 H2 WAT 2802 119.702 42.513 154.385 1.00 0.00 H TER 80889 WAT 2802 ATOM 80889 O WAT 2803 10.210 42.583 122.399 1.00 0.00 O ATOM 80890 H1 WAT 2803 10.507 41.694 122.592 1.00 0.00 H ATOM 80891 H2 WAT 2803 10.032 42.968 123.258 1.00 0.00 H TER 80893 WAT 2803 ATOM 80893 O WAT 2804 15.991 61.542 66.055 1.00 0.00 O ATOM 80894 H1 WAT 2804 15.944 62.496 65.990 1.00 0.00 H ATOM 80895 H2 WAT 2804 15.181 61.234 65.648 1.00 0.00 H TER 80897 WAT 2804 ATOM 80897 O WAT 2805 125.665 98.188 23.666 1.00 0.00 O ATOM 80898 H1 WAT 2805 125.759 97.354 24.125 1.00 0.00 H ATOM 80899 H2 WAT 2805 126.546 98.386 23.347 1.00 0.00 H TER 80901 WAT 2805 ATOM 80901 O WAT 2806 134.018 43.867 101.889 1.00 0.00 O ATOM 80902 H1 WAT 2806 134.634 44.593 101.787 1.00 0.00 H ATOM 80903 H2 WAT 2806 134.483 43.234 102.436 1.00 0.00 H TER 80905 WAT 2806 ATOM 80905 O WAT 2807 27.772 34.265 69.799 1.00 0.00 O ATOM 80906 H1 WAT 2807 27.904 33.317 69.799 1.00 0.00 H ATOM 80907 H2 WAT 2807 28.657 34.630 69.773 1.00 0.00 H TER 80909 WAT 2807 ATOM 80909 O WAT 2808 89.273 21.292 103.641 1.00 0.00 O ATOM 80910 H1 WAT 2808 90.131 21.023 103.971 1.00 0.00 H ATOM 80911 H2 WAT 2808 88.694 21.229 104.400 1.00 0.00 H TER 80913 WAT 2808 ATOM 80913 O WAT 2809 84.364 88.618 60.700 1.00 0.00 O ATOM 80914 H1 WAT 2809 83.727 87.979 61.020 1.00 0.00 H ATOM 80915 H2 WAT 2809 84.189 88.681 59.761 1.00 0.00 H TER 80917 WAT 2809 ATOM 80917 O WAT 2810 66.174 135.732 112.408 1.00 0.00 O ATOM 80918 H1 WAT 2810 66.614 135.624 113.251 1.00 0.00 H ATOM 80919 H2 WAT 2810 65.734 136.580 112.475 1.00 0.00 H TER 80921 WAT 2810 ATOM 80921 O WAT 2811 138.565 63.487 95.838 1.00 0.00 O ATOM 80922 H1 WAT 2811 138.147 63.360 94.986 1.00 0.00 H ATOM 80923 H2 WAT 2811 139.406 63.035 95.762 1.00 0.00 H TER 80925 WAT 2811 ATOM 80925 O WAT 2812 77.104 24.726 59.629 1.00 0.00 O ATOM 80926 H1 WAT 2812 77.257 25.528 59.128 1.00 0.00 H ATOM 80927 H2 WAT 2812 76.843 24.080 58.973 1.00 0.00 H TER 80929 WAT 2812 ATOM 80929 O WAT 2813 77.955 39.454 144.335 1.00 0.00 O ATOM 80930 H1 WAT 2813 77.455 39.747 143.574 1.00 0.00 H ATOM 80931 H2 WAT 2813 78.734 40.010 144.340 1.00 0.00 H TER 80933 WAT 2813 ATOM 80933 O WAT 2814 127.345 93.582 145.871 1.00 0.00 O ATOM 80934 H1 WAT 2814 127.719 93.317 145.030 1.00 0.00 H ATOM 80935 H2 WAT 2814 127.264 92.766 146.365 1.00 0.00 H TER 80937 WAT 2814 ATOM 80937 O WAT 2815 63.490 57.936 113.909 1.00 0.00 O ATOM 80938 H1 WAT 2815 63.403 56.983 113.914 1.00 0.00 H ATOM 80939 H2 WAT 2815 63.876 58.146 114.760 1.00 0.00 H TER 80941 WAT 2815 ATOM 80941 O WAT 2816 36.652 10.632 96.899 1.00 0.00 O ATOM 80942 H1 WAT 2816 36.284 11.305 97.472 1.00 0.00 H ATOM 80943 H2 WAT 2816 35.902 10.093 96.650 1.00 0.00 H TER 80945 WAT 2816 ATOM 80945 O WAT 2817 21.838 117.049 150.457 1.00 0.00 O ATOM 80946 H1 WAT 2817 22.591 116.730 149.961 1.00 0.00 H ATOM 80947 H2 WAT 2817 21.906 116.610 151.305 1.00 0.00 H TER 80949 WAT 2817 ATOM 80949 O WAT 2818 30.147 21.485 66.275 1.00 0.00 O ATOM 80950 H1 WAT 2818 29.202 21.595 66.167 1.00 0.00 H ATOM 80951 H2 WAT 2818 30.484 21.414 65.381 1.00 0.00 H TER 80953 WAT 2818 ATOM 80953 O WAT 2819 117.587 114.391 84.311 1.00 0.00 O ATOM 80954 H1 WAT 2819 118.472 114.652 84.567 1.00 0.00 H ATOM 80955 H2 WAT 2819 117.709 113.899 83.499 1.00 0.00 H TER 80957 WAT 2819 ATOM 80957 O WAT 2820 13.290 107.368 143.897 1.00 0.00 O ATOM 80958 H1 WAT 2820 13.290 107.870 143.082 1.00 0.00 H ATOM 80959 H2 WAT 2820 14.216 107.221 144.089 1.00 0.00 H TER 80961 WAT 2820 ATOM 80961 O WAT 2821 3.768 42.797 146.106 1.00 0.00 O ATOM 80962 H1 WAT 2821 4.118 43.301 146.841 1.00 0.00 H ATOM 80963 H2 WAT 2821 4.309 43.055 145.360 1.00 0.00 H TER 80965 WAT 2821 ATOM 80965 O WAT 2822 135.546 106.834 117.668 1.00 0.00 O ATOM 80966 H1 WAT 2822 135.983 105.986 117.590 1.00 0.00 H ATOM 80967 H2 WAT 2822 135.967 107.383 117.007 1.00 0.00 H TER 80969 WAT 2822 ATOM 80969 O WAT 2823 138.954 83.266 9.996 1.00 0.00 O ATOM 80970 H1 WAT 2823 139.804 82.990 9.654 1.00 0.00 H ATOM 80971 H2 WAT 2823 138.366 83.221 9.241 1.00 0.00 H TER 80973 WAT 2823 ATOM 80973 O WAT 2824 120.320 121.244 113.293 1.00 0.00 O ATOM 80974 H1 WAT 2824 120.621 120.360 113.082 1.00 0.00 H ATOM 80975 H2 WAT 2824 119.438 121.291 112.925 1.00 0.00 H TER 80977 WAT 2824 ATOM 80977 O WAT 2825 26.144 47.469 101.184 1.00 0.00 O ATOM 80978 H1 WAT 2825 26.575 46.868 100.578 1.00 0.00 H ATOM 80979 H2 WAT 2825 26.790 48.158 101.340 1.00 0.00 H TER 80981 WAT 2825 ATOM 80981 O WAT 2826 39.786 128.646 147.728 1.00 0.00 O ATOM 80982 H1 WAT 2826 39.023 128.772 147.163 1.00 0.00 H ATOM 80983 H2 WAT 2826 40.081 127.756 147.536 1.00 0.00 H TER 80985 WAT 2826 ATOM 80985 O WAT 2827 112.220 121.036 15.514 1.00 0.00 O ATOM 80986 H1 WAT 2827 112.733 121.471 14.833 1.00 0.00 H ATOM 80987 H2 WAT 2827 111.878 120.249 15.090 1.00 0.00 H TER 80989 WAT 2827 ATOM 80989 O WAT 2828 52.794 13.490 71.965 1.00 0.00 O ATOM 80990 H1 WAT 2828 52.202 13.160 72.642 1.00 0.00 H ATOM 80991 H2 WAT 2828 52.621 14.431 71.933 1.00 0.00 H TER 80993 WAT 2828 ATOM 80993 O WAT 2829 30.758 29.087 2.491 1.00 0.00 O ATOM 80994 H1 WAT 2829 31.174 29.501 3.247 1.00 0.00 H ATOM 80995 H2 WAT 2829 31.489 28.808 1.940 1.00 0.00 H TER 80997 WAT 2829 ATOM 80997 O WAT 2830 110.877 26.013 84.659 1.00 0.00 O ATOM 80998 H1 WAT 2830 109.930 26.147 84.706 1.00 0.00 H ATOM 80999 H2 WAT 2830 111.252 26.862 84.892 1.00 0.00 H TER 81001 WAT 2830 ATOM 81001 O WAT 2831 90.234 49.764 152.272 1.00 0.00 O ATOM 81002 H1 WAT 2831 90.420 48.921 151.860 1.00 0.00 H ATOM 81003 H2 WAT 2831 89.925 49.539 153.150 1.00 0.00 H TER 81005 WAT 2831 ATOM 81005 O WAT 2832 60.743 34.905 68.225 1.00 0.00 O ATOM 81006 H1 WAT 2832 60.966 34.205 67.611 1.00 0.00 H ATOM 81007 H2 WAT 2832 60.734 35.699 67.691 1.00 0.00 H TER 81009 WAT 2832 ATOM 81009 O WAT 2833 60.682 116.947 65.652 1.00 0.00 O ATOM 81010 H1 WAT 2833 61.566 117.000 65.290 1.00 0.00 H ATOM 81011 H2 WAT 2833 60.549 117.790 66.086 1.00 0.00 H TER 81013 WAT 2833 ATOM 81013 O WAT 2834 15.971 113.429 20.061 1.00 0.00 O ATOM 81014 H1 WAT 2834 16.392 113.244 20.900 1.00 0.00 H ATOM 81015 H2 WAT 2834 15.122 113.803 20.297 1.00 0.00 H TER 81017 WAT 2834 ATOM 81017 O WAT 2835 37.581 119.915 15.314 1.00 0.00 O ATOM 81018 H1 WAT 2835 37.964 120.602 15.860 1.00 0.00 H ATOM 81019 H2 WAT 2835 36.742 120.276 15.028 1.00 0.00 H TER 81021 WAT 2835 ATOM 81021 O WAT 2836 113.919 16.836 13.936 1.00 0.00 O ATOM 81022 H1 WAT 2836 113.027 16.987 13.624 1.00 0.00 H ATOM 81023 H2 WAT 2836 113.863 16.942 14.885 1.00 0.00 H TER 81025 WAT 2836 ATOM 81025 O WAT 2837 4.689 26.079 158.593 1.00 0.00 O ATOM 81026 H1 WAT 2837 4.068 25.368 158.429 1.00 0.00 H ATOM 81027 H2 WAT 2837 4.151 26.870 158.599 1.00 0.00 H TER 81029 WAT 2837 ATOM 81029 O WAT 2838 111.118 11.474 132.364 1.00 0.00 O ATOM 81030 H1 WAT 2838 111.074 11.000 131.533 1.00 0.00 H ATOM 81031 H2 WAT 2838 110.230 11.421 132.717 1.00 0.00 H TER 81033 WAT 2838 ATOM 81033 O WAT 2839 132.199 130.748 24.282 1.00 0.00 O ATOM 81034 H1 WAT 2839 132.025 131.504 24.842 1.00 0.00 H ATOM 81035 H2 WAT 2839 131.791 130.012 24.739 1.00 0.00 H TER 81037 WAT 2839 ATOM 81037 O WAT 2840 60.487 50.044 116.024 1.00 0.00 O ATOM 81038 H1 WAT 2840 61.370 49.677 116.052 1.00 0.00 H ATOM 81039 H2 WAT 2840 60.148 49.920 116.911 1.00 0.00 H TER 81041 WAT 2840 ATOM 81041 O WAT 2841 13.588 135.650 21.236 1.00 0.00 O ATOM 81042 H1 WAT 2841 13.915 135.189 22.009 1.00 0.00 H ATOM 81043 H2 WAT 2841 12.657 135.785 21.413 1.00 0.00 H TER 81045 WAT 2841 ATOM 81045 O WAT 2842 65.094 62.476 2.870 1.00 0.00 O ATOM 81046 H1 WAT 2842 65.286 63.268 3.373 1.00 0.00 H ATOM 81047 H2 WAT 2842 64.164 62.548 2.655 1.00 0.00 H TER 81049 WAT 2842 ATOM 81049 O WAT 2843 130.267 136.591 81.289 1.00 0.00 O ATOM 81050 H1 WAT 2843 130.667 135.738 81.457 1.00 0.00 H ATOM 81051 H2 WAT 2843 130.843 137.216 81.729 1.00 0.00 H TER 81053 WAT 2843 ATOM 81053 O WAT 2844 62.083 48.185 104.322 1.00 0.00 O ATOM 81054 H1 WAT 2844 61.453 48.588 103.724 1.00 0.00 H ATOM 81055 H2 WAT 2844 62.394 48.909 104.865 1.00 0.00 H TER 81057 WAT 2844 ATOM 81057 O WAT 2845 145.775 57.345 63.291 1.00 0.00 O ATOM 81058 H1 WAT 2845 145.883 58.157 63.787 1.00 0.00 H ATOM 81059 H2 WAT 2845 145.659 56.670 63.960 1.00 0.00 H TER 81061 WAT 2845 ATOM 81061 O WAT 2846 55.425 32.386 8.090 1.00 0.00 O ATOM 81062 H1 WAT 2846 56.161 32.846 8.495 1.00 0.00 H ATOM 81063 H2 WAT 2846 54.855 32.155 8.823 1.00 0.00 H TER 81065 WAT 2846 ATOM 81065 O WAT 2847 20.402 82.300 101.606 1.00 0.00 O ATOM 81066 H1 WAT 2847 20.351 83.093 102.140 1.00 0.00 H ATOM 81067 H2 WAT 2847 20.859 81.667 102.160 1.00 0.00 H TER 81069 WAT 2847 ATOM 81069 O WAT 2848 100.630 30.260 59.777 1.00 0.00 O ATOM 81070 H1 WAT 2848 100.641 30.557 58.867 1.00 0.00 H ATOM 81071 H2 WAT 2848 99.740 30.442 60.078 1.00 0.00 H TER 81073 WAT 2848 ATOM 81073 O WAT 2849 42.211 82.937 152.696 1.00 0.00 O ATOM 81074 H1 WAT 2849 42.150 83.111 151.757 1.00 0.00 H ATOM 81075 H2 WAT 2849 42.857 82.235 152.769 1.00 0.00 H TER 81077 WAT 2849 ATOM 81077 O WAT 2850 21.726 105.058 87.723 1.00 0.00 O ATOM 81078 H1 WAT 2850 21.380 104.208 87.995 1.00 0.00 H ATOM 81079 H2 WAT 2850 21.036 105.431 87.174 1.00 0.00 H TER 81081 WAT 2850 ATOM 81081 O WAT 2851 133.808 23.290 14.239 1.00 0.00 O ATOM 81082 H1 WAT 2851 133.705 22.377 13.973 1.00 0.00 H ATOM 81083 H2 WAT 2851 133.568 23.299 15.166 1.00 0.00 H TER 81085 WAT 2851 ATOM 81085 O WAT 2852 87.372 18.581 89.373 1.00 0.00 O ATOM 81086 H1 WAT 2852 87.094 19.302 88.808 1.00 0.00 H ATOM 81087 H2 WAT 2852 88.152 18.913 89.817 1.00 0.00 H TER 81089 WAT 2852 ATOM 81089 O WAT 2853 134.366 142.780 110.041 1.00 0.00 O ATOM 81090 H1 WAT 2853 134.351 141.826 109.966 1.00 0.00 H ATOM 81091 H2 WAT 2853 134.460 143.090 109.140 1.00 0.00 H TER 81093 WAT 2853 ATOM 81093 O WAT 2854 111.710 81.765 5.758 1.00 0.00 O ATOM 81094 H1 WAT 2854 111.387 82.573 5.358 1.00 0.00 H ATOM 81095 H2 WAT 2854 112.188 81.325 5.055 1.00 0.00 H TER 81097 WAT 2854 ATOM 81097 O WAT 2855 100.152 9.297 62.978 1.00 0.00 O ATOM 81098 H1 WAT 2855 101.009 8.908 62.803 1.00 0.00 H ATOM 81099 H2 WAT 2855 99.711 9.297 62.129 1.00 0.00 H TER 81101 WAT 2855 ATOM 81101 O WAT 2856 32.283 29.820 67.028 1.00 0.00 O ATOM 81102 H1 WAT 2856 32.430 28.915 66.753 1.00 0.00 H ATOM 81103 H2 WAT 2856 31.857 29.744 67.882 1.00 0.00 H TER 81105 WAT 2856 ATOM 81105 O WAT 2857 50.788 19.569 105.267 1.00 0.00 O ATOM 81106 H1 WAT 2857 50.695 19.602 106.219 1.00 0.00 H ATOM 81107 H2 WAT 2857 51.730 19.643 105.115 1.00 0.00 H TER 81109 WAT 2857 ATOM 81109 O WAT 2858 99.770 63.862 114.913 1.00 0.00 O ATOM 81110 H1 WAT 2858 99.565 64.737 114.582 1.00 0.00 H ATOM 81111 H2 WAT 2858 99.741 63.954 115.865 1.00 0.00 H TER 81113 WAT 2858 ATOM 81113 O WAT 2859 77.106 45.709 88.918 1.00 0.00 O ATOM 81114 H1 WAT 2859 76.248 45.759 89.340 1.00 0.00 H ATOM 81115 H2 WAT 2859 77.041 44.954 88.334 1.00 0.00 H TER 81117 WAT 2859 ATOM 81117 O WAT 2860 18.045 138.630 140.193 1.00 0.00 O ATOM 81118 H1 WAT 2860 18.383 137.810 140.553 1.00 0.00 H ATOM 81119 H2 WAT 2860 18.667 139.295 140.487 1.00 0.00 H TER 81121 WAT 2860 ATOM 81121 O WAT 2861 75.979 50.806 6.549 1.00 0.00 O ATOM 81122 H1 WAT 2861 76.245 49.909 6.345 1.00 0.00 H ATOM 81123 H2 WAT 2861 76.223 51.310 5.773 1.00 0.00 H TER 81125 WAT 2861 ATOM 81125 O WAT 2862 47.650 76.033 92.861 1.00 0.00 O ATOM 81126 H1 WAT 2862 47.067 75.916 92.111 1.00 0.00 H ATOM 81127 H2 WAT 2862 47.513 75.250 93.395 1.00 0.00 H TER 81129 WAT 2862 ATOM 81129 O WAT 2863 57.159 131.945 4.370 1.00 0.00 O ATOM 81130 H1 WAT 2863 57.788 132.637 4.575 1.00 0.00 H ATOM 81131 H2 WAT 2863 56.450 132.394 3.910 1.00 0.00 H TER 81133 WAT 2863 ATOM 81133 O WAT 2864 110.857 83.869 4.084 1.00 0.00 O ATOM 81134 H1 WAT 2864 110.044 83.695 3.610 1.00 0.00 H ATOM 81135 H2 WAT 2864 110.664 84.639 4.619 1.00 0.00 H TER 81137 WAT 2864 ATOM 81137 O WAT 2865 15.784 71.584 136.225 1.00 0.00 O ATOM 81138 H1 WAT 2865 15.287 71.668 137.038 1.00 0.00 H ATOM 81139 H2 WAT 2865 16.255 70.756 136.316 1.00 0.00 H TER 81141 WAT 2865 ATOM 81141 O WAT 2866 84.820 50.348 79.739 1.00 0.00 O ATOM 81142 H1 WAT 2866 85.159 50.094 80.597 1.00 0.00 H ATOM 81143 H2 WAT 2866 84.079 49.760 79.590 1.00 0.00 H TER 81145 WAT 2866 ATOM 81145 O WAT 2867 16.609 115.235 119.711 1.00 0.00 O ATOM 81146 H1 WAT 2867 16.939 114.481 119.224 1.00 0.00 H ATOM 81147 H2 WAT 2867 17.316 115.878 119.665 1.00 0.00 H TER 81149 WAT 2867 ATOM 81149 O WAT 2868 145.180 96.011 96.713 1.00 0.00 O ATOM 81150 H1 WAT 2868 145.771 96.406 96.072 1.00 0.00 H ATOM 81151 H2 WAT 2868 145.631 96.115 97.550 1.00 0.00 H TER 81153 WAT 2868 ATOM 81153 O WAT 2869 142.204 14.199 118.886 1.00 0.00 O ATOM 81154 H1 WAT 2869 141.965 14.973 118.375 1.00 0.00 H ATOM 81155 H2 WAT 2869 142.542 13.580 118.239 1.00 0.00 H TER 81157 WAT 2869 ATOM 81157 O WAT 2870 1.194 54.001 148.122 1.00 0.00 O ATOM 81158 H1 WAT 2870 1.210 54.958 148.112 1.00 0.00 H ATOM 81159 H2 WAT 2870 0.347 53.780 148.509 1.00 0.00 H TER 81161 WAT 2870 ATOM 81161 O WAT 2871 30.949 108.629 80.667 1.00 0.00 O ATOM 81162 H1 WAT 2871 31.594 109.318 80.508 1.00 0.00 H ATOM 81163 H2 WAT 2871 30.155 108.939 80.231 1.00 0.00 H TER 81165 WAT 2871 ATOM 81165 O WAT 2872 33.893 79.167 88.924 1.00 0.00 O ATOM 81166 H1 WAT 2872 34.819 78.923 88.930 1.00 0.00 H ATOM 81167 H2 WAT 2872 33.701 79.401 89.832 1.00 0.00 H TER 81169 WAT 2872 ATOM 81169 O WAT 2873 136.683 125.861 84.854 1.00 0.00 O ATOM 81170 H1 WAT 2873 135.901 125.456 84.478 1.00 0.00 H ATOM 81171 H2 WAT 2873 136.955 125.258 85.546 1.00 0.00 H TER 81173 WAT 2873 ATOM 81173 O WAT 2874 120.850 82.117 151.696 1.00 0.00 O ATOM 81174 H1 WAT 2874 121.173 82.240 150.803 1.00 0.00 H ATOM 81175 H2 WAT 2874 121.360 81.382 152.036 1.00 0.00 H TER 81177 WAT 2874 ATOM 81177 O WAT 2875 37.063 29.019 146.472 1.00 0.00 O ATOM 81178 H1 WAT 2875 37.285 28.620 147.313 1.00 0.00 H ATOM 81179 H2 WAT 2875 36.681 29.866 146.701 1.00 0.00 H TER 81181 WAT 2875 ATOM 81181 O WAT 2876 13.923 125.202 140.711 1.00 0.00 O ATOM 81182 H1 WAT 2876 13.479 126.033 140.879 1.00 0.00 H ATOM 81183 H2 WAT 2876 14.765 125.285 141.158 1.00 0.00 H TER 81185 WAT 2876 ATOM 81185 O WAT 2877 88.555 121.762 82.691 1.00 0.00 O ATOM 81186 H1 WAT 2877 87.985 122.494 82.926 1.00 0.00 H ATOM 81187 H2 WAT 2877 89.422 122.155 82.595 1.00 0.00 H TER 81189 WAT 2877 ATOM 81189 O WAT 2878 96.405 56.723 65.719 1.00 0.00 O ATOM 81190 H1 WAT 2878 96.356 57.646 65.470 1.00 0.00 H ATOM 81191 H2 WAT 2878 97.043 56.345 65.114 1.00 0.00 H TER 81193 WAT 2878 ATOM 81193 O WAT 2879 71.129 4.323 65.385 1.00 0.00 O ATOM 81194 H1 WAT 2879 71.069 3.551 64.822 1.00 0.00 H ATOM 81195 H2 WAT 2879 70.222 4.607 65.499 1.00 0.00 H TER 81197 WAT 2879 ATOM 81197 O WAT 2880 110.560 47.986 122.939 1.00 0.00 O ATOM 81198 H1 WAT 2880 110.344 48.916 123.009 1.00 0.00 H ATOM 81199 H2 WAT 2880 109.857 47.541 123.412 1.00 0.00 H TER 81201 WAT 2880 ATOM 81201 O WAT 2881 105.092 12.786 89.563 1.00 0.00 O ATOM 81202 H1 WAT 2881 104.205 12.456 89.420 1.00 0.00 H ATOM 81203 H2 WAT 2881 105.519 12.703 88.710 1.00 0.00 H TER 81205 WAT 2881 ATOM 81205 O WAT 2882 75.897 28.116 154.553 1.00 0.00 O ATOM 81206 H1 WAT 2882 75.466 28.774 154.008 1.00 0.00 H ATOM 81207 H2 WAT 2882 76.831 28.302 154.458 1.00 0.00 H TER 81209 WAT 2882 ATOM 81209 O WAT 2883 51.071 1.878 81.609 1.00 0.00 O ATOM 81210 H1 WAT 2883 50.272 1.500 81.242 1.00 0.00 H ATOM 81211 H2 WAT 2883 50.795 2.259 82.443 1.00 0.00 H TER 81213 WAT 2883 ATOM 81213 O WAT 2884 65.685 65.742 88.980 1.00 0.00 O ATOM 81214 H1 WAT 2884 65.744 66.394 88.281 1.00 0.00 H ATOM 81215 H2 WAT 2884 65.121 66.147 89.638 1.00 0.00 H TER 81217 WAT 2884 ATOM 81217 O WAT 2885 127.014 50.610 76.580 1.00 0.00 O ATOM 81218 H1 WAT 2885 126.449 50.206 75.922 1.00 0.00 H ATOM 81219 H2 WAT 2885 127.817 50.089 76.559 1.00 0.00 H TER 81221 WAT 2885 ATOM 81221 O WAT 2886 64.268 22.884 103.392 1.00 0.00 O ATOM 81222 H1 WAT 2886 63.357 23.017 103.132 1.00 0.00 H ATOM 81223 H2 WAT 2886 64.257 22.069 103.895 1.00 0.00 H TER 81225 WAT 2886 ATOM 81225 O WAT 2887 79.398 145.784 139.845 1.00 0.00 O ATOM 81226 H1 WAT 2887 79.992 146.103 140.524 1.00 0.00 H ATOM 81227 H2 WAT 2887 79.971 145.547 139.116 1.00 0.00 H TER 81229 WAT 2887 ATOM 81229 O WAT 2888 50.320 73.823 95.582 1.00 0.00 O ATOM 81230 H1 WAT 2888 50.159 72.900 95.385 1.00 0.00 H ATOM 81231 H2 WAT 2888 49.572 74.283 95.204 1.00 0.00 H TER 81233 WAT 2888 ATOM 81233 O WAT 2889 59.265 103.984 59.946 1.00 0.00 O ATOM 81234 H1 WAT 2889 58.778 103.649 59.193 1.00 0.00 H ATOM 81235 H2 WAT 2889 60.165 104.068 59.630 1.00 0.00 H TER 81237 WAT 2889 ATOM 81237 O WAT 2890 20.253 89.167 59.938 1.00 0.00 O ATOM 81238 H1 WAT 2890 20.072 90.104 60.019 1.00 0.00 H ATOM 81239 H2 WAT 2890 19.468 88.806 59.527 1.00 0.00 H TER 81241 WAT 2890 ATOM 81241 O WAT 2891 58.619 77.138 152.298 1.00 0.00 O ATOM 81242 H1 WAT 2891 57.912 77.673 152.657 1.00 0.00 H ATOM 81243 H2 WAT 2891 58.306 76.238 152.382 1.00 0.00 H TER 81245 WAT 2891 ATOM 81245 O WAT 2892 98.652 81.686 11.007 1.00 0.00 O ATOM 81246 H1 WAT 2892 98.681 81.078 10.269 1.00 0.00 H ATOM 81247 H2 WAT 2892 97.731 81.936 11.076 1.00 0.00 H TER 81249 WAT 2892 ATOM 81249 O WAT 2893 124.113 73.875 70.569 1.00 0.00 O ATOM 81250 H1 WAT 2893 123.243 73.476 70.608 1.00 0.00 H ATOM 81251 H2 WAT 2893 123.982 74.688 70.081 1.00 0.00 H TER 81253 WAT 2893 ATOM 81253 O WAT 2894 41.197 139.793 1.064 1.00 0.00 O ATOM 81254 H1 WAT 2894 41.019 140.088 1.957 1.00 0.00 H ATOM 81255 H2 WAT 2894 40.591 139.066 0.926 1.00 0.00 H TER 81257 WAT 2894 ATOM 81257 O WAT 2895 7.694 138.701 100.980 1.00 0.00 O ATOM 81258 H1 WAT 2895 7.578 138.544 100.043 1.00 0.00 H ATOM 81259 H2 WAT 2895 8.559 139.104 101.050 1.00 0.00 H TER 81261 WAT 2895 ATOM 81261 O WAT 2896 72.120 58.591 155.167 1.00 0.00 O ATOM 81262 H1 WAT 2896 71.922 58.878 154.276 1.00 0.00 H ATOM 81263 H2 WAT 2896 71.806 57.687 155.203 1.00 0.00 H TER 81265 WAT 2896 ATOM 81265 O WAT 2897 28.654 7.778 93.580 1.00 0.00 O ATOM 81266 H1 WAT 2897 27.740 8.058 93.524 1.00 0.00 H ATOM 81267 H2 WAT 2897 29.154 8.524 93.250 1.00 0.00 H TER 81269 WAT 2897 ATOM 81269 O WAT 2898 93.969 6.372 64.861 1.00 0.00 O ATOM 81270 H1 WAT 2898 93.505 7.003 65.411 1.00 0.00 H ATOM 81271 H2 WAT 2898 94.494 6.911 64.269 1.00 0.00 H TER 81273 WAT 2898 ATOM 81273 O WAT 2899 99.014 2.501 152.553 1.00 0.00 O ATOM 81274 H1 WAT 2899 98.246 2.263 152.033 1.00 0.00 H ATOM 81275 H2 WAT 2899 99.526 3.070 151.978 1.00 0.00 H TER 81277 WAT 2899 ATOM 81277 O WAT 2900 120.785 66.045 100.341 1.00 0.00 O ATOM 81278 H1 WAT 2900 120.144 65.598 99.788 1.00 0.00 H ATOM 81279 H2 WAT 2900 120.396 66.903 100.513 1.00 0.00 H TER 81281 WAT 2900 ATOM 81281 O WAT 2901 104.139 108.593 101.227 1.00 0.00 O ATOM 81282 H1 WAT 2901 104.194 108.789 100.292 1.00 0.00 H ATOM 81283 H2 WAT 2901 104.532 107.724 101.313 1.00 0.00 H TER 81285 WAT 2901 ATOM 81285 O WAT 2902 9.319 94.205 101.940 1.00 0.00 O ATOM 81286 H1 WAT 2902 8.854 94.860 101.419 1.00 0.00 H ATOM 81287 H2 WAT 2902 10.211 94.545 102.012 1.00 0.00 H TER 81289 WAT 2902 ATOM 81289 O WAT 2903 123.091 86.549 132.703 1.00 0.00 O ATOM 81290 H1 WAT 2903 122.401 86.946 132.172 1.00 0.00 H ATOM 81291 H2 WAT 2903 123.205 85.674 132.331 1.00 0.00 H TER 81293 WAT 2903 ATOM 81293 O WAT 2904 94.939 97.364 62.229 1.00 0.00 O ATOM 81294 H1 WAT 2904 94.538 96.497 62.167 1.00 0.00 H ATOM 81295 H2 WAT 2904 94.258 97.965 61.926 1.00 0.00 H TER 81297 WAT 2904 ATOM 81297 O WAT 2905 109.558 17.920 103.149 1.00 0.00 O ATOM 81298 H1 WAT 2905 108.810 17.958 102.553 1.00 0.00 H ATOM 81299 H2 WAT 2905 110.115 18.651 102.881 1.00 0.00 H TER 81301 WAT 2905 ATOM 81301 O WAT 2906 126.477 6.996 90.061 1.00 0.00 O ATOM 81302 H1 WAT 2906 126.907 6.976 90.916 1.00 0.00 H ATOM 81303 H2 WAT 2906 125.612 6.618 90.219 1.00 0.00 H TER 81305 WAT 2906 ATOM 81305 O WAT 2907 143.433 103.733 103.353 1.00 0.00 O ATOM 81306 H1 WAT 2907 143.356 102.835 103.676 1.00 0.00 H ATOM 81307 H2 WAT 2907 142.800 103.784 102.637 1.00 0.00 H TER 81309 WAT 2907 ATOM 81309 O WAT 2908 2.454 115.321 146.755 1.00 0.00 O ATOM 81310 H1 WAT 2908 3.072 115.978 146.434 1.00 0.00 H ATOM 81311 H2 WAT 2908 1.603 115.759 146.728 1.00 0.00 H TER 81313 WAT 2908 ATOM 81313 O WAT 2909 76.302 1.620 67.739 1.00 0.00 O ATOM 81314 H1 WAT 2909 76.134 1.935 68.627 1.00 0.00 H ATOM 81315 H2 WAT 2909 75.621 0.966 67.584 1.00 0.00 H TER 81317 WAT 2909 ATOM 81317 O WAT 2910 25.607 6.223 96.955 1.00 0.00 O ATOM 81318 H1 WAT 2910 25.578 6.141 97.908 1.00 0.00 H ATOM 81319 H2 WAT 2910 26.432 5.808 96.704 1.00 0.00 H TER 81321 WAT 2910 ATOM 81321 O WAT 2911 47.467 138.843 4.137 1.00 0.00 O ATOM 81322 H1 WAT 2911 46.566 138.655 3.874 1.00 0.00 H ATOM 81323 H2 WAT 2911 47.987 138.672 3.352 1.00 0.00 H TER 81325 WAT 2911 ATOM 81325 O WAT 2912 105.978 24.257 65.182 1.00 0.00 O ATOM 81326 H1 WAT 2912 105.225 23.671 65.095 1.00 0.00 H ATOM 81327 H2 WAT 2912 105.594 25.115 65.359 1.00 0.00 H TER 81329 WAT 2912 ATOM 81329 O WAT 2913 12.936 39.863 65.494 1.00 0.00 O ATOM 81330 H1 WAT 2913 13.013 39.542 66.393 1.00 0.00 H ATOM 81331 H2 WAT 2913 13.646 40.499 65.405 1.00 0.00 H TER 81333 WAT 2913 ATOM 81333 O WAT 2914 48.738 41.689 9.515 1.00 0.00 O ATOM 81334 H1 WAT 2914 49.271 42.099 10.197 1.00 0.00 H ATOM 81335 H2 WAT 2914 48.033 41.252 9.993 1.00 0.00 H TER 81337 WAT 2914 ATOM 81337 O WAT 2915 14.892 34.396 78.299 1.00 0.00 O ATOM 81338 H1 WAT 2915 14.259 34.216 77.605 1.00 0.00 H ATOM 81339 H2 WAT 2915 15.209 33.533 78.566 1.00 0.00 H TER 81341 WAT 2915 ATOM 81341 O WAT 2916 79.165 30.633 114.825 1.00 0.00 O ATOM 81342 H1 WAT 2916 79.323 31.473 114.392 1.00 0.00 H ATOM 81343 H2 WAT 2916 78.309 30.735 115.241 1.00 0.00 H TER 81345 WAT 2916 ATOM 81345 O WAT 2917 132.984 87.302 156.795 1.00 0.00 O ATOM 81346 H1 WAT 2917 133.231 86.446 157.144 1.00 0.00 H ATOM 81347 H2 WAT 2917 132.138 87.491 157.202 1.00 0.00 H TER 81349 WAT 2917 ATOM 81349 O WAT 2918 62.298 10.700 70.790 1.00 0.00 O ATOM 81350 H1 WAT 2918 62.879 11.459 70.851 1.00 0.00 H ATOM 81351 H2 WAT 2918 62.334 10.302 71.660 1.00 0.00 H TER 81353 WAT 2918 ATOM 81353 O WAT 2919 59.920 18.545 117.700 1.00 0.00 O ATOM 81354 H1 WAT 2919 59.591 17.752 118.124 1.00 0.00 H ATOM 81355 H2 WAT 2919 59.382 19.250 118.061 1.00 0.00 H TER 81357 WAT 2919 ATOM 81357 O WAT 2920 71.778 13.274 144.660 1.00 0.00 O ATOM 81358 H1 WAT 2920 72.529 12.986 144.141 1.00 0.00 H ATOM 81359 H2 WAT 2920 71.068 12.687 144.402 1.00 0.00 H TER 81361 WAT 2920 ATOM 81361 O WAT 2921 10.158 36.102 81.445 1.00 0.00 O ATOM 81362 H1 WAT 2921 10.043 36.983 81.087 1.00 0.00 H ATOM 81363 H2 WAT 2921 10.894 35.738 80.952 1.00 0.00 H TER 81365 WAT 2921 ATOM 81365 O WAT 2922 26.160 70.728 98.823 1.00 0.00 O ATOM 81366 H1 WAT 2922 25.543 70.488 99.515 1.00 0.00 H ATOM 81367 H2 WAT 2922 26.978 70.911 99.285 1.00 0.00 H TER 81369 WAT 2922 ATOM 81369 O WAT 2923 142.104 5.874 15.430 1.00 0.00 O ATOM 81370 H1 WAT 2923 141.845 4.981 15.655 1.00 0.00 H ATOM 81371 H2 WAT 2923 142.556 6.196 16.210 1.00 0.00 H TER 81373 WAT 2923 ATOM 81373 O WAT 2924 5.082 45.315 65.407 1.00 0.00 O ATOM 81374 H1 WAT 2924 4.506 45.192 66.162 1.00 0.00 H ATOM 81375 H2 WAT 2924 4.781 44.668 64.769 1.00 0.00 H TER 81377 WAT 2924 ATOM 81377 O WAT 2925 22.884 17.363 70.303 1.00 0.00 O ATOM 81378 H1 WAT 2925 23.650 16.978 70.728 1.00 0.00 H ATOM 81379 H2 WAT 2925 23.246 18.001 69.688 1.00 0.00 H TER 81381 WAT 2925 ATOM 81381 O WAT 2926 40.321 119.735 144.188 1.00 0.00 O ATOM 81382 H1 WAT 2926 40.210 120.230 143.376 1.00 0.00 H ATOM 81383 H2 WAT 2926 39.464 119.775 144.612 1.00 0.00 H TER 81385 WAT 2926 ATOM 81385 O WAT 2927 124.759 49.714 95.672 1.00 0.00 O ATOM 81386 H1 WAT 2927 125.397 49.525 96.360 1.00 0.00 H ATOM 81387 H2 WAT 2927 125.044 50.550 95.304 1.00 0.00 H TER 81389 WAT 2927 ATOM 81389 O WAT 2928 142.973 88.979 156.038 1.00 0.00 O ATOM 81390 H1 WAT 2928 142.365 88.497 156.599 1.00 0.00 H ATOM 81391 H2 WAT 2928 142.486 89.760 155.774 1.00 0.00 H TER 81393 WAT 2928 ATOM 81393 O WAT 2929 58.152 79.192 142.984 1.00 0.00 O ATOM 81394 H1 WAT 2929 57.553 79.748 142.486 1.00 0.00 H ATOM 81395 H2 WAT 2929 59.024 79.451 142.685 1.00 0.00 H TER 81397 WAT 2929 ATOM 81397 O WAT 2930 138.542 59.786 56.843 1.00 0.00 O ATOM 81398 H1 WAT 2930 139.350 60.281 56.978 1.00 0.00 H ATOM 81399 H2 WAT 2930 137.917 60.178 57.452 1.00 0.00 H TER 81401 WAT 2930 ATOM 81401 O WAT 2931 134.405 68.207 121.546 1.00 0.00 O ATOM 81402 H1 WAT 2931 133.634 68.406 121.015 1.00 0.00 H ATOM 81403 H2 WAT 2931 134.210 68.587 122.402 1.00 0.00 H TER 81405 WAT 2931 ATOM 81405 O WAT 2932 121.707 109.244 102.485 1.00 0.00 O ATOM 81406 H1 WAT 2932 122.202 109.597 103.224 1.00 0.00 H ATOM 81407 H2 WAT 2932 121.080 109.933 102.266 1.00 0.00 H TER 81409 WAT 2932 ATOM 81409 O WAT 2933 99.973 130.156 107.614 1.00 0.00 O ATOM 81410 H1 WAT 2933 100.131 131.099 107.645 1.00 0.00 H ATOM 81411 H2 WAT 2933 100.843 129.764 107.695 1.00 0.00 H TER 81413 WAT 2933 ATOM 81413 O WAT 2934 90.507 35.092 92.175 1.00 0.00 O ATOM 81414 H1 WAT 2934 90.956 34.267 91.988 1.00 0.00 H ATOM 81415 H2 WAT 2934 89.729 35.073 91.618 1.00 0.00 H TER 81417 WAT 2934 ATOM 81417 O WAT 2935 5.514 115.809 71.588 1.00 0.00 O ATOM 81418 H1 WAT 2935 4.682 115.720 72.053 1.00 0.00 H ATOM 81419 H2 WAT 2935 6.082 115.149 71.985 1.00 0.00 H TER 81421 WAT 2935 ATOM 81421 O WAT 2936 51.322 57.029 88.324 1.00 0.00 O ATOM 81422 H1 WAT 2936 50.663 57.065 87.631 1.00 0.00 H ATOM 81423 H2 WAT 2936 50.821 57.111 89.136 1.00 0.00 H TER 81425 WAT 2936 ATOM 81425 O WAT 2937 104.021 99.416 156.079 1.00 0.00 O ATOM 81426 H1 WAT 2937 103.323 99.240 155.448 1.00 0.00 H ATOM 81427 H2 WAT 2937 104.711 99.833 155.562 1.00 0.00 H TER 81429 WAT 2937 ATOM 81429 O WAT 2938 50.883 128.838 117.760 1.00 0.00 O ATOM 81430 H1 WAT 2938 50.109 129.271 117.401 1.00 0.00 H ATOM 81431 H2 WAT 2938 51.093 129.339 118.549 1.00 0.00 H TER 81433 WAT 2938 ATOM 81433 O WAT 2939 104.034 137.091 114.656 1.00 0.00 O ATOM 81434 H1 WAT 2939 103.184 136.941 115.070 1.00 0.00 H ATOM 81435 H2 WAT 2939 103.901 137.865 114.108 1.00 0.00 H TER 81437 WAT 2939 ATOM 81437 O WAT 2940 37.441 22.697 2.543 1.00 0.00 O ATOM 81438 H1 WAT 2940 36.668 22.364 2.087 1.00 0.00 H ATOM 81439 H2 WAT 2940 37.625 22.040 3.214 1.00 0.00 H TER 81441 WAT 2940 ATOM 81441 O WAT 2941 3.379 125.422 81.406 1.00 0.00 O ATOM 81442 H1 WAT 2941 2.486 125.424 81.060 1.00 0.00 H ATOM 81443 H2 WAT 2941 3.284 125.701 82.316 1.00 0.00 H TER 81445 WAT 2941 ATOM 81445 O WAT 2942 39.034 3.609 7.293 1.00 0.00 O ATOM 81446 H1 WAT 2942 38.687 2.747 7.525 1.00 0.00 H ATOM 81447 H2 WAT 2942 38.257 4.151 7.156 1.00 0.00 H TER 81449 WAT 2942 ATOM 81449 O WAT 2943 28.872 138.136 123.071 1.00 0.00 O ATOM 81450 H1 WAT 2943 28.722 137.622 122.278 1.00 0.00 H ATOM 81451 H2 WAT 2943 29.266 137.518 123.687 1.00 0.00 H TER 81453 WAT 2943 ATOM 81453 O WAT 2944 100.051 58.461 110.611 1.00 0.00 O ATOM 81454 H1 WAT 2944 100.133 57.933 109.817 1.00 0.00 H ATOM 81455 H2 WAT 2944 100.014 59.364 110.296 1.00 0.00 H TER 81457 WAT 2944 ATOM 81457 O WAT 2945 121.412 122.635 96.181 1.00 0.00 O ATOM 81458 H1 WAT 2945 120.576 123.044 95.956 1.00 0.00 H ATOM 81459 H2 WAT 2945 121.348 122.461 97.120 1.00 0.00 H TER 81461 WAT 2945 ATOM 81461 O WAT 2946 33.382 71.740 153.201 1.00 0.00 O ATOM 81462 H1 WAT 2946 33.874 71.048 152.758 1.00 0.00 H ATOM 81463 H2 WAT 2946 33.755 72.553 152.862 1.00 0.00 H TER 81465 WAT 2946 ATOM 81465 O WAT 2947 130.833 128.247 4.526 1.00 0.00 O ATOM 81466 H1 WAT 2947 131.541 128.040 3.916 1.00 0.00 H ATOM 81467 H2 WAT 2947 130.041 127.936 4.088 1.00 0.00 H TER 81469 WAT 2947 ATOM 81469 O WAT 2948 46.000 28.999 93.976 1.00 0.00 O ATOM 81470 H1 WAT 2948 45.126 29.372 93.859 1.00 0.00 H ATOM 81471 H2 WAT 2948 46.595 29.682 93.666 1.00 0.00 H TER 81473 WAT 2948 ATOM 81473 O WAT 2949 125.071 88.466 67.875 1.00 0.00 O ATOM 81474 H1 WAT 2949 124.628 88.449 68.723 1.00 0.00 H ATOM 81475 H2 WAT 2949 124.399 88.196 67.249 1.00 0.00 H TER 81477 WAT 2949 ATOM 81477 O WAT 2950 60.803 17.703 78.655 1.00 0.00 O ATOM 81478 H1 WAT 2950 59.901 17.996 78.526 1.00 0.00 H ATOM 81479 H2 WAT 2950 61.045 17.299 77.822 1.00 0.00 H TER 81481 WAT 2950 ATOM 81481 O WAT 2951 109.293 79.868 75.839 1.00 0.00 O ATOM 81482 H1 WAT 2951 108.371 79.659 75.986 1.00 0.00 H ATOM 81483 H2 WAT 2951 109.290 80.434 75.067 1.00 0.00 H TER 81485 WAT 2951 ATOM 81485 O WAT 2952 98.558 12.998 140.316 1.00 0.00 O ATOM 81486 H1 WAT 2952 98.196 12.112 140.320 1.00 0.00 H ATOM 81487 H2 WAT 2952 98.022 13.478 140.947 1.00 0.00 H TER 81489 WAT 2952 ATOM 81489 O WAT 2953 29.178 42.147 121.787 1.00 0.00 O ATOM 81490 H1 WAT 2953 28.712 41.911 120.984 1.00 0.00 H ATOM 81491 H2 WAT 2953 29.021 43.085 121.888 1.00 0.00 H TER 81493 WAT 2953 ATOM 81493 O WAT 2954 70.555 6.772 155.288 1.00 0.00 O ATOM 81494 H1 WAT 2954 70.484 7.155 154.413 1.00 0.00 H ATOM 81495 H2 WAT 2954 70.319 7.485 155.881 1.00 0.00 H TER 81497 WAT 2954 ATOM 81497 O WAT 2955 141.091 40.279 142.415 1.00 0.00 O ATOM 81498 H1 WAT 2955 140.979 41.226 142.324 1.00 0.00 H ATOM 81499 H2 WAT 2955 140.411 40.015 143.034 1.00 0.00 H TER 81501 WAT 2955 ATOM 81501 O WAT 2956 134.469 124.714 83.696 1.00 0.00 O ATOM 81502 H1 WAT 2956 134.946 124.512 82.892 1.00 0.00 H ATOM 81503 H2 WAT 2956 134.466 123.892 84.186 1.00 0.00 H TER 81505 WAT 2956 ATOM 81505 O WAT 2957 51.346 32.031 111.460 1.00 0.00 O ATOM 81506 H1 WAT 2957 50.563 32.092 110.913 1.00 0.00 H ATOM 81507 H2 WAT 2957 51.419 31.100 111.671 1.00 0.00 H TER 81509 WAT 2957 ATOM 81509 O WAT 2958 55.670 64.872 82.883 1.00 0.00 O ATOM 81510 H1 WAT 2958 54.800 64.933 82.490 1.00 0.00 H ATOM 81511 H2 WAT 2958 56.271 65.096 82.172 1.00 0.00 H TER 81513 WAT 2958 ATOM 81513 O WAT 2959 144.192 117.063 98.753 1.00 0.00 O ATOM 81514 H1 WAT 2959 143.838 116.569 98.014 1.00 0.00 H ATOM 81515 H2 WAT 2959 144.814 116.464 99.165 1.00 0.00 H TER 81517 WAT 2959 ATOM 81517 O WAT 2960 118.511 76.636 135.465 1.00 0.00 O ATOM 81518 H1 WAT 2960 118.930 77.260 136.058 1.00 0.00 H ATOM 81519 H2 WAT 2960 118.986 75.817 135.606 1.00 0.00 H TER 81521 WAT 2960 ATOM 81521 O WAT 2961 65.444 66.134 85.576 1.00 0.00 O ATOM 81522 H1 WAT 2961 64.716 66.713 85.799 1.00 0.00 H ATOM 81523 H2 WAT 2961 65.082 65.251 85.657 1.00 0.00 H TER 81525 WAT 2961 ATOM 81525 O WAT 2962 62.575 121.980 122.623 1.00 0.00 O ATOM 81526 H1 WAT 2962 61.849 122.474 122.243 1.00 0.00 H ATOM 81527 H2 WAT 2962 62.469 122.087 123.569 1.00 0.00 H TER 81529 WAT 2962 ATOM 81529 O WAT 2963 20.394 19.356 133.221 1.00 0.00 O ATOM 81530 H1 WAT 2963 19.830 20.094 133.452 1.00 0.00 H ATOM 81531 H2 WAT 2963 20.515 18.881 134.043 1.00 0.00 H TER 81533 WAT 2963 ATOM 81533 O WAT 2964 133.717 86.163 7.439 1.00 0.00 O ATOM 81534 H1 WAT 2964 133.231 85.473 7.891 1.00 0.00 H ATOM 81535 H2 WAT 2964 133.356 86.978 7.786 1.00 0.00 H TER 81537 WAT 2964 ATOM 81537 O WAT 2965 89.872 91.889 91.763 1.00 0.00 O ATOM 81538 H1 WAT 2965 88.923 91.839 91.883 1.00 0.00 H ATOM 81539 H2 WAT 2965 90.020 92.754 91.381 1.00 0.00 H TER 81541 WAT 2965 ATOM 81541 O WAT 2966 40.192 27.635 64.928 1.00 0.00 O ATOM 81542 H1 WAT 2966 41.006 28.133 64.847 1.00 0.00 H ATOM 81543 H2 WAT 2966 39.667 27.910 64.177 1.00 0.00 H TER 81545 WAT 2966 ATOM 81545 O WAT 2967 44.588 13.088 105.078 1.00 0.00 O ATOM 81546 H1 WAT 2967 44.204 13.615 105.779 1.00 0.00 H ATOM 81547 H2 WAT 2967 44.358 13.554 104.274 1.00 0.00 H TER 81549 WAT 2967 ATOM 81549 O WAT 2968 66.110 112.510 154.291 1.00 0.00 O ATOM 81550 H1 WAT 2968 65.816 113.374 154.004 1.00 0.00 H ATOM 81551 H2 WAT 2968 66.968 112.667 154.684 1.00 0.00 H TER 81553 WAT 2968 ATOM 81553 O WAT 2969 135.351 5.254 134.235 1.00 0.00 O ATOM 81554 H1 WAT 2969 135.615 5.404 133.328 1.00 0.00 H ATOM 81555 H2 WAT 2969 135.836 4.472 134.500 1.00 0.00 H TER 81557 WAT 2969 ATOM 81557 O WAT 2970 99.621 126.256 76.078 1.00 0.00 O ATOM 81558 H1 WAT 2970 99.589 125.328 75.847 1.00 0.00 H ATOM 81559 H2 WAT 2970 98.725 126.469 76.338 1.00 0.00 H TER 81561 WAT 2970 ATOM 81561 O WAT 2971 13.785 37.368 64.586 1.00 0.00 O ATOM 81562 H1 WAT 2971 13.259 36.667 64.970 1.00 0.00 H ATOM 81563 H2 WAT 2971 13.364 38.174 64.885 1.00 0.00 H TER 81565 WAT 2971 ATOM 81565 O WAT 2972 13.786 5.895 69.120 1.00 0.00 O ATOM 81566 H1 WAT 2972 13.705 5.189 69.761 1.00 0.00 H ATOM 81567 H2 WAT 2972 14.010 6.667 69.641 1.00 0.00 H TER 81569 WAT 2972 ATOM 81569 O WAT 2973 75.349 103.437 117.976 1.00 0.00 O ATOM 81570 H1 WAT 2973 74.847 103.688 117.201 1.00 0.00 H ATOM 81571 H2 WAT 2973 76.159 103.944 117.912 1.00 0.00 H TER 81573 WAT 2973 ATOM 81573 O WAT 2974 107.229 2.914 51.439 1.00 0.00 O ATOM 81574 H1 WAT 2974 107.524 3.818 51.336 1.00 0.00 H ATOM 81575 H2 WAT 2974 106.712 2.739 50.653 1.00 0.00 H TER 81577 WAT 2974 ATOM 81577 O WAT 2975 22.059 72.419 100.970 1.00 0.00 O ATOM 81578 H1 WAT 2975 22.889 71.953 100.867 1.00 0.00 H ATOM 81579 H2 WAT 2975 22.028 73.021 100.226 1.00 0.00 H TER 81581 WAT 2975 ATOM 81581 O WAT 2976 96.535 137.217 14.461 1.00 0.00 O ATOM 81582 H1 WAT 2976 96.668 138.158 14.341 1.00 0.00 H ATOM 81583 H2 WAT 2976 97.340 136.914 14.882 1.00 0.00 H TER 81585 WAT 2976 ATOM 81585 O WAT 2977 122.225 122.449 148.168 1.00 0.00 O ATOM 81586 H1 WAT 2977 122.562 123.031 148.849 1.00 0.00 H ATOM 81587 H2 WAT 2977 122.815 121.696 148.182 1.00 0.00 H TER 81589 WAT 2977 ATOM 81589 O WAT 2978 86.120 11.507 82.806 1.00 0.00 O ATOM 81590 H1 WAT 2978 86.469 11.964 82.041 1.00 0.00 H ATOM 81591 H2 WAT 2978 86.706 11.757 83.521 1.00 0.00 H TER 81593 WAT 2978 ATOM 81593 O WAT 2979 96.360 74.909 21.189 1.00 0.00 O ATOM 81594 H1 WAT 2979 97.277 74.636 21.219 1.00 0.00 H ATOM 81595 H2 WAT 2979 96.257 75.308 20.326 1.00 0.00 H TER 81597 WAT 2979 ATOM 81597 O WAT 2980 77.154 25.642 146.733 1.00 0.00 O ATOM 81598 H1 WAT 2980 77.784 26.056 147.322 1.00 0.00 H ATOM 81599 H2 WAT 2980 76.365 25.533 147.264 1.00 0.00 H TER 81601 WAT 2980 ATOM 81601 O WAT 2981 80.107 109.970 111.000 1.00 0.00 O ATOM 81602 H1 WAT 2981 79.602 109.921 110.189 1.00 0.00 H ATOM 81603 H2 WAT 2981 80.623 109.164 111.010 1.00 0.00 H TER 81605 WAT 2981 ATOM 81605 O WAT 2982 38.707 93.860 149.965 1.00 0.00 O ATOM 81606 H1 WAT 2982 38.432 93.489 149.127 1.00 0.00 H ATOM 81607 H2 WAT 2982 39.637 93.641 150.031 1.00 0.00 H TER 81609 WAT 2982 ATOM 81609 O WAT 2983 13.290 96.957 144.683 1.00 0.00 O ATOM 81610 H1 WAT 2983 12.764 96.462 145.312 1.00 0.00 H ATOM 81611 H2 WAT 2983 12.700 97.638 144.361 1.00 0.00 H TER 81613 WAT 2983 ATOM 81613 O WAT 2984 68.084 53.395 122.027 1.00 0.00 O ATOM 81614 H1 WAT 2984 68.782 52.742 122.091 1.00 0.00 H ATOM 81615 H2 WAT 2984 68.535 54.235 122.106 1.00 0.00 H TER 81617 WAT 2984 ATOM 81617 O WAT 2985 67.329 130.301 132.398 1.00 0.00 O ATOM 81618 H1 WAT 2985 66.722 130.828 132.919 1.00 0.00 H ATOM 81619 H2 WAT 2985 66.772 129.660 131.958 1.00 0.00 H TER 81621 WAT 2985 ATOM 81621 O WAT 2986 19.125 55.604 58.307 1.00 0.00 O ATOM 81622 H1 WAT 2986 19.484 55.716 57.426 1.00 0.00 H ATOM 81623 H2 WAT 2986 19.882 55.380 58.847 1.00 0.00 H TER 81625 WAT 2986 ATOM 81625 O WAT 2987 8.662 113.136 124.148 1.00 0.00 O ATOM 81626 H1 WAT 2987 8.707 113.232 125.099 1.00 0.00 H ATOM 81627 H2 WAT 2987 8.493 112.205 124.008 1.00 0.00 H TER 81629 WAT 2987 ATOM 81629 O WAT 2988 6.754 30.279 136.821 1.00 0.00 O ATOM 81630 H1 WAT 2988 6.723 29.851 137.677 1.00 0.00 H ATOM 81631 H2 WAT 2988 5.966 30.822 136.796 1.00 0.00 H TER 81633 WAT 2988 ATOM 81633 O WAT 2989 86.759 134.013 95.448 1.00 0.00 O ATOM 81634 H1 WAT 2989 85.826 133.914 95.258 1.00 0.00 H ATOM 81635 H2 WAT 2989 86.786 134.363 96.339 1.00 0.00 H TER 81637 WAT 2989 ATOM 81637 O WAT 2990 113.614 15.402 118.080 1.00 0.00 O ATOM 81638 H1 WAT 2990 114.345 15.610 118.661 1.00 0.00 H ATOM 81639 H2 WAT 2990 113.094 14.764 118.569 1.00 0.00 H TER 81641 WAT 2990 ATOM 81641 O WAT 2991 106.682 80.296 76.976 1.00 0.00 O ATOM 81642 H1 WAT 2991 107.189 80.950 77.457 1.00 0.00 H ATOM 81643 H2 WAT 2991 106.485 79.621 77.625 1.00 0.00 H TER 81645 WAT 2991 ATOM 81645 O WAT 2992 61.705 34.304 24.145 1.00 0.00 O ATOM 81646 H1 WAT 2992 60.818 34.665 24.157 1.00 0.00 H ATOM 81647 H2 WAT 2992 61.606 33.441 23.741 1.00 0.00 H TER 81649 WAT 2992 ATOM 81649 O WAT 2993 71.153 40.093 8.854 1.00 0.00 O ATOM 81650 H1 WAT 2993 70.583 39.330 8.949 1.00 0.00 H ATOM 81651 H2 WAT 2993 71.608 39.950 8.024 1.00 0.00 H TER 81653 WAT 2993 ATOM 81653 O WAT 2994 110.715 3.229 99.172 1.00 0.00 O ATOM 81654 H1 WAT 2994 111.131 3.559 98.376 1.00 0.00 H ATOM 81655 H2 WAT 2994 109.844 3.625 99.169 1.00 0.00 H TER 81657 WAT 2994 ATOM 81657 O WAT 2995 11.075 62.160 111.646 1.00 0.00 O ATOM 81658 H1 WAT 2995 12.019 62.145 111.491 1.00 0.00 H ATOM 81659 H2 WAT 2995 10.956 62.807 112.342 1.00 0.00 H TER 81661 WAT 2995 ATOM 81661 O WAT 2996 73.561 21.242 82.843 1.00 0.00 O ATOM 81662 H1 WAT 2996 74.053 21.514 82.069 1.00 0.00 H ATOM 81663 H2 WAT 2996 73.637 21.981 83.447 1.00 0.00 H TER 81665 WAT 2996 ATOM 81665 O WAT 2997 63.182 129.754 53.551 1.00 0.00 O ATOM 81666 H1 WAT 2997 62.352 129.366 53.274 1.00 0.00 H ATOM 81667 H2 WAT 2997 62.962 130.658 53.774 1.00 0.00 H TER 81669 WAT 2997 ATOM 81669 O WAT 2998 106.074 85.766 147.903 1.00 0.00 O ATOM 81670 H1 WAT 2998 105.885 85.213 147.145 1.00 0.00 H ATOM 81671 H2 WAT 2998 107.019 85.910 147.864 1.00 0.00 H TER 81673 WAT 2998 ATOM 81673 O WAT 2999 130.952 88.351 123.693 1.00 0.00 O ATOM 81674 H1 WAT 2999 130.595 87.563 123.284 1.00 0.00 H ATOM 81675 H2 WAT 2999 131.274 88.876 122.960 1.00 0.00 H TER 81677 WAT 2999 ATOM 81677 O WAT 3000 130.185 132.093 151.886 1.00 0.00 O ATOM 81678 H1 WAT 3000 129.783 131.231 151.773 1.00 0.00 H ATOM 81679 H2 WAT 3000 129.551 132.587 152.405 1.00 0.00 H TER 81681 WAT 3000 ATOM 81681 O WAT 3001 142.823 122.429 71.668 1.00 0.00 O ATOM 81682 H1 WAT 3001 143.279 121.672 72.034 1.00 0.00 H ATOM 81683 H2 WAT 3001 141.952 122.100 71.446 1.00 0.00 H TER 81685 WAT 3001 ATOM 81685 O WAT 3002 97.834 139.741 82.030 1.00 0.00 O ATOM 81686 H1 WAT 3002 97.327 138.966 82.271 1.00 0.00 H ATOM 81687 H2 WAT 3002 98.123 139.568 81.134 1.00 0.00 H TER 81689 WAT 3002 ATOM 81689 O WAT 3003 1.628 100.499 133.964 1.00 0.00 O ATOM 81690 H1 WAT 3003 2.494 100.879 133.818 1.00 0.00 H ATOM 81691 H2 WAT 3003 1.630 99.693 133.448 1.00 0.00 H TER 81693 WAT 3003 ATOM 81693 O WAT 3004 109.599 65.418 152.195 1.00 0.00 O ATOM 81694 H1 WAT 3004 110.158 66.157 152.436 1.00 0.00 H ATOM 81695 H2 WAT 3004 109.771 65.282 151.263 1.00 0.00 H TER 81697 WAT 3004 ATOM 81697 O WAT 3005 53.670 53.521 87.338 1.00 0.00 O ATOM 81698 H1 WAT 3005 54.607 53.368 87.458 1.00 0.00 H ATOM 81699 H2 WAT 3005 53.604 54.454 87.131 1.00 0.00 H TER 81701 WAT 3005 ATOM 81701 O WAT 3006 64.908 117.134 82.593 1.00 0.00 O ATOM 81702 H1 WAT 3006 65.216 116.456 83.193 1.00 0.00 H ATOM 81703 H2 WAT 3006 65.704 117.465 82.176 1.00 0.00 H TER 81705 WAT 3006 ATOM 81705 O WAT 3007 119.825 73.400 12.021 1.00 0.00 O ATOM 81706 H1 WAT 3007 118.882 73.237 12.002 1.00 0.00 H ATOM 81707 H2 WAT 3007 119.980 73.997 11.289 1.00 0.00 H TER 81709 WAT 3007 ATOM 81709 O WAT 3008 0.959 17.728 77.670 1.00 0.00 O ATOM 81710 H1 WAT 3008 1.094 17.818 78.613 1.00 0.00 H ATOM 81711 H2 WAT 3008 0.739 16.804 77.547 1.00 0.00 H TER 81713 WAT 3008 ATOM 81713 O WAT 3009 29.808 84.886 84.472 1.00 0.00 O ATOM 81714 H1 WAT 3009 30.513 84.239 84.456 1.00 0.00 H ATOM 81715 H2 WAT 3009 29.906 85.327 85.315 1.00 0.00 H TER 81717 WAT 3009 ATOM 81717 O WAT 3010 8.518 12.752 118.695 1.00 0.00 O ATOM 81718 H1 WAT 3010 8.742 11.914 119.101 1.00 0.00 H ATOM 81719 H2 WAT 3010 8.182 12.516 117.830 1.00 0.00 H TER 81721 WAT 3010 ATOM 81721 O WAT 3011 101.652 119.834 136.767 1.00 0.00 O ATOM 81722 H1 WAT 3011 101.592 120.571 137.375 1.00 0.00 H ATOM 81723 H2 WAT 3011 101.773 120.240 135.909 1.00 0.00 H TER 81725 WAT 3011 ATOM 81725 O WAT 3012 67.376 89.091 148.096 1.00 0.00 O ATOM 81726 H1 WAT 3012 66.453 89.242 148.299 1.00 0.00 H ATOM 81727 H2 WAT 3012 67.852 89.541 148.794 1.00 0.00 H TER 81729 WAT 3012 ATOM 81729 O WAT 3013 20.219 6.149 90.651 1.00 0.00 O ATOM 81730 H1 WAT 3013 20.998 5.699 90.981 1.00 0.00 H ATOM 81731 H2 WAT 3013 19.968 6.743 91.358 1.00 0.00 H TER 81733 WAT 3013 ATOM 81733 O WAT 3014 101.782 12.695 17.609 1.00 0.00 O ATOM 81734 H1 WAT 3014 102.404 12.852 18.320 1.00 0.00 H ATOM 81735 H2 WAT 3014 101.793 13.504 17.098 1.00 0.00 H TER 81737 WAT 3014 ATOM 81737 O WAT 3015 56.864 142.199 152.736 1.00 0.00 O ATOM 81738 H1 WAT 3015 56.706 143.100 152.456 1.00 0.00 H ATOM 81739 H2 WAT 3015 57.792 142.180 152.972 1.00 0.00 H TER 81741 WAT 3015 ATOM 81741 O WAT 3016 119.254 70.187 83.318 1.00 0.00 O ATOM 81742 H1 WAT 3016 118.904 70.960 83.760 1.00 0.00 H ATOM 81743 H2 WAT 3016 119.776 69.744 83.988 1.00 0.00 H TER 81745 WAT 3016 ATOM 81745 O WAT 3017 74.667 116.921 58.632 1.00 0.00 O ATOM 81746 H1 WAT 3017 74.021 116.269 58.903 1.00 0.00 H ATOM 81747 H2 WAT 3017 75.200 117.069 59.412 1.00 0.00 H TER 81749 WAT 3017 ATOM 81749 O WAT 3018 132.525 126.681 131.411 1.00 0.00 O ATOM 81750 H1 WAT 3018 132.540 125.805 131.025 1.00 0.00 H ATOM 81751 H2 WAT 3018 133.412 127.015 131.281 1.00 0.00 H TER 81753 WAT 3018 ATOM 81753 O WAT 3019 111.019 128.014 92.196 1.00 0.00 O ATOM 81754 H1 WAT 3019 111.246 128.364 93.057 1.00 0.00 H ATOM 81755 H2 WAT 3019 111.840 128.034 91.705 1.00 0.00 H TER 81757 WAT 3019 ATOM 81757 O WAT 3020 57.741 114.667 127.376 1.00 0.00 O ATOM 81758 H1 WAT 3020 57.151 114.483 126.645 1.00 0.00 H ATOM 81759 H2 WAT 3020 57.698 115.617 127.486 1.00 0.00 H TER 81761 WAT 3020 ATOM 81761 O WAT 3021 82.639 120.468 14.904 1.00 0.00 O ATOM 81762 H1 WAT 3021 82.514 121.034 14.142 1.00 0.00 H ATOM 81763 H2 WAT 3021 82.975 121.052 15.584 1.00 0.00 H TER 81765 WAT 3021 ATOM 81765 O WAT 3022 38.624 50.148 112.430 1.00 0.00 O ATOM 81766 H1 WAT 3022 38.036 49.504 112.824 1.00 0.00 H ATOM 81767 H2 WAT 3022 39.502 49.834 112.646 1.00 0.00 H TER 81769 WAT 3022 ATOM 81769 O WAT 3023 47.182 117.935 149.780 1.00 0.00 O ATOM 81770 H1 WAT 3023 47.805 118.100 150.487 1.00 0.00 H ATOM 81771 H2 WAT 3023 47.700 118.021 148.979 1.00 0.00 H TER 81773 WAT 3023 ATOM 81773 O WAT 3024 52.674 126.940 91.430 1.00 0.00 O ATOM 81774 H1 WAT 3024 52.992 126.438 92.181 1.00 0.00 H ATOM 81775 H2 WAT 3024 51.783 126.620 91.287 1.00 0.00 H TER 81777 WAT 3024 ATOM 81777 O WAT 3025 55.357 43.862 115.283 1.00 0.00 O ATOM 81778 H1 WAT 3025 56.265 43.646 115.498 1.00 0.00 H ATOM 81779 H2 WAT 3025 54.965 43.025 115.032 1.00 0.00 H TER 81781 WAT 3025 ATOM 81781 O WAT 3026 56.716 108.397 136.632 1.00 0.00 O ATOM 81782 H1 WAT 3026 56.088 108.184 137.323 1.00 0.00 H ATOM 81783 H2 WAT 3026 57.051 107.548 136.344 1.00 0.00 H TER 81785 WAT 3026 ATOM 81785 O WAT 3027 128.861 57.589 94.369 1.00 0.00 O ATOM 81786 H1 WAT 3027 128.254 57.190 93.746 1.00 0.00 H ATOM 81787 H2 WAT 3027 129.728 57.418 94.001 1.00 0.00 H TER 81789 WAT 3027 ATOM 81789 O WAT 3028 13.307 16.162 56.892 1.00 0.00 O ATOM 81790 H1 WAT 3028 12.357 16.273 56.924 1.00 0.00 H ATOM 81791 H2 WAT 3028 13.482 15.431 57.485 1.00 0.00 H TER 81793 WAT 3028 ATOM 81793 O WAT 3029 141.281 61.302 154.306 1.00 0.00 O ATOM 81794 H1 WAT 3029 141.740 61.687 155.053 1.00 0.00 H ATOM 81795 H2 WAT 3029 141.736 60.475 154.146 1.00 0.00 H TER 81797 WAT 3029 ATOM 81797 O WAT 3030 115.657 115.889 98.412 1.00 0.00 O ATOM 81798 H1 WAT 3030 114.891 116.388 98.694 1.00 0.00 H ATOM 81799 H2 WAT 3030 116.334 116.109 99.052 1.00 0.00 H TER 81801 WAT 3030 ATOM 81801 O WAT 3031 89.190 43.016 126.607 1.00 0.00 O ATOM 81802 H1 WAT 3031 89.977 43.175 126.086 1.00 0.00 H ATOM 81803 H2 WAT 3031 89.515 42.639 127.424 1.00 0.00 H TER 81805 WAT 3031 ATOM 81805 O WAT 3032 48.735 89.523 101.821 1.00 0.00 O ATOM 81806 H1 WAT 3032 48.133 89.512 102.565 1.00 0.00 H ATOM 81807 H2 WAT 3032 48.410 88.835 101.240 1.00 0.00 H TER 81809 WAT 3032 ATOM 81809 O WAT 3033 142.622 11.263 139.196 1.00 0.00 O ATOM 81810 H1 WAT 3033 142.226 11.373 140.061 1.00 0.00 H ATOM 81811 H2 WAT 3033 143.364 10.677 139.345 1.00 0.00 H TER 81813 WAT 3033 ATOM 81813 O WAT 3034 13.996 85.031 22.119 1.00 0.00 O ATOM 81814 H1 WAT 3034 13.594 85.082 22.987 1.00 0.00 H ATOM 81815 H2 WAT 3034 13.320 85.355 21.523 1.00 0.00 H TER 81817 WAT 3034 ATOM 81817 O WAT 3035 38.306 67.664 119.983 1.00 0.00 O ATOM 81818 H1 WAT 3035 37.807 66.897 120.265 1.00 0.00 H ATOM 81819 H2 WAT 3035 37.792 68.411 120.290 1.00 0.00 H TER 81821 WAT 3035 ATOM 81821 O WAT 3036 139.846 107.538 157.173 1.00 0.00 O ATOM 81822 H1 WAT 3036 140.315 107.469 156.342 1.00 0.00 H ATOM 81823 H2 WAT 3036 139.404 106.694 157.270 1.00 0.00 H TER 81825 WAT 3036 ATOM 81825 O WAT 3037 1.679 11.917 71.266 1.00 0.00 O ATOM 81826 H1 WAT 3037 0.840 12.211 70.912 1.00 0.00 H ATOM 81827 H2 WAT 3037 2.334 12.349 70.718 1.00 0.00 H TER 81829 WAT 3037 ATOM 81829 O WAT 3038 43.349 66.620 102.833 1.00 0.00 O ATOM 81830 H1 WAT 3038 42.533 66.436 103.298 1.00 0.00 H ATOM 81831 H2 WAT 3038 43.857 67.156 103.442 1.00 0.00 H TER 81833 WAT 3038 ATOM 81833 O WAT 3039 93.554 126.231 136.042 1.00 0.00 O ATOM 81834 H1 WAT 3039 92.958 126.507 135.346 1.00 0.00 H ATOM 81835 H2 WAT 3039 93.248 126.699 136.819 1.00 0.00 H TER 81837 WAT 3039 ATOM 81837 O WAT 3040 110.032 76.880 149.889 1.00 0.00 O ATOM 81838 H1 WAT 3040 109.225 77.313 149.610 1.00 0.00 H ATOM 81839 H2 WAT 3040 110.513 77.556 150.367 1.00 0.00 H TER 81841 WAT 3040 ATOM 81841 O WAT 3041 50.738 13.414 69.158 1.00 0.00 O ATOM 81842 H1 WAT 3041 50.847 14.268 69.578 1.00 0.00 H ATOM 81843 H2 WAT 3041 49.818 13.193 69.301 1.00 0.00 H TER 81845 WAT 3041 ATOM 81845 O WAT 3042 17.715 134.598 113.880 1.00 0.00 O ATOM 81846 H1 WAT 3042 17.951 135.363 113.355 1.00 0.00 H ATOM 81847 H2 WAT 3042 18.104 133.858 113.413 1.00 0.00 H TER 81849 WAT 3042 ATOM 81849 O WAT 3043 49.293 111.053 103.338 1.00 0.00 O ATOM 81850 H1 WAT 3043 48.497 110.891 103.845 1.00 0.00 H ATOM 81851 H2 WAT 3043 49.719 110.198 103.282 1.00 0.00 H TER 81853 WAT 3043 ATOM 81853 O WAT 3044 127.823 140.807 139.366 1.00 0.00 O ATOM 81854 H1 WAT 3044 128.772 140.831 139.251 1.00 0.00 H ATOM 81855 H2 WAT 3044 127.683 141.119 140.261 1.00 0.00 H TER 81857 WAT 3044 ATOM 81857 O WAT 3045 125.810 104.215 143.391 1.00 0.00 O ATOM 81858 H1 WAT 3045 125.107 103.624 143.659 1.00 0.00 H ATOM 81859 H2 WAT 3045 126.432 104.192 144.118 1.00 0.00 H TER 81861 WAT 3045 ATOM 81861 O WAT 3046 23.443 19.877 11.863 1.00 0.00 O ATOM 81862 H1 WAT 3046 22.976 20.022 11.040 1.00 0.00 H ATOM 81863 H2 WAT 3046 24.160 20.511 11.846 1.00 0.00 H TER 81865 WAT 3046 ATOM 81865 O WAT 3047 104.641 76.647 126.675 1.00 0.00 O ATOM 81866 H1 WAT 3047 105.024 76.045 126.038 1.00 0.00 H ATOM 81867 H2 WAT 3047 105.210 77.416 126.650 1.00 0.00 H TER 81869 WAT 3047 ATOM 81869 O WAT 3048 32.280 27.802 108.819 1.00 0.00 O ATOM 81870 H1 WAT 3048 32.044 27.120 109.447 1.00 0.00 H ATOM 81871 H2 WAT 3048 33.160 28.072 109.078 1.00 0.00 H TER 81873 WAT 3048 ATOM 81873 O WAT 3049 51.813 38.003 21.456 1.00 0.00 O ATOM 81874 H1 WAT 3049 51.966 37.304 22.092 1.00 0.00 H ATOM 81875 H2 WAT 3049 51.672 38.785 21.989 1.00 0.00 H TER 81877 WAT 3049 ATOM 81877 O WAT 3050 136.881 102.528 20.751 1.00 0.00 O ATOM 81878 H1 WAT 3050 136.923 102.087 21.600 1.00 0.00 H ATOM 81879 H2 WAT 3050 136.102 103.082 20.808 1.00 0.00 H TER 81881 WAT 3050 ATOM 81881 O WAT 3051 33.001 53.947 3.641 1.00 0.00 O ATOM 81882 H1 WAT 3051 32.783 53.154 4.132 1.00 0.00 H ATOM 81883 H2 WAT 3051 32.740 54.665 4.218 1.00 0.00 H TER 81885 WAT 3051 ATOM 81885 O WAT 3052 117.405 82.201 129.639 1.00 0.00 O ATOM 81886 H1 WAT 3052 117.386 82.711 130.449 1.00 0.00 H ATOM 81887 H2 WAT 3052 117.928 81.429 129.855 1.00 0.00 H TER 81889 WAT 3052 ATOM 81889 O WAT 3053 17.974 114.034 131.958 1.00 0.00 O ATOM 81890 H1 WAT 3053 17.214 113.477 132.125 1.00 0.00 H ATOM 81891 H2 WAT 3053 17.712 114.898 132.277 1.00 0.00 H TER 81893 WAT 3053 ATOM 81893 O WAT 3054 138.972 71.379 90.527 1.00 0.00 O ATOM 81894 H1 WAT 3054 138.125 71.225 90.946 1.00 0.00 H ATOM 81895 H2 WAT 3054 139.203 72.274 90.776 1.00 0.00 H TER 81897 WAT 3054 ATOM 81897 O WAT 3055 102.099 35.661 140.018 1.00 0.00 O ATOM 81898 H1 WAT 3055 102.682 35.662 140.777 1.00 0.00 H ATOM 81899 H2 WAT 3055 101.536 36.424 140.148 1.00 0.00 H TER 81901 WAT 3055 ATOM 81901 O WAT 3056 46.698 31.438 16.252 1.00 0.00 O ATOM 81902 H1 WAT 3056 47.545 31.009 16.371 1.00 0.00 H ATOM 81903 H2 WAT 3056 46.502 31.822 17.107 1.00 0.00 H TER 81905 WAT 3056 ATOM 81905 O WAT 3057 14.401 87.397 124.844 1.00 0.00 O ATOM 81906 H1 WAT 3057 14.410 88.226 125.322 1.00 0.00 H ATOM 81907 H2 WAT 3057 13.760 86.859 125.308 1.00 0.00 H TER 81909 WAT 3057 ATOM 81909 O WAT 3058 142.637 108.748 13.558 1.00 0.00 O ATOM 81910 H1 WAT 3058 142.855 109.543 13.072 1.00 0.00 H ATOM 81911 H2 WAT 3058 143.047 108.042 13.058 1.00 0.00 H TER 81913 WAT 3058 ATOM 81913 O WAT 3059 120.195 9.041 106.741 1.00 0.00 O ATOM 81914 H1 WAT 3059 120.177 8.136 106.428 1.00 0.00 H ATOM 81915 H2 WAT 3059 119.301 9.210 107.038 1.00 0.00 H TER 81917 WAT 3059 ATOM 81917 O WAT 3060 26.908 72.344 126.499 1.00 0.00 O ATOM 81918 H1 WAT 3060 27.311 72.259 127.364 1.00 0.00 H ATOM 81919 H2 WAT 3060 26.602 73.250 126.466 1.00 0.00 H TER 81921 WAT 3060 ATOM 81921 O WAT 3061 101.041 133.213 152.058 1.00 0.00 O ATOM 81922 H1 WAT 3061 101.535 132.410 151.891 1.00 0.00 H ATOM 81923 H2 WAT 3061 100.224 132.913 152.457 1.00 0.00 H TER 81925 WAT 3061 ATOM 81925 O WAT 3062 65.062 48.696 122.611 1.00 0.00 O ATOM 81926 H1 WAT 3062 65.131 47.791 122.914 1.00 0.00 H ATOM 81927 H2 WAT 3062 65.182 48.642 121.663 1.00 0.00 H TER 81929 WAT 3062 ATOM 81929 O WAT 3063 95.031 57.127 154.541 1.00 0.00 O ATOM 81930 H1 WAT 3063 95.450 57.511 153.772 1.00 0.00 H ATOM 81931 H2 WAT 3063 95.708 57.145 155.217 1.00 0.00 H TER 81933 WAT 3063 ATOM 81933 O WAT 3064 89.918 136.218 14.774 1.00 0.00 O ATOM 81934 H1 WAT 3064 89.846 136.908 14.114 1.00 0.00 H ATOM 81935 H2 WAT 3064 90.272 136.661 15.545 1.00 0.00 H TER 81937 WAT 3064 ATOM 81937 O WAT 3065 1.690 88.777 8.178 1.00 0.00 O ATOM 81938 H1 WAT 3065 1.316 88.895 7.306 1.00 0.00 H ATOM 81939 H2 WAT 3065 2.605 88.546 8.017 1.00 0.00 H TER 81941 WAT 3065 ATOM 81941 O WAT 3066 108.865 10.791 127.231 1.00 0.00 O ATOM 81942 H1 WAT 3066 109.472 11.521 127.103 1.00 0.00 H ATOM 81943 H2 WAT 3066 109.347 10.173 127.780 1.00 0.00 H TER 81945 WAT 3066 ATOM 81945 O WAT 3067 93.448 5.653 111.984 1.00 0.00 O ATOM 81946 H1 WAT 3067 94.035 5.859 112.711 1.00 0.00 H ATOM 81947 H2 WAT 3067 92.777 5.089 112.370 1.00 0.00 H TER 81949 WAT 3067 ATOM 81949 O WAT 3068 62.340 19.826 155.988 1.00 0.00 O ATOM 81950 H1 WAT 3068 61.834 19.330 156.631 1.00 0.00 H ATOM 81951 H2 WAT 3068 61.717 20.011 155.284 1.00 0.00 H TER 81953 WAT 3068 ATOM 81953 O WAT 3069 101.648 13.866 145.541 1.00 0.00 O ATOM 81954 H1 WAT 3069 101.948 13.100 146.032 1.00 0.00 H ATOM 81955 H2 WAT 3069 102.082 14.607 145.965 1.00 0.00 H TER 81957 WAT 3069 ATOM 81957 O WAT 3070 13.929 32.729 151.893 1.00 0.00 O ATOM 81958 H1 WAT 3070 14.169 31.938 152.376 1.00 0.00 H ATOM 81959 H2 WAT 3070 13.329 33.193 152.477 1.00 0.00 H TER 81961 WAT 3070 ATOM 81961 O WAT 3071 27.272 2.094 82.844 1.00 0.00 O ATOM 81962 H1 WAT 3071 27.811 1.944 82.067 1.00 0.00 H ATOM 81963 H2 WAT 3071 26.798 2.904 82.654 1.00 0.00 H TER 81965 WAT 3071 ATOM 81965 O WAT 3072 132.297 58.747 120.862 1.00 0.00 O ATOM 81966 H1 WAT 3072 132.721 58.325 120.114 1.00 0.00 H ATOM 81967 H2 WAT 3072 131.400 58.905 120.570 1.00 0.00 H TER 81969 WAT 3072 ATOM 81969 O WAT 3073 81.186 3.298 124.300 1.00 0.00 O ATOM 81970 H1 WAT 3073 80.407 2.937 123.876 1.00 0.00 H ATOM 81971 H2 WAT 3073 81.444 2.629 124.935 1.00 0.00 H TER 81973 WAT 3073 ATOM 81973 O WAT 3074 133.742 33.186 72.926 1.00 0.00 O ATOM 81974 H1 WAT 3074 133.734 32.246 73.104 1.00 0.00 H ATOM 81975 H2 WAT 3074 133.946 33.253 71.994 1.00 0.00 H TER 81977 WAT 3074 ATOM 81977 O WAT 3075 65.234 74.792 80.347 1.00 0.00 O ATOM 81978 H1 WAT 3075 65.795 75.374 80.859 1.00 0.00 H ATOM 81979 H2 WAT 3075 64.344 75.094 80.532 1.00 0.00 H TER 81981 WAT 3075 ATOM 81981 O WAT 3076 85.253 73.025 136.886 1.00 0.00 O ATOM 81982 H1 WAT 3076 85.514 72.554 137.676 1.00 0.00 H ATOM 81983 H2 WAT 3076 84.374 73.351 137.081 1.00 0.00 H TER 81985 WAT 3076 ATOM 81985 O WAT 3077 81.639 131.027 154.854 1.00 0.00 O ATOM 81986 H1 WAT 3077 82.240 130.837 155.574 1.00 0.00 H ATOM 81987 H2 WAT 3077 82.119 130.767 154.067 1.00 0.00 H TER 81989 WAT 3077 ATOM 81989 O WAT 3078 31.082 141.764 66.370 1.00 0.00 O ATOM 81990 H1 WAT 3078 30.457 142.443 66.622 1.00 0.00 H ATOM 81991 H2 WAT 3078 31.884 142.242 66.160 1.00 0.00 H TER 81993 WAT 3078 ATOM 81993 O WAT 3079 17.122 119.171 146.879 1.00 0.00 O ATOM 81994 H1 WAT 3079 16.526 118.788 146.235 1.00 0.00 H ATOM 81995 H2 WAT 3079 16.557 119.697 147.445 1.00 0.00 H TER 81997 WAT 3079 ATOM 81997 O WAT 3080 109.855 112.786 14.404 1.00 0.00 O ATOM 81998 H1 WAT 3080 109.173 113.076 15.010 1.00 0.00 H ATOM 81999 H2 WAT 3080 110.675 112.939 14.875 1.00 0.00 H TER 82001 WAT 3080 ATOM 82001 O WAT 3081 13.587 27.803 91.360 1.00 0.00 O ATOM 82002 H1 WAT 3081 13.508 27.053 91.950 1.00 0.00 H ATOM 82003 H2 WAT 3081 13.766 28.544 91.939 1.00 0.00 H TER 82005 WAT 3081 ATOM 82005 O WAT 3082 108.213 110.602 23.057 1.00 0.00 O ATOM 82006 H1 WAT 3082 109.055 110.855 23.434 1.00 0.00 H ATOM 82007 H2 WAT 3082 107.781 111.432 22.856 1.00 0.00 H TER 82009 WAT 3082 ATOM 82009 O WAT 3083 9.338 125.542 5.243 1.00 0.00 O ATOM 82010 H1 WAT 3083 9.703 124.907 4.626 1.00 0.00 H ATOM 82011 H2 WAT 3083 10.084 125.811 5.779 1.00 0.00 H TER 82013 WAT 3083 ATOM 82013 O WAT 3084 69.895 48.620 66.841 1.00 0.00 O ATOM 82014 H1 WAT 3084 69.581 49.160 67.566 1.00 0.00 H ATOM 82015 H2 WAT 3084 70.244 47.834 67.262 1.00 0.00 H TER 82017 WAT 3084 ATOM 82017 O WAT 3085 143.455 9.181 130.958 1.00 0.00 O ATOM 82018 H1 WAT 3085 143.423 9.536 131.847 1.00 0.00 H ATOM 82019 H2 WAT 3085 142.564 8.875 130.790 1.00 0.00 H TER 82021 WAT 3085 ATOM 82021 O WAT 3086 46.647 114.435 6.312 1.00 0.00 O ATOM 82022 H1 WAT 3086 46.731 115.281 6.753 1.00 0.00 H ATOM 82023 H2 WAT 3086 45.856 114.047 6.686 1.00 0.00 H TER 82025 WAT 3086 ATOM 82025 O WAT 3087 124.766 3.012 141.337 1.00 0.00 O ATOM 82026 H1 WAT 3087 124.420 3.901 141.264 1.00 0.00 H ATOM 82027 H2 WAT 3087 125.449 2.965 140.667 1.00 0.00 H TER 82029 WAT 3087 ATOM 82029 O WAT 3088 51.221 136.554 60.834 1.00 0.00 O ATOM 82030 H1 WAT 3088 51.427 135.928 60.140 1.00 0.00 H ATOM 82031 H2 WAT 3088 51.578 136.157 61.628 1.00 0.00 H TER 82033 WAT 3088 ATOM 82033 O WAT 3089 87.213 66.253 68.256 1.00 0.00 O ATOM 82034 H1 WAT 3089 88.104 65.958 68.445 1.00 0.00 H ATOM 82035 H2 WAT 3089 86.694 65.935 68.994 1.00 0.00 H TER 82037 WAT 3089 ATOM 82037 O WAT 3090 91.220 37.622 74.051 1.00 0.00 O ATOM 82038 H1 WAT 3090 90.898 37.664 73.151 1.00 0.00 H ATOM 82039 H2 WAT 3090 90.433 37.703 74.590 1.00 0.00 H TER 82041 WAT 3090 ATOM 82041 O WAT 3091 84.603 5.509 13.025 1.00 0.00 O ATOM 82042 H1 WAT 3091 84.802 5.140 13.885 1.00 0.00 H ATOM 82043 H2 WAT 3091 85.441 5.852 12.712 1.00 0.00 H TER 82045 WAT 3091 ATOM 82045 O WAT 3092 137.611 118.760 3.899 1.00 0.00 O ATOM 82046 H1 WAT 3092 138.324 119.194 4.367 1.00 0.00 H ATOM 82047 H2 WAT 3092 136.816 119.073 4.330 1.00 0.00 H TER 82049 WAT 3092 ATOM 82049 O WAT 3093 13.034 116.036 64.620 1.00 0.00 O ATOM 82050 H1 WAT 3093 12.241 116.088 64.087 1.00 0.00 H ATOM 82051 H2 WAT 3093 13.663 115.570 64.069 1.00 0.00 H TER 82053 WAT 3093 ATOM 82053 O WAT 3094 31.965 126.837 97.165 1.00 0.00 O ATOM 82054 H1 WAT 3094 31.742 127.398 97.908 1.00 0.00 H ATOM 82055 H2 WAT 3094 32.767 126.390 97.436 1.00 0.00 H TER 82057 WAT 3094 ATOM 82057 O WAT 3095 16.199 106.810 144.015 1.00 0.00 O ATOM 82058 H1 WAT 3095 16.261 105.879 144.227 1.00 0.00 H ATOM 82059 H2 WAT 3095 16.767 106.920 143.252 1.00 0.00 H TER 82061 WAT 3095 ATOM 82061 O WAT 3096 143.412 74.179 90.394 1.00 0.00 O ATOM 82062 H1 WAT 3096 142.719 74.666 89.947 1.00 0.00 H ATOM 82063 H2 WAT 3096 143.229 74.304 91.326 1.00 0.00 H TER 82065 WAT 3096 ATOM 82065 O WAT 3097 21.968 135.729 3.497 1.00 0.00 O ATOM 82066 H1 WAT 3097 22.062 134.777 3.480 1.00 0.00 H ATOM 82067 H2 WAT 3097 21.057 135.875 3.752 1.00 0.00 H TER 82069 WAT 3097 ATOM 82069 O WAT 3098 102.266 131.396 118.493 1.00 0.00 O ATOM 82070 H1 WAT 3098 101.388 131.018 118.460 1.00 0.00 H ATOM 82071 H2 WAT 3098 102.244 132.110 117.855 1.00 0.00 H TER 82073 WAT 3098 ATOM 82073 O WAT 3099 77.692 128.905 87.380 1.00 0.00 O ATOM 82074 H1 WAT 3099 78.498 129.022 87.884 1.00 0.00 H ATOM 82075 H2 WAT 3099 77.298 129.777 87.353 1.00 0.00 H TER 82077 WAT 3099 ATOM 82077 O WAT 3100 13.096 9.646 68.599 1.00 0.00 O ATOM 82078 H1 WAT 3100 13.536 9.474 67.766 1.00 0.00 H ATOM 82079 H2 WAT 3100 13.705 9.324 69.263 1.00 0.00 H TER 82081 WAT 3100 ATOM 82081 O WAT 3101 68.578 41.888 97.834 1.00 0.00 O ATOM 82082 H1 WAT 3101 68.268 41.119 97.357 1.00 0.00 H ATOM 82083 H2 WAT 3101 67.967 41.980 98.565 1.00 0.00 H TER 82085 WAT 3101 ATOM 82085 O WAT 3102 63.293 109.911 83.111 1.00 0.00 O ATOM 82086 H1 WAT 3102 63.298 109.356 83.891 1.00 0.00 H ATOM 82087 H2 WAT 3102 63.767 109.403 82.452 1.00 0.00 H TER 82089 WAT 3102 ATOM 82089 O WAT 3103 120.234 35.997 144.249 1.00 0.00 O ATOM 82090 H1 WAT 3103 120.461 35.076 144.381 1.00 0.00 H ATOM 82091 H2 WAT 3103 119.645 36.205 144.975 1.00 0.00 H TER 82093 WAT 3103 ATOM 82093 O WAT 3104 66.193 1.691 4.836 1.00 0.00 O ATOM 82094 H1 WAT 3104 65.965 1.370 5.709 1.00 0.00 H ATOM 82095 H2 WAT 3104 65.949 2.616 4.850 1.00 0.00 H TER 82097 WAT 3104 ATOM 82097 O WAT 3105 25.923 11.544 64.504 1.00 0.00 O ATOM 82098 H1 WAT 3105 26.363 12.150 63.907 1.00 0.00 H ATOM 82099 H2 WAT 3105 25.207 11.177 63.986 1.00 0.00 H TER 82101 WAT 3105 ATOM 82101 O WAT 3106 85.482 18.089 123.836 1.00 0.00 O ATOM 82102 H1 WAT 3106 85.327 18.969 123.494 1.00 0.00 H ATOM 82103 H2 WAT 3106 86.412 18.080 124.063 1.00 0.00 H TER 82105 WAT 3106 ATOM 82105 O WAT 3107 55.874 32.193 150.441 1.00 0.00 O ATOM 82106 H1 WAT 3107 56.208 33.079 150.307 1.00 0.00 H ATOM 82107 H2 WAT 3107 55.696 31.867 149.559 1.00 0.00 H TER 82109 WAT 3107 ATOM 82109 O WAT 3108 127.391 79.894 67.914 1.00 0.00 O ATOM 82110 H1 WAT 3108 126.529 79.663 67.568 1.00 0.00 H ATOM 82111 H2 WAT 3108 127.230 80.120 68.830 1.00 0.00 H TER 82113 WAT 3108 ATOM 82113 O WAT 3109 102.926 82.001 134.673 1.00 0.00 O ATOM 82114 H1 WAT 3109 103.564 82.411 134.090 1.00 0.00 H ATOM 82115 H2 WAT 3109 102.120 82.498 134.534 1.00 0.00 H TER 82117 WAT 3109 ATOM 82117 O WAT 3110 82.838 133.524 72.510 1.00 0.00 O ATOM 82118 H1 WAT 3110 82.633 132.809 71.908 1.00 0.00 H ATOM 82119 H2 WAT 3110 82.251 134.234 72.248 1.00 0.00 H TER 82121 WAT 3110 ATOM 82121 O WAT 3111 47.493 73.021 9.759 1.00 0.00 O ATOM 82122 H1 WAT 3111 47.903 73.739 10.240 1.00 0.00 H ATOM 82123 H2 WAT 3111 47.746 73.168 8.847 1.00 0.00 H TER 82125 WAT 3111 ATOM 82125 O WAT 3112 12.039 112.211 118.813 1.00 0.00 O ATOM 82126 H1 WAT 3112 12.526 111.408 118.997 1.00 0.00 H ATOM 82127 H2 WAT 3112 11.183 112.070 119.216 1.00 0.00 H TER 82129 WAT 3112 ATOM 82129 O WAT 3113 69.726 80.108 9.543 1.00 0.00 O ATOM 82130 H1 WAT 3113 70.632 79.856 9.369 1.00 0.00 H ATOM 82131 H2 WAT 3113 69.377 79.395 10.078 1.00 0.00 H TER 82133 WAT 3113 ATOM 82133 O WAT 3114 145.042 47.359 99.028 1.00 0.00 O ATOM 82134 H1 WAT 3114 145.969 47.462 99.239 1.00 0.00 H ATOM 82135 H2 WAT 3114 144.596 47.989 99.595 1.00 0.00 H TER 82137 WAT 3114 ATOM 82137 O WAT 3115 104.130 35.250 11.521 1.00 0.00 O ATOM 82138 H1 WAT 3115 103.512 35.133 12.242 1.00 0.00 H ATOM 82139 H2 WAT 3115 104.991 35.122 11.921 1.00 0.00 H TER 82141 WAT 3115 ATOM 82141 O WAT 3116 85.657 25.821 61.982 1.00 0.00 O ATOM 82142 H1 WAT 3116 86.137 25.360 62.670 1.00 0.00 H ATOM 82143 H2 WAT 3116 86.277 25.878 61.255 1.00 0.00 H TER 82145 WAT 3116 ATOM 82145 O WAT 3117 24.889 12.860 23.091 1.00 0.00 O ATOM 82146 H1 WAT 3117 24.335 13.430 23.624 1.00 0.00 H ATOM 82147 H2 WAT 3117 25.748 12.900 23.512 1.00 0.00 H TER 82149 WAT 3117 ATOM 82149 O WAT 3118 9.369 35.284 108.792 1.00 0.00 O ATOM 82150 H1 WAT 3118 9.469 36.199 108.529 1.00 0.00 H ATOM 82151 H2 WAT 3118 9.444 34.791 107.976 1.00 0.00 H TER 82153 WAT 3118 ATOM 82153 O WAT 3119 3.566 8.580 120.516 1.00 0.00 O ATOM 82154 H1 WAT 3119 2.639 8.399 120.359 1.00 0.00 H ATOM 82155 H2 WAT 3119 3.587 9.496 120.794 1.00 0.00 H TER 82157 WAT 3119 ATOM 82157 O WAT 3120 21.096 94.155 74.482 1.00 0.00 O ATOM 82158 H1 WAT 3120 21.350 94.545 73.646 1.00 0.00 H ATOM 82159 H2 WAT 3120 20.799 93.273 74.254 1.00 0.00 H TER 82161 WAT 3120 ATOM 82161 O WAT 3121 87.877 37.874 156.354 1.00 0.00 O ATOM 82162 H1 WAT 3121 87.084 37.339 156.311 1.00 0.00 H ATOM 82163 H2 WAT 3121 88.100 37.899 157.284 1.00 0.00 H TER 82165 WAT 3121 ATOM 82165 O WAT 3122 58.827 112.963 70.744 1.00 0.00 O ATOM 82166 H1 WAT 3122 58.405 112.168 70.419 1.00 0.00 H ATOM 82167 H2 WAT 3122 59.756 112.837 70.551 1.00 0.00 H TER 82169 WAT 3122 ATOM 82169 O WAT 3123 44.797 84.955 148.823 1.00 0.00 O ATOM 82170 H1 WAT 3123 44.827 84.107 148.379 1.00 0.00 H ATOM 82171 H2 WAT 3123 45.154 85.572 148.185 1.00 0.00 H TER 82173 WAT 3123 ATOM 82173 O WAT 3124 39.345 119.930 101.465 1.00 0.00 O ATOM 82174 H1 WAT 3124 39.443 119.960 100.514 1.00 0.00 H ATOM 82175 H2 WAT 3124 39.205 119.003 101.662 1.00 0.00 H TER 82177 WAT 3124 ATOM 82177 O WAT 3125 13.614 61.638 54.984 1.00 0.00 O ATOM 82178 H1 WAT 3125 14.490 62.021 55.034 1.00 0.00 H ATOM 82179 H2 WAT 3125 13.747 60.790 54.562 1.00 0.00 H TER 82181 WAT 3125 ATOM 82181 O WAT 3126 6.796 17.086 151.479 1.00 0.00 O ATOM 82182 H1 WAT 3126 5.925 17.373 151.752 1.00 0.00 H ATOM 82183 H2 WAT 3126 6.716 16.941 150.536 1.00 0.00 H TER 82185 WAT 3126 ATOM 82185 O WAT 3127 138.504 66.303 67.204 1.00 0.00 O ATOM 82186 H1 WAT 3127 137.802 65.860 66.727 1.00 0.00 H ATOM 82187 H2 WAT 3127 138.586 65.811 68.021 1.00 0.00 H TER 82189 WAT 3127 ATOM 82189 O WAT 3128 88.994 27.058 98.490 1.00 0.00 O ATOM 82190 H1 WAT 3128 88.458 27.848 98.415 1.00 0.00 H ATOM 82191 H2 WAT 3128 88.419 26.350 98.198 1.00 0.00 H TER 82193 WAT 3128 ATOM 82193 O WAT 3129 52.283 61.099 106.389 1.00 0.00 O ATOM 82194 H1 WAT 3129 51.766 60.466 106.888 1.00 0.00 H ATOM 82195 H2 WAT 3129 52.113 60.877 105.474 1.00 0.00 H TER 82197 WAT 3129 ATOM 82197 O WAT 3130 94.929 80.872 68.437 1.00 0.00 O ATOM 82198 H1 WAT 3130 94.300 81.461 68.020 1.00 0.00 H ATOM 82199 H2 WAT 3130 94.662 80.847 69.355 1.00 0.00 H TER 82201 WAT 3130 ATOM 82201 O WAT 3131 68.077 48.904 58.044 1.00 0.00 O ATOM 82202 H1 WAT 3131 68.563 48.702 57.244 1.00 0.00 H ATOM 82203 H2 WAT 3131 67.840 48.049 58.403 1.00 0.00 H TER 82205 WAT 3131 ATOM 82205 O WAT 3132 88.034 4.200 3.170 1.00 0.00 O ATOM 82206 H1 WAT 3132 88.567 4.763 3.732 1.00 0.00 H ATOM 82207 H2 WAT 3132 87.553 4.808 2.609 1.00 0.00 H TER 82209 WAT 3132 ATOM 82209 O WAT 3133 141.857 77.266 92.262 1.00 0.00 O ATOM 82210 H1 WAT 3133 142.314 76.826 91.545 1.00 0.00 H ATOM 82211 H2 WAT 3133 142.483 77.915 92.583 1.00 0.00 H TER 82213 WAT 3133 ATOM 82213 O WAT 3134 28.065 51.151 91.937 1.00 0.00 O ATOM 82214 H1 WAT 3134 28.042 50.373 92.494 1.00 0.00 H ATOM 82215 H2 WAT 3134 27.906 51.880 92.537 1.00 0.00 H TER 82217 WAT 3134 ATOM 82217 O WAT 3135 139.212 22.823 92.190 1.00 0.00 O ATOM 82218 H1 WAT 3135 139.429 21.891 92.185 1.00 0.00 H ATOM 82219 H2 WAT 3135 139.925 23.232 92.680 1.00 0.00 H TER 82221 WAT 3135 ATOM 82221 O WAT 3136 14.287 115.319 5.543 1.00 0.00 O ATOM 82222 H1 WAT 3136 14.822 116.003 5.139 1.00 0.00 H ATOM 82223 H2 WAT 3136 14.444 115.416 6.482 1.00 0.00 H TER 82225 WAT 3136 ATOM 82225 O WAT 3137 134.882 64.284 76.560 1.00 0.00 O ATOM 82226 H1 WAT 3137 134.127 63.818 76.919 1.00 0.00 H ATOM 82227 H2 WAT 3137 135.053 63.853 75.723 1.00 0.00 H TER 82229 WAT 3137 ATOM 82229 O WAT 3138 144.266 23.611 58.930 1.00 0.00 O ATOM 82230 H1 WAT 3138 145.105 23.659 59.387 1.00 0.00 H ATOM 82231 H2 WAT 3138 144.110 24.503 58.620 1.00 0.00 H TER 82233 WAT 3138 ATOM 82233 O WAT 3139 21.735 94.646 88.333 1.00 0.00 O ATOM 82234 H1 WAT 3139 22.662 94.427 88.429 1.00 0.00 H ATOM 82235 H2 WAT 3139 21.510 94.352 87.450 1.00 0.00 H TER 82237 WAT 3139 ATOM 82237 O WAT 3140 115.636 33.907 12.668 1.00 0.00 O ATOM 82238 H1 WAT 3140 116.215 33.169 12.479 1.00 0.00 H ATOM 82239 H2 WAT 3140 115.884 34.577 12.031 1.00 0.00 H TER 82241 WAT 3140 ATOM 82241 O WAT 3141 33.669 96.226 102.510 1.00 0.00 O ATOM 82242 H1 WAT 3141 34.326 95.536 102.422 1.00 0.00 H ATOM 82243 H2 WAT 3141 32.882 95.861 102.105 1.00 0.00 H TER 82245 WAT 3141 ATOM 82245 O WAT 3142 137.411 115.874 4.037 1.00 0.00 O ATOM 82246 H1 WAT 3142 137.581 116.816 4.019 1.00 0.00 H ATOM 82247 H2 WAT 3142 137.252 115.677 4.960 1.00 0.00 H TER 82249 WAT 3142 ATOM 82249 O WAT 3143 78.500 49.351 121.405 1.00 0.00 O ATOM 82250 H1 WAT 3143 79.366 49.110 121.075 1.00 0.00 H ATOM 82251 H2 WAT 3143 78.414 50.281 121.195 1.00 0.00 H TER 82253 WAT 3143 ATOM 82253 O WAT 3144 66.050 80.836 11.953 1.00 0.00 O ATOM 82254 H1 WAT 3144 65.322 80.218 11.890 1.00 0.00 H ATOM 82255 H2 WAT 3144 66.273 81.037 11.044 1.00 0.00 H TER 82257 WAT 3144 ATOM 82257 O WAT 3145 131.996 96.858 137.936 1.00 0.00 O ATOM 82258 H1 WAT 3145 131.534 96.227 138.489 1.00 0.00 H ATOM 82259 H2 WAT 3145 131.301 97.314 137.461 1.00 0.00 H TER 82261 WAT 3145 ATOM 82261 O WAT 3146 5.029 27.733 122.097 1.00 0.00 O ATOM 82262 H1 WAT 3146 4.414 27.214 122.615 1.00 0.00 H ATOM 82263 H2 WAT 3146 5.770 27.883 122.684 1.00 0.00 H TER 82265 WAT 3146 ATOM 82265 O WAT 3147 29.824 100.918 59.085 1.00 0.00 O ATOM 82266 H1 WAT 3147 30.577 100.344 59.233 1.00 0.00 H ATOM 82267 H2 WAT 3147 29.063 100.351 59.210 1.00 0.00 H TER 82269 WAT 3147 ATOM 82269 O WAT 3148 101.713 104.010 149.649 1.00 0.00 O ATOM 82270 H1 WAT 3148 101.886 103.153 149.259 1.00 0.00 H ATOM 82271 H2 WAT 3148 102.067 103.945 150.536 1.00 0.00 H TER 82273 WAT 3148 ATOM 82273 O WAT 3149 14.346 79.311 154.309 1.00 0.00 O ATOM 82274 H1 WAT 3149 14.024 78.422 154.464 1.00 0.00 H ATOM 82275 H2 WAT 3149 13.554 79.836 154.198 1.00 0.00 H TER 82277 WAT 3149 ATOM 82277 O WAT 3150 25.169 70.145 6.432 1.00 0.00 O ATOM 82278 H1 WAT 3150 25.397 71.075 6.404 1.00 0.00 H ATOM 82279 H2 WAT 3150 25.816 69.723 5.867 1.00 0.00 H TER 82281 WAT 3150 ATOM 82281 O WAT 3151 118.312 66.631 116.617 1.00 0.00 O ATOM 82282 H1 WAT 3151 119.212 66.852 116.859 1.00 0.00 H ATOM 82283 H2 WAT 3151 118.339 66.527 115.666 1.00 0.00 H TER 82285 WAT 3151 ATOM 82285 O WAT 3152 48.392 132.232 116.510 1.00 0.00 O ATOM 82286 H1 WAT 3152 48.183 132.025 117.421 1.00 0.00 H ATOM 82287 H2 WAT 3152 49.263 131.860 116.373 1.00 0.00 H TER 82289 WAT 3152 ATOM 82289 O WAT 3153 21.869 91.510 110.964 1.00 0.00 O ATOM 82290 H1 WAT 3153 22.589 91.894 110.463 1.00 0.00 H ATOM 82291 H2 WAT 3153 21.464 92.253 111.410 1.00 0.00 H TER 82293 WAT 3153 ATOM 82293 O WAT 3154 66.067 94.683 142.846 1.00 0.00 O ATOM 82294 H1 WAT 3154 65.114 94.597 142.838 1.00 0.00 H ATOM 82295 H2 WAT 3154 66.248 95.279 143.573 1.00 0.00 H TER 82297 WAT 3154 ATOM 82297 O WAT 3155 139.925 138.360 23.554 1.00 0.00 O ATOM 82298 H1 WAT 3155 139.216 138.508 22.928 1.00 0.00 H ATOM 82299 H2 WAT 3155 139.964 139.168 24.067 1.00 0.00 H TER 82301 WAT 3155 ATOM 82301 O WAT 3156 113.616 118.777 80.707 1.00 0.00 O ATOM 82302 H1 WAT 3156 113.532 118.247 79.915 1.00 0.00 H ATOM 82303 H2 WAT 3156 112.785 118.654 81.166 1.00 0.00 H TER 82305 WAT 3156 ATOM 82305 O WAT 3157 144.187 91.986 20.033 1.00 0.00 O ATOM 82306 H1 WAT 3157 144.399 91.529 20.847 1.00 0.00 H ATOM 82307 H2 WAT 3157 143.434 91.512 19.681 1.00 0.00 H TER 82309 WAT 3157 ATOM 82309 O WAT 3158 79.609 77.775 96.055 1.00 0.00 O ATOM 82310 H1 WAT 3158 79.935 78.670 95.956 1.00 0.00 H ATOM 82311 H2 WAT 3158 80.336 77.222 95.769 1.00 0.00 H TER 82313 WAT 3158 ATOM 82313 O WAT 3159 55.547 114.767 58.494 1.00 0.00 O ATOM 82314 H1 WAT 3159 56.163 114.293 57.936 1.00 0.00 H ATOM 82315 H2 WAT 3159 55.798 115.686 58.400 1.00 0.00 H TER 82317 WAT 3159 ATOM 82317 O WAT 3160 36.486 57.261 56.097 1.00 0.00 O ATOM 82318 H1 WAT 3160 36.383 58.098 56.550 1.00 0.00 H ATOM 82319 H2 WAT 3160 37.015 57.469 55.327 1.00 0.00 H TER 82321 WAT 3160 ATOM 82321 O WAT 3161 50.141 123.460 75.195 1.00 0.00 O ATOM 82322 H1 WAT 3161 49.377 123.044 75.593 1.00 0.00 H ATOM 82323 H2 WAT 3161 50.890 122.994 75.567 1.00 0.00 H TER 82325 WAT 3161 ATOM 82325 O WAT 3162 49.654 116.602 6.278 1.00 0.00 O ATOM 82326 H1 WAT 3162 50.173 117.369 6.519 1.00 0.00 H ATOM 82327 H2 WAT 3162 50.236 116.085 5.721 1.00 0.00 H TER 82329 WAT 3162 ATOM 82329 O WAT 3163 90.943 131.464 143.894 1.00 0.00 O ATOM 82330 H1 WAT 3163 90.687 132.128 144.534 1.00 0.00 H ATOM 82331 H2 WAT 3163 90.604 130.643 144.251 1.00 0.00 H TER 82333 WAT 3163 ATOM 82333 O WAT 3164 105.114 89.648 6.285 1.00 0.00 O ATOM 82334 H1 WAT 3164 105.423 88.743 6.261 1.00 0.00 H ATOM 82335 H2 WAT 3164 104.249 89.618 5.877 1.00 0.00 H TER 82337 WAT 3164 ATOM 82337 O WAT 3165 107.801 45.059 146.380 1.00 0.00 O ATOM 82338 H1 WAT 3165 107.888 45.164 147.327 1.00 0.00 H ATOM 82339 H2 WAT 3165 107.165 45.726 146.122 1.00 0.00 H TER 82341 WAT 3165 ATOM 82341 O WAT 3166 127.716 41.225 10.769 1.00 0.00 O ATOM 82342 H1 WAT 3166 126.898 41.619 11.070 1.00 0.00 H ATOM 82343 H2 WAT 3166 127.582 41.081 9.832 1.00 0.00 H TER 82345 WAT 3166 ATOM 82345 O WAT 3167 139.262 38.486 113.167 1.00 0.00 O ATOM 82346 H1 WAT 3167 140.019 38.064 112.760 1.00 0.00 H ATOM 82347 H2 WAT 3167 138.543 37.868 113.034 1.00 0.00 H TER 82349 WAT 3167 ATOM 82349 O WAT 3168 132.562 114.457 69.974 1.00 0.00 O ATOM 82350 H1 WAT 3168 133.122 114.358 69.204 1.00 0.00 H ATOM 82351 H2 WAT 3168 131.982 115.187 69.756 1.00 0.00 H TER 82353 WAT 3168 ATOM 82353 O WAT 3169 101.247 57.466 97.600 1.00 0.00 O ATOM 82354 H1 WAT 3169 100.530 57.266 98.201 1.00 0.00 H ATOM 82355 H2 WAT 3169 101.868 56.747 97.719 1.00 0.00 H TER 82357 WAT 3169 ATOM 82357 O WAT 3170 4.697 27.876 126.874 1.00 0.00 O ATOM 82358 H1 WAT 3170 5.375 28.490 127.158 1.00 0.00 H ATOM 82359 H2 WAT 3170 4.947 27.042 127.271 1.00 0.00 H TER 82361 WAT 3170 ATOM 82361 O WAT 3171 54.675 77.711 29.249 1.00 0.00 O ATOM 82362 H1 WAT 3171 55.328 78.402 29.140 1.00 0.00 H ATOM 82363 H2 WAT 3171 54.099 78.033 29.943 1.00 0.00 H TER 82365 WAT 3171 ATOM 82365 O WAT 3172 15.020 145.135 152.590 1.00 0.00 O ATOM 82366 H1 WAT 3172 14.921 144.191 152.714 1.00 0.00 H ATOM 82367 H2 WAT 3172 15.963 145.287 152.654 1.00 0.00 H TER 82369 WAT 3172 ATOM 82369 O WAT 3173 56.561 108.053 67.982 1.00 0.00 O ATOM 82370 H1 WAT 3173 55.861 107.731 67.413 1.00 0.00 H ATOM 82371 H2 WAT 3173 57.118 107.290 68.132 1.00 0.00 H TER 82373 WAT 3173 ATOM 82373 O WAT 3174 39.109 136.944 18.319 1.00 0.00 O ATOM 82374 H1 WAT 3174 39.674 137.289 19.011 1.00 0.00 H ATOM 82375 H2 WAT 3174 38.360 136.573 18.786 1.00 0.00 H TER 82377 WAT 3174 ATOM 82377 O WAT 3175 142.691 118.750 109.562 1.00 0.00 O ATOM 82378 H1 WAT 3175 143.419 119.311 109.294 1.00 0.00 H ATOM 82379 H2 WAT 3175 141.960 119.025 109.008 1.00 0.00 H TER 82381 WAT 3175 ATOM 82381 O WAT 3176 129.190 4.366 121.142 1.00 0.00 O ATOM 82382 H1 WAT 3176 128.726 5.103 120.744 1.00 0.00 H ATOM 82383 H2 WAT 3176 129.996 4.286 120.631 1.00 0.00 H TER 82385 WAT 3176 ATOM 82385 O WAT 3177 20.102 111.174 101.701 1.00 0.00 O ATOM 82386 H1 WAT 3177 20.396 110.639 102.438 1.00 0.00 H ATOM 82387 H2 WAT 3177 20.477 112.039 101.869 1.00 0.00 H TER 82389 WAT 3177 ATOM 82389 O WAT 3178 137.249 112.805 12.079 1.00 0.00 O ATOM 82390 H1 WAT 3178 138.055 112.314 11.917 1.00 0.00 H ATOM 82391 H2 WAT 3178 136.853 112.374 12.836 1.00 0.00 H TER 82393 WAT 3178 ATOM 82393 O WAT 3179 59.815 130.537 84.067 1.00 0.00 O ATOM 82394 H1 WAT 3179 60.321 130.985 84.744 1.00 0.00 H ATOM 82395 H2 WAT 3179 60.420 129.891 83.704 1.00 0.00 H TER 82397 WAT 3179 ATOM 82397 O WAT 3180 60.660 106.654 149.474 1.00 0.00 O ATOM 82398 H1 WAT 3180 60.435 107.051 150.315 1.00 0.00 H ATOM 82399 H2 WAT 3180 61.293 107.258 149.085 1.00 0.00 H TER 82401 WAT 3180 ATOM 82401 O WAT 3181 60.806 84.107 71.428 1.00 0.00 O ATOM 82402 H1 WAT 3181 61.053 83.830 70.546 1.00 0.00 H ATOM 82403 H2 WAT 3181 61.177 84.985 71.516 1.00 0.00 H TER 82405 WAT 3181 ATOM 82405 O WAT 3182 116.559 85.227 141.167 1.00 0.00 O ATOM 82406 H1 WAT 3182 117.444 85.446 141.459 1.00 0.00 H ATOM 82407 H2 WAT 3182 116.602 84.297 140.946 1.00 0.00 H TER 82409 WAT 3182 ATOM 82409 O WAT 3183 8.724 15.636 153.464 1.00 0.00 O ATOM 82410 H1 WAT 3183 8.073 15.232 152.891 1.00 0.00 H ATOM 82411 H2 WAT 3183 9.552 15.534 152.996 1.00 0.00 H TER 82413 WAT 3183 ATOM 82413 O WAT 3184 50.597 79.680 81.121 1.00 0.00 O ATOM 82414 H1 WAT 3184 51.312 79.735 80.487 1.00 0.00 H ATOM 82415 H2 WAT 3184 50.103 78.904 80.859 1.00 0.00 H TER 82417 WAT 3184 ATOM 82417 O WAT 3185 129.053 77.635 122.127 1.00 0.00 O ATOM 82418 H1 WAT 3185 129.925 77.683 122.519 1.00 0.00 H ATOM 82419 H2 WAT 3185 128.463 77.936 122.817 1.00 0.00 H TER 82421 WAT 3185 ATOM 82421 O WAT 3186 92.423 92.915 13.622 1.00 0.00 O ATOM 82422 H1 WAT 3186 91.591 93.256 13.952 1.00 0.00 H ATOM 82423 H2 WAT 3186 93.028 93.006 14.359 1.00 0.00 H TER 82425 WAT 3186 ATOM 82425 O WAT 3187 74.169 40.383 135.390 1.00 0.00 O ATOM 82426 H1 WAT 3187 73.687 40.556 134.581 1.00 0.00 H ATOM 82427 H2 WAT 3187 74.695 41.171 135.528 1.00 0.00 H TER 82429 WAT 3187 ATOM 82429 O WAT 3188 49.252 65.532 132.528 1.00 0.00 O ATOM 82430 H1 WAT 3188 49.739 65.697 133.335 1.00 0.00 H ATOM 82431 H2 WAT 3188 49.921 65.282 131.891 1.00 0.00 H TER 82433 WAT 3188 ATOM 82433 O WAT 3189 137.168 72.869 120.729 1.00 0.00 O ATOM 82434 H1 WAT 3189 137.800 73.469 121.126 1.00 0.00 H ATOM 82435 H2 WAT 3189 136.315 73.258 120.922 1.00 0.00 H TER 82437 WAT 3189 ATOM 82437 O WAT 3190 145.410 95.979 72.010 1.00 0.00 O ATOM 82438 H1 WAT 3190 145.286 96.257 72.917 1.00 0.00 H ATOM 82439 H2 WAT 3190 144.602 95.517 71.788 1.00 0.00 H TER 82441 WAT 3190 ATOM 82441 O WAT 3191 103.327 15.288 155.206 1.00 0.00 O ATOM 82442 H1 WAT 3191 102.901 15.844 155.858 1.00 0.00 H ATOM 82443 H2 WAT 3191 104.244 15.259 155.478 1.00 0.00 H TER 82445 WAT 3191 ATOM 82445 O WAT 3192 76.418 119.834 10.661 1.00 0.00 O ATOM 82446 H1 WAT 3192 76.880 120.611 10.975 1.00 0.00 H ATOM 82447 H2 WAT 3192 75.834 119.595 11.380 1.00 0.00 H TER 82449 WAT 3192 ATOM 82449 O WAT 3193 31.632 69.909 2.957 1.00 0.00 O ATOM 82450 H1 WAT 3193 30.785 70.231 2.647 1.00 0.00 H ATOM 82451 H2 WAT 3193 31.763 69.086 2.485 1.00 0.00 H TER 82453 WAT 3193 ATOM 82453 O WAT 3194 34.220 36.228 90.829 1.00 0.00 O ATOM 82454 H1 WAT 3194 35.058 36.077 91.266 1.00 0.00 H ATOM 82455 H2 WAT 3194 34.249 37.149 90.567 1.00 0.00 H TER 82457 WAT 3194 ATOM 82457 O WAT 3195 57.729 48.825 58.040 1.00 0.00 O ATOM 82458 H1 WAT 3195 58.026 49.523 57.456 1.00 0.00 H ATOM 82459 H2 WAT 3195 58.507 48.586 58.543 1.00 0.00 H TER 82461 WAT 3195 ATOM 82461 O WAT 3196 44.457 41.764 20.574 1.00 0.00 O ATOM 82462 H1 WAT 3196 44.856 42.351 21.216 1.00 0.00 H ATOM 82463 H2 WAT 3196 44.348 40.936 21.042 1.00 0.00 H TER 82465 WAT 3196 ATOM 82465 O WAT 3197 45.959 27.601 60.391 1.00 0.00 O ATOM 82466 H1 WAT 3197 45.540 26.921 59.864 1.00 0.00 H ATOM 82467 H2 WAT 3197 46.761 27.814 59.914 1.00 0.00 H TER 82469 WAT 3197 ATOM 82469 O WAT 3198 36.317 92.969 139.786 1.00 0.00 O ATOM 82470 H1 WAT 3198 37.075 93.509 140.011 1.00 0.00 H ATOM 82471 H2 WAT 3198 35.562 93.501 140.037 1.00 0.00 H TER 82473 WAT 3198 ATOM 82473 O WAT 3199 52.602 5.817 16.316 1.00 0.00 O ATOM 82474 H1 WAT 3199 51.677 5.874 16.078 1.00 0.00 H ATOM 82475 H2 WAT 3199 52.603 5.807 17.273 1.00 0.00 H TER 82477 WAT 3199 ATOM 82477 O WAT 3200 123.586 103.547 76.731 1.00 0.00 O ATOM 82478 H1 WAT 3200 123.339 103.355 77.635 1.00 0.00 H ATOM 82479 H2 WAT 3200 122.756 103.558 76.253 1.00 0.00 H TER 82481 WAT 3200 ATOM 82481 O WAT 3201 46.959 56.332 116.215 1.00 0.00 O ATOM 82482 H1 WAT 3201 47.271 57.024 115.632 1.00 0.00 H ATOM 82483 H2 WAT 3201 46.451 56.793 116.883 1.00 0.00 H TER 82485 WAT 3201 ATOM 82485 O WAT 3202 113.830 66.180 113.627 1.00 0.00 O ATOM 82486 H1 WAT 3202 113.328 65.724 112.952 1.00 0.00 H ATOM 82487 H2 WAT 3202 113.428 67.047 113.679 1.00 0.00 H TER 82489 WAT 3202 ATOM 82489 O WAT 3203 117.079 15.258 58.608 1.00 0.00 O ATOM 82490 H1 WAT 3203 116.938 15.510 59.521 1.00 0.00 H ATOM 82491 H2 WAT 3203 116.626 15.931 58.101 1.00 0.00 H TER 82493 WAT 3203 ATOM 82493 O WAT 3204 138.154 47.291 154.790 1.00 0.00 O ATOM 82494 H1 WAT 3204 138.619 48.127 154.781 1.00 0.00 H ATOM 82495 H2 WAT 3204 137.705 47.276 155.635 1.00 0.00 H TER 82497 WAT 3204 ATOM 82497 O WAT 3205 50.820 7.910 142.064 1.00 0.00 O ATOM 82498 H1 WAT 3205 50.680 7.315 141.328 1.00 0.00 H ATOM 82499 H2 WAT 3205 51.136 7.346 142.771 1.00 0.00 H TER 82501 WAT 3205 ATOM 82501 O WAT 3206 115.127 122.924 91.386 1.00 0.00 O ATOM 82502 H1 WAT 3206 114.420 123.568 91.344 1.00 0.00 H ATOM 82503 H2 WAT 3206 114.772 122.149 90.951 1.00 0.00 H TER 82505 WAT 3206 ATOM 82505 O WAT 3207 21.537 60.986 117.240 1.00 0.00 O ATOM 82506 H1 WAT 3207 21.435 60.472 118.041 1.00 0.00 H ATOM 82507 H2 WAT 3207 20.725 60.836 116.755 1.00 0.00 H TER 82509 WAT 3207 ATOM 82509 O WAT 3208 139.941 37.455 71.454 1.00 0.00 O ATOM 82510 H1 WAT 3208 140.825 37.329 71.798 1.00 0.00 H ATOM 82511 H2 WAT 3208 139.757 36.653 70.965 1.00 0.00 H TER 82513 WAT 3208 ATOM 82513 O WAT 3209 113.332 27.938 4.317 1.00 0.00 O ATOM 82514 H1 WAT 3209 113.720 28.334 3.536 1.00 0.00 H ATOM 82515 H2 WAT 3209 114.082 27.641 4.832 1.00 0.00 H TER 82517 WAT 3209 ATOM 82517 O WAT 3210 64.498 31.981 146.898 1.00 0.00 O ATOM 82518 H1 WAT 3210 63.961 31.407 147.444 1.00 0.00 H ATOM 82519 H2 WAT 3210 65.159 31.401 146.519 1.00 0.00 H TER 82521 WAT 3210 ATOM 82521 O WAT 3211 65.594 48.940 10.181 1.00 0.00 O ATOM 82522 H1 WAT 3211 65.618 49.868 9.947 1.00 0.00 H ATOM 82523 H2 WAT 3211 65.959 48.907 11.066 1.00 0.00 H TER 82525 WAT 3211 ATOM 82525 O WAT 3212 101.306 30.216 113.870 1.00 0.00 O ATOM 82526 H1 WAT 3212 102.192 29.960 114.126 1.00 0.00 H ATOM 82527 H2 WAT 3212 100.931 30.602 114.662 1.00 0.00 H TER 82529 WAT 3212 ATOM 82529 O WAT 3213 14.365 98.557 96.755 1.00 0.00 O ATOM 82530 H1 WAT 3213 15.123 99.000 96.372 1.00 0.00 H ATOM 82531 H2 WAT 3213 14.729 97.775 97.169 1.00 0.00 H TER 82533 WAT 3213 ATOM 82533 O WAT 3214 64.988 123.741 114.509 1.00 0.00 O ATOM 82534 H1 WAT 3214 64.157 124.143 114.764 1.00 0.00 H ATOM 82535 H2 WAT 3214 64.895 123.572 113.572 1.00 0.00 H TER 82537 WAT 3214 ATOM 82537 O WAT 3215 131.271 53.006 108.863 1.00 0.00 O ATOM 82538 H1 WAT 3215 131.718 52.222 109.181 1.00 0.00 H ATOM 82539 H2 WAT 3215 130.640 53.218 109.551 1.00 0.00 H TER 82541 WAT 3215 ATOM 82541 O WAT 3216 15.058 78.594 89.955 1.00 0.00 O ATOM 82542 H1 WAT 3216 14.358 79.194 90.214 1.00 0.00 H ATOM 82543 H2 WAT 3216 15.484 78.354 90.778 1.00 0.00 H TER 82545 WAT 3216 ATOM 82545 O WAT 3217 111.397 91.376 87.235 1.00 0.00 O ATOM 82546 H1 WAT 3217 110.462 91.489 87.063 1.00 0.00 H ATOM 82547 H2 WAT 3217 111.645 90.612 86.716 1.00 0.00 H TER 82549 WAT 3217 ATOM 82549 O WAT 3218 30.113 64.557 105.079 1.00 0.00 O ATOM 82550 H1 WAT 3218 30.072 64.834 104.163 1.00 0.00 H ATOM 82551 H2 WAT 3218 31.014 64.257 105.198 1.00 0.00 H TER 82553 WAT 3218 ATOM 82553 O WAT 3219 116.449 136.335 68.594 1.00 0.00 O ATOM 82554 H1 WAT 3219 115.955 136.858 69.225 1.00 0.00 H ATOM 82555 H2 WAT 3219 115.935 135.535 68.491 1.00 0.00 H TER 82557 WAT 3219 ATOM 82557 O WAT 3220 17.011 39.184 58.127 1.00 0.00 O ATOM 82558 H1 WAT 3220 17.424 38.425 57.716 1.00 0.00 H ATOM 82559 H2 WAT 3220 16.806 39.769 57.398 1.00 0.00 H TER 82561 WAT 3220 ATOM 82561 O WAT 3221 119.170 136.560 75.398 1.00 0.00 O ATOM 82562 H1 WAT 3221 119.667 137.293 75.034 1.00 0.00 H ATOM 82563 H2 WAT 3221 119.734 136.206 76.086 1.00 0.00 H TER 82565 WAT 3221 ATOM 82565 O WAT 3222 86.052 45.002 75.387 1.00 0.00 O ATOM 82566 H1 WAT 3222 86.866 44.966 75.888 1.00 0.00 H ATOM 82567 H2 WAT 3222 86.069 45.861 74.964 1.00 0.00 H TER 82569 WAT 3222 ATOM 82569 O WAT 3223 120.360 29.976 144.861 1.00 0.00 O ATOM 82570 H1 WAT 3223 120.273 29.137 145.313 1.00 0.00 H ATOM 82571 H2 WAT 3223 120.662 29.746 143.983 1.00 0.00 H TER 82573 WAT 3223 ATOM 82573 O WAT 3224 59.831 53.676 93.074 1.00 0.00 O ATOM 82574 H1 WAT 3224 59.899 52.975 92.427 1.00 0.00 H ATOM 82575 H2 WAT 3224 58.908 53.929 93.057 1.00 0.00 H TER 82577 WAT 3224 ATOM 82577 O WAT 3225 46.112 78.262 1.373 1.00 0.00 O ATOM 82578 H1 WAT 3225 46.492 78.390 0.504 1.00 0.00 H ATOM 82579 H2 WAT 3225 45.643 79.078 1.551 1.00 0.00 H TER 82581 WAT 3225 ATOM 82581 O WAT 3226 48.987 113.037 64.113 1.00 0.00 O ATOM 82582 H1 WAT 3226 48.619 113.670 63.497 1.00 0.00 H ATOM 82583 H2 WAT 3226 48.982 112.207 63.635 1.00 0.00 H TER 82585 WAT 3226 ATOM 82585 O WAT 3227 13.375 53.102 4.592 1.00 0.00 O ATOM 82586 H1 WAT 3227 12.672 53.069 5.241 1.00 0.00 H ATOM 82587 H2 WAT 3227 13.515 52.188 4.345 1.00 0.00 H TER 82589 WAT 3227 ATOM 82589 O WAT 3228 29.807 18.993 147.712 1.00 0.00 O ATOM 82590 H1 WAT 3228 29.312 19.805 147.606 1.00 0.00 H ATOM 82591 H2 WAT 3228 30.679 19.199 147.377 1.00 0.00 H TER 82593 WAT 3228 ATOM 82593 O WAT 3229 118.463 36.817 133.814 1.00 0.00 O ATOM 82594 H1 WAT 3229 118.315 35.892 134.012 1.00 0.00 H ATOM 82595 H2 WAT 3229 117.646 37.110 133.411 1.00 0.00 H TER 82597 WAT 3229 ATOM 82597 O WAT 3230 76.771 48.993 108.040 1.00 0.00 O ATOM 82598 H1 WAT 3230 76.620 49.690 108.678 1.00 0.00 H ATOM 82599 H2 WAT 3230 77.718 48.855 108.057 1.00 0.00 H TER 82601 WAT 3230 ATOM 82601 O WAT 3231 114.886 21.978 61.217 1.00 0.00 O ATOM 82602 H1 WAT 3231 115.628 21.729 60.666 1.00 0.00 H ATOM 82603 H2 WAT 3231 114.333 22.511 60.647 1.00 0.00 H TER 82605 WAT 3231 ATOM 82605 O WAT 3232 82.769 51.266 102.217 1.00 0.00 O ATOM 82606 H1 WAT 3232 82.398 51.482 103.073 1.00 0.00 H ATOM 82607 H2 WAT 3232 83.171 50.406 102.341 1.00 0.00 H TER 82609 WAT 3232 ATOM 82609 O WAT 3233 86.674 59.007 71.670 1.00 0.00 O ATOM 82610 H1 WAT 3233 86.284 59.016 72.544 1.00 0.00 H ATOM 82611 H2 WAT 3233 86.884 58.087 71.510 1.00 0.00 H TER 82613 WAT 3233 ATOM 82613 O WAT 3234 45.694 97.634 8.885 1.00 0.00 O ATOM 82614 H1 WAT 3234 44.798 97.864 9.131 1.00 0.00 H ATOM 82615 H2 WAT 3234 45.946 98.301 8.247 1.00 0.00 H TER 82617 WAT 3234 ATOM 82617 O WAT 3235 42.727 10.699 149.919 1.00 0.00 O ATOM 82618 H1 WAT 3235 43.245 11.297 150.459 1.00 0.00 H ATOM 82619 H2 WAT 3235 43.292 9.936 149.798 1.00 0.00 H TER 82621 WAT 3235 ATOM 82621 O WAT 3236 129.646 111.116 125.617 1.00 0.00 O ATOM 82622 H1 WAT 3236 129.598 110.961 124.673 1.00 0.00 H ATOM 82623 H2 WAT 3236 129.002 110.515 125.992 1.00 0.00 H TER 82625 WAT 3236 ATOM 82625 O WAT 3237 58.942 38.096 139.629 1.00 0.00 O ATOM 82626 H1 WAT 3237 59.849 37.851 139.810 1.00 0.00 H ATOM 82627 H2 WAT 3237 58.426 37.571 140.242 1.00 0.00 H TER 82629 WAT 3237 ATOM 82629 O WAT 3238 11.487 122.242 6.833 1.00 0.00 O ATOM 82630 H1 WAT 3238 10.535 122.182 6.751 1.00 0.00 H ATOM 82631 H2 WAT 3238 11.796 121.347 6.697 1.00 0.00 H TER 82633 WAT 3238 ATOM 82633 O WAT 3239 111.005 88.090 5.083 1.00 0.00 O ATOM 82634 H1 WAT 3239 110.085 88.257 4.881 1.00 0.00 H ATOM 82635 H2 WAT 3239 111.059 87.139 5.183 1.00 0.00 H TER 82637 WAT 3239 ATOM 82637 O WAT 3240 5.256 134.021 144.588 1.00 0.00 O ATOM 82638 H1 WAT 3240 5.966 134.589 144.287 1.00 0.00 H ATOM 82639 H2 WAT 3240 5.354 133.221 144.071 1.00 0.00 H TER 82641 WAT 3240 ATOM 82641 O WAT 3241 87.046 86.439 62.244 1.00 0.00 O ATOM 82642 H1 WAT 3241 87.831 85.891 62.237 1.00 0.00 H ATOM 82643 H2 WAT 3241 86.778 86.485 61.326 1.00 0.00 H TER 82645 WAT 3241 ATOM 82645 O WAT 3242 9.963 65.965 135.774 1.00 0.00 O ATOM 82646 H1 WAT 3242 10.030 66.906 135.609 1.00 0.00 H ATOM 82647 H2 WAT 3242 10.106 65.561 134.918 1.00 0.00 H TER 82649 WAT 3242 ATOM 82649 O WAT 3243 93.009 37.879 79.434 1.00 0.00 O ATOM 82650 H1 WAT 3243 92.477 37.099 79.278 1.00 0.00 H ATOM 82651 H2 WAT 3243 93.691 37.842 78.764 1.00 0.00 H TER 82653 WAT 3243 ATOM 82653 O WAT 3244 101.131 142.990 77.973 1.00 0.00 O ATOM 82654 H1 WAT 3244 100.889 142.370 78.661 1.00 0.00 H ATOM 82655 H2 WAT 3244 102.083 142.913 77.906 1.00 0.00 H TER 82657 WAT 3244 ATOM 82657 O WAT 3245 39.668 47.242 80.385 1.00 0.00 O ATOM 82658 H1 WAT 3245 40.186 46.455 80.217 1.00 0.00 H ATOM 82659 H2 WAT 3245 39.797 47.784 79.606 1.00 0.00 H TER 82661 WAT 3245 ATOM 82661 O WAT 3246 117.450 46.162 76.359 1.00 0.00 O ATOM 82662 H1 WAT 3246 117.605 47.087 76.171 1.00 0.00 H ATOM 82663 H2 WAT 3246 118.247 45.721 76.065 1.00 0.00 H TER 82665 WAT 3246 ATOM 82665 O WAT 3247 96.504 90.553 11.132 1.00 0.00 O ATOM 82666 H1 WAT 3247 95.818 90.060 10.683 1.00 0.00 H ATOM 82667 H2 WAT 3247 97.028 90.931 10.426 1.00 0.00 H TER 82669 WAT 3247 ATOM 82669 O WAT 3248 112.137 72.785 107.140 1.00 0.00 O ATOM 82670 H1 WAT 3248 111.465 72.586 106.488 1.00 0.00 H ATOM 82671 H2 WAT 3248 112.630 73.513 106.763 1.00 0.00 H TER 82673 WAT 3248 ATOM 82673 O WAT 3249 9.013 33.062 152.260 1.00 0.00 O ATOM 82674 H1 WAT 3249 8.961 33.992 152.040 1.00 0.00 H ATOM 82675 H2 WAT 3249 9.501 33.038 153.084 1.00 0.00 H TER 82677 WAT 3249 ATOM 82677 O WAT 3250 88.496 79.377 73.421 1.00 0.00 O ATOM 82678 H1 WAT 3250 89.370 79.190 73.762 1.00 0.00 H ATOM 82679 H2 WAT 3250 88.069 79.874 74.119 1.00 0.00 H TER 82681 WAT 3250 ATOM 82681 O WAT 3251 120.089 135.944 81.852 1.00 0.00 O ATOM 82682 H1 WAT 3251 120.769 135.285 81.989 1.00 0.00 H ATOM 82683 H2 WAT 3251 119.419 135.493 81.337 1.00 0.00 H TER 82685 WAT 3251 ATOM 82685 O WAT 3252 9.882 110.648 60.696 1.00 0.00 O ATOM 82686 H1 WAT 3252 10.437 109.939 61.022 1.00 0.00 H ATOM 82687 H2 WAT 3252 9.383 110.251 59.981 1.00 0.00 H TER 82689 WAT 3252 ATOM 82689 O WAT 3253 112.334 14.863 92.035 1.00 0.00 O ATOM 82690 H1 WAT 3253 111.918 15.038 91.190 1.00 0.00 H ATOM 82691 H2 WAT 3253 113.268 14.806 91.835 1.00 0.00 H TER 82693 WAT 3253 ATOM 82693 O WAT 3254 52.963 12.030 145.454 1.00 0.00 O ATOM 82694 H1 WAT 3254 52.849 11.192 145.006 1.00 0.00 H ATOM 82695 H2 WAT 3254 52.624 12.679 144.838 1.00 0.00 H TER 82697 WAT 3254 ATOM 82697 O WAT 3255 8.595 121.939 109.624 1.00 0.00 O ATOM 82698 H1 WAT 3255 9.198 121.646 108.941 1.00 0.00 H ATOM 82699 H2 WAT 3255 8.806 121.392 110.381 1.00 0.00 H TER 82701 WAT 3255 ATOM 82701 O WAT 3256 74.592 10.972 158.091 1.00 0.00 O ATOM 82702 H1 WAT 3256 74.854 10.919 157.173 1.00 0.00 H ATOM 82703 H2 WAT 3256 73.887 11.620 158.102 1.00 0.00 H TER 82705 WAT 3256 ATOM 82705 O WAT 3257 18.217 126.752 126.959 1.00 0.00 O ATOM 82706 H1 WAT 3257 17.977 127.649 127.190 1.00 0.00 H ATOM 82707 H2 WAT 3257 18.742 126.842 126.163 1.00 0.00 H TER 82709 WAT 3257 ATOM 82709 O WAT 3258 21.586 53.053 121.469 1.00 0.00 O ATOM 82710 H1 WAT 3258 21.742 52.118 121.334 1.00 0.00 H ATOM 82711 H2 WAT 3258 22.107 53.484 120.792 1.00 0.00 H TER 82713 WAT 3258 ATOM 82713 O WAT 3259 63.836 77.739 19.518 1.00 0.00 O ATOM 82714 H1 WAT 3259 64.648 77.937 19.052 1.00 0.00 H ATOM 82715 H2 WAT 3259 63.146 77.887 18.872 1.00 0.00 H TER 82717 WAT 3259 ATOM 82717 O WAT 3260 61.795 40.460 72.487 1.00 0.00 O ATOM 82718 H1 WAT 3260 61.300 41.234 72.756 1.00 0.00 H ATOM 82719 H2 WAT 3260 62.449 40.342 73.176 1.00 0.00 H TER 82721 WAT 3260 ATOM 82721 O WAT 3261 100.168 101.203 117.215 1.00 0.00 O ATOM 82722 H1 WAT 3261 100.190 102.084 116.840 1.00 0.00 H ATOM 82723 H2 WAT 3261 100.542 101.306 118.090 1.00 0.00 H TER 82725 WAT 3261 ATOM 82725 O WAT 3262 70.630 59.324 77.285 1.00 0.00 O ATOM 82726 H1 WAT 3262 70.092 59.339 76.494 1.00 0.00 H ATOM 82727 H2 WAT 3262 70.056 59.664 77.971 1.00 0.00 H TER 82729 WAT 3262 ATOM 82729 O WAT 3263 51.481 59.224 5.198 1.00 0.00 O ATOM 82730 H1 WAT 3263 51.593 59.972 5.784 1.00 0.00 H ATOM 82731 H2 WAT 3263 51.881 59.503 4.374 1.00 0.00 H TER 82733 WAT 3263 ATOM 82733 O WAT 3264 118.510 34.000 9.300 1.00 0.00 O ATOM 82734 H1 WAT 3264 117.915 33.256 9.214 1.00 0.00 H ATOM 82735 H2 WAT 3264 118.903 33.894 10.166 1.00 0.00 H TER 82737 WAT 3264 ATOM 82737 O WAT 3265 126.848 133.274 138.453 1.00 0.00 O ATOM 82738 H1 WAT 3265 126.974 133.938 137.776 1.00 0.00 H ATOM 82739 H2 WAT 3265 125.909 133.087 138.434 1.00 0.00 H TER 82741 WAT 3265 ATOM 82741 O WAT 3266 123.606 143.307 4.501 1.00 0.00 O ATOM 82742 H1 WAT 3266 124.154 142.711 3.991 1.00 0.00 H ATOM 82743 H2 WAT 3266 124.137 144.097 4.600 1.00 0.00 H TER 82745 WAT 3266 ATOM 82745 O WAT 3267 87.854 130.180 142.041 1.00 0.00 O ATOM 82746 H1 WAT 3267 88.633 130.601 141.679 1.00 0.00 H ATOM 82747 H2 WAT 3267 87.699 130.634 142.869 1.00 0.00 H TER 82749 WAT 3267 ATOM 82749 O WAT 3268 97.245 41.051 65.843 1.00 0.00 O ATOM 82750 H1 WAT 3268 97.634 40.188 65.986 1.00 0.00 H ATOM 82751 H2 WAT 3268 96.982 41.045 64.923 1.00 0.00 H TER 82753 WAT 3268 ATOM 82753 O WAT 3269 22.617 106.100 18.538 1.00 0.00 O ATOM 82754 H1 WAT 3269 22.475 105.285 18.056 1.00 0.00 H ATOM 82755 H2 WAT 3269 21.798 106.244 19.012 1.00 0.00 H TER 82757 WAT 3269 ATOM 82757 O WAT 3270 142.419 50.723 150.835 1.00 0.00 O ATOM 82758 H1 WAT 3270 143.275 51.097 150.628 1.00 0.00 H ATOM 82759 H2 WAT 3270 142.505 49.793 150.624 1.00 0.00 H TER 82761 WAT 3270 ATOM 82761 O WAT 3271 105.498 19.421 4.043 1.00 0.00 O ATOM 82762 H1 WAT 3271 105.776 19.129 3.175 1.00 0.00 H ATOM 82763 H2 WAT 3271 106.315 19.560 4.522 1.00 0.00 H TER 82765 WAT 3271 ATOM 82765 O WAT 3272 4.306 1.861 149.260 1.00 0.00 O ATOM 82766 H1 WAT 3272 5.044 1.648 149.832 1.00 0.00 H ATOM 82767 H2 WAT 3272 4.097 1.036 148.822 1.00 0.00 H TER 82769 WAT 3272 ATOM 82769 O WAT 3273 47.527 33.896 83.508 1.00 0.00 O ATOM 82770 H1 WAT 3273 48.095 33.687 84.249 1.00 0.00 H ATOM 82771 H2 WAT 3273 46.653 33.631 83.795 1.00 0.00 H TER 82773 WAT 3273 ATOM 82773 O WAT 3274 22.719 140.313 68.854 1.00 0.00 O ATOM 82774 H1 WAT 3274 22.193 139.549 68.616 1.00 0.00 H ATOM 82775 H2 WAT 3274 22.287 141.047 68.416 1.00 0.00 H TER 82777 WAT 3274 ATOM 82777 O WAT 3275 116.052 117.777 120.857 1.00 0.00 O ATOM 82778 H1 WAT 3275 115.298 117.970 121.415 1.00 0.00 H ATOM 82779 H2 WAT 3275 115.696 117.231 120.156 1.00 0.00 H TER 82781 WAT 3275 ATOM 82781 O WAT 3276 62.692 132.256 127.835 1.00 0.00 O ATOM 82782 H1 WAT 3276 62.038 131.842 128.398 1.00 0.00 H ATOM 82783 H2 WAT 3276 63.507 131.795 128.036 1.00 0.00 H TER 82785 WAT 3276 ATOM 82785 O WAT 3277 24.809 50.831 14.329 1.00 0.00 O ATOM 82786 H1 WAT 3277 25.133 50.305 15.060 1.00 0.00 H ATOM 82787 H2 WAT 3277 25.600 51.144 13.890 1.00 0.00 H TER 82789 WAT 3277 ATOM 82789 O WAT 3278 78.035 76.592 70.549 1.00 0.00 O ATOM 82790 H1 WAT 3278 78.579 75.940 70.989 1.00 0.00 H ATOM 82791 H2 WAT 3278 77.218 76.599 71.047 1.00 0.00 H TER 82793 WAT 3278 ATOM 82793 O WAT 3279 84.155 131.106 1.708 1.00 0.00 O ATOM 82794 H1 WAT 3279 83.544 131.500 2.331 1.00 0.00 H ATOM 82795 H2 WAT 3279 83.686 130.348 1.359 1.00 0.00 H TER 82797 WAT 3279 ATOM 82797 O WAT 3280 87.752 21.786 114.372 1.00 0.00 O ATOM 82798 H1 WAT 3280 87.507 22.605 114.802 1.00 0.00 H ATOM 82799 H2 WAT 3280 87.145 21.710 113.636 1.00 0.00 H TER 82801 WAT 3280 ATOM 82801 O WAT 3281 14.134 52.293 14.877 1.00 0.00 O ATOM 82802 H1 WAT 3281 14.394 53.211 14.803 1.00 0.00 H ATOM 82803 H2 WAT 3281 13.180 52.308 14.809 1.00 0.00 H TER 82805 WAT 3281 ATOM 82805 O WAT 3282 22.274 106.931 135.208 1.00 0.00 O ATOM 82806 H1 WAT 3282 22.086 106.367 135.958 1.00 0.00 H ATOM 82807 H2 WAT 3282 21.653 107.654 135.289 1.00 0.00 H TER 82809 WAT 3282 ATOM 82809 O WAT 3283 73.512 74.255 144.557 1.00 0.00 O ATOM 82810 H1 WAT 3283 72.667 74.702 144.607 1.00 0.00 H ATOM 82811 H2 WAT 3283 74.089 74.769 145.121 1.00 0.00 H TER 82813 WAT 3283 ATOM 82813 O WAT 3284 109.981 46.188 74.540 1.00 0.00 O ATOM 82814 H1 WAT 3284 109.387 46.014 73.810 1.00 0.00 H ATOM 82815 H2 WAT 3284 109.404 46.326 75.291 1.00 0.00 H TER 82817 WAT 3284 ATOM 82817 O WAT 3285 78.022 48.630 92.761 1.00 0.00 O ATOM 82818 H1 WAT 3285 77.788 47.728 92.543 1.00 0.00 H ATOM 82819 H2 WAT 3285 78.291 48.592 93.679 1.00 0.00 H TER 82821 WAT 3285 ATOM 82821 O WAT 3286 143.024 74.290 4.929 1.00 0.00 O ATOM 82822 H1 WAT 3286 142.893 75.214 5.145 1.00 0.00 H ATOM 82823 H2 WAT 3286 143.842 74.273 4.433 1.00 0.00 H TER 82825 WAT 3286 ATOM 82825 O WAT 3287 96.122 31.230 139.203 1.00 0.00 O ATOM 82826 H1 WAT 3287 95.849 31.328 140.115 1.00 0.00 H ATOM 82827 H2 WAT 3287 96.242 30.287 139.088 1.00 0.00 H TER 82829 WAT 3287 ATOM 82829 O WAT 3288 81.447 116.557 67.818 1.00 0.00 O ATOM 82830 H1 WAT 3288 82.024 115.918 68.236 1.00 0.00 H ATOM 82831 H2 WAT 3288 80.706 116.040 67.502 1.00 0.00 H TER 82833 WAT 3288 ATOM 82833 O WAT 3289 6.097 92.061 127.990 1.00 0.00 O ATOM 82834 H1 WAT 3289 5.194 92.214 127.711 1.00 0.00 H ATOM 82835 H2 WAT 3289 6.326 92.838 128.499 1.00 0.00 H TER 82837 WAT 3289 ATOM 82837 O WAT 3290 39.423 81.238 86.898 1.00 0.00 O ATOM 82838 H1 WAT 3290 39.556 80.712 86.110 1.00 0.00 H ATOM 82839 H2 WAT 3290 38.801 80.732 87.421 1.00 0.00 H TER 82841 WAT 3290 ATOM 82841 O WAT 3291 86.618 56.133 137.978 1.00 0.00 O ATOM 82842 H1 WAT 3291 86.159 56.060 137.141 1.00 0.00 H ATOM 82843 H2 WAT 3291 87.103 56.956 137.915 1.00 0.00 H TER 82845 WAT 3291 ATOM 82845 O WAT 3292 114.506 141.025 137.668 1.00 0.00 O ATOM 82846 H1 WAT 3292 114.196 141.182 138.560 1.00 0.00 H ATOM 82847 H2 WAT 3292 113.708 140.879 137.159 1.00 0.00 H TER 82849 WAT 3292 ATOM 82849 O WAT 3293 118.914 144.295 94.237 1.00 0.00 O ATOM 82850 H1 WAT 3293 118.409 143.488 94.336 1.00 0.00 H ATOM 82851 H2 WAT 3293 118.394 144.833 93.641 1.00 0.00 H TER 82853 WAT 3293 ATOM 82853 O WAT 3294 134.717 106.219 144.947 1.00 0.00 O ATOM 82854 H1 WAT 3294 135.672 106.158 144.954 1.00 0.00 H ATOM 82855 H2 WAT 3294 134.463 106.110 145.863 1.00 0.00 H TER 82857 WAT 3294 ATOM 82857 O WAT 3295 44.944 30.684 3.064 1.00 0.00 O ATOM 82858 H1 WAT 3295 45.789 31.085 3.269 1.00 0.00 H ATOM 82859 H2 WAT 3295 44.376 30.937 3.792 1.00 0.00 H TER 82861 WAT 3295 ATOM 82861 O WAT 3296 66.021 33.954 85.811 1.00 0.00 O ATOM 82862 H1 WAT 3296 66.587 33.593 85.129 1.00 0.00 H ATOM 82863 H2 WAT 3296 66.097 34.903 85.707 1.00 0.00 H TER 82865 WAT 3296 ATOM 82865 O WAT 3297 41.005 66.139 104.245 1.00 0.00 O ATOM 82866 H1 WAT 3297 41.158 66.411 105.150 1.00 0.00 H ATOM 82867 H2 WAT 3297 40.469 65.349 104.319 1.00 0.00 H TER 82869 WAT 3297 ATOM 82869 O WAT 3298 39.932 145.066 157.931 1.00 0.00 O ATOM 82870 H1 WAT 3298 39.372 144.339 157.661 1.00 0.00 H ATOM 82871 H2 WAT 3298 39.643 145.273 158.820 1.00 0.00 H TER 82873 WAT 3298 ATOM 82873 O WAT 3299 78.460 4.441 153.871 1.00 0.00 O ATOM 82874 H1 WAT 3299 78.526 5.247 153.359 1.00 0.00 H ATOM 82875 H2 WAT 3299 77.734 3.962 153.472 1.00 0.00 H TER 82877 WAT 3299 ATOM 82877 O WAT 3300 85.448 48.971 154.031 1.00 0.00 O ATOM 82878 H1 WAT 3300 86.289 49.427 154.067 1.00 0.00 H ATOM 82879 H2 WAT 3300 85.066 49.238 153.195 1.00 0.00 H TER 82881 WAT 3300 ATOM 82881 O WAT 3301 3.830 133.064 56.436 1.00 0.00 O ATOM 82882 H1 WAT 3301 2.911 133.079 56.704 1.00 0.00 H ATOM 82883 H2 WAT 3301 4.195 132.297 56.877 1.00 0.00 H TER 82885 WAT 3301 ATOM 82885 O WAT 3302 96.507 2.116 133.843 1.00 0.00 O ATOM 82886 H1 WAT 3302 95.578 2.067 133.619 1.00 0.00 H ATOM 82887 H2 WAT 3302 96.938 2.357 133.022 1.00 0.00 H TER 82889 WAT 3302 ATOM 82889 O WAT 3303 80.132 120.240 73.082 1.00 0.00 O ATOM 82890 H1 WAT 3303 80.135 120.674 73.935 1.00 0.00 H ATOM 82891 H2 WAT 3303 80.614 119.426 73.225 1.00 0.00 H TER 82893 WAT 3303 ATOM 82893 O WAT 3304 53.246 27.989 22.939 1.00 0.00 O ATOM 82894 H1 WAT 3304 54.136 27.701 23.143 1.00 0.00 H ATOM 82895 H2 WAT 3304 52.944 27.378 22.268 1.00 0.00 H TER 82897 WAT 3304 ATOM 82897 O WAT 3305 3.073 67.061 145.699 1.00 0.00 O ATOM 82898 H1 WAT 3305 3.577 67.821 145.988 1.00 0.00 H ATOM 82899 H2 WAT 3305 3.205 67.033 144.751 1.00 0.00 H TER 82901 WAT 3305 ATOM 82901 O WAT 3306 55.551 71.915 8.775 1.00 0.00 O ATOM 82902 H1 WAT 3306 55.218 71.389 8.048 1.00 0.00 H ATOM 82903 H2 WAT 3306 56.503 71.884 8.676 1.00 0.00 H TER 82905 WAT 3306 ATOM 82905 O WAT 3307 7.359 74.127 137.304 1.00 0.00 O ATOM 82906 H1 WAT 3307 7.531 74.943 137.775 1.00 0.00 H ATOM 82907 H2 WAT 3307 7.533 73.439 137.946 1.00 0.00 H TER 82909 WAT 3307 ATOM 82909 O WAT 3308 47.965 11.301 151.042 1.00 0.00 O ATOM 82910 H1 WAT 3308 47.580 10.779 151.746 1.00 0.00 H ATOM 82911 H2 WAT 3308 48.909 11.193 151.153 1.00 0.00 H TER 82913 WAT 3308 ATOM 82913 O WAT 3309 22.725 21.710 94.220 1.00 0.00 O ATOM 82914 H1 WAT 3309 22.491 22.619 94.033 1.00 0.00 H ATOM 82915 H2 WAT 3309 23.682 21.697 94.187 1.00 0.00 H TER 82917 WAT 3309 ATOM 82917 O WAT 3310 47.782 57.924 139.411 1.00 0.00 O ATOM 82918 H1 WAT 3310 48.681 57.837 139.095 1.00 0.00 H ATOM 82919 H2 WAT 3310 47.734 57.335 140.164 1.00 0.00 H TER 82921 WAT 3310 ATOM 82921 O WAT 3311 124.957 113.179 88.929 1.00 0.00 O ATOM 82922 H1 WAT 3311 124.482 113.502 89.694 1.00 0.00 H ATOM 82923 H2 WAT 3311 124.752 112.244 88.897 1.00 0.00 H TER 82925 WAT 3311 ATOM 82925 O WAT 3312 57.754 76.699 144.375 1.00 0.00 O ATOM 82926 H1 WAT 3312 58.133 76.762 145.252 1.00 0.00 H ATOM 82927 H2 WAT 3312 58.170 77.406 143.882 1.00 0.00 H TER 82929 WAT 3312 ATOM 82929 O WAT 3313 27.724 85.930 118.380 1.00 0.00 O ATOM 82930 H1 WAT 3313 27.108 85.799 119.100 1.00 0.00 H ATOM 82931 H2 WAT 3313 28.017 86.836 118.478 1.00 0.00 H TER 82933 WAT 3313 ATOM 82933 O WAT 3314 36.784 0.393 94.651 1.00 0.00 O ATOM 82934 H1 WAT 3314 36.281 0.426 93.837 1.00 0.00 H ATOM 82935 H2 WAT 3314 36.827 -0.539 94.867 1.00 0.00 H TER 82937 WAT 3314 ATOM 82937 O WAT 3315 89.943 13.463 68.434 1.00 0.00 O ATOM 82938 H1 WAT 3315 89.777 14.402 68.356 1.00 0.00 H ATOM 82939 H2 WAT 3315 89.529 13.082 67.660 1.00 0.00 H TER 82941 WAT 3315 ATOM 82941 O WAT 3316 88.332 114.964 22.226 1.00 0.00 O ATOM 82942 H1 WAT 3316 88.932 115.671 21.987 1.00 0.00 H ATOM 82943 H2 WAT 3316 87.927 115.259 23.041 1.00 0.00 H TER 82945 WAT 3316 ATOM 82945 O WAT 3317 37.309 58.034 71.971 1.00 0.00 O ATOM 82946 H1 WAT 3317 36.561 58.573 72.228 1.00 0.00 H ATOM 82947 H2 WAT 3317 37.972 58.665 71.688 1.00 0.00 H TER 82949 WAT 3317 ATOM 82949 O WAT 3318 41.427 41.985 76.250 1.00 0.00 O ATOM 82950 H1 WAT 3318 41.936 42.121 77.049 1.00 0.00 H ATOM 82951 H2 WAT 3318 41.968 42.362 75.555 1.00 0.00 H TER 82953 WAT 3318 ATOM 82953 O WAT 3319 135.873 125.559 103.901 1.00 0.00 O ATOM 82954 H1 WAT 3319 136.537 125.551 103.212 1.00 0.00 H ATOM 82955 H2 WAT 3319 135.350 124.774 103.739 1.00 0.00 H TER 82957 WAT 3319 ATOM 82957 O WAT 3320 14.415 74.315 56.797 1.00 0.00 O ATOM 82958 H1 WAT 3320 13.872 74.538 57.553 1.00 0.00 H ATOM 82959 H2 WAT 3320 13.871 73.722 56.278 1.00 0.00 H TER 82961 WAT 3320 ATOM 82961 O WAT 3321 -0.152 70.603 13.643 1.00 0.00 O ATOM 82962 H1 WAT 3321 0.342 71.292 14.087 1.00 0.00 H ATOM 82963 H2 WAT 3321 0.429 70.305 12.942 1.00 0.00 H TER 82965 WAT 3321 ATOM 82965 O WAT 3322 3.916 124.969 113.716 1.00 0.00 O ATOM 82966 H1 WAT 3322 4.131 125.885 113.892 1.00 0.00 H ATOM 82967 H2 WAT 3322 4.393 124.478 114.384 1.00 0.00 H TER 82969 WAT 3322 ATOM 82969 O WAT 3323 143.669 64.942 155.475 1.00 0.00 O ATOM 82970 H1 WAT 3323 143.529 64.331 154.751 1.00 0.00 H ATOM 82971 H2 WAT 3323 142.981 64.728 156.105 1.00 0.00 H TER 82973 WAT 3323 ATOM 82973 O WAT 3324 127.653 61.974 73.324 1.00 0.00 O ATOM 82974 H1 WAT 3324 127.995 61.342 73.957 1.00 0.00 H ATOM 82975 H2 WAT 3324 127.361 61.439 72.586 1.00 0.00 H TER 82977 WAT 3324 ATOM 82977 O WAT 3325 88.184 75.644 15.722 1.00 0.00 O ATOM 82978 H1 WAT 3325 87.837 76.482 16.030 1.00 0.00 H ATOM 82979 H2 WAT 3325 89.032 75.864 15.335 1.00 0.00 H TER 82981 WAT 3325 ATOM 82981 O WAT 3326 13.529 109.280 131.855 1.00 0.00 O ATOM 82982 H1 WAT 3326 12.672 109.685 131.717 1.00 0.00 H ATOM 82983 H2 WAT 3326 13.334 108.358 132.018 1.00 0.00 H TER 82985 WAT 3326 ATOM 82985 O WAT 3327 12.686 5.394 150.496 1.00 0.00 O ATOM 82986 H1 WAT 3327 13.065 4.994 151.279 1.00 0.00 H ATOM 82987 H2 WAT 3327 12.126 4.712 150.126 1.00 0.00 H TER 82989 WAT 3327 ATOM 82989 O WAT 3328 94.326 94.858 5.875 1.00 0.00 O ATOM 82990 H1 WAT 3328 94.199 94.592 6.786 1.00 0.00 H ATOM 82991 H2 WAT 3328 94.287 94.041 5.379 1.00 0.00 H TER 82993 WAT 3328 ATOM 82993 O WAT 3329 96.294 119.229 60.288 1.00 0.00 O ATOM 82994 H1 WAT 3329 95.741 119.779 59.733 1.00 0.00 H ATOM 82995 H2 WAT 3329 96.296 118.376 59.854 1.00 0.00 H TER 82997 WAT 3329 ATOM 82997 O WAT 3330 112.560 131.859 127.177 1.00 0.00 O ATOM 82998 H1 WAT 3330 111.891 131.178 127.100 1.00 0.00 H ATOM 82999 H2 WAT 3330 112.829 132.033 126.275 1.00 0.00 H TER 83001 WAT 3330 ATOM 83001 O WAT 3331 35.128 42.664 152.810 1.00 0.00 O ATOM 83002 H1 WAT 3331 34.914 43.486 152.369 1.00 0.00 H ATOM 83003 H2 WAT 3331 34.395 42.084 152.604 1.00 0.00 H TER 83005 WAT 3331 ATOM 83005 O WAT 3332 143.553 15.834 79.254 1.00 0.00 O ATOM 83006 H1 WAT 3332 142.794 16.129 79.757 1.00 0.00 H ATOM 83007 H2 WAT 3332 144.236 15.696 79.911 1.00 0.00 H TER 83009 WAT 3332 ATOM 83009 O WAT 3333 72.372 92.457 133.855 1.00 0.00 O ATOM 83010 H1 WAT 3333 72.408 93.412 133.797 1.00 0.00 H ATOM 83011 H2 WAT 3333 73.230 92.206 134.196 1.00 0.00 H TER 83013 WAT 3333 ATOM 83013 O WAT 3334 139.329 115.110 125.612 1.00 0.00 O ATOM 83014 H1 WAT 3334 140.107 115.665 125.664 1.00 0.00 H ATOM 83015 H2 WAT 3334 138.998 115.077 126.510 1.00 0.00 H TER 83017 WAT 3334 ATOM 83017 O WAT 3335 131.367 95.423 140.311 1.00 0.00 O ATOM 83018 H1 WAT 3335 132.276 95.468 140.606 1.00 0.00 H ATOM 83019 H2 WAT 3335 130.864 95.816 141.024 1.00 0.00 H TER 83021 WAT 3335 ATOM 83021 O WAT 3336 59.873 120.105 108.162 1.00 0.00 O ATOM 83022 H1 WAT 3336 60.331 120.876 108.495 1.00 0.00 H ATOM 83023 H2 WAT 3336 59.676 120.319 107.250 1.00 0.00 H TER 83025 WAT 3336 ATOM 83025 O WAT 3337 14.725 4.054 111.363 1.00 0.00 O ATOM 83026 H1 WAT 3337 15.065 3.600 110.591 1.00 0.00 H ATOM 83027 H2 WAT 3337 15.504 4.280 111.871 1.00 0.00 H TER 83029 WAT 3337 ATOM 83029 O WAT 3338 101.152 113.645 130.653 1.00 0.00 O ATOM 83030 H1 WAT 3338 100.713 114.495 130.617 1.00 0.00 H ATOM 83031 H2 WAT 3338 100.440 113.006 130.616 1.00 0.00 H TER 83033 WAT 3338 ATOM 83033 O WAT 3339 97.207 82.855 67.958 1.00 0.00 O ATOM 83034 H1 WAT 3339 96.362 82.412 67.875 1.00 0.00 H ATOM 83035 H2 WAT 3339 96.996 83.786 67.894 1.00 0.00 H TER 83037 WAT 3339 ATOM 83037 O WAT 3340 74.961 71.714 99.293 1.00 0.00 O ATOM 83038 H1 WAT 3340 74.825 71.041 98.626 1.00 0.00 H ATOM 83039 H2 WAT 3340 75.281 72.473 98.804 1.00 0.00 H TER 83041 WAT 3340 ATOM 83041 O WAT 3341 54.808 5.940 3.893 1.00 0.00 O ATOM 83042 H1 WAT 3341 54.542 6.746 3.449 1.00 0.00 H ATOM 83043 H2 WAT 3341 54.664 5.251 3.244 1.00 0.00 H TER 83045 WAT 3341 ATOM 83045 O WAT 3342 125.743 48.853 7.086 1.00 0.00 O ATOM 83046 H1 WAT 3342 125.396 48.061 7.496 1.00 0.00 H ATOM 83047 H2 WAT 3342 125.137 49.545 7.352 1.00 0.00 H TER 83049 WAT 3342 ATOM 83049 O WAT 3343 107.103 136.568 4.393 1.00 0.00 O ATOM 83050 H1 WAT 3343 107.609 136.464 5.198 1.00 0.00 H ATOM 83051 H2 WAT 3343 106.438 137.221 4.610 1.00 0.00 H TER 83053 WAT 3343 ATOM 83053 O WAT 3344 34.074 7.715 16.960 1.00 0.00 O ATOM 83054 H1 WAT 3344 34.792 7.520 16.357 1.00 0.00 H ATOM 83055 H2 WAT 3344 34.470 7.657 17.830 1.00 0.00 H TER 83057 WAT 3344 ATOM 83057 O WAT 3345 6.092 82.163 100.913 1.00 0.00 O ATOM 83058 H1 WAT 3345 6.740 82.594 100.356 1.00 0.00 H ATOM 83059 H2 WAT 3345 6.396 81.257 100.976 1.00 0.00 H TER 83061 WAT 3345 ATOM 83061 O WAT 3346 124.581 74.954 7.019 1.00 0.00 O ATOM 83062 H1 WAT 3346 123.940 74.855 7.723 1.00 0.00 H ATOM 83063 H2 WAT 3346 124.144 74.599 6.245 1.00 0.00 H TER 83065 WAT 3346 ATOM 83065 O WAT 3347 120.932 28.382 69.904 1.00 0.00 O ATOM 83066 H1 WAT 3347 121.235 27.479 69.806 1.00 0.00 H ATOM 83067 H2 WAT 3347 120.562 28.416 70.786 1.00 0.00 H TER 83069 WAT 3347 ATOM 83069 O WAT 3348 89.783 73.578 90.107 1.00 0.00 O ATOM 83070 H1 WAT 3348 88.897 73.811 89.831 1.00 0.00 H ATOM 83071 H2 WAT 3348 90.219 74.418 90.248 1.00 0.00 H TER 83073 WAT 3348 ATOM 83073 O WAT 3349 123.234 138.547 110.193 1.00 0.00 O ATOM 83074 H1 WAT 3349 123.974 138.742 110.769 1.00 0.00 H ATOM 83075 H2 WAT 3349 122.497 139.019 110.581 1.00 0.00 H TER 83077 WAT 3349 ATOM 83077 O WAT 3350 72.593 21.387 132.229 1.00 0.00 O ATOM 83078 H1 WAT 3350 72.389 21.658 131.334 1.00 0.00 H ATOM 83079 H2 WAT 3350 73.275 21.995 132.514 1.00 0.00 H TER 83081 WAT 3350 ATOM 83081 O WAT 3351 103.380 88.211 133.813 1.00 0.00 O ATOM 83082 H1 WAT 3351 103.909 88.960 134.088 1.00 0.00 H ATOM 83083 H2 WAT 3351 103.885 87.446 134.087 1.00 0.00 H TER 83085 WAT 3351 ATOM 83085 O WAT 3352 11.615 46.763 65.479 1.00 0.00 O ATOM 83086 H1 WAT 3352 11.866 46.211 64.739 1.00 0.00 H ATOM 83087 H2 WAT 3352 11.378 47.602 65.083 1.00 0.00 H TER 83089 WAT 3352 ATOM 83089 O WAT 3353 117.217 126.580 95.744 1.00 0.00 O ATOM 83090 H1 WAT 3353 116.887 127.460 95.561 1.00 0.00 H ATOM 83091 H2 WAT 3353 116.873 126.042 95.031 1.00 0.00 H TER 83093 WAT 3353 ATOM 83093 O WAT 3354 25.963 84.989 58.928 1.00 0.00 O ATOM 83094 H1 WAT 3354 26.167 84.736 59.828 1.00 0.00 H ATOM 83095 H2 WAT 3354 26.558 85.715 58.742 1.00 0.00 H TER 83097 WAT 3354 ATOM 83097 O WAT 3355 105.394 67.754 100.200 1.00 0.00 O ATOM 83098 H1 WAT 3355 104.547 67.310 100.229 1.00 0.00 H ATOM 83099 H2 WAT 3355 105.940 67.194 99.649 1.00 0.00 H TER 83101 WAT 3355 ATOM 83101 O WAT 3356 112.744 48.243 86.798 1.00 0.00 O ATOM 83102 H1 WAT 3356 112.856 47.677 86.034 1.00 0.00 H ATOM 83103 H2 WAT 3356 112.946 49.122 86.477 1.00 0.00 H TER 83105 WAT 3356 ATOM 83105 O WAT 3357 71.142 106.886 94.641 1.00 0.00 O ATOM 83106 H1 WAT 3357 71.880 106.996 94.042 1.00 0.00 H ATOM 83107 H2 WAT 3357 70.657 106.140 94.289 1.00 0.00 H TER 83109 WAT 3357 ATOM 83109 O WAT 3358 47.610 13.851 81.373 1.00 0.00 O ATOM 83110 H1 WAT 3358 47.383 14.230 80.523 1.00 0.00 H ATOM 83111 H2 WAT 3358 48.422 13.370 81.211 1.00 0.00 H TER 83113 WAT 3358 ATOM 83113 O WAT 3359 78.840 37.848 108.623 1.00 0.00 O ATOM 83114 H1 WAT 3359 78.041 37.320 108.598 1.00 0.00 H ATOM 83115 H2 WAT 3359 78.558 38.692 108.975 1.00 0.00 H TER 83117 WAT 3359 ATOM 83117 O WAT 3360 131.245 6.220 64.962 1.00 0.00 O ATOM 83118 H1 WAT 3360 132.149 6.442 65.187 1.00 0.00 H ATOM 83119 H2 WAT 3360 131.022 6.819 64.250 1.00 0.00 H TER 83121 WAT 3360 ATOM 83121 O WAT 3361 87.753 124.026 71.285 1.00 0.00 O ATOM 83122 H1 WAT 3361 86.979 123.573 70.951 1.00 0.00 H ATOM 83123 H2 WAT 3361 88.243 123.350 71.753 1.00 0.00 H TER 83125 WAT 3361 ATOM 83125 O WAT 3362 15.393 96.847 67.315 1.00 0.00 O ATOM 83126 H1 WAT 3362 14.671 97.298 66.878 1.00 0.00 H ATOM 83127 H2 WAT 3362 14.974 96.344 68.014 1.00 0.00 H TER 83129 WAT 3362 ATOM 83129 O WAT 3363 49.172 55.190 118.206 1.00 0.00 O ATOM 83130 H1 WAT 3363 48.968 54.255 118.225 1.00 0.00 H ATOM 83131 H2 WAT 3363 48.322 55.623 118.294 1.00 0.00 H TER 83133 WAT 3363 ATOM 83133 O WAT 3364 78.269 14.447 103.128 1.00 0.00 O ATOM 83134 H1 WAT 3364 78.835 14.734 102.411 1.00 0.00 H ATOM 83135 H2 WAT 3364 78.843 14.429 103.893 1.00 0.00 H TER 83137 WAT 3364 ATOM 83137 O WAT 3365 58.762 66.804 89.074 1.00 0.00 O ATOM 83138 H1 WAT 3365 58.809 67.273 89.908 1.00 0.00 H ATOM 83139 H2 WAT 3365 57.891 67.007 88.734 1.00 0.00 H TER 83141 WAT 3365 ATOM 83141 O WAT 3366 2.187 47.945 4.406 1.00 0.00 O ATOM 83142 H1 WAT 3366 2.459 48.452 5.171 1.00 0.00 H ATOM 83143 H2 WAT 3366 2.726 48.282 3.691 1.00 0.00 H TER 83145 WAT 3366 ATOM 83145 O WAT 3367 82.353 19.992 138.018 1.00 0.00 O ATOM 83146 H1 WAT 3367 81.629 20.360 137.513 1.00 0.00 H ATOM 83147 H2 WAT 3367 82.482 20.610 138.737 1.00 0.00 H TER 83149 WAT 3367 ATOM 83149 O WAT 3368 92.331 119.755 115.688 1.00 0.00 O ATOM 83150 H1 WAT 3368 92.962 120.307 115.226 1.00 0.00 H ATOM 83151 H2 WAT 3368 92.869 119.168 116.218 1.00 0.00 H TER 83153 WAT 3368 ATOM 83153 O WAT 3369 32.058 138.551 138.317 1.00 0.00 O ATOM 83154 H1 WAT 3369 32.836 139.030 138.604 1.00 0.00 H ATOM 83155 H2 WAT 3369 32.010 137.799 138.907 1.00 0.00 H TER 83157 WAT 3369 ATOM 83157 O WAT 3370 135.543 88.027 128.807 1.00 0.00 O ATOM 83158 H1 WAT 3370 135.646 88.666 129.512 1.00 0.00 H ATOM 83159 H2 WAT 3370 136.414 87.645 128.701 1.00 0.00 H TER 83161 WAT 3370 ATOM 83161 O WAT 3371 65.489 103.558 107.063 1.00 0.00 O ATOM 83162 H1 WAT 3371 64.777 103.763 106.457 1.00 0.00 H ATOM 83163 H2 WAT 3371 65.974 102.854 106.633 1.00 0.00 H TER 83165 WAT 3371 ATOM 83165 O WAT 3372 20.930 101.162 105.968 1.00 0.00 O ATOM 83166 H1 WAT 3372 20.626 102.069 105.994 1.00 0.00 H ATOM 83167 H2 WAT 3372 21.454 101.063 106.763 1.00 0.00 H TER 83169 WAT 3372 ATOM 83169 O WAT 3373 33.804 131.650 93.392 1.00 0.00 O ATOM 83170 H1 WAT 3373 34.353 131.237 92.726 1.00 0.00 H ATOM 83171 H2 WAT 3373 32.998 131.133 93.394 1.00 0.00 H TER 83173 WAT 3373 ATOM 83173 O WAT 3374 32.805 14.152 14.277 1.00 0.00 O ATOM 83174 H1 WAT 3374 32.108 14.023 13.633 1.00 0.00 H ATOM 83175 H2 WAT 3374 33.036 15.077 14.197 1.00 0.00 H TER 83177 WAT 3374 ATOM 83177 O WAT 3375 59.094 145.849 124.517 1.00 0.00 O ATOM 83178 H1 WAT 3375 59.749 145.948 123.826 1.00 0.00 H ATOM 83179 H2 WAT 3375 59.128 144.921 124.748 1.00 0.00 H TER 83181 WAT 3375 ATOM 83181 O WAT 3376 89.770 9.684 81.167 1.00 0.00 O ATOM 83182 H1 WAT 3376 90.149 9.047 80.560 1.00 0.00 H ATOM 83183 H2 WAT 3376 89.205 9.164 81.738 1.00 0.00 H TER 83185 WAT 3376 ATOM 83185 O WAT 3377 38.063 37.006 83.715 1.00 0.00 O ATOM 83186 H1 WAT 3377 38.134 36.575 84.567 1.00 0.00 H ATOM 83187 H2 WAT 3377 37.360 37.645 83.828 1.00 0.00 H TER 83189 WAT 3377 ATOM 83189 O WAT 3378 72.839 23.744 147.018 1.00 0.00 O ATOM 83190 H1 WAT 3378 72.718 24.210 146.190 1.00 0.00 H ATOM 83191 H2 WAT 3378 71.988 23.803 147.452 1.00 0.00 H TER 83193 WAT 3378 ATOM 83193 O WAT 3379 105.330 130.948 64.480 1.00 0.00 O ATOM 83194 H1 WAT 3379 105.279 131.096 65.424 1.00 0.00 H ATOM 83195 H2 WAT 3379 105.687 131.763 64.128 1.00 0.00 H TER 83197 WAT 3379 ATOM 83197 O WAT 3380 100.809 25.367 127.456 1.00 0.00 O ATOM 83198 H1 WAT 3380 100.514 26.160 127.007 1.00 0.00 H ATOM 83199 H2 WAT 3380 100.496 24.650 126.905 1.00 0.00 H TER 83201 WAT 3380 ATOM 83201 O WAT 3381 83.968 125.891 76.706 1.00 0.00 O ATOM 83202 H1 WAT 3381 84.803 125.560 76.373 1.00 0.00 H ATOM 83203 H2 WAT 3381 83.767 126.640 76.145 1.00 0.00 H TER 83205 WAT 3381 ATOM 83205 O WAT 3382 109.141 16.413 128.045 1.00 0.00 O ATOM 83206 H1 WAT 3382 108.206 16.604 128.126 1.00 0.00 H ATOM 83207 H2 WAT 3382 109.440 16.295 128.946 1.00 0.00 H TER 83209 WAT 3382 ATOM 83209 O WAT 3383 124.054 138.974 8.671 1.00 0.00 O ATOM 83210 H1 WAT 3383 123.898 139.868 8.973 1.00 0.00 H ATOM 83211 H2 WAT 3383 123.207 138.538 8.764 1.00 0.00 H TER 83213 WAT 3383 ATOM 83213 O WAT 3384 42.499 8.278 54.565 1.00 0.00 O ATOM 83214 H1 WAT 3384 43.221 7.676 54.747 1.00 0.00 H ATOM 83215 H2 WAT 3384 41.861 7.750 54.085 1.00 0.00 H TER 83217 WAT 3384 ATOM 83217 O WAT 3385 68.325 3.957 78.375 1.00 0.00 O ATOM 83218 H1 WAT 3385 67.856 4.295 77.612 1.00 0.00 H ATOM 83219 H2 WAT 3385 67.635 3.712 78.991 1.00 0.00 H TER 83221 WAT 3385 ATOM 83221 O WAT 3386 49.142 143.095 157.305 1.00 0.00 O ATOM 83222 H1 WAT 3386 48.611 142.544 157.881 1.00 0.00 H ATOM 83223 H2 WAT 3386 49.868 142.532 157.038 1.00 0.00 H TER 83225 WAT 3386 ATOM 83225 O WAT 3387 109.007 109.012 105.308 1.00 0.00 O ATOM 83226 H1 WAT 3387 108.870 109.594 106.055 1.00 0.00 H ATOM 83227 H2 WAT 3387 109.715 109.422 104.812 1.00 0.00 H TER 83229 WAT 3387 ATOM 83229 O WAT 3388 62.015 64.772 13.867 1.00 0.00 O ATOM 83230 H1 WAT 3388 61.748 64.845 14.783 1.00 0.00 H ATOM 83231 H2 WAT 3388 62.563 63.987 13.840 1.00 0.00 H TER 83233 WAT 3388 ATOM 83233 O WAT 3389 83.371 31.382 95.373 1.00 0.00 O ATOM 83234 H1 WAT 3389 83.358 31.243 94.426 1.00 0.00 H ATOM 83235 H2 WAT 3389 83.201 30.516 95.744 1.00 0.00 H TER 83237 WAT 3389 ATOM 83237 O WAT 3390 66.522 0.442 105.399 1.00 0.00 O ATOM 83238 H1 WAT 3390 66.116 -0.399 105.612 1.00 0.00 H ATOM 83239 H2 WAT 3390 67.461 0.287 105.499 1.00 0.00 H TER 83241 WAT 3390 ATOM 83241 O WAT 3391 122.822 63.910 75.352 1.00 0.00 O ATOM 83242 H1 WAT 3391 122.897 64.661 75.941 1.00 0.00 H ATOM 83243 H2 WAT 3391 123.569 63.995 74.760 1.00 0.00 H TER 83245 WAT 3391 ATOM 83245 O WAT 3392 78.444 45.958 78.209 1.00 0.00 O ATOM 83246 H1 WAT 3392 78.017 45.550 78.962 1.00 0.00 H ATOM 83247 H2 WAT 3392 79.260 46.315 78.561 1.00 0.00 H TER 83249 WAT 3392 ATOM 83249 O WAT 3393 73.004 20.718 18.195 1.00 0.00 O ATOM 83250 H1 WAT 3393 73.066 20.344 19.074 1.00 0.00 H ATOM 83251 H2 WAT 3393 72.126 20.482 17.895 1.00 0.00 H TER 83253 WAT 3393 ATOM 83253 O WAT 3394 6.927 113.788 72.888 1.00 0.00 O ATOM 83254 H1 WAT 3394 6.737 112.851 72.835 1.00 0.00 H ATOM 83255 H2 WAT 3394 6.525 114.068 73.711 1.00 0.00 H TER 83257 WAT 3394 ATOM 83257 O WAT 3395 67.580 129.518 98.102 1.00 0.00 O ATOM 83258 H1 WAT 3395 67.135 130.051 97.443 1.00 0.00 H ATOM 83259 H2 WAT 3395 67.281 129.873 98.939 1.00 0.00 H TER 83261 WAT 3395 ATOM 83261 O WAT 3396 77.093 37.718 113.564 1.00 0.00 O ATOM 83262 H1 WAT 3396 77.947 38.093 113.347 1.00 0.00 H ATOM 83263 H2 WAT 3396 76.480 38.169 112.983 1.00 0.00 H TER 83265 WAT 3396 ATOM 83265 O WAT 3397 142.521 118.690 144.560 1.00 0.00 O ATOM 83266 H1 WAT 3397 141.876 118.322 143.956 1.00 0.00 H ATOM 83267 H2 WAT 3397 142.930 117.927 144.968 1.00 0.00 H TER 83269 WAT 3397 ATOM 83269 O WAT 3398 69.403 82.670 63.869 1.00 0.00 O ATOM 83270 H1 WAT 3398 69.364 83.236 64.640 1.00 0.00 H ATOM 83271 H2 WAT 3398 68.616 82.129 63.929 1.00 0.00 H TER 83273 WAT 3398 ATOM 83273 O WAT 3399 135.291 48.111 130.983 1.00 0.00 O ATOM 83274 H1 WAT 3399 135.161 47.418 131.631 1.00 0.00 H ATOM 83275 H2 WAT 3399 136.163 48.457 131.174 1.00 0.00 H TER 83277 WAT 3399 ATOM 83277 O WAT 3400 101.571 59.634 60.427 1.00 0.00 O ATOM 83278 H1 WAT 3400 101.220 59.068 59.740 1.00 0.00 H ATOM 83279 H2 WAT 3400 102.220 59.091 60.876 1.00 0.00 H TER 83281 WAT 3400 ATOM 83281 O WAT 3401 98.801 109.828 85.302 1.00 0.00 O ATOM 83282 H1 WAT 3401 99.655 110.255 85.376 1.00 0.00 H ATOM 83283 H2 WAT 3401 99.004 108.931 85.038 1.00 0.00 H TER 83285 WAT 3401 ATOM 83285 O WAT 3402 1.027 81.818 77.061 1.00 0.00 O ATOM 83286 H1 WAT 3402 0.789 81.640 77.971 1.00 0.00 H ATOM 83287 H2 WAT 3402 0.920 80.976 76.617 1.00 0.00 H TER 83289 WAT 3402 ATOM 83289 O WAT 3403 17.615 102.921 153.893 1.00 0.00 O ATOM 83290 H1 WAT 3403 16.807 103.130 154.362 1.00 0.00 H ATOM 83291 H2 WAT 3403 17.786 102.004 154.108 1.00 0.00 H TER 83293 WAT 3403 ATOM 83293 O WAT 3404 135.505 62.111 103.110 1.00 0.00 O ATOM 83294 H1 WAT 3404 136.199 61.519 103.400 1.00 0.00 H ATOM 83295 H2 WAT 3404 135.951 62.750 102.555 1.00 0.00 H TER 83297 WAT 3404 ATOM 83297 O WAT 3405 92.106 113.438 92.760 1.00 0.00 O ATOM 83298 H1 WAT 3405 92.042 114.062 92.037 1.00 0.00 H ATOM 83299 H2 WAT 3405 91.871 113.946 93.536 1.00 0.00 H TER 83301 WAT 3405 ATOM 83301 O WAT 3406 28.698 57.649 85.853 1.00 0.00 O ATOM 83302 H1 WAT 3406 29.058 57.314 86.674 1.00 0.00 H ATOM 83303 H2 WAT 3406 29.324 57.368 85.185 1.00 0.00 H TER 83305 WAT 3406 ATOM 83305 O WAT 3407 38.201 1.148 136.871 1.00 0.00 O ATOM 83306 H1 WAT 3407 38.197 0.300 137.315 1.00 0.00 H ATOM 83307 H2 WAT 3407 38.596 1.748 137.503 1.00 0.00 H TER 83309 WAT 3407 ATOM 83309 O WAT 3408 28.478 24.472 97.730 1.00 0.00 O ATOM 83310 H1 WAT 3408 28.338 23.548 97.526 1.00 0.00 H ATOM 83311 H2 WAT 3408 28.539 24.900 96.876 1.00 0.00 H TER 83313 WAT 3408 ATOM 83313 O WAT 3409 85.804 119.725 5.139 1.00 0.00 O ATOM 83314 H1 WAT 3409 86.372 119.762 5.909 1.00 0.00 H ATOM 83315 H2 WAT 3409 86.090 120.459 4.595 1.00 0.00 H TER 83317 WAT 3409 ATOM 83317 O WAT 3410 78.509 39.246 120.073 1.00 0.00 O ATOM 83318 H1 WAT 3410 78.621 39.851 120.806 1.00 0.00 H ATOM 83319 H2 WAT 3410 79.230 39.455 119.479 1.00 0.00 H TER 83321 WAT 3410 ATOM 83321 O WAT 3411 17.022 64.244 13.464 1.00 0.00 O ATOM 83322 H1 WAT 3411 16.927 64.858 12.736 1.00 0.00 H ATOM 83323 H2 WAT 3411 17.798 64.548 13.935 1.00 0.00 H TER 83325 WAT 3411 ATOM 83325 O WAT 3412 70.313 112.367 152.141 1.00 0.00 O ATOM 83326 H1 WAT 3412 70.157 112.946 152.887 1.00 0.00 H ATOM 83327 H2 WAT 3412 71.184 112.001 152.301 1.00 0.00 H TER 83329 WAT 3412 ATOM 83329 O WAT 3413 122.381 122.864 99.326 1.00 0.00 O ATOM 83330 H1 WAT 3413 122.909 122.409 99.981 1.00 0.00 H ATOM 83331 H2 WAT 3413 121.675 122.251 99.120 1.00 0.00 H TER 83333 WAT 3413 ATOM 83333 O WAT 3414 140.161 114.344 89.799 1.00 0.00 O ATOM 83334 H1 WAT 3414 139.917 115.092 89.254 1.00 0.00 H ATOM 83335 H2 WAT 3414 139.519 114.344 90.508 1.00 0.00 H TER 83337 WAT 3414 ATOM 83337 O WAT 3415 96.580 43.411 84.477 1.00 0.00 O ATOM 83338 H1 WAT 3415 97.405 43.468 83.995 1.00 0.00 H ATOM 83339 H2 WAT 3415 96.025 42.850 83.935 1.00 0.00 H TER 83341 WAT 3415 ATOM 83341 O WAT 3416 117.804 122.820 98.760 1.00 0.00 O ATOM 83342 H1 WAT 3416 118.360 122.092 99.037 1.00 0.00 H ATOM 83343 H2 WAT 3416 116.939 122.609 99.110 1.00 0.00 H TER 83345 WAT 3416 ATOM 83345 O WAT 3417 28.023 8.200 107.660 1.00 0.00 O ATOM 83346 H1 WAT 3417 27.250 7.694 107.913 1.00 0.00 H ATOM 83347 H2 WAT 3417 28.763 7.652 107.918 1.00 0.00 H TER 83349 WAT 3417 ATOM 83349 O WAT 3418 102.963 8.408 9.401 1.00 0.00 O ATOM 83350 H1 WAT 3418 102.103 8.035 9.597 1.00 0.00 H ATOM 83351 H2 WAT 3418 102.805 8.997 8.663 1.00 0.00 H TER 83353 WAT 3418 ATOM 83353 O WAT 3419 114.807 93.870 152.480 1.00 0.00 O ATOM 83354 H1 WAT 3419 115.408 94.601 152.627 1.00 0.00 H ATOM 83355 H2 WAT 3419 114.381 94.075 151.648 1.00 0.00 H TER 83357 WAT 3419 ATOM 83357 O WAT 3420 87.906 19.489 16.228 1.00 0.00 O ATOM 83358 H1 WAT 3420 87.349 18.864 15.764 1.00 0.00 H ATOM 83359 H2 WAT 3420 88.062 19.084 17.082 1.00 0.00 H TER 83361 WAT 3420 ATOM 83361 O WAT 3421 89.515 0.103 23.548 1.00 0.00 O ATOM 83362 H1 WAT 3421 90.416 -0.030 23.843 1.00 0.00 H ATOM 83363 H2 WAT 3421 89.530 0.954 23.110 1.00 0.00 H TER 83365 WAT 3421 ATOM 83365 O WAT 3422 71.754 39.349 95.193 1.00 0.00 O ATOM 83366 H1 WAT 3422 71.318 38.626 95.643 1.00 0.00 H ATOM 83367 H2 WAT 3422 72.161 39.858 95.895 1.00 0.00 H TER 83369 WAT 3422 ATOM 83369 O WAT 3423 145.059 61.199 57.225 1.00 0.00 O ATOM 83370 H1 WAT 3423 145.003 60.922 58.140 1.00 0.00 H ATOM 83371 H2 WAT 3423 145.951 60.977 56.961 1.00 0.00 H TER 83373 WAT 3423 ATOM 83373 O WAT 3424 74.754 51.425 96.549 1.00 0.00 O ATOM 83374 H1 WAT 3424 73.819 51.327 96.373 1.00 0.00 H ATOM 83375 H2 WAT 3424 75.071 50.530 96.666 1.00 0.00 H TER 83377 WAT 3424 ATOM 83377 O WAT 3425 77.606 81.373 154.910 1.00 0.00 O ATOM 83378 H1 WAT 3425 77.119 80.930 155.605 1.00 0.00 H ATOM 83379 H2 WAT 3425 77.127 81.159 154.109 1.00 0.00 H TER 83381 WAT 3425 ATOM 83381 O WAT 3426 78.918 139.333 131.432 1.00 0.00 O ATOM 83382 H1 WAT 3426 79.081 139.869 130.656 1.00 0.00 H ATOM 83383 H2 WAT 3426 79.250 139.858 132.160 1.00 0.00 H TER 83385 WAT 3426 ATOM 83385 O WAT 3427 36.360 80.484 103.882 1.00 0.00 O ATOM 83386 H1 WAT 3427 36.622 80.606 102.970 1.00 0.00 H ATOM 83387 H2 WAT 3427 35.922 79.632 103.894 1.00 0.00 H TER 83389 WAT 3427 ATOM 83389 O WAT 3428 15.977 54.807 151.298 1.00 0.00 O ATOM 83390 H1 WAT 3428 16.570 54.089 151.077 1.00 0.00 H ATOM 83391 H2 WAT 3428 16.297 55.132 152.140 1.00 0.00 H TER 83393 WAT 3428 ATOM 83393 O WAT 3429 123.488 79.814 144.629 1.00 0.00 O ATOM 83394 H1 WAT 3429 124.428 79.880 144.458 1.00 0.00 H ATOM 83395 H2 WAT 3429 123.077 80.243 143.879 1.00 0.00 H TER 83397 WAT 3429 ATOM 83397 O WAT 3430 19.679 28.292 148.104 1.00 0.00 O ATOM 83398 H1 WAT 3430 19.136 28.950 148.537 1.00 0.00 H ATOM 83399 H2 WAT 3430 19.056 27.741 147.630 1.00 0.00 H TER 83401 WAT 3430 ATOM 83401 O WAT 3431 66.311 118.091 19.191 1.00 0.00 O ATOM 83402 H1 WAT 3431 65.533 118.525 19.540 1.00 0.00 H ATOM 83403 H2 WAT 3431 66.081 117.162 19.174 1.00 0.00 H TER 83405 WAT 3431 ATOM 83405 O WAT 3432 53.544 144.600 127.514 1.00 0.00 O ATOM 83406 H1 WAT 3432 53.851 144.641 128.419 1.00 0.00 H ATOM 83407 H2 WAT 3432 52.946 145.343 127.430 1.00 0.00 H TER 83409 WAT 3432 ATOM 83409 O WAT 3433 9.217 81.543 148.620 1.00 0.00 O ATOM 83410 H1 WAT 3433 9.773 82.134 149.128 1.00 0.00 H ATOM 83411 H2 WAT 3433 8.998 82.040 147.831 1.00 0.00 H TER 83413 WAT 3433 ATOM 83413 O WAT 3434 70.198 141.778 14.241 1.00 0.00 O ATOM 83414 H1 WAT 3434 70.226 140.899 13.862 1.00 0.00 H ATOM 83415 H2 WAT 3434 71.021 141.858 14.724 1.00 0.00 H TER 83417 WAT 3434 ATOM 83417 O WAT 3435 82.628 22.332 70.421 1.00 0.00 O ATOM 83418 H1 WAT 3435 81.788 22.772 70.550 1.00 0.00 H ATOM 83419 H2 WAT 3435 82.550 21.914 69.563 1.00 0.00 H TER 83421 WAT 3435 ATOM 83421 O WAT 3436 88.991 62.761 140.044 1.00 0.00 O ATOM 83422 H1 WAT 3436 89.397 63.581 140.325 1.00 0.00 H ATOM 83423 H2 WAT 3436 88.528 62.445 140.820 1.00 0.00 H TER 83425 WAT 3436 ATOM 83425 O WAT 3437 107.243 25.122 107.405 1.00 0.00 O ATOM 83426 H1 WAT 3437 106.316 25.163 107.639 1.00 0.00 H ATOM 83427 H2 WAT 3437 107.652 24.645 108.127 1.00 0.00 H TER 83429 WAT 3437 ATOM 83429 O WAT 3438 56.773 60.330 149.366 1.00 0.00 O ATOM 83430 H1 WAT 3438 56.471 60.084 150.240 1.00 0.00 H ATOM 83431 H2 WAT 3438 57.661 59.976 149.310 1.00 0.00 H TER 83433 WAT 3438 ATOM 83433 O WAT 3439 21.087 91.761 4.154 1.00 0.00 O ATOM 83434 H1 WAT 3439 20.722 91.067 3.604 1.00 0.00 H ATOM 83435 H2 WAT 3439 20.426 91.901 4.832 1.00 0.00 H TER 83437 WAT 3439 ATOM 83437 O WAT 3440 7.037 139.487 116.469 1.00 0.00 O ATOM 83438 H1 WAT 3440 7.826 138.956 116.357 1.00 0.00 H ATOM 83439 H2 WAT 3440 7.135 139.881 117.336 1.00 0.00 H TER 83441 WAT 3440 ATOM 83441 O WAT 3441 139.014 92.465 25.046 1.00 0.00 O ATOM 83442 H1 WAT 3441 139.373 92.899 25.820 1.00 0.00 H ATOM 83443 H2 WAT 3441 138.971 91.540 25.288 1.00 0.00 H TER 83445 WAT 3441 ATOM 83445 O WAT 3442 62.477 5.841 146.482 1.00 0.00 O ATOM 83446 H1 WAT 3442 61.755 5.539 147.034 1.00 0.00 H ATOM 83447 H2 WAT 3442 63.173 6.066 147.099 1.00 0.00 H TER 83449 WAT 3442 ATOM 83449 O WAT 3443 126.659 129.699 56.507 1.00 0.00 O ATOM 83450 H1 WAT 3443 126.759 128.775 56.733 1.00 0.00 H ATOM 83451 H2 WAT 3443 125.862 129.731 55.977 1.00 0.00 H TER 83453 WAT 3443 ATOM 83453 O WAT 3444 115.033 110.959 142.166 1.00 0.00 O ATOM 83454 H1 WAT 3444 114.275 111.543 142.182 1.00 0.00 H ATOM 83455 H2 WAT 3444 115.696 111.411 142.687 1.00 0.00 H TER 83457 WAT 3444 ATOM 83457 O WAT 3445 101.630 43.351 150.469 1.00 0.00 O ATOM 83458 H1 WAT 3445 101.643 44.225 150.860 1.00 0.00 H ATOM 83459 H2 WAT 3445 101.503 42.760 151.211 1.00 0.00 H TER 83461 WAT 3445 ATOM 83461 O WAT 3446 84.547 140.080 105.273 1.00 0.00 O ATOM 83462 H1 WAT 3446 85.108 140.523 105.910 1.00 0.00 H ATOM 83463 H2 WAT 3446 84.341 140.753 104.625 1.00 0.00 H TER 83465 WAT 3446 ATOM 83465 O WAT 3447 12.338 32.903 98.265 1.00 0.00 O ATOM 83466 H1 WAT 3447 12.259 33.806 98.573 1.00 0.00 H ATOM 83467 H2 WAT 3447 13.057 32.537 98.780 1.00 0.00 H TER 83469 WAT 3447 ATOM 83469 O WAT 3448 137.700 114.849 150.842 1.00 0.00 O ATOM 83470 H1 WAT 3448 137.986 115.153 151.704 1.00 0.00 H ATOM 83471 H2 WAT 3448 136.753 114.741 150.928 1.00 0.00 H TER 83473 WAT 3448 ATOM 83473 O WAT 3449 75.269 81.407 78.677 1.00 0.00 O ATOM 83474 H1 WAT 3449 74.624 81.791 78.083 1.00 0.00 H ATOM 83475 H2 WAT 3449 75.215 80.466 78.514 1.00 0.00 H TER 83477 WAT 3449 ATOM 83477 O WAT 3450 127.990 74.285 141.645 1.00 0.00 O ATOM 83478 H1 WAT 3450 127.784 74.886 140.929 1.00 0.00 H ATOM 83479 H2 WAT 3450 128.915 74.072 141.520 1.00 0.00 H TER 83481 WAT 3450 ATOM 83481 O WAT 3451 106.109 99.128 100.904 1.00 0.00 O ATOM 83482 H1 WAT 3451 105.688 99.663 101.577 1.00 0.00 H ATOM 83483 H2 WAT 3451 105.409 98.563 100.575 1.00 0.00 H TER 83485 WAT 3451 ATOM 83485 O WAT 3452 1.292 111.804 123.163 1.00 0.00 O ATOM 83486 H1 WAT 3452 1.315 112.203 124.033 1.00 0.00 H ATOM 83487 H2 WAT 3452 1.921 111.084 123.213 1.00 0.00 H TER 83489 WAT 3452 ATOM 83489 O WAT 3453 67.017 51.827 24.636 1.00 0.00 O ATOM 83490 H1 WAT 3453 67.279 51.135 24.028 1.00 0.00 H ATOM 83491 H2 WAT 3453 66.068 51.728 24.717 1.00 0.00 H TER 83493 WAT 3453 ATOM 83493 O WAT 3454 21.927 119.536 113.472 1.00 0.00 O ATOM 83494 H1 WAT 3454 21.785 118.709 113.012 1.00 0.00 H ATOM 83495 H2 WAT 3454 21.309 120.145 113.066 1.00 0.00 H TER 83497 WAT 3454 ATOM 83497 O WAT 3455 123.521 99.347 13.831 1.00 0.00 O ATOM 83498 H1 WAT 3455 123.876 99.854 13.101 1.00 0.00 H ATOM 83499 H2 WAT 3455 122.670 99.748 14.010 1.00 0.00 H TER 83501 WAT 3455 ATOM 83501 O WAT 3456 99.618 23.474 14.482 1.00 0.00 O ATOM 83502 H1 WAT 3456 99.735 24.421 14.555 1.00 0.00 H ATOM 83503 H2 WAT 3456 100.276 23.199 13.844 1.00 0.00 H TER 83505 WAT 3456 ATOM 83505 O WAT 3457 67.808 140.697 146.617 1.00 0.00 O ATOM 83506 H1 WAT 3457 68.308 140.859 147.417 1.00 0.00 H ATOM 83507 H2 WAT 3457 68.447 140.797 145.911 1.00 0.00 H TER 83509 WAT 3457 ATOM 83509 O WAT 3458 20.933 125.223 122.521 1.00 0.00 O ATOM 83510 H1 WAT 3458 20.352 124.659 122.010 1.00 0.00 H ATOM 83511 H2 WAT 3458 20.411 125.476 123.283 1.00 0.00 H TER 83513 WAT 3458 ATOM 83513 O WAT 3459 142.083 107.881 110.659 1.00 0.00 O ATOM 83514 H1 WAT 3459 142.680 108.550 110.994 1.00 0.00 H ATOM 83515 H2 WAT 3459 141.563 108.334 109.995 1.00 0.00 H TER 83517 WAT 3459 ATOM 83517 O WAT 3460 37.961 85.912 63.551 1.00 0.00 O ATOM 83518 H1 WAT 3460 37.491 85.092 63.400 1.00 0.00 H ATOM 83519 H2 WAT 3460 37.458 86.353 64.236 1.00 0.00 H TER 83521 WAT 3460 ATOM 83521 O WAT 3461 119.705 27.370 80.170 1.00 0.00 O ATOM 83522 H1 WAT 3461 118.922 27.592 79.667 1.00 0.00 H ATOM 83523 H2 WAT 3461 120.353 28.023 79.906 1.00 0.00 H TER 83525 WAT 3461 ATOM 83525 O WAT 3462 121.545 93.706 130.759 1.00 0.00 O ATOM 83526 H1 WAT 3462 122.108 93.569 129.997 1.00 0.00 H ATOM 83527 H2 WAT 3462 122.153 93.800 131.492 1.00 0.00 H TER 83529 WAT 3462 ATOM 83529 O WAT 3463 39.551 113.006 145.788 1.00 0.00 O ATOM 83530 H1 WAT 3463 40.098 112.412 145.274 1.00 0.00 H ATOM 83531 H2 WAT 3463 39.409 112.546 146.615 1.00 0.00 H TER 83533 WAT 3463 ATOM 83533 O WAT 3464 84.810 133.378 147.728 1.00 0.00 O ATOM 83534 H1 WAT 3464 85.251 134.039 147.194 1.00 0.00 H ATOM 83535 H2 WAT 3464 84.621 132.665 147.118 1.00 0.00 H TER 83537 WAT 3464 ATOM 83537 O WAT 3465 64.192 45.147 12.632 1.00 0.00 O ATOM 83538 H1 WAT 3465 63.571 45.284 13.348 1.00 0.00 H ATOM 83539 H2 WAT 3465 63.643 44.965 11.870 1.00 0.00 H TER 83541 WAT 3465 ATOM 83541 O WAT 3466 59.113 93.676 84.878 1.00 0.00 O ATOM 83542 H1 WAT 3466 59.225 94.599 84.647 1.00 0.00 H ATOM 83543 H2 WAT 3466 59.893 93.460 85.387 1.00 0.00 H TER 83545 WAT 3466 ATOM 83545 O WAT 3467 78.335 145.975 153.988 1.00 0.00 O ATOM 83546 H1 WAT 3467 79.259 145.812 154.178 1.00 0.00 H ATOM 83547 H2 WAT 3467 78.091 145.284 153.372 1.00 0.00 H TER 83549 WAT 3467 ATOM 83549 O WAT 3468 31.162 62.452 73.354 1.00 0.00 O ATOM 83550 H1 WAT 3468 31.288 63.176 72.741 1.00 0.00 H ATOM 83551 H2 WAT 3468 30.865 62.871 74.162 1.00 0.00 H TER 83553 WAT 3468 ATOM 83553 O WAT 3469 21.561 70.043 70.260 1.00 0.00 O ATOM 83554 H1 WAT 3469 22.181 70.208 70.970 1.00 0.00 H ATOM 83555 H2 WAT 3469 21.976 70.422 69.485 1.00 0.00 H TER 83557 WAT 3469 ATOM 83557 O WAT 3470 100.031 67.678 15.480 1.00 0.00 O ATOM 83558 H1 WAT 3470 99.257 67.970 14.997 1.00 0.00 H ATOM 83559 H2 WAT 3470 100.480 67.086 14.877 1.00 0.00 H TER 83561 WAT 3470 ATOM 83561 O WAT 3471 38.090 13.733 10.528 1.00 0.00 O ATOM 83562 H1 WAT 3471 37.501 14.200 9.936 1.00 0.00 H ATOM 83563 H2 WAT 3471 38.055 12.823 10.234 1.00 0.00 H TER 83565 WAT 3471 ATOM 83565 O WAT 3472 25.284 111.660 27.018 1.00 0.00 O ATOM 83566 H1 WAT 3472 25.998 111.981 27.569 1.00 0.00 H ATOM 83567 H2 WAT 3472 25.577 110.797 26.725 1.00 0.00 H TER 83569 WAT 3472 ATOM 83569 O WAT 3473 10.194 42.016 9.635 1.00 0.00 O ATOM 83570 H1 WAT 3473 10.283 42.917 9.944 1.00 0.00 H ATOM 83571 H2 WAT 3473 9.656 42.085 8.847 1.00 0.00 H TER 83573 WAT 3473 ATOM 83573 O WAT 3474 92.258 110.401 97.706 1.00 0.00 O ATOM 83574 H1 WAT 3474 93.209 110.333 97.791 1.00 0.00 H ATOM 83575 H2 WAT 3474 92.066 110.018 96.850 1.00 0.00 H TER 83577 WAT 3474 ATOM 83577 O WAT 3475 28.997 50.181 120.151 1.00 0.00 O ATOM 83578 H1 WAT 3475 29.710 50.705 120.518 1.00 0.00 H ATOM 83579 H2 WAT 3475 28.700 49.637 120.880 1.00 0.00 H TER 83581 WAT 3475 ATOM 83581 O WAT 3476 110.399 3.249 61.873 1.00 0.00 O ATOM 83582 H1 WAT 3476 109.638 3.391 62.436 1.00 0.00 H ATOM 83583 H2 WAT 3476 110.465 2.298 61.793 1.00 0.00 H TER 83585 WAT 3476 ATOM 83585 O WAT 3477 19.378 86.319 149.267 1.00 0.00 O ATOM 83586 H1 WAT 3477 20.111 85.821 149.629 1.00 0.00 H ATOM 83587 H2 WAT 3477 19.220 87.012 149.908 1.00 0.00 H TER 83589 WAT 3477 ATOM 83589 O WAT 3478 26.554 119.888 55.602 1.00 0.00 O ATOM 83590 H1 WAT 3478 26.495 119.498 56.474 1.00 0.00 H ATOM 83591 H2 WAT 3478 25.644 120.026 55.340 1.00 0.00 H TER 83593 WAT 3478 ATOM 83593 O WAT 3479 51.732 36.686 8.595 1.00 0.00 O ATOM 83594 H1 WAT 3479 51.864 35.860 8.130 1.00 0.00 H ATOM 83595 H2 WAT 3479 51.184 36.455 9.345 1.00 0.00 H TER 83597 WAT 3479 ATOM 83597 O WAT 3480 53.597 96.746 133.913 1.00 0.00 O ATOM 83598 H1 WAT 3480 54.253 96.927 133.241 1.00 0.00 H ATOM 83599 H2 WAT 3480 54.048 96.184 134.543 1.00 0.00 H TER 83601 WAT 3480 ATOM 83601 O WAT 3481 0.227 64.115 126.393 1.00 0.00 O ATOM 83602 H1 WAT 3481 0.641 64.935 126.126 1.00 0.00 H ATOM 83603 H2 WAT 3481 -0.401 63.925 125.696 1.00 0.00 H TER 83605 WAT 3481 ATOM 83605 O WAT 3482 75.939 67.988 113.867 1.00 0.00 O ATOM 83606 H1 WAT 3482 75.785 68.527 114.643 1.00 0.00 H ATOM 83607 H2 WAT 3482 75.218 68.207 113.276 1.00 0.00 H TER 83609 WAT 3482 ATOM 83609 O WAT 3483 100.632 134.079 149.634 1.00 0.00 O ATOM 83610 H1 WAT 3483 100.770 133.807 150.541 1.00 0.00 H ATOM 83611 H2 WAT 3483 99.685 134.026 149.509 1.00 0.00 H TER 83613 WAT 3483 ATOM 83613 O WAT 3484 73.035 29.438 4.797 1.00 0.00 O ATOM 83614 H1 WAT 3484 72.828 28.650 5.300 1.00 0.00 H ATOM 83615 H2 WAT 3484 72.269 29.573 4.238 1.00 0.00 H TER 83617 WAT 3484 ATOM 83617 O WAT 3485 73.290 139.708 124.914 1.00 0.00 O ATOM 83618 H1 WAT 3485 73.346 139.126 125.672 1.00 0.00 H ATOM 83619 H2 WAT 3485 73.861 140.444 125.135 1.00 0.00 H TER 83621 WAT 3485 ATOM 83621 O WAT 3486 49.146 18.166 14.586 1.00 0.00 O ATOM 83622 H1 WAT 3486 50.084 18.257 14.750 1.00 0.00 H ATOM 83623 H2 WAT 3486 48.751 18.150 15.458 1.00 0.00 H TER 83625 WAT 3486 ATOM 83625 O WAT 3487 140.602 76.845 114.841 1.00 0.00 O ATOM 83626 H1 WAT 3487 140.782 76.124 115.443 1.00 0.00 H ATOM 83627 H2 WAT 3487 139.877 77.322 115.247 1.00 0.00 H TER 83629 WAT 3487 ATOM 83629 O WAT 3488 45.382 101.287 140.752 1.00 0.00 O ATOM 83630 H1 WAT 3488 45.919 101.337 141.542 1.00 0.00 H ATOM 83631 H2 WAT 3488 44.546 100.930 141.052 1.00 0.00 H TER 83633 WAT 3488 ATOM 83633 O WAT 3489 2.751 116.277 9.301 1.00 0.00 O ATOM 83634 H1 WAT 3489 2.871 117.144 8.913 1.00 0.00 H ATOM 83635 H2 WAT 3489 3.556 116.123 9.796 1.00 0.00 H TER 83637 WAT 3489 ATOM 83637 O WAT 3490 104.087 144.540 106.043 1.00 0.00 O ATOM 83638 H1 WAT 3490 104.059 143.834 106.688 1.00 0.00 H ATOM 83639 H2 WAT 3490 104.662 145.199 106.433 1.00 0.00 H TER 83641 WAT 3490 ATOM 83641 O WAT 3491 130.006 106.255 73.257 1.00 0.00 O ATOM 83642 H1 WAT 3491 129.599 107.121 73.246 1.00 0.00 H ATOM 83643 H2 WAT 3491 129.354 105.679 72.858 1.00 0.00 H TER 83645 WAT 3491 ATOM 83645 O WAT 3492 47.193 119.918 126.008 1.00 0.00 O ATOM 83646 H1 WAT 3492 47.701 119.263 126.487 1.00 0.00 H ATOM 83647 H2 WAT 3492 47.789 120.660 125.911 1.00 0.00 H TER 83649 WAT 3492 ATOM 83649 O WAT 3493 72.992 122.334 112.662 1.00 0.00 O ATOM 83650 H1 WAT 3493 73.585 121.630 112.399 1.00 0.00 H ATOM 83651 H2 WAT 3493 72.321 122.349 111.981 1.00 0.00 H TER 83653 WAT 3493 ATOM 83653 O WAT 3494 45.756 118.733 90.146 1.00 0.00 O ATOM 83654 H1 WAT 3494 46.241 118.284 90.838 1.00 0.00 H ATOM 83655 H2 WAT 3494 44.840 118.517 90.315 1.00 0.00 H TER 83657 WAT 3494 ATOM 83657 O WAT 3495 28.038 89.412 62.148 1.00 0.00 O ATOM 83658 H1 WAT 3495 28.395 88.699 61.618 1.00 0.00 H ATOM 83659 H2 WAT 3495 27.446 88.981 62.764 1.00 0.00 H TER 83661 WAT 3495 ATOM 83661 O WAT 3496 108.890 98.034 143.993 1.00 0.00 O ATOM 83662 H1 WAT 3496 109.214 97.282 144.488 1.00 0.00 H ATOM 83663 H2 WAT 3496 107.943 98.020 144.129 1.00 0.00 H TER 83665 WAT 3496 ATOM 83665 O WAT 3497 45.359 79.759 156.110 1.00 0.00 O ATOM 83666 H1 WAT 3497 44.796 79.711 156.882 1.00 0.00 H ATOM 83667 H2 WAT 3497 45.904 80.531 156.257 1.00 0.00 H TER 83669 WAT 3497 ATOM 83669 O WAT 3498 124.444 28.108 6.179 1.00 0.00 O ATOM 83670 H1 WAT 3498 123.606 27.988 5.732 1.00 0.00 H ATOM 83671 H2 WAT 3498 124.439 29.024 6.455 1.00 0.00 H TER 83673 WAT 3498 ATOM 83673 O WAT 3499 134.518 113.013 61.214 1.00 0.00 O ATOM 83674 H1 WAT 3499 133.647 112.909 60.832 1.00 0.00 H ATOM 83675 H2 WAT 3499 135.082 112.453 60.680 1.00 0.00 H TER 83677 WAT 3499 ATOM 83677 O WAT 3500 137.008 67.319 95.158 1.00 0.00 O ATOM 83678 H1 WAT 3500 136.401 66.579 95.168 1.00 0.00 H ATOM 83679 H2 WAT 3500 137.370 67.321 94.272 1.00 0.00 H TER 83681 WAT 3500 ATOM 83681 O WAT 3501 117.912 42.681 151.214 1.00 0.00 O ATOM 83682 H1 WAT 3501 117.479 42.710 152.068 1.00 0.00 H ATOM 83683 H2 WAT 3501 117.195 42.712 150.581 1.00 0.00 H TER 83685 WAT 3501 ATOM 83685 O WAT 3502 38.400 4.192 126.304 1.00 0.00 O ATOM 83686 H1 WAT 3502 37.679 4.500 126.853 1.00 0.00 H ATOM 83687 H2 WAT 3502 39.179 4.293 126.852 1.00 0.00 H TER 83689 WAT 3502 ATOM 83689 O WAT 3503 58.208 2.391 158.259 1.00 0.00 O ATOM 83690 H1 WAT 3503 58.415 2.863 157.453 1.00 0.00 H ATOM 83691 H2 WAT 3503 57.649 1.667 157.976 1.00 0.00 H TER 83693 WAT 3503 ATOM 83693 O WAT 3504 68.936 102.287 54.618 1.00 0.00 O ATOM 83694 H1 WAT 3504 69.643 101.643 54.593 1.00 0.00 H ATOM 83695 H2 WAT 3504 68.223 101.880 54.126 1.00 0.00 H TER 83697 WAT 3504 ATOM 83697 O WAT 3505 97.254 136.226 3.991 1.00 0.00 O ATOM 83698 H1 WAT 3505 97.431 136.677 4.816 1.00 0.00 H ATOM 83699 H2 WAT 3505 96.304 136.108 3.981 1.00 0.00 H TER 83701 WAT 3505 ATOM 83701 O WAT 3506 93.965 126.205 123.881 1.00 0.00 O ATOM 83702 H1 WAT 3506 94.483 125.652 124.466 1.00 0.00 H ATOM 83703 H2 WAT 3506 93.500 125.586 123.317 1.00 0.00 H TER 83705 WAT 3506 ATOM 83705 O WAT 3507 132.184 81.083 105.409 1.00 0.00 O ATOM 83706 H1 WAT 3507 131.309 80.810 105.134 1.00 0.00 H ATOM 83707 H2 WAT 3507 132.048 81.930 105.835 1.00 0.00 H TER 83709 WAT 3507 ATOM 83709 O WAT 3508 32.426 21.475 132.574 1.00 0.00 O ATOM 83710 H1 WAT 3508 33.211 21.118 132.158 1.00 0.00 H ATOM 83711 H2 WAT 3508 32.670 22.367 132.820 1.00 0.00 H TER 83713 WAT 3508 ATOM 83713 O WAT 3509 42.058 118.554 11.276 1.00 0.00 O ATOM 83714 H1 WAT 3509 41.634 118.336 12.106 1.00 0.00 H ATOM 83715 H2 WAT 3509 41.869 117.807 10.707 1.00 0.00 H TER 83717 WAT 3509 ATOM 83717 O WAT 3510 100.090 58.828 95.368 1.00 0.00 O ATOM 83718 H1 WAT 3510 100.671 58.699 94.618 1.00 0.00 H ATOM 83719 H2 WAT 3510 100.570 58.461 96.109 1.00 0.00 H TER 83721 WAT 3510 ATOM 83721 O WAT 3511 58.339 52.757 80.728 1.00 0.00 O ATOM 83722 H1 WAT 3511 58.837 52.400 79.993 1.00 0.00 H ATOM 83723 H2 WAT 3511 57.883 52.001 81.098 1.00 0.00 H TER 83725 WAT 3511 ATOM 83725 O WAT 3512 79.901 51.488 122.889 1.00 0.00 O ATOM 83726 H1 WAT 3512 79.224 51.887 122.342 1.00 0.00 H ATOM 83727 H2 WAT 3512 80.600 52.141 122.918 1.00 0.00 H TER 83729 WAT 3512 ATOM 83729 O WAT 3513 108.707 50.413 20.208 1.00 0.00 O ATOM 83730 H1 WAT 3513 109.460 50.339 20.795 1.00 0.00 H ATOM 83731 H2 WAT 3513 107.970 50.080 20.721 1.00 0.00 H TER 83733 WAT 3513 ATOM 83733 O WAT 3514 140.860 121.242 134.215 1.00 0.00 O ATOM 83734 H1 WAT 3514 140.796 121.127 133.267 1.00 0.00 H ATOM 83735 H2 WAT 3514 140.090 120.794 134.564 1.00 0.00 H TER 83737 WAT 3514 ATOM 83737 O WAT 3515 138.856 125.693 113.147 1.00 0.00 O ATOM 83738 H1 WAT 3515 138.233 125.700 113.874 1.00 0.00 H ATOM 83739 H2 WAT 3515 139.581 126.242 113.447 1.00 0.00 H TER 83741 WAT 3515 ATOM 83741 O WAT 3516 99.051 33.339 107.670 1.00 0.00 O ATOM 83742 H1 WAT 3516 99.714 33.249 108.355 1.00 0.00 H ATOM 83743 H2 WAT 3516 98.415 33.957 108.032 1.00 0.00 H TER 83745 WAT 3516 ATOM 83745 O WAT 3517 61.323 60.938 119.524 1.00 0.00 O ATOM 83746 H1 WAT 3517 60.907 61.537 120.143 1.00 0.00 H ATOM 83747 H2 WAT 3517 60.934 60.085 119.718 1.00 0.00 H TER 83749 WAT 3517 ATOM 83749 O WAT 3518 57.642 81.552 121.558 1.00 0.00 O ATOM 83750 H1 WAT 3518 58.334 81.719 120.918 1.00 0.00 H ATOM 83751 H2 WAT 3518 57.493 80.607 121.508 1.00 0.00 H TER 83753 WAT 3518 ATOM 83753 O WAT 3519 32.832 4.072 130.998 1.00 0.00 O ATOM 83754 H1 WAT 3519 33.635 4.587 131.076 1.00 0.00 H ATOM 83755 H2 WAT 3519 32.781 3.582 131.819 1.00 0.00 H TER 83757 WAT 3519 ATOM 83757 O WAT 3520 95.101 137.328 141.286 1.00 0.00 O ATOM 83758 H1 WAT 3520 95.842 137.296 140.680 1.00 0.00 H ATOM 83759 H2 WAT 3520 95.286 136.640 141.926 1.00 0.00 H TER 83761 WAT 3520 ATOM 83761 O WAT 3521 50.096 49.859 96.545 1.00 0.00 O ATOM 83762 H1 WAT 3521 49.280 49.359 96.565 1.00 0.00 H ATOM 83763 H2 WAT 3521 50.466 49.679 95.680 1.00 0.00 H TER 83765 WAT 3521 ATOM 83765 O WAT 3522 22.252 66.238 94.868 1.00 0.00 O ATOM 83766 H1 WAT 3522 22.599 66.879 95.488 1.00 0.00 H ATOM 83767 H2 WAT 3522 21.480 65.876 95.304 1.00 0.00 H TER 83769 WAT 3522 ATOM 83769 O WAT 3523 33.068 90.049 14.783 1.00 0.00 O ATOM 83770 H1 WAT 3523 33.445 90.852 15.142 1.00 0.00 H ATOM 83771 H2 WAT 3523 32.219 89.968 15.217 1.00 0.00 H TER 83773 WAT 3523 ATOM 83773 O WAT 3524 112.298 112.421 105.793 1.00 0.00 O ATOM 83774 H1 WAT 3524 113.186 112.699 105.570 1.00 0.00 H ATOM 83775 H2 WAT 3524 112.419 111.764 106.479 1.00 0.00 H TER 83777 WAT 3524 ATOM 83777 O WAT 3525 126.585 83.813 131.476 1.00 0.00 O ATOM 83778 H1 WAT 3525 125.648 83.639 131.393 1.00 0.00 H ATOM 83779 H2 WAT 3525 127.006 83.000 131.195 1.00 0.00 H TER 83781 WAT 3525 ATOM 83781 O WAT 3526 72.692 129.952 80.471 1.00 0.00 O ATOM 83782 H1 WAT 3526 72.702 130.628 81.148 1.00 0.00 H ATOM 83783 H2 WAT 3526 73.251 130.300 79.776 1.00 0.00 H TER 83785 WAT 3526 ATOM 83785 O WAT 3527 26.921 74.793 119.090 1.00 0.00 O ATOM 83786 H1 WAT 3527 26.161 75.037 118.563 1.00 0.00 H ATOM 83787 H2 WAT 3527 27.338 74.086 118.596 1.00 0.00 H TER 83789 WAT 3527 ATOM 83789 O WAT 3528 112.677 39.798 99.376 1.00 0.00 O ATOM 83790 H1 WAT 3528 112.595 39.266 100.168 1.00 0.00 H ATOM 83791 H2 WAT 3528 113.074 40.616 99.677 1.00 0.00 H TER 83793 WAT 3528 ATOM 83793 O WAT 3529 134.491 130.097 140.106 1.00 0.00 O ATOM 83794 H1 WAT 3529 134.365 129.586 139.307 1.00 0.00 H ATOM 83795 H2 WAT 3529 133.649 130.046 140.559 1.00 0.00 H TER 83797 WAT 3529 ATOM 83797 O WAT 3530 132.072 45.443 66.641 1.00 0.00 O ATOM 83798 H1 WAT 3530 132.917 45.313 67.071 1.00 0.00 H ATOM 83799 H2 WAT 3530 132.040 44.765 65.965 1.00 0.00 H TER 83801 WAT 3530 ATOM 83801 O WAT 3531 8.544 99.063 69.829 1.00 0.00 O ATOM 83802 H1 WAT 3531 8.340 98.789 68.934 1.00 0.00 H ATOM 83803 H2 WAT 3531 9.299 99.644 69.736 1.00 0.00 H TER 83805 WAT 3531 ATOM 83805 O WAT 3532 104.600 46.867 151.935 1.00 0.00 O ATOM 83806 H1 WAT 3532 104.535 46.082 152.478 1.00 0.00 H ATOM 83807 H2 WAT 3532 104.653 47.588 152.561 1.00 0.00 H TER 83809 WAT 3532 ATOM 83809 O WAT 3533 89.930 84.120 94.739 1.00 0.00 O ATOM 83810 H1 WAT 3533 89.511 83.622 95.441 1.00 0.00 H ATOM 83811 H2 WAT 3533 89.921 85.026 95.049 1.00 0.00 H TER 83813 WAT 3533 ATOM 83813 O WAT 3534 14.449 75.830 96.451 1.00 0.00 O ATOM 83814 H1 WAT 3534 15.220 75.317 96.210 1.00 0.00 H ATOM 83815 H2 WAT 3534 13.991 75.288 97.094 1.00 0.00 H TER 83817 WAT 3534 ATOM 83817 O WAT 3535 22.179 74.457 114.361 1.00 0.00 O ATOM 83818 H1 WAT 3535 23.133 74.526 114.349 1.00 0.00 H ATOM 83819 H2 WAT 3535 21.923 74.514 113.441 1.00 0.00 H TER 83821 WAT 3535 ATOM 83821 O WAT 3536 48.971 97.691 115.009 1.00 0.00 O ATOM 83822 H1 WAT 3536 48.310 97.352 115.612 1.00 0.00 H ATOM 83823 H2 WAT 3536 49.806 97.504 115.439 1.00 0.00 H TER 83825 WAT 3536 ATOM 83825 O WAT 3537 84.097 36.574 148.310 1.00 0.00 O ATOM 83826 H1 WAT 3537 83.250 36.773 148.710 1.00 0.00 H ATOM 83827 H2 WAT 3537 83.932 36.615 147.368 1.00 0.00 H TER 83829 WAT 3537 ATOM 83829 O WAT 3538 54.351 18.427 0.783 1.00 0.00 O ATOM 83830 H1 WAT 3538 55.243 18.774 0.805 1.00 0.00 H ATOM 83831 H2 WAT 3538 53.982 18.764 -0.033 1.00 0.00 H TER 83833 WAT 3538 ATOM 83833 O WAT 3539 2.902 60.094 147.851 1.00 0.00 O ATOM 83834 H1 WAT 3539 2.681 60.844 147.298 1.00 0.00 H ATOM 83835 H2 WAT 3539 2.961 60.458 148.735 1.00 0.00 H TER 83837 WAT 3539 ATOM 83837 O WAT 3540 36.375 66.842 149.645 1.00 0.00 O ATOM 83838 H1 WAT 3540 35.705 67.187 150.234 1.00 0.00 H ATOM 83839 H2 WAT 3540 37.157 67.356 149.845 1.00 0.00 H TER 83841 WAT 3540 ATOM 83841 O WAT 3541 95.750 54.493 87.865 1.00 0.00 O ATOM 83842 H1 WAT 3541 96.166 53.742 87.441 1.00 0.00 H ATOM 83843 H2 WAT 3541 95.732 55.170 87.189 1.00 0.00 H TER 83845 WAT 3541 ATOM 83845 O WAT 3542 145.191 92.677 114.285 1.00 0.00 O ATOM 83846 H1 WAT 3542 145.042 92.772 113.344 1.00 0.00 H ATOM 83847 H2 WAT 3542 145.845 91.982 114.355 1.00 0.00 H TER 83849 WAT 3542 ATOM 83849 O WAT 3543 64.661 68.649 148.188 1.00 0.00 O ATOM 83850 H1 WAT 3543 65.537 68.548 148.559 1.00 0.00 H ATOM 83851 H2 WAT 3543 64.701 69.470 147.698 1.00 0.00 H TER 83853 WAT 3543 ATOM 83853 O WAT 3544 109.210 32.350 124.128 1.00 0.00 O ATOM 83854 H1 WAT 3544 108.270 32.187 124.202 1.00 0.00 H ATOM 83855 H2 WAT 3544 109.598 31.480 124.035 1.00 0.00 H TER 83857 WAT 3544 ATOM 83857 O WAT 3545 41.851 101.396 99.699 1.00 0.00 O ATOM 83858 H1 WAT 3545 41.876 100.513 99.330 1.00 0.00 H ATOM 83859 H2 WAT 3545 40.971 101.714 99.497 1.00 0.00 H TER 83861 WAT 3545 ATOM 83861 O WAT 3546 133.224 121.764 120.212 1.00 0.00 O ATOM 83862 H1 WAT 3546 134.063 121.452 119.873 1.00 0.00 H ATOM 83863 H2 WAT 3546 133.460 122.360 120.924 1.00 0.00 H TER 83865 WAT 3546 ATOM 83865 O WAT 3547 54.154 40.905 150.496 1.00 0.00 O ATOM 83866 H1 WAT 3547 54.015 41.738 150.045 1.00 0.00 H ATOM 83867 H2 WAT 3547 53.898 40.241 149.857 1.00 0.00 H TER 83869 WAT 3547 ATOM 83869 O WAT 3548 85.426 53.107 127.491 1.00 0.00 O ATOM 83870 H1 WAT 3548 84.677 53.574 127.122 1.00 0.00 H ATOM 83871 H2 WAT 3548 85.039 52.391 127.994 1.00 0.00 H TER 83873 WAT 3548 ATOM 83873 O WAT 3549 55.551 39.819 81.323 1.00 0.00 O ATOM 83874 H1 WAT 3549 55.043 40.162 82.059 1.00 0.00 H ATOM 83875 H2 WAT 3549 55.003 39.126 80.956 1.00 0.00 H TER 83877 WAT 3549 ATOM 83877 O WAT 3550 141.747 23.563 15.514 1.00 0.00 O ATOM 83878 H1 WAT 3550 141.968 23.838 16.404 1.00 0.00 H ATOM 83879 H2 WAT 3550 141.088 24.193 15.225 1.00 0.00 H TER 83881 WAT 3550 ATOM 83881 O WAT 3551 75.087 79.319 141.415 1.00 0.00 O ATOM 83882 H1 WAT 3551 75.065 79.083 140.488 1.00 0.00 H ATOM 83883 H2 WAT 3551 75.993 79.162 141.681 1.00 0.00 H TER 83885 WAT 3551 ATOM 83885 O WAT 3552 44.309 130.551 65.570 1.00 0.00 O ATOM 83886 H1 WAT 3552 43.930 131.399 65.800 1.00 0.00 H ATOM 83887 H2 WAT 3552 44.250 130.037 66.375 1.00 0.00 H TER 83889 WAT 3552 ATOM 83889 O WAT 3553 49.725 32.443 75.304 1.00 0.00 O ATOM 83890 H1 WAT 3553 50.264 31.657 75.210 1.00 0.00 H ATOM 83891 H2 WAT 3553 49.408 32.410 76.206 1.00 0.00 H TER 83893 WAT 3553 ATOM 83893 O WAT 3554 25.884 12.712 19.703 1.00 0.00 O ATOM 83894 H1 WAT 3554 26.797 12.540 19.931 1.00 0.00 H ATOM 83895 H2 WAT 3554 25.865 13.642 19.475 1.00 0.00 H TER 83897 WAT 3554 ATOM 83897 O WAT 3555 45.627 25.175 59.219 1.00 0.00 O ATOM 83898 H1 WAT 3555 45.095 25.689 58.611 1.00 0.00 H ATOM 83899 H2 WAT 3555 45.684 24.309 58.814 1.00 0.00 H TER 83901 WAT 3555 ATOM 83901 O WAT 3556 125.613 85.716 147.727 1.00 0.00 O ATOM 83902 H1 WAT 3556 125.311 85.468 148.601 1.00 0.00 H ATOM 83903 H2 WAT 3556 126.026 84.924 147.382 1.00 0.00 H TER 83905 WAT 3556 ATOM 83905 O WAT 3557 60.736 17.519 132.999 1.00 0.00 O ATOM 83906 H1 WAT 3557 59.945 17.693 133.510 1.00 0.00 H ATOM 83907 H2 WAT 3557 61.432 17.450 133.652 1.00 0.00 H TER 83909 WAT 3557 ATOM 83909 O WAT 3558 117.012 98.871 154.078 1.00 0.00 O ATOM 83910 H1 WAT 3558 117.143 97.981 153.750 1.00 0.00 H ATOM 83911 H2 WAT 3558 117.896 99.197 154.244 1.00 0.00 H TER 83913 WAT 3558 ATOM 83913 O WAT 3559 45.397 125.089 113.682 1.00 0.00 O ATOM 83914 H1 WAT 3559 45.049 124.725 114.496 1.00 0.00 H ATOM 83915 H2 WAT 3559 44.897 124.654 112.992 1.00 0.00 H TER 83917 WAT 3559 ATOM 83917 O WAT 3560 19.737 55.141 131.944 1.00 0.00 O ATOM 83918 H1 WAT 3560 20.606 54.784 132.123 1.00 0.00 H ATOM 83919 H2 WAT 3560 19.785 55.448 131.039 1.00 0.00 H TER 83921 WAT 3560 ATOM 83921 O WAT 3561 104.898 79.833 149.804 1.00 0.00 O ATOM 83922 H1 WAT 3561 105.725 79.517 150.167 1.00 0.00 H ATOM 83923 H2 WAT 3561 104.903 79.530 148.896 1.00 0.00 H TER 83925 WAT 3561 ATOM 83925 O WAT 3562 98.657 38.917 144.801 1.00 0.00 O ATOM 83926 H1 WAT 3562 98.727 39.752 145.263 1.00 0.00 H ATOM 83927 H2 WAT 3562 98.249 38.326 145.435 1.00 0.00 H TER 83929 WAT 3562 ATOM 83929 O WAT 3563 8.352 20.580 77.127 1.00 0.00 O ATOM 83930 H1 WAT 3563 8.957 21.317 77.209 1.00 0.00 H ATOM 83931 H2 WAT 3563 7.645 20.781 77.741 1.00 0.00 H TER 83933 WAT 3563 ATOM 83933 O WAT 3564 1.233 61.302 66.615 1.00 0.00 O ATOM 83934 H1 WAT 3564 1.900 61.553 65.977 1.00 0.00 H ATOM 83935 H2 WAT 3564 1.378 61.890 67.357 1.00 0.00 H TER 83937 WAT 3564 ATOM 83937 O WAT 3565 36.360 73.649 3.144 1.00 0.00 O ATOM 83938 H1 WAT 3565 37.186 73.866 3.577 1.00 0.00 H ATOM 83939 H2 WAT 3565 36.613 73.407 2.253 1.00 0.00 H TER 83941 WAT 3565 ATOM 83941 O WAT 3566 120.203 116.358 77.419 1.00 0.00 O ATOM 83942 H1 WAT 3566 119.717 115.809 76.802 1.00 0.00 H ATOM 83943 H2 WAT 3566 121.117 116.097 77.303 1.00 0.00 H TER 83945 WAT 3566 ATOM 83945 O WAT 3567 37.204 7.706 113.213 1.00 0.00 O ATOM 83946 H1 WAT 3567 38.143 7.877 113.134 1.00 0.00 H ATOM 83947 H2 WAT 3567 36.844 7.943 112.359 1.00 0.00 H TER 83949 WAT 3567 ATOM 83949 O WAT 3568 90.893 23.415 154.292 1.00 0.00 O ATOM 83950 H1 WAT 3568 91.079 24.343 154.149 1.00 0.00 H ATOM 83951 H2 WAT 3568 91.155 23.255 155.199 1.00 0.00 H TER 83953 WAT 3568 ATOM 83953 O WAT 3569 0.880 131.297 59.474 1.00 0.00 O ATOM 83954 H1 WAT 3569 0.248 131.721 58.895 1.00 0.00 H ATOM 83955 H2 WAT 3569 0.410 130.544 59.832 1.00 0.00 H TER 83957 WAT 3569 ATOM 83957 O WAT 3570 107.793 32.043 66.491 1.00 0.00 O ATOM 83958 H1 WAT 3570 107.291 32.156 67.299 1.00 0.00 H ATOM 83959 H2 WAT 3570 108.601 32.533 66.641 1.00 0.00 H TER 83961 WAT 3570 ATOM 83961 O WAT 3571 35.943 48.121 158.252 1.00 0.00 O ATOM 83962 H1 WAT 3571 35.372 48.253 157.495 1.00 0.00 H ATOM 83963 H2 WAT 3571 36.096 49.002 158.593 1.00 0.00 H TER 83965 WAT 3571 ATOM 83965 O WAT 3572 33.981 94.473 10.913 1.00 0.00 O ATOM 83966 H1 WAT 3572 34.218 93.549 10.995 1.00 0.00 H ATOM 83967 H2 WAT 3572 34.607 94.932 11.474 1.00 0.00 H TER 83969 WAT 3572 ATOM 83969 O WAT 3573 90.135 98.131 97.212 1.00 0.00 O ATOM 83970 H1 WAT 3573 89.975 97.535 97.943 1.00 0.00 H ATOM 83971 H2 WAT 3573 91.089 98.185 97.152 1.00 0.00 H TER 83973 WAT 3573 ATOM 83973 O WAT 3574 24.905 30.191 95.335 1.00 0.00 O ATOM 83974 H1 WAT 3574 25.250 30.480 96.181 1.00 0.00 H ATOM 83975 H2 WAT 3574 25.582 29.611 94.986 1.00 0.00 H TER 83977 WAT 3574 ATOM 83977 O WAT 3575 31.287 137.510 80.429 1.00 0.00 O ATOM 83978 H1 WAT 3575 32.012 137.295 79.843 1.00 0.00 H ATOM 83979 H2 WAT 3575 31.386 136.906 81.165 1.00 0.00 H TER 83981 WAT 3575 ATOM 83981 O WAT 3576 100.798 116.086 152.530 1.00 0.00 O ATOM 83982 H1 WAT 3576 101.086 116.704 153.202 1.00 0.00 H ATOM 83983 H2 WAT 3576 99.884 116.318 152.369 1.00 0.00 H TER 83985 WAT 3576 ATOM 83985 O WAT 3577 104.584 71.121 92.915 1.00 0.00 O ATOM 83986 H1 WAT 3577 105.365 71.187 92.367 1.00 0.00 H ATOM 83987 H2 WAT 3577 104.214 70.264 92.702 1.00 0.00 H TER 83989 WAT 3577 ATOM 83989 O WAT 3578 89.506 63.800 88.225 1.00 0.00 O ATOM 83990 H1 WAT 3578 89.312 64.323 87.447 1.00 0.00 H ATOM 83991 H2 WAT 3578 89.978 64.399 88.804 1.00 0.00 H TER 83993 WAT 3578 ATOM 83993 O WAT 3579 29.207 26.399 101.576 1.00 0.00 O ATOM 83994 H1 WAT 3579 28.394 26.883 101.431 1.00 0.00 H ATOM 83995 H2 WAT 3579 29.816 26.755 100.929 1.00 0.00 H TER 83997 WAT 3579 ATOM 83997 O WAT 3580 111.077 0.768 70.661 1.00 0.00 O ATOM 83998 H1 WAT 3580 111.246 -0.134 70.388 1.00 0.00 H ATOM 83999 H2 WAT 3580 110.332 0.702 71.258 1.00 0.00 H TER 84001 WAT 3580 ATOM 84001 O WAT 3581 118.200 99.774 99.515 1.00 0.00 O ATOM 84002 H1 WAT 3581 119.015 99.706 99.018 1.00 0.00 H ATOM 84003 H2 WAT 3581 118.479 100.006 100.401 1.00 0.00 H TER 84005 WAT 3581 ATOM 84005 O WAT 3582 81.603 100.871 104.542 1.00 0.00 O ATOM 84006 H1 WAT 3582 81.739 100.461 103.688 1.00 0.00 H ATOM 84007 H2 WAT 3582 82.039 100.284 105.160 1.00 0.00 H TER 84009 WAT 3582 ATOM 84009 O WAT 3583 65.362 11.424 3.357 1.00 0.00 O ATOM 84010 H1 WAT 3583 65.540 11.333 2.421 1.00 0.00 H ATOM 84011 H2 WAT 3583 64.528 11.891 3.399 1.00 0.00 H TER 84013 WAT 3583 ATOM 84013 O WAT 3584 68.568 87.312 71.382 1.00 0.00 O ATOM 84014 H1 WAT 3584 69.060 86.493 71.433 1.00 0.00 H ATOM 84015 H2 WAT 3584 69.158 87.918 70.934 1.00 0.00 H TER 84017 WAT 3584 ATOM 84017 O WAT 3585 118.260 27.070 76.181 1.00 0.00 O ATOM 84018 H1 WAT 3585 117.845 27.065 75.318 1.00 0.00 H ATOM 84019 H2 WAT 3585 119.168 27.318 76.008 1.00 0.00 H TER 84021 WAT 3585 ATOM 84021 O WAT 3586 113.174 139.291 10.983 1.00 0.00 O ATOM 84022 H1 WAT 3586 112.723 138.502 11.282 1.00 0.00 H ATOM 84023 H2 WAT 3586 112.797 139.996 11.510 1.00 0.00 H TER 84025 WAT 3586 ATOM 84025 O WAT 3587 137.669 42.802 95.102 1.00 0.00 O ATOM 84026 H1 WAT 3587 136.818 43.149 95.370 1.00 0.00 H ATOM 84027 H2 WAT 3587 137.607 42.725 94.150 1.00 0.00 H TER 84029 WAT 3587 ATOM 84029 O WAT 3588 55.789 6.363 134.645 1.00 0.00 O ATOM 84030 H1 WAT 3588 55.562 6.893 135.409 1.00 0.00 H ATOM 84031 H2 WAT 3588 54.946 6.095 134.280 1.00 0.00 H TER 84033 WAT 3588 ATOM 84033 O WAT 3589 91.563 135.373 127.629 1.00 0.00 O ATOM 84034 H1 WAT 3589 91.727 135.128 128.540 1.00 0.00 H ATOM 84035 H2 WAT 3589 91.009 134.671 127.288 1.00 0.00 H TER 84037 WAT 3589 ATOM 84037 O WAT 3590 28.627 91.866 29.597 1.00 0.00 O ATOM 84038 H1 WAT 3590 29.191 92.634 29.505 1.00 0.00 H ATOM 84039 H2 WAT 3590 28.923 91.267 28.912 1.00 0.00 H TER 84041 WAT 3590 ATOM 84041 O WAT 3591 60.588 21.611 7.300 1.00 0.00 O ATOM 84042 H1 WAT 3591 60.376 21.480 6.376 1.00 0.00 H ATOM 84043 H2 WAT 3591 59.761 21.467 7.759 1.00 0.00 H TER 84045 WAT 3591 ATOM 84045 O WAT 3592 56.781 94.141 127.645 1.00 0.00 O ATOM 84046 H1 WAT 3592 57.131 95.017 127.481 1.00 0.00 H ATOM 84047 H2 WAT 3592 57.220 93.854 128.445 1.00 0.00 H TER 84049 WAT 3592 ATOM 84049 O WAT 3593 46.298 110.995 140.538 1.00 0.00 O ATOM 84050 H1 WAT 3593 46.827 110.452 139.954 1.00 0.00 H ATOM 84051 H2 WAT 3593 46.914 111.306 141.201 1.00 0.00 H TER 84053 WAT 3593 ATOM 84053 O WAT 3594 56.210 34.820 61.323 1.00 0.00 O ATOM 84054 H1 WAT 3594 56.048 34.957 60.390 1.00 0.00 H ATOM 84055 H2 WAT 3594 55.823 35.586 61.748 1.00 0.00 H TER 84057 WAT 3594 ATOM 84057 O WAT 3595 112.387 92.588 80.617 1.00 0.00 O ATOM 84058 H1 WAT 3595 112.009 93.178 79.965 1.00 0.00 H ATOM 84059 H2 WAT 3595 112.065 92.920 81.455 1.00 0.00 H TER 84061 WAT 3595 ATOM 84061 O WAT 3596 131.818 60.848 95.715 1.00 0.00 O ATOM 84062 H1 WAT 3596 131.230 60.927 94.963 1.00 0.00 H ATOM 84063 H2 WAT 3596 131.386 60.218 96.292 1.00 0.00 H TER 84065 WAT 3596 ATOM 84065 O WAT 3597 11.649 131.563 157.314 1.00 0.00 O ATOM 84066 H1 WAT 3597 10.741 131.863 157.350 1.00 0.00 H ATOM 84067 H2 WAT 3597 12.164 132.367 157.242 1.00 0.00 H TER 84069 WAT 3597 ATOM 84069 O WAT 3598 78.402 7.605 107.661 1.00 0.00 O ATOM 84070 H1 WAT 3598 78.786 8.050 108.416 1.00 0.00 H ATOM 84071 H2 WAT 3598 79.136 7.138 107.260 1.00 0.00 H TER 84073 WAT 3598 ATOM 84073 O WAT 3599 35.173 83.152 97.146 1.00 0.00 O ATOM 84074 H1 WAT 3599 36.101 82.930 97.223 1.00 0.00 H ATOM 84075 H2 WAT 3599 34.746 82.325 96.923 1.00 0.00 H TER 84077 WAT 3599 ATOM 84077 O WAT 3600 81.631 142.209 102.027 1.00 0.00 O ATOM 84078 H1 WAT 3600 81.129 141.568 102.529 1.00 0.00 H ATOM 84079 H2 WAT 3600 81.015 142.533 101.370 1.00 0.00 H TER 84081 WAT 3600 ATOM 84081 O WAT 3601 55.874 109.470 82.484 1.00 0.00 O ATOM 84082 H1 WAT 3601 55.314 109.549 83.256 1.00 0.00 H ATOM 84083 H2 WAT 3601 56.129 108.547 82.468 1.00 0.00 H TER 84085 WAT 3601 ATOM 84085 O WAT 3602 58.053 139.450 87.713 1.00 0.00 O ATOM 84086 H1 WAT 3602 58.595 140.210 87.498 1.00 0.00 H ATOM 84087 H2 WAT 3602 57.266 139.560 87.180 1.00 0.00 H TER 84089 WAT 3602 ATOM 84089 O WAT 3603 68.953 53.668 67.194 1.00 0.00 O ATOM 84090 H1 WAT 3603 69.701 53.300 66.724 1.00 0.00 H ATOM 84091 H2 WAT 3603 68.232 53.066 67.008 1.00 0.00 H TER 84093 WAT 3603 ATOM 84093 O WAT 3604 112.551 79.787 7.460 1.00 0.00 O ATOM 84094 H1 WAT 3604 111.953 79.903 8.199 1.00 0.00 H ATOM 84095 H2 WAT 3604 112.183 80.334 6.766 1.00 0.00 H TER 84097 WAT 3604 ATOM 84097 O WAT 3605 122.969 68.351 11.382 1.00 0.00 O ATOM 84098 H1 WAT 3605 122.039 68.271 11.170 1.00 0.00 H ATOM 84099 H2 WAT 3605 123.142 69.292 11.350 1.00 0.00 H TER 84101 WAT 3605 ATOM 84101 O WAT 3606 123.226 42.261 146.527 1.00 0.00 O ATOM 84102 H1 WAT 3606 123.815 41.585 146.862 1.00 0.00 H ATOM 84103 H2 WAT 3606 123.028 41.985 145.632 1.00 0.00 H TER 84105 WAT 3606 ATOM 84105 O WAT 3607 66.950 6.568 3.340 1.00 0.00 O ATOM 84106 H1 WAT 3607 66.867 6.154 2.480 1.00 0.00 H ATOM 84107 H2 WAT 3607 67.811 6.293 3.655 1.00 0.00 H TER 84109 WAT 3607 ATOM 84109 O WAT 3608 102.751 53.990 94.738 1.00 0.00 O ATOM 84110 H1 WAT 3608 103.325 53.358 95.170 1.00 0.00 H ATOM 84111 H2 WAT 3608 103.235 54.259 93.957 1.00 0.00 H TER 84113 WAT 3608 ATOM 84113 O WAT 3609 138.252 145.579 72.576 1.00 0.00 O ATOM 84114 H1 WAT 3609 138.589 145.431 73.460 1.00 0.00 H ATOM 84115 H2 WAT 3609 138.947 145.262 71.999 1.00 0.00 H TER 84117 WAT 3609 ATOM 84117 O WAT 3610 118.811 66.746 154.044 1.00 0.00 O ATOM 84118 H1 WAT 3610 117.948 67.137 154.184 1.00 0.00 H ATOM 84119 H2 WAT 3610 119.057 66.398 154.901 1.00 0.00 H TER 84121 WAT 3610 ATOM 84121 O WAT 3611 119.858 85.161 128.447 1.00 0.00 O ATOM 84122 H1 WAT 3611 120.215 84.329 128.138 1.00 0.00 H ATOM 84123 H2 WAT 3611 118.963 85.178 128.109 1.00 0.00 H TER 84125 WAT 3611 ATOM 84125 O WAT 3612 113.573 137.140 6.870 1.00 0.00 O ATOM 84126 H1 WAT 3612 113.432 137.174 7.816 1.00 0.00 H ATOM 84127 H2 WAT 3612 112.925 136.510 6.553 1.00 0.00 H TER 84129 WAT 3612 ATOM 84129 O WAT 3613 0.376 25.686 76.337 1.00 0.00 O ATOM 84130 H1 WAT 3613 0.275 26.213 75.544 1.00 0.00 H ATOM 84131 H2 WAT 3613 -0.167 24.913 76.181 1.00 0.00 H TER 84133 WAT 3613 ATOM 84133 O WAT 3614 122.489 89.267 144.725 1.00 0.00 O ATOM 84134 H1 WAT 3614 122.882 88.450 144.418 1.00 0.00 H ATOM 84135 H2 WAT 3614 122.954 89.467 145.537 1.00 0.00 H TER 84137 WAT 3614 ATOM 84137 O WAT 3615 78.443 99.454 23.463 1.00 0.00 O ATOM 84138 H1 WAT 3615 77.563 99.805 23.600 1.00 0.00 H ATOM 84139 H2 WAT 3615 78.911 100.154 23.007 1.00 0.00 H TER 84141 WAT 3615 ATOM 84141 O WAT 3616 15.396 94.563 76.407 1.00 0.00 O ATOM 84142 H1 WAT 3616 16.190 94.711 76.919 1.00 0.00 H ATOM 84143 H2 WAT 3616 15.417 93.629 76.197 1.00 0.00 H TER 84145 WAT 3616 ATOM 84145 O WAT 3617 139.943 4.022 154.828 1.00 0.00 O ATOM 84146 H1 WAT 3617 140.481 4.326 155.559 1.00 0.00 H ATOM 84147 H2 WAT 3617 140.267 4.511 154.072 1.00 0.00 H TER 84149 WAT 3617 ATOM 84149 O WAT 3618 37.207 107.827 85.078 1.00 0.00 O ATOM 84150 H1 WAT 3618 36.866 107.093 85.590 1.00 0.00 H ATOM 84151 H2 WAT 3618 37.879 107.437 84.519 1.00 0.00 H TER 84153 WAT 3618 ATOM 84153 O WAT 3619 80.527 122.167 71.032 1.00 0.00 O ATOM 84154 H1 WAT 3619 80.428 121.456 71.665 1.00 0.00 H ATOM 84155 H2 WAT 3619 80.331 121.763 70.187 1.00 0.00 H TER 84157 WAT 3619 ATOM 84157 O WAT 3620 116.096 96.149 111.839 1.00 0.00 O ATOM 84158 H1 WAT 3620 115.319 96.700 111.743 1.00 0.00 H ATOM 84159 H2 WAT 3620 116.150 95.974 112.779 1.00 0.00 H TER 84161 WAT 3620 ATOM 84161 O WAT 3621 57.836 60.396 129.349 1.00 0.00 O ATOM 84162 H1 WAT 3621 56.891 60.269 129.259 1.00 0.00 H ATOM 84163 H2 WAT 3621 57.922 61.230 129.811 1.00 0.00 H TER 84165 WAT 3621 ATOM 84165 O WAT 3622 2.641 140.428 16.630 1.00 0.00 O ATOM 84166 H1 WAT 3622 2.410 139.500 16.672 1.00 0.00 H ATOM 84167 H2 WAT 3622 2.986 140.629 17.500 1.00 0.00 H TER 84169 WAT 3622 ATOM 84169 O WAT 3623 138.940 110.100 11.664 1.00 0.00 O ATOM 84170 H1 WAT 3623 139.294 110.105 10.774 1.00 0.00 H ATOM 84171 H2 WAT 3623 138.142 109.575 11.600 1.00 0.00 H TER 84173 WAT 3623 ATOM 84173 O WAT 3624 50.558 2.974 15.482 1.00 0.00 O ATOM 84174 H1 WAT 3624 50.199 2.247 14.973 1.00 0.00 H ATOM 84175 H2 WAT 3624 51.460 3.059 15.174 1.00 0.00 H TER 84177 WAT 3624 ATOM 84177 O WAT 3625 57.262 145.268 72.051 1.00 0.00 O ATOM 84178 H1 WAT 3625 56.620 145.117 72.744 1.00 0.00 H ATOM 84179 H2 WAT 3625 56.933 146.036 71.583 1.00 0.00 H TER 84181 WAT 3625 ATOM 84181 O WAT 3626 39.189 74.477 16.185 1.00 0.00 O ATOM 84182 H1 WAT 3626 39.815 74.614 15.474 1.00 0.00 H ATOM 84183 H2 WAT 3626 38.759 73.650 15.970 1.00 0.00 H TER 84185 WAT 3626 ATOM 84185 O WAT 3627 13.631 104.907 5.201 1.00 0.00 O ATOM 84186 H1 WAT 3627 13.791 104.154 4.632 1.00 0.00 H ATOM 84187 H2 WAT 3627 13.148 104.547 5.945 1.00 0.00 H TER 84189 WAT 3627 ATOM 84189 O WAT 3628 106.464 115.563 71.272 1.00 0.00 O ATOM 84190 H1 WAT 3628 106.029 116.365 70.983 1.00 0.00 H ATOM 84191 H2 WAT 3628 107.151 115.864 71.866 1.00 0.00 H TER 84193 WAT 3628 ATOM 84193 O WAT 3629 68.287 132.740 68.106 1.00 0.00 O ATOM 84194 H1 WAT 3629 68.875 131.993 68.220 1.00 0.00 H ATOM 84195 H2 WAT 3629 68.793 133.365 67.586 1.00 0.00 H TER 84197 WAT 3629 ATOM 84197 O WAT 3630 101.410 19.871 98.169 1.00 0.00 O ATOM 84198 H1 WAT 3630 101.305 18.977 97.843 1.00 0.00 H ATOM 84199 H2 WAT 3630 100.699 19.980 98.800 1.00 0.00 H TER 84201 WAT 3630 ATOM 84201 O WAT 3631 7.571 50.180 2.727 1.00 0.00 O ATOM 84202 H1 WAT 3631 8.022 50.947 2.374 1.00 0.00 H ATOM 84203 H2 WAT 3631 7.880 50.115 3.630 1.00 0.00 H TER 84205 WAT 3631 ATOM 84205 O WAT 3632 119.366 23.648 15.340 1.00 0.00 O ATOM 84206 H1 WAT 3632 119.897 23.548 14.550 1.00 0.00 H ATOM 84207 H2 WAT 3632 118.979 24.519 15.260 1.00 0.00 H TER 84209 WAT 3632 ATOM 84209 O WAT 3633 48.794 25.174 82.076 1.00 0.00 O ATOM 84210 H1 WAT 3633 49.644 24.892 81.739 1.00 0.00 H ATOM 84211 H2 WAT 3633 48.180 24.982 81.367 1.00 0.00 H TER 84213 WAT 3633 ATOM 84213 O WAT 3634 58.844 30.910 138.723 1.00 0.00 O ATOM 84214 H1 WAT 3634 59.773 30.945 138.494 1.00 0.00 H ATOM 84215 H2 WAT 3634 58.780 30.195 139.356 1.00 0.00 H TER 84217 WAT 3634 ATOM 84217 O WAT 3635 112.853 83.762 103.032 1.00 0.00 O ATOM 84218 H1 WAT 3635 112.013 84.129 102.754 1.00 0.00 H ATOM 84219 H2 WAT 3635 112.709 83.498 103.941 1.00 0.00 H TER 84221 WAT 3635 ATOM 84221 O WAT 3636 97.388 79.230 5.220 1.00 0.00 O ATOM 84222 H1 WAT 3636 96.670 78.627 5.025 1.00 0.00 H ATOM 84223 H2 WAT 3636 97.890 79.275 4.406 1.00 0.00 H TER 84225 WAT 3636 ATOM 84225 O WAT 3637 100.435 85.935 139.115 1.00 0.00 O ATOM 84226 H1 WAT 3637 100.141 86.248 139.970 1.00 0.00 H ATOM 84227 H2 WAT 3637 99.767 85.303 138.849 1.00 0.00 H TER 84229 WAT 3637 ATOM 84229 O WAT 3638 87.967 76.827 67.383 1.00 0.00 O ATOM 84230 H1 WAT 3638 87.771 76.089 67.960 1.00 0.00 H ATOM 84231 H2 WAT 3638 88.562 76.467 66.725 1.00 0.00 H TER 84233 WAT 3638 ATOM 84233 O WAT 3639 43.993 11.838 19.127 1.00 0.00 O ATOM 84234 H1 WAT 3639 44.176 12.308 18.313 1.00 0.00 H ATOM 84235 H2 WAT 3639 44.839 11.479 19.391 1.00 0.00 H TER 84237 WAT 3639 ATOM 84237 O WAT 3640 113.714 23.746 115.726 1.00 0.00 O ATOM 84238 H1 WAT 3640 114.662 23.733 115.595 1.00 0.00 H ATOM 84239 H2 WAT 3640 113.508 22.882 116.082 1.00 0.00 H TER 84241 WAT 3640 ATOM 84241 O WAT 3641 72.680 126.279 120.184 1.00 0.00 O ATOM 84242 H1 WAT 3641 73.556 126.309 120.568 1.00 0.00 H ATOM 84243 H2 WAT 3641 72.676 126.989 119.542 1.00 0.00 H TER 84245 WAT 3641 ATOM 84245 O WAT 3642 17.154 74.960 57.002 1.00 0.00 O ATOM 84246 H1 WAT 3642 16.948 75.385 57.834 1.00 0.00 H ATOM 84247 H2 WAT 3642 16.316 74.608 56.699 1.00 0.00 H TER 84249 WAT 3642 ATOM 84249 O WAT 3643 71.439 125.890 68.159 1.00 0.00 O ATOM 84250 H1 WAT 3643 72.214 126.212 68.620 1.00 0.00 H ATOM 84251 H2 WAT 3643 70.798 125.730 68.852 1.00 0.00 H TER 84253 WAT 3643 ATOM 84253 O WAT 3644 1.341 75.719 82.599 1.00 0.00 O ATOM 84254 H1 WAT 3644 1.794 75.409 83.383 1.00 0.00 H ATOM 84255 H2 WAT 3644 0.469 75.329 82.655 1.00 0.00 H TER 84257 WAT 3644 ATOM 84257 O WAT 3645 71.946 130.884 128.744 1.00 0.00 O ATOM 84258 H1 WAT 3645 72.573 130.265 129.117 1.00 0.00 H ATOM 84259 H2 WAT 3645 71.282 130.992 129.425 1.00 0.00 H TER 84261 WAT 3645 ATOM 84261 O WAT 3646 27.987 37.299 2.246 1.00 0.00 O ATOM 84262 H1 WAT 3646 28.412 37.347 1.390 1.00 0.00 H ATOM 84263 H2 WAT 3646 27.288 36.656 2.130 1.00 0.00 H TER 84265 WAT 3646 ATOM 84265 O WAT 3647 36.442 9.181 147.209 1.00 0.00 O ATOM 84266 H1 WAT 3647 36.562 9.994 146.719 1.00 0.00 H ATOM 84267 H2 WAT 3647 35.999 9.450 148.014 1.00 0.00 H TER 84269 WAT 3647 ATOM 84269 O WAT 3648 116.247 5.426 5.389 1.00 0.00 O ATOM 84270 H1 WAT 3648 115.357 5.201 5.117 1.00 0.00 H ATOM 84271 H2 WAT 3648 116.326 6.361 5.199 1.00 0.00 H TER 84273 WAT 3648 ATOM 84273 O WAT 3649 11.346 138.601 127.146 1.00 0.00 O ATOM 84274 H1 WAT 3649 10.679 138.389 126.493 1.00 0.00 H ATOM 84275 H2 WAT 3649 11.130 138.048 127.897 1.00 0.00 H TER 84277 WAT 3649 ATOM 84277 O WAT 3650 132.885 77.691 92.752 1.00 0.00 O ATOM 84278 H1 WAT 3650 133.550 77.101 93.107 1.00 0.00 H ATOM 84279 H2 WAT 3650 132.167 77.649 93.383 1.00 0.00 H TER 84281 WAT 3650 ATOM 84281 O WAT 3651 107.660 97.784 2.713 1.00 0.00 O ATOM 84282 H1 WAT 3651 107.037 98.442 2.402 1.00 0.00 H ATOM 84283 H2 WAT 3651 107.366 96.967 2.309 1.00 0.00 H TER 84285 WAT 3651 ATOM 84285 O WAT 3652 143.883 115.920 142.416 1.00 0.00 O ATOM 84286 H1 WAT 3652 144.779 116.245 142.508 1.00 0.00 H ATOM 84287 H2 WAT 3652 143.876 115.476 141.568 1.00 0.00 H TER 84289 WAT 3652 ATOM 84289 O WAT 3653 110.150 93.323 111.157 1.00 0.00 O ATOM 84290 H1 WAT 3653 110.851 93.216 111.800 1.00 0.00 H ATOM 84291 H2 WAT 3653 110.583 93.211 110.310 1.00 0.00 H TER 84293 WAT 3653 ATOM 84293 O WAT 3654 72.589 143.078 96.293 1.00 0.00 O ATOM 84294 H1 WAT 3654 73.272 143.030 96.961 1.00 0.00 H ATOM 84295 H2 WAT 3654 72.935 143.687 95.640 1.00 0.00 H TER 84297 WAT 3654 ATOM 84297 O WAT 3655 90.824 89.582 130.593 1.00 0.00 O ATOM 84298 H1 WAT 3655 90.146 90.221 130.811 1.00 0.00 H ATOM 84299 H2 WAT 3655 91.596 90.111 130.392 1.00 0.00 H TER 84301 WAT 3655 ATOM 84301 O WAT 3656 129.708 41.131 79.561 1.00 0.00 O ATOM 84302 H1 WAT 3656 129.924 41.778 78.889 1.00 0.00 H ATOM 84303 H2 WAT 3656 129.677 40.298 79.091 1.00 0.00 H TER 84305 WAT 3656 ATOM 84305 O WAT 3657 87.483 85.648 102.105 1.00 0.00 O ATOM 84306 H1 WAT 3657 87.758 86.495 101.754 1.00 0.00 H ATOM 84307 H2 WAT 3657 87.223 85.142 101.335 1.00 0.00 H TER 84309 WAT 3657 ATOM 84309 O WAT 3658 62.817 84.590 157.865 1.00 0.00 O ATOM 84310 H1 WAT 3658 63.092 83.965 157.194 1.00 0.00 H ATOM 84311 H2 WAT 3658 63.093 85.442 157.528 1.00 0.00 H TER 84313 WAT 3658 ATOM 84313 O WAT 3659 135.450 85.472 130.486 1.00 0.00 O ATOM 84314 H1 WAT 3659 135.134 86.262 130.048 1.00 0.00 H ATOM 84315 H2 WAT 3659 134.846 84.785 130.207 1.00 0.00 H TER 84317 WAT 3659 ATOM 84317 O WAT 3660 39.438 15.076 158.050 1.00 0.00 O ATOM 84318 H1 WAT 3660 39.508 15.963 157.696 1.00 0.00 H ATOM 84319 H2 WAT 3660 39.974 15.092 158.843 1.00 0.00 H TER 84321 WAT 3660 ATOM 84321 O WAT 3661 98.973 39.404 123.364 1.00 0.00 O ATOM 84322 H1 WAT 3661 99.418 38.840 123.995 1.00 0.00 H ATOM 84323 H2 WAT 3661 99.646 39.618 122.717 1.00 0.00 H TER 84325 WAT 3661 ATOM 84325 O WAT 3662 3.844 89.155 74.877 1.00 0.00 O ATOM 84326 H1 WAT 3662 4.124 88.751 74.055 1.00 0.00 H ATOM 84327 H2 WAT 3662 3.826 88.433 75.504 1.00 0.00 H TER 84329 WAT 3662 ATOM 84329 O WAT 3663 66.750 35.167 67.988 1.00 0.00 O ATOM 84330 H1 WAT 3663 66.747 35.357 68.926 1.00 0.00 H ATOM 84331 H2 WAT 3663 67.357 35.808 67.616 1.00 0.00 H TER 84333 WAT 3663 ATOM 84333 O WAT 3664 85.480 81.231 112.397 1.00 0.00 O ATOM 84334 H1 WAT 3664 85.356 80.864 113.272 1.00 0.00 H ATOM 84335 H2 WAT 3664 85.761 82.132 112.552 1.00 0.00 H TER 84337 WAT 3664 ATOM 84337 O WAT 3665 109.708 91.045 6.740 1.00 0.00 O ATOM 84338 H1 WAT 3665 109.697 90.631 7.603 1.00 0.00 H ATOM 84339 H2 WAT 3665 110.128 91.893 6.886 1.00 0.00 H TER 84341 WAT 3665 ATOM 84341 O WAT 3666 138.459 23.356 63.882 1.00 0.00 O ATOM 84342 H1 WAT 3666 138.277 22.896 63.061 1.00 0.00 H ATOM 84343 H2 WAT 3666 138.263 24.273 63.691 1.00 0.00 H TER 84345 WAT 3666 ATOM 84345 O WAT 3667 42.694 66.620 89.987 1.00 0.00 O ATOM 84346 H1 WAT 3667 43.114 67.112 89.281 1.00 0.00 H ATOM 84347 H2 WAT 3667 43.261 65.861 90.121 1.00 0.00 H TER 84349 WAT 3667 ATOM 84349 O WAT 3668 73.478 16.788 18.870 1.00 0.00 O ATOM 84350 H1 WAT 3668 74.108 17.344 19.327 1.00 0.00 H ATOM 84351 H2 WAT 3668 72.856 16.523 19.548 1.00 0.00 H TER 84353 WAT 3668 ATOM 84353 O WAT 3669 129.046 62.900 127.489 1.00 0.00 O ATOM 84354 H1 WAT 3669 128.970 63.849 127.589 1.00 0.00 H ATOM 84355 H2 WAT 3669 128.145 62.581 127.540 1.00 0.00 H TER 84357 WAT 3669 ATOM 84357 O WAT 3670 70.706 117.978 56.891 1.00 0.00 O ATOM 84358 H1 WAT 3670 69.752 118.055 56.889 1.00 0.00 H ATOM 84359 H2 WAT 3670 70.871 117.047 57.041 1.00 0.00 H TER 84361 WAT 3670 ATOM 84361 O WAT 3671 94.636 41.785 11.606 1.00 0.00 O ATOM 84362 H1 WAT 3671 94.602 40.901 11.973 1.00 0.00 H ATOM 84363 H2 WAT 3671 93.744 41.951 11.301 1.00 0.00 H TER 84365 WAT 3671 ATOM 84365 O WAT 3672 85.410 114.265 127.542 1.00 0.00 O ATOM 84366 H1 WAT 3672 84.588 114.577 127.920 1.00 0.00 H ATOM 84367 H2 WAT 3672 85.542 113.402 127.936 1.00 0.00 H TER 84369 WAT 3672 ATOM 84369 O WAT 3673 59.096 21.982 14.900 1.00 0.00 O ATOM 84370 H1 WAT 3673 58.612 22.424 14.203 1.00 0.00 H ATOM 84371 H2 WAT 3673 58.418 21.644 15.485 1.00 0.00 H TER 84373 WAT 3673 ATOM 84373 O WAT 3674 15.848 133.816 97.680 1.00 0.00 O ATOM 84374 H1 WAT 3674 16.093 132.935 97.397 1.00 0.00 H ATOM 84375 H2 WAT 3674 16.382 134.399 97.140 1.00 0.00 H TER 84377 WAT 3674 ATOM 84377 O WAT 3675 143.536 66.206 101.175 1.00 0.00 O ATOM 84378 H1 WAT 3675 144.359 66.687 101.259 1.00 0.00 H ATOM 84379 H2 WAT 3675 143.514 65.633 101.941 1.00 0.00 H TER 84381 WAT 3675 ATOM 84381 O WAT 3676 28.726 129.333 148.876 1.00 0.00 O ATOM 84382 H1 WAT 3676 28.163 128.580 149.056 1.00 0.00 H ATOM 84383 H2 WAT 3676 28.782 129.366 147.921 1.00 0.00 H TER 84385 WAT 3676 ATOM 84385 O WAT 3677 35.820 69.366 16.139 1.00 0.00 O ATOM 84386 H1 WAT 3677 34.912 69.263 16.426 1.00 0.00 H ATOM 84387 H2 WAT 3677 35.774 69.337 15.183 1.00 0.00 H TER 84389 WAT 3677 ATOM 84389 O WAT 3678 131.441 40.401 2.792 1.00 0.00 O ATOM 84390 H1 WAT 3678 130.927 39.780 3.308 1.00 0.00 H ATOM 84391 H2 WAT 3678 130.792 40.991 2.410 1.00 0.00 H TER 84393 WAT 3678 ATOM 84393 O WAT 3679 99.944 24.293 91.570 1.00 0.00 O ATOM 84394 H1 WAT 3679 99.834 24.481 90.638 1.00 0.00 H ATOM 84395 H2 WAT 3679 100.739 23.760 91.614 1.00 0.00 H TER 84397 WAT 3679 ATOM 84397 O WAT 3680 96.879 126.893 115.938 1.00 0.00 O ATOM 84398 H1 WAT 3680 97.785 127.089 116.176 1.00 0.00 H ATOM 84399 H2 WAT 3680 96.947 126.386 115.129 1.00 0.00 H TER 84401 WAT 3680 ATOM 84401 O WAT 3681 2.458 106.734 142.580 1.00 0.00 O ATOM 84402 H1 WAT 3681 2.800 106.001 142.069 1.00 0.00 H ATOM 84403 H2 WAT 3681 2.679 106.519 143.486 1.00 0.00 H TER 84405 WAT 3681 ATOM 84405 O WAT 3682 59.131 0.655 140.581 1.00 0.00 O ATOM 84406 H1 WAT 3682 59.976 0.662 140.131 1.00 0.00 H ATOM 84407 H2 WAT 3682 58.918 -0.273 140.677 1.00 0.00 H TER 84409 WAT 3682 ATOM 84409 O WAT 3683 45.590 37.566 18.869 1.00 0.00 O ATOM 84410 H1 WAT 3683 46.318 37.039 18.541 1.00 0.00 H ATOM 84411 H2 WAT 3683 45.570 37.388 19.809 1.00 0.00 H TER 84413 WAT 3683 ATOM 84413 O WAT 3684 46.878 35.259 1.368 1.00 0.00 O ATOM 84414 H1 WAT 3684 47.346 34.427 1.303 1.00 0.00 H ATOM 84415 H2 WAT 3684 46.177 35.091 1.997 1.00 0.00 H TER 84417 WAT 3684 ATOM 84417 O WAT 3685 46.575 117.445 141.161 1.00 0.00 O ATOM 84418 H1 WAT 3685 46.201 117.052 141.950 1.00 0.00 H ATOM 84419 H2 WAT 3685 45.864 117.975 140.798 1.00 0.00 H TER 84421 WAT 3685 ATOM 84421 O WAT 3686 69.950 101.045 113.878 1.00 0.00 O ATOM 84422 H1 WAT 3686 69.287 101.736 113.886 1.00 0.00 H ATOM 84423 H2 WAT 3686 69.618 100.388 114.490 1.00 0.00 H TER 84425 WAT 3686 ATOM 84425 O WAT 3687 97.950 111.096 65.355 1.00 0.00 O ATOM 84426 H1 WAT 3687 98.675 110.561 65.031 1.00 0.00 H ATOM 84427 H2 WAT 3687 98.324 111.971 65.455 1.00 0.00 H TER 84429 WAT 3687 ATOM 84429 O WAT 3688 133.776 41.508 16.583 1.00 0.00 O ATOM 84430 H1 WAT 3688 133.850 42.196 15.922 1.00 0.00 H ATOM 84431 H2 WAT 3688 134.552 40.964 16.451 1.00 0.00 H TER 84433 WAT 3688 ATOM 84433 O WAT 3689 9.271 96.080 62.056 1.00 0.00 O ATOM 84434 H1 WAT 3689 9.978 95.979 62.693 1.00 0.00 H ATOM 84435 H2 WAT 3689 8.472 96.076 62.583 1.00 0.00 H TER 84437 WAT 3689 ATOM 84437 O WAT 3690 91.703 104.542 156.259 1.00 0.00 O ATOM 84438 H1 WAT 3690 91.282 103.837 156.752 1.00 0.00 H ATOM 84439 H2 WAT 3690 92.345 104.096 155.706 1.00 0.00 H TER 84441 WAT 3690 ATOM 84441 O WAT 3691 127.453 25.679 117.188 1.00 0.00 O ATOM 84442 H1 WAT 3691 128.087 25.002 116.951 1.00 0.00 H ATOM 84443 H2 WAT 3691 127.888 26.502 116.968 1.00 0.00 H TER 84445 WAT 3691 ATOM 84445 O WAT 3692 61.406 30.342 94.347 1.00 0.00 O ATOM 84446 H1 WAT 3692 61.729 29.454 94.196 1.00 0.00 H ATOM 84447 H2 WAT 3692 61.867 30.878 93.702 1.00 0.00 H TER 84449 WAT 3692 ATOM 84449 O WAT 3693 3.730 6.182 158.629 1.00 0.00 O ATOM 84450 H1 WAT 3693 3.859 6.359 157.697 1.00 0.00 H ATOM 84451 H2 WAT 3693 4.461 5.612 158.867 1.00 0.00 H TER 84453 WAT 3693 ATOM 84453 O WAT 3694 119.013 73.425 114.402 1.00 0.00 O ATOM 84454 H1 WAT 3694 118.181 73.795 114.696 1.00 0.00 H ATOM 84455 H2 WAT 3694 118.884 72.478 114.447 1.00 0.00 H TER 84457 WAT 3694 ATOM 84457 O WAT 3695 89.948 95.158 7.673 1.00 0.00 O ATOM 84458 H1 WAT 3695 90.159 95.531 6.817 1.00 0.00 H ATOM 84459 H2 WAT 3695 89.779 94.233 7.496 1.00 0.00 H TER 84461 WAT 3695 ATOM 84461 O WAT 3696 109.640 50.211 111.191 1.00 0.00 O ATOM 84462 H1 WAT 3696 109.114 49.412 111.177 1.00 0.00 H ATOM 84463 H2 WAT 3696 109.427 50.623 112.029 1.00 0.00 H TER 84465 WAT 3696 ATOM 84465 O WAT 3697 84.002 55.939 78.761 1.00 0.00 O ATOM 84466 H1 WAT 3697 83.056 56.031 78.644 1.00 0.00 H ATOM 84467 H2 WAT 3697 84.381 56.585 78.165 1.00 0.00 H TER 84469 WAT 3697 ATOM 84469 O WAT 3698 21.814 138.925 62.260 1.00 0.00 O ATOM 84470 H1 WAT 3698 22.668 138.788 61.849 1.00 0.00 H ATOM 84471 H2 WAT 3698 21.784 139.864 62.442 1.00 0.00 H TER 84473 WAT 3698 ATOM 84473 O WAT 3699 63.781 134.034 82.945 1.00 0.00 O ATOM 84474 H1 WAT 3699 64.620 134.231 83.361 1.00 0.00 H ATOM 84475 H2 WAT 3699 63.814 133.094 82.771 1.00 0.00 H TER 84477 WAT 3699 ATOM 84477 O WAT 3700 54.407 104.142 86.429 1.00 0.00 O ATOM 84478 H1 WAT 3700 55.032 104.126 87.153 1.00 0.00 H ATOM 84479 H2 WAT 3700 53.757 104.795 86.688 1.00 0.00 H TER 84481 WAT 3700 ATOM 84481 O WAT 3701 23.159 77.218 143.794 1.00 0.00 O ATOM 84482 H1 WAT 3701 22.708 76.911 143.007 1.00 0.00 H ATOM 84483 H2 WAT 3701 22.534 77.068 144.502 1.00 0.00 H TER 84485 WAT 3701 ATOM 84485 O WAT 3702 82.149 44.814 0.234 1.00 0.00 O ATOM 84486 H1 WAT 3702 82.294 44.538 1.139 1.00 0.00 H ATOM 84487 H2 WAT 3702 82.694 45.595 0.131 1.00 0.00 H TER 84489 WAT 3702 ATOM 84489 O WAT 3703 142.557 8.681 136.100 1.00 0.00 O ATOM 84490 H1 WAT 3703 143.029 7.866 135.929 1.00 0.00 H ATOM 84491 H2 WAT 3703 142.629 9.176 135.284 1.00 0.00 H TER 84493 WAT 3703 ATOM 84493 O WAT 3704 115.353 92.608 134.034 1.00 0.00 O ATOM 84494 H1 WAT 3704 115.574 93.534 134.134 1.00 0.00 H ATOM 84495 H2 WAT 3704 116.192 92.152 134.106 1.00 0.00 H TER 84497 WAT 3704 ATOM 84497 O WAT 3705 4.075 98.909 124.291 1.00 0.00 O ATOM 84498 H1 WAT 3705 3.373 98.425 123.856 1.00 0.00 H ATOM 84499 H2 WAT 3705 4.874 98.617 123.853 1.00 0.00 H TER 84501 WAT 3705 ATOM 84501 O WAT 3706 115.816 61.343 128.583 1.00 0.00 O ATOM 84502 H1 WAT 3706 115.908 61.912 127.819 1.00 0.00 H ATOM 84503 H2 WAT 3706 116.712 61.200 128.886 1.00 0.00 H TER 84505 WAT 3706 ATOM 84505 O WAT 3707 131.555 35.034 121.011 1.00 0.00 O ATOM 84506 H1 WAT 3707 131.062 34.427 121.563 1.00 0.00 H ATOM 84507 H2 WAT 3707 132.392 35.144 121.462 1.00 0.00 H TER 84509 WAT 3707 ATOM 84509 O WAT 3708 80.227 129.627 80.450 1.00 0.00 O ATOM 84510 H1 WAT 3708 79.574 130.257 80.754 1.00 0.00 H ATOM 84511 H2 WAT 3708 80.739 129.417 81.230 1.00 0.00 H TER 84513 WAT 3708 ATOM 84513 O WAT 3709 107.873 66.551 17.630 1.00 0.00 O ATOM 84514 H1 WAT 3709 108.098 65.653 17.384 1.00 0.00 H ATOM 84515 H2 WAT 3709 108.604 66.838 18.179 1.00 0.00 H TER 84517 WAT 3709 ATOM 84517 O WAT 3710 70.874 0.983 110.863 1.00 0.00 O ATOM 84518 H1 WAT 3710 70.740 1.595 111.587 1.00 0.00 H ATOM 84519 H2 WAT 3710 71.719 0.574 111.050 1.00 0.00 H TER 84521 WAT 3710 ATOM 84521 O WAT 3711 143.282 143.937 155.819 1.00 0.00 O ATOM 84522 H1 WAT 3711 143.933 143.343 156.192 1.00 0.00 H ATOM 84523 H2 WAT 3711 143.179 144.623 156.479 1.00 0.00 H TER 84525 WAT 3711 ATOM 84525 O WAT 3712 118.173 138.051 2.048 1.00 0.00 O ATOM 84526 H1 WAT 3712 117.681 138.150 1.233 1.00 0.00 H ATOM 84527 H2 WAT 3712 117.749 137.320 2.497 1.00 0.00 H TER 84529 WAT 3712 ATOM 84529 O WAT 3713 2.023 75.111 65.178 1.00 0.00 O ATOM 84530 H1 WAT 3713 1.764 74.200 65.314 1.00 0.00 H ATOM 84531 H2 WAT 3713 1.306 75.623 65.555 1.00 0.00 H TER 84533 WAT 3713 ATOM 84533 O WAT 3714 139.466 67.836 124.029 1.00 0.00 O ATOM 84534 H1 WAT 3714 138.909 68.580 124.255 1.00 0.00 H ATOM 84535 H2 WAT 3714 138.860 67.100 123.941 1.00 0.00 H TER 84537 WAT 3714 ATOM 84537 O WAT 3715 95.672 121.391 96.535 1.00 0.00 O ATOM 84538 H1 WAT 3715 95.531 120.757 97.237 1.00 0.00 H ATOM 84539 H2 WAT 3715 96.316 120.976 95.962 1.00 0.00 H TER 84541 WAT 3715 ATOM 84541 O WAT 3716 89.481 62.312 134.515 1.00 0.00 O ATOM 84542 H1 WAT 3716 88.705 62.101 135.034 1.00 0.00 H ATOM 84543 H2 WAT 3716 90.190 62.370 135.156 1.00 0.00 H TER 84545 WAT 3716 ATOM 84545 O WAT 3717 76.642 22.862 74.975 1.00 0.00 O ATOM 84546 H1 WAT 3717 76.179 23.590 74.562 1.00 0.00 H ATOM 84547 H2 WAT 3717 76.814 23.162 75.868 1.00 0.00 H TER 84549 WAT 3717 ATOM 84549 O WAT 3718 42.581 18.757 156.713 1.00 0.00 O ATOM 84550 H1 WAT 3718 43.315 18.506 156.152 1.00 0.00 H ATOM 84551 H2 WAT 3718 42.984 18.960 157.558 1.00 0.00 H TER 84553 WAT 3718 ATOM 84553 O WAT 3719 90.982 26.661 59.479 1.00 0.00 O ATOM 84554 H1 WAT 3719 90.730 25.794 59.161 1.00 0.00 H ATOM 84555 H2 WAT 3719 90.447 27.269 58.969 1.00 0.00 H TER 84557 WAT 3719 ATOM 84557 O WAT 3720 59.313 53.329 136.253 1.00 0.00 O ATOM 84558 H1 WAT 3720 59.223 54.281 136.211 1.00 0.00 H ATOM 84559 H2 WAT 3720 60.098 53.140 135.739 1.00 0.00 H TER 84561 WAT 3720 ATOM 84561 O WAT 3721 58.361 101.130 135.693 1.00 0.00 O ATOM 84562 H1 WAT 3721 58.554 100.590 136.460 1.00 0.00 H ATOM 84563 H2 WAT 3721 57.954 100.526 135.072 1.00 0.00 H TER 84565 WAT 3721 ATOM 84565 O WAT 3722 79.573 129.178 150.626 1.00 0.00 O ATOM 84566 H1 WAT 3722 79.050 129.971 150.746 1.00 0.00 H ATOM 84567 H2 WAT 3722 79.041 128.624 150.055 1.00 0.00 H TER 84569 WAT 3722 ATOM 84569 O WAT 3723 120.430 133.958 110.900 1.00 0.00 O ATOM 84570 H1 WAT 3723 120.564 134.101 111.837 1.00 0.00 H ATOM 84571 H2 WAT 3723 120.635 134.802 110.498 1.00 0.00 H TER 84573 WAT 3723 ATOM 84573 O WAT 3724 2.703 143.260 109.238 1.00 0.00 O ATOM 84574 H1 WAT 3724 2.138 143.982 108.961 1.00 0.00 H ATOM 84575 H2 WAT 3724 3.547 143.672 109.421 1.00 0.00 H TER 84577 WAT 3724 ATOM 84577 O WAT 3725 110.500 3.617 142.440 1.00 0.00 O ATOM 84578 H1 WAT 3725 110.098 2.748 142.444 1.00 0.00 H ATOM 84579 H2 WAT 3725 111.059 3.626 143.217 1.00 0.00 H TER 84581 WAT 3725 ATOM 84581 O WAT 3726 100.624 72.986 111.714 1.00 0.00 O ATOM 84582 H1 WAT 3726 100.193 72.241 112.135 1.00 0.00 H ATOM 84583 H2 WAT 3726 101.216 72.590 111.075 1.00 0.00 H TER 84585 WAT 3726 ATOM 84585 O WAT 3727 136.329 111.972 14.538 1.00 0.00 O ATOM 84586 H1 WAT 3727 136.426 111.059 14.807 1.00 0.00 H ATOM 84587 H2 WAT 3727 136.965 112.448 15.072 1.00 0.00 H TER 84589 WAT 3727 ATOM 84589 O WAT 3728 73.503 42.150 17.864 1.00 0.00 O ATOM 84590 H1 WAT 3728 73.251 41.352 17.400 1.00 0.00 H ATOM 84591 H2 WAT 3728 72.956 42.154 18.649 1.00 0.00 H TER 84593 WAT 3728 ATOM 84593 O WAT 3729 46.158 86.356 101.758 1.00 0.00 O ATOM 84594 H1 WAT 3729 46.595 85.571 102.089 1.00 0.00 H ATOM 84595 H2 WAT 3729 46.202 86.271 100.806 1.00 0.00 H TER 84597 WAT 3729 ATOM 84597 O WAT 3730 48.105 54.395 91.745 1.00 0.00 O ATOM 84598 H1 WAT 3730 48.195 53.522 92.126 1.00 0.00 H ATOM 84599 H2 WAT 3730 47.162 54.514 91.639 1.00 0.00 H TER 84601 WAT 3730 ATOM 84601 O WAT 3731 56.315 34.395 133.874 1.00 0.00 O ATOM 84602 H1 WAT 3731 57.188 34.043 134.048 1.00 0.00 H ATOM 84603 H2 WAT 3731 55.730 33.858 134.409 1.00 0.00 H TER 84605 WAT 3731 ATOM 84605 O WAT 3732 84.807 142.214 139.408 1.00 0.00 O ATOM 84606 H1 WAT 3732 85.480 142.782 139.783 1.00 0.00 H ATOM 84607 H2 WAT 3732 83.980 142.619 139.669 1.00 0.00 H TER 84609 WAT 3732 ATOM 84609 O WAT 3733 24.113 29.785 91.230 1.00 0.00 O ATOM 84610 H1 WAT 3733 24.885 30.325 91.403 1.00 0.00 H ATOM 84611 H2 WAT 3733 24.296 28.957 91.674 1.00 0.00 H TER 84613 WAT 3733 ATOM 84613 O WAT 3734 88.660 105.769 68.886 1.00 0.00 O ATOM 84614 H1 WAT 3734 88.879 105.295 69.689 1.00 0.00 H ATOM 84615 H2 WAT 3734 88.527 105.083 68.232 1.00 0.00 H TER 84617 WAT 3734 ATOM 84617 O WAT 3735 44.735 113.567 85.368 1.00 0.00 O ATOM 84618 H1 WAT 3735 45.111 114.439 85.493 1.00 0.00 H ATOM 84619 H2 WAT 3735 44.522 113.529 84.435 1.00 0.00 H TER 84621 WAT 3735 ATOM 84621 O WAT 3736 94.954 0.247 107.810 1.00 0.00 O ATOM 84622 H1 WAT 3736 94.247 0.882 107.925 1.00 0.00 H ATOM 84623 H2 WAT 3736 94.528 -0.605 107.902 1.00 0.00 H TER 84625 WAT 3736 ATOM 84625 O WAT 3737 4.886 83.632 73.562 1.00 0.00 O ATOM 84626 H1 WAT 3737 5.789 83.408 73.338 1.00 0.00 H ATOM 84627 H2 WAT 3737 4.392 83.472 72.758 1.00 0.00 H TER 84629 WAT 3737 ATOM 84629 O WAT 3738 2.376 67.042 117.766 1.00 0.00 O ATOM 84630 H1 WAT 3738 1.439 67.142 117.931 1.00 0.00 H ATOM 84631 H2 WAT 3738 2.442 66.927 116.818 1.00 0.00 H TER 84633 WAT 3738 ATOM 84633 O WAT 3739 87.177 60.272 110.133 1.00 0.00 O ATOM 84634 H1 WAT 3739 86.560 60.222 109.403 1.00 0.00 H ATOM 84635 H2 WAT 3739 87.636 61.102 110.004 1.00 0.00 H TER 84637 WAT 3739 ATOM 84637 O WAT 3740 24.340 50.880 116.616 1.00 0.00 O ATOM 84638 H1 WAT 3740 24.395 50.056 117.101 1.00 0.00 H ATOM 84639 H2 WAT 3740 24.975 50.782 115.906 1.00 0.00 H TER 84641 WAT 3740 ATOM 84641 O WAT 3741 10.282 132.609 144.012 1.00 0.00 O ATOM 84642 H1 WAT 3741 10.125 133.290 144.667 1.00 0.00 H ATOM 84643 H2 WAT 3741 10.298 133.079 143.178 1.00 0.00 H TER 84645 WAT 3741 ATOM 84645 O WAT 3742 8.969 83.731 4.345 1.00 0.00 O ATOM 84646 H1 WAT 3742 8.099 83.385 4.543 1.00 0.00 H ATOM 84647 H2 WAT 3742 8.801 84.577 3.929 1.00 0.00 H TER 84649 WAT 3742 ATOM 84649 O WAT 3743 34.163 82.514 114.228 1.00 0.00 O ATOM 84650 H1 WAT 3743 35.087 82.263 114.199 1.00 0.00 H ATOM 84651 H2 WAT 3743 33.976 82.837 113.346 1.00 0.00 H TER 84653 WAT 3743 ATOM 84653 O WAT 3744 14.430 108.321 8.307 1.00 0.00 O ATOM 84654 H1 WAT 3744 15.292 108.447 7.909 1.00 0.00 H ATOM 84655 H2 WAT 3744 14.486 107.466 8.734 1.00 0.00 H TER 84657 WAT 3744 ATOM 84657 O WAT 3745 140.604 69.458 157.241 1.00 0.00 O ATOM 84658 H1 WAT 3745 140.930 70.272 157.624 1.00 0.00 H ATOM 84659 H2 WAT 3745 139.738 69.684 156.901 1.00 0.00 H TER 84661 WAT 3745 ATOM 84661 O WAT 3746 0.876 18.989 13.278 1.00 0.00 O ATOM 84662 H1 WAT 3746 1.529 18.468 13.745 1.00 0.00 H ATOM 84663 H2 WAT 3746 1.139 19.897 13.434 1.00 0.00 H TER 84665 WAT 3746 ATOM 84665 O WAT 3747 77.554 145.472 80.982 1.00 0.00 O ATOM 84666 H1 WAT 3747 76.929 145.214 80.304 1.00 0.00 H ATOM 84667 H2 WAT 3747 77.447 146.420 81.058 1.00 0.00 H TER 84669 WAT 3747 ATOM 84669 O WAT 3748 110.550 68.315 80.126 1.00 0.00 O ATOM 84670 H1 WAT 3748 111.398 68.665 79.852 1.00 0.00 H ATOM 84671 H2 WAT 3748 110.699 67.996 81.016 1.00 0.00 H TER 84673 WAT 3748 ATOM 84673 O WAT 3749 39.158 128.615 153.424 1.00 0.00 O ATOM 84674 H1 WAT 3749 39.665 128.417 152.636 1.00 0.00 H ATOM 84675 H2 WAT 3749 38.385 129.078 153.101 1.00 0.00 H TER 84677 WAT 3749 ATOM 84677 O WAT 3750 75.430 28.287 106.985 1.00 0.00 O ATOM 84678 H1 WAT 3750 76.307 28.378 107.357 1.00 0.00 H ATOM 84679 H2 WAT 3750 75.165 27.396 107.211 1.00 0.00 H TER 84681 WAT 3750 ATOM 84681 O WAT 3751 99.331 16.311 150.770 1.00 0.00 O ATOM 84682 H1 WAT 3751 98.991 16.206 151.659 1.00 0.00 H ATOM 84683 H2 WAT 3751 99.278 15.435 150.389 1.00 0.00 H TER 84685 WAT 3751 ATOM 84685 O WAT 3752 58.763 98.498 92.663 1.00 0.00 O ATOM 84686 H1 WAT 3752 58.302 99.064 93.282 1.00 0.00 H ATOM 84687 H2 WAT 3752 58.348 98.678 91.820 1.00 0.00 H TER 84689 WAT 3752 ATOM 84689 O WAT 3753 107.138 88.145 12.336 1.00 0.00 O ATOM 84690 H1 WAT 3753 106.335 87.635 12.447 1.00 0.00 H ATOM 84691 H2 WAT 3753 106.896 89.033 12.598 1.00 0.00 H TER 84693 WAT 3753 ATOM 84693 O WAT 3754 103.079 132.168 131.442 1.00 0.00 O ATOM 84694 H1 WAT 3754 103.545 131.607 130.822 1.00 0.00 H ATOM 84695 H2 WAT 3754 102.783 131.572 132.130 1.00 0.00 H TER 84697 WAT 3754 ATOM 84697 O WAT 3755 98.890 113.716 65.378 1.00 0.00 O ATOM 84698 H1 WAT 3755 99.741 113.699 65.817 1.00 0.00 H ATOM 84699 H2 WAT 3755 99.101 113.705 64.445 1.00 0.00 H TER 84701 WAT 3755 ATOM 84701 O WAT 3756 79.947 104.956 139.191 1.00 0.00 O ATOM 84702 H1 WAT 3756 79.631 104.971 140.094 1.00 0.00 H ATOM 84703 H2 WAT 3756 79.779 105.839 138.864 1.00 0.00 H TER 84705 WAT 3756 ATOM 84705 O WAT 3757 100.040 66.468 132.599 1.00 0.00 O ATOM 84706 H1 WAT 3757 99.150 66.600 132.927 1.00 0.00 H ATOM 84707 H2 WAT 3757 100.043 65.570 132.270 1.00 0.00 H TER 84709 WAT 3757 ATOM 84709 O WAT 3758 138.569 71.874 79.271 1.00 0.00 O ATOM 84710 H1 WAT 3758 139.029 71.615 80.069 1.00 0.00 H ATOM 84711 H2 WAT 3758 138.138 71.074 78.972 1.00 0.00 H TER 84713 WAT 3758 ATOM 84713 O WAT 3759 5.966 138.131 2.621 1.00 0.00 O ATOM 84714 H1 WAT 3759 5.335 138.587 3.179 1.00 0.00 H ATOM 84715 H2 WAT 3759 6.133 138.740 1.901 1.00 0.00 H TER 84717 WAT 3759 ATOM 84717 O WAT 3760 143.694 3.371 4.824 1.00 0.00 O ATOM 84718 H1 WAT 3760 144.588 3.191 4.533 1.00 0.00 H ATOM 84719 H2 WAT 3760 143.487 2.653 5.422 1.00 0.00 H TER 84721 WAT 3760 ATOM 84721 O WAT 3761 15.563 84.154 65.798 1.00 0.00 O ATOM 84722 H1 WAT 3761 15.084 84.173 64.970 1.00 0.00 H ATOM 84723 H2 WAT 3761 15.037 83.590 66.366 1.00 0.00 H TER 84725 WAT 3761 ATOM 84725 O WAT 3762 75.912 17.606 5.576 1.00 0.00 O ATOM 84726 H1 WAT 3762 75.021 17.280 5.452 1.00 0.00 H ATOM 84727 H2 WAT 3762 75.863 18.533 5.343 1.00 0.00 H TER 84729 WAT 3762 ATOM 84729 O WAT 3763 11.874 27.430 24.579 1.00 0.00 O ATOM 84730 H1 WAT 3763 12.508 27.409 23.862 1.00 0.00 H ATOM 84731 H2 WAT 3763 12.208 26.794 25.212 1.00 0.00 H TER 84733 WAT 3763 ATOM 84733 O WAT 3764 41.612 51.390 18.245 1.00 0.00 O ATOM 84734 H1 WAT 3764 41.850 50.491 18.472 1.00 0.00 H ATOM 84735 H2 WAT 3764 40.666 51.430 18.388 1.00 0.00 H TER 84737 WAT 3764 ATOM 84737 O WAT 3765 28.914 100.435 10.354 1.00 0.00 O ATOM 84738 H1 WAT 3765 29.323 100.863 11.107 1.00 0.00 H ATOM 84739 H2 WAT 3765 29.225 99.531 10.395 1.00 0.00 H TER 84741 WAT 3765 ATOM 84741 O WAT 3766 114.319 85.778 19.544 1.00 0.00 O ATOM 84742 H1 WAT 3766 113.956 85.098 18.977 1.00 0.00 H ATOM 84743 H2 WAT 3766 115.057 85.356 19.983 1.00 0.00 H TER 84745 WAT 3766 ATOM 84745 O WAT 3767 106.289 98.348 94.278 1.00 0.00 O ATOM 84746 H1 WAT 3767 107.176 98.061 94.493 1.00 0.00 H ATOM 84747 H2 WAT 3767 105.857 97.562 93.943 1.00 0.00 H TER 84749 WAT 3767 ATOM 84749 O WAT 3768 62.558 21.033 149.108 1.00 0.00 O ATOM 84750 H1 WAT 3768 63.174 21.344 148.444 1.00 0.00 H ATOM 84751 H2 WAT 3768 62.978 21.242 149.942 1.00 0.00 H TER 84753 WAT 3768 ATOM 84753 O WAT 3769 136.708 64.026 100.814 1.00 0.00 O ATOM 84754 H1 WAT 3769 136.066 64.536 100.320 1.00 0.00 H ATOM 84755 H2 WAT 3769 137.169 64.673 101.348 1.00 0.00 H TER 84757 WAT 3769 ATOM 84757 O WAT 3770 101.377 100.411 87.686 1.00 0.00 O ATOM 84758 H1 WAT 3770 101.200 101.196 87.167 1.00 0.00 H ATOM 84759 H2 WAT 3770 101.649 99.756 87.043 1.00 0.00 H TER 84761 WAT 3770 ATOM 84761 O WAT 3771 128.745 84.674 16.390 1.00 0.00 O ATOM 84762 H1 WAT 3771 129.225 84.732 17.216 1.00 0.00 H ATOM 84763 H2 WAT 3771 127.868 84.995 16.599 1.00 0.00 H TER 84765 WAT 3771 ATOM 84765 O WAT 3772 77.858 110.274 62.663 1.00 0.00 O ATOM 84766 H1 WAT 3772 77.928 110.563 63.573 1.00 0.00 H ATOM 84767 H2 WAT 3772 77.287 109.507 62.699 1.00 0.00 H TER 84769 WAT 3772 ATOM 84769 O WAT 3773 102.458 82.540 152.932 1.00 0.00 O ATOM 84770 H1 WAT 3773 103.233 82.308 153.444 1.00 0.00 H ATOM 84771 H2 WAT 3773 102.383 81.842 152.281 1.00 0.00 H TER 84773 WAT 3773 ATOM 84773 O WAT 3774 63.433 140.302 8.855 1.00 0.00 O ATOM 84774 H1 WAT 3774 64.241 140.615 9.260 1.00 0.00 H ATOM 84775 H2 WAT 3774 62.798 140.282 9.571 1.00 0.00 H TER 84777 WAT 3774 ATOM 84777 O WAT 3775 117.242 84.419 112.828 1.00 0.00 O ATOM 84778 H1 WAT 3775 117.580 84.477 113.722 1.00 0.00 H ATOM 84779 H2 WAT 3775 116.941 83.514 112.744 1.00 0.00 H TER 84781 WAT 3775 ATOM 84781 O WAT 3776 120.332 91.479 98.598 1.00 0.00 O ATOM 84782 H1 WAT 3776 121.108 91.457 98.038 1.00 0.00 H ATOM 84783 H2 WAT 3776 120.330 90.629 99.039 1.00 0.00 H TER 84785 WAT 3776 ATOM 84785 O WAT 3777 11.588 98.879 130.716 1.00 0.00 O ATOM 84786 H1 WAT 3777 10.771 98.762 130.232 1.00 0.00 H ATOM 84787 H2 WAT 3777 11.317 98.941 131.632 1.00 0.00 H TER 84789 WAT 3777 ATOM 84789 O WAT 3778 25.368 84.246 139.836 1.00 0.00 O ATOM 84790 H1 WAT 3778 24.426 84.137 139.961 1.00 0.00 H ATOM 84791 H2 WAT 3778 25.488 84.228 138.887 1.00 0.00 H TER 84793 WAT 3778 ATOM 84793 O WAT 3779 90.425 51.425 96.753 1.00 0.00 O ATOM 84794 H1 WAT 3779 91.364 51.316 96.901 1.00 0.00 H ATOM 84795 H2 WAT 3779 90.368 51.913 95.931 1.00 0.00 H TER 84797 WAT 3779 ATOM 84797 O WAT 3780 145.726 123.461 114.066 1.00 0.00 O ATOM 84798 H1 WAT 3780 146.252 123.475 113.267 1.00 0.00 H ATOM 84799 H2 WAT 3780 145.746 122.547 114.350 1.00 0.00 H TER 84801 WAT 3780 ATOM 84801 O WAT 3781 139.426 126.495 127.058 1.00 0.00 O ATOM 84802 H1 WAT 3781 140.253 126.022 127.153 1.00 0.00 H ATOM 84803 H2 WAT 3781 139.647 127.406 127.253 1.00 0.00 H TER 84805 WAT 3781 ATOM 84805 O WAT 3782 5.635 46.859 77.826 1.00 0.00 O ATOM 84806 H1 WAT 3782 6.480 46.490 77.570 1.00 0.00 H ATOM 84807 H2 WAT 3782 5.429 47.488 77.134 1.00 0.00 H TER 84809 WAT 3782 ATOM 84809 O WAT 3783 67.409 18.635 95.684 1.00 0.00 O ATOM 84810 H1 WAT 3783 67.480 18.208 94.830 1.00 0.00 H ATOM 84811 H2 WAT 3783 66.625 18.253 96.078 1.00 0.00 H TER 84813 WAT 3783 ATOM 84813 O WAT 3784 37.630 75.683 117.661 1.00 0.00 O ATOM 84814 H1 WAT 3784 37.296 76.100 116.867 1.00 0.00 H ATOM 84815 H2 WAT 3784 37.891 74.807 117.380 1.00 0.00 H TER 84817 WAT 3784 ATOM 84817 O WAT 3785 104.793 132.470 111.217 1.00 0.00 O ATOM 84818 H1 WAT 3785 103.859 132.286 111.119 1.00 0.00 H ATOM 84819 H2 WAT 3785 104.873 133.407 111.035 1.00 0.00 H TER 84821 WAT 3785 ATOM 84821 O WAT 3786 97.876 95.811 109.612 1.00 0.00 O ATOM 84822 H1 WAT 3786 97.561 95.853 108.710 1.00 0.00 H ATOM 84823 H2 WAT 3786 98.638 96.391 109.626 1.00 0.00 H TER 84825 WAT 3786 ATOM 84825 O WAT 3787 93.407 85.751 112.512 1.00 0.00 O ATOM 84826 H1 WAT 3787 93.047 84.886 112.710 1.00 0.00 H ATOM 84827 H2 WAT 3787 94.334 85.681 112.738 1.00 0.00 H TER 84829 WAT 3787 ATOM 84829 O WAT 3788 16.958 111.542 74.896 1.00 0.00 O ATOM 84830 H1 WAT 3788 16.942 112.373 74.421 1.00 0.00 H ATOM 84831 H2 WAT 3788 17.604 111.675 75.590 1.00 0.00 H TER 84833 WAT 3788 ATOM 84833 O WAT 3789 31.973 30.011 4.816 1.00 0.00 O ATOM 84834 H1 WAT 3789 31.721 30.498 5.601 1.00 0.00 H ATOM 84835 H2 WAT 3789 32.095 29.112 5.120 1.00 0.00 H TER 84837 WAT 3789 ATOM 84837 O WAT 3790 38.628 73.070 117.225 1.00 0.00 O ATOM 84838 H1 WAT 3790 37.887 72.795 117.765 1.00 0.00 H ATOM 84839 H2 WAT 3790 39.307 73.311 117.856 1.00 0.00 H TER 84841 WAT 3790 ATOM 84841 O WAT 3791 45.251 39.553 95.060 1.00 0.00 O ATOM 84842 H1 WAT 3791 45.743 39.581 95.881 1.00 0.00 H ATOM 84843 H2 WAT 3791 45.793 40.039 94.439 1.00 0.00 H TER 84845 WAT 3791 ATOM 84845 O WAT 3792 34.179 140.289 151.360 1.00 0.00 O ATOM 84846 H1 WAT 3792 33.225 140.356 151.378 1.00 0.00 H ATOM 84847 H2 WAT 3792 34.386 139.629 152.021 1.00 0.00 H TER 84849 WAT 3792 ATOM 84849 O WAT 3793 128.479 79.341 93.095 1.00 0.00 O ATOM 84850 H1 WAT 3793 129.055 79.811 92.491 1.00 0.00 H ATOM 84851 H2 WAT 3793 127.703 79.897 93.168 1.00 0.00 H TER 84853 WAT 3793 ATOM 84853 O WAT 3794 11.256 73.191 123.359 1.00 0.00 O ATOM 84854 H1 WAT 3794 10.504 72.852 122.874 1.00 0.00 H ATOM 84855 H2 WAT 3794 11.415 72.538 124.041 1.00 0.00 H TER 84857 WAT 3794 ATOM 84857 O WAT 3795 27.354 1.856 140.131 1.00 0.00 O ATOM 84858 H1 WAT 3795 26.787 1.094 140.242 1.00 0.00 H ATOM 84859 H2 WAT 3795 28.031 1.750 140.799 1.00 0.00 H TER 84861 WAT 3795 ATOM 84861 O WAT 3796 22.941 127.549 147.972 1.00 0.00 O ATOM 84862 H1 WAT 3796 22.028 127.830 147.907 1.00 0.00 H ATOM 84863 H2 WAT 3796 23.026 127.216 148.865 1.00 0.00 H TER 84865 WAT 3796 ATOM 84865 O WAT 3797 40.685 99.642 56.236 1.00 0.00 O ATOM 84866 H1 WAT 3797 40.764 99.490 55.294 1.00 0.00 H ATOM 84867 H2 WAT 3797 39.955 100.256 56.319 1.00 0.00 H TER 84869 WAT 3797 ATOM 84869 O WAT 3798 29.231 91.583 124.634 1.00 0.00 O ATOM 84870 H1 WAT 3798 28.885 91.919 123.807 1.00 0.00 H ATOM 84871 H2 WAT 3798 29.926 92.197 124.869 1.00 0.00 H TER 84873 WAT 3798 ATOM 84873 O WAT 3799 131.791 4.566 139.377 1.00 0.00 O ATOM 84874 H1 WAT 3799 131.285 4.581 138.564 1.00 0.00 H ATOM 84875 H2 WAT 3799 132.603 4.116 139.145 1.00 0.00 H TER 84877 WAT 3799 ATOM 84877 O WAT 3800 0.384 98.060 154.714 1.00 0.00 O ATOM 84878 H1 WAT 3800 0.452 98.587 153.918 1.00 0.00 H ATOM 84879 H2 WAT 3800 0.687 98.641 155.412 1.00 0.00 H TER 84881 WAT 3800 ATOM 84881 O WAT 3801 28.850 52.689 144.575 1.00 0.00 O ATOM 84882 H1 WAT 3801 28.260 52.085 145.026 1.00 0.00 H ATOM 84883 H2 WAT 3801 29.653 52.185 144.445 1.00 0.00 H TER 84885 WAT 3801 ATOM 84885 O WAT 3802 113.621 70.617 69.655 1.00 0.00 O ATOM 84886 H1 WAT 3802 113.975 71.496 69.790 1.00 0.00 H ATOM 84887 H2 WAT 3802 114.376 70.093 69.388 1.00 0.00 H TER 84889 WAT 3802 ATOM 84889 O WAT 3803 76.812 11.529 100.295 1.00 0.00 O ATOM 84890 H1 WAT 3803 77.176 11.053 99.549 1.00 0.00 H ATOM 84891 H2 WAT 3803 76.007 11.923 99.959 1.00 0.00 H TER 84893 WAT 3803 ATOM 84893 O WAT 3804 40.230 76.042 124.870 1.00 0.00 O ATOM 84894 H1 WAT 3804 40.341 76.783 124.274 1.00 0.00 H ATOM 84895 H2 WAT 3804 40.733 76.282 125.648 1.00 0.00 H TER 84897 WAT 3804 ATOM 84897 O WAT 3805 40.007 20.005 79.012 1.00 0.00 O ATOM 84898 H1 WAT 3805 39.389 20.724 78.878 1.00 0.00 H ATOM 84899 H2 WAT 3805 40.122 19.961 79.961 1.00 0.00 H TER 84901 WAT 3805 ATOM 84901 O WAT 3806 67.040 68.688 77.730 1.00 0.00 O ATOM 84902 H1 WAT 3806 67.021 69.381 77.070 1.00 0.00 H ATOM 84903 H2 WAT 3806 67.742 68.945 78.327 1.00 0.00 H TER 84905 WAT 3806 ATOM 84905 O WAT 3807 135.249 60.386 106.897 1.00 0.00 O ATOM 84906 H1 WAT 3807 134.766 60.639 107.683 1.00 0.00 H ATOM 84907 H2 WAT 3807 136.071 60.874 106.952 1.00 0.00 H TER 84909 WAT 3807 ATOM 84909 O WAT 3808 46.234 0.434 93.289 1.00 0.00 O ATOM 84910 H1 WAT 3808 45.903 -0.463 93.311 1.00 0.00 H ATOM 84911 H2 WAT 3808 45.527 0.960 93.664 1.00 0.00 H TER 84913 WAT 3808 ATOM 84913 O WAT 3809 17.519 125.342 68.047 1.00 0.00 O ATOM 84914 H1 WAT 3809 16.699 124.872 68.198 1.00 0.00 H ATOM 84915 H2 WAT 3809 17.666 125.270 67.104 1.00 0.00 H TER 84917 WAT 3809 ATOM 84917 O WAT 3810 93.089 110.120 15.227 1.00 0.00 O ATOM 84918 H1 WAT 3810 92.268 110.572 15.035 1.00 0.00 H ATOM 84919 H2 WAT 3810 93.239 109.561 14.464 1.00 0.00 H TER 84921 WAT 3810 ATOM 84921 O WAT 3811 57.914 45.301 79.320 1.00 0.00 O ATOM 84922 H1 WAT 3811 57.636 46.134 78.939 1.00 0.00 H ATOM 84923 H2 WAT 3811 57.590 45.331 80.221 1.00 0.00 H TER 84925 WAT 3811 ATOM 84925 O WAT 3812 135.274 23.706 74.928 1.00 0.00 O ATOM 84926 H1 WAT 3812 135.843 22.954 75.089 1.00 0.00 H ATOM 84927 H2 WAT 3812 134.839 23.504 74.099 1.00 0.00 H TER 84929 WAT 3812 ATOM 84929 O WAT 3813 0.919 130.703 16.807 1.00 0.00 O ATOM 84930 H1 WAT 3813 1.805 131.007 16.614 1.00 0.00 H ATOM 84931 H2 WAT 3813 0.853 129.858 16.362 1.00 0.00 H TER 84933 WAT 3813 ATOM 84933 O WAT 3814 131.747 138.475 133.244 1.00 0.00 O ATOM 84934 H1 WAT 3814 130.997 139.067 133.192 1.00 0.00 H ATOM 84935 H2 WAT 3814 131.393 137.672 133.627 1.00 0.00 H TER 84937 WAT 3814 ATOM 84937 O WAT 3815 141.777 18.268 111.283 1.00 0.00 O ATOM 84938 H1 WAT 3815 141.696 17.602 110.600 1.00 0.00 H ATOM 84939 H2 WAT 3815 140.913 18.296 111.693 1.00 0.00 H TER 84941 WAT 3815 ATOM 84941 O WAT 3816 19.476 139.147 17.921 1.00 0.00 O ATOM 84942 H1 WAT 3816 19.121 140.035 17.877 1.00 0.00 H ATOM 84943 H2 WAT 3816 18.773 138.591 17.584 1.00 0.00 H TER 84945 WAT 3816 ATOM 84945 O WAT 3817 26.542 24.718 117.079 1.00 0.00 O ATOM 84946 H1 WAT 3817 27.204 24.667 116.390 1.00 0.00 H ATOM 84947 H2 WAT 3817 25.915 25.367 116.761 1.00 0.00 H TER 84949 WAT 3817 ATOM 84949 O WAT 3818 45.755 22.864 69.722 1.00 0.00 O ATOM 84950 H1 WAT 3818 45.654 23.022 70.661 1.00 0.00 H ATOM 84951 H2 WAT 3818 46.397 22.157 69.666 1.00 0.00 H TER 84953 WAT 3818 ATOM 84953 O WAT 3819 142.443 83.341 98.513 1.00 0.00 O ATOM 84954 H1 WAT 3819 142.169 82.426 98.455 1.00 0.00 H ATOM 84955 H2 WAT 3819 141.625 83.832 98.584 1.00 0.00 H TER 84957 WAT 3819 ATOM 84957 O WAT 3820 3.524 143.978 75.893 1.00 0.00 O ATOM 84958 H1 WAT 3820 4.187 143.988 75.204 1.00 0.00 H ATOM 84959 H2 WAT 3820 4.005 143.737 76.685 1.00 0.00 H TER 84961 WAT 3820 ATOM 84961 O WAT 3821 131.816 129.256 65.858 1.00 0.00 O ATOM 84962 H1 WAT 3821 131.981 128.357 65.574 1.00 0.00 H ATOM 84963 H2 WAT 3821 131.663 129.739 65.046 1.00 0.00 H TER 84965 WAT 3821 ATOM 84965 O WAT 3822 80.642 4.198 13.964 1.00 0.00 O ATOM 84966 H1 WAT 3822 80.978 5.006 13.576 1.00 0.00 H ATOM 84967 H2 WAT 3822 80.545 3.600 13.223 1.00 0.00 H TER 84969 WAT 3822 ATOM 84969 O WAT 3823 101.639 12.271 140.663 1.00 0.00 O ATOM 84970 H1 WAT 3823 101.085 12.789 140.080 1.00 0.00 H ATOM 84971 H2 WAT 3823 101.204 12.321 141.515 1.00 0.00 H TER 84973 WAT 3823 ATOM 84973 O WAT 3824 33.365 46.540 65.441 1.00 0.00 O ATOM 84974 H1 WAT 3824 32.858 46.323 66.223 1.00 0.00 H ATOM 84975 H2 WAT 3824 32.921 46.077 64.731 1.00 0.00 H TER 84977 WAT 3824 ATOM 84977 O WAT 3825 108.011 56.447 106.793 1.00 0.00 O ATOM 84978 H1 WAT 3825 107.389 57.109 106.492 1.00 0.00 H ATOM 84979 H2 WAT 3825 107.850 55.692 106.227 1.00 0.00 H TER 84981 WAT 3825 ATOM 84981 O WAT 3826 39.253 79.487 92.070 1.00 0.00 O ATOM 84982 H1 WAT 3826 39.221 80.361 91.682 1.00 0.00 H ATOM 84983 H2 WAT 3826 38.885 78.913 91.398 1.00 0.00 H TER 84985 WAT 3826 ATOM 84985 O WAT 3827 74.740 128.300 158.498 1.00 0.00 O ATOM 84986 H1 WAT 3827 74.184 127.928 159.183 1.00 0.00 H ATOM 84987 H2 WAT 3827 74.778 129.235 158.702 1.00 0.00 H TER 84989 WAT 3827 ATOM 84989 O WAT 3828 76.312 141.700 68.108 1.00 0.00 O ATOM 84990 H1 WAT 3828 76.757 142.397 67.626 1.00 0.00 H ATOM 84991 H2 WAT 3828 76.822 141.601 68.912 1.00 0.00 H TER 84993 WAT 3828 ATOM 84993 O WAT 3829 46.548 16.123 85.259 1.00 0.00 O ATOM 84994 H1 WAT 3829 46.991 16.300 86.089 1.00 0.00 H ATOM 84995 H2 WAT 3829 46.147 16.958 85.019 1.00 0.00 H TER 84997 WAT 3829 ATOM 84997 O WAT 3830 138.134 59.223 109.099 1.00 0.00 O ATOM 84998 H1 WAT 3830 138.062 58.480 108.500 1.00 0.00 H ATOM 84999 H2 WAT 3830 139.073 59.400 109.151 1.00 0.00 H TER 85001 WAT 3830 ATOM 85001 O WAT 3831 133.332 112.364 108.132 1.00 0.00 O ATOM 85002 H1 WAT 3831 132.398 112.495 108.299 1.00 0.00 H ATOM 85003 H2 WAT 3831 133.360 111.768 107.384 1.00 0.00 H TER 85005 WAT 3831 ATOM 85005 O WAT 3832 54.745 82.717 135.906 1.00 0.00 O ATOM 85006 H1 WAT 3832 54.396 82.553 135.030 1.00 0.00 H ATOM 85007 H2 WAT 3832 55.213 83.548 135.826 1.00 0.00 H TER 85009 WAT 3832 ATOM 85009 O WAT 3833 83.407 80.016 83.156 1.00 0.00 O ATOM 85010 H1 WAT 3833 83.731 80.857 83.479 1.00 0.00 H ATOM 85011 H2 WAT 3833 83.724 79.376 83.794 1.00 0.00 H TER 85013 WAT 3833 ATOM 85013 O WAT 3834 0.393 34.709 19.269 1.00 0.00 O ATOM 85014 H1 WAT 3834 -0.333 34.476 19.847 1.00 0.00 H ATOM 85015 H2 WAT 3834 -0.022 34.903 18.429 1.00 0.00 H TER 85017 WAT 3834 ATOM 85017 O WAT 3835 91.329 130.772 110.989 1.00 0.00 O ATOM 85018 H1 WAT 3835 90.779 131.418 111.432 1.00 0.00 H ATOM 85019 H2 WAT 3835 91.490 131.149 110.124 1.00 0.00 H TER 85021 WAT 3835 ATOM 85021 O WAT 3836 75.972 110.571 144.873 1.00 0.00 O ATOM 85022 H1 WAT 3836 75.994 110.481 143.921 1.00 0.00 H ATOM 85023 H2 WAT 3836 76.778 110.149 145.173 1.00 0.00 H TER 85025 WAT 3836 ATOM 85025 O WAT 3837 37.506 2.036 0.591 1.00 0.00 O ATOM 85026 H1 WAT 3837 37.267 2.223 -0.317 1.00 0.00 H ATOM 85027 H2 WAT 3837 38.162 2.699 0.807 1.00 0.00 H TER 85029 WAT 3837 ATOM 85029 O WAT 3838 68.970 135.117 133.332 1.00 0.00 O ATOM 85030 H1 WAT 3838 69.186 135.073 132.401 1.00 0.00 H ATOM 85031 H2 WAT 3838 68.819 136.047 133.499 1.00 0.00 H TER 85033 WAT 3838 ATOM 85033 O WAT 3839 134.409 65.192 141.170 1.00 0.00 O ATOM 85034 H1 WAT 3839 133.759 65.366 141.851 1.00 0.00 H ATOM 85035 H2 WAT 3839 133.901 64.841 140.438 1.00 0.00 H TER 85037 WAT 3839 ATOM 85037 O WAT 3840 98.675 74.059 67.152 1.00 0.00 O ATOM 85038 H1 WAT 3840 99.590 74.186 66.902 1.00 0.00 H ATOM 85039 H2 WAT 3840 98.717 73.526 67.946 1.00 0.00 H TER 85041 WAT 3840 ATOM 85041 O WAT 3841 29.007 16.586 122.746 1.00 0.00 O ATOM 85042 H1 WAT 3841 29.063 17.148 123.519 1.00 0.00 H ATOM 85043 H2 WAT 3841 28.810 17.186 122.027 1.00 0.00 H TER 85045 WAT 3841 ATOM 85045 O WAT 3842 61.668 23.981 8.194 1.00 0.00 O ATOM 85046 H1 WAT 3842 61.401 24.024 9.112 1.00 0.00 H ATOM 85047 H2 WAT 3842 61.324 23.144 7.884 1.00 0.00 H TER 85049 WAT 3842 ATOM 85049 O WAT 3843 30.761 94.124 149.585 1.00 0.00 O ATOM 85050 H1 WAT 3843 30.725 94.825 148.935 1.00 0.00 H ATOM 85051 H2 WAT 3843 30.778 94.578 150.427 1.00 0.00 H TER 85053 WAT 3843 ATOM 85053 O WAT 3844 25.348 134.192 105.647 1.00 0.00 O ATOM 85054 H1 WAT 3844 26.005 133.694 105.161 1.00 0.00 H ATOM 85055 H2 WAT 3844 24.966 134.783 104.998 1.00 0.00 H TER 85057 WAT 3844 ATOM 85057 O WAT 3845 76.764 130.429 107.564 1.00 0.00 O ATOM 85058 H1 WAT 3845 77.381 130.242 108.271 1.00 0.00 H ATOM 85059 H2 WAT 3845 76.606 131.371 107.627 1.00 0.00 H TER 85061 WAT 3845 ATOM 85061 O WAT 3846 120.609 68.335 5.800 1.00 0.00 O ATOM 85062 H1 WAT 3846 120.421 69.244 6.032 1.00 0.00 H ATOM 85063 H2 WAT 3846 121.563 68.271 5.832 1.00 0.00 H TER 85065 WAT 3846 ATOM 85065 O WAT 3847 125.075 34.185 110.944 1.00 0.00 O ATOM 85066 H1 WAT 3847 125.682 34.724 110.436 1.00 0.00 H ATOM 85067 H2 WAT 3847 124.238 34.645 110.882 1.00 0.00 H TER 85069 WAT 3847 ATOM 85069 O WAT 3848 45.904 16.183 121.670 1.00 0.00 O ATOM 85070 H1 WAT 3848 46.164 15.638 122.413 1.00 0.00 H ATOM 85071 H2 WAT 3848 45.023 15.881 121.448 1.00 0.00 H TER 85073 WAT 3848 ATOM 85073 O WAT 3849 70.563 51.871 113.189 1.00 0.00 O ATOM 85074 H1 WAT 3849 69.672 52.123 112.944 1.00 0.00 H ATOM 85075 H2 WAT 3849 70.805 51.199 112.551 1.00 0.00 H TER 85077 WAT 3849 ATOM 85077 O WAT 3850 60.897 4.600 62.279 1.00 0.00 O ATOM 85078 H1 WAT 3850 60.888 3.936 62.969 1.00 0.00 H ATOM 85079 H2 WAT 3850 61.825 4.790 62.142 1.00 0.00 H TER 85081 WAT 3850 ATOM 85081 O WAT 3851 47.358 82.336 15.396 1.00 0.00 O ATOM 85082 H1 WAT 3851 48.273 82.560 15.562 1.00 0.00 H ATOM 85083 H2 WAT 3851 47.110 82.877 14.646 1.00 0.00 H TER 85085 WAT 3851 ATOM 85085 O WAT 3852 113.445 27.004 116.093 1.00 0.00 O ATOM 85086 H1 WAT 3852 112.766 27.578 115.739 1.00 0.00 H ATOM 85087 H2 WAT 3852 113.095 26.120 115.977 1.00 0.00 H TER 85089 WAT 3852 ATOM 85089 O WAT 3853 59.488 44.518 93.772 1.00 0.00 O ATOM 85090 H1 WAT 3853 60.043 43.908 93.285 1.00 0.00 H ATOM 85091 H2 WAT 3853 58.980 44.970 93.098 1.00 0.00 H TER 85093 WAT 3853 ATOM 85093 O WAT 3854 72.130 141.534 16.125 1.00 0.00 O ATOM 85094 H1 WAT 3854 72.367 140.613 16.017 1.00 0.00 H ATOM 85095 H2 WAT 3854 72.185 141.686 17.068 1.00 0.00 H TER 85097 WAT 3854 ATOM 85097 O WAT 3855 37.097 130.632 132.004 1.00 0.00 O ATOM 85098 H1 WAT 3855 36.716 131.499 131.865 1.00 0.00 H ATOM 85099 H2 WAT 3855 37.499 130.682 132.871 1.00 0.00 H TER 85101 WAT 3855 ATOM 85101 O WAT 3856 140.859 14.197 138.569 1.00 0.00 O ATOM 85102 H1 WAT 3856 140.154 14.338 137.937 1.00 0.00 H ATOM 85103 H2 WAT 3856 140.787 14.935 139.175 1.00 0.00 H TER 85105 WAT 3856 ATOM 85105 O WAT 3857 93.343 111.402 82.460 1.00 0.00 O ATOM 85106 H1 WAT 3857 93.067 111.012 83.289 1.00 0.00 H ATOM 85107 H2 WAT 3857 94.225 111.061 82.317 1.00 0.00 H TER 85109 WAT 3857 ATOM 85109 O WAT 3858 140.111 79.219 125.627 1.00 0.00 O ATOM 85110 H1 WAT 3858 141.067 79.242 125.655 1.00 0.00 H ATOM 85111 H2 WAT 3858 139.837 79.929 126.207 1.00 0.00 H TER 85113 WAT 3858 ATOM 85113 O WAT 3859 72.431 44.889 147.589 1.00 0.00 O ATOM 85114 H1 WAT 3859 71.951 45.619 147.979 1.00 0.00 H ATOM 85115 H2 WAT 3859 72.577 44.283 148.315 1.00 0.00 H TER 85117 WAT 3859 ATOM 85117 O WAT 3860 138.261 2.537 137.632 1.00 0.00 O ATOM 85118 H1 WAT 3860 138.141 3.151 138.357 1.00 0.00 H ATOM 85119 H2 WAT 3860 139.159 2.221 137.732 1.00 0.00 H TER 85121 WAT 3860 ATOM 85121 O WAT 3861 69.017 143.106 133.419 1.00 0.00 O ATOM 85122 H1 WAT 3861 68.978 143.088 132.463 1.00 0.00 H ATOM 85123 H2 WAT 3861 68.898 144.028 133.647 1.00 0.00 H TER 85125 WAT 3861 ATOM 85125 O WAT 3862 117.599 65.757 102.094 1.00 0.00 O ATOM 85126 H1 WAT 3862 116.926 65.153 101.780 1.00 0.00 H ATOM 85127 H2 WAT 3862 117.319 65.987 102.980 1.00 0.00 H TER 85129 WAT 3862 ATOM 85129 O WAT 3863 63.630 76.186 11.516 1.00 0.00 O ATOM 85130 H1 WAT 3863 63.210 75.958 12.346 1.00 0.00 H ATOM 85131 H2 WAT 3863 62.903 76.305 10.905 1.00 0.00 H TER 85133 WAT 3863 ATOM 85133 O WAT 3864 131.207 9.728 86.155 1.00 0.00 O ATOM 85134 H1 WAT 3864 130.947 10.619 86.386 1.00 0.00 H ATOM 85135 H2 WAT 3864 131.876 9.840 85.479 1.00 0.00 H TER 85137 WAT 3864 ATOM 85137 O WAT 3865 143.233 70.587 152.722 1.00 0.00 O ATOM 85138 H1 WAT 3865 143.606 69.992 152.072 1.00 0.00 H ATOM 85139 H2 WAT 3865 143.104 70.043 153.499 1.00 0.00 H TER 85141 WAT 3865 ATOM 85141 O WAT 3866 18.561 87.272 139.849 1.00 0.00 O ATOM 85142 H1 WAT 3866 18.579 87.376 140.801 1.00 0.00 H ATOM 85143 H2 WAT 3866 19.332 86.740 139.652 1.00 0.00 H TER 85145 WAT 3866 ATOM 85145 O WAT 3867 135.976 20.912 5.980 1.00 0.00 O ATOM 85146 H1 WAT 3867 135.961 20.811 6.932 1.00 0.00 H ATOM 85147 H2 WAT 3867 136.440 20.137 5.664 1.00 0.00 H TER 85149 WAT 3867 ATOM 85149 O WAT 3868 33.400 77.444 98.075 1.00 0.00 O ATOM 85150 H1 WAT 3868 33.722 76.989 97.297 1.00 0.00 H ATOM 85151 H2 WAT 3868 32.460 77.266 98.085 1.00 0.00 H TER 85153 WAT 3868 ATOM 85153 O WAT 3869 80.276 42.618 22.829 1.00 0.00 O ATOM 85154 H1 WAT 3869 80.184 41.926 23.483 1.00 0.00 H ATOM 85155 H2 WAT 3869 80.519 43.394 23.333 1.00 0.00 H TER 85157 WAT 3869 ATOM 85157 O WAT 3870 125.774 137.919 25.342 1.00 0.00 O ATOM 85158 H1 WAT 3870 124.842 137.935 25.558 1.00 0.00 H ATOM 85159 H2 WAT 3870 126.002 138.838 25.199 1.00 0.00 H TER 85161 WAT 3870 ATOM 85161 O WAT 3871 90.925 56.809 76.367 1.00 0.00 O ATOM 85162 H1 WAT 3871 91.596 57.152 76.957 1.00 0.00 H ATOM 85163 H2 WAT 3871 90.792 55.906 76.656 1.00 0.00 H TER 85165 WAT 3871 ATOM 85165 O WAT 3872 76.399 104.929 58.125 1.00 0.00 O ATOM 85166 H1 WAT 3872 75.946 104.277 58.659 1.00 0.00 H ATOM 85167 H2 WAT 3872 77.178 104.476 57.803 1.00 0.00 H TER 85169 WAT 3872 ATOM 85169 O WAT 3873 4.358 103.175 14.380 1.00 0.00 O ATOM 85170 H1 WAT 3873 4.217 103.117 15.325 1.00 0.00 H ATOM 85171 H2 WAT 3873 4.684 104.064 14.240 1.00 0.00 H TER 85173 WAT 3873 ATOM 85173 O WAT 3874 19.368 82.442 58.296 1.00 0.00 O ATOM 85174 H1 WAT 3874 18.932 83.227 57.965 1.00 0.00 H ATOM 85175 H2 WAT 3874 18.684 81.772 58.299 1.00 0.00 H TER 85177 WAT 3874 ATOM 85177 O WAT 3875 3.991 126.317 134.168 1.00 0.00 O ATOM 85178 H1 WAT 3875 3.317 126.895 134.524 1.00 0.00 H ATOM 85179 H2 WAT 3875 3.513 125.536 133.889 1.00 0.00 H TER 85181 WAT 3875 ATOM 85181 O WAT 3876 119.978 25.234 129.553 1.00 0.00 O ATOM 85182 H1 WAT 3876 120.604 24.861 128.931 1.00 0.00 H ATOM 85183 H2 WAT 3876 119.856 26.136 129.258 1.00 0.00 H TER 85185 WAT 3876 ATOM 85185 O WAT 3877 58.770 70.607 82.641 1.00 0.00 O ATOM 85186 H1 WAT 3877 58.003 71.140 82.847 1.00 0.00 H ATOM 85187 H2 WAT 3877 58.956 70.131 83.451 1.00 0.00 H TER 85189 WAT 3877 ATOM 85189 O WAT 3878 137.644 77.147 54.012 1.00 0.00 O ATOM 85190 H1 WAT 3878 136.907 77.004 54.605 1.00 0.00 H ATOM 85191 H2 WAT 3878 137.726 76.325 53.529 1.00 0.00 H TER 85193 WAT 3878 ATOM 85193 O WAT 3879 69.383 31.426 67.900 1.00 0.00 O ATOM 85194 H1 WAT 3879 70.116 32.042 67.920 1.00 0.00 H ATOM 85195 H2 WAT 3879 69.173 31.336 66.970 1.00 0.00 H TER 85197 WAT 3879 ATOM 85197 O WAT 3880 122.601 36.608 83.837 1.00 0.00 O ATOM 85198 H1 WAT 3880 121.837 36.034 83.890 1.00 0.00 H ATOM 85199 H2 WAT 3880 122.420 37.308 84.464 1.00 0.00 H TER 85201 WAT 3880 ATOM 85201 O WAT 3881 37.396 71.144 81.579 1.00 0.00 O ATOM 85202 H1 WAT 3881 36.447 71.251 81.643 1.00 0.00 H ATOM 85203 H2 WAT 3881 37.515 70.249 81.261 1.00 0.00 H TER 85205 WAT 3881 ATOM 85205 O WAT 3882 45.894 102.905 156.159 1.00 0.00 O ATOM 85206 H1 WAT 3882 45.361 102.347 156.724 1.00 0.00 H ATOM 85207 H2 WAT 3882 46.131 102.343 155.421 1.00 0.00 H TER 85209 WAT 3882 ATOM 85209 O WAT 3883 25.202 59.247 22.352 1.00 0.00 O ATOM 85210 H1 WAT 3883 25.575 59.006 21.505 1.00 0.00 H ATOM 85211 H2 WAT 3883 25.912 59.700 22.807 1.00 0.00 H TER 85213 WAT 3883 ATOM 85213 O WAT 3884 124.413 110.577 134.939 1.00 0.00 O ATOM 85214 H1 WAT 3884 124.209 109.686 134.654 1.00 0.00 H ATOM 85215 H2 WAT 3884 124.177 111.127 134.191 1.00 0.00 H TER 85217 WAT 3884 ATOM 85217 O WAT 3885 118.148 55.959 15.156 1.00 0.00 O ATOM 85218 H1 WAT 3885 117.635 56.418 14.491 1.00 0.00 H ATOM 85219 H2 WAT 3885 118.691 55.347 14.660 1.00 0.00 H TER 85221 WAT 3885 ATOM 85221 O WAT 3886 56.026 41.548 76.438 1.00 0.00 O ATOM 85222 H1 WAT 3886 56.223 42.189 77.121 1.00 0.00 H ATOM 85223 H2 WAT 3886 56.765 40.941 76.458 1.00 0.00 H TER 85225 WAT 3886 ATOM 85225 O WAT 3887 38.410 142.199 7.579 1.00 0.00 O ATOM 85226 H1 WAT 3887 38.615 141.599 6.862 1.00 0.00 H ATOM 85227 H2 WAT 3887 39.151 142.118 8.179 1.00 0.00 H TER 85229 WAT 3887 ATOM 85229 O WAT 3888 75.917 126.747 106.431 1.00 0.00 O ATOM 85230 H1 WAT 3888 75.165 126.243 106.740 1.00 0.00 H ATOM 85231 H2 WAT 3888 76.084 127.381 107.129 1.00 0.00 H TER 85233 WAT 3888 ATOM 85233 O WAT 3889 122.624 121.289 65.394 1.00 0.00 O ATOM 85234 H1 WAT 3889 122.208 120.531 64.984 1.00 0.00 H ATOM 85235 H2 WAT 3889 122.897 121.838 64.659 1.00 0.00 H TER 85237 WAT 3889 ATOM 85237 O WAT 3890 93.348 90.416 80.959 1.00 0.00 O ATOM 85238 H1 WAT 3890 93.496 90.599 80.032 1.00 0.00 H ATOM 85239 H2 WAT 3890 92.851 89.598 80.966 1.00 0.00 H TER 85241 WAT 3890 ATOM 85241 O WAT 3891 19.755 93.497 156.240 1.00 0.00 O ATOM 85242 H1 WAT 3891 20.104 92.611 156.333 1.00 0.00 H ATOM 85243 H2 WAT 3891 20.517 94.067 156.341 1.00 0.00 H TER 85245 WAT 3891 ATOM 85245 O WAT 3892 1.839 25.216 1.473 1.00 0.00 O ATOM 85246 H1 WAT 3892 1.386 24.596 0.902 1.00 0.00 H ATOM 85247 H2 WAT 3892 2.405 24.670 2.019 1.00 0.00 H TER 85249 WAT 3892 ATOM 85249 O WAT 3893 138.518 85.266 25.088 1.00 0.00 O ATOM 85250 H1 WAT 3893 138.967 84.483 24.769 1.00 0.00 H ATOM 85251 H2 WAT 3893 139.224 85.858 25.346 1.00 0.00 H TER 85253 WAT 3893 ATOM 85253 O WAT 3894 58.002 49.776 23.230 1.00 0.00 O ATOM 85254 H1 WAT 3894 57.859 48.890 22.898 1.00 0.00 H ATOM 85255 H2 WAT 3894 58.375 50.253 22.489 1.00 0.00 H TER 85257 WAT 3894 ATOM 85257 O WAT 3895 78.428 132.012 95.186 1.00 0.00 O ATOM 85258 H1 WAT 3895 78.433 131.747 94.266 1.00 0.00 H ATOM 85259 H2 WAT 3895 78.730 131.237 95.660 1.00 0.00 H TER 85261 WAT 3895 ATOM 85261 O WAT 3896 6.295 98.995 147.314 1.00 0.00 O ATOM 85262 H1 WAT 3896 6.181 99.942 147.396 1.00 0.00 H ATOM 85263 H2 WAT 3896 6.170 98.819 146.381 1.00 0.00 H TER 85265 WAT 3896 ATOM 85265 O WAT 3897 84.801 14.756 17.511 1.00 0.00 O ATOM 85266 H1 WAT 3897 84.219 15.515 17.554 1.00 0.00 H ATOM 85267 H2 WAT 3897 85.585 15.027 17.989 1.00 0.00 H TER 85269 WAT 3897 ATOM 85269 O WAT 3898 74.738 80.278 100.304 1.00 0.00 O ATOM 85270 H1 WAT 3898 74.300 79.729 100.955 1.00 0.00 H ATOM 85271 H2 WAT 3898 75.079 79.659 99.659 1.00 0.00 H TER 85273 WAT 3898 ATOM 85273 O WAT 3899 22.941 103.974 111.496 1.00 0.00 O ATOM 85274 H1 WAT 3899 22.037 103.699 111.645 1.00 0.00 H ATOM 85275 H2 WAT 3899 23.118 104.603 112.195 1.00 0.00 H TER 85277 WAT 3899 ATOM 85277 O WAT 3900 96.739 24.164 153.540 1.00 0.00 O ATOM 85278 H1 WAT 3900 95.950 24.107 154.077 1.00 0.00 H ATOM 85279 H2 WAT 3900 96.416 24.358 152.660 1.00 0.00 H TER 85281 WAT 3900 ATOM 85281 O WAT 3901 50.271 52.036 17.520 1.00 0.00 O ATOM 85282 H1 WAT 3901 50.340 51.273 16.946 1.00 0.00 H ATOM 85283 H2 WAT 3901 50.300 52.786 16.925 1.00 0.00 H TER 85285 WAT 3901 ATOM 85285 O WAT 3902 4.310 19.646 18.721 1.00 0.00 O ATOM 85286 H1 WAT 3902 5.128 20.040 19.024 1.00 0.00 H ATOM 85287 H2 WAT 3902 4.401 18.716 18.927 1.00 0.00 H TER 85289 WAT 3902 ATOM 85289 O WAT 3903 31.443 7.442 125.322 1.00 0.00 O ATOM 85290 H1 WAT 3903 32.014 7.257 126.068 1.00 0.00 H ATOM 85291 H2 WAT 3903 30.798 8.061 125.663 1.00 0.00 H TER 85293 WAT 3903 ATOM 85293 O WAT 3904 79.410 9.845 156.739 1.00 0.00 O ATOM 85294 H1 WAT 3904 79.768 10.255 157.526 1.00 0.00 H ATOM 85295 H2 WAT 3904 79.927 10.212 156.022 1.00 0.00 H TER 85297 WAT 3904 ATOM 85297 O WAT 3905 57.689 65.809 92.447 1.00 0.00 O ATOM 85298 H1 WAT 3905 57.591 65.820 93.399 1.00 0.00 H ATOM 85299 H2 WAT 3905 56.891 66.224 92.120 1.00 0.00 H TER 85301 WAT 3905 ATOM 85301 O WAT 3906 140.765 31.147 129.789 1.00 0.00 O ATOM 85302 H1 WAT 3906 141.080 30.809 130.627 1.00 0.00 H ATOM 85303 H2 WAT 3906 141.039 30.492 129.148 1.00 0.00 H TER 85305 WAT 3906 ATOM 85305 O WAT 3907 7.522 136.209 10.672 1.00 0.00 O ATOM 85306 H1 WAT 3907 8.276 135.949 11.202 1.00 0.00 H ATOM 85307 H2 WAT 3907 6.813 136.323 11.305 1.00 0.00 H TER 85309 WAT 3907 ATOM 85309 O WAT 3908 74.630 138.503 127.598 1.00 0.00 O ATOM 85310 H1 WAT 3908 74.555 137.678 128.079 1.00 0.00 H ATOM 85311 H2 WAT 3908 75.564 138.708 127.620 1.00 0.00 H TER 85313 WAT 3908 ATOM 85313 O WAT 3909 7.550 24.728 58.685 1.00 0.00 O ATOM 85314 H1 WAT 3909 7.750 25.616 58.390 1.00 0.00 H ATOM 85315 H2 WAT 3909 8.363 24.241 58.552 1.00 0.00 H TER 85317 WAT 3909 ATOM 85317 O WAT 3910 50.346 62.610 101.186 1.00 0.00 O ATOM 85318 H1 WAT 3910 50.707 61.965 100.577 1.00 0.00 H ATOM 85319 H2 WAT 3910 49.701 62.121 101.697 1.00 0.00 H TER 85321 WAT 3910 ATOM 85321 O WAT 3911 79.306 145.530 115.910 1.00 0.00 O ATOM 85322 H1 WAT 3911 80.026 145.330 115.310 1.00 0.00 H ATOM 85323 H2 WAT 3911 78.645 145.949 115.359 1.00 0.00 H TER 85325 WAT 3911 ATOM 85325 O WAT 3912 125.316 15.569 74.641 1.00 0.00 O ATOM 85326 H1 WAT 3912 125.784 16.165 74.055 1.00 0.00 H ATOM 85327 H2 WAT 3912 125.477 15.919 75.517 1.00 0.00 H TER 85329 WAT 3912 ATOM 85329 O WAT 3913 71.473 118.359 121.295 1.00 0.00 O ATOM 85330 H1 WAT 3913 72.254 118.151 121.807 1.00 0.00 H ATOM 85331 H2 WAT 3913 70.984 118.973 121.843 1.00 0.00 H TER 85333 WAT 3913 ATOM 85333 O WAT 3914 127.524 9.158 5.869 1.00 0.00 O ATOM 85334 H1 WAT 3914 128.412 8.890 5.634 1.00 0.00 H ATOM 85335 H2 WAT 3914 127.641 9.746 6.615 1.00 0.00 H TER 85337 WAT 3914 ATOM 85337 O WAT 3915 99.643 40.136 72.087 1.00 0.00 O ATOM 85338 H1 WAT 3915 100.595 40.114 71.984 1.00 0.00 H ATOM 85339 H2 WAT 3915 99.490 39.800 72.970 1.00 0.00 H TER 85341 WAT 3915 ATOM 85341 O WAT 3916 21.445 136.752 94.114 1.00 0.00 O ATOM 85342 H1 WAT 3916 21.077 137.054 93.284 1.00 0.00 H ATOM 85343 H2 WAT 3916 20.975 135.940 94.304 1.00 0.00 H TER 85345 WAT 3916 ATOM 85345 O WAT 3917 17.589 35.980 0.968 1.00 0.00 O ATOM 85346 H1 WAT 3917 18.271 35.419 0.599 1.00 0.00 H ATOM 85347 H2 WAT 3917 17.714 35.918 1.915 1.00 0.00 H TER 85349 WAT 3917 ATOM 85349 O WAT 3918 8.169 61.905 156.891 1.00 0.00 O ATOM 85350 H1 WAT 3918 7.825 62.770 156.669 1.00 0.00 H ATOM 85351 H2 WAT 3918 8.074 61.846 157.842 1.00 0.00 H TER 85353 WAT 3918 ATOM 85353 O WAT 3919 1.840 131.338 128.602 1.00 0.00 O ATOM 85354 H1 WAT 3919 1.598 131.888 127.857 1.00 0.00 H ATOM 85355 H2 WAT 3919 1.296 130.555 128.509 1.00 0.00 H TER 85357 WAT 3919 ATOM 85357 O WAT 3920 62.388 88.272 119.715 1.00 0.00 O ATOM 85358 H1 WAT 3920 63.196 88.538 119.278 1.00 0.00 H ATOM 85359 H2 WAT 3920 62.184 87.415 119.340 1.00 0.00 H TER 85361 WAT 3920 ATOM 85361 O WAT 3921 108.683 83.561 2.890 1.00 0.00 O ATOM 85362 H1 WAT 3921 109.040 83.230 2.066 1.00 0.00 H ATOM 85363 H2 WAT 3921 108.613 84.506 2.759 1.00 0.00 H TER 85365 WAT 3921 ATOM 85365 O WAT 3922 89.822 89.712 106.098 1.00 0.00 O ATOM 85366 H1 WAT 3922 89.722 89.816 107.044 1.00 0.00 H ATOM 85367 H2 WAT 3922 89.459 88.846 105.912 1.00 0.00 H TER 85369 WAT 3922 ATOM 85369 O WAT 3923 11.663 86.363 114.147 1.00 0.00 O ATOM 85370 H1 WAT 3923 11.244 87.223 114.178 1.00 0.00 H ATOM 85371 H2 WAT 3923 11.353 85.917 114.935 1.00 0.00 H TER 85373 WAT 3923 ATOM 85373 O WAT 3924 38.971 131.586 79.011 1.00 0.00 O ATOM 85374 H1 WAT 3924 39.586 130.912 78.721 1.00 0.00 H ATOM 85375 H2 WAT 3924 39.203 132.359 78.496 1.00 0.00 H TER 85377 WAT 3924 ATOM 85377 O WAT 3925 9.542 11.285 15.435 1.00 0.00 O ATOM 85378 H1 WAT 3925 9.760 11.279 14.503 1.00 0.00 H ATOM 85379 H2 WAT 3925 8.772 11.850 15.497 1.00 0.00 H TER 85381 WAT 3925 ATOM 85381 O WAT 3926 128.753 75.224 87.198 1.00 0.00 O ATOM 85382 H1 WAT 3926 128.812 75.447 88.127 1.00 0.00 H ATOM 85383 H2 WAT 3926 127.815 75.231 87.009 1.00 0.00 H TER 85385 WAT 3926 ATOM 85385 O WAT 3927 117.284 33.465 99.092 1.00 0.00 O ATOM 85386 H1 WAT 3927 117.056 33.544 98.166 1.00 0.00 H ATOM 85387 H2 WAT 3927 116.935 32.612 99.353 1.00 0.00 H TER 85389 WAT 3927 ATOM 85389 O WAT 3928 14.582 116.650 15.758 1.00 0.00 O ATOM 85390 H1 WAT 3928 14.366 116.164 16.554 1.00 0.00 H ATOM 85391 H2 WAT 3928 14.341 116.060 15.044 1.00 0.00 H TER 85393 WAT 3928 ATOM 85393 O WAT 3929 127.895 6.437 62.583 1.00 0.00 O ATOM 85394 H1 WAT 3929 127.429 5.768 62.081 1.00 0.00 H ATOM 85395 H2 WAT 3929 127.332 7.209 62.534 1.00 0.00 H TER 85397 WAT 3929 ATOM 85397 O WAT 3930 123.688 41.619 112.888 1.00 0.00 O ATOM 85398 H1 WAT 3930 123.260 41.299 113.682 1.00 0.00 H ATOM 85399 H2 WAT 3930 123.447 40.985 112.213 1.00 0.00 H TER 85401 WAT 3930 ATOM 85401 O WAT 3931 26.470 82.309 105.820 1.00 0.00 O ATOM 85402 H1 WAT 3931 25.767 82.452 106.454 1.00 0.00 H ATOM 85403 H2 WAT 3931 26.909 81.515 106.125 1.00 0.00 H TER 85405 WAT 3931 ATOM 85405 O WAT 3932 79.684 30.536 119.687 1.00 0.00 O ATOM 85406 H1 WAT 3932 80.190 30.649 118.882 1.00 0.00 H ATOM 85407 H2 WAT 3932 78.841 30.189 119.394 1.00 0.00 H TER 85409 WAT 3932 ATOM 85409 O WAT 3933 80.658 45.029 58.633 1.00 0.00 O ATOM 85410 H1 WAT 3933 80.122 44.751 59.376 1.00 0.00 H ATOM 85411 H2 WAT 3933 81.089 44.228 58.335 1.00 0.00 H TER 85413 WAT 3933 ATOM 85413 O WAT 3934 104.662 46.384 139.367 1.00 0.00 O ATOM 85414 H1 WAT 3934 104.430 45.739 140.035 1.00 0.00 H ATOM 85415 H2 WAT 3934 105.503 46.736 139.656 1.00 0.00 H TER 85417 WAT 3934 ATOM 85417 O WAT 3935 56.187 38.254 76.955 1.00 0.00 O ATOM 85418 H1 WAT 3935 55.342 38.457 76.553 1.00 0.00 H ATOM 85419 H2 WAT 3935 56.761 38.049 76.218 1.00 0.00 H TER 85421 WAT 3935 ATOM 85421 O WAT 3936 86.910 81.514 62.029 1.00 0.00 O ATOM 85422 H1 WAT 3936 87.784 81.434 61.647 1.00 0.00 H ATOM 85423 H2 WAT 3936 86.659 82.424 61.865 1.00 0.00 H TER 85425 WAT 3936 ATOM 85425 O WAT 3937 7.323 90.518 123.183 1.00 0.00 O ATOM 85426 H1 WAT 3937 7.149 90.810 124.078 1.00 0.00 H ATOM 85427 H2 WAT 3937 7.585 89.602 123.277 1.00 0.00 H TER 85429 WAT 3937 ATOM 85429 O WAT 3938 114.824 10.462 157.257 1.00 0.00 O ATOM 85430 H1 WAT 3938 114.825 9.510 157.355 1.00 0.00 H ATOM 85431 H2 WAT 3938 115.571 10.757 157.779 1.00 0.00 H TER 85433 WAT 3938 ATOM 85433 O WAT 3939 52.191 116.917 115.123 1.00 0.00 O ATOM 85434 H1 WAT 3939 53.037 117.343 115.259 1.00 0.00 H ATOM 85435 H2 WAT 3939 52.266 116.502 114.264 1.00 0.00 H TER 85437 WAT 3939 ATOM 85437 O WAT 3940 69.647 10.851 0.551 1.00 0.00 O ATOM 85438 H1 WAT 3940 69.936 10.379 -0.229 1.00 0.00 H ATOM 85439 H2 WAT 3940 69.958 11.747 0.418 1.00 0.00 H TER 85441 WAT 3940 ATOM 85441 O WAT 3941 25.740 93.997 144.273 1.00 0.00 O ATOM 85442 H1 WAT 3941 25.381 93.483 144.997 1.00 0.00 H ATOM 85443 H2 WAT 3941 25.151 94.747 144.197 1.00 0.00 H TER 85445 WAT 3941 ATOM 85445 O WAT 3942 125.759 64.026 115.799 1.00 0.00 O ATOM 85446 H1 WAT 3942 126.494 64.294 116.351 1.00 0.00 H ATOM 85447 H2 WAT 3942 125.189 63.528 116.384 1.00 0.00 H TER 85449 WAT 3942 ATOM 85449 O WAT 3943 22.245 28.933 20.597 1.00 0.00 O ATOM 85450 H1 WAT 3943 23.095 29.357 20.477 1.00 0.00 H ATOM 85451 H2 WAT 3943 22.456 28.008 20.729 1.00 0.00 H TER 85453 WAT 3943 ATOM 85453 O WAT 3944 52.990 141.442 17.104 1.00 0.00 O ATOM 85454 H1 WAT 3944 52.903 141.438 18.057 1.00 0.00 H ATOM 85455 H2 WAT 3944 53.266 140.552 16.885 1.00 0.00 H TER 85457 WAT 3944 ATOM 85457 O WAT 3945 32.039 41.055 111.143 1.00 0.00 O ATOM 85458 H1 WAT 3945 31.429 41.236 110.427 1.00 0.00 H ATOM 85459 H2 WAT 3945 32.072 41.872 111.641 1.00 0.00 H TER 85461 WAT 3945 ATOM 85461 O WAT 3946 131.375 89.542 81.340 1.00 0.00 O ATOM 85462 H1 WAT 3946 131.544 88.721 80.878 1.00 0.00 H ATOM 85463 H2 WAT 3946 132.244 89.892 81.534 1.00 0.00 H TER 85465 WAT 3946 ATOM 85465 O WAT 3947 69.869 37.442 8.950 1.00 0.00 O ATOM 85466 H1 WAT 3947 69.506 37.061 8.151 1.00 0.00 H ATOM 85467 H2 WAT 3947 70.504 36.796 9.257 1.00 0.00 H TER 85469 WAT 3947 ATOM 85469 O WAT 3948 21.830 99.454 122.571 1.00 0.00 O ATOM 85470 H1 WAT 3948 22.402 98.875 122.068 1.00 0.00 H ATOM 85471 H2 WAT 3948 21.290 99.889 121.911 1.00 0.00 H TER 85473 WAT 3948 ATOM 85473 O WAT 3949 62.041 143.025 154.743 1.00 0.00 O ATOM 85474 H1 WAT 3949 62.847 143.083 155.257 1.00 0.00 H ATOM 85475 H2 WAT 3949 62.317 142.650 153.907 1.00 0.00 H TER 85477 WAT 3949 ATOM 85477 O WAT 3950 46.248 7.476 85.488 1.00 0.00 O ATOM 85478 H1 WAT 3950 45.431 7.680 85.034 1.00 0.00 H ATOM 85479 H2 WAT 3950 46.722 8.307 85.514 1.00 0.00 H TER 85481 WAT 3950 ATOM 85481 O WAT 3951 87.149 127.580 118.581 1.00 0.00 O ATOM 85482 H1 WAT 3951 87.043 126.693 118.237 1.00 0.00 H ATOM 85483 H2 WAT 3951 86.589 127.605 119.357 1.00 0.00 H TER 85485 WAT 3951 ATOM 85485 O WAT 3952 89.169 82.759 139.462 1.00 0.00 O ATOM 85486 H1 WAT 3952 88.493 82.379 140.024 1.00 0.00 H ATOM 85487 H2 WAT 3952 88.867 82.580 138.571 1.00 0.00 H TER 85489 WAT 3952 ATOM 85489 O WAT 3953 68.087 102.276 128.602 1.00 0.00 O ATOM 85490 H1 WAT 3953 67.989 103.129 129.024 1.00 0.00 H ATOM 85491 H2 WAT 3953 68.494 101.724 129.269 1.00 0.00 H TER 85493 WAT 3953 ATOM 85493 O WAT 3954 133.948 23.986 110.803 1.00 0.00 O ATOM 85494 H1 WAT 3954 134.841 23.682 110.639 1.00 0.00 H ATOM 85495 H2 WAT 3954 133.394 23.242 110.567 1.00 0.00 H TER 85497 WAT 3954 ATOM 85497 O WAT 3955 36.740 130.557 156.375 1.00 0.00 O ATOM 85498 H1 WAT 3955 36.611 129.980 157.128 1.00 0.00 H ATOM 85499 H2 WAT 3955 37.616 130.922 156.500 1.00 0.00 H TER 85501 WAT 3955 ATOM 85501 O WAT 3956 108.834 48.985 113.932 1.00 0.00 O ATOM 85502 H1 WAT 3956 109.487 49.504 114.402 1.00 0.00 H ATOM 85503 H2 WAT 3956 109.170 48.089 113.969 1.00 0.00 H TER 85505 WAT 3956 ATOM 85505 O WAT 3957 4.830 33.793 5.882 1.00 0.00 O ATOM 85506 H1 WAT 3957 5.504 33.151 6.105 1.00 0.00 H ATOM 85507 H2 WAT 3957 5.217 34.312 5.177 1.00 0.00 H TER 85509 WAT 3957 ATOM 85509 O WAT 3958 34.955 91.830 103.656 1.00 0.00 O ATOM 85510 H1 WAT 3958 35.506 91.170 104.077 1.00 0.00 H ATOM 85511 H2 WAT 3958 34.546 91.369 102.924 1.00 0.00 H TER 85513 WAT 3958 ATOM 85513 O WAT 3959 72.754 50.742 94.108 1.00 0.00 O ATOM 85514 H1 WAT 3959 73.464 50.115 93.968 1.00 0.00 H ATOM 85515 H2 WAT 3959 72.328 50.817 93.254 1.00 0.00 H TER 85517 WAT 3959 ATOM 85517 O WAT 3960 143.897 12.938 110.947 1.00 0.00 O ATOM 85518 H1 WAT 3960 143.999 13.752 111.441 1.00 0.00 H ATOM 85519 H2 WAT 3960 143.328 12.396 111.494 1.00 0.00 H TER 85521 WAT 3960 ATOM 85521 O WAT 3961 138.756 137.447 148.021 1.00 0.00 O ATOM 85522 H1 WAT 3961 138.942 136.532 147.808 1.00 0.00 H ATOM 85523 H2 WAT 3961 139.292 137.950 147.407 1.00 0.00 H TER 85525 WAT 3961 ATOM 85525 O WAT 3962 42.844 93.978 127.782 1.00 0.00 O ATOM 85526 H1 WAT 3962 42.595 93.825 128.694 1.00 0.00 H ATOM 85527 H2 WAT 3962 42.425 94.808 127.555 1.00 0.00 H TER 85529 WAT 3962 ATOM 85529 O WAT 3963 47.540 39.044 120.334 1.00 0.00 O ATOM 85530 H1 WAT 3963 46.742 38.730 120.759 1.00 0.00 H ATOM 85531 H2 WAT 3963 47.684 39.914 120.706 1.00 0.00 H TER 85533 WAT 3963 ATOM 85533 O WAT 3964 105.169 115.131 135.522 1.00 0.00 O ATOM 85534 H1 WAT 3964 106.000 114.970 135.969 1.00 0.00 H ATOM 85535 H2 WAT 3964 104.543 115.287 136.229 1.00 0.00 H TER 85537 WAT 3964 ATOM 85537 O WAT 3965 141.294 49.740 85.190 1.00 0.00 O ATOM 85538 H1 WAT 3965 142.111 49.302 85.429 1.00 0.00 H ATOM 85539 H2 WAT 3965 140.959 50.088 86.016 1.00 0.00 H TER 85541 WAT 3965 ATOM 85541 O WAT 3966 23.554 37.510 139.989 1.00 0.00 O ATOM 85542 H1 WAT 3966 24.177 36.979 140.484 1.00 0.00 H ATOM 85543 H2 WAT 3966 22.860 36.899 139.742 1.00 0.00 H TER 85545 WAT 3966 ATOM 85545 O WAT 3967 40.154 3.552 118.491 1.00 0.00 O ATOM 85546 H1 WAT 3967 39.220 3.377 118.380 1.00 0.00 H ATOM 85547 H2 WAT 3967 40.319 4.324 117.950 1.00 0.00 H TER 85549 WAT 3967 ATOM 85549 O WAT 3968 33.685 35.219 18.395 1.00 0.00 O ATOM 85550 H1 WAT 3968 32.853 35.179 18.867 1.00 0.00 H ATOM 85551 H2 WAT 3968 33.583 35.955 17.792 1.00 0.00 H TER 85553 WAT 3968 ATOM 85553 O WAT 3969 47.998 34.510 73.950 1.00 0.00 O ATOM 85554 H1 WAT 3969 47.247 33.920 74.015 1.00 0.00 H ATOM 85555 H2 WAT 3969 48.687 34.077 74.454 1.00 0.00 H TER 85557 WAT 3969 ATOM 85557 O WAT 3970 129.361 30.500 73.660 1.00 0.00 O ATOM 85558 H1 WAT 3970 129.578 31.224 74.247 1.00 0.00 H ATOM 85559 H2 WAT 3970 129.368 29.725 74.222 1.00 0.00 H TER 85561 WAT 3970 ATOM 85561 O WAT 3971 93.953 110.004 74.043 1.00 0.00 O ATOM 85562 H1 WAT 3971 93.590 110.331 74.865 1.00 0.00 H ATOM 85563 H2 WAT 3971 93.437 109.223 73.847 1.00 0.00 H TER 85565 WAT 3971 ATOM 85565 O WAT 3972 103.118 46.764 146.663 1.00 0.00 O ATOM 85566 H1 WAT 3972 102.692 45.919 146.804 1.00 0.00 H ATOM 85567 H2 WAT 3972 102.812 47.311 147.387 1.00 0.00 H TER 85569 WAT 3972 ATOM 85569 O WAT 3973 32.623 82.169 67.666 1.00 0.00 O ATOM 85570 H1 WAT 3973 32.100 82.363 68.444 1.00 0.00 H ATOM 85571 H2 WAT 3973 32.907 83.026 67.348 1.00 0.00 H TER 85573 WAT 3973 ATOM 85573 O WAT 3974 9.039 98.458 58.809 1.00 0.00 O ATOM 85574 H1 WAT 3974 8.806 99.102 59.477 1.00 0.00 H ATOM 85575 H2 WAT 3974 8.501 98.692 58.053 1.00 0.00 H TER 85577 WAT 3974 ATOM 85577 O WAT 3975 98.197 91.745 114.745 1.00 0.00 O ATOM 85578 H1 WAT 3975 98.247 90.790 114.707 1.00 0.00 H ATOM 85579 H2 WAT 3975 98.828 91.991 115.422 1.00 0.00 H TER 85581 WAT 3975 ATOM 85581 O WAT 3976 14.881 50.428 11.589 1.00 0.00 O ATOM 85582 H1 WAT 3976 15.429 50.502 12.371 1.00 0.00 H ATOM 85583 H2 WAT 3976 15.476 50.116 10.908 1.00 0.00 H TER 85585 WAT 3976 ATOM 85585 O WAT 3977 118.987 8.069 114.595 1.00 0.00 O ATOM 85586 H1 WAT 3977 119.263 8.892 114.997 1.00 0.00 H ATOM 85587 H2 WAT 3977 119.598 7.939 113.870 1.00 0.00 H TER 85589 WAT 3977 ATOM 85589 O WAT 3978 130.420 130.903 87.296 1.00 0.00 O ATOM 85590 H1 WAT 3978 130.909 131.076 86.491 1.00 0.00 H ATOM 85591 H2 WAT 3978 130.982 130.312 87.796 1.00 0.00 H TER 85593 WAT 3978 ATOM 85593 O WAT 3979 1.346 31.644 3.718 1.00 0.00 O ATOM 85594 H1 WAT 3979 2.200 31.593 4.148 1.00 0.00 H ATOM 85595 H2 WAT 3979 1.545 31.921 2.824 1.00 0.00 H TER 85597 WAT 3979 ATOM 85597 O WAT 3980 64.782 106.377 60.084 1.00 0.00 O ATOM 85598 H1 WAT 3980 65.468 107.013 60.289 1.00 0.00 H ATOM 85599 H2 WAT 3980 65.119 105.897 59.328 1.00 0.00 H TER 85601 WAT 3980 ATOM 85601 O WAT 3981 104.471 9.904 78.318 1.00 0.00 O ATOM 85602 H1 WAT 3981 104.584 9.065 78.765 1.00 0.00 H ATOM 85603 H2 WAT 3981 105.358 10.165 78.070 1.00 0.00 H TER 85605 WAT 3981 ATOM 85605 O WAT 3982 63.801 136.530 14.445 1.00 0.00 O ATOM 85606 H1 WAT 3982 63.545 136.654 15.359 1.00 0.00 H ATOM 85607 H2 WAT 3982 64.651 136.092 14.490 1.00 0.00 H TER 85609 WAT 3982 ATOM 85609 O WAT 3983 110.200 139.350 13.178 1.00 0.00 O ATOM 85610 H1 WAT 3983 111.033 138.931 13.395 1.00 0.00 H ATOM 85611 H2 WAT 3983 109.596 139.049 13.857 1.00 0.00 H TER 85613 WAT 3983 ATOM 85613 O WAT 3984 6.555 111.264 84.094 1.00 0.00 O ATOM 85614 H1 WAT 3984 6.339 111.849 83.368 1.00 0.00 H ATOM 85615 H2 WAT 3984 7.500 111.368 84.211 1.00 0.00 H TER 85617 WAT 3984 ATOM 85617 O WAT 3985 61.184 18.900 3.599 1.00 0.00 O ATOM 85618 H1 WAT 3985 61.198 18.447 4.442 1.00 0.00 H ATOM 85619 H2 WAT 3985 61.289 18.203 2.951 1.00 0.00 H TER 85621 WAT 3985 ATOM 85621 O WAT 3986 116.362 64.804 154.874 1.00 0.00 O ATOM 85622 H1 WAT 3986 117.101 64.588 154.306 1.00 0.00 H ATOM 85623 H2 WAT 3986 116.340 65.761 154.884 1.00 0.00 H TER 85625 WAT 3986 ATOM 85625 O WAT 3987 33.342 77.747 10.397 1.00 0.00 O ATOM 85626 H1 WAT 3987 33.982 77.873 9.697 1.00 0.00 H ATOM 85627 H2 WAT 3987 33.871 77.596 11.181 1.00 0.00 H TER 85629 WAT 3987 ATOM 85629 O WAT 3988 5.846 114.238 75.329 1.00 0.00 O ATOM 85630 H1 WAT 3988 5.038 114.438 75.800 1.00 0.00 H ATOM 85631 H2 WAT 3988 6.419 113.850 75.990 1.00 0.00 H TER 85633 WAT 3988 ATOM 85633 O WAT 3989 10.851 143.197 21.979 1.00 0.00 O ATOM 85634 H1 WAT 3989 9.990 143.062 22.377 1.00 0.00 H ATOM 85635 H2 WAT 3989 11.457 142.739 22.561 1.00 0.00 H TER 85637 WAT 3989 ATOM 85637 O WAT 3990 121.484 21.869 74.351 1.00 0.00 O ATOM 85638 H1 WAT 3990 121.914 21.941 75.203 1.00 0.00 H ATOM 85639 H2 WAT 3990 121.857 21.078 73.961 1.00 0.00 H TER 85641 WAT 3990 ATOM 85641 O WAT 3991 4.372 21.586 134.238 1.00 0.00 O ATOM 85642 H1 WAT 3991 4.121 20.861 134.811 1.00 0.00 H ATOM 85643 H2 WAT 3991 5.234 21.340 133.904 1.00 0.00 H TER 85645 WAT 3991 ATOM 85645 O WAT 3992 69.397 101.444 1.273 1.00 0.00 O ATOM 85646 H1 WAT 3992 68.627 102.012 1.303 1.00 0.00 H ATOM 85647 H2 WAT 3992 69.056 100.569 1.459 1.00 0.00 H TER 85649 WAT 3992 ATOM 85649 O WAT 3993 99.477 130.966 65.304 1.00 0.00 O ATOM 85650 H1 WAT 3993 99.529 131.014 66.259 1.00 0.00 H ATOM 85651 H2 WAT 3993 99.996 131.710 64.998 1.00 0.00 H TER 85653 WAT 3993 ATOM 85653 O WAT 3994 53.284 141.599 79.661 1.00 0.00 O ATOM 85654 H1 WAT 3994 53.752 141.936 78.898 1.00 0.00 H ATOM 85655 H2 WAT 3994 53.809 140.854 79.954 1.00 0.00 H TER 85657 WAT 3994 ATOM 85657 O WAT 3995 41.681 77.388 127.388 1.00 0.00 O ATOM 85658 H1 WAT 3995 42.597 77.375 127.109 1.00 0.00 H ATOM 85659 H2 WAT 3995 41.434 78.312 127.359 1.00 0.00 H TER 85661 WAT 3995 ATOM 85661 O WAT 3996 99.405 103.178 9.297 1.00 0.00 O ATOM 85662 H1 WAT 3996 98.958 103.317 10.132 1.00 0.00 H ATOM 85663 H2 WAT 3996 98.712 102.901 8.698 1.00 0.00 H TER 85665 WAT 3996 ATOM 85665 O WAT 3997 11.259 84.365 77.827 1.00 0.00 O ATOM 85666 H1 WAT 3997 11.421 83.500 77.449 1.00 0.00 H ATOM 85667 H2 WAT 3997 10.784 84.187 78.639 1.00 0.00 H TER 85669 WAT 3997 ATOM 85669 O WAT 3998 79.692 3.751 102.286 1.00 0.00 O ATOM 85670 H1 WAT 3998 79.161 3.105 102.753 1.00 0.00 H ATOM 85671 H2 WAT 3998 79.204 3.926 101.482 1.00 0.00 H TER 85673 WAT 3998 ATOM 85673 O WAT 3999 133.016 95.802 23.606 1.00 0.00 O ATOM 85674 H1 WAT 3999 133.687 95.197 23.291 1.00 0.00 H ATOM 85675 H2 WAT 3999 133.498 96.444 24.127 1.00 0.00 H TER 85677 WAT 3999 ATOM 85677 O WAT 4000 4.967 49.055 76.347 1.00 0.00 O ATOM 85678 H1 WAT 4000 5.692 49.375 75.811 1.00 0.00 H ATOM 85679 H2 WAT 4000 4.363 48.656 75.721 1.00 0.00 H TER 85681 WAT 4000 ATOM 85681 O WAT 4001 71.812 128.859 100.493 1.00 0.00 O ATOM 85682 H1 WAT 4001 71.147 128.378 100.001 1.00 0.00 H ATOM 85683 H2 WAT 4001 72.386 128.179 100.847 1.00 0.00 H TER 85685 WAT 4001 ATOM 85685 O WAT 4002 12.566 70.951 70.098 1.00 0.00 O ATOM 85686 H1 WAT 4002 13.450 70.586 70.059 1.00 0.00 H ATOM 85687 H2 WAT 4002 12.403 71.279 69.213 1.00 0.00 H TER 85689 WAT 4002 ATOM 85689 O WAT 4003 60.279 119.185 150.040 1.00 0.00 O ATOM 85690 H1 WAT 4003 59.903 119.973 149.647 1.00 0.00 H ATOM 85691 H2 WAT 4003 60.712 119.497 150.834 1.00 0.00 H TER 85693 WAT 4003 ATOM 85693 O WAT 4004 98.842 49.969 117.440 1.00 0.00 O ATOM 85694 H1 WAT 4004 97.914 50.171 117.322 1.00 0.00 H ATOM 85695 H2 WAT 4004 99.124 49.635 116.588 1.00 0.00 H TER 85697 WAT 4004 ATOM 85697 O WAT 4005 23.460 60.505 79.241 1.00 0.00 O ATOM 85698 H1 WAT 4005 23.438 60.433 78.286 1.00 0.00 H ATOM 85699 H2 WAT 4005 22.762 61.125 79.450 1.00 0.00 H TER 85701 WAT 4005 ATOM 85701 O WAT 4006 22.921 54.580 66.634 1.00 0.00 O ATOM 85702 H1 WAT 4006 21.991 54.596 66.860 1.00 0.00 H ATOM 85703 H2 WAT 4006 22.966 55.002 65.776 1.00 0.00 H TER 85705 WAT 4006 ATOM 85705 O WAT 4007 50.480 68.862 83.385 1.00 0.00 O ATOM 85706 H1 WAT 4007 51.294 68.474 83.067 1.00 0.00 H ATOM 85707 H2 WAT 4007 50.519 69.773 83.093 1.00 0.00 H TER 85709 WAT 4007 ATOM 85709 O WAT 4008 97.995 95.454 156.644 1.00 0.00 O ATOM 85710 H1 WAT 4008 98.422 95.528 157.498 1.00 0.00 H ATOM 85711 H2 WAT 4008 98.695 95.186 156.049 1.00 0.00 H TER 85713 WAT 4008 ATOM 85713 O WAT 4009 37.647 128.603 13.261 1.00 0.00 O ATOM 85714 H1 WAT 4009 37.164 128.961 14.005 1.00 0.00 H ATOM 85715 H2 WAT 4009 38.498 129.041 13.295 1.00 0.00 H TER 85717 WAT 4009 ATOM 85717 O WAT 4010 4.376 26.806 108.857 1.00 0.00 O ATOM 85718 H1 WAT 4010 3.491 26.549 108.596 1.00 0.00 H ATOM 85719 H2 WAT 4010 4.951 26.260 108.321 1.00 0.00 H TER 85721 WAT 4010 ATOM 85721 O WAT 4011 94.849 41.311 137.215 1.00 0.00 O ATOM 85722 H1 WAT 4011 94.404 41.799 137.908 1.00 0.00 H ATOM 85723 H2 WAT 4011 95.062 40.468 137.614 1.00 0.00 H TER 85725 WAT 4011 ATOM 85725 O WAT 4012 71.992 145.414 18.928 1.00 0.00 O ATOM 85726 H1 WAT 4012 72.231 144.931 19.719 1.00 0.00 H ATOM 85727 H2 WAT 4012 72.620 145.119 18.268 1.00 0.00 H TER 85729 WAT 4012 ATOM 85729 O WAT 4013 23.590 48.880 98.635 1.00 0.00 O ATOM 85730 H1 WAT 4013 23.960 48.009 98.492 1.00 0.00 H ATOM 85731 H2 WAT 4013 22.733 48.849 98.210 1.00 0.00 H TER 85733 WAT 4013 ATOM 85733 O WAT 4014 29.591 62.796 151.395 1.00 0.00 O ATOM 85734 H1 WAT 4014 29.268 62.881 152.292 1.00 0.00 H ATOM 85735 H2 WAT 4014 29.160 63.504 150.916 1.00 0.00 H TER 85737 WAT 4014 ATOM 85737 O WAT 4015 14.638 102.788 104.318 1.00 0.00 O ATOM 85738 H1 WAT 4015 13.954 103.450 104.209 1.00 0.00 H ATOM 85739 H2 WAT 4015 14.674 102.633 105.261 1.00 0.00 H TER 85741 WAT 4015 ATOM 85741 O WAT 4016 67.552 67.517 7.979 1.00 0.00 O ATOM 85742 H1 WAT 4016 67.903 67.476 7.089 1.00 0.00 H ATOM 85743 H2 WAT 4016 68.305 67.337 8.542 1.00 0.00 H TER 85745 WAT 4016 ATOM 85745 O WAT 4017 11.601 130.477 101.342 1.00 0.00 O ATOM 85746 H1 WAT 4017 12.492 130.700 101.072 1.00 0.00 H ATOM 85747 H2 WAT 4017 11.109 130.420 100.523 1.00 0.00 H TER 85749 WAT 4017 ATOM 85749 O WAT 4018 90.769 61.845 86.369 1.00 0.00 O ATOM 85750 H1 WAT 4018 91.710 61.887 86.198 1.00 0.00 H ATOM 85751 H2 WAT 4018 90.648 62.361 87.166 1.00 0.00 H TER 85753 WAT 4018 ATOM 85753 O WAT 4019 42.438 107.084 128.648 1.00 0.00 O ATOM 85754 H1 WAT 4019 43.003 107.732 129.068 1.00 0.00 H ATOM 85755 H2 WAT 4019 42.789 106.998 127.762 1.00 0.00 H TER 85757 WAT 4019 ATOM 85757 O WAT 4020 112.780 81.750 64.417 1.00 0.00 O ATOM 85758 H1 WAT 4020 112.148 82.467 64.361 1.00 0.00 H ATOM 85759 H2 WAT 4020 112.336 81.007 64.008 1.00 0.00 H TER 85761 WAT 4020 ATOM 85761 O WAT 4021 138.281 46.331 108.038 1.00 0.00 O ATOM 85762 H1 WAT 4021 138.395 45.834 107.228 1.00 0.00 H ATOM 85763 H2 WAT 4021 137.875 47.152 107.760 1.00 0.00 H TER 85765 WAT 4021 ATOM 85765 O WAT 4022 22.208 119.280 130.913 1.00 0.00 O ATOM 85766 H1 WAT 4022 22.392 120.100 130.455 1.00 0.00 H ATOM 85767 H2 WAT 4022 21.351 119.419 131.317 1.00 0.00 H TER 85769 WAT 4022 ATOM 85769 O WAT 4023 8.342 101.707 143.836 1.00 0.00 O ATOM 85770 H1 WAT 4023 8.781 101.807 144.681 1.00 0.00 H ATOM 85771 H2 WAT 4023 7.465 102.064 143.977 1.00 0.00 H TER 85773 WAT 4023 ATOM 85773 O WAT 4024 52.590 124.601 97.014 1.00 0.00 O ATOM 85774 H1 WAT 4024 53.422 124.281 96.666 1.00 0.00 H ATOM 85775 H2 WAT 4024 52.112 123.809 97.260 1.00 0.00 H TER 85777 WAT 4024 ATOM 85777 O WAT 4025 68.594 94.453 152.861 1.00 0.00 O ATOM 85778 H1 WAT 4025 67.685 94.744 152.795 1.00 0.00 H ATOM 85779 H2 WAT 4025 69.053 94.948 152.182 1.00 0.00 H TER 85781 WAT 4025 ATOM 85781 O WAT 4026 56.886 88.137 86.609 1.00 0.00 O ATOM 85782 H1 WAT 4026 56.162 88.354 86.021 1.00 0.00 H ATOM 85783 H2 WAT 4026 57.578 88.756 86.374 1.00 0.00 H TER 85785 WAT 4026 ATOM 85785 O WAT 4027 84.225 7.451 67.042 1.00 0.00 O ATOM 85786 H1 WAT 4027 83.439 7.005 66.725 1.00 0.00 H ATOM 85787 H2 WAT 4027 84.935 6.830 66.878 1.00 0.00 H TER 85789 WAT 4027 ATOM 85789 O WAT 4028 28.526 73.521 136.808 1.00 0.00 O ATOM 85790 H1 WAT 4028 28.574 74.347 136.326 1.00 0.00 H ATOM 85791 H2 WAT 4028 27.751 73.612 137.362 1.00 0.00 H TER 85793 WAT 4028 ATOM 85793 O WAT 4029 50.068 15.812 113.203 1.00 0.00 O ATOM 85794 H1 WAT 4029 50.143 16.539 113.822 1.00 0.00 H ATOM 85795 H2 WAT 4029 49.144 15.565 113.234 1.00 0.00 H TER 85797 WAT 4029 ATOM 85797 O WAT 4030 88.293 84.540 51.419 1.00 0.00 O ATOM 85798 H1 WAT 4030 88.866 84.925 50.756 1.00 0.00 H ATOM 85799 H2 WAT 4030 88.890 84.217 52.094 1.00 0.00 H TER 85801 WAT 4030 ATOM 85801 O WAT 4031 2.947 114.124 69.348 1.00 0.00 O ATOM 85802 H1 WAT 4031 2.559 113.924 68.496 1.00 0.00 H ATOM 85803 H2 WAT 4031 2.469 113.569 69.965 1.00 0.00 H TER 85805 WAT 4031 ATOM 85805 O WAT 4032 23.513 8.088 97.027 1.00 0.00 O ATOM 85806 H1 WAT 4032 23.228 7.678 97.844 1.00 0.00 H ATOM 85807 H2 WAT 4032 24.296 7.599 96.774 1.00 0.00 H TER 85809 WAT 4032 ATOM 85809 O WAT 4033 142.029 55.150 102.300 1.00 0.00 O ATOM 85810 H1 WAT 4033 141.768 56.063 102.184 1.00 0.00 H ATOM 85811 H2 WAT 4033 142.969 55.144 102.121 1.00 0.00 H TER 85813 WAT 4033 ATOM 85813 O WAT 4034 50.228 66.822 24.608 1.00 0.00 O ATOM 85814 H1 WAT 4034 49.333 67.084 24.391 1.00 0.00 H ATOM 85815 H2 WAT 4034 50.591 67.575 25.075 1.00 0.00 H TER 85817 WAT 4034 ATOM 85817 O WAT 4035 99.071 145.208 93.302 1.00 0.00 O ATOM 85818 H1 WAT 4035 98.999 144.818 94.173 1.00 0.00 H ATOM 85819 H2 WAT 4035 98.252 145.689 93.186 1.00 0.00 H TER 85821 WAT 4035 ATOM 85821 O WAT 4036 117.339 119.864 74.479 1.00 0.00 O ATOM 85822 H1 WAT 4036 116.963 119.921 73.601 1.00 0.00 H ATOM 85823 H2 WAT 4036 116.650 120.193 75.056 1.00 0.00 H TER 85825 WAT 4036 ATOM 85825 O WAT 4037 89.729 96.118 141.451 1.00 0.00 O ATOM 85826 H1 WAT 4037 88.945 96.644 141.296 1.00 0.00 H ATOM 85827 H2 WAT 4037 90.454 96.736 141.357 1.00 0.00 H TER 85829 WAT 4037 ATOM 85829 O WAT 4038 69.160 80.773 95.022 1.00 0.00 O ATOM 85830 H1 WAT 4038 69.111 80.187 95.776 1.00 0.00 H ATOM 85831 H2 WAT 4038 69.744 81.478 95.303 1.00 0.00 H TER 85833 WAT 4038 ATOM 85833 O WAT 4039 115.125 138.676 148.451 1.00 0.00 O ATOM 85834 H1 WAT 4039 114.569 139.318 148.891 1.00 0.00 H ATOM 85835 H2 WAT 4039 115.681 138.325 149.147 1.00 0.00 H TER 85837 WAT 4039 ATOM 85837 O WAT 4040 113.934 126.872 2.189 1.00 0.00 O ATOM 85838 H1 WAT 4040 114.278 126.135 1.685 1.00 0.00 H ATOM 85839 H2 WAT 4040 113.177 126.514 2.652 1.00 0.00 H TER 85841 WAT 4040 ATOM 85841 O WAT 4041 42.453 91.319 66.063 1.00 0.00 O ATOM 85842 H1 WAT 4041 43.299 90.871 66.072 1.00 0.00 H ATOM 85843 H2 WAT 4041 41.963 90.920 66.781 1.00 0.00 H TER 85845 WAT 4041 ATOM 85845 O WAT 4042 55.105 66.424 91.170 1.00 0.00 O ATOM 85846 H1 WAT 4042 55.220 66.300 90.228 1.00 0.00 H ATOM 85847 H2 WAT 4042 54.168 66.298 91.316 1.00 0.00 H TER 85849 WAT 4042 ATOM 85849 O WAT 4043 56.990 76.305 158.154 1.00 0.00 O ATOM 85850 H1 WAT 4043 56.139 75.869 158.190 1.00 0.00 H ATOM 85851 H2 WAT 4043 57.308 76.136 157.267 1.00 0.00 H TER 85853 WAT 4043 ATOM 85853 O WAT 4044 14.120 143.913 98.627 1.00 0.00 O ATOM 85854 H1 WAT 4044 13.864 143.501 97.802 1.00 0.00 H ATOM 85855 H2 WAT 4044 14.007 143.226 99.283 1.00 0.00 H TER 85857 WAT 4044 ATOM 85857 O WAT 4045 88.524 10.353 72.977 1.00 0.00 O ATOM 85858 H1 WAT 4045 88.045 10.740 73.710 1.00 0.00 H ATOM 85859 H2 WAT 4045 88.155 9.474 72.888 1.00 0.00 H TER 85861 WAT 4045 ATOM 85861 O WAT 4046 6.159 70.543 128.881 1.00 0.00 O ATOM 85862 H1 WAT 4046 5.659 71.149 129.428 1.00 0.00 H ATOM 85863 H2 WAT 4046 6.098 70.911 127.999 1.00 0.00 H TER 85865 WAT 4046 ATOM 85865 O WAT 4047 6.165 74.468 0.233 1.00 0.00 O ATOM 85866 H1 WAT 4047 6.149 73.524 0.391 1.00 0.00 H ATOM 85867 H2 WAT 4047 5.338 74.650 -0.213 1.00 0.00 H TER 85869 WAT 4047 ATOM 85869 O WAT 4048 5.169 99.672 139.213 1.00 0.00 O ATOM 85870 H1 WAT 4048 5.219 100.401 139.831 1.00 0.00 H ATOM 85871 H2 WAT 4048 5.382 98.899 139.736 1.00 0.00 H TER 85873 WAT 4048 ATOM 85873 O WAT 4049 143.256 70.456 74.116 1.00 0.00 O ATOM 85874 H1 WAT 4049 143.052 71.356 73.860 1.00 0.00 H ATOM 85875 H2 WAT 4049 142.882 69.918 73.418 1.00 0.00 H TER 85877 WAT 4049 ATOM 85877 O WAT 4050 65.672 79.269 156.238 1.00 0.00 O ATOM 85878 H1 WAT 4050 66.362 79.241 155.575 1.00 0.00 H ATOM 85879 H2 WAT 4050 66.127 79.101 157.063 1.00 0.00 H TER 85881 WAT 4050 ATOM 85881 O WAT 4051 56.301 15.154 80.295 1.00 0.00 O ATOM 85882 H1 WAT 4051 56.685 15.970 80.618 1.00 0.00 H ATOM 85883 H2 WAT 4051 56.373 14.548 81.032 1.00 0.00 H TER 85885 WAT 4051 ATOM 85885 O WAT 4052 29.186 127.321 157.677 1.00 0.00 O ATOM 85886 H1 WAT 4052 28.892 128.232 157.692 1.00 0.00 H ATOM 85887 H2 WAT 4052 28.919 126.998 156.816 1.00 0.00 H TER 85889 WAT 4052 ATOM 85889 O WAT 4053 124.690 32.488 103.637 1.00 0.00 O ATOM 85890 H1 WAT 4053 125.415 33.108 103.716 1.00 0.00 H ATOM 85891 H2 WAT 4053 125.068 31.645 103.888 1.00 0.00 H TER 85893 WAT 4053 ATOM 85893 O WAT 4054 136.804 95.933 121.631 1.00 0.00 O ATOM 85894 H1 WAT 4054 137.361 96.458 122.205 1.00 0.00 H ATOM 85895 H2 WAT 4054 136.101 96.527 121.370 1.00 0.00 H TER 85897 WAT 4054 ATOM 85897 O WAT 4055 2.297 77.436 105.409 1.00 0.00 O ATOM 85898 H1 WAT 4055 2.298 76.612 105.896 1.00 0.00 H ATOM 85899 H2 WAT 4055 1.810 78.043 105.965 1.00 0.00 H TER 85901 WAT 4055 ATOM 85901 O WAT 4056 13.006 70.075 134.042 1.00 0.00 O ATOM 85902 H1 WAT 4056 13.365 70.962 134.010 1.00 0.00 H ATOM 85903 H2 WAT 4056 13.351 69.648 133.258 1.00 0.00 H TER 85905 WAT 4056 ATOM 85905 O WAT 4057 33.045 127.590 120.461 1.00 0.00 O ATOM 85906 H1 WAT 4057 32.283 128.070 120.134 1.00 0.00 H ATOM 85907 H2 WAT 4057 32.700 127.050 121.172 1.00 0.00 H TER 85909 WAT 4057 ATOM 85909 O WAT 4058 75.413 35.204 94.913 1.00 0.00 O ATOM 85910 H1 WAT 4058 75.764 35.063 95.792 1.00 0.00 H ATOM 85911 H2 WAT 4058 74.870 35.988 94.995 1.00 0.00 H TER 85913 WAT 4058 ATOM 85913 O WAT 4059 36.900 77.284 115.373 1.00 0.00 O ATOM 85914 H1 WAT 4059 36.578 77.851 116.074 1.00 0.00 H ATOM 85915 H2 WAT 4059 37.541 77.820 114.906 1.00 0.00 H TER 85917 WAT 4059 ATOM 85917 O WAT 4060 24.509 24.128 78.327 1.00 0.00 O ATOM 85918 H1 WAT 4060 23.638 24.505 78.448 1.00 0.00 H ATOM 85919 H2 WAT 4060 24.896 24.134 79.203 1.00 0.00 H TER 85921 WAT 4060 ATOM 85921 O WAT 4061 104.817 61.767 140.314 1.00 0.00 O ATOM 85922 H1 WAT 4061 104.100 62.363 140.531 1.00 0.00 H ATOM 85923 H2 WAT 4061 105.609 62.291 140.436 1.00 0.00 H TER 85925 WAT 4061 ATOM 85925 O WAT 4062 112.509 12.869 63.527 1.00 0.00 O ATOM 85926 H1 WAT 4062 111.643 12.507 63.341 1.00 0.00 H ATOM 85927 H2 WAT 4062 112.334 13.742 63.880 1.00 0.00 H TER 85929 WAT 4062 ATOM 85929 O WAT 4063 20.946 42.116 102.349 1.00 0.00 O ATOM 85930 H1 WAT 4063 21.582 42.322 101.665 1.00 0.00 H ATOM 85931 H2 WAT 4063 20.225 41.691 101.885 1.00 0.00 H TER 85933 WAT 4063 ATOM 85933 O WAT 4064 37.542 74.962 101.720 1.00 0.00 O ATOM 85934 H1 WAT 4064 38.110 74.302 102.119 1.00 0.00 H ATOM 85935 H2 WAT 4064 36.898 74.456 101.226 1.00 0.00 H TER 85937 WAT 4064 ATOM 85937 O WAT 4065 35.801 142.127 64.686 1.00 0.00 O ATOM 85938 H1 WAT 4065 35.200 142.579 65.277 1.00 0.00 H ATOM 85939 H2 WAT 4065 35.586 141.200 64.790 1.00 0.00 H TER 85941 WAT 4065 ATOM 85941 O WAT 4066 2.972 92.445 96.888 1.00 0.00 O ATOM 85942 H1 WAT 4066 2.944 91.489 96.932 1.00 0.00 H ATOM 85943 H2 WAT 4066 2.967 92.641 95.951 1.00 0.00 H TER 85945 WAT 4066 ATOM 85945 O WAT 4067 5.121 94.282 57.721 1.00 0.00 O ATOM 85946 H1 WAT 4067 5.257 94.646 56.847 1.00 0.00 H ATOM 85947 H2 WAT 4067 5.738 94.757 58.277 1.00 0.00 H TER 85949 WAT 4067 ATOM 85949 O WAT 4068 117.879 124.408 69.924 1.00 0.00 O ATOM 85950 H1 WAT 4068 117.514 124.892 69.183 1.00 0.00 H ATOM 85951 H2 WAT 4068 117.140 124.292 70.521 1.00 0.00 H TER 85953 WAT 4068 ATOM 85953 O WAT 4069 100.158 81.655 132.383 1.00 0.00 O ATOM 85954 H1 WAT 4069 100.859 81.090 132.707 1.00 0.00 H ATOM 85955 H2 WAT 4069 100.137 82.388 132.997 1.00 0.00 H TER 85957 WAT 4069 ATOM 85957 O WAT 4070 139.203 2.015 76.566 1.00 0.00 O ATOM 85958 H1 WAT 4070 138.471 2.171 77.163 1.00 0.00 H ATOM 85959 H2 WAT 4070 138.962 1.217 76.094 1.00 0.00 H TER 85961 WAT 4070 ATOM 85961 O WAT 4071 123.267 30.221 18.119 1.00 0.00 O ATOM 85962 H1 WAT 4071 123.643 29.999 18.971 1.00 0.00 H ATOM 85963 H2 WAT 4071 122.536 30.804 18.324 1.00 0.00 H TER 85965 WAT 4071 ATOM 85965 O WAT 4072 93.447 114.815 127.372 1.00 0.00 O ATOM 85966 H1 WAT 4072 93.812 114.875 128.254 1.00 0.00 H ATOM 85967 H2 WAT 4072 92.915 115.605 127.278 1.00 0.00 H TER 85969 WAT 4072 ATOM 85969 O WAT 4073 103.497 132.778 140.087 1.00 0.00 O ATOM 85970 H1 WAT 4073 103.100 133.442 140.652 1.00 0.00 H ATOM 85971 H2 WAT 4073 104.348 132.600 140.490 1.00 0.00 H TER 85973 WAT 4073 ATOM 85973 O WAT 4074 21.508 105.155 5.085 1.00 0.00 O ATOM 85974 H1 WAT 4074 21.070 105.412 4.274 1.00 0.00 H ATOM 85975 H2 WAT 4074 20.941 105.489 5.780 1.00 0.00 H TER 85977 WAT 4074 ATOM 85977 O WAT 4075 84.078 30.468 68.717 1.00 0.00 O ATOM 85978 H1 WAT 4075 84.530 30.014 68.007 1.00 0.00 H ATOM 85979 H2 WAT 4075 84.195 31.397 68.520 1.00 0.00 H TER 85981 WAT 4075 ATOM 85981 O WAT 4076 93.014 23.243 125.419 1.00 0.00 O ATOM 85982 H1 WAT 4076 92.423 23.115 124.676 1.00 0.00 H ATOM 85983 H2 WAT 4076 93.778 23.681 125.044 1.00 0.00 H TER 85985 WAT 4076 ATOM 85985 O WAT 4077 83.935 130.631 80.733 1.00 0.00 O ATOM 85986 H1 WAT 4077 83.524 130.095 80.054 1.00 0.00 H ATOM 85987 H2 WAT 4077 83.705 131.530 80.500 1.00 0.00 H TER 85989 WAT 4077 ATOM 85989 O WAT 4078 90.141 30.225 148.918 1.00 0.00 O ATOM 85990 H1 WAT 4078 90.938 30.313 149.440 1.00 0.00 H ATOM 85991 H2 WAT 4078 89.442 30.533 149.494 1.00 0.00 H TER 85993 WAT 4078 ATOM 85993 O WAT 4079 50.338 103.847 82.574 1.00 0.00 O ATOM 85994 H1 WAT 4079 51.273 104.052 82.582 1.00 0.00 H ATOM 85995 H2 WAT 4079 50.027 104.180 81.732 1.00 0.00 H TER 85997 WAT 4079 ATOM 85997 O WAT 4080 135.612 132.199 133.115 1.00 0.00 O ATOM 85998 H1 WAT 4080 135.554 131.244 133.132 1.00 0.00 H ATOM 85999 H2 WAT 4080 135.899 132.406 132.225 1.00 0.00 H TER 86001 WAT 4080 ATOM 86001 O WAT 4081 130.725 118.314 8.276 1.00 0.00 O ATOM 86002 H1 WAT 4081 130.827 118.179 9.218 1.00 0.00 H ATOM 86003 H2 WAT 4081 130.711 117.431 7.907 1.00 0.00 H TER 86005 WAT 4081 ATOM 86005 O WAT 4082 138.212 44.419 77.992 1.00 0.00 O ATOM 86006 H1 WAT 4082 139.051 44.062 77.700 1.00 0.00 H ATOM 86007 H2 WAT 4082 137.850 43.743 78.565 1.00 0.00 H TER 86009 WAT 4082 ATOM 86009 O WAT 4083 24.003 102.257 83.360 1.00 0.00 O ATOM 86010 H1 WAT 4083 23.745 102.715 82.560 1.00 0.00 H ATOM 86011 H2 WAT 4083 23.618 102.773 84.068 1.00 0.00 H TER 86013 WAT 4083 ATOM 86013 O WAT 4084 107.425 15.864 118.447 1.00 0.00 O ATOM 86014 H1 WAT 4084 106.886 16.362 117.832 1.00 0.00 H ATOM 86015 H2 WAT 4084 108.318 16.165 118.281 1.00 0.00 H TER 86017 WAT 4084 ATOM 86017 O WAT 4085 129.818 103.609 96.831 1.00 0.00 O ATOM 86018 H1 WAT 4085 129.430 103.651 97.705 1.00 0.00 H ATOM 86019 H2 WAT 4085 129.765 104.507 96.502 1.00 0.00 H TER 86021 WAT 4085 ATOM 86021 O WAT 4086 96.528 2.681 69.530 1.00 0.00 O ATOM 86022 H1 WAT 4086 97.026 2.932 68.752 1.00 0.00 H ATOM 86023 H2 WAT 4086 96.138 3.499 69.839 1.00 0.00 H TER 86025 WAT 4086 ATOM 86025 O WAT 4087 117.372 99.826 112.771 1.00 0.00 O ATOM 86026 H1 WAT 4087 116.462 99.929 112.490 1.00 0.00 H ATOM 86027 H2 WAT 4087 117.323 99.246 113.531 1.00 0.00 H TER 86029 WAT 4087 ATOM 86029 O WAT 4088 36.925 25.738 108.551 1.00 0.00 O ATOM 86030 H1 WAT 4088 36.216 25.103 108.652 1.00 0.00 H ATOM 86031 H2 WAT 4088 37.721 25.242 108.743 1.00 0.00 H TER 86033 WAT 4088 ATOM 86033 O WAT 4089 46.810 40.252 101.412 1.00 0.00 O ATOM 86034 H1 WAT 4089 46.559 39.411 101.030 1.00 0.00 H ATOM 86035 H2 WAT 4089 47.758 40.189 101.529 1.00 0.00 H TER 86037 WAT 4089 ATOM 86037 O WAT 4090 144.816 25.383 133.024 1.00 0.00 O ATOM 86038 H1 WAT 4090 144.267 24.674 133.359 1.00 0.00 H ATOM 86039 H2 WAT 4090 145.248 25.009 132.256 1.00 0.00 H TER 86041 WAT 4090 ATOM 86041 O WAT 4091 15.000 133.962 2.160 1.00 0.00 O ATOM 86042 H1 WAT 4091 14.936 133.034 1.931 1.00 0.00 H ATOM 86043 H2 WAT 4091 14.149 134.327 1.917 1.00 0.00 H TER 86045 WAT 4091 ATOM 86045 O WAT 4092 113.802 126.124 149.996 1.00 0.00 O ATOM 86046 H1 WAT 4092 113.547 126.948 149.580 1.00 0.00 H ATOM 86047 H2 WAT 4092 114.551 125.819 149.484 1.00 0.00 H TER 86049 WAT 4092 ATOM 86049 O WAT 4093 47.442 80.278 27.090 1.00 0.00 O ATOM 86050 H1 WAT 4093 48.164 79.685 26.882 1.00 0.00 H ATOM 86051 H2 WAT 4093 47.458 80.930 26.390 1.00 0.00 H TER 86053 WAT 4093 ATOM 86053 O WAT 4094 57.259 35.435 71.774 1.00 0.00 O ATOM 86054 H1 WAT 4094 56.665 35.775 71.105 1.00 0.00 H ATOM 86055 H2 WAT 4094 57.066 34.498 71.813 1.00 0.00 H TER 86057 WAT 4094 ATOM 86057 O WAT 4095 126.001 40.669 123.503 1.00 0.00 O ATOM 86058 H1 WAT 4095 125.477 39.914 123.771 1.00 0.00 H ATOM 86059 H2 WAT 4095 125.388 41.229 123.026 1.00 0.00 H TER 86061 WAT 4095 ATOM 86061 O WAT 4096 49.939 1.748 90.676 1.00 0.00 O ATOM 86062 H1 WAT 4096 50.376 2.582 90.504 1.00 0.00 H ATOM 86063 H2 WAT 4096 50.652 1.116 90.759 1.00 0.00 H TER 86065 WAT 4096 ATOM 86065 O WAT 4097 88.772 112.658 152.427 1.00 0.00 O ATOM 86066 H1 WAT 4097 88.853 111.809 152.862 1.00 0.00 H ATOM 86067 H2 WAT 4097 89.068 113.291 153.081 1.00 0.00 H TER 86069 WAT 4097 ATOM 86069 O WAT 4098 30.375 3.861 7.973 1.00 0.00 O ATOM 86070 H1 WAT 4098 30.624 2.982 7.689 1.00 0.00 H ATOM 86071 H2 WAT 4098 31.149 4.194 8.426 1.00 0.00 H TER 86073 WAT 4098 ATOM 86073 O WAT 4099 123.980 31.231 54.824 1.00 0.00 O ATOM 86074 H1 WAT 4099 123.268 30.594 54.878 1.00 0.00 H ATOM 86075 H2 WAT 4099 123.612 31.962 54.327 1.00 0.00 H TER 86077 WAT 4099 ATOM 86077 O WAT 4100 28.399 43.052 105.493 1.00 0.00 O ATOM 86078 H1 WAT 4100 29.220 42.973 105.977 1.00 0.00 H ATOM 86079 H2 WAT 4100 27.814 43.523 106.087 1.00 0.00 H TER 86081 WAT 4100 ATOM 86081 O WAT 4101 120.606 78.973 146.590 1.00 0.00 O ATOM 86082 H1 WAT 4101 120.051 79.482 147.181 1.00 0.00 H ATOM 86083 H2 WAT 4101 120.500 78.068 146.881 1.00 0.00 H TER 86085 WAT 4101 ATOM 86085 O WAT 4102 5.467 4.159 108.298 1.00 0.00 O ATOM 86086 H1 WAT 4102 4.602 4.095 108.704 1.00 0.00 H ATOM 86087 H2 WAT 4102 5.963 4.733 108.881 1.00 0.00 H TER 86089 WAT 4102 ATOM 86089 O WAT 4103 44.457 32.572 109.941 1.00 0.00 O ATOM 86090 H1 WAT 4103 44.583 32.103 109.116 1.00 0.00 H ATOM 86091 H2 WAT 4103 44.619 33.490 109.722 1.00 0.00 H TER 86093 WAT 4103 ATOM 86093 O WAT 4104 30.342 19.747 83.195 1.00 0.00 O ATOM 86094 H1 WAT 4104 31.213 20.135 83.275 1.00 0.00 H ATOM 86095 H2 WAT 4104 29.744 20.443 83.468 1.00 0.00 H TER 86097 WAT 4104 ATOM 86097 O WAT 4105 75.469 144.416 147.305 1.00 0.00 O ATOM 86098 H1 WAT 4105 76.250 144.668 146.813 1.00 0.00 H ATOM 86099 H2 WAT 4105 74.739 144.662 146.737 1.00 0.00 H TER 86101 WAT 4105 ATOM 86101 O WAT 4106 61.453 87.556 109.375 1.00 0.00 O ATOM 86102 H1 WAT 4106 61.385 87.061 110.191 1.00 0.00 H ATOM 86103 H2 WAT 4106 60.614 87.413 108.937 1.00 0.00 H TER 86105 WAT 4106 ATOM 86105 O WAT 4107 109.709 35.726 156.230 1.00 0.00 O ATOM 86106 H1 WAT 4107 109.479 36.030 157.108 1.00 0.00 H ATOM 86107 H2 WAT 4107 109.714 36.520 155.695 1.00 0.00 H TER 86109 WAT 4107 ATOM 86109 O WAT 4108 100.139 116.025 5.680 1.00 0.00 O ATOM 86110 H1 WAT 4108 101.059 116.270 5.579 1.00 0.00 H ATOM 86111 H2 WAT 4108 99.854 115.795 4.796 1.00 0.00 H TER 86113 WAT 4108 ATOM 86113 O WAT 4109 14.448 123.519 116.305 1.00 0.00 O ATOM 86114 H1 WAT 4109 13.936 124.071 115.713 1.00 0.00 H ATOM 86115 H2 WAT 4109 13.815 123.211 116.953 1.00 0.00 H TER 86117 WAT 4109 ATOM 86117 O WAT 4110 68.235 29.746 137.856 1.00 0.00 O ATOM 86118 H1 WAT 4110 67.558 29.675 137.183 1.00 0.00 H ATOM 86119 H2 WAT 4110 68.962 29.223 137.521 1.00 0.00 H TER 86121 WAT 4110 ATOM 86121 O WAT 4111 112.356 106.850 123.781 1.00 0.00 O ATOM 86122 H1 WAT 4111 111.850 106.113 124.123 1.00 0.00 H ATOM 86123 H2 WAT 4111 111.778 107.259 123.136 1.00 0.00 H TER 86125 WAT 4111 ATOM 86125 O WAT 4112 115.408 39.196 124.541 1.00 0.00 O ATOM 86126 H1 WAT 4112 114.785 39.404 123.844 1.00 0.00 H ATOM 86127 H2 WAT 4112 115.173 38.310 124.815 1.00 0.00 H TER 86129 WAT 4112 ATOM 86129 O WAT 4113 38.278 122.192 129.939 1.00 0.00 O ATOM 86130 H1 WAT 4113 37.491 121.869 129.500 1.00 0.00 H ATOM 86131 H2 WAT 4113 38.985 122.027 129.316 1.00 0.00 H TER 86133 WAT 4113 ATOM 86133 O WAT 4114 78.134 110.768 112.907 1.00 0.00 O ATOM 86134 H1 WAT 4114 78.407 110.074 112.307 1.00 0.00 H ATOM 86135 H2 WAT 4114 78.352 111.580 112.450 1.00 0.00 H TER 86137 WAT 4114 ATOM 86137 O WAT 4115 122.289 143.758 118.097 1.00 0.00 O ATOM 86138 H1 WAT 4115 121.832 144.430 118.603 1.00 0.00 H ATOM 86139 H2 WAT 4115 121.727 142.986 118.161 1.00 0.00 H TER 86141 WAT 4115 ATOM 86141 O WAT 4116 128.730 143.699 87.811 1.00 0.00 O ATOM 86142 H1 WAT 4116 129.462 144.199 87.451 1.00 0.00 H ATOM 86143 H2 WAT 4116 128.028 144.341 87.913 1.00 0.00 H TER 86145 WAT 4116 ATOM 86145 O WAT 4117 9.881 140.824 85.115 1.00 0.00 O ATOM 86146 H1 WAT 4117 9.662 141.171 85.980 1.00 0.00 H ATOM 86147 H2 WAT 4117 10.478 140.098 85.292 1.00 0.00 H TER 86149 WAT 4117 ATOM 86149 O WAT 4118 45.229 22.929 136.473 1.00 0.00 O ATOM 86150 H1 WAT 4118 44.284 22.820 136.366 1.00 0.00 H ATOM 86151 H2 WAT 4118 45.372 23.873 136.400 1.00 0.00 H TER 86153 WAT 4118 ATOM 86153 O WAT 4119 35.544 142.231 61.903 1.00 0.00 O ATOM 86154 H1 WAT 4119 34.596 142.316 61.800 1.00 0.00 H ATOM 86155 H2 WAT 4119 35.691 142.313 62.845 1.00 0.00 H TER 86157 WAT 4119 ATOM 86157 O WAT 4120 138.941 10.977 12.533 1.00 0.00 O ATOM 86158 H1 WAT 4120 139.003 11.181 13.466 1.00 0.00 H ATOM 86159 H2 WAT 4120 138.071 10.592 12.429 1.00 0.00 H TER 86161 WAT 4120 ATOM 86161 O WAT 4121 28.690 140.949 135.287 1.00 0.00 O ATOM 86162 H1 WAT 4121 28.483 140.159 135.786 1.00 0.00 H ATOM 86163 H2 WAT 4121 28.622 141.660 135.925 1.00 0.00 H TER 86165 WAT 4121 ATOM 86165 O WAT 4122 80.766 48.327 55.640 1.00 0.00 O ATOM 86166 H1 WAT 4122 80.601 47.386 55.581 1.00 0.00 H ATOM 86167 H2 WAT 4122 79.914 48.731 55.475 1.00 0.00 H TER 86169 WAT 4122 ATOM 86169 O WAT 4123 130.588 141.458 15.066 1.00 0.00 O ATOM 86170 H1 WAT 4123 130.430 140.651 15.555 1.00 0.00 H ATOM 86171 H2 WAT 4123 131.531 141.459 14.903 1.00 0.00 H TER 86173 WAT 4123 ATOM 86173 O WAT 4124 82.621 52.935 155.360 1.00 0.00 O ATOM 86174 H1 WAT 4124 82.969 53.337 156.156 1.00 0.00 H ATOM 86175 H2 WAT 4124 82.634 51.995 155.542 1.00 0.00 H TER 86177 WAT 4124 ATOM 86177 O WAT 4125 137.261 106.387 122.493 1.00 0.00 O ATOM 86178 H1 WAT 4125 137.058 106.911 121.718 1.00 0.00 H ATOM 86179 H2 WAT 4125 136.552 105.746 122.541 1.00 0.00 H TER 86181 WAT 4125 ATOM 86181 O WAT 4126 83.230 120.059 75.874 1.00 0.00 O ATOM 86182 H1 WAT 4126 83.006 120.233 74.960 1.00 0.00 H ATOM 86183 H2 WAT 4126 84.184 119.983 75.876 1.00 0.00 H TER 86185 WAT 4126 ATOM 86185 O WAT 4127 79.181 62.670 107.906 1.00 0.00 O ATOM 86186 H1 WAT 4127 78.574 63.099 107.303 1.00 0.00 H ATOM 86187 H2 WAT 4127 80.007 62.628 107.424 1.00 0.00 H TER 86189 WAT 4127 ATOM 86189 O WAT 4128 122.176 116.942 17.865 1.00 0.00 O ATOM 86190 H1 WAT 4128 122.272 117.242 16.961 1.00 0.00 H ATOM 86191 H2 WAT 4128 122.955 116.408 18.024 1.00 0.00 H TER 86193 WAT 4128 ATOM 86193 O WAT 4129 46.509 120.755 93.970 1.00 0.00 O ATOM 86194 H1 WAT 4129 47.073 120.181 94.488 1.00 0.00 H ATOM 86195 H2 WAT 4129 46.457 121.563 94.479 1.00 0.00 H TER 86197 WAT 4129 ATOM 86197 O WAT 4130 59.984 39.398 10.625 1.00 0.00 O ATOM 86198 H1 WAT 4130 60.322 38.857 9.911 1.00 0.00 H ATOM 86199 H2 WAT 4130 60.441 39.080 11.403 1.00 0.00 H TER 86201 WAT 4130 ATOM 86201 O WAT 4131 15.824 45.080 60.914 1.00 0.00 O ATOM 86202 H1 WAT 4131 15.166 45.774 60.963 1.00 0.00 H ATOM 86203 H2 WAT 4131 15.343 44.317 60.595 1.00 0.00 H TER 86205 WAT 4131 ATOM 86205 O WAT 4132 92.293 32.583 0.570 1.00 0.00 O ATOM 86206 H1 WAT 4132 92.757 31.746 0.592 1.00 0.00 H ATOM 86207 H2 WAT 4132 92.984 33.239 0.481 1.00 0.00 H TER 86209 WAT 4132 ATOM 86209 O WAT 4133 112.378 121.863 65.590 1.00 0.00 O ATOM 86210 H1 WAT 4133 112.005 122.414 66.278 1.00 0.00 H ATOM 86211 H2 WAT 4133 112.348 120.977 65.950 1.00 0.00 H TER 86213 WAT 4133 ATOM 86213 O WAT 4134 7.348 43.639 97.765 1.00 0.00 O ATOM 86214 H1 WAT 4134 6.941 42.798 97.557 1.00 0.00 H ATOM 86215 H2 WAT 4134 8.243 43.415 98.020 1.00 0.00 H TER 86217 WAT 4134 ATOM 86217 O WAT 4135 120.124 43.399 134.851 1.00 0.00 O ATOM 86218 H1 WAT 4135 119.658 43.567 134.032 1.00 0.00 H ATOM 86219 H2 WAT 4135 120.780 42.741 134.622 1.00 0.00 H TER 86221 WAT 4135 ATOM 86221 O WAT 4136 130.722 48.967 140.422 1.00 0.00 O ATOM 86222 H1 WAT 4136 130.068 49.138 141.099 1.00 0.00 H ATOM 86223 H2 WAT 4136 131.503 48.698 140.906 1.00 0.00 H TER 86225 WAT 4136 ATOM 86225 O WAT 4137 32.882 1.991 128.813 1.00 0.00 O ATOM 86226 H1 WAT 4137 32.740 2.785 129.328 1.00 0.00 H ATOM 86227 H2 WAT 4137 32.006 1.732 128.527 1.00 0.00 H TER 86229 WAT 4137 ATOM 86229 O WAT 4138 19.965 8.754 72.896 1.00 0.00 O ATOM 86230 H1 WAT 4138 20.223 9.646 72.665 1.00 0.00 H ATOM 86231 H2 WAT 4138 20.754 8.232 72.754 1.00 0.00 H TER 86233 WAT 4138 ATOM 86233 O WAT 4139 145.364 133.818 67.067 1.00 0.00 O ATOM 86234 H1 WAT 4139 145.257 133.386 67.915 1.00 0.00 H ATOM 86235 H2 WAT 4139 146.262 134.150 67.079 1.00 0.00 H TER 86237 WAT 4139 ATOM 86237 O WAT 4140 86.393 61.321 13.765 1.00 0.00 O ATOM 86238 H1 WAT 4140 85.484 61.594 13.891 1.00 0.00 H ATOM 86239 H2 WAT 4140 86.531 61.381 12.820 1.00 0.00 H TER 86241 WAT 4140 ATOM 86241 O WAT 4141 71.694 104.299 58.407 1.00 0.00 O ATOM 86242 H1 WAT 4141 70.847 104.744 58.367 1.00 0.00 H ATOM 86243 H2 WAT 4141 72.335 105.008 58.453 1.00 0.00 H TER 86245 WAT 4141 ATOM 86245 O WAT 4142 67.601 47.946 76.947 1.00 0.00 O ATOM 86246 H1 WAT 4142 67.443 47.919 77.891 1.00 0.00 H ATOM 86247 H2 WAT 4142 66.730 48.030 76.560 1.00 0.00 H TER 86249 WAT 4142 ATOM 86249 O WAT 4143 129.073 145.087 97.915 1.00 0.00 O ATOM 86250 H1 WAT 4143 128.736 144.937 97.032 1.00 0.00 H ATOM 86251 H2 WAT 4143 128.385 144.758 98.494 1.00 0.00 H TER 86253 WAT 4143 ATOM 86253 O WAT 4144 2.636 21.302 62.882 1.00 0.00 O ATOM 86254 H1 WAT 4144 2.005 21.268 62.163 1.00 0.00 H ATOM 86255 H2 WAT 4144 3.458 21.002 62.494 1.00 0.00 H TER 86257 WAT 4144 ATOM 86257 O WAT 4145 109.284 136.878 75.760 1.00 0.00 O ATOM 86258 H1 WAT 4145 110.002 137.508 75.816 1.00 0.00 H ATOM 86259 H2 WAT 4145 108.495 137.402 75.898 1.00 0.00 H TER 86261 WAT 4145 ATOM 86261 O WAT 4146 106.992 104.020 59.700 1.00 0.00 O ATOM 86262 H1 WAT 4146 107.492 103.912 60.509 1.00 0.00 H ATOM 86263 H2 WAT 4146 106.716 103.133 59.469 1.00 0.00 H TER 86265 WAT 4146 ATOM 86265 O WAT 4147 72.683 107.908 154.227 1.00 0.00 O ATOM 86266 H1 WAT 4147 72.410 107.152 153.707 1.00 0.00 H ATOM 86267 H2 WAT 4147 73.473 107.613 154.680 1.00 0.00 H TER 86269 WAT 4147 ATOM 86269 O WAT 4148 49.108 77.449 6.365 1.00 0.00 O ATOM 86270 H1 WAT 4148 48.575 78.243 6.386 1.00 0.00 H ATOM 86271 H2 WAT 4148 49.947 77.712 6.743 1.00 0.00 H TER 86273 WAT 4148 ATOM 86273 O WAT 4149 116.884 145.475 103.365 1.00 0.00 O ATOM 86274 H1 WAT 4149 117.415 145.089 102.669 1.00 0.00 H ATOM 86275 H2 WAT 4149 116.249 144.794 103.588 1.00 0.00 H TER 86277 WAT 4149 ATOM 86277 O WAT 4150 106.321 17.647 127.940 1.00 0.00 O ATOM 86278 H1 WAT 4150 106.676 18.473 127.612 1.00 0.00 H ATOM 86279 H2 WAT 4150 106.431 17.699 128.889 1.00 0.00 H TER 86281 WAT 4150 ATOM 86281 O WAT 4151 0.600 45.393 10.850 1.00 0.00 O ATOM 86282 H1 WAT 4151 0.356 45.053 11.710 1.00 0.00 H ATOM 86283 H2 WAT 4151 1.144 46.157 11.040 1.00 0.00 H TER 86285 WAT 4151 ATOM 86285 O WAT 4152 11.726 52.251 79.959 1.00 0.00 O ATOM 86286 H1 WAT 4152 11.673 52.983 79.344 1.00 0.00 H ATOM 86287 H2 WAT 4152 12.596 52.331 80.351 1.00 0.00 H TER 86289 WAT 4152 ATOM 86289 O WAT 4153 82.602 120.433 8.728 1.00 0.00 O ATOM 86290 H1 WAT 4153 83.551 120.318 8.779 1.00 0.00 H ATOM 86291 H2 WAT 4153 82.354 120.013 7.904 1.00 0.00 H TER 86293 WAT 4153 ATOM 86293 O WAT 4154 98.596 29.884 79.857 1.00 0.00 O ATOM 86294 H1 WAT 4154 99.155 30.404 80.434 1.00 0.00 H ATOM 86295 H2 WAT 4154 98.352 29.123 80.384 1.00 0.00 H TER 86297 WAT 4154 ATOM 86297 O WAT 4155 61.467 15.154 119.841 1.00 0.00 O ATOM 86298 H1 WAT 4155 60.777 14.503 119.714 1.00 0.00 H ATOM 86299 H2 WAT 4155 61.590 15.191 120.789 1.00 0.00 H TER 86301 WAT 4155 ATOM 86301 O WAT 4156 135.434 110.031 121.479 1.00 0.00 O ATOM 86302 H1 WAT 4156 134.637 110.543 121.617 1.00 0.00 H ATOM 86303 H2 WAT 4156 135.869 110.029 122.331 1.00 0.00 H TER 86305 WAT 4156 ATOM 86305 O WAT 4157 10.971 133.523 119.242 1.00 0.00 O ATOM 86306 H1 WAT 4157 10.289 132.857 119.157 1.00 0.00 H ATOM 86307 H2 WAT 4157 10.899 134.042 118.440 1.00 0.00 H TER 86309 WAT 4157 ATOM 86309 O WAT 4158 62.548 87.800 105.214 1.00 0.00 O ATOM 86310 H1 WAT 4158 61.799 87.324 104.855 1.00 0.00 H ATOM 86311 H2 WAT 4158 62.242 88.704 105.291 1.00 0.00 H TER 86313 WAT 4158 ATOM 86313 O WAT 4159 114.617 122.958 149.538 1.00 0.00 O ATOM 86314 H1 WAT 4159 114.749 122.951 148.590 1.00 0.00 H ATOM 86315 H2 WAT 4159 115.288 123.555 149.869 1.00 0.00 H TER 86317 WAT 4159 ATOM 86317 O WAT 4160 95.891 62.944 12.078 1.00 0.00 O ATOM 86318 H1 WAT 4160 96.422 63.601 11.628 1.00 0.00 H ATOM 86319 H2 WAT 4160 96.240 62.106 11.774 1.00 0.00 H TER 86321 WAT 4160 ATOM 86321 O WAT 4161 107.915 132.044 99.798 1.00 0.00 O ATOM 86322 H1 WAT 4161 107.596 132.700 99.178 1.00 0.00 H ATOM 86323 H2 WAT 4161 108.242 132.554 100.539 1.00 0.00 H TER 86325 WAT 4161 ATOM 86325 O WAT 4162 120.526 122.988 143.694 1.00 0.00 O ATOM 86326 H1 WAT 4162 119.859 122.390 144.030 1.00 0.00 H ATOM 86327 H2 WAT 4162 120.274 123.846 144.035 1.00 0.00 H TER 86329 WAT 4162 ATOM 86329 O WAT 4163 86.437 72.407 25.231 1.00 0.00 O ATOM 86330 H1 WAT 4163 85.939 72.572 24.431 1.00 0.00 H ATOM 86331 H2 WAT 4163 87.297 72.119 24.923 1.00 0.00 H TER 86333 WAT 4163 ATOM 86333 O WAT 4164 130.025 66.262 17.934 1.00 0.00 O ATOM 86334 H1 WAT 4164 129.869 66.881 17.221 1.00 0.00 H ATOM 86335 H2 WAT 4164 129.900 66.778 18.730 1.00 0.00 H TER 86337 WAT 4164 ATOM 86337 O WAT 4165 90.379 141.857 108.271 1.00 0.00 O ATOM 86338 H1 WAT 4165 89.545 142.264 108.035 1.00 0.00 H ATOM 86339 H2 WAT 4165 90.664 142.330 109.053 1.00 0.00 H TER 86341 WAT 4165 ATOM 86341 O WAT 4166 105.004 44.452 71.104 1.00 0.00 O ATOM 86342 H1 WAT 4166 104.938 44.171 70.191 1.00 0.00 H ATOM 86343 H2 WAT 4166 105.086 43.637 71.599 1.00 0.00 H TER 86345 WAT 4166 ATOM 86345 O WAT 4167 28.297 28.481 16.947 1.00 0.00 O ATOM 86346 H1 WAT 4167 27.612 29.123 16.761 1.00 0.00 H ATOM 86347 H2 WAT 4167 28.816 28.446 16.143 1.00 0.00 H TER 86349 WAT 4167 ATOM 86349 O WAT 4168 125.128 120.944 113.877 1.00 0.00 O ATOM 86350 H1 WAT 4168 125.156 120.361 114.635 1.00 0.00 H ATOM 86351 H2 WAT 4168 125.068 121.823 114.252 1.00 0.00 H TER 86353 WAT 4168 ATOM 86353 O WAT 4169 31.256 70.794 86.466 1.00 0.00 O ATOM 86354 H1 WAT 4169 31.108 71.739 86.430 1.00 0.00 H ATOM 86355 H2 WAT 4169 31.848 70.616 85.735 1.00 0.00 H TER 86357 WAT 4169 ATOM 86357 O WAT 4170 141.211 1.124 113.545 1.00 0.00 O ATOM 86358 H1 WAT 4170 141.661 0.488 114.101 1.00 0.00 H ATOM 86359 H2 WAT 4170 140.281 0.972 113.712 1.00 0.00 H TER 86361 WAT 4170 ATOM 86361 O WAT 4171 111.634 59.457 91.804 1.00 0.00 O ATOM 86362 H1 WAT 4171 111.701 58.689 92.372 1.00 0.00 H ATOM 86363 H2 WAT 4171 112.076 60.153 92.290 1.00 0.00 H TER 86365 WAT 4171 ATOM 86365 O WAT 4172 103.918 50.721 145.614 1.00 0.00 O ATOM 86366 H1 WAT 4172 103.795 49.812 145.340 1.00 0.00 H ATOM 86367 H2 WAT 4172 104.653 51.033 145.086 1.00 0.00 H TER 86369 WAT 4172 ATOM 86369 O WAT 4173 26.507 6.423 157.350 1.00 0.00 O ATOM 86370 H1 WAT 4173 27.320 6.695 157.776 1.00 0.00 H ATOM 86371 H2 WAT 4173 26.781 6.119 156.485 1.00 0.00 H TER 86373 WAT 4173 ATOM 86373 O WAT 4174 47.326 9.200 153.303 1.00 0.00 O ATOM 86374 H1 WAT 4174 47.353 8.290 153.598 1.00 0.00 H ATOM 86375 H2 WAT 4174 48.190 9.548 153.520 1.00 0.00 H TER 86377 WAT 4174 ATOM 86377 O WAT 4175 97.889 18.958 152.137 1.00 0.00 O ATOM 86378 H1 WAT 4175 98.561 19.266 151.528 1.00 0.00 H ATOM 86379 H2 WAT 4175 97.572 19.753 152.566 1.00 0.00 H TER 86381 WAT 4175 ATOM 86381 O WAT 4176 92.369 45.973 64.862 1.00 0.00 O ATOM 86382 H1 WAT 4176 91.588 45.430 64.971 1.00 0.00 H ATOM 86383 H2 WAT 4176 92.804 45.614 64.088 1.00 0.00 H TER 86385 WAT 4176 ATOM 86385 O WAT 4177 32.623 36.128 67.409 1.00 0.00 O ATOM 86386 H1 WAT 4177 32.674 36.284 66.466 1.00 0.00 H ATOM 86387 H2 WAT 4177 33.458 36.446 67.750 1.00 0.00 H TER 86389 WAT 4177 ATOM 86389 O WAT 4178 88.889 105.698 119.024 1.00 0.00 O ATOM 86390 H1 WAT 4178 89.569 106.172 118.545 1.00 0.00 H ATOM 86391 H2 WAT 4178 88.433 106.374 119.525 1.00 0.00 H TER 86393 WAT 4178 ATOM 86393 O WAT 4179 91.121 4.321 145.428 1.00 0.00 O ATOM 86394 H1 WAT 4179 91.262 4.076 146.342 1.00 0.00 H ATOM 86395 H2 WAT 4179 90.475 3.691 145.108 1.00 0.00 H TER 86397 WAT 4179 ATOM 86397 O WAT 4180 100.128 39.685 62.442 1.00 0.00 O ATOM 86398 H1 WAT 4180 100.339 40.478 61.949 1.00 0.00 H ATOM 86399 H2 WAT 4180 100.941 39.179 62.441 1.00 0.00 H TER 86401 WAT 4180 ATOM 86401 O WAT 4181 112.271 11.816 125.644 1.00 0.00 O ATOM 86402 H1 WAT 4181 112.296 12.039 124.713 1.00 0.00 H ATOM 86403 H2 WAT 4181 112.393 10.867 125.666 1.00 0.00 H TER 86405 WAT 4181 ATOM 86405 O WAT 4182 70.676 46.831 148.501 1.00 0.00 O ATOM 86406 H1 WAT 4182 71.314 47.430 148.888 1.00 0.00 H ATOM 86407 H2 WAT 4182 70.204 47.365 147.862 1.00 0.00 H TER 86409 WAT 4182 ATOM 86409 O WAT 4183 3.185 82.300 90.400 1.00 0.00 O ATOM 86410 H1 WAT 4183 3.857 82.728 90.930 1.00 0.00 H ATOM 86411 H2 WAT 4183 3.383 81.367 90.468 1.00 0.00 H TER 86413 WAT 4183 ATOM 86413 O WAT 4184 16.331 64.031 0.194 1.00 0.00 O ATOM 86414 H1 WAT 4184 17.076 63.922 0.785 1.00 0.00 H ATOM 86415 H2 WAT 4184 15.596 64.240 0.771 1.00 0.00 H TER 86417 WAT 4184 ATOM 86417 O WAT 4185 19.159 107.851 65.479 1.00 0.00 O ATOM 86418 H1 WAT 4185 19.805 107.870 66.185 1.00 0.00 H ATOM 86419 H2 WAT 4185 19.660 107.600 64.703 1.00 0.00 H TER 86421 WAT 4185 ATOM 86421 O WAT 4186 117.259 83.535 16.602 1.00 0.00 O ATOM 86422 H1 WAT 4186 117.962 84.141 16.834 1.00 0.00 H ATOM 86423 H2 WAT 4186 116.548 84.098 16.295 1.00 0.00 H TER 86425 WAT 4186 ATOM 86425 O WAT 4187 58.736 85.124 22.005 1.00 0.00 O ATOM 86426 H1 WAT 4187 58.516 84.950 22.920 1.00 0.00 H ATOM 86427 H2 WAT 4187 58.124 85.809 21.737 1.00 0.00 H TER 86429 WAT 4187 ATOM 86429 O WAT 4188 121.709 39.664 13.252 1.00 0.00 O ATOM 86430 H1 WAT 4188 122.067 40.504 12.966 1.00 0.00 H ATOM 86431 H2 WAT 4188 121.331 39.282 12.460 1.00 0.00 H TER 86433 WAT 4188 ATOM 86433 O WAT 4189 70.987 77.840 15.526 1.00 0.00 O ATOM 86434 H1 WAT 4189 71.394 77.456 16.302 1.00 0.00 H ATOM 86435 H2 WAT 4189 70.090 78.036 15.798 1.00 0.00 H TER 86437 WAT 4189 ATOM 86437 O WAT 4190 50.617 17.799 84.323 1.00 0.00 O ATOM 86438 H1 WAT 4190 50.727 17.651 83.384 1.00 0.00 H ATOM 86439 H2 WAT 4190 51.430 17.479 84.713 1.00 0.00 H TER 86441 WAT 4190 ATOM 86441 O WAT 4191 16.883 117.263 76.733 1.00 0.00 O ATOM 86442 H1 WAT 4191 16.716 117.087 77.659 1.00 0.00 H ATOM 86443 H2 WAT 4191 16.021 117.204 76.320 1.00 0.00 H TER 86445 WAT 4191 ATOM 86445 O WAT 4192 141.704 5.091 0.741 1.00 0.00 O ATOM 86446 H1 WAT 4192 141.614 5.809 1.367 1.00 0.00 H ATOM 86447 H2 WAT 4192 141.720 4.302 1.283 1.00 0.00 H TER 86449 WAT 4192 ATOM 86449 O WAT 4193 109.616 112.540 88.007 1.00 0.00 O ATOM 86450 H1 WAT 4193 110.247 113.191 87.699 1.00 0.00 H ATOM 86451 H2 WAT 4193 108.871 113.055 88.316 1.00 0.00 H TER 86453 WAT 4193 ATOM 86453 O WAT 4194 124.160 57.013 24.835 1.00 0.00 O ATOM 86454 H1 WAT 4194 124.372 57.897 25.134 1.00 0.00 H ATOM 86455 H2 WAT 4194 124.043 56.509 25.640 1.00 0.00 H TER 86457 WAT 4194 ATOM 86457 O WAT 4195 108.677 41.822 85.821 1.00 0.00 O ATOM 86458 H1 WAT 4195 108.906 42.195 86.672 1.00 0.00 H ATOM 86459 H2 WAT 4195 108.339 42.562 85.318 1.00 0.00 H TER 86461 WAT 4195 ATOM 86461 O WAT 4196 100.750 39.812 86.095 1.00 0.00 O ATOM 86462 H1 WAT 4196 99.884 39.512 86.373 1.00 0.00 H ATOM 86463 H2 WAT 4196 101.098 40.276 86.856 1.00 0.00 H TER 86465 WAT 4196 ATOM 86465 O WAT 4197 46.859 3.483 127.640 1.00 0.00 O ATOM 86466 H1 WAT 4197 46.132 3.206 127.083 1.00 0.00 H ATOM 86467 H2 WAT 4197 46.919 4.429 127.503 1.00 0.00 H TER 86469 WAT 4197 ATOM 86469 O WAT 4198 17.046 109.934 1.524 1.00 0.00 O ATOM 86470 H1 WAT 4198 16.788 109.159 2.023 1.00 0.00 H ATOM 86471 H2 WAT 4198 16.693 110.670 2.025 1.00 0.00 H TER 86473 WAT 4198 ATOM 86473 O WAT 4199 79.057 39.866 113.783 1.00 0.00 O ATOM 86474 H1 WAT 4199 78.589 40.240 114.529 1.00 0.00 H ATOM 86475 H2 WAT 4199 79.567 39.147 114.155 1.00 0.00 H TER 86477 WAT 4199 ATOM 86477 O WAT 4200 122.453 126.629 110.304 1.00 0.00 O ATOM 86478 H1 WAT 4200 123.304 126.202 110.407 1.00 0.00 H ATOM 86479 H2 WAT 4200 122.662 127.557 110.204 1.00 0.00 H TER 86481 WAT 4200 ATOM 86481 O WAT 4201 51.644 7.242 1.164 1.00 0.00 O ATOM 86482 H1 WAT 4201 52.395 7.599 1.638 1.00 0.00 H ATOM 86483 H2 WAT 4201 51.414 6.446 1.644 1.00 0.00 H TER 86485 WAT 4201 ATOM 86485 O WAT 4202 11.459 95.689 110.621 1.00 0.00 O ATOM 86486 H1 WAT 4202 10.881 96.451 110.572 1.00 0.00 H ATOM 86487 H2 WAT 4202 11.300 95.323 111.491 1.00 0.00 H TER 86489 WAT 4202 ATOM 86489 O WAT 4203 71.747 55.010 12.193 1.00 0.00 O ATOM 86490 H1 WAT 4203 71.056 55.538 12.593 1.00 0.00 H ATOM 86491 H2 WAT 4203 72.013 54.402 12.883 1.00 0.00 H TER 86493 WAT 4203 ATOM 86493 O WAT 4204 12.731 142.915 58.136 1.00 0.00 O ATOM 86494 H1 WAT 4204 12.713 142.567 59.028 1.00 0.00 H ATOM 86495 H2 WAT 4204 12.316 142.235 57.605 1.00 0.00 H TER 86497 WAT 4204 ATOM 86497 O WAT 4205 69.948 84.536 148.304 1.00 0.00 O ATOM 86498 H1 WAT 4205 69.460 85.258 147.907 1.00 0.00 H ATOM 86499 H2 WAT 4205 69.370 83.778 148.215 1.00 0.00 H TER 86501 WAT 4205 ATOM 86501 O WAT 4206 28.168 109.989 68.497 1.00 0.00 O ATOM 86502 H1 WAT 4206 27.904 109.279 67.911 1.00 0.00 H ATOM 86503 H2 WAT 4206 27.788 110.776 68.106 1.00 0.00 H TER 86505 WAT 4206 ATOM 86505 O WAT 4207 62.070 61.415 84.755 1.00 0.00 O ATOM 86506 H1 WAT 4207 61.929 62.358 84.670 1.00 0.00 H ATOM 86507 H2 WAT 4207 62.703 61.331 85.468 1.00 0.00 H TER 86509 WAT 4207 ATOM 86509 O WAT 4208 101.818 71.222 96.484 1.00 0.00 O ATOM 86510 H1 WAT 4208 101.976 71.947 97.089 1.00 0.00 H ATOM 86511 H2 WAT 4208 101.908 71.612 95.615 1.00 0.00 H TER 86513 WAT 4208 ATOM 86513 O WAT 4209 45.960 109.262 65.773 1.00 0.00 O ATOM 86514 H1 WAT 4209 45.371 108.767 66.343 1.00 0.00 H ATOM 86515 H2 WAT 4209 46.657 109.566 66.354 1.00 0.00 H TER 86517 WAT 4209 ATOM 86517 O WAT 4210 41.310 41.206 109.177 1.00 0.00 O ATOM 86518 H1 WAT 4210 41.384 40.477 109.792 1.00 0.00 H ATOM 86519 H2 WAT 4210 41.623 41.966 109.667 1.00 0.00 H TER 86521 WAT 4210 ATOM 86521 O WAT 4211 22.523 13.943 86.934 1.00 0.00 O ATOM 86522 H1 WAT 4211 23.034 14.732 87.118 1.00 0.00 H ATOM 86523 H2 WAT 4211 23.062 13.447 86.318 1.00 0.00 H TER 86525 WAT 4211 ATOM 86525 O WAT 4212 40.630 62.940 67.254 1.00 0.00 O ATOM 86526 H1 WAT 4212 40.790 63.451 68.047 1.00 0.00 H ATOM 86527 H2 WAT 4212 40.013 62.261 67.526 1.00 0.00 H TER 86529 WAT 4212 ATOM 86529 O WAT 4213 104.028 36.679 100.967 1.00 0.00 O ATOM 86530 H1 WAT 4213 104.468 37.522 100.860 1.00 0.00 H ATOM 86531 H2 WAT 4213 104.728 36.031 100.884 1.00 0.00 H TER 86533 WAT 4213 ATOM 86533 O WAT 4214 103.018 33.298 158.365 1.00 0.00 O ATOM 86534 H1 WAT 4214 102.886 34.208 158.630 1.00 0.00 H ATOM 86535 H2 WAT 4214 103.937 33.121 158.565 1.00 0.00 H TER 86537 WAT 4214 ATOM 86537 O WAT 4215 22.770 20.193 76.846 1.00 0.00 O ATOM 86538 H1 WAT 4215 23.160 21.066 76.855 1.00 0.00 H ATOM 86539 H2 WAT 4215 23.295 19.702 76.213 1.00 0.00 H TER 86541 WAT 4215 ATOM 86541 O WAT 4216 15.729 116.356 22.602 1.00 0.00 O ATOM 86542 H1 WAT 4216 16.233 117.138 22.828 1.00 0.00 H ATOM 86543 H2 WAT 4216 14.923 116.435 23.114 1.00 0.00 H TER 86545 WAT 4216 ATOM 86545 O WAT 4217 94.895 11.197 156.059 1.00 0.00 O ATOM 86546 H1 WAT 4217 94.320 11.203 156.825 1.00 0.00 H ATOM 86547 H2 WAT 4217 94.341 11.504 155.341 1.00 0.00 H TER 86549 WAT 4217 ATOM 86549 O WAT 4218 29.679 15.292 104.758 1.00 0.00 O ATOM 86550 H1 WAT 4218 30.582 15.568 104.598 1.00 0.00 H ATOM 86551 H2 WAT 4218 29.763 14.464 105.231 1.00 0.00 H TER 86553 WAT 4218 ATOM 86553 O WAT 4219 67.586 124.068 62.309 1.00 0.00 O ATOM 86554 H1 WAT 4219 67.202 124.855 61.922 1.00 0.00 H ATOM 86555 H2 WAT 4219 67.786 123.506 61.561 1.00 0.00 H TER 86557 WAT 4219 ATOM 86557 O WAT 4220 49.435 39.439 101.655 1.00 0.00 O ATOM 86558 H1 WAT 4220 49.244 38.525 101.442 1.00 0.00 H ATOM 86559 H2 WAT 4220 49.575 39.440 102.602 1.00 0.00 H TER 86561 WAT 4220 ATOM 86561 O WAT 4221 15.437 74.274 110.582 1.00 0.00 O ATOM 86562 H1 WAT 4221 15.235 73.434 110.168 1.00 0.00 H ATOM 86563 H2 WAT 4221 16.258 74.120 111.048 1.00 0.00 H TER 86565 WAT 4221 ATOM 86565 O WAT 4222 58.827 18.944 65.247 1.00 0.00 O ATOM 86566 H1 WAT 4222 58.845 19.794 65.687 1.00 0.00 H ATOM 86567 H2 WAT 4222 59.055 19.139 64.338 1.00 0.00 H TER 86569 WAT 4222 ATOM 86569 O WAT 4223 51.170 103.079 89.360 1.00 0.00 O ATOM 86570 H1 WAT 4223 50.699 103.596 88.706 1.00 0.00 H ATOM 86571 H2 WAT 4223 50.511 102.483 89.713 1.00 0.00 H TER 86573 WAT 4223 ATOM 86573 O WAT 4224 43.857 121.946 55.801 1.00 0.00 O ATOM 86574 H1 WAT 4224 44.027 121.949 54.859 1.00 0.00 H ATOM 86575 H2 WAT 4224 43.923 121.025 56.053 1.00 0.00 H TER 86577 WAT 4224 ATOM 86577 O WAT 4225 120.807 39.498 154.590 1.00 0.00 O ATOM 86578 H1 WAT 4225 120.743 40.091 155.338 1.00 0.00 H ATOM 86579 H2 WAT 4225 119.913 39.181 154.459 1.00 0.00 H TER 86581 WAT 4225 ATOM 86581 O WAT 4226 95.907 33.388 21.191 1.00 0.00 O ATOM 86582 H1 WAT 4226 96.384 34.036 20.672 1.00 0.00 H ATOM 86583 H2 WAT 4226 96.591 32.866 21.610 1.00 0.00 H TER 86585 WAT 4226 ATOM 86585 O WAT 4227 54.989 78.561 151.065 1.00 0.00 O ATOM 86586 H1 WAT 4227 54.909 78.797 150.141 1.00 0.00 H ATOM 86587 H2 WAT 4227 55.586 79.215 151.428 1.00 0.00 H TER 86589 WAT 4227 ATOM 86589 O WAT 4228 113.804 58.567 152.475 1.00 0.00 O ATOM 86590 H1 WAT 4228 113.638 57.967 151.748 1.00 0.00 H ATOM 86591 H2 WAT 4228 114.588 59.049 152.214 1.00 0.00 H TER 86593 WAT 4228 ATOM 86593 O WAT 4229 129.901 39.226 77.474 1.00 0.00 O ATOM 86594 H1 WAT 4229 130.119 38.401 77.041 1.00 0.00 H ATOM 86595 H2 WAT 4229 129.771 39.846 76.756 1.00 0.00 H TER 86597 WAT 4229 ATOM 86597 O WAT 4230 7.581 119.646 3.543 1.00 0.00 O ATOM 86598 H1 WAT 4230 6.754 120.097 3.375 1.00 0.00 H ATOM 86599 H2 WAT 4230 8.223 120.349 3.638 1.00 0.00 H TER 86601 WAT 4230 ATOM 86601 O WAT 4231 90.899 95.027 91.144 1.00 0.00 O ATOM 86602 H1 WAT 4231 91.245 95.833 90.760 1.00 0.00 H ATOM 86603 H2 WAT 4231 89.950 95.153 91.151 1.00 0.00 H TER 86605 WAT 4231 ATOM 86605 O WAT 4232 8.277 63.141 69.987 1.00 0.00 O ATOM 86606 H1 WAT 4232 7.604 63.525 70.550 1.00 0.00 H ATOM 86607 H2 WAT 4232 7.983 63.334 69.097 1.00 0.00 H TER 86609 WAT 4232 ATOM 86609 O WAT 4233 78.006 96.330 69.622 1.00 0.00 O ATOM 86610 H1 WAT 4233 78.776 96.725 69.214 1.00 0.00 H ATOM 86611 H2 WAT 4233 77.815 96.895 70.371 1.00 0.00 H TER 86613 WAT 4233 ATOM 86613 O WAT 4234 137.824 114.776 112.218 1.00 0.00 O ATOM 86614 H1 WAT 4234 138.727 114.981 111.974 1.00 0.00 H ATOM 86615 H2 WAT 4234 137.902 114.061 112.849 1.00 0.00 H TER 86617 WAT 4234 ATOM 86617 O WAT 4235 32.346 95.085 157.616 1.00 0.00 O ATOM 86618 H1 WAT 4235 31.829 95.887 157.550 1.00 0.00 H ATOM 86619 H2 WAT 4235 33.198 95.375 157.944 1.00 0.00 H TER 86621 WAT 4235 ATOM 86621 O WAT 4236 101.081 131.527 4.784 1.00 0.00 O ATOM 86622 H1 WAT 4236 101.666 131.706 5.520 1.00 0.00 H ATOM 86623 H2 WAT 4236 101.635 131.083 4.141 1.00 0.00 H TER 86625 WAT 4236 ATOM 86625 O WAT 4237 88.935 123.294 136.678 1.00 0.00 O ATOM 86626 H1 WAT 4237 89.554 122.807 136.134 1.00 0.00 H ATOM 86627 H2 WAT 4237 89.429 123.508 137.470 1.00 0.00 H TER 86629 WAT 4237 ATOM 86629 O WAT 4238 140.166 110.528 9.101 1.00 0.00 O ATOM 86630 H1 WAT 4238 140.856 111.124 8.810 1.00 0.00 H ATOM 86631 H2 WAT 4238 139.378 110.836 8.653 1.00 0.00 H TER 86633 WAT 4238 ATOM 86633 O WAT 4239 127.332 58.429 154.075 1.00 0.00 O ATOM 86634 H1 WAT 4239 127.780 58.457 154.920 1.00 0.00 H ATOM 86635 H2 WAT 4239 127.441 57.526 153.776 1.00 0.00 H TER 86637 WAT 4239 ATOM 86637 O WAT 4240 30.764 97.578 156.370 1.00 0.00 O ATOM 86638 H1 WAT 4240 29.963 97.062 156.282 1.00 0.00 H ATOM 86639 H2 WAT 4240 30.546 98.251 157.016 1.00 0.00 H TER 86641 WAT 4240 ATOM 86641 O WAT 4241 3.672 25.425 148.882 1.00 0.00 O ATOM 86642 H1 WAT 4241 2.814 25.283 148.481 1.00 0.00 H ATOM 86643 H2 WAT 4241 3.772 26.376 148.903 1.00 0.00 H TER 86645 WAT 4241 ATOM 86645 O WAT 4242 118.519 27.489 116.055 1.00 0.00 O ATOM 86646 H1 WAT 4242 118.652 28.179 116.705 1.00 0.00 H ATOM 86647 H2 WAT 4242 117.646 27.146 116.247 1.00 0.00 H TER 86649 WAT 4242 ATOM 86649 O WAT 4243 18.566 123.906 132.015 1.00 0.00 O ATOM 86650 H1 WAT 4243 19.507 123.733 132.038 1.00 0.00 H ATOM 86651 H2 WAT 4243 18.424 124.351 131.180 1.00 0.00 H TER 86653 WAT 4243 ATOM 86653 O WAT 4244 48.005 130.002 151.365 1.00 0.00 O ATOM 86654 H1 WAT 4244 47.484 129.266 151.043 1.00 0.00 H ATOM 86655 H2 WAT 4244 48.907 129.682 151.347 1.00 0.00 H TER 86657 WAT 4244 ATOM 86657 O WAT 4245 112.430 103.926 89.290 1.00 0.00 O ATOM 86658 H1 WAT 4245 112.341 103.988 88.339 1.00 0.00 H ATOM 86659 H2 WAT 4245 112.211 103.016 89.493 1.00 0.00 H TER 86661 WAT 4245 ATOM 86661 O WAT 4246 91.244 5.968 69.206 1.00 0.00 O ATOM 86662 H1 WAT 4246 91.270 6.925 69.197 1.00 0.00 H ATOM 86663 H2 WAT 4246 90.483 5.745 68.669 1.00 0.00 H TER 86665 WAT 4246 ATOM 86665 O WAT 4247 34.753 127.311 144.785 1.00 0.00 O ATOM 86666 H1 WAT 4247 34.131 127.908 144.369 1.00 0.00 H ATOM 86667 H2 WAT 4247 35.566 127.814 144.843 1.00 0.00 H TER 86669 WAT 4247 ATOM 86669 O WAT 4248 23.212 40.753 117.717 1.00 0.00 O ATOM 86670 H1 WAT 4248 22.720 41.546 117.503 1.00 0.00 H ATOM 86671 H2 WAT 4248 22.579 40.042 117.611 1.00 0.00 H TER 86673 WAT 4248 ATOM 86673 O WAT 4249 125.084 19.065 134.956 1.00 0.00 O ATOM 86674 H1 WAT 4249 125.715 19.559 134.431 1.00 0.00 H ATOM 86675 H2 WAT 4249 125.615 18.632 135.624 1.00 0.00 H TER 86677 WAT 4249 ATOM 86677 O WAT 4250 13.483 97.292 104.138 1.00 0.00 O ATOM 86678 H1 WAT 4250 13.311 96.882 103.290 1.00 0.00 H ATOM 86679 H2 WAT 4250 14.298 97.777 104.008 1.00 0.00 H TER 86681 WAT 4250 ATOM 86681 O WAT 4251 106.193 51.459 143.607 1.00 0.00 O ATOM 86682 H1 WAT 4251 106.394 50.632 144.045 1.00 0.00 H ATOM 86683 H2 WAT 4251 106.129 51.230 142.680 1.00 0.00 H TER 86685 WAT 4251 ATOM 86685 O WAT 4252 14.427 7.310 101.605 1.00 0.00 O ATOM 86686 H1 WAT 4252 14.561 7.657 102.487 1.00 0.00 H ATOM 86687 H2 WAT 4252 13.611 6.814 101.664 1.00 0.00 H TER 86689 WAT 4252 ATOM 86689 O WAT 4253 69.796 101.304 81.837 1.00 0.00 O ATOM 86690 H1 WAT 4253 69.930 100.428 82.198 1.00 0.00 H ATOM 86691 H2 WAT 4253 69.012 101.628 82.280 1.00 0.00 H TER 86693 WAT 4253 ATOM 86693 O WAT 4254 113.548 39.786 137.771 1.00 0.00 O ATOM 86694 H1 WAT 4254 113.523 39.313 138.603 1.00 0.00 H ATOM 86695 H2 WAT 4254 114.224 39.339 137.262 1.00 0.00 H TER 86697 WAT 4254 ATOM 86697 O WAT 4255 81.769 24.415 8.214 1.00 0.00 O ATOM 86698 H1 WAT 4255 82.336 24.112 7.505 1.00 0.00 H ATOM 86699 H2 WAT 4255 82.100 25.288 8.428 1.00 0.00 H TER 86701 WAT 4255 ATOM 86701 O WAT 4256 24.864 122.121 123.571 1.00 0.00 O ATOM 86702 H1 WAT 4256 24.220 122.684 124.000 1.00 0.00 H ATOM 86703 H2 WAT 4256 24.812 122.358 122.645 1.00 0.00 H TER 86705 WAT 4256 ATOM 86705 O WAT 4257 42.070 35.112 84.985 1.00 0.00 O ATOM 86706 H1 WAT 4257 41.881 34.964 84.059 1.00 0.00 H ATOM 86707 H2 WAT 4257 43.024 35.163 85.030 1.00 0.00 H TER 86709 WAT 4257 ATOM 86709 O WAT 4258 128.702 51.032 64.987 1.00 0.00 O ATOM 86710 H1 WAT 4258 128.610 51.984 65.025 1.00 0.00 H ATOM 86711 H2 WAT 4258 128.634 50.748 65.898 1.00 0.00 H TER 86713 WAT 4258 ATOM 86713 O WAT 4259 46.565 50.539 1.309 1.00 0.00 O ATOM 86714 H1 WAT 4259 46.593 50.042 2.127 1.00 0.00 H ATOM 86715 H2 WAT 4259 46.480 51.451 1.587 1.00 0.00 H TER 86717 WAT 4259 ATOM 86717 O WAT 4260 46.298 99.665 107.828 1.00 0.00 O ATOM 86718 H1 WAT 4260 45.837 98.904 108.181 1.00 0.00 H ATOM 86719 H2 WAT 4260 46.083 100.377 108.430 1.00 0.00 H TER 86721 WAT 4260 ATOM 86721 O WAT 4261 130.628 100.467 116.841 1.00 0.00 O ATOM 86722 H1 WAT 4261 131.041 100.362 115.985 1.00 0.00 H ATOM 86723 H2 WAT 4261 130.608 101.414 116.983 1.00 0.00 H TER 86725 WAT 4261 ATOM 86725 O WAT 4262 46.620 131.664 4.459 1.00 0.00 O ATOM 86726 H1 WAT 4262 47.328 131.231 4.937 1.00 0.00 H ATOM 86727 H2 WAT 4262 45.844 131.522 5.001 1.00 0.00 H TER 86729 WAT 4262 ATOM 86729 O WAT 4263 102.378 96.268 140.432 1.00 0.00 O ATOM 86730 H1 WAT 4263 102.873 95.588 139.975 1.00 0.00 H ATOM 86731 H2 WAT 4263 102.014 95.824 141.198 1.00 0.00 H TER 86733 WAT 4263 ATOM 86733 O WAT 4264 102.629 83.777 109.479 1.00 0.00 O ATOM 86734 H1 WAT 4264 102.357 84.058 108.605 1.00 0.00 H ATOM 86735 H2 WAT 4264 103.585 83.775 109.443 1.00 0.00 H TER 86737 WAT 4264 ATOM 86737 O WAT 4265 44.214 76.092 126.712 1.00 0.00 O ATOM 86738 H1 WAT 4265 44.266 75.640 125.869 1.00 0.00 H ATOM 86739 H2 WAT 4265 44.188 75.388 127.360 1.00 0.00 H TER 86741 WAT 4265 ATOM 86741 O WAT 4266 56.991 103.373 132.814 1.00 0.00 O ATOM 86742 H1 WAT 4266 56.805 102.466 132.570 1.00 0.00 H ATOM 86743 H2 WAT 4266 56.322 103.587 133.464 1.00 0.00 H TER 86745 WAT 4266 ATOM 86745 O WAT 4267 17.227 145.368 148.679 1.00 0.00 O ATOM 86746 H1 WAT 4267 17.844 144.707 148.993 1.00 0.00 H ATOM 86747 H2 WAT 4267 17.763 146.149 148.541 1.00 0.00 H TER 86749 WAT 4267 ATOM 86749 O WAT 4268 126.793 82.245 126.153 1.00 0.00 O ATOM 86750 H1 WAT 4268 126.618 81.315 126.295 1.00 0.00 H ATOM 86751 H2 WAT 4268 126.617 82.383 125.222 1.00 0.00 H TER 86753 WAT 4268 ATOM 86753 O WAT 4269 73.050 62.507 117.546 1.00 0.00 O ATOM 86754 H1 WAT 4269 73.196 61.700 118.041 1.00 0.00 H ATOM 86755 H2 WAT 4269 73.883 62.975 117.601 1.00 0.00 H TER 86757 WAT 4269 ATOM 86757 O WAT 4270 83.083 106.763 145.023 1.00 0.00 O ATOM 86758 H1 WAT 4270 83.196 105.838 144.803 1.00 0.00 H ATOM 86759 H2 WAT 4270 83.974 107.093 145.136 1.00 0.00 H TER 86761 WAT 4270 ATOM 86761 O WAT 4271 22.282 63.704 147.328 1.00 0.00 O ATOM 86762 H1 WAT 4271 22.712 62.978 147.780 1.00 0.00 H ATOM 86763 H2 WAT 4271 21.715 64.097 147.992 1.00 0.00 H TER 86765 WAT 4271 ATOM 86765 O WAT 4272 36.772 -0.070 2.219 1.00 0.00 O ATOM 86766 H1 WAT 4272 36.825 0.389 3.057 1.00 0.00 H ATOM 86767 H2 WAT 4272 37.031 0.585 1.570 1.00 0.00 H TER 86769 WAT 4272 ATOM 86769 O WAT 4273 121.188 43.098 124.117 1.00 0.00 O ATOM 86770 H1 WAT 4273 120.409 42.575 124.302 1.00 0.00 H ATOM 86771 H2 WAT 4273 121.192 43.194 123.165 1.00 0.00 H TER 86773 WAT 4273 ATOM 86773 O WAT 4274 126.657 60.305 107.365 1.00 0.00 O ATOM 86774 H1 WAT 4274 126.046 60.706 107.982 1.00 0.00 H ATOM 86775 H2 WAT 4274 127.398 60.030 107.906 1.00 0.00 H TER 86777 WAT 4274 ATOM 86777 O WAT 4275 85.825 85.142 85.871 1.00 0.00 O ATOM 86778 H1 WAT 4275 85.425 84.984 86.726 1.00 0.00 H ATOM 86779 H2 WAT 4275 85.170 85.648 85.390 1.00 0.00 H TER 86781 WAT 4275 ATOM 86781 O WAT 4276 80.344 76.400 58.613 1.00 0.00 O ATOM 86782 H1 WAT 4276 79.560 76.762 59.026 1.00 0.00 H ATOM 86783 H2 WAT 4276 80.009 75.858 57.898 1.00 0.00 H TER 86785 WAT 4276 ATOM 86785 O WAT 4277 106.839 101.909 153.240 1.00 0.00 O ATOM 86786 H1 WAT 4277 106.846 102.744 153.707 1.00 0.00 H ATOM 86787 H2 WAT 4277 106.577 102.136 152.347 1.00 0.00 H TER 86789 WAT 4277 ATOM 86789 O WAT 4278 142.151 52.194 89.973 1.00 0.00 O ATOM 86790 H1 WAT 4278 142.434 52.862 90.598 1.00 0.00 H ATOM 86791 H2 WAT 4278 142.220 52.621 89.119 1.00 0.00 H TER 86793 WAT 4278 ATOM 86793 O WAT 4279 94.150 16.949 146.731 1.00 0.00 O ATOM 86794 H1 WAT 4279 94.056 17.703 146.149 1.00 0.00 H ATOM 86795 H2 WAT 4279 94.432 16.237 146.157 1.00 0.00 H TER 86797 WAT 4279 ATOM 86797 O WAT 4280 123.803 73.793 101.244 1.00 0.00 O ATOM 86798 H1 WAT 4280 124.298 73.980 100.446 1.00 0.00 H ATOM 86799 H2 WAT 4280 124.158 72.961 101.557 1.00 0.00 H TER 86801 WAT 4280 ATOM 86801 O WAT 4281 17.371 60.543 126.858 1.00 0.00 O ATOM 86802 H1 WAT 4281 16.525 60.216 127.165 1.00 0.00 H ATOM 86803 H2 WAT 4281 18.010 59.925 127.213 1.00 0.00 H TER 86805 WAT 4281 ATOM 86805 O WAT 4282 14.579 112.410 147.333 1.00 0.00 O ATOM 86806 H1 WAT 4282 14.062 113.068 147.797 1.00 0.00 H ATOM 86807 H2 WAT 4282 14.442 112.607 146.407 1.00 0.00 H TER 86809 WAT 4282 ATOM 86809 O WAT 4283 79.199 110.223 4.227 1.00 0.00 O ATOM 86810 H1 WAT 4283 78.318 110.438 4.533 1.00 0.00 H ATOM 86811 H2 WAT 4283 79.443 110.959 3.666 1.00 0.00 H TER 86813 WAT 4283 ATOM 86813 O WAT 4284 58.992 35.760 52.824 1.00 0.00 O ATOM 86814 H1 WAT 4284 58.250 35.460 52.299 1.00 0.00 H ATOM 86815 H2 WAT 4284 59.644 35.064 52.738 1.00 0.00 H TER 86817 WAT 4284 ATOM 86817 O WAT 4285 75.613 77.436 15.501 1.00 0.00 O ATOM 86818 H1 WAT 4285 74.903 76.863 15.212 1.00 0.00 H ATOM 86819 H2 WAT 4285 76.038 77.719 14.692 1.00 0.00 H TER 86821 WAT 4285 ATOM 86821 O WAT 4286 31.106 83.054 147.129 1.00 0.00 O ATOM 86822 H1 WAT 4286 31.810 82.407 147.160 1.00 0.00 H ATOM 86823 H2 WAT 4286 30.948 83.191 146.195 1.00 0.00 H TER 86825 WAT 4286 ATOM 86825 O WAT 4287 19.240 134.551 148.558 1.00 0.00 O ATOM 86826 H1 WAT 4287 18.443 134.332 149.041 1.00 0.00 H ATOM 86827 H2 WAT 4287 19.934 134.520 149.216 1.00 0.00 H TER 86829 WAT 4287 ATOM 86829 O WAT 4288 72.700 131.761 104.637 1.00 0.00 O ATOM 86830 H1 WAT 4288 73.452 131.342 104.217 1.00 0.00 H ATOM 86831 H2 WAT 4288 73.072 132.512 105.099 1.00 0.00 H TER 86833 WAT 4288 ATOM 86833 O WAT 4289 55.433 70.608 11.183 1.00 0.00 O ATOM 86834 H1 WAT 4289 55.883 69.815 10.893 1.00 0.00 H ATOM 86835 H2 WAT 4289 55.479 71.198 10.430 1.00 0.00 H TER 86837 WAT 4289 ATOM 86837 O WAT 4290 37.744 99.107 126.230 1.00 0.00 O ATOM 86838 H1 WAT 4290 38.197 99.428 125.450 1.00 0.00 H ATOM 86839 H2 WAT 4290 37.757 98.154 126.139 1.00 0.00 H TER 86841 WAT 4290 ATOM 86841 O WAT 4291 36.630 128.275 114.334 1.00 0.00 O ATOM 86842 H1 WAT 4291 36.768 129.197 114.550 1.00 0.00 H ATOM 86843 H2 WAT 4291 35.746 128.085 114.647 1.00 0.00 H TER 86845 WAT 4291 ATOM 86845 O WAT 4292 69.823 87.706 14.054 1.00 0.00 O ATOM 86846 H1 WAT 4292 69.411 86.971 14.508 1.00 0.00 H ATOM 86847 H2 WAT 4292 69.292 87.830 13.268 1.00 0.00 H TER 86849 WAT 4292 ATOM 86849 O WAT 4293 114.451 100.578 99.490 1.00 0.00 O ATOM 86850 H1 WAT 4293 114.866 100.559 100.352 1.00 0.00 H ATOM 86851 H2 WAT 4293 113.816 101.292 99.546 1.00 0.00 H TER 86853 WAT 4293 ATOM 86853 O WAT 4294 122.116 91.700 148.449 1.00 0.00 O ATOM 86854 H1 WAT 4294 121.162 91.750 148.383 1.00 0.00 H ATOM 86855 H2 WAT 4294 122.434 92.149 147.666 1.00 0.00 H TER 86857 WAT 4294 ATOM 86857 O WAT 4295 39.942 6.271 14.268 1.00 0.00 O ATOM 86858 H1 WAT 4295 39.117 6.102 13.813 1.00 0.00 H ATOM 86859 H2 WAT 4295 40.194 5.422 14.631 1.00 0.00 H TER 86861 WAT 4295 ATOM 86861 O WAT 4296 3.171 43.117 102.260 1.00 0.00 O ATOM 86862 H1 WAT 4296 2.734 42.302 102.508 1.00 0.00 H ATOM 86863 H2 WAT 4296 4.079 42.861 102.096 1.00 0.00 H TER 86865 WAT 4296 ATOM 86865 O WAT 4297 18.600 83.573 141.124 1.00 0.00 O ATOM 86866 H1 WAT 4297 17.685 83.294 141.135 1.00 0.00 H ATOM 86867 H2 WAT 4297 18.713 84.056 141.943 1.00 0.00 H TER 86869 WAT 4297 ATOM 86869 O WAT 4298 131.263 104.759 70.631 1.00 0.00 O ATOM 86870 H1 WAT 4298 130.651 105.212 70.051 1.00 0.00 H ATOM 86871 H2 WAT 4298 130.705 104.245 71.215 1.00 0.00 H TER 86873 WAT 4298 ATOM 86873 O WAT 4299 75.863 1.682 121.217 1.00 0.00 O ATOM 86874 H1 WAT 4299 75.086 2.228 121.093 1.00 0.00 H ATOM 86875 H2 WAT 4299 76.599 2.278 121.075 1.00 0.00 H TER 86877 WAT 4299 ATOM 86877 O WAT 4300 97.991 121.676 137.071 1.00 0.00 O ATOM 86878 H1 WAT 4300 97.997 121.002 137.751 1.00 0.00 H ATOM 86879 H2 WAT 4300 97.064 121.872 136.937 1.00 0.00 H TER 86881 WAT 4300 ATOM 86881 O WAT 4301 64.927 33.005 11.210 1.00 0.00 O ATOM 86882 H1 WAT 4301 64.709 32.115 11.487 1.00 0.00 H ATOM 86883 H2 WAT 4301 64.456 33.569 11.824 1.00 0.00 H TER 86885 WAT 4301 ATOM 86885 O WAT 4302 134.682 26.401 10.180 1.00 0.00 O ATOM 86886 H1 WAT 4302 135.141 25.919 10.868 1.00 0.00 H ATOM 86887 H2 WAT 4302 133.925 25.854 9.969 1.00 0.00 H TER 86889 WAT 4302 ATOM 86889 O WAT 4303 136.520 28.712 97.045 1.00 0.00 O ATOM 86890 H1 WAT 4303 136.226 28.961 96.169 1.00 0.00 H ATOM 86891 H2 WAT 4303 136.213 27.812 97.155 1.00 0.00 H TER 86893 WAT 4303 ATOM 86893 O WAT 4304 116.684 16.252 104.370 1.00 0.00 O ATOM 86894 H1 WAT 4304 116.182 16.534 105.134 1.00 0.00 H ATOM 86895 H2 WAT 4304 116.860 17.060 103.888 1.00 0.00 H TER 86897 WAT 4304 ATOM 86897 O WAT 4305 139.302 29.939 94.613 1.00 0.00 O ATOM 86898 H1 WAT 4305 138.806 30.097 95.417 1.00 0.00 H ATOM 86899 H2 WAT 4305 140.094 30.467 94.713 1.00 0.00 H TER 86901 WAT 4305 ATOM 86901 O WAT 4306 121.506 138.788 93.684 1.00 0.00 O ATOM 86902 H1 WAT 4306 122.316 138.678 93.185 1.00 0.00 H ATOM 86903 H2 WAT 4306 121.085 137.929 93.648 1.00 0.00 H TER 86905 WAT 4306 ATOM 86905 O WAT 4307 46.967 106.302 77.296 1.00 0.00 O ATOM 86906 H1 WAT 4307 47.469 106.494 78.088 1.00 0.00 H ATOM 86907 H2 WAT 4307 46.462 107.099 77.133 1.00 0.00 H TER 86909 WAT 4307 ATOM 86909 O WAT 4308 141.125 66.468 3.552 1.00 0.00 O ATOM 86910 H1 WAT 4308 140.469 66.260 4.217 1.00 0.00 H ATOM 86911 H2 WAT 4308 141.955 66.478 4.029 1.00 0.00 H TER 86913 WAT 4308 ATOM 86913 O WAT 4309 92.558 31.636 127.507 1.00 0.00 O ATOM 86914 H1 WAT 4309 93.406 31.476 127.923 1.00 0.00 H ATOM 86915 H2 WAT 4309 92.320 32.521 127.782 1.00 0.00 H TER 86917 WAT 4309 ATOM 86917 O WAT 4310 51.245 146.046 87.703 1.00 0.00 O ATOM 86918 H1 WAT 4310 50.878 145.396 88.302 1.00 0.00 H ATOM 86919 H2 WAT 4310 50.715 145.967 86.910 1.00 0.00 H TER 86921 WAT 4310 ATOM 86921 O WAT 4311 126.671 109.782 106.924 1.00 0.00 O ATOM 86922 H1 WAT 4311 126.503 109.935 105.995 1.00 0.00 H ATOM 86923 H2 WAT 4311 127.496 110.235 107.097 1.00 0.00 H TER 86925 WAT 4311 ATOM 86925 O WAT 4312 43.091 79.769 66.955 1.00 0.00 O ATOM 86926 H1 WAT 4312 43.977 79.648 66.613 1.00 0.00 H ATOM 86927 H2 WAT 4312 42.711 78.890 66.951 1.00 0.00 H TER 86929 WAT 4312 ATOM 86929 O WAT 4313 39.614 144.935 118.593 1.00 0.00 O ATOM 86930 H1 WAT 4313 39.086 144.547 117.895 1.00 0.00 H ATOM 86931 H2 WAT 4313 40.434 145.180 118.165 1.00 0.00 H TER 86933 WAT 4313 ATOM 86933 O WAT 4314 31.455 33.034 130.044 1.00 0.00 O ATOM 86934 H1 WAT 4314 31.459 32.673 129.157 1.00 0.00 H ATOM 86935 H2 WAT 4314 31.095 32.331 130.586 1.00 0.00 H TER 86937 WAT 4314 ATOM 86937 O WAT 4315 30.594 123.658 60.356 1.00 0.00 O ATOM 86938 H1 WAT 4315 31.108 123.158 59.722 1.00 0.00 H ATOM 86939 H2 WAT 4315 31.086 123.583 61.174 1.00 0.00 H TER 86941 WAT 4315 ATOM 86941 O WAT 4316 108.754 71.348 139.802 1.00 0.00 O ATOM 86942 H1 WAT 4316 109.222 72.179 139.711 1.00 0.00 H ATOM 86943 H2 WAT 4316 108.255 71.443 140.614 1.00 0.00 H TER 86945 WAT 4316 ATOM 86945 O WAT 4317 24.678 73.069 92.098 1.00 0.00 O ATOM 86946 H1 WAT 4317 24.791 72.632 91.254 1.00 0.00 H ATOM 86947 H2 WAT 4317 24.085 73.798 91.912 1.00 0.00 H TER 86949 WAT 4317 ATOM 86949 O WAT 4318 117.034 58.599 99.937 1.00 0.00 O ATOM 86950 H1 WAT 4318 116.997 59.521 99.683 1.00 0.00 H ATOM 86951 H2 WAT 4318 116.142 58.392 100.218 1.00 0.00 H TER 86953 WAT 4318 ATOM 86953 O WAT 4319 21.067 100.794 73.041 1.00 0.00 O ATOM 86954 H1 WAT 4319 20.256 101.260 72.838 1.00 0.00 H ATOM 86955 H2 WAT 4319 21.751 101.302 72.606 1.00 0.00 H TER 86957 WAT 4319 ATOM 86957 O WAT 4320 40.890 129.842 55.387 1.00 0.00 O ATOM 86958 H1 WAT 4320 41.596 129.387 55.847 1.00 0.00 H ATOM 86959 H2 WAT 4320 40.117 129.297 55.537 1.00 0.00 H TER 86961 WAT 4320 ATOM 86961 O WAT 4321 9.096 135.356 1.985 1.00 0.00 O ATOM 86962 H1 WAT 4321 9.130 136.312 1.979 1.00 0.00 H ATOM 86963 H2 WAT 4321 9.943 135.088 2.342 1.00 0.00 H TER 86965 WAT 4321 ATOM 86965 O WAT 4322 38.624 104.444 100.695 1.00 0.00 O ATOM 86966 H1 WAT 4322 38.756 105.133 100.043 1.00 0.00 H ATOM 86967 H2 WAT 4322 38.981 103.656 100.285 1.00 0.00 H TER 86969 WAT 4322 ATOM 86969 O WAT 4323 32.755 86.953 142.041 1.00 0.00 O ATOM 86970 H1 WAT 4323 32.662 87.865 141.763 1.00 0.00 H ATOM 86971 H2 WAT 4323 32.556 86.442 141.256 1.00 0.00 H TER 86973 WAT 4323 ATOM 86973 O WAT 4324 139.105 130.524 95.881 1.00 0.00 O ATOM 86974 H1 WAT 4324 138.463 129.873 95.597 1.00 0.00 H ATOM 86975 H2 WAT 4324 138.762 131.356 95.556 1.00 0.00 H TER 86977 WAT 4324 ATOM 86977 O WAT 4325 18.021 51.152 85.611 1.00 0.00 O ATOM 86978 H1 WAT 4325 18.845 50.829 85.974 1.00 0.00 H ATOM 86979 H2 WAT 4325 17.848 50.580 84.863 1.00 0.00 H TER 86981 WAT 4325 ATOM 86981 O WAT 4326 24.129 96.986 63.850 1.00 0.00 O ATOM 86982 H1 WAT 4326 23.345 96.705 64.322 1.00 0.00 H ATOM 86983 H2 WAT 4326 23.804 97.599 63.190 1.00 0.00 H TER 86985 WAT 4326 ATOM 86985 O WAT 4327 132.825 93.129 134.182 1.00 0.00 O ATOM 86986 H1 WAT 4327 132.362 93.644 133.522 1.00 0.00 H ATOM 86987 H2 WAT 4327 133.190 93.780 134.781 1.00 0.00 H TER 86989 WAT 4327 ATOM 86989 O WAT 4328 14.352 139.953 138.396 1.00 0.00 O ATOM 86990 H1 WAT 4328 14.643 139.328 139.059 1.00 0.00 H ATOM 86991 H2 WAT 4328 13.998 139.410 137.693 1.00 0.00 H TER 86993 WAT 4328 ATOM 86993 O WAT 4329 103.796 122.708 157.488 1.00 0.00 O ATOM 86994 H1 WAT 4329 103.700 123.361 156.795 1.00 0.00 H ATOM 86995 H2 WAT 4329 103.610 121.873 157.058 1.00 0.00 H TER 86997 WAT 4329 ATOM 86997 O WAT 4330 104.921 95.875 93.142 1.00 0.00 O ATOM 86998 H1 WAT 4330 104.637 95.028 92.799 1.00 0.00 H ATOM 86999 H2 WAT 4330 105.867 95.782 93.256 1.00 0.00 H TER 87001 WAT 4330 ATOM 87001 O WAT 4331 29.595 88.626 20.298 1.00 0.00 O ATOM 87002 H1 WAT 4331 29.758 87.820 19.807 1.00 0.00 H ATOM 87003 H2 WAT 4331 30.366 89.168 20.132 1.00 0.00 H TER 87005 WAT 4331 ATOM 87005 O WAT 4332 136.905 101.039 73.957 1.00 0.00 O ATOM 87006 H1 WAT 4332 136.500 101.734 73.438 1.00 0.00 H ATOM 87007 H2 WAT 4332 136.242 100.807 74.606 1.00 0.00 H TER 87009 WAT 4332 ATOM 87009 O WAT 4333 54.841 74.456 20.577 1.00 0.00 O ATOM 87010 H1 WAT 4333 55.081 73.792 21.224 1.00 0.00 H ATOM 87011 H2 WAT 4333 53.899 74.576 20.697 1.00 0.00 H TER 87013 WAT 4333 ATOM 87013 O WAT 4334 114.258 17.950 64.384 1.00 0.00 O ATOM 87014 H1 WAT 4334 114.322 18.821 64.776 1.00 0.00 H ATOM 87015 H2 WAT 4334 114.811 17.998 63.603 1.00 0.00 H TER 87017 WAT 4334 ATOM 87017 O WAT 4335 3.529 63.052 22.253 1.00 0.00 O ATOM 87018 H1 WAT 4335 3.526 62.205 21.808 1.00 0.00 H ATOM 87019 H2 WAT 4335 4.293 63.506 21.898 1.00 0.00 H TER 87021 WAT 4335 ATOM 87021 O WAT 4336 129.745 99.702 126.242 1.00 0.00 O ATOM 87022 H1 WAT 4336 130.617 99.918 126.572 1.00 0.00 H ATOM 87023 H2 WAT 4336 129.893 99.427 125.337 1.00 0.00 H TER 87025 WAT 4336 ATOM 87025 O WAT 4337 71.240 32.004 110.060 1.00 0.00 O ATOM 87026 H1 WAT 4337 71.301 31.393 109.326 1.00 0.00 H ATOM 87027 H2 WAT 4337 72.150 32.181 110.300 1.00 0.00 H TER 87029 WAT 4337 ATOM 87029 O WAT 4338 4.747 65.745 101.013 1.00 0.00 O ATOM 87030 H1 WAT 4338 5.463 66.378 100.962 1.00 0.00 H ATOM 87031 H2 WAT 4338 4.820 65.236 100.205 1.00 0.00 H TER 87033 WAT 4338 ATOM 87033 O WAT 4339 110.967 53.840 11.872 1.00 0.00 O ATOM 87034 H1 WAT 4339 110.943 54.650 12.381 1.00 0.00 H ATOM 87035 H2 WAT 4339 110.050 53.658 11.668 1.00 0.00 H TER 87037 WAT 4339 ATOM 87037 O WAT 4340 63.178 58.286 130.416 1.00 0.00 O ATOM 87038 H1 WAT 4340 62.662 57.519 130.664 1.00 0.00 H ATOM 87039 H2 WAT 4340 64.082 58.043 130.618 1.00 0.00 H TER 87041 WAT 4340 ATOM 87041 O WAT 4341 87.839 23.635 127.184 1.00 0.00 O ATOM 87042 H1 WAT 4341 88.719 23.648 126.806 1.00 0.00 H ATOM 87043 H2 WAT 4341 87.701 22.723 127.438 1.00 0.00 H TER 87045 WAT 4341 ATOM 87045 O WAT 4342 104.055 82.829 137.134 1.00 0.00 O ATOM 87046 H1 WAT 4342 103.969 82.721 136.187 1.00 0.00 H ATOM 87047 H2 WAT 4342 103.795 83.736 137.296 1.00 0.00 H TER 87049 WAT 4342 ATOM 87049 O WAT 4343 71.783 16.342 125.516 1.00 0.00 O ATOM 87050 H1 WAT 4343 72.400 15.919 124.920 1.00 0.00 H ATOM 87051 H2 WAT 4343 71.654 15.705 126.219 1.00 0.00 H TER 87053 WAT 4343 ATOM 87053 O WAT 4344 62.331 3.425 114.374 1.00 0.00 O ATOM 87054 H1 WAT 4344 62.194 3.869 113.537 1.00 0.00 H ATOM 87055 H2 WAT 4344 62.976 3.966 114.830 1.00 0.00 H TER 87057 WAT 4344 ATOM 87057 O WAT 4345 104.518 76.210 90.228 1.00 0.00 O ATOM 87058 H1 WAT 4345 105.262 76.809 90.158 1.00 0.00 H ATOM 87059 H2 WAT 4345 103.806 76.751 90.570 1.00 0.00 H TER 87061 WAT 4345 ATOM 87061 O WAT 4346 38.510 100.845 107.040 1.00 0.00 O ATOM 87062 H1 WAT 4346 37.959 101.529 107.422 1.00 0.00 H ATOM 87063 H2 WAT 4346 39.305 101.303 106.767 1.00 0.00 H TER 87065 WAT 4346 ATOM 87065 O WAT 4347 115.628 15.314 149.642 1.00 0.00 O ATOM 87066 H1 WAT 4347 114.765 15.358 149.230 1.00 0.00 H ATOM 87067 H2 WAT 4347 116.225 15.674 148.987 1.00 0.00 H TER 87069 WAT 4347 ATOM 87069 O WAT 4348 34.360 122.870 134.896 1.00 0.00 O ATOM 87070 H1 WAT 4348 34.167 122.738 135.825 1.00 0.00 H ATOM 87071 H2 WAT 4348 35.306 122.739 134.828 1.00 0.00 H TER 87073 WAT 4348 ATOM 87073 O WAT 4349 64.772 40.357 12.840 1.00 0.00 O ATOM 87074 H1 WAT 4349 64.749 39.881 13.671 1.00 0.00 H ATOM 87075 H2 WAT 4349 63.895 40.242 12.474 1.00 0.00 H TER 87077 WAT 4349 ATOM 87077 O WAT 4350 54.894 144.805 148.388 1.00 0.00 O ATOM 87078 H1 WAT 4350 53.977 145.078 148.413 1.00 0.00 H ATOM 87079 H2 WAT 4350 54.893 143.929 148.774 1.00 0.00 H TER 87081 WAT 4350 ATOM 87081 O WAT 4351 135.389 12.126 131.416 1.00 0.00 O ATOM 87082 H1 WAT 4351 136.091 12.774 131.471 1.00 0.00 H ATOM 87083 H2 WAT 4351 134.585 12.644 131.392 1.00 0.00 H TER 87085 WAT 4351 ATOM 87085 O WAT 4352 110.617 39.830 1.745 1.00 0.00 O ATOM 87086 H1 WAT 4352 109.941 39.927 1.075 1.00 0.00 H ATOM 87087 H2 WAT 4352 110.646 38.889 1.920 1.00 0.00 H TER 87089 WAT 4352 ATOM 87089 O WAT 4353 88.684 136.423 19.645 1.00 0.00 O ATOM 87090 H1 WAT 4353 89.431 136.838 19.213 1.00 0.00 H ATOM 87091 H2 WAT 4353 88.190 136.019 18.932 1.00 0.00 H TER 87093 WAT 4353 ATOM 87093 O WAT 4354 38.974 37.275 72.134 1.00 0.00 O ATOM 87094 H1 WAT 4354 39.232 38.184 72.286 1.00 0.00 H ATOM 87095 H2 WAT 4354 38.057 37.329 71.863 1.00 0.00 H TER 87097 WAT 4354 ATOM 87097 O WAT 4355 77.825 31.832 78.528 1.00 0.00 O ATOM 87098 H1 WAT 4355 78.288 31.829 77.691 1.00 0.00 H ATOM 87099 H2 WAT 4355 77.754 30.907 78.766 1.00 0.00 H TER 87101 WAT 4355 ATOM 87101 O WAT 4356 102.559 101.363 139.465 1.00 0.00 O ATOM 87102 H1 WAT 4356 103.291 101.763 138.994 1.00 0.00 H ATOM 87103 H2 WAT 4356 102.870 100.487 139.691 1.00 0.00 H TER 87105 WAT 4356 ATOM 87105 O WAT 4357 59.601 5.460 153.508 1.00 0.00 O ATOM 87106 H1 WAT 4357 59.650 4.877 152.750 1.00 0.00 H ATOM 87107 H2 WAT 4357 58.751 5.270 153.903 1.00 0.00 H TER 87109 WAT 4357 ATOM 87109 O WAT 4358 32.325 70.451 101.173 1.00 0.00 O ATOM 87110 H1 WAT 4358 31.670 71.004 101.599 1.00 0.00 H ATOM 87111 H2 WAT 4358 32.037 69.556 101.351 1.00 0.00 H TER 87113 WAT 4358 ATOM 87113 O WAT 4359 134.352 21.660 82.769 1.00 0.00 O ATOM 87114 H1 WAT 4359 133.531 21.172 82.833 1.00 0.00 H ATOM 87115 H2 WAT 4359 134.620 21.799 83.677 1.00 0.00 H TER 87117 WAT 4359 ATOM 87117 O WAT 4360 35.242 5.025 62.498 1.00 0.00 O ATOM 87118 H1 WAT 4360 35.715 4.793 61.699 1.00 0.00 H ATOM 87119 H2 WAT 4360 35.859 4.836 63.205 1.00 0.00 H TER 87121 WAT 4360 ATOM 87121 O WAT 4361 107.078 119.572 116.393 1.00 0.00 O ATOM 87122 H1 WAT 4361 108.006 119.782 116.283 1.00 0.00 H ATOM 87123 H2 WAT 4361 106.640 120.039 115.682 1.00 0.00 H TER 87125 WAT 4361 ATOM 87125 O WAT 4362 39.058 127.290 122.662 1.00 0.00 O ATOM 87126 H1 WAT 4362 39.530 127.162 123.484 1.00 0.00 H ATOM 87127 H2 WAT 4362 38.243 127.723 122.919 1.00 0.00 H TER 87129 WAT 4362 ATOM 87129 O WAT 4363 10.179 96.204 77.108 1.00 0.00 O ATOM 87130 H1 WAT 4363 11.068 95.902 76.918 1.00 0.00 H ATOM 87131 H2 WAT 4363 9.617 95.646 76.570 1.00 0.00 H TER 87133 WAT 4363 ATOM 87133 O WAT 4364 21.628 130.465 89.414 1.00 0.00 O ATOM 87134 H1 WAT 4364 20.809 130.085 89.731 1.00 0.00 H ATOM 87135 H2 WAT 4364 22.239 129.728 89.386 1.00 0.00 H TER 87137 WAT 4364 ATOM 87137 O WAT 4365 15.288 46.345 125.527 1.00 0.00 O ATOM 87138 H1 WAT 4365 15.209 45.537 126.034 1.00 0.00 H ATOM 87139 H2 WAT 4365 14.579 46.901 125.850 1.00 0.00 H TER 87141 WAT 4365 ATOM 87141 O WAT 4366 139.354 41.416 80.626 1.00 0.00 O ATOM 87142 H1 WAT 4366 138.559 41.865 80.338 1.00 0.00 H ATOM 87143 H2 WAT 4366 139.793 42.049 81.195 1.00 0.00 H TER 87145 WAT 4366 ATOM 87145 O WAT 4367 78.496 95.427 88.669 1.00 0.00 O ATOM 87146 H1 WAT 4367 78.939 95.438 87.820 1.00 0.00 H ATOM 87147 H2 WAT 4367 79.202 95.527 89.308 1.00 0.00 H TER 87149 WAT 4367 ATOM 87149 O WAT 4368 17.554 42.321 23.749 1.00 0.00 O ATOM 87150 H1 WAT 4368 16.611 42.157 23.766 1.00 0.00 H ATOM 87151 H2 WAT 4368 17.755 42.654 24.624 1.00 0.00 H TER 87153 WAT 4368 ATOM 87153 O WAT 4369 80.563 10.933 0.378 1.00 0.00 O ATOM 87154 H1 WAT 4369 80.270 11.674 -0.153 1.00 0.00 H ATOM 87155 H2 WAT 4369 81.427 10.715 0.028 1.00 0.00 H TER 87157 WAT 4369 ATOM 87157 O WAT 4370 30.273 47.556 109.987 1.00 0.00 O ATOM 87158 H1 WAT 4370 30.434 47.096 109.164 1.00 0.00 H ATOM 87159 H2 WAT 4370 31.133 47.607 110.405 1.00 0.00 H TER 87161 WAT 4370 ATOM 87161 O WAT 4371 51.972 144.113 107.904 1.00 0.00 O ATOM 87162 H1 WAT 4371 52.781 144.298 107.426 1.00 0.00 H ATOM 87163 H2 WAT 4371 51.280 144.214 107.252 1.00 0.00 H TER 87165 WAT 4371 ATOM 87165 O WAT 4372 68.901 133.613 120.082 1.00 0.00 O ATOM 87166 H1 WAT 4372 68.152 133.454 120.656 1.00 0.00 H ATOM 87167 H2 WAT 4372 69.664 133.510 120.650 1.00 0.00 H TER 87169 WAT 4372 ATOM 87169 O WAT 4373 91.227 73.801 157.306 1.00 0.00 O ATOM 87170 H1 WAT 4373 91.864 73.187 157.672 1.00 0.00 H ATOM 87171 H2 WAT 4373 90.804 74.191 158.071 1.00 0.00 H TER 87173 WAT 4373 ATOM 87173 O WAT 4374 56.604 134.101 57.971 1.00 0.00 O ATOM 87174 H1 WAT 4374 56.098 134.894 58.151 1.00 0.00 H ATOM 87175 H2 WAT 4374 57.005 134.261 57.117 1.00 0.00 H TER 87177 WAT 4374 ATOM 87177 O WAT 4375 35.986 99.877 80.631 1.00 0.00 O ATOM 87178 H1 WAT 4375 35.848 99.612 79.722 1.00 0.00 H ATOM 87179 H2 WAT 4375 35.106 100.041 80.969 1.00 0.00 H TER 87181 WAT 4375 ATOM 87181 O WAT 4376 64.874 55.997 57.743 1.00 0.00 O ATOM 87182 H1 WAT 4376 64.479 56.652 58.318 1.00 0.00 H ATOM 87183 H2 WAT 4376 65.547 55.580 58.280 1.00 0.00 H TER 87185 WAT 4376 ATOM 87185 O WAT 4377 146.023 134.455 118.856 1.00 0.00 O ATOM 87186 H1 WAT 4377 145.903 135.087 119.564 1.00 0.00 H ATOM 87187 H2 WAT 4377 145.470 134.781 118.146 1.00 0.00 H TER 87189 WAT 4377 ATOM 87189 O WAT 4378 134.202 77.755 142.919 1.00 0.00 O ATOM 87190 H1 WAT 4378 134.820 78.448 143.151 1.00 0.00 H ATOM 87191 H2 WAT 4378 134.602 77.320 142.166 1.00 0.00 H TER 87193 WAT 4378 ATOM 87193 O WAT 4379 57.885 65.772 67.701 1.00 0.00 O ATOM 87194 H1 WAT 4379 57.548 64.917 67.967 1.00 0.00 H ATOM 87195 H2 WAT 4379 57.114 66.340 67.689 1.00 0.00 H TER 87197 WAT 4379 ATOM 87197 O WAT 4380 71.322 136.757 60.376 1.00 0.00 O ATOM 87198 H1 WAT 4380 71.505 137.689 60.255 1.00 0.00 H ATOM 87199 H2 WAT 4380 71.027 136.458 59.515 1.00 0.00 H TER 87201 WAT 4380 ATOM 87201 O WAT 4381 24.954 107.657 83.485 1.00 0.00 O ATOM 87202 H1 WAT 4381 25.341 106.788 83.372 1.00 0.00 H ATOM 87203 H2 WAT 4381 25.239 107.935 84.355 1.00 0.00 H TER 87205 WAT 4381 ATOM 87205 O WAT 4382 135.636 107.079 138.872 1.00 0.00 O ATOM 87206 H1 WAT 4382 135.151 106.984 138.052 1.00 0.00 H ATOM 87207 H2 WAT 4382 135.018 107.503 139.468 1.00 0.00 H TER 87209 WAT 4382 ATOM 87209 O WAT 4383 56.103 17.796 65.308 1.00 0.00 O ATOM 87210 H1 WAT 4383 56.996 17.992 65.027 1.00 0.00 H ATOM 87211 H2 WAT 4383 56.082 16.842 65.393 1.00 0.00 H TER 87213 WAT 4383 ATOM 87213 O WAT 4384 58.143 5.212 11.823 1.00 0.00 O ATOM 87214 H1 WAT 4384 58.073 6.143 12.034 1.00 0.00 H ATOM 87215 H2 WAT 4384 57.439 5.056 11.194 1.00 0.00 H TER 87217 WAT 4384 ATOM 87217 O WAT 4385 141.854 28.532 152.493 1.00 0.00 O ATOM 87218 H1 WAT 4385 142.500 28.405 151.798 1.00 0.00 H ATOM 87219 H2 WAT 4385 141.772 29.482 152.573 1.00 0.00 H TER 87221 WAT 4385 ATOM 87221 O WAT 4386 8.398 41.586 68.269 1.00 0.00 O ATOM 87222 H1 WAT 4386 9.004 42.226 68.642 1.00 0.00 H ATOM 87223 H2 WAT 4386 7.904 42.077 67.613 1.00 0.00 H TER 87225 WAT 4386 ATOM 87225 O WAT 4387 123.482 73.558 126.078 1.00 0.00 O ATOM 87226 H1 WAT 4387 123.760 72.933 126.747 1.00 0.00 H ATOM 87227 H2 WAT 4387 123.030 73.024 125.424 1.00 0.00 H TER 87229 WAT 4387 ATOM 87229 O WAT 4388 102.470 114.120 128.317 1.00 0.00 O ATOM 87230 H1 WAT 4388 103.133 114.731 128.639 1.00 0.00 H ATOM 87231 H2 WAT 4388 102.012 113.827 129.105 1.00 0.00 H TER 87233 WAT 4388 ATOM 87233 O WAT 4389 113.879 4.309 154.810 1.00 0.00 O ATOM 87234 H1 WAT 4389 112.994 3.989 154.633 1.00 0.00 H ATOM 87235 H2 WAT 4389 113.818 4.715 155.675 1.00 0.00 H TER 87237 WAT 4389 ATOM 87237 O WAT 4390 111.155 75.444 72.593 1.00 0.00 O ATOM 87238 H1 WAT 4390 112.101 75.553 72.685 1.00 0.00 H ATOM 87239 H2 WAT 4390 110.780 76.108 73.171 1.00 0.00 H TER 87241 WAT 4390 ATOM 87241 O WAT 4391 57.516 96.831 61.393 1.00 0.00 O ATOM 87242 H1 WAT 4391 57.695 97.324 60.592 1.00 0.00 H ATOM 87243 H2 WAT 4391 58.355 96.809 61.854 1.00 0.00 H TER 87245 WAT 4391 ATOM 87245 O WAT 4392 72.350 13.460 102.895 1.00 0.00 O ATOM 87246 H1 WAT 4392 72.999 14.136 103.090 1.00 0.00 H ATOM 87247 H2 WAT 4392 72.507 13.235 101.978 1.00 0.00 H TER 87249 WAT 4392 ATOM 87249 O WAT 4393 28.939 49.874 136.822 1.00 0.00 O ATOM 87250 H1 WAT 4393 28.442 50.196 136.070 1.00 0.00 H ATOM 87251 H2 WAT 4393 29.187 50.665 137.301 1.00 0.00 H TER 87253 WAT 4393 ATOM 87253 O WAT 4394 138.921 35.356 137.548 1.00 0.00 O ATOM 87254 H1 WAT 4394 139.029 34.960 138.413 1.00 0.00 H ATOM 87255 H2 WAT 4394 138.173 34.896 137.166 1.00 0.00 H TER 87257 WAT 4394 ATOM 87257 O WAT 4395 27.861 57.138 55.255 1.00 0.00 O ATOM 87258 H1 WAT 4395 28.392 57.849 54.898 1.00 0.00 H ATOM 87259 H2 WAT 4395 26.989 57.519 55.361 1.00 0.00 H TER 87261 WAT 4395 ATOM 87261 O WAT 4396 67.235 81.919 78.887 1.00 0.00 O ATOM 87262 H1 WAT 4396 66.842 82.310 78.107 1.00 0.00 H ATOM 87263 H2 WAT 4396 67.496 81.041 78.610 1.00 0.00 H TER 87265 WAT 4396 ATOM 87265 O WAT 4397 102.113 12.567 155.457 1.00 0.00 O ATOM 87266 H1 WAT 4397 102.595 13.266 155.015 1.00 0.00 H ATOM 87267 H2 WAT 4397 102.615 11.774 155.270 1.00 0.00 H TER 87269 WAT 4397 ATOM 87269 O WAT 4398 94.314 50.888 143.373 1.00 0.00 O ATOM 87270 H1 WAT 4398 93.732 51.642 143.276 1.00 0.00 H ATOM 87271 H2 WAT 4398 94.457 50.816 144.316 1.00 0.00 H TER 87273 WAT 4398 ATOM 87273 O WAT 4399 139.234 21.572 109.144 1.00 0.00 O ATOM 87274 H1 WAT 4399 140.108 21.309 108.854 1.00 0.00 H ATOM 87275 H2 WAT 4399 138.909 20.818 109.637 1.00 0.00 H TER 87277 WAT 4399 ATOM 87277 O WAT 4400 7.387 63.095 151.020 1.00 0.00 O ATOM 87278 H1 WAT 4400 7.962 62.912 150.277 1.00 0.00 H ATOM 87279 H2 WAT 4400 7.403 62.290 151.539 1.00 0.00 H TER 87281 WAT 4400 ATOM 87281 O WAT 4401 96.379 8.639 117.594 1.00 0.00 O ATOM 87282 H1 WAT 4401 96.634 8.018 116.911 1.00 0.00 H ATOM 87283 H2 WAT 4401 96.845 9.444 117.372 1.00 0.00 H TER 87285 WAT 4401 ATOM 87285 O WAT 4402 104.524 47.665 127.243 1.00 0.00 O ATOM 87286 H1 WAT 4402 105.445 47.846 127.055 1.00 0.00 H ATOM 87287 H2 WAT 4402 104.274 47.003 126.598 1.00 0.00 H TER 87289 WAT 4402 ATOM 87289 O WAT 4403 26.774 42.757 132.056 1.00 0.00 O ATOM 87290 H1 WAT 4403 26.524 42.156 131.354 1.00 0.00 H ATOM 87291 H2 WAT 4403 25.984 43.271 132.223 1.00 0.00 H TER 87293 WAT 4403 ATOM 87293 O WAT 4404 43.225 114.392 134.645 1.00 0.00 O ATOM 87294 H1 WAT 4404 43.309 113.895 133.832 1.00 0.00 H ATOM 87295 H2 WAT 4404 43.999 114.151 135.154 1.00 0.00 H TER 87297 WAT 4404 ATOM 87297 O WAT 4405 1.018 72.746 88.608 1.00 0.00 O ATOM 87298 H1 WAT 4405 0.879 72.465 89.512 1.00 0.00 H ATOM 87299 H2 WAT 4405 0.147 72.721 88.213 1.00 0.00 H TER 87301 WAT 4405 ATOM 87301 O WAT 4406 70.015 11.711 152.190 1.00 0.00 O ATOM 87302 H1 WAT 4406 70.945 11.847 152.012 1.00 0.00 H ATOM 87303 H2 WAT 4406 69.565 12.216 151.512 1.00 0.00 H TER 87305 WAT 4406 ATOM 87305 O WAT 4407 132.666 105.382 121.904 1.00 0.00 O ATOM 87306 H1 WAT 4407 132.507 105.245 120.970 1.00 0.00 H ATOM 87307 H2 WAT 4407 132.977 106.285 121.964 1.00 0.00 H TER 87309 WAT 4407 ATOM 87309 O WAT 4408 71.125 86.441 57.131 1.00 0.00 O ATOM 87310 H1 WAT 4408 70.373 85.944 57.453 1.00 0.00 H ATOM 87311 H2 WAT 4408 71.788 86.340 57.814 1.00 0.00 H TER 87313 WAT 4408 ATOM 87313 O WAT 4409 99.988 117.722 69.818 1.00 0.00 O ATOM 87314 H1 WAT 4409 100.004 118.656 69.612 1.00 0.00 H ATOM 87315 H2 WAT 4409 99.494 117.326 69.100 1.00 0.00 H TER 87317 WAT 4409 ATOM 87317 O WAT 4410 26.993 86.861 85.598 1.00 0.00 O ATOM 87318 H1 WAT 4410 27.292 86.696 84.704 1.00 0.00 H ATOM 87319 H2 WAT 4410 26.945 85.994 85.999 1.00 0.00 H TER 87321 WAT 4410 ATOM 87321 O WAT 4411 24.556 94.498 152.497 1.00 0.00 O ATOM 87322 H1 WAT 4411 23.720 94.962 152.455 1.00 0.00 H ATOM 87323 H2 WAT 4411 24.889 94.520 151.600 1.00 0.00 H TER 87325 WAT 4411 ATOM 87325 O WAT 4412 134.184 7.337 92.798 1.00 0.00 O ATOM 87326 H1 WAT 4412 134.213 8.289 92.887 1.00 0.00 H ATOM 87327 H2 WAT 4412 134.659 7.158 91.987 1.00 0.00 H TER 87329 WAT 4412 ATOM 87329 O WAT 4413 129.358 43.388 10.281 1.00 0.00 O ATOM 87330 H1 WAT 4413 130.229 43.075 10.523 1.00 0.00 H ATOM 87331 H2 WAT 4413 128.805 42.608 10.316 1.00 0.00 H TER 87333 WAT 4413 ATOM 87333 O WAT 4414 86.842 121.293 86.075 1.00 0.00 O ATOM 87334 H1 WAT 4414 87.705 121.336 85.664 1.00 0.00 H ATOM 87335 H2 WAT 4414 86.389 122.077 85.765 1.00 0.00 H TER 87337 WAT 4414 ATOM 87337 O WAT 4415 4.419 20.347 25.676 1.00 0.00 O ATOM 87338 H1 WAT 4415 5.035 20.882 25.175 1.00 0.00 H ATOM 87339 H2 WAT 4415 4.586 19.452 25.383 1.00 0.00 H TER 87341 WAT 4415 ATOM 87341 O WAT 4416 92.129 65.279 118.466 1.00 0.00 O ATOM 87342 H1 WAT 4416 91.631 66.072 118.663 1.00 0.00 H ATOM 87343 H2 WAT 4416 91.762 64.615 119.049 1.00 0.00 H TER 87345 WAT 4416 ATOM 87345 O WAT 4417 76.478 84.800 120.445 1.00 0.00 O ATOM 87346 H1 WAT 4417 75.597 85.038 120.737 1.00 0.00 H ATOM 87347 H2 WAT 4417 76.737 85.513 119.862 1.00 0.00 H TER 87349 WAT 4417 ATOM 87349 O WAT 4418 45.155 39.380 14.609 1.00 0.00 O ATOM 87350 H1 WAT 4418 44.775 38.609 15.029 1.00 0.00 H ATOM 87351 H2 WAT 4418 45.776 39.722 15.252 1.00 0.00 H TER 87353 WAT 4418 ATOM 87353 O WAT 4419 25.306 99.166 6.744 1.00 0.00 O ATOM 87354 H1 WAT 4419 25.514 98.423 6.176 1.00 0.00 H ATOM 87355 H2 WAT 4419 25.002 99.847 6.145 1.00 0.00 H TER 87357 WAT 4419 ATOM 87357 O WAT 4420 62.091 90.916 71.600 1.00 0.00 O ATOM 87358 H1 WAT 4420 61.261 91.370 71.452 1.00 0.00 H ATOM 87359 H2 WAT 4420 62.144 90.276 70.891 1.00 0.00 H TER 87361 WAT 4420 ATOM 87361 O WAT 4421 8.078 141.002 81.679 1.00 0.00 O ATOM 87362 H1 WAT 4421 7.265 141.321 82.070 1.00 0.00 H ATOM 87363 H2 WAT 4421 8.638 141.777 81.624 1.00 0.00 H TER 87365 WAT 4421 ATOM 87365 O WAT 4422 21.141 58.983 119.363 1.00 0.00 O ATOM 87366 H1 WAT 4422 22.030 58.628 119.385 1.00 0.00 H ATOM 87367 H2 WAT 4422 20.589 58.266 119.677 1.00 0.00 H TER 87369 WAT 4422 ATOM 87369 O WAT 4423 54.921 67.985 21.776 1.00 0.00 O ATOM 87370 H1 WAT 4423 54.410 68.634 22.260 1.00 0.00 H ATOM 87371 H2 WAT 4423 54.874 67.194 22.313 1.00 0.00 H TER 87373 WAT 4423 ATOM 87373 O WAT 4424 51.777 16.783 6.835 1.00 0.00 O ATOM 87374 H1 WAT 4424 51.650 16.980 7.763 1.00 0.00 H ATOM 87375 H2 WAT 4424 50.891 16.723 6.479 1.00 0.00 H TER 87377 WAT 4424 ATOM 87377 O WAT 4425 89.417 60.203 66.865 1.00 0.00 O ATOM 87378 H1 WAT 4425 88.527 60.524 67.007 1.00 0.00 H ATOM 87379 H2 WAT 4425 89.589 60.375 65.940 1.00 0.00 H TER 87381 WAT 4425 ATOM 87381 O WAT 4426 4.802 53.256 66.071 1.00 0.00 O ATOM 87382 H1 WAT 4426 4.609 53.122 66.999 1.00 0.00 H ATOM 87383 H2 WAT 4426 4.007 52.975 65.618 1.00 0.00 H TER 87385 WAT 4426 ATOM 87385 O WAT 4427 5.076 84.722 13.996 1.00 0.00 O ATOM 87386 H1 WAT 4427 4.833 85.088 14.846 1.00 0.00 H ATOM 87387 H2 WAT 4427 4.241 84.507 13.580 1.00 0.00 H TER 87389 WAT 4427 ATOM 87389 O WAT 4428 11.738 59.315 142.142 1.00 0.00 O ATOM 87390 H1 WAT 4428 11.138 58.928 142.778 1.00 0.00 H ATOM 87391 H2 WAT 4428 12.003 58.583 141.586 1.00 0.00 H TER 87393 WAT 4428 ATOM 87393 O WAT 4429 39.612 93.452 142.356 1.00 0.00 O ATOM 87394 H1 WAT 4429 39.252 93.744 141.519 1.00 0.00 H ATOM 87395 H2 WAT 4429 40.284 92.814 142.119 1.00 0.00 H TER 87397 WAT 4429 ATOM 87397 O WAT 4430 62.986 97.996 155.814 1.00 0.00 O ATOM 87398 H1 WAT 4430 62.232 98.582 155.875 1.00 0.00 H ATOM 87399 H2 WAT 4430 62.671 97.253 155.300 1.00 0.00 H TER 87401 WAT 4430 ATOM 87401 O WAT 4431 118.072 132.390 23.927 1.00 0.00 O ATOM 87402 H1 WAT 4431 118.903 132.029 23.617 1.00 0.00 H ATOM 87403 H2 WAT 4431 117.806 133.002 23.240 1.00 0.00 H TER 87405 WAT 4431 ATOM 87405 O WAT 4432 107.736 136.068 102.773 1.00 0.00 O ATOM 87406 H1 WAT 4432 107.784 136.072 103.729 1.00 0.00 H ATOM 87407 H2 WAT 4432 106.867 136.419 102.575 1.00 0.00 H TER 87409 WAT 4432 ATOM 87409 O WAT 4433 72.557 121.839 20.189 1.00 0.00 O ATOM 87410 H1 WAT 4433 71.874 122.508 20.215 1.00 0.00 H ATOM 87411 H2 WAT 4433 73.339 122.306 19.894 1.00 0.00 H TER 87413 WAT 4433 ATOM 87413 O WAT 4434 5.003 115.657 127.843 1.00 0.00 O ATOM 87414 H1 WAT 4434 4.388 114.926 127.906 1.00 0.00 H ATOM 87415 H2 WAT 4434 5.391 115.719 128.716 1.00 0.00 H TER 87417 WAT 4434 ATOM 87417 O WAT 4435 105.804 39.646 145.720 1.00 0.00 O ATOM 87418 H1 WAT 4435 105.904 40.354 145.084 1.00 0.00 H ATOM 87419 H2 WAT 4435 106.691 39.486 146.043 1.00 0.00 H TER 87421 WAT 4435 ATOM 87421 O WAT 4436 13.526 110.426 100.062 1.00 0.00 O ATOM 87422 H1 WAT 4436 14.043 109.741 100.486 1.00 0.00 H ATOM 87423 H2 WAT 4436 13.033 109.967 99.382 1.00 0.00 H TER 87425 WAT 4436 ATOM 87425 O WAT 4437 105.782 90.546 8.968 1.00 0.00 O ATOM 87426 H1 WAT 4437 106.286 91.310 8.688 1.00 0.00 H ATOM 87427 H2 WAT 4437 104.978 90.586 8.450 1.00 0.00 H TER 87429 WAT 4437 ATOM 87429 O WAT 4438 134.291 91.015 2.454 1.00 0.00 O ATOM 87430 H1 WAT 4438 134.205 90.229 1.915 1.00 0.00 H ATOM 87431 H2 WAT 4438 134.575 91.695 1.842 1.00 0.00 H TER 87433 WAT 4438 ATOM 87433 O WAT 4439 47.043 57.051 134.681 1.00 0.00 O ATOM 87434 H1 WAT 4439 46.745 56.903 135.578 1.00 0.00 H ATOM 87435 H2 WAT 4439 46.496 56.473 134.149 1.00 0.00 H TER 87437 WAT 4439 ATOM 87437 O WAT 4440 17.226 137.946 126.923 1.00 0.00 O ATOM 87438 H1 WAT 4440 17.243 137.007 127.110 1.00 0.00 H ATOM 87439 H2 WAT 4440 17.009 138.353 127.762 1.00 0.00 H TER 87441 WAT 4440 ATOM 87441 O WAT 4441 134.668 111.546 113.235 1.00 0.00 O ATOM 87442 H1 WAT 4441 134.563 111.757 112.307 1.00 0.00 H ATOM 87443 H2 WAT 4441 134.609 110.592 113.273 1.00 0.00 H TER 87445 WAT 4441 ATOM 87445 O WAT 4442 65.293 133.651 154.144 1.00 0.00 O ATOM 87446 H1 WAT 4442 65.303 134.603 154.241 1.00 0.00 H ATOM 87447 H2 WAT 4442 65.550 133.320 155.005 1.00 0.00 H TER 87449 WAT 4442 ATOM 87449 O WAT 4443 4.763 10.814 23.997 1.00 0.00 O ATOM 87450 H1 WAT 4443 4.632 10.422 23.134 1.00 0.00 H ATOM 87451 H2 WAT 4443 4.609 10.097 24.612 1.00 0.00 H TER 87453 WAT 4443 ATOM 87453 O WAT 4444 70.266 89.262 103.777 1.00 0.00 O ATOM 87454 H1 WAT 4444 70.526 88.341 103.751 1.00 0.00 H ATOM 87455 H2 WAT 4444 71.072 89.744 103.593 1.00 0.00 H TER 87457 WAT 4444 ATOM 87457 O WAT 4445 34.436 84.868 121.429 1.00 0.00 O ATOM 87458 H1 WAT 4445 34.512 84.285 122.185 1.00 0.00 H ATOM 87459 H2 WAT 4445 35.313 85.233 121.320 1.00 0.00 H TER 87461 WAT 4445 ATOM 87461 O WAT 4446 108.599 93.118 69.495 1.00 0.00 O ATOM 87462 H1 WAT 4446 108.021 92.667 68.879 1.00 0.00 H ATOM 87463 H2 WAT 4446 109.424 92.635 69.448 1.00 0.00 H TER 87465 WAT 4446 ATOM 87465 O WAT 4447 125.657 4.048 132.054 1.00 0.00 O ATOM 87466 H1 WAT 4447 125.260 4.868 131.761 1.00 0.00 H ATOM 87467 H2 WAT 4447 125.777 3.540 131.251 1.00 0.00 H TER 87469 WAT 4447 ATOM 87469 O WAT 4448 71.816 98.344 2.606 1.00 0.00 O ATOM 87470 H1 WAT 4448 71.870 99.174 3.080 1.00 0.00 H ATOM 87471 H2 WAT 4448 71.838 98.594 1.682 1.00 0.00 H TER 87473 WAT 4448 ATOM 87473 O WAT 4449 1.829 117.143 3.962 1.00 0.00 O ATOM 87474 H1 WAT 4449 2.508 116.470 4.013 1.00 0.00 H ATOM 87475 H2 WAT 4449 2.240 117.863 3.484 1.00 0.00 H TER 87477 WAT 4449 ATOM 87477 O WAT 4450 4.751 59.043 145.849 1.00 0.00 O ATOM 87478 H1 WAT 4450 5.024 59.509 145.059 1.00 0.00 H ATOM 87479 H2 WAT 4450 4.043 59.577 146.209 1.00 0.00 H TER 87481 WAT 4450 ATOM 87481 O WAT 4451 7.283 9.976 65.146 1.00 0.00 O ATOM 87482 H1 WAT 4451 8.007 9.643 64.616 1.00 0.00 H ATOM 87483 H2 WAT 4451 7.177 10.884 64.862 1.00 0.00 H TER 87485 WAT 4451 ATOM 87485 O WAT 4452 61.925 40.306 152.013 1.00 0.00 O ATOM 87486 H1 WAT 4452 62.525 40.059 152.717 1.00 0.00 H ATOM 87487 H2 WAT 4452 61.390 39.525 151.869 1.00 0.00 H TER 87489 WAT 4452 ATOM 87489 O WAT 4453 123.533 97.955 154.538 1.00 0.00 O ATOM 87490 H1 WAT 4453 122.782 98.399 154.145 1.00 0.00 H ATOM 87491 H2 WAT 4453 124.044 97.643 153.791 1.00 0.00 H TER 87493 WAT 4453 ATOM 87493 O WAT 4454 65.301 130.440 102.482 1.00 0.00 O ATOM 87494 H1 WAT 4454 64.431 130.793 102.298 1.00 0.00 H ATOM 87495 H2 WAT 4454 65.896 130.993 101.974 1.00 0.00 H TER 87497 WAT 4454 ATOM 87497 O WAT 4455 68.599 130.429 120.483 1.00 0.00 O ATOM 87498 H1 WAT 4455 68.561 131.348 120.219 1.00 0.00 H ATOM 87499 H2 WAT 4455 69.429 130.349 120.954 1.00 0.00 H TER 87501 WAT 4455 ATOM 87501 O WAT 4456 95.895 131.672 152.800 1.00 0.00 O ATOM 87502 H1 WAT 4456 95.231 131.492 153.465 1.00 0.00 H ATOM 87503 H2 WAT 4456 96.650 131.990 153.296 1.00 0.00 H TER 87505 WAT 4456 ATOM 87505 O WAT 4457 86.463 51.247 69.547 1.00 0.00 O ATOM 87506 H1 WAT 4457 87.104 51.914 69.302 1.00 0.00 H ATOM 87507 H2 WAT 4457 86.990 50.483 69.779 1.00 0.00 H TER 87509 WAT 4457 ATOM 87509 O WAT 4458 22.759 23.794 13.077 1.00 0.00 O ATOM 87510 H1 WAT 4458 23.422 23.855 12.389 1.00 0.00 H ATOM 87511 H2 WAT 4458 21.929 23.734 12.605 1.00 0.00 H TER 87513 WAT 4458 ATOM 87513 O WAT 4459 91.782 103.199 20.505 1.00 0.00 O ATOM 87514 H1 WAT 4459 92.717 103.362 20.629 1.00 0.00 H ATOM 87515 H2 WAT 4459 91.745 102.491 19.862 1.00 0.00 H TER 87517 WAT 4459 ATOM 87517 O WAT 4460 19.935 33.829 120.507 1.00 0.00 O ATOM 87518 H1 WAT 4460 20.548 33.253 120.964 1.00 0.00 H ATOM 87519 H2 WAT 4460 19.258 33.241 120.172 1.00 0.00 H TER 87521 WAT 4460 ATOM 87521 O WAT 4461 129.109 43.920 154.513 1.00 0.00 O ATOM 87522 H1 WAT 4461 128.323 43.767 155.038 1.00 0.00 H ATOM 87523 H2 WAT 4461 129.076 44.853 154.298 1.00 0.00 H TER 87525 WAT 4461 ATOM 87525 O WAT 4462 49.751 116.625 98.233 1.00 0.00 O ATOM 87526 H1 WAT 4462 50.154 115.784 98.017 1.00 0.00 H ATOM 87527 H2 WAT 4462 49.237 116.449 99.021 1.00 0.00 H TER 87529 WAT 4462 ATOM 87529 O WAT 4463 9.654 132.342 64.768 1.00 0.00 O ATOM 87530 H1 WAT 4463 9.938 131.434 64.867 1.00 0.00 H ATOM 87531 H2 WAT 4463 9.675 132.498 63.824 1.00 0.00 H TER 87533 WAT 4463 ATOM 87533 O WAT 4464 130.647 112.113 96.719 1.00 0.00 O ATOM 87534 H1 WAT 4464 131.331 111.536 97.060 1.00 0.00 H ATOM 87535 H2 WAT 4464 130.598 111.901 95.787 1.00 0.00 H TER 87537 WAT 4464 ATOM 87537 O WAT 4465 112.099 69.221 73.275 1.00 0.00 O ATOM 87538 H1 WAT 4465 112.130 70.048 72.794 1.00 0.00 H ATOM 87539 H2 WAT 4465 112.586 68.606 72.727 1.00 0.00 H TER 87541 WAT 4465 ATOM 87541 O WAT 4466 51.505 3.326 114.488 1.00 0.00 O ATOM 87542 H1 WAT 4466 52.257 2.767 114.292 1.00 0.00 H ATOM 87543 H2 WAT 4466 51.742 4.181 114.131 1.00 0.00 H TER 87545 WAT 4466 ATOM 87545 O WAT 4467 51.449 49.784 26.462 1.00 0.00 O ATOM 87546 H1 WAT 4467 50.887 49.965 27.215 1.00 0.00 H ATOM 87547 H2 WAT 4467 51.847 50.628 26.251 1.00 0.00 H TER 87549 WAT 4467 ATOM 87549 O WAT 4468 74.429 62.137 19.619 1.00 0.00 O ATOM 87550 H1 WAT 4468 74.227 62.343 20.531 1.00 0.00 H ATOM 87551 H2 WAT 4468 75.156 61.516 19.668 1.00 0.00 H TER 87553 WAT 4468 ATOM 87553 O WAT 4469 124.311 6.476 150.161 1.00 0.00 O ATOM 87554 H1 WAT 4469 123.854 6.844 149.405 1.00 0.00 H ATOM 87555 H2 WAT 4469 125.095 7.018 150.253 1.00 0.00 H TER 87557 WAT 4469 ATOM 87557 O WAT 4470 36.421 90.953 87.032 1.00 0.00 O ATOM 87558 H1 WAT 4470 36.804 90.631 86.217 1.00 0.00 H ATOM 87559 H2 WAT 4470 36.752 91.847 87.116 1.00 0.00 H TER 87561 WAT 4470 ATOM 87561 O WAT 4471 94.069 106.470 151.909 1.00 0.00 O ATOM 87562 H1 WAT 4471 94.794 106.792 152.444 1.00 0.00 H ATOM 87563 H2 WAT 4471 93.633 105.821 152.462 1.00 0.00 H TER 87565 WAT 4471 ATOM 87565 O WAT 4472 23.963 89.369 147.493 1.00 0.00 O ATOM 87566 H1 WAT 4472 23.753 88.444 147.364 1.00 0.00 H ATOM 87567 H2 WAT 4472 24.899 89.431 147.304 1.00 0.00 H TER 87569 WAT 4472 ATOM 87569 O WAT 4473 94.401 67.770 108.478 1.00 0.00 O ATOM 87570 H1 WAT 4473 94.064 68.515 108.977 1.00 0.00 H ATOM 87571 H2 WAT 4473 94.228 67.011 109.035 1.00 0.00 H TER 87573 WAT 4473 ATOM 87573 O WAT 4474 53.085 110.975 117.883 1.00 0.00 O ATOM 87574 H1 WAT 4474 53.935 111.398 118.002 1.00 0.00 H ATOM 87575 H2 WAT 4474 52.898 111.070 116.949 1.00 0.00 H TER 87577 WAT 4474 ATOM 87577 O WAT 4475 21.834 20.366 117.968 1.00 0.00 O ATOM 87578 H1 WAT 4475 22.750 20.100 117.881 1.00 0.00 H ATOM 87579 H2 WAT 4475 21.413 19.631 118.414 1.00 0.00 H TER 87581 WAT 4475 ATOM 87581 O WAT 4476 82.511 45.242 123.967 1.00 0.00 O ATOM 87582 H1 WAT 4476 81.863 45.435 123.289 1.00 0.00 H ATOM 87583 H2 WAT 4476 82.476 44.291 124.067 1.00 0.00 H TER 87585 WAT 4476 ATOM 87585 O WAT 4477 17.676 85.310 152.151 1.00 0.00 O ATOM 87586 H1 WAT 4477 17.888 85.928 151.452 1.00 0.00 H ATOM 87587 H2 WAT 4477 16.782 85.535 152.407 1.00 0.00 H TER 87589 WAT 4477 ATOM 87589 O WAT 4478 1.578 134.381 109.209 1.00 0.00 O ATOM 87590 H1 WAT 4478 1.219 135.132 109.682 1.00 0.00 H ATOM 87591 H2 WAT 4478 0.817 133.970 108.799 1.00 0.00 H TER 87593 WAT 4478 ATOM 87593 O WAT 4479 46.222 96.232 78.764 1.00 0.00 O ATOM 87594 H1 WAT 4479 46.172 95.323 78.469 1.00 0.00 H ATOM 87595 H2 WAT 4479 45.640 96.708 78.172 1.00 0.00 H TER 87597 WAT 4479 ATOM 87597 O WAT 4480 52.644 108.285 11.292 1.00 0.00 O ATOM 87598 H1 WAT 4480 51.734 108.025 11.151 1.00 0.00 H ATOM 87599 H2 WAT 4480 52.985 107.638 11.910 1.00 0.00 H TER 87601 WAT 4480 ATOM 87601 O WAT 4481 114.245 28.885 61.550 1.00 0.00 O ATOM 87602 H1 WAT 4481 114.599 28.051 61.856 1.00 0.00 H ATOM 87603 H2 WAT 4481 113.771 28.664 60.748 1.00 0.00 H TER 87605 WAT 4481 ATOM 87605 O WAT 4482 57.963 62.839 29.120 1.00 0.00 O ATOM 87606 H1 WAT 4482 58.434 63.118 29.905 1.00 0.00 H ATOM 87607 H2 WAT 4482 58.251 63.447 28.439 1.00 0.00 H TER 87609 WAT 4482 ATOM 87609 O WAT 4483 130.995 91.477 70.011 1.00 0.00 O ATOM 87610 H1 WAT 4483 130.814 91.895 70.852 1.00 0.00 H ATOM 87611 H2 WAT 4483 130.365 90.758 69.960 1.00 0.00 H TER 87613 WAT 4483 ATOM 87613 O WAT 4484 139.946 23.975 68.357 1.00 0.00 O ATOM 87614 H1 WAT 4484 140.577 23.290 68.134 1.00 0.00 H ATOM 87615 H2 WAT 4484 140.394 24.793 68.143 1.00 0.00 H TER 87617 WAT 4484 ATOM 87617 O WAT 4485 72.826 90.062 16.995 1.00 0.00 O ATOM 87618 H1 WAT 4485 73.179 89.770 17.835 1.00 0.00 H ATOM 87619 H2 WAT 4485 72.669 90.999 17.114 1.00 0.00 H TER 87621 WAT 4485 ATOM 87621 O WAT 4486 98.140 42.917 101.771 1.00 0.00 O ATOM 87622 H1 WAT 4486 98.778 43.021 101.065 1.00 0.00 H ATOM 87623 H2 WAT 4486 98.659 42.629 102.522 1.00 0.00 H TER 87625 WAT 4486 ATOM 87625 O WAT 4487 75.987 55.574 84.782 1.00 0.00 O ATOM 87626 H1 WAT 4487 76.025 54.619 84.829 1.00 0.00 H ATOM 87627 H2 WAT 4487 75.074 55.767 84.566 1.00 0.00 H TER 87629 WAT 4487 ATOM 87629 O WAT 4488 134.293 137.894 150.308 1.00 0.00 O ATOM 87630 H1 WAT 4488 134.886 137.796 149.563 1.00 0.00 H ATOM 87631 H2 WAT 4488 134.134 136.999 150.607 1.00 0.00 H TER 87633 WAT 4488 ATOM 87633 O WAT 4489 50.921 25.127 134.416 1.00 0.00 O ATOM 87634 H1 WAT 4489 51.649 24.517 134.300 1.00 0.00 H ATOM 87635 H2 WAT 4489 50.286 24.646 134.947 1.00 0.00 H TER 87637 WAT 4489 ATOM 87637 O WAT 4490 18.670 104.785 110.918 1.00 0.00 O ATOM 87638 H1 WAT 4490 18.887 105.515 110.339 1.00 0.00 H ATOM 87639 H2 WAT 4490 17.797 104.995 111.250 1.00 0.00 H TER 87641 WAT 4490 ATOM 87641 O WAT 4491 123.144 33.429 81.598 1.00 0.00 O ATOM 87642 H1 WAT 4491 124.012 33.572 81.974 1.00 0.00 H ATOM 87643 H2 WAT 4491 123.121 33.995 80.826 1.00 0.00 H TER 87645 WAT 4491 ATOM 87645 O WAT 4492 66.868 62.966 64.743 1.00 0.00 O ATOM 87646 H1 WAT 4492 66.010 63.180 65.109 1.00 0.00 H ATOM 87647 H2 WAT 4492 66.807 62.039 64.516 1.00 0.00 H TER 87649 WAT 4492 ATOM 87649 O WAT 4493 130.809 39.537 152.621 1.00 0.00 O ATOM 87650 H1 WAT 4493 130.940 40.238 153.259 1.00 0.00 H ATOM 87651 H2 WAT 4493 130.519 38.789 153.142 1.00 0.00 H TER 87653 WAT 4493 ATOM 87653 O WAT 4494 131.415 82.721 139.552 1.00 0.00 O ATOM 87654 H1 WAT 4494 131.681 82.807 138.637 1.00 0.00 H ATOM 87655 H2 WAT 4494 131.898 83.410 140.008 1.00 0.00 H TER 87657 WAT 4494 ATOM 87657 O WAT 4495 46.300 117.254 110.198 1.00 0.00 O ATOM 87658 H1 WAT 4495 46.788 117.728 109.525 1.00 0.00 H ATOM 87659 H2 WAT 4495 46.765 116.422 110.290 1.00 0.00 H TER 87661 WAT 4495 ATOM 87661 O WAT 4496 60.175 102.554 158.417 1.00 0.00 O ATOM 87662 H1 WAT 4496 59.609 102.042 158.994 1.00 0.00 H ATOM 87663 H2 WAT 4496 59.593 102.864 157.723 1.00 0.00 H TER 87665 WAT 4496 ATOM 87665 O WAT 4497 143.111 72.017 113.656 1.00 0.00 O ATOM 87666 H1 WAT 4497 143.981 71.625 113.577 1.00 0.00 H ATOM 87667 H2 WAT 4497 142.736 71.946 112.778 1.00 0.00 H TER 87669 WAT 4497 ATOM 87669 O WAT 4498 96.983 46.043 117.573 1.00 0.00 O ATOM 87670 H1 WAT 4498 96.031 46.113 117.631 1.00 0.00 H ATOM 87671 H2 WAT 4498 97.309 46.799 118.062 1.00 0.00 H TER 87673 WAT 4498 ATOM 87673 O WAT 4499 12.330 38.203 2.751 1.00 0.00 O ATOM 87674 H1 WAT 4499 12.889 37.969 3.492 1.00 0.00 H ATOM 87675 H2 WAT 4499 12.899 38.711 2.172 1.00 0.00 H TER 87677 WAT 4499 ATOM 87677 O WAT 4500 73.915 36.660 87.027 1.00 0.00 O ATOM 87678 H1 WAT 4500 74.204 35.893 87.523 1.00 0.00 H ATOM 87679 H2 WAT 4500 73.374 36.300 86.325 1.00 0.00 H TER 87681 WAT 4500 ATOM 87681 O WAT 4501 108.321 134.243 149.325 1.00 0.00 O ATOM 87682 H1 WAT 4501 107.608 133.605 149.293 1.00 0.00 H ATOM 87683 H2 WAT 4501 108.752 134.163 148.474 1.00 0.00 H TER 87685 WAT 4501 ATOM 87685 O WAT 4502 5.485 108.830 15.116 1.00 0.00 O ATOM 87686 H1 WAT 4502 5.417 107.897 15.322 1.00 0.00 H ATOM 87687 H2 WAT 4502 5.539 109.260 15.970 1.00 0.00 H TER 87689 WAT 4502 ATOM 87689 O WAT 4503 42.179 2.399 60.714 1.00 0.00 O ATOM 87690 H1 WAT 4503 41.648 2.636 59.954 1.00 0.00 H ATOM 87691 H2 WAT 4503 42.980 2.031 60.341 1.00 0.00 H TER 87693 WAT 4503 ATOM 87693 O WAT 4504 31.153 120.961 15.512 1.00 0.00 O ATOM 87694 H1 WAT 4504 32.022 121.216 15.820 1.00 0.00 H ATOM 87695 H2 WAT 4504 30.691 120.679 16.301 1.00 0.00 H TER 87697 WAT 4504 ATOM 87697 O WAT 4505 133.430 76.354 127.399 1.00 0.00 O ATOM 87698 H1 WAT 4505 134.118 76.881 126.992 1.00 0.00 H ATOM 87699 H2 WAT 4505 132.785 76.994 127.700 1.00 0.00 H TER 87701 WAT 4505 ATOM 87701 O WAT 4506 101.236 119.268 9.701 1.00 0.00 O ATOM 87702 H1 WAT 4506 100.485 118.866 9.266 1.00 0.00 H ATOM 87703 H2 WAT 4506 101.613 118.564 10.229 1.00 0.00 H TER 87705 WAT 4506 ATOM 87705 O WAT 4507 94.714 119.179 157.230 1.00 0.00 O ATOM 87706 H1 WAT 4507 95.304 119.458 157.930 1.00 0.00 H ATOM 87707 H2 WAT 4507 93.837 119.295 157.596 1.00 0.00 H TER 87709 WAT 4507 ATOM 87709 O WAT 4508 51.017 138.696 112.317 1.00 0.00 O ATOM 87710 H1 WAT 4508 51.457 138.205 113.011 1.00 0.00 H ATOM 87711 H2 WAT 4508 51.616 138.646 111.572 1.00 0.00 H TER 87713 WAT 4508 ATOM 87713 O WAT 4509 37.856 82.995 96.952 1.00 0.00 O ATOM 87714 H1 WAT 4509 38.309 82.232 96.594 1.00 0.00 H ATOM 87715 H2 WAT 4509 38.352 83.222 97.738 1.00 0.00 H TER 87717 WAT 4509 ATOM 87717 O WAT 4510 136.501 27.579 148.863 1.00 0.00 O ATOM 87718 H1 WAT 4510 135.716 27.377 149.371 1.00 0.00 H ATOM 87719 H2 WAT 4510 136.219 28.255 148.246 1.00 0.00 H TER 87721 WAT 4510 ATOM 87721 O WAT 4511 145.759 60.596 79.044 1.00 0.00 O ATOM 87722 H1 WAT 4511 145.582 59.726 79.403 1.00 0.00 H ATOM 87723 H2 WAT 4511 146.232 61.051 79.742 1.00 0.00 H TER 87725 WAT 4511 ATOM 87725 O WAT 4512 24.977 19.190 84.183 1.00 0.00 O ATOM 87726 H1 WAT 4512 24.442 18.397 84.214 1.00 0.00 H ATOM 87727 H2 WAT 4512 24.548 19.742 83.528 1.00 0.00 H TER 87729 WAT 4512 ATOM 87729 O WAT 4513 47.275 13.474 61.288 1.00 0.00 O ATOM 87730 H1 WAT 4513 47.531 12.553 61.231 1.00 0.00 H ATOM 87731 H2 WAT 4513 48.074 13.958 61.079 1.00 0.00 H TER 87733 WAT 4513 ATOM 87733 O WAT 4514 105.218 51.473 101.847 1.00 0.00 O ATOM 87734 H1 WAT 4514 105.121 51.122 100.962 1.00 0.00 H ATOM 87735 H2 WAT 4514 105.013 52.404 101.760 1.00 0.00 H TER 87737 WAT 4514 ATOM 87737 O WAT 4515 130.324 11.042 129.643 1.00 0.00 O ATOM 87738 H1 WAT 4515 130.541 11.367 130.516 1.00 0.00 H ATOM 87739 H2 WAT 4515 130.189 11.831 129.119 1.00 0.00 H TER 87741 WAT 4515 ATOM 87741 O WAT 4516 59.859 73.986 125.575 1.00 0.00 O ATOM 87742 H1 WAT 4516 59.905 74.318 126.472 1.00 0.00 H ATOM 87743 H2 WAT 4516 58.983 73.608 125.504 1.00 0.00 H TER 87745 WAT 4516 ATOM 87745 O WAT 4517 126.074 82.775 9.541 1.00 0.00 O ATOM 87746 H1 WAT 4517 125.927 83.720 9.529 1.00 0.00 H ATOM 87747 H2 WAT 4517 125.201 82.395 9.442 1.00 0.00 H TER 87749 WAT 4517 ATOM 87749 O WAT 4518 74.808 52.815 127.297 1.00 0.00 O ATOM 87750 H1 WAT 4518 74.013 52.284 127.326 1.00 0.00 H ATOM 87751 H2 WAT 4518 74.602 53.586 127.826 1.00 0.00 H TER 87753 WAT 4518 ATOM 87753 O WAT 4519 136.685 27.469 109.954 1.00 0.00 O ATOM 87754 H1 WAT 4519 136.360 28.304 109.616 1.00 0.00 H ATOM 87755 H2 WAT 4519 136.189 27.327 110.760 1.00 0.00 H TER 87757 WAT 4519 ATOM 87757 O WAT 4520 110.496 76.297 102.932 1.00 0.00 O ATOM 87758 H1 WAT 4520 111.433 76.486 102.986 1.00 0.00 H ATOM 87759 H2 WAT 4520 110.445 75.342 102.895 1.00 0.00 H TER 87761 WAT 4520 ATOM 87761 O WAT 4521 134.478 112.097 58.152 1.00 0.00 O ATOM 87762 H1 WAT 4521 133.633 112.421 58.463 1.00 0.00 H ATOM 87763 H2 WAT 4521 135.060 112.855 58.206 1.00 0.00 H TER 87765 WAT 4521 ATOM 87765 O WAT 4522 124.544 132.855 7.617 1.00 0.00 O ATOM 87766 H1 WAT 4522 124.138 133.647 7.264 1.00 0.00 H ATOM 87767 H2 WAT 4522 123.915 132.530 8.261 1.00 0.00 H TER 87769 WAT 4522 ATOM 87769 O WAT 4523 22.305 116.521 76.563 1.00 0.00 O ATOM 87770 H1 WAT 4523 21.537 116.841 77.037 1.00 0.00 H ATOM 87771 H2 WAT 4523 22.259 116.956 75.711 1.00 0.00 H TER 87773 WAT 4523 ATOM 87773 O WAT 4524 111.250 39.606 78.177 1.00 0.00 O ATOM 87774 H1 WAT 4524 110.326 39.422 78.348 1.00 0.00 H ATOM 87775 H2 WAT 4524 111.384 40.491 78.516 1.00 0.00 H TER 87777 WAT 4524 ATOM 87777 O WAT 4525 21.272 82.779 96.273 1.00 0.00 O ATOM 87778 H1 WAT 4525 22.208 82.698 96.454 1.00 0.00 H ATOM 87779 H2 WAT 4525 20.907 83.169 97.067 1.00 0.00 H TER 87781 WAT 4525 ATOM 87781 O WAT 4526 77.693 99.450 115.040 1.00 0.00 O ATOM 87782 H1 WAT 4526 77.864 100.279 115.486 1.00 0.00 H ATOM 87783 H2 WAT 4526 77.205 98.930 115.678 1.00 0.00 H TER 87785 WAT 4526 ATOM 87785 O WAT 4527 106.300 121.412 122.412 1.00 0.00 O ATOM 87786 H1 WAT 4527 106.405 120.591 122.892 1.00 0.00 H ATOM 87787 H2 WAT 4527 107.167 121.590 122.048 1.00 0.00 H TER 87789 WAT 4527 ATOM 87789 O WAT 4528 128.807 21.047 74.459 1.00 0.00 O ATOM 87790 H1 WAT 4528 128.817 21.646 75.206 1.00 0.00 H ATOM 87791 H2 WAT 4528 129.297 21.507 73.777 1.00 0.00 H TER 87793 WAT 4528 ATOM 87793 O WAT 4529 85.638 38.953 148.743 1.00 0.00 O ATOM 87794 H1 WAT 4529 86.448 38.835 148.246 1.00 0.00 H ATOM 87795 H2 WAT 4529 85.131 38.161 148.566 1.00 0.00 H TER 87797 WAT 4529 ATOM 87797 O WAT 4530 52.521 65.899 91.942 1.00 0.00 O ATOM 87798 H1 WAT 4530 52.800 65.427 92.727 1.00 0.00 H ATOM 87799 H2 WAT 4530 51.827 65.356 91.570 1.00 0.00 H TER 87801 WAT 4530 ATOM 87801 O WAT 4531 62.252 25.690 70.156 1.00 0.00 O ATOM 87802 H1 WAT 4531 61.783 25.115 70.760 1.00 0.00 H ATOM 87803 H2 WAT 4531 62.524 26.433 70.695 1.00 0.00 H TER 87805 WAT 4531 ATOM 87805 O WAT 4532 6.051 71.847 153.493 1.00 0.00 O ATOM 87806 H1 WAT 4532 6.232 72.715 153.854 1.00 0.00 H ATOM 87807 H2 WAT 4532 5.195 71.612 153.851 1.00 0.00 H TER 87809 WAT 4532 ATOM 87809 O WAT 4533 123.270 113.100 151.747 1.00 0.00 O ATOM 87810 H1 WAT 4533 123.520 113.114 150.823 1.00 0.00 H ATOM 87811 H2 WAT 4533 122.751 113.895 151.867 1.00 0.00 H TER 87813 WAT 4533 ATOM 87813 O WAT 4534 16.856 58.400 1.846 1.00 0.00 O ATOM 87814 H1 WAT 4534 16.258 57.909 2.409 1.00 0.00 H ATOM 87815 H2 WAT 4534 16.979 57.840 1.080 1.00 0.00 H TER 87817 WAT 4534 ATOM 87817 O WAT 4535 113.906 15.342 102.392 1.00 0.00 O ATOM 87818 H1 WAT 4535 113.944 14.460 102.022 1.00 0.00 H ATOM 87819 H2 WAT 4535 114.755 15.729 102.178 1.00 0.00 H TER 87821 WAT 4535 ATOM 87821 O WAT 4536 77.110 19.754 2.534 1.00 0.00 O ATOM 87822 H1 WAT 4536 76.805 20.628 2.290 1.00 0.00 H ATOM 87823 H2 WAT 4536 76.628 19.162 1.957 1.00 0.00 H TER 87825 WAT 4536 ATOM 87825 O WAT 4537 101.330 122.678 154.646 1.00 0.00 O ATOM 87826 H1 WAT 4537 100.494 122.849 154.213 1.00 0.00 H ATOM 87827 H2 WAT 4537 101.370 121.725 154.725 1.00 0.00 H TER 87829 WAT 4537 ATOM 87829 O WAT 4538 46.605 85.643 63.320 1.00 0.00 O ATOM 87830 H1 WAT 4538 46.491 86.018 62.447 1.00 0.00 H ATOM 87831 H2 WAT 4538 46.290 84.743 63.237 1.00 0.00 H TER 87833 WAT 4538 ATOM 87833 O WAT 4539 59.969 49.821 131.729 1.00 0.00 O ATOM 87834 H1 WAT 4539 59.390 49.630 132.468 1.00 0.00 H ATOM 87835 H2 WAT 4539 60.775 50.141 132.133 1.00 0.00 H TER 87837 WAT 4539 ATOM 87837 O WAT 4540 28.157 131.805 76.699 1.00 0.00 O ATOM 87838 H1 WAT 4540 28.852 131.411 76.171 1.00 0.00 H ATOM 87839 H2 WAT 4540 28.557 131.939 77.558 1.00 0.00 H TER 87841 WAT 4540 ATOM 87841 O WAT 4541 80.623 26.696 93.841 1.00 0.00 O ATOM 87842 H1 WAT 4541 80.356 27.090 93.010 1.00 0.00 H ATOM 87843 H2 WAT 4541 81.056 27.406 94.315 1.00 0.00 H TER 87845 WAT 4541 ATOM 87845 O WAT 4542 23.748 25.985 155.273 1.00 0.00 O ATOM 87846 H1 WAT 4542 24.058 26.160 156.161 1.00 0.00 H ATOM 87847 H2 WAT 4542 23.938 26.789 154.790 1.00 0.00 H TER 87849 WAT 4542 ATOM 87849 O WAT 4543 74.770 12.901 78.286 1.00 0.00 O ATOM 87850 H1 WAT 4543 74.280 12.181 77.889 1.00 0.00 H ATOM 87851 H2 WAT 4543 75.684 12.721 78.064 1.00 0.00 H TER 87853 WAT 4543 ATOM 87853 O WAT 4544 13.022 29.639 111.637 1.00 0.00 O ATOM 87854 H1 WAT 4544 12.101 29.770 111.860 1.00 0.00 H ATOM 87855 H2 WAT 4544 13.487 29.744 112.467 1.00 0.00 H TER 87857 WAT 4544 ATOM 87857 O WAT 4545 118.737 128.084 3.434 1.00 0.00 O ATOM 87858 H1 WAT 4545 119.157 127.224 3.432 1.00 0.00 H ATOM 87859 H2 WAT 4545 118.973 128.468 2.589 1.00 0.00 H TER 87861 WAT 4545 ATOM 87861 O WAT 4546 116.928 46.674 116.564 1.00 0.00 O ATOM 87862 H1 WAT 4546 116.071 47.097 116.608 1.00 0.00 H ATOM 87863 H2 WAT 4546 117.070 46.514 115.631 1.00 0.00 H TER 87865 WAT 4546 ATOM 87865 O WAT 4547 107.793 104.805 154.171 1.00 0.00 O ATOM 87866 H1 WAT 4547 106.923 105.122 153.925 1.00 0.00 H ATOM 87867 H2 WAT 4547 107.842 104.948 155.116 1.00 0.00 H TER 87869 WAT 4547 ATOM 87869 O WAT 4548 133.516 22.065 157.222 1.00 0.00 O ATOM 87870 H1 WAT 4548 134.039 21.363 157.609 1.00 0.00 H ATOM 87871 H2 WAT 4548 132.982 21.627 156.559 1.00 0.00 H TER 87873 WAT 4548 ATOM 87873 O WAT 4549 10.853 99.736 8.115 1.00 0.00 O ATOM 87874 H1 WAT 4549 11.646 99.565 7.607 1.00 0.00 H ATOM 87875 H2 WAT 4549 10.707 98.931 8.611 1.00 0.00 H TER 87877 WAT 4549 ATOM 87877 O WAT 4550 119.582 40.293 23.380 1.00 0.00 O ATOM 87878 H1 WAT 4550 120.006 40.545 22.560 1.00 0.00 H ATOM 87879 H2 WAT 4550 120.253 39.806 23.858 1.00 0.00 H TER 87881 WAT 4550 ATOM 87881 O WAT 4551 9.260 102.535 118.925 1.00 0.00 O ATOM 87882 H1 WAT 4551 9.308 103.481 118.784 1.00 0.00 H ATOM 87883 H2 WAT 4551 8.645 102.433 119.652 1.00 0.00 H TER 87885 WAT 4551 ATOM 87885 O WAT 4552 85.723 21.141 17.007 1.00 0.00 O ATOM 87886 H1 WAT 4552 84.962 20.907 16.476 1.00 0.00 H ATOM 87887 H2 WAT 4552 86.464 20.741 16.552 1.00 0.00 H TER 87889 WAT 4552 ATOM 87889 O WAT 4553 132.145 40.733 5.422 1.00 0.00 O ATOM 87890 H1 WAT 4553 131.862 40.771 4.508 1.00 0.00 H ATOM 87891 H2 WAT 4553 132.639 41.542 5.554 1.00 0.00 H TER 87893 WAT 4553 ATOM 87893 O WAT 4554 104.074 88.991 10.549 1.00 0.00 O ATOM 87894 H1 WAT 4554 103.502 88.624 9.876 1.00 0.00 H ATOM 87895 H2 WAT 4554 104.632 89.610 10.078 1.00 0.00 H TER 87897 WAT 4554 ATOM 87897 O WAT 4555 47.159 36.077 85.921 1.00 0.00 O ATOM 87898 H1 WAT 4555 47.719 35.316 85.768 1.00 0.00 H ATOM 87899 H2 WAT 4555 47.704 36.827 85.682 1.00 0.00 H TER 87901 WAT 4555 ATOM 87901 O WAT 4556 97.056 36.656 61.766 1.00 0.00 O ATOM 87902 H1 WAT 4556 97.280 35.811 61.378 1.00 0.00 H ATOM 87903 H2 WAT 4556 96.175 36.843 61.441 1.00 0.00 H TER 87905 WAT 4556 ATOM 87905 O WAT 4557 97.017 55.533 14.239 1.00 0.00 O ATOM 87906 H1 WAT 4557 96.419 55.703 14.967 1.00 0.00 H ATOM 87907 H2 WAT 4557 97.890 55.652 14.614 1.00 0.00 H TER 87909 WAT 4557 ATOM 87909 O WAT 4558 99.637 127.047 116.080 1.00 0.00 O ATOM 87910 H1 WAT 4558 99.951 126.340 115.516 1.00 0.00 H ATOM 87911 H2 WAT 4558 100.203 127.008 116.851 1.00 0.00 H TER 87913 WAT 4558 ATOM 87913 O WAT 4559 45.882 48.287 154.581 1.00 0.00 O ATOM 87914 H1 WAT 4559 46.459 48.107 153.839 1.00 0.00 H ATOM 87915 H2 WAT 4559 46.465 48.619 155.263 1.00 0.00 H TER 87917 WAT 4559 ATOM 87917 O WAT 4560 87.029 35.073 1.403 1.00 0.00 O ATOM 87918 H1 WAT 4560 87.289 34.657 0.582 1.00 0.00 H ATOM 87919 H2 WAT 4560 87.033 34.363 2.044 1.00 0.00 H TER 87921 WAT 4560 ATOM 87921 O WAT 4561 51.462 126.582 95.360 1.00 0.00 O ATOM 87922 H1 WAT 4561 52.093 127.282 95.530 1.00 0.00 H ATOM 87923 H2 WAT 4561 51.707 125.885 95.968 1.00 0.00 H TER 87925 WAT 4561 ATOM 87925 O WAT 4562 110.811 81.028 77.663 1.00 0.00 O ATOM 87926 H1 WAT 4562 110.188 80.591 77.082 1.00 0.00 H ATOM 87927 H2 WAT 4562 110.702 81.960 77.474 1.00 0.00 H TER 87929 WAT 4562 ATOM 87929 O WAT 4563 36.224 71.842 87.158 1.00 0.00 O ATOM 87930 H1 WAT 4563 35.516 71.201 87.226 1.00 0.00 H ATOM 87931 H2 WAT 4563 36.120 72.222 86.286 1.00 0.00 H TER 87933 WAT 4563 ATOM 87933 O WAT 4564 126.122 119.804 66.337 1.00 0.00 O ATOM 87934 H1 WAT 4564 126.737 119.256 66.824 1.00 0.00 H ATOM 87935 H2 WAT 4564 125.261 119.444 66.547 1.00 0.00 H TER 87937 WAT 4564 ATOM 87937 O WAT 4565 27.465 133.554 147.926 1.00 0.00 O ATOM 87938 H1 WAT 4565 27.954 134.219 148.411 1.00 0.00 H ATOM 87939 H2 WAT 4565 27.008 133.054 148.601 1.00 0.00 H TER 87941 WAT 4565 ATOM 87941 O WAT 4566 105.976 39.031 89.725 1.00 0.00 O ATOM 87942 H1 WAT 4566 106.070 38.783 88.806 1.00 0.00 H ATOM 87943 H2 WAT 4566 105.415 39.806 89.708 1.00 0.00 H TER 87945 WAT 4566 ATOM 87945 O WAT 4567 106.982 91.495 137.871 1.00 0.00 O ATOM 87946 H1 WAT 4567 106.752 91.828 137.004 1.00 0.00 H ATOM 87947 H2 WAT 4567 106.250 91.755 138.430 1.00 0.00 H TER 87949 WAT 4567 ATOM 87949 O WAT 4568 129.838 74.219 135.297 1.00 0.00 O ATOM 87950 H1 WAT 4568 130.241 74.745 134.606 1.00 0.00 H ATOM 87951 H2 WAT 4568 130.433 74.306 136.042 1.00 0.00 H TER 87953 WAT 4568 ATOM 87953 O WAT 4569 70.047 16.669 73.877 1.00 0.00 O ATOM 87954 H1 WAT 4569 70.562 15.927 73.559 1.00 0.00 H ATOM 87955 H2 WAT 4569 70.686 17.372 73.994 1.00 0.00 H TER 87957 WAT 4569 ATOM 87957 O WAT 4570 51.235 143.881 141.810 1.00 0.00 O ATOM 87958 H1 WAT 4570 50.852 144.363 142.542 1.00 0.00 H ATOM 87959 H2 WAT 4570 50.487 143.636 141.266 1.00 0.00 H TER 87961 WAT 4570 ATOM 87961 O WAT 4571 13.685 73.256 114.554 1.00 0.00 O ATOM 87962 H1 WAT 4571 13.923 72.699 113.812 1.00 0.00 H ATOM 87963 H2 WAT 4571 13.274 74.023 114.155 1.00 0.00 H TER 87965 WAT 4571 ATOM 87965 O WAT 4572 94.682 97.925 116.134 1.00 0.00 O ATOM 87966 H1 WAT 4572 94.417 97.708 115.240 1.00 0.00 H ATOM 87967 H2 WAT 4572 93.960 97.616 116.680 1.00 0.00 H TER 87969 WAT 4572 ATOM 87969 O WAT 4573 11.339 39.526 10.203 1.00 0.00 O ATOM 87970 H1 WAT 4573 11.480 39.691 11.135 1.00 0.00 H ATOM 87971 H2 WAT 4573 10.990 40.350 9.864 1.00 0.00 H TER 87973 WAT 4573 ATOM 87973 O WAT 4574 32.845 97.429 99.280 1.00 0.00 O ATOM 87974 H1 WAT 4574 33.166 97.136 100.133 1.00 0.00 H ATOM 87975 H2 WAT 4574 33.622 97.438 98.721 1.00 0.00 H TER 87977 WAT 4574 ATOM 87977 O WAT 4575 101.952 54.969 8.220 1.00 0.00 O ATOM 87978 H1 WAT 4575 101.961 54.801 7.278 1.00 0.00 H ATOM 87979 H2 WAT 4575 101.206 54.465 8.546 1.00 0.00 H TER 87981 WAT 4575 ATOM 87981 O WAT 4576 28.782 49.305 132.534 1.00 0.00 O ATOM 87982 H1 WAT 4576 29.075 48.746 133.254 1.00 0.00 H ATOM 87983 H2 WAT 4576 29.579 49.737 132.227 1.00 0.00 H TER 87985 WAT 4576 ATOM 87985 O WAT 4577 39.715 26.182 107.074 1.00 0.00 O ATOM 87986 H1 WAT 4577 39.169 25.858 106.358 1.00 0.00 H ATOM 87987 H2 WAT 4577 40.583 26.287 106.684 1.00 0.00 H TER 87989 WAT 4577 ATOM 87989 O WAT 4578 12.411 129.138 91.670 1.00 0.00 O ATOM 87990 H1 WAT 4578 12.698 129.520 90.841 1.00 0.00 H ATOM 87991 H2 WAT 4578 12.143 128.248 91.444 1.00 0.00 H TER 87993 WAT 4578 ATOM 87993 O WAT 4579 110.673 132.201 113.957 1.00 0.00 O ATOM 87994 H1 WAT 4579 110.955 133.081 114.207 1.00 0.00 H ATOM 87995 H2 WAT 4579 111.307 131.618 114.374 1.00 0.00 H TER 87997 WAT 4579 ATOM 87997 O WAT 4580 105.011 41.196 75.409 1.00 0.00 O ATOM 87998 H1 WAT 4580 105.456 40.738 74.696 1.00 0.00 H ATOM 87999 H2 WAT 4580 104.082 41.137 75.188 1.00 0.00 H TER 88001 WAT 4580 ATOM 88001 O WAT 4581 133.103 104.804 73.054 1.00 0.00 O ATOM 88002 H1 WAT 4581 133.993 105.068 72.819 1.00 0.00 H ATOM 88003 H2 WAT 4581 132.567 105.080 72.311 1.00 0.00 H TER 88005 WAT 4581 ATOM 88005 O WAT 4582 29.958 24.655 24.735 1.00 0.00 O ATOM 88006 H1 WAT 4582 30.624 24.674 25.422 1.00 0.00 H ATOM 88007 H2 WAT 4582 29.264 24.100 25.090 1.00 0.00 H TER 88009 WAT 4582 ATOM 88009 O WAT 4583 67.828 91.528 71.212 1.00 0.00 O ATOM 88010 H1 WAT 4583 68.252 92.370 71.048 1.00 0.00 H ATOM 88011 H2 WAT 4583 67.840 91.435 72.164 1.00 0.00 H TER 88013 WAT 4583 ATOM 88013 O WAT 4584 54.891 99.047 157.573 1.00 0.00 O ATOM 88014 H1 WAT 4584 54.444 99.874 157.394 1.00 0.00 H ATOM 88015 H2 WAT 4584 54.269 98.549 158.104 1.00 0.00 H TER 88017 WAT 4584 ATOM 88017 O WAT 4585 32.296 113.309 17.302 1.00 0.00 O ATOM 88018 H1 WAT 4585 31.579 112.859 17.750 1.00 0.00 H ATOM 88019 H2 WAT 4585 31.864 113.841 16.634 1.00 0.00 H TER 88021 WAT 4585 ATOM 88021 O WAT 4586 28.282 12.804 142.995 1.00 0.00 O ATOM 88022 H1 WAT 4586 28.906 12.856 143.719 1.00 0.00 H ATOM 88023 H2 WAT 4586 28.761 13.147 142.241 1.00 0.00 H TER 88025 WAT 4586 ATOM 88025 O WAT 4587 141.610 37.417 96.133 1.00 0.00 O ATOM 88026 H1 WAT 4587 141.751 36.474 96.054 1.00 0.00 H ATOM 88027 H2 WAT 4587 142.429 37.808 95.828 1.00 0.00 H TER 88029 WAT 4587 ATOM 88029 O WAT 4588 74.116 84.095 133.972 1.00 0.00 O ATOM 88030 H1 WAT 4588 74.175 83.148 134.104 1.00 0.00 H ATOM 88031 H2 WAT 4588 73.477 84.388 134.621 1.00 0.00 H TER 88033 WAT 4588 ATOM 88033 O WAT 4589 7.196 34.903 100.454 1.00 0.00 O ATOM 88034 H1 WAT 4589 7.654 35.685 100.766 1.00 0.00 H ATOM 88035 H2 WAT 4589 7.569 34.737 99.588 1.00 0.00 H TER 88037 WAT 4589 ATOM 88037 O WAT 4590 88.336 108.608 129.369 1.00 0.00 O ATOM 88038 H1 WAT 4590 88.886 109.273 128.955 1.00 0.00 H ATOM 88039 H2 WAT 4590 88.052 109.009 130.190 1.00 0.00 H TER 88041 WAT 4590 ATOM 88041 O WAT 4591 44.566 83.421 122.900 1.00 0.00 O ATOM 88042 H1 WAT 4591 44.261 82.717 123.471 1.00 0.00 H ATOM 88043 H2 WAT 4591 45.142 82.986 122.271 1.00 0.00 H TER 88045 WAT 4591 ATOM 88045 O WAT 4592 43.923 39.519 136.689 1.00 0.00 O ATOM 88046 H1 WAT 4592 43.887 39.331 137.627 1.00 0.00 H ATOM 88047 H2 WAT 4592 44.826 39.324 136.440 1.00 0.00 H TER 88049 WAT 4592 ATOM 88049 O WAT 4593 35.123 106.219 133.616 1.00 0.00 O ATOM 88050 H1 WAT 4593 34.646 106.702 132.941 1.00 0.00 H ATOM 88051 H2 WAT 4593 34.755 106.534 134.442 1.00 0.00 H TER 88053 WAT 4593 ATOM 88053 O WAT 4594 134.249 43.407 11.881 1.00 0.00 O ATOM 88054 H1 WAT 4594 133.873 44.159 11.423 1.00 0.00 H ATOM 88055 H2 WAT 4594 135.005 43.156 11.350 1.00 0.00 H TER 88057 WAT 4594 ATOM 88057 O WAT 4595 48.723 94.847 146.630 1.00 0.00 O ATOM 88058 H1 WAT 4595 48.265 94.508 147.399 1.00 0.00 H ATOM 88059 H2 WAT 4595 48.521 95.783 146.624 1.00 0.00 H TER 88061 WAT 4595 ATOM 88061 O WAT 4596 133.452 6.530 136.088 1.00 0.00 O ATOM 88062 H1 WAT 4596 134.084 5.853 135.847 1.00 0.00 H ATOM 88063 H2 WAT 4596 133.609 7.238 135.463 1.00 0.00 H TER 88065 WAT 4596 ATOM 88065 O WAT 4597 7.499 56.429 105.256 1.00 0.00 O ATOM 88066 H1 WAT 4597 7.894 56.589 106.113 1.00 0.00 H ATOM 88067 H2 WAT 4597 7.212 57.293 104.961 1.00 0.00 H TER 88069 WAT 4597 ATOM 88069 O WAT 4598 68.687 17.947 2.802 1.00 0.00 O ATOM 88070 H1 WAT 4598 68.793 18.440 1.988 1.00 0.00 H ATOM 88071 H2 WAT 4598 67.791 18.134 3.081 1.00 0.00 H TER 88073 WAT 4598 ATOM 88073 O WAT 4599 136.693 42.450 10.627 1.00 0.00 O ATOM 88074 H1 WAT 4599 136.765 42.434 9.673 1.00 0.00 H ATOM 88075 H2 WAT 4599 137.105 43.275 10.885 1.00 0.00 H TER 88077 WAT 4599 ATOM 88077 O WAT 4600 83.260 6.081 99.628 1.00 0.00 O ATOM 88078 H1 WAT 4600 84.025 6.401 99.151 1.00 0.00 H ATOM 88079 H2 WAT 4600 82.637 5.834 98.943 1.00 0.00 H TER 88081 WAT 4600 ATOM 88081 O WAT 4601 94.039 36.798 151.630 1.00 0.00 O ATOM 88082 H1 WAT 4601 93.934 37.736 151.791 1.00 0.00 H ATOM 88083 H2 WAT 4601 93.177 36.509 151.329 1.00 0.00 H TER 88085 WAT 4601 ATOM 88085 O WAT 4602 13.002 13.525 120.003 1.00 0.00 O ATOM 88086 H1 WAT 4602 12.743 14.397 120.300 1.00 0.00 H ATOM 88087 H2 WAT 4602 12.364 13.304 119.324 1.00 0.00 H TER 88089 WAT 4602 ATOM 88089 O WAT 4603 111.825 15.620 130.008 1.00 0.00 O ATOM 88090 H1 WAT 4603 112.065 16.533 129.851 1.00 0.00 H ATOM 88091 H2 WAT 4603 112.580 15.249 130.465 1.00 0.00 H TER 88093 WAT 4603 ATOM 88093 O WAT 4604 55.283 130.166 153.626 1.00 0.00 O ATOM 88094 H1 WAT 4604 55.661 129.562 154.265 1.00 0.00 H ATOM 88095 H2 WAT 4604 55.150 130.979 154.114 1.00 0.00 H TER 88097 WAT 4604 ATOM 88097 O WAT 4605 54.021 38.859 90.754 1.00 0.00 O ATOM 88098 H1 WAT 4605 54.576 39.607 90.532 1.00 0.00 H ATOM 88099 H2 WAT 4605 53.232 39.249 91.130 1.00 0.00 H TER 88101 WAT 4605 ATOM 88101 O WAT 4606 4.665 27.474 114.701 1.00 0.00 O ATOM 88102 H1 WAT 4606 5.535 27.238 114.380 1.00 0.00 H ATOM 88103 H2 WAT 4606 4.764 28.370 115.025 1.00 0.00 H TER 88105 WAT 4606 ATOM 88105 O WAT 4607 46.128 22.628 113.731 1.00 0.00 O ATOM 88106 H1 WAT 4607 45.507 22.192 113.147 1.00 0.00 H ATOM 88107 H2 WAT 4607 46.220 22.029 114.472 1.00 0.00 H TER 88109 WAT 4607 ATOM 88109 O WAT 4608 36.901 30.614 81.734 1.00 0.00 O ATOM 88110 H1 WAT 4608 37.143 30.031 82.453 1.00 0.00 H ATOM 88111 H2 WAT 4608 37.107 31.491 82.057 1.00 0.00 H TER 88113 WAT 4608 ATOM 88113 O WAT 4609 102.174 35.389 102.739 1.00 0.00 O ATOM 88114 H1 WAT 4609 102.441 35.433 103.657 1.00 0.00 H ATOM 88115 H2 WAT 4609 102.793 35.959 102.282 1.00 0.00 H TER 88117 WAT 4609 ATOM 88117 O WAT 4610 17.943 109.792 113.300 1.00 0.00 O ATOM 88118 H1 WAT 4610 17.868 108.850 113.457 1.00 0.00 H ATOM 88119 H2 WAT 4610 17.432 109.943 112.505 1.00 0.00 H TER 88121 WAT 4610 ATOM 88121 O WAT 4611 74.409 55.594 71.966 1.00 0.00 O ATOM 88122 H1 WAT 4611 74.643 54.667 71.915 1.00 0.00 H ATOM 88123 H2 WAT 4611 73.639 55.616 72.535 1.00 0.00 H TER 88125 WAT 4611 ATOM 88125 O WAT 4612 17.692 85.361 67.137 1.00 0.00 O ATOM 88126 H1 WAT 4612 18.320 85.616 66.462 1.00 0.00 H ATOM 88127 H2 WAT 4612 16.939 85.027 66.650 1.00 0.00 H TER 88129 WAT 4612 ATOM 88129 O WAT 4613 65.696 114.205 122.645 1.00 0.00 O ATOM 88130 H1 WAT 4613 65.265 113.352 122.689 1.00 0.00 H ATOM 88131 H2 WAT 4613 65.081 114.806 123.065 1.00 0.00 H TER 88133 WAT 4613 ATOM 88133 O WAT 4614 87.103 124.680 113.254 1.00 0.00 O ATOM 88134 H1 WAT 4614 87.632 124.250 113.926 1.00 0.00 H ATOM 88135 H2 WAT 4614 86.209 124.386 113.427 1.00 0.00 H TER 88137 WAT 4614 ATOM 88137 O WAT 4615 28.659 95.940 141.168 1.00 0.00 O ATOM 88138 H1 WAT 4615 29.161 95.523 140.468 1.00 0.00 H ATOM 88139 H2 WAT 4615 28.499 96.829 140.852 1.00 0.00 H TER 88141 WAT 4615 ATOM 88141 O WAT 4616 81.701 63.800 141.787 1.00 0.00 O ATOM 88142 H1 WAT 4616 82.278 63.395 142.434 1.00 0.00 H ATOM 88143 H2 WAT 4616 82.180 63.731 140.962 1.00 0.00 H TER 88145 WAT 4616 ATOM 88145 O WAT 4617 26.732 132.981 118.897 1.00 0.00 O ATOM 88146 H1 WAT 4617 26.643 133.864 118.540 1.00 0.00 H ATOM 88147 H2 WAT 4617 27.676 132.821 118.906 1.00 0.00 H TER 88149 WAT 4617 ATOM 88149 O WAT 4618 120.568 1.433 0.010 1.00 0.00 O ATOM 88150 H1 WAT 4618 120.246 2.328 0.113 1.00 0.00 H ATOM 88151 H2 WAT 4618 121.292 1.365 0.634 1.00 0.00 H TER 88153 WAT 4618 ATOM 88153 O WAT 4619 128.696 51.611 137.473 1.00 0.00 O ATOM 88154 H1 WAT 4619 129.161 51.943 136.705 1.00 0.00 H ATOM 88155 H2 WAT 4619 129.159 50.806 137.705 1.00 0.00 H TER 88157 WAT 4619 ATOM 88157 O WAT 4620 110.903 44.224 2.363 1.00 0.00 O ATOM 88158 H1 WAT 4620 110.351 44.500 1.631 1.00 0.00 H ATOM 88159 H2 WAT 4620 111.231 45.042 2.737 1.00 0.00 H TER 88161 WAT 4620 ATOM 88161 O WAT 4621 3.119 8.643 83.841 1.00 0.00 O ATOM 88162 H1 WAT 4621 4.042 8.501 83.633 1.00 0.00 H ATOM 88163 H2 WAT 4621 3.129 9.306 84.532 1.00 0.00 H TER 88165 WAT 4621 ATOM 88165 O WAT 4622 26.858 134.768 90.359 1.00 0.00 O ATOM 88166 H1 WAT 4622 26.211 135.351 90.758 1.00 0.00 H ATOM 88167 H2 WAT 4622 27.237 134.292 91.098 1.00 0.00 H TER 88169 WAT 4622 ATOM 88169 O WAT 4623 77.925 39.988 80.227 1.00 0.00 O ATOM 88170 H1 WAT 4623 77.464 40.347 80.986 1.00 0.00 H ATOM 88171 H2 WAT 4623 78.795 39.765 80.559 1.00 0.00 H TER 88173 WAT 4623 ATOM 88173 O WAT 4624 8.134 13.360 74.653 1.00 0.00 O ATOM 88174 H1 WAT 4624 8.462 13.700 73.820 1.00 0.00 H ATOM 88175 H2 WAT 4624 7.493 14.009 74.940 1.00 0.00 H TER 88177 WAT 4624 ATOM 88177 O WAT 4625 10.410 113.021 153.013 1.00 0.00 O ATOM 88178 H1 WAT 4625 10.500 113.450 153.864 1.00 0.00 H ATOM 88179 H2 WAT 4625 9.556 113.308 152.689 1.00 0.00 H TER 88181 WAT 4625 ATOM 88181 O WAT 4626 109.952 136.579 121.816 1.00 0.00 O ATOM 88182 H1 WAT 4626 109.050 136.881 121.920 1.00 0.00 H ATOM 88183 H2 WAT 4626 110.075 136.514 120.869 1.00 0.00 H TER 88185 WAT 4626 ATOM 88185 O WAT 4627 14.771 78.530 96.962 1.00 0.00 O ATOM 88186 H1 WAT 4627 14.750 77.586 96.805 1.00 0.00 H ATOM 88187 H2 WAT 4627 15.295 78.630 97.757 1.00 0.00 H TER 88189 WAT 4627 ATOM 88189 O WAT 4628 88.844 70.168 146.368 1.00 0.00 O ATOM 88190 H1 WAT 4628 89.636 69.823 146.781 1.00 0.00 H ATOM 88191 H2 WAT 4628 88.622 69.522 145.698 1.00 0.00 H TER 88193 WAT 4628 ATOM 88193 O WAT 4629 100.831 123.805 65.114 1.00 0.00 O ATOM 88194 H1 WAT 4629 101.415 123.159 64.716 1.00 0.00 H ATOM 88195 H2 WAT 4629 100.137 123.284 65.518 1.00 0.00 H TER 88197 WAT 4629 ATOM 88197 O WAT 4630 64.951 7.509 140.408 1.00 0.00 O ATOM 88198 H1 WAT 4630 64.315 7.968 139.860 1.00 0.00 H ATOM 88199 H2 WAT 4630 64.955 6.613 140.070 1.00 0.00 H TER 88201 WAT 4630 ATOM 88201 O WAT 4631 54.891 134.658 50.462 1.00 0.00 O ATOM 88202 H1 WAT 4631 54.328 133.998 50.057 1.00 0.00 H ATOM 88203 H2 WAT 4631 55.778 134.312 50.359 1.00 0.00 H TER 88205 WAT 4631 ATOM 88205 O WAT 4632 15.176 69.038 83.542 1.00 0.00 O ATOM 88206 H1 WAT 4632 14.656 69.533 82.909 1.00 0.00 H ATOM 88207 H2 WAT 4632 14.884 69.358 84.395 1.00 0.00 H TER 88209 WAT 4632 ATOM 88209 O WAT 4633 133.190 120.890 88.571 1.00 0.00 O ATOM 88210 H1 WAT 4633 133.177 119.971 88.303 1.00 0.00 H ATOM 88211 H2 WAT 4633 132.270 121.110 88.717 1.00 0.00 H TER 88213 WAT 4633 ATOM 88213 O WAT 4634 12.688 91.919 24.276 1.00 0.00 O ATOM 88214 H1 WAT 4634 11.922 92.405 24.581 1.00 0.00 H ATOM 88215 H2 WAT 4634 13.375 92.132 24.908 1.00 0.00 H TER 88217 WAT 4634 ATOM 88217 O WAT 4635 56.563 134.938 118.987 1.00 0.00 O ATOM 88218 H1 WAT 4635 56.443 135.723 118.453 1.00 0.00 H ATOM 88219 H2 WAT 4635 56.099 135.131 119.802 1.00 0.00 H TER 88221 WAT 4635 ATOM 88221 O WAT 4636 44.934 138.468 17.514 1.00 0.00 O ATOM 88222 H1 WAT 4636 45.325 137.750 18.012 1.00 0.00 H ATOM 88223 H2 WAT 4636 43.992 138.376 17.660 1.00 0.00 H TER 88225 WAT 4636 ATOM 88225 O WAT 4637 72.280 82.939 118.844 1.00 0.00 O ATOM 88226 H1 WAT 4637 71.830 82.298 119.394 1.00 0.00 H ATOM 88227 H2 WAT 4637 72.184 82.601 117.954 1.00 0.00 H TER 88229 WAT 4637 ATOM 88229 O WAT 4638 129.832 47.247 116.673 1.00 0.00 O ATOM 88230 H1 WAT 4638 129.617 46.995 117.571 1.00 0.00 H ATOM 88231 H2 WAT 4638 130.568 47.852 116.764 1.00 0.00 H TER 88233 WAT 4638 ATOM 88233 O WAT 4639 50.555 37.064 75.837 1.00 0.00 O ATOM 88234 H1 WAT 4639 50.352 36.212 76.224 1.00 0.00 H ATOM 88235 H2 WAT 4639 50.866 37.593 76.572 1.00 0.00 H TER 88237 WAT 4639 ATOM 88237 O WAT 4640 97.477 28.488 16.953 1.00 0.00 O ATOM 88238 H1 WAT 4640 97.439 28.421 17.907 1.00 0.00 H ATOM 88239 H2 WAT 4640 98.106 29.190 16.787 1.00 0.00 H TER 88241 WAT 4640 ATOM 88241 O WAT 4641 0.944 106.345 97.502 1.00 0.00 O ATOM 88242 H1 WAT 4641 1.470 107.058 97.865 1.00 0.00 H ATOM 88243 H2 WAT 4641 0.144 106.771 97.194 1.00 0.00 H TER 88245 WAT 4641 ATOM 88245 O WAT 4642 104.850 117.936 17.229 1.00 0.00 O ATOM 88246 H1 WAT 4642 105.150 118.714 17.700 1.00 0.00 H ATOM 88247 H2 WAT 4642 104.666 117.296 17.917 1.00 0.00 H TER 88249 WAT 4642 ATOM 88249 O WAT 4643 25.971 134.172 135.705 1.00 0.00 O ATOM 88250 H1 WAT 4643 26.118 133.381 136.224 1.00 0.00 H ATOM 88251 H2 WAT 4643 25.406 134.717 136.254 1.00 0.00 H TER 88253 WAT 4643 ATOM 88253 O WAT 4644 76.716 132.572 21.663 1.00 0.00 O ATOM 88254 H1 WAT 4644 77.373 133.207 21.379 1.00 0.00 H ATOM 88255 H2 WAT 4644 77.021 132.280 22.522 1.00 0.00 H TER 88257 WAT 4644 ATOM 88257 O WAT 4645 28.907 115.663 61.834 1.00 0.00 O ATOM 88258 H1 WAT 4645 29.428 114.878 61.998 1.00 0.00 H ATOM 88259 H2 WAT 4645 28.349 115.429 61.092 1.00 0.00 H TER 88261 WAT 4645 ATOM 88261 O WAT 4646 29.058 43.825 26.786 1.00 0.00 O ATOM 88262 H1 WAT 4646 29.126 42.910 27.058 1.00 0.00 H ATOM 88263 H2 WAT 4646 28.132 43.944 26.575 1.00 0.00 H TER 88265 WAT 4646 ATOM 88265 O WAT 4647 117.983 143.781 151.410 1.00 0.00 O ATOM 88266 H1 WAT 4647 118.236 144.683 151.607 1.00 0.00 H ATOM 88267 H2 WAT 4647 118.422 143.584 150.583 1.00 0.00 H TER 88269 WAT 4647 ATOM 88269 O WAT 4648 72.677 102.990 3.551 1.00 0.00 O ATOM 88270 H1 WAT 4648 73.349 103.045 2.871 1.00 0.00 H ATOM 88271 H2 WAT 4648 73.142 103.189 4.364 1.00 0.00 H TER 88273 WAT 4648 ATOM 88273 O WAT 4649 101.283 89.477 85.962 1.00 0.00 O ATOM 88274 H1 WAT 4649 101.280 89.155 86.863 1.00 0.00 H ATOM 88275 H2 WAT 4649 100.384 89.770 85.810 1.00 0.00 H TER 88277 WAT 4649 ATOM 88277 O WAT 4650 22.827 4.782 91.051 1.00 0.00 O ATOM 88278 H1 WAT 4650 22.714 3.833 91.003 1.00 0.00 H ATOM 88279 H2 WAT 4650 23.528 4.971 90.427 1.00 0.00 H TER 88281 WAT 4650 ATOM 88281 O WAT 4651 69.779 35.165 88.266 1.00 0.00 O ATOM 88282 H1 WAT 4651 68.876 34.848 88.282 1.00 0.00 H ATOM 88283 H2 WAT 4651 69.699 36.119 88.268 1.00 0.00 H TER 88285 WAT 4651 ATOM 88285 O WAT 4652 101.561 6.619 74.581 1.00 0.00 O ATOM 88286 H1 WAT 4652 102.453 6.838 74.849 1.00 0.00 H ATOM 88287 H2 WAT 4652 101.059 6.621 75.396 1.00 0.00 H TER 88289 WAT 4652 ATOM 88289 O WAT 4653 117.783 83.631 25.154 1.00 0.00 O ATOM 88290 H1 WAT 4653 118.419 83.981 25.777 1.00 0.00 H ATOM 88291 H2 WAT 4653 116.932 83.883 25.512 1.00 0.00 H TER 88293 WAT 4653 ATOM 88293 O WAT 4654 113.718 4.409 8.703 1.00 0.00 O ATOM 88294 H1 WAT 4654 113.921 3.571 8.286 1.00 0.00 H ATOM 88295 H2 WAT 4654 113.417 4.173 9.580 1.00 0.00 H TER 88297 WAT 4654 ATOM 88297 O WAT 4655 11.335 61.641 50.789 1.00 0.00 O ATOM 88298 H1 WAT 4655 10.674 62.322 50.911 1.00 0.00 H ATOM 88299 H2 WAT 4655 11.462 61.270 51.662 1.00 0.00 H TER 88301 WAT 4655 ATOM 88301 O WAT 4656 9.371 78.986 149.840 1.00 0.00 O ATOM 88302 H1 WAT 4656 10.102 79.265 150.391 1.00 0.00 H ATOM 88303 H2 WAT 4656 8.990 79.801 149.514 1.00 0.00 H TER 88305 WAT 4656 ATOM 88305 O WAT 4657 35.005 45.027 148.151 1.00 0.00 O ATOM 88306 H1 WAT 4657 35.054 44.193 147.685 1.00 0.00 H ATOM 88307 H2 WAT 4657 35.085 45.690 147.465 1.00 0.00 H TER 88309 WAT 4657 ATOM 88309 O WAT 4658 83.244 121.085 68.878 1.00 0.00 O ATOM 88310 H1 WAT 4658 83.615 120.870 68.023 1.00 0.00 H ATOM 88311 H2 WAT 4658 82.297 121.092 68.733 1.00 0.00 H TER 88313 WAT 4658 ATOM 88313 O WAT 4659 102.270 41.790 14.478 1.00 0.00 O ATOM 88314 H1 WAT 4659 102.306 41.755 15.434 1.00 0.00 H ATOM 88315 H2 WAT 4659 102.802 42.552 14.247 1.00 0.00 H TER 88317 WAT 4659 ATOM 88317 O WAT 4660 32.812 31.871 80.361 1.00 0.00 O ATOM 88318 H1 WAT 4660 32.910 32.415 81.142 1.00 0.00 H ATOM 88319 H2 WAT 4660 32.398 32.448 79.718 1.00 0.00 H TER 88321 WAT 4660 ATOM 88321 O WAT 4661 133.011 124.937 19.372 1.00 0.00 O ATOM 88322 H1 WAT 4661 132.399 124.207 19.469 1.00 0.00 H ATOM 88323 H2 WAT 4661 133.270 125.152 20.268 1.00 0.00 H TER 88325 WAT 4661 ATOM 88325 O WAT 4662 6.839 140.592 67.810 1.00 0.00 O ATOM 88326 H1 WAT 4662 6.318 139.950 67.329 1.00 0.00 H ATOM 88327 H2 WAT 4662 7.527 140.850 67.196 1.00 0.00 H TER 88329 WAT 4662 ATOM 88329 O WAT 4663 40.341 111.706 71.065 1.00 0.00 O ATOM 88330 H1 WAT 4663 40.248 111.154 71.842 1.00 0.00 H ATOM 88331 H2 WAT 4663 41.226 112.063 71.130 1.00 0.00 H TER 88333 WAT 4663 ATOM 88333 O WAT 4664 89.482 128.385 153.245 1.00 0.00 O ATOM 88334 H1 WAT 4664 89.486 129.279 153.589 1.00 0.00 H ATOM 88335 H2 WAT 4664 88.829 127.928 153.776 1.00 0.00 H TER 88337 WAT 4664 ATOM 88337 O WAT 4665 137.183 35.900 124.186 1.00 0.00 O ATOM 88338 H1 WAT 4665 137.537 35.633 123.337 1.00 0.00 H ATOM 88339 H2 WAT 4665 137.785 35.520 124.826 1.00 0.00 H TER 88341 WAT 4665 ATOM 88341 O WAT 4666 105.603 94.717 57.922 1.00 0.00 O ATOM 88342 H1 WAT 4666 105.507 95.557 58.370 1.00 0.00 H ATOM 88343 H2 WAT 4666 106.327 94.852 57.311 1.00 0.00 H TER 88345 WAT 4666 ATOM 88345 O WAT 4667 142.969 98.895 153.551 1.00 0.00 O ATOM 88346 H1 WAT 4667 143.226 99.791 153.766 1.00 0.00 H ATOM 88347 H2 WAT 4667 143.109 98.404 154.361 1.00 0.00 H TER 88349 WAT 4667 ATOM 88349 O WAT 4668 105.202 10.072 10.333 1.00 0.00 O ATOM 88350 H1 WAT 4668 104.614 9.334 10.172 1.00 0.00 H ATOM 88351 H2 WAT 4668 104.942 10.401 11.194 1.00 0.00 H TER 88353 WAT 4668 ATOM 88353 O WAT 4669 71.210 124.442 59.370 1.00 0.00 O ATOM 88354 H1 WAT 4669 71.514 123.682 58.874 1.00 0.00 H ATOM 88355 H2 WAT 4669 70.638 124.912 58.763 1.00 0.00 H TER 88357 WAT 4669 ATOM 88357 O WAT 4670 27.362 60.350 62.256 1.00 0.00 O ATOM 88358 H1 WAT 4670 28.060 60.928 62.563 1.00 0.00 H ATOM 88359 H2 WAT 4670 26.982 60.810 61.508 1.00 0.00 H TER 88361 WAT 4670 ATOM 88361 O WAT 4671 15.123 18.635 74.088 1.00 0.00 O ATOM 88362 H1 WAT 4671 14.803 17.854 73.635 1.00 0.00 H ATOM 88363 H2 WAT 4671 14.726 19.366 73.615 1.00 0.00 H TER 88365 WAT 4671 ATOM 88365 O WAT 4672 74.246 107.978 54.737 1.00 0.00 O ATOM 88366 H1 WAT 4672 73.338 107.682 54.798 1.00 0.00 H ATOM 88367 H2 WAT 4672 74.188 108.850 54.345 1.00 0.00 H TER 88369 WAT 4672 ATOM 88369 O WAT 4673 13.955 50.096 16.625 1.00 0.00 O ATOM 88370 H1 WAT 4673 14.239 50.787 16.027 1.00 0.00 H ATOM 88371 H2 WAT 4673 13.230 50.486 17.114 1.00 0.00 H TER 88373 WAT 4673 ATOM 88373 O WAT 4674 125.584 33.475 82.883 1.00 0.00 O ATOM 88374 H1 WAT 4674 125.237 33.888 83.674 1.00 0.00 H ATOM 88375 H2 WAT 4674 126.102 34.161 82.462 1.00 0.00 H TER 88377 WAT 4674 ATOM 88377 O WAT 4675 126.846 107.341 78.695 1.00 0.00 O ATOM 88378 H1 WAT 4675 127.384 106.871 79.332 1.00 0.00 H ATOM 88379 H2 WAT 4675 125.960 107.300 79.054 1.00 0.00 H TER 88381 WAT 4675 ATOM 88381 O WAT 4676 98.123 101.454 72.154 1.00 0.00 O ATOM 88382 H1 WAT 4676 97.819 102.265 72.561 1.00 0.00 H ATOM 88383 H2 WAT 4676 98.157 100.823 72.874 1.00 0.00 H TER 88385 WAT 4676 ATOM 88385 O WAT 4677 146.050 67.628 111.034 1.00 0.00 O ATOM 88386 H1 WAT 4677 145.387 67.403 111.687 1.00 0.00 H ATOM 88387 H2 WAT 4677 145.567 67.670 110.208 1.00 0.00 H TER 88389 WAT 4677 ATOM 88389 O WAT 4678 10.077 105.904 98.304 1.00 0.00 O ATOM 88390 H1 WAT 4678 9.913 106.321 99.150 1.00 0.00 H ATOM 88391 H2 WAT 4678 9.921 106.596 97.661 1.00 0.00 H TER 88393 WAT 4678 ATOM 88393 O WAT 4679 86.667 111.019 116.229 1.00 0.00 O ATOM 88394 H1 WAT 4679 85.907 111.593 116.323 1.00 0.00 H ATOM 88395 H2 WAT 4679 87.415 111.572 116.457 1.00 0.00 H TER 88397 WAT 4679 ATOM 88397 O WAT 4680 110.015 63.853 102.029 1.00 0.00 O ATOM 88398 H1 WAT 4680 110.453 64.342 101.332 1.00 0.00 H ATOM 88399 H2 WAT 4680 109.490 63.198 101.569 1.00 0.00 H TER 88401 WAT 4680 ATOM 88401 O WAT 4681 111.759 27.049 95.222 1.00 0.00 O ATOM 88402 H1 WAT 4681 110.925 26.820 95.631 1.00 0.00 H ATOM 88403 H2 WAT 4681 111.977 26.291 94.680 1.00 0.00 H TER 88405 WAT 4681 ATOM 88405 O WAT 4682 61.667 21.098 55.324 1.00 0.00 O ATOM 88406 H1 WAT 4682 62.124 20.972 54.492 1.00 0.00 H ATOM 88407 H2 WAT 4682 62.112 21.842 55.730 1.00 0.00 H TER 88409 WAT 4682 ATOM 88409 O WAT 4683 78.304 8.671 141.646 1.00 0.00 O ATOM 88410 H1 WAT 4683 78.407 9.197 140.853 1.00 0.00 H ATOM 88411 H2 WAT 4683 77.804 9.229 142.241 1.00 0.00 H TER 88413 WAT 4683 ATOM 88413 O WAT 4684 24.946 127.547 123.363 1.00 0.00 O ATOM 88414 H1 WAT 4684 25.140 128.075 124.137 1.00 0.00 H ATOM 88415 H2 WAT 4684 25.801 127.239 123.062 1.00 0.00 H TER 88417 WAT 4684 ATOM 88417 O WAT 4685 89.815 43.461 117.799 1.00 0.00 O ATOM 88418 H1 WAT 4685 89.214 44.204 117.751 1.00 0.00 H ATOM 88419 H2 WAT 4685 90.646 43.843 118.080 1.00 0.00 H TER 88421 WAT 4685 ATOM 88421 O WAT 4686 89.197 41.268 11.543 1.00 0.00 O ATOM 88422 H1 WAT 4686 89.104 41.355 12.492 1.00 0.00 H ATOM 88423 H2 WAT 4686 88.622 40.538 11.313 1.00 0.00 H TER 88425 WAT 4686 ATOM 88425 O WAT 4687 53.716 13.573 75.466 1.00 0.00 O ATOM 88426 H1 WAT 4687 52.940 14.058 75.746 1.00 0.00 H ATOM 88427 H2 WAT 4687 53.879 12.951 76.176 1.00 0.00 H TER 88429 WAT 4687 ATOM 88429 O WAT 4688 12.432 44.248 9.167 1.00 0.00 O ATOM 88430 H1 WAT 4688 12.813 43.375 9.064 1.00 0.00 H ATOM 88431 H2 WAT 4688 12.181 44.505 8.280 1.00 0.00 H TER 88433 WAT 4688 ATOM 88433 O WAT 4689 120.362 60.307 131.829 1.00 0.00 O ATOM 88434 H1 WAT 4689 120.419 59.356 131.923 1.00 0.00 H ATOM 88435 H2 WAT 4689 121.270 60.594 131.735 1.00 0.00 H TER 88437 WAT 4689 ATOM 88437 O WAT 4690 57.000 60.027 156.408 1.00 0.00 O ATOM 88438 H1 WAT 4690 57.511 60.730 156.809 1.00 0.00 H ATOM 88439 H2 WAT 4690 56.317 59.831 157.050 1.00 0.00 H TER 88441 WAT 4690 ATOM 88441 O WAT 4691 46.948 82.409 21.535 1.00 0.00 O ATOM 88442 H1 WAT 4691 46.295 82.275 22.222 1.00 0.00 H ATOM 88443 H2 WAT 4691 46.900 81.615 21.002 1.00 0.00 H TER 88445 WAT 4691 ATOM 88445 O WAT 4692 51.051 90.773 5.061 1.00 0.00 O ATOM 88446 H1 WAT 4692 50.308 91.025 4.512 1.00 0.00 H ATOM 88447 H2 WAT 4692 50.653 90.347 5.821 1.00 0.00 H TER 88449 WAT 4692 ATOM 88449 O WAT 4693 6.419 72.212 122.772 1.00 0.00 O ATOM 88450 H1 WAT 4693 5.555 72.279 122.366 1.00 0.00 H ATOM 88451 H2 WAT 4693 6.909 72.953 122.416 1.00 0.00 H TER 88453 WAT 4693 ATOM 88453 O WAT 4694 119.427 119.222 4.405 1.00 0.00 O ATOM 88454 H1 WAT 4694 119.982 118.577 3.966 1.00 0.00 H ATOM 88455 H2 WAT 4694 119.027 119.719 3.692 1.00 0.00 H TER 88457 WAT 4694 ATOM 88457 O WAT 4695 104.031 40.624 68.792 1.00 0.00 O ATOM 88458 H1 WAT 4695 104.064 39.728 68.458 1.00 0.00 H ATOM 88459 H2 WAT 4695 103.100 40.847 68.787 1.00 0.00 H TER 88461 WAT 4695 ATOM 88461 O WAT 4696 49.454 64.270 83.700 1.00 0.00 O ATOM 88462 H1 WAT 4696 49.980 63.897 84.407 1.00 0.00 H ATOM 88463 H2 WAT 4696 49.232 65.150 84.004 1.00 0.00 H TER 88465 WAT 4696 ATOM 88465 O WAT 4697 46.722 32.282 62.080 1.00 0.00 O ATOM 88466 H1 WAT 4697 47.061 33.177 62.113 1.00 0.00 H ATOM 88467 H2 WAT 4697 46.838 31.949 62.970 1.00 0.00 H TER 88469 WAT 4697 ATOM 88469 O WAT 4698 61.373 9.488 124.516 1.00 0.00 O ATOM 88470 H1 WAT 4698 62.088 8.900 124.272 1.00 0.00 H ATOM 88471 H2 WAT 4698 60.611 9.145 124.051 1.00 0.00 H TER 88473 WAT 4698 ATOM 88473 O WAT 4699 108.760 91.063 86.197 1.00 0.00 O ATOM 88474 H1 WAT 4699 109.077 90.405 85.578 1.00 0.00 H ATOM 88475 H2 WAT 4699 108.408 90.554 86.927 1.00 0.00 H TER 88477 WAT 4699 ATOM 88477 O WAT 4700 39.638 134.918 63.478 1.00 0.00 O ATOM 88478 H1 WAT 4700 40.263 134.911 62.752 1.00 0.00 H ATOM 88479 H2 WAT 4700 39.863 135.701 63.980 1.00 0.00 H TER 88481 WAT 4700 ATOM 88481 O WAT 4701 121.330 126.336 82.491 1.00 0.00 O ATOM 88482 H1 WAT 4701 122.188 125.935 82.350 1.00 0.00 H ATOM 88483 H2 WAT 4701 121.000 125.921 83.287 1.00 0.00 H TER 88485 WAT 4701 ATOM 88485 O WAT 4702 22.506 130.475 99.951 1.00 0.00 O ATOM 88486 H1 WAT 4702 22.529 131.419 100.108 1.00 0.00 H ATOM 88487 H2 WAT 4702 22.520 130.087 100.826 1.00 0.00 H TER 88489 WAT 4702 ATOM 88489 O WAT 4703 84.147 11.598 16.237 1.00 0.00 O ATOM 88490 H1 WAT 4703 84.954 11.125 16.033 1.00 0.00 H ATOM 88491 H2 WAT 4703 83.486 10.913 16.332 1.00 0.00 H TER 88493 WAT 4703 ATOM 88493 O WAT 4704 59.911 24.836 100.494 1.00 0.00 O ATOM 88494 H1 WAT 4704 59.334 25.408 99.989 1.00 0.00 H ATOM 88495 H2 WAT 4704 60.417 24.362 99.833 1.00 0.00 H TER 88497 WAT 4704 ATOM 88497 O WAT 4705 23.423 90.067 61.320 1.00 0.00 O ATOM 88498 H1 WAT 4705 24.008 89.503 60.814 1.00 0.00 H ATOM 88499 H2 WAT 4705 23.699 90.957 61.102 1.00 0.00 H TER 88501 WAT 4705 ATOM 88501 O WAT 4706 140.100 111.287 135.282 1.00 0.00 O ATOM 88502 H1 WAT 4706 140.930 111.086 135.715 1.00 0.00 H ATOM 88503 H2 WAT 4706 139.995 112.232 135.393 1.00 0.00 H TER 88505 WAT 4706 ATOM 88505 O WAT 4707 30.392 106.898 147.800 1.00 0.00 O ATOM 88506 H1 WAT 4707 30.940 107.573 148.198 1.00 0.00 H ATOM 88507 H2 WAT 4707 29.575 107.348 147.586 1.00 0.00 H TER 88509 WAT 4707 ATOM 88509 O WAT 4708 83.649 3.437 11.324 1.00 0.00 O ATOM 88510 H1 WAT 4708 83.965 4.047 11.990 1.00 0.00 H ATOM 88511 H2 WAT 4708 83.103 3.973 10.748 1.00 0.00 H TER 88513 WAT 4708 ATOM 88513 O WAT 4709 104.832 115.145 64.337 1.00 0.00 O ATOM 88514 H1 WAT 4709 105.165 114.316 64.678 1.00 0.00 H ATOM 88515 H2 WAT 4709 103.903 114.981 64.174 1.00 0.00 H TER 88517 WAT 4709 ATOM 88517 O WAT 4710 83.704 118.626 142.029 1.00 0.00 O ATOM 88518 H1 WAT 4710 84.625 118.363 142.024 1.00 0.00 H ATOM 88519 H2 WAT 4710 83.366 118.328 141.184 1.00 0.00 H TER 88521 WAT 4710 ATOM 88521 O WAT 4711 113.287 76.176 156.803 1.00 0.00 O ATOM 88522 H1 WAT 4711 112.782 76.828 157.289 1.00 0.00 H ATOM 88523 H2 WAT 4711 112.712 75.913 156.085 1.00 0.00 H TER 88525 WAT 4711 ATOM 88525 O WAT 4712 60.018 142.001 76.135 1.00 0.00 O ATOM 88526 H1 WAT 4712 60.955 141.811 76.188 1.00 0.00 H ATOM 88527 H2 WAT 4712 59.901 142.391 75.268 1.00 0.00 H TER 88529 WAT 4712 ATOM 88529 O WAT 4713 108.321 106.543 142.875 1.00 0.00 O ATOM 88530 H1 WAT 4713 108.751 107.337 142.558 1.00 0.00 H ATOM 88531 H2 WAT 4713 108.152 106.031 142.085 1.00 0.00 H TER 88533 WAT 4713 ATOM 88533 O WAT 4714 38.264 53.448 150.722 1.00 0.00 O ATOM 88534 H1 WAT 4714 38.020 52.523 150.764 1.00 0.00 H ATOM 88535 H2 WAT 4714 39.169 53.442 150.410 1.00 0.00 H TER 88537 WAT 4714 ATOM 88537 O WAT 4715 61.375 40.019 93.779 1.00 0.00 O ATOM 88538 H1 WAT 4715 61.477 39.131 94.122 1.00 0.00 H ATOM 88539 H2 WAT 4715 60.935 40.498 94.481 1.00 0.00 H TER 88541 WAT 4715 ATOM 88541 O WAT 4716 57.877 16.396 93.019 1.00 0.00 O ATOM 88542 H1 WAT 4716 58.816 16.243 92.914 1.00 0.00 H ATOM 88543 H2 WAT 4716 57.472 15.556 92.803 1.00 0.00 H TER 88545 WAT 4716 ATOM 88545 O WAT 4717 6.747 12.414 9.362 1.00 0.00 O ATOM 88546 H1 WAT 4717 7.287 12.297 8.580 1.00 0.00 H ATOM 88547 H2 WAT 4717 7.227 11.961 10.055 1.00 0.00 H TER 88549 WAT 4717 ATOM 88549 O WAT 4718 49.155 107.489 63.534 1.00 0.00 O ATOM 88550 H1 WAT 4718 49.676 106.980 62.913 1.00 0.00 H ATOM 88551 H2 WAT 4718 49.080 108.354 63.132 1.00 0.00 H TER 88553 WAT 4718 ATOM 88553 O WAT 4719 126.046 70.677 111.166 1.00 0.00 O ATOM 88554 H1 WAT 4719 125.971 69.856 110.678 1.00 0.00 H ATOM 88555 H2 WAT 4719 125.844 71.357 110.523 1.00 0.00 H TER 88557 WAT 4719 ATOM 88557 O WAT 4720 57.095 52.098 139.963 1.00 0.00 O ATOM 88558 H1 WAT 4720 57.776 52.771 139.984 1.00 0.00 H ATOM 88559 H2 WAT 4720 57.337 51.537 139.226 1.00 0.00 H TER 88561 WAT 4720 ATOM 88561 O WAT 4721 113.890 122.652 62.840 1.00 0.00 O ATOM 88562 H1 WAT 4721 113.780 122.235 63.695 1.00 0.00 H ATOM 88563 H2 WAT 4721 113.930 123.589 63.034 1.00 0.00 H TER 88565 WAT 4721 ATOM 88565 O WAT 4722 108.424 96.583 106.418 1.00 0.00 O ATOM 88566 H1 WAT 4722 108.519 96.002 107.173 1.00 0.00 H ATOM 88567 H2 WAT 4722 109.226 96.452 105.912 1.00 0.00 H TER 88569 WAT 4722 ATOM 88569 O WAT 4723 84.365 72.673 13.581 1.00 0.00 O ATOM 88570 H1 WAT 4723 85.063 73.142 14.038 1.00 0.00 H ATOM 88571 H2 WAT 4723 84.582 71.748 13.697 1.00 0.00 H TER 88573 WAT 4723 ATOM 88573 O WAT 4724 13.597 64.234 129.202 1.00 0.00 O ATOM 88574 H1 WAT 4724 14.167 64.894 128.808 1.00 0.00 H ATOM 88575 H2 WAT 4724 13.193 63.791 128.456 1.00 0.00 H TER 88577 WAT 4724 ATOM 88577 O WAT 4725 14.337 30.759 99.987 1.00 0.00 O ATOM 88578 H1 WAT 4725 15.226 30.514 99.728 1.00 0.00 H ATOM 88579 H2 WAT 4725 14.333 30.673 100.940 1.00 0.00 H TER 88581 WAT 4725 ATOM 88581 O WAT 4726 73.251 121.023 59.094 1.00 0.00 O ATOM 88582 H1 WAT 4726 73.895 120.521 59.593 1.00 0.00 H ATOM 88583 H2 WAT 4726 73.498 121.937 59.235 1.00 0.00 H TER 88585 WAT 4726 ATOM 88585 O WAT 4727 94.162 126.190 144.081 1.00 0.00 O ATOM 88586 H1 WAT 4727 94.158 127.002 144.588 1.00 0.00 H ATOM 88587 H2 WAT 4727 95.090 126.002 143.938 1.00 0.00 H TER 88589 WAT 4727 ATOM 88589 O WAT 4728 84.513 26.572 53.555 1.00 0.00 O ATOM 88590 H1 WAT 4728 84.000 27.303 53.211 1.00 0.00 H ATOM 88591 H2 WAT 4728 84.137 25.797 53.137 1.00 0.00 H TER 88593 WAT 4728 ATOM 88593 O WAT 4729 144.107 4.766 96.888 1.00 0.00 O ATOM 88594 H1 WAT 4729 143.962 4.254 97.684 1.00 0.00 H ATOM 88595 H2 WAT 4729 145.047 4.690 96.723 1.00 0.00 H TER 88597 WAT 4729 ATOM 88597 O WAT 4730 129.549 93.013 83.672 1.00 0.00 O ATOM 88598 H1 WAT 4730 129.516 93.959 83.814 1.00 0.00 H ATOM 88599 H2 WAT 4730 129.977 92.913 82.822 1.00 0.00 H TER 88601 WAT 4730 ATOM 88601 O WAT 4731 142.371 36.873 113.821 1.00 0.00 O ATOM 88602 H1 WAT 4731 142.215 36.037 114.261 1.00 0.00 H ATOM 88603 H2 WAT 4731 142.391 37.516 114.530 1.00 0.00 H TER 88605 WAT 4731 ATOM 88605 O WAT 4732 79.076 124.456 22.316 1.00 0.00 O ATOM 88606 H1 WAT 4732 78.541 125.249 22.322 1.00 0.00 H ATOM 88607 H2 WAT 4732 78.518 123.787 22.714 1.00 0.00 H TER 88609 WAT 4732 ATOM 88609 O WAT 4733 106.022 74.575 125.301 1.00 0.00 O ATOM 88610 H1 WAT 4733 106.296 74.387 124.403 1.00 0.00 H ATOM 88611 H2 WAT 4733 106.842 74.667 125.786 1.00 0.00 H TER 88613 WAT 4733 ATOM 88613 O WAT 4734 105.935 112.379 62.377 1.00 0.00 O ATOM 88614 H1 WAT 4734 106.424 111.802 62.965 1.00 0.00 H ATOM 88615 H2 WAT 4734 106.521 113.121 62.228 1.00 0.00 H TER 88617 WAT 4734 ATOM 88617 O WAT 4735 127.031 62.786 141.528 1.00 0.00 O ATOM 88618 H1 WAT 4735 127.637 62.509 140.841 1.00 0.00 H ATOM 88619 H2 WAT 4735 126.799 61.977 141.983 1.00 0.00 H TER 88621 WAT 4735 ATOM 88621 O WAT 4736 20.263 121.552 23.763 1.00 0.00 O ATOM 88622 H1 WAT 4736 21.048 122.059 23.971 1.00 0.00 H ATOM 88623 H2 WAT 4736 20.552 120.640 23.795 1.00 0.00 H TER 88625 WAT 4736 ATOM 88625 O WAT 4737 5.207 103.020 134.524 1.00 0.00 O ATOM 88626 H1 WAT 4737 4.757 103.862 134.454 1.00 0.00 H ATOM 88627 H2 WAT 4737 4.900 102.521 133.768 1.00 0.00 H TER 88629 WAT 4737 ATOM 88629 O WAT 4738 0.939 89.550 147.820 1.00 0.00 O ATOM 88630 H1 WAT 4738 0.129 89.118 147.546 1.00 0.00 H ATOM 88631 H2 WAT 4738 1.150 90.142 147.098 1.00 0.00 H TER 88633 WAT 4738 ATOM 88633 O WAT 4739 69.071 59.772 101.618 1.00 0.00 O ATOM 88634 H1 WAT 4739 68.954 60.150 100.746 1.00 0.00 H ATOM 88635 H2 WAT 4739 68.255 59.973 102.077 1.00 0.00 H TER 88637 WAT 4739 ATOM 88637 O WAT 4740 11.890 82.806 114.160 1.00 0.00 O ATOM 88638 H1 WAT 4740 12.193 83.389 114.856 1.00 0.00 H ATOM 88639 H2 WAT 4740 11.220 82.264 114.576 1.00 0.00 H TER 88641 WAT 4740 ATOM 88641 O WAT 4741 19.636 35.765 10.450 1.00 0.00 O ATOM 88642 H1 WAT 4741 20.267 36.405 10.780 1.00 0.00 H ATOM 88643 H2 WAT 4741 20.154 34.974 10.299 1.00 0.00 H TER 88645 WAT 4741 ATOM 88645 O WAT 4742 57.196 73.615 91.800 1.00 0.00 O ATOM 88646 H1 WAT 4742 57.816 73.684 92.526 1.00 0.00 H ATOM 88647 H2 WAT 4742 57.062 72.673 91.688 1.00 0.00 H TER 88649 WAT 4742 ATOM 88649 O WAT 4743 41.159 122.983 112.695 1.00 0.00 O ATOM 88650 H1 WAT 4743 42.097 122.973 112.504 1.00 0.00 H ATOM 88651 H2 WAT 4743 41.057 122.373 113.425 1.00 0.00 H TER 88653 WAT 4743 ATOM 88653 O WAT 4744 16.943 69.844 116.165 1.00 0.00 O ATOM 88654 H1 WAT 4744 16.080 70.108 115.846 1.00 0.00 H ATOM 88655 H2 WAT 4744 16.884 68.892 116.252 1.00 0.00 H TER 88657 WAT 4744 ATOM 88657 O WAT 4745 12.020 108.637 98.501 1.00 0.00 O ATOM 88658 H1 WAT 4745 11.239 108.488 99.034 1.00 0.00 H ATOM 88659 H2 WAT 4745 12.448 107.782 98.458 1.00 0.00 H TER 88661 WAT 4745 ATOM 88661 O WAT 4746 95.350 5.647 93.341 1.00 0.00 O ATOM 88662 H1 WAT 4746 96.123 5.092 93.446 1.00 0.00 H ATOM 88663 H2 WAT 4746 95.559 6.442 93.832 1.00 0.00 H TER 88665 WAT 4746 ATOM 88665 O WAT 4747 10.092 63.019 87.855 1.00 0.00 O ATOM 88666 H1 WAT 4747 10.243 63.947 87.675 1.00 0.00 H ATOM 88667 H2 WAT 4747 10.917 62.593 87.622 1.00 0.00 H TER 88669 WAT 4747 ATOM 88669 O WAT 4748 75.324 131.311 8.753 1.00 0.00 O ATOM 88670 H1 WAT 4748 75.711 132.095 9.143 1.00 0.00 H ATOM 88671 H2 WAT 4748 76.000 130.640 8.843 1.00 0.00 H TER 88673 WAT 4748 ATOM 88673 O WAT 4749 72.077 56.149 133.243 1.00 0.00 O ATOM 88674 H1 WAT 4749 72.974 55.889 133.035 1.00 0.00 H ATOM 88675 H2 WAT 4749 71.571 55.906 132.467 1.00 0.00 H TER 88677 WAT 4749 ATOM 88677 O WAT 4750 116.050 70.620 73.060 1.00 0.00 O ATOM 88678 H1 WAT 4750 116.538 70.756 73.872 1.00 0.00 H ATOM 88679 H2 WAT 4750 115.564 71.434 72.933 1.00 0.00 H TER 88681 WAT 4750 ATOM 88681 O WAT 4751 62.666 92.811 91.806 1.00 0.00 O ATOM 88682 H1 WAT 4751 62.931 91.899 91.923 1.00 0.00 H ATOM 88683 H2 WAT 4751 63.200 93.123 91.075 1.00 0.00 H TER 88685 WAT 4751 ATOM 88685 O WAT 4752 120.013 64.271 6.030 1.00 0.00 O ATOM 88686 H1 WAT 4752 119.105 64.228 5.731 1.00 0.00 H ATOM 88687 H2 WAT 4752 120.009 64.942 6.712 1.00 0.00 H TER 88689 WAT 4752 ATOM 88689 O WAT 4753 24.673 136.395 149.766 1.00 0.00 O ATOM 88690 H1 WAT 4753 24.282 135.528 149.655 1.00 0.00 H ATOM 88691 H2 WAT 4753 25.475 136.364 149.244 1.00 0.00 H TER 88693 WAT 4753 ATOM 88693 O WAT 4754 0.523 95.192 107.374 1.00 0.00 O ATOM 88694 H1 WAT 4754 0.966 95.195 108.222 1.00 0.00 H ATOM 88695 H2 WAT 4754 -0.394 95.016 107.583 1.00 0.00 H TER 88697 WAT 4754 ATOM 88697 O WAT 4755 14.731 67.964 0.112 1.00 0.00 O ATOM 88698 H1 WAT 4755 14.396 67.183 -0.329 1.00 0.00 H ATOM 88699 H2 WAT 4755 15.639 67.747 0.324 1.00 0.00 H TER 88701 WAT 4755 ATOM 88701 O WAT 4756 83.925 117.199 113.314 1.00 0.00 O ATOM 88702 H1 WAT 4756 83.665 117.691 114.093 1.00 0.00 H ATOM 88703 H2 WAT 4756 84.455 117.815 112.808 1.00 0.00 H TER 88705 WAT 4756 ATOM 88705 O WAT 4757 113.705 115.706 151.683 1.00 0.00 O ATOM 88706 H1 WAT 4757 112.798 115.979 151.824 1.00 0.00 H ATOM 88707 H2 WAT 4757 113.720 114.784 151.938 1.00 0.00 H TER 88709 WAT 4757 ATOM 88709 O WAT 4758 94.879 10.304 14.574 1.00 0.00 O ATOM 88710 H1 WAT 4758 94.080 10.761 14.311 1.00 0.00 H ATOM 88711 H2 WAT 4758 94.595 9.703 15.263 1.00 0.00 H TER 88713 WAT 4758 ATOM 88713 O WAT 4759 77.019 109.150 154.254 1.00 0.00 O ATOM 88714 H1 WAT 4759 76.469 108.560 153.740 1.00 0.00 H ATOM 88715 H2 WAT 4759 77.908 108.814 154.135 1.00 0.00 H TER 88717 WAT 4759 ATOM 88717 O WAT 4760 123.488 118.204 87.198 1.00 0.00 O ATOM 88718 H1 WAT 4760 122.996 118.649 86.508 1.00 0.00 H ATOM 88719 H2 WAT 4760 122.928 117.473 87.458 1.00 0.00 H TER 88721 WAT 4760 ATOM 88721 O WAT 4761 117.732 48.352 85.074 1.00 0.00 O ATOM 88722 H1 WAT 4761 117.155 47.684 84.704 1.00 0.00 H ATOM 88723 H2 WAT 4761 117.608 49.115 84.510 1.00 0.00 H TER 88725 WAT 4761 ATOM 88725 O WAT 4762 105.120 58.501 75.690 1.00 0.00 O ATOM 88726 H1 WAT 4762 105.297 58.170 76.571 1.00 0.00 H ATOM 88727 H2 WAT 4762 105.517 57.853 75.107 1.00 0.00 H TER 88729 WAT 4762 ATOM 88729 O WAT 4763 113.666 108.896 22.498 1.00 0.00 O ATOM 88730 H1 WAT 4763 113.650 109.627 21.880 1.00 0.00 H ATOM 88731 H2 WAT 4763 112.958 109.086 23.113 1.00 0.00 H TER 88733 WAT 4763 ATOM 88733 O WAT 4764 141.224 117.048 150.522 1.00 0.00 O ATOM 88734 H1 WAT 4764 141.122 117.375 151.416 1.00 0.00 H ATOM 88735 H2 WAT 4764 140.610 117.570 150.006 1.00 0.00 H TER 88737 WAT 4764 ATOM 88737 O WAT 4765 128.982 102.647 136.101 1.00 0.00 O ATOM 88738 H1 WAT 4765 128.463 103.072 135.418 1.00 0.00 H ATOM 88739 H2 WAT 4765 128.482 101.862 136.327 1.00 0.00 H TER 88741 WAT 4765 ATOM 88741 O WAT 4766 50.681 66.914 105.979 1.00 0.00 O ATOM 88742 H1 WAT 4766 51.505 66.493 105.733 1.00 0.00 H ATOM 88743 H2 WAT 4766 50.031 66.529 105.391 1.00 0.00 H TER 88745 WAT 4766 ATOM 88745 O WAT 4767 115.514 14.789 100.029 1.00 0.00 O ATOM 88746 H1 WAT 4767 114.756 14.231 100.203 1.00 0.00 H ATOM 88747 H2 WAT 4767 115.660 14.709 99.086 1.00 0.00 H TER 88749 WAT 4767 ATOM 88749 O WAT 4768 100.923 121.684 130.315 1.00 0.00 O ATOM 88750 H1 WAT 4768 100.506 121.504 131.158 1.00 0.00 H ATOM 88751 H2 WAT 4768 101.589 121.003 130.227 1.00 0.00 H TER 88753 WAT 4768 ATOM 88753 O WAT 4769 61.605 114.786 10.851 1.00 0.00 O ATOM 88754 H1 WAT 4769 61.329 114.948 11.753 1.00 0.00 H ATOM 88755 H2 WAT 4769 61.901 115.639 10.535 1.00 0.00 H TER 88757 WAT 4769 ATOM 88757 O WAT 4770 85.404 134.047 112.615 1.00 0.00 O ATOM 88758 H1 WAT 4770 84.829 133.741 113.316 1.00 0.00 H ATOM 88759 H2 WAT 4770 85.406 133.334 111.977 1.00 0.00 H TER 88761 WAT 4770 ATOM 88761 O WAT 4771 115.351 79.762 11.501 1.00 0.00 O ATOM 88762 H1 WAT 4771 114.484 79.367 11.592 1.00 0.00 H ATOM 88763 H2 WAT 4771 115.747 79.303 10.760 1.00 0.00 H TER 88765 WAT 4771 ATOM 88765 O WAT 4772 98.939 65.371 17.385 1.00 0.00 O ATOM 88766 H1 WAT 4772 98.320 65.997 17.009 1.00 0.00 H ATOM 88767 H2 WAT 4772 99.145 65.728 18.249 1.00 0.00 H TER 88769 WAT 4772 ATOM 88769 O WAT 4773 66.725 91.063 64.484 1.00 0.00 O ATOM 88770 H1 WAT 4773 66.104 90.386 64.754 1.00 0.00 H ATOM 88771 H2 WAT 4773 66.290 91.888 64.700 1.00 0.00 H TER 88773 WAT 4773 ATOM 88773 O WAT 4774 47.222 79.115 141.135 1.00 0.00 O ATOM 88774 H1 WAT 4774 48.134 79.249 141.394 1.00 0.00 H ATOM 88775 H2 WAT 4774 46.735 79.129 141.959 1.00 0.00 H TER 88777 WAT 4774 ATOM 88777 O WAT 4775 70.037 65.299 98.327 1.00 0.00 O ATOM 88778 H1 WAT 4775 70.959 65.539 98.414 1.00 0.00 H ATOM 88779 H2 WAT 4775 69.999 64.781 97.523 1.00 0.00 H TER 88781 WAT 4775 ATOM 88781 O WAT 4776 5.080 89.034 111.825 1.00 0.00 O ATOM 88782 H1 WAT 4776 5.861 88.538 111.579 1.00 0.00 H ATOM 88783 H2 WAT 4776 5.420 89.844 112.203 1.00 0.00 H TER 88785 WAT 4776 ATOM 88785 O WAT 4777 42.409 99.264 19.475 1.00 0.00 O ATOM 88786 H1 WAT 4777 42.185 100.051 18.979 1.00 0.00 H ATOM 88787 H2 WAT 4777 42.572 99.580 20.364 1.00 0.00 H TER 88789 WAT 4777 ATOM 88789 O WAT 4778 57.322 59.379 62.688 1.00 0.00 O ATOM 88790 H1 WAT 4778 57.620 58.618 62.191 1.00 0.00 H ATOM 88791 H2 WAT 4778 57.138 60.042 62.023 1.00 0.00 H TER 88793 WAT 4778 ATOM 88793 O WAT 4779 90.815 65.726 94.529 1.00 0.00 O ATOM 88794 H1 WAT 4779 89.878 65.548 94.604 1.00 0.00 H ATOM 88795 H2 WAT 4779 90.864 66.563 94.067 1.00 0.00 H TER 88797 WAT 4779 ATOM 88797 O WAT 4780 107.908 22.141 18.284 1.00 0.00 O ATOM 88798 H1 WAT 4780 107.609 21.490 18.919 1.00 0.00 H ATOM 88799 H2 WAT 4780 108.402 22.774 18.805 1.00 0.00 H TER 88801 WAT 4780 ATOM 88801 O WAT 4781 135.239 55.048 66.973 1.00 0.00 O ATOM 88802 H1 WAT 4781 135.439 55.067 66.037 1.00 0.00 H ATOM 88803 H2 WAT 4781 135.136 55.969 67.215 1.00 0.00 H TER 88805 WAT 4781 ATOM 88805 O WAT 4782 88.929 125.951 135.771 1.00 0.00 O ATOM 88806 H1 WAT 4782 89.101 126.162 134.854 1.00 0.00 H ATOM 88807 H2 WAT 4782 89.250 125.055 135.875 1.00 0.00 H TER 88809 WAT 4782 ATOM 88809 O WAT 4783 64.520 36.225 152.712 1.00 0.00 O ATOM 88810 H1 WAT 4783 64.410 36.901 152.043 1.00 0.00 H ATOM 88811 H2 WAT 4783 65.440 36.288 152.967 1.00 0.00 H TER 88813 WAT 4783 ATOM 88813 O WAT 4784 110.174 47.212 61.687 1.00 0.00 O ATOM 88814 H1 WAT 4784 109.372 46.970 61.222 1.00 0.00 H ATOM 88815 H2 WAT 4784 110.862 47.154 61.024 1.00 0.00 H TER 88817 WAT 4784 ATOM 88817 O WAT 4785 130.962 75.742 108.061 1.00 0.00 O ATOM 88818 H1 WAT 4785 131.615 76.433 108.169 1.00 0.00 H ATOM 88819 H2 WAT 4785 130.122 76.201 108.081 1.00 0.00 H TER 88821 WAT 4785 ATOM 88821 O WAT 4786 145.513 128.049 71.093 1.00 0.00 O ATOM 88822 H1 WAT 4786 145.345 128.987 71.191 1.00 0.00 H ATOM 88823 H2 WAT 4786 145.135 127.825 70.243 1.00 0.00 H TER 88825 WAT 4786 ATOM 88825 O WAT 4787 37.916 114.554 9.533 1.00 0.00 O ATOM 88826 H1 WAT 4787 38.229 113.928 10.186 1.00 0.00 H ATOM 88827 H2 WAT 4787 37.207 115.024 9.971 1.00 0.00 H TER 88829 WAT 4787 ATOM 88829 O WAT 4788 94.880 12.495 63.328 1.00 0.00 O ATOM 88830 H1 WAT 4788 94.594 12.643 62.426 1.00 0.00 H ATOM 88831 H2 WAT 4788 95.776 12.168 63.244 1.00 0.00 H TER 88833 WAT 4788 ATOM 88833 O WAT 4789 116.189 128.179 98.304 1.00 0.00 O ATOM 88834 H1 WAT 4789 116.751 127.898 99.026 1.00 0.00 H ATOM 88835 H2 WAT 4789 116.633 127.863 97.517 1.00 0.00 H TER 88837 WAT 4789 ATOM 88837 O WAT 4790 40.677 96.217 94.719 1.00 0.00 O ATOM 88838 H1 WAT 4790 40.028 96.593 94.124 1.00 0.00 H ATOM 88839 H2 WAT 4790 40.353 96.432 95.593 1.00 0.00 H TER 88841 WAT 4790 ATOM 88841 O WAT 4791 137.479 128.471 107.264 1.00 0.00 O ATOM 88842 H1 WAT 4791 138.359 128.551 106.897 1.00 0.00 H ATOM 88843 H2 WAT 4791 137.325 127.527 107.313 1.00 0.00 H TER 88845 WAT 4791 ATOM 88845 O WAT 4792 33.623 70.226 118.065 1.00 0.00 O ATOM 88846 H1 WAT 4792 34.576 70.306 118.089 1.00 0.00 H ATOM 88847 H2 WAT 4792 33.431 69.473 118.624 1.00 0.00 H TER 88849 WAT 4792 ATOM 88849 O WAT 4793 76.193 4.137 89.464 1.00 0.00 O ATOM 88850 H1 WAT 4793 76.924 4.648 89.117 1.00 0.00 H ATOM 88851 H2 WAT 4793 75.419 4.665 89.268 1.00 0.00 H TER 88853 WAT 4793 ATOM 88853 O WAT 4794 43.664 33.040 9.097 1.00 0.00 O ATOM 88854 H1 WAT 4794 43.875 32.276 8.560 1.00 0.00 H ATOM 88855 H2 WAT 4794 43.296 32.673 9.901 1.00 0.00 H TER 88857 WAT 4794 ATOM 88857 O WAT 4795 60.784 44.887 18.836 1.00 0.00 O ATOM 88858 H1 WAT 4795 61.546 44.638 18.314 1.00 0.00 H ATOM 88859 H2 WAT 4795 60.978 44.559 19.715 1.00 0.00 H TER 88861 WAT 4795 ATOM 88861 O WAT 4796 129.278 129.168 114.857 1.00 0.00 O ATOM 88862 H1 WAT 4796 129.656 128.613 115.539 1.00 0.00 H ATOM 88863 H2 WAT 4796 128.813 128.559 114.283 1.00 0.00 H TER 88865 WAT 4796 ATOM 88865 O WAT 4797 21.726 140.697 3.090 1.00 0.00 O ATOM 88866 H1 WAT 4797 21.288 140.445 3.903 1.00 0.00 H ATOM 88867 H2 WAT 4797 21.229 141.451 2.773 1.00 0.00 H TER 88869 WAT 4797 ATOM 88869 O WAT 4798 16.030 80.150 9.302 1.00 0.00 O ATOM 88870 H1 WAT 4798 16.041 80.107 8.345 1.00 0.00 H ATOM 88871 H2 WAT 4798 15.734 81.038 9.498 1.00 0.00 H TER 88873 WAT 4798 ATOM 88873 O WAT 4799 7.576 41.004 3.033 1.00 0.00 O ATOM 88874 H1 WAT 4799 6.831 41.173 2.456 1.00 0.00 H ATOM 88875 H2 WAT 4799 7.417 40.125 3.378 1.00 0.00 H TER 88877 WAT 4799 ATOM 88877 O WAT 4800 12.698 19.187 157.110 1.00 0.00 O ATOM 88878 H1 WAT 4800 13.483 18.728 157.410 1.00 0.00 H ATOM 88879 H2 WAT 4800 12.058 18.492 156.959 1.00 0.00 H TER 88881 WAT 4800 ATOM 88881 O WAT 4801 45.498 57.735 99.507 1.00 0.00 O ATOM 88882 H1 WAT 4801 45.445 58.664 99.283 1.00 0.00 H ATOM 88883 H2 WAT 4801 45.860 57.320 98.724 1.00 0.00 H TER 88885 WAT 4801 ATOM 88885 O WAT 4802 128.135 49.002 134.986 1.00 0.00 O ATOM 88886 H1 WAT 4802 128.808 48.346 134.802 1.00 0.00 H ATOM 88887 H2 WAT 4802 128.391 49.760 134.461 1.00 0.00 H TER 88889 WAT 4802 ATOM 88889 O WAT 4803 27.968 51.297 134.631 1.00 0.00 O ATOM 88890 H1 WAT 4803 28.219 52.214 134.744 1.00 0.00 H ATOM 88891 H2 WAT 4803 27.963 51.165 133.683 1.00 0.00 H TER 88893 WAT 4803 ATOM 88893 O WAT 4804 24.401 94.983 71.997 1.00 0.00 O ATOM 88894 H1 WAT 4804 25.125 95.569 71.778 1.00 0.00 H ATOM 88895 H2 WAT 4804 24.587 94.179 71.512 1.00 0.00 H TER 88897 WAT 4804 ATOM 88897 O WAT 4805 1.680 124.638 128.577 1.00 0.00 O ATOM 88898 H1 WAT 4805 1.936 123.718 128.510 1.00 0.00 H ATOM 88899 H2 WAT 4805 0.728 124.629 128.477 1.00 0.00 H TER 88901 WAT 4805 ATOM 88901 O WAT 4806 66.555 133.536 136.849 1.00 0.00 O ATOM 88902 H1 WAT 4806 66.151 134.402 136.788 1.00 0.00 H ATOM 88903 H2 WAT 4806 67.468 133.713 137.078 1.00 0.00 H TER 88905 WAT 4806 ATOM 88905 O WAT 4807 49.024 139.570 141.134 1.00 0.00 O ATOM 88906 H1 WAT 4807 49.001 138.990 140.372 1.00 0.00 H ATOM 88907 H2 WAT 4807 49.892 139.431 141.514 1.00 0.00 H TER 88909 WAT 4807 ATOM 88909 O WAT 4808 56.281 59.527 56.683 1.00 0.00 O ATOM 88910 H1 WAT 4808 55.567 59.269 56.099 1.00 0.00 H ATOM 88911 H2 WAT 4808 56.404 60.461 56.513 1.00 0.00 H TER 88913 WAT 4808 ATOM 88913 O WAT 4809 116.861 87.131 154.801 1.00 0.00 O ATOM 88914 H1 WAT 4809 117.694 86.953 155.238 1.00 0.00 H ATOM 88915 H2 WAT 4809 116.956 86.736 153.934 1.00 0.00 H TER 88917 WAT 4809 ATOM 88917 O WAT 4810 65.287 131.518 126.547 1.00 0.00 O ATOM 88918 H1 WAT 4810 64.874 131.173 125.755 1.00 0.00 H ATOM 88919 H2 WAT 4810 65.704 132.332 126.265 1.00 0.00 H TER 88921 WAT 4810 ATOM 88921 O WAT 4811 103.950 31.729 75.145 1.00 0.00 O ATOM 88922 H1 WAT 4811 103.835 30.791 75.302 1.00 0.00 H ATOM 88923 H2 WAT 4811 104.684 31.977 75.707 1.00 0.00 H TER 88925 WAT 4811 ATOM 88925 O WAT 4812 139.477 106.135 18.907 1.00 0.00 O ATOM 88926 H1 WAT 4812 139.551 106.417 17.995 1.00 0.00 H ATOM 88927 H2 WAT 4812 139.773 106.890 19.415 1.00 0.00 H TER 88929 WAT 4812 ATOM 88929 O WAT 4813 38.378 37.766 148.823 1.00 0.00 O ATOM 88930 H1 WAT 4813 37.860 37.367 149.522 1.00 0.00 H ATOM 88931 H2 WAT 4813 38.735 38.563 149.215 1.00 0.00 H TER 88933 WAT 4813 ATOM 88933 O WAT 4814 12.960 135.169 6.036 1.00 0.00 O ATOM 88934 H1 WAT 4814 13.637 134.535 5.798 1.00 0.00 H ATOM 88935 H2 WAT 4814 12.558 134.805 6.825 1.00 0.00 H TER 88937 WAT 4814 ATOM 88937 O WAT 4815 10.674 52.270 8.709 1.00 0.00 O ATOM 88938 H1 WAT 4815 10.677 53.211 8.531 1.00 0.00 H ATOM 88939 H2 WAT 4815 11.589 52.059 8.893 1.00 0.00 H TER 88941 WAT 4815 ATOM 88941 O WAT 4816 127.421 127.392 84.511 1.00 0.00 O ATOM 88942 H1 WAT 4816 127.523 127.133 83.596 1.00 0.00 H ATOM 88943 H2 WAT 4816 127.178 128.317 84.473 1.00 0.00 H TER 88945 WAT 4816 ATOM 88945 O WAT 4817 144.255 50.208 65.841 1.00 0.00 O ATOM 88946 H1 WAT 4817 143.786 49.424 65.555 1.00 0.00 H ATOM 88947 H2 WAT 4817 145.042 50.229 65.297 1.00 0.00 H TER 88949 WAT 4817 ATOM 88949 O WAT 4818 85.107 112.160 151.647 1.00 0.00 O ATOM 88950 H1 WAT 4818 85.863 112.729 151.790 1.00 0.00 H ATOM 88951 H2 WAT 4818 84.753 112.008 152.523 1.00 0.00 H TER 88953 WAT 4818 ATOM 88953 O WAT 4819 12.270 132.545 67.932 1.00 0.00 O ATOM 88954 H1 WAT 4819 11.326 132.493 68.083 1.00 0.00 H ATOM 88955 H2 WAT 4819 12.421 133.453 67.668 1.00 0.00 H TER 88957 WAT 4819 ATOM 88957 O WAT 4820 104.184 137.044 104.312 1.00 0.00 O ATOM 88958 H1 WAT 4820 104.616 137.230 103.478 1.00 0.00 H ATOM 88959 H2 WAT 4820 103.539 137.744 104.409 1.00 0.00 H TER 88961 WAT 4820 ATOM 88961 O WAT 4821 15.716 50.875 150.955 1.00 0.00 O ATOM 88962 H1 WAT 4821 16.380 50.202 150.804 1.00 0.00 H ATOM 88963 H2 WAT 4821 16.056 51.651 150.510 1.00 0.00 H TER 88965 WAT 4821 ATOM 88965 O WAT 4822 7.268 67.356 139.830 1.00 0.00 O ATOM 88966 H1 WAT 4822 6.881 67.292 140.703 1.00 0.00 H ATOM 88967 H2 WAT 4822 6.638 67.871 139.326 1.00 0.00 H TER 88969 WAT 4822 ATOM 88969 O WAT 4823 46.266 43.287 156.309 1.00 0.00 O ATOM 88970 H1 WAT 4823 45.486 43.806 156.502 1.00 0.00 H ATOM 88971 H2 WAT 4823 46.700 43.763 155.600 1.00 0.00 H TER 88973 WAT 4823 ATOM 88973 O WAT 4824 103.244 24.955 122.313 1.00 0.00 O ATOM 88974 H1 WAT 4824 103.755 24.560 121.606 1.00 0.00 H ATOM 88975 H2 WAT 4824 102.760 25.664 121.891 1.00 0.00 H TER 88977 WAT 4824 ATOM 88977 O WAT 4825 89.800 54.871 15.354 1.00 0.00 O ATOM 88978 H1 WAT 4825 89.977 54.006 14.984 1.00 0.00 H ATOM 88979 H2 WAT 4825 89.029 54.742 15.907 1.00 0.00 H TER 88981 WAT 4825 ATOM 88981 O WAT 4826 127.193 91.748 98.995 1.00 0.00 O ATOM 88982 H1 WAT 4826 128.025 91.964 98.573 1.00 0.00 H ATOM 88983 H2 WAT 4826 126.531 92.166 98.444 1.00 0.00 H TER 88985 WAT 4826 ATOM 88985 O WAT 4827 107.387 103.482 29.691 1.00 0.00 O ATOM 88986 H1 WAT 4827 107.602 104.320 30.100 1.00 0.00 H ATOM 88987 H2 WAT 4827 107.235 103.696 28.771 1.00 0.00 H TER 88989 WAT 4827 ATOM 88989 O WAT 4828 72.356 44.639 17.567 1.00 0.00 O ATOM 88990 H1 WAT 4828 71.732 44.415 16.876 1.00 0.00 H ATOM 88991 H2 WAT 4828 73.055 43.991 17.477 1.00 0.00 H TER 88993 WAT 4828 ATOM 88993 O WAT 4829 106.441 2.467 53.817 1.00 0.00 O ATOM 88994 H1 WAT 4829 106.822 2.413 52.941 1.00 0.00 H ATOM 88995 H2 WAT 4829 106.608 3.367 54.096 1.00 0.00 H TER 88997 WAT 4829 ATOM 88997 O WAT 4830 85.920 63.815 96.399 1.00 0.00 O ATOM 88998 H1 WAT 4830 86.855 63.693 96.234 1.00 0.00 H ATOM 88999 H2 WAT 4830 85.510 63.709 95.541 1.00 0.00 H TER 89001 WAT 4830 ATOM 89001 O WAT 4831 86.037 145.161 122.047 1.00 0.00 O ATOM 89002 H1 WAT 4831 85.248 145.310 121.527 1.00 0.00 H ATOM 89003 H2 WAT 4831 86.505 145.995 122.018 1.00 0.00 H TER 89005 WAT 4831 ATOM 89005 O WAT 4832 78.153 7.037 99.048 1.00 0.00 O ATOM 89006 H1 WAT 4832 77.620 7.473 99.713 1.00 0.00 H ATOM 89007 H2 WAT 4832 77.565 6.935 98.299 1.00 0.00 H TER 89009 WAT 4832 ATOM 89009 O WAT 4833 40.325 18.368 87.944 1.00 0.00 O ATOM 89010 H1 WAT 4833 40.450 18.469 87.001 1.00 0.00 H ATOM 89011 H2 WAT 4833 40.793 19.110 88.328 1.00 0.00 H TER 89013 WAT 4833 ATOM 89013 O WAT 4834 65.608 50.327 104.294 1.00 0.00 O ATOM 89014 H1 WAT 4834 64.856 50.121 104.849 1.00 0.00 H ATOM 89015 H2 WAT 4834 66.037 49.483 104.149 1.00 0.00 H TER 89017 WAT 4834 ATOM 89017 O WAT 4835 6.630 100.468 150.712 1.00 0.00 O ATOM 89018 H1 WAT 4835 6.247 101.181 151.224 1.00 0.00 H ATOM 89019 H2 WAT 4835 6.552 100.758 149.803 1.00 0.00 H TER 89021 WAT 4835 ATOM 89021 O WAT 4836 109.214 27.569 11.862 1.00 0.00 O ATOM 89022 H1 WAT 4836 108.335 27.942 11.798 1.00 0.00 H ATOM 89023 H2 WAT 4836 109.652 27.850 11.058 1.00 0.00 H TER 89025 WAT 4836 ATOM 89025 O WAT 4837 134.166 46.415 71.336 1.00 0.00 O ATOM 89026 H1 WAT 4837 134.183 45.459 71.309 1.00 0.00 H ATOM 89027 H2 WAT 4837 133.311 46.650 70.977 1.00 0.00 H TER 89029 WAT 4837 ATOM 89029 O WAT 4838 67.558 34.025 137.608 1.00 0.00 O ATOM 89030 H1 WAT 4838 66.944 33.598 137.011 1.00 0.00 H ATOM 89031 H2 WAT 4838 67.316 33.698 138.474 1.00 0.00 H TER 89033 WAT 4838 ATOM 89033 O WAT 4839 34.950 95.068 70.570 1.00 0.00 O ATOM 89034 H1 WAT 4839 34.170 95.129 71.121 1.00 0.00 H ATOM 89035 H2 WAT 4839 35.632 94.741 71.157 1.00 0.00 H TER 89037 WAT 4839 ATOM 89037 O WAT 4840 35.266 95.894 142.794 1.00 0.00 O ATOM 89038 H1 WAT 4840 36.199 96.105 142.829 1.00 0.00 H ATOM 89039 H2 WAT 4840 35.151 95.206 143.450 1.00 0.00 H TER 89041 WAT 4840 ATOM 89041 O WAT 4841 39.415 31.247 65.052 1.00 0.00 O ATOM 89042 H1 WAT 4841 39.057 32.098 64.800 1.00 0.00 H ATOM 89043 H2 WAT 4841 38.672 30.646 64.987 1.00 0.00 H TER 89045 WAT 4841 ATOM 89045 O WAT 4842 123.334 98.754 81.548 1.00 0.00 O ATOM 89046 H1 WAT 4842 123.214 97.822 81.366 1.00 0.00 H ATOM 89047 H2 WAT 4842 122.965 99.197 80.784 1.00 0.00 H TER 89049 WAT 4842 ATOM 89049 O WAT 4843 28.455 127.239 78.419 1.00 0.00 O ATOM 89050 H1 WAT 4843 27.948 128.049 78.468 1.00 0.00 H ATOM 89051 H2 WAT 4843 29.131 127.419 77.766 1.00 0.00 H TER 89053 WAT 4843 ATOM 89053 O WAT 4844 106.098 102.000 94.020 1.00 0.00 O ATOM 89054 H1 WAT 4844 105.322 101.457 94.157 1.00 0.00 H ATOM 89055 H2 WAT 4844 106.497 102.072 94.887 1.00 0.00 H TER 89057 WAT 4844 ATOM 89057 O WAT 4845 144.474 64.064 14.864 1.00 0.00 O ATOM 89058 H1 WAT 4845 143.593 63.763 14.641 1.00 0.00 H ATOM 89059 H2 WAT 4845 144.533 64.938 14.479 1.00 0.00 H TER 89061 WAT 4845 ATOM 89061 O WAT 4846 28.078 66.579 132.058 1.00 0.00 O ATOM 89062 H1 WAT 4846 27.853 66.934 131.198 1.00 0.00 H ATOM 89063 H2 WAT 4846 28.985 66.851 132.198 1.00 0.00 H TER 89065 WAT 4846 ATOM 89065 O WAT 4847 62.520 101.107 17.681 1.00 0.00 O ATOM 89066 H1 WAT 4847 63.361 101.169 18.134 1.00 0.00 H ATOM 89067 H2 WAT 4847 61.892 100.891 18.370 1.00 0.00 H TER 89069 WAT 4847 ATOM 89069 O WAT 4848 103.579 85.297 22.889 1.00 0.00 O ATOM 89070 H1 WAT 4848 103.322 86.145 23.251 1.00 0.00 H ATOM 89071 H2 WAT 4848 104.085 84.882 23.587 1.00 0.00 H TER 89073 WAT 4848 ATOM 89073 O WAT 4849 105.426 87.660 109.060 1.00 0.00 O ATOM 89074 H1 WAT 4849 106.132 87.674 108.413 1.00 0.00 H ATOM 89075 H2 WAT 4849 104.720 88.163 108.655 1.00 0.00 H TER 89077 WAT 4849 ATOM 89077 O WAT 4850 76.339 37.410 85.543 1.00 0.00 O ATOM 89078 H1 WAT 4850 77.080 37.637 86.104 1.00 0.00 H ATOM 89079 H2 WAT 4850 75.584 37.403 86.132 1.00 0.00 H TER 89081 WAT 4850 ATOM 89081 O WAT 4851 5.787 18.182 101.493 1.00 0.00 O ATOM 89082 H1 WAT 4851 4.920 18.589 101.492 1.00 0.00 H ATOM 89083 H2 WAT 4851 6.362 18.845 101.875 1.00 0.00 H TER 89085 WAT 4851 ATOM 89085 O WAT 4852 81.320 2.169 148.678 1.00 0.00 O ATOM 89086 H1 WAT 4852 81.996 1.512 148.511 1.00 0.00 H ATOM 89087 H2 WAT 4852 80.505 1.748 148.406 1.00 0.00 H TER 89089 WAT 4852 ATOM 89089 O WAT 4853 48.262 46.026 131.424 1.00 0.00 O ATOM 89090 H1 WAT 4853 47.422 46.006 131.882 1.00 0.00 H ATOM 89091 H2 WAT 4853 48.049 45.781 130.523 1.00 0.00 H TER 89093 WAT 4853 ATOM 89093 O WAT 4854 62.332 53.322 125.729 1.00 0.00 O ATOM 89094 H1 WAT 4854 61.680 53.200 125.038 1.00 0.00 H ATOM 89095 H2 WAT 4854 61.881 53.062 126.532 1.00 0.00 H TER 89097 WAT 4854 ATOM 89097 O WAT 4855 7.499 58.150 72.690 1.00 0.00 O ATOM 89098 H1 WAT 4855 7.383 57.399 73.273 1.00 0.00 H ATOM 89099 H2 WAT 4855 6.626 58.313 72.333 1.00 0.00 H TER 89101 WAT 4855 ATOM 89101 O WAT 4856 132.081 1.480 68.783 1.00 0.00 O ATOM 89102 H1 WAT 4856 131.964 2.415 68.613 1.00 0.00 H ATOM 89103 H2 WAT 4856 133.028 1.347 68.751 1.00 0.00 H TER 89105 WAT 4856 ATOM 89105 O WAT 4857 23.110 6.139 149.056 1.00 0.00 O ATOM 89106 H1 WAT 4857 23.454 5.741 148.257 1.00 0.00 H ATOM 89107 H2 WAT 4857 22.192 5.869 149.082 1.00 0.00 H TER 89109 WAT 4857 ATOM 89109 O WAT 4858 48.249 5.413 119.873 1.00 0.00 O ATOM 89110 H1 WAT 4858 48.600 5.317 120.758 1.00 0.00 H ATOM 89111 H2 WAT 4858 49.010 5.634 119.336 1.00 0.00 H TER 89113 WAT 4858 ATOM 89113 O WAT 4859 62.022 15.770 127.346 1.00 0.00 O ATOM 89114 H1 WAT 4859 61.112 16.034 127.205 1.00 0.00 H ATOM 89115 H2 WAT 4859 61.992 14.814 127.374 1.00 0.00 H TER 89117 WAT 4859 ATOM 89117 O WAT 4860 143.852 50.325 16.640 1.00 0.00 O ATOM 89118 H1 WAT 4860 143.005 50.670 16.921 1.00 0.00 H ATOM 89119 H2 WAT 4860 144.047 49.627 17.265 1.00 0.00 H TER 89121 WAT 4860 ATOM 89121 O WAT 4861 22.949 74.051 102.974 1.00 0.00 O ATOM 89122 H1 WAT 4861 22.797 73.577 102.156 1.00 0.00 H ATOM 89123 H2 WAT 4861 22.129 74.515 103.138 1.00 0.00 H TER 89125 WAT 4861 ATOM 89125 O WAT 4862 143.173 138.399 146.426 1.00 0.00 O ATOM 89126 H1 WAT 4862 143.317 137.922 147.243 1.00 0.00 H ATOM 89127 H2 WAT 4862 142.398 137.988 146.042 1.00 0.00 H TER 89129 WAT 4862 ATOM 89129 O WAT 4863 22.856 24.451 28.852 1.00 0.00 O ATOM 89130 H1 WAT 4863 23.663 24.918 28.635 1.00 0.00 H ATOM 89131 H2 WAT 4863 23.134 23.757 29.449 1.00 0.00 H TER 89133 WAT 4863 ATOM 89133 O WAT 4864 121.887 0.100 150.238 1.00 0.00 O ATOM 89134 H1 WAT 4864 121.517 0.357 149.394 1.00 0.00 H ATOM 89135 H2 WAT 4864 122.808 0.357 150.184 1.00 0.00 H TER 89137 WAT 4864 ATOM 89137 O WAT 4865 27.839 -0.060 137.919 1.00 0.00 O ATOM 89138 H1 WAT 4865 28.237 0.624 137.381 1.00 0.00 H ATOM 89139 H2 WAT 4865 27.883 0.282 138.812 1.00 0.00 H TER 89141 WAT 4865 ATOM 89141 O WAT 4866 88.927 126.213 130.375 1.00 0.00 O ATOM 89142 H1 WAT 4866 88.151 125.700 130.600 1.00 0.00 H ATOM 89143 H2 WAT 4866 89.518 125.585 129.960 1.00 0.00 H TER 89145 WAT 4866 ATOM 89145 O WAT 4867 10.652 100.830 153.005 1.00 0.00 O ATOM 89146 H1 WAT 4867 10.533 99.902 153.208 1.00 0.00 H ATOM 89147 H2 WAT 4867 10.154 101.289 153.681 1.00 0.00 H TER 89149 WAT 4867 ATOM 89149 O WAT 4868 40.982 42.784 95.084 1.00 0.00 O ATOM 89150 H1 WAT 4868 40.947 43.338 95.863 1.00 0.00 H ATOM 89151 H2 WAT 4868 41.720 42.195 95.241 1.00 0.00 H TER 89153 WAT 4868 ATOM 89153 O WAT 4869 25.215 117.353 102.733 1.00 0.00 O ATOM 89154 H1 WAT 4869 25.454 118.096 102.179 1.00 0.00 H ATOM 89155 H2 WAT 4869 24.317 117.537 103.007 1.00 0.00 H TER 89157 WAT 4869 ATOM 89157 O WAT 4870 118.307 127.295 7.122 1.00 0.00 O ATOM 89158 H1 WAT 4870 117.674 127.046 7.795 1.00 0.00 H ATOM 89159 H2 WAT 4870 117.831 127.200 6.298 1.00 0.00 H TER 89161 WAT 4870 ATOM 89161 O WAT 4871 139.946 24.900 74.064 1.00 0.00 O ATOM 89162 H1 WAT 4871 139.159 24.424 73.800 1.00 0.00 H ATOM 89163 H2 WAT 4871 140.475 24.948 73.268 1.00 0.00 H TER 89165 WAT 4871 ATOM 89165 O WAT 4872 132.270 19.070 4.183 1.00 0.00 O ATOM 89166 H1 WAT 4872 132.600 19.411 5.015 1.00 0.00 H ATOM 89167 H2 WAT 4872 131.351 19.338 4.163 1.00 0.00 H TER 89169 WAT 4872 ATOM 89169 O WAT 4873 37.604 52.946 140.264 1.00 0.00 O ATOM 89170 H1 WAT 4873 37.620 52.554 139.390 1.00 0.00 H ATOM 89171 H2 WAT 4873 36.678 53.120 140.431 1.00 0.00 H TER 89173 WAT 4873 ATOM 89173 O WAT 4874 101.570 88.286 98.367 1.00 0.00 O ATOM 89174 H1 WAT 4874 101.046 88.538 97.607 1.00 0.00 H ATOM 89175 H2 WAT 4874 101.079 87.570 98.769 1.00 0.00 H TER 89177 WAT 4874 ATOM 89177 O WAT 4875 119.097 120.892 100.227 1.00 0.00 O ATOM 89178 H1 WAT 4875 119.866 121.083 100.765 1.00 0.00 H ATOM 89179 H2 WAT 4875 119.039 119.937 100.223 1.00 0.00 H TER 89181 WAT 4875 ATOM 89181 O WAT 4876 32.546 67.018 110.971 1.00 0.00 O ATOM 89182 H1 WAT 4876 32.035 66.213 111.061 1.00 0.00 H ATOM 89183 H2 WAT 4876 33.440 66.761 111.195 1.00 0.00 H TER 89185 WAT 4876 ATOM 89185 O WAT 4877 62.611 75.675 128.927 1.00 0.00 O ATOM 89186 H1 WAT 4877 61.951 75.284 128.353 1.00 0.00 H ATOM 89187 H2 WAT 4877 62.205 76.481 129.245 1.00 0.00 H TER 89189 WAT 4877 ATOM 89189 O WAT 4878 60.038 77.809 158.225 1.00 0.00 O ATOM 89190 H1 WAT 4878 59.698 77.610 159.097 1.00 0.00 H ATOM 89191 H2 WAT 4878 60.685 78.499 158.373 1.00 0.00 H TER 89193 WAT 4878 ATOM 89193 O WAT 4879 97.236 124.707 114.152 1.00 0.00 O ATOM 89194 H1 WAT 4879 97.971 125.057 113.648 1.00 0.00 H ATOM 89195 H2 WAT 4879 97.643 124.140 114.807 1.00 0.00 H TER 89197 WAT 4879 ATOM 89197 O WAT 4880 91.307 7.092 127.616 1.00 0.00 O ATOM 89198 H1 WAT 4880 91.674 7.836 128.094 1.00 0.00 H ATOM 89199 H2 WAT 4880 91.131 6.437 128.291 1.00 0.00 H TER 89201 WAT 4880 ATOM 89201 O WAT 4881 0.744 1.164 7.106 1.00 0.00 O ATOM 89202 H1 WAT 4881 0.575 1.652 7.912 1.00 0.00 H ATOM 89203 H2 WAT 4881 -0.074 0.699 6.931 1.00 0.00 H TER 89205 WAT 4881 ATOM 89205 O WAT 4882 117.248 87.067 121.663 1.00 0.00 O ATOM 89206 H1 WAT 4882 116.316 87.108 121.449 1.00 0.00 H ATOM 89207 H2 WAT 4882 117.472 87.958 121.931 1.00 0.00 H TER 89209 WAT 4882 ATOM 89209 O WAT 4883 32.769 131.438 153.816 1.00 0.00 O ATOM 89210 H1 WAT 4883 32.283 132.259 153.733 1.00 0.00 H ATOM 89211 H2 WAT 4883 32.230 130.794 153.357 1.00 0.00 H TER 89213 WAT 4883 ATOM 89213 O WAT 4884 108.445 128.194 121.454 1.00 0.00 O ATOM 89214 H1 WAT 4884 107.758 128.414 122.082 1.00 0.00 H ATOM 89215 H2 WAT 4884 108.644 127.274 121.629 1.00 0.00 H TER 89217 WAT 4884 ATOM 89217 O WAT 4885 22.334 80.733 132.127 1.00 0.00 O ATOM 89218 H1 WAT 4885 21.656 80.389 132.708 1.00 0.00 H ATOM 89219 H2 WAT 4885 22.809 79.958 131.828 1.00 0.00 H TER 89221 WAT 4885 ATOM 89221 O WAT 4886 55.506 24.515 147.263 1.00 0.00 O ATOM 89222 H1 WAT 4886 55.290 24.599 148.192 1.00 0.00 H ATOM 89223 H2 WAT 4886 55.577 23.571 147.118 1.00 0.00 H TER 89225 WAT 4886 ATOM 89225 O WAT 4887 136.489 51.498 56.621 1.00 0.00 O ATOM 89226 H1 WAT 4887 136.057 50.889 57.220 1.00 0.00 H ATOM 89227 H2 WAT 4887 137.389 51.554 56.943 1.00 0.00 H TER 89229 WAT 4887 ATOM 89229 O WAT 4888 120.369 137.301 99.314 1.00 0.00 O ATOM 89230 H1 WAT 4888 119.568 137.799 99.151 1.00 0.00 H ATOM 89231 H2 WAT 4888 120.611 136.949 98.457 1.00 0.00 H TER 89233 WAT 4888 ATOM 89233 O WAT 4889 50.753 142.922 96.064 1.00 0.00 O ATOM 89234 H1 WAT 4889 51.047 142.739 96.957 1.00 0.00 H ATOM 89235 H2 WAT 4889 49.878 142.535 96.017 1.00 0.00 H TER 89237 WAT 4889 ATOM 89237 O WAT 4890 128.563 37.942 71.575 1.00 0.00 O ATOM 89238 H1 WAT 4890 129.323 37.697 72.104 1.00 0.00 H ATOM 89239 H2 WAT 4890 127.997 38.424 72.178 1.00 0.00 H TER 89241 WAT 4890 ATOM 89241 O WAT 4891 91.949 137.411 119.281 1.00 0.00 O ATOM 89242 H1 WAT 4891 91.340 138.056 119.641 1.00 0.00 H ATOM 89243 H2 WAT 4891 91.388 136.759 118.862 1.00 0.00 H TER 89245 WAT 4891 ATOM 89245 O WAT 4892 23.311 52.391 158.804 1.00 0.00 O ATOM 89246 H1 WAT 4892 23.831 52.035 158.084 1.00 0.00 H ATOM 89247 H2 WAT 4892 22.406 52.184 158.571 1.00 0.00 H TER 89249 WAT 4892 ATOM 89249 O WAT 4893 57.241 65.203 6.283 1.00 0.00 O ATOM 89250 H1 WAT 4893 56.696 65.382 5.516 1.00 0.00 H ATOM 89251 H2 WAT 4893 57.876 64.555 5.979 1.00 0.00 H TER 89253 WAT 4893 ATOM 89253 O WAT 4894 70.300 42.105 81.686 1.00 0.00 O ATOM 89254 H1 WAT 4894 69.816 41.535 81.088 1.00 0.00 H ATOM 89255 H2 WAT 4894 69.722 42.857 81.820 1.00 0.00 H TER 89257 WAT 4894 ATOM 89257 O WAT 4895 118.603 125.032 60.950 1.00 0.00 O ATOM 89258 H1 WAT 4895 119.305 125.036 61.600 1.00 0.00 H ATOM 89259 H2 WAT 4895 118.297 125.938 60.922 1.00 0.00 H TER 89261 WAT 4895 ATOM 89261 O WAT 4896 71.633 59.169 101.036 1.00 0.00 O ATOM 89262 H1 WAT 4896 72.079 60.016 101.024 1.00 0.00 H ATOM 89263 H2 WAT 4896 70.715 59.384 101.200 1.00 0.00 H TER 89265 WAT 4896 ATOM 89265 O WAT 4897 83.565 55.077 142.837 1.00 0.00 O ATOM 89266 H1 WAT 4897 82.745 55.014 143.327 1.00 0.00 H ATOM 89267 H2 WAT 4897 83.295 55.075 141.918 1.00 0.00 H TER 89269 WAT 4897 ATOM 89269 O WAT 4898 60.449 68.189 21.560 1.00 0.00 O ATOM 89270 H1 WAT 4898 60.285 68.950 22.116 1.00 0.00 H ATOM 89271 H2 WAT 4898 59.578 67.892 21.297 1.00 0.00 H TER 89273 WAT 4898 ATOM 89273 O WAT 4899 73.986 32.958 141.363 1.00 0.00 O ATOM 89274 H1 WAT 4899 74.395 33.770 141.662 1.00 0.00 H ATOM 89275 H2 WAT 4899 74.216 32.901 140.435 1.00 0.00 H TER 89277 WAT 4899 ATOM 89277 O WAT 4900 39.174 78.589 130.612 1.00 0.00 O ATOM 89278 H1 WAT 4900 39.339 77.844 130.034 1.00 0.00 H ATOM 89279 H2 WAT 4900 38.779 78.203 131.394 1.00 0.00 H TER 89281 WAT 4900 ATOM 89281 O WAT 4901 31.998 58.076 106.467 1.00 0.00 O ATOM 89282 H1 WAT 4901 31.993 58.979 106.149 1.00 0.00 H ATOM 89283 H2 WAT 4901 32.887 57.942 106.795 1.00 0.00 H TER 89285 WAT 4901 ATOM 89285 O WAT 4902 59.387 131.295 92.879 1.00 0.00 O ATOM 89286 H1 WAT 4902 59.111 130.380 92.820 1.00 0.00 H ATOM 89287 H2 WAT 4902 59.131 131.677 92.040 1.00 0.00 H TER 89289 WAT 4902 ATOM 89289 O WAT 4903 28.549 110.794 25.881 1.00 0.00 O ATOM 89290 H1 WAT 4903 27.721 110.318 25.937 1.00 0.00 H ATOM 89291 H2 WAT 4903 29.219 110.132 26.053 1.00 0.00 H TER 89293 WAT 4903 ATOM 89293 O WAT 4904 92.643 48.203 74.092 1.00 0.00 O ATOM 89294 H1 WAT 4904 93.006 48.116 74.973 1.00 0.00 H ATOM 89295 H2 WAT 4904 92.957 49.054 73.786 1.00 0.00 H TER 89297 WAT 4904 ATOM 89297 O WAT 4905 96.167 103.520 143.362 1.00 0.00 O ATOM 89298 H1 WAT 4905 95.460 103.444 144.002 1.00 0.00 H ATOM 89299 H2 WAT 4905 96.968 103.494 143.885 1.00 0.00 H TER 89301 WAT 4905 ATOM 89301 O WAT 4906 32.837 102.549 74.768 1.00 0.00 O ATOM 89302 H1 WAT 4906 33.587 102.814 75.300 1.00 0.00 H ATOM 89303 H2 WAT 4906 33.133 101.764 74.309 1.00 0.00 H TER 89305 WAT 4906 ATOM 89305 O WAT 4907 25.980 32.477 72.299 1.00 0.00 O ATOM 89306 H1 WAT 4907 25.089 32.792 72.453 1.00 0.00 H ATOM 89307 H2 WAT 4907 26.460 32.719 73.091 1.00 0.00 H TER 89309 WAT 4907 ATOM 89309 O WAT 4908 70.493 22.314 143.942 1.00 0.00 O ATOM 89310 H1 WAT 4908 69.949 21.672 143.487 1.00 0.00 H ATOM 89311 H2 WAT 4908 71.307 22.338 143.439 1.00 0.00 H TER 89313 WAT 4908 ATOM 89313 O WAT 4909 97.880 95.575 106.788 1.00 0.00 O ATOM 89314 H1 WAT 4909 97.182 95.731 106.152 1.00 0.00 H ATOM 89315 H2 WAT 4909 98.669 95.916 106.366 1.00 0.00 H TER 89317 WAT 4909 ATOM 89317 O WAT 4910 141.026 115.368 26.873 1.00 0.00 O ATOM 89318 H1 WAT 4910 140.232 115.637 27.335 1.00 0.00 H ATOM 89319 H2 WAT 4910 141.147 116.034 26.196 1.00 0.00 H TER 89321 WAT 4910 ATOM 89321 O WAT 4911 132.229 120.331 12.494 1.00 0.00 O ATOM 89322 H1 WAT 4911 132.618 120.378 11.620 1.00 0.00 H ATOM 89323 H2 WAT 4911 131.403 119.867 12.364 1.00 0.00 H TER 89325 WAT 4911 ATOM 89325 O WAT 4912 22.652 45.086 127.601 1.00 0.00 O ATOM 89326 H1 WAT 4912 23.112 45.695 127.022 1.00 0.00 H ATOM 89327 H2 WAT 4912 21.805 45.502 127.762 1.00 0.00 H TER 89329 WAT 4912 ATOM 89329 O WAT 4913 143.386 74.004 10.231 1.00 0.00 O ATOM 89330 H1 WAT 4913 143.944 74.542 9.669 1.00 0.00 H ATOM 89331 H2 WAT 4913 143.874 73.188 10.343 1.00 0.00 H TER 89333 WAT 4913 ATOM 89333 O WAT 4914 39.715 77.394 100.596 1.00 0.00 O ATOM 89334 H1 WAT 4914 39.580 76.936 101.426 1.00 0.00 H ATOM 89335 H2 WAT 4914 40.187 78.191 100.835 1.00 0.00 H TER 89337 WAT 4914 ATOM 89337 O WAT 4915 136.007 145.605 87.771 1.00 0.00 O ATOM 89338 H1 WAT 4915 135.528 146.434 87.773 1.00 0.00 H ATOM 89339 H2 WAT 4915 136.548 145.642 86.983 1.00 0.00 H TER 89341 WAT 4915 ATOM 89341 O WAT 4916 122.226 5.234 99.342 1.00 0.00 O ATOM 89342 H1 WAT 4916 121.860 4.443 98.946 1.00 0.00 H ATOM 89343 H2 WAT 4916 123.091 4.968 99.653 1.00 0.00 H TER 89345 WAT 4916 ATOM 89345 O WAT 4917 73.848 14.505 154.702 1.00 0.00 O ATOM 89346 H1 WAT 4917 74.519 13.826 154.783 1.00 0.00 H ATOM 89347 H2 WAT 4917 73.217 14.301 155.392 1.00 0.00 H TER 89349 WAT 4917 ATOM 89349 O WAT 4918 68.354 49.583 132.064 1.00 0.00 O ATOM 89350 H1 WAT 4918 67.549 50.058 132.268 1.00 0.00 H ATOM 89351 H2 WAT 4918 68.815 49.522 132.901 1.00 0.00 H TER 89353 WAT 4918 ATOM 89353 O WAT 4919 68.087 22.185 139.471 1.00 0.00 O ATOM 89354 H1 WAT 4919 68.292 22.498 138.590 1.00 0.00 H ATOM 89355 H2 WAT 4919 68.862 22.403 139.989 1.00 0.00 H TER 89357 WAT 4919 ATOM 89357 O WAT 4920 97.888 18.651 95.407 1.00 0.00 O ATOM 89358 H1 WAT 4920 98.759 18.522 95.783 1.00 0.00 H ATOM 89359 H2 WAT 4920 97.591 19.485 95.772 1.00 0.00 H TER 89361 WAT 4920 ATOM 89361 O WAT 4921 60.189 109.797 157.895 1.00 0.00 O ATOM 89362 H1 WAT 4921 59.973 109.258 158.656 1.00 0.00 H ATOM 89363 H2 WAT 4921 60.608 110.574 158.263 1.00 0.00 H TER 89365 WAT 4921 ATOM 89365 O WAT 4922 84.141 132.539 114.670 1.00 0.00 O ATOM 89366 H1 WAT 4922 83.434 131.916 114.499 1.00 0.00 H ATOM 89367 H2 WAT 4922 84.053 132.752 115.599 1.00 0.00 H TER 89369 WAT 4922 ATOM 89369 O WAT 4923 106.339 38.422 142.967 1.00 0.00 O ATOM 89370 H1 WAT 4923 105.460 38.242 143.300 1.00 0.00 H ATOM 89371 H2 WAT 4923 106.210 39.097 142.302 1.00 0.00 H TER 89373 WAT 4923 ATOM 89373 O WAT 4924 13.094 139.140 121.738 1.00 0.00 O ATOM 89374 H1 WAT 4924 12.900 138.564 120.998 1.00 0.00 H ATOM 89375 H2 WAT 4924 13.319 139.979 121.336 1.00 0.00 H TER 89377 WAT 4924 ATOM 89377 O WAT 4925 141.471 52.335 17.558 1.00 0.00 O ATOM 89378 H1 WAT 4925 142.193 52.204 18.172 1.00 0.00 H ATOM 89379 H2 WAT 4925 140.837 52.864 18.043 1.00 0.00 H TER 89381 WAT 4925 ATOM 89381 O WAT 4926 122.187 113.525 155.626 1.00 0.00 O ATOM 89382 H1 WAT 4926 122.692 112.725 155.480 1.00 0.00 H ATOM 89383 H2 WAT 4926 121.790 113.715 154.776 1.00 0.00 H TER 89385 WAT 4926 ATOM 89385 O WAT 4927 33.572 3.353 145.942 1.00 0.00 O ATOM 89386 H1 WAT 4927 33.765 2.604 146.505 1.00 0.00 H ATOM 89387 H2 WAT 4927 34.412 3.801 145.843 1.00 0.00 H TER 89389 WAT 4927 ATOM 89389 O WAT 4928 125.771 52.895 158.152 1.00 0.00 O ATOM 89390 H1 WAT 4928 125.828 53.830 157.959 1.00 0.00 H ATOM 89391 H2 WAT 4928 126.036 52.822 159.069 1.00 0.00 H TER 89393 WAT 4928 ATOM 89393 O WAT 4929 85.159 67.289 14.892 1.00 0.00 O ATOM 89394 H1 WAT 4929 84.816 66.637 15.503 1.00 0.00 H ATOM 89395 H2 WAT 4929 86.110 67.211 14.967 1.00 0.00 H TER 89397 WAT 4929 ATOM 89397 O WAT 4930 6.353 115.312 64.917 1.00 0.00 O ATOM 89398 H1 WAT 4930 5.923 114.462 64.830 1.00 0.00 H ATOM 89399 H2 WAT 4930 5.651 115.950 64.791 1.00 0.00 H TER 89401 WAT 4930 ATOM 89401 O WAT 4931 56.102 96.956 114.968 1.00 0.00 O ATOM 89402 H1 WAT 4931 56.318 97.366 114.130 1.00 0.00 H ATOM 89403 H2 WAT 4931 56.224 96.019 114.814 1.00 0.00 H TER 89405 WAT 4931 ATOM 89405 O WAT 4932 109.036 135.520 82.297 1.00 0.00 O ATOM 89406 H1 WAT 4932 108.710 135.557 83.196 1.00 0.00 H ATOM 89407 H2 WAT 4932 108.275 135.265 81.775 1.00 0.00 H TER 89409 WAT 4932 ATOM 89409 O WAT 4933 15.322 111.599 23.194 1.00 0.00 O ATOM 89410 H1 WAT 4933 16.102 111.933 22.751 1.00 0.00 H ATOM 89411 H2 WAT 4933 15.131 110.771 22.752 1.00 0.00 H TER 89413 WAT 4933 ATOM 89413 O WAT 4934 111.793 87.560 145.198 1.00 0.00 O ATOM 89414 H1 WAT 4934 111.122 88.174 144.900 1.00 0.00 H ATOM 89415 H2 WAT 4934 112.106 87.141 144.396 1.00 0.00 H TER 89417 WAT 4934 ATOM 89417 O WAT 4935 64.787 62.948 143.922 1.00 0.00 O ATOM 89418 H1 WAT 4935 65.653 63.165 143.578 1.00 0.00 H ATOM 89419 H2 WAT 4935 64.894 62.080 144.311 1.00 0.00 H TER 89421 WAT 4935 ATOM 89421 O WAT 4936 92.827 129.183 99.172 1.00 0.00 O ATOM 89422 H1 WAT 4936 93.106 129.628 99.972 1.00 0.00 H ATOM 89423 H2 WAT 4936 92.797 129.874 98.511 1.00 0.00 H TER 89425 WAT 4936 ATOM 89425 O WAT 4937 27.043 35.065 21.062 1.00 0.00 O ATOM 89426 H1 WAT 4937 26.588 35.059 21.904 1.00 0.00 H ATOM 89427 H2 WAT 4937 27.873 34.620 21.235 1.00 0.00 H TER 89429 WAT 4937 ATOM 89429 O WAT 4938 103.888 17.705 132.979 1.00 0.00 O ATOM 89430 H1 WAT 4938 103.294 18.100 133.617 1.00 0.00 H ATOM 89431 H2 WAT 4938 103.804 18.256 132.201 1.00 0.00 H TER 89433 WAT 4938 ATOM 89433 O WAT 4939 10.277 52.497 3.552 1.00 0.00 O ATOM 89434 H1 WAT 4939 11.000 52.705 2.961 1.00 0.00 H ATOM 89435 H2 WAT 4939 10.702 52.183 4.350 1.00 0.00 H TER 89437 WAT 4939 ATOM 89437 O WAT 4940 37.140 58.656 88.601 1.00 0.00 O ATOM 89438 H1 WAT 4940 37.687 59.302 89.046 1.00 0.00 H ATOM 89439 H2 WAT 4940 37.241 57.858 89.120 1.00 0.00 H TER 89441 WAT 4940 ATOM 89441 O WAT 4941 18.927 142.097 110.354 1.00 0.00 O ATOM 89442 H1 WAT 4941 19.343 141.246 110.489 1.00 0.00 H ATOM 89443 H2 WAT 4941 19.525 142.723 110.762 1.00 0.00 H TER 89445 WAT 4941 ATOM 89445 O WAT 4942 31.013 57.140 114.098 1.00 0.00 O ATOM 89446 H1 WAT 4942 31.740 56.745 114.579 1.00 0.00 H ATOM 89447 H2 WAT 4942 30.946 56.620 113.297 1.00 0.00 H TER 89449 WAT 4942 ATOM 89449 O WAT 4943 117.840 122.853 91.414 1.00 0.00 O ATOM 89450 H1 WAT 4943 117.938 122.455 92.278 1.00 0.00 H ATOM 89451 H2 WAT 4943 116.905 123.047 91.344 1.00 0.00 H TER 89453 WAT 4943 ATOM 89453 O WAT 4944 77.135 29.936 57.102 1.00 0.00 O ATOM 89454 H1 WAT 4944 77.992 30.213 57.426 1.00 0.00 H ATOM 89455 H2 WAT 4944 76.508 30.401 57.656 1.00 0.00 H TER 89457 WAT 4944 ATOM 89457 O WAT 4945 115.059 143.345 127.456 1.00 0.00 O ATOM 89458 H1 WAT 4945 115.560 142.539 127.328 1.00 0.00 H ATOM 89459 H2 WAT 4945 115.573 144.019 127.010 1.00 0.00 H TER 89461 WAT 4945 ATOM 89461 O WAT 4946 143.891 35.225 4.884 1.00 0.00 O ATOM 89462 H1 WAT 4946 144.798 34.931 4.796 1.00 0.00 H ATOM 89463 H2 WAT 4946 143.377 34.554 4.435 1.00 0.00 H TER 89465 WAT 4946 ATOM 89465 O WAT 4947 107.575 54.139 105.141 1.00 0.00 O ATOM 89466 H1 WAT 4947 106.708 53.737 105.084 1.00 0.00 H ATOM 89467 H2 WAT 4947 107.677 54.607 104.312 1.00 0.00 H TER 89469 WAT 4947 ATOM 89469 O WAT 4948 96.767 5.721 88.467 1.00 0.00 O ATOM 89470 H1 WAT 4948 96.970 6.060 89.339 1.00 0.00 H ATOM 89471 H2 WAT 4948 96.465 6.486 87.977 1.00 0.00 H TER 89473 WAT 4948 ATOM 89473 O WAT 4949 46.617 45.633 117.220 1.00 0.00 O ATOM 89474 H1 WAT 4949 46.042 46.164 116.668 1.00 0.00 H ATOM 89475 H2 WAT 4949 46.690 46.129 118.036 1.00 0.00 H TER 89477 WAT 4949 ATOM 89477 O WAT 4950 110.931 47.963 140.673 1.00 0.00 O ATOM 89478 H1 WAT 4950 110.103 48.440 140.621 1.00 0.00 H ATOM 89479 H2 WAT 4950 111.584 48.580 140.343 1.00 0.00 H TER 89481 WAT 4950 ATOM 89481 O WAT 4951 21.667 104.013 108.755 1.00 0.00 O ATOM 89482 H1 WAT 4951 22.278 103.570 109.344 1.00 0.00 H ATOM 89483 H2 WAT 4951 22.227 104.512 108.160 1.00 0.00 H TER 89485 WAT 4951 ATOM 89485 O WAT 4952 52.495 76.377 -0.068 1.00 0.00 O ATOM 89486 H1 WAT 4952 51.741 75.870 -0.371 1.00 0.00 H ATOM 89487 H2 WAT 4952 52.386 76.422 0.882 1.00 0.00 H TER 89489 WAT 4952 ATOM 89489 O WAT 4953 90.931 116.861 116.062 1.00 0.00 O ATOM 89490 H1 WAT 4953 91.005 117.687 116.542 1.00 0.00 H ATOM 89491 H2 WAT 4953 91.823 116.674 115.769 1.00 0.00 H TER 89493 WAT 4953 ATOM 89493 O WAT 4954 118.463 25.005 101.701 1.00 0.00 O ATOM 89494 H1 WAT 4954 117.813 24.526 101.187 1.00 0.00 H ATOM 89495 H2 WAT 4954 118.050 25.124 102.557 1.00 0.00 H TER 89497 WAT 4954 ATOM 89497 O WAT 4955 63.676 93.866 103.506 1.00 0.00 O ATOM 89498 H1 WAT 4955 63.310 93.005 103.303 1.00 0.00 H ATOM 89499 H2 WAT 4955 64.554 93.680 103.840 1.00 0.00 H TER 89501 WAT 4955 ATOM 89501 O WAT 4956 78.064 48.059 76.378 1.00 0.00 O ATOM 89502 H1 WAT 4956 77.153 48.081 76.085 1.00 0.00 H ATOM 89503 H2 WAT 4956 78.077 47.399 77.072 1.00 0.00 H TER 89505 WAT 4956 ATOM 89505 O WAT 4957 65.686 108.199 97.395 1.00 0.00 O ATOM 89506 H1 WAT 4957 65.959 108.493 98.264 1.00 0.00 H ATOM 89507 H2 WAT 4957 65.285 107.343 97.547 1.00 0.00 H TER 89509 WAT 4957 ATOM 89509 O WAT 4958 125.128 123.753 94.333 1.00 0.00 O ATOM 89510 H1 WAT 4958 124.559 123.011 94.537 1.00 0.00 H ATOM 89511 H2 WAT 4958 125.856 123.674 94.949 1.00 0.00 H TER 89513 WAT 4958 ATOM 89513 O WAT 4959 7.137 98.045 67.421 1.00 0.00 O ATOM 89514 H1 WAT 4959 7.354 97.163 67.119 1.00 0.00 H ATOM 89515 H2 WAT 4959 7.270 98.600 66.653 1.00 0.00 H TER 89517 WAT 4959 ATOM 89517 O WAT 4960 121.289 24.890 18.085 1.00 0.00 O ATOM 89518 H1 WAT 4960 121.290 25.515 18.810 1.00 0.00 H ATOM 89519 H2 WAT 4960 120.544 25.151 17.544 1.00 0.00 H TER 89521 WAT 4960 ATOM 89521 O WAT 4961 97.951 91.301 9.001 1.00 0.00 O ATOM 89522 H1 WAT 4961 97.757 90.517 8.487 1.00 0.00 H ATOM 89523 H2 WAT 4961 98.907 91.356 9.001 1.00 0.00 H TER 89525 WAT 4961 ATOM 89525 O WAT 4962 85.652 120.305 103.066 1.00 0.00 O ATOM 89526 H1 WAT 4962 86.565 120.228 102.790 1.00 0.00 H ATOM 89527 H2 WAT 4962 85.322 119.407 103.055 1.00 0.00 H TER 89529 WAT 4962 ATOM 89529 O WAT 4963 37.771 36.668 146.190 1.00 0.00 O ATOM 89530 H1 WAT 4963 36.837 36.474 146.110 1.00 0.00 H ATOM 89531 H2 WAT 4963 37.903 36.828 147.125 1.00 0.00 H TER 89533 WAT 4963 ATOM 89533 O WAT 4964 114.917 68.942 105.976 1.00 0.00 O ATOM 89534 H1 WAT 4964 115.292 69.659 106.486 1.00 0.00 H ATOM 89535 H2 WAT 4964 115.426 68.173 106.232 1.00 0.00 H TER 89537 WAT 4964 ATOM 89537 O WAT 4965 145.177 121.801 134.299 1.00 0.00 O ATOM 89538 H1 WAT 4965 144.624 121.631 133.537 1.00 0.00 H ATOM 89539 H2 WAT 4965 145.803 121.077 134.308 1.00 0.00 H TER 89541 WAT 4965 ATOM 89541 O WAT 4966 112.686 130.217 5.932 1.00 0.00 O ATOM 89542 H1 WAT 4966 112.845 131.121 5.659 1.00 0.00 H ATOM 89543 H2 WAT 4966 113.555 129.873 6.139 1.00 0.00 H TER 89545 WAT 4966 ATOM 89545 O WAT 4967 33.343 141.189 126.280 1.00 0.00 O ATOM 89546 H1 WAT 4967 33.996 141.514 125.661 1.00 0.00 H ATOM 89547 H2 WAT 4967 32.919 140.463 125.822 1.00 0.00 H TER 89549 WAT 4967 ATOM 89549 O WAT 4968 42.416 129.278 11.101 1.00 0.00 O ATOM 89550 H1 WAT 4968 41.805 129.300 11.838 1.00 0.00 H ATOM 89551 H2 WAT 4968 43.280 129.365 11.504 1.00 0.00 H TER 89553 WAT 4968 ATOM 89553 O WAT 4969 54.000 98.760 78.475 1.00 0.00 O ATOM 89554 H1 WAT 4969 54.640 99.261 77.969 1.00 0.00 H ATOM 89555 H2 WAT 4969 53.239 99.337 78.536 1.00 0.00 H TER 89557 WAT 4969 ATOM 89557 O WAT 4970 71.262 26.345 23.388 1.00 0.00 O ATOM 89558 H1 WAT 4970 70.371 26.350 23.736 1.00 0.00 H ATOM 89559 H2 WAT 4970 71.255 25.658 22.722 1.00 0.00 H TER 89561 WAT 4970 ATOM 89561 O WAT 4971 52.498 14.930 104.285 1.00 0.00 O ATOM 89562 H1 WAT 4971 51.871 15.317 103.674 1.00 0.00 H ATOM 89563 H2 WAT 4971 53.243 14.681 103.738 1.00 0.00 H TER 89565 WAT 4971 ATOM 89565 O WAT 4972 90.981 37.411 132.386 1.00 0.00 O ATOM 89566 H1 WAT 4972 90.104 37.781 132.493 1.00 0.00 H ATOM 89567 H2 WAT 4972 91.567 38.166 132.438 1.00 0.00 H TER 89569 WAT 4972 ATOM 89569 O WAT 4973 143.328 60.024 146.170 1.00 0.00 O ATOM 89570 H1 WAT 4973 143.747 59.669 146.955 1.00 0.00 H ATOM 89571 H2 WAT 4973 143.705 59.520 145.449 1.00 0.00 H TER 89573 WAT 4973 ATOM 89573 O WAT 4974 92.784 51.487 2.931 1.00 0.00 O ATOM 89574 H1 WAT 4974 92.080 51.256 2.325 1.00 0.00 H ATOM 89575 H2 WAT 4974 93.556 51.590 2.375 1.00 0.00 H TER 89577 WAT 4974 ATOM 89577 O WAT 4975 37.266 137.174 2.225 1.00 0.00 O ATOM 89578 H1 WAT 4975 37.386 137.383 3.151 1.00 0.00 H ATOM 89579 H2 WAT 4975 37.168 136.222 2.205 1.00 0.00 H TER 89581 WAT 4975 ATOM 89581 O WAT 4976 96.681 42.004 120.702 1.00 0.00 O ATOM 89582 H1 WAT 4976 96.751 42.948 120.563 1.00 0.00 H ATOM 89583 H2 WAT 4976 97.107 41.853 121.545 1.00 0.00 H TER 89585 WAT 4976 ATOM 89585 O WAT 4977 136.931 73.643 138.824 1.00 0.00 O ATOM 89586 H1 WAT 4977 137.114 74.474 138.384 1.00 0.00 H ATOM 89587 H2 WAT 4977 136.990 72.987 138.130 1.00 0.00 H TER 89589 WAT 4977 ATOM 89589 O WAT 4978 110.415 130.612 125.745 1.00 0.00 O ATOM 89590 H1 WAT 4978 109.848 131.072 125.125 1.00 0.00 H ATOM 89591 H2 WAT 4978 109.933 129.814 125.963 1.00 0.00 H TER 89593 WAT 4978 ATOM 89593 O WAT 4979 79.977 54.392 84.492 1.00 0.00 O ATOM 89594 H1 WAT 4979 80.917 54.413 84.311 1.00 0.00 H ATOM 89595 H2 WAT 4979 79.818 53.510 84.829 1.00 0.00 H TER 89597 WAT 4979 ATOM 89597 O WAT 4980 103.779 72.706 143.630 1.00 0.00 O ATOM 89598 H1 WAT 4980 103.963 71.774 143.518 1.00 0.00 H ATOM 89599 H2 WAT 4980 104.624 73.135 143.494 1.00 0.00 H TER 89601 WAT 4980 ATOM 89601 O WAT 4981 115.893 108.874 75.872 1.00 0.00 O ATOM 89602 H1 WAT 4981 115.575 108.095 76.330 1.00 0.00 H ATOM 89603 H2 WAT 4981 115.698 108.705 74.950 1.00 0.00 H TER 89605 WAT 4981 ATOM 89605 O WAT 4982 35.500 54.655 79.829 1.00 0.00 O ATOM 89606 H1 WAT 4982 36.305 55.170 79.771 1.00 0.00 H ATOM 89607 H2 WAT 4982 35.518 54.094 79.054 1.00 0.00 H TER 89609 WAT 4982 ATOM 89609 O WAT 4983 3.438 41.586 60.360 1.00 0.00 O ATOM 89610 H1 WAT 4983 3.666 40.903 60.990 1.00 0.00 H ATOM 89611 H2 WAT 4983 4.002 41.414 59.606 1.00 0.00 H TER 89613 WAT 4983 ATOM 89613 O WAT 4984 82.960 18.918 24.612 1.00 0.00 O ATOM 89614 H1 WAT 4984 82.027 18.942 24.826 1.00 0.00 H ATOM 89615 H2 WAT 4984 83.095 19.677 24.044 1.00 0.00 H TER 89617 WAT 4984 ATOM 89617 O WAT 4985 47.116 54.182 124.828 1.00 0.00 O ATOM 89618 H1 WAT 4985 47.701 54.662 125.414 1.00 0.00 H ATOM 89619 H2 WAT 4985 46.496 53.746 125.412 1.00 0.00 H TER 89621 WAT 4985 ATOM 89621 O WAT 4986 90.745 91.224 79.484 1.00 0.00 O ATOM 89622 H1 WAT 4986 91.566 91.104 79.961 1.00 0.00 H ATOM 89623 H2 WAT 4986 90.064 91.129 80.150 1.00 0.00 H TER 89625 WAT 4986 ATOM 89625 O WAT 4987 60.930 62.835 135.188 1.00 0.00 O ATOM 89626 H1 WAT 4987 60.656 62.528 136.052 1.00 0.00 H ATOM 89627 H2 WAT 4987 60.122 63.138 134.774 1.00 0.00 H TER 89629 WAT 4987 ATOM 89629 O WAT 4988 103.307 16.540 80.617 1.00 0.00 O ATOM 89630 H1 WAT 4988 104.030 16.520 81.245 1.00 0.00 H ATOM 89631 H2 WAT 4988 103.704 16.279 79.786 1.00 0.00 H TER 89633 WAT 4988 ATOM 89633 O WAT 4989 37.007 132.086 5.536 1.00 0.00 O ATOM 89634 H1 WAT 4989 36.055 132.179 5.564 1.00 0.00 H ATOM 89635 H2 WAT 4989 37.295 132.757 4.917 1.00 0.00 H TER 89637 WAT 4989 ATOM 89637 O WAT 4990 90.066 31.582 157.424 1.00 0.00 O ATOM 89638 H1 WAT 4990 90.550 31.883 158.193 1.00 0.00 H ATOM 89639 H2 WAT 4990 89.844 32.384 156.951 1.00 0.00 H TER 89641 WAT 4990 ATOM 89641 O WAT 4991 28.744 56.254 119.380 1.00 0.00 O ATOM 89642 H1 WAT 4991 28.906 55.335 119.166 1.00 0.00 H ATOM 89643 H2 WAT 4991 27.872 56.258 119.774 1.00 0.00 H TER 89645 WAT 4991 ATOM 89645 O WAT 4992 52.228 135.625 51.308 1.00 0.00 O ATOM 89646 H1 WAT 4992 51.590 135.148 50.778 1.00 0.00 H ATOM 89647 H2 WAT 4992 53.077 135.370 50.948 1.00 0.00 H TER 89649 WAT 4992 ATOM 89649 O WAT 4993 92.567 98.206 74.843 1.00 0.00 O ATOM 89650 H1 WAT 4993 92.685 97.819 75.710 1.00 0.00 H ATOM 89651 H2 WAT 4993 92.013 98.971 74.995 1.00 0.00 H TER 89653 WAT 4993 ATOM 89653 O WAT 4994 32.631 103.538 22.301 1.00 0.00 O ATOM 89654 H1 WAT 4994 32.234 103.083 23.043 1.00 0.00 H ATOM 89655 H2 WAT 4994 33.567 103.350 22.378 1.00 0.00 H TER 89657 WAT 4994 ATOM 89657 O WAT 4995 136.147 33.164 141.223 1.00 0.00 O ATOM 89658 H1 WAT 4995 135.404 33.764 141.160 1.00 0.00 H ATOM 89659 H2 WAT 4995 136.610 33.438 142.014 1.00 0.00 H TER 89661 WAT 4995 ATOM 89661 O WAT 4996 81.262 71.587 0.321 1.00 0.00 O ATOM 89662 H1 WAT 4996 81.703 72.314 -0.120 1.00 0.00 H ATOM 89663 H2 WAT 4996 80.958 71.958 1.149 1.00 0.00 H TER 89665 WAT 4996 ATOM 89665 O WAT 4997 52.067 126.532 141.203 1.00 0.00 O ATOM 89666 H1 WAT 4997 51.624 126.168 140.437 1.00 0.00 H ATOM 89667 H2 WAT 4997 51.632 126.120 141.949 1.00 0.00 H TER 89669 WAT 4997 ATOM 89669 O WAT 4998 22.938 79.155 26.062 1.00 0.00 O ATOM 89670 H1 WAT 4998 22.629 80.060 26.017 1.00 0.00 H ATOM 89671 H2 WAT 4998 23.528 79.066 25.314 1.00 0.00 H TER 89673 WAT 4998 ATOM 89673 O WAT 4999 139.112 69.516 20.026 1.00 0.00 O ATOM 89674 H1 WAT 4999 139.544 68.772 20.445 1.00 0.00 H ATOM 89675 H2 WAT 4999 139.801 69.932 19.507 1.00 0.00 H TER 89677 WAT 4999 ATOM 89677 O WAT 5000 69.250 122.173 107.125 1.00 0.00 O ATOM 89678 H1 WAT 5000 69.286 121.790 108.001 1.00 0.00 H ATOM 89679 H2 WAT 5000 68.315 122.254 106.938 1.00 0.00 H TER 89681 WAT 5000 ATOM 89681 O WAT 5001 104.637 23.684 115.590 1.00 0.00 O ATOM 89682 H1 WAT 5001 105.515 23.355 115.783 1.00 0.00 H ATOM 89683 H2 WAT 5001 104.734 24.153 114.761 1.00 0.00 H TER 89685 WAT 5001 ATOM 89685 O WAT 5002 25.070 57.216 61.792 1.00 0.00 O ATOM 89686 H1 WAT 5002 24.571 57.491 61.023 1.00 0.00 H ATOM 89687 H2 WAT 5002 24.466 56.660 62.283 1.00 0.00 H TER 89689 WAT 5002 ATOM 89689 O WAT 5003 43.160 47.945 150.160 1.00 0.00 O ATOM 89690 H1 WAT 5003 43.341 47.124 150.617 1.00 0.00 H ATOM 89691 H2 WAT 5003 43.928 48.086 149.607 1.00 0.00 H TER 89693 WAT 5003 ATOM 89693 O WAT 5004 100.438 140.865 97.876 1.00 0.00 O ATOM 89694 H1 WAT 5004 100.218 141.639 98.394 1.00 0.00 H ATOM 89695 H2 WAT 5004 101.393 140.820 97.906 1.00 0.00 H TER 89697 WAT 5004 ATOM 89697 O WAT 5005 66.263 52.564 80.006 1.00 0.00 O ATOM 89698 H1 WAT 5005 66.350 52.172 80.875 1.00 0.00 H ATOM 89699 H2 WAT 5005 65.804 51.902 79.489 1.00 0.00 H TER 89701 WAT 5005 ATOM 89701 O WAT 5006 56.573 50.459 72.901 1.00 0.00 O ATOM 89702 H1 WAT 5006 57.077 49.877 73.470 1.00 0.00 H ATOM 89703 H2 WAT 5006 56.202 51.112 73.494 1.00 0.00 H TER 89705 WAT 5006 ATOM 89705 O WAT 5007 66.106 83.352 3.301 1.00 0.00 O ATOM 89706 H1 WAT 5007 65.443 83.934 2.929 1.00 0.00 H ATOM 89707 H2 WAT 5007 66.523 82.947 2.541 1.00 0.00 H TER 89709 WAT 5007 ATOM 89709 O WAT 5008 109.774 119.200 3.080 1.00 0.00 O ATOM 89710 H1 WAT 5008 109.685 118.817 3.953 1.00 0.00 H ATOM 89711 H2 WAT 5008 108.926 119.045 2.663 1.00 0.00 H TER 89713 WAT 5008 ATOM 89713 O WAT 5009 115.494 120.388 105.060 1.00 0.00 O ATOM 89714 H1 WAT 5009 115.049 121.160 105.410 1.00 0.00 H ATOM 89715 H2 WAT 5009 116.274 120.737 104.628 1.00 0.00 H TER 89717 WAT 5009 ATOM 89717 O WAT 5010 127.299 91.692 138.314 1.00 0.00 O ATOM 89718 H1 WAT 5010 127.657 90.955 137.820 1.00 0.00 H ATOM 89719 H2 WAT 5010 127.104 92.353 137.651 1.00 0.00 H TER 89721 WAT 5010 ATOM 89721 O WAT 5011 77.181 139.869 80.414 1.00 0.00 O ATOM 89722 H1 WAT 5011 77.465 140.518 81.056 1.00 0.00 H ATOM 89723 H2 WAT 5011 76.982 139.089 80.933 1.00 0.00 H TER 89725 WAT 5011 ATOM 89725 O WAT 5012 49.878 8.681 8.452 1.00 0.00 O ATOM 89726 H1 WAT 5012 49.611 7.770 8.331 1.00 0.00 H ATOM 89727 H2 WAT 5012 49.117 9.193 8.178 1.00 0.00 H TER 89729 WAT 5012 ATOM 89729 O WAT 5013 109.166 80.103 120.261 1.00 0.00 O ATOM 89730 H1 WAT 5013 109.448 80.700 119.568 1.00 0.00 H ATOM 89731 H2 WAT 5013 109.920 79.532 120.407 1.00 0.00 H TER 89733 WAT 5013 ATOM 89733 O WAT 5014 122.166 125.628 135.435 1.00 0.00 O ATOM 89734 H1 WAT 5014 122.241 125.209 136.292 1.00 0.00 H ATOM 89735 H2 WAT 5014 121.231 125.804 135.335 1.00 0.00 H TER 89737 WAT 5014 ATOM 89737 O WAT 5015 23.806 110.103 18.331 1.00 0.00 O ATOM 89738 H1 WAT 5015 23.614 109.660 19.158 1.00 0.00 H ATOM 89739 H2 WAT 5015 24.759 110.064 18.254 1.00 0.00 H TER 89741 WAT 5015 ATOM 89741 O WAT 5016 123.098 53.800 148.856 1.00 0.00 O ATOM 89742 H1 WAT 5016 122.864 54.610 148.403 1.00 0.00 H ATOM 89743 H2 WAT 5016 123.582 54.090 149.629 1.00 0.00 H TER 89745 WAT 5016 ATOM 89745 O WAT 5017 42.088 56.698 26.551 1.00 0.00 O ATOM 89746 H1 WAT 5017 42.272 56.410 27.445 1.00 0.00 H ATOM 89747 H2 WAT 5017 41.790 57.603 26.648 1.00 0.00 H TER 89749 WAT 5017 ATOM 89749 O WAT 5018 143.166 45.987 97.087 1.00 0.00 O ATOM 89750 H1 WAT 5018 143.719 46.665 97.476 1.00 0.00 H ATOM 89751 H2 WAT 5018 143.179 45.273 97.724 1.00 0.00 H TER 89753 WAT 5018 ATOM 89753 O WAT 5019 76.374 130.838 121.815 1.00 0.00 O ATOM 89754 H1 WAT 5019 76.705 131.245 122.615 1.00 0.00 H ATOM 89755 H2 WAT 5019 76.523 129.901 121.943 1.00 0.00 H TER 89757 WAT 5019 ATOM 89757 O WAT 5020 69.330 83.617 156.954 1.00 0.00 O ATOM 89758 H1 WAT 5020 68.887 84.043 156.220 1.00 0.00 H ATOM 89759 H2 WAT 5020 69.520 84.329 157.565 1.00 0.00 H TER 89761 WAT 5020 ATOM 89761 O WAT 5021 70.092 49.059 0.547 1.00 0.00 O ATOM 89762 H1 WAT 5021 70.069 48.965 1.499 1.00 0.00 H ATOM 89763 H2 WAT 5021 69.248 49.451 0.325 1.00 0.00 H TER 89765 WAT 5021 ATOM 89765 O WAT 5022 46.230 27.290 98.044 1.00 0.00 O ATOM 89766 H1 WAT 5022 47.010 26.944 97.610 1.00 0.00 H ATOM 89767 H2 WAT 5022 46.224 28.220 97.818 1.00 0.00 H TER 89769 WAT 5022 ATOM 89769 O WAT 5023 117.218 102.622 16.475 1.00 0.00 O ATOM 89770 H1 WAT 5023 117.521 102.991 17.304 1.00 0.00 H ATOM 89771 H2 WAT 5023 117.719 101.813 16.375 1.00 0.00 H TER 89773 WAT 5023 ATOM 89773 O WAT 5024 67.272 140.368 122.420 1.00 0.00 O ATOM 89774 H1 WAT 5024 67.337 139.519 122.858 1.00 0.00 H ATOM 89775 H2 WAT 5024 68.170 140.571 122.156 1.00 0.00 H TER 89777 WAT 5024 ATOM 89777 O WAT 5025 129.338 42.743 77.130 1.00 0.00 O ATOM 89778 H1 WAT 5025 129.914 43.435 76.806 1.00 0.00 H ATOM 89779 H2 WAT 5025 129.194 42.176 76.372 1.00 0.00 H TER 89781 WAT 5025 ATOM 89781 O WAT 5026 100.665 108.586 82.797 1.00 0.00 O ATOM 89782 H1 WAT 5026 101.264 107.857 82.957 1.00 0.00 H ATOM 89783 H2 WAT 5026 99.901 108.183 82.387 1.00 0.00 H TER 89785 WAT 5026 ATOM 89785 O WAT 5027 64.763 34.328 140.822 1.00 0.00 O ATOM 89786 H1 WAT 5027 64.340 33.516 141.100 1.00 0.00 H ATOM 89787 H2 WAT 5027 65.036 34.748 141.637 1.00 0.00 H TER 89789 WAT 5027 ATOM 89789 O WAT 5028 138.288 67.198 114.793 1.00 0.00 O ATOM 89790 H1 WAT 5028 138.074 67.678 113.993 1.00 0.00 H ATOM 89791 H2 WAT 5028 138.313 66.280 114.523 1.00 0.00 H TER 89793 WAT 5028 ATOM 89793 O WAT 5029 96.369 112.491 142.127 1.00 0.00 O ATOM 89794 H1 WAT 5029 95.747 111.871 141.749 1.00 0.00 H ATOM 89795 H2 WAT 5029 96.593 112.117 142.979 1.00 0.00 H TER 89797 WAT 5029 ATOM 89797 O WAT 5030 81.201 22.183 15.662 1.00 0.00 O ATOM 89798 H1 WAT 5030 82.121 22.248 15.406 1.00 0.00 H ATOM 89799 H2 WAT 5030 81.045 22.964 16.193 1.00 0.00 H TER 89801 WAT 5030 ATOM 89801 O WAT 5031 124.780 82.100 103.261 1.00 0.00 O ATOM 89802 H1 WAT 5031 124.024 82.174 102.678 1.00 0.00 H ATOM 89803 H2 WAT 5031 125.530 82.023 102.671 1.00 0.00 H TER 89805 WAT 5031 ATOM 89805 O WAT 5032 83.939 143.113 81.323 1.00 0.00 O ATOM 89806 H1 WAT 5032 83.190 143.478 80.851 1.00 0.00 H ATOM 89807 H2 WAT 5032 84.440 143.879 81.605 1.00 0.00 H TER 89809 WAT 5032 ATOM 89809 O WAT 5033 28.457 29.000 74.413 1.00 0.00 O ATOM 89810 H1 WAT 5033 29.096 29.543 73.952 1.00 0.00 H ATOM 89811 H2 WAT 5033 27.674 29.548 74.470 1.00 0.00 H TER 89813 WAT 5033 ATOM 89813 O WAT 5034 54.506 31.561 147.884 1.00 0.00 O ATOM 89814 H1 WAT 5034 53.582 31.779 148.011 1.00 0.00 H ATOM 89815 H2 WAT 5034 54.499 30.654 147.581 1.00 0.00 H TER 89817 WAT 5034 ATOM 89817 O WAT 5035 109.504 15.140 76.620 1.00 0.00 O ATOM 89818 H1 WAT 5035 109.603 15.225 77.568 1.00 0.00 H ATOM 89819 H2 WAT 5035 110.351 14.809 76.319 1.00 0.00 H TER 89821 WAT 5035 ATOM 89821 O WAT 5036 21.351 78.061 94.346 1.00 0.00 O ATOM 89822 H1 WAT 5036 21.746 78.564 93.633 1.00 0.00 H ATOM 89823 H2 WAT 5036 21.230 78.698 95.050 1.00 0.00 H TER 89825 WAT 5036 ATOM 89825 O WAT 5037 120.230 74.068 105.373 1.00 0.00 O ATOM 89826 H1 WAT 5037 120.721 74.818 105.039 1.00 0.00 H ATOM 89827 H2 WAT 5037 120.253 74.171 106.325 1.00 0.00 H TER 89829 WAT 5037 ATOM 89829 O WAT 5038 43.408 0.105 157.135 1.00 0.00 O ATOM 89830 H1 WAT 5038 43.635 -0.412 156.361 1.00 0.00 H ATOM 89831 H2 WAT 5038 42.934 0.861 156.787 1.00 0.00 H TER 89833 WAT 5038 ATOM 89833 O WAT 5039 79.506 53.777 143.631 1.00 0.00 O ATOM 89834 H1 WAT 5039 79.141 54.575 143.249 1.00 0.00 H ATOM 89835 H2 WAT 5039 79.025 53.662 144.450 1.00 0.00 H TER 89837 WAT 5039 ATOM 89837 O WAT 5040 145.180 50.385 118.828 1.00 0.00 O ATOM 89838 H1 WAT 5040 145.183 50.432 119.784 1.00 0.00 H ATOM 89839 H2 WAT 5040 144.253 50.371 118.592 1.00 0.00 H TER 89841 WAT 5040 ATOM 89841 O WAT 5041 23.481 9.483 103.446 1.00 0.00 O ATOM 89842 H1 WAT 5041 24.382 9.668 103.181 1.00 0.00 H ATOM 89843 H2 WAT 5041 23.001 10.285 103.242 1.00 0.00 H TER 89845 WAT 5041 ATOM 89845 O WAT 5042 119.107 143.895 22.378 1.00 0.00 O ATOM 89846 H1 WAT 5042 120.057 143.861 22.495 1.00 0.00 H ATOM 89847 H2 WAT 5042 118.754 143.832 23.266 1.00 0.00 H TER 89849 WAT 5042 ATOM 89849 O WAT 5043 28.989 47.784 75.436 1.00 0.00 O ATOM 89850 H1 WAT 5043 29.354 47.056 75.939 1.00 0.00 H ATOM 89851 H2 WAT 5043 29.671 48.455 75.455 1.00 0.00 H TER 89853 WAT 5043 ATOM 89853 O WAT 5044 139.859 62.005 12.747 1.00 0.00 O ATOM 89854 H1 WAT 5044 139.817 61.181 12.262 1.00 0.00 H ATOM 89855 H2 WAT 5044 139.537 61.785 13.621 1.00 0.00 H TER 89857 WAT 5044 ATOM 89857 O WAT 5045 126.604 134.119 100.935 1.00 0.00 O ATOM 89858 H1 WAT 5045 126.305 133.842 100.069 1.00 0.00 H ATOM 89859 H2 WAT 5045 127.368 134.668 100.761 1.00 0.00 H TER 89861 WAT 5045 ATOM 89861 O WAT 5046 84.177 64.905 94.093 1.00 0.00 O ATOM 89862 H1 WAT 5046 84.584 64.600 93.281 1.00 0.00 H ATOM 89863 H2 WAT 5046 83.266 65.077 93.854 1.00 0.00 H TER 89865 WAT 5046 ATOM 89865 O WAT 5047 81.012 69.881 155.953 1.00 0.00 O ATOM 89866 H1 WAT 5047 80.126 70.240 155.910 1.00 0.00 H ATOM 89867 H2 WAT 5047 81.584 70.647 155.903 1.00 0.00 H TER 89869 WAT 5047 ATOM 89869 O WAT 5048 88.201 1.947 84.259 1.00 0.00 O ATOM 89870 H1 WAT 5048 88.311 2.638 83.606 1.00 0.00 H ATOM 89871 H2 WAT 5048 88.484 1.149 83.812 1.00 0.00 H TER 89873 WAT 5048 ATOM 89873 O WAT 5049 22.698 13.524 7.323 1.00 0.00 O ATOM 89874 H1 WAT 5049 23.591 13.530 7.666 1.00 0.00 H ATOM 89875 H2 WAT 5049 22.350 12.669 7.575 1.00 0.00 H TER 89877 WAT 5049 ATOM 89877 O WAT 5050 67.018 103.920 91.585 1.00 0.00 O ATOM 89878 H1 WAT 5050 67.360 103.085 91.267 1.00 0.00 H ATOM 89879 H2 WAT 5050 66.091 103.907 91.344 1.00 0.00 H TER 89881 WAT 5050 ATOM 89881 O WAT 5051 19.546 5.871 16.484 1.00 0.00 O ATOM 89882 H1 WAT 5051 18.802 5.392 16.120 1.00 0.00 H ATOM 89883 H2 WAT 5051 20.096 6.072 15.727 1.00 0.00 H TER 89885 WAT 5051 ATOM 89885 O WAT 5052 136.759 29.005 133.715 1.00 0.00 O ATOM 89886 H1 WAT 5052 137.385 28.368 133.370 1.00 0.00 H ATOM 89887 H2 WAT 5052 137.283 29.578 134.274 1.00 0.00 H TER 89889 WAT 5052 ATOM 89889 O WAT 5053 19.623 84.753 132.273 1.00 0.00 O ATOM 89890 H1 WAT 5053 18.931 84.100 132.383 1.00 0.00 H ATOM 89891 H2 WAT 5053 20.273 84.527 132.938 1.00 0.00 H TER 89893 WAT 5053 ATOM 89893 O WAT 5054 53.423 85.595 100.562 1.00 0.00 O ATOM 89894 H1 WAT 5054 52.495 85.521 100.787 1.00 0.00 H ATOM 89895 H2 WAT 5054 53.522 85.058 99.776 1.00 0.00 H TER 89897 WAT 5054 ATOM 89897 O WAT 5055 114.590 121.315 107.685 1.00 0.00 O ATOM 89898 H1 WAT 5055 115.448 121.737 107.658 1.00 0.00 H ATOM 89899 H2 WAT 5055 114.784 120.382 107.778 1.00 0.00 H TER 89901 WAT 5055 ATOM 89901 O WAT 5056 58.323 107.338 79.314 1.00 0.00 O ATOM 89902 H1 WAT 5056 57.995 107.352 80.213 1.00 0.00 H ATOM 89903 H2 WAT 5056 58.785 108.170 79.214 1.00 0.00 H TER 89905 WAT 5056 ATOM 89905 O WAT 5057 97.509 123.986 68.314 1.00 0.00 O ATOM 89906 H1 WAT 5057 97.228 123.565 69.127 1.00 0.00 H ATOM 89907 H2 WAT 5057 96.718 124.018 67.776 1.00 0.00 H TER 89909 WAT 5057 ATOM 89909 O WAT 5058 12.070 139.041 83.753 1.00 0.00 O ATOM 89910 H1 WAT 5058 12.621 138.325 83.439 1.00 0.00 H ATOM 89911 H2 WAT 5058 12.686 139.745 83.956 1.00 0.00 H TER 89913 WAT 5058 ATOM 89913 O WAT 5059 103.279 70.071 22.883 1.00 0.00 O ATOM 89914 H1 WAT 5059 103.220 69.552 22.081 1.00 0.00 H ATOM 89915 H2 WAT 5059 102.390 70.069 23.237 1.00 0.00 H TER 89917 WAT 5059 ATOM 89917 O WAT 5060 136.259 42.463 70.343 1.00 0.00 O ATOM 89918 H1 WAT 5060 137.151 42.408 69.999 1.00 0.00 H ATOM 89919 H2 WAT 5060 135.700 42.264 69.591 1.00 0.00 H TER 89921 WAT 5060 ATOM 89921 O WAT 5061 109.736 102.174 98.038 1.00 0.00 O ATOM 89922 H1 WAT 5061 110.106 103.044 98.185 1.00 0.00 H ATOM 89923 H2 WAT 5061 110.332 101.763 97.411 1.00 0.00 H TER 89925 WAT 5061 ATOM 89925 O WAT 5062 107.843 57.360 132.735 1.00 0.00 O ATOM 89926 H1 WAT 5062 107.505 56.465 132.776 1.00 0.00 H ATOM 89927 H2 WAT 5062 107.861 57.566 131.801 1.00 0.00 H TER 89929 WAT 5062 ATOM 89929 O WAT 5063 44.383 35.812 21.249 1.00 0.00 O ATOM 89930 H1 WAT 5063 44.982 35.791 21.995 1.00 0.00 H ATOM 89931 H2 WAT 5063 43.653 35.252 21.512 1.00 0.00 H TER 89933 WAT 5063 ATOM 89933 O WAT 5064 102.519 59.766 103.244 1.00 0.00 O ATOM 89934 H1 WAT 5064 102.776 59.872 102.328 1.00 0.00 H ATOM 89935 H2 WAT 5064 102.621 60.638 103.625 1.00 0.00 H TER 89937 WAT 5064 ATOM 89937 O WAT 5065 83.935 78.102 91.752 1.00 0.00 O ATOM 89938 H1 WAT 5065 84.053 78.957 92.167 1.00 0.00 H ATOM 89939 H2 WAT 5065 84.276 78.218 90.865 1.00 0.00 H TER 89941 WAT 5065 ATOM 89941 O WAT 5066 24.049 57.161 123.426 1.00 0.00 O ATOM 89942 H1 WAT 5066 24.232 56.285 123.088 1.00 0.00 H ATOM 89943 H2 WAT 5066 23.294 57.042 124.003 1.00 0.00 H TER 89945 WAT 5066 ATOM 89945 O WAT 5067 15.886 55.208 82.771 1.00 0.00 O ATOM 89946 H1 WAT 5067 16.490 54.782 83.379 1.00 0.00 H ATOM 89947 H2 WAT 5067 15.027 55.117 83.182 1.00 0.00 H TER 89949 WAT 5067 ATOM 89949 O WAT 5068 118.156 110.498 75.390 1.00 0.00 O ATOM 89950 H1 WAT 5068 117.474 109.907 75.708 1.00 0.00 H ATOM 89951 H2 WAT 5068 118.143 111.231 76.005 1.00 0.00 H TER 89953 WAT 5068 ATOM 89953 O WAT 5069 61.678 89.656 63.627 1.00 0.00 O ATOM 89954 H1 WAT 5069 61.902 90.324 62.979 1.00 0.00 H ATOM 89955 H2 WAT 5069 62.380 89.706 64.275 1.00 0.00 H TER 89957 WAT 5069 ATOM 89957 O WAT 5070 112.589 29.908 87.300 1.00 0.00 O ATOM 89958 H1 WAT 5070 112.060 29.936 88.097 1.00 0.00 H ATOM 89959 H2 WAT 5070 113.494 29.915 87.613 1.00 0.00 H TER 89961 WAT 5070 ATOM 89961 O WAT 5071 122.712 138.015 76.056 1.00 0.00 O ATOM 89962 H1 WAT 5071 123.183 137.246 75.736 1.00 0.00 H ATOM 89963 H2 WAT 5071 121.990 138.129 75.438 1.00 0.00 H TER 89965 WAT 5071 ATOM 89965 O WAT 5072 31.388 115.599 132.089 1.00 0.00 O ATOM 89966 H1 WAT 5072 31.381 115.420 133.029 1.00 0.00 H ATOM 89967 H2 WAT 5072 32.086 116.244 131.974 1.00 0.00 H TER 89969 WAT 5072 ATOM 89969 O WAT 5073 84.509 83.925 8.602 1.00 0.00 O ATOM 89970 H1 WAT 5073 85.199 83.505 8.088 1.00 0.00 H ATOM 89971 H2 WAT 5073 84.313 83.297 9.297 1.00 0.00 H TER 89973 WAT 5073 ATOM 89973 O WAT 5074 67.887 59.581 149.637 1.00 0.00 O ATOM 89974 H1 WAT 5074 68.374 59.344 150.427 1.00 0.00 H ATOM 89975 H2 WAT 5074 66.973 59.612 149.920 1.00 0.00 H TER 89977 WAT 5074 ATOM 89977 O WAT 5075 78.642 73.924 113.830 1.00 0.00 O ATOM 89978 H1 WAT 5075 79.168 74.722 113.792 1.00 0.00 H ATOM 89979 H2 WAT 5075 78.232 73.866 112.967 1.00 0.00 H TER 89981 WAT 5075 ATOM 89981 O WAT 5076 -0.080 53.373 99.174 1.00 0.00 O ATOM 89982 H1 WAT 5076 0.500 54.028 98.786 1.00 0.00 H ATOM 89983 H2 WAT 5076 0.504 52.804 99.676 1.00 0.00 H TER 89985 WAT 5076 ATOM 89985 O WAT 5077 92.496 71.939 4.449 1.00 0.00 O ATOM 89986 H1 WAT 5077 92.136 72.164 5.307 1.00 0.00 H ATOM 89987 H2 WAT 5077 91.728 71.830 3.888 1.00 0.00 H TER 89989 WAT 5077 ATOM 89989 O WAT 5078 88.250 3.816 6.715 1.00 0.00 O ATOM 89990 H1 WAT 5078 88.489 4.588 6.202 1.00 0.00 H ATOM 89991 H2 WAT 5078 88.074 4.156 7.592 1.00 0.00 H TER 89993 WAT 5078 ATOM 89993 O WAT 5079 88.444 74.270 139.019 1.00 0.00 O ATOM 89994 H1 WAT 5079 89.033 74.851 138.538 1.00 0.00 H ATOM 89995 H2 WAT 5079 87.598 74.717 139.002 1.00 0.00 H TER 89997 WAT 5079 ATOM 89997 O WAT 5080 69.055 19.413 119.445 1.00 0.00 O ATOM 89998 H1 WAT 5080 69.879 18.927 119.411 1.00 0.00 H ATOM 89999 H2 WAT 5080 68.877 19.647 118.534 1.00 0.00 H TER 90001 WAT 5080 ATOM 90001 O WAT 5081 81.566 131.603 147.931 1.00 0.00 O ATOM 90002 H1 WAT 5081 81.748 131.169 148.764 1.00 0.00 H ATOM 90003 H2 WAT 5081 80.674 131.336 147.712 1.00 0.00 H TER 90005 WAT 5081 ATOM 90005 O WAT 5082 108.268 60.936 130.312 1.00 0.00 O ATOM 90006 H1 WAT 5082 108.075 61.385 131.134 1.00 0.00 H ATOM 90007 H2 WAT 5082 108.850 61.534 129.843 1.00 0.00 H TER 90009 WAT 5082 ATOM 90009 O WAT 5083 26.570 111.383 15.201 1.00 0.00 O ATOM 90010 H1 WAT 5083 26.596 112.322 15.385 1.00 0.00 H ATOM 90011 H2 WAT 5083 27.485 111.105 15.247 1.00 0.00 H TER 90013 WAT 5083 ATOM 90013 O WAT 5084 107.391 94.474 83.765 1.00 0.00 O ATOM 90014 H1 WAT 5084 108.059 93.796 83.663 1.00 0.00 H ATOM 90015 H2 WAT 5084 107.778 95.100 84.377 1.00 0.00 H TER 90017 WAT 5084 ATOM 90017 O WAT 5085 88.784 83.297 97.016 1.00 0.00 O ATOM 90018 H1 WAT 5085 87.908 83.326 97.401 1.00 0.00 H ATOM 90019 H2 WAT 5085 89.377 83.323 97.767 1.00 0.00 H TER 90021 WAT 5085 ATOM 90021 O WAT 5086 75.656 117.465 128.805 1.00 0.00 O ATOM 90022 H1 WAT 5086 76.109 118.294 128.958 1.00 0.00 H ATOM 90023 H2 WAT 5086 74.851 117.533 129.319 1.00 0.00 H TER 90025 WAT 5086 ATOM 90025 O WAT 5087 75.835 21.050 77.489 1.00 0.00 O ATOM 90026 H1 WAT 5087 76.419 21.804 77.574 1.00 0.00 H ATOM 90027 H2 WAT 5087 75.428 21.159 76.629 1.00 0.00 H TER 90029 WAT 5087 ATOM 90029 O WAT 5088 136.176 29.617 157.704 1.00 0.00 O ATOM 90030 H1 WAT 5088 136.209 30.510 158.047 1.00 0.00 H ATOM 90031 H2 WAT 5088 136.320 29.061 158.471 1.00 0.00 H TER 90033 WAT 5088 ATOM 90033 O WAT 5089 90.598 75.945 14.443 1.00 0.00 O ATOM 90034 H1 WAT 5089 91.150 75.252 14.805 1.00 0.00 H ATOM 90035 H2 WAT 5089 91.189 76.692 14.341 1.00 0.00 H TER 90037 WAT 5089 ATOM 90037 O WAT 5090 92.188 53.943 19.344 1.00 0.00 O ATOM 90038 H1 WAT 5090 92.591 53.542 18.574 1.00 0.00 H ATOM 90039 H2 WAT 5090 92.924 54.298 19.843 1.00 0.00 H TER 90041 WAT 5090 ATOM 90041 O WAT 5091 46.858 81.802 3.292 1.00 0.00 O ATOM 90042 H1 WAT 5091 47.600 81.855 3.894 1.00 0.00 H ATOM 90043 H2 WAT 5091 46.615 82.714 3.131 1.00 0.00 H TER 90045 WAT 5091 ATOM 90045 O WAT 5092 97.049 30.586 121.386 1.00 0.00 O ATOM 90046 H1 WAT 5092 97.259 31.364 121.903 1.00 0.00 H ATOM 90047 H2 WAT 5092 96.096 30.511 121.444 1.00 0.00 H TER 90049 WAT 5092 ATOM 90049 O WAT 5093 107.063 134.623 76.824 1.00 0.00 O ATOM 90050 H1 WAT 5093 106.346 133.990 76.850 1.00 0.00 H ATOM 90051 H2 WAT 5093 106.911 135.189 77.582 1.00 0.00 H TER 90053 WAT 5093 ATOM 90053 O WAT 5094 130.955 136.362 57.204 1.00 0.00 O ATOM 90054 H1 WAT 5094 130.767 136.048 56.319 1.00 0.00 H ATOM 90055 H2 WAT 5094 130.343 137.087 57.336 1.00 0.00 H TER 90057 WAT 5094 ATOM 90057 O WAT 5095 78.483 115.357 131.623 1.00 0.00 O ATOM 90058 H1 WAT 5095 78.077 116.185 131.880 1.00 0.00 H ATOM 90059 H2 WAT 5095 77.767 114.847 131.244 1.00 0.00 H TER 90061 WAT 5095 ATOM 90061 O WAT 5096 36.412 127.389 77.748 1.00 0.00 O ATOM 90062 H1 WAT 5096 36.731 127.135 78.614 1.00 0.00 H ATOM 90063 H2 WAT 5096 35.890 126.641 77.456 1.00 0.00 H TER 90065 WAT 5096 ATOM 90065 O WAT 5097 66.480 21.125 10.435 1.00 0.00 O ATOM 90066 H1 WAT 5097 66.589 21.233 9.490 1.00 0.00 H ATOM 90067 H2 WAT 5097 67.099 20.434 10.670 1.00 0.00 H TER 90069 WAT 5097 ATOM 90069 O WAT 5098 27.841 113.899 2.074 1.00 0.00 O ATOM 90070 H1 WAT 5098 27.188 113.240 2.311 1.00 0.00 H ATOM 90071 H2 WAT 5098 27.332 114.695 1.918 1.00 0.00 H TER 90073 WAT 5098 ATOM 90073 O WAT 5099 75.436 48.108 79.805 1.00 0.00 O ATOM 90074 H1 WAT 5099 75.033 47.371 79.347 1.00 0.00 H ATOM 90075 H2 WAT 5099 76.026 48.497 79.160 1.00 0.00 H TER 90077 WAT 5099 ATOM 90077 O WAT 5100 74.777 52.420 86.788 1.00 0.00 O ATOM 90078 H1 WAT 5100 73.909 52.034 86.906 1.00 0.00 H ATOM 90079 H2 WAT 5100 75.214 52.289 87.630 1.00 0.00 H TER 90081 WAT 5100 ATOM 90081 O WAT 5101 40.378 79.725 96.321 1.00 0.00 O ATOM 90082 H1 WAT 5101 40.013 80.143 97.101 1.00 0.00 H ATOM 90083 H2 WAT 5101 39.864 80.080 95.596 1.00 0.00 H TER 90085 WAT 5101 ATOM 90085 O WAT 5102 23.250 87.464 74.164 1.00 0.00 O ATOM 90086 H1 WAT 5102 23.108 86.645 74.637 1.00 0.00 H ATOM 90087 H2 WAT 5102 22.455 87.580 73.643 1.00 0.00 H TER 90089 WAT 5102 ATOM 90089 O WAT 5103 6.773 135.930 151.861 1.00 0.00 O ATOM 90090 H1 WAT 5103 6.406 135.370 152.545 1.00 0.00 H ATOM 90091 H2 WAT 5103 7.714 135.937 152.035 1.00 0.00 H TER 90093 WAT 5103 ATOM 90093 O WAT 5104 20.384 59.685 72.095 1.00 0.00 O ATOM 90094 H1 WAT 5104 20.758 59.995 71.270 1.00 0.00 H ATOM 90095 H2 WAT 5104 20.189 58.761 71.936 1.00 0.00 H TER 90097 WAT 5104 ATOM 90097 O WAT 5105 64.399 113.187 5.387 1.00 0.00 O ATOM 90098 H1 WAT 5105 63.868 113.462 6.134 1.00 0.00 H ATOM 90099 H2 WAT 5105 65.296 113.405 5.637 1.00 0.00 H TER 90101 WAT 5105 ATOM 90101 O WAT 5106 114.503 54.573 9.919 1.00 0.00 O ATOM 90102 H1 WAT 5106 115.243 53.983 10.066 1.00 0.00 H ATOM 90103 H2 WAT 5106 113.765 53.991 9.738 1.00 0.00 H TER 90105 WAT 5106 ATOM 90105 O WAT 5107 115.804 55.156 6.782 1.00 0.00 O ATOM 90106 H1 WAT 5107 116.089 54.295 7.087 1.00 0.00 H ATOM 90107 H2 WAT 5107 115.996 55.155 5.845 1.00 0.00 H TER 90109 WAT 5107 ATOM 90109 O WAT 5108 53.103 80.689 8.599 1.00 0.00 O ATOM 90110 H1 WAT 5108 53.122 80.985 9.509 1.00 0.00 H ATOM 90111 H2 WAT 5108 53.854 81.120 8.192 1.00 0.00 H TER 90113 WAT 5108 ATOM 90113 O WAT 5109 88.301 135.579 70.273 1.00 0.00 O ATOM 90114 H1 WAT 5109 88.368 134.645 70.470 1.00 0.00 H ATOM 90115 H2 WAT 5109 89.066 135.969 70.697 1.00 0.00 H TER 90117 WAT 5109 ATOM 90117 O WAT 5110 135.889 99.018 0.344 1.00 0.00 O ATOM 90118 H1 WAT 5110 136.152 98.603 1.166 1.00 0.00 H ATOM 90119 H2 WAT 5110 136.666 99.500 0.060 1.00 0.00 H TER 90121 WAT 5110 ATOM 90121 O WAT 5111 53.124 14.695 122.892 1.00 0.00 O ATOM 90122 H1 WAT 5111 54.009 15.052 122.810 1.00 0.00 H ATOM 90123 H2 WAT 5111 52.804 15.037 123.726 1.00 0.00 H TER 90125 WAT 5111 ATOM 90125 O WAT 5112 50.860 26.500 62.969 1.00 0.00 O ATOM 90126 H1 WAT 5112 51.001 26.628 62.031 1.00 0.00 H ATOM 90127 H2 WAT 5112 51.231 27.282 63.377 1.00 0.00 H TER 90129 WAT 5112 ATOM 90129 O WAT 5113 21.672 90.148 152.547 1.00 0.00 O ATOM 90130 H1 WAT 5113 20.817 90.128 152.977 1.00 0.00 H ATOM 90131 H2 WAT 5113 21.677 90.974 152.062 1.00 0.00 H TER 90133 WAT 5113 ATOM 90133 O WAT 5114 73.194 108.178 81.429 1.00 0.00 O ATOM 90134 H1 WAT 5114 73.388 109.087 81.658 1.00 0.00 H ATOM 90135 H2 WAT 5114 73.953 107.685 81.741 1.00 0.00 H TER 90137 WAT 5114 ATOM 90137 O WAT 5115 125.032 77.637 155.833 1.00 0.00 O ATOM 90138 H1 WAT 5115 124.268 77.206 156.215 1.00 0.00 H ATOM 90139 H2 WAT 5115 125.201 78.382 156.409 1.00 0.00 H TER 90141 WAT 5115 ATOM 90141 O WAT 5116 40.287 104.539 111.767 1.00 0.00 O ATOM 90142 H1 WAT 5116 40.843 103.930 112.254 1.00 0.00 H ATOM 90143 H2 WAT 5116 40.125 104.100 110.932 1.00 0.00 H TER 90145 WAT 5116 ATOM 90145 O WAT 5117 122.553 102.359 147.128 1.00 0.00 O ATOM 90146 H1 WAT 5117 123.420 101.962 147.217 1.00 0.00 H ATOM 90147 H2 WAT 5117 122.693 103.286 147.321 1.00 0.00 H TER 90149 WAT 5117 ATOM 90149 O WAT 5118 124.276 145.663 137.206 1.00 0.00 O ATOM 90150 H1 WAT 5118 124.494 145.515 138.127 1.00 0.00 H ATOM 90151 H2 WAT 5118 123.515 145.106 137.048 1.00 0.00 H TER 90153 WAT 5118 ATOM 90153 O WAT 5119 79.005 124.210 156.458 1.00 0.00 O ATOM 90154 H1 WAT 5119 78.260 124.754 156.200 1.00 0.00 H ATOM 90155 H2 WAT 5119 79.327 123.839 155.636 1.00 0.00 H TER 90157 WAT 5119 ATOM 90157 O WAT 5120 65.263 80.817 117.434 1.00 0.00 O ATOM 90158 H1 WAT 5120 65.639 80.616 118.291 1.00 0.00 H ATOM 90159 H2 WAT 5120 64.460 80.297 117.397 1.00 0.00 H TER 90161 WAT 5120 ATOM 90161 O WAT 5121 93.434 60.917 66.408 1.00 0.00 O ATOM 90162 H1 WAT 5121 93.147 60.008 66.320 1.00 0.00 H ATOM 90163 H2 WAT 5121 94.374 60.890 66.229 1.00 0.00 H TER 90165 WAT 5121 ATOM 90165 O WAT 5122 116.380 96.428 152.807 1.00 0.00 O ATOM 90166 H1 WAT 5122 117.181 95.965 153.053 1.00 0.00 H ATOM 90167 H2 WAT 5122 116.565 96.781 151.937 1.00 0.00 H TER 90169 WAT 5122 ATOM 90169 O WAT 5123 96.427 15.226 139.196 1.00 0.00 O ATOM 90170 H1 WAT 5123 95.788 15.671 138.639 1.00 0.00 H ATOM 90171 H2 WAT 5123 97.276 15.539 138.884 1.00 0.00 H TER 90173 WAT 5123 ATOM 90173 O WAT 5124 122.447 55.014 129.630 1.00 0.00 O ATOM 90174 H1 WAT 5124 122.445 55.167 128.685 1.00 0.00 H ATOM 90175 H2 WAT 5124 122.264 55.873 130.011 1.00 0.00 H TER 90177 WAT 5124 ATOM 90177 O WAT 5125 7.713 90.707 142.402 1.00 0.00 O ATOM 90178 H1 WAT 5125 7.819 89.762 142.289 1.00 0.00 H ATOM 90179 H2 WAT 5125 7.226 90.988 141.628 1.00 0.00 H TER 90181 WAT 5125 ATOM 90181 O WAT 5126 80.959 134.233 113.240 1.00 0.00 O ATOM 90182 H1 WAT 5126 80.494 134.974 112.851 1.00 0.00 H ATOM 90183 H2 WAT 5126 80.987 134.433 114.176 1.00 0.00 H TER 90185 WAT 5126 ATOM 90185 O WAT 5127 18.988 61.573 64.180 1.00 0.00 O ATOM 90186 H1 WAT 5127 18.394 62.047 64.763 1.00 0.00 H ATOM 90187 H2 WAT 5127 19.078 62.142 63.416 1.00 0.00 H TER 90189 WAT 5127 ATOM 90189 O WAT 5128 72.421 85.564 154.016 1.00 0.00 O ATOM 90190 H1 WAT 5128 72.177 86.159 153.308 1.00 0.00 H ATOM 90191 H2 WAT 5128 72.342 84.690 153.633 1.00 0.00 H TER 90193 WAT 5128 ATOM 90193 O WAT 5129 55.852 127.892 149.203 1.00 0.00 O ATOM 90194 H1 WAT 5129 55.997 128.250 150.079 1.00 0.00 H ATOM 90195 H2 WAT 5129 56.482 127.175 149.130 1.00 0.00 H TER 90197 WAT 5129 ATOM 90197 O WAT 5130 105.617 105.018 118.849 1.00 0.00 O ATOM 90198 H1 WAT 5130 106.434 105.420 119.143 1.00 0.00 H ATOM 90199 H2 WAT 5130 105.435 104.341 119.501 1.00 0.00 H TER 90201 WAT 5130 ATOM 90201 O WAT 5131 48.981 141.153 16.925 1.00 0.00 O ATOM 90202 H1 WAT 5131 48.280 140.738 17.427 1.00 0.00 H ATOM 90203 H2 WAT 5131 48.534 141.569 16.188 1.00 0.00 H TER 90205 WAT 5131 ATOM 90205 O WAT 5132 10.351 105.805 2.141 1.00 0.00 O ATOM 90206 H1 WAT 5132 9.780 106.543 2.353 1.00 0.00 H ATOM 90207 H2 WAT 5132 11.235 106.171 2.166 1.00 0.00 H TER 90209 WAT 5132 ATOM 90209 O WAT 5133 102.645 17.552 62.644 1.00 0.00 O ATOM 90210 H1 WAT 5133 103.168 18.080 62.041 1.00 0.00 H ATOM 90211 H2 WAT 5133 102.985 16.663 62.542 1.00 0.00 H TER 90213 WAT 5133 ATOM 90213 O WAT 5134 67.564 135.241 16.963 1.00 0.00 O ATOM 90214 H1 WAT 5134 68.486 135.069 16.769 1.00 0.00 H ATOM 90215 H2 WAT 5134 67.099 134.969 16.172 1.00 0.00 H TER 90217 WAT 5134 ATOM 90217 O WAT 5135 89.544 42.109 89.612 1.00 0.00 O ATOM 90218 H1 WAT 5135 89.041 42.917 89.714 1.00 0.00 H ATOM 90219 H2 WAT 5135 89.520 41.701 90.478 1.00 0.00 H TER 90221 WAT 5135 ATOM 90221 O WAT 5136 99.465 18.653 128.370 1.00 0.00 O ATOM 90222 H1 WAT 5136 99.809 19.521 128.157 1.00 0.00 H ATOM 90223 H2 WAT 5136 99.930 18.400 129.167 1.00 0.00 H TER 90225 WAT 5136 ATOM 90225 O WAT 5137 51.267 4.856 104.274 1.00 0.00 O ATOM 90226 H1 WAT 5137 50.962 3.952 104.199 1.00 0.00 H ATOM 90227 H2 WAT 5137 51.621 4.917 105.161 1.00 0.00 H TER 90229 WAT 5137 ATOM 90229 O WAT 5138 67.873 93.822 124.709 1.00 0.00 O ATOM 90230 H1 WAT 5138 67.059 94.147 124.325 1.00 0.00 H ATOM 90231 H2 WAT 5138 67.592 93.317 125.472 1.00 0.00 H TER 90233 WAT 5138 ATOM 90233 O WAT 5139 53.802 81.575 142.324 1.00 0.00 O ATOM 90234 H1 WAT 5139 53.342 81.504 141.488 1.00 0.00 H ATOM 90235 H2 WAT 5139 53.467 82.382 142.715 1.00 0.00 H TER 90237 WAT 5139 ATOM 90237 O WAT 5140 43.262 3.210 81.305 1.00 0.00 O ATOM 90238 H1 WAT 5140 42.842 2.361 81.444 1.00 0.00 H ATOM 90239 H2 WAT 5140 43.751 3.105 80.489 1.00 0.00 H TER 90241 WAT 5140 ATOM 90241 O WAT 5141 4.857 88.182 149.193 1.00 0.00 O ATOM 90242 H1 WAT 5141 5.613 87.737 149.576 1.00 0.00 H ATOM 90243 H2 WAT 5141 5.050 88.218 148.256 1.00 0.00 H TER 90245 WAT 5141 ATOM 90245 O WAT 5142 36.268 100.127 91.838 1.00 0.00 O ATOM 90246 H1 WAT 5142 36.183 99.826 92.743 1.00 0.00 H ATOM 90247 H2 WAT 5142 36.948 100.800 91.873 1.00 0.00 H TER 90249 WAT 5142 ATOM 90249 O WAT 5143 110.813 88.311 127.818 1.00 0.00 O ATOM 90250 H1 WAT 5143 110.876 88.130 128.755 1.00 0.00 H ATOM 90251 H2 WAT 5143 109.982 88.775 127.719 1.00 0.00 H TER 90253 WAT 5143 ATOM 90253 O WAT 5144 16.012 39.356 152.800 1.00 0.00 O ATOM 90254 H1 WAT 5144 16.569 39.313 152.022 1.00 0.00 H ATOM 90255 H2 WAT 5144 16.609 39.594 153.509 1.00 0.00 H TER 90257 WAT 5144 ATOM 90257 O WAT 5145 144.618 41.925 121.764 1.00 0.00 O ATOM 90258 H1 WAT 5145 144.068 42.496 122.299 1.00 0.00 H ATOM 90259 H2 WAT 5145 145.330 41.663 122.347 1.00 0.00 H TER 90261 WAT 5145 ATOM 90261 O WAT 5146 144.507 140.500 98.414 1.00 0.00 O ATOM 90262 H1 WAT 5146 144.925 140.111 97.646 1.00 0.00 H ATOM 90263 H2 WAT 5146 144.010 141.241 98.067 1.00 0.00 H TER 90265 WAT 5146 ATOM 90265 O WAT 5147 83.587 109.008 89.214 1.00 0.00 O ATOM 90266 H1 WAT 5147 84.068 108.316 89.669 1.00 0.00 H ATOM 90267 H2 WAT 5147 84.155 109.253 88.483 1.00 0.00 H TER 90269 WAT 5147 ATOM 90269 O WAT 5148 104.144 3.247 69.714 1.00 0.00 O ATOM 90270 H1 WAT 5148 103.657 2.704 69.094 1.00 0.00 H ATOM 90271 H2 WAT 5148 104.080 2.777 70.546 1.00 0.00 H TER 90273 WAT 5148 ATOM 90273 O WAT 5149 44.295 84.086 59.024 1.00 0.00 O ATOM 90274 H1 WAT 5149 44.664 84.773 59.579 1.00 0.00 H ATOM 90275 H2 WAT 5149 43.877 83.482 59.637 1.00 0.00 H TER 90277 WAT 5149 ATOM 90277 O WAT 5150 145.119 40.799 124.326 1.00 0.00 O ATOM 90278 H1 WAT 5150 145.616 39.986 124.423 1.00 0.00 H ATOM 90279 H2 WAT 5150 145.667 41.466 124.740 1.00 0.00 H TER 90281 WAT 5150 ATOM 90281 O WAT 5151 35.074 36.680 146.532 1.00 0.00 O ATOM 90282 H1 WAT 5151 34.716 37.470 146.937 1.00 0.00 H ATOM 90283 H2 WAT 5151 35.003 36.009 147.211 1.00 0.00 H TER 90285 WAT 5151 ATOM 90285 O WAT 5152 71.647 87.079 138.738 1.00 0.00 O ATOM 90286 H1 WAT 5152 72.387 86.809 139.282 1.00 0.00 H ATOM 90287 H2 WAT 5152 71.163 87.699 139.283 1.00 0.00 H TER 90289 WAT 5152 ATOM 90289 O WAT 5153 119.604 90.216 107.204 1.00 0.00 O ATOM 90290 H1 WAT 5153 120.501 89.978 106.971 1.00 0.00 H ATOM 90291 H2 WAT 5153 119.057 89.636 106.674 1.00 0.00 H TER 90293 WAT 5153 ATOM 90293 O WAT 5154 24.884 143.882 74.702 1.00 0.00 O ATOM 90294 H1 WAT 5154 24.096 144.418 74.783 1.00 0.00 H ATOM 90295 H2 WAT 5154 25.606 144.508 74.759 1.00 0.00 H TER 90297 WAT 5154 ATOM 90297 O WAT 5155 58.316 20.376 124.409 1.00 0.00 O ATOM 90298 H1 WAT 5155 59.005 19.729 124.564 1.00 0.00 H ATOM 90299 H2 WAT 5155 58.055 20.661 125.285 1.00 0.00 H TER 90301 WAT 5155 ATOM 90301 O WAT 5156 7.350 72.418 10.583 1.00 0.00 O ATOM 90302 H1 WAT 5156 7.181 73.042 9.877 1.00 0.00 H ATOM 90303 H2 WAT 5156 7.737 71.660 10.145 1.00 0.00 H TER 90305 WAT 5156 ATOM 90305 O WAT 5157 107.433 27.934 106.750 1.00 0.00 O ATOM 90306 H1 WAT 5157 107.011 27.089 106.906 1.00 0.00 H ATOM 90307 H2 WAT 5157 108.060 27.762 106.048 1.00 0.00 H TER 90309 WAT 5157 ATOM 90309 O WAT 5158 70.689 13.569 107.968 1.00 0.00 O ATOM 90310 H1 WAT 5158 70.439 14.081 107.199 1.00 0.00 H ATOM 90311 H2 WAT 5158 70.026 12.882 108.024 1.00 0.00 H TER 90313 WAT 5158 ATOM 90313 O WAT 5159 125.119 79.465 130.563 1.00 0.00 O ATOM 90314 H1 WAT 5159 126.028 79.727 130.420 1.00 0.00 H ATOM 90315 H2 WAT 5159 124.870 79.015 129.756 1.00 0.00 H TER 90317 WAT 5159 ATOM 90317 O WAT 5160 22.583 94.572 98.857 1.00 0.00 O ATOM 90318 H1 WAT 5160 22.692 94.154 99.711 1.00 0.00 H ATOM 90319 H2 WAT 5160 21.953 94.017 98.397 1.00 0.00 H TER 90321 WAT 5160 ATOM 90321 O WAT 5161 30.990 128.103 99.576 1.00 0.00 O ATOM 90322 H1 WAT 5161 31.871 128.451 99.714 1.00 0.00 H ATOM 90323 H2 WAT 5161 30.427 128.652 100.121 1.00 0.00 H TER 90325 WAT 5161 ATOM 90325 O WAT 5162 42.055 36.647 122.889 1.00 0.00 O ATOM 90326 H1 WAT 5162 41.119 36.767 123.053 1.00 0.00 H ATOM 90327 H2 WAT 5162 42.094 36.006 122.179 1.00 0.00 H TER 90329 WAT 5162 ATOM 90329 O WAT 5163 31.673 126.338 122.746 1.00 0.00 O ATOM 90330 H1 WAT 5163 32.120 125.539 122.466 1.00 0.00 H ATOM 90331 H2 WAT 5163 30.742 126.134 122.659 1.00 0.00 H TER 90333 WAT 5163 ATOM 90333 O WAT 5164 2.358 6.744 140.641 1.00 0.00 O ATOM 90334 H1 WAT 5164 1.698 6.285 141.160 1.00 0.00 H ATOM 90335 H2 WAT 5164 1.913 7.534 140.333 1.00 0.00 H TER 90337 WAT 5164 ATOM 90337 O WAT 5165 60.079 45.507 110.360 1.00 0.00 O ATOM 90338 H1 WAT 5165 59.129 45.387 110.338 1.00 0.00 H ATOM 90339 H2 WAT 5165 60.233 46.053 111.131 1.00 0.00 H TER 90341 WAT 5165 ATOM 90341 O WAT 5166 119.932 98.691 150.929 1.00 0.00 O ATOM 90342 H1 WAT 5166 120.046 99.473 150.389 1.00 0.00 H ATOM 90343 H2 WAT 5166 120.442 98.015 150.483 1.00 0.00 H TER 90345 WAT 5166 ATOM 90345 O WAT 5167 6.349 21.707 148.498 1.00 0.00 O ATOM 90346 H1 WAT 5167 6.693 21.928 147.633 1.00 0.00 H ATOM 90347 H2 WAT 5167 5.979 22.527 148.825 1.00 0.00 H TER 90349 WAT 5167 ATOM 90349 O WAT 5168 65.567 66.216 127.282 1.00 0.00 O ATOM 90350 H1 WAT 5168 64.887 66.475 126.660 1.00 0.00 H ATOM 90351 H2 WAT 5168 66.175 65.687 126.766 1.00 0.00 H TER 90353 WAT 5168 ATOM 90353 O WAT 5169 126.346 82.390 27.429 1.00 0.00 O ATOM 90354 H1 WAT 5169 126.608 82.981 28.135 1.00 0.00 H ATOM 90355 H2 WAT 5169 125.495 82.051 27.704 1.00 0.00 H TER 90357 WAT 5169 ATOM 90357 O WAT 5170 110.765 9.238 128.759 1.00 0.00 O ATOM 90358 H1 WAT 5170 111.276 10.015 128.988 1.00 0.00 H ATOM 90359 H2 WAT 5170 111.405 8.634 128.382 1.00 0.00 H TER 90361 WAT 5170 ATOM 90361 O WAT 5171 38.662 47.332 74.293 1.00 0.00 O ATOM 90362 H1 WAT 5171 37.942 47.369 74.922 1.00 0.00 H ATOM 90363 H2 WAT 5171 39.099 48.179 74.378 1.00 0.00 H TER 90365 WAT 5171 ATOM 90365 O WAT 5172 117.126 30.133 157.870 1.00 0.00 O ATOM 90366 H1 WAT 5172 116.327 30.596 157.618 1.00 0.00 H ATOM 90367 H2 WAT 5172 117.836 30.712 157.591 1.00 0.00 H TER 90369 WAT 5172 ATOM 90369 O WAT 5173 11.383 12.362 127.260 1.00 0.00 O ATOM 90370 H1 WAT 5173 10.516 12.664 127.532 1.00 0.00 H ATOM 90371 H2 WAT 5173 11.748 11.947 128.042 1.00 0.00 H TER 90373 WAT 5173 ATOM 90373 O WAT 5174 45.558 12.731 132.709 1.00 0.00 O ATOM 90374 H1 WAT 5174 44.822 13.194 133.109 1.00 0.00 H ATOM 90375 H2 WAT 5174 46.215 12.681 133.404 1.00 0.00 H TER 90377 WAT 5174 ATOM 90377 O WAT 5175 65.190 142.045 77.879 1.00 0.00 O ATOM 90378 H1 WAT 5175 65.902 141.717 77.330 1.00 0.00 H ATOM 90379 H2 WAT 5175 65.166 142.985 77.704 1.00 0.00 H TER 90381 WAT 5175 ATOM 90381 O WAT 5176 20.897 109.581 57.444 1.00 0.00 O ATOM 90382 H1 WAT 5176 21.704 109.996 57.139 1.00 0.00 H ATOM 90383 H2 WAT 5176 21.182 108.979 58.131 1.00 0.00 H TER 90385 WAT 5176 ATOM 90385 O WAT 5177 94.467 105.994 81.598 1.00 0.00 O ATOM 90386 H1 WAT 5177 94.187 106.865 81.315 1.00 0.00 H ATOM 90387 H2 WAT 5177 93.819 105.400 81.219 1.00 0.00 H TER 90389 WAT 5177 ATOM 90389 O WAT 5178 10.354 69.194 0.204 1.00 0.00 O ATOM 90390 H1 WAT 5178 11.128 69.143 -0.357 1.00 0.00 H ATOM 90391 H2 WAT 5178 10.625 68.781 1.024 1.00 0.00 H TER 90393 WAT 5178 ATOM 90393 O WAT 5179 111.328 96.982 141.087 1.00 0.00 O ATOM 90394 H1 WAT 5179 110.575 97.547 141.256 1.00 0.00 H ATOM 90395 H2 WAT 5179 111.336 96.367 141.820 1.00 0.00 H TER 90397 WAT 5179 ATOM 90397 O WAT 5180 118.728 94.106 65.719 1.00 0.00 O ATOM 90398 H1 WAT 5180 117.979 94.700 65.676 1.00 0.00 H ATOM 90399 H2 WAT 5180 119.492 94.680 65.672 1.00 0.00 H TER 90401 WAT 5180 ATOM 90401 O WAT 5181 55.753 73.202 60.783 1.00 0.00 O ATOM 90402 H1 WAT 5181 55.877 73.836 61.489 1.00 0.00 H ATOM 90403 H2 WAT 5181 55.124 73.620 60.194 1.00 0.00 H TER 90405 WAT 5181 ATOM 90405 O WAT 5182 103.459 85.460 137.461 1.00 0.00 O ATOM 90406 H1 WAT 5182 103.956 86.135 137.923 1.00 0.00 H ATOM 90407 H2 WAT 5182 102.707 85.926 137.095 1.00 0.00 H TER 90409 WAT 5182 ATOM 90409 O WAT 5183 101.275 26.146 105.410 1.00 0.00 O ATOM 90410 H1 WAT 5183 102.218 26.308 105.391 1.00 0.00 H ATOM 90411 H2 WAT 5183 100.921 26.853 105.950 1.00 0.00 H TER 90413 WAT 5183 ATOM 90413 O WAT 5184 42.786 8.858 13.533 1.00 0.00 O ATOM 90414 H1 WAT 5184 43.206 9.717 13.495 1.00 0.00 H ATOM 90415 H2 WAT 5184 41.901 9.009 13.200 1.00 0.00 H TER 90417 WAT 5184 ATOM 90417 O WAT 5185 138.184 141.082 151.939 1.00 0.00 O ATOM 90418 H1 WAT 5185 138.059 140.388 151.292 1.00 0.00 H ATOM 90419 H2 WAT 5185 138.817 141.676 151.534 1.00 0.00 H TER 90421 WAT 5185 ATOM 90421 O WAT 5186 114.152 15.275 70.670 1.00 0.00 O ATOM 90422 H1 WAT 5186 113.262 14.924 70.635 1.00 0.00 H ATOM 90423 H2 WAT 5186 114.037 16.197 70.901 1.00 0.00 H TER 90425 WAT 5186 ATOM 90425 O WAT 5187 129.221 51.037 111.072 1.00 0.00 O ATOM 90426 H1 WAT 5187 130.160 50.888 111.185 1.00 0.00 H ATOM 90427 H2 WAT 5187 128.809 50.475 111.728 1.00 0.00 H TER 90429 WAT 5187 ATOM 90429 O WAT 5188 6.193 98.101 76.939 1.00 0.00 O ATOM 90430 H1 WAT 5188 6.073 98.459 76.060 1.00 0.00 H ATOM 90431 H2 WAT 5188 7.070 98.388 77.197 1.00 0.00 H TER 90433 WAT 5188 ATOM 90433 O WAT 5189 40.389 137.846 137.932 1.00 0.00 O ATOM 90434 H1 WAT 5189 39.912 138.669 138.035 1.00 0.00 H ATOM 90435 H2 WAT 5189 40.374 137.676 136.990 1.00 0.00 H TER 90437 WAT 5189 ATOM 90437 O WAT 5190 73.959 9.230 104.826 1.00 0.00 O ATOM 90438 H1 WAT 5190 73.815 10.137 104.556 1.00 0.00 H ATOM 90439 H2 WAT 5190 74.722 9.271 105.404 1.00 0.00 H TER 90441 WAT 5190 ATOM 90441 O WAT 5191 58.588 43.864 73.438 1.00 0.00 O ATOM 90442 H1 WAT 5191 58.692 43.274 72.692 1.00 0.00 H ATOM 90443 H2 WAT 5191 57.835 43.517 73.916 1.00 0.00 H TER 90445 WAT 5191 ATOM 90445 O WAT 5192 122.044 19.168 101.559 1.00 0.00 O ATOM 90446 H1 WAT 5192 121.552 18.348 101.509 1.00 0.00 H ATOM 90447 H2 WAT 5192 122.365 19.309 100.668 1.00 0.00 H TER 90449 WAT 5192 ATOM 90449 O WAT 5193 145.019 53.486 77.799 1.00 0.00 O ATOM 90450 H1 WAT 5193 144.804 52.962 77.027 1.00 0.00 H ATOM 90451 H2 WAT 5193 145.725 53.002 78.227 1.00 0.00 H TER 90453 WAT 5193 ATOM 90453 O WAT 5194 74.459 26.295 87.408 1.00 0.00 O ATOM 90454 H1 WAT 5194 74.325 25.456 87.847 1.00 0.00 H ATOM 90455 H2 WAT 5194 74.959 26.817 88.036 1.00 0.00 H TER 90457 WAT 5194 ATOM 90457 O WAT 5195 125.499 23.375 16.002 1.00 0.00 O ATOM 90458 H1 WAT 5195 125.543 23.554 16.942 1.00 0.00 H ATOM 90459 H2 WAT 5195 126.281 23.793 15.642 1.00 0.00 H TER 90461 WAT 5195 ATOM 90461 O WAT 5196 130.810 0.272 116.350 1.00 0.00 O ATOM 90462 H1 WAT 5196 130.295 0.002 115.590 1.00 0.00 H ATOM 90463 H2 WAT 5196 130.312 0.995 116.732 1.00 0.00 H TER 90465 WAT 5196 ATOM 90465 O WAT 5197 101.004 88.401 95.252 1.00 0.00 O ATOM 90466 H1 WAT 5197 100.307 89.055 95.304 1.00 0.00 H ATOM 90467 H2 WAT 5197 101.790 88.865 95.542 1.00 0.00 H TER 90469 WAT 5197 ATOM 90469 O WAT 5198 44.539 104.087 143.728 1.00 0.00 O ATOM 90470 H1 WAT 5198 44.281 104.784 143.124 1.00 0.00 H ATOM 90471 H2 WAT 5198 44.622 104.524 144.576 1.00 0.00 H TER 90473 WAT 5198 ATOM 90473 O WAT 5199 30.445 100.360 55.121 1.00 0.00 O ATOM 90474 H1 WAT 5199 30.771 101.252 55.002 1.00 0.00 H ATOM 90475 H2 WAT 5199 31.028 99.818 54.589 1.00 0.00 H TER 90477 WAT 5199 ATOM 90477 O WAT 5200 135.266 18.398 91.066 1.00 0.00 O ATOM 90478 H1 WAT 5200 134.562 19.022 90.896 1.00 0.00 H ATOM 90479 H2 WAT 5200 135.955 18.920 91.477 1.00 0.00 H TER 90481 WAT 5200 ATOM 90481 O WAT 5201 65.633 123.321 152.583 1.00 0.00 O ATOM 90482 H1 WAT 5201 65.698 123.282 151.629 1.00 0.00 H ATOM 90483 H2 WAT 5201 64.708 123.501 152.753 1.00 0.00 H TER 90485 WAT 5201 ATOM 90485 O WAT 5202 72.265 144.301 21.309 1.00 0.00 O ATOM 90486 H1 WAT 5202 72.648 143.462 21.563 1.00 0.00 H ATOM 90487 H2 WAT 5202 71.341 144.224 21.545 1.00 0.00 H TER 90489 WAT 5202 ATOM 90489 O WAT 5203 2.976 80.997 80.955 1.00 0.00 O ATOM 90490 H1 WAT 5203 2.305 80.893 80.279 1.00 0.00 H ATOM 90491 H2 WAT 5203 2.563 81.547 81.620 1.00 0.00 H TER 90493 WAT 5203 ATOM 90493 O WAT 5204 93.082 77.302 153.596 1.00 0.00 O ATOM 90494 H1 WAT 5204 93.189 77.258 152.646 1.00 0.00 H ATOM 90495 H2 WAT 5204 92.198 76.972 153.753 1.00 0.00 H TER 90497 WAT 5204 ATOM 90497 O WAT 5205 96.266 1.487 121.115 1.00 0.00 O ATOM 90498 H1 WAT 5205 96.359 0.785 121.759 1.00 0.00 H ATOM 90499 H2 WAT 5205 96.988 2.086 121.307 1.00 0.00 H TER 90501 WAT 5205 ATOM 90501 O WAT 5206 4.442 59.231 155.539 1.00 0.00 O ATOM 90502 H1 WAT 5206 3.645 59.751 155.443 1.00 0.00 H ATOM 90503 H2 WAT 5206 4.266 58.658 156.285 1.00 0.00 H TER 90505 WAT 5206 ATOM 90505 O WAT 5207 105.479 13.168 134.900 1.00 0.00 O ATOM 90506 H1 WAT 5207 105.509 12.215 134.815 1.00 0.00 H ATOM 90507 H2 WAT 5207 106.109 13.486 134.254 1.00 0.00 H TER 90509 WAT 5207 ATOM 90509 O WAT 5208 6.177 8.125 69.392 1.00 0.00 O ATOM 90510 H1 WAT 5208 7.074 8.114 69.726 1.00 0.00 H ATOM 90511 H2 WAT 5208 6.266 8.390 68.476 1.00 0.00 H TER 90513 WAT 5208 ATOM 90513 O WAT 5209 17.573 72.964 67.530 1.00 0.00 O ATOM 90514 H1 WAT 5209 17.872 73.797 67.893 1.00 0.00 H ATOM 90515 H2 WAT 5209 16.732 72.804 67.960 1.00 0.00 H TER 90517 WAT 5209 ATOM 90517 O WAT 5210 74.427 89.177 79.598 1.00 0.00 O ATOM 90518 H1 WAT 5210 74.330 89.660 78.777 1.00 0.00 H ATOM 90519 H2 WAT 5210 73.651 88.619 79.641 1.00 0.00 H TER 90521 WAT 5210 ATOM 90521 O WAT 5211 74.305 34.247 12.375 1.00 0.00 O ATOM 90522 H1 WAT 5211 74.111 35.150 12.629 1.00 0.00 H ATOM 90523 H2 WAT 5211 73.753 34.090 11.609 1.00 0.00 H TER 90525 WAT 5211 ATOM 90525 O WAT 5212 6.348 44.454 75.124 1.00 0.00 O ATOM 90526 H1 WAT 5212 6.763 43.839 74.518 1.00 0.00 H ATOM 90527 H2 WAT 5212 5.842 43.900 75.718 1.00 0.00 H TER 90529 WAT 5212 ATOM 90529 O WAT 5213 141.575 75.755 89.182 1.00 0.00 O ATOM 90530 H1 WAT 5213 140.778 76.103 89.582 1.00 0.00 H ATOM 90531 H2 WAT 5213 141.681 76.264 88.378 1.00 0.00 H TER 90533 WAT 5213 ATOM 90533 O WAT 5214 8.820 115.880 83.112 1.00 0.00 O ATOM 90534 H1 WAT 5214 8.376 116.085 82.289 1.00 0.00 H ATOM 90535 H2 WAT 5214 8.338 116.376 83.774 1.00 0.00 H TER 90537 WAT 5214 ATOM 90537 O WAT 5215 124.837 130.028 3.801 1.00 0.00 O ATOM 90538 H1 WAT 5215 124.415 129.758 2.985 1.00 0.00 H ATOM 90539 H2 WAT 5215 125.372 129.276 4.054 1.00 0.00 H TER 90541 WAT 5215 ATOM 90541 O WAT 5216 41.572 0.117 100.057 1.00 0.00 O ATOM 90542 H1 WAT 5216 41.117 0.468 99.292 1.00 0.00 H ATOM 90543 H2 WAT 5216 41.888 0.890 100.524 1.00 0.00 H TER 90545 WAT 5216 ATOM 90545 O WAT 5217 104.005 107.615 127.140 1.00 0.00 O ATOM 90546 H1 WAT 5217 104.463 108.348 127.552 1.00 0.00 H ATOM 90547 H2 WAT 5217 103.263 108.019 126.690 1.00 0.00 H TER 90549 WAT 5217 ATOM 90549 O WAT 5218 40.364 3.697 135.359 1.00 0.00 O ATOM 90550 H1 WAT 5218 41.123 3.214 135.030 1.00 0.00 H ATOM 90551 H2 WAT 5218 40.131 3.250 136.173 1.00 0.00 H TER 90553 WAT 5218 ATOM 90553 O WAT 5219 14.249 94.319 154.844 1.00 0.00 O ATOM 90554 H1 WAT 5219 15.069 94.804 154.755 1.00 0.00 H ATOM 90555 H2 WAT 5219 14.483 93.413 154.639 1.00 0.00 H TER 90557 WAT 5219 ATOM 90557 O WAT 5220 70.671 7.529 76.214 1.00 0.00 O ATOM 90558 H1 WAT 5220 69.974 7.824 76.800 1.00 0.00 H ATOM 90559 H2 WAT 5220 70.547 8.043 75.416 1.00 0.00 H TER 90561 WAT 5220 ATOM 90561 O WAT 5221 41.885 132.206 4.772 1.00 0.00 O ATOM 90562 H1 WAT 5221 41.250 131.732 5.309 1.00 0.00 H ATOM 90563 H2 WAT 5221 41.744 131.874 3.885 1.00 0.00 H TER 90565 WAT 5221 ATOM 90565 O WAT 5222 114.600 61.912 94.143 1.00 0.00 O ATOM 90566 H1 WAT 5222 115.177 62.409 94.724 1.00 0.00 H ATOM 90567 H2 WAT 5222 115.189 61.335 93.657 1.00 0.00 H TER 90569 WAT 5222 ATOM 90569 O WAT 5223 104.177 137.516 3.777 1.00 0.00 O ATOM 90570 H1 WAT 5223 104.332 138.372 3.378 1.00 0.00 H ATOM 90571 H2 WAT 5223 103.521 137.684 4.454 1.00 0.00 H TER 90573 WAT 5223 ATOM 90573 O WAT 5224 80.899 60.969 92.213 1.00 0.00 O ATOM 90574 H1 WAT 5224 80.125 60.421 92.344 1.00 0.00 H ATOM 90575 H2 WAT 5224 80.674 61.527 91.469 1.00 0.00 H TER 90577 WAT 5224 ATOM 90577 O WAT 5225 74.320 21.069 96.224 1.00 0.00 O ATOM 90578 H1 WAT 5225 75.249 21.250 96.370 1.00 0.00 H ATOM 90579 H2 WAT 5225 74.159 21.351 95.324 1.00 0.00 H TER 90581 WAT 5225 ATOM 90581 O WAT 5226 114.593 78.307 139.462 1.00 0.00 O ATOM 90582 H1 WAT 5226 114.280 79.205 139.356 1.00 0.00 H ATOM 90583 H2 WAT 5226 115.389 78.391 139.986 1.00 0.00 H TER 90585 WAT 5226 ATOM 90585 O WAT 5227 45.402 65.435 59.571 1.00 0.00 O ATOM 90586 H1 WAT 5227 45.864 65.231 60.384 1.00 0.00 H ATOM 90587 H2 WAT 5227 45.986 65.125 58.879 1.00 0.00 H TER 90589 WAT 5227 ATOM 90589 O WAT 5228 36.533 63.388 75.069 1.00 0.00 O ATOM 90590 H1 WAT 5228 37.446 63.099 75.065 1.00 0.00 H ATOM 90591 H2 WAT 5228 36.355 63.606 75.984 1.00 0.00 H TER 90593 WAT 5228 ATOM 90593 O WAT 5229 37.595 143.781 144.010 1.00 0.00 O ATOM 90594 H1 WAT 5229 36.974 143.128 144.336 1.00 0.00 H ATOM 90595 H2 WAT 5229 37.203 144.098 143.197 1.00 0.00 H TER 90597 WAT 5229 ATOM 90597 O WAT 5230 93.504 116.277 137.707 1.00 0.00 O ATOM 90598 H1 WAT 5230 93.137 116.771 136.973 1.00 0.00 H ATOM 90599 H2 WAT 5230 94.452 116.361 137.601 1.00 0.00 H TER 90601 WAT 5230 ATOM 90601 O WAT 5231 6.144 76.011 152.172 1.00 0.00 O ATOM 90602 H1 WAT 5231 6.563 76.861 152.039 1.00 0.00 H ATOM 90603 H2 WAT 5231 5.955 75.696 151.288 1.00 0.00 H TER 90605 WAT 5231 ATOM 90605 O WAT 5232 49.417 9.601 100.342 1.00 0.00 O ATOM 90606 H1 WAT 5232 49.567 10.079 101.158 1.00 0.00 H ATOM 90607 H2 WAT 5232 49.590 10.244 99.653 1.00 0.00 H TER 90609 WAT 5232 ATOM 90609 O WAT 5233 141.704 46.935 144.595 1.00 0.00 O ATOM 90610 H1 WAT 5233 140.964 46.945 145.201 1.00 0.00 H ATOM 90611 H2 WAT 5233 142.476 46.887 145.159 1.00 0.00 H TER 90613 WAT 5233 ATOM 90613 O WAT 5234 17.837 122.551 2.944 1.00 0.00 O ATOM 90614 H1 WAT 5234 18.328 123.369 2.865 1.00 0.00 H ATOM 90615 H2 WAT 5234 18.370 122.006 3.522 1.00 0.00 H TER 90617 WAT 5234 ATOM 90617 O WAT 5235 112.900 86.587 142.944 1.00 0.00 O ATOM 90618 H1 WAT 5235 112.186 86.520 142.310 1.00 0.00 H ATOM 90619 H2 WAT 5235 113.247 85.697 143.009 1.00 0.00 H TER 90621 WAT 5235 ATOM 90621 O WAT 5236 113.567 66.112 139.043 1.00 0.00 O ATOM 90622 H1 WAT 5236 114.321 65.531 139.139 1.00 0.00 H ATOM 90623 H2 WAT 5236 113.129 65.805 138.249 1.00 0.00 H TER 90625 WAT 5236 ATOM 90625 O WAT 5237 105.204 133.224 93.119 1.00 0.00 O ATOM 90626 H1 WAT 5237 105.178 132.281 92.959 1.00 0.00 H ATOM 90627 H2 WAT 5237 104.661 133.600 92.425 1.00 0.00 H TER 90629 WAT 5237 ATOM 90629 O WAT 5238 44.012 111.818 150.728 1.00 0.00 O ATOM 90630 H1 WAT 5238 43.166 111.428 150.506 1.00 0.00 H ATOM 90631 H2 WAT 5238 43.950 112.006 151.665 1.00 0.00 H TER 90633 WAT 5238 ATOM 90633 O WAT 5239 28.890 110.138 85.697 1.00 0.00 O ATOM 90634 H1 WAT 5239 28.772 109.206 85.514 1.00 0.00 H ATOM 90635 H2 WAT 5239 28.245 110.575 85.141 1.00 0.00 H TER 90637 WAT 5239 ATOM 90637 O WAT 5240 76.631 100.133 19.509 1.00 0.00 O ATOM 90638 H1 WAT 5240 77.519 99.876 19.262 1.00 0.00 H ATOM 90639 H2 WAT 5240 76.254 99.346 19.903 1.00 0.00 H TER 90641 WAT 5240 ATOM 90641 O WAT 5241 123.681 120.940 101.134 1.00 0.00 O ATOM 90642 H1 WAT 5241 123.166 120.621 101.876 1.00 0.00 H ATOM 90643 H2 WAT 5241 124.356 120.274 101.008 1.00 0.00 H TER 90645 WAT 5241 ATOM 90645 O WAT 5242 33.135 129.814 134.741 1.00 0.00 O ATOM 90646 H1 WAT 5242 32.512 129.194 135.121 1.00 0.00 H ATOM 90647 H2 WAT 5242 33.904 129.284 134.532 1.00 0.00 H TER 90649 WAT 5242 ATOM 90649 O WAT 5243 91.270 57.002 62.426 1.00 0.00 O ATOM 90650 H1 WAT 5243 91.097 57.720 61.817 1.00 0.00 H ATOM 90651 H2 WAT 5243 92.088 57.247 62.860 1.00 0.00 H TER 90653 WAT 5243 ATOM 90653 O WAT 5244 111.872 136.186 127.381 1.00 0.00 O ATOM 90654 H1 WAT 5244 112.227 135.736 128.147 1.00 0.00 H ATOM 90655 H2 WAT 5244 110.956 136.354 127.605 1.00 0.00 H TER 90657 WAT 5244 ATOM 90657 O WAT 5245 112.464 142.365 127.791 1.00 0.00 O ATOM 90658 H1 WAT 5245 112.684 142.031 128.660 1.00 0.00 H ATOM 90659 H2 WAT 5245 113.311 142.543 127.382 1.00 0.00 H TER 90661 WAT 5245 ATOM 90661 O WAT 5246 15.407 82.614 108.168 1.00 0.00 O ATOM 90662 H1 WAT 5246 15.263 82.273 107.285 1.00 0.00 H ATOM 90663 H2 WAT 5246 15.134 83.530 108.118 1.00 0.00 H TER 90665 WAT 5246 ATOM 90665 O WAT 5247 74.501 98.697 150.492 1.00 0.00 O ATOM 90666 H1 WAT 5247 74.555 98.905 151.424 1.00 0.00 H ATOM 90667 H2 WAT 5247 75.377 98.879 150.154 1.00 0.00 H TER 90669 WAT 5247 ATOM 90669 O WAT 5248 84.765 114.464 147.139 1.00 0.00 O ATOM 90670 H1 WAT 5248 85.461 114.686 146.520 1.00 0.00 H ATOM 90671 H2 WAT 5248 85.005 113.598 147.468 1.00 0.00 H TER 90673 WAT 5248 ATOM 90673 O WAT 5249 71.024 71.149 133.785 1.00 0.00 O ATOM 90674 H1 WAT 5249 70.415 71.084 133.049 1.00 0.00 H ATOM 90675 H2 WAT 5249 70.652 70.576 134.455 1.00 0.00 H TER 90677 WAT 5249 ATOM 90677 O WAT 5250 57.965 43.622 116.055 1.00 0.00 O ATOM 90678 H1 WAT 5250 58.290 44.485 116.311 1.00 0.00 H ATOM 90679 H2 WAT 5250 58.334 43.476 115.184 1.00 0.00 H TER 90681 WAT 5250 ATOM 90681 O WAT 5251 142.931 141.923 58.511 1.00 0.00 O ATOM 90682 H1 WAT 5251 143.195 142.496 59.230 1.00 0.00 H ATOM 90683 H2 WAT 5251 142.520 142.509 57.876 1.00 0.00 H TER 90685 WAT 5251 ATOM 90685 O WAT 5252 104.819 51.239 120.974 1.00 0.00 O ATOM 90686 H1 WAT 5252 103.904 51.486 121.107 1.00 0.00 H ATOM 90687 H2 WAT 5252 105.171 51.139 121.859 1.00 0.00 H TER 90689 WAT 5252 ATOM 90689 O WAT 5253 61.547 129.611 99.723 1.00 0.00 O ATOM 90690 H1 WAT 5253 62.415 129.969 99.537 1.00 0.00 H ATOM 90691 H2 WAT 5253 61.046 129.769 98.922 1.00 0.00 H TER 90693 WAT 5253 ATOM 90693 O WAT 5254 28.075 102.733 90.824 1.00 0.00 O ATOM 90694 H1 WAT 5254 28.944 103.124 90.903 1.00 0.00 H ATOM 90695 H2 WAT 5254 28.004 102.149 91.579 1.00 0.00 H TER 90697 WAT 5254 ATOM 90697 O WAT 5255 88.402 123.718 115.501 1.00 0.00 O ATOM 90698 H1 WAT 5255 87.895 122.947 115.247 1.00 0.00 H ATOM 90699 H2 WAT 5255 87.883 124.129 116.192 1.00 0.00 H TER 90701 WAT 5255 ATOM 90701 O WAT 5256 107.747 126.755 76.797 1.00 0.00 O ATOM 90702 H1 WAT 5256 107.155 127.507 76.780 1.00 0.00 H ATOM 90703 H2 WAT 5256 107.960 126.638 77.723 1.00 0.00 H TER 90705 WAT 5256 ATOM 90705 O WAT 5257 119.762 63.708 132.844 1.00 0.00 O ATOM 90706 H1 WAT 5257 119.200 63.691 132.070 1.00 0.00 H ATOM 90707 H2 WAT 5257 120.557 63.248 132.573 1.00 0.00 H TER 90709 WAT 5257 ATOM 90709 O WAT 5258 69.829 123.270 79.739 1.00 0.00 O ATOM 90710 H1 WAT 5258 69.218 123.914 80.096 1.00 0.00 H ATOM 90711 H2 WAT 5258 70.149 123.666 78.929 1.00 0.00 H TER 90713 WAT 5258 ATOM 90713 O WAT 5259 43.907 75.600 112.843 1.00 0.00 O ATOM 90714 H1 WAT 5259 44.279 76.454 113.061 1.00 0.00 H ATOM 90715 H2 WAT 5259 44.074 75.061 113.616 1.00 0.00 H TER 90717 WAT 5259 ATOM 90717 O WAT 5260 85.583 108.329 132.774 1.00 0.00 O ATOM 90718 H1 WAT 5260 86.153 109.076 132.592 1.00 0.00 H ATOM 90719 H2 WAT 5260 85.931 107.623 132.230 1.00 0.00 H TER 90721 WAT 5260 ATOM 90721 O WAT 5261 17.729 57.100 75.859 1.00 0.00 O ATOM 90722 H1 WAT 5261 17.470 57.163 74.940 1.00 0.00 H ATOM 90723 H2 WAT 5261 17.220 56.364 76.201 1.00 0.00 H TER 90725 WAT 5261 ATOM 90725 O WAT 5262 87.412 64.121 155.287 1.00 0.00 O ATOM 90726 H1 WAT 5262 86.696 64.381 154.708 1.00 0.00 H ATOM 90727 H2 WAT 5262 87.331 64.702 156.044 1.00 0.00 H TER 90729 WAT 5262 ATOM 90729 O WAT 5263 47.143 2.453 59.040 1.00 0.00 O ATOM 90730 H1 WAT 5263 46.673 1.625 58.941 1.00 0.00 H ATOM 90731 H2 WAT 5263 47.541 2.606 58.183 1.00 0.00 H TER 90733 WAT 5263 ATOM 90733 O WAT 5264 15.173 131.737 59.689 1.00 0.00 O ATOM 90734 H1 WAT 5264 16.095 131.850 59.456 1.00 0.00 H ATOM 90735 H2 WAT 5264 15.190 131.454 60.603 1.00 0.00 H TER 90737 WAT 5264 ATOM 90737 O WAT 5265 91.020 8.031 139.455 1.00 0.00 O ATOM 90738 H1 WAT 5265 91.617 8.038 138.707 1.00 0.00 H ATOM 90739 H2 WAT 5265 91.350 8.721 140.031 1.00 0.00 H TER 90741 WAT 5265 ATOM 90741 O WAT 5266 96.876 87.135 26.281 1.00 0.00 O ATOM 90742 H1 WAT 5266 96.208 86.451 26.230 1.00 0.00 H ATOM 90743 H2 WAT 5266 97.391 86.909 27.056 1.00 0.00 H TER 90745 WAT 5266 ATOM 90745 O WAT 5267 137.178 123.963 14.987 1.00 0.00 O ATOM 90746 H1 WAT 5267 137.870 123.736 15.608 1.00 0.00 H ATOM 90747 H2 WAT 5267 136.724 123.137 14.822 1.00 0.00 H TER 90749 WAT 5267 ATOM 90749 O WAT 5268 73.445 100.238 14.871 1.00 0.00 O ATOM 90750 H1 WAT 5268 73.275 100.481 13.961 1.00 0.00 H ATOM 90751 H2 WAT 5268 74.348 100.516 15.028 1.00 0.00 H TER 90753 WAT 5268 ATOM 90753 O WAT 5269 20.425 76.081 116.161 1.00 0.00 O ATOM 90754 H1 WAT 5269 19.671 75.494 116.107 1.00 0.00 H ATOM 90755 H2 WAT 5269 21.055 75.721 115.536 1.00 0.00 H TER 90757 WAT 5269 ATOM 90757 O WAT 5270 0.839 66.051 64.417 1.00 0.00 O ATOM 90758 H1 WAT 5270 -0.100 65.867 64.426 1.00 0.00 H ATOM 90759 H2 WAT 5270 1.142 65.716 63.573 1.00 0.00 H TER 90761 WAT 5270 ATOM 90761 O WAT 5271 111.966 77.489 122.769 1.00 0.00 O ATOM 90762 H1 WAT 5271 111.568 78.178 123.301 1.00 0.00 H ATOM 90763 H2 WAT 5271 111.706 77.699 121.872 1.00 0.00 H TER 90765 WAT 5271 ATOM 90765 O WAT 5272 105.334 138.151 15.127 1.00 0.00 O ATOM 90766 H1 WAT 5272 104.976 137.326 15.456 1.00 0.00 H ATOM 90767 H2 WAT 5272 106.278 138.073 15.262 1.00 0.00 H TER 90769 WAT 5272 ATOM 90769 O WAT 5273 97.479 141.480 136.867 1.00 0.00 O ATOM 90770 H1 WAT 5273 96.741 141.167 137.390 1.00 0.00 H ATOM 90771 H2 WAT 5273 97.172 142.305 136.490 1.00 0.00 H TER 90773 WAT 5273 ATOM 90773 O WAT 5274 77.226 25.320 17.727 1.00 0.00 O ATOM 90774 H1 WAT 5274 76.518 25.100 18.332 1.00 0.00 H ATOM 90775 H2 WAT 5274 77.801 24.555 17.743 1.00 0.00 H TER 90777 WAT 5274 ATOM 90777 O WAT 5275 94.857 81.893 17.775 1.00 0.00 O ATOM 90778 H1 WAT 5275 94.109 82.384 17.435 1.00 0.00 H ATOM 90779 H2 WAT 5275 94.795 81.038 17.349 1.00 0.00 H TER 90781 WAT 5275 ATOM 90781 O WAT 5276 56.372 84.529 17.634 1.00 0.00 O ATOM 90782 H1 WAT 5276 55.568 84.864 18.032 1.00 0.00 H ATOM 90783 H2 WAT 5276 56.786 84.016 18.328 1.00 0.00 H TER 90785 WAT 5276 ATOM 90785 O WAT 5277 3.715 76.351 115.803 1.00 0.00 O ATOM 90786 H1 WAT 5277 3.023 76.731 116.344 1.00 0.00 H ATOM 90787 H2 WAT 5277 4.432 76.182 116.414 1.00 0.00 H TER 90789 WAT 5277 ATOM 90789 O WAT 5278 109.114 68.299 118.229 1.00 0.00 O ATOM 90790 H1 WAT 5278 108.809 68.802 118.984 1.00 0.00 H ATOM 90791 H2 WAT 5278 108.937 67.387 118.462 1.00 0.00 H TER 90793 WAT 5278 ATOM 90793 O WAT 5279 67.440 84.772 102.782 1.00 0.00 O ATOM 90794 H1 WAT 5279 68.195 84.193 102.883 1.00 0.00 H ATOM 90795 H2 WAT 5279 66.939 84.656 103.589 1.00 0.00 H TER 90797 WAT 5279 ATOM 90797 O WAT 5280 4.726 91.080 125.172 1.00 0.00 O ATOM 90798 H1 WAT 5280 4.183 91.143 125.958 1.00 0.00 H ATOM 90799 H2 WAT 5280 5.308 90.339 125.342 1.00 0.00 H TER 90801 WAT 5280 ATOM 90801 O WAT 5281 71.315 106.180 81.916 1.00 0.00 O ATOM 90802 H1 WAT 5281 70.429 106.435 82.171 1.00 0.00 H ATOM 90803 H2 WAT 5281 71.760 107.008 81.733 1.00 0.00 H TER 90805 WAT 5281 ATOM 90805 O WAT 5282 45.531 81.439 110.451 1.00 0.00 O ATOM 90806 H1 WAT 5282 46.394 81.441 110.038 1.00 0.00 H ATOM 90807 H2 WAT 5282 45.126 82.257 110.162 1.00 0.00 H TER 90809 WAT 5282 ATOM 90809 O WAT 5283 54.415 106.773 9.638 1.00 0.00 O ATOM 90810 H1 WAT 5283 53.925 105.956 9.732 1.00 0.00 H ATOM 90811 H2 WAT 5283 54.007 107.371 10.264 1.00 0.00 H TER 90813 WAT 5283 ATOM 90813 O WAT 5284 34.438 34.659 158.165 1.00 0.00 O ATOM 90814 H1 WAT 5284 34.783 33.908 158.648 1.00 0.00 H ATOM 90815 H2 WAT 5284 33.636 34.334 157.756 1.00 0.00 H TER 90817 WAT 5284 ATOM 90817 O WAT 5285 106.918 82.374 85.974 1.00 0.00 O ATOM 90818 H1 WAT 5285 107.801 82.720 85.846 1.00 0.00 H ATOM 90819 H2 WAT 5285 106.486 82.500 85.130 1.00 0.00 H TER 90821 WAT 5285 ATOM 90821 O WAT 5286 15.097 73.980 83.694 1.00 0.00 O ATOM 90822 H1 WAT 5286 15.725 73.319 83.983 1.00 0.00 H ATOM 90823 H2 WAT 5286 14.300 73.786 84.187 1.00 0.00 H TER 90825 WAT 5286 ATOM 90825 O WAT 5287 7.922 83.541 78.195 1.00 0.00 O ATOM 90826 H1 WAT 5287 7.034 83.185 78.199 1.00 0.00 H ATOM 90827 H2 WAT 5287 8.303 83.227 77.375 1.00 0.00 H TER 90829 WAT 5287 ATOM 90829 O WAT 5288 124.923 100.488 146.107 1.00 0.00 O ATOM 90830 H1 WAT 5288 124.308 99.756 146.150 1.00 0.00 H ATOM 90831 H2 WAT 5288 125.646 100.162 145.571 1.00 0.00 H TER 90833 WAT 5288 ATOM 90833 O WAT 5289 89.854 76.689 155.684 1.00 0.00 O ATOM 90834 H1 WAT 5289 90.182 76.066 155.035 1.00 0.00 H ATOM 90835 H2 WAT 5289 89.505 76.140 156.387 1.00 0.00 H TER 90837 WAT 5289 ATOM 90837 O WAT 5290 124.685 9.912 157.579 1.00 0.00 O ATOM 90838 H1 WAT 5290 124.327 9.466 156.811 1.00 0.00 H ATOM 90839 H2 WAT 5290 123.951 9.962 158.191 1.00 0.00 H TER 90841 WAT 5290 ATOM 90841 O WAT 5291 123.516 48.063 72.449 1.00 0.00 O ATOM 90842 H1 WAT 5291 122.606 48.252 72.681 1.00 0.00 H ATOM 90843 H2 WAT 5291 123.732 47.276 72.950 1.00 0.00 H TER 90845 WAT 5291 ATOM 90845 O WAT 5292 87.732 67.606 97.131 1.00 0.00 O ATOM 90846 H1 WAT 5292 87.566 68.548 97.182 1.00 0.00 H ATOM 90847 H2 WAT 5292 87.007 67.263 96.608 1.00 0.00 H TER 90849 WAT 5292 ATOM 90849 O WAT 5293 9.910 94.735 118.517 1.00 0.00 O ATOM 90850 H1 WAT 5293 9.316 94.979 119.227 1.00 0.00 H ATOM 90851 H2 WAT 5293 10.146 93.827 118.703 1.00 0.00 H TER 90853 WAT 5293 ATOM 90853 O WAT 5294 109.323 34.847 70.229 1.00 0.00 O ATOM 90854 H1 WAT 5294 109.776 35.672 70.054 1.00 0.00 H ATOM 90855 H2 WAT 5294 109.846 34.426 70.911 1.00 0.00 H TER 90857 WAT 5294 ATOM 90857 O WAT 5295 76.222 56.801 75.328 1.00 0.00 O ATOM 90858 H1 WAT 5295 76.525 57.598 74.894 1.00 0.00 H ATOM 90859 H2 WAT 5295 76.866 56.136 75.084 1.00 0.00 H TER 90861 WAT 5295 ATOM 90861 O WAT 5296 77.422 128.316 149.052 1.00 0.00 O ATOM 90862 H1 WAT 5296 77.355 127.436 148.681 1.00 0.00 H ATOM 90863 H2 WAT 5296 76.714 128.360 149.694 1.00 0.00 H TER 90865 WAT 5296 ATOM 90865 O WAT 5297 33.451 61.950 150.090 1.00 0.00 O ATOM 90866 H1 WAT 5297 32.962 61.441 150.737 1.00 0.00 H ATOM 90867 H2 WAT 5297 32.896 61.941 149.310 1.00 0.00 H TER 90869 WAT 5297 ATOM 90869 O WAT 5298 139.691 62.162 68.117 1.00 0.00 O ATOM 90870 H1 WAT 5298 140.072 62.966 67.765 1.00 0.00 H ATOM 90871 H2 WAT 5298 139.536 61.613 67.348 1.00 0.00 H TER 90873 WAT 5298 ATOM 90873 O WAT 5299 98.914 29.954 133.235 1.00 0.00 O ATOM 90874 H1 WAT 5299 99.394 30.772 133.366 1.00 0.00 H ATOM 90875 H2 WAT 5299 98.920 29.532 134.095 1.00 0.00 H TER 90877 WAT 5299 ATOM 90877 O WAT 5300 62.781 11.664 104.724 1.00 0.00 O ATOM 90878 H1 WAT 5300 62.898 11.342 105.618 1.00 0.00 H ATOM 90879 H2 WAT 5300 61.848 11.547 104.547 1.00 0.00 H TER 90881 WAT 5300 ATOM 90881 O WAT 5301 134.330 102.239 0.671 1.00 0.00 O ATOM 90882 H1 WAT 5301 135.027 102.466 1.287 1.00 0.00 H ATOM 90883 H2 WAT 5301 134.766 102.202 -0.180 1.00 0.00 H TER 90885 WAT 5301 ATOM 90885 O WAT 5302 7.629 27.025 21.567 1.00 0.00 O ATOM 90886 H1 WAT 5302 7.043 27.563 22.099 1.00 0.00 H ATOM 90887 H2 WAT 5302 8.237 26.638 22.198 1.00 0.00 H TER 90889 WAT 5302 ATOM 90889 O WAT 5303 45.678 131.976 115.438 1.00 0.00 O ATOM 90890 H1 WAT 5303 46.438 132.277 115.935 1.00 0.00 H ATOM 90891 H2 WAT 5303 44.925 132.276 115.946 1.00 0.00 H TER 90893 WAT 5303 ATOM 90893 O WAT 5304 106.546 40.729 78.913 1.00 0.00 O ATOM 90894 H1 WAT 5304 107.415 41.107 79.048 1.00 0.00 H ATOM 90895 H2 WAT 5304 106.710 39.908 78.450 1.00 0.00 H TER 90897 WAT 5304 ATOM 90897 O WAT 5305 32.539 144.887 63.916 1.00 0.00 O ATOM 90898 H1 WAT 5305 32.796 145.776 63.671 1.00 0.00 H ATOM 90899 H2 WAT 5305 31.583 144.892 63.865 1.00 0.00 H TER 90901 WAT 5305 ATOM 90901 O WAT 5306 98.646 46.730 82.443 1.00 0.00 O ATOM 90902 H1 WAT 5306 99.527 46.389 82.288 1.00 0.00 H ATOM 90903 H2 WAT 5306 98.781 47.503 82.991 1.00 0.00 H TER 90905 WAT 5306 ATOM 90905 O WAT 5307 70.264 29.178 110.886 1.00 0.00 O ATOM 90906 H1 WAT 5307 69.380 28.957 111.179 1.00 0.00 H ATOM 90907 H2 WAT 5307 70.428 28.585 110.152 1.00 0.00 H TER 90909 WAT 5307 ATOM 90909 O WAT 5308 69.258 52.102 72.851 1.00 0.00 O ATOM 90910 H1 WAT 5308 69.237 51.246 72.423 1.00 0.00 H ATOM 90911 H2 WAT 5308 69.184 52.731 72.134 1.00 0.00 H TER 90913 WAT 5308 ATOM 90913 O WAT 5309 27.326 78.976 61.737 1.00 0.00 O ATOM 90914 H1 WAT 5309 27.045 79.032 60.823 1.00 0.00 H ATOM 90915 H2 WAT 5309 26.844 79.675 62.178 1.00 0.00 H TER 90917 WAT 5309 ATOM 90917 O WAT 5310 83.475 114.157 107.429 1.00 0.00 O ATOM 90918 H1 WAT 5310 83.734 113.435 106.857 1.00 0.00 H ATOM 90919 H2 WAT 5310 82.519 114.111 107.456 1.00 0.00 H TER 90921 WAT 5310 ATOM 90921 O WAT 5311 103.563 98.747 140.093 1.00 0.00 O ATOM 90922 H1 WAT 5311 103.689 98.407 139.207 1.00 0.00 H ATOM 90923 H2 WAT 5311 103.338 97.977 140.616 1.00 0.00 H TER 90925 WAT 5311 ATOM 90925 O WAT 5312 69.170 104.732 104.278 1.00 0.00 O ATOM 90926 H1 WAT 5312 69.218 105.001 105.195 1.00 0.00 H ATOM 90927 H2 WAT 5312 68.307 104.329 104.191 1.00 0.00 H TER 90929 WAT 5312 ATOM 90929 O WAT 5313 130.655 23.110 59.040 1.00 0.00 O ATOM 90930 H1 WAT 5313 130.574 22.414 58.388 1.00 0.00 H ATOM 90931 H2 WAT 5313 129.885 23.661 58.900 1.00 0.00 H TER 90933 WAT 5313 ATOM 90933 O WAT 5314 115.348 141.098 7.700 1.00 0.00 O ATOM 90934 H1 WAT 5314 115.159 140.863 6.791 1.00 0.00 H ATOM 90935 H2 WAT 5314 115.261 140.276 8.183 1.00 0.00 H TER 90937 WAT 5314 ATOM 90937 O WAT 5315 73.870 91.150 154.840 1.00 0.00 O ATOM 90938 H1 WAT 5315 74.399 91.913 154.607 1.00 0.00 H ATOM 90939 H2 WAT 5315 73.842 90.625 154.041 1.00 0.00 H TER 90941 WAT 5315 ATOM 90941 O WAT 5316 136.455 117.221 73.557 1.00 0.00 O ATOM 90942 H1 WAT 5316 135.883 117.360 72.803 1.00 0.00 H ATOM 90943 H2 WAT 5316 136.664 116.287 73.530 1.00 0.00 H TER 90945 WAT 5316 ATOM 90945 O WAT 5317 27.783 16.323 127.059 1.00 0.00 O ATOM 90946 H1 WAT 5317 26.837 16.409 127.177 1.00 0.00 H ATOM 90947 H2 WAT 5317 27.881 15.646 126.389 1.00 0.00 H TER 90949 WAT 5317 ATOM 90949 O WAT 5318 57.055 55.238 157.569 1.00 0.00 O ATOM 90950 H1 WAT 5318 57.184 54.476 157.004 1.00 0.00 H ATOM 90951 H2 WAT 5318 56.104 55.313 157.656 1.00 0.00 H TER 90953 WAT 5318 ATOM 90953 O WAT 5319 80.791 54.256 89.638 1.00 0.00 O ATOM 90954 H1 WAT 5319 81.409 54.941 89.381 1.00 0.00 H ATOM 90955 H2 WAT 5319 80.609 54.432 90.561 1.00 0.00 H TER 90957 WAT 5319 ATOM 90957 O WAT 5320 106.440 55.550 130.867 1.00 0.00 O ATOM 90958 H1 WAT 5320 106.137 54.684 130.594 1.00 0.00 H ATOM 90959 H2 WAT 5320 107.380 55.542 130.688 1.00 0.00 H TER 90961 WAT 5320 ATOM 90961 O WAT 5321 61.184 38.843 18.656 1.00 0.00 O ATOM 90962 H1 WAT 5321 61.803 38.950 19.378 1.00 0.00 H ATOM 90963 H2 WAT 5321 60.344 39.129 19.016 1.00 0.00 H TER 90965 WAT 5321 ATOM 90965 O WAT 5322 21.990 61.845 87.932 1.00 0.00 O ATOM 90966 H1 WAT 5322 22.545 61.182 88.342 1.00 0.00 H ATOM 90967 H2 WAT 5322 21.463 62.195 88.651 1.00 0.00 H TER 90969 WAT 5322 ATOM 90969 O WAT 5323 25.538 115.183 11.908 1.00 0.00 O ATOM 90970 H1 WAT 5323 24.979 114.805 12.587 1.00 0.00 H ATOM 90971 H2 WAT 5323 26.152 114.484 11.687 1.00 0.00 H TER 90973 WAT 5323 ATOM 90973 O WAT 5324 56.989 46.501 124.061 1.00 0.00 O ATOM 90974 H1 WAT 5324 56.435 46.512 123.280 1.00 0.00 H ATOM 90975 H2 WAT 5324 57.182 45.575 124.205 1.00 0.00 H TER 90977 WAT 5324 ATOM 90977 O WAT 5325 119.943 75.104 79.749 1.00 0.00 O ATOM 90978 H1 WAT 5325 119.505 75.005 78.904 1.00 0.00 H ATOM 90979 H2 WAT 5325 120.862 74.909 79.567 1.00 0.00 H TER 90981 WAT 5325 ATOM 90981 O WAT 5326 71.577 6.242 123.995 1.00 0.00 O ATOM 90982 H1 WAT 5326 71.357 5.321 124.135 1.00 0.00 H ATOM 90983 H2 WAT 5326 70.832 6.596 123.509 1.00 0.00 H TER 90985 WAT 5326 ATOM 90985 O WAT 5327 48.805 114.042 21.070 1.00 0.00 O ATOM 90986 H1 WAT 5327 47.896 113.912 20.802 1.00 0.00 H ATOM 90987 H2 WAT 5327 49.050 113.221 21.496 1.00 0.00 H TER 90989 WAT 5327 ATOM 90989 O WAT 5328 99.452 73.376 130.064 1.00 0.00 O ATOM 90990 H1 WAT 5328 99.672 74.241 130.410 1.00 0.00 H ATOM 90991 H2 WAT 5328 100.180 72.817 130.336 1.00 0.00 H TER 90993 WAT 5328 ATOM 90993 O WAT 5329 35.159 73.749 142.300 1.00 0.00 O ATOM 90994 H1 WAT 5329 34.780 73.937 143.158 1.00 0.00 H ATOM 90995 H2 WAT 5329 34.901 74.492 141.755 1.00 0.00 H TER 90997 WAT 5329 ATOM 90997 O WAT 5330 18.918 77.781 153.516 1.00 0.00 O ATOM 90998 H1 WAT 5330 19.752 77.758 153.986 1.00 0.00 H ATOM 90999 H2 WAT 5330 18.599 78.675 153.639 1.00 0.00 H TER 91001 WAT 5330 ATOM 91001 O WAT 5331 30.057 142.710 8.590 1.00 0.00 O ATOM 91002 H1 WAT 5331 29.874 142.516 9.509 1.00 0.00 H ATOM 91003 H2 WAT 5331 31.007 142.821 8.553 1.00 0.00 H TER 91005 WAT 5331 ATOM 91005 O WAT 5332 100.106 107.469 119.982 1.00 0.00 O ATOM 91006 H1 WAT 5332 99.925 107.449 120.922 1.00 0.00 H ATOM 91007 H2 WAT 5332 99.559 108.180 119.648 1.00 0.00 H TER 91009 WAT 5332 ATOM 91009 O WAT 5333 140.246 109.195 59.594 1.00 0.00 O ATOM 91010 H1 WAT 5333 140.895 109.008 60.273 1.00 0.00 H ATOM 91011 H2 WAT 5333 140.180 108.381 59.096 1.00 0.00 H TER 91013 WAT 5333 ATOM 91013 O WAT 5334 99.691 70.735 112.859 1.00 0.00 O ATOM 91014 H1 WAT 5334 100.228 70.153 113.397 1.00 0.00 H ATOM 91015 H2 WAT 5334 99.084 70.149 112.406 1.00 0.00 H TER 91017 WAT 5334 ATOM 91017 O WAT 5335 37.205 92.015 100.715 1.00 0.00 O ATOM 91018 H1 WAT 5335 37.345 92.544 99.929 1.00 0.00 H ATOM 91019 H2 WAT 5335 36.321 91.663 100.613 1.00 0.00 H TER 91021 WAT 5335 ATOM 91021 O WAT 5336 53.528 131.242 121.563 1.00 0.00 O ATOM 91022 H1 WAT 5336 53.632 131.488 120.644 1.00 0.00 H ATOM 91023 H2 WAT 5336 54.318 130.739 121.766 1.00 0.00 H TER 91025 WAT 5336 ATOM 91025 O WAT 5337 93.778 62.118 113.213 1.00 0.00 O ATOM 91026 H1 WAT 5337 94.355 61.518 113.685 1.00 0.00 H ATOM 91027 H2 WAT 5337 94.236 62.294 112.391 1.00 0.00 H TER 91029 WAT 5337 ATOM 91029 O WAT 5338 138.022 64.961 69.697 1.00 0.00 O ATOM 91030 H1 WAT 5338 137.070 64.987 69.790 1.00 0.00 H ATOM 91031 H2 WAT 5338 138.298 64.241 70.263 1.00 0.00 H TER 91033 WAT 5338 ATOM 91033 O WAT 5339 112.363 134.909 148.066 1.00 0.00 O ATOM 91034 H1 WAT 5339 112.798 135.579 147.538 1.00 0.00 H ATOM 91035 H2 WAT 5339 112.354 135.272 148.952 1.00 0.00 H TER 91037 WAT 5339 ATOM 91037 O WAT 5340 88.274 142.126 87.738 1.00 0.00 O ATOM 91038 H1 WAT 5340 88.625 141.752 88.546 1.00 0.00 H ATOM 91039 H2 WAT 5340 87.455 142.544 88.004 1.00 0.00 H TER 91041 WAT 5340 ATOM 91041 O WAT 5341 140.612 90.549 121.491 1.00 0.00 O ATOM 91042 H1 WAT 5341 140.565 91.415 121.086 1.00 0.00 H ATOM 91043 H2 WAT 5341 140.099 89.986 120.910 1.00 0.00 H TER 91045 WAT 5341 ATOM 91045 O WAT 5342 79.724 106.930 58.732 1.00 0.00 O ATOM 91046 H1 WAT 5342 79.809 107.432 57.922 1.00 0.00 H ATOM 91047 H2 WAT 5342 80.323 107.357 59.343 1.00 0.00 H TER 91049 WAT 5342 ATOM 91049 O WAT 5343 30.519 0.781 98.093 1.00 0.00 O ATOM 91050 H1 WAT 5343 30.746 -0.071 98.466 1.00 0.00 H ATOM 91051 H2 WAT 5343 29.562 0.795 98.094 1.00 0.00 H TER 91053 WAT 5343 ATOM 91053 O WAT 5344 6.596 109.005 98.476 1.00 0.00 O ATOM 91054 H1 WAT 5344 6.342 109.313 97.606 1.00 0.00 H ATOM 91055 H2 WAT 5344 6.310 109.701 99.069 1.00 0.00 H TER 91057 WAT 5344 ATOM 91057 O WAT 5345 41.189 4.577 145.517 1.00 0.00 O ATOM 91058 H1 WAT 5345 41.206 5.443 145.925 1.00 0.00 H ATOM 91059 H2 WAT 5345 42.055 4.483 145.121 1.00 0.00 H TER 91061 WAT 5345 ATOM 91061 O WAT 5346 116.407 20.211 107.801 1.00 0.00 O ATOM 91062 H1 WAT 5346 116.545 19.379 107.349 1.00 0.00 H ATOM 91063 H2 WAT 5346 115.457 20.273 107.903 1.00 0.00 H TER 91065 WAT 5346 ATOM 91065 O WAT 5347 57.837 145.264 17.049 1.00 0.00 O ATOM 91066 H1 WAT 5347 58.348 144.772 17.692 1.00 0.00 H ATOM 91067 H2 WAT 5347 57.108 145.627 17.551 1.00 0.00 H TER 91069 WAT 5347 ATOM 91069 O WAT 5348 124.227 34.997 117.804 1.00 0.00 O ATOM 91070 H1 WAT 5348 124.858 35.067 117.089 1.00 0.00 H ATOM 91071 H2 WAT 5348 124.600 34.339 118.390 1.00 0.00 H TER 91073 WAT 5348 ATOM 91073 O WAT 5349 32.694 91.030 143.466 1.00 0.00 O ATOM 91074 H1 WAT 5349 33.558 90.734 143.751 1.00 0.00 H ATOM 91075 H2 WAT 5349 32.806 91.964 143.290 1.00 0.00 H TER 91077 WAT 5349 ATOM 91077 O WAT 5350 143.648 110.742 17.668 1.00 0.00 O ATOM 91078 H1 WAT 5350 142.822 110.560 17.219 1.00 0.00 H ATOM 91079 H2 WAT 5350 143.611 110.207 18.461 1.00 0.00 H TER 91081 WAT 5350 ATOM 91081 O WAT 5351 89.489 84.383 92.031 1.00 0.00 O ATOM 91082 H1 WAT 5351 89.735 84.274 92.950 1.00 0.00 H ATOM 91083 H2 WAT 5351 88.712 84.942 92.056 1.00 0.00 H TER 91085 WAT 5351 ATOM 91085 O WAT 5352 83.211 58.175 108.283 1.00 0.00 O ATOM 91086 H1 WAT 5352 82.751 58.470 109.069 1.00 0.00 H ATOM 91087 H2 WAT 5352 83.786 57.474 108.591 1.00 0.00 H TER 91089 WAT 5352 ATOM 91089 O WAT 5353 77.099 48.254 6.851 1.00 0.00 O ATOM 91090 H1 WAT 5353 77.442 47.984 7.703 1.00 0.00 H ATOM 91091 H2 WAT 5353 76.369 47.658 6.687 1.00 0.00 H TER 91093 WAT 5353 ATOM 91093 O WAT 5354 93.043 61.473 116.980 1.00 0.00 O ATOM 91094 H1 WAT 5354 93.741 61.140 116.417 1.00 0.00 H ATOM 91095 H2 WAT 5354 93.490 61.744 117.782 1.00 0.00 H TER 91097 WAT 5354 ATOM 91097 O WAT 5355 77.261 73.713 111.330 1.00 0.00 O ATOM 91098 H1 WAT 5355 76.602 73.031 111.456 1.00 0.00 H ATOM 91099 H2 WAT 5355 76.808 74.395 110.834 1.00 0.00 H TER 91101 WAT 5355 ATOM 91101 O WAT 5356 64.167 137.857 2.709 1.00 0.00 O ATOM 91102 H1 WAT 5356 64.029 137.459 3.568 1.00 0.00 H ATOM 91103 H2 WAT 5356 64.741 138.604 2.881 1.00 0.00 H TER 91105 WAT 5356 ATOM 91105 O WAT 5357 127.398 110.956 110.685 1.00 0.00 O ATOM 91106 H1 WAT 5357 127.159 111.141 111.594 1.00 0.00 H ATOM 91107 H2 WAT 5357 126.565 110.782 110.249 1.00 0.00 H TER 91109 WAT 5357 ATOM 91109 O WAT 5358 75.938 78.714 77.935 1.00 0.00 O ATOM 91110 H1 WAT 5358 75.189 78.230 78.284 1.00 0.00 H ATOM 91111 H2 WAT 5358 75.733 78.837 77.008 1.00 0.00 H TER 91113 WAT 5358 ATOM 91113 O WAT 5359 113.440 48.794 20.912 1.00 0.00 O ATOM 91114 H1 WAT 5359 114.306 48.475 21.169 1.00 0.00 H ATOM 91115 H2 WAT 5359 112.942 48.815 21.729 1.00 0.00 H TER 91117 WAT 5359 ATOM 91117 O WAT 5360 143.914 113.487 6.692 1.00 0.00 O ATOM 91118 H1 WAT 5360 143.962 114.312 7.174 1.00 0.00 H ATOM 91119 H2 WAT 5360 143.381 112.916 7.247 1.00 0.00 H TER 91121 WAT 5360 ATOM 91121 O WAT 5361 94.714 9.460 83.956 1.00 0.00 O ATOM 91122 H1 WAT 5361 94.629 8.511 84.052 1.00 0.00 H ATOM 91123 H2 WAT 5361 94.455 9.633 83.051 1.00 0.00 H TER 91125 WAT 5361 ATOM 91125 O WAT 5362 134.018 109.854 135.865 1.00 0.00 O ATOM 91126 H1 WAT 5362 133.196 110.341 135.806 1.00 0.00 H ATOM 91127 H2 WAT 5362 133.748 108.945 135.997 1.00 0.00 H TER 91129 WAT 5362 ATOM 91129 O WAT 5363 69.006 79.335 18.850 1.00 0.00 O ATOM 91130 H1 WAT 5363 68.211 78.802 18.861 1.00 0.00 H ATOM 91131 H2 WAT 5363 69.155 79.524 17.923 1.00 0.00 H TER 91133 WAT 5363 ATOM 91133 O WAT 5364 63.747 108.366 100.516 1.00 0.00 O ATOM 91134 H1 WAT 5364 63.212 107.658 100.876 1.00 0.00 H ATOM 91135 H2 WAT 5364 63.822 108.998 101.232 1.00 0.00 H TER 91137 WAT 5364 ATOM 91137 O WAT 5365 27.239 139.865 154.402 1.00 0.00 O ATOM 91138 H1 WAT 5365 27.324 140.301 155.249 1.00 0.00 H ATOM 91139 H2 WAT 5365 27.148 138.937 154.618 1.00 0.00 H TER 91141 WAT 5365 ATOM 91141 O WAT 5366 10.618 59.671 116.539 1.00 0.00 O ATOM 91142 H1 WAT 5366 10.000 58.951 116.414 1.00 0.00 H ATOM 91143 H2 WAT 5366 10.854 59.941 115.652 1.00 0.00 H TER 91145 WAT 5366 ATOM 91145 O WAT 5367 55.144 116.352 146.556 1.00 0.00 O ATOM 91146 H1 WAT 5367 54.847 115.735 147.226 1.00 0.00 H ATOM 91147 H2 WAT 5367 54.490 117.050 146.566 1.00 0.00 H TER 91149 WAT 5367 ATOM 91149 O WAT 5368 68.034 127.789 62.441 1.00 0.00 O ATOM 91150 H1 WAT 5368 67.845 127.294 61.644 1.00 0.00 H ATOM 91151 H2 WAT 5368 68.970 127.654 62.590 1.00 0.00 H TER 91153 WAT 5368 ATOM 91153 O WAT 5369 72.496 9.322 143.974 1.00 0.00 O ATOM 91154 H1 WAT 5369 72.142 10.032 143.437 1.00 0.00 H ATOM 91155 H2 WAT 5369 71.799 9.124 144.599 1.00 0.00 H TER 91157 WAT 5369 ATOM 91157 O WAT 5370 89.448 54.639 62.072 1.00 0.00 O ATOM 91158 H1 WAT 5370 89.826 55.505 62.225 1.00 0.00 H ATOM 91159 H2 WAT 5370 90.136 54.028 62.335 1.00 0.00 H TER 91161 WAT 5370 ATOM 91161 O WAT 5371 4.317 66.757 93.148 1.00 0.00 O ATOM 91162 H1 WAT 5371 3.591 66.995 92.571 1.00 0.00 H ATOM 91163 H2 WAT 5371 4.038 65.941 93.562 1.00 0.00 H TER 91165 WAT 5371 ATOM 91165 O WAT 5372 50.509 0.337 98.648 1.00 0.00 O ATOM 91166 H1 WAT 5372 49.902 -0.053 99.278 1.00 0.00 H ATOM 91167 H2 WAT 5372 50.269 1.264 98.628 1.00 0.00 H TER 91169 WAT 5372 ATOM 91169 O WAT 5373 22.974 63.023 58.269 1.00 0.00 O ATOM 91170 H1 WAT 5373 23.747 63.553 58.463 1.00 0.00 H ATOM 91171 H2 WAT 5373 22.728 63.277 57.379 1.00 0.00 H TER 91173 WAT 5373 ATOM 91173 O WAT 5374 118.178 99.564 75.209 1.00 0.00 O ATOM 91174 H1 WAT 5374 117.939 100.129 74.474 1.00 0.00 H ATOM 91175 H2 WAT 5374 118.885 99.015 74.870 1.00 0.00 H TER 91177 WAT 5374 ATOM 91177 O WAT 5375 131.838 118.157 143.769 1.00 0.00 O ATOM 91178 H1 WAT 5375 132.520 117.600 143.393 1.00 0.00 H ATOM 91179 H2 WAT 5375 132.028 119.031 143.426 1.00 0.00 H TER 91181 WAT 5375 ATOM 91181 O WAT 5376 53.637 58.983 111.174 1.00 0.00 O ATOM 91182 H1 WAT 5376 53.313 59.743 111.656 1.00 0.00 H ATOM 91183 H2 WAT 5376 54.570 59.159 111.049 1.00 0.00 H TER 91185 WAT 5376 ATOM 91185 O WAT 5377 24.652 142.577 157.507 1.00 0.00 O ATOM 91186 H1 WAT 5377 25.552 142.904 157.510 1.00 0.00 H ATOM 91187 H2 WAT 5377 24.705 141.726 157.943 1.00 0.00 H TER 91189 WAT 5377 ATOM 91189 O WAT 5378 2.695 13.072 84.174 1.00 0.00 O ATOM 91190 H1 WAT 5378 3.291 13.050 83.425 1.00 0.00 H ATOM 91191 H2 WAT 5378 2.737 12.189 84.539 1.00 0.00 H TER 91193 WAT 5378 ATOM 91193 O WAT 5379 125.525 4.771 74.181 1.00 0.00 O ATOM 91194 H1 WAT 5379 126.193 4.097 74.051 1.00 0.00 H ATOM 91195 H2 WAT 5379 125.742 5.164 75.026 1.00 0.00 H TER 91197 WAT 5379 ATOM 91197 O WAT 5380 133.387 115.963 140.281 1.00 0.00 O ATOM 91198 H1 WAT 5380 133.007 115.632 141.095 1.00 0.00 H ATOM 91199 H2 WAT 5380 132.631 116.171 139.732 1.00 0.00 H TER 91201 WAT 5380 ATOM 91201 O WAT 5381 81.661 135.936 142.643 1.00 0.00 O ATOM 91202 H1 WAT 5381 82.063 135.185 142.208 1.00 0.00 H ATOM 91203 H2 WAT 5381 82.391 136.527 142.825 1.00 0.00 H TER 91205 WAT 5381 ATOM 91205 O WAT 5382 106.318 94.914 141.184 1.00 0.00 O ATOM 91206 H1 WAT 5382 105.432 94.808 141.531 1.00 0.00 H ATOM 91207 H2 WAT 5382 106.815 94.194 141.572 1.00 0.00 H TER 91209 WAT 5382 ATOM 91209 O WAT 5383 88.742 56.814 87.752 1.00 0.00 O ATOM 91210 H1 WAT 5383 89.178 56.570 88.569 1.00 0.00 H ATOM 91211 H2 WAT 5383 89.374 57.376 87.303 1.00 0.00 H TER 91213 WAT 5383 ATOM 91213 O WAT 5384 113.207 2.074 86.668 1.00 0.00 O ATOM 91214 H1 WAT 5384 113.649 1.467 86.074 1.00 0.00 H ATOM 91215 H2 WAT 5384 113.897 2.669 86.960 1.00 0.00 H TER 91217 WAT 5384 ATOM 91217 O WAT 5385 127.073 144.497 65.528 1.00 0.00 O ATOM 91218 H1 WAT 5385 126.342 145.008 65.875 1.00 0.00 H ATOM 91219 H2 WAT 5385 126.660 143.745 65.103 1.00 0.00 H TER 91221 WAT 5385 ATOM 91221 O WAT 5386 96.835 69.964 158.430 1.00 0.00 O ATOM 91222 H1 WAT 5386 96.544 69.952 159.342 1.00 0.00 H ATOM 91223 H2 WAT 5386 97.558 70.591 158.418 1.00 0.00 H TER 91225 WAT 5386 ATOM 91225 O WAT 5387 28.817 139.298 70.086 1.00 0.00 O ATOM 91226 H1 WAT 5387 29.431 139.536 70.782 1.00 0.00 H ATOM 91227 H2 WAT 5387 29.244 138.575 69.628 1.00 0.00 H TER 91229 WAT 5387 ATOM 91229 O WAT 5388 8.283 107.846 130.196 1.00 0.00 O ATOM 91230 H1 WAT 5388 8.181 106.897 130.129 1.00 0.00 H ATOM 91231 H2 WAT 5388 8.306 108.019 131.137 1.00 0.00 H TER 91233 WAT 5388 ATOM 91233 O WAT 5389 95.382 96.131 19.352 1.00 0.00 O ATOM 91234 H1 WAT 5389 95.735 96.526 18.555 1.00 0.00 H ATOM 91235 H2 WAT 5389 94.534 96.558 19.475 1.00 0.00 H TER 91237 WAT 5389 ATOM 91237 O WAT 5390 80.743 69.384 7.123 1.00 0.00 O ATOM 91238 H1 WAT 5390 80.321 70.230 7.276 1.00 0.00 H ATOM 91239 H2 WAT 5390 81.018 69.416 6.206 1.00 0.00 H TER 91241 WAT 5390 ATOM 91241 O WAT 5391 102.445 7.038 124.680 1.00 0.00 O ATOM 91242 H1 WAT 5391 102.579 7.790 125.258 1.00 0.00 H ATOM 91243 H2 WAT 5391 101.626 6.645 124.985 1.00 0.00 H TER 91245 WAT 5391 ATOM 91245 O WAT 5392 65.189 144.807 77.272 1.00 0.00 O ATOM 91246 H1 WAT 5392 65.058 144.713 76.328 1.00 0.00 H ATOM 91247 H2 WAT 5392 64.352 145.138 77.598 1.00 0.00 H TER 91249 WAT 5392 ATOM 91249 O WAT 5393 4.164 121.292 100.733 1.00 0.00 O ATOM 91250 H1 WAT 5393 3.633 121.992 100.352 1.00 0.00 H ATOM 91251 H2 WAT 5393 4.948 121.261 100.185 1.00 0.00 H TER 91253 WAT 5393 ATOM 91253 O WAT 5394 56.304 57.780 0.989 1.00 0.00 O ATOM 91254 H1 WAT 5394 56.121 58.588 0.510 1.00 0.00 H ATOM 91255 H2 WAT 5394 55.767 57.118 0.554 1.00 0.00 H TER 91257 WAT 5394 ATOM 91257 O WAT 5395 20.116 65.584 81.043 1.00 0.00 O ATOM 91258 H1 WAT 5395 20.389 65.290 81.912 1.00 0.00 H ATOM 91259 H2 WAT 5395 19.473 64.933 80.761 1.00 0.00 H TER 91261 WAT 5395 ATOM 91261 O WAT 5396 82.059 144.661 107.623 1.00 0.00 O ATOM 91262 H1 WAT 5396 82.972 144.484 107.850 1.00 0.00 H ATOM 91263 H2 WAT 5396 81.625 144.798 108.465 1.00 0.00 H TER 91265 WAT 5396 ATOM 91265 O WAT 5397 20.713 113.587 109.342 1.00 0.00 O ATOM 91266 H1 WAT 5397 20.558 112.722 108.962 1.00 0.00 H ATOM 91267 H2 WAT 5397 21.656 113.612 109.506 1.00 0.00 H TER 91269 WAT 5397 ATOM 91269 O WAT 5398 115.229 133.768 68.400 1.00 0.00 O ATOM 91270 H1 WAT 5398 114.984 133.861 67.479 1.00 0.00 H ATOM 91271 H2 WAT 5398 114.411 133.543 68.844 1.00 0.00 H TER 91273 WAT 5398 ATOM 91273 O WAT 5399 55.408 102.027 84.710 1.00 0.00 O ATOM 91274 H1 WAT 5399 54.648 101.492 84.483 1.00 0.00 H ATOM 91275 H2 WAT 5399 55.108 102.573 85.436 1.00 0.00 H TER 91277 WAT 5399 ATOM 91277 O WAT 5400 90.968 19.242 79.915 1.00 0.00 O ATOM 91278 H1 WAT 5400 90.233 18.792 80.332 1.00 0.00 H ATOM 91279 H2 WAT 5400 91.705 19.096 80.508 1.00 0.00 H TER 91281 WAT 5400 ATOM 91281 O WAT 5401 123.437 133.195 96.679 1.00 0.00 O ATOM 91282 H1 WAT 5401 122.630 133.692 96.544 1.00 0.00 H ATOM 91283 H2 WAT 5401 123.892 133.243 95.839 1.00 0.00 H TER 91285 WAT 5401 ATOM 91285 O WAT 5402 16.625 55.780 95.337 1.00 0.00 O ATOM 91286 H1 WAT 5402 16.297 55.581 94.460 1.00 0.00 H ATOM 91287 H2 WAT 5402 17.572 55.865 95.225 1.00 0.00 H TER 91289 WAT 5402 ATOM 91289 O WAT 5403 143.888 27.762 103.810 1.00 0.00 O ATOM 91290 H1 WAT 5403 144.557 27.210 104.215 1.00 0.00 H ATOM 91291 H2 WAT 5403 143.240 27.145 103.472 1.00 0.00 H TER 91293 WAT 5403 ATOM 91293 O WAT 5404 9.159 15.771 136.246 1.00 0.00 O ATOM 91294 H1 WAT 5404 8.793 15.662 137.124 1.00 0.00 H ATOM 91295 H2 WAT 5404 8.715 15.108 135.717 1.00 0.00 H TER 91297 WAT 5404 ATOM 91297 O WAT 5405 96.637 67.092 17.255 1.00 0.00 O ATOM 91298 H1 WAT 5405 96.637 67.138 18.211 1.00 0.00 H ATOM 91299 H2 WAT 5405 96.151 66.293 17.054 1.00 0.00 H TER 91301 WAT 5405 ATOM 91301 O WAT 5406 32.300 1.910 74.748 1.00 0.00 O ATOM 91302 H1 WAT 5406 32.403 0.964 74.851 1.00 0.00 H ATOM 91303 H2 WAT 5406 33.001 2.287 75.280 1.00 0.00 H TER 91305 WAT 5406 ATOM 91305 O WAT 5407 104.515 69.364 146.595 1.00 0.00 O ATOM 91306 H1 WAT 5407 104.316 68.507 146.219 1.00 0.00 H ATOM 91307 H2 WAT 5407 105.064 69.170 147.355 1.00 0.00 H TER 91309 WAT 5407 ATOM 91309 O WAT 5408 47.635 15.335 73.513 1.00 0.00 O ATOM 91310 H1 WAT 5408 46.793 14.885 73.446 1.00 0.00 H ATOM 91311 H2 WAT 5408 47.789 15.417 74.454 1.00 0.00 H TER 91313 WAT 5408 ATOM 91313 O WAT 5409 138.389 117.552 128.778 1.00 0.00 O ATOM 91314 H1 WAT 5409 139.117 117.200 128.265 1.00 0.00 H ATOM 91315 H2 WAT 5409 138.627 118.465 128.937 1.00 0.00 H TER 91317 WAT 5409 ATOM 91317 O WAT 5410 38.832 18.853 149.242 1.00 0.00 O ATOM 91318 H1 WAT 5410 38.784 18.648 148.308 1.00 0.00 H ATOM 91319 H2 WAT 5410 39.672 19.300 149.346 1.00 0.00 H TER 91321 WAT 5410 ATOM 91321 O WAT 5411 122.959 59.338 22.409 1.00 0.00 O ATOM 91322 H1 WAT 5411 123.906 59.471 22.461 1.00 0.00 H ATOM 91323 H2 WAT 5411 122.590 60.029 22.960 1.00 0.00 H TER 91325 WAT 5411 ATOM 91325 O WAT 5412 103.297 11.840 92.518 1.00 0.00 O ATOM 91326 H1 WAT 5412 102.931 12.609 92.081 1.00 0.00 H ATOM 91327 H2 WAT 5412 104.242 11.914 92.384 1.00 0.00 H TER 91329 WAT 5412 ATOM 91329 O WAT 5413 93.899 7.361 134.784 1.00 0.00 O ATOM 91330 H1 WAT 5413 94.575 8.017 134.614 1.00 0.00 H ATOM 91331 H2 WAT 5413 93.783 6.914 133.946 1.00 0.00 H TER 91333 WAT 5413 ATOM 91333 O WAT 5414 122.845 94.101 104.409 1.00 0.00 O ATOM 91334 H1 WAT 5414 122.826 93.146 104.349 1.00 0.00 H ATOM 91335 H2 WAT 5414 122.524 94.400 103.558 1.00 0.00 H TER 91337 WAT 5414 ATOM 91337 O WAT 5415 115.630 130.910 107.044 1.00 0.00 O ATOM 91338 H1 WAT 5415 116.571 131.053 107.143 1.00 0.00 H ATOM 91339 H2 WAT 5415 115.561 130.210 106.395 1.00 0.00 H TER 91341 WAT 5415 ATOM 91341 O WAT 5416 54.211 38.517 131.792 1.00 0.00 O ATOM 91342 H1 WAT 5416 55.100 38.771 132.041 1.00 0.00 H ATOM 91343 H2 WAT 5416 54.333 37.874 131.093 1.00 0.00 H TER 91345 WAT 5416 ATOM 91345 O WAT 5417 34.655 70.135 2.337 1.00 0.00 O ATOM 91346 H1 WAT 5417 33.760 70.321 2.622 1.00 0.00 H ATOM 91347 H2 WAT 5417 34.748 69.188 2.443 1.00 0.00 H TER 91349 WAT 5417 ATOM 91349 O WAT 5418 26.506 127.236 15.840 1.00 0.00 O ATOM 91350 H1 WAT 5418 25.821 127.823 16.161 1.00 0.00 H ATOM 91351 H2 WAT 5418 26.916 127.716 15.121 1.00 0.00 H TER 91353 WAT 5418 ATOM 91353 O WAT 5419 13.588 137.613 2.520 1.00 0.00 O ATOM 91354 H1 WAT 5419 13.155 137.639 1.667 1.00 0.00 H ATOM 91355 H2 WAT 5419 13.358 136.757 2.880 1.00 0.00 H TER 91357 WAT 5419 ATOM 91357 O WAT 5420 26.816 127.420 137.303 1.00 0.00 O ATOM 91358 H1 WAT 5420 27.533 127.548 137.924 1.00 0.00 H ATOM 91359 H2 WAT 5420 26.995 128.044 136.599 1.00 0.00 H TER 91361 WAT 5420 ATOM 91361 O WAT 5421 37.685 62.545 115.839 1.00 0.00 O ATOM 91362 H1 WAT 5421 38.634 62.418 115.868 1.00 0.00 H ATOM 91363 H2 WAT 5421 37.343 61.719 115.496 1.00 0.00 H TER 91365 WAT 5421 ATOM 91365 O WAT 5422 5.631 13.233 145.531 1.00 0.00 O ATOM 91366 H1 WAT 5422 4.757 12.952 145.802 1.00 0.00 H ATOM 91367 H2 WAT 5422 6.218 12.566 145.888 1.00 0.00 H TER 91369 WAT 5422 ATOM 91369 O WAT 5423 116.907 125.484 76.203 1.00 0.00 O ATOM 91370 H1 WAT 5423 116.041 125.846 76.389 1.00 0.00 H ATOM 91371 H2 WAT 5423 116.739 124.756 75.604 1.00 0.00 H TER 91373 WAT 5423 ATOM 91373 O WAT 5424 130.321 23.102 129.881 1.00 0.00 O ATOM 91374 H1 WAT 5424 130.290 22.170 129.668 1.00 0.00 H ATOM 91375 H2 WAT 5424 129.404 23.354 129.988 1.00 0.00 H TER 91377 WAT 5424 ATOM 91377 O WAT 5425 14.180 97.204 90.711 1.00 0.00 O ATOM 91378 H1 WAT 5425 14.862 97.667 90.225 1.00 0.00 H ATOM 91379 H2 WAT 5425 13.581 96.883 90.037 1.00 0.00 H TER 91381 WAT 5425 ATOM 91381 O WAT 5426 84.102 37.222 69.097 1.00 0.00 O ATOM 91382 H1 WAT 5426 83.676 36.391 69.305 1.00 0.00 H ATOM 91383 H2 WAT 5426 84.724 37.005 68.402 1.00 0.00 H TER 91385 WAT 5426 ATOM 91385 O WAT 5427 116.779 124.687 150.177 1.00 0.00 O ATOM 91386 H1 WAT 5427 117.032 125.354 149.539 1.00 0.00 H ATOM 91387 H2 WAT 5427 116.832 125.132 151.023 1.00 0.00 H TER 91389 WAT 5427 ATOM 91389 O WAT 5428 62.794 53.596 11.770 1.00 0.00 O ATOM 91390 H1 WAT 5428 61.911 53.703 11.415 1.00 0.00 H ATOM 91391 H2 WAT 5428 63.268 54.371 11.469 1.00 0.00 H TER 91393 WAT 5428 ATOM 91393 O WAT 5429 8.673 57.649 97.783 1.00 0.00 O ATOM 91394 H1 WAT 5429 8.547 56.868 98.322 1.00 0.00 H ATOM 91395 H2 WAT 5429 9.606 57.845 97.861 1.00 0.00 H TER 91397 WAT 5429 ATOM 91397 O WAT 5430 125.583 33.452 4.890 1.00 0.00 O ATOM 91398 H1 WAT 5430 126.081 33.221 4.105 1.00 0.00 H ATOM 91399 H2 WAT 5430 126.126 34.104 5.334 1.00 0.00 H TER 91401 WAT 5430 ATOM 91401 O WAT 5431 11.668 15.887 71.180 1.00 0.00 O ATOM 91402 H1 WAT 5431 12.569 15.705 71.448 1.00 0.00 H ATOM 91403 H2 WAT 5431 11.510 15.289 70.450 1.00 0.00 H TER 91405 WAT 5431 ATOM 91405 O WAT 5432 121.123 139.764 17.411 1.00 0.00 O ATOM 91406 H1 WAT 5432 121.319 140.611 17.811 1.00 0.00 H ATOM 91407 H2 WAT 5432 121.859 139.205 17.661 1.00 0.00 H TER 91409 WAT 5432 ATOM 91409 O WAT 5433 58.779 3.078 155.734 1.00 0.00 O ATOM 91410 H1 WAT 5433 58.681 2.331 155.143 1.00 0.00 H ATOM 91411 H2 WAT 5433 58.182 3.740 155.385 1.00 0.00 H TER 91413 WAT 5433 ATOM 91413 O WAT 5434 136.952 57.907 147.725 1.00 0.00 O ATOM 91414 H1 WAT 5434 137.507 58.525 147.249 1.00 0.00 H ATOM 91415 H2 WAT 5434 136.061 58.124 147.450 1.00 0.00 H TER 91417 WAT 5434 ATOM 91417 O WAT 5435 126.591 110.345 143.455 1.00 0.00 O ATOM 91418 H1 WAT 5435 126.698 109.855 144.270 1.00 0.00 H ATOM 91419 H2 WAT 5435 126.499 109.672 142.780 1.00 0.00 H TER 91421 WAT 5435 ATOM 91421 O WAT 5436 1.006 6.945 3.212 1.00 0.00 O ATOM 91422 H1 WAT 5436 1.450 7.793 3.230 1.00 0.00 H ATOM 91423 H2 WAT 5436 0.523 6.910 4.038 1.00 0.00 H TER 91425 WAT 5436 ATOM 91425 O WAT 5437 12.503 138.811 130.708 1.00 0.00 O ATOM 91426 H1 WAT 5437 13.250 138.730 130.115 1.00 0.00 H ATOM 91427 H2 WAT 5437 12.891 139.028 131.555 1.00 0.00 H TER 91429 WAT 5437 ATOM 91429 O WAT 5438 129.745 124.632 6.957 1.00 0.00 O ATOM 91430 H1 WAT 5438 129.953 124.351 7.848 1.00 0.00 H ATOM 91431 H2 WAT 5438 128.871 125.018 7.025 1.00 0.00 H TER 91433 WAT 5438 ATOM 91433 O WAT 5439 114.210 140.139 89.412 1.00 0.00 O ATOM 91434 H1 WAT 5439 115.081 140.283 89.043 1.00 0.00 H ATOM 91435 H2 WAT 5439 113.748 139.632 88.744 1.00 0.00 H TER 91437 WAT 5439 ATOM 91437 O WAT 5440 102.002 78.654 144.930 1.00 0.00 O ATOM 91438 H1 WAT 5440 101.194 78.615 145.441 1.00 0.00 H ATOM 91439 H2 WAT 5440 101.796 79.239 144.201 1.00 0.00 H TER 91441 WAT 5440 ATOM 91441 O WAT 5441 72.436 61.028 26.688 1.00 0.00 O ATOM 91442 H1 WAT 5441 72.068 61.655 27.310 1.00 0.00 H ATOM 91443 H2 WAT 5441 73.335 61.327 26.550 1.00 0.00 H TER 91445 WAT 5441 ATOM 91445 O WAT 5442 119.748 58.038 82.739 1.00 0.00 O ATOM 91446 H1 WAT 5442 119.701 58.538 83.554 1.00 0.00 H ATOM 91447 H2 WAT 5442 120.138 58.644 82.109 1.00 0.00 H TER 91449 WAT 5442 ATOM 91449 O WAT 5443 61.464 144.857 146.427 1.00 0.00 O ATOM 91450 H1 WAT 5443 61.488 144.472 145.551 1.00 0.00 H ATOM 91451 H2 WAT 5443 60.935 145.649 146.327 1.00 0.00 H TER 91453 WAT 5443 ATOM 91453 O WAT 5444 21.312 110.333 3.672 1.00 0.00 O ATOM 91454 H1 WAT 5444 21.579 110.466 4.582 1.00 0.00 H ATOM 91455 H2 WAT 5444 20.470 109.881 3.734 1.00 0.00 H TER 91457 WAT 5444 ATOM 91457 O WAT 5445 121.088 56.396 62.291 1.00 0.00 O ATOM 91458 H1 WAT 5445 121.700 55.723 61.993 1.00 0.00 H ATOM 91459 H2 WAT 5445 121.059 57.028 61.572 1.00 0.00 H TER 91461 WAT 5445 ATOM 91461 O WAT 5446 11.692 122.322 150.584 1.00 0.00 O ATOM 91462 H1 WAT 5446 12.228 121.997 151.308 1.00 0.00 H ATOM 91463 H2 WAT 5446 10.794 122.107 150.835 1.00 0.00 H TER 91465 WAT 5446 ATOM 91465 O WAT 5447 37.416 27.386 132.958 1.00 0.00 O ATOM 91466 H1 WAT 5447 38.024 27.553 132.238 1.00 0.00 H ATOM 91467 H2 WAT 5447 36.630 27.882 132.727 1.00 0.00 H TER 91469 WAT 5447 ATOM 91469 O WAT 5448 0.376 53.177 20.630 1.00 0.00 O ATOM 91470 H1 WAT 5448 0.995 53.671 20.092 1.00 0.00 H ATOM 91471 H2 WAT 5448 -0.258 53.829 20.927 1.00 0.00 H TER 91473 WAT 5448 ATOM 91473 O WAT 5449 42.424 55.820 156.098 1.00 0.00 O ATOM 91474 H1 WAT 5449 41.715 55.499 155.540 1.00 0.00 H ATOM 91475 H2 WAT 5449 43.144 55.209 155.944 1.00 0.00 H TER 91477 WAT 5449 ATOM 91477 O WAT 5450 20.502 63.831 95.184 1.00 0.00 O ATOM 91478 H1 WAT 5450 20.095 62.968 95.265 1.00 0.00 H ATOM 91479 H2 WAT 5450 20.426 64.046 94.255 1.00 0.00 H TER 91481 WAT 5450 ATOM 91481 O WAT 5451 122.874 75.820 13.041 1.00 0.00 O ATOM 91482 H1 WAT 5451 123.183 75.280 12.313 1.00 0.00 H ATOM 91483 H2 WAT 5451 122.323 75.233 13.558 1.00 0.00 H TER 91485 WAT 5451 ATOM 91485 O WAT 5452 28.554 135.357 129.310 1.00 0.00 O ATOM 91486 H1 WAT 5452 28.582 135.051 130.216 1.00 0.00 H ATOM 91487 H2 WAT 5452 29.472 135.392 129.040 1.00 0.00 H TER 91489 WAT 5452 ATOM 91489 O WAT 5453 109.727 134.493 123.714 1.00 0.00 O ATOM 91490 H1 WAT 5453 109.809 135.139 123.013 1.00 0.00 H ATOM 91491 H2 WAT 5453 109.255 134.951 124.409 1.00 0.00 H TER 91493 WAT 5453 ATOM 91493 O WAT 5454 100.081 95.989 150.465 1.00 0.00 O ATOM 91494 H1 WAT 5454 99.677 95.401 149.827 1.00 0.00 H ATOM 91495 H2 WAT 5454 100.999 96.038 150.198 1.00 0.00 H TER 91497 WAT 5454 ATOM 91497 O WAT 5455 84.520 30.018 90.673 1.00 0.00 O ATOM 91498 H1 WAT 5455 85.462 30.164 90.753 1.00 0.00 H ATOM 91499 H2 WAT 5455 84.260 30.542 89.915 1.00 0.00 H TER 91501 WAT 5455 ATOM 91501 O WAT 5456 132.183 103.172 99.886 1.00 0.00 O ATOM 91502 H1 WAT 5456 131.691 103.867 99.448 1.00 0.00 H ATOM 91503 H2 WAT 5456 131.939 102.374 99.418 1.00 0.00 H TER 91505 WAT 5456 ATOM 91505 O WAT 5457 68.396 17.165 156.220 1.00 0.00 O ATOM 91506 H1 WAT 5457 69.295 16.870 156.367 1.00 0.00 H ATOM 91507 H2 WAT 5457 67.966 17.056 157.068 1.00 0.00 H TER 91509 WAT 5457 ATOM 91509 O WAT 5458 75.378 26.171 136.906 1.00 0.00 O ATOM 91510 H1 WAT 5458 75.337 25.416 137.492 1.00 0.00 H ATOM 91511 H2 WAT 5458 75.037 25.847 136.073 1.00 0.00 H TER 91513 WAT 5458 ATOM 91513 O WAT 5459 17.169 63.523 123.102 1.00 0.00 O ATOM 91514 H1 WAT 5459 17.531 62.733 123.503 1.00 0.00 H ATOM 91515 H2 WAT 5459 16.436 63.766 123.668 1.00 0.00 H TER 91517 WAT 5459 ATOM 91517 O WAT 5460 82.042 80.678 68.361 1.00 0.00 O ATOM 91518 H1 WAT 5460 81.483 81.454 68.408 1.00 0.00 H ATOM 91519 H2 WAT 5460 82.242 80.472 69.274 1.00 0.00 H TER 91521 WAT 5460 ATOM 91521 O WAT 5461 7.329 108.186 108.429 1.00 0.00 O ATOM 91522 H1 WAT 5461 6.768 107.429 108.260 1.00 0.00 H ATOM 91523 H2 WAT 5461 7.044 108.510 109.283 1.00 0.00 H TER 91525 WAT 5461 ATOM 91525 O WAT 5462 105.440 48.446 148.562 1.00 0.00 O ATOM 91526 H1 WAT 5462 105.469 47.506 148.742 1.00 0.00 H ATOM 91527 H2 WAT 5462 106.139 48.815 149.103 1.00 0.00 H TER 91529 WAT 5462 ATOM 91529 O WAT 5463 93.315 123.916 79.541 1.00 0.00 O ATOM 91530 H1 WAT 5463 92.721 123.284 79.136 1.00 0.00 H ATOM 91531 H2 WAT 5463 94.136 123.436 79.654 1.00 0.00 H TER 91533 WAT 5463 ATOM 91533 O WAT 5464 39.457 44.571 130.377 1.00 0.00 O ATOM 91534 H1 WAT 5464 40.219 44.511 130.954 1.00 0.00 H ATOM 91535 H2 WAT 5464 39.452 45.481 130.080 1.00 0.00 H TER 91537 WAT 5464 ATOM 91537 O WAT 5465 58.123 115.723 61.072 1.00 0.00 O ATOM 91538 H1 WAT 5465 58.441 116.028 61.922 1.00 0.00 H ATOM 91539 H2 WAT 5465 58.426 116.386 60.451 1.00 0.00 H TER 91541 WAT 5465 ATOM 91541 O WAT 5466 14.937 74.310 93.528 1.00 0.00 O ATOM 91542 H1 WAT 5466 15.720 73.954 93.108 1.00 0.00 H ATOM 91543 H2 WAT 5466 14.529 73.555 93.953 1.00 0.00 H TER 91545 WAT 5466 ATOM 91545 O WAT 5467 56.435 27.888 104.581 1.00 0.00 O ATOM 91546 H1 WAT 5467 57.044 27.163 104.441 1.00 0.00 H ATOM 91547 H2 WAT 5467 55.570 27.479 104.582 1.00 0.00 H TER 91549 WAT 5467 ATOM 91549 O WAT 5468 138.775 125.796 21.302 1.00 0.00 O ATOM 91550 H1 WAT 5468 139.000 126.713 21.140 1.00 0.00 H ATOM 91551 H2 WAT 5468 137.823 125.797 21.400 1.00 0.00 H TER 91553 WAT 5468 ATOM 91553 O WAT 5469 123.092 17.386 74.552 1.00 0.00 O ATOM 91554 H1 WAT 5469 123.524 16.541 74.427 1.00 0.00 H ATOM 91555 H2 WAT 5469 123.757 17.935 74.967 1.00 0.00 H TER 91557 WAT 5469 ATOM 91557 O WAT 5470 92.501 143.823 128.565 1.00 0.00 O ATOM 91558 H1 WAT 5470 91.581 143.611 128.722 1.00 0.00 H ATOM 91559 H2 WAT 5470 92.958 142.986 128.654 1.00 0.00 H TER 91561 WAT 5470 ATOM 91561 O WAT 5471 13.163 40.476 150.390 1.00 0.00 O ATOM 91562 H1 WAT 5471 12.442 40.039 149.937 1.00 0.00 H ATOM 91563 H2 WAT 5471 12.816 40.670 151.261 1.00 0.00 H TER 91565 WAT 5471 ATOM 91565 O WAT 5472 105.633 75.987 69.190 1.00 0.00 O ATOM 91566 H1 WAT 5472 105.467 75.246 69.772 1.00 0.00 H ATOM 91567 H2 WAT 5472 105.113 76.702 69.558 1.00 0.00 H TER 91569 WAT 5472 ATOM 91569 O WAT 5473 128.347 59.752 148.712 1.00 0.00 O ATOM 91570 H1 WAT 5473 127.517 60.041 148.332 1.00 0.00 H ATOM 91571 H2 WAT 5473 128.755 59.226 148.023 1.00 0.00 H TER 91573 WAT 5473 ATOM 91573 O WAT 5474 13.221 28.931 87.773 1.00 0.00 O ATOM 91574 H1 WAT 5474 13.439 28.509 86.942 1.00 0.00 H ATOM 91575 H2 WAT 5474 14.059 29.013 88.227 1.00 0.00 H TER 91577 WAT 5474 ATOM 91577 O WAT 5475 60.572 144.868 75.248 1.00 0.00 O ATOM 91578 H1 WAT 5475 59.683 145.167 75.058 1.00 0.00 H ATOM 91579 H2 WAT 5475 60.527 144.533 76.143 1.00 0.00 H TER 91581 WAT 5475 ATOM 91581 O WAT 5476 81.044 102.842 80.914 1.00 0.00 O ATOM 91582 H1 WAT 5476 80.113 103.037 81.018 1.00 0.00 H ATOM 91583 H2 WAT 5476 81.487 103.661 81.135 1.00 0.00 H TER 91585 WAT 5476 ATOM 91585 O WAT 5477 139.416 11.678 122.487 1.00 0.00 O ATOM 91586 H1 WAT 5477 139.014 11.169 121.783 1.00 0.00 H ATOM 91587 H2 WAT 5477 139.635 12.517 122.082 1.00 0.00 H TER 91589 WAT 5477 ATOM 91589 O WAT 5478 1.694 10.217 142.543 1.00 0.00 O ATOM 91590 H1 WAT 5478 2.517 10.658 142.752 1.00 0.00 H ATOM 91591 H2 WAT 5478 1.016 10.848 142.782 1.00 0.00 H TER 91593 WAT 5478 ATOM 91593 O WAT 5479 128.806 82.427 139.178 1.00 0.00 O ATOM 91594 H1 WAT 5479 128.828 82.400 138.221 1.00 0.00 H ATOM 91595 H2 WAT 5479 129.720 82.550 139.435 1.00 0.00 H TER 91597 WAT 5479 ATOM 91597 O WAT 5480 43.313 128.954 114.964 1.00 0.00 O ATOM 91598 H1 WAT 5480 43.181 129.663 114.334 1.00 0.00 H ATOM 91599 H2 WAT 5480 44.046 128.452 114.609 1.00 0.00 H TER 91601 WAT 5480 ATOM 91601 O WAT 5481 138.169 47.761 90.826 1.00 0.00 O ATOM 91602 H1 WAT 5481 139.114 47.913 90.833 1.00 0.00 H ATOM 91603 H2 WAT 5481 137.914 47.886 89.912 1.00 0.00 H TER 91605 WAT 5481 ATOM 91605 O WAT 5482 93.297 124.694 141.467 1.00 0.00 O ATOM 91606 H1 WAT 5482 92.434 124.994 141.751 1.00 0.00 H ATOM 91607 H2 WAT 5482 93.909 125.121 142.067 1.00 0.00 H TER 91609 WAT 5482 ATOM 91609 O WAT 5483 24.586 7.858 152.322 1.00 0.00 O ATOM 91610 H1 WAT 5483 24.524 6.906 152.390 1.00 0.00 H ATOM 91611 H2 WAT 5483 24.562 8.033 151.381 1.00 0.00 H TER 91613 WAT 5483 ATOM 91613 O WAT 5484 84.499 118.614 133.356 1.00 0.00 O ATOM 91614 H1 WAT 5484 83.628 118.800 133.004 1.00 0.00 H ATOM 91615 H2 WAT 5484 84.709 119.379 133.892 1.00 0.00 H TER 91617 WAT 5484 ATOM 91617 O WAT 5485 6.859 9.996 96.819 1.00 0.00 O ATOM 91618 H1 WAT 5485 7.427 10.741 96.625 1.00 0.00 H ATOM 91619 H2 WAT 5485 6.354 9.864 96.016 1.00 0.00 H TER 91621 WAT 5485 ATOM 91621 O WAT 5486 106.594 23.516 152.469 1.00 0.00 O ATOM 91622 H1 WAT 5486 107.310 24.096 152.208 1.00 0.00 H ATOM 91623 H2 WAT 5486 105.952 23.596 151.764 1.00 0.00 H TER 91625 WAT 5486 ATOM 91625 O WAT 5487 64.517 7.691 76.169 1.00 0.00 O ATOM 91626 H1 WAT 5487 64.914 8.479 75.799 1.00 0.00 H ATOM 91627 H2 WAT 5487 64.853 6.976 75.628 1.00 0.00 H TER 91629 WAT 5487 ATOM 91629 O WAT 5488 33.486 6.975 63.346 1.00 0.00 O ATOM 91630 H1 WAT 5488 33.935 6.275 62.873 1.00 0.00 H ATOM 91631 H2 WAT 5488 32.991 7.440 62.672 1.00 0.00 H TER 91633 WAT 5488 ATOM 91633 O WAT 5489 42.067 10.010 65.046 1.00 0.00 O ATOM 91634 H1 WAT 5489 42.668 9.823 64.325 1.00 0.00 H ATOM 91635 H2 WAT 5489 41.487 9.249 65.078 1.00 0.00 H TER 91637 WAT 5489 ATOM 91637 O WAT 5490 65.203 11.807 111.806 1.00 0.00 O ATOM 91638 H1 WAT 5490 65.761 11.280 112.379 1.00 0.00 H ATOM 91639 H2 WAT 5490 65.754 12.547 111.551 1.00 0.00 H TER 91641 WAT 5490 ATOM 91641 O WAT 5491 116.548 113.782 4.204 1.00 0.00 O ATOM 91642 H1 WAT 5491 116.997 114.051 5.005 1.00 0.00 H ATOM 91643 H2 WAT 5491 115.887 114.459 4.061 1.00 0.00 H TER 91645 WAT 5491 ATOM 91645 O WAT 5492 96.414 67.924 140.068 1.00 0.00 O ATOM 91646 H1 WAT 5492 96.850 67.258 139.536 1.00 0.00 H ATOM 91647 H2 WAT 5492 95.538 67.570 140.223 1.00 0.00 H TER 91649 WAT 5492 ATOM 91649 O WAT 5493 75.271 76.051 131.586 1.00 0.00 O ATOM 91650 H1 WAT 5493 75.223 75.699 130.698 1.00 0.00 H ATOM 91651 H2 WAT 5493 74.644 76.774 131.592 1.00 0.00 H TER 91653 WAT 5493 ATOM 91653 O WAT 5494 92.528 8.296 122.995 1.00 0.00 O ATOM 91654 H1 WAT 5494 92.502 7.393 123.312 1.00 0.00 H ATOM 91655 H2 WAT 5494 93.351 8.355 122.508 1.00 0.00 H TER 91657 WAT 5494 ATOM 91657 O WAT 5495 41.559 74.164 142.023 1.00 0.00 O ATOM 91658 H1 WAT 5495 41.021 74.936 142.202 1.00 0.00 H ATOM 91659 H2 WAT 5495 42.396 74.520 141.724 1.00 0.00 H TER 91661 WAT 5495 ATOM 91661 O WAT 5496 70.302 2.517 68.276 1.00 0.00 O ATOM 91662 H1 WAT 5496 69.384 2.247 68.307 1.00 0.00 H ATOM 91663 H2 WAT 5496 70.776 1.800 68.699 1.00 0.00 H TER 91665 WAT 5496 ATOM 91665 O WAT 5497 69.875 130.024 56.282 1.00 0.00 O ATOM 91666 H1 WAT 5497 70.635 129.732 56.786 1.00 0.00 H ATOM 91667 H2 WAT 5497 69.468 130.695 56.830 1.00 0.00 H TER 91669 WAT 5497 ATOM 91669 O WAT 5498 22.266 38.841 89.892 1.00 0.00 O ATOM 91670 H1 WAT 5498 21.529 39.450 89.942 1.00 0.00 H ATOM 91671 H2 WAT 5498 22.669 38.881 90.760 1.00 0.00 H TER 91673 WAT 5498 ATOM 91673 O WAT 5499 124.341 76.730 98.108 1.00 0.00 O ATOM 91674 H1 WAT 5499 124.389 76.977 97.184 1.00 0.00 H ATOM 91675 H2 WAT 5499 125.082 77.179 98.515 1.00 0.00 H TER 91677 WAT 5499 ATOM 91677 O WAT 5500 139.230 43.203 128.498 1.00 0.00 O ATOM 91678 H1 WAT 5500 140.036 43.210 129.014 1.00 0.00 H ATOM 91679 H2 WAT 5500 138.863 42.331 128.639 1.00 0.00 H TER 91681 WAT 5500 ATOM 91681 O WAT 5501 5.325 130.221 76.652 1.00 0.00 O ATOM 91682 H1 WAT 5501 6.018 130.597 76.110 1.00 0.00 H ATOM 91683 H2 WAT 5501 5.084 129.410 76.205 1.00 0.00 H TER 91685 WAT 5501 ATOM 91685 O WAT 5502 74.303 101.452 152.928 1.00 0.00 O ATOM 91686 H1 WAT 5502 75.089 101.577 152.396 1.00 0.00 H ATOM 91687 H2 WAT 5502 74.635 101.188 153.787 1.00 0.00 H TER 91689 WAT 5502 ATOM 91689 O WAT 5503 46.317 102.355 131.933 1.00 0.00 O ATOM 91690 H1 WAT 5503 46.612 101.784 132.643 1.00 0.00 H ATOM 91691 H2 WAT 5503 47.003 102.286 131.269 1.00 0.00 H TER 91693 WAT 5503 ATOM 91693 O WAT 5504 37.592 55.659 73.691 1.00 0.00 O ATOM 91694 H1 WAT 5504 37.560 56.518 73.270 1.00 0.00 H ATOM 91695 H2 WAT 5504 36.790 55.221 73.405 1.00 0.00 H TER 91697 WAT 5504 ATOM 91697 O WAT 5505 97.429 13.085 14.513 1.00 0.00 O ATOM 91698 H1 WAT 5505 98.222 13.585 14.320 1.00 0.00 H ATOM 91699 H2 WAT 5505 97.190 13.348 15.402 1.00 0.00 H TER 91701 WAT 5505 ATOM 91701 O WAT 5506 112.549 121.366 6.151 1.00 0.00 O ATOM 91702 H1 WAT 5506 112.722 122.058 6.788 1.00 0.00 H ATOM 91703 H2 WAT 5506 111.692 121.586 5.785 1.00 0.00 H TER 91705 WAT 5506 ATOM 91705 O WAT 5507 137.263 19.906 125.754 1.00 0.00 O ATOM 91706 H1 WAT 5507 138.139 20.059 125.401 1.00 0.00 H ATOM 91707 H2 WAT 5507 136.966 19.105 125.322 1.00 0.00 H TER 91709 WAT 5507 ATOM 91709 O WAT 5508 12.673 37.689 121.694 1.00 0.00 O ATOM 91710 H1 WAT 5508 12.942 36.799 121.466 1.00 0.00 H ATOM 91711 H2 WAT 5508 13.297 37.963 122.367 1.00 0.00 H TER 91713 WAT 5508 ATOM 91713 O WAT 5509 80.616 17.904 104.018 1.00 0.00 O ATOM 91714 H1 WAT 5509 81.072 18.147 104.824 1.00 0.00 H ATOM 91715 H2 WAT 5509 80.610 16.947 104.025 1.00 0.00 H TER 91717 WAT 5509 ATOM 91717 O WAT 5510 53.005 122.127 138.014 1.00 0.00 O ATOM 91718 H1 WAT 5510 53.005 122.152 137.057 1.00 0.00 H ATOM 91719 H2 WAT 5510 53.338 121.256 138.231 1.00 0.00 H TER 91721 WAT 5510 ATOM 91721 O WAT 5511 10.322 14.535 88.912 1.00 0.00 O ATOM 91722 H1 WAT 5511 10.715 13.881 89.490 1.00 0.00 H ATOM 91723 H2 WAT 5511 9.379 14.393 88.994 1.00 0.00 H TER 91725 WAT 5511 ATOM 91725 O WAT 5512 126.914 19.163 148.700 1.00 0.00 O ATOM 91726 H1 WAT 5512 127.506 19.889 148.506 1.00 0.00 H ATOM 91727 H2 WAT 5512 126.166 19.303 148.119 1.00 0.00 H TER 91729 WAT 5512 ATOM 91729 O WAT 5513 35.027 128.072 111.803 1.00 0.00 O ATOM 91730 H1 WAT 5513 35.550 127.777 112.549 1.00 0.00 H ATOM 91731 H2 WAT 5513 35.633 128.052 111.063 1.00 0.00 H TER 91733 WAT 5513 ATOM 91733 O WAT 5514 76.975 19.455 136.349 1.00 0.00 O ATOM 91734 H1 WAT 5514 77.091 19.491 137.298 1.00 0.00 H ATOM 91735 H2 WAT 5514 77.341 18.608 136.094 1.00 0.00 H TER 91737 WAT 5514 ATOM 91737 O WAT 5515 76.348 3.841 137.429 1.00 0.00 O ATOM 91738 H1 WAT 5515 76.515 3.279 138.185 1.00 0.00 H ATOM 91739 H2 WAT 5515 75.606 3.431 136.984 1.00 0.00 H TER 91741 WAT 5515 ATOM 91741 O WAT 5516 2.469 91.776 70.920 1.00 0.00 O ATOM 91742 H1 WAT 5516 1.542 92.008 70.866 1.00 0.00 H ATOM 91743 H2 WAT 5516 2.911 92.600 71.123 1.00 0.00 H TER 91745 WAT 5516 ATOM 91745 O WAT 5517 41.051 84.980 83.033 1.00 0.00 O ATOM 91746 H1 WAT 5517 40.107 85.093 83.144 1.00 0.00 H ATOM 91747 H2 WAT 5517 41.303 84.373 83.729 1.00 0.00 H TER 91749 WAT 5517 ATOM 91749 O WAT 5518 62.900 60.533 148.783 1.00 0.00 O ATOM 91750 H1 WAT 5518 63.071 59.608 148.609 1.00 0.00 H ATOM 91751 H2 WAT 5518 62.492 60.543 149.649 1.00 0.00 H TER 91753 WAT 5518 ATOM 91753 O WAT 5519 97.931 16.923 70.332 1.00 0.00 O ATOM 91754 H1 WAT 5519 97.445 16.210 70.746 1.00 0.00 H ATOM 91755 H2 WAT 5519 98.850 16.721 70.507 1.00 0.00 H TER 91757 WAT 5519 ATOM 91757 O WAT 5520 12.159 94.531 17.276 1.00 0.00 O ATOM 91758 H1 WAT 5520 11.891 94.327 18.172 1.00 0.00 H ATOM 91759 H2 WAT 5520 12.474 95.434 17.319 1.00 0.00 H TER 91761 WAT 5520 ATOM 91761 O WAT 5521 35.579 26.515 18.437 1.00 0.00 O ATOM 91762 H1 WAT 5521 36.200 26.232 17.766 1.00 0.00 H ATOM 91763 H2 WAT 5521 36.107 26.603 19.230 1.00 0.00 H TER 91765 WAT 5521 ATOM 91765 O WAT 5522 98.496 107.425 109.052 1.00 0.00 O ATOM 91766 H1 WAT 5522 98.477 107.711 109.966 1.00 0.00 H ATOM 91767 H2 WAT 5522 97.656 107.712 108.694 1.00 0.00 H TER 91769 WAT 5522 ATOM 91769 O WAT 5523 106.422 132.601 141.608 1.00 0.00 O ATOM 91770 H1 WAT 5523 106.341 133.041 142.454 1.00 0.00 H ATOM 91771 H2 WAT 5523 107.366 132.536 141.462 1.00 0.00 H TER 91773 WAT 5523 ATOM 91773 O WAT 5524 76.673 81.174 91.036 1.00 0.00 O ATOM 91774 H1 WAT 5524 77.290 81.847 91.324 1.00 0.00 H ATOM 91775 H2 WAT 5524 76.926 80.989 90.132 1.00 0.00 H TER 91777 WAT 5524 ATOM 91777 O WAT 5525 74.546 70.603 84.012 1.00 0.00 O ATOM 91778 H1 WAT 5525 74.302 69.707 84.244 1.00 0.00 H ATOM 91779 H2 WAT 5525 74.853 70.540 83.107 1.00 0.00 H TER 91781 WAT 5525 ATOM 91781 O WAT 5526 44.161 31.306 122.057 1.00 0.00 O ATOM 91782 H1 WAT 5526 45.058 31.634 122.119 1.00 0.00 H ATOM 91783 H2 WAT 5526 43.773 31.806 121.339 1.00 0.00 H TER 91785 WAT 5526 ATOM 91785 O WAT 5527 80.521 38.989 125.045 1.00 0.00 O ATOM 91786 H1 WAT 5527 80.092 38.570 124.299 1.00 0.00 H ATOM 91787 H2 WAT 5527 79.804 39.202 125.644 1.00 0.00 H TER 91789 WAT 5527 ATOM 91789 O WAT 5528 138.875 22.950 138.442 1.00 0.00 O ATOM 91790 H1 WAT 5528 137.924 23.050 138.493 1.00 0.00 H ATOM 91791 H2 WAT 5528 139.171 23.015 139.350 1.00 0.00 H TER 91793 WAT 5528 ATOM 91793 O WAT 5529 59.422 16.570 85.120 1.00 0.00 O ATOM 91794 H1 WAT 5529 59.758 17.465 85.166 1.00 0.00 H ATOM 91795 H2 WAT 5529 58.490 16.653 85.321 1.00 0.00 H TER 91797 WAT 5529 ATOM 91797 O WAT 5530 10.187 21.242 16.369 1.00 0.00 O ATOM 91798 H1 WAT 5530 10.258 20.491 16.958 1.00 0.00 H ATOM 91799 H2 WAT 5530 9.715 21.902 16.877 1.00 0.00 H TER 91801 WAT 5530 ATOM 91801 O WAT 5531 120.318 32.982 109.173 1.00 0.00 O ATOM 91802 H1 WAT 5531 121.256 32.788 109.167 1.00 0.00 H ATOM 91803 H2 WAT 5531 120.191 33.571 108.429 1.00 0.00 H TER 91805 WAT 5531 ATOM 91805 O WAT 5532 140.885 132.143 127.093 1.00 0.00 O ATOM 91806 H1 WAT 5532 140.846 131.186 127.109 1.00 0.00 H ATOM 91807 H2 WAT 5532 140.721 132.374 126.179 1.00 0.00 H TER 91809 WAT 5532 ATOM 91809 O WAT 5533 15.359 18.524 8.851 1.00 0.00 O ATOM 91810 H1 WAT 5533 15.721 19.114 9.513 1.00 0.00 H ATOM 91811 H2 WAT 5533 14.453 18.813 8.742 1.00 0.00 H TER 91813 WAT 5533 ATOM 91813 O WAT 5534 15.693 69.774 108.760 1.00 0.00 O ATOM 91814 H1 WAT 5534 15.032 69.449 108.149 1.00 0.00 H ATOM 91815 H2 WAT 5534 15.415 70.666 108.964 1.00 0.00 H TER 91817 WAT 5534 ATOM 91817 O WAT 5535 110.545 122.734 143.502 1.00 0.00 O ATOM 91818 H1 WAT 5535 111.097 123.287 142.948 1.00 0.00 H ATOM 91819 H2 WAT 5535 109.835 123.311 143.783 1.00 0.00 H TER 91821 WAT 5535 ATOM 91821 O WAT 5536 12.971 43.408 65.988 1.00 0.00 O ATOM 91822 H1 WAT 5536 13.470 43.000 65.280 1.00 0.00 H ATOM 91823 H2 WAT 5536 12.546 44.162 65.578 1.00 0.00 H TER 91825 WAT 5536 ATOM 91825 O WAT 5537 13.314 70.867 13.710 1.00 0.00 O ATOM 91826 H1 WAT 5537 12.788 71.004 12.922 1.00 0.00 H ATOM 91827 H2 WAT 5537 14.138 70.502 13.387 1.00 0.00 H TER 91829 WAT 5537 ATOM 91829 O WAT 5538 75.791 70.998 126.074 1.00 0.00 O ATOM 91830 H1 WAT 5538 76.564 70.434 126.074 1.00 0.00 H ATOM 91831 H2 WAT 5538 75.300 70.733 125.297 1.00 0.00 H TER 91833 WAT 5538 ATOM 91833 O WAT 5539 57.413 127.334 66.485 1.00 0.00 O ATOM 91834 H1 WAT 5539 57.169 126.792 65.734 1.00 0.00 H ATOM 91835 H2 WAT 5539 56.804 128.072 66.455 1.00 0.00 H TER 91837 WAT 5539 ATOM 91837 O WAT 5540 20.649 84.980 82.239 1.00 0.00 O ATOM 91838 H1 WAT 5540 20.972 85.857 82.446 1.00 0.00 H ATOM 91839 H2 WAT 5540 19.739 84.984 82.538 1.00 0.00 H TER 91841 WAT 5540 ATOM 91841 O WAT 5541 140.295 135.129 140.845 1.00 0.00 O ATOM 91842 H1 WAT 5541 139.724 135.785 141.246 1.00 0.00 H ATOM 91843 H2 WAT 5541 139.791 134.316 140.887 1.00 0.00 H TER 91845 WAT 5541 ATOM 91845 O WAT 5542 38.949 6.444 68.410 1.00 0.00 O ATOM 91846 H1 WAT 5542 38.879 6.672 69.337 1.00 0.00 H ATOM 91847 H2 WAT 5542 38.537 5.583 68.342 1.00 0.00 H TER 91849 WAT 5542 ATOM 91849 O WAT 5543 73.510 117.910 144.361 1.00 0.00 O ATOM 91850 H1 WAT 5543 74.001 117.115 144.151 1.00 0.00 H ATOM 91851 H2 WAT 5543 73.914 118.235 145.166 1.00 0.00 H TER 91853 WAT 5543 ATOM 91853 O WAT 5544 73.719 53.215 136.662 1.00 0.00 O ATOM 91854 H1 WAT 5544 72.967 53.671 136.283 1.00 0.00 H ATOM 91855 H2 WAT 5544 73.579 53.269 137.608 1.00 0.00 H TER 91857 WAT 5544 ATOM 91857 O WAT 5545 0.689 144.466 94.037 1.00 0.00 O ATOM 91858 H1 WAT 5545 0.532 143.522 94.065 1.00 0.00 H ATOM 91859 H2 WAT 5545 1.636 144.555 94.144 1.00 0.00 H TER 91861 WAT 5545 ATOM 91861 O WAT 5546 74.793 39.372 151.985 1.00 0.00 O ATOM 91862 H1 WAT 5546 74.038 39.032 151.506 1.00 0.00 H ATOM 91863 H2 WAT 5546 75.535 38.864 151.654 1.00 0.00 H TER 91865 WAT 5546 ATOM 91865 O WAT 5547 68.069 12.038 18.029 1.00 0.00 O ATOM 91866 H1 WAT 5547 68.931 12.396 17.818 1.00 0.00 H ATOM 91867 H2 WAT 5547 67.824 12.470 18.848 1.00 0.00 H TER 91869 WAT 5547 ATOM 91869 O WAT 5548 52.711 86.291 23.551 1.00 0.00 O ATOM 91870 H1 WAT 5548 52.648 86.646 22.664 1.00 0.00 H ATOM 91871 H2 WAT 5548 53.355 85.587 23.481 1.00 0.00 H TER 91873 WAT 5548 ATOM 91873 O WAT 5549 145.218 42.855 92.468 1.00 0.00 O ATOM 91874 H1 WAT 5549 145.474 43.772 92.564 1.00 0.00 H ATOM 91875 H2 WAT 5549 146.042 42.390 92.324 1.00 0.00 H TER 91877 WAT 5549 ATOM 91877 O WAT 5550 8.654 31.431 61.325 1.00 0.00 O ATOM 91878 H1 WAT 5550 8.465 32.206 60.796 1.00 0.00 H ATOM 91879 H2 WAT 5550 8.168 30.726 60.898 1.00 0.00 H TER 91881 WAT 5550 ATOM 91881 O WAT 5551 13.707 61.834 112.254 1.00 0.00 O ATOM 91882 H1 WAT 5551 13.970 61.196 111.591 1.00 0.00 H ATOM 91883 H2 WAT 5551 14.424 62.467 112.276 1.00 0.00 H TER 91885 WAT 5551 ATOM 91885 O WAT 5552 83.258 91.497 150.089 1.00 0.00 O ATOM 91886 H1 WAT 5552 83.650 91.476 150.962 1.00 0.00 H ATOM 91887 H2 WAT 5552 82.314 91.503 150.250 1.00 0.00 H TER 91889 WAT 5552 ATOM 91889 O WAT 5553 4.740 106.514 154.892 1.00 0.00 O ATOM 91890 H1 WAT 5553 3.857 106.855 154.754 1.00 0.00 H ATOM 91891 H2 WAT 5553 5.269 106.935 154.215 1.00 0.00 H TER 91893 WAT 5553 ATOM 91893 O WAT 5554 68.326 106.848 100.221 1.00 0.00 O ATOM 91894 H1 WAT 5554 68.696 106.225 100.847 1.00 0.00 H ATOM 91895 H2 WAT 5554 67.389 106.655 100.215 1.00 0.00 H TER 91897 WAT 5554 ATOM 91897 O WAT 5555 89.322 21.590 14.902 1.00 0.00 O ATOM 91898 H1 WAT 5555 88.747 20.994 15.382 1.00 0.00 H ATOM 91899 H2 WAT 5555 89.843 22.018 15.581 1.00 0.00 H TER 91901 WAT 5555 ATOM 91901 O WAT 5556 23.211 15.692 134.241 1.00 0.00 O ATOM 91902 H1 WAT 5556 23.340 14.784 134.513 1.00 0.00 H ATOM 91903 H2 WAT 5556 23.357 15.682 133.296 1.00 0.00 H TER 91905 WAT 5556 ATOM 91905 O WAT 5557 119.405 25.312 122.517 1.00 0.00 O ATOM 91906 H1 WAT 5557 120.326 25.408 122.760 1.00 0.00 H ATOM 91907 H2 WAT 5557 119.139 24.481 122.912 1.00 0.00 H TER 91909 WAT 5557 ATOM 91909 O WAT 5558 124.335 117.075 111.727 1.00 0.00 O ATOM 91910 H1 WAT 5558 123.605 116.462 111.807 1.00 0.00 H ATOM 91911 H2 WAT 5558 125.080 116.529 111.477 1.00 0.00 H TER 91913 WAT 5558 ATOM 91913 O WAT 5559 135.870 137.518 111.274 1.00 0.00 O ATOM 91914 H1 WAT 5559 135.786 136.621 111.597 1.00 0.00 H ATOM 91915 H2 WAT 5559 136.078 137.420 110.345 1.00 0.00 H TER 91917 WAT 5559 ATOM 91917 O WAT 5560 38.423 75.409 70.543 1.00 0.00 O ATOM 91918 H1 WAT 5560 38.199 76.322 70.361 1.00 0.00 H ATOM 91919 H2 WAT 5560 38.950 75.137 69.792 1.00 0.00 H TER 91921 WAT 5560 ATOM 91921 O WAT 5561 5.549 54.435 124.108 1.00 0.00 O ATOM 91922 H1 WAT 5561 5.362 54.090 124.981 1.00 0.00 H ATOM 91923 H2 WAT 5561 5.805 55.345 124.260 1.00 0.00 H TER 91925 WAT 5561 ATOM 91925 O WAT 5562 115.169 39.584 9.582 1.00 0.00 O ATOM 91926 H1 WAT 5562 114.364 40.100 9.543 1.00 0.00 H ATOM 91927 H2 WAT 5562 115.100 39.094 10.401 1.00 0.00 H TER 91929 WAT 5562 ATOM 91929 O WAT 5563 60.535 81.398 110.757 1.00 0.00 O ATOM 91930 H1 WAT 5563 59.744 81.413 110.219 1.00 0.00 H ATOM 91931 H2 WAT 5563 60.814 80.482 110.746 1.00 0.00 H TER 91933 WAT 5563 ATOM 91933 O WAT 5564 63.298 62.906 95.806 1.00 0.00 O ATOM 91934 H1 WAT 5564 63.787 62.101 95.975 1.00 0.00 H ATOM 91935 H2 WAT 5564 63.928 63.608 95.971 1.00 0.00 H TER 91937 WAT 5564 ATOM 91937 O WAT 5565 31.408 101.977 24.423 1.00 0.00 O ATOM 91938 H1 WAT 5565 31.843 101.130 24.323 1.00 0.00 H ATOM 91939 H2 WAT 5565 31.958 102.456 25.043 1.00 0.00 H TER 91941 WAT 5565 ATOM 91941 O WAT 5566 36.154 34.246 131.501 1.00 0.00 O ATOM 91942 H1 WAT 5566 36.533 33.395 131.721 1.00 0.00 H ATOM 91943 H2 WAT 5566 35.861 34.150 130.594 1.00 0.00 H TER 91945 WAT 5566 ATOM 91945 O WAT 5567 140.934 48.172 91.238 1.00 0.00 O ATOM 91946 H1 WAT 5567 140.822 48.954 91.779 1.00 0.00 H ATOM 91947 H2 WAT 5567 141.231 47.498 91.850 1.00 0.00 H TER 91949 WAT 5567 ATOM 91949 O WAT 5568 81.517 33.781 68.482 1.00 0.00 O ATOM 91950 H1 WAT 5568 81.163 32.983 68.875 1.00 0.00 H ATOM 91951 H2 WAT 5568 81.570 33.584 67.547 1.00 0.00 H TER 91953 WAT 5568 ATOM 91953 O WAT 5569 47.453 12.809 65.162 1.00 0.00 O ATOM 91954 H1 WAT 5569 48.191 13.337 65.467 1.00 0.00 H ATOM 91955 H2 WAT 5569 46.683 13.347 65.346 1.00 0.00 H TER 91957 WAT 5569 ATOM 91957 O WAT 5570 138.146 77.086 126.086 1.00 0.00 O ATOM 91958 H1 WAT 5570 138.628 76.293 125.852 1.00 0.00 H ATOM 91959 H2 WAT 5570 138.779 77.795 125.968 1.00 0.00 H TER 91961 WAT 5570 ATOM 91961 O WAT 5571 132.850 120.557 82.763 1.00 0.00 O ATOM 91962 H1 WAT 5571 132.573 121.014 81.968 1.00 0.00 H ATOM 91963 H2 WAT 5571 132.237 119.826 82.844 1.00 0.00 H TER 91965 WAT 5571 ATOM 91965 O WAT 5572 30.191 91.457 92.229 1.00 0.00 O ATOM 91966 H1 WAT 5572 29.790 90.691 92.638 1.00 0.00 H ATOM 91967 H2 WAT 5572 31.100 91.442 92.530 1.00 0.00 H TER 91969 WAT 5572 ATOM 91969 O WAT 5573 73.473 16.356 84.611 1.00 0.00 O ATOM 91970 H1 WAT 5573 74.003 17.148 84.699 1.00 0.00 H ATOM 91971 H2 WAT 5573 74.110 15.655 84.478 1.00 0.00 H TER 91973 WAT 5573 ATOM 91973 O WAT 5574 77.513 106.743 86.576 1.00 0.00 O ATOM 91974 H1 WAT 5574 77.504 105.891 86.139 1.00 0.00 H ATOM 91975 H2 WAT 5574 77.031 107.320 85.984 1.00 0.00 H TER 91977 WAT 5574 ATOM 91977 O WAT 5575 68.785 47.828 122.300 1.00 0.00 O ATOM 91978 H1 WAT 5575 68.336 48.598 121.952 1.00 0.00 H ATOM 91979 H2 WAT 5575 69.483 48.184 122.849 1.00 0.00 H TER 91981 WAT 5575 ATOM 91981 O WAT 5576 59.655 123.517 101.828 1.00 0.00 O ATOM 91982 H1 WAT 5576 58.939 122.946 102.105 1.00 0.00 H ATOM 91983 H2 WAT 5576 60.065 123.801 102.645 1.00 0.00 H TER 91985 WAT 5576 ATOM 91985 O WAT 5577 101.552 87.561 102.482 1.00 0.00 O ATOM 91986 H1 WAT 5577 101.236 87.399 103.371 1.00 0.00 H ATOM 91987 H2 WAT 5577 102.207 88.252 102.583 1.00 0.00 H TER 91989 WAT 5577 ATOM 91989 O WAT 5578 114.900 100.223 69.694 1.00 0.00 O ATOM 91990 H1 WAT 5578 114.343 99.858 69.006 1.00 0.00 H ATOM 91991 H2 WAT 5578 115.708 99.713 69.644 1.00 0.00 H TER 91993 WAT 5578 ATOM 91993 O WAT 5579 144.874 14.335 88.101 1.00 0.00 O ATOM 91994 H1 WAT 5579 144.627 13.466 88.419 1.00 0.00 H ATOM 91995 H2 WAT 5579 144.685 14.310 87.164 1.00 0.00 H TER 91997 WAT 5579 ATOM 91997 O WAT 5580 82.562 134.996 14.935 1.00 0.00 O ATOM 91998 H1 WAT 5580 82.719 135.417 15.780 1.00 0.00 H ATOM 91999 H2 WAT 5580 83.436 134.858 14.571 1.00 0.00 H TER 92001 WAT 5580 ATOM 92001 O WAT 5581 4.079 46.983 74.750 1.00 0.00 O ATOM 92002 H1 WAT 5581 3.990 46.722 73.833 1.00 0.00 H ATOM 92003 H2 WAT 5581 4.961 46.702 74.994 1.00 0.00 H TER 92005 WAT 5581 ATOM 92005 O WAT 5582 8.531 62.342 148.449 1.00 0.00 O ATOM 92006 H1 WAT 5582 8.604 61.423 148.706 1.00 0.00 H ATOM 92007 H2 WAT 5582 7.783 62.365 147.853 1.00 0.00 H TER 92009 WAT 5582 ATOM 92009 O WAT 5583 17.843 64.286 113.988 1.00 0.00 O ATOM 92010 H1 WAT 5583 17.006 64.747 114.047 1.00 0.00 H ATOM 92011 H2 WAT 5583 17.955 63.883 114.848 1.00 0.00 H TER 92013 WAT 5583 ATOM 92013 O WAT 5584 61.633 96.476 152.557 1.00 0.00 O ATOM 92014 H1 WAT 5584 61.619 95.774 151.906 1.00 0.00 H ATOM 92015 H2 WAT 5584 62.074 97.203 152.116 1.00 0.00 H TER 92017 WAT 5584 ATOM 92017 O WAT 5585 114.642 68.879 87.999 1.00 0.00 O ATOM 92018 H1 WAT 5585 115.484 69.099 87.600 1.00 0.00 H ATOM 92019 H2 WAT 5585 114.872 68.414 88.803 1.00 0.00 H TER 92021 WAT 5585 ATOM 92021 O WAT 5586 53.616 37.331 151.601 1.00 0.00 O ATOM 92022 H1 WAT 5586 53.869 37.944 152.292 1.00 0.00 H ATOM 92023 H2 WAT 5586 53.270 36.572 152.069 1.00 0.00 H TER 92025 WAT 5586 ATOM 92025 O WAT 5587 8.985 51.261 130.499 1.00 0.00 O ATOM 92026 H1 WAT 5587 9.175 50.401 130.123 1.00 0.00 H ATOM 92027 H2 WAT 5587 8.234 51.581 129.998 1.00 0.00 H TER 92029 WAT 5587 ATOM 92029 O WAT 5588 43.754 81.169 100.833 1.00 0.00 O ATOM 92030 H1 WAT 5588 43.435 80.462 101.394 1.00 0.00 H ATOM 92031 H2 WAT 5588 44.138 80.722 100.079 1.00 0.00 H TER 92033 WAT 5588 ATOM 92033 O WAT 5589 95.926 105.263 150.036 1.00 0.00 O ATOM 92034 H1 WAT 5589 95.393 105.819 150.604 1.00 0.00 H ATOM 92035 H2 WAT 5589 96.520 104.809 150.634 1.00 0.00 H TER 92037 WAT 5589 ATOM 92037 O WAT 5590 19.529 77.645 16.304 1.00 0.00 O ATOM 92038 H1 WAT 5590 20.075 76.950 15.936 1.00 0.00 H ATOM 92039 H2 WAT 5590 19.542 77.486 17.248 1.00 0.00 H TER 92041 WAT 5590 ATOM 92041 O WAT 5591 115.473 95.707 78.051 1.00 0.00 O ATOM 92042 H1 WAT 5591 115.665 96.607 77.790 1.00 0.00 H ATOM 92043 H2 WAT 5591 116.133 95.503 78.714 1.00 0.00 H TER 92045 WAT 5591 ATOM 92045 O WAT 5592 143.328 17.575 146.129 1.00 0.00 O ATOM 92046 H1 WAT 5592 143.414 17.189 147.001 1.00 0.00 H ATOM 92047 H2 WAT 5592 142.450 17.954 146.120 1.00 0.00 H TER 92049 WAT 5592 ATOM 92049 O WAT 5593 67.503 70.172 62.602 1.00 0.00 O ATOM 92050 H1 WAT 5593 67.490 70.908 61.990 1.00 0.00 H ATOM 92051 H2 WAT 5593 68.322 70.278 63.086 1.00 0.00 H TER 92053 WAT 5593 ATOM 92053 O WAT 5594 115.399 126.918 84.055 1.00 0.00 O ATOM 92054 H1 WAT 5594 115.580 127.767 84.459 1.00 0.00 H ATOM 92055 H2 WAT 5594 116.242 126.640 83.696 1.00 0.00 H TER 92057 WAT 5594 ATOM 92057 O WAT 5595 59.058 46.152 76.014 1.00 0.00 O ATOM 92058 H1 WAT 5595 59.013 45.223 76.240 1.00 0.00 H ATOM 92059 H2 WAT 5595 59.942 46.272 75.667 1.00 0.00 H TER 92061 WAT 5595 ATOM 92061 O WAT 5596 51.690 131.788 100.926 1.00 0.00 O ATOM 92062 H1 WAT 5596 52.265 131.043 100.747 1.00 0.00 H ATOM 92063 H2 WAT 5596 51.713 132.307 100.122 1.00 0.00 H TER 92065 WAT 5596 ATOM 92065 O WAT 5597 41.948 100.225 95.432 1.00 0.00 O ATOM 92066 H1 WAT 5597 42.612 100.914 95.411 1.00 0.00 H ATOM 92067 H2 WAT 5597 42.328 99.510 94.921 1.00 0.00 H TER 92069 WAT 5597 ATOM 92069 O WAT 5598 10.677 110.204 152.948 1.00 0.00 O ATOM 92070 H1 WAT 5598 11.517 109.853 153.244 1.00 0.00 H ATOM 92071 H2 WAT 5598 10.768 111.152 153.036 1.00 0.00 H TER 92073 WAT 5598 ATOM 92073 O WAT 5599 15.503 113.767 78.448 1.00 0.00 O ATOM 92074 H1 WAT 5599 15.468 113.111 77.752 1.00 0.00 H ATOM 92075 H2 WAT 5599 16.089 113.389 79.104 1.00 0.00 H TER 92077 WAT 5599 ATOM 92077 O WAT 5600 22.655 102.539 136.149 1.00 0.00 O ATOM 92078 H1 WAT 5600 21.894 102.505 135.569 1.00 0.00 H ATOM 92079 H2 WAT 5600 22.459 101.904 136.838 1.00 0.00 H TER 92081 WAT 5600 ATOM 92081 O WAT 5601 61.638 124.883 125.746 1.00 0.00 O ATOM 92082 H1 WAT 5601 61.014 125.064 125.043 1.00 0.00 H ATOM 92083 H2 WAT 5601 61.092 124.751 126.522 1.00 0.00 H TER 92085 WAT 5601 ATOM 92085 O WAT 5602 17.936 63.748 116.851 1.00 0.00 O ATOM 92086 H1 WAT 5602 17.091 64.168 117.006 1.00 0.00 H ATOM 92087 H2 WAT 5602 17.974 63.041 117.496 1.00 0.00 H TER 92089 WAT 5602 ATOM 92089 O WAT 5603 137.650 107.218 155.044 1.00 0.00 O ATOM 92090 H1 WAT 5603 137.054 106.666 154.537 1.00 0.00 H ATOM 92091 H2 WAT 5603 137.710 108.030 154.541 1.00 0.00 H TER 92093 WAT 5603 ATOM 92093 O WAT 5604 3.294 111.119 75.861 1.00 0.00 O ATOM 92094 H1 WAT 5604 2.578 111.535 76.340 1.00 0.00 H ATOM 92095 H2 WAT 5604 3.523 111.748 75.178 1.00 0.00 H TER 92097 WAT 5604 ATOM 92097 O WAT 5605 106.756 76.757 93.628 1.00 0.00 O ATOM 92098 H1 WAT 5605 107.660 76.457 93.728 1.00 0.00 H ATOM 92099 H2 WAT 5605 106.319 76.049 93.155 1.00 0.00 H TER 92101 WAT 5605 ATOM 92101 O WAT 5606 84.447 54.747 115.281 1.00 0.00 O ATOM 92102 H1 WAT 5606 85.092 55.125 115.878 1.00 0.00 H ATOM 92103 H2 WAT 5606 84.638 55.152 114.435 1.00 0.00 H TER 92105 WAT 5606 ATOM 92105 O WAT 5607 53.457 13.228 140.626 1.00 0.00 O ATOM 92106 H1 WAT 5607 52.905 13.915 140.251 1.00 0.00 H ATOM 92107 H2 WAT 5607 53.561 13.479 141.544 1.00 0.00 H TER 92109 WAT 5607 ATOM 92109 O WAT 5608 104.193 76.087 120.116 1.00 0.00 O ATOM 92110 H1 WAT 5608 103.441 76.675 120.055 1.00 0.00 H ATOM 92111 H2 WAT 5608 104.915 76.649 120.396 1.00 0.00 H TER 92113 WAT 5608 ATOM 92113 O WAT 5609 114.053 116.181 139.639 1.00 0.00 O ATOM 92114 H1 WAT 5609 113.239 115.710 139.464 1.00 0.00 H ATOM 92115 H2 WAT 5609 114.549 116.114 138.823 1.00 0.00 H TER 92117 WAT 5609 ATOM 92117 O WAT 5610 90.091 132.022 141.305 1.00 0.00 O ATOM 92118 H1 WAT 5610 90.305 132.087 142.235 1.00 0.00 H ATOM 92119 H2 WAT 5610 90.932 132.111 140.858 1.00 0.00 H TER 92121 WAT 5610 ATOM 92121 O WAT 5611 117.946 138.043 86.761 1.00 0.00 O ATOM 92122 H1 WAT 5611 118.601 138.219 86.085 1.00 0.00 H ATOM 92123 H2 WAT 5611 117.134 138.407 86.409 1.00 0.00 H TER 92125 WAT 5611 ATOM 92125 O WAT 5612 78.520 121.595 75.325 1.00 0.00 O ATOM 92126 H1 WAT 5612 77.807 122.130 75.674 1.00 0.00 H ATOM 92127 H2 WAT 5612 79.241 122.211 75.197 1.00 0.00 H TER 92129 WAT 5612 ATOM 92129 O WAT 5613 125.613 142.838 137.227 1.00 0.00 O ATOM 92130 H1 WAT 5613 125.934 143.679 136.901 1.00 0.00 H ATOM 92131 H2 WAT 5613 126.124 142.185 136.749 1.00 0.00 H TER 92133 WAT 5613 ATOM 92133 O WAT 5614 37.277 93.706 156.730 1.00 0.00 O ATOM 92134 H1 WAT 5614 37.089 94.645 156.756 1.00 0.00 H ATOM 92135 H2 WAT 5614 36.935 93.371 157.559 1.00 0.00 H TER 92137 WAT 5614 ATOM 92137 O WAT 5615 98.362 126.316 149.006 1.00 0.00 O ATOM 92138 H1 WAT 5615 97.618 125.926 148.548 1.00 0.00 H ATOM 92139 H2 WAT 5615 99.124 125.843 148.670 1.00 0.00 H TER 92141 WAT 5615 ATOM 92141 O WAT 5616 4.428 134.727 153.177 1.00 0.00 O ATOM 92142 H1 WAT 5616 3.818 134.112 152.770 1.00 0.00 H ATOM 92143 H2 WAT 5616 3.869 135.415 153.537 1.00 0.00 H TER 92145 WAT 5616 ATOM 92145 O WAT 5617 136.996 49.495 60.082 1.00 0.00 O ATOM 92146 H1 WAT 5617 137.766 49.235 59.576 1.00 0.00 H ATOM 92147 H2 WAT 5617 136.331 49.691 59.422 1.00 0.00 H TER 92149 WAT 5617 ATOM 92149 O WAT 5618 41.069 124.262 5.088 1.00 0.00 O ATOM 92150 H1 WAT 5618 40.864 125.196 5.130 1.00 0.00 H ATOM 92151 H2 WAT 5618 41.678 124.183 4.354 1.00 0.00 H TER 92153 WAT 5618 ATOM 92153 O WAT 5619 31.405 77.410 137.030 1.00 0.00 O ATOM 92154 H1 WAT 5619 31.074 77.339 137.925 1.00 0.00 H ATOM 92155 H2 WAT 5619 32.357 77.360 137.122 1.00 0.00 H TER 92157 WAT 5619 ATOM 92157 O WAT 5620 92.145 111.815 3.241 1.00 0.00 O ATOM 92158 H1 WAT 5620 92.652 112.462 2.750 1.00 0.00 H ATOM 92159 H2 WAT 5620 92.270 112.059 4.158 1.00 0.00 H TER 92161 WAT 5620 ATOM 92161 O WAT 5621 84.347 104.592 62.023 1.00 0.00 O ATOM 92162 H1 WAT 5621 84.764 103.803 61.678 1.00 0.00 H ATOM 92163 H2 WAT 5621 83.409 104.434 61.917 1.00 0.00 H TER 92165 WAT 5621 ATOM 92165 O WAT 5622 141.875 27.453 9.942 1.00 0.00 O ATOM 92166 H1 WAT 5622 142.574 27.304 9.306 1.00 0.00 H ATOM 92167 H2 WAT 5622 141.624 26.576 10.233 1.00 0.00 H TER 92169 WAT 5622 ATOM 92169 O WAT 5623 85.943 54.180 56.903 1.00 0.00 O ATOM 92170 H1 WAT 5623 85.632 54.674 56.144 1.00 0.00 H ATOM 92171 H2 WAT 5623 85.157 53.764 57.255 1.00 0.00 H TER 92173 WAT 5623 ATOM 92173 O WAT 5624 140.253 37.091 127.652 1.00 0.00 O ATOM 92174 H1 WAT 5624 140.739 37.768 128.124 1.00 0.00 H ATOM 92175 H2 WAT 5624 140.389 37.300 126.728 1.00 0.00 H TER 92177 WAT 5624 ATOM 92177 O WAT 5625 62.767 112.664 135.368 1.00 0.00 O ATOM 92178 H1 WAT 5625 63.447 112.826 134.713 1.00 0.00 H ATOM 92179 H2 WAT 5625 61.966 113.004 134.969 1.00 0.00 H TER 92181 WAT 5625 ATOM 92181 O WAT 5626 43.635 95.520 148.932 1.00 0.00 O ATOM 92182 H1 WAT 5626 43.511 94.675 149.364 1.00 0.00 H ATOM 92183 H2 WAT 5626 42.861 95.621 148.378 1.00 0.00 H TER 92185 WAT 5626 ATOM 92185 O WAT 5627 132.504 30.222 138.882 1.00 0.00 O ATOM 92186 H1 WAT 5627 132.306 31.112 139.173 1.00 0.00 H ATOM 92187 H2 WAT 5627 133.264 29.963 139.403 1.00 0.00 H TER 92189 WAT 5627 ATOM 92189 O WAT 5628 61.897 85.584 118.365 1.00 0.00 O ATOM 92190 H1 WAT 5628 62.587 85.381 118.996 1.00 0.00 H ATOM 92191 H2 WAT 5628 61.925 84.860 117.739 1.00 0.00 H TER 92193 WAT 5628 ATOM 92193 O WAT 5629 44.758 105.162 146.384 1.00 0.00 O ATOM 92194 H1 WAT 5629 44.621 106.110 146.385 1.00 0.00 H ATOM 92195 H2 WAT 5629 43.996 104.810 146.843 1.00 0.00 H TER 92197 WAT 5629 ATOM 92197 O WAT 5630 4.672 41.535 95.079 1.00 0.00 O ATOM 92198 H1 WAT 5630 4.088 41.061 95.672 1.00 0.00 H ATOM 92199 H2 WAT 5630 5.541 41.433 95.467 1.00 0.00 H TER 92201 WAT 5630 ATOM 92201 O WAT 5631 97.750 38.018 10.577 1.00 0.00 O ATOM 92202 H1 WAT 5631 98.378 38.728 10.443 1.00 0.00 H ATOM 92203 H2 WAT 5631 97.544 37.710 9.695 1.00 0.00 H TER 92205 WAT 5631 ATOM 92205 O WAT 5632 132.748 61.616 1.204 1.00 0.00 O ATOM 92206 H1 WAT 5632 133.389 61.499 1.906 1.00 0.00 H ATOM 92207 H2 WAT 5632 131.997 61.088 1.475 1.00 0.00 H TER 92209 WAT 5632 ATOM 92209 O WAT 5633 139.152 122.996 113.290 1.00 0.00 O ATOM 92210 H1 WAT 5633 138.549 122.507 112.730 1.00 0.00 H ATOM 92211 H2 WAT 5633 139.087 123.899 112.980 1.00 0.00 H TER 92213 WAT 5633 ATOM 92213 O WAT 5634 25.995 105.058 151.927 1.00 0.00 O ATOM 92214 H1 WAT 5634 25.902 104.203 151.507 1.00 0.00 H ATOM 92215 H2 WAT 5634 26.454 104.873 152.746 1.00 0.00 H TER 92217 WAT 5634 ATOM 92217 O WAT 5635 54.541 104.049 5.918 1.00 0.00 O ATOM 92218 H1 WAT 5635 54.029 103.976 5.113 1.00 0.00 H ATOM 92219 H2 WAT 5635 54.238 103.321 6.461 1.00 0.00 H TER 92221 WAT 5635 ATOM 92221 O WAT 5636 5.312 53.980 132.033 1.00 0.00 O ATOM 92222 H1 WAT 5636 5.829 54.769 131.871 1.00 0.00 H ATOM 92223 H2 WAT 5636 5.732 53.568 132.787 1.00 0.00 H TER 92225 WAT 5636 ATOM 92225 O WAT 5637 22.657 10.116 87.325 1.00 0.00 O ATOM 92226 H1 WAT 5637 22.637 10.759 88.033 1.00 0.00 H ATOM 92227 H2 WAT 5637 23.564 9.811 87.304 1.00 0.00 H TER 92229 WAT 5637 ATOM 92229 O WAT 5638 120.285 52.507 23.633 1.00 0.00 O ATOM 92230 H1 WAT 5638 119.710 51.795 23.353 1.00 0.00 H ATOM 92231 H2 WAT 5638 119.849 53.302 23.326 1.00 0.00 H TER 92233 WAT 5638 ATOM 92233 O WAT 5639 130.996 27.793 111.115 1.00 0.00 O ATOM 92234 H1 WAT 5639 131.662 27.191 110.781 1.00 0.00 H ATOM 92235 H2 WAT 5639 131.484 28.580 111.355 1.00 0.00 H TER 92237 WAT 5639 ATOM 92237 O WAT 5640 29.411 123.389 156.388 1.00 0.00 O ATOM 92238 H1 WAT 5640 30.349 123.464 156.208 1.00 0.00 H ATOM 92239 H2 WAT 5640 29.005 124.041 155.817 1.00 0.00 H TER 92241 WAT 5640 ATOM 92241 O WAT 5641 55.297 71.292 26.005 1.00 0.00 O ATOM 92242 H1 WAT 5641 54.483 71.043 25.567 1.00 0.00 H ATOM 92243 H2 WAT 5641 55.704 71.925 25.414 1.00 0.00 H TER 92245 WAT 5641 ATOM 92245 O WAT 5642 35.721 29.766 138.781 1.00 0.00 O ATOM 92246 H1 WAT 5642 35.730 29.219 137.996 1.00 0.00 H ATOM 92247 H2 WAT 5642 35.996 29.179 139.486 1.00 0.00 H TER 92249 WAT 5642 ATOM 92249 O WAT 5643 75.814 121.222 105.532 1.00 0.00 O ATOM 92250 H1 WAT 5643 75.944 121.648 106.379 1.00 0.00 H ATOM 92251 H2 WAT 5643 76.121 121.863 104.891 1.00 0.00 H TER 92253 WAT 5643 ATOM 92253 O WAT 5644 75.114 88.270 137.047 1.00 0.00 O ATOM 92254 H1 WAT 5644 75.624 88.949 137.490 1.00 0.00 H ATOM 92255 H2 WAT 5644 75.546 88.162 136.200 1.00 0.00 H TER 92257 WAT 5644 ATOM 92257 O WAT 5645 99.048 123.146 111.328 1.00 0.00 O ATOM 92258 H1 WAT 5645 99.566 122.341 111.322 1.00 0.00 H ATOM 92259 H2 WAT 5645 99.563 123.758 111.854 1.00 0.00 H TER 92261 WAT 5645 ATOM 92261 O WAT 5646 145.381 122.274 110.081 1.00 0.00 O ATOM 92262 H1 WAT 5646 145.115 123.168 109.866 1.00 0.00 H ATOM 92263 H2 WAT 5646 145.978 122.373 110.823 1.00 0.00 H TER 92265 WAT 5646 ATOM 92265 O WAT 5647 133.515 70.780 109.529 1.00 0.00 O ATOM 92266 H1 WAT 5647 133.563 71.660 109.157 1.00 0.00 H ATOM 92267 H2 WAT 5647 133.114 70.250 108.840 1.00 0.00 H TER 92269 WAT 5647 ATOM 92269 O WAT 5648 15.623 143.213 116.266 1.00 0.00 O ATOM 92270 H1 WAT 5648 16.069 142.436 116.604 1.00 0.00 H ATOM 92271 H2 WAT 5648 15.945 143.930 116.812 1.00 0.00 H TER 92273 WAT 5648 ATOM 92273 O WAT 5649 96.101 136.769 10.235 1.00 0.00 O ATOM 92274 H1 WAT 5649 95.634 136.294 9.547 1.00 0.00 H ATOM 92275 H2 WAT 5649 95.570 136.637 11.020 1.00 0.00 H TER 92277 WAT 5649 ATOM 92277 O WAT 5650 53.669 115.271 107.549 1.00 0.00 O ATOM 92278 H1 WAT 5650 54.506 115.061 107.964 1.00 0.00 H ATOM 92279 H2 WAT 5650 53.616 114.676 106.801 1.00 0.00 H TER 92281 WAT 5650 ATOM 92281 O WAT 5651 50.017 42.368 125.353 1.00 0.00 O ATOM 92282 H1 WAT 5651 49.762 42.404 124.432 1.00 0.00 H ATOM 92283 H2 WAT 5651 50.869 42.802 125.383 1.00 0.00 H TER 92285 WAT 5651 ATOM 92285 O WAT 5652 81.124 63.899 137.709 1.00 0.00 O ATOM 92286 H1 WAT 5652 81.655 64.604 138.080 1.00 0.00 H ATOM 92287 H2 WAT 5652 80.646 64.313 136.990 1.00 0.00 H TER 92289 WAT 5652 ATOM 92289 O WAT 5653 81.272 74.563 156.990 1.00 0.00 O ATOM 92290 H1 WAT 5653 80.473 74.713 156.484 1.00 0.00 H ATOM 92291 H2 WAT 5653 81.047 74.835 157.880 1.00 0.00 H TER 92293 WAT 5653 ATOM 92293 O WAT 5654 125.084 61.591 79.468 1.00 0.00 O ATOM 92294 H1 WAT 5654 124.719 62.421 79.776 1.00 0.00 H ATOM 92295 H2 WAT 5654 124.325 61.016 79.373 1.00 0.00 H TER 92297 WAT 5654 ATOM 92297 O WAT 5655 48.479 109.158 13.264 1.00 0.00 O ATOM 92298 H1 WAT 5655 47.623 108.764 13.095 1.00 0.00 H ATOM 92299 H2 WAT 5655 48.280 109.988 13.696 1.00 0.00 H TER 92301 WAT 5655 ATOM 92301 O WAT 5656 47.764 76.867 106.411 1.00 0.00 O ATOM 92302 H1 WAT 5656 47.477 77.612 106.939 1.00 0.00 H ATOM 92303 H2 WAT 5656 48.444 76.447 106.938 1.00 0.00 H TER 92305 WAT 5656 ATOM 92305 O WAT 5657 23.930 14.656 111.181 1.00 0.00 O ATOM 92306 H1 WAT 5657 23.229 14.308 111.733 1.00 0.00 H ATOM 92307 H2 WAT 5657 24.131 13.944 110.573 1.00 0.00 H TER 92309 WAT 5657 ATOM 92309 O WAT 5658 143.955 79.354 149.351 1.00 0.00 O ATOM 92310 H1 WAT 5658 143.785 80.211 149.742 1.00 0.00 H ATOM 92311 H2 WAT 5658 143.921 79.509 148.408 1.00 0.00 H TER 92313 WAT 5658 ATOM 92313 O WAT 5659 137.862 62.191 153.026 1.00 0.00 O ATOM 92314 H1 WAT 5659 138.463 62.924 152.893 1.00 0.00 H ATOM 92315 H2 WAT 5659 138.228 61.483 152.496 1.00 0.00 H TER 92317 WAT 5659 ATOM 92317 O WAT 5660 109.240 9.727 72.454 1.00 0.00 O ATOM 92318 H1 WAT 5660 109.191 10.514 72.997 1.00 0.00 H ATOM 92319 H2 WAT 5660 108.437 9.744 71.933 1.00 0.00 H TER 92321 WAT 5660 ATOM 92321 O WAT 5661 90.067 11.897 19.938 1.00 0.00 O ATOM 92322 H1 WAT 5661 89.881 11.021 19.599 1.00 0.00 H ATOM 92323 H2 WAT 5661 90.491 12.351 19.210 1.00 0.00 H TER 92325 WAT 5661 ATOM 92325 O WAT 5662 56.688 27.427 118.744 1.00 0.00 O ATOM 92326 H1 WAT 5662 56.936 26.574 118.389 1.00 0.00 H ATOM 92327 H2 WAT 5662 56.251 27.224 119.572 1.00 0.00 H TER 92329 WAT 5662 ATOM 92329 O WAT 5663 144.682 131.757 65.217 1.00 0.00 O ATOM 92330 H1 WAT 5663 145.414 131.439 64.689 1.00 0.00 H ATOM 92331 H2 WAT 5663 145.050 132.480 65.726 1.00 0.00 H TER 92333 WAT 5663 ATOM 92333 O WAT 5664 26.335 14.755 106.940 1.00 0.00 O ATOM 92334 H1 WAT 5664 26.987 15.360 107.292 1.00 0.00 H ATOM 92335 H2 WAT 5664 25.511 15.029 107.343 1.00 0.00 H TER 92337 WAT 5664 ATOM 92337 O WAT 5665 4.945 0.348 6.328 1.00 0.00 O ATOM 92338 H1 WAT 5665 4.236 -0.076 6.812 1.00 0.00 H ATOM 92339 H2 WAT 5665 4.626 1.235 6.164 1.00 0.00 H TER 92341 WAT 5665 ATOM 92341 O WAT 5666 75.624 69.561 81.710 1.00 0.00 O ATOM 92342 H1 WAT 5666 75.376 69.293 80.825 1.00 0.00 H ATOM 92343 H2 WAT 5666 76.292 68.928 81.973 1.00 0.00 H TER 92345 WAT 5666 ATOM 92345 O WAT 5667 132.641 145.790 104.498 1.00 0.00 O ATOM 92346 H1 WAT 5667 133.083 146.594 104.226 1.00 0.00 H ATOM 92347 H2 WAT 5667 132.824 145.167 103.795 1.00 0.00 H TER 92349 WAT 5667 ATOM 92349 O WAT 5668 114.022 125.219 101.417 1.00 0.00 O ATOM 92350 H1 WAT 5668 113.670 125.514 100.577 1.00 0.00 H ATOM 92351 H2 WAT 5668 114.514 124.426 101.206 1.00 0.00 H TER 92353 WAT 5668 ATOM 92353 O WAT 5669 7.116 57.658 87.663 1.00 0.00 O ATOM 92354 H1 WAT 5669 6.829 58.561 87.797 1.00 0.00 H ATOM 92355 H2 WAT 5669 7.638 57.455 88.439 1.00 0.00 H TER 92357 WAT 5669 ATOM 92357 O WAT 5670 144.766 57.682 7.809 1.00 0.00 O ATOM 92358 H1 WAT 5670 144.383 56.811 7.709 1.00 0.00 H ATOM 92359 H2 WAT 5670 144.771 57.835 8.754 1.00 0.00 H TER 92361 WAT 5670 ATOM 92361 O WAT 5671 131.238 105.406 9.809 1.00 0.00 O ATOM 92362 H1 WAT 5671 130.356 105.467 10.176 1.00 0.00 H ATOM 92363 H2 WAT 5671 131.116 105.540 8.869 1.00 0.00 H TER 92365 WAT 5671 ATOM 92365 O WAT 5672 74.056 113.559 11.182 1.00 0.00 O ATOM 92366 H1 WAT 5672 73.105 113.616 11.276 1.00 0.00 H ATOM 92367 H2 WAT 5672 74.284 112.710 11.562 1.00 0.00 H TER 92369 WAT 5672 ATOM 92369 O WAT 5673 42.385 99.969 91.040 1.00 0.00 O ATOM 92370 H1 WAT 5673 43.294 100.267 91.017 1.00 0.00 H ATOM 92371 H2 WAT 5673 42.036 100.197 90.178 1.00 0.00 H TER 92373 WAT 5673 ATOM 92373 O WAT 5674 114.915 111.328 69.032 1.00 0.00 O ATOM 92374 H1 WAT 5674 114.945 112.153 69.516 1.00 0.00 H ATOM 92375 H2 WAT 5674 114.750 111.588 68.126 1.00 0.00 H TER 92377 WAT 5674 ATOM 92377 O WAT 5675 126.251 129.741 104.680 1.00 0.00 O ATOM 92378 H1 WAT 5675 126.154 129.077 103.997 1.00 0.00 H ATOM 92379 H2 WAT 5675 127.116 129.575 105.054 1.00 0.00 H TER 92381 WAT 5675 ATOM 92381 O WAT 5676 131.373 43.629 123.522 1.00 0.00 O ATOM 92382 H1 WAT 5676 132.049 44.303 123.585 1.00 0.00 H ATOM 92383 H2 WAT 5676 130.606 44.091 123.181 1.00 0.00 H TER 92385 WAT 5676 ATOM 92385 O WAT 5677 28.468 74.373 145.068 1.00 0.00 O ATOM 92386 H1 WAT 5677 29.056 75.022 144.679 1.00 0.00 H ATOM 92387 H2 WAT 5677 27.593 74.741 144.949 1.00 0.00 H TER 92389 WAT 5677 ATOM 92389 O WAT 5678 46.420 8.727 61.614 1.00 0.00 O ATOM 92390 H1 WAT 5678 47.117 8.481 62.222 1.00 0.00 H ATOM 92391 H2 WAT 5678 46.478 8.081 60.910 1.00 0.00 H TER 92393 WAT 5678 ATOM 92393 O WAT 5679 121.222 74.158 116.405 1.00 0.00 O ATOM 92394 H1 WAT 5679 120.516 73.752 115.902 1.00 0.00 H ATOM 92395 H2 WAT 5679 121.561 74.844 115.831 1.00 0.00 H TER 92397 WAT 5679 ATOM 92397 O WAT 5680 138.057 88.959 33.367 1.00 0.00 O ATOM 92398 H1 WAT 5680 138.448 88.883 34.237 1.00 0.00 H ATOM 92399 H2 WAT 5680 138.729 88.626 32.772 1.00 0.00 H TER 92401 WAT 5680 ATOM 92401 O WAT 5681 13.672 80.105 135.846 1.00 0.00 O ATOM 92402 H1 WAT 5681 14.152 80.545 136.548 1.00 0.00 H ATOM 92403 H2 WAT 5681 14.247 80.174 135.084 1.00 0.00 H TER 92405 WAT 5681 ATOM 92405 O WAT 5682 50.333 86.499 122.164 1.00 0.00 O ATOM 92406 H1 WAT 5682 49.393 86.674 122.117 1.00 0.00 H ATOM 92407 H2 WAT 5682 50.504 85.914 121.426 1.00 0.00 H TER 92409 WAT 5682 ATOM 92409 O WAT 5683 77.779 125.890 123.811 1.00 0.00 O ATOM 92410 H1 WAT 5683 78.311 126.023 124.595 1.00 0.00 H ATOM 92411 H2 WAT 5683 78.145 125.104 123.404 1.00 0.00 H TER 92413 WAT 5683 ATOM 92413 O WAT 5684 40.097 74.020 76.367 1.00 0.00 O ATOM 92414 H1 WAT 5684 39.745 73.532 75.623 1.00 0.00 H ATOM 92415 H2 WAT 5684 40.952 74.330 76.067 1.00 0.00 H TER 92417 WAT 5684 ATOM 92417 O WAT 5685 15.933 119.047 28.725 1.00 0.00 O ATOM 92418 H1 WAT 5685 16.219 118.209 28.363 1.00 0.00 H ATOM 92419 H2 WAT 5685 15.967 119.652 27.984 1.00 0.00 H TER 92421 WAT 5685 ATOM 92421 O WAT 5686 128.890 114.611 113.194 1.00 0.00 O ATOM 92422 H1 WAT 5686 128.762 115.446 112.743 1.00 0.00 H ATOM 92423 H2 WAT 5686 129.351 114.063 112.559 1.00 0.00 H TER 92425 WAT 5686 ATOM 92425 O WAT 5687 102.627 38.810 66.423 1.00 0.00 O ATOM 92426 H1 WAT 5687 103.159 38.864 65.629 1.00 0.00 H ATOM 92427 H2 WAT 5687 101.825 38.369 66.144 1.00 0.00 H TER 92429 WAT 5687 ATOM 92429 O WAT 5688 47.861 11.800 15.702 1.00 0.00 O ATOM 92430 H1 WAT 5688 48.335 12.491 15.239 1.00 0.00 H ATOM 92431 H2 WAT 5688 48.184 10.987 15.313 1.00 0.00 H TER 92433 WAT 5688 ATOM 92433 O WAT 5689 17.183 116.339 6.908 1.00 0.00 O ATOM 92434 H1 WAT 5689 16.798 116.651 7.727 1.00 0.00 H ATOM 92435 H2 WAT 5689 17.905 115.774 7.182 1.00 0.00 H TER 92437 WAT 5689 ATOM 92437 O WAT 5690 61.539 17.614 10.038 1.00 0.00 O ATOM 92438 H1 WAT 5690 61.170 18.396 9.627 1.00 0.00 H ATOM 92439 H2 WAT 5690 60.878 17.343 10.675 1.00 0.00 H TER 92441 WAT 5690 ATOM 92441 O WAT 5691 86.952 17.330 114.544 1.00 0.00 O ATOM 92442 H1 WAT 5691 86.615 18.081 114.054 1.00 0.00 H ATOM 92443 H2 WAT 5691 87.557 17.712 115.181 1.00 0.00 H TER 92445 WAT 5691 ATOM 92445 O WAT 5692 94.408 15.420 78.638 1.00 0.00 O ATOM 92446 H1 WAT 5692 94.381 16.374 78.567 1.00 0.00 H ATOM 92447 H2 WAT 5692 95.138 15.244 79.232 1.00 0.00 H TER 92449 WAT 5692 ATOM 92449 O WAT 5693 69.506 61.460 13.647 1.00 0.00 O ATOM 92450 H1 WAT 5693 69.895 60.702 14.084 1.00 0.00 H ATOM 92451 H2 WAT 5693 68.657 61.147 13.334 1.00 0.00 H TER 92453 WAT 5693 ATOM 92453 O WAT 5694 144.814 102.950 107.916 1.00 0.00 O ATOM 92454 H1 WAT 5694 145.339 103.226 108.667 1.00 0.00 H ATOM 92455 H2 WAT 5694 145.449 102.581 107.303 1.00 0.00 H TER 92457 WAT 5694 ATOM 92457 O WAT 5695 87.064 92.839 61.677 1.00 0.00 O ATOM 92458 H1 WAT 5695 86.503 93.556 61.381 1.00 0.00 H ATOM 92459 H2 WAT 5695 86.809 92.094 61.132 1.00 0.00 H TER 92461 WAT 5695 ATOM 92461 O WAT 5696 128.107 20.825 130.819 1.00 0.00 O ATOM 92462 H1 WAT 5696 128.834 21.034 131.406 1.00 0.00 H ATOM 92463 H2 WAT 5696 127.504 21.562 130.913 1.00 0.00 H TER 92465 WAT 5696 ATOM 92465 O WAT 5697 19.182 96.927 147.148 1.00 0.00 O ATOM 92466 H1 WAT 5697 19.863 96.338 147.473 1.00 0.00 H ATOM 92467 H2 WAT 5697 18.833 96.485 146.374 1.00 0.00 H TER 92469 WAT 5697 ATOM 92469 O WAT 5698 24.712 17.544 144.355 1.00 0.00 O ATOM 92470 H1 WAT 5698 24.000 17.921 143.839 1.00 0.00 H ATOM 92471 H2 WAT 5698 25.301 18.280 144.525 1.00 0.00 H TER 92473 WAT 5698 ATOM 92473 O WAT 5699 82.498 52.026 88.857 1.00 0.00 O ATOM 92474 H1 WAT 5699 81.957 51.244 88.966 1.00 0.00 H ATOM 92475 H2 WAT 5699 82.019 52.715 89.318 1.00 0.00 H TER 92477 WAT 5699 ATOM 92477 O WAT 5700 45.886 123.385 143.247 1.00 0.00 O ATOM 92478 H1 WAT 5700 45.714 123.776 142.390 1.00 0.00 H ATOM 92479 H2 WAT 5700 45.021 123.139 143.575 1.00 0.00 H TER 92481 WAT 5700 ATOM 92481 O WAT 5701 67.653 61.110 109.819 1.00 0.00 O ATOM 92482 H1 WAT 5701 68.076 61.315 110.653 1.00 0.00 H ATOM 92483 H2 WAT 5701 67.774 60.166 109.715 1.00 0.00 H TER 92485 WAT 5701 ATOM 92485 O WAT 5702 68.347 64.686 122.961 1.00 0.00 O ATOM 92486 H1 WAT 5702 68.116 65.614 123.010 1.00 0.00 H ATOM 92487 H2 WAT 5702 67.530 64.226 123.151 1.00 0.00 H TER 92489 WAT 5702 ATOM 92489 O WAT 5703 29.367 57.389 11.193 1.00 0.00 O ATOM 92490 H1 WAT 5703 29.500 56.866 11.984 1.00 0.00 H ATOM 92491 H2 WAT 5703 29.924 58.157 11.317 1.00 0.00 H TER 92493 WAT 5703 ATOM 92493 O WAT 5704 120.618 61.965 85.068 1.00 0.00 O ATOM 92494 H1 WAT 5704 120.872 62.041 85.988 1.00 0.00 H ATOM 92495 H2 WAT 5704 119.791 62.443 85.007 1.00 0.00 H TER 92497 WAT 5704 ATOM 92497 O WAT 5705 29.458 5.463 20.722 1.00 0.00 O ATOM 92498 H1 WAT 5705 29.153 6.208 21.240 1.00 0.00 H ATOM 92499 H2 WAT 5705 28.678 4.923 20.595 1.00 0.00 H TER 92501 WAT 5705 ATOM 92501 O WAT 5706 26.435 100.018 62.935 1.00 0.00 O ATOM 92502 H1 WAT 5706 26.167 100.748 63.494 1.00 0.00 H ATOM 92503 H2 WAT 5706 25.612 99.634 62.633 1.00 0.00 H TER 92505 WAT 5706 ATOM 92505 O WAT 5707 26.118 59.901 65.709 1.00 0.00 O ATOM 92506 H1 WAT 5707 27.062 59.958 65.563 1.00 0.00 H ATOM 92507 H2 WAT 5707 25.903 58.984 65.534 1.00 0.00 H TER 92509 WAT 5707 ATOM 92509 O WAT 5708 143.855 67.471 105.414 1.00 0.00 O ATOM 92510 H1 WAT 5708 143.875 68.134 104.724 1.00 0.00 H ATOM 92511 H2 WAT 5708 144.732 67.499 105.798 1.00 0.00 H TER 92513 WAT 5708 ATOM 92513 O WAT 5709 10.330 6.000 137.307 1.00 0.00 O ATOM 92514 H1 WAT 5709 10.184 5.970 136.361 1.00 0.00 H ATOM 92515 H2 WAT 5709 10.786 5.182 137.505 1.00 0.00 H TER 92517 WAT 5709 ATOM 92517 O WAT 5710 122.190 24.809 96.260 1.00 0.00 O ATOM 92518 H1 WAT 5710 121.617 24.611 97.000 1.00 0.00 H ATOM 92519 H2 WAT 5710 122.994 24.323 96.442 1.00 0.00 H TER 92521 WAT 5710 ATOM 92521 O WAT 5711 89.966 10.428 10.774 1.00 0.00 O ATOM 92522 H1 WAT 5711 89.751 10.644 9.867 1.00 0.00 H ATOM 92523 H2 WAT 5711 90.708 9.827 10.707 1.00 0.00 H TER 92525 WAT 5711 ATOM 92525 O WAT 5712 38.352 75.186 146.432 1.00 0.00 O ATOM 92526 H1 WAT 5712 38.057 74.299 146.637 1.00 0.00 H ATOM 92527 H2 WAT 5712 39.224 75.068 146.054 1.00 0.00 H TER 92529 WAT 5712 ATOM 92529 O WAT 5713 93.714 70.361 113.170 1.00 0.00 O ATOM 92530 H1 WAT 5713 93.551 70.049 112.280 1.00 0.00 H ATOM 92531 H2 WAT 5713 93.962 71.279 113.060 1.00 0.00 H TER 92533 WAT 5713 ATOM 92533 O WAT 5714 32.267 12.406 120.552 1.00 0.00 O ATOM 92534 H1 WAT 5714 32.105 12.793 121.412 1.00 0.00 H ATOM 92535 H2 WAT 5714 31.734 11.611 120.543 1.00 0.00 H TER 92537 WAT 5714 ATOM 92537 O WAT 5715 117.879 11.823 99.746 1.00 0.00 O ATOM 92538 H1 WAT 5715 117.859 12.584 99.167 1.00 0.00 H ATOM 92539 H2 WAT 5715 117.286 12.052 100.462 1.00 0.00 H TER 92541 WAT 5715 ATOM 92541 O WAT 5716 0.578 80.668 79.704 1.00 0.00 O ATOM 92542 H1 WAT 5716 -0.105 81.081 80.232 1.00 0.00 H ATOM 92543 H2 WAT 5716 0.115 80.009 79.187 1.00 0.00 H TER 92545 WAT 5716 ATOM 92545 O WAT 5717 55.764 15.907 124.086 1.00 0.00 O ATOM 92546 H1 WAT 5717 56.662 15.682 123.844 1.00 0.00 H ATOM 92547 H2 WAT 5717 55.691 15.646 125.004 1.00 0.00 H TER 92549 WAT 5717 ATOM 92549 O WAT 5718 5.249 123.933 116.037 1.00 0.00 O ATOM 92550 H1 WAT 5718 4.684 124.022 116.804 1.00 0.00 H ATOM 92551 H2 WAT 5718 5.348 122.988 115.921 1.00 0.00 H TER 92553 WAT 5718 ATOM 92553 O WAT 5719 100.066 139.520 114.718 1.00 0.00 O ATOM 92554 H1 WAT 5719 99.968 139.772 113.800 1.00 0.00 H ATOM 92555 H2 WAT 5719 99.204 139.187 114.969 1.00 0.00 H TER 92557 WAT 5719 ATOM 92557 O WAT 5720 142.263 102.269 89.375 1.00 0.00 O ATOM 92558 H1 WAT 5720 141.857 101.881 88.600 1.00 0.00 H ATOM 92559 H2 WAT 5720 141.561 102.293 90.026 1.00 0.00 H TER 92561 WAT 5720 ATOM 92561 O WAT 5721 58.330 8.599 136.536 1.00 0.00 O ATOM 92562 H1 WAT 5721 58.223 8.509 135.589 1.00 0.00 H ATOM 92563 H2 WAT 5721 57.436 8.608 136.877 1.00 0.00 H TER 92565 WAT 5721 ATOM 92565 O WAT 5722 48.733 0.704 156.245 1.00 0.00 O ATOM 92566 H1 WAT 5722 48.006 0.263 156.686 1.00 0.00 H ATOM 92567 H2 WAT 5722 48.320 1.189 155.530 1.00 0.00 H TER 92569 WAT 5722 ATOM 92569 O WAT 5723 129.515 61.156 123.022 1.00 0.00 O ATOM 92570 H1 WAT 5723 129.771 61.388 122.130 1.00 0.00 H ATOM 92571 H2 WAT 5723 130.053 61.718 123.579 1.00 0.00 H TER 92573 WAT 5723 ATOM 92573 O WAT 5724 98.088 86.192 107.868 1.00 0.00 O ATOM 92574 H1 WAT 5724 97.217 86.071 108.247 1.00 0.00 H ATOM 92575 H2 WAT 5724 97.972 86.885 107.218 1.00 0.00 H TER 92577 WAT 5724 ATOM 92577 O WAT 5725 127.641 62.680 3.218 1.00 0.00 O ATOM 92578 H1 WAT 5725 128.496 63.028 2.964 1.00 0.00 H ATOM 92579 H2 WAT 5725 127.623 62.763 4.171 1.00 0.00 H TER 92581 WAT 5725 ATOM 92581 O WAT 5726 144.863 120.878 78.680 1.00 0.00 O ATOM 92582 H1 WAT 5726 144.279 121.525 79.077 1.00 0.00 H ATOM 92583 H2 WAT 5726 145.165 121.293 77.872 1.00 0.00 H TER 92585 WAT 5726 ATOM 92585 O WAT 5727 117.516 111.547 68.078 1.00 0.00 O ATOM 92586 H1 WAT 5727 117.594 110.684 67.670 1.00 0.00 H ATOM 92587 H2 WAT 5727 116.636 111.555 68.454 1.00 0.00 H TER 92589 WAT 5727 ATOM 92589 O WAT 5728 69.447 54.714 15.558 1.00 0.00 O ATOM 92590 H1 WAT 5728 68.721 54.370 15.038 1.00 0.00 H ATOM 92591 H2 WAT 5728 69.039 55.340 16.155 1.00 0.00 H TER 92593 WAT 5728 ATOM 92593 O WAT 5729 127.762 46.579 61.957 1.00 0.00 O ATOM 92594 H1 WAT 5729 127.691 47.199 61.231 1.00 0.00 H ATOM 92595 H2 WAT 5729 128.424 45.950 61.671 1.00 0.00 H TER 92597 WAT 5729 ATOM 92597 O WAT 5730 52.178 22.333 127.093 1.00 0.00 O ATOM 92598 H1 WAT 5730 52.975 21.961 126.716 1.00 0.00 H ATOM 92599 H2 WAT 5730 51.686 21.575 127.408 1.00 0.00 H TER 92601 WAT 5730 ATOM 92601 O WAT 5731 12.726 121.957 65.729 1.00 0.00 O ATOM 92602 H1 WAT 5731 11.863 122.155 65.364 1.00 0.00 H ATOM 92603 H2 WAT 5731 13.208 121.563 65.002 1.00 0.00 H TER 92605 WAT 5731 ATOM 92605 O WAT 5732 105.226 62.493 74.948 1.00 0.00 O ATOM 92606 H1 WAT 5732 105.381 63.420 75.127 1.00 0.00 H ATOM 92607 H2 WAT 5732 106.100 62.104 74.926 1.00 0.00 H TER 92609 WAT 5732 ATOM 92609 O WAT 5733 145.410 23.672 88.809 1.00 0.00 O ATOM 92610 H1 WAT 5733 144.843 23.278 88.147 1.00 0.00 H ATOM 92611 H2 WAT 5733 146.247 23.801 88.362 1.00 0.00 H TER 92613 WAT 5733 ATOM 92613 O WAT 5734 14.643 72.670 133.786 1.00 0.00 O ATOM 92614 H1 WAT 5734 14.581 73.614 133.931 1.00 0.00 H ATOM 92615 H2 WAT 5734 15.213 72.356 134.489 1.00 0.00 H TER 92617 WAT 5734 ATOM 92617 O WAT 5735 90.995 119.450 25.918 1.00 0.00 O ATOM 92618 H1 WAT 5735 90.841 120.129 25.262 1.00 0.00 H ATOM 92619 H2 WAT 5735 90.221 118.889 25.868 1.00 0.00 H TER 92621 WAT 5735 ATOM 92621 O WAT 5736 71.372 124.668 16.683 1.00 0.00 O ATOM 92622 H1 WAT 5736 71.164 125.013 15.815 1.00 0.00 H ATOM 92623 H2 WAT 5736 70.585 124.190 16.945 1.00 0.00 H TER 92625 WAT 5736 ATOM 92625 O WAT 5737 97.171 117.948 119.379 1.00 0.00 O ATOM 92626 H1 WAT 5737 96.267 118.070 119.668 1.00 0.00 H ATOM 92627 H2 WAT 5737 97.129 117.215 118.764 1.00 0.00 H TER 92629 WAT 5737 ATOM 92629 O WAT 5738 9.656 91.466 75.000 1.00 0.00 O ATOM 92630 H1 WAT 5738 10.305 92.167 74.944 1.00 0.00 H ATOM 92631 H2 WAT 5738 10.060 90.810 75.569 1.00 0.00 H TER 92633 WAT 5738 ATOM 92633 O WAT 5739 16.634 117.296 107.556 1.00 0.00 O ATOM 92634 H1 WAT 5739 17.514 116.923 107.618 1.00 0.00 H ATOM 92635 H2 WAT 5739 16.670 117.866 106.788 1.00 0.00 H TER 92637 WAT 5739 ATOM 92637 O WAT 5740 22.088 31.916 136.945 1.00 0.00 O ATOM 92638 H1 WAT 5740 22.298 31.335 136.214 1.00 0.00 H ATOM 92639 H2 WAT 5740 21.138 31.848 137.041 1.00 0.00 H TER 92641 WAT 5740 ATOM 92641 O WAT 5741 117.475 131.013 147.290 1.00 0.00 O ATOM 92642 H1 WAT 5741 117.900 130.281 146.843 1.00 0.00 H ATOM 92643 H2 WAT 5741 117.590 130.824 148.222 1.00 0.00 H TER 92645 WAT 5741 ATOM 92645 O WAT 5742 34.483 83.286 117.492 1.00 0.00 O ATOM 92646 H1 WAT 5742 35.334 83.710 117.609 1.00 0.00 H ATOM 92647 H2 WAT 5742 34.343 83.288 116.545 1.00 0.00 H TER 92649 WAT 5742 ATOM 92649 O WAT 5743 76.094 76.425 137.081 1.00 0.00 O ATOM 92650 H1 WAT 5743 76.087 75.555 137.479 1.00 0.00 H ATOM 92651 H2 WAT 5743 75.407 76.906 137.545 1.00 0.00 H TER 92653 WAT 5743 ATOM 92653 O WAT 5744 14.161 78.898 106.755 1.00 0.00 O ATOM 92654 H1 WAT 5744 15.055 79.043 107.063 1.00 0.00 H ATOM 92655 H2 WAT 5744 13.619 78.998 107.538 1.00 0.00 H TER 92657 WAT 5744 ATOM 92657 O WAT 5745 65.585 91.065 143.696 1.00 0.00 O ATOM 92658 H1 WAT 5745 66.342 90.740 144.183 1.00 0.00 H ATOM 92659 H2 WAT 5745 65.963 91.541 142.956 1.00 0.00 H TER 92661 WAT 5745 ATOM 92661 O WAT 5746 129.679 68.609 16.403 1.00 0.00 O ATOM 92662 H1 WAT 5746 128.927 68.029 16.287 1.00 0.00 H ATOM 92663 H2 WAT 5746 129.326 69.370 16.865 1.00 0.00 H TER 92665 WAT 5746 ATOM 92665 O WAT 5747 127.012 29.411 0.525 1.00 0.00 O ATOM 92666 H1 WAT 5747 127.706 30.062 0.420 1.00 0.00 H ATOM 92667 H2 WAT 5747 126.235 29.924 0.747 1.00 0.00 H TER 92669 WAT 5747 ATOM 92669 O WAT 5748 86.754 114.810 123.698 1.00 0.00 O ATOM 92670 H1 WAT 5748 86.290 114.091 124.126 1.00 0.00 H ATOM 92671 H2 WAT 5748 86.319 115.600 124.017 1.00 0.00 H TER 92673 WAT 5748 ATOM 92673 O WAT 5749 30.215 24.281 1.224 1.00 0.00 O ATOM 92674 H1 WAT 5749 29.536 24.252 1.899 1.00 0.00 H ATOM 92675 H2 WAT 5749 29.815 23.859 0.464 1.00 0.00 H TER 92677 WAT 5749 ATOM 92677 O WAT 5750 104.320 54.281 73.089 1.00 0.00 O ATOM 92678 H1 WAT 5750 104.067 54.695 72.264 1.00 0.00 H ATOM 92679 H2 WAT 5750 104.531 55.012 73.670 1.00 0.00 H TER 92681 WAT 5750 ATOM 92681 O WAT 5751 122.448 89.198 78.456 1.00 0.00 O ATOM 92682 H1 WAT 5751 121.798 89.114 77.758 1.00 0.00 H ATOM 92683 H2 WAT 5751 121.943 89.476 79.221 1.00 0.00 H TER 92685 WAT 5751 ATOM 92685 O WAT 5752 89.509 42.478 5.999 1.00 0.00 O ATOM 92686 H1 WAT 5752 88.698 41.972 5.961 1.00 0.00 H ATOM 92687 H2 WAT 5752 89.228 43.366 6.219 1.00 0.00 H TER 92689 WAT 5752 ATOM 92689 O WAT 5753 114.675 141.184 115.444 1.00 0.00 O ATOM 92690 H1 WAT 5753 115.498 141.663 115.350 1.00 0.00 H ATOM 92691 H2 WAT 5753 114.175 141.689 116.085 1.00 0.00 H TER 92693 WAT 5753 ATOM 92693 O WAT 5754 92.643 36.488 57.672 1.00 0.00 O ATOM 92694 H1 WAT 5754 92.493 35.543 57.657 1.00 0.00 H ATOM 92695 H2 WAT 5754 92.318 36.796 56.826 1.00 0.00 H TER 92697 WAT 5754 ATOM 92697 O WAT 5755 30.474 76.975 89.012 1.00 0.00 O ATOM 92698 H1 WAT 5755 29.960 76.210 89.271 1.00 0.00 H ATOM 92699 H2 WAT 5755 29.870 77.712 89.105 1.00 0.00 H TER 92701 WAT 5755 ATOM 92701 O WAT 5756 143.355 88.373 128.626 1.00 0.00 O ATOM 92702 H1 WAT 5756 142.795 88.636 129.357 1.00 0.00 H ATOM 92703 H2 WAT 5756 144.072 89.007 128.632 1.00 0.00 H TER 92705 WAT 5756 ATOM 92705 O WAT 5757 55.373 136.700 63.559 1.00 0.00 O ATOM 92706 H1 WAT 5757 55.943 137.115 64.206 1.00 0.00 H ATOM 92707 H2 WAT 5757 54.872 137.424 63.182 1.00 0.00 H TER 92709 WAT 5757 ATOM 92709 O WAT 5758 14.651 7.153 149.286 1.00 0.00 O ATOM 92710 H1 WAT 5758 13.865 6.828 149.726 1.00 0.00 H ATOM 92711 H2 WAT 5758 15.337 7.099 149.950 1.00 0.00 H TER 92713 WAT 5758 ATOM 92713 O WAT 5759 13.450 85.358 90.566 1.00 0.00 O ATOM 92714 H1 WAT 5759 13.894 85.761 91.313 1.00 0.00 H ATOM 92715 H2 WAT 5759 12.520 85.510 90.730 1.00 0.00 H TER 92717 WAT 5759 ATOM 92717 O WAT 5760 40.506 30.898 18.202 1.00 0.00 O ATOM 92718 H1 WAT 5760 40.001 31.327 17.511 1.00 0.00 H ATOM 92719 H2 WAT 5760 40.522 31.535 18.917 1.00 0.00 H TER 92721 WAT 5760 ATOM 92721 O WAT 5761 141.128 143.386 82.989 1.00 0.00 O ATOM 92722 H1 WAT 5761 140.506 143.437 82.263 1.00 0.00 H ATOM 92723 H2 WAT 5761 141.483 144.272 83.063 1.00 0.00 H TER 92725 WAT 5761 ATOM 92725 O WAT 5762 12.322 11.812 86.630 1.00 0.00 O ATOM 92726 H1 WAT 5762 12.185 12.758 86.588 1.00 0.00 H ATOM 92727 H2 WAT 5762 12.299 11.525 85.717 1.00 0.00 H TER 92729 WAT 5762 ATOM 92729 O WAT 5763 49.019 12.658 56.421 1.00 0.00 O ATOM 92730 H1 WAT 5763 49.718 12.477 55.793 1.00 0.00 H ATOM 92731 H2 WAT 5763 48.524 11.840 56.470 1.00 0.00 H TER 92733 WAT 5763 ATOM 92733 O WAT 5764 92.556 51.326 133.128 1.00 0.00 O ATOM 92734 H1 WAT 5764 93.204 51.906 133.528 1.00 0.00 H ATOM 92735 H2 WAT 5764 93.025 50.901 132.410 1.00 0.00 H TER 92737 WAT 5764 ATOM 92737 O WAT 5765 87.125 37.186 136.375 1.00 0.00 O ATOM 92738 H1 WAT 5765 86.562 36.867 135.669 1.00 0.00 H ATOM 92739 H2 WAT 5765 87.789 37.714 135.931 1.00 0.00 H TER 92741 WAT 5765 ATOM 92741 O WAT 5766 121.342 144.550 112.664 1.00 0.00 O ATOM 92742 H1 WAT 5766 120.812 144.576 111.867 1.00 0.00 H ATOM 92743 H2 WAT 5766 122.077 145.135 112.481 1.00 0.00 H TER 92745 WAT 5766 ATOM 92745 O WAT 5767 57.405 126.469 75.801 1.00 0.00 O ATOM 92746 H1 WAT 5767 58.301 126.148 75.699 1.00 0.00 H ATOM 92747 H2 WAT 5767 57.377 127.272 75.280 1.00 0.00 H TER 92749 WAT 5767 ATOM 92749 O WAT 5768 101.797 33.306 138.349 1.00 0.00 O ATOM 92750 H1 WAT 5768 101.040 32.785 138.616 1.00 0.00 H ATOM 92751 H2 WAT 5768 101.683 34.144 138.798 1.00 0.00 H TER 92753 WAT 5768 ATOM 92753 O WAT 5769 140.723 131.131 111.748 1.00 0.00 O ATOM 92754 H1 WAT 5769 140.465 130.246 111.489 1.00 0.00 H ATOM 92755 H2 WAT 5769 141.422 131.000 112.388 1.00 0.00 H TER 92757 WAT 5769 ATOM 92757 O WAT 5770 74.755 45.717 74.967 1.00 0.00 O ATOM 92758 H1 WAT 5770 74.894 45.676 74.021 1.00 0.00 H ATOM 92759 H2 WAT 5770 75.233 44.963 75.313 1.00 0.00 H TER 92761 WAT 5770 ATOM 92761 O WAT 5771 4.398 133.121 94.588 1.00 0.00 O ATOM 92762 H1 WAT 5771 5.001 132.448 94.273 1.00 0.00 H ATOM 92763 H2 WAT 5771 4.800 133.947 94.319 1.00 0.00 H TER 92765 WAT 5771 ATOM 92765 O WAT 5772 104.567 68.717 3.252 1.00 0.00 O ATOM 92766 H1 WAT 5772 104.934 67.872 2.992 1.00 0.00 H ATOM 92767 H2 WAT 5772 103.664 68.694 2.935 1.00 0.00 H TER 92769 WAT 5772 ATOM 92769 O WAT 5773 8.302 108.012 113.194 1.00 0.00 O ATOM 92770 H1 WAT 5773 8.214 107.806 114.125 1.00 0.00 H ATOM 92771 H2 WAT 5773 8.996 107.430 112.885 1.00 0.00 H TER 92773 WAT 5773 ATOM 92773 O WAT 5774 94.808 93.751 118.123 1.00 0.00 O ATOM 92774 H1 WAT 5774 94.222 93.155 118.590 1.00 0.00 H ATOM 92775 H2 WAT 5774 95.518 93.191 117.810 1.00 0.00 H TER 92777 WAT 5774 ATOM 92777 O WAT 5775 66.750 122.908 117.032 1.00 0.00 O ATOM 92778 H1 WAT 5775 66.293 123.229 116.254 1.00 0.00 H ATOM 92779 H2 WAT 5775 66.075 122.453 117.536 1.00 0.00 H TER 92781 WAT 5775 ATOM 92781 O WAT 5776 123.795 126.574 97.636 1.00 0.00 O ATOM 92782 H1 WAT 5776 124.139 125.846 98.154 1.00 0.00 H ATOM 92783 H2 WAT 5776 123.502 126.169 96.819 1.00 0.00 H TER 92785 WAT 5776 ATOM 92785 O WAT 5777 91.587 126.740 98.405 1.00 0.00 O ATOM 92786 H1 WAT 5777 91.943 127.586 98.674 1.00 0.00 H ATOM 92787 H2 WAT 5777 91.987 126.571 97.553 1.00 0.00 H TER 92789 WAT 5777 ATOM 92789 O WAT 5778 76.306 84.740 149.482 1.00 0.00 O ATOM 92790 H1 WAT 5778 75.814 84.039 149.910 1.00 0.00 H ATOM 92791 H2 WAT 5778 75.740 85.028 148.766 1.00 0.00 H TER 92793 WAT 5778 ATOM 92793 O WAT 5779 122.044 28.635 129.596 1.00 0.00 O ATOM 92794 H1 WAT 5779 121.321 29.139 129.968 1.00 0.00 H ATOM 92795 H2 WAT 5779 122.760 29.265 129.517 1.00 0.00 H TER 92797 WAT 5779 ATOM 92797 O WAT 5780 8.375 110.354 154.698 1.00 0.00 O ATOM 92798 H1 WAT 5780 8.102 109.488 155.001 1.00 0.00 H ATOM 92799 H2 WAT 5780 9.236 110.211 154.306 1.00 0.00 H TER 92801 WAT 5780 ATOM 92801 O WAT 5781 40.020 128.341 100.738 1.00 0.00 O ATOM 92802 H1 WAT 5781 40.273 129.148 101.187 1.00 0.00 H ATOM 92803 H2 WAT 5781 39.511 128.636 99.984 1.00 0.00 H TER 92805 WAT 5781 ATOM 92805 O WAT 5782 54.803 126.093 129.210 1.00 0.00 O ATOM 92806 H1 WAT 5782 55.132 126.992 129.227 1.00 0.00 H ATOM 92807 H2 WAT 5782 54.232 126.062 128.443 1.00 0.00 H TER 92809 WAT 5782 ATOM 92809 O WAT 5783 139.320 121.401 120.645 1.00 0.00 O ATOM 92810 H1 WAT 5783 139.305 120.448 120.738 1.00 0.00 H ATOM 92811 H2 WAT 5783 139.026 121.558 119.748 1.00 0.00 H TER 92813 WAT 5783 ATOM 92813 O WAT 5784 142.544 46.695 88.289 1.00 0.00 O ATOM 92814 H1 WAT 5784 142.381 47.484 88.805 1.00 0.00 H ATOM 92815 H2 WAT 5784 142.799 47.022 87.426 1.00 0.00 H TER 92817 WAT 5784 ATOM 92817 O WAT 5785 91.068 55.280 114.489 1.00 0.00 O ATOM 92818 H1 WAT 5785 91.958 55.064 114.210 1.00 0.00 H ATOM 92819 H2 WAT 5785 90.527 55.110 113.718 1.00 0.00 H TER 92821 WAT 5785 ATOM 92821 O WAT 5786 90.891 17.277 138.300 1.00 0.00 O ATOM 92822 H1 WAT 5786 91.801 17.533 138.150 1.00 0.00 H ATOM 92823 H2 WAT 5786 90.569 17.906 138.946 1.00 0.00 H TER 92825 WAT 5786 ATOM 92825 O WAT 5787 81.765 73.804 28.648 1.00 0.00 O ATOM 92826 H1 WAT 5787 81.118 73.135 28.867 1.00 0.00 H ATOM 92827 H2 WAT 5787 82.567 73.313 28.469 1.00 0.00 H TER 92829 WAT 5787 ATOM 92829 O WAT 5788 8.904 94.385 145.657 1.00 0.00 O ATOM 92830 H1 WAT 5788 8.835 94.186 146.591 1.00 0.00 H ATOM 92831 H2 WAT 5788 8.046 94.738 145.423 1.00 0.00 H TER 92833 WAT 5788 ATOM 92833 O WAT 5789 133.547 29.446 4.965 1.00 0.00 O ATOM 92834 H1 WAT 5789 133.995 28.603 4.889 1.00 0.00 H ATOM 92835 H2 WAT 5789 133.485 29.765 4.064 1.00 0.00 H TER 92837 WAT 5789 ATOM 92837 O WAT 5790 123.162 0.108 80.278 1.00 0.00 O ATOM 92838 H1 WAT 5790 123.811 0.460 79.669 1.00 0.00 H ATOM 92839 H2 WAT 5790 122.318 0.334 79.885 1.00 0.00 H TER 92841 WAT 5790 ATOM 92841 O WAT 5791 142.137 48.419 10.941 1.00 0.00 O ATOM 92842 H1 WAT 5791 142.998 48.035 10.776 1.00 0.00 H ATOM 92843 H2 WAT 5791 141.518 47.727 10.708 1.00 0.00 H TER 92845 WAT 5791 ATOM 92845 O WAT 5792 104.018 1.526 71.874 1.00 0.00 O ATOM 92846 H1 WAT 5792 103.162 1.116 71.749 1.00 0.00 H ATOM 92847 H2 WAT 5792 103.947 1.976 72.716 1.00 0.00 H TER 92849 WAT 5792 ATOM 92849 O WAT 5793 64.471 130.211 134.044 1.00 0.00 O ATOM 92850 H1 WAT 5793 64.800 129.520 133.470 1.00 0.00 H ATOM 92851 H2 WAT 5793 65.058 130.196 134.799 1.00 0.00 H TER 92853 WAT 5793 ATOM 92853 O WAT 5794 58.130 78.875 129.551 1.00 0.00 O ATOM 92854 H1 WAT 5794 58.110 78.540 130.447 1.00 0.00 H ATOM 92855 H2 WAT 5794 57.339 79.408 129.476 1.00 0.00 H TER 92857 WAT 5794 ATOM 92857 O WAT 5795 41.685 130.895 69.944 1.00 0.00 O ATOM 92858 H1 WAT 5795 41.049 131.439 70.410 1.00 0.00 H ATOM 92859 H2 WAT 5795 42.366 130.714 70.592 1.00 0.00 H TER 92861 WAT 5795 ATOM 92861 O WAT 5796 65.620 28.291 127.809 1.00 0.00 O ATOM 92862 H1 WAT 5796 66.563 28.434 127.888 1.00 0.00 H ATOM 92863 H2 WAT 5796 65.296 29.072 127.362 1.00 0.00 H TER 92865 WAT 5796 ATOM 92865 O WAT 5797 133.428 33.618 123.125 1.00 0.00 O ATOM 92866 H1 WAT 5797 134.087 33.767 123.803 1.00 0.00 H ATOM 92867 H2 WAT 5797 132.607 33.515 123.606 1.00 0.00 H TER 92869 WAT 5797 ATOM 92869 O WAT 5798 107.643 116.222 77.116 1.00 0.00 O ATOM 92870 H1 WAT 5798 106.702 116.384 77.188 1.00 0.00 H ATOM 92871 H2 WAT 5798 107.741 115.743 76.293 1.00 0.00 H TER 92873 WAT 5798 ATOM 92873 O WAT 5799 73.438 90.742 93.029 1.00 0.00 O ATOM 92874 H1 WAT 5799 73.441 90.144 93.777 1.00 0.00 H ATOM 92875 H2 WAT 5799 73.141 90.205 92.294 1.00 0.00 H TER 92877 WAT 5799 ATOM 92877 O WAT 5800 48.875 102.914 10.044 1.00 0.00 O ATOM 92878 H1 WAT 5800 48.466 103.362 10.785 1.00 0.00 H ATOM 92879 H2 WAT 5800 48.317 103.130 9.296 1.00 0.00 H TER 92881 WAT 5800 ATOM 92881 O WAT 5801 102.233 14.059 90.961 1.00 0.00 O ATOM 92882 H1 WAT 5801 102.534 14.602 91.690 1.00 0.00 H ATOM 92883 H2 WAT 5801 101.278 14.115 91.001 1.00 0.00 H TER 92885 WAT 5801 ATOM 92885 O WAT 5802 78.855 49.830 30.739 1.00 0.00 O ATOM 92886 H1 WAT 5802 78.658 50.733 30.491 1.00 0.00 H ATOM 92887 H2 WAT 5802 79.759 49.696 30.453 1.00 0.00 H TER 92889 WAT 5802 ATOM 92889 O WAT 5803 71.450 78.637 79.305 1.00 0.00 O ATOM 92890 H1 WAT 5803 71.232 79.225 80.028 1.00 0.00 H ATOM 92891 H2 WAT 5803 71.310 77.759 79.660 1.00 0.00 H TER 92893 WAT 5803 ATOM 92893 O WAT 5804 15.184 59.314 62.314 1.00 0.00 O ATOM 92894 H1 WAT 5804 15.671 59.392 63.135 1.00 0.00 H ATOM 92895 H2 WAT 5804 15.222 60.189 61.929 1.00 0.00 H TER 92897 WAT 5804 ATOM 92897 O WAT 5805 119.134 34.579 121.090 1.00 0.00 O ATOM 92898 H1 WAT 5805 120.007 34.970 121.118 1.00 0.00 H ATOM 92899 H2 WAT 5805 118.932 34.510 120.157 1.00 0.00 H TER 92901 WAT 5805 ATOM 92901 O WAT 5806 7.849 130.650 80.392 1.00 0.00 O ATOM 92902 H1 WAT 5806 7.066 131.091 80.062 1.00 0.00 H ATOM 92903 H2 WAT 5806 8.262 131.294 80.968 1.00 0.00 H TER 92905 WAT 5806 ATOM 92905 O WAT 5807 47.459 2.214 79.176 1.00 0.00 O ATOM 92906 H1 WAT 5807 46.505 2.251 79.104 1.00 0.00 H ATOM 92907 H2 WAT 5807 47.775 2.485 78.314 1.00 0.00 H TER 92909 WAT 5807 ATOM 92909 O WAT 5808 65.499 112.564 97.299 1.00 0.00 O ATOM 92910 H1 WAT 5808 66.057 112.091 96.682 1.00 0.00 H ATOM 92911 H2 WAT 5808 64.991 111.880 97.736 1.00 0.00 H TER 92913 WAT 5808 ATOM 92913 O WAT 5809 140.618 131.825 70.390 1.00 0.00 O ATOM 92914 H1 WAT 5809 139.877 131.998 69.809 1.00 0.00 H ATOM 92915 H2 WAT 5809 140.218 131.508 71.200 1.00 0.00 H TER 92917 WAT 5809 ATOM 92917 O WAT 5810 76.001 98.663 113.174 1.00 0.00 O ATOM 92918 H1 WAT 5810 76.364 97.820 112.901 1.00 0.00 H ATOM 92919 H2 WAT 5810 76.584 98.959 113.873 1.00 0.00 H TER 92921 WAT 5810 ATOM 92921 O WAT 5811 108.511 24.911 73.038 1.00 0.00 O ATOM 92922 H1 WAT 5811 109.412 24.926 72.715 1.00 0.00 H ATOM 92923 H2 WAT 5811 108.578 24.535 73.916 1.00 0.00 H TER 92925 WAT 5811 ATOM 92925 O WAT 5812 129.118 10.173 116.311 1.00 0.00 O ATOM 92926 H1 WAT 5812 129.171 10.617 117.157 1.00 0.00 H ATOM 92927 H2 WAT 5812 128.553 10.736 115.781 1.00 0.00 H TER 92929 WAT 5812 ATOM 92929 O WAT 5813 2.814 88.752 134.235 1.00 0.00 O ATOM 92930 H1 WAT 5813 2.854 89.290 133.444 1.00 0.00 H ATOM 92931 H2 WAT 5813 3.730 88.606 134.471 1.00 0.00 H TER 92933 WAT 5813 ATOM 92933 O WAT 5814 130.582 7.442 114.724 1.00 0.00 O ATOM 92934 H1 WAT 5814 129.824 7.876 114.333 1.00 0.00 H ATOM 92935 H2 WAT 5814 131.296 7.604 114.107 1.00 0.00 H TER 92937 WAT 5814 ATOM 92937 O WAT 5815 117.539 31.147 27.414 1.00 0.00 O ATOM 92938 H1 WAT 5815 117.360 30.229 27.211 1.00 0.00 H ATOM 92939 H2 WAT 5815 118.153 31.427 26.736 1.00 0.00 H TER 92941 WAT 5815 ATOM 92941 O WAT 5816 125.870 123.214 137.195 1.00 0.00 O ATOM 92942 H1 WAT 5816 124.928 123.053 137.137 1.00 0.00 H ATOM 92943 H2 WAT 5816 126.045 123.860 136.510 1.00 0.00 H TER 92945 WAT 5816 ATOM 92945 O WAT 5817 143.965 44.424 147.869 1.00 0.00 O ATOM 92946 H1 WAT 5817 144.478 44.529 148.670 1.00 0.00 H ATOM 92947 H2 WAT 5817 143.086 44.198 148.175 1.00 0.00 H TER 92949 WAT 5817 ATOM 92949 O WAT 5818 104.486 131.188 129.209 1.00 0.00 O ATOM 92950 H1 WAT 5818 103.958 130.627 128.641 1.00 0.00 H ATOM 92951 H2 WAT 5818 105.077 131.645 128.611 1.00 0.00 H TER 92953 WAT 5818 ATOM 92953 O WAT 5819 61.406 10.372 85.392 1.00 0.00 O ATOM 92954 H1 WAT 5819 61.935 11.048 85.816 1.00 0.00 H ATOM 92955 H2 WAT 5819 60.674 10.230 85.991 1.00 0.00 H TER 92957 WAT 5819 ATOM 92957 O WAT 5820 39.554 142.904 150.911 1.00 0.00 O ATOM 92958 H1 WAT 5820 39.742 142.848 151.848 1.00 0.00 H ATOM 92959 H2 WAT 5820 38.781 142.353 150.789 1.00 0.00 H TER 92961 WAT 5820 ATOM 92961 O WAT 5821 109.813 114.725 80.857 1.00 0.00 O ATOM 92962 H1 WAT 5821 108.867 114.608 80.763 1.00 0.00 H ATOM 92963 H2 WAT 5821 109.965 114.699 81.802 1.00 0.00 H TER 92965 WAT 5821 ATOM 92965 O WAT 5822 126.958 101.889 107.283 1.00 0.00 O ATOM 92966 H1 WAT 5822 126.866 102.784 106.958 1.00 0.00 H ATOM 92967 H2 WAT 5822 127.826 101.614 106.986 1.00 0.00 H TER 92969 WAT 5822 ATOM 92969 O WAT 5823 113.931 80.735 157.824 1.00 0.00 O ATOM 92970 H1 WAT 5823 114.516 80.856 158.572 1.00 0.00 H ATOM 92971 H2 WAT 5823 114.058 81.520 157.291 1.00 0.00 H TER 92973 WAT 5823 ATOM 92973 O WAT 5824 96.572 20.562 83.754 1.00 0.00 O ATOM 92974 H1 WAT 5824 95.797 21.010 83.412 1.00 0.00 H ATOM 92975 H2 WAT 5824 97.305 21.119 83.492 1.00 0.00 H TER 92977 WAT 5824 ATOM 92977 O WAT 5825 66.030 51.012 132.248 1.00 0.00 O ATOM 92978 H1 WAT 5825 65.971 51.244 131.322 1.00 0.00 H ATOM 92979 H2 WAT 5825 65.620 51.746 132.706 1.00 0.00 H TER 92981 WAT 5825 ATOM 92981 O WAT 5826 127.678 117.763 13.364 1.00 0.00 O ATOM 92982 H1 WAT 5826 127.125 117.017 13.132 1.00 0.00 H ATOM 92983 H2 WAT 5826 127.590 117.840 14.314 1.00 0.00 H TER 92985 WAT 5826 ATOM 92985 O WAT 5827 1.605 47.744 100.232 1.00 0.00 O ATOM 92986 H1 WAT 5827 2.166 48.494 100.037 1.00 0.00 H ATOM 92987 H2 WAT 5827 1.909 47.056 99.639 1.00 0.00 H TER 92989 WAT 5827 ATOM 92989 O WAT 5828 76.187 35.818 151.078 1.00 0.00 O ATOM 92990 H1 WAT 5828 76.391 36.717 151.337 1.00 0.00 H ATOM 92991 H2 WAT 5828 76.529 35.743 150.187 1.00 0.00 H TER 92993 WAT 5828 ATOM 92993 O WAT 5829 27.852 45.522 21.566 1.00 0.00 O ATOM 92994 H1 WAT 5829 28.042 44.585 21.621 1.00 0.00 H ATOM 92995 H2 WAT 5829 27.467 45.638 20.698 1.00 0.00 H TER 92997 WAT 5829 ATOM 92997 O WAT 5830 93.170 42.979 81.212 1.00 0.00 O ATOM 92998 H1 WAT 5830 92.494 42.984 80.534 1.00 0.00 H ATOM 92999 H2 WAT 5830 92.756 42.549 81.960 1.00 0.00 H TER 93001 WAT 5830 ATOM 93001 O WAT 5831 91.099 93.831 126.955 1.00 0.00 O ATOM 93002 H1 WAT 5831 90.907 94.534 126.333 1.00 0.00 H ATOM 93003 H2 WAT 5831 91.821 93.348 126.553 1.00 0.00 H TER 93005 WAT 5831 ATOM 93005 O WAT 5832 114.517 75.340 140.694 1.00 0.00 O ATOM 93006 H1 WAT 5832 115.213 75.917 141.009 1.00 0.00 H ATOM 93007 H2 WAT 5832 114.841 75.010 139.856 1.00 0.00 H TER 93009 WAT 5832 ATOM 93009 O WAT 5833 64.898 142.226 12.249 1.00 0.00 O ATOM 93010 H1 WAT 5833 65.782 142.093 11.906 1.00 0.00 H ATOM 93011 H2 WAT 5833 64.523 141.347 12.292 1.00 0.00 H TER 93013 WAT 5833 ATOM 93013 O WAT 5834 78.860 0.545 131.345 1.00 0.00 O ATOM 93014 H1 WAT 5834 78.482 1.315 131.769 1.00 0.00 H ATOM 93015 H2 WAT 5834 79.400 0.900 130.639 1.00 0.00 H TER 93017 WAT 5834 ATOM 93017 O WAT 5835 109.026 39.179 5.679 1.00 0.00 O ATOM 93018 H1 WAT 5835 109.480 39.382 6.497 1.00 0.00 H ATOM 93019 H2 WAT 5835 109.286 39.880 5.081 1.00 0.00 H TER 93021 WAT 5835 ATOM 93021 O WAT 5836 40.772 104.653 102.607 1.00 0.00 O ATOM 93022 H1 WAT 5836 40.108 104.738 101.923 1.00 0.00 H ATOM 93023 H2 WAT 5836 41.550 104.336 102.148 1.00 0.00 H TER 93025 WAT 5836 ATOM 93025 O WAT 5837 129.648 105.524 5.040 1.00 0.00 O ATOM 93026 H1 WAT 5837 128.955 105.657 5.687 1.00 0.00 H ATOM 93027 H2 WAT 5837 129.224 105.689 4.197 1.00 0.00 H TER 93029 WAT 5837 ATOM 93029 O WAT 5838 112.633 87.514 123.198 1.00 0.00 O ATOM 93030 H1 WAT 5838 112.400 87.723 124.103 1.00 0.00 H ATOM 93031 H2 WAT 5838 111.800 87.301 122.779 1.00 0.00 H TER 93033 WAT 5838 ATOM 93033 O WAT 5839 86.879 78.077 4.096 1.00 0.00 O ATOM 93034 H1 WAT 5839 87.836 78.089 4.058 1.00 0.00 H ATOM 93035 H2 WAT 5839 86.624 77.383 3.489 1.00 0.00 H TER 93037 WAT 5839 ATOM 93037 O WAT 5840 43.199 54.200 118.195 1.00 0.00 O ATOM 93038 H1 WAT 5840 42.822 54.947 117.729 1.00 0.00 H ATOM 93039 H2 WAT 5840 43.984 53.977 117.694 1.00 0.00 H TER 93041 WAT 5840 ATOM 93041 O WAT 5841 33.897 74.011 144.868 1.00 0.00 O ATOM 93042 H1 WAT 5841 32.950 73.925 144.980 1.00 0.00 H ATOM 93043 H2 WAT 5841 34.268 73.615 145.656 1.00 0.00 H TER 93045 WAT 5841 ATOM 93045 O WAT 5842 73.417 15.836 104.404 1.00 0.00 O ATOM 93046 H1 WAT 5842 72.862 16.221 105.082 1.00 0.00 H ATOM 93047 H2 WAT 5842 73.545 16.542 103.770 1.00 0.00 H TER 93049 WAT 5842 ATOM 93049 O WAT 5843 76.839 132.393 90.385 1.00 0.00 O ATOM 93050 H1 WAT 5843 77.667 132.728 90.041 1.00 0.00 H ATOM 93051 H2 WAT 5843 76.474 131.874 89.668 1.00 0.00 H TER 93053 WAT 5843 ATOM 93053 O WAT 5844 27.311 83.391 66.907 1.00 0.00 O ATOM 93054 H1 WAT 5844 26.816 83.856 66.231 1.00 0.00 H ATOM 93055 H2 WAT 5844 28.094 83.925 67.039 1.00 0.00 H TER 93057 WAT 5844 ATOM 93057 O WAT 5845 135.658 43.228 19.589 1.00 0.00 O ATOM 93058 H1 WAT 5845 135.216 42.873 20.360 1.00 0.00 H ATOM 93059 H2 WAT 5845 135.014 43.148 18.885 1.00 0.00 H TER 93061 WAT 5845 ATOM 93061 O WAT 5846 70.577 145.155 65.752 1.00 0.00 O ATOM 93062 H1 WAT 5846 70.464 144.859 66.656 1.00 0.00 H ATOM 93063 H2 WAT 5846 70.263 146.059 65.755 1.00 0.00 H TER 93065 WAT 5846 ATOM 93065 O WAT 5847 127.336 57.322 107.745 1.00 0.00 O ATOM 93066 H1 WAT 5847 127.386 58.197 107.360 1.00 0.00 H ATOM 93067 H2 WAT 5847 126.503 57.315 108.217 1.00 0.00 H TER 93069 WAT 5847 ATOM 93069 O WAT 5848 29.800 63.494 9.539 1.00 0.00 O ATOM 93070 H1 WAT 5848 29.981 64.412 9.740 1.00 0.00 H ATOM 93071 H2 WAT 5848 29.262 63.190 10.270 1.00 0.00 H TER 93073 WAT 5848 ATOM 93073 O WAT 5849 13.099 47.435 157.415 1.00 0.00 O ATOM 93074 H1 WAT 5849 14.015 47.167 157.349 1.00 0.00 H ATOM 93075 H2 WAT 5849 12.832 47.165 158.294 1.00 0.00 H TER 93077 WAT 5849 ATOM 93077 O WAT 5850 87.429 112.138 80.984 1.00 0.00 O ATOM 93078 H1 WAT 5850 88.218 111.733 81.343 1.00 0.00 H ATOM 93079 H2 WAT 5850 87.155 111.549 80.280 1.00 0.00 H TER 93081 WAT 5850 ATOM 93081 O WAT 5851 68.532 62.370 93.413 1.00 0.00 O ATOM 93082 H1 WAT 5851 67.673 62.774 93.287 1.00 0.00 H ATOM 93083 H2 WAT 5851 68.337 61.487 93.725 1.00 0.00 H TER 93085 WAT 5851 ATOM 93085 O WAT 5852 117.974 114.191 128.414 1.00 0.00 O ATOM 93086 H1 WAT 5852 117.454 113.393 128.506 1.00 0.00 H ATOM 93087 H2 WAT 5852 117.754 114.522 127.544 1.00 0.00 H TER 93089 WAT 5852 ATOM 93089 O WAT 5853 57.838 53.014 116.278 1.00 0.00 O ATOM 93090 H1 WAT 5853 57.577 52.641 115.436 1.00 0.00 H ATOM 93091 H2 WAT 5853 58.560 53.605 116.065 1.00 0.00 H TER 93093 WAT 5853 ATOM 93093 O WAT 5854 144.463 0.431 80.144 1.00 0.00 O ATOM 93094 H1 WAT 5854 143.761 0.044 79.621 1.00 0.00 H ATOM 93095 H2 WAT 5854 145.260 0.007 79.825 1.00 0.00 H TER 93097 WAT 5854 ATOM 93097 O WAT 5855 128.425 124.087 73.837 1.00 0.00 O ATOM 93098 H1 WAT 5855 129.187 124.543 74.193 1.00 0.00 H ATOM 93099 H2 WAT 5855 128.006 123.688 74.600 1.00 0.00 H TER 93101 WAT 5855 ATOM 93101 O WAT 5856 109.550 26.797 104.719 1.00 0.00 O ATOM 93102 H1 WAT 5856 110.296 26.699 104.126 1.00 0.00 H ATOM 93103 H2 WAT 5856 108.783 26.747 104.149 1.00 0.00 H TER 93105 WAT 5856 ATOM 93105 O WAT 5857 102.561 104.089 117.675 1.00 0.00 O ATOM 93106 H1 WAT 5857 102.208 103.474 118.317 1.00 0.00 H ATOM 93107 H2 WAT 5857 103.306 103.629 117.287 1.00 0.00 H TER 93109 WAT 5857 ATOM 93109 O WAT 5858 121.569 132.268 144.552 1.00 0.00 O ATOM 93110 H1 WAT 5858 121.331 132.930 143.904 1.00 0.00 H ATOM 93111 H2 WAT 5858 121.958 131.560 144.039 1.00 0.00 H TER 93113 WAT 5858 ATOM 93113 O WAT 5859 34.938 137.607 0.402 1.00 0.00 O ATOM 93114 H1 WAT 5859 34.384 136.990 0.881 1.00 0.00 H ATOM 93115 H2 WAT 5859 35.687 137.754 0.979 1.00 0.00 H TER 93117 WAT 5859 ATOM 93117 O WAT 5860 85.506 65.056 88.294 1.00 0.00 O ATOM 93118 H1 WAT 5860 86.085 65.696 88.707 1.00 0.00 H ATOM 93119 H2 WAT 5860 85.735 64.223 88.707 1.00 0.00 H TER 93121 WAT 5860 ATOM 93121 O WAT 5861 114.857 125.853 15.720 1.00 0.00 O ATOM 93122 H1 WAT 5861 114.569 124.983 15.999 1.00 0.00 H ATOM 93123 H2 WAT 5861 114.063 126.387 15.748 1.00 0.00 H TER 93125 WAT 5861 ATOM 93125 O WAT 5862 59.840 1.736 120.416 1.00 0.00 O ATOM 93126 H1 WAT 5862 59.595 2.497 119.889 1.00 0.00 H ATOM 93127 H2 WAT 5862 59.953 2.085 121.300 1.00 0.00 H TER 93129 WAT 5862 ATOM 93129 O WAT 5863 42.539 20.240 74.428 1.00 0.00 O ATOM 93130 H1 WAT 5863 42.020 20.901 73.970 1.00 0.00 H ATOM 93131 H2 WAT 5863 42.486 20.491 75.351 1.00 0.00 H TER 93133 WAT 5863 ATOM 93133 O WAT 5864 50.822 126.435 14.416 1.00 0.00 O ATOM 93134 H1 WAT 5864 50.643 125.650 14.934 1.00 0.00 H ATOM 93135 H2 WAT 5864 51.688 126.720 14.706 1.00 0.00 H TER 93137 WAT 5864 ATOM 93137 O WAT 5865 79.650 19.247 67.821 1.00 0.00 O ATOM 93138 H1 WAT 5865 78.800 19.669 67.950 1.00 0.00 H ATOM 93139 H2 WAT 5865 79.562 18.778 66.992 1.00 0.00 H TER 93141 WAT 5865 ATOM 93141 O WAT 5866 116.641 130.148 10.114 1.00 0.00 O ATOM 93142 H1 WAT 5866 115.896 130.570 10.542 1.00 0.00 H ATOM 93143 H2 WAT 5866 117.404 130.455 10.604 1.00 0.00 H TER 93145 WAT 5866 ATOM 93145 O WAT 5867 74.001 83.150 147.323 1.00 0.00 O ATOM 93146 H1 WAT 5867 74.392 82.645 146.610 1.00 0.00 H ATOM 93147 H2 WAT 5867 73.084 83.254 147.069 1.00 0.00 H TER 93149 WAT 5867 ATOM 93149 O WAT 5868 21.781 87.764 22.873 1.00 0.00 O ATOM 93150 H1 WAT 5868 21.714 87.099 22.187 1.00 0.00 H ATOM 93151 H2 WAT 5868 20.994 87.641 23.403 1.00 0.00 H TER 93153 WAT 5868 ATOM 93153 O WAT 5869 70.559 143.686 77.033 1.00 0.00 O ATOM 93154 H1 WAT 5869 70.322 143.203 76.241 1.00 0.00 H ATOM 93155 H2 WAT 5869 70.949 144.498 76.711 1.00 0.00 H TER 93157 WAT 5869 ATOM 93157 O WAT 5870 95.544 88.787 127.054 1.00 0.00 O ATOM 93158 H1 WAT 5870 96.134 89.187 126.416 1.00 0.00 H ATOM 93159 H2 WAT 5870 96.023 88.025 127.379 1.00 0.00 H TER 93161 WAT 5870 ATOM 93161 O WAT 5871 133.769 134.357 156.132 1.00 0.00 O ATOM 93162 H1 WAT 5871 133.010 133.833 155.878 1.00 0.00 H ATOM 93163 H2 WAT 5871 133.981 134.867 155.350 1.00 0.00 H TER 93165 WAT 5871 ATOM 93165 O WAT 5872 63.990 89.240 149.941 1.00 0.00 O ATOM 93166 H1 WAT 5872 64.617 88.524 149.841 1.00 0.00 H ATOM 93167 H2 WAT 5872 63.384 88.935 150.617 1.00 0.00 H TER 93169 WAT 5872 ATOM 93169 O WAT 5873 9.988 48.494 149.472 1.00 0.00 O ATOM 93170 H1 WAT 5873 9.285 48.278 148.859 1.00 0.00 H ATOM 93171 H2 WAT 5873 9.727 49.333 149.851 1.00 0.00 H TER 93173 WAT 5873 ATOM 93173 O WAT 5874 118.021 46.595 16.641 1.00 0.00 O ATOM 93174 H1 WAT 5874 118.766 47.026 16.223 1.00 0.00 H ATOM 93175 H2 WAT 5874 118.036 45.702 16.296 1.00 0.00 H TER 93177 WAT 5874 ATOM 93177 O WAT 5875 68.145 114.367 85.000 1.00 0.00 O ATOM 93178 H1 WAT 5875 67.365 113.948 85.362 1.00 0.00 H ATOM 93179 H2 WAT 5875 68.856 113.756 85.193 1.00 0.00 H TER 93181 WAT 5875 ATOM 93181 O WAT 5876 141.942 30.262 147.086 1.00 0.00 O ATOM 93182 H1 WAT 5876 142.550 30.171 146.353 1.00 0.00 H ATOM 93183 H2 WAT 5876 141.406 29.470 147.052 1.00 0.00 H TER 93185 WAT 5876 ATOM 93185 O WAT 5877 62.258 87.487 0.491 1.00 0.00 O ATOM 93186 H1 WAT 5877 62.502 88.243 1.024 1.00 0.00 H ATOM 93187 H2 WAT 5877 61.983 86.825 1.126 1.00 0.00 H TER 93189 WAT 5877 ATOM 93189 O WAT 5878 122.291 81.880 114.819 1.00 0.00 O ATOM 93190 H1 WAT 5878 122.287 81.063 115.319 1.00 0.00 H ATOM 93191 H2 WAT 5878 121.943 81.637 113.961 1.00 0.00 H TER 93193 WAT 5878 ATOM 93193 O WAT 5879 113.520 16.340 142.479 1.00 0.00 O ATOM 93194 H1 WAT 5879 113.581 16.093 141.557 1.00 0.00 H ATOM 93195 H2 WAT 5879 114.125 17.076 142.571 1.00 0.00 H TER 93197 WAT 5879 ATOM 93197 O WAT 5880 9.130 27.889 140.528 1.00 0.00 O ATOM 93198 H1 WAT 5880 8.561 28.378 141.123 1.00 0.00 H ATOM 93199 H2 WAT 5880 8.677 27.917 139.685 1.00 0.00 H TER 93201 WAT 5880 ATOM 93201 O WAT 5881 40.518 125.656 112.793 1.00 0.00 O ATOM 93202 H1 WAT 5881 41.138 125.762 112.073 1.00 0.00 H ATOM 93203 H2 WAT 5881 40.570 124.727 113.020 1.00 0.00 H TER 93205 WAT 5881 ATOM 93205 O WAT 5882 131.841 69.633 18.789 1.00 0.00 O ATOM 93206 H1 WAT 5882 131.637 69.191 17.965 1.00 0.00 H ATOM 93207 H2 WAT 5882 131.441 69.082 19.462 1.00 0.00 H TER 93209 WAT 5882 ATOM 93209 O WAT 5883 105.324 137.506 149.909 1.00 0.00 O ATOM 93210 H1 WAT 5883 105.239 136.849 149.219 1.00 0.00 H ATOM 93211 H2 WAT 5883 105.370 138.340 149.442 1.00 0.00 H TER 93213 WAT 5883 ATOM 93213 O WAT 5884 55.357 140.621 99.293 1.00 0.00 O ATOM 93214 H1 WAT 5884 56.089 140.015 99.410 1.00 0.00 H ATOM 93215 H2 WAT 5884 54.739 140.387 99.986 1.00 0.00 H TER 93217 WAT 5884 ATOM 93217 O WAT 5885 48.882 8.829 4.681 1.00 0.00 O ATOM 93218 H1 WAT 5885 48.200 9.110 4.070 1.00 0.00 H ATOM 93219 H2 WAT 5885 48.894 7.875 4.605 1.00 0.00 H TER 93221 WAT 5885 ATOM 93221 O WAT 5886 50.729 77.971 88.035 1.00 0.00 O ATOM 93222 H1 WAT 5886 49.883 77.553 87.872 1.00 0.00 H ATOM 93223 H2 WAT 5886 50.529 78.687 88.638 1.00 0.00 H TER 93225 WAT 5886 ATOM 93225 O WAT 5887 59.342 69.263 95.761 1.00 0.00 O ATOM 93226 H1 WAT 5887 59.683 70.028 96.225 1.00 0.00 H ATOM 93227 H2 WAT 5887 59.237 69.558 94.857 1.00 0.00 H TER 93229 WAT 5887 ATOM 93229 O WAT 5888 0.303 33.112 65.089 1.00 0.00 O ATOM 93230 H1 WAT 5888 -0.507 32.683 65.368 1.00 0.00 H ATOM 93231 H2 WAT 5888 0.090 33.495 64.238 1.00 0.00 H TER 93233 WAT 5888 ATOM 93233 O WAT 5889 86.268 12.655 72.073 1.00 0.00 O ATOM 93234 H1 WAT 5889 86.099 11.786 72.439 1.00 0.00 H ATOM 93235 H2 WAT 5889 87.182 12.833 72.292 1.00 0.00 H TER 93237 WAT 5889 ATOM 93237 O WAT 5890 2.031 69.844 66.720 1.00 0.00 O ATOM 93238 H1 WAT 5890 1.284 69.665 66.148 1.00 0.00 H ATOM 93239 H2 WAT 5890 1.710 70.509 67.330 1.00 0.00 H TER 93241 WAT 5890 ATOM 93241 O WAT 5891 11.716 16.729 136.769 1.00 0.00 O ATOM 93242 H1 WAT 5891 11.595 17.671 136.651 1.00 0.00 H ATOM 93243 H2 WAT 5891 10.826 16.377 136.812 1.00 0.00 H TER 93245 WAT 5891 ATOM 93245 O WAT 5892 53.801 123.127 118.614 1.00 0.00 O ATOM 93246 H1 WAT 5892 54.601 123.175 118.091 1.00 0.00 H ATOM 93247 H2 WAT 5892 53.691 124.011 118.964 1.00 0.00 H TER 93249 WAT 5892 ATOM 93249 O WAT 5893 39.202 83.284 77.612 1.00 0.00 O ATOM 93250 H1 WAT 5893 39.297 83.767 78.432 1.00 0.00 H ATOM 93251 H2 WAT 5893 38.481 83.720 77.159 1.00 0.00 H TER 93253 WAT 5893 ATOM 93253 O WAT 5894 70.946 43.592 110.533 1.00 0.00 O ATOM 93254 H1 WAT 5894 70.455 42.886 110.114 1.00 0.00 H ATOM 93255 H2 WAT 5894 71.099 44.226 109.833 1.00 0.00 H TER 93257 WAT 5894 ATOM 93257 O WAT 5895 22.588 30.611 116.468 1.00 0.00 O ATOM 93258 H1 WAT 5895 22.519 31.197 115.714 1.00 0.00 H ATOM 93259 H2 WAT 5895 23.524 30.426 116.543 1.00 0.00 H TER 93261 WAT 5895 ATOM 93261 O WAT 5896 118.865 104.175 138.532 1.00 0.00 O ATOM 93262 H1 WAT 5896 119.016 103.258 138.302 1.00 0.00 H ATOM 93263 H2 WAT 5896 118.372 104.529 137.791 1.00 0.00 H TER 93265 WAT 5896 ATOM 93265 O WAT 5897 101.627 64.702 16.446 1.00 0.00 O ATOM 93266 H1 WAT 5897 101.597 63.886 15.947 1.00 0.00 H ATOM 93267 H2 WAT 5897 100.724 64.845 16.727 1.00 0.00 H TER 93269 WAT 5897 ATOM 93269 O WAT 5898 21.825 8.942 3.737 1.00 0.00 O ATOM 93270 H1 WAT 5898 21.642 9.722 4.261 1.00 0.00 H ATOM 93271 H2 WAT 5898 21.179 8.971 3.031 1.00 0.00 H TER 93273 WAT 5898 ATOM 93273 O WAT 5899 95.096 44.153 158.410 1.00 0.00 O ATOM 93274 H1 WAT 5899 95.756 43.524 158.700 1.00 0.00 H ATOM 93275 H2 WAT 5899 94.599 44.361 159.202 1.00 0.00 H TER 93277 WAT 5899 ATOM 93277 O WAT 5900 64.627 57.848 11.661 1.00 0.00 O ATOM 93278 H1 WAT 5900 64.304 57.762 12.557 1.00 0.00 H ATOM 93279 H2 WAT 5900 63.839 57.984 11.134 1.00 0.00 H TER 93281 WAT 5900 ATOM 93281 O WAT 5901 7.889 69.626 118.415 1.00 0.00 O ATOM 93282 H1 WAT 5901 7.583 70.396 117.935 1.00 0.00 H ATOM 93283 H2 WAT 5901 7.096 69.253 118.799 1.00 0.00 H TER 93285 WAT 5901 ATOM 93285 O WAT 5902 9.467 98.404 105.016 1.00 0.00 O ATOM 93286 H1 WAT 5902 9.682 97.483 105.168 1.00 0.00 H ATOM 93287 H2 WAT 5902 9.338 98.467 104.070 1.00 0.00 H TER 93289 WAT 5902 ATOM 93289 O WAT 5903 18.826 83.800 61.103 1.00 0.00 O ATOM 93290 H1 WAT 5903 19.194 83.105 61.649 1.00 0.00 H ATOM 93291 H2 WAT 5903 18.707 83.394 60.245 1.00 0.00 H TER 93293 WAT 5903 ATOM 93293 O WAT 5904 48.514 94.047 149.486 1.00 0.00 O ATOM 93294 H1 WAT 5904 49.197 93.858 150.130 1.00 0.00 H ATOM 93295 H2 WAT 5904 48.294 93.193 149.113 1.00 0.00 H TER 93297 WAT 5904 ATOM 93297 O WAT 5905 72.235 59.906 150.864 1.00 0.00 O ATOM 93298 H1 WAT 5905 73.099 59.552 151.074 1.00 0.00 H ATOM 93299 H2 WAT 5905 71.815 59.220 150.344 1.00 0.00 H TER 93301 WAT 5905 ATOM 93301 O WAT 5906 108.493 115.543 131.186 1.00 0.00 O ATOM 93302 H1 WAT 5906 108.019 115.156 130.450 1.00 0.00 H ATOM 93303 H2 WAT 5906 109.149 114.887 131.421 1.00 0.00 H TER 93305 WAT 5906 ATOM 93305 O WAT 5907 21.576 11.248 113.104 1.00 0.00 O ATOM 93306 H1 WAT 5907 22.468 10.912 113.190 1.00 0.00 H ATOM 93307 H2 WAT 5907 21.036 10.623 113.587 1.00 0.00 H TER 93309 WAT 5907 ATOM 93309 O WAT 5908 112.050 12.864 104.241 1.00 0.00 O ATOM 93310 H1 WAT 5908 111.283 13.353 103.944 1.00 0.00 H ATOM 93311 H2 WAT 5908 112.549 13.494 104.761 1.00 0.00 H TER 93313 WAT 5908 ATOM 93313 O WAT 5909 105.412 105.411 9.865 1.00 0.00 O ATOM 93314 H1 WAT 5909 105.295 104.991 9.013 1.00 0.00 H ATOM 93315 H2 WAT 5909 106.339 105.649 9.889 1.00 0.00 H TER 93317 WAT 5909 ATOM 93317 O WAT 5910 58.472 27.433 107.930 1.00 0.00 O ATOM 93318 H1 WAT 5910 59.274 27.244 108.416 1.00 0.00 H ATOM 93319 H2 WAT 5910 57.768 27.268 108.557 1.00 0.00 H TER 93321 WAT 5910 ATOM 93321 O WAT 5911 26.965 106.533 113.965 1.00 0.00 O ATOM 93322 H1 WAT 5911 27.002 105.813 114.593 1.00 0.00 H ATOM 93323 H2 WAT 5911 26.757 106.113 113.130 1.00 0.00 H TER 93325 WAT 5911 ATOM 93325 O WAT 5912 127.947 42.346 135.351 1.00 0.00 O ATOM 93326 H1 WAT 5912 128.262 42.398 136.253 1.00 0.00 H ATOM 93327 H2 WAT 5912 128.683 41.981 134.860 1.00 0.00 H TER 93329 WAT 5912 ATOM 93329 O WAT 5913 74.595 125.997 146.588 1.00 0.00 O ATOM 93330 H1 WAT 5913 74.139 125.633 145.829 1.00 0.00 H ATOM 93331 H2 WAT 5913 74.781 126.904 146.344 1.00 0.00 H TER 93333 WAT 5913 ATOM 93333 O WAT 5914 84.403 74.485 149.615 1.00 0.00 O ATOM 93334 H1 WAT 5914 84.706 74.520 148.707 1.00 0.00 H ATOM 93335 H2 WAT 5914 84.817 73.700 149.974 1.00 0.00 H TER 93337 WAT 5914 ATOM 93337 O WAT 5915 54.044 71.258 121.719 1.00 0.00 O ATOM 93338 H1 WAT 5915 54.387 70.525 122.230 1.00 0.00 H ATOM 93339 H2 WAT 5915 54.471 72.030 122.090 1.00 0.00 H TER 93341 WAT 5915 ATOM 93341 O WAT 5916 51.748 34.771 91.319 1.00 0.00 O ATOM 93342 H1 WAT 5916 51.241 35.331 90.731 1.00 0.00 H ATOM 93343 H2 WAT 5916 52.305 34.254 90.737 1.00 0.00 H TER 93345 WAT 5916 ATOM 93345 O WAT 5917 97.391 77.823 110.952 1.00 0.00 O ATOM 93346 H1 WAT 5917 97.263 78.746 111.170 1.00 0.00 H ATOM 93347 H2 WAT 5917 97.273 77.362 111.782 1.00 0.00 H TER 93349 WAT 5917 ATOM 93349 O WAT 5918 48.601 115.081 127.359 1.00 0.00 O ATOM 93350 H1 WAT 5918 47.661 115.230 127.260 1.00 0.00 H ATOM 93351 H2 WAT 5918 48.663 114.277 127.875 1.00 0.00 H TER 93353 WAT 5918 ATOM 93353 O WAT 5919 11.726 83.673 154.768 1.00 0.00 O ATOM 93354 H1 WAT 5919 11.336 84.195 155.469 1.00 0.00 H ATOM 93355 H2 WAT 5919 12.654 83.620 154.996 1.00 0.00 H TER 93357 WAT 5919 ATOM 93357 O WAT 5920 74.970 69.916 9.211 1.00 0.00 O ATOM 93358 H1 WAT 5920 74.703 69.817 10.125 1.00 0.00 H ATOM 93359 H2 WAT 5920 75.530 70.692 9.208 1.00 0.00 H TER 93361 WAT 5920 ATOM 93361 O WAT 5921 0.181 95.738 145.435 1.00 0.00 O ATOM 93362 H1 WAT 5921 0.476 94.888 145.761 1.00 0.00 H ATOM 93363 H2 WAT 5921 0.960 96.293 145.477 1.00 0.00 H TER 93365 WAT 5921 ATOM 93365 O WAT 5922 105.089 59.586 107.442 1.00 0.00 O ATOM 93366 H1 WAT 5922 105.372 59.251 108.293 1.00 0.00 H ATOM 93367 H2 WAT 5922 105.403 60.490 107.425 1.00 0.00 H TER 93369 WAT 5922 ATOM 93369 O WAT 5923 122.126 17.191 147.448 1.00 0.00 O ATOM 93370 H1 WAT 5923 122.324 17.693 148.239 1.00 0.00 H ATOM 93371 H2 WAT 5923 121.727 16.383 147.770 1.00 0.00 H TER 93373 WAT 5923 ATOM 93373 O WAT 5924 30.803 122.194 134.054 1.00 0.00 O ATOM 93374 H1 WAT 5924 31.249 122.732 133.400 1.00 0.00 H ATOM 93375 H2 WAT 5924 29.871 122.322 133.874 1.00 0.00 H TER 93377 WAT 5924 ATOM 93377 O WAT 5925 128.394 136.475 107.331 1.00 0.00 O ATOM 93378 H1 WAT 5925 128.452 137.425 107.440 1.00 0.00 H ATOM 93379 H2 WAT 5925 127.468 136.310 107.157 1.00 0.00 H TER 93381 WAT 5925 ATOM 93381 O WAT 5926 128.935 44.555 102.056 1.00 0.00 O ATOM 93382 H1 WAT 5926 129.805 44.939 101.948 1.00 0.00 H ATOM 93383 H2 WAT 5926 128.344 45.178 101.634 1.00 0.00 H TER 93385 WAT 5926 ATOM 93385 O WAT 5927 0.454 79.533 75.370 1.00 0.00 O ATOM 93386 H1 WAT 5927 0.897 79.268 74.564 1.00 0.00 H ATOM 93387 H2 WAT 5927 -0.443 79.216 75.265 1.00 0.00 H TER 93389 WAT 5927 ATOM 93389 O WAT 5928 99.949 50.844 21.085 1.00 0.00 O ATOM 93390 H1 WAT 5928 99.816 51.783 20.951 1.00 0.00 H ATOM 93391 H2 WAT 5928 99.511 50.656 21.915 1.00 0.00 H TER 93393 WAT 5928 ATOM 93393 O WAT 5929 138.977 138.200 111.661 1.00 0.00 O ATOM 93394 H1 WAT 5929 139.279 137.351 111.337 1.00 0.00 H ATOM 93395 H2 WAT 5929 138.027 138.109 111.722 1.00 0.00 H TER 93397 WAT 5929 ATOM 93397 O WAT 5930 37.002 31.462 8.934 1.00 0.00 O ATOM 93398 H1 WAT 5930 36.490 31.430 8.127 1.00 0.00 H ATOM 93399 H2 WAT 5930 36.391 31.790 9.594 1.00 0.00 H TER 93401 WAT 5930 ATOM 93401 O WAT 5931 122.473 15.362 66.381 1.00 0.00 O ATOM 93402 H1 WAT 5931 122.860 14.815 67.064 1.00 0.00 H ATOM 93403 H2 WAT 5931 122.875 15.051 65.569 1.00 0.00 H TER 93405 WAT 5931 ATOM 93405 O WAT 5932 93.366 74.473 115.402 1.00 0.00 O ATOM 93406 H1 WAT 5932 93.465 75.409 115.228 1.00 0.00 H ATOM 93407 H2 WAT 5932 93.572 74.051 114.567 1.00 0.00 H TER 93409 WAT 5932 ATOM 93409 O WAT 5933 91.490 35.607 156.357 1.00 0.00 O ATOM 93410 H1 WAT 5933 91.073 36.029 157.109 1.00 0.00 H ATOM 93411 H2 WAT 5933 92.393 35.458 156.636 1.00 0.00 H TER 93413 WAT 5933 ATOM 93413 O WAT 5934 140.323 53.727 19.955 1.00 0.00 O ATOM 93414 H1 WAT 5934 139.833 54.060 20.706 1.00 0.00 H ATOM 93415 H2 WAT 5934 140.911 53.068 20.325 1.00 0.00 H TER 93417 WAT 5934 ATOM 93417 O WAT 5935 21.739 133.681 80.365 1.00 0.00 O ATOM 93418 H1 WAT 5935 22.535 133.920 79.889 1.00 0.00 H ATOM 93419 H2 WAT 5935 21.921 133.924 81.273 1.00 0.00 H TER 93421 WAT 5935 ATOM 93421 O WAT 5936 34.421 138.736 97.422 1.00 0.00 O ATOM 93422 H1 WAT 5936 33.827 139.482 97.503 1.00 0.00 H ATOM 93423 H2 WAT 5936 35.057 138.858 98.127 1.00 0.00 H TER 93425 WAT 5936 ATOM 93425 O WAT 5937 47.396 135.044 133.532 1.00 0.00 O ATOM 93426 H1 WAT 5937 47.985 134.810 132.814 1.00 0.00 H ATOM 93427 H2 WAT 5937 46.522 135.023 133.142 1.00 0.00 H TER 93429 WAT 5937 ATOM 93429 O WAT 5938 110.032 118.228 155.459 1.00 0.00 O ATOM 93430 H1 WAT 5938 109.559 117.432 155.704 1.00 0.00 H ATOM 93431 H2 WAT 5938 110.708 118.321 156.130 1.00 0.00 H TER 93433 WAT 5938 ATOM 93433 O WAT 5939 135.651 87.241 143.596 1.00 0.00 O ATOM 93434 H1 WAT 5939 135.233 87.334 144.452 1.00 0.00 H ATOM 93435 H2 WAT 5939 135.756 88.138 143.281 1.00 0.00 H TER 93437 WAT 5939 ATOM 93437 O WAT 5940 11.499 44.776 95.255 1.00 0.00 O ATOM 93438 H1 WAT 5940 10.598 44.990 95.011 1.00 0.00 H ATOM 93439 H2 WAT 5940 11.583 43.842 95.066 1.00 0.00 H TER 93441 WAT 5940 ATOM 93441 O WAT 5941 72.909 73.370 105.143 1.00 0.00 O ATOM 93442 H1 WAT 5941 72.519 72.499 105.210 1.00 0.00 H ATOM 93443 H2 WAT 5941 72.164 73.958 105.016 1.00 0.00 H TER 93445 WAT 5941 ATOM 93445 O WAT 5942 105.183 102.879 116.970 1.00 0.00 O ATOM 93446 H1 WAT 5942 105.141 103.214 116.074 1.00 0.00 H ATOM 93447 H2 WAT 5942 105.568 103.594 117.476 1.00 0.00 H TER 93449 WAT 5942 ATOM 93449 O WAT 5943 85.968 134.217 74.406 1.00 0.00 O ATOM 93450 H1 WAT 5943 85.733 134.648 73.584 1.00 0.00 H ATOM 93451 H2 WAT 5943 86.786 134.639 74.672 1.00 0.00 H TER 93453 WAT 5943 ATOM 93453 O WAT 5944 0.647 127.180 85.210 1.00 0.00 O ATOM 93454 H1 WAT 5944 1.525 126.939 84.915 1.00 0.00 H ATOM 93455 H2 WAT 5944 0.713 127.203 86.165 1.00 0.00 H TER 93457 WAT 5944 ATOM 93457 O WAT 5945 34.582 89.340 73.133 1.00 0.00 O ATOM 93458 H1 WAT 5945 33.976 89.511 72.412 1.00 0.00 H ATOM 93459 H2 WAT 5945 34.017 89.129 73.876 1.00 0.00 H TER 93461 WAT 5945 ATOM 93461 O WAT 5946 9.916 101.096 21.985 1.00 0.00 O ATOM 93462 H1 WAT 5946 10.399 100.391 22.416 1.00 0.00 H ATOM 93463 H2 WAT 5946 10.032 101.852 22.561 1.00 0.00 H TER 93465 WAT 5946 ATOM 93465 O WAT 5947 85.225 38.519 90.453 1.00 0.00 O ATOM 93466 H1 WAT 5947 85.365 38.343 89.523 1.00 0.00 H ATOM 93467 H2 WAT 5947 85.405 39.454 90.550 1.00 0.00 H TER 93469 WAT 5947 ATOM 93469 O WAT 5948 92.332 97.885 144.105 1.00 0.00 O ATOM 93470 H1 WAT 5948 93.179 98.251 144.360 1.00 0.00 H ATOM 93471 H2 WAT 5948 92.453 96.937 144.167 1.00 0.00 H TER 93473 WAT 5948 ATOM 93473 O WAT 5949 1.469 84.755 136.162 1.00 0.00 O ATOM 93474 H1 WAT 5949 2.339 84.521 136.486 1.00 0.00 H ATOM 93475 H2 WAT 5949 1.519 84.612 135.217 1.00 0.00 H TER 93477 WAT 5949 ATOM 93477 O WAT 5950 104.900 106.802 106.778 1.00 0.00 O ATOM 93478 H1 WAT 5950 105.514 106.802 106.044 1.00 0.00 H ATOM 93479 H2 WAT 5950 104.663 105.881 106.892 1.00 0.00 H TER 93481 WAT 5950 ATOM 93481 O WAT 5951 54.673 91.249 125.119 1.00 0.00 O ATOM 93482 H1 WAT 5951 54.579 90.959 126.027 1.00 0.00 H ATOM 93483 H2 WAT 5951 55.497 91.737 125.108 1.00 0.00 H TER 93485 WAT 5951 ATOM 93485 O WAT 5952 114.702 115.306 142.155 1.00 0.00 O ATOM 93486 H1 WAT 5952 114.773 115.604 141.248 1.00 0.00 H ATOM 93487 H2 WAT 5952 114.084 114.576 142.120 1.00 0.00 H TER 93489 WAT 5952 ATOM 93489 O WAT 5953 24.364 23.488 101.104 1.00 0.00 O ATOM 93490 H1 WAT 5953 24.950 23.727 100.385 1.00 0.00 H ATOM 93491 H2 WAT 5953 24.715 23.954 101.863 1.00 0.00 H TER 93493 WAT 5953 ATOM 93493 O WAT 5954 1.604 87.042 116.844 1.00 0.00 O ATOM 93494 H1 WAT 5954 2.332 86.787 117.411 1.00 0.00 H ATOM 93495 H2 WAT 5954 2.015 87.536 116.134 1.00 0.00 H TER 93497 WAT 5954 ATOM 93497 O WAT 5955 25.382 42.520 85.795 1.00 0.00 O ATOM 93498 H1 WAT 5955 25.281 41.938 86.548 1.00 0.00 H ATOM 93499 H2 WAT 5955 24.658 43.141 85.872 1.00 0.00 H TER 93501 WAT 5955 ATOM 93501 O WAT 5956 84.004 73.156 98.814 1.00 0.00 O ATOM 93502 H1 WAT 5956 83.181 72.671 98.862 1.00 0.00 H ATOM 93503 H2 WAT 5956 84.682 72.480 98.827 1.00 0.00 H TER 93505 WAT 5956 ATOM 93505 O WAT 5957 115.933 86.228 105.846 1.00 0.00 O ATOM 93506 H1 WAT 5957 115.120 85.977 105.408 1.00 0.00 H ATOM 93507 H2 WAT 5957 115.967 85.671 106.624 1.00 0.00 H TER 93509 WAT 5957 ATOM 93509 O WAT 5958 36.609 94.214 94.545 1.00 0.00 O ATOM 93510 H1 WAT 5958 37.124 93.910 95.292 1.00 0.00 H ATOM 93511 H2 WAT 5958 35.888 94.707 94.936 1.00 0.00 H TER 93513 WAT 5958 ATOM 93513 O WAT 5959 18.252 76.688 13.890 1.00 0.00 O ATOM 93514 H1 WAT 5959 18.438 77.110 14.729 1.00 0.00 H ATOM 93515 H2 WAT 5959 18.310 75.751 14.075 1.00 0.00 H TER 93517 WAT 5959 ATOM 93517 O WAT 5960 28.402 120.406 91.114 1.00 0.00 O ATOM 93518 H1 WAT 5960 28.942 119.647 91.338 1.00 0.00 H ATOM 93519 H2 WAT 5960 27.657 120.355 91.713 1.00 0.00 H TER 93521 WAT 5960 ATOM 93521 O WAT 5961 97.024 31.815 157.214 1.00 0.00 O ATOM 93522 H1 WAT 5961 96.457 31.731 156.447 1.00 0.00 H ATOM 93523 H2 WAT 5961 97.768 32.333 156.906 1.00 0.00 H TER 93525 WAT 5961 ATOM 93525 O WAT 5962 67.495 27.714 141.397 1.00 0.00 O ATOM 93526 H1 WAT 5962 66.942 27.712 140.615 1.00 0.00 H ATOM 93527 H2 WAT 5962 67.460 28.616 141.713 1.00 0.00 H TER 93529 WAT 5962 ATOM 93529 O WAT 5963 126.801 24.775 123.096 1.00 0.00 O ATOM 93530 H1 WAT 5963 126.094 24.696 122.456 1.00 0.00 H ATOM 93531 H2 WAT 5963 126.451 25.359 123.769 1.00 0.00 H TER 93533 WAT 5963 ATOM 93533 O WAT 5964 90.372 53.795 22.215 1.00 0.00 O ATOM 93534 H1 WAT 5964 91.282 53.535 22.358 1.00 0.00 H ATOM 93535 H2 WAT 5964 89.968 53.033 21.801 1.00 0.00 H TER 93537 WAT 5964 ATOM 93537 O WAT 5965 5.450 3.384 121.881 1.00 0.00 O ATOM 93538 H1 WAT 5965 4.983 3.847 121.185 1.00 0.00 H ATOM 93539 H2 WAT 5965 5.202 2.467 121.767 1.00 0.00 H TER 93541 WAT 5965 ATOM 93541 O WAT 5966 111.004 106.540 152.390 1.00 0.00 O ATOM 93542 H1 WAT 5966 110.405 107.066 152.920 1.00 0.00 H ATOM 93543 H2 WAT 5966 111.241 105.805 152.955 1.00 0.00 H TER 93545 WAT 5966 ATOM 93545 O WAT 5967 136.190 40.514 81.376 1.00 0.00 O ATOM 93546 H1 WAT 5967 137.052 40.249 81.052 1.00 0.00 H ATOM 93547 H2 WAT 5967 135.647 40.571 80.590 1.00 0.00 H TER 93549 WAT 5967 ATOM 93549 O WAT 5968 138.971 107.880 119.157 1.00 0.00 O ATOM 93550 H1 WAT 5968 139.331 107.045 119.457 1.00 0.00 H ATOM 93551 H2 WAT 5968 138.097 107.917 119.545 1.00 0.00 H TER 93553 WAT 5968 ATOM 93553 O WAT 5969 85.501 30.629 75.359 1.00 0.00 O ATOM 93554 H1 WAT 5969 84.682 30.160 75.523 1.00 0.00 H ATOM 93555 H2 WAT 5969 86.143 29.938 75.196 1.00 0.00 H TER 93557 WAT 5969 ATOM 93557 O WAT 5970 124.321 115.548 107.240 1.00 0.00 O ATOM 93558 H1 WAT 5970 123.437 115.829 107.004 1.00 0.00 H ATOM 93559 H2 WAT 5970 124.188 114.765 107.774 1.00 0.00 H TER 93561 WAT 5970 ATOM 93561 O WAT 5971 63.057 100.871 109.265 1.00 0.00 O ATOM 93562 H1 WAT 5971 63.227 100.126 109.841 1.00 0.00 H ATOM 93563 H2 WAT 5971 63.681 101.539 109.546 1.00 0.00 H TER 93565 WAT 5971 ATOM 93565 O WAT 5972 63.384 56.247 84.284 1.00 0.00 O ATOM 93566 H1 WAT 5972 64.037 55.668 83.892 1.00 0.00 H ATOM 93567 H2 WAT 5972 63.772 57.120 84.229 1.00 0.00 H TER 93569 WAT 5972 ATOM 93569 O WAT 5973 54.309 77.158 136.154 1.00 0.00 O ATOM 93570 H1 WAT 5973 53.406 76.883 136.315 1.00 0.00 H ATOM 93571 H2 WAT 5973 54.655 76.502 135.549 1.00 0.00 H TER 93573 WAT 5973 ATOM 93573 O WAT 5974 130.548 63.522 131.901 1.00 0.00 O ATOM 93574 H1 WAT 5974 131.400 63.231 131.577 1.00 0.00 H ATOM 93575 H2 WAT 5974 130.681 64.442 132.132 1.00 0.00 H TER 93577 WAT 5974 ATOM 93577 O WAT 5975 61.603 86.241 24.487 1.00 0.00 O ATOM 93578 H1 WAT 5975 61.641 85.662 23.726 1.00 0.00 H ATOM 93579 H2 WAT 5975 62.304 86.875 24.339 1.00 0.00 H TER 93581 WAT 5975 ATOM 93581 O WAT 5976 10.064 87.489 100.567 1.00 0.00 O ATOM 93582 H1 WAT 5976 10.543 86.907 99.977 1.00 0.00 H ATOM 93583 H2 WAT 5976 10.252 87.150 101.443 1.00 0.00 H TER 93585 WAT 5976 ATOM 93585 O WAT 5977 52.372 116.396 112.316 1.00 0.00 O ATOM 93586 H1 WAT 5977 52.766 115.629 111.899 1.00 0.00 H ATOM 93587 H2 WAT 5977 52.966 117.116 112.102 1.00 0.00 H TER 93589 WAT 5977 ATOM 93589 O WAT 5978 140.742 113.348 65.667 1.00 0.00 O ATOM 93590 H1 WAT 5978 140.667 112.950 64.800 1.00 0.00 H ATOM 93591 H2 WAT 5978 140.788 114.289 65.495 1.00 0.00 H TER 93593 WAT 5978 ATOM 93593 O WAT 5979 98.649 115.895 91.052 1.00 0.00 O ATOM 93594 H1 WAT 5979 99.398 115.298 91.052 1.00 0.00 H ATOM 93595 H2 WAT 5979 99.001 116.720 90.718 1.00 0.00 H TER 93597 WAT 5979 ATOM 93597 O WAT 5980 50.246 84.719 58.987 1.00 0.00 O ATOM 93598 H1 WAT 5980 49.318 84.701 58.756 1.00 0.00 H ATOM 93599 H2 WAT 5980 50.657 84.106 58.378 1.00 0.00 H TER 93601 WAT 5980 ATOM 93601 O WAT 5981 88.975 19.328 11.595 1.00 0.00 O ATOM 93602 H1 WAT 5981 88.357 19.589 10.912 1.00 0.00 H ATOM 93603 H2 WAT 5981 88.829 18.389 11.705 1.00 0.00 H TER 93605 WAT 5981 ATOM 93605 O WAT 5982 56.190 36.202 138.167 1.00 0.00 O ATOM 93606 H1 WAT 5982 56.495 36.531 137.321 1.00 0.00 H ATOM 93607 H2 WAT 5982 55.628 36.898 138.506 1.00 0.00 H TER 93609 WAT 5982 ATOM 93609 O WAT 5983 108.539 22.812 140.191 1.00 0.00 O ATOM 93610 H1 WAT 5983 109.354 22.421 139.876 1.00 0.00 H ATOM 93611 H2 WAT 5983 108.743 23.110 141.077 1.00 0.00 H TER 93613 WAT 5983 ATOM 93613 O WAT 5984 83.811 98.650 131.334 1.00 0.00 O ATOM 93614 H1 WAT 5984 83.709 97.702 131.257 1.00 0.00 H ATOM 93615 H2 WAT 5984 84.756 98.794 131.289 1.00 0.00 H TER 93617 WAT 5984 ATOM 93617 O WAT 5985 13.373 143.224 83.167 1.00 0.00 O ATOM 93618 H1 WAT 5985 13.666 144.129 83.059 1.00 0.00 H ATOM 93619 H2 WAT 5985 13.709 142.965 84.025 1.00 0.00 H TER 93621 WAT 5985 ATOM 93621 O WAT 5986 135.545 48.876 78.547 1.00 0.00 O ATOM 93622 H1 WAT 5986 135.494 49.668 78.012 1.00 0.00 H ATOM 93623 H2 WAT 5986 135.249 48.175 77.967 1.00 0.00 H TER 93625 WAT 5986 ATOM 93625 O WAT 5987 66.064 34.442 76.480 1.00 0.00 O ATOM 93626 H1 WAT 5987 65.590 35.269 76.566 1.00 0.00 H ATOM 93627 H2 WAT 5987 66.984 34.698 76.419 1.00 0.00 H TER 93629 WAT 5987 ATOM 93629 O WAT 5988 83.909 126.861 61.350 1.00 0.00 O ATOM 93630 H1 WAT 5988 83.182 126.801 60.730 1.00 0.00 H ATOM 93631 H2 WAT 5988 83.963 127.792 61.567 1.00 0.00 H TER 93633 WAT 5988 ATOM 93633 O WAT 5989 71.433 121.057 131.289 1.00 0.00 O ATOM 93634 H1 WAT 5989 71.307 121.101 130.341 1.00 0.00 H ATOM 93635 H2 WAT 5989 70.726 120.491 131.599 1.00 0.00 H TER 93637 WAT 5989 ATOM 93637 O WAT 5990 108.102 11.483 9.463 1.00 0.00 O ATOM 93638 H1 WAT 5990 108.301 12.221 10.040 1.00 0.00 H ATOM 93639 H2 WAT 5990 107.288 11.119 9.812 1.00 0.00 H TER 93641 WAT 5990 ATOM 93641 O WAT 5991 16.323 93.776 140.093 1.00 0.00 O ATOM 93642 H1 WAT 5991 16.604 92.870 139.964 1.00 0.00 H ATOM 93643 H2 WAT 5991 15.596 93.716 140.713 1.00 0.00 H TER 93645 WAT 5991 ATOM 93645 O WAT 5992 54.360 44.638 146.398 1.00 0.00 O ATOM 93646 H1 WAT 5992 55.315 44.574 146.419 1.00 0.00 H ATOM 93647 H2 WAT 5992 54.166 45.041 145.552 1.00 0.00 H TER 93649 WAT 5992 ATOM 93649 O WAT 5993 60.905 97.948 126.497 1.00 0.00 O ATOM 93650 H1 WAT 5993 60.146 98.519 126.617 1.00 0.00 H ATOM 93651 H2 WAT 5993 60.529 97.083 126.330 1.00 0.00 H TER 93653 WAT 5993 ATOM 93653 O WAT 5994 81.116 6.837 111.250 1.00 0.00 O ATOM 93654 H1 WAT 5994 81.411 6.947 110.346 1.00 0.00 H ATOM 93655 H2 WAT 5994 81.914 6.639 111.740 1.00 0.00 H TER 93657 WAT 5994 ATOM 93657 O WAT 5995 56.630 98.195 63.793 1.00 0.00 O ATOM 93658 H1 WAT 5995 55.781 97.890 64.114 1.00 0.00 H ATOM 93659 H2 WAT 5995 56.732 97.767 62.943 1.00 0.00 H TER 93661 WAT 5995 ATOM 93661 O WAT 5996 140.917 39.793 91.044 1.00 0.00 O ATOM 93662 H1 WAT 5996 141.550 40.511 91.037 1.00 0.00 H ATOM 93663 H2 WAT 5996 140.395 39.941 91.832 1.00 0.00 H TER 93665 WAT 5996 ATOM 93665 O WAT 5997 33.485 12.126 10.348 1.00 0.00 O ATOM 93666 H1 WAT 5997 33.758 11.237 10.122 1.00 0.00 H ATOM 93667 H2 WAT 5997 34.079 12.691 9.854 1.00 0.00 H TER 93669 WAT 5997 ATOM 93669 O WAT 5998 82.036 42.396 71.074 1.00 0.00 O ATOM 93670 H1 WAT 5998 82.346 41.517 71.290 1.00 0.00 H ATOM 93671 H2 WAT 5998 82.221 42.915 71.857 1.00 0.00 H TER 93673 WAT 5998 ATOM 93673 O WAT 5999 51.505 112.306 104.245 1.00 0.00 O ATOM 93674 H1 WAT 5999 50.646 111.892 104.162 1.00 0.00 H ATOM 93675 H2 WAT 5999 51.861 111.958 105.062 1.00 0.00 H TER 93677 WAT 5999 ATOM 93677 O WAT 6000 60.906 7.418 155.407 1.00 0.00 O ATOM 93678 H1 WAT 6000 61.854 7.498 155.301 1.00 0.00 H ATOM 93679 H2 WAT 6000 60.626 6.883 154.665 1.00 0.00 H TER 93681 WAT 6000 ATOM 93681 O WAT 6001 142.227 78.111 122.025 1.00 0.00 O ATOM 93682 H1 WAT 6001 141.617 77.394 122.197 1.00 0.00 H ATOM 93683 H2 WAT 6001 142.970 77.693 121.590 1.00 0.00 H TER 93685 WAT 6001 ATOM 93685 O WAT 6002 140.838 75.934 142.283 1.00 0.00 O ATOM 93686 H1 WAT 6002 140.722 75.591 143.170 1.00 0.00 H ATOM 93687 H2 WAT 6002 140.453 76.810 142.313 1.00 0.00 H TER 93689 WAT 6002 ATOM 93689 O WAT 6003 64.846 44.758 94.562 1.00 0.00 O ATOM 93690 H1 WAT 6003 64.719 44.117 93.862 1.00 0.00 H ATOM 93691 H2 WAT 6003 64.344 44.411 95.299 1.00 0.00 H TER 93693 WAT 6003 ATOM 93693 O WAT 6004 18.486 109.633 69.048 1.00 0.00 O ATOM 93694 H1 WAT 6004 18.407 108.730 69.358 1.00 0.00 H ATOM 93695 H2 WAT 6004 19.375 109.893 69.292 1.00 0.00 H TER 93697 WAT 6004 ATOM 93697 O WAT 6005 6.706 56.995 154.739 1.00 0.00 O ATOM 93698 H1 WAT 6005 6.648 57.929 154.939 1.00 0.00 H ATOM 93699 H2 WAT 6005 7.365 56.660 155.347 1.00 0.00 H TER 93701 WAT 6005 ATOM 93701 O WAT 6006 46.547 40.676 155.265 1.00 0.00 O ATOM 93702 H1 WAT 6006 46.263 41.532 155.587 1.00 0.00 H ATOM 93703 H2 WAT 6006 45.753 40.142 155.272 1.00 0.00 H TER 93705 WAT 6006 ATOM 93705 O WAT 6007 86.173 68.398 142.810 1.00 0.00 O ATOM 93706 H1 WAT 6007 85.986 69.203 142.326 1.00 0.00 H ATOM 93707 H2 WAT 6007 85.461 68.330 143.447 1.00 0.00 H TER 93709 WAT 6007 ATOM 93709 O WAT 6008 87.263 89.630 108.103 1.00 0.00 O ATOM 93710 H1 WAT 6008 86.763 90.035 107.395 1.00 0.00 H ATOM 93711 H2 WAT 6008 87.000 88.709 108.085 1.00 0.00 H TER 93713 WAT 6008 ATOM 93713 O WAT 6009 37.819 36.823 92.877 1.00 0.00 O ATOM 93714 H1 WAT 6009 37.162 36.161 93.092 1.00 0.00 H ATOM 93715 H2 WAT 6009 38.300 36.451 92.137 1.00 0.00 H TER 93717 WAT 6009 ATOM 93717 O WAT 6010 102.763 76.724 3.320 1.00 0.00 O ATOM 93718 H1 WAT 6010 102.504 76.867 2.410 1.00 0.00 H ATOM 93719 H2 WAT 6010 101.940 76.563 3.781 1.00 0.00 H TER 93721 WAT 6010 ATOM 93721 O WAT 6011 69.657 91.030 147.912 1.00 0.00 O ATOM 93722 H1 WAT 6011 69.586 90.880 146.969 1.00 0.00 H ATOM 93723 H2 WAT 6011 69.789 91.975 147.995 1.00 0.00 H TER 93725 WAT 6011 ATOM 93725 O WAT 6012 123.917 139.602 14.482 1.00 0.00 O ATOM 93726 H1 WAT 6012 122.995 139.820 14.343 1.00 0.00 H ATOM 93727 H2 WAT 6012 124.240 140.290 15.063 1.00 0.00 H TER 93729 WAT 6012 ATOM 93729 O WAT 6013 24.062 111.833 82.482 1.00 0.00 O ATOM 93730 H1 WAT 6013 24.535 111.461 83.227 1.00 0.00 H ATOM 93731 H2 WAT 6013 23.659 112.629 82.828 1.00 0.00 H TER 93733 WAT 6013 ATOM 93733 O WAT 6014 12.010 105.298 94.554 1.00 0.00 O ATOM 93734 H1 WAT 6014 12.821 105.585 94.135 1.00 0.00 H ATOM 93735 H2 WAT 6014 11.394 106.014 94.400 1.00 0.00 H TER 93737 WAT 6014 ATOM 93737 O WAT 6015 7.770 48.608 151.492 1.00 0.00 O ATOM 93738 H1 WAT 6015 6.987 48.780 152.015 1.00 0.00 H ATOM 93739 H2 WAT 6015 7.942 49.433 151.038 1.00 0.00 H TER 93741 WAT 6015 ATOM 93741 O WAT 6016 92.790 52.987 66.551 1.00 0.00 O ATOM 93742 H1 WAT 6016 93.566 53.546 66.516 1.00 0.00 H ATOM 93743 H2 WAT 6016 92.176 53.390 65.937 1.00 0.00 H TER 93745 WAT 6016 ATOM 93745 O WAT 6017 107.109 62.824 23.595 1.00 0.00 O ATOM 93746 H1 WAT 6017 107.031 62.803 24.549 1.00 0.00 H ATOM 93747 H2 WAT 6017 107.428 63.706 23.401 1.00 0.00 H TER 93749 WAT 6017 ATOM 93749 O WAT 6018 131.536 87.278 142.284 1.00 0.00 O ATOM 93750 H1 WAT 6018 131.562 87.197 143.237 1.00 0.00 H ATOM 93751 H2 WAT 6018 131.411 86.383 141.970 1.00 0.00 H TER 93753 WAT 6018 ATOM 93753 O WAT 6019 134.560 84.839 83.862 1.00 0.00 O ATOM 93754 H1 WAT 6019 133.625 84.991 83.995 1.00 0.00 H ATOM 93755 H2 WAT 6019 134.950 84.970 84.727 1.00 0.00 H TER 93757 WAT 6019 ATOM 93757 O WAT 6020 56.287 144.065 107.489 1.00 0.00 O ATOM 93758 H1 WAT 6020 56.795 143.419 107.978 1.00 0.00 H ATOM 93759 H2 WAT 6020 56.310 144.851 108.035 1.00 0.00 H TER 93761 WAT 6020 ATOM 93761 O WAT 6021 86.350 22.232 135.926 1.00 0.00 O ATOM 93762 H1 WAT 6021 86.890 22.808 135.384 1.00 0.00 H ATOM 93763 H2 WAT 6021 85.477 22.623 135.894 1.00 0.00 H TER 93765 WAT 6021 ATOM 93765 O WAT 6022 52.854 38.397 5.076 1.00 0.00 O ATOM 93766 H1 WAT 6022 53.286 37.550 4.968 1.00 0.00 H ATOM 93767 H2 WAT 6022 53.451 39.025 4.668 1.00 0.00 H TER 93769 WAT 6022 ATOM 93769 O WAT 6023 44.548 78.524 60.042 1.00 0.00 O ATOM 93770 H1 WAT 6023 43.805 78.966 60.453 1.00 0.00 H ATOM 93771 H2 WAT 6023 45.291 78.726 60.611 1.00 0.00 H TER 93773 WAT 6023 ATOM 93773 O WAT 6024 29.250 6.799 81.095 1.00 0.00 O ATOM 93774 H1 WAT 6024 29.756 6.893 81.902 1.00 0.00 H ATOM 93775 H2 WAT 6024 28.868 5.923 81.153 1.00 0.00 H TER 93777 WAT 6024 ATOM 93777 O WAT 6025 143.992 73.715 75.145 1.00 0.00 O ATOM 93778 H1 WAT 6025 143.764 74.329 74.447 1.00 0.00 H ATOM 93779 H2 WAT 6025 144.924 73.540 75.016 1.00 0.00 H TER 93781 WAT 6025 ATOM 93781 O WAT 6026 30.903 27.248 99.585 1.00 0.00 O ATOM 93782 H1 WAT 6026 30.980 26.819 98.733 1.00 0.00 H ATOM 93783 H2 WAT 6026 31.246 28.130 99.441 1.00 0.00 H TER 93785 WAT 6026 ATOM 93785 O WAT 6027 8.471 142.721 155.718 1.00 0.00 O ATOM 93786 H1 WAT 6027 9.045 142.294 155.082 1.00 0.00 H ATOM 93787 H2 WAT 6027 7.674 142.191 155.714 1.00 0.00 H TER 93789 WAT 6027 ATOM 93789 O WAT 6028 77.334 13.813 107.752 1.00 0.00 O ATOM 93790 H1 WAT 6028 77.044 13.296 108.504 1.00 0.00 H ATOM 93791 H2 WAT 6028 76.551 14.287 107.472 1.00 0.00 H TER 93793 WAT 6028 ATOM 93793 O WAT 6029 110.957 80.264 24.706 1.00 0.00 O ATOM 93794 H1 WAT 6029 111.122 81.126 25.089 1.00 0.00 H ATOM 93795 H2 WAT 6029 111.820 79.956 24.428 1.00 0.00 H TER 93797 WAT 6029 ATOM 93797 O WAT 6030 44.617 107.553 67.327 1.00 0.00 O ATOM 93798 H1 WAT 6030 43.904 107.050 66.932 1.00 0.00 H ATOM 93799 H2 WAT 6030 45.317 106.914 67.458 1.00 0.00 H TER 93801 WAT 6030 ATOM 93801 O WAT 6031 134.443 124.017 7.465 1.00 0.00 O ATOM 93802 H1 WAT 6031 134.085 124.162 6.589 1.00 0.00 H ATOM 93803 H2 WAT 6031 134.483 123.064 7.553 1.00 0.00 H TER 93805 WAT 6031 ATOM 93805 O WAT 6032 10.724 45.469 110.681 1.00 0.00 O ATOM 93806 H1 WAT 6032 10.112 45.987 110.158 1.00 0.00 H ATOM 93807 H2 WAT 6032 10.823 44.651 110.194 1.00 0.00 H TER 93809 WAT 6032 ATOM 93809 O WAT 6033 96.756 103.398 73.699 1.00 0.00 O ATOM 93810 H1 WAT 6033 96.606 103.058 74.581 1.00 0.00 H ATOM 93811 H2 WAT 6033 97.465 104.033 73.805 1.00 0.00 H TER 93813 WAT 6033 ATOM 93813 O WAT 6034 129.109 99.602 30.074 1.00 0.00 O ATOM 93814 H1 WAT 6034 128.265 99.589 29.623 1.00 0.00 H ATOM 93815 H2 WAT 6034 128.896 99.837 30.977 1.00 0.00 H TER 93817 WAT 6034 ATOM 93817 O WAT 6035 87.080 121.140 98.992 1.00 0.00 O ATOM 93818 H1 WAT 6035 87.460 120.370 99.416 1.00 0.00 H ATOM 93819 H2 WAT 6035 86.932 120.866 98.087 1.00 0.00 H TER 93821 WAT 6035 ATOM 93821 O WAT 6036 58.207 8.789 131.124 1.00 0.00 O ATOM 93822 H1 WAT 6036 58.514 8.551 130.250 1.00 0.00 H ATOM 93823 H2 WAT 6036 58.502 9.692 131.244 1.00 0.00 H TER 93825 WAT 6036 ATOM 93825 O WAT 6037 42.950 122.861 120.737 1.00 0.00 O ATOM 93826 H1 WAT 6037 41.997 122.921 120.665 1.00 0.00 H ATOM 93827 H2 WAT 6037 43.273 123.659 120.319 1.00 0.00 H TER 93829 WAT 6037 ATOM 93829 O WAT 6038 120.510 35.173 6.621 1.00 0.00 O ATOM 93830 H1 WAT 6038 119.864 34.494 6.431 1.00 0.00 H ATOM 93831 H2 WAT 6038 121.267 34.942 6.082 1.00 0.00 H TER 93833 WAT 6038 ATOM 93833 O WAT 6039 138.909 27.048 61.388 1.00 0.00 O ATOM 93834 H1 WAT 6039 138.339 27.789 61.592 1.00 0.00 H ATOM 93835 H2 WAT 6039 138.563 26.697 60.567 1.00 0.00 H TER 93837 WAT 6039 ATOM 93837 O WAT 6040 33.067 59.502 58.305 1.00 0.00 O ATOM 93838 H1 WAT 6040 32.461 59.191 57.632 1.00 0.00 H ATOM 93839 H2 WAT 6040 33.935 59.280 57.967 1.00 0.00 H TER 93841 WAT 6040 ATOM 93841 O WAT 6041 119.165 89.075 74.523 1.00 0.00 O ATOM 93842 H1 WAT 6041 118.886 88.994 75.435 1.00 0.00 H ATOM 93843 H2 WAT 6041 119.283 90.015 74.391 1.00 0.00 H TER 93845 WAT 6041 ATOM 93845 O WAT 6042 8.091 70.927 7.935 1.00 0.00 O ATOM 93846 H1 WAT 6042 8.599 70.339 7.376 1.00 0.00 H ATOM 93847 H2 WAT 6042 8.614 71.727 7.979 1.00 0.00 H TER 93849 WAT 6042 ATOM 93849 O WAT 6043 109.158 80.503 135.153 1.00 0.00 O ATOM 93850 H1 WAT 6043 109.059 80.727 134.228 1.00 0.00 H ATOM 93851 H2 WAT 6043 109.266 81.346 135.593 1.00 0.00 H TER 93853 WAT 6043 ATOM 93853 O WAT 6044 41.676 23.784 103.799 1.00 0.00 O ATOM 93854 H1 WAT 6044 42.146 23.178 104.372 1.00 0.00 H ATOM 93855 H2 WAT 6044 42.217 24.574 103.790 1.00 0.00 H TER 93857 WAT 6044 ATOM 93857 O WAT 6045 76.582 144.607 123.815 1.00 0.00 O ATOM 93858 H1 WAT 6045 77.433 144.740 123.398 1.00 0.00 H ATOM 93859 H2 WAT 6045 76.113 144.020 123.221 1.00 0.00 H TER 93861 WAT 6045 ATOM 93861 O WAT 6046 48.045 46.304 108.668 1.00 0.00 O ATOM 93862 H1 WAT 6046 47.468 47.058 108.795 1.00 0.00 H ATOM 93863 H2 WAT 6046 48.542 46.513 107.877 1.00 0.00 H TER 93865 WAT 6046 ATOM 93865 O WAT 6047 103.710 27.131 72.463 1.00 0.00 O ATOM 93866 H1 WAT 6047 103.562 27.890 71.899 1.00 0.00 H ATOM 93867 H2 WAT 6047 104.547 26.772 72.169 1.00 0.00 H TER 93869 WAT 6047 ATOM 93869 O WAT 6048 27.180 97.904 12.952 1.00 0.00 O ATOM 93870 H1 WAT 6048 26.970 98.153 12.052 1.00 0.00 H ATOM 93871 H2 WAT 6048 27.953 98.425 13.171 1.00 0.00 H TER 93873 WAT 6048 ATOM 93873 O WAT 6049 11.308 31.830 60.806 1.00 0.00 O ATOM 93874 H1 WAT 6049 11.660 31.418 60.017 1.00 0.00 H ATOM 93875 H2 WAT 6049 10.384 31.579 60.814 1.00 0.00 H TER 93877 WAT 6049 ATOM 93877 O WAT 6050 103.274 116.593 147.837 1.00 0.00 O ATOM 93878 H1 WAT 6050 102.810 116.404 147.021 1.00 0.00 H ATOM 93879 H2 WAT 6050 104.168 116.288 147.680 1.00 0.00 H TER 93881 WAT 6050 ATOM 93881 O WAT 6051 79.999 118.408 138.042 1.00 0.00 O ATOM 93882 H1 WAT 6051 79.763 118.591 137.133 1.00 0.00 H ATOM 93883 H2 WAT 6051 79.355 117.761 138.331 1.00 0.00 H TER 93885 WAT 6051 ATOM 93885 O WAT 6052 101.162 84.817 16.308 1.00 0.00 O ATOM 93886 H1 WAT 6052 102.104 84.655 16.242 1.00 0.00 H ATOM 93887 H2 WAT 6052 100.960 84.678 17.233 1.00 0.00 H TER 93889 WAT 6052 ATOM 93889 O WAT 6053 7.491 64.455 156.039 1.00 0.00 O ATOM 93890 H1 WAT 6053 6.700 64.993 156.018 1.00 0.00 H ATOM 93891 H2 WAT 6053 7.631 64.199 155.127 1.00 0.00 H TER 93893 WAT 6053 ATOM 93893 O WAT 6054 135.818 17.403 101.702 1.00 0.00 O ATOM 93894 H1 WAT 6054 135.129 17.522 102.356 1.00 0.00 H ATOM 93895 H2 WAT 6054 136.355 16.689 102.047 1.00 0.00 H TER 93897 WAT 6054 ATOM 93897 O WAT 6055 33.960 124.525 155.000 1.00 0.00 O ATOM 93898 H1 WAT 6055 34.806 124.260 155.361 1.00 0.00 H ATOM 93899 H2 WAT 6055 33.484 123.703 154.878 1.00 0.00 H TER 93901 WAT 6055 ATOM 93901 O WAT 6056 2.639 137.692 76.556 1.00 0.00 O ATOM 93902 H1 WAT 6056 3.272 138.101 75.966 1.00 0.00 H ATOM 93903 H2 WAT 6056 2.775 138.131 77.396 1.00 0.00 H TER 93905 WAT 6056 ATOM 93905 O WAT 6057 85.145 27.616 152.934 1.00 0.00 O ATOM 93906 H1 WAT 6057 84.966 26.696 152.740 1.00 0.00 H ATOM 93907 H2 WAT 6057 85.918 27.595 153.498 1.00 0.00 H TER 93909 WAT 6057 ATOM 93909 O WAT 6058 40.252 96.017 68.801 1.00 0.00 O ATOM 93910 H1 WAT 6058 39.383 95.624 68.885 1.00 0.00 H ATOM 93911 H2 WAT 6058 40.116 96.781 68.241 1.00 0.00 H TER 93913 WAT 6058 ATOM 93913 O WAT 6059 53.757 79.925 130.636 1.00 0.00 O ATOM 93914 H1 WAT 6059 53.684 79.870 131.588 1.00 0.00 H ATOM 93915 H2 WAT 6059 53.043 80.507 130.374 1.00 0.00 H TER 93917 WAT 6059 ATOM 93917 O WAT 6060 9.463 78.229 121.134 1.00 0.00 O ATOM 93918 H1 WAT 6060 10.414 78.187 121.231 1.00 0.00 H ATOM 93919 H2 WAT 6060 9.164 78.703 121.910 1.00 0.00 H TER 93921 WAT 6060 ATOM 93921 O WAT 6061 127.542 136.799 86.159 1.00 0.00 O ATOM 93922 H1 WAT 6061 127.752 135.923 85.836 1.00 0.00 H ATOM 93923 H2 WAT 6061 127.176 137.253 85.400 1.00 0.00 H TER 93925 WAT 6061 ATOM 93925 O WAT 6062 38.805 112.758 148.496 1.00 0.00 O ATOM 93926 H1 WAT 6062 38.846 113.698 148.319 1.00 0.00 H ATOM 93927 H2 WAT 6062 39.245 112.654 149.339 1.00 0.00 H TER 93929 WAT 6062 ATOM 93929 O WAT 6063 102.920 34.108 73.858 1.00 0.00 O ATOM 93930 H1 WAT 6063 102.000 34.068 74.118 1.00 0.00 H ATOM 93931 H2 WAT 6063 103.349 33.440 74.393 1.00 0.00 H TER 93933 WAT 6063 ATOM 93933 O WAT 6064 91.317 136.245 85.407 1.00 0.00 O ATOM 93934 H1 WAT 6064 90.951 136.543 86.240 1.00 0.00 H ATOM 93935 H2 WAT 6064 91.484 135.312 85.539 1.00 0.00 H TER 93937 WAT 6064 ATOM 93937 O WAT 6065 95.041 68.429 90.111 1.00 0.00 O ATOM 93938 H1 WAT 6065 94.354 68.407 90.777 1.00 0.00 H ATOM 93939 H2 WAT 6065 95.688 69.046 90.455 1.00 0.00 H TER 93941 WAT 6065 ATOM 93941 O WAT 6066 99.348 112.682 122.929 1.00 0.00 O ATOM 93942 H1 WAT 6066 100.135 112.345 122.502 1.00 0.00 H ATOM 93943 H2 WAT 6066 98.818 111.905 123.105 1.00 0.00 H TER 93945 WAT 6066 ATOM 93945 O WAT 6067 71.090 102.624 8.717 1.00 0.00 O ATOM 93946 H1 WAT 6067 71.110 102.017 7.977 1.00 0.00 H ATOM 93947 H2 WAT 6067 70.931 102.067 9.479 1.00 0.00 H TER 93949 WAT 6067 ATOM 93949 O WAT 6068 60.297 35.313 93.311 1.00 0.00 O ATOM 93950 H1 WAT 6068 60.147 36.163 92.897 1.00 0.00 H ATOM 93951 H2 WAT 6068 60.714 34.785 92.630 1.00 0.00 H TER 93953 WAT 6068 ATOM 93953 O WAT 6069 117.806 20.791 101.397 1.00 0.00 O ATOM 93954 H1 WAT 6069 118.454 21.413 101.726 1.00 0.00 H ATOM 93955 H2 WAT 6069 117.414 21.230 100.642 1.00 0.00 H TER 93957 WAT 6069 ATOM 93957 O WAT 6070 69.196 121.281 57.308 1.00 0.00 O ATOM 93958 H1 WAT 6070 69.483 120.771 58.065 1.00 0.00 H ATOM 93959 H2 WAT 6070 69.857 121.966 57.216 1.00 0.00 H TER 93961 WAT 6070 ATOM 93961 O WAT 6071 54.126 124.805 147.046 1.00 0.00 O ATOM 93962 H1 WAT 6071 53.562 125.005 146.298 1.00 0.00 H ATOM 93963 H2 WAT 6071 53.941 123.888 147.248 1.00 0.00 H TER 93965 WAT 6071 ATOM 93965 O WAT 6072 103.758 23.752 9.206 1.00 0.00 O ATOM 93966 H1 WAT 6072 103.114 23.904 9.898 1.00 0.00 H ATOM 93967 H2 WAT 6072 103.249 23.390 8.481 1.00 0.00 H TER 93969 WAT 6072 ATOM 93969 O WAT 6073 47.004 21.870 106.419 1.00 0.00 O ATOM 93970 H1 WAT 6073 47.154 21.026 105.993 1.00 0.00 H ATOM 93971 H2 WAT 6073 46.114 21.807 106.767 1.00 0.00 H TER 93973 WAT 6073 ATOM 93973 O WAT 6074 99.313 142.598 92.239 1.00 0.00 O ATOM 93974 H1 WAT 6074 98.981 143.385 92.670 1.00 0.00 H ATOM 93975 H2 WAT 6074 99.046 141.880 92.811 1.00 0.00 H TER 93977 WAT 6074 ATOM 93977 O WAT 6075 113.384 3.841 129.825 1.00 0.00 O ATOM 93978 H1 WAT 6075 114.166 3.298 129.924 1.00 0.00 H ATOM 93979 H2 WAT 6075 113.425 4.159 128.924 1.00 0.00 H TER 93981 WAT 6075 ATOM 93981 O WAT 6076 75.859 145.270 127.518 1.00 0.00 O ATOM 93982 H1 WAT 6076 75.988 144.797 128.340 1.00 0.00 H ATOM 93983 H2 WAT 6076 76.696 145.189 127.061 1.00 0.00 H TER 93985 WAT 6076 ATOM 93985 O WAT 6077 49.897 110.956 92.817 1.00 0.00 O ATOM 93986 H1 WAT 6077 49.987 110.046 93.102 1.00 0.00 H ATOM 93987 H2 WAT 6077 49.032 111.220 93.132 1.00 0.00 H TER 93989 WAT 6077 ATOM 93989 O WAT 6078 99.913 128.618 128.850 1.00 0.00 O ATOM 93990 H1 WAT 6078 100.051 129.550 129.021 1.00 0.00 H ATOM 93991 H2 WAT 6078 99.234 128.358 129.472 1.00 0.00 H TER 93993 WAT 6078 ATOM 93993 O WAT 6079 70.591 107.139 15.024 1.00 0.00 O ATOM 93994 H1 WAT 6079 71.352 106.949 14.476 1.00 0.00 H ATOM 93995 H2 WAT 6079 69.944 106.479 14.773 1.00 0.00 H TER 93997 WAT 6079 ATOM 93997 O WAT 6080 18.965 60.023 107.864 1.00 0.00 O ATOM 93998 H1 WAT 6080 19.254 59.604 108.675 1.00 0.00 H ATOM 93999 H2 WAT 6080 19.776 60.280 107.425 1.00 0.00 H TER 94001 WAT 6080 ATOM 94001 O WAT 6081 141.180 130.330 104.289 1.00 0.00 O ATOM 94002 H1 WAT 6081 140.521 130.009 103.674 1.00 0.00 H ATOM 94003 H2 WAT 6081 140.751 130.291 105.143 1.00 0.00 H TER 94005 WAT 6081 ATOM 94005 O WAT 6082 95.513 107.891 124.136 1.00 0.00 O ATOM 94006 H1 WAT 6082 94.751 108.334 123.763 1.00 0.00 H ATOM 94007 H2 WAT 6082 96.075 108.600 124.449 1.00 0.00 H TER 94009 WAT 6082 ATOM 94009 O WAT 6083 8.104 55.810 121.865 1.00 0.00 O ATOM 94010 H1 WAT 6083 8.376 55.797 122.782 1.00 0.00 H ATOM 94011 H2 WAT 6083 8.905 56.006 121.380 1.00 0.00 H TER 94013 WAT 6083 ATOM 94013 O WAT 6084 99.061 84.892 111.008 1.00 0.00 O ATOM 94014 H1 WAT 6084 99.343 84.578 110.149 1.00 0.00 H ATOM 94015 H2 WAT 6084 98.238 84.432 111.174 1.00 0.00 H TER 94017 WAT 6084 ATOM 94017 O WAT 6085 65.744 3.250 149.844 1.00 0.00 O ATOM 94018 H1 WAT 6085 65.525 2.405 149.450 1.00 0.00 H ATOM 94019 H2 WAT 6085 65.773 3.074 150.785 1.00 0.00 H TER 94021 WAT 6085 ATOM 94021 O WAT 6086 69.372 9.650 154.556 1.00 0.00 O ATOM 94022 H1 WAT 6086 68.844 8.919 154.235 1.00 0.00 H ATOM 94023 H2 WAT 6086 69.484 10.218 153.794 1.00 0.00 H TER 94025 WAT 6086 ATOM 94025 O WAT 6087 88.939 114.691 80.713 1.00 0.00 O ATOM 94026 H1 WAT 6087 88.376 113.933 80.557 1.00 0.00 H ATOM 94027 H2 WAT 6087 89.422 114.804 79.894 1.00 0.00 H TER 94029 WAT 6087 ATOM 94029 O WAT 6088 15.726 112.521 140.361 1.00 0.00 O ATOM 94030 H1 WAT 6088 16.336 111.825 140.605 1.00 0.00 H ATOM 94031 H2 WAT 6088 14.995 112.423 140.971 1.00 0.00 H TER 94033 WAT 6088 ATOM 94033 O WAT 6089 58.820 3.856 118.975 1.00 0.00 O ATOM 94034 H1 WAT 6089 59.253 3.563 118.173 1.00 0.00 H ATOM 94035 H2 WAT 6089 57.894 3.663 118.831 1.00 0.00 H TER 94037 WAT 6089 ATOM 94037 O WAT 6090 26.088 2.627 1.719 1.00 0.00 O ATOM 94038 H1 WAT 6090 25.734 3.230 2.373 1.00 0.00 H ATOM 94039 H2 WAT 6090 27.031 2.620 1.885 1.00 0.00 H TER 94041 WAT 6090 ATOM 94041 O WAT 6091 9.871 120.716 72.774 1.00 0.00 O ATOM 94042 H1 WAT 6091 10.007 119.772 72.700 1.00 0.00 H ATOM 94043 H2 WAT 6091 10.674 121.102 72.423 1.00 0.00 H TER 94045 WAT 6091 ATOM 94045 O WAT 6092 128.385 89.995 29.112 1.00 0.00 O ATOM 94046 H1 WAT 6092 129.087 89.426 28.798 1.00 0.00 H ATOM 94047 H2 WAT 6092 128.146 89.633 29.965 1.00 0.00 H TER 94049 WAT 6092 ATOM 94049 O WAT 6093 68.690 77.527 102.016 1.00 0.00 O ATOM 94050 H1 WAT 6093 69.135 76.706 101.804 1.00 0.00 H ATOM 94051 H2 WAT 6093 69.285 77.973 102.618 1.00 0.00 H TER 94053 WAT 6093 ATOM 94053 O WAT 6094 135.808 138.006 91.258 1.00 0.00 O ATOM 94054 H1 WAT 6094 134.897 137.863 91.000 1.00 0.00 H ATOM 94055 H2 WAT 6094 136.305 137.910 90.446 1.00 0.00 H TER 94057 WAT 6094 ATOM 94057 O WAT 6095 92.728 33.411 114.175 1.00 0.00 O ATOM 94058 H1 WAT 6095 92.038 33.888 114.635 1.00 0.00 H ATOM 94059 H2 WAT 6095 93.045 32.772 114.813 1.00 0.00 H TER 94061 WAT 6095 ATOM 94061 O WAT 6096 43.515 118.222 120.057 1.00 0.00 O ATOM 94062 H1 WAT 6096 43.004 117.643 119.491 1.00 0.00 H ATOM 94063 H2 WAT 6096 43.553 117.765 120.897 1.00 0.00 H TER 94065 WAT 6096 ATOM 94065 O WAT 6097 9.410 121.012 112.444 1.00 0.00 O ATOM 94066 H1 WAT 6097 10.099 121.621 112.711 1.00 0.00 H ATOM 94067 H2 WAT 6097 8.596 121.497 112.579 1.00 0.00 H TER 94069 WAT 6097 ATOM 94069 O WAT 6098 2.488 36.982 68.172 1.00 0.00 O ATOM 94070 H1 WAT 6098 2.224 36.125 67.837 1.00 0.00 H ATOM 94071 H2 WAT 6098 3.328 36.823 68.603 1.00 0.00 H TER 94073 WAT 6098 ATOM 94073 O WAT 6099 145.128 37.299 90.452 1.00 0.00 O ATOM 94074 H1 WAT 6099 144.328 36.910 90.804 1.00 0.00 H ATOM 94075 H2 WAT 6099 145.832 36.743 90.787 1.00 0.00 H TER 94077 WAT 6099 ATOM 94077 O WAT 6100 94.763 86.594 144.618 1.00 0.00 O ATOM 94078 H1 WAT 6100 94.308 85.757 144.709 1.00 0.00 H ATOM 94079 H2 WAT 6100 95.681 86.355 144.491 1.00 0.00 H TER 94081 WAT 6100 ATOM 94081 O WAT 6101 64.423 25.554 118.358 1.00 0.00 O ATOM 94082 H1 WAT 6101 64.243 26.389 117.926 1.00 0.00 H ATOM 94083 H2 WAT 6101 64.327 24.901 117.665 1.00 0.00 H TER 94085 WAT 6101 ATOM 94085 O WAT 6102 116.866 15.558 141.604 1.00 0.00 O ATOM 94086 H1 WAT 6102 117.823 15.556 141.628 1.00 0.00 H ATOM 94087 H2 WAT 6102 116.648 15.277 140.716 1.00 0.00 H TER 94089 WAT 6102 ATOM 94089 O WAT 6103 23.649 119.322 8.385 1.00 0.00 O ATOM 94090 H1 WAT 6103 22.871 119.576 8.881 1.00 0.00 H ATOM 94091 H2 WAT 6103 23.359 118.586 7.846 1.00 0.00 H TER 94093 WAT 6103 ATOM 94093 O WAT 6104 41.453 23.574 142.060 1.00 0.00 O ATOM 94094 H1 WAT 6104 41.689 22.671 142.272 1.00 0.00 H ATOM 94095 H2 WAT 6104 42.170 23.886 141.507 1.00 0.00 H TER 94097 WAT 6104 ATOM 94097 O WAT 6105 45.776 135.900 94.342 1.00 0.00 O ATOM 94098 H1 WAT 6105 46.417 135.512 93.746 1.00 0.00 H ATOM 94099 H2 WAT 6105 44.994 136.025 93.804 1.00 0.00 H TER 94101 WAT 6105 ATOM 94101 O WAT 6106 105.384 125.651 84.386 1.00 0.00 O ATOM 94102 H1 WAT 6106 104.596 126.194 84.385 1.00 0.00 H ATOM 94103 H2 WAT 6106 105.821 125.862 83.561 1.00 0.00 H TER 94105 WAT 6106 ATOM 94105 O WAT 6107 9.236 48.393 6.667 1.00 0.00 O ATOM 94106 H1 WAT 6107 10.173 48.234 6.783 1.00 0.00 H ATOM 94107 H2 WAT 6107 8.882 48.398 7.556 1.00 0.00 H TER 94109 WAT 6107 ATOM 94109 O WAT 6108 93.776 26.318 59.777 1.00 0.00 O ATOM 94110 H1 WAT 6108 94.149 27.098 59.366 1.00 0.00 H ATOM 94111 H2 WAT 6108 92.837 26.498 59.823 1.00 0.00 H TER 94113 WAT 6108 ATOM 94113 O WAT 6109 17.396 124.973 104.409 1.00 0.00 O ATOM 94114 H1 WAT 6109 16.927 125.522 105.036 1.00 0.00 H ATOM 94115 H2 WAT 6109 18.241 125.409 104.294 1.00 0.00 H TER 94117 WAT 6109 ATOM 94117 O WAT 6110 22.380 52.625 150.966 1.00 0.00 O ATOM 94118 H1 WAT 6110 22.617 53.194 151.698 1.00 0.00 H ATOM 94119 H2 WAT 6110 23.192 52.167 150.746 1.00 0.00 H TER 94121 WAT 6110 ATOM 94121 O WAT 6111 31.454 58.910 60.756 1.00 0.00 O ATOM 94122 H1 WAT 6111 31.001 59.753 60.725 1.00 0.00 H ATOM 94123 H2 WAT 6111 31.920 58.858 59.922 1.00 0.00 H TER 94125 WAT 6111 ATOM 94125 O WAT 6112 21.991 84.530 115.773 1.00 0.00 O ATOM 94126 H1 WAT 6112 22.015 84.932 114.905 1.00 0.00 H ATOM 94127 H2 WAT 6112 21.062 84.509 116.003 1.00 0.00 H TER 94129 WAT 6112 ATOM 94129 O WAT 6113 67.481 69.615 95.618 1.00 0.00 O ATOM 94130 H1 WAT 6113 67.741 69.786 94.713 1.00 0.00 H ATOM 94131 H2 WAT 6113 67.607 68.672 95.730 1.00 0.00 H TER 94133 WAT 6113 ATOM 94133 O WAT 6114 50.461 143.246 18.198 1.00 0.00 O ATOM 94134 H1 WAT 6114 50.115 142.505 17.700 1.00 0.00 H ATOM 94135 H2 WAT 6114 51.128 142.863 18.766 1.00 0.00 H TER 94137 WAT 6114 ATOM 94137 O WAT 6115 60.781 54.699 156.744 1.00 0.00 O ATOM 94138 H1 WAT 6115 60.329 54.031 157.260 1.00 0.00 H ATOM 94139 H2 WAT 6115 61.686 54.668 157.054 1.00 0.00 H TER 94141 WAT 6115 ATOM 94141 O WAT 6116 24.363 115.100 80.488 1.00 0.00 O ATOM 94142 H1 WAT 6116 24.932 114.339 80.376 1.00 0.00 H ATOM 94143 H2 WAT 6116 23.638 114.781 81.026 1.00 0.00 H TER 94145 WAT 6116 ATOM 94145 O WAT 6117 24.114 13.866 71.145 1.00 0.00 O ATOM 94146 H1 WAT 6117 24.735 13.681 71.850 1.00 0.00 H ATOM 94147 H2 WAT 6117 23.266 13.930 71.584 1.00 0.00 H TER 94149 WAT 6117 ATOM 94149 O WAT 6118 31.407 113.293 87.130 1.00 0.00 O ATOM 94150 H1 WAT 6118 32.221 112.991 87.533 1.00 0.00 H ATOM 94151 H2 WAT 6118 31.298 112.732 86.361 1.00 0.00 H TER 94153 WAT 6118 ATOM 94153 O WAT 6119 2.455 76.476 96.630 1.00 0.00 O ATOM 94154 H1 WAT 6119 1.958 77.239 96.925 1.00 0.00 H ATOM 94155 H2 WAT 6119 2.360 75.840 97.339 1.00 0.00 H TER 94157 WAT 6119 ATOM 94157 O WAT 6120 2.943 132.500 16.016 1.00 0.00 O ATOM 94158 H1 WAT 6120 3.129 132.008 15.216 1.00 0.00 H ATOM 94159 H2 WAT 6120 3.805 132.682 16.390 1.00 0.00 H TER 94161 WAT 6120 ATOM 94161 O WAT 6121 83.271 95.752 91.709 1.00 0.00 O ATOM 94162 H1 WAT 6121 83.852 96.432 91.367 1.00 0.00 H ATOM 94163 H2 WAT 6121 83.036 96.056 92.585 1.00 0.00 H TER 94165 WAT 6121 ATOM 94165 O WAT 6122 80.320 54.398 155.718 1.00 0.00 O ATOM 94166 H1 WAT 6122 79.690 53.841 156.174 1.00 0.00 H ATOM 94167 H2 WAT 6122 81.134 53.895 155.726 1.00 0.00 H TER 94169 WAT 6122 ATOM 94169 O WAT 6123 97.321 44.247 73.384 1.00 0.00 O ATOM 94170 H1 WAT 6123 96.665 44.028 72.722 1.00 0.00 H ATOM 94171 H2 WAT 6123 96.993 45.050 73.788 1.00 0.00 H TER 94173 WAT 6123 ATOM 94173 O WAT 6124 6.880 109.982 119.160 1.00 0.00 O ATOM 94174 H1 WAT 6124 7.388 109.734 118.388 1.00 0.00 H ATOM 94175 H2 WAT 6124 7.503 110.449 119.717 1.00 0.00 H TER 94177 WAT 6124 ATOM 94177 O WAT 6125 67.561 144.192 4.213 1.00 0.00 O ATOM 94178 H1 WAT 6125 66.666 144.451 3.993 1.00 0.00 H ATOM 94179 H2 WAT 6125 67.903 144.925 4.725 1.00 0.00 H TER 94181 WAT 6125 ATOM 94181 O WAT 6126 20.236 106.758 2.845 1.00 0.00 O ATOM 94182 H1 WAT 6126 19.571 107.354 3.191 1.00 0.00 H ATOM 94183 H2 WAT 6126 20.923 107.335 2.509 1.00 0.00 H TER 94185 WAT 6126 ATOM 94185 O WAT 6127 21.707 79.298 5.946 1.00 0.00 O ATOM 94186 H1 WAT 6127 21.057 79.443 6.633 1.00 0.00 H ATOM 94187 H2 WAT 6127 22.136 78.478 6.191 1.00 0.00 H TER 94189 WAT 6127 ATOM 94189 O WAT 6128 132.573 100.455 14.004 1.00 0.00 O ATOM 94190 H1 WAT 6128 131.990 99.801 13.619 1.00 0.00 H ATOM 94191 H2 WAT 6128 132.222 101.294 13.706 1.00 0.00 H TER 94193 WAT 6128 ATOM 94193 O WAT 6129 36.384 92.813 23.038 1.00 0.00 O ATOM 94194 H1 WAT 6129 35.878 92.160 23.522 1.00 0.00 H ATOM 94195 H2 WAT 6129 37.140 92.992 23.598 1.00 0.00 H TER 94197 WAT 6129 ATOM 94197 O WAT 6130 116.296 19.714 126.696 1.00 0.00 O ATOM 94198 H1 WAT 6130 115.792 20.301 126.131 1.00 0.00 H ATOM 94199 H2 WAT 6130 116.226 18.858 126.275 1.00 0.00 H TER 94201 WAT 6130 ATOM 94201 O WAT 6131 72.646 106.559 118.632 1.00 0.00 O ATOM 94202 H1 WAT 6131 72.375 106.666 117.720 1.00 0.00 H ATOM 94203 H2 WAT 6131 72.841 107.447 118.930 1.00 0.00 H TER 94205 WAT 6131 ATOM 94205 O WAT 6132 13.409 101.219 12.549 1.00 0.00 O ATOM 94206 H1 WAT 6132 12.716 101.244 11.889 1.00 0.00 H ATOM 94207 H2 WAT 6132 12.942 101.184 13.384 1.00 0.00 H TER 94209 WAT 6132 ATOM 94209 O WAT 6133 142.943 104.691 74.092 1.00 0.00 O ATOM 94210 H1 WAT 6133 143.478 105.386 74.476 1.00 0.00 H ATOM 94211 H2 WAT 6133 142.853 104.940 73.172 1.00 0.00 H TER 94213 WAT 6133 ATOM 94213 O WAT 6134 128.987 135.550 143.690 1.00 0.00 O ATOM 94214 H1 WAT 6134 128.783 136.308 143.144 1.00 0.00 H ATOM 94215 H2 WAT 6134 129.535 135.900 144.392 1.00 0.00 H TER 94217 WAT 6134 ATOM 94217 O WAT 6135 114.480 58.060 101.164 1.00 0.00 O ATOM 94218 H1 WAT 6135 113.890 58.808 101.250 1.00 0.00 H ATOM 94219 H2 WAT 6135 114.059 57.496 100.515 1.00 0.00 H TER 94221 WAT 6135 ATOM 94221 O WAT 6136 48.078 136.754 156.065 1.00 0.00 O ATOM 94222 H1 WAT 6136 47.711 136.018 156.556 1.00 0.00 H ATOM 94223 H2 WAT 6136 47.552 136.794 155.267 1.00 0.00 H TER 94225 WAT 6136 ATOM 94225 O WAT 6137 49.501 54.887 82.957 1.00 0.00 O ATOM 94226 H1 WAT 6137 49.935 54.195 83.457 1.00 0.00 H ATOM 94227 H2 WAT 6137 49.095 55.444 83.622 1.00 0.00 H TER 94229 WAT 6137 ATOM 94229 O WAT 6138 122.566 89.361 108.993 1.00 0.00 O ATOM 94230 H1 WAT 6138 121.755 88.894 109.193 1.00 0.00 H ATOM 94231 H2 WAT 6138 123.216 88.973 109.579 1.00 0.00 H TER 94233 WAT 6138 ATOM 94233 O WAT 6139 28.039 116.887 115.745 1.00 0.00 O ATOM 94234 H1 WAT 6139 27.159 117.057 115.407 1.00 0.00 H ATOM 94235 H2 WAT 6139 28.143 117.510 116.465 1.00 0.00 H TER 94237 WAT 6139 ATOM 94237 O WAT 6140 113.343 56.257 7.689 1.00 0.00 O ATOM 94238 H1 WAT 6140 114.031 55.724 7.290 1.00 0.00 H ATOM 94239 H2 WAT 6140 112.526 55.861 7.384 1.00 0.00 H TER 94241 WAT 6140 ATOM 94241 O WAT 6141 141.020 122.537 109.511 1.00 0.00 O ATOM 94242 H1 WAT 6141 141.574 122.529 108.731 1.00 0.00 H ATOM 94243 H2 WAT 6141 141.637 122.559 110.243 1.00 0.00 H TER 94245 WAT 6141 ATOM 94245 O WAT 6142 126.538 109.462 85.432 1.00 0.00 O ATOM 94246 H1 WAT 6142 126.727 110.397 85.507 1.00 0.00 H ATOM 94247 H2 WAT 6142 126.556 109.140 86.333 1.00 0.00 H TER 94249 WAT 6142 ATOM 94249 O WAT 6143 129.415 119.626 106.349 1.00 0.00 O ATOM 94250 H1 WAT 6143 128.960 118.785 106.293 1.00 0.00 H ATOM 94251 H2 WAT 6143 128.753 120.273 106.102 1.00 0.00 H TER 94253 WAT 6143 ATOM 94253 O WAT 6144 107.273 5.385 84.778 1.00 0.00 O ATOM 94254 H1 WAT 6144 106.840 6.237 84.732 1.00 0.00 H ATOM 94255 H2 WAT 6144 106.606 4.796 85.131 1.00 0.00 H TER 94257 WAT 6144 ATOM 94257 O WAT 6145 132.618 63.123 97.578 1.00 0.00 O ATOM 94258 H1 WAT 6145 133.002 62.655 98.319 1.00 0.00 H ATOM 94259 H2 WAT 6145 132.401 62.435 96.948 1.00 0.00 H TER 94261 WAT 6145 ATOM 94261 O WAT 6146 60.299 72.324 105.059 1.00 0.00 O ATOM 94262 H1 WAT 6146 60.625 72.924 104.388 1.00 0.00 H ATOM 94263 H2 WAT 6146 59.406 72.119 104.784 1.00 0.00 H TER 94265 WAT 6146 ATOM 94265 O WAT 6147 61.243 35.204 77.196 1.00 0.00 O ATOM 94266 H1 WAT 6147 61.244 35.475 76.279 1.00 0.00 H ATOM 94267 H2 WAT 6147 62.102 35.467 77.525 1.00 0.00 H TER 94269 WAT 6147 ATOM 94269 O WAT 6148 121.829 110.646 107.978 1.00 0.00 O ATOM 94270 H1 WAT 6148 121.813 110.705 108.934 1.00 0.00 H ATOM 94271 H2 WAT 6148 121.132 110.026 107.765 1.00 0.00 H TER 94273 WAT 6148 ATOM 94273 O WAT 6149 44.632 135.420 132.670 1.00 0.00 O ATOM 94274 H1 WAT 6149 44.563 136.265 132.226 1.00 0.00 H ATOM 94275 H2 WAT 6149 44.046 135.496 133.423 1.00 0.00 H TER 94277 WAT 6149 ATOM 94277 O WAT 6150 28.316 110.771 138.433 1.00 0.00 O ATOM 94278 H1 WAT 6150 27.888 109.966 138.727 1.00 0.00 H ATOM 94279 H2 WAT 6150 27.595 111.339 138.161 1.00 0.00 H TER 94281 WAT 6150 ATOM 94281 O WAT 6151 131.770 92.377 118.267 1.00 0.00 O ATOM 94282 H1 WAT 6151 131.246 91.648 118.599 1.00 0.00 H ATOM 94283 H2 WAT 6151 131.636 93.078 118.905 1.00 0.00 H TER 94285 WAT 6151 ATOM 94285 O WAT 6152 85.859 141.877 5.352 1.00 0.00 O ATOM 94286 H1 WAT 6152 85.383 141.050 5.276 1.00 0.00 H ATOM 94287 H2 WAT 6152 86.674 141.728 4.874 1.00 0.00 H TER 94289 WAT 6152 ATOM 94289 O WAT 6153 60.735 138.888 153.625 1.00 0.00 O ATOM 94290 H1 WAT 6153 60.562 138.486 152.774 1.00 0.00 H ATOM 94291 H2 WAT 6153 60.740 138.155 154.240 1.00 0.00 H TER 94293 WAT 6153 ATOM 94293 O WAT 6154 87.329 82.527 91.677 1.00 0.00 O ATOM 94294 H1 WAT 6154 87.547 81.644 91.975 1.00 0.00 H ATOM 94295 H2 WAT 6154 88.146 83.019 91.766 1.00 0.00 H TER 94297 WAT 6154 ATOM 94297 O WAT 6155 120.743 116.867 116.824 1.00 0.00 O ATOM 94298 H1 WAT 6155 121.386 117.563 116.685 1.00 0.00 H ATOM 94299 H2 WAT 6155 121.217 116.197 117.317 1.00 0.00 H TER 94301 WAT 6155 ATOM 94301 O WAT 6156 90.162 137.744 111.504 1.00 0.00 O ATOM 94302 H1 WAT 6156 90.027 138.335 112.245 1.00 0.00 H ATOM 94303 H2 WAT 6156 89.318 137.307 111.389 1.00 0.00 H TER 94305 WAT 6156 ATOM 94305 O WAT 6157 49.597 35.347 106.591 1.00 0.00 O ATOM 94306 H1 WAT 6157 49.759 36.248 106.312 1.00 0.00 H ATOM 94307 H2 WAT 6157 50.057 35.269 107.427 1.00 0.00 H TER 94309 WAT 6157 ATOM 94309 O WAT 6158 49.969 2.791 65.897 1.00 0.00 O ATOM 94310 H1 WAT 6158 50.253 2.007 65.427 1.00 0.00 H ATOM 94311 H2 WAT 6158 50.152 3.511 65.293 1.00 0.00 H TER 94313 WAT 6158 ATOM 94313 O WAT 6159 47.244 20.645 140.154 1.00 0.00 O ATOM 94314 H1 WAT 6159 48.021 21.088 139.812 1.00 0.00 H ATOM 94315 H2 WAT 6159 47.345 19.736 139.873 1.00 0.00 H TER 94317 WAT 6159 ATOM 94317 O WAT 6160 48.621 118.311 101.716 1.00 0.00 O ATOM 94318 H1 WAT 6160 48.422 118.487 102.635 1.00 0.00 H ATOM 94319 H2 WAT 6160 49.127 117.499 101.731 1.00 0.00 H TER 94321 WAT 6160 ATOM 94321 O WAT 6161 23.369 77.524 113.204 1.00 0.00 O ATOM 94322 H1 WAT 6161 23.360 76.770 113.793 1.00 0.00 H ATOM 94323 H2 WAT 6161 23.739 78.234 113.729 1.00 0.00 H TER 94325 WAT 6161 ATOM 94325 O WAT 6162 123.314 122.210 136.834 1.00 0.00 O ATOM 94326 H1 WAT 6162 122.484 121.849 136.522 1.00 0.00 H ATOM 94327 H2 WAT 6162 123.529 121.685 137.604 1.00 0.00 H TER 94329 WAT 6162 ATOM 94329 O WAT 6163 62.821 78.158 156.746 1.00 0.00 O ATOM 94330 H1 WAT 6163 63.443 78.518 156.114 1.00 0.00 H ATOM 94331 H2 WAT 6163 62.084 77.857 156.214 1.00 0.00 H TER 94333 WAT 6163 ATOM 94333 O WAT 6164 145.229 117.071 12.350 1.00 0.00 O ATOM 94334 H1 WAT 6164 145.645 116.663 11.590 1.00 0.00 H ATOM 94335 H2 WAT 6164 144.869 116.337 12.848 1.00 0.00 H TER 94337 WAT 6164 ATOM 94337 O WAT 6165 40.477 14.971 81.848 1.00 0.00 O ATOM 94338 H1 WAT 6165 40.846 14.166 82.211 1.00 0.00 H ATOM 94339 H2 WAT 6165 39.535 14.890 81.994 1.00 0.00 H TER 94341 WAT 6165 ATOM 94341 O WAT 6166 25.684 11.429 102.539 1.00 0.00 O ATOM 94342 H1 WAT 6166 25.146 12.158 102.231 1.00 0.00 H ATOM 94343 H2 WAT 6166 25.704 11.531 103.491 1.00 0.00 H TER 94345 WAT 6166 ATOM 94345 O WAT 6167 61.336 74.180 12.293 1.00 0.00 O ATOM 94346 H1 WAT 6167 60.523 73.863 12.687 1.00 0.00 H ATOM 94347 H2 WAT 6167 61.395 75.095 12.568 1.00 0.00 H TER 94349 WAT 6167 ATOM 94349 O WAT 6168 126.093 57.377 58.763 1.00 0.00 O ATOM 94350 H1 WAT 6168 125.393 57.379 59.417 1.00 0.00 H ATOM 94351 H2 WAT 6168 126.531 56.535 58.884 1.00 0.00 H TER 94353 WAT 6168 ATOM 94353 O WAT 6169 133.396 91.543 125.688 1.00 0.00 O ATOM 94354 H1 WAT 6169 133.459 90.663 125.318 1.00 0.00 H ATOM 94355 H2 WAT 6169 133.520 91.418 126.628 1.00 0.00 H TER 94357 WAT 6169 ATOM 94357 O WAT 6170 47.769 56.521 141.847 1.00 0.00 O ATOM 94358 H1 WAT 6170 48.666 56.806 142.021 1.00 0.00 H ATOM 94359 H2 WAT 6170 47.681 55.698 142.327 1.00 0.00 H TER 94361 WAT 6170 ATOM 94361 O WAT 6171 22.184 70.941 135.162 1.00 0.00 O ATOM 94362 H1 WAT 6171 21.875 71.692 134.656 1.00 0.00 H ATOM 94363 H2 WAT 6171 21.419 70.661 135.665 1.00 0.00 H TER 94365 WAT 6171 ATOM 94365 O WAT 6172 38.257 134.278 99.692 1.00 0.00 O ATOM 94366 H1 WAT 6172 38.092 135.003 100.295 1.00 0.00 H ATOM 94367 H2 WAT 6172 39.206 134.157 99.719 1.00 0.00 H TER 94369 WAT 6172 ATOM 94369 O WAT 6173 8.083 52.960 1.950 1.00 0.00 O ATOM 94370 H1 WAT 6173 7.526 53.254 2.672 1.00 0.00 H ATOM 94371 H2 WAT 6173 8.938 52.812 2.353 1.00 0.00 H TER 94373 WAT 6173 ATOM 94373 O WAT 6174 89.643 91.644 124.004 1.00 0.00 O ATOM 94374 H1 WAT 6174 88.888 91.348 123.495 1.00 0.00 H ATOM 94375 H2 WAT 6174 89.646 91.080 124.777 1.00 0.00 H TER 94377 WAT 6174 ATOM 94377 O WAT 6175 81.450 113.523 92.719 1.00 0.00 O ATOM 94378 H1 WAT 6175 81.043 112.663 92.826 1.00 0.00 H ATOM 94379 H2 WAT 6175 82.123 113.388 92.051 1.00 0.00 H TER 94381 WAT 6175 ATOM 94381 O WAT 6176 91.247 97.534 122.515 1.00 0.00 O ATOM 94382 H1 WAT 6176 90.683 97.366 121.761 1.00 0.00 H ATOM 94383 H2 WAT 6176 91.843 98.222 122.220 1.00 0.00 H TER 94385 WAT 6176 ATOM 94385 O WAT 6177 62.748 122.779 16.308 1.00 0.00 O ATOM 94386 H1 WAT 6177 63.187 121.936 16.420 1.00 0.00 H ATOM 94387 H2 WAT 6177 62.227 122.886 17.105 1.00 0.00 H TER 94389 WAT 6177 ATOM 94389 O WAT 6178 16.692 5.845 13.075 1.00 0.00 O ATOM 94390 H1 WAT 6178 16.731 5.266 12.313 1.00 0.00 H ATOM 94391 H2 WAT 6178 17.259 6.581 12.844 1.00 0.00 H TER 94393 WAT 6178 ATOM 94393 O WAT 6179 114.883 9.188 131.154 1.00 0.00 O ATOM 94394 H1 WAT 6179 114.224 8.562 130.853 1.00 0.00 H ATOM 94395 H2 WAT 6179 114.387 9.985 131.342 1.00 0.00 H TER 94397 WAT 6179 ATOM 94397 O WAT 6180 95.559 136.142 62.809 1.00 0.00 O ATOM 94398 H1 WAT 6180 95.292 135.674 62.018 1.00 0.00 H ATOM 94399 H2 WAT 6180 96.093 136.869 62.489 1.00 0.00 H TER 94401 WAT 6180 ATOM 94401 O WAT 6181 6.930 79.592 102.601 1.00 0.00 O ATOM 94402 H1 WAT 6181 7.561 79.289 103.254 1.00 0.00 H ATOM 94403 H2 WAT 6181 7.075 79.022 101.846 1.00 0.00 H TER 94405 WAT 6181 ATOM 94405 O WAT 6182 113.315 86.753 11.004 1.00 0.00 O ATOM 94406 H1 WAT 6182 114.072 87.186 10.609 1.00 0.00 H ATOM 94407 H2 WAT 6182 113.412 86.910 11.943 1.00 0.00 H TER 94409 WAT 6182 ATOM 94409 O WAT 6183 112.697 37.455 104.043 1.00 0.00 O ATOM 94410 H1 WAT 6183 113.530 37.102 104.354 1.00 0.00 H ATOM 94411 H2 WAT 6183 112.900 38.352 103.778 1.00 0.00 H TER 94413 WAT 6183 ATOM 94413 O WAT 6184 25.693 110.468 88.040 1.00 0.00 O ATOM 94414 H1 WAT 6184 25.480 111.217 88.597 1.00 0.00 H ATOM 94415 H2 WAT 6184 25.384 109.708 88.534 1.00 0.00 H TER 94417 WAT 6184 ATOM 94417 O WAT 6185 17.375 36.517 149.425 1.00 0.00 O ATOM 94418 H1 WAT 6185 18.072 37.162 149.548 1.00 0.00 H ATOM 94419 H2 WAT 6185 16.992 36.410 150.295 1.00 0.00 H TER 94421 WAT 6185 ATOM 94421 O WAT 6186 69.755 56.431 13.486 1.00 0.00 O ATOM 94422 H1 WAT 6186 68.902 56.771 13.217 1.00 0.00 H ATOM 94423 H2 WAT 6186 69.556 55.821 14.197 1.00 0.00 H TER 94425 WAT 6186 ATOM 94425 O WAT 6187 127.518 131.216 87.277 1.00 0.00 O ATOM 94426 H1 WAT 6187 128.372 130.879 87.007 1.00 0.00 H ATOM 94427 H2 WAT 6187 127.330 130.761 88.098 1.00 0.00 H TER 94429 WAT 6187 ATOM 94429 O WAT 6188 18.302 11.919 11.995 1.00 0.00 O ATOM 94430 H1 WAT 6188 18.764 12.088 12.816 1.00 0.00 H ATOM 94431 H2 WAT 6188 17.997 12.780 11.711 1.00 0.00 H TER 94433 WAT 6188 ATOM 94433 O WAT 6189 15.466 69.665 12.560 1.00 0.00 O ATOM 94434 H1 WAT 6189 15.184 68.752 12.521 1.00 0.00 H ATOM 94435 H2 WAT 6189 16.195 69.665 13.180 1.00 0.00 H TER 94437 WAT 6189 ATOM 94437 O WAT 6190 43.189 41.993 84.687 1.00 0.00 O ATOM 94438 H1 WAT 6190 43.741 42.754 84.864 1.00 0.00 H ATOM 94439 H2 WAT 6190 43.149 41.527 85.522 1.00 0.00 H TER 94441 WAT 6190 ATOM 94441 O WAT 6191 40.541 20.423 3.993 1.00 0.00 O ATOM 94442 H1 WAT 6191 41.055 21.177 4.282 1.00 0.00 H ATOM 94443 H2 WAT 6191 41.189 19.804 3.659 1.00 0.00 H TER 94445 WAT 6191 ATOM 94445 O WAT 6192 71.251 23.586 85.220 1.00 0.00 O ATOM 94446 H1 WAT 6192 71.312 24.496 84.928 1.00 0.00 H ATOM 94447 H2 WAT 6192 72.135 23.237 85.100 1.00 0.00 H TER 94449 WAT 6192 ATOM 94449 O WAT 6193 2.999 44.754 7.950 1.00 0.00 O ATOM 94450 H1 WAT 6193 3.317 43.871 8.139 1.00 0.00 H ATOM 94451 H2 WAT 6193 2.803 44.742 7.013 1.00 0.00 H TER 94453 WAT 6193 ATOM 94453 O WAT 6194 120.316 51.725 83.181 1.00 0.00 O ATOM 94454 H1 WAT 6194 120.436 50.867 82.772 1.00 0.00 H ATOM 94455 H2 WAT 6194 121.048 52.249 82.855 1.00 0.00 H TER 94457 WAT 6194 ATOM 94457 O WAT 6195 28.174 136.640 3.337 1.00 0.00 O ATOM 94458 H1 WAT 6195 27.406 137.185 3.166 1.00 0.00 H ATOM 94459 H2 WAT 6195 28.883 137.265 3.488 1.00 0.00 H TER 94461 WAT 6195 ATOM 94461 O WAT 6196 107.269 126.705 20.582 1.00 0.00 O ATOM 94462 H1 WAT 6196 107.859 127.019 19.897 1.00 0.00 H ATOM 94463 H2 WAT 6196 106.627 126.168 20.117 1.00 0.00 H TER 94465 WAT 6196 ATOM 94465 O WAT 6197 91.011 54.045 65.109 1.00 0.00 O ATOM 94466 H1 WAT 6197 90.591 53.203 64.932 1.00 0.00 H ATOM 94467 H2 WAT 6197 90.295 54.617 65.384 1.00 0.00 H TER 94469 WAT 6197 ATOM 94469 O WAT 6198 4.874 73.902 96.154 1.00 0.00 O ATOM 94470 H1 WAT 6198 4.732 74.845 96.072 1.00 0.00 H ATOM 94471 H2 WAT 6198 4.139 73.508 95.684 1.00 0.00 H TER 94473 WAT 6198 ATOM 94473 O WAT 6199 92.068 72.187 133.200 1.00 0.00 O ATOM 94474 H1 WAT 6199 92.575 72.044 133.999 1.00 0.00 H ATOM 94475 H2 WAT 6199 92.665 71.947 132.491 1.00 0.00 H TER 94477 WAT 6199 ATOM 94477 O WAT 6200 22.797 121.628 142.654 1.00 0.00 O ATOM 94478 H1 WAT 6200 22.784 120.679 142.783 1.00 0.00 H ATOM 94479 H2 WAT 6200 23.378 121.759 141.905 1.00 0.00 H TER 94481 WAT 6200 ATOM 94481 O WAT 6201 62.349 94.778 136.231 1.00 0.00 O ATOM 94482 H1 WAT 6201 62.875 94.914 135.442 1.00 0.00 H ATOM 94483 H2 WAT 6201 62.993 94.654 136.928 1.00 0.00 H TER 94485 WAT 6201 ATOM 94485 O WAT 6202 89.520 140.373 94.258 1.00 0.00 O ATOM 94486 H1 WAT 6202 88.673 140.496 94.688 1.00 0.00 H ATOM 94487 H2 WAT 6202 90.088 140.025 94.945 1.00 0.00 H TER 94489 WAT 6202 ATOM 94489 O WAT 6203 28.506 12.083 101.079 1.00 0.00 O ATOM 94490 H1 WAT 6203 28.102 11.217 101.127 1.00 0.00 H ATOM 94491 H2 WAT 6203 29.445 11.905 101.018 1.00 0.00 H TER 94493 WAT 6203 ATOM 94493 O WAT 6204 85.038 8.947 85.897 1.00 0.00 O ATOM 94494 H1 WAT 6204 85.986 8.820 85.851 1.00 0.00 H ATOM 94495 H2 WAT 6204 84.836 8.903 86.832 1.00 0.00 H TER 94497 WAT 6204 ATOM 94497 O WAT 6205 74.769 34.398 61.494 1.00 0.00 O ATOM 94498 H1 WAT 6205 74.778 34.192 60.560 1.00 0.00 H ATOM 94499 H2 WAT 6205 74.787 33.545 61.928 1.00 0.00 H TER 94501 WAT 6205 ATOM 94501 O WAT 6206 6.820 21.597 105.147 1.00 0.00 O ATOM 94502 H1 WAT 6206 5.996 22.085 105.134 1.00 0.00 H ATOM 94503 H2 WAT 6206 7.498 22.270 105.090 1.00 0.00 H TER 94505 WAT 6206 ATOM 94505 O WAT 6207 24.511 96.439 132.903 1.00 0.00 O ATOM 94506 H1 WAT 6207 24.009 95.917 132.278 1.00 0.00 H ATOM 94507 H2 WAT 6207 24.135 96.219 133.756 1.00 0.00 H TER 94509 WAT 6207 ATOM 94509 O WAT 6208 115.304 55.002 3.751 1.00 0.00 O ATOM 94510 H1 WAT 6208 115.133 54.109 4.051 1.00 0.00 H ATOM 94511 H2 WAT 6208 115.870 54.893 2.986 1.00 0.00 H TER 94513 WAT 6208 ATOM 94513 O WAT 6209 47.436 96.875 89.942 1.00 0.00 O ATOM 94514 H1 WAT 6209 47.541 96.622 89.025 1.00 0.00 H ATOM 94515 H2 WAT 6209 48.329 96.908 90.285 1.00 0.00 H TER 94517 WAT 6209 ATOM 94517 O WAT 6210 4.602 45.139 2.360 1.00 0.00 O ATOM 94518 H1 WAT 6210 4.887 44.860 3.230 1.00 0.00 H ATOM 94519 H2 WAT 6210 5.397 45.115 1.828 1.00 0.00 H TER 94521 WAT 6210 ATOM 94521 O WAT 6211 0.523 104.801 89.979 1.00 0.00 O ATOM 94522 H1 WAT 6211 0.829 104.722 89.075 1.00 0.00 H ATOM 94523 H2 WAT 6211 -0.031 104.032 90.113 1.00 0.00 H TER 94525 WAT 6211 ATOM 94525 O WAT 6212 137.646 67.641 77.953 1.00 0.00 O ATOM 94526 H1 WAT 6212 137.571 67.545 78.903 1.00 0.00 H ATOM 94527 H2 WAT 6212 138.508 68.035 77.820 1.00 0.00 H TER 94529 WAT 6212 ATOM 94529 O WAT 6213 116.879 60.301 11.338 1.00 0.00 O ATOM 94530 H1 WAT 6213 117.022 59.443 10.939 1.00 0.00 H ATOM 94531 H2 WAT 6213 117.425 60.898 10.826 1.00 0.00 H TER 94533 WAT 6213 ATOM 94533 O WAT 6214 140.040 145.896 157.056 1.00 0.00 O ATOM 94534 H1 WAT 6214 139.508 145.119 156.883 1.00 0.00 H ATOM 94535 H2 WAT 6214 139.672 146.264 157.860 1.00 0.00 H TER 94537 WAT 6214 ATOM 94537 O WAT 6215 76.022 102.405 20.975 1.00 0.00 O ATOM 94538 H1 WAT 6215 76.240 102.320 21.903 1.00 0.00 H ATOM 94539 H2 WAT 6215 76.188 101.536 20.609 1.00 0.00 H TER 94541 WAT 6215 ATOM 94541 O WAT 6216 76.353 104.600 150.781 1.00 0.00 O ATOM 94542 H1 WAT 6216 75.426 104.425 150.945 1.00 0.00 H ATOM 94543 H2 WAT 6216 76.440 104.559 149.829 1.00 0.00 H TER 94545 WAT 6216 ATOM 94545 O WAT 6217 139.715 31.096 6.292 1.00 0.00 O ATOM 94546 H1 WAT 6217 140.411 30.886 6.915 1.00 0.00 H ATOM 94547 H2 WAT 6217 139.962 31.950 5.936 1.00 0.00 H TER 94549 WAT 6217 ATOM 94549 O WAT 6218 94.010 32.004 77.491 1.00 0.00 O ATOM 94550 H1 WAT 6218 93.719 32.878 77.231 1.00 0.00 H ATOM 94551 H2 WAT 6218 93.512 31.409 76.930 1.00 0.00 H TER 94553 WAT 6218 ATOM 94553 O WAT 6219 89.308 145.515 82.547 1.00 0.00 O ATOM 94554 H1 WAT 6219 90.126 145.136 82.868 1.00 0.00 H ATOM 94555 H2 WAT 6219 89.507 145.794 81.654 1.00 0.00 H TER 94557 WAT 6219 ATOM 94557 O WAT 6220 23.395 61.835 65.185 1.00 0.00 O ATOM 94558 H1 WAT 6220 23.819 61.772 66.041 1.00 0.00 H ATOM 94559 H2 WAT 6220 22.484 61.591 65.350 1.00 0.00 H TER 94561 WAT 6220 ATOM 94561 O WAT 6221 27.816 72.350 129.085 1.00 0.00 O ATOM 94562 H1 WAT 6221 28.385 71.733 129.545 1.00 0.00 H ATOM 94563 H2 WAT 6221 27.292 72.754 129.777 1.00 0.00 H TER 94565 WAT 6221 ATOM 94565 O WAT 6222 78.875 116.895 156.819 1.00 0.00 O ATOM 94566 H1 WAT 6222 79.222 117.180 157.664 1.00 0.00 H ATOM 94567 H2 WAT 6222 78.837 115.941 156.885 1.00 0.00 H TER 94569 WAT 6222 ATOM 94569 O WAT 6223 63.804 103.394 61.295 1.00 0.00 O ATOM 94570 H1 WAT 6223 63.657 103.085 60.401 1.00 0.00 H ATOM 94571 H2 WAT 6223 62.965 103.769 61.560 1.00 0.00 H TER 94573 WAT 6223 ATOM 94573 O WAT 6224 54.934 56.358 133.874 1.00 0.00 O ATOM 94574 H1 WAT 6224 54.749 56.694 134.751 1.00 0.00 H ATOM 94575 H2 WAT 6224 55.630 55.714 134.007 1.00 0.00 H TER 94577 WAT 6224 ATOM 94577 O WAT 6225 72.319 47.119 113.216 1.00 0.00 O ATOM 94578 H1 WAT 6225 71.502 46.624 113.271 1.00 0.00 H ATOM 94579 H2 WAT 6225 72.439 47.483 114.093 1.00 0.00 H TER 94581 WAT 6225 ATOM 94581 O WAT 6226 34.168 13.216 102.570 1.00 0.00 O ATOM 94582 H1 WAT 6226 33.890 12.301 102.623 1.00 0.00 H ATOM 94583 H2 WAT 6226 34.597 13.385 103.408 1.00 0.00 H TER 94585 WAT 6226 ATOM 94585 O WAT 6227 136.542 145.157 92.653 1.00 0.00 O ATOM 94586 H1 WAT 6227 137.309 145.713 92.792 1.00 0.00 H ATOM 94587 H2 WAT 6227 136.904 144.286 92.490 1.00 0.00 H TER 94589 WAT 6227 ATOM 94589 O WAT 6228 115.864 109.618 99.932 1.00 0.00 O ATOM 94590 H1 WAT 6228 115.886 110.471 100.365 1.00 0.00 H ATOM 94591 H2 WAT 6228 114.952 109.335 100.008 1.00 0.00 H TER 94593 WAT 6228 ATOM 94593 O WAT 6229 31.299 127.528 12.253 1.00 0.00 O ATOM 94594 H1 WAT 6229 32.201 127.785 12.441 1.00 0.00 H ATOM 94595 H2 WAT 6229 30.880 128.333 11.947 1.00 0.00 H TER 94597 WAT 6229 ATOM 94597 O WAT 6230 37.339 14.794 16.321 1.00 0.00 O ATOM 94598 H1 WAT 6230 36.976 15.002 17.182 1.00 0.00 H ATOM 94599 H2 WAT 6230 36.586 14.821 15.731 1.00 0.00 H TER 94601 WAT 6230 ATOM 94601 O WAT 6231 76.721 1.826 115.806 1.00 0.00 O ATOM 94602 H1 WAT 6231 76.618 2.761 115.632 1.00 0.00 H ATOM 94603 H2 WAT 6231 77.271 1.786 116.588 1.00 0.00 H TER 94605 WAT 6231 ATOM 94605 O WAT 6232 73.252 138.208 137.475 1.00 0.00 O ATOM 94606 H1 WAT 6232 73.980 138.649 137.038 1.00 0.00 H ATOM 94607 H2 WAT 6232 72.557 138.184 136.817 1.00 0.00 H TER 94609 WAT 6232 ATOM 94609 O WAT 6233 22.085 66.101 157.488 1.00 0.00 O ATOM 94610 H1 WAT 6233 22.454 65.275 157.803 1.00 0.00 H ATOM 94611 H2 WAT 6233 22.121 66.684 158.246 1.00 0.00 H TER 94613 WAT 6233 ATOM 94613 O WAT 6234 140.095 71.340 111.263 1.00 0.00 O ATOM 94614 H1 WAT 6234 140.388 70.461 111.503 1.00 0.00 H ATOM 94615 H2 WAT 6234 140.796 71.684 110.709 1.00 0.00 H TER 94617 WAT 6234 ATOM 94617 O WAT 6235 48.765 112.740 9.920 1.00 0.00 O ATOM 94618 H1 WAT 6235 49.605 113.074 10.236 1.00 0.00 H ATOM 94619 H2 WAT 6235 48.822 112.813 8.967 1.00 0.00 H TER 94621 WAT 6235 ATOM 94621 O WAT 6236 77.271 125.671 13.525 1.00 0.00 O ATOM 94622 H1 WAT 6236 76.504 125.548 14.085 1.00 0.00 H ATOM 94623 H2 WAT 6236 77.840 124.929 13.732 1.00 0.00 H TER 94625 WAT 6236 ATOM 94625 O WAT 6237 51.104 3.103 120.428 1.00 0.00 O ATOM 94626 H1 WAT 6237 51.786 2.455 120.603 1.00 0.00 H ATOM 94627 H2 WAT 6237 51.475 3.930 120.735 1.00 0.00 H TER 94629 WAT 6237 ATOM 94629 O WAT 6238 70.632 51.411 84.053 1.00 0.00 O ATOM 94630 H1 WAT 6238 70.444 50.719 83.420 1.00 0.00 H ATOM 94631 H2 WAT 6238 69.780 51.622 84.437 1.00 0.00 H TER 94633 WAT 6238 ATOM 94633 O WAT 6239 42.868 124.240 3.021 1.00 0.00 O ATOM 94634 H1 WAT 6239 43.221 123.361 2.885 1.00 0.00 H ATOM 94635 H2 WAT 6239 43.359 124.793 2.413 1.00 0.00 H TER 94637 WAT 6239 ATOM 94637 O WAT 6240 56.571 129.082 4.768 1.00 0.00 O ATOM 94638 H1 WAT 6240 56.745 130.019 4.683 1.00 0.00 H ATOM 94639 H2 WAT 6240 55.634 128.996 4.596 1.00 0.00 H TER 94641 WAT 6240 ATOM 94641 O WAT 6241 4.939 72.402 68.902 1.00 0.00 O ATOM 94642 H1 WAT 6241 4.671 73.292 69.130 1.00 0.00 H ATOM 94643 H2 WAT 6241 4.802 72.345 67.956 1.00 0.00 H TER 94645 WAT 6241 ATOM 94645 O WAT 6242 138.402 87.068 134.119 1.00 0.00 O ATOM 94646 H1 WAT 6242 137.491 87.315 133.961 1.00 0.00 H ATOM 94647 H2 WAT 6242 138.905 87.851 133.896 1.00 0.00 H TER 94649 WAT 6242 ATOM 94649 O WAT 6243 22.318 105.727 122.456 1.00 0.00 O ATOM 94650 H1 WAT 6243 22.188 104.807 122.227 1.00 0.00 H ATOM 94651 H2 WAT 6243 22.040 105.788 123.370 1.00 0.00 H TER 94653 WAT 6243 ATOM 94653 O WAT 6244 56.749 53.665 121.896 1.00 0.00 O ATOM 94654 H1 WAT 6244 56.377 53.455 122.752 1.00 0.00 H ATOM 94655 H2 WAT 6244 56.205 53.182 121.274 1.00 0.00 H TER 94657 WAT 6244 ATOM 94657 O WAT 6245 139.151 16.253 81.056 1.00 0.00 O ATOM 94658 H1 WAT 6245 139.067 15.317 81.240 1.00 0.00 H ATOM 94659 H2 WAT 6245 138.260 16.593 81.135 1.00 0.00 H TER 94661 WAT 6245 ATOM 94661 O WAT 6246 13.511 47.073 85.326 1.00 0.00 O ATOM 94662 H1 WAT 6246 12.856 46.386 85.206 1.00 0.00 H ATOM 94663 H2 WAT 6246 13.852 46.928 86.208 1.00 0.00 H TER 94665 WAT 6246 ATOM 94665 O WAT 6247 136.717 2.213 95.062 1.00 0.00 O ATOM 94666 H1 WAT 6247 136.962 2.960 95.608 1.00 0.00 H ATOM 94667 H2 WAT 6247 136.376 2.605 94.258 1.00 0.00 H TER 94669 WAT 6247 ATOM 94669 O WAT 6248 77.134 41.465 126.490 1.00 0.00 O ATOM 94670 H1 WAT 6248 76.251 41.326 126.831 1.00 0.00 H ATOM 94671 H2 WAT 6248 77.452 42.237 126.957 1.00 0.00 H TER 94673 WAT 6248 ATOM 94673 O WAT 6249 108.307 126.950 129.628 1.00 0.00 O ATOM 94674 H1 WAT 6249 107.395 126.784 129.394 1.00 0.00 H ATOM 94675 H2 WAT 6249 108.292 127.074 130.577 1.00 0.00 H TER 94677 WAT 6249 ATOM 94677 O WAT 6250 121.434 78.927 103.935 1.00 0.00 O ATOM 94678 H1 WAT 6250 121.232 77.993 103.987 1.00 0.00 H ATOM 94679 H2 WAT 6250 122.250 78.968 103.437 1.00 0.00 H TER 94681 WAT 6250 ATOM 94681 O WAT 6251 29.473 123.233 91.017 1.00 0.00 O ATOM 94682 H1 WAT 6251 28.966 122.422 90.996 1.00 0.00 H ATOM 94683 H2 WAT 6251 28.896 123.887 90.623 1.00 0.00 H TER 94685 WAT 6251 ATOM 94685 O WAT 6252 141.654 93.987 151.333 1.00 0.00 O ATOM 94686 H1 WAT 6252 142.174 94.349 150.615 1.00 0.00 H ATOM 94687 H2 WAT 6252 140.886 94.556 151.383 1.00 0.00 H TER 94689 WAT 6252 ATOM 94689 O WAT 6253 129.800 125.573 153.622 1.00 0.00 O ATOM 94690 H1 WAT 6253 129.857 125.007 154.393 1.00 0.00 H ATOM 94691 H2 WAT 6253 129.381 125.028 152.956 1.00 0.00 H TER 94693 WAT 6253 ATOM 94693 O WAT 6254 38.768 9.065 59.850 1.00 0.00 O ATOM 94694 H1 WAT 6254 38.178 9.501 59.234 1.00 0.00 H ATOM 94695 H2 WAT 6254 38.928 8.205 59.459 1.00 0.00 H TER 94697 WAT 6254 ATOM 94697 O WAT 6255 134.835 84.958 153.693 1.00 0.00 O ATOM 94698 H1 WAT 6255 135.396 84.622 154.392 1.00 0.00 H ATOM 94699 H2 WAT 6255 133.995 85.128 154.121 1.00 0.00 H TER 94701 WAT 6255 ATOM 94701 O WAT 6256 57.937 53.729 131.140 1.00 0.00 O ATOM 94702 H1 WAT 6256 57.813 54.348 131.860 1.00 0.00 H ATOM 94703 H2 WAT 6256 57.342 53.006 131.340 1.00 0.00 H TER 94705 WAT 6256 ATOM 94705 O WAT 6257 84.463 54.376 123.857 1.00 0.00 O ATOM 94706 H1 WAT 6257 84.262 54.696 122.978 1.00 0.00 H ATOM 94707 H2 WAT 6257 83.901 53.609 123.968 1.00 0.00 H TER 94709 WAT 6257 ATOM 94709 O WAT 6258 142.482 96.587 108.421 1.00 0.00 O ATOM 94710 H1 WAT 6258 141.741 96.910 108.933 1.00 0.00 H ATOM 94711 H2 WAT 6258 142.105 96.354 107.573 1.00 0.00 H TER 94713 WAT 6258 ATOM 94713 O WAT 6259 135.674 79.919 99.382 1.00 0.00 O ATOM 94714 H1 WAT 6259 136.262 80.021 98.633 1.00 0.00 H ATOM 94715 H2 WAT 6259 136.004 79.147 99.842 1.00 0.00 H TER 94717 WAT 6259 ATOM 94717 O WAT 6260 48.727 43.119 151.941 1.00 0.00 O ATOM 94718 H1 WAT 6260 48.855 42.170 151.935 1.00 0.00 H ATOM 94719 H2 WAT 6260 48.392 43.310 152.817 1.00 0.00 H TER 94721 WAT 6260 ATOM 94721 O WAT 6261 90.828 30.316 65.571 1.00 0.00 O ATOM 94722 H1 WAT 6261 91.217 31.148 65.843 1.00 0.00 H ATOM 94723 H2 WAT 6261 91.577 29.737 65.429 1.00 0.00 H TER 94725 WAT 6261 ATOM 94725 O WAT 6262 75.678 68.137 146.892 1.00 0.00 O ATOM 94726 H1 WAT 6262 75.958 68.280 145.987 1.00 0.00 H ATOM 94727 H2 WAT 6262 74.754 67.899 146.822 1.00 0.00 H TER 94729 WAT 6262 ATOM 94729 O WAT 6263 101.532 4.098 7.798 1.00 0.00 O ATOM 94730 H1 WAT 6263 100.602 4.284 7.931 1.00 0.00 H ATOM 94731 H2 WAT 6263 101.921 4.197 8.667 1.00 0.00 H TER 94733 WAT 6263 ATOM 94733 O WAT 6264 53.302 19.771 85.460 1.00 0.00 O ATOM 94734 H1 WAT 6264 53.181 18.822 85.438 1.00 0.00 H ATOM 94735 H2 WAT 6264 52.483 20.109 85.822 1.00 0.00 H TER 94737 WAT 6264 ATOM 94737 O WAT 6265 54.719 70.343 76.676 1.00 0.00 O ATOM 94738 H1 WAT 6265 54.550 69.407 76.783 1.00 0.00 H ATOM 94739 H2 WAT 6265 53.890 70.764 76.903 1.00 0.00 H TER 94741 WAT 6265 ATOM 94741 O WAT 6266 10.574 140.710 70.787 1.00 0.00 O ATOM 94742 H1 WAT 6266 10.603 141.188 71.616 1.00 0.00 H ATOM 94743 H2 WAT 6266 11.428 140.281 70.729 1.00 0.00 H TER 94745 WAT 6266 ATOM 94745 O WAT 6267 82.316 51.381 18.196 1.00 0.00 O ATOM 94746 H1 WAT 6267 82.672 51.674 17.357 1.00 0.00 H ATOM 94747 H2 WAT 6267 82.369 50.426 18.158 1.00 0.00 H TER 94749 WAT 6267 ATOM 94749 O WAT 6268 5.093 113.991 12.744 1.00 0.00 O ATOM 94750 H1 WAT 6268 5.307 114.614 13.438 1.00 0.00 H ATOM 94751 H2 WAT 6268 4.150 113.850 12.831 1.00 0.00 H TER 94753 WAT 6268 ATOM 94753 O WAT 6269 39.157 38.974 64.114 1.00 0.00 O ATOM 94754 H1 WAT 6269 39.590 38.293 64.628 1.00 0.00 H ATOM 94755 H2 WAT 6269 38.618 38.493 63.486 1.00 0.00 H TER 94757 WAT 6269 ATOM 94757 O WAT 6270 8.620 52.564 78.575 1.00 0.00 O ATOM 94758 H1 WAT 6270 9.455 52.308 78.184 1.00 0.00 H ATOM 94759 H2 WAT 6270 8.147 53.000 77.866 1.00 0.00 H TER 94761 WAT 6270 ATOM 94761 O WAT 6271 116.599 112.905 8.872 1.00 0.00 O ATOM 94762 H1 WAT 6271 116.692 111.980 9.098 1.00 0.00 H ATOM 94763 H2 WAT 6271 117.250 113.351 9.414 1.00 0.00 H TER 94765 WAT 6271 ATOM 94765 O WAT 6272 89.743 77.114 129.905 1.00 0.00 O ATOM 94766 H1 WAT 6272 90.502 77.546 129.513 1.00 0.00 H ATOM 94767 H2 WAT 6272 89.301 76.692 129.168 1.00 0.00 H TER 94769 WAT 6272 ATOM 94769 O WAT 6273 29.401 97.593 150.252 1.00 0.00 O ATOM 94770 H1 WAT 6273 29.406 97.149 149.404 1.00 0.00 H ATOM 94771 H2 WAT 6273 30.007 97.086 150.791 1.00 0.00 H TER 94773 WAT 6273 ATOM 94773 O WAT 6274 35.183 87.396 9.558 1.00 0.00 O ATOM 94774 H1 WAT 6274 34.505 87.980 9.898 1.00 0.00 H ATOM 94775 H2 WAT 6274 34.752 86.913 8.853 1.00 0.00 H TER 94777 WAT 6274 ATOM 94777 O WAT 6275 14.708 11.482 92.550 1.00 0.00 O ATOM 94778 H1 WAT 6275 15.333 11.807 93.198 1.00 0.00 H ATOM 94779 H2 WAT 6275 14.941 11.940 91.742 1.00 0.00 H TER 94781 WAT 6275 ATOM 94781 O WAT 6276 47.486 62.136 73.112 1.00 0.00 O ATOM 94782 H1 WAT 6276 47.979 62.116 72.292 1.00 0.00 H ATOM 94783 H2 WAT 6276 46.643 62.523 72.876 1.00 0.00 H TER 94785 WAT 6276 ATOM 94785 O WAT 6277 74.876 46.635 122.063 1.00 0.00 O ATOM 94786 H1 WAT 6277 75.658 46.586 122.613 1.00 0.00 H ATOM 94787 H2 WAT 6277 74.201 46.179 122.566 1.00 0.00 H TER 94789 WAT 6277 ATOM 94789 O WAT 6278 97.093 80.618 111.195 1.00 0.00 O ATOM 94790 H1 WAT 6278 97.395 80.716 110.292 1.00 0.00 H ATOM 94791 H2 WAT 6278 96.396 81.268 111.287 1.00 0.00 H TER 94793 WAT 6278 ATOM 94793 O WAT 6279 15.597 99.535 117.110 1.00 0.00 O ATOM 94794 H1 WAT 6279 14.873 99.530 116.484 1.00 0.00 H ATOM 94795 H2 WAT 6279 15.550 98.679 117.537 1.00 0.00 H TER 94797 WAT 6279 ATOM 94797 O WAT 6280 67.509 112.739 12.859 1.00 0.00 O ATOM 94798 H1 WAT 6280 67.275 112.482 11.967 1.00 0.00 H ATOM 94799 H2 WAT 6280 67.983 113.564 12.754 1.00 0.00 H TER 94801 WAT 6280 ATOM 94801 O WAT 6281 94.991 137.541 87.609 1.00 0.00 O ATOM 94802 H1 WAT 6281 95.519 136.973 88.169 1.00 0.00 H ATOM 94803 H2 WAT 6281 95.411 138.399 87.675 1.00 0.00 H TER 94805 WAT 6281 ATOM 94805 O WAT 6282 113.342 143.178 85.480 1.00 0.00 O ATOM 94806 H1 WAT 6282 114.245 143.441 85.659 1.00 0.00 H ATOM 94807 H2 WAT 6282 112.816 143.709 86.078 1.00 0.00 H TER 94809 WAT 6282 ATOM 94809 O WAT 6283 68.209 102.021 93.960 1.00 0.00 O ATOM 94810 H1 WAT 6283 67.264 101.995 93.812 1.00 0.00 H ATOM 94811 H2 WAT 6283 68.343 101.499 94.751 1.00 0.00 H TER 94813 WAT 6283 ATOM 94813 O WAT 6284 28.621 92.449 129.775 1.00 0.00 O ATOM 94814 H1 WAT 6284 28.436 92.653 128.858 1.00 0.00 H ATOM 94815 H2 WAT 6284 28.058 91.700 129.972 1.00 0.00 H TER 94817 WAT 6284 ATOM 94817 O WAT 6285 16.384 48.614 72.524 1.00 0.00 O ATOM 94818 H1 WAT 6285 17.065 49.093 72.052 1.00 0.00 H ATOM 94819 H2 WAT 6285 16.862 47.969 73.046 1.00 0.00 H TER 94821 WAT 6285 ATOM 94821 O WAT 6286 35.177 87.258 2.788 1.00 0.00 O ATOM 94822 H1 WAT 6286 34.594 87.753 3.364 1.00 0.00 H ATOM 94823 H2 WAT 6286 35.932 87.833 2.660 1.00 0.00 H TER 94825 WAT 6286 ATOM 94825 O WAT 6287 108.478 120.510 156.073 1.00 0.00 O ATOM 94826 H1 WAT 6287 107.588 120.247 155.842 1.00 0.00 H ATOM 94827 H2 WAT 6287 108.994 119.707 155.993 1.00 0.00 H TER 94829 WAT 6287 ATOM 94829 O WAT 6288 2.169 56.678 70.023 1.00 0.00 O ATOM 94830 H1 WAT 6288 1.941 56.125 69.277 1.00 0.00 H ATOM 94831 H2 WAT 6288 1.426 56.593 70.621 1.00 0.00 H TER 94833 WAT 6288 ATOM 94833 O WAT 6289 17.489 110.233 6.052 1.00 0.00 O ATOM 94834 H1 WAT 6289 17.646 111.074 6.480 1.00 0.00 H ATOM 94835 H2 WAT 6289 16.537 110.183 5.963 1.00 0.00 H TER 94837 WAT 6289 ATOM 94837 O WAT 6290 125.324 43.568 101.122 1.00 0.00 O ATOM 94838 H1 WAT 6290 126.029 43.671 100.483 1.00 0.00 H ATOM 94839 H2 WAT 6290 125.773 43.375 101.945 1.00 0.00 H TER 94841 WAT 6290 ATOM 94841 O WAT 6291 57.910 21.863 127.107 1.00 0.00 O ATOM 94842 H1 WAT 6291 58.829 21.743 127.345 1.00 0.00 H ATOM 94843 H2 WAT 6291 57.808 22.810 127.012 1.00 0.00 H TER 94845 WAT 6291 ATOM 94845 O WAT 6292 16.293 58.228 15.260 1.00 0.00 O ATOM 94846 H1 WAT 6292 16.961 57.726 14.793 1.00 0.00 H ATOM 94847 H2 WAT 6292 15.494 57.711 15.165 1.00 0.00 H TER 94849 WAT 6292 ATOM 94849 O WAT 6293 20.091 93.350 81.609 1.00 0.00 O ATOM 94850 H1 WAT 6293 20.187 93.379 80.657 1.00 0.00 H ATOM 94851 H2 WAT 6293 20.972 93.521 81.944 1.00 0.00 H TER 94853 WAT 6293 ATOM 94853 O WAT 6294 90.688 123.519 88.270 1.00 0.00 O ATOM 94854 H1 WAT 6294 91.333 123.453 87.565 1.00 0.00 H ATOM 94855 H2 WAT 6294 91.155 123.957 88.981 1.00 0.00 H TER 94857 WAT 6294 ATOM 94857 O WAT 6295 126.389 64.129 104.487 1.00 0.00 O ATOM 94858 H1 WAT 6295 125.551 64.310 104.062 1.00 0.00 H ATOM 94859 H2 WAT 6295 126.171 64.034 105.414 1.00 0.00 H TER 94861 WAT 6295 ATOM 94861 O WAT 6296 69.462 144.177 17.019 1.00 0.00 O ATOM 94862 H1 WAT 6296 69.762 143.701 17.794 1.00 0.00 H ATOM 94863 H2 WAT 6296 68.891 143.558 16.564 1.00 0.00 H TER 94865 WAT 6296 ATOM 94865 O WAT 6297 15.175 42.047 75.647 1.00 0.00 O ATOM 94866 H1 WAT 6297 15.906 41.449 75.804 1.00 0.00 H ATOM 94867 H2 WAT 6297 14.717 42.092 76.486 1.00 0.00 H TER 94869 WAT 6297 ATOM 94869 O WAT 6298 144.285 29.007 81.690 1.00 0.00 O ATOM 94870 H1 WAT 6298 144.835 28.746 82.429 1.00 0.00 H ATOM 94871 H2 WAT 6298 144.892 29.416 81.073 1.00 0.00 H TER 94873 WAT 6298 ATOM 94873 O WAT 6299 5.644 105.271 145.580 1.00 0.00 O ATOM 94874 H1 WAT 6299 5.379 104.655 144.896 1.00 0.00 H ATOM 94875 H2 WAT 6299 6.552 105.039 145.772 1.00 0.00 H TER 94877 WAT 6299 ATOM 94877 O WAT 6300 103.978 130.617 105.350 1.00 0.00 O ATOM 94878 H1 WAT 6300 104.845 130.266 105.147 1.00 0.00 H ATOM 94879 H2 WAT 6300 104.076 131.565 105.259 1.00 0.00 H TER 94881 WAT 6300 ATOM 94881 O WAT 6301 113.924 107.614 156.324 1.00 0.00 O ATOM 94882 H1 WAT 6301 114.494 107.363 157.051 1.00 0.00 H ATOM 94883 H2 WAT 6301 114.413 107.366 155.540 1.00 0.00 H TER 94885 WAT 6301 ATOM 94885 O WAT 6302 2.777 40.546 96.777 1.00 0.00 O ATOM 94886 H1 WAT 6302 1.976 40.120 96.470 1.00 0.00 H ATOM 94887 H2 WAT 6302 2.536 40.928 97.621 1.00 0.00 H TER 94889 WAT 6302 ATOM 94889 O WAT 6303 29.242 47.794 66.238 1.00 0.00 O ATOM 94890 H1 WAT 6303 30.141 48.106 66.137 1.00 0.00 H ATOM 94891 H2 WAT 6303 29.037 47.949 67.160 1.00 0.00 H TER 94893 WAT 6303 ATOM 94893 O WAT 6304 36.071 16.525 141.595 1.00 0.00 O ATOM 94894 H1 WAT 6304 35.264 16.271 141.148 1.00 0.00 H ATOM 94895 H2 WAT 6304 36.503 15.696 141.799 1.00 0.00 H TER 94897 WAT 6304 ATOM 94897 O WAT 6305 62.746 110.088 137.059 1.00 0.00 O ATOM 94898 H1 WAT 6305 62.107 109.377 137.010 1.00 0.00 H ATOM 94899 H2 WAT 6305 62.682 110.527 136.211 1.00 0.00 H TER 94901 WAT 6305 ATOM 94901 O WAT 6306 61.108 25.334 148.417 1.00 0.00 O ATOM 94902 H1 WAT 6306 60.255 24.912 148.314 1.00 0.00 H ATOM 94903 H2 WAT 6306 61.305 25.250 149.350 1.00 0.00 H TER 94905 WAT 6306 ATOM 94905 O WAT 6307 14.446 68.304 94.399 1.00 0.00 O ATOM 94906 H1 WAT 6307 14.219 68.463 95.315 1.00 0.00 H ATOM 94907 H2 WAT 6307 15.403 68.340 94.380 1.00 0.00 H TER 94909 WAT 6307 ATOM 94909 O WAT 6308 94.708 47.999 109.056 1.00 0.00 O ATOM 94910 H1 WAT 6308 95.142 47.219 108.710 1.00 0.00 H ATOM 94911 H2 WAT 6308 93.820 47.956 108.702 1.00 0.00 H TER 94913 WAT 6308 ATOM 94913 O WAT 6309 36.176 91.159 118.514 1.00 0.00 O ATOM 94914 H1 WAT 6309 36.268 91.383 117.587 1.00 0.00 H ATOM 94915 H2 WAT 6309 35.392 91.630 118.797 1.00 0.00 H TER 94917 WAT 6309 ATOM 94917 O WAT 6310 64.655 35.861 14.331 1.00 0.00 O ATOM 94918 H1 WAT 6310 64.922 35.072 14.803 1.00 0.00 H ATOM 94919 H2 WAT 6310 63.728 35.967 14.546 1.00 0.00 H TER 94921 WAT 6310 ATOM 94921 O WAT 6311 24.162 69.885 85.379 1.00 0.00 O ATOM 94922 H1 WAT 6311 23.547 70.579 85.617 1.00 0.00 H ATOM 94923 H2 WAT 6311 23.862 69.583 84.522 1.00 0.00 H TER 94925 WAT 6311 ATOM 94925 O WAT 6312 97.229 121.649 13.991 1.00 0.00 O ATOM 94926 H1 WAT 6312 97.505 121.272 13.156 1.00 0.00 H ATOM 94927 H2 WAT 6312 96.556 121.050 14.314 1.00 0.00 H TER 94929 WAT 6312 ATOM 94929 O WAT 6313 94.818 119.919 98.596 1.00 0.00 O ATOM 94930 H1 WAT 6313 95.462 119.548 99.199 1.00 0.00 H ATOM 94931 H2 WAT 6313 94.051 119.353 98.686 1.00 0.00 H TER 94933 WAT 6313 ATOM 94933 O WAT 6314 131.545 2.994 8.978 1.00 0.00 O ATOM 94934 H1 WAT 6314 132.175 3.659 9.254 1.00 0.00 H ATOM 94935 H2 WAT 6314 131.521 2.371 9.705 1.00 0.00 H TER 94937 WAT 6314 ATOM 94937 O WAT 6315 116.103 58.889 62.406 1.00 0.00 O ATOM 94938 H1 WAT 6315 116.316 59.218 63.279 1.00 0.00 H ATOM 94939 H2 WAT 6315 116.301 59.621 61.820 1.00 0.00 H TER 94941 WAT 6315 ATOM 94941 O WAT 6316 60.354 113.782 80.439 1.00 0.00 O ATOM 94942 H1 WAT 6316 59.874 113.075 80.871 1.00 0.00 H ATOM 94943 H2 WAT 6316 61.256 113.679 80.743 1.00 0.00 H TER 94945 WAT 6316 ATOM 94945 O WAT 6317 67.514 87.905 135.967 1.00 0.00 O ATOM 94946 H1 WAT 6317 67.513 88.466 136.742 1.00 0.00 H ATOM 94947 H2 WAT 6317 68.280 88.188 135.467 1.00 0.00 H TER 94949 WAT 6317 ATOM 94949 O WAT 6318 39.984 11.410 111.305 1.00 0.00 O ATOM 94950 H1 WAT 6318 39.567 11.318 110.448 1.00 0.00 H ATOM 94951 H2 WAT 6318 40.919 11.473 111.111 1.00 0.00 H TER 94953 WAT 6318 ATOM 94953 O WAT 6319 141.217 75.997 67.115 1.00 0.00 O ATOM 94954 H1 WAT 6319 141.406 76.725 66.523 1.00 0.00 H ATOM 94955 H2 WAT 6319 140.714 76.391 67.828 1.00 0.00 H TER 94957 WAT 6319 ATOM 94957 O WAT 6320 30.646 17.453 108.165 1.00 0.00 O ATOM 94958 H1 WAT 6320 30.503 18.275 107.695 1.00 0.00 H ATOM 94959 H2 WAT 6320 31.281 16.978 107.630 1.00 0.00 H TER 94961 WAT 6320 ATOM 94961 O WAT 6321 135.705 7.625 114.948 1.00 0.00 O ATOM 94962 H1 WAT 6321 136.004 6.848 114.474 1.00 0.00 H ATOM 94963 H2 WAT 6321 135.154 7.280 115.650 1.00 0.00 H TER 94965 WAT 6321 ATOM 94965 O WAT 6322 135.249 37.152 14.569 1.00 0.00 O ATOM 94966 H1 WAT 6322 135.243 37.522 15.451 1.00 0.00 H ATOM 94967 H2 WAT 6322 134.536 37.602 14.116 1.00 0.00 H TER 94969 WAT 6322 ATOM 94969 O WAT 6323 22.223 67.698 68.543 1.00 0.00 O ATOM 94970 H1 WAT 6323 22.145 67.865 67.604 1.00 0.00 H ATOM 94971 H2 WAT 6323 22.031 68.541 68.953 1.00 0.00 H TER 94973 WAT 6323 ATOM 94973 O WAT 6324 106.000 136.326 11.160 1.00 0.00 O ATOM 94974 H1 WAT 6324 106.218 137.138 11.618 1.00 0.00 H ATOM 94975 H2 WAT 6324 105.075 136.180 11.358 1.00 0.00 H TER 94977 WAT 6324 ATOM 94977 O WAT 6325 79.068 86.217 132.481 1.00 0.00 O ATOM 94978 H1 WAT 6325 79.286 85.338 132.171 1.00 0.00 H ATOM 94979 H2 WAT 6325 78.132 86.307 132.307 1.00 0.00 H TER 94981 WAT 6325 ATOM 94981 O WAT 6326 81.158 22.489 141.366 1.00 0.00 O ATOM 94982 H1 WAT 6326 80.940 21.568 141.511 1.00 0.00 H ATOM 94983 H2 WAT 6326 80.901 22.926 142.177 1.00 0.00 H TER 94985 WAT 6326 ATOM 94985 O WAT 6327 25.656 127.566 142.987 1.00 0.00 O ATOM 94986 H1 WAT 6327 25.914 126.651 143.098 1.00 0.00 H ATOM 94987 H2 WAT 6327 26.254 128.054 143.554 1.00 0.00 H TER 94989 WAT 6327 ATOM 94989 O WAT 6328 70.731 93.441 141.149 1.00 0.00 O ATOM 94990 H1 WAT 6328 71.594 93.463 141.563 1.00 0.00 H ATOM 94991 H2 WAT 6328 70.223 94.101 141.621 1.00 0.00 H TER 94993 WAT 6328 ATOM 94993 O WAT 6329 63.958 10.184 91.490 1.00 0.00 O ATOM 94994 H1 WAT 6329 63.463 9.641 90.877 1.00 0.00 H ATOM 94995 H2 WAT 6329 64.872 10.072 91.226 1.00 0.00 H TER 94997 WAT 6329 ATOM 94997 O WAT 6330 126.684 81.537 106.427 1.00 0.00 O ATOM 94998 H1 WAT 6330 126.844 81.113 105.584 1.00 0.00 H ATOM 94999 H2 WAT 6330 125.778 81.314 106.639 1.00 0.00 H TER 95001 WAT 6330 ATOM 95001 O WAT 6331 18.400 52.670 97.953 1.00 0.00 O ATOM 95002 H1 WAT 6331 18.843 51.989 97.447 1.00 0.00 H ATOM 95003 H2 WAT 6331 18.266 52.278 98.816 1.00 0.00 H TER 95005 WAT 6331 ATOM 95005 O WAT 6332 22.596 12.847 68.972 1.00 0.00 O ATOM 95006 H1 WAT 6332 23.226 13.237 69.578 1.00 0.00 H ATOM 95007 H2 WAT 6332 21.781 13.322 69.134 1.00 0.00 H TER 95009 WAT 6332 ATOM 95009 O WAT 6333 69.555 60.224 4.427 1.00 0.00 O ATOM 95010 H1 WAT 6333 69.218 59.670 3.723 1.00 0.00 H ATOM 95011 H2 WAT 6333 69.337 59.750 5.229 1.00 0.00 H TER 95013 WAT 6333 ATOM 95013 O WAT 6334 9.533 127.092 14.286 1.00 0.00 O ATOM 95014 H1 WAT 6334 10.032 127.266 13.489 1.00 0.00 H ATOM 95015 H2 WAT 6334 10.196 126.871 14.940 1.00 0.00 H TER 95017 WAT 6334 ATOM 95017 O WAT 6335 137.251 119.203 132.452 1.00 0.00 O ATOM 95018 H1 WAT 6335 137.541 118.489 131.884 1.00 0.00 H ATOM 95019 H2 WAT 6335 136.309 119.063 132.550 1.00 0.00 H TER 95021 WAT 6335 ATOM 95021 O WAT 6336 54.628 142.735 1.856 1.00 0.00 O ATOM 95022 H1 WAT 6336 53.694 142.686 1.654 1.00 0.00 H ATOM 95023 H2 WAT 6336 54.980 141.893 1.565 1.00 0.00 H TER 95025 WAT 6336 ATOM 95025 O WAT 6337 143.380 70.672 76.877 1.00 0.00 O ATOM 95026 H1 WAT 6337 143.427 70.373 75.969 1.00 0.00 H ATOM 95027 H2 WAT 6337 144.202 71.141 77.019 1.00 0.00 H TER 95029 WAT 6337 ATOM 95029 O WAT 6338 116.244 40.675 110.391 1.00 0.00 O ATOM 95030 H1 WAT 6338 116.977 40.482 110.976 1.00 0.00 H ATOM 95031 H2 WAT 6338 115.635 39.949 110.522 1.00 0.00 H TER 95033 WAT 6338 ATOM 95033 O WAT 6339 75.227 22.755 136.692 1.00 0.00 O ATOM 95034 H1 WAT 6339 74.887 22.997 137.554 1.00 0.00 H ATOM 95035 H2 WAT 6339 76.178 22.773 136.796 1.00 0.00 H TER 95037 WAT 6339 ATOM 95037 O WAT 6340 84.288 8.616 153.255 1.00 0.00 O ATOM 95038 H1 WAT 6340 84.428 7.700 153.014 1.00 0.00 H ATOM 95039 H2 WAT 6340 84.864 9.108 152.669 1.00 0.00 H TER 95041 WAT 6340 ATOM 95041 O WAT 6341 42.533 90.878 85.145 1.00 0.00 O ATOM 95042 H1 WAT 6341 42.682 90.820 84.202 1.00 0.00 H ATOM 95043 H2 WAT 6341 42.676 89.987 85.466 1.00 0.00 H TER 95045 WAT 6341 ATOM 95045 O WAT 6342 71.815 16.675 27.732 1.00 0.00 O ATOM 95046 H1 WAT 6342 72.020 15.965 28.341 1.00 0.00 H ATOM 95047 H2 WAT 6342 72.560 17.272 27.799 1.00 0.00 H TER 95049 WAT 6342 ATOM 95049 O WAT 6343 114.251 67.404 85.564 1.00 0.00 O ATOM 95050 H1 WAT 6343 114.008 68.044 84.895 1.00 0.00 H ATOM 95051 H2 WAT 6343 114.164 67.877 86.392 1.00 0.00 H TER 95053 WAT 6343 ATOM 95053 O WAT 6344 84.059 88.499 150.589 1.00 0.00 O ATOM 95054 H1 WAT 6344 84.898 88.905 150.807 1.00 0.00 H ATOM 95055 H2 WAT 6344 83.513 89.224 150.286 1.00 0.00 H TER 95057 WAT 6344 ATOM 95057 O WAT 6345 131.347 110.227 69.259 1.00 0.00 O ATOM 95058 H1 WAT 6345 130.826 110.505 68.506 1.00 0.00 H ATOM 95059 H2 WAT 6345 131.194 109.284 69.321 1.00 0.00 H TER 95061 WAT 6345 ATOM 95061 O WAT 6346 16.965 135.321 62.224 1.00 0.00 O ATOM 95062 H1 WAT 6346 16.233 134.925 61.752 1.00 0.00 H ATOM 95063 H2 WAT 6346 17.470 135.772 61.547 1.00 0.00 H TER 95065 WAT 6346 ATOM 95065 O WAT 6347 70.408 120.875 8.325 1.00 0.00 O ATOM 95066 H1 WAT 6347 69.720 121.413 8.719 1.00 0.00 H ATOM 95067 H2 WAT 6347 70.852 120.471 9.071 1.00 0.00 H TER 95069 WAT 6347 ATOM 95069 O WAT 6348 137.040 128.550 10.567 1.00 0.00 O ATOM 95070 H1 WAT 6348 136.137 128.499 10.254 1.00 0.00 H ATOM 95071 H2 WAT 6348 137.004 128.207 11.460 1.00 0.00 H TER 95073 WAT 6348 ATOM 95073 O WAT 6349 100.257 81.093 3.176 1.00 0.00 O ATOM 95074 H1 WAT 6349 100.215 80.551 2.389 1.00 0.00 H ATOM 95075 H2 WAT 6349 100.204 80.468 3.900 1.00 0.00 H TER 95077 WAT 6349 ATOM 95077 O WAT 6350 52.247 14.300 116.783 1.00 0.00 O ATOM 95078 H1 WAT 6350 51.837 13.714 116.147 1.00 0.00 H ATOM 95079 H2 WAT 6350 52.726 14.935 116.251 1.00 0.00 H TER 95081 WAT 6350 ATOM 95081 O WAT 6351 135.916 144.348 114.103 1.00 0.00 O ATOM 95082 H1 WAT 6351 135.408 145.153 114.001 1.00 0.00 H ATOM 95083 H2 WAT 6351 136.071 144.048 113.207 1.00 0.00 H TER 95085 WAT 6351 ATOM 95085 O WAT 6352 131.176 93.287 128.417 1.00 0.00 O ATOM 95086 H1 WAT 6352 130.380 93.290 127.885 1.00 0.00 H ATOM 95087 H2 WAT 6352 131.457 94.202 128.433 1.00 0.00 H TER 95089 WAT 6352 ATOM 95089 O WAT 6353 97.273 67.620 100.773 1.00 0.00 O ATOM 95090 H1 WAT 6353 96.940 68.042 99.981 1.00 0.00 H ATOM 95091 H2 WAT 6353 96.723 67.964 101.477 1.00 0.00 H TER 95093 WAT 6353 ATOM 95093 O WAT 6354 39.705 55.568 92.403 1.00 0.00 O ATOM 95094 H1 WAT 6354 40.484 55.134 92.750 1.00 0.00 H ATOM 95095 H2 WAT 6354 39.760 56.463 92.737 1.00 0.00 H TER 95097 WAT 6354 ATOM 95097 O WAT 6355 103.345 76.061 110.785 1.00 0.00 O ATOM 95098 H1 WAT 6355 103.671 75.203 111.059 1.00 0.00 H ATOM 95099 H2 WAT 6355 102.682 75.865 110.123 1.00 0.00 H TER 95101 WAT 6355 ATOM 95101 O WAT 6356 27.188 28.442 94.294 1.00 0.00 O ATOM 95102 H1 WAT 6356 27.214 29.197 93.707 1.00 0.00 H ATOM 95103 H2 WAT 6356 27.211 27.684 93.710 1.00 0.00 H TER 95105 WAT 6356 ATOM 95105 O WAT 6357 142.066 7.621 7.599 1.00 0.00 O ATOM 95106 H1 WAT 6357 141.727 7.090 8.320 1.00 0.00 H ATOM 95107 H2 WAT 6357 142.556 8.322 8.028 1.00 0.00 H TER 95109 WAT 6357 ATOM 95109 O WAT 6358 72.093 71.842 141.798 1.00 0.00 O ATOM 95110 H1 WAT 6358 72.184 72.469 141.080 1.00 0.00 H ATOM 95111 H2 WAT 6358 72.989 71.691 142.099 1.00 0.00 H TER 95113 WAT 6358 ATOM 95113 O WAT 6359 116.866 63.509 68.747 1.00 0.00 O ATOM 95114 H1 WAT 6359 117.231 63.786 69.587 1.00 0.00 H ATOM 95115 H2 WAT 6359 117.612 63.148 68.268 1.00 0.00 H TER 95117 WAT 6359 ATOM 95117 O WAT 6360 113.281 100.398 105.790 1.00 0.00 O ATOM 95118 H1 WAT 6360 113.904 99.933 106.348 1.00 0.00 H ATOM 95119 H2 WAT 6360 112.968 99.735 105.175 1.00 0.00 H TER 95121 WAT 6360 ATOM 95121 O WAT 6361 68.090 101.216 133.615 1.00 0.00 O ATOM 95122 H1 WAT 6361 67.191 101.221 133.945 1.00 0.00 H ATOM 95123 H2 WAT 6361 68.465 102.038 133.930 1.00 0.00 H TER 95125 WAT 6361 ATOM 95125 O WAT 6362 93.319 127.986 140.964 1.00 0.00 O ATOM 95126 H1 WAT 6362 93.648 128.877 141.083 1.00 0.00 H ATOM 95127 H2 WAT 6362 93.973 127.430 141.387 1.00 0.00 H TER 95129 WAT 6362 ATOM 95129 O WAT 6363 24.391 71.109 119.573 1.00 0.00 O ATOM 95130 H1 WAT 6363 24.033 71.908 119.187 1.00 0.00 H ATOM 95131 H2 WAT 6363 24.016 71.079 120.453 1.00 0.00 H TER 95133 WAT 6363 ATOM 95133 O WAT 6364 39.025 141.292 136.177 1.00 0.00 O ATOM 95134 H1 WAT 6364 39.470 142.044 135.786 1.00 0.00 H ATOM 95135 H2 WAT 6364 38.157 141.623 136.410 1.00 0.00 H TER 95137 WAT 6364 ATOM 95137 O WAT 6365 44.427 43.806 13.451 1.00 0.00 O ATOM 95138 H1 WAT 6365 44.911 43.857 12.626 1.00 0.00 H ATOM 95139 H2 WAT 6365 44.018 42.941 13.435 1.00 0.00 H TER 95141 WAT 6365 ATOM 95141 O WAT 6366 67.859 58.579 58.510 1.00 0.00 O ATOM 95142 H1 WAT 6366 67.228 58.752 59.209 1.00 0.00 H ATOM 95143 H2 WAT 6366 67.337 58.584 57.708 1.00 0.00 H TER 95145 WAT 6366 ATOM 95145 O WAT 6367 70.859 87.318 65.822 1.00 0.00 O ATOM 95146 H1 WAT 6367 71.018 87.099 64.903 1.00 0.00 H ATOM 95147 H2 WAT 6367 71.597 87.875 66.067 1.00 0.00 H TER 95149 WAT 6367 ATOM 95149 O WAT 6368 3.557 76.160 11.209 1.00 0.00 O ATOM 95150 H1 WAT 6368 4.077 76.957 11.312 1.00 0.00 H ATOM 95151 H2 WAT 6368 2.683 76.403 11.513 1.00 0.00 H TER 95153 WAT 6368 ATOM 95153 O WAT 6369 122.242 8.121 101.650 1.00 0.00 O ATOM 95154 H1 WAT 6369 122.625 8.320 100.796 1.00 0.00 H ATOM 95155 H2 WAT 6369 122.223 7.165 101.688 1.00 0.00 H TER 95157 WAT 6369 ATOM 95157 O WAT 6370 114.824 76.865 10.267 1.00 0.00 O ATOM 95158 H1 WAT 6370 115.225 76.046 9.976 1.00 0.00 H ATOM 95159 H2 WAT 6370 114.221 77.101 9.561 1.00 0.00 H TER 95161 WAT 6370 ATOM 95161 O WAT 6371 7.361 32.769 106.755 1.00 0.00 O ATOM 95162 H1 WAT 6371 8.317 32.817 106.726 1.00 0.00 H ATOM 95163 H2 WAT 6371 7.145 31.989 106.244 1.00 0.00 H TER 95165 WAT 6371 ATOM 95165 O WAT 6372 142.836 125.003 60.606 1.00 0.00 O ATOM 95166 H1 WAT 6372 142.509 125.549 61.322 1.00 0.00 H ATOM 95167 H2 WAT 6372 143.749 125.270 60.500 1.00 0.00 H TER 95169 WAT 6372 ATOM 95169 O WAT 6373 55.703 60.496 103.304 1.00 0.00 O ATOM 95170 H1 WAT 6373 55.872 59.555 103.366 1.00 0.00 H ATOM 95171 H2 WAT 6373 56.282 60.886 103.959 1.00 0.00 H TER 95173 WAT 6373 ATOM 95173 O WAT 6374 11.581 94.016 142.548 1.00 0.00 O ATOM 95174 H1 WAT 6374 12.527 94.115 142.656 1.00 0.00 H ATOM 95175 H2 WAT 6374 11.366 93.224 143.040 1.00 0.00 H TER 95177 WAT 6374 ATOM 95177 O WAT 6375 139.097 131.343 121.392 1.00 0.00 O ATOM 95178 H1 WAT 6375 138.623 131.609 120.604 1.00 0.00 H ATOM 95179 H2 WAT 6375 140.008 131.575 121.212 1.00 0.00 H TER 95181 WAT 6375 ATOM 95181 O WAT 6376 28.832 62.834 158.426 1.00 0.00 O ATOM 95182 H1 WAT 6376 29.127 62.082 158.938 1.00 0.00 H ATOM 95183 H2 WAT 6376 29.145 63.595 158.916 1.00 0.00 H TER 95185 WAT 6376 ATOM 95185 O WAT 6377 76.452 145.003 19.551 1.00 0.00 O ATOM 95186 H1 WAT 6377 76.568 145.290 18.645 1.00 0.00 H ATOM 95187 H2 WAT 6377 77.134 144.345 19.682 1.00 0.00 H TER 95189 WAT 6377 ATOM 95189 O WAT 6378 141.961 95.732 133.641 1.00 0.00 O ATOM 95190 H1 WAT 6378 142.860 95.578 133.353 1.00 0.00 H ATOM 95191 H2 WAT 6378 141.462 95.830 132.830 1.00 0.00 H TER 95193 WAT 6378 ATOM 95193 O WAT 6379 31.242 9.504 13.887 1.00 0.00 O ATOM 95194 H1 WAT 6379 30.848 10.370 13.777 1.00 0.00 H ATOM 95195 H2 WAT 6379 30.981 9.232 14.767 1.00 0.00 H TER 95197 WAT 6379 ATOM 95197 O WAT 6380 61.757 43.872 149.050 1.00 0.00 O ATOM 95198 H1 WAT 6380 62.537 43.377 149.300 1.00 0.00 H ATOM 95199 H2 WAT 6380 62.000 44.303 148.230 1.00 0.00 H TER 95201 WAT 6380 ATOM 95201 O WAT 6381 18.257 109.486 60.930 1.00 0.00 O ATOM 95202 H1 WAT 6381 18.293 110.285 60.404 1.00 0.00 H ATOM 95203 H2 WAT 6381 17.756 108.870 60.396 1.00 0.00 H TER 95205 WAT 6381 ATOM 95205 O WAT 6382 81.962 64.179 3.444 1.00 0.00 O ATOM 95206 H1 WAT 6382 82.501 64.625 2.791 1.00 0.00 H ATOM 95207 H2 WAT 6382 81.429 64.874 3.830 1.00 0.00 H TER 95209 WAT 6382 ATOM 95209 O WAT 6383 53.264 70.956 119.036 1.00 0.00 O ATOM 95210 H1 WAT 6383 53.325 71.104 119.980 1.00 0.00 H ATOM 95211 H2 WAT 6383 52.332 70.809 118.876 1.00 0.00 H TER 95213 WAT 6383 ATOM 95213 O WAT 6384 42.200 27.068 105.948 1.00 0.00 O ATOM 95214 H1 WAT 6384 42.567 26.189 105.852 1.00 0.00 H ATOM 95215 H2 WAT 6384 41.836 27.271 105.086 1.00 0.00 H TER 95217 WAT 6384 ATOM 95217 O WAT 6385 37.102 19.182 13.054 1.00 0.00 O ATOM 95218 H1 WAT 6385 37.116 20.084 12.735 1.00 0.00 H ATOM 95219 H2 WAT 6385 38.025 18.938 13.125 1.00 0.00 H TER 95221 WAT 6385 ATOM 95221 O WAT 6386 28.293 90.279 18.465 1.00 0.00 O ATOM 95222 H1 WAT 6386 28.631 89.623 19.075 1.00 0.00 H ATOM 95223 H2 WAT 6386 27.955 90.976 19.027 1.00 0.00 H TER 95225 WAT 6386 ATOM 95225 O WAT 6387 94.677 110.433 152.022 1.00 0.00 O ATOM 95226 H1 WAT 6387 94.107 109.730 152.331 1.00 0.00 H ATOM 95227 H2 WAT 6387 94.146 111.226 152.101 1.00 0.00 H TER 95229 WAT 6387 ATOM 95229 O WAT 6388 98.415 55.727 80.881 1.00 0.00 O ATOM 95230 H1 WAT 6388 99.308 55.960 80.627 1.00 0.00 H ATOM 95231 H2 WAT 6388 98.286 54.848 80.522 1.00 0.00 H TER 95233 WAT 6388 ATOM 95233 O WAT 6389 20.996 83.612 90.744 1.00 0.00 O ATOM 95234 H1 WAT 6389 20.569 82.794 90.490 1.00 0.00 H ATOM 95235 H2 WAT 6389 20.613 83.829 91.594 1.00 0.00 H TER 95237 WAT 6389 ATOM 95237 O WAT 6390 88.416 74.180 9.935 1.00 0.00 O ATOM 95238 H1 WAT 6390 88.758 73.492 9.365 1.00 0.00 H ATOM 95239 H2 WAT 6390 88.959 74.132 10.722 1.00 0.00 H TER 95241 WAT 6390 ATOM 95241 O WAT 6391 95.946 40.202 83.468 1.00 0.00 O ATOM 95242 H1 WAT 6391 96.402 39.442 83.830 1.00 0.00 H ATOM 95243 H2 WAT 6391 95.487 39.862 82.700 1.00 0.00 H TER 95245 WAT 6391 ATOM 95245 O WAT 6392 23.510 128.116 11.659 1.00 0.00 O ATOM 95246 H1 WAT 6392 23.844 127.717 12.463 1.00 0.00 H ATOM 95247 H2 WAT 6392 23.925 128.978 11.631 1.00 0.00 H TER 95249 WAT 6392 ATOM 95249 O WAT 6393 12.151 124.871 12.297 1.00 0.00 O ATOM 95250 H1 WAT 6393 11.847 124.160 11.732 1.00 0.00 H ATOM 95251 H2 WAT 6393 12.911 125.232 11.840 1.00 0.00 H TER 95253 WAT 6393 ATOM 95253 O WAT 6394 44.679 109.100 115.479 1.00 0.00 O ATOM 95254 H1 WAT 6394 43.727 109.035 115.541 1.00 0.00 H ATOM 95255 H2 WAT 6394 44.857 110.040 115.499 1.00 0.00 H TER 95257 WAT 6394 ATOM 95257 O WAT 6395 15.254 117.770 61.586 1.00 0.00 O ATOM 95258 H1 WAT 6395 15.554 117.614 60.690 1.00 0.00 H ATOM 95259 H2 WAT 6395 14.980 116.908 61.900 1.00 0.00 H TER 95261 WAT 6395 ATOM 95261 O WAT 6396 70.668 75.473 14.023 1.00 0.00 O ATOM 95262 H1 WAT 6396 70.755 76.296 14.504 1.00 0.00 H ATOM 95263 H2 WAT 6396 71.063 74.817 14.597 1.00 0.00 H TER 95265 WAT 6396 ATOM 95265 O WAT 6397 119.598 45.727 147.065 1.00 0.00 O ATOM 95266 H1 WAT 6397 119.168 46.258 146.395 1.00 0.00 H ATOM 95267 H2 WAT 6397 119.983 46.365 147.666 1.00 0.00 H TER 95269 WAT 6397 ATOM 95269 O WAT 6398 142.460 130.176 88.595 1.00 0.00 O ATOM 95270 H1 WAT 6398 142.855 130.829 89.172 1.00 0.00 H ATOM 95271 H2 WAT 6398 143.189 129.612 88.336 1.00 0.00 H TER 95273 WAT 6398 ATOM 95273 O WAT 6399 62.296 124.753 99.168 1.00 0.00 O ATOM 95274 H1 WAT 6399 62.606 125.219 99.944 1.00 0.00 H ATOM 95275 H2 WAT 6399 63.088 124.587 98.656 1.00 0.00 H TER 95277 WAT 6399 ATOM 95277 O WAT 6400 39.010 60.598 111.540 1.00 0.00 O ATOM 95278 H1 WAT 6400 39.854 60.333 111.174 1.00 0.00 H ATOM 95279 H2 WAT 6400 38.749 59.865 112.097 1.00 0.00 H TER 95281 WAT 6400 ATOM 95281 O WAT 6401 41.064 107.616 97.877 1.00 0.00 O ATOM 95282 H1 WAT 6401 40.484 107.793 97.136 1.00 0.00 H ATOM 95283 H2 WAT 6401 41.597 108.407 97.958 1.00 0.00 H TER 95285 WAT 6401 ATOM 95285 O WAT 6402 86.320 55.194 117.331 1.00 0.00 O ATOM 95286 H1 WAT 6402 86.500 55.203 118.271 1.00 0.00 H ATOM 95287 H2 WAT 6402 86.737 55.989 116.999 1.00 0.00 H TER 95289 WAT 6402 ATOM 95289 O WAT 6403 145.852 5.773 142.040 1.00 0.00 O ATOM 95290 H1 WAT 6403 145.472 5.341 141.275 1.00 0.00 H ATOM 95291 H2 WAT 6403 145.125 6.262 142.424 1.00 0.00 H TER 95293 WAT 6403 ATOM 95293 O WAT 6404 117.377 72.681 87.680 1.00 0.00 O ATOM 95294 H1 WAT 6404 118.132 72.882 88.233 1.00 0.00 H ATOM 95295 H2 WAT 6404 116.638 72.649 88.287 1.00 0.00 H TER 95297 WAT 6404 ATOM 95297 O WAT 6405 136.368 11.753 118.255 1.00 0.00 O ATOM 95298 H1 WAT 6405 137.123 11.183 118.110 1.00 0.00 H ATOM 95299 H2 WAT 6405 135.861 11.310 118.935 1.00 0.00 H TER 95301 WAT 6405 ATOM 95301 O WAT 6406 32.562 118.447 69.494 1.00 0.00 O ATOM 95302 H1 WAT 6406 32.374 118.196 70.398 1.00 0.00 H ATOM 95303 H2 WAT 6406 33.318 117.914 69.249 1.00 0.00 H TER 95305 WAT 6406 ATOM 95305 O WAT 6407 109.488 68.980 103.257 1.00 0.00 O ATOM 95306 H1 WAT 6407 108.589 68.909 102.935 1.00 0.00 H ATOM 95307 H2 WAT 6407 109.597 68.221 103.830 1.00 0.00 H TER 95309 WAT 6407 ATOM 95309 O WAT 6408 3.333 67.866 129.630 1.00 0.00 O ATOM 95310 H1 WAT 6408 3.325 68.540 128.951 1.00 0.00 H ATOM 95311 H2 WAT 6408 4.215 67.498 129.592 1.00 0.00 H TER 95313 WAT 6408 ATOM 95313 O WAT 6409 62.120 73.684 144.983 1.00 0.00 O ATOM 95314 H1 WAT 6409 61.784 73.161 144.255 1.00 0.00 H ATOM 95315 H2 WAT 6409 61.727 73.290 145.762 1.00 0.00 H TER 95317 WAT 6409 ATOM 95317 O WAT 6410 5.980 54.989 102.685 1.00 0.00 O ATOM 95318 H1 WAT 6410 5.276 54.665 102.124 1.00 0.00 H ATOM 95319 H2 WAT 6410 5.920 55.942 102.618 1.00 0.00 H TER 95321 WAT 6410 ATOM 95321 O WAT 6411 54.558 42.722 80.229 1.00 0.00 O ATOM 95322 H1 WAT 6411 55.399 42.267 80.182 1.00 0.00 H ATOM 95323 H2 WAT 6411 54.614 43.246 81.028 1.00 0.00 H TER 95325 WAT 6411 ATOM 95325 O WAT 6412 95.405 26.856 99.367 1.00 0.00 O ATOM 95326 H1 WAT 6412 94.822 27.577 99.130 1.00 0.00 H ATOM 95327 H2 WAT 6412 96.283 27.182 99.168 1.00 0.00 H TER 95329 WAT 6412 ATOM 95329 O WAT 6413 25.431 18.738 148.208 1.00 0.00 O ATOM 95330 H1 WAT 6413 24.961 18.069 148.706 1.00 0.00 H ATOM 95331 H2 WAT 6413 26.178 18.274 147.831 1.00 0.00 H TER 95333 WAT 6413 ATOM 95333 O WAT 6414 11.751 55.580 88.997 1.00 0.00 O ATOM 95334 H1 WAT 6414 11.348 55.577 88.128 1.00 0.00 H ATOM 95335 H2 WAT 6414 12.634 55.242 88.852 1.00 0.00 H TER 95337 WAT 6414 ATOM 95337 O WAT 6415 72.785 49.162 61.834 1.00 0.00 O ATOM 95338 H1 WAT 6415 72.766 49.988 61.350 1.00 0.00 H ATOM 95339 H2 WAT 6415 73.661 49.129 62.218 1.00 0.00 H TER 95341 WAT 6415 ATOM 95341 O WAT 6416 96.754 112.098 112.725 1.00 0.00 O ATOM 95342 H1 WAT 6416 95.808 112.190 112.608 1.00 0.00 H ATOM 95343 H2 WAT 6416 96.854 111.296 113.238 1.00 0.00 H TER 95345 WAT 6416 ATOM 95345 O WAT 6417 70.173 62.857 124.331 1.00 0.00 O ATOM 95346 H1 WAT 6417 70.539 63.484 124.955 1.00 0.00 H ATOM 95347 H2 WAT 6417 69.599 63.382 123.773 1.00 0.00 H TER 95349 WAT 6417 ATOM 95349 O WAT 6418 95.541 91.796 109.569 1.00 0.00 O ATOM 95350 H1 WAT 6418 94.943 91.110 109.272 1.00 0.00 H ATOM 95351 H2 WAT 6418 96.171 91.339 110.126 1.00 0.00 H TER 95353 WAT 6418 ATOM 95353 O WAT 6419 57.676 117.299 147.293 1.00 0.00 O ATOM 95354 H1 WAT 6419 57.360 118.044 147.804 1.00 0.00 H ATOM 95355 H2 WAT 6419 56.889 116.939 146.883 1.00 0.00 H TER 95357 WAT 6419 ATOM 95357 O WAT 6420 69.578 92.656 67.782 1.00 0.00 O ATOM 95358 H1 WAT 6420 69.703 92.280 68.653 1.00 0.00 H ATOM 95359 H2 WAT 6420 69.715 93.596 67.905 1.00 0.00 H TER 95361 WAT 6420 ATOM 95361 O WAT 6421 118.909 10.955 4.989 1.00 0.00 O ATOM 95362 H1 WAT 6421 119.762 10.591 4.752 1.00 0.00 H ATOM 95363 H2 WAT 6421 119.001 11.896 4.839 1.00 0.00 H TER 95365 WAT 6421 ATOM 95365 O WAT 6422 50.506 30.560 155.779 1.00 0.00 O ATOM 95366 H1 WAT 6422 51.071 30.427 155.018 1.00 0.00 H ATOM 95367 H2 WAT 6422 50.970 30.134 156.500 1.00 0.00 H TER 95369 WAT 6422 ATOM 95369 O WAT 6423 111.465 74.218 76.600 1.00 0.00 O ATOM 95370 H1 WAT 6423 111.849 73.387 76.880 1.00 0.00 H ATOM 95371 H2 WAT 6423 110.843 73.975 75.914 1.00 0.00 H TER 95373 WAT 6423 ATOM 95373 O WAT 6424 38.873 4.450 110.449 1.00 0.00 O ATOM 95374 H1 WAT 6424 39.393 3.756 110.855 1.00 0.00 H ATOM 95375 H2 WAT 6424 38.031 4.038 110.257 1.00 0.00 H TER 95377 WAT 6424 ATOM 95377 O WAT 6425 95.068 93.484 18.065 1.00 0.00 O ATOM 95378 H1 WAT 6425 95.215 94.301 18.541 1.00 0.00 H ATOM 95379 H2 WAT 6425 94.933 93.756 17.157 1.00 0.00 H TER 95381 WAT 6425 ATOM 95381 O WAT 6426 117.559 131.834 78.879 1.00 0.00 O ATOM 95382 H1 WAT 6426 117.500 130.881 78.815 1.00 0.00 H ATOM 95383 H2 WAT 6426 118.231 131.988 79.544 1.00 0.00 H TER 95385 WAT 6426 ATOM 95385 O WAT 6427 127.738 34.664 11.090 1.00 0.00 O ATOM 95386 H1 WAT 6427 127.619 34.577 12.035 1.00 0.00 H ATOM 95387 H2 WAT 6427 127.011 35.219 10.807 1.00 0.00 H TER 95389 WAT 6427 ATOM 95389 O WAT 6428 141.822 89.045 14.904 1.00 0.00 O ATOM 95390 H1 WAT 6428 141.253 88.494 14.366 1.00 0.00 H ATOM 95391 H2 WAT 6428 141.757 89.914 14.508 1.00 0.00 H TER 95393 WAT 6428 ATOM 95393 O WAT 6429 90.947 38.205 20.886 1.00 0.00 O ATOM 95394 H1 WAT 6429 90.439 39.017 20.869 1.00 0.00 H ATOM 95395 H2 WAT 6429 91.847 38.482 20.714 1.00 0.00 H TER 95397 WAT 6429 ATOM 95397 O WAT 6430 70.932 46.390 13.091 1.00 0.00 O ATOM 95398 H1 WAT 6430 70.262 46.784 12.532 1.00 0.00 H ATOM 95399 H2 WAT 6430 70.620 45.498 13.246 1.00 0.00 H TER 95401 WAT 6430 ATOM 95401 O WAT 6431 6.645 56.606 132.022 1.00 0.00 O ATOM 95402 H1 WAT 6431 6.313 57.502 131.955 1.00 0.00 H ATOM 95403 H2 WAT 6431 6.834 56.490 132.953 1.00 0.00 H TER 95405 WAT 6431 ATOM 95405 O WAT 6432 11.386 118.629 108.503 1.00 0.00 O ATOM 95406 H1 WAT 6432 11.103 118.497 109.408 1.00 0.00 H ATOM 95407 H2 WAT 6432 12.305 118.887 108.574 1.00 0.00 H TER 95409 WAT 6432 ATOM 95409 O WAT 6433 89.303 126.152 12.051 1.00 0.00 O ATOM 95410 H1 WAT 6433 89.114 126.132 12.989 1.00 0.00 H ATOM 95411 H2 WAT 6433 90.049 126.746 11.969 1.00 0.00 H TER 95413 WAT 6433 ATOM 95413 O WAT 6434 2.394 95.157 141.684 1.00 0.00 O ATOM 95414 H1 WAT 6434 2.316 94.209 141.575 1.00 0.00 H ATOM 95415 H2 WAT 6434 3.296 95.292 141.975 1.00 0.00 H TER 95417 WAT 6434 ATOM 95417 O WAT 6435 2.580 124.021 133.842 1.00 0.00 O ATOM 95418 H1 WAT 6435 1.860 124.180 134.452 1.00 0.00 H ATOM 95419 H2 WAT 6435 2.216 123.417 133.195 1.00 0.00 H TER 95421 WAT 6435 ATOM 95421 O WAT 6436 66.920 44.882 11.714 1.00 0.00 O ATOM 95422 H1 WAT 6436 67.136 44.000 12.017 1.00 0.00 H ATOM 95423 H2 WAT 6436 66.159 45.134 12.237 1.00 0.00 H TER 95425 WAT 6436 ATOM 95425 O WAT 6437 24.328 103.370 120.471 1.00 0.00 O ATOM 95426 H1 WAT 6437 24.744 104.006 119.889 1.00 0.00 H ATOM 95427 H2 WAT 6437 23.393 103.569 120.414 1.00 0.00 H TER 95429 WAT 6437 ATOM 95429 O WAT 6438 98.282 62.752 129.634 1.00 0.00 O ATOM 95430 H1 WAT 6438 97.677 63.310 130.123 1.00 0.00 H ATOM 95431 H2 WAT 6438 98.413 61.989 130.196 1.00 0.00 H TER 95433 WAT 6438 ATOM 95433 O WAT 6439 0.510 51.642 72.683 1.00 0.00 O ATOM 95434 H1 WAT 6439 -0.409 51.560 72.430 1.00 0.00 H ATOM 95435 H2 WAT 6439 0.770 50.755 72.931 1.00 0.00 H TER 95437 WAT 6439 ATOM 95437 O WAT 6440 31.962 5.316 110.789 1.00 0.00 O ATOM 95438 H1 WAT 6440 32.763 5.454 111.295 1.00 0.00 H ATOM 95439 H2 WAT 6440 31.676 4.434 111.029 1.00 0.00 H TER 95441 WAT 6440 ATOM 95441 O WAT 6441 87.889 104.076 108.068 1.00 0.00 O ATOM 95442 H1 WAT 6441 87.857 103.862 109.000 1.00 0.00 H ATOM 95443 H2 WAT 6441 87.438 103.349 107.639 1.00 0.00 H TER 95445 WAT 6441 ATOM 95445 O WAT 6442 1.226 137.805 80.592 1.00 0.00 O ATOM 95446 H1 WAT 6442 0.876 136.937 80.793 1.00 0.00 H ATOM 95447 H2 WAT 6442 1.295 138.238 81.443 1.00 0.00 H TER 95449 WAT 6442 ATOM 95449 O WAT 6443 139.372 84.010 143.285 1.00 0.00 O ATOM 95450 H1 WAT 6443 138.975 84.753 143.740 1.00 0.00 H ATOM 95451 H2 WAT 6443 140.039 84.403 142.722 1.00 0.00 H TER 95453 WAT 6443 ATOM 95453 O WAT 6444 54.677 51.696 127.101 1.00 0.00 O ATOM 95454 H1 WAT 6444 55.039 52.581 127.052 1.00 0.00 H ATOM 95455 H2 WAT 6444 53.778 51.822 127.406 1.00 0.00 H TER 95457 WAT 6444 ATOM 95457 O WAT 6445 4.255 4.027 60.851 1.00 0.00 O ATOM 95458 H1 WAT 6445 3.315 4.172 60.746 1.00 0.00 H ATOM 95459 H2 WAT 6445 4.388 3.115 60.592 1.00 0.00 H TER 95461 WAT 6445 ATOM 95461 O WAT 6446 63.184 45.304 64.201 1.00 0.00 O ATOM 95462 H1 WAT 6446 63.476 44.434 64.472 1.00 0.00 H ATOM 95463 H2 WAT 6446 63.825 45.579 63.546 1.00 0.00 H TER 95465 WAT 6446 ATOM 95465 O WAT 6447 84.017 129.493 97.490 1.00 0.00 O ATOM 95466 H1 WAT 6447 84.502 130.130 98.015 1.00 0.00 H ATOM 95467 H2 WAT 6447 84.694 128.981 97.048 1.00 0.00 H TER 95469 WAT 6447 ATOM 95469 O WAT 6448 95.403 45.915 17.389 1.00 0.00 O ATOM 95470 H1 WAT 6448 95.883 46.587 16.905 1.00 0.00 H ATOM 95471 H2 WAT 6448 94.501 45.994 17.078 1.00 0.00 H TER 95473 WAT 6448 ATOM 95473 O WAT 6449 95.626 16.368 66.781 1.00 0.00 O ATOM 95474 H1 WAT 6449 95.738 16.603 65.860 1.00 0.00 H ATOM 95475 H2 WAT 6449 96.510 16.164 67.086 1.00 0.00 H TER 95477 WAT 6449 ATOM 95477 O WAT 6450 64.467 65.979 147.460 1.00 0.00 O ATOM 95478 H1 WAT 6450 64.095 65.788 148.321 1.00 0.00 H ATOM 95479 H2 WAT 6450 64.667 66.914 147.487 1.00 0.00 H TER 95481 WAT 6450 ATOM 95481 O WAT 6451 140.816 102.899 18.708 1.00 0.00 O ATOM 95482 H1 WAT 6451 141.365 103.682 18.683 1.00 0.00 H ATOM 95483 H2 WAT 6451 141.315 102.241 18.223 1.00 0.00 H TER 95485 WAT 6451 ATOM 95485 O WAT 6452 115.994 44.621 13.706 1.00 0.00 O ATOM 95486 H1 WAT 6452 115.140 44.883 14.050 1.00 0.00 H ATOM 95487 H2 WAT 6452 116.577 44.647 14.465 1.00 0.00 H TER 95489 WAT 6452 ATOM 95489 O WAT 6453 90.931 1.959 100.852 1.00 0.00 O ATOM 95490 H1 WAT 6453 90.376 1.305 101.278 1.00 0.00 H ATOM 95491 H2 WAT 6453 91.539 1.447 100.318 1.00 0.00 H TER 95493 WAT 6453 ATOM 95493 O WAT 6454 99.392 140.952 134.621 1.00 0.00 O ATOM 95494 H1 WAT 6454 98.871 141.160 135.397 1.00 0.00 H ATOM 95495 H2 WAT 6454 98.979 141.448 133.915 1.00 0.00 H TER 95497 WAT 6454 ATOM 95497 O WAT 6455 39.863 52.352 101.616 1.00 0.00 O ATOM 95498 H1 WAT 6455 39.360 52.321 100.803 1.00 0.00 H ATOM 95499 H2 WAT 6455 40.592 52.943 101.426 1.00 0.00 H TER 95501 WAT 6455 ATOM 95501 O WAT 6456 99.604 47.847 114.154 1.00 0.00 O ATOM 95502 H1 WAT 6456 100.207 48.567 113.969 1.00 0.00 H ATOM 95503 H2 WAT 6456 100.132 47.213 114.640 1.00 0.00 H TER 95505 WAT 6456 ATOM 95505 O WAT 6457 119.341 115.451 98.263 1.00 0.00 O ATOM 95506 H1 WAT 6457 119.176 115.770 97.376 1.00 0.00 H ATOM 95507 H2 WAT 6457 119.266 114.499 98.193 1.00 0.00 H TER 95509 WAT 6457 ATOM 95509 O WAT 6458 8.136 73.626 109.031 1.00 0.00 O ATOM 95510 H1 WAT 6458 8.455 73.548 109.930 1.00 0.00 H ATOM 95511 H2 WAT 6458 7.764 74.507 108.985 1.00 0.00 H TER 95513 WAT 6458 ATOM 95513 O WAT 6459 105.315 89.021 155.342 1.00 0.00 O ATOM 95514 H1 WAT 6459 105.717 89.854 155.093 1.00 0.00 H ATOM 95515 H2 WAT 6459 106.049 88.476 155.625 1.00 0.00 H TER 95517 WAT 6459 ATOM 95517 O WAT 6460 50.452 34.974 20.301 1.00 0.00 O ATOM 95518 H1 WAT 6460 51.098 35.152 20.984 1.00 0.00 H ATOM 95519 H2 WAT 6460 50.972 34.720 19.539 1.00 0.00 H TER 95521 WAT 6460 ATOM 95521 O WAT 6461 18.591 41.908 59.184 1.00 0.00 O ATOM 95522 H1 WAT 6461 18.409 41.061 59.590 1.00 0.00 H ATOM 95523 H2 WAT 6461 18.586 41.729 58.244 1.00 0.00 H TER 95525 WAT 6461 ATOM 95525 O WAT 6462 58.113 53.000 71.757 1.00 0.00 O ATOM 95526 H1 WAT 6462 59.045 52.898 71.949 1.00 0.00 H ATOM 95527 H2 WAT 6462 57.669 52.641 72.525 1.00 0.00 H TER 95529 WAT 6462 ATOM 95529 O WAT 6463 112.903 100.411 7.069 1.00 0.00 O ATOM 95530 H1 WAT 6463 113.846 100.257 7.125 1.00 0.00 H ATOM 95531 H2 WAT 6463 112.525 99.543 6.933 1.00 0.00 H TER 95533 WAT 6463 ATOM 95533 O WAT 6464 145.545 137.235 21.525 1.00 0.00 O ATOM 95534 H1 WAT 6464 145.718 136.416 21.061 1.00 0.00 H ATOM 95535 H2 WAT 6464 145.387 136.968 22.431 1.00 0.00 H TER 95537 WAT 6464 ATOM 95537 O WAT 6465 5.931 66.817 112.209 1.00 0.00 O ATOM 95538 H1 WAT 6465 5.554 66.424 111.421 1.00 0.00 H ATOM 95539 H2 WAT 6465 5.671 66.228 112.918 1.00 0.00 H TER 95541 WAT 6465 ATOM 95541 O WAT 6466 125.089 113.911 104.991 1.00 0.00 O ATOM 95542 H1 WAT 6466 125.009 114.519 105.727 1.00 0.00 H ATOM 95543 H2 WAT 6466 124.711 113.093 105.315 1.00 0.00 H TER 95545 WAT 6466 ATOM 95545 O WAT 6467 1.020 71.827 68.524 1.00 0.00 O ATOM 95546 H1 WAT 6467 0.183 71.608 68.932 1.00 0.00 H ATOM 95547 H2 WAT 6467 1.521 72.253 69.219 1.00 0.00 H TER 95549 WAT 6467 ATOM 95549 O WAT 6468 118.086 136.444 15.592 1.00 0.00 O ATOM 95550 H1 WAT 6468 118.021 135.593 16.027 1.00 0.00 H ATOM 95551 H2 WAT 6468 117.879 137.079 16.277 1.00 0.00 H TER 95553 WAT 6468 ATOM 95553 O WAT 6469 129.194 133.566 27.072 1.00 0.00 O ATOM 95554 H1 WAT 6469 128.716 133.650 26.247 1.00 0.00 H ATOM 95555 H2 WAT 6469 129.582 134.430 27.214 1.00 0.00 H TER 95557 WAT 6469 ATOM 95557 O WAT 6470 65.912 26.835 74.893 1.00 0.00 O ATOM 95558 H1 WAT 6470 66.452 26.956 75.674 1.00 0.00 H ATOM 95559 H2 WAT 6470 66.004 25.907 74.680 1.00 0.00 H TER 95561 WAT 6470 ATOM 95561 O WAT 6471 37.547 33.931 85.612 1.00 0.00 O ATOM 95562 H1 WAT 6471 38.373 33.451 85.673 1.00 0.00 H ATOM 95563 H2 WAT 6471 37.725 34.769 86.040 1.00 0.00 H TER 95565 WAT 6471 ATOM 95565 O WAT 6472 42.401 103.582 156.004 1.00 0.00 O ATOM 95566 H1 WAT 6472 43.015 103.006 155.549 1.00 0.00 H ATOM 95567 H2 WAT 6472 42.728 104.465 155.831 1.00 0.00 H TER 95569 WAT 6472 ATOM 95569 O WAT 6473 131.144 95.038 64.618 1.00 0.00 O ATOM 95570 H1 WAT 6473 131.950 95.520 64.433 1.00 0.00 H ATOM 95571 H2 WAT 6473 131.339 94.542 65.413 1.00 0.00 H TER 95573 WAT 6473 ATOM 95573 O WAT 6474 114.665 16.506 50.001 1.00 0.00 O ATOM 95574 H1 WAT 6474 115.231 15.796 50.304 1.00 0.00 H ATOM 95575 H2 WAT 6474 115.248 17.261 49.923 1.00 0.00 H TER 95577 WAT 6474 ATOM 95577 O WAT 6475 48.859 118.788 73.397 1.00 0.00 O ATOM 95578 H1 WAT 6475 49.648 118.502 72.938 1.00 0.00 H ATOM 95579 H2 WAT 6475 48.280 119.104 72.704 1.00 0.00 H TER 95581 WAT 6475 ATOM 95581 O WAT 6476 52.507 98.414 80.908 1.00 0.00 O ATOM 95582 H1 WAT 6476 52.498 98.367 79.952 1.00 0.00 H ATOM 95583 H2 WAT 6476 52.211 99.302 81.107 1.00 0.00 H TER 95585 WAT 6476 ATOM 95585 O WAT 6477 39.412 18.636 17.151 1.00 0.00 O ATOM 95586 H1 WAT 6477 39.748 17.745 17.253 1.00 0.00 H ATOM 95587 H2 WAT 6477 39.959 19.021 16.466 1.00 0.00 H TER 95589 WAT 6477 ATOM 95589 O WAT 6478 115.684 105.353 15.250 1.00 0.00 O ATOM 95590 H1 WAT 6478 115.429 105.388 16.172 1.00 0.00 H ATOM 95591 H2 WAT 6478 116.614 105.128 15.267 1.00 0.00 H TER 95593 WAT 6478 ATOM 95593 O WAT 6479 67.815 66.849 129.986 1.00 0.00 O ATOM 95594 H1 WAT 6479 67.398 65.989 130.021 1.00 0.00 H ATOM 95595 H2 WAT 6479 67.455 67.258 129.199 1.00 0.00 H TER 95597 WAT 6479 ATOM 95597 O WAT 6480 139.293 72.161 142.760 1.00 0.00 O ATOM 95598 H1 WAT 6480 138.872 72.925 142.365 1.00 0.00 H ATOM 95599 H2 WAT 6480 139.769 72.513 143.513 1.00 0.00 H TER 95601 WAT 6480 ATOM 95601 O WAT 6481 123.534 66.017 110.714 1.00 0.00 O ATOM 95602 H1 WAT 6481 123.838 65.143 110.959 1.00 0.00 H ATOM 95603 H2 WAT 6481 122.617 66.037 110.988 1.00 0.00 H TER 95605 WAT 6481 ATOM 95605 O WAT 6482 35.061 131.451 110.298 1.00 0.00 O ATOM 95606 H1 WAT 6482 35.817 131.133 109.803 1.00 0.00 H ATOM 95607 H2 WAT 6482 34.605 132.033 109.691 1.00 0.00 H TER 95609 WAT 6482 ATOM 95609 O WAT 6483 136.352 95.396 88.602 1.00 0.00 O ATOM 95610 H1 WAT 6483 136.383 95.897 89.417 1.00 0.00 H ATOM 95611 H2 WAT 6483 136.996 95.820 88.035 1.00 0.00 H TER 95613 WAT 6483 ATOM 95613 O WAT 6484 96.002 25.015 55.476 1.00 0.00 O ATOM 95614 H1 WAT 6484 96.254 25.845 55.072 1.00 0.00 H ATOM 95615 H2 WAT 6484 95.087 24.893 55.223 1.00 0.00 H TER 95617 WAT 6484 ATOM 95617 O WAT 6485 18.755 75.243 64.415 1.00 0.00 O ATOM 95618 H1 WAT 6485 19.681 75.274 64.178 1.00 0.00 H ATOM 95619 H2 WAT 6485 18.421 76.112 64.194 1.00 0.00 H TER 95621 WAT 6485 ATOM 95621 O WAT 6486 111.053 54.777 4.117 1.00 0.00 O ATOM 95622 H1 WAT 6486 110.354 55.178 4.634 1.00 0.00 H ATOM 95623 H2 WAT 6486 111.464 54.151 4.713 1.00 0.00 H TER 95625 WAT 6486 ATOM 95625 O WAT 6487 88.563 18.460 81.156 1.00 0.00 O ATOM 95626 H1 WAT 6487 88.299 17.559 80.973 1.00 0.00 H ATOM 95627 H2 WAT 6487 88.816 18.453 82.080 1.00 0.00 H TER 95629 WAT 6487 ATOM 95629 O WAT 6488 135.823 29.900 88.405 1.00 0.00 O ATOM 95630 H1 WAT 6488 135.881 30.096 89.340 1.00 0.00 H ATOM 95631 H2 WAT 6488 135.945 30.747 87.976 1.00 0.00 H TER 95633 WAT 6488 ATOM 95633 O WAT 6489 103.477 115.748 119.451 1.00 0.00 O ATOM 95634 H1 WAT 6489 103.913 114.905 119.330 1.00 0.00 H ATOM 95635 H2 WAT 6489 104.167 116.397 119.310 1.00 0.00 H TER 95637 WAT 6489 ATOM 95637 O WAT 6490 90.965 54.953 152.524 1.00 0.00 O ATOM 95638 H1 WAT 6490 91.286 55.630 153.119 1.00 0.00 H ATOM 95639 H2 WAT 6490 90.044 55.173 152.385 1.00 0.00 H TER 95641 WAT 6490 ATOM 95641 O WAT 6491 62.757 91.993 137.313 1.00 0.00 O ATOM 95642 H1 WAT 6491 62.633 91.124 137.694 1.00 0.00 H ATOM 95643 H2 WAT 6491 61.904 92.417 137.400 1.00 0.00 H TER 95645 WAT 6491 ATOM 95645 O WAT 6492 135.724 72.641 123.226 1.00 0.00 O ATOM 95646 H1 WAT 6492 134.940 73.082 122.900 1.00 0.00 H ATOM 95647 H2 WAT 6492 135.395 72.004 123.860 1.00 0.00 H TER 95649 WAT 6492 ATOM 95649 O WAT 6493 12.950 117.783 95.765 1.00 0.00 O ATOM 95650 H1 WAT 6493 13.118 118.483 95.134 1.00 0.00 H ATOM 95651 H2 WAT 6493 13.388 118.072 96.565 1.00 0.00 H TER 95653 WAT 6493 ATOM 95653 O WAT 6494 61.175 41.130 59.608 1.00 0.00 O ATOM 95654 H1 WAT 6494 61.294 40.439 58.957 1.00 0.00 H ATOM 95655 H2 WAT 6494 61.384 41.938 59.140 1.00 0.00 H TER 95657 WAT 6494 ATOM 95657 O WAT 6495 12.587 72.602 9.318 1.00 0.00 O ATOM 95658 H1 WAT 6495 13.231 73.065 8.782 1.00 0.00 H ATOM 95659 H2 WAT 6495 12.758 72.902 10.211 1.00 0.00 H TER 95661 WAT 6495 ATOM 95661 O WAT 6496 56.647 144.219 131.269 1.00 0.00 O ATOM 95662 H1 WAT 6496 57.071 143.562 130.717 1.00 0.00 H ATOM 95663 H2 WAT 6496 56.088 143.712 131.858 1.00 0.00 H TER 95665 WAT 6496 ATOM 95665 O WAT 6497 76.114 35.907 155.110 1.00 0.00 O ATOM 95666 H1 WAT 6497 75.775 35.492 155.904 1.00 0.00 H ATOM 95667 H2 WAT 6497 76.919 35.426 154.914 1.00 0.00 H TER 95669 WAT 6497 ATOM 95669 O WAT 6498 47.828 36.597 82.502 1.00 0.00 O ATOM 95670 H1 WAT 6498 48.172 37.035 83.280 1.00 0.00 H ATOM 95671 H2 WAT 6498 47.754 35.678 82.758 1.00 0.00 H TER 95673 WAT 6498 ATOM 95673 O WAT 6499 16.343 84.314 76.400 1.00 0.00 O ATOM 95674 H1 WAT 6499 15.490 84.507 76.010 1.00 0.00 H ATOM 95675 H2 WAT 6499 16.926 84.985 76.045 1.00 0.00 H TER 95677 WAT 6499 ATOM 95677 O WAT 6500 121.055 2.729 121.781 1.00 0.00 O ATOM 95678 H1 WAT 6500 121.548 3.545 121.699 1.00 0.00 H ATOM 95679 H2 WAT 6500 121.472 2.269 122.510 1.00 0.00 H TER 95681 WAT 6500 ATOM 95681 O WAT 6501 122.816 122.282 15.597 1.00 0.00 O ATOM 95682 H1 WAT 6501 122.764 121.407 15.982 1.00 0.00 H ATOM 95683 H2 WAT 6501 123.424 122.186 14.864 1.00 0.00 H TER 95685 WAT 6501 ATOM 95685 O WAT 6502 71.960 73.123 100.017 1.00 0.00 O ATOM 95686 H1 WAT 6502 72.347 73.785 99.443 1.00 0.00 H ATOM 95687 H2 WAT 6502 72.529 72.360 99.920 1.00 0.00 H TER 95689 WAT 6502 ATOM 95689 O WAT 6503 60.157 55.759 142.370 1.00 0.00 O ATOM 95690 H1 WAT 6503 60.440 56.487 141.817 1.00 0.00 H ATOM 95691 H2 WAT 6503 60.324 56.057 143.264 1.00 0.00 H TER 95693 WAT 6503 ATOM 95693 O WAT 6504 135.745 22.737 139.505 1.00 0.00 O ATOM 95694 H1 WAT 6504 135.247 22.145 140.069 1.00 0.00 H ATOM 95695 H2 WAT 6504 135.218 22.811 138.710 1.00 0.00 H TER 95697 WAT 6504 ATOM 95697 O WAT 6505 72.228 100.533 84.449 1.00 0.00 O ATOM 95698 H1 WAT 6505 72.186 99.733 83.924 1.00 0.00 H ATOM 95699 H2 WAT 6505 72.306 101.237 83.805 1.00 0.00 H TER 95701 WAT 6505 ATOM 95701 O WAT 6506 48.568 28.138 58.817 1.00 0.00 O ATOM 95702 H1 WAT 6506 48.510 27.299 58.362 1.00 0.00 H ATOM 95703 H2 WAT 6506 48.207 28.773 58.198 1.00 0.00 H TER 95705 WAT 6506 ATOM 95705 O WAT 6507 119.522 12.269 70.247 1.00 0.00 O ATOM 95706 H1 WAT 6507 119.845 13.132 69.989 1.00 0.00 H ATOM 95707 H2 WAT 6507 118.595 12.279 70.006 1.00 0.00 H TER 95709 WAT 6507 ATOM 95709 O WAT 6508 43.099 31.990 150.440 1.00 0.00 O ATOM 95710 H1 WAT 6508 43.266 31.113 150.785 1.00 0.00 H ATOM 95711 H2 WAT 6508 42.270 32.251 150.840 1.00 0.00 H TER 95713 WAT 6508 ATOM 95713 O WAT 6509 90.483 78.554 90.631 1.00 0.00 O ATOM 95714 H1 WAT 6509 91.110 78.240 91.282 1.00 0.00 H ATOM 95715 H2 WAT 6509 90.967 79.208 90.128 1.00 0.00 H TER 95717 WAT 6509 ATOM 95717 O WAT 6510 124.115 17.031 145.397 1.00 0.00 O ATOM 95718 H1 WAT 6510 123.543 17.025 146.165 1.00 0.00 H ATOM 95719 H2 WAT 6510 124.838 16.449 145.632 1.00 0.00 H TER 95721 WAT 6510 ATOM 95721 O WAT 6511 36.334 144.598 141.896 1.00 0.00 O ATOM 95722 H1 WAT 6511 35.768 145.182 142.401 1.00 0.00 H ATOM 95723 H2 WAT 6511 35.729 144.076 141.369 1.00 0.00 H TER 95725 WAT 6511 ATOM 95725 O WAT 6512 3.506 100.841 61.984 1.00 0.00 O ATOM 95726 H1 WAT 6512 2.724 101.388 61.903 1.00 0.00 H ATOM 95727 H2 WAT 6512 3.177 99.997 62.294 1.00 0.00 H TER 95729 WAT 6512 ATOM 95729 O WAT 6513 0.537 58.715 75.515 1.00 0.00 O ATOM 95730 H1 WAT 6513 0.424 59.571 75.929 1.00 0.00 H ATOM 95731 H2 WAT 6513 1.352 58.795 75.019 1.00 0.00 H TER 95733 WAT 6513 ATOM 95733 O WAT 6514 48.602 133.648 8.419 1.00 0.00 O ATOM 95734 H1 WAT 6514 48.591 134.054 7.552 1.00 0.00 H ATOM 95735 H2 WAT 6514 49.175 134.210 8.940 1.00 0.00 H TER 95737 WAT 6514 ATOM 95737 O WAT 6515 19.696 57.495 147.560 1.00 0.00 O ATOM 95738 H1 WAT 6515 18.910 58.009 147.371 1.00 0.00 H ATOM 95739 H2 WAT 6515 20.378 58.149 147.714 1.00 0.00 H TER 95741 WAT 6515 ATOM 95741 O WAT 6516 119.026 6.177 61.166 1.00 0.00 O ATOM 95742 H1 WAT 6516 118.140 5.815 61.165 1.00 0.00 H ATOM 95743 H2 WAT 6516 119.073 6.698 60.365 1.00 0.00 H TER 95745 WAT 6516 ATOM 95745 O WAT 6517 137.817 8.471 108.162 1.00 0.00 O ATOM 95746 H1 WAT 6517 138.699 8.308 107.828 1.00 0.00 H ATOM 95747 H2 WAT 6517 137.667 9.402 107.998 1.00 0.00 H TER 95749 WAT 6517 ATOM 95749 O WAT 6518 32.448 0.571 80.576 1.00 0.00 O ATOM 95750 H1 WAT 6518 33.184 0.002 80.800 1.00 0.00 H ATOM 95751 H2 WAT 6518 32.416 1.213 81.285 1.00 0.00 H TER 95753 WAT 6518 ATOM 95753 O WAT 6519 54.289 114.471 56.111 1.00 0.00 O ATOM 95754 H1 WAT 6519 53.606 114.270 56.751 1.00 0.00 H ATOM 95755 H2 WAT 6519 54.997 114.854 56.629 1.00 0.00 H TER 95757 WAT 6519 ATOM 95757 O WAT 6520 121.226 50.435 112.458 1.00 0.00 O ATOM 95758 H1 WAT 6520 120.625 50.666 113.167 1.00 0.00 H ATOM 95759 H2 WAT 6520 121.285 51.229 111.927 1.00 0.00 H TER 95761 WAT 6520 ATOM 95761 O WAT 6521 74.466 104.558 84.584 1.00 0.00 O ATOM 95762 H1 WAT 6521 74.600 104.072 85.398 1.00 0.00 H ATOM 95763 H2 WAT 6521 74.829 103.991 83.904 1.00 0.00 H TER 95765 WAT 6521 ATOM 95765 O WAT 6522 48.436 93.845 155.975 1.00 0.00 O ATOM 95766 H1 WAT 6522 48.278 93.040 155.483 1.00 0.00 H ATOM 95767 H2 WAT 6522 47.650 94.372 155.833 1.00 0.00 H TER 95769 WAT 6522 ATOM 95769 O WAT 6523 27.889 93.523 56.457 1.00 0.00 O ATOM 95770 H1 WAT 6523 28.729 93.878 56.168 1.00 0.00 H ATOM 95771 H2 WAT 6523 27.244 94.169 56.168 1.00 0.00 H TER 95773 WAT 6523 ATOM 95773 O WAT 6524 7.222 13.080 99.782 1.00 0.00 O ATOM 95774 H1 WAT 6524 6.412 12.861 99.320 1.00 0.00 H ATOM 95775 H2 WAT 6524 7.271 14.035 99.741 1.00 0.00 H TER 95777 WAT 6524 ATOM 95777 O WAT 6525 86.648 31.466 158.366 1.00 0.00 O ATOM 95778 H1 WAT 6525 86.392 30.774 158.976 1.00 0.00 H ATOM 95779 H2 WAT 6525 86.483 31.095 157.499 1.00 0.00 H TER 95781 WAT 6525 ATOM 95781 O WAT 6526 18.857 25.307 8.020 1.00 0.00 O ATOM 95782 H1 WAT 6526 18.253 24.655 7.663 1.00 0.00 H ATOM 95783 H2 WAT 6526 18.498 25.518 8.882 1.00 0.00 H TER 95785 WAT 6526 ATOM 95785 O WAT 6527 89.192 109.544 112.534 1.00 0.00 O ATOM 95786 H1 WAT 6527 88.766 109.781 111.710 1.00 0.00 H ATOM 95787 H2 WAT 6527 88.776 110.105 113.189 1.00 0.00 H TER 95789 WAT 6527 ATOM 95789 O WAT 6528 87.009 6.615 7.545 1.00 0.00 O ATOM 95790 H1 WAT 6528 86.308 7.172 7.208 1.00 0.00 H ATOM 95791 H2 WAT 6528 86.714 6.359 8.418 1.00 0.00 H TER 95793 WAT 6528 ATOM 95793 O WAT 6529 115.274 69.714 20.277 1.00 0.00 O ATOM 95794 H1 WAT 6529 114.620 70.223 20.756 1.00 0.00 H ATOM 95795 H2 WAT 6529 115.975 69.567 20.911 1.00 0.00 H TER 95797 WAT 6529 ATOM 95797 O WAT 6530 20.313 50.366 150.916 1.00 0.00 O ATOM 95798 H1 WAT 6530 20.940 51.060 150.709 1.00 0.00 H ATOM 95799 H2 WAT 6530 20.591 49.625 150.377 1.00 0.00 H TER 95801 WAT 6530 ATOM 95801 O WAT 6531 100.779 116.306 65.732 1.00 0.00 O ATOM 95802 H1 WAT 6531 100.092 116.405 66.391 1.00 0.00 H ATOM 95803 H2 WAT 6531 101.347 117.065 65.864 1.00 0.00 H TER 95805 WAT 6531 ATOM 95805 O WAT 6532 90.300 33.714 75.053 1.00 0.00 O ATOM 95806 H1 WAT 6532 90.578 32.805 75.161 1.00 0.00 H ATOM 95807 H2 WAT 6532 90.943 34.092 74.454 1.00 0.00 H TER 95809 WAT 6532 ATOM 95809 O WAT 6533 64.814 15.355 140.373 1.00 0.00 O ATOM 95810 H1 WAT 6533 64.670 14.670 139.720 1.00 0.00 H ATOM 95811 H2 WAT 6533 65.653 15.130 140.775 1.00 0.00 H TER 95813 WAT 6533 ATOM 95813 O WAT 6534 131.151 50.942 83.676 1.00 0.00 O ATOM 95814 H1 WAT 6534 131.320 51.241 82.783 1.00 0.00 H ATOM 95815 H2 WAT 6534 132.021 50.837 84.062 1.00 0.00 H TER 95817 WAT 6534 ATOM 95817 O WAT 6535 21.459 54.724 113.515 1.00 0.00 O ATOM 95818 H1 WAT 6535 21.807 55.607 113.640 1.00 0.00 H ATOM 95819 H2 WAT 6535 20.949 54.779 112.707 1.00 0.00 H TER 95821 WAT 6535 ATOM 95821 O WAT 6536 2.192 53.542 59.169 1.00 0.00 O ATOM 95822 H1 WAT 6536 2.178 54.497 59.105 1.00 0.00 H ATOM 95823 H2 WAT 6536 1.631 53.245 58.453 1.00 0.00 H TER 95825 WAT 6536 ATOM 95825 O WAT 6537 91.860 129.878 69.962 1.00 0.00 O ATOM 95826 H1 WAT 6537 91.420 130.500 70.543 1.00 0.00 H ATOM 95827 H2 WAT 6537 92.291 129.262 70.554 1.00 0.00 H TER 95829 WAT 6537 ATOM 95829 O WAT 6538 14.308 105.672 152.729 1.00 0.00 O ATOM 95830 H1 WAT 6538 15.053 105.954 152.199 1.00 0.00 H ATOM 95831 H2 WAT 6538 13.729 106.434 152.754 1.00 0.00 H TER 95833 WAT 6538 ATOM 95833 O WAT 6539 120.627 92.487 6.377 1.00 0.00 O ATOM 95834 H1 WAT 6539 120.465 91.732 6.942 1.00 0.00 H ATOM 95835 H2 WAT 6539 121.352 92.950 6.797 1.00 0.00 H TER 95837 WAT 6539 ATOM 95837 O WAT 6540 10.574 80.289 129.374 1.00 0.00 O ATOM 95838 H1 WAT 6540 10.261 81.139 129.065 1.00 0.00 H ATOM 95839 H2 WAT 6540 11.347 80.109 128.839 1.00 0.00 H TER 95841 WAT 6540 ATOM 95841 O WAT 6541 35.201 43.398 139.806 1.00 0.00 O ATOM 95842 H1 WAT 6541 34.364 43.795 139.566 1.00 0.00 H ATOM 95843 H2 WAT 6541 35.267 42.623 139.248 1.00 0.00 H TER 95845 WAT 6541 ATOM 95845 O WAT 6542 143.111 139.648 65.203 1.00 0.00 O ATOM 95846 H1 WAT 6542 142.474 139.643 65.918 1.00 0.00 H ATOM 95847 H2 WAT 6542 142.583 139.550 64.411 1.00 0.00 H TER 95849 WAT 6542 ATOM 95849 O WAT 6543 78.292 105.998 80.450 1.00 0.00 O ATOM 95850 H1 WAT 6543 77.987 105.108 80.629 1.00 0.00 H ATOM 95851 H2 WAT 6543 79.087 105.877 79.930 1.00 0.00 H TER 95853 WAT 6543 ATOM 95853 O WAT 6544 51.373 4.713 97.021 1.00 0.00 O ATOM 95854 H1 WAT 6544 51.348 4.602 97.972 1.00 0.00 H ATOM 95855 H2 WAT 6544 52.279 4.518 96.781 1.00 0.00 H TER 95857 WAT 6544 ATOM 95857 O WAT 6545 101.304 8.866 111.420 1.00 0.00 O ATOM 95858 H1 WAT 6545 100.530 8.969 110.867 1.00 0.00 H ATOM 95859 H2 WAT 6545 101.050 9.247 112.261 1.00 0.00 H TER 95861 WAT 6545 ATOM 95861 O WAT 6546 21.661 91.658 62.969 1.00 0.00 O ATOM 95862 H1 WAT 6546 22.267 92.368 63.183 1.00 0.00 H ATOM 95863 H2 WAT 6546 22.164 91.079 62.395 1.00 0.00 H TER 95865 WAT 6546 ATOM 95865 O WAT 6547 73.938 76.210 154.252 1.00 0.00 O ATOM 95866 H1 WAT 6547 74.819 76.583 154.245 1.00 0.00 H ATOM 95867 H2 WAT 6547 73.957 75.536 153.573 1.00 0.00 H TER 95869 WAT 6547 ATOM 95869 O WAT 6548 85.805 67.893 89.075 1.00 0.00 O ATOM 95870 H1 WAT 6548 85.393 67.768 89.930 1.00 0.00 H ATOM 95871 H2 WAT 6548 85.074 68.062 88.480 1.00 0.00 H TER 95873 WAT 6548 ATOM 95873 O WAT 6549 93.636 139.256 140.202 1.00 0.00 O ATOM 95874 H1 WAT 6549 94.203 138.631 140.654 1.00 0.00 H ATOM 95875 H2 WAT 6549 92.779 139.143 140.614 1.00 0.00 H TER 95877 WAT 6549 ATOM 95877 O WAT 6550 125.147 4.034 14.152 1.00 0.00 O ATOM 95878 H1 WAT 6550 124.710 4.874 14.291 1.00 0.00 H ATOM 95879 H2 WAT 6550 126.053 4.189 14.419 1.00 0.00 H TER 95881 WAT 6550 ATOM 95881 O WAT 6551 43.839 24.548 140.883 1.00 0.00 O ATOM 95882 H1 WAT 6551 44.459 23.937 140.484 1.00 0.00 H ATOM 95883 H2 WAT 6551 44.380 25.106 141.443 1.00 0.00 H TER 95885 WAT 6551 ATOM 95885 O WAT 6552 116.934 36.698 99.111 1.00 0.00 O ATOM 95886 H1 WAT 6552 116.965 35.742 99.141 1.00 0.00 H ATOM 95887 H2 WAT 6552 116.992 36.969 100.027 1.00 0.00 H TER 95889 WAT 6552 ATOM 95889 O WAT 6553 98.165 40.296 13.718 1.00 0.00 O ATOM 95890 H1 WAT 6553 97.821 39.472 14.062 1.00 0.00 H ATOM 95891 H2 WAT 6553 99.059 40.089 13.449 1.00 0.00 H TER 95893 WAT 6553 ATOM 95893 O WAT 6554 119.970 64.522 141.892 1.00 0.00 O ATOM 95894 H1 WAT 6554 119.840 64.801 142.799 1.00 0.00 H ATOM 95895 H2 WAT 6554 119.287 64.979 141.401 1.00 0.00 H TER 95897 WAT 6554 ATOM 95897 O WAT 6555 105.225 108.682 76.192 1.00 0.00 O ATOM 95898 H1 WAT 6555 105.494 108.577 77.105 1.00 0.00 H ATOM 95899 H2 WAT 6555 106.015 108.490 75.686 1.00 0.00 H TER 95901 WAT 6555 ATOM 95901 O WAT 6556 54.215 48.582 127.283 1.00 0.00 O ATOM 95902 H1 WAT 6556 54.661 49.429 127.286 1.00 0.00 H ATOM 95903 H2 WAT 6556 53.283 48.801 127.269 1.00 0.00 H TER 95905 WAT 6556 ATOM 95905 O WAT 6557 87.415 109.932 89.733 1.00 0.00 O ATOM 95906 H1 WAT 6557 88.185 109.561 90.163 1.00 0.00 H ATOM 95907 H2 WAT 6557 87.768 110.588 89.132 1.00 0.00 H TER 95909 WAT 6557 ATOM 95909 O WAT 6558 145.574 85.692 109.752 1.00 0.00 O ATOM 95910 H1 WAT 6558 146.151 86.455 109.718 1.00 0.00 H ATOM 95911 H2 WAT 6558 144.714 86.031 109.503 1.00 0.00 H TER 95913 WAT 6558 ATOM 95913 O WAT 6559 108.869 131.848 8.466 1.00 0.00 O ATOM 95914 H1 WAT 6559 109.780 131.768 8.181 1.00 0.00 H ATOM 95915 H2 WAT 6559 108.847 131.414 9.319 1.00 0.00 H TER 95917 WAT 6559 ATOM 95917 O WAT 6560 49.291 82.647 153.763 1.00 0.00 O ATOM 95918 H1 WAT 6560 49.703 83.302 153.200 1.00 0.00 H ATOM 95919 H2 WAT 6560 48.809 83.159 154.413 1.00 0.00 H TER 95921 WAT 6560 ATOM 95921 O WAT 6561 46.333 46.608 -0.050 1.00 0.00 O ATOM 95922 H1 WAT 6561 45.856 46.928 0.716 1.00 0.00 H ATOM 95923 H2 WAT 6561 46.475 47.388 -0.587 1.00 0.00 H TER 95925 WAT 6561 ATOM 95925 O WAT 6562 12.159 35.452 125.494 1.00 0.00 O ATOM 95926 H1 WAT 6562 12.975 35.935 125.365 1.00 0.00 H ATOM 95927 H2 WAT 6562 12.176 34.770 124.823 1.00 0.00 H TER 95929 WAT 6562 ATOM 95929 O WAT 6563 23.644 38.239 87.522 1.00 0.00 O ATOM 95930 H1 WAT 6563 23.350 38.478 88.401 1.00 0.00 H ATOM 95931 H2 WAT 6563 22.971 37.640 87.199 1.00 0.00 H TER 95933 WAT 6563 ATOM 95933 O WAT 6564 39.764 86.175 148.794 1.00 0.00 O ATOM 95934 H1 WAT 6564 39.482 85.568 148.110 1.00 0.00 H ATOM 95935 H2 WAT 6564 40.676 85.939 148.962 1.00 0.00 H TER 95937 WAT 6564 ATOM 95937 O WAT 6565 70.680 94.608 23.890 1.00 0.00 O ATOM 95938 H1 WAT 6565 70.622 93.720 24.241 1.00 0.00 H ATOM 95939 H2 WAT 6565 71.135 95.105 24.570 1.00 0.00 H TER 95941 WAT 6565 ATOM 95941 O WAT 6566 117.572 7.631 79.222 1.00 0.00 O ATOM 95942 H1 WAT 6566 117.042 7.498 80.008 1.00 0.00 H ATOM 95943 H2 WAT 6566 117.595 6.772 78.801 1.00 0.00 H TER 95945 WAT 6566 ATOM 95945 O WAT 6567 91.345 87.765 123.986 1.00 0.00 O ATOM 95946 H1 WAT 6567 92.009 87.275 124.471 1.00 0.00 H ATOM 95947 H2 WAT 6567 90.517 87.515 124.396 1.00 0.00 H TER 95949 WAT 6567 ATOM 95949 O WAT 6568 12.700 35.612 80.139 1.00 0.00 O ATOM 95950 H1 WAT 6568 13.413 35.284 80.686 1.00 0.00 H ATOM 95951 H2 WAT 6568 13.138 35.994 79.378 1.00 0.00 H TER 95953 WAT 6568 ATOM 95953 O WAT 6569 109.817 12.192 85.582 1.00 0.00 O ATOM 95954 H1 WAT 6569 109.181 12.770 86.005 1.00 0.00 H ATOM 95955 H2 WAT 6569 110.122 12.688 84.821 1.00 0.00 H TER 95957 WAT 6569 ATOM 95957 O WAT 6570 123.863 27.523 131.842 1.00 0.00 O ATOM 95958 H1 WAT 6570 123.391 27.385 132.664 1.00 0.00 H ATOM 95959 H2 WAT 6570 123.212 27.905 131.253 1.00 0.00 H TER 95961 WAT 6570 ATOM 95961 O WAT 6571 41.080 120.245 135.794 1.00 0.00 O ATOM 95962 H1 WAT 6571 40.695 120.984 135.322 1.00 0.00 H ATOM 95963 H2 WAT 6571 41.985 120.207 135.483 1.00 0.00 H TER 95965 WAT 6571 ATOM 95965 O WAT 6572 19.453 102.730 79.826 1.00 0.00 O ATOM 95966 H1 WAT 6572 20.314 102.339 79.677 1.00 0.00 H ATOM 95967 H2 WAT 6572 18.919 102.011 80.163 1.00 0.00 H TER 95969 WAT 6572 ATOM 95969 O WAT 6573 48.274 48.889 112.368 1.00 0.00 O ATOM 95970 H1 WAT 6573 48.291 48.139 112.963 1.00 0.00 H ATOM 95971 H2 WAT 6573 49.050 49.398 112.604 1.00 0.00 H TER 95973 WAT 6573 ATOM 95973 O WAT 6574 126.094 50.371 150.194 1.00 0.00 O ATOM 95974 H1 WAT 6574 126.306 50.960 150.917 1.00 0.00 H ATOM 95975 H2 WAT 6574 125.151 50.226 150.271 1.00 0.00 H TER 95977 WAT 6574 ATOM 95977 O WAT 6575 94.362 34.893 153.861 1.00 0.00 O ATOM 95978 H1 WAT 6575 94.131 35.458 153.124 1.00 0.00 H ATOM 95979 H2 WAT 6575 95.300 34.730 153.753 1.00 0.00 H TER 95981 WAT 6575 ATOM 95981 O WAT 6576 33.332 11.519 117.099 1.00 0.00 O ATOM 95982 H1 WAT 6576 33.199 10.624 116.785 1.00 0.00 H ATOM 95983 H2 WAT 6576 34.222 11.520 117.451 1.00 0.00 H TER 95985 WAT 6576 ATOM 95985 O WAT 6577 90.831 66.779 83.072 1.00 0.00 O ATOM 95986 H1 WAT 6577 91.232 67.648 83.091 1.00 0.00 H ATOM 95987 H2 WAT 6577 91.025 66.407 83.933 1.00 0.00 H TER 95989 WAT 6577 ATOM 95989 O WAT 6578 90.782 71.752 18.476 1.00 0.00 O ATOM 95990 H1 WAT 6578 90.188 72.238 17.904 1.00 0.00 H ATOM 95991 H2 WAT 6578 90.274 71.596 19.272 1.00 0.00 H TER 95993 WAT 6578 ATOM 95993 O WAT 6579 125.355 31.788 112.525 1.00 0.00 O ATOM 95994 H1 WAT 6579 125.495 32.661 112.159 1.00 0.00 H ATOM 95995 H2 WAT 6579 124.746 31.927 113.250 1.00 0.00 H TER 95997 WAT 6579 ATOM 95997 O WAT 6580 126.062 96.149 145.898 1.00 0.00 O ATOM 95998 H1 WAT 6580 125.198 96.047 145.499 1.00 0.00 H ATOM 95999 H2 WAT 6580 126.401 95.257 145.966 1.00 0.00 H TER 96001 WAT 6580 ATOM 96001 O WAT 6581 140.459 31.506 141.088 1.00 0.00 O ATOM 96002 H1 WAT 6581 140.871 30.711 140.748 1.00 0.00 H ATOM 96003 H2 WAT 6581 141.124 32.186 140.976 1.00 0.00 H TER 96005 WAT 6581 ATOM 96005 O WAT 6582 93.976 120.440 72.410 1.00 0.00 O ATOM 96006 H1 WAT 6582 93.414 121.161 72.691 1.00 0.00 H ATOM 96007 H2 WAT 6582 93.490 119.650 72.649 1.00 0.00 H TER 96009 WAT 6582 ATOM 96009 O WAT 6583 32.985 18.162 126.046 1.00 0.00 O ATOM 96010 H1 WAT 6583 33.120 18.231 126.991 1.00 0.00 H ATOM 96011 H2 WAT 6583 32.182 17.649 125.956 1.00 0.00 H TER 96013 WAT 6583 ATOM 96013 O WAT 6584 47.954 48.049 138.970 1.00 0.00 O ATOM 96014 H1 WAT 6584 47.814 48.807 138.402 1.00 0.00 H ATOM 96015 H2 WAT 6584 48.866 47.801 138.817 1.00 0.00 H TER 96017 WAT 6584 ATOM 96017 O WAT 6585 103.746 15.292 77.935 1.00 0.00 O ATOM 96018 H1 WAT 6585 104.228 15.743 77.242 1.00 0.00 H ATOM 96019 H2 WAT 6585 104.325 14.580 78.206 1.00 0.00 H TER 96021 WAT 6585 ATOM 96021 O WAT 6586 90.995 4.040 90.483 1.00 0.00 O ATOM 96022 H1 WAT 6586 90.241 4.421 90.933 1.00 0.00 H ATOM 96023 H2 WAT 6586 91.746 4.529 90.817 1.00 0.00 H TER 96025 WAT 6586 ATOM 96025 O WAT 6587 88.039 50.688 120.884 1.00 0.00 O ATOM 96026 H1 WAT 6587 87.835 50.146 120.122 1.00 0.00 H ATOM 96027 H2 WAT 6587 87.250 50.648 121.425 1.00 0.00 H TER 96029 WAT 6587 ATOM 96029 O WAT 6588 66.306 38.559 80.600 1.00 0.00 O ATOM 96030 H1 WAT 6588 66.144 37.630 80.433 1.00 0.00 H ATOM 96031 H2 WAT 6588 66.848 38.569 81.389 1.00 0.00 H TER 96033 WAT 6588 ATOM 96033 O WAT 6589 0.645 103.721 117.733 1.00 0.00 O ATOM 96034 H1 WAT 6589 0.234 103.017 117.232 1.00 0.00 H ATOM 96035 H2 WAT 6589 0.025 103.906 118.439 1.00 0.00 H TER 96037 WAT 6589 ATOM 96037 O WAT 6590 92.760 55.898 98.553 1.00 0.00 O ATOM 96038 H1 WAT 6590 92.784 54.944 98.485 1.00 0.00 H ATOM 96039 H2 WAT 6590 91.867 56.096 98.836 1.00 0.00 H TER 96041 WAT 6590 ATOM 96041 O WAT 6591 2.573 94.161 123.112 1.00 0.00 O ATOM 96042 H1 WAT 6591 2.561 93.895 122.193 1.00 0.00 H ATOM 96043 H2 WAT 6591 3.476 94.013 123.393 1.00 0.00 H TER 96045 WAT 6591 ATOM 96045 O WAT 6592 30.970 64.856 86.274 1.00 0.00 O ATOM 96046 H1 WAT 6592 31.451 65.620 86.590 1.00 0.00 H ATOM 96047 H2 WAT 6592 31.373 64.651 85.430 1.00 0.00 H TER 96049 WAT 6592 ATOM 96049 O WAT 6593 72.646 108.522 84.856 1.00 0.00 O ATOM 96050 H1 WAT 6593 72.464 107.609 84.632 1.00 0.00 H ATOM 96051 H2 WAT 6593 72.033 109.026 84.321 1.00 0.00 H TER 96053 WAT 6593 ATOM 96053 O WAT 6594 77.038 11.687 121.948 1.00 0.00 O ATOM 96054 H1 WAT 6594 76.290 11.977 121.426 1.00 0.00 H ATOM 96055 H2 WAT 6594 76.648 11.283 122.723 1.00 0.00 H TER 96057 WAT 6594 ATOM 96057 O WAT 6595 49.182 29.522 121.480 1.00 0.00 O ATOM 96058 H1 WAT 6595 49.907 29.886 121.987 1.00 0.00 H ATOM 96059 H2 WAT 6595 48.400 29.745 121.985 1.00 0.00 H TER 96061 WAT 6595 ATOM 96061 O WAT 6596 126.112 13.391 117.074 1.00 0.00 O ATOM 96062 H1 WAT 6596 126.562 12.782 117.660 1.00 0.00 H ATOM 96063 H2 WAT 6596 126.693 13.469 116.318 1.00 0.00 H TER 96065 WAT 6596 ATOM 96065 O WAT 6597 102.748 139.935 127.917 1.00 0.00 O ATOM 96066 H1 WAT 6597 103.646 139.707 127.678 1.00 0.00 H ATOM 96067 H2 WAT 6597 102.819 140.288 128.804 1.00 0.00 H TER 96069 WAT 6597 ATOM 96069 O WAT 6598 52.350 143.291 102.676 1.00 0.00 O ATOM 96070 H1 WAT 6598 52.412 143.033 103.596 1.00 0.00 H ATOM 96071 H2 WAT 6598 52.799 144.136 102.634 1.00 0.00 H TER 96073 WAT 6598 ATOM 96073 O WAT 6599 77.305 58.986 8.299 1.00 0.00 O ATOM 96074 H1 WAT 6599 78.120 58.501 8.170 1.00 0.00 H ATOM 96075 H2 WAT 6599 77.507 59.615 8.992 1.00 0.00 H TER 96077 WAT 6599 ATOM 96077 O WAT 6600 94.787 46.825 100.555 1.00 0.00 O ATOM 96078 H1 WAT 6600 95.659 47.167 100.752 1.00 0.00 H ATOM 96079 H2 WAT 6600 94.882 46.407 99.699 1.00 0.00 H TER 96081 WAT 6600 ATOM 96081 O WAT 6601 93.621 124.146 13.950 1.00 0.00 O ATOM 96082 H1 WAT 6601 94.247 123.747 14.555 1.00 0.00 H ATOM 96083 H2 WAT 6601 93.825 123.753 13.101 1.00 0.00 H TER 96085 WAT 6601 ATOM 96085 O WAT 6602 107.863 46.007 93.615 1.00 0.00 O ATOM 96086 H1 WAT 6602 107.637 45.096 93.801 1.00 0.00 H ATOM 96087 H2 WAT 6602 107.780 46.452 94.458 1.00 0.00 H TER 96089 WAT 6602 ATOM 96089 O WAT 6603 79.332 10.530 145.891 1.00 0.00 O ATOM 96090 H1 WAT 6603 79.731 9.664 145.805 1.00 0.00 H ATOM 96091 H2 WAT 6603 80.029 11.140 145.649 1.00 0.00 H TER 96093 WAT 6603 ATOM 96093 O WAT 6604 133.807 55.573 116.280 1.00 0.00 O ATOM 96094 H1 WAT 6604 134.608 55.167 115.950 1.00 0.00 H ATOM 96095 H2 WAT 6604 133.188 54.847 116.365 1.00 0.00 H TER 96097 WAT 6604 ATOM 96097 O WAT 6605 105.048 2.214 66.850 1.00 0.00 O ATOM 96098 H1 WAT 6605 104.807 3.140 66.823 1.00 0.00 H ATOM 96099 H2 WAT 6605 105.966 2.197 66.579 1.00 0.00 H TER 96101 WAT 6605 ATOM 96101 O WAT 6606 96.352 98.007 138.367 1.00 0.00 O ATOM 96102 H1 WAT 6606 95.458 97.800 138.638 1.00 0.00 H ATOM 96103 H2 WAT 6606 96.701 98.542 139.080 1.00 0.00 H TER 96105 WAT 6606 ATOM 96105 O WAT 6607 131.616 78.851 119.238 1.00 0.00 O ATOM 96106 H1 WAT 6607 132.552 79.050 119.237 1.00 0.00 H ATOM 96107 H2 WAT 6607 131.574 77.895 119.243 1.00 0.00 H TER 96109 WAT 6607 ATOM 96109 O WAT 6608 107.124 66.944 61.437 1.00 0.00 O ATOM 96110 H1 WAT 6608 107.723 66.224 61.635 1.00 0.00 H ATOM 96111 H2 WAT 6608 106.306 66.702 61.870 1.00 0.00 H TER 96113 WAT 6608 ATOM 96113 O WAT 6609 143.323 85.699 129.571 1.00 0.00 O ATOM 96114 H1 WAT 6609 143.402 86.495 129.047 1.00 0.00 H ATOM 96115 H2 WAT 6609 142.867 85.978 130.365 1.00 0.00 H TER 96117 WAT 6609 ATOM 96117 O WAT 6610 73.168 110.389 133.738 1.00 0.00 O ATOM 96118 H1 WAT 6610 74.043 110.259 133.374 1.00 0.00 H ATOM 96119 H2 WAT 6610 72.621 109.751 133.279 1.00 0.00 H TER 96121 WAT 6610 ATOM 96121 O WAT 6611 70.108 80.663 16.673 1.00 0.00 O ATOM 96122 H1 WAT 6611 70.243 80.869 15.748 1.00 0.00 H ATOM 96123 H2 WAT 6611 70.990 80.538 17.022 1.00 0.00 H TER 96125 WAT 6611 ATOM 96125 O WAT 6612 22.412 102.134 78.963 1.00 0.00 O ATOM 96126 H1 WAT 6612 22.859 102.653 79.631 1.00 0.00 H ATOM 96127 H2 WAT 6612 22.475 101.232 79.279 1.00 0.00 H TER 96129 WAT 6612 ATOM 96129 O WAT 6613 131.182 2.155 91.207 1.00 0.00 O ATOM 96130 H1 WAT 6613 131.968 1.611 91.265 1.00 0.00 H ATOM 96131 H2 WAT 6613 131.490 2.982 90.837 1.00 0.00 H TER 96133 WAT 6613 ATOM 96133 O WAT 6614 88.627 9.530 128.395 1.00 0.00 O ATOM 96134 H1 WAT 6614 89.427 10.036 128.251 1.00 0.00 H ATOM 96135 H2 WAT 6614 88.301 9.832 129.242 1.00 0.00 H TER 96137 WAT 6614 ATOM 96137 O WAT 6615 131.046 7.089 3.723 1.00 0.00 O ATOM 96138 H1 WAT 6615 130.405 7.088 4.434 1.00 0.00 H ATOM 96139 H2 WAT 6615 131.759 6.537 4.042 1.00 0.00 H TER 96141 WAT 6615 ATOM 96141 O WAT 6616 7.928 0.073 100.381 1.00 0.00 O ATOM 96142 H1 WAT 6616 8.651 0.479 100.860 1.00 0.00 H ATOM 96143 H2 WAT 6616 7.719 0.699 99.687 1.00 0.00 H TER 96145 WAT 6616 ATOM 96145 O WAT 6617 20.935 17.049 110.808 1.00 0.00 O ATOM 96146 H1 WAT 6617 21.520 17.322 111.514 1.00 0.00 H ATOM 96147 H2 WAT 6617 21.466 17.120 110.015 1.00 0.00 H TER 96149 WAT 6617 ATOM 96149 O WAT 6618 54.698 141.159 129.837 1.00 0.00 O ATOM 96150 H1 WAT 6618 55.085 141.316 130.698 1.00 0.00 H ATOM 96151 H2 WAT 6618 53.829 141.558 129.889 1.00 0.00 H TER 96153 WAT 6618 ATOM 96153 O WAT 6619 130.471 50.798 152.634 1.00 0.00 O ATOM 96154 H1 WAT 6619 129.630 50.403 152.862 1.00 0.00 H ATOM 96155 H2 WAT 6619 130.241 51.577 152.127 1.00 0.00 H TER 96157 WAT 6619 ATOM 96157 O WAT 6620 5.832 102.391 109.015 1.00 0.00 O ATOM 96158 H1 WAT 6620 6.111 103.279 109.238 1.00 0.00 H ATOM 96159 H2 WAT 6620 4.876 102.437 108.998 1.00 0.00 H TER 96161 WAT 6620 ATOM 96161 O WAT 6621 81.608 72.301 104.833 1.00 0.00 O ATOM 96162 H1 WAT 6621 81.308 73.101 105.263 1.00 0.00 H ATOM 96163 H2 WAT 6621 81.376 72.422 103.912 1.00 0.00 H TER 96165 WAT 6621 ATOM 96165 O WAT 6622 89.099 120.252 151.609 1.00 0.00 O ATOM 96166 H1 WAT 6622 90.051 120.302 151.521 1.00 0.00 H ATOM 96167 H2 WAT 6622 88.763 120.771 150.878 1.00 0.00 H TER 96169 WAT 6622 ATOM 96169 O WAT 6623 70.393 72.507 77.452 1.00 0.00 O ATOM 96170 H1 WAT 6623 71.305 72.228 77.535 1.00 0.00 H ATOM 96171 H2 WAT 6623 70.159 72.292 76.549 1.00 0.00 H TER 96173 WAT 6623 ATOM 96173 O WAT 6624 73.765 58.863 146.127 1.00 0.00 O ATOM 96174 H1 WAT 6624 73.070 59.373 145.711 1.00 0.00 H ATOM 96175 H2 WAT 6624 74.252 59.502 146.647 1.00 0.00 H TER 96177 WAT 6624 ATOM 96177 O WAT 6625 26.932 61.214 148.015 1.00 0.00 O ATOM 96178 H1 WAT 6625 27.654 60.586 147.991 1.00 0.00 H ATOM 96179 H2 WAT 6625 27.270 61.984 147.557 1.00 0.00 H TER 96181 WAT 6625 ATOM 96181 O WAT 6626 67.175 0.451 157.012 1.00 0.00 O ATOM 96182 H1 WAT 6626 67.083 0.660 157.942 1.00 0.00 H ATOM 96183 H2 WAT 6626 67.132 -0.505 156.976 1.00 0.00 H TER 96185 WAT 6626 ATOM 96185 O WAT 6627 99.196 143.832 103.096 1.00 0.00 O ATOM 96186 H1 WAT 6627 99.640 144.679 103.069 1.00 0.00 H ATOM 96187 H2 WAT 6627 99.862 143.204 102.815 1.00 0.00 H TER 96189 WAT 6627 ATOM 96189 O WAT 6628 69.232 59.550 74.946 1.00 0.00 O ATOM 96190 H1 WAT 6628 69.078 58.969 74.202 1.00 0.00 H ATOM 96191 H2 WAT 6628 69.855 60.199 74.619 1.00 0.00 H TER 96193 WAT 6628 ATOM 96193 O WAT 6629 59.525 11.420 18.470 1.00 0.00 O ATOM 96194 H1 WAT 6629 58.794 11.223 19.057 1.00 0.00 H ATOM 96195 H2 WAT 6629 60.138 10.697 18.600 1.00 0.00 H TER 96197 WAT 6629 ATOM 96197 O WAT 6630 36.890 18.589 107.360 1.00 0.00 O ATOM 96198 H1 WAT 6630 37.255 17.736 107.123 1.00 0.00 H ATOM 96199 H2 WAT 6630 35.970 18.536 107.101 1.00 0.00 H TER 96201 WAT 6630 ATOM 96201 O WAT 6631 29.917 32.438 106.347 1.00 0.00 O ATOM 96202 H1 WAT 6631 30.282 33.132 106.895 1.00 0.00 H ATOM 96203 H2 WAT 6631 30.100 31.631 106.830 1.00 0.00 H TER 96205 WAT 6631 ATOM 96205 O WAT 6632 102.283 20.656 124.013 1.00 0.00 O ATOM 96206 H1 WAT 6632 103.163 20.289 124.088 1.00 0.00 H ATOM 96207 H2 WAT 6632 101.702 19.896 124.040 1.00 0.00 H TER 96209 WAT 6632 ATOM 96209 O WAT 6633 18.078 28.543 10.693 1.00 0.00 O ATOM 96210 H1 WAT 6633 17.318 28.831 10.187 1.00 0.00 H ATOM 96211 H2 WAT 6633 18.119 27.598 10.546 1.00 0.00 H TER 96213 WAT 6633 ATOM 96213 O WAT 6634 55.998 3.678 126.861 1.00 0.00 O ATOM 96214 H1 WAT 6634 56.146 3.057 126.149 1.00 0.00 H ATOM 96215 H2 WAT 6634 55.874 3.129 127.636 1.00 0.00 H TER 96217 WAT 6634 ATOM 96217 O WAT 6635 26.827 141.091 89.023 1.00 0.00 O ATOM 96218 H1 WAT 6635 25.896 140.881 89.085 1.00 0.00 H ATOM 96219 H2 WAT 6635 27.034 141.513 89.857 1.00 0.00 H TER 96221 WAT 6635 ATOM 96221 O WAT 6636 142.676 96.360 20.258 1.00 0.00 O ATOM 96222 H1 WAT 6636 142.836 96.764 21.111 1.00 0.00 H ATOM 96223 H2 WAT 6636 143.373 95.710 20.167 1.00 0.00 H TER 96225 WAT 6636 ATOM 96225 O WAT 6637 63.909 56.794 77.037 1.00 0.00 O ATOM 96226 H1 WAT 6637 64.505 56.067 77.216 1.00 0.00 H ATOM 96227 H2 WAT 6637 63.875 57.284 77.859 1.00 0.00 H TER 96229 WAT 6637 ATOM 96229 O WAT 6638 145.326 107.251 101.127 1.00 0.00 O ATOM 96230 H1 WAT 6638 145.863 106.557 100.743 1.00 0.00 H ATOM 96231 H2 WAT 6638 145.512 108.022 100.592 1.00 0.00 H TER 96233 WAT 6638 ATOM 96233 O WAT 6639 59.332 144.078 137.382 1.00 0.00 O ATOM 96234 H1 WAT 6639 59.100 143.408 136.739 1.00 0.00 H ATOM 96235 H2 WAT 6639 60.144 143.759 137.777 1.00 0.00 H TER 96237 WAT 6639 ATOM 96237 O WAT 6640 124.367 25.716 22.605 1.00 0.00 O ATOM 96238 H1 WAT 6640 124.682 26.115 21.794 1.00 0.00 H ATOM 96239 H2 WAT 6640 124.762 26.242 23.300 1.00 0.00 H TER 96241 WAT 6640 ATOM 96241 O WAT 6641 123.171 101.598 106.616 1.00 0.00 O ATOM 96242 H1 WAT 6641 123.468 102.390 107.064 1.00 0.00 H ATOM 96243 H2 WAT 6641 122.966 101.888 105.727 1.00 0.00 H TER 96245 WAT 6641 ATOM 96245 O WAT 6642 135.191 89.559 83.824 1.00 0.00 O ATOM 96246 H1 WAT 6642 134.500 89.105 84.307 1.00 0.00 H ATOM 96247 H2 WAT 6642 135.784 89.883 84.502 1.00 0.00 H TER 96249 WAT 6642 ATOM 96249 O WAT 6643 126.557 92.898 101.803 1.00 0.00 O ATOM 96250 H1 WAT 6643 126.853 93.650 102.316 1.00 0.00 H ATOM 96251 H2 WAT 6643 126.660 93.174 100.892 1.00 0.00 H TER 96253 WAT 6643 ATOM 96253 O WAT 6644 103.517 71.547 0.386 1.00 0.00 O ATOM 96254 H1 WAT 6644 102.828 70.916 0.591 1.00 0.00 H ATOM 96255 H2 WAT 6644 104.333 71.075 0.556 1.00 0.00 H TER 96257 WAT 6644 ATOM 96257 O WAT 6645 18.155 10.629 94.057 1.00 0.00 O ATOM 96258 H1 WAT 6645 17.738 11.453 93.805 1.00 0.00 H ATOM 96259 H2 WAT 6645 18.637 10.357 93.277 1.00 0.00 H TER 96261 WAT 6645 ATOM 96261 O WAT 6646 31.200 36.258 79.604 1.00 0.00 O ATOM 96262 H1 WAT 6646 31.259 35.514 79.005 1.00 0.00 H ATOM 96263 H2 WAT 6646 30.281 36.523 79.566 1.00 0.00 H TER 96265 WAT 6646 ATOM 96265 O WAT 6647 0.575 60.156 131.088 1.00 0.00 O ATOM 96266 H1 WAT 6647 0.635 60.420 130.170 1.00 0.00 H ATOM 96267 H2 WAT 6647 -0.157 59.539 131.112 1.00 0.00 H TER 96269 WAT 6647 ATOM 96269 O WAT 6648 11.082 121.643 119.579 1.00 0.00 O ATOM 96270 H1 WAT 6648 11.220 122.324 118.920 1.00 0.00 H ATOM 96271 H2 WAT 6648 10.143 121.458 119.539 1.00 0.00 H TER 96273 WAT 6648 ATOM 96273 O WAT 6649 123.012 137.970 78.898 1.00 0.00 O ATOM 96274 H1 WAT 6649 123.950 137.775 78.914 1.00 0.00 H ATOM 96275 H2 WAT 6649 122.803 138.065 77.969 1.00 0.00 H TER 96277 WAT 6649 ATOM 96277 O WAT 6650 81.955 17.017 135.477 1.00 0.00 O ATOM 96278 H1 WAT 6650 81.508 17.689 134.963 1.00 0.00 H ATOM 96279 H2 WAT 6650 81.270 16.641 136.029 1.00 0.00 H TER 96281 WAT 6650 ATOM 96281 O WAT 6651 96.373 14.283 141.787 1.00 0.00 O ATOM 96282 H1 WAT 6651 95.997 13.413 141.651 1.00 0.00 H ATOM 96283 H2 WAT 6651 96.198 14.750 140.970 1.00 0.00 H TER 96285 WAT 6651 ATOM 96285 O WAT 6652 113.222 73.508 22.549 1.00 0.00 O ATOM 96286 H1 WAT 6652 113.944 72.893 22.422 1.00 0.00 H ATOM 96287 H2 WAT 6652 113.365 73.870 23.423 1.00 0.00 H TER 96289 WAT 6652 ATOM 96289 O WAT 6653 34.753 65.311 97.600 1.00 0.00 O ATOM 96290 H1 WAT 6653 35.599 64.891 97.749 1.00 0.00 H ATOM 96291 H2 WAT 6653 34.568 65.155 96.674 1.00 0.00 H TER 96293 WAT 6653 ATOM 96293 O WAT 6654 126.584 54.094 136.988 1.00 0.00 O ATOM 96294 H1 WAT 6654 126.115 53.644 136.286 1.00 0.00 H ATOM 96295 H2 WAT 6654 125.985 54.784 137.272 1.00 0.00 H TER 96297 WAT 6654 ATOM 96297 O WAT 6655 96.363 140.728 117.392 1.00 0.00 O ATOM 96298 H1 WAT 6655 95.766 140.256 117.973 1.00 0.00 H ATOM 96299 H2 WAT 6655 95.827 141.425 117.013 1.00 0.00 H TER 96301 WAT 6655 ATOM 96301 O WAT 6656 87.329 48.014 115.117 1.00 0.00 O ATOM 96302 H1 WAT 6656 87.074 47.164 114.758 1.00 0.00 H ATOM 96303 H2 WAT 6656 88.182 47.857 115.521 1.00 0.00 H TER 96305 WAT 6656 ATOM 96305 O WAT 6657 26.071 41.541 53.607 1.00 0.00 O ATOM 96306 H1 WAT 6657 25.281 42.044 53.408 1.00 0.00 H ATOM 96307 H2 WAT 6657 26.778 42.031 53.187 1.00 0.00 H TER 96309 WAT 6657 ATOM 96309 O WAT 6658 61.291 139.828 72.709 1.00 0.00 O ATOM 96310 H1 WAT 6658 61.148 139.018 73.199 1.00 0.00 H ATOM 96311 H2 WAT 6658 61.195 139.573 71.791 1.00 0.00 H TER 96313 WAT 6658 ATOM 96313 O WAT 6659 29.506 15.101 129.029 1.00 0.00 O ATOM 96314 H1 WAT 6659 28.913 15.280 128.299 1.00 0.00 H ATOM 96315 H2 WAT 6659 29.964 14.300 128.774 1.00 0.00 H TER 96317 WAT 6659 ATOM 96317 O WAT 6660 47.818 109.214 100.799 1.00 0.00 O ATOM 96318 H1 WAT 6660 47.614 109.995 100.284 1.00 0.00 H ATOM 96319 H2 WAT 6660 48.390 109.531 101.498 1.00 0.00 H TER 96321 WAT 6660 ATOM 96321 O WAT 6661 19.586 1.439 63.064 1.00 0.00 O ATOM 96322 H1 WAT 6661 18.782 0.954 63.252 1.00 0.00 H ATOM 96323 H2 WAT 6661 19.838 1.821 63.905 1.00 0.00 H TER 96325 WAT 6661 ATOM 96325 O WAT 6662 74.744 105.339 79.458 1.00 0.00 O ATOM 96326 H1 WAT 6662 75.304 105.859 78.882 1.00 0.00 H ATOM 96327 H2 WAT 6662 74.951 105.650 80.339 1.00 0.00 H TER 96329 WAT 6662 ATOM 96329 O WAT 6663 45.171 138.080 123.454 1.00 0.00 O ATOM 96330 H1 WAT 6663 45.172 138.574 124.274 1.00 0.00 H ATOM 96331 H2 WAT 6663 44.530 137.383 123.595 1.00 0.00 H TER 96333 WAT 6663 ATOM 96333 O WAT 6664 122.873 56.373 99.035 1.00 0.00 O ATOM 96334 H1 WAT 6664 123.642 55.803 99.012 1.00 0.00 H ATOM 96335 H2 WAT 6664 122.230 55.930 98.480 1.00 0.00 H TER 96337 WAT 6664 ATOM 96337 O WAT 6665 15.861 87.049 134.389 1.00 0.00 O ATOM 96338 H1 WAT 6665 14.977 87.082 134.023 1.00 0.00 H ATOM 96339 H2 WAT 6665 16.120 87.967 134.472 1.00 0.00 H TER 96341 WAT 6665 ATOM 96341 O WAT 6666 94.519 37.395 112.112 1.00 0.00 O ATOM 96342 H1 WAT 6666 95.345 37.763 111.798 1.00 0.00 H ATOM 96343 H2 WAT 6666 94.733 36.490 112.341 1.00 0.00 H TER 96345 WAT 6666 ATOM 96345 O WAT 6667 80.358 23.790 91.791 1.00 0.00 O ATOM 96346 H1 WAT 6667 79.736 23.084 91.616 1.00 0.00 H ATOM 96347 H2 WAT 6667 79.810 24.561 91.939 1.00 0.00 H TER 96349 WAT 6667 ATOM 96349 O WAT 6668 37.596 106.541 74.047 1.00 0.00 O ATOM 96350 H1 WAT 6668 38.527 106.617 73.839 1.00 0.00 H ATOM 96351 H2 WAT 6668 37.575 106.096 74.895 1.00 0.00 H TER 96353 WAT 6668 ATOM 96353 O WAT 6669 31.168 39.755 117.698 1.00 0.00 O ATOM 96354 H1 WAT 6669 30.371 39.602 118.205 1.00 0.00 H ATOM 96355 H2 WAT 6669 31.501 40.593 118.020 1.00 0.00 H TER 96357 WAT 6669 ATOM 96357 O WAT 6670 50.088 101.539 75.114 1.00 0.00 O ATOM 96358 H1 WAT 6670 49.441 101.034 75.606 1.00 0.00 H ATOM 96359 H2 WAT 6670 50.265 102.302 75.664 1.00 0.00 H TER 96361 WAT 6670 ATOM 96361 O WAT 6671 1.310 118.013 119.539 1.00 0.00 O ATOM 96362 H1 WAT 6671 1.270 118.869 119.112 1.00 0.00 H ATOM 96363 H2 WAT 6671 1.949 118.126 120.243 1.00 0.00 H TER 96365 WAT 6671 ATOM 96365 O WAT 6672 9.750 94.630 71.554 1.00 0.00 O ATOM 96366 H1 WAT 6672 9.795 95.496 71.147 1.00 0.00 H ATOM 96367 H2 WAT 6672 10.517 94.167 71.219 1.00 0.00 H TER 96369 WAT 6672 ATOM 96369 O WAT 6673 6.969 28.226 157.871 1.00 0.00 O ATOM 96370 H1 WAT 6673 7.761 27.800 158.197 1.00 0.00 H ATOM 96371 H2 WAT 6673 6.250 27.726 158.258 1.00 0.00 H TER 96373 WAT 6673 ATOM 96373 O WAT 6674 53.121 94.354 150.430 1.00 0.00 O ATOM 96374 H1 WAT 6674 53.514 94.071 149.604 1.00 0.00 H ATOM 96375 H2 WAT 6674 53.519 95.207 150.605 1.00 0.00 H TER 96377 WAT 6674 ATOM 96377 O WAT 6675 36.561 92.108 25.897 1.00 0.00 O ATOM 96378 H1 WAT 6675 37.220 92.508 25.330 1.00 0.00 H ATOM 96379 H2 WAT 6675 35.864 91.836 25.300 1.00 0.00 H TER 96381 WAT 6675 ATOM 96381 O WAT 6676 95.696 77.196 26.901 1.00 0.00 O ATOM 96382 H1 WAT 6676 95.037 77.549 26.303 1.00 0.00 H ATOM 96383 H2 WAT 6676 95.456 77.549 27.758 1.00 0.00 H TER 96385 WAT 6676 ATOM 96385 O WAT 6677 77.744 110.779 87.770 1.00 0.00 O ATOM 96386 H1 WAT 6677 77.615 111.689 88.037 1.00 0.00 H ATOM 96387 H2 WAT 6677 76.922 110.344 87.997 1.00 0.00 H TER 96389 WAT 6677 ATOM 96389 O WAT 6678 33.983 137.577 9.375 1.00 0.00 O ATOM 96390 H1 WAT 6678 34.404 138.316 8.936 1.00 0.00 H ATOM 96391 H2 WAT 6678 33.800 137.896 10.259 1.00 0.00 H TER 96393 WAT 6678 ATOM 96393 O WAT 6679 97.078 1.106 136.375 1.00 0.00 O ATOM 96394 H1 WAT 6679 96.191 0.915 136.680 1.00 0.00 H ATOM 96395 H2 WAT 6679 96.952 1.666 135.609 1.00 0.00 H TER 96397 WAT 6679 ATOM 96397 O WAT 6680 133.639 116.338 81.090 1.00 0.00 O ATOM 96398 H1 WAT 6680 133.537 116.259 82.038 1.00 0.00 H ATOM 96399 H2 WAT 6680 133.833 117.264 80.946 1.00 0.00 H TER 96401 WAT 6680 ATOM 96401 O WAT 6681 20.354 21.604 135.871 1.00 0.00 O ATOM 96402 H1 WAT 6681 19.514 21.146 135.869 1.00 0.00 H ATOM 96403 H2 WAT 6681 20.123 22.528 135.776 1.00 0.00 H TER 96405 WAT 6681 ATOM 96405 O WAT 6682 28.448 3.448 17.937 1.00 0.00 O ATOM 96406 H1 WAT 6682 29.297 3.209 18.309 1.00 0.00 H ATOM 96407 H2 WAT 6682 28.349 2.874 17.178 1.00 0.00 H TER 96409 WAT 6682 ATOM 96409 O WAT 6683 124.773 103.687 96.695 1.00 0.00 O ATOM 96410 H1 WAT 6683 123.950 104.123 96.474 1.00 0.00 H ATOM 96411 H2 WAT 6683 125.250 103.641 95.866 1.00 0.00 H TER 96413 WAT 6683 ATOM 96413 O WAT 6684 1.088 8.773 19.526 1.00 0.00 O ATOM 96414 H1 WAT 6684 1.483 9.432 20.097 1.00 0.00 H ATOM 96415 H2 WAT 6684 0.846 8.059 20.115 1.00 0.00 H TER 96417 WAT 6684 ATOM 96417 O WAT 6685 54.901 22.491 60.075 1.00 0.00 O ATOM 96418 H1 WAT 6685 55.480 23.196 59.787 1.00 0.00 H ATOM 96419 H2 WAT 6685 55.371 21.688 59.850 1.00 0.00 H TER 96421 WAT 6685 ATOM 96421 O WAT 6686 34.043 24.189 151.838 1.00 0.00 O ATOM 96422 H1 WAT 6686 34.807 23.970 151.304 1.00 0.00 H ATOM 96423 H2 WAT 6686 33.928 23.432 152.413 1.00 0.00 H TER 96425 WAT 6686 ATOM 96425 O WAT 6687 62.809 43.728 24.861 1.00 0.00 O ATOM 96426 H1 WAT 6687 61.864 43.878 24.858 1.00 0.00 H ATOM 96427 H2 WAT 6687 63.035 43.601 23.940 1.00 0.00 H TER 96429 WAT 6687 ATOM 96429 O WAT 6688 107.486 128.649 119.013 1.00 0.00 O ATOM 96430 H1 WAT 6688 107.859 128.588 119.893 1.00 0.00 H ATOM 96431 H2 WAT 6688 106.651 129.100 119.138 1.00 0.00 H TER 96433 WAT 6688 ATOM 96433 O WAT 6689 87.652 47.789 144.219 1.00 0.00 O ATOM 96434 H1 WAT 6689 87.836 46.850 144.185 1.00 0.00 H ATOM 96435 H2 WAT 6689 87.284 47.930 145.091 1.00 0.00 H TER 96437 WAT 6689 ATOM 96437 O WAT 6690 12.298 76.927 133.769 1.00 0.00 O ATOM 96438 H1 WAT 6690 11.900 76.580 134.568 1.00 0.00 H ATOM 96439 H2 WAT 6690 13.077 76.388 133.636 1.00 0.00 H TER 96441 WAT 6690 ATOM 96441 O WAT 6691 79.876 82.571 83.820 1.00 0.00 O ATOM 96442 H1 WAT 6691 78.929 82.606 83.690 1.00 0.00 H ATOM 96443 H2 WAT 6691 80.117 81.674 83.589 1.00 0.00 H TER 96445 WAT 6691 ATOM 96445 O WAT 6692 59.686 113.583 87.842 1.00 0.00 O ATOM 96446 H1 WAT 6692 60.047 112.795 87.436 1.00 0.00 H ATOM 96447 H2 WAT 6692 60.104 113.622 88.703 1.00 0.00 H TER 96449 WAT 6692 ATOM 96449 O WAT 6693 76.037 78.307 98.640 1.00 0.00 O ATOM 96450 H1 WAT 6693 75.788 77.748 99.376 1.00 0.00 H ATOM 96451 H2 WAT 6693 76.363 77.699 97.976 1.00 0.00 H TER 96453 WAT 6693 ATOM 96453 O WAT 6694 0.177 131.990 0.102 1.00 0.00 O ATOM 96454 H1 WAT 6694 0.433 132.830 0.484 1.00 0.00 H ATOM 96455 H2 WAT 6694 0.799 131.361 0.467 1.00 0.00 H TER 96457 WAT 6694 ATOM 96457 O WAT 6695 102.564 123.849 77.042 1.00 0.00 O ATOM 96458 H1 WAT 6695 102.057 124.281 77.730 1.00 0.00 H ATOM 96459 H2 WAT 6695 102.703 122.960 77.371 1.00 0.00 H TER 96461 WAT 6695 ATOM 96461 O WAT 6696 23.199 65.014 81.115 1.00 0.00 O ATOM 96462 H1 WAT 6696 23.428 65.939 81.208 1.00 0.00 H ATOM 96463 H2 WAT 6696 22.262 65.018 80.922 1.00 0.00 H TER 96465 WAT 6696 ATOM 96465 O WAT 6697 129.592 120.101 80.291 1.00 0.00 O ATOM 96466 H1 WAT 6697 130.378 120.647 80.277 1.00 0.00 H ATOM 96467 H2 WAT 6697 128.917 120.641 79.881 1.00 0.00 H TER 96469 WAT 6697 ATOM 96469 O WAT 6698 80.801 49.776 88.597 1.00 0.00 O ATOM 96470 H1 WAT 6698 81.362 49.002 88.643 1.00 0.00 H ATOM 96471 H2 WAT 6698 80.209 49.688 89.344 1.00 0.00 H TER 96473 WAT 6698 ATOM 96473 O WAT 6699 31.480 106.851 133.702 1.00 0.00 O ATOM 96474 H1 WAT 6699 30.818 106.241 133.378 1.00 0.00 H ATOM 96475 H2 WAT 6699 31.047 107.318 134.417 1.00 0.00 H TER 96477 WAT 6699 ATOM 96477 O WAT 6700 25.968 115.643 100.539 1.00 0.00 O ATOM 96478 H1 WAT 6700 25.756 116.019 101.393 1.00 0.00 H ATOM 96479 H2 WAT 6700 26.399 116.354 100.064 1.00 0.00 H TER 96481 WAT 6700 ATOM 96481 O WAT 6701 2.996 72.184 84.784 1.00 0.00 O ATOM 96482 H1 WAT 6701 3.218 72.184 83.853 1.00 0.00 H ATOM 96483 H2 WAT 6701 2.064 71.968 84.808 1.00 0.00 H TER 96485 WAT 6701 ATOM 96485 O WAT 6702 21.898 90.903 80.714 1.00 0.00 O ATOM 96486 H1 WAT 6702 21.687 91.718 81.170 1.00 0.00 H ATOM 96487 H2 WAT 6702 21.635 91.061 79.808 1.00 0.00 H TER 96489 WAT 6702 ATOM 96489 O WAT 6703 103.300 88.434 148.157 1.00 0.00 O ATOM 96490 H1 WAT 6703 104.143 88.535 147.713 1.00 0.00 H ATOM 96491 H2 WAT 6703 103.434 88.830 149.018 1.00 0.00 H TER 96493 WAT 6703 ATOM 96493 O WAT 6704 64.516 65.328 98.487 1.00 0.00 O ATOM 96494 H1 WAT 6704 65.117 64.595 98.354 1.00 0.00 H ATOM 96495 H2 WAT 6704 65.065 66.028 98.840 1.00 0.00 H TER 96497 WAT 6704 ATOM 96497 O WAT 6705 38.114 74.132 80.010 1.00 0.00 O ATOM 96498 H1 WAT 6705 37.544 73.982 80.765 1.00 0.00 H ATOM 96499 H2 WAT 6705 38.380 73.255 79.734 1.00 0.00 H TER 96501 WAT 6705 ATOM 96501 O WAT 6706 12.213 84.012 107.479 1.00 0.00 O ATOM 96502 H1 WAT 6706 12.056 84.477 106.657 1.00 0.00 H ATOM 96503 H2 WAT 6706 11.497 84.288 108.051 1.00 0.00 H TER 96505 WAT 6706 ATOM 96505 O WAT 6707 49.800 100.406 135.776 1.00 0.00 O ATOM 96506 H1 WAT 6707 49.648 100.617 134.855 1.00 0.00 H ATOM 96507 H2 WAT 6707 48.930 100.431 136.174 1.00 0.00 H TER 96509 WAT 6707 ATOM 96509 O WAT 6708 17.599 2.781 114.571 1.00 0.00 O ATOM 96510 H1 WAT 6708 17.462 3.427 113.878 1.00 0.00 H ATOM 96511 H2 WAT 6708 16.995 2.070 114.358 1.00 0.00 H TER 96513 WAT 6708 ATOM 96513 O WAT 6709 114.383 72.456 88.876 1.00 0.00 O ATOM 96514 H1 WAT 6709 113.468 72.710 88.999 1.00 0.00 H ATOM 96515 H2 WAT 6709 114.449 72.244 87.945 1.00 0.00 H TER 96517 WAT 6709 ATOM 96517 O WAT 6710 121.795 28.387 106.207 1.00 0.00 O ATOM 96518 H1 WAT 6710 122.253 28.448 105.369 1.00 0.00 H ATOM 96519 H2 WAT 6710 121.510 29.282 106.390 1.00 0.00 H TER 96521 WAT 6710 ATOM 96521 O WAT 6711 133.540 145.430 5.811 1.00 0.00 O ATOM 96522 H1 WAT 6711 133.288 144.814 5.122 1.00 0.00 H ATOM 96523 H2 WAT 6711 133.903 144.879 6.504 1.00 0.00 H TER 96525 WAT 6711 ATOM 96525 O WAT 6712 28.270 17.650 104.828 1.00 0.00 O ATOM 96526 H1 WAT 6712 28.733 16.813 104.878 1.00 0.00 H ATOM 96527 H2 WAT 6712 28.355 17.916 103.912 1.00 0.00 H TER 96529 WAT 6712 ATOM 96529 O WAT 6713 116.385 75.542 12.810 1.00 0.00 O ATOM 96530 H1 WAT 6713 116.115 75.244 13.678 1.00 0.00 H ATOM 96531 H2 WAT 6713 116.658 74.745 12.357 1.00 0.00 H TER 96533 WAT 6713 ATOM 96533 O WAT 6714 52.482 122.628 57.230 1.00 0.00 O ATOM 96534 H1 WAT 6714 53.219 123.236 57.171 1.00 0.00 H ATOM 96535 H2 WAT 6714 51.707 123.181 57.128 1.00 0.00 H TER 96537 WAT 6714 ATOM 96537 O WAT 6715 93.816 58.575 10.792 1.00 0.00 O ATOM 96538 H1 WAT 6715 93.500 58.044 11.523 1.00 0.00 H ATOM 96539 H2 WAT 6715 94.260 59.314 11.208 1.00 0.00 H TER 96541 WAT 6715 ATOM 96541 O WAT 6716 121.869 97.933 10.235 1.00 0.00 O ATOM 96542 H1 WAT 6716 122.798 97.807 10.040 1.00 0.00 H ATOM 96543 H2 WAT 6716 121.432 97.197 9.807 1.00 0.00 H TER 96545 WAT 6716 ATOM 96545 O WAT 6717 125.138 113.914 77.033 1.00 0.00 O ATOM 96546 H1 WAT 6717 124.678 113.211 76.575 1.00 0.00 H ATOM 96547 H2 WAT 6717 125.758 114.255 76.389 1.00 0.00 H TER 96549 WAT 6717 ATOM 96549 O WAT 6718 44.631 107.064 14.858 1.00 0.00 O ATOM 96550 H1 WAT 6718 44.065 107.634 15.378 1.00 0.00 H ATOM 96551 H2 WAT 6718 44.122 106.262 14.742 1.00 0.00 H TER 96553 WAT 6718 ATOM 96553 O WAT 6719 73.590 114.488 61.820 1.00 0.00 O ATOM 96554 H1 WAT 6719 73.068 115.216 61.482 1.00 0.00 H ATOM 96555 H2 WAT 6719 73.781 113.953 61.049 1.00 0.00 H TER 96557 WAT 6719 ATOM 96557 O WAT 6720 121.488 50.698 135.870 1.00 0.00 O ATOM 96558 H1 WAT 6720 121.391 51.649 135.926 1.00 0.00 H ATOM 96559 H2 WAT 6720 120.631 50.386 135.581 1.00 0.00 H TER 96561 WAT 6720 ATOM 96561 O WAT 6721 22.643 57.059 153.732 1.00 0.00 O ATOM 96562 H1 WAT 6721 22.637 58.002 153.570 1.00 0.00 H ATOM 96563 H2 WAT 6721 23.152 56.957 154.536 1.00 0.00 H TER 96565 WAT 6721 ATOM 96565 O WAT 6722 78.770 42.634 158.394 1.00 0.00 O ATOM 96566 H1 WAT 6722 79.231 41.935 157.930 1.00 0.00 H ATOM 96567 H2 WAT 6722 79.113 43.441 158.012 1.00 0.00 H TER 96569 WAT 6722 ATOM 96569 O WAT 6723 83.349 113.165 118.827 1.00 0.00 O ATOM 96570 H1 WAT 6723 82.678 112.567 119.158 1.00 0.00 H ATOM 96571 H2 WAT 6723 82.912 114.016 118.786 1.00 0.00 H TER 96573 WAT 6723 ATOM 96573 O WAT 6724 86.362 141.098 18.368 1.00 0.00 O ATOM 96574 H1 WAT 6724 87.007 140.593 18.862 1.00 0.00 H ATOM 96575 H2 WAT 6724 86.317 140.662 17.517 1.00 0.00 H TER 96577 WAT 6724 ATOM 96577 O WAT 6725 96.759 37.802 7.909 1.00 0.00 O ATOM 96578 H1 WAT 6725 95.940 38.091 7.506 1.00 0.00 H ATOM 96579 H2 WAT 6725 96.958 36.971 7.478 1.00 0.00 H TER 96581 WAT 6725 ATOM 96581 O WAT 6726 15.330 137.888 90.293 1.00 0.00 O ATOM 96582 H1 WAT 6726 15.243 138.837 90.382 1.00 0.00 H ATOM 96583 H2 WAT 6726 14.920 137.534 91.082 1.00 0.00 H TER 96585 WAT 6726 ATOM 96585 O WAT 6727 2.591 48.644 105.175 1.00 0.00 O ATOM 96586 H1 WAT 6727 3.267 49.282 105.402 1.00 0.00 H ATOM 96587 H2 WAT 6727 2.002 49.118 104.588 1.00 0.00 H TER 96589 WAT 6727 ATOM 96589 O WAT 6728 94.866 120.531 89.497 1.00 0.00 O ATOM 96590 H1 WAT 6728 94.616 119.718 89.937 1.00 0.00 H ATOM 96591 H2 WAT 6728 94.211 120.641 88.808 1.00 0.00 H TER 96593 WAT 6728 ATOM 96593 O WAT 6729 20.893 16.105 128.495 1.00 0.00 O ATOM 96594 H1 WAT 6729 21.415 16.890 128.332 1.00 0.00 H ATOM 96595 H2 WAT 6729 20.711 16.130 129.435 1.00 0.00 H TER 96597 WAT 6729 ATOM 96597 O WAT 6730 113.725 133.945 137.194 1.00 0.00 O ATOM 96598 H1 WAT 6730 113.485 133.757 136.287 1.00 0.00 H ATOM 96599 H2 WAT 6730 112.998 133.597 137.711 1.00 0.00 H TER 96601 WAT 6730 ATOM 96601 O WAT 6731 81.246 114.368 11.916 1.00 0.00 O ATOM 96602 H1 WAT 6731 81.401 113.432 12.043 1.00 0.00 H ATOM 96603 H2 WAT 6731 81.155 114.718 12.802 1.00 0.00 H TER 96605 WAT 6731 ATOM 96605 O WAT 6732 29.908 79.722 109.440 1.00 0.00 O ATOM 96606 H1 WAT 6732 29.132 80.008 109.922 1.00 0.00 H ATOM 96607 H2 WAT 6732 30.490 79.366 110.111 1.00 0.00 H TER 96609 WAT 6732 ATOM 96609 O WAT 6733 118.067 80.058 83.602 1.00 0.00 O ATOM 96610 H1 WAT 6733 118.636 80.410 84.287 1.00 0.00 H ATOM 96611 H2 WAT 6733 118.420 80.419 82.789 1.00 0.00 H TER 96613 WAT 6733 ATOM 96613 O WAT 6734 56.564 2.613 8.123 1.00 0.00 O ATOM 96614 H1 WAT 6734 57.513 2.566 8.005 1.00 0.00 H ATOM 96615 H2 WAT 6734 56.409 3.495 8.461 1.00 0.00 H TER 96617 WAT 6734 ATOM 96617 O WAT 6735 19.602 1.868 69.806 1.00 0.00 O ATOM 96618 H1 WAT 6735 19.571 2.295 70.663 1.00 0.00 H ATOM 96619 H2 WAT 6735 18.933 2.318 69.290 1.00 0.00 H TER 96621 WAT 6735 ATOM 96621 O WAT 6736 54.264 14.878 129.729 1.00 0.00 O ATOM 96622 H1 WAT 6736 54.811 14.809 128.947 1.00 0.00 H ATOM 96623 H2 WAT 6736 54.438 14.071 130.214 1.00 0.00 H TER 96625 WAT 6736 ATOM 96625 O WAT 6737 144.723 73.330 14.191 1.00 0.00 O ATOM 96626 H1 WAT 6737 145.473 73.788 13.811 1.00 0.00 H ATOM 96627 H2 WAT 6737 144.714 73.605 15.108 1.00 0.00 H TER 96629 WAT 6737 ATOM 96629 O WAT 6738 8.538 59.244 75.280 1.00 0.00 O ATOM 96630 H1 WAT 6738 8.361 58.553 75.919 1.00 0.00 H ATOM 96631 H2 WAT 6738 8.814 58.775 74.492 1.00 0.00 H TER 96633 WAT 6738 ATOM 96633 O WAT 6739 131.365 77.483 8.005 1.00 0.00 O ATOM 96634 H1 WAT 6739 130.983 76.638 7.769 1.00 0.00 H ATOM 96635 H2 WAT 6739 132.189 77.261 8.439 1.00 0.00 H TER 96637 WAT 6739 ATOM 96637 O WAT 6740 29.685 32.312 25.903 1.00 0.00 O ATOM 96638 H1 WAT 6740 29.152 32.983 25.476 1.00 0.00 H ATOM 96639 H2 WAT 6740 29.399 31.490 25.505 1.00 0.00 H TER 96641 WAT 6740 ATOM 96641 O WAT 6741 80.612 97.066 130.289 1.00 0.00 O ATOM 96642 H1 WAT 6741 80.728 98.014 130.355 1.00 0.00 H ATOM 96643 H2 WAT 6741 80.230 96.813 131.130 1.00 0.00 H TER 96645 WAT 6741 ATOM 96645 O WAT 6742 101.149 94.811 8.066 1.00 0.00 O ATOM 96646 H1 WAT 6742 101.400 94.398 7.240 1.00 0.00 H ATOM 96647 H2 WAT 6742 101.929 94.740 8.617 1.00 0.00 H TER 96649 WAT 6742 ATOM 96649 O WAT 6743 82.077 126.173 117.624 1.00 0.00 O ATOM 96650 H1 WAT 6743 82.640 126.626 116.996 1.00 0.00 H ATOM 96651 H2 WAT 6743 81.189 126.432 117.380 1.00 0.00 H TER 96653 WAT 6743 ATOM 96653 O WAT 6744 21.911 21.738 99.977 1.00 0.00 O ATOM 96654 H1 WAT 6744 22.556 21.230 100.469 1.00 0.00 H ATOM 96655 H2 WAT 6744 21.993 21.421 99.077 1.00 0.00 H TER 96657 WAT 6744 ATOM 96657 O WAT 6745 6.343 30.520 65.149 1.00 0.00 O ATOM 96658 H1 WAT 6745 6.266 30.018 64.338 1.00 0.00 H ATOM 96659 H2 WAT 6745 6.682 29.892 65.787 1.00 0.00 H TER 96661 WAT 6745 ATOM 96661 O WAT 6746 46.637 29.885 123.031 1.00 0.00 O ATOM 96662 H1 WAT 6746 45.940 29.232 122.967 1.00 0.00 H ATOM 96663 H2 WAT 6746 47.015 29.748 123.899 1.00 0.00 H TER 96665 WAT 6746 ATOM 96665 O WAT 6747 84.658 68.487 5.170 1.00 0.00 O ATOM 96666 H1 WAT 6747 84.135 69.288 5.190 1.00 0.00 H ATOM 96667 H2 WAT 6747 85.470 68.719 5.619 1.00 0.00 H TER 96669 WAT 6747 ATOM 96669 O WAT 6748 89.444 102.930 148.179 1.00 0.00 O ATOM 96670 H1 WAT 6748 89.622 103.870 148.219 1.00 0.00 H ATOM 96671 H2 WAT 6748 88.501 102.871 148.029 1.00 0.00 H TER 96673 WAT 6748 ATOM 96673 O WAT 6749 12.278 133.800 155.512 1.00 0.00 O ATOM 96674 H1 WAT 6749 11.409 133.418 155.386 1.00 0.00 H ATOM 96675 H2 WAT 6749 12.881 133.144 155.162 1.00 0.00 H TER 96677 WAT 6749 ATOM 96677 O WAT 6750 144.510 10.218 116.539 1.00 0.00 O ATOM 96678 H1 WAT 6750 143.964 9.723 115.928 1.00 0.00 H ATOM 96679 H2 WAT 6750 145.401 10.101 116.212 1.00 0.00 H TER 96681 WAT 6750 ATOM 96681 O WAT 6751 124.260 136.400 138.824 1.00 0.00 O ATOM 96682 H1 WAT 6751 124.428 136.359 139.766 1.00 0.00 H ATOM 96683 H2 WAT 6751 124.046 135.500 138.580 1.00 0.00 H TER 96685 WAT 6751 ATOM 96685 O WAT 6752 110.587 63.984 91.711 1.00 0.00 O ATOM 96686 H1 WAT 6752 110.739 64.925 91.805 1.00 0.00 H ATOM 96687 H2 WAT 6752 110.806 63.796 90.798 1.00 0.00 H TER 96689 WAT 6752 ATOM 96689 O WAT 6753 23.234 27.127 83.306 1.00 0.00 O ATOM 96690 H1 WAT 6753 23.328 27.460 82.413 1.00 0.00 H ATOM 96691 H2 WAT 6753 23.860 27.637 83.819 1.00 0.00 H TER 96693 WAT 6753 ATOM 96693 O WAT 6754 54.884 70.569 6.392 1.00 0.00 O ATOM 96694 H1 WAT 6754 55.356 71.066 5.724 1.00 0.00 H ATOM 96695 H2 WAT 6754 53.991 70.502 6.055 1.00 0.00 H TER 96697 WAT 6754 ATOM 96697 O WAT 6755 137.397 70.226 102.953 1.00 0.00 O ATOM 96698 H1 WAT 6755 137.183 69.352 102.627 1.00 0.00 H ATOM 96699 H2 WAT 6755 138.321 70.344 102.734 1.00 0.00 H TER 96701 WAT 6755 ATOM 96701 O WAT 6756 41.879 47.308 157.019 1.00 0.00 O ATOM 96702 H1 WAT 6756 41.539 46.532 157.465 1.00 0.00 H ATOM 96703 H2 WAT 6756 41.166 47.944 157.067 1.00 0.00 H TER 96705 WAT 6756 ATOM 96705 O WAT 6757 58.798 15.320 108.072 1.00 0.00 O ATOM 96706 H1 WAT 6757 59.478 15.381 108.743 1.00 0.00 H ATOM 96707 H2 WAT 6757 58.660 16.224 107.789 1.00 0.00 H TER 96709 WAT 6757 ATOM 96709 O WAT 6758 101.166 125.898 5.908 1.00 0.00 O ATOM 96710 H1 WAT 6758 101.261 124.988 6.190 1.00 0.00 H ATOM 96711 H2 WAT 6758 101.665 125.950 5.093 1.00 0.00 H TER 96713 WAT 6758 ATOM 96713 O WAT 6759 87.320 0.942 143.429 1.00 0.00 O ATOM 96714 H1 WAT 6759 87.648 1.624 144.015 1.00 0.00 H ATOM 96715 H2 WAT 6759 87.526 0.122 143.877 1.00 0.00 H TER 96717 WAT 6759 ATOM 96717 O WAT 6760 117.488 32.965 140.689 1.00 0.00 O ATOM 96718 H1 WAT 6760 116.822 33.188 141.339 1.00 0.00 H ATOM 96719 H2 WAT 6760 117.155 32.172 140.268 1.00 0.00 H TER 96721 WAT 6760 ATOM 96721 O WAT 6761 24.459 48.271 156.785 1.00 0.00 O ATOM 96722 H1 WAT 6761 23.684 47.709 156.805 1.00 0.00 H ATOM 96723 H2 WAT 6761 24.528 48.616 157.675 1.00 0.00 H TER 96725 WAT 6761 ATOM 96725 O WAT 6762 37.863 113.562 142.670 1.00 0.00 O ATOM 96726 H1 WAT 6762 38.401 114.316 142.912 1.00 0.00 H ATOM 96727 H2 WAT 6762 37.352 113.371 143.457 1.00 0.00 H TER 96729 WAT 6762 ATOM 96729 O WAT 6763 144.200 63.840 158.340 1.00 0.00 O ATOM 96730 H1 WAT 6763 143.676 64.136 159.084 1.00 0.00 H ATOM 96731 H2 WAT 6763 145.075 63.702 158.703 1.00 0.00 H TER 96733 WAT 6763 ATOM 96733 O WAT 6764 108.662 127.301 157.785 1.00 0.00 O ATOM 96734 H1 WAT 6764 109.244 127.497 157.051 1.00 0.00 H ATOM 96735 H2 WAT 6764 109.126 127.632 158.554 1.00 0.00 H TER 96737 WAT 6764 ATOM 96737 O WAT 6765 106.019 27.284 145.270 1.00 0.00 O ATOM 96738 H1 WAT 6765 105.065 27.293 145.189 1.00 0.00 H ATOM 96739 H2 WAT 6765 106.324 26.869 144.463 1.00 0.00 H TER 96741 WAT 6765 ATOM 96741 O WAT 6766 103.437 35.503 122.427 1.00 0.00 O ATOM 96742 H1 WAT 6766 103.727 34.595 122.514 1.00 0.00 H ATOM 96743 H2 WAT 6766 102.607 35.535 122.902 1.00 0.00 H TER 96745 WAT 6766 ATOM 96745 O WAT 6767 50.216 119.424 49.738 1.00 0.00 O ATOM 96746 H1 WAT 6767 50.653 119.126 50.536 1.00 0.00 H ATOM 96747 H2 WAT 6767 49.308 119.573 50.004 1.00 0.00 H TER 96749 WAT 6767 ATOM 96749 O WAT 6768 20.269 52.080 59.429 1.00 0.00 O ATOM 96750 H1 WAT 6768 19.580 52.719 59.606 1.00 0.00 H ATOM 96751 H2 WAT 6768 19.846 51.230 59.554 1.00 0.00 H TER 96753 WAT 6768 ATOM 96753 O WAT 6769 71.590 74.497 150.554 1.00 0.00 O ATOM 96754 H1 WAT 6769 72.017 73.924 149.918 1.00 0.00 H ATOM 96755 H2 WAT 6769 72.029 74.304 151.383 1.00 0.00 H TER 96757 WAT 6769 ATOM 96757 O WAT 6770 94.120 20.360 7.745 1.00 0.00 O ATOM 96758 H1 WAT 6770 93.682 21.200 7.877 1.00 0.00 H ATOM 96759 H2 WAT 6770 93.720 19.777 8.391 1.00 0.00 H TER 96761 WAT 6770 ATOM 96761 O WAT 6771 89.037 29.621 138.023 1.00 0.00 O ATOM 96762 H1 WAT 6771 88.298 29.575 137.417 1.00 0.00 H ATOM 96763 H2 WAT 6771 89.043 30.530 138.325 1.00 0.00 H TER 96765 WAT 6771 ATOM 96765 O WAT 6772 134.650 22.640 136.849 1.00 0.00 O ATOM 96766 H1 WAT 6772 135.464 22.391 136.411 1.00 0.00 H ATOM 96767 H2 WAT 6772 134.636 23.596 136.802 1.00 0.00 H TER 96769 WAT 6772 ATOM 96769 O WAT 6773 87.415 91.408 74.142 1.00 0.00 O ATOM 96770 H1 WAT 6773 86.775 90.865 74.602 1.00 0.00 H ATOM 96771 H2 WAT 6773 87.483 92.201 74.675 1.00 0.00 H TER 96773 WAT 6773 ATOM 96773 O WAT 6774 134.340 114.884 133.763 1.00 0.00 O ATOM 96774 H1 WAT 6774 134.469 115.480 134.501 1.00 0.00 H ATOM 96775 H2 WAT 6774 135.226 114.678 133.464 1.00 0.00 H TER 96777 WAT 6774 ATOM 96777 O WAT 6775 130.717 120.262 108.824 1.00 0.00 O ATOM 96778 H1 WAT 6775 130.521 119.969 107.934 1.00 0.00 H ATOM 96779 H2 WAT 6775 131.402 120.921 108.714 1.00 0.00 H TER 96781 WAT 6775 ATOM 96781 O WAT 6776 141.810 139.214 10.558 1.00 0.00 O ATOM 96782 H1 WAT 6776 142.347 139.659 11.214 1.00 0.00 H ATOM 96783 H2 WAT 6776 142.323 138.444 10.311 1.00 0.00 H TER 96785 WAT 6776 ATOM 96785 O WAT 6777 37.927 9.275 86.277 1.00 0.00 O ATOM 96786 H1 WAT 6777 37.464 9.991 86.713 1.00 0.00 H ATOM 96787 H2 WAT 6777 37.232 8.721 85.923 1.00 0.00 H TER 96789 WAT 6777 ATOM 96789 O WAT 6778 124.251 143.964 8.746 1.00 0.00 O ATOM 96790 H1 WAT 6778 124.534 144.740 9.230 1.00 0.00 H ATOM 96791 H2 WAT 6778 123.417 143.722 9.146 1.00 0.00 H TER 96793 WAT 6778 ATOM 96793 O WAT 6779 7.695 109.969 128.243 1.00 0.00 O ATOM 96794 H1 WAT 6779 7.908 109.181 128.744 1.00 0.00 H ATOM 96795 H2 WAT 6779 8.514 110.464 128.216 1.00 0.00 H TER 96797 WAT 6779 ATOM 96797 O WAT 6780 101.421 59.724 81.461 1.00 0.00 O ATOM 96798 H1 WAT 6780 100.552 59.788 81.858 1.00 0.00 H ATOM 96799 H2 WAT 6780 101.456 60.455 80.844 1.00 0.00 H TER 96801 WAT 6780 ATOM 96801 O WAT 6781 83.207 44.335 107.661 1.00 0.00 O ATOM 96802 H1 WAT 6781 83.975 44.762 107.281 1.00 0.00 H ATOM 96803 H2 WAT 6781 82.462 44.766 107.242 1.00 0.00 H TER 96805 WAT 6781 ATOM 96805 O WAT 6782 88.180 39.416 112.617 1.00 0.00 O ATOM 96806 H1 WAT 6782 87.907 39.341 113.531 1.00 0.00 H ATOM 96807 H2 WAT 6782 88.880 38.770 112.521 1.00 0.00 H TER 96809 WAT 6782 ATOM 96809 O WAT 6783 144.284 45.738 118.645 1.00 0.00 O ATOM 96810 H1 WAT 6783 144.447 44.798 118.567 1.00 0.00 H ATOM 96811 H2 WAT 6783 143.342 45.831 118.501 1.00 0.00 H TER 96813 WAT 6783 ATOM 96813 O WAT 6784 67.347 111.262 78.424 1.00 0.00 O ATOM 96814 H1 WAT 6784 68.214 111.422 78.798 1.00 0.00 H ATOM 96815 H2 WAT 6784 67.476 110.524 77.828 1.00 0.00 H TER 96817 WAT 6784 ATOM 96817 O WAT 6785 117.481 52.385 133.285 1.00 0.00 O ATOM 96818 H1 WAT 6785 117.377 52.018 132.407 1.00 0.00 H ATOM 96819 H2 WAT 6785 116.669 52.868 133.441 1.00 0.00 H TER 96821 WAT 6785 ATOM 96821 O WAT 6786 81.561 6.391 66.522 1.00 0.00 O ATOM 96822 H1 WAT 6786 81.433 5.579 66.033 1.00 0.00 H ATOM 96823 H2 WAT 6786 81.319 7.083 65.906 1.00 0.00 H TER 96825 WAT 6786 ATOM 96825 O WAT 6787 25.065 134.062 98.929 1.00 0.00 O ATOM 96826 H1 WAT 6787 25.258 133.807 98.027 1.00 0.00 H ATOM 96827 H2 WAT 6787 25.760 133.658 99.447 1.00 0.00 H TER 96829 WAT 6787 ATOM 96829 O WAT 6788 141.552 106.944 25.608 1.00 0.00 O ATOM 96830 H1 WAT 6788 141.808 106.071 25.312 1.00 0.00 H ATOM 96831 H2 WAT 6788 142.018 107.542 25.023 1.00 0.00 H TER 96833 WAT 6788 ATOM 96833 O WAT 6789 102.628 127.977 149.494 1.00 0.00 O ATOM 96834 H1 WAT 6789 101.774 128.232 149.845 1.00 0.00 H ATOM 96835 H2 WAT 6789 102.610 127.020 149.491 1.00 0.00 H TER 96837 WAT 6789 ATOM 96837 O WAT 6790 53.506 97.201 111.496 1.00 0.00 O ATOM 96838 H1 WAT 6790 53.652 97.723 112.285 1.00 0.00 H ATOM 96839 H2 WAT 6790 52.570 96.999 111.513 1.00 0.00 H TER 96841 WAT 6790 ATOM 96841 O WAT 6791 124.563 40.198 9.958 1.00 0.00 O ATOM 96842 H1 WAT 6791 123.632 40.389 10.071 1.00 0.00 H ATOM 96843 H2 WAT 6791 124.931 40.267 10.839 1.00 0.00 H TER 96845 WAT 6791 ATOM 96845 O WAT 6792 13.897 143.226 122.508 1.00 0.00 O ATOM 96846 H1 WAT 6792 13.646 142.793 123.324 1.00 0.00 H ATOM 96847 H2 WAT 6792 13.967 142.514 121.872 1.00 0.00 H TER 96849 WAT 6792 ATOM 96849 O WAT 6793 107.719 137.148 68.299 1.00 0.00 O ATOM 96850 H1 WAT 6793 107.136 137.438 69.000 1.00 0.00 H ATOM 96851 H2 WAT 6793 107.607 136.198 68.272 1.00 0.00 H TER 96853 WAT 6793 ATOM 96853 O WAT 6794 102.166 91.268 17.051 1.00 0.00 O ATOM 96854 H1 WAT 6794 102.652 92.092 17.035 1.00 0.00 H ATOM 96855 H2 WAT 6794 102.611 90.714 16.410 1.00 0.00 H TER 96857 WAT 6794 ATOM 96857 O WAT 6795 126.428 112.089 12.996 1.00 0.00 O ATOM 96858 H1 WAT 6795 125.754 112.590 13.454 1.00 0.00 H ATOM 96859 H2 WAT 6795 127.189 112.126 13.575 1.00 0.00 H TER 96861 WAT 6795 ATOM 96861 O WAT 6796 129.866 90.014 111.078 1.00 0.00 O ATOM 96862 H1 WAT 6796 130.477 90.612 111.508 1.00 0.00 H ATOM 96863 H2 WAT 6796 130.096 90.064 110.150 1.00 0.00 H TER 96865 WAT 6796 ATOM 96865 O WAT 6797 28.342 121.045 157.550 1.00 0.00 O ATOM 96866 H1 WAT 6797 28.330 121.882 157.085 1.00 0.00 H ATOM 96867 H2 WAT 6797 29.117 120.595 157.214 1.00 0.00 H TER 96869 WAT 6797 ATOM 96869 O WAT 6798 23.874 10.790 12.664 1.00 0.00 O ATOM 96870 H1 WAT 6798 23.574 11.090 11.806 1.00 0.00 H ATOM 96871 H2 WAT 6798 23.704 11.529 13.249 1.00 0.00 H TER 96873 WAT 6798 ATOM 96873 O WAT 6799 120.208 109.416 115.838 1.00 0.00 O ATOM 96874 H1 WAT 6799 119.281 109.205 115.730 1.00 0.00 H ATOM 96875 H2 WAT 6799 120.219 110.122 116.485 1.00 0.00 H TER 96877 WAT 6799 ATOM 96877 O WAT 6800 23.695 34.397 9.334 1.00 0.00 O ATOM 96878 H1 WAT 6800 22.823 34.006 9.272 1.00 0.00 H ATOM 96879 H2 WAT 6800 24.274 33.759 8.919 1.00 0.00 H TER 96881 WAT 6800 ATOM 96881 O WAT 6801 49.163 139.367 8.939 1.00 0.00 O ATOM 96882 H1 WAT 6801 49.445 138.511 8.614 1.00 0.00 H ATOM 96883 H2 WAT 6801 49.292 139.959 8.198 1.00 0.00 H TER 96885 WAT 6801 ATOM 96885 O WAT 6802 58.881 83.998 68.224 1.00 0.00 O ATOM 96886 H1 WAT 6802 59.815 83.904 68.411 1.00 0.00 H ATOM 96887 H2 WAT 6802 58.494 83.173 68.517 1.00 0.00 H TER 96889 WAT 6802 ATOM 96889 O WAT 6803 45.153 25.706 158.788 1.00 0.00 O ATOM 96890 H1 WAT 6803 45.228 24.781 159.024 1.00 0.00 H ATOM 96891 H2 WAT 6803 44.526 25.718 158.065 1.00 0.00 H TER 96893 WAT 6803 ATOM 96893 O WAT 6804 13.049 98.330 61.768 1.00 0.00 O ATOM 96894 H1 WAT 6804 12.757 99.241 61.777 1.00 0.00 H ATOM 96895 H2 WAT 6804 12.695 97.973 60.953 1.00 0.00 H TER 96897 WAT 6804 ATOM 96897 O WAT 6805 37.985 33.490 90.717 1.00 0.00 O ATOM 96898 H1 WAT 6805 38.460 32.849 90.188 1.00 0.00 H ATOM 96899 H2 WAT 6805 37.260 33.772 90.159 1.00 0.00 H TER 96901 WAT 6805 ATOM 96901 O WAT 6806 136.250 117.230 92.408 1.00 0.00 O ATOM 96902 H1 WAT 6806 136.763 116.733 93.046 1.00 0.00 H ATOM 96903 H2 WAT 6806 136.851 117.372 91.677 1.00 0.00 H TER 96905 WAT 6806 ATOM 96905 O WAT 6807 64.779 63.507 106.529 1.00 0.00 O ATOM 96906 H1 WAT 6807 64.955 63.113 107.383 1.00 0.00 H ATOM 96907 H2 WAT 6807 64.536 62.768 105.971 1.00 0.00 H TER 96909 WAT 6807 ATOM 96909 O WAT 6808 40.460 81.596 114.347 1.00 0.00 O ATOM 96910 H1 WAT 6808 39.838 80.925 114.629 1.00 0.00 H ATOM 96911 H2 WAT 6808 40.517 81.485 113.398 1.00 0.00 H TER 96913 WAT 6808 ATOM 96913 O WAT 6809 133.048 126.585 65.586 1.00 0.00 O ATOM 96914 H1 WAT 6809 133.108 125.891 64.930 1.00 0.00 H ATOM 96915 H2 WAT 6809 133.224 126.144 66.418 1.00 0.00 H TER 96917 WAT 6809 ATOM 96917 O WAT 6810 111.783 101.482 91.124 1.00 0.00 O ATOM 96918 H1 WAT 6810 111.681 100.996 91.943 1.00 0.00 H ATOM 96919 H2 WAT 6810 110.953 101.946 91.017 1.00 0.00 H TER 96921 WAT 6810 ATOM 96921 O WAT 6811 117.417 79.059 96.531 1.00 0.00 O ATOM 96922 H1 WAT 6811 118.301 78.800 96.791 1.00 0.00 H ATOM 96923 H2 WAT 6811 117.408 78.957 95.579 1.00 0.00 H TER 96925 WAT 6811 ATOM 96925 O WAT 6812 115.609 55.934 80.491 1.00 0.00 O ATOM 96926 H1 WAT 6812 115.470 56.165 79.572 1.00 0.00 H ATOM 96927 H2 WAT 6812 115.270 55.042 80.567 1.00 0.00 H TER 96929 WAT 6812 ATOM 96929 O WAT 6813 106.580 75.150 112.771 1.00 0.00 O ATOM 96930 H1 WAT 6813 107.446 75.547 112.683 1.00 0.00 H ATOM 96931 H2 WAT 6813 106.044 75.832 113.176 1.00 0.00 H TER 96933 WAT 6813 ATOM 96933 O WAT 6814 129.457 96.816 11.577 1.00 0.00 O ATOM 96934 H1 WAT 6814 129.154 97.420 10.898 1.00 0.00 H ATOM 96935 H2 WAT 6814 129.859 97.381 12.237 1.00 0.00 H TER 96937 WAT 6814 ATOM 96937 O WAT 6815 13.626 112.034 7.872 1.00 0.00 O ATOM 96938 H1 WAT 6815 13.286 111.407 8.510 1.00 0.00 H ATOM 96939 H2 WAT 6815 12.876 112.590 7.660 1.00 0.00 H TER 96941 WAT 6815 ATOM 96941 O WAT 6816 141.441 68.149 73.922 1.00 0.00 O ATOM 96942 H1 WAT 6816 141.478 68.548 73.052 1.00 0.00 H ATOM 96943 H2 WAT 6816 141.401 68.892 74.524 1.00 0.00 H TER 96945 WAT 6816 ATOM 96945 O WAT 6817 123.319 15.234 78.660 1.00 0.00 O ATOM 96946 H1 WAT 6817 122.780 15.484 77.909 1.00 0.00 H ATOM 96947 H2 WAT 6817 123.664 16.063 78.993 1.00 0.00 H TER 96949 WAT 6817 ATOM 96949 O WAT 6818 72.482 35.425 53.857 1.00 0.00 O ATOM 96950 H1 WAT 6818 73.213 35.799 54.349 1.00 0.00 H ATOM 96951 H2 WAT 6818 72.142 34.732 54.423 1.00 0.00 H TER 96953 WAT 6818 ATOM 96953 O WAT 6819 129.532 77.031 126.948 1.00 0.00 O ATOM 96954 H1 WAT 6819 128.588 76.874 126.936 1.00 0.00 H ATOM 96955 H2 WAT 6819 129.629 77.933 126.644 1.00 0.00 H TER 96957 WAT 6819 ATOM 96957 O WAT 6820 91.235 9.009 7.141 1.00 0.00 O ATOM 96958 H1 WAT 6820 91.951 9.281 7.715 1.00 0.00 H ATOM 96959 H2 WAT 6820 90.584 8.632 7.734 1.00 0.00 H TER 96961 WAT 6820 ATOM 96961 O WAT 6821 122.764 3.301 151.937 1.00 0.00 O ATOM 96962 H1 WAT 6821 122.503 3.925 151.259 1.00 0.00 H ATOM 96963 H2 WAT 6821 123.469 3.743 152.411 1.00 0.00 H TER 96965 WAT 6821 ATOM 96965 O WAT 6822 48.657 145.976 108.331 1.00 0.00 O ATOM 96966 H1 WAT 6822 49.206 146.144 107.565 1.00 0.00 H ATOM 96967 H2 WAT 6822 48.537 145.027 108.336 1.00 0.00 H TER 96969 WAT 6822 ATOM 96969 O WAT 6823 32.223 139.898 59.615 1.00 0.00 O ATOM 96970 H1 WAT 6823 32.153 140.308 60.478 1.00 0.00 H ATOM 96971 H2 WAT 6823 32.573 139.025 59.793 1.00 0.00 H TER 96973 WAT 6823 ATOM 96973 O WAT 6824 124.831 88.145 79.326 1.00 0.00 O ATOM 96974 H1 WAT 6824 125.463 88.560 78.739 1.00 0.00 H ATOM 96975 H2 WAT 6824 123.977 88.414 78.988 1.00 0.00 H TER 96977 WAT 6824 ATOM 96977 O WAT 6825 51.190 94.442 65.987 1.00 0.00 O ATOM 96978 H1 WAT 6825 50.702 93.691 66.324 1.00 0.00 H ATOM 96979 H2 WAT 6825 50.515 95.051 65.687 1.00 0.00 H TER 96981 WAT 6825 ATOM 96981 O WAT 6826 131.142 34.667 118.254 1.00 0.00 O ATOM 96982 H1 WAT 6826 130.216 34.828 118.077 1.00 0.00 H ATOM 96983 H2 WAT 6826 131.225 34.763 119.203 1.00 0.00 H TER 96985 WAT 6826 ATOM 96985 O WAT 6827 33.441 80.274 98.080 1.00 0.00 O ATOM 96986 H1 WAT 6827 33.388 80.728 98.922 1.00 0.00 H ATOM 96987 H2 WAT 6827 33.562 79.353 98.312 1.00 0.00 H TER 96989 WAT 6827 ATOM 96989 O WAT 6828 126.812 77.632 99.268 1.00 0.00 O ATOM 96990 H1 WAT 6828 127.561 78.104 98.904 1.00 0.00 H ATOM 96991 H2 WAT 6828 126.918 77.710 100.216 1.00 0.00 H TER 96993 WAT 6828 ATOM 96993 O WAT 6829 24.804 112.447 89.746 1.00 0.00 O ATOM 96994 H1 WAT 6829 25.023 113.378 89.747 1.00 0.00 H ATOM 96995 H2 WAT 6829 23.852 112.425 89.643 1.00 0.00 H TER 96997 WAT 6829 ATOM 96997 O WAT 6830 100.450 135.553 2.312 1.00 0.00 O ATOM 96998 H1 WAT 6830 99.562 135.318 2.042 1.00 0.00 H ATOM 96999 H2 WAT 6830 100.932 135.650 1.490 1.00 0.00 H TER 97001 WAT 6830 ATOM 97001 O WAT 6831 38.245 12.045 77.090 1.00 0.00 O ATOM 97002 H1 WAT 6831 38.973 12.279 76.513 1.00 0.00 H ATOM 97003 H2 WAT 6831 37.978 12.874 77.487 1.00 0.00 H TER 97005 WAT 6831 ATOM 97005 O WAT 6832 13.838 119.520 132.163 1.00 0.00 O ATOM 97006 H1 WAT 6832 14.121 118.612 132.057 1.00 0.00 H ATOM 97007 H2 WAT 6832 13.172 119.485 132.849 1.00 0.00 H TER 97009 WAT 6832 ATOM 97009 O WAT 6833 17.748 67.375 13.393 1.00 0.00 O ATOM 97010 H1 WAT 6833 18.609 67.007 13.592 1.00 0.00 H ATOM 97011 H2 WAT 6833 17.743 68.224 13.835 1.00 0.00 H TER 97013 WAT 6833 ATOM 97013 O WAT 6834 123.461 3.719 18.848 1.00 0.00 O ATOM 97014 H1 WAT 6834 124.041 3.118 19.316 1.00 0.00 H ATOM 97015 H2 WAT 6834 123.462 3.400 17.946 1.00 0.00 H TER 97017 WAT 6834 ATOM 97017 O WAT 6835 35.425 29.940 96.700 1.00 0.00 O ATOM 97018 H1 WAT 6835 34.999 30.302 95.923 1.00 0.00 H ATOM 97019 H2 WAT 6835 35.138 30.506 97.416 1.00 0.00 H TER 97021 WAT 6835 ATOM 97021 O WAT 6836 69.108 38.869 19.140 1.00 0.00 O ATOM 97022 H1 WAT 6836 68.376 38.276 19.312 1.00 0.00 H ATOM 97023 H2 WAT 6836 69.085 39.493 19.865 1.00 0.00 H TER 97025 WAT 6836 ATOM 97025 O WAT 6837 23.046 69.366 83.077 1.00 0.00 O ATOM 97026 H1 WAT 6837 22.363 68.847 83.500 1.00 0.00 H ATOM 97027 H2 WAT 6837 23.408 68.785 82.407 1.00 0.00 H TER 97029 WAT 6837 ATOM 97029 O WAT 6838 58.523 76.872 118.531 1.00 0.00 O ATOM 97030 H1 WAT 6838 57.987 76.546 117.808 1.00 0.00 H ATOM 97031 H2 WAT 6838 59.417 76.621 118.299 1.00 0.00 H TER 97033 WAT 6838 ATOM 97033 O WAT 6839 57.382 143.842 79.619 1.00 0.00 O ATOM 97034 H1 WAT 6839 56.985 144.696 79.447 1.00 0.00 H ATOM 97035 H2 WAT 6839 57.171 143.660 80.535 1.00 0.00 H TER 97037 WAT 6839 ATOM 97037 O WAT 6840 12.288 21.829 112.604 1.00 0.00 O ATOM 97038 H1 WAT 6840 12.646 21.752 111.720 1.00 0.00 H ATOM 97039 H2 WAT 6840 11.387 22.126 112.473 1.00 0.00 H TER 97041 WAT 6840 ATOM 97041 O WAT 6841 77.195 30.343 97.878 1.00 0.00 O ATOM 97042 H1 WAT 6841 77.002 31.280 97.889 1.00 0.00 H ATOM 97043 H2 WAT 6841 76.408 29.941 97.510 1.00 0.00 H TER 97045 WAT 6841 ATOM 97045 O WAT 6842 142.678 32.698 3.700 1.00 0.00 O ATOM 97046 H1 WAT 6842 142.497 32.653 2.761 1.00 0.00 H ATOM 97047 H2 WAT 6842 141.826 32.870 4.100 1.00 0.00 H TER 97049 WAT 6842 ATOM 97049 O WAT 6843 93.036 87.794 128.998 1.00 0.00 O ATOM 97050 H1 WAT 6843 92.533 88.607 128.953 1.00 0.00 H ATOM 97051 H2 WAT 6843 92.376 87.110 129.117 1.00 0.00 H TER 97053 WAT 6843 ATOM 97053 O WAT 6844 63.265 61.527 137.229 1.00 0.00 O ATOM 97054 H1 WAT 6844 62.827 60.794 136.796 1.00 0.00 H ATOM 97055 H2 WAT 6844 64.189 61.277 137.248 1.00 0.00 H TER 97057 WAT 6844 ATOM 97057 O WAT 6845 82.737 36.045 114.735 1.00 0.00 O ATOM 97058 H1 WAT 6845 83.194 36.854 114.964 1.00 0.00 H ATOM 97059 H2 WAT 6845 82.341 35.754 115.556 1.00 0.00 H TER 97061 WAT 6845 ATOM 97061 O WAT 6846 121.630 135.259 148.264 1.00 0.00 O ATOM 97062 H1 WAT 6846 121.280 134.467 147.858 1.00 0.00 H ATOM 97063 H2 WAT 6846 121.790 135.011 149.175 1.00 0.00 H TER 97065 WAT 6846 ATOM 97065 O WAT 6847 66.669 126.034 60.518 1.00 0.00 O ATOM 97066 H1 WAT 6847 66.762 125.522 59.715 1.00 0.00 H ATOM 97067 H2 WAT 6847 65.850 125.725 60.907 1.00 0.00 H TER 97069 WAT 6847 ATOM 97069 O WAT 6848 66.921 116.772 150.206 1.00 0.00 O ATOM 97070 H1 WAT 6848 66.745 117.641 149.845 1.00 0.00 H ATOM 97071 H2 WAT 6848 66.202 116.618 150.819 1.00 0.00 H TER 97073 WAT 6848 ATOM 97073 O WAT 6849 51.756 112.081 155.941 1.00 0.00 O ATOM 97074 H1 WAT 6849 51.841 111.456 155.220 1.00 0.00 H ATOM 97075 H2 WAT 6849 50.975 112.591 155.725 1.00 0.00 H TER 97077 WAT 6849 ATOM 97077 O WAT 6850 122.654 54.711 114.814 1.00 0.00 O ATOM 97078 H1 WAT 6850 123.338 54.914 114.175 1.00 0.00 H ATOM 97079 H2 WAT 6850 122.713 53.764 114.935 1.00 0.00 H TER 97081 WAT 6850 ATOM 97081 O WAT 6851 91.404 116.699 87.423 1.00 0.00 O ATOM 97082 H1 WAT 6851 90.545 116.862 87.033 1.00 0.00 H ATOM 97083 H2 WAT 6851 91.590 115.783 87.217 1.00 0.00 H TER 97085 WAT 6851 ATOM 97085 O WAT 6852 17.620 126.712 4.539 1.00 0.00 O ATOM 97086 H1 WAT 6852 18.015 125.947 4.958 1.00 0.00 H ATOM 97087 H2 WAT 6852 16.694 126.663 4.776 1.00 0.00 H TER 97089 WAT 6852 ATOM 97089 O WAT 6853 140.508 50.959 146.071 1.00 0.00 O ATOM 97090 H1 WAT 6853 140.762 51.746 146.553 1.00 0.00 H ATOM 97091 H2 WAT 6853 139.557 50.916 146.168 1.00 0.00 H TER 97093 WAT 6853 ATOM 97093 O WAT 6854 114.627 0.091 -0.104 1.00 0.00 O ATOM 97094 H1 WAT 6854 113.810 0.355 -0.527 1.00 0.00 H ATOM 97095 H2 WAT 6854 114.464 0.215 0.831 1.00 0.00 H TER 97097 WAT 6854 ATOM 97097 O WAT 6855 45.124 138.317 12.520 1.00 0.00 O ATOM 97098 H1 WAT 6855 45.354 137.964 13.380 1.00 0.00 H ATOM 97099 H2 WAT 6855 45.314 139.253 12.587 1.00 0.00 H TER 97101 WAT 6855 ATOM 97101 O WAT 6856 38.638 35.015 123.934 1.00 0.00 O ATOM 97102 H1 WAT 6856 38.887 34.093 123.872 1.00 0.00 H ATOM 97103 H2 WAT 6856 38.845 35.378 123.072 1.00 0.00 H TER 97105 WAT 6856 ATOM 97105 O WAT 6857 135.427 127.006 132.372 1.00 0.00 O ATOM 97106 H1 WAT 6857 134.861 126.475 132.932 1.00 0.00 H ATOM 97107 H2 WAT 6857 135.611 127.789 132.890 1.00 0.00 H TER 97109 WAT 6857 ATOM 97109 O WAT 6858 81.580 129.440 96.035 1.00 0.00 O ATOM 97110 H1 WAT 6858 81.601 130.081 95.324 1.00 0.00 H ATOM 97111 H2 WAT 6858 82.435 129.523 96.457 1.00 0.00 H TER 97113 WAT 6858 ATOM 97113 O WAT 6859 119.382 133.079 124.933 1.00 0.00 O ATOM 97114 H1 WAT 6859 119.323 132.353 125.553 1.00 0.00 H ATOM 97115 H2 WAT 6859 118.698 132.898 124.288 1.00 0.00 H TER 97117 WAT 6859 ATOM 97117 O WAT 6860 10.711 11.875 132.848 1.00 0.00 O ATOM 97118 H1 WAT 6860 10.471 12.773 132.618 1.00 0.00 H ATOM 97119 H2 WAT 6860 9.956 11.541 133.332 1.00 0.00 H TER 97121 WAT 6860 ATOM 97121 O WAT 6861 133.250 37.760 57.636 1.00 0.00 O ATOM 97122 H1 WAT 6861 133.908 37.482 57.000 1.00 0.00 H ATOM 97123 H2 WAT 6861 132.946 36.947 58.039 1.00 0.00 H TER 97125 WAT 6861 ATOM 97125 O WAT 6862 106.847 7.297 121.319 1.00 0.00 O ATOM 97126 H1 WAT 6862 106.644 6.419 121.642 1.00 0.00 H ATOM 97127 H2 WAT 6862 107.709 7.209 120.912 1.00 0.00 H TER 97129 WAT 6862 ATOM 97129 O WAT 6863 8.797 8.836 16.427 1.00 0.00 O ATOM 97130 H1 WAT 6863 9.242 9.666 16.251 1.00 0.00 H ATOM 97131 H2 WAT 6863 9.397 8.360 17.002 1.00 0.00 H TER 97133 WAT 6863 ATOM 97133 O WAT 6864 122.320 9.983 0.105 1.00 0.00 O ATOM 97134 H1 WAT 6864 121.935 9.132 0.319 1.00 0.00 H ATOM 97135 H2 WAT 6864 122.722 10.275 0.923 1.00 0.00 H TER 97137 WAT 6864 ATOM 97137 O WAT 6865 39.980 133.802 107.176 1.00 0.00 O ATOM 97138 H1 WAT 6865 39.099 133.762 107.548 1.00 0.00 H ATOM 97139 H2 WAT 6865 40.552 133.498 107.881 1.00 0.00 H TER 97141 WAT 6865 ATOM 97141 O WAT 6866 4.778 67.993 104.467 1.00 0.00 O ATOM 97142 H1 WAT 6866 5.435 68.506 103.997 1.00 0.00 H ATOM 97143 H2 WAT 6866 3.969 68.495 104.373 1.00 0.00 H TER 97145 WAT 6866 ATOM 97145 O WAT 6867 22.779 76.130 87.618 1.00 0.00 O ATOM 97146 H1 WAT 6867 23.586 76.122 88.132 1.00 0.00 H ATOM 97147 H2 WAT 6867 22.738 77.012 87.249 1.00 0.00 H TER 97149 WAT 6867 ATOM 97149 O WAT 6868 44.109 119.368 94.623 1.00 0.00 O ATOM 97150 H1 WAT 6868 44.472 118.887 95.367 1.00 0.00 H ATOM 97151 H2 WAT 6868 44.819 119.942 94.339 1.00 0.00 H TER 97153 WAT 6868 ATOM 97153 O WAT 6869 21.034 11.190 150.738 1.00 0.00 O ATOM 97154 H1 WAT 6869 21.445 10.940 151.565 1.00 0.00 H ATOM 97155 H2 WAT 6869 20.205 11.595 150.995 1.00 0.00 H TER 97157 WAT 6869 ATOM 97157 O WAT 6870 68.312 140.395 103.273 1.00 0.00 O ATOM 97158 H1 WAT 6870 68.570 140.215 104.177 1.00 0.00 H ATOM 97159 H2 WAT 6870 68.095 141.327 103.267 1.00 0.00 H TER 97161 WAT 6870 ATOM 97161 O WAT 6871 112.414 117.287 74.614 1.00 0.00 O ATOM 97162 H1 WAT 6871 112.585 118.221 74.736 1.00 0.00 H ATOM 97163 H2 WAT 6871 111.508 117.248 74.306 1.00 0.00 H TER 97165 WAT 6871 ATOM 97165 O WAT 6872 42.011 137.206 116.270 1.00 0.00 O ATOM 97166 H1 WAT 6872 42.783 137.595 115.859 1.00 0.00 H ATOM 97167 H2 WAT 6872 42.126 137.376 117.205 1.00 0.00 H TER 97169 WAT 6872 ATOM 97169 O WAT 6873 71.798 94.181 63.673 1.00 0.00 O ATOM 97170 H1 WAT 6873 72.110 94.111 62.770 1.00 0.00 H ATOM 97171 H2 WAT 6873 71.598 95.110 63.785 1.00 0.00 H TER 97173 WAT 6873 ATOM 97173 O WAT 6874 51.845 23.529 12.322 1.00 0.00 O ATOM 97174 H1 WAT 6874 52.104 22.738 12.794 1.00 0.00 H ATOM 97175 H2 WAT 6874 51.217 23.959 12.901 1.00 0.00 H TER 97177 WAT 6874 ATOM 97177 O WAT 6875 81.211 75.877 26.549 1.00 0.00 O ATOM 97178 H1 WAT 6875 82.036 76.311 26.332 1.00 0.00 H ATOM 97179 H2 WAT 6875 81.383 75.437 27.382 1.00 0.00 H TER 97181 WAT 6875 ATOM 97181 O WAT 6876 88.948 82.880 66.372 1.00 0.00 O ATOM 97182 H1 WAT 6876 88.449 83.537 65.887 1.00 0.00 H ATOM 97183 H2 WAT 6876 89.560 82.522 65.729 1.00 0.00 H TER 97185 WAT 6876 ATOM 97185 O WAT 6877 38.398 50.748 126.545 1.00 0.00 O ATOM 97186 H1 WAT 6877 37.634 51.227 126.225 1.00 0.00 H ATOM 97187 H2 WAT 6877 38.285 49.861 126.203 1.00 0.00 H TER 97189 WAT 6877 ATOM 97189 O WAT 6878 56.962 122.270 68.320 1.00 0.00 O ATOM 97190 H1 WAT 6878 57.589 121.558 68.448 1.00 0.00 H ATOM 97191 H2 WAT 6878 56.698 122.520 69.206 1.00 0.00 H TER 97193 WAT 6878 ATOM 97193 O WAT 6879 67.624 66.897 96.889 1.00 0.00 O ATOM 97194 H1 WAT 6879 68.518 66.665 97.141 1.00 0.00 H ATOM 97195 H2 WAT 6879 67.114 66.793 97.692 1.00 0.00 H TER 97197 WAT 6879 ATOM 97197 O WAT 6880 52.481 89.672 76.249 1.00 0.00 O ATOM 97198 H1 WAT 6880 53.433 89.666 76.153 1.00 0.00 H ATOM 97199 H2 WAT 6880 52.164 90.129 75.470 1.00 0.00 H TER 97201 WAT 6880 ATOM 97201 O WAT 6881 107.253 85.476 23.141 1.00 0.00 O ATOM 97202 H1 WAT 6881 108.158 85.177 23.230 1.00 0.00 H ATOM 97203 H2 WAT 6881 106.729 84.772 23.524 1.00 0.00 H TER 97205 WAT 6881 ATOM 97205 O WAT 6882 123.623 42.167 75.423 1.00 0.00 O ATOM 97206 H1 WAT 6882 123.832 43.080 75.618 1.00 0.00 H ATOM 97207 H2 WAT 6882 122.975 41.923 76.085 1.00 0.00 H TER 97209 WAT 6882 ATOM 97209 O WAT 6883 96.670 120.557 0.328 1.00 0.00 O ATOM 97210 H1 WAT 6883 97.273 120.834 -0.362 1.00 0.00 H ATOM 97211 H2 WAT 6883 97.235 120.177 1.000 1.00 0.00 H TER 97213 WAT 6883 ATOM 97213 O WAT 6884 126.063 25.760 65.294 1.00 0.00 O ATOM 97214 H1 WAT 6884 125.963 25.171 64.546 1.00 0.00 H ATOM 97215 H2 WAT 6884 125.168 26.011 65.522 1.00 0.00 H TER 97217 WAT 6884 ATOM 97217 O WAT 6885 67.807 85.272 92.486 1.00 0.00 O ATOM 97218 H1 WAT 6885 67.257 84.728 93.050 1.00 0.00 H ATOM 97219 H2 WAT 6885 67.756 86.146 92.874 1.00 0.00 H TER 97221 WAT 6885 ATOM 97221 O WAT 6886 36.791 91.526 153.713 1.00 0.00 O ATOM 97222 H1 WAT 6886 36.434 91.379 152.837 1.00 0.00 H ATOM 97223 H2 WAT 6886 37.186 92.397 153.667 1.00 0.00 H TER 97225 WAT 6886 ATOM 97225 O WAT 6887 27.929 1.045 154.246 1.00 0.00 O ATOM 97226 H1 WAT 6887 28.326 0.698 153.447 1.00 0.00 H ATOM 97227 H2 WAT 6887 28.631 1.544 154.665 1.00 0.00 H TER 97229 WAT 6887 ATOM 97229 O WAT 6888 117.494 97.186 82.880 1.00 0.00 O ATOM 97230 H1 WAT 6888 117.317 96.458 83.475 1.00 0.00 H ATOM 97231 H2 WAT 6888 118.214 97.663 83.292 1.00 0.00 H TER 97233 WAT 6888 ATOM 97233 O WAT 6889 36.631 13.888 72.556 1.00 0.00 O ATOM 97234 H1 WAT 6889 36.156 13.062 72.651 1.00 0.00 H ATOM 97235 H2 WAT 6889 36.080 14.534 72.998 1.00 0.00 H TER 97237 WAT 6889 ATOM 97237 O WAT 6890 73.428 140.395 143.321 1.00 0.00 O ATOM 97238 H1 WAT 6890 73.941 139.617 143.103 1.00 0.00 H ATOM 97239 H2 WAT 6890 73.582 140.995 142.591 1.00 0.00 H TER 97241 WAT 6890 ATOM 97241 O WAT 6891 2.242 133.814 83.305 1.00 0.00 O ATOM 97242 H1 WAT 6891 2.145 134.154 82.415 1.00 0.00 H ATOM 97243 H2 WAT 6891 3.124 133.443 83.324 1.00 0.00 H TER 97245 WAT 6891 ATOM 97245 O WAT 6892 26.977 60.985 100.562 1.00 0.00 O ATOM 97246 H1 WAT 6892 26.323 61.626 100.284 1.00 0.00 H ATOM 97247 H2 WAT 6892 27.543 60.874 99.798 1.00 0.00 H TER 97249 WAT 6892 ATOM 97249 O WAT 6893 41.997 37.729 84.243 1.00 0.00 O ATOM 97250 H1 WAT 6893 41.320 38.047 83.645 1.00 0.00 H ATOM 97251 H2 WAT 6893 41.909 36.777 84.219 1.00 0.00 H TER 97253 WAT 6893 ATOM 97253 O WAT 6894 15.210 36.601 19.967 1.00 0.00 O ATOM 97254 H1 WAT 6894 15.460 35.741 20.305 1.00 0.00 H ATOM 97255 H2 WAT 6894 16.030 37.094 19.935 1.00 0.00 H TER 97257 WAT 6894 ATOM 97257 O WAT 6895 93.208 16.431 68.044 1.00 0.00 O ATOM 97258 H1 WAT 6895 93.024 15.499 67.927 1.00 0.00 H ATOM 97259 H2 WAT 6895 94.023 16.577 67.565 1.00 0.00 H TER 97261 WAT 6895 ATOM 97261 O WAT 6896 37.890 107.868 2.978 1.00 0.00 O ATOM 97262 H1 WAT 6896 37.467 107.491 2.206 1.00 0.00 H ATOM 97263 H2 WAT 6896 38.580 107.243 3.201 1.00 0.00 H TER 97265 WAT 6896 ATOM 97265 O WAT 6897 60.223 105.310 109.838 1.00 0.00 O ATOM 97266 H1 WAT 6897 60.247 104.354 109.880 1.00 0.00 H ATOM 97267 H2 WAT 6897 59.333 105.539 110.107 1.00 0.00 H TER 97269 WAT 6897 ATOM 97269 O WAT 6898 95.882 48.379 91.803 1.00 0.00 O ATOM 97270 H1 WAT 6898 95.785 49.115 91.199 1.00 0.00 H ATOM 97271 H2 WAT 6898 95.017 47.969 91.821 1.00 0.00 H TER 97273 WAT 6898 ATOM 97273 O WAT 6899 22.258 89.531 93.952 1.00 0.00 O ATOM 97274 H1 WAT 6899 21.916 89.793 94.806 1.00 0.00 H ATOM 97275 H2 WAT 6899 21.843 88.686 93.776 1.00 0.00 H TER 97277 WAT 6899 ATOM 97277 O WAT 6900 22.750 138.373 105.733 1.00 0.00 O ATOM 97278 H1 WAT 6900 22.830 139.079 106.375 1.00 0.00 H ATOM 97279 H2 WAT 6900 22.879 137.572 106.241 1.00 0.00 H TER 97281 WAT 6900 ATOM 97281 O WAT 6901 47.614 138.625 89.086 1.00 0.00 O ATOM 97282 H1 WAT 6901 48.364 138.033 89.025 1.00 0.00 H ATOM 97283 H2 WAT 6901 47.771 139.128 89.885 1.00 0.00 H TER 97285 WAT 6901 ATOM 97285 O WAT 6902 140.884 30.054 104.819 1.00 0.00 O ATOM 97286 H1 WAT 6902 140.865 29.735 103.917 1.00 0.00 H ATOM 97287 H2 WAT 6902 139.962 30.146 105.061 1.00 0.00 H TER 97289 WAT 6902 ATOM 97289 O WAT 6903 30.116 45.310 60.294 1.00 0.00 O ATOM 97290 H1 WAT 6903 30.593 45.698 61.027 1.00 0.00 H ATOM 97291 H2 WAT 6903 30.716 45.383 59.552 1.00 0.00 H TER 97293 WAT 6903 ATOM 97293 O WAT 6904 111.940 78.198 128.191 1.00 0.00 O ATOM 97294 H1 WAT 6904 112.006 77.378 127.703 1.00 0.00 H ATOM 97295 H2 WAT 6904 112.177 78.874 127.556 1.00 0.00 H TER 97297 WAT 6904 ATOM 97297 O WAT 6905 132.972 48.793 56.868 1.00 0.00 O ATOM 97298 H1 WAT 6905 132.341 48.780 56.149 1.00 0.00 H ATOM 97299 H2 WAT 6905 133.131 47.870 57.064 1.00 0.00 H TER 97301 WAT 6905 ATOM 97301 O WAT 6906 70.232 15.645 109.836 1.00 0.00 O ATOM 97302 H1 WAT 6906 70.929 16.298 109.901 1.00 0.00 H ATOM 97303 H2 WAT 6906 70.507 15.073 109.119 1.00 0.00 H TER 97305 WAT 6906 ATOM 97305 O WAT 6907 36.558 116.153 151.039 1.00 0.00 O ATOM 97306 H1 WAT 6907 35.678 115.858 151.275 1.00 0.00 H ATOM 97307 H2 WAT 6907 36.447 117.074 150.804 1.00 0.00 H TER 97309 WAT 6907 ATOM 97309 O WAT 6908 78.962 119.700 63.300 1.00 0.00 O ATOM 97310 H1 WAT 6908 79.776 119.862 63.777 1.00 0.00 H ATOM 97311 H2 WAT 6908 79.153 119.970 62.402 1.00 0.00 H TER 97313 WAT 6908 ATOM 97313 O WAT 6909 118.357 33.472 150.540 1.00 0.00 O ATOM 97314 H1 WAT 6909 118.180 34.389 150.752 1.00 0.00 H ATOM 97315 H2 WAT 6909 119.305 33.383 150.639 1.00 0.00 H TER 97317 WAT 6909 ATOM 97317 O WAT 6910 70.795 3.549 134.235 1.00 0.00 O ATOM 97318 H1 WAT 6910 70.513 3.877 135.088 1.00 0.00 H ATOM 97319 H2 WAT 6910 71.183 4.310 133.802 1.00 0.00 H TER 97321 WAT 6910 ATOM 97321 O WAT 6911 126.443 73.664 112.650 1.00 0.00 O ATOM 97322 H1 WAT 6911 127.077 73.238 112.074 1.00 0.00 H ATOM 97323 H2 WAT 6911 126.936 74.368 113.070 1.00 0.00 H TER 97325 WAT 6911 ATOM 97325 O WAT 6912 78.279 0.649 17.367 1.00 0.00 O ATOM 97326 H1 WAT 6912 78.426 1.526 17.013 1.00 0.00 H ATOM 97327 H2 WAT 6912 78.925 0.562 18.068 1.00 0.00 H TER 97329 WAT 6912 ATOM 97329 O WAT 6913 133.335 10.014 84.169 1.00 0.00 O ATOM 97330 H1 WAT 6913 134.095 10.375 83.713 1.00 0.00 H ATOM 97331 H2 WAT 6913 133.191 9.162 83.756 1.00 0.00 H TER 97333 WAT 6913 ATOM 97333 O WAT 6914 21.195 70.489 122.271 1.00 0.00 O ATOM 97334 H1 WAT 6914 20.690 70.408 121.462 1.00 0.00 H ATOM 97335 H2 WAT 6914 20.542 70.679 122.944 1.00 0.00 H TER 97337 WAT 6914 ATOM 97337 O WAT 6915 103.443 67.297 127.175 1.00 0.00 O ATOM 97338 H1 WAT 6915 104.253 67.780 127.341 1.00 0.00 H ATOM 97339 H2 WAT 6915 103.617 66.418 127.512 1.00 0.00 H TER 97341 WAT 6915 ATOM 97341 O WAT 6916 13.178 127.393 100.095 1.00 0.00 O ATOM 97342 H1 WAT 6916 13.821 127.640 100.759 1.00 0.00 H ATOM 97343 H2 WAT 6916 12.719 128.208 99.890 1.00 0.00 H TER 97345 WAT 6916 ATOM 97345 O WAT 6917 52.214 47.442 3.683 1.00 0.00 O ATOM 97346 H1 WAT 6917 52.412 46.837 4.398 1.00 0.00 H ATOM 97347 H2 WAT 6917 52.229 46.897 2.896 1.00 0.00 H TER 97349 WAT 6917 ATOM 97349 O WAT 6918 107.050 39.296 98.501 1.00 0.00 O ATOM 97350 H1 WAT 6918 107.083 40.132 98.034 1.00 0.00 H ATOM 97351 H2 WAT 6918 107.102 38.635 97.811 1.00 0.00 H TER 97353 WAT 6918 ATOM 97353 O WAT 6919 137.434 43.460 139.935 1.00 0.00 O ATOM 97354 H1 WAT 6919 137.325 44.407 140.023 1.00 0.00 H ATOM 97355 H2 WAT 6919 137.822 43.185 140.766 1.00 0.00 H TER 97357 WAT 6919 ATOM 97357 O WAT 6920 35.840 110.636 22.166 1.00 0.00 O ATOM 97358 H1 WAT 6920 35.465 110.687 23.045 1.00 0.00 H ATOM 97359 H2 WAT 6920 36.717 111.007 22.259 1.00 0.00 H TER 97361 WAT 6920 ATOM 97361 O WAT 6921 62.278 81.155 84.981 1.00 0.00 O ATOM 97362 H1 WAT 6921 62.031 81.464 85.853 1.00 0.00 H ATOM 97363 H2 WAT 6921 61.659 81.583 84.390 1.00 0.00 H TER 97365 WAT 6921 ATOM 97365 O WAT 6922 88.352 144.694 126.906 1.00 0.00 O ATOM 97366 H1 WAT 6922 88.810 145.529 126.803 1.00 0.00 H ATOM 97367 H2 WAT 6922 87.691 144.697 126.215 1.00 0.00 H TER 97369 WAT 6922 ATOM 97369 O WAT 6923 145.371 92.456 98.685 1.00 0.00 O ATOM 97370 H1 WAT 6923 146.157 92.996 98.765 1.00 0.00 H ATOM 97371 H2 WAT 6923 144.824 92.921 98.051 1.00 0.00 H TER 97373 WAT 6923 ATOM 97373 O WAT 6924 91.663 8.113 100.246 1.00 0.00 O ATOM 97374 H1 WAT 6924 91.360 9.003 100.427 1.00 0.00 H ATOM 97375 H2 WAT 6924 91.169 7.843 99.472 1.00 0.00 H TER 97377 WAT 6924 ATOM 97377 O WAT 6925 65.624 37.380 145.687 1.00 0.00 O ATOM 97378 H1 WAT 6925 66.330 36.874 145.285 1.00 0.00 H ATOM 97379 H2 WAT 6925 66.043 38.194 145.967 1.00 0.00 H TER 97381 WAT 6925 ATOM 97381 O WAT 6926 85.098 31.447 121.515 1.00 0.00 O ATOM 97382 H1 WAT 6926 85.509 31.045 122.280 1.00 0.00 H ATOM 97383 H2 WAT 6926 84.181 31.559 121.767 1.00 0.00 H TER 97385 WAT 6926 ATOM 97385 O WAT 6927 21.422 65.650 89.988 1.00 0.00 O ATOM 97386 H1 WAT 6927 20.891 64.940 89.627 1.00 0.00 H ATOM 97387 H2 WAT 6927 22.249 65.597 89.510 1.00 0.00 H TER 97389 WAT 6927 ATOM 97389 O WAT 6928 121.325 15.742 19.192 1.00 0.00 O ATOM 97390 H1 WAT 6928 120.685 16.277 18.723 1.00 0.00 H ATOM 97391 H2 WAT 6928 122.153 15.912 18.744 1.00 0.00 H TER 97393 WAT 6928 ATOM 97393 O WAT 6929 134.283 85.727 122.681 1.00 0.00 O ATOM 97394 H1 WAT 6929 134.154 85.797 123.627 1.00 0.00 H ATOM 97395 H2 WAT 6929 134.666 84.858 122.555 1.00 0.00 H TER 97397 WAT 6929 ATOM 97397 O WAT 6930 110.989 69.195 131.658 1.00 0.00 O ATOM 97398 H1 WAT 6930 110.389 68.854 132.320 1.00 0.00 H ATOM 97399 H2 WAT 6930 110.554 69.014 130.824 1.00 0.00 H TER 97401 WAT 6930 ATOM 97401 O WAT 6931 95.070 49.343 21.453 1.00 0.00 O ATOM 97402 H1 WAT 6931 94.385 49.324 22.121 1.00 0.00 H ATOM 97403 H2 WAT 6931 95.036 50.231 21.099 1.00 0.00 H TER 97405 WAT 6931 ATOM 97405 O WAT 6932 62.211 118.408 7.115 1.00 0.00 O ATOM 97406 H1 WAT 6932 61.789 117.674 7.561 1.00 0.00 H ATOM 97407 H2 WAT 6932 62.777 117.998 6.461 1.00 0.00 H TER 97409 WAT 6932 ATOM 97409 O WAT 6933 124.990 90.050 136.319 1.00 0.00 O ATOM 97410 H1 WAT 6933 124.958 90.962 136.607 1.00 0.00 H ATOM 97411 H2 WAT 6933 124.142 89.901 135.901 1.00 0.00 H TER 97413 WAT 6933 ATOM 97413 O WAT 6934 74.808 29.496 8.065 1.00 0.00 O ATOM 97414 H1 WAT 6934 75.362 30.274 8.132 1.00 0.00 H ATOM 97415 H2 WAT 6934 75.235 28.849 8.626 1.00 0.00 H TER 97417 WAT 6934 ATOM 97417 O WAT 6935 139.986 36.460 153.791 1.00 0.00 O ATOM 97418 H1 WAT 6935 140.918 36.663 153.713 1.00 0.00 H ATOM 97419 H2 WAT 6935 139.942 35.792 154.475 1.00 0.00 H TER 97421 WAT 6935 ATOM 97421 O WAT 6936 74.886 113.026 152.115 1.00 0.00 O ATOM 97422 H1 WAT 6936 74.914 112.465 151.339 1.00 0.00 H ATOM 97423 H2 WAT 6936 75.096 113.900 151.786 1.00 0.00 H TER 97425 WAT 6936 ATOM 97425 O WAT 6937 123.754 57.060 60.764 1.00 0.00 O ATOM 97426 H1 WAT 6937 122.940 57.503 61.001 1.00 0.00 H ATOM 97427 H2 WAT 6937 123.605 56.144 60.996 1.00 0.00 H TER 97429 WAT 6937 ATOM 97429 O WAT 6938 56.866 95.081 68.530 1.00 0.00 O ATOM 97430 H1 WAT 6938 56.470 95.425 67.730 1.00 0.00 H ATOM 97431 H2 WAT 6938 56.640 94.151 68.528 1.00 0.00 H TER 97433 WAT 6938 ATOM 97433 O WAT 6939 114.995 90.176 137.586 1.00 0.00 O ATOM 97434 H1 WAT 6939 115.500 89.412 137.310 1.00 0.00 H ATOM 97435 H2 WAT 6939 114.082 89.925 137.443 1.00 0.00 H TER 97437 WAT 6939 ATOM 97437 O WAT 6940 31.860 118.568 152.685 1.00 0.00 O ATOM 97438 H1 WAT 6940 32.557 118.535 152.030 1.00 0.00 H ATOM 97439 H2 WAT 6940 31.787 117.668 153.004 1.00 0.00 H TER 97441 WAT 6940 ATOM 97441 O WAT 6941 112.910 109.505 100.413 1.00 0.00 O ATOM 97442 H1 WAT 6941 112.654 109.594 99.495 1.00 0.00 H ATOM 97443 H2 WAT 6941 112.212 108.981 100.806 1.00 0.00 H TER 97445 WAT 6941 ATOM 97445 O WAT 6942 78.394 103.631 136.653 1.00 0.00 O ATOM 97446 H1 WAT 6942 78.917 103.054 137.210 1.00 0.00 H ATOM 97447 H2 WAT 6942 78.259 103.131 135.848 1.00 0.00 H TER 97449 WAT 6942 ATOM 97449 O WAT 6943 53.690 38.500 128.597 1.00 0.00 O ATOM 97450 H1 WAT 6943 53.108 39.135 128.179 1.00 0.00 H ATOM 97451 H2 WAT 6943 54.006 37.955 127.876 1.00 0.00 H TER 97453 WAT 6943 ATOM 97453 O WAT 6944 75.457 113.888 154.790 1.00 0.00 O ATOM 97454 H1 WAT 6944 75.014 113.997 153.949 1.00 0.00 H ATOM 97455 H2 WAT 6944 76.315 114.294 154.663 1.00 0.00 H TER 97457 WAT 6944 ATOM 97457 O WAT 6945 54.272 79.510 138.073 1.00 0.00 O ATOM 97458 H1 WAT 6945 55.130 79.323 138.455 1.00 0.00 H ATOM 97459 H2 WAT 6945 53.927 78.651 137.828 1.00 0.00 H TER 97461 WAT 6945 ATOM 97461 O WAT 6946 37.783 63.783 157.329 1.00 0.00 O ATOM 97462 H1 WAT 6946 37.806 63.177 156.588 1.00 0.00 H ATOM 97463 H2 WAT 6946 38.244 63.322 158.030 1.00 0.00 H TER 97465 WAT 6946 ATOM 97465 O WAT 6947 114.693 61.940 135.097 1.00 0.00 O ATOM 97466 H1 WAT 6947 115.097 61.222 135.585 1.00 0.00 H ATOM 97467 H2 WAT 6947 114.346 61.528 134.307 1.00 0.00 H TER 97469 WAT 6947 ATOM 97469 O WAT 6948 2.562 57.059 66.742 1.00 0.00 O ATOM 97470 H1 WAT 6948 1.713 57.386 66.443 1.00 0.00 H ATOM 97471 H2 WAT 6948 2.975 57.815 67.161 1.00 0.00 H TER 97473 WAT 6948 ATOM 97473 O WAT 6949 45.237 26.831 152.854 1.00 0.00 O ATOM 97474 H1 WAT 6949 44.868 27.666 153.142 1.00 0.00 H ATOM 97475 H2 WAT 6949 45.260 26.293 153.646 1.00 0.00 H TER 97477 WAT 6949 ATOM 97477 O WAT 6950 94.181 142.682 76.561 1.00 0.00 O ATOM 97478 H1 WAT 6950 94.510 141.783 76.554 1.00 0.00 H ATOM 97479 H2 WAT 6950 94.968 143.225 76.601 1.00 0.00 H TER 97481 WAT 6950 ATOM 97481 O WAT 6951 119.748 2.395 128.760 1.00 0.00 O ATOM 97482 H1 WAT 6951 119.019 2.999 128.620 1.00 0.00 H ATOM 97483 H2 WAT 6951 119.394 1.536 128.529 1.00 0.00 H TER 97485 WAT 6951 ATOM 97485 O WAT 6952 124.339 17.816 105.465 1.00 0.00 O ATOM 97486 H1 WAT 6952 124.687 18.151 104.639 1.00 0.00 H ATOM 97487 H2 WAT 6952 123.910 18.571 105.869 1.00 0.00 H TER 97489 WAT 6952 ATOM 97489 O WAT 6953 87.685 130.569 69.788 1.00 0.00 O ATOM 97490 H1 WAT 6953 88.165 130.391 68.979 1.00 0.00 H ATOM 97491 H2 WAT 6953 86.768 130.611 69.518 1.00 0.00 H TER 97493 WAT 6953 ATOM 97493 O WAT 6954 143.844 123.479 144.337 1.00 0.00 O ATOM 97494 H1 WAT 6954 144.544 123.759 143.748 1.00 0.00 H ATOM 97495 H2 WAT 6954 144.049 122.565 144.536 1.00 0.00 H TER 97497 WAT 6954 ATOM 97497 O WAT 6955 72.551 130.397 8.938 1.00 0.00 O ATOM 97498 H1 WAT 6955 73.363 130.856 9.153 1.00 0.00 H ATOM 97499 H2 WAT 6955 72.422 130.564 8.004 1.00 0.00 H TER 97501 WAT 6955 ATOM 97501 O WAT 6956 80.077 5.259 129.928 1.00 0.00 O ATOM 97502 H1 WAT 6956 79.168 5.502 129.752 1.00 0.00 H ATOM 97503 H2 WAT 6956 80.185 5.403 130.868 1.00 0.00 H TER 97505 WAT 6956 ATOM 97505 O WAT 6957 61.113 20.227 129.370 1.00 0.00 O ATOM 97506 H1 WAT 6957 61.522 19.893 128.571 1.00 0.00 H ATOM 97507 H2 WAT 6957 60.365 19.648 129.515 1.00 0.00 H TER 97509 WAT 6957 ATOM 97509 O WAT 6958 107.017 144.970 144.747 1.00 0.00 O ATOM 97510 H1 WAT 6958 107.708 144.745 144.123 1.00 0.00 H ATOM 97511 H2 WAT 6958 106.777 145.870 144.524 1.00 0.00 H TER 97513 WAT 6958 ATOM 97513 O WAT 6959 17.016 56.735 158.186 1.00 0.00 O ATOM 97514 H1 WAT 6959 17.825 56.616 157.689 1.00 0.00 H ATOM 97515 H2 WAT 6959 16.384 57.056 157.542 1.00 0.00 H TER 97517 WAT 6959 ATOM 97517 O WAT 6960 7.907 124.506 73.791 1.00 0.00 O ATOM 97518 H1 WAT 6960 8.326 123.880 73.200 1.00 0.00 H ATOM 97519 H2 WAT 6960 7.864 124.050 74.631 1.00 0.00 H TER 97521 WAT 6960 ATOM 97521 O WAT 6961 22.325 59.800 15.528 1.00 0.00 O ATOM 97522 H1 WAT 6961 23.059 59.208 15.362 1.00 0.00 H ATOM 97523 H2 WAT 6961 21.590 59.221 15.728 1.00 0.00 H TER 97525 WAT 6961 ATOM 97525 O WAT 6962 124.026 5.123 127.126 1.00 0.00 O ATOM 97526 H1 WAT 6962 124.900 5.066 126.742 1.00 0.00 H ATOM 97527 H2 WAT 6962 123.434 5.131 126.373 1.00 0.00 H TER 97529 WAT 6962 ATOM 97529 O WAT 6963 98.171 23.131 55.348 1.00 0.00 O ATOM 97530 H1 WAT 6963 97.621 22.572 54.799 1.00 0.00 H ATOM 97531 H2 WAT 6963 97.625 23.894 55.535 1.00 0.00 H TER 97533 WAT 6963 ATOM 97533 O WAT 6964 55.748 110.632 110.522 1.00 0.00 O ATOM 97534 H1 WAT 6964 56.454 110.971 109.971 1.00 0.00 H ATOM 97535 H2 WAT 6964 55.488 111.378 111.063 1.00 0.00 H TER 97537 WAT 6964 ATOM 97537 O WAT 6965 127.191 101.165 123.675 1.00 0.00 O ATOM 97538 H1 WAT 6965 127.721 101.903 123.977 1.00 0.00 H ATOM 97539 H2 WAT 6965 127.459 101.035 122.765 1.00 0.00 H TER 97541 WAT 6965 ATOM 97541 O WAT 6966 136.085 59.104 122.901 1.00 0.00 O ATOM 97542 H1 WAT 6966 136.894 59.617 122.919 1.00 0.00 H ATOM 97543 H2 WAT 6966 136.201 58.501 122.167 1.00 0.00 H TER 97545 WAT 6966 ATOM 97545 O WAT 6967 36.486 52.983 131.269 1.00 0.00 O ATOM 97546 H1 WAT 6967 36.774 53.130 130.368 1.00 0.00 H ATOM 97547 H2 WAT 6967 37.298 52.914 131.772 1.00 0.00 H TER 97549 WAT 6967 ATOM 97549 O WAT 6968 12.544 26.409 80.365 1.00 0.00 O ATOM 97550 H1 WAT 6968 12.577 27.359 80.250 1.00 0.00 H ATOM 97551 H2 WAT 6968 13.456 26.128 80.298 1.00 0.00 H TER 97553 WAT 6968 ATOM 97553 O WAT 6969 126.112 9.284 125.997 1.00 0.00 O ATOM 97554 H1 WAT 6969 125.820 9.820 126.734 1.00 0.00 H ATOM 97555 H2 WAT 6969 126.899 8.843 126.317 1.00 0.00 H TER 97557 WAT 6969 ATOM 97557 O WAT 6970 110.871 111.446 60.436 1.00 0.00 O ATOM 97558 H1 WAT 6970 110.717 112.374 60.261 1.00 0.00 H ATOM 97559 H2 WAT 6970 111.047 111.405 61.376 1.00 0.00 H TER 97561 WAT 6970 ATOM 97561 O WAT 6971 18.261 18.034 77.365 1.00 0.00 O ATOM 97562 H1 WAT 6971 17.551 18.673 77.300 1.00 0.00 H ATOM 97563 H2 WAT 6971 18.271 17.599 76.512 1.00 0.00 H TER 97565 WAT 6971 ATOM 97565 O WAT 6972 62.508 128.469 65.881 1.00 0.00 O ATOM 97566 H1 WAT 6972 63.131 127.785 65.637 1.00 0.00 H ATOM 97567 H2 WAT 6972 63.054 129.225 66.096 1.00 0.00 H TER 97569 WAT 6972 ATOM 97569 O WAT 6973 22.707 87.187 103.674 1.00 0.00 O ATOM 97570 H1 WAT 6973 22.455 86.310 103.383 1.00 0.00 H ATOM 97571 H2 WAT 6973 22.138 87.776 103.179 1.00 0.00 H TER 97573 WAT 6973 ATOM 97573 O WAT 6974 128.060 115.546 123.240 1.00 0.00 O ATOM 97574 H1 WAT 6974 127.867 116.434 122.939 1.00 0.00 H ATOM 97575 H2 WAT 6974 127.355 115.012 122.874 1.00 0.00 H TER 97577 WAT 6974 ATOM 97577 O WAT 6975 53.068 90.002 71.913 1.00 0.00 O ATOM 97578 H1 WAT 6975 52.836 89.075 71.957 1.00 0.00 H ATOM 97579 H2 WAT 6975 52.411 90.386 71.332 1.00 0.00 H TER 97581 WAT 6975 ATOM 97581 O WAT 6976 129.198 103.050 124.470 1.00 0.00 O ATOM 97582 H1 WAT 6976 129.118 102.901 125.412 1.00 0.00 H ATOM 97583 H2 WAT 6976 129.351 103.991 124.388 1.00 0.00 H TER 97585 WAT 6976 ATOM 97585 O WAT 6977 142.816 61.502 76.122 1.00 0.00 O ATOM 97586 H1 WAT 6977 142.369 60.693 75.872 1.00 0.00 H ATOM 97587 H2 WAT 6977 143.740 61.259 76.177 1.00 0.00 H TER 97589 WAT 6977 ATOM 97589 O WAT 6978 78.452 20.261 138.842 1.00 0.00 O ATOM 97590 H1 WAT 6978 79.254 20.012 139.301 1.00 0.00 H ATOM 97591 H2 WAT 6978 78.318 21.180 139.076 1.00 0.00 H TER 97593 WAT 6978 ATOM 97593 O WAT 6979 59.372 26.507 126.525 1.00 0.00 O ATOM 97594 H1 WAT 6979 58.858 27.253 126.834 1.00 0.00 H ATOM 97595 H2 WAT 6979 60.161 26.519 127.067 1.00 0.00 H TER 97597 WAT 6979 ATOM 97597 O WAT 6980 141.189 109.162 146.629 1.00 0.00 O ATOM 97598 H1 WAT 6980 141.712 109.693 147.230 1.00 0.00 H ATOM 97599 H2 WAT 6980 141.051 108.338 147.097 1.00 0.00 H TER 97601 WAT 6980 ATOM 97601 O WAT 6981 133.914 32.524 60.533 1.00 0.00 O ATOM 97602 H1 WAT 6981 133.457 32.941 61.263 1.00 0.00 H ATOM 97603 H2 WAT 6981 134.268 33.254 60.024 1.00 0.00 H TER 97605 WAT 6981 ATOM 97605 O WAT 6982 114.972 80.470 126.455 1.00 0.00 O ATOM 97606 H1 WAT 6982 115.156 81.406 126.374 1.00 0.00 H ATOM 97607 H2 WAT 6982 115.599 80.050 125.867 1.00 0.00 H TER 97609 WAT 6982 ATOM 97609 O WAT 6983 91.996 45.567 70.688 1.00 0.00 O ATOM 97610 H1 WAT 6983 91.156 45.123 70.810 1.00 0.00 H ATOM 97611 H2 WAT 6983 91.885 46.070 69.881 1.00 0.00 H TER 97613 WAT 6983 ATOM 97613 O WAT 6984 84.644 91.294 98.894 1.00 0.00 O ATOM 97614 H1 WAT 6984 83.867 91.588 98.419 1.00 0.00 H ATOM 97615 H2 WAT 6984 84.369 91.270 99.810 1.00 0.00 H TER 97617 WAT 6984 ATOM 97617 O WAT 6985 10.589 14.846 68.896 1.00 0.00 O ATOM 97618 H1 WAT 6985 10.692 14.191 68.206 1.00 0.00 H ATOM 97619 H2 WAT 6985 10.089 15.551 68.483 1.00 0.00 H TER 97621 WAT 6985 ATOM 97621 O WAT 6986 15.269 1.768 21.544 1.00 0.00 O ATOM 97622 H1 WAT 6986 14.625 1.334 22.103 1.00 0.00 H ATOM 97623 H2 WAT 6986 15.369 2.640 21.927 1.00 0.00 H TER 97625 WAT 6986 ATOM 97625 O WAT 6987 11.535 25.282 149.741 1.00 0.00 O ATOM 97626 H1 WAT 6987 12.154 26.011 149.730 1.00 0.00 H ATOM 97627 H2 WAT 6987 10.859 25.551 150.363 1.00 0.00 H TER 97629 WAT 6987 ATOM 97629 O WAT 6988 37.986 37.347 112.956 1.00 0.00 O ATOM 97630 H1 WAT 6988 37.519 37.907 113.577 1.00 0.00 H ATOM 97631 H2 WAT 6988 37.444 36.560 112.890 1.00 0.00 H TER 97633 WAT 6988 ATOM 97633 O WAT 6989 0.913 35.094 104.942 1.00 0.00 O ATOM 97634 H1 WAT 6989 1.460 34.526 105.486 1.00 0.00 H ATOM 97635 H2 WAT 6989 0.278 35.470 105.551 1.00 0.00 H TER 97637 WAT 6989 ATOM 97637 O WAT 6990 33.964 37.864 140.425 1.00 0.00 O ATOM 97638 H1 WAT 6990 34.770 37.521 140.811 1.00 0.00 H ATOM 97639 H2 WAT 6990 33.263 37.440 140.920 1.00 0.00 H TER 97641 WAT 6990 ATOM 97641 O WAT 6991 127.627 74.055 107.699 1.00 0.00 O ATOM 97642 H1 WAT 6991 127.991 74.940 107.696 1.00 0.00 H ATOM 97643 H2 WAT 6991 127.172 73.985 108.538 1.00 0.00 H TER 97645 WAT 6991 ATOM 97645 O WAT 6992 100.002 125.502 133.763 1.00 0.00 O ATOM 97646 H1 WAT 6992 100.403 125.016 133.043 1.00 0.00 H ATOM 97647 H2 WAT 6992 99.100 125.182 133.794 1.00 0.00 H TER 97649 WAT 6992 ATOM 97649 O WAT 6993 137.359 84.550 141.032 1.00 0.00 O ATOM 97650 H1 WAT 6993 137.821 84.215 141.801 1.00 0.00 H ATOM 97651 H2 WAT 6993 137.464 83.865 140.372 1.00 0.00 H TER 97653 WAT 6993 ATOM 97653 O WAT 6994 97.417 59.643 59.917 1.00 0.00 O ATOM 97654 H1 WAT 6994 97.191 60.552 59.717 1.00 0.00 H ATOM 97655 H2 WAT 6994 96.604 59.261 60.248 1.00 0.00 H TER 97657 WAT 6994 ATOM 97657 O WAT 6995 109.369 19.689 21.439 1.00 0.00 O ATOM 97658 H1 WAT 6995 109.965 19.406 22.133 1.00 0.00 H ATOM 97659 H2 WAT 6995 109.928 20.166 20.824 1.00 0.00 H TER 97661 WAT 6995 ATOM 97661 O WAT 6996 82.902 24.596 62.214 1.00 0.00 O ATOM 97662 H1 WAT 6996 83.361 23.758 62.272 1.00 0.00 H ATOM 97663 H2 WAT 6996 83.598 25.243 62.103 1.00 0.00 H TER 97665 WAT 6996 ATOM 97665 O WAT 6997 96.001 33.660 132.854 1.00 0.00 O ATOM 97666 H1 WAT 6997 96.862 34.020 133.065 1.00 0.00 H ATOM 97667 H2 WAT 6997 96.121 32.711 132.892 1.00 0.00 H TER 97669 WAT 6997 ATOM 97669 O WAT 6998 12.165 99.389 117.191 1.00 0.00 O ATOM 97670 H1 WAT 6998 11.353 98.902 117.049 1.00 0.00 H ATOM 97671 H2 WAT 6998 12.859 98.767 116.973 1.00 0.00 H TER 97673 WAT 6998 ATOM 97673 O WAT 6999 102.124 120.029 62.824 1.00 0.00 O ATOM 97674 H1 WAT 6999 102.106 119.406 63.550 1.00 0.00 H ATOM 97675 H2 WAT 6999 102.637 119.591 62.145 1.00 0.00 H TER 97677 WAT 6999 ATOM 97677 O WAT 7000 5.540 121.249 75.801 1.00 0.00 O ATOM 97678 H1 WAT 7000 6.395 121.679 75.779 1.00 0.00 H ATOM 97679 H2 WAT 7000 5.609 120.547 75.153 1.00 0.00 H TER 97681 WAT 7000 ATOM 97681 O WAT 7001 79.423 136.079 147.753 1.00 0.00 O ATOM 97682 H1 WAT 7001 80.017 135.328 147.781 1.00 0.00 H ATOM 97683 H2 WAT 7001 79.394 136.395 148.656 1.00 0.00 H TER 97685 WAT 7001 ATOM 97685 O WAT 7002 39.003 72.183 133.387 1.00 0.00 O ATOM 97686 H1 WAT 7002 39.873 72.494 133.635 1.00 0.00 H ATOM 97687 H2 WAT 7002 38.487 72.246 134.191 1.00 0.00 H TER 97689 WAT 7002 ATOM 97689 O WAT 7003 9.172 114.632 129.856 1.00 0.00 O ATOM 97690 H1 WAT 7003 8.925 115.479 129.486 1.00 0.00 H ATOM 97691 H2 WAT 7003 9.116 114.758 130.803 1.00 0.00 H TER 97693 WAT 7003 ATOM 97693 O WAT 7004 13.443 107.089 125.030 1.00 0.00 O ATOM 97694 H1 WAT 7004 13.429 106.704 124.153 1.00 0.00 H ATOM 97695 H2 WAT 7004 14.285 106.819 125.397 1.00 0.00 H TER 97697 WAT 7004 ATOM 97697 O WAT 7005 66.413 39.088 91.394 1.00 0.00 O ATOM 97698 H1 WAT 7005 67.188 39.357 90.902 1.00 0.00 H ATOM 97699 H2 WAT 7005 65.701 39.610 91.024 1.00 0.00 H TER 97701 WAT 7005 ATOM 97701 O WAT 7006 20.245 92.440 104.418 1.00 0.00 O ATOM 97702 H1 WAT 7006 19.477 92.829 104.835 1.00 0.00 H ATOM 97703 H2 WAT 7006 20.697 91.982 105.127 1.00 0.00 H TER 97705 WAT 7006 ATOM 97705 O WAT 7007 27.775 30.381 22.861 1.00 0.00 O ATOM 97706 H1 WAT 7007 27.316 31.206 22.700 1.00 0.00 H ATOM 97707 H2 WAT 7007 28.191 30.501 23.714 1.00 0.00 H TER 97709 WAT 7007 ATOM 97709 O WAT 7008 35.022 112.620 61.396 1.00 0.00 O ATOM 97710 H1 WAT 7008 34.824 112.219 62.243 1.00 0.00 H ATOM 97711 H2 WAT 7008 34.518 112.106 60.765 1.00 0.00 H TER 97713 WAT 7008 ATOM 97713 O WAT 7009 117.655 67.772 133.600 1.00 0.00 O ATOM 97714 H1 WAT 7009 118.421 67.292 133.916 1.00 0.00 H ATOM 97715 H2 WAT 7009 117.130 67.113 133.146 1.00 0.00 H TER 97717 WAT 7009 ATOM 97717 O WAT 7010 53.670 117.817 140.979 1.00 0.00 O ATOM 97718 H1 WAT 7010 53.532 116.975 140.545 1.00 0.00 H ATOM 97719 H2 WAT 7010 52.801 118.217 141.007 1.00 0.00 H TER 97721 WAT 7010 ATOM 97721 O WAT 7011 46.597 8.940 97.336 1.00 0.00 O ATOM 97722 H1 WAT 7011 46.599 9.166 98.266 1.00 0.00 H ATOM 97723 H2 WAT 7011 47.523 8.869 97.105 1.00 0.00 H TER 97725 WAT 7011 ATOM 97725 O WAT 7012 74.420 36.034 136.901 1.00 0.00 O ATOM 97726 H1 WAT 7012 74.292 35.671 136.025 1.00 0.00 H ATOM 97727 H2 WAT 7012 73.704 35.667 137.420 1.00 0.00 H TER 97729 WAT 7012 ATOM 97729 O WAT 7013 105.181 82.862 18.344 1.00 0.00 O ATOM 97730 H1 WAT 7013 105.292 83.135 19.254 1.00 0.00 H ATOM 97731 H2 WAT 7013 105.537 81.974 18.316 1.00 0.00 H TER 97733 WAT 7013 ATOM 97733 O WAT 7014 111.646 141.921 12.211 1.00 0.00 O ATOM 97734 H1 WAT 7014 111.044 141.372 12.713 1.00 0.00 H ATOM 97735 H2 WAT 7014 111.079 142.541 11.751 1.00 0.00 H TER 97737 WAT 7014 ATOM 97737 O WAT 7015 40.185 135.927 59.434 1.00 0.00 O ATOM 97738 H1 WAT 7015 40.006 135.547 58.574 1.00 0.00 H ATOM 97739 H2 WAT 7015 39.543 136.631 59.523 1.00 0.00 H TER 97741 WAT 7015 ATOM 97741 O WAT 7016 33.779 62.857 153.757 1.00 0.00 O ATOM 97742 H1 WAT 7016 34.181 62.905 154.624 1.00 0.00 H ATOM 97743 H2 WAT 7016 32.970 63.363 153.840 1.00 0.00 H TER 97745 WAT 7016 ATOM 97745 O WAT 7017 117.767 75.288 146.025 1.00 0.00 O ATOM 97746 H1 WAT 7017 117.700 74.999 146.935 1.00 0.00 H ATOM 97747 H2 WAT 7017 117.487 76.203 146.043 1.00 0.00 H TER 97749 WAT 7017 ATOM 97749 O WAT 7018 98.207 142.869 24.548 1.00 0.00 O ATOM 97750 H1 WAT 7018 97.858 143.743 24.373 1.00 0.00 H ATOM 97751 H2 WAT 7018 97.508 142.273 24.277 1.00 0.00 H TER 97753 WAT 7018 ATOM 97753 O WAT 7019 6.221 106.736 77.089 1.00 0.00 O ATOM 97754 H1 WAT 7019 5.701 106.093 76.607 1.00 0.00 H ATOM 97755 H2 WAT 7019 6.075 107.559 76.624 1.00 0.00 H TER 97757 WAT 7019 ATOM 97757 O WAT 7020 4.887 1.875 110.491 1.00 0.00 O ATOM 97758 H1 WAT 7020 5.401 2.353 111.141 1.00 0.00 H ATOM 97759 H2 WAT 7020 4.000 1.860 110.851 1.00 0.00 H TER 97761 WAT 7020 ATOM 97761 O WAT 7021 130.533 81.805 72.359 1.00 0.00 O ATOM 97762 H1 WAT 7021 130.801 82.170 73.202 1.00 0.00 H ATOM 97763 H2 WAT 7021 129.902 81.122 72.583 1.00 0.00 H TER 97765 WAT 7021 ATOM 97765 O WAT 7022 144.929 49.817 82.026 1.00 0.00 O ATOM 97766 H1 WAT 7022 145.873 49.957 82.102 1.00 0.00 H ATOM 97767 H2 WAT 7022 144.789 49.621 81.100 1.00 0.00 H TER 97769 WAT 7022 ATOM 97769 O WAT 7023 78.934 48.825 95.694 1.00 0.00 O ATOM 97770 H1 WAT 7023 79.414 49.653 95.665 1.00 0.00 H ATOM 97771 H2 WAT 7023 79.552 48.203 96.078 1.00 0.00 H TER 97773 WAT 7023 ATOM 97773 O WAT 7024 77.106 130.597 19.727 1.00 0.00 O ATOM 97774 H1 WAT 7024 76.885 131.377 20.236 1.00 0.00 H ATOM 97775 H2 WAT 7024 78.062 130.560 19.748 1.00 0.00 H TER 97777 WAT 7024 ATOM 97777 O WAT 7025 12.242 136.630 75.609 1.00 0.00 O ATOM 97778 H1 WAT 7025 12.856 137.090 76.181 1.00 0.00 H ATOM 97779 H2 WAT 7025 11.399 137.051 75.774 1.00 0.00 H TER 97781 WAT 7025 ATOM 97781 O WAT 7026 3.780 80.179 105.519 1.00 0.00 O ATOM 97782 H1 WAT 7026 2.914 80.061 105.129 1.00 0.00 H ATOM 97783 H2 WAT 7026 3.747 79.676 106.333 1.00 0.00 H TER 97785 WAT 7026 ATOM 97785 O WAT 7027 10.761 113.953 107.174 1.00 0.00 O ATOM 97786 H1 WAT 7027 11.526 114.424 107.504 1.00 0.00 H ATOM 97787 H2 WAT 7027 10.615 113.255 107.813 1.00 0.00 H TER 97789 WAT 7027 ATOM 97789 O WAT 7028 73.847 145.788 68.320 1.00 0.00 O ATOM 97790 H1 WAT 7028 72.995 146.095 68.630 1.00 0.00 H ATOM 97791 H2 WAT 7028 73.926 144.902 68.674 1.00 0.00 H TER 97793 WAT 7028 ATOM 97793 O WAT 7029 122.964 2.186 101.786 1.00 0.00 O ATOM 97794 H1 WAT 7029 123.638 2.061 102.454 1.00 0.00 H ATOM 97795 H2 WAT 7029 123.193 3.015 101.366 1.00 0.00 H TER 97797 WAT 7029 ATOM 97797 O WAT 7030 24.618 73.094 148.614 1.00 0.00 O ATOM 97798 H1 WAT 7030 24.080 72.304 148.655 1.00 0.00 H ATOM 97799 H2 WAT 7030 24.776 73.325 149.529 1.00 0.00 H TER 97801 WAT 7030 ATOM 97801 O WAT 7031 132.579 38.807 94.250 1.00 0.00 O ATOM 97802 H1 WAT 7031 133.178 39.534 94.418 1.00 0.00 H ATOM 97803 H2 WAT 7031 131.907 38.890 94.926 1.00 0.00 H TER 97805 WAT 7031 ATOM 97805 O WAT 7032 51.580 7.517 145.238 1.00 0.00 O ATOM 97806 H1 WAT 7032 51.961 6.994 145.943 1.00 0.00 H ATOM 97807 H2 WAT 7032 50.673 7.216 145.180 1.00 0.00 H TER 97809 WAT 7032 ATOM 97809 O WAT 7033 134.258 59.571 95.375 1.00 0.00 O ATOM 97810 H1 WAT 7033 133.408 59.995 95.494 1.00 0.00 H ATOM 97811 H2 WAT 7033 134.065 58.634 95.413 1.00 0.00 H TER 97813 WAT 7033 ATOM 97813 O WAT 7034 22.802 29.090 142.459 1.00 0.00 O ATOM 97814 H1 WAT 7034 22.665 28.186 142.740 1.00 0.00 H ATOM 97815 H2 WAT 7034 23.256 29.014 141.620 1.00 0.00 H TER 97817 WAT 7034 ATOM 97817 O WAT 7035 6.103 135.181 124.216 1.00 0.00 O ATOM 97818 H1 WAT 7035 6.720 135.861 123.946 1.00 0.00 H ATOM 97819 H2 WAT 7035 5.742 134.846 123.395 1.00 0.00 H TER 97821 WAT 7035 ATOM 97821 O WAT 7036 42.234 80.168 155.972 1.00 0.00 O ATOM 97822 H1 WAT 7036 42.680 79.772 156.721 1.00 0.00 H ATOM 97823 H2 WAT 7036 42.229 81.105 156.164 1.00 0.00 H TER 97825 WAT 7036 ATOM 97825 O WAT 7037 52.509 92.359 137.490 1.00 0.00 O ATOM 97826 H1 WAT 7037 52.982 93.137 137.787 1.00 0.00 H ATOM 97827 H2 WAT 7037 52.906 92.144 136.646 1.00 0.00 H TER 97829 WAT 7037 ATOM 97829 O WAT 7038 47.895 32.084 128.255 1.00 0.00 O ATOM 97830 H1 WAT 7038 48.443 31.637 127.610 1.00 0.00 H ATOM 97831 H2 WAT 7038 47.781 32.967 127.903 1.00 0.00 H TER 97833 WAT 7038 ATOM 97833 O WAT 7039 78.646 58.390 91.749 1.00 0.00 O ATOM 97834 H1 WAT 7039 77.879 58.661 92.254 1.00 0.00 H ATOM 97835 H2 WAT 7039 78.284 57.941 90.985 1.00 0.00 H TER 97837 WAT 7039 ATOM 97837 O WAT 7040 22.162 134.559 82.889 1.00 0.00 O ATOM 97838 H1 WAT 7040 21.446 134.116 83.345 1.00 0.00 H ATOM 97839 H2 WAT 7040 22.949 134.086 83.162 1.00 0.00 H TER 97841 WAT 7040 ATOM 97841 O WAT 7041 50.660 110.807 128.552 1.00 0.00 O ATOM 97842 H1 WAT 7041 50.816 111.001 127.627 1.00 0.00 H ATOM 97843 H2 WAT 7041 51.500 110.479 128.873 1.00 0.00 H TER 97845 WAT 7041 ATOM 97845 O WAT 7042 48.517 87.576 127.192 1.00 0.00 O ATOM 97846 H1 WAT 7042 49.238 87.352 127.780 1.00 0.00 H ATOM 97847 H2 WAT 7042 48.938 88.021 126.456 1.00 0.00 H TER 97849 WAT 7042 ATOM 97849 O WAT 7043 72.007 75.519 139.324 1.00 0.00 O ATOM 97850 H1 WAT 7043 71.428 74.875 138.917 1.00 0.00 H ATOM 97851 H2 WAT 7043 71.874 75.400 140.264 1.00 0.00 H TER 97853 WAT 7043 ATOM 97853 O WAT 7044 23.228 142.246 130.664 1.00 0.00 O ATOM 97854 H1 WAT 7044 23.495 143.082 131.047 1.00 0.00 H ATOM 97855 H2 WAT 7044 22.398 142.040 131.095 1.00 0.00 H TER 97857 WAT 7044 ATOM 97857 O WAT 7045 140.689 93.193 133.888 1.00 0.00 O ATOM 97858 H1 WAT 7045 139.758 93.379 134.008 1.00 0.00 H ATOM 97859 H2 WAT 7045 141.046 93.996 133.507 1.00 0.00 H TER 97861 WAT 7045 ATOM 97861 O WAT 7046 52.958 68.818 141.666 1.00 0.00 O ATOM 97862 H1 WAT 7046 52.200 68.492 142.149 1.00 0.00 H ATOM 97863 H2 WAT 7046 52.626 68.988 140.784 1.00 0.00 H TER 97865 WAT 7046 ATOM 97865 O WAT 7047 132.252 28.793 145.633 1.00 0.00 O ATOM 97866 H1 WAT 7047 131.520 29.200 145.169 1.00 0.00 H ATOM 97867 H2 WAT 7047 132.876 28.566 144.944 1.00 0.00 H TER 97869 WAT 7047 ATOM 97869 O WAT 7048 40.176 44.997 115.531 1.00 0.00 O ATOM 97870 H1 WAT 7048 40.690 45.252 114.764 1.00 0.00 H ATOM 97871 H2 WAT 7048 40.603 44.203 115.852 1.00 0.00 H TER 97873 WAT 7048 ATOM 97873 O WAT 7049 14.290 55.986 131.052 1.00 0.00 O ATOM 97874 H1 WAT 7049 13.473 56.445 131.248 1.00 0.00 H ATOM 97875 H2 WAT 7049 14.970 56.526 131.453 1.00 0.00 H TER 97877 WAT 7049 ATOM 97877 O WAT 7050 27.622 144.210 17.091 1.00 0.00 O ATOM 97878 H1 WAT 7050 28.074 144.987 16.763 1.00 0.00 H ATOM 97879 H2 WAT 7050 27.312 143.764 16.303 1.00 0.00 H TER 97881 WAT 7050 ATOM 97881 O WAT 7051 64.389 46.959 155.855 1.00 0.00 O ATOM 97882 H1 WAT 7051 64.220 46.301 156.529 1.00 0.00 H ATOM 97883 H2 WAT 7051 64.213 47.795 156.287 1.00 0.00 H TER 97885 WAT 7051 ATOM 97885 O WAT 7052 30.793 40.015 87.727 1.00 0.00 O ATOM 97886 H1 WAT 7052 29.853 40.129 87.873 1.00 0.00 H ATOM 97887 H2 WAT 7052 30.850 39.330 87.061 1.00 0.00 H TER 97889 WAT 7052 ATOM 97889 O WAT 7053 68.065 98.717 105.303 1.00 0.00 O ATOM 97890 H1 WAT 7053 67.811 98.302 106.128 1.00 0.00 H ATOM 97891 H2 WAT 7053 67.256 98.749 104.793 1.00 0.00 H TER 97893 WAT 7053 ATOM 97893 O WAT 7054 66.270 113.684 151.078 1.00 0.00 O ATOM 97894 H1 WAT 7054 66.192 113.070 151.808 1.00 0.00 H ATOM 97895 H2 WAT 7054 67.188 113.627 150.814 1.00 0.00 H TER 97897 WAT 7054 ATOM 97897 O WAT 7055 112.804 142.761 139.858 1.00 0.00 O ATOM 97898 H1 WAT 7055 112.807 143.235 139.027 1.00 0.00 H ATOM 97899 H2 WAT 7055 113.339 143.299 140.442 1.00 0.00 H TER 97901 WAT 7055 ATOM 97901 O WAT 7056 131.480 72.430 69.172 1.00 0.00 O ATOM 97902 H1 WAT 7056 130.805 72.412 69.851 1.00 0.00 H ATOM 97903 H2 WAT 7056 132.116 71.770 69.449 1.00 0.00 H TER 97905 WAT 7056 ATOM 97905 O WAT 7057 10.927 2.527 127.170 1.00 0.00 O ATOM 97906 H1 WAT 7057 11.554 3.250 127.182 1.00 0.00 H ATOM 97907 H2 WAT 7057 10.769 2.362 126.241 1.00 0.00 H TER 97909 WAT 7057 ATOM 97909 O WAT 7058 127.787 103.609 82.755 1.00 0.00 O ATOM 97910 H1 WAT 7058 128.053 103.963 83.603 1.00 0.00 H ATOM 97911 H2 WAT 7058 128.511 103.038 82.496 1.00 0.00 H TER 97913 WAT 7058 ATOM 97913 O WAT 7059 129.499 44.092 147.855 1.00 0.00 O ATOM 97914 H1 WAT 7059 129.154 44.105 148.748 1.00 0.00 H ATOM 97915 H2 WAT 7059 129.881 43.219 147.758 1.00 0.00 H TER 97917 WAT 7059 ATOM 97917 O WAT 7060 0.846 122.767 56.515 1.00 0.00 O ATOM 97918 H1 WAT 7060 0.633 123.658 56.791 1.00 0.00 H ATOM 97919 H2 WAT 7060 1.486 122.880 55.812 1.00 0.00 H TER 97921 WAT 7060 ATOM 97921 O WAT 7061 139.827 3.822 130.230 1.00 0.00 O ATOM 97922 H1 WAT 7061 139.159 4.269 130.751 1.00 0.00 H ATOM 97923 H2 WAT 7061 139.571 2.900 130.252 1.00 0.00 H TER 97925 WAT 7061 ATOM 97925 O WAT 7062 102.111 68.404 108.084 1.00 0.00 O ATOM 97926 H1 WAT 7062 101.262 68.443 108.524 1.00 0.00 H ATOM 97927 H2 WAT 7062 102.712 68.848 108.682 1.00 0.00 H TER 97929 WAT 7062 ATOM 97929 O WAT 7063 131.946 49.500 70.859 1.00 0.00 O ATOM 97930 H1 WAT 7063 132.864 49.685 70.661 1.00 0.00 H ATOM 97931 H2 WAT 7063 131.778 48.652 70.447 1.00 0.00 H TER 97933 WAT 7063 ATOM 97933 O WAT 7064 145.497 58.170 79.929 1.00 0.00 O ATOM 97934 H1 WAT 7064 145.953 57.329 79.903 1.00 0.00 H ATOM 97935 H2 WAT 7064 144.993 58.146 80.742 1.00 0.00 H TER 97937 WAT 7064 ATOM 97937 O WAT 7065 77.216 27.395 58.020 1.00 0.00 O ATOM 97938 H1 WAT 7065 77.073 28.198 57.518 1.00 0.00 H ATOM 97939 H2 WAT 7065 76.984 26.691 57.415 1.00 0.00 H TER 97941 WAT 7065 ATOM 97941 O WAT 7066 133.903 101.986 70.626 1.00 0.00 O ATOM 97942 H1 WAT 7066 134.090 102.733 70.058 1.00 0.00 H ATOM 97943 H2 WAT 7066 134.444 101.278 70.276 1.00 0.00 H TER 97945 WAT 7066 ATOM 97945 O WAT 7067 112.066 89.793 136.544 1.00 0.00 O ATOM 97946 H1 WAT 7067 111.967 89.986 137.477 1.00 0.00 H ATOM 97947 H2 WAT 7067 112.466 88.924 136.520 1.00 0.00 H TER 97949 WAT 7067 ATOM 97949 O WAT 7068 133.603 122.327 152.678 1.00 0.00 O ATOM 97950 H1 WAT 7068 132.917 122.991 152.617 1.00 0.00 H ATOM 97951 H2 WAT 7068 133.442 121.893 153.516 1.00 0.00 H TER 97953 WAT 7068 ATOM 97953 O WAT 7069 102.618 58.593 117.259 1.00 0.00 O ATOM 97954 H1 WAT 7069 102.038 58.884 117.963 1.00 0.00 H ATOM 97955 H2 WAT 7069 102.088 57.979 116.750 1.00 0.00 H TER 97957 WAT 7069 ATOM 97957 O WAT 7070 37.690 26.020 71.517 1.00 0.00 O ATOM 97958 H1 WAT 7070 36.910 25.523 71.764 1.00 0.00 H ATOM 97959 H2 WAT 7070 37.376 26.918 71.406 1.00 0.00 H TER 97961 WAT 7070 ATOM 97961 O WAT 7071 23.111 52.164 75.201 1.00 0.00 O ATOM 97962 H1 WAT 7071 23.520 52.284 74.344 1.00 0.00 H ATOM 97963 H2 WAT 7071 22.998 53.053 75.539 1.00 0.00 H TER 97965 WAT 7071 ATOM 97965 O WAT 7072 60.180 103.874 20.572 1.00 0.00 O ATOM 97966 H1 WAT 7072 59.870 103.041 20.927 1.00 0.00 H ATOM 97967 H2 WAT 7072 60.442 103.669 19.675 1.00 0.00 H TER 97969 WAT 7072 ATOM 97969 O WAT 7073 46.330 132.359 63.798 1.00 0.00 O ATOM 97970 H1 WAT 7073 47.022 132.459 63.144 1.00 0.00 H ATOM 97971 H2 WAT 7073 45.521 132.321 63.288 1.00 0.00 H TER 97973 WAT 7073 ATOM 97973 O WAT 7074 38.517 111.540 51.840 1.00 0.00 O ATOM 97974 H1 WAT 7074 37.636 111.599 52.209 1.00 0.00 H ATOM 97975 H2 WAT 7074 39.089 111.878 52.529 1.00 0.00 H TER 97977 WAT 7074 ATOM 97977 O WAT 7075 84.311 4.788 92.091 1.00 0.00 O ATOM 97978 H1 WAT 7075 84.180 4.668 93.031 1.00 0.00 H ATOM 97979 H2 WAT 7075 83.598 4.295 91.685 1.00 0.00 H TER 97981 WAT 7075 ATOM 97981 O WAT 7076 94.961 129.484 6.916 1.00 0.00 O ATOM 97982 H1 WAT 7076 95.829 129.888 6.926 1.00 0.00 H ATOM 97983 H2 WAT 7076 94.423 130.061 7.458 1.00 0.00 H TER 97985 WAT 7076 ATOM 97985 O WAT 7077 111.059 110.117 114.425 1.00 0.00 O ATOM 97986 H1 WAT 7077 110.326 110.381 113.868 1.00 0.00 H ATOM 97987 H2 WAT 7077 111.789 109.995 113.819 1.00 0.00 H TER 97989 WAT 7077 ATOM 97989 O WAT 7078 51.190 22.357 117.795 1.00 0.00 O ATOM 97990 H1 WAT 7078 50.764 21.967 117.032 1.00 0.00 H ATOM 97991 H2 WAT 7078 51.735 23.056 117.435 1.00 0.00 H TER 97993 WAT 7078 ATOM 97993 O WAT 7079 22.498 10.839 91.548 1.00 0.00 O ATOM 97994 H1 WAT 7079 22.611 11.486 90.851 1.00 0.00 H ATOM 97995 H2 WAT 7079 22.959 10.062 91.230 1.00 0.00 H TER 97997 WAT 7079 ATOM 97997 O WAT 7080 122.833 6.935 60.591 1.00 0.00 O ATOM 97998 H1 WAT 7080 122.774 6.065 60.195 1.00 0.00 H ATOM 97999 H2 WAT 7080 123.644 7.303 60.239 1.00 0.00 H TER 98001 WAT 7080 ATOM 98001 O WAT 7081 83.403 70.170 101.112 1.00 0.00 O ATOM 98002 H1 WAT 7081 82.672 70.786 101.063 1.00 0.00 H ATOM 98003 H2 WAT 7081 83.594 70.099 102.048 1.00 0.00 H TER 98005 WAT 7081 ATOM 98005 O WAT 7082 55.478 31.349 100.848 1.00 0.00 O ATOM 98006 H1 WAT 7082 56.028 30.863 101.462 1.00 0.00 H ATOM 98007 H2 WAT 7082 54.679 30.826 100.778 1.00 0.00 H TER 98009 WAT 7082 ATOM 98009 O WAT 7083 86.694 45.284 131.411 1.00 0.00 O ATOM 98010 H1 WAT 7083 86.976 44.483 130.969 1.00 0.00 H ATOM 98011 H2 WAT 7083 86.011 45.643 130.844 1.00 0.00 H TER 98013 WAT 7083 ATOM 98013 O WAT 7084 5.037 11.574 118.843 1.00 0.00 O ATOM 98014 H1 WAT 7084 5.528 12.274 119.274 1.00 0.00 H ATOM 98015 H2 WAT 7084 5.693 11.104 118.328 1.00 0.00 H TER 98017 WAT 7084 ATOM 98017 O WAT 7085 124.269 135.970 75.270 1.00 0.00 O ATOM 98018 H1 WAT 7085 124.215 135.250 75.898 1.00 0.00 H ATOM 98019 H2 WAT 7085 123.812 135.646 74.493 1.00 0.00 H TER 98021 WAT 7085 ATOM 98021 O WAT 7086 60.291 121.931 71.701 1.00 0.00 O ATOM 98022 H1 WAT 7086 60.272 122.871 71.523 1.00 0.00 H ATOM 98023 H2 WAT 7086 61.200 121.750 71.940 1.00 0.00 H TER 98025 WAT 7086 ATOM 98025 O WAT 7087 54.501 75.899 84.741 1.00 0.00 O ATOM 98026 H1 WAT 7087 55.069 76.139 84.008 1.00 0.00 H ATOM 98027 H2 WAT 7087 54.531 76.657 85.325 1.00 0.00 H TER 98029 WAT 7087 ATOM 98029 O WAT 7088 41.314 107.298 11.942 1.00 0.00 O ATOM 98030 H1 WAT 7088 40.895 106.881 12.695 1.00 0.00 H ATOM 98031 H2 WAT 7088 41.249 108.236 12.121 1.00 0.00 H TER 98033 WAT 7088 ATOM 98033 O WAT 7089 9.656 52.895 16.755 1.00 0.00 O ATOM 98034 H1 WAT 7089 8.859 52.400 16.565 1.00 0.00 H ATOM 98035 H2 WAT 7089 9.380 53.558 17.388 1.00 0.00 H TER 98037 WAT 7089 ATOM 98037 O WAT 7090 135.885 94.568 109.030 1.00 0.00 O ATOM 98038 H1 WAT 7090 135.763 93.622 109.114 1.00 0.00 H ATOM 98039 H2 WAT 7090 136.246 94.838 109.875 1.00 0.00 H TER 98041 WAT 7090 ATOM 98041 O WAT 7091 113.982 30.280 20.767 1.00 0.00 O ATOM 98042 H1 WAT 7091 113.914 31.194 21.046 1.00 0.00 H ATOM 98043 H2 WAT 7091 113.082 30.023 20.566 1.00 0.00 H TER 98045 WAT 7091 ATOM 98045 O WAT 7092 117.218 8.018 110.354 1.00 0.00 O ATOM 98046 H1 WAT 7092 117.447 8.780 110.886 1.00 0.00 H ATOM 98047 H2 WAT 7092 116.550 8.340 109.750 1.00 0.00 H TER 98049 WAT 7092 ATOM 98049 O WAT 7093 61.072 122.696 152.816 1.00 0.00 O ATOM 98050 H1 WAT 7093 60.340 123.293 152.661 1.00 0.00 H ATOM 98051 H2 WAT 7093 60.933 122.373 153.706 1.00 0.00 H TER 98053 WAT 7093 ATOM 98053 O WAT 7094 121.957 1.224 137.211 1.00 0.00 O ATOM 98054 H1 WAT 7094 122.860 1.009 137.442 1.00 0.00 H ATOM 98055 H2 WAT 7094 122.029 1.716 136.393 1.00 0.00 H TER 98057 WAT 7094 ATOM 98057 O WAT 7095 105.879 100.363 133.474 1.00 0.00 O ATOM 98058 H1 WAT 7095 106.436 99.590 133.379 1.00 0.00 H ATOM 98059 H2 WAT 7095 105.595 100.342 134.388 1.00 0.00 H TER 98061 WAT 7095 ATOM 98061 O WAT 7096 51.712 129.491 93.033 1.00 0.00 O ATOM 98062 H1 WAT 7096 52.027 130.127 92.390 1.00 0.00 H ATOM 98063 H2 WAT 7096 51.593 128.684 92.533 1.00 0.00 H TER 98065 WAT 7096 ATOM 98065 O WAT 7097 59.838 78.348 10.680 1.00 0.00 O ATOM 98066 H1 WAT 7097 59.720 77.814 11.466 1.00 0.00 H ATOM 98067 H2 WAT 7097 60.540 77.912 10.197 1.00 0.00 H TER 98069 WAT 7097 ATOM 98069 O WAT 7098 68.006 85.279 153.584 1.00 0.00 O ATOM 98070 H1 WAT 7098 67.606 84.452 153.852 1.00 0.00 H ATOM 98071 H2 WAT 7098 68.090 85.778 154.396 1.00 0.00 H TER 98073 WAT 7098 ATOM 98073 O WAT 7099 124.572 22.034 69.733 1.00 0.00 O ATOM 98074 H1 WAT 7099 124.030 22.419 69.044 1.00 0.00 H ATOM 98075 H2 WAT 7099 124.312 21.113 69.756 1.00 0.00 H TER 98077 WAT 7099 ATOM 98077 O WAT 7100 97.471 129.794 3.181 1.00 0.00 O ATOM 98078 H1 WAT 7100 97.453 130.192 2.311 1.00 0.00 H ATOM 98079 H2 WAT 7100 98.156 129.128 3.126 1.00 0.00 H TER 98081 WAT 7100 ATOM 98081 O WAT 7101 115.927 71.109 84.725 1.00 0.00 O ATOM 98082 H1 WAT 7101 115.926 70.576 83.930 1.00 0.00 H ATOM 98083 H2 WAT 7101 116.257 70.522 85.406 1.00 0.00 H TER 98085 WAT 7101 ATOM 98085 O WAT 7102 75.445 88.135 145.435 1.00 0.00 O ATOM 98086 H1 WAT 7102 74.755 88.505 144.885 1.00 0.00 H ATOM 98087 H2 WAT 7102 76.061 88.856 145.564 1.00 0.00 H TER 98089 WAT 7102 ATOM 98089 O WAT 7103 35.156 33.201 62.377 1.00 0.00 O ATOM 98090 H1 WAT 7103 35.807 32.502 62.440 1.00 0.00 H ATOM 98091 H2 WAT 7103 35.665 33.984 62.164 1.00 0.00 H TER 98093 WAT 7103 ATOM 98093 O WAT 7104 120.955 87.152 147.737 1.00 0.00 O ATOM 98094 H1 WAT 7104 120.309 87.061 148.438 1.00 0.00 H ATOM 98095 H2 WAT 7104 121.641 87.703 148.113 1.00 0.00 H TER 98097 WAT 7104 ATOM 98097 O WAT 7105 13.585 6.889 20.413 1.00 0.00 O ATOM 98098 H1 WAT 7105 12.645 7.068 20.412 1.00 0.00 H ATOM 98099 H2 WAT 7105 13.981 7.685 20.057 1.00 0.00 H TER 98101 WAT 7105 ATOM 98101 O WAT 7106 54.579 62.459 149.022 1.00 0.00 O ATOM 98102 H1 WAT 7106 55.145 62.955 148.429 1.00 0.00 H ATOM 98103 H2 WAT 7106 55.003 61.604 149.098 1.00 0.00 H TER 98105 WAT 7106 ATOM 98105 O WAT 7107 12.743 107.018 2.973 1.00 0.00 O ATOM 98106 H1 WAT 7107 13.317 106.549 3.578 1.00 0.00 H ATOM 98107 H2 WAT 7107 12.586 107.862 3.397 1.00 0.00 H TER 98109 WAT 7107 ATOM 98109 O WAT 7108 27.455 101.343 71.460 1.00 0.00 O ATOM 98110 H1 WAT 7108 26.824 100.627 71.385 1.00 0.00 H ATOM 98111 H2 WAT 7108 27.211 101.952 70.763 1.00 0.00 H TER 98113 WAT 7108 ATOM 98113 O WAT 7109 17.597 130.056 112.719 1.00 0.00 O ATOM 98114 H1 WAT 7109 16.765 130.443 112.991 1.00 0.00 H ATOM 98115 H2 WAT 7109 17.664 129.249 113.230 1.00 0.00 H TER 98117 WAT 7109 ATOM 98117 O WAT 7110 68.406 128.902 11.401 1.00 0.00 O ATOM 98118 H1 WAT 7110 67.455 128.812 11.342 1.00 0.00 H ATOM 98119 H2 WAT 7110 68.668 128.253 12.054 1.00 0.00 H TER 98121 WAT 7110 ATOM 98121 O WAT 7111 70.643 77.103 106.349 1.00 0.00 O ATOM 98122 H1 WAT 7111 71.290 76.757 106.963 1.00 0.00 H ATOM 98123 H2 WAT 7111 69.800 76.815 106.700 1.00 0.00 H TER 98125 WAT 7111 ATOM 98125 O WAT 7112 47.745 18.113 114.061 1.00 0.00 O ATOM 98126 H1 WAT 7112 47.106 18.696 114.470 1.00 0.00 H ATOM 98127 H2 WAT 7112 47.216 17.477 113.580 1.00 0.00 H TER 98129 WAT 7112 ATOM 98129 O WAT 7113 69.265 137.009 14.323 1.00 0.00 O ATOM 98130 H1 WAT 7113 69.603 136.400 14.980 1.00 0.00 H ATOM 98131 H2 WAT 7113 68.730 137.627 14.822 1.00 0.00 H TER 98133 WAT 7113 ATOM 98133 O WAT 7114 50.720 63.313 144.161 1.00 0.00 O ATOM 98134 H1 WAT 7114 51.040 62.411 144.166 1.00 0.00 H ATOM 98135 H2 WAT 7114 51.425 63.820 144.563 1.00 0.00 H TER 98137 WAT 7114 ATOM 98137 O WAT 7115 6.336 86.332 22.654 1.00 0.00 O ATOM 98138 H1 WAT 7115 6.908 85.581 22.498 1.00 0.00 H ATOM 98139 H2 WAT 7115 5.454 85.961 22.675 1.00 0.00 H TER 98141 WAT 7115 ATOM 98141 O WAT 7116 64.358 33.358 152.614 1.00 0.00 O ATOM 98142 H1 WAT 7116 63.702 33.141 151.952 1.00 0.00 H ATOM 98143 H2 WAT 7116 64.526 34.292 152.488 1.00 0.00 H TER 98145 WAT 7116 ATOM 98145 O WAT 7117 30.556 120.932 113.559 1.00 0.00 O ATOM 98146 H1 WAT 7117 30.856 121.831 113.422 1.00 0.00 H ATOM 98147 H2 WAT 7117 31.341 120.458 113.834 1.00 0.00 H TER 98149 WAT 7117 ATOM 98149 O WAT 7118 110.261 134.054 70.130 1.00 0.00 O ATOM 98150 H1 WAT 7118 110.089 134.941 69.813 1.00 0.00 H ATOM 98151 H2 WAT 7118 110.701 134.181 70.971 1.00 0.00 H TER 98153 WAT 7118 ATOM 98153 O WAT 7119 97.144 76.326 113.314 1.00 0.00 O ATOM 98154 H1 WAT 7119 96.881 75.453 113.024 1.00 0.00 H ATOM 98155 H2 WAT 7119 97.236 76.245 114.263 1.00 0.00 H TER 98157 WAT 7119 ATOM 98157 O WAT 7120 0.536 57.874 141.573 1.00 0.00 O ATOM 98158 H1 WAT 7120 -0.360 57.559 141.453 1.00 0.00 H ATOM 98159 H2 WAT 7120 0.590 58.656 141.024 1.00 0.00 H TER 98161 WAT 7120 ATOM 98161 O WAT 7121 39.249 102.058 99.440 1.00 0.00 O ATOM 98162 H1 WAT 7121 38.699 101.417 99.890 1.00 0.00 H ATOM 98163 H2 WAT 7121 38.874 102.121 98.562 1.00 0.00 H TER 98165 WAT 7121 ATOM 98165 O WAT 7122 63.189 27.015 56.257 1.00 0.00 O ATOM 98166 H1 WAT 7122 63.992 26.567 56.521 1.00 0.00 H ATOM 98167 H2 WAT 7122 63.115 27.751 56.864 1.00 0.00 H TER 98169 WAT 7122 ATOM 98169 O WAT 7123 143.115 7.411 111.267 1.00 0.00 O ATOM 98170 H1 WAT 7123 142.666 8.177 110.908 1.00 0.00 H ATOM 98171 H2 WAT 7123 142.414 6.879 111.644 1.00 0.00 H TER 98173 WAT 7123 ATOM 98173 O WAT 7124 125.182 9.469 143.007 1.00 0.00 O ATOM 98174 H1 WAT 7124 125.777 10.214 142.930 1.00 0.00 H ATOM 98175 H2 WAT 7124 124.665 9.655 143.791 1.00 0.00 H TER 98177 WAT 7124 ATOM 98177 O WAT 7125 89.104 37.399 115.855 1.00 0.00 O ATOM 98178 H1 WAT 7125 88.224 37.043 115.734 1.00 0.00 H ATOM 98179 H2 WAT 7125 89.358 37.118 116.734 1.00 0.00 H TER 98181 WAT 7125 ATOM 98181 O WAT 7126 38.125 62.223 100.752 1.00 0.00 O ATOM 98182 H1 WAT 7126 38.303 61.533 100.114 1.00 0.00 H ATOM 98183 H2 WAT 7126 37.170 62.293 100.770 1.00 0.00 H TER 98185 WAT 7126 ATOM 98185 O WAT 7127 130.663 60.101 16.436 1.00 0.00 O ATOM 98186 H1 WAT 7127 130.437 59.331 16.957 1.00 0.00 H ATOM 98187 H2 WAT 7127 130.228 60.828 16.883 1.00 0.00 H TER 98189 WAT 7127 ATOM 98189 O WAT 7128 74.770 85.427 85.416 1.00 0.00 O ATOM 98190 H1 WAT 7128 75.403 85.607 84.722 1.00 0.00 H ATOM 98191 H2 WAT 7128 74.767 86.222 85.950 1.00 0.00 H TER 98193 WAT 7128 ATOM 98193 O WAT 7129 131.088 9.715 94.588 1.00 0.00 O ATOM 98194 H1 WAT 7129 132.008 9.500 94.735 1.00 0.00 H ATOM 98195 H2 WAT 7129 130.902 9.386 93.708 1.00 0.00 H TER 98197 WAT 7129 ATOM 98197 O WAT 7130 50.661 69.989 12.189 1.00 0.00 O ATOM 98198 H1 WAT 7130 50.954 70.880 11.995 1.00 0.00 H ATOM 98199 H2 WAT 7130 49.968 69.821 11.551 1.00 0.00 H TER 98201 WAT 7130 ATOM 98201 O WAT 7131 96.951 60.591 148.053 1.00 0.00 O ATOM 98202 H1 WAT 7131 97.837 60.947 148.124 1.00 0.00 H ATOM 98203 H2 WAT 7131 96.969 59.795 148.584 1.00 0.00 H TER 98205 WAT 7131 ATOM 98205 O WAT 7132 134.538 44.161 26.179 1.00 0.00 O ATOM 98206 H1 WAT 7132 134.940 43.397 25.765 1.00 0.00 H ATOM 98207 H2 WAT 7132 133.606 44.078 25.981 1.00 0.00 H TER 98209 WAT 7132 ATOM 98209 O WAT 7133 40.881 10.402 54.877 1.00 0.00 O ATOM 98210 H1 WAT 7133 41.568 9.790 54.613 1.00 0.00 H ATOM 98211 H2 WAT 7133 40.068 9.986 54.592 1.00 0.00 H TER 98213 WAT 7133 ATOM 98213 O WAT 7134 93.090 105.542 108.006 1.00 0.00 O ATOM 98214 H1 WAT 7134 93.920 105.097 107.834 1.00 0.00 H ATOM 98215 H2 WAT 7134 92.613 105.487 107.178 1.00 0.00 H TER 98217 WAT 7134 ATOM 98217 O WAT 7135 7.078 41.742 80.449 1.00 0.00 O ATOM 98218 H1 WAT 7135 7.697 42.012 79.770 1.00 0.00 H ATOM 98219 H2 WAT 7135 7.127 42.436 81.107 1.00 0.00 H TER 98221 WAT 7135 ATOM 98221 O WAT 7136 102.198 132.501 13.360 1.00 0.00 O ATOM 98222 H1 WAT 7136 101.975 133.242 13.924 1.00 0.00 H ATOM 98223 H2 WAT 7136 103.138 132.595 13.202 1.00 0.00 H TER 98225 WAT 7136 ATOM 98225 O WAT 7137 36.838 135.892 132.297 1.00 0.00 O ATOM 98226 H1 WAT 7137 37.266 136.707 132.036 1.00 0.00 H ATOM 98227 H2 WAT 7137 37.061 135.272 131.602 1.00 0.00 H TER 98229 WAT 7137 ATOM 98229 O WAT 7138 122.785 129.423 110.267 1.00 0.00 O ATOM 98230 H1 WAT 7138 122.957 130.335 110.032 1.00 0.00 H ATOM 98231 H2 WAT 7138 122.014 129.463 110.833 1.00 0.00 H TER 98233 WAT 7138 ATOM 98233 O WAT 7139 20.856 80.568 86.841 1.00 0.00 O ATOM 98234 H1 WAT 7139 20.113 80.009 87.068 1.00 0.00 H ATOM 98235 H2 WAT 7139 21.088 80.308 85.950 1.00 0.00 H TER 98237 WAT 7139 ATOM 98237 O WAT 7140 126.100 92.967 66.038 1.00 0.00 O ATOM 98238 H1 WAT 7140 126.511 93.061 65.178 1.00 0.00 H ATOM 98239 H2 WAT 7140 126.409 93.725 66.535 1.00 0.00 H TER 98241 WAT 7140 ATOM 98241 O WAT 7141 96.885 134.789 115.654 1.00 0.00 O ATOM 98242 H1 WAT 7141 97.736 135.111 115.950 1.00 0.00 H ATOM 98243 H2 WAT 7141 96.893 133.857 115.873 1.00 0.00 H TER 98245 WAT 7141 ATOM 98245 O WAT 7142 138.927 98.945 19.318 1.00 0.00 O ATOM 98246 H1 WAT 7142 138.081 99.393 19.341 1.00 0.00 H ATOM 98247 H2 WAT 7142 139.197 98.898 20.236 1.00 0.00 H TER 98249 WAT 7142 ATOM 98249 O WAT 7143 98.820 56.005 84.926 1.00 0.00 O ATOM 98250 H1 WAT 7143 98.068 55.789 84.374 1.00 0.00 H ATOM 98251 H2 WAT 7143 98.963 55.219 85.453 1.00 0.00 H TER 98253 WAT 7143 ATOM 98253 O WAT 7144 8.270 63.074 98.462 1.00 0.00 O ATOM 98254 H1 WAT 7144 8.781 63.882 98.408 1.00 0.00 H ATOM 98255 H2 WAT 7144 8.272 62.729 97.569 1.00 0.00 H TER 98257 WAT 7144 ATOM 98257 O WAT 7145 98.842 78.432 94.490 1.00 0.00 O ATOM 98258 H1 WAT 7145 99.203 77.776 95.085 1.00 0.00 H ATOM 98259 H2 WAT 7145 97.926 78.518 94.753 1.00 0.00 H TER 98261 WAT 7145 ATOM 98261 O WAT 7146 40.315 123.867 102.295 1.00 0.00 O ATOM 98262 H1 WAT 7146 39.483 123.753 101.836 1.00 0.00 H ATOM 98263 H2 WAT 7146 40.823 124.449 101.730 1.00 0.00 H TER 98265 WAT 7146 ATOM 98265 O WAT 7147 90.871 9.571 53.217 1.00 0.00 O ATOM 98266 H1 WAT 7147 90.670 8.821 52.657 1.00 0.00 H ATOM 98267 H2 WAT 7147 91.513 9.237 53.844 1.00 0.00 H TER 98269 WAT 7147 ATOM 98269 O WAT 7148 75.291 33.505 112.901 1.00 0.00 O ATOM 98270 H1 WAT 7148 75.724 32.657 112.798 1.00 0.00 H ATOM 98271 H2 WAT 7148 75.627 33.847 113.729 1.00 0.00 H TER 98273 WAT 7148 ATOM 98273 O WAT 7149 129.752 88.737 88.314 1.00 0.00 O ATOM 98274 H1 WAT 7149 130.323 88.220 88.882 1.00 0.00 H ATOM 98275 H2 WAT 7149 130.344 89.126 87.670 1.00 0.00 H TER 98277 WAT 7149 ATOM 98277 O WAT 7150 95.351 17.164 153.560 1.00 0.00 O ATOM 98278 H1 WAT 7150 94.728 17.891 153.560 1.00 0.00 H ATOM 98279 H2 WAT 7150 96.050 17.448 152.971 1.00 0.00 H TER 98281 WAT 7150 ATOM 98281 O WAT 7151 143.622 106.513 134.323 1.00 0.00 O ATOM 98282 H1 WAT 7151 142.905 105.992 134.684 1.00 0.00 H ATOM 98283 H2 WAT 7151 144.412 106.131 134.706 1.00 0.00 H TER 98285 WAT 7151 ATOM 98285 O WAT 7152 18.759 115.975 86.522 1.00 0.00 O ATOM 98286 H1 WAT 7152 18.467 116.023 85.612 1.00 0.00 H ATOM 98287 H2 WAT 7152 18.369 115.168 86.857 1.00 0.00 H TER 98289 WAT 7152 ATOM 98289 O WAT 7153 38.502 85.612 83.225 1.00 0.00 O ATOM 98290 H1 WAT 7153 38.284 86.055 84.045 1.00 0.00 H ATOM 98291 H2 WAT 7153 38.123 84.738 83.317 1.00 0.00 H TER 98293 WAT 7153 ATOM 98293 O WAT 7154 12.872 133.502 14.919 1.00 0.00 O ATOM 98294 H1 WAT 7154 12.307 132.741 15.047 1.00 0.00 H ATOM 98295 H2 WAT 7154 13.628 133.338 15.482 1.00 0.00 H TER 98297 WAT 7154 ATOM 98297 O WAT 7155 16.007 80.401 1.688 1.00 0.00 O ATOM 98298 H1 WAT 7155 15.751 81.323 1.713 1.00 0.00 H ATOM 98299 H2 WAT 7155 16.908 80.394 2.009 1.00 0.00 H TER 98301 WAT 7155 ATOM 98301 O WAT 7156 136.689 1.830 106.342 1.00 0.00 O ATOM 98302 H1 WAT 7156 136.113 1.665 105.596 1.00 0.00 H ATOM 98303 H2 WAT 7156 137.522 2.091 105.949 1.00 0.00 H TER 98305 WAT 7156 ATOM 98305 O WAT 7157 126.351 82.854 83.713 1.00 0.00 O ATOM 98306 H1 WAT 7157 125.449 83.153 83.829 1.00 0.00 H ATOM 98307 H2 WAT 7157 126.785 83.575 83.256 1.00 0.00 H TER 98309 WAT 7157 ATOM 98309 O WAT 7158 8.158 142.545 22.655 1.00 0.00 O ATOM 98310 H1 WAT 7158 8.005 143.089 23.428 1.00 0.00 H ATOM 98311 H2 WAT 7158 7.505 142.841 22.021 1.00 0.00 H TER 98313 WAT 7158 ATOM 98313 O WAT 7159 88.643 45.196 152.876 1.00 0.00 O ATOM 98314 H1 WAT 7159 89.276 45.348 153.578 1.00 0.00 H ATOM 98315 H2 WAT 7159 88.835 45.875 152.229 1.00 0.00 H TER 98317 WAT 7159 ATOM 98317 O WAT 7160 23.349 145.361 145.221 1.00 0.00 O ATOM 98318 H1 WAT 7160 22.873 145.030 144.459 1.00 0.00 H ATOM 98319 H2 WAT 7160 22.706 145.345 145.930 1.00 0.00 H TER 98321 WAT 7160 ATOM 98321 O WAT 7161 65.634 74.335 143.184 1.00 0.00 O ATOM 98322 H1 WAT 7161 65.370 74.539 144.081 1.00 0.00 H ATOM 98323 H2 WAT 7161 65.395 75.114 142.681 1.00 0.00 H TER 98325 WAT 7161 ATOM 98325 O WAT 7162 23.855 90.541 1.823 1.00 0.00 O ATOM 98326 H1 WAT 7162 24.002 91.285 1.239 1.00 0.00 H ATOM 98327 H2 WAT 7162 24.079 90.872 2.693 1.00 0.00 H TER 98329 WAT 7162 ATOM 98329 O WAT 7163 59.842 32.943 145.537 1.00 0.00 O ATOM 98330 H1 WAT 7163 60.276 32.364 146.164 1.00 0.00 H ATOM 98331 H2 WAT 7163 59.643 32.380 144.789 1.00 0.00 H TER 98333 WAT 7163 ATOM 98333 O WAT 7164 124.826 76.146 84.147 1.00 0.00 O ATOM 98334 H1 WAT 7164 125.593 76.606 83.806 1.00 0.00 H ATOM 98335 H2 WAT 7164 124.807 75.320 83.664 1.00 0.00 H TER 98337 WAT 7164 ATOM 98337 O WAT 7165 103.112 42.379 26.746 1.00 0.00 O ATOM 98338 H1 WAT 7165 103.565 43.008 27.308 1.00 0.00 H ATOM 98339 H2 WAT 7165 102.239 42.301 27.130 1.00 0.00 H TER 98341 WAT 7165 ATOM 98341 O WAT 7166 19.275 17.385 2.073 1.00 0.00 O ATOM 98342 H1 WAT 7166 19.135 17.723 2.957 1.00 0.00 H ATOM 98343 H2 WAT 7166 19.733 16.554 2.204 1.00 0.00 H TER 98345 WAT 7166 ATOM 98345 O WAT 7167 59.318 46.049 147.407 1.00 0.00 O ATOM 98346 H1 WAT 7167 59.981 45.393 147.193 1.00 0.00 H ATOM 98347 H2 WAT 7167 58.621 45.553 147.837 1.00 0.00 H TER 98349 WAT 7167 ATOM 98349 O WAT 7168 107.082 65.962 141.555 1.00 0.00 O ATOM 98350 H1 WAT 7168 107.709 65.308 141.863 1.00 0.00 H ATOM 98351 H2 WAT 7168 107.578 66.495 140.934 1.00 0.00 H TER 98353 WAT 7168 ATOM 98353 O WAT 7169 55.521 100.866 144.131 1.00 0.00 O ATOM 98354 H1 WAT 7169 55.318 99.931 144.166 1.00 0.00 H ATOM 98355 H2 WAT 7169 55.950 100.986 143.284 1.00 0.00 H TER 98357 WAT 7169 ATOM 98357 O WAT 7170 84.113 115.547 154.703 1.00 0.00 O ATOM 98358 H1 WAT 7170 83.789 115.741 155.583 1.00 0.00 H ATOM 98359 H2 WAT 7170 83.488 114.912 154.353 1.00 0.00 H TER 98361 WAT 7170 ATOM 98361 O WAT 7171 119.912 128.151 0.587 1.00 0.00 O ATOM 98362 H1 WAT 7171 120.439 128.940 0.714 1.00 0.00 H ATOM 98363 H2 WAT 7171 120.437 127.603 0.003 1.00 0.00 H TER 98365 WAT 7171 ATOM 98365 O WAT 7172 81.662 106.307 63.368 1.00 0.00 O ATOM 98366 H1 WAT 7172 81.663 105.795 62.560 1.00 0.00 H ATOM 98367 H2 WAT 7172 80.871 106.844 63.310 1.00 0.00 H TER 98369 WAT 7172 ATOM 98369 O WAT 7173 32.831 11.398 106.059 1.00 0.00 O ATOM 98370 H1 WAT 7173 32.630 10.656 105.489 1.00 0.00 H ATOM 98371 H2 WAT 7173 32.556 11.112 106.930 1.00 0.00 H TER 98373 WAT 7173 ATOM 98373 O WAT 7174 101.560 8.462 82.040 1.00 0.00 O ATOM 98374 H1 WAT 7174 100.942 8.915 82.614 1.00 0.00 H ATOM 98375 H2 WAT 7174 102.133 7.980 82.637 1.00 0.00 H TER 98377 WAT 7174 ATOM 98377 O WAT 7175 113.538 131.138 152.680 1.00 0.00 O ATOM 98378 H1 WAT 7175 113.074 131.467 153.450 1.00 0.00 H ATOM 98379 H2 WAT 7175 114.465 131.240 152.896 1.00 0.00 H TER 98381 WAT 7175 ATOM 98381 O WAT 7176 66.670 52.288 102.208 1.00 0.00 O ATOM 98382 H1 WAT 7176 67.362 51.629 102.266 1.00 0.00 H ATOM 98383 H2 WAT 7176 67.121 53.121 102.344 1.00 0.00 H TER 98385 WAT 7176 ATOM 98385 O WAT 7177 0.797 2.998 126.559 1.00 0.00 O ATOM 98386 H1 WAT 7177 0.447 2.133 126.771 1.00 0.00 H ATOM 98387 H2 WAT 7177 1.698 2.831 126.284 1.00 0.00 H TER 98389 WAT 7177 ATOM 98389 O WAT 7178 97.800 34.028 83.990 1.00 0.00 O ATOM 98390 H1 WAT 7178 98.198 34.863 83.743 1.00 0.00 H ATOM 98391 H2 WAT 7178 97.691 34.085 84.939 1.00 0.00 H TER 98393 WAT 7178 ATOM 98393 O WAT 7179 25.002 132.209 66.813 1.00 0.00 O ATOM 98394 H1 WAT 7179 25.079 131.301 67.106 1.00 0.00 H ATOM 98395 H2 WAT 7179 25.185 132.730 67.594 1.00 0.00 H TER 98397 WAT 7179 ATOM 98397 O WAT 7180 129.647 78.957 152.528 1.00 0.00 O ATOM 98398 H1 WAT 7180 129.413 78.201 153.068 1.00 0.00 H ATOM 98399 H2 WAT 7180 130.098 79.550 153.129 1.00 0.00 H TER 98401 WAT 7180 ATOM 98401 O WAT 7181 15.455 110.525 130.119 1.00 0.00 O ATOM 98402 H1 WAT 7181 15.229 111.027 129.336 1.00 0.00 H ATOM 98403 H2 WAT 7181 14.627 110.137 130.402 1.00 0.00 H TER 98405 WAT 7181 ATOM 98405 O WAT 7182 105.244 3.913 155.718 1.00 0.00 O ATOM 98406 H1 WAT 7182 105.071 4.683 156.259 1.00 0.00 H ATOM 98407 H2 WAT 7182 104.723 4.053 154.928 1.00 0.00 H TER 98409 WAT 7182 ATOM 98409 O WAT 7183 104.973 22.563 92.382 1.00 0.00 O ATOM 98410 H1 WAT 7183 104.200 23.122 92.465 1.00 0.00 H ATOM 98411 H2 WAT 7183 104.642 21.754 91.992 1.00 0.00 H TER 98413 WAT 7183 ATOM 98413 O WAT 7184 90.824 80.404 117.142 1.00 0.00 O ATOM 98414 H1 WAT 7184 90.967 80.227 118.072 1.00 0.00 H ATOM 98415 H2 WAT 7184 90.235 81.158 117.130 1.00 0.00 H TER 98417 WAT 7184 ATOM 98417 O WAT 7185 86.783 73.874 157.274 1.00 0.00 O ATOM 98418 H1 WAT 7185 86.146 74.323 156.718 1.00 0.00 H ATOM 98419 H2 WAT 7185 87.186 73.224 156.700 1.00 0.00 H TER 98421 WAT 7185 ATOM 98421 O WAT 7186 143.677 79.677 89.740 1.00 0.00 O ATOM 98422 H1 WAT 7186 143.816 78.730 89.762 1.00 0.00 H ATOM 98423 H2 WAT 7186 142.752 79.789 89.955 1.00 0.00 H TER 98425 WAT 7186 ATOM 98425 O WAT 7187 94.353 76.565 84.998 1.00 0.00 O ATOM 98426 H1 WAT 7187 94.166 77.468 85.256 1.00 0.00 H ATOM 98427 H2 WAT 7187 95.041 76.642 84.337 1.00 0.00 H TER 98429 WAT 7187 ATOM 98429 O WAT 7188 11.608 37.727 91.301 1.00 0.00 O ATOM 98430 H1 WAT 7188 11.175 37.298 90.563 1.00 0.00 H ATOM 98431 H2 WAT 7188 12.226 38.335 90.896 1.00 0.00 H TER 98433 WAT 7188 ATOM 98433 O WAT 7189 131.646 144.774 54.273 1.00 0.00 O ATOM 98434 H1 WAT 7189 131.478 143.844 54.118 1.00 0.00 H ATOM 98435 H2 WAT 7189 131.797 144.836 55.217 1.00 0.00 H TER 98437 WAT 7189 ATOM 98437 O WAT 7190 89.497 99.297 62.983 1.00 0.00 O ATOM 98438 H1 WAT 7190 89.639 98.518 63.520 1.00 0.00 H ATOM 98439 H2 WAT 7190 89.971 99.118 62.171 1.00 0.00 H TER 98441 WAT 7190 ATOM 98441 O WAT 7191 83.875 127.180 69.683 1.00 0.00 O ATOM 98442 H1 WAT 7191 84.548 126.851 70.278 1.00 0.00 H ATOM 98443 H2 WAT 7191 83.327 127.743 70.230 1.00 0.00 H TER 98445 WAT 7191 ATOM 98445 O WAT 7192 112.224 66.642 133.408 1.00 0.00 O ATOM 98446 H1 WAT 7192 111.725 66.506 132.603 1.00 0.00 H ATOM 98447 H2 WAT 7192 112.864 67.317 133.183 1.00 0.00 H TER 98449 WAT 7192 ATOM 98449 O WAT 7193 81.681 98.125 142.468 1.00 0.00 O ATOM 98450 H1 WAT 7193 81.421 97.625 141.694 1.00 0.00 H ATOM 98451 H2 WAT 7193 81.296 98.991 142.333 1.00 0.00 H TER 98453 WAT 7193 ATOM 98453 O WAT 7194 33.887 45.087 86.026 1.00 0.00 O ATOM 98454 H1 WAT 7194 32.962 44.842 86.007 1.00 0.00 H ATOM 98455 H2 WAT 7194 34.228 44.675 86.819 1.00 0.00 H TER 98457 WAT 7194 ATOM 98457 O WAT 7195 57.333 32.275 113.912 1.00 0.00 O ATOM 98458 H1 WAT 7195 58.125 32.812 113.940 1.00 0.00 H ATOM 98459 H2 WAT 7195 56.660 32.819 114.321 1.00 0.00 H TER 98461 WAT 7195 ATOM 98461 O WAT 7196 109.924 82.959 146.217 1.00 0.00 O ATOM 98462 H1 WAT 7196 109.177 82.361 146.219 1.00 0.00 H ATOM 98463 H2 WAT 7196 110.538 82.573 145.592 1.00 0.00 H TER 98465 WAT 7196 ATOM 98465 O WAT 7197 128.922 133.715 147.470 1.00 0.00 O ATOM 98466 H1 WAT 7197 128.169 133.442 147.995 1.00 0.00 H ATOM 98467 H2 WAT 7197 129.648 133.748 148.093 1.00 0.00 H TER 98469 WAT 7197 ATOM 98469 O WAT 7198 143.671 68.657 150.562 1.00 0.00 O ATOM 98470 H1 WAT 7198 144.086 67.935 150.090 1.00 0.00 H ATOM 98471 H2 WAT 7198 142.812 68.751 150.150 1.00 0.00 H TER 98473 WAT 7198 ATOM 98473 O WAT 7199 110.815 123.501 152.976 1.00 0.00 O ATOM 98474 H1 WAT 7199 111.177 123.699 153.840 1.00 0.00 H ATOM 98475 H2 WAT 7199 111.443 122.892 152.587 1.00 0.00 H TER 98477 WAT 7199 ATOM 98477 O WAT 7200 52.430 106.491 148.786 1.00 0.00 O ATOM 98478 H1 WAT 7200 51.743 105.833 148.679 1.00 0.00 H ATOM 98479 H2 WAT 7200 52.109 107.252 148.301 1.00 0.00 H TER 98481 WAT 7200 ATOM 98481 O WAT 7201 90.522 51.068 84.195 1.00 0.00 O ATOM 98482 H1 WAT 7201 90.962 50.650 83.455 1.00 0.00 H ATOM 98483 H2 WAT 7201 89.594 51.061 83.958 1.00 0.00 H TER 98485 WAT 7201 ATOM 98485 O WAT 7202 36.715 48.868 6.832 1.00 0.00 O ATOM 98486 H1 WAT 7202 35.844 48.873 7.229 1.00 0.00 H ATOM 98487 H2 WAT 7202 36.976 49.789 6.814 1.00 0.00 H TER 98489 WAT 7202 ATOM 98489 O WAT 7203 59.928 52.855 148.033 1.00 0.00 O ATOM 98490 H1 WAT 7203 60.160 53.667 148.484 1.00 0.00 H ATOM 98491 H2 WAT 7203 59.181 52.513 148.525 1.00 0.00 H TER 98493 WAT 7203 ATOM 98493 O WAT 7204 26.164 11.369 143.801 1.00 0.00 O ATOM 98494 H1 WAT 7204 26.421 10.461 143.965 1.00 0.00 H ATOM 98495 H2 WAT 7204 26.929 11.762 143.382 1.00 0.00 H TER 98497 WAT 7204 ATOM 98497 O WAT 7205 90.384 114.157 82.972 1.00 0.00 O ATOM 98498 H1 WAT 7205 89.878 114.241 83.780 1.00 0.00 H ATOM 98499 H2 WAT 7205 89.740 114.267 82.272 1.00 0.00 H TER 98501 WAT 7205 ATOM 98501 O WAT 7206 51.601 70.717 135.685 1.00 0.00 O ATOM 98502 H1 WAT 7206 51.561 71.667 135.574 1.00 0.00 H ATOM 98503 H2 WAT 7206 50.740 70.479 136.027 1.00 0.00 H TER 98505 WAT 7206 ATOM 98505 O WAT 7207 69.579 138.158 130.421 1.00 0.00 O ATOM 98506 H1 WAT 7207 69.423 137.214 130.407 1.00 0.00 H ATOM 98507 H2 WAT 7207 70.531 138.243 130.475 1.00 0.00 H TER 98509 WAT 7207 ATOM 98509 O WAT 7208 60.031 31.027 132.990 1.00 0.00 O ATOM 98510 H1 WAT 7208 60.920 30.783 132.732 1.00 0.00 H ATOM 98511 H2 WAT 7208 59.479 30.330 132.637 1.00 0.00 H TER 98513 WAT 7208 ATOM 98513 O WAT 7209 119.417 3.215 71.725 1.00 0.00 O ATOM 98514 H1 WAT 7209 120.328 3.462 71.883 1.00 0.00 H ATOM 98515 H2 WAT 7209 119.357 3.113 70.775 1.00 0.00 H TER 98517 WAT 7209 ATOM 98517 O WAT 7210 28.240 98.079 64.243 1.00 0.00 O ATOM 98518 H1 WAT 7210 27.947 98.908 63.864 1.00 0.00 H ATOM 98519 H2 WAT 7210 29.046 98.300 64.709 1.00 0.00 H TER 98521 WAT 7210 ATOM 98521 O WAT 7211 138.056 34.601 11.639 1.00 0.00 O ATOM 98522 H1 WAT 7211 137.573 34.180 10.928 1.00 0.00 H ATOM 98523 H2 WAT 7211 138.587 35.269 11.206 1.00 0.00 H TER 98525 WAT 7211 ATOM 98525 O WAT 7212 134.771 78.107 139.216 1.00 0.00 O ATOM 98526 H1 WAT 7212 135.668 78.255 138.918 1.00 0.00 H ATOM 98527 H2 WAT 7212 134.377 78.980 139.233 1.00 0.00 H TER 98529 WAT 7212 ATOM 98529 O WAT 7213 80.520 114.209 107.964 1.00 0.00 O ATOM 98530 H1 WAT 7213 80.405 114.280 108.912 1.00 0.00 H ATOM 98531 H2 WAT 7213 80.405 115.103 107.641 1.00 0.00 H TER 98533 WAT 7213 ATOM 98533 O WAT 7214 35.990 15.730 83.908 1.00 0.00 O ATOM 98534 H1 WAT 7214 36.004 15.303 83.051 1.00 0.00 H ATOM 98535 H2 WAT 7214 35.384 16.464 83.799 1.00 0.00 H TER 98537 WAT 7214 ATOM 98537 O WAT 7215 38.119 46.210 155.307 1.00 0.00 O ATOM 98538 H1 WAT 7215 37.187 46.036 155.180 1.00 0.00 H ATOM 98539 H2 WAT 7215 38.562 45.573 154.747 1.00 0.00 H TER 98541 WAT 7215 ATOM 98541 O WAT 7216 10.338 103.991 13.598 1.00 0.00 O ATOM 98542 H1 WAT 7216 10.960 103.990 14.325 1.00 0.00 H ATOM 98543 H2 WAT 7216 9.774 103.235 13.764 1.00 0.00 H TER 98545 WAT 7216 ATOM 98545 O WAT 7217 74.085 66.532 69.546 1.00 0.00 O ATOM 98546 H1 WAT 7217 74.214 65.604 69.740 1.00 0.00 H ATOM 98547 H2 WAT 7217 73.143 66.617 69.399 1.00 0.00 H TER 98549 WAT 7217 ATOM 98549 O WAT 7218 58.266 91.156 96.748 1.00 0.00 O ATOM 98550 H1 WAT 7218 57.859 90.992 97.598 1.00 0.00 H ATOM 98551 H2 WAT 7218 57.841 91.952 96.428 1.00 0.00 H TER 98553 WAT 7218 ATOM 98553 O WAT 7219 94.146 132.777 119.021 1.00 0.00 O ATOM 98554 H1 WAT 7219 93.382 133.026 119.541 1.00 0.00 H ATOM 98555 H2 WAT 7219 94.840 133.366 119.318 1.00 0.00 H TER 98557 WAT 7219 ATOM 98557 O WAT 7220 63.996 43.176 91.982 1.00 0.00 O ATOM 98558 H1 WAT 7220 64.057 42.242 91.784 1.00 0.00 H ATOM 98559 H2 WAT 7220 63.056 43.344 92.057 1.00 0.00 H TER 98561 WAT 7220 ATOM 98561 O WAT 7221 109.050 97.358 137.732 1.00 0.00 O ATOM 98562 H1 WAT 7221 109.506 98.195 137.816 1.00 0.00 H ATOM 98563 H2 WAT 7221 108.703 97.186 138.607 1.00 0.00 H TER 98565 WAT 7221 ATOM 98565 O WAT 7222 57.732 68.076 123.290 1.00 0.00 O ATOM 98566 H1 WAT 7222 58.032 68.428 124.128 1.00 0.00 H ATOM 98567 H2 WAT 7222 57.430 67.192 123.496 1.00 0.00 H TER 98569 WAT 7222 ATOM 98569 O WAT 7223 43.210 25.411 127.589 1.00 0.00 O ATOM 98570 H1 WAT 7223 43.535 25.353 128.487 1.00 0.00 H ATOM 98571 H2 WAT 7223 43.322 24.528 127.237 1.00 0.00 H TER 98573 WAT 7223 ATOM 98573 O WAT 7224 112.778 96.419 82.310 1.00 0.00 O ATOM 98574 H1 WAT 7224 113.186 96.813 83.081 1.00 0.00 H ATOM 98575 H2 WAT 7224 111.923 96.843 82.248 1.00 0.00 H TER 98577 WAT 7224 ATOM 98577 O WAT 7225 56.689 24.172 83.317 1.00 0.00 O ATOM 98578 H1 WAT 7225 57.235 24.553 84.005 1.00 0.00 H ATOM 98579 H2 WAT 7225 56.935 24.649 82.524 1.00 0.00 H TER 98581 WAT 7225 ATOM 98581 O WAT 7226 104.073 47.319 86.561 1.00 0.00 O ATOM 98582 H1 WAT 7226 104.209 47.924 85.832 1.00 0.00 H ATOM 98583 H2 WAT 7226 104.873 47.387 87.081 1.00 0.00 H TER 98585 WAT 7226 ATOM 98585 O WAT 7227 32.859 72.327 18.473 1.00 0.00 O ATOM 98586 H1 WAT 7227 32.647 72.919 19.195 1.00 0.00 H ATOM 98587 H2 WAT 7227 33.237 71.557 18.898 1.00 0.00 H TER 98589 WAT 7227 ATOM 98589 O WAT 7228 127.189 62.931 12.352 1.00 0.00 O ATOM 98590 H1 WAT 7228 127.651 63.661 12.763 1.00 0.00 H ATOM 98591 H2 WAT 7228 126.343 63.297 12.094 1.00 0.00 H TER 98593 WAT 7228 ATOM 98593 O WAT 7229 118.031 70.172 71.402 1.00 0.00 O ATOM 98594 H1 WAT 7229 117.254 70.322 71.941 1.00 0.00 H ATOM 98595 H2 WAT 7229 118.143 69.221 71.402 1.00 0.00 H TER 98597 WAT 7229 ATOM 98597 O WAT 7230 111.235 16.997 12.906 1.00 0.00 O ATOM 98598 H1 WAT 7230 111.189 16.240 12.323 1.00 0.00 H ATOM 98599 H2 WAT 7230 111.367 17.743 12.321 1.00 0.00 H TER 98601 WAT 7230 ATOM 98601 O WAT 7231 6.506 79.677 147.156 1.00 0.00 O ATOM 98602 H1 WAT 7231 6.355 80.078 148.012 1.00 0.00 H ATOM 98603 H2 WAT 7231 6.653 78.751 147.347 1.00 0.00 H TER 98605 WAT 7231 ATOM 98605 O WAT 7232 55.453 26.261 153.863 1.00 0.00 O ATOM 98606 H1 WAT 7232 55.969 27.048 153.686 1.00 0.00 H ATOM 98607 H2 WAT 7232 54.929 26.486 154.631 1.00 0.00 H TER 98609 WAT 7232 ATOM 98609 O WAT 7233 136.427 107.936 120.119 1.00 0.00 O ATOM 98610 H1 WAT 7233 136.203 107.717 119.214 1.00 0.00 H ATOM 98611 H2 WAT 7233 135.844 108.662 120.340 1.00 0.00 H TER 98613 WAT 7233 ATOM 98613 O WAT 7234 63.050 114.862 136.955 1.00 0.00 O ATOM 98614 H1 WAT 7234 62.996 114.121 136.351 1.00 0.00 H ATOM 98615 H2 WAT 7234 63.045 115.633 136.388 1.00 0.00 H TER 98617 WAT 7234 ATOM 98617 O WAT 7235 137.452 11.166 66.418 1.00 0.00 O ATOM 98618 H1 WAT 7235 137.574 10.885 67.325 1.00 0.00 H ATOM 98619 H2 WAT 7235 138.278 11.590 66.184 1.00 0.00 H TER 98621 WAT 7235 ATOM 98621 O WAT 7236 44.275 86.969 107.636 1.00 0.00 O ATOM 98622 H1 WAT 7236 44.945 86.781 108.294 1.00 0.00 H ATOM 98623 H2 WAT 7236 43.479 86.566 107.983 1.00 0.00 H TER 98625 WAT 7236 ATOM 98625 O WAT 7237 140.862 32.433 107.568 1.00 0.00 O ATOM 98626 H1 WAT 7237 141.448 32.250 106.833 1.00 0.00 H ATOM 98627 H2 WAT 7237 141.387 32.965 108.166 1.00 0.00 H TER 98629 WAT 7237 ATOM 98629 O WAT 7238 5.763 139.893 109.524 1.00 0.00 O ATOM 98630 H1 WAT 7238 5.861 140.236 110.413 1.00 0.00 H ATOM 98631 H2 WAT 7238 4.894 140.184 109.249 1.00 0.00 H TER 98633 WAT 7238 ATOM 98633 O WAT 7239 32.353 73.040 158.277 1.00 0.00 O ATOM 98634 H1 WAT 7239 32.331 73.057 159.233 1.00 0.00 H ATOM 98635 H2 WAT 7239 33.186 73.452 158.048 1.00 0.00 H TER 98637 WAT 7239 ATOM 98637 O WAT 7240 108.377 62.049 105.959 1.00 0.00 O ATOM 98638 H1 WAT 7240 107.811 62.284 106.694 1.00 0.00 H ATOM 98639 H2 WAT 7240 107.771 61.827 105.252 1.00 0.00 H TER 98641 WAT 7240 ATOM 98641 O WAT 7241 23.697 29.656 98.478 1.00 0.00 O ATOM 98642 H1 WAT 7241 23.968 28.994 99.113 1.00 0.00 H ATOM 98643 H2 WAT 7241 24.474 30.201 98.354 1.00 0.00 H TER 98645 WAT 7241 ATOM 98645 O WAT 7242 60.479 129.512 131.523 1.00 0.00 O ATOM 98646 H1 WAT 7242 60.565 130.062 130.745 1.00 0.00 H ATOM 98647 H2 WAT 7242 60.082 130.085 132.179 1.00 0.00 H TER 98649 WAT 7242 ATOM 98649 O WAT 7243 65.877 90.621 1.508 1.00 0.00 O ATOM 98650 H1 WAT 7243 65.271 90.789 0.786 1.00 0.00 H ATOM 98651 H2 WAT 7243 66.733 90.880 1.167 1.00 0.00 H TER 98653 WAT 7243 ATOM 98653 O WAT 7244 9.498 135.052 95.360 1.00 0.00 O ATOM 98654 H1 WAT 7244 10.435 135.140 95.187 1.00 0.00 H ATOM 98655 H2 WAT 7244 9.213 135.937 95.590 1.00 0.00 H TER 98657 WAT 7244 ATOM 98657 O WAT 7245 4.976 6.925 22.685 1.00 0.00 O ATOM 98658 H1 WAT 7245 4.871 7.866 22.546 1.00 0.00 H ATOM 98659 H2 WAT 7245 4.082 6.595 22.779 1.00 0.00 H TER 98661 WAT 7245 ATOM 98661 O WAT 7246 65.170 120.821 61.833 1.00 0.00 O ATOM 98662 H1 WAT 7246 64.550 120.368 62.405 1.00 0.00 H ATOM 98663 H2 WAT 7246 66.031 120.566 62.165 1.00 0.00 H TER 98665 WAT 7246 ATOM 98665 O WAT 7247 89.260 37.405 108.563 1.00 0.00 O ATOM 98666 H1 WAT 7247 88.417 37.749 108.267 1.00 0.00 H ATOM 98667 H2 WAT 7247 89.534 38.007 109.256 1.00 0.00 H TER 98669 WAT 7247 ATOM 98669 O WAT 7248 10.372 131.613 94.488 1.00 0.00 O ATOM 98670 H1 WAT 7248 10.176 131.380 93.580 1.00 0.00 H ATOM 98671 H2 WAT 7248 9.551 131.968 94.827 1.00 0.00 H TER 98673 WAT 7248 ATOM 98673 O WAT 7249 41.264 32.955 3.523 1.00 0.00 O ATOM 98674 H1 WAT 7249 41.722 33.795 3.558 1.00 0.00 H ATOM 98675 H2 WAT 7249 40.421 33.124 3.944 1.00 0.00 H TER 98677 WAT 7249 ATOM 98677 O WAT 7250 123.540 2.965 74.317 1.00 0.00 O ATOM 98678 H1 WAT 7250 123.877 2.125 74.628 1.00 0.00 H ATOM 98679 H2 WAT 7250 124.316 3.520 74.238 1.00 0.00 H TER 98681 WAT 7250 ATOM 98681 O WAT 7251 89.727 117.625 74.852 1.00 0.00 O ATOM 98682 H1 WAT 7251 90.146 116.768 74.769 1.00 0.00 H ATOM 98683 H2 WAT 7251 89.313 117.607 75.715 1.00 0.00 H TER 98685 WAT 7251 ATOM 98685 O WAT 7252 142.668 72.805 101.303 1.00 0.00 O ATOM 98686 H1 WAT 7252 142.909 73.705 101.083 1.00 0.00 H ATOM 98687 H2 WAT 7252 141.955 72.896 101.935 1.00 0.00 H TER 98689 WAT 7252 ATOM 98689 O WAT 7253 31.139 14.997 8.992 1.00 0.00 O ATOM 98690 H1 WAT 7253 30.416 15.419 8.529 1.00 0.00 H ATOM 98691 H2 WAT 7253 31.768 14.777 8.305 1.00 0.00 H TER 98693 WAT 7253 ATOM 98693 O WAT 7254 6.149 84.911 158.333 1.00 0.00 O ATOM 98694 H1 WAT 7254 5.808 84.429 159.086 1.00 0.00 H ATOM 98695 H2 WAT 7254 5.715 84.515 157.578 1.00 0.00 H TER 98697 WAT 7254 ATOM 98697 O WAT 7255 104.611 109.136 131.470 1.00 0.00 O ATOM 98698 H1 WAT 7255 104.513 108.865 132.383 1.00 0.00 H ATOM 98699 H2 WAT 7255 103.831 109.660 131.291 1.00 0.00 H TER 98701 WAT 7255 ATOM 98701 O WAT 7256 33.271 37.337 93.895 1.00 0.00 O ATOM 98702 H1 WAT 7256 33.620 36.752 93.222 1.00 0.00 H ATOM 98703 H2 WAT 7256 32.324 37.318 93.761 1.00 0.00 H TER 98705 WAT 7256 ATOM 98705 O WAT 7257 48.807 126.230 71.318 1.00 0.00 O ATOM 98706 H1 WAT 7257 49.453 126.090 72.010 1.00 0.00 H ATOM 98707 H2 WAT 7257 49.308 126.163 70.505 1.00 0.00 H TER 98709 WAT 7257 ATOM 98709 O WAT 7258 78.724 48.595 72.204 1.00 0.00 O ATOM 98710 H1 WAT 7258 78.401 49.491 72.115 1.00 0.00 H ATOM 98711 H2 WAT 7258 79.645 48.646 71.947 1.00 0.00 H TER 98713 WAT 7258 ATOM 98713 O WAT 7259 54.617 72.805 81.848 1.00 0.00 O ATOM 98714 H1 WAT 7259 54.277 73.699 81.824 1.00 0.00 H ATOM 98715 H2 WAT 7259 54.075 72.325 81.221 1.00 0.00 H TER 98717 WAT 7259 ATOM 98717 O WAT 7260 76.474 77.859 62.199 1.00 0.00 O ATOM 98718 H1 WAT 7260 75.779 78.231 61.656 1.00 0.00 H ATOM 98719 H2 WAT 7260 76.692 78.554 62.819 1.00 0.00 H TER 98721 WAT 7260 ATOM 98721 O WAT 7261 48.815 12.964 129.614 1.00 0.00 O ATOM 98722 H1 WAT 7261 49.039 12.244 130.204 1.00 0.00 H ATOM 98723 H2 WAT 7261 49.641 13.430 129.481 1.00 0.00 H TER 98725 WAT 7261 ATOM 98725 O WAT 7262 7.649 69.996 91.579 1.00 0.00 O ATOM 98726 H1 WAT 7262 7.076 70.760 91.637 1.00 0.00 H ATOM 98727 H2 WAT 7262 8.255 70.204 90.868 1.00 0.00 H TER 98729 WAT 7262 ATOM 98729 O WAT 7263 131.143 110.935 65.827 1.00 0.00 O ATOM 98730 H1 WAT 7263 130.862 110.847 64.916 1.00 0.00 H ATOM 98731 H2 WAT 7263 131.868 110.316 65.915 1.00 0.00 H TER 98733 WAT 7263 ATOM 98733 O WAT 7264 58.429 63.860 99.269 1.00 0.00 O ATOM 98734 H1 WAT 7264 58.526 64.639 99.817 1.00 0.00 H ATOM 98735 H2 WAT 7264 59.091 63.251 99.598 1.00 0.00 H TER 98737 WAT 7264 ATOM 98737 O WAT 7265 69.110 65.826 67.256 1.00 0.00 O ATOM 98738 H1 WAT 7265 68.848 66.657 66.860 1.00 0.00 H ATOM 98739 H2 WAT 7265 69.111 65.203 66.530 1.00 0.00 H TER 98741 WAT 7265 ATOM 98741 O WAT 7266 23.272 107.368 144.608 1.00 0.00 O ATOM 98742 H1 WAT 7266 22.759 107.911 144.009 1.00 0.00 H ATOM 98743 H2 WAT 7266 23.048 107.696 145.479 1.00 0.00 H TER 98745 WAT 7266 ATOM 98745 O WAT 7267 45.137 29.706 82.887 1.00 0.00 O ATOM 98746 H1 WAT 7267 44.512 29.002 83.059 1.00 0.00 H ATOM 98747 H2 WAT 7267 44.876 30.056 82.035 1.00 0.00 H TER 98749 WAT 7267 ATOM 98749 O WAT 7268 95.751 120.285 74.581 1.00 0.00 O ATOM 98750 H1 WAT 7268 95.298 121.057 74.919 1.00 0.00 H ATOM 98751 H2 WAT 7268 95.133 119.896 73.962 1.00 0.00 H TER 98753 WAT 7268 ATOM 98753 O WAT 7269 72.350 122.593 65.678 1.00 0.00 O ATOM 98754 H1 WAT 7269 73.012 123.104 65.210 1.00 0.00 H ATOM 98755 H2 WAT 7269 71.579 123.160 65.696 1.00 0.00 H TER 98757 WAT 7269 ATOM 98757 O WAT 7270 145.249 121.831 76.039 1.00 0.00 O ATOM 98758 H1 WAT 7270 145.677 121.763 75.186 1.00 0.00 H ATOM 98759 H2 WAT 7270 144.395 122.220 75.849 1.00 0.00 H TER 98761 WAT 7270 ATOM 98761 O WAT 7271 68.509 21.577 71.746 1.00 0.00 O ATOM 98762 H1 WAT 7271 67.952 20.829 71.532 1.00 0.00 H ATOM 98763 H2 WAT 7271 68.775 21.930 70.897 1.00 0.00 H TER 98765 WAT 7271 ATOM 98765 O WAT 7272 92.015 117.943 139.444 1.00 0.00 O ATOM 98766 H1 WAT 7272 92.423 117.310 138.853 1.00 0.00 H ATOM 98767 H2 WAT 7272 92.291 117.667 140.318 1.00 0.00 H TER 98769 WAT 7272 ATOM 98769 O WAT 7273 95.625 100.814 129.895 1.00 0.00 O ATOM 98770 H1 WAT 7273 95.064 101.587 129.832 1.00 0.00 H ATOM 98771 H2 WAT 7273 96.372 101.103 130.420 1.00 0.00 H TER 98773 WAT 7273 ATOM 98773 O WAT 7274 36.120 80.059 91.220 1.00 0.00 O ATOM 98774 H1 WAT 7274 35.367 80.455 91.659 1.00 0.00 H ATOM 98775 H2 WAT 7274 36.345 79.304 91.763 1.00 0.00 H TER 98777 WAT 7274 ATOM 98777 O WAT 7275 129.455 8.516 105.614 1.00 0.00 O ATOM 98778 H1 WAT 7275 128.953 8.651 106.417 1.00 0.00 H ATOM 98779 H2 WAT 7275 129.410 9.356 105.158 1.00 0.00 H TER 98781 WAT 7275 ATOM 98781 O WAT 7276 39.745 69.313 152.503 1.00 0.00 O ATOM 98782 H1 WAT 7276 39.539 70.246 152.451 1.00 0.00 H ATOM 98783 H2 WAT 7276 39.048 68.943 153.044 1.00 0.00 H TER 98785 WAT 7276 ATOM 98785 O WAT 7277 87.532 122.911 65.949 1.00 0.00 O ATOM 98786 H1 WAT 7277 87.064 123.480 66.560 1.00 0.00 H ATOM 98787 H2 WAT 7277 87.542 123.401 65.127 1.00 0.00 H TER 98789 WAT 7277 ATOM 98789 O WAT 7278 21.889 44.928 16.533 1.00 0.00 O ATOM 98790 H1 WAT 7278 21.378 45.391 17.198 1.00 0.00 H ATOM 98791 H2 WAT 7278 21.455 44.080 16.445 1.00 0.00 H TER 98793 WAT 7278 ATOM 98793 O WAT 7279 104.779 90.676 128.940 1.00 0.00 O ATOM 98794 H1 WAT 7279 103.949 91.110 129.137 1.00 0.00 H ATOM 98795 H2 WAT 7279 104.887 90.035 129.642 1.00 0.00 H TER 98797 WAT 7279 ATOM 98797 O WAT 7280 93.669 32.965 85.242 1.00 0.00 O ATOM 98798 H1 WAT 7280 94.175 32.569 85.952 1.00 0.00 H ATOM 98799 H2 WAT 7280 93.098 33.597 85.679 1.00 0.00 H TER 98801 WAT 7280 ATOM 98801 O WAT 7281 20.421 44.358 119.622 1.00 0.00 O ATOM 98802 H1 WAT 7281 20.380 45.168 120.131 1.00 0.00 H ATOM 98803 H2 WAT 7281 20.686 43.691 120.256 1.00 0.00 H TER 98805 WAT 7281 ATOM 98805 O WAT 7282 25.637 134.123 76.656 1.00 0.00 O ATOM 98806 H1 WAT 7282 26.128 134.205 77.474 1.00 0.00 H ATOM 98807 H2 WAT 7282 25.736 133.204 76.408 1.00 0.00 H TER 98809 WAT 7282 ATOM 98809 O WAT 7283 100.581 2.555 12.761 1.00 0.00 O ATOM 98810 H1 WAT 7283 100.064 2.724 11.974 1.00 0.00 H ATOM 98811 H2 WAT 7283 101.470 2.410 12.438 1.00 0.00 H TER 98813 WAT 7283 ATOM 98813 O WAT 7284 76.655 21.056 13.899 1.00 0.00 O ATOM 98814 H1 WAT 7284 76.694 20.954 14.850 1.00 0.00 H ATOM 98815 H2 WAT 7284 77.499 21.441 13.665 1.00 0.00 H TER 98817 WAT 7284 ATOM 98817 O WAT 7285 51.412 145.954 155.437 1.00 0.00 O ATOM 98818 H1 WAT 7285 51.723 145.444 156.184 1.00 0.00 H ATOM 98819 H2 WAT 7285 50.472 146.055 155.591 1.00 0.00 H TER 98821 WAT 7285 ATOM 98821 O WAT 7286 38.570 101.192 76.812 1.00 0.00 O ATOM 98822 H1 WAT 7286 38.221 101.956 76.354 1.00 0.00 H ATOM 98823 H2 WAT 7286 38.553 101.438 77.737 1.00 0.00 H TER 98825 WAT 7286 ATOM 98825 O WAT 7287 116.493 128.385 114.457 1.00 0.00 O ATOM 98826 H1 WAT 7287 117.282 128.194 113.950 1.00 0.00 H ATOM 98827 H2 WAT 7287 115.921 128.848 113.845 1.00 0.00 H TER 98829 WAT 7287 ATOM 98829 O WAT 7288 2.156 59.444 60.911 1.00 0.00 O ATOM 98830 H1 WAT 7288 2.577 60.300 60.997 1.00 0.00 H ATOM 98831 H2 WAT 7288 2.529 59.073 60.112 1.00 0.00 H TER 98833 WAT 7288 ATOM 98833 O WAT 7289 63.232 20.729 84.099 1.00 0.00 O ATOM 98834 H1 WAT 7289 63.379 21.668 83.989 1.00 0.00 H ATOM 98835 H2 WAT 7289 63.257 20.376 83.209 1.00 0.00 H TER 98837 WAT 7289 ATOM 98837 O WAT 7290 132.978 16.218 156.648 1.00 0.00 O ATOM 98838 H1 WAT 7290 133.460 15.876 155.895 1.00 0.00 H ATOM 98839 H2 WAT 7290 132.638 17.063 156.352 1.00 0.00 H TER 98841 WAT 7290 ATOM 98841 O WAT 7291 102.319 128.042 70.038 1.00 0.00 O ATOM 98842 H1 WAT 7291 102.188 128.990 70.056 1.00 0.00 H ATOM 98843 H2 WAT 7291 101.915 127.761 69.217 1.00 0.00 H TER 98845 WAT 7291 ATOM 98845 O WAT 7292 115.799 99.718 88.325 1.00 0.00 O ATOM 98846 H1 WAT 7292 116.683 100.003 88.094 1.00 0.00 H ATOM 98847 H2 WAT 7292 115.628 98.973 87.750 1.00 0.00 H TER 98849 WAT 7292 ATOM 98849 O WAT 7293 41.068 46.683 3.964 1.00 0.00 O ATOM 98850 H1 WAT 7293 40.126 46.634 3.804 1.00 0.00 H ATOM 98851 H2 WAT 7293 41.165 47.385 4.608 1.00 0.00 H TER 98853 WAT 7293 ATOM 98853 O WAT 7294 87.683 116.940 72.996 1.00 0.00 O ATOM 98854 H1 WAT 7294 87.636 116.061 73.372 1.00 0.00 H ATOM 98855 H2 WAT 7294 88.415 117.356 73.451 1.00 0.00 H TER 98857 WAT 7294 ATOM 98857 O WAT 7295 39.292 107.403 64.277 1.00 0.00 O ATOM 98858 H1 WAT 7295 39.725 106.566 64.447 1.00 0.00 H ATOM 98859 H2 WAT 7295 38.361 107.219 64.398 1.00 0.00 H TER 98861 WAT 7295 ATOM 98861 O WAT 7296 38.597 135.345 152.739 1.00 0.00 O ATOM 98862 H1 WAT 7296 39.427 135.253 152.271 1.00 0.00 H ATOM 98863 H2 WAT 7296 38.461 134.494 153.155 1.00 0.00 H TER 98865 WAT 7296 ATOM 98865 O WAT 7297 46.412 59.859 103.003 1.00 0.00 O ATOM 98866 H1 WAT 7297 46.734 59.005 103.290 1.00 0.00 H ATOM 98867 H2 WAT 7297 46.340 59.781 102.052 1.00 0.00 H TER 98869 WAT 7297 ATOM 98869 O WAT 7298 81.230 101.720 10.214 1.00 0.00 O ATOM 98870 H1 WAT 7298 81.344 101.412 9.316 1.00 0.00 H ATOM 98871 H2 WAT 7298 81.010 102.647 10.123 1.00 0.00 H TER 98873 WAT 7298 ATOM 98873 O WAT 7299 89.152 78.095 134.732 1.00 0.00 O ATOM 98874 H1 WAT 7299 89.238 77.489 133.996 1.00 0.00 H ATOM 98875 H2 WAT 7299 89.924 78.657 134.670 1.00 0.00 H TER 98877 WAT 7299 ATOM 98877 O WAT 7300 123.303 56.462 19.231 1.00 0.00 O ATOM 98878 H1 WAT 7300 123.254 56.380 20.183 1.00 0.00 H ATOM 98879 H2 WAT 7300 124.238 56.400 19.033 1.00 0.00 H TER 98881 WAT 7300 ATOM 98881 O WAT 7301 48.110 53.547 151.197 1.00 0.00 O ATOM 98882 H1 WAT 7301 47.746 53.117 151.971 1.00 0.00 H ATOM 98883 H2 WAT 7301 48.630 54.270 151.546 1.00 0.00 H TER 98885 WAT 7301 ATOM 98885 O WAT 7302 79.390 129.279 74.774 1.00 0.00 O ATOM 98886 H1 WAT 7302 78.600 128.819 75.056 1.00 0.00 H ATOM 98887 H2 WAT 7302 79.363 129.238 73.818 1.00 0.00 H TER 98889 WAT 7302 ATOM 98889 O WAT 7303 44.224 127.412 133.267 1.00 0.00 O ATOM 98890 H1 WAT 7303 45.140 127.449 133.540 1.00 0.00 H ATOM 98891 H2 WAT 7303 44.023 128.303 132.981 1.00 0.00 H TER 98893 WAT 7303 ATOM 98893 O WAT 7304 112.596 69.238 117.306 1.00 0.00 O ATOM 98894 H1 WAT 7304 112.166 68.514 117.761 1.00 0.00 H ATOM 98895 H2 WAT 7304 111.915 69.906 117.223 1.00 0.00 H TER 98897 WAT 7304 ATOM 98897 O WAT 7305 3.688 123.234 89.916 1.00 0.00 O ATOM 98898 H1 WAT 7305 4.473 123.756 90.084 1.00 0.00 H ATOM 98899 H2 WAT 7305 3.626 122.646 90.669 1.00 0.00 H TER 98901 WAT 7305 ATOM 98901 O WAT 7306 74.289 115.671 105.939 1.00 0.00 O ATOM 98902 H1 WAT 7306 74.707 116.528 106.022 1.00 0.00 H ATOM 98903 H2 WAT 7306 74.390 115.444 105.014 1.00 0.00 H TER 98905 WAT 7306 ATOM 98905 O WAT 7307 13.242 94.661 114.482 1.00 0.00 O ATOM 98906 H1 WAT 7307 12.919 94.180 113.720 1.00 0.00 H ATOM 98907 H2 WAT 7307 12.950 94.144 115.233 1.00 0.00 H TER 98909 WAT 7307 ATOM 98909 O WAT 7308 127.640 42.071 102.094 1.00 0.00 O ATOM 98910 H1 WAT 7308 127.474 41.828 101.183 1.00 0.00 H ATOM 98911 H2 WAT 7308 128.124 42.895 102.038 1.00 0.00 H TER 98913 WAT 7308 ATOM 98913 O WAT 7309 45.370 137.780 59.693 1.00 0.00 O ATOM 98914 H1 WAT 7309 45.503 137.442 58.808 1.00 0.00 H ATOM 98915 H2 WAT 7309 44.422 137.745 59.822 1.00 0.00 H TER 98917 WAT 7309 ATOM 98917 O WAT 7310 74.630 9.823 17.953 1.00 0.00 O ATOM 98918 H1 WAT 7310 74.758 10.377 18.723 1.00 0.00 H ATOM 98919 H2 WAT 7310 73.699 9.910 17.747 1.00 0.00 H TER 98921 WAT 7310 ATOM 98921 O WAT 7311 96.159 125.996 105.231 1.00 0.00 O ATOM 98922 H1 WAT 7311 95.877 126.901 105.099 1.00 0.00 H ATOM 98923 H2 WAT 7311 96.644 126.014 106.056 1.00 0.00 H TER 98925 WAT 7311 ATOM 98925 O WAT 7312 63.072 96.139 148.797 1.00 0.00 O ATOM 98926 H1 WAT 7312 63.859 96.678 148.718 1.00 0.00 H ATOM 98927 H2 WAT 7312 63.022 95.665 147.967 1.00 0.00 H TER 98929 WAT 7312 ATOM 98929 O WAT 7313 20.726 133.238 23.452 1.00 0.00 O ATOM 98930 H1 WAT 7313 20.070 133.612 24.041 1.00 0.00 H ATOM 98931 H2 WAT 7313 20.258 133.103 22.628 1.00 0.00 H TER 98933 WAT 7313 ATOM 98933 O WAT 7314 144.427 85.243 70.484 1.00 0.00 O ATOM 98934 H1 WAT 7314 145.118 84.601 70.648 1.00 0.00 H ATOM 98935 H2 WAT 7314 144.581 85.931 71.132 1.00 0.00 H TER 98937 WAT 7314 ATOM 98937 O WAT 7315 115.642 131.307 24.558 1.00 0.00 O ATOM 98938 H1 WAT 7315 116.397 131.856 24.344 1.00 0.00 H ATOM 98939 H2 WAT 7315 115.738 131.123 25.493 1.00 0.00 H TER 98941 WAT 7315 ATOM 98941 O WAT 7316 69.823 5.375 59.372 1.00 0.00 O ATOM 98942 H1 WAT 7316 69.882 5.568 58.436 1.00 0.00 H ATOM 98943 H2 WAT 7316 69.358 6.125 59.742 1.00 0.00 H TER 98945 WAT 7316 ATOM 98945 O WAT 7317 18.183 33.695 82.321 1.00 0.00 O ATOM 98946 H1 WAT 7317 18.450 34.242 81.582 1.00 0.00 H ATOM 98947 H2 WAT 7317 18.654 32.872 82.192 1.00 0.00 H TER 98949 WAT 7317 ATOM 98949 O WAT 7318 89.066 3.174 99.000 1.00 0.00 O ATOM 98950 H1 WAT 7318 89.681 3.018 99.717 1.00 0.00 H ATOM 98951 H2 WAT 7318 88.215 3.261 99.430 1.00 0.00 H TER 98953 WAT 7318 ATOM 98953 O WAT 7319 34.959 132.283 70.504 1.00 0.00 O ATOM 98954 H1 WAT 7319 34.364 132.569 69.811 1.00 0.00 H ATOM 98955 H2 WAT 7319 35.586 133.000 70.592 1.00 0.00 H TER 98957 WAT 7319 ATOM 98957 O WAT 7320 112.424 135.036 106.066 1.00 0.00 O ATOM 98958 H1 WAT 7320 113.127 135.487 106.532 1.00 0.00 H ATOM 98959 H2 WAT 7320 111.891 134.643 106.757 1.00 0.00 H TER 98961 WAT 7320 ATOM 98961 O WAT 7321 125.788 102.535 121.354 1.00 0.00 O ATOM 98962 H1 WAT 7321 126.740 102.617 121.300 1.00 0.00 H ATOM 98963 H2 WAT 7321 125.595 102.593 122.290 1.00 0.00 H TER 98965 WAT 7321 ATOM 98965 O WAT 7322 109.891 16.313 108.743 1.00 0.00 O ATOM 98966 H1 WAT 7322 110.470 16.999 109.074 1.00 0.00 H ATOM 98967 H2 WAT 7322 109.888 16.439 107.794 1.00 0.00 H TER 98969 WAT 7322 ATOM 98969 O WAT 7323 58.611 40.029 127.537 1.00 0.00 O ATOM 98970 H1 WAT 7323 59.422 39.989 128.043 1.00 0.00 H ATOM 98971 H2 WAT 7323 58.883 40.337 126.672 1.00 0.00 H TER 98973 WAT 7323 ATOM 98973 O WAT 7324 104.439 100.131 135.990 1.00 0.00 O ATOM 98974 H1 WAT 7324 104.132 101.037 135.948 1.00 0.00 H ATOM 98975 H2 WAT 7324 103.679 99.635 136.296 1.00 0.00 H TER 98977 WAT 7324 ATOM 98977 O WAT 7325 60.697 40.551 1.308 1.00 0.00 O ATOM 98978 H1 WAT 7325 59.774 40.708 1.108 1.00 0.00 H ATOM 98979 H2 WAT 7325 60.691 40.183 2.192 1.00 0.00 H TER 98981 WAT 7325 ATOM 98981 O WAT 7326 95.357 0.560 75.249 1.00 0.00 O ATOM 98982 H1 WAT 7326 94.693 1.139 75.623 1.00 0.00 H ATOM 98983 H2 WAT 7326 94.944 0.194 74.467 1.00 0.00 H TER 98985 WAT 7326 ATOM 98985 O WAT 7327 132.194 143.167 95.104 1.00 0.00 O ATOM 98986 H1 WAT 7327 132.903 143.765 94.868 1.00 0.00 H ATOM 98987 H2 WAT 7327 131.397 143.620 94.830 1.00 0.00 H TER 98989 WAT 7327 ATOM 98989 O WAT 7328 74.157 101.708 76.974 1.00 0.00 O ATOM 98990 H1 WAT 7328 74.443 100.814 76.783 1.00 0.00 H ATOM 98991 H2 WAT 7328 73.427 101.600 77.585 1.00 0.00 H TER 98993 WAT 7328 ATOM 98993 O WAT 7329 109.161 69.255 129.387 1.00 0.00 O ATOM 98994 H1 WAT 7329 108.417 68.663 129.496 1.00 0.00 H ATOM 98995 H2 WAT 7329 109.508 69.045 128.520 1.00 0.00 H TER 98997 WAT 7329 ATOM 98997 O WAT 7330 140.906 23.334 98.749 1.00 0.00 O ATOM 98998 H1 WAT 7330 141.242 24.105 99.205 1.00 0.00 H ATOM 98999 H2 WAT 7330 141.592 23.110 98.119 1.00 0.00 H TER 99001 WAT 7330 ATOM 99001 O WAT 7331 118.282 46.323 138.160 1.00 0.00 O ATOM 99002 H1 WAT 7331 117.367 46.556 137.998 1.00 0.00 H ATOM 99003 H2 WAT 7331 118.241 45.457 138.566 1.00 0.00 H TER 99005 WAT 7331 ATOM 99005 O WAT 7332 129.974 108.173 79.073 1.00 0.00 O ATOM 99006 H1 WAT 7332 130.095 108.917 79.663 1.00 0.00 H ATOM 99007 H2 WAT 7332 130.774 107.657 79.171 1.00 0.00 H TER 99009 WAT 7332 ATOM 99009 O WAT 7333 126.510 0.744 76.356 1.00 0.00 O ATOM 99010 H1 WAT 7333 127.275 0.452 76.852 1.00 0.00 H ATOM 99011 H2 WAT 7333 126.849 1.414 75.764 1.00 0.00 H TER 99013 WAT 7333 ATOM 99013 O WAT 7334 94.882 75.970 121.432 1.00 0.00 O ATOM 99014 H1 WAT 7334 94.315 76.513 121.979 1.00 0.00 H ATOM 99015 H2 WAT 7334 94.847 75.103 121.836 1.00 0.00 H TER 99017 WAT 7334 ATOM 99017 O WAT 7335 144.803 26.690 106.828 1.00 0.00 O ATOM 99018 H1 WAT 7335 145.588 26.582 106.291 1.00 0.00 H ATOM 99019 H2 WAT 7335 144.556 27.607 106.710 1.00 0.00 H TER 99021 WAT 7335 ATOM 99021 O WAT 7336 103.503 21.590 121.801 1.00 0.00 O ATOM 99022 H1 WAT 7336 102.937 21.417 122.553 1.00 0.00 H ATOM 99023 H2 WAT 7336 102.899 21.814 121.093 1.00 0.00 H TER 99025 WAT 7336 ATOM 99025 O WAT 7337 44.648 34.656 63.831 1.00 0.00 O ATOM 99026 H1 WAT 7337 43.711 34.784 63.983 1.00 0.00 H ATOM 99027 H2 WAT 7337 44.750 34.746 62.883 1.00 0.00 H TER 99029 WAT 7337 ATOM 99029 O WAT 7338 63.844 133.834 141.233 1.00 0.00 O ATOM 99030 H1 WAT 7338 64.647 133.434 141.566 1.00 0.00 H ATOM 99031 H2 WAT 7338 63.271 133.894 141.998 1.00 0.00 H TER 99033 WAT 7338 ATOM 99033 O WAT 7339 54.387 91.328 131.078 1.00 0.00 O ATOM 99034 H1 WAT 7339 54.570 90.407 131.264 1.00 0.00 H ATOM 99035 H2 WAT 7339 53.734 91.579 131.731 1.00 0.00 H TER 99037 WAT 7339 ATOM 99037 O WAT 7340 4.137 84.165 137.492 1.00 0.00 O ATOM 99038 H1 WAT 7340 4.672 84.958 137.466 1.00 0.00 H ATOM 99039 H2 WAT 7340 4.715 83.498 137.864 1.00 0.00 H TER 99041 WAT 7340 ATOM 99041 O WAT 7341 135.478 58.590 139.131 1.00 0.00 O ATOM 99042 H1 WAT 7341 135.839 57.883 139.666 1.00 0.00 H ATOM 99043 H2 WAT 7341 135.158 59.231 139.766 1.00 0.00 H TER 99045 WAT 7341 ATOM 99045 O WAT 7342 33.387 144.634 150.352 1.00 0.00 O ATOM 99046 H1 WAT 7342 33.349 144.091 151.139 1.00 0.00 H ATOM 99047 H2 WAT 7342 33.020 144.080 149.662 1.00 0.00 H TER 99049 WAT 7342 ATOM 99049 O WAT 7343 39.712 128.091 92.149 1.00 0.00 O ATOM 99050 H1 WAT 7343 40.376 128.201 92.829 1.00 0.00 H ATOM 99051 H2 WAT 7343 39.529 127.152 92.141 1.00 0.00 H TER 99053 WAT 7343 ATOM 99053 O WAT 7344 65.387 144.232 61.693 1.00 0.00 O ATOM 99054 H1 WAT 7344 64.570 144.409 61.226 1.00 0.00 H ATOM 99055 H2 WAT 7344 65.195 143.461 62.228 1.00 0.00 H TER 99057 WAT 7344 ATOM 99057 O WAT 7345 64.040 108.690 111.253 1.00 0.00 O ATOM 99058 H1 WAT 7345 63.321 108.845 110.640 1.00 0.00 H ATOM 99059 H2 WAT 7345 64.588 109.471 111.182 1.00 0.00 H TER 99061 WAT 7345 ATOM 99061 O WAT 7346 143.492 136.664 10.159 1.00 0.00 O ATOM 99062 H1 WAT 7346 142.768 136.091 10.410 1.00 0.00 H ATOM 99063 H2 WAT 7346 143.972 136.816 10.973 1.00 0.00 H TER 99065 WAT 7346 ATOM 99065 O WAT 7347 100.383 98.575 92.197 1.00 0.00 O ATOM 99066 H1 WAT 7347 100.840 99.412 92.123 1.00 0.00 H ATOM 99067 H2 WAT 7347 100.908 97.968 91.676 1.00 0.00 H TER 99069 WAT 7347 ATOM 99069 O WAT 7348 18.723 38.847 93.102 1.00 0.00 O ATOM 99070 H1 WAT 7348 19.078 39.384 93.811 1.00 0.00 H ATOM 99071 H2 WAT 7348 18.883 39.360 92.310 1.00 0.00 H TER 99073 WAT 7348 ATOM 99073 O WAT 7349 68.853 118.600 90.670 1.00 0.00 O ATOM 99074 H1 WAT 7349 69.428 117.839 90.748 1.00 0.00 H ATOM 99075 H2 WAT 7349 69.004 119.098 91.474 1.00 0.00 H TER 99077 WAT 7349 ATOM 99077 O WAT 7350 78.331 22.755 136.818 1.00 0.00 O ATOM 99078 H1 WAT 7350 78.613 23.211 137.610 1.00 0.00 H ATOM 99079 H2 WAT 7350 79.099 22.255 136.542 1.00 0.00 H TER 99081 WAT 7350 ATOM 99081 O WAT 7351 125.188 13.107 93.082 1.00 0.00 O ATOM 99082 H1 WAT 7351 125.105 12.209 92.763 1.00 0.00 H ATOM 99083 H2 WAT 7351 125.786 13.526 92.462 1.00 0.00 H TER 99085 WAT 7351 ATOM 99085 O WAT 7352 136.765 143.940 13.060 1.00 0.00 O ATOM 99086 H1 WAT 7352 136.280 143.903 13.884 1.00 0.00 H ATOM 99087 H2 WAT 7352 136.824 143.028 12.775 1.00 0.00 H TER 99089 WAT 7352 ATOM 99089 O WAT 7353 60.421 27.823 21.676 1.00 0.00 O ATOM 99090 H1 WAT 7353 60.493 28.324 22.489 1.00 0.00 H ATOM 99091 H2 WAT 7353 61.226 27.306 21.641 1.00 0.00 H TER 99093 WAT 7353 ATOM 99093 O WAT 7354 13.568 61.859 101.561 1.00 0.00 O ATOM 99094 H1 WAT 7354 14.328 62.148 102.066 1.00 0.00 H ATOM 99095 H2 WAT 7354 13.128 62.669 101.304 1.00 0.00 H TER 99097 WAT 7354 ATOM 99097 O WAT 7355 110.808 78.500 106.490 1.00 0.00 O ATOM 99098 H1 WAT 7355 109.939 78.793 106.215 1.00 0.00 H ATOM 99099 H2 WAT 7355 110.807 77.558 106.322 1.00 0.00 H TER 99101 WAT 7355 ATOM 99101 O WAT 7356 2.838 53.652 110.033 1.00 0.00 O ATOM 99102 H1 WAT 7356 2.604 52.796 109.674 1.00 0.00 H ATOM 99103 H2 WAT 7356 1.998 54.088 110.180 1.00 0.00 H TER 99105 WAT 7356 ATOM 99105 O WAT 7357 102.579 24.354 15.675 1.00 0.00 O ATOM 99106 H1 WAT 7357 102.083 24.533 16.474 1.00 0.00 H ATOM 99107 H2 WAT 7357 102.475 23.413 15.533 1.00 0.00 H TER 99109 WAT 7357 ATOM 99109 O WAT 7358 20.241 103.412 148.819 1.00 0.00 O ATOM 99110 H1 WAT 7358 19.950 102.951 149.606 1.00 0.00 H ATOM 99111 H2 WAT 7358 21.196 103.373 148.858 1.00 0.00 H TER 99113 WAT 7358 ATOM 99113 O WAT 7359 95.091 65.063 9.496 1.00 0.00 O ATOM 99114 H1 WAT 7359 94.632 65.627 8.873 1.00 0.00 H ATOM 99115 H2 WAT 7359 94.405 64.508 9.866 1.00 0.00 H TER 99117 WAT 7359 ATOM 99117 O WAT 7360 21.540 122.365 10.627 1.00 0.00 O ATOM 99118 H1 WAT 7360 21.613 122.430 11.579 1.00 0.00 H ATOM 99119 H2 WAT 7360 21.196 123.215 10.354 1.00 0.00 H TER 99121 WAT 7360 ATOM 99121 O WAT 7361 106.228 99.795 107.244 1.00 0.00 O ATOM 99122 H1 WAT 7361 105.417 100.178 106.909 1.00 0.00 H ATOM 99123 H2 WAT 7361 106.517 99.201 106.550 1.00 0.00 H TER 99125 WAT 7361 ATOM 99125 O WAT 7362 123.610 17.489 111.892 1.00 0.00 O ATOM 99126 H1 WAT 7362 123.373 18.286 112.367 1.00 0.00 H ATOM 99127 H2 WAT 7362 122.816 17.252 111.412 1.00 0.00 H TER 99129 WAT 7362 ATOM 99129 O WAT 7363 69.850 113.283 15.401 1.00 0.00 O ATOM 99130 H1 WAT 7363 70.269 112.689 16.024 1.00 0.00 H ATOM 99131 H2 WAT 7363 69.856 114.133 15.840 1.00 0.00 H TER 99133 WAT 7363 ATOM 99133 O WAT 7364 105.975 130.067 99.597 1.00 0.00 O ATOM 99134 H1 WAT 7364 105.732 130.119 98.672 1.00 0.00 H ATOM 99135 H2 WAT 7364 106.789 130.566 99.659 1.00 0.00 H TER 99137 WAT 7364 ATOM 99137 O WAT 7365 27.952 81.915 70.331 1.00 0.00 O ATOM 99138 H1 WAT 7365 28.266 81.199 69.779 1.00 0.00 H ATOM 99139 H2 WAT 7365 27.025 81.720 70.473 1.00 0.00 H TER 99141 WAT 7365 ATOM 99141 O WAT 7366 96.258 14.917 71.650 1.00 0.00 O ATOM 99142 H1 WAT 7366 95.452 15.374 71.410 1.00 0.00 H ATOM 99143 H2 WAT 7366 96.180 14.059 71.234 1.00 0.00 H TER 99145 WAT 7366 ATOM 99145 O WAT 7367 92.650 126.934 78.801 1.00 0.00 O ATOM 99146 H1 WAT 7367 92.769 127.396 79.631 1.00 0.00 H ATOM 99147 H2 WAT 7367 93.181 126.142 78.889 1.00 0.00 H TER 99149 WAT 7367 ATOM 99149 O WAT 7368 141.063 80.299 77.562 1.00 0.00 O ATOM 99150 H1 WAT 7368 140.439 80.955 77.254 1.00 0.00 H ATOM 99151 H2 WAT 7368 141.458 80.691 78.341 1.00 0.00 H TER 99153 WAT 7368 ATOM 99153 O WAT 7369 122.144 95.258 5.111 1.00 0.00 O ATOM 99154 H1 WAT 7369 122.638 95.600 5.857 1.00 0.00 H ATOM 99155 H2 WAT 7369 121.437 95.891 4.983 1.00 0.00 H TER 99157 WAT 7369 ATOM 99157 O WAT 7370 32.449 10.764 108.804 1.00 0.00 O ATOM 99158 H1 WAT 7370 31.684 11.256 109.102 1.00 0.00 H ATOM 99159 H2 WAT 7370 33.118 10.937 109.466 1.00 0.00 H TER 99161 WAT 7370 ATOM 99161 O WAT 7371 139.688 14.609 20.857 1.00 0.00 O ATOM 99162 H1 WAT 7371 138.860 14.646 21.337 1.00 0.00 H ATOM 99163 H2 WAT 7371 139.621 15.312 20.211 1.00 0.00 H TER 99165 WAT 7371 ATOM 99165 O WAT 7372 89.129 76.280 132.434 1.00 0.00 O ATOM 99166 H1 WAT 7372 89.312 76.490 131.518 1.00 0.00 H ATOM 99167 H2 WAT 7372 88.191 76.094 132.454 1.00 0.00 H TER 99169 WAT 7372 ATOM 99169 O WAT 7373 32.012 124.303 132.143 1.00 0.00 O ATOM 99170 H1 WAT 7373 31.607 124.360 131.277 1.00 0.00 H ATOM 99171 H2 WAT 7373 32.951 124.376 131.974 1.00 0.00 H TER 99173 WAT 7373 ATOM 99173 O WAT 7374 32.517 123.298 116.342 1.00 0.00 O ATOM 99174 H1 WAT 7374 32.738 123.670 115.488 1.00 0.00 H ATOM 99175 H2 WAT 7374 32.762 122.376 116.273 1.00 0.00 H TER 99177 WAT 7374 ATOM 99177 O WAT 7375 124.341 85.122 93.460 1.00 0.00 O ATOM 99178 H1 WAT 7375 124.978 85.446 92.822 1.00 0.00 H ATOM 99179 H2 WAT 7375 123.845 84.455 92.986 1.00 0.00 H TER 99181 WAT 7375 ATOM 99181 O WAT 7376 14.078 107.439 90.085 1.00 0.00 O ATOM 99182 H1 WAT 7376 13.175 107.754 90.119 1.00 0.00 H ATOM 99183 H2 WAT 7376 14.220 107.026 90.937 1.00 0.00 H TER 99185 WAT 7376 ATOM 99185 O WAT 7377 117.240 23.959 145.848 1.00 0.00 O ATOM 99186 H1 WAT 7377 117.456 24.735 145.331 1.00 0.00 H ATOM 99187 H2 WAT 7377 116.291 23.869 145.762 1.00 0.00 H TER 99189 WAT 7377 ATOM 99189 O WAT 7378 63.187 21.567 151.948 1.00 0.00 O ATOM 99190 H1 WAT 7378 62.972 20.646 152.095 1.00 0.00 H ATOM 99191 H2 WAT 7378 64.133 21.573 151.803 1.00 0.00 H TER 99193 WAT 7378 ATOM 99193 O WAT 7379 135.260 121.409 95.370 1.00 0.00 O ATOM 99194 H1 WAT 7379 135.391 120.730 94.708 1.00 0.00 H ATOM 99195 H2 WAT 7379 136.142 121.720 95.572 1.00 0.00 H TER 99197 WAT 7379 ATOM 99197 O WAT 7380 109.806 70.519 113.655 1.00 0.00 O ATOM 99198 H1 WAT 7380 109.228 70.069 114.272 1.00 0.00 H ATOM 99199 H2 WAT 7380 109.970 69.875 112.967 1.00 0.00 H TER 99201 WAT 7380 ATOM 99201 O WAT 7381 25.183 119.619 151.043 1.00 0.00 O ATOM 99202 H1 WAT 7381 25.748 118.857 150.912 1.00 0.00 H ATOM 99203 H2 WAT 7381 25.788 120.337 151.227 1.00 0.00 H TER 99205 WAT 7381 ATOM 99205 O WAT 7382 28.072 144.301 141.478 1.00 0.00 O ATOM 99206 H1 WAT 7382 28.023 143.432 141.080 1.00 0.00 H ATOM 99207 H2 WAT 7382 28.190 144.131 142.413 1.00 0.00 H TER 99209 WAT 7382 ATOM 99209 O WAT 7383 55.351 105.251 134.566 1.00 0.00 O ATOM 99210 H1 WAT 7383 54.431 105.163 134.814 1.00 0.00 H ATOM 99211 H2 WAT 7383 55.767 105.655 135.327 1.00 0.00 H TER 99213 WAT 7383 ATOM 99213 O WAT 7384 62.316 65.273 104.094 1.00 0.00 O ATOM 99214 H1 WAT 7384 63.029 65.590 104.648 1.00 0.00 H ATOM 99215 H2 WAT 7384 61.691 65.998 104.071 1.00 0.00 H TER 99217 WAT 7384 ATOM 99217 O WAT 7385 43.506 15.128 120.759 1.00 0.00 O ATOM 99218 H1 WAT 7385 43.196 15.511 119.938 1.00 0.00 H ATOM 99219 H2 WAT 7385 42.997 14.323 120.855 1.00 0.00 H TER 99221 WAT 7385 ATOM 99221 O WAT 7386 61.757 16.484 1.824 1.00 0.00 O ATOM 99222 H1 WAT 7386 61.166 16.652 1.090 1.00 0.00 H ATOM 99223 H2 WAT 7386 61.396 15.706 2.249 1.00 0.00 H TER 99225 WAT 7386 ATOM 99225 O WAT 7387 141.740 136.593 121.657 1.00 0.00 O ATOM 99226 H1 WAT 7387 140.839 136.881 121.515 1.00 0.00 H ATOM 99227 H2 WAT 7387 142.274 137.351 121.419 1.00 0.00 H TER 99229 WAT 7387 ATOM 99229 O WAT 7388 33.406 116.666 88.572 1.00 0.00 O ATOM 99230 H1 WAT 7388 33.281 117.314 87.878 1.00 0.00 H ATOM 99231 H2 WAT 7388 34.079 117.046 89.136 1.00 0.00 H TER 99233 WAT 7388 ATOM 99233 O WAT 7389 125.922 0.853 135.221 1.00 0.00 O ATOM 99234 H1 WAT 7389 125.079 0.602 135.597 1.00 0.00 H ATOM 99235 H2 WAT 7389 126.444 0.051 135.245 1.00 0.00 H TER 99237 WAT 7389 ATOM 99237 O WAT 7390 122.132 34.080 65.609 1.00 0.00 O ATOM 99238 H1 WAT 7390 122.952 33.652 65.855 1.00 0.00 H ATOM 99239 H2 WAT 7390 121.472 33.389 65.678 1.00 0.00 H TER 99241 WAT 7390 ATOM 99241 O WAT 7391 65.061 8.097 101.536 1.00 0.00 O ATOM 99242 H1 WAT 7391 64.215 8.170 101.978 1.00 0.00 H ATOM 99243 H2 WAT 7391 65.630 8.707 102.004 1.00 0.00 H TER 99245 WAT 7391 ATOM 99245 O WAT 7392 63.605 5.883 60.848 1.00 0.00 O ATOM 99246 H1 WAT 7392 62.916 6.194 60.261 1.00 0.00 H ATOM 99247 H2 WAT 7392 64.421 6.127 60.410 1.00 0.00 H TER 99249 WAT 7392 ATOM 99249 O WAT 7393 93.689 63.806 143.569 1.00 0.00 O ATOM 99250 H1 WAT 7393 93.742 64.169 142.685 1.00 0.00 H ATOM 99251 H2 WAT 7393 94.430 63.202 143.625 1.00 0.00 H TER 99253 WAT 7393 ATOM 99253 O WAT 7394 57.966 10.920 62.081 1.00 0.00 O ATOM 99254 H1 WAT 7394 57.426 10.129 62.073 1.00 0.00 H ATOM 99255 H2 WAT 7394 58.810 10.630 62.426 1.00 0.00 H TER 99257 WAT 7394 ATOM 99257 O WAT 7395 54.995 145.567 129.616 1.00 0.00 O ATOM 99258 H1 WAT 7395 55.548 146.313 129.384 1.00 0.00 H ATOM 99259 H2 WAT 7395 55.574 144.983 130.107 1.00 0.00 H TER 99261 WAT 7395 ATOM 99261 O WAT 7396 103.192 139.515 53.266 1.00 0.00 O ATOM 99262 H1 WAT 7396 102.940 140.130 52.577 1.00 0.00 H ATOM 99263 H2 WAT 7396 103.380 140.068 54.024 1.00 0.00 H TER 99265 WAT 7396 ATOM 99265 O WAT 7397 132.711 46.109 123.783 1.00 0.00 O ATOM 99266 H1 WAT 7397 132.547 46.913 123.290 1.00 0.00 H ATOM 99267 H2 WAT 7397 133.641 46.150 124.006 1.00 0.00 H TER 99269 WAT 7397 ATOM 99269 O WAT 7398 12.982 7.645 121.596 1.00 0.00 O ATOM 99270 H1 WAT 7398 12.658 6.808 121.263 1.00 0.00 H ATOM 99271 H2 WAT 7398 12.859 8.256 120.870 1.00 0.00 H TER 99273 WAT 7398 ATOM 99273 O WAT 7399 140.512 36.599 111.301 1.00 0.00 O ATOM 99274 H1 WAT 7399 141.172 36.999 110.735 1.00 0.00 H ATOM 99275 H2 WAT 7399 139.693 36.689 110.814 1.00 0.00 H TER 99277 WAT 7399 ATOM 99277 O WAT 7400 113.148 105.070 140.487 1.00 0.00 O ATOM 99278 H1 WAT 7400 112.806 105.963 140.473 1.00 0.00 H ATOM 99279 H2 WAT 7400 113.309 104.890 141.414 1.00 0.00 H TER 99281 WAT 7400 ATOM 99281 O WAT 7401 7.965 136.065 134.312 1.00 0.00 O ATOM 99282 H1 WAT 7401 8.721 135.488 134.422 1.00 0.00 H ATOM 99283 H2 WAT 7401 7.245 135.601 134.739 1.00 0.00 H TER 99285 WAT 7401 ATOM 99285 O WAT 7402 83.016 133.696 88.481 1.00 0.00 O ATOM 99286 H1 WAT 7402 82.271 133.972 89.015 1.00 0.00 H ATOM 99287 H2 WAT 7402 83.130 132.769 88.688 1.00 0.00 H TER 99289 WAT 7402 ATOM 99289 O WAT 7403 135.130 108.063 90.492 1.00 0.00 O ATOM 99290 H1 WAT 7403 135.858 107.925 89.887 1.00 0.00 H ATOM 99291 H2 WAT 7403 135.288 107.443 91.203 1.00 0.00 H TER 99293 WAT 7403 ATOM 99293 O WAT 7404 85.083 32.845 11.576 1.00 0.00 O ATOM 99294 H1 WAT 7404 84.397 33.441 11.876 1.00 0.00 H ATOM 99295 H2 WAT 7404 84.652 31.992 11.520 1.00 0.00 H TER 99297 WAT 7404 ATOM 99297 O WAT 7405 55.328 78.445 101.457 1.00 0.00 O ATOM 99298 H1 WAT 7405 55.810 78.521 100.634 1.00 0.00 H ATOM 99299 H2 WAT 7405 55.899 78.850 102.109 1.00 0.00 H TER 99301 WAT 7405 ATOM 99301 O WAT 7406 94.130 65.997 156.232 1.00 0.00 O ATOM 99302 H1 WAT 7406 94.154 65.770 157.162 1.00 0.00 H ATOM 99303 H2 WAT 7406 94.597 65.282 155.799 1.00 0.00 H TER 99305 WAT 7406 ATOM 99305 O WAT 7407 137.208 74.299 88.409 1.00 0.00 O ATOM 99306 H1 WAT 7407 136.527 73.887 88.940 1.00 0.00 H ATOM 99307 H2 WAT 7407 137.912 73.651 88.377 1.00 0.00 H TER 99309 WAT 7407 ATOM 99309 O WAT 7408 3.348 113.733 144.163 1.00 0.00 O ATOM 99310 H1 WAT 7408 3.222 113.006 143.553 1.00 0.00 H ATOM 99311 H2 WAT 7408 3.543 113.312 145.000 1.00 0.00 H TER 99313 WAT 7408 ATOM 99313 O WAT 7409 119.068 76.613 108.685 1.00 0.00 O ATOM 99314 H1 WAT 7409 119.320 75.757 108.339 1.00 0.00 H ATOM 99315 H2 WAT 7409 118.133 76.531 108.872 1.00 0.00 H TER 99317 WAT 7409 ATOM 99317 O WAT 7410 44.158 129.985 16.367 1.00 0.00 O ATOM 99318 H1 WAT 7410 44.166 130.345 17.254 1.00 0.00 H ATOM 99319 H2 WAT 7410 45.005 129.548 16.279 1.00 0.00 H TER 99321 WAT 7410 ATOM 99321 O WAT 7411 140.713 42.320 156.044 1.00 0.00 O ATOM 99322 H1 WAT 7411 140.319 42.397 156.913 1.00 0.00 H ATOM 99323 H2 WAT 7411 141.327 43.053 155.995 1.00 0.00 H TER 99325 WAT 7411 ATOM 99325 O WAT 7412 140.231 101.132 153.694 1.00 0.00 O ATOM 99326 H1 WAT 7412 139.494 101.742 153.736 1.00 0.00 H ATOM 99327 H2 WAT 7412 140.917 101.550 154.215 1.00 0.00 H TER 99329 WAT 7412 ATOM 99329 O WAT 7413 53.572 38.576 76.079 1.00 0.00 O ATOM 99330 H1 WAT 7413 53.530 37.687 75.727 1.00 0.00 H ATOM 99331 H2 WAT 7413 53.550 39.141 75.306 1.00 0.00 H TER 99333 WAT 7413 ATOM 99333 O WAT 7414 18.058 113.472 87.267 1.00 0.00 O ATOM 99334 H1 WAT 7414 17.770 113.069 88.086 1.00 0.00 H ATOM 99335 H2 WAT 7414 17.744 112.878 86.584 1.00 0.00 H TER 99337 WAT 7414 ATOM 99337 O WAT 7415 74.369 81.063 5.238 1.00 0.00 O ATOM 99338 H1 WAT 7415 75.282 80.977 5.511 1.00 0.00 H ATOM 99339 H2 WAT 7415 73.965 80.231 5.487 1.00 0.00 H TER 99341 WAT 7415 ATOM 99341 O WAT 7416 84.193 34.259 129.114 1.00 0.00 O ATOM 99342 H1 WAT 7416 83.588 35.000 129.148 1.00 0.00 H ATOM 99343 H2 WAT 7416 84.258 34.046 128.184 1.00 0.00 H TER 99345 WAT 7416 ATOM 99345 O WAT 7417 63.805 28.648 54.039 1.00 0.00 O ATOM 99346 H1 WAT 7417 63.610 29.472 54.485 1.00 0.00 H ATOM 99347 H2 WAT 7417 63.543 27.970 54.661 1.00 0.00 H TER 99349 WAT 7417 ATOM 99349 O WAT 7418 90.022 95.692 66.022 1.00 0.00 O ATOM 99350 H1 WAT 7418 89.526 94.892 65.851 1.00 0.00 H ATOM 99351 H2 WAT 7418 90.077 96.126 65.170 1.00 0.00 H TER 99353 WAT 7418 ATOM 99353 O WAT 7419 63.675 104.338 113.115 1.00 0.00 O ATOM 99354 H1 WAT 7419 63.885 104.487 112.193 1.00 0.00 H ATOM 99355 H2 WAT 7419 64.346 104.823 113.595 1.00 0.00 H TER 99357 WAT 7419 ATOM 99357 O WAT 7420 114.502 26.318 107.143 1.00 0.00 O ATOM 99358 H1 WAT 7420 114.490 25.520 107.672 1.00 0.00 H ATOM 99359 H2 WAT 7420 115.426 26.448 106.927 1.00 0.00 H TER 99361 WAT 7420 ATOM 99361 O WAT 7421 104.856 30.586 59.121 1.00 0.00 O ATOM 99362 H1 WAT 7421 104.077 30.159 58.764 1.00 0.00 H ATOM 99363 H2 WAT 7421 105.111 31.218 58.449 1.00 0.00 H TER 99365 WAT 7421 ATOM 99365 O WAT 7422 107.706 0.848 129.025 1.00 0.00 O ATOM 99366 H1 WAT 7422 107.322 0.667 128.167 1.00 0.00 H ATOM 99367 H2 WAT 7422 107.335 1.693 129.280 1.00 0.00 H TER 99369 WAT 7422 ATOM 99369 O WAT 7423 75.927 139.897 20.627 1.00 0.00 O ATOM 99370 H1 WAT 7423 76.349 139.060 20.433 1.00 0.00 H ATOM 99371 H2 WAT 7423 75.074 139.657 20.988 1.00 0.00 H TER 99373 WAT 7423 ATOM 99373 O WAT 7424 10.747 83.908 150.011 1.00 0.00 O ATOM 99374 H1 WAT 7424 9.885 84.307 149.892 1.00 0.00 H ATOM 99375 H2 WAT 7424 10.934 84.015 150.944 1.00 0.00 H TER 99377 WAT 7424 ATOM 99377 O WAT 7425 81.838 110.912 133.519 1.00 0.00 O ATOM 99378 H1 WAT 7425 81.063 110.381 133.334 1.00 0.00 H ATOM 99379 H2 WAT 7425 81.583 111.801 133.271 1.00 0.00 H TER 99381 WAT 7425 ATOM 99381 O WAT 7426 113.914 82.661 27.029 1.00 0.00 O ATOM 99382 H1 WAT 7426 113.494 82.509 27.875 1.00 0.00 H ATOM 99383 H2 WAT 7426 114.747 83.080 27.247 1.00 0.00 H TER 99385 WAT 7426 ATOM 99385 O WAT 7427 18.358 92.897 93.319 1.00 0.00 O ATOM 99386 H1 WAT 7427 19.095 93.255 93.814 1.00 0.00 H ATOM 99387 H2 WAT 7427 17.582 93.244 93.760 1.00 0.00 H TER 99389 WAT 7427 ATOM 99389 O WAT 7428 77.383 47.730 119.509 1.00 0.00 O ATOM 99390 H1 WAT 7428 77.697 46.830 119.602 1.00 0.00 H ATOM 99391 H2 WAT 7428 77.594 48.145 120.345 1.00 0.00 H TER 99393 WAT 7428 ATOM 99393 O WAT 7429 86.341 88.295 75.075 1.00 0.00 O ATOM 99394 H1 WAT 7429 85.627 88.878 75.332 1.00 0.00 H ATOM 99395 H2 WAT 7429 86.391 88.383 74.123 1.00 0.00 H TER 99397 WAT 7429 ATOM 99397 O WAT 7430 15.316 59.635 119.127 1.00 0.00 O ATOM 99398 H1 WAT 7430 16.267 59.666 119.224 1.00 0.00 H ATOM 99399 H2 WAT 7430 15.067 58.777 119.471 1.00 0.00 H TER 99401 WAT 7430 ATOM 99401 O WAT 7431 91.413 7.448 111.482 1.00 0.00 O ATOM 99402 H1 WAT 7431 91.019 7.602 112.340 1.00 0.00 H ATOM 99403 H2 WAT 7431 92.257 7.040 111.676 1.00 0.00 H TER 99405 WAT 7431 ATOM 99405 O WAT 7432 76.254 116.823 119.851 1.00 0.00 O ATOM 99406 H1 WAT 7432 75.587 116.240 120.215 1.00 0.00 H ATOM 99407 H2 WAT 7432 76.763 116.265 119.263 1.00 0.00 H TER 99409 WAT 7432 ATOM 99409 O WAT 7433 26.418 111.092 91.687 1.00 0.00 O ATOM 99410 H1 WAT 7433 25.976 110.294 91.978 1.00 0.00 H ATOM 99411 H2 WAT 7433 25.951 111.348 90.892 1.00 0.00 H TER 99413 WAT 7433 ATOM 99413 O WAT 7434 74.970 97.374 156.837 1.00 0.00 O ATOM 99414 H1 WAT 7434 74.903 96.426 156.724 1.00 0.00 H ATOM 99415 H2 WAT 7434 74.143 97.715 156.495 1.00 0.00 H TER 99417 WAT 7434 ATOM 99417 O WAT 7435 102.853 117.027 131.537 1.00 0.00 O ATOM 99418 H1 WAT 7435 101.909 116.872 131.551 1.00 0.00 H ATOM 99419 H2 WAT 7435 103.236 116.204 131.842 1.00 0.00 H TER 99421 WAT 7435 ATOM 99421 O WAT 7436 139.591 116.918 132.304 1.00 0.00 O ATOM 99422 H1 WAT 7436 139.573 116.154 131.727 1.00 0.00 H ATOM 99423 H2 WAT 7436 139.141 116.630 133.098 1.00 0.00 H TER 99425 WAT 7436 ATOM 99425 O WAT 7437 53.783 123.775 152.261 1.00 0.00 O ATOM 99426 H1 WAT 7437 53.024 123.270 152.554 1.00 0.00 H ATOM 99427 H2 WAT 7437 53.688 124.623 152.694 1.00 0.00 H TER 99429 WAT 7437 ATOM 99429 O WAT 7438 136.274 145.140 62.137 1.00 0.00 O ATOM 99430 H1 WAT 7438 137.171 145.450 62.015 1.00 0.00 H ATOM 99431 H2 WAT 7438 136.366 144.203 62.310 1.00 0.00 H TER 99433 WAT 7438 ATOM 99433 O WAT 7439 41.286 134.797 140.965 1.00 0.00 O ATOM 99434 H1 WAT 7439 41.699 135.611 141.253 1.00 0.00 H ATOM 99435 H2 WAT 7439 40.915 134.421 141.764 1.00 0.00 H TER 99437 WAT 7439 ATOM 99437 O WAT 7440 41.516 62.868 84.383 1.00 0.00 O ATOM 99438 H1 WAT 7440 42.372 62.625 84.031 1.00 0.00 H ATOM 99439 H2 WAT 7440 40.892 62.354 83.870 1.00 0.00 H TER 99441 WAT 7440 ATOM 99441 O WAT 7441 41.801 22.377 86.040 1.00 0.00 O ATOM 99442 H1 WAT 7441 42.407 22.188 85.324 1.00 0.00 H ATOM 99443 H2 WAT 7441 42.277 22.988 86.602 1.00 0.00 H TER 99445 WAT 7441 ATOM 99445 O WAT 7442 84.279 78.574 138.362 1.00 0.00 O ATOM 99446 H1 WAT 7442 83.747 77.998 137.813 1.00 0.00 H ATOM 99447 H2 WAT 7442 85.173 78.249 138.255 1.00 0.00 H TER 99449 WAT 7442 ATOM 99449 O WAT 7443 11.844 115.994 121.022 1.00 0.00 O ATOM 99450 H1 WAT 7443 11.017 116.438 121.212 1.00 0.00 H ATOM 99451 H2 WAT 7443 12.518 116.614 121.301 1.00 0.00 H TER 99453 WAT 7443 ATOM 99453 O WAT 7444 129.127 84.828 88.447 1.00 0.00 O ATOM 99454 H1 WAT 7444 129.993 84.650 88.079 1.00 0.00 H ATOM 99455 H2 WAT 7444 129.307 85.233 89.296 1.00 0.00 H TER 99457 WAT 7444 ATOM 99457 O WAT 7445 131.272 114.791 148.346 1.00 0.00 O ATOM 99458 H1 WAT 7445 130.558 115.411 148.491 1.00 0.00 H ATOM 99459 H2 WAT 7445 131.416 114.808 147.400 1.00 0.00 H TER 99461 WAT 7445 ATOM 99461 O WAT 7446 39.342 125.222 133.680 1.00 0.00 O ATOM 99462 H1 WAT 7446 39.275 126.137 133.409 1.00 0.00 H ATOM 99463 H2 WAT 7446 39.790 125.254 134.525 1.00 0.00 H TER 99465 WAT 7446 ATOM 99465 O WAT 7447 126.294 77.296 91.170 1.00 0.00 O ATOM 99466 H1 WAT 7447 126.291 76.500 91.702 1.00 0.00 H ATOM 99467 H2 WAT 7447 126.877 77.094 90.439 1.00 0.00 H TER 99469 WAT 7447 ATOM 99469 O WAT 7448 143.919 79.979 119.194 1.00 0.00 O ATOM 99470 H1 WAT 7448 143.220 79.770 118.575 1.00 0.00 H ATOM 99471 H2 WAT 7448 143.536 80.636 119.775 1.00 0.00 H TER 99473 WAT 7448 ATOM 99473 O WAT 7449 141.230 85.040 102.795 1.00 0.00 O ATOM 99474 H1 WAT 7449 140.453 85.301 102.300 1.00 0.00 H ATOM 99475 H2 WAT 7449 140.920 84.946 103.696 1.00 0.00 H TER 99477 WAT 7449 ATOM 99477 O WAT 7450 35.897 79.846 12.657 1.00 0.00 O ATOM 99478 H1 WAT 7450 35.714 78.906 12.657 1.00 0.00 H ATOM 99479 H2 WAT 7450 36.800 79.914 12.968 1.00 0.00 H TER 99481 WAT 7450 ATOM 99481 O WAT 7451 15.498 26.128 20.415 1.00 0.00 O ATOM 99482 H1 WAT 7451 16.289 26.564 20.730 1.00 0.00 H ATOM 99483 H2 WAT 7451 15.052 26.791 19.889 1.00 0.00 H TER 99485 WAT 7451 ATOM 99485 O WAT 7452 67.432 54.801 143.719 1.00 0.00 O ATOM 99486 H1 WAT 7452 67.559 54.715 142.774 1.00 0.00 H ATOM 99487 H2 WAT 7452 67.200 55.721 143.847 1.00 0.00 H TER 99489 WAT 7452 ATOM 99489 O WAT 7453 13.650 88.677 116.757 1.00 0.00 O ATOM 99490 H1 WAT 7453 14.387 88.208 116.366 1.00 0.00 H ATOM 99491 H2 WAT 7453 14.010 89.530 116.999 1.00 0.00 H TER 99493 WAT 7453 ATOM 99493 O WAT 7454 23.265 134.270 146.355 1.00 0.00 O ATOM 99494 H1 WAT 7454 23.084 133.330 146.389 1.00 0.00 H ATOM 99495 H2 WAT 7454 24.219 134.329 146.317 1.00 0.00 H TER 99497 WAT 7454 ATOM 99497 O WAT 7455 50.709 70.067 118.576 1.00 0.00 O ATOM 99498 H1 WAT 7455 50.733 69.158 118.874 1.00 0.00 H ATOM 99499 H2 WAT 7455 50.686 70.006 117.621 1.00 0.00 H TER 99501 WAT 7455 ATOM 99501 O WAT 7456 140.257 93.037 114.475 1.00 0.00 O ATOM 99502 H1 WAT 7456 140.195 92.266 113.910 1.00 0.00 H ATOM 99503 H2 WAT 7456 141.132 92.983 114.858 1.00 0.00 H TER 99505 WAT 7456 ATOM 99505 O WAT 7457 10.700 137.630 109.166 1.00 0.00 O ATOM 99506 H1 WAT 7457 11.371 137.094 108.742 1.00 0.00 H ATOM 99507 H2 WAT 7457 10.434 138.256 108.494 1.00 0.00 H TER 99509 WAT 7457 ATOM 99509 O WAT 7458 114.323 31.229 104.501 1.00 0.00 O ATOM 99510 H1 WAT 7458 113.920 31.815 105.141 1.00 0.00 H ATOM 99511 H2 WAT 7458 115.088 30.872 104.951 1.00 0.00 H TER 99513 WAT 7458 ATOM 99513 O WAT 7459 75.403 25.561 107.677 1.00 0.00 O ATOM 99514 H1 WAT 7459 76.163 25.652 108.252 1.00 0.00 H ATOM 99515 H2 WAT 7459 75.035 24.705 107.899 1.00 0.00 H TER 99517 WAT 7459 ATOM 99517 O WAT 7460 104.018 13.316 107.918 1.00 0.00 O ATOM 99518 H1 WAT 7460 104.184 13.124 106.995 1.00 0.00 H ATOM 99519 H2 WAT 7460 103.064 13.360 107.986 1.00 0.00 H TER 99521 WAT 7460 ATOM 99521 O WAT 7461 38.577 47.997 143.121 1.00 0.00 O ATOM 99522 H1 WAT 7461 38.686 48.826 142.655 1.00 0.00 H ATOM 99523 H2 WAT 7461 37.636 47.936 143.284 1.00 0.00 H TER 99525 WAT 7461 ATOM 99525 O WAT 7462 40.544 24.787 127.936 1.00 0.00 O ATOM 99526 H1 WAT 7462 40.696 23.896 128.252 1.00 0.00 H ATOM 99527 H2 WAT 7462 41.407 25.201 127.964 1.00 0.00 H TER 99529 WAT 7462 ATOM 99529 O WAT 7463 36.204 38.650 137.346 1.00 0.00 O ATOM 99530 H1 WAT 7463 35.468 38.213 137.775 1.00 0.00 H ATOM 99531 H2 WAT 7463 36.019 38.567 136.410 1.00 0.00 H TER 99533 WAT 7463 ATOM 99533 O WAT 7464 135.430 22.486 148.737 1.00 0.00 O ATOM 99534 H1 WAT 7464 136.347 22.278 148.558 1.00 0.00 H ATOM 99535 H2 WAT 7464 135.234 22.020 149.550 1.00 0.00 H TER 99537 WAT 7464 ATOM 99537 O WAT 7465 139.634 19.692 92.654 1.00 0.00 O ATOM 99538 H1 WAT 7465 140.317 19.323 92.093 1.00 0.00 H ATOM 99539 H2 WAT 7465 139.258 18.936 93.104 1.00 0.00 H TER 99541 WAT 7465 ATOM 99541 O WAT 7466 51.504 100.552 9.029 1.00 0.00 O ATOM 99542 H1 WAT 7466 51.893 99.838 9.535 1.00 0.00 H ATOM 99543 H2 WAT 7466 50.927 100.998 9.648 1.00 0.00 H TER 99545 WAT 7466 ATOM 99545 O WAT 7467 21.858 107.616 156.425 1.00 0.00 O ATOM 99546 H1 WAT 7467 20.946 107.542 156.142 1.00 0.00 H ATOM 99547 H2 WAT 7467 22.013 106.825 156.940 1.00 0.00 H TER 99549 WAT 7467 ATOM 99549 O WAT 7468 125.008 99.908 20.466 1.00 0.00 O ATOM 99550 H1 WAT 7468 124.641 100.415 19.741 1.00 0.00 H ATOM 99551 H2 WAT 7468 125.734 99.422 20.075 1.00 0.00 H TER 99553 WAT 7468 ATOM 99553 O WAT 7469 73.615 55.784 22.942 1.00 0.00 O ATOM 99554 H1 WAT 7469 73.457 55.927 23.876 1.00 0.00 H ATOM 99555 H2 WAT 7469 74.165 55.001 22.910 1.00 0.00 H TER 99557 WAT 7469 ATOM 99557 O WAT 7470 32.671 29.228 15.295 1.00 0.00 O ATOM 99558 H1 WAT 7470 32.954 28.728 14.530 1.00 0.00 H ATOM 99559 H2 WAT 7470 32.953 28.702 16.043 1.00 0.00 H TER 99561 WAT 7470 ATOM 99561 O WAT 7471 25.417 101.053 126.576 1.00 0.00 O ATOM 99562 H1 WAT 7471 25.573 101.989 126.456 1.00 0.00 H ATOM 99563 H2 WAT 7471 25.680 100.658 125.744 1.00 0.00 H TER 99565 WAT 7471 ATOM 99565 O WAT 7472 87.616 53.646 115.174 1.00 0.00 O ATOM 99566 H1 WAT 7472 86.982 53.908 115.841 1.00 0.00 H ATOM 99567 H2 WAT 7472 88.466 53.873 115.549 1.00 0.00 H TER 99569 WAT 7472 ATOM 99569 O WAT 7473 17.635 21.360 61.016 1.00 0.00 O ATOM 99570 H1 WAT 7473 17.672 21.275 60.063 1.00 0.00 H ATOM 99571 H2 WAT 7473 17.399 22.275 61.166 1.00 0.00 H TER 99573 WAT 7473 ATOM 99573 O WAT 7474 109.400 9.784 82.562 1.00 0.00 O ATOM 99574 H1 WAT 7474 110.127 10.109 83.092 1.00 0.00 H ATOM 99575 H2 WAT 7474 108.681 10.390 82.743 1.00 0.00 H TER 99577 WAT 7474 ATOM 99577 O WAT 7475 45.991 90.616 117.781 1.00 0.00 O ATOM 99578 H1 WAT 7475 46.805 90.142 117.952 1.00 0.00 H ATOM 99579 H2 WAT 7475 46.267 91.410 117.323 1.00 0.00 H TER 99581 WAT 7475 ATOM 99581 O WAT 7476 92.763 103.540 13.928 1.00 0.00 O ATOM 99582 H1 WAT 7476 92.511 103.163 14.770 1.00 0.00 H ATOM 99583 H2 WAT 7476 92.686 104.486 14.056 1.00 0.00 H TER 99585 WAT 7476 ATOM 99585 O WAT 7477 114.599 64.085 141.041 1.00 0.00 O ATOM 99586 H1 WAT 7477 114.297 63.413 140.430 1.00 0.00 H ATOM 99587 H2 WAT 7477 115.479 63.804 141.291 1.00 0.00 H TER 99589 WAT 7477 ATOM 99589 O WAT 7478 70.166 95.579 67.888 1.00 0.00 O ATOM 99590 H1 WAT 7478 69.648 96.298 67.526 1.00 0.00 H ATOM 99591 H2 WAT 7478 71.072 95.880 67.825 1.00 0.00 H TER 99593 WAT 7478 ATOM 99593 O WAT 7479 83.591 111.633 123.702 1.00 0.00 O ATOM 99594 H1 WAT 7479 83.858 111.984 122.852 1.00 0.00 H ATOM 99595 H2 WAT 7479 82.635 111.664 123.685 1.00 0.00 H TER 99597 WAT 7479 ATOM 99597 O WAT 7480 126.568 31.253 74.306 1.00 0.00 O ATOM 99598 H1 WAT 7480 127.380 30.748 74.272 1.00 0.00 H ATOM 99599 H2 WAT 7480 125.895 30.610 74.530 1.00 0.00 H TER 99601 WAT 7480 ATOM 99601 O WAT 7481 24.141 125.416 95.982 1.00 0.00 O ATOM 99602 H1 WAT 7481 23.234 125.721 95.949 1.00 0.00 H ATOM 99603 H2 WAT 7481 24.516 125.688 95.144 1.00 0.00 H TER 99605 WAT 7481 ATOM 99605 O WAT 7482 100.456 27.908 74.565 1.00 0.00 O ATOM 99606 H1 WAT 7482 101.186 28.389 74.955 1.00 0.00 H ATOM 99607 H2 WAT 7482 99.719 28.074 75.153 1.00 0.00 H TER 99609 WAT 7482 ATOM 99609 O WAT 7483 119.862 19.470 12.501 1.00 0.00 O ATOM 99610 H1 WAT 7483 120.093 19.545 13.427 1.00 0.00 H ATOM 99611 H2 WAT 7483 119.027 19.931 12.424 1.00 0.00 H TER 99613 WAT 7483 ATOM 99613 O WAT 7484 1.446 55.360 129.196 1.00 0.00 O ATOM 99614 H1 WAT 7484 2.133 56.019 129.294 1.00 0.00 H ATOM 99615 H2 WAT 7484 1.292 55.040 130.085 1.00 0.00 H TER 99617 WAT 7484 ATOM 99617 O WAT 7485 8.859 85.216 106.600 1.00 0.00 O ATOM 99618 H1 WAT 7485 8.814 84.338 106.223 1.00 0.00 H ATOM 99619 H2 WAT 7485 8.682 85.086 107.532 1.00 0.00 H TER 99621 WAT 7485 ATOM 99621 O WAT 7486 71.547 102.250 95.546 1.00 0.00 O ATOM 99622 H1 WAT 7486 71.742 101.562 94.909 1.00 0.00 H ATOM 99623 H2 WAT 7486 70.940 102.833 95.091 1.00 0.00 H TER 99625 WAT 7486 ATOM 99625 O WAT 7487 62.842 76.403 83.102 1.00 0.00 O ATOM 99626 H1 WAT 7487 62.500 75.632 83.556 1.00 0.00 H ATOM 99627 H2 WAT 7487 62.479 77.145 83.585 1.00 0.00 H TER 99629 WAT 7487 ATOM 99629 O WAT 7488 21.870 99.242 94.318 1.00 0.00 O ATOM 99630 H1 WAT 7488 22.294 100.092 94.438 1.00 0.00 H ATOM 99631 H2 WAT 7488 21.153 99.240 94.952 1.00 0.00 H TER 99633 WAT 7488 ATOM 99633 O WAT 7489 112.982 110.377 95.887 1.00 0.00 O ATOM 99634 H1 WAT 7489 112.284 110.150 96.502 1.00 0.00 H ATOM 99635 H2 WAT 7489 113.791 110.184 96.361 1.00 0.00 H TER 99637 WAT 7489 ATOM 99637 O WAT 7490 67.152 117.631 146.348 1.00 0.00 O ATOM 99638 H1 WAT 7490 66.496 117.658 145.650 1.00 0.00 H ATOM 99639 H2 WAT 7490 67.888 118.136 146.003 1.00 0.00 H TER 99641 WAT 7490 ATOM 99641 O WAT 7491 65.698 145.026 74.483 1.00 0.00 O ATOM 99642 H1 WAT 7491 65.804 144.303 73.866 1.00 0.00 H ATOM 99643 H2 WAT 7491 66.578 145.178 74.828 1.00 0.00 H TER 99645 WAT 7491 ATOM 99645 O WAT 7492 106.794 93.005 59.925 1.00 0.00 O ATOM 99646 H1 WAT 7492 106.410 93.743 59.453 1.00 0.00 H ATOM 99647 H2 WAT 7492 106.547 92.236 59.410 1.00 0.00 H TER 99649 WAT 7492 ATOM 99649 O WAT 7493 86.441 92.885 157.545 1.00 0.00 O ATOM 99650 H1 WAT 7493 87.033 93.385 158.107 1.00 0.00 H ATOM 99651 H2 WAT 7493 86.810 92.002 157.535 1.00 0.00 H TER 99653 WAT 7493 ATOM 99653 O WAT 7494 128.655 41.562 123.503 1.00 0.00 O ATOM 99654 H1 WAT 7494 127.722 41.347 123.501 1.00 0.00 H ATOM 99655 H2 WAT 7494 128.710 42.395 123.036 1.00 0.00 H TER 99657 WAT 7494 ATOM 99657 O WAT 7495 82.266 93.870 97.939 1.00 0.00 O ATOM 99658 H1 WAT 7495 81.325 94.046 97.912 1.00 0.00 H ATOM 99659 H2 WAT 7495 82.600 94.230 97.117 1.00 0.00 H TER 99661 WAT 7495 ATOM 99661 O WAT 7496 29.048 40.001 5.110 1.00 0.00 O ATOM 99662 H1 WAT 7496 28.199 40.236 4.734 1.00 0.00 H ATOM 99663 H2 WAT 7496 29.629 39.919 4.354 1.00 0.00 H TER 99665 WAT 7496 ATOM 99665 O WAT 7497 128.897 135.985 100.819 1.00 0.00 O ATOM 99666 H1 WAT 7497 129.471 136.035 101.583 1.00 0.00 H ATOM 99667 H2 WAT 7497 128.829 136.889 100.510 1.00 0.00 H TER 99669 WAT 7497 ATOM 99669 O WAT 7498 122.071 125.372 92.212 1.00 0.00 O ATOM 99670 H1 WAT 7498 121.351 125.970 92.014 1.00 0.00 H ATOM 99671 H2 WAT 7498 121.682 124.500 92.151 1.00 0.00 H TER 99673 WAT 7498 ATOM 99673 O WAT 7499 12.283 18.100 81.307 1.00 0.00 O ATOM 99674 H1 WAT 7499 11.536 17.700 81.754 1.00 0.00 H ATOM 99675 H2 WAT 7499 12.065 19.031 81.263 1.00 0.00 H TER 99677 WAT 7499 ATOM 99677 O WAT 7500 38.050 105.835 66.758 1.00 0.00 O ATOM 99678 H1 WAT 7500 38.061 104.879 66.716 1.00 0.00 H ATOM 99679 H2 WAT 7500 38.966 106.080 66.887 1.00 0.00 H TER 99681 WAT 7500 ATOM 99681 O WAT 7501 65.515 98.472 104.336 1.00 0.00 O ATOM 99682 H1 WAT 7501 65.641 98.769 103.434 1.00 0.00 H ATOM 99683 H2 WAT 7501 64.608 98.702 104.539 1.00 0.00 H TER 99685 WAT 7501 ATOM 99685 O WAT 7502 81.970 7.983 101.330 1.00 0.00 O ATOM 99686 H1 WAT 7502 82.345 7.306 100.766 1.00 0.00 H ATOM 99687 H2 WAT 7502 82.614 8.691 101.315 1.00 0.00 H TER 99689 WAT 7502 ATOM 99689 O WAT 7503 52.699 32.594 99.050 1.00 0.00 O ATOM 99690 H1 WAT 7503 53.017 33.071 98.283 1.00 0.00 H ATOM 99691 H2 WAT 7503 52.538 31.706 98.730 1.00 0.00 H TER 99693 WAT 7503 ATOM 99693 O WAT 7504 91.011 128.087 75.442 1.00 0.00 O ATOM 99694 H1 WAT 7504 90.907 128.554 76.271 1.00 0.00 H ATOM 99695 H2 WAT 7504 90.124 127.818 75.205 1.00 0.00 H TER 99697 WAT 7504 ATOM 99697 O WAT 7505 57.926 83.060 94.016 1.00 0.00 O ATOM 99698 H1 WAT 7505 58.091 83.721 94.689 1.00 0.00 H ATOM 99699 H2 WAT 7505 56.972 82.984 93.983 1.00 0.00 H TER 99701 WAT 7505 ATOM 99701 O WAT 7506 42.290 77.919 105.315 1.00 0.00 O ATOM 99702 H1 WAT 7506 42.250 77.229 105.977 1.00 0.00 H ATOM 99703 H2 WAT 7506 42.960 77.623 104.700 1.00 0.00 H TER 99705 WAT 7506 ATOM 99705 O WAT 7507 109.471 115.090 114.898 1.00 0.00 O ATOM 99706 H1 WAT 7507 109.671 115.383 114.009 1.00 0.00 H ATOM 99707 H2 WAT 7507 109.076 115.853 115.318 1.00 0.00 H TER 99709 WAT 7507 ATOM 99709 O WAT 7508 26.335 112.609 138.058 1.00 0.00 O ATOM 99710 H1 WAT 7508 26.363 112.887 138.973 1.00 0.00 H ATOM 99711 H2 WAT 7508 25.448 112.272 137.936 1.00 0.00 H TER 99713 WAT 7508 ATOM 99713 O WAT 7509 141.688 123.412 89.459 1.00 0.00 O ATOM 99714 H1 WAT 7509 142.471 123.540 88.924 1.00 0.00 H ATOM 99715 H2 WAT 7509 141.074 124.077 89.148 1.00 0.00 H TER 99717 WAT 7509 ATOM 99717 O WAT 7510 108.471 120.115 0.101 1.00 0.00 O ATOM 99718 H1 WAT 7510 108.871 120.708 0.737 1.00 0.00 H ATOM 99719 H2 WAT 7510 108.632 120.529 -0.747 1.00 0.00 H TER 99721 WAT 7510 ATOM 99721 O WAT 7511 109.953 44.976 87.369 1.00 0.00 O ATOM 99722 H1 WAT 7511 110.692 44.629 86.870 1.00 0.00 H ATOM 99723 H2 WAT 7511 109.458 44.201 87.634 1.00 0.00 H TER 99725 WAT 7511 ATOM 99725 O WAT 7512 5.670 6.147 59.996 1.00 0.00 O ATOM 99726 H1 WAT 7512 5.546 6.893 60.582 1.00 0.00 H ATOM 99727 H2 WAT 7512 5.104 5.464 60.355 1.00 0.00 H TER 99729 WAT 7512 ATOM 99729 O WAT 7513 6.315 128.673 132.956 1.00 0.00 O ATOM 99730 H1 WAT 7513 6.283 128.682 133.912 1.00 0.00 H ATOM 99731 H2 WAT 7513 6.450 127.753 132.730 1.00 0.00 H TER 99733 WAT 7513 ATOM 99733 O WAT 7514 54.321 65.504 28.840 1.00 0.00 O ATOM 99734 H1 WAT 7514 53.365 65.513 28.875 1.00 0.00 H ATOM 99735 H2 WAT 7514 54.549 64.580 28.739 1.00 0.00 H TER 99737 WAT 7514 ATOM 99737 O WAT 7515 45.656 66.619 121.891 1.00 0.00 O ATOM 99738 H1 WAT 7515 45.803 67.399 122.427 1.00 0.00 H ATOM 99739 H2 WAT 7515 45.735 65.889 122.504 1.00 0.00 H TER 99741 WAT 7515 ATOM 99741 O WAT 7516 38.603 85.627 96.530 1.00 0.00 O ATOM 99742 H1 WAT 7516 39.548 85.778 96.550 1.00 0.00 H ATOM 99743 H2 WAT 7516 38.504 84.700 96.749 1.00 0.00 H TER 99745 WAT 7516 ATOM 99745 O WAT 7517 22.481 13.756 66.188 1.00 0.00 O ATOM 99746 H1 WAT 7517 22.143 12.903 66.458 1.00 0.00 H ATOM 99747 H2 WAT 7517 23.410 13.728 66.416 1.00 0.00 H TER 99749 WAT 7517 ATOM 99749 O WAT 7518 32.893 143.137 21.242 1.00 0.00 O ATOM 99750 H1 WAT 7518 33.463 143.905 21.269 1.00 0.00 H ATOM 99751 H2 WAT 7518 32.828 142.920 20.312 1.00 0.00 H TER 99753 WAT 7518 ATOM 99753 O WAT 7519 39.102 88.436 112.763 1.00 0.00 O ATOM 99754 H1 WAT 7519 38.990 88.160 111.854 1.00 0.00 H ATOM 99755 H2 WAT 7519 39.844 89.040 112.741 1.00 0.00 H TER 99757 WAT 7519 ATOM 99757 O WAT 7520 9.689 46.296 105.664 1.00 0.00 O ATOM 99758 H1 WAT 7520 9.412 45.558 106.207 1.00 0.00 H ATOM 99759 H2 WAT 7520 10.404 45.948 105.132 1.00 0.00 H TER 99761 WAT 7520 ATOM 99761 O WAT 7521 122.306 35.395 158.102 1.00 0.00 O ATOM 99762 H1 WAT 7521 122.535 35.450 157.174 1.00 0.00 H ATOM 99763 H2 WAT 7521 122.171 34.461 158.260 1.00 0.00 H TER 99765 WAT 7521 ATOM 99765 O WAT 7522 125.887 75.416 131.411 1.00 0.00 O ATOM 99766 H1 WAT 7522 125.301 76.063 131.803 1.00 0.00 H ATOM 99767 H2 WAT 7522 125.696 74.604 131.881 1.00 0.00 H TER 99769 WAT 7522 ATOM 99769 O WAT 7523 84.844 109.670 77.579 1.00 0.00 O ATOM 99770 H1 WAT 7523 84.809 108.723 77.716 1.00 0.00 H ATOM 99771 H2 WAT 7523 85.341 109.776 76.768 1.00 0.00 H TER 99773 WAT 7523 ATOM 99773 O WAT 7524 88.707 35.943 63.292 1.00 0.00 O ATOM 99774 H1 WAT 7524 88.261 36.733 63.596 1.00 0.00 H ATOM 99775 H2 WAT 7524 89.638 36.144 63.380 1.00 0.00 H TER 99777 WAT 7524 ATOM 99777 O WAT 7525 143.707 66.559 146.483 1.00 0.00 O ATOM 99778 H1 WAT 7525 144.574 66.902 146.266 1.00 0.00 H ATOM 99779 H2 WAT 7525 143.114 67.295 146.333 1.00 0.00 H TER 99781 WAT 7525 ATOM 99781 O WAT 7526 38.129 76.011 94.297 1.00 0.00 O ATOM 99782 H1 WAT 7526 38.350 75.579 93.472 1.00 0.00 H ATOM 99783 H2 WAT 7526 37.593 76.761 94.039 1.00 0.00 H TER 99785 WAT 7526 ATOM 99785 O WAT 7527 1.376 49.248 97.071 1.00 0.00 O ATOM 99786 H1 WAT 7527 0.569 49.400 97.563 1.00 0.00 H ATOM 99787 H2 WAT 7527 1.788 50.110 97.013 1.00 0.00 H TER 99789 WAT 7527 ATOM 99789 O WAT 7528 96.278 14.750 80.533 1.00 0.00 O ATOM 99790 H1 WAT 7528 97.173 15.044 80.703 1.00 0.00 H ATOM 99791 H2 WAT 7528 96.334 13.795 80.537 1.00 0.00 H TER 99793 WAT 7528 ATOM 99793 O WAT 7529 115.655 31.374 148.551 1.00 0.00 O ATOM 99794 H1 WAT 7529 115.345 31.381 149.457 1.00 0.00 H ATOM 99795 H2 WAT 7529 116.269 30.640 148.514 1.00 0.00 H TER 99797 WAT 7529 ATOM 99797 O WAT 7530 110.692 85.363 127.779 1.00 0.00 O ATOM 99798 H1 WAT 7530 110.757 86.318 127.788 1.00 0.00 H ATOM 99799 H2 WAT 7530 110.955 85.114 126.893 1.00 0.00 H TER 99801 WAT 7530 ATOM 99801 O WAT 7531 141.445 68.970 148.901 1.00 0.00 O ATOM 99802 H1 WAT 7531 140.917 69.741 149.112 1.00 0.00 H ATOM 99803 H2 WAT 7531 141.671 69.080 147.978 1.00 0.00 H TER 99805 WAT 7531 ATOM 99805 O WAT 7532 25.012 61.840 113.079 1.00 0.00 O ATOM 99806 H1 WAT 7532 24.600 61.358 112.363 1.00 0.00 H ATOM 99807 H2 WAT 7532 25.920 61.535 113.082 1.00 0.00 H TER 99809 WAT 7532 ATOM 99809 O WAT 7533 17.826 84.953 96.999 1.00 0.00 O ATOM 99810 H1 WAT 7533 18.590 84.778 97.548 1.00 0.00 H ATOM 99811 H2 WAT 7533 18.101 85.669 96.427 1.00 0.00 H TER 99813 WAT 7533 ATOM 99813 O WAT 7534 16.547 59.881 112.721 1.00 0.00 O ATOM 99814 H1 WAT 7534 16.622 59.569 111.819 1.00 0.00 H ATOM 99815 H2 WAT 7534 17.429 59.787 113.081 1.00 0.00 H TER 99817 WAT 7534 ATOM 99817 O WAT 7535 142.579 108.444 120.436 1.00 0.00 O ATOM 99818 H1 WAT 7535 142.206 109.144 120.973 1.00 0.00 H ATOM 99819 H2 WAT 7535 142.558 107.672 121.000 1.00 0.00 H TER 99821 WAT 7535 ATOM 99821 O WAT 7536 10.826 39.525 149.234 1.00 0.00 O ATOM 99822 H1 WAT 7536 10.194 39.810 149.894 1.00 0.00 H ATOM 99823 H2 WAT 7536 10.752 40.174 148.535 1.00 0.00 H TER 99825 WAT 7536 ATOM 99825 O WAT 7537 28.931 119.309 130.957 1.00 0.00 O ATOM 99826 H1 WAT 7537 29.102 118.803 131.752 1.00 0.00 H ATOM 99827 H2 WAT 7537 28.046 119.652 131.077 1.00 0.00 H TER 99829 WAT 7537 ATOM 99829 O WAT 7538 53.395 18.893 66.598 1.00 0.00 O ATOM 99830 H1 WAT 7538 53.865 19.135 67.396 1.00 0.00 H ATOM 99831 H2 WAT 7538 54.062 18.500 66.036 1.00 0.00 H TER 99833 WAT 7538 ATOM 99833 O WAT 7539 38.312 109.160 92.392 1.00 0.00 O ATOM 99834 H1 WAT 7539 37.751 109.821 92.797 1.00 0.00 H ATOM 99835 H2 WAT 7539 37.960 108.325 92.701 1.00 0.00 H TER 99837 WAT 7539 ATOM 99837 O WAT 7540 78.169 108.583 94.785 1.00 0.00 O ATOM 99838 H1 WAT 7540 79.094 108.730 94.589 1.00 0.00 H ATOM 99839 H2 WAT 7540 77.803 108.240 93.970 1.00 0.00 H TER 99841 WAT 7540 ATOM 99841 O WAT 7541 141.601 66.101 93.728 1.00 0.00 O ATOM 99842 H1 WAT 7541 141.948 65.690 94.520 1.00 0.00 H ATOM 99843 H2 WAT 7541 141.258 66.943 94.026 1.00 0.00 H TER 99845 WAT 7541 ATOM 99845 O WAT 7542 106.950 59.597 82.495 1.00 0.00 O ATOM 99846 H1 WAT 7542 106.004 59.611 82.641 1.00 0.00 H ATOM 99847 H2 WAT 7542 107.282 60.335 83.006 1.00 0.00 H TER 99849 WAT 7542 ATOM 99849 O WAT 7543 97.732 69.985 63.685 1.00 0.00 O ATOM 99850 H1 WAT 7543 97.413 70.666 63.092 1.00 0.00 H ATOM 99851 H2 WAT 7543 98.351 69.479 63.159 1.00 0.00 H TER 99853 WAT 7543 ATOM 99853 O WAT 7544 132.701 103.089 156.141 1.00 0.00 O ATOM 99854 H1 WAT 7544 132.265 103.853 155.764 1.00 0.00 H ATOM 99855 H2 WAT 7544 131.988 102.489 156.360 1.00 0.00 H TER 99857 WAT 7544 ATOM 99857 O WAT 7545 24.379 53.203 129.624 1.00 0.00 O ATOM 99858 H1 WAT 7545 24.394 52.811 128.751 1.00 0.00 H ATOM 99859 H2 WAT 7545 24.871 54.019 129.530 1.00 0.00 H TER 99861 WAT 7545 ATOM 99861 O WAT 7546 90.868 7.273 134.063 1.00 0.00 O ATOM 99862 H1 WAT 7546 90.516 7.284 134.953 1.00 0.00 H ATOM 99863 H2 WAT 7546 91.194 8.162 133.923 1.00 0.00 H TER 99865 WAT 7546 ATOM 99865 O WAT 7547 29.457 58.622 78.474 1.00 0.00 O ATOM 99866 H1 WAT 7547 28.572 58.753 78.814 1.00 0.00 H ATOM 99867 H2 WAT 7547 29.969 58.355 79.237 1.00 0.00 H TER 99869 WAT 7547 ATOM 99869 O WAT 7548 139.908 45.072 12.848 1.00 0.00 O ATOM 99870 H1 WAT 7548 139.762 44.140 13.011 1.00 0.00 H ATOM 99871 H2 WAT 7548 139.872 45.475 13.716 1.00 0.00 H TER 99873 WAT 7548 ATOM 99873 O WAT 7549 89.679 76.432 137.470 1.00 0.00 O ATOM 99874 H1 WAT 7549 89.844 76.062 136.602 1.00 0.00 H ATOM 99875 H2 WAT 7549 89.050 77.136 137.314 1.00 0.00 H TER 99877 WAT 7549 ATOM 99877 O WAT 7550 31.375 132.633 120.236 1.00 0.00 O ATOM 99878 H1 WAT 7550 31.717 133.129 119.491 1.00 0.00 H ATOM 99879 H2 WAT 7550 32.146 132.443 120.771 1.00 0.00 H TER 99881 WAT 7550 ATOM 99881 O WAT 7551 136.050 111.416 117.524 1.00 0.00 O ATOM 99882 H1 WAT 7551 135.468 111.646 118.248 1.00 0.00 H ATOM 99883 H2 WAT 7551 136.875 111.177 117.946 1.00 0.00 H TER 99885 WAT 7551 ATOM 99885 O WAT 7552 31.374 103.686 146.199 1.00 0.00 O ATOM 99886 H1 WAT 7552 30.475 104.005 146.123 1.00 0.00 H ATOM 99887 H2 WAT 7552 31.797 103.969 145.388 1.00 0.00 H TER 99889 WAT 7552 ATOM 99889 O WAT 7553 54.554 45.451 137.098 1.00 0.00 O ATOM 99890 H1 WAT 7553 54.902 46.216 137.556 1.00 0.00 H ATOM 99891 H2 WAT 7553 55.267 44.813 137.121 1.00 0.00 H TER 99893 WAT 7553 ATOM 99893 O WAT 7554 31.080 3.037 66.313 1.00 0.00 O ATOM 99894 H1 WAT 7554 30.247 3.390 66.000 1.00 0.00 H ATOM 99895 H2 WAT 7554 31.725 3.347 65.677 1.00 0.00 H TER 99897 WAT 7554 ATOM 99897 O WAT 7555 51.679 46.319 102.262 1.00 0.00 O ATOM 99898 H1 WAT 7555 52.427 46.150 101.689 1.00 0.00 H ATOM 99899 H2 WAT 7555 50.976 45.776 101.904 1.00 0.00 H TER 99901 WAT 7555 ATOM 99901 O WAT 7556 105.914 81.089 158.959 1.00 0.00 O ATOM 99902 H1 WAT 7556 106.383 81.201 158.131 1.00 0.00 H ATOM 99903 H2 WAT 7556 105.357 80.324 158.817 1.00 0.00 H TER 99905 WAT 7556 ATOM 99905 O WAT 7557 53.706 99.924 83.623 1.00 0.00 O ATOM 99906 H1 WAT 7557 54.366 99.232 83.577 1.00 0.00 H ATOM 99907 H2 WAT 7557 53.177 99.804 82.834 1.00 0.00 H TER 99909 WAT 7557 ATOM 99909 O WAT 7558 83.183 5.085 126.749 1.00 0.00 O ATOM 99910 H1 WAT 7558 83.407 5.383 125.867 1.00 0.00 H ATOM 99911 H2 WAT 7558 82.226 5.093 126.769 1.00 0.00 H TER 99913 WAT 7558 ATOM 99913 O WAT 7559 49.323 116.044 91.622 1.00 0.00 O ATOM 99914 H1 WAT 7559 49.309 116.512 90.787 1.00 0.00 H ATOM 99915 H2 WAT 7559 48.472 116.233 92.017 1.00 0.00 H TER 99917 WAT 7559 ATOM 99917 O WAT 7560 143.593 97.648 94.242 1.00 0.00 O ATOM 99918 H1 WAT 7560 143.131 97.181 94.938 1.00 0.00 H ATOM 99919 H2 WAT 7560 144.493 97.327 94.294 1.00 0.00 H TER 99921 WAT 7560 ATOM 99921 O WAT 7561 84.877 41.980 149.443 1.00 0.00 O ATOM 99922 H1 WAT 7561 85.557 41.653 148.853 1.00 0.00 H ATOM 99923 H2 WAT 7561 84.100 42.060 148.890 1.00 0.00 H TER 99925 WAT 7561 ATOM 99925 O WAT 7562 127.390 23.305 127.147 1.00 0.00 O ATOM 99926 H1 WAT 7562 126.499 23.140 126.839 1.00 0.00 H ATOM 99927 H2 WAT 7562 127.536 24.235 126.974 1.00 0.00 H TER 99929 WAT 7562 ATOM 99929 O WAT 7563 52.761 136.436 84.502 1.00 0.00 O ATOM 99930 H1 WAT 7563 53.469 136.561 83.870 1.00 0.00 H ATOM 99931 H2 WAT 7563 52.124 137.116 84.286 1.00 0.00 H TER 99933 WAT 7563 ATOM 99933 O WAT 7564 49.390 79.630 9.481 1.00 0.00 O ATOM 99934 H1 WAT 7564 50.091 79.892 8.884 1.00 0.00 H ATOM 99935 H2 WAT 7564 48.781 80.369 9.474 1.00 0.00 H TER 99937 WAT 7564 ATOM 99937 O WAT 7565 103.740 66.859 106.043 1.00 0.00 O ATOM 99938 H1 WAT 7565 103.355 67.319 106.789 1.00 0.00 H ATOM 99939 H2 WAT 7565 104.258 66.156 106.437 1.00 0.00 H TER 99941 WAT 7565 ATOM 99941 O WAT 7566 7.646 23.537 80.372 1.00 0.00 O ATOM 99942 H1 WAT 7566 8.073 23.841 79.571 1.00 0.00 H ATOM 99943 H2 WAT 7566 6.727 23.778 80.259 1.00 0.00 H TER 99945 WAT 7566 ATOM 99945 O WAT 7567 129.181 37.716 136.617 1.00 0.00 O ATOM 99946 H1 WAT 7567 128.325 37.737 137.045 1.00 0.00 H ATOM 99947 H2 WAT 7567 129.766 37.333 137.271 1.00 0.00 H TER 99949 WAT 7567 ATOM 99949 O WAT 7568 44.242 65.027 3.033 1.00 0.00 O ATOM 99950 H1 WAT 7568 44.102 64.588 3.872 1.00 0.00 H ATOM 99951 H2 WAT 7568 43.677 64.556 2.420 1.00 0.00 H TER 99953 WAT 7568 ATOM 99953 O WAT 7569 32.387 96.824 142.510 1.00 0.00 O ATOM 99954 H1 WAT 7569 33.342 96.860 142.453 1.00 0.00 H ATOM 99955 H2 WAT 7569 32.188 97.141 143.391 1.00 0.00 H TER 99957 WAT 7569 ATOM 99957 O WAT 7570 47.972 61.329 29.428 1.00 0.00 O ATOM 99958 H1 WAT 7570 48.838 61.706 29.579 1.00 0.00 H ATOM 99959 H2 WAT 7570 47.772 60.856 30.236 1.00 0.00 H TER 99961 WAT 7570 ATOM 99961 O WAT 7571 15.522 53.937 99.618 1.00 0.00 O ATOM 99962 H1 WAT 7571 16.182 54.569 99.333 1.00 0.00 H ATOM 99963 H2 WAT 7571 14.774 54.473 99.881 1.00 0.00 H TER 99965 WAT 7571 ATOM 99965 O WAT 7572 11.837 18.981 151.653 1.00 0.00 O ATOM 99966 H1 WAT 7572 10.904 18.981 151.437 1.00 0.00 H ATOM 99967 H2 WAT 7572 11.892 19.473 152.473 1.00 0.00 H TER 99969 WAT 7572 ATOM 99969 O WAT 7573 18.262 23.868 151.000 1.00 0.00 O ATOM 99970 H1 WAT 7573 17.554 24.225 151.537 1.00 0.00 H ATOM 99971 H2 WAT 7573 18.840 24.614 150.840 1.00 0.00 H TER 99973 WAT 7573 ATOM 99973 O WAT 7574 119.367 80.747 123.602 1.00 0.00 O ATOM 99974 H1 WAT 7574 119.227 81.586 124.041 1.00 0.00 H ATOM 99975 H2 WAT 7574 118.811 80.788 122.823 1.00 0.00 H TER 99977 WAT 7574 ATOM 99977 O WAT 7575 109.940 82.229 126.550 1.00 0.00 O ATOM 99978 H1 WAT 7575 110.436 81.465 126.257 1.00 0.00 H ATOM 99979 H2 WAT 7575 109.375 82.447 125.809 1.00 0.00 H TER 99981 WAT 7575 ATOM 99981 O WAT 7576 115.383 67.912 90.550 1.00 0.00 O ATOM 99982 H1 WAT 7576 114.965 67.089 90.803 1.00 0.00 H ATOM 99983 H2 WAT 7576 116.310 67.693 90.463 1.00 0.00 H TER 99985 WAT 7576 ATOM 99985 O WAT 7577 44.367 31.177 107.490 1.00 0.00 O ATOM 99986 H1 WAT 7577 43.802 30.654 106.921 1.00 0.00 H ATOM 99987 H2 WAT 7577 45.241 31.082 107.113 1.00 0.00 H TER 99989 WAT 7577 ATOM 99989 O WAT 7578 54.770 115.993 79.166 1.00 0.00 O ATOM 99990 H1 WAT 7578 54.186 115.248 79.024 1.00 0.00 H ATOM 99991 H2 WAT 7578 55.631 115.678 78.891 1.00 0.00 H TER 99993 WAT 7578 ATOM 99993 O WAT 7579 29.497 128.006 19.598 1.00 0.00 O ATOM 99994 H1 WAT 7579 29.551 127.144 20.009 1.00 0.00 H ATOM 99995 H2 WAT 7579 30.308 128.446 19.854 1.00 0.00 H TER 99997 WAT 7579 ATOM 99997 O WAT 7580 143.392 61.965 2.442 1.00 0.00 O ATOM 99998 H1 WAT 7580 143.060 61.943 3.339 1.00 0.00 H ATOM 99999 H2 WAT 7580 144.129 61.354 2.443 1.00 0.00 H TER 1 WAT 7580 ATOM 1 O WAT 7581 29.022 128.572 111.455 1.00 0.00 O ATOM 2 H1 WAT 7581 29.264 129.330 111.988 1.00 0.00 H ATOM 3 H2 WAT 7581 29.346 128.783 110.579 1.00 0.00 H TER 5 WAT 7581 ATOM 5 O WAT 7582 81.552 60.660 141.468 1.00 0.00 O ATOM 6 H1 WAT 7582 80.990 60.820 140.710 1.00 0.00 H ATOM 7 H2 WAT 7582 81.240 61.277 142.131 1.00 0.00 H TER 9 WAT 7582 ATOM 9 O WAT 7583 27.581 92.336 20.357 1.00 0.00 O ATOM 10 H1 WAT 7583 27.437 91.535 20.861 1.00 0.00 H ATOM 11 H2 WAT 7583 28.101 92.893 20.937 1.00 0.00 H TER 13 WAT 7583 ATOM 13 O WAT 7584 29.202 93.905 22.078 1.00 0.00 O ATOM 14 H1 WAT 7584 29.210 94.634 21.457 1.00 0.00 H ATOM 15 H2 WAT 7584 29.734 93.228 21.660 1.00 0.00 H TER 17 WAT 7584 ATOM 17 O WAT 7585 59.806 139.892 136.032 1.00 0.00 O ATOM 18 H1 WAT 7585 59.180 140.616 136.017 1.00 0.00 H ATOM 19 H2 WAT 7585 60.593 140.264 136.429 1.00 0.00 H TER 21 WAT 7585 ATOM 21 O WAT 7586 85.696 109.314 57.191 1.00 0.00 O ATOM 22 H1 WAT 7586 84.998 108.817 56.765 1.00 0.00 H ATOM 23 H2 WAT 7586 85.367 109.480 58.075 1.00 0.00 H TER 25 WAT 7586 ATOM 25 O WAT 7587 46.392 131.075 122.100 1.00 0.00 O ATOM 26 H1 WAT 7587 45.686 131.688 122.307 1.00 0.00 H ATOM 27 H2 WAT 7587 47.189 131.523 122.382 1.00 0.00 H TER 29 WAT 7587 ATOM 29 O WAT 7588 19.468 23.160 76.594 1.00 0.00 O ATOM 30 H1 WAT 7588 19.835 23.730 75.919 1.00 0.00 H ATOM 31 H2 WAT 7588 19.922 22.326 76.475 1.00 0.00 H TER 33 WAT 7588 ATOM 33 O WAT 7589 23.840 138.141 141.159 1.00 0.00 O ATOM 34 H1 WAT 7589 23.231 137.713 140.557 1.00 0.00 H ATOM 35 H2 WAT 7589 23.331 138.851 141.551 1.00 0.00 H TER 37 WAT 7589 ATOM 37 O WAT 7590 3.574 20.992 111.748 1.00 0.00 O ATOM 38 H1 WAT 7590 3.466 21.587 112.490 1.00 0.00 H ATOM 39 H2 WAT 7590 4.260 20.386 112.025 1.00 0.00 H TER 41 WAT 7590 ATOM 41 O WAT 7591 37.584 11.805 4.373 1.00 0.00 O ATOM 42 H1 WAT 7591 37.439 12.190 5.237 1.00 0.00 H ATOM 43 H2 WAT 7591 38.536 11.735 4.299 1.00 0.00 H TER 45 WAT 7591 ATOM 45 O WAT 7592 52.535 26.938 95.542 1.00 0.00 O ATOM 46 H1 WAT 7592 52.696 26.218 94.931 1.00 0.00 H ATOM 47 H2 WAT 7592 52.221 26.510 96.339 1.00 0.00 H TER 49 WAT 7592 ATOM 49 O WAT 7593 77.242 16.642 69.251 1.00 0.00 O ATOM 50 H1 WAT 7593 77.251 16.037 69.993 1.00 0.00 H ATOM 51 H2 WAT 7593 77.530 17.477 69.620 1.00 0.00 H TER 53 WAT 7593 ATOM 53 O WAT 7594 99.547 114.433 125.000 1.00 0.00 O ATOM 54 H1 WAT 7594 99.550 113.621 124.494 1.00 0.00 H ATOM 55 H2 WAT 7594 98.956 115.013 124.520 1.00 0.00 H TER 57 WAT 7594 ATOM 57 O WAT 7595 46.800 130.835 144.369 1.00 0.00 O ATOM 58 H1 WAT 7595 46.650 131.149 145.261 1.00 0.00 H ATOM 59 H2 WAT 7595 47.450 131.437 144.009 1.00 0.00 H TER 61 WAT 7595 ATOM 61 O WAT 7596 120.091 113.196 153.330 1.00 0.00 O ATOM 62 H1 WAT 7596 119.560 113.572 152.628 1.00 0.00 H ATOM 63 H2 WAT 7596 120.792 112.729 152.876 1.00 0.00 H TER 65 WAT 7596 ATOM 65 O WAT 7597 9.561 28.934 90.794 1.00 0.00 O ATOM 66 H1 WAT 7597 9.265 28.901 91.704 1.00 0.00 H ATOM 67 H2 WAT 7597 8.846 28.540 90.295 1.00 0.00 H TER 69 WAT 7597 ATOM 69 O WAT 7598 3.451 29.357 137.123 1.00 0.00 O ATOM 70 H1 WAT 7598 2.904 28.930 136.463 1.00 0.00 H ATOM 71 H2 WAT 7598 4.167 28.741 137.275 1.00 0.00 H TER 73 WAT 7598 ATOM 73 O WAT 7599 76.553 143.993 59.626 1.00 0.00 O ATOM 74 H1 WAT 7599 76.836 143.118 59.893 1.00 0.00 H ATOM 75 H2 WAT 7599 77.267 144.320 59.079 1.00 0.00 H TER 77 WAT 7599 ATOM 77 O WAT 7600 29.181 22.657 61.599 1.00 0.00 O ATOM 78 H1 WAT 7600 29.383 22.150 60.813 1.00 0.00 H ATOM 79 H2 WAT 7600 29.413 23.557 61.371 1.00 0.00 H TER 81 WAT 7600 ATOM 81 O WAT 7601 2.170 73.210 58.806 1.00 0.00 O ATOM 82 H1 WAT 7601 2.304 72.263 58.789 1.00 0.00 H ATOM 83 H2 WAT 7601 2.797 73.552 58.169 1.00 0.00 H TER 85 WAT 7601 ATOM 85 O WAT 7602 57.881 67.717 111.538 1.00 0.00 O ATOM 86 H1 WAT 7602 57.538 67.646 112.429 1.00 0.00 H ATOM 87 H2 WAT 7602 57.447 68.489 111.175 1.00 0.00 H TER 89 WAT 7602 ATOM 89 O WAT 7603 77.447 128.332 122.056 1.00 0.00 O ATOM 90 H1 WAT 7603 77.425 127.462 122.454 1.00 0.00 H ATOM 91 H2 WAT 7603 78.197 128.764 122.465 1.00 0.00 H TER 93 WAT 7603 ATOM 93 O WAT 7604 4.957 97.181 60.402 1.00 0.00 O ATOM 94 H1 WAT 7604 4.088 96.909 60.696 1.00 0.00 H ATOM 95 H2 WAT 7604 4.921 98.138 60.403 1.00 0.00 H TER 97 WAT 7604 ATOM 97 O WAT 7605 126.209 56.261 98.015 1.00 0.00 O ATOM 98 H1 WAT 7605 127.070 56.116 97.623 1.00 0.00 H ATOM 99 H2 WAT 7605 126.031 57.189 97.864 1.00 0.00 H TER 101 WAT 7605 ATOM 101 O WAT 7606 118.295 67.345 119.735 1.00 0.00 O ATOM 102 H1 WAT 7606 118.429 66.699 119.041 1.00 0.00 H ATOM 103 H2 WAT 7606 118.900 68.055 119.521 1.00 0.00 H TER 105 WAT 7606 ATOM 105 O WAT 7607 137.956 6.876 97.008 1.00 0.00 O ATOM 106 H1 WAT 7607 137.408 6.899 97.793 1.00 0.00 H ATOM 107 H2 WAT 7607 138.826 7.127 97.316 1.00 0.00 H TER 109 WAT 7607 ATOM 109 O WAT 7608 17.261 68.893 113.016 1.00 0.00 O ATOM 110 H1 WAT 7608 16.782 68.496 112.289 1.00 0.00 H ATOM 111 H2 WAT 7608 18.162 68.959 112.702 1.00 0.00 H TER 113 WAT 7608 ATOM 113 O WAT 7609 28.131 2.506 11.037 1.00 0.00 O ATOM 114 H1 WAT 7609 27.834 3.375 11.306 1.00 0.00 H ATOM 115 H2 WAT 7609 27.409 1.923 11.269 1.00 0.00 H TER 117 WAT 7609 ATOM 117 O WAT 7610 106.003 143.823 63.899 1.00 0.00 O ATOM 118 H1 WAT 7610 106.179 144.639 63.429 1.00 0.00 H ATOM 119 H2 WAT 7610 106.829 143.342 63.861 1.00 0.00 H TER 121 WAT 7610 ATOM 121 O WAT 7611 131.764 131.938 143.599 1.00 0.00 O ATOM 122 H1 WAT 7611 132.144 132.670 143.113 1.00 0.00 H ATOM 123 H2 WAT 7611 130.858 132.201 143.761 1.00 0.00 H TER 125 WAT 7611 ATOM 125 O WAT 7612 73.370 121.715 147.610 1.00 0.00 O ATOM 126 H1 WAT 7612 74.085 121.433 148.179 1.00 0.00 H ATOM 127 H2 WAT 7612 72.638 121.143 147.843 1.00 0.00 H TER 129 WAT 7612 ATOM 129 O WAT 7613 139.916 117.075 88.874 1.00 0.00 O ATOM 130 H1 WAT 7613 139.066 117.451 89.102 1.00 0.00 H ATOM 131 H2 WAT 7613 140.548 117.760 89.094 1.00 0.00 H TER 133 WAT 7613 ATOM 133 O WAT 7614 5.497 122.706 63.001 1.00 0.00 O ATOM 134 H1 WAT 7614 5.641 122.903 62.075 1.00 0.00 H ATOM 135 H2 WAT 7614 4.680 122.208 63.015 1.00 0.00 H TER 137 WAT 7614 ATOM 137 O WAT 7615 43.516 103.014 132.305 1.00 0.00 O ATOM 138 H1 WAT 7615 43.504 103.613 133.051 1.00 0.00 H ATOM 139 H2 WAT 7615 44.445 102.903 132.102 1.00 0.00 H TER 141 WAT 7615 ATOM 141 O WAT 7616 118.406 27.221 61.754 1.00 0.00 O ATOM 142 H1 WAT 7616 118.649 26.312 61.930 1.00 0.00 H ATOM 143 H2 WAT 7616 118.870 27.727 62.421 1.00 0.00 H TER 145 WAT 7616 ATOM 145 O WAT 7617 84.942 102.708 2.583 1.00 0.00 O ATOM 146 H1 WAT 7617 84.631 103.606 2.704 1.00 0.00 H ATOM 147 H2 WAT 7617 84.518 102.415 1.777 1.00 0.00 H TER 149 WAT 7617 ATOM 149 O WAT 7618 123.299 23.847 67.613 1.00 0.00 O ATOM 150 H1 WAT 7618 122.827 23.367 66.932 1.00 0.00 H ATOM 151 H2 WAT 7618 122.613 24.166 68.200 1.00 0.00 H TER 153 WAT 7618 ATOM 153 O WAT 7619 9.093 27.963 59.550 1.00 0.00 O ATOM 154 H1 WAT 7619 9.233 28.263 58.652 1.00 0.00 H ATOM 155 H2 WAT 7619 8.317 28.440 59.843 1.00 0.00 H TER 157 WAT 7619 ATOM 157 O WAT 7620 39.368 39.709 90.071 1.00 0.00 O ATOM 158 H1 WAT 7620 39.256 38.796 90.337 1.00 0.00 H ATOM 159 H2 WAT 7620 39.605 40.166 90.878 1.00 0.00 H TER 161 WAT 7620 ATOM 161 O WAT 7621 111.102 78.305 87.138 1.00 0.00 O ATOM 162 H1 WAT 7621 111.790 77.660 87.302 1.00 0.00 H ATOM 163 H2 WAT 7621 111.452 79.124 87.491 1.00 0.00 H TER 165 WAT 7621 ATOM 165 O WAT 7622 24.250 116.052 149.818 1.00 0.00 O ATOM 166 H1 WAT 7622 24.344 115.117 150.002 1.00 0.00 H ATOM 167 H2 WAT 7622 24.305 116.115 148.865 1.00 0.00 H TER 169 WAT 7622 ATOM 169 O WAT 7623 87.646 103.604 151.697 1.00 0.00 O ATOM 170 H1 WAT 7623 88.369 103.977 152.202 1.00 0.00 H ATOM 171 H2 WAT 7623 86.937 104.240 151.789 1.00 0.00 H TER 173 WAT 7623 ATOM 173 O WAT 7624 117.265 141.618 92.128 1.00 0.00 O ATOM 174 H1 WAT 7624 117.473 140.764 91.748 1.00 0.00 H ATOM 175 H2 WAT 7624 117.404 141.503 93.068 1.00 0.00 H TER 177 WAT 7624 ATOM 177 O WAT 7625 63.685 101.077 78.101 1.00 0.00 O ATOM 178 H1 WAT 7625 64.084 101.529 77.357 1.00 0.00 H ATOM 179 H2 WAT 7625 64.352 101.108 78.786 1.00 0.00 H TER 181 WAT 7625 ATOM 181 O WAT 7626 91.261 145.458 74.067 1.00 0.00 O ATOM 182 H1 WAT 7626 90.966 146.158 74.649 1.00 0.00 H ATOM 183 H2 WAT 7626 91.118 145.803 73.186 1.00 0.00 H TER 185 WAT 7626 ATOM 185 O WAT 7627 133.469 73.318 107.800 1.00 0.00 O ATOM 186 H1 WAT 7627 133.931 74.155 107.822 1.00 0.00 H ATOM 187 H2 WAT 7627 133.262 73.182 106.875 1.00 0.00 H TER 189 WAT 7627 ATOM 189 O WAT 7628 141.486 52.490 75.997 1.00 0.00 O ATOM 190 H1 WAT 7628 141.061 51.676 75.727 1.00 0.00 H ATOM 191 H2 WAT 7628 142.417 52.342 75.826 1.00 0.00 H TER 193 WAT 7628 ATOM 193 O WAT 7629 92.929 102.933 61.397 1.00 0.00 O ATOM 194 H1 WAT 7629 93.179 103.814 61.118 1.00 0.00 H ATOM 195 H2 WAT 7629 93.688 102.389 61.184 1.00 0.00 H TER 197 WAT 7629 ATOM 197 O WAT 7630 144.146 109.522 5.736 1.00 0.00 O ATOM 198 H1 WAT 7630 143.534 108.884 6.103 1.00 0.00 H ATOM 199 H2 WAT 7630 143.974 109.504 4.794 1.00 0.00 H TER 201 WAT 7630 ATOM 201 O WAT 7631 36.706 13.521 138.654 1.00 0.00 O ATOM 202 H1 WAT 7631 35.775 13.581 138.444 1.00 0.00 H ATOM 203 H2 WAT 7631 36.853 12.592 138.831 1.00 0.00 H TER 205 WAT 7631 ATOM 205 O WAT 7632 108.464 136.140 6.623 1.00 0.00 O ATOM 206 H1 WAT 7632 108.029 135.297 6.499 1.00 0.00 H ATOM 207 H2 WAT 7632 108.233 136.401 7.514 1.00 0.00 H TER 209 WAT 7632 ATOM 209 O WAT 7633 24.379 14.136 151.968 1.00 0.00 O ATOM 210 H1 WAT 7633 24.019 14.997 152.181 1.00 0.00 H ATOM 211 H2 WAT 7633 24.014 13.930 151.107 1.00 0.00 H TER 213 WAT 7633 ATOM 213 O WAT 7634 15.159 140.489 89.523 1.00 0.00 O ATOM 214 H1 WAT 7634 14.354 140.002 89.346 1.00 0.00 H ATOM 215 H2 WAT 7634 14.907 141.408 89.437 1.00 0.00 H TER 217 WAT 7634 ATOM 217 O WAT 7635 57.603 59.395 96.235 1.00 0.00 O ATOM 218 H1 WAT 7635 58.168 59.367 97.007 1.00 0.00 H ATOM 219 H2 WAT 7635 58.091 59.918 95.599 1.00 0.00 H TER 221 WAT 7635 ATOM 221 O WAT 7636 114.552 1.737 155.207 1.00 0.00 O ATOM 222 H1 WAT 7636 114.374 2.600 154.832 1.00 0.00 H ATOM 223 H2 WAT 7636 115.266 1.387 154.673 1.00 0.00 H TER 225 WAT 7636 ATOM 225 O WAT 7637 133.517 107.955 25.692 1.00 0.00 O ATOM 226 H1 WAT 7637 134.235 107.345 25.858 1.00 0.00 H ATOM 227 H2 WAT 7637 133.883 108.816 25.893 1.00 0.00 H TER 229 WAT 7637 ATOM 229 O WAT 7638 89.204 76.564 145.205 1.00 0.00 O ATOM 230 H1 WAT 7638 88.310 76.901 145.259 1.00 0.00 H ATOM 231 H2 WAT 7638 89.288 76.251 144.304 1.00 0.00 H TER 233 WAT 7638 ATOM 233 O WAT 7639 37.824 66.844 74.455 1.00 0.00 O ATOM 234 H1 WAT 7639 37.137 67.390 74.837 1.00 0.00 H ATOM 235 H2 WAT 7639 38.255 67.412 73.816 1.00 0.00 H TER 237 WAT 7639 ATOM 237 O WAT 7640 25.495 4.028 66.302 1.00 0.00 O ATOM 238 H1 WAT 7640 25.026 3.282 66.675 1.00 0.00 H ATOM 239 H2 WAT 7640 24.830 4.712 66.221 1.00 0.00 H TER 241 WAT 7640 ATOM 241 O WAT 7641 39.755 110.779 61.234 1.00 0.00 O ATOM 242 H1 WAT 7641 40.450 111.419 61.388 1.00 0.00 H ATOM 243 H2 WAT 7641 39.442 110.973 60.350 1.00 0.00 H TER 245 WAT 7641 ATOM 245 O WAT 7642 72.275 9.368 100.973 1.00 0.00 O ATOM 246 H1 WAT 7642 72.494 8.740 101.661 1.00 0.00 H ATOM 247 H2 WAT 7642 71.526 8.978 100.522 1.00 0.00 H TER 249 WAT 7642 ATOM 249 O WAT 7643 5.097 24.538 141.188 1.00 0.00 O ATOM 250 H1 WAT 7643 5.271 24.657 142.122 1.00 0.00 H ATOM 251 H2 WAT 7643 5.760 23.911 140.899 1.00 0.00 H TER 253 WAT 7643 ATOM 253 O WAT 7644 48.470 137.877 1.557 1.00 0.00 O ATOM 254 H1 WAT 7644 48.425 136.921 1.524 1.00 0.00 H ATOM 255 H2 WAT 7644 47.773 138.170 0.969 1.00 0.00 H TER 257 WAT 7644 ATOM 257 O WAT 7645 78.519 93.194 157.557 1.00 0.00 O ATOM 258 H1 WAT 7645 78.624 92.460 156.951 1.00 0.00 H ATOM 259 H2 WAT 7645 78.986 92.921 158.347 1.00 0.00 H TER 261 WAT 7645 ATOM 261 O WAT 7646 51.844 130.859 110.836 1.00 0.00 O ATOM 262 H1 WAT 7646 51.517 131.746 110.982 1.00 0.00 H ATOM 263 H2 WAT 7646 51.281 130.304 111.375 1.00 0.00 H TER 265 WAT 7646 ATOM 265 O WAT 7647 15.376 130.213 143.816 1.00 0.00 O ATOM 266 H1 WAT 7647 16.075 130.638 144.312 1.00 0.00 H ATOM 267 H2 WAT 7647 14.572 130.627 144.131 1.00 0.00 H TER 269 WAT 7647 ATOM 269 O WAT 7648 102.899 116.860 0.919 1.00 0.00 O ATOM 270 H1 WAT 7648 103.455 116.458 1.586 1.00 0.00 H ATOM 271 H2 WAT 7648 102.752 117.752 1.234 1.00 0.00 H TER 273 WAT 7648 ATOM 273 O WAT 7649 31.386 33.605 78.493 1.00 0.00 O ATOM 274 H1 WAT 7649 30.552 33.184 78.702 1.00 0.00 H ATOM 275 H2 WAT 7649 31.452 33.544 77.540 1.00 0.00 H TER 277 WAT 7649 ATOM 277 O WAT 7650 17.610 123.324 18.564 1.00 0.00 O ATOM 278 H1 WAT 7650 16.932 122.696 18.812 1.00 0.00 H ATOM 279 H2 WAT 7650 18.346 123.123 19.141 1.00 0.00 H TER 281 WAT 7650 ATOM 281 O WAT 7651 45.118 38.149 100.041 1.00 0.00 O ATOM 282 H1 WAT 7651 44.273 38.146 100.490 1.00 0.00 H ATOM 283 H2 WAT 7651 45.034 38.834 99.378 1.00 0.00 H TER 285 WAT 7651 ATOM 285 O WAT 7652 133.801 135.339 124.627 1.00 0.00 O ATOM 286 H1 WAT 7652 134.697 135.655 124.511 1.00 0.00 H ATOM 287 H2 WAT 7652 133.312 136.109 124.918 1.00 0.00 H TER 289 WAT 7652 ATOM 289 O WAT 7653 21.766 116.943 60.690 1.00 0.00 O ATOM 290 H1 WAT 7653 21.651 116.439 61.495 1.00 0.00 H ATOM 291 H2 WAT 7653 22.687 117.204 60.701 1.00 0.00 H TER 293 WAT 7653 ATOM 293 O WAT 7654 32.594 57.877 68.199 1.00 0.00 O ATOM 294 H1 WAT 7654 33.425 57.897 67.725 1.00 0.00 H ATOM 295 H2 WAT 7654 32.070 58.568 67.794 1.00 0.00 H TER 297 WAT 7654 ATOM 297 O WAT 7655 70.649 75.284 114.720 1.00 0.00 O ATOM 298 H1 WAT 7655 70.612 76.233 114.842 1.00 0.00 H ATOM 299 H2 WAT 7655 69.738 74.998 114.794 1.00 0.00 H TER 301 WAT 7655 ATOM 301 O WAT 7656 60.424 72.624 69.369 1.00 0.00 O ATOM 302 H1 WAT 7656 60.671 73.199 70.093 1.00 0.00 H ATOM 303 H2 WAT 7656 60.719 71.756 69.641 1.00 0.00 H TER 305 WAT 7656 ATOM 305 O WAT 7657 46.593 91.357 128.109 1.00 0.00 O ATOM 306 H1 WAT 7657 46.651 91.502 127.164 1.00 0.00 H ATOM 307 H2 WAT 7657 45.766 90.890 128.230 1.00 0.00 H TER 309 WAT 7657 ATOM 309 O WAT 7658 41.577 118.511 6.807 1.00 0.00 O ATOM 310 H1 WAT 7658 41.621 119.175 6.119 1.00 0.00 H ATOM 311 H2 WAT 7658 41.115 118.940 7.526 1.00 0.00 H TER 313 WAT 7658 ATOM 313 O WAT 7659 43.694 16.006 101.849 1.00 0.00 O ATOM 314 H1 WAT 7659 43.435 16.135 100.937 1.00 0.00 H ATOM 315 H2 WAT 7659 42.901 16.192 102.352 1.00 0.00 H TER 317 WAT 7659 ATOM 317 O WAT 7660 95.634 89.640 142.587 1.00 0.00 O ATOM 318 H1 WAT 7660 95.376 89.756 141.672 1.00 0.00 H ATOM 319 H2 WAT 7660 96.002 90.486 142.841 1.00 0.00 H TER 321 WAT 7660 ATOM 321 O WAT 7661 33.559 136.726 118.673 1.00 0.00 O ATOM 322 H1 WAT 7661 33.031 137.284 118.102 1.00 0.00 H ATOM 323 H2 WAT 7661 34.448 137.069 118.587 1.00 0.00 H TER 325 WAT 7661 ATOM 325 O WAT 7662 139.216 100.369 131.790 1.00 0.00 O ATOM 326 H1 WAT 7662 139.205 99.833 132.583 1.00 0.00 H ATOM 327 H2 WAT 7662 138.455 100.943 131.878 1.00 0.00 H TER 329 WAT 7662 ATOM 329 O WAT 7663 27.622 75.655 77.078 1.00 0.00 O ATOM 330 H1 WAT 7663 27.750 75.847 76.149 1.00 0.00 H ATOM 331 H2 WAT 7663 26.716 75.354 77.138 1.00 0.00 H TER 333 WAT 7663 ATOM 333 O WAT 7664 37.589 18.769 142.562 1.00 0.00 O ATOM 334 H1 WAT 7664 37.222 19.223 143.320 1.00 0.00 H ATOM 335 H2 WAT 7664 37.024 18.006 142.443 1.00 0.00 H TER 337 WAT 7664 ATOM 337 O WAT 7665 17.357 45.851 66.093 1.00 0.00 O ATOM 338 H1 WAT 7665 17.617 45.888 67.014 1.00 0.00 H ATOM 339 H2 WAT 7665 18.055 46.311 65.628 1.00 0.00 H TER 341 WAT 7665 ATOM 341 O WAT 7666 121.998 113.925 131.680 1.00 0.00 O ATOM 342 H1 WAT 7666 122.779 113.781 131.146 1.00 0.00 H ATOM 343 H2 WAT 7666 121.813 113.070 132.069 1.00 0.00 H TER 345 WAT 7666 ATOM 345 O WAT 7667 139.178 124.983 109.680 1.00 0.00 O ATOM 346 H1 WAT 7667 138.227 124.886 109.728 1.00 0.00 H ATOM 347 H2 WAT 7667 139.521 124.141 109.980 1.00 0.00 H TER 349 WAT 7667 ATOM 349 O WAT 7668 46.447 59.273 150.555 1.00 0.00 O ATOM 350 H1 WAT 7668 46.208 58.552 149.972 1.00 0.00 H ATOM 351 H2 WAT 7668 45.868 59.991 150.298 1.00 0.00 H TER 353 WAT 7668 ATOM 353 O WAT 7669 60.903 143.876 8.821 1.00 0.00 O ATOM 354 H1 WAT 7669 60.393 143.350 9.437 1.00 0.00 H ATOM 355 H2 WAT 7669 60.246 144.303 8.270 1.00 0.00 H TER 357 WAT 7669 ATOM 357 O WAT 7670 71.679 26.599 60.773 1.00 0.00 O ATOM 358 H1 WAT 7670 71.878 27.118 61.552 1.00 0.00 H ATOM 359 H2 WAT 7670 71.572 27.246 60.075 1.00 0.00 H TER 361 WAT 7670 ATOM 361 O WAT 7671 121.336 98.350 17.357 1.00 0.00 O ATOM 362 H1 WAT 7671 121.663 98.591 18.225 1.00 0.00 H ATOM 363 H2 WAT 7671 120.526 97.871 17.531 1.00 0.00 H TER 365 WAT 7671 ATOM 365 O WAT 7672 7.309 95.584 77.254 1.00 0.00 O ATOM 366 H1 WAT 7672 6.888 95.075 76.561 1.00 0.00 H ATOM 367 H2 WAT 7672 6.996 96.478 77.118 1.00 0.00 H TER 369 WAT 7672 ATOM 369 O WAT 7673 104.272 84.634 115.399 1.00 0.00 O ATOM 370 H1 WAT 7673 104.979 84.018 115.588 1.00 0.00 H ATOM 371 H2 WAT 7673 104.068 85.032 116.245 1.00 0.00 H TER 373 WAT 7673 ATOM 373 O WAT 7674 26.206 74.329 100.984 1.00 0.00 O ATOM 374 H1 WAT 7674 25.879 75.214 101.143 1.00 0.00 H ATOM 375 H2 WAT 7674 25.564 73.939 100.390 1.00 0.00 H TER 377 WAT 7674 ATOM 377 O WAT 7675 27.454 56.823 141.505 1.00 0.00 O ATOM 378 H1 WAT 7675 27.906 56.688 140.672 1.00 0.00 H ATOM 379 H2 WAT 7675 27.596 57.747 141.708 1.00 0.00 H TER 381 WAT 7675 ATOM 381 O WAT 7676 80.712 39.296 95.736 1.00 0.00 O ATOM 382 H1 WAT 7676 80.263 40.118 95.541 1.00 0.00 H ATOM 383 H2 WAT 7676 81.588 39.562 96.017 1.00 0.00 H TER 385 WAT 7676 ATOM 385 O WAT 7677 60.449 123.596 119.279 1.00 0.00 O ATOM 386 H1 WAT 7677 60.517 123.036 118.505 1.00 0.00 H ATOM 387 H2 WAT 7677 60.630 124.478 118.952 1.00 0.00 H TER 389 WAT 7677 ATOM 389 O WAT 7678 0.487 93.578 65.228 1.00 0.00 O ATOM 390 H1 WAT 7678 0.701 93.727 64.307 1.00 0.00 H ATOM 391 H2 WAT 7678 -0.167 94.246 65.433 1.00 0.00 H TER 393 WAT 7678 ATOM 393 O WAT 7679 50.566 1.042 140.312 1.00 0.00 O ATOM 394 H1 WAT 7679 51.401 1.502 140.397 1.00 0.00 H ATOM 395 H2 WAT 7679 50.679 0.479 139.546 1.00 0.00 H TER 397 WAT 7679 ATOM 397 O WAT 7680 125.961 123.231 122.911 1.00 0.00 O ATOM 398 H1 WAT 7680 125.411 122.754 123.533 1.00 0.00 H ATOM 399 H2 WAT 7680 125.840 124.152 123.140 1.00 0.00 H TER 401 WAT 7680 ATOM 401 O WAT 7681 57.605 90.417 120.333 1.00 0.00 O ATOM 402 H1 WAT 7681 57.922 90.100 121.178 1.00 0.00 H ATOM 403 H2 WAT 7681 57.056 89.707 120.001 1.00 0.00 H TER 405 WAT 7681 ATOM 405 O WAT 7682 95.507 34.326 54.562 1.00 0.00 O ATOM 406 H1 WAT 7682 95.723 33.907 53.728 1.00 0.00 H ATOM 407 H2 WAT 7682 95.417 33.600 55.179 1.00 0.00 H TER 409 WAT 7682 ATOM 409 O WAT 7683 51.419 88.275 15.795 1.00 0.00 O ATOM 410 H1 WAT 7683 52.015 89.014 15.668 1.00 0.00 H ATOM 411 H2 WAT 7683 51.138 88.348 16.707 1.00 0.00 H TER 413 WAT 7683 ATOM 413 O WAT 7684 73.032 132.318 91.058 1.00 0.00 O ATOM 414 H1 WAT 7684 72.944 132.118 90.126 1.00 0.00 H ATOM 415 H2 WAT 7684 72.141 132.252 91.402 1.00 0.00 H TER 417 WAT 7684 ATOM 417 O WAT 7685 134.273 96.054 117.698 1.00 0.00 O ATOM 418 H1 WAT 7685 133.904 96.038 116.815 1.00 0.00 H ATOM 419 H2 WAT 7685 134.102 95.178 118.045 1.00 0.00 H TER 421 WAT 7685 ATOM 421 O WAT 7686 39.365 20.272 67.202 1.00 0.00 O ATOM 422 H1 WAT 7686 39.247 19.788 66.385 1.00 0.00 H ATOM 423 H2 WAT 7686 39.663 19.613 67.830 1.00 0.00 H TER 425 WAT 7686 ATOM 425 O WAT 7687 30.534 60.578 15.681 1.00 0.00 O ATOM 426 H1 WAT 7687 30.437 61.289 16.315 1.00 0.00 H ATOM 427 H2 WAT 7687 31.346 60.140 15.934 1.00 0.00 H TER 429 WAT 7687 ATOM 429 O WAT 7688 128.900 20.692 127.184 1.00 0.00 O ATOM 430 H1 WAT 7688 129.329 20.260 126.446 1.00 0.00 H ATOM 431 H2 WAT 7688 128.327 21.343 126.780 1.00 0.00 H TER 433 WAT 7688 ATOM 433 O WAT 7689 1.454 128.995 137.531 1.00 0.00 O ATOM 434 H1 WAT 7689 1.947 129.368 138.263 1.00 0.00 H ATOM 435 H2 WAT 7689 1.106 128.172 137.873 1.00 0.00 H TER 437 WAT 7689 ATOM 437 O WAT 7690 126.718 81.617 76.392 1.00 0.00 O ATOM 438 H1 WAT 7690 126.546 82.540 76.210 1.00 0.00 H ATOM 439 H2 WAT 7690 127.334 81.628 77.125 1.00 0.00 H TER 441 WAT 7690 ATOM 441 O WAT 7691 22.316 22.858 17.084 1.00 0.00 O ATOM 442 H1 WAT 7691 21.933 23.399 16.394 1.00 0.00 H ATOM 443 H2 WAT 7691 23.120 23.314 17.329 1.00 0.00 H TER 445 WAT 7691 ATOM 445 O WAT 7692 18.224 105.224 9.535 1.00 0.00 O ATOM 446 H1 WAT 7692 18.313 104.482 10.133 1.00 0.00 H ATOM 447 H2 WAT 7692 17.971 104.830 8.700 1.00 0.00 H TER 449 WAT 7692 ATOM 449 O WAT 7693 55.419 117.533 157.039 1.00 0.00 O ATOM 450 H1 WAT 7693 54.630 117.866 156.610 1.00 0.00 H ATOM 451 H2 WAT 7693 55.227 116.612 157.213 1.00 0.00 H TER 453 WAT 7693 ATOM 453 O WAT 7694 25.452 145.088 148.397 1.00 0.00 O ATOM 454 H1 WAT 7694 25.402 144.657 149.250 1.00 0.00 H ATOM 455 H2 WAT 7694 25.368 144.376 147.763 1.00 0.00 H TER 457 WAT 7694 ATOM 457 O WAT 7695 45.780 142.623 64.609 1.00 0.00 O ATOM 458 H1 WAT 7695 44.854 142.772 64.796 1.00 0.00 H ATOM 459 H2 WAT 7695 45.883 141.672 64.650 1.00 0.00 H TER 461 WAT 7695 ATOM 461 O WAT 7696 14.743 127.362 113.546 1.00 0.00 O ATOM 462 H1 WAT 7696 15.661 127.628 113.609 1.00 0.00 H ATOM 463 H2 WAT 7696 14.251 128.135 113.821 1.00 0.00 H TER 465 WAT 7696 ATOM 465 O WAT 7697 122.267 57.223 101.595 1.00 0.00 O ATOM 466 H1 WAT 7697 122.507 58.145 101.508 1.00 0.00 H ATOM 467 H2 WAT 7697 122.449 56.846 100.734 1.00 0.00 H TER 469 WAT 7697 ATOM 469 O WAT 7698 50.760 18.204 66.458 1.00 0.00 O ATOM 470 H1 WAT 7698 50.610 18.325 67.395 1.00 0.00 H ATOM 471 H2 WAT 7698 51.712 18.215 66.363 1.00 0.00 H TER 473 WAT 7698 ATOM 473 O WAT 7699 42.186 123.503 62.868 1.00 0.00 O ATOM 474 H1 WAT 7699 41.332 123.599 62.446 1.00 0.00 H ATOM 475 H2 WAT 7699 42.325 124.336 63.318 1.00 0.00 H TER 477 WAT 7699 ATOM 477 O WAT 7700 115.982 117.913 62.293 1.00 0.00 O ATOM 478 H1 WAT 7700 115.488 117.182 62.664 1.00 0.00 H ATOM 479 H2 WAT 7700 115.445 118.683 62.477 1.00 0.00 H TER 481 WAT 7700 ATOM 481 O WAT 7701 84.244 143.012 77.574 1.00 0.00 O ATOM 482 H1 WAT 7701 83.403 142.589 77.750 1.00 0.00 H ATOM 483 H2 WAT 7701 84.015 143.906 77.322 1.00 0.00 H TER 485 WAT 7701 ATOM 485 O WAT 7702 22.558 86.168 99.961 1.00 0.00 O ATOM 486 H1 WAT 7702 22.696 85.232 100.102 1.00 0.00 H ATOM 487 H2 WAT 7702 22.655 86.285 99.016 1.00 0.00 H TER 489 WAT 7702 ATOM 489 O WAT 7703 27.999 52.110 16.591 1.00 0.00 O ATOM 490 H1 WAT 7703 28.595 52.838 16.761 1.00 0.00 H ATOM 491 H2 WAT 7703 28.505 51.329 16.814 1.00 0.00 H TER 493 WAT 7703 ATOM 493 O WAT 7704 112.602 58.390 89.216 1.00 0.00 O ATOM 494 H1 WAT 7704 112.617 59.135 88.615 1.00 0.00 H ATOM 495 H2 WAT 7704 112.513 58.784 90.084 1.00 0.00 H TER 497 WAT 7704 ATOM 497 O WAT 7705 48.406 114.801 106.532 1.00 0.00 O ATOM 498 H1 WAT 7705 48.437 113.938 106.945 1.00 0.00 H ATOM 499 H2 WAT 7705 49.304 115.128 106.593 1.00 0.00 H TER 501 WAT 7705 ATOM 501 O WAT 7706 85.409 15.563 132.674 1.00 0.00 O ATOM 502 H1 WAT 7706 84.695 15.313 132.088 1.00 0.00 H ATOM 503 H2 WAT 7706 85.470 16.514 132.586 1.00 0.00 H TER 505 WAT 7706 ATOM 505 O WAT 7707 125.634 86.863 91.088 1.00 0.00 O ATOM 506 H1 WAT 7707 126.460 87.113 90.673 1.00 0.00 H ATOM 507 H2 WAT 7707 125.214 87.695 91.306 1.00 0.00 H TER 509 WAT 7707 ATOM 509 O WAT 7708 14.782 75.461 134.183 1.00 0.00 O ATOM 510 H1 WAT 7708 15.235 75.714 134.988 1.00 0.00 H ATOM 511 H2 WAT 7708 15.358 75.761 133.480 1.00 0.00 H TER 513 WAT 7708 ATOM 513 O WAT 7709 24.410 54.124 123.338 1.00 0.00 O ATOM 514 H1 WAT 7709 23.874 53.948 122.564 1.00 0.00 H ATOM 515 H2 WAT 7709 25.295 53.869 123.079 1.00 0.00 H TER 517 WAT 7709 ATOM 517 O WAT 7710 88.806 39.220 78.157 1.00 0.00 O ATOM 518 H1 WAT 7710 89.653 39.629 78.336 1.00 0.00 H ATOM 519 H2 WAT 7710 88.436 39.738 77.442 1.00 0.00 H TER 521 WAT 7710 ATOM 521 O WAT 7711 21.996 88.680 18.027 1.00 0.00 O ATOM 522 H1 WAT 7711 22.656 87.987 18.044 1.00 0.00 H ATOM 523 H2 WAT 7711 22.405 89.390 17.533 1.00 0.00 H TER 525 WAT 7711 ATOM 525 O WAT 7712 18.048 40.326 150.739 1.00 0.00 O ATOM 526 H1 WAT 7712 17.346 40.294 150.089 1.00 0.00 H ATOM 527 H2 WAT 7712 18.270 41.255 150.807 1.00 0.00 H TER 529 WAT 7712 ATOM 529 O WAT 7713 113.455 15.282 88.538 1.00 0.00 O ATOM 530 H1 WAT 7713 113.636 14.364 88.337 1.00 0.00 H ATOM 531 H2 WAT 7713 112.533 15.294 88.794 1.00 0.00 H TER 533 WAT 7713 ATOM 533 O WAT 7714 59.410 133.927 16.149 1.00 0.00 O ATOM 534 H1 WAT 7714 59.083 134.331 16.953 1.00 0.00 H ATOM 535 H2 WAT 7714 60.110 133.343 16.442 1.00 0.00 H TER 537 WAT 7714 ATOM 537 O WAT 7715 124.759 33.992 135.804 1.00 0.00 O ATOM 538 H1 WAT 7715 124.451 33.095 135.672 1.00 0.00 H ATOM 539 H2 WAT 7715 124.068 34.409 136.319 1.00 0.00 H TER 541 WAT 7715 ATOM 541 O WAT 7716 54.318 113.986 115.731 1.00 0.00 O ATOM 542 H1 WAT 7716 54.975 113.551 116.275 1.00 0.00 H ATOM 543 H2 WAT 7716 53.793 114.494 116.349 1.00 0.00 H TER 545 WAT 7716 ATOM 545 O WAT 7717 98.426 51.367 0.389 1.00 0.00 O ATOM 546 H1 WAT 7717 97.813 50.633 0.428 1.00 0.00 H ATOM 547 H2 WAT 7717 98.664 51.431 -0.536 1.00 0.00 H TER 549 WAT 7717 ATOM 549 O WAT 7718 78.937 60.509 151.264 1.00 0.00 O ATOM 550 H1 WAT 7718 78.427 60.416 150.459 1.00 0.00 H ATOM 551 H2 WAT 7718 79.750 60.929 150.984 1.00 0.00 H TER 553 WAT 7718 ATOM 553 O WAT 7719 125.280 50.025 71.186 1.00 0.00 O ATOM 554 H1 WAT 7719 124.499 49.477 71.260 1.00 0.00 H ATOM 555 H2 WAT 7719 125.137 50.732 71.815 1.00 0.00 H TER 557 WAT 7719 ATOM 557 O WAT 7720 120.814 140.022 69.659 1.00 0.00 O ATOM 558 H1 WAT 7720 121.752 139.879 69.787 1.00 0.00 H ATOM 559 H2 WAT 7720 120.765 140.778 69.075 1.00 0.00 H TER 561 WAT 7720 ATOM 561 O WAT 7721 75.150 3.046 69.855 1.00 0.00 O ATOM 562 H1 WAT 7721 74.403 3.320 69.324 1.00 0.00 H ATOM 563 H2 WAT 7721 74.761 2.716 70.665 1.00 0.00 H TER 565 WAT 7721 ATOM 565 O WAT 7722 67.779 127.841 125.348 1.00 0.00 O ATOM 566 H1 WAT 7722 67.542 127.744 126.270 1.00 0.00 H ATOM 567 H2 WAT 7722 67.074 127.402 124.872 1.00 0.00 H TER 569 WAT 7722 ATOM 569 O WAT 7723 142.309 27.288 139.072 1.00 0.00 O ATOM 570 H1 WAT 7723 141.408 27.361 139.386 1.00 0.00 H ATOM 571 H2 WAT 7723 142.766 26.814 139.767 1.00 0.00 H TER 573 WAT 7723 ATOM 573 O WAT 7724 92.282 34.525 147.301 1.00 0.00 O ATOM 574 H1 WAT 7724 91.517 34.411 147.863 1.00 0.00 H ATOM 575 H2 WAT 7724 92.458 35.466 147.325 1.00 0.00 H TER 577 WAT 7724 ATOM 577 O WAT 7725 85.326 141.191 121.831 1.00 0.00 O ATOM 578 H1 WAT 7725 84.476 141.432 122.198 1.00 0.00 H ATOM 579 H2 WAT 7725 85.132 140.479 121.223 1.00 0.00 H TER 581 WAT 7725 ATOM 581 O WAT 7726 68.894 41.492 116.810 1.00 0.00 O ATOM 582 H1 WAT 7726 68.962 40.816 116.136 1.00 0.00 H ATOM 583 H2 WAT 7726 69.497 42.178 116.523 1.00 0.00 H TER 585 WAT 7726 ATOM 585 O WAT 7727 66.667 144.703 151.421 1.00 0.00 O ATOM 586 H1 WAT 7727 66.983 144.321 152.240 1.00 0.00 H ATOM 587 H2 WAT 7727 67.122 145.542 151.357 1.00 0.00 H TER 589 WAT 7727 ATOM 589 O WAT 7728 140.122 21.470 81.087 1.00 0.00 O ATOM 590 H1 WAT 7728 139.791 22.311 81.403 1.00 0.00 H ATOM 591 H2 WAT 7728 141.070 21.527 81.202 1.00 0.00 H TER 593 WAT 7728 ATOM 593 O WAT 7729 24.176 99.254 65.610 1.00 0.00 O ATOM 594 H1 WAT 7729 23.293 99.596 65.471 1.00 0.00 H ATOM 595 H2 WAT 7729 24.275 98.570 64.948 1.00 0.00 H TER 597 WAT 7729 ATOM 597 O WAT 7730 76.508 41.816 64.828 1.00 0.00 O ATOM 598 H1 WAT 7730 77.031 42.145 64.097 1.00 0.00 H ATOM 599 H2 WAT 7730 76.113 42.599 65.211 1.00 0.00 H TER 601 WAT 7730 ATOM 601 O WAT 7731 78.127 71.407 89.506 1.00 0.00 O ATOM 602 H1 WAT 7731 78.989 71.005 89.616 1.00 0.00 H ATOM 603 H2 WAT 7731 78.014 71.948 90.287 1.00 0.00 H TER 605 WAT 7731 ATOM 605 O WAT 7732 22.556 24.625 6.105 1.00 0.00 O ATOM 606 H1 WAT 7732 22.467 24.368 7.023 1.00 0.00 H ATOM 607 H2 WAT 7732 22.204 25.515 6.070 1.00 0.00 H TER 609 WAT 7732 ATOM 609 O WAT 7733 136.749 26.792 136.457 1.00 0.00 O ATOM 610 H1 WAT 7733 136.123 26.078 136.577 1.00 0.00 H ATOM 611 H2 WAT 7733 137.267 26.532 135.695 1.00 0.00 H TER 613 WAT 7733 ATOM 613 O WAT 7734 114.878 66.608 108.821 1.00 0.00 O ATOM 614 H1 WAT 7734 113.948 66.823 108.743 1.00 0.00 H ATOM 615 H2 WAT 7734 115.272 67.389 109.210 1.00 0.00 H TER 617 WAT 7734 ATOM 617 O WAT 7735 28.376 56.364 138.426 1.00 0.00 O ATOM 618 H1 WAT 7735 28.512 57.104 137.834 1.00 0.00 H ATOM 619 H2 WAT 7735 27.457 56.125 138.303 1.00 0.00 H TER 621 WAT 7735 ATOM 621 O WAT 7736 46.071 77.414 77.721 1.00 0.00 O ATOM 622 H1 WAT 7736 45.159 77.121 77.710 1.00 0.00 H ATOM 623 H2 WAT 7736 46.074 78.166 78.313 1.00 0.00 H TER 625 WAT 7736 ATOM 625 O WAT 7737 43.993 68.296 88.194 1.00 0.00 O ATOM 626 H1 WAT 7737 43.873 69.027 87.588 1.00 0.00 H ATOM 627 H2 WAT 7737 44.804 67.876 87.906 1.00 0.00 H TER 629 WAT 7737 ATOM 629 O WAT 7738 79.618 1.849 105.107 1.00 0.00 O ATOM 630 H1 WAT 7738 80.442 1.560 105.500 1.00 0.00 H ATOM 631 H2 WAT 7738 79.245 2.451 105.750 1.00 0.00 H TER 633 WAT 7738 ATOM 633 O WAT 7739 59.853 113.817 100.362 1.00 0.00 O ATOM 634 H1 WAT 7739 58.996 113.653 99.967 1.00 0.00 H ATOM 635 H2 WAT 7739 60.351 113.017 100.194 1.00 0.00 H TER 637 WAT 7739 ATOM 637 O WAT 7740 1.987 101.508 150.632 1.00 0.00 O ATOM 638 H1 WAT 7740 1.060 101.635 150.432 1.00 0.00 H ATOM 639 H2 WAT 7740 2.358 101.140 149.830 1.00 0.00 H TER 641 WAT 7740 ATOM 641 O WAT 7741 106.816 71.392 110.624 1.00 0.00 O ATOM 642 H1 WAT 7741 106.692 71.086 111.523 1.00 0.00 H ATOM 643 H2 WAT 7741 107.697 71.764 110.618 1.00 0.00 H TER 645 WAT 7741 ATOM 645 O WAT 7742 107.981 120.636 139.737 1.00 0.00 O ATOM 646 H1 WAT 7742 107.222 120.440 139.188 1.00 0.00 H ATOM 647 H2 WAT 7742 107.705 120.399 140.622 1.00 0.00 H TER 649 WAT 7742 ATOM 649 O WAT 7743 116.131 0.491 113.157 1.00 0.00 O ATOM 650 H1 WAT 7743 115.740 0.364 114.021 1.00 0.00 H ATOM 651 H2 WAT 7743 116.578 1.336 113.219 1.00 0.00 H TER 653 WAT 7743 ATOM 653 O WAT 7744 125.914 139.423 155.231 1.00 0.00 O ATOM 654 H1 WAT 7744 125.009 139.646 155.012 1.00 0.00 H ATOM 655 H2 WAT 7744 126.428 139.758 154.496 1.00 0.00 H TER 657 WAT 7744 ATOM 657 O WAT 7745 93.290 129.925 4.656 1.00 0.00 O ATOM 658 H1 WAT 7745 92.440 129.489 4.697 1.00 0.00 H ATOM 659 H2 WAT 7745 93.729 129.670 5.468 1.00 0.00 H TER 661 WAT 7745 ATOM 661 O WAT 7746 39.378 131.522 115.704 1.00 0.00 O ATOM 662 H1 WAT 7746 39.876 132.185 115.225 1.00 0.00 H ATOM 663 H2 WAT 7746 39.994 131.181 116.352 1.00 0.00 H TER 665 WAT 7746 ATOM 665 O WAT 7747 66.857 96.449 69.176 1.00 0.00 O ATOM 666 H1 WAT 7747 67.407 97.209 68.987 1.00 0.00 H ATOM 667 H2 WAT 7747 65.964 96.753 69.009 1.00 0.00 H TER 669 WAT 7747 ATOM 669 O WAT 7748 2.031 46.642 81.916 1.00 0.00 O ATOM 670 H1 WAT 7748 1.952 47.549 81.622 1.00 0.00 H ATOM 671 H2 WAT 7748 1.676 46.647 82.805 1.00 0.00 H TER 673 WAT 7748 ATOM 673 O WAT 7749 54.378 91.088 19.905 1.00 0.00 O ATOM 674 H1 WAT 7749 54.295 91.786 19.256 1.00 0.00 H ATOM 675 H2 WAT 7749 55.312 91.064 20.113 1.00 0.00 H TER 677 WAT 7749 ATOM 677 O WAT 7750 8.922 33.480 77.502 1.00 0.00 O ATOM 678 H1 WAT 7750 9.087 33.452 78.445 1.00 0.00 H ATOM 679 H2 WAT 7750 9.543 34.129 77.170 1.00 0.00 H TER 681 WAT 7750 ATOM 681 O WAT 7751 9.204 8.138 11.745 1.00 0.00 O ATOM 682 H1 WAT 7751 9.909 8.602 11.294 1.00 0.00 H ATOM 683 H2 WAT 7751 9.551 7.968 12.621 1.00 0.00 H TER 685 WAT 7751 ATOM 685 O WAT 7752 109.098 101.565 103.055 1.00 0.00 O ATOM 686 H1 WAT 7752 109.165 100.658 102.757 1.00 0.00 H ATOM 687 H2 WAT 7752 109.827 101.670 103.667 1.00 0.00 H TER 689 WAT 7752 ATOM 689 O WAT 7753 85.749 68.259 79.367 1.00 0.00 O ATOM 690 H1 WAT 7753 85.844 68.047 80.296 1.00 0.00 H ATOM 691 H2 WAT 7753 86.430 68.911 79.200 1.00 0.00 H TER 693 WAT 7753 ATOM 693 O WAT 7754 103.605 135.361 100.905 1.00 0.00 O ATOM 694 H1 WAT 7754 102.775 135.089 101.297 1.00 0.00 H ATOM 695 H2 WAT 7754 104.141 134.567 100.907 1.00 0.00 H TER 697 WAT 7754 ATOM 697 O WAT 7755 89.148 81.559 136.368 1.00 0.00 O ATOM 698 H1 WAT 7755 88.551 80.870 136.079 1.00 0.00 H ATOM 699 H2 WAT 7755 88.925 82.314 135.822 1.00 0.00 H TER 701 WAT 7755 ATOM 701 O WAT 7756 84.983 137.635 65.544 1.00 0.00 O ATOM 702 H1 WAT 7756 84.067 137.365 65.490 1.00 0.00 H ATOM 703 H2 WAT 7756 85.249 137.764 64.634 1.00 0.00 H TER 705 WAT 7756 ATOM 705 O WAT 7757 9.359 62.061 135.461 1.00 0.00 O ATOM 706 H1 WAT 7757 8.785 61.457 134.989 1.00 0.00 H ATOM 707 H2 WAT 7757 9.410 62.833 134.897 1.00 0.00 H TER 709 WAT 7757 ATOM 709 O WAT 7758 136.013 85.740 86.292 1.00 0.00 O ATOM 710 H1 WAT 7758 136.664 86.102 85.691 1.00 0.00 H ATOM 711 H2 WAT 7758 135.691 86.498 86.781 1.00 0.00 H TER 713 WAT 7758 ATOM 713 O WAT 7759 66.778 78.007 135.139 1.00 0.00 O ATOM 714 H1 WAT 7759 66.705 77.128 135.512 1.00 0.00 H ATOM 715 H2 WAT 7759 66.292 78.566 135.746 1.00 0.00 H TER 717 WAT 7759 ATOM 717 O WAT 7760 118.257 112.438 77.241 1.00 0.00 O ATOM 718 H1 WAT 7760 119.059 112.745 77.664 1.00 0.00 H ATOM 719 H2 WAT 7760 117.729 112.084 77.957 1.00 0.00 H TER 721 WAT 7760 ATOM 721 O WAT 7761 64.576 30.489 143.442 1.00 0.00 O ATOM 722 H1 WAT 7761 64.099 30.976 142.771 1.00 0.00 H ATOM 723 H2 WAT 7761 65.290 31.072 143.700 1.00 0.00 H TER 725 WAT 7761 ATOM 725 O WAT 7762 111.170 108.698 24.351 1.00 0.00 O ATOM 726 H1 WAT 7762 110.865 109.603 24.292 1.00 0.00 H ATOM 727 H2 WAT 7762 110.397 108.201 24.621 1.00 0.00 H TER 729 WAT 7762 ATOM 729 O WAT 7763 57.247 115.128 104.900 1.00 0.00 O ATOM 730 H1 WAT 7763 57.796 114.795 104.191 1.00 0.00 H ATOM 731 H2 WAT 7763 56.386 115.247 104.500 1.00 0.00 H TER 733 WAT 7763 ATOM 733 O WAT 7764 113.074 135.950 119.311 1.00 0.00 O ATOM 734 H1 WAT 7764 113.240 135.212 119.896 1.00 0.00 H ATOM 735 H2 WAT 7764 112.122 136.050 119.315 1.00 0.00 H TER 737 WAT 7764 ATOM 737 O WAT 7765 75.997 110.733 78.267 1.00 0.00 O ATOM 738 H1 WAT 7765 75.056 110.562 78.297 1.00 0.00 H ATOM 739 H2 WAT 7765 76.151 111.075 77.386 1.00 0.00 H TER 741 WAT 7765 ATOM 741 O WAT 7766 23.774 59.663 85.449 1.00 0.00 O ATOM 742 H1 WAT 7766 24.418 59.549 84.750 1.00 0.00 H ATOM 743 H2 WAT 7766 24.171 59.240 86.211 1.00 0.00 H TER 745 WAT 7766 ATOM 745 O WAT 7767 32.703 116.719 71.697 1.00 0.00 O ATOM 746 H1 WAT 7767 33.562 116.556 72.086 1.00 0.00 H ATOM 747 H2 WAT 7767 32.125 116.868 72.446 1.00 0.00 H TER 749 WAT 7767 ATOM 749 O WAT 7768 15.786 78.365 126.482 1.00 0.00 O ATOM 750 H1 WAT 7768 16.112 77.814 127.193 1.00 0.00 H ATOM 751 H2 WAT 7768 14.835 78.356 126.589 1.00 0.00 H TER 753 WAT 7768 ATOM 753 O WAT 7769 36.471 84.483 7.175 1.00 0.00 O ATOM 754 H1 WAT 7769 37.155 84.178 7.772 1.00 0.00 H ATOM 755 H2 WAT 7769 36.813 85.303 6.818 1.00 0.00 H TER 757 WAT 7769 ATOM 757 O WAT 7770 28.717 105.305 72.715 1.00 0.00 O ATOM 758 H1 WAT 7770 28.310 105.956 73.286 1.00 0.00 H ATOM 759 H2 WAT 7770 29.155 105.820 72.038 1.00 0.00 H TER 761 WAT 7770 ATOM 761 O WAT 7771 33.572 44.755 136.348 1.00 0.00 O ATOM 762 H1 WAT 7771 33.273 44.331 137.152 1.00 0.00 H ATOM 763 H2 WAT 7771 34.317 44.226 136.061 1.00 0.00 H TER 765 WAT 7771 ATOM 765 O WAT 7772 46.798 15.944 97.465 1.00 0.00 O ATOM 766 H1 WAT 7772 47.647 15.886 97.027 1.00 0.00 H ATOM 767 H2 WAT 7772 46.855 16.739 97.995 1.00 0.00 H TER 769 WAT 7772 ATOM 769 O WAT 7773 141.713 104.349 3.305 1.00 0.00 O ATOM 770 H1 WAT 7773 142.404 104.316 3.966 1.00 0.00 H ATOM 771 H2 WAT 7773 140.912 104.506 3.804 1.00 0.00 H TER 773 WAT 7773 ATOM 773 O WAT 7774 110.642 69.709 5.813 1.00 0.00 O ATOM 774 H1 WAT 7774 110.827 70.242 6.586 1.00 0.00 H ATOM 775 H2 WAT 7774 110.902 70.259 5.075 1.00 0.00 H TER 777 WAT 7774 ATOM 777 O WAT 7775 93.298 87.234 117.112 1.00 0.00 O ATOM 778 H1 WAT 7775 94.003 86.602 116.970 1.00 0.00 H ATOM 779 H2 WAT 7775 92.700 87.095 116.378 1.00 0.00 H TER 781 WAT 7775 ATOM 781 O WAT 7776 111.877 43.036 73.060 1.00 0.00 O ATOM 782 H1 WAT 7776 111.289 43.003 73.815 1.00 0.00 H ATOM 783 H2 WAT 7776 112.435 43.797 73.225 1.00 0.00 H TER 785 WAT 7776 ATOM 785 O WAT 7777 88.220 102.972 15.379 1.00 0.00 O ATOM 786 H1 WAT 7777 88.989 102.665 14.899 1.00 0.00 H ATOM 787 H2 WAT 7777 88.398 102.739 16.291 1.00 0.00 H TER 789 WAT 7777 ATOM 789 O WAT 7778 16.124 22.703 94.896 1.00 0.00 O ATOM 790 H1 WAT 7778 16.293 21.852 94.492 1.00 0.00 H ATOM 791 H2 WAT 7778 15.180 22.831 94.800 1.00 0.00 H TER 793 WAT 7778 ATOM 793 O WAT 7779 89.947 47.629 122.329 1.00 0.00 O ATOM 794 H1 WAT 7779 90.481 47.988 123.038 1.00 0.00 H ATOM 795 H2 WAT 7779 90.226 48.111 121.551 1.00 0.00 H TER 797 WAT 7779 ATOM 797 O WAT 7780 65.331 25.418 56.663 1.00 0.00 O ATOM 798 H1 WAT 7780 66.212 25.789 56.607 1.00 0.00 H ATOM 799 H2 WAT 7780 65.349 24.667 56.070 1.00 0.00 H TER 801 WAT 7780 ATOM 801 O WAT 7781 91.354 126.362 24.725 1.00 0.00 O ATOM 802 H1 WAT 7781 90.549 126.878 24.682 1.00 0.00 H ATOM 803 H2 WAT 7781 91.056 125.453 24.718 1.00 0.00 H TER 805 WAT 7781 ATOM 805 O WAT 7782 18.451 53.026 66.768 1.00 0.00 O ATOM 806 H1 WAT 7782 17.633 53.520 66.813 1.00 0.00 H ATOM 807 H2 WAT 7782 18.348 52.332 67.419 1.00 0.00 H TER 809 WAT 7782 ATOM 809 O WAT 7783 125.515 65.736 138.770 1.00 0.00 O ATOM 810 H1 WAT 7783 125.540 66.404 139.455 1.00 0.00 H ATOM 811 H2 WAT 7783 126.408 65.394 138.737 1.00 0.00 H TER 813 WAT 7783 ATOM 813 O WAT 7784 128.623 29.282 110.473 1.00 0.00 O ATOM 814 H1 WAT 7784 128.663 30.233 110.573 1.00 0.00 H ATOM 815 H2 WAT 7784 129.395 28.960 110.939 1.00 0.00 H TER 817 WAT 7784 ATOM 817 O WAT 7785 119.246 95.713 14.818 1.00 0.00 O ATOM 818 H1 WAT 7785 118.968 96.524 14.392 1.00 0.00 H ATOM 819 H2 WAT 7785 119.089 95.867 15.750 1.00 0.00 H TER 821 WAT 7785 ATOM 821 O WAT 7786 0.742 83.368 71.519 1.00 0.00 O ATOM 822 H1 WAT 7786 1.648 83.643 71.373 1.00 0.00 H ATOM 823 H2 WAT 7786 0.736 83.027 72.413 1.00 0.00 H TER 825 WAT 7786 ATOM 825 O WAT 7787 47.299 110.871 105.273 1.00 0.00 O ATOM 826 H1 WAT 7787 47.192 109.973 105.584 1.00 0.00 H ATOM 827 H2 WAT 7787 47.845 111.291 105.938 1.00 0.00 H TER 829 WAT 7787 ATOM 829 O WAT 7788 45.388 143.621 118.627 1.00 0.00 O ATOM 830 H1 WAT 7788 44.574 143.797 118.155 1.00 0.00 H ATOM 831 H2 WAT 7788 45.789 144.483 118.743 1.00 0.00 H TER 833 WAT 7788 ATOM 833 O WAT 7789 134.067 43.570 71.623 1.00 0.00 O ATOM 834 H1 WAT 7789 134.847 43.085 71.353 1.00 0.00 H ATOM 835 H2 WAT 7789 133.346 43.138 71.166 1.00 0.00 H TER 837 WAT 7789 ATOM 837 O WAT 7790 85.689 46.720 133.718 1.00 0.00 O ATOM 838 H1 WAT 7790 86.336 46.668 134.423 1.00 0.00 H ATOM 839 H2 WAT 7790 86.140 46.365 132.952 1.00 0.00 H TER 841 WAT 7790 ATOM 841 O WAT 7791 61.384 68.397 4.229 1.00 0.00 O ATOM 842 H1 WAT 7791 60.635 68.251 4.807 1.00 0.00 H ATOM 843 H2 WAT 7791 61.430 69.348 4.132 1.00 0.00 H TER 845 WAT 7791 ATOM 845 O WAT 7792 129.734 106.003 95.763 1.00 0.00 O ATOM 846 H1 WAT 7792 129.753 106.107 94.812 1.00 0.00 H ATOM 847 H2 WAT 7792 130.321 106.684 96.090 1.00 0.00 H TER 849 WAT 7792 ATOM 849 O WAT 7793 22.498 135.690 23.649 1.00 0.00 O ATOM 850 H1 WAT 7793 22.506 135.304 22.773 1.00 0.00 H ATOM 851 H2 WAT 7793 23.088 136.441 23.585 1.00 0.00 H TER 853 WAT 7793 ATOM 853 O WAT 7794 60.045 96.879 2.145 1.00 0.00 O ATOM 854 H1 WAT 7794 60.261 96.268 2.849 1.00 0.00 H ATOM 855 H2 WAT 7794 59.159 96.634 1.878 1.00 0.00 H TER 857 WAT 7794 ATOM 857 O WAT 7795 130.527 78.089 74.404 1.00 0.00 O ATOM 858 H1 WAT 7795 129.966 78.427 75.102 1.00 0.00 H ATOM 859 H2 WAT 7795 129.980 78.124 73.619 1.00 0.00 H TER 861 WAT 7795 ATOM 861 O WAT 7796 98.656 78.919 87.144 1.00 0.00 O ATOM 862 H1 WAT 7796 97.903 79.189 86.618 1.00 0.00 H ATOM 863 H2 WAT 7796 99.415 79.240 86.659 1.00 0.00 H TER 865 WAT 7796 ATOM 865 O WAT 7797 137.150 40.415 104.772 1.00 0.00 O ATOM 866 H1 WAT 7797 137.280 39.593 104.299 1.00 0.00 H ATOM 867 H2 WAT 7797 136.443 40.227 105.389 1.00 0.00 H TER 869 WAT 7797 ATOM 869 O WAT 7798 131.363 129.220 119.003 1.00 0.00 O ATOM 870 H1 WAT 7798 131.631 129.826 118.312 1.00 0.00 H ATOM 871 H2 WAT 7798 130.543 129.584 119.337 1.00 0.00 H TER 873 WAT 7798 ATOM 873 O WAT 7799 83.093 60.296 95.073 1.00 0.00 O ATOM 874 H1 WAT 7799 83.252 60.344 96.016 1.00 0.00 H ATOM 875 H2 WAT 7799 82.364 60.898 94.922 1.00 0.00 H TER 877 WAT 7799 ATOM 877 O WAT 7800 75.036 113.090 108.874 1.00 0.00 O ATOM 878 H1 WAT 7800 74.866 112.372 109.484 1.00 0.00 H ATOM 879 H2 WAT 7800 75.260 113.833 109.435 1.00 0.00 H TER 881 WAT 7800 ATOM 881 O WAT 7801 100.280 24.509 119.162 1.00 0.00 O ATOM 882 H1 WAT 7801 99.784 24.520 118.344 1.00 0.00 H ATOM 883 H2 WAT 7801 100.158 23.623 119.504 1.00 0.00 H TER 885 WAT 7801 ATOM 885 O WAT 7802 14.723 8.667 92.625 1.00 0.00 O ATOM 886 H1 WAT 7802 14.768 9.621 92.562 1.00 0.00 H ATOM 887 H2 WAT 7802 15.333 8.354 91.957 1.00 0.00 H TER 889 WAT 7802 ATOM 889 O WAT 7803 100.454 130.354 99.368 1.00 0.00 O ATOM 890 H1 WAT 7803 100.967 129.551 99.276 1.00 0.00 H ATOM 891 H2 WAT 7803 100.906 130.850 100.051 1.00 0.00 H TER 893 WAT 7803 ATOM 893 O WAT 7804 43.603 82.245 0.717 1.00 0.00 O ATOM 894 H1 WAT 7804 44.181 82.849 0.251 1.00 0.00 H ATOM 895 H2 WAT 7804 42.727 82.612 0.597 1.00 0.00 H TER 897 WAT 7804 ATOM 897 O WAT 7805 108.203 139.410 152.290 1.00 0.00 O ATOM 898 H1 WAT 7805 108.285 140.082 151.614 1.00 0.00 H ATOM 899 H2 WAT 7805 108.703 138.667 151.951 1.00 0.00 H TER 901 WAT 7805 ATOM 901 O WAT 7806 11.002 27.075 3.247 1.00 0.00 O ATOM 902 H1 WAT 7806 11.466 26.823 2.449 1.00 0.00 H ATOM 903 H2 WAT 7806 10.156 27.400 2.939 1.00 0.00 H TER 905 WAT 7806 ATOM 905 O WAT 7807 65.789 110.365 137.583 1.00 0.00 O ATOM 906 H1 WAT 7807 65.928 109.648 138.201 1.00 0.00 H ATOM 907 H2 WAT 7807 64.837 110.423 137.494 1.00 0.00 H TER 909 WAT 7807 ATOM 909 O WAT 7808 50.475 52.717 84.237 1.00 0.00 O ATOM 910 H1 WAT 7808 50.076 51.928 83.871 1.00 0.00 H ATOM 911 H2 WAT 7808 51.242 52.399 84.713 1.00 0.00 H TER 913 WAT 7808 ATOM 913 O WAT 7809 34.082 34.697 73.837 1.00 0.00 O ATOM 914 H1 WAT 7809 34.851 34.233 73.504 1.00 0.00 H ATOM 915 H2 WAT 7809 34.341 35.618 73.842 1.00 0.00 H TER 917 WAT 7809 ATOM 917 O WAT 7810 8.069 127.893 58.613 1.00 0.00 O ATOM 918 H1 WAT 7810 8.927 127.926 59.037 1.00 0.00 H ATOM 919 H2 WAT 7810 7.645 127.122 58.989 1.00 0.00 H TER 921 WAT 7810 ATOM 921 O WAT 7811 24.627 12.734 154.401 1.00 0.00 O ATOM 922 H1 WAT 7811 25.172 12.054 154.006 1.00 0.00 H ATOM 923 H2 WAT 7811 24.338 13.269 153.662 1.00 0.00 H TER 925 WAT 7811 ATOM 925 O WAT 7812 84.587 37.040 104.853 1.00 0.00 O ATOM 926 H1 WAT 7812 85.005 36.180 104.898 1.00 0.00 H ATOM 927 H2 WAT 7812 83.860 36.985 105.474 1.00 0.00 H TER 929 WAT 7812 ATOM 929 O WAT 7813 108.962 65.654 95.801 1.00 0.00 O ATOM 930 H1 WAT 7813 108.226 66.120 96.196 1.00 0.00 H ATOM 931 H2 WAT 7813 109.073 66.065 94.943 1.00 0.00 H TER 933 WAT 7813 ATOM 933 O WAT 7814 60.958 1.721 0.135 1.00 0.00 O ATOM 934 H1 WAT 7814 60.050 1.955 -0.057 1.00 0.00 H ATOM 935 H2 WAT 7814 61.024 0.798 -0.109 1.00 0.00 H TER 937 WAT 7814 ATOM 937 O WAT 7815 142.155 22.288 20.645 1.00 0.00 O ATOM 938 H1 WAT 7815 143.054 22.607 20.713 1.00 0.00 H ATOM 939 H2 WAT 7815 142.213 21.357 20.863 1.00 0.00 H TER 941 WAT 7815 ATOM 941 O WAT 7816 128.405 70.870 157.316 1.00 0.00 O ATOM 942 H1 WAT 7816 128.846 71.634 156.945 1.00 0.00 H ATOM 943 H2 WAT 7816 129.107 70.235 157.460 1.00 0.00 H TER 945 WAT 7816 ATOM 945 O WAT 7817 55.921 87.034 154.882 1.00 0.00 O ATOM 946 H1 WAT 7817 56.070 86.127 155.150 1.00 0.00 H ATOM 947 H2 WAT 7817 56.741 87.482 155.089 1.00 0.00 H TER 949 WAT 7817 ATOM 949 O WAT 7818 130.344 123.493 66.427 1.00 0.00 O ATOM 950 H1 WAT 7818 130.633 124.312 66.830 1.00 0.00 H ATOM 951 H2 WAT 7818 129.954 122.996 67.146 1.00 0.00 H TER 953 WAT 7818 ATOM 953 O WAT 7819 16.041 40.537 67.754 1.00 0.00 O ATOM 954 H1 WAT 7819 15.584 41.207 68.262 1.00 0.00 H ATOM 955 H2 WAT 7819 16.212 39.836 68.382 1.00 0.00 H TER 957 WAT 7819 ATOM 957 O WAT 7820 16.392 40.412 55.583 1.00 0.00 O ATOM 958 H1 WAT 7820 15.853 41.117 55.942 1.00 0.00 H ATOM 959 H2 WAT 7820 15.807 39.655 55.552 1.00 0.00 H TER 961 WAT 7820 ATOM 961 O WAT 7821 94.293 123.069 109.826 1.00 0.00 O ATOM 962 H1 WAT 7821 95.006 123.707 109.865 1.00 0.00 H ATOM 963 H2 WAT 7821 94.493 122.444 110.523 1.00 0.00 H TER 965 WAT 7821 ATOM 965 O WAT 7822 34.600 20.646 147.939 1.00 0.00 O ATOM 966 H1 WAT 7822 34.960 21.467 147.604 1.00 0.00 H ATOM 967 H2 WAT 7822 33.889 20.432 147.335 1.00 0.00 H TER 969 WAT 7822 ATOM 969 O WAT 7823 104.406 5.290 91.459 1.00 0.00 O ATOM 970 H1 WAT 7823 105.275 5.160 91.079 1.00 0.00 H ATOM 971 H2 WAT 7823 104.391 4.716 92.225 1.00 0.00 H TER 973 WAT 7823 ATOM 973 O WAT 7824 58.470 13.978 152.121 1.00 0.00 O ATOM 974 H1 WAT 7824 58.174 14.686 151.549 1.00 0.00 H ATOM 975 H2 WAT 7824 58.753 13.288 151.521 1.00 0.00 H TER 977 WAT 7824 ATOM 977 O WAT 7825 51.023 118.223 83.698 1.00 0.00 O ATOM 978 H1 WAT 7825 51.928 118.053 83.956 1.00 0.00 H ATOM 979 H2 WAT 7825 50.986 119.170 83.561 1.00 0.00 H TER 981 WAT 7825 ATOM 981 O WAT 7826 40.250 85.663 103.531 1.00 0.00 O ATOM 982 H1 WAT 7826 39.538 85.597 102.895 1.00 0.00 H ATOM 983 H2 WAT 7826 39.980 85.095 104.253 1.00 0.00 H TER 985 WAT 7826 ATOM 985 O WAT 7827 97.684 101.751 156.739 1.00 0.00 O ATOM 986 H1 WAT 7827 97.877 101.052 156.115 1.00 0.00 H ATOM 987 H2 WAT 7827 97.474 101.294 157.553 1.00 0.00 H TER 989 WAT 7827 ATOM 989 O WAT 7828 99.607 74.941 72.072 1.00 0.00 O ATOM 990 H1 WAT 7828 98.729 75.317 72.147 1.00 0.00 H ATOM 991 H2 WAT 7828 99.526 74.066 72.452 1.00 0.00 H TER 993 WAT 7828 ATOM 993 O WAT 7829 88.176 7.471 140.452 1.00 0.00 O ATOM 994 H1 WAT 7829 88.139 6.941 141.249 1.00 0.00 H ATOM 995 H2 WAT 7829 89.090 7.419 140.172 1.00 0.00 H TER 997 WAT 7829 ATOM 997 O WAT 7830 144.193 7.476 148.297 1.00 0.00 O ATOM 998 H1 WAT 7830 144.452 7.656 149.201 1.00 0.00 H ATOM 999 H2 WAT 7830 143.347 7.914 148.199 1.00 0.00 H TER 1001 WAT 7830 ATOM 1001 O WAT 7831 130.437 67.753 20.842 1.00 0.00 O ATOM 1002 H1 WAT 7831 130.901 67.406 21.603 1.00 0.00 H ATOM 1003 H2 WAT 7831 129.699 68.238 21.212 1.00 0.00 H TER 1005 WAT 7831 ATOM 1005 O WAT 7832 86.169 72.254 119.475 1.00 0.00 O ATOM 1006 H1 WAT 7832 86.061 72.571 118.579 1.00 0.00 H ATOM 1007 H2 WAT 7832 85.676 72.875 120.011 1.00 0.00 H TER 1009 WAT 7832 ATOM 1009 O WAT 7833 33.820 136.406 75.531 1.00 0.00 O ATOM 1010 H1 WAT 7833 33.672 136.230 74.602 1.00 0.00 H ATOM 1011 H2 WAT 7833 33.730 135.551 75.953 1.00 0.00 H TER 1013 WAT 7833 ATOM 1013 O WAT 7834 40.697 27.321 112.517 1.00 0.00 O ATOM 1014 H1 WAT 7834 40.352 28.200 112.361 1.00 0.00 H ATOM 1015 H2 WAT 7834 41.648 27.429 112.489 1.00 0.00 H TER 1017 WAT 7834 ATOM 1017 O WAT 7835 -0.291 48.760 136.973 1.00 0.00 O ATOM 1018 H1 WAT 7835 0.478 48.549 137.501 1.00 0.00 H ATOM 1019 H2 WAT 7835 0.055 49.266 136.237 1.00 0.00 H TER 1021 WAT 7835 ATOM 1021 O WAT 7836 104.620 133.027 97.698 1.00 0.00 O ATOM 1022 H1 WAT 7836 104.323 132.419 98.375 1.00 0.00 H ATOM 1023 H2 WAT 7836 104.201 132.715 96.895 1.00 0.00 H TER 1025 WAT 7836 ATOM 1025 O WAT 7837 33.792 118.858 61.802 1.00 0.00 O ATOM 1026 H1 WAT 7837 32.972 118.429 61.557 1.00 0.00 H ATOM 1027 H2 WAT 7837 34.154 119.174 60.974 1.00 0.00 H TER 1029 WAT 7837 ATOM 1029 O WAT 7838 14.218 136.989 83.047 1.00 0.00 O ATOM 1030 H1 WAT 7838 14.404 137.564 82.304 1.00 0.00 H ATOM 1031 H2 WAT 7838 14.112 136.121 82.656 1.00 0.00 H TER 1033 WAT 7838 ATOM 1033 O WAT 7839 69.172 34.181 62.701 1.00 0.00 O ATOM 1034 H1 WAT 7839 69.893 34.693 62.336 1.00 0.00 H ATOM 1035 H2 WAT 7839 68.618 34.826 63.141 1.00 0.00 H TER 1037 WAT 7839 ATOM 1037 O WAT 7840 57.817 59.956 126.582 1.00 0.00 O ATOM 1038 H1 WAT 7840 58.257 59.137 126.353 1.00 0.00 H ATOM 1039 H2 WAT 7840 58.028 60.091 127.506 1.00 0.00 H TER 1041 WAT 7840 ATOM 1041 O WAT 7841 52.953 64.955 122.988 1.00 0.00 O ATOM 1042 H1 WAT 7841 53.325 65.429 122.244 1.00 0.00 H ATOM 1043 H2 WAT 7841 52.079 65.330 123.098 1.00 0.00 H TER 1045 WAT 7841 ATOM 1045 O WAT 7842 136.625 53.841 118.548 1.00 0.00 O ATOM 1046 H1 WAT 7842 137.486 53.461 118.722 1.00 0.00 H ATOM 1047 H2 WAT 7842 136.058 53.468 119.223 1.00 0.00 H TER 1049 WAT 7842 ATOM 1049 O WAT 7843 53.054 135.258 70.327 1.00 0.00 O ATOM 1050 H1 WAT 7843 52.886 135.735 71.139 1.00 0.00 H ATOM 1051 H2 WAT 7843 53.099 134.340 70.594 1.00 0.00 H TER 1053 WAT 7843 ATOM 1053 O WAT 7844 1.656 37.881 95.772 1.00 0.00 O ATOM 1054 H1 WAT 7844 1.808 36.937 95.728 1.00 0.00 H ATOM 1055 H2 WAT 7844 1.232 38.095 94.940 1.00 0.00 H TER 1057 WAT 7844 ATOM 1057 O WAT 7845 95.704 76.451 103.835 1.00 0.00 O ATOM 1058 H1 WAT 7845 95.975 76.658 104.730 1.00 0.00 H ATOM 1059 H2 WAT 7845 96.515 76.476 103.327 1.00 0.00 H TER 1061 WAT 7845 ATOM 1061 O WAT 7846 30.385 52.166 112.613 1.00 0.00 O ATOM 1062 H1 WAT 7846 31.323 52.008 112.717 1.00 0.00 H ATOM 1063 H2 WAT 7846 29.968 51.389 112.985 1.00 0.00 H TER 1065 WAT 7846 ATOM 1065 O WAT 7847 47.244 104.099 11.906 1.00 0.00 O ATOM 1066 H1 WAT 7847 47.217 104.231 12.854 1.00 0.00 H ATOM 1067 H2 WAT 7847 47.140 104.976 11.538 1.00 0.00 H TER 1069 WAT 7847 ATOM 1069 O WAT 7848 123.617 69.442 59.028 1.00 0.00 O ATOM 1070 H1 WAT 7848 124.095 68.729 58.605 1.00 0.00 H ATOM 1071 H2 WAT 7848 123.378 69.094 59.887 1.00 0.00 H TER 1073 WAT 7848 ATOM 1073 O WAT 7849 72.589 46.399 139.645 1.00 0.00 O ATOM 1074 H1 WAT 7849 73.168 47.144 139.485 1.00 0.00 H ATOM 1075 H2 WAT 7849 72.745 45.812 138.904 1.00 0.00 H TER 1077 WAT 7849 ATOM 1077 O WAT 7850 128.932 128.031 9.066 1.00 0.00 O ATOM 1078 H1 WAT 7850 129.494 127.947 8.296 1.00 0.00 H ATOM 1079 H2 WAT 7850 129.519 127.891 9.808 1.00 0.00 H TER 1081 WAT 7850 ATOM 1081 O WAT 7851 79.346 80.297 92.829 1.00 0.00 O ATOM 1082 H1 WAT 7851 79.423 80.229 93.780 1.00 0.00 H ATOM 1083 H2 WAT 7851 79.852 79.557 92.494 1.00 0.00 H TER 1085 WAT 7851 ATOM 1085 O WAT 7852 117.301 17.361 148.262 1.00 0.00 O ATOM 1086 H1 WAT 7852 117.716 16.702 147.706 1.00 0.00 H ATOM 1087 H2 WAT 7852 116.923 17.990 147.647 1.00 0.00 H TER 1089 WAT 7852 ATOM 1089 O WAT 7853 130.104 125.733 60.391 1.00 0.00 O ATOM 1090 H1 WAT 7853 130.621 126.522 60.553 1.00 0.00 H ATOM 1091 H2 WAT 7853 130.732 125.015 60.470 1.00 0.00 H TER 1093 WAT 7853 ATOM 1093 O WAT 7854 112.814 51.964 12.164 1.00 0.00 O ATOM 1094 H1 WAT 7854 112.081 52.580 12.160 1.00 0.00 H ATOM 1095 H2 WAT 7854 112.832 51.619 13.056 1.00 0.00 H TER 1097 WAT 7854 ATOM 1097 O WAT 7855 52.388 35.957 102.433 1.00 0.00 O ATOM 1098 H1 WAT 7855 52.885 36.550 101.870 1.00 0.00 H ATOM 1099 H2 WAT 7855 52.869 35.130 102.393 1.00 0.00 H TER 1101 WAT 7855 ATOM 1101 O WAT 7856 22.401 78.131 19.996 1.00 0.00 O ATOM 1102 H1 WAT 7856 22.736 79.027 20.001 1.00 0.00 H ATOM 1103 H2 WAT 7856 23.179 77.584 19.890 1.00 0.00 H TER 1105 WAT 7856 ATOM 1105 O WAT 7857 140.827 126.292 74.749 1.00 0.00 O ATOM 1106 H1 WAT 7857 140.769 125.448 74.302 1.00 0.00 H ATOM 1107 H2 WAT 7857 139.925 126.497 74.993 1.00 0.00 H TER 1109 WAT 7857 ATOM 1109 O WAT 7858 104.345 115.882 155.349 1.00 0.00 O ATOM 1110 H1 WAT 7858 104.424 116.522 156.057 1.00 0.00 H ATOM 1111 H2 WAT 7858 105.085 116.070 154.773 1.00 0.00 H TER 1113 WAT 7858 ATOM 1113 O WAT 7859 51.786 62.399 122.818 1.00 0.00 O ATOM 1114 H1 WAT 7859 52.290 63.213 122.819 1.00 0.00 H ATOM 1115 H2 WAT 7859 51.937 62.025 121.950 1.00 0.00 H TER 1117 WAT 7859 ATOM 1117 O WAT 7860 130.197 139.651 144.159 1.00 0.00 O ATOM 1118 H1 WAT 7860 130.657 140.175 143.503 1.00 0.00 H ATOM 1119 H2 WAT 7860 130.430 140.056 144.995 1.00 0.00 H TER 1121 WAT 7860 ATOM 1121 O WAT 7861 75.092 43.705 125.358 1.00 0.00 O ATOM 1122 H1 WAT 7861 74.622 44.262 124.738 1.00 0.00 H ATOM 1123 H2 WAT 7861 74.414 43.382 125.952 1.00 0.00 H TER 1125 WAT 7861 ATOM 1125 O WAT 7862 6.033 58.350 76.785 1.00 0.00 O ATOM 1126 H1 WAT 7862 5.882 59.194 76.360 1.00 0.00 H ATOM 1127 H2 WAT 7862 5.188 58.122 77.172 1.00 0.00 H TER 1129 WAT 7862 ATOM 1129 O WAT 7863 39.841 129.413 51.738 1.00 0.00 O ATOM 1130 H1 WAT 7863 40.594 129.873 52.109 1.00 0.00 H ATOM 1131 H2 WAT 7863 39.938 128.511 52.042 1.00 0.00 H TER 1133 WAT 7863 ATOM 1133 O WAT 7864 57.548 6.310 3.523 1.00 0.00 O ATOM 1134 H1 WAT 7864 56.640 6.341 3.824 1.00 0.00 H ATOM 1135 H2 WAT 7864 57.940 7.116 3.859 1.00 0.00 H TER 1137 WAT 7864 ATOM 1137 O WAT 7865 45.383 78.507 127.553 1.00 0.00 O ATOM 1138 H1 WAT 7865 45.084 78.599 128.458 1.00 0.00 H ATOM 1139 H2 WAT 7865 44.922 77.736 127.224 1.00 0.00 H TER 1141 WAT 7865 ATOM 1141 O WAT 7866 98.986 59.215 155.641 1.00 0.00 O ATOM 1142 H1 WAT 7866 98.382 58.589 156.042 1.00 0.00 H ATOM 1143 H2 WAT 7866 99.302 58.772 154.854 1.00 0.00 H TER 1145 WAT 7866 ATOM 1145 O WAT 7867 19.963 87.715 124.975 1.00 0.00 O ATOM 1146 H1 WAT 7867 20.356 86.862 125.160 1.00 0.00 H ATOM 1147 H2 WAT 7867 19.031 87.593 125.154 1.00 0.00 H TER 1149 WAT 7867 ATOM 1149 O WAT 7868 60.780 19.244 121.155 1.00 0.00 O ATOM 1150 H1 WAT 7868 61.287 18.575 120.694 1.00 0.00 H ATOM 1151 H2 WAT 7868 61.308 19.456 121.925 1.00 0.00 H TER 1153 WAT 7868 ATOM 1153 O WAT 7869 126.630 34.556 63.938 1.00 0.00 O ATOM 1154 H1 WAT 7869 126.165 35.392 63.912 1.00 0.00 H ATOM 1155 H2 WAT 7869 127.526 34.772 63.681 1.00 0.00 H TER 1157 WAT 7869 ATOM 1157 O WAT 7870 70.624 107.345 11.669 1.00 0.00 O ATOM 1158 H1 WAT 7870 70.747 108.279 11.836 1.00 0.00 H ATOM 1159 H2 WAT 7870 70.108 107.035 12.414 1.00 0.00 H TER 1161 WAT 7870 ATOM 1161 O WAT 7871 100.017 10.123 58.179 1.00 0.00 O ATOM 1162 H1 WAT 7871 100.765 9.535 58.288 1.00 0.00 H ATOM 1163 H2 WAT 7871 100.320 10.963 58.524 1.00 0.00 H TER 1165 WAT 7871 ATOM 1165 O WAT 7872 77.228 78.030 7.337 1.00 0.00 O ATOM 1166 H1 WAT 7872 77.162 78.678 6.636 1.00 0.00 H ATOM 1167 H2 WAT 7872 76.513 77.418 7.165 1.00 0.00 H TER 1169 WAT 7872 ATOM 1169 O WAT 7873 66.262 123.797 96.056 1.00 0.00 O ATOM 1170 H1 WAT 7873 66.310 122.844 95.988 1.00 0.00 H ATOM 1171 H2 WAT 7873 67.164 124.092 95.932 1.00 0.00 H TER 1173 WAT 7873 ATOM 1173 O WAT 7874 105.135 11.882 8.145 1.00 0.00 O ATOM 1174 H1 WAT 7874 105.286 11.259 8.855 1.00 0.00 H ATOM 1175 H2 WAT 7874 105.510 12.703 8.462 1.00 0.00 H TER 1177 WAT 7874 ATOM 1177 O WAT 7875 36.650 0.728 139.860 1.00 0.00 O ATOM 1178 H1 WAT 7875 36.520 1.469 140.453 1.00 0.00 H ATOM 1179 H2 WAT 7875 37.026 0.043 140.413 1.00 0.00 H TER 1181 WAT 7875 ATOM 1181 O WAT 7876 95.527 23.596 51.921 1.00 0.00 O ATOM 1182 H1 WAT 7876 94.962 24.342 52.126 1.00 0.00 H ATOM 1183 H2 WAT 7876 96.340 23.991 51.606 1.00 0.00 H TER 1185 WAT 7876 ATOM 1185 O WAT 7877 70.740 1.719 138.072 1.00 0.00 O ATOM 1186 H1 WAT 7877 70.394 2.168 138.843 1.00 0.00 H ATOM 1187 H2 WAT 7877 70.507 2.288 137.338 1.00 0.00 H TER 1189 WAT 7877 ATOM 1189 O WAT 7878 110.623 45.992 79.495 1.00 0.00 O ATOM 1190 H1 WAT 7878 110.239 46.127 80.361 1.00 0.00 H ATOM 1191 H2 WAT 7878 111.413 45.477 79.661 1.00 0.00 H TER 1193 WAT 7878 ATOM 1193 O WAT 7879 61.627 101.932 89.512 1.00 0.00 O ATOM 1194 H1 WAT 7879 61.018 102.262 90.172 1.00 0.00 H ATOM 1195 H2 WAT 7879 62.262 102.639 89.398 1.00 0.00 H TER 1197 WAT 7879 ATOM 1197 O WAT 7880 20.858 16.741 73.592 1.00 0.00 O ATOM 1198 H1 WAT 7880 20.940 16.032 72.955 1.00 0.00 H ATOM 1199 H2 WAT 7880 21.495 16.527 74.273 1.00 0.00 H TER 1201 WAT 7880 ATOM 1201 O WAT 7881 31.800 97.709 81.487 1.00 0.00 O ATOM 1202 H1 WAT 7881 31.386 96.875 81.269 1.00 0.00 H ATOM 1203 H2 WAT 7881 31.321 98.021 82.255 1.00 0.00 H TER 1205 WAT 7881 ATOM 1205 O WAT 7882 128.464 91.664 91.602 1.00 0.00 O ATOM 1206 H1 WAT 7882 128.810 90.774 91.530 1.00 0.00 H ATOM 1207 H2 WAT 7882 127.738 91.690 90.979 1.00 0.00 H TER 1209 WAT 7882 ATOM 1209 O WAT 7883 57.975 118.059 6.356 1.00 0.00 O ATOM 1210 H1 WAT 7883 57.764 117.134 6.483 1.00 0.00 H ATOM 1211 H2 WAT 7883 57.204 118.526 6.675 1.00 0.00 H TER 1213 WAT 7883 ATOM 1213 O WAT 7884 108.750 7.956 111.204 1.00 0.00 O ATOM 1214 H1 WAT 7884 108.108 8.666 111.231 1.00 0.00 H ATOM 1215 H2 WAT 7884 109.360 8.158 111.915 1.00 0.00 H TER 1217 WAT 7884 ATOM 1217 O WAT 7885 57.232 132.212 15.530 1.00 0.00 O ATOM 1218 H1 WAT 7885 58.061 132.675 15.655 1.00 0.00 H ATOM 1219 H2 WAT 7885 56.843 132.177 16.404 1.00 0.00 H TER 1221 WAT 7885 ATOM 1221 O WAT 7886 112.027 114.075 135.191 1.00 0.00 O ATOM 1222 H1 WAT 7886 112.138 114.525 134.354 1.00 0.00 H ATOM 1223 H2 WAT 7886 111.082 114.087 135.346 1.00 0.00 H TER 1225 WAT 7886 ATOM 1225 O WAT 7887 53.350 101.738 21.507 1.00 0.00 O ATOM 1226 H1 WAT 7887 52.816 102.008 20.760 1.00 0.00 H ATOM 1227 H2 WAT 7887 52.811 101.092 21.965 1.00 0.00 H TER 1229 WAT 7887 ATOM 1229 O WAT 7888 40.446 120.396 123.325 1.00 0.00 O ATOM 1230 H1 WAT 7888 39.982 119.662 122.922 1.00 0.00 H ATOM 1231 H2 WAT 7888 40.617 120.998 122.601 1.00 0.00 H TER 1233 WAT 7888 ATOM 1233 O WAT 7889 1.032 13.140 139.386 1.00 0.00 O ATOM 1234 H1 WAT 7889 0.370 13.038 138.702 1.00 0.00 H ATOM 1235 H2 WAT 7889 1.680 12.462 139.195 1.00 0.00 H TER 1237 WAT 7889 ATOM 1237 O WAT 7890 47.542 118.019 138.054 1.00 0.00 O ATOM 1238 H1 WAT 7890 47.309 117.371 137.390 1.00 0.00 H ATOM 1239 H2 WAT 7890 46.705 118.278 138.440 1.00 0.00 H TER 1241 WAT 7890 ATOM 1241 O WAT 7891 132.020 83.323 103.030 1.00 0.00 O ATOM 1242 H1 WAT 7891 132.654 82.607 103.057 1.00 0.00 H ATOM 1243 H2 WAT 7891 131.660 83.358 103.917 1.00 0.00 H TER 1245 WAT 7891 ATOM 1245 O WAT 7892 57.507 28.156 153.572 1.00 0.00 O ATOM 1246 H1 WAT 7892 57.418 28.563 152.710 1.00 0.00 H ATOM 1247 H2 WAT 7892 58.310 28.532 153.933 1.00 0.00 H TER 1249 WAT 7892 ATOM 1249 O WAT 7893 81.574 2.814 74.417 1.00 0.00 O ATOM 1250 H1 WAT 7893 81.902 3.091 75.272 1.00 0.00 H ATOM 1251 H2 WAT 7893 82.348 2.485 73.959 1.00 0.00 H TER 1253 WAT 7893 ATOM 1253 O WAT 7894 141.659 24.506 121.620 1.00 0.00 O ATOM 1254 H1 WAT 7894 142.351 24.004 122.051 1.00 0.00 H ATOM 1255 H2 WAT 7894 141.320 25.083 122.304 1.00 0.00 H TER 1257 WAT 7894 ATOM 1257 O WAT 7895 64.974 116.890 144.416 1.00 0.00 O ATOM 1258 H1 WAT 7895 64.591 116.865 145.293 1.00 0.00 H ATOM 1259 H2 WAT 7895 64.732 116.051 144.025 1.00 0.00 H TER 1261 WAT 7895 ATOM 1261 O WAT 7896 116.785 57.475 112.778 1.00 0.00 O ATOM 1262 H1 WAT 7896 117.314 57.188 113.523 1.00 0.00 H ATOM 1263 H2 WAT 7896 117.283 58.196 112.393 1.00 0.00 H TER 1265 WAT 7896 ATOM 1265 O WAT 7897 102.782 40.840 71.819 1.00 0.00 O ATOM 1266 H1 WAT 7897 102.566 40.933 70.891 1.00 0.00 H ATOM 1267 H2 WAT 7897 103.165 39.966 71.890 1.00 0.00 H TER 1269 WAT 7897 ATOM 1269 O WAT 7898 64.599 111.995 156.730 1.00 0.00 O ATOM 1270 H1 WAT 7898 64.772 112.797 157.223 1.00 0.00 H ATOM 1271 H2 WAT 7898 65.125 112.084 155.935 1.00 0.00 H TER 1273 WAT 7898 ATOM 1273 O WAT 7899 120.892 29.992 152.235 1.00 0.00 O ATOM 1274 H1 WAT 7899 120.468 29.238 151.824 1.00 0.00 H ATOM 1275 H2 WAT 7899 121.690 29.634 152.625 1.00 0.00 H TER 1277 WAT 7899 ATOM 1277 O WAT 7900 38.114 2.314 62.659 1.00 0.00 O ATOM 1278 H1 WAT 7900 38.129 3.224 62.362 1.00 0.00 H ATOM 1279 H2 WAT 7900 39.030 2.107 62.842 1.00 0.00 H TER 1281 WAT 7900 ATOM 1281 O WAT 7901 19.486 85.699 54.950 1.00 0.00 O ATOM 1282 H1 WAT 7901 19.206 86.600 55.111 1.00 0.00 H ATOM 1283 H2 WAT 7901 20.435 85.718 55.070 1.00 0.00 H TER 1285 WAT 7901 ATOM 1285 O WAT 7902 123.769 126.098 85.894 1.00 0.00 O ATOM 1286 H1 WAT 7902 123.520 126.591 85.113 1.00 0.00 H ATOM 1287 H2 WAT 7902 124.536 126.559 86.234 1.00 0.00 H TER 1289 WAT 7902 ATOM 1289 O WAT 7903 57.751 48.662 54.595 1.00 0.00 O ATOM 1290 H1 WAT 7903 58.672 48.644 54.336 1.00 0.00 H ATOM 1291 H2 WAT 7903 57.675 47.978 55.260 1.00 0.00 H TER 1293 WAT 7903 ATOM 1293 O WAT 7904 124.762 120.204 0.303 1.00 0.00 O ATOM 1294 H1 WAT 7904 124.621 119.839 -0.571 1.00 0.00 H ATOM 1295 H2 WAT 7904 124.366 119.566 0.896 1.00 0.00 H TER 1297 WAT 7904 ATOM 1297 O WAT 7905 56.433 104.106 88.362 1.00 0.00 O ATOM 1298 H1 WAT 7905 57.073 103.531 87.943 1.00 0.00 H ATOM 1299 H2 WAT 7905 56.365 103.776 89.258 1.00 0.00 H TER 1301 WAT 7905 ATOM 1301 O WAT 7906 142.001 12.573 133.765 1.00 0.00 O ATOM 1302 H1 WAT 7906 142.767 13.086 133.507 1.00 0.00 H ATOM 1303 H2 WAT 7906 142.008 12.596 134.721 1.00 0.00 H TER 1305 WAT 7906 ATOM 1305 O WAT 7907 94.333 71.011 88.379 1.00 0.00 O ATOM 1306 H1 WAT 7907 94.255 71.420 89.241 1.00 0.00 H ATOM 1307 H2 WAT 7907 95.244 71.161 88.124 1.00 0.00 H TER 1309 WAT 7907 ATOM 1309 O WAT 7908 37.300 122.371 147.634 1.00 0.00 O ATOM 1310 H1 WAT 7908 37.616 121.580 147.196 1.00 0.00 H ATOM 1311 H2 WAT 7908 37.490 122.223 148.560 1.00 0.00 H TER 1313 WAT 7908 ATOM 1313 O WAT 7909 39.602 145.537 94.845 1.00 0.00 O ATOM 1314 H1 WAT 7909 40.336 146.124 94.664 1.00 0.00 H ATOM 1315 H2 WAT 7909 38.921 146.109 95.200 1.00 0.00 H TER 1317 WAT 7909 ATOM 1317 O WAT 7910 135.978 15.629 60.220 1.00 0.00 O ATOM 1318 H1 WAT 7910 136.205 14.701 60.158 1.00 0.00 H ATOM 1319 H2 WAT 7910 136.337 16.018 59.423 1.00 0.00 H TER 1321 WAT 7910 ATOM 1321 O WAT 7911 5.196 38.498 154.319 1.00 0.00 O ATOM 1322 H1 WAT 7911 5.186 38.502 153.362 1.00 0.00 H ATOM 1323 H2 WAT 7911 5.212 39.424 154.562 1.00 0.00 H TER 1325 WAT 7911 ATOM 1325 O WAT 7912 133.789 113.092 1.879 1.00 0.00 O ATOM 1326 H1 WAT 7912 133.611 113.622 2.656 1.00 0.00 H ATOM 1327 H2 WAT 7912 134.475 112.485 2.155 1.00 0.00 H TER 1329 WAT 7912 ATOM 1329 O WAT 7913 75.659 127.689 68.887 1.00 0.00 O ATOM 1330 H1 WAT 7913 76.141 128.465 68.601 1.00 0.00 H ATOM 1331 H2 WAT 7913 75.513 127.188 68.085 1.00 0.00 H TER 1333 WAT 7913 ATOM 1333 O WAT 7914 89.250 71.919 8.426 1.00 0.00 O ATOM 1334 H1 WAT 7914 89.764 71.579 9.158 1.00 0.00 H ATOM 1335 H2 WAT 7914 88.356 71.626 8.604 1.00 0.00 H TER 1337 WAT 7914 ATOM 1337 O WAT 7915 53.796 77.463 15.420 1.00 0.00 O ATOM 1338 H1 WAT 7915 53.600 76.786 16.068 1.00 0.00 H ATOM 1339 H2 WAT 7915 53.011 78.011 15.403 1.00 0.00 H TER 1341 WAT 7915 ATOM 1341 O WAT 7916 62.752 87.499 134.127 1.00 0.00 O ATOM 1342 H1 WAT 7916 62.845 87.264 135.051 1.00 0.00 H ATOM 1343 H2 WAT 7916 63.529 88.024 133.934 1.00 0.00 H TER 1345 WAT 7916 ATOM 1345 O WAT 7917 48.095 134.726 119.763 1.00 0.00 O ATOM 1346 H1 WAT 7917 48.041 135.577 120.199 1.00 0.00 H ATOM 1347 H2 WAT 7917 47.775 134.891 118.876 1.00 0.00 H TER 1349 WAT 7917 ATOM 1349 O WAT 7918 95.860 86.974 139.537 1.00 0.00 O ATOM 1350 H1 WAT 7918 96.072 87.058 138.607 1.00 0.00 H ATOM 1351 H2 WAT 7918 95.185 86.296 139.568 1.00 0.00 H TER 1353 WAT 7918 ATOM 1353 O WAT 7919 98.819 88.678 114.271 1.00 0.00 O ATOM 1354 H1 WAT 7919 99.294 88.310 115.016 1.00 0.00 H ATOM 1355 H2 WAT 7919 98.002 88.181 114.239 1.00 0.00 H TER 1357 WAT 7919 ATOM 1357 O WAT 7920 71.934 140.464 139.208 1.00 0.00 O ATOM 1358 H1 WAT 7920 72.227 140.021 138.412 1.00 0.00 H ATOM 1359 H2 WAT 7920 71.149 139.985 139.473 1.00 0.00 H TER 1361 WAT 7920 ATOM 1361 O WAT 7921 67.360 16.467 98.496 1.00 0.00 O ATOM 1362 H1 WAT 7921 67.028 15.866 97.829 1.00 0.00 H ATOM 1363 H2 WAT 7921 67.113 16.062 99.328 1.00 0.00 H TER 1365 WAT 7921 ATOM 1365 O WAT 7922 107.877 53.902 114.790 1.00 0.00 O ATOM 1366 H1 WAT 7922 108.452 53.488 114.146 1.00 0.00 H ATOM 1367 H2 WAT 7922 106.999 53.605 114.553 1.00 0.00 H TER 1369 WAT 7922 ATOM 1369 O WAT 7923 64.915 53.066 73.545 1.00 0.00 O ATOM 1370 H1 WAT 7923 65.202 52.297 73.053 1.00 0.00 H ATOM 1371 H2 WAT 7923 65.253 52.924 74.429 1.00 0.00 H TER 1373 WAT 7923 ATOM 1373 O WAT 7924 5.088 45.615 10.924 1.00 0.00 O ATOM 1374 H1 WAT 7924 5.782 44.972 10.778 1.00 0.00 H ATOM 1375 H2 WAT 7924 5.239 45.934 11.813 1.00 0.00 H TER 1377 WAT 7924 ATOM 1377 O WAT 7925 36.891 25.367 142.601 1.00 0.00 O ATOM 1378 H1 WAT 7925 36.851 25.123 141.677 1.00 0.00 H ATOM 1379 H2 WAT 7925 36.624 24.575 143.069 1.00 0.00 H TER 1381 WAT 7925 ATOM 1381 O WAT 7926 114.196 84.785 87.760 1.00 0.00 O ATOM 1382 H1 WAT 7926 114.941 85.329 88.016 1.00 0.00 H ATOM 1383 H2 WAT 7926 113.428 85.312 87.979 1.00 0.00 H TER 1385 WAT 7926 ATOM 1385 O WAT 7927 90.150 63.060 21.155 1.00 0.00 O ATOM 1386 H1 WAT 7927 89.533 62.361 21.372 1.00 0.00 H ATOM 1387 H2 WAT 7927 90.691 62.692 20.456 1.00 0.00 H TER 1389 WAT 7927 ATOM 1389 O WAT 7928 74.763 62.202 92.503 1.00 0.00 O ATOM 1390 H1 WAT 7928 74.823 62.079 91.556 1.00 0.00 H ATOM 1391 H2 WAT 7928 74.430 61.367 92.833 1.00 0.00 H TER 1393 WAT 7928 ATOM 1393 O WAT 7929 104.521 124.728 99.316 1.00 0.00 O ATOM 1394 H1 WAT 7929 104.923 125.098 100.103 1.00 0.00 H ATOM 1395 H2 WAT 7929 103.579 124.817 99.465 1.00 0.00 H TER 1397 WAT 7929 ATOM 1397 O WAT 7930 16.688 38.325 119.487 1.00 0.00 O ATOM 1398 H1 WAT 7930 16.612 38.410 120.438 1.00 0.00 H ATOM 1399 H2 WAT 7930 16.457 37.414 119.308 1.00 0.00 H TER 1401 WAT 7930 ATOM 1401 O WAT 7931 49.889 90.714 133.047 1.00 0.00 O ATOM 1402 H1 WAT 7931 48.984 90.857 132.770 1.00 0.00 H ATOM 1403 H2 WAT 7931 49.925 91.060 133.938 1.00 0.00 H TER 1405 WAT 7931 ATOM 1405 O WAT 7932 46.303 87.930 79.570 1.00 0.00 O ATOM 1406 H1 WAT 7932 47.181 87.778 79.222 1.00 0.00 H ATOM 1407 H2 WAT 7932 45.735 87.922 78.800 1.00 0.00 H TER 1409 WAT 7932 ATOM 1409 O WAT 7933 90.605 29.651 9.585 1.00 0.00 O ATOM 1410 H1 WAT 7933 91.006 29.888 10.421 1.00 0.00 H ATOM 1411 H2 WAT 7933 90.864 30.353 8.988 1.00 0.00 H TER 1413 WAT 7933 ATOM 1413 O WAT 7934 39.468 103.153 125.137 1.00 0.00 O ATOM 1414 H1 WAT 7934 40.184 102.784 125.654 1.00 0.00 H ATOM 1415 H2 WAT 7934 38.925 103.617 125.774 1.00 0.00 H TER 1417 WAT 7934 ATOM 1417 O WAT 7935 60.055 87.659 68.239 1.00 0.00 O ATOM 1418 H1 WAT 7935 60.617 86.889 68.328 1.00 0.00 H ATOM 1419 H2 WAT 7935 59.940 87.763 67.294 1.00 0.00 H TER 1421 WAT 7935 ATOM 1421 O WAT 7936 135.188 111.810 102.448 1.00 0.00 O ATOM 1422 H1 WAT 7936 134.568 111.316 101.911 1.00 0.00 H ATOM 1423 H2 WAT 7936 135.295 112.642 101.986 1.00 0.00 H TER 1425 WAT 7936 ATOM 1425 O WAT 7937 117.665 54.976 152.447 1.00 0.00 O ATOM 1426 H1 WAT 7937 116.853 55.364 152.774 1.00 0.00 H ATOM 1427 H2 WAT 7937 118.005 54.472 153.186 1.00 0.00 H TER 1429 WAT 7937 ATOM 1429 O WAT 7938 79.540 91.841 95.984 1.00 0.00 O ATOM 1430 H1 WAT 7938 79.800 91.296 96.727 1.00 0.00 H ATOM 1431 H2 WAT 7938 78.634 92.086 96.173 1.00 0.00 H TER 1433 WAT 7938 ATOM 1433 O WAT 7939 37.295 101.840 19.167 1.00 0.00 O ATOM 1434 H1 WAT 7939 37.937 102.277 19.727 1.00 0.00 H ATOM 1435 H2 WAT 7939 37.744 101.729 18.329 1.00 0.00 H TER 1437 WAT 7939 ATOM 1437 O WAT 7940 84.096 107.148 116.461 1.00 0.00 O ATOM 1438 H1 WAT 7940 84.816 107.541 116.955 1.00 0.00 H ATOM 1439 H2 WAT 7940 84.525 106.673 115.750 1.00 0.00 H TER 1441 WAT 7940 ATOM 1441 O WAT 7941 122.203 29.115 15.909 1.00 0.00 O ATOM 1442 H1 WAT 7941 122.576 28.245 16.051 1.00 0.00 H ATOM 1443 H2 WAT 7941 122.596 29.658 16.592 1.00 0.00 H TER 1445 WAT 7941 ATOM 1445 O WAT 7942 124.167 32.223 92.012 1.00 0.00 O ATOM 1446 H1 WAT 7942 124.084 33.062 91.559 1.00 0.00 H ATOM 1447 H2 WAT 7942 123.633 32.322 92.800 1.00 0.00 H TER 1449 WAT 7942 ATOM 1449 O WAT 7943 132.304 117.065 95.714 1.00 0.00 O ATOM 1450 H1 WAT 7943 131.398 116.958 95.424 1.00 0.00 H ATOM 1451 H2 WAT 7943 132.603 116.175 95.899 1.00 0.00 H TER 1453 WAT 7943 ATOM 1453 O WAT 7944 116.139 41.923 118.676 1.00 0.00 O ATOM 1454 H1 WAT 7944 116.375 42.845 118.781 1.00 0.00 H ATOM 1455 H2 WAT 7944 115.191 41.932 118.543 1.00 0.00 H TER 1457 WAT 7944 ATOM 1457 O WAT 7945 54.054 63.864 118.856 1.00 0.00 O ATOM 1458 H1 WAT 7945 53.570 63.275 119.435 1.00 0.00 H ATOM 1459 H2 WAT 7945 54.673 63.295 118.399 1.00 0.00 H TER 1461 WAT 7945 ATOM 1461 O WAT 7946 117.488 30.619 74.971 1.00 0.00 O ATOM 1462 H1 WAT 7946 116.745 30.016 74.944 1.00 0.00 H ATOM 1463 H2 WAT 7946 118.173 30.134 75.432 1.00 0.00 H TER 1465 WAT 7946 ATOM 1465 O WAT 7947 48.488 141.381 95.419 1.00 0.00 O ATOM 1466 H1 WAT 7947 49.120 141.038 94.787 1.00 0.00 H ATOM 1467 H2 WAT 7947 48.397 140.684 96.069 1.00 0.00 H TER 1469 WAT 7947 ATOM 1469 O WAT 7948 11.150 108.994 73.527 1.00 0.00 O ATOM 1470 H1 WAT 7948 10.867 109.895 73.368 1.00 0.00 H ATOM 1471 H2 WAT 7948 11.915 109.080 74.096 1.00 0.00 H TER 1473 WAT 7948 ATOM 1473 O WAT 7949 53.060 39.998 116.626 1.00 0.00 O ATOM 1474 H1 WAT 7949 53.150 39.067 116.419 1.00 0.00 H ATOM 1475 H2 WAT 7949 52.428 40.023 117.344 1.00 0.00 H TER 1477 WAT 7949 ATOM 1477 O WAT 7950 143.696 27.233 116.220 1.00 0.00 O ATOM 1478 H1 WAT 7950 142.970 26.626 116.080 1.00 0.00 H ATOM 1479 H2 WAT 7950 143.588 27.532 117.123 1.00 0.00 H TER 1481 WAT 7950 ATOM 1481 O WAT 7951 47.764 46.151 82.571 1.00 0.00 O ATOM 1482 H1 WAT 7951 47.158 46.891 82.611 1.00 0.00 H ATOM 1483 H2 WAT 7951 47.409 45.587 81.883 1.00 0.00 H TER 1485 WAT 7951 ATOM 1485 O WAT 7952 139.487 28.284 116.330 1.00 0.00 O ATOM 1486 H1 WAT 7952 139.612 28.252 115.382 1.00 0.00 H ATOM 1487 H2 WAT 7952 138.993 27.490 116.534 1.00 0.00 H TER 1489 WAT 7952 ATOM 1489 O WAT 7953 144.801 103.327 147.528 1.00 0.00 O ATOM 1490 H1 WAT 7953 143.946 103.074 147.180 1.00 0.00 H ATOM 1491 H2 WAT 7953 145.048 104.099 147.019 1.00 0.00 H TER 1493 WAT 7953 ATOM 1493 O WAT 7954 84.479 111.417 102.520 1.00 0.00 O ATOM 1494 H1 WAT 7954 85.030 110.766 102.086 1.00 0.00 H ATOM 1495 H2 WAT 7954 83.584 111.114 102.367 1.00 0.00 H TER 1497 WAT 7954 ATOM 1497 O WAT 7955 50.055 124.000 57.554 1.00 0.00 O ATOM 1498 H1 WAT 7955 50.222 124.123 56.619 1.00 0.00 H ATOM 1499 H2 WAT 7955 49.566 123.179 57.604 1.00 0.00 H TER 1501 WAT 7955 ATOM 1501 O WAT 7956 36.545 115.930 146.713 1.00 0.00 O ATOM 1502 H1 WAT 7956 35.754 115.771 147.228 1.00 0.00 H ATOM 1503 H2 WAT 7956 37.252 115.946 147.359 1.00 0.00 H TER 1505 WAT 7956 ATOM 1505 O WAT 7957 82.255 7.140 108.757 1.00 0.00 O ATOM 1506 H1 WAT 7957 82.705 6.351 108.456 1.00 0.00 H ATOM 1507 H2 WAT 7957 81.980 7.581 107.953 1.00 0.00 H TER 1509 WAT 7957 ATOM 1509 O WAT 7958 119.976 28.671 72.412 1.00 0.00 O ATOM 1510 H1 WAT 7958 119.708 27.768 72.583 1.00 0.00 H ATOM 1511 H2 WAT 7958 119.166 29.178 72.478 1.00 0.00 H TER 1513 WAT 7958 ATOM 1513 O WAT 7959 32.639 80.244 9.288 1.00 0.00 O ATOM 1514 H1 WAT 7959 31.825 79.764 9.136 1.00 0.00 H ATOM 1515 H2 WAT 7959 33.081 79.751 9.980 1.00 0.00 H TER 1517 WAT 7959 ATOM 1517 O WAT 7960 46.463 129.047 64.699 1.00 0.00 O ATOM 1518 H1 WAT 7960 45.836 129.730 64.937 1.00 0.00 H ATOM 1519 H2 WAT 7960 45.966 128.232 64.765 1.00 0.00 H TER 1521 WAT 7960 ATOM 1521 O WAT 7961 140.880 42.985 82.561 1.00 0.00 O ATOM 1522 H1 WAT 7961 140.444 42.712 83.368 1.00 0.00 H ATOM 1523 H2 WAT 7961 141.814 42.893 82.751 1.00 0.00 H TER 1525 WAT 7961 ATOM 1525 O WAT 7962 130.867 50.242 87.091 1.00 0.00 O ATOM 1526 H1 WAT 7962 131.012 50.989 87.672 1.00 0.00 H ATOM 1527 H2 WAT 7962 130.195 50.542 86.479 1.00 0.00 H TER 1529 WAT 7962 ATOM 1529 O WAT 7963 75.287 92.529 27.127 1.00 0.00 O ATOM 1530 H1 WAT 7963 74.429 92.133 26.971 1.00 0.00 H ATOM 1531 H2 WAT 7963 75.194 93.429 26.815 1.00 0.00 H TER 1533 WAT 7963 ATOM 1533 O WAT 7964 1.487 50.710 150.849 1.00 0.00 O ATOM 1534 H1 WAT 7964 1.934 50.297 150.111 1.00 0.00 H ATOM 1535 H2 WAT 7964 2.045 51.453 151.081 1.00 0.00 H TER 1537 WAT 7964 ATOM 1537 O WAT 7965 37.138 53.606 136.411 1.00 0.00 O ATOM 1538 H1 WAT 7965 37.618 54.200 135.834 1.00 0.00 H ATOM 1539 H2 WAT 7965 36.908 52.863 135.853 1.00 0.00 H TER 1541 WAT 7965 ATOM 1541 O WAT 7966 48.962 24.929 89.269 1.00 0.00 O ATOM 1542 H1 WAT 7966 49.493 25.008 90.061 1.00 0.00 H ATOM 1543 H2 WAT 7966 49.251 24.110 88.867 1.00 0.00 H TER 1545 WAT 7966 ATOM 1545 O WAT 7967 67.534 5.495 75.992 1.00 0.00 O ATOM 1546 H1 WAT 7967 68.181 5.286 75.317 1.00 0.00 H ATOM 1547 H2 WAT 7967 66.689 5.360 75.563 1.00 0.00 H TER 1549 WAT 7967 ATOM 1549 O WAT 7968 38.533 102.945 136.220 1.00 0.00 O ATOM 1550 H1 WAT 7968 38.464 102.856 135.269 1.00 0.00 H ATOM 1551 H2 WAT 7968 39.462 103.117 136.377 1.00 0.00 H TER 1553 WAT 7968 ATOM 1553 O WAT 7969 96.636 15.888 2.259 1.00 0.00 O ATOM 1554 H1 WAT 7969 96.345 15.070 1.855 1.00 0.00 H ATOM 1555 H2 WAT 7969 96.954 16.416 1.528 1.00 0.00 H TER 1557 WAT 7969 ATOM 1557 O WAT 7970 125.004 104.214 101.349 1.00 0.00 O ATOM 1558 H1 WAT 7970 125.188 103.601 102.060 1.00 0.00 H ATOM 1559 H2 WAT 7970 125.079 103.688 100.553 1.00 0.00 H TER 1561 WAT 7970 ATOM 1561 O WAT 7971 112.178 80.483 88.502 1.00 0.00 O ATOM 1562 H1 WAT 7971 111.668 80.235 89.273 1.00 0.00 H ATOM 1563 H2 WAT 7971 112.875 81.041 88.846 1.00 0.00 H TER 1565 WAT 7971 ATOM 1565 O WAT 7972 22.909 36.404 150.801 1.00 0.00 O ATOM 1566 H1 WAT 7972 22.379 36.896 151.428 1.00 0.00 H ATOM 1567 H2 WAT 7972 22.528 35.526 150.803 1.00 0.00 H TER 1569 WAT 7972 ATOM 1569 O WAT 7973 72.551 57.396 13.964 1.00 0.00 O ATOM 1570 H1 WAT 7973 71.625 57.634 13.940 1.00 0.00 H ATOM 1571 H2 WAT 7973 72.779 57.222 13.051 1.00 0.00 H TER 1573 WAT 7973 ATOM 1573 O WAT 7974 25.319 103.960 147.920 1.00 0.00 O ATOM 1574 H1 WAT 7974 25.712 104.761 148.265 1.00 0.00 H ATOM 1575 H2 WAT 7974 25.548 103.961 146.991 1.00 0.00 H TER 1577 WAT 7974 ATOM 1577 O WAT 7975 2.589 120.364 91.214 1.00 0.00 O ATOM 1578 H1 WAT 7975 2.509 120.394 90.261 1.00 0.00 H ATOM 1579 H2 WAT 7975 3.152 119.608 91.383 1.00 0.00 H TER 1581 WAT 7975 ATOM 1581 O WAT 7976 39.971 52.496 92.349 1.00 0.00 O ATOM 1582 H1 WAT 7976 39.760 51.571 92.221 1.00 0.00 H ATOM 1583 H2 WAT 7976 39.886 52.884 91.478 1.00 0.00 H TER 1585 WAT 7976 ATOM 1585 O WAT 7977 76.737 117.977 122.310 1.00 0.00 O ATOM 1586 H1 WAT 7977 77.566 118.453 122.255 1.00 0.00 H ATOM 1587 H2 WAT 7977 76.553 117.711 121.409 1.00 0.00 H TER 1589 WAT 7977 ATOM 1589 O WAT 7978 132.225 24.700 19.940 1.00 0.00 O ATOM 1590 H1 WAT 7978 132.200 23.744 19.896 1.00 0.00 H ATOM 1591 H2 WAT 7978 131.509 24.985 19.372 1.00 0.00 H TER 1593 WAT 7978 ATOM 1593 O WAT 7979 64.563 135.511 97.735 1.00 0.00 O ATOM 1594 H1 WAT 7979 64.661 134.604 98.025 1.00 0.00 H ATOM 1595 H2 WAT 7979 63.675 135.553 97.380 1.00 0.00 H TER 1597 WAT 7979 ATOM 1597 O WAT 7980 40.768 83.845 22.938 1.00 0.00 O ATOM 1598 H1 WAT 7980 41.695 83.738 22.727 1.00 0.00 H ATOM 1599 H2 WAT 7980 40.425 84.401 22.239 1.00 0.00 H TER 1601 WAT 7980 ATOM 1601 O WAT 7981 9.316 145.308 79.525 1.00 0.00 O ATOM 1602 H1 WAT 7981 8.620 144.772 79.146 1.00 0.00 H ATOM 1603 H2 WAT 7981 9.660 144.779 80.245 1.00 0.00 H TER 1605 WAT 7981 ATOM 1605 O WAT 7982 64.056 90.919 158.271 1.00 0.00 O ATOM 1606 H1 WAT 7982 63.622 91.677 158.663 1.00 0.00 H ATOM 1607 H2 WAT 7982 63.563 90.749 157.468 1.00 0.00 H TER 1609 WAT 7982 ATOM 1609 O WAT 7983 53.466 25.515 130.647 1.00 0.00 O ATOM 1610 H1 WAT 7983 53.217 25.838 129.781 1.00 0.00 H ATOM 1611 H2 WAT 7983 53.027 24.667 130.720 1.00 0.00 H TER 1613 WAT 7983 ATOM 1613 O WAT 7984 49.771 71.210 127.409 1.00 0.00 O ATOM 1614 H1 WAT 7984 50.454 71.202 126.738 1.00 0.00 H ATOM 1615 H2 WAT 7984 49.694 70.297 127.684 1.00 0.00 H TER 1617 WAT 7984 ATOM 1617 O WAT 7985 11.292 58.066 157.194 1.00 0.00 O ATOM 1618 H1 WAT 7985 11.182 58.825 157.766 1.00 0.00 H ATOM 1619 H2 WAT 7985 11.604 58.433 156.367 1.00 0.00 H TER 1621 WAT 7985 ATOM 1621 O WAT 7986 33.655 105.419 91.109 1.00 0.00 O ATOM 1622 H1 WAT 7986 33.121 106.034 91.612 1.00 0.00 H ATOM 1623 H2 WAT 7986 34.470 105.348 91.605 1.00 0.00 H TER 1625 WAT 7986 ATOM 1625 O WAT 7987 57.276 35.354 117.284 1.00 0.00 O ATOM 1626 H1 WAT 7987 56.867 35.022 116.485 1.00 0.00 H ATOM 1627 H2 WAT 7987 58.215 35.237 117.140 1.00 0.00 H TER 1629 WAT 7987 ATOM 1629 O WAT 7988 6.808 20.119 134.184 1.00 0.00 O ATOM 1630 H1 WAT 7988 7.323 19.595 134.799 1.00 0.00 H ATOM 1631 H2 WAT 7988 7.410 20.804 133.892 1.00 0.00 H TER 1633 WAT 7988 ATOM 1633 O WAT 7989 145.653 88.254 123.564 1.00 0.00 O ATOM 1634 H1 WAT 7989 146.498 88.682 123.422 1.00 0.00 H ATOM 1635 H2 WAT 7989 145.077 88.957 123.864 1.00 0.00 H TER 1637 WAT 7989 ATOM 1637 O WAT 7990 110.380 34.462 146.683 1.00 0.00 O ATOM 1638 H1 WAT 7990 110.001 34.537 145.807 1.00 0.00 H ATOM 1639 H2 WAT 7990 111.289 34.742 146.575 1.00 0.00 H TER 1641 WAT 7990 ATOM 1641 O WAT 7991 51.068 67.420 119.018 1.00 0.00 O ATOM 1642 H1 WAT 7991 50.807 66.622 119.479 1.00 0.00 H ATOM 1643 H2 WAT 7991 51.826 67.157 118.496 1.00 0.00 H TER 1645 WAT 7991 ATOM 1645 O WAT 7992 8.249 97.937 119.885 1.00 0.00 O ATOM 1646 H1 WAT 7992 8.142 97.011 120.103 1.00 0.00 H ATOM 1647 H2 WAT 7992 7.398 98.200 119.533 1.00 0.00 H TER 1649 WAT 7992 ATOM 1649 O WAT 7993 19.360 11.127 131.372 1.00 0.00 O ATOM 1650 H1 WAT 7993 19.102 10.595 132.125 1.00 0.00 H ATOM 1651 H2 WAT 7993 20.308 11.014 131.313 1.00 0.00 H TER 1653 WAT 7993 ATOM 1653 O WAT 7994 121.791 59.883 125.628 1.00 0.00 O ATOM 1654 H1 WAT 7994 121.243 59.122 125.437 1.00 0.00 H ATOM 1655 H2 WAT 7994 121.448 60.573 125.059 1.00 0.00 H TER 1657 WAT 7994 ATOM 1657 O WAT 7995 107.992 125.612 79.366 1.00 0.00 O ATOM 1658 H1 WAT 7995 108.704 125.815 79.973 1.00 0.00 H ATOM 1659 H2 WAT 7995 108.325 124.885 78.841 1.00 0.00 H TER 1661 WAT 7995 ATOM 1661 O WAT 7996 88.093 94.932 133.697 1.00 0.00 O ATOM 1662 H1 WAT 7996 87.915 95.166 134.608 1.00 0.00 H ATOM 1663 H2 WAT 7996 87.250 94.632 133.357 1.00 0.00 H TER 1665 WAT 7996 ATOM 1665 O WAT 7997 105.893 116.550 14.874 1.00 0.00 O ATOM 1666 H1 WAT 7997 105.827 117.115 15.644 1.00 0.00 H ATOM 1667 H2 WAT 7997 105.476 115.731 15.142 1.00 0.00 H TER 1669 WAT 7997 ATOM 1669 O WAT 7998 21.589 5.305 82.397 1.00 0.00 O ATOM 1670 H1 WAT 7998 21.144 4.581 82.837 1.00 0.00 H ATOM 1671 H2 WAT 7998 20.895 5.755 81.914 1.00 0.00 H TER 1673 WAT 7998 ATOM 1673 O WAT 7999 60.616 54.531 18.659 1.00 0.00 O ATOM 1674 H1 WAT 7999 60.251 53.646 18.633 1.00 0.00 H ATOM 1675 H2 WAT 7999 61.504 54.413 18.995 1.00 0.00 H TER 1677 WAT 7999 ATOM 1677 O WAT 8000 5.064 25.829 67.107 1.00 0.00 O ATOM 1678 H1 WAT 8000 5.875 26.319 66.974 1.00 0.00 H ATOM 1679 H2 WAT 8000 4.844 25.489 66.240 1.00 0.00 H TER 1681 WAT 8000 ATOM 1681 O WAT 8001 41.137 58.623 76.375 1.00 0.00 O ATOM 1682 H1 WAT 8001 42.091 58.550 76.336 1.00 0.00 H ATOM 1683 H2 WAT 8001 40.890 58.126 77.155 1.00 0.00 H TER 1685 WAT 8001 ATOM 1685 O WAT 8002 79.461 69.462 134.085 1.00 0.00 O ATOM 1686 H1 WAT 8002 79.867 69.212 133.255 1.00 0.00 H ATOM 1687 H2 WAT 8002 78.615 69.013 134.083 1.00 0.00 H TER 1689 WAT 8002 ATOM 1689 O WAT 8003 63.524 39.572 109.637 1.00 0.00 O ATOM 1690 H1 WAT 8003 63.756 38.924 108.971 1.00 0.00 H ATOM 1691 H2 WAT 8003 62.789 39.179 110.108 1.00 0.00 H TER 1693 WAT 8003 ATOM 1693 O WAT 8004 73.013 6.844 21.158 1.00 0.00 O ATOM 1694 H1 WAT 8004 72.940 7.701 21.580 1.00 0.00 H ATOM 1695 H2 WAT 8004 72.247 6.793 20.587 1.00 0.00 H TER 1697 WAT 8004 ATOM 1697 O WAT 8005 137.832 128.667 5.205 1.00 0.00 O ATOM 1698 H1 WAT 8005 138.674 128.881 4.803 1.00 0.00 H ATOM 1699 H2 WAT 8005 137.997 128.714 6.147 1.00 0.00 H TER 1701 WAT 8005 ATOM 1701 O WAT 8006 72.039 104.453 113.044 1.00 0.00 O ATOM 1702 H1 WAT 8006 71.992 105.405 112.958 1.00 0.00 H ATOM 1703 H2 WAT 8006 72.841 104.210 112.581 1.00 0.00 H TER 1705 WAT 8006 ATOM 1705 O WAT 8007 49.060 58.365 23.481 1.00 0.00 O ATOM 1706 H1 WAT 8007 49.312 57.770 24.187 1.00 0.00 H ATOM 1707 H2 WAT 8007 49.177 59.240 23.852 1.00 0.00 H TER 1709 WAT 8007 ATOM 1709 O WAT 8008 113.316 111.715 102.740 1.00 0.00 O ATOM 1710 H1 WAT 8008 112.822 110.964 103.069 1.00 0.00 H ATOM 1711 H2 WAT 8008 114.030 111.826 103.367 1.00 0.00 H TER 1713 WAT 8008 ATOM 1713 O WAT 8009 10.809 75.817 102.554 1.00 0.00 O ATOM 1714 H1 WAT 8009 10.964 76.762 102.573 1.00 0.00 H ATOM 1715 H2 WAT 8009 11.442 75.458 103.176 1.00 0.00 H TER 1717 WAT 8009 ATOM 1717 O WAT 8010 91.846 5.740 85.492 1.00 0.00 O ATOM 1718 H1 WAT 8010 91.515 5.023 84.952 1.00 0.00 H ATOM 1719 H2 WAT 8010 91.366 5.662 86.316 1.00 0.00 H TER 1721 WAT 8010 ATOM 1721 O WAT 8011 40.413 54.489 147.810 1.00 0.00 O ATOM 1722 H1 WAT 8011 40.344 55.400 148.094 1.00 0.00 H ATOM 1723 H2 WAT 8011 41.346 54.286 147.882 1.00 0.00 H TER 1725 WAT 8011 ATOM 1725 O WAT 8012 32.594 80.713 4.105 1.00 0.00 O ATOM 1726 H1 WAT 8012 32.596 81.371 4.799 1.00 0.00 H ATOM 1727 H2 WAT 8012 33.327 80.137 4.318 1.00 0.00 H TER 1729 WAT 8012 ATOM 1729 O WAT 8013 32.582 33.094 124.645 1.00 0.00 O ATOM 1730 H1 WAT 8013 33.073 33.518 123.941 1.00 0.00 H ATOM 1731 H2 WAT 8013 31.703 32.973 124.285 1.00 0.00 H TER 1733 WAT 8013 ATOM 1733 O WAT 8014 131.805 9.393 108.464 1.00 0.00 O ATOM 1734 H1 WAT 8014 131.012 9.882 108.245 1.00 0.00 H ATOM 1735 H2 WAT 8014 131.590 8.483 108.258 1.00 0.00 H TER 1737 WAT 8014 ATOM 1737 O WAT 8015 28.091 77.546 11.148 1.00 0.00 O ATOM 1738 H1 WAT 8015 27.827 78.044 11.921 1.00 0.00 H ATOM 1739 H2 WAT 8015 29.046 77.606 11.139 1.00 0.00 H TER 1741 WAT 8015 ATOM 1741 O WAT 8016 28.449 111.309 88.187 1.00 0.00 O ATOM 1742 H1 WAT 8016 28.750 111.070 87.310 1.00 0.00 H ATOM 1743 H2 WAT 8016 27.844 110.609 88.431 1.00 0.00 H TER 1745 WAT 8016 ATOM 1745 O WAT 8017 64.078 8.958 94.211 1.00 0.00 O ATOM 1746 H1 WAT 8017 64.119 9.395 93.360 1.00 0.00 H ATOM 1747 H2 WAT 8017 64.790 9.351 94.716 1.00 0.00 H TER 1749 WAT 8017 ATOM 1749 O WAT 8018 134.313 58.377 148.931 1.00 0.00 O ATOM 1750 H1 WAT 8018 133.953 57.563 149.283 1.00 0.00 H ATOM 1751 H2 WAT 8018 133.555 58.838 148.571 1.00 0.00 H TER 1753 WAT 8018 ATOM 1753 O WAT 8019 23.603 65.173 88.798 1.00 0.00 O ATOM 1754 H1 WAT 8019 23.276 64.919 87.935 1.00 0.00 H ATOM 1755 H2 WAT 8019 23.729 64.344 89.260 1.00 0.00 H TER 1757 WAT 8019 ATOM 1757 O WAT 8020 53.820 100.704 132.019 1.00 0.00 O ATOM 1758 H1 WAT 8020 54.764 100.700 131.864 1.00 0.00 H ATOM 1759 H2 WAT 8020 53.493 99.949 131.529 1.00 0.00 H TER 1761 WAT 8020 ATOM 1761 O WAT 8021 113.278 68.458 63.326 1.00 0.00 O ATOM 1762 H1 WAT 8021 114.054 68.055 62.936 1.00 0.00 H ATOM 1763 H2 WAT 8021 113.368 69.390 63.130 1.00 0.00 H TER 1765 WAT 8021 ATOM 1765 O WAT 8022 55.146 6.867 92.057 1.00 0.00 O ATOM 1766 H1 WAT 8022 55.453 5.999 91.794 1.00 0.00 H ATOM 1767 H2 WAT 8022 54.248 6.913 91.730 1.00 0.00 H TER 1769 WAT 8022 ATOM 1769 O WAT 8023 65.435 25.112 143.859 1.00 0.00 O ATOM 1770 H1 WAT 8023 64.844 25.860 143.948 1.00 0.00 H ATOM 1771 H2 WAT 8023 65.064 24.445 144.436 1.00 0.00 H TER 1773 WAT 8023 ATOM 1773 O WAT 8024 136.764 45.435 15.219 1.00 0.00 O ATOM 1774 H1 WAT 8024 136.033 44.841 15.047 1.00 0.00 H ATOM 1775 H2 WAT 8024 137.434 44.880 15.619 1.00 0.00 H TER 1777 WAT 8024 ATOM 1777 O WAT 8025 69.511 106.195 136.411 1.00 0.00 O ATOM 1778 H1 WAT 8025 70.132 106.321 137.129 1.00 0.00 H ATOM 1779 H2 WAT 8025 69.857 106.731 135.698 1.00 0.00 H TER 1781 WAT 8025 ATOM 1781 O WAT 8026 87.873 18.114 134.023 1.00 0.00 O ATOM 1782 H1 WAT 8026 87.558 17.973 134.915 1.00 0.00 H ATOM 1783 H2 WAT 8026 88.554 18.781 134.112 1.00 0.00 H TER 1785 WAT 8026 ATOM 1785 O WAT 8027 43.469 133.540 139.386 1.00 0.00 O ATOM 1786 H1 WAT 8027 42.764 134.002 139.840 1.00 0.00 H ATOM 1787 H2 WAT 8027 43.600 132.742 139.898 1.00 0.00 H TER 1789 WAT 8027 ATOM 1789 O WAT 8028 69.885 125.649 92.640 1.00 0.00 O ATOM 1790 H1 WAT 8028 69.740 126.023 93.510 1.00 0.00 H ATOM 1791 H2 WAT 8028 70.692 125.144 92.728 1.00 0.00 H TER 1793 WAT 8028 ATOM 1793 O WAT 8029 63.235 86.515 18.624 1.00 0.00 O ATOM 1794 H1 WAT 8029 63.172 86.654 19.569 1.00 0.00 H ATOM 1795 H2 WAT 8029 63.046 87.372 18.242 1.00 0.00 H TER 1797 WAT 8029 ATOM 1797 O WAT 8030 52.136 99.746 144.637 1.00 0.00 O ATOM 1798 H1 WAT 8030 51.984 100.690 144.590 1.00 0.00 H ATOM 1799 H2 WAT 8030 52.087 99.541 145.570 1.00 0.00 H TER 1801 WAT 8030 ATOM 1801 O WAT 8031 122.404 26.843 157.288 1.00 0.00 O ATOM 1802 H1 WAT 8031 121.766 26.227 157.648 1.00 0.00 H ATOM 1803 H2 WAT 8031 123.003 27.020 158.014 1.00 0.00 H TER 1805 WAT 8031 ATOM 1805 O WAT 8032 17.267 125.519 133.871 1.00 0.00 O ATOM 1806 H1 WAT 8032 17.819 126.285 133.713 1.00 0.00 H ATOM 1807 H2 WAT 8032 17.608 124.852 133.275 1.00 0.00 H TER 1809 WAT 8032 ATOM 1809 O WAT 8033 117.200 20.128 79.399 1.00 0.00 O ATOM 1810 H1 WAT 8033 117.825 20.379 80.079 1.00 0.00 H ATOM 1811 H2 WAT 8033 116.343 20.319 79.780 1.00 0.00 H TER 1813 WAT 8033 ATOM 1813 O WAT 8034 105.304 115.855 19.273 1.00 0.00 O ATOM 1814 H1 WAT 8034 105.635 116.315 20.045 1.00 0.00 H ATOM 1815 H2 WAT 8034 104.475 115.472 19.560 1.00 0.00 H TER 1817 WAT 8034 ATOM 1817 O WAT 8035 70.311 3.772 20.790 1.00 0.00 O ATOM 1818 H1 WAT 8035 69.517 3.968 21.287 1.00 0.00 H ATOM 1819 H2 WAT 8035 70.628 4.626 20.497 1.00 0.00 H TER 1821 WAT 8035 ATOM 1821 O WAT 8036 27.719 73.464 141.630 1.00 0.00 O ATOM 1822 H1 WAT 8036 26.925 73.629 141.121 1.00 0.00 H ATOM 1823 H2 WAT 8036 27.728 72.516 141.760 1.00 0.00 H TER 1825 WAT 8036 ATOM 1825 O WAT 8037 42.323 33.284 133.535 1.00 0.00 O ATOM 1826 H1 WAT 8037 42.514 33.803 132.754 1.00 0.00 H ATOM 1827 H2 WAT 8037 41.377 33.143 133.504 1.00 0.00 H TER 1829 WAT 8037 ATOM 1829 O WAT 8038 38.344 130.857 59.259 1.00 0.00 O ATOM 1830 H1 WAT 8038 38.812 131.273 59.983 1.00 0.00 H ATOM 1831 H2 WAT 8038 38.585 131.374 58.490 1.00 0.00 H TER 1833 WAT 8038 ATOM 1833 O WAT 8039 135.069 111.078 5.999 1.00 0.00 O ATOM 1834 H1 WAT 8039 134.918 110.136 6.077 1.00 0.00 H ATOM 1835 H2 WAT 8039 134.741 111.442 6.822 1.00 0.00 H TER 1837 WAT 8039 ATOM 1837 O WAT 8040 102.611 101.498 148.537 1.00 0.00 O ATOM 1838 H1 WAT 8040 102.773 100.988 149.331 1.00 0.00 H ATOM 1839 H2 WAT 8040 102.049 100.936 148.002 1.00 0.00 H TER 1841 WAT 8040 ATOM 1841 O WAT 8041 24.613 21.343 150.140 1.00 0.00 O ATOM 1842 H1 WAT 8041 23.924 20.685 150.229 1.00 0.00 H ATOM 1843 H2 WAT 8041 25.343 20.997 150.653 1.00 0.00 H TER 1845 WAT 8041 ATOM 1845 O WAT 8042 64.162 75.727 136.058 1.00 0.00 O ATOM 1846 H1 WAT 8042 63.679 74.998 136.448 1.00 0.00 H ATOM 1847 H2 WAT 8042 63.991 75.653 135.119 1.00 0.00 H TER 1849 WAT 8042 ATOM 1849 O WAT 8043 54.900 0.653 9.241 1.00 0.00 O ATOM 1850 H1 WAT 8043 55.434 1.395 8.957 1.00 0.00 H ATOM 1851 H2 WAT 8043 54.711 0.173 8.434 1.00 0.00 H TER 1853 WAT 8043 ATOM 1853 O WAT 8044 111.482 118.752 91.597 1.00 0.00 O ATOM 1854 H1 WAT 8044 110.847 119.216 92.143 1.00 0.00 H ATOM 1855 H2 WAT 8044 111.571 117.894 92.010 1.00 0.00 H TER 1857 WAT 8044 ATOM 1857 O WAT 8045 129.789 121.553 153.596 1.00 0.00 O ATOM 1858 H1 WAT 8045 129.069 120.923 153.575 1.00 0.00 H ATOM 1859 H2 WAT 8045 129.992 121.715 152.674 1.00 0.00 H TER 1861 WAT 8045 ATOM 1861 O WAT 8046 127.991 75.943 12.877 1.00 0.00 O ATOM 1862 H1 WAT 8046 127.395 76.196 13.583 1.00 0.00 H ATOM 1863 H2 WAT 8046 128.567 76.700 12.768 1.00 0.00 H TER 1865 WAT 8046 ATOM 1865 O WAT 8047 62.819 125.781 136.139 1.00 0.00 O ATOM 1866 H1 WAT 8047 63.430 125.376 135.524 1.00 0.00 H ATOM 1867 H2 WAT 8047 63.374 126.298 136.723 1.00 0.00 H TER 1869 WAT 8047 ATOM 1869 O WAT 8048 94.379 66.488 126.738 1.00 0.00 O ATOM 1870 H1 WAT 8048 94.868 65.701 126.498 1.00 0.00 H ATOM 1871 H2 WAT 8048 93.947 66.758 125.927 1.00 0.00 H TER 1873 WAT 8048 ATOM 1873 O WAT 8049 103.008 68.876 92.474 1.00 0.00 O ATOM 1874 H1 WAT 8049 102.595 68.517 93.259 1.00 0.00 H ATOM 1875 H2 WAT 8049 102.351 69.469 92.108 1.00 0.00 H TER 1877 WAT 8049 ATOM 1877 O WAT 8050 10.337 55.482 119.991 1.00 0.00 O ATOM 1878 H1 WAT 8050 10.208 54.605 119.631 1.00 0.00 H ATOM 1879 H2 WAT 8050 10.410 56.048 119.223 1.00 0.00 H TER 1881 WAT 8050 ATOM 1881 O WAT 8051 66.002 74.896 113.040 1.00 0.00 O ATOM 1882 H1 WAT 8051 66.310 75.789 113.199 1.00 0.00 H ATOM 1883 H2 WAT 8051 65.796 74.556 113.911 1.00 0.00 H TER 1885 WAT 8051 ATOM 1885 O WAT 8052 86.600 119.434 125.644 1.00 0.00 O ATOM 1886 H1 WAT 8052 87.470 119.446 125.244 1.00 0.00 H ATOM 1887 H2 WAT 8052 86.032 119.845 124.993 1.00 0.00 H TER 1889 WAT 8052 ATOM 1889 O WAT 8053 110.096 34.378 132.919 1.00 0.00 O ATOM 1890 H1 WAT 8053 110.838 33.923 133.318 1.00 0.00 H ATOM 1891 H2 WAT 8053 110.492 34.958 132.269 1.00 0.00 H TER 1893 WAT 8053 ATOM 1893 O WAT 8054 130.216 122.047 97.613 1.00 0.00 O ATOM 1894 H1 WAT 8054 129.497 122.524 98.027 1.00 0.00 H ATOM 1895 H2 WAT 8054 130.966 122.200 98.187 1.00 0.00 H TER 1897 WAT 8054 ATOM 1897 O WAT 8055 55.514 47.542 146.298 1.00 0.00 O ATOM 1898 H1 WAT 8055 55.889 46.849 145.755 1.00 0.00 H ATOM 1899 H2 WAT 8055 55.891 47.397 147.166 1.00 0.00 H TER 1901 WAT 8055 ATOM 1901 O WAT 8056 75.548 24.266 61.933 1.00 0.00 O ATOM 1902 H1 WAT 8056 76.205 24.402 61.249 1.00 0.00 H ATOM 1903 H2 WAT 8056 75.398 23.320 61.935 1.00 0.00 H TER 1905 WAT 8056 ATOM 1905 O WAT 8057 42.165 125.217 126.165 1.00 0.00 O ATOM 1906 H1 WAT 8057 42.065 124.867 127.050 1.00 0.00 H ATOM 1907 H2 WAT 8057 43.029 125.630 126.167 1.00 0.00 H TER 1909 WAT 8057 ATOM 1909 O WAT 8058 7.706 50.186 75.581 1.00 0.00 O ATOM 1910 H1 WAT 8058 8.506 49.781 75.245 1.00 0.00 H ATOM 1911 H2 WAT 8058 7.739 51.086 75.257 1.00 0.00 H TER 1913 WAT 8058 ATOM 1913 O WAT 8059 77.529 61.796 79.027 1.00 0.00 O ATOM 1914 H1 WAT 8059 77.789 61.197 78.327 1.00 0.00 H ATOM 1915 H2 WAT 8059 77.558 62.663 78.623 1.00 0.00 H TER 1917 WAT 8059 ATOM 1917 O WAT 8060 15.063 84.231 122.947 1.00 0.00 O ATOM 1918 H1 WAT 8060 14.932 83.428 123.451 1.00 0.00 H ATOM 1919 H2 WAT 8060 15.846 84.061 122.424 1.00 0.00 H TER 1921 WAT 8060 ATOM 1921 O WAT 8061 32.821 110.812 144.768 1.00 0.00 O ATOM 1922 H1 WAT 8061 32.844 111.768 144.736 1.00 0.00 H ATOM 1923 H2 WAT 8061 33.622 110.569 145.232 1.00 0.00 H TER 1925 WAT 8061 ATOM 1925 O WAT 8062 95.840 50.455 117.494 1.00 0.00 O ATOM 1926 H1 WAT 8062 95.991 51.382 117.677 1.00 0.00 H ATOM 1927 H2 WAT 8062 95.486 50.104 118.311 1.00 0.00 H TER 1929 WAT 8062 ATOM 1929 O WAT 8063 105.736 99.617 141.731 1.00 0.00 O ATOM 1930 H1 WAT 8063 105.324 99.044 141.085 1.00 0.00 H ATOM 1931 H2 WAT 8063 105.524 100.503 141.435 1.00 0.00 H TER 1933 WAT 8063 ATOM 1933 O WAT 8064 140.689 27.477 18.540 1.00 0.00 O ATOM 1934 H1 WAT 8064 141.617 27.632 18.367 1.00 0.00 H ATOM 1935 H2 WAT 8064 140.233 28.122 17.999 1.00 0.00 H TER 1937 WAT 8064 ATOM 1937 O WAT 8065 28.558 138.897 10.130 1.00 0.00 O ATOM 1938 H1 WAT 8065 28.135 139.613 9.657 1.00 0.00 H ATOM 1939 H2 WAT 8065 28.551 139.177 11.045 1.00 0.00 H TER 1941 WAT 8065 ATOM 1941 O WAT 8066 36.732 85.201 117.982 1.00 0.00 O ATOM 1942 H1 WAT 8066 37.164 85.900 117.491 1.00 0.00 H ATOM 1943 H2 WAT 8066 37.011 85.336 118.887 1.00 0.00 H TER 1945 WAT 8066 ATOM 1945 O WAT 8067 71.401 75.096 86.539 1.00 0.00 O ATOM 1946 H1 WAT 8067 72.071 75.407 85.930 1.00 0.00 H ATOM 1947 H2 WAT 8067 71.004 75.895 86.887 1.00 0.00 H TER 1949 WAT 8067 ATOM 1949 O WAT 8068 7.343 37.560 17.203 1.00 0.00 O ATOM 1950 H1 WAT 8068 8.136 37.897 17.619 1.00 0.00 H ATOM 1951 H2 WAT 8068 6.832 38.341 16.992 1.00 0.00 H TER 1953 WAT 8068 ATOM 1953 O WAT 8069 15.972 71.418 103.316 1.00 0.00 O ATOM 1954 H1 WAT 8069 15.876 72.289 102.928 1.00 0.00 H ATOM 1955 H2 WAT 8069 16.913 71.322 103.459 1.00 0.00 H TER 1957 WAT 8069 ATOM 1957 O WAT 8070 66.228 135.302 4.326 1.00 0.00 O ATOM 1958 H1 WAT 8070 66.381 134.414 4.647 1.00 0.00 H ATOM 1959 H2 WAT 8070 66.807 135.851 4.854 1.00 0.00 H TER 1961 WAT 8070 ATOM 1961 O WAT 8071 67.790 70.496 153.328 1.00 0.00 O ATOM 1962 H1 WAT 8071 68.440 69.794 153.366 1.00 0.00 H ATOM 1963 H2 WAT 8071 68.168 71.141 152.730 1.00 0.00 H TER 1965 WAT 8071 ATOM 1965 O WAT 8072 5.869 19.036 123.119 1.00 0.00 O ATOM 1966 H1 WAT 8072 6.509 18.332 123.221 1.00 0.00 H ATOM 1967 H2 WAT 8072 6.296 19.665 122.538 1.00 0.00 H TER 1969 WAT 8072 ATOM 1969 O WAT 8073 85.313 42.178 1.989 1.00 0.00 O ATOM 1970 H1 WAT 8073 84.471 42.633 2.027 1.00 0.00 H ATOM 1971 H2 WAT 8073 85.943 42.860 1.757 1.00 0.00 H TER 1973 WAT 8073 ATOM 1973 O WAT 8074 94.925 70.556 152.211 1.00 0.00 O ATOM 1974 H1 WAT 8074 95.266 71.081 152.935 1.00 0.00 H ATOM 1975 H2 WAT 8074 94.355 69.912 152.630 1.00 0.00 H TER 1977 WAT 8074 ATOM 1977 O WAT 8075 72.226 145.352 57.432 1.00 0.00 O ATOM 1978 H1 WAT 8075 72.068 144.628 56.827 1.00 0.00 H ATOM 1979 H2 WAT 8075 71.453 145.910 57.345 1.00 0.00 H TER 1981 WAT 8075 ATOM 1981 O WAT 8076 81.795 23.474 145.596 1.00 0.00 O ATOM 1982 H1 WAT 8076 81.641 22.536 145.713 1.00 0.00 H ATOM 1983 H2 WAT 8076 82.529 23.521 144.983 1.00 0.00 H TER 1985 WAT 8076 ATOM 1985 O WAT 8077 4.901 4.205 86.176 1.00 0.00 O ATOM 1986 H1 WAT 8077 3.995 4.484 86.306 1.00 0.00 H ATOM 1987 H2 WAT 8077 4.861 3.594 85.441 1.00 0.00 H TER 1989 WAT 8077 ATOM 1989 O WAT 8078 129.135 138.617 99.251 1.00 0.00 O ATOM 1990 H1 WAT 8078 128.748 138.584 98.376 1.00 0.00 H ATOM 1991 H2 WAT 8078 129.063 139.536 99.510 1.00 0.00 H TER 1993 WAT 8078 ATOM 1993 O WAT 8079 95.039 76.449 110.191 1.00 0.00 O ATOM 1994 H1 WAT 8079 94.698 76.756 109.351 1.00 0.00 H ATOM 1995 H2 WAT 8079 95.719 77.083 110.420 1.00 0.00 H TER 1997 WAT 8079 ATOM 1997 O WAT 8080 18.276 28.109 100.376 1.00 0.00 O ATOM 1998 H1 WAT 8080 18.189 28.240 101.320 1.00 0.00 H ATOM 1999 H2 WAT 8080 18.211 27.162 100.258 1.00 0.00 H TER 2001 WAT 8080 ATOM 2001 O WAT 8081 44.172 15.186 88.517 1.00 0.00 O ATOM 2002 H1 WAT 8081 44.024 14.686 89.319 1.00 0.00 H ATOM 2003 H2 WAT 8081 43.501 15.869 88.533 1.00 0.00 H TER 2005 WAT 8081 ATOM 2005 O WAT 8082 2.712 20.196 20.850 1.00 0.00 O ATOM 2006 H1 WAT 8082 2.773 19.437 21.430 1.00 0.00 H ATOM 2007 H2 WAT 8082 3.116 19.905 20.032 1.00 0.00 H TER 2009 WAT 8082 ATOM 2009 O WAT 8083 93.944 100.773 21.593 1.00 0.00 O ATOM 2010 H1 WAT 8083 94.891 100.881 21.500 1.00 0.00 H ATOM 2011 H2 WAT 8083 93.824 100.493 22.501 1.00 0.00 H TER 2013 WAT 8083 ATOM 2013 O WAT 8084 104.780 82.085 14.371 1.00 0.00 O ATOM 2014 H1 WAT 8084 105.393 81.410 14.079 1.00 0.00 H ATOM 2015 H2 WAT 8084 104.203 82.225 13.619 1.00 0.00 H TER 2017 WAT 8084 ATOM 2017 O WAT 8085 140.615 89.229 91.512 1.00 0.00 O ATOM 2018 H1 WAT 8085 140.387 89.962 92.084 1.00 0.00 H ATOM 2019 H2 WAT 8085 140.569 89.593 90.627 1.00 0.00 H TER 2021 WAT 8085 ATOM 2021 O WAT 8086 114.837 110.257 146.599 1.00 0.00 O ATOM 2022 H1 WAT 8086 115.125 111.014 147.109 1.00 0.00 H ATOM 2023 H2 WAT 8086 115.114 110.451 145.704 1.00 0.00 H TER 2025 WAT 8086 ATOM 2025 O WAT 8087 82.778 32.594 56.241 1.00 0.00 O ATOM 2026 H1 WAT 8087 82.369 31.868 56.711 1.00 0.00 H ATOM 2027 H2 WAT 8087 82.043 33.121 55.929 1.00 0.00 H TER 2029 WAT 8087 ATOM 2029 O WAT 8088 60.664 136.544 121.827 1.00 0.00 O ATOM 2030 H1 WAT 8088 60.002 137.234 121.847 1.00 0.00 H ATOM 2031 H2 WAT 8088 60.908 136.471 120.904 1.00 0.00 H TER 2033 WAT 8088 ATOM 2033 O WAT 8089 139.378 78.004 157.670 1.00 0.00 O ATOM 2034 H1 WAT 8089 139.589 78.689 158.305 1.00 0.00 H ATOM 2035 H2 WAT 8089 138.425 78.039 157.588 1.00 0.00 H TER 2037 WAT 8089 ATOM 2037 O WAT 8090 67.782 115.553 147.856 1.00 0.00 O ATOM 2038 H1 WAT 8090 67.500 115.766 148.746 1.00 0.00 H ATOM 2039 H2 WAT 8090 67.571 116.334 147.345 1.00 0.00 H TER 2041 WAT 8090 ATOM 2041 O WAT 8091 85.821 111.109 22.974 1.00 0.00 O ATOM 2042 H1 WAT 8091 85.645 111.038 23.912 1.00 0.00 H ATOM 2043 H2 WAT 8091 85.437 110.317 22.597 1.00 0.00 H TER 2045 WAT 8091 ATOM 2045 O WAT 8092 76.422 8.177 82.899 1.00 0.00 O ATOM 2046 H1 WAT 8092 75.621 8.202 83.424 1.00 0.00 H ATOM 2047 H2 WAT 8092 77.016 7.613 83.396 1.00 0.00 H TER 2049 WAT 8092 ATOM 2049 O WAT 8093 13.056 11.551 10.906 1.00 0.00 O ATOM 2050 H1 WAT 8093 13.141 11.157 10.038 1.00 0.00 H ATOM 2051 H2 WAT 8093 12.182 11.939 10.908 1.00 0.00 H TER 2053 WAT 8093 ATOM 2053 O WAT 8094 85.417 41.462 77.564 1.00 0.00 O ATOM 2054 H1 WAT 8094 85.009 42.283 77.291 1.00 0.00 H ATOM 2055 H2 WAT 8094 85.021 40.798 76.999 1.00 0.00 H TER 2057 WAT 8094 ATOM 2057 O WAT 8095 141.882 86.161 124.488 1.00 0.00 O ATOM 2058 H1 WAT 8095 142.547 85.819 125.085 1.00 0.00 H ATOM 2059 H2 WAT 8095 142.337 86.252 123.650 1.00 0.00 H TER 2061 WAT 8095 ATOM 2061 O WAT 8096 42.998 52.630 20.280 1.00 0.00 O ATOM 2062 H1 WAT 8096 43.908 52.582 19.985 1.00 0.00 H ATOM 2063 H2 WAT 8096 42.534 52.001 19.728 1.00 0.00 H TER 2065 WAT 8096 ATOM 2065 O WAT 8097 7.194 81.752 137.316 1.00 0.00 O ATOM 2066 H1 WAT 8097 7.110 82.420 136.636 1.00 0.00 H ATOM 2067 H2 WAT 8097 8.133 81.715 137.502 1.00 0.00 H TER 2069 WAT 8097 ATOM 2069 O WAT 8098 5.278 108.298 114.453 1.00 0.00 O ATOM 2070 H1 WAT 8098 4.694 108.215 113.699 1.00 0.00 H ATOM 2071 H2 WAT 8098 4.947 107.659 115.084 1.00 0.00 H TER 2073 WAT 8098 ATOM 2073 O WAT 8099 36.969 117.104 10.724 1.00 0.00 O ATOM 2074 H1 WAT 8099 37.273 117.622 11.469 1.00 0.00 H ATOM 2075 H2 WAT 8099 36.190 116.652 11.049 1.00 0.00 H TER 2077 WAT 8099 ATOM 2077 O WAT 8100 1.221 11.960 14.496 1.00 0.00 O ATOM 2078 H1 WAT 8100 0.732 11.573 13.770 1.00 0.00 H ATOM 2079 H2 WAT 8100 1.490 11.212 15.029 1.00 0.00 H TER 2081 WAT 8100 ATOM 2081 O WAT 8101 132.011 130.116 141.517 1.00 0.00 O ATOM 2082 H1 WAT 8101 131.825 130.735 142.223 1.00 0.00 H ATOM 2083 H2 WAT 8101 131.899 129.254 141.917 1.00 0.00 H TER 2085 WAT 8101 ATOM 2085 O WAT 8102 91.128 86.128 121.649 1.00 0.00 O ATOM 2086 H1 WAT 8102 91.188 86.380 120.728 1.00 0.00 H ATOM 2087 H2 WAT 8102 91.301 86.937 122.130 1.00 0.00 H TER 2089 WAT 8102 ATOM 2089 O WAT 8103 21.884 130.994 15.249 1.00 0.00 O ATOM 2090 H1 WAT 8103 21.817 130.050 15.107 1.00 0.00 H ATOM 2091 H2 WAT 8103 22.364 131.318 14.487 1.00 0.00 H TER 2093 WAT 8103 ATOM 2093 O WAT 8104 86.713 67.128 102.605 1.00 0.00 O ATOM 2094 H1 WAT 8104 86.840 66.271 102.199 1.00 0.00 H ATOM 2095 H2 WAT 8104 86.349 66.932 103.469 1.00 0.00 H TER 2097 WAT 8104 ATOM 2097 O WAT 8105 56.800 52.895 97.437 1.00 0.00 O ATOM 2098 H1 WAT 8105 55.853 52.818 97.320 1.00 0.00 H ATOM 2099 H2 WAT 8105 57.168 52.611 96.600 1.00 0.00 H TER 2101 WAT 8105 ATOM 2101 O WAT 8106 34.128 136.986 64.850 1.00 0.00 O ATOM 2102 H1 WAT 8106 33.283 137.020 64.400 1.00 0.00 H ATOM 2103 H2 WAT 8106 33.916 137.145 65.770 1.00 0.00 H TER 2105 WAT 8106 ATOM 2105 O WAT 8107 132.465 62.468 72.220 1.00 0.00 O ATOM 2106 H1 WAT 8107 132.260 62.412 73.154 1.00 0.00 H ATOM 2107 H2 WAT 8107 132.121 63.319 71.950 1.00 0.00 H TER 2109 WAT 8107 ATOM 2109 O WAT 8108 22.555 31.937 68.303 1.00 0.00 O ATOM 2110 H1 WAT 8108 21.733 32.107 67.844 1.00 0.00 H ATOM 2111 H2 WAT 8108 23.234 32.112 67.650 1.00 0.00 H TER 2113 WAT 8108 ATOM 2113 O WAT 8109 107.345 106.844 136.469 1.00 0.00 O ATOM 2114 H1 WAT 8109 107.917 107.422 136.973 1.00 0.00 H ATOM 2115 H2 WAT 8109 106.849 106.361 137.131 1.00 0.00 H TER 2117 WAT 8109 ATOM 2117 O WAT 8110 123.971 41.401 6.143 1.00 0.00 O ATOM 2118 H1 WAT 8110 123.259 41.994 5.902 1.00 0.00 H ATOM 2119 H2 WAT 8110 124.747 41.777 5.727 1.00 0.00 H TER 2121 WAT 8110 ATOM 2121 O WAT 8111 58.086 120.293 72.491 1.00 0.00 O ATOM 2122 H1 WAT 8111 58.205 119.620 73.161 1.00 0.00 H ATOM 2123 H2 WAT 8111 58.962 120.655 72.356 1.00 0.00 H TER 2125 WAT 8111 ATOM 2125 O WAT 8112 14.022 6.211 138.635 1.00 0.00 O ATOM 2126 H1 WAT 8112 14.898 6.392 138.977 1.00 0.00 H ATOM 2127 H2 WAT 8112 13.992 6.674 137.798 1.00 0.00 H TER 2129 WAT 8112 ATOM 2129 O WAT 8113 2.511 78.548 85.289 1.00 0.00 O ATOM 2130 H1 WAT 8113 3.038 77.769 85.466 1.00 0.00 H ATOM 2131 H2 WAT 8113 2.125 78.773 86.135 1.00 0.00 H TER 2133 WAT 8113 ATOM 2133 O WAT 8114 132.447 142.076 62.732 1.00 0.00 O ATOM 2134 H1 WAT 8114 133.015 142.725 63.147 1.00 0.00 H ATOM 2135 H2 WAT 8114 132.576 142.210 61.794 1.00 0.00 H TER 2137 WAT 8114 ATOM 2137 O WAT 8115 51.683 45.780 14.245 1.00 0.00 O ATOM 2138 H1 WAT 8115 52.099 45.291 13.535 1.00 0.00 H ATOM 2139 H2 WAT 8115 52.104 45.454 15.040 1.00 0.00 H TER 2141 WAT 8115 ATOM 2141 O WAT 8116 100.114 91.068 157.050 1.00 0.00 O ATOM 2142 H1 WAT 8116 100.824 91.606 156.699 1.00 0.00 H ATOM 2143 H2 WAT 8116 99.868 91.500 157.868 1.00 0.00 H TER 2145 WAT 8116 ATOM 2145 O WAT 8117 19.190 11.706 100.875 1.00 0.00 O ATOM 2146 H1 WAT 8117 19.142 12.004 101.783 1.00 0.00 H ATOM 2147 H2 WAT 8117 19.888 11.052 100.873 1.00 0.00 H TER 2149 WAT 8117 ATOM 2149 O WAT 8118 139.780 12.156 10.256 1.00 0.00 O ATOM 2150 H1 WAT 8118 140.674 11.856 10.089 1.00 0.00 H ATOM 2151 H2 WAT 8118 139.460 11.580 10.951 1.00 0.00 H TER 2153 WAT 8118 ATOM 2153 O WAT 8119 51.336 28.890 114.700 1.00 0.00 O ATOM 2154 H1 WAT 8119 51.620 29.042 113.798 1.00 0.00 H ATOM 2155 H2 WAT 8119 51.901 29.454 115.228 1.00 0.00 H TER 2157 WAT 8119 ATOM 2157 O WAT 8120 57.523 102.450 61.979 1.00 0.00 O ATOM 2158 H1 WAT 8120 58.266 102.803 61.490 1.00 0.00 H ATOM 2159 H2 WAT 8120 57.582 102.866 62.839 1.00 0.00 H TER 2161 WAT 8120 ATOM 2161 O WAT 8121 16.280 136.217 10.622 1.00 0.00 O ATOM 2162 H1 WAT 8121 16.424 137.081 11.009 1.00 0.00 H ATOM 2163 H2 WAT 8121 16.012 136.399 9.722 1.00 0.00 H TER 2165 WAT 8121 ATOM 2165 O WAT 8122 19.616 49.801 107.297 1.00 0.00 O ATOM 2166 H1 WAT 8122 19.764 50.294 106.489 1.00 0.00 H ATOM 2167 H2 WAT 8122 19.582 50.469 107.982 1.00 0.00 H TER 2169 WAT 8122 ATOM 2169 O WAT 8123 111.673 107.393 73.640 1.00 0.00 O ATOM 2170 H1 WAT 8123 112.118 108.223 73.811 1.00 0.00 H ATOM 2171 H2 WAT 8123 112.360 106.818 73.303 1.00 0.00 H TER 2173 WAT 8123 ATOM 2173 O WAT 8124 55.945 138.855 5.233 1.00 0.00 O ATOM 2174 H1 WAT 8124 55.468 139.679 5.336 1.00 0.00 H ATOM 2175 H2 WAT 8124 55.292 138.240 4.900 1.00 0.00 H TER 2177 WAT 8124 ATOM 2177 O WAT 8125 143.896 39.139 155.700 1.00 0.00 O ATOM 2178 H1 WAT 8125 143.012 39.494 155.602 1.00 0.00 H ATOM 2179 H2 WAT 8125 143.764 38.202 155.844 1.00 0.00 H TER 2181 WAT 8125 ATOM 2181 O WAT 8126 98.179 145.405 134.063 1.00 0.00 O ATOM 2182 H1 WAT 8126 97.476 146.044 133.942 1.00 0.00 H ATOM 2183 H2 WAT 8126 97.885 144.861 134.793 1.00 0.00 H TER 2185 WAT 8126 ATOM 2185 O WAT 8127 38.318 46.576 111.112 1.00 0.00 O ATOM 2186 H1 WAT 8127 38.027 45.668 111.022 1.00 0.00 H ATOM 2187 H2 WAT 8127 38.289 46.926 110.222 1.00 0.00 H TER 2189 WAT 8127 ATOM 2189 O WAT 8128 62.765 24.628 76.364 1.00 0.00 O ATOM 2190 H1 WAT 8128 63.069 25.330 76.939 1.00 0.00 H ATOM 2191 H2 WAT 8128 61.840 24.522 76.583 1.00 0.00 H TER 2193 WAT 8128 ATOM 2193 O WAT 8129 95.993 46.950 152.157 1.00 0.00 O ATOM 2194 H1 WAT 8129 96.035 45.994 152.132 1.00 0.00 H ATOM 2195 H2 WAT 8129 96.889 47.234 151.974 1.00 0.00 H TER 2197 WAT 8129 ATOM 2197 O WAT 8130 12.214 63.648 133.344 1.00 0.00 O ATOM 2198 H1 WAT 8130 12.419 62.821 133.780 1.00 0.00 H ATOM 2199 H2 WAT 8130 12.887 64.255 133.652 1.00 0.00 H TER 2201 WAT 8130 ATOM 2201 O WAT 8131 72.814 88.653 69.207 1.00 0.00 O ATOM 2202 H1 WAT 8131 73.644 88.931 69.594 1.00 0.00 H ATOM 2203 H2 WAT 8131 72.709 89.212 68.437 1.00 0.00 H TER 2205 WAT 8131 ATOM 2205 O WAT 8132 144.681 43.006 20.321 1.00 0.00 O ATOM 2206 H1 WAT 8132 144.844 42.448 21.082 1.00 0.00 H ATOM 2207 H2 WAT 8132 144.407 42.399 19.634 1.00 0.00 H TER 2209 WAT 8132 ATOM 2209 O WAT 8133 71.647 113.924 63.822 1.00 0.00 O ATOM 2210 H1 WAT 8133 72.069 113.771 62.977 1.00 0.00 H ATOM 2211 H2 WAT 8133 71.227 113.090 64.035 1.00 0.00 H TER 2213 WAT 8133 ATOM 2213 O WAT 8134 10.185 59.685 92.740 1.00 0.00 O ATOM 2214 H1 WAT 8134 9.236 59.564 92.704 1.00 0.00 H ATOM 2215 H2 WAT 8134 10.411 59.533 93.657 1.00 0.00 H TER 2217 WAT 8134 ATOM 2217 O WAT 8135 132.713 2.945 145.016 1.00 0.00 O ATOM 2218 H1 WAT 8135 133.218 3.246 145.771 1.00 0.00 H ATOM 2219 H2 WAT 8135 132.333 3.743 144.649 1.00 0.00 H TER 2221 WAT 8135 ATOM 2221 O WAT 8136 110.424 87.699 97.712 1.00 0.00 O ATOM 2222 H1 WAT 8136 110.292 86.783 97.465 1.00 0.00 H ATOM 2223 H2 WAT 8136 109.554 88.004 97.970 1.00 0.00 H TER 2225 WAT 8136 ATOM 2225 O WAT 8137 56.000 57.649 103.450 1.00 0.00 O ATOM 2226 H1 WAT 8137 55.150 57.383 103.803 1.00 0.00 H ATOM 2227 H2 WAT 8137 56.639 57.173 103.981 1.00 0.00 H TER 2229 WAT 8137 ATOM 2229 O WAT 8138 69.457 91.085 57.503 1.00 0.00 O ATOM 2230 H1 WAT 8138 68.549 90.788 57.555 1.00 0.00 H ATOM 2231 H2 WAT 8138 69.952 90.301 57.265 1.00 0.00 H TER 2233 WAT 8138 ATOM 2233 O WAT 8139 120.187 76.996 76.425 1.00 0.00 O ATOM 2234 H1 WAT 8139 120.203 76.663 75.528 1.00 0.00 H ATOM 2235 H2 WAT 8139 121.067 77.347 76.566 1.00 0.00 H TER 2237 WAT 8139 ATOM 2237 O WAT 8140 100.656 140.574 87.962 1.00 0.00 O ATOM 2238 H1 WAT 8140 100.927 140.786 87.069 1.00 0.00 H ATOM 2239 H2 WAT 8140 100.194 139.740 87.880 1.00 0.00 H TER 2241 WAT 8140 ATOM 2241 O WAT 8141 73.830 44.768 134.935 1.00 0.00 O ATOM 2242 H1 WAT 8141 73.030 44.292 134.711 1.00 0.00 H ATOM 2243 H2 WAT 8141 74.455 44.086 135.181 1.00 0.00 H TER 2245 WAT 8141 ATOM 2245 O WAT 8142 48.510 64.130 70.100 1.00 0.00 O ATOM 2246 H1 WAT 8142 48.587 63.179 70.181 1.00 0.00 H ATOM 2247 H2 WAT 8142 48.785 64.465 70.953 1.00 0.00 H TER 2249 WAT 8142 ATOM 2249 O WAT 8143 78.136 8.319 103.481 1.00 0.00 O ATOM 2250 H1 WAT 8143 78.612 7.490 103.429 1.00 0.00 H ATOM 2251 H2 WAT 8143 77.701 8.399 102.632 1.00 0.00 H TER 2253 WAT 8143 ATOM 2253 O WAT 8144 101.115 115.132 156.836 1.00 0.00 O ATOM 2254 H1 WAT 8144 100.264 115.568 156.785 1.00 0.00 H ATOM 2255 H2 WAT 8144 101.069 114.440 156.176 1.00 0.00 H TER 2257 WAT 8144 ATOM 2257 O WAT 8145 53.961 15.473 0.728 1.00 0.00 O ATOM 2258 H1 WAT 8145 53.998 15.130 -0.164 1.00 0.00 H ATOM 2259 H2 WAT 8145 54.013 16.423 0.622 1.00 0.00 H TER 2261 WAT 8145 ATOM 2261 O WAT 8146 17.411 76.613 105.839 1.00 0.00 O ATOM 2262 H1 WAT 8146 18.359 76.496 105.906 1.00 0.00 H ATOM 2263 H2 WAT 8146 17.124 75.912 105.254 1.00 0.00 H TER 2265 WAT 8146 ATOM 2265 O WAT 8147 75.238 98.915 136.489 1.00 0.00 O ATOM 2266 H1 WAT 8147 75.282 98.341 135.724 1.00 0.00 H ATOM 2267 H2 WAT 8147 75.701 98.434 137.175 1.00 0.00 H TER 2269 WAT 8147 ATOM 2269 O WAT 8148 51.520 79.691 150.493 1.00 0.00 O ATOM 2270 H1 WAT 8148 51.888 79.280 151.275 1.00 0.00 H ATOM 2271 H2 WAT 8148 50.578 79.531 150.558 1.00 0.00 H TER 2273 WAT 8148 ATOM 2273 O WAT 8149 34.994 19.071 101.098 1.00 0.00 O ATOM 2274 H1 WAT 8149 34.588 18.205 101.132 1.00 0.00 H ATOM 2275 H2 WAT 8149 34.256 19.678 101.031 1.00 0.00 H TER 2277 WAT 8149 ATOM 2277 O WAT 8150 79.660 126.414 71.010 1.00 0.00 O ATOM 2278 H1 WAT 8150 79.022 125.704 71.089 1.00 0.00 H ATOM 2279 H2 WAT 8150 80.399 126.133 71.549 1.00 0.00 H TER 2281 WAT 8150 ATOM 2281 O WAT 8151 89.153 38.539 135.065 1.00 0.00 O ATOM 2282 H1 WAT 8151 89.239 39.293 135.648 1.00 0.00 H ATOM 2283 H2 WAT 8151 89.804 37.915 135.384 1.00 0.00 H TER 2285 WAT 8151 ATOM 2285 O WAT 8152 144.221 107.374 147.486 1.00 0.00 O ATOM 2286 H1 WAT 8152 143.394 106.911 147.618 1.00 0.00 H ATOM 2287 H2 WAT 8152 144.324 107.414 146.535 1.00 0.00 H TER 2289 WAT 8152 ATOM 2289 O WAT 8153 43.987 45.520 73.564 1.00 0.00 O ATOM 2290 H1 WAT 8153 43.671 46.422 73.612 1.00 0.00 H ATOM 2291 H2 WAT 8153 44.359 45.443 72.686 1.00 0.00 H TER 2293 WAT 8153 ATOM 2293 O WAT 8154 36.074 47.709 20.688 1.00 0.00 O ATOM 2294 H1 WAT 8154 35.139 47.834 20.850 1.00 0.00 H ATOM 2295 H2 WAT 8154 36.187 46.759 20.660 1.00 0.00 H TER 2297 WAT 8154 ATOM 2297 O WAT 8155 58.811 62.605 107.372 1.00 0.00 O ATOM 2298 H1 WAT 8155 58.335 63.419 107.206 1.00 0.00 H ATOM 2299 H2 WAT 8155 59.703 62.783 107.072 1.00 0.00 H TER 2301 WAT 8155 ATOM 2301 O WAT 8156 72.025 6.716 130.397 1.00 0.00 O ATOM 2302 H1 WAT 8156 71.340 6.296 129.876 1.00 0.00 H ATOM 2303 H2 WAT 8156 71.791 6.519 131.304 1.00 0.00 H TER 2305 WAT 8156 ATOM 2305 O WAT 8157 50.602 25.213 91.339 1.00 0.00 O ATOM 2306 H1 WAT 8157 50.600 24.882 92.237 1.00 0.00 H ATOM 2307 H2 WAT 8157 51.522 25.184 91.075 1.00 0.00 H TER 2309 WAT 8157 ATOM 2309 O WAT 8158 11.294 40.684 75.819 1.00 0.00 O ATOM 2310 H1 WAT 8158 11.982 40.292 76.356 1.00 0.00 H ATOM 2311 H2 WAT 8158 11.431 41.627 75.905 1.00 0.00 H TER 2313 WAT 8158 ATOM 2313 O WAT 8159 29.928 59.090 139.942 1.00 0.00 O ATOM 2314 H1 WAT 8159 29.896 58.139 140.045 1.00 0.00 H ATOM 2315 H2 WAT 8159 29.029 59.378 140.098 1.00 0.00 H TER 2317 WAT 8159 ATOM 2317 O WAT 8160 127.775 21.092 58.150 1.00 0.00 O ATOM 2318 H1 WAT 8160 127.402 21.928 57.872 1.00 0.00 H ATOM 2319 H2 WAT 8160 128.619 21.046 57.702 1.00 0.00 H TER 2321 WAT 8160 ATOM 2321 O WAT 8161 114.736 118.868 131.332 1.00 0.00 O ATOM 2322 H1 WAT 8161 113.889 118.566 131.006 1.00 0.00 H ATOM 2323 H2 WAT 8161 114.520 119.577 131.938 1.00 0.00 H TER 2325 WAT 8161 ATOM 2325 O WAT 8162 112.040 56.415 68.125 1.00 0.00 O ATOM 2326 H1 WAT 8162 111.846 55.515 68.390 1.00 0.00 H ATOM 2327 H2 WAT 8162 111.980 56.402 67.170 1.00 0.00 H TER 2329 WAT 8162 ATOM 2329 O WAT 8163 42.828 58.856 10.385 1.00 0.00 O ATOM 2330 H1 WAT 8163 42.454 59.522 9.807 1.00 0.00 H ATOM 2331 H2 WAT 8163 43.733 59.139 10.521 1.00 0.00 H TER 2333 WAT 8163 ATOM 2333 O WAT 8164 62.623 64.429 100.414 1.00 0.00 O ATOM 2334 H1 WAT 8164 63.131 64.142 101.172 1.00 0.00 H ATOM 2335 H2 WAT 8164 63.276 64.763 99.800 1.00 0.00 H TER 2337 WAT 8164 ATOM 2337 O WAT 8165 120.118 23.045 133.921 1.00 0.00 O ATOM 2338 H1 WAT 8165 119.678 23.714 133.397 1.00 0.00 H ATOM 2339 H2 WAT 8165 120.602 23.538 134.583 1.00 0.00 H TER 2341 WAT 8165 ATOM 2341 O WAT 8166 26.904 105.908 149.370 1.00 0.00 O ATOM 2342 H1 WAT 8166 27.236 106.791 149.533 1.00 0.00 H ATOM 2343 H2 WAT 8166 26.914 105.486 150.229 1.00 0.00 H TER 2345 WAT 8166 ATOM 2345 O WAT 8167 89.309 112.413 61.542 1.00 0.00 O ATOM 2346 H1 WAT 8167 89.363 111.580 61.074 1.00 0.00 H ATOM 2347 H2 WAT 8167 88.658 112.919 61.056 1.00 0.00 H TER 2349 WAT 8167 ATOM 2349 O WAT 8168 55.056 125.402 71.552 1.00 0.00 O ATOM 2350 H1 WAT 8168 55.188 126.106 72.187 1.00 0.00 H ATOM 2351 H2 WAT 8168 55.350 124.612 72.006 1.00 0.00 H TER 2353 WAT 8168 ATOM 2353 O WAT 8169 75.770 144.632 1.080 1.00 0.00 O ATOM 2354 H1 WAT 8169 75.870 144.637 0.128 1.00 0.00 H ATOM 2355 H2 WAT 8169 76.032 145.512 1.352 1.00 0.00 H TER 2357 WAT 8169 ATOM 2357 O WAT 8170 69.169 62.660 132.835 1.00 0.00 O ATOM 2358 H1 WAT 8170 68.323 62.275 133.063 1.00 0.00 H ATOM 2359 H2 WAT 8170 69.009 63.604 132.830 1.00 0.00 H TER 2361 WAT 8170 ATOM 2361 O WAT 8171 34.784 97.215 127.953 1.00 0.00 O ATOM 2362 H1 WAT 8171 34.252 96.868 127.236 1.00 0.00 H ATOM 2363 H2 WAT 8171 34.867 98.149 127.760 1.00 0.00 H TER 2365 WAT 8171 ATOM 2365 O WAT 8172 37.970 43.234 72.008 1.00 0.00 O ATOM 2366 H1 WAT 8172 38.281 43.516 71.148 1.00 0.00 H ATOM 2367 H2 WAT 8172 37.283 43.862 72.232 1.00 0.00 H TER 2369 WAT 8172 ATOM 2369 O WAT 8173 68.565 122.778 60.064 1.00 0.00 O ATOM 2370 H1 WAT 8173 68.099 123.447 59.563 1.00 0.00 H ATOM 2371 H2 WAT 8173 69.030 122.264 59.404 1.00 0.00 H TER 2373 WAT 8173 ATOM 2373 O WAT 8174 94.067 84.517 156.082 1.00 0.00 O ATOM 2374 H1 WAT 8174 94.532 84.248 155.290 1.00 0.00 H ATOM 2375 H2 WAT 8174 94.518 84.058 156.791 1.00 0.00 H TER 2377 WAT 8174 ATOM 2377 O WAT 8175 74.963 76.868 20.105 1.00 0.00 O ATOM 2378 H1 WAT 8175 74.459 76.912 20.917 1.00 0.00 H ATOM 2379 H2 WAT 8175 75.868 77.019 20.375 1.00 0.00 H TER 2381 WAT 8175 ATOM 2381 O WAT 8176 114.199 97.412 12.129 1.00 0.00 O ATOM 2382 H1 WAT 8176 113.365 97.596 12.561 1.00 0.00 H ATOM 2383 H2 WAT 8176 114.862 97.715 12.749 1.00 0.00 H TER 2385 WAT 8176 ATOM 2385 O WAT 8177 105.242 139.479 65.396 1.00 0.00 O ATOM 2386 H1 WAT 8177 105.128 140.263 64.858 1.00 0.00 H ATOM 2387 H2 WAT 8177 104.464 138.951 65.217 1.00 0.00 H TER 2389 WAT 8177 ATOM 2389 O WAT 8178 11.970 46.568 133.589 1.00 0.00 O ATOM 2390 H1 WAT 8178 11.559 47.119 132.923 1.00 0.00 H ATOM 2391 H2 WAT 8178 12.635 46.072 133.112 1.00 0.00 H TER 2393 WAT 8178 ATOM 2393 O WAT 8179 65.516 100.045 129.650 1.00 0.00 O ATOM 2394 H1 WAT 8179 65.862 99.240 130.036 1.00 0.00 H ATOM 2395 H2 WAT 8179 66.293 100.564 129.442 1.00 0.00 H TER 2397 WAT 8179 ATOM 2397 O WAT 8180 2.212 119.376 102.393 1.00 0.00 O ATOM 2398 H1 WAT 8180 1.950 119.873 101.617 1.00 0.00 H ATOM 2399 H2 WAT 8180 2.860 119.931 102.826 1.00 0.00 H TER 2401 WAT 8180 ATOM 2401 O WAT 8181 119.985 119.531 89.838 1.00 0.00 O ATOM 2402 H1 WAT 8181 120.863 119.736 89.518 1.00 0.00 H ATOM 2403 H2 WAT 8181 119.656 118.870 89.229 1.00 0.00 H TER 2405 WAT 8181 ATOM 2405 O WAT 8182 16.946 26.010 147.062 1.00 0.00 O ATOM 2406 H1 WAT 8182 17.551 25.285 146.905 1.00 0.00 H ATOM 2407 H2 WAT 8182 17.085 26.603 146.323 1.00 0.00 H TER 2409 WAT 8182 ATOM 2409 O WAT 8183 12.909 17.572 96.404 1.00 0.00 O ATOM 2410 H1 WAT 8183 13.464 17.953 97.084 1.00 0.00 H ATOM 2411 H2 WAT 8183 13.338 17.811 95.582 1.00 0.00 H TER 2413 WAT 8183 ATOM 2413 O WAT 8184 138.442 62.044 112.339 1.00 0.00 O ATOM 2414 H1 WAT 8184 138.828 61.599 113.094 1.00 0.00 H ATOM 2415 H2 WAT 8184 137.753 61.452 112.038 1.00 0.00 H TER 2417 WAT 8184 ATOM 2417 O WAT 8185 128.665 66.560 78.953 1.00 0.00 O ATOM 2418 H1 WAT 8185 129.091 67.403 79.108 1.00 0.00 H ATOM 2419 H2 WAT 8185 128.548 66.521 78.004 1.00 0.00 H TER 2421 WAT 8185 ATOM 2421 O WAT 8186 123.948 107.536 128.988 1.00 0.00 O ATOM 2422 H1 WAT 8186 123.257 107.046 129.432 1.00 0.00 H ATOM 2423 H2 WAT 8186 123.502 108.300 128.621 1.00 0.00 H TER 2425 WAT 8186 ATOM 2425 O WAT 8187 47.484 129.902 11.850 1.00 0.00 O ATOM 2426 H1 WAT 8187 47.355 129.651 10.936 1.00 0.00 H ATOM 2427 H2 WAT 8187 47.715 129.085 12.292 1.00 0.00 H TER 2429 WAT 8187 ATOM 2429 O WAT 8188 119.781 16.919 153.947 1.00 0.00 O ATOM 2430 H1 WAT 8188 119.063 17.536 153.804 1.00 0.00 H ATOM 2431 H2 WAT 8188 119.706 16.293 153.227 1.00 0.00 H TER 2433 WAT 8188 ATOM 2433 O WAT 8189 79.298 38.456 149.061 1.00 0.00 O ATOM 2434 H1 WAT 8189 80.090 38.994 149.075 1.00 0.00 H ATOM 2435 H2 WAT 8189 78.736 38.872 148.408 1.00 0.00 H TER 2437 WAT 8189 ATOM 2437 O WAT 8190 113.178 52.675 91.389 1.00 0.00 O ATOM 2438 H1 WAT 8190 112.734 52.292 92.145 1.00 0.00 H ATOM 2439 H2 WAT 8190 112.469 52.933 90.800 1.00 0.00 H TER 2441 WAT 8190 ATOM 2441 O WAT 8191 5.357 10.597 87.079 1.00 0.00 O ATOM 2442 H1 WAT 8191 5.865 11.407 87.127 1.00 0.00 H ATOM 2443 H2 WAT 8191 5.919 9.991 86.596 1.00 0.00 H TER 2445 WAT 8191 ATOM 2445 O WAT 8192 72.095 117.904 102.159 1.00 0.00 O ATOM 2446 H1 WAT 8192 71.402 117.297 101.900 1.00 0.00 H ATOM 2447 H2 WAT 8192 72.905 117.475 101.882 1.00 0.00 H TER 2449 WAT 8192 ATOM 2449 O WAT 8193 88.010 0.980 154.513 1.00 0.00 O ATOM 2450 H1 WAT 8193 87.676 1.782 154.112 1.00 0.00 H ATOM 2451 H2 WAT 8193 88.236 1.235 155.407 1.00 0.00 H TER 2453 WAT 8193 ATOM 2453 O WAT 8194 144.741 107.192 113.571 1.00 0.00 O ATOM 2454 H1 WAT 8194 143.897 107.641 113.536 1.00 0.00 H ATOM 2455 H2 WAT 8194 144.933 106.972 112.660 1.00 0.00 H TER 2457 WAT 8194 ATOM 2457 O WAT 8195 34.937 139.722 138.923 1.00 0.00 O ATOM 2458 H1 WAT 8195 35.478 139.176 139.494 1.00 0.00 H ATOM 2459 H2 WAT 8195 34.873 140.559 139.382 1.00 0.00 H TER 2461 WAT 8195 ATOM 2461 O WAT 8196 43.504 73.145 119.126 1.00 0.00 O ATOM 2462 H1 WAT 8196 42.956 72.468 119.523 1.00 0.00 H ATOM 2463 H2 WAT 8196 43.870 72.730 118.345 1.00 0.00 H TER 2465 WAT 8196 ATOM 2465 O WAT 8197 83.340 112.841 19.239 1.00 0.00 O ATOM 2466 H1 WAT 8197 83.599 113.697 19.580 1.00 0.00 H ATOM 2467 H2 WAT 8197 83.075 113.013 18.335 1.00 0.00 H TER 2469 WAT 8197 ATOM 2469 O WAT 8198 100.723 4.492 151.776 1.00 0.00 O ATOM 2470 H1 WAT 8198 100.366 5.287 152.173 1.00 0.00 H ATOM 2471 H2 WAT 8198 100.635 4.635 150.833 1.00 0.00 H TER 2473 WAT 8198 ATOM 2473 O WAT 8199 13.999 6.746 63.399 1.00 0.00 O ATOM 2474 H1 WAT 8199 14.854 6.520 63.032 1.00 0.00 H ATOM 2475 H2 WAT 8199 13.415 6.053 63.089 1.00 0.00 H TER 2477 WAT 8199 ATOM 2477 O WAT 8200 108.459 64.853 128.742 1.00 0.00 O ATOM 2478 H1 WAT 8200 109.023 64.115 128.973 1.00 0.00 H ATOM 2479 H2 WAT 8200 107.606 64.627 129.112 1.00 0.00 H TER 2481 WAT 8200 ATOM 2481 O WAT 8201 112.712 58.000 22.498 1.00 0.00 O ATOM 2482 H1 WAT 8201 112.955 58.443 23.311 1.00 0.00 H ATOM 2483 H2 WAT 8201 113.438 58.180 21.901 1.00 0.00 H TER 2485 WAT 8201 ATOM 2485 O WAT 8202 129.934 33.639 61.098 1.00 0.00 O ATOM 2486 H1 WAT 8202 129.403 32.854 61.234 1.00 0.00 H ATOM 2487 H2 WAT 8202 129.791 33.869 60.180 1.00 0.00 H TER 2489 WAT 8202 ATOM 2489 O WAT 8203 52.244 11.061 86.631 1.00 0.00 O ATOM 2490 H1 WAT 8203 52.016 10.155 86.420 1.00 0.00 H ATOM 2491 H2 WAT 8203 52.305 11.077 87.586 1.00 0.00 H TER 2493 WAT 8203 ATOM 2493 O WAT 8204 5.708 139.686 148.443 1.00 0.00 O ATOM 2494 H1 WAT 8204 6.042 140.449 147.971 1.00 0.00 H ATOM 2495 H2 WAT 8204 5.127 140.053 149.110 1.00 0.00 H TER 2497 WAT 8204 ATOM 2497 O WAT 8205 5.844 133.436 97.062 1.00 0.00 O ATOM 2498 H1 WAT 8205 5.348 133.297 96.256 1.00 0.00 H ATOM 2499 H2 WAT 8205 6.586 132.834 96.994 1.00 0.00 H TER 2501 WAT 8205 ATOM 2501 O WAT 8206 54.165 118.302 111.577 1.00 0.00 O ATOM 2502 H1 WAT 8206 53.989 119.183 111.909 1.00 0.00 H ATOM 2503 H2 WAT 8206 54.528 118.443 110.703 1.00 0.00 H TER 2505 WAT 8206 ATOM 2505 O WAT 8207 68.532 34.423 94.990 1.00 0.00 O ATOM 2506 H1 WAT 8207 68.775 33.520 94.786 1.00 0.00 H ATOM 2507 H2 WAT 8207 68.756 34.916 94.201 1.00 0.00 H TER 2509 WAT 8207 ATOM 2509 O WAT 8208 107.617 19.132 156.538 1.00 0.00 O ATOM 2510 H1 WAT 8208 107.360 19.465 155.678 1.00 0.00 H ATOM 2511 H2 WAT 8208 106.825 18.720 156.882 1.00 0.00 H TER 2513 WAT 8208 ATOM 2513 O WAT 8209 92.997 3.604 64.719 1.00 0.00 O ATOM 2514 H1 WAT 8209 93.059 3.336 65.636 1.00 0.00 H ATOM 2515 H2 WAT 8209 93.157 4.548 64.734 1.00 0.00 H TER 2517 WAT 8209 ATOM 2517 O WAT 8210 106.179 30.824 5.049 1.00 0.00 O ATOM 2518 H1 WAT 8210 105.452 30.751 5.668 1.00 0.00 H ATOM 2519 H2 WAT 8210 106.485 31.725 5.145 1.00 0.00 H TER 2521 WAT 8210 ATOM 2521 O WAT 8211 58.359 107.325 154.298 1.00 0.00 O ATOM 2522 H1 WAT 8211 58.973 106.598 154.404 1.00 0.00 H ATOM 2523 H2 WAT 8211 57.804 107.064 153.563 1.00 0.00 H TER 2525 WAT 8211 ATOM 2525 O WAT 8212 77.380 101.318 74.193 1.00 0.00 O ATOM 2526 H1 WAT 8212 77.929 101.259 74.975 1.00 0.00 H ATOM 2527 H2 WAT 8212 76.822 100.542 74.233 1.00 0.00 H TER 2529 WAT 8212 ATOM 2529 O WAT 8213 52.361 21.775 99.632 1.00 0.00 O ATOM 2530 H1 WAT 8213 52.909 21.138 99.175 1.00 0.00 H ATOM 2531 H2 WAT 8213 52.980 22.317 100.122 1.00 0.00 H TER 2533 WAT 8213 ATOM 2533 O WAT 8214 47.425 49.643 55.142 1.00 0.00 O ATOM 2534 H1 WAT 8214 46.992 50.454 55.406 1.00 0.00 H ATOM 2535 H2 WAT 8214 47.853 49.330 55.939 1.00 0.00 H TER 2537 WAT 8214 ATOM 2537 O WAT 8215 30.847 31.732 112.560 1.00 0.00 O ATOM 2538 H1 WAT 8215 30.864 30.861 112.956 1.00 0.00 H ATOM 2539 H2 WAT 8215 30.247 31.647 111.819 1.00 0.00 H TER 2541 WAT 8215 ATOM 2541 O WAT 8216 1.716 23.103 58.705 1.00 0.00 O ATOM 2542 H1 WAT 8216 2.451 22.903 58.125 1.00 0.00 H ATOM 2543 H2 WAT 8216 1.375 23.938 58.381 1.00 0.00 H TER 2545 WAT 8216 ATOM 2545 O WAT 8217 69.953 8.913 109.950 1.00 0.00 O ATOM 2546 H1 WAT 8217 69.636 9.728 109.561 1.00 0.00 H ATOM 2547 H2 WAT 8217 70.569 9.194 110.626 1.00 0.00 H TER 2549 WAT 8217 ATOM 2549 O WAT 8218 126.688 68.947 75.692 1.00 0.00 O ATOM 2550 H1 WAT 8218 126.188 69.660 75.294 1.00 0.00 H ATOM 2551 H2 WAT 8218 126.836 69.233 76.593 1.00 0.00 H TER 2553 WAT 8218 ATOM 2553 O WAT 8219 102.084 79.811 10.763 1.00 0.00 O ATOM 2554 H1 WAT 8219 101.458 80.142 10.118 1.00 0.00 H ATOM 2555 H2 WAT 8219 102.768 79.392 10.240 1.00 0.00 H TER 2557 WAT 8219 ATOM 2557 O WAT 8220 40.744 145.324 77.078 1.00 0.00 O ATOM 2558 H1 WAT 8220 40.645 145.225 76.131 1.00 0.00 H ATOM 2559 H2 WAT 8220 41.539 144.834 77.289 1.00 0.00 H TER 2561 WAT 8220 ATOM 2561 O WAT 8221 14.020 118.615 19.791 1.00 0.00 O ATOM 2562 H1 WAT 8221 14.693 117.982 19.542 1.00 0.00 H ATOM 2563 H2 WAT 8221 14.216 118.827 20.703 1.00 0.00 H TER 2565 WAT 8221 ATOM 2565 O WAT 8222 96.645 58.800 68.736 1.00 0.00 O ATOM 2566 H1 WAT 8222 97.209 58.123 68.362 1.00 0.00 H ATOM 2567 H2 WAT 8222 95.767 58.419 68.714 1.00 0.00 H TER 2569 WAT 8222 ATOM 2569 O WAT 8223 41.246 19.685 107.609 1.00 0.00 O ATOM 2570 H1 WAT 8223 41.514 20.400 108.188 1.00 0.00 H ATOM 2571 H2 WAT 8223 40.967 18.988 108.202 1.00 0.00 H TER 2573 WAT 8223 ATOM 2573 O WAT 8224 79.132 65.978 69.225 1.00 0.00 O ATOM 2574 H1 WAT 8224 79.734 66.314 68.562 1.00 0.00 H ATOM 2575 H2 WAT 8224 79.453 66.346 70.049 1.00 0.00 H TER 2577 WAT 8224 ATOM 2577 O WAT 8225 1.910 15.480 87.839 1.00 0.00 O ATOM 2578 H1 WAT 8225 0.988 15.224 87.847 1.00 0.00 H ATOM 2579 H2 WAT 8225 1.960 16.217 88.449 1.00 0.00 H TER 2581 WAT 8225 ATOM 2581 O WAT 8226 104.891 110.759 82.114 1.00 0.00 O ATOM 2582 H1 WAT 8226 104.622 111.667 81.971 1.00 0.00 H ATOM 2583 H2 WAT 8226 105.788 110.720 81.781 1.00 0.00 H TER 2585 WAT 8226 ATOM 2585 O WAT 8227 60.829 142.599 132.392 1.00 0.00 O ATOM 2586 H1 WAT 8227 61.737 142.829 132.586 1.00 0.00 H ATOM 2587 H2 WAT 8227 60.691 142.903 131.494 1.00 0.00 H TER 2589 WAT 8227 ATOM 2589 O WAT 8228 51.291 122.331 133.053 1.00 0.00 O ATOM 2590 H1 WAT 8228 50.897 121.555 133.451 1.00 0.00 H ATOM 2591 H2 WAT 8228 50.696 122.562 132.340 1.00 0.00 H TER 2593 WAT 8228 ATOM 2593 O WAT 8229 105.209 52.860 116.095 1.00 0.00 O ATOM 2594 H1 WAT 8229 105.742 52.169 115.703 1.00 0.00 H ATOM 2595 H2 WAT 8229 105.121 53.516 115.405 1.00 0.00 H TER 2597 WAT 8229 ATOM 2597 O WAT 8230 33.154 67.745 103.840 1.00 0.00 O ATOM 2598 H1 WAT 8230 32.239 67.948 103.648 1.00 0.00 H ATOM 2599 H2 WAT 8230 33.540 67.546 102.987 1.00 0.00 H TER 2601 WAT 8230 ATOM 2601 O WAT 8231 52.504 11.637 61.412 1.00 0.00 O ATOM 2602 H1 WAT 8231 52.022 12.457 61.519 1.00 0.00 H ATOM 2603 H2 WAT 8231 53.299 11.758 61.931 1.00 0.00 H TER 2605 WAT 8231 ATOM 2605 O WAT 8232 1.985 55.557 7.342 1.00 0.00 O ATOM 2606 H1 WAT 8232 2.891 55.349 7.113 1.00 0.00 H ATOM 2607 H2 WAT 8232 1.920 56.505 7.226 1.00 0.00 H TER 2609 WAT 8232 ATOM 2609 O WAT 8233 93.010 135.237 77.996 1.00 0.00 O ATOM 2610 H1 WAT 8233 93.882 135.173 78.385 1.00 0.00 H ATOM 2611 H2 WAT 8233 93.134 135.784 77.220 1.00 0.00 H TER 2613 WAT 8233 ATOM 2613 O WAT 8234 105.126 56.506 78.173 1.00 0.00 O ATOM 2614 H1 WAT 8234 104.773 56.744 79.030 1.00 0.00 H ATOM 2615 H2 WAT 8234 106.019 56.850 78.177 1.00 0.00 H TER 2617 WAT 8234 ATOM 2617 O WAT 8235 78.760 134.546 20.579 1.00 0.00 O ATOM 2618 H1 WAT 8235 79.244 135.186 21.102 1.00 0.00 H ATOM 2619 H2 WAT 8235 79.391 134.246 19.925 1.00 0.00 H TER 2621 WAT 8235 ATOM 2621 O WAT 8236 48.707 113.238 91.184 1.00 0.00 O ATOM 2622 H1 WAT 8236 48.221 112.717 91.822 1.00 0.00 H ATOM 2623 H2 WAT 8236 48.345 114.120 91.270 1.00 0.00 H TER 2625 WAT 8236 ATOM 2625 O WAT 8237 51.851 19.709 154.356 1.00 0.00 O ATOM 2626 H1 WAT 8237 52.196 19.464 155.214 1.00 0.00 H ATOM 2627 H2 WAT 8237 52.357 19.184 153.736 1.00 0.00 H TER 2629 WAT 8237 ATOM 2629 O WAT 8238 98.823 134.820 57.867 1.00 0.00 O ATOM 2630 H1 WAT 8238 97.918 134.798 58.178 1.00 0.00 H ATOM 2631 H2 WAT 8238 98.750 134.754 56.915 1.00 0.00 H TER 2633 WAT 8238 ATOM 2633 O WAT 8239 15.779 11.459 69.808 1.00 0.00 O ATOM 2634 H1 WAT 8239 15.359 11.970 69.117 1.00 0.00 H ATOM 2635 H2 WAT 8239 16.017 10.634 69.385 1.00 0.00 H TER 2637 WAT 8239 ATOM 2637 O WAT 8240 40.875 40.264 87.810 1.00 0.00 O ATOM 2638 H1 WAT 8240 40.350 40.922 87.355 1.00 0.00 H ATOM 2639 H2 WAT 8240 40.402 40.102 88.626 1.00 0.00 H TER 2641 WAT 8240 ATOM 2641 O WAT 8241 132.446 32.592 144.122 1.00 0.00 O ATOM 2642 H1 WAT 8241 133.164 32.264 143.580 1.00 0.00 H ATOM 2643 H2 WAT 8241 132.264 33.466 143.776 1.00 0.00 H TER 2645 WAT 8241 ATOM 2645 O WAT 8242 61.752 112.703 70.140 1.00 0.00 O ATOM 2646 H1 WAT 8242 61.759 113.660 70.121 1.00 0.00 H ATOM 2647 H2 WAT 8242 62.531 112.448 69.646 1.00 0.00 H TER 2649 WAT 8242 ATOM 2649 O WAT 8243 17.903 47.554 155.548 1.00 0.00 O ATOM 2650 H1 WAT 8243 18.669 48.127 155.565 1.00 0.00 H ATOM 2651 H2 WAT 8243 17.190 48.116 155.243 1.00 0.00 H TER 2653 WAT 8243 ATOM 2653 O WAT 8244 114.259 122.985 96.032 1.00 0.00 O ATOM 2654 H1 WAT 8244 113.771 123.615 95.501 1.00 0.00 H ATOM 2655 H2 WAT 8244 113.762 122.924 96.848 1.00 0.00 H TER 2657 WAT 8244 ATOM 2657 O WAT 8245 74.272 91.004 150.251 1.00 0.00 O ATOM 2658 H1 WAT 8245 73.430 91.278 150.616 1.00 0.00 H ATOM 2659 H2 WAT 8245 74.041 90.473 149.489 1.00 0.00 H TER 2661 WAT 8245 ATOM 2661 O WAT 8246 59.389 87.515 65.345 1.00 0.00 O ATOM 2662 H1 WAT 8246 59.858 87.219 64.565 1.00 0.00 H ATOM 2663 H2 WAT 8246 59.259 88.453 65.205 1.00 0.00 H TER 2665 WAT 8246 ATOM 2665 O WAT 8247 49.040 32.173 60.262 1.00 0.00 O ATOM 2666 H1 WAT 8247 48.199 32.058 60.705 1.00 0.00 H ATOM 2667 H2 WAT 8247 49.693 31.973 60.933 1.00 0.00 H TER 2669 WAT 8247 ATOM 2669 O WAT 8248 137.937 86.027 105.670 1.00 0.00 O ATOM 2670 H1 WAT 8248 138.725 86.043 106.213 1.00 0.00 H ATOM 2671 H2 WAT 8248 138.198 86.458 104.856 1.00 0.00 H TER 2673 WAT 8248 ATOM 2673 O WAT 8249 22.754 1.997 91.484 1.00 0.00 O ATOM 2674 H1 WAT 8249 22.184 2.078 92.248 1.00 0.00 H ATOM 2675 H2 WAT 8249 22.204 1.584 90.818 1.00 0.00 H TER 2677 WAT 8249 ATOM 2677 O WAT 8250 135.616 102.604 78.583 1.00 0.00 O ATOM 2678 H1 WAT 8250 135.990 101.788 78.251 1.00 0.00 H ATOM 2679 H2 WAT 8250 136.374 103.170 78.734 1.00 0.00 H TER 2681 WAT 8250 ATOM 2681 O WAT 8251 52.014 103.115 98.234 1.00 0.00 O ATOM 2682 H1 WAT 8251 52.842 102.636 98.273 1.00 0.00 H ATOM 2683 H2 WAT 8251 51.454 102.679 98.877 1.00 0.00 H TER 2685 WAT 8251 ATOM 2685 O WAT 8252 115.258 67.356 96.108 1.00 0.00 O ATOM 2686 H1 WAT 8252 115.295 68.226 96.507 1.00 0.00 H ATOM 2687 H2 WAT 8252 114.323 67.161 96.046 1.00 0.00 H TER 2689 WAT 8252 ATOM 2689 O WAT 8253 98.232 43.832 6.217 1.00 0.00 O ATOM 2690 H1 WAT 8253 98.901 43.273 5.823 1.00 0.00 H ATOM 2691 H2 WAT 8253 98.336 43.704 7.160 1.00 0.00 H TER 2693 WAT 8253 ATOM 2693 O WAT 8254 23.167 1.288 12.845 1.00 0.00 O ATOM 2694 H1 WAT 8254 22.980 2.016 13.438 1.00 0.00 H ATOM 2695 H2 WAT 8254 22.661 0.556 13.197 1.00 0.00 H TER 2697 WAT 8254 ATOM 2697 O WAT 8255 9.149 57.804 139.867 1.00 0.00 O ATOM 2698 H1 WAT 8255 8.283 58.098 139.585 1.00 0.00 H ATOM 2699 H2 WAT 8255 8.972 57.081 140.468 1.00 0.00 H TER 2701 WAT 8255 ATOM 2701 O WAT 8256 75.215 116.641 93.091 1.00 0.00 O ATOM 2702 H1 WAT 8256 76.049 116.205 92.915 1.00 0.00 H ATOM 2703 H2 WAT 8256 74.552 116.019 92.791 1.00 0.00 H TER 2705 WAT 8256 ATOM 2705 O WAT 8257 30.682 126.603 133.188 1.00 0.00 O ATOM 2706 H1 WAT 8257 30.446 126.544 134.114 1.00 0.00 H ATOM 2707 H2 WAT 8257 31.059 125.747 132.982 1.00 0.00 H TER 2709 WAT 8257 ATOM 2709 O WAT 8258 102.306 93.850 133.081 1.00 0.00 O ATOM 2710 H1 WAT 8258 102.016 94.503 132.444 1.00 0.00 H ATOM 2711 H2 WAT 8258 101.958 94.160 133.917 1.00 0.00 H TER 2713 WAT 8258 ATOM 2713 O WAT 8259 92.077 124.973 82.940 1.00 0.00 O ATOM 2714 H1 WAT 8259 92.930 124.557 82.819 1.00 0.00 H ATOM 2715 H2 WAT 8259 91.727 124.576 83.738 1.00 0.00 H TER 2717 WAT 8259 ATOM 2717 O WAT 8260 106.848 18.304 96.321 1.00 0.00 O ATOM 2718 H1 WAT 8260 107.343 19.044 96.672 1.00 0.00 H ATOM 2719 H2 WAT 8260 106.461 17.888 97.091 1.00 0.00 H TER 2721 WAT 8260 ATOM 2721 O WAT 8261 18.057 106.588 73.454 1.00 0.00 O ATOM 2722 H1 WAT 8261 18.948 106.835 73.206 1.00 0.00 H ATOM 2723 H2 WAT 8261 17.497 107.207 72.983 1.00 0.00 H TER 2725 WAT 8261 ATOM 2725 O WAT 8262 16.942 127.386 27.682 1.00 0.00 O ATOM 2726 H1 WAT 8262 17.328 126.931 28.431 1.00 0.00 H ATOM 2727 H2 WAT 8262 17.291 128.275 27.736 1.00 0.00 H TER 2729 WAT 8262 ATOM 2729 O WAT 8263 89.315 108.168 97.023 1.00 0.00 O ATOM 2730 H1 WAT 8263 89.937 107.562 97.427 1.00 0.00 H ATOM 2731 H2 WAT 8263 89.844 108.929 96.783 1.00 0.00 H TER 2733 WAT 8263 ATOM 2733 O WAT 8264 64.459 71.078 18.514 1.00 0.00 O ATOM 2734 H1 WAT 8264 63.691 70.595 18.208 1.00 0.00 H ATOM 2735 H2 WAT 8264 64.652 70.703 19.373 1.00 0.00 H TER 2737 WAT 8264 ATOM 2737 O WAT 8265 142.709 24.794 112.956 1.00 0.00 O ATOM 2738 H1 WAT 8265 142.728 24.296 112.139 1.00 0.00 H ATOM 2739 H2 WAT 8265 142.025 25.450 112.821 1.00 0.00 H TER 2741 WAT 8265 ATOM 2741 O WAT 8266 46.892 23.922 13.752 1.00 0.00 O ATOM 2742 H1 WAT 8266 47.371 24.409 13.081 1.00 0.00 H ATOM 2743 H2 WAT 8266 46.336 23.320 13.259 1.00 0.00 H TER 2745 WAT 8266 ATOM 2745 O WAT 8267 69.476 127.724 89.254 1.00 0.00 O ATOM 2746 H1 WAT 8267 69.048 128.070 90.037 1.00 0.00 H ATOM 2747 H2 WAT 8267 69.829 126.878 89.529 1.00 0.00 H TER 2749 WAT 8267 ATOM 2749 O WAT 8268 61.641 58.568 66.745 1.00 0.00 O ATOM 2750 H1 WAT 8268 60.736 58.801 66.952 1.00 0.00 H ATOM 2751 H2 WAT 8268 61.646 58.450 65.795 1.00 0.00 H TER 2753 WAT 8268 ATOM 2753 O WAT 8269 125.159 19.601 3.590 1.00 0.00 O ATOM 2754 H1 WAT 8269 125.419 19.304 4.462 1.00 0.00 H ATOM 2755 H2 WAT 8269 125.416 20.523 3.564 1.00 0.00 H TER 2757 WAT 8269 ATOM 2757 O WAT 8270 98.392 108.446 78.319 1.00 0.00 O ATOM 2758 H1 WAT 8270 99.012 109.030 77.883 1.00 0.00 H ATOM 2759 H2 WAT 8270 98.621 108.502 79.246 1.00 0.00 H TER 2761 WAT 8270 ATOM 2761 O WAT 8271 101.817 124.853 151.058 1.00 0.00 O ATOM 2762 H1 WAT 8271 100.943 124.463 151.032 1.00 0.00 H ATOM 2763 H2 WAT 8271 102.397 124.126 151.285 1.00 0.00 H TER 2765 WAT 8271 ATOM 2765 O WAT 8272 93.216 127.880 84.476 1.00 0.00 O ATOM 2766 H1 WAT 8272 93.370 128.771 84.162 1.00 0.00 H ATOM 2767 H2 WAT 8272 93.845 127.765 85.188 1.00 0.00 H TER 2769 WAT 8272 ATOM 2769 O WAT 8273 28.092 96.026 125.327 1.00 0.00 O ATOM 2770 H1 WAT 8273 28.197 96.143 126.272 1.00 0.00 H ATOM 2771 H2 WAT 8273 27.196 95.707 125.224 1.00 0.00 H TER 2773 WAT 8273 ATOM 2773 O WAT 8274 51.218 53.959 15.140 1.00 0.00 O ATOM 2774 H1 WAT 8274 50.983 54.839 15.435 1.00 0.00 H ATOM 2775 H2 WAT 8274 52.128 53.850 15.416 1.00 0.00 H TER 2777 WAT 8274 ATOM 2777 O WAT 8275 14.162 122.937 104.772 1.00 0.00 O ATOM 2778 H1 WAT 8275 13.271 122.633 104.947 1.00 0.00 H ATOM 2779 H2 WAT 8275 14.253 123.729 105.302 1.00 0.00 H TER 2781 WAT 8275 ATOM 2781 O WAT 8276 68.809 1.136 130.619 1.00 0.00 O ATOM 2782 H1 WAT 8276 68.838 1.758 129.891 1.00 0.00 H ATOM 2783 H2 WAT 8276 69.495 1.435 131.216 1.00 0.00 H TER 2785 WAT 8276 ATOM 2785 O WAT 8277 48.386 81.273 0.679 1.00 0.00 O ATOM 2786 H1 WAT 8277 48.657 82.133 0.360 1.00 0.00 H ATOM 2787 H2 WAT 8277 47.972 81.449 1.524 1.00 0.00 H TER 2789 WAT 8277 ATOM 2789 O WAT 8278 86.774 50.831 3.174 1.00 0.00 O ATOM 2790 H1 WAT 8278 87.422 51.108 2.526 1.00 0.00 H ATOM 2791 H2 WAT 8278 87.287 50.396 3.855 1.00 0.00 H TER 2793 WAT 8278 ATOM 2793 O WAT 8279 2.253 92.697 94.029 1.00 0.00 O ATOM 2794 H1 WAT 8279 1.470 92.173 94.195 1.00 0.00 H ATOM 2795 H2 WAT 8279 2.574 92.387 93.182 1.00 0.00 H TER 2797 WAT 8279 ATOM 2797 O WAT 8280 62.834 100.909 130.746 1.00 0.00 O ATOM 2798 H1 WAT 8280 63.653 100.432 130.878 1.00 0.00 H ATOM 2799 H2 WAT 8280 62.261 100.602 131.448 1.00 0.00 H TER 2801 WAT 8280 ATOM 2801 O WAT 8281 27.625 44.734 123.942 1.00 0.00 O ATOM 2802 H1 WAT 8281 26.715 44.993 123.802 1.00 0.00 H ATOM 2803 H2 WAT 8281 28.040 44.844 123.086 1.00 0.00 H TER 2805 WAT 8281 ATOM 2805 O WAT 8282 27.137 22.031 79.917 1.00 0.00 O ATOM 2806 H1 WAT 8282 27.857 21.405 79.991 1.00 0.00 H ATOM 2807 H2 WAT 8282 27.199 22.561 80.712 1.00 0.00 H TER 2809 WAT 8282 ATOM 2809 O WAT 8283 38.444 15.583 106.776 1.00 0.00 O ATOM 2810 H1 WAT 8283 37.931 15.292 107.530 1.00 0.00 H ATOM 2811 H2 WAT 8283 39.211 16.009 107.159 1.00 0.00 H TER 2813 WAT 8283 ATOM 2813 O WAT 8284 37.032 130.160 108.566 1.00 0.00 O ATOM 2814 H1 WAT 8284 36.424 129.595 108.090 1.00 0.00 H ATOM 2815 H2 WAT 8284 37.241 129.670 109.362 1.00 0.00 H TER 2817 WAT 8284 ATOM 2817 O WAT 8285 55.294 140.827 14.299 1.00 0.00 O ATOM 2818 H1 WAT 8285 55.833 140.056 14.122 1.00 0.00 H ATOM 2819 H2 WAT 8285 54.440 140.613 13.925 1.00 0.00 H TER 2821 WAT 8285 ATOM 2821 O WAT 8286 44.002 55.762 32.459 1.00 0.00 O ATOM 2822 H1 WAT 8286 44.789 55.858 31.924 1.00 0.00 H ATOM 2823 H2 WAT 8286 43.484 56.543 32.267 1.00 0.00 H TER 2825 WAT 8286 ATOM 2825 O WAT 8287 23.609 71.290 139.790 1.00 0.00 O ATOM 2826 H1 WAT 8287 24.187 70.981 140.488 1.00 0.00 H ATOM 2827 H2 WAT 8287 23.250 72.112 140.123 1.00 0.00 H TER 2829 WAT 8287 ATOM 2829 O WAT 8288 114.870 107.749 6.902 1.00 0.00 O ATOM 2830 H1 WAT 8288 114.132 108.311 6.667 1.00 0.00 H ATOM 2831 H2 WAT 8288 115.566 108.358 7.152 1.00 0.00 H TER 2833 WAT 8288 ATOM 2833 O WAT 8289 85.541 19.184 127.727 1.00 0.00 O ATOM 2834 H1 WAT 8289 85.018 19.010 126.945 1.00 0.00 H ATOM 2835 H2 WAT 8289 86.422 19.354 127.394 1.00 0.00 H TER 2837 WAT 8289 ATOM 2837 O WAT 8290 126.856 136.032 138.877 1.00 0.00 O ATOM 2838 H1 WAT 8290 126.903 135.223 139.386 1.00 0.00 H ATOM 2839 H2 WAT 8290 125.922 136.157 138.710 1.00 0.00 H TER 2841 WAT 8290 ATOM 2841 O WAT 8291 1.622 66.832 86.324 1.00 0.00 O ATOM 2842 H1 WAT 8291 1.673 66.515 85.422 1.00 0.00 H ATOM 2843 H2 WAT 8291 0.886 66.353 86.705 1.00 0.00 H TER 2845 WAT 8291 ATOM 2845 O WAT 8292 112.440 45.491 147.875 1.00 0.00 O ATOM 2846 H1 WAT 8292 112.463 44.698 148.410 1.00 0.00 H ATOM 2847 H2 WAT 8292 112.435 45.172 146.973 1.00 0.00 H TER 2849 WAT 8292 ATOM 2849 O WAT 8293 128.115 106.343 17.171 1.00 0.00 O ATOM 2850 H1 WAT 8293 127.414 106.842 16.752 1.00 0.00 H ATOM 2851 H2 WAT 8293 128.289 105.621 16.567 1.00 0.00 H TER 2853 WAT 8293 ATOM 2853 O WAT 8294 68.331 130.355 14.417 1.00 0.00 O ATOM 2854 H1 WAT 8294 69.214 130.238 14.767 1.00 0.00 H ATOM 2855 H2 WAT 8294 68.364 129.959 13.546 1.00 0.00 H TER 2857 WAT 8294 ATOM 2857 O WAT 8295 42.943 97.501 130.188 1.00 0.00 O ATOM 2858 H1 WAT 8295 43.710 97.435 129.619 1.00 0.00 H ATOM 2859 H2 WAT 8295 42.349 98.090 129.722 1.00 0.00 H TER 2861 WAT 8295 ATOM 2861 O WAT 8296 55.530 52.593 56.437 1.00 0.00 O ATOM 2862 H1 WAT 8296 55.478 53.308 57.071 1.00 0.00 H ATOM 2863 H2 WAT 8296 54.787 52.736 55.852 1.00 0.00 H TER 2865 WAT 8296 ATOM 2865 O WAT 8297 142.568 90.762 78.599 1.00 0.00 O ATOM 2866 H1 WAT 8297 142.998 91.606 78.460 1.00 0.00 H ATOM 2867 H2 WAT 8297 142.258 90.506 77.730 1.00 0.00 H TER 2869 WAT 8297 ATOM 2869 O WAT 8298 118.699 45.918 154.875 1.00 0.00 O ATOM 2870 H1 WAT 8298 118.056 45.704 155.551 1.00 0.00 H ATOM 2871 H2 WAT 8298 118.852 45.091 154.419 1.00 0.00 H TER 2873 WAT 8298 ATOM 2873 O WAT 8299 135.073 131.254 104.294 1.00 0.00 O ATOM 2874 H1 WAT 8299 135.837 131.395 103.735 1.00 0.00 H ATOM 2875 H2 WAT 8299 135.043 130.307 104.426 1.00 0.00 H TER 2877 WAT 8299 ATOM 2877 O WAT 8300 135.256 57.564 87.982 1.00 0.00 O ATOM 2878 H1 WAT 8300 136.194 57.717 88.099 1.00 0.00 H ATOM 2879 H2 WAT 8300 134.843 58.046 88.699 1.00 0.00 H TER 2881 WAT 8300 ATOM 2881 O WAT 8301 18.808 129.485 74.847 1.00 0.00 O ATOM 2882 H1 WAT 8301 18.794 129.631 75.792 1.00 0.00 H ATOM 2883 H2 WAT 8301 17.962 129.081 74.654 1.00 0.00 H TER 2885 WAT 8301 ATOM 2885 O WAT 8302 36.563 125.363 107.958 1.00 0.00 O ATOM 2886 H1 WAT 8302 36.073 124.550 107.837 1.00 0.00 H ATOM 2887 H2 WAT 8302 36.579 125.495 108.906 1.00 0.00 H TER 2889 WAT 8302 ATOM 2889 O WAT 8303 40.914 121.221 158.965 1.00 0.00 O ATOM 2890 H1 WAT 8303 40.675 120.305 158.827 1.00 0.00 H ATOM 2891 H2 WAT 8303 41.294 121.498 158.131 1.00 0.00 H TER 2893 WAT 8303 ATOM 2893 O WAT 8304 9.518 115.104 21.473 1.00 0.00 O ATOM 2894 H1 WAT 8304 8.949 115.857 21.312 1.00 0.00 H ATOM 2895 H2 WAT 8304 9.233 114.449 20.836 1.00 0.00 H TER 2897 WAT 8304 ATOM 2897 O WAT 8305 15.454 48.168 78.885 1.00 0.00 O ATOM 2898 H1 WAT 8305 14.723 48.193 79.503 1.00 0.00 H ATOM 2899 H2 WAT 8305 15.373 48.981 78.386 1.00 0.00 H TER 2901 WAT 8305 ATOM 2901 O WAT 8306 98.255 3.474 5.801 1.00 0.00 O ATOM 2902 H1 WAT 8306 97.548 2.830 5.752 1.00 0.00 H ATOM 2903 H2 WAT 8306 97.944 4.211 5.274 1.00 0.00 H TER 2905 WAT 8306 ATOM 2905 O WAT 8307 6.863 129.105 99.240 1.00 0.00 O ATOM 2906 H1 WAT 8307 6.963 128.246 98.829 1.00 0.00 H ATOM 2907 H2 WAT 8307 5.960 129.359 99.049 1.00 0.00 H TER 2909 WAT 8307 ATOM 2909 O WAT 8308 47.215 41.555 83.847 1.00 0.00 O ATOM 2910 H1 WAT 8308 47.400 41.089 84.662 1.00 0.00 H ATOM 2911 H2 WAT 8308 47.930 41.307 83.261 1.00 0.00 H TER 2913 WAT 8308 ATOM 2913 O WAT 8309 110.364 133.742 91.271 1.00 0.00 O ATOM 2914 H1 WAT 8309 110.213 133.404 90.388 1.00 0.00 H ATOM 2915 H2 WAT 8309 109.490 133.798 91.658 1.00 0.00 H TER 2917 WAT 8309 ATOM 2917 O WAT 8310 37.028 36.451 6.223 1.00 0.00 O ATOM 2918 H1 WAT 8310 36.643 36.942 5.498 1.00 0.00 H ATOM 2919 H2 WAT 8310 36.336 35.852 6.502 1.00 0.00 H TER 2921 WAT 8310 ATOM 2921 O WAT 8311 68.071 144.923 90.894 1.00 0.00 O ATOM 2922 H1 WAT 8311 68.890 145.345 91.153 1.00 0.00 H ATOM 2923 H2 WAT 8311 67.499 145.024 91.654 1.00 0.00 H TER 2925 WAT 8311 ATOM 2925 O WAT 8312 55.615 24.564 12.053 1.00 0.00 O ATOM 2926 H1 WAT 8312 55.102 24.866 12.803 1.00 0.00 H ATOM 2927 H2 WAT 8312 54.970 24.440 11.356 1.00 0.00 H TER 2929 WAT 8312 ATOM 2929 O WAT 8313 16.401 8.373 79.322 1.00 0.00 O ATOM 2930 H1 WAT 8313 16.026 7.815 78.641 1.00 0.00 H ATOM 2931 H2 WAT 8313 16.110 9.256 79.096 1.00 0.00 H TER 2933 WAT 8313 ATOM 2933 O WAT 8314 8.201 64.289 125.876 1.00 0.00 O ATOM 2934 H1 WAT 8314 8.876 64.121 126.534 1.00 0.00 H ATOM 2935 H2 WAT 8314 7.434 64.556 126.382 1.00 0.00 H TER 2937 WAT 8314 ATOM 2937 O WAT 8315 27.532 106.006 107.659 1.00 0.00 O ATOM 2938 H1 WAT 8315 28.401 105.865 108.037 1.00 0.00 H ATOM 2939 H2 WAT 8315 27.041 106.455 108.348 1.00 0.00 H TER 2941 WAT 8315 ATOM 2941 O WAT 8316 29.832 62.834 22.823 1.00 0.00 O ATOM 2942 H1 WAT 8316 30.512 62.793 23.495 1.00 0.00 H ATOM 2943 H2 WAT 8316 30.151 62.265 22.124 1.00 0.00 H TER 2945 WAT 8316 ATOM 2945 O WAT 8317 29.053 44.322 133.421 1.00 0.00 O ATOM 2946 H1 WAT 8317 29.203 43.777 132.649 1.00 0.00 H ATOM 2947 H2 WAT 8317 28.234 43.992 133.792 1.00 0.00 H TER 2949 WAT 8317 ATOM 2949 O WAT 8318 141.210 54.646 149.626 1.00 0.00 O ATOM 2950 H1 WAT 8318 141.989 54.736 150.174 1.00 0.00 H ATOM 2951 H2 WAT 8318 140.870 55.538 149.545 1.00 0.00 H TER 2953 WAT 8318 ATOM 2953 O WAT 8319 77.411 121.325 83.804 1.00 0.00 O ATOM 2954 H1 WAT 8319 78.279 121.202 83.420 1.00 0.00 H ATOM 2955 H2 WAT 8319 77.094 120.437 83.970 1.00 0.00 H TER 2957 WAT 8319 ATOM 2957 O WAT 8320 94.172 39.653 3.183 1.00 0.00 O ATOM 2958 H1 WAT 8320 95.106 39.676 2.974 1.00 0.00 H ATOM 2959 H2 WAT 8320 93.745 40.039 2.419 1.00 0.00 H TER 2961 WAT 8320 ATOM 2961 O WAT 8321 76.924 105.411 24.809 1.00 0.00 O ATOM 2962 H1 WAT 8321 75.999 105.166 24.769 1.00 0.00 H ATOM 2963 H2 WAT 8321 76.940 106.197 25.355 1.00 0.00 H TER 2965 WAT 8321 ATOM 2965 O WAT 8322 29.832 66.266 8.917 1.00 0.00 O ATOM 2966 H1 WAT 8322 29.848 65.951 8.013 1.00 0.00 H ATOM 2967 H2 WAT 8322 29.215 66.998 8.904 1.00 0.00 H TER 2969 WAT 8322 ATOM 2969 O WAT 8323 19.451 82.247 5.649 1.00 0.00 O ATOM 2970 H1 WAT 8323 20.341 82.348 5.311 1.00 0.00 H ATOM 2971 H2 WAT 8323 19.485 81.451 6.179 1.00 0.00 H TER 2973 WAT 8323 ATOM 2973 O WAT 8324 100.819 134.685 100.746 1.00 0.00 O ATOM 2974 H1 WAT 8324 100.083 134.632 101.356 1.00 0.00 H ATOM 2975 H2 WAT 8324 100.840 135.602 100.475 1.00 0.00 H TER 2977 WAT 8324 ATOM 2977 O WAT 8325 66.329 70.044 129.789 1.00 0.00 O ATOM 2978 H1 WAT 8325 66.676 69.694 128.969 1.00 0.00 H ATOM 2979 H2 WAT 8325 66.717 69.493 130.468 1.00 0.00 H TER 2981 WAT 8325 ATOM 2981 O WAT 8326 89.051 140.873 122.110 1.00 0.00 O ATOM 2982 H1 WAT 8326 88.860 141.744 121.761 1.00 0.00 H ATOM 2983 H2 WAT 8326 88.414 140.753 122.815 1.00 0.00 H TER 2985 WAT 8326 ATOM 2985 O WAT 8327 39.511 21.556 87.207 1.00 0.00 O ATOM 2986 H1 WAT 8327 39.073 21.249 86.412 1.00 0.00 H ATOM 2987 H2 WAT 8327 40.335 21.930 86.897 1.00 0.00 H TER 2989 WAT 8327 ATOM 2989 O WAT 8328 115.870 47.545 155.966 1.00 0.00 O ATOM 2990 H1 WAT 8328 115.901 47.337 155.032 1.00 0.00 H ATOM 2991 H2 WAT 8328 115.807 48.500 155.997 1.00 0.00 H TER 2993 WAT 8328 ATOM 2993 O WAT 8329 38.157 96.554 109.522 1.00 0.00 O ATOM 2994 H1 WAT 8329 37.652 95.752 109.657 1.00 0.00 H ATOM 2995 H2 WAT 8329 39.022 96.249 109.248 1.00 0.00 H TER 2997 WAT 8329 ATOM 2997 O WAT 8330 26.081 25.146 149.005 1.00 0.00 O ATOM 2998 H1 WAT 8330 25.222 25.544 148.868 1.00 0.00 H ATOM 2999 H2 WAT 8330 26.048 24.804 149.898 1.00 0.00 H TER 3001 WAT 8330 ATOM 3001 O WAT 8331 112.836 32.660 138.757 1.00 0.00 O ATOM 3002 H1 WAT 8331 113.778 32.702 138.595 1.00 0.00 H ATOM 3003 H2 WAT 8331 112.687 31.772 139.080 1.00 0.00 H TER 3005 WAT 8331 ATOM 3005 O WAT 8332 102.200 52.726 101.733 1.00 0.00 O ATOM 3006 H1 WAT 8332 101.504 52.172 102.087 1.00 0.00 H ATOM 3007 H2 WAT 8332 102.566 53.169 102.498 1.00 0.00 H TER 3009 WAT 8332 ATOM 3009 O WAT 8333 142.158 19.810 99.427 1.00 0.00 O ATOM 3010 H1 WAT 8333 142.657 19.150 98.944 1.00 0.00 H ATOM 3011 H2 WAT 8333 141.621 19.305 100.037 1.00 0.00 H TER 3013 WAT 8333 ATOM 3013 O WAT 8334 101.467 29.475 128.931 1.00 0.00 O ATOM 3014 H1 WAT 8334 100.648 28.990 128.833 1.00 0.00 H ATOM 3015 H2 WAT 8334 101.786 29.234 129.801 1.00 0.00 H TER 3017 WAT 8334 ATOM 3017 O WAT 8335 96.755 58.759 121.202 1.00 0.00 O ATOM 3018 H1 WAT 8335 96.376 58.031 120.710 1.00 0.00 H ATOM 3019 H2 WAT 8335 96.105 58.958 121.876 1.00 0.00 H TER 3021 WAT 8335 ATOM 3021 O WAT 8336 95.210 100.166 4.044 1.00 0.00 O ATOM 3022 H1 WAT 8336 95.942 99.563 4.175 1.00 0.00 H ATOM 3023 H2 WAT 8336 95.571 101.028 4.250 1.00 0.00 H TER 3025 WAT 8336 ATOM 3025 O WAT 8337 130.289 66.152 115.897 1.00 0.00 O ATOM 3026 H1 WAT 8337 129.584 65.652 116.309 1.00 0.00 H ATOM 3027 H2 WAT 8337 130.450 65.700 115.069 1.00 0.00 H TER 3029 WAT 8337 ATOM 3029 O WAT 8338 87.074 17.629 153.379 1.00 0.00 O ATOM 3030 H1 WAT 8338 87.361 17.063 152.662 1.00 0.00 H ATOM 3031 H2 WAT 8338 87.308 18.513 153.093 1.00 0.00 H TER 3033 WAT 8338 ATOM 3033 O WAT 8339 68.003 97.756 149.330 1.00 0.00 O ATOM 3034 H1 WAT 8339 68.610 98.185 148.727 1.00 0.00 H ATOM 3035 H2 WAT 8339 68.519 97.057 149.731 1.00 0.00 H TER 3037 WAT 8339 ATOM 3037 O WAT 8340 126.129 18.711 113.282 1.00 0.00 O ATOM 3038 H1 WAT 8340 127.079 18.616 113.214 1.00 0.00 H ATOM 3039 H2 WAT 8340 125.830 18.779 112.375 1.00 0.00 H TER 3041 WAT 8340 ATOM 3041 O WAT 8341 80.242 119.793 134.269 1.00 0.00 O ATOM 3042 H1 WAT 8341 80.188 120.504 133.631 1.00 0.00 H ATOM 3043 H2 WAT 8341 79.399 119.814 134.723 1.00 0.00 H TER 3045 WAT 8341 ATOM 3045 O WAT 8342 128.233 87.032 86.782 1.00 0.00 O ATOM 3046 H1 WAT 8342 128.462 86.159 87.102 1.00 0.00 H ATOM 3047 H2 WAT 8342 128.598 87.629 87.434 1.00 0.00 H TER 3049 WAT 8342 ATOM 3049 O WAT 8343 101.728 118.724 140.530 1.00 0.00 O ATOM 3050 H1 WAT 8343 101.345 118.273 139.777 1.00 0.00 H ATOM 3051 H2 WAT 8343 101.005 118.809 141.152 1.00 0.00 H TER 3053 WAT 8343 ATOM 3053 O WAT 8344 10.921 9.909 66.067 1.00 0.00 O ATOM 3054 H1 WAT 8344 10.451 9.933 65.233 1.00 0.00 H ATOM 3055 H2 WAT 8344 11.581 9.225 65.950 1.00 0.00 H TER 3057 WAT 8344 ATOM 3057 O WAT 8345 13.943 89.490 134.050 1.00 0.00 O ATOM 3058 H1 WAT 8345 14.187 89.652 134.961 1.00 0.00 H ATOM 3059 H2 WAT 8345 13.074 89.883 133.961 1.00 0.00 H TER 3061 WAT 8345 ATOM 3061 O WAT 8346 29.870 30.014 71.585 1.00 0.00 O ATOM 3062 H1 WAT 8346 30.207 29.138 71.776 1.00 0.00 H ATOM 3063 H2 WAT 8346 30.265 30.574 72.252 1.00 0.00 H TER 3065 WAT 8346 ATOM 3065 O WAT 8347 123.748 114.811 86.683 1.00 0.00 O ATOM 3066 H1 WAT 8347 124.102 114.165 87.294 1.00 0.00 H ATOM 3067 H2 WAT 8347 124.509 115.320 86.405 1.00 0.00 H TER 3069 WAT 8347 ATOM 3069 O WAT 8348 119.817 31.864 115.583 1.00 0.00 O ATOM 3070 H1 WAT 8348 118.919 31.569 115.735 1.00 0.00 H ATOM 3071 H2 WAT 8348 120.189 31.207 114.995 1.00 0.00 H TER 3073 WAT 8348 ATOM 3073 O WAT 8349 118.292 2.746 66.886 1.00 0.00 O ATOM 3074 H1 WAT 8349 117.737 1.966 66.887 1.00 0.00 H ATOM 3075 H2 WAT 8349 118.324 3.016 65.969 1.00 0.00 H TER 3077 WAT 8349 ATOM 3077 O WAT 8350 61.837 138.020 103.718 1.00 0.00 O ATOM 3078 H1 WAT 8350 61.917 137.482 102.931 1.00 0.00 H ATOM 3079 H2 WAT 8350 62.519 137.691 104.303 1.00 0.00 H TER 3081 WAT 8350 ATOM 3081 O WAT 8351 2.238 89.832 124.041 1.00 0.00 O ATOM 3082 H1 WAT 8351 1.830 90.112 124.860 1.00 0.00 H ATOM 3083 H2 WAT 8351 3.175 89.969 124.182 1.00 0.00 H TER 3085 WAT 8351 ATOM 3085 O WAT 8352 32.789 105.509 102.409 1.00 0.00 O ATOM 3086 H1 WAT 8352 33.592 105.089 102.718 1.00 0.00 H ATOM 3087 H2 WAT 8352 32.972 105.733 101.496 1.00 0.00 H TER 3089 WAT 8352 ATOM 3089 O WAT 8353 101.708 49.058 105.773 1.00 0.00 O ATOM 3090 H1 WAT 8353 102.049 49.110 106.666 1.00 0.00 H ATOM 3091 H2 WAT 8353 102.118 49.793 105.317 1.00 0.00 H TER 3093 WAT 8353 ATOM 3093 O WAT 8354 84.439 72.342 77.617 1.00 0.00 O ATOM 3094 H1 WAT 8354 85.217 71.913 77.260 1.00 0.00 H ATOM 3095 H2 WAT 8354 83.867 71.620 77.880 1.00 0.00 H TER 3097 WAT 8354 ATOM 3097 O WAT 8355 60.001 67.626 68.172 1.00 0.00 O ATOM 3098 H1 WAT 8355 59.277 67.048 67.931 1.00 0.00 H ATOM 3099 H2 WAT 8355 60.788 67.115 67.982 1.00 0.00 H TER 3101 WAT 8355 ATOM 3101 O WAT 8356 28.060 87.824 115.716 1.00 0.00 O ATOM 3102 H1 WAT 8356 28.654 87.076 115.654 1.00 0.00 H ATOM 3103 H2 WAT 8356 27.500 87.749 114.943 1.00 0.00 H TER 3105 WAT 8356 ATOM 3105 O WAT 8357 4.753 42.895 148.797 1.00 0.00 O ATOM 3106 H1 WAT 8357 5.366 43.140 149.489 1.00 0.00 H ATOM 3107 H2 WAT 8357 5.173 42.158 148.353 1.00 0.00 H TER 3109 WAT 8357 ATOM 3109 O WAT 8358 13.781 105.730 18.070 1.00 0.00 O ATOM 3110 H1 WAT 8358 13.071 105.252 18.498 1.00 0.00 H ATOM 3111 H2 WAT 8358 14.460 105.072 17.925 1.00 0.00 H TER 3113 WAT 8358 ATOM 3113 O WAT 8359 85.314 123.158 70.347 1.00 0.00 O ATOM 3114 H1 WAT 8359 84.909 122.482 69.804 1.00 0.00 H ATOM 3115 H2 WAT 8359 84.582 123.558 70.817 1.00 0.00 H TER 3117 WAT 8359 ATOM 3117 O WAT 8360 78.489 76.114 67.916 1.00 0.00 O ATOM 3118 H1 WAT 8360 78.206 76.305 68.810 1.00 0.00 H ATOM 3119 H2 WAT 8360 79.101 76.818 67.703 1.00 0.00 H TER 3121 WAT 8360 ATOM 3121 O WAT 8361 57.457 33.425 147.708 1.00 0.00 O ATOM 3122 H1 WAT 8361 56.544 33.706 147.639 1.00 0.00 H ATOM 3123 H2 WAT 8361 57.797 33.897 148.468 1.00 0.00 H TER 3125 WAT 8361 ATOM 3125 O WAT 8362 135.889 102.788 2.692 1.00 0.00 O ATOM 3126 H1 WAT 8362 136.825 102.615 2.597 1.00 0.00 H ATOM 3127 H2 WAT 8362 135.564 102.064 3.228 1.00 0.00 H TER 3129 WAT 8362 ATOM 3129 O WAT 8363 119.123 43.884 132.245 1.00 0.00 O ATOM 3130 H1 WAT 8363 118.617 43.142 131.914 1.00 0.00 H ATOM 3131 H2 WAT 8363 118.979 44.578 131.601 1.00 0.00 H TER 3133 WAT 8363 ATOM 3133 O WAT 8364 83.802 10.376 76.174 1.00 0.00 O ATOM 3134 H1 WAT 8364 83.837 10.457 77.127 1.00 0.00 H ATOM 3135 H2 WAT 8364 83.244 11.101 75.892 1.00 0.00 H TER 3137 WAT 8364 ATOM 3137 O WAT 8365 85.839 95.272 127.214 1.00 0.00 O ATOM 3138 H1 WAT 8365 85.011 95.745 127.130 1.00 0.00 H ATOM 3139 H2 WAT 8365 85.749 94.524 126.623 1.00 0.00 H TER 3141 WAT 8365 ATOM 3141 O WAT 8366 105.512 106.051 102.008 1.00 0.00 O ATOM 3142 H1 WAT 8366 106.008 105.532 101.375 1.00 0.00 H ATOM 3143 H2 WAT 8366 106.026 106.001 102.814 1.00 0.00 H TER 3145 WAT 8366 ATOM 3145 O WAT 8367 51.301 122.834 117.452 1.00 0.00 O ATOM 3146 H1 WAT 8367 51.476 121.967 117.084 1.00 0.00 H ATOM 3147 H2 WAT 8367 52.146 123.124 117.795 1.00 0.00 H TER 3149 WAT 8367 ATOM 3149 O WAT 8368 117.648 59.921 67.361 1.00 0.00 O ATOM 3150 H1 WAT 8368 118.317 60.605 67.325 1.00 0.00 H ATOM 3151 H2 WAT 8368 116.955 60.292 67.907 1.00 0.00 H TER 3153 WAT 8368 ATOM 3153 O WAT 8369 135.661 117.063 127.820 1.00 0.00 O ATOM 3154 H1 WAT 8369 135.766 117.492 126.971 1.00 0.00 H ATOM 3155 H2 WAT 8369 136.529 117.109 128.221 1.00 0.00 H TER 3157 WAT 8369 ATOM 3157 O WAT 8370 137.881 92.877 83.246 1.00 0.00 O ATOM 3158 H1 WAT 8370 138.230 92.018 83.486 1.00 0.00 H ATOM 3159 H2 WAT 8370 137.506 93.218 84.058 1.00 0.00 H TER 3161 WAT 8370 ATOM 3161 O WAT 8371 140.404 117.546 81.136 1.00 0.00 O ATOM 3162 H1 WAT 8371 140.283 118.353 80.636 1.00 0.00 H ATOM 3163 H2 WAT 8371 141.073 117.765 81.785 1.00 0.00 H TER 3165 WAT 8371 ATOM 3165 O WAT 8372 68.883 94.360 85.223 1.00 0.00 O ATOM 3166 H1 WAT 8372 69.330 95.206 85.211 1.00 0.00 H ATOM 3167 H2 WAT 8372 68.305 94.405 85.985 1.00 0.00 H TER 3169 WAT 8372 ATOM 3169 O WAT 8373 92.338 49.231 85.661 1.00 0.00 O ATOM 3170 H1 WAT 8373 92.442 50.156 85.441 1.00 0.00 H ATOM 3171 H2 WAT 8373 92.934 49.091 86.397 1.00 0.00 H TER 3173 WAT 8373 ATOM 3173 O WAT 8374 51.591 41.926 3.172 1.00 0.00 O ATOM 3174 H1 WAT 8374 51.483 42.280 2.289 1.00 0.00 H ATOM 3175 H2 WAT 8374 50.708 41.671 3.437 1.00 0.00 H TER 3177 WAT 8374 ATOM 3177 O WAT 8375 19.614 5.058 156.800 1.00 0.00 O ATOM 3178 H1 WAT 8375 19.818 4.345 156.194 1.00 0.00 H ATOM 3179 H2 WAT 8375 18.929 4.702 157.366 1.00 0.00 H TER 3181 WAT 8375 ATOM 3181 O WAT 8376 55.649 99.215 80.615 1.00 0.00 O ATOM 3182 H1 WAT 8376 54.998 98.998 79.948 1.00 0.00 H ATOM 3183 H2 WAT 8376 55.514 100.147 80.787 1.00 0.00 H TER 3185 WAT 8376 ATOM 3185 O WAT 8377 76.915 59.084 74.106 1.00 0.00 O ATOM 3186 H1 WAT 8377 76.722 58.700 73.251 1.00 0.00 H ATOM 3187 H2 WAT 8377 76.150 59.623 74.305 1.00 0.00 H TER 3189 WAT 8377 ATOM 3189 O WAT 8378 70.581 113.371 106.064 1.00 0.00 O ATOM 3190 H1 WAT 8378 70.129 112.639 105.645 1.00 0.00 H ATOM 3191 H2 WAT 8378 71.430 113.013 106.321 1.00 0.00 H TER 3193 WAT 8378 ATOM 3193 O WAT 8379 16.434 4.350 84.153 1.00 0.00 O ATOM 3194 H1 WAT 8379 15.725 4.295 84.793 1.00 0.00 H ATOM 3195 H2 WAT 8379 17.132 3.809 84.522 1.00 0.00 H TER 3197 WAT 8379 ATOM 3197 O WAT 8380 24.071 33.807 87.311 1.00 0.00 O ATOM 3198 H1 WAT 8380 23.410 33.134 87.471 1.00 0.00 H ATOM 3199 H2 WAT 8380 24.055 33.938 86.363 1.00 0.00 H TER 3201 WAT 8380 ATOM 3201 O WAT 8381 79.963 123.684 25.499 1.00 0.00 O ATOM 3202 H1 WAT 8381 79.300 123.932 24.855 1.00 0.00 H ATOM 3203 H2 WAT 8381 80.321 124.517 25.806 1.00 0.00 H TER 3205 WAT 8381 ATOM 3205 O WAT 8382 94.737 130.735 156.093 1.00 0.00 O ATOM 3206 H1 WAT 8382 93.788 130.846 156.048 1.00 0.00 H ATOM 3207 H2 WAT 8382 94.874 129.797 155.959 1.00 0.00 H TER 3209 WAT 8382 ATOM 3209 O WAT 8383 14.714 13.881 105.967 1.00 0.00 O ATOM 3210 H1 WAT 8383 14.635 13.961 106.917 1.00 0.00 H ATOM 3211 H2 WAT 8383 13.992 14.407 105.622 1.00 0.00 H TER 3213 WAT 8383 ATOM 3213 O WAT 8384 58.202 15.061 123.080 1.00 0.00 O ATOM 3214 H1 WAT 8384 58.639 15.709 122.528 1.00 0.00 H ATOM 3215 H2 WAT 8384 57.927 14.375 122.471 1.00 0.00 H TER 3217 WAT 8384 ATOM 3217 O WAT 8385 109.954 134.158 146.948 1.00 0.00 O ATOM 3218 H1 WAT 8385 110.829 134.311 147.304 1.00 0.00 H ATOM 3219 H2 WAT 8385 109.990 134.520 146.062 1.00 0.00 H TER 3221 WAT 8385 ATOM 3221 O WAT 8386 136.374 17.012 15.510 1.00 0.00 O ATOM 3222 H1 WAT 8386 135.574 16.971 16.034 1.00 0.00 H ATOM 3223 H2 WAT 8386 136.069 16.966 14.603 1.00 0.00 H TER 3225 WAT 8386 ATOM 3225 O WAT 8387 60.154 31.552 99.742 1.00 0.00 O ATOM 3226 H1 WAT 8387 59.313 31.485 99.289 1.00 0.00 H ATOM 3227 H2 WAT 8387 60.753 31.901 99.082 1.00 0.00 H TER 3229 WAT 8387 ATOM 3229 O WAT 8388 113.985 142.300 107.982 1.00 0.00 O ATOM 3230 H1 WAT 8388 113.969 142.071 107.053 1.00 0.00 H ATOM 3231 H2 WAT 8388 113.762 141.486 108.433 1.00 0.00 H TER 3233 WAT 8388 ATOM 3233 O WAT 8389 4.067 109.085 138.498 1.00 0.00 O ATOM 3234 H1 WAT 8389 3.214 109.383 138.813 1.00 0.00 H ATOM 3235 H2 WAT 8389 4.244 109.630 137.731 1.00 0.00 H TER 3237 WAT 8389 ATOM 3237 O WAT 8390 85.611 112.759 125.179 1.00 0.00 O ATOM 3238 H1 WAT 8390 85.369 113.327 125.911 1.00 0.00 H ATOM 3239 H2 WAT 8390 84.779 112.534 124.764 1.00 0.00 H TER 3241 WAT 8390 ATOM 3241 O WAT 8391 111.663 7.260 10.457 1.00 0.00 O ATOM 3242 H1 WAT 8391 111.495 6.368 10.152 1.00 0.00 H ATOM 3243 H2 WAT 8391 110.856 7.735 10.260 1.00 0.00 H TER 3245 WAT 8391 ATOM 3245 O WAT 8392 99.730 78.077 146.454 1.00 0.00 O ATOM 3246 H1 WAT 8392 99.257 77.418 145.945 1.00 0.00 H ATOM 3247 H2 WAT 8392 99.045 78.566 146.909 1.00 0.00 H TER 3249 WAT 8392 ATOM 3249 O WAT 8393 99.113 36.653 119.763 1.00 0.00 O ATOM 3250 H1 WAT 8393 99.253 35.752 119.472 1.00 0.00 H ATOM 3251 H2 WAT 8393 98.834 36.570 120.675 1.00 0.00 H TER 3253 WAT 8393 ATOM 3253 O WAT 8394 99.032 32.101 11.853 1.00 0.00 O ATOM 3254 H1 WAT 8394 98.418 31.553 11.364 1.00 0.00 H ATOM 3255 H2 WAT 8394 98.887 31.865 12.769 1.00 0.00 H TER 3257 WAT 8394 ATOM 3257 O WAT 8395 81.468 31.215 70.085 1.00 0.00 O ATOM 3258 H1 WAT 8395 81.160 31.335 70.983 1.00 0.00 H ATOM 3259 H2 WAT 8395 82.354 30.865 70.180 1.00 0.00 H TER 3261 WAT 8395 ATOM 3261 O WAT 8396 114.410 67.075 102.629 1.00 0.00 O ATOM 3262 H1 WAT 8396 114.381 68.030 102.689 1.00 0.00 H ATOM 3263 H2 WAT 8396 114.475 66.896 101.692 1.00 0.00 H TER 3265 WAT 8396 ATOM 3265 O WAT 8397 105.412 5.977 14.753 1.00 0.00 O ATOM 3266 H1 WAT 8397 105.848 5.297 15.267 1.00 0.00 H ATOM 3267 H2 WAT 8397 105.906 6.013 13.935 1.00 0.00 H TER 3269 WAT 8397 ATOM 3269 O WAT 8398 97.237 11.831 86.739 1.00 0.00 O ATOM 3270 H1 WAT 8398 97.325 10.916 86.475 1.00 0.00 H ATOM 3271 H2 WAT 8398 97.088 12.303 85.919 1.00 0.00 H TER 3273 WAT 8398 ATOM 3273 O WAT 8399 66.002 139.032 6.863 1.00 0.00 O ATOM 3274 H1 WAT 8399 66.615 138.610 6.260 1.00 0.00 H ATOM 3275 H2 WAT 8399 65.657 138.314 7.394 1.00 0.00 H TER 3277 WAT 8399 ATOM 3277 O WAT 8400 95.540 2.950 57.032 1.00 0.00 O ATOM 3278 H1 WAT 8400 94.840 3.600 56.972 1.00 0.00 H ATOM 3279 H2 WAT 8400 96.055 3.079 56.235 1.00 0.00 H TER 3281 WAT 8400 ATOM 3281 O WAT 8401 105.589 82.217 115.650 1.00 0.00 O ATOM 3282 H1 WAT 8401 106.139 81.435 115.702 1.00 0.00 H ATOM 3283 H2 WAT 8401 104.962 82.117 116.366 1.00 0.00 H TER 3285 WAT 8401 ATOM 3285 O WAT 8402 86.535 128.141 94.122 1.00 0.00 O ATOM 3286 H1 WAT 8402 87.377 128.180 94.574 1.00 0.00 H ATOM 3287 H2 WAT 8402 85.953 127.697 94.738 1.00 0.00 H TER 3289 WAT 8402 ATOM 3289 O WAT 8403 76.253 70.521 109.389 1.00 0.00 O ATOM 3290 H1 WAT 8403 75.847 70.851 110.190 1.00 0.00 H ATOM 3291 H2 WAT 8403 76.235 71.266 108.787 1.00 0.00 H TER 3293 WAT 8403 ATOM 3293 O WAT 8404 113.955 11.557 132.317 1.00 0.00 O ATOM 3294 H1 WAT 8404 113.051 11.548 132.001 1.00 0.00 H ATOM 3295 H2 WAT 8404 114.334 12.349 131.936 1.00 0.00 H TER 3297 WAT 8404 ATOM 3297 O WAT 8405 74.765 124.352 119.173 1.00 0.00 O ATOM 3298 H1 WAT 8405 73.918 124.206 119.595 1.00 0.00 H ATOM 3299 H2 WAT 8405 75.295 124.783 119.842 1.00 0.00 H TER 3301 WAT 8405 ATOM 3301 O WAT 8406 92.621 88.726 93.465 1.00 0.00 O ATOM 3302 H1 WAT 8406 91.925 88.351 92.926 1.00 0.00 H ATOM 3303 H2 WAT 8406 93.349 88.110 93.379 1.00 0.00 H TER 3305 WAT 8406 ATOM 3305 O WAT 8407 105.832 5.114 70.800 1.00 0.00 O ATOM 3306 H1 WAT 8407 105.492 4.379 70.289 1.00 0.00 H ATOM 3307 H2 WAT 8407 106.727 5.232 70.482 1.00 0.00 H TER 3309 WAT 8407 ATOM 3309 O WAT 8408 1.166 27.157 109.366 1.00 0.00 O ATOM 3310 H1 WAT 8408 0.610 26.537 109.837 1.00 0.00 H ATOM 3311 H2 WAT 8408 1.240 26.790 108.485 1.00 0.00 H TER 3313 WAT 8408 ATOM 3313 O WAT 8409 73.456 56.039 18.533 1.00 0.00 O ATOM 3314 H1 WAT 8409 73.974 55.324 18.903 1.00 0.00 H ATOM 3315 H2 WAT 8409 72.547 55.759 18.646 1.00 0.00 H TER 3317 WAT 8409 ATOM 3317 O WAT 8410 68.088 74.557 115.494 1.00 0.00 O ATOM 3318 H1 WAT 8410 67.177 74.262 115.494 1.00 0.00 H ATOM 3319 H2 WAT 8410 68.466 74.166 116.282 1.00 0.00 H TER 3321 WAT 8410 ATOM 3321 O WAT 8411 91.617 60.759 148.658 1.00 0.00 O ATOM 3322 H1 WAT 8411 91.583 61.715 148.632 1.00 0.00 H ATOM 3323 H2 WAT 8411 90.706 60.491 148.781 1.00 0.00 H TER 3325 WAT 8411 ATOM 3325 O WAT 8412 41.613 32.135 13.744 1.00 0.00 O ATOM 3326 H1 WAT 8412 42.424 31.747 14.073 1.00 0.00 H ATOM 3327 H2 WAT 8412 41.723 33.075 13.885 1.00 0.00 H TER 3329 WAT 8412 ATOM 3329 O WAT 8413 78.582 134.490 153.757 1.00 0.00 O ATOM 3330 H1 WAT 8413 78.282 134.103 152.934 1.00 0.00 H ATOM 3331 H2 WAT 8413 78.810 133.739 154.305 1.00 0.00 H TER 3333 WAT 8413 ATOM 3333 O WAT 8414 137.024 131.456 59.403 1.00 0.00 O ATOM 3334 H1 WAT 8414 137.602 131.029 60.036 1.00 0.00 H ATOM 3335 H2 WAT 8414 137.548 131.517 58.605 1.00 0.00 H TER 3337 WAT 8414 ATOM 3337 O WAT 8415 82.243 90.751 70.308 1.00 0.00 O ATOM 3338 H1 WAT 8415 82.154 91.590 70.761 1.00 0.00 H ATOM 3339 H2 WAT 8415 82.609 90.979 69.453 1.00 0.00 H TER 3341 WAT 8415 ATOM 3341 O WAT 8416 47.192 132.674 70.534 1.00 0.00 O ATOM 3342 H1 WAT 8416 46.770 132.564 71.386 1.00 0.00 H ATOM 3343 H2 WAT 8416 46.615 132.220 69.920 1.00 0.00 H TER 3345 WAT 8416 ATOM 3345 O WAT 8417 112.296 145.804 124.043 1.00 0.00 O ATOM 3346 H1 WAT 8417 111.680 146.193 123.422 1.00 0.00 H ATOM 3347 H2 WAT 8417 112.609 145.012 123.605 1.00 0.00 H TER 3349 WAT 8417 ATOM 3349 O WAT 8418 125.018 53.021 121.719 1.00 0.00 O ATOM 3350 H1 WAT 8418 124.411 53.661 121.347 1.00 0.00 H ATOM 3351 H2 WAT 8418 124.470 52.266 121.931 1.00 0.00 H TER 3353 WAT 8418 ATOM 3353 O WAT 8419 96.070 132.455 20.332 1.00 0.00 O ATOM 3354 H1 WAT 8419 95.478 133.183 20.521 1.00 0.00 H ATOM 3355 H2 WAT 8419 95.590 131.676 20.614 1.00 0.00 H TER 3357 WAT 8419 ATOM 3357 O WAT 8420 19.960 137.114 148.836 1.00 0.00 O ATOM 3358 H1 WAT 8420 20.842 136.996 148.482 1.00 0.00 H ATOM 3359 H2 WAT 8420 19.558 136.248 148.773 1.00 0.00 H TER 3361 WAT 8420 ATOM 3361 O WAT 8421 48.932 92.346 88.841 1.00 0.00 O ATOM 3362 H1 WAT 8421 49.587 92.053 88.209 1.00 0.00 H ATOM 3363 H2 WAT 8421 49.417 92.449 89.660 1.00 0.00 H TER 3365 WAT 8421 ATOM 3365 O WAT 8422 11.260 76.642 140.747 1.00 0.00 O ATOM 3366 H1 WAT 8422 11.152 77.588 140.848 1.00 0.00 H ATOM 3367 H2 WAT 8422 10.475 76.360 140.277 1.00 0.00 H TER 3369 WAT 8422 ATOM 3369 O WAT 8423 131.070 125.285 123.269 1.00 0.00 O ATOM 3370 H1 WAT 8423 130.880 126.029 122.698 1.00 0.00 H ATOM 3371 H2 WAT 8423 130.394 124.641 123.056 1.00 0.00 H TER 3373 WAT 8423 ATOM 3373 O WAT 8424 42.879 70.877 11.927 1.00 0.00 O ATOM 3374 H1 WAT 8424 42.995 70.836 10.978 1.00 0.00 H ATOM 3375 H2 WAT 8424 42.626 69.988 12.176 1.00 0.00 H TER 3377 WAT 8424 ATOM 3377 O WAT 8425 58.604 0.229 105.646 1.00 0.00 O ATOM 3378 H1 WAT 8425 57.754 0.666 105.607 1.00 0.00 H ATOM 3379 H2 WAT 8425 58.757 -0.077 104.752 1.00 0.00 H TER 3381 WAT 8425 ATOM 3381 O WAT 8426 47.887 74.063 1.589 1.00 0.00 O ATOM 3382 H1 WAT 8426 48.406 73.414 1.114 1.00 0.00 H ATOM 3383 H2 WAT 8426 47.017 74.009 1.195 1.00 0.00 H TER 3385 WAT 8426 ATOM 3385 O WAT 8427 76.310 119.444 5.735 1.00 0.00 O ATOM 3386 H1 WAT 8427 75.397 119.166 5.812 1.00 0.00 H ATOM 3387 H2 WAT 8427 76.403 119.709 4.819 1.00 0.00 H TER 3389 WAT 8427 ATOM 3389 O WAT 8428 60.048 92.246 66.909 1.00 0.00 O ATOM 3390 H1 WAT 8428 59.569 93.035 66.657 1.00 0.00 H ATOM 3391 H2 WAT 8428 60.823 92.572 67.366 1.00 0.00 H TER 3393 WAT 8428 ATOM 3393 O WAT 8429 90.277 61.358 95.313 1.00 0.00 O ATOM 3394 H1 WAT 8429 90.224 60.535 95.800 1.00 0.00 H ATOM 3395 H2 WAT 8429 90.914 61.185 94.620 1.00 0.00 H TER 3397 WAT 8429 ATOM 3397 O WAT 8430 13.931 58.262 9.934 1.00 0.00 O ATOM 3398 H1 WAT 8430 14.381 57.445 10.150 1.00 0.00 H ATOM 3399 H2 WAT 8430 13.956 58.771 10.744 1.00 0.00 H TER 3401 WAT 8430 ATOM 3401 O WAT 8431 2.461 6.272 100.946 1.00 0.00 O ATOM 3402 H1 WAT 8431 3.098 6.907 101.273 1.00 0.00 H ATOM 3403 H2 WAT 8431 2.316 5.677 101.681 1.00 0.00 H TER 3405 WAT 8431 ATOM 3405 O WAT 8432 115.780 54.950 70.581 1.00 0.00 O ATOM 3406 H1 WAT 8432 115.793 54.682 69.662 1.00 0.00 H ATOM 3407 H2 WAT 8432 115.368 54.217 71.039 1.00 0.00 H TER 3409 WAT 8432 ATOM 3409 O WAT 8433 60.760 25.686 84.297 1.00 0.00 O ATOM 3410 H1 WAT 8433 60.686 26.216 83.504 1.00 0.00 H ATOM 3411 H2 WAT 8433 61.189 26.261 84.931 1.00 0.00 H TER 3413 WAT 8433 ATOM 3413 O WAT 8434 109.633 47.233 129.650 1.00 0.00 O ATOM 3414 H1 WAT 8434 109.974 46.342 129.720 1.00 0.00 H ATOM 3415 H2 WAT 8434 109.783 47.475 128.736 1.00 0.00 H TER 3417 WAT 8434 ATOM 3417 O WAT 8435 68.374 26.481 60.141 1.00 0.00 O ATOM 3418 H1 WAT 8435 68.899 26.328 59.356 1.00 0.00 H ATOM 3419 H2 WAT 8435 68.902 26.125 60.856 1.00 0.00 H TER 3421 WAT 8435 ATOM 3421 O WAT 8436 57.559 128.972 13.716 1.00 0.00 O ATOM 3422 H1 WAT 8436 56.824 128.828 14.311 1.00 0.00 H ATOM 3423 H2 WAT 8436 58.238 129.365 14.265 1.00 0.00 H TER 3425 WAT 8436 ATOM 3425 O WAT 8437 11.230 110.841 132.355 1.00 0.00 O ATOM 3426 H1 WAT 8437 10.834 111.695 132.183 1.00 0.00 H ATOM 3427 H2 WAT 8437 11.876 111.010 133.041 1.00 0.00 H TER 3429 WAT 8437 ATOM 3429 O WAT 8438 92.676 99.694 147.405 1.00 0.00 O ATOM 3430 H1 WAT 8438 93.368 100.188 146.966 1.00 0.00 H ATOM 3431 H2 WAT 8438 91.916 99.783 146.830 1.00 0.00 H TER 3433 WAT 8438 ATOM 3433 O WAT 8439 29.490 135.950 136.440 1.00 0.00 O ATOM 3434 H1 WAT 8439 29.949 136.699 136.059 1.00 0.00 H ATOM 3435 H2 WAT 8439 29.528 135.275 135.762 1.00 0.00 H TER 3437 WAT 8439 ATOM 3437 O WAT 8440 108.689 17.637 135.278 1.00 0.00 O ATOM 3438 H1 WAT 8440 108.758 18.531 135.612 1.00 0.00 H ATOM 3439 H2 WAT 8440 108.291 17.735 134.412 1.00 0.00 H TER 3441 WAT 8440 ATOM 3441 O WAT 8441 113.224 139.794 56.997 1.00 0.00 O ATOM 3442 H1 WAT 8441 112.912 139.575 56.120 1.00 0.00 H ATOM 3443 H2 WAT 8441 113.660 140.640 56.893 1.00 0.00 H TER 3445 WAT 8441 ATOM 3445 O WAT 8442 98.597 98.319 150.778 1.00 0.00 O ATOM 3446 H1 WAT 8442 99.182 99.075 150.738 1.00 0.00 H ATOM 3447 H2 WAT 8442 99.182 97.561 150.753 1.00 0.00 H TER 3449 WAT 8442 ATOM 3449 O WAT 8443 129.884 41.697 60.083 1.00 0.00 O ATOM 3450 H1 WAT 8443 129.379 41.888 59.293 1.00 0.00 H ATOM 3451 H2 WAT 8443 130.536 42.396 60.125 1.00 0.00 H TER 3453 WAT 8443 ATOM 3453 O WAT 8444 39.089 7.586 27.151 1.00 0.00 O ATOM 3454 H1 WAT 8444 38.418 8.261 27.252 1.00 0.00 H ATOM 3455 H2 WAT 8444 39.423 7.712 26.262 1.00 0.00 H TER 3457 WAT 8444 ATOM 3457 O WAT 8445 86.449 75.864 12.108 1.00 0.00 O ATOM 3458 H1 WAT 8445 86.889 75.079 12.434 1.00 0.00 H ATOM 3459 H2 WAT 8445 86.013 76.231 12.877 1.00 0.00 H TER 3461 WAT 8445 ATOM 3461 O WAT 8446 52.322 91.864 81.898 1.00 0.00 O ATOM 3462 H1 WAT 8446 52.630 92.224 82.730 1.00 0.00 H ATOM 3463 H2 WAT 8446 51.539 91.365 82.129 1.00 0.00 H TER 3465 WAT 8446 ATOM 3465 O WAT 8447 19.692 38.097 82.124 1.00 0.00 O ATOM 3466 H1 WAT 8447 19.767 38.546 82.966 1.00 0.00 H ATOM 3467 H2 WAT 8447 18.767 38.179 81.890 1.00 0.00 H TER 3469 WAT 8447 ATOM 3469 O WAT 8448 117.851 106.161 99.683 1.00 0.00 O ATOM 3470 H1 WAT 8448 117.348 105.495 100.151 1.00 0.00 H ATOM 3471 H2 WAT 8448 117.253 106.483 99.008 1.00 0.00 H TER 3473 WAT 8448 ATOM 3473 O WAT 8449 39.192 77.092 21.284 1.00 0.00 O ATOM 3474 H1 WAT 8449 38.547 77.180 21.985 1.00 0.00 H ATOM 3475 H2 WAT 8449 38.671 77.072 20.481 1.00 0.00 H TER 3477 WAT 8449 ATOM 3477 O WAT 8450 3.039 121.867 115.281 1.00 0.00 O ATOM 3478 H1 WAT 8450 2.893 122.677 115.770 1.00 0.00 H ATOM 3479 H2 WAT 8450 3.397 122.156 114.441 1.00 0.00 H TER 3481 WAT 8450 ATOM 3481 O WAT 8451 7.217 36.595 80.127 1.00 0.00 O ATOM 3482 H1 WAT 8451 7.663 36.244 80.897 1.00 0.00 H ATOM 3483 H2 WAT 8451 6.286 36.533 80.341 1.00 0.00 H TER 3485 WAT 8451 ATOM 3485 O WAT 8452 40.038 24.865 8.901 1.00 0.00 O ATOM 3486 H1 WAT 8452 40.848 24.489 8.558 1.00 0.00 H ATOM 3487 H2 WAT 8452 40.300 25.296 9.715 1.00 0.00 H TER 3489 WAT 8452 ATOM 3489 O WAT 8453 47.516 41.070 115.219 1.00 0.00 O ATOM 3490 H1 WAT 8453 47.569 40.620 114.376 1.00 0.00 H ATOM 3491 H2 WAT 8453 48.426 41.262 115.446 1.00 0.00 H TER 3493 WAT 8453 ATOM 3493 O WAT 8454 99.220 80.127 108.023 1.00 0.00 O ATOM 3494 H1 WAT 8454 99.714 80.552 107.322 1.00 0.00 H ATOM 3495 H2 WAT 8454 98.382 80.588 108.039 1.00 0.00 H TER 3497 WAT 8454 ATOM 3497 O WAT 8455 132.714 38.175 138.578 1.00 0.00 O ATOM 3498 H1 WAT 8455 133.437 38.781 138.739 1.00 0.00 H ATOM 3499 H2 WAT 8455 132.443 37.889 139.451 1.00 0.00 H TER 3501 WAT 8455 ATOM 3501 O WAT 8456 63.698 126.580 96.776 1.00 0.00 O ATOM 3502 H1 WAT 8456 64.137 127.127 97.428 1.00 0.00 H ATOM 3503 H2 WAT 8456 63.025 127.148 96.401 1.00 0.00 H TER 3505 WAT 8456 ATOM 3505 O WAT 8457 64.009 79.493 149.731 1.00 0.00 O ATOM 3506 H1 WAT 8457 64.493 79.321 150.538 1.00 0.00 H ATOM 3507 H2 WAT 8457 63.109 79.233 149.930 1.00 0.00 H TER 3509 WAT 8457 ATOM 3509 O WAT 8458 127.039 32.216 9.838 1.00 0.00 O ATOM 3510 H1 WAT 8458 127.304 31.402 10.267 1.00 0.00 H ATOM 3511 H2 WAT 8458 127.291 32.904 10.453 1.00 0.00 H TER 3513 WAT 8458 ATOM 3513 O WAT 8459 34.598 43.046 21.359 1.00 0.00 O ATOM 3514 H1 WAT 8459 34.809 43.464 22.194 1.00 0.00 H ATOM 3515 H2 WAT 8459 33.654 43.167 21.261 1.00 0.00 H TER 3517 WAT 8459 ATOM 3517 O WAT 8460 137.821 56.457 56.330 1.00 0.00 O ATOM 3518 H1 WAT 8460 138.460 56.575 57.032 1.00 0.00 H ATOM 3519 H2 WAT 8460 138.058 55.622 55.928 1.00 0.00 H TER 3521 WAT 8460 ATOM 3521 O WAT 8461 90.609 102.776 113.393 1.00 0.00 O ATOM 3522 H1 WAT 8461 90.226 101.916 113.220 1.00 0.00 H ATOM 3523 H2 WAT 8461 90.222 103.047 114.225 1.00 0.00 H TER 3525 WAT 8461 ATOM 3525 O WAT 8462 86.333 103.200 138.818 1.00 0.00 O ATOM 3526 H1 WAT 8462 86.364 102.883 137.916 1.00 0.00 H ATOM 3527 H2 WAT 8462 87.251 103.298 139.070 1.00 0.00 H TER 3529 WAT 8462 ATOM 3529 O WAT 8463 69.973 102.796 90.936 1.00 0.00 O ATOM 3530 H1 WAT 8463 69.963 103.355 90.159 1.00 0.00 H ATOM 3531 H2 WAT 8463 69.306 102.132 90.762 1.00 0.00 H TER 3533 WAT 8463 ATOM 3533 O WAT 8464 134.477 66.337 60.984 1.00 0.00 O ATOM 3534 H1 WAT 8464 135.043 66.177 60.229 1.00 0.00 H ATOM 3535 H2 WAT 8464 134.252 67.265 60.922 1.00 0.00 H TER 3537 WAT 8464 ATOM 3537 O WAT 8465 32.652 85.316 135.501 1.00 0.00 O ATOM 3538 H1 WAT 8465 33.057 85.131 136.348 1.00 0.00 H ATOM 3539 H2 WAT 8465 33.353 85.173 134.865 1.00 0.00 H TER 3541 WAT 8465 ATOM 3541 O WAT 8466 113.239 2.718 133.487 1.00 0.00 O ATOM 3542 H1 WAT 8466 113.210 2.916 134.423 1.00 0.00 H ATOM 3543 H2 WAT 8466 114.088 2.295 133.359 1.00 0.00 H TER 3545 WAT 8466 ATOM 3545 O WAT 8467 50.609 97.753 132.952 1.00 0.00 O ATOM 3546 H1 WAT 8467 49.807 97.467 133.389 1.00 0.00 H ATOM 3547 H2 WAT 8467 51.291 97.660 133.617 1.00 0.00 H TER 3549 WAT 8467 ATOM 3549 O WAT 8468 77.228 113.070 76.393 1.00 0.00 O ATOM 3550 H1 WAT 8468 78.119 112.722 76.354 1.00 0.00 H ATOM 3551 H2 WAT 8468 77.322 113.995 76.167 1.00 0.00 H TER 3553 WAT 8468 ATOM 3553 O WAT 8469 17.816 44.501 100.738 1.00 0.00 O ATOM 3554 H1 WAT 8469 17.215 43.909 101.189 1.00 0.00 H ATOM 3555 H2 WAT 8469 18.630 44.443 101.238 1.00 0.00 H TER 3557 WAT 8469 ATOM 3557 O WAT 8470 6.144 64.624 3.900 1.00 0.00 O ATOM 3558 H1 WAT 8470 5.586 64.457 3.140 1.00 0.00 H ATOM 3559 H2 WAT 8470 5.533 64.864 4.597 1.00 0.00 H TER 3561 WAT 8470 ATOM 3561 O WAT 8471 76.050 65.462 110.603 1.00 0.00 O ATOM 3562 H1 WAT 8471 76.642 66.190 110.794 1.00 0.00 H ATOM 3563 H2 WAT 8471 75.387 65.838 110.024 1.00 0.00 H TER 3565 WAT 8471 ATOM 3565 O WAT 8472 92.104 13.587 136.163 1.00 0.00 O ATOM 3566 H1 WAT 8472 91.444 14.135 136.588 1.00 0.00 H ATOM 3567 H2 WAT 8472 92.783 13.471 136.827 1.00 0.00 H TER 3569 WAT 8472 ATOM 3569 O WAT 8473 57.850 74.660 11.089 1.00 0.00 O ATOM 3570 H1 WAT 8473 56.912 74.849 11.056 1.00 0.00 H ATOM 3571 H2 WAT 8473 58.221 75.160 10.362 1.00 0.00 H TER 3573 WAT 8473 ATOM 3573 O WAT 8474 121.791 77.742 4.229 1.00 0.00 O ATOM 3574 H1 WAT 8474 121.513 76.889 3.895 1.00 0.00 H ATOM 3575 H2 WAT 8474 121.851 78.296 3.451 1.00 0.00 H TER 3577 WAT 8474 ATOM 3577 O WAT 8475 98.060 35.496 52.662 1.00 0.00 O ATOM 3578 H1 WAT 8475 98.793 35.967 52.266 1.00 0.00 H ATOM 3579 H2 WAT 8475 98.386 34.604 52.784 1.00 0.00 H TER 3581 WAT 8475 ATOM 3581 O WAT 8476 92.870 93.165 139.890 1.00 0.00 O ATOM 3582 H1 WAT 8476 92.013 93.545 139.694 1.00 0.00 H ATOM 3583 H2 WAT 8476 92.814 92.914 140.812 1.00 0.00 H TER 3585 WAT 8476 ATOM 3585 O WAT 8477 94.258 94.119 92.770 1.00 0.00 O ATOM 3586 H1 WAT 8477 93.769 93.300 92.687 1.00 0.00 H ATOM 3587 H2 WAT 8477 94.833 93.979 93.522 1.00 0.00 H TER 3589 WAT 8477 ATOM 3589 O WAT 8478 116.205 70.052 82.091 1.00 0.00 O ATOM 3590 H1 WAT 8478 115.429 69.493 82.125 1.00 0.00 H ATOM 3591 H2 WAT 8478 116.901 69.475 81.776 1.00 0.00 H TER 3593 WAT 8478 ATOM 3593 O WAT 8479 105.310 79.791 104.162 1.00 0.00 O ATOM 3594 H1 WAT 8479 105.819 79.071 104.533 1.00 0.00 H ATOM 3595 H2 WAT 8479 104.497 79.382 103.864 1.00 0.00 H TER 3597 WAT 8479 ATOM 3597 O WAT 8480 103.036 112.248 114.012 1.00 0.00 O ATOM 3598 H1 WAT 8480 102.791 112.190 113.089 1.00 0.00 H ATOM 3599 H2 WAT 8480 102.868 113.160 114.248 1.00 0.00 H TER 3601 WAT 8480 ATOM 3601 O WAT 8481 6.395 80.378 108.236 1.00 0.00 O ATOM 3602 H1 WAT 8481 7.094 79.733 108.130 1.00 0.00 H ATOM 3603 H2 WAT 8481 5.603 79.855 108.356 1.00 0.00 H TER 3605 WAT 8481 ATOM 3605 O WAT 8482 39.649 65.136 18.051 1.00 0.00 O ATOM 3606 H1 WAT 8482 38.807 64.956 17.633 1.00 0.00 H ATOM 3607 H2 WAT 8482 39.860 64.330 18.523 1.00 0.00 H TER 3609 WAT 8482 ATOM 3609 O WAT 8483 123.980 68.206 116.331 1.00 0.00 O ATOM 3610 H1 WAT 8483 123.254 68.542 115.804 1.00 0.00 H ATOM 3611 H2 WAT 8483 124.607 67.874 115.689 1.00 0.00 H TER 3613 WAT 8483 ATOM 3613 O WAT 8484 28.447 6.630 129.840 1.00 0.00 O ATOM 3614 H1 WAT 8484 28.623 7.193 130.594 1.00 0.00 H ATOM 3615 H2 WAT 8484 29.313 6.352 129.541 1.00 0.00 H TER 3617 WAT 8484 ATOM 3617 O WAT 8485 126.657 52.628 154.446 1.00 0.00 O ATOM 3618 H1 WAT 8485 127.215 52.803 155.204 1.00 0.00 H ATOM 3619 H2 WAT 8485 125.918 52.135 154.801 1.00 0.00 H TER 3621 WAT 8485 ATOM 3621 O WAT 8486 80.977 110.659 122.658 1.00 0.00 O ATOM 3622 H1 WAT 8486 81.294 109.850 122.258 1.00 0.00 H ATOM 3623 H2 WAT 8486 80.222 110.389 123.181 1.00 0.00 H TER 3625 WAT 8486 ATOM 3625 O WAT 8487 133.626 2.965 153.432 1.00 0.00 O ATOM 3626 H1 WAT 8487 133.810 3.629 152.769 1.00 0.00 H ATOM 3627 H2 WAT 8487 134.430 2.913 153.949 1.00 0.00 H TER 3629 WAT 8487 ATOM 3629 O WAT 8488 10.522 49.187 121.381 1.00 0.00 O ATOM 3630 H1 WAT 8488 11.367 48.938 121.754 1.00 0.00 H ATOM 3631 H2 WAT 8488 10.082 48.354 121.208 1.00 0.00 H TER 3633 WAT 8488 ATOM 3633 O WAT 8489 4.727 117.532 78.255 1.00 0.00 O ATOM 3634 H1 WAT 8489 5.317 116.872 78.618 1.00 0.00 H ATOM 3635 H2 WAT 8489 4.504 117.202 77.385 1.00 0.00 H TER 3637 WAT 8489 ATOM 3637 O WAT 8490 63.785 40.476 100.179 1.00 0.00 O ATOM 3638 H1 WAT 8490 64.639 40.072 100.029 1.00 0.00 H ATOM 3639 H2 WAT 8490 63.171 39.741 100.197 1.00 0.00 H TER 3641 WAT 8490 ATOM 3641 O WAT 8491 46.896 107.841 152.888 1.00 0.00 O ATOM 3642 H1 WAT 8491 46.420 107.703 153.707 1.00 0.00 H ATOM 3643 H2 WAT 8491 47.057 106.958 152.553 1.00 0.00 H TER 3645 WAT 8491 ATOM 3645 O WAT 8492 15.874 118.163 93.161 1.00 0.00 O ATOM 3646 H1 WAT 8492 16.183 117.959 92.278 1.00 0.00 H ATOM 3647 H2 WAT 8492 15.036 118.605 93.025 1.00 0.00 H TER 3649 WAT 8492 ATOM 3649 O WAT 8493 145.193 70.111 114.172 1.00 0.00 O ATOM 3650 H1 WAT 8493 146.073 70.435 113.981 1.00 0.00 H ATOM 3651 H2 WAT 8493 145.108 70.196 115.122 1.00 0.00 H TER 3653 WAT 8493 ATOM 3653 O WAT 8494 17.907 124.760 148.889 1.00 0.00 O ATOM 3654 H1 WAT 8494 17.593 125.385 149.542 1.00 0.00 H ATOM 3655 H2 WAT 8494 18.090 125.293 148.116 1.00 0.00 H TER 3657 WAT 8494 ATOM 3657 O WAT 8495 100.516 33.260 100.262 1.00 0.00 O ATOM 3658 H1 WAT 8495 99.712 32.746 100.339 1.00 0.00 H ATOM 3659 H2 WAT 8495 100.214 34.153 100.096 1.00 0.00 H TER 3661 WAT 8495 ATOM 3661 O WAT 8496 143.136 19.804 21.410 1.00 0.00 O ATOM 3662 H1 WAT 8496 143.317 18.865 21.390 1.00 0.00 H ATOM 3663 H2 WAT 8496 143.935 20.195 21.765 1.00 0.00 H TER 3665 WAT 8496 ATOM 3665 O WAT 8497 51.049 106.896 7.065 1.00 0.00 O ATOM 3666 H1 WAT 8497 50.726 106.595 6.215 1.00 0.00 H ATOM 3667 H2 WAT 8497 50.448 107.596 7.316 1.00 0.00 H TER 3669 WAT 8497 ATOM 3669 O WAT 8498 1.959 131.343 9.836 1.00 0.00 O ATOM 3670 H1 WAT 8498 1.047 131.277 10.119 1.00 0.00 H ATOM 3671 H2 WAT 8498 2.087 132.274 9.655 1.00 0.00 H TER 3673 WAT 8498 ATOM 3673 O WAT 8499 13.806 75.725 77.935 1.00 0.00 O ATOM 3674 H1 WAT 8499 13.138 75.424 78.551 1.00 0.00 H ATOM 3675 H2 WAT 8499 13.953 76.641 78.172 1.00 0.00 H TER 3677 WAT 8499 ATOM 3677 O WAT 8500 130.769 68.270 61.533 1.00 0.00 O ATOM 3678 H1 WAT 8500 130.316 68.234 60.691 1.00 0.00 H ATOM 3679 H2 WAT 8500 131.673 68.491 61.309 1.00 0.00 H TER 3681 WAT 8500 ATOM 3681 O WAT 8501 48.574 100.278 15.690 1.00 0.00 O ATOM 3682 H1 WAT 8501 49.161 100.639 15.026 1.00 0.00 H ATOM 3683 H2 WAT 8501 49.143 99.752 16.252 1.00 0.00 H TER 3685 WAT 8501 ATOM 3685 O WAT 8502 85.163 35.159 14.930 1.00 0.00 O ATOM 3686 H1 WAT 8502 86.003 34.941 14.525 1.00 0.00 H ATOM 3687 H2 WAT 8502 85.386 35.773 15.629 1.00 0.00 H TER 3689 WAT 8502 ATOM 3689 O WAT 8503 93.552 71.728 157.667 1.00 0.00 O ATOM 3690 H1 WAT 8503 93.680 71.026 158.305 1.00 0.00 H ATOM 3691 H2 WAT 8503 93.128 71.301 156.923 1.00 0.00 H TER 3693 WAT 8503 ATOM 3693 O WAT 8504 29.412 131.784 79.331 1.00 0.00 O ATOM 3694 H1 WAT 8504 30.357 131.642 79.268 1.00 0.00 H ATOM 3695 H2 WAT 8504 29.167 131.398 80.171 1.00 0.00 H TER 3697 WAT 8504 ATOM 3697 O WAT 8505 66.783 3.160 140.106 1.00 0.00 O ATOM 3698 H1 WAT 8505 66.459 2.541 140.760 1.00 0.00 H ATOM 3699 H2 WAT 8505 67.712 2.948 140.015 1.00 0.00 H TER 3701 WAT 8505 ATOM 3701 O WAT 8506 110.272 130.241 121.783 1.00 0.00 O ATOM 3702 H1 WAT 8506 109.758 129.471 121.539 1.00 0.00 H ATOM 3703 H2 WAT 8506 110.015 130.911 121.149 1.00 0.00 H TER 3705 WAT 8506 ATOM 3705 O WAT 8507 120.552 66.325 111.802 1.00 0.00 O ATOM 3706 H1 WAT 8507 120.571 67.193 111.400 1.00 0.00 H ATOM 3707 H2 WAT 8507 119.640 66.045 111.726 1.00 0.00 H TER 3709 WAT 8507 ATOM 3709 O WAT 8508 117.316 129.933 150.164 1.00 0.00 O ATOM 3710 H1 WAT 8508 116.389 130.063 150.364 1.00 0.00 H ATOM 3711 H2 WAT 8508 117.336 129.145 149.622 1.00 0.00 H TER 3713 WAT 8508 ATOM 3713 O WAT 8509 113.042 142.917 95.206 1.00 0.00 O ATOM 3714 H1 WAT 8509 112.652 143.525 94.577 1.00 0.00 H ATOM 3715 H2 WAT 8509 113.578 142.332 94.671 1.00 0.00 H TER 3717 WAT 8509 ATOM 3717 O WAT 8510 56.193 21.107 101.095 1.00 0.00 O ATOM 3718 H1 WAT 8510 56.748 21.880 101.196 1.00 0.00 H ATOM 3719 H2 WAT 8510 55.747 21.240 100.259 1.00 0.00 H TER 3721 WAT 8510 ATOM 3721 O WAT 8511 113.499 117.061 99.495 1.00 0.00 O ATOM 3722 H1 WAT 8511 113.199 116.342 100.051 1.00 0.00 H ATOM 3723 H2 WAT 8511 113.830 117.717 100.108 1.00 0.00 H TER 3725 WAT 8511 ATOM 3725 O WAT 8512 111.506 97.972 6.479 1.00 0.00 O ATOM 3726 H1 WAT 8512 111.842 97.147 6.829 1.00 0.00 H ATOM 3727 H2 WAT 8512 111.486 97.840 5.532 1.00 0.00 H TER 3729 WAT 8512 ATOM 3729 O WAT 8513 83.717 69.966 90.226 1.00 0.00 O ATOM 3730 H1 WAT 8513 83.357 69.944 89.340 1.00 0.00 H ATOM 3731 H2 WAT 8513 84.042 70.860 90.331 1.00 0.00 H TER 3733 WAT 8513 ATOM 3733 O WAT 8514 0.951 50.795 100.853 1.00 0.00 O ATOM 3734 H1 WAT 8514 1.783 50.478 100.501 1.00 0.00 H ATOM 3735 H2 WAT 8514 0.311 50.596 100.169 1.00 0.00 H TER 3737 WAT 8514 ATOM 3737 O WAT 8515 18.590 77.971 67.201 1.00 0.00 O ATOM 3738 H1 WAT 8515 17.736 77.638 67.475 1.00 0.00 H ATOM 3739 H2 WAT 8515 18.856 78.558 67.909 1.00 0.00 H TER 3741 WAT 8515 ATOM 3741 O WAT 8516 42.443 126.916 139.713 1.00 0.00 O ATOM 3742 H1 WAT 8516 43.129 126.818 140.373 1.00 0.00 H ATOM 3743 H2 WAT 8516 42.225 127.848 139.732 1.00 0.00 H TER 3745 WAT 8516 ATOM 3745 O WAT 8517 136.897 44.963 81.658 1.00 0.00 O ATOM 3746 H1 WAT 8517 137.511 45.695 81.716 1.00 0.00 H ATOM 3747 H2 WAT 8517 137.095 44.423 82.423 1.00 0.00 H TER 3749 WAT 8517 ATOM 3749 O WAT 8518 130.565 17.637 68.158 1.00 0.00 O ATOM 3750 H1 WAT 8518 130.871 17.904 67.291 1.00 0.00 H ATOM 3751 H2 WAT 8518 129.642 17.891 68.175 1.00 0.00 H TER 3753 WAT 8518 ATOM 3753 O WAT 8519 10.077 65.551 131.182 1.00 0.00 O ATOM 3754 H1 WAT 8519 10.927 65.947 130.992 1.00 0.00 H ATOM 3755 H2 WAT 8519 9.713 65.338 130.323 1.00 0.00 H TER 3757 WAT 8519 ATOM 3757 O WAT 8520 117.161 74.995 152.260 1.00 0.00 O ATOM 3758 H1 WAT 8520 117.547 74.305 152.800 1.00 0.00 H ATOM 3759 H2 WAT 8520 117.882 75.298 151.708 1.00 0.00 H TER 3761 WAT 8520 ATOM 3761 O WAT 8521 22.802 12.418 3.504 1.00 0.00 O ATOM 3762 H1 WAT 8521 22.869 13.355 3.322 1.00 0.00 H ATOM 3763 H2 WAT 8521 22.956 11.998 2.658 1.00 0.00 H TER 3765 WAT 8521 ATOM 3765 O WAT 8522 116.420 15.082 123.625 1.00 0.00 O ATOM 3766 H1 WAT 8522 115.771 14.400 123.799 1.00 0.00 H ATOM 3767 H2 WAT 8522 116.139 15.823 124.160 1.00 0.00 H TER 3769 WAT 8522 ATOM 3769 O WAT 8523 41.535 17.737 66.143 1.00 0.00 O ATOM 3770 H1 WAT 8523 42.162 18.441 66.310 1.00 0.00 H ATOM 3771 H2 WAT 8523 41.794 17.383 65.291 1.00 0.00 H TER 3773 WAT 8523 ATOM 3773 O WAT 8524 92.985 29.278 114.928 1.00 0.00 O ATOM 3774 H1 WAT 8524 92.303 29.932 115.082 1.00 0.00 H ATOM 3775 H2 WAT 8524 92.575 28.637 114.347 1.00 0.00 H TER 3777 WAT 8524 ATOM 3777 O WAT 8525 59.960 135.331 66.413 1.00 0.00 O ATOM 3778 H1 WAT 8525 60.095 136.050 65.795 1.00 0.00 H ATOM 3779 H2 WAT 8525 60.838 135.118 66.728 1.00 0.00 H TER 3781 WAT 8525 ATOM 3781 O WAT 8526 23.418 33.538 73.209 1.00 0.00 O ATOM 3782 H1 WAT 8526 23.444 32.669 73.610 1.00 0.00 H ATOM 3783 H2 WAT 8526 23.148 33.377 72.305 1.00 0.00 H TER 3785 WAT 8526 ATOM 3785 O WAT 8527 35.733 25.695 68.312 1.00 0.00 O ATOM 3786 H1 WAT 8527 35.704 25.888 69.250 1.00 0.00 H ATOM 3787 H2 WAT 8527 36.207 26.434 67.930 1.00 0.00 H TER 3789 WAT 8527 ATOM 3789 O WAT 8528 5.868 86.970 66.565 1.00 0.00 O ATOM 3790 H1 WAT 8528 6.013 87.292 65.676 1.00 0.00 H ATOM 3791 H2 WAT 8528 6.748 86.846 66.922 1.00 0.00 H TER 3793 WAT 8528 ATOM 3793 O WAT 8529 64.296 77.034 61.787 1.00 0.00 O ATOM 3794 H1 WAT 8529 64.506 77.859 61.350 1.00 0.00 H ATOM 3795 H2 WAT 8529 63.370 77.113 62.016 1.00 0.00 H TER 3797 WAT 8529 ATOM 3797 O WAT 8530 106.871 8.722 118.170 1.00 0.00 O ATOM 3798 H1 WAT 8530 106.626 7.799 118.230 1.00 0.00 H ATOM 3799 H2 WAT 8530 106.039 9.185 118.070 1.00 0.00 H TER 3801 WAT 8530 ATOM 3801 O WAT 8531 143.837 30.185 135.020 1.00 0.00 O ATOM 3802 H1 WAT 8531 142.948 30.147 135.373 1.00 0.00 H ATOM 3803 H2 WAT 8531 144.401 29.990 135.768 1.00 0.00 H TER 3805 WAT 8531 ATOM 3805 O WAT 8532 71.734 0.849 88.184 1.00 0.00 O ATOM 3806 H1 WAT 8532 71.594 0.334 87.390 1.00 0.00 H ATOM 3807 H2 WAT 8532 71.040 1.509 88.168 1.00 0.00 H TER 3809 WAT 8532 ATOM 3809 O WAT 8533 14.883 77.397 158.072 1.00 0.00 O ATOM 3810 H1 WAT 8533 15.670 77.032 157.667 1.00 0.00 H ATOM 3811 H2 WAT 8533 14.973 78.343 157.958 1.00 0.00 H TER 3813 WAT 8533 ATOM 3813 O WAT 8534 5.145 111.812 6.409 1.00 0.00 O ATOM 3814 H1 WAT 8534 4.654 112.626 6.522 1.00 0.00 H ATOM 3815 H2 WAT 8534 4.729 111.384 5.661 1.00 0.00 H TER 3817 WAT 8534 ATOM 3817 O WAT 8535 77.434 109.782 138.588 1.00 0.00 O ATOM 3818 H1 WAT 8535 76.779 109.352 139.139 1.00 0.00 H ATOM 3819 H2 WAT 8535 77.289 109.416 137.715 1.00 0.00 H TER 3821 WAT 8535 ATOM 3821 O WAT 8536 101.170 32.671 109.790 1.00 0.00 O ATOM 3822 H1 WAT 8536 101.707 32.454 109.028 1.00 0.00 H ATOM 3823 H2 WAT 8536 101.018 31.831 110.223 1.00 0.00 H TER 3825 WAT 8536 ATOM 3825 O WAT 8537 134.356 15.018 124.780 1.00 0.00 O ATOM 3826 H1 WAT 8537 134.663 15.921 124.700 1.00 0.00 H ATOM 3827 H2 WAT 8537 135.070 14.561 125.224 1.00 0.00 H TER 3829 WAT 8537 ATOM 3829 O WAT 8538 99.869 29.495 145.201 1.00 0.00 O ATOM 3830 H1 WAT 8538 99.514 30.104 145.849 1.00 0.00 H ATOM 3831 H2 WAT 8538 100.752 29.819 145.025 1.00 0.00 H TER 3833 WAT 8538 ATOM 3833 O WAT 8539 25.149 62.059 3.745 1.00 0.00 O ATOM 3834 H1 WAT 8539 26.010 62.175 3.343 1.00 0.00 H ATOM 3835 H2 WAT 8539 25.094 62.755 4.400 1.00 0.00 H TER 3837 WAT 8539 ATOM 3837 O WAT 8540 30.853 34.788 107.506 1.00 0.00 O ATOM 3838 H1 WAT 8540 31.210 35.201 106.719 1.00 0.00 H ATOM 3839 H2 WAT 8540 31.616 34.420 107.950 1.00 0.00 H TER 3841 WAT 8540 ATOM 3841 O WAT 8541 99.462 42.498 107.036 1.00 0.00 O ATOM 3842 H1 WAT 8541 99.289 43.436 106.959 1.00 0.00 H ATOM 3843 H2 WAT 8541 99.450 42.329 107.978 1.00 0.00 H TER 3845 WAT 8541 ATOM 3845 O WAT 8542 141.695 16.692 64.752 1.00 0.00 O ATOM 3846 H1 WAT 8542 142.282 17.203 65.310 1.00 0.00 H ATOM 3847 H2 WAT 8542 142.059 16.786 63.872 1.00 0.00 H TER 3849 WAT 8542 ATOM 3849 O WAT 8543 127.402 25.390 152.295 1.00 0.00 O ATOM 3850 H1 WAT 8543 126.826 24.723 152.670 1.00 0.00 H ATOM 3851 H2 WAT 8543 127.660 25.033 151.445 1.00 0.00 H TER 3853 WAT 8543 ATOM 3853 O WAT 8544 111.816 70.618 91.126 1.00 0.00 O ATOM 3854 H1 WAT 8544 111.680 70.910 92.027 1.00 0.00 H ATOM 3855 H2 WAT 8544 112.714 70.285 91.115 1.00 0.00 H TER 3857 WAT 8544 ATOM 3857 O WAT 8545 120.364 8.422 88.675 1.00 0.00 O ATOM 3858 H1 WAT 8545 119.593 8.954 88.482 1.00 0.00 H ATOM 3859 H2 WAT 8545 120.473 8.491 89.624 1.00 0.00 H TER 3861 WAT 8545 ATOM 3861 O WAT 8546 84.066 90.756 54.986 1.00 0.00 O ATOM 3862 H1 WAT 8546 84.486 91.367 54.381 1.00 0.00 H ATOM 3863 H2 WAT 8546 83.163 90.692 54.673 1.00 0.00 H TER 3865 WAT 8546 ATOM 3865 O WAT 8547 144.014 118.241 131.334 1.00 0.00 O ATOM 3866 H1 WAT 8547 144.044 119.189 131.202 1.00 0.00 H ATOM 3867 H2 WAT 8547 144.914 117.951 131.188 1.00 0.00 H TER 3869 WAT 8547 ATOM 3869 O WAT 8548 33.366 136.665 98.633 1.00 0.00 O ATOM 3870 H1 WAT 8548 32.863 136.160 97.994 1.00 0.00 H ATOM 3871 H2 WAT 8548 33.699 137.413 98.137 1.00 0.00 H TER 3873 WAT 8548 ATOM 3873 O WAT 8549 49.792 57.865 79.662 1.00 0.00 O ATOM 3874 H1 WAT 8549 49.482 57.051 79.264 1.00 0.00 H ATOM 3875 H2 WAT 8549 50.194 57.591 80.486 1.00 0.00 H TER 3877 WAT 8549 ATOM 3877 O WAT 8550 129.267 28.413 121.089 1.00 0.00 O ATOM 3878 H1 WAT 8550 128.430 28.147 121.470 1.00 0.00 H ATOM 3879 H2 WAT 8550 129.874 27.714 121.332 1.00 0.00 H TER 3881 WAT 8550 ATOM 3881 O WAT 8551 50.622 72.900 88.238 1.00 0.00 O ATOM 3882 H1 WAT 8551 51.187 73.672 88.276 1.00 0.00 H ATOM 3883 H2 WAT 8551 51.057 72.258 88.798 1.00 0.00 H TER 3885 WAT 8551 ATOM 3885 O WAT 8552 8.703 55.130 70.022 1.00 0.00 O ATOM 3886 H1 WAT 8552 8.762 56.076 70.151 1.00 0.00 H ATOM 3887 H2 WAT 8552 8.557 55.024 69.082 1.00 0.00 H TER 3889 WAT 8552 ATOM 3889 O WAT 8553 130.579 41.750 158.775 1.00 0.00 O ATOM 3890 H1 WAT 8553 130.838 41.008 158.229 1.00 0.00 H ATOM 3891 H2 WAT 8553 130.831 42.521 158.267 1.00 0.00 H TER 3893 WAT 8553 ATOM 3893 O WAT 8554 37.420 125.342 110.473 1.00 0.00 O ATOM 3894 H1 WAT 8554 37.055 124.458 110.500 1.00 0.00 H ATOM 3895 H2 WAT 8554 37.458 125.613 111.390 1.00 0.00 H TER 3897 WAT 8554 ATOM 3897 O WAT 8555 52.418 93.363 107.181 1.00 0.00 O ATOM 3898 H1 WAT 8555 52.158 93.454 106.264 1.00 0.00 H ATOM 3899 H2 WAT 8555 51.592 93.355 107.665 1.00 0.00 H TER 3901 WAT 8555 ATOM 3901 O WAT 8556 51.218 44.090 139.650 1.00 0.00 O ATOM 3902 H1 WAT 8556 50.394 43.724 139.974 1.00 0.00 H ATOM 3903 H2 WAT 8556 51.271 44.955 140.056 1.00 0.00 H TER 3905 WAT 8556 ATOM 3905 O WAT 8557 96.941 54.510 150.600 1.00 0.00 O ATOM 3906 H1 WAT 8557 96.395 55.000 149.985 1.00 0.00 H ATOM 3907 H2 WAT 8557 97.507 55.172 150.997 1.00 0.00 H TER 3909 WAT 8557 ATOM 3909 O WAT 8558 129.461 33.134 4.563 1.00 0.00 O ATOM 3910 H1 WAT 8558 129.951 32.512 5.102 1.00 0.00 H ATOM 3911 H2 WAT 8558 129.042 33.719 5.193 1.00 0.00 H TER 3913 WAT 8558 ATOM 3913 O WAT 8559 123.787 67.436 104.916 1.00 0.00 O ATOM 3914 H1 WAT 8559 123.647 68.106 104.247 1.00 0.00 H ATOM 3915 H2 WAT 8559 123.663 66.607 104.454 1.00 0.00 H TER 3917 WAT 8559 ATOM 3917 O WAT 8560 116.261 89.944 103.881 1.00 0.00 O ATOM 3918 H1 WAT 8560 116.707 90.207 103.075 1.00 0.00 H ATOM 3919 H2 WAT 8560 116.905 89.412 104.348 1.00 0.00 H TER 3921 WAT 8560 ATOM 3921 O WAT 8561 36.280 11.457 134.611 1.00 0.00 O ATOM 3922 H1 WAT 8561 36.630 11.871 133.823 1.00 0.00 H ATOM 3923 H2 WAT 8561 35.486 11.954 134.810 1.00 0.00 H TER 3925 WAT 8561 ATOM 3925 O WAT 8562 22.475 85.173 3.115 1.00 0.00 O ATOM 3926 H1 WAT 8562 22.130 85.408 3.976 1.00 0.00 H ATOM 3927 H2 WAT 8562 23.341 85.579 3.085 1.00 0.00 H TER 3929 WAT 8562 ATOM 3929 O WAT 8563 25.779 6.631 81.943 1.00 0.00 O ATOM 3930 H1 WAT 8563 26.341 5.883 81.739 1.00 0.00 H ATOM 3931 H2 WAT 8563 25.995 7.282 81.275 1.00 0.00 H TER 3933 WAT 8563 ATOM 3933 O WAT 8564 50.186 22.813 145.793 1.00 0.00 O ATOM 3934 H1 WAT 8564 50.171 23.740 146.032 1.00 0.00 H ATOM 3935 H2 WAT 8564 51.110 22.568 145.844 1.00 0.00 H TER 3937 WAT 8564 ATOM 3937 O WAT 8565 80.779 132.835 14.656 1.00 0.00 O ATOM 3938 H1 WAT 8565 81.505 133.326 15.042 1.00 0.00 H ATOM 3939 H2 WAT 8565 80.138 132.759 15.362 1.00 0.00 H TER 3941 WAT 8565 ATOM 3941 O WAT 8566 107.959 98.858 13.516 1.00 0.00 O ATOM 3942 H1 WAT 8566 108.273 99.709 13.211 1.00 0.00 H ATOM 3943 H2 WAT 8566 107.382 99.065 14.251 1.00 0.00 H TER 3945 WAT 8566 ATOM 3945 O WAT 8567 3.812 53.401 95.439 1.00 0.00 O ATOM 3946 H1 WAT 8567 4.197 53.404 96.316 1.00 0.00 H ATOM 3947 H2 WAT 8567 4.141 54.202 95.030 1.00 0.00 H TER 3949 WAT 8567 ATOM 3949 O WAT 8568 63.609 97.877 115.725 1.00 0.00 O ATOM 3950 H1 WAT 8568 64.269 98.488 116.052 1.00 0.00 H ATOM 3951 H2 WAT 8568 63.898 97.020 116.038 1.00 0.00 H TER 3953 WAT 8568 ATOM 3953 O WAT 8569 55.685 51.965 145.255 1.00 0.00 O ATOM 3954 H1 WAT 8569 56.252 51.220 145.456 1.00 0.00 H ATOM 3955 H2 WAT 8569 55.034 51.613 144.648 1.00 0.00 H TER 3957 WAT 8569 ATOM 3957 O WAT 8570 56.004 142.992 101.003 1.00 0.00 O ATOM 3958 H1 WAT 8570 56.098 142.192 100.486 1.00 0.00 H ATOM 3959 H2 WAT 8570 55.777 142.685 101.880 1.00 0.00 H TER 3961 WAT 8570 ATOM 3961 O WAT 8571 115.108 66.782 142.275 1.00 0.00 O ATOM 3962 H1 WAT 8571 116.018 66.681 141.993 1.00 0.00 H ATOM 3963 H2 WAT 8571 114.800 65.887 142.416 1.00 0.00 H TER 3965 WAT 8571 ATOM 3965 O WAT 8572 63.379 124.813 59.106 1.00 0.00 O ATOM 3966 H1 WAT 8572 63.825 123.972 59.204 1.00 0.00 H ATOM 3967 H2 WAT 8572 62.803 124.692 58.351 1.00 0.00 H TER 3969 WAT 8572 ATOM 3969 O WAT 8573 45.696 65.521 77.583 1.00 0.00 O ATOM 3970 H1 WAT 8573 44.785 65.400 77.315 1.00 0.00 H ATOM 3971 H2 WAT 8573 46.048 66.152 76.954 1.00 0.00 H TER 3973 WAT 8573 ATOM 3973 O WAT 8574 30.608 15.750 95.806 1.00 0.00 O ATOM 3974 H1 WAT 8574 30.206 16.505 96.236 1.00 0.00 H ATOM 3975 H2 WAT 8574 30.552 15.949 94.871 1.00 0.00 H TER 3977 WAT 8574 ATOM 3977 O WAT 8575 19.281 9.245 127.795 1.00 0.00 O ATOM 3978 H1 WAT 8575 18.522 9.330 128.371 1.00 0.00 H ATOM 3979 H2 WAT 8575 19.975 8.905 128.361 1.00 0.00 H TER 3981 WAT 8575 ATOM 3981 O WAT 8576 21.731 121.056 154.908 1.00 0.00 O ATOM 3982 H1 WAT 8576 20.775 121.096 154.871 1.00 0.00 H ATOM 3983 H2 WAT 8576 22.010 121.157 153.998 1.00 0.00 H TER 3985 WAT 8576 ATOM 3985 O WAT 8577 41.199 109.641 8.583 1.00 0.00 O ATOM 3986 H1 WAT 8577 42.010 109.961 8.978 1.00 0.00 H ATOM 3987 H2 WAT 8577 40.689 110.432 8.410 1.00 0.00 H TER 3989 WAT 8577 ATOM 3989 O WAT 8578 57.725 69.863 -0.039 1.00 0.00 O ATOM 3990 H1 WAT 8578 57.243 70.679 0.094 1.00 0.00 H ATOM 3991 H2 WAT 8578 57.297 69.234 0.542 1.00 0.00 H TER 3993 WAT 8578 ATOM 3993 O WAT 8579 53.236 129.419 100.816 1.00 0.00 O ATOM 3994 H1 WAT 8579 53.688 129.567 99.985 1.00 0.00 H ATOM 3995 H2 WAT 8579 53.886 129.634 101.485 1.00 0.00 H TER 3997 WAT 8579 ATOM 3997 O WAT 8580 40.696 92.311 154.021 1.00 0.00 O ATOM 3998 H1 WAT 8580 40.417 91.446 154.321 1.00 0.00 H ATOM 3999 H2 WAT 8580 39.926 92.672 153.582 1.00 0.00 H TER 4001 WAT 8580 ATOM 4001 O WAT 8581 84.018 29.959 154.843 1.00 0.00 O ATOM 4002 H1 WAT 8581 83.964 30.496 154.052 1.00 0.00 H ATOM 4003 H2 WAT 8581 83.463 29.202 154.655 1.00 0.00 H TER 4005 WAT 8581 ATOM 4005 O WAT 8582 112.003 110.126 75.970 1.00 0.00 O ATOM 4006 H1 WAT 8582 112.647 110.064 75.265 1.00 0.00 H ATOM 4007 H2 WAT 8582 111.159 110.003 75.535 1.00 0.00 H TER 4009 WAT 8582 ATOM 4009 O WAT 8583 92.005 115.707 20.514 1.00 0.00 O ATOM 4010 H1 WAT 8583 92.904 116.035 20.540 1.00 0.00 H ATOM 4011 H2 WAT 8583 92.055 114.842 20.921 1.00 0.00 H TER 4013 WAT 8583 ATOM 4013 O WAT 8584 81.348 125.759 68.409 1.00 0.00 O ATOM 4014 H1 WAT 8584 82.280 125.963 68.331 1.00 0.00 H ATOM 4015 H2 WAT 8584 81.065 126.225 69.196 1.00 0.00 H TER 4017 WAT 8584 ATOM 4017 O WAT 8585 63.379 53.831 14.615 1.00 0.00 O ATOM 4018 H1 WAT 8585 63.096 53.964 13.711 1.00 0.00 H ATOM 4019 H2 WAT 8585 62.778 54.364 15.135 1.00 0.00 H TER 4021 WAT 8585 ATOM 4021 O WAT 8586 70.596 54.271 24.392 1.00 0.00 O ATOM 4022 H1 WAT 8586 69.680 54.112 24.620 1.00 0.00 H ATOM 4023 H2 WAT 8586 70.582 54.440 23.450 1.00 0.00 H TER 4025 WAT 8586 ATOM 4025 O WAT 8587 30.091 119.007 110.294 1.00 0.00 O ATOM 4026 H1 WAT 8587 31.036 119.100 110.410 1.00 0.00 H ATOM 4027 H2 WAT 8587 29.886 118.154 110.676 1.00 0.00 H TER 4029 WAT 8587 ATOM 4029 O WAT 8588 103.222 121.193 85.989 1.00 0.00 O ATOM 4030 H1 WAT 8588 102.989 121.447 86.882 1.00 0.00 H ATOM 4031 H2 WAT 8588 103.256 120.237 86.014 1.00 0.00 H TER 4033 WAT 8588 ATOM 4033 O WAT 8589 77.045 21.426 7.490 1.00 0.00 O ATOM 4034 H1 WAT 8589 76.929 21.208 6.566 1.00 0.00 H ATOM 4035 H2 WAT 8589 77.166 20.580 7.922 1.00 0.00 H TER 4037 WAT 8589 ATOM 4037 O WAT 8590 102.297 144.441 121.426 1.00 0.00 O ATOM 4038 H1 WAT 8590 101.551 144.496 122.024 1.00 0.00 H ATOM 4039 H2 WAT 8590 101.988 143.889 120.708 1.00 0.00 H TER 4041 WAT 8590 ATOM 4041 O WAT 8591 92.856 31.738 100.643 1.00 0.00 O ATOM 4042 H1 WAT 8591 92.710 32.052 101.536 1.00 0.00 H ATOM 4043 H2 WAT 8591 93.170 32.506 100.167 1.00 0.00 H TER 4045 WAT 8591 ATOM 4045 O WAT 8592 21.709 119.069 5.970 1.00 0.00 O ATOM 4046 H1 WAT 8592 20.831 118.715 6.114 1.00 0.00 H ATOM 4047 H2 WAT 8592 22.297 118.349 6.197 1.00 0.00 H TER 4049 WAT 8592 ATOM 4049 O WAT 8593 34.137 134.784 0.936 1.00 0.00 O ATOM 4050 H1 WAT 8593 33.819 134.907 0.041 1.00 0.00 H ATOM 4051 H2 WAT 8593 33.479 135.210 1.485 1.00 0.00 H TER 4053 WAT 8593 ATOM 4053 O WAT 8594 13.304 31.025 68.785 1.00 0.00 O ATOM 4054 H1 WAT 8594 12.675 31.247 69.471 1.00 0.00 H ATOM 4055 H2 WAT 8594 12.836 30.413 68.218 1.00 0.00 H TER 4057 WAT 8594 ATOM 4057 O WAT 8595 27.158 129.274 20.493 1.00 0.00 O ATOM 4058 H1 WAT 8595 27.976 128.926 20.138 1.00 0.00 H ATOM 4059 H2 WAT 8595 26.781 128.545 20.985 1.00 0.00 H TER 4061 WAT 8595 ATOM 4061 O WAT 8596 97.898 21.872 145.339 1.00 0.00 O ATOM 4062 H1 WAT 8596 98.103 22.158 144.449 1.00 0.00 H ATOM 4063 H2 WAT 8596 98.277 22.547 145.901 1.00 0.00 H TER 4065 WAT 8596 ATOM 4065 O WAT 8597 46.471 115.442 60.343 1.00 0.00 O ATOM 4066 H1 WAT 8597 46.790 115.518 59.443 1.00 0.00 H ATOM 4067 H2 WAT 8597 45.651 114.955 60.266 1.00 0.00 H TER 4069 WAT 8597 ATOM 4069 O WAT 8598 17.058 65.029 72.079 1.00 0.00 O ATOM 4070 H1 WAT 8598 17.920 65.084 72.491 1.00 0.00 H ATOM 4071 H2 WAT 8598 17.159 64.362 71.400 1.00 0.00 H TER 4073 WAT 8598 ATOM 4073 O WAT 8599 4.421 53.462 0.418 1.00 0.00 O ATOM 4074 H1 WAT 8599 4.848 53.770 -0.381 1.00 0.00 H ATOM 4075 H2 WAT 8599 4.920 52.687 0.673 1.00 0.00 H TER 4077 WAT 8599 ATOM 4077 O WAT 8600 28.015 84.215 92.158 1.00 0.00 O ATOM 4078 H1 WAT 8600 28.213 84.299 91.225 1.00 0.00 H ATOM 4079 H2 WAT 8600 27.821 85.108 92.444 1.00 0.00 H TER 4081 WAT 8600 ATOM 4081 O WAT 8601 138.568 130.202 12.744 1.00 0.00 O ATOM 4082 H1 WAT 8601 138.474 130.670 11.914 1.00 0.00 H ATOM 4083 H2 WAT 8601 138.854 129.324 12.492 1.00 0.00 H TER 4085 WAT 8601 ATOM 4085 O WAT 8602 48.602 68.799 80.221 1.00 0.00 O ATOM 4086 H1 WAT 8602 48.076 69.587 80.088 1.00 0.00 H ATOM 4087 H2 WAT 8602 49.205 68.785 79.478 1.00 0.00 H TER 4089 WAT 8602 ATOM 4089 O WAT 8603 1.229 50.662 129.452 1.00 0.00 O ATOM 4090 H1 WAT 8603 2.025 51.191 129.388 1.00 0.00 H ATOM 4091 H2 WAT 8603 1.541 49.758 129.452 1.00 0.00 H TER 4093 WAT 8603 ATOM 4093 O WAT 8604 72.031 18.306 65.026 1.00 0.00 O ATOM 4094 H1 WAT 8604 71.089 18.274 65.188 1.00 0.00 H ATOM 4095 H2 WAT 8604 72.159 19.099 64.506 1.00 0.00 H TER 4097 WAT 8604 ATOM 4097 O WAT 8605 13.674 83.919 79.930 1.00 0.00 O ATOM 4098 H1 WAT 8605 12.732 83.768 79.843 1.00 0.00 H ATOM 4099 H2 WAT 8605 13.748 84.848 80.147 1.00 0.00 H TER 4101 WAT 8605 ATOM 4101 O WAT 8606 13.909 137.753 136.427 1.00 0.00 O ATOM 4102 H1 WAT 8606 13.987 136.844 136.714 1.00 0.00 H ATOM 4103 H2 WAT 8606 14.598 137.857 135.770 1.00 0.00 H TER 4105 WAT 8606 ATOM 4105 O WAT 8607 108.661 12.906 61.228 1.00 0.00 O ATOM 4106 H1 WAT 8607 108.102 12.841 60.454 1.00 0.00 H ATOM 4107 H2 WAT 8607 109.220 13.664 61.056 1.00 0.00 H TER 4109 WAT 8607 ATOM 4109 O WAT 8608 113.049 66.969 104.981 1.00 0.00 O ATOM 4110 H1 WAT 8608 113.410 67.528 105.668 1.00 0.00 H ATOM 4111 H2 WAT 8608 113.607 67.133 104.220 1.00 0.00 H TER 4113 WAT 8608 ATOM 4113 O WAT 8609 56.028 135.340 1.231 1.00 0.00 O ATOM 4114 H1 WAT 8609 55.861 134.478 0.849 1.00 0.00 H ATOM 4115 H2 WAT 8609 56.059 135.182 2.174 1.00 0.00 H TER 4117 WAT 8609 ATOM 4117 O WAT 8610 79.029 123.327 93.731 1.00 0.00 O ATOM 4118 H1 WAT 8610 79.123 123.104 92.805 1.00 0.00 H ATOM 4119 H2 WAT 8610 79.920 123.520 94.023 1.00 0.00 H TER 4121 WAT 8610 ATOM 4121 O WAT 8611 94.274 45.828 130.707 1.00 0.00 O ATOM 4122 H1 WAT 8611 94.214 45.088 130.103 1.00 0.00 H ATOM 4123 H2 WAT 8611 93.764 46.521 130.289 1.00 0.00 H TER 4125 WAT 8611 ATOM 4125 O WAT 8612 10.882 137.244 99.543 1.00 0.00 O ATOM 4126 H1 WAT 8612 10.662 137.919 100.184 1.00 0.00 H ATOM 4127 H2 WAT 8612 11.653 136.809 99.908 1.00 0.00 H TER 4129 WAT 8612 ATOM 4129 O WAT 8613 29.344 120.407 72.529 1.00 0.00 O ATOM 4130 H1 WAT 8613 30.172 120.121 72.915 1.00 0.00 H ATOM 4131 H2 WAT 8613 29.349 120.036 71.647 1.00 0.00 H TER 4133 WAT 8613 ATOM 4133 O WAT 8614 63.457 1.911 100.122 1.00 0.00 O ATOM 4134 H1 WAT 8614 64.224 1.452 100.463 1.00 0.00 H ATOM 4135 H2 WAT 8614 63.195 2.499 100.830 1.00 0.00 H TER 4137 WAT 8614 ATOM 4137 O WAT 8615 134.302 45.461 80.360 1.00 0.00 O ATOM 4138 H1 WAT 8615 134.135 44.697 79.807 1.00 0.00 H ATOM 4139 H2 WAT 8615 135.256 45.523 80.400 1.00 0.00 H TER 4141 WAT 8615 ATOM 4141 O WAT 8616 117.219 3.621 128.291 1.00 0.00 O ATOM 4142 H1 WAT 8616 116.720 2.804 128.271 1.00 0.00 H ATOM 4143 H2 WAT 8616 116.765 4.162 128.937 1.00 0.00 H TER 4145 WAT 8616 ATOM 4145 O WAT 8617 142.041 64.852 139.065 1.00 0.00 O ATOM 4146 H1 WAT 8617 141.947 65.564 139.698 1.00 0.00 H ATOM 4147 H2 WAT 8617 141.144 64.641 138.807 1.00 0.00 H TER 4149 WAT 8617 ATOM 4149 O WAT 8618 115.619 55.382 124.775 1.00 0.00 O ATOM 4150 H1 WAT 8618 114.841 55.023 124.348 1.00 0.00 H ATOM 4151 H2 WAT 8618 115.454 56.323 124.822 1.00 0.00 H TER 4153 WAT 8618 ATOM 4153 O WAT 8619 107.325 133.211 6.610 1.00 0.00 O ATOM 4154 H1 WAT 8619 106.383 133.376 6.571 1.00 0.00 H ATOM 4155 H2 WAT 8619 107.528 133.205 7.546 1.00 0.00 H TER 4157 WAT 8619 ATOM 4157 O WAT 8620 50.083 7.069 148.359 1.00 0.00 O ATOM 4158 H1 WAT 8620 50.750 7.752 148.285 1.00 0.00 H ATOM 4159 H2 WAT 8620 49.288 7.538 148.611 1.00 0.00 H TER 4161 WAT 8620 ATOM 4161 O WAT 8621 130.161 47.083 81.461 1.00 0.00 O ATOM 4162 H1 WAT 8621 130.437 47.407 82.319 1.00 0.00 H ATOM 4163 H2 WAT 8621 130.798 47.452 80.849 1.00 0.00 H TER 4165 WAT 8621 ATOM 4165 O WAT 8622 91.802 141.104 7.724 1.00 0.00 O ATOM 4166 H1 WAT 8622 91.988 140.929 6.802 1.00 0.00 H ATOM 4167 H2 WAT 8622 91.269 141.899 7.713 1.00 0.00 H TER 4169 WAT 8622 ATOM 4169 O WAT 8623 77.002 77.824 13.230 1.00 0.00 O ATOM 4170 H1 WAT 8623 77.660 78.190 13.821 1.00 0.00 H ATOM 4171 H2 WAT 8623 76.716 78.568 12.700 1.00 0.00 H TER 4173 WAT 8623 ATOM 4173 O WAT 8624 1.665 107.834 12.459 1.00 0.00 O ATOM 4174 H1 WAT 8624 1.809 107.567 13.367 1.00 0.00 H ATOM 4175 H2 WAT 8624 1.003 108.523 12.514 1.00 0.00 H TER 4177 WAT 8624 ATOM 4177 O WAT 8625 107.731 2.431 122.649 1.00 0.00 O ATOM 4178 H1 WAT 8625 107.344 2.625 121.796 1.00 0.00 H ATOM 4179 H2 WAT 8625 107.043 1.966 123.125 1.00 0.00 H TER 4181 WAT 8625 ATOM 4181 O WAT 8626 97.973 132.233 143.878 1.00 0.00 O ATOM 4182 H1 WAT 8626 98.266 132.252 142.966 1.00 0.00 H ATOM 4183 H2 WAT 8626 97.192 131.680 143.866 1.00 0.00 H TER 4185 WAT 8626 ATOM 4185 O WAT 8627 27.465 140.831 17.717 1.00 0.00 O ATOM 4186 H1 WAT 8627 27.759 140.094 18.254 1.00 0.00 H ATOM 4187 H2 WAT 8627 26.510 140.778 17.740 1.00 0.00 H TER 4189 WAT 8627 ATOM 4189 O WAT 8628 81.857 80.014 21.037 1.00 0.00 O ATOM 4190 H1 WAT 8628 81.683 79.288 21.635 1.00 0.00 H ATOM 4191 H2 WAT 8628 82.547 80.519 21.468 1.00 0.00 H TER 4193 WAT 8628 ATOM 4193 O WAT 8629 0.689 21.882 13.598 1.00 0.00 O ATOM 4194 H1 WAT 8629 1.229 22.646 13.804 1.00 0.00 H ATOM 4195 H2 WAT 8629 -0.186 22.118 13.906 1.00 0.00 H TER 4197 WAT 8629 ATOM 4197 O WAT 8630 76.443 90.149 114.481 1.00 0.00 O ATOM 4198 H1 WAT 8630 77.318 90.522 114.376 1.00 0.00 H ATOM 4199 H2 WAT 8630 75.867 90.909 114.567 1.00 0.00 H TER 4201 WAT 8630 ATOM 4201 O WAT 8631 62.008 92.775 123.926 1.00 0.00 O ATOM 4202 H1 WAT 8631 62.108 92.978 124.856 1.00 0.00 H ATOM 4203 H2 WAT 8631 61.157 92.339 123.866 1.00 0.00 H TER 4205 WAT 8631 ATOM 4205 O WAT 8632 48.743 79.777 150.446 1.00 0.00 O ATOM 4206 H1 WAT 8632 48.113 79.366 151.037 1.00 0.00 H ATOM 4207 H2 WAT 8632 48.205 80.177 149.763 1.00 0.00 H TER 4209 WAT 8632 ATOM 4209 O WAT 8633 118.146 26.292 16.794 1.00 0.00 O ATOM 4210 H1 WAT 8633 117.926 27.061 16.267 1.00 0.00 H ATOM 4211 H2 WAT 8633 117.318 25.820 16.886 1.00 0.00 H TER 4213 WAT 8633 ATOM 4213 O WAT 8634 84.751 50.522 99.114 1.00 0.00 O ATOM 4214 H1 WAT 8634 84.385 51.364 99.384 1.00 0.00 H ATOM 4215 H2 WAT 8634 84.795 50.010 99.921 1.00 0.00 H TER 4217 WAT 8634 ATOM 4217 O WAT 8635 141.142 132.048 108.797 1.00 0.00 O ATOM 4218 H1 WAT 8635 142.092 131.975 108.892 1.00 0.00 H ATOM 4219 H2 WAT 8635 140.794 131.766 109.643 1.00 0.00 H TER 4221 WAT 8635 ATOM 4221 O WAT 8636 88.748 14.616 116.114 1.00 0.00 O ATOM 4222 H1 WAT 8636 88.427 13.773 115.792 1.00 0.00 H ATOM 4223 H2 WAT 8636 88.019 14.971 116.623 1.00 0.00 H TER 4225 WAT 8636 ATOM 4225 O WAT 8637 99.873 9.108 84.175 1.00 0.00 O ATOM 4226 H1 WAT 8637 99.868 8.355 84.765 1.00 0.00 H ATOM 4227 H2 WAT 8637 98.994 9.479 84.254 1.00 0.00 H TER 4229 WAT 8637 ATOM 4229 O WAT 8638 9.474 102.916 151.076 1.00 0.00 O ATOM 4230 H1 WAT 8638 9.770 102.079 151.432 1.00 0.00 H ATOM 4231 H2 WAT 8638 10.279 103.405 150.910 1.00 0.00 H TER 4233 WAT 8638 ATOM 4233 O WAT 8639 93.570 111.969 94.827 1.00 0.00 O ATOM 4234 H1 WAT 8639 93.438 112.743 94.279 1.00 0.00 H ATOM 4235 H2 WAT 8639 94.295 112.205 95.405 1.00 0.00 H TER 4237 WAT 8639 ATOM 4237 O WAT 8640 143.535 3.649 146.519 1.00 0.00 O ATOM 4238 H1 WAT 8640 144.458 3.855 146.375 1.00 0.00 H ATOM 4239 H2 WAT 8640 143.077 4.079 145.798 1.00 0.00 H TER 4241 WAT 8640 ATOM 4241 O WAT 8641 14.681 23.559 118.194 1.00 0.00 O ATOM 4242 H1 WAT 8641 15.023 23.094 118.958 1.00 0.00 H ATOM 4243 H2 WAT 8641 14.083 24.212 118.559 1.00 0.00 H TER 4245 WAT 8641 ATOM 4245 O WAT 8642 58.719 127.427 61.635 1.00 0.00 O ATOM 4246 H1 WAT 8642 58.618 126.955 62.462 1.00 0.00 H ATOM 4247 H2 WAT 8642 58.119 126.986 61.033 1.00 0.00 H TER 4249 WAT 8642 ATOM 4249 O WAT 8643 14.187 69.142 9.788 1.00 0.00 O ATOM 4250 H1 WAT 8643 14.101 68.206 9.967 1.00 0.00 H ATOM 4251 H2 WAT 8643 14.410 69.529 10.634 1.00 0.00 H TER 4253 WAT 8643 ATOM 4253 O WAT 8644 36.438 54.346 113.632 1.00 0.00 O ATOM 4254 H1 WAT 8644 35.752 54.343 114.299 1.00 0.00 H ATOM 4255 H2 WAT 8644 36.379 55.214 113.232 1.00 0.00 H TER 4257 WAT 8644 ATOM 4257 O WAT 8645 85.088 104.480 154.549 1.00 0.00 O ATOM 4258 H1 WAT 8645 84.868 103.841 155.227 1.00 0.00 H ATOM 4259 H2 WAT 8645 84.331 104.478 153.964 1.00 0.00 H TER 4261 WAT 8645 ATOM 4261 O WAT 8646 40.522 120.345 65.712 1.00 0.00 O ATOM 4262 H1 WAT 8646 40.286 121.272 65.733 1.00 0.00 H ATOM 4263 H2 WAT 8646 39.721 119.887 65.968 1.00 0.00 H TER 4265 WAT 8646 ATOM 4265 O WAT 8647 116.142 11.852 151.295 1.00 0.00 O ATOM 4266 H1 WAT 8647 116.007 12.619 150.739 1.00 0.00 H ATOM 4267 H2 WAT 8647 116.065 12.187 152.188 1.00 0.00 H TER 4269 WAT 8647 ATOM 4269 O WAT 8648 142.669 34.447 145.570 1.00 0.00 O ATOM 4270 H1 WAT 8648 141.830 33.997 145.471 1.00 0.00 H ATOM 4271 H2 WAT 8648 143.223 33.820 146.035 1.00 0.00 H TER 4273 WAT 8648 ATOM 4273 O WAT 8649 125.285 120.701 129.143 1.00 0.00 O ATOM 4274 H1 WAT 8649 125.251 120.870 130.085 1.00 0.00 H ATOM 4275 H2 WAT 8649 124.973 119.801 129.050 1.00 0.00 H TER 4277 WAT 8649 ATOM 4277 O WAT 8650 49.138 2.226 148.211 1.00 0.00 O ATOM 4278 H1 WAT 8650 49.666 3.022 148.146 1.00 0.00 H ATOM 4279 H2 WAT 8650 48.905 2.018 147.307 1.00 0.00 H TER 4281 WAT 8650 ATOM 4281 O WAT 8651 21.651 28.279 130.421 1.00 0.00 O ATOM 4282 H1 WAT 8651 22.251 27.774 129.871 1.00 0.00 H ATOM 4283 H2 WAT 8651 21.313 28.963 129.842 1.00 0.00 H TER 4285 WAT 8651 ATOM 4285 O WAT 8652 77.019 38.677 12.461 1.00 0.00 O ATOM 4286 H1 WAT 8652 77.135 38.591 11.515 1.00 0.00 H ATOM 4287 H2 WAT 8652 77.699 38.118 12.837 1.00 0.00 H TER 4289 WAT 8652 ATOM 4289 O WAT 8653 80.544 82.307 136.020 1.00 0.00 O ATOM 4290 H1 WAT 8653 80.799 82.033 135.140 1.00 0.00 H ATOM 4291 H2 WAT 8653 81.104 81.796 136.603 1.00 0.00 H TER 4293 WAT 8653 ATOM 4293 O WAT 8654 78.673 129.006 99.520 1.00 0.00 O ATOM 4294 H1 WAT 8654 78.584 128.057 99.608 1.00 0.00 H ATOM 4295 H2 WAT 8654 78.768 129.151 98.579 1.00 0.00 H TER 4297 WAT 8654 ATOM 4297 O WAT 8655 75.179 38.895 2.777 1.00 0.00 O ATOM 4298 H1 WAT 8655 75.863 38.915 2.108 1.00 0.00 H ATOM 4299 H2 WAT 8655 74.360 38.923 2.284 1.00 0.00 H TER 4301 WAT 8655 ATOM 4301 O WAT 8656 141.470 92.701 136.440 1.00 0.00 O ATOM 4302 H1 WAT 8656 142.387 92.974 136.454 1.00 0.00 H ATOM 4303 H2 WAT 8656 141.156 92.959 135.573 1.00 0.00 H TER 4305 WAT 8656 ATOM 4305 O WAT 8657 19.338 86.095 71.814 1.00 0.00 O ATOM 4306 H1 WAT 8657 18.557 86.646 71.868 1.00 0.00 H ATOM 4307 H2 WAT 8657 19.327 85.749 70.921 1.00 0.00 H TER 4309 WAT 8657 ATOM 4309 O WAT 8658 133.147 56.055 3.511 1.00 0.00 O ATOM 4310 H1 WAT 8658 133.283 55.891 4.445 1.00 0.00 H ATOM 4311 H2 WAT 8658 132.196 56.041 3.403 1.00 0.00 H TER 4313 WAT 8658 ATOM 4313 O WAT 8659 87.623 15.495 17.995 1.00 0.00 O ATOM 4314 H1 WAT 8659 88.348 15.028 17.580 1.00 0.00 H ATOM 4315 H2 WAT 8659 87.921 16.403 18.046 1.00 0.00 H TER 4317 WAT 8659 ATOM 4317 O WAT 8660 93.978 127.371 128.579 1.00 0.00 O ATOM 4318 H1 WAT 8660 94.820 127.057 128.249 1.00 0.00 H ATOM 4319 H2 WAT 8660 94.095 128.316 128.674 1.00 0.00 H TER 4321 WAT 8660 ATOM 4321 O WAT 8661 31.060 64.309 67.173 1.00 0.00 O ATOM 4322 H1 WAT 8661 31.604 63.536 67.025 1.00 0.00 H ATOM 4323 H2 WAT 8661 31.528 64.807 67.844 1.00 0.00 H TER 4325 WAT 8661 ATOM 4325 O WAT 8662 7.844 18.119 64.040 1.00 0.00 O ATOM 4326 H1 WAT 8662 6.931 18.130 63.753 1.00 0.00 H ATOM 4327 H2 WAT 8662 8.253 18.841 63.563 1.00 0.00 H TER 4329 WAT 8662 ATOM 4329 O WAT 8663 111.479 70.419 102.134 1.00 0.00 O ATOM 4330 H1 WAT 8663 110.712 70.073 102.590 1.00 0.00 H ATOM 4331 H2 WAT 8663 112.206 69.876 102.441 1.00 0.00 H TER 4333 WAT 8663 ATOM 4333 O WAT 8664 0.369 110.248 154.171 1.00 0.00 O ATOM 4334 H1 WAT 8664 0.356 111.151 153.855 1.00 0.00 H ATOM 4335 H2 WAT 8664 1.255 109.940 153.980 1.00 0.00 H TER 4337 WAT 8664 ATOM 4337 O WAT 8665 69.165 75.480 128.688 1.00 0.00 O ATOM 4338 H1 WAT 8665 68.278 75.835 128.755 1.00 0.00 H ATOM 4339 H2 WAT 8665 69.049 74.625 128.273 1.00 0.00 H TER 4341 WAT 8665 ATOM 4341 O WAT 8666 12.488 103.879 112.630 1.00 0.00 O ATOM 4342 H1 WAT 8666 11.798 103.216 112.617 1.00 0.00 H ATOM 4343 H2 WAT 8666 12.416 104.282 113.496 1.00 0.00 H TER 4345 WAT 8666 ATOM 4345 O WAT 8667 83.283 11.800 110.467 1.00 0.00 O ATOM 4346 H1 WAT 8667 83.640 11.997 111.334 1.00 0.00 H ATOM 4347 H2 WAT 8667 82.692 11.062 110.614 1.00 0.00 H TER 4349 WAT 8667 ATOM 4349 O WAT 8668 90.785 101.860 122.726 1.00 0.00 O ATOM 4350 H1 WAT 8668 90.050 101.300 122.975 1.00 0.00 H ATOM 4351 H2 WAT 8668 91.528 101.261 122.651 1.00 0.00 H TER 4353 WAT 8668 ATOM 4353 O WAT 8669 28.427 66.051 117.155 1.00 0.00 O ATOM 4354 H1 WAT 8669 28.024 65.755 116.339 1.00 0.00 H ATOM 4355 H2 WAT 8669 29.221 65.521 117.235 1.00 0.00 H TER 4357 WAT 8669 ATOM 4357 O WAT 8670 39.494 65.311 153.302 1.00 0.00 O ATOM 4358 H1 WAT 8670 39.007 64.880 152.601 1.00 0.00 H ATOM 4359 H2 WAT 8670 38.888 65.968 153.646 1.00 0.00 H TER 4361 WAT 8670 ATOM 4361 O WAT 8671 117.050 111.856 96.382 1.00 0.00 O ATOM 4362 H1 WAT 8671 117.920 111.773 96.774 1.00 0.00 H ATOM 4363 H2 WAT 8671 117.201 112.331 95.564 1.00 0.00 H TER 4365 WAT 8671 ATOM 4365 O WAT 8672 62.062 74.705 62.566 1.00 0.00 O ATOM 4366 H1 WAT 8672 61.619 74.413 61.769 1.00 0.00 H ATOM 4367 H2 WAT 8672 61.804 75.622 62.661 1.00 0.00 H TER 4369 WAT 8672 ATOM 4369 O WAT 8673 47.896 81.040 136.196 1.00 0.00 O ATOM 4370 H1 WAT 8673 47.922 80.107 136.404 1.00 0.00 H ATOM 4371 H2 WAT 8673 47.196 81.390 136.747 1.00 0.00 H TER 4373 WAT 8673 ATOM 4373 O WAT 8674 92.706 24.995 82.531 1.00 0.00 O ATOM 4374 H1 WAT 8674 92.706 25.579 81.773 1.00 0.00 H ATOM 4375 H2 WAT 8674 92.499 24.133 82.170 1.00 0.00 H TER 4377 WAT 8674 ATOM 4377 O WAT 8675 25.662 6.312 8.634 1.00 0.00 O ATOM 4378 H1 WAT 8675 26.372 5.688 8.780 1.00 0.00 H ATOM 4379 H2 WAT 8675 24.871 5.774 8.607 1.00 0.00 H TER 4381 WAT 8675 ATOM 4381 O WAT 8676 1.905 31.608 112.261 1.00 0.00 O ATOM 4382 H1 WAT 8676 2.623 31.617 112.895 1.00 0.00 H ATOM 4383 H2 WAT 8676 1.684 30.682 112.164 1.00 0.00 H TER 4385 WAT 8676 ATOM 4385 O WAT 8677 15.185 38.153 14.804 1.00 0.00 O ATOM 4386 H1 WAT 8677 14.895 38.621 15.587 1.00 0.00 H ATOM 4387 H2 WAT 8677 15.937 38.654 14.490 1.00 0.00 H TER 4389 WAT 8677 ATOM 4389 O WAT 8678 10.715 141.475 103.626 1.00 0.00 O ATOM 4390 H1 WAT 8678 11.026 142.201 104.167 1.00 0.00 H ATOM 4391 H2 WAT 8678 9.819 141.717 103.392 1.00 0.00 H TER 4393 WAT 8678 ATOM 4393 O WAT 8679 21.224 32.772 75.774 1.00 0.00 O ATOM 4394 H1 WAT 8679 20.966 32.223 75.034 1.00 0.00 H ATOM 4395 H2 WAT 8679 20.402 32.979 76.217 1.00 0.00 H TER 4397 WAT 8679 ATOM 4397 O WAT 8680 83.643 111.738 110.724 1.00 0.00 O ATOM 4398 H1 WAT 8680 82.931 111.940 111.330 1.00 0.00 H ATOM 4399 H2 WAT 8680 84.226 111.165 111.222 1.00 0.00 H TER 4401 WAT 8680 ATOM 4401 O WAT 8681 108.009 107.298 83.155 1.00 0.00 O ATOM 4402 H1 WAT 8681 108.390 106.669 83.767 1.00 0.00 H ATOM 4403 H2 WAT 8681 107.217 107.608 83.593 1.00 0.00 H TER 4405 WAT 8681 ATOM 4405 O WAT 8682 85.436 91.281 86.965 1.00 0.00 O ATOM 4406 H1 WAT 8682 86.255 91.119 87.432 1.00 0.00 H ATOM 4407 H2 WAT 8682 84.765 90.869 87.508 1.00 0.00 H TER 4409 WAT 8682 ATOM 4409 O WAT 8683 36.629 103.632 127.668 1.00 0.00 O ATOM 4410 H1 WAT 8683 36.022 103.914 126.984 1.00 0.00 H ATOM 4411 H2 WAT 8683 37.332 104.282 127.647 1.00 0.00 H TER 4413 WAT 8683 ATOM 4413 O WAT 8684 117.573 108.634 92.265 1.00 0.00 O ATOM 4414 H1 WAT 8684 116.997 109.088 91.650 1.00 0.00 H ATOM 4415 H2 WAT 8684 117.593 107.729 91.952 1.00 0.00 H TER 4417 WAT 8684 ATOM 4417 O WAT 8685 18.635 67.683 119.370 1.00 0.00 O ATOM 4418 H1 WAT 8685 19.482 67.241 119.321 1.00 0.00 H ATOM 4419 H2 WAT 8685 17.992 66.978 119.288 1.00 0.00 H TER 4421 WAT 8685 ATOM 4421 O WAT 8686 138.145 62.781 64.282 1.00 0.00 O ATOM 4422 H1 WAT 8686 138.498 62.200 64.955 1.00 0.00 H ATOM 4423 H2 WAT 8686 138.919 63.163 63.866 1.00 0.00 H TER 4425 WAT 8686 ATOM 4425 O WAT 8687 2.766 106.839 145.251 1.00 0.00 O ATOM 4426 H1 WAT 8687 3.340 106.384 145.866 1.00 0.00 H ATOM 4427 H2 WAT 8687 2.568 107.672 145.678 1.00 0.00 H TER 4429 WAT 8687 ATOM 4429 O WAT 8688 142.723 94.612 146.864 1.00 0.00 O ATOM 4430 H1 WAT 8688 142.511 93.679 146.891 1.00 0.00 H ATOM 4431 H2 WAT 8688 141.916 95.032 146.564 1.00 0.00 H TER 4433 WAT 8688 ATOM 4433 O WAT 8689 23.763 26.029 94.120 1.00 0.00 O ATOM 4434 H1 WAT 8689 22.965 25.532 93.943 1.00 0.00 H ATOM 4435 H2 WAT 8689 23.498 26.687 94.762 1.00 0.00 H TER 4437 WAT 8689 ATOM 4437 O WAT 8690 1.688 4.010 122.187 1.00 0.00 O ATOM 4438 H1 WAT 8690 1.495 4.304 123.077 1.00 0.00 H ATOM 4439 H2 WAT 8690 1.562 3.062 122.216 1.00 0.00 H TER 4441 WAT 8690 ATOM 4441 O WAT 8691 132.515 49.015 147.792 1.00 0.00 O ATOM 4442 H1 WAT 8691 132.469 49.963 147.666 1.00 0.00 H ATOM 4443 H2 WAT 8691 132.635 48.904 148.735 1.00 0.00 H TER 4445 WAT 8691 ATOM 4445 O WAT 8692 100.375 132.495 1.573 1.00 0.00 O ATOM 4446 H1 WAT 8692 100.059 131.689 1.165 1.00 0.00 H ATOM 4447 H2 WAT 8692 101.081 132.793 0.999 1.00 0.00 H TER 4449 WAT 8692 ATOM 4449 O WAT 8693 12.880 59.221 106.873 1.00 0.00 O ATOM 4450 H1 WAT 8693 12.418 59.910 106.396 1.00 0.00 H ATOM 4451 H2 WAT 8693 12.685 58.420 106.386 1.00 0.00 H TER 4453 WAT 8693 ATOM 4453 O WAT 8694 42.570 127.937 154.682 1.00 0.00 O ATOM 4454 H1 WAT 8694 42.214 128.223 153.841 1.00 0.00 H ATOM 4455 H2 WAT 8694 43.380 127.480 154.457 1.00 0.00 H TER 4457 WAT 8694 ATOM 4457 O WAT 8695 83.935 26.671 17.783 1.00 0.00 O ATOM 4458 H1 WAT 8695 84.864 26.486 17.926 1.00 0.00 H ATOM 4459 H2 WAT 8695 83.721 26.209 16.973 1.00 0.00 H TER 4461 WAT 8695 ATOM 4461 O WAT 8696 56.529 4.048 69.385 1.00 0.00 O ATOM 4462 H1 WAT 8696 56.275 4.860 69.823 1.00 0.00 H ATOM 4463 H2 WAT 8696 57.287 4.290 68.852 1.00 0.00 H TER 4465 WAT 8696 ATOM 4465 O WAT 8697 78.075 144.290 73.440 1.00 0.00 O ATOM 4466 H1 WAT 8697 77.810 144.284 72.520 1.00 0.00 H ATOM 4467 H2 WAT 8697 78.864 144.831 73.458 1.00 0.00 H TER 4469 WAT 8697 ATOM 4469 O WAT 8698 33.105 69.181 17.047 1.00 0.00 O ATOM 4470 H1 WAT 8698 32.537 68.412 17.109 1.00 0.00 H ATOM 4471 H2 WAT 8698 33.257 69.441 17.955 1.00 0.00 H TER 4473 WAT 8698 ATOM 4473 O WAT 8699 40.312 133.471 127.430 1.00 0.00 O ATOM 4474 H1 WAT 8699 39.543 134.017 127.264 1.00 0.00 H ATOM 4475 H2 WAT 8699 40.507 133.069 126.583 1.00 0.00 H TER 4477 WAT 8699 ATOM 4477 O WAT 8700 4.455 27.039 140.724 1.00 0.00 O ATOM 4478 H1 WAT 8700 4.802 26.155 140.839 1.00 0.00 H ATOM 4479 H2 WAT 8700 4.167 27.298 141.600 1.00 0.00 H TER 4481 WAT 8700 ATOM 4481 O WAT 8701 66.666 38.104 68.482 1.00 0.00 O ATOM 4482 H1 WAT 8701 66.492 38.953 68.075 1.00 0.00 H ATOM 4483 H2 WAT 8701 67.606 38.113 68.661 1.00 0.00 H TER 4485 WAT 8701 ATOM 4485 O WAT 8702 71.100 18.876 112.620 1.00 0.00 O ATOM 4486 H1 WAT 8702 71.152 17.982 112.958 1.00 0.00 H ATOM 4487 H2 WAT 8702 70.747 18.779 111.736 1.00 0.00 H TER 4489 WAT 8702 ATOM 4489 O WAT 8703 11.747 127.404 135.445 1.00 0.00 O ATOM 4490 H1 WAT 8703 11.351 128.120 134.949 1.00 0.00 H ATOM 4491 H2 WAT 8703 11.498 127.574 136.353 1.00 0.00 H TER 4493 WAT 8703 ATOM 4493 O WAT 8704 6.895 109.065 62.411 1.00 0.00 O ATOM 4494 H1 WAT 8704 7.034 108.392 61.744 1.00 0.00 H ATOM 4495 H2 WAT 8704 7.252 108.684 63.213 1.00 0.00 H TER 4497 WAT 8704 ATOM 4497 O WAT 8705 5.788 24.614 23.303 1.00 0.00 O ATOM 4498 H1 WAT 8705 5.721 23.727 23.656 1.00 0.00 H ATOM 4499 H2 WAT 8705 6.650 24.920 23.585 1.00 0.00 H TER 4501 WAT 8705 ATOM 4501 O WAT 8706 8.642 94.091 85.513 1.00 0.00 O ATOM 4502 H1 WAT 8706 8.062 94.408 84.820 1.00 0.00 H ATOM 4503 H2 WAT 8706 9.512 94.089 85.114 1.00 0.00 H TER 4505 WAT 8706 ATOM 4505 O WAT 8707 74.671 23.313 132.911 1.00 0.00 O ATOM 4506 H1 WAT 8707 74.514 23.945 133.612 1.00 0.00 H ATOM 4507 H2 WAT 8707 75.207 22.632 133.317 1.00 0.00 H TER 4509 WAT 8707 ATOM 4509 O WAT 8708 68.377 48.535 155.060 1.00 0.00 O ATOM 4510 H1 WAT 8708 68.725 47.957 154.381 1.00 0.00 H ATOM 4511 H2 WAT 8708 68.981 48.430 155.796 1.00 0.00 H TER 4513 WAT 8708 ATOM 4513 O WAT 8709 14.466 1.220 131.101 1.00 0.00 O ATOM 4514 H1 WAT 8709 14.792 0.497 130.566 1.00 0.00 H ATOM 4515 H2 WAT 8709 15.093 1.286 131.822 1.00 0.00 H TER 4517 WAT 8709 ATOM 4517 O WAT 8710 44.340 25.040 133.214 1.00 0.00 O ATOM 4518 H1 WAT 8710 44.286 25.242 134.148 1.00 0.00 H ATOM 4519 H2 WAT 8710 45.252 24.785 133.076 1.00 0.00 H TER 4521 WAT 8710 ATOM 4521 O WAT 8711 24.764 67.957 157.087 1.00 0.00 O ATOM 4522 H1 WAT 8711 25.373 68.662 157.305 1.00 0.00 H ATOM 4523 H2 WAT 8711 23.980 68.149 157.602 1.00 0.00 H TER 4525 WAT 8711 ATOM 4525 O WAT 8712 30.010 142.579 155.621 1.00 0.00 O ATOM 4526 H1 WAT 8712 30.352 141.891 156.191 1.00 0.00 H ATOM 4527 H2 WAT 8712 29.127 142.746 155.950 1.00 0.00 H TER 4529 WAT 8712 ATOM 4529 O WAT 8713 123.268 125.906 151.010 1.00 0.00 O ATOM 4530 H1 WAT 8713 122.532 125.630 151.555 1.00 0.00 H ATOM 4531 H2 WAT 8713 123.002 125.686 150.117 1.00 0.00 H TER 4533 WAT 8713 ATOM 4533 O WAT 8714 134.512 39.337 108.818 1.00 0.00 O ATOM 4534 H1 WAT 8714 133.567 39.257 108.688 1.00 0.00 H ATOM 4535 H2 WAT 8714 134.750 40.139 108.353 1.00 0.00 H TER 4537 WAT 8714 ATOM 4537 O WAT 8715 107.961 16.797 72.700 1.00 0.00 O ATOM 4538 H1 WAT 8715 108.357 15.962 72.451 1.00 0.00 H ATOM 4539 H2 WAT 8715 107.534 17.108 71.902 1.00 0.00 H TER 4541 WAT 8715 ATOM 4541 O WAT 8716 131.133 116.492 126.821 1.00 0.00 O ATOM 4542 H1 WAT 8716 131.665 117.259 126.607 1.00 0.00 H ATOM 4543 H2 WAT 8716 130.253 116.843 126.963 1.00 0.00 H TER 4545 WAT 8716 ATOM 4545 O WAT 8717 25.764 12.443 131.996 1.00 0.00 O ATOM 4546 H1 WAT 8717 25.589 12.806 131.128 1.00 0.00 H ATOM 4547 H2 WAT 8717 25.576 13.162 132.599 1.00 0.00 H TER 4549 WAT 8717 ATOM 4549 O WAT 8718 108.154 6.180 69.815 1.00 0.00 O ATOM 4550 H1 WAT 8718 108.036 7.130 69.804 1.00 0.00 H ATOM 4551 H2 WAT 8718 108.077 5.918 68.897 1.00 0.00 H TER 4553 WAT 8718 ATOM 4553 O WAT 8719 122.272 56.929 82.809 1.00 0.00 O ATOM 4554 H1 WAT 8719 122.819 57.593 83.228 1.00 0.00 H ATOM 4555 H2 WAT 8719 121.397 57.315 82.792 1.00 0.00 H TER 4557 WAT 8719 ATOM 4557 O WAT 8720 144.563 50.527 143.364 1.00 0.00 O ATOM 4558 H1 WAT 8720 143.852 50.988 142.918 1.00 0.00 H ATOM 4559 H2 WAT 8720 144.704 49.739 142.839 1.00 0.00 H TER 4561 WAT 8720 ATOM 4561 O WAT 8721 48.042 25.753 130.698 1.00 0.00 O ATOM 4562 H1 WAT 8721 48.815 26.099 131.143 1.00 0.00 H ATOM 4563 H2 WAT 8721 48.389 25.111 130.079 1.00 0.00 H TER 4565 WAT 8721 ATOM 4565 O WAT 8722 4.054 57.379 122.466 1.00 0.00 O ATOM 4566 H1 WAT 8722 3.532 58.146 122.700 1.00 0.00 H ATOM 4567 H2 WAT 8722 3.408 56.693 122.297 1.00 0.00 H TER 4569 WAT 8722 ATOM 4569 O WAT 8723 72.219 102.491 60.626 1.00 0.00 O ATOM 4570 H1 WAT 8723 72.906 102.914 61.142 1.00 0.00 H ATOM 4571 H2 WAT 8723 72.116 103.054 59.858 1.00 0.00 H TER 4573 WAT 8723 ATOM 4573 O WAT 8724 101.718 62.703 131.172 1.00 0.00 O ATOM 4574 H1 WAT 8724 101.965 63.002 130.296 1.00 0.00 H ATOM 4575 H2 WAT 8724 101.321 61.844 131.028 1.00 0.00 H TER 4577 WAT 8724 ATOM 4577 O WAT 8725 8.412 131.765 107.080 1.00 0.00 O ATOM 4578 H1 WAT 8725 7.523 131.872 107.419 1.00 0.00 H ATOM 4579 H2 WAT 8725 8.424 130.879 106.716 1.00 0.00 H TER 4581 WAT 8725 ATOM 4581 O WAT 8726 16.028 144.530 143.372 1.00 0.00 O ATOM 4582 H1 WAT 8726 15.522 144.573 144.183 1.00 0.00 H ATOM 4583 H2 WAT 8726 16.484 145.371 143.330 1.00 0.00 H TER 4585 WAT 8726 ATOM 4585 O WAT 8727 41.823 145.554 126.381 1.00 0.00 O ATOM 4586 H1 WAT 8727 41.755 145.179 125.503 1.00 0.00 H ATOM 4587 H2 WAT 8727 42.336 144.915 126.875 1.00 0.00 H TER 4589 WAT 8727 ATOM 4589 O WAT 8728 10.400 25.714 8.972 1.00 0.00 O ATOM 4590 H1 WAT 8728 10.631 25.948 8.073 1.00 0.00 H ATOM 4591 H2 WAT 8728 9.614 26.226 9.158 1.00 0.00 H TER 4593 WAT 8728 ATOM 4593 O WAT 8729 8.414 136.333 15.804 1.00 0.00 O ATOM 4594 H1 WAT 8729 7.552 135.924 15.723 1.00 0.00 H ATOM 4595 H2 WAT 8729 8.362 137.112 15.250 1.00 0.00 H TER 4597 WAT 8729 ATOM 4597 O WAT 8730 118.633 64.681 95.849 1.00 0.00 O ATOM 4598 H1 WAT 8730 119.273 64.487 95.164 1.00 0.00 H ATOM 4599 H2 WAT 8730 118.229 65.504 95.572 1.00 0.00 H TER 4601 WAT 8730 ATOM 4601 O WAT 8731 137.539 28.770 129.334 1.00 0.00 O ATOM 4602 H1 WAT 8731 136.612 28.959 129.186 1.00 0.00 H ATOM 4603 H2 WAT 8731 137.862 29.526 129.823 1.00 0.00 H TER 4605 WAT 8731 ATOM 4605 O WAT 8732 57.257 76.383 128.344 1.00 0.00 O ATOM 4606 H1 WAT 8732 57.401 77.306 128.553 1.00 0.00 H ATOM 4607 H2 WAT 8732 56.933 76.388 127.444 1.00 0.00 H TER 4609 WAT 8732 ATOM 4609 O WAT 8733 13.837 69.540 156.632 1.00 0.00 O ATOM 4610 H1 WAT 8733 14.232 69.403 157.493 1.00 0.00 H ATOM 4611 H2 WAT 8733 14.521 69.286 156.012 1.00 0.00 H TER 4613 WAT 8733 ATOM 4613 O WAT 8734 141.975 115.674 103.758 1.00 0.00 O ATOM 4614 H1 WAT 8734 142.570 116.368 104.041 1.00 0.00 H ATOM 4615 H2 WAT 8734 141.252 116.136 103.333 1.00 0.00 H TER 4617 WAT 8734 ATOM 4617 O WAT 8735 0.979 144.883 68.161 1.00 0.00 O ATOM 4618 H1 WAT 8735 1.289 144.103 68.620 1.00 0.00 H ATOM 4619 H2 WAT 8735 0.741 144.569 67.289 1.00 0.00 H TER 4621 WAT 8735 ATOM 4621 O WAT 8736 4.100 93.226 107.060 1.00 0.00 O ATOM 4622 H1 WAT 8736 4.409 92.486 106.536 1.00 0.00 H ATOM 4623 H2 WAT 8736 4.441 93.057 107.938 1.00 0.00 H TER 4625 WAT 8736 ATOM 4625 O WAT 8737 88.925 106.285 141.970 1.00 0.00 O ATOM 4626 H1 WAT 8737 89.795 106.032 142.280 1.00 0.00 H ATOM 4627 H2 WAT 8737 88.361 106.193 142.738 1.00 0.00 H TER 4629 WAT 8737 ATOM 4629 O WAT 8738 72.333 122.282 103.086 1.00 0.00 O ATOM 4630 H1 WAT 8738 71.742 123.034 103.040 1.00 0.00 H ATOM 4631 H2 WAT 8738 72.014 121.773 103.831 1.00 0.00 H TER 4633 WAT 8738 ATOM 4633 O WAT 8739 103.036 80.607 146.724 1.00 0.00 O ATOM 4634 H1 WAT 8739 102.927 81.485 146.358 1.00 0.00 H ATOM 4635 H2 WAT 8739 102.591 80.032 146.101 1.00 0.00 H TER 4637 WAT 8739 ATOM 4637 O WAT 8740 117.956 106.496 110.930 1.00 0.00 O ATOM 4638 H1 WAT 8740 118.233 106.076 111.744 1.00 0.00 H ATOM 4639 H2 WAT 8740 117.466 107.267 111.213 1.00 0.00 H TER 4641 WAT 8740 ATOM 4641 O WAT 8741 86.631 59.435 112.604 1.00 0.00 O ATOM 4642 H1 WAT 8741 85.806 59.823 112.896 1.00 0.00 H ATOM 4643 H2 WAT 8741 86.733 59.738 111.702 1.00 0.00 H TER 4645 WAT 8741 ATOM 4645 O WAT 8742 87.082 9.413 61.263 1.00 0.00 O ATOM 4646 H1 WAT 8742 87.608 9.953 60.673 1.00 0.00 H ATOM 4647 H2 WAT 8742 86.514 10.036 61.715 1.00 0.00 H TER 4649 WAT 8742 ATOM 4649 O WAT 8743 39.562 3.739 18.008 1.00 0.00 O ATOM 4650 H1 WAT 8743 40.475 3.991 18.146 1.00 0.00 H ATOM 4651 H2 WAT 8743 39.459 2.930 18.510 1.00 0.00 H TER 4653 WAT 8743 ATOM 4653 O WAT 8744 125.618 67.329 141.253 1.00 0.00 O ATOM 4654 H1 WAT 8744 125.325 68.239 141.296 1.00 0.00 H ATOM 4655 H2 WAT 8744 125.307 66.938 142.069 1.00 0.00 H TER 4657 WAT 8744 ATOM 4657 O WAT 8745 142.271 140.842 129.774 1.00 0.00 O ATOM 4658 H1 WAT 8745 141.554 140.550 130.336 1.00 0.00 H ATOM 4659 H2 WAT 8745 142.542 140.054 129.302 1.00 0.00 H TER 4661 WAT 8745 ATOM 4661 O WAT 8746 35.621 86.732 73.292 1.00 0.00 O ATOM 4662 H1 WAT 8746 35.447 87.552 72.831 1.00 0.00 H ATOM 4663 H2 WAT 8746 36.154 86.222 72.681 1.00 0.00 H TER 4665 WAT 8746 ATOM 4665 O WAT 8747 37.564 12.502 6.992 1.00 0.00 O ATOM 4666 H1 WAT 8747 38.145 13.246 6.833 1.00 0.00 H ATOM 4667 H2 WAT 8747 37.920 12.083 7.776 1.00 0.00 H TER 4669 WAT 8747 ATOM 4669 O WAT 8748 28.222 93.698 63.480 1.00 0.00 O ATOM 4670 H1 WAT 8748 28.774 93.829 64.250 1.00 0.00 H ATOM 4671 H2 WAT 8748 27.613 93.006 63.737 1.00 0.00 H TER 4673 WAT 8748 ATOM 4673 O WAT 8749 70.510 21.957 87.410 1.00 0.00 O ATOM 4674 H1 WAT 8749 71.130 21.228 87.390 1.00 0.00 H ATOM 4675 H2 WAT 8749 70.799 22.536 86.705 1.00 0.00 H TER 4677 WAT 8749 ATOM 4677 O WAT 8750 24.315 63.870 135.793 1.00 0.00 O ATOM 4678 H1 WAT 8750 24.947 64.323 135.235 1.00 0.00 H ATOM 4679 H2 WAT 8750 24.081 63.084 135.300 1.00 0.00 H TER 4681 WAT 8750 ATOM 4681 O WAT 8751 39.416 7.312 153.561 1.00 0.00 O ATOM 4682 H1 WAT 8751 39.764 7.478 152.685 1.00 0.00 H ATOM 4683 H2 WAT 8751 38.549 6.937 153.407 1.00 0.00 H TER 4685 WAT 8751 ATOM 4685 O WAT 8752 101.887 65.875 84.859 1.00 0.00 O ATOM 4686 H1 WAT 8752 101.990 64.985 84.520 1.00 0.00 H ATOM 4687 H2 WAT 8752 100.967 65.928 85.117 1.00 0.00 H TER 4689 WAT 8752 ATOM 4689 O WAT 8753 75.578 142.562 143.539 1.00 0.00 O ATOM 4690 H1 WAT 8753 76.474 142.796 143.783 1.00 0.00 H ATOM 4691 H2 WAT 8753 75.303 141.937 144.210 1.00 0.00 H TER 4693 WAT 8753 ATOM 4693 O WAT 8754 12.476 68.102 79.730 1.00 0.00 O ATOM 4694 H1 WAT 8754 12.019 67.727 78.977 1.00 0.00 H ATOM 4695 H2 WAT 8754 12.833 68.929 79.406 1.00 0.00 H TER 4697 WAT 8754 ATOM 4697 O WAT 8755 59.824 80.432 72.029 1.00 0.00 O ATOM 4698 H1 WAT 8755 59.344 81.254 71.927 1.00 0.00 H ATOM 4699 H2 WAT 8755 59.221 79.861 72.507 1.00 0.00 H TER 4701 WAT 8755 ATOM 4701 O WAT 8756 46.129 31.458 78.473 1.00 0.00 O ATOM 4702 H1 WAT 8756 45.480 31.622 77.788 1.00 0.00 H ATOM 4703 H2 WAT 8756 45.969 32.142 79.123 1.00 0.00 H TER 4705 WAT 8756 ATOM 4705 O WAT 8757 140.632 66.662 141.053 1.00 0.00 O ATOM 4706 H1 WAT 8757 140.271 66.199 141.809 1.00 0.00 H ATOM 4707 H2 WAT 8757 139.871 66.861 140.508 1.00 0.00 H TER 4709 WAT 8757 ATOM 4709 O WAT 8758 40.168 14.147 154.196 1.00 0.00 O ATOM 4710 H1 WAT 8758 40.509 14.009 153.313 1.00 0.00 H ATOM 4711 H2 WAT 8758 40.436 13.367 154.681 1.00 0.00 H TER 4713 WAT 8758 ATOM 4713 O WAT 8759 142.021 33.519 67.370 1.00 0.00 O ATOM 4714 H1 WAT 8759 142.914 33.817 67.543 1.00 0.00 H ATOM 4715 H2 WAT 8759 141.495 34.319 67.379 1.00 0.00 H TER 4717 WAT 8759 ATOM 4717 O WAT 8760 47.350 79.572 71.019 1.00 0.00 O ATOM 4718 H1 WAT 8760 46.452 79.704 71.325 1.00 0.00 H ATOM 4719 H2 WAT 8760 47.272 78.918 70.325 1.00 0.00 H TER 4721 WAT 8760 ATOM 4721 O WAT 8761 54.911 76.283 145.320 1.00 0.00 O ATOM 4722 H1 WAT 8761 54.498 77.067 144.958 1.00 0.00 H ATOM 4723 H2 WAT 8761 55.849 76.425 145.193 1.00 0.00 H TER 4725 WAT 8761 ATOM 4725 O WAT 8762 93.534 52.006 123.503 1.00 0.00 O ATOM 4726 H1 WAT 8762 94.066 52.203 122.731 1.00 0.00 H ATOM 4727 H2 WAT 8762 93.324 52.863 123.874 1.00 0.00 H TER 4729 WAT 8762 ATOM 4729 O WAT 8763 38.429 5.023 61.786 1.00 0.00 O ATOM 4730 H1 WAT 8763 38.586 4.621 60.931 1.00 0.00 H ATOM 4731 H2 WAT 8763 38.001 5.855 61.583 1.00 0.00 H TER 4733 WAT 8763 ATOM 4733 O WAT 8764 75.113 10.507 68.401 1.00 0.00 O ATOM 4734 H1 WAT 8764 75.698 10.285 67.677 1.00 0.00 H ATOM 4735 H2 WAT 8764 74.430 11.045 68.000 1.00 0.00 H TER 4737 WAT 8764 ATOM 4737 O WAT 8765 105.884 13.648 79.490 1.00 0.00 O ATOM 4738 H1 WAT 8765 106.449 13.998 80.179 1.00 0.00 H ATOM 4739 H2 WAT 8765 106.264 12.795 79.279 1.00 0.00 H TER 4741 WAT 8765 ATOM 4741 O WAT 8766 61.759 77.953 66.711 1.00 0.00 O ATOM 4742 H1 WAT 8766 61.036 77.440 66.349 1.00 0.00 H ATOM 4743 H2 WAT 8766 62.495 77.777 66.125 1.00 0.00 H TER 4745 WAT 8766 ATOM 4745 O WAT 8767 128.430 104.203 112.434 1.00 0.00 O ATOM 4746 H1 WAT 8767 127.779 103.928 113.079 1.00 0.00 H ATOM 4747 H2 WAT 8767 128.357 105.157 112.410 1.00 0.00 H TER 4749 WAT 8767 ATOM 4749 O WAT 8768 44.507 44.596 64.936 1.00 0.00 O ATOM 4750 H1 WAT 8768 45.150 45.292 65.075 1.00 0.00 H ATOM 4751 H2 WAT 8768 44.591 44.374 64.009 1.00 0.00 H TER 4753 WAT 8768 ATOM 4753 O WAT 8769 143.177 133.183 59.237 1.00 0.00 O ATOM 4754 H1 WAT 8769 143.124 132.643 60.026 1.00 0.00 H ATOM 4755 H2 WAT 8769 142.292 133.164 58.874 1.00 0.00 H TER 4757 WAT 8769 ATOM 4757 O WAT 8770 96.077 1.711 96.940 1.00 0.00 O ATOM 4758 H1 WAT 8770 96.032 1.980 96.022 1.00 0.00 H ATOM 4759 H2 WAT 8770 95.859 0.779 96.927 1.00 0.00 H TER 4761 WAT 8770 ATOM 4761 O WAT 8771 35.264 103.993 19.117 1.00 0.00 O ATOM 4762 H1 WAT 8771 34.415 103.582 18.955 1.00 0.00 H ATOM 4763 H2 WAT 8771 35.903 103.305 18.930 1.00 0.00 H TER 4765 WAT 8771 ATOM 4765 O WAT 8772 34.558 134.933 4.155 1.00 0.00 O ATOM 4766 H1 WAT 8772 34.365 134.504 4.989 1.00 0.00 H ATOM 4767 H2 WAT 8772 35.511 134.885 4.077 1.00 0.00 H TER 4769 WAT 8772 ATOM 4769 O WAT 8773 25.155 35.712 72.291 1.00 0.00 O ATOM 4770 H1 WAT 8773 24.629 35.161 72.870 1.00 0.00 H ATOM 4771 H2 WAT 8773 26.056 35.430 72.445 1.00 0.00 H TER 4773 WAT 8773 ATOM 4773 O WAT 8774 48.758 72.502 72.842 1.00 0.00 O ATOM 4774 H1 WAT 8774 49.667 72.203 72.870 1.00 0.00 H ATOM 4775 H2 WAT 8774 48.785 73.303 72.319 1.00 0.00 H TER 4777 WAT 8774 ATOM 4777 O WAT 8775 130.066 68.795 13.541 1.00 0.00 O ATOM 4778 H1 WAT 8775 129.749 68.927 14.435 1.00 0.00 H ATOM 4779 H2 WAT 8775 130.841 69.353 13.477 1.00 0.00 H TER 4781 WAT 8775 ATOM 4781 O WAT 8776 80.587 92.161 13.122 1.00 0.00 O ATOM 4782 H1 WAT 8776 81.530 92.304 13.202 1.00 0.00 H ATOM 4783 H2 WAT 8776 80.210 93.041 13.122 1.00 0.00 H TER 4785 WAT 8776 ATOM 4785 O WAT 8777 65.244 15.439 72.102 1.00 0.00 O ATOM 4786 H1 WAT 8777 65.800 16.118 71.719 1.00 0.00 H ATOM 4787 H2 WAT 8777 65.785 15.043 72.785 1.00 0.00 H TER 4789 WAT 8777 ATOM 4789 O WAT 8778 130.333 73.229 86.284 1.00 0.00 O ATOM 4790 H1 WAT 8778 129.673 73.892 86.486 1.00 0.00 H ATOM 4791 H2 WAT 8778 130.013 72.808 85.486 1.00 0.00 H TER 4793 WAT 8778 ATOM 4793 O WAT 8779 80.679 117.878 70.138 1.00 0.00 O ATOM 4794 H1 WAT 8779 79.750 118.091 70.056 1.00 0.00 H ATOM 4795 H2 WAT 8779 80.980 117.767 69.236 1.00 0.00 H TER 4797 WAT 8779 ATOM 4797 O WAT 8780 15.358 10.057 7.399 1.00 0.00 O ATOM 4798 H1 WAT 8780 15.701 10.774 7.932 1.00 0.00 H ATOM 4799 H2 WAT 8780 15.413 9.289 7.967 1.00 0.00 H TER 4801 WAT 8780 ATOM 4801 O WAT 8781 1.121 114.565 74.921 1.00 0.00 O ATOM 4802 H1 WAT 8781 0.232 114.822 74.674 1.00 0.00 H ATOM 4803 H2 WAT 8781 1.187 114.791 75.849 1.00 0.00 H TER 4805 WAT 8781 ATOM 4805 O WAT 8782 70.870 90.901 155.236 1.00 0.00 O ATOM 4806 H1 WAT 8782 71.772 91.222 155.220 1.00 0.00 H ATOM 4807 H2 WAT 8782 70.596 91.001 156.148 1.00 0.00 H TER 4809 WAT 8782 ATOM 4809 O WAT 8783 28.173 16.106 10.302 1.00 0.00 O ATOM 4810 H1 WAT 8783 28.881 16.439 10.854 1.00 0.00 H ATOM 4811 H2 WAT 8783 28.294 16.551 9.463 1.00 0.00 H TER 4813 WAT 8783 ATOM 4813 O WAT 8784 15.831 52.175 7.265 1.00 0.00 O ATOM 4814 H1 WAT 8784 16.282 53.006 7.412 1.00 0.00 H ATOM 4815 H2 WAT 8784 16.280 51.789 6.513 1.00 0.00 H TER 4817 WAT 8784 ATOM 4817 O WAT 8785 28.023 72.898 81.065 1.00 0.00 O ATOM 4818 H1 WAT 8785 27.545 72.082 80.914 1.00 0.00 H ATOM 4819 H2 WAT 8785 28.931 72.687 80.850 1.00 0.00 H TER 4821 WAT 8785 ATOM 4821 O WAT 8786 91.030 79.199 21.959 1.00 0.00 O ATOM 4822 H1 WAT 8786 91.729 79.461 21.360 1.00 0.00 H ATOM 4823 H2 WAT 8786 91.335 79.481 22.821 1.00 0.00 H TER 4825 WAT 8786 ATOM 4825 O WAT 8787 97.750 22.819 61.505 1.00 0.00 O ATOM 4826 H1 WAT 8787 97.623 21.876 61.401 1.00 0.00 H ATOM 4827 H2 WAT 8787 96.866 23.185 61.460 1.00 0.00 H TER 4829 WAT 8787 ATOM 4829 O WAT 8788 76.688 34.005 145.035 1.00 0.00 O ATOM 4830 H1 WAT 8788 75.887 34.469 144.790 1.00 0.00 H ATOM 4831 H2 WAT 8788 76.448 33.079 145.000 1.00 0.00 H TER 4833 WAT 8788 ATOM 4833 O WAT 8789 63.827 105.661 158.451 1.00 0.00 O ATOM 4834 H1 WAT 8789 63.231 105.886 159.166 1.00 0.00 H ATOM 4835 H2 WAT 8789 63.497 104.826 158.118 1.00 0.00 H TER 4837 WAT 8789 ATOM 4837 O WAT 8790 136.139 40.235 17.167 1.00 0.00 O ATOM 4838 H1 WAT 8790 135.869 39.319 17.230 1.00 0.00 H ATOM 4839 H2 WAT 8790 136.492 40.441 18.033 1.00 0.00 H TER 4841 WAT 8790 ATOM 4841 O WAT 8791 120.124 50.528 144.363 1.00 0.00 O ATOM 4842 H1 WAT 8791 121.028 50.653 144.652 1.00 0.00 H ATOM 4843 H2 WAT 8791 120.193 49.940 143.610 1.00 0.00 H TER 4845 WAT 8791 ATOM 4845 O WAT 8792 1.607 12.661 74.223 1.00 0.00 O ATOM 4846 H1 WAT 8792 1.651 13.615 74.293 1.00 0.00 H ATOM 4847 H2 WAT 8792 1.545 12.492 73.283 1.00 0.00 H TER 4849 WAT 8792 ATOM 4849 O WAT 8793 102.209 89.536 136.802 1.00 0.00 O ATOM 4850 H1 WAT 8793 101.732 90.334 137.030 1.00 0.00 H ATOM 4851 H2 WAT 8793 102.616 89.257 137.621 1.00 0.00 H TER 4853 WAT 8793 ATOM 4853 O WAT 8794 26.174 85.997 102.302 1.00 0.00 O ATOM 4854 H1 WAT 8794 26.416 85.355 101.634 1.00 0.00 H ATOM 4855 H2 WAT 8794 25.710 86.681 101.819 1.00 0.00 H TER 4857 WAT 8794 ATOM 4857 O WAT 8795 92.964 33.606 21.639 1.00 0.00 O ATOM 4858 H1 WAT 8795 92.625 33.032 22.326 1.00 0.00 H ATOM 4859 H2 WAT 8795 93.915 33.505 21.690 1.00 0.00 H TER 4861 WAT 8795 ATOM 4861 O WAT 8796 25.304 139.436 129.215 1.00 0.00 O ATOM 4862 H1 WAT 8796 25.211 139.547 130.161 1.00 0.00 H ATOM 4863 H2 WAT 8796 26.242 139.537 129.054 1.00 0.00 H TER 4865 WAT 8796 ATOM 4865 O WAT 8797 136.059 129.796 119.934 1.00 0.00 O ATOM 4866 H1 WAT 8797 135.456 129.199 119.492 1.00 0.00 H ATOM 4867 H2 WAT 8797 136.125 129.453 120.826 1.00 0.00 H TER 4869 WAT 8797 ATOM 4869 O WAT 8798 55.199 132.168 146.870 1.00 0.00 O ATOM 4870 H1 WAT 8798 55.270 131.614 146.093 1.00 0.00 H ATOM 4871 H2 WAT 8798 54.987 133.036 146.527 1.00 0.00 H TER 4873 WAT 8798 ATOM 4873 O WAT 8799 138.306 139.102 97.269 1.00 0.00 O ATOM 4874 H1 WAT 8799 138.347 138.148 97.193 1.00 0.00 H ATOM 4875 H2 WAT 8799 137.373 139.294 97.367 1.00 0.00 H TER 4877 WAT 8799 ATOM 4877 O WAT 8800 124.482 7.427 139.207 1.00 0.00 O ATOM 4878 H1 WAT 8800 124.067 6.927 139.909 1.00 0.00 H ATOM 4879 H2 WAT 8800 123.964 7.222 138.429 1.00 0.00 H TER 4881 WAT 8800 ATOM 4881 O WAT 8801 76.863 98.723 2.621 1.00 0.00 O ATOM 4882 H1 WAT 8801 76.796 99.628 2.317 1.00 0.00 H ATOM 4883 H2 WAT 8801 77.684 98.696 3.112 1.00 0.00 H TER 4885 WAT 8801 ATOM 4885 O WAT 8802 20.763 94.115 145.188 1.00 0.00 O ATOM 4886 H1 WAT 8802 19.965 93.651 144.934 1.00 0.00 H ATOM 4887 H2 WAT 8802 20.593 95.028 144.957 1.00 0.00 H TER 4889 WAT 8802 ATOM 4889 O WAT 8803 86.632 101.189 20.448 1.00 0.00 O ATOM 4890 H1 WAT 8803 86.693 101.974 20.992 1.00 0.00 H ATOM 4891 H2 WAT 8803 87.061 100.506 20.964 1.00 0.00 H TER 4893 WAT 8803 ATOM 4893 O WAT 8804 31.213 57.551 80.336 1.00 0.00 O ATOM 4894 H1 WAT 8804 32.051 57.762 79.924 1.00 0.00 H ATOM 4895 H2 WAT 8804 31.343 57.756 81.262 1.00 0.00 H TER 4897 WAT 8804 ATOM 4897 O WAT 8805 35.222 112.824 151.843 1.00 0.00 O ATOM 4898 H1 WAT 8805 35.673 112.666 151.014 1.00 0.00 H ATOM 4899 H2 WAT 8805 35.588 112.173 152.442 1.00 0.00 H TER 4901 WAT 8805 ATOM 4901 O WAT 8806 67.879 43.064 146.923 1.00 0.00 O ATOM 4902 H1 WAT 8806 67.568 42.485 146.227 1.00 0.00 H ATOM 4903 H2 WAT 8806 67.541 42.673 147.728 1.00 0.00 H TER 4905 WAT 8806 ATOM 4905 O WAT 8807 106.188 80.333 18.522 1.00 0.00 O ATOM 4906 H1 WAT 8807 105.895 79.605 19.070 1.00 0.00 H ATOM 4907 H2 WAT 8807 107.001 80.629 18.932 1.00 0.00 H TER 4909 WAT 8807 ATOM 4909 O WAT 8808 114.606 131.351 119.460 1.00 0.00 O ATOM 4910 H1 WAT 8808 113.995 132.061 119.658 1.00 0.00 H ATOM 4911 H2 WAT 8808 115.273 131.757 118.907 1.00 0.00 H TER 4913 WAT 8808 ATOM 4913 O WAT 8809 86.131 90.197 154.619 1.00 0.00 O ATOM 4914 H1 WAT 8809 86.507 90.971 155.039 1.00 0.00 H ATOM 4915 H2 WAT 8809 86.517 89.458 155.089 1.00 0.00 H TER 4917 WAT 8809 ATOM 4917 O WAT 8810 42.331 106.810 86.985 1.00 0.00 O ATOM 4918 H1 WAT 8810 41.502 106.390 87.215 1.00 0.00 H ATOM 4919 H2 WAT 8810 42.174 107.193 86.122 1.00 0.00 H TER 4921 WAT 8810 ATOM 4921 O WAT 8811 21.780 22.325 97.120 1.00 0.00 O ATOM 4922 H1 WAT 8811 20.979 22.846 97.067 1.00 0.00 H ATOM 4923 H2 WAT 8811 21.542 21.479 96.742 1.00 0.00 H TER 4925 WAT 8811 ATOM 4925 O WAT 8812 66.722 126.143 116.286 1.00 0.00 O ATOM 4926 H1 WAT 8812 66.577 126.249 115.346 1.00 0.00 H ATOM 4927 H2 WAT 8812 67.673 126.176 116.387 1.00 0.00 H TER 4929 WAT 8812 ATOM 4929 O WAT 8813 3.765 9.336 131.686 1.00 0.00 O ATOM 4930 H1 WAT 8813 4.522 9.886 131.485 1.00 0.00 H ATOM 4931 H2 WAT 8813 3.240 9.349 130.886 1.00 0.00 H TER 4933 WAT 8813 ATOM 4933 O WAT 8814 98.050 137.090 72.711 1.00 0.00 O ATOM 4934 H1 WAT 8814 98.655 137.781 72.441 1.00 0.00 H ATOM 4935 H2 WAT 8814 98.182 136.392 72.069 1.00 0.00 H TER 4937 WAT 8814 ATOM 4937 O WAT 8815 120.333 96.430 142.791 1.00 0.00 O ATOM 4938 H1 WAT 8815 120.898 96.992 142.261 1.00 0.00 H ATOM 4939 H2 WAT 8815 119.640 97.011 143.103 1.00 0.00 H TER 4941 WAT 8815 ATOM 4941 O WAT 8816 33.008 70.079 83.390 1.00 0.00 O ATOM 4942 H1 WAT 8816 33.879 69.972 83.772 1.00 0.00 H ATOM 4943 H2 WAT 8816 32.929 69.357 82.766 1.00 0.00 H TER 4945 WAT 8816 ATOM 4945 O WAT 8817 31.218 81.093 26.402 1.00 0.00 O ATOM 4946 H1 WAT 8817 30.707 80.513 25.837 1.00 0.00 H ATOM 4947 H2 WAT 8817 30.839 81.961 26.259 1.00 0.00 H TER 4949 WAT 8817 ATOM 4949 O WAT 8818 3.682 114.342 77.446 1.00 0.00 O ATOM 4950 H1 WAT 8818 2.954 114.955 77.346 1.00 0.00 H ATOM 4951 H2 WAT 8818 3.283 113.478 77.343 1.00 0.00 H TER 4953 WAT 8818 ATOM 4953 O WAT 8819 27.135 3.152 143.556 1.00 0.00 O ATOM 4954 H1 WAT 8819 27.855 2.578 143.295 1.00 0.00 H ATOM 4955 H2 WAT 8819 26.559 3.176 142.793 1.00 0.00 H TER 4957 WAT 8819 ATOM 4957 O WAT 8820 128.257 10.323 71.603 1.00 0.00 O ATOM 4958 H1 WAT 8820 128.676 9.510 71.320 1.00 0.00 H ATOM 4959 H2 WAT 8820 128.317 10.901 70.843 1.00 0.00 H TER 4961 WAT 8820 ATOM 4961 O WAT 8821 130.103 20.646 64.940 1.00 0.00 O ATOM 4962 H1 WAT 8821 130.832 20.784 64.336 1.00 0.00 H ATOM 4963 H2 WAT 8821 129.320 20.772 64.404 1.00 0.00 H TER 4965 WAT 8821 ATOM 4965 O WAT 8822 8.071 13.931 3.681 1.00 0.00 O ATOM 4966 H1 WAT 8822 7.735 13.072 3.425 1.00 0.00 H ATOM 4967 H2 WAT 8822 8.259 14.372 2.853 1.00 0.00 H TER 4969 WAT 8822 ATOM 4969 O WAT 8823 139.189 37.148 58.432 1.00 0.00 O ATOM 4970 H1 WAT 8823 139.992 37.163 58.952 1.00 0.00 H ATOM 4971 H2 WAT 8823 139.027 38.066 58.214 1.00 0.00 H TER 4973 WAT 8823 ATOM 4973 O WAT 8824 108.300 109.980 79.020 1.00 0.00 O ATOM 4974 H1 WAT 8824 108.030 110.038 79.937 1.00 0.00 H ATOM 4975 H2 WAT 8824 108.926 109.256 79.000 1.00 0.00 H TER 4977 WAT 8824 ATOM 4977 O WAT 8825 134.586 33.419 16.831 1.00 0.00 O ATOM 4978 H1 WAT 8825 133.759 33.568 17.290 1.00 0.00 H ATOM 4979 H2 WAT 8825 135.163 34.115 17.145 1.00 0.00 H TER 4981 WAT 8825 ATOM 4981 O WAT 8826 119.264 60.705 134.545 1.00 0.00 O ATOM 4982 H1 WAT 8826 119.292 60.886 133.606 1.00 0.00 H ATOM 4983 H2 WAT 8826 118.814 61.461 134.922 1.00 0.00 H TER 4985 WAT 8826 ATOM 4985 O WAT 8827 37.448 133.598 108.271 1.00 0.00 O ATOM 4986 H1 WAT 8827 37.615 133.666 109.211 1.00 0.00 H ATOM 4987 H2 WAT 8827 36.784 134.265 108.096 1.00 0.00 H TER 4989 WAT 8827 ATOM 4989 O WAT 8828 100.739 115.476 118.354 1.00 0.00 O ATOM 4990 H1 WAT 8828 101.681 115.305 118.367 1.00 0.00 H ATOM 4991 H2 WAT 8828 100.401 114.898 117.670 1.00 0.00 H TER 4993 WAT 8828 ATOM 4993 O WAT 8829 19.978 4.543 105.917 1.00 0.00 O ATOM 4994 H1 WAT 8829 20.807 4.959 106.154 1.00 0.00 H ATOM 4995 H2 WAT 8829 19.312 5.065 106.362 1.00 0.00 H TER 4997 WAT 8829 ATOM 4997 O WAT 8830 53.451 126.510 114.805 1.00 0.00 O ATOM 4998 H1 WAT 8830 52.681 126.792 114.312 1.00 0.00 H ATOM 4999 H2 WAT 8830 53.095 126.003 115.535 1.00 0.00 H TER 5001 WAT 8830 ATOM 5001 O WAT 8831 60.062 101.135 15.298 1.00 0.00 O ATOM 5002 H1 WAT 8831 60.960 101.457 15.378 1.00 0.00 H ATOM 5003 H2 WAT 8831 60.116 100.212 15.543 1.00 0.00 H TER 5005 WAT 8831 ATOM 5005 O WAT 8832 129.336 103.734 91.805 1.00 0.00 O ATOM 5006 H1 WAT 8832 129.039 102.856 92.046 1.00 0.00 H ATOM 5007 H2 WAT 8832 129.629 103.647 90.898 1.00 0.00 H TER 5009 WAT 8832 ATOM 5009 O WAT 8833 34.208 97.777 60.414 1.00 0.00 O ATOM 5010 H1 WAT 8833 34.115 96.894 60.772 1.00 0.00 H ATOM 5011 H2 WAT 8833 35.010 97.740 59.892 1.00 0.00 H TER 5013 WAT 8833 ATOM 5013 O WAT 8834 112.915 83.409 105.712 1.00 0.00 O ATOM 5014 H1 WAT 8834 112.027 83.103 105.898 1.00 0.00 H ATOM 5015 H2 WAT 8834 112.895 84.343 105.919 1.00 0.00 H TER 5017 WAT 8834 ATOM 5017 O WAT 8835 39.780 137.194 79.578 1.00 0.00 O ATOM 5018 H1 WAT 8835 39.330 137.048 78.746 1.00 0.00 H ATOM 5019 H2 WAT 8835 40.047 136.320 79.862 1.00 0.00 H TER 5021 WAT 8835 ATOM 5021 O WAT 8836 89.428 3.013 18.439 1.00 0.00 O ATOM 5022 H1 WAT 8836 89.384 3.939 18.675 1.00 0.00 H ATOM 5023 H2 WAT 8836 88.684 2.615 18.891 1.00 0.00 H TER 5025 WAT 8836 ATOM 5025 O WAT 8837 134.958 52.804 141.027 1.00 0.00 O ATOM 5026 H1 WAT 8837 134.643 53.630 141.394 1.00 0.00 H ATOM 5027 H2 WAT 8837 134.179 52.250 140.981 1.00 0.00 H TER 5029 WAT 8837 ATOM 5029 O WAT 8838 96.084 48.861 94.623 1.00 0.00 O ATOM 5030 H1 WAT 8838 95.980 49.804 94.745 1.00 0.00 H ATOM 5031 H2 WAT 8838 95.983 48.729 93.680 1.00 0.00 H TER 5033 WAT 8838 ATOM 5033 O WAT 8839 97.601 32.906 96.338 1.00 0.00 O ATOM 5034 H1 WAT 8839 97.815 33.409 95.552 1.00 0.00 H ATOM 5035 H2 WAT 8839 98.451 32.693 96.724 1.00 0.00 H TER 5037 WAT 8839 ATOM 5037 O WAT 8840 108.699 132.525 127.212 1.00 0.00 O ATOM 5038 H1 WAT 8840 108.956 133.388 126.888 1.00 0.00 H ATOM 5039 H2 WAT 8840 109.357 131.929 126.854 1.00 0.00 H TER 5041 WAT 8840 ATOM 5041 O WAT 8841 100.593 70.820 58.609 1.00 0.00 O ATOM 5042 H1 WAT 8841 100.203 71.420 59.245 1.00 0.00 H ATOM 5043 H2 WAT 8841 99.852 70.501 58.095 1.00 0.00 H TER 5045 WAT 8841 ATOM 5045 O WAT 8842 111.356 22.105 73.129 1.00 0.00 O ATOM 5046 H1 WAT 8842 110.632 21.701 73.608 1.00 0.00 H ATOM 5047 H2 WAT 8842 112.035 21.430 73.108 1.00 0.00 H TER 5049 WAT 8842 ATOM 5049 O WAT 8843 8.462 57.486 150.675 1.00 0.00 O ATOM 5050 H1 WAT 8843 9.406 57.342 150.744 1.00 0.00 H ATOM 5051 H2 WAT 8843 8.073 56.779 151.189 1.00 0.00 H TER 5053 WAT 8843 ATOM 5053 O WAT 8844 127.226 104.391 134.368 1.00 0.00 O ATOM 5054 H1 WAT 8844 127.651 105.199 134.659 1.00 0.00 H ATOM 5055 H2 WAT 8844 127.674 104.165 133.553 1.00 0.00 H TER 5057 WAT 8844 ATOM 5057 O WAT 8845 129.468 37.587 81.142 1.00 0.00 O ATOM 5058 H1 WAT 8845 129.793 37.121 80.371 1.00 0.00 H ATOM 5059 H2 WAT 8845 130.258 37.882 81.595 1.00 0.00 H TER 5061 WAT 8845 ATOM 5061 O WAT 8846 91.849 89.597 140.969 1.00 0.00 O ATOM 5062 H1 WAT 8846 91.707 89.182 141.819 1.00 0.00 H ATOM 5063 H2 WAT 8846 92.742 89.352 140.728 1.00 0.00 H TER 5065 WAT 8846 ATOM 5065 O WAT 8847 102.904 116.651 99.874 1.00 0.00 O ATOM 5066 H1 WAT 8847 103.517 116.402 100.566 1.00 0.00 H ATOM 5067 H2 WAT 8847 103.452 117.064 99.206 1.00 0.00 H TER 5069 WAT 8847 ATOM 5069 O WAT 8848 56.265 145.066 123.915 1.00 0.00 O ATOM 5070 H1 WAT 8848 57.036 145.347 123.422 1.00 0.00 H ATOM 5071 H2 WAT 8848 56.606 144.827 124.777 1.00 0.00 H TER 5073 WAT 8848 ATOM 5073 O WAT 8849 36.113 72.283 129.455 1.00 0.00 O ATOM 5074 H1 WAT 8849 35.360 72.155 130.032 1.00 0.00 H ATOM 5075 H2 WAT 8849 36.055 73.200 129.185 1.00 0.00 H TER 5077 WAT 8849 ATOM 5077 O WAT 8850 131.665 22.240 110.880 1.00 0.00 O ATOM 5078 H1 WAT 8850 131.513 22.389 111.813 1.00 0.00 H ATOM 5079 H2 WAT 8850 132.125 21.402 110.842 1.00 0.00 H TER 5081 WAT 8850 ATOM 5081 O WAT 8851 67.669 138.852 74.558 1.00 0.00 O ATOM 5082 H1 WAT 8851 68.592 138.835 74.303 1.00 0.00 H ATOM 5083 H2 WAT 8851 67.242 139.374 73.879 1.00 0.00 H TER 5085 WAT 8851 ATOM 5085 O WAT 8852 143.806 110.103 80.767 1.00 0.00 O ATOM 5086 H1 WAT 8852 144.211 109.274 80.511 1.00 0.00 H ATOM 5087 H2 WAT 8852 143.872 110.653 79.986 1.00 0.00 H TER 5089 WAT 8852 ATOM 5089 O WAT 8853 1.861 93.870 99.166 1.00 0.00 O ATOM 5090 H1 WAT 8853 2.529 93.395 98.672 1.00 0.00 H ATOM 5091 H2 WAT 8853 2.033 94.792 98.976 1.00 0.00 H TER 5093 WAT 8853 ATOM 5093 O WAT 8854 36.018 87.603 65.148 1.00 0.00 O ATOM 5094 H1 WAT 8854 36.443 88.149 64.487 1.00 0.00 H ATOM 5095 H2 WAT 8854 36.439 87.851 65.971 1.00 0.00 H TER 5097 WAT 8854 ATOM 5097 O WAT 8855 28.770 35.264 115.751 1.00 0.00 O ATOM 5098 H1 WAT 8855 28.648 34.343 115.983 1.00 0.00 H ATOM 5099 H2 WAT 8855 28.248 35.381 114.957 1.00 0.00 H TER 5101 WAT 8855 ATOM 5101 O WAT 8856 24.857 58.255 127.026 1.00 0.00 O ATOM 5102 H1 WAT 8856 24.340 58.908 127.498 1.00 0.00 H ATOM 5103 H2 WAT 8856 24.248 57.885 126.386 1.00 0.00 H TER 5105 WAT 8856 ATOM 5105 O WAT 8857 101.776 137.513 153.930 1.00 0.00 O ATOM 5106 H1 WAT 8857 102.184 137.216 153.116 1.00 0.00 H ATOM 5107 H2 WAT 8857 100.893 137.777 153.673 1.00 0.00 H TER 5109 WAT 8857 ATOM 5109 O WAT 8858 140.825 140.048 112.730 1.00 0.00 O ATOM 5110 H1 WAT 8858 141.600 139.955 112.176 1.00 0.00 H ATOM 5111 H2 WAT 8858 140.188 139.440 112.355 1.00 0.00 H TER 5113 WAT 8858 ATOM 5113 O WAT 8859 73.729 15.863 5.178 1.00 0.00 O ATOM 5114 H1 WAT 8859 74.279 15.124 5.438 1.00 0.00 H ATOM 5115 H2 WAT 8859 73.287 16.129 5.984 1.00 0.00 H TER 5117 WAT 8859 ATOM 5117 O WAT 8860 3.449 44.535 137.842 1.00 0.00 O ATOM 5118 H1 WAT 8860 3.010 44.164 137.077 1.00 0.00 H ATOM 5119 H2 WAT 8860 4.376 44.345 137.703 1.00 0.00 H TER 5121 WAT 8860 ATOM 5121 O WAT 8861 134.099 35.832 5.724 1.00 0.00 O ATOM 5122 H1 WAT 8861 133.465 36.072 6.401 1.00 0.00 H ATOM 5123 H2 WAT 8861 133.946 34.899 5.574 1.00 0.00 H TER 5125 WAT 8861 ATOM 5125 O WAT 8862 63.222 12.133 114.372 1.00 0.00 O ATOM 5126 H1 WAT 8862 62.660 11.794 113.676 1.00 0.00 H ATOM 5127 H2 WAT 8862 63.780 11.393 114.612 1.00 0.00 H TER 5129 WAT 8862 ATOM 5129 O WAT 8863 5.433 90.675 9.178 1.00 0.00 O ATOM 5130 H1 WAT 8863 4.802 89.978 9.359 1.00 0.00 H ATOM 5131 H2 WAT 8863 6.232 90.214 8.923 1.00 0.00 H TER 5133 WAT 8863 ATOM 5133 O WAT 8864 37.477 87.849 117.258 1.00 0.00 O ATOM 5134 H1 WAT 8864 38.003 88.247 117.951 1.00 0.00 H ATOM 5135 H2 WAT 8864 36.867 88.538 116.994 1.00 0.00 H TER 5137 WAT 8864 ATOM 5137 O WAT 8865 2.462 71.588 106.655 1.00 0.00 O ATOM 5138 H1 WAT 8865 3.253 72.068 106.409 1.00 0.00 H ATOM 5139 H2 WAT 8865 2.777 70.878 107.213 1.00 0.00 H TER 5141 WAT 8865 ATOM 5141 O WAT 8866 3.690 49.098 17.901 1.00 0.00 O ATOM 5142 H1 WAT 8866 2.903 48.891 17.398 1.00 0.00 H ATOM 5143 H2 WAT 8866 3.844 48.320 18.437 1.00 0.00 H TER 5145 WAT 8866 ATOM 5145 O WAT 8867 69.752 56.223 71.174 1.00 0.00 O ATOM 5146 H1 WAT 8867 70.423 56.181 71.855 1.00 0.00 H ATOM 5147 H2 WAT 8867 70.178 56.672 70.445 1.00 0.00 H TER 5149 WAT 8867 ATOM 5149 O WAT 8868 36.849 72.172 62.229 1.00 0.00 O ATOM 5150 H1 WAT 8868 36.648 72.055 61.300 1.00 0.00 H ATOM 5151 H2 WAT 8868 36.017 72.434 62.623 1.00 0.00 H TER 5153 WAT 8868 ATOM 5153 O WAT 8869 29.605 131.609 156.513 1.00 0.00 O ATOM 5154 H1 WAT 8869 29.642 131.121 155.691 1.00 0.00 H ATOM 5155 H2 WAT 8869 29.261 130.982 157.149 1.00 0.00 H TER 5157 WAT 8869 ATOM 5157 O WAT 8870 97.002 11.975 80.031 1.00 0.00 O ATOM 5158 H1 WAT 8870 96.601 11.444 79.344 1.00 0.00 H ATOM 5159 H2 WAT 8870 97.820 12.289 79.646 1.00 0.00 H TER 5161 WAT 8870 ATOM 5161 O WAT 8871 100.036 59.444 125.622 1.00 0.00 O ATOM 5162 H1 WAT 8871 100.052 60.379 125.418 1.00 0.00 H ATOM 5163 H2 WAT 8871 100.652 59.347 126.348 1.00 0.00 H TER 5165 WAT 8871 ATOM 5165 O WAT 8872 91.635 27.812 67.554 1.00 0.00 O ATOM 5166 H1 WAT 8872 92.312 27.288 67.126 1.00 0.00 H ATOM 5167 H2 WAT 8872 90.856 27.256 67.538 1.00 0.00 H TER 5169 WAT 8872 ATOM 5169 O WAT 8873 91.213 77.357 11.084 1.00 0.00 O ATOM 5170 H1 WAT 8873 90.326 77.415 11.438 1.00 0.00 H ATOM 5171 H2 WAT 8873 91.752 77.091 11.829 1.00 0.00 H TER 5173 WAT 8873 ATOM 5173 O WAT 8874 131.648 124.608 107.554 1.00 0.00 O ATOM 5174 H1 WAT 8874 130.950 125.072 108.017 1.00 0.00 H ATOM 5175 H2 WAT 8874 132.372 125.234 107.523 1.00 0.00 H TER 5177 WAT 8874 ATOM 5177 O WAT 8875 59.871 4.395 106.682 1.00 0.00 O ATOM 5178 H1 WAT 8875 59.060 4.249 106.196 1.00 0.00 H ATOM 5179 H2 WAT 8875 60.513 3.829 106.254 1.00 0.00 H TER 5181 WAT 8875 ATOM 5181 O WAT 8876 137.126 76.158 84.091 1.00 0.00 O ATOM 5182 H1 WAT 8876 137.520 77.029 84.136 1.00 0.00 H ATOM 5183 H2 WAT 8876 136.830 76.075 83.184 1.00 0.00 H TER 5185 WAT 8876 ATOM 5185 O WAT 8877 129.187 25.048 157.996 1.00 0.00 O ATOM 5186 H1 WAT 8877 129.534 25.363 158.831 1.00 0.00 H ATOM 5187 H2 WAT 8877 129.959 24.758 157.510 1.00 0.00 H TER 5189 WAT 8877 ATOM 5189 O WAT 8878 68.735 24.386 145.114 1.00 0.00 O ATOM 5190 H1 WAT 8878 69.251 23.743 144.627 1.00 0.00 H ATOM 5191 H2 WAT 8878 68.445 25.012 144.451 1.00 0.00 H TER 5193 WAT 8878 ATOM 5193 O WAT 8879 113.023 141.154 20.826 1.00 0.00 O ATOM 5194 H1 WAT 8879 113.314 140.349 20.398 1.00 0.00 H ATOM 5195 H2 WAT 8879 113.619 141.828 20.498 1.00 0.00 H TER 5197 WAT 8879 ATOM 5197 O WAT 8880 139.667 133.181 89.829 1.00 0.00 O ATOM 5198 H1 WAT 8880 139.070 132.873 89.146 1.00 0.00 H ATOM 5199 H2 WAT 8880 139.492 132.607 90.575 1.00 0.00 H TER 5201 WAT 8880 ATOM 5201 O WAT 8881 112.327 51.936 69.830 1.00 0.00 O ATOM 5202 H1 WAT 8881 112.310 51.124 70.336 1.00 0.00 H ATOM 5203 H2 WAT 8881 112.405 52.627 70.488 1.00 0.00 H TER 5205 WAT 8881 ATOM 5205 O WAT 8882 73.429 67.292 7.464 1.00 0.00 O ATOM 5206 H1 WAT 8882 73.542 68.177 7.116 1.00 0.00 H ATOM 5207 H2 WAT 8882 74.173 67.171 8.055 1.00 0.00 H TER 5209 WAT 8882 ATOM 5209 O WAT 8883 30.511 40.387 130.023 1.00 0.00 O ATOM 5210 H1 WAT 8883 30.749 40.218 130.934 1.00 0.00 H ATOM 5211 H2 WAT 8883 29.988 39.627 129.767 1.00 0.00 H TER 5213 WAT 8883 ATOM 5213 O WAT 8884 75.968 39.861 156.865 1.00 0.00 O ATOM 5214 H1 WAT 8884 75.756 39.469 156.018 1.00 0.00 H ATOM 5215 H2 WAT 8884 75.819 40.798 156.738 1.00 0.00 H TER 5217 WAT 8884 ATOM 5217 O WAT 8885 113.244 127.999 102.362 1.00 0.00 O ATOM 5218 H1 WAT 8885 113.930 127.401 102.063 1.00 0.00 H ATOM 5219 H2 WAT 8885 113.704 128.819 102.542 1.00 0.00 H TER 5221 WAT 8885 ATOM 5221 O WAT 8886 85.329 22.975 68.602 1.00 0.00 O ATOM 5222 H1 WAT 8886 84.628 23.059 67.955 1.00 0.00 H ATOM 5223 H2 WAT 8886 85.353 23.825 69.042 1.00 0.00 H TER 5225 WAT 8886 ATOM 5225 O WAT 8887 78.603 29.865 132.696 1.00 0.00 O ATOM 5226 H1 WAT 8887 77.926 29.236 132.443 1.00 0.00 H ATOM 5227 H2 WAT 8887 79.132 29.977 131.907 1.00 0.00 H TER 5229 WAT 8887 ATOM 5229 O WAT 8888 37.674 32.011 61.754 1.00 0.00 O ATOM 5230 H1 WAT 8888 38.295 31.334 61.485 1.00 0.00 H ATOM 5231 H2 WAT 8888 38.125 32.835 61.574 1.00 0.00 H TER 5233 WAT 8888 ATOM 5233 O WAT 8889 89.457 132.728 12.586 1.00 0.00 O ATOM 5234 H1 WAT 8889 89.278 133.036 13.474 1.00 0.00 H ATOM 5235 H2 WAT 8889 89.006 131.885 12.529 1.00 0.00 H TER 5237 WAT 8889 ATOM 5237 O WAT 8890 14.233 141.993 75.201 1.00 0.00 O ATOM 5238 H1 WAT 8890 14.826 141.616 75.851 1.00 0.00 H ATOM 5239 H2 WAT 8890 13.835 142.741 75.646 1.00 0.00 H TER 5241 WAT 8890 ATOM 5241 O WAT 8891 20.030 53.954 153.860 1.00 0.00 O ATOM 5242 H1 WAT 8891 19.819 53.048 153.635 1.00 0.00 H ATOM 5243 H2 WAT 8891 19.675 54.470 153.136 1.00 0.00 H TER 5245 WAT 8891 ATOM 5245 O WAT 8892 81.654 51.412 11.045 1.00 0.00 O ATOM 5246 H1 WAT 8892 82.528 51.243 10.692 1.00 0.00 H ATOM 5247 H2 WAT 8892 81.814 51.832 11.890 1.00 0.00 H TER 5249 WAT 8892 ATOM 5249 O WAT 8893 105.510 113.608 75.201 1.00 0.00 O ATOM 5250 H1 WAT 8893 104.842 114.018 74.651 1.00 0.00 H ATOM 5251 H2 WAT 8893 106.340 113.914 74.836 1.00 0.00 H TER 5253 WAT 8893 ATOM 5253 O WAT 8894 126.684 60.006 115.899 1.00 0.00 O ATOM 5254 H1 WAT 8894 126.827 60.121 116.839 1.00 0.00 H ATOM 5255 H2 WAT 8894 127.368 59.394 115.626 1.00 0.00 H TER 5257 WAT 8894 ATOM 5257 O WAT 8895 10.767 9.896 2.804 1.00 0.00 O ATOM 5258 H1 WAT 8895 11.100 9.002 2.726 1.00 0.00 H ATOM 5259 H2 WAT 8895 10.990 10.308 1.970 1.00 0.00 H TER 5261 WAT 8895 ATOM 5261 O WAT 8896 103.900 40.376 151.547 1.00 0.00 O ATOM 5262 H1 WAT 8896 102.944 40.396 151.497 1.00 0.00 H ATOM 5263 H2 WAT 8896 104.178 40.074 150.683 1.00 0.00 H TER 5265 WAT 8896 ATOM 5265 O WAT 8897 123.958 51.692 82.955 1.00 0.00 O ATOM 5266 H1 WAT 8897 124.558 52.256 83.444 1.00 0.00 H ATOM 5267 H2 WAT 8897 123.794 52.167 82.140 1.00 0.00 H TER 5269 WAT 8897 ATOM 5269 O WAT 8898 142.068 83.243 22.237 1.00 0.00 O ATOM 5270 H1 WAT 8898 142.692 83.579 21.594 1.00 0.00 H ATOM 5271 H2 WAT 8898 141.948 83.964 22.855 1.00 0.00 H TER 5273 WAT 8898 ATOM 5273 O WAT 8899 74.428 59.888 99.342 1.00 0.00 O ATOM 5274 H1 WAT 8899 75.106 60.468 98.996 1.00 0.00 H ATOM 5275 H2 WAT 8899 74.038 60.379 100.064 1.00 0.00 H TER 5277 WAT 8899 ATOM 5277 O WAT 8900 3.063 66.894 142.756 1.00 0.00 O ATOM 5278 H1 WAT 8900 3.039 65.958 142.559 1.00 0.00 H ATOM 5279 H2 WAT 8900 2.242 67.235 142.399 1.00 0.00 H TER 5281 WAT 8900 ATOM 5281 O WAT 8901 132.126 13.309 126.833 1.00 0.00 O ATOM 5282 H1 WAT 8901 132.895 12.841 127.158 1.00 0.00 H ATOM 5283 H2 WAT 8901 132.485 14.019 126.301 1.00 0.00 H TER 5285 WAT 8901 ATOM 5285 O WAT 8902 38.334 137.289 112.518 1.00 0.00 O ATOM 5286 H1 WAT 8902 37.631 137.905 112.727 1.00 0.00 H ATOM 5287 H2 WAT 8902 38.140 136.516 113.048 1.00 0.00 H TER 5289 WAT 8902 ATOM 5289 O WAT 8903 91.254 41.015 15.763 1.00 0.00 O ATOM 5290 H1 WAT 8903 91.554 40.272 15.239 1.00 0.00 H ATOM 5291 H2 WAT 8903 91.910 41.695 15.612 1.00 0.00 H TER 5293 WAT 8903 ATOM 5293 O WAT 8904 86.102 140.617 97.694 1.00 0.00 O ATOM 5294 H1 WAT 8904 86.533 141.290 98.221 1.00 0.00 H ATOM 5295 H2 WAT 8904 85.722 140.017 98.336 1.00 0.00 H TER 5297 WAT 8904 ATOM 5297 O WAT 8905 133.748 144.377 3.247 1.00 0.00 O ATOM 5298 H1 WAT 8905 133.324 143.647 2.796 1.00 0.00 H ATOM 5299 H2 WAT 8905 134.676 144.143 3.260 1.00 0.00 H TER 5301 WAT 8905 ATOM 5301 O WAT 8906 124.941 53.280 16.365 1.00 0.00 O ATOM 5302 H1 WAT 8906 124.432 53.087 15.578 1.00 0.00 H ATOM 5303 H2 WAT 8906 124.990 52.445 16.830 1.00 0.00 H TER 5305 WAT 8906 ATOM 5305 O WAT 8907 79.613 69.535 122.421 1.00 0.00 O ATOM 5306 H1 WAT 8907 78.947 69.159 122.996 1.00 0.00 H ATOM 5307 H2 WAT 8907 79.272 69.396 121.537 1.00 0.00 H TER 5309 WAT 8907 ATOM 5309 O WAT 8908 133.313 29.702 150.880 1.00 0.00 O ATOM 5310 H1 WAT 8908 133.486 29.838 149.949 1.00 0.00 H ATOM 5311 H2 WAT 8908 134.151 29.877 151.308 1.00 0.00 H TER 5313 WAT 8908 ATOM 5313 O WAT 8909 35.627 96.643 118.497 1.00 0.00 O ATOM 5314 H1 WAT 8909 35.213 97.053 119.256 1.00 0.00 H ATOM 5315 H2 WAT 8909 36.228 97.310 118.163 1.00 0.00 H TER 5317 WAT 8909 ATOM 5317 O WAT 8910 63.411 65.514 149.888 1.00 0.00 O ATOM 5318 H1 WAT 8910 62.458 65.433 149.861 1.00 0.00 H ATOM 5319 H2 WAT 8910 63.567 66.398 150.220 1.00 0.00 H TER 5321 WAT 8910 ATOM 5321 O WAT 8911 92.638 42.067 5.704 1.00 0.00 O ATOM 5322 H1 WAT 8911 93.410 41.927 5.155 1.00 0.00 H ATOM 5323 H2 WAT 8911 92.042 42.574 5.153 1.00 0.00 H TER 5325 WAT 8911 ATOM 5325 O WAT 8912 66.542 18.514 67.015 1.00 0.00 O ATOM 5326 H1 WAT 8912 65.644 18.589 66.691 1.00 0.00 H ATOM 5327 H2 WAT 8912 66.686 19.320 67.510 1.00 0.00 H TER 5329 WAT 8912 ATOM 5329 O WAT 8913 19.621 132.171 76.240 1.00 0.00 O ATOM 5330 H1 WAT 8913 18.793 132.033 76.700 1.00 0.00 H ATOM 5331 H2 WAT 8913 19.365 132.352 75.335 1.00 0.00 H TER 5333 WAT 8913 ATOM 5333 O WAT 8914 4.937 61.467 56.150 1.00 0.00 O ATOM 5334 H1 WAT 8914 4.694 62.388 56.251 1.00 0.00 H ATOM 5335 H2 WAT 8914 5.872 61.442 56.355 1.00 0.00 H TER 5337 WAT 8914 ATOM 5337 O WAT 8915 66.816 137.330 68.262 1.00 0.00 O ATOM 5338 H1 WAT 8915 67.119 138.216 68.062 1.00 0.00 H ATOM 5339 H2 WAT 8915 67.284 137.092 69.062 1.00 0.00 H TER 5341 WAT 8915 ATOM 5341 O WAT 8916 22.405 112.243 123.436 1.00 0.00 O ATOM 5342 H1 WAT 8916 21.565 111.841 123.216 1.00 0.00 H ATOM 5343 H2 WAT 8916 23.044 111.768 122.904 1.00 0.00 H TER 5345 WAT 8916 ATOM 5345 O WAT 8917 78.075 29.363 91.376 1.00 0.00 O ATOM 5346 H1 WAT 8917 77.226 29.368 90.932 1.00 0.00 H ATOM 5347 H2 WAT 8917 77.957 29.950 92.123 1.00 0.00 H TER 5349 WAT 8917 ATOM 5349 O WAT 8918 77.236 60.646 88.499 1.00 0.00 O ATOM 5350 H1 WAT 8918 76.526 60.007 88.443 1.00 0.00 H ATOM 5351 H2 WAT 8918 77.201 61.118 87.667 1.00 0.00 H TER 5353 WAT 8918 ATOM 5353 O WAT 8919 110.159 130.466 104.164 1.00 0.00 O ATOM 5354 H1 WAT 8919 110.733 131.122 103.768 1.00 0.00 H ATOM 5355 H2 WAT 8919 109.986 129.842 103.459 1.00 0.00 H TER 5357 WAT 8919 ATOM 5357 O WAT 8920 78.147 118.567 135.640 1.00 0.00 O ATOM 5358 H1 WAT 8920 77.384 119.144 135.602 1.00 0.00 H ATOM 5359 H2 WAT 8920 77.778 117.687 135.719 1.00 0.00 H TER 5361 WAT 8920 ATOM 5361 O WAT 8921 113.517 51.655 126.997 1.00 0.00 O ATOM 5362 H1 WAT 8921 114.011 51.412 127.779 1.00 0.00 H ATOM 5363 H2 WAT 8921 112.620 51.381 127.185 1.00 0.00 H TER 5365 WAT 8921 ATOM 5365 O WAT 8922 54.882 136.643 74.451 1.00 0.00 O ATOM 5366 H1 WAT 8922 55.394 137.084 73.773 1.00 0.00 H ATOM 5367 H2 WAT 8922 54.744 137.312 75.121 1.00 0.00 H TER 5369 WAT 8922 ATOM 5369 O WAT 8923 89.162 45.617 155.949 1.00 0.00 O ATOM 5370 H1 WAT 8923 89.424 46.537 155.984 1.00 0.00 H ATOM 5371 H2 WAT 8923 88.272 45.608 156.299 1.00 0.00 H TER 5373 WAT 8923 ATOM 5373 O WAT 8924 11.540 136.088 86.076 1.00 0.00 O ATOM 5374 H1 WAT 8924 11.299 136.556 85.276 1.00 0.00 H ATOM 5375 H2 WAT 8924 12.252 136.607 86.452 1.00 0.00 H TER 5377 WAT 8924 ATOM 5377 O WAT 8925 22.003 104.030 16.734 1.00 0.00 O ATOM 5378 H1 WAT 8925 21.419 103.467 17.242 1.00 0.00 H ATOM 5379 H2 WAT 8925 22.819 103.533 16.670 1.00 0.00 H TER 5381 WAT 8925 ATOM 5381 O WAT 8926 136.059 125.517 109.879 1.00 0.00 O ATOM 5382 H1 WAT 8926 135.433 124.825 110.092 1.00 0.00 H ATOM 5383 H2 WAT 8926 135.515 126.261 109.622 1.00 0.00 H TER 5385 WAT 8926 ATOM 5385 O WAT 8927 72.538 99.111 117.767 1.00 0.00 O ATOM 5386 H1 WAT 8927 73.142 99.850 117.833 1.00 0.00 H ATOM 5387 H2 WAT 8927 72.440 98.800 118.667 1.00 0.00 H TER 5389 WAT 8927 ATOM 5389 O WAT 8928 141.122 44.316 143.610 1.00 0.00 O ATOM 5390 H1 WAT 8928 141.627 43.824 144.258 1.00 0.00 H ATOM 5391 H2 WAT 8928 141.222 45.231 143.872 1.00 0.00 H TER 5393 WAT 8928 ATOM 5393 O WAT 8929 39.440 29.629 119.034 1.00 0.00 O ATOM 5394 H1 WAT 8929 38.994 29.010 118.455 1.00 0.00 H ATOM 5395 H2 WAT 8929 40.371 29.452 118.901 1.00 0.00 H TER 5397 WAT 8929 ATOM 5397 O WAT 8930 140.920 83.741 149.714 1.00 0.00 O ATOM 5398 H1 WAT 8930 140.053 83.341 149.647 1.00 0.00 H ATOM 5399 H2 WAT 8930 140.830 84.395 150.407 1.00 0.00 H TER 5401 WAT 8930 ATOM 5401 O WAT 8931 19.068 44.730 62.828 1.00 0.00 O ATOM 5402 H1 WAT 8931 18.219 44.288 62.794 1.00 0.00 H ATOM 5403 H2 WAT 8931 18.852 45.661 62.861 1.00 0.00 H TER 5405 WAT 8931 ATOM 5405 O WAT 8932 21.641 118.275 74.053 1.00 0.00 O ATOM 5406 H1 WAT 8932 20.880 118.831 73.887 1.00 0.00 H ATOM 5407 H2 WAT 8932 21.434 117.449 73.616 1.00 0.00 H TER 5409 WAT 8932 ATOM 5409 O WAT 8933 9.679 107.447 126.732 1.00 0.00 O ATOM 5410 H1 WAT 8933 9.961 108.036 127.432 1.00 0.00 H ATOM 5411 H2 WAT 8933 10.248 106.682 126.817 1.00 0.00 H TER 5413 WAT 8933 ATOM 5413 O WAT 8934 13.446 89.972 129.771 1.00 0.00 O ATOM 5414 H1 WAT 8934 14.174 89.473 130.142 1.00 0.00 H ATOM 5415 H2 WAT 8934 13.722 90.167 128.875 1.00 0.00 H TER 5417 WAT 8934 ATOM 5417 O WAT 8935 61.390 117.939 107.693 1.00 0.00 O ATOM 5418 H1 WAT 8935 60.886 117.288 107.205 1.00 0.00 H ATOM 5419 H2 WAT 8935 60.755 118.623 107.907 1.00 0.00 H TER 5421 WAT 8935 ATOM 5421 O WAT 8936 85.425 26.704 94.879 1.00 0.00 O ATOM 5422 H1 WAT 8936 85.261 27.196 94.075 1.00 0.00 H ATOM 5423 H2 WAT 8936 84.554 26.471 95.199 1.00 0.00 H TER 5425 WAT 8936 ATOM 5425 O WAT 8937 6.607 20.186 8.547 1.00 0.00 O ATOM 5426 H1 WAT 8937 7.314 20.191 7.901 1.00 0.00 H ATOM 5427 H2 WAT 8937 6.414 19.258 8.683 1.00 0.00 H TER 5429 WAT 8937 ATOM 5429 O WAT 8938 39.969 49.181 145.662 1.00 0.00 O ATOM 5430 H1 WAT 8938 40.575 49.332 144.937 1.00 0.00 H ATOM 5431 H2 WAT 8938 39.473 49.997 145.734 1.00 0.00 H TER 5433 WAT 8938 ATOM 5433 O WAT 8939 67.538 135.889 91.965 1.00 0.00 O ATOM 5434 H1 WAT 8939 67.297 136.776 91.699 1.00 0.00 H ATOM 5435 H2 WAT 8939 68.163 136.014 92.680 1.00 0.00 H TER 5437 WAT 8939 ATOM 5437 O WAT 8940 79.510 33.761 16.185 1.00 0.00 O ATOM 5438 H1 WAT 8940 78.887 33.876 15.468 1.00 0.00 H ATOM 5439 H2 WAT 8940 80.368 33.878 15.778 1.00 0.00 H TER 5441 WAT 8940 ATOM 5441 O WAT 8941 90.715 101.168 74.238 1.00 0.00 O ATOM 5442 H1 WAT 8941 91.186 100.805 73.488 1.00 0.00 H ATOM 5443 H2 WAT 8941 89.867 100.723 74.226 1.00 0.00 H TER 5445 WAT 8941 ATOM 5445 O WAT 8942 61.330 16.980 76.165 1.00 0.00 O ATOM 5446 H1 WAT 8942 60.829 17.745 75.882 1.00 0.00 H ATOM 5447 H2 WAT 8942 60.743 16.240 76.011 1.00 0.00 H TER 5449 WAT 8942 ATOM 5449 O WAT 8943 126.952 30.410 16.089 1.00 0.00 O ATOM 5450 H1 WAT 8943 126.644 30.403 16.996 1.00 0.00 H ATOM 5451 H2 WAT 8943 127.201 31.321 15.929 1.00 0.00 H TER 5453 WAT 8943 ATOM 5453 O WAT 8944 15.558 38.476 144.801 1.00 0.00 O ATOM 5454 H1 WAT 8944 15.160 39.318 145.023 1.00 0.00 H ATOM 5455 H2 WAT 8944 14.816 37.908 144.593 1.00 0.00 H TER 5457 WAT 8944 ATOM 5457 O WAT 8945 29.041 65.206 71.397 1.00 0.00 O ATOM 5458 H1 WAT 8945 28.954 65.485 70.485 1.00 0.00 H ATOM 5459 H2 WAT 8945 28.528 64.400 71.451 1.00 0.00 H TER 5461 WAT 8945 ATOM 5461 O WAT 8946 42.284 40.352 157.419 1.00 0.00 O ATOM 5462 H1 WAT 8946 42.698 41.148 157.752 1.00 0.00 H ATOM 5463 H2 WAT 8946 42.830 40.090 156.677 1.00 0.00 H TER 5465 WAT 8946 ATOM 5465 O WAT 8947 70.392 84.951 77.836 1.00 0.00 O ATOM 5466 H1 WAT 8947 70.196 84.192 77.287 1.00 0.00 H ATOM 5467 H2 WAT 8947 71.308 85.153 77.646 1.00 0.00 H TER 5469 WAT 8947 ATOM 5469 O WAT 8948 9.190 105.882 61.874 1.00 0.00 O ATOM 5470 H1 WAT 8948 9.013 105.053 61.428 1.00 0.00 H ATOM 5471 H2 WAT 8948 8.459 106.448 61.625 1.00 0.00 H TER 5473 WAT 8948 ATOM 5473 O WAT 8949 4.817 26.258 15.143 1.00 0.00 O ATOM 5474 H1 WAT 8949 4.807 25.528 14.524 1.00 0.00 H ATOM 5475 H2 WAT 8949 4.245 26.915 14.747 1.00 0.00 H TER 5477 WAT 8949 ATOM 5477 O WAT 8950 48.839 110.775 147.178 1.00 0.00 O ATOM 5478 H1 WAT 8950 48.230 110.469 147.850 1.00 0.00 H ATOM 5479 H2 WAT 8950 48.275 111.101 146.476 1.00 0.00 H TER 5481 WAT 8950 ATOM 5481 O WAT 8951 37.744 126.081 11.056 1.00 0.00 O ATOM 5482 H1 WAT 8951 37.987 126.903 11.484 1.00 0.00 H ATOM 5483 H2 WAT 8951 36.794 126.134 10.958 1.00 0.00 H TER 5485 WAT 8951 ATOM 5485 O WAT 8952 57.431 28.886 84.672 1.00 0.00 O ATOM 5486 H1 WAT 8952 57.709 27.976 84.781 1.00 0.00 H ATOM 5487 H2 WAT 8952 57.523 29.053 83.734 1.00 0.00 H TER 5489 WAT 8952 ATOM 5489 O WAT 8953 15.643 16.539 107.511 1.00 0.00 O ATOM 5490 H1 WAT 8953 16.052 17.245 107.011 1.00 0.00 H ATOM 5491 H2 WAT 8953 15.932 16.684 108.412 1.00 0.00 H TER 5493 WAT 8953 ATOM 5493 O WAT 8954 81.446 137.319 128.235 1.00 0.00 O ATOM 5494 H1 WAT 8954 81.150 136.652 128.855 1.00 0.00 H ATOM 5495 H2 WAT 8954 80.661 137.549 127.738 1.00 0.00 H TER 5497 WAT 8954 ATOM 5497 O WAT 8955 132.809 42.868 108.785 1.00 0.00 O ATOM 5498 H1 WAT 8955 131.970 43.300 108.943 1.00 0.00 H ATOM 5499 H2 WAT 8955 132.664 42.348 107.994 1.00 0.00 H TER 5501 WAT 8955 ATOM 5501 O WAT 8956 15.419 91.539 148.114 1.00 0.00 O ATOM 5502 H1 WAT 8956 15.906 92.363 148.088 1.00 0.00 H ATOM 5503 H2 WAT 8956 15.936 90.938 147.579 1.00 0.00 H TER 5505 WAT 8956 ATOM 5505 O WAT 8957 52.556 132.017 153.063 1.00 0.00 O ATOM 5506 H1 WAT 8957 51.763 132.047 153.598 1.00 0.00 H ATOM 5507 H2 WAT 8957 52.257 132.233 152.180 1.00 0.00 H TER 5509 WAT 8957 ATOM 5509 O WAT 8958 86.964 68.290 10.456 1.00 0.00 O ATOM 5510 H1 WAT 8958 87.501 67.558 10.153 1.00 0.00 H ATOM 5511 H2 WAT 8958 86.065 68.022 10.266 1.00 0.00 H TER 5513 WAT 8958 ATOM 5513 O WAT 8959 32.547 18.094 112.236 1.00 0.00 O ATOM 5514 H1 WAT 8959 33.198 18.795 112.252 1.00 0.00 H ATOM 5515 H2 WAT 8959 32.109 18.193 111.391 1.00 0.00 H TER 5517 WAT 8959 ATOM 5517 O WAT 8960 123.696 121.599 95.010 1.00 0.00 O ATOM 5518 H1 WAT 8960 122.800 121.805 95.275 1.00 0.00 H ATOM 5519 H2 WAT 8960 123.602 121.171 94.159 1.00 0.00 H TER 5521 WAT 8960 ATOM 5521 O WAT 8961 124.372 77.647 132.532 1.00 0.00 O ATOM 5522 H1 WAT 8961 124.555 78.105 133.352 1.00 0.00 H ATOM 5523 H2 WAT 8961 124.369 78.337 131.868 1.00 0.00 H TER 5525 WAT 8961 ATOM 5525 O WAT 8962 91.058 15.990 130.533 1.00 0.00 O ATOM 5526 H1 WAT 8962 90.329 16.609 130.494 1.00 0.00 H ATOM 5527 H2 WAT 8962 90.818 15.381 131.231 1.00 0.00 H TER 5529 WAT 8962 ATOM 5529 O WAT 8963 119.773 75.209 138.772 1.00 0.00 O ATOM 5530 H1 WAT 8963 120.444 75.411 139.424 1.00 0.00 H ATOM 5531 H2 WAT 8963 119.164 74.628 139.227 1.00 0.00 H TER 5533 WAT 8963 ATOM 5533 O WAT 8964 10.538 26.131 112.318 1.00 0.00 O ATOM 5534 H1 WAT 8964 9.827 26.727 112.088 1.00 0.00 H ATOM 5535 H2 WAT 8964 10.102 25.389 112.737 1.00 0.00 H TER 5537 WAT 8964 ATOM 5537 O WAT 8965 40.511 125.892 147.613 1.00 0.00 O ATOM 5538 H1 WAT 8965 40.735 125.281 148.315 1.00 0.00 H ATOM 5539 H2 WAT 8965 39.576 125.752 147.464 1.00 0.00 H TER 5541 WAT 8965 ATOM 5541 O WAT 8966 8.469 2.530 93.907 1.00 0.00 O ATOM 5542 H1 WAT 8966 8.775 2.429 94.808 1.00 0.00 H ATOM 5543 H2 WAT 8966 7.617 2.959 93.990 1.00 0.00 H TER 5545 WAT 8966 ATOM 5545 O WAT 8967 70.226 108.576 99.062 1.00 0.00 O ATOM 5546 H1 WAT 8967 69.662 107.918 99.467 1.00 0.00 H ATOM 5547 H2 WAT 8967 70.838 108.071 98.527 1.00 0.00 H TER 5549 WAT 8967 ATOM 5549 O WAT 8968 11.258 56.741 151.220 1.00 0.00 O ATOM 5550 H1 WAT 8968 11.687 57.412 150.689 1.00 0.00 H ATOM 5551 H2 WAT 8968 11.888 56.021 151.250 1.00 0.00 H TER 5553 WAT 8968 ATOM 5553 O WAT 8969 98.135 78.215 68.261 1.00 0.00 O ATOM 5554 H1 WAT 8969 97.719 78.167 69.121 1.00 0.00 H ATOM 5555 H2 WAT 8969 98.255 79.152 68.104 1.00 0.00 H TER 5557 WAT 8969 ATOM 5557 O WAT 8970 6.040 144.916 95.353 1.00 0.00 O ATOM 5558 H1 WAT 8970 6.120 144.106 95.857 1.00 0.00 H ATOM 5559 H2 WAT 8970 6.757 145.466 95.668 1.00 0.00 H TER 5561 WAT 8970 ATOM 5561 O WAT 8971 73.063 63.645 145.351 1.00 0.00 O ATOM 5562 H1 WAT 8971 73.737 63.314 144.759 1.00 0.00 H ATOM 5563 H2 WAT 8971 73.547 64.140 146.013 1.00 0.00 H TER 5565 WAT 8971 ATOM 5565 O WAT 8972 84.565 35.313 140.687 1.00 0.00 O ATOM 5566 H1 WAT 8972 83.738 35.227 140.213 1.00 0.00 H ATOM 5567 H2 WAT 8972 85.164 35.712 140.055 1.00 0.00 H TER 5569 WAT 8972 ATOM 5569 O WAT 8973 117.957 36.629 156.673 1.00 0.00 O ATOM 5570 H1 WAT 8973 117.002 36.656 156.607 1.00 0.00 H ATOM 5571 H2 WAT 8973 118.264 37.061 155.876 1.00 0.00 H TER 5573 WAT 8973 ATOM 5573 O WAT 8974 139.395 79.547 100.283 1.00 0.00 O ATOM 5574 H1 WAT 8974 139.858 79.170 101.031 1.00 0.00 H ATOM 5575 H2 WAT 8974 138.943 78.806 99.882 1.00 0.00 H TER 5577 WAT 8974 ATOM 5577 O WAT 8975 86.154 26.605 103.895 1.00 0.00 O ATOM 5578 H1 WAT 8975 87.099 26.621 104.045 1.00 0.00 H ATOM 5579 H2 WAT 8975 85.771 26.658 104.771 1.00 0.00 H TER 5581 WAT 8975 ATOM 5581 O WAT 8976 133.618 67.650 9.759 1.00 0.00 O ATOM 5582 H1 WAT 8976 132.932 67.259 9.218 1.00 0.00 H ATOM 5583 H2 WAT 8976 134.433 67.439 9.303 1.00 0.00 H TER 5585 WAT 8976 ATOM 5585 O WAT 8977 36.936 102.314 4.245 1.00 0.00 O ATOM 5586 H1 WAT 8977 37.405 102.807 3.572 1.00 0.00 H ATOM 5587 H2 WAT 8977 36.034 102.273 3.927 1.00 0.00 H TER 5589 WAT 8977 ATOM 5589 O WAT 8978 92.726 86.087 58.785 1.00 0.00 O ATOM 5590 H1 WAT 8978 92.350 86.967 58.794 1.00 0.00 H ATOM 5591 H2 WAT 8978 92.196 85.606 58.150 1.00 0.00 H TER 5593 WAT 8978 ATOM 5593 O WAT 8979 65.255 122.888 122.642 1.00 0.00 O ATOM 5594 H1 WAT 8979 65.902 122.263 122.315 1.00 0.00 H ATOM 5595 H2 WAT 8979 64.458 122.371 122.757 1.00 0.00 H TER 5597 WAT 8979 ATOM 5597 O WAT 8980 14.577 112.496 86.596 1.00 0.00 O ATOM 5598 H1 WAT 8980 14.968 113.246 86.148 1.00 0.00 H ATOM 5599 H2 WAT 8980 14.970 112.508 87.469 1.00 0.00 H TER 5601 WAT 8980 ATOM 5601 O WAT 8981 49.240 135.285 135.903 1.00 0.00 O ATOM 5602 H1 WAT 8981 50.085 134.880 135.707 1.00 0.00 H ATOM 5603 H2 WAT 8981 48.702 135.100 135.133 1.00 0.00 H TER 5605 WAT 8981 ATOM 5605 O WAT 8982 124.544 5.593 120.027 1.00 0.00 O ATOM 5606 H1 WAT 8982 123.789 5.472 120.604 1.00 0.00 H ATOM 5607 H2 WAT 8982 125.282 5.235 120.520 1.00 0.00 H TER 5609 WAT 8982 ATOM 5609 O WAT 8983 46.387 44.301 94.154 1.00 0.00 O ATOM 5610 H1 WAT 8983 45.590 44.244 94.680 1.00 0.00 H ATOM 5611 H2 WAT 8983 46.097 44.668 93.319 1.00 0.00 H TER 5613 WAT 8983 ATOM 5613 O WAT 8984 60.320 38.159 149.658 1.00 0.00 O ATOM 5614 H1 WAT 8984 59.720 38.845 149.364 1.00 0.00 H ATOM 5615 H2 WAT 8984 60.085 38.013 150.574 1.00 0.00 H TER 5617 WAT 8984 ATOM 5617 O WAT 8985 122.489 49.693 108.740 1.00 0.00 O ATOM 5618 H1 WAT 8985 122.399 48.804 109.081 1.00 0.00 H ATOM 5619 H2 WAT 8985 123.317 50.007 109.104 1.00 0.00 H TER 5621 WAT 8985 ATOM 5621 O WAT 8986 104.448 22.702 97.154 1.00 0.00 O ATOM 5622 H1 WAT 8986 105.221 23.083 97.570 1.00 0.00 H ATOM 5623 H2 WAT 8986 104.151 22.031 97.769 1.00 0.00 H TER 5625 WAT 8986 ATOM 5625 O WAT 8987 63.751 89.580 131.008 1.00 0.00 O ATOM 5626 H1 WAT 8987 64.347 89.110 130.424 1.00 0.00 H ATOM 5627 H2 WAT 8987 64.267 90.318 131.334 1.00 0.00 H TER 5629 WAT 8987 ATOM 5629 O WAT 8988 97.374 59.846 90.798 1.00 0.00 O ATOM 5630 H1 WAT 8988 97.456 60.726 91.166 1.00 0.00 H ATOM 5631 H2 WAT 8988 98.246 59.463 90.896 1.00 0.00 H TER 5633 WAT 8988 ATOM 5633 O WAT 8989 67.899 142.395 7.609 1.00 0.00 O ATOM 5634 H1 WAT 8989 68.732 142.841 7.760 1.00 0.00 H ATOM 5635 H2 WAT 8989 68.095 141.746 6.933 1.00 0.00 H TER 5637 WAT 8989 ATOM 5637 O WAT 8990 55.091 129.070 7.915 1.00 0.00 O ATOM 5638 H1 WAT 8990 56.037 129.040 7.769 1.00 0.00 H ATOM 5639 H2 WAT 8990 54.780 128.206 7.646 1.00 0.00 H TER 5641 WAT 8990 ATOM 5641 O WAT 8991 11.639 103.576 16.010 1.00 0.00 O ATOM 5642 H1 WAT 8991 11.875 103.928 16.868 1.00 0.00 H ATOM 5643 H2 WAT 8991 12.443 103.166 15.690 1.00 0.00 H TER 5645 WAT 8991 ATOM 5645 O WAT 8992 37.377 111.118 94.386 1.00 0.00 O ATOM 5646 H1 WAT 8992 37.846 111.837 93.961 1.00 0.00 H ATOM 5647 H2 WAT 8992 36.609 111.533 94.779 1.00 0.00 H TER 5649 WAT 8992 ATOM 5649 O WAT 8993 25.863 64.643 1.429 1.00 0.00 O ATOM 5650 H1 WAT 8993 25.477 63.777 1.300 1.00 0.00 H ATOM 5651 H2 WAT 8993 25.868 65.036 0.556 1.00 0.00 H TER 5653 WAT 8993 ATOM 5653 O WAT 8994 89.346 123.220 132.513 1.00 0.00 O ATOM 5654 H1 WAT 8994 89.623 124.134 132.571 1.00 0.00 H ATOM 5655 H2 WAT 8994 89.480 122.988 131.594 1.00 0.00 H TER 5657 WAT 8994 ATOM 5657 O WAT 8995 15.455 36.486 10.452 1.00 0.00 O ATOM 5658 H1 WAT 8995 14.987 37.243 10.100 1.00 0.00 H ATOM 5659 H2 WAT 8995 15.599 35.919 9.694 1.00 0.00 H TER 5661 WAT 8995 ATOM 5661 O WAT 8996 52.826 74.374 62.199 1.00 0.00 O ATOM 5662 H1 WAT 8996 52.373 74.257 61.364 1.00 0.00 H ATOM 5663 H2 WAT 8996 53.078 73.488 62.461 1.00 0.00 H TER 5665 WAT 8996 ATOM 5665 O WAT 8997 124.345 78.960 148.527 1.00 0.00 O ATOM 5666 H1 WAT 8997 123.753 79.175 149.248 1.00 0.00 H ATOM 5667 H2 WAT 8997 124.824 78.190 148.833 1.00 0.00 H TER 5669 WAT 8997 ATOM 5669 O WAT 8998 76.902 67.951 95.115 1.00 0.00 O ATOM 5670 H1 WAT 8998 77.819 67.824 94.874 1.00 0.00 H ATOM 5671 H2 WAT 8998 76.409 67.594 94.376 1.00 0.00 H TER 5673 WAT 8998 ATOM 5673 O WAT 8999 45.202 58.933 153.350 1.00 0.00 O ATOM 5674 H1 WAT 8999 45.565 59.082 152.477 1.00 0.00 H ATOM 5675 H2 WAT 8999 44.589 58.208 153.234 1.00 0.00 H TER 5677 WAT 8999 ATOM 5677 O WAT 9000 114.943 131.167 62.084 1.00 0.00 O ATOM 5678 H1 WAT 9000 115.199 131.525 61.233 1.00 0.00 H ATOM 5679 H2 WAT 9000 114.705 131.934 62.604 1.00 0.00 H TER 5681 WAT 9000 ATOM 5681 O WAT 9001 77.865 136.287 117.460 1.00 0.00 O ATOM 5682 H1 WAT 9001 76.963 136.357 117.147 1.00 0.00 H ATOM 5683 H2 WAT 9001 78.266 135.632 116.888 1.00 0.00 H TER 5685 WAT 9001 ATOM 5685 O WAT 9002 69.571 35.849 121.631 1.00 0.00 O ATOM 5686 H1 WAT 9002 70.368 35.396 121.354 1.00 0.00 H ATOM 5687 H2 WAT 9002 69.878 36.697 121.952 1.00 0.00 H TER 5689 WAT 9002 ATOM 5689 O WAT 9003 36.138 105.616 71.896 1.00 0.00 O ATOM 5690 H1 WAT 9003 36.671 106.055 72.560 1.00 0.00 H ATOM 5691 H2 WAT 9003 36.338 106.081 71.084 1.00 0.00 H TER 5693 WAT 9003 ATOM 5693 O WAT 9004 81.513 96.100 109.231 1.00 0.00 O ATOM 5694 H1 WAT 9004 80.887 96.661 108.773 1.00 0.00 H ATOM 5695 H2 WAT 9004 81.908 96.671 109.890 1.00 0.00 H TER 5697 WAT 9004 ATOM 5697 O WAT 9005 54.156 49.934 99.066 1.00 0.00 O ATOM 5698 H1 WAT 9005 53.334 49.854 99.549 1.00 0.00 H ATOM 5699 H2 WAT 9005 54.788 50.236 99.718 1.00 0.00 H TER 5701 WAT 9005 ATOM 5701 O WAT 9006 109.683 139.788 70.195 1.00 0.00 O ATOM 5702 H1 WAT 9006 110.083 139.740 69.327 1.00 0.00 H ATOM 5703 H2 WAT 9006 110.206 139.193 70.733 1.00 0.00 H TER 5705 WAT 9006 ATOM 5705 O WAT 9007 14.481 5.526 8.845 1.00 0.00 O ATOM 5706 H1 WAT 9007 14.841 4.673 9.089 1.00 0.00 H ATOM 5707 H2 WAT 9007 14.971 6.153 9.376 1.00 0.00 H TER 5709 WAT 9007 ATOM 5709 O WAT 9008 24.920 30.808 151.833 1.00 0.00 O ATOM 5710 H1 WAT 9008 25.016 31.734 151.610 1.00 0.00 H ATOM 5711 H2 WAT 9008 24.863 30.797 152.789 1.00 0.00 H TER 5713 WAT 9008 ATOM 5713 O WAT 9009 43.982 27.469 139.110 1.00 0.00 O ATOM 5714 H1 WAT 9009 43.724 28.267 138.648 1.00 0.00 H ATOM 5715 H2 WAT 9009 44.793 27.195 138.680 1.00 0.00 H TER 5717 WAT 9009 ATOM 5717 O WAT 9010 142.136 111.019 21.979 1.00 0.00 O ATOM 5718 H1 WAT 9010 143.003 111.164 21.599 1.00 0.00 H ATOM 5719 H2 WAT 9010 142.306 110.524 22.781 1.00 0.00 H TER 5721 WAT 9010 ATOM 5721 O WAT 9011 94.024 128.039 118.543 1.00 0.00 O ATOM 5722 H1 WAT 9011 94.466 127.439 117.942 1.00 0.00 H ATOM 5723 H2 WAT 9011 93.369 128.480 118.002 1.00 0.00 H TER 5725 WAT 9011 ATOM 5725 O WAT 9012 9.252 144.028 111.742 1.00 0.00 O ATOM 5726 H1 WAT 9012 8.683 144.547 112.311 1.00 0.00 H ATOM 5727 H2 WAT 9012 8.684 143.755 111.021 1.00 0.00 H TER 5729 WAT 9012 ATOM 5729 O WAT 9013 84.790 136.786 158.725 1.00 0.00 O ATOM 5730 H1 WAT 9013 84.046 136.184 158.738 1.00 0.00 H ATOM 5731 H2 WAT 9013 84.879 137.037 157.805 1.00 0.00 H TER 5733 WAT 9013 ATOM 5733 O WAT 9014 25.055 4.781 140.854 1.00 0.00 O ATOM 5734 H1 WAT 9014 25.812 4.700 140.274 1.00 0.00 H ATOM 5735 H2 WAT 9014 24.558 3.976 140.712 1.00 0.00 H TER 5737 WAT 9014 ATOM 5737 O WAT 9015 15.497 3.638 92.934 1.00 0.00 O ATOM 5738 H1 WAT 9015 16.040 4.425 92.965 1.00 0.00 H ATOM 5739 H2 WAT 9015 14.770 3.870 92.356 1.00 0.00 H TER 5741 WAT 9015 ATOM 5741 O WAT 9016 145.131 3.830 151.038 1.00 0.00 O ATOM 5742 H1 WAT 9016 145.445 2.932 150.934 1.00 0.00 H ATOM 5743 H2 WAT 9016 144.565 3.975 150.280 1.00 0.00 H TER 5745 WAT 9016 ATOM 5745 O WAT 9017 11.164 48.856 93.817 1.00 0.00 O ATOM 5746 H1 WAT 9017 11.974 48.594 93.378 1.00 0.00 H ATOM 5747 H2 WAT 9017 10.476 48.377 93.354 1.00 0.00 H TER 5749 WAT 9017 ATOM 5749 O WAT 9018 42.343 105.050 98.027 1.00 0.00 O ATOM 5750 H1 WAT 9018 41.649 105.698 97.912 1.00 0.00 H ATOM 5751 H2 WAT 9018 43.110 105.563 98.282 1.00 0.00 H TER 5753 WAT 9018 ATOM 5753 O WAT 9019 94.293 107.761 99.077 1.00 0.00 O ATOM 5754 H1 WAT 9019 93.350 107.653 98.952 1.00 0.00 H ATOM 5755 H2 WAT 9019 94.671 107.576 98.217 1.00 0.00 H TER 5757 WAT 9019 ATOM 5757 O WAT 9020 14.574 76.574 109.379 1.00 0.00 O ATOM 5758 H1 WAT 9020 14.795 75.784 109.873 1.00 0.00 H ATOM 5759 H2 WAT 9020 13.949 76.276 108.718 1.00 0.00 H TER 5761 WAT 9020 ATOM 5761 O WAT 9021 54.709 45.018 8.661 1.00 0.00 O ATOM 5762 H1 WAT 9021 55.500 45.433 9.006 1.00 0.00 H ATOM 5763 H2 WAT 9021 54.686 44.159 9.082 1.00 0.00 H TER 5765 WAT 9021 ATOM 5765 O WAT 9022 26.312 84.506 0.863 1.00 0.00 O ATOM 5766 H1 WAT 9022 25.869 85.102 0.258 1.00 0.00 H ATOM 5767 H2 WAT 9022 27.240 84.720 0.772 1.00 0.00 H TER 5769 WAT 9022 ATOM 5769 O WAT 9023 105.475 124.891 102.621 1.00 0.00 O ATOM 5770 H1 WAT 9023 104.895 124.238 103.012 1.00 0.00 H ATOM 5771 H2 WAT 9023 105.618 125.531 103.318 1.00 0.00 H TER 5773 WAT 9023 ATOM 5773 O WAT 9024 7.042 144.673 65.539 1.00 0.00 O ATOM 5774 H1 WAT 9024 7.897 144.649 65.109 1.00 0.00 H ATOM 5775 H2 WAT 9024 7.199 144.300 66.406 1.00 0.00 H TER 5777 WAT 9024 ATOM 5777 O WAT 9025 22.066 0.988 135.435 1.00 0.00 O ATOM 5778 H1 WAT 9025 22.487 0.160 135.206 1.00 0.00 H ATOM 5779 H2 WAT 9025 22.679 1.409 136.039 1.00 0.00 H TER 5781 WAT 9025 ATOM 5781 O WAT 9026 92.292 45.006 108.485 1.00 0.00 O ATOM 5782 H1 WAT 9026 92.845 44.951 109.264 1.00 0.00 H ATOM 5783 H2 WAT 9026 91.515 44.493 108.706 1.00 0.00 H TER 5785 WAT 9026 ATOM 5785 O WAT 9027 121.984 137.186 18.148 1.00 0.00 O ATOM 5786 H1 WAT 9027 122.854 137.037 17.778 1.00 0.00 H ATOM 5787 H2 WAT 9027 121.556 136.331 18.104 1.00 0.00 H TER 5789 WAT 9027 ATOM 5789 O WAT 9028 62.460 88.388 9.443 1.00 0.00 O ATOM 5790 H1 WAT 9028 62.413 88.177 10.376 1.00 0.00 H ATOM 5791 H2 WAT 9028 63.385 88.288 9.221 1.00 0.00 H TER 5793 WAT 9028 ATOM 5793 O WAT 9029 62.835 126.025 101.647 1.00 0.00 O ATOM 5794 H1 WAT 9029 63.609 126.562 101.815 1.00 0.00 H ATOM 5795 H2 WAT 9029 63.101 125.139 101.893 1.00 0.00 H TER 5797 WAT 9029 ATOM 5797 O WAT 9030 93.113 140.408 149.626 1.00 0.00 O ATOM 5798 H1 WAT 9030 93.056 141.322 149.348 1.00 0.00 H ATOM 5799 H2 WAT 9030 92.410 139.968 149.147 1.00 0.00 H TER 5801 WAT 9030 ATOM 5801 O WAT 9031 143.895 134.248 155.491 1.00 0.00 O ATOM 5802 H1 WAT 9031 143.430 133.954 154.709 1.00 0.00 H ATOM 5803 H2 WAT 9031 143.503 135.097 155.698 1.00 0.00 H TER 5805 WAT 9031 ATOM 5805 O WAT 9032 82.718 25.565 147.134 1.00 0.00 O ATOM 5806 H1 WAT 9032 82.449 24.720 146.773 1.00 0.00 H ATOM 5807 H2 WAT 9032 83.015 26.066 146.374 1.00 0.00 H TER 5809 WAT 9032 ATOM 5809 O WAT 9033 142.284 68.909 116.943 1.00 0.00 O ATOM 5810 H1 WAT 9033 141.841 68.519 116.190 1.00 0.00 H ATOM 5811 H2 WAT 9033 143.170 68.547 116.915 1.00 0.00 H TER 5813 WAT 9033 ATOM 5813 O WAT 9034 42.026 75.982 107.433 1.00 0.00 O ATOM 5814 H1 WAT 9034 42.390 76.302 108.259 1.00 0.00 H ATOM 5815 H2 WAT 9034 41.123 75.746 107.645 1.00 0.00 H TER 5817 WAT 9034 ATOM 5817 O WAT 9035 39.073 57.100 69.061 1.00 0.00 O ATOM 5818 H1 WAT 9035 38.892 57.649 69.823 1.00 0.00 H ATOM 5819 H2 WAT 9035 39.991 56.847 69.161 1.00 0.00 H TER 5821 WAT 9035 ATOM 5821 O WAT 9036 41.025 10.525 99.493 1.00 0.00 O ATOM 5822 H1 WAT 9036 40.121 10.840 99.527 1.00 0.00 H ATOM 5823 H2 WAT 9036 41.386 10.919 98.700 1.00 0.00 H TER 5825 WAT 9036 ATOM 5825 O WAT 9037 139.124 91.689 16.453 1.00 0.00 O ATOM 5826 H1 WAT 9037 138.876 91.755 15.531 1.00 0.00 H ATOM 5827 H2 WAT 9037 139.892 92.254 16.536 1.00 0.00 H TER 5829 WAT 9037 ATOM 5829 O WAT 9038 25.368 15.091 64.903 1.00 0.00 O ATOM 5830 H1 WAT 9038 26.233 15.400 64.637 1.00 0.00 H ATOM 5831 H2 WAT 9038 24.939 14.842 64.084 1.00 0.00 H TER 5833 WAT 9038 ATOM 5833 O WAT 9039 130.935 143.886 156.356 1.00 0.00 O ATOM 5834 H1 WAT 9039 130.992 144.048 155.414 1.00 0.00 H ATOM 5835 H2 WAT 9039 131.813 143.592 156.601 1.00 0.00 H TER 5837 WAT 9039 ATOM 5837 O WAT 9040 69.047 53.729 70.672 1.00 0.00 O ATOM 5838 H1 WAT 9040 68.548 53.747 69.855 1.00 0.00 H ATOM 5839 H2 WAT 9040 69.283 54.644 70.828 1.00 0.00 H TER 5841 WAT 9040 ATOM 5841 O WAT 9041 113.528 46.746 23.856 1.00 0.00 O ATOM 5842 H1 WAT 9041 113.674 46.084 23.181 1.00 0.00 H ATOM 5843 H2 WAT 9041 112.706 47.168 23.605 1.00 0.00 H TER 5845 WAT 9041 ATOM 5845 O WAT 9042 50.620 73.157 18.418 1.00 0.00 O ATOM 5846 H1 WAT 9042 50.928 72.522 19.065 1.00 0.00 H ATOM 5847 H2 WAT 9042 50.907 74.004 18.759 1.00 0.00 H TER 5849 WAT 9042 ATOM 5849 O WAT 9043 33.165 5.589 88.780 1.00 0.00 O ATOM 5850 H1 WAT 9043 32.275 5.863 89.002 1.00 0.00 H ATOM 5851 H2 WAT 9043 33.266 5.829 87.859 1.00 0.00 H TER 5853 WAT 9043 ATOM 5853 O WAT 9044 140.357 27.827 158.280 1.00 0.00 O ATOM 5854 H1 WAT 9044 140.458 28.305 159.104 1.00 0.00 H ATOM 5855 H2 WAT 9044 139.611 28.246 157.851 1.00 0.00 H TER 5857 WAT 9044 ATOM 5857 O WAT 9045 40.037 11.509 21.121 1.00 0.00 O ATOM 5858 H1 WAT 9045 40.062 12.175 21.809 1.00 0.00 H ATOM 5859 H2 WAT 9045 39.782 10.706 21.574 1.00 0.00 H TER 5861 WAT 9045 ATOM 5861 O WAT 9046 48.745 114.832 62.017 1.00 0.00 O ATOM 5862 H1 WAT 9046 47.957 114.813 61.474 1.00 0.00 H ATOM 5863 H2 WAT 9046 49.451 114.577 61.423 1.00 0.00 H TER 5865 WAT 9046 ATOM 5865 O WAT 9047 139.789 122.606 19.046 1.00 0.00 O ATOM 5866 H1 WAT 9047 139.046 122.408 19.615 1.00 0.00 H ATOM 5867 H2 WAT 9047 140.542 122.641 19.637 1.00 0.00 H TER 5869 WAT 9047 ATOM 5869 O WAT 9048 22.523 57.666 145.206 1.00 0.00 O ATOM 5870 H1 WAT 9048 22.004 57.094 145.773 1.00 0.00 H ATOM 5871 H2 WAT 9048 23.229 57.106 144.883 1.00 0.00 H TER 5873 WAT 9048 ATOM 5873 O WAT 9049 118.999 96.365 17.599 1.00 0.00 O ATOM 5874 H1 WAT 9049 119.654 95.787 17.991 1.00 0.00 H ATOM 5875 H2 WAT 9049 118.381 96.542 18.309 1.00 0.00 H TER 5877 WAT 9049 ATOM 5877 O WAT 9050 41.459 18.142 57.769 1.00 0.00 O ATOM 5878 H1 WAT 9050 42.299 18.179 57.311 1.00 0.00 H ATOM 5879 H2 WAT 9050 41.023 17.371 57.408 1.00 0.00 H TER 5881 WAT 9050 ATOM 5881 O WAT 9051 103.065 83.068 68.696 1.00 0.00 O ATOM 5882 H1 WAT 9051 103.964 83.313 68.477 1.00 0.00 H ATOM 5883 H2 WAT 9051 102.530 83.506 68.035 1.00 0.00 H TER 5885 WAT 9051 ATOM 5885 O WAT 9052 39.590 131.924 105.102 1.00 0.00 O ATOM 5886 H1 WAT 9052 39.037 131.236 105.473 1.00 0.00 H ATOM 5887 H2 WAT 9052 39.669 132.571 105.804 1.00 0.00 H TER 5889 WAT 9052 ATOM 5889 O WAT 9053 55.413 128.859 129.377 1.00 0.00 O ATOM 5890 H1 WAT 9053 56.369 128.835 129.366 1.00 0.00 H ATOM 5891 H2 WAT 9053 55.170 129.175 128.507 1.00 0.00 H TER 5893 WAT 9053 ATOM 5893 O WAT 9054 46.148 26.223 121.033 1.00 0.00 O ATOM 5894 H1 WAT 9054 46.264 26.778 120.262 1.00 0.00 H ATOM 5895 H2 WAT 9054 45.747 26.799 121.684 1.00 0.00 H TER 5897 WAT 9054 ATOM 5897 O WAT 9055 77.510 88.315 110.578 1.00 0.00 O ATOM 5898 H1 WAT 9055 78.251 88.350 109.973 1.00 0.00 H ATOM 5899 H2 WAT 9055 77.872 87.931 111.377 1.00 0.00 H TER 5901 WAT 9055 ATOM 5901 O WAT 9056 86.540 22.714 14.403 1.00 0.00 O ATOM 5902 H1 WAT 9056 87.406 22.976 14.092 1.00 0.00 H ATOM 5903 H2 WAT 9056 86.610 22.742 15.357 1.00 0.00 H TER 5905 WAT 9056 ATOM 5905 O WAT 9057 6.949 19.272 85.799 1.00 0.00 O ATOM 5906 H1 WAT 9057 7.856 19.138 85.523 1.00 0.00 H ATOM 5907 H2 WAT 9057 6.427 19.007 85.042 1.00 0.00 H TER 5909 WAT 9057 ATOM 5909 O WAT 9058 3.423 68.510 14.905 1.00 0.00 O ATOM 5910 H1 WAT 9058 2.702 69.119 14.746 1.00 0.00 H ATOM 5911 H2 WAT 9058 4.042 68.681 14.195 1.00 0.00 H TER 5913 WAT 9058 ATOM 5913 O WAT 9059 65.019 18.172 114.693 1.00 0.00 O ATOM 5914 H1 WAT 9059 64.326 17.601 114.361 1.00 0.00 H ATOM 5915 H2 WAT 9059 65.707 17.572 114.980 1.00 0.00 H TER 5917 WAT 9059 ATOM 5917 O WAT 9060 48.484 129.815 132.665 1.00 0.00 O ATOM 5918 H1 WAT 9060 49.041 130.569 132.470 1.00 0.00 H ATOM 5919 H2 WAT 9060 48.544 129.265 131.884 1.00 0.00 H TER 5921 WAT 9060 ATOM 5921 O WAT 9061 18.817 89.087 73.508 1.00 0.00 O ATOM 5922 H1 WAT 9061 18.280 89.082 72.716 1.00 0.00 H ATOM 5923 H2 WAT 9061 19.719 89.097 73.186 1.00 0.00 H TER 5925 WAT 9061 ATOM 5925 O WAT 9062 143.009 139.623 102.127 1.00 0.00 O ATOM 5926 H1 WAT 9062 142.055 139.694 102.129 1.00 0.00 H ATOM 5927 H2 WAT 9062 143.267 139.841 103.023 1.00 0.00 H TER 5929 WAT 9062 ATOM 5929 O WAT 9063 67.179 44.122 78.118 1.00 0.00 O ATOM 5930 H1 WAT 9063 66.304 44.206 77.740 1.00 0.00 H ATOM 5931 H2 WAT 9063 67.767 44.443 77.434 1.00 0.00 H TER 5933 WAT 9063 ATOM 5933 O WAT 9064 60.509 59.953 18.258 1.00 0.00 O ATOM 5934 H1 WAT 9064 60.341 59.059 17.962 1.00 0.00 H ATOM 5935 H2 WAT 9064 60.394 60.490 17.474 1.00 0.00 H TER 5937 WAT 9064 ATOM 5937 O WAT 9065 41.177 68.411 68.102 1.00 0.00 O ATOM 5938 H1 WAT 9065 41.950 68.101 67.630 1.00 0.00 H ATOM 5939 H2 WAT 9065 41.530 68.946 68.813 1.00 0.00 H TER 5941 WAT 9065 ATOM 5941 O WAT 9066 46.198 70.116 23.454 1.00 0.00 O ATOM 5942 H1 WAT 9066 45.930 70.616 24.226 1.00 0.00 H ATOM 5943 H2 WAT 9066 45.375 69.826 23.060 1.00 0.00 H TER 5945 WAT 9066 ATOM 5945 O WAT 9067 66.379 116.736 6.240 1.00 0.00 O ATOM 5946 H1 WAT 9067 66.176 116.924 7.156 1.00 0.00 H ATOM 5947 H2 WAT 9067 66.988 117.428 5.982 1.00 0.00 H TER 5949 WAT 9067 ATOM 5949 O WAT 9068 47.581 33.554 116.274 1.00 0.00 O ATOM 5950 H1 WAT 9068 47.944 32.899 115.677 1.00 0.00 H ATOM 5951 H2 WAT 9068 48.342 34.053 116.571 1.00 0.00 H TER 5953 WAT 9068 ATOM 5953 O WAT 9069 71.937 85.327 116.669 1.00 0.00 O ATOM 5954 H1 WAT 9069 71.079 85.678 116.433 1.00 0.00 H ATOM 5955 H2 WAT 9069 72.524 85.647 115.984 1.00 0.00 H TER 5957 WAT 9069 ATOM 5957 O WAT 9070 98.596 68.728 72.751 1.00 0.00 O ATOM 5958 H1 WAT 9070 98.397 67.792 72.776 1.00 0.00 H ATOM 5959 H2 WAT 9070 99.434 68.807 73.206 1.00 0.00 H TER 5961 WAT 9070 ATOM 5961 O WAT 9071 117.501 131.137 96.790 1.00 0.00 O ATOM 5962 H1 WAT 9071 118.266 130.782 97.242 1.00 0.00 H ATOM 5963 H2 WAT 9071 116.944 131.474 97.492 1.00 0.00 H TER 5965 WAT 9071 ATOM 5965 O WAT 9072 20.546 122.598 16.374 1.00 0.00 O ATOM 5966 H1 WAT 9072 20.093 121.760 16.274 1.00 0.00 H ATOM 5967 H2 WAT 9072 21.475 122.370 16.357 1.00 0.00 H TER 5969 WAT 9072 ATOM 5969 O WAT 9073 121.119 63.347 116.561 1.00 0.00 O ATOM 5970 H1 WAT 9073 121.071 62.391 116.576 1.00 0.00 H ATOM 5971 H2 WAT 9073 120.504 63.629 117.238 1.00 0.00 H TER 5973 WAT 9073 ATOM 5973 O WAT 9074 6.655 59.929 118.662 1.00 0.00 O ATOM 5974 H1 WAT 9074 5.992 60.571 118.917 1.00 0.00 H ATOM 5975 H2 WAT 9074 6.420 59.138 119.147 1.00 0.00 H TER 5977 WAT 9074 ATOM 5977 O WAT 9075 55.675 55.142 153.575 1.00 0.00 O ATOM 5978 H1 WAT 9075 55.983 55.517 152.750 1.00 0.00 H ATOM 5979 H2 WAT 9075 54.967 54.550 153.320 1.00 0.00 H TER 5981 WAT 9075 ATOM 5981 O WAT 9076 85.694 36.446 97.610 1.00 0.00 O ATOM 5982 H1 WAT 9076 84.738 36.452 97.566 1.00 0.00 H ATOM 5983 H2 WAT 9076 85.974 36.887 96.808 1.00 0.00 H TER 5985 WAT 9076 ATOM 5985 O WAT 9077 34.105 40.416 141.914 1.00 0.00 O ATOM 5986 H1 WAT 9077 33.819 39.919 141.148 1.00 0.00 H ATOM 5987 H2 WAT 9077 35.058 40.455 141.833 1.00 0.00 H TER 5989 WAT 9077 ATOM 5989 O WAT 9078 137.731 145.283 105.628 1.00 0.00 O ATOM 5990 H1 WAT 9078 137.323 144.540 106.073 1.00 0.00 H ATOM 5991 H2 WAT 9078 137.320 146.053 106.021 1.00 0.00 H TER 5993 WAT 9078 ATOM 5993 O WAT 9079 116.942 40.571 79.794 1.00 0.00 O ATOM 5994 H1 WAT 9079 117.200 41.455 79.533 1.00 0.00 H ATOM 5995 H2 WAT 9079 116.012 40.646 80.008 1.00 0.00 H TER 5997 WAT 9079 ATOM 5997 O WAT 9080 131.250 97.390 102.696 1.00 0.00 O ATOM 5998 H1 WAT 9080 130.701 96.606 102.719 1.00 0.00 H ATOM 5999 H2 WAT 9080 132.100 97.096 103.024 1.00 0.00 H TER 6001 WAT 9080 ATOM 6001 O WAT 9081 54.408 113.137 121.133 1.00 0.00 O ATOM 6002 H1 WAT 9081 55.145 113.747 121.128 1.00 0.00 H ATOM 6003 H2 WAT 9081 54.721 112.378 120.640 1.00 0.00 H TER 6005 WAT 9081 ATOM 6005 O WAT 9082 26.630 103.567 69.979 1.00 0.00 O ATOM 6006 H1 WAT 9082 25.723 103.851 70.098 1.00 0.00 H ATOM 6007 H2 WAT 9082 26.787 103.655 69.039 1.00 0.00 H TER 6009 WAT 9082 ATOM 6009 O WAT 9083 69.655 15.264 52.716 1.00 0.00 O ATOM 6010 H1 WAT 9083 68.977 15.940 52.730 1.00 0.00 H ATOM 6011 H2 WAT 9083 69.396 14.652 53.405 1.00 0.00 H TER 6013 WAT 9083 ATOM 6013 O WAT 9084 48.329 33.656 89.088 1.00 0.00 O ATOM 6014 H1 WAT 9084 48.449 33.886 88.167 1.00 0.00 H ATOM 6015 H2 WAT 9084 48.193 32.708 89.083 1.00 0.00 H TER 6017 WAT 9084 ATOM 6017 O WAT 9085 52.351 139.525 99.542 1.00 0.00 O ATOM 6018 H1 WAT 9085 52.262 140.352 99.068 1.00 0.00 H ATOM 6019 H2 WAT 9085 52.066 139.728 100.433 1.00 0.00 H TER 6021 WAT 9085 ATOM 6021 O WAT 9086 39.954 120.971 98.573 1.00 0.00 O ATOM 6022 H1 WAT 9086 40.808 121.383 98.705 1.00 0.00 H ATOM 6023 H2 WAT 9086 39.353 121.704 98.443 1.00 0.00 H TER 6025 WAT 9086 ATOM 6025 O WAT 9087 57.771 113.683 19.876 1.00 0.00 O ATOM 6026 H1 WAT 9087 57.602 113.682 20.818 1.00 0.00 H ATOM 6027 H2 WAT 9087 57.974 112.771 19.668 1.00 0.00 H TER 6029 WAT 9087 ATOM 6029 O WAT 9088 80.431 20.088 71.782 1.00 0.00 O ATOM 6030 H1 WAT 9088 80.718 19.837 72.660 1.00 0.00 H ATOM 6031 H2 WAT 9088 80.138 19.268 71.382 1.00 0.00 H TER 6033 WAT 9088 ATOM 6033 O WAT 9089 143.297 3.298 135.645 1.00 0.00 O ATOM 6034 H1 WAT 9089 143.562 3.087 134.749 1.00 0.00 H ATOM 6035 H2 WAT 9089 143.037 4.218 135.608 1.00 0.00 H TER 6037 WAT 9089 ATOM 6037 O WAT 9090 67.671 52.021 82.450 1.00 0.00 O ATOM 6038 H1 WAT 9090 68.370 51.452 82.130 1.00 0.00 H ATOM 6039 H2 WAT 9090 68.024 52.906 82.364 1.00 0.00 H TER 6041 WAT 9090 ATOM 6041 O WAT 9091 11.683 74.889 69.628 1.00 0.00 O ATOM 6042 H1 WAT 9091 11.827 74.317 70.382 1.00 0.00 H ATOM 6043 H2 WAT 9091 12.492 75.395 69.553 1.00 0.00 H TER 6045 WAT 9091 ATOM 6045 O WAT 9092 130.065 30.747 21.100 1.00 0.00 O ATOM 6046 H1 WAT 9092 129.705 29.894 21.343 1.00 0.00 H ATOM 6047 H2 WAT 9092 129.344 31.194 20.657 1.00 0.00 H TER 6049 WAT 9092 ATOM 6049 O WAT 9093 13.128 128.344 16.946 1.00 0.00 O ATOM 6050 H1 WAT 9093 12.262 128.752 16.938 1.00 0.00 H ATOM 6051 H2 WAT 9093 13.419 128.383 16.035 1.00 0.00 H TER 6053 WAT 9093 ATOM 6053 O WAT 9094 97.550 9.451 94.572 1.00 0.00 O ATOM 6054 H1 WAT 9094 97.491 10.227 95.129 1.00 0.00 H ATOM 6055 H2 WAT 9094 97.035 8.787 95.031 1.00 0.00 H TER 6057 WAT 9094 ATOM 6057 O WAT 9095 85.381 72.434 10.846 1.00 0.00 O ATOM 6058 H1 WAT 9095 85.230 72.562 11.783 1.00 0.00 H ATOM 6059 H2 WAT 9095 85.322 73.312 10.471 1.00 0.00 H TER 6061 WAT 9095 ATOM 6061 O WAT 9096 1.318 67.748 12.242 1.00 0.00 O ATOM 6062 H1 WAT 9096 0.466 68.070 11.950 1.00 0.00 H ATOM 6063 H2 WAT 9096 1.740 67.429 11.444 1.00 0.00 H TER 6065 WAT 9096 ATOM 6065 O WAT 9097 121.340 111.282 64.060 1.00 0.00 O ATOM 6066 H1 WAT 9097 120.656 111.771 63.602 1.00 0.00 H ATOM 6067 H2 WAT 9097 121.571 111.836 64.806 1.00 0.00 H TER 6069 WAT 9097 ATOM 6069 O WAT 9098 1.309 -0.022 84.454 1.00 0.00 O ATOM 6070 H1 WAT 9098 1.302 0.142 85.397 1.00 0.00 H ATOM 6071 H2 WAT 9098 1.432 0.843 84.062 1.00 0.00 H TER 6073 WAT 9098 ATOM 6073 O WAT 9099 53.822 49.525 157.097 1.00 0.00 O ATOM 6074 H1 WAT 9099 53.473 49.345 157.970 1.00 0.00 H ATOM 6075 H2 WAT 9099 54.257 50.373 157.183 1.00 0.00 H TER 6077 WAT 9099 ATOM 6077 O WAT 9100 134.494 69.956 140.016 1.00 0.00 O ATOM 6078 H1 WAT 9100 134.544 70.889 139.807 1.00 0.00 H ATOM 6079 H2 WAT 9100 133.720 69.646 139.546 1.00 0.00 H TER 6081 WAT 9100 ATOM 6081 O WAT 9101 75.320 16.861 154.881 1.00 0.00 O ATOM 6082 H1 WAT 9101 76.176 16.676 154.495 1.00 0.00 H ATOM 6083 H2 WAT 9101 74.814 16.061 154.734 1.00 0.00 H TER 6085 WAT 9101 ATOM 6085 O WAT 9102 140.477 113.078 122.295 1.00 0.00 O ATOM 6086 H1 WAT 9102 140.678 114.011 122.218 1.00 0.00 H ATOM 6087 H2 WAT 9102 140.718 112.855 123.194 1.00 0.00 H TER 6089 WAT 9102 ATOM 6089 O WAT 9103 35.732 27.530 120.775 1.00 0.00 O ATOM 6090 H1 WAT 9103 35.375 26.809 121.295 1.00 0.00 H ATOM 6091 H2 WAT 9103 34.965 28.042 120.519 1.00 0.00 H TER 6093 WAT 9103 ATOM 6093 O WAT 9104 22.164 47.314 81.087 1.00 0.00 O ATOM 6094 H1 WAT 9104 22.639 47.542 81.886 1.00 0.00 H ATOM 6095 H2 WAT 9104 22.418 47.988 80.457 1.00 0.00 H TER 6097 WAT 9104 ATOM 6097 O WAT 9105 1.709 74.627 154.049 1.00 0.00 O ATOM 6098 H1 WAT 9105 0.867 75.045 153.866 1.00 0.00 H ATOM 6099 H2 WAT 9105 1.513 73.984 154.731 1.00 0.00 H TER 6101 WAT 9105 ATOM 6101 O WAT 9106 106.032 102.946 83.243 1.00 0.00 O ATOM 6102 H1 WAT 9106 105.709 102.271 82.646 1.00 0.00 H ATOM 6103 H2 WAT 9106 105.385 102.973 83.947 1.00 0.00 H TER 6105 WAT 9106 ATOM 6105 O WAT 9107 133.360 121.059 155.149 1.00 0.00 O ATOM 6106 H1 WAT 9107 134.090 121.051 155.768 1.00 0.00 H ATOM 6107 H2 WAT 9107 133.068 120.149 155.111 1.00 0.00 H TER 6109 WAT 9107 ATOM 6109 O WAT 9108 15.778 44.627 128.038 1.00 0.00 O ATOM 6110 H1 WAT 9108 15.423 45.050 128.819 1.00 0.00 H ATOM 6111 H2 WAT 9108 15.509 43.712 128.117 1.00 0.00 H TER 6113 WAT 9108 ATOM 6113 O WAT 9109 43.239 82.136 76.296 1.00 0.00 O ATOM 6114 H1 WAT 9109 42.556 81.471 76.210 1.00 0.00 H ATOM 6115 H2 WAT 9109 42.799 82.960 76.087 1.00 0.00 H TER 6117 WAT 9109 ATOM 6117 O WAT 9110 114.391 141.776 92.833 1.00 0.00 O ATOM 6118 H1 WAT 9110 114.237 142.546 92.286 1.00 0.00 H ATOM 6119 H2 WAT 9110 115.275 141.490 92.602 1.00 0.00 H TER 6121 WAT 9110 ATOM 6121 O WAT 9111 145.007 66.886 1.877 1.00 0.00 O ATOM 6122 H1 WAT 9111 144.121 66.934 1.517 1.00 0.00 H ATOM 6123 H2 WAT 9111 145.560 66.674 1.124 1.00 0.00 H TER 6125 WAT 9111 ATOM 6125 O WAT 9112 130.754 133.610 69.648 1.00 0.00 O ATOM 6126 H1 WAT 9112 131.509 133.382 70.190 1.00 0.00 H ATOM 6127 H2 WAT 9112 130.671 134.559 69.739 1.00 0.00 H TER 6129 WAT 9112 ATOM 6129 O WAT 9113 140.795 8.814 69.037 1.00 0.00 O ATOM 6130 H1 WAT 9113 141.224 8.901 69.888 1.00 0.00 H ATOM 6131 H2 WAT 9113 141.255 8.091 68.610 1.00 0.00 H TER 6133 WAT 9113 ATOM 6133 O WAT 9114 38.770 43.196 6.237 1.00 0.00 O ATOM 6134 H1 WAT 9114 38.489 43.432 5.353 1.00 0.00 H ATOM 6135 H2 WAT 9114 39.383 43.888 6.486 1.00 0.00 H TER 6137 WAT 9114 ATOM 6137 O WAT 9115 39.987 49.806 74.521 1.00 0.00 O ATOM 6138 H1 WAT 9115 39.939 50.630 75.007 1.00 0.00 H ATOM 6139 H2 WAT 9115 40.851 49.453 74.734 1.00 0.00 H TER 6141 WAT 9115 ATOM 6141 O WAT 9116 59.362 44.787 2.959 1.00 0.00 O ATOM 6142 H1 WAT 9116 59.504 45.626 3.398 1.00 0.00 H ATOM 6143 H2 WAT 9116 59.808 44.879 2.117 1.00 0.00 H TER 6145 WAT 9116 ATOM 6145 O WAT 9117 8.357 116.414 147.805 1.00 0.00 O ATOM 6146 H1 WAT 9117 7.524 115.946 147.861 1.00 0.00 H ATOM 6147 H2 WAT 9117 8.799 116.217 148.631 1.00 0.00 H TER 6149 WAT 9117 ATOM 6149 O WAT 9118 20.114 136.960 21.155 1.00 0.00 O ATOM 6150 H1 WAT 9118 19.507 137.637 20.855 1.00 0.00 H ATOM 6151 H2 WAT 9118 19.712 136.614 21.952 1.00 0.00 H TER 6153 WAT 9118 ATOM 6153 O WAT 9119 139.474 20.177 75.536 1.00 0.00 O ATOM 6154 H1 WAT 9119 139.058 19.933 74.709 1.00 0.00 H ATOM 6155 H2 WAT 9119 139.016 19.657 76.197 1.00 0.00 H TER 6157 WAT 9119 ATOM 6157 O WAT 9120 9.360 24.249 147.953 1.00 0.00 O ATOM 6158 H1 WAT 9120 9.539 24.270 147.013 1.00 0.00 H ATOM 6159 H2 WAT 9120 10.112 24.689 148.349 1.00 0.00 H TER 6161 WAT 9120 ATOM 6161 O WAT 9121 101.667 74.260 12.267 1.00 0.00 O ATOM 6162 H1 WAT 9121 101.908 74.530 13.153 1.00 0.00 H ATOM 6163 H2 WAT 9121 101.350 75.062 11.850 1.00 0.00 H TER 6165 WAT 9121 ATOM 6165 O WAT 9122 65.153 12.859 130.706 1.00 0.00 O ATOM 6166 H1 WAT 9122 65.806 12.165 130.621 1.00 0.00 H ATOM 6167 H2 WAT 9122 65.483 13.567 130.152 1.00 0.00 H TER 6169 WAT 9122 ATOM 6169 O WAT 9123 4.369 26.453 3.553 1.00 0.00 O ATOM 6170 H1 WAT 9123 3.638 26.200 4.117 1.00 0.00 H ATOM 6171 H2 WAT 9123 3.980 27.046 2.909 1.00 0.00 H TER 6173 WAT 9123 ATOM 6173 O WAT 9124 104.216 8.266 120.468 1.00 0.00 O ATOM 6174 H1 WAT 9124 104.008 7.611 119.802 1.00 0.00 H ATOM 6175 H2 WAT 9124 105.107 8.052 120.744 1.00 0.00 H TER 6177 WAT 9124 ATOM 6177 O WAT 9125 89.718 26.976 82.707 1.00 0.00 O ATOM 6178 H1 WAT 9125 90.602 27.065 82.352 1.00 0.00 H ATOM 6179 H2 WAT 9125 89.615 26.037 82.862 1.00 0.00 H TER 6181 WAT 9125 ATOM 6181 O WAT 9126 58.370 60.300 153.929 1.00 0.00 O ATOM 6182 H1 WAT 9126 59.250 59.964 154.103 1.00 0.00 H ATOM 6183 H2 WAT 9126 57.993 60.443 154.797 1.00 0.00 H TER 6185 WAT 9126 ATOM 6185 O WAT 9127 144.512 16.335 15.392 1.00 0.00 O ATOM 6186 H1 WAT 9127 144.316 16.518 14.473 1.00 0.00 H ATOM 6187 H2 WAT 9127 145.460 16.450 15.462 1.00 0.00 H TER 6189 WAT 9127 ATOM 6189 O WAT 9128 105.996 53.117 69.732 1.00 0.00 O ATOM 6190 H1 WAT 9128 105.651 52.492 69.095 1.00 0.00 H ATOM 6191 H2 WAT 9128 106.947 53.059 69.633 1.00 0.00 H TER 6193 WAT 9128 ATOM 6193 O WAT 9129 98.453 56.277 88.274 1.00 0.00 O ATOM 6194 H1 WAT 9129 98.693 55.358 88.154 1.00 0.00 H ATOM 6195 H2 WAT 9129 98.576 56.437 89.209 1.00 0.00 H TER 6197 WAT 9129 ATOM 6197 O WAT 9130 39.581 72.463 67.053 1.00 0.00 O ATOM 6198 H1 WAT 9130 40.336 72.156 67.556 1.00 0.00 H ATOM 6199 H2 WAT 9130 39.957 72.803 66.242 1.00 0.00 H TER 6201 WAT 9130 ATOM 6201 O WAT 9131 106.599 95.648 81.310 1.00 0.00 O ATOM 6202 H1 WAT 9131 107.021 95.459 82.148 1.00 0.00 H ATOM 6203 H2 WAT 9131 107.234 95.363 80.653 1.00 0.00 H TER 6205 WAT 9131 ATOM 6205 O WAT 9132 110.386 118.987 125.263 1.00 0.00 O ATOM 6206 H1 WAT 9132 109.833 119.768 125.295 1.00 0.00 H ATOM 6207 H2 WAT 9132 110.124 118.541 124.458 1.00 0.00 H TER 6209 WAT 9132 ATOM 6209 O WAT 9133 27.349 100.941 118.454 1.00 0.00 O ATOM 6210 H1 WAT 9133 26.393 100.935 118.508 1.00 0.00 H ATOM 6211 H2 WAT 9133 27.584 101.868 118.469 1.00 0.00 H TER 6213 WAT 9133 ATOM 6213 O WAT 9134 120.996 100.005 95.634 1.00 0.00 O ATOM 6214 H1 WAT 9134 121.915 99.980 95.900 1.00 0.00 H ATOM 6215 H2 WAT 9134 120.551 100.454 96.353 1.00 0.00 H TER 6217 WAT 9134 ATOM 6217 O WAT 9135 15.599 22.870 64.193 1.00 0.00 O ATOM 6218 H1 WAT 9135 16.134 23.058 63.422 1.00 0.00 H ATOM 6219 H2 WAT 9135 14.823 22.430 63.846 1.00 0.00 H TER 6221 WAT 9135 ATOM 6221 O WAT 9136 76.937 67.642 69.856 1.00 0.00 O ATOM 6222 H1 WAT 9136 77.566 67.209 69.279 1.00 0.00 H ATOM 6223 H2 WAT 9136 76.115 67.175 69.709 1.00 0.00 H TER 6225 WAT 9136 ATOM 6225 O WAT 9137 17.781 90.795 111.987 1.00 0.00 O ATOM 6226 H1 WAT 9137 18.689 90.861 111.694 1.00 0.00 H ATOM 6227 H2 WAT 9137 17.698 91.468 112.663 1.00 0.00 H TER 6229 WAT 9137 ATOM 6229 O WAT 9138 89.550 26.993 75.058 1.00 0.00 O ATOM 6230 H1 WAT 9138 89.897 27.609 75.703 1.00 0.00 H ATOM 6231 H2 WAT 9138 90.139 27.076 74.308 1.00 0.00 H TER 6233 WAT 9138 ATOM 6233 O WAT 9139 92.082 61.228 131.833 1.00 0.00 O ATOM 6234 H1 WAT 9139 91.372 61.037 132.445 1.00 0.00 H ATOM 6235 H2 WAT 9139 92.195 62.177 131.886 1.00 0.00 H TER 6237 WAT 9139 ATOM 6237 O WAT 9140 60.855 23.420 150.738 1.00 0.00 O ATOM 6238 H1 WAT 9140 60.181 23.542 150.069 1.00 0.00 H ATOM 6239 H2 WAT 9140 61.135 22.511 150.631 1.00 0.00 H TER 6241 WAT 9140 ATOM 6241 O WAT 9141 109.622 98.845 66.928 1.00 0.00 O ATOM 6242 H1 WAT 9141 108.677 98.738 67.038 1.00 0.00 H ATOM 6243 H2 WAT 9141 109.999 98.059 67.325 1.00 0.00 H TER 6245 WAT 9141 ATOM 6245 O WAT 9142 2.110 26.257 106.936 1.00 0.00 O ATOM 6246 H1 WAT 9142 2.463 26.728 106.182 1.00 0.00 H ATOM 6247 H2 WAT 9142 2.173 25.333 106.692 1.00 0.00 H TER 6249 WAT 9142 ATOM 6249 O WAT 9143 98.465 106.317 141.501 1.00 0.00 O ATOM 6250 H1 WAT 9143 98.903 105.968 142.277 1.00 0.00 H ATOM 6251 H2 WAT 9143 97.921 107.031 141.833 1.00 0.00 H TER 6253 WAT 9143 ATOM 6253 O WAT 9144 87.802 141.433 118.575 1.00 0.00 O ATOM 6254 H1 WAT 9144 87.716 141.804 119.453 1.00 0.00 H ATOM 6255 H2 WAT 9144 87.625 140.499 118.691 1.00 0.00 H TER 6257 WAT 9144 ATOM 6257 O WAT 9145 58.014 0.790 99.538 1.00 0.00 O ATOM 6258 H1 WAT 9145 58.803 1.271 99.787 1.00 0.00 H ATOM 6259 H2 WAT 9145 57.620 0.528 100.371 1.00 0.00 H TER 6261 WAT 9145 ATOM 6261 O WAT 9146 65.316 130.191 152.792 1.00 0.00 O ATOM 6262 H1 WAT 9146 65.744 129.832 152.014 1.00 0.00 H ATOM 6263 H2 WAT 9146 64.864 130.973 152.477 1.00 0.00 H TER 6265 WAT 9146 ATOM 6265 O WAT 9147 145.560 61.924 13.465 1.00 0.00 O ATOM 6266 H1 WAT 9147 146.146 61.500 14.092 1.00 0.00 H ATOM 6267 H2 WAT 9147 145.201 62.672 13.942 1.00 0.00 H TER 6269 WAT 9147 ATOM 6269 O WAT 9148 141.036 135.032 83.755 1.00 0.00 O ATOM 6270 H1 WAT 9148 141.241 135.638 83.043 1.00 0.00 H ATOM 6271 H2 WAT 9148 140.895 135.596 84.516 1.00 0.00 H TER 6273 WAT 9148 ATOM 6273 O WAT 9149 27.488 99.977 106.566 1.00 0.00 O ATOM 6274 H1 WAT 9149 28.082 100.727 106.559 1.00 0.00 H ATOM 6275 H2 WAT 9149 28.060 99.219 106.686 1.00 0.00 H TER 6277 WAT 9149 ATOM 6277 O WAT 9150 41.820 134.369 78.898 1.00 0.00 O ATOM 6278 H1 WAT 9150 42.000 134.155 77.983 1.00 0.00 H ATOM 6279 H2 WAT 9150 42.483 135.021 79.126 1.00 0.00 H TER 6281 WAT 9150 ATOM 6281 O WAT 9151 101.529 134.173 78.611 1.00 0.00 O ATOM 6282 H1 WAT 9151 100.857 134.841 78.472 1.00 0.00 H ATOM 6283 H2 WAT 9151 101.721 133.841 77.735 1.00 0.00 H TER 6285 WAT 9151 ATOM 6285 O WAT 9152 33.910 66.592 129.199 1.00 0.00 O ATOM 6286 H1 WAT 9152 33.243 66.916 129.805 1.00 0.00 H ATOM 6287 H2 WAT 9152 33.537 65.787 128.840 1.00 0.00 H TER 6289 WAT 9152 ATOM 6289 O WAT 9153 40.529 102.194 157.988 1.00 0.00 O ATOM 6290 H1 WAT 9153 39.676 102.562 157.757 1.00 0.00 H ATOM 6291 H2 WAT 9153 41.155 102.693 157.463 1.00 0.00 H TER 6293 WAT 9153 ATOM 6293 O WAT 9154 95.944 97.505 17.013 1.00 0.00 O ATOM 6294 H1 WAT 9154 96.625 97.277 16.379 1.00 0.00 H ATOM 6295 H2 WAT 9154 96.177 98.386 17.306 1.00 0.00 H TER 6297 WAT 9154 ATOM 6297 O WAT 9155 102.754 89.507 119.618 1.00 0.00 O ATOM 6298 H1 WAT 9155 102.996 90.433 119.652 1.00 0.00 H ATOM 6299 H2 WAT 9155 101.819 89.511 119.415 1.00 0.00 H TER 6301 WAT 9155 ATOM 6301 O WAT 9156 79.312 118.792 121.657 1.00 0.00 O ATOM 6302 H1 WAT 9156 79.917 118.067 121.501 1.00 0.00 H ATOM 6303 H2 WAT 9156 79.837 119.446 122.119 1.00 0.00 H TER 6305 WAT 9156 ATOM 6305 O WAT 9157 49.341 37.954 145.522 1.00 0.00 O ATOM 6306 H1 WAT 9157 49.956 38.039 146.251 1.00 0.00 H ATOM 6307 H2 WAT 9157 49.191 37.012 145.443 1.00 0.00 H TER 6309 WAT 9157 ATOM 6309 O WAT 9158 81.302 38.226 65.505 1.00 0.00 O ATOM 6310 H1 WAT 9158 81.260 39.100 65.117 1.00 0.00 H ATOM 6311 H2 WAT 9158 80.547 37.765 65.139 1.00 0.00 H TER 6313 WAT 9158 ATOM 6313 O WAT 9159 141.877 96.536 25.598 1.00 0.00 O ATOM 6314 H1 WAT 9159 142.264 95.924 24.972 1.00 0.00 H ATOM 6315 H2 WAT 9159 142.614 96.832 26.131 1.00 0.00 H TER 6317 WAT 9159 ATOM 6317 O WAT 9160 6.093 133.594 67.526 1.00 0.00 O ATOM 6318 H1 WAT 9160 6.517 134.359 67.915 1.00 0.00 H ATOM 6319 H2 WAT 9160 5.531 133.954 66.840 1.00 0.00 H TER 6321 WAT 9160 ATOM 6321 O WAT 9161 63.444 96.852 143.231 1.00 0.00 O ATOM 6322 H1 WAT 9161 63.513 96.130 143.856 1.00 0.00 H ATOM 6323 H2 WAT 9161 63.276 96.426 142.391 1.00 0.00 H TER 6325 WAT 9161 ATOM 6325 O WAT 9162 55.547 127.557 87.011 1.00 0.00 O ATOM 6326 H1 WAT 9162 55.378 126.748 86.528 1.00 0.00 H ATOM 6327 H2 WAT 9162 54.998 128.212 86.579 1.00 0.00 H TER 6329 WAT 9162 ATOM 6329 O WAT 9163 46.184 45.413 151.898 1.00 0.00 O ATOM 6330 H1 WAT 9163 46.948 45.774 151.450 1.00 0.00 H ATOM 6331 H2 WAT 9163 46.518 44.647 152.363 1.00 0.00 H TER 6333 WAT 9163 ATOM 6333 O WAT 9164 113.603 26.912 146.087 1.00 0.00 O ATOM 6334 H1 WAT 9164 114.214 27.611 146.320 1.00 0.00 H ATOM 6335 H2 WAT 9164 113.425 27.050 145.157 1.00 0.00 H TER 6337 WAT 9164 ATOM 6337 O WAT 9165 137.053 2.226 72.949 1.00 0.00 O ATOM 6338 H1 WAT 9165 137.475 1.367 72.930 1.00 0.00 H ATOM 6339 H2 WAT 9165 137.685 2.812 72.532 1.00 0.00 H TER 6341 WAT 9165 ATOM 6341 O WAT 9166 15.718 46.737 70.710 1.00 0.00 O ATOM 6342 H1 WAT 9166 15.885 47.444 71.333 1.00 0.00 H ATOM 6343 H2 WAT 9166 16.576 46.543 70.333 1.00 0.00 H TER 6345 WAT 9166 ATOM 6345 O WAT 9167 65.849 18.697 54.937 1.00 0.00 O ATOM 6346 H1 WAT 9167 65.784 19.573 54.558 1.00 0.00 H ATOM 6347 H2 WAT 9167 64.997 18.296 54.761 1.00 0.00 H TER 6349 WAT 9167 ATOM 6349 O WAT 9168 74.626 45.487 112.398 1.00 0.00 O ATOM 6350 H1 WAT 9168 73.848 46.040 112.471 1.00 0.00 H ATOM 6351 H2 WAT 9168 74.417 44.871 111.696 1.00 0.00 H TER 6353 WAT 9168 ATOM 6353 O WAT 9169 108.959 115.680 90.434 1.00 0.00 O ATOM 6354 H1 WAT 9169 109.603 115.014 90.671 1.00 0.00 H ATOM 6355 H2 WAT 9169 109.311 116.084 89.641 1.00 0.00 H TER 6357 WAT 9169 ATOM 6357 O WAT 9170 116.268 68.381 116.782 1.00 0.00 O ATOM 6358 H1 WAT 9170 116.557 69.104 117.338 1.00 0.00 H ATOM 6359 H2 WAT 9170 117.031 67.806 116.721 1.00 0.00 H TER 6361 WAT 9170 ATOM 6361 O WAT 9171 11.681 14.920 13.450 1.00 0.00 O ATOM 6362 H1 WAT 9171 12.170 14.102 13.545 1.00 0.00 H ATOM 6363 H2 WAT 9171 10.764 14.664 13.541 1.00 0.00 H TER 6365 WAT 9171 ATOM 6365 O WAT 9172 43.389 78.722 75.810 1.00 0.00 O ATOM 6366 H1 WAT 9172 43.037 78.527 74.941 1.00 0.00 H ATOM 6367 H2 WAT 9172 43.600 77.866 76.181 1.00 0.00 H TER 6369 WAT 9172 ATOM 6369 O WAT 9173 92.181 131.004 14.724 1.00 0.00 O ATOM 6370 H1 WAT 9173 91.479 131.605 14.971 1.00 0.00 H ATOM 6371 H2 WAT 9173 92.679 130.873 15.531 1.00 0.00 H TER 6373 WAT 9173 ATOM 6373 O WAT 9174 90.758 140.177 100.709 1.00 0.00 O ATOM 6374 H1 WAT 9174 91.441 140.840 100.614 1.00 0.00 H ATOM 6375 H2 WAT 9174 91.090 139.586 101.385 1.00 0.00 H TER 6377 WAT 9174 ATOM 6377 O WAT 9175 43.071 65.878 85.004 1.00 0.00 O ATOM 6378 H1 WAT 9175 43.814 66.431 84.764 1.00 0.00 H ATOM 6379 H2 WAT 9175 42.363 66.165 84.427 1.00 0.00 H TER 6381 WAT 9175 ATOM 6381 O WAT 9176 143.676 44.710 18.187 1.00 0.00 O ATOM 6382 H1 WAT 9176 144.209 44.438 18.935 1.00 0.00 H ATOM 6383 H2 WAT 9176 143.253 43.905 17.890 1.00 0.00 H TER 6385 WAT 9176 ATOM 6385 O WAT 9177 53.596 33.453 16.042 1.00 0.00 O ATOM 6386 H1 WAT 9177 53.326 34.352 15.852 1.00 0.00 H ATOM 6387 H2 WAT 9177 52.995 32.909 15.533 1.00 0.00 H TER 6389 WAT 9177 ATOM 6389 O WAT 9178 61.843 42.180 127.175 1.00 0.00 O ATOM 6390 H1 WAT 9178 61.553 41.269 127.121 1.00 0.00 H ATOM 6391 H2 WAT 9178 61.321 42.637 126.516 1.00 0.00 H TER 6393 WAT 9178 ATOM 6393 O WAT 9179 96.264 121.820 120.389 1.00 0.00 O ATOM 6394 H1 WAT 9179 96.832 122.573 120.226 1.00 0.00 H ATOM 6395 H2 WAT 9179 96.088 121.460 119.520 1.00 0.00 H TER 6397 WAT 9179 ATOM 6397 O WAT 9180 127.307 130.088 90.538 1.00 0.00 O ATOM 6398 H1 WAT 9180 126.659 129.405 90.712 1.00 0.00 H ATOM 6399 H2 WAT 9180 126.928 130.881 90.918 1.00 0.00 H TER 6401 WAT 9180 ATOM 6401 O WAT 9181 71.223 49.749 103.866 1.00 0.00 O ATOM 6402 H1 WAT 9181 70.630 50.033 103.171 1.00 0.00 H ATOM 6403 H2 WAT 9181 71.984 50.322 103.782 1.00 0.00 H TER 6405 WAT 9181 ATOM 6405 O WAT 9182 99.173 83.260 156.983 1.00 0.00 O ATOM 6406 H1 WAT 9182 99.370 83.325 156.048 1.00 0.00 H ATOM 6407 H2 WAT 9182 99.950 82.853 157.364 1.00 0.00 H TER 6409 WAT 9182 ATOM 6409 O WAT 9183 40.392 108.342 106.727 1.00 0.00 O ATOM 6410 H1 WAT 9183 40.329 107.574 106.158 1.00 0.00 H ATOM 6411 H2 WAT 9183 39.490 108.512 107.000 1.00 0.00 H TER 6413 WAT 9183 ATOM 6413 O WAT 9184 115.995 36.162 68.825 1.00 0.00 O ATOM 6414 H1 WAT 9184 116.030 35.351 68.317 1.00 0.00 H ATOM 6415 H2 WAT 9184 116.912 36.408 68.948 1.00 0.00 H TER 6417 WAT 9184 ATOM 6417 O WAT 9185 86.481 28.579 98.265 1.00 0.00 O ATOM 6418 H1 WAT 9185 86.007 29.298 97.846 1.00 0.00 H ATOM 6419 H2 WAT 9185 86.159 27.792 97.825 1.00 0.00 H TER 6421 WAT 9185 ATOM 6421 O WAT 9186 67.151 13.335 4.253 1.00 0.00 O ATOM 6422 H1 WAT 9186 67.384 13.075 5.144 1.00 0.00 H ATOM 6423 H2 WAT 9186 66.314 12.900 4.088 1.00 0.00 H TER 6425 WAT 9186 ATOM 6425 O WAT 9187 53.011 113.256 131.962 1.00 0.00 O ATOM 6426 H1 WAT 9187 53.350 114.080 132.311 1.00 0.00 H ATOM 6427 H2 WAT 9187 52.837 113.440 131.039 1.00 0.00 H TER 6429 WAT 9187 ATOM 6429 O WAT 9188 51.103 48.218 7.507 1.00 0.00 O ATOM 6430 H1 WAT 9188 51.433 49.076 7.242 1.00 0.00 H ATOM 6431 H2 WAT 9188 51.546 47.601 6.923 1.00 0.00 H TER 6433 WAT 9188 ATOM 6433 O WAT 9189 137.446 138.946 1.660 1.00 0.00 O ATOM 6434 H1 WAT 9189 138.009 139.066 2.425 1.00 0.00 H ATOM 6435 H2 WAT 9189 137.788 138.162 1.231 1.00 0.00 H TER 6437 WAT 9189 ATOM 6437 O WAT 9190 47.679 15.136 135.544 1.00 0.00 O ATOM 6438 H1 WAT 9190 48.411 15.738 135.413 1.00 0.00 H ATOM 6439 H2 WAT 9190 46.947 15.546 135.083 1.00 0.00 H TER 6441 WAT 9190 ATOM 6441 O WAT 9191 139.664 33.629 153.248 1.00 0.00 O ATOM 6442 H1 WAT 9191 140.182 34.408 153.045 1.00 0.00 H ATOM 6443 H2 WAT 9191 138.926 33.667 152.640 1.00 0.00 H TER 6445 WAT 9191 ATOM 6445 O WAT 9192 131.540 107.310 136.308 1.00 0.00 O ATOM 6446 H1 WAT 9192 131.305 108.205 136.553 1.00 0.00 H ATOM 6447 H2 WAT 9192 130.757 106.795 136.502 1.00 0.00 H TER 6449 WAT 9192 ATOM 6449 O WAT 9193 137.864 18.307 86.854 1.00 0.00 O ATOM 6450 H1 WAT 9193 137.457 18.517 86.013 1.00 0.00 H ATOM 6451 H2 WAT 9193 138.118 17.388 86.774 1.00 0.00 H TER 6453 WAT 9193 ATOM 6453 O WAT 9194 26.839 137.484 125.708 1.00 0.00 O ATOM 6454 H1 WAT 9194 27.336 137.189 124.946 1.00 0.00 H ATOM 6455 H2 WAT 9194 26.159 136.820 125.823 1.00 0.00 H TER 6457 WAT 9194 ATOM 6457 O WAT 9195 64.516 60.701 14.850 1.00 0.00 O ATOM 6458 H1 WAT 9195 63.977 59.911 14.898 1.00 0.00 H ATOM 6459 H2 WAT 9195 64.544 61.026 15.750 1.00 0.00 H TER 6461 WAT 9195 ATOM 6461 O WAT 9196 85.233 61.629 6.820 1.00 0.00 O ATOM 6462 H1 WAT 9196 85.672 61.276 6.045 1.00 0.00 H ATOM 6463 H2 WAT 9196 85.692 62.448 7.003 1.00 0.00 H TER 6465 WAT 9196 ATOM 6465 O WAT 9197 101.967 50.964 120.850 1.00 0.00 O ATOM 6466 H1 WAT 9197 101.368 51.478 120.308 1.00 0.00 H ATOM 6467 H2 WAT 9197 101.838 51.303 121.736 1.00 0.00 H TER 6469 WAT 9197 ATOM 6469 O WAT 9198 125.851 91.412 75.743 1.00 0.00 O ATOM 6470 H1 WAT 9198 125.989 92.358 75.713 1.00 0.00 H ATOM 6471 H2 WAT 9198 124.919 91.300 75.556 1.00 0.00 H TER 6473 WAT 9198 ATOM 6473 O WAT 9199 87.305 118.318 14.863 1.00 0.00 O ATOM 6474 H1 WAT 9199 87.029 118.887 14.144 1.00 0.00 H ATOM 6475 H2 WAT 9199 88.260 118.386 14.869 1.00 0.00 H TER 6477 WAT 9199 ATOM 6477 O WAT 9200 123.031 33.770 151.974 1.00 0.00 O ATOM 6478 H1 WAT 9200 122.696 33.751 152.871 1.00 0.00 H ATOM 6479 H2 WAT 9200 122.459 33.173 151.492 1.00 0.00 H TER 6481 WAT 9200 ATOM 6481 O WAT 9201 126.214 51.763 147.794 1.00 0.00 O ATOM 6482 H1 WAT 9201 126.200 51.484 148.709 1.00 0.00 H ATOM 6483 H2 WAT 9201 125.359 51.505 147.451 1.00 0.00 H TER 6485 WAT 9201 ATOM 6485 O WAT 9202 72.012 120.375 71.323 1.00 0.00 O ATOM 6486 H1 WAT 9202 71.175 120.155 70.915 1.00 0.00 H ATOM 6487 H2 WAT 9202 72.670 119.986 70.746 1.00 0.00 H TER 6489 WAT 9202 ATOM 6489 O WAT 9203 109.420 110.103 74.656 1.00 0.00 O ATOM 6490 H1 WAT 9203 109.382 110.904 75.179 1.00 0.00 H ATOM 6491 H2 WAT 9203 109.879 110.361 73.857 1.00 0.00 H TER 6493 WAT 9203 ATOM 6493 O WAT 9204 91.615 117.653 17.312 1.00 0.00 O ATOM 6494 H1 WAT 9204 91.665 116.698 17.352 1.00 0.00 H ATOM 6495 H2 WAT 9204 90.740 117.862 17.638 1.00 0.00 H TER 6497 WAT 9204 ATOM 6497 O WAT 9205 33.171 29.084 61.427 1.00 0.00 O ATOM 6498 H1 WAT 9205 33.324 29.443 62.301 1.00 0.00 H ATOM 6499 H2 WAT 9205 32.450 28.465 61.545 1.00 0.00 H TER 6501 WAT 9205 ATOM 6501 O WAT 9206 104.910 117.607 122.135 1.00 0.00 O ATOM 6502 H1 WAT 9206 105.308 116.749 122.281 1.00 0.00 H ATOM 6503 H2 WAT 9206 103.982 117.477 122.329 1.00 0.00 H TER 6505 WAT 9206 ATOM 6505 O WAT 9207 41.822 128.022 8.817 1.00 0.00 O ATOM 6506 H1 WAT 9207 42.067 128.437 9.644 1.00 0.00 H ATOM 6507 H2 WAT 9207 40.958 127.647 8.983 1.00 0.00 H TER 6509 WAT 9207 ATOM 6509 O WAT 9208 79.408 144.972 14.783 1.00 0.00 O ATOM 6510 H1 WAT 9208 78.794 144.734 15.478 1.00 0.00 H ATOM 6511 H2 WAT 9208 79.101 145.824 14.473 1.00 0.00 H TER 6513 WAT 9208 ATOM 6513 O WAT 9209 102.044 113.641 140.449 1.00 0.00 O ATOM 6514 H1 WAT 9209 102.783 114.244 140.363 1.00 0.00 H ATOM 6515 H2 WAT 9209 101.531 113.993 141.175 1.00 0.00 H TER 6517 WAT 9209 ATOM 6517 O WAT 9210 129.144 17.851 136.511 1.00 0.00 O ATOM 6518 H1 WAT 9210 129.684 17.211 136.974 1.00 0.00 H ATOM 6519 H2 WAT 9210 128.313 17.400 136.361 1.00 0.00 H TER 6521 WAT 9210 ATOM 6521 O WAT 9211 106.599 67.600 25.892 1.00 0.00 O ATOM 6522 H1 WAT 9211 107.316 68.099 25.500 1.00 0.00 H ATOM 6523 H2 WAT 9211 106.963 66.725 26.027 1.00 0.00 H TER 6525 WAT 9211 ATOM 6525 O WAT 9212 5.968 76.834 111.211 1.00 0.00 O ATOM 6526 H1 WAT 9212 6.813 76.515 111.528 1.00 0.00 H ATOM 6527 H2 WAT 9212 5.693 77.477 111.864 1.00 0.00 H TER 6529 WAT 9212 ATOM 6529 O WAT 9213 80.685 55.896 61.998 1.00 0.00 O ATOM 6530 H1 WAT 9213 81.642 55.919 61.970 1.00 0.00 H ATOM 6531 H2 WAT 9213 80.422 56.816 61.970 1.00 0.00 H TER 6533 WAT 9213 ATOM 6533 O WAT 9214 33.700 17.720 75.285 1.00 0.00 O ATOM 6534 H1 WAT 9214 33.424 18.621 75.115 1.00 0.00 H ATOM 6535 H2 WAT 9214 33.117 17.185 74.747 1.00 0.00 H TER 6537 WAT 9214 ATOM 6537 O WAT 9215 30.457 136.702 66.158 1.00 0.00 O ATOM 6538 H1 WAT 9215 31.226 136.856 66.707 1.00 0.00 H ATOM 6539 H2 WAT 9215 30.710 137.027 65.294 1.00 0.00 H TER 6541 WAT 9215 ATOM 6541 O WAT 9216 140.139 73.572 18.109 1.00 0.00 O ATOM 6542 H1 WAT 9216 139.251 73.927 18.132 1.00 0.00 H ATOM 6543 H2 WAT 9216 140.706 74.342 18.138 1.00 0.00 H TER 6545 WAT 9216 ATOM 6545 O WAT 9217 92.075 5.266 98.165 1.00 0.00 O ATOM 6546 H1 WAT 9217 91.204 5.615 97.977 1.00 0.00 H ATOM 6547 H2 WAT 9217 92.625 5.597 97.455 1.00 0.00 H TER 6549 WAT 9217 ATOM 6549 O WAT 9218 8.848 75.976 70.314 1.00 0.00 O ATOM 6550 H1 WAT 9218 8.780 75.109 69.916 1.00 0.00 H ATOM 6551 H2 WAT 9218 9.762 76.228 70.186 1.00 0.00 H TER 6553 WAT 9218 ATOM 6553 O WAT 9219 85.336 44.799 119.920 1.00 0.00 O ATOM 6554 H1 WAT 9219 85.754 44.465 120.713 1.00 0.00 H ATOM 6555 H2 WAT 9219 85.702 45.676 119.807 1.00 0.00 H TER 6557 WAT 9219 ATOM 6557 O WAT 9220 87.562 35.508 132.159 1.00 0.00 O ATOM 6558 H1 WAT 9220 86.980 34.835 131.805 1.00 0.00 H ATOM 6559 H2 WAT 9220 88.346 35.028 132.427 1.00 0.00 H TER 6561 WAT 9220 ATOM 6561 O WAT 9221 81.412 25.958 78.290 1.00 0.00 O ATOM 6562 H1 WAT 9221 80.967 25.461 78.977 1.00 0.00 H ATOM 6563 H2 WAT 9221 82.343 25.798 78.443 1.00 0.00 H TER 6565 WAT 9221 ATOM 6565 O WAT 9222 74.118 10.537 83.482 1.00 0.00 O ATOM 6566 H1 WAT 9222 73.901 10.272 82.588 1.00 0.00 H ATOM 6567 H2 WAT 9222 73.538 10.013 84.034 1.00 0.00 H TER 6569 WAT 9222 ATOM 6569 O WAT 9223 47.618 64.679 108.349 1.00 0.00 O ATOM 6570 H1 WAT 9223 47.036 65.136 107.741 1.00 0.00 H ATOM 6571 H2 WAT 9223 48.349 65.283 108.479 1.00 0.00 H TER 6573 WAT 9223 ATOM 6573 O WAT 9224 57.269 6.193 17.837 1.00 0.00 O ATOM 6574 H1 WAT 9224 56.640 5.994 17.143 1.00 0.00 H ATOM 6575 H2 WAT 9224 57.830 5.419 17.881 1.00 0.00 H TER 6577 WAT 9224 ATOM 6577 O WAT 9225 121.756 137.719 5.376 1.00 0.00 O ATOM 6578 H1 WAT 9225 121.169 137.225 4.804 1.00 0.00 H ATOM 6579 H2 WAT 9225 121.808 137.196 6.176 1.00 0.00 H TER 6581 WAT 9225 ATOM 6581 O WAT 9226 39.382 87.876 108.182 1.00 0.00 O ATOM 6582 H1 WAT 9226 39.182 88.599 108.777 1.00 0.00 H ATOM 6583 H2 WAT 9226 38.538 87.453 108.027 1.00 0.00 H TER 6585 WAT 9226 ATOM 6585 O WAT 9227 24.755 93.413 6.425 1.00 0.00 O ATOM 6586 H1 WAT 9227 24.320 92.589 6.207 1.00 0.00 H ATOM 6587 H2 WAT 9227 24.143 93.859 7.012 1.00 0.00 H TER 6589 WAT 9227 ATOM 6589 O WAT 9228 59.278 137.074 125.182 1.00 0.00 O ATOM 6590 H1 WAT 9228 60.114 136.844 125.587 1.00 0.00 H ATOM 6591 H2 WAT 9228 58.971 137.832 125.681 1.00 0.00 H TER 6593 WAT 9228 ATOM 6593 O WAT 9229 0.225 0.354 117.904 1.00 0.00 O ATOM 6594 H1 WAT 9229 0.972 -0.136 117.558 1.00 0.00 H ATOM 6595 H2 WAT 9229 -0.533 -0.015 117.452 1.00 0.00 H TER 6597 WAT 9229 ATOM 6597 O WAT 9230 98.231 3.302 122.180 1.00 0.00 O ATOM 6598 H1 WAT 9230 98.917 2.711 122.492 1.00 0.00 H ATOM 6599 H2 WAT 9230 98.569 3.645 121.352 1.00 0.00 H TER 6601 WAT 9230 ATOM 6601 O WAT 9231 21.859 108.512 142.334 1.00 0.00 O ATOM 6602 H1 WAT 9231 22.337 109.320 142.519 1.00 0.00 H ATOM 6603 H2 WAT 9231 20.962 108.798 142.161 1.00 0.00 H TER 6605 WAT 9231 ATOM 6605 O WAT 9232 110.562 89.885 105.512 1.00 0.00 O ATOM 6606 H1 WAT 9232 110.271 90.767 105.282 1.00 0.00 H ATOM 6607 H2 WAT 9232 111.440 90.008 105.873 1.00 0.00 H TER 6609 WAT 9232 ATOM 6609 O WAT 9233 99.408 109.307 106.557 1.00 0.00 O ATOM 6610 H1 WAT 9233 98.684 108.687 106.635 1.00 0.00 H ATOM 6611 H2 WAT 9233 99.414 109.774 107.393 1.00 0.00 H TER 6613 WAT 9233 ATOM 6613 O WAT 9234 127.378 109.626 64.504 1.00 0.00 O ATOM 6614 H1 WAT 9234 126.872 109.326 63.748 1.00 0.00 H ATOM 6615 H2 WAT 9234 128.024 108.935 64.649 1.00 0.00 H TER 6617 WAT 9234 ATOM 6617 O WAT 9235 14.008 2.856 57.287 1.00 0.00 O ATOM 6618 H1 WAT 9235 14.675 2.426 56.751 1.00 0.00 H ATOM 6619 H2 WAT 9235 13.545 2.136 57.715 1.00 0.00 H TER 6621 WAT 9235 ATOM 6621 O WAT 9236 132.948 48.530 150.664 1.00 0.00 O ATOM 6622 H1 WAT 9236 132.484 48.210 151.438 1.00 0.00 H ATOM 6623 H2 WAT 9236 133.821 48.143 150.732 1.00 0.00 H TER 6625 WAT 9236 ATOM 6625 O WAT 9237 87.144 41.316 19.506 1.00 0.00 O ATOM 6626 H1 WAT 9237 86.548 40.571 19.429 1.00 0.00 H ATOM 6627 H2 WAT 9237 86.758 41.862 20.190 1.00 0.00 H TER 6629 WAT 9237 ATOM 6629 O WAT 9238 16.742 107.979 124.840 1.00 0.00 O ATOM 6630 H1 WAT 9238 16.613 107.624 125.719 1.00 0.00 H ATOM 6631 H2 WAT 9238 16.497 108.901 124.915 1.00 0.00 H TER 6633 WAT 9238 ATOM 6633 O WAT 9239 68.673 129.992 117.226 1.00 0.00 O ATOM 6634 H1 WAT 9239 68.999 130.890 117.294 1.00 0.00 H ATOM 6635 H2 WAT 9239 67.733 130.066 117.394 1.00 0.00 H TER 6637 WAT 9239 ATOM 6637 O WAT 9240 131.896 3.029 131.712 1.00 0.00 O ATOM 6638 H1 WAT 9240 131.628 3.706 131.090 1.00 0.00 H ATOM 6639 H2 WAT 9240 132.226 3.515 132.467 1.00 0.00 H TER 6641 WAT 9240 ATOM 6641 O WAT 9241 94.036 76.501 80.821 1.00 0.00 O ATOM 6642 H1 WAT 9241 94.133 75.758 80.225 1.00 0.00 H ATOM 6643 H2 WAT 9241 94.379 77.248 80.331 1.00 0.00 H TER 6645 WAT 9241 ATOM 6645 O WAT 9242 94.387 6.217 13.969 1.00 0.00 O ATOM 6646 H1 WAT 9242 93.699 5.827 14.508 1.00 0.00 H ATOM 6647 H2 WAT 9242 95.182 5.745 14.217 1.00 0.00 H TER 6649 WAT 9242 ATOM 6649 O WAT 9243 74.736 139.073 113.966 1.00 0.00 O ATOM 6650 H1 WAT 9243 75.387 138.719 114.571 1.00 0.00 H ATOM 6651 H2 WAT 9243 75.246 139.371 113.213 1.00 0.00 H TER 6653 WAT 9243 ATOM 6653 O WAT 9244 144.603 69.758 107.566 1.00 0.00 O ATOM 6654 H1 WAT 9244 144.424 68.841 107.773 1.00 0.00 H ATOM 6655 H2 WAT 9244 144.472 69.821 106.620 1.00 0.00 H TER 6657 WAT 9244 ATOM 6657 O WAT 9245 14.033 18.564 93.942 1.00 0.00 O ATOM 6658 H1 WAT 9245 14.784 19.128 93.758 1.00 0.00 H ATOM 6659 H2 WAT 9245 13.870 18.105 93.118 1.00 0.00 H TER 6661 WAT 9245 ATOM 6661 O WAT 9246 58.300 77.796 5.974 1.00 0.00 O ATOM 6662 H1 WAT 9246 58.078 78.562 5.445 1.00 0.00 H ATOM 6663 H2 WAT 9246 58.985 77.351 5.476 1.00 0.00 H TER 6665 WAT 9246 ATOM 6665 O WAT 9247 8.799 89.602 154.823 1.00 0.00 O ATOM 6666 H1 WAT 9247 9.198 89.227 155.608 1.00 0.00 H ATOM 6667 H2 WAT 9247 8.118 90.186 155.157 1.00 0.00 H TER 6669 WAT 9247 ATOM 6669 O WAT 9248 84.885 61.727 93.262 1.00 0.00 O ATOM 6670 H1 WAT 9248 85.753 61.325 93.254 1.00 0.00 H ATOM 6671 H2 WAT 9248 84.356 61.146 93.809 1.00 0.00 H TER 6673 WAT 9248 ATOM 6673 O WAT 9249 30.146 22.878 93.934 1.00 0.00 O ATOM 6674 H1 WAT 9249 29.365 23.213 93.495 1.00 0.00 H ATOM 6675 H2 WAT 9249 29.922 21.978 94.170 1.00 0.00 H TER 6677 WAT 9249 ATOM 6677 O WAT 9250 72.636 101.817 88.783 1.00 0.00 O ATOM 6678 H1 WAT 9250 72.878 102.100 89.664 1.00 0.00 H ATOM 6679 H2 WAT 9250 73.165 102.364 88.202 1.00 0.00 H TER 6681 WAT 9250 ATOM 6681 O WAT 9251 93.476 104.974 140.448 1.00 0.00 O ATOM 6682 H1 WAT 9251 93.326 104.098 140.092 1.00 0.00 H ATOM 6683 H2 WAT 9251 94.427 105.082 140.427 1.00 0.00 H TER 6685 WAT 9251 ATOM 6685 O WAT 9252 103.818 145.263 103.470 1.00 0.00 O ATOM 6686 H1 WAT 9252 103.625 146.201 103.480 1.00 0.00 H ATOM 6687 H2 WAT 9252 104.076 145.062 104.369 1.00 0.00 H TER 6689 WAT 9252 ATOM 6689 O WAT 9253 73.357 97.584 128.937 1.00 0.00 O ATOM 6690 H1 WAT 9253 74.242 97.946 128.880 1.00 0.00 H ATOM 6691 H2 WAT 9253 72.873 98.027 128.240 1.00 0.00 H TER 6693 WAT 9253 ATOM 6693 O WAT 9254 39.943 112.588 104.863 1.00 0.00 O ATOM 6694 H1 WAT 9254 40.421 111.759 104.866 1.00 0.00 H ATOM 6695 H2 WAT 9254 39.426 112.563 104.058 1.00 0.00 H TER 6697 WAT 9254 ATOM 6697 O WAT 9255 109.456 92.106 123.077 1.00 0.00 O ATOM 6698 H1 WAT 9255 109.838 91.487 122.455 1.00 0.00 H ATOM 6699 H2 WAT 9255 110.205 92.599 123.414 1.00 0.00 H TER 6701 WAT 9255 ATOM 6701 O WAT 9256 75.237 62.433 123.028 1.00 0.00 O ATOM 6702 H1 WAT 9256 74.517 62.428 122.398 1.00 0.00 H ATOM 6703 H2 WAT 9256 75.647 63.291 122.916 1.00 0.00 H TER 6705 WAT 9256 ATOM 6705 O WAT 9257 28.796 133.616 85.661 1.00 0.00 O ATOM 6706 H1 WAT 9257 28.100 133.237 86.197 1.00 0.00 H ATOM 6707 H2 WAT 9257 29.239 134.232 86.244 1.00 0.00 H TER 6709 WAT 9257 ATOM 6709 O WAT 9258 52.274 41.806 141.083 1.00 0.00 O ATOM 6710 H1 WAT 9258 52.112 42.645 140.651 1.00 0.00 H ATOM 6711 H2 WAT 9258 51.624 41.768 141.784 1.00 0.00 H TER 6713 WAT 9258 ATOM 6713 O WAT 9259 133.601 54.581 74.078 1.00 0.00 O ATOM 6714 H1 WAT 9259 133.270 53.901 73.491 1.00 0.00 H ATOM 6715 H2 WAT 9259 133.013 55.323 73.942 1.00 0.00 H TER 6717 WAT 9259 ATOM 6717 O WAT 9260 67.417 81.370 133.183 1.00 0.00 O ATOM 6718 H1 WAT 9260 66.811 80.771 132.748 1.00 0.00 H ATOM 6719 H2 WAT 9260 68.286 81.048 132.945 1.00 0.00 H TER 6721 WAT 9260 ATOM 6721 O WAT 9261 98.567 143.696 156.113 1.00 0.00 O ATOM 6722 H1 WAT 9261 97.663 143.436 156.288 1.00 0.00 H ATOM 6723 H2 WAT 9261 99.074 143.287 156.815 1.00 0.00 H TER 6725 WAT 9261 ATOM 6725 O WAT 9262 27.420 19.558 108.915 1.00 0.00 O ATOM 6726 H1 WAT 9262 26.953 19.210 108.156 1.00 0.00 H ATOM 6727 H2 WAT 9262 28.186 19.996 108.545 1.00 0.00 H TER 6729 WAT 9262 ATOM 6729 O WAT 9263 116.738 12.127 14.288 1.00 0.00 O ATOM 6730 H1 WAT 9263 116.043 12.785 14.322 1.00 0.00 H ATOM 6731 H2 WAT 9263 116.548 11.618 13.499 1.00 0.00 H TER 6733 WAT 9263 ATOM 6733 O WAT 9264 40.198 18.095 68.730 1.00 0.00 O ATOM 6734 H1 WAT 9264 39.561 17.476 69.089 1.00 0.00 H ATOM 6735 H2 WAT 9264 40.537 17.662 67.947 1.00 0.00 H TER 6737 WAT 9264 ATOM 6737 O WAT 9265 86.876 138.273 124.344 1.00 0.00 O ATOM 6738 H1 WAT 9265 87.824 138.340 124.453 1.00 0.00 H ATOM 6739 H2 WAT 9265 86.666 137.378 124.613 1.00 0.00 H TER 6741 WAT 9265 ATOM 6741 O WAT 9266 116.313 111.566 135.511 1.00 0.00 O ATOM 6742 H1 WAT 9266 115.587 111.878 136.051 1.00 0.00 H ATOM 6743 H2 WAT 9266 117.075 112.049 135.831 1.00 0.00 H TER 6745 WAT 9266 ATOM 6745 O WAT 9267 110.691 4.819 71.546 1.00 0.00 O ATOM 6746 H1 WAT 9267 109.929 4.885 70.971 1.00 0.00 H ATOM 6747 H2 WAT 9267 111.442 4.867 70.954 1.00 0.00 H TER 6749 WAT 9267 ATOM 6749 O WAT 9268 40.977 141.903 72.469 1.00 0.00 O ATOM 6750 H1 WAT 9268 40.541 142.216 71.677 1.00 0.00 H ATOM 6751 H2 WAT 9268 41.365 142.688 72.856 1.00 0.00 H TER 6753 WAT 9268 ATOM 6753 O WAT 9269 96.017 14.830 104.734 1.00 0.00 O ATOM 6754 H1 WAT 9269 96.659 15.044 105.412 1.00 0.00 H ATOM 6755 H2 WAT 9269 96.390 14.074 104.282 1.00 0.00 H TER 6757 WAT 9269 ATOM 6757 O WAT 9270 42.923 88.764 155.512 1.00 0.00 O ATOM 6758 H1 WAT 9270 43.135 88.364 156.356 1.00 0.00 H ATOM 6759 H2 WAT 9270 42.410 88.099 155.054 1.00 0.00 H TER 6761 WAT 9270 ATOM 6761 O WAT 9271 10.448 72.724 152.020 1.00 0.00 O ATOM 6762 H1 WAT 9271 10.269 72.290 152.854 1.00 0.00 H ATOM 6763 H2 WAT 9271 10.071 73.598 152.119 1.00 0.00 H TER 6765 WAT 9271 ATOM 6765 O WAT 9272 120.142 97.985 74.307 1.00 0.00 O ATOM 6766 H1 WAT 9272 120.620 98.182 73.501 1.00 0.00 H ATOM 6767 H2 WAT 9272 119.765 97.118 74.156 1.00 0.00 H TER 6769 WAT 9272 ATOM 6769 O WAT 9273 120.629 22.654 123.088 1.00 0.00 O ATOM 6770 H1 WAT 9273 121.359 22.863 123.672 1.00 0.00 H ATOM 6771 H2 WAT 9273 120.723 23.268 122.359 1.00 0.00 H TER 6773 WAT 9273 ATOM 6773 O WAT 9274 136.736 132.106 146.304 1.00 0.00 O ATOM 6774 H1 WAT 9274 136.909 132.765 145.631 1.00 0.00 H ATOM 6775 H2 WAT 9274 136.079 132.510 146.871 1.00 0.00 H TER 6777 WAT 9274 ATOM 6777 O WAT 9275 101.246 61.973 11.145 1.00 0.00 O ATOM 6778 H1 WAT 9275 101.695 61.128 11.172 1.00 0.00 H ATOM 6779 H2 WAT 9275 101.951 62.615 11.056 1.00 0.00 H TER 6781 WAT 9275 ATOM 6781 O WAT 9276 10.213 126.522 124.156 1.00 0.00 O ATOM 6782 H1 WAT 9276 9.314 126.479 123.830 1.00 0.00 H ATOM 6783 H2 WAT 9276 10.755 126.380 123.381 1.00 0.00 H TER 6785 WAT 9276 ATOM 6785 O WAT 9277 71.339 95.237 81.524 1.00 0.00 O ATOM 6786 H1 WAT 9277 71.147 94.545 82.156 1.00 0.00 H ATOM 6787 H2 WAT 9277 70.562 95.795 81.535 1.00 0.00 H TER 6789 WAT 9277 ATOM 6789 O WAT 9278 66.627 88.047 116.790 1.00 0.00 O ATOM 6790 H1 WAT 9278 66.526 88.076 115.839 1.00 0.00 H ATOM 6791 H2 WAT 9278 67.479 88.450 116.953 1.00 0.00 H TER 6793 WAT 9278 ATOM 6793 O WAT 9279 129.742 119.229 11.616 1.00 0.00 O ATOM 6794 H1 WAT 9279 129.428 118.362 11.876 1.00 0.00 H ATOM 6795 H2 WAT 9279 129.264 119.836 12.181 1.00 0.00 H TER 6797 WAT 9279 ATOM 6797 O WAT 9280 19.356 19.317 83.702 1.00 0.00 O ATOM 6798 H1 WAT 9280 18.554 19.050 84.151 1.00 0.00 H ATOM 6799 H2 WAT 9280 19.961 18.589 83.840 1.00 0.00 H TER 6801 WAT 9280 ATOM 6801 O WAT 9281 121.424 110.137 83.267 1.00 0.00 O ATOM 6802 H1 WAT 9281 121.581 109.219 83.487 1.00 0.00 H ATOM 6803 H2 WAT 9281 121.791 110.626 84.004 1.00 0.00 H TER 6805 WAT 9281 ATOM 6805 O WAT 9282 127.328 125.974 99.234 1.00 0.00 O ATOM 6806 H1 WAT 9282 127.770 125.176 98.942 1.00 0.00 H ATOM 6807 H2 WAT 9282 126.501 125.667 99.606 1.00 0.00 H TER 6809 WAT 9282 ATOM 6809 O WAT 9283 108.614 117.221 136.422 1.00 0.00 O ATOM 6810 H1 WAT 9283 108.935 117.592 137.244 1.00 0.00 H ATOM 6811 H2 WAT 9283 107.790 117.678 136.258 1.00 0.00 H TER 6813 WAT 9283 ATOM 6813 O WAT 9284 113.112 144.489 155.132 1.00 0.00 O ATOM 6814 H1 WAT 9284 112.729 145.114 155.748 1.00 0.00 H ATOM 6815 H2 WAT 9284 112.513 143.742 155.145 1.00 0.00 H TER 6817 WAT 9284 ATOM 6817 O WAT 9285 1.712 0.867 87.304 1.00 0.00 O ATOM 6818 H1 WAT 9285 2.497 1.375 87.512 1.00 0.00 H ATOM 6819 H2 WAT 9285 0.985 1.434 87.560 1.00 0.00 H TER 6821 WAT 9285 ATOM 6821 O WAT 9286 111.263 41.607 137.110 1.00 0.00 O ATOM 6822 H1 WAT 9286 110.804 41.591 137.949 1.00 0.00 H ATOM 6823 H2 WAT 9286 112.070 41.117 137.269 1.00 0.00 H TER 6825 WAT 9286 ATOM 6825 O WAT 9287 104.822 58.119 143.136 1.00 0.00 O ATOM 6826 H1 WAT 9287 104.677 59.001 143.477 1.00 0.00 H ATOM 6827 H2 WAT 9287 105.198 58.257 142.266 1.00 0.00 H TER 6829 WAT 9287 ATOM 6829 O WAT 9288 17.125 143.522 146.231 1.00 0.00 O ATOM 6830 H1 WAT 9288 17.256 144.095 146.987 1.00 0.00 H ATOM 6831 H2 WAT 9288 17.947 143.575 145.744 1.00 0.00 H TER 6833 WAT 9288 ATOM 6833 O WAT 9289 15.753 80.230 95.159 1.00 0.00 O ATOM 6834 H1 WAT 9289 16.364 80.736 95.695 1.00 0.00 H ATOM 6835 H2 WAT 9289 15.288 79.674 95.785 1.00 0.00 H TER 6837 WAT 9289 ATOM 6837 O WAT 9290 66.476 5.259 0.876 1.00 0.00 O ATOM 6838 H1 WAT 9290 66.071 5.825 0.218 1.00 0.00 H ATOM 6839 H2 WAT 9290 67.336 5.047 0.514 1.00 0.00 H TER 6841 WAT 9290 ATOM 6841 O WAT 9291 -0.202 20.894 85.465 1.00 0.00 O ATOM 6842 H1 WAT 9291 0.672 21.220 85.683 1.00 0.00 H ATOM 6843 H2 WAT 9291 -0.353 20.181 86.086 1.00 0.00 H TER 6845 WAT 9291 ATOM 6845 O WAT 9292 131.851 2.758 86.759 1.00 0.00 O ATOM 6846 H1 WAT 9292 131.638 2.109 86.088 1.00 0.00 H ATOM 6847 H2 WAT 9292 131.606 3.596 86.368 1.00 0.00 H TER 6849 WAT 9292 ATOM 6849 O WAT 9293 75.429 48.656 75.346 1.00 0.00 O ATOM 6850 H1 WAT 9293 75.334 47.706 75.284 1.00 0.00 H ATOM 6851 H2 WAT 9293 75.687 48.929 74.466 1.00 0.00 H TER 6853 WAT 9293 ATOM 6853 O WAT 9294 87.171 52.581 64.965 1.00 0.00 O ATOM 6854 H1 WAT 9294 86.595 52.984 65.615 1.00 0.00 H ATOM 6855 H2 WAT 9294 86.581 52.086 64.396 1.00 0.00 H TER 6857 WAT 9294 ATOM 6857 O WAT 9295 51.854 34.585 17.974 1.00 0.00 O ATOM 6858 H1 WAT 9295 52.166 33.690 17.846 1.00 0.00 H ATOM 6859 H2 WAT 9295 52.603 35.049 18.350 1.00 0.00 H TER 6861 WAT 9295 ATOM 6861 O WAT 9296 1.750 8.632 136.007 1.00 0.00 O ATOM 6862 H1 WAT 9296 1.020 9.096 136.417 1.00 0.00 H ATOM 6863 H2 WAT 9296 2.529 8.989 136.433 1.00 0.00 H TER 6865 WAT 9296 ATOM 6865 O WAT 9297 3.691 102.754 28.170 1.00 0.00 O ATOM 6866 H1 WAT 9297 4.563 102.423 28.386 1.00 0.00 H ATOM 6867 H2 WAT 9297 3.855 103.543 27.654 1.00 0.00 H TER 6869 WAT 9297 ATOM 6869 O WAT 9298 0.863 0.561 157.692 1.00 0.00 O ATOM 6870 H1 WAT 9298 0.017 1.002 157.616 1.00 0.00 H ATOM 6871 H2 WAT 9298 0.846 0.160 158.561 1.00 0.00 H TER 6873 WAT 9298 ATOM 6873 O WAT 9299 126.797 91.452 69.127 1.00 0.00 O ATOM 6874 H1 WAT 9299 126.405 91.804 69.927 1.00 0.00 H ATOM 6875 H2 WAT 9299 127.498 90.879 69.437 1.00 0.00 H TER 6877 WAT 9299 ATOM 6877 O WAT 9300 60.314 100.899 119.011 1.00 0.00 O ATOM 6878 H1 WAT 9300 59.824 100.124 118.735 1.00 0.00 H ATOM 6879 H2 WAT 9300 60.060 101.578 118.386 1.00 0.00 H TER 6881 WAT 9300 ATOM 6881 O WAT 9301 26.573 50.204 124.807 1.00 0.00 O ATOM 6882 H1 WAT 9301 27.412 50.123 124.353 1.00 0.00 H ATOM 6883 H2 WAT 9301 26.672 50.982 125.356 1.00 0.00 H TER 6885 WAT 9301 ATOM 6885 O WAT 9302 0.603 123.583 101.394 1.00 0.00 O ATOM 6886 H1 WAT 9302 1.529 123.791 101.269 1.00 0.00 H ATOM 6887 H2 WAT 9302 0.355 123.108 100.601 1.00 0.00 H TER 6889 WAT 9302 ATOM 6889 O WAT 9303 30.840 22.467 130.533 1.00 0.00 O ATOM 6890 H1 WAT 9303 31.399 22.040 131.183 1.00 0.00 H ATOM 6891 H2 WAT 9303 30.696 21.798 129.864 1.00 0.00 H TER 6893 WAT 9303 ATOM 6893 O WAT 9304 77.990 113.189 82.925 1.00 0.00 O ATOM 6894 H1 WAT 9304 78.645 113.683 82.433 1.00 0.00 H ATOM 6895 H2 WAT 9304 77.546 112.656 82.265 1.00 0.00 H TER 6897 WAT 9304 ATOM 6897 O WAT 9305 116.505 132.082 152.368 1.00 0.00 O ATOM 6898 H1 WAT 9305 117.132 131.636 152.938 1.00 0.00 H ATOM 6899 H2 WAT 9305 116.772 131.837 151.482 1.00 0.00 H TER 6901 WAT 9305 ATOM 6901 O WAT 9306 106.735 114.806 127.122 1.00 0.00 O ATOM 6902 H1 WAT 9306 107.079 115.566 126.652 1.00 0.00 H ATOM 6903 H2 WAT 9306 106.147 115.177 127.780 1.00 0.00 H TER 6905 WAT 9306 ATOM 6905 O WAT 9307 49.668 123.906 9.817 1.00 0.00 O ATOM 6906 H1 WAT 9307 49.767 123.052 9.395 1.00 0.00 H ATOM 6907 H2 WAT 9307 48.907 123.804 10.389 1.00 0.00 H TER 6909 WAT 9307 ATOM 6909 O WAT 9308 132.593 95.857 80.631 1.00 0.00 O ATOM 6910 H1 WAT 9308 132.080 95.478 79.918 1.00 0.00 H ATOM 6911 H2 WAT 9308 132.821 95.111 81.186 1.00 0.00 H TER 6913 WAT 9308 ATOM 6913 O WAT 9309 131.522 141.096 142.345 1.00 0.00 O ATOM 6914 H1 WAT 9309 132.409 140.986 142.004 1.00 0.00 H ATOM 6915 H2 WAT 9309 131.379 142.042 142.342 1.00 0.00 H TER 6917 WAT 9309 ATOM 6917 O WAT 9310 40.973 115.438 92.111 1.00 0.00 O ATOM 6918 H1 WAT 9310 41.370 115.040 91.336 1.00 0.00 H ATOM 6919 H2 WAT 9310 40.610 114.700 92.600 1.00 0.00 H TER 6921 WAT 9310 ATOM 6921 O WAT 9311 16.250 83.242 21.835 1.00 0.00 O ATOM 6922 H1 WAT 9311 16.977 83.856 21.724 1.00 0.00 H ATOM 6923 H2 WAT 9311 15.486 83.800 21.982 1.00 0.00 H TER 6925 WAT 9311 ATOM 6925 O WAT 9312 106.639 28.271 11.412 1.00 0.00 O ATOM 6926 H1 WAT 9312 106.149 28.351 12.231 1.00 0.00 H ATOM 6927 H2 WAT 9312 105.994 28.452 10.728 1.00 0.00 H TER 6929 WAT 9312 ATOM 6929 O WAT 9313 121.984 28.252 87.817 1.00 0.00 O ATOM 6930 H1 WAT 9313 121.431 28.357 87.043 1.00 0.00 H ATOM 6931 H2 WAT 9313 122.569 27.528 87.597 1.00 0.00 H TER 6933 WAT 9313 ATOM 6933 O WAT 9314 5.711 142.293 7.716 1.00 0.00 O ATOM 6934 H1 WAT 9314 6.405 142.938 7.579 1.00 0.00 H ATOM 6935 H2 WAT 9314 5.805 141.681 6.986 1.00 0.00 H TER 6937 WAT 9314 ATOM 6937 O WAT 9315 24.550 12.578 141.575 1.00 0.00 O ATOM 6938 H1 WAT 9315 24.980 12.143 142.312 1.00 0.00 H ATOM 6939 H2 WAT 9315 24.131 13.347 141.962 1.00 0.00 H TER 6941 WAT 9315 ATOM 6941 O WAT 9316 95.306 116.724 146.767 1.00 0.00 O ATOM 6942 H1 WAT 9316 96.215 116.710 147.068 1.00 0.00 H ATOM 6943 H2 WAT 9316 95.061 117.649 146.788 1.00 0.00 H TER 6945 WAT 9316 ATOM 6945 O WAT 9317 45.631 77.444 94.435 1.00 0.00 O ATOM 6946 H1 WAT 9317 44.924 76.808 94.543 1.00 0.00 H ATOM 6947 H2 WAT 9317 46.336 76.951 94.016 1.00 0.00 H TER 6949 WAT 9317 ATOM 6949 O WAT 9318 30.670 89.266 13.051 1.00 0.00 O ATOM 6950 H1 WAT 9318 31.447 89.781 12.831 1.00 0.00 H ATOM 6951 H2 WAT 9318 30.084 89.888 13.481 1.00 0.00 H TER 6953 WAT 9318 ATOM 6953 O WAT 9319 110.079 105.070 98.573 1.00 0.00 O ATOM 6954 H1 WAT 9319 110.549 105.454 97.833 1.00 0.00 H ATOM 6955 H2 WAT 9319 109.265 105.571 98.625 1.00 0.00 H TER 6957 WAT 9319 ATOM 6957 O WAT 9320 2.632 26.810 65.001 1.00 0.00 O ATOM 6958 H1 WAT 9320 2.336 26.634 64.107 1.00 0.00 H ATOM 6959 H2 WAT 9320 3.200 26.071 65.216 1.00 0.00 H TER 6961 WAT 9320 ATOM 6961 O WAT 9321 123.367 11.718 70.668 1.00 0.00 O ATOM 6962 H1 WAT 9321 123.993 11.048 70.941 1.00 0.00 H ATOM 6963 H2 WAT 9321 122.631 11.619 71.271 1.00 0.00 H TER 6965 WAT 9321 ATOM 6965 O WAT 9322 49.555 4.925 88.183 1.00 0.00 O ATOM 6966 H1 WAT 9322 48.787 4.585 88.641 1.00 0.00 H ATOM 6967 H2 WAT 9322 49.205 5.584 87.584 1.00 0.00 H TER 6969 WAT 9322 ATOM 6969 O WAT 9323 21.068 59.831 148.554 1.00 0.00 O ATOM 6970 H1 WAT 9323 20.495 60.151 147.857 1.00 0.00 H ATOM 6971 H2 WAT 9323 20.503 59.782 149.325 1.00 0.00 H TER 6973 WAT 9323 ATOM 6973 O WAT 9324 106.232 62.517 107.849 1.00 0.00 O ATOM 6974 H1 WAT 9324 105.620 63.223 107.642 1.00 0.00 H ATOM 6975 H2 WAT 9324 106.511 62.697 108.747 1.00 0.00 H TER 6977 WAT 9324 ATOM 6977 O WAT 9325 99.850 79.649 113.630 1.00 0.00 O ATOM 6978 H1 WAT 9325 100.731 79.543 113.989 1.00 0.00 H ATOM 6979 H2 WAT 9325 99.873 79.179 112.797 1.00 0.00 H TER 6981 WAT 9325 ATOM 6981 O WAT 9326 23.668 5.093 151.827 1.00 0.00 O ATOM 6982 H1 WAT 9326 23.826 4.934 150.896 1.00 0.00 H ATOM 6983 H2 WAT 9326 24.215 4.448 152.276 1.00 0.00 H TER 6985 WAT 9326 ATOM 6985 O WAT 9327 55.334 107.311 114.405 1.00 0.00 O ATOM 6986 H1 WAT 9327 54.431 107.538 114.628 1.00 0.00 H ATOM 6987 H2 WAT 9327 55.291 107.028 113.492 1.00 0.00 H TER 6989 WAT 9327 ATOM 6989 O WAT 9328 115.615 52.794 73.254 1.00 0.00 O ATOM 6990 H1 WAT 9328 116.427 52.502 72.841 1.00 0.00 H ATOM 6991 H2 WAT 9328 115.398 52.097 73.874 1.00 0.00 H TER 6993 WAT 9328 ATOM 6993 O WAT 9329 87.689 107.303 113.658 1.00 0.00 O ATOM 6994 H1 WAT 9329 88.190 107.982 113.205 1.00 0.00 H ATOM 6995 H2 WAT 9329 87.862 107.458 114.587 1.00 0.00 H TER 6997 WAT 9329 ATOM 6997 O WAT 9330 53.316 85.499 92.614 1.00 0.00 O ATOM 6998 H1 WAT 9330 52.664 85.160 92.000 1.00 0.00 H ATOM 6999 H2 WAT 9330 53.042 85.159 93.466 1.00 0.00 H TER 7001 WAT 9330 ATOM 7001 O WAT 9331 21.587 51.879 69.488 1.00 0.00 O ATOM 7002 H1 WAT 9331 21.365 51.209 68.841 1.00 0.00 H ATOM 7003 H2 WAT 9331 22.448 51.619 69.815 1.00 0.00 H TER 7005 WAT 9331 ATOM 7005 O WAT 9332 44.976 106.013 137.197 1.00 0.00 O ATOM 7006 H1 WAT 9332 45.777 105.777 136.728 1.00 0.00 H ATOM 7007 H2 WAT 9332 45.284 106.397 138.018 1.00 0.00 H TER 7009 WAT 9332 ATOM 7009 O WAT 9333 112.717 115.310 132.714 1.00 0.00 O ATOM 7010 H1 WAT 9333 111.972 115.849 132.449 1.00 0.00 H ATOM 7011 H2 WAT 9333 113.365 115.938 133.034 1.00 0.00 H TER 7013 WAT 9333 ATOM 7013 O WAT 9334 53.647 63.905 93.881 1.00 0.00 O ATOM 7014 H1 WAT 9334 53.968 63.827 94.780 1.00 0.00 H ATOM 7015 H2 WAT 9334 54.418 63.742 93.337 1.00 0.00 H TER 7017 WAT 9334 ATOM 7017 O WAT 9335 76.146 36.502 4.204 1.00 0.00 O ATOM 7018 H1 WAT 9335 76.869 36.783 4.764 1.00 0.00 H ATOM 7019 H2 WAT 9335 75.840 37.306 3.786 1.00 0.00 H TER 7021 WAT 9335 ATOM 7021 O WAT 9336 54.624 16.558 151.358 1.00 0.00 O ATOM 7022 H1 WAT 9336 54.357 16.052 152.126 1.00 0.00 H ATOM 7023 H2 WAT 9336 54.636 17.466 151.661 1.00 0.00 H TER 7025 WAT 9336 ATOM 7025 O WAT 9337 28.852 11.036 64.946 1.00 0.00 O ATOM 7026 H1 WAT 9337 28.792 11.989 65.018 1.00 0.00 H ATOM 7027 H2 WAT 9337 27.950 10.731 65.047 1.00 0.00 H TER 7029 WAT 9337 ATOM 7029 O WAT 9338 58.427 54.902 149.948 1.00 0.00 O ATOM 7030 H1 WAT 9338 58.568 54.381 150.738 1.00 0.00 H ATOM 7031 H2 WAT 9338 59.135 55.546 149.956 1.00 0.00 H TER 7033 WAT 9338 ATOM 7033 O WAT 9339 89.739 24.715 93.084 1.00 0.00 O ATOM 7034 H1 WAT 9339 90.163 25.538 93.327 1.00 0.00 H ATOM 7035 H2 WAT 9339 88.969 24.666 93.651 1.00 0.00 H TER 7037 WAT 9339 ATOM 7037 O WAT 9340 137.645 56.871 16.601 1.00 0.00 O ATOM 7038 H1 WAT 9340 138.263 57.587 16.742 1.00 0.00 H ATOM 7039 H2 WAT 9340 138.193 56.088 16.544 1.00 0.00 H TER 7041 WAT 9340 ATOM 7041 O WAT 9341 103.090 23.743 146.142 1.00 0.00 O ATOM 7042 H1 WAT 9341 102.752 24.634 146.054 1.00 0.00 H ATOM 7043 H2 WAT 9341 103.768 23.676 145.470 1.00 0.00 H TER 7045 WAT 9341 ATOM 7045 O WAT 9342 11.267 78.152 61.877 1.00 0.00 O ATOM 7046 H1 WAT 9342 10.762 77.545 61.336 1.00 0.00 H ATOM 7047 H2 WAT 9342 11.910 78.531 61.277 1.00 0.00 H TER 7049 WAT 9342 ATOM 7049 O WAT 9343 129.189 94.784 100.402 1.00 0.00 O ATOM 7050 H1 WAT 9343 129.911 94.335 99.961 1.00 0.00 H ATOM 7051 H2 WAT 9343 129.179 94.412 101.284 1.00 0.00 H TER 7053 WAT 9343 ATOM 7053 O WAT 9344 125.419 122.648 79.604 1.00 0.00 O ATOM 7054 H1 WAT 9344 124.685 122.675 78.991 1.00 0.00 H ATOM 7055 H2 WAT 9344 125.177 121.973 80.238 1.00 0.00 H TER 7057 WAT 9344 ATOM 7057 O WAT 9345 90.868 136.150 71.108 1.00 0.00 O ATOM 7058 H1 WAT 9345 91.153 137.023 71.379 1.00 0.00 H ATOM 7059 H2 WAT 9345 90.781 135.662 71.926 1.00 0.00 H TER 7061 WAT 9345 ATOM 7061 O WAT 9346 80.714 38.133 115.250 1.00 0.00 O ATOM 7062 H1 WAT 9346 80.964 37.433 114.647 1.00 0.00 H ATOM 7063 H2 WAT 9346 81.459 38.213 115.846 1.00 0.00 H TER 7065 WAT 9346 ATOM 7065 O WAT 9347 15.245 99.982 68.562 1.00 0.00 O ATOM 7066 H1 WAT 9347 14.341 100.007 68.876 1.00 0.00 H ATOM 7067 H2 WAT 9347 15.673 99.327 69.114 1.00 0.00 H TER 7069 WAT 9347 ATOM 7069 O WAT 9348 115.190 88.369 65.269 1.00 0.00 O ATOM 7070 H1 WAT 9348 114.746 88.799 64.537 1.00 0.00 H ATOM 7071 H2 WAT 9348 115.661 89.076 65.711 1.00 0.00 H TER 7073 WAT 9348 ATOM 7073 O WAT 9349 60.869 105.515 70.556 1.00 0.00 O ATOM 7074 H1 WAT 9349 60.280 106.219 70.828 1.00 0.00 H ATOM 7075 H2 WAT 9349 61.639 105.967 70.213 1.00 0.00 H TER 7077 WAT 9349 ATOM 7077 O WAT 9350 138.522 9.260 152.608 1.00 0.00 O ATOM 7078 H1 WAT 9350 137.642 9.610 152.744 1.00 0.00 H ATOM 7079 H2 WAT 9350 138.382 8.340 152.385 1.00 0.00 H TER 7081 WAT 9350 ATOM 7081 O WAT 9351 77.853 103.360 6.448 1.00 0.00 O ATOM 7082 H1 WAT 9351 78.684 103.206 6.000 1.00 0.00 H ATOM 7083 H2 WAT 9351 78.087 103.420 7.374 1.00 0.00 H TER 7085 WAT 9351 ATOM 7085 O WAT 9352 94.396 94.559 1.784 1.00 0.00 O ATOM 7086 H1 WAT 9352 94.116 95.402 2.140 1.00 0.00 H ATOM 7087 H2 WAT 9352 95.213 94.364 2.244 1.00 0.00 H TER 7089 WAT 9352 ATOM 7089 O WAT 9353 58.146 116.799 158.013 1.00 0.00 O ATOM 7090 H1 WAT 9353 58.854 117.197 157.506 1.00 0.00 H ATOM 7091 H2 WAT 9353 57.347 117.172 157.642 1.00 0.00 H TER 7093 WAT 9353 ATOM 7093 O WAT 9354 41.386 77.960 118.075 1.00 0.00 O ATOM 7094 H1 WAT 9354 41.951 77.357 117.591 1.00 0.00 H ATOM 7095 H2 WAT 9354 41.928 78.737 118.212 1.00 0.00 H TER 7097 WAT 9354 ATOM 7097 O WAT 9355 124.468 99.520 109.562 1.00 0.00 O ATOM 7098 H1 WAT 9355 124.704 98.593 109.587 1.00 0.00 H ATOM 7099 H2 WAT 9355 125.247 99.974 109.885 1.00 0.00 H TER 7101 WAT 9355 ATOM 7101 O WAT 9356 30.178 74.571 12.064 1.00 0.00 O ATOM 7102 H1 WAT 9356 30.452 73.701 12.357 1.00 0.00 H ATOM 7103 H2 WAT 9356 29.290 74.442 11.732 1.00 0.00 H TER 7105 WAT 9356 ATOM 7105 O WAT 9357 37.246 52.794 96.895 1.00 0.00 O ATOM 7106 H1 WAT 9357 36.568 53.341 96.498 1.00 0.00 H ATOM 7107 H2 WAT 9357 37.953 52.783 96.249 1.00 0.00 H TER 7109 WAT 9357 ATOM 7109 O WAT 9358 70.225 26.876 99.951 1.00 0.00 O ATOM 7110 H1 WAT 9358 69.391 26.475 99.706 1.00 0.00 H ATOM 7111 H2 WAT 9358 70.657 26.217 100.493 1.00 0.00 H TER 7113 WAT 9358 ATOM 7113 O WAT 9359 2.149 64.557 150.378 1.00 0.00 O ATOM 7114 H1 WAT 9359 3.063 64.789 150.541 1.00 0.00 H ATOM 7115 H2 WAT 9359 1.747 64.541 151.247 1.00 0.00 H TER 7117 WAT 9359 ATOM 7117 O WAT 9360 139.391 95.680 80.701 1.00 0.00 O ATOM 7118 H1 WAT 9360 138.631 96.055 81.146 1.00 0.00 H ATOM 7119 H2 WAT 9360 139.882 95.240 81.395 1.00 0.00 H TER 7121 WAT 9360 ATOM 7121 O WAT 9361 35.690 68.707 75.715 1.00 0.00 O ATOM 7122 H1 WAT 9361 36.173 69.518 75.875 1.00 0.00 H ATOM 7123 H2 WAT 9361 35.390 68.431 76.581 1.00 0.00 H TER 7125 WAT 9361 ATOM 7125 O WAT 9362 95.397 0.667 118.672 1.00 0.00 O ATOM 7126 H1 WAT 9362 96.173 0.642 118.112 1.00 0.00 H ATOM 7127 H2 WAT 9362 95.717 1.001 119.510 1.00 0.00 H TER 7129 WAT 9362 ATOM 7129 O WAT 9363 122.685 12.811 152.217 1.00 0.00 O ATOM 7130 H1 WAT 9363 123.300 13.539 152.131 1.00 0.00 H ATOM 7131 H2 WAT 9363 123.164 12.052 151.885 1.00 0.00 H TER 7133 WAT 9363 ATOM 7133 O WAT 9364 49.669 60.524 25.219 1.00 0.00 O ATOM 7134 H1 WAT 9364 49.947 60.070 26.014 1.00 0.00 H ATOM 7135 H2 WAT 9364 49.980 61.422 25.335 1.00 0.00 H TER 7137 WAT 9364 ATOM 7137 O WAT 9365 38.944 11.098 141.639 1.00 0.00 O ATOM 7138 H1 WAT 9365 39.832 11.163 141.289 1.00 0.00 H ATOM 7139 H2 WAT 9365 38.832 10.168 141.837 1.00 0.00 H TER 7141 WAT 9365 ATOM 7141 O WAT 9366 145.073 17.044 106.056 1.00 0.00 O ATOM 7142 H1 WAT 9366 144.127 17.179 106.119 1.00 0.00 H ATOM 7143 H2 WAT 9366 145.169 16.115 105.847 1.00 0.00 H TER 7145 WAT 9366 ATOM 7145 O WAT 9367 47.135 6.945 148.878 1.00 0.00 O ATOM 7146 H1 WAT 9367 46.982 6.021 149.076 1.00 0.00 H ATOM 7147 H2 WAT 9367 46.678 7.091 148.049 1.00 0.00 H TER 7149 WAT 9367 ATOM 7149 O WAT 9368 67.120 97.618 122.808 1.00 0.00 O ATOM 7150 H1 WAT 9368 66.819 97.954 123.652 1.00 0.00 H ATOM 7151 H2 WAT 9368 66.488 97.959 122.175 1.00 0.00 H TER 7153 WAT 9368 ATOM 7153 O WAT 9369 42.849 100.721 141.360 1.00 0.00 O ATOM 7154 H1 WAT 9369 42.275 100.908 140.617 1.00 0.00 H ATOM 7155 H2 WAT 9369 42.651 101.410 141.995 1.00 0.00 H TER 7157 WAT 9369 ATOM 7157 O WAT 9370 120.910 125.562 99.972 1.00 0.00 O ATOM 7158 H1 WAT 9370 121.292 124.786 99.561 1.00 0.00 H ATOM 7159 H2 WAT 9370 120.125 125.745 99.456 1.00 0.00 H TER 7161 WAT 9370 ATOM 7161 O WAT 9371 121.617 20.899 84.773 1.00 0.00 O ATOM 7162 H1 WAT 9371 121.619 20.800 85.725 1.00 0.00 H ATOM 7163 H2 WAT 9371 120.812 20.466 84.489 1.00 0.00 H TER 7165 WAT 9371 ATOM 7165 O WAT 9372 104.642 72.754 135.239 1.00 0.00 O ATOM 7166 H1 WAT 9372 104.425 73.646 135.512 1.00 0.00 H ATOM 7167 H2 WAT 9372 103.794 72.338 135.085 1.00 0.00 H TER 7169 WAT 9372 ATOM 7169 O WAT 9373 32.112 31.685 117.421 1.00 0.00 O ATOM 7170 H1 WAT 9373 31.553 32.393 117.742 1.00 0.00 H ATOM 7171 H2 WAT 9373 32.324 31.936 116.522 1.00 0.00 H TER 7173 WAT 9373 ATOM 7173 O WAT 9374 91.283 113.960 130.334 1.00 0.00 O ATOM 7174 H1 WAT 9374 91.100 113.620 131.210 1.00 0.00 H ATOM 7175 H2 WAT 9374 90.600 113.580 129.782 1.00 0.00 H TER 7177 WAT 9374 ATOM 7177 O WAT 9375 94.715 36.304 11.983 1.00 0.00 O ATOM 7178 H1 WAT 9375 93.895 36.245 11.492 1.00 0.00 H ATOM 7179 H2 WAT 9375 94.886 37.244 12.051 1.00 0.00 H TER 7181 WAT 9375 ATOM 7181 O WAT 9376 4.411 63.685 64.686 1.00 0.00 O ATOM 7182 H1 WAT 9376 3.815 64.033 65.349 1.00 0.00 H ATOM 7183 H2 WAT 9376 4.439 64.362 64.010 1.00 0.00 H TER 7185 WAT 9376 ATOM 7185 O WAT 9377 75.988 46.125 139.742 1.00 0.00 O ATOM 7186 H1 WAT 9377 76.619 45.985 140.448 1.00 0.00 H ATOM 7187 H2 WAT 9377 75.581 46.967 139.948 1.00 0.00 H TER 7189 WAT 9377 ATOM 7189 O WAT 9378 134.539 132.366 66.195 1.00 0.00 O ATOM 7190 H1 WAT 9378 133.783 132.127 65.659 1.00 0.00 H ATOM 7191 H2 WAT 9378 134.993 131.538 66.352 1.00 0.00 H TER 7193 WAT 9378 ATOM 7193 O WAT 9379 125.687 23.567 77.471 1.00 0.00 O ATOM 7194 H1 WAT 9379 125.307 24.428 77.644 1.00 0.00 H ATOM 7195 H2 WAT 9379 125.291 22.993 78.127 1.00 0.00 H TER 7197 WAT 9379 ATOM 7197 O WAT 9380 57.458 125.378 103.741 1.00 0.00 O ATOM 7198 H1 WAT 9380 58.332 125.018 103.588 1.00 0.00 H ATOM 7199 H2 WAT 9380 57.180 125.703 102.885 1.00 0.00 H TER 7201 WAT 9380 ATOM 7201 O WAT 9381 138.497 43.962 16.662 1.00 0.00 O ATOM 7202 H1 WAT 9381 139.052 44.739 16.730 1.00 0.00 H ATOM 7203 H2 WAT 9381 138.820 43.376 17.346 1.00 0.00 H TER 7205 WAT 9381 ATOM 7205 O WAT 9382 77.307 83.137 2.557 1.00 0.00 O ATOM 7206 H1 WAT 9382 77.549 83.946 2.105 1.00 0.00 H ATOM 7207 H2 WAT 9382 76.484 83.346 2.998 1.00 0.00 H TER 7209 WAT 9382 ATOM 7209 O WAT 9383 102.203 42.856 103.512 1.00 0.00 O ATOM 7210 H1 WAT 9383 101.269 42.677 103.401 1.00 0.00 H ATOM 7211 H2 WAT 9383 102.439 42.401 104.320 1.00 0.00 H TER 7213 WAT 9383 ATOM 7213 O WAT 9384 43.659 72.649 1.843 1.00 0.00 O ATOM 7214 H1 WAT 9384 42.914 72.601 1.245 1.00 0.00 H ATOM 7215 H2 WAT 9384 43.452 72.021 2.535 1.00 0.00 H TER 7217 WAT 9384 ATOM 7217 O WAT 9385 142.429 9.435 85.418 1.00 0.00 O ATOM 7218 H1 WAT 9385 143.357 9.671 85.428 1.00 0.00 H ATOM 7219 H2 WAT 9385 142.197 9.415 84.490 1.00 0.00 H TER 7221 WAT 9385 ATOM 7221 O WAT 9386 63.158 92.471 152.580 1.00 0.00 O ATOM 7222 H1 WAT 9386 62.818 93.161 152.011 1.00 0.00 H ATOM 7223 H2 WAT 9386 63.805 92.014 152.043 1.00 0.00 H TER 7225 WAT 9386 ATOM 7225 O WAT 9387 141.425 1.356 149.837 1.00 0.00 O ATOM 7226 H1 WAT 9387 142.049 1.452 150.557 1.00 0.00 H ATOM 7227 H2 WAT 9387 141.970 1.298 149.053 1.00 0.00 H TER 7229 WAT 9387 ATOM 7229 O WAT 9388 115.525 93.212 16.946 1.00 0.00 O ATOM 7230 H1 WAT 9388 115.284 92.289 17.026 1.00 0.00 H ATOM 7231 H2 WAT 9388 116.409 93.261 17.310 1.00 0.00 H TER 7233 WAT 9388 ATOM 7233 O WAT 9389 98.112 43.018 98.577 1.00 0.00 O ATOM 7234 H1 WAT 9389 98.017 43.840 98.095 1.00 0.00 H ATOM 7235 H2 WAT 9389 97.265 42.583 98.478 1.00 0.00 H TER 7237 WAT 9389 ATOM 7237 O WAT 9390 85.998 118.553 87.214 1.00 0.00 O ATOM 7238 H1 WAT 9390 85.903 117.937 86.488 1.00 0.00 H ATOM 7239 H2 WAT 9390 86.341 118.023 87.934 1.00 0.00 H TER 7241 WAT 9390 ATOM 7241 O WAT 9391 30.831 24.695 135.113 1.00 0.00 O ATOM 7242 H1 WAT 9391 30.410 24.130 135.762 1.00 0.00 H ATOM 7243 H2 WAT 9391 30.172 24.804 134.427 1.00 0.00 H TER 7245 WAT 9391 ATOM 7245 O WAT 9392 122.746 127.929 133.963 1.00 0.00 O ATOM 7246 H1 WAT 9392 122.622 128.648 134.583 1.00 0.00 H ATOM 7247 H2 WAT 9392 122.455 127.151 134.438 1.00 0.00 H TER 7249 WAT 9392 ATOM 7249 O WAT 9393 32.444 19.992 94.606 1.00 0.00 O ATOM 7250 H1 WAT 9393 33.005 20.653 94.200 1.00 0.00 H ATOM 7251 H2 WAT 9393 32.243 19.381 93.897 1.00 0.00 H TER 7253 WAT 9393 ATOM 7253 O WAT 9394 10.538 85.214 72.425 1.00 0.00 O ATOM 7254 H1 WAT 9394 10.764 85.625 71.591 1.00 0.00 H ATOM 7255 H2 WAT 9394 11.185 85.555 73.043 1.00 0.00 H TER 7257 WAT 9394 ATOM 7257 O WAT 9395 64.017 118.841 88.582 1.00 0.00 O ATOM 7258 H1 WAT 9395 63.941 118.786 87.630 1.00 0.00 H ATOM 7259 H2 WAT 9395 64.848 119.293 88.730 1.00 0.00 H TER 7261 WAT 9395 ATOM 7261 O WAT 9396 81.565 131.161 115.142 1.00 0.00 O ATOM 7262 H1 WAT 9396 81.751 130.282 114.812 1.00 0.00 H ATOM 7263 H2 WAT 9396 80.680 131.351 114.830 1.00 0.00 H TER 7265 WAT 9396 ATOM 7265 O WAT 9397 80.822 94.294 129.451 1.00 0.00 O ATOM 7266 H1 WAT 9397 80.249 93.765 130.005 1.00 0.00 H ATOM 7267 H2 WAT 9397 80.539 95.196 129.606 1.00 0.00 H TER 7269 WAT 9397 ATOM 7269 O WAT 9398 94.106 48.283 156.397 1.00 0.00 O ATOM 7270 H1 WAT 9398 93.647 47.693 156.995 1.00 0.00 H ATOM 7271 H2 WAT 9398 94.908 47.814 156.167 1.00 0.00 H TER 7273 WAT 9398 ATOM 7273 O WAT 9399 74.472 18.335 96.579 1.00 0.00 O ATOM 7274 H1 WAT 9399 75.425 18.256 96.535 1.00 0.00 H ATOM 7275 H2 WAT 9399 74.305 19.273 96.485 1.00 0.00 H TER 7277 WAT 9399 ATOM 7277 O WAT 9400 134.596 13.672 81.506 1.00 0.00 O ATOM 7278 H1 WAT 9400 134.339 13.327 80.651 1.00 0.00 H ATOM 7279 H2 WAT 9400 133.822 14.143 81.816 1.00 0.00 H TER 7281 WAT 9400 ATOM 7281 O WAT 9401 142.051 122.650 21.113 1.00 0.00 O ATOM 7282 H1 WAT 9401 142.044 121.706 21.271 1.00 0.00 H ATOM 7283 H2 WAT 9401 142.704 122.990 21.725 1.00 0.00 H TER 7285 WAT 9401 ATOM 7285 O WAT 9402 144.941 22.405 21.269 1.00 0.00 O ATOM 7286 H1 WAT 9402 145.386 21.731 21.782 1.00 0.00 H ATOM 7287 H2 WAT 9402 145.338 23.227 21.557 1.00 0.00 H TER 7289 WAT 9402 ATOM 7289 O WAT 9403 12.658 23.069 69.019 1.00 0.00 O ATOM 7290 H1 WAT 9403 11.850 22.778 69.441 1.00 0.00 H ATOM 7291 H2 WAT 9403 12.949 22.313 68.510 1.00 0.00 H TER 7293 WAT 9403 ATOM 7293 O WAT 9404 17.702 62.172 90.338 1.00 0.00 O ATOM 7294 H1 WAT 9404 17.380 62.638 91.110 1.00 0.00 H ATOM 7295 H2 WAT 9404 17.813 61.269 90.633 1.00 0.00 H TER 7297 WAT 9404 ATOM 7297 O WAT 9405 142.294 120.657 96.760 1.00 0.00 O ATOM 7298 H1 WAT 9405 142.229 120.505 95.817 1.00 0.00 H ATOM 7299 H2 WAT 9405 143.120 120.245 97.013 1.00 0.00 H TER 7301 WAT 9405 ATOM 7301 O WAT 9406 93.405 98.444 11.858 1.00 0.00 O ATOM 7302 H1 WAT 9406 92.482 98.263 11.683 1.00 0.00 H ATOM 7303 H2 WAT 9406 93.808 98.491 10.990 1.00 0.00 H TER 7305 WAT 9406 ATOM 7305 O WAT 9407 72.493 121.205 96.743 1.00 0.00 O ATOM 7306 H1 WAT 9407 71.698 120.756 97.032 1.00 0.00 H ATOM 7307 H2 WAT 9407 73.191 120.563 96.872 1.00 0.00 H TER 7309 WAT 9407 ATOM 7309 O WAT 9408 63.568 116.127 128.236 1.00 0.00 O ATOM 7310 H1 WAT 9408 64.287 115.499 128.164 1.00 0.00 H ATOM 7311 H2 WAT 9408 63.866 116.890 127.740 1.00 0.00 H TER 7313 WAT 9408 ATOM 7313 O WAT 9409 11.212 132.348 103.633 1.00 0.00 O ATOM 7314 H1 WAT 9409 11.527 131.917 102.839 1.00 0.00 H ATOM 7315 H2 WAT 9409 11.258 133.283 103.433 1.00 0.00 H TER 7317 WAT 9409 ATOM 7317 O WAT 9410 51.017 25.759 149.761 1.00 0.00 O ATOM 7318 H1 WAT 9410 50.393 26.481 149.839 1.00 0.00 H ATOM 7319 H2 WAT 9410 51.164 25.471 150.662 1.00 0.00 H TER 7321 WAT 9410 ATOM 7321 O WAT 9411 110.796 74.646 124.565 1.00 0.00 O ATOM 7322 H1 WAT 9411 111.163 73.778 124.733 1.00 0.00 H ATOM 7323 H2 WAT 9411 111.385 75.033 123.917 1.00 0.00 H TER 7325 WAT 9411 ATOM 7325 O WAT 9412 78.941 47.494 1.270 1.00 0.00 O ATOM 7326 H1 WAT 9412 79.116 46.804 0.629 1.00 0.00 H ATOM 7327 H2 WAT 9412 79.787 47.923 1.397 1.00 0.00 H TER 7329 WAT 9412 ATOM 7329 O WAT 9413 125.874 56.926 86.299 1.00 0.00 O ATOM 7330 H1 WAT 9413 126.779 56.626 86.223 1.00 0.00 H ATOM 7331 H2 WAT 9413 125.348 56.167 86.047 1.00 0.00 H TER 7333 WAT 9413 ATOM 7333 O WAT 9414 84.329 26.568 88.237 1.00 0.00 O ATOM 7334 H1 WAT 9414 83.609 27.072 88.614 1.00 0.00 H ATOM 7335 H2 WAT 9414 84.714 27.152 87.583 1.00 0.00 H TER 7337 WAT 9414 ATOM 7337 O WAT 9415 68.002 62.525 3.920 1.00 0.00 O ATOM 7338 H1 WAT 9415 67.329 62.310 3.275 1.00 0.00 H ATOM 7339 H2 WAT 9415 68.369 61.678 4.175 1.00 0.00 H TER 7341 WAT 9415 ATOM 7341 O WAT 9416 37.829 128.957 110.860 1.00 0.00 O ATOM 7342 H1 WAT 9416 38.534 128.322 110.734 1.00 0.00 H ATOM 7343 H2 WAT 9416 38.081 129.441 111.647 1.00 0.00 H TER 7345 WAT 9416 ATOM 7345 O WAT 9417 21.898 23.754 151.735 1.00 0.00 O ATOM 7346 H1 WAT 9417 21.253 23.245 152.226 1.00 0.00 H ATOM 7347 H2 WAT 9417 22.727 23.588 152.184 1.00 0.00 H TER 7349 WAT 9417 ATOM 7349 O WAT 9418 29.774 108.745 129.662 1.00 0.00 O ATOM 7350 H1 WAT 9418 30.030 108.726 130.584 1.00 0.00 H ATOM 7351 H2 WAT 9418 28.967 108.231 129.627 1.00 0.00 H TER 7353 WAT 9418 ATOM 7353 O WAT 9419 5.853 7.807 119.380 1.00 0.00 O ATOM 7354 H1 WAT 9419 6.527 7.746 120.057 1.00 0.00 H ATOM 7355 H2 WAT 9419 5.080 8.132 119.840 1.00 0.00 H TER 7357 WAT 9419 ATOM 7357 O WAT 9420 33.289 111.773 157.261 1.00 0.00 O ATOM 7358 H1 WAT 9420 33.738 112.409 157.818 1.00 0.00 H ATOM 7359 H2 WAT 9420 32.963 111.110 157.870 1.00 0.00 H TER 7361 WAT 9420 ATOM 7361 O WAT 9421 26.613 1.746 157.346 1.00 0.00 O ATOM 7362 H1 WAT 9421 26.112 1.601 156.543 1.00 0.00 H ATOM 7363 H2 WAT 9421 26.158 1.227 158.009 1.00 0.00 H TER 7365 WAT 9421 ATOM 7365 O WAT 9422 33.615 141.248 98.063 1.00 0.00 O ATOM 7366 H1 WAT 9422 33.396 140.736 98.841 1.00 0.00 H ATOM 7367 H2 WAT 9422 32.769 141.525 97.712 1.00 0.00 H TER 7369 WAT 9422 ATOM 7369 O WAT 9423 81.283 4.027 57.628 1.00 0.00 O ATOM 7370 H1 WAT 9423 80.517 3.910 57.065 1.00 0.00 H ATOM 7371 H2 WAT 9423 81.983 4.286 57.029 1.00 0.00 H TER 7373 WAT 9423 ATOM 7373 O WAT 9424 84.008 53.493 95.389 1.00 0.00 O ATOM 7374 H1 WAT 9424 84.825 53.008 95.269 1.00 0.00 H ATOM 7375 H2 WAT 9424 83.326 52.822 95.358 1.00 0.00 H TER 7377 WAT 9424 ATOM 7377 O WAT 9425 14.820 59.211 143.502 1.00 0.00 O ATOM 7378 H1 WAT 9425 15.222 59.641 142.747 1.00 0.00 H ATOM 7379 H2 WAT 9425 14.071 59.766 143.721 1.00 0.00 H TER 7381 WAT 9425 ATOM 7381 O WAT 9426 94.925 126.618 61.407 1.00 0.00 O ATOM 7382 H1 WAT 9426 94.735 126.128 60.607 1.00 0.00 H ATOM 7383 H2 WAT 9426 95.572 127.271 61.140 1.00 0.00 H TER 7385 WAT 9426 ATOM 7385 O WAT 9427 77.116 41.876 123.733 1.00 0.00 O ATOM 7386 H1 WAT 9427 76.411 42.488 123.523 1.00 0.00 H ATOM 7387 H2 WAT 9427 77.083 41.791 124.686 1.00 0.00 H TER 7389 WAT 9427 ATOM 7389 O WAT 9428 70.311 50.980 63.195 1.00 0.00 O ATOM 7390 H1 WAT 9428 70.187 51.389 62.339 1.00 0.00 H ATOM 7391 H2 WAT 9428 71.033 50.365 63.065 1.00 0.00 H TER 7393 WAT 9428 ATOM 7393 O WAT 9429 66.009 76.195 66.126 1.00 0.00 O ATOM 7394 H1 WAT 9429 65.872 77.048 66.537 1.00 0.00 H ATOM 7395 H2 WAT 9429 65.726 75.563 66.786 1.00 0.00 H TER 7397 WAT 9429 ATOM 7397 O WAT 9430 24.355 109.915 13.130 1.00 0.00 O ATOM 7398 H1 WAT 9430 24.345 110.481 12.358 1.00 0.00 H ATOM 7399 H2 WAT 9430 24.869 110.399 13.776 1.00 0.00 H TER 7401 WAT 9430 ATOM 7401 O WAT 9431 111.109 120.040 132.684 1.00 0.00 O ATOM 7402 H1 WAT 9431 110.435 119.602 133.203 1.00 0.00 H ATOM 7403 H2 WAT 9431 110.810 119.951 131.779 1.00 0.00 H TER 7405 WAT 9431 ATOM 7405 O WAT 9432 144.663 75.007 147.204 1.00 0.00 O ATOM 7406 H1 WAT 9432 143.993 74.324 147.172 1.00 0.00 H ATOM 7407 H2 WAT 9432 145.311 74.737 146.553 1.00 0.00 H TER 7409 WAT 9432 ATOM 7409 O WAT 9433 62.116 112.534 146.601 1.00 0.00 O ATOM 7410 H1 WAT 9433 61.843 113.148 147.283 1.00 0.00 H ATOM 7411 H2 WAT 9433 62.721 111.938 147.044 1.00 0.00 H TER 7413 WAT 9433 ATOM 7413 O WAT 9434 26.870 53.451 154.782 1.00 0.00 O ATOM 7414 H1 WAT 9434 27.443 54.112 155.170 1.00 0.00 H ATOM 7415 H2 WAT 9434 27.230 52.616 155.083 1.00 0.00 H TER 7417 WAT 9434 ATOM 7417 O WAT 9435 45.778 -0.047 104.861 1.00 0.00 O ATOM 7418 H1 WAT 9435 46.545 -0.322 104.358 1.00 0.00 H ATOM 7419 H2 WAT 9435 46.136 0.480 105.575 1.00 0.00 H TER 7421 WAT 9435 ATOM 7421 O WAT 9436 93.221 54.635 72.568 1.00 0.00 O ATOM 7422 H1 WAT 9436 92.380 54.934 72.912 1.00 0.00 H ATOM 7423 H2 WAT 9436 93.249 54.977 71.674 1.00 0.00 H TER 7425 WAT 9436 ATOM 7425 O WAT 9437 29.567 45.991 141.630 1.00 0.00 O ATOM 7426 H1 WAT 9437 29.562 46.151 140.686 1.00 0.00 H ATOM 7427 H2 WAT 9437 28.848 45.374 141.772 1.00 0.00 H TER 7429 WAT 9437 ATOM 7429 O WAT 9438 116.842 30.266 11.665 1.00 0.00 O ATOM 7430 H1 WAT 9438 115.984 30.683 11.590 1.00 0.00 H ATOM 7431 H2 WAT 9438 116.653 29.388 11.994 1.00 0.00 H TER 7433 WAT 9438 ATOM 7433 O WAT 9439 104.035 19.438 78.076 1.00 0.00 O ATOM 7434 H1 WAT 9439 103.246 19.266 78.589 1.00 0.00 H ATOM 7435 H2 WAT 9439 103.888 20.302 77.692 1.00 0.00 H TER 7437 WAT 9439 ATOM 7437 O WAT 9440 109.063 42.397 108.461 1.00 0.00 O ATOM 7438 H1 WAT 9440 109.513 43.227 108.614 1.00 0.00 H ATOM 7439 H2 WAT 9440 108.140 42.590 108.626 1.00 0.00 H TER 7441 WAT 9440 ATOM 7441 O WAT 9441 142.443 91.325 86.802 1.00 0.00 O ATOM 7442 H1 WAT 9441 142.715 91.299 85.884 1.00 0.00 H ATOM 7443 H2 WAT 9441 143.180 90.947 87.281 1.00 0.00 H TER 7445 WAT 9441 ATOM 7445 O WAT 9442 132.839 19.227 93.072 1.00 0.00 O ATOM 7446 H1 WAT 9442 131.892 19.366 93.044 1.00 0.00 H ATOM 7447 H2 WAT 9442 133.191 20.041 93.430 1.00 0.00 H TER 7449 WAT 9442 ATOM 7449 O WAT 9443 21.954 135.664 55.177 1.00 0.00 O ATOM 7450 H1 WAT 9443 22.369 136.448 55.536 1.00 0.00 H ATOM 7451 H2 WAT 9443 21.082 135.653 55.571 1.00 0.00 H TER 7453 WAT 9443 ATOM 7453 O WAT 9444 16.981 14.473 137.537 1.00 0.00 O ATOM 7454 H1 WAT 9444 17.558 13.733 137.348 1.00 0.00 H ATOM 7455 H2 WAT 9444 16.202 14.075 137.925 1.00 0.00 H TER 7457 WAT 9444 ATOM 7457 O WAT 9445 120.185 23.145 81.093 1.00 0.00 O ATOM 7458 H1 WAT 9445 119.500 23.454 81.686 1.00 0.00 H ATOM 7459 H2 WAT 9445 120.946 23.007 81.657 1.00 0.00 H TER 7461 WAT 9445 ATOM 7461 O WAT 9446 69.275 83.836 98.366 1.00 0.00 O ATOM 7462 H1 WAT 9446 68.768 83.486 97.633 1.00 0.00 H ATOM 7463 H2 WAT 9446 69.707 84.612 98.010 1.00 0.00 H TER 7465 WAT 9446 ATOM 7465 O WAT 9447 70.498 36.802 105.764 1.00 0.00 O ATOM 7466 H1 WAT 9447 71.242 36.208 105.863 1.00 0.00 H ATOM 7467 H2 WAT 9447 69.891 36.332 105.193 1.00 0.00 H TER 7469 WAT 9447 ATOM 7469 O WAT 9448 115.866 35.299 71.708 1.00 0.00 O ATOM 7470 H1 WAT 9448 115.505 34.438 71.494 1.00 0.00 H ATOM 7471 H2 WAT 9448 115.643 35.846 70.956 1.00 0.00 H TER 7473 WAT 9448 ATOM 7473 O WAT 9449 86.548 25.700 17.708 1.00 0.00 O ATOM 7474 H1 WAT 9449 86.996 24.855 17.744 1.00 0.00 H ATOM 7475 H2 WAT 9449 87.230 26.341 17.911 1.00 0.00 H TER 7477 WAT 9449 ATOM 7477 O WAT 9450 135.965 74.970 19.941 1.00 0.00 O ATOM 7478 H1 WAT 9450 136.102 75.643 20.608 1.00 0.00 H ATOM 7479 H2 WAT 9450 135.407 75.391 19.287 1.00 0.00 H TER 7481 WAT 9450 ATOM 7481 O WAT 9451 57.385 5.336 113.804 1.00 0.00 O ATOM 7482 H1 WAT 9451 57.436 5.979 114.511 1.00 0.00 H ATOM 7483 H2 WAT 9451 56.462 5.083 113.777 1.00 0.00 H TER 7485 WAT 9451 ATOM 7485 O WAT 9452 3.609 50.822 131.586 1.00 0.00 O ATOM 7486 H1 WAT 9452 3.662 49.885 131.395 1.00 0.00 H ATOM 7487 H2 WAT 9452 4.440 51.026 132.014 1.00 0.00 H TER 7489 WAT 9452 ATOM 7489 O WAT 9453 89.508 21.796 12.225 1.00 0.00 O ATOM 7490 H1 WAT 9453 89.532 20.878 11.956 1.00 0.00 H ATOM 7491 H2 WAT 9453 89.544 21.766 13.181 1.00 0.00 H TER 7493 WAT 9453 ATOM 7493 O WAT 9454 70.318 94.087 109.141 1.00 0.00 O ATOM 7494 H1 WAT 9454 70.072 93.187 108.930 1.00 0.00 H ATOM 7495 H2 WAT 9454 69.571 94.431 109.630 1.00 0.00 H TER 7497 WAT 9454 ATOM 7497 O WAT 9455 133.557 109.021 111.395 1.00 0.00 O ATOM 7498 H1 WAT 9455 132.753 109.496 111.604 1.00 0.00 H ATOM 7499 H2 WAT 9455 133.286 108.104 111.341 1.00 0.00 H TER 7501 WAT 9455 ATOM 7501 O WAT 9456 37.453 106.036 104.358 1.00 0.00 O ATOM 7502 H1 WAT 9456 36.660 105.633 104.005 1.00 0.00 H ATOM 7503 H2 WAT 9456 37.358 106.968 104.160 1.00 0.00 H TER 7505 WAT 9456 ATOM 7505 O WAT 9457 57.770 46.019 14.922 1.00 0.00 O ATOM 7506 H1 WAT 9457 58.502 45.406 14.851 1.00 0.00 H ATOM 7507 H2 WAT 9457 57.427 46.085 14.031 1.00 0.00 H TER 7509 WAT 9457 ATOM 7509 O WAT 9458 85.721 81.573 149.254 1.00 0.00 O ATOM 7510 H1 WAT 9458 85.377 81.669 148.365 1.00 0.00 H ATOM 7511 H2 WAT 9458 85.452 80.693 149.520 1.00 0.00 H TER 7513 WAT 9458 ATOM 7513 O WAT 9459 140.788 111.905 111.342 1.00 0.00 O ATOM 7514 H1 WAT 9459 140.990 111.906 110.406 1.00 0.00 H ATOM 7515 H2 WAT 9459 141.469 111.358 111.733 1.00 0.00 H TER 7517 WAT 9459 ATOM 7517 O WAT 9460 71.236 142.618 55.941 1.00 0.00 O ATOM 7518 H1 WAT 9460 72.092 142.356 56.280 1.00 0.00 H ATOM 7519 H2 WAT 9460 70.890 141.827 55.527 1.00 0.00 H TER 7521 WAT 9460 ATOM 7521 O WAT 9461 5.278 31.136 19.808 1.00 0.00 O ATOM 7522 H1 WAT 9461 4.630 31.603 20.335 1.00 0.00 H ATOM 7523 H2 WAT 9461 5.258 31.577 18.958 1.00 0.00 H TER 7525 WAT 9461 ATOM 7525 O WAT 9462 54.105 145.399 103.062 1.00 0.00 O ATOM 7526 H1 WAT 9462 53.819 146.276 102.807 1.00 0.00 H ATOM 7527 H2 WAT 9462 54.997 145.330 102.722 1.00 0.00 H TER 7529 WAT 9462 ATOM 7529 O WAT 9463 2.811 89.025 61.341 1.00 0.00 O ATOM 7530 H1 WAT 9463 3.734 88.892 61.125 1.00 0.00 H ATOM 7531 H2 WAT 9463 2.345 88.835 60.528 1.00 0.00 H TER 7533 WAT 9463 ATOM 7533 O WAT 9464 115.344 67.563 74.293 1.00 0.00 O ATOM 7534 H1 WAT 9464 115.947 68.207 73.921 1.00 0.00 H ATOM 7535 H2 WAT 9464 115.123 67.913 75.156 1.00 0.00 H TER 7537 WAT 9464 ATOM 7537 O WAT 9465 41.051 76.548 120.653 1.00 0.00 O ATOM 7538 H1 WAT 9465 40.146 76.561 120.341 1.00 0.00 H ATOM 7539 H2 WAT 9465 41.577 76.711 119.869 1.00 0.00 H TER 7541 WAT 9465 ATOM 7541 O WAT 9466 45.615 30.527 131.963 1.00 0.00 O ATOM 7542 H1 WAT 9466 46.136 31.218 131.553 1.00 0.00 H ATOM 7543 H2 WAT 9466 46.121 29.728 131.819 1.00 0.00 H TER 7545 WAT 9466 ATOM 7545 O WAT 9467 88.090 63.073 77.678 1.00 0.00 O ATOM 7546 H1 WAT 9467 87.699 62.981 76.809 1.00 0.00 H ATOM 7547 H2 WAT 9467 88.738 62.371 77.725 1.00 0.00 H TER 7549 WAT 9467 ATOM 7549 O WAT 9468 117.554 13.749 113.386 1.00 0.00 O ATOM 7550 H1 WAT 9468 116.681 14.135 113.308 1.00 0.00 H ATOM 7551 H2 WAT 9468 118.153 14.471 113.194 1.00 0.00 H TER 7553 WAT 9468 ATOM 7553 O WAT 9469 130.942 144.804 129.413 1.00 0.00 O ATOM 7554 H1 WAT 9469 130.816 144.801 128.464 1.00 0.00 H ATOM 7555 H2 WAT 9469 131.786 145.236 129.542 1.00 0.00 H TER 7557 WAT 9469 ATOM 7557 O WAT 9470 98.570 139.570 0.726 1.00 0.00 O ATOM 7558 H1 WAT 9470 98.182 140.404 0.989 1.00 0.00 H ATOM 7559 H2 WAT 9470 99.119 139.788 -0.027 1.00 0.00 H TER 7561 WAT 9470 ATOM 7561 O WAT 9471 1.629 121.376 88.580 1.00 0.00 O ATOM 7562 H1 WAT 9471 0.800 120.923 88.427 1.00 0.00 H ATOM 7563 H2 WAT 9471 1.476 122.268 88.269 1.00 0.00 H TER 7565 WAT 9471 ATOM 7565 O WAT 9472 134.435 3.497 139.050 1.00 0.00 O ATOM 7566 H1 WAT 9472 134.982 4.281 139.017 1.00 0.00 H ATOM 7567 H2 WAT 9472 134.716 3.043 139.845 1.00 0.00 H TER 7569 WAT 9472 ATOM 7569 O WAT 9473 65.679 102.459 76.471 1.00 0.00 O ATOM 7570 H1 WAT 9473 65.537 102.353 75.531 1.00 0.00 H ATOM 7571 H2 WAT 9473 65.221 103.270 76.692 1.00 0.00 H TER 7573 WAT 9473 ATOM 7573 O WAT 9474 102.427 129.305 132.335 1.00 0.00 O ATOM 7574 H1 WAT 9474 101.535 128.962 132.394 1.00 0.00 H ATOM 7575 H2 WAT 9474 102.651 129.228 131.408 1.00 0.00 H TER 7577 WAT 9474 ATOM 7577 O WAT 9475 54.316 100.031 66.183 1.00 0.00 O ATOM 7578 H1 WAT 9475 54.098 100.760 65.603 1.00 0.00 H ATOM 7579 H2 WAT 9475 53.682 99.349 65.960 1.00 0.00 H TER 7581 WAT 9475 ATOM 7581 O WAT 9476 9.262 22.195 82.275 1.00 0.00 O ATOM 7582 H1 WAT 9476 8.850 22.881 81.748 1.00 0.00 H ATOM 7583 H2 WAT 9476 9.223 22.526 83.172 1.00 0.00 H TER 7585 WAT 9476 ATOM 7585 O WAT 9477 33.161 81.596 119.312 1.00 0.00 O ATOM 7586 H1 WAT 9477 33.820 81.575 120.006 1.00 0.00 H ATOM 7587 H2 WAT 9477 33.514 82.207 118.665 1.00 0.00 H TER 7589 WAT 9477 ATOM 7589 O WAT 9478 107.058 107.851 70.473 1.00 0.00 O ATOM 7590 H1 WAT 9478 106.815 106.994 70.823 1.00 0.00 H ATOM 7591 H2 WAT 9478 106.722 108.476 71.115 1.00 0.00 H TER 7593 WAT 9478 ATOM 7593 O WAT 9479 129.995 39.167 85.599 1.00 0.00 O ATOM 7594 H1 WAT 9479 129.545 39.121 84.756 1.00 0.00 H ATOM 7595 H2 WAT 9479 130.438 40.015 85.589 1.00 0.00 H TER 7597 WAT 9479 ATOM 7597 O WAT 9480 105.577 90.051 85.080 1.00 0.00 O ATOM 7598 H1 WAT 9480 106.525 90.062 85.212 1.00 0.00 H ATOM 7599 H2 WAT 9480 105.467 90.122 84.132 1.00 0.00 H TER 7601 WAT 9480 ATOM 7601 O WAT 9481 112.790 133.257 83.811 1.00 0.00 O ATOM 7602 H1 WAT 9481 113.321 132.899 84.523 1.00 0.00 H ATOM 7603 H2 WAT 9481 113.325 133.960 83.444 1.00 0.00 H TER 7605 WAT 9481 ATOM 7605 O WAT 9482 55.226 17.759 106.137 1.00 0.00 O ATOM 7606 H1 WAT 9482 54.628 17.045 106.359 1.00 0.00 H ATOM 7607 H2 WAT 9482 55.787 17.396 105.450 1.00 0.00 H TER 7609 WAT 9482 ATOM 7609 O WAT 9483 40.646 64.722 74.019 1.00 0.00 O ATOM 7610 H1 WAT 9483 41.049 64.895 74.870 1.00 0.00 H ATOM 7611 H2 WAT 9483 40.121 63.934 74.158 1.00 0.00 H TER 7613 WAT 9483 ATOM 7613 O WAT 9484 134.789 75.283 8.254 1.00 0.00 O ATOM 7614 H1 WAT 9484 135.657 75.387 8.643 1.00 0.00 H ATOM 7615 H2 WAT 9484 134.852 75.721 7.405 1.00 0.00 H TER 7617 WAT 9484 ATOM 7617 O WAT 9485 132.652 91.326 20.764 1.00 0.00 O ATOM 7618 H1 WAT 9485 132.278 91.758 19.996 1.00 0.00 H ATOM 7619 H2 WAT 9485 133.166 92.009 21.196 1.00 0.00 H TER 7621 WAT 9485 ATOM 7621 O WAT 9486 76.565 19.262 63.131 1.00 0.00 O ATOM 7622 H1 WAT 9486 76.315 18.402 63.468 1.00 0.00 H ATOM 7623 H2 WAT 9486 77.346 19.096 62.604 1.00 0.00 H TER 7625 WAT 9486 ATOM 7625 O WAT 9487 36.648 2.550 92.353 1.00 0.00 O ATOM 7626 H1 WAT 9487 36.538 3.298 91.766 1.00 0.00 H ATOM 7627 H2 WAT 9487 35.757 2.310 92.605 1.00 0.00 H TER 7629 WAT 9487 ATOM 7629 O WAT 9488 77.894 79.740 104.517 1.00 0.00 O ATOM 7630 H1 WAT 9488 77.578 80.512 104.985 1.00 0.00 H ATOM 7631 H2 WAT 9488 78.516 79.333 105.121 1.00 0.00 H TER 7633 WAT 9488 ATOM 7633 O WAT 9489 71.485 2.694 81.676 1.00 0.00 O ATOM 7634 H1 WAT 9489 71.250 3.468 81.163 1.00 0.00 H ATOM 7635 H2 WAT 9489 71.945 3.043 82.439 1.00 0.00 H TER 7637 WAT 9489 ATOM 7637 O WAT 9490 1.445 22.835 116.612 1.00 0.00 O ATOM 7638 H1 WAT 9490 0.557 23.033 116.908 1.00 0.00 H ATOM 7639 H2 WAT 9490 1.935 22.671 117.418 1.00 0.00 H TER 7641 WAT 9490 ATOM 7641 O WAT 9491 131.692 65.515 69.677 1.00 0.00 O ATOM 7642 H1 WAT 9491 132.298 66.056 69.171 1.00 0.00 H ATOM 7643 H2 WAT 9491 131.953 64.615 69.482 1.00 0.00 H TER 7645 WAT 9491 ATOM 7645 O WAT 9492 47.892 30.745 89.227 1.00 0.00 O ATOM 7646 H1 WAT 9492 46.950 30.595 89.307 1.00 0.00 H ATOM 7647 H2 WAT 9492 48.087 30.567 88.307 1.00 0.00 H TER 7649 WAT 9492 ATOM 7649 O WAT 9493 39.190 112.669 76.328 1.00 0.00 O ATOM 7650 H1 WAT 9493 38.285 112.777 76.035 1.00 0.00 H ATOM 7651 H2 WAT 9493 39.680 113.332 75.841 1.00 0.00 H TER 7653 WAT 9493 ATOM 7653 O WAT 9494 31.790 119.776 73.503 1.00 0.00 O ATOM 7654 H1 WAT 9494 32.546 120.236 73.868 1.00 0.00 H ATOM 7655 H2 WAT 9494 31.706 118.989 74.043 1.00 0.00 H TER 7657 WAT 9494 ATOM 7657 O WAT 9495 20.139 99.990 149.520 1.00 0.00 O ATOM 7658 H1 WAT 9495 20.894 100.546 149.325 1.00 0.00 H ATOM 7659 H2 WAT 9495 19.421 100.376 149.018 1.00 0.00 H TER 7661 WAT 9495 ATOM 7661 O WAT 9496 104.188 87.219 121.289 1.00 0.00 O ATOM 7662 H1 WAT 9496 103.444 87.773 121.056 1.00 0.00 H ATOM 7663 H2 WAT 9496 103.888 86.328 121.109 1.00 0.00 H TER 7665 WAT 9496 ATOM 7665 O WAT 9497 54.004 133.074 16.875 1.00 0.00 O ATOM 7666 H1 WAT 9497 54.840 132.766 17.224 1.00 0.00 H ATOM 7667 H2 WAT 9497 54.221 133.884 16.413 1.00 0.00 H TER 7669 WAT 9497 ATOM 7669 O WAT 9498 56.578 123.987 74.302 1.00 0.00 O ATOM 7670 H1 WAT 9498 57.297 123.360 74.378 1.00 0.00 H ATOM 7671 H2 WAT 9498 56.842 124.722 74.856 1.00 0.00 H TER 7673 WAT 9498 ATOM 7673 O WAT 9499 101.206 100.574 25.738 1.00 0.00 O ATOM 7674 H1 WAT 9499 101.093 100.889 24.841 1.00 0.00 H ATOM 7675 H2 WAT 9499 100.816 99.700 25.735 1.00 0.00 H TER 7677 WAT 9499 ATOM 7677 O WAT 9500 112.565 48.460 68.559 1.00 0.00 O ATOM 7678 H1 WAT 9500 112.460 47.719 69.155 1.00 0.00 H ATOM 7679 H2 WAT 9500 111.679 48.802 68.443 1.00 0.00 H TER 7681 WAT 9500 ATOM 7681 O WAT 9501 139.555 106.919 86.808 1.00 0.00 O ATOM 7682 H1 WAT 9501 139.567 106.784 85.860 1.00 0.00 H ATOM 7683 H2 WAT 9501 140.316 106.434 87.128 1.00 0.00 H TER 7685 WAT 9501 ATOM 7685 O WAT 9502 123.182 140.112 85.043 1.00 0.00 O ATOM 7686 H1 WAT 9502 123.147 139.412 85.695 1.00 0.00 H ATOM 7687 H2 WAT 9502 122.268 140.363 84.912 1.00 0.00 H TER 7689 WAT 9502 ATOM 7689 O WAT 9503 58.004 98.179 79.483 1.00 0.00 O ATOM 7690 H1 WAT 9503 57.258 98.435 80.025 1.00 0.00 H ATOM 7691 H2 WAT 9503 58.717 98.749 79.772 1.00 0.00 H TER 7693 WAT 9503 ATOM 7693 O WAT 9504 65.321 145.306 133.958 1.00 0.00 O ATOM 7694 H1 WAT 9504 65.471 145.887 133.213 1.00 0.00 H ATOM 7695 H2 WAT 9504 64.544 145.663 134.388 1.00 0.00 H TER 7697 WAT 9504 ATOM 7697 O WAT 9505 43.005 95.995 16.022 1.00 0.00 O ATOM 7698 H1 WAT 9505 42.522 96.766 15.725 1.00 0.00 H ATOM 7699 H2 WAT 9505 43.851 96.055 15.577 1.00 0.00 H TER 7701 WAT 9505 ATOM 7701 O WAT 9506 102.507 70.998 72.683 1.00 0.00 O ATOM 7702 H1 WAT 9506 102.602 71.901 72.986 1.00 0.00 H ATOM 7703 H2 WAT 9506 102.926 70.988 71.823 1.00 0.00 H TER 7705 WAT 9506 ATOM 7705 O WAT 9507 28.982 45.137 63.319 1.00 0.00 O ATOM 7706 H1 WAT 9507 28.155 45.568 63.533 1.00 0.00 H ATOM 7707 H2 WAT 9507 29.545 45.842 63.001 1.00 0.00 H TER 7709 WAT 9507 ATOM 7709 O WAT 9508 111.417 95.782 156.805 1.00 0.00 O ATOM 7710 H1 WAT 9508 111.883 96.605 156.951 1.00 0.00 H ATOM 7711 H2 WAT 9508 111.836 95.160 157.400 1.00 0.00 H TER 7713 WAT 9508 ATOM 7713 O WAT 9509 41.859 8.951 140.355 1.00 0.00 O ATOM 7714 H1 WAT 9509 41.837 9.863 140.644 1.00 0.00 H ATOM 7715 H2 WAT 9509 42.579 8.917 139.725 1.00 0.00 H TER 7717 WAT 9509 ATOM 7717 O WAT 9510 120.156 13.245 96.696 1.00 0.00 O ATOM 7718 H1 WAT 9510 120.116 13.811 95.926 1.00 0.00 H ATOM 7719 H2 WAT 9510 119.284 12.855 96.753 1.00 0.00 H TER 7721 WAT 9510 ATOM 7721 O WAT 9511 143.263 17.797 87.351 1.00 0.00 O ATOM 7722 H1 WAT 9511 142.349 18.037 87.503 1.00 0.00 H ATOM 7723 H2 WAT 9511 143.276 16.843 87.432 1.00 0.00 H TER 7725 WAT 9511 ATOM 7725 O WAT 9512 85.338 41.268 155.567 1.00 0.00 O ATOM 7726 H1 WAT 9512 85.163 41.335 156.505 1.00 0.00 H ATOM 7727 H2 WAT 9512 85.183 42.150 155.230 1.00 0.00 H TER 7729 WAT 9512 ATOM 7729 O WAT 9513 88.814 96.155 57.241 1.00 0.00 O ATOM 7730 H1 WAT 9513 88.442 96.913 56.791 1.00 0.00 H ATOM 7731 H2 WAT 9513 88.845 96.415 58.162 1.00 0.00 H TER 7733 WAT 9513 ATOM 7733 O WAT 9514 49.709 53.177 9.049 1.00 0.00 O ATOM 7734 H1 WAT 9514 49.190 52.643 9.650 1.00 0.00 H ATOM 7735 H2 WAT 9514 49.500 54.080 9.288 1.00 0.00 H TER 7737 WAT 9514 ATOM 7737 O WAT 9515 136.183 72.134 117.842 1.00 0.00 O ATOM 7738 H1 WAT 9515 136.379 72.324 118.759 1.00 0.00 H ATOM 7739 H2 WAT 9515 136.474 71.231 117.717 1.00 0.00 H TER 7741 WAT 9515 ATOM 7741 O WAT 9516 16.676 0.301 76.197 1.00 0.00 O ATOM 7742 H1 WAT 9516 15.954 0.291 76.826 1.00 0.00 H ATOM 7743 H2 WAT 9516 16.282 0.007 75.376 1.00 0.00 H TER 7745 WAT 9516 ATOM 7745 O WAT 9517 0.368 108.829 127.989 1.00 0.00 O ATOM 7746 H1 WAT 9517 -0.440 109.117 127.564 1.00 0.00 H ATOM 7747 H2 WAT 9517 0.806 108.291 127.330 1.00 0.00 H TER 7749 WAT 9517 ATOM 7749 O WAT 9518 79.842 135.755 10.318 1.00 0.00 O ATOM 7750 H1 WAT 9518 79.074 136.170 10.711 1.00 0.00 H ATOM 7751 H2 WAT 9518 80.047 136.300 9.558 1.00 0.00 H TER 7753 WAT 9518 ATOM 7753 O WAT 9519 73.372 4.791 6.459 1.00 0.00 O ATOM 7754 H1 WAT 9519 73.812 4.592 5.632 1.00 0.00 H ATOM 7755 H2 WAT 9519 73.860 4.294 7.115 1.00 0.00 H TER 7757 WAT 9519 ATOM 7757 O WAT 9520 72.532 25.365 12.373 1.00 0.00 O ATOM 7758 H1 WAT 9520 71.905 25.909 12.849 1.00 0.00 H ATOM 7759 H2 WAT 9520 72.132 25.233 11.514 1.00 0.00 H TER 7761 WAT 9520 ATOM 7761 O WAT 9521 44.787 45.301 104.079 1.00 0.00 O ATOM 7762 H1 WAT 9521 44.729 45.658 104.965 1.00 0.00 H ATOM 7763 H2 WAT 9521 45.722 45.318 103.874 1.00 0.00 H TER 7765 WAT 9521 ATOM 7765 O WAT 9522 129.364 101.876 68.433 1.00 0.00 O ATOM 7766 H1 WAT 9522 128.871 101.550 69.185 1.00 0.00 H ATOM 7767 H2 WAT 9522 129.226 102.823 68.447 1.00 0.00 H TER 7769 WAT 9522 ATOM 7769 O WAT 9523 6.684 116.258 8.143 1.00 0.00 O ATOM 7770 H1 WAT 9523 6.237 116.291 8.988 1.00 0.00 H ATOM 7771 H2 WAT 9523 6.960 115.345 8.054 1.00 0.00 H TER 7773 WAT 9523 ATOM 7773 O WAT 9524 77.402 79.976 112.316 1.00 0.00 O ATOM 7774 H1 WAT 9524 77.098 79.234 112.838 1.00 0.00 H ATOM 7775 H2 WAT 9524 78.261 80.189 112.680 1.00 0.00 H TER 7777 WAT 9524 ATOM 7777 O WAT 9525 19.679 139.874 114.799 1.00 0.00 O ATOM 7778 H1 WAT 9525 18.905 140.105 114.286 1.00 0.00 H ATOM 7779 H2 WAT 9525 20.403 139.924 114.175 1.00 0.00 H TER 7781 WAT 9525 ATOM 7781 O WAT 9526 116.200 56.657 85.752 1.00 0.00 O ATOM 7782 H1 WAT 9526 116.598 56.787 84.891 1.00 0.00 H ATOM 7783 H2 WAT 9526 115.969 55.728 85.770 1.00 0.00 H TER 7785 WAT 9526 ATOM 7785 O WAT 9527 11.469 69.644 151.122 1.00 0.00 O ATOM 7786 H1 WAT 9527 12.320 70.063 150.997 1.00 0.00 H ATOM 7787 H2 WAT 9527 10.938 69.957 150.389 1.00 0.00 H TER 7789 WAT 9527 ATOM 7789 O WAT 9528 141.262 119.025 100.812 1.00 0.00 O ATOM 7790 H1 WAT 9528 140.967 119.718 100.222 1.00 0.00 H ATOM 7791 H2 WAT 9528 142.207 119.160 100.886 1.00 0.00 H TER 7793 WAT 9528 ATOM 7793 O WAT 9529 123.970 59.951 155.857 1.00 0.00 O ATOM 7794 H1 WAT 9529 123.435 59.547 155.174 1.00 0.00 H ATOM 7795 H2 WAT 9529 124.382 60.700 155.427 1.00 0.00 H TER 7797 WAT 9529 ATOM 7797 O WAT 9530 54.529 131.785 2.872 1.00 0.00 O ATOM 7798 H1 WAT 9530 53.734 132.261 3.113 1.00 0.00 H ATOM 7799 H2 WAT 9530 54.376 130.892 3.179 1.00 0.00 H TER 7801 WAT 9530 ATOM 7801 O WAT 9531 10.199 127.536 129.849 1.00 0.00 O ATOM 7802 H1 WAT 9531 10.779 126.931 130.312 1.00 0.00 H ATOM 7803 H2 WAT 9531 9.382 127.050 129.742 1.00 0.00 H TER 7805 WAT 9531 ATOM 7805 O WAT 9532 24.028 2.355 70.855 1.00 0.00 O ATOM 7806 H1 WAT 9532 23.707 3.185 71.207 1.00 0.00 H ATOM 7807 H2 WAT 9532 23.739 2.354 69.943 1.00 0.00 H TER 7809 WAT 9532 ATOM 7809 O WAT 9533 143.950 86.452 114.851 1.00 0.00 O ATOM 7810 H1 WAT 9533 144.464 85.746 114.458 1.00 0.00 H ATOM 7811 H2 WAT 9533 144.560 86.892 115.442 1.00 0.00 H TER 7813 WAT 9533 ATOM 7813 O WAT 9534 114.406 135.063 94.709 1.00 0.00 O ATOM 7814 H1 WAT 9534 113.508 134.782 94.880 1.00 0.00 H ATOM 7815 H2 WAT 9534 114.322 135.969 94.412 1.00 0.00 H TER 7817 WAT 9534 ATOM 7817 O WAT 9535 50.989 69.104 72.156 1.00 0.00 O ATOM 7818 H1 WAT 9535 51.140 68.388 72.773 1.00 0.00 H ATOM 7819 H2 WAT 9535 50.063 69.028 71.923 1.00 0.00 H TER 7821 WAT 9535 ATOM 7821 O WAT 9536 101.560 0.879 147.619 1.00 0.00 O ATOM 7822 H1 WAT 9536 102.152 1.359 147.040 1.00 0.00 H ATOM 7823 H2 WAT 9536 101.249 0.145 147.089 1.00 0.00 H TER 7825 WAT 9536 ATOM 7825 O WAT 9537 56.349 49.535 68.179 1.00 0.00 O ATOM 7826 H1 WAT 9537 56.928 50.279 68.346 1.00 0.00 H ATOM 7827 H2 WAT 9537 55.980 49.321 69.037 1.00 0.00 H TER 7829 WAT 9537 ATOM 7829 O WAT 9538 78.639 132.240 6.531 1.00 0.00 O ATOM 7830 H1 WAT 9538 79.487 132.555 6.217 1.00 0.00 H ATOM 7831 H2 WAT 9538 78.558 132.609 7.411 1.00 0.00 H TER 7833 WAT 9538 ATOM 7833 O WAT 9539 125.225 67.280 147.877 1.00 0.00 O ATOM 7834 H1 WAT 9539 126.102 67.245 148.257 1.00 0.00 H ATOM 7835 H2 WAT 9539 125.254 66.658 147.150 1.00 0.00 H TER 7837 WAT 9539 ATOM 7837 O WAT 9540 5.961 66.852 131.529 1.00 0.00 O ATOM 7838 H1 WAT 9540 5.170 67.168 131.967 1.00 0.00 H ATOM 7839 H2 WAT 9540 5.914 65.899 131.609 1.00 0.00 H TER 7841 WAT 9540 ATOM 7841 O WAT 9541 67.920 131.667 147.119 1.00 0.00 O ATOM 7842 H1 WAT 9541 67.656 132.583 147.203 1.00 0.00 H ATOM 7843 H2 WAT 9541 68.785 131.704 146.711 1.00 0.00 H TER 7845 WAT 9541 ATOM 7845 O WAT 9542 43.815 121.830 147.913 1.00 0.00 O ATOM 7846 H1 WAT 9542 44.724 121.606 148.112 1.00 0.00 H ATOM 7847 H2 WAT 9542 43.625 121.359 147.101 1.00 0.00 H TER 7849 WAT 9542 ATOM 7849 O WAT 9543 136.754 99.060 80.407 1.00 0.00 O ATOM 7850 H1 WAT 9543 135.971 98.561 80.171 1.00 0.00 H ATOM 7851 H2 WAT 9543 136.958 99.570 79.624 1.00 0.00 H TER 7853 WAT 9543 ATOM 7853 O WAT 9544 12.336 56.558 3.913 1.00 0.00 O ATOM 7854 H1 WAT 9544 11.884 57.393 4.035 1.00 0.00 H ATOM 7855 H2 WAT 9544 12.185 56.336 2.994 1.00 0.00 H TER 7857 WAT 9544 ATOM 7857 O WAT 9545 76.229 98.721 123.741 1.00 0.00 O ATOM 7858 H1 WAT 9545 76.500 99.216 124.514 1.00 0.00 H ATOM 7859 H2 WAT 9545 75.524 99.242 123.358 1.00 0.00 H TER 7861 WAT 9545 ATOM 7861 O WAT 9546 114.646 44.276 9.772 1.00 0.00 O ATOM 7862 H1 WAT 9546 114.769 43.390 10.113 1.00 0.00 H ATOM 7863 H2 WAT 9546 114.368 44.146 8.865 1.00 0.00 H TER 7865 WAT 9546 ATOM 7865 O WAT 9547 116.823 126.867 157.000 1.00 0.00 O ATOM 7866 H1 WAT 9547 116.646 126.874 157.940 1.00 0.00 H ATOM 7867 H2 WAT 9547 116.097 127.358 156.615 1.00 0.00 H TER 7869 WAT 9547 ATOM 7869 O WAT 9548 94.600 90.321 57.359 1.00 0.00 O ATOM 7870 H1 WAT 9548 94.389 89.532 56.859 1.00 0.00 H ATOM 7871 H2 WAT 9548 93.856 90.905 57.211 1.00 0.00 H TER 7873 WAT 9548 ATOM 7873 O WAT 9549 43.647 79.439 111.486 1.00 0.00 O ATOM 7874 H1 WAT 9549 42.808 79.898 111.523 1.00 0.00 H ATOM 7875 H2 WAT 9549 44.268 80.100 111.178 1.00 0.00 H TER 7877 WAT 9549 ATOM 7877 O WAT 9550 89.073 11.223 1.058 1.00 0.00 O ATOM 7878 H1 WAT 9550 89.438 10.869 1.869 1.00 0.00 H ATOM 7879 H2 WAT 9550 88.156 10.948 1.068 1.00 0.00 H TER 7881 WAT 9550 ATOM 7881 O WAT 9551 134.919 120.809 126.605 1.00 0.00 O ATOM 7882 H1 WAT 9551 135.407 120.103 126.181 1.00 0.00 H ATOM 7883 H2 WAT 9551 135.034 120.649 127.542 1.00 0.00 H TER 7885 WAT 9551 ATOM 7885 O WAT 9552 13.614 27.876 18.996 1.00 0.00 O ATOM 7886 H1 WAT 9552 12.825 27.387 18.759 1.00 0.00 H ATOM 7887 H2 WAT 9552 14.014 28.106 18.157 1.00 0.00 H TER 7889 WAT 9552 ATOM 7889 O WAT 9553 28.113 33.638 151.411 1.00 0.00 O ATOM 7890 H1 WAT 9553 27.648 33.957 152.185 1.00 0.00 H ATOM 7891 H2 WAT 9553 28.266 32.710 151.590 1.00 0.00 H TER 7893 WAT 9553 ATOM 7893 O WAT 9554 41.185 86.753 96.946 1.00 0.00 O ATOM 7894 H1 WAT 9554 40.682 87.551 97.110 1.00 0.00 H ATOM 7895 H2 WAT 9554 41.868 86.760 97.617 1.00 0.00 H TER 7897 WAT 9554 ATOM 7897 O WAT 9555 9.558 40.188 82.141 1.00 0.00 O ATOM 7898 H1 WAT 9555 9.185 39.488 82.677 1.00 0.00 H ATOM 7899 H2 WAT 9555 9.217 40.024 81.262 1.00 0.00 H TER 7901 WAT 9555 ATOM 7901 O WAT 9556 57.185 30.121 2.448 1.00 0.00 O ATOM 7902 H1 WAT 9556 57.199 29.719 1.580 1.00 0.00 H ATOM 7903 H2 WAT 9556 57.904 30.753 2.431 1.00 0.00 H TER 7905 WAT 9556 ATOM 7905 O WAT 9557 29.301 15.791 158.161 1.00 0.00 O ATOM 7906 H1 WAT 9557 28.818 16.012 158.957 1.00 0.00 H ATOM 7907 H2 WAT 9557 28.888 14.987 157.846 1.00 0.00 H TER 7909 WAT 9557 ATOM 7909 O WAT 9558 20.874 90.339 70.111 1.00 0.00 O ATOM 7910 H1 WAT 9558 21.026 90.305 71.056 1.00 0.00 H ATOM 7911 H2 WAT 9558 20.246 89.635 69.945 1.00 0.00 H TER 7913 WAT 9558 ATOM 7913 O WAT 9559 19.393 120.234 124.089 1.00 0.00 O ATOM 7914 H1 WAT 9559 19.469 121.064 124.560 1.00 0.00 H ATOM 7915 H2 WAT 9559 20.295 119.923 124.004 1.00 0.00 H TER 7917 WAT 9559 ATOM 7917 O WAT 9560 3.798 127.592 25.021 1.00 0.00 O ATOM 7918 H1 WAT 9560 4.142 128.281 24.453 1.00 0.00 H ATOM 7919 H2 WAT 9560 3.102 128.018 25.521 1.00 0.00 H TER 7921 WAT 9560 ATOM 7921 O WAT 9561 99.807 85.923 113.827 1.00 0.00 O ATOM 7922 H1 WAT 9561 99.395 86.693 113.436 1.00 0.00 H ATOM 7923 H2 WAT 9561 100.382 86.278 114.505 1.00 0.00 H TER 7925 WAT 9561 ATOM 7925 O WAT 9562 2.057 82.632 16.720 1.00 0.00 O ATOM 7926 H1 WAT 9562 2.867 82.240 16.394 1.00 0.00 H ATOM 7927 H2 WAT 9562 2.062 82.445 17.659 1.00 0.00 H TER 7929 WAT 9562 ATOM 7929 O WAT 9563 133.629 101.252 150.422 1.00 0.00 O ATOM 7930 H1 WAT 9563 132.805 101.450 150.868 1.00 0.00 H ATOM 7931 H2 WAT 9563 133.483 101.526 149.517 1.00 0.00 H TER 7933 WAT 9563 ATOM 7933 O WAT 9564 28.099 76.951 4.460 1.00 0.00 O ATOM 7934 H1 WAT 9564 27.818 76.314 3.803 1.00 0.00 H ATOM 7935 H2 WAT 9564 27.287 77.360 4.761 1.00 0.00 H TER 7937 WAT 9564 ATOM 7937 O WAT 9565 66.312 21.731 142.112 1.00 0.00 O ATOM 7938 H1 WAT 9565 67.019 21.285 142.579 1.00 0.00 H ATOM 7939 H2 WAT 9565 66.759 22.257 141.447 1.00 0.00 H TER 7941 WAT 9565 ATOM 7941 O WAT 9566 56.900 116.042 99.483 1.00 0.00 O ATOM 7942 H1 WAT 9566 57.393 116.239 100.279 1.00 0.00 H ATOM 7943 H2 WAT 9566 55.982 116.104 99.749 1.00 0.00 H TER 7945 WAT 9566 ATOM 7945 O WAT 9567 25.678 10.396 95.344 1.00 0.00 O ATOM 7946 H1 WAT 9567 25.462 10.618 96.249 1.00 0.00 H ATOM 7947 H2 WAT 9567 26.634 10.376 95.324 1.00 0.00 H TER 7949 WAT 9567 ATOM 7949 O WAT 9568 97.671 125.381 130.088 1.00 0.00 O ATOM 7950 H1 WAT 9568 98.360 124.903 129.627 1.00 0.00 H ATOM 7951 H2 WAT 9568 96.996 124.725 130.258 1.00 0.00 H TER 7953 WAT 9568 ATOM 7953 O WAT 9569 23.264 56.344 149.151 1.00 0.00 O ATOM 7954 H1 WAT 9569 23.891 55.837 149.666 1.00 0.00 H ATOM 7955 H2 WAT 9569 23.413 56.064 148.248 1.00 0.00 H TER 7957 WAT 9569 ATOM 7957 O WAT 9570 83.310 132.821 106.209 1.00 0.00 O ATOM 7958 H1 WAT 9570 82.651 132.134 106.120 1.00 0.00 H ATOM 7959 H2 WAT 9570 83.078 133.272 107.022 1.00 0.00 H TER 7961 WAT 9570 ATOM 7961 O WAT 9571 26.786 124.169 99.820 1.00 0.00 O ATOM 7962 H1 WAT 9571 27.390 124.472 99.142 1.00 0.00 H ATOM 7963 H2 WAT 9571 26.762 123.218 99.712 1.00 0.00 H TER 7965 WAT 9571 ATOM 7965 O WAT 9572 122.429 60.632 89.541 1.00 0.00 O ATOM 7966 H1 WAT 9572 123.240 60.813 90.015 1.00 0.00 H ATOM 7967 H2 WAT 9572 122.271 59.699 89.684 1.00 0.00 H TER 7969 WAT 9572 ATOM 7969 O WAT 9573 105.452 11.074 2.972 1.00 0.00 O ATOM 7970 H1 WAT 9573 105.406 12.011 2.786 1.00 0.00 H ATOM 7971 H2 WAT 9573 106.367 10.842 2.813 1.00 0.00 H TER 7973 WAT 9573 ATOM 7973 O WAT 9574 87.280 47.596 97.503 1.00 0.00 O ATOM 7974 H1 WAT 9574 86.594 48.043 97.007 1.00 0.00 H ATOM 7975 H2 WAT 9574 88.093 48.009 97.210 1.00 0.00 H TER 7977 WAT 9574 ATOM 7977 O WAT 9575 43.837 65.325 64.973 1.00 0.00 O ATOM 7978 H1 WAT 9575 43.561 64.410 65.008 1.00 0.00 H ATOM 7979 H2 WAT 9575 43.706 65.580 64.059 1.00 0.00 H TER 7981 WAT 9575 ATOM 7981 O WAT 9576 119.797 144.256 81.366 1.00 0.00 O ATOM 7982 H1 WAT 9576 118.997 143.774 81.159 1.00 0.00 H ATOM 7983 H2 WAT 9576 119.748 144.409 82.309 1.00 0.00 H TER 7985 WAT 9576 ATOM 7985 O WAT 9577 70.962 19.847 140.526 1.00 0.00 O ATOM 7986 H1 WAT 9577 71.245 20.364 139.772 1.00 0.00 H ATOM 7987 H2 WAT 9577 71.375 18.992 140.399 1.00 0.00 H TER 7989 WAT 9577 ATOM 7989 O WAT 9578 114.924 8.485 70.192 1.00 0.00 O ATOM 7990 H1 WAT 9578 115.598 7.866 70.471 1.00 0.00 H ATOM 7991 H2 WAT 9578 114.587 8.119 69.374 1.00 0.00 H TER 7993 WAT 9578 ATOM 7993 O WAT 9579 27.821 81.901 137.824 1.00 0.00 O ATOM 7994 H1 WAT 9579 27.899 82.855 137.822 1.00 0.00 H ATOM 7995 H2 WAT 9579 28.718 81.587 137.711 1.00 0.00 H TER 7997 WAT 9579 ATOM 7997 O WAT 9580 25.880 58.461 117.588 1.00 0.00 O ATOM 7998 H1 WAT 9580 25.757 58.494 116.639 1.00 0.00 H ATOM 7999 H2 WAT 9580 25.637 59.336 117.892 1.00 0.00 H TER 8001 WAT 9580 ATOM 8001 O WAT 9581 134.060 117.074 147.002 1.00 0.00 O ATOM 8002 H1 WAT 9581 134.033 116.467 146.262 1.00 0.00 H ATOM 8003 H2 WAT 9581 134.276 116.523 147.755 1.00 0.00 H TER 8005 WAT 9581 ATOM 8005 O WAT 9582 138.651 13.543 86.315 1.00 0.00 O ATOM 8006 H1 WAT 9582 139.114 13.333 87.126 1.00 0.00 H ATOM 8007 H2 WAT 9582 138.775 14.486 86.205 1.00 0.00 H TER 8009 WAT 9582 ATOM 8009 O WAT 9583 47.793 94.322 140.585 1.00 0.00 O ATOM 8010 H1 WAT 9583 48.366 93.845 139.984 1.00 0.00 H ATOM 8011 H2 WAT 9583 46.937 93.906 140.480 1.00 0.00 H TER 8013 WAT 9583 ATOM 8013 O WAT 9584 83.728 41.980 141.020 1.00 0.00 O ATOM 8014 H1 WAT 9584 83.105 42.369 140.406 1.00 0.00 H ATOM 8015 H2 WAT 9584 84.268 42.715 141.312 1.00 0.00 H TER 8017 WAT 9584 ATOM 8017 O WAT 9585 141.659 2.571 103.039 1.00 0.00 O ATOM 8018 H1 WAT 9585 141.777 2.125 103.877 1.00 0.00 H ATOM 8019 H2 WAT 9585 142.096 2.006 102.402 1.00 0.00 H TER 8021 WAT 9585 ATOM 8021 O WAT 9586 41.435 51.212 118.132 1.00 0.00 O ATOM 8022 H1 WAT 9586 41.453 50.979 119.060 1.00 0.00 H ATOM 8023 H2 WAT 9586 42.304 50.977 117.808 1.00 0.00 H TER 8025 WAT 9586 ATOM 8025 O WAT 9587 14.240 101.605 113.540 1.00 0.00 O ATOM 8026 H1 WAT 9587 13.912 101.928 112.701 1.00 0.00 H ATOM 8027 H2 WAT 9587 14.523 102.391 114.006 1.00 0.00 H TER 8029 WAT 9587 ATOM 8029 O WAT 9588 118.912 111.400 131.648 1.00 0.00 O ATOM 8030 H1 WAT 9588 119.566 111.585 132.322 1.00 0.00 H ATOM 8031 H2 WAT 9588 118.113 111.818 131.970 1.00 0.00 H TER 8033 WAT 9588 ATOM 8033 O WAT 9589 81.965 89.621 26.309 1.00 0.00 O ATOM 8034 H1 WAT 9589 81.632 90.354 26.825 1.00 0.00 H ATOM 8035 H2 WAT 9589 82.775 89.365 26.750 1.00 0.00 H TER 8037 WAT 9589 ATOM 8037 O WAT 9590 62.635 124.018 11.550 1.00 0.00 O ATOM 8038 H1 WAT 9590 63.502 124.046 11.954 1.00 0.00 H ATOM 8039 H2 WAT 9590 62.767 124.376 10.673 1.00 0.00 H TER 8041 WAT 9590 ATOM 8041 O WAT 9591 122.285 133.105 4.785 1.00 0.00 O ATOM 8042 H1 WAT 9591 122.616 132.252 5.069 1.00 0.00 H ATOM 8043 H2 WAT 9591 122.911 133.396 4.121 1.00 0.00 H TER 8045 WAT 9591 ATOM 8045 O WAT 9592 120.223 70.381 136.721 1.00 0.00 O ATOM 8046 H1 WAT 9592 119.454 69.842 136.540 1.00 0.00 H ATOM 8047 H2 WAT 9592 120.209 70.508 137.670 1.00 0.00 H TER 8049 WAT 9592 ATOM 8049 O WAT 9593 128.012 66.501 57.310 1.00 0.00 O ATOM 8050 H1 WAT 9593 128.183 65.607 57.013 1.00 0.00 H ATOM 8051 H2 WAT 9593 128.009 67.023 56.508 1.00 0.00 H TER 8053 WAT 9593 ATOM 8053 O WAT 9594 27.857 6.277 17.792 1.00 0.00 O ATOM 8054 H1 WAT 9594 28.079 5.375 18.019 1.00 0.00 H ATOM 8055 H2 WAT 9594 28.304 6.432 16.960 1.00 0.00 H TER 8057 WAT 9594 ATOM 8057 O WAT 9595 98.293 76.258 102.751 1.00 0.00 O ATOM 8058 H1 WAT 9595 98.727 76.759 103.441 1.00 0.00 H ATOM 8059 H2 WAT 9595 97.969 75.473 103.192 1.00 0.00 H TER 8061 WAT 9595 ATOM 8061 O WAT 9596 93.328 86.915 27.304 1.00 0.00 O ATOM 8062 H1 WAT 9596 92.728 87.048 26.571 1.00 0.00 H ATOM 8063 H2 WAT 9596 92.783 87.025 28.083 1.00 0.00 H TER 8065 WAT 9596 ATOM 8065 O WAT 9597 137.412 30.980 11.212 1.00 0.00 O ATOM 8066 H1 WAT 9597 138.220 30.673 10.802 1.00 0.00 H ATOM 8067 H2 WAT 9597 136.721 30.468 10.792 1.00 0.00 H TER 8069 WAT 9597 ATOM 8069 O WAT 9598 115.376 74.944 129.937 1.00 0.00 O ATOM 8070 H1 WAT 9598 115.096 75.813 130.223 1.00 0.00 H ATOM 8071 H2 WAT 9598 114.560 74.476 129.759 1.00 0.00 H TER 8073 WAT 9598 ATOM 8073 O WAT 9599 124.820 98.330 104.577 1.00 0.00 O ATOM 8074 H1 WAT 9599 124.143 98.137 105.226 1.00 0.00 H ATOM 8075 H2 WAT 9599 125.189 99.167 104.858 1.00 0.00 H TER 8077 WAT 9599 ATOM 8077 O WAT 9600 17.266 141.990 142.956 1.00 0.00 O ATOM 8078 H1 WAT 9600 16.697 142.725 143.184 1.00 0.00 H ATOM 8079 H2 WAT 9600 16.768 141.214 143.213 1.00 0.00 H TER 8081 WAT 9600 ATOM 8081 O WAT 9601 28.287 77.929 23.108 1.00 0.00 O ATOM 8082 H1 WAT 9601 27.585 77.390 22.745 1.00 0.00 H ATOM 8083 H2 WAT 9601 27.866 78.436 23.802 1.00 0.00 H TER 8085 WAT 9601 ATOM 8085 O WAT 9602 7.588 16.543 157.204 1.00 0.00 O ATOM 8086 H1 WAT 9602 7.351 17.228 157.828 1.00 0.00 H ATOM 8087 H2 WAT 9602 6.758 16.292 156.797 1.00 0.00 H TER 8089 WAT 9602 ATOM 8089 O WAT 9603 5.606 32.459 157.341 1.00 0.00 O ATOM 8090 H1 WAT 9603 5.639 33.142 156.671 1.00 0.00 H ATOM 8091 H2 WAT 9603 6.516 32.178 157.441 1.00 0.00 H TER 8093 WAT 9603 ATOM 8093 O WAT 9604 27.912 59.172 142.843 1.00 0.00 O ATOM 8094 H1 WAT 9604 27.380 59.349 143.618 1.00 0.00 H ATOM 8095 H2 WAT 9604 28.696 59.708 142.963 1.00 0.00 H TER 8097 WAT 9604 ATOM 8097 O WAT 9605 88.018 50.052 113.362 1.00 0.00 O ATOM 8098 H1 WAT 9605 87.838 49.547 112.569 1.00 0.00 H ATOM 8099 H2 WAT 9605 87.731 49.485 114.078 1.00 0.00 H TER 8101 WAT 9605 ATOM 8101 O WAT 9606 127.104 133.770 80.774 1.00 0.00 O ATOM 8102 H1 WAT 9606 126.994 133.290 79.953 1.00 0.00 H ATOM 8103 H2 WAT 9606 127.744 134.452 80.568 1.00 0.00 H TER 8105 WAT 9606 ATOM 8105 O WAT 9607 30.867 110.682 114.382 1.00 0.00 O ATOM 8106 H1 WAT 9607 29.913 110.639 114.458 1.00 0.00 H ATOM 8107 H2 WAT 9607 31.110 109.860 113.956 1.00 0.00 H TER 8109 WAT 9607 ATOM 8109 O WAT 9608 91.869 80.545 138.179 1.00 0.00 O ATOM 8110 H1 WAT 9608 90.976 80.786 137.932 1.00 0.00 H ATOM 8111 H2 WAT 9608 91.872 80.583 139.135 1.00 0.00 H TER 8113 WAT 9608 ATOM 8113 O WAT 9609 80.727 103.512 14.738 1.00 0.00 O ATOM 8114 H1 WAT 9609 80.260 103.195 15.511 1.00 0.00 H ATOM 8115 H2 WAT 9609 81.198 102.746 14.411 1.00 0.00 H TER 8117 WAT 9609 ATOM 8117 O WAT 9610 57.856 68.589 139.570 1.00 0.00 O ATOM 8118 H1 WAT 9610 58.351 69.400 139.460 1.00 0.00 H ATOM 8119 H2 WAT 9610 57.727 68.264 138.679 1.00 0.00 H TER 8121 WAT 9610 ATOM 8121 O WAT 9611 111.072 28.227 16.460 1.00 0.00 O ATOM 8122 H1 WAT 9611 110.729 27.805 15.672 1.00 0.00 H ATOM 8123 H2 WAT 9611 110.690 27.729 17.183 1.00 0.00 H TER 8125 WAT 9611 ATOM 8125 O WAT 9612 1.028 94.178 80.722 1.00 0.00 O ATOM 8126 H1 WAT 9612 1.075 95.034 80.295 1.00 0.00 H ATOM 8127 H2 WAT 9612 0.158 94.157 81.120 1.00 0.00 H TER 8129 WAT 9612 ATOM 8129 O WAT 9613 2.028 36.951 103.158 1.00 0.00 O ATOM 8130 H1 WAT 9613 1.216 36.616 103.538 1.00 0.00 H ATOM 8131 H2 WAT 9613 2.627 37.026 103.901 1.00 0.00 H TER 8133 WAT 9613 ATOM 8133 O WAT 9614 2.474 78.290 76.919 1.00 0.00 O ATOM 8134 H1 WAT 9614 1.777 78.651 76.371 1.00 0.00 H ATOM 8135 H2 WAT 9614 3.071 79.024 77.062 1.00 0.00 H TER 8137 WAT 9614 ATOM 8137 O WAT 9615 39.245 128.522 83.983 1.00 0.00 O ATOM 8138 H1 WAT 9615 39.519 128.140 83.149 1.00 0.00 H ATOM 8139 H2 WAT 9615 39.976 128.350 84.576 1.00 0.00 H TER 8141 WAT 9615 ATOM 8141 O WAT 9616 82.078 11.396 150.015 1.00 0.00 O ATOM 8142 H1 WAT 9616 82.611 12.169 150.202 1.00 0.00 H ATOM 8143 H2 WAT 9616 81.362 11.440 150.648 1.00 0.00 H TER 8145 WAT 9616 ATOM 8145 O WAT 9617 21.418 48.523 148.940 1.00 0.00 O ATOM 8146 H1 WAT 9617 22.334 48.343 148.727 1.00 0.00 H ATOM 8147 H2 WAT 9617 20.960 48.462 148.101 1.00 0.00 H TER 8149 WAT 9617 ATOM 8149 O WAT 9618 90.949 25.507 69.819 1.00 0.00 O ATOM 8150 H1 WAT 9618 89.994 25.477 69.869 1.00 0.00 H ATOM 8151 H2 WAT 9618 91.164 26.437 69.890 1.00 0.00 H TER 8153 WAT 9618 ATOM 8153 O WAT 9619 82.604 29.458 85.498 1.00 0.00 O ATOM 8154 H1 WAT 9619 83.367 29.317 86.059 1.00 0.00 H ATOM 8155 H2 WAT 9619 82.461 30.404 85.523 1.00 0.00 H TER 8157 WAT 9619 ATOM 8157 O WAT 9620 90.010 121.722 128.143 1.00 0.00 O ATOM 8158 H1 WAT 9620 89.274 122.062 127.634 1.00 0.00 H ATOM 8159 H2 WAT 9620 90.137 122.367 128.839 1.00 0.00 H TER 8161 WAT 9620 ATOM 8161 O WAT 9621 76.356 42.681 155.849 1.00 0.00 O ATOM 8162 H1 WAT 9621 76.034 43.260 156.539 1.00 0.00 H ATOM 8163 H2 WAT 9621 75.711 42.763 155.146 1.00 0.00 H TER 8165 WAT 9621 ATOM 8165 O WAT 9622 129.553 58.457 18.472 1.00 0.00 O ATOM 8166 H1 WAT 9622 129.549 57.502 18.532 1.00 0.00 H ATOM 8167 H2 WAT 9622 129.782 58.752 19.354 1.00 0.00 H TER 8169 WAT 9622 ATOM 8169 O WAT 9623 43.314 12.368 75.124 1.00 0.00 O ATOM 8170 H1 WAT 9623 43.845 12.856 74.495 1.00 0.00 H ATOM 8171 H2 WAT 9623 43.859 12.315 75.909 1.00 0.00 H TER 8173 WAT 9623 ATOM 8173 O WAT 9624 21.481 73.133 60.567 1.00 0.00 O ATOM 8174 H1 WAT 9624 21.851 73.969 60.851 1.00 0.00 H ATOM 8175 H2 WAT 9624 20.536 73.242 60.673 1.00 0.00 H TER 8177 WAT 9624 ATOM 8177 O WAT 9625 25.438 90.760 120.139 1.00 0.00 O ATOM 8178 H1 WAT 9625 24.491 90.709 120.012 1.00 0.00 H ATOM 8179 H2 WAT 9625 25.741 91.354 119.452 1.00 0.00 H TER 8181 WAT 9625 ATOM 8181 O WAT 9626 65.025 37.477 95.165 1.00 0.00 O ATOM 8182 H1 WAT 9626 64.229 37.389 94.640 1.00 0.00 H ATOM 8183 H2 WAT 9626 65.394 38.320 94.901 1.00 0.00 H TER 8185 WAT 9626 ATOM 8185 O WAT 9627 136.621 31.543 154.995 1.00 0.00 O ATOM 8186 H1 WAT 9627 136.388 32.183 154.322 1.00 0.00 H ATOM 8187 H2 WAT 9627 136.909 30.773 154.504 1.00 0.00 H TER 8189 WAT 9627 ATOM 8189 O WAT 9628 85.147 107.029 157.677 1.00 0.00 O ATOM 8190 H1 WAT 9628 85.253 107.897 158.066 1.00 0.00 H ATOM 8191 H2 WAT 9628 84.686 107.191 156.854 1.00 0.00 H TER 8193 WAT 9628 ATOM 8193 O WAT 9629 61.394 45.680 71.327 1.00 0.00 O ATOM 8194 H1 WAT 9629 61.955 45.459 72.071 1.00 0.00 H ATOM 8195 H2 WAT 9629 61.445 44.915 70.754 1.00 0.00 H TER 8197 WAT 9629 ATOM 8197 O WAT 9630 124.295 60.705 119.138 1.00 0.00 O ATOM 8198 H1 WAT 9630 124.003 61.241 118.401 1.00 0.00 H ATOM 8199 H2 WAT 9630 123.535 60.165 119.358 1.00 0.00 H TER 8201 WAT 9630 ATOM 8201 O WAT 9631 29.652 129.789 11.430 1.00 0.00 O ATOM 8202 H1 WAT 9631 29.537 130.247 12.262 1.00 0.00 H ATOM 8203 H2 WAT 9631 28.810 129.887 10.984 1.00 0.00 H TER 8205 WAT 9631 ATOM 8205 O WAT 9632 6.198 43.597 108.065 1.00 0.00 O ATOM 8206 H1 WAT 9632 5.783 42.736 108.116 1.00 0.00 H ATOM 8207 H2 WAT 9632 6.402 43.818 108.974 1.00 0.00 H TER 8209 WAT 9632 ATOM 8209 O WAT 9633 66.995 12.848 127.382 1.00 0.00 O ATOM 8210 H1 WAT 9633 66.548 13.511 127.908 1.00 0.00 H ATOM 8211 H2 WAT 9633 67.634 13.341 126.867 1.00 0.00 H TER 8213 WAT 9633 ATOM 8213 O WAT 9634 114.041 8.733 102.009 1.00 0.00 O ATOM 8214 H1 WAT 9634 114.813 8.501 101.492 1.00 0.00 H ATOM 8215 H2 WAT 9634 114.311 9.501 102.511 1.00 0.00 H TER 8217 WAT 9634 ATOM 8217 O WAT 9635 48.186 139.729 72.755 1.00 0.00 O ATOM 8218 H1 WAT 9635 47.977 140.643 72.946 1.00 0.00 H ATOM 8219 H2 WAT 9635 47.931 139.612 71.839 1.00 0.00 H TER 8221 WAT 9635 ATOM 8221 O WAT 9636 76.332 59.088 93.174 1.00 0.00 O ATOM 8222 H1 WAT 9636 75.584 58.606 92.822 1.00 0.00 H ATOM 8223 H2 WAT 9636 76.241 59.010 94.124 1.00 0.00 H TER 8225 WAT 9636 ATOM 8225 O WAT 9637 32.881 82.010 95.989 1.00 0.00 O ATOM 8226 H1 WAT 9637 32.840 81.422 96.743 1.00 0.00 H ATOM 8227 H2 WAT 9637 32.116 81.780 95.463 1.00 0.00 H TER 8229 WAT 9637 ATOM 8229 O WAT 9638 70.302 30.593 143.428 1.00 0.00 O ATOM 8230 H1 WAT 9638 70.830 30.590 144.226 1.00 0.00 H ATOM 8231 H2 WAT 9638 70.914 30.348 142.734 1.00 0.00 H TER 8233 WAT 9638 ATOM 8233 O WAT 9639 99.996 39.856 118.602 1.00 0.00 O ATOM 8234 H1 WAT 9639 100.051 40.510 117.905 1.00 0.00 H ATOM 8235 H2 WAT 9639 100.621 39.179 118.345 1.00 0.00 H TER 8237 WAT 9639 ATOM 8237 O WAT 9640 125.025 130.625 154.779 1.00 0.00 O ATOM 8238 H1 WAT 9640 125.411 131.010 155.566 1.00 0.00 H ATOM 8239 H2 WAT 9640 125.489 131.045 154.055 1.00 0.00 H TER 8241 WAT 9640 ATOM 8241 O WAT 9641 36.474 81.540 147.516 1.00 0.00 O ATOM 8242 H1 WAT 9641 36.064 81.801 148.340 1.00 0.00 H ATOM 8243 H2 WAT 9641 36.681 82.366 147.079 1.00 0.00 H TER 8245 WAT 9641 ATOM 8245 O WAT 9642 28.429 109.761 102.291 1.00 0.00 O ATOM 8246 H1 WAT 9642 28.503 110.667 101.993 1.00 0.00 H ATOM 8247 H2 WAT 9642 29.282 109.373 102.093 1.00 0.00 H TER 8249 WAT 9642 ATOM 8249 O WAT 9643 79.682 92.760 21.572 1.00 0.00 O ATOM 8250 H1 WAT 9643 79.916 93.307 22.322 1.00 0.00 H ATOM 8251 H2 WAT 9643 78.754 92.562 21.702 1.00 0.00 H TER 8253 WAT 9643 ATOM 8253 O WAT 9644 83.547 61.995 121.590 1.00 0.00 O ATOM 8254 H1 WAT 9644 83.389 61.166 122.041 1.00 0.00 H ATOM 8255 H2 WAT 9644 84.114 62.487 122.184 1.00 0.00 H TER 8257 WAT 9644 ATOM 8257 O WAT 9645 90.061 103.910 26.287 1.00 0.00 O ATOM 8258 H1 WAT 9645 89.454 104.643 26.388 1.00 0.00 H ATOM 8259 H2 WAT 9645 90.394 103.751 27.170 1.00 0.00 H TER 8261 WAT 9645 ATOM 8261 O WAT 9646 86.276 135.589 58.044 1.00 0.00 O ATOM 8262 H1 WAT 9646 86.662 136.421 58.316 1.00 0.00 H ATOM 8263 H2 WAT 9646 85.425 135.828 57.675 1.00 0.00 H TER 8265 WAT 9646 ATOM 8265 O WAT 9647 28.122 76.112 82.558 1.00 0.00 O ATOM 8266 H1 WAT 9647 27.786 76.963 82.839 1.00 0.00 H ATOM 8267 H2 WAT 9647 27.836 76.030 81.648 1.00 0.00 H TER 8269 WAT 9647 ATOM 8269 O WAT 9648 24.991 84.034 103.782 1.00 0.00 O ATOM 8270 H1 WAT 9648 25.425 84.750 103.318 1.00 0.00 H ATOM 8271 H2 WAT 9648 25.652 83.710 104.394 1.00 0.00 H TER 8273 WAT 9648 ATOM 8273 O WAT 9649 4.877 57.869 70.012 1.00 0.00 O ATOM 8274 H1 WAT 9649 3.994 57.503 69.983 1.00 0.00 H ATOM 8275 H2 WAT 9649 5.426 57.206 69.594 1.00 0.00 H TER 8277 WAT 9649 ATOM 8277 O WAT 9650 133.462 138.679 9.747 1.00 0.00 O ATOM 8278 H1 WAT 9650 132.651 138.583 10.247 1.00 0.00 H ATOM 8279 H2 WAT 9650 133.354 139.501 9.269 1.00 0.00 H TER 8281 WAT 9650 ATOM 8281 O WAT 9651 55.379 64.893 8.417 1.00 0.00 O ATOM 8282 H1 WAT 9651 55.063 65.789 8.532 1.00 0.00 H ATOM 8283 H2 WAT 9651 55.846 64.909 7.581 1.00 0.00 H TER 8285 WAT 9651 ATOM 8285 O WAT 9652 140.996 97.586 89.404 1.00 0.00 O ATOM 8286 H1 WAT 9652 140.203 98.012 89.080 1.00 0.00 H ATOM 8287 H2 WAT 9652 140.821 97.426 90.331 1.00 0.00 H TER 8289 WAT 9652 ATOM 8289 O WAT 9653 89.134 138.854 61.082 1.00 0.00 O ATOM 8290 H1 WAT 9653 90.074 138.797 61.256 1.00 0.00 H ATOM 8291 H2 WAT 9653 88.764 139.219 61.886 1.00 0.00 H TER 8293 WAT 9653 ATOM 8293 O WAT 9654 133.705 134.291 6.206 1.00 0.00 O ATOM 8294 H1 WAT 9654 133.972 134.482 5.306 1.00 0.00 H ATOM 8295 H2 WAT 9654 133.287 135.098 6.507 1.00 0.00 H TER 8297 WAT 9654 ATOM 8297 O WAT 9655 18.812 102.607 108.647 1.00 0.00 O ATOM 8298 H1 WAT 9655 19.060 102.982 107.802 1.00 0.00 H ATOM 8299 H2 WAT 9655 19.388 103.038 109.278 1.00 0.00 H TER 8301 WAT 9655 ATOM 8301 O WAT 9656 6.903 3.092 117.737 1.00 0.00 O ATOM 8302 H1 WAT 9656 7.157 4.014 117.760 1.00 0.00 H ATOM 8303 H2 WAT 9656 7.238 2.772 116.899 1.00 0.00 H TER 8305 WAT 9656 ATOM 8305 O WAT 9657 92.534 57.300 74.086 1.00 0.00 O ATOM 8306 H1 WAT 9657 91.954 57.085 73.356 1.00 0.00 H ATOM 8307 H2 WAT 9657 92.119 56.898 74.848 1.00 0.00 H TER 8309 WAT 9657 ATOM 8309 O WAT 9658 34.302 75.472 79.021 1.00 0.00 O ATOM 8310 H1 WAT 9658 33.622 75.622 78.363 1.00 0.00 H ATOM 8311 H2 WAT 9658 34.375 76.306 79.485 1.00 0.00 H TER 8313 WAT 9658 ATOM 8313 O WAT 9659 135.787 117.857 138.365 1.00 0.00 O ATOM 8314 H1 WAT 9659 135.758 117.182 139.042 1.00 0.00 H ATOM 8315 H2 WAT 9659 136.196 118.609 138.794 1.00 0.00 H TER 8317 WAT 9659 ATOM 8317 O WAT 9660 97.788 130.990 139.001 1.00 0.00 O ATOM 8318 H1 WAT 9660 97.469 130.112 138.793 1.00 0.00 H ATOM 8319 H2 WAT 9660 97.012 131.459 139.309 1.00 0.00 H TER 8321 WAT 9660 ATOM 8321 O WAT 9661 134.082 58.772 98.141 1.00 0.00 O ATOM 8322 H1 WAT 9661 134.651 59.229 97.523 1.00 0.00 H ATOM 8323 H2 WAT 9661 133.238 58.716 97.693 1.00 0.00 H TER 8325 WAT 9661 ATOM 8325 O WAT 9662 138.860 77.909 6.639 1.00 0.00 O ATOM 8326 H1 WAT 9662 139.148 77.139 6.150 1.00 0.00 H ATOM 8327 H2 WAT 9662 138.415 77.552 7.408 1.00 0.00 H TER 8329 WAT 9662 ATOM 8329 O WAT 9663 81.538 114.764 141.688 1.00 0.00 O ATOM 8330 H1 WAT 9663 81.929 114.928 140.830 1.00 0.00 H ATOM 8331 H2 WAT 9663 82.285 114.713 142.285 1.00 0.00 H TER 8333 WAT 9663 ATOM 8333 O WAT 9664 139.841 14.530 93.213 1.00 0.00 O ATOM 8334 H1 WAT 9664 139.182 14.565 93.906 1.00 0.00 H ATOM 8335 H2 WAT 9664 140.656 14.787 93.644 1.00 0.00 H TER 8337 WAT 9664 ATOM 8337 O WAT 9665 66.091 74.126 61.643 1.00 0.00 O ATOM 8338 H1 WAT 9665 66.578 74.739 62.193 1.00 0.00 H ATOM 8339 H2 WAT 9665 66.763 73.565 61.256 1.00 0.00 H TER 8341 WAT 9665 ATOM 8341 O WAT 9666 30.666 0.342 70.238 1.00 0.00 O ATOM 8342 H1 WAT 9666 30.076 0.742 69.599 1.00 0.00 H ATOM 8343 H2 WAT 9666 30.997 1.079 70.752 1.00 0.00 H TER 8345 WAT 9666 ATOM 8345 O WAT 9667 87.667 77.886 116.598 1.00 0.00 O ATOM 8346 H1 WAT 9667 88.435 77.874 117.169 1.00 0.00 H ATOM 8347 H2 WAT 9667 86.923 77.810 117.196 1.00 0.00 H TER 8349 WAT 9667 ATOM 8349 O WAT 9668 107.157 43.809 63.268 1.00 0.00 O ATOM 8350 H1 WAT 9668 107.015 42.894 63.512 1.00 0.00 H ATOM 8351 H2 WAT 9668 108.011 43.811 62.834 1.00 0.00 H TER 8353 WAT 9668 ATOM 8353 O WAT 9669 79.817 50.559 75.916 1.00 0.00 O ATOM 8354 H1 WAT 9669 80.624 50.119 75.652 1.00 0.00 H ATOM 8355 H2 WAT 9669 79.139 49.889 75.829 1.00 0.00 H TER 8357 WAT 9669 ATOM 8357 O WAT 9670 132.663 136.575 109.373 1.00 0.00 O ATOM 8358 H1 WAT 9670 133.460 136.057 109.485 1.00 0.00 H ATOM 8359 H2 WAT 9670 132.153 136.402 110.164 1.00 0.00 H TER 8361 WAT 9670 ATOM 8361 O WAT 9671 37.303 126.548 87.222 1.00 0.00 O ATOM 8362 H1 WAT 9671 37.406 127.442 87.550 1.00 0.00 H ATOM 8363 H2 WAT 9671 37.151 126.654 86.283 1.00 0.00 H TER 8365 WAT 9671 ATOM 8365 O WAT 9672 133.275 54.290 156.577 1.00 0.00 O ATOM 8366 H1 WAT 9672 134.129 54.652 156.339 1.00 0.00 H ATOM 8367 H2 WAT 9672 133.266 54.305 157.534 1.00 0.00 H TER 8369 WAT 9672 ATOM 8369 O WAT 9673 139.169 13.405 59.102 1.00 0.00 O ATOM 8370 H1 WAT 9673 139.298 14.342 58.957 1.00 0.00 H ATOM 8371 H2 WAT 9673 138.337 13.347 59.571 1.00 0.00 H TER 8373 WAT 9673 ATOM 8373 O WAT 9674 97.682 63.747 143.978 1.00 0.00 O ATOM 8374 H1 WAT 9674 97.694 64.586 144.438 1.00 0.00 H ATOM 8375 H2 WAT 9674 97.461 63.972 143.074 1.00 0.00 H TER 8377 WAT 9674 ATOM 8377 O WAT 9675 95.459 52.158 121.609 1.00 0.00 O ATOM 8378 H1 WAT 9675 96.312 51.724 121.629 1.00 0.00 H ATOM 8379 H2 WAT 9675 95.643 53.033 121.267 1.00 0.00 H TER 8381 WAT 9675 ATOM 8381 O WAT 9676 89.368 34.976 77.728 1.00 0.00 O ATOM 8382 H1 WAT 9676 89.681 35.178 76.846 1.00 0.00 H ATOM 8383 H2 WAT 9676 88.416 34.921 77.637 1.00 0.00 H TER 8385 WAT 9676 ATOM 8385 O WAT 9677 21.631 17.852 135.326 1.00 0.00 O ATOM 8386 H1 WAT 9677 22.433 18.312 135.574 1.00 0.00 H ATOM 8387 H2 WAT 9677 21.933 17.005 134.997 1.00 0.00 H TER 8389 WAT 9677 ATOM 8389 O WAT 9678 139.126 15.768 136.941 1.00 0.00 O ATOM 8390 H1 WAT 9678 139.580 16.532 136.587 1.00 0.00 H ATOM 8391 H2 WAT 9678 138.887 15.253 136.171 1.00 0.00 H TER 8393 WAT 9678 ATOM 8393 O WAT 9679 136.061 9.890 130.007 1.00 0.00 O ATOM 8394 H1 WAT 9679 136.493 9.423 130.722 1.00 0.00 H ATOM 8395 H2 WAT 9679 135.645 10.642 130.429 1.00 0.00 H TER 8397 WAT 9679 ATOM 8397 O WAT 9680 6.615 56.737 111.704 1.00 0.00 O ATOM 8398 H1 WAT 9680 6.554 57.361 112.427 1.00 0.00 H ATOM 8399 H2 WAT 9680 6.874 57.268 110.951 1.00 0.00 H TER 8401 WAT 9680 ATOM 8401 O WAT 9681 72.714 57.209 120.911 1.00 0.00 O ATOM 8402 H1 WAT 9681 73.128 56.724 120.197 1.00 0.00 H ATOM 8403 H2 WAT 9681 73.431 57.411 121.511 1.00 0.00 H TER 8405 WAT 9681 ATOM 8405 O WAT 9682 16.604 58.880 64.799 1.00 0.00 O ATOM 8406 H1 WAT 9682 15.908 58.852 65.456 1.00 0.00 H ATOM 8407 H2 WAT 9682 17.003 59.742 64.910 1.00 0.00 H TER 8409 WAT 9682 ATOM 8409 O WAT 9683 91.539 47.262 6.171 1.00 0.00 O ATOM 8410 H1 WAT 9683 90.984 47.544 6.898 1.00 0.00 H ATOM 8411 H2 WAT 9683 91.766 48.072 5.715 1.00 0.00 H TER 8413 WAT 9683 ATOM 8413 O WAT 9684 40.734 43.400 128.075 1.00 0.00 O ATOM 8414 H1 WAT 9684 40.262 43.765 128.824 1.00 0.00 H ATOM 8415 H2 WAT 9684 41.181 42.629 128.426 1.00 0.00 H TER 8417 WAT 9684 ATOM 8417 O WAT 9685 142.059 4.711 144.567 1.00 0.00 O ATOM 8418 H1 WAT 9685 142.036 3.936 144.006 1.00 0.00 H ATOM 8419 H2 WAT 9685 142.842 5.186 144.288 1.00 0.00 H TER 8421 WAT 9685 ATOM 8421 O WAT 9686 96.371 18.410 120.686 1.00 0.00 O ATOM 8422 H1 WAT 9686 96.043 19.289 120.876 1.00 0.00 H ATOM 8423 H2 WAT 9686 96.601 18.050 121.543 1.00 0.00 H TER 8425 WAT 9686 ATOM 8425 O WAT 9687 0.170 85.137 113.406 1.00 0.00 O ATOM 8426 H1 WAT 9687 0.822 84.626 112.927 1.00 0.00 H ATOM 8427 H2 WAT 9687 0.257 86.024 113.058 1.00 0.00 H TER 8429 WAT 9687 ATOM 8429 O WAT 9688 99.155 33.017 77.734 1.00 0.00 O ATOM 8430 H1 WAT 9688 99.850 32.506 78.147 1.00 0.00 H ATOM 8431 H2 WAT 9688 98.380 32.843 78.267 1.00 0.00 H TER 8433 WAT 9688 ATOM 8433 O WAT 9689 29.960 8.763 144.624 1.00 0.00 O ATOM 8434 H1 WAT 9689 29.807 7.955 145.113 1.00 0.00 H ATOM 8435 H2 WAT 9689 29.376 9.403 145.030 1.00 0.00 H TER 8437 WAT 9689 ATOM 8437 O WAT 9690 79.407 58.423 118.344 1.00 0.00 O ATOM 8438 H1 WAT 9690 79.243 58.831 117.493 1.00 0.00 H ATOM 8439 H2 WAT 9690 78.919 58.964 118.966 1.00 0.00 H TER 8441 WAT 9690 ATOM 8441 O WAT 9691 130.169 74.051 13.388 1.00 0.00 O ATOM 8442 H1 WAT 9691 129.798 73.534 12.674 1.00 0.00 H ATOM 8443 H2 WAT 9691 129.549 74.770 13.511 1.00 0.00 H TER 8445 WAT 9691 ATOM 8445 O WAT 9692 55.713 73.630 141.934 1.00 0.00 O ATOM 8446 H1 WAT 9692 55.407 72.959 141.323 1.00 0.00 H ATOM 8447 H2 WAT 9692 56.161 74.270 141.381 1.00 0.00 H TER 8449 WAT 9692 ATOM 8449 O WAT 9693 107.238 1.811 118.282 1.00 0.00 O ATOM 8450 H1 WAT 9693 107.139 0.967 118.722 1.00 0.00 H ATOM 8451 H2 WAT 9693 108.184 1.923 118.188 1.00 0.00 H TER 8453 WAT 9693 ATOM 8453 O WAT 9694 6.975 71.211 18.515 1.00 0.00 O ATOM 8454 H1 WAT 9694 6.812 70.946 19.420 1.00 0.00 H ATOM 8455 H2 WAT 9694 6.485 70.579 17.989 1.00 0.00 H TER 8457 WAT 9694 ATOM 8457 O WAT 9695 119.171 101.474 88.998 1.00 0.00 O ATOM 8458 H1 WAT 9695 118.767 102.202 89.470 1.00 0.00 H ATOM 8459 H2 WAT 9695 120.051 101.407 89.369 1.00 0.00 H TER 8461 WAT 9695 ATOM 8461 O WAT 9696 63.627 93.181 96.148 1.00 0.00 O ATOM 8462 H1 WAT 9696 64.349 92.614 95.878 1.00 0.00 H ATOM 8463 H2 WAT 9696 63.288 92.775 96.945 1.00 0.00 H TER 8465 WAT 9696 ATOM 8465 O WAT 9697 72.355 123.767 81.181 1.00 0.00 O ATOM 8466 H1 WAT 9697 72.351 122.814 81.270 1.00 0.00 H ATOM 8467 H2 WAT 9697 71.568 123.962 80.671 1.00 0.00 H TER 8469 WAT 9697 ATOM 8469 O WAT 9698 18.424 93.595 88.676 1.00 0.00 O ATOM 8470 H1 WAT 9698 17.617 93.949 88.303 1.00 0.00 H ATOM 8471 H2 WAT 9698 19.113 93.888 88.080 1.00 0.00 H TER 8473 WAT 9698 ATOM 8473 O WAT 9699 112.449 138.189 121.174 1.00 0.00 O ATOM 8474 H1 WAT 9699 112.481 137.497 120.513 1.00 0.00 H ATOM 8475 H2 WAT 9699 112.461 139.002 120.670 1.00 0.00 H TER 8477 WAT 9699 ATOM 8477 O WAT 9700 82.644 47.921 7.271 1.00 0.00 O ATOM 8478 H1 WAT 9700 81.751 48.263 7.232 1.00 0.00 H ATOM 8479 H2 WAT 9700 82.627 47.287 7.988 1.00 0.00 H TER 8481 WAT 9700 ATOM 8481 O WAT 9701 14.859 10.102 144.298 1.00 0.00 O ATOM 8482 H1 WAT 9701 15.414 10.644 144.858 1.00 0.00 H ATOM 8483 H2 WAT 9701 15.370 9.982 143.497 1.00 0.00 H TER 8485 WAT 9701 ATOM 8485 O WAT 9702 55.940 7.182 20.258 1.00 0.00 O ATOM 8486 H1 WAT 9702 55.073 7.191 19.853 1.00 0.00 H ATOM 8487 H2 WAT 9702 56.546 7.079 19.523 1.00 0.00 H TER 8489 WAT 9702 ATOM 8489 O WAT 9703 29.564 46.920 134.038 1.00 0.00 O ATOM 8490 H1 WAT 9703 29.509 46.031 133.688 1.00 0.00 H ATOM 8491 H2 WAT 9703 29.179 46.859 134.912 1.00 0.00 H TER 8493 WAT 9703 ATOM 8493 O WAT 9704 73.071 97.605 74.194 1.00 0.00 O ATOM 8494 H1 WAT 9704 73.770 97.103 74.613 1.00 0.00 H ATOM 8495 H2 WAT 9704 72.452 97.789 74.901 1.00 0.00 H TER 8497 WAT 9704 ATOM 8497 O WAT 9705 100.754 106.533 67.883 1.00 0.00 O ATOM 8498 H1 WAT 9705 101.305 106.123 67.216 1.00 0.00 H ATOM 8499 H2 WAT 9705 101.043 106.140 68.707 1.00 0.00 H TER 8501 WAT 9705 ATOM 8501 O WAT 9706 0.585 91.489 21.830 1.00 0.00 O ATOM 8502 H1 WAT 9706 0.951 91.975 21.091 1.00 0.00 H ATOM 8503 H2 WAT 9706 1.049 90.651 21.820 1.00 0.00 H TER 8505 WAT 9706 ATOM 8505 O WAT 9707 61.532 63.468 78.025 1.00 0.00 O ATOM 8506 H1 WAT 9707 60.889 63.352 77.326 1.00 0.00 H ATOM 8507 H2 WAT 9707 62.217 64.009 77.634 1.00 0.00 H TER 8509 WAT 9707 ATOM 8509 O WAT 9708 93.812 57.611 123.178 1.00 0.00 O ATOM 8510 H1 WAT 9708 92.962 57.649 122.741 1.00 0.00 H ATOM 8511 H2 WAT 9708 94.196 56.785 122.885 1.00 0.00 H TER 8513 WAT 9708 ATOM 8513 O WAT 9709 33.333 108.631 142.705 1.00 0.00 O ATOM 8514 H1 WAT 9709 33.644 109.497 142.442 1.00 0.00 H ATOM 8515 H2 WAT 9709 33.167 108.712 143.644 1.00 0.00 H TER 8517 WAT 9709 ATOM 8517 O WAT 9710 94.096 129.212 138.251 1.00 0.00 O ATOM 8518 H1 WAT 9710 94.742 128.549 138.496 1.00 0.00 H ATOM 8519 H2 WAT 9710 94.414 129.559 137.418 1.00 0.00 H TER 8521 WAT 9710 ATOM 8521 O WAT 9711 37.074 101.146 82.720 1.00 0.00 O ATOM 8522 H1 WAT 9711 37.366 101.992 82.379 1.00 0.00 H ATOM 8523 H2 WAT 9711 36.757 100.675 81.949 1.00 0.00 H TER 8525 WAT 9711 ATOM 8525 O WAT 9712 99.007 82.563 78.726 1.00 0.00 O ATOM 8526 H1 WAT 9712 98.623 82.899 77.916 1.00 0.00 H ATOM 8527 H2 WAT 9712 98.485 81.789 78.936 1.00 0.00 H TER 8529 WAT 9712 ATOM 8529 O WAT 9713 44.640 23.211 97.761 1.00 0.00 O ATOM 8530 H1 WAT 9713 45.033 23.139 98.631 1.00 0.00 H ATOM 8531 H2 WAT 9713 45.037 22.500 97.259 1.00 0.00 H TER 8533 WAT 9713 ATOM 8533 O WAT 9714 78.009 45.485 141.975 1.00 0.00 O ATOM 8534 H1 WAT 9714 77.790 44.558 141.879 1.00 0.00 H ATOM 8535 H2 WAT 9714 78.686 45.502 142.651 1.00 0.00 H TER 8537 WAT 9714 ATOM 8537 O WAT 9715 101.324 105.332 32.037 1.00 0.00 O ATOM 8538 H1 WAT 9715 101.395 106.064 31.425 1.00 0.00 H ATOM 8539 H2 WAT 9715 102.139 105.360 32.539 1.00 0.00 H TER 8541 WAT 9715 ATOM 8541 O WAT 9716 55.151 94.215 98.309 1.00 0.00 O ATOM 8542 H1 WAT 9716 55.953 94.270 97.789 1.00 0.00 H ATOM 8543 H2 WAT 9716 55.118 95.045 98.786 1.00 0.00 H TER 8545 WAT 9716 ATOM 8545 O WAT 9717 139.897 33.635 8.303 1.00 0.00 O ATOM 8546 H1 WAT 9717 139.655 34.532 8.073 1.00 0.00 H ATOM 8547 H2 WAT 9717 140.635 33.733 8.905 1.00 0.00 H TER 8549 WAT 9717 ATOM 8549 O WAT 9718 80.611 144.399 129.286 1.00 0.00 O ATOM 8550 H1 WAT 9718 80.003 144.017 129.919 1.00 0.00 H ATOM 8551 H2 WAT 9718 80.332 145.311 129.206 1.00 0.00 H TER 8553 WAT 9718 ATOM 8553 O WAT 9719 138.187 86.352 84.139 1.00 0.00 O ATOM 8554 H1 WAT 9719 138.132 86.641 83.228 1.00 0.00 H ATOM 8555 H2 WAT 9719 138.732 85.566 84.109 1.00 0.00 H TER 8557 WAT 9719 ATOM 8557 O WAT 9720 3.087 92.627 79.706 1.00 0.00 O ATOM 8558 H1 WAT 9720 3.943 93.054 79.681 1.00 0.00 H ATOM 8559 H2 WAT 9720 2.504 93.281 80.092 1.00 0.00 H TER 8561 WAT 9720 ATOM 8561 O WAT 9721 123.141 60.825 131.723 1.00 0.00 O ATOM 8562 H1 WAT 9721 123.448 60.591 132.599 1.00 0.00 H ATOM 8563 H2 WAT 9721 123.050 61.778 131.748 1.00 0.00 H TER 8565 WAT 9721 ATOM 8565 O WAT 9722 102.225 103.390 4.937 1.00 0.00 O ATOM 8566 H1 WAT 9722 102.755 104.024 4.455 1.00 0.00 H ATOM 8567 H2 WAT 9722 101.498 103.904 5.289 1.00 0.00 H TER 8569 WAT 9722 ATOM 8569 O WAT 9723 46.061 34.832 98.379 1.00 0.00 O ATOM 8570 H1 WAT 9723 45.480 34.318 98.940 1.00 0.00 H ATOM 8571 H2 WAT 9723 45.771 34.634 97.488 1.00 0.00 H TER 8573 WAT 9723 ATOM 8573 O WAT 9724 82.354 138.683 107.733 1.00 0.00 O ATOM 8574 H1 WAT 9724 82.859 138.031 107.248 1.00 0.00 H ATOM 8575 H2 WAT 9724 82.119 139.340 107.079 1.00 0.00 H TER 8577 WAT 9724 ATOM 8577 O WAT 9725 103.276 45.831 125.374 1.00 0.00 O ATOM 8578 H1 WAT 9725 102.412 46.231 125.270 1.00 0.00 H ATOM 8579 H2 WAT 9725 103.541 45.599 124.483 1.00 0.00 H TER 8581 WAT 9725 ATOM 8581 O WAT 9726 113.592 138.969 72.222 1.00 0.00 O ATOM 8582 H1 WAT 9726 114.335 139.571 72.175 1.00 0.00 H ATOM 8583 H2 WAT 9726 113.672 138.557 73.082 1.00 0.00 H TER 8585 WAT 9726 ATOM 8585 O WAT 9727 78.604 38.369 116.876 1.00 0.00 O ATOM 8586 H1 WAT 9727 78.140 39.103 116.474 1.00 0.00 H ATOM 8587 H2 WAT 9727 79.398 38.270 116.351 1.00 0.00 H TER 8589 WAT 9727 ATOM 8589 O WAT 9728 107.771 18.761 124.280 1.00 0.00 O ATOM 8590 H1 WAT 9728 108.117 19.006 125.138 1.00 0.00 H ATOM 8591 H2 WAT 9728 108.045 17.852 124.161 1.00 0.00 H TER 8593 WAT 9728 ATOM 8593 O WAT 9729 70.105 69.214 11.627 1.00 0.00 O ATOM 8594 H1 WAT 9729 70.201 69.242 10.675 1.00 0.00 H ATOM 8595 H2 WAT 9729 70.467 68.364 11.878 1.00 0.00 H TER 8597 WAT 9729 ATOM 8597 O WAT 9730 24.280 57.257 78.436 1.00 0.00 O ATOM 8598 H1 WAT 9730 23.429 57.630 78.205 1.00 0.00 H ATOM 8599 H2 WAT 9730 24.089 56.651 79.152 1.00 0.00 H TER 8601 WAT 9730 ATOM 8601 O WAT 9731 55.119 15.522 126.827 1.00 0.00 O ATOM 8602 H1 WAT 9731 54.222 15.435 126.503 1.00 0.00 H ATOM 8603 H2 WAT 9731 55.209 16.452 127.036 1.00 0.00 H TER 8605 WAT 9731 ATOM 8605 O WAT 9732 44.317 121.715 137.237 1.00 0.00 O ATOM 8606 H1 WAT 9732 43.485 122.040 136.894 1.00 0.00 H ATOM 8607 H2 WAT 9732 44.402 120.837 136.866 1.00 0.00 H TER 8609 WAT 9732 ATOM 8609 O WAT 9733 123.044 74.672 21.078 1.00 0.00 O ATOM 8610 H1 WAT 9733 122.228 75.117 21.307 1.00 0.00 H ATOM 8611 H2 WAT 9733 123.718 75.138 21.575 1.00 0.00 H TER 8613 WAT 9733 ATOM 8613 O WAT 9734 80.140 75.107 71.795 1.00 0.00 O ATOM 8614 H1 WAT 9734 79.670 75.052 72.627 1.00 0.00 H ATOM 8615 H2 WAT 9734 80.940 75.589 72.003 1.00 0.00 H TER 8617 WAT 9734 ATOM 8617 O WAT 9735 95.243 38.961 87.102 1.00 0.00 O ATOM 8618 H1 WAT 9735 96.110 39.361 87.027 1.00 0.00 H ATOM 8619 H2 WAT 9735 94.641 39.633 86.784 1.00 0.00 H TER 8621 WAT 9735 ATOM 8621 O WAT 9736 59.878 98.345 113.270 1.00 0.00 O ATOM 8622 H1 WAT 9736 60.665 97.804 113.345 1.00 0.00 H ATOM 8623 H2 WAT 9736 59.538 98.395 114.163 1.00 0.00 H TER 8625 WAT 9736 ATOM 8625 O WAT 9737 93.212 86.566 125.572 1.00 0.00 O ATOM 8626 H1 WAT 9737 93.086 87.202 126.277 1.00 0.00 H ATOM 8627 H2 WAT 9737 94.107 86.248 125.693 1.00 0.00 H TER 8629 WAT 9737 ATOM 8629 O WAT 9738 31.424 37.831 155.270 1.00 0.00 O ATOM 8630 H1 WAT 9738 30.888 38.180 154.557 1.00 0.00 H ATOM 8631 H2 WAT 9738 32.263 37.623 154.859 1.00 0.00 H TER 8633 WAT 9738 ATOM 8633 O WAT 9739 25.042 0.661 3.173 1.00 0.00 O ATOM 8634 H1 WAT 9739 25.257 0.942 4.063 1.00 0.00 H ATOM 8635 H2 WAT 9739 25.602 1.197 2.611 1.00 0.00 H TER 8637 WAT 9739 ATOM 8637 O WAT 9740 12.662 129.384 121.921 1.00 0.00 O ATOM 8638 H1 WAT 9740 12.297 130.036 121.323 1.00 0.00 H ATOM 8639 H2 WAT 9740 12.165 129.496 122.731 1.00 0.00 H TER 8641 WAT 9740 ATOM 8641 O WAT 9741 91.418 100.585 80.858 1.00 0.00 O ATOM 8642 H1 WAT 9741 92.352 100.604 80.651 1.00 0.00 H ATOM 8643 H2 WAT 9741 90.984 100.770 80.025 1.00 0.00 H TER 8645 WAT 9741 ATOM 8645 O WAT 9742 70.086 32.535 79.836 1.00 0.00 O ATOM 8646 H1 WAT 9742 70.626 33.202 79.413 1.00 0.00 H ATOM 8647 H2 WAT 9742 69.957 31.868 79.162 1.00 0.00 H TER 8649 WAT 9742 ATOM 8649 O WAT 9743 114.985 112.870 77.328 1.00 0.00 O ATOM 8650 H1 WAT 9743 115.525 112.445 77.995 1.00 0.00 H ATOM 8651 H2 WAT 9743 114.104 112.526 77.478 1.00 0.00 H TER 8653 WAT 9743 ATOM 8653 O WAT 9744 141.085 142.573 99.540 1.00 0.00 O ATOM 8654 H1 WAT 9744 140.149 142.631 99.728 1.00 0.00 H ATOM 8655 H2 WAT 9744 141.133 142.117 98.700 1.00 0.00 H TER 8657 WAT 9744 ATOM 8657 O WAT 9745 121.727 7.786 113.501 1.00 0.00 O ATOM 8658 H1 WAT 9745 121.910 8.641 113.110 1.00 0.00 H ATOM 8659 H2 WAT 9745 121.892 7.910 114.436 1.00 0.00 H TER 8661 WAT 9745 ATOM 8661 O WAT 9746 110.092 72.560 118.614 1.00 0.00 O ATOM 8662 H1 WAT 9746 110.554 72.323 119.418 1.00 0.00 H ATOM 8663 H2 WAT 9746 110.313 71.863 117.996 1.00 0.00 H TER 8665 WAT 9746 ATOM 8665 O WAT 9747 10.303 144.783 70.499 1.00 0.00 O ATOM 8666 H1 WAT 9747 10.440 145.500 71.119 1.00 0.00 H ATOM 8667 H2 WAT 9747 11.175 144.411 70.367 1.00 0.00 H TER 8669 WAT 9747 ATOM 8669 O WAT 9748 144.773 141.528 15.582 1.00 0.00 O ATOM 8670 H1 WAT 9748 145.004 140.729 15.109 1.00 0.00 H ATOM 8671 H2 WAT 9748 143.861 141.397 15.843 1.00 0.00 H TER 8673 WAT 9748 ATOM 8673 O WAT 9749 22.308 0.276 121.950 1.00 0.00 O ATOM 8674 H1 WAT 9749 22.128 0.724 122.776 1.00 0.00 H ATOM 8675 H2 WAT 9749 22.136 -0.648 122.135 1.00 0.00 H TER 8677 WAT 9749 ATOM 8677 O WAT 9750 67.794 54.619 96.403 1.00 0.00 O ATOM 8678 H1 WAT 9750 67.167 54.576 95.681 1.00 0.00 H ATOM 8679 H2 WAT 9750 68.132 55.514 96.374 1.00 0.00 H TER 8681 WAT 9750 ATOM 8681 O WAT 9751 21.206 97.390 7.085 1.00 0.00 O ATOM 8682 H1 WAT 9751 21.785 96.958 7.713 1.00 0.00 H ATOM 8683 H2 WAT 9751 20.628 97.930 7.624 1.00 0.00 H TER 8685 WAT 9751 ATOM 8685 O WAT 9752 56.572 26.716 19.410 1.00 0.00 O ATOM 8686 H1 WAT 9752 57.191 27.194 18.857 1.00 0.00 H ATOM 8687 H2 WAT 9752 57.044 26.574 20.230 1.00 0.00 H TER 8689 WAT 9752 ATOM 8689 O WAT 9753 50.429 20.425 128.566 1.00 0.00 O ATOM 8690 H1 WAT 9753 50.263 20.644 129.483 1.00 0.00 H ATOM 8691 H2 WAT 9753 50.824 19.554 128.595 1.00 0.00 H TER 8693 WAT 9753 ATOM 8693 O WAT 9754 87.438 23.766 78.647 1.00 0.00 O ATOM 8694 H1 WAT 9754 86.927 22.960 78.578 1.00 0.00 H ATOM 8695 H2 WAT 9754 86.999 24.379 78.057 1.00 0.00 H TER 8697 WAT 9754 ATOM 8697 O WAT 9755 122.605 119.942 89.112 1.00 0.00 O ATOM 8698 H1 WAT 9755 123.364 120.227 89.620 1.00 0.00 H ATOM 8699 H2 WAT 9755 122.941 119.245 88.549 1.00 0.00 H TER 8701 WAT 9755 ATOM 8701 O WAT 9756 124.801 137.253 96.001 1.00 0.00 O ATOM 8702 H1 WAT 9756 125.304 138.021 95.729 1.00 0.00 H ATOM 8703 H2 WAT 9756 123.987 137.613 96.354 1.00 0.00 H TER 8705 WAT 9756 ATOM 8705 O WAT 9757 11.854 102.686 138.415 1.00 0.00 O ATOM 8706 H1 WAT 9757 11.860 102.148 139.206 1.00 0.00 H ATOM 8707 H2 WAT 9757 10.935 102.711 138.148 1.00 0.00 H TER 8709 WAT 9757 ATOM 8709 O WAT 9758 103.284 9.381 95.367 1.00 0.00 O ATOM 8710 H1 WAT 9758 102.338 9.476 95.250 1.00 0.00 H ATOM 8711 H2 WAT 9758 103.561 8.826 94.638 1.00 0.00 H TER 8713 WAT 9758 ATOM 8713 O WAT 9759 63.159 20.288 12.975 1.00 0.00 O ATOM 8714 H1 WAT 9759 62.205 20.238 12.913 1.00 0.00 H ATOM 8715 H2 WAT 9759 63.453 19.382 12.886 1.00 0.00 H TER 8717 WAT 9759 ATOM 8717 O WAT 9760 46.551 81.839 140.766 1.00 0.00 O ATOM 8718 H1 WAT 9760 45.795 81.965 141.340 1.00 0.00 H ATOM 8719 H2 WAT 9760 46.711 80.895 140.784 1.00 0.00 H TER 8721 WAT 9760 ATOM 8721 O WAT 9761 6.283 93.325 120.703 1.00 0.00 O ATOM 8722 H1 WAT 9761 5.639 92.877 121.251 1.00 0.00 H ATOM 8723 H2 WAT 9761 5.789 93.599 119.930 1.00 0.00 H TER 8725 WAT 9761 ATOM 8725 O WAT 9762 63.721 121.388 86.261 1.00 0.00 O ATOM 8726 H1 WAT 9762 64.041 122.277 86.106 1.00 0.00 H ATOM 8727 H2 WAT 9762 64.483 120.915 86.596 1.00 0.00 H TER 8729 WAT 9762 ATOM 8729 O WAT 9763 139.958 137.268 78.166 1.00 0.00 O ATOM 8730 H1 WAT 9763 139.845 137.734 77.338 1.00 0.00 H ATOM 8731 H2 WAT 9763 140.748 137.649 78.550 1.00 0.00 H TER 8733 WAT 9763 ATOM 8733 O WAT 9764 115.914 138.942 114.205 1.00 0.00 O ATOM 8734 H1 WAT 9764 115.510 139.680 114.662 1.00 0.00 H ATOM 8735 H2 WAT 9764 115.209 138.300 114.117 1.00 0.00 H TER 8737 WAT 9764 ATOM 8737 O WAT 9765 73.415 79.543 157.841 1.00 0.00 O ATOM 8738 H1 WAT 9765 73.840 79.141 158.599 1.00 0.00 H ATOM 8739 H2 WAT 9765 74.138 79.793 157.266 1.00 0.00 H TER 8741 WAT 9765 ATOM 8741 O WAT 9766 27.012 109.538 76.156 1.00 0.00 O ATOM 8742 H1 WAT 9766 26.703 109.499 77.061 1.00 0.00 H ATOM 8743 H2 WAT 9766 26.680 108.734 75.755 1.00 0.00 H TER 8745 WAT 9766 ATOM 8745 O WAT 9767 58.687 35.369 102.560 1.00 0.00 O ATOM 8746 H1 WAT 9767 59.391 35.339 101.913 1.00 0.00 H ATOM 8747 H2 WAT 9767 57.889 35.473 102.042 1.00 0.00 H TER 8749 WAT 9767 ATOM 8749 O WAT 9768 134.911 125.809 145.408 1.00 0.00 O ATOM 8750 H1 WAT 9768 134.741 124.891 145.619 1.00 0.00 H ATOM 8751 H2 WAT 9768 135.866 125.881 145.404 1.00 0.00 H TER 8753 WAT 9768 ATOM 8753 O WAT 9769 144.621 33.158 156.038 1.00 0.00 O ATOM 8754 H1 WAT 9769 143.873 32.590 156.223 1.00 0.00 H ATOM 8755 H2 WAT 9769 144.747 33.660 156.843 1.00 0.00 H TER 8757 WAT 9769 ATOM 8757 O WAT 9770 91.901 39.923 11.443 1.00 0.00 O ATOM 8758 H1 WAT 9770 92.061 39.532 10.583 1.00 0.00 H ATOM 8759 H2 WAT 9770 90.977 40.172 11.424 1.00 0.00 H TER 8761 WAT 9770 ATOM 8761 O WAT 9771 117.331 28.830 130.801 1.00 0.00 O ATOM 8762 H1 WAT 9771 116.867 29.624 131.067 1.00 0.00 H ATOM 8763 H2 WAT 9771 117.730 28.504 131.607 1.00 0.00 H TER 8765 WAT 9771 ATOM 8765 O WAT 9772 10.720 138.195 153.753 1.00 0.00 O ATOM 8766 H1 WAT 9772 11.504 138.600 153.384 1.00 0.00 H ATOM 8767 H2 WAT 9772 10.099 138.917 153.849 1.00 0.00 H TER 8769 WAT 9772 ATOM 8769 O WAT 9773 37.153 55.409 99.341 1.00 0.00 O ATOM 8770 H1 WAT 9773 37.436 55.777 98.504 1.00 0.00 H ATOM 8771 H2 WAT 9773 37.187 56.148 99.950 1.00 0.00 H TER 8773 WAT 9773 ATOM 8773 O WAT 9774 90.515 47.096 14.674 1.00 0.00 O ATOM 8774 H1 WAT 9774 90.883 46.568 15.384 1.00 0.00 H ATOM 8775 H2 WAT 9774 90.807 46.658 13.875 1.00 0.00 H TER 8777 WAT 9774 ATOM 8777 O WAT 9775 108.416 121.454 102.388 1.00 0.00 O ATOM 8778 H1 WAT 9775 109.118 121.330 103.027 1.00 0.00 H ATOM 8779 H2 WAT 9775 108.450 122.387 102.175 1.00 0.00 H TER 8781 WAT 9775 ATOM 8781 O WAT 9776 22.862 62.788 73.127 1.00 0.00 O ATOM 8782 H1 WAT 9776 22.283 62.898 72.372 1.00 0.00 H ATOM 8783 H2 WAT 9776 22.271 62.741 73.878 1.00 0.00 H TER 8785 WAT 9776 ATOM 8785 O WAT 9777 50.041 57.994 86.025 1.00 0.00 O ATOM 8786 H1 WAT 9777 50.540 58.698 85.610 1.00 0.00 H ATOM 8787 H2 WAT 9777 49.388 57.747 85.371 1.00 0.00 H TER 8789 WAT 9777 ATOM 8789 O WAT 9778 121.228 90.516 133.687 1.00 0.00 O ATOM 8790 H1 WAT 9778 120.969 91.377 134.016 1.00 0.00 H ATOM 8791 H2 WAT 9778 120.480 89.951 133.882 1.00 0.00 H TER 8793 WAT 9778 ATOM 8793 O WAT 9779 120.605 32.020 8.217 1.00 0.00 O ATOM 8794 H1 WAT 9779 121.100 32.813 8.423 1.00 0.00 H ATOM 8795 H2 WAT 9779 119.702 32.322 8.111 1.00 0.00 H TER 8797 WAT 9779 ATOM 8797 O WAT 9780 144.901 113.108 23.647 1.00 0.00 O ATOM 8798 H1 WAT 9780 145.601 113.098 22.995 1.00 0.00 H ATOM 8799 H2 WAT 9780 145.050 112.322 24.172 1.00 0.00 H TER 8801 WAT 9780 ATOM 8801 O WAT 9781 62.618 118.964 148.669 1.00 0.00 O ATOM 8802 H1 WAT 9781 63.208 119.401 149.284 1.00 0.00 H ATOM 8803 H2 WAT 9781 61.748 119.073 149.053 1.00 0.00 H TER 8805 WAT 9781 ATOM 8805 O WAT 9782 46.149 19.049 67.696 1.00 0.00 O ATOM 8806 H1 WAT 9782 45.279 19.134 67.306 1.00 0.00 H ATOM 8807 H2 WAT 9782 46.578 19.884 67.509 1.00 0.00 H TER 8809 WAT 9782 ATOM 8809 O WAT 9783 59.858 142.157 84.303 1.00 0.00 O ATOM 8810 H1 WAT 9783 60.074 141.816 85.171 1.00 0.00 H ATOM 8811 H2 WAT 9783 59.047 142.647 84.434 1.00 0.00 H TER 8813 WAT 9783 ATOM 8813 O WAT 9784 61.934 70.170 150.942 1.00 0.00 O ATOM 8814 H1 WAT 9784 62.090 70.254 151.883 1.00 0.00 H ATOM 8815 H2 WAT 9784 61.029 70.459 150.823 1.00 0.00 H TER 8817 WAT 9784 ATOM 8817 O WAT 9785 53.835 96.189 129.439 1.00 0.00 O ATOM 8818 H1 WAT 9785 53.351 96.878 129.894 1.00 0.00 H ATOM 8819 H2 WAT 9785 54.125 96.597 128.624 1.00 0.00 H TER 8821 WAT 9785 ATOM 8821 O WAT 9786 134.986 138.444 2.650 1.00 0.00 O ATOM 8822 H1 WAT 9786 135.905 138.634 2.464 1.00 0.00 H ATOM 8823 H2 WAT 9786 134.854 138.752 3.547 1.00 0.00 H TER 8825 WAT 9786 ATOM 8825 O WAT 9787 138.062 35.868 60.996 1.00 0.00 O ATOM 8826 H1 WAT 9787 137.643 36.578 61.483 1.00 0.00 H ATOM 8827 H2 WAT 9787 138.171 36.216 60.111 1.00 0.00 H TER 8829 WAT 9787 ATOM 8829 O WAT 9788 86.953 6.443 80.843 1.00 0.00 O ATOM 8830 H1 WAT 9788 86.979 7.272 81.322 1.00 0.00 H ATOM 8831 H2 WAT 9788 87.322 6.651 79.985 1.00 0.00 H TER 8833 WAT 9788 ATOM 8833 O WAT 9789 109.966 46.581 113.555 1.00 0.00 O ATOM 8834 H1 WAT 9789 109.326 45.957 113.211 1.00 0.00 H ATOM 8835 H2 WAT 9789 110.690 46.549 112.930 1.00 0.00 H TER 8837 WAT 9789 ATOM 8837 O WAT 9790 29.213 102.267 106.554 1.00 0.00 O ATOM 8838 H1 WAT 9790 29.476 103.114 106.192 1.00 0.00 H ATOM 8839 H2 WAT 9790 29.329 102.364 107.499 1.00 0.00 H TER 8841 WAT 9790 ATOM 8841 O WAT 9791 128.868 125.956 133.065 1.00 0.00 O ATOM 8842 H1 WAT 9791 128.014 126.368 133.200 1.00 0.00 H ATOM 8843 H2 WAT 9791 129.450 126.681 132.839 1.00 0.00 H TER 8845 WAT 9791 ATOM 8845 O WAT 9792 3.865 30.548 22.666 1.00 0.00 O ATOM 8846 H1 WAT 9792 3.623 30.610 23.590 1.00 0.00 H ATOM 8847 H2 WAT 9792 3.897 31.456 22.365 1.00 0.00 H TER 8849 WAT 9792 ATOM 8849 O WAT 9793 75.846 88.294 100.004 1.00 0.00 O ATOM 8850 H1 WAT 9793 75.342 87.534 100.295 1.00 0.00 H ATOM 8851 H2 WAT 9793 76.383 88.529 100.761 1.00 0.00 H TER 8853 WAT 9793 ATOM 8853 O WAT 9794 99.673 79.950 9.090 1.00 0.00 O ATOM 8854 H1 WAT 9794 99.543 80.014 8.144 1.00 0.00 H ATOM 8855 H2 WAT 9794 99.498 79.031 9.295 1.00 0.00 H TER 8857 WAT 9794 ATOM 8857 O WAT 9795 81.816 8.055 87.855 1.00 0.00 O ATOM 8858 H1 WAT 9795 81.994 8.711 87.180 1.00 0.00 H ATOM 8859 H2 WAT 9795 81.935 7.216 87.410 1.00 0.00 H TER 8861 WAT 9795 ATOM 8861 O WAT 9796 113.723 20.221 108.234 1.00 0.00 O ATOM 8862 H1 WAT 9796 113.381 19.732 107.486 1.00 0.00 H ATOM 8863 H2 WAT 9796 113.047 20.132 108.907 1.00 0.00 H TER 8865 WAT 9796 ATOM 8865 O WAT 9797 85.669 140.304 9.282 1.00 0.00 O ATOM 8866 H1 WAT 9797 84.723 140.432 9.216 1.00 0.00 H ATOM 8867 H2 WAT 9797 85.922 139.940 8.434 1.00 0.00 H TER 8869 WAT 9797 ATOM 8869 O WAT 9798 56.266 74.366 65.198 1.00 0.00 O ATOM 8870 H1 WAT 9798 57.221 74.397 65.254 1.00 0.00 H ATOM 8871 H2 WAT 9798 56.022 73.580 65.687 1.00 0.00 H TER 8873 WAT 9798 ATOM 8873 O WAT 9799 127.965 49.492 152.995 1.00 0.00 O ATOM 8874 H1 WAT 9799 127.236 50.069 153.223 1.00 0.00 H ATOM 8875 H2 WAT 9799 127.597 48.882 152.355 1.00 0.00 H TER 8877 WAT 9799 ATOM 8877 O WAT 9800 64.248 3.056 146.761 1.00 0.00 O ATOM 8878 H1 WAT 9800 64.689 2.276 147.097 1.00 0.00 H ATOM 8879 H2 WAT 9800 64.653 3.783 147.233 1.00 0.00 H TER 8881 WAT 9800 ATOM 8881 O WAT 9801 133.867 140.755 6.384 1.00 0.00 O ATOM 8882 H1 WAT 9801 133.248 141.114 5.748 1.00 0.00 H ATOM 8883 H2 WAT 9801 134.719 141.092 6.106 1.00 0.00 H TER 8885 WAT 9801 ATOM 8885 O WAT 9802 132.374 0.427 154.037 1.00 0.00 O ATOM 8886 H1 WAT 9802 132.597 1.215 153.542 1.00 0.00 H ATOM 8887 H2 WAT 9802 132.769 -0.288 153.538 1.00 0.00 H TER 8889 WAT 9802 ATOM 8889 O WAT 9803 121.049 137.622 146.934 1.00 0.00 O ATOM 8890 H1 WAT 9803 121.322 136.809 147.359 1.00 0.00 H ATOM 8891 H2 WAT 9803 120.960 137.391 146.010 1.00 0.00 H TER 8893 WAT 9803 ATOM 8893 O WAT 9804 105.618 32.051 72.943 1.00 0.00 O ATOM 8894 H1 WAT 9804 105.223 32.676 72.335 1.00 0.00 H ATOM 8895 H2 WAT 9804 104.980 31.971 73.652 1.00 0.00 H TER 8897 WAT 9804 ATOM 8897 O WAT 9805 43.168 1.591 15.904 1.00 0.00 O ATOM 8898 H1 WAT 9805 42.600 1.406 16.652 1.00 0.00 H ATOM 8899 H2 WAT 9805 43.790 2.241 16.230 1.00 0.00 H TER 8901 WAT 9805 ATOM 8901 O WAT 9806 138.325 132.014 24.000 1.00 0.00 O ATOM 8902 H1 WAT 9806 138.275 131.543 24.831 1.00 0.00 H ATOM 8903 H2 WAT 9806 138.766 132.835 24.216 1.00 0.00 H TER 8905 WAT 9806 ATOM 8905 O WAT 9807 87.482 45.494 19.085 1.00 0.00 O ATOM 8906 H1 WAT 9807 86.692 45.230 19.558 1.00 0.00 H ATOM 8907 H2 WAT 9807 88.202 45.254 19.669 1.00 0.00 H TER 8909 WAT 9807 ATOM 8909 O WAT 9808 115.262 46.243 103.237 1.00 0.00 O ATOM 8910 H1 WAT 9808 114.424 46.582 103.553 1.00 0.00 H ATOM 8911 H2 WAT 9808 115.078 45.944 102.346 1.00 0.00 H TER 8913 WAT 9808 ATOM 8913 O WAT 9809 3.270 141.156 8.384 1.00 0.00 O ATOM 8914 H1 WAT 9809 4.081 141.646 8.251 1.00 0.00 H ATOM 8915 H2 WAT 9809 2.629 141.597 7.825 1.00 0.00 H TER 8917 WAT 9809 ATOM 8917 O WAT 9810 36.367 81.593 120.372 1.00 0.00 O ATOM 8918 H1 WAT 9810 36.959 82.017 119.751 1.00 0.00 H ATOM 8919 H2 WAT 9810 36.507 80.656 120.235 1.00 0.00 H TER 8921 WAT 9810 ATOM 8921 O WAT 9811 123.193 54.251 68.686 1.00 0.00 O ATOM 8922 H1 WAT 9811 122.841 53.866 69.488 1.00 0.00 H ATOM 8923 H2 WAT 9811 123.686 53.541 68.275 1.00 0.00 H TER 8925 WAT 9811 ATOM 8925 O WAT 9812 33.130 20.031 83.689 1.00 0.00 O ATOM 8926 H1 WAT 9812 33.616 20.648 83.142 1.00 0.00 H ATOM 8927 H2 WAT 9812 33.543 20.097 84.550 1.00 0.00 H TER 8929 WAT 9812 ATOM 8929 O WAT 9813 55.772 31.357 88.772 1.00 0.00 O ATOM 8930 H1 WAT 9813 55.176 30.757 89.220 1.00 0.00 H ATOM 8931 H2 WAT 9813 56.315 30.791 88.224 1.00 0.00 H TER 8933 WAT 9813 ATOM 8933 O WAT 9814 86.120 98.525 97.066 1.00 0.00 O ATOM 8934 H1 WAT 9814 86.563 99.297 96.714 1.00 0.00 H ATOM 8935 H2 WAT 9814 85.726 98.828 97.884 1.00 0.00 H TER 8937 WAT 9814 ATOM 8937 O WAT 9815 17.671 128.142 14.608 1.00 0.00 O ATOM 8938 H1 WAT 9815 17.815 128.194 15.553 1.00 0.00 H ATOM 8939 H2 WAT 9815 17.358 127.249 14.462 1.00 0.00 H TER 8941 WAT 9815 ATOM 8941 O WAT 9816 30.499 102.389 -0.009 1.00 0.00 O ATOM 8942 H1 WAT 9816 30.314 102.892 0.784 1.00 0.00 H ATOM 8943 H2 WAT 9816 30.790 103.043 -0.645 1.00 0.00 H TER 8945 WAT 9816 ATOM 8945 O WAT 9817 19.101 83.425 12.030 1.00 0.00 O ATOM 8946 H1 WAT 9817 18.951 82.492 11.874 1.00 0.00 H ATOM 8947 H2 WAT 9817 19.175 83.499 12.982 1.00 0.00 H TER 8949 WAT 9817 ATOM 8949 O WAT 9818 32.023 34.719 150.127 1.00 0.00 O ATOM 8950 H1 WAT 9818 31.190 35.112 149.866 1.00 0.00 H ATOM 8951 H2 WAT 9818 32.434 35.378 150.686 1.00 0.00 H TER 8953 WAT 9818 ATOM 8953 O WAT 9819 16.371 106.922 68.261 1.00 0.00 O ATOM 8954 H1 WAT 9819 16.554 107.532 67.546 1.00 0.00 H ATOM 8955 H2 WAT 9819 15.662 107.335 68.753 1.00 0.00 H TER 8957 WAT 9819 ATOM 8957 O WAT 9820 33.469 58.391 93.942 1.00 0.00 O ATOM 8958 H1 WAT 9820 32.569 58.119 93.764 1.00 0.00 H ATOM 8959 H2 WAT 9820 33.379 59.196 94.453 1.00 0.00 H TER 8961 WAT 9820 ATOM 8961 O WAT 9821 42.679 4.029 94.025 1.00 0.00 O ATOM 8962 H1 WAT 9821 43.004 4.060 93.126 1.00 0.00 H ATOM 8963 H2 WAT 9821 43.341 3.529 94.503 1.00 0.00 H TER 8965 WAT 9821 ATOM 8965 O WAT 9822 114.290 102.228 16.353 1.00 0.00 O ATOM 8966 H1 WAT 9822 115.175 102.587 16.403 1.00 0.00 H ATOM 8967 H2 WAT 9822 114.152 102.059 15.421 1.00 0.00 H TER 8969 WAT 9822 ATOM 8969 O WAT 9823 3.271 66.824 136.748 1.00 0.00 O ATOM 8970 H1 WAT 9823 2.322 66.805 136.619 1.00 0.00 H ATOM 8971 H2 WAT 9823 3.441 66.119 137.373 1.00 0.00 H TER 8973 WAT 9823 ATOM 8973 O WAT 9824 32.274 96.453 67.449 1.00 0.00 O ATOM 8974 H1 WAT 9824 31.941 97.234 67.892 1.00 0.00 H ATOM 8975 H2 WAT 9824 33.032 96.763 66.954 1.00 0.00 H TER 8977 WAT 9824 ATOM 8977 O WAT 9825 65.297 93.078 139.031 1.00 0.00 O ATOM 8978 H1 WAT 9825 65.256 94.003 138.788 1.00 0.00 H ATOM 8979 H2 WAT 9825 64.398 92.852 139.268 1.00 0.00 H TER 8981 WAT 9825 ATOM 8981 O WAT 9826 73.651 19.185 12.256 1.00 0.00 O ATOM 8982 H1 WAT 9826 72.923 18.685 12.628 1.00 0.00 H ATOM 8983 H2 WAT 9826 73.272 20.038 12.045 1.00 0.00 H TER 8985 WAT 9826 ATOM 8985 O WAT 9827 23.280 144.650 134.510 1.00 0.00 O ATOM 8986 H1 WAT 9827 22.566 144.047 134.299 1.00 0.00 H ATOM 8987 H2 WAT 9827 23.622 144.333 135.345 1.00 0.00 H TER 8989 WAT 9827 ATOM 8989 O WAT 9828 119.033 46.958 110.052 1.00 0.00 O ATOM 8990 H1 WAT 9828 119.137 47.867 110.333 1.00 0.00 H ATOM 8991 H2 WAT 9828 118.121 46.897 109.769 1.00 0.00 H TER 8993 WAT 9828 ATOM 8993 O WAT 9829 71.692 121.254 5.720 1.00 0.00 O ATOM 8994 H1 WAT 9829 72.465 121.817 5.763 1.00 0.00 H ATOM 8995 H2 WAT 9829 71.278 121.349 6.578 1.00 0.00 H TER 8997 WAT 9829 ATOM 8997 O WAT 9830 45.250 2.470 125.547 1.00 0.00 O ATOM 8998 H1 WAT 9830 44.293 2.497 125.553 1.00 0.00 H ATOM 8999 H2 WAT 9830 45.466 1.765 124.936 1.00 0.00 H TER 9001 WAT 9830 ATOM 9001 O WAT 9831 48.174 27.480 8.465 1.00 0.00 O ATOM 9002 H1 WAT 9831 47.458 26.845 8.450 1.00 0.00 H ATOM 9003 H2 WAT 9831 48.111 27.893 9.326 1.00 0.00 H TER 9005 WAT 9831 ATOM 9005 O WAT 9832 124.252 23.144 96.722 1.00 0.00 O ATOM 9006 H1 WAT 9832 123.799 22.672 97.421 1.00 0.00 H ATOM 9007 H2 WAT 9832 124.838 23.746 97.181 1.00 0.00 H TER 9009 WAT 9832 ATOM 9009 O WAT 9833 22.042 68.916 108.429 1.00 0.00 O ATOM 9010 H1 WAT 9833 22.501 68.614 109.213 1.00 0.00 H ATOM 9011 H2 WAT 9833 22.495 68.485 107.705 1.00 0.00 H TER 9013 WAT 9833 ATOM 9013 O WAT 9834 143.830 13.322 95.486 1.00 0.00 O ATOM 9014 H1 WAT 9834 143.064 13.837 95.232 1.00 0.00 H ATOM 9015 H2 WAT 9834 143.485 12.661 96.086 1.00 0.00 H TER 9017 WAT 9834 ATOM 9017 O WAT 9835 105.060 22.498 69.851 1.00 0.00 O ATOM 9018 H1 WAT 9835 104.757 21.593 69.777 1.00 0.00 H ATOM 9019 H2 WAT 9835 104.266 23.025 69.758 1.00 0.00 H TER 9021 WAT 9835 ATOM 9021 O WAT 9836 55.311 83.662 83.137 1.00 0.00 O ATOM 9022 H1 WAT 9836 55.237 84.070 84.000 1.00 0.00 H ATOM 9023 H2 WAT 9836 54.750 82.889 83.189 1.00 0.00 H TER 9025 WAT 9836 ATOM 9025 O WAT 9837 68.660 31.853 111.286 1.00 0.00 O ATOM 9026 H1 WAT 9837 69.482 31.818 110.798 1.00 0.00 H ATOM 9027 H2 WAT 9837 68.093 31.218 110.847 1.00 0.00 H TER 9029 WAT 9837 ATOM 9029 O WAT 9838 58.632 98.669 144.076 1.00 0.00 O ATOM 9030 H1 WAT 9838 59.546 98.552 143.818 1.00 0.00 H ATOM 9031 H2 WAT 9838 58.141 98.602 143.257 1.00 0.00 H TER 9033 WAT 9838 ATOM 9033 O WAT 9839 48.112 96.222 75.083 1.00 0.00 O ATOM 9034 H1 WAT 9839 48.384 95.350 75.372 1.00 0.00 H ATOM 9035 H2 WAT 9839 48.663 96.823 75.584 1.00 0.00 H TER 9037 WAT 9839 ATOM 9037 O WAT 9840 19.768 56.728 114.616 1.00 0.00 O ATOM 9038 H1 WAT 9840 20.248 55.917 114.782 1.00 0.00 H ATOM 9039 H2 WAT 9840 20.440 57.354 114.347 1.00 0.00 H TER 9041 WAT 9840 ATOM 9041 O WAT 9841 45.783 53.328 2.716 1.00 0.00 O ATOM 9042 H1 WAT 9841 45.958 54.125 2.216 1.00 0.00 H ATOM 9043 H2 WAT 9841 44.883 53.432 3.024 1.00 0.00 H TER 9045 WAT 9841 ATOM 9045 O WAT 9842 129.208 140.043 102.242 1.00 0.00 O ATOM 9046 H1 WAT 9842 129.904 139.409 102.417 1.00 0.00 H ATOM 9047 H2 WAT 9842 128.445 139.507 102.028 1.00 0.00 H TER 9049 WAT 9842 ATOM 9049 O WAT 9843 118.768 15.214 129.024 1.00 0.00 O ATOM 9050 H1 WAT 9843 118.510 15.126 128.106 1.00 0.00 H ATOM 9051 H2 WAT 9843 118.801 16.159 129.173 1.00 0.00 H TER 9053 WAT 9843 ATOM 9053 O WAT 9844 75.110 68.965 89.734 1.00 0.00 O ATOM 9054 H1 WAT 9844 75.263 69.713 89.156 1.00 0.00 H ATOM 9055 H2 WAT 9844 75.838 68.989 90.355 1.00 0.00 H TER 9057 WAT 9844 ATOM 9057 O WAT 9845 9.352 36.514 104.753 1.00 0.00 O ATOM 9058 H1 WAT 9845 9.961 35.797 104.927 1.00 0.00 H ATOM 9059 H2 WAT 9845 8.487 36.141 104.923 1.00 0.00 H TER 9061 WAT 9845 ATOM 9061 O WAT 9846 134.844 74.470 120.006 1.00 0.00 O ATOM 9062 H1 WAT 9846 134.090 74.897 120.413 1.00 0.00 H ATOM 9063 H2 WAT 9846 134.948 74.918 119.166 1.00 0.00 H TER 9065 WAT 9846 ATOM 9065 O WAT 9847 104.502 112.291 96.085 1.00 0.00 O ATOM 9066 H1 WAT 9847 105.447 112.381 95.961 1.00 0.00 H ATOM 9067 H2 WAT 9847 104.328 112.724 96.920 1.00 0.00 H TER 9069 WAT 9847 ATOM 9069 O WAT 9848 36.024 104.459 95.229 1.00 0.00 O ATOM 9070 H1 WAT 9848 36.543 104.560 96.028 1.00 0.00 H ATOM 9071 H2 WAT 9848 36.424 103.716 94.777 1.00 0.00 H TER 9073 WAT 9848 ATOM 9073 O WAT 9849 82.645 72.149 118.696 1.00 0.00 O ATOM 9074 H1 WAT 9849 81.931 72.635 118.284 1.00 0.00 H ATOM 9075 H2 WAT 9849 83.148 71.793 117.963 1.00 0.00 H TER 9077 WAT 9849 ATOM 9077 O WAT 9850 16.287 144.175 69.045 1.00 0.00 O ATOM 9078 H1 WAT 9850 16.475 143.360 69.510 1.00 0.00 H ATOM 9079 H2 WAT 9850 16.609 144.863 69.628 1.00 0.00 H TER 9081 WAT 9850 ATOM 9081 O WAT 9851 80.405 100.863 123.781 1.00 0.00 O ATOM 9082 H1 WAT 9851 81.014 101.588 123.923 1.00 0.00 H ATOM 9083 H2 WAT 9851 80.889 100.086 124.063 1.00 0.00 H TER 9085 WAT 9851 ATOM 9085 O WAT 9852 132.400 23.222 151.235 1.00 0.00 O ATOM 9086 H1 WAT 9852 132.151 23.987 150.716 1.00 0.00 H ATOM 9087 H2 WAT 9852 132.319 23.513 152.144 1.00 0.00 H TER 9089 WAT 9852 ATOM 9089 O WAT 9853 120.792 73.301 83.451 1.00 0.00 O ATOM 9090 H1 WAT 9853 119.931 73.007 83.155 1.00 0.00 H ATOM 9091 H2 WAT 9853 120.817 73.073 84.381 1.00 0.00 H TER 9093 WAT 9853 ATOM 9093 O WAT 9854 121.006 10.777 81.463 1.00 0.00 O ATOM 9094 H1 WAT 9854 121.665 10.321 81.986 1.00 0.00 H ATOM 9095 H2 WAT 9854 121.485 11.093 80.697 1.00 0.00 H TER 9097 WAT 9854 ATOM 9097 O WAT 9855 81.541 31.620 155.438 1.00 0.00 O ATOM 9098 H1 WAT 9855 82.340 31.113 155.296 1.00 0.00 H ATOM 9099 H2 WAT 9855 81.411 32.098 154.619 1.00 0.00 H TER 9101 WAT 9855 ATOM 9101 O WAT 9856 9.709 7.265 14.448 1.00 0.00 O ATOM 9102 H1 WAT 9856 9.399 7.791 15.185 1.00 0.00 H ATOM 9103 H2 WAT 9856 9.362 6.389 14.617 1.00 0.00 H TER 9105 WAT 9856 ATOM 9105 O WAT 9857 80.220 76.753 65.062 1.00 0.00 O ATOM 9106 H1 WAT 9857 80.210 77.301 65.847 1.00 0.00 H ATOM 9107 H2 WAT 9857 80.914 77.125 64.519 1.00 0.00 H TER 9109 WAT 9857 ATOM 9109 O WAT 9858 126.568 107.358 155.995 1.00 0.00 O ATOM 9110 H1 WAT 9858 126.688 106.864 156.806 1.00 0.00 H ATOM 9111 H2 WAT 9858 127.132 106.916 155.360 1.00 0.00 H TER 9113 WAT 9858 ATOM 9113 O WAT 9859 90.730 95.113 118.682 1.00 0.00 O ATOM 9114 H1 WAT 9859 90.256 94.698 117.962 1.00 0.00 H ATOM 9115 H2 WAT 9859 90.047 95.518 119.217 1.00 0.00 H TER 9117 WAT 9859 ATOM 9117 O WAT 9860 86.485 95.845 147.328 1.00 0.00 O ATOM 9118 H1 WAT 9860 87.204 95.632 147.923 1.00 0.00 H ATOM 9119 H2 WAT 9860 86.881 95.821 146.457 1.00 0.00 H TER 9121 WAT 9860 ATOM 9121 O WAT 9861 87.981 113.621 136.251 1.00 0.00 O ATOM 9122 H1 WAT 9861 87.922 113.225 135.381 1.00 0.00 H ATOM 9123 H2 WAT 9861 88.290 114.512 136.088 1.00 0.00 H TER 9125 WAT 9861 ATOM 9125 O WAT 9862 14.288 129.963 151.832 1.00 0.00 O ATOM 9126 H1 WAT 9862 14.579 129.106 152.143 1.00 0.00 H ATOM 9127 H2 WAT 9862 14.310 130.520 152.610 1.00 0.00 H TER 9129 WAT 9862 ATOM 9129 O WAT 9863 75.181 42.286 58.592 1.00 0.00 O ATOM 9130 H1 WAT 9863 75.477 42.873 57.896 1.00 0.00 H ATOM 9131 H2 WAT 9863 74.233 42.233 58.474 1.00 0.00 H TER 9133 WAT 9863 ATOM 9133 O WAT 9864 5.654 7.849 100.340 1.00 0.00 O ATOM 9134 H1 WAT 9864 5.686 8.697 100.783 1.00 0.00 H ATOM 9135 H2 WAT 9864 6.073 7.244 100.952 1.00 0.00 H TER 9137 WAT 9864 ATOM 9137 O WAT 9865 65.999 1.035 131.671 1.00 0.00 O ATOM 9138 H1 WAT 9865 66.208 1.829 132.164 1.00 0.00 H ATOM 9139 H2 WAT 9865 66.710 0.954 131.036 1.00 0.00 H TER 9141 WAT 9865 ATOM 9141 O WAT 9866 20.080 140.715 14.286 1.00 0.00 O ATOM 9142 H1 WAT 9866 19.912 139.827 14.600 1.00 0.00 H ATOM 9143 H2 WAT 9866 20.070 141.255 15.077 1.00 0.00 H TER 9145 WAT 9866 ATOM 9145 O WAT 9867 72.402 1.673 114.903 1.00 0.00 O ATOM 9146 H1 WAT 9867 72.756 2.559 114.826 1.00 0.00 H ATOM 9147 H2 WAT 9867 72.072 1.624 115.800 1.00 0.00 H TER 9149 WAT 9867 ATOM 9149 O WAT 9868 60.783 105.824 156.784 1.00 0.00 O ATOM 9150 H1 WAT 9868 61.187 106.675 156.612 1.00 0.00 H ATOM 9151 H2 WAT 9868 59.984 106.032 157.267 1.00 0.00 H TER 9153 WAT 9868 ATOM 9153 O WAT 9869 41.458 36.385 117.903 1.00 0.00 O ATOM 9154 H1 WAT 9869 40.908 35.645 117.643 1.00 0.00 H ATOM 9155 H2 WAT 9869 42.343 36.128 117.643 1.00 0.00 H TER 9157 WAT 9869 ATOM 9157 O WAT 9870 42.524 107.626 17.805 1.00 0.00 O ATOM 9158 H1 WAT 9870 43.008 107.575 18.630 1.00 0.00 H ATOM 9159 H2 WAT 9870 42.486 106.722 17.494 1.00 0.00 H TER 9161 WAT 9870 ATOM 9161 O WAT 9871 29.542 79.730 118.822 1.00 0.00 O ATOM 9162 H1 WAT 9871 28.899 79.123 119.187 1.00 0.00 H ATOM 9163 H2 WAT 9871 30.343 79.212 118.744 1.00 0.00 H TER 9165 WAT 9871 ATOM 9165 O WAT 9872 65.429 79.337 60.294 1.00 0.00 O ATOM 9166 H1 WAT 9872 65.071 79.786 59.528 1.00 0.00 H ATOM 9167 H2 WAT 9872 66.246 79.799 60.482 1.00 0.00 H TER 9169 WAT 9872 ATOM 9169 O WAT 9873 143.869 75.513 100.955 1.00 0.00 O ATOM 9170 H1 WAT 9873 143.142 76.048 100.634 1.00 0.00 H ATOM 9171 H2 WAT 9873 144.017 75.823 101.848 1.00 0.00 H TER 9173 WAT 9873 ATOM 9173 O WAT 9874 68.496 58.219 72.758 1.00 0.00 O ATOM 9174 H1 WAT 9874 68.828 57.492 72.232 1.00 0.00 H ATOM 9175 H2 WAT 9874 68.623 58.991 72.206 1.00 0.00 H TER 9177 WAT 9874 ATOM 9177 O WAT 9875 135.243 131.355 0.407 1.00 0.00 O ATOM 9178 H1 WAT 9875 135.472 131.324 1.335 1.00 0.00 H ATOM 9179 H2 WAT 9875 134.606 132.067 0.340 1.00 0.00 H TER 9181 WAT 9875 ATOM 9181 O WAT 9876 140.083 143.756 79.769 1.00 0.00 O ATOM 9182 H1 WAT 9876 140.056 143.251 78.956 1.00 0.00 H ATOM 9183 H2 WAT 9876 140.708 144.460 79.593 1.00 0.00 H TER 9185 WAT 9876 ATOM 9185 O WAT 9877 84.760 90.622 96.006 1.00 0.00 O ATOM 9186 H1 WAT 9877 84.303 89.811 96.231 1.00 0.00 H ATOM 9187 H2 WAT 9877 85.531 90.628 96.574 1.00 0.00 H TER 9189 WAT 9877 ATOM 9189 O WAT 9878 139.210 89.953 133.745 1.00 0.00 O ATOM 9190 H1 WAT 9878 139.094 90.649 133.098 1.00 0.00 H ATOM 9191 H2 WAT 9878 140.103 90.071 134.067 1.00 0.00 H TER 9193 WAT 9878 ATOM 9193 O WAT 9879 5.266 61.853 120.010 1.00 0.00 O ATOM 9194 H1 WAT 9879 4.631 61.973 120.716 1.00 0.00 H ATOM 9195 H2 WAT 9879 4.748 61.920 119.208 1.00 0.00 H TER 9197 WAT 9879 ATOM 9197 O WAT 9880 6.918 141.565 146.928 1.00 0.00 O ATOM 9198 H1 WAT 9880 7.560 140.859 146.855 1.00 0.00 H ATOM 9199 H2 WAT 9880 7.424 142.320 147.229 1.00 0.00 H TER 9201 WAT 9880 ATOM 9201 O WAT 9881 112.430 1.185 89.931 1.00 0.00 O ATOM 9202 H1 WAT 9881 112.905 1.806 90.482 1.00 0.00 H ATOM 9203 H2 WAT 9881 112.320 0.410 90.482 1.00 0.00 H TER 9205 WAT 9881 ATOM 9205 O WAT 9882 137.677 129.159 15.201 1.00 0.00 O ATOM 9206 H1 WAT 9882 138.551 129.139 15.589 1.00 0.00 H ATOM 9207 H2 WAT 9882 137.777 129.693 14.413 1.00 0.00 H TER 9209 WAT 9882 ATOM 9209 O WAT 9883 61.175 94.252 107.804 1.00 0.00 O ATOM 9210 H1 WAT 9883 60.780 93.408 107.586 1.00 0.00 H ATOM 9211 H2 WAT 9883 60.892 94.425 108.702 1.00 0.00 H TER 9213 WAT 9883 ATOM 9213 O WAT 9884 113.637 24.172 118.746 1.00 0.00 O ATOM 9214 H1 WAT 9884 113.586 24.242 117.793 1.00 0.00 H ATOM 9215 H2 WAT 9884 112.931 23.570 118.981 1.00 0.00 H TER 9217 WAT 9884 ATOM 9217 O WAT 9885 99.804 122.814 139.860 1.00 0.00 O ATOM 9218 H1 WAT 9885 100.057 123.654 140.242 1.00 0.00 H ATOM 9219 H2 WAT 9885 100.631 122.349 139.732 1.00 0.00 H TER 9221 WAT 9885 ATOM 9221 O WAT 9886 88.795 90.523 84.329 1.00 0.00 O ATOM 9222 H1 WAT 9886 89.114 91.393 84.568 1.00 0.00 H ATOM 9223 H2 WAT 9886 87.843 90.586 84.406 1.00 0.00 H TER 9225 WAT 9886 ATOM 9225 O WAT 9887 98.134 97.563 119.845 1.00 0.00 O ATOM 9226 H1 WAT 9887 98.208 98.508 119.712 1.00 0.00 H ATOM 9227 H2 WAT 9887 97.230 97.358 119.608 1.00 0.00 H TER 9229 WAT 9887 ATOM 9229 O WAT 9888 52.758 23.030 156.233 1.00 0.00 O ATOM 9230 H1 WAT 9888 52.736 23.891 156.649 1.00 0.00 H ATOM 9231 H2 WAT 9888 53.420 22.544 156.725 1.00 0.00 H TER 9233 WAT 9888 ATOM 9233 O WAT 9889 42.414 14.448 147.240 1.00 0.00 O ATOM 9234 H1 WAT 9889 42.411 14.265 146.301 1.00 0.00 H ATOM 9235 H2 WAT 9889 43.208 14.023 147.565 1.00 0.00 H TER 9237 WAT 9889 ATOM 9237 O WAT 9890 134.852 104.539 134.467 1.00 0.00 O ATOM 9238 H1 WAT 9890 134.817 103.770 135.036 1.00 0.00 H ATOM 9239 H2 WAT 9890 135.780 104.638 134.255 1.00 0.00 H TER 9241 WAT 9890 ATOM 9241 O WAT 9891 97.586 52.360 128.761 1.00 0.00 O ATOM 9242 H1 WAT 9891 97.613 53.311 128.865 1.00 0.00 H ATOM 9243 H2 WAT 9891 96.659 52.159 128.628 1.00 0.00 H TER 9245 WAT 9891 ATOM 9245 O WAT 9892 97.905 99.204 4.577 1.00 0.00 O ATOM 9246 H1 WAT 9892 98.648 99.722 4.267 1.00 0.00 H ATOM 9247 H2 WAT 9892 98.207 98.819 5.399 1.00 0.00 H TER 9249 WAT 9892 ATOM 9249 O WAT 9893 55.279 13.727 138.272 1.00 0.00 O ATOM 9250 H1 WAT 9893 54.584 13.526 137.646 1.00 0.00 H ATOM 9251 H2 WAT 9893 54.980 13.338 139.095 1.00 0.00 H TER 9253 WAT 9893 ATOM 9253 O WAT 9894 136.883 43.512 88.999 1.00 0.00 O ATOM 9254 H1 WAT 9894 137.535 43.752 89.658 1.00 0.00 H ATOM 9255 H2 WAT 9894 137.302 43.717 88.163 1.00 0.00 H TER 9257 WAT 9894 ATOM 9257 O WAT 9895 95.123 111.598 101.065 1.00 0.00 O ATOM 9258 H1 WAT 9895 94.913 110.744 101.442 1.00 0.00 H ATOM 9259 H2 WAT 9895 94.282 112.051 101.015 1.00 0.00 H TER 9261 WAT 9895 ATOM 9261 O WAT 9896 75.169 13.602 84.018 1.00 0.00 O ATOM 9262 H1 WAT 9896 75.370 12.872 83.433 1.00 0.00 H ATOM 9263 H2 WAT 9896 74.456 13.279 84.568 1.00 0.00 H TER 9265 WAT 9896 ATOM 9265 O WAT 9897 106.151 98.248 144.227 1.00 0.00 O ATOM 9266 H1 WAT 9897 105.321 98.289 144.700 1.00 0.00 H ATOM 9267 H2 WAT 9897 106.047 98.867 143.504 1.00 0.00 H TER 9269 WAT 9897 ATOM 9269 O WAT 9898 115.046 122.061 111.121 1.00 0.00 O ATOM 9270 H1 WAT 9898 115.774 122.012 111.740 1.00 0.00 H ATOM 9271 H2 WAT 9898 115.062 121.219 110.665 1.00 0.00 H TER 9273 WAT 9898 ATOM 9273 O WAT 9899 64.289 69.132 86.179 1.00 0.00 O ATOM 9274 H1 WAT 9899 64.869 69.887 86.278 1.00 0.00 H ATOM 9275 H2 WAT 9899 63.950 69.206 85.287 1.00 0.00 H TER 9277 WAT 9899 ATOM 9277 O WAT 9900 105.449 17.182 98.316 1.00 0.00 O ATOM 9278 H1 WAT 9900 105.002 16.404 98.649 1.00 0.00 H ATOM 9279 H2 WAT 9900 104.762 17.845 98.252 1.00 0.00 H TER 9281 WAT 9900 ATOM 9281 O WAT 9901 9.759 9.644 63.569 1.00 0.00 O ATOM 9282 H1 WAT 9901 9.196 9.147 62.976 1.00 0.00 H ATOM 9283 H2 WAT 9901 10.281 10.203 62.993 1.00 0.00 H TER 9285 WAT 9901 ATOM 9285 O WAT 9902 130.696 140.444 80.058 1.00 0.00 O ATOM 9286 H1 WAT 9902 131.640 140.405 80.210 1.00 0.00 H ATOM 9287 H2 WAT 9902 130.609 140.484 79.105 1.00 0.00 H TER 9289 WAT 9902 ATOM 9289 O WAT 9903 6.000 37.339 127.870 1.00 0.00 O ATOM 9290 H1 WAT 9903 5.318 36.857 127.402 1.00 0.00 H ATOM 9291 H2 WAT 9903 6.568 36.659 128.232 1.00 0.00 H TER 9293 WAT 9903 ATOM 9293 O WAT 9904 96.830 44.828 119.989 1.00 0.00 O ATOM 9294 H1 WAT 9904 96.314 45.345 120.608 1.00 0.00 H ATOM 9295 H2 WAT 9904 96.826 45.346 119.184 1.00 0.00 H TER 9297 WAT 9904 ATOM 9297 O WAT 9905 107.429 74.254 64.922 1.00 0.00 O ATOM 9298 H1 WAT 9905 107.534 75.177 65.155 1.00 0.00 H ATOM 9299 H2 WAT 9905 107.623 74.220 63.986 1.00 0.00 H TER 9301 WAT 9905 ATOM 9301 O WAT 9906 43.663 108.906 123.886 1.00 0.00 O ATOM 9302 H1 WAT 9906 44.107 108.437 123.180 1.00 0.00 H ATOM 9303 H2 WAT 9906 42.808 109.135 123.521 1.00 0.00 H TER 9305 WAT 9906 ATOM 9305 O WAT 9907 3.035 21.761 154.680 1.00 0.00 O ATOM 9306 H1 WAT 9907 2.170 21.354 154.719 1.00 0.00 H ATOM 9307 H2 WAT 9907 3.244 21.792 153.746 1.00 0.00 H TER 9309 WAT 9907 ATOM 9309 O WAT 9908 105.152 65.317 80.606 1.00 0.00 O ATOM 9310 H1 WAT 9908 105.625 65.295 79.774 1.00 0.00 H ATOM 9311 H2 WAT 9908 104.838 64.421 80.727 1.00 0.00 H TER 9313 WAT 9908 ATOM 9313 O WAT 9909 31.637 59.100 157.244 1.00 0.00 O ATOM 9314 H1 WAT 9909 32.200 59.413 156.535 1.00 0.00 H ATOM 9315 H2 WAT 9909 32.075 59.391 158.044 1.00 0.00 H TER 9317 WAT 9909 ATOM 9317 O WAT 9910 117.735 5.389 1.414 1.00 0.00 O ATOM 9318 H1 WAT 9910 117.264 6.221 1.456 1.00 0.00 H ATOM 9319 H2 WAT 9910 117.057 4.723 1.531 1.00 0.00 H TER 9321 WAT 9910 ATOM 9321 O WAT 9911 1.067 47.716 89.231 1.00 0.00 O ATOM 9322 H1 WAT 9911 1.919 47.588 89.648 1.00 0.00 H ATOM 9323 H2 WAT 9911 0.503 47.055 89.634 1.00 0.00 H TER 9325 WAT 9911 ATOM 9325 O WAT 9912 38.640 21.380 6.578 1.00 0.00 O ATOM 9326 H1 WAT 9912 38.637 22.333 6.482 1.00 0.00 H ATOM 9327 H2 WAT 9912 37.902 21.084 6.044 1.00 0.00 H TER 9329 WAT 9912 ATOM 9329 O WAT 9913 59.122 102.523 99.401 1.00 0.00 O ATOM 9330 H1 WAT 9913 59.597 101.741 99.120 1.00 0.00 H ATOM 9331 H2 WAT 9913 58.932 102.993 98.589 1.00 0.00 H TER 9333 WAT 9913 ATOM 9333 O WAT 9914 79.665 7.729 79.331 1.00 0.00 O ATOM 9334 H1 WAT 9914 80.614 7.656 79.426 1.00 0.00 H ATOM 9335 H2 WAT 9914 79.410 8.397 79.967 1.00 0.00 H TER 9337 WAT 9914 ATOM 9337 O WAT 9915 84.449 18.643 11.633 1.00 0.00 O ATOM 9338 H1 WAT 9915 85.243 18.166 11.390 1.00 0.00 H ATOM 9339 H2 WAT 9915 84.690 19.566 11.549 1.00 0.00 H TER 9341 WAT 9915 ATOM 9341 O WAT 9916 89.941 138.926 16.089 1.00 0.00 O ATOM 9342 H1 WAT 9916 90.214 138.625 16.955 1.00 0.00 H ATOM 9343 H2 WAT 9916 89.012 138.700 16.039 1.00 0.00 H TER 9345 WAT 9916 ATOM 9345 O WAT 9917 32.699 3.677 135.765 1.00 0.00 O ATOM 9346 H1 WAT 9917 32.962 4.358 136.384 1.00 0.00 H ATOM 9347 H2 WAT 9917 32.314 2.992 136.312 1.00 0.00 H TER 9349 WAT 9917 ATOM 9349 O WAT 9918 22.477 84.654 139.859 1.00 0.00 O ATOM 9350 H1 WAT 9918 22.354 83.704 139.850 1.00 0.00 H ATOM 9351 H2 WAT 9918 22.737 84.852 140.759 1.00 0.00 H TER 9353 WAT 9918 ATOM 9353 O WAT 9919 51.976 97.886 85.529 1.00 0.00 O ATOM 9354 H1 WAT 9919 51.619 97.161 86.041 1.00 0.00 H ATOM 9355 H2 WAT 9919 52.449 97.463 84.813 1.00 0.00 H TER 9357 WAT 9919 ATOM 9357 O WAT 9920 61.442 76.519 144.675 1.00 0.00 O ATOM 9358 H1 WAT 9920 61.618 75.594 144.847 1.00 0.00 H ATOM 9359 H2 WAT 9920 61.414 76.923 145.543 1.00 0.00 H TER 9361 WAT 9920 ATOM 9361 O WAT 9921 94.847 54.554 63.282 1.00 0.00 O ATOM 9362 H1 WAT 9921 94.400 55.092 62.630 1.00 0.00 H ATOM 9363 H2 WAT 9921 94.534 54.887 64.123 1.00 0.00 H TER 9365 WAT 9921 ATOM 9365 O WAT 9922 93.400 28.139 153.552 1.00 0.00 O ATOM 9366 H1 WAT 9922 94.036 27.928 152.868 1.00 0.00 H ATOM 9367 H2 WAT 9922 93.927 28.495 154.267 1.00 0.00 H TER 9369 WAT 9922 ATOM 9369 O WAT 9923 43.013 21.790 14.405 1.00 0.00 O ATOM 9370 H1 WAT 9923 42.336 21.160 14.653 1.00 0.00 H ATOM 9371 H2 WAT 9923 43.118 22.345 15.178 1.00 0.00 H TER 9373 WAT 9923 ATOM 9373 O WAT 9924 22.715 129.061 93.799 1.00 0.00 O ATOM 9374 H1 WAT 9924 22.776 129.646 94.554 1.00 0.00 H ATOM 9375 H2 WAT 9924 23.149 129.538 93.092 1.00 0.00 H TER 9377 WAT 9924 ATOM 9377 O WAT 9925 60.832 79.810 141.231 1.00 0.00 O ATOM 9378 H1 WAT 9925 60.919 80.759 141.319 1.00 0.00 H ATOM 9379 H2 WAT 9925 61.433 79.453 141.885 1.00 0.00 H TER 9381 WAT 9925 ATOM 9381 O WAT 9926 94.953 132.979 5.179 1.00 0.00 O ATOM 9382 H1 WAT 9926 94.665 132.067 5.156 1.00 0.00 H ATOM 9383 H2 WAT 9926 94.945 133.256 4.262 1.00 0.00 H TER 9385 WAT 9926 ATOM 9385 O WAT 9927 141.905 51.989 104.517 1.00 0.00 O ATOM 9386 H1 WAT 9927 141.164 52.478 104.876 1.00 0.00 H ATOM 9387 H2 WAT 9927 142.624 52.165 105.124 1.00 0.00 H TER 9389 WAT 9927 ATOM 9389 O WAT 9928 47.413 20.419 135.950 1.00 0.00 O ATOM 9390 H1 WAT 9928 46.640 19.937 136.245 1.00 0.00 H ATOM 9391 H2 WAT 9928 47.103 21.316 135.824 1.00 0.00 H TER 9393 WAT 9928 ATOM 9393 O WAT 9929 106.262 141.552 126.251 1.00 0.00 O ATOM 9394 H1 WAT 9929 106.379 141.958 125.393 1.00 0.00 H ATOM 9395 H2 WAT 9929 107.091 141.708 126.705 1.00 0.00 H TER 9397 WAT 9929 ATOM 9397 O WAT 9930 1.935 25.590 78.902 1.00 0.00 O ATOM 9398 H1 WAT 9930 1.195 25.673 79.503 1.00 0.00 H ATOM 9399 H2 WAT 9930 1.537 25.584 78.031 1.00 0.00 H TER 9401 WAT 9930 ATOM 9401 O WAT 9931 30.185 18.364 128.350 1.00 0.00 O ATOM 9402 H1 WAT 9931 29.989 17.518 128.753 1.00 0.00 H ATOM 9403 H2 WAT 9931 29.526 18.459 127.662 1.00 0.00 H TER 9405 WAT 9931 ATOM 9405 O WAT 9932 24.616 46.138 93.361 1.00 0.00 O ATOM 9406 H1 WAT 9932 23.924 46.076 92.703 1.00 0.00 H ATOM 9407 H2 WAT 9932 25.233 45.445 93.126 1.00 0.00 H TER 9409 WAT 9932 ATOM 9409 O WAT 9933 35.524 41.131 27.978 1.00 0.00 O ATOM 9410 H1 WAT 9933 36.075 41.151 28.761 1.00 0.00 H ATOM 9411 H2 WAT 9933 36.071 40.719 27.310 1.00 0.00 H TER 9413 WAT 9933 ATOM 9413 O WAT 9934 50.183 43.901 156.695 1.00 0.00 O ATOM 9414 H1 WAT 9934 49.603 44.130 157.421 1.00 0.00 H ATOM 9415 H2 WAT 9934 50.444 42.998 156.871 1.00 0.00 H TER 9417 WAT 9934 ATOM 9417 O WAT 9935 127.998 9.461 129.348 1.00 0.00 O ATOM 9418 H1 WAT 9935 128.817 9.950 129.430 1.00 0.00 H ATOM 9419 H2 WAT 9935 128.123 8.914 128.572 1.00 0.00 H TER 9421 WAT 9935 ATOM 9421 O WAT 9936 24.578 93.094 13.702 1.00 0.00 O ATOM 9422 H1 WAT 9936 24.831 93.040 14.623 1.00 0.00 H ATOM 9423 H2 WAT 9936 24.961 93.916 13.396 1.00 0.00 H TER 9425 WAT 9936 ATOM 9425 O WAT 9937 66.525 77.629 9.591 1.00 0.00 O ATOM 9426 H1 WAT 9937 65.903 78.054 10.181 1.00 0.00 H ATOM 9427 H2 WAT 9937 67.384 77.915 9.903 1.00 0.00 H TER 9429 WAT 9937 ATOM 9429 O WAT 9938 121.825 36.915 151.051 1.00 0.00 O ATOM 9430 H1 WAT 9938 121.020 36.989 150.539 1.00 0.00 H ATOM 9431 H2 WAT 9938 121.558 36.472 151.856 1.00 0.00 H TER 9433 WAT 9938 ATOM 9433 O WAT 9939 79.481 56.085 126.938 1.00 0.00 O ATOM 9434 H1 WAT 9939 78.997 55.495 127.517 1.00 0.00 H ATOM 9435 H2 WAT 9939 79.362 55.714 126.064 1.00 0.00 H TER 9437 WAT 9939 ATOM 9437 O WAT 9940 76.422 4.238 133.995 1.00 0.00 O ATOM 9438 H1 WAT 9940 75.849 3.573 134.375 1.00 0.00 H ATOM 9439 H2 WAT 9940 77.184 3.748 133.684 1.00 0.00 H TER 9441 WAT 9940 ATOM 9441 O WAT 9941 91.346 104.646 110.197 1.00 0.00 O ATOM 9442 H1 WAT 9941 91.588 104.440 109.294 1.00 0.00 H ATOM 9443 H2 WAT 9941 90.759 105.398 110.121 1.00 0.00 H TER 9445 WAT 9941 ATOM 9445 O WAT 9942 128.979 26.974 71.670 1.00 0.00 O ATOM 9446 H1 WAT 9942 129.434 26.471 72.345 1.00 0.00 H ATOM 9447 H2 WAT 9942 128.220 27.346 72.119 1.00 0.00 H TER 9449 WAT 9942 ATOM 9449 O WAT 9943 14.380 25.796 73.795 1.00 0.00 O ATOM 9450 H1 WAT 9943 13.651 26.407 73.901 1.00 0.00 H ATOM 9451 H2 WAT 9943 14.184 25.081 74.400 1.00 0.00 H TER 9453 WAT 9943 ATOM 9453 O WAT 9944 60.898 142.699 69.334 1.00 0.00 O ATOM 9454 H1 WAT 9944 60.369 143.318 69.837 1.00 0.00 H ATOM 9455 H2 WAT 9944 61.334 143.237 68.673 1.00 0.00 H TER 9457 WAT 9944 ATOM 9457 O WAT 9945 122.049 25.844 61.165 1.00 0.00 O ATOM 9458 H1 WAT 9945 121.814 26.009 62.078 1.00 0.00 H ATOM 9459 H2 WAT 9945 121.464 26.411 60.662 1.00 0.00 H TER 9461 WAT 9945 ATOM 9461 O WAT 9946 47.301 112.090 81.964 1.00 0.00 O ATOM 9462 H1 WAT 9946 46.732 112.739 81.550 1.00 0.00 H ATOM 9463 H2 WAT 9946 47.534 111.490 81.255 1.00 0.00 H TER 9465 WAT 9946 ATOM 9465 O WAT 9947 42.851 49.442 152.382 1.00 0.00 O ATOM 9466 H1 WAT 9947 42.905 48.758 153.049 1.00 0.00 H ATOM 9467 H2 WAT 9947 42.915 48.972 151.551 1.00 0.00 H TER 9469 WAT 9947 ATOM 9469 O WAT 9948 116.724 27.882 13.093 1.00 0.00 O ATOM 9470 H1 WAT 9948 117.480 27.308 12.969 1.00 0.00 H ATOM 9471 H2 WAT 9948 115.992 27.284 13.247 1.00 0.00 H TER 9473 WAT 9948 ATOM 9473 O WAT 9949 61.053 73.571 23.302 1.00 0.00 O ATOM 9474 H1 WAT 9949 61.534 72.991 23.891 1.00 0.00 H ATOM 9475 H2 WAT 9949 60.910 73.047 22.514 1.00 0.00 H TER 9477 WAT 9949 ATOM 9477 O WAT 9950 106.143 3.224 146.976 1.00 0.00 O ATOM 9478 H1 WAT 9950 106.754 3.867 146.618 1.00 0.00 H ATOM 9479 H2 WAT 9950 106.621 2.395 146.944 1.00 0.00 H TER 9481 WAT 9950 ATOM 9481 O WAT 9951 27.505 20.646 69.377 1.00 0.00 O ATOM 9482 H1 WAT 9951 26.717 21.152 69.575 1.00 0.00 H ATOM 9483 H2 WAT 9951 27.503 20.561 68.424 1.00 0.00 H TER 9485 WAT 9951 ATOM 9485 O WAT 9952 24.879 45.043 150.405 1.00 0.00 O ATOM 9486 H1 WAT 9952 25.388 44.835 149.621 1.00 0.00 H ATOM 9487 H2 WAT 9952 25.077 45.962 150.583 1.00 0.00 H TER 9489 WAT 9952 ATOM 9489 O WAT 9953 70.393 111.607 6.410 1.00 0.00 O ATOM 9490 H1 WAT 9953 70.021 112.302 5.868 1.00 0.00 H ATOM 9491 H2 WAT 9953 71.339 111.751 6.369 1.00 0.00 H TER 9493 WAT 9953 ATOM 9493 O WAT 9954 137.366 105.785 91.524 1.00 0.00 O ATOM 9494 H1 WAT 9954 137.739 106.332 90.833 1.00 0.00 H ATOM 9495 H2 WAT 9954 137.495 104.888 91.215 1.00 0.00 H TER 9497 WAT 9954 ATOM 9497 O WAT 9955 19.520 125.171 16.850 1.00 0.00 O ATOM 9498 H1 WAT 9955 19.784 124.265 17.012 1.00 0.00 H ATOM 9499 H2 WAT 9955 18.760 125.100 16.273 1.00 0.00 H TER 9501 WAT 9955 ATOM 9501 O WAT 9956 81.638 31.589 12.988 1.00 0.00 O ATOM 9502 H1 WAT 9956 80.945 32.090 12.557 1.00 0.00 H ATOM 9503 H2 WAT 9956 82.000 32.192 13.637 1.00 0.00 H TER 9505 WAT 9956 ATOM 9505 O WAT 9957 76.666 34.746 123.064 1.00 0.00 O ATOM 9506 H1 WAT 9957 76.728 33.892 122.636 1.00 0.00 H ATOM 9507 H2 WAT 9957 77.572 34.978 123.269 1.00 0.00 H TER 9509 WAT 9957 ATOM 9509 O WAT 9958 104.332 118.214 140.814 1.00 0.00 O ATOM 9510 H1 WAT 9958 104.691 119.004 141.218 1.00 0.00 H ATOM 9511 H2 WAT 9958 103.386 118.362 140.797 1.00 0.00 H TER 9513 WAT 9958 ATOM 9513 O WAT 9959 105.911 105.888 144.006 1.00 0.00 O ATOM 9514 H1 WAT 9959 106.730 106.084 143.551 1.00 0.00 H ATOM 9515 H2 WAT 9959 105.414 106.706 143.967 1.00 0.00 H TER 9517 WAT 9959 ATOM 9517 O WAT 9960 60.457 57.411 157.655 1.00 0.00 O ATOM 9518 H1 WAT 9960 60.240 56.575 157.242 1.00 0.00 H ATOM 9519 H2 WAT 9960 59.798 57.517 158.341 1.00 0.00 H TER 9521 WAT 9960 ATOM 9521 O WAT 9961 109.424 12.164 107.923 1.00 0.00 O ATOM 9522 H1 WAT 9961 109.578 11.369 107.413 1.00 0.00 H ATOM 9523 H2 WAT 9961 108.811 12.674 107.393 1.00 0.00 H TER 9525 WAT 9961 ATOM 9525 O WAT 9962 82.829 7.538 84.607 1.00 0.00 O ATOM 9526 H1 WAT 9962 83.149 6.640 84.701 1.00 0.00 H ATOM 9527 H2 WAT 9962 83.583 8.085 84.826 1.00 0.00 H TER 9529 WAT 9962 ATOM 9529 O WAT 9963 35.910 122.667 114.129 1.00 0.00 O ATOM 9530 H1 WAT 9963 35.794 121.968 113.485 1.00 0.00 H ATOM 9531 H2 WAT 9963 35.629 122.278 114.958 1.00 0.00 H TER 9533 WAT 9963 ATOM 9533 O WAT 9964 106.123 36.861 121.112 1.00 0.00 O ATOM 9534 H1 WAT 9964 106.579 37.428 120.489 1.00 0.00 H ATOM 9535 H2 WAT 9964 105.393 37.392 121.429 1.00 0.00 H TER 9537 WAT 9964 ATOM 9537 O WAT 9965 84.312 86.393 148.796 1.00 0.00 O ATOM 9538 H1 WAT 9965 84.396 87.160 149.363 1.00 0.00 H ATOM 9539 H2 WAT 9965 83.492 86.535 148.323 1.00 0.00 H TER 9541 WAT 9965 ATOM 9541 O WAT 9966 136.092 132.397 119.608 1.00 0.00 O ATOM 9542 H1 WAT 9966 136.010 131.445 119.671 1.00 0.00 H ATOM 9543 H2 WAT 9966 136.904 132.536 119.121 1.00 0.00 H TER 9545 WAT 9966 ATOM 9545 O WAT 9967 76.037 37.583 73.806 1.00 0.00 O ATOM 9546 H1 WAT 9967 76.719 38.124 73.406 1.00 0.00 H ATOM 9547 H2 WAT 9967 76.494 36.788 74.082 1.00 0.00 H TER 9549 WAT 9967 ATOM 9549 O WAT 9968 77.806 114.297 157.157 1.00 0.00 O ATOM 9550 H1 WAT 9968 77.765 113.365 156.942 1.00 0.00 H ATOM 9551 H2 WAT 9968 77.224 114.394 157.911 1.00 0.00 H TER 9553 WAT 9968 ATOM 9553 O WAT 9969 139.910 93.328 4.337 1.00 0.00 O ATOM 9554 H1 WAT 9969 140.362 94.051 4.772 1.00 0.00 H ATOM 9555 H2 WAT 9969 140.606 92.839 3.898 1.00 0.00 H TER 9557 WAT 9969 ATOM 9557 O WAT 9970 94.107 15.260 8.645 1.00 0.00 O ATOM 9558 H1 WAT 9970 94.132 14.310 8.759 1.00 0.00 H ATOM 9559 H2 WAT 9970 93.440 15.403 7.973 1.00 0.00 H TER 9561 WAT 9970 ATOM 9561 O WAT 9971 52.140 59.314 152.354 1.00 0.00 O ATOM 9562 H1 WAT 9971 52.289 59.609 151.455 1.00 0.00 H ATOM 9563 H2 WAT 9971 51.188 59.258 152.434 1.00 0.00 H TER 9565 WAT 9971 ATOM 9565 O WAT 9972 98.329 140.519 79.311 1.00 0.00 O ATOM 9566 H1 WAT 9972 98.806 141.138 79.863 1.00 0.00 H ATOM 9567 H2 WAT 9972 98.984 140.195 78.693 1.00 0.00 H TER 9569 WAT 9972 ATOM 9569 O WAT 9973 36.049 91.618 133.016 1.00 0.00 O ATOM 9570 H1 WAT 9973 36.083 91.245 132.135 1.00 0.00 H ATOM 9571 H2 WAT 9973 36.906 92.026 133.136 1.00 0.00 H TER 9573 WAT 9973 ATOM 9573 O WAT 9974 37.195 110.121 147.324 1.00 0.00 O ATOM 9574 H1 WAT 9974 37.452 110.305 146.420 1.00 0.00 H ATOM 9575 H2 WAT 9974 36.385 110.617 147.448 1.00 0.00 H TER 9577 WAT 9974 ATOM 9577 O WAT 9975 35.394 92.167 96.984 1.00 0.00 O ATOM 9578 H1 WAT 9975 35.105 93.010 97.334 1.00 0.00 H ATOM 9579 H2 WAT 9975 35.246 92.236 96.041 1.00 0.00 H TER 9581 WAT 9975 ATOM 9581 O WAT 9976 96.457 15.311 117.727 1.00 0.00 O ATOM 9582 H1 WAT 9976 96.531 16.243 117.934 1.00 0.00 H ATOM 9583 H2 WAT 9976 97.250 15.113 117.230 1.00 0.00 H TER 9585 WAT 9976 ATOM 9585 O WAT 9977 90.557 73.994 1.857 1.00 0.00 O ATOM 9586 H1 WAT 9977 90.002 73.275 2.160 1.00 0.00 H ATOM 9587 H2 WAT 9977 90.063 74.785 2.072 1.00 0.00 H TER 9589 WAT 9977 ATOM 9589 O WAT 9978 100.997 49.705 101.088 1.00 0.00 O ATOM 9590 H1 WAT 9978 100.551 50.385 101.593 1.00 0.00 H ATOM 9591 H2 WAT 9978 101.788 49.513 101.592 1.00 0.00 H TER 9593 WAT 9978 ATOM 9593 O WAT 9979 69.937 19.667 80.373 1.00 0.00 O ATOM 9594 H1 WAT 9979 70.694 19.471 80.925 1.00 0.00 H ATOM 9595 H2 WAT 9979 69.193 19.291 80.843 1.00 0.00 H TER 9597 WAT 9979 ATOM 9597 O WAT 9980 145.038 124.047 137.829 1.00 0.00 O ATOM 9598 H1 WAT 9980 144.156 124.275 137.535 1.00 0.00 H ATOM 9599 H2 WAT 9980 144.944 123.885 138.767 1.00 0.00 H TER 9601 WAT 9980 ATOM 9601 O WAT 9981 82.855 125.825 16.657 1.00 0.00 O ATOM 9602 H1 WAT 9981 82.797 125.445 17.534 1.00 0.00 H ATOM 9603 H2 WAT 9981 82.111 126.426 16.607 1.00 0.00 H TER 9605 WAT 9981 ATOM 9605 O WAT 9982 68.429 43.670 6.037 1.00 0.00 O ATOM 9606 H1 WAT 9982 68.349 44.484 5.539 1.00 0.00 H ATOM 9607 H2 WAT 9982 67.533 43.342 6.104 1.00 0.00 H TER 9609 WAT 9982 ATOM 9609 O WAT 9983 30.762 6.473 137.231 1.00 0.00 O ATOM 9610 H1 WAT 9983 31.565 6.233 137.694 1.00 0.00 H ATOM 9611 H2 WAT 9983 30.334 5.638 137.045 1.00 0.00 H TER 9613 WAT 9983 ATOM 9613 O WAT 9984 67.042 55.656 115.009 1.00 0.00 O ATOM 9614 H1 WAT 9984 67.257 56.029 114.154 1.00 0.00 H ATOM 9615 H2 WAT 9984 66.338 55.033 114.828 1.00 0.00 H TER 9617 WAT 9984 ATOM 9617 O WAT 9985 6.764 139.862 152.534 1.00 0.00 O ATOM 9618 H1 WAT 9985 6.405 140.605 153.020 1.00 0.00 H ATOM 9619 H2 WAT 9985 7.178 139.317 153.202 1.00 0.00 H TER 9621 WAT 9985 ATOM 9621 O WAT 9986 131.780 102.884 13.457 1.00 0.00 O ATOM 9622 H1 WAT 9986 130.855 102.990 13.235 1.00 0.00 H ATOM 9623 H2 WAT 9986 131.956 103.581 14.090 1.00 0.00 H TER 9625 WAT 9986 ATOM 9625 O WAT 9987 114.748 96.602 119.901 1.00 0.00 O ATOM 9626 H1 WAT 9987 115.588 96.253 119.602 1.00 0.00 H ATOM 9627 H2 WAT 9987 114.543 97.300 119.279 1.00 0.00 H TER 9629 WAT 9987 ATOM 9629 O WAT 9988 20.958 98.547 -0.043 1.00 0.00 O ATOM 9630 H1 WAT 9988 21.237 97.684 0.262 1.00 0.00 H ATOM 9631 H2 WAT 9988 20.241 98.789 0.543 1.00 0.00 H TER 9633 WAT 9988 ATOM 9633 O WAT 9989 67.655 108.952 16.566 1.00 0.00 O ATOM 9634 H1 WAT 9989 66.900 108.933 15.978 1.00 0.00 H ATOM 9635 H2 WAT 9989 67.701 108.067 16.926 1.00 0.00 H TER 9637 WAT 9989 ATOM 9637 O WAT 9990 40.636 76.096 98.414 1.00 0.00 O ATOM 9638 H1 WAT 9990 40.228 76.561 99.144 1.00 0.00 H ATOM 9639 H2 WAT 9990 39.968 76.092 97.729 1.00 0.00 H TER 9641 WAT 9990 ATOM 9641 O WAT 9991 40.796 57.621 148.735 1.00 0.00 O ATOM 9642 H1 WAT 9991 40.001 57.368 149.204 1.00 0.00 H ATOM 9643 H2 WAT 9991 40.524 58.351 148.179 1.00 0.00 H TER 9645 WAT 9991 ATOM 9645 O WAT 9992 105.965 80.350 90.265 1.00 0.00 O ATOM 9646 H1 WAT 9992 105.996 81.087 89.655 1.00 0.00 H ATOM 9647 H2 WAT 9992 106.105 79.578 89.716 1.00 0.00 H TER 9649 WAT 9992 ATOM 9649 O WAT 9993 48.358 56.381 30.080 1.00 0.00 O ATOM 9650 H1 WAT 9993 47.446 56.124 30.215 1.00 0.00 H ATOM 9651 H2 WAT 9993 48.404 56.629 29.157 1.00 0.00 H TER 9653 WAT 9993 ATOM 9653 O WAT 9994 2.524 90.068 145.356 1.00 0.00 O ATOM 9654 H1 WAT 9994 3.284 89.721 145.825 1.00 0.00 H ATOM 9655 H2 WAT 9994 2.481 89.548 144.554 1.00 0.00 H TER 9657 WAT 9994 ATOM 9657 O WAT 9995 57.486 46.889 67.287 1.00 0.00 O ATOM 9658 H1 WAT 9995 57.084 47.681 67.644 1.00 0.00 H ATOM 9659 H2 WAT 9995 57.192 46.861 66.376 1.00 0.00 H TER 9661 WAT 9995 ATOM 9661 O WAT 9996 112.770 97.926 157.910 1.00 0.00 O ATOM 9662 H1 WAT 9996 113.500 98.034 157.300 1.00 0.00 H ATOM 9663 H2 WAT 9996 112.280 98.746 157.846 1.00 0.00 H TER 9665 WAT 9996 ATOM 9665 O WAT 9997 21.155 45.953 87.919 1.00 0.00 O ATOM 9666 H1 WAT 9997 21.971 45.534 87.644 1.00 0.00 H ATOM 9667 H2 WAT 9997 21.324 46.890 87.824 1.00 0.00 H TER 9669 WAT 9997 ATOM 9669 O WAT 9998 47.204 77.949 68.502 1.00 0.00 O ATOM 9670 H1 WAT 9998 46.268 77.868 68.317 1.00 0.00 H ATOM 9671 H2 WAT 9998 47.536 77.053 68.452 1.00 0.00 H TER 9673 WAT 9998 ATOM 9673 O WAT 9999 60.398 77.133 73.319 1.00 0.00 O ATOM 9674 H1 WAT 9999 60.751 77.072 72.431 1.00 0.00 H ATOM 9675 H2 WAT 9999 60.689 76.328 73.748 1.00 0.00 H TER 9677 WAT 9999 ATOM 9677 O WAT 0 90.242 31.096 103.555 1.00 0.00 O ATOM 9678 H1 WAT 0 90.206 30.757 104.450 1.00 0.00 H ATOM 9679 H2 WAT 0 91.144 31.398 103.450 1.00 0.00 H TER 9681 WAT 0 ATOM 9681 O WAT 1 139.758 138.805 134.121 1.00 0.00 O ATOM 9682 H1 WAT 1 140.563 138.477 134.521 1.00 0.00 H ATOM 9683 H2 WAT 1 139.057 138.336 134.573 1.00 0.00 H TER 9685 WAT 1 ATOM 9685 O WAT 2 111.854 64.369 147.847 1.00 0.00 O ATOM 9686 H1 WAT 2 112.690 64.633 148.231 1.00 0.00 H ATOM 9687 H2 WAT 2 112.083 64.041 146.977 1.00 0.00 H TER 9689 WAT 2 ATOM 9689 O WAT 3 42.811 123.926 109.537 1.00 0.00 O ATOM 9690 H1 WAT 3 43.623 123.705 109.080 1.00 0.00 H ATOM 9691 H2 WAT 3 42.342 123.094 109.606 1.00 0.00 H TER 9693 WAT 3 ATOM 9693 O WAT 4 86.569 10.474 2.006 1.00 0.00 O ATOM 9694 H1 WAT 4 86.213 11.151 2.581 1.00 0.00 H ATOM 9695 H2 WAT 4 86.584 9.684 2.547 1.00 0.00 H TER 9697 WAT 4 ATOM 9697 O WAT 5 43.779 119.435 157.759 1.00 0.00 O ATOM 9698 H1 WAT 5 43.773 119.778 158.653 1.00 0.00 H ATOM 9699 H2 WAT 5 44.453 119.947 157.311 1.00 0.00 H TER 9701 WAT 5 ATOM 9701 O WAT 6 13.331 72.911 147.562 1.00 0.00 O ATOM 9702 H1 WAT 6 12.418 72.635 147.482 1.00 0.00 H ATOM 9703 H2 WAT 6 13.303 73.863 147.474 1.00 0.00 H TER 9705 WAT 6 ATOM 9705 O WAT 7 88.593 45.866 1.795 1.00 0.00 O ATOM 9706 H1 WAT 7 89.034 45.654 2.618 1.00 0.00 H ATOM 9707 H2 WAT 7 88.531 45.030 1.334 1.00 0.00 H TER 9709 WAT 7 ATOM 9709 O WAT 8 14.387 96.538 110.950 1.00 0.00 O ATOM 9710 H1 WAT 8 13.456 96.696 111.106 1.00 0.00 H ATOM 9711 H2 WAT 8 14.503 96.698 110.013 1.00 0.00 H TER 9713 WAT 8 ATOM 9713 O WAT 9 32.628 2.948 10.961 1.00 0.00 O ATOM 9714 H1 WAT 9 31.923 2.679 11.549 1.00 0.00 H ATOM 9715 H2 WAT 9 32.745 2.204 10.370 1.00 0.00 H TER 9717 WAT 9 ATOM 9717 O WAT 10 124.205 48.547 130.525 1.00 0.00 O ATOM 9718 H1 WAT 10 123.724 49.373 130.478 1.00 0.00 H ATOM 9719 H2 WAT 10 124.910 48.715 131.150 1.00 0.00 H TER 9721 WAT 10 ATOM 9721 O WAT 11 21.223 115.044 5.255 1.00 0.00 O ATOM 9722 H1 WAT 11 20.779 114.459 4.641 1.00 0.00 H ATOM 9723 H2 WAT 11 22.155 114.916 5.075 1.00 0.00 H TER 9725 WAT 11 ATOM 9725 O WAT 12 109.166 24.627 124.901 1.00 0.00 O ATOM 9726 H1 WAT 12 109.428 25.052 124.085 1.00 0.00 H ATOM 9727 H2 WAT 12 108.815 25.337 125.439 1.00 0.00 H TER 9729 WAT 12 ATOM 9729 O WAT 13 9.547 138.560 82.737 1.00 0.00 O ATOM 9730 H1 WAT 13 10.454 138.764 82.964 1.00 0.00 H ATOM 9731 H2 WAT 13 9.181 139.393 82.441 1.00 0.00 H TER 9733 WAT 13 ATOM 9733 O WAT 14 143.000 44.672 6.385 1.00 0.00 O ATOM 9734 H1 WAT 14 143.904 44.407 6.217 1.00 0.00 H ATOM 9735 H2 WAT 14 143.078 45.470 6.909 1.00 0.00 H TER 9737 WAT 14 ATOM 9737 O WAT 15 46.180 116.801 119.811 1.00 0.00 O ATOM 9738 H1 WAT 15 46.893 117.438 119.857 1.00 0.00 H ATOM 9739 H2 WAT 15 45.412 117.318 119.569 1.00 0.00 H TER 9741 WAT 15 ATOM 9741 O WAT 16 77.246 44.777 131.154 1.00 0.00 O ATOM 9742 H1 WAT 16 77.853 44.392 130.522 1.00 0.00 H ATOM 9743 H2 WAT 16 77.527 45.688 131.233 1.00 0.00 H TER 9745 WAT 16 ATOM 9745 O WAT 17 108.734 94.012 98.497 1.00 0.00 O ATOM 9746 H1 WAT 17 108.325 94.273 97.672 1.00 0.00 H ATOM 9747 H2 WAT 17 108.183 94.405 99.173 1.00 0.00 H TER 9749 WAT 17 ATOM 9749 O WAT 18 34.859 14.518 66.571 1.00 0.00 O ATOM 9750 H1 WAT 18 35.796 14.713 66.549 1.00 0.00 H ATOM 9751 H2 WAT 18 34.795 13.709 67.079 1.00 0.00 H TER 9753 WAT 18 ATOM 9753 O WAT 19 42.395 125.090 73.922 1.00 0.00 O ATOM 9754 H1 WAT 19 41.732 125.055 73.232 1.00 0.00 H ATOM 9755 H2 WAT 19 42.898 124.283 73.811 1.00 0.00 H TER 9757 WAT 19 ATOM 9757 O WAT 20 65.865 8.596 47.362 1.00 0.00 O ATOM 9758 H1 WAT 20 65.864 8.594 46.404 1.00 0.00 H ATOM 9759 H2 WAT 20 65.252 9.291 47.600 1.00 0.00 H TER 9761 WAT 20 ATOM 9761 O WAT 21 70.490 101.395 15.234 1.00 0.00 O ATOM 9762 H1 WAT 21 69.776 101.449 14.598 1.00 0.00 H ATOM 9763 H2 WAT 21 71.132 102.036 14.929 1.00 0.00 H TER 9765 WAT 21 ATOM 9765 O WAT 22 65.854 60.966 137.982 1.00 0.00 O ATOM 9766 H1 WAT 22 66.166 61.185 138.860 1.00 0.00 H ATOM 9767 H2 WAT 22 66.652 60.852 137.466 1.00 0.00 H TER 9769 WAT 22 ATOM 9769 O WAT 23 22.510 3.578 0.438 1.00 0.00 O ATOM 9770 H1 WAT 23 22.535 2.982 1.187 1.00 0.00 H ATOM 9771 H2 WAT 23 23.430 3.765 0.250 1.00 0.00 H TER 9773 WAT 23 ATOM 9773 O WAT 24 13.193 132.556 76.928 1.00 0.00 O ATOM 9774 H1 WAT 24 13.454 132.703 77.837 1.00 0.00 H ATOM 9775 H2 WAT 24 13.517 133.324 76.458 1.00 0.00 H TER 9777 WAT 24 ATOM 9777 O WAT 25 83.531 114.565 94.448 1.00 0.00 O ATOM 9778 H1 WAT 25 83.559 113.798 95.019 1.00 0.00 H ATOM 9779 H2 WAT 25 83.042 114.274 93.678 1.00 0.00 H TER 9781 WAT 25 ATOM 9781 O WAT 26 49.776 139.891 148.580 1.00 0.00 O ATOM 9782 H1 WAT 26 50.363 140.607 148.824 1.00 0.00 H ATOM 9783 H2 WAT 26 50.360 139.171 148.344 1.00 0.00 H TER 9785 WAT 26 ATOM 9785 O WAT 27 13.460 81.766 74.452 1.00 0.00 O ATOM 9786 H1 WAT 27 14.402 81.657 74.584 1.00 0.00 H ATOM 9787 H2 WAT 27 13.176 80.943 74.053 1.00 0.00 H TER 9789 WAT 27 ATOM 9789 O WAT 28 57.248 37.790 113.634 1.00 0.00 O ATOM 9790 H1 WAT 28 57.161 38.396 114.370 1.00 0.00 H ATOM 9791 H2 WAT 28 56.371 37.421 113.524 1.00 0.00 H TER 9793 WAT 28 ATOM 9793 O WAT 29 142.548 133.736 16.500 1.00 0.00 O ATOM 9794 H1 WAT 29 143.446 133.434 16.632 1.00 0.00 H ATOM 9795 H2 WAT 29 142.213 133.885 17.384 1.00 0.00 H TER 9797 WAT 29 ATOM 9797 O WAT 30 73.246 5.445 78.828 1.00 0.00 O ATOM 9798 H1 WAT 30 73.859 5.495 79.561 1.00 0.00 H ATOM 9799 H2 WAT 30 72.396 5.282 79.236 1.00 0.00 H TER 9801 WAT 30 ATOM 9801 O WAT 31 34.848 122.333 65.966 1.00 0.00 O ATOM 9802 H1 WAT 31 35.476 123.017 66.199 1.00 0.00 H ATOM 9803 H2 WAT 31 35.288 121.515 66.197 1.00 0.00 H TER 9805 WAT 31 ATOM 9805 O WAT 32 13.589 56.171 62.031 1.00 0.00 O ATOM 9806 H1 WAT 32 12.808 55.876 62.499 1.00 0.00 H ATOM 9807 H2 WAT 32 13.825 55.431 61.471 1.00 0.00 H TER 9809 WAT 32 ATOM 9809 O WAT 33 93.560 60.492 158.279 1.00 0.00 O ATOM 9810 H1 WAT 33 93.528 60.728 157.352 1.00 0.00 H ATOM 9811 H2 WAT 33 93.932 59.610 158.289 1.00 0.00 H TER 9813 WAT 33 ATOM 9813 O WAT 34 49.389 122.382 130.560 1.00 0.00 O ATOM 9814 H1 WAT 34 48.993 122.802 129.796 1.00 0.00 H ATOM 9815 H2 WAT 34 48.655 122.224 131.154 1.00 0.00 H TER 9817 WAT 34 ATOM 9817 O WAT 35 8.189 57.043 0.865 1.00 0.00 O ATOM 9818 H1 WAT 35 8.334 57.251 -0.058 1.00 0.00 H ATOM 9819 H2 WAT 35 8.651 57.732 1.342 1.00 0.00 H TER 9821 WAT 35 ATOM 9821 O WAT 36 112.118 37.709 7.687 1.00 0.00 O ATOM 9822 H1 WAT 36 111.509 37.403 7.015 1.00 0.00 H ATOM 9823 H2 WAT 36 111.639 38.397 8.149 1.00 0.00 H TER 9825 WAT 36 ATOM 9825 O WAT 37 27.534 32.344 131.702 1.00 0.00 O ATOM 9826 H1 WAT 37 27.495 32.826 130.876 1.00 0.00 H ATOM 9827 H2 WAT 37 28.372 32.599 132.089 1.00 0.00 H TER 9829 WAT 37 ATOM 9829 O WAT 38 36.517 48.757 76.109 1.00 0.00 O ATOM 9830 H1 WAT 38 35.814 48.108 76.084 1.00 0.00 H ATOM 9831 H2 WAT 38 36.648 48.932 77.040 1.00 0.00 H TER 9833 WAT 38 ATOM 9833 O WAT 39 123.435 118.221 73.691 1.00 0.00 O ATOM 9834 H1 WAT 39 122.625 118.194 73.181 1.00 0.00 H ATOM 9835 H2 WAT 39 123.395 117.442 74.245 1.00 0.00 H TER 9837 WAT 39 ATOM 9837 O WAT 40 63.075 115.514 119.844 1.00 0.00 O ATOM 9838 H1 WAT 40 63.114 115.139 118.964 1.00 0.00 H ATOM 9839 H2 WAT 40 63.749 116.194 119.844 1.00 0.00 H TER 9841 WAT 40 ATOM 9841 O WAT 41 15.582 85.476 111.365 1.00 0.00 O ATOM 9842 H1 WAT 41 15.490 84.593 111.722 1.00 0.00 H ATOM 9843 H2 WAT 41 15.088 85.456 110.545 1.00 0.00 H TER 9845 WAT 41 ATOM 9845 O WAT 42 22.745 86.573 63.641 1.00 0.00 O ATOM 9846 H1 WAT 42 23.635 86.722 63.322 1.00 0.00 H ATOM 9847 H2 WAT 42 22.193 86.667 62.865 1.00 0.00 H TER 9849 WAT 42 ATOM 9849 O WAT 43 123.626 101.265 65.607 1.00 0.00 O ATOM 9850 H1 WAT 43 122.832 101.799 65.652 1.00 0.00 H ATOM 9851 H2 WAT 43 123.746 101.093 64.673 1.00 0.00 H TER 9853 WAT 43 ATOM 9853 O WAT 44 66.626 43.133 88.189 1.00 0.00 O ATOM 9854 H1 WAT 44 66.340 43.771 88.842 1.00 0.00 H ATOM 9855 H2 WAT 44 67.001 43.662 87.485 1.00 0.00 H TER 9857 WAT 44 ATOM 9857 O WAT 45 17.778 20.709 135.863 1.00 0.00 O ATOM 9858 H1 WAT 45 17.957 20.618 136.799 1.00 0.00 H ATOM 9859 H2 WAT 45 16.832 20.584 135.787 1.00 0.00 H TER 9861 WAT 45 ATOM 9861 O WAT 46 25.344 126.757 79.999 1.00 0.00 O ATOM 9862 H1 WAT 46 25.103 126.924 79.088 1.00 0.00 H ATOM 9863 H2 WAT 46 25.637 127.606 80.329 1.00 0.00 H TER 9865 WAT 46 ATOM 9865 O WAT 47 63.718 23.410 116.446 1.00 0.00 O ATOM 9866 H1 WAT 47 63.662 22.454 116.445 1.00 0.00 H ATOM 9867 H2 WAT 47 63.000 23.692 115.879 1.00 0.00 H TER 9869 WAT 47 ATOM 9869 O WAT 48 52.003 108.187 137.249 1.00 0.00 O ATOM 9870 H1 WAT 48 52.753 108.571 137.703 1.00 0.00 H ATOM 9871 H2 WAT 48 52.326 107.347 136.923 1.00 0.00 H TER 9873 WAT 48 ATOM 9873 O WAT 49 90.177 133.255 79.863 1.00 0.00 O ATOM 9874 H1 WAT 49 90.599 133.309 80.721 1.00 0.00 H ATOM 9875 H2 WAT 49 89.444 132.654 79.994 1.00 0.00 H TER 9877 WAT 49 ATOM 9877 O WAT 50 41.146 48.855 5.797 1.00 0.00 O ATOM 9878 H1 WAT 50 41.929 48.773 6.343 1.00 0.00 H ATOM 9879 H2 WAT 50 40.547 49.391 6.317 1.00 0.00 H TER 9881 WAT 50 ATOM 9881 O WAT 51 140.511 121.606 138.289 1.00 0.00 O ATOM 9882 H1 WAT 51 141.432 121.773 138.088 1.00 0.00 H ATOM 9883 H2 WAT 51 140.521 121.249 139.177 1.00 0.00 H TER 9885 WAT 51 ATOM 9885 O WAT 52 133.326 132.839 109.220 1.00 0.00 O ATOM 9886 H1 WAT 52 132.737 132.931 108.472 1.00 0.00 H ATOM 9887 H2 WAT 52 133.937 132.149 108.961 1.00 0.00 H TER 9889 WAT 52 ATOM 9889 O WAT 53 31.956 73.116 139.308 1.00 0.00 O ATOM 9890 H1 WAT 53 31.520 73.836 139.765 1.00 0.00 H ATOM 9891 H2 WAT 53 31.308 72.411 139.301 1.00 0.00 H TER 9893 WAT 53 ATOM 9893 O WAT 54 107.128 134.359 68.401 1.00 0.00 O ATOM 9894 H1 WAT 54 106.909 134.036 67.528 1.00 0.00 H ATOM 9895 H2 WAT 54 107.466 133.592 68.863 1.00 0.00 H TER 9897 WAT 54 ATOM 9897 O WAT 55 118.226 30.237 147.589 1.00 0.00 O ATOM 9898 H1 WAT 55 119.138 30.151 147.868 1.00 0.00 H ATOM 9899 H2 WAT 55 117.996 29.372 147.251 1.00 0.00 H TER 9901 WAT 55 ATOM 9901 O WAT 56 95.197 5.899 114.549 1.00 0.00 O ATOM 9902 H1 WAT 56 95.229 4.945 114.485 1.00 0.00 H ATOM 9903 H2 WAT 56 96.067 6.187 114.272 1.00 0.00 H TER 9905 WAT 56 ATOM 9905 O WAT 57 99.662 122.130 148.962 1.00 0.00 O ATOM 9906 H1 WAT 57 99.927 121.235 149.176 1.00 0.00 H ATOM 9907 H2 WAT 57 98.984 122.026 148.294 1.00 0.00 H TER 9909 WAT 57 ATOM 9909 O WAT 58 142.559 60.764 122.288 1.00 0.00 O ATOM 9910 H1 WAT 58 143.439 60.853 121.922 1.00 0.00 H ATOM 9911 H2 WAT 58 142.516 59.857 122.591 1.00 0.00 H TER 9913 WAT 58 ATOM 9913 O WAT 59 88.461 79.371 9.279 1.00 0.00 O ATOM 9914 H1 WAT 59 88.428 78.522 8.838 1.00 0.00 H ATOM 9915 H2 WAT 59 87.544 79.632 9.364 1.00 0.00 H TER 9917 WAT 59 ATOM 9917 O WAT 60 49.554 134.236 96.913 1.00 0.00 O ATOM 9918 H1 WAT 60 50.003 135.015 96.586 1.00 0.00 H ATOM 9919 H2 WAT 60 49.858 134.145 97.816 1.00 0.00 H TER 9921 WAT 60 ATOM 9921 O WAT 61 32.109 120.204 116.953 1.00 0.00 O ATOM 9922 H1 WAT 61 32.420 119.611 116.269 1.00 0.00 H ATOM 9923 H2 WAT 61 31.310 120.589 116.592 1.00 0.00 H TER 9925 WAT 61 ATOM 9925 O WAT 62 2.148 97.701 7.524 1.00 0.00 O ATOM 9926 H1 WAT 62 2.603 97.289 6.789 1.00 0.00 H ATOM 9927 H2 WAT 62 2.288 98.639 7.397 1.00 0.00 H TER 9929 WAT 62 ATOM 9929 O WAT 63 10.474 79.072 133.986 1.00 0.00 O ATOM 9930 H1 WAT 63 10.966 78.251 133.983 1.00 0.00 H ATOM 9931 H2 WAT 63 9.583 78.818 133.744 1.00 0.00 H TER 9933 WAT 63 ATOM 9933 O WAT 64 108.255 117.394 92.905 1.00 0.00 O ATOM 9934 H1 WAT 64 108.742 117.072 92.147 1.00 0.00 H ATOM 9935 H2 WAT 64 108.828 117.215 93.651 1.00 0.00 H TER 9937 WAT 64 ATOM 9937 O WAT 65 136.281 87.196 79.575 1.00 0.00 O ATOM 9938 H1 WAT 65 137.232 87.130 79.659 1.00 0.00 H ATOM 9939 H2 WAT 65 135.963 87.230 80.477 1.00 0.00 H TER 9941 WAT 65 ATOM 9941 O WAT 66 14.559 138.423 95.244 1.00 0.00 O ATOM 9942 H1 WAT 66 13.908 137.734 95.377 1.00 0.00 H ATOM 9943 H2 WAT 66 15.389 137.955 95.155 1.00 0.00 H TER 9945 WAT 66 ATOM 9945 O WAT 67 110.475 120.197 103.802 1.00 0.00 O ATOM 9946 H1 WAT 67 110.600 120.624 104.649 1.00 0.00 H ATOM 9947 H2 WAT 67 109.967 119.411 104.002 1.00 0.00 H TER 9949 WAT 67 ATOM 9949 O WAT 68 91.776 86.752 74.173 1.00 0.00 O ATOM 9950 H1 WAT 68 91.317 86.268 74.859 1.00 0.00 H ATOM 9951 H2 WAT 68 92.608 87.005 74.574 1.00 0.00 H TER 9953 WAT 68 ATOM 9953 O WAT 69 54.827 50.559 133.634 1.00 0.00 O ATOM 9954 H1 WAT 69 55.226 51.045 134.356 1.00 0.00 H ATOM 9955 H2 WAT 69 54.893 51.150 132.883 1.00 0.00 H TER 9957 WAT 69 ATOM 9957 O WAT 70 53.661 140.910 73.422 1.00 0.00 O ATOM 9958 H1 WAT 70 53.572 140.544 72.542 1.00 0.00 H ATOM 9959 H2 WAT 70 54.442 141.461 73.374 1.00 0.00 H TER 9961 WAT 70 ATOM 9961 O WAT 71 65.748 104.695 141.458 1.00 0.00 O ATOM 9962 H1 WAT 71 65.550 105.576 141.775 1.00 0.00 H ATOM 9963 H2 WAT 71 65.421 104.114 142.145 1.00 0.00 H TER 9965 WAT 71 ATOM 9965 O WAT 72 65.704 78.593 67.787 1.00 0.00 O ATOM 9966 H1 WAT 72 64.796 78.633 68.087 1.00 0.00 H ATOM 9967 H2 WAT 72 66.221 78.551 68.592 1.00 0.00 H TER 9969 WAT 72 ATOM 9969 O WAT 73 23.977 93.309 76.699 1.00 0.00 O ATOM 9970 H1 WAT 73 24.365 93.385 77.571 1.00 0.00 H ATOM 9971 H2 WAT 73 23.989 92.370 76.512 1.00 0.00 H TER 9973 WAT 73 ATOM 9973 O WAT 74 7.757 11.843 116.332 1.00 0.00 O ATOM 9974 H1 WAT 74 8.296 11.835 115.542 1.00 0.00 H ATOM 9975 H2 WAT 74 7.194 11.073 116.245 1.00 0.00 H TER 9977 WAT 74 ATOM 9977 O WAT 75 20.657 127.645 57.705 1.00 0.00 O ATOM 9978 H1 WAT 75 20.963 128.178 56.971 1.00 0.00 H ATOM 9979 H2 WAT 75 20.080 126.994 57.304 1.00 0.00 H TER 9981 WAT 75 ATOM 9981 O WAT 76 70.795 6.171 19.415 1.00 0.00 O ATOM 9982 H1 WAT 76 71.225 5.601 18.778 1.00 0.00 H ATOM 9983 H2 WAT 76 69.899 5.840 19.466 1.00 0.00 H TER 9985 WAT 76 ATOM 9985 O WAT 77 145.778 34.961 130.264 1.00 0.00 O ATOM 9986 H1 WAT 77 146.368 35.194 130.981 1.00 0.00 H ATOM 9987 H2 WAT 77 145.204 35.721 130.169 1.00 0.00 H TER 9989 WAT 77 ATOM 9989 O WAT 78 18.054 86.385 155.690 1.00 0.00 O ATOM 9990 H1 WAT 78 18.465 86.592 154.850 1.00 0.00 H ATOM 9991 H2 WAT 78 18.741 85.947 156.191 1.00 0.00 H TER 9993 WAT 78 ATOM 9993 O WAT 79 51.027 89.598 103.284 1.00 0.00 O ATOM 9994 H1 WAT 79 50.340 89.907 102.693 1.00 0.00 H ATOM 9995 H2 WAT 79 51.762 90.190 103.128 1.00 0.00 H TER 9997 WAT 79 ATOM 9997 O WAT 80 55.573 80.364 26.473 1.00 0.00 O ATOM 9998 H1 WAT 80 55.831 81.108 27.018 1.00 0.00 H ATOM 9999 H2 WAT 80 56.022 79.614 26.865 1.00 0.00 H TER 10001 WAT 80 ATOM 10001 O WAT 81 79.132 16.262 145.735 1.00 0.00 O ATOM 10002 H1 WAT 81 79.825 16.921 145.755 1.00 0.00 H ATOM 10003 H2 WAT 81 79.579 15.452 145.489 1.00 0.00 H TER 10005 WAT 81 ATOM 10005 O WAT 82 99.502 42.290 149.001 1.00 0.00 O ATOM 10006 H1 WAT 82 99.004 42.059 149.785 1.00 0.00 H ATOM 10007 H2 WAT 82 100.329 42.636 149.336 1.00 0.00 H TER 10009 WAT 82 ATOM 10009 O WAT 83 76.874 64.265 88.715 1.00 0.00 O ATOM 10010 H1 WAT 83 76.572 65.152 88.913 1.00 0.00 H ATOM 10011 H2 WAT 83 77.513 64.382 88.012 1.00 0.00 H TER 10013 WAT 83 ATOM 10013 O WAT 84 90.160 72.359 147.425 1.00 0.00 O ATOM 10014 H1 WAT 84 89.772 71.620 146.957 1.00 0.00 H ATOM 10015 H2 WAT 84 90.830 72.695 146.829 1.00 0.00 H TER 10017 WAT 84 ATOM 10017 O WAT 85 28.589 33.120 13.784 1.00 0.00 O ATOM 10018 H1 WAT 85 28.002 33.522 14.424 1.00 0.00 H ATOM 10019 H2 WAT 85 29.443 33.514 13.962 1.00 0.00 H TER 10021 WAT 85 ATOM 10021 O WAT 86 78.070 71.718 99.198 1.00 0.00 O ATOM 10022 H1 WAT 86 77.292 71.258 98.882 1.00 0.00 H ATOM 10023 H2 WAT 86 77.819 72.642 99.197 1.00 0.00 H TER 10025 WAT 86 ATOM 10025 O WAT 87 34.918 134.979 135.979 1.00 0.00 O ATOM 10026 H1 WAT 87 34.907 135.583 135.237 1.00 0.00 H ATOM 10027 H2 WAT 87 35.648 134.388 135.797 1.00 0.00 H TER 10029 WAT 87 ATOM 10029 O WAT 88 26.717 26.886 79.649 1.00 0.00 O ATOM 10030 H1 WAT 88 26.428 27.343 78.859 1.00 0.00 H ATOM 10031 H2 WAT 88 27.569 26.518 79.416 1.00 0.00 H TER 10033 WAT 88 ATOM 10033 O WAT 89 36.749 106.339 64.354 1.00 0.00 O ATOM 10034 H1 WAT 89 37.087 105.589 63.865 1.00 0.00 H ATOM 10035 H2 WAT 89 36.972 106.152 65.266 1.00 0.00 H TER 10037 WAT 89 ATOM 10037 O WAT 90 7.898 41.568 131.348 1.00 0.00 O ATOM 10038 H1 WAT 90 7.143 41.427 130.777 1.00 0.00 H ATOM 10039 H2 WAT 90 7.560 42.105 132.064 1.00 0.00 H TER 10041 WAT 90 ATOM 10041 O WAT 91 112.127 84.576 129.862 1.00 0.00 O ATOM 10042 H1 WAT 91 111.667 84.736 129.038 1.00 0.00 H ATOM 10043 H2 WAT 91 113.023 84.366 129.599 1.00 0.00 H TER 10045 WAT 91 ATOM 10045 O WAT 92 56.575 46.786 140.679 1.00 0.00 O ATOM 10046 H1 WAT 92 57.056 46.019 140.370 1.00 0.00 H ATOM 10047 H2 WAT 92 55.735 46.438 140.978 1.00 0.00 H TER 10049 WAT 92 ATOM 10049 O WAT 93 134.808 115.689 16.469 1.00 0.00 O ATOM 10050 H1 WAT 93 134.567 114.786 16.677 1.00 0.00 H ATOM 10051 H2 WAT 93 135.351 115.618 15.685 1.00 0.00 H TER 10053 WAT 93 ATOM 10053 O WAT 94 71.683 120.497 2.018 1.00 0.00 O ATOM 10054 H1 WAT 94 71.905 120.444 1.088 1.00 0.00 H ATOM 10055 H2 WAT 94 70.726 120.509 2.036 1.00 0.00 H TER 10057 WAT 94 ATOM 10057 O WAT 95 62.819 99.465 85.093 1.00 0.00 O ATOM 10058 H1 WAT 95 62.801 99.457 84.136 1.00 0.00 H ATOM 10059 H2 WAT 95 63.729 99.268 85.318 1.00 0.00 H TER 10061 WAT 95 ATOM 10061 O WAT 96 119.710 68.606 13.328 1.00 0.00 O ATOM 10062 H1 WAT 96 120.020 69.400 12.894 1.00 0.00 H ATOM 10063 H2 WAT 96 118.814 68.813 13.593 1.00 0.00 H TER 10065 WAT 96 ATOM 10065 O WAT 97 101.984 31.651 155.757 1.00 0.00 O ATOM 10066 H1 WAT 97 101.321 30.977 155.906 1.00 0.00 H ATOM 10067 H2 WAT 97 102.436 31.731 156.597 1.00 0.00 H TER 10069 WAT 97 ATOM 10069 O WAT 98 62.173 71.283 121.111 1.00 0.00 O ATOM 10070 H1 WAT 98 62.667 71.568 121.879 1.00 0.00 H ATOM 10071 H2 WAT 98 62.409 70.362 121.002 1.00 0.00 H TER 10073 WAT 98 ATOM 10073 O WAT 99 118.266 93.187 85.728 1.00 0.00 O ATOM 10074 H1 WAT 99 119.070 93.703 85.770 1.00 0.00 H ATOM 10075 H2 WAT 99 117.881 93.271 86.600 1.00 0.00 H TER 10077 WAT 99 ATOM 10077 O WAT 100 97.768 64.882 61.893 1.00 0.00 O ATOM 10078 H1 WAT 100 98.212 65.494 62.480 1.00 0.00 H ATOM 10079 H2 WAT 100 97.150 64.416 62.456 1.00 0.00 H TER 10081 WAT 100 ATOM 10081 O WAT 101 51.621 97.986 101.757 1.00 0.00 O ATOM 10082 H1 WAT 101 51.977 97.855 102.636 1.00 0.00 H ATOM 10083 H2 WAT 101 50.959 98.668 101.865 1.00 0.00 H TER 10085 WAT 101 ATOM 10085 O WAT 102 141.534 24.207 18.480 1.00 0.00 O ATOM 10086 H1 WAT 102 141.636 23.453 19.059 1.00 0.00 H ATOM 10087 H2 WAT 102 142.376 24.660 18.526 1.00 0.00 H TER 10089 WAT 102 ATOM 10089 O WAT 103 23.800 141.264 74.450 1.00 0.00 O ATOM 10090 H1 WAT 103 24.184 141.014 75.290 1.00 0.00 H ATOM 10091 H2 WAT 103 24.122 142.152 74.293 1.00 0.00 H TER 10093 WAT 103 ATOM 10093 O WAT 104 103.744 65.706 96.976 1.00 0.00 O ATOM 10094 H1 WAT 104 103.352 64.872 96.717 1.00 0.00 H ATOM 10095 H2 WAT 104 104.260 65.975 96.216 1.00 0.00 H TER 10097 WAT 104 ATOM 10097 O WAT 105 59.785 10.430 12.389 1.00 0.00 O ATOM 10098 H1 WAT 105 60.459 10.991 12.004 1.00 0.00 H ATOM 10099 H2 WAT 105 60.237 9.608 12.579 1.00 0.00 H TER 10101 WAT 105 ATOM 10101 O WAT 106 82.662 28.989 15.620 1.00 0.00 O ATOM 10102 H1 WAT 106 82.395 28.806 16.521 1.00 0.00 H ATOM 10103 H2 WAT 106 81.840 29.039 15.132 1.00 0.00 H TER 10105 WAT 106 ATOM 10105 O WAT 107 11.936 56.340 10.559 1.00 0.00 O ATOM 10106 H1 WAT 107 12.606 57.024 10.540 1.00 0.00 H ATOM 10107 H2 WAT 107 11.107 56.818 10.553 1.00 0.00 H TER 10109 WAT 107 ATOM 10109 O WAT 108 27.760 21.972 96.729 1.00 0.00 O ATOM 10110 H1 WAT 108 27.679 21.473 97.542 1.00 0.00 H ATOM 10111 H2 WAT 108 28.486 21.556 96.264 1.00 0.00 H TER 10113 WAT 108 ATOM 10113 O WAT 109 135.008 87.251 82.196 1.00 0.00 O ATOM 10114 H1 WAT 109 135.161 86.503 82.774 1.00 0.00 H ATOM 10115 H2 WAT 109 135.303 88.008 82.702 1.00 0.00 H TER 10117 WAT 109 ATOM 10117 O WAT 110 16.528 44.317 114.877 1.00 0.00 O ATOM 10118 H1 WAT 110 16.675 44.895 115.625 1.00 0.00 H ATOM 10119 H2 WAT 110 15.922 43.652 115.203 1.00 0.00 H TER 10121 WAT 110 ATOM 10121 O WAT 111 41.789 106.157 59.471 1.00 0.00 O ATOM 10122 H1 WAT 111 41.249 105.408 59.219 1.00 0.00 H ATOM 10123 H2 WAT 111 41.172 106.778 59.857 1.00 0.00 H TER 10125 WAT 111 ATOM 10125 O WAT 112 111.479 93.793 66.497 1.00 0.00 O ATOM 10126 H1 WAT 112 110.831 93.847 65.795 1.00 0.00 H ATOM 10127 H2 WAT 112 112.120 93.155 66.183 1.00 0.00 H TER 10129 WAT 112 ATOM 10129 O WAT 113 78.406 16.673 6.699 1.00 0.00 O ATOM 10130 H1 WAT 113 77.572 16.918 6.297 1.00 0.00 H ATOM 10131 H2 WAT 113 78.706 15.921 6.188 1.00 0.00 H TER 10133 WAT 113 ATOM 10133 O WAT 114 38.356 28.214 62.923 1.00 0.00 O ATOM 10134 H1 WAT 114 37.904 28.833 63.497 1.00 0.00 H ATOM 10135 H2 WAT 114 38.739 28.760 62.237 1.00 0.00 H TER 10137 WAT 114 ATOM 10137 O WAT 115 109.079 31.406 13.497 1.00 0.00 O ATOM 10138 H1 WAT 115 109.801 30.794 13.641 1.00 0.00 H ATOM 10139 H2 WAT 115 109.125 31.615 12.564 1.00 0.00 H TER 10141 WAT 115 ATOM 10141 O WAT 116 33.166 44.697 77.380 1.00 0.00 O ATOM 10142 H1 WAT 116 32.800 43.911 76.973 1.00 0.00 H ATOM 10143 H2 WAT 116 33.145 44.511 78.319 1.00 0.00 H TER 10145 WAT 116 ATOM 10145 O WAT 117 99.802 65.961 135.530 1.00 0.00 O ATOM 10146 H1 WAT 117 98.988 65.488 135.703 1.00 0.00 H ATOM 10147 H2 WAT 117 99.810 66.085 134.581 1.00 0.00 H TER 10149 WAT 117 ATOM 10149 O WAT 118 134.998 49.875 58.342 1.00 0.00 O ATOM 10150 H1 WAT 118 134.396 49.306 57.862 1.00 0.00 H ATOM 10151 H2 WAT 118 134.435 50.539 58.739 1.00 0.00 H TER 10153 WAT 118 ATOM 10153 O WAT 119 102.439 117.471 154.198 1.00 0.00 O ATOM 10154 H1 WAT 119 102.697 117.608 153.287 1.00 0.00 H ATOM 10155 H2 WAT 119 103.052 116.812 154.524 1.00 0.00 H TER 10157 WAT 119 ATOM 10157 O WAT 120 7.256 3.304 101.480 1.00 0.00 O ATOM 10158 H1 WAT 120 6.577 2.804 101.933 1.00 0.00 H ATOM 10159 H2 WAT 120 6.923 3.408 100.589 1.00 0.00 H TER 10161 WAT 120 ATOM 10161 O WAT 121 66.005 43.934 63.483 1.00 0.00 O ATOM 10162 H1 WAT 121 66.509 43.352 64.051 1.00 0.00 H ATOM 10163 H2 WAT 121 65.110 43.597 63.530 1.00 0.00 H TER 10165 WAT 121 ATOM 10165 O WAT 122 117.731 2.456 103.623 1.00 0.00 O ATOM 10166 H1 WAT 122 117.733 1.499 103.590 1.00 0.00 H ATOM 10167 H2 WAT 122 117.936 2.665 104.535 1.00 0.00 H TER 10169 WAT 122 ATOM 10169 O WAT 123 44.701 98.280 71.097 1.00 0.00 O ATOM 10170 H1 WAT 123 44.332 99.163 71.067 1.00 0.00 H ATOM 10171 H2 WAT 123 44.663 97.974 70.190 1.00 0.00 H TER 10173 WAT 123 ATOM 10173 O WAT 124 39.122 55.656 118.380 1.00 0.00 O ATOM 10174 H1 WAT 124 39.245 54.736 118.613 1.00 0.00 H ATOM 10175 H2 WAT 124 39.635 56.138 119.028 1.00 0.00 H TER 10177 WAT 124 ATOM 10177 O WAT 125 87.137 38.008 118.669 1.00 0.00 O ATOM 10178 H1 WAT 125 87.840 38.639 118.824 1.00 0.00 H ATOM 10179 H2 WAT 125 86.603 38.408 117.982 1.00 0.00 H TER 10181 WAT 125 ATOM 10181 O WAT 126 119.901 144.690 142.532 1.00 0.00 O ATOM 10182 H1 WAT 126 120.309 144.695 143.399 1.00 0.00 H ATOM 10183 H2 WAT 126 119.939 145.602 142.245 1.00 0.00 H TER 10185 WAT 126 ATOM 10185 O WAT 127 36.588 108.315 11.022 1.00 0.00 O ATOM 10186 H1 WAT 127 36.763 109.052 10.438 1.00 0.00 H ATOM 10187 H2 WAT 127 36.540 107.555 10.442 1.00 0.00 H TER 10189 WAT 127 ATOM 10189 O WAT 128 72.708 91.701 26.588 1.00 0.00 O ATOM 10190 H1 WAT 128 72.875 91.350 25.713 1.00 0.00 H ATOM 10191 H2 WAT 128 72.584 90.927 27.137 1.00 0.00 H TER 10193 WAT 128 ATOM 10193 O WAT 129 83.434 126.600 151.460 1.00 0.00 O ATOM 10194 H1 WAT 129 83.772 126.034 152.154 1.00 0.00 H ATOM 10195 H2 WAT 129 82.499 126.679 151.650 1.00 0.00 H TER 10197 WAT 129 ATOM 10197 O WAT 130 56.387 3.887 81.285 1.00 0.00 O ATOM 10198 H1 WAT 130 55.461 4.128 81.253 1.00 0.00 H ATOM 10199 H2 WAT 130 56.664 3.879 80.369 1.00 0.00 H TER 10201 WAT 130 ATOM 10201 O WAT 131 5.671 23.704 111.813 1.00 0.00 O ATOM 10202 H1 WAT 131 4.797 23.437 111.528 1.00 0.00 H ATOM 10203 H2 WAT 131 6.044 22.918 112.211 1.00 0.00 H TER 10205 WAT 131 ATOM 10205 O WAT 132 95.437 84.401 151.748 1.00 0.00 O ATOM 10206 H1 WAT 132 95.613 84.056 152.623 1.00 0.00 H ATOM 10207 H2 WAT 132 95.045 83.666 151.275 1.00 0.00 H TER 10209 WAT 132 ATOM 10209 O WAT 133 22.673 3.011 97.918 1.00 0.00 O ATOM 10210 H1 WAT 133 22.548 2.106 97.635 1.00 0.00 H ATOM 10211 H2 WAT 133 22.711 2.960 98.873 1.00 0.00 H TER 10213 WAT 133 ATOM 10213 O WAT 134 4.110 51.383 88.869 1.00 0.00 O ATOM 10214 H1 WAT 134 3.915 50.581 88.385 1.00 0.00 H ATOM 10215 H2 WAT 134 3.823 52.088 88.289 1.00 0.00 H TER 10217 WAT 134 ATOM 10217 O WAT 135 103.491 43.940 136.682 1.00 0.00 O ATOM 10218 H1 WAT 135 104.228 43.834 137.284 1.00 0.00 H ATOM 10219 H2 WAT 135 102.716 43.781 137.222 1.00 0.00 H TER 10221 WAT 135 ATOM 10221 O WAT 136 4.533 34.298 100.744 1.00 0.00 O ATOM 10222 H1 WAT 136 4.505 33.545 100.154 1.00 0.00 H ATOM 10223 H2 WAT 136 5.382 34.706 100.571 1.00 0.00 H TER 10225 WAT 136 ATOM 10225 O WAT 137 116.810 134.082 82.519 1.00 0.00 O ATOM 10226 H1 WAT 137 115.995 134.397 82.911 1.00 0.00 H ATOM 10227 H2 WAT 137 116.701 134.239 81.581 1.00 0.00 H TER 10229 WAT 137 ATOM 10229 O WAT 138 32.403 92.234 104.332 1.00 0.00 O ATOM 10230 H1 WAT 138 33.357 92.189 104.264 1.00 0.00 H ATOM 10231 H2 WAT 138 32.236 93.023 104.846 1.00 0.00 H TER 10233 WAT 138 ATOM 10233 O WAT 139 13.973 92.997 92.956 1.00 0.00 O ATOM 10234 H1 WAT 139 14.697 92.791 92.365 1.00 0.00 H ATOM 10235 H2 WAT 139 13.911 93.951 92.935 1.00 0.00 H TER 10237 WAT 139 ATOM 10237 O WAT 140 50.665 76.153 143.672 1.00 0.00 O ATOM 10238 H1 WAT 140 51.445 76.257 143.127 1.00 0.00 H ATOM 10239 H2 WAT 140 50.565 76.997 144.112 1.00 0.00 H TER 10241 WAT 140 ATOM 10241 O WAT 141 23.363 38.087 18.199 1.00 0.00 O ATOM 10242 H1 WAT 141 22.508 37.660 18.257 1.00 0.00 H ATOM 10243 H2 WAT 141 23.868 37.532 17.604 1.00 0.00 H TER 10245 WAT 141 ATOM 10245 O WAT 142 38.810 105.192 122.066 1.00 0.00 O ATOM 10246 H1 WAT 142 39.306 105.161 121.247 1.00 0.00 H ATOM 10247 H2 WAT 142 39.173 105.942 122.537 1.00 0.00 H TER 10249 WAT 142 ATOM 10249 O WAT 143 12.593 113.276 16.135 1.00 0.00 O ATOM 10250 H1 WAT 143 11.714 113.086 16.462 1.00 0.00 H ATOM 10251 H2 WAT 143 13.049 112.435 16.174 1.00 0.00 H TER 10253 WAT 143 ATOM 10253 O WAT 144 25.722 78.919 19.143 1.00 0.00 O ATOM 10254 H1 WAT 144 25.261 78.082 19.199 1.00 0.00 H ATOM 10255 H2 WAT 144 25.351 79.345 18.370 1.00 0.00 H TER 10257 WAT 144 ATOM 10257 O WAT 145 13.118 90.625 10.625 1.00 0.00 O ATOM 10258 H1 WAT 145 13.801 90.562 9.957 1.00 0.00 H ATOM 10259 H2 WAT 145 13.514 90.245 11.409 1.00 0.00 H TER 10261 WAT 145 ATOM 10261 O WAT 146 128.813 69.645 145.430 1.00 0.00 O ATOM 10262 H1 WAT 146 128.606 68.714 145.345 1.00 0.00 H ATOM 10263 H2 WAT 146 128.810 69.974 144.531 1.00 0.00 H TER 10265 WAT 146 ATOM 10265 O WAT 147 101.711 33.984 21.669 1.00 0.00 O ATOM 10266 H1 WAT 147 102.330 34.684 21.465 1.00 0.00 H ATOM 10267 H2 WAT 147 101.523 33.576 20.823 1.00 0.00 H TER 10269 WAT 147 ATOM 10269 O WAT 148 81.561 138.369 77.147 1.00 0.00 O ATOM 10270 H1 WAT 148 80.785 138.924 77.233 1.00 0.00 H ATOM 10271 H2 WAT 148 82.234 138.951 76.794 1.00 0.00 H TER 10273 WAT 148 ATOM 10273 O WAT 149 90.614 118.263 56.372 1.00 0.00 O ATOM 10274 H1 WAT 149 90.287 117.585 55.781 1.00 0.00 H ATOM 10275 H2 WAT 149 89.853 118.513 56.895 1.00 0.00 H TER 10277 WAT 149 ATOM 10277 O WAT 150 14.795 70.917 146.068 1.00 0.00 O ATOM 10278 H1 WAT 150 15.610 71.326 145.776 1.00 0.00 H ATOM 10279 H2 WAT 150 14.328 71.616 146.526 1.00 0.00 H TER 10281 WAT 150 ATOM 10281 O WAT 151 69.728 115.614 129.216 1.00 0.00 O ATOM 10282 H1 WAT 151 70.554 115.259 129.544 1.00 0.00 H ATOM 10283 H2 WAT 151 69.072 115.314 129.845 1.00 0.00 H TER 10285 WAT 151 ATOM 10285 O WAT 152 96.812 59.866 108.372 1.00 0.00 O ATOM 10286 H1 WAT 152 96.228 59.514 109.044 1.00 0.00 H ATOM 10287 H2 WAT 152 97.569 59.280 108.382 1.00 0.00 H TER 10289 WAT 152 ATOM 10289 O WAT 153 113.118 121.718 1.327 1.00 0.00 O ATOM 10290 H1 WAT 153 113.817 121.067 1.388 1.00 0.00 H ATOM 10291 H2 WAT 153 113.086 122.117 2.196 1.00 0.00 H TER 10293 WAT 153 ATOM 10293 O WAT 154 101.372 1.913 154.100 1.00 0.00 O ATOM 10294 H1 WAT 154 100.646 2.086 153.500 1.00 0.00 H ATOM 10295 H2 WAT 154 100.986 1.378 154.794 1.00 0.00 H TER 10297 WAT 154 ATOM 10297 O WAT 155 84.786 10.193 78.796 1.00 0.00 O ATOM 10298 H1 WAT 155 84.728 10.924 79.412 1.00 0.00 H ATOM 10299 H2 WAT 155 85.685 10.227 78.469 1.00 0.00 H TER 10301 WAT 155 ATOM 10301 O WAT 156 104.733 12.230 105.407 1.00 0.00 O ATOM 10302 H1 WAT 156 104.209 12.111 104.615 1.00 0.00 H ATOM 10303 H2 WAT 156 105.117 13.102 105.311 1.00 0.00 H TER 10305 WAT 156 ATOM 10305 O WAT 157 138.949 93.824 59.046 1.00 0.00 O ATOM 10306 H1 WAT 157 138.103 94.131 58.719 1.00 0.00 H ATOM 10307 H2 WAT 157 138.958 92.888 58.843 1.00 0.00 H TER 10309 WAT 157 ATOM 10309 O WAT 158 88.757 68.530 91.481 1.00 0.00 O ATOM 10310 H1 WAT 158 88.860 68.747 90.555 1.00 0.00 H ATOM 10311 H2 WAT 158 88.368 67.655 91.481 1.00 0.00 H TER 10313 WAT 158 ATOM 10313 O WAT 159 106.585 125.763 94.510 1.00 0.00 O ATOM 10314 H1 WAT 159 107.530 125.672 94.386 1.00 0.00 H ATOM 10315 H2 WAT 159 106.447 126.704 94.614 1.00 0.00 H TER 10317 WAT 159 ATOM 10317 O WAT 160 107.628 133.266 59.996 1.00 0.00 O ATOM 10318 H1 WAT 160 107.840 133.560 59.110 1.00 0.00 H ATOM 10319 H2 WAT 160 106.673 133.308 60.040 1.00 0.00 H TER 10321 WAT 160 ATOM 10321 O WAT 161 100.933 38.211 54.420 1.00 0.00 O ATOM 10322 H1 WAT 161 101.855 38.465 54.466 1.00 0.00 H ATOM 10323 H2 WAT 161 100.459 39.041 54.364 1.00 0.00 H TER 10325 WAT 161 ATOM 10325 O WAT 162 65.002 1.006 148.512 1.00 0.00 O ATOM 10326 H1 WAT 162 65.686 0.379 148.278 1.00 0.00 H ATOM 10327 H2 WAT 162 64.350 0.485 148.981 1.00 0.00 H TER 10329 WAT 162 ATOM 10329 O WAT 163 9.792 61.594 79.568 1.00 0.00 O ATOM 10330 H1 WAT 163 9.517 61.945 80.415 1.00 0.00 H ATOM 10331 H2 WAT 163 8.974 61.445 79.094 1.00 0.00 H TER 10333 WAT 163 ATOM 10333 O WAT 164 25.095 15.978 114.940 1.00 0.00 O ATOM 10334 H1 WAT 164 24.664 16.831 115.002 1.00 0.00 H ATOM 10335 H2 WAT 164 24.385 15.343 115.036 1.00 0.00 H TER 10337 WAT 164 ATOM 10337 O WAT 165 31.753 55.742 77.503 1.00 0.00 O ATOM 10338 H1 WAT 165 31.176 55.809 78.264 1.00 0.00 H ATOM 10339 H2 WAT 165 31.194 55.397 76.807 1.00 0.00 H TER 10341 WAT 165 ATOM 10341 O WAT 166 20.774 6.910 121.005 1.00 0.00 O ATOM 10342 H1 WAT 166 20.596 7.810 121.279 1.00 0.00 H ATOM 10343 H2 WAT 166 21.559 6.976 120.461 1.00 0.00 H TER 10345 WAT 166 ATOM 10345 O WAT 167 133.916 91.149 144.232 1.00 0.00 O ATOM 10346 H1 WAT 167 134.085 92.091 144.187 1.00 0.00 H ATOM 10347 H2 WAT 167 134.626 90.755 143.724 1.00 0.00 H TER 10349 WAT 167 ATOM 10349 O WAT 168 136.282 80.815 102.153 1.00 0.00 O ATOM 10350 H1 WAT 168 136.038 80.595 101.255 1.00 0.00 H ATOM 10351 H2 WAT 168 137.004 80.221 102.358 1.00 0.00 H TER 10353 WAT 168 ATOM 10353 O WAT 169 63.331 77.749 57.765 1.00 0.00 O ATOM 10354 H1 WAT 169 63.635 78.384 58.413 1.00 0.00 H ATOM 10355 H2 WAT 169 63.775 76.934 58.003 1.00 0.00 H TER 10357 WAT 169 ATOM 10357 O WAT 170 121.735 91.679 63.967 1.00 0.00 O ATOM 10358 H1 WAT 170 122.141 91.204 63.243 1.00 0.00 H ATOM 10359 H2 WAT 170 120.889 91.965 63.622 1.00 0.00 H TER 10361 WAT 170 ATOM 10361 O WAT 171 106.217 30.518 155.859 1.00 0.00 O ATOM 10362 H1 WAT 171 106.910 29.892 155.646 1.00 0.00 H ATOM 10363 H2 WAT 171 106.633 31.142 156.455 1.00 0.00 H TER 10365 WAT 171 ATOM 10365 O WAT 172 42.158 27.887 123.056 1.00 0.00 O ATOM 10366 H1 WAT 172 41.932 27.164 123.641 1.00 0.00 H ATOM 10367 H2 WAT 172 42.023 27.535 122.176 1.00 0.00 H TER 10369 WAT 172 ATOM 10369 O WAT 173 128.075 60.909 151.449 1.00 0.00 O ATOM 10370 H1 WAT 173 128.022 61.100 150.513 1.00 0.00 H ATOM 10371 H2 WAT 173 127.335 60.325 151.617 1.00 0.00 H TER 10373 WAT 173 ATOM 10373 O WAT 174 38.691 70.125 62.064 1.00 0.00 O ATOM 10374 H1 WAT 174 38.284 69.369 61.641 1.00 0.00 H ATOM 10375 H2 WAT 174 37.991 70.776 62.116 1.00 0.00 H TER 10377 WAT 174 ATOM 10377 O WAT 175 99.542 63.700 117.708 1.00 0.00 O ATOM 10378 H1 WAT 175 98.592 63.582 117.712 1.00 0.00 H ATOM 10379 H2 WAT 175 99.883 62.911 118.130 1.00 0.00 H TER 10381 WAT 175 ATOM 10381 O WAT 176 89.780 106.688 139.228 1.00 0.00 O ATOM 10382 H1 WAT 176 89.562 106.696 140.160 1.00 0.00 H ATOM 10383 H2 WAT 176 89.380 107.487 138.882 1.00 0.00 H TER 10385 WAT 176 ATOM 10385 O WAT 177 130.052 111.614 114.778 1.00 0.00 O ATOM 10386 H1 WAT 177 129.323 112.232 114.719 1.00 0.00 H ATOM 10387 H2 WAT 177 130.796 112.084 114.401 1.00 0.00 H TER 10389 WAT 177 ATOM 10389 O WAT 178 72.106 58.306 25.768 1.00 0.00 O ATOM 10390 H1 WAT 178 72.236 59.144 26.211 1.00 0.00 H ATOM 10391 H2 WAT 178 72.304 58.487 24.849 1.00 0.00 H TER 10393 WAT 178 ATOM 10393 O WAT 179 52.822 69.800 64.818 1.00 0.00 O ATOM 10394 H1 WAT 179 53.155 70.453 64.203 1.00 0.00 H ATOM 10395 H2 WAT 179 51.908 69.675 64.563 1.00 0.00 H TER 10397 WAT 179 ATOM 10397 O WAT 180 139.920 21.550 124.200 1.00 0.00 O ATOM 10398 H1 WAT 180 139.188 21.996 123.775 1.00 0.00 H ATOM 10399 H2 WAT 180 140.284 20.985 123.518 1.00 0.00 H TER 10401 WAT 180 ATOM 10401 O WAT 181 114.364 66.355 116.380 1.00 0.00 O ATOM 10402 H1 WAT 181 114.890 67.111 116.641 1.00 0.00 H ATOM 10403 H2 WAT 181 114.224 66.474 115.441 1.00 0.00 H TER 10405 WAT 181 ATOM 10405 O WAT 182 121.611 25.650 68.920 1.00 0.00 O ATOM 10406 H1 WAT 182 120.699 25.365 68.865 1.00 0.00 H ATOM 10407 H2 WAT 182 121.962 25.189 69.682 1.00 0.00 H TER 10409 WAT 182 ATOM 10409 O WAT 183 85.635 84.669 91.126 1.00 0.00 O ATOM 10410 H1 WAT 183 86.208 83.949 91.389 1.00 0.00 H ATOM 10411 H2 WAT 183 86.227 85.409 90.990 1.00 0.00 H TER 10413 WAT 183 ATOM 10413 O WAT 184 24.208 19.209 136.079 1.00 0.00 O ATOM 10414 H1 WAT 184 24.899 19.140 135.420 1.00 0.00 H ATOM 10415 H2 WAT 184 23.882 20.105 135.991 1.00 0.00 H TER 10417 WAT 184 ATOM 10417 O WAT 185 79.780 9.187 56.195 1.00 0.00 O ATOM 10418 H1 WAT 185 79.592 8.347 56.614 1.00 0.00 H ATOM 10419 H2 WAT 185 80.217 9.700 56.874 1.00 0.00 H TER 10421 WAT 185 ATOM 10421 O WAT 186 36.080 115.108 131.034 1.00 0.00 O ATOM 10422 H1 WAT 186 36.840 115.009 131.607 1.00 0.00 H ATOM 10423 H2 WAT 186 35.402 114.569 131.441 1.00 0.00 H TER 10425 WAT 186 ATOM 10425 O WAT 187 16.516 52.424 73.279 1.00 0.00 O ATOM 10426 H1 WAT 187 16.854 52.532 74.168 1.00 0.00 H ATOM 10427 H2 WAT 187 15.980 51.632 73.322 1.00 0.00 H TER 10429 WAT 187 ATOM 10429 O WAT 188 4.005 24.832 119.722 1.00 0.00 O ATOM 10430 H1 WAT 188 4.291 25.275 118.923 1.00 0.00 H ATOM 10431 H2 WAT 188 4.747 24.279 119.968 1.00 0.00 H TER 10433 WAT 188 ATOM 10433 O WAT 189 80.566 140.654 106.546 1.00 0.00 O ATOM 10434 H1 WAT 189 80.129 140.578 107.394 1.00 0.00 H ATOM 10435 H2 WAT 189 79.943 140.285 105.921 1.00 0.00 H TER 10437 WAT 189 ATOM 10437 O WAT 190 130.201 130.040 139.467 1.00 0.00 O ATOM 10438 H1 WAT 190 129.568 130.741 139.626 1.00 0.00 H ATOM 10439 H2 WAT 190 130.957 130.274 140.005 1.00 0.00 H TER 10441 WAT 190 ATOM 10441 O WAT 191 63.567 31.625 61.993 1.00 0.00 O ATOM 10442 H1 WAT 191 63.188 31.110 61.281 1.00 0.00 H ATOM 10443 H2 WAT 191 62.965 31.499 62.726 1.00 0.00 H TER 10445 WAT 191 ATOM 10445 O WAT 192 127.829 22.145 10.467 1.00 0.00 O ATOM 10446 H1 WAT 192 127.210 21.436 10.642 1.00 0.00 H ATOM 10447 H2 WAT 192 127.293 22.841 10.086 1.00 0.00 H TER 10449 WAT 192 ATOM 10449 O WAT 193 142.467 31.294 156.353 1.00 0.00 O ATOM 10450 H1 WAT 193 141.547 31.535 156.247 1.00 0.00 H ATOM 10451 H2 WAT 193 142.492 30.355 156.170 1.00 0.00 H TER 10453 WAT 193 ATOM 10453 O WAT 194 84.869 8.926 140.648 1.00 0.00 O ATOM 10454 H1 WAT 194 84.087 8.900 140.097 1.00 0.00 H ATOM 10455 H2 WAT 194 85.458 9.534 140.201 1.00 0.00 H TER 10457 WAT 194 ATOM 10457 O WAT 195 30.424 67.555 22.940 1.00 0.00 O ATOM 10458 H1 WAT 195 30.580 68.398 23.366 1.00 0.00 H ATOM 10459 H2 WAT 195 30.884 66.920 23.489 1.00 0.00 H TER 10461 WAT 195 ATOM 10461 O WAT 196 15.182 102.473 81.879 1.00 0.00 O ATOM 10462 H1 WAT 196 15.891 102.727 82.470 1.00 0.00 H ATOM 10463 H2 WAT 196 14.502 103.132 82.024 1.00 0.00 H TER 10465 WAT 196 ATOM 10465 O WAT 197 88.558 35.295 85.153 1.00 0.00 O ATOM 10466 H1 WAT 197 88.773 35.924 84.464 1.00 0.00 H ATOM 10467 H2 WAT 197 88.346 34.488 84.683 1.00 0.00 H TER 10469 WAT 197 ATOM 10469 O WAT 198 53.506 81.013 96.076 1.00 0.00 O ATOM 10470 H1 WAT 198 53.096 81.514 95.371 1.00 0.00 H ATOM 10471 H2 WAT 198 52.955 81.182 96.841 1.00 0.00 H TER 10473 WAT 198 ATOM 10473 O WAT 199 129.262 143.458 116.532 1.00 0.00 O ATOM 10474 H1 WAT 199 129.910 143.710 117.190 1.00 0.00 H ATOM 10475 H2 WAT 199 128.442 143.383 117.020 1.00 0.00 H TER 10477 WAT 199 ATOM 10477 O WAT 200 102.874 126.790 138.041 1.00 0.00 O ATOM 10478 H1 WAT 200 103.763 127.143 138.072 1.00 0.00 H ATOM 10479 H2 WAT 200 102.450 127.270 137.330 1.00 0.00 H TER 10481 WAT 200 ATOM 10481 O WAT 201 55.781 119.755 7.641 1.00 0.00 O ATOM 10482 H1 WAT 201 54.877 119.442 7.669 1.00 0.00 H ATOM 10483 H2 WAT 201 55.717 120.636 7.270 1.00 0.00 H TER 10485 WAT 201 ATOM 10485 O WAT 202 12.843 139.854 67.986 1.00 0.00 O ATOM 10486 H1 WAT 202 13.720 139.547 67.757 1.00 0.00 H ATOM 10487 H2 WAT 202 12.979 140.745 68.311 1.00 0.00 H TER 10489 WAT 202 ATOM 10489 O WAT 203 126.563 74.486 66.898 1.00 0.00 O ATOM 10490 H1 WAT 203 127.262 74.306 66.269 1.00 0.00 H ATOM 10491 H2 WAT 203 127.022 74.708 67.708 1.00 0.00 H TER 10493 WAT 203 ATOM 10493 O WAT 204 55.913 107.153 122.716 1.00 0.00 O ATOM 10494 H1 WAT 204 55.847 108.108 122.687 1.00 0.00 H ATOM 10495 H2 WAT 204 55.765 106.876 121.812 1.00 0.00 H TER 10497 WAT 204 ATOM 10497 O WAT 205 26.757 62.708 64.173 1.00 0.00 O ATOM 10498 H1 WAT 205 27.557 62.722 64.698 1.00 0.00 H ATOM 10499 H2 WAT 205 26.931 63.317 63.455 1.00 0.00 H TER 10501 WAT 205 ATOM 10501 O WAT 206 89.542 72.757 129.088 1.00 0.00 O ATOM 10502 H1 WAT 206 89.938 72.277 128.360 1.00 0.00 H ATOM 10503 H2 WAT 206 89.598 72.155 129.830 1.00 0.00 H TER 10505 WAT 206 ATOM 10505 O WAT 207 133.446 98.007 71.708 1.00 0.00 O ATOM 10506 H1 WAT 207 133.945 98.066 72.523 1.00 0.00 H ATOM 10507 H2 WAT 207 132.543 98.192 71.967 1.00 0.00 H TER 10509 WAT 207 ATOM 10509 O WAT 208 97.750 72.587 142.907 1.00 0.00 O ATOM 10510 H1 WAT 208 97.504 72.027 143.643 1.00 0.00 H ATOM 10511 H2 WAT 208 98.118 71.984 142.260 1.00 0.00 H TER 10513 WAT 208 ATOM 10513 O WAT 209 99.184 113.104 3.813 1.00 0.00 O ATOM 10514 H1 WAT 209 98.585 112.583 3.278 1.00 0.00 H ATOM 10515 H2 WAT 209 98.677 113.325 4.594 1.00 0.00 H TER 10517 WAT 209 ATOM 10517 O WAT 210 36.833 25.849 138.035 1.00 0.00 O ATOM 10518 H1 WAT 210 36.443 25.346 138.750 1.00 0.00 H ATOM 10519 H2 WAT 210 36.510 25.424 137.240 1.00 0.00 H TER 10521 WAT 210 ATOM 10521 O WAT 211 25.224 9.602 118.598 1.00 0.00 O ATOM 10522 H1 WAT 211 25.215 10.516 118.311 1.00 0.00 H ATOM 10523 H2 WAT 211 25.726 9.611 119.412 1.00 0.00 H TER 10525 WAT 211 ATOM 10525 O WAT 212 74.411 55.397 128.227 1.00 0.00 O ATOM 10526 H1 WAT 212 74.353 55.981 127.470 1.00 0.00 H ATOM 10527 H2 WAT 212 74.226 55.960 128.978 1.00 0.00 H TER 10529 WAT 212 ATOM 10529 O WAT 213 21.392 44.499 64.402 1.00 0.00 O ATOM 10530 H1 WAT 213 22.184 44.875 64.019 1.00 0.00 H ATOM 10531 H2 WAT 213 20.741 44.545 63.702 1.00 0.00 H TER 10533 WAT 213 ATOM 10533 O WAT 214 14.124 43.312 59.546 1.00 0.00 O ATOM 10534 H1 WAT 214 13.536 42.609 59.822 1.00 0.00 H ATOM 10535 H2 WAT 214 14.391 43.068 58.660 1.00 0.00 H TER 10537 WAT 214 ATOM 10537 O WAT 215 116.623 111.421 79.129 1.00 0.00 O ATOM 10538 H1 WAT 215 116.680 111.779 80.014 1.00 0.00 H ATOM 10539 H2 WAT 215 116.899 110.509 79.220 1.00 0.00 H TER 10541 WAT 215 ATOM 10541 O WAT 216 47.048 17.542 6.658 1.00 0.00 O ATOM 10542 H1 WAT 216 47.249 18.475 6.720 1.00 0.00 H ATOM 10543 H2 WAT 216 46.093 17.498 6.716 1.00 0.00 H TER 10545 WAT 216 ATOM 10545 O WAT 217 45.035 104.433 56.972 1.00 0.00 O ATOM 10546 H1 WAT 217 45.832 104.851 57.299 1.00 0.00 H ATOM 10547 H2 WAT 217 45.160 103.502 57.155 1.00 0.00 H TER 10549 WAT 217 ATOM 10549 O WAT 218 35.847 125.587 128.729 1.00 0.00 O ATOM 10550 H1 WAT 218 35.697 126.526 128.618 1.00 0.00 H ATOM 10551 H2 WAT 218 36.791 125.479 128.608 1.00 0.00 H TER 10553 WAT 218 ATOM 10553 O WAT 219 6.913 121.476 138.708 1.00 0.00 O ATOM 10554 H1 WAT 219 7.037 122.399 138.485 1.00 0.00 H ATOM 10555 H2 WAT 219 6.010 121.424 139.020 1.00 0.00 H TER 10557 WAT 219 ATOM 10557 O WAT 220 141.511 104.909 117.365 1.00 0.00 O ATOM 10558 H1 WAT 220 141.692 104.599 116.479 1.00 0.00 H ATOM 10559 H2 WAT 220 141.942 105.763 117.413 1.00 0.00 H TER 10561 WAT 220 ATOM 10561 O WAT 221 4.610 103.602 5.796 1.00 0.00 O ATOM 10562 H1 WAT 221 4.692 104.535 5.597 1.00 0.00 H ATOM 10563 H2 WAT 221 5.349 103.413 6.374 1.00 0.00 H TER 10565 WAT 221 ATOM 10565 O WAT 222 89.969 76.907 118.007 1.00 0.00 O ATOM 10566 H1 WAT 222 90.465 76.196 117.601 1.00 0.00 H ATOM 10567 H2 WAT 222 89.510 76.492 118.737 1.00 0.00 H TER 10569 WAT 222 ATOM 10569 O WAT 223 111.725 6.559 85.032 1.00 0.00 O ATOM 10570 H1 WAT 223 111.925 6.501 85.966 1.00 0.00 H ATOM 10571 H2 WAT 223 111.098 5.851 84.877 1.00 0.00 H TER 10573 WAT 223 ATOM 10573 O WAT 224 31.352 113.792 67.746 1.00 0.00 O ATOM 10574 H1 WAT 224 31.575 114.385 67.029 1.00 0.00 H ATOM 10575 H2 WAT 224 32.188 113.404 68.004 1.00 0.00 H TER 10577 WAT 224 ATOM 10577 O WAT 225 123.773 110.515 140.828 1.00 0.00 O ATOM 10578 H1 WAT 225 123.816 110.253 139.908 1.00 0.00 H ATOM 10579 H2 WAT 225 122.938 110.976 140.908 1.00 0.00 H TER 10581 WAT 225 ATOM 10581 O WAT 226 52.531 60.025 91.125 1.00 0.00 O ATOM 10582 H1 WAT 226 52.349 60.555 91.901 1.00 0.00 H ATOM 10583 H2 WAT 226 53.448 60.209 90.919 1.00 0.00 H TER 10585 WAT 226 ATOM 10585 O WAT 227 37.855 139.832 134.236 1.00 0.00 O ATOM 10586 H1 WAT 227 36.951 140.099 134.400 1.00 0.00 H ATOM 10587 H2 WAT 227 38.364 140.281 134.911 1.00 0.00 H TER 10589 WAT 227 ATOM 10589 O WAT 228 13.695 117.930 121.870 1.00 0.00 O ATOM 10590 H1 WAT 228 13.057 118.641 121.818 1.00 0.00 H ATOM 10591 H2 WAT 228 13.805 117.775 122.809 1.00 0.00 H TER 10593 WAT 228 ATOM 10593 O WAT 229 74.126 130.046 109.004 1.00 0.00 O ATOM 10594 H1 WAT 229 73.457 130.102 108.321 1.00 0.00 H ATOM 10595 H2 WAT 229 74.941 130.276 108.558 1.00 0.00 H TER 10597 WAT 229 ATOM 10597 O WAT 230 116.097 138.778 118.436 1.00 0.00 O ATOM 10598 H1 WAT 230 116.335 138.374 119.270 1.00 0.00 H ATOM 10599 H2 WAT 230 116.409 139.680 118.508 1.00 0.00 H TER 10601 WAT 230 ATOM 10601 O WAT 231 61.305 2.327 14.039 1.00 0.00 O ATOM 10602 H1 WAT 231 60.901 1.574 14.470 1.00 0.00 H ATOM 10603 H2 WAT 231 60.570 2.898 13.815 1.00 0.00 H TER 10605 WAT 231 ATOM 10605 O WAT 232 22.865 47.073 6.544 1.00 0.00 O ATOM 10606 H1 WAT 232 22.749 47.049 7.493 1.00 0.00 H ATOM 10607 H2 WAT 232 22.458 47.896 6.273 1.00 0.00 H TER 10609 WAT 232 ATOM 10609 O WAT 233 44.320 94.448 93.623 1.00 0.00 O ATOM 10610 H1 WAT 233 43.733 94.679 92.903 1.00 0.00 H ATOM 10611 H2 WAT 233 44.404 93.496 93.568 1.00 0.00 H TER 10613 WAT 233 ATOM 10613 O WAT 234 8.304 67.735 116.304 1.00 0.00 O ATOM 10614 H1 WAT 234 7.558 67.141 116.382 1.00 0.00 H ATOM 10615 H2 WAT 234 8.217 68.330 117.048 1.00 0.00 H TER 10617 WAT 234 ATOM 10617 O WAT 235 24.897 92.486 146.560 1.00 0.00 O ATOM 10618 H1 WAT 235 24.305 93.075 147.029 1.00 0.00 H ATOM 10619 H2 WAT 235 24.318 91.850 146.141 1.00 0.00 H TER 10621 WAT 235 ATOM 10621 O WAT 236 57.648 99.027 90.149 1.00 0.00 O ATOM 10622 H1 WAT 236 56.704 99.076 90.303 1.00 0.00 H ATOM 10623 H2 WAT 236 57.750 98.328 89.504 1.00 0.00 H TER 10625 WAT 236 ATOM 10625 O WAT 237 38.619 95.301 6.835 1.00 0.00 O ATOM 10626 H1 WAT 237 38.521 94.899 5.972 1.00 0.00 H ATOM 10627 H2 WAT 237 39.094 96.115 6.667 1.00 0.00 H TER 10629 WAT 237 ATOM 10629 O WAT 238 46.944 60.580 142.924 1.00 0.00 O ATOM 10630 H1 WAT 238 47.767 60.733 142.460 1.00 0.00 H ATOM 10631 H2 WAT 238 46.461 59.973 142.362 1.00 0.00 H TER 10633 WAT 238 ATOM 10633 O WAT 239 61.231 120.974 133.782 1.00 0.00 O ATOM 10634 H1 WAT 239 60.425 121.405 133.501 1.00 0.00 H ATOM 10635 H2 WAT 239 61.023 120.040 133.762 1.00 0.00 H TER 10637 WAT 239 ATOM 10637 O WAT 240 2.327 91.710 73.844 1.00 0.00 O ATOM 10638 H1 WAT 240 2.346 90.822 74.202 1.00 0.00 H ATOM 10639 H2 WAT 240 2.120 91.589 72.917 1.00 0.00 H TER 10641 WAT 240 ATOM 10641 O WAT 241 120.154 64.193 147.128 1.00 0.00 O ATOM 10642 H1 WAT 241 119.446 64.338 147.757 1.00 0.00 H ATOM 10643 H2 WAT 241 120.916 63.988 147.669 1.00 0.00 H TER 10645 WAT 241 ATOM 10645 O WAT 242 30.689 125.088 16.713 1.00 0.00 O ATOM 10646 H1 WAT 242 31.413 124.886 16.120 1.00 0.00 H ATOM 10647 H2 WAT 242 30.515 124.265 17.169 1.00 0.00 H TER 10649 WAT 242 ATOM 10649 O WAT 243 134.401 15.387 111.896 1.00 0.00 O ATOM 10650 H1 WAT 243 133.788 15.855 111.329 1.00 0.00 H ATOM 10651 H2 WAT 243 134.086 15.561 112.783 1.00 0.00 H TER 10653 WAT 243 ATOM 10653 O WAT 244 54.966 44.855 94.996 1.00 0.00 O ATOM 10654 H1 WAT 244 55.035 45.810 94.985 1.00 0.00 H ATOM 10655 H2 WAT 244 55.162 44.612 95.901 1.00 0.00 H TER 10657 WAT 244 ATOM 10657 O WAT 245 141.372 93.568 102.609 1.00 0.00 O ATOM 10658 H1 WAT 245 141.065 92.815 103.115 1.00 0.00 H ATOM 10659 H2 WAT 245 140.643 94.188 102.636 1.00 0.00 H TER 10661 WAT 245 ATOM 10661 O WAT 246 47.933 79.687 23.704 1.00 0.00 O ATOM 10662 H1 WAT 246 48.618 79.372 23.113 1.00 0.00 H ATOM 10663 H2 WAT 246 47.996 80.641 23.657 1.00 0.00 H TER 10665 WAT 246 ATOM 10665 O WAT 247 68.252 94.217 70.256 1.00 0.00 O ATOM 10666 H1 WAT 247 68.418 94.475 71.162 1.00 0.00 H ATOM 10667 H2 WAT 247 68.019 95.033 69.814 1.00 0.00 H TER 10669 WAT 247 ATOM 10669 O WAT 248 2.310 128.710 69.996 1.00 0.00 O ATOM 10670 H1 WAT 248 1.519 128.477 70.482 1.00 0.00 H ATOM 10671 H2 WAT 248 3.016 128.636 70.637 1.00 0.00 H TER 10673 WAT 248 ATOM 10673 O WAT 249 113.597 144.070 68.616 1.00 0.00 O ATOM 10674 H1 WAT 249 112.790 144.133 69.127 1.00 0.00 H ATOM 10675 H2 WAT 249 114.007 143.259 68.914 1.00 0.00 H TER 10677 WAT 249 ATOM 10677 O WAT 250 118.110 70.657 155.927 1.00 0.00 O ATOM 10678 H1 WAT 250 118.229 70.259 155.065 1.00 0.00 H ATOM 10679 H2 WAT 250 117.881 71.568 155.741 1.00 0.00 H TER 10681 WAT 250 ATOM 10681 O WAT 251 102.245 111.754 143.260 1.00 0.00 O ATOM 10682 H1 WAT 251 102.769 111.399 143.978 1.00 0.00 H ATOM 10683 H2 WAT 251 102.223 112.697 143.423 1.00 0.00 H TER 10685 WAT 251 ATOM 10685 O WAT 252 1.872 57.500 98.855 1.00 0.00 O ATOM 10686 H1 WAT 252 0.951 57.442 98.601 1.00 0.00 H ATOM 10687 H2 WAT 252 1.852 57.829 99.754 1.00 0.00 H TER 10689 WAT 252 ATOM 10689 O WAT 253 108.048 115.102 95.606 1.00 0.00 O ATOM 10690 H1 WAT 253 107.378 115.576 95.113 1.00 0.00 H ATOM 10691 H2 WAT 253 108.877 115.418 95.248 1.00 0.00 H TER 10693 WAT 253 ATOM 10693 O WAT 254 135.889 66.282 111.036 1.00 0.00 O ATOM 10694 H1 WAT 254 135.165 66.755 110.626 1.00 0.00 H ATOM 10695 H2 WAT 254 136.489 66.968 111.328 1.00 0.00 H TER 10697 WAT 254 ATOM 10697 O WAT 255 43.250 55.137 69.318 1.00 0.00 O ATOM 10698 H1 WAT 255 42.686 54.364 69.301 1.00 0.00 H ATOM 10699 H2 WAT 255 44.095 54.824 68.997 1.00 0.00 H TER 10701 WAT 255 ATOM 10701 O WAT 256 117.551 95.062 145.589 1.00 0.00 O ATOM 10702 H1 WAT 256 117.014 94.501 145.029 1.00 0.00 H ATOM 10703 H2 WAT 256 117.317 94.805 146.480 1.00 0.00 H TER 10705 WAT 256 ATOM 10705 O WAT 257 17.221 82.064 96.675 1.00 0.00 O ATOM 10706 H1 WAT 257 17.355 83.011 96.690 1.00 0.00 H ATOM 10707 H2 WAT 257 17.688 81.743 97.446 1.00 0.00 H TER 10709 WAT 257 ATOM 10709 O WAT 258 63.963 90.169 13.528 1.00 0.00 O ATOM 10710 H1 WAT 258 64.527 90.902 13.281 1.00 0.00 H ATOM 10711 H2 WAT 258 63.177 90.582 13.885 1.00 0.00 H TER 10713 WAT 258 ATOM 10713 O WAT 259 142.219 21.406 111.659 1.00 0.00 O ATOM 10714 H1 WAT 259 142.071 21.123 112.561 1.00 0.00 H ATOM 10715 H2 WAT 259 142.478 20.609 111.197 1.00 0.00 H TER 10717 WAT 259 ATOM 10717 O WAT 260 43.898 67.027 67.421 1.00 0.00 O ATOM 10718 H1 WAT 260 43.782 66.314 66.792 1.00 0.00 H ATOM 10719 H2 WAT 260 44.412 67.682 66.949 1.00 0.00 H TER 10721 WAT 260 ATOM 10721 O WAT 261 41.190 3.748 130.072 1.00 0.00 O ATOM 10722 H1 WAT 261 40.729 3.747 130.911 1.00 0.00 H ATOM 10723 H2 WAT 261 41.392 2.827 129.908 1.00 0.00 H TER 10725 WAT 261 ATOM 10725 O WAT 262 57.811 133.740 134.710 1.00 0.00 O ATOM 10726 H1 WAT 262 58.264 133.135 134.123 1.00 0.00 H ATOM 10727 H2 WAT 262 58.308 133.698 135.527 1.00 0.00 H TER 10729 WAT 262 ATOM 10729 O WAT 263 65.089 29.890 86.583 1.00 0.00 O ATOM 10730 H1 WAT 263 64.452 29.995 87.290 1.00 0.00 H ATOM 10731 H2 WAT 263 65.932 30.091 86.989 1.00 0.00 H TER 10733 WAT 263 ATOM 10733 O WAT 264 84.711 47.462 138.699 1.00 0.00 O ATOM 10734 H1 WAT 264 85.485 48.012 138.827 1.00 0.00 H ATOM 10735 H2 WAT 264 83.983 47.997 139.013 1.00 0.00 H TER 10737 WAT 264 ATOM 10737 O WAT 265 55.320 1.005 98.555 1.00 0.00 O ATOM 10738 H1 WAT 265 56.027 1.351 99.099 1.00 0.00 H ATOM 10739 H2 WAT 265 55.766 0.486 97.885 1.00 0.00 H TER 10741 WAT 265 ATOM 10741 O WAT 266 94.716 135.191 82.079 1.00 0.00 O ATOM 10742 H1 WAT 266 94.798 135.222 81.126 1.00 0.00 H ATOM 10743 H2 WAT 266 93.774 135.249 82.241 1.00 0.00 H TER 10745 WAT 266 ATOM 10745 O WAT 267 106.232 95.343 105.554 1.00 0.00 O ATOM 10746 H1 WAT 267 107.006 95.693 105.995 1.00 0.00 H ATOM 10747 H2 WAT 267 106.341 94.393 105.599 1.00 0.00 H TER 10749 WAT 267 ATOM 10749 O WAT 268 120.495 112.573 93.921 1.00 0.00 O ATOM 10750 H1 WAT 268 120.108 113.296 94.414 1.00 0.00 H ATOM 10751 H2 WAT 268 121.227 112.278 94.463 1.00 0.00 H TER 10753 WAT 268 ATOM 10753 O WAT 269 23.970 131.150 157.954 1.00 0.00 O ATOM 10754 H1 WAT 269 24.656 131.640 158.406 1.00 0.00 H ATOM 10755 H2 WAT 269 23.958 131.516 157.069 1.00 0.00 H TER 10757 WAT 269 ATOM 10757 O WAT 270 79.174 111.331 127.283 1.00 0.00 O ATOM 10758 H1 WAT 270 78.900 111.690 126.440 1.00 0.00 H ATOM 10759 H2 WAT 270 79.028 112.043 127.906 1.00 0.00 H TER 10761 WAT 270 ATOM 10761 O WAT 271 98.782 134.847 130.217 1.00 0.00 O ATOM 10762 H1 WAT 271 99.506 134.570 130.779 1.00 0.00 H ATOM 10763 H2 WAT 271 99.158 134.873 129.337 1.00 0.00 H TER 10765 WAT 271 ATOM 10765 O WAT 272 10.010 136.127 58.372 1.00 0.00 O ATOM 10766 H1 WAT 272 10.702 136.133 57.711 1.00 0.00 H ATOM 10767 H2 WAT 272 9.472 136.891 58.163 1.00 0.00 H TER 10769 WAT 272 ATOM 10769 O WAT 273 112.727 113.232 113.344 1.00 0.00 O ATOM 10770 H1 WAT 273 112.748 113.979 112.745 1.00 0.00 H ATOM 10771 H2 WAT 273 112.152 113.512 114.056 1.00 0.00 H TER 10773 WAT 273 ATOM 10773 O WAT 274 90.518 100.197 83.727 1.00 0.00 O ATOM 10774 H1 WAT 274 90.999 99.524 84.208 1.00 0.00 H ATOM 10775 H2 WAT 274 91.078 100.400 82.977 1.00 0.00 H TER 10777 WAT 274 ATOM 10777 O WAT 275 14.740 91.422 1.208 1.00 0.00 O ATOM 10778 H1 WAT 275 14.547 92.355 1.304 1.00 0.00 H ATOM 10779 H2 WAT 275 15.284 91.371 0.421 1.00 0.00 H TER 10781 WAT 275 ATOM 10781 O WAT 276 12.789 108.329 153.697 1.00 0.00 O ATOM 10782 H1 WAT 276 12.620 108.298 152.755 1.00 0.00 H ATOM 10783 H2 WAT 276 13.737 108.437 153.767 1.00 0.00 H TER 10785 WAT 276 ATOM 10785 O WAT 277 2.626 36.480 116.205 1.00 0.00 O ATOM 10786 H1 WAT 277 3.579 36.563 116.233 1.00 0.00 H ATOM 10787 H2 WAT 277 2.364 36.424 117.124 1.00 0.00 H TER 10789 WAT 277 ATOM 10789 O WAT 278 79.455 50.602 131.052 1.00 0.00 O ATOM 10790 H1 WAT 278 79.297 50.835 131.967 1.00 0.00 H ATOM 10791 H2 WAT 278 80.235 50.047 131.077 1.00 0.00 H TER 10793 WAT 278 ATOM 10793 O WAT 279 7.562 75.348 141.532 1.00 0.00 O ATOM 10794 H1 WAT 279 7.893 74.477 141.752 1.00 0.00 H ATOM 10795 H2 WAT 279 6.644 75.203 141.299 1.00 0.00 H TER 10797 WAT 279 ATOM 10797 O WAT 280 131.096 26.084 95.978 1.00 0.00 O ATOM 10798 H1 WAT 280 130.628 26.084 95.144 1.00 0.00 H ATOM 10799 H2 WAT 280 131.457 26.968 96.050 1.00 0.00 H TER 10801 WAT 280 ATOM 10801 O WAT 281 105.569 64.642 132.754 1.00 0.00 O ATOM 10802 H1 WAT 281 104.622 64.622 132.887 1.00 0.00 H ATOM 10803 H2 WAT 281 105.888 63.842 133.171 1.00 0.00 H TER 10805 WAT 281 ATOM 10805 O WAT 282 60.723 104.794 87.684 1.00 0.00 O ATOM 10806 H1 WAT 282 60.175 104.036 87.480 1.00 0.00 H ATOM 10807 H2 WAT 282 60.842 105.236 86.843 1.00 0.00 H TER 10809 WAT 282 ATOM 10809 O WAT 283 36.603 118.675 133.940 1.00 0.00 O ATOM 10810 H1 WAT 283 36.490 118.148 133.150 1.00 0.00 H ATOM 10811 H2 WAT 283 35.999 119.409 133.827 1.00 0.00 H TER 10813 WAT 283 ATOM 10813 O WAT 284 125.895 106.070 14.029 1.00 0.00 O ATOM 10814 H1 WAT 284 125.312 106.603 14.570 1.00 0.00 H ATOM 10815 H2 WAT 284 126.238 105.407 14.628 1.00 0.00 H TER 10817 WAT 284 ATOM 10817 O WAT 285 36.333 101.703 140.767 1.00 0.00 O ATOM 10818 H1 WAT 285 36.116 102.256 141.518 1.00 0.00 H ATOM 10819 H2 WAT 285 36.091 100.819 141.044 1.00 0.00 H TER 10821 WAT 285 ATOM 10821 O WAT 286 44.146 133.939 143.628 1.00 0.00 O ATOM 10822 H1 WAT 286 44.064 132.986 143.641 1.00 0.00 H ATOM 10823 H2 WAT 286 44.326 134.176 144.538 1.00 0.00 H TER 10825 WAT 286 ATOM 10825 O WAT 287 81.547 90.794 63.722 1.00 0.00 O ATOM 10826 H1 WAT 287 81.074 91.397 63.148 1.00 0.00 H ATOM 10827 H2 WAT 287 82.409 90.704 63.317 1.00 0.00 H TER 10829 WAT 287 ATOM 10829 O WAT 288 30.299 70.438 138.719 1.00 0.00 O ATOM 10830 H1 WAT 288 29.470 70.897 138.854 1.00 0.00 H ATOM 10831 H2 WAT 288 30.356 69.827 139.454 1.00 0.00 H TER 10833 WAT 288 ATOM 10833 O WAT 289 73.322 2.887 76.016 1.00 0.00 O ATOM 10834 H1 WAT 289 73.768 3.718 76.178 1.00 0.00 H ATOM 10835 H2 WAT 289 73.215 2.499 76.885 1.00 0.00 H TER 10837 WAT 289 ATOM 10837 O WAT 290 66.060 84.453 5.937 1.00 0.00 O ATOM 10838 H1 WAT 290 66.705 83.836 6.283 1.00 0.00 H ATOM 10839 H2 WAT 290 65.996 84.236 5.007 1.00 0.00 H TER 10841 WAT 290 ATOM 10841 O WAT 291 77.647 48.276 133.344 1.00 0.00 O ATOM 10842 H1 WAT 291 76.861 48.270 133.890 1.00 0.00 H ATOM 10843 H2 WAT 291 78.023 49.147 133.473 1.00 0.00 H TER 10845 WAT 291 ATOM 10845 O WAT 292 14.139 130.878 136.543 1.00 0.00 O ATOM 10846 H1 WAT 292 14.430 131.579 137.126 1.00 0.00 H ATOM 10847 H2 WAT 292 13.451 131.279 136.011 1.00 0.00 H TER 10849 WAT 292 ATOM 10849 O WAT 293 119.185 11.349 117.630 1.00 0.00 O ATOM 10850 H1 WAT 293 118.824 11.017 116.808 1.00 0.00 H ATOM 10851 H2 WAT 293 118.778 10.808 118.306 1.00 0.00 H TER 10853 WAT 293 ATOM 10853 O WAT 294 67.422 77.496 23.796 1.00 0.00 O ATOM 10854 H1 WAT 294 66.950 76.775 23.379 1.00 0.00 H ATOM 10855 H2 WAT 294 68.335 77.364 23.539 1.00 0.00 H TER 10857 WAT 294 ATOM 10857 O WAT 295 54.889 103.593 128.410 1.00 0.00 O ATOM 10858 H1 WAT 295 54.188 103.139 128.877 1.00 0.00 H ATOM 10859 H2 WAT 295 55.214 104.240 129.035 1.00 0.00 H TER 10861 WAT 295 ATOM 10861 O WAT 296 12.325 13.754 150.724 1.00 0.00 O ATOM 10862 H1 WAT 296 11.929 12.940 151.037 1.00 0.00 H ATOM 10863 H2 WAT 296 13.258 13.656 150.915 1.00 0.00 H TER 10865 WAT 296 ATOM 10865 O WAT 297 122.091 43.392 70.573 1.00 0.00 O ATOM 10866 H1 WAT 297 121.759 44.284 70.672 1.00 0.00 H ATOM 10867 H2 WAT 297 121.317 42.872 70.355 1.00 0.00 H TER 10869 WAT 297 ATOM 10869 O WAT 298 36.817 41.984 156.004 1.00 0.00 O ATOM 10870 H1 WAT 298 36.641 41.067 155.791 1.00 0.00 H ATOM 10871 H2 WAT 298 37.760 42.017 156.163 1.00 0.00 H TER 10873 WAT 298 ATOM 10873 O WAT 299 8.574 109.603 80.014 1.00 0.00 O ATOM 10874 H1 WAT 299 7.932 109.568 79.305 1.00 0.00 H ATOM 10875 H2 WAT 299 8.088 109.328 80.792 1.00 0.00 H TER 10877 WAT 299 ATOM 10877 O WAT 300 98.320 21.507 148.718 1.00 0.00 O ATOM 10878 H1 WAT 300 97.672 20.863 148.434 1.00 0.00 H ATOM 10879 H2 WAT 300 98.039 22.326 148.309 1.00 0.00 H TER 10881 WAT 300 ATOM 10881 O WAT 301 83.315 46.923 125.901 1.00 0.00 O ATOM 10882 H1 WAT 301 84.233 46.681 125.786 1.00 0.00 H ATOM 10883 H2 WAT 301 82.841 46.369 125.281 1.00 0.00 H TER 10885 WAT 301 ATOM 10885 O WAT 302 94.983 106.801 111.862 1.00 0.00 O ATOM 10886 H1 WAT 302 94.278 107.444 111.934 1.00 0.00 H ATOM 10887 H2 WAT 302 94.533 105.967 111.724 1.00 0.00 H TER 10889 WAT 302 ATOM 10889 O WAT 303 16.007 137.915 3.844 1.00 0.00 O ATOM 10890 H1 WAT 303 16.468 137.106 3.620 1.00 0.00 H ATOM 10891 H2 WAT 303 15.204 137.885 3.324 1.00 0.00 H TER 10893 WAT 303 ATOM 10893 O WAT 304 95.897 98.716 150.265 1.00 0.00 O ATOM 10894 H1 WAT 304 95.620 99.621 150.123 1.00 0.00 H ATOM 10895 H2 WAT 304 96.825 98.782 150.490 1.00 0.00 H TER 10897 WAT 304 ATOM 10897 O WAT 305 75.089 138.755 59.945 1.00 0.00 O ATOM 10898 H1 WAT 305 75.055 139.517 59.367 1.00 0.00 H ATOM 10899 H2 WAT 305 75.430 138.051 59.394 1.00 0.00 H TER 10901 WAT 305 ATOM 10901 O WAT 306 69.082 94.496 21.093 1.00 0.00 O ATOM 10902 H1 WAT 306 68.550 93.756 21.385 1.00 0.00 H ATOM 10903 H2 WAT 306 68.446 95.186 20.903 1.00 0.00 H TER 10905 WAT 306 ATOM 10905 O WAT 307 142.419 110.178 141.116 1.00 0.00 O ATOM 10906 H1 WAT 307 143.328 110.443 141.253 1.00 0.00 H ATOM 10907 H2 WAT 307 142.136 109.842 141.966 1.00 0.00 H TER 10909 WAT 307 ATOM 10909 O WAT 308 110.001 10.293 68.547 1.00 0.00 O ATOM 10910 H1 WAT 308 109.332 9.884 69.097 1.00 0.00 H ATOM 10911 H2 WAT 308 110.586 9.574 68.308 1.00 0.00 H TER 10913 WAT 308 ATOM 10913 O WAT 309 89.454 73.867 93.628 1.00 0.00 O ATOM 10914 H1 WAT 309 89.170 74.630 94.132 1.00 0.00 H ATOM 10915 H2 WAT 309 88.685 73.619 93.116 1.00 0.00 H TER 10917 WAT 309 ATOM 10917 O WAT 310 65.685 46.424 98.141 1.00 0.00 O ATOM 10918 H1 WAT 310 65.675 45.663 98.722 1.00 0.00 H ATOM 10919 H2 WAT 310 65.714 47.176 98.732 1.00 0.00 H TER 10921 WAT 310 ATOM 10921 O WAT 311 29.785 108.880 144.992 1.00 0.00 O ATOM 10922 H1 WAT 311 30.115 109.254 145.808 1.00 0.00 H ATOM 10923 H2 WAT 311 29.227 109.564 144.623 1.00 0.00 H TER 10925 WAT 311 ATOM 10925 O WAT 312 135.509 66.300 85.198 1.00 0.00 O ATOM 10926 H1 WAT 312 135.372 66.804 84.396 1.00 0.00 H ATOM 10927 H2 WAT 312 136.140 66.816 85.700 1.00 0.00 H TER 10929 WAT 312 ATOM 10929 O WAT 313 73.725 42.242 76.331 1.00 0.00 O ATOM 10930 H1 WAT 313 73.561 41.940 75.438 1.00 0.00 H ATOM 10931 H2 WAT 313 74.489 42.814 76.254 1.00 0.00 H TER 10933 WAT 313 ATOM 10933 O WAT 314 81.392 49.389 133.977 1.00 0.00 O ATOM 10934 H1 WAT 314 81.897 48.820 133.397 1.00 0.00 H ATOM 10935 H2 WAT 314 81.945 49.494 134.751 1.00 0.00 H TER 10937 WAT 314 ATOM 10937 O WAT 315 98.146 116.154 147.579 1.00 0.00 O ATOM 10938 H1 WAT 315 97.655 115.844 148.340 1.00 0.00 H ATOM 10939 H2 WAT 315 98.133 115.417 146.969 1.00 0.00 H TER 10941 WAT 315 ATOM 10941 O WAT 316 73.762 110.812 129.056 1.00 0.00 O ATOM 10942 H1 WAT 316 73.818 111.659 128.614 1.00 0.00 H ATOM 10943 H2 WAT 316 74.603 110.719 129.502 1.00 0.00 H TER 10945 WAT 316 ATOM 10945 O WAT 317 37.777 119.453 9.356 1.00 0.00 O ATOM 10946 H1 WAT 317 37.448 118.569 9.521 1.00 0.00 H ATOM 10947 H2 WAT 317 37.670 119.576 8.412 1.00 0.00 H TER 10949 WAT 317 ATOM 10949 O WAT 318 35.415 20.587 78.707 1.00 0.00 O ATOM 10950 H1 WAT 318 35.452 19.759 78.227 1.00 0.00 H ATOM 10951 H2 WAT 318 34.851 21.147 78.174 1.00 0.00 H TER 10953 WAT 318 ATOM 10953 O WAT 319 65.386 74.938 124.956 1.00 0.00 O ATOM 10954 H1 WAT 319 65.153 75.683 125.511 1.00 0.00 H ATOM 10955 H2 WAT 319 64.754 74.967 124.238 1.00 0.00 H TER 10957 WAT 319 ATOM 10957 O WAT 320 57.214 41.421 112.936 1.00 0.00 O ATOM 10958 H1 WAT 320 56.615 41.147 113.630 1.00 0.00 H ATOM 10959 H2 WAT 320 57.916 41.883 113.393 1.00 0.00 H TER 10961 WAT 320 ATOM 10961 O WAT 321 39.306 20.457 11.246 1.00 0.00 O ATOM 10962 H1 WAT 321 38.825 20.545 10.423 1.00 0.00 H ATOM 10963 H2 WAT 321 39.247 19.526 11.460 1.00 0.00 H TER 10965 WAT 321 ATOM 10965 O WAT 322 55.230 111.108 71.313 1.00 0.00 O ATOM 10966 H1 WAT 322 54.321 111.402 71.384 1.00 0.00 H ATOM 10967 H2 WAT 322 55.561 111.543 70.528 1.00 0.00 H TER 10969 WAT 322 ATOM 10969 O WAT 323 34.984 3.080 123.795 1.00 0.00 O ATOM 10970 H1 WAT 323 34.252 2.776 123.257 1.00 0.00 H ATOM 10971 H2 WAT 323 35.015 2.464 124.527 1.00 0.00 H TER 10973 WAT 323 ATOM 10973 O WAT 324 142.990 60.059 67.358 1.00 0.00 O ATOM 10974 H1 WAT 324 142.669 60.582 68.093 1.00 0.00 H ATOM 10975 H2 WAT 324 143.469 60.683 66.812 1.00 0.00 H TER 10977 WAT 324 ATOM 10977 O WAT 325 71.618 103.738 13.572 1.00 0.00 O ATOM 10978 H1 WAT 325 72.031 103.965 12.739 1.00 0.00 H ATOM 10979 H2 WAT 325 72.268 103.976 14.234 1.00 0.00 H TER 10981 WAT 325 ATOM 10981 O WAT 326 37.181 33.653 141.368 1.00 0.00 O ATOM 10982 H1 WAT 326 37.285 33.427 140.444 1.00 0.00 H ATOM 10983 H2 WAT 326 38.076 33.743 141.695 1.00 0.00 H TER 10985 WAT 326 ATOM 10985 O WAT 327 15.328 127.587 91.238 1.00 0.00 O ATOM 10986 H1 WAT 327 15.839 127.256 90.499 1.00 0.00 H ATOM 10987 H2 WAT 327 14.939 128.400 90.915 1.00 0.00 H TER 10989 WAT 327 ATOM 10989 O WAT 328 47.974 105.685 136.443 1.00 0.00 O ATOM 10990 H1 WAT 328 48.645 105.882 137.096 1.00 0.00 H ATOM 10991 H2 WAT 328 48.274 104.876 136.028 1.00 0.00 H TER 10993 WAT 328 ATOM 10993 O WAT 329 132.158 69.126 120.037 1.00 0.00 O ATOM 10994 H1 WAT 329 132.540 69.941 119.709 1.00 0.00 H ATOM 10995 H2 WAT 329 131.442 69.409 120.605 1.00 0.00 H TER 10997 WAT 329 ATOM 10997 O WAT 330 12.516 109.976 9.674 1.00 0.00 O ATOM 10998 H1 WAT 330 13.087 109.404 9.162 1.00 0.00 H ATOM 10999 H2 WAT 330 11.630 109.681 9.463 1.00 0.00 H TER 11001 WAT 330 ATOM 11001 O WAT 331 24.045 23.930 9.313 1.00 0.00 O ATOM 11002 H1 WAT 331 24.247 24.712 9.827 1.00 0.00 H ATOM 11003 H2 WAT 331 23.089 23.894 9.298 1.00 0.00 H TER 11005 WAT 331 ATOM 11005 O WAT 332 102.967 32.881 107.416 1.00 0.00 O ATOM 11006 H1 WAT 332 102.697 32.133 106.882 1.00 0.00 H ATOM 11007 H2 WAT 332 102.987 33.617 106.803 1.00 0.00 H TER 11009 WAT 332 ATOM 11009 O WAT 333 41.240 92.670 104.517 1.00 0.00 O ATOM 11010 H1 WAT 333 41.561 92.297 103.696 1.00 0.00 H ATOM 11011 H2 WAT 333 40.311 92.441 104.537 1.00 0.00 H TER 11013 WAT 333 ATOM 11013 O WAT 334 103.388 102.307 19.077 1.00 0.00 O ATOM 11014 H1 WAT 334 104.306 102.343 19.346 1.00 0.00 H ATOM 11015 H2 WAT 334 103.411 102.423 18.127 1.00 0.00 H TER 11017 WAT 334 ATOM 11017 O WAT 335 131.604 84.025 106.392 1.00 0.00 O ATOM 11018 H1 WAT 335 132.330 84.457 106.843 1.00 0.00 H ATOM 11019 H2 WAT 335 131.098 84.743 106.010 1.00 0.00 H TER 11021 WAT 335 ATOM 11021 O WAT 336 22.786 37.223 77.424 1.00 0.00 O ATOM 11022 H1 WAT 336 22.119 36.944 76.796 1.00 0.00 H ATOM 11023 H2 WAT 336 23.154 38.021 77.044 1.00 0.00 H TER 11025 WAT 336 ATOM 11025 O WAT 337 87.296 20.690 96.348 1.00 0.00 O ATOM 11026 H1 WAT 337 87.443 21.265 97.099 1.00 0.00 H ATOM 11027 H2 WAT 337 86.960 21.269 95.664 1.00 0.00 H TER 11029 WAT 337 ATOM 11029 O WAT 338 5.220 57.578 102.516 1.00 0.00 O ATOM 11030 H1 WAT 338 4.463 57.891 103.011 1.00 0.00 H ATOM 11031 H2 WAT 338 5.033 57.827 101.611 1.00 0.00 H TER 11033 WAT 338 ATOM 11033 O WAT 339 26.654 51.301 79.442 1.00 0.00 O ATOM 11034 H1 WAT 339 25.855 51.489 78.949 1.00 0.00 H ATOM 11035 H2 WAT 339 27.364 51.531 78.843 1.00 0.00 H TER 11037 WAT 339 ATOM 11037 O WAT 340 129.682 70.147 115.781 1.00 0.00 O ATOM 11038 H1 WAT 340 129.834 70.712 116.539 1.00 0.00 H ATOM 11039 H2 WAT 340 128.954 70.561 115.317 1.00 0.00 H TER 11041 WAT 340 ATOM 11041 O WAT 341 111.294 77.492 113.702 1.00 0.00 O ATOM 11042 H1 WAT 341 110.503 77.008 113.465 1.00 0.00 H ATOM 11043 H2 WAT 341 111.675 77.753 112.864 1.00 0.00 H TER 11045 WAT 341 ATOM 11045 O WAT 342 83.034 121.465 102.186 1.00 0.00 O ATOM 11046 H1 WAT 342 83.589 121.267 101.432 1.00 0.00 H ATOM 11047 H2 WAT 342 83.207 122.387 102.375 1.00 0.00 H TER 11049 WAT 342 ATOM 11049 O WAT 343 136.179 144.724 75.114 1.00 0.00 O ATOM 11050 H1 WAT 343 136.635 143.921 74.863 1.00 0.00 H ATOM 11051 H2 WAT 343 136.025 145.181 74.288 1.00 0.00 H TER 11053 WAT 343 ATOM 11053 O WAT 344 145.062 51.544 127.859 1.00 0.00 O ATOM 11054 H1 WAT 344 145.893 51.409 128.315 1.00 0.00 H ATOM 11055 H2 WAT 344 145.315 51.788 126.968 1.00 0.00 H TER 11057 WAT 344 ATOM 11057 O WAT 345 23.685 144.687 105.459 1.00 0.00 O ATOM 11058 H1 WAT 345 24.362 145.075 106.013 1.00 0.00 H ATOM 11059 H2 WAT 345 23.145 145.428 105.186 1.00 0.00 H TER 11061 WAT 345 ATOM 11061 O WAT 346 4.363 54.488 138.953 1.00 0.00 O ATOM 11062 H1 WAT 346 5.051 54.341 138.304 1.00 0.00 H ATOM 11063 H2 WAT 346 3.913 53.645 139.019 1.00 0.00 H TER 11065 WAT 346 ATOM 11065 O WAT 347 24.218 129.555 134.782 1.00 0.00 O ATOM 11066 H1 WAT 347 23.493 129.200 135.295 1.00 0.00 H ATOM 11067 H2 WAT 347 23.820 129.808 133.949 1.00 0.00 H TER 11069 WAT 347 ATOM 11069 O WAT 348 129.584 85.334 131.469 1.00 0.00 O ATOM 11070 H1 WAT 348 130.524 85.238 131.626 1.00 0.00 H ATOM 11071 H2 WAT 348 129.200 85.392 132.343 1.00 0.00 H TER 11073 WAT 348 ATOM 11073 O WAT 349 92.430 123.441 127.563 1.00 0.00 O ATOM 11074 H1 WAT 349 92.811 122.605 127.833 1.00 0.00 H ATOM 11075 H2 WAT 349 93.081 123.821 126.973 1.00 0.00 H TER 11077 WAT 349 ATOM 11077 O WAT 350 101.196 91.547 95.825 1.00 0.00 O ATOM 11078 H1 WAT 350 100.517 91.369 95.174 1.00 0.00 H ATOM 11079 H2 WAT 350 102.002 91.623 95.315 1.00 0.00 H TER 11081 WAT 350 ATOM 11081 O WAT 351 16.343 141.957 8.968 1.00 0.00 O ATOM 11082 H1 WAT 351 15.486 142.352 8.808 1.00 0.00 H ATOM 11083 H2 WAT 351 16.208 141.390 9.727 1.00 0.00 H TER 11085 WAT 351 ATOM 11085 O WAT 352 107.840 140.523 140.606 1.00 0.00 O ATOM 11086 H1 WAT 352 107.085 141.034 140.900 1.00 0.00 H ATOM 11087 H2 WAT 352 107.500 139.634 140.500 1.00 0.00 H TER 11089 WAT 352 ATOM 11089 O WAT 353 60.550 18.641 125.067 1.00 0.00 O ATOM 11090 H1 WAT 353 60.350 17.714 125.195 1.00 0.00 H ATOM 11091 H2 WAT 353 60.877 18.935 125.917 1.00 0.00 H TER 11093 WAT 353 ATOM 11093 O WAT 354 47.776 34.029 55.102 1.00 0.00 O ATOM 11094 H1 WAT 354 47.314 33.818 55.913 1.00 0.00 H ATOM 11095 H2 WAT 354 48.299 34.801 55.318 1.00 0.00 H TER 11097 WAT 354 ATOM 11097 O WAT 355 94.481 136.233 4.191 1.00 0.00 O ATOM 11098 H1 WAT 355 94.585 136.998 4.757 1.00 0.00 H ATOM 11099 H2 WAT 355 93.916 135.642 4.688 1.00 0.00 H TER 11101 WAT 355 ATOM 11101 O WAT 356 24.994 110.195 4.608 1.00 0.00 O ATOM 11102 H1 WAT 356 24.643 110.886 5.169 1.00 0.00 H ATOM 11103 H2 WAT 356 25.333 110.658 3.842 1.00 0.00 H TER 11105 WAT 356 ATOM 11105 O WAT 357 109.462 54.931 27.258 1.00 0.00 O ATOM 11106 H1 WAT 357 108.586 55.244 27.030 1.00 0.00 H ATOM 11107 H2 WAT 357 109.316 54.060 27.628 1.00 0.00 H TER 11109 WAT 357 ATOM 11109 O WAT 358 140.373 26.776 58.889 1.00 0.00 O ATOM 11110 H1 WAT 358 140.962 26.709 58.138 1.00 0.00 H ATOM 11111 H2 WAT 358 139.498 26.824 58.503 1.00 0.00 H TER 11113 WAT 358 ATOM 11113 O WAT 359 99.818 21.573 128.044 1.00 0.00 O ATOM 11114 H1 WAT 359 100.204 22.157 128.697 1.00 0.00 H ATOM 11115 H2 WAT 359 98.918 21.443 128.341 1.00 0.00 H TER 11117 WAT 359 ATOM 11117 O WAT 360 78.029 55.974 142.473 1.00 0.00 O ATOM 11118 H1 WAT 360 78.344 56.461 141.711 1.00 0.00 H ATOM 11119 H2 WAT 360 77.747 56.650 143.090 1.00 0.00 H TER 11121 WAT 360 ATOM 11121 O WAT 361 26.014 144.587 70.537 1.00 0.00 O ATOM 11122 H1 WAT 361 25.824 143.694 70.824 1.00 0.00 H ATOM 11123 H2 WAT 361 25.526 144.684 69.719 1.00 0.00 H TER 11125 WAT 361 ATOM 11125 O WAT 362 54.413 26.472 149.309 1.00 0.00 O ATOM 11126 H1 WAT 362 55.249 26.807 148.983 1.00 0.00 H ATOM 11127 H2 WAT 362 53.781 27.158 149.095 1.00 0.00 H TER 11129 WAT 362 ATOM 11129 O WAT 363 114.036 32.154 102.053 1.00 0.00 O ATOM 11130 H1 WAT 363 113.328 31.801 101.514 1.00 0.00 H ATOM 11131 H2 WAT 363 113.910 31.748 102.910 1.00 0.00 H TER 11133 WAT 363 ATOM 11133 O WAT 364 126.812 75.718 155.370 1.00 0.00 O ATOM 11134 H1 WAT 364 127.631 76.189 155.212 1.00 0.00 H ATOM 11135 H2 WAT 364 126.160 76.407 155.497 1.00 0.00 H TER 11137 WAT 364 ATOM 11137 O WAT 365 13.379 37.448 150.587 1.00 0.00 O ATOM 11138 H1 WAT 365 13.256 36.907 149.807 1.00 0.00 H ATOM 11139 H2 WAT 365 13.488 38.336 150.248 1.00 0.00 H TER 11141 WAT 365 ATOM 11141 O WAT 366 20.110 128.163 147.572 1.00 0.00 O ATOM 11142 H1 WAT 366 20.096 127.613 148.355 1.00 0.00 H ATOM 11143 H2 WAT 366 19.864 127.573 146.860 1.00 0.00 H TER 11145 WAT 366 ATOM 11145 O WAT 367 66.617 89.835 109.779 1.00 0.00 O ATOM 11146 H1 WAT 367 66.620 90.110 108.862 1.00 0.00 H ATOM 11147 H2 WAT 367 67.536 89.873 110.043 1.00 0.00 H TER 11149 WAT 367 ATOM 11149 O WAT 368 36.421 8.868 70.664 1.00 0.00 O ATOM 11150 H1 WAT 368 35.600 9.028 71.130 1.00 0.00 H ATOM 11151 H2 WAT 368 36.157 8.733 69.754 1.00 0.00 H TER 11153 WAT 368 ATOM 11153 O WAT 369 145.589 2.926 72.146 1.00 0.00 O ATOM 11154 H1 WAT 369 146.147 3.500 71.621 1.00 0.00 H ATOM 11155 H2 WAT 369 144.942 2.588 71.526 1.00 0.00 H TER 11157 WAT 369 ATOM 11157 O WAT 370 45.774 121.789 88.237 1.00 0.00 O ATOM 11158 H1 WAT 370 44.868 121.912 88.519 1.00 0.00 H ATOM 11159 H2 WAT 370 45.854 120.846 88.092 1.00 0.00 H TER 11161 WAT 370 ATOM 11161 O WAT 371 117.224 22.203 59.687 1.00 0.00 O ATOM 11162 H1 WAT 371 117.226 22.972 60.257 1.00 0.00 H ATOM 11163 H2 WAT 371 117.083 22.556 58.809 1.00 0.00 H TER 11165 WAT 371 ATOM 11165 O WAT 372 63.549 38.347 20.776 1.00 0.00 O ATOM 11166 H1 WAT 372 63.653 37.650 21.424 1.00 0.00 H ATOM 11167 H2 WAT 372 63.862 37.961 19.958 1.00 0.00 H TER 11169 WAT 372 ATOM 11169 O WAT 373 118.982 109.607 134.186 1.00 0.00 O ATOM 11170 H1 WAT 373 118.535 109.624 135.033 1.00 0.00 H ATOM 11171 H2 WAT 373 118.307 109.330 133.565 1.00 0.00 H TER 11173 WAT 373 ATOM 11173 O WAT 374 89.636 1.413 108.339 1.00 0.00 O ATOM 11174 H1 WAT 374 88.973 0.724 108.387 1.00 0.00 H ATOM 11175 H2 WAT 374 89.269 2.055 107.731 1.00 0.00 H TER 11177 WAT 374 ATOM 11177 O WAT 375 42.139 73.208 18.077 1.00 0.00 O ATOM 11178 H1 WAT 375 42.641 73.527 17.326 1.00 0.00 H ATOM 11179 H2 WAT 375 42.575 72.393 18.327 1.00 0.00 H TER 11181 WAT 375 ATOM 11181 O WAT 376 127.682 105.544 99.893 1.00 0.00 O ATOM 11182 H1 WAT 376 128.382 104.897 99.808 1.00 0.00 H ATOM 11183 H2 WAT 376 126.954 105.059 100.282 1.00 0.00 H TER 11185 WAT 376 ATOM 11185 O WAT 377 96.938 8.639 141.861 1.00 0.00 O ATOM 11186 H1 WAT 377 96.023 8.374 141.763 1.00 0.00 H ATOM 11187 H2 WAT 377 97.072 9.294 141.175 1.00 0.00 H TER 11189 WAT 377 ATOM 11189 O WAT 378 70.711 118.158 14.697 1.00 0.00 O ATOM 11190 H1 WAT 378 70.495 117.989 15.614 1.00 0.00 H ATOM 11191 H2 WAT 378 69.862 118.210 14.258 1.00 0.00 H TER 11193 WAT 378 ATOM 11193 O WAT 379 7.971 90.791 68.038 1.00 0.00 O ATOM 11194 H1 WAT 379 7.900 90.719 67.086 1.00 0.00 H ATOM 11195 H2 WAT 379 7.365 91.495 68.271 1.00 0.00 H TER 11197 WAT 379 ATOM 11197 O WAT 380 85.844 32.486 86.102 1.00 0.00 O ATOM 11198 H1 WAT 380 86.120 31.764 86.667 1.00 0.00 H ATOM 11199 H2 WAT 380 85.084 32.145 85.631 1.00 0.00 H TER 11201 WAT 380 ATOM 11201 O WAT 381 119.078 3.980 25.296 1.00 0.00 O ATOM 11202 H1 WAT 381 120.014 3.964 25.498 1.00 0.00 H ATOM 11203 H2 WAT 381 119.033 4.301 24.395 1.00 0.00 H TER 11205 WAT 381 ATOM 11205 O WAT 382 44.037 25.392 119.523 1.00 0.00 O ATOM 11206 H1 WAT 382 44.735 25.443 120.176 1.00 0.00 H ATOM 11207 H2 WAT 382 44.445 24.969 118.768 1.00 0.00 H TER 11209 WAT 382 ATOM 11209 O WAT 383 135.283 27.231 74.066 1.00 0.00 O ATOM 11210 H1 WAT 383 135.144 27.548 73.174 1.00 0.00 H ATOM 11211 H2 WAT 383 135.561 26.322 73.956 1.00 0.00 H TER 11213 WAT 383 ATOM 11213 O WAT 384 95.438 65.924 22.065 1.00 0.00 O ATOM 11214 H1 WAT 384 94.697 66.195 22.607 1.00 0.00 H ATOM 11215 H2 WAT 384 95.107 65.182 21.559 1.00 0.00 H TER 11217 WAT 384 ATOM 11217 O WAT 385 11.649 50.452 132.171 1.00 0.00 O ATOM 11218 H1 WAT 385 12.291 50.013 131.613 1.00 0.00 H ATOM 11219 H2 WAT 385 10.945 50.705 131.574 1.00 0.00 H TER 11221 WAT 385 ATOM 11221 O WAT 386 37.322 111.846 107.813 1.00 0.00 O ATOM 11222 H1 WAT 386 36.945 112.277 107.046 1.00 0.00 H ATOM 11223 H2 WAT 386 36.757 112.112 108.538 1.00 0.00 H TER 11225 WAT 386 ATOM 11225 O WAT 387 27.649 72.713 15.716 1.00 0.00 O ATOM 11226 H1 WAT 387 27.922 73.332 16.394 1.00 0.00 H ATOM 11227 H2 WAT 387 26.887 72.270 16.090 1.00 0.00 H TER 11229 WAT 387 ATOM 11229 O WAT 388 51.469 14.917 139.759 1.00 0.00 O ATOM 11230 H1 WAT 388 50.565 15.059 139.479 1.00 0.00 H ATOM 11231 H2 WAT 388 51.855 15.793 139.774 1.00 0.00 H TER 11233 WAT 388 ATOM 11233 O WAT 389 106.326 89.617 90.935 1.00 0.00 O ATOM 11234 H1 WAT 389 106.335 89.636 91.892 1.00 0.00 H ATOM 11235 H2 WAT 389 105.597 89.036 90.714 1.00 0.00 H TER 11237 WAT 389 ATOM 11237 O WAT 390 130.026 35.731 79.225 1.00 0.00 O ATOM 11238 H1 WAT 390 129.859 35.423 78.334 1.00 0.00 H ATOM 11239 H2 WAT 390 130.933 36.036 79.207 1.00 0.00 H TER 11241 WAT 390 ATOM 11241 O WAT 391 132.991 123.771 138.568 1.00 0.00 O ATOM 11242 H1 WAT 391 133.828 124.185 138.360 1.00 0.00 H ATOM 11243 H2 WAT 391 132.477 124.464 138.981 1.00 0.00 H TER 11245 WAT 391 ATOM 11245 O WAT 392 72.193 54.506 151.753 1.00 0.00 O ATOM 11246 H1 WAT 392 71.405 54.115 152.131 1.00 0.00 H ATOM 11247 H2 WAT 392 72.355 53.997 150.958 1.00 0.00 H TER 11249 WAT 392 ATOM 11249 O WAT 393 135.171 126.211 113.618 1.00 0.00 O ATOM 11250 H1 WAT 393 134.347 126.333 113.147 1.00 0.00 H ATOM 11251 H2 WAT 393 135.812 126.712 113.113 1.00 0.00 H TER 11253 WAT 393 ATOM 11253 O WAT 394 17.768 105.554 127.062 1.00 0.00 O ATOM 11254 H1 WAT 394 18.386 105.280 127.740 1.00 0.00 H ATOM 11255 H2 WAT 394 17.894 106.501 126.992 1.00 0.00 H TER 11257 WAT 394 ATOM 11257 O WAT 395 27.649 42.155 89.942 1.00 0.00 O ATOM 11258 H1 WAT 395 28.337 42.142 90.607 1.00 0.00 H ATOM 11259 H2 WAT 395 27.167 42.965 90.112 1.00 0.00 H TER 11261 WAT 395 ATOM 11261 O WAT 396 97.441 101.947 134.343 1.00 0.00 O ATOM 11262 H1 WAT 396 97.134 101.626 135.191 1.00 0.00 H ATOM 11263 H2 WAT 396 97.874 101.193 133.944 1.00 0.00 H TER 11265 WAT 396 ATOM 11265 O WAT 397 79.029 61.765 147.285 1.00 0.00 O ATOM 11266 H1 WAT 397 78.349 62.368 147.588 1.00 0.00 H ATOM 11267 H2 WAT 397 78.688 60.895 147.493 1.00 0.00 H TER 11269 WAT 397 ATOM 11269 O WAT 398 126.487 132.268 62.136 1.00 0.00 O ATOM 11270 H1 WAT 398 126.284 131.399 61.790 1.00 0.00 H ATOM 11271 H2 WAT 398 127.421 132.231 62.342 1.00 0.00 H TER 11273 WAT 398 ATOM 11273 O WAT 399 139.169 115.789 119.666 1.00 0.00 O ATOM 11274 H1 WAT 399 138.471 115.164 119.862 1.00 0.00 H ATOM 11275 H2 WAT 399 139.579 115.447 118.871 1.00 0.00 H TER 11277 WAT 399 ATOM 11277 O WAT 400 103.005 99.212 3.913 1.00 0.00 O ATOM 11278 H1 WAT 400 103.072 98.553 3.223 1.00 0.00 H ATOM 11279 H2 WAT 400 103.908 99.351 4.200 1.00 0.00 H TER 11281 WAT 400 ATOM 11281 O WAT 401 76.662 124.857 81.311 1.00 0.00 O ATOM 11282 H1 WAT 401 77.375 125.146 81.881 1.00 0.00 H ATOM 11283 H2 WAT 401 76.023 124.466 81.907 1.00 0.00 H TER 11285 WAT 401 ATOM 11285 O WAT 402 17.548 143.039 137.325 1.00 0.00 O ATOM 11286 H1 WAT 402 17.719 143.384 138.201 1.00 0.00 H ATOM 11287 H2 WAT 402 17.392 142.104 137.462 1.00 0.00 H TER 11289 WAT 402 ATOM 11289 O WAT 403 112.539 99.382 89.671 1.00 0.00 O ATOM 11290 H1 WAT 403 113.381 99.207 90.092 1.00 0.00 H ATOM 11291 H2 WAT 403 112.153 100.086 90.193 1.00 0.00 H TER 11293 WAT 403 ATOM 11293 O WAT 404 98.530 21.508 86.501 1.00 0.00 O ATOM 11294 H1 WAT 404 99.381 21.474 86.064 1.00 0.00 H ATOM 11295 H2 WAT 404 98.184 20.619 86.421 1.00 0.00 H TER 11297 WAT 404 ATOM 11297 O WAT 405 2.760 140.936 57.735 1.00 0.00 O ATOM 11298 H1 WAT 405 3.688 141.097 57.906 1.00 0.00 H ATOM 11299 H2 WAT 405 2.638 141.184 56.819 1.00 0.00 H TER 11301 WAT 405 ATOM 11301 O WAT 406 77.582 31.815 155.347 1.00 0.00 O ATOM 11302 H1 WAT 406 77.853 30.968 154.994 1.00 0.00 H ATOM 11303 H2 WAT 406 77.783 31.761 156.281 1.00 0.00 H TER 11305 WAT 406 ATOM 11305 O WAT 407 66.153 34.985 5.462 1.00 0.00 O ATOM 11306 H1 WAT 407 65.213 34.835 5.360 1.00 0.00 H ATOM 11307 H2 WAT 407 66.544 34.592 4.681 1.00 0.00 H TER 11309 WAT 407 ATOM 11309 O WAT 408 38.766 88.723 9.077 1.00 0.00 O ATOM 11310 H1 WAT 408 38.398 88.075 9.677 1.00 0.00 H ATOM 11311 H2 WAT 408 38.147 89.453 9.103 1.00 0.00 H TER 11313 WAT 408 ATOM 11313 O WAT 409 3.929 42.170 131.523 1.00 0.00 O ATOM 11314 H1 WAT 409 3.230 42.521 132.075 1.00 0.00 H ATOM 11315 H2 WAT 409 4.550 42.892 131.435 1.00 0.00 H TER 11317 WAT 409 ATOM 11317 O WAT 410 82.495 58.552 126.553 1.00 0.00 O ATOM 11318 H1 WAT 410 82.220 59.469 126.534 1.00 0.00 H ATOM 11319 H2 WAT 410 82.176 58.224 127.394 1.00 0.00 H TER 11321 WAT 410 ATOM 11321 O WAT 411 116.534 76.197 102.764 1.00 0.00 O ATOM 11322 H1 WAT 411 115.627 75.945 102.936 1.00 0.00 H ATOM 11323 H2 WAT 411 116.517 77.154 102.747 1.00 0.00 H TER 11325 WAT 411 ATOM 11325 O WAT 412 5.411 114.114 90.958 1.00 0.00 O ATOM 11326 H1 WAT 412 5.220 113.317 90.464 1.00 0.00 H ATOM 11327 H2 WAT 412 6.183 114.483 90.528 1.00 0.00 H TER 11329 WAT 412 ATOM 11329 O WAT 413 25.686 46.577 6.561 1.00 0.00 O ATOM 11330 H1 WAT 413 24.730 46.538 6.553 1.00 0.00 H ATOM 11331 H2 WAT 413 25.912 46.726 7.480 1.00 0.00 H TER 11333 WAT 413 ATOM 11333 O WAT 414 92.497 15.582 116.634 1.00 0.00 O ATOM 11334 H1 WAT 414 91.980 16.314 116.297 1.00 0.00 H ATOM 11335 H2 WAT 414 91.926 14.820 116.534 1.00 0.00 H TER 11337 WAT 414 ATOM 11337 O WAT 415 101.104 37.807 15.258 1.00 0.00 O ATOM 11338 H1 WAT 415 100.449 38.108 15.888 1.00 0.00 H ATOM 11339 H2 WAT 415 101.567 37.103 15.712 1.00 0.00 H TER 11341 WAT 415 ATOM 11341 O WAT 416 113.067 86.527 105.577 1.00 0.00 O ATOM 11342 H1 WAT 416 112.313 86.945 105.161 1.00 0.00 H ATOM 11343 H2 WAT 416 112.905 86.619 106.515 1.00 0.00 H TER 11345 WAT 416 ATOM 11345 O WAT 417 65.715 141.798 89.919 1.00 0.00 O ATOM 11346 H1 WAT 417 66.668 141.739 89.983 1.00 0.00 H ATOM 11347 H2 WAT 417 65.467 142.419 90.605 1.00 0.00 H TER 11349 WAT 417 ATOM 11349 O WAT 418 75.050 111.090 97.364 1.00 0.00 O ATOM 11350 H1 WAT 418 74.266 111.355 97.845 1.00 0.00 H ATOM 11351 H2 WAT 418 75.552 111.899 97.261 1.00 0.00 H TER 11353 WAT 418 ATOM 11353 O WAT 419 76.715 142.081 128.468 1.00 0.00 O ATOM 11354 H1 WAT 419 76.028 141.782 129.063 1.00 0.00 H ATOM 11355 H2 WAT 419 76.894 142.980 128.741 1.00 0.00 H TER 11357 WAT 419 ATOM 11357 O WAT 420 71.128 24.616 93.197 1.00 0.00 O ATOM 11358 H1 WAT 420 70.903 25.301 92.568 1.00 0.00 H ATOM 11359 H2 WAT 420 70.961 23.797 92.730 1.00 0.00 H TER 11361 WAT 420 ATOM 11361 O WAT 421 116.115 44.449 5.710 1.00 0.00 O ATOM 11362 H1 WAT 421 115.183 44.306 5.875 1.00 0.00 H ATOM 11363 H2 WAT 421 116.446 44.829 6.523 1.00 0.00 H TER 11365 WAT 421 ATOM 11365 O WAT 422 11.672 117.806 103.061 1.00 0.00 O ATOM 11366 H1 WAT 422 11.365 117.525 102.199 1.00 0.00 H ATOM 11367 H2 WAT 422 12.554 118.143 102.902 1.00 0.00 H TER 11369 WAT 422 ATOM 11369 O WAT 423 131.527 50.862 0.547 1.00 0.00 O ATOM 11370 H1 WAT 423 130.707 50.532 0.914 1.00 0.00 H ATOM 11371 H2 WAT 423 132.018 50.074 0.312 1.00 0.00 H TER 11373 WAT 423 ATOM 11373 O WAT 424 69.204 91.599 65.350 1.00 0.00 O ATOM 11374 H1 WAT 424 68.283 91.348 65.281 1.00 0.00 H ATOM 11375 H2 WAT 424 69.310 91.871 66.262 1.00 0.00 H TER 11377 WAT 424 ATOM 11377 O WAT 425 81.078 78.874 115.164 1.00 0.00 O ATOM 11378 H1 WAT 425 81.013 79.183 114.260 1.00 0.00 H ATOM 11379 H2 WAT 425 80.618 79.538 115.678 1.00 0.00 H TER 11381 WAT 425 ATOM 11381 O WAT 426 95.036 6.487 61.353 1.00 0.00 O ATOM 11382 H1 WAT 426 94.541 5.697 61.568 1.00 0.00 H ATOM 11383 H2 WAT 426 95.222 6.407 60.417 1.00 0.00 H TER 11385 WAT 426 ATOM 11385 O WAT 427 0.445 28.362 96.550 1.00 0.00 O ATOM 11386 H1 WAT 427 0.685 28.292 97.474 1.00 0.00 H ATOM 11387 H2 WAT 427 -0.259 27.722 96.437 1.00 0.00 H TER 11389 WAT 427 ATOM 11389 O WAT 428 47.868 127.035 106.192 1.00 0.00 O ATOM 11390 H1 WAT 428 48.074 127.534 105.401 1.00 0.00 H ATOM 11391 H2 WAT 428 46.954 127.251 106.380 1.00 0.00 H TER 11393 WAT 428 ATOM 11393 O WAT 429 138.386 27.345 93.722 1.00 0.00 O ATOM 11394 H1 WAT 429 138.667 26.672 94.342 1.00 0.00 H ATOM 11395 H2 WAT 429 138.822 28.143 94.020 1.00 0.00 H TER 11397 WAT 429 ATOM 11397 O WAT 430 97.992 33.362 119.697 1.00 0.00 O ATOM 11398 H1 WAT 430 97.370 33.129 119.008 1.00 0.00 H ATOM 11399 H2 WAT 430 98.650 32.667 119.671 1.00 0.00 H TER 11401 WAT 430 ATOM 11401 O WAT 431 79.268 0.807 87.309 1.00 0.00 O ATOM 11402 H1 WAT 431 79.041 0.381 86.482 1.00 0.00 H ATOM 11403 H2 WAT 431 78.703 0.388 87.958 1.00 0.00 H TER 11405 WAT 431 ATOM 11405 O WAT 432 35.451 121.942 104.454 1.00 0.00 O ATOM 11406 H1 WAT 432 35.873 121.653 103.645 1.00 0.00 H ATOM 11407 H2 WAT 432 34.690 122.443 104.161 1.00 0.00 H TER 11409 WAT 432 ATOM 11409 O WAT 433 103.701 45.247 67.033 1.00 0.00 O ATOM 11410 H1 WAT 433 103.928 45.820 66.301 1.00 0.00 H ATOM 11411 H2 WAT 433 102.849 44.881 66.795 1.00 0.00 H TER 11413 WAT 433 ATOM 11413 O WAT 434 102.282 21.369 118.928 1.00 0.00 O ATOM 11414 H1 WAT 434 101.331 21.360 119.035 1.00 0.00 H ATOM 11415 H2 WAT 434 102.511 20.458 118.743 1.00 0.00 H TER 11417 WAT 434 ATOM 11417 O WAT 435 70.641 32.227 93.562 1.00 0.00 O ATOM 11418 H1 WAT 435 70.994 33.112 93.660 1.00 0.00 H ATOM 11419 H2 WAT 435 71.213 31.811 92.918 1.00 0.00 H TER 11421 WAT 435 ATOM 11421 O WAT 436 135.929 53.983 115.726 1.00 0.00 O ATOM 11422 H1 WAT 436 136.144 53.642 116.594 1.00 0.00 H ATOM 11423 H2 WAT 436 136.601 53.617 115.151 1.00 0.00 H TER 11425 WAT 436 ATOM 11425 O WAT 437 128.701 116.409 19.785 1.00 0.00 O ATOM 11426 H1 WAT 437 128.558 116.910 18.982 1.00 0.00 H ATOM 11427 H2 WAT 437 127.825 116.139 20.058 1.00 0.00 H TER 11429 WAT 437 ATOM 11429 O WAT 438 49.735 19.995 8.723 1.00 0.00 O ATOM 11430 H1 WAT 438 49.559 20.678 9.371 1.00 0.00 H ATOM 11431 H2 WAT 438 49.461 19.184 9.149 1.00 0.00 H TER 11433 WAT 438 ATOM 11433 O WAT 439 100.480 106.002 70.687 1.00 0.00 O ATOM 11434 H1 WAT 439 100.246 105.079 70.787 1.00 0.00 H ATOM 11435 H2 WAT 439 101.427 106.025 70.821 1.00 0.00 H TER 11437 WAT 439 ATOM 11437 O WAT 440 84.843 1.141 2.781 1.00 0.00 O ATOM 11438 H1 WAT 440 84.214 1.804 2.497 1.00 0.00 H ATOM 11439 H2 WAT 440 84.681 1.042 3.719 1.00 0.00 H TER 11441 WAT 440 ATOM 11441 O WAT 441 78.095 117.369 72.624 1.00 0.00 O ATOM 11442 H1 WAT 441 78.069 116.420 72.746 1.00 0.00 H ATOM 11443 H2 WAT 441 78.143 117.487 71.676 1.00 0.00 H TER 11445 WAT 441 ATOM 11445 O WAT 442 89.928 41.752 8.728 1.00 0.00 O ATOM 11446 H1 WAT 442 89.949 42.026 7.811 1.00 0.00 H ATOM 11447 H2 WAT 442 88.997 41.675 8.934 1.00 0.00 H TER 11449 WAT 442 ATOM 11449 O WAT 443 27.806 29.365 99.405 1.00 0.00 O ATOM 11450 H1 WAT 443 27.368 28.848 100.081 1.00 0.00 H ATOM 11451 H2 WAT 443 28.577 29.727 99.842 1.00 0.00 H TER 11453 WAT 443 ATOM 11453 O WAT 444 124.211 112.038 63.250 1.00 0.00 O ATOM 11454 H1 WAT 444 123.825 112.843 63.595 1.00 0.00 H ATOM 11455 H2 WAT 444 123.496 111.402 63.269 1.00 0.00 H TER 11457 WAT 444 ATOM 11457 O WAT 445 40.548 55.046 139.328 1.00 0.00 O ATOM 11458 H1 WAT 445 41.238 54.949 138.672 1.00 0.00 H ATOM 11459 H2 WAT 445 39.824 55.458 138.855 1.00 0.00 H TER 11461 WAT 445 ATOM 11461 O WAT 446 72.520 45.175 106.288 1.00 0.00 O ATOM 11462 H1 WAT 446 72.482 45.518 107.181 1.00 0.00 H ATOM 11463 H2 WAT 446 72.644 45.948 105.739 1.00 0.00 H TER 11465 WAT 446 ATOM 11465 O WAT 447 85.142 72.857 102.847 1.00 0.00 O ATOM 11466 H1 WAT 447 84.793 72.864 103.738 1.00 0.00 H ATOM 11467 H2 WAT 447 85.757 73.590 102.824 1.00 0.00 H TER 11469 WAT 447 ATOM 11469 O WAT 448 129.658 27.734 153.133 1.00 0.00 O ATOM 11470 H1 WAT 448 128.850 28.043 152.724 1.00 0.00 H ATOM 11471 H2 WAT 448 129.442 27.660 154.063 1.00 0.00 H TER 11473 WAT 448 ATOM 11473 O WAT 449 51.097 57.130 82.131 1.00 0.00 O ATOM 11474 H1 WAT 449 52.004 56.861 81.988 1.00 0.00 H ATOM 11475 H2 WAT 449 50.643 56.324 82.374 1.00 0.00 H TER 11477 WAT 449 ATOM 11477 O WAT 450 48.606 32.963 151.992 1.00 0.00 O ATOM 11478 H1 WAT 450 48.071 32.298 151.559 1.00 0.00 H ATOM 11479 H2 WAT 450 47.972 33.542 152.415 1.00 0.00 H TER 11481 WAT 450 ATOM 11481 O WAT 451 32.978 15.244 144.088 1.00 0.00 O ATOM 11482 H1 WAT 451 33.078 14.385 143.678 1.00 0.00 H ATOM 11483 H2 WAT 451 33.848 15.449 144.430 1.00 0.00 H TER 11485 WAT 451 ATOM 11485 O WAT 452 107.063 32.550 134.137 1.00 0.00 O ATOM 11486 H1 WAT 452 107.800 32.545 134.748 1.00 0.00 H ATOM 11487 H2 WAT 452 107.258 33.268 133.534 1.00 0.00 H TER 11489 WAT 452 ATOM 11489 O WAT 453 88.130 10.160 12.871 1.00 0.00 O ATOM 11490 H1 WAT 453 87.628 9.383 12.625 1.00 0.00 H ATOM 11491 H2 WAT 453 88.761 10.274 12.160 1.00 0.00 H TER 11493 WAT 453 ATOM 11493 O WAT 454 108.651 43.835 8.441 1.00 0.00 O ATOM 11494 H1 WAT 454 109.537 43.473 8.449 1.00 0.00 H ATOM 11495 H2 WAT 454 108.668 44.526 9.103 1.00 0.00 H TER 11497 WAT 454 ATOM 11497 O WAT 455 82.280 119.982 150.834 1.00 0.00 O ATOM 11498 H1 WAT 455 81.700 119.749 150.110 1.00 0.00 H ATOM 11499 H2 WAT 455 81.746 119.856 151.619 1.00 0.00 H TER 11501 WAT 455 ATOM 11501 O WAT 456 130.704 31.240 6.085 1.00 0.00 O ATOM 11502 H1 WAT 456 131.597 30.969 5.872 1.00 0.00 H ATOM 11503 H2 WAT 456 130.163 30.484 5.855 1.00 0.00 H TER 11505 WAT 456 ATOM 11505 O WAT 457 17.165 125.084 75.338 1.00 0.00 O ATOM 11506 H1 WAT 457 18.028 125.364 75.642 1.00 0.00 H ATOM 11507 H2 WAT 457 17.309 124.797 74.437 1.00 0.00 H TER 11509 WAT 457 ATOM 11509 O WAT 458 45.442 5.111 5.777 1.00 0.00 O ATOM 11510 H1 WAT 458 44.582 5.218 5.370 1.00 0.00 H ATOM 11511 H2 WAT 458 45.580 5.924 6.263 1.00 0.00 H TER 11513 WAT 458 ATOM 11513 O WAT 459 73.633 39.652 79.057 1.00 0.00 O ATOM 11514 H1 WAT 459 73.130 40.401 78.736 1.00 0.00 H ATOM 11515 H2 WAT 459 73.033 38.910 78.981 1.00 0.00 H TER 11517 WAT 459 ATOM 11517 O WAT 460 24.901 56.028 81.505 1.00 0.00 O ATOM 11518 H1 WAT 460 24.849 55.072 81.518 1.00 0.00 H ATOM 11519 H2 WAT 460 24.113 56.317 81.965 1.00 0.00 H TER 11521 WAT 460 ATOM 11521 O WAT 461 86.748 14.958 104.220 1.00 0.00 O ATOM 11522 H1 WAT 461 85.952 15.374 104.551 1.00 0.00 H ATOM 11523 H2 WAT 461 87.319 14.891 104.985 1.00 0.00 H TER 11525 WAT 461 ATOM 11525 O WAT 462 42.677 93.482 86.000 1.00 0.00 O ATOM 11526 H1 WAT 462 42.766 92.565 85.742 1.00 0.00 H ATOM 11527 H2 WAT 462 43.341 93.942 85.487 1.00 0.00 H TER 11529 WAT 462 ATOM 11529 O WAT 463 82.298 83.827 148.195 1.00 0.00 O ATOM 11530 H1 WAT 463 81.583 83.290 148.535 1.00 0.00 H ATOM 11531 H2 WAT 463 82.995 83.738 148.844 1.00 0.00 H TER 11533 WAT 463 ATOM 11533 O WAT 464 29.834 88.867 121.589 1.00 0.00 O ATOM 11534 H1 WAT 464 30.499 89.171 122.208 1.00 0.00 H ATOM 11535 H2 WAT 464 30.293 88.233 121.038 1.00 0.00 H TER 11537 WAT 464 ATOM 11537 O WAT 465 121.646 28.797 78.913 1.00 0.00 O ATOM 11538 H1 WAT 465 122.318 28.153 78.689 1.00 0.00 H ATOM 11539 H2 WAT 465 122.135 29.543 79.259 1.00 0.00 H TER 11541 WAT 465 ATOM 11541 O WAT 466 60.157 39.950 134.200 1.00 0.00 O ATOM 11542 H1 WAT 466 59.856 40.490 133.469 1.00 0.00 H ATOM 11543 H2 WAT 466 59.952 40.466 134.979 1.00 0.00 H TER 11545 WAT 466 ATOM 11545 O WAT 467 10.909 36.009 130.404 1.00 0.00 O ATOM 11546 H1 WAT 467 10.947 36.455 131.250 1.00 0.00 H ATOM 11547 H2 WAT 467 11.518 36.496 129.849 1.00 0.00 H TER 11549 WAT 467 ATOM 11549 O WAT 468 89.980 142.874 6.892 1.00 0.00 O ATOM 11550 H1 WAT 468 89.721 142.259 6.205 1.00 0.00 H ATOM 11551 H2 WAT 468 89.153 143.180 7.264 1.00 0.00 H TER 11553 WAT 468 ATOM 11553 O WAT 469 4.183 47.997 130.771 1.00 0.00 O ATOM 11554 H1 WAT 469 4.728 47.571 130.109 1.00 0.00 H ATOM 11555 H2 WAT 469 4.451 47.594 131.597 1.00 0.00 H TER 11557 WAT 469 ATOM 11557 O WAT 470 97.868 51.869 73.893 1.00 0.00 O ATOM 11558 H1 WAT 470 97.921 52.805 73.700 1.00 0.00 H ATOM 11559 H2 WAT 470 98.341 51.449 73.175 1.00 0.00 H TER 11561 WAT 470 ATOM 11561 O WAT 471 39.116 16.632 85.046 1.00 0.00 O ATOM 11562 H1 WAT 471 39.126 16.919 84.133 1.00 0.00 H ATOM 11563 H2 WAT 471 39.962 16.911 85.395 1.00 0.00 H TER 11565 WAT 471 ATOM 11565 O WAT 472 73.069 45.509 157.381 1.00 0.00 O ATOM 11566 H1 WAT 472 72.359 45.535 158.023 1.00 0.00 H ATOM 11567 H2 WAT 472 73.802 45.110 157.851 1.00 0.00 H TER 11569 WAT 472 ATOM 11569 O WAT 473 61.649 71.671 156.402 1.00 0.00 O ATOM 11570 H1 WAT 473 62.584 71.805 156.244 1.00 0.00 H ATOM 11571 H2 WAT 473 61.297 72.553 156.521 1.00 0.00 H TER 11573 WAT 473 ATOM 11573 O WAT 474 38.063 32.907 79.469 1.00 0.00 O ATOM 11574 H1 WAT 474 38.433 33.012 78.593 1.00 0.00 H ATOM 11575 H2 WAT 474 37.317 32.320 79.344 1.00 0.00 H TER 11577 WAT 474 ATOM 11577 O WAT 475 31.033 36.646 126.468 1.00 0.00 O ATOM 11578 H1 WAT 475 31.728 37.288 126.616 1.00 0.00 H ATOM 11579 H2 WAT 475 30.737 36.816 125.573 1.00 0.00 H TER 11581 WAT 475 ATOM 11581 O WAT 476 43.809 26.404 13.477 1.00 0.00 O ATOM 11582 H1 WAT 476 44.242 26.458 12.625 1.00 0.00 H ATOM 11583 H2 WAT 476 43.435 25.523 13.499 1.00 0.00 H TER 11585 WAT 476 ATOM 11585 O WAT 477 123.982 75.804 103.171 1.00 0.00 O ATOM 11586 H1 WAT 477 124.908 75.680 103.379 1.00 0.00 H ATOM 11587 H2 WAT 477 123.832 75.246 102.408 1.00 0.00 H TER 11589 WAT 477 ATOM 11589 O WAT 478 31.676 49.711 18.994 1.00 0.00 O ATOM 11590 H1 WAT 478 31.136 50.496 19.075 1.00 0.00 H ATOM 11591 H2 WAT 478 31.749 49.566 18.050 1.00 0.00 H TER 11593 WAT 478 ATOM 11593 O WAT 479 74.598 61.452 68.300 1.00 0.00 O ATOM 11594 H1 WAT 479 73.847 60.893 68.100 1.00 0.00 H ATOM 11595 H2 WAT 479 75.069 61.526 67.471 1.00 0.00 H TER 11597 WAT 479 ATOM 11597 O WAT 480 113.460 92.505 115.022 1.00 0.00 O ATOM 11598 H1 WAT 480 114.196 92.482 114.410 1.00 0.00 H ATOM 11599 H2 WAT 480 113.077 91.630 114.968 1.00 0.00 H TER 11601 WAT 480 ATOM 11601 O WAT 481 85.421 103.735 98.034 1.00 0.00 O ATOM 11602 H1 WAT 481 84.500 103.937 98.197 1.00 0.00 H ATOM 11603 H2 WAT 481 85.555 103.954 97.112 1.00 0.00 H TER 11605 WAT 481 ATOM 11605 O WAT 482 130.640 66.572 12.154 1.00 0.00 O ATOM 11606 H1 WAT 482 131.425 67.049 11.883 1.00 0.00 H ATOM 11607 H2 WAT 482 130.158 67.194 12.699 1.00 0.00 H TER 11609 WAT 482 ATOM 11609 O WAT 483 79.053 57.558 140.403 1.00 0.00 O ATOM 11610 H1 WAT 483 79.096 57.209 139.513 1.00 0.00 H ATOM 11611 H2 WAT 483 79.968 57.649 140.669 1.00 0.00 H TER 11613 WAT 483 ATOM 11613 O WAT 484 137.969 119.092 74.802 1.00 0.00 O ATOM 11614 H1 WAT 484 137.819 119.204 75.741 1.00 0.00 H ATOM 11615 H2 WAT 484 137.388 118.374 74.551 1.00 0.00 H TER 11617 WAT 484 ATOM 11617 O WAT 485 95.627 72.910 93.262 1.00 0.00 O ATOM 11618 H1 WAT 485 95.791 72.609 94.156 1.00 0.00 H ATOM 11619 H2 WAT 485 95.270 73.792 93.368 1.00 0.00 H TER 11621 WAT 485 ATOM 11621 O WAT 486 24.765 27.365 151.433 1.00 0.00 O ATOM 11622 H1 WAT 486 24.760 27.824 150.593 1.00 0.00 H ATOM 11623 H2 WAT 486 23.911 26.934 151.476 1.00 0.00 H TER 11625 WAT 486 ATOM 11625 O WAT 487 69.297 53.105 125.346 1.00 0.00 O ATOM 11626 H1 WAT 487 68.540 52.520 125.311 1.00 0.00 H ATOM 11627 H2 WAT 487 69.019 53.886 124.867 1.00 0.00 H TER 11629 WAT 487 ATOM 11629 O WAT 488 47.489 31.200 114.559 1.00 0.00 O ATOM 11630 H1 WAT 488 46.624 30.909 114.273 1.00 0.00 H ATOM 11631 H2 WAT 488 48.084 30.509 114.267 1.00 0.00 H TER 11633 WAT 488 ATOM 11633 O WAT 489 86.158 111.864 142.045 1.00 0.00 O ATOM 11634 H1 WAT 489 86.014 112.809 142.004 1.00 0.00 H ATOM 11635 H2 WAT 489 86.330 111.608 141.139 1.00 0.00 H TER 11637 WAT 489 ATOM 11637 O WAT 490 2.178 119.026 98.419 1.00 0.00 O ATOM 11638 H1 WAT 490 2.217 119.439 97.556 1.00 0.00 H ATOM 11639 H2 WAT 490 1.587 119.584 98.925 1.00 0.00 H TER 11641 WAT 490 ATOM 11641 O WAT 491 136.870 32.240 157.679 1.00 0.00 O ATOM 11642 H1 WAT 491 136.696 32.001 156.769 1.00 0.00 H ATOM 11643 H2 WAT 491 137.732 31.866 157.864 1.00 0.00 H TER 11645 WAT 491 ATOM 11645 O WAT 492 22.455 132.137 121.221 1.00 0.00 O ATOM 11646 H1 WAT 492 23.408 132.138 121.304 1.00 0.00 H ATOM 11647 H2 WAT 492 22.163 131.448 121.817 1.00 0.00 H TER 11649 WAT 492 ATOM 11649 O WAT 493 138.757 39.595 149.089 1.00 0.00 O ATOM 11650 H1 WAT 493 138.415 39.101 149.834 1.00 0.00 H ATOM 11651 H2 WAT 493 139.659 39.289 148.992 1.00 0.00 H TER 11653 WAT 493 ATOM 11653 O WAT 494 29.819 3.757 14.682 1.00 0.00 O ATOM 11654 H1 WAT 494 29.934 4.629 14.304 1.00 0.00 H ATOM 11655 H2 WAT 494 29.933 3.887 15.624 1.00 0.00 H TER 11657 WAT 494 ATOM 11657 O WAT 495 72.597 35.362 91.127 1.00 0.00 O ATOM 11658 H1 WAT 495 72.113 35.806 91.823 1.00 0.00 H ATOM 11659 H2 WAT 495 71.973 34.732 90.766 1.00 0.00 H TER 11661 WAT 495 ATOM 11661 O WAT 496 121.569 100.279 84.551 1.00 0.00 O ATOM 11662 H1 WAT 496 122.375 100.120 84.061 1.00 0.00 H ATOM 11663 H2 WAT 496 121.499 101.233 84.595 1.00 0.00 H TER 11665 WAT 496 ATOM 11665 O WAT 497 67.515 124.991 88.258 1.00 0.00 O ATOM 11666 H1 WAT 497 67.496 124.239 87.665 1.00 0.00 H ATOM 11667 H2 WAT 497 67.862 125.707 87.725 1.00 0.00 H TER 11669 WAT 497 ATOM 11669 O WAT 498 110.925 24.339 69.246 1.00 0.00 O ATOM 11670 H1 WAT 498 110.206 23.737 69.438 1.00 0.00 H ATOM 11671 H2 WAT 498 111.225 24.635 70.106 1.00 0.00 H TER 11673 WAT 498 ATOM 11673 O WAT 499 104.540 35.017 21.481 1.00 0.00 O ATOM 11674 H1 WAT 499 104.990 35.458 22.202 1.00 0.00 H ATOM 11675 H2 WAT 499 105.244 34.641 20.953 1.00 0.00 H TER 11677 WAT 499 ATOM 11677 O WAT 500 139.509 6.940 10.801 1.00 0.00 O ATOM 11678 H1 WAT 500 139.212 7.650 10.232 1.00 0.00 H ATOM 11679 H2 WAT 500 139.827 6.268 10.199 1.00 0.00 H TER 11681 WAT 500 ATOM 11681 O WAT 501 14.779 110.437 5.889 1.00 0.00 O ATOM 11682 H1 WAT 501 14.238 109.663 5.734 1.00 0.00 H ATOM 11683 H2 WAT 501 14.374 110.866 6.642 1.00 0.00 H TER 11685 WAT 501 ATOM 11685 O WAT 502 22.500 96.503 152.198 1.00 0.00 O ATOM 11686 H1 WAT 502 22.950 97.300 152.481 1.00 0.00 H ATOM 11687 H2 WAT 502 22.014 96.768 151.417 1.00 0.00 H TER 11689 WAT 502 ATOM 11689 O WAT 503 42.557 25.729 68.478 1.00 0.00 O ATOM 11690 H1 WAT 503 42.990 25.072 67.933 1.00 0.00 H ATOM 11691 H2 WAT 503 43.139 25.837 69.230 1.00 0.00 H TER 11693 WAT 503 ATOM 11693 O WAT 504 83.466 40.135 63.793 1.00 0.00 O ATOM 11694 H1 WAT 504 83.699 40.916 63.291 1.00 0.00 H ATOM 11695 H2 WAT 504 83.892 40.259 64.641 1.00 0.00 H TER 11697 WAT 504 ATOM 11697 O WAT 505 129.886 43.614 111.930 1.00 0.00 O ATOM 11698 H1 WAT 505 129.801 43.504 112.877 1.00 0.00 H ATOM 11699 H2 WAT 505 129.331 42.928 111.559 1.00 0.00 H TER 11701 WAT 505 ATOM 11701 O WAT 506 20.924 36.828 18.372 1.00 0.00 O ATOM 11702 H1 WAT 506 20.592 36.701 19.261 1.00 0.00 H ATOM 11703 H2 WAT 506 20.186 37.205 17.893 1.00 0.00 H TER 11705 WAT 506 ATOM 11705 O WAT 507 25.431 23.610 93.330 1.00 0.00 O ATOM 11706 H1 WAT 507 25.002 24.452 93.478 1.00 0.00 H ATOM 11707 H2 WAT 507 25.607 23.272 94.209 1.00 0.00 H TER 11709 WAT 507 ATOM 11709 O WAT 508 129.479 93.933 7.345 1.00 0.00 O ATOM 11710 H1 WAT 508 129.750 94.596 7.981 1.00 0.00 H ATOM 11711 H2 WAT 508 128.931 93.330 7.846 1.00 0.00 H TER 11713 WAT 508 ATOM 11713 O WAT 509 94.694 29.020 117.898 1.00 0.00 O ATOM 11714 H1 WAT 509 95.477 29.465 118.221 1.00 0.00 H ATOM 11715 H2 WAT 509 94.725 28.154 118.303 1.00 0.00 H TER 11717 WAT 509 ATOM 11717 O WAT 510 131.450 68.078 132.708 1.00 0.00 O ATOM 11718 H1 WAT 510 132.120 68.034 133.391 1.00 0.00 H ATOM 11719 H2 WAT 510 131.807 68.688 132.062 1.00 0.00 H TER 11721 WAT 510 ATOM 11721 O WAT 511 126.478 56.983 1.673 1.00 0.00 O ATOM 11722 H1 WAT 511 126.021 56.398 2.278 1.00 0.00 H ATOM 11723 H2 WAT 511 127.324 57.146 2.091 1.00 0.00 H TER 11725 WAT 511 ATOM 11725 O WAT 512 112.986 117.907 83.861 1.00 0.00 O ATOM 11726 H1 WAT 512 113.264 117.320 83.158 1.00 0.00 H ATOM 11727 H2 WAT 512 113.596 118.643 83.815 1.00 0.00 H TER 11729 WAT 512 ATOM 11729 O WAT 513 85.825 7.321 130.558 1.00 0.00 O ATOM 11730 H1 WAT 513 85.471 7.285 129.670 1.00 0.00 H ATOM 11731 H2 WAT 513 86.724 7.003 130.471 1.00 0.00 H TER 11733 WAT 513 ATOM 11733 O WAT 514 111.813 125.847 158.435 1.00 0.00 O ATOM 11734 H1 WAT 514 111.638 126.626 157.907 1.00 0.00 H ATOM 11735 H2 WAT 514 111.493 125.120 157.902 1.00 0.00 H TER 11737 WAT 514 ATOM 11737 O WAT 515 3.280 80.873 130.287 1.00 0.00 O ATOM 11738 H1 WAT 515 3.461 80.360 131.075 1.00 0.00 H ATOM 11739 H2 WAT 515 4.134 80.976 129.867 1.00 0.00 H TER 11741 WAT 515 ATOM 11741 O WAT 516 76.849 9.453 73.805 1.00 0.00 O ATOM 11742 H1 WAT 516 77.641 9.467 74.343 1.00 0.00 H ATOM 11743 H2 WAT 516 77.168 9.314 72.913 1.00 0.00 H TER 11745 WAT 516 ATOM 11745 O WAT 517 110.992 133.300 62.442 1.00 0.00 O ATOM 11746 H1 WAT 517 110.816 134.240 62.496 1.00 0.00 H ATOM 11747 H2 WAT 517 111.867 133.242 62.060 1.00 0.00 H TER 11749 WAT 517 ATOM 11749 O WAT 518 7.959 110.011 10.874 1.00 0.00 O ATOM 11750 H1 WAT 518 7.950 109.525 11.698 1.00 0.00 H ATOM 11751 H2 WAT 518 7.099 109.844 10.489 1.00 0.00 H TER 11753 WAT 518 ATOM 11753 O WAT 519 100.539 24.666 136.868 1.00 0.00 O ATOM 11754 H1 WAT 519 101.041 25.475 136.969 1.00 0.00 H ATOM 11755 H2 WAT 519 100.000 24.814 136.091 1.00 0.00 H TER 11757 WAT 519 ATOM 11757 O WAT 520 21.145 86.966 93.658 1.00 0.00 O ATOM 11758 H1 WAT 520 20.625 87.168 94.436 1.00 0.00 H ATOM 11759 H2 WAT 520 20.516 86.995 92.936 1.00 0.00 H TER 11761 WAT 520 ATOM 11761 O WAT 521 124.430 80.042 99.987 1.00 0.00 O ATOM 11762 H1 WAT 521 125.094 79.763 99.356 1.00 0.00 H ATOM 11763 H2 WAT 521 123.680 79.473 99.812 1.00 0.00 H TER 11765 WAT 521 ATOM 11765 O WAT 522 61.047 74.410 59.914 1.00 0.00 O ATOM 11766 H1 WAT 522 60.168 74.645 60.212 1.00 0.00 H ATOM 11767 H2 WAT 522 61.158 74.893 59.095 1.00 0.00 H TER 11769 WAT 522 ATOM 11769 O WAT 523 95.276 11.165 130.207 1.00 0.00 O ATOM 11770 H1 WAT 523 94.435 11.328 129.780 1.00 0.00 H ATOM 11771 H2 WAT 523 95.321 11.819 130.905 1.00 0.00 H TER 11773 WAT 523 ATOM 11773 O WAT 524 101.378 41.922 144.499 1.00 0.00 O ATOM 11774 H1 WAT 524 101.786 41.362 145.159 1.00 0.00 H ATOM 11775 H2 WAT 524 102.079 42.105 143.873 1.00 0.00 H TER 11777 WAT 524 ATOM 11777 O WAT 525 99.705 5.838 157.628 1.00 0.00 O ATOM 11778 H1 WAT 525 99.130 5.127 157.347 1.00 0.00 H ATOM 11779 H2 WAT 525 99.174 6.629 157.532 1.00 0.00 H TER 11781 WAT 525 ATOM 11781 O WAT 526 1.858 8.085 144.545 1.00 0.00 O ATOM 11782 H1 WAT 526 1.296 8.490 145.205 1.00 0.00 H ATOM 11783 H2 WAT 526 1.656 8.556 143.736 1.00 0.00 H TER 11785 WAT 526 ATOM 11785 O WAT 527 74.541 45.781 78.727 1.00 0.00 O ATOM 11786 H1 WAT 527 75.104 45.145 78.284 1.00 0.00 H ATOM 11787 H2 WAT 527 73.782 45.870 78.151 1.00 0.00 H TER 11789 WAT 527 ATOM 11789 O WAT 528 12.101 68.394 146.457 1.00 0.00 O ATOM 11790 H1 WAT 528 12.674 67.860 147.007 1.00 0.00 H ATOM 11791 H2 WAT 528 11.215 68.133 146.709 1.00 0.00 H TER 11793 WAT 528 ATOM 11793 O WAT 529 138.768 43.929 116.601 1.00 0.00 O ATOM 11794 H1 WAT 529 138.757 43.120 116.090 1.00 0.00 H ATOM 11795 H2 WAT 529 138.872 43.639 117.507 1.00 0.00 H TER 11797 WAT 529 ATOM 11797 O WAT 530 2.679 87.351 121.268 1.00 0.00 O ATOM 11798 H1 WAT 530 1.902 87.810 120.949 1.00 0.00 H ATOM 11799 H2 WAT 530 3.256 87.298 120.507 1.00 0.00 H TER 11801 WAT 530 ATOM 11801 O WAT 531 49.088 29.504 138.575 1.00 0.00 O ATOM 11802 H1 WAT 531 49.054 28.892 139.310 1.00 0.00 H ATOM 11803 H2 WAT 531 48.174 29.739 138.417 1.00 0.00 H TER 11805 WAT 531 ATOM 11805 O WAT 532 46.735 21.007 74.100 1.00 0.00 O ATOM 11806 H1 WAT 532 47.560 20.744 73.694 1.00 0.00 H ATOM 11807 H2 WAT 532 46.994 21.421 74.923 1.00 0.00 H TER 11809 WAT 532 ATOM 11809 O WAT 533 74.172 132.440 121.439 1.00 0.00 O ATOM 11810 H1 WAT 533 75.001 131.967 121.357 1.00 0.00 H ATOM 11811 H2 WAT 533 74.372 133.327 121.139 1.00 0.00 H TER 11813 WAT 533 ATOM 11813 O WAT 534 30.500 33.322 144.216 1.00 0.00 O ATOM 11814 H1 WAT 534 29.655 33.650 143.908 1.00 0.00 H ATOM 11815 H2 WAT 534 31.146 33.795 143.692 1.00 0.00 H TER 11817 WAT 534 ATOM 11817 O WAT 535 45.550 81.688 114.108 1.00 0.00 O ATOM 11818 H1 WAT 535 45.183 81.493 114.970 1.00 0.00 H ATOM 11819 H2 WAT 535 45.923 80.858 113.813 1.00 0.00 H TER 11821 WAT 535 ATOM 11821 O WAT 536 58.649 107.215 116.020 1.00 0.00 O ATOM 11822 H1 WAT 536 58.021 106.504 115.893 1.00 0.00 H ATOM 11823 H2 WAT 536 59.155 106.953 116.790 1.00 0.00 H TER 11825 WAT 536 ATOM 11825 O WAT 537 63.898 140.985 127.128 1.00 0.00 O ATOM 11826 H1 WAT 537 63.085 140.499 126.986 1.00 0.00 H ATOM 11827 H2 WAT 537 64.547 140.311 127.331 1.00 0.00 H TER 11829 WAT 537 ATOM 11829 O WAT 538 84.697 52.186 13.117 1.00 0.00 O ATOM 11830 H1 WAT 538 83.772 52.409 13.224 1.00 0.00 H ATOM 11831 H2 WAT 538 85.159 52.804 13.684 1.00 0.00 H TER 11833 WAT 538 ATOM 11833 O WAT 539 12.473 140.717 13.681 1.00 0.00 O ATOM 11834 H1 WAT 539 11.609 140.719 13.269 1.00 0.00 H ATOM 11835 H2 WAT 539 12.406 140.061 14.375 1.00 0.00 H TER 11837 WAT 539 ATOM 11837 O WAT 540 54.456 92.603 114.385 1.00 0.00 O ATOM 11838 H1 WAT 540 54.007 93.426 114.193 1.00 0.00 H ATOM 11839 H2 WAT 540 54.422 92.528 115.339 1.00 0.00 H TER 11841 WAT 540 ATOM 11841 O WAT 541 0.472 4.323 118.814 1.00 0.00 O ATOM 11842 H1 WAT 541 -0.074 4.804 118.191 1.00 0.00 H ATOM 11843 H2 WAT 541 0.873 5.004 119.355 1.00 0.00 H TER 11845 WAT 541 ATOM 11845 O WAT 542 122.117 124.728 75.304 1.00 0.00 O ATOM 11846 H1 WAT 542 122.190 124.111 74.577 1.00 0.00 H ATOM 11847 H2 WAT 542 122.391 124.227 76.072 1.00 0.00 H TER 11849 WAT 542 ATOM 11849 O WAT 543 126.659 14.125 18.800 1.00 0.00 O ATOM 11850 H1 WAT 543 127.453 14.068 19.332 1.00 0.00 H ATOM 11851 H2 WAT 543 125.942 14.087 19.434 1.00 0.00 H TER 11853 WAT 543 ATOM 11853 O WAT 544 68.408 137.056 118.262 1.00 0.00 O ATOM 11854 H1 WAT 544 67.762 137.591 117.800 1.00 0.00 H ATOM 11855 H2 WAT 544 67.940 136.252 118.482 1.00 0.00 H TER 11857 WAT 544 ATOM 11857 O WAT 545 51.610 142.358 149.430 1.00 0.00 O ATOM 11858 H1 WAT 545 52.123 141.903 150.098 1.00 0.00 H ATOM 11859 H2 WAT 545 51.058 142.964 149.924 1.00 0.00 H TER 11861 WAT 545 ATOM 11861 O WAT 546 115.075 65.286 2.168 1.00 0.00 O ATOM 11862 H1 WAT 546 115.160 64.376 2.454 1.00 0.00 H ATOM 11863 H2 WAT 546 114.389 65.650 2.728 1.00 0.00 H TER 11865 WAT 546 ATOM 11865 O WAT 547 114.474 90.313 91.348 1.00 0.00 O ATOM 11866 H1 WAT 547 114.642 90.774 90.525 1.00 0.00 H ATOM 11867 H2 WAT 547 113.827 89.645 91.120 1.00 0.00 H TER 11869 WAT 547 ATOM 11869 O WAT 548 113.206 91.775 123.859 1.00 0.00 O ATOM 11870 H1 WAT 548 113.072 92.659 123.519 1.00 0.00 H ATOM 11871 H2 WAT 548 114.067 91.806 124.276 1.00 0.00 H TER 11873 WAT 548 ATOM 11873 O WAT 549 64.188 81.573 4.789 1.00 0.00 O ATOM 11874 H1 WAT 549 64.358 81.264 5.678 1.00 0.00 H ATOM 11875 H2 WAT 549 65.053 81.787 4.439 1.00 0.00 H TER 11877 WAT 549 ATOM 11877 O WAT 550 103.753 113.871 60.964 1.00 0.00 O ATOM 11878 H1 WAT 550 103.975 114.757 60.678 1.00 0.00 H ATOM 11879 H2 WAT 550 104.477 113.615 61.535 1.00 0.00 H TER 11881 WAT 550 ATOM 11881 O WAT 551 44.184 28.563 86.647 1.00 0.00 O ATOM 11882 H1 WAT 551 44.762 28.600 85.885 1.00 0.00 H ATOM 11883 H2 WAT 551 43.496 29.201 86.457 1.00 0.00 H TER 11885 WAT 551 ATOM 11885 O WAT 552 95.766 35.537 50.300 1.00 0.00 O ATOM 11886 H1 WAT 552 96.095 36.353 50.676 1.00 0.00 H ATOM 11887 H2 WAT 552 94.817 35.585 50.418 1.00 0.00 H TER 11889 WAT 552 ATOM 11889 O WAT 553 42.222 6.314 81.199 1.00 0.00 O ATOM 11890 H1 WAT 553 42.354 7.044 80.594 1.00 0.00 H ATOM 11891 H2 WAT 553 42.514 5.543 80.713 1.00 0.00 H TER 11893 WAT 553 ATOM 11893 O WAT 554 60.971 88.847 122.165 1.00 0.00 O ATOM 11894 H1 WAT 554 61.453 88.532 121.401 1.00 0.00 H ATOM 11895 H2 WAT 554 61.553 89.492 122.566 1.00 0.00 H TER 11897 WAT 554 ATOM 11897 O WAT 555 131.438 101.176 153.883 1.00 0.00 O ATOM 11898 H1 WAT 555 131.675 100.389 153.393 1.00 0.00 H ATOM 11899 H2 WAT 555 132.196 101.349 154.441 1.00 0.00 H TER 11901 WAT 555 ATOM 11901 O WAT 556 30.587 135.868 78.104 1.00 0.00 O ATOM 11902 H1 WAT 556 30.298 135.200 77.482 1.00 0.00 H ATOM 11903 H2 WAT 556 31.169 135.400 78.704 1.00 0.00 H TER 11905 WAT 556 ATOM 11905 O WAT 557 122.723 35.095 75.037 1.00 0.00 O ATOM 11906 H1 WAT 557 123.036 34.384 74.478 1.00 0.00 H ATOM 11907 H2 WAT 557 121.774 34.976 75.068 1.00 0.00 H TER 11909 WAT 557 ATOM 11909 O WAT 558 89.489 9.340 91.992 1.00 0.00 O ATOM 11910 H1 WAT 558 88.563 9.117 91.897 1.00 0.00 H ATOM 11911 H2 WAT 558 89.505 10.015 92.670 1.00 0.00 H TER 11913 WAT 558 ATOM 11913 O WAT 559 114.876 50.440 139.376 1.00 0.00 O ATOM 11914 H1 WAT 559 115.726 50.314 139.798 1.00 0.00 H ATOM 11915 H2 WAT 559 114.916 49.898 138.589 1.00 0.00 H TER 11917 WAT 559 ATOM 11917 O WAT 560 87.432 120.190 132.083 1.00 0.00 O ATOM 11918 H1 WAT 560 87.965 120.731 131.501 1.00 0.00 H ATOM 11919 H2 WAT 560 86.817 119.745 131.501 1.00 0.00 H TER 11921 WAT 560 ATOM 11921 O WAT 561 120.527 62.153 124.326 1.00 0.00 O ATOM 11922 H1 WAT 561 119.638 61.895 124.086 1.00 0.00 H ATOM 11923 H2 WAT 561 120.430 62.590 125.173 1.00 0.00 H TER 11925 WAT 561 ATOM 11925 O WAT 562 14.128 74.195 81.056 1.00 0.00 O ATOM 11926 H1 WAT 562 14.196 75.146 80.976 1.00 0.00 H ATOM 11927 H2 WAT 562 14.621 73.986 81.849 1.00 0.00 H TER 11929 WAT 562 ATOM 11929 O WAT 563 76.730 142.625 75.236 1.00 0.00 O ATOM 11930 H1 WAT 563 75.838 142.965 75.310 1.00 0.00 H ATOM 11931 H2 WAT 563 77.191 143.276 74.706 1.00 0.00 H TER 11933 WAT 563 ATOM 11933 O WAT 564 62.931 84.932 110.460 1.00 0.00 O ATOM 11934 H1 WAT 564 63.603 85.403 109.966 1.00 0.00 H ATOM 11935 H2 WAT 564 62.922 84.055 110.077 1.00 0.00 H TER 11937 WAT 564 ATOM 11937 O WAT 565 83.394 104.407 90.890 1.00 0.00 O ATOM 11938 H1 WAT 565 82.520 104.759 91.057 1.00 0.00 H ATOM 11939 H2 WAT 565 83.481 103.680 91.507 1.00 0.00 H TER 11941 WAT 565 ATOM 11941 O WAT 566 73.171 89.435 108.011 1.00 0.00 O ATOM 11942 H1 WAT 566 73.058 89.006 108.859 1.00 0.00 H ATOM 11943 H2 WAT 566 73.534 90.295 108.224 1.00 0.00 H TER 11945 WAT 566 ATOM 11945 O WAT 567 131.041 5.942 156.602 1.00 0.00 O ATOM 11946 H1 WAT 567 130.435 5.430 157.138 1.00 0.00 H ATOM 11947 H2 WAT 567 131.868 5.913 157.083 1.00 0.00 H TER 11949 WAT 567 ATOM 11949 O WAT 568 38.190 138.733 81.095 1.00 0.00 O ATOM 11950 H1 WAT 568 38.583 138.152 80.443 1.00 0.00 H ATOM 11951 H2 WAT 568 37.746 139.406 80.579 1.00 0.00 H TER 11953 WAT 568 ATOM 11953 O WAT 569 29.803 12.607 151.953 1.00 0.00 O ATOM 11954 H1 WAT 569 28.920 12.972 151.911 1.00 0.00 H ATOM 11955 H2 WAT 569 29.835 12.156 152.797 1.00 0.00 H TER 11957 WAT 569 ATOM 11957 O WAT 570 8.056 23.101 133.622 1.00 0.00 O ATOM 11958 H1 WAT 570 8.753 22.559 133.252 1.00 0.00 H ATOM 11959 H2 WAT 570 8.283 23.181 134.549 1.00 0.00 H TER 11961 WAT 570 ATOM 11961 O WAT 571 69.200 1.842 65.643 1.00 0.00 O ATOM 11962 H1 WAT 571 68.424 1.657 66.172 1.00 0.00 H ATOM 11963 H2 WAT 571 69.785 2.318 66.233 1.00 0.00 H TER 11965 WAT 571 ATOM 11965 O WAT 572 104.227 68.245 117.258 1.00 0.00 O ATOM 11966 H1 WAT 572 104.448 67.504 117.823 1.00 0.00 H ATOM 11967 H2 WAT 572 104.915 68.888 117.427 1.00 0.00 H TER 11969 WAT 572 ATOM 11969 O WAT 573 97.266 132.834 134.895 1.00 0.00 O ATOM 11970 H1 WAT 573 96.643 133.341 134.375 1.00 0.00 H ATOM 11971 H2 WAT 573 97.739 133.489 135.408 1.00 0.00 H TER 11973 WAT 573 ATOM 11973 O WAT 574 26.103 96.351 147.212 1.00 0.00 O ATOM 11974 H1 WAT 574 25.700 95.613 146.755 1.00 0.00 H ATOM 11975 H2 WAT 574 27.025 96.107 147.296 1.00 0.00 H TER 11977 WAT 574 ATOM 11977 O WAT 575 140.638 121.101 61.471 1.00 0.00 O ATOM 11978 H1 WAT 575 140.425 120.723 60.617 1.00 0.00 H ATOM 11979 H2 WAT 575 140.993 120.368 61.974 1.00 0.00 H TER 11981 WAT 575 ATOM 11981 O WAT 576 43.902 81.925 128.907 1.00 0.00 O ATOM 11982 H1 WAT 576 44.499 82.256 128.236 1.00 0.00 H ATOM 11983 H2 WAT 576 43.102 81.707 128.430 1.00 0.00 H TER 11985 WAT 576 ATOM 11985 O WAT 577 111.682 88.628 7.762 1.00 0.00 O ATOM 11986 H1 WAT 577 112.269 89.381 7.834 1.00 0.00 H ATOM 11987 H2 WAT 577 111.612 88.468 6.820 1.00 0.00 H TER 11989 WAT 577 ATOM 11989 O WAT 578 34.810 21.208 115.128 1.00 0.00 O ATOM 11990 H1 WAT 578 34.807 20.355 115.563 1.00 0.00 H ATOM 11991 H2 WAT 578 34.038 21.656 115.475 1.00 0.00 H TER 11993 WAT 578 ATOM 11993 O WAT 579 99.203 92.870 104.971 1.00 0.00 O ATOM 11994 H1 WAT 579 99.697 92.468 104.256 1.00 0.00 H ATOM 11995 H2 WAT 579 98.378 93.142 104.569 1.00 0.00 H TER 11997 WAT 579 ATOM 11997 O WAT 580 4.182 2.023 118.830 1.00 0.00 O ATOM 11998 H1 WAT 580 3.787 2.853 118.561 1.00 0.00 H ATOM 11999 H2 WAT 580 5.124 2.187 118.804 1.00 0.00 H TER 12001 WAT 580 ATOM 12001 O WAT 581 20.014 100.322 90.463 1.00 0.00 O ATOM 12002 H1 WAT 581 19.390 99.683 90.808 1.00 0.00 H ATOM 12003 H2 WAT 581 20.436 100.687 91.241 1.00 0.00 H TER 12005 WAT 581 ATOM 12005 O WAT 582 21.933 19.940 17.643 1.00 0.00 O ATOM 12006 H1 WAT 582 21.809 20.753 18.133 1.00 0.00 H ATOM 12007 H2 WAT 582 21.053 19.699 17.354 1.00 0.00 H TER 12009 WAT 582 ATOM 12009 O WAT 583 5.286 18.551 132.574 1.00 0.00 O ATOM 12010 H1 WAT 583 5.824 17.842 132.222 1.00 0.00 H ATOM 12011 H2 WAT 583 5.776 18.869 133.332 1.00 0.00 H TER 12013 WAT 583 ATOM 12013 O WAT 584 20.565 124.956 61.482 1.00 0.00 O ATOM 12014 H1 WAT 584 19.918 125.175 60.811 1.00 0.00 H ATOM 12015 H2 WAT 584 20.043 124.726 62.251 1.00 0.00 H TER 12017 WAT 584 ATOM 12017 O WAT 585 55.532 38.943 20.765 1.00 0.00 O ATOM 12018 H1 WAT 585 55.502 38.961 19.808 1.00 0.00 H ATOM 12019 H2 WAT 585 55.362 38.029 20.993 1.00 0.00 H TER 12021 WAT 585 ATOM 12021 O WAT 586 19.550 113.602 114.385 1.00 0.00 O ATOM 12022 H1 WAT 586 20.113 112.951 114.804 1.00 0.00 H ATOM 12023 H2 WAT 586 19.193 114.113 115.111 1.00 0.00 H TER 12025 WAT 586 ATOM 12025 O WAT 587 98.407 24.069 51.360 1.00 0.00 O ATOM 12026 H1 WAT 587 99.008 23.609 51.945 1.00 0.00 H ATOM 12027 H2 WAT 587 98.847 24.897 51.168 1.00 0.00 H TER 12029 WAT 587 ATOM 12029 O WAT 588 70.786 43.666 117.456 1.00 0.00 O ATOM 12030 H1 WAT 588 71.569 43.884 116.950 1.00 0.00 H ATOM 12031 H2 WAT 588 71.028 42.880 117.945 1.00 0.00 H TER 12033 WAT 588 ATOM 12033 O WAT 589 85.810 120.415 93.600 1.00 0.00 O ATOM 12034 H1 WAT 589 85.014 120.944 93.628 1.00 0.00 H ATOM 12035 H2 WAT 589 86.411 120.914 93.047 1.00 0.00 H TER 12037 WAT 589 ATOM 12037 O WAT 590 133.209 101.961 79.866 1.00 0.00 O ATOM 12038 H1 WAT 590 134.080 102.309 79.674 1.00 0.00 H ATOM 12039 H2 WAT 590 133.329 101.438 80.658 1.00 0.00 H TER 12041 WAT 590 ATOM 12041 O WAT 591 34.791 43.199 64.360 1.00 0.00 O ATOM 12042 H1 WAT 591 35.307 43.972 64.587 1.00 0.00 H ATOM 12043 H2 WAT 591 33.943 43.548 64.085 1.00 0.00 H TER 12045 WAT 591 ATOM 12045 O WAT 592 45.556 57.483 52.796 1.00 0.00 O ATOM 12046 H1 WAT 592 46.421 57.893 52.785 1.00 0.00 H ATOM 12047 H2 WAT 592 44.979 58.130 52.392 1.00 0.00 H TER 12049 WAT 592 ATOM 12049 O WAT 593 25.248 131.189 5.747 1.00 0.00 O ATOM 12050 H1 WAT 593 25.361 130.558 6.458 1.00 0.00 H ATOM 12051 H2 WAT 593 24.417 130.944 5.340 1.00 0.00 H TER 12053 WAT 593 ATOM 12053 O WAT 594 117.469 43.934 83.022 1.00 0.00 O ATOM 12054 H1 WAT 594 116.870 43.770 82.294 1.00 0.00 H ATOM 12055 H2 WAT 594 118.339 43.931 82.623 1.00 0.00 H TER 12057 WAT 594 ATOM 12057 O WAT 595 112.716 73.218 130.232 1.00 0.00 O ATOM 12058 H1 WAT 595 112.481 73.547 131.100 1.00 0.00 H ATOM 12059 H2 WAT 595 112.767 72.269 130.342 1.00 0.00 H TER 12061 WAT 595 ATOM 12061 O WAT 596 139.642 105.852 134.850 1.00 0.00 O ATOM 12062 H1 WAT 596 139.098 106.232 135.540 1.00 0.00 H ATOM 12063 H2 WAT 596 140.488 105.696 135.269 1.00 0.00 H TER 12065 WAT 596 ATOM 12065 O WAT 597 15.674 8.163 121.546 1.00 0.00 O ATOM 12066 H1 WAT 597 15.863 8.730 122.294 1.00 0.00 H ATOM 12067 H2 WAT 597 14.793 7.829 121.715 1.00 0.00 H TER 12069 WAT 597 ATOM 12069 O WAT 598 91.793 57.891 121.131 1.00 0.00 O ATOM 12070 H1 WAT 598 91.471 56.989 121.146 1.00 0.00 H ATOM 12071 H2 WAT 598 92.062 58.034 120.224 1.00 0.00 H TER 12073 WAT 598 ATOM 12073 O WAT 599 28.721 111.752 117.961 1.00 0.00 O ATOM 12074 H1 WAT 599 28.206 111.003 117.663 1.00 0.00 H ATOM 12075 H2 WAT 599 28.630 112.399 117.261 1.00 0.00 H TER 12077 WAT 599 ATOM 12077 O WAT 600 63.783 65.509 110.006 1.00 0.00 O ATOM 12078 H1 WAT 600 63.761 65.647 110.953 1.00 0.00 H ATOM 12079 H2 WAT 600 63.146 64.812 109.851 1.00 0.00 H TER 12081 WAT 600 ATOM 12081 O WAT 601 61.553 72.059 9.176 1.00 0.00 O ATOM 12082 H1 WAT 601 62.146 71.381 8.851 1.00 0.00 H ATOM 12083 H2 WAT 601 61.650 72.026 10.128 1.00 0.00 H TER 12085 WAT 601 ATOM 12085 O WAT 602 136.425 116.081 26.463 1.00 0.00 O ATOM 12086 H1 WAT 602 135.483 116.124 26.300 1.00 0.00 H ATOM 12087 H2 WAT 602 136.526 115.377 27.103 1.00 0.00 H TER 12089 WAT 602 ATOM 12089 O WAT 603 51.922 54.287 5.705 1.00 0.00 O ATOM 12090 H1 WAT 603 51.407 53.583 5.311 1.00 0.00 H ATOM 12091 H2 WAT 603 52.398 54.675 4.971 1.00 0.00 H TER 12093 WAT 603 ATOM 12093 O WAT 604 1.603 117.916 58.803 1.00 0.00 O ATOM 12094 H1 WAT 604 2.160 117.648 58.072 1.00 0.00 H ATOM 12095 H2 WAT 604 2.075 118.642 59.211 1.00 0.00 H TER 12097 WAT 604 ATOM 12097 O WAT 605 5.753 112.241 94.495 1.00 0.00 O ATOM 12098 H1 WAT 605 6.431 112.435 95.142 1.00 0.00 H ATOM 12099 H2 WAT 605 6.230 112.140 93.671 1.00 0.00 H TER 12101 WAT 605 ATOM 12101 O WAT 606 135.086 4.399 117.897 1.00 0.00 O ATOM 12102 H1 WAT 606 135.569 4.946 118.516 1.00 0.00 H ATOM 12103 H2 WAT 606 134.400 3.989 118.425 1.00 0.00 H TER 12105 WAT 606 ATOM 12105 O WAT 607 7.536 50.220 78.233 1.00 0.00 O ATOM 12106 H1 WAT 607 7.969 51.069 78.318 1.00 0.00 H ATOM 12107 H2 WAT 607 7.550 50.036 77.294 1.00 0.00 H TER 12109 WAT 607 ATOM 12109 O WAT 608 30.709 128.579 87.081 1.00 0.00 O ATOM 12110 H1 WAT 608 30.183 129.166 87.625 1.00 0.00 H ATOM 12111 H2 WAT 608 31.355 128.210 87.683 1.00 0.00 H TER 12113 WAT 608 ATOM 12113 O WAT 609 131.419 60.665 100.909 1.00 0.00 O ATOM 12114 H1 WAT 609 132.073 60.252 100.345 1.00 0.00 H ATOM 12115 H2 WAT 609 131.914 61.299 101.426 1.00 0.00 H TER 12117 WAT 609 ATOM 12117 O WAT 610 73.337 0.061 111.030 1.00 0.00 O ATOM 12118 H1 WAT 610 73.632 -0.779 111.381 1.00 0.00 H ATOM 12119 H2 WAT 610 73.901 0.709 111.452 1.00 0.00 H TER 12121 WAT 610 ATOM 12121 O WAT 611 103.408 56.163 98.491 1.00 0.00 O ATOM 12122 H1 WAT 611 104.279 56.094 98.101 1.00 0.00 H ATOM 12123 H2 WAT 611 103.213 55.279 98.801 1.00 0.00 H TER 12125 WAT 611 ATOM 12125 O WAT 612 109.979 112.823 67.380 1.00 0.00 O ATOM 12126 H1 WAT 612 109.494 113.591 67.680 1.00 0.00 H ATOM 12127 H2 WAT 612 109.340 112.316 66.879 1.00 0.00 H TER 12129 WAT 612 ATOM 12129 O WAT 613 99.275 89.487 104.145 1.00 0.00 O ATOM 12130 H1 WAT 613 99.822 90.269 104.208 1.00 0.00 H ATOM 12131 H2 WAT 613 99.314 89.240 103.221 1.00 0.00 H TER 12133 WAT 613 ATOM 12133 O WAT 614 128.525 55.930 6.007 1.00 0.00 O ATOM 12134 H1 WAT 614 128.777 55.150 6.502 1.00 0.00 H ATOM 12135 H2 WAT 614 128.628 56.651 6.628 1.00 0.00 H TER 12137 WAT 614 ATOM 12137 O WAT 615 91.433 88.297 78.164 1.00 0.00 O ATOM 12138 H1 WAT 615 91.297 88.396 79.106 1.00 0.00 H ATOM 12139 H2 WAT 615 90.582 88.502 77.776 1.00 0.00 H TER 12141 WAT 615 ATOM 12141 O WAT 616 100.882 115.604 109.355 1.00 0.00 O ATOM 12142 H1 WAT 616 101.324 116.429 109.558 1.00 0.00 H ATOM 12143 H2 WAT 616 101.045 115.051 110.120 1.00 0.00 H TER 12145 WAT 616 ATOM 12145 O WAT 617 123.717 1.445 85.562 1.00 0.00 O ATOM 12146 H1 WAT 617 124.307 1.862 84.935 1.00 0.00 H ATOM 12147 H2 WAT 617 124.186 1.483 86.395 1.00 0.00 H TER 12149 WAT 617 ATOM 12149 O WAT 618 23.389 86.481 125.967 1.00 0.00 O ATOM 12150 H1 WAT 618 24.298 86.714 126.155 1.00 0.00 H ATOM 12151 H2 WAT 618 23.229 86.829 125.089 1.00 0.00 H TER 12153 WAT 618 ATOM 12153 O WAT 619 44.042 61.830 97.767 1.00 0.00 O ATOM 12154 H1 WAT 619 44.274 60.913 97.625 1.00 0.00 H ATOM 12155 H2 WAT 619 44.879 62.267 97.926 1.00 0.00 H TER 12157 WAT 619 ATOM 12157 O WAT 620 47.587 72.756 144.131 1.00 0.00 O ATOM 12158 H1 WAT 620 46.972 72.302 144.707 1.00 0.00 H ATOM 12159 H2 WAT 620 47.299 73.669 144.147 1.00 0.00 H TER 12161 WAT 620 ATOM 12161 O WAT 621 65.370 35.822 127.091 1.00 0.00 O ATOM 12162 H1 WAT 621 64.653 36.437 127.245 1.00 0.00 H ATOM 12163 H2 WAT 621 66.163 36.333 127.253 1.00 0.00 H TER 12165 WAT 621 ATOM 12165 O WAT 622 124.298 81.073 77.628 1.00 0.00 O ATOM 12166 H1 WAT 622 125.133 81.148 77.166 1.00 0.00 H ATOM 12167 H2 WAT 622 123.636 81.204 76.949 1.00 0.00 H TER 12169 WAT 622 ATOM 12169 O WAT 623 75.112 3.153 141.330 1.00 0.00 O ATOM 12170 H1 WAT 623 75.436 4.045 141.206 1.00 0.00 H ATOM 12171 H2 WAT 623 74.294 3.261 141.816 1.00 0.00 H TER 12173 WAT 623 ATOM 12173 O WAT 624 89.653 25.960 135.146 1.00 0.00 O ATOM 12174 H1 WAT 624 90.302 25.801 135.832 1.00 0.00 H ATOM 12175 H2 WAT 624 89.040 25.228 135.222 1.00 0.00 H TER 12177 WAT 624 ATOM 12177 O WAT 625 17.320 9.540 150.712 1.00 0.00 O ATOM 12178 H1 WAT 625 16.377 9.688 150.777 1.00 0.00 H ATOM 12179 H2 WAT 625 17.709 10.240 151.237 1.00 0.00 H TER 12181 WAT 625 ATOM 12181 O WAT 626 12.075 5.964 66.093 1.00 0.00 O ATOM 12182 H1 WAT 626 12.821 6.554 65.984 1.00 0.00 H ATOM 12183 H2 WAT 626 11.331 6.544 66.254 1.00 0.00 H TER 12185 WAT 626 ATOM 12185 O WAT 627 15.911 62.555 132.506 1.00 0.00 O ATOM 12186 H1 WAT 627 16.557 62.651 133.206 1.00 0.00 H ATOM 12187 H2 WAT 627 15.077 62.446 132.964 1.00 0.00 H TER 12189 WAT 627 ATOM 12189 O WAT 628 73.253 18.059 157.264 1.00 0.00 O ATOM 12190 H1 WAT 628 74.103 18.244 156.865 1.00 0.00 H ATOM 12191 H2 WAT 628 73.416 18.102 158.206 1.00 0.00 H TER 12193 WAT 628 ATOM 12193 O WAT 629 51.142 101.229 18.313 1.00 0.00 O ATOM 12194 H1 WAT 629 51.990 101.391 17.901 1.00 0.00 H ATOM 12195 H2 WAT 629 51.078 101.895 18.998 1.00 0.00 H TER 12197 WAT 629 ATOM 12197 O WAT 630 144.661 41.844 151.523 1.00 0.00 O ATOM 12198 H1 WAT 630 144.212 41.323 150.857 1.00 0.00 H ATOM 12199 H2 WAT 630 144.997 42.603 151.047 1.00 0.00 H TER 12201 WAT 630 ATOM 12201 O WAT 631 89.688 9.901 137.235 1.00 0.00 O ATOM 12202 H1 WAT 631 89.911 9.190 137.836 1.00 0.00 H ATOM 12203 H2 WAT 631 89.551 10.660 137.801 1.00 0.00 H TER 12205 WAT 631 ATOM 12205 O WAT 632 23.201 55.494 91.230 1.00 0.00 O ATOM 12206 H1 WAT 632 23.100 55.965 90.403 1.00 0.00 H ATOM 12207 H2 WAT 632 24.001 55.851 91.614 1.00 0.00 H TER 12209 WAT 632 ATOM 12209 O WAT 633 132.733 51.831 143.469 1.00 0.00 O ATOM 12210 H1 WAT 633 131.977 51.255 143.586 1.00 0.00 H ATOM 12211 H2 WAT 633 133.468 51.236 143.321 1.00 0.00 H TER 12213 WAT 633 ATOM 12213 O WAT 634 63.090 2.528 58.886 1.00 0.00 O ATOM 12214 H1 WAT 634 62.302 1.992 58.976 1.00 0.00 H ATOM 12215 H2 WAT 634 63.491 2.512 59.756 1.00 0.00 H TER 12217 WAT 634 ATOM 12217 O WAT 635 53.615 136.554 157.171 1.00 0.00 O ATOM 12218 H1 WAT 635 54.166 137.323 157.321 1.00 0.00 H ATOM 12219 H2 WAT 635 52.930 136.863 156.577 1.00 0.00 H TER 12221 WAT 635 ATOM 12221 O WAT 636 53.892 38.259 80.005 1.00 0.00 O ATOM 12222 H1 WAT 636 53.684 38.864 79.293 1.00 0.00 H ATOM 12223 H2 WAT 636 54.283 37.502 79.569 1.00 0.00 H TER 12225 WAT 636 ATOM 12225 O WAT 637 128.167 131.264 137.205 1.00 0.00 O ATOM 12226 H1 WAT 637 127.778 132.080 137.519 1.00 0.00 H ATOM 12227 H2 WAT 637 128.623 131.510 136.400 1.00 0.00 H TER 12229 WAT 637 ATOM 12229 O WAT 638 103.934 77.892 124.091 1.00 0.00 O ATOM 12230 H1 WAT 638 103.706 78.362 123.289 1.00 0.00 H ATOM 12231 H2 WAT 638 103.578 77.012 123.963 1.00 0.00 H TER 12233 WAT 638 ATOM 12233 O WAT 639 136.938 102.561 150.034 1.00 0.00 O ATOM 12234 H1 WAT 639 137.809 102.880 150.272 1.00 0.00 H ATOM 12235 H2 WAT 639 136.664 103.128 149.313 1.00 0.00 H TER 12237 WAT 639 ATOM 12237 O WAT 640 95.760 8.018 124.954 1.00 0.00 O ATOM 12238 H1 WAT 640 95.017 8.028 125.558 1.00 0.00 H ATOM 12239 H2 WAT 640 96.090 8.917 124.965 1.00 0.00 H TER 12241 WAT 640 ATOM 12241 O WAT 641 92.522 23.096 120.930 1.00 0.00 O ATOM 12242 H1 WAT 641 91.983 22.947 121.707 1.00 0.00 H ATOM 12243 H2 WAT 641 92.162 23.891 120.538 1.00 0.00 H TER 12245 WAT 641 ATOM 12245 O WAT 642 68.118 115.211 75.422 1.00 0.00 O ATOM 12246 H1 WAT 642 68.493 114.899 76.246 1.00 0.00 H ATOM 12247 H2 WAT 642 67.840 114.414 74.969 1.00 0.00 H TER 12249 WAT 642 ATOM 12249 O WAT 643 81.592 62.320 74.646 1.00 0.00 O ATOM 12250 H1 WAT 643 82.487 62.659 74.651 1.00 0.00 H ATOM 12251 H2 WAT 643 81.151 62.819 73.958 1.00 0.00 H TER 12253 WAT 643 ATOM 12253 O WAT 644 3.460 40.767 121.319 1.00 0.00 O ATOM 12254 H1 WAT 644 4.075 41.253 120.769 1.00 0.00 H ATOM 12255 H2 WAT 644 2.945 41.444 121.758 1.00 0.00 H TER 12257 WAT 644 ATOM 12257 O WAT 645 30.793 82.761 107.135 1.00 0.00 O ATOM 12258 H1 WAT 645 30.812 83.557 106.603 1.00 0.00 H ATOM 12259 H2 WAT 645 31.226 82.101 106.594 1.00 0.00 H TER 12261 WAT 645 ATOM 12261 O WAT 646 55.470 21.785 147.173 1.00 0.00 O ATOM 12262 H1 WAT 646 55.577 21.322 148.004 1.00 0.00 H ATOM 12263 H2 WAT 646 55.514 21.098 146.508 1.00 0.00 H TER 12265 WAT 646 ATOM 12265 O WAT 647 51.679 68.460 90.949 1.00 0.00 O ATOM 12266 H1 WAT 647 51.437 68.132 90.082 1.00 0.00 H ATOM 12267 H2 WAT 647 52.128 67.725 91.366 1.00 0.00 H TER 12269 WAT 647 ATOM 12269 O WAT 648 127.914 31.561 77.381 1.00 0.00 O ATOM 12270 H1 WAT 648 127.040 31.757 77.719 1.00 0.00 H ATOM 12271 H2 WAT 648 128.125 30.702 77.747 1.00 0.00 H TER 12273 WAT 648 ATOM 12273 O WAT 649 83.294 66.521 12.539 1.00 0.00 O ATOM 12274 H1 WAT 649 82.527 67.091 12.491 1.00 0.00 H ATOM 12275 H2 WAT 649 83.902 66.984 13.116 1.00 0.00 H TER 12277 WAT 649 ATOM 12277 O WAT 650 46.262 103.288 93.855 1.00 0.00 O ATOM 12278 H1 WAT 650 46.645 103.388 94.727 1.00 0.00 H ATOM 12279 H2 WAT 650 46.975 103.506 93.254 1.00 0.00 H TER 12281 WAT 650 ATOM 12281 O WAT 651 72.413 91.585 105.718 1.00 0.00 O ATOM 12282 H1 WAT 651 73.277 91.686 106.118 1.00 0.00 H ATOM 12283 H2 WAT 651 72.465 92.089 104.906 1.00 0.00 H TER 12285 WAT 651 ATOM 12285 O WAT 652 101.790 110.907 7.311 1.00 0.00 O ATOM 12286 H1 WAT 652 101.697 111.658 7.897 1.00 0.00 H ATOM 12287 H2 WAT 652 102.233 111.259 6.539 1.00 0.00 H TER 12289 WAT 652 ATOM 12289 O WAT 653 82.422 79.427 61.697 1.00 0.00 O ATOM 12290 H1 WAT 653 82.470 79.971 62.483 1.00 0.00 H ATOM 12291 H2 WAT 653 82.144 80.029 61.006 1.00 0.00 H TER 12293 WAT 653 ATOM 12293 O WAT 654 51.242 138.092 140.063 1.00 0.00 O ATOM 12294 H1 WAT 654 51.602 138.607 139.342 1.00 0.00 H ATOM 12295 H2 WAT 654 50.765 137.381 139.635 1.00 0.00 H TER 12297 WAT 654 ATOM 12297 O WAT 655 127.499 55.169 131.601 1.00 0.00 O ATOM 12298 H1 WAT 655 126.973 54.852 130.867 1.00 0.00 H ATOM 12299 H2 WAT 655 127.871 55.994 131.290 1.00 0.00 H TER 12301 WAT 655 ATOM 12301 O WAT 656 64.289 110.114 102.764 1.00 0.00 O ATOM 12302 H1 WAT 656 64.380 110.966 103.191 1.00 0.00 H ATOM 12303 H2 WAT 656 65.132 109.684 102.907 1.00 0.00 H TER 12305 WAT 656 ATOM 12305 O WAT 657 7.139 21.344 155.708 1.00 0.00 O ATOM 12306 H1 WAT 657 6.797 22.205 155.950 1.00 0.00 H ATOM 12307 H2 WAT 657 6.443 20.948 155.184 1.00 0.00 H TER 12309 WAT 657 ATOM 12309 O WAT 658 110.529 66.931 156.977 1.00 0.00 O ATOM 12310 H1 WAT 658 110.234 66.059 157.239 1.00 0.00 H ATOM 12311 H2 WAT 658 111.200 66.768 156.315 1.00 0.00 H TER 12313 WAT 658 ATOM 12313 O WAT 659 103.498 0.017 108.753 1.00 0.00 O ATOM 12314 H1 WAT 659 103.427 0.952 108.946 1.00 0.00 H ATOM 12315 H2 WAT 659 104.187 -0.297 109.338 1.00 0.00 H TER 12317 WAT 659 ATOM 12317 O WAT 660 42.938 32.633 120.018 1.00 0.00 O ATOM 12318 H1 WAT 660 43.171 32.627 119.089 1.00 0.00 H ATOM 12319 H2 WAT 660 42.832 33.560 120.232 1.00 0.00 H TER 12321 WAT 660 ATOM 12321 O WAT 661 99.871 76.596 23.875 1.00 0.00 O ATOM 12322 H1 WAT 661 99.053 76.271 24.252 1.00 0.00 H ATOM 12323 H2 WAT 661 100.225 75.849 23.391 1.00 0.00 H TER 12325 WAT 661 ATOM 12325 O WAT 662 63.420 37.682 8.703 1.00 0.00 O ATOM 12326 H1 WAT 662 63.533 38.480 8.187 1.00 0.00 H ATOM 12327 H2 WAT 662 63.814 37.886 9.551 1.00 0.00 H TER 12329 WAT 662 ATOM 12329 O WAT 663 37.224 105.861 131.751 1.00 0.00 O ATOM 12330 H1 WAT 663 36.621 105.318 131.242 1.00 0.00 H ATOM 12331 H2 WAT 663 36.773 106.002 132.583 1.00 0.00 H TER 12333 WAT 663 ATOM 12333 O WAT 664 60.903 10.056 0.755 1.00 0.00 O ATOM 12334 H1 WAT 664 60.281 10.590 0.262 1.00 0.00 H ATOM 12335 H2 WAT 664 60.710 9.157 0.490 1.00 0.00 H TER 12337 WAT 664 ATOM 12337 O WAT 665 124.669 10.646 128.060 1.00 0.00 O ATOM 12338 H1 WAT 665 125.384 10.582 128.693 1.00 0.00 H ATOM 12339 H2 WAT 665 123.913 10.274 128.514 1.00 0.00 H TER 12341 WAT 665 ATOM 12341 O WAT 666 43.538 40.895 87.382 1.00 0.00 O ATOM 12342 H1 WAT 666 42.631 40.637 87.549 1.00 0.00 H ATOM 12343 H2 WAT 666 43.984 40.077 87.166 1.00 0.00 H TER 12345 WAT 666 ATOM 12345 O WAT 667 55.246 42.888 99.602 1.00 0.00 O ATOM 12346 H1 WAT 667 55.915 42.787 100.280 1.00 0.00 H ATOM 12347 H2 WAT 667 54.883 42.010 99.491 1.00 0.00 H TER 12349 WAT 667 ATOM 12349 O WAT 668 33.269 114.688 127.470 1.00 0.00 O ATOM 12350 H1 WAT 668 32.636 115.291 127.081 1.00 0.00 H ATOM 12351 H2 WAT 668 32.758 113.904 127.674 1.00 0.00 H TER 12353 WAT 668 ATOM 12353 O WAT 669 50.712 145.099 144.310 1.00 0.00 O ATOM 12354 H1 WAT 669 50.423 144.520 145.016 1.00 0.00 H ATOM 12355 H2 WAT 669 50.745 145.967 144.711 1.00 0.00 H TER 12357 WAT 669 ATOM 12357 O WAT 670 55.923 35.190 10.380 1.00 0.00 O ATOM 12358 H1 WAT 670 56.196 35.072 11.290 1.00 0.00 H ATOM 12359 H2 WAT 670 54.982 35.357 10.433 1.00 0.00 H TER 12361 WAT 670 ATOM 12361 O WAT 671 105.556 91.804 97.870 1.00 0.00 O ATOM 12362 H1 WAT 671 105.603 91.079 98.493 1.00 0.00 H ATOM 12363 H2 WAT 671 105.912 92.553 98.348 1.00 0.00 H TER 12365 WAT 671 ATOM 12365 O WAT 672 61.570 60.581 107.806 1.00 0.00 O ATOM 12366 H1 WAT 672 61.860 60.512 106.896 1.00 0.00 H ATOM 12367 H2 WAT 672 62.307 60.250 108.318 1.00 0.00 H TER 12369 WAT 672 ATOM 12369 O WAT 673 25.783 38.621 71.853 1.00 0.00 O ATOM 12370 H1 WAT 673 25.383 37.755 71.931 1.00 0.00 H ATOM 12371 H2 WAT 673 26.489 38.502 71.217 1.00 0.00 H TER 12373 WAT 673 ATOM 12373 O WAT 674 98.455 105.205 130.815 1.00 0.00 O ATOM 12374 H1 WAT 674 98.695 105.769 130.080 1.00 0.00 H ATOM 12375 H2 WAT 674 97.640 105.579 131.148 1.00 0.00 H TER 12377 WAT 674 ATOM 12377 O WAT 675 73.188 137.560 151.060 1.00 0.00 O ATOM 12378 H1 WAT 675 73.481 137.326 150.179 1.00 0.00 H ATOM 12379 H2 WAT 675 72.354 137.103 151.165 1.00 0.00 H TER 12381 WAT 675 ATOM 12381 O WAT 676 42.035 8.327 133.213 1.00 0.00 O ATOM 12382 H1 WAT 676 42.198 9.270 133.229 1.00 0.00 H ATOM 12383 H2 WAT 676 42.878 7.942 132.973 1.00 0.00 H TER 12385 WAT 676 ATOM 12385 O WAT 677 9.034 76.814 98.453 1.00 0.00 O ATOM 12386 H1 WAT 677 9.280 77.668 98.809 1.00 0.00 H ATOM 12387 H2 WAT 677 9.225 76.881 97.518 1.00 0.00 H TER 12389 WAT 677 ATOM 12389 O WAT 678 62.199 42.591 118.855 1.00 0.00 O ATOM 12390 H1 WAT 678 61.260 42.586 118.668 1.00 0.00 H ATOM 12391 H2 WAT 678 62.282 42.105 119.676 1.00 0.00 H TER 12393 WAT 678 ATOM 12393 O WAT 679 26.713 58.806 79.360 1.00 0.00 O ATOM 12394 H1 WAT 679 26.759 58.142 80.048 1.00 0.00 H ATOM 12395 H2 WAT 679 25.822 58.733 79.016 1.00 0.00 H TER 12397 WAT 679 ATOM 12397 O WAT 680 51.771 30.327 139.083 1.00 0.00 O ATOM 12398 H1 WAT 680 50.817 30.253 139.049 1.00 0.00 H ATOM 12399 H2 WAT 680 52.082 29.708 138.423 1.00 0.00 H TER 12401 WAT 680 ATOM 12401 O WAT 681 20.378 36.654 123.716 1.00 0.00 O ATOM 12402 H1 WAT 681 21.151 36.123 123.521 1.00 0.00 H ATOM 12403 H2 WAT 681 20.716 37.544 123.808 1.00 0.00 H TER 12405 WAT 681 ATOM 12405 O WAT 682 49.928 74.156 137.045 1.00 0.00 O ATOM 12406 H1 WAT 682 49.307 74.677 136.536 1.00 0.00 H ATOM 12407 H2 WAT 682 49.839 74.484 137.940 1.00 0.00 H TER 12409 WAT 682 ATOM 12409 O WAT 683 29.267 114.185 75.230 1.00 0.00 O ATOM 12410 H1 WAT 683 28.997 115.103 75.235 1.00 0.00 H ATOM 12411 H2 WAT 683 28.448 113.694 75.170 1.00 0.00 H TER 12413 WAT 683 ATOM 12413 O WAT 684 7.882 122.010 25.921 1.00 0.00 O ATOM 12414 H1 WAT 684 6.928 122.079 25.972 1.00 0.00 H ATOM 12415 H2 WAT 684 8.203 122.695 26.508 1.00 0.00 H TER 12417 WAT 684 ATOM 12417 O WAT 685 118.875 126.937 66.438 1.00 0.00 O ATOM 12418 H1 WAT 685 118.504 127.505 65.762 1.00 0.00 H ATOM 12419 H2 WAT 685 119.788 126.819 66.177 1.00 0.00 H TER 12421 WAT 685 ATOM 12421 O WAT 686 21.978 61.626 124.004 1.00 0.00 O ATOM 12422 H1 WAT 686 22.236 61.332 123.131 1.00 0.00 H ATOM 12423 H2 WAT 686 22.796 61.901 124.416 1.00 0.00 H TER 12425 WAT 686 ATOM 12425 O WAT 687 125.330 112.814 140.016 1.00 0.00 O ATOM 12426 H1 WAT 687 124.578 112.296 140.303 1.00 0.00 H ATOM 12427 H2 WAT 687 125.028 113.721 140.064 1.00 0.00 H TER 12429 WAT 687 ATOM 12429 O WAT 688 129.559 23.005 104.561 1.00 0.00 O ATOM 12430 H1 WAT 688 128.776 22.581 104.210 1.00 0.00 H ATOM 12431 H2 WAT 688 129.371 23.942 104.504 1.00 0.00 H TER 12433 WAT 688 ATOM 12433 O WAT 689 21.994 100.561 127.449 1.00 0.00 O ATOM 12434 H1 WAT 689 22.253 100.164 128.281 1.00 0.00 H ATOM 12435 H2 WAT 689 21.213 100.074 127.185 1.00 0.00 H TER 12437 WAT 689 ATOM 12437 O WAT 690 101.302 82.096 76.454 1.00 0.00 O ATOM 12438 H1 WAT 690 100.354 82.163 76.344 1.00 0.00 H ATOM 12439 H2 WAT 690 101.646 82.897 76.057 1.00 0.00 H TER 12441 WAT 690 ATOM 12441 O WAT 691 107.467 72.361 5.162 1.00 0.00 O ATOM 12442 H1 WAT 691 107.402 71.461 4.845 1.00 0.00 H ATOM 12443 H2 WAT 691 107.237 72.306 6.090 1.00 0.00 H TER 12445 WAT 691 ATOM 12445 O WAT 692 84.933 93.044 9.217 1.00 0.00 O ATOM 12446 H1 WAT 692 84.456 93.827 8.944 1.00 0.00 H ATOM 12447 H2 WAT 692 84.251 92.431 9.493 1.00 0.00 H TER 12449 WAT 692 ATOM 12449 O WAT 693 37.948 129.952 106.026 1.00 0.00 O ATOM 12450 H1 WAT 693 37.797 130.230 106.930 1.00 0.00 H ATOM 12451 H2 WAT 693 38.496 129.171 106.105 1.00 0.00 H TER 12453 WAT 693 ATOM 12453 O WAT 694 79.699 13.401 158.426 1.00 0.00 O ATOM 12454 H1 WAT 694 79.758 14.289 158.073 1.00 0.00 H ATOM 12455 H2 WAT 694 79.274 13.510 159.277 1.00 0.00 H TER 12457 WAT 694 ATOM 12457 O WAT 695 144.832 17.002 138.907 1.00 0.00 O ATOM 12458 H1 WAT 695 145.537 17.632 139.055 1.00 0.00 H ATOM 12459 H2 WAT 695 144.598 17.115 137.986 1.00 0.00 H TER 12461 WAT 695 ATOM 12461 O WAT 696 37.719 141.761 118.899 1.00 0.00 O ATOM 12462 H1 WAT 696 37.304 142.582 118.634 1.00 0.00 H ATOM 12463 H2 WAT 696 38.553 142.028 119.285 1.00 0.00 H TER 12465 WAT 696 ATOM 12465 O WAT 697 53.425 1.346 13.314 1.00 0.00 O ATOM 12466 H1 WAT 697 53.281 2.291 13.365 1.00 0.00 H ATOM 12467 H2 WAT 697 53.075 1.096 12.458 1.00 0.00 H TER 12469 WAT 697 ATOM 12469 O WAT 698 116.401 79.354 141.583 1.00 0.00 O ATOM 12470 H1 WAT 698 117.127 79.891 141.900 1.00 0.00 H ATOM 12471 H2 WAT 698 116.764 78.470 141.526 1.00 0.00 H TER 12473 WAT 698 ATOM 12473 O WAT 699 130.591 46.366 126.007 1.00 0.00 O ATOM 12474 H1 WAT 699 130.209 45.541 126.307 1.00 0.00 H ATOM 12475 H2 WAT 699 131.369 46.105 125.515 1.00 0.00 H TER 12477 WAT 699 ATOM 12477 O WAT 700 125.059 87.858 6.897 1.00 0.00 O ATOM 12478 H1 WAT 700 125.394 87.035 6.540 1.00 0.00 H ATOM 12479 H2 WAT 700 124.539 88.233 6.187 1.00 0.00 H TER 12481 WAT 700 ATOM 12481 O WAT 701 59.542 13.274 13.649 1.00 0.00 O ATOM 12482 H1 WAT 701 59.702 12.963 12.758 1.00 0.00 H ATOM 12483 H2 WAT 701 59.740 12.519 14.204 1.00 0.00 H TER 12485 WAT 701 ATOM 12485 O WAT 702 84.918 38.625 26.577 1.00 0.00 O ATOM 12486 H1 WAT 702 84.616 39.001 25.750 1.00 0.00 H ATOM 12487 H2 WAT 702 84.807 39.329 27.215 1.00 0.00 H TER 12489 WAT 702 ATOM 12489 O WAT 703 16.891 116.090 133.542 1.00 0.00 O ATOM 12490 H1 WAT 703 16.519 116.417 132.723 1.00 0.00 H ATOM 12491 H2 WAT 703 16.131 115.927 134.101 1.00 0.00 H TER 12493 WAT 703 ATOM 12493 O WAT 704 89.365 106.617 126.632 1.00 0.00 O ATOM 12494 H1 WAT 704 88.534 106.728 126.172 1.00 0.00 H ATOM 12495 H2 WAT 704 89.241 105.834 127.167 1.00 0.00 H TER 12497 WAT 704 ATOM 12497 O WAT 705 126.350 19.901 100.390 1.00 0.00 O ATOM 12498 H1 WAT 705 125.706 20.409 100.884 1.00 0.00 H ATOM 12499 H2 WAT 705 126.733 19.307 101.035 1.00 0.00 H TER 12501 WAT 705 ATOM 12501 O WAT 706 8.016 127.197 3.206 1.00 0.00 O ATOM 12502 H1 WAT 706 8.400 128.049 3.411 1.00 0.00 H ATOM 12503 H2 WAT 706 8.396 126.601 3.852 1.00 0.00 H TER 12505 WAT 706 ATOM 12505 O WAT 707 117.740 87.264 4.506 1.00 0.00 O ATOM 12506 H1 WAT 707 117.496 87.313 3.581 1.00 0.00 H ATOM 12507 H2 WAT 707 117.069 86.707 4.901 1.00 0.00 H TER 12509 WAT 707 ATOM 12509 O WAT 708 129.360 32.193 103.902 1.00 0.00 O ATOM 12510 H1 WAT 708 130.074 32.794 103.688 1.00 0.00 H ATOM 12511 H2 WAT 708 129.172 32.364 104.825 1.00 0.00 H TER 12513 WAT 708 ATOM 12513 O WAT 709 8.215 100.779 60.138 1.00 0.00 O ATOM 12514 H1 WAT 709 7.272 100.641 60.218 1.00 0.00 H ATOM 12515 H2 WAT 709 8.598 100.216 60.812 1.00 0.00 H TER 12517 WAT 709 ATOM 12517 O WAT 710 13.785 129.080 138.794 1.00 0.00 O ATOM 12518 H1 WAT 710 13.607 129.527 139.622 1.00 0.00 H ATOM 12519 H2 WAT 710 13.899 129.789 138.160 1.00 0.00 H TER 12521 WAT 710 ATOM 12521 O WAT 711 108.690 53.120 69.805 1.00 0.00 O ATOM 12522 H1 WAT 711 109.391 53.072 69.155 1.00 0.00 H ATOM 12523 H2 WAT 711 109.072 52.744 70.598 1.00 0.00 H TER 12525 WAT 711 ATOM 12525 O WAT 712 128.445 75.370 23.731 1.00 0.00 O ATOM 12526 H1 WAT 712 127.579 75.394 24.138 1.00 0.00 H ATOM 12527 H2 WAT 712 129.011 74.977 24.394 1.00 0.00 H TER 12529 WAT 712 ATOM 12529 O WAT 713 91.666 52.104 76.500 1.00 0.00 O ATOM 12530 H1 WAT 713 91.658 51.419 77.169 1.00 0.00 H ATOM 12531 H2 WAT 713 91.074 52.775 76.839 1.00 0.00 H TER 12533 WAT 713 ATOM 12533 O WAT 714 66.686 121.809 99.425 1.00 0.00 O ATOM 12534 H1 WAT 714 66.676 120.990 98.930 1.00 0.00 H ATOM 12535 H2 WAT 714 66.192 122.423 98.883 1.00 0.00 H TER 12537 WAT 714 ATOM 12537 O WAT 715 58.188 73.701 68.535 1.00 0.00 O ATOM 12538 H1 WAT 715 57.581 72.971 68.409 1.00 0.00 H ATOM 12539 H2 WAT 715 59.017 73.285 68.770 1.00 0.00 H TER 12541 WAT 715 ATOM 12541 O WAT 716 52.543 133.341 86.648 1.00 0.00 O ATOM 12542 H1 WAT 716 52.155 133.776 87.407 1.00 0.00 H ATOM 12543 H2 WAT 716 51.912 133.484 85.942 1.00 0.00 H TER 12545 WAT 716 ATOM 12545 O WAT 717 8.627 43.042 92.903 1.00 0.00 O ATOM 12546 H1 WAT 717 8.988 42.896 92.028 1.00 0.00 H ATOM 12547 H2 WAT 717 7.792 43.482 92.747 1.00 0.00 H TER 12549 WAT 717 ATOM 12549 O WAT 718 84.393 113.386 131.142 1.00 0.00 O ATOM 12550 H1 WAT 718 84.413 113.675 132.054 1.00 0.00 H ATOM 12551 H2 WAT 718 85.304 113.446 130.852 1.00 0.00 H TER 12553 WAT 718 ATOM 12553 O WAT 719 137.951 25.986 105.532 1.00 0.00 O ATOM 12554 H1 WAT 719 137.249 26.352 106.070 1.00 0.00 H ATOM 12555 H2 WAT 719 138.658 26.629 105.591 1.00 0.00 H TER 12557 WAT 719 ATOM 12557 O WAT 720 102.980 77.255 85.977 1.00 0.00 O ATOM 12558 H1 WAT 720 103.201 77.974 86.569 1.00 0.00 H ATOM 12559 H2 WAT 720 103.654 76.595 86.138 1.00 0.00 H TER 12561 WAT 720 ATOM 12561 O WAT 721 118.051 27.605 133.121 1.00 0.00 O ATOM 12562 H1 WAT 721 117.389 27.036 132.728 1.00 0.00 H ATOM 12563 H2 WAT 721 118.838 27.062 133.166 1.00 0.00 H TER 12565 WAT 721 ATOM 12565 O WAT 722 75.936 41.738 87.052 1.00 0.00 O ATOM 12566 H1 WAT 722 75.335 41.894 86.324 1.00 0.00 H ATOM 12567 H2 WAT 722 76.383 42.574 87.178 1.00 0.00 H TER 12569 WAT 722 ATOM 12569 O WAT 723 68.367 38.686 134.328 1.00 0.00 O ATOM 12570 H1 WAT 723 67.977 38.312 135.118 1.00 0.00 H ATOM 12571 H2 WAT 723 69.311 38.605 134.466 1.00 0.00 H TER 12573 WAT 723 ATOM 12573 O WAT 724 77.345 137.840 3.196 1.00 0.00 O ATOM 12574 H1 WAT 724 77.135 136.910 3.281 1.00 0.00 H ATOM 12575 H2 WAT 724 76.493 138.272 3.130 1.00 0.00 H TER 12577 WAT 724 ATOM 12577 O WAT 725 54.963 39.147 135.547 1.00 0.00 O ATOM 12578 H1 WAT 725 54.897 40.068 135.296 1.00 0.00 H ATOM 12579 H2 WAT 725 54.064 38.890 135.753 1.00 0.00 H TER 12581 WAT 725 ATOM 12581 O WAT 726 23.362 71.783 112.312 1.00 0.00 O ATOM 12582 H1 WAT 726 23.447 70.964 111.824 1.00 0.00 H ATOM 12583 H2 WAT 726 23.845 72.424 111.790 1.00 0.00 H TER 12585 WAT 726 ATOM 12585 O WAT 727 105.902 74.770 139.901 1.00 0.00 O ATOM 12586 H1 WAT 727 106.446 74.628 139.126 1.00 0.00 H ATOM 12587 H2 WAT 727 106.505 75.121 140.556 1.00 0.00 H TER 12589 WAT 727 ATOM 12589 O WAT 728 58.053 43.694 89.896 1.00 0.00 O ATOM 12590 H1 WAT 728 58.973 43.956 89.928 1.00 0.00 H ATOM 12591 H2 WAT 728 57.651 44.141 90.642 1.00 0.00 H TER 12593 WAT 728 ATOM 12593 O WAT 729 48.872 119.177 94.882 1.00 0.00 O ATOM 12594 H1 WAT 729 49.495 118.801 94.260 1.00 0.00 H ATOM 12595 H2 WAT 729 48.590 118.435 95.417 1.00 0.00 H TER 12597 WAT 729 ATOM 12597 O WAT 730 142.087 34.413 115.086 1.00 0.00 O ATOM 12598 H1 WAT 730 142.059 34.803 115.959 1.00 0.00 H ATOM 12599 H2 WAT 730 142.934 33.969 115.049 1.00 0.00 H TER 12601 WAT 730 ATOM 12601 O WAT 731 96.718 30.249 70.396 1.00 0.00 O ATOM 12602 H1 WAT 731 96.787 30.332 71.347 1.00 0.00 H ATOM 12603 H2 WAT 731 96.991 29.349 70.214 1.00 0.00 H TER 12605 WAT 731 ATOM 12605 O WAT 732 1.609 107.622 67.648 1.00 0.00 O ATOM 12606 H1 WAT 732 1.217 107.111 68.356 1.00 0.00 H ATOM 12607 H2 WAT 732 2.548 107.454 67.722 1.00 0.00 H TER 12609 WAT 732 ATOM 12609 O WAT 733 9.288 116.823 121.912 1.00 0.00 O ATOM 12610 H1 WAT 733 9.201 117.086 122.829 1.00 0.00 H ATOM 12611 H2 WAT 733 8.639 117.351 121.449 1.00 0.00 H TER 12613 WAT 733 ATOM 12613 O WAT 734 6.837 70.196 100.015 1.00 0.00 O ATOM 12614 H1 WAT 734 5.968 70.593 99.951 1.00 0.00 H ATOM 12615 H2 WAT 734 7.236 70.612 100.779 1.00 0.00 H TER 12617 WAT 734 ATOM 12617 O WAT 735 103.074 10.669 15.797 1.00 0.00 O ATOM 12618 H1 WAT 735 103.976 10.863 15.540 1.00 0.00 H ATOM 12619 H2 WAT 735 102.832 11.386 16.383 1.00 0.00 H TER 12621 WAT 735 ATOM 12621 O WAT 736 112.095 33.896 111.767 1.00 0.00 O ATOM 12622 H1 WAT 736 112.217 33.627 112.677 1.00 0.00 H ATOM 12623 H2 WAT 736 111.415 33.310 111.434 1.00 0.00 H TER 12625 WAT 736 ATOM 12625 O WAT 737 0.041 70.029 124.930 1.00 0.00 O ATOM 12626 H1 WAT 737 0.996 70.086 124.966 1.00 0.00 H ATOM 12627 H2 WAT 737 -0.139 69.498 124.154 1.00 0.00 H TER 12629 WAT 737 ATOM 12629 O WAT 738 53.141 126.587 148.930 1.00 0.00 O ATOM 12630 H1 WAT 738 53.344 126.123 148.118 1.00 0.00 H ATOM 12631 H2 WAT 738 53.981 126.942 149.220 1.00 0.00 H TER 12633 WAT 738 ATOM 12633 O WAT 739 5.885 105.628 139.570 1.00 0.00 O ATOM 12634 H1 WAT 739 6.143 106.406 140.064 1.00 0.00 H ATOM 12635 H2 WAT 739 6.474 104.940 139.880 1.00 0.00 H TER 12637 WAT 739 ATOM 12637 O WAT 740 78.843 88.445 101.978 1.00 0.00 O ATOM 12638 H1 WAT 740 79.377 88.400 101.184 1.00 0.00 H ATOM 12639 H2 WAT 740 79.329 89.030 102.560 1.00 0.00 H TER 12641 WAT 740 ATOM 12641 O WAT 741 112.795 66.558 3.319 1.00 0.00 O ATOM 12642 H1 WAT 741 112.870 66.650 4.269 1.00 0.00 H ATOM 12643 H2 WAT 741 112.729 67.456 2.996 1.00 0.00 H TER 12645 WAT 741 ATOM 12645 O WAT 742 132.763 115.857 84.043 1.00 0.00 O ATOM 12646 H1 WAT 742 132.465 115.742 84.945 1.00 0.00 H ATOM 12647 H2 WAT 742 133.688 116.091 84.124 1.00 0.00 H TER 12649 WAT 742 ATOM 12649 O WAT 743 142.610 121.854 141.241 1.00 0.00 O ATOM 12650 H1 WAT 743 141.911 121.203 141.313 1.00 0.00 H ATOM 12651 H2 WAT 743 143.119 121.576 140.480 1.00 0.00 H TER 12653 WAT 743 ATOM 12653 O WAT 744 69.974 99.724 28.572 1.00 0.00 O ATOM 12654 H1 WAT 744 69.520 100.234 27.901 1.00 0.00 H ATOM 12655 H2 WAT 744 70.824 100.154 28.664 1.00 0.00 H TER 12657 WAT 744 ATOM 12657 O WAT 745 137.746 140.383 110.010 1.00 0.00 O ATOM 12658 H1 WAT 745 138.620 139.996 110.049 1.00 0.00 H ATOM 12659 H2 WAT 745 137.352 140.170 110.857 1.00 0.00 H TER 12661 WAT 745 ATOM 12661 O WAT 746 116.030 26.088 9.783 1.00 0.00 O ATOM 12662 H1 WAT 746 116.872 25.638 9.726 1.00 0.00 H ATOM 12663 H2 WAT 746 115.493 25.678 9.105 1.00 0.00 H TER 12665 WAT 746 ATOM 12665 O WAT 747 18.093 82.435 8.738 1.00 0.00 O ATOM 12666 H1 WAT 747 18.029 82.051 9.612 1.00 0.00 H ATOM 12667 H2 WAT 747 18.896 82.063 8.372 1.00 0.00 H TER 12669 WAT 747 ATOM 12669 O WAT 748 115.342 89.724 132.339 1.00 0.00 O ATOM 12670 H1 WAT 748 115.373 90.471 131.741 1.00 0.00 H ATOM 12671 H2 WAT 748 114.711 89.983 133.012 1.00 0.00 H TER 12673 WAT 748 ATOM 12673 O WAT 749 96.396 90.625 28.431 1.00 0.00 O ATOM 12674 H1 WAT 749 97.347 90.695 28.512 1.00 0.00 H ATOM 12675 H2 WAT 749 96.255 90.264 27.556 1.00 0.00 H TER 12677 WAT 749 ATOM 12677 O WAT 750 62.639 48.256 11.458 1.00 0.00 O ATOM 12678 H1 WAT 750 63.430 48.197 11.993 1.00 0.00 H ATOM 12679 H2 WAT 750 62.781 47.629 10.749 1.00 0.00 H TER 12681 WAT 750 ATOM 12681 O WAT 751 22.155 73.973 107.223 1.00 0.00 O ATOM 12682 H1 WAT 751 22.329 73.242 107.816 1.00 0.00 H ATOM 12683 H2 WAT 751 21.215 74.133 107.309 1.00 0.00 H TER 12685 WAT 751 ATOM 12685 O WAT 752 6.956 72.798 91.138 1.00 0.00 O ATOM 12686 H1 WAT 752 7.727 73.215 90.753 1.00 0.00 H ATOM 12687 H2 WAT 752 6.332 72.733 90.416 1.00 0.00 H TER 12689 WAT 752 ATOM 12689 O WAT 753 31.635 49.360 86.638 1.00 0.00 O ATOM 12690 H1 WAT 753 32.519 49.302 86.275 1.00 0.00 H ATOM 12691 H2 WAT 753 31.196 50.013 86.093 1.00 0.00 H TER 12693 WAT 753 ATOM 12693 O WAT 754 40.124 106.252 135.698 1.00 0.00 O ATOM 12694 H1 WAT 754 40.487 107.038 135.292 1.00 0.00 H ATOM 12695 H2 WAT 754 39.886 106.528 136.583 1.00 0.00 H TER 12697 WAT 754 ATOM 12697 O WAT 755 90.849 115.810 4.919 1.00 0.00 O ATOM 12698 H1 WAT 755 89.905 115.759 5.067 1.00 0.00 H ATOM 12699 H2 WAT 755 91.023 116.745 4.805 1.00 0.00 H TER 12701 WAT 755 ATOM 12701 O WAT 756 92.990 42.952 138.798 1.00 0.00 O ATOM 12702 H1 WAT 756 93.165 43.605 139.476 1.00 0.00 H ATOM 12703 H2 WAT 756 92.374 42.343 139.206 1.00 0.00 H TER 12705 WAT 756 ATOM 12705 O WAT 757 74.131 143.023 108.846 1.00 0.00 O ATOM 12706 H1 WAT 757 73.300 143.400 108.558 1.00 0.00 H ATOM 12707 H2 WAT 757 74.786 143.424 108.275 1.00 0.00 H TER 12709 WAT 757 ATOM 12709 O WAT 758 113.032 27.852 105.278 1.00 0.00 O ATOM 12710 H1 WAT 758 112.483 28.522 105.686 1.00 0.00 H ATOM 12711 H2 WAT 758 113.702 27.660 105.935 1.00 0.00 H TER 12713 WAT 758 ATOM 12713 O WAT 759 65.340 114.234 52.000 1.00 0.00 O ATOM 12714 H1 WAT 759 65.125 114.816 52.729 1.00 0.00 H ATOM 12715 H2 WAT 759 64.931 114.643 51.238 1.00 0.00 H TER 12717 WAT 759 ATOM 12717 O WAT 760 130.542 132.762 21.681 1.00 0.00 O ATOM 12718 H1 WAT 760 129.587 132.826 21.714 1.00 0.00 H ATOM 12719 H2 WAT 760 130.841 133.276 22.432 1.00 0.00 H TER 12721 WAT 760 ATOM 12721 O WAT 761 40.625 15.569 98.961 1.00 0.00 O ATOM 12722 H1 WAT 761 41.488 15.982 98.955 1.00 0.00 H ATOM 12723 H2 WAT 761 40.732 14.780 98.429 1.00 0.00 H TER 12725 WAT 761 ATOM 12725 O WAT 762 19.856 63.294 145.917 1.00 0.00 O ATOM 12726 H1 WAT 762 19.386 62.529 146.249 1.00 0.00 H ATOM 12727 H2 WAT 762 20.753 63.180 146.230 1.00 0.00 H TER 12729 WAT 762 ATOM 12729 O WAT 763 30.175 105.699 58.585 1.00 0.00 O ATOM 12730 H1 WAT 763 29.304 106.061 58.421 1.00 0.00 H ATOM 12731 H2 WAT 763 30.634 105.791 57.750 1.00 0.00 H TER 12733 WAT 763 ATOM 12733 O WAT 764 31.059 40.227 148.170 1.00 0.00 O ATOM 12734 H1 WAT 764 31.164 41.126 147.857 1.00 0.00 H ATOM 12735 H2 WAT 764 30.787 39.734 147.396 1.00 0.00 H TER 12737 WAT 764 ATOM 12737 O WAT 765 5.657 129.835 85.637 1.00 0.00 O ATOM 12738 H1 WAT 765 6.150 129.582 86.418 1.00 0.00 H ATOM 12739 H2 WAT 765 5.645 129.047 85.095 1.00 0.00 H TER 12741 WAT 765 ATOM 12741 O WAT 766 96.507 95.873 68.559 1.00 0.00 O ATOM 12742 H1 WAT 766 95.853 95.983 67.868 1.00 0.00 H ATOM 12743 H2 WAT 766 96.562 96.734 68.975 1.00 0.00 H TER 12745 WAT 766 ATOM 12745 O WAT 767 17.146 94.915 145.160 1.00 0.00 O ATOM 12746 H1 WAT 767 16.847 95.769 144.848 1.00 0.00 H ATOM 12747 H2 WAT 767 16.469 94.304 144.870 1.00 0.00 H TER 12749 WAT 767 ATOM 12749 O WAT 768 24.865 106.712 121.697 1.00 0.00 O ATOM 12750 H1 WAT 768 25.294 106.670 122.551 1.00 0.00 H ATOM 12751 H2 WAT 768 23.960 106.452 121.870 1.00 0.00 H TER 12753 WAT 768 ATOM 12753 O WAT 769 25.953 87.712 127.300 1.00 0.00 O ATOM 12754 H1 WAT 769 26.122 88.284 126.551 1.00 0.00 H ATOM 12755 H2 WAT 769 25.139 88.046 127.678 1.00 0.00 H TER 12757 WAT 769 ATOM 12757 O WAT 770 38.152 127.392 130.220 1.00 0.00 O ATOM 12758 H1 WAT 770 38.731 126.838 129.696 1.00 0.00 H ATOM 12759 H2 WAT 770 38.348 128.284 129.930 1.00 0.00 H TER 12761 WAT 770 ATOM 12761 O WAT 771 50.530 21.243 134.425 1.00 0.00 O ATOM 12762 H1 WAT 771 50.130 20.374 134.425 1.00 0.00 H ATOM 12763 H2 WAT 771 51.354 21.128 134.899 1.00 0.00 H TER 12765 WAT 771 ATOM 12765 O WAT 772 90.336 17.366 13.593 1.00 0.00 O ATOM 12766 H1 WAT 772 89.668 16.956 14.142 1.00 0.00 H ATOM 12767 H2 WAT 772 90.510 16.723 12.905 1.00 0.00 H TER 12769 WAT 772 ATOM 12769 O WAT 773 134.977 46.771 125.519 1.00 0.00 O ATOM 12770 H1 WAT 773 134.571 46.033 125.973 1.00 0.00 H ATOM 12771 H2 WAT 773 135.913 46.572 125.528 1.00 0.00 H TER 12773 WAT 773 ATOM 12773 O WAT 774 137.647 116.084 82.270 1.00 0.00 O ATOM 12774 H1 WAT 774 138.448 116.606 82.225 1.00 0.00 H ATOM 12775 H2 WAT 774 137.123 116.508 82.949 1.00 0.00 H TER 12777 WAT 774 ATOM 12777 O WAT 775 0.194 13.908 114.377 1.00 0.00 O ATOM 12778 H1 WAT 775 0.729 14.382 113.740 1.00 0.00 H ATOM 12779 H2 WAT 775 0.824 13.404 114.891 1.00 0.00 H TER 12781 WAT 775 ATOM 12781 O WAT 776 43.315 62.474 110.901 1.00 0.00 O ATOM 12782 H1 WAT 776 44.224 62.369 110.621 1.00 0.00 H ATOM 12783 H2 WAT 776 43.256 61.978 111.717 1.00 0.00 H TER 12785 WAT 776 ATOM 12785 O WAT 777 30.545 128.805 81.272 1.00 0.00 O ATOM 12786 H1 WAT 777 30.903 129.006 80.407 1.00 0.00 H ATOM 12787 H2 WAT 777 31.309 128.570 81.799 1.00 0.00 H TER 12789 WAT 777 ATOM 12789 O WAT 778 47.657 139.226 144.807 1.00 0.00 O ATOM 12790 H1 WAT 778 48.270 138.604 145.200 1.00 0.00 H ATOM 12791 H2 WAT 778 48.213 139.922 144.457 1.00 0.00 H TER 12793 WAT 778 ATOM 12793 O WAT 779 0.738 124.510 82.932 1.00 0.00 O ATOM 12794 H1 WAT 779 1.444 125.067 83.262 1.00 0.00 H ATOM 12795 H2 WAT 779 -0.057 125.025 83.069 1.00 0.00 H TER 12797 WAT 779 ATOM 12797 O WAT 780 36.709 37.576 88.671 1.00 0.00 O ATOM 12798 H1 WAT 780 35.761 37.484 88.579 1.00 0.00 H ATOM 12799 H2 WAT 780 36.840 38.498 88.891 1.00 0.00 H TER 12801 WAT 780 ATOM 12801 O WAT 781 0.668 55.264 122.107 1.00 0.00 O ATOM 12802 H1 WAT 781 0.050 54.556 121.930 1.00 0.00 H ATOM 12803 H2 WAT 781 0.644 55.806 121.318 1.00 0.00 H TER 12805 WAT 781 ATOM 12805 O WAT 782 40.159 52.543 96.649 1.00 0.00 O ATOM 12806 H1 WAT 782 40.166 51.813 96.030 1.00 0.00 H ATOM 12807 H2 WAT 782 40.001 52.134 97.500 1.00 0.00 H TER 12809 WAT 782 ATOM 12809 O WAT 783 128.482 124.189 146.448 1.00 0.00 O ATOM 12810 H1 WAT 783 129.310 123.731 146.300 1.00 0.00 H ATOM 12811 H2 WAT 783 127.822 123.496 146.451 1.00 0.00 H TER 12813 WAT 783 ATOM 12813 O WAT 784 118.134 8.453 121.951 1.00 0.00 O ATOM 12814 H1 WAT 784 118.423 8.942 122.722 1.00 0.00 H ATOM 12815 H2 WAT 784 117.562 7.770 122.301 1.00 0.00 H TER 12817 WAT 784 ATOM 12817 O WAT 785 2.010 118.301 154.253 1.00 0.00 O ATOM 12818 H1 WAT 785 2.260 117.377 154.230 1.00 0.00 H ATOM 12819 H2 WAT 785 2.735 118.734 154.702 1.00 0.00 H TER 12821 WAT 785 ATOM 12821 O WAT 786 10.621 11.023 140.584 1.00 0.00 O ATOM 12822 H1 WAT 786 10.912 11.285 139.711 1.00 0.00 H ATOM 12823 H2 WAT 786 9.670 11.130 140.562 1.00 0.00 H TER 12825 WAT 786 ATOM 12825 O WAT 787 90.028 77.053 123.669 1.00 0.00 O ATOM 12826 H1 WAT 787 90.575 76.678 124.359 1.00 0.00 H ATOM 12827 H2 WAT 787 89.924 77.971 123.919 1.00 0.00 H TER 12829 WAT 787 ATOM 12829 O WAT 788 63.659 72.645 103.260 1.00 0.00 O ATOM 12830 H1 WAT 788 64.505 72.952 103.584 1.00 0.00 H ATOM 12831 H2 WAT 788 63.342 72.052 103.942 1.00 0.00 H TER 12833 WAT 788 ATOM 12833 O WAT 789 53.320 122.104 71.004 1.00 0.00 O ATOM 12834 H1 WAT 789 52.988 121.494 71.663 1.00 0.00 H ATOM 12835 H2 WAT 789 53.393 121.580 70.207 1.00 0.00 H TER 12837 WAT 789 ATOM 12837 O WAT 790 6.688 137.888 145.558 1.00 0.00 O ATOM 12838 H1 WAT 790 7.166 138.603 145.977 1.00 0.00 H ATOM 12839 H2 WAT 790 5.767 138.081 145.732 1.00 0.00 H TER 12841 WAT 790 ATOM 12841 O WAT 791 74.679 141.714 80.651 1.00 0.00 O ATOM 12842 H1 WAT 791 74.757 141.990 81.564 1.00 0.00 H ATOM 12843 H2 WAT 791 75.266 140.961 80.578 1.00 0.00 H TER 12845 WAT 791 ATOM 12845 O WAT 792 113.847 58.283 5.947 1.00 0.00 O ATOM 12846 H1 WAT 792 114.624 57.894 5.546 1.00 0.00 H ATOM 12847 H2 WAT 792 113.493 57.590 6.504 1.00 0.00 H TER 12849 WAT 792 ATOM 12849 O WAT 793 3.609 141.470 104.288 1.00 0.00 O ATOM 12850 H1 WAT 793 3.832 142.330 104.644 1.00 0.00 H ATOM 12851 H2 WAT 793 2.925 141.141 104.871 1.00 0.00 H TER 12853 WAT 793 ATOM 12853 O WAT 794 16.312 112.570 100.943 1.00 0.00 O ATOM 12854 H1 WAT 794 16.744 112.816 101.761 1.00 0.00 H ATOM 12855 H2 WAT 794 17.028 112.301 100.367 1.00 0.00 H TER 12857 WAT 794 ATOM 12857 O WAT 795 34.411 84.199 126.675 1.00 0.00 O ATOM 12858 H1 WAT 795 33.613 83.722 126.447 1.00 0.00 H ATOM 12859 H2 WAT 795 34.186 85.120 126.545 1.00 0.00 H TER 12861 WAT 795 ATOM 12861 O WAT 796 51.521 100.875 120.181 1.00 0.00 O ATOM 12862 H1 WAT 796 51.744 100.652 119.277 1.00 0.00 H ATOM 12863 H2 WAT 796 52.055 100.283 120.712 1.00 0.00 H TER 12865 WAT 796 ATOM 12865 O WAT 797 91.160 2.553 56.454 1.00 0.00 O ATOM 12866 H1 WAT 797 90.231 2.324 56.461 1.00 0.00 H ATOM 12867 H2 WAT 797 91.217 3.308 55.869 1.00 0.00 H TER 12869 WAT 797 ATOM 12869 O WAT 798 56.864 10.733 90.266 1.00 0.00 O ATOM 12870 H1 WAT 798 56.500 11.541 90.626 1.00 0.00 H ATOM 12871 H2 WAT 798 56.787 10.097 90.977 1.00 0.00 H TER 12873 WAT 798 ATOM 12873 O WAT 799 4.206 88.123 7.346 1.00 0.00 O ATOM 12874 H1 WAT 799 5.089 87.758 7.398 1.00 0.00 H ATOM 12875 H2 WAT 799 4.279 88.838 6.715 1.00 0.00 H TER 12877 WAT 799 ATOM 12877 O WAT 800 65.577 143.498 14.727 1.00 0.00 O ATOM 12878 H1 WAT 800 66.363 143.131 15.133 1.00 0.00 H ATOM 12879 H2 WAT 800 65.385 142.907 13.999 1.00 0.00 H TER 12881 WAT 800 ATOM 12881 O WAT 801 33.124 123.611 140.968 1.00 0.00 O ATOM 12882 H1 WAT 801 32.351 123.122 140.684 1.00 0.00 H ATOM 12883 H2 WAT 801 33.285 123.307 141.861 1.00 0.00 H TER 12885 WAT 801 ATOM 12885 O WAT 802 8.617 44.606 137.566 1.00 0.00 O ATOM 12886 H1 WAT 802 8.543 44.859 136.646 1.00 0.00 H ATOM 12887 H2 WAT 802 9.437 45.003 137.858 1.00 0.00 H TER 12889 WAT 802 ATOM 12889 O WAT 803 71.526 117.621 126.882 1.00 0.00 O ATOM 12890 H1 WAT 803 70.769 117.321 126.377 1.00 0.00 H ATOM 12891 H2 WAT 803 71.195 117.717 127.775 1.00 0.00 H TER 12893 WAT 803 ATOM 12893 O WAT 804 57.778 56.845 95.290 1.00 0.00 O ATOM 12894 H1 WAT 804 56.938 56.405 95.157 1.00 0.00 H ATOM 12895 H2 WAT 804 57.551 57.668 95.722 1.00 0.00 H TER 12897 WAT 804 ATOM 12897 O WAT 805 31.138 128.500 149.603 1.00 0.00 O ATOM 12898 H1 WAT 805 30.257 128.745 149.321 1.00 0.00 H ATOM 12899 H2 WAT 805 31.696 128.705 148.853 1.00 0.00 H TER 12901 WAT 805 ATOM 12901 O WAT 806 93.865 1.179 16.072 1.00 0.00 O ATOM 12902 H1 WAT 806 94.690 0.702 15.986 1.00 0.00 H ATOM 12903 H2 WAT 806 94.061 1.888 16.685 1.00 0.00 H TER 12905 WAT 806 ATOM 12905 O WAT 807 26.143 134.091 96.359 1.00 0.00 O ATOM 12906 H1 WAT 807 26.612 133.674 95.637 1.00 0.00 H ATOM 12907 H2 WAT 807 26.061 135.007 96.095 1.00 0.00 H TER 12909 WAT 807 ATOM 12909 O WAT 808 28.991 44.582 87.724 1.00 0.00 O ATOM 12910 H1 WAT 808 29.649 45.277 87.757 1.00 0.00 H ATOM 12911 H2 WAT 808 28.317 44.861 88.343 1.00 0.00 H TER 12913 WAT 808 ATOM 12913 O WAT 809 31.824 22.034 2.177 1.00 0.00 O ATOM 12914 H1 WAT 809 31.546 22.847 1.755 1.00 0.00 H ATOM 12915 H2 WAT 809 31.137 21.404 1.959 1.00 0.00 H TER 12917 WAT 809 ATOM 12917 O WAT 810 55.293 49.053 2.364 1.00 0.00 O ATOM 12918 H1 WAT 810 54.785 49.471 3.059 1.00 0.00 H ATOM 12919 H2 WAT 810 54.725 49.095 1.594 1.00 0.00 H TER 12921 WAT 810 ATOM 12921 O WAT 811 127.320 4.230 1.992 1.00 0.00 O ATOM 12922 H1 WAT 811 127.949 4.931 2.161 1.00 0.00 H ATOM 12923 H2 WAT 811 126.808 4.542 1.246 1.00 0.00 H TER 12925 WAT 811 ATOM 12925 O WAT 812 104.702 31.200 135.358 1.00 0.00 O ATOM 12926 H1 WAT 812 105.383 31.805 135.063 1.00 0.00 H ATOM 12927 H2 WAT 812 104.574 31.414 136.282 1.00 0.00 H TER 12929 WAT 812 ATOM 12929 O WAT 813 112.961 91.888 71.667 1.00 0.00 O ATOM 12930 H1 WAT 813 113.331 92.367 72.409 1.00 0.00 H ATOM 12931 H2 WAT 813 112.785 91.013 72.011 1.00 0.00 H TER 12933 WAT 813 ATOM 12933 O WAT 814 41.005 0.494 17.824 1.00 0.00 O ATOM 12934 H1 WAT 814 40.107 0.789 17.975 1.00 0.00 H ATOM 12935 H2 WAT 814 41.292 0.155 18.671 1.00 0.00 H TER 12937 WAT 814 ATOM 12937 O WAT 815 93.948 103.269 144.854 1.00 0.00 O ATOM 12938 H1 WAT 815 94.010 102.583 145.519 1.00 0.00 H ATOM 12939 H2 WAT 815 93.009 103.354 144.685 1.00 0.00 H TER 12941 WAT 815 ATOM 12941 O WAT 816 93.438 3.236 95.598 1.00 0.00 O ATOM 12942 H1 WAT 816 93.389 2.359 95.978 1.00 0.00 H ATOM 12943 H2 WAT 816 92.695 3.704 95.979 1.00 0.00 H TER 12945 WAT 816 ATOM 12945 O WAT 817 81.503 82.883 17.446 1.00 0.00 O ATOM 12946 H1 WAT 817 80.580 82.784 17.213 1.00 0.00 H ATOM 12947 H2 WAT 817 81.909 82.062 17.169 1.00 0.00 H TER 12949 WAT 817 ATOM 12949 O WAT 818 63.131 54.409 158.179 1.00 0.00 O ATOM 12950 H1 WAT 818 62.701 54.163 158.998 1.00 0.00 H ATOM 12951 H2 WAT 818 63.892 53.831 158.125 1.00 0.00 H TER 12953 WAT 818 ATOM 12953 O WAT 819 2.336 129.703 91.671 1.00 0.00 O ATOM 12954 H1 WAT 819 1.621 129.434 92.248 1.00 0.00 H ATOM 12955 H2 WAT 819 2.616 130.551 92.016 1.00 0.00 H TER 12957 WAT 819 ATOM 12957 O WAT 820 133.210 14.902 139.424 1.00 0.00 O ATOM 12958 H1 WAT 820 133.361 15.418 140.215 1.00 0.00 H ATOM 12959 H2 WAT 820 133.924 15.149 138.837 1.00 0.00 H TER 12961 WAT 820 ATOM 12961 O WAT 821 125.631 28.641 134.433 1.00 0.00 O ATOM 12962 H1 WAT 821 125.986 28.271 133.625 1.00 0.00 H ATOM 12963 H2 WAT 821 126.286 29.282 134.710 1.00 0.00 H TER 12965 WAT 821 ATOM 12965 O WAT 822 142.302 1.552 105.554 1.00 0.00 O ATOM 12966 H1 WAT 822 141.624 0.895 105.713 1.00 0.00 H ATOM 12967 H2 WAT 822 142.521 1.885 106.424 1.00 0.00 H TER 12969 WAT 822 ATOM 12969 O WAT 823 100.767 50.768 84.494 1.00 0.00 O ATOM 12970 H1 WAT 823 101.206 51.365 83.888 1.00 0.00 H ATOM 12971 H2 WAT 823 101.459 50.176 84.790 1.00 0.00 H TER 12973 WAT 823 ATOM 12973 O WAT 824 143.251 98.963 73.487 1.00 0.00 O ATOM 12974 H1 WAT 824 142.318 98.831 73.321 1.00 0.00 H ATOM 12975 H2 WAT 824 143.537 98.152 73.908 1.00 0.00 H TER 12977 WAT 824 ATOM 12977 O WAT 825 0.610 114.169 60.868 1.00 0.00 O ATOM 12978 H1 WAT 825 0.834 114.539 60.015 1.00 0.00 H ATOM 12979 H2 WAT 825 0.126 113.368 60.662 1.00 0.00 H TER 12981 WAT 825 ATOM 12981 O WAT 826 17.061 56.073 59.979 1.00 0.00 O ATOM 12982 H1 WAT 826 17.756 55.891 59.346 1.00 0.00 H ATOM 12983 H2 WAT 826 16.558 55.260 60.022 1.00 0.00 H TER 12985 WAT 826 ATOM 12985 O WAT 827 57.783 15.520 131.713 1.00 0.00 O ATOM 12986 H1 WAT 827 57.082 16.170 131.730 1.00 0.00 H ATOM 12987 H2 WAT 827 57.495 14.840 132.322 1.00 0.00 H TER 12989 WAT 827 ATOM 12989 O WAT 828 19.926 59.026 110.144 1.00 0.00 O ATOM 12990 H1 WAT 828 20.737 58.599 110.418 1.00 0.00 H ATOM 12991 H2 WAT 828 19.575 59.413 110.946 1.00 0.00 H TER 12993 WAT 828 ATOM 12993 O WAT 829 46.432 20.478 115.606 1.00 0.00 O ATOM 12994 H1 WAT 829 46.901 20.651 116.422 1.00 0.00 H ATOM 12995 H2 WAT 829 45.686 19.939 115.868 1.00 0.00 H TER 12997 WAT 829 ATOM 12997 O WAT 830 125.635 71.319 157.024 1.00 0.00 O ATOM 12998 H1 WAT 830 125.145 70.785 156.398 1.00 0.00 H ATOM 12999 H2 WAT 830 126.549 71.073 156.884 1.00 0.00 H TER 13001 WAT 830 ATOM 13001 O WAT 831 8.708 46.294 130.116 1.00 0.00 O ATOM 13002 H1 WAT 831 9.090 45.633 130.694 1.00 0.00 H ATOM 13003 H2 WAT 831 7.956 45.857 129.717 1.00 0.00 H TER 13005 WAT 831 ATOM 13005 O WAT 832 85.708 115.661 6.619 1.00 0.00 O ATOM 13006 H1 WAT 832 85.693 116.251 7.372 1.00 0.00 H ATOM 13007 H2 WAT 832 86.489 115.918 6.129 1.00 0.00 H TER 13009 WAT 832 ATOM 13009 O WAT 833 44.211 44.585 18.116 1.00 0.00 O ATOM 13010 H1 WAT 833 44.412 43.873 17.509 1.00 0.00 H ATOM 13011 H2 WAT 833 44.886 45.242 17.947 1.00 0.00 H TER 13013 WAT 833 ATOM 13013 O WAT 834 82.676 143.729 147.799 1.00 0.00 O ATOM 13014 H1 WAT 834 83.265 143.582 147.059 1.00 0.00 H ATOM 13015 H2 WAT 834 81.816 143.455 147.479 1.00 0.00 H TER 13017 WAT 834 ATOM 13017 O WAT 835 115.187 95.772 142.326 1.00 0.00 O ATOM 13018 H1 WAT 835 116.051 95.485 142.032 1.00 0.00 H ATOM 13019 H2 WAT 835 115.292 96.707 142.504 1.00 0.00 H TER 13021 WAT 835 ATOM 13021 O WAT 836 98.209 57.897 135.659 1.00 0.00 O ATOM 13022 H1 WAT 836 97.266 57.993 135.791 1.00 0.00 H ATOM 13023 H2 WAT 836 98.373 58.294 134.803 1.00 0.00 H TER 13025 WAT 836 ATOM 13025 O WAT 837 61.195 9.214 73.023 1.00 0.00 O ATOM 13026 H1 WAT 837 60.285 9.500 72.943 1.00 0.00 H ATOM 13027 H2 WAT 837 61.165 8.494 73.653 1.00 0.00 H TER 13029 WAT 837 ATOM 13029 O WAT 838 4.580 49.879 157.075 1.00 0.00 O ATOM 13030 H1 WAT 838 4.530 50.232 157.964 1.00 0.00 H ATOM 13031 H2 WAT 838 5.270 50.391 156.652 1.00 0.00 H TER 13033 WAT 838 ATOM 13033 O WAT 839 46.855 35.517 17.648 1.00 0.00 O ATOM 13034 H1 WAT 839 46.397 35.972 16.942 1.00 0.00 H ATOM 13035 H2 WAT 839 47.772 35.512 17.375 1.00 0.00 H TER 13037 WAT 839 ATOM 13037 O WAT 840 11.348 48.075 58.773 1.00 0.00 O ATOM 13038 H1 WAT 840 10.687 48.556 58.276 1.00 0.00 H ATOM 13039 H2 WAT 840 12.095 48.672 58.820 1.00 0.00 H TER 13041 WAT 840 ATOM 13041 O WAT 841 37.978 130.266 72.496 1.00 0.00 O ATOM 13042 H1 WAT 841 38.058 129.330 72.316 1.00 0.00 H ATOM 13043 H2 WAT 841 38.773 130.486 72.982 1.00 0.00 H TER 13045 WAT 841 ATOM 13045 O WAT 842 57.896 120.586 100.004 1.00 0.00 O ATOM 13046 H1 WAT 842 57.700 121.063 99.198 1.00 0.00 H ATOM 13047 H2 WAT 842 58.248 119.747 99.707 1.00 0.00 H TER 13049 WAT 842 ATOM 13049 O WAT 843 1.121 138.210 17.219 1.00 0.00 O ATOM 13050 H1 WAT 843 0.762 137.323 17.183 1.00 0.00 H ATOM 13051 H2 WAT 843 1.063 138.454 18.143 1.00 0.00 H TER 13053 WAT 843 ATOM 13053 O WAT 844 114.086 26.675 150.316 1.00 0.00 O ATOM 13054 H1 WAT 844 113.582 25.880 150.140 1.00 0.00 H ATOM 13055 H2 WAT 844 114.699 26.423 151.006 1.00 0.00 H TER 13057 WAT 844 ATOM 13057 O WAT 845 112.818 10.834 20.163 1.00 0.00 O ATOM 13058 H1 WAT 845 112.466 10.029 19.783 1.00 0.00 H ATOM 13059 H2 WAT 845 112.461 10.857 21.050 1.00 0.00 H TER 13061 WAT 845 ATOM 13061 O WAT 846 28.284 105.229 87.867 1.00 0.00 O ATOM 13062 H1 WAT 846 27.361 105.033 88.026 1.00 0.00 H ATOM 13063 H2 WAT 846 28.728 104.387 87.967 1.00 0.00 H TER 13065 WAT 846 ATOM 13065 O WAT 847 47.950 61.111 92.124 1.00 0.00 O ATOM 13066 H1 WAT 847 47.893 60.160 92.216 1.00 0.00 H ATOM 13067 H2 WAT 847 48.083 61.253 91.187 1.00 0.00 H TER 13069 WAT 847 ATOM 13069 O WAT 848 34.392 0.514 58.396 1.00 0.00 O ATOM 13070 H1 WAT 848 33.895 1.004 57.741 1.00 0.00 H ATOM 13071 H2 WAT 848 34.411 1.089 59.161 1.00 0.00 H TER 13073 WAT 848 ATOM 13073 O WAT 849 12.105 19.099 146.079 1.00 0.00 O ATOM 13074 H1 WAT 849 12.945 18.869 145.681 1.00 0.00 H ATOM 13075 H2 WAT 849 12.282 19.904 146.564 1.00 0.00 H TER 13077 WAT 849 ATOM 13077 O WAT 850 123.211 12.769 143.461 1.00 0.00 O ATOM 13078 H1 WAT 850 123.270 12.701 142.508 1.00 0.00 H ATOM 13079 H2 WAT 850 122.560 13.454 143.611 1.00 0.00 H TER 13081 WAT 850 ATOM 13081 O WAT 851 99.229 96.046 92.973 1.00 0.00 O ATOM 13082 H1 WAT 851 99.414 96.818 92.437 1.00 0.00 H ATOM 13083 H2 WAT 851 98.613 96.357 93.636 1.00 0.00 H TER 13085 WAT 851 ATOM 13085 O WAT 852 48.062 63.850 92.298 1.00 0.00 O ATOM 13086 H1 WAT 852 48.599 64.299 92.952 1.00 0.00 H ATOM 13087 H2 WAT 852 48.067 62.933 92.572 1.00 0.00 H TER 13089 WAT 852 ATOM 13089 O WAT 853 64.991 67.963 140.628 1.00 0.00 O ATOM 13090 H1 WAT 853 65.901 67.687 140.515 1.00 0.00 H ATOM 13091 H2 WAT 853 64.495 67.403 140.031 1.00 0.00 H TER 13093 WAT 853 ATOM 13093 O WAT 854 31.939 107.328 2.228 1.00 0.00 O ATOM 13094 H1 WAT 854 32.529 107.492 2.964 1.00 0.00 H ATOM 13095 H2 WAT 854 31.204 107.924 2.372 1.00 0.00 H TER 13097 WAT 854 ATOM 13097 O WAT 855 49.529 92.061 144.417 1.00 0.00 O ATOM 13098 H1 WAT 855 48.778 92.598 144.670 1.00 0.00 H ATOM 13099 H2 WAT 855 50.050 91.988 145.216 1.00 0.00 H TER 13101 WAT 855 ATOM 13101 O WAT 856 59.685 32.681 76.000 1.00 0.00 O ATOM 13102 H1 WAT 856 60.089 33.309 76.598 1.00 0.00 H ATOM 13103 H2 WAT 856 60.170 32.784 75.181 1.00 0.00 H TER 13105 WAT 856 ATOM 13105 O WAT 857 44.131 44.116 62.347 1.00 0.00 O ATOM 13106 H1 WAT 857 43.290 44.166 61.892 1.00 0.00 H ATOM 13107 H2 WAT 857 44.572 43.363 61.953 1.00 0.00 H TER 13109 WAT 857 ATOM 13109 O WAT 858 16.540 13.434 103.987 1.00 0.00 O ATOM 13110 H1 WAT 858 16.241 13.610 104.879 1.00 0.00 H ATOM 13111 H2 WAT 858 16.644 12.483 103.952 1.00 0.00 H TER 13113 WAT 858 ATOM 13113 O WAT 859 114.257 59.251 77.657 1.00 0.00 O ATOM 13114 H1 WAT 859 114.467 58.396 77.282 1.00 0.00 H ATOM 13115 H2 WAT 859 114.445 59.874 76.955 1.00 0.00 H TER 13117 WAT 859 ATOM 13117 O WAT 860 38.315 44.231 105.651 1.00 0.00 O ATOM 13118 H1 WAT 860 37.751 44.712 105.046 1.00 0.00 H ATOM 13119 H2 WAT 860 38.325 43.336 105.310 1.00 0.00 H TER 13121 WAT 860 ATOM 13121 O WAT 861 30.826 13.311 106.059 1.00 0.00 O ATOM 13122 H1 WAT 861 30.124 12.761 105.710 1.00 0.00 H ATOM 13123 H2 WAT 861 31.586 12.730 106.103 1.00 0.00 H TER 13125 WAT 861 ATOM 13125 O WAT 862 110.697 50.591 144.490 1.00 0.00 O ATOM 13126 H1 WAT 862 110.197 51.288 144.915 1.00 0.00 H ATOM 13127 H2 WAT 862 111.021 50.988 143.681 1.00 0.00 H TER 13129 WAT 862 ATOM 13129 O WAT 863 122.492 47.038 109.708 1.00 0.00 O ATOM 13130 H1 WAT 863 122.204 47.322 110.576 1.00 0.00 H ATOM 13131 H2 WAT 863 122.836 46.156 109.847 1.00 0.00 H TER 13133 WAT 863 ATOM 13133 O WAT 864 87.012 103.425 114.797 1.00 0.00 O ATOM 13134 H1 WAT 864 86.418 103.007 115.421 1.00 0.00 H ATOM 13135 H2 WAT 864 86.486 103.540 114.006 1.00 0.00 H TER 13137 WAT 864 ATOM 13137 O WAT 865 72.932 128.287 66.568 1.00 0.00 O ATOM 13138 H1 WAT 865 72.599 128.588 67.414 1.00 0.00 H ATOM 13139 H2 WAT 865 73.697 128.837 66.403 1.00 0.00 H TER 13141 WAT 865 ATOM 13141 O WAT 866 144.781 62.089 121.193 1.00 0.00 O ATOM 13142 H1 WAT 866 145.647 62.496 121.209 1.00 0.00 H ATOM 13143 H2 WAT 866 144.174 62.824 121.102 1.00 0.00 H TER 13145 WAT 866 ATOM 13145 O WAT 867 1.864 136.236 145.996 1.00 0.00 O ATOM 13146 H1 WAT 867 1.580 135.689 145.263 1.00 0.00 H ATOM 13147 H2 WAT 867 2.696 135.852 146.272 1.00 0.00 H TER 13149 WAT 867 ATOM 13149 O WAT 868 76.210 125.572 116.365 1.00 0.00 O ATOM 13150 H1 WAT 868 76.479 124.744 115.968 1.00 0.00 H ATOM 13151 H2 WAT 868 75.274 125.637 116.174 1.00 0.00 H TER 13153 WAT 868 ATOM 13153 O WAT 869 7.488 34.014 73.692 1.00 0.00 O ATOM 13154 H1 WAT 869 8.041 33.326 74.063 1.00 0.00 H ATOM 13155 H2 WAT 869 7.666 33.984 72.752 1.00 0.00 H TER 13157 WAT 869 ATOM 13157 O WAT 870 58.709 24.246 9.586 1.00 0.00 O ATOM 13158 H1 WAT 870 58.514 23.415 9.152 1.00 0.00 H ATOM 13159 H2 WAT 870 58.416 24.914 8.966 1.00 0.00 H TER 13161 WAT 870 ATOM 13161 O WAT 871 15.104 58.354 48.195 1.00 0.00 O ATOM 13162 H1 WAT 871 14.248 58.772 48.289 1.00 0.00 H ATOM 13163 H2 WAT 871 14.904 57.429 48.052 1.00 0.00 H TER 13165 WAT 871 ATOM 13165 O WAT 872 25.953 115.173 111.739 1.00 0.00 O ATOM 13166 H1 WAT 872 25.256 115.725 111.383 1.00 0.00 H ATOM 13167 H2 WAT 872 26.762 115.634 111.514 1.00 0.00 H TER 13169 WAT 872 ATOM 13169 O WAT 873 107.839 86.571 6.829 1.00 0.00 O ATOM 13170 H1 WAT 873 107.706 87.047 7.649 1.00 0.00 H ATOM 13171 H2 WAT 873 108.348 87.170 6.283 1.00 0.00 H TER 13173 WAT 873 ATOM 13173 O WAT 874 60.226 101.403 111.274 1.00 0.00 O ATOM 13174 H1 WAT 874 59.647 100.925 111.867 1.00 0.00 H ATOM 13175 H2 WAT 874 61.104 101.254 111.624 1.00 0.00 H TER 13177 WAT 874 ATOM 13177 O WAT 875 6.581 9.736 0.625 1.00 0.00 O ATOM 13178 H1 WAT 875 5.911 9.148 0.973 1.00 0.00 H ATOM 13179 H2 WAT 875 7.410 9.305 0.833 1.00 0.00 H TER 13181 WAT 875 ATOM 13181 O WAT 876 20.494 122.690 98.096 1.00 0.00 O ATOM 13182 H1 WAT 876 20.227 122.556 99.005 1.00 0.00 H ATOM 13183 H2 WAT 876 20.983 123.513 98.109 1.00 0.00 H TER 13185 WAT 876 ATOM 13185 O WAT 877 94.360 107.831 109.035 1.00 0.00 O ATOM 13186 H1 WAT 877 93.959 107.032 108.692 1.00 0.00 H ATOM 13187 H2 WAT 877 95.010 107.520 109.666 1.00 0.00 H TER 13189 WAT 877 ATOM 13189 O WAT 878 32.313 111.407 125.970 1.00 0.00 O ATOM 13190 H1 WAT 878 31.670 110.758 126.255 1.00 0.00 H ATOM 13191 H2 WAT 878 32.572 111.856 126.775 1.00 0.00 H TER 13193 WAT 878 ATOM 13193 O WAT 879 64.973 13.608 80.766 1.00 0.00 O ATOM 13194 H1 WAT 879 64.596 13.232 79.971 1.00 0.00 H ATOM 13195 H2 WAT 879 65.241 14.491 80.509 1.00 0.00 H TER 13197 WAT 879 ATOM 13197 O WAT 880 61.840 41.457 80.185 1.00 0.00 O ATOM 13198 H1 WAT 880 62.587 41.955 79.853 1.00 0.00 H ATOM 13199 H2 WAT 880 61.756 41.733 81.098 1.00 0.00 H TER 13201 WAT 880 ATOM 13201 O WAT 881 1.093 33.217 1.325 1.00 0.00 O ATOM 13202 H1 WAT 881 1.777 33.070 0.671 1.00 0.00 H ATOM 13203 H2 WAT 881 0.359 33.576 0.826 1.00 0.00 H TER 13205 WAT 881 ATOM 13205 O WAT 882 46.959 73.027 22.734 1.00 0.00 O ATOM 13206 H1 WAT 882 46.970 72.795 21.806 1.00 0.00 H ATOM 13207 H2 WAT 882 47.882 73.044 22.987 1.00 0.00 H TER 13209 WAT 882 ATOM 13209 O WAT 883 53.745 22.600 8.267 1.00 0.00 O ATOM 13210 H1 WAT 883 53.529 21.812 8.766 1.00 0.00 H ATOM 13211 H2 WAT 883 53.743 23.303 8.917 1.00 0.00 H TER 13213 WAT 883 ATOM 13213 O WAT 884 80.824 16.059 76.341 1.00 0.00 O ATOM 13214 H1 WAT 884 81.070 15.755 75.467 1.00 0.00 H ATOM 13215 H2 WAT 884 80.214 15.394 76.662 1.00 0.00 H TER 13217 WAT 884 ATOM 13217 O WAT 885 21.654 125.084 86.507 1.00 0.00 O ATOM 13218 H1 WAT 885 22.291 125.765 86.722 1.00 0.00 H ATOM 13219 H2 WAT 885 21.300 125.346 85.657 1.00 0.00 H TER 13221 WAT 885 ATOM 13221 O WAT 886 25.462 40.183 74.180 1.00 0.00 O ATOM 13222 H1 WAT 886 25.784 39.578 73.512 1.00 0.00 H ATOM 13223 H2 WAT 886 26.220 40.345 74.742 1.00 0.00 H TER 13225 WAT 886 ATOM 13225 O WAT 887 83.183 128.543 64.436 1.00 0.00 O ATOM 13226 H1 WAT 887 82.882 127.635 64.432 1.00 0.00 H ATOM 13227 H2 WAT 887 83.929 128.545 65.037 1.00 0.00 H TER 13229 WAT 887 ATOM 13229 O WAT 888 135.450 77.523 96.930 1.00 0.00 O ATOM 13230 H1 WAT 888 136.133 78.179 97.072 1.00 0.00 H ATOM 13231 H2 WAT 888 134.720 78.015 96.554 1.00 0.00 H TER 13233 WAT 888 ATOM 13233 O WAT 889 105.429 88.928 99.005 1.00 0.00 O ATOM 13234 H1 WAT 889 106.378 88.851 99.107 1.00 0.00 H ATOM 13235 H2 WAT 889 105.158 88.089 98.634 1.00 0.00 H TER 13237 WAT 889 ATOM 13237 O WAT 890 59.390 123.223 135.853 1.00 0.00 O ATOM 13238 H1 WAT 890 58.634 122.906 136.348 1.00 0.00 H ATOM 13239 H2 WAT 890 60.125 122.704 136.179 1.00 0.00 H TER 13241 WAT 890 ATOM 13241 O WAT 891 8.570 7.469 146.173 1.00 0.00 O ATOM 13242 H1 WAT 891 7.658 7.757 146.214 1.00 0.00 H ATOM 13243 H2 WAT 891 8.960 8.006 145.482 1.00 0.00 H TER 13245 WAT 891 ATOM 13245 O WAT 892 101.437 81.677 137.507 1.00 0.00 O ATOM 13246 H1 WAT 892 101.798 81.465 136.647 1.00 0.00 H ATOM 13247 H2 WAT 892 102.166 82.079 137.981 1.00 0.00 H TER 13249 WAT 892 ATOM 13249 O WAT 893 70.360 98.166 109.165 1.00 0.00 O ATOM 13250 H1 WAT 893 71.209 98.445 108.823 1.00 0.00 H ATOM 13251 H2 WAT 893 69.849 98.974 109.224 1.00 0.00 H TER 13253 WAT 893 ATOM 13253 O WAT 894 129.925 96.652 66.594 1.00 0.00 O ATOM 13254 H1 WAT 894 129.939 95.702 66.484 1.00 0.00 H ATOM 13255 H2 WAT 894 130.177 96.791 67.507 1.00 0.00 H TER 13257 WAT 894 ATOM 13257 O WAT 895 89.512 50.885 129.517 1.00 0.00 O ATOM 13258 H1 WAT 895 89.165 50.351 130.231 1.00 0.00 H ATOM 13259 H2 WAT 895 88.759 51.043 128.947 1.00 0.00 H TER 13261 WAT 895 ATOM 13261 O WAT 896 15.007 121.235 19.413 1.00 0.00 O ATOM 13262 H1 WAT 896 14.612 121.786 20.088 1.00 0.00 H ATOM 13263 H2 WAT 896 14.754 120.343 19.652 1.00 0.00 H TER 13265 WAT 896 ATOM 13265 O WAT 897 72.425 2.325 91.515 1.00 0.00 O ATOM 13266 H1 WAT 897 71.809 1.683 91.868 1.00 0.00 H ATOM 13267 H2 WAT 897 71.887 2.898 90.969 1.00 0.00 H TER 13269 WAT 897 ATOM 13269 O WAT 898 128.888 0.213 68.980 1.00 0.00 O ATOM 13270 H1 WAT 898 129.446 0.323 68.210 1.00 0.00 H ATOM 13271 H2 WAT 898 129.487 0.287 69.723 1.00 0.00 H TER 13273 WAT 898 ATOM 13273 O WAT 899 107.182 43.503 158.115 1.00 0.00 O ATOM 13274 H1 WAT 899 107.726 42.891 157.619 1.00 0.00 H ATOM 13275 H2 WAT 899 106.634 43.926 157.453 1.00 0.00 H TER 13277 WAT 899 ATOM 13277 O WAT 900 83.254 47.119 15.039 1.00 0.00 O ATOM 13278 H1 WAT 900 83.034 47.524 15.878 1.00 0.00 H ATOM 13279 H2 WAT 900 83.375 46.192 15.246 1.00 0.00 H TER 13281 WAT 900 ATOM 13281 O WAT 901 47.355 68.658 150.426 1.00 0.00 O ATOM 13282 H1 WAT 901 46.547 68.164 150.286 1.00 0.00 H ATOM 13283 H2 WAT 901 48.054 68.023 150.273 1.00 0.00 H TER 13285 WAT 901 ATOM 13285 O WAT 902 0.581 69.370 71.453 1.00 0.00 O ATOM 13286 H1 WAT 902 -0.160 68.765 71.458 1.00 0.00 H ATOM 13287 H2 WAT 902 1.331 68.833 71.709 1.00 0.00 H TER 13289 WAT 902 ATOM 13289 O WAT 903 121.118 107.933 140.257 1.00 0.00 O ATOM 13290 H1 WAT 903 121.313 107.011 140.421 1.00 0.00 H ATOM 13291 H2 WAT 903 121.260 108.044 139.317 1.00 0.00 H TER 13293 WAT 903 ATOM 13293 O WAT 904 84.278 77.141 5.774 1.00 0.00 O ATOM 13294 H1 WAT 904 85.125 77.050 5.337 1.00 0.00 H ATOM 13295 H2 WAT 904 83.666 76.666 5.211 1.00 0.00 H TER 13297 WAT 904 ATOM 13297 O WAT 905 83.932 70.669 20.224 1.00 0.00 O ATOM 13298 H1 WAT 905 84.247 69.907 19.738 1.00 0.00 H ATOM 13299 H2 WAT 905 82.983 70.660 20.095 1.00 0.00 H TER 13301 WAT 905 ATOM 13301 O WAT 906 131.892 66.967 118.096 1.00 0.00 O ATOM 13302 H1 WAT 906 131.621 67.783 118.517 1.00 0.00 H ATOM 13303 H2 WAT 906 131.312 66.885 117.338 1.00 0.00 H TER 13305 WAT 906 ATOM 13305 O WAT 907 46.812 143.513 112.227 1.00 0.00 O ATOM 13306 H1 WAT 907 46.370 144.249 112.651 1.00 0.00 H ATOM 13307 H2 WAT 907 46.536 143.563 111.312 1.00 0.00 H TER 13309 WAT 907 ATOM 13309 O WAT 908 44.306 109.363 86.908 1.00 0.00 O ATOM 13310 H1 WAT 908 44.250 108.410 86.975 1.00 0.00 H ATOM 13311 H2 WAT 908 43.757 109.583 86.156 1.00 0.00 H TER 13313 WAT 908 ATOM 13313 O WAT 909 2.235 44.826 132.917 1.00 0.00 O ATOM 13314 H1 WAT 909 1.925 45.731 132.941 1.00 0.00 H ATOM 13315 H2 WAT 909 1.441 44.304 132.802 1.00 0.00 H TER 13317 WAT 909 ATOM 13317 O WAT 910 143.708 32.929 97.384 1.00 0.00 O ATOM 13318 H1 WAT 910 144.299 33.639 97.631 1.00 0.00 H ATOM 13319 H2 WAT 910 144.189 32.130 97.601 1.00 0.00 H TER 13321 WAT 910 ATOM 13321 O WAT 911 15.300 112.278 12.191 1.00 0.00 O ATOM 13322 H1 WAT 911 14.347 112.284 12.280 1.00 0.00 H ATOM 13323 H2 WAT 911 15.625 112.270 13.091 1.00 0.00 H TER 13325 WAT 911 ATOM 13325 O WAT 912 50.403 122.782 112.614 1.00 0.00 O ATOM 13326 H1 WAT 912 50.959 123.325 112.055 1.00 0.00 H ATOM 13327 H2 WAT 912 50.584 121.885 112.332 1.00 0.00 H TER 13329 WAT 912 ATOM 13329 O WAT 913 102.618 4.667 147.063 1.00 0.00 O ATOM 13330 H1 WAT 913 103.522 4.977 146.997 1.00 0.00 H ATOM 13331 H2 WAT 913 102.680 3.721 146.931 1.00 0.00 H TER 13333 WAT 913 ATOM 13333 O WAT 914 121.718 71.003 155.979 1.00 0.00 O ATOM 13334 H1 WAT 914 122.386 71.550 155.568 1.00 0.00 H ATOM 13335 H2 WAT 914 120.968 71.053 155.386 1.00 0.00 H TER 13337 WAT 914 ATOM 13337 O WAT 915 43.976 64.817 93.164 1.00 0.00 O ATOM 13338 H1 WAT 915 44.113 64.484 92.277 1.00 0.00 H ATOM 13339 H2 WAT 915 43.815 65.753 93.047 1.00 0.00 H TER 13341 WAT 915 ATOM 13341 O WAT 916 6.907 56.373 134.825 1.00 0.00 O ATOM 13342 H1 WAT 916 6.117 56.710 135.248 1.00 0.00 H ATOM 13343 H2 WAT 916 7.625 56.687 135.375 1.00 0.00 H TER 13345 WAT 916 ATOM 13345 O WAT 917 39.354 17.174 96.887 1.00 0.00 O ATOM 13346 H1 WAT 917 40.026 17.697 96.451 1.00 0.00 H ATOM 13347 H2 WAT 917 39.824 16.709 97.579 1.00 0.00 H TER 13349 WAT 917 ATOM 13349 O WAT 918 126.038 93.356 80.958 1.00 0.00 O ATOM 13350 H1 WAT 918 125.164 93.332 80.569 1.00 0.00 H ATOM 13351 H2 WAT 918 126.405 94.193 80.672 1.00 0.00 H TER 13353 WAT 918 ATOM 13353 O WAT 919 34.697 8.926 96.224 1.00 0.00 O ATOM 13354 H1 WAT 919 33.799 9.237 96.107 1.00 0.00 H ATOM 13355 H2 WAT 919 34.928 8.537 95.381 1.00 0.00 H TER 13357 WAT 919 ATOM 13357 O WAT 920 128.417 66.689 69.118 1.00 0.00 O ATOM 13358 H1 WAT 920 127.751 66.032 68.917 1.00 0.00 H ATOM 13359 H2 WAT 920 129.211 66.362 68.694 1.00 0.00 H TER 13361 WAT 920 ATOM 13361 O WAT 921 110.153 57.837 105.717 1.00 0.00 O ATOM 13362 H1 WAT 921 110.133 58.568 106.334 1.00 0.00 H ATOM 13363 H2 WAT 921 109.847 57.086 106.225 1.00 0.00 H TER 13365 WAT 921 ATOM 13365 O WAT 922 28.569 77.926 94.169 1.00 0.00 O ATOM 13366 H1 WAT 922 28.839 77.259 93.537 1.00 0.00 H ATOM 13367 H2 WAT 922 28.716 78.757 93.718 1.00 0.00 H TER 13369 WAT 922 ATOM 13369 O WAT 923 69.827 13.436 154.392 1.00 0.00 O ATOM 13370 H1 WAT 923 69.515 14.305 154.140 1.00 0.00 H ATOM 13371 H2 WAT 923 70.083 13.024 153.567 1.00 0.00 H TER 13373 WAT 923 ATOM 13373 O WAT 924 1.906 103.882 95.761 1.00 0.00 O ATOM 13374 H1 WAT 924 2.656 103.394 95.421 1.00 0.00 H ATOM 13375 H2 WAT 924 2.219 104.258 96.584 1.00 0.00 H TER 13377 WAT 924 ATOM 13377 O WAT 925 85.008 57.316 143.473 1.00 0.00 O ATOM 13378 H1 WAT 925 84.719 56.461 143.155 1.00 0.00 H ATOM 13379 H2 WAT 925 85.589 57.115 144.207 1.00 0.00 H TER 13381 WAT 925 ATOM 13381 O WAT 926 3.500 13.824 110.297 1.00 0.00 O ATOM 13382 H1 WAT 926 3.242 13.005 110.719 1.00 0.00 H ATOM 13383 H2 WAT 926 2.675 14.220 110.017 1.00 0.00 H TER 13385 WAT 926 ATOM 13385 O WAT 927 108.410 88.188 156.613 1.00 0.00 O ATOM 13386 H1 WAT 927 108.000 87.326 156.685 1.00 0.00 H ATOM 13387 H2 WAT 927 109.285 88.010 156.267 1.00 0.00 H TER 13389 WAT 927 ATOM 13389 O WAT 928 122.316 103.077 87.323 1.00 0.00 O ATOM 13390 H1 WAT 928 122.207 103.155 86.375 1.00 0.00 H ATOM 13391 H2 WAT 928 122.544 102.158 87.463 1.00 0.00 H TER 13393 WAT 928 ATOM 13393 O WAT 929 95.368 137.767 56.493 1.00 0.00 O ATOM 13394 H1 WAT 929 96.003 138.157 55.892 1.00 0.00 H ATOM 13395 H2 WAT 929 95.165 136.915 56.107 1.00 0.00 H TER 13397 WAT 929 ATOM 13397 O WAT 930 6.480 1.906 98.517 1.00 0.00 O ATOM 13398 H1 WAT 930 5.856 1.778 97.802 1.00 0.00 H ATOM 13399 H2 WAT 930 6.483 2.852 98.665 1.00 0.00 H TER 13401 WAT 930 ATOM 13401 O WAT 931 86.044 59.204 8.196 1.00 0.00 O ATOM 13402 H1 WAT 931 85.747 60.044 7.848 1.00 0.00 H ATOM 13403 H2 WAT 931 86.335 58.715 7.426 1.00 0.00 H TER 13405 WAT 931 ATOM 13405 O WAT 932 139.455 55.788 99.389 1.00 0.00 O ATOM 13406 H1 WAT 932 139.098 55.386 98.597 1.00 0.00 H ATOM 13407 H2 WAT 932 138.898 56.551 99.542 1.00 0.00 H TER 13409 WAT 932 ATOM 13409 O WAT 933 105.579 74.348 103.325 1.00 0.00 O ATOM 13410 H1 WAT 933 106.001 75.203 103.414 1.00 0.00 H ATOM 13411 H2 WAT 933 104.707 74.546 102.984 1.00 0.00 H TER 13413 WAT 933 ATOM 13413 O WAT 934 51.915 26.302 76.335 1.00 0.00 O ATOM 13414 H1 WAT 934 51.008 26.388 76.627 1.00 0.00 H ATOM 13415 H2 WAT 934 52.273 25.594 76.871 1.00 0.00 H TER 13417 WAT 934 ATOM 13417 O WAT 935 102.299 19.984 108.834 1.00 0.00 O ATOM 13418 H1 WAT 935 101.533 20.415 108.454 1.00 0.00 H ATOM 13419 H2 WAT 935 102.373 19.160 108.354 1.00 0.00 H TER 13421 WAT 935 ATOM 13421 O WAT 936 113.377 37.402 64.047 1.00 0.00 O ATOM 13422 H1 WAT 936 114.136 37.965 64.195 1.00 0.00 H ATOM 13423 H2 WAT 936 112.635 38.005 64.009 1.00 0.00 H TER 13425 WAT 936 ATOM 13425 O WAT 937 8.086 102.169 154.544 1.00 0.00 O ATOM 13426 H1 WAT 937 7.802 102.901 153.997 1.00 0.00 H ATOM 13427 H2 WAT 937 7.297 101.901 155.015 1.00 0.00 H TER 13429 WAT 937 ATOM 13429 O WAT 938 51.853 54.511 135.214 1.00 0.00 O ATOM 13430 H1 WAT 938 50.928 54.750 135.144 1.00 0.00 H ATOM 13431 H2 WAT 938 51.892 53.928 135.972 1.00 0.00 H TER 13433 WAT 938 ATOM 13433 O WAT 939 99.246 95.374 153.798 1.00 0.00 O ATOM 13434 H1 WAT 939 99.582 94.490 153.654 1.00 0.00 H ATOM 13435 H2 WAT 939 98.318 95.319 153.568 1.00 0.00 H TER 13437 WAT 939 ATOM 13437 O WAT 940 113.085 70.651 24.505 1.00 0.00 O ATOM 13438 H1 WAT 940 112.149 70.848 24.491 1.00 0.00 H ATOM 13439 H2 WAT 940 113.150 69.834 25.000 1.00 0.00 H TER 13441 WAT 940 ATOM 13441 O WAT 941 100.104 99.205 18.334 1.00 0.00 O ATOM 13442 H1 WAT 941 100.354 99.959 18.868 1.00 0.00 H ATOM 13443 H2 WAT 941 100.295 98.446 18.885 1.00 0.00 H TER 13445 WAT 941 ATOM 13445 O WAT 942 44.476 123.809 128.043 1.00 0.00 O ATOM 13446 H1 WAT 942 43.791 123.853 128.710 1.00 0.00 H ATOM 13447 H2 WAT 942 45.097 123.162 128.380 1.00 0.00 H TER 13449 WAT 942 ATOM 13449 O WAT 943 14.677 75.796 145.067 1.00 0.00 O ATOM 13450 H1 WAT 943 15.094 75.834 145.927 1.00 0.00 H ATOM 13451 H2 WAT 943 15.181 76.407 144.529 1.00 0.00 H TER 13453 WAT 943 ATOM 13453 O WAT 944 24.201 126.692 13.962 1.00 0.00 O ATOM 13454 H1 WAT 944 25.051 126.545 14.376 1.00 0.00 H ATOM 13455 H2 WAT 944 23.673 125.938 14.224 1.00 0.00 H TER 13457 WAT 944 ATOM 13457 O WAT 945 56.393 66.330 103.478 1.00 0.00 O ATOM 13458 H1 WAT 945 56.078 67.219 103.315 1.00 0.00 H ATOM 13459 H2 WAT 945 55.633 65.867 103.829 1.00 0.00 H TER 13461 WAT 945 ATOM 13461 O WAT 946 128.828 91.590 18.201 1.00 0.00 O ATOM 13462 H1 WAT 946 128.485 91.847 19.057 1.00 0.00 H ATOM 13463 H2 WAT 946 129.698 91.990 18.163 1.00 0.00 H TER 13465 WAT 946 ATOM 13465 O WAT 947 114.679 84.424 153.706 1.00 0.00 O ATOM 13466 H1 WAT 947 114.316 85.061 153.090 1.00 0.00 H ATOM 13467 H2 WAT 947 115.535 84.782 153.943 1.00 0.00 H TER 13469 WAT 947 ATOM 13469 O WAT 948 75.343 101.445 90.196 1.00 0.00 O ATOM 13470 H1 WAT 948 75.305 102.398 90.113 1.00 0.00 H ATOM 13471 H2 WAT 948 75.600 101.138 89.327 1.00 0.00 H TER 13473 WAT 948 ATOM 13473 O WAT 949 43.557 112.440 93.126 1.00 0.00 O ATOM 13474 H1 WAT 949 44.040 111.614 93.090 1.00 0.00 H ATOM 13475 H2 WAT 949 42.912 112.372 92.422 1.00 0.00 H TER 13477 WAT 949 ATOM 13477 O WAT 950 73.520 70.716 96.650 1.00 0.00 O ATOM 13478 H1 WAT 950 73.116 70.309 97.417 1.00 0.00 H ATOM 13479 H2 WAT 950 72.858 71.325 96.325 1.00 0.00 H TER 13481 WAT 950 ATOM 13481 O WAT 951 137.663 139.979 71.855 1.00 0.00 O ATOM 13482 H1 WAT 951 137.567 139.644 70.963 1.00 0.00 H ATOM 13483 H2 WAT 951 136.916 139.614 72.329 1.00 0.00 H TER 13485 WAT 951 ATOM 13485 O WAT 952 135.341 73.636 95.068 1.00 0.00 O ATOM 13486 H1 WAT 952 134.872 73.337 94.289 1.00 0.00 H ATOM 13487 H2 WAT 952 136.028 72.983 95.200 1.00 0.00 H TER 13489 WAT 952 ATOM 13489 O WAT 953 35.663 115.449 133.874 1.00 0.00 O ATOM 13490 H1 WAT 953 35.128 114.847 133.356 1.00 0.00 H ATOM 13491 H2 WAT 953 35.151 116.258 133.905 1.00 0.00 H TER 13493 WAT 953 ATOM 13493 O WAT 954 99.792 122.068 145.338 1.00 0.00 O ATOM 13494 H1 WAT 954 100.582 121.915 145.856 1.00 0.00 H ATOM 13495 H2 WAT 954 99.940 122.917 144.920 1.00 0.00 H TER 13497 WAT 954 ATOM 13497 O WAT 955 68.679 138.431 78.363 1.00 0.00 O ATOM 13498 H1 WAT 955 69.612 138.644 78.375 1.00 0.00 H ATOM 13499 H2 WAT 955 68.641 137.539 78.019 1.00 0.00 H TER 13501 WAT 955 ATOM 13501 O WAT 956 117.557 9.774 6.935 1.00 0.00 O ATOM 13502 H1 WAT 956 117.070 9.234 6.313 1.00 0.00 H ATOM 13503 H2 WAT 956 118.144 10.297 6.390 1.00 0.00 H TER 13505 WAT 956 ATOM 13505 O WAT 957 89.567 3.391 127.555 1.00 0.00 O ATOM 13506 H1 WAT 957 89.058 2.879 128.183 1.00 0.00 H ATOM 13507 H2 WAT 957 90.289 3.752 128.069 1.00 0.00 H TER 13509 WAT 957 ATOM 13509 O WAT 958 26.387 135.019 113.570 1.00 0.00 O ATOM 13510 H1 WAT 958 26.532 134.654 114.443 1.00 0.00 H ATOM 13511 H2 WAT 958 26.245 134.254 113.012 1.00 0.00 H TER 13513 WAT 958 ATOM 13513 O WAT 959 6.310 119.785 126.057 1.00 0.00 O ATOM 13514 H1 WAT 959 6.060 118.873 126.205 1.00 0.00 H ATOM 13515 H2 WAT 959 6.354 119.869 125.105 1.00 0.00 H TER 13517 WAT 959 ATOM 13517 O WAT 960 64.055 21.957 72.226 1.00 0.00 O ATOM 13518 H1 WAT 960 64.532 22.708 72.577 1.00 0.00 H ATOM 13519 H2 WAT 960 64.350 21.217 72.757 1.00 0.00 H TER 13521 WAT 960 ATOM 13521 O WAT 961 74.017 58.980 108.095 1.00 0.00 O ATOM 13522 H1 WAT 961 74.156 59.875 107.784 1.00 0.00 H ATOM 13523 H2 WAT 961 74.821 58.517 107.861 1.00 0.00 H TER 13525 WAT 961 ATOM 13525 O WAT 962 38.326 7.952 20.537 1.00 0.00 O ATOM 13526 H1 WAT 962 38.934 8.408 21.119 1.00 0.00 H ATOM 13527 H2 WAT 962 38.534 7.025 20.652 1.00 0.00 H TER 13529 WAT 962 ATOM 13529 O WAT 963 51.951 73.961 9.806 1.00 0.00 O ATOM 13530 H1 WAT 963 52.735 74.501 9.711 1.00 0.00 H ATOM 13531 H2 WAT 963 51.683 73.767 8.908 1.00 0.00 H TER 13533 WAT 963 ATOM 13533 O WAT 964 131.779 64.814 156.385 1.00 0.00 O ATOM 13534 H1 WAT 964 132.291 65.402 156.941 1.00 0.00 H ATOM 13535 H2 WAT 964 131.450 64.144 156.984 1.00 0.00 H TER 13537 WAT 964 ATOM 13537 O WAT 965 80.877 64.915 128.401 1.00 0.00 O ATOM 13538 H1 WAT 965 80.881 65.866 128.299 1.00 0.00 H ATOM 13539 H2 WAT 965 81.786 64.692 128.601 1.00 0.00 H TER 13541 WAT 965 ATOM 13541 O WAT 966 126.298 142.103 147.953 1.00 0.00 O ATOM 13542 H1 WAT 966 127.116 141.649 148.151 1.00 0.00 H ATOM 13543 H2 WAT 966 125.619 141.439 148.076 1.00 0.00 H TER 13545 WAT 966 ATOM 13545 O WAT 967 5.910 67.406 142.284 1.00 0.00 O ATOM 13546 H1 WAT 967 4.954 67.385 142.243 1.00 0.00 H ATOM 13547 H2 WAT 967 6.119 68.297 142.564 1.00 0.00 H TER 13549 WAT 967 ATOM 13549 O WAT 968 132.244 43.243 87.683 1.00 0.00 O ATOM 13550 H1 WAT 968 132.893 42.752 88.186 1.00 0.00 H ATOM 13551 H2 WAT 968 132.621 44.119 87.597 1.00 0.00 H TER 13553 WAT 968 ATOM 13553 O WAT 969 87.377 57.111 60.861 1.00 0.00 O ATOM 13554 H1 WAT 969 86.458 57.144 60.598 1.00 0.00 H ATOM 13555 H2 WAT 969 87.631 56.197 60.733 1.00 0.00 H TER 13557 WAT 969 ATOM 13557 O WAT 970 24.349 20.770 86.507 1.00 0.00 O ATOM 13558 H1 WAT 970 24.490 20.053 87.126 1.00 0.00 H ATOM 13559 H2 WAT 970 24.471 20.370 85.646 1.00 0.00 H TER 13561 WAT 970 ATOM 13561 O WAT 971 112.579 71.721 3.164 1.00 0.00 O ATOM 13562 H1 WAT 971 113.098 70.976 2.859 1.00 0.00 H ATOM 13563 H2 WAT 971 111.727 71.608 2.742 1.00 0.00 H TER 13565 WAT 971 ATOM 13565 O WAT 972 90.287 52.895 103.914 1.00 0.00 O ATOM 13566 H1 WAT 972 90.273 53.460 104.687 1.00 0.00 H ATOM 13567 H2 WAT 972 90.503 53.484 103.191 1.00 0.00 H TER 13569 WAT 972 ATOM 13569 O WAT 973 59.529 41.348 144.847 1.00 0.00 O ATOM 13570 H1 WAT 973 60.444 41.497 145.084 1.00 0.00 H ATOM 13571 H2 WAT 973 59.542 40.541 144.334 1.00 0.00 H TER 13573 WAT 973 ATOM 13573 O WAT 974 35.590 96.862 134.760 1.00 0.00 O ATOM 13574 H1 WAT 974 35.730 96.409 135.591 1.00 0.00 H ATOM 13575 H2 WAT 974 35.117 96.229 134.219 1.00 0.00 H TER 13577 WAT 974 ATOM 13577 O WAT 975 99.486 71.701 82.997 1.00 0.00 O ATOM 13578 H1 WAT 975 98.541 71.554 83.043 1.00 0.00 H ATOM 13579 H2 WAT 975 99.575 72.640 82.838 1.00 0.00 H TER 13581 WAT 975 ATOM 13581 O WAT 976 121.465 98.532 118.765 1.00 0.00 O ATOM 13582 H1 WAT 976 121.652 99.429 118.489 1.00 0.00 H ATOM 13583 H2 WAT 976 120.927 98.630 119.550 1.00 0.00 H TER 13585 WAT 976 ATOM 13585 O WAT 977 34.076 51.479 12.191 1.00 0.00 O ATOM 13586 H1 WAT 977 34.467 52.163 12.735 1.00 0.00 H ATOM 13587 H2 WAT 977 33.312 51.186 12.687 1.00 0.00 H TER 13589 WAT 977 ATOM 13589 O WAT 978 67.281 104.416 79.309 1.00 0.00 O ATOM 13590 H1 WAT 978 66.329 104.456 79.397 1.00 0.00 H ATOM 13591 H2 WAT 978 67.517 105.236 78.876 1.00 0.00 H TER 13593 WAT 978 ATOM 13593 O WAT 979 144.301 39.150 65.490 1.00 0.00 O ATOM 13594 H1 WAT 979 143.553 39.676 65.774 1.00 0.00 H ATOM 13595 H2 WAT 979 144.421 38.508 66.190 1.00 0.00 H TER 13597 WAT 979 ATOM 13597 O WAT 980 100.010 27.701 67.981 1.00 0.00 O ATOM 13598 H1 WAT 980 99.342 27.799 68.659 1.00 0.00 H ATOM 13599 H2 WAT 980 100.516 28.512 68.023 1.00 0.00 H TER 13601 WAT 980 ATOM 13601 O WAT 981 18.873 32.069 77.933 1.00 0.00 O ATOM 13602 H1 WAT 981 19.354 31.491 78.526 1.00 0.00 H ATOM 13603 H2 WAT 981 18.787 31.564 77.124 1.00 0.00 H TER 13605 WAT 981 ATOM 13605 O WAT 982 11.998 87.925 135.532 1.00 0.00 O ATOM 13606 H1 WAT 982 12.200 87.970 136.467 1.00 0.00 H ATOM 13607 H2 WAT 982 12.224 88.792 135.196 1.00 0.00 H TER 13609 WAT 982 ATOM 13609 O WAT 983 139.394 110.963 131.749 1.00 0.00 O ATOM 13610 H1 WAT 983 139.528 110.141 132.221 1.00 0.00 H ATOM 13611 H2 WAT 983 138.443 111.045 131.677 1.00 0.00 H TER 13613 WAT 983 ATOM 13613 O WAT 984 37.077 51.848 67.741 1.00 0.00 O ATOM 13614 H1 WAT 984 37.126 52.707 68.160 1.00 0.00 H ATOM 13615 H2 WAT 984 37.026 51.229 68.470 1.00 0.00 H TER 13617 WAT 984 ATOM 13617 O WAT 985 48.048 18.458 99.036 1.00 0.00 O ATOM 13618 H1 WAT 985 47.878 18.761 98.144 1.00 0.00 H ATOM 13619 H2 WAT 985 47.864 19.219 99.587 1.00 0.00 H TER 13621 WAT 985 ATOM 13621 O WAT 986 111.844 137.023 131.490 1.00 0.00 O ATOM 13622 H1 WAT 986 110.913 136.846 131.630 1.00 0.00 H ATOM 13623 H2 WAT 986 112.218 137.046 132.371 1.00 0.00 H TER 13625 WAT 986 ATOM 13625 O WAT 987 119.039 128.624 93.288 1.00 0.00 O ATOM 13626 H1 WAT 987 118.707 127.728 93.225 1.00 0.00 H ATOM 13627 H2 WAT 987 119.431 128.795 92.432 1.00 0.00 H TER 13629 WAT 987 ATOM 13629 O WAT 988 94.946 49.684 7.595 1.00 0.00 O ATOM 13630 H1 WAT 988 94.233 49.231 8.047 1.00 0.00 H ATOM 13631 H2 WAT 988 94.729 50.612 7.676 1.00 0.00 H TER 13633 WAT 988 ATOM 13633 O WAT 989 33.580 37.463 10.434 1.00 0.00 O ATOM 13634 H1 WAT 989 33.753 38.344 10.103 1.00 0.00 H ATOM 13635 H2 WAT 989 32.636 37.347 10.326 1.00 0.00 H TER 13637 WAT 989 ATOM 13637 O WAT 990 60.649 73.875 102.756 1.00 0.00 O ATOM 13638 H1 WAT 990 61.006 73.319 102.064 1.00 0.00 H ATOM 13639 H2 WAT 990 59.845 74.236 102.382 1.00 0.00 H TER 13641 WAT 990 ATOM 13641 O WAT 991 97.784 44.388 124.329 1.00 0.00 O ATOM 13642 H1 WAT 991 97.810 43.439 124.204 1.00 0.00 H ATOM 13643 H2 WAT 991 98.188 44.745 123.538 1.00 0.00 H TER 13645 WAT 991 ATOM 13645 O WAT 992 47.180 32.991 144.720 1.00 0.00 O ATOM 13646 H1 WAT 992 47.532 33.001 145.610 1.00 0.00 H ATOM 13647 H2 WAT 992 47.943 32.841 144.162 1.00 0.00 H TER 13649 WAT 992 ATOM 13649 O WAT 993 51.636 130.377 97.619 1.00 0.00 O ATOM 13650 H1 WAT 993 51.358 129.498 97.877 1.00 0.00 H ATOM 13651 H2 WAT 993 50.820 130.863 97.505 1.00 0.00 H TER 13653 WAT 993 ATOM 13653 O WAT 994 95.258 100.228 71.614 1.00 0.00 O ATOM 13654 H1 WAT 994 96.109 100.615 71.817 1.00 0.00 H ATOM 13655 H2 WAT 994 94.793 100.912 71.132 1.00 0.00 H TER 13657 WAT 994 ATOM 13657 O WAT 995 27.918 134.674 10.753 1.00 0.00 O ATOM 13658 H1 WAT 995 28.052 134.029 10.058 1.00 0.00 H ATOM 13659 H2 WAT 995 28.784 134.784 11.147 1.00 0.00 H TER 13661 WAT 995 ATOM 13661 O WAT 996 95.955 111.399 104.036 1.00 0.00 O ATOM 13662 H1 WAT 996 95.036 111.179 104.189 1.00 0.00 H ATOM 13663 H2 WAT 996 96.031 111.461 103.084 1.00 0.00 H TER 13665 WAT 996 ATOM 13665 O WAT 997 51.808 97.185 2.430 1.00 0.00 O ATOM 13666 H1 WAT 997 52.297 97.420 3.219 1.00 0.00 H ATOM 13667 H2 WAT 997 50.925 96.993 2.744 1.00 0.00 H TER 13669 WAT 997 ATOM 13669 O WAT 998 27.952 138.300 57.804 1.00 0.00 O ATOM 13670 H1 WAT 998 28.541 137.735 57.305 1.00 0.00 H ATOM 13671 H2 WAT 998 27.412 138.729 57.140 1.00 0.00 H TER 13673 WAT 998 ATOM 13673 O WAT 999 46.789 110.331 96.452 1.00 0.00 O ATOM 13674 H1 WAT 999 46.756 110.664 97.349 1.00 0.00 H ATOM 13675 H2 WAT 999 46.642 111.102 95.904 1.00 0.00 H TER 13677 WAT 999 ATOM 13677 O WAT 1000 92.772 82.132 7.205 1.00 0.00 O ATOM 13678 H1 WAT 1000 93.438 82.801 7.045 1.00 0.00 H ATOM 13679 H2 WAT 1000 93.064 81.378 6.692 1.00 0.00 H TER 13681 WAT 1000 ATOM 13681 O WAT 1001 12.844 122.692 94.003 1.00 0.00 O ATOM 13682 H1 WAT 1001 12.644 121.837 93.621 1.00 0.00 H ATOM 13683 H2 WAT 1001 12.489 122.646 94.891 1.00 0.00 H TER 13685 WAT 1001 ATOM 13685 O WAT 1002 98.699 43.124 115.578 1.00 0.00 O ATOM 13686 H1 WAT 1002 98.849 43.930 115.084 1.00 0.00 H ATOM 13687 H2 WAT 1002 99.577 42.798 115.775 1.00 0.00 H TER 13689 WAT 1002 ATOM 13689 O WAT 1003 108.077 33.919 81.182 1.00 0.00 O ATOM 13690 H1 WAT 1003 108.288 32.987 81.129 1.00 0.00 H ATOM 13691 H2 WAT 1003 108.728 34.279 81.784 1.00 0.00 H TER 13693 WAT 1003 ATOM 13693 O WAT 1004 125.395 21.278 156.175 1.00 0.00 O ATOM 13694 H1 WAT 1004 125.510 21.340 157.123 1.00 0.00 H ATOM 13695 H2 WAT 1004 124.453 21.386 156.041 1.00 0.00 H TER 13697 WAT 1004 ATOM 13697 O WAT 1005 52.454 127.694 123.831 1.00 0.00 O ATOM 13698 H1 WAT 1005 51.706 127.311 124.288 1.00 0.00 H ATOM 13699 H2 WAT 1005 52.454 128.613 124.097 1.00 0.00 H TER 13701 WAT 1005 ATOM 13701 O WAT 1006 137.753 33.394 85.711 1.00 0.00 O ATOM 13702 H1 WAT 1006 137.774 34.145 86.305 1.00 0.00 H ATOM 13703 H2 WAT 1006 138.632 33.020 85.767 1.00 0.00 H TER 13705 WAT 1006 ATOM 13705 O WAT 1007 66.662 41.370 99.750 1.00 0.00 O ATOM 13706 H1 WAT 1007 66.905 40.495 99.449 1.00 0.00 H ATOM 13707 H2 WAT 1007 66.927 41.390 100.670 1.00 0.00 H TER 13709 WAT 1007 ATOM 13709 O WAT 1008 42.136 58.594 89.844 1.00 0.00 O ATOM 13710 H1 WAT 1008 41.890 59.115 90.609 1.00 0.00 H ATOM 13711 H2 WAT 1008 42.197 57.698 90.174 1.00 0.00 H TER 13713 WAT 1008 ATOM 13713 O WAT 1009 63.731 48.164 153.439 1.00 0.00 O ATOM 13714 H1 WAT 1009 63.525 47.548 152.737 1.00 0.00 H ATOM 13715 H2 WAT 1009 63.993 47.611 154.175 1.00 0.00 H TER 13717 WAT 1009 ATOM 13717 O WAT 1010 42.462 100.296 149.684 1.00 0.00 O ATOM 13718 H1 WAT 1010 43.357 100.541 149.451 1.00 0.00 H ATOM 13719 H2 WAT 1010 42.542 99.411 150.040 1.00 0.00 H TER 13721 WAT 1010 ATOM 13721 O WAT 1011 36.095 31.402 147.258 1.00 0.00 O ATOM 13722 H1 WAT 1011 35.149 31.266 147.309 1.00 0.00 H ATOM 13723 H2 WAT 1011 36.219 31.940 146.476 1.00 0.00 H TER 13725 WAT 1011 ATOM 13725 O WAT 1012 61.974 4.337 154.060 1.00 0.00 O ATOM 13726 H1 WAT 1012 61.219 4.912 153.934 1.00 0.00 H ATOM 13727 H2 WAT 1012 62.656 4.713 153.504 1.00 0.00 H TER 13729 WAT 1012 ATOM 13729 O WAT 1013 50.286 107.223 90.963 1.00 0.00 O ATOM 13730 H1 WAT 1013 50.121 107.045 90.037 1.00 0.00 H ATOM 13731 H2 WAT 1013 49.438 107.501 91.308 1.00 0.00 H TER 13733 WAT 1013 ATOM 13733 O WAT 1014 4.778 77.788 61.374 1.00 0.00 O ATOM 13734 H1 WAT 1014 4.270 77.062 61.736 1.00 0.00 H ATOM 13735 H2 WAT 1014 4.134 78.479 61.220 1.00 0.00 H TER 13737 WAT 1014 ATOM 13737 O WAT 1015 3.006 129.217 18.629 1.00 0.00 O ATOM 13738 H1 WAT 1015 2.842 128.588 17.927 1.00 0.00 H ATOM 13739 H2 WAT 1015 3.837 129.629 18.393 1.00 0.00 H TER 13741 WAT 1015 ATOM 13741 O WAT 1016 116.758 77.184 120.180 1.00 0.00 O ATOM 13742 H1 WAT 1016 116.056 76.574 119.952 1.00 0.00 H ATOM 13743 H2 WAT 1016 116.714 77.863 119.507 1.00 0.00 H TER 13745 WAT 1016 ATOM 13745 O WAT 1017 18.861 93.747 19.774 1.00 0.00 O ATOM 13746 H1 WAT 1017 18.147 93.566 20.386 1.00 0.00 H ATOM 13747 H2 WAT 1017 19.470 94.292 20.271 1.00 0.00 H TER 13749 WAT 1017 ATOM 13749 O WAT 1018 71.274 65.315 131.835 1.00 0.00 O ATOM 13750 H1 WAT 1018 71.939 65.844 132.277 1.00 0.00 H ATOM 13751 H2 WAT 1018 71.681 64.455 131.732 1.00 0.00 H TER 13753 WAT 1018 ATOM 13753 O WAT 1019 78.511 90.170 130.286 1.00 0.00 O ATOM 13754 H1 WAT 1019 77.881 90.079 131.001 1.00 0.00 H ATOM 13755 H2 WAT 1019 78.795 91.083 130.331 1.00 0.00 H TER 13757 WAT 1019 ATOM 13757 O WAT 1020 70.551 130.478 122.660 1.00 0.00 O ATOM 13758 H1 WAT 1020 71.186 129.766 122.583 1.00 0.00 H ATOM 13759 H2 WAT 1020 70.187 130.380 123.540 1.00 0.00 H TER 13761 WAT 1020 ATOM 13761 O WAT 1021 144.251 89.611 97.185 1.00 0.00 O ATOM 13762 H1 WAT 1021 143.616 90.327 97.180 1.00 0.00 H ATOM 13763 H2 WAT 1021 144.026 89.086 96.416 1.00 0.00 H TER 13765 WAT 1021 ATOM 13765 O WAT 1022 4.872 122.697 109.824 1.00 0.00 O ATOM 13766 H1 WAT 1022 5.603 122.226 109.426 1.00 0.00 H ATOM 13767 H2 WAT 1022 4.518 122.086 110.471 1.00 0.00 H TER 13769 WAT 1022 ATOM 13769 O WAT 1023 70.015 43.836 154.303 1.00 0.00 O ATOM 13770 H1 WAT 1023 70.679 44.465 154.585 1.00 0.00 H ATOM 13771 H2 WAT 1023 70.022 43.894 153.347 1.00 0.00 H TER 13773 WAT 1023 ATOM 13773 O WAT 1024 67.221 71.054 115.894 1.00 0.00 O ATOM 13774 H1 WAT 1024 66.689 70.580 116.533 1.00 0.00 H ATOM 13775 H2 WAT 1024 66.665 71.781 115.611 1.00 0.00 H TER 13777 WAT 1024 ATOM 13777 O WAT 1025 79.733 94.026 103.185 1.00 0.00 O ATOM 13778 H1 WAT 1025 78.997 93.467 102.934 1.00 0.00 H ATOM 13779 H2 WAT 1025 79.946 94.514 102.390 1.00 0.00 H TER 13781 WAT 1025 ATOM 13781 O WAT 1026 109.245 37.871 79.620 1.00 0.00 O ATOM 13782 H1 WAT 1026 110.057 37.532 79.997 1.00 0.00 H ATOM 13783 H2 WAT 1026 108.906 37.147 79.092 1.00 0.00 H TER 13785 WAT 1026 ATOM 13785 O WAT 1027 26.753 9.477 116.367 1.00 0.00 O ATOM 13786 H1 WAT 1027 26.242 9.406 117.173 1.00 0.00 H ATOM 13787 H2 WAT 1027 27.095 10.371 116.379 1.00 0.00 H TER 13789 WAT 1027 ATOM 13789 O WAT 1028 126.293 55.323 116.721 1.00 0.00 O ATOM 13790 H1 WAT 1028 125.958 55.918 116.050 1.00 0.00 H ATOM 13791 H2 WAT 1028 126.035 55.727 117.549 1.00 0.00 H TER 13793 WAT 1028 ATOM 13793 O WAT 1029 37.231 122.577 134.797 1.00 0.00 O ATOM 13794 H1 WAT 1029 37.276 123.135 134.021 1.00 0.00 H ATOM 13795 H2 WAT 1029 37.223 123.189 135.533 1.00 0.00 H TER 13797 WAT 1029 ATOM 13797 O WAT 1030 8.781 98.639 77.706 1.00 0.00 O ATOM 13798 H1 WAT 1030 9.217 97.823 77.461 1.00 0.00 H ATOM 13799 H2 WAT 1030 9.164 98.871 78.552 1.00 0.00 H TER 13801 WAT 1030 ATOM 13801 O WAT 1031 36.480 87.134 147.327 1.00 0.00 O ATOM 13802 H1 WAT 1031 37.207 87.059 146.710 1.00 0.00 H ATOM 13803 H2 WAT 1031 36.768 87.792 147.960 1.00 0.00 H TER 13805 WAT 1031 ATOM 13805 O WAT 1032 58.607 26.333 150.479 1.00 0.00 O ATOM 13806 H1 WAT 1032 58.269 27.228 150.517 1.00 0.00 H ATOM 13807 H2 WAT 1032 58.282 25.921 151.280 1.00 0.00 H TER 13809 WAT 1032 ATOM 13809 O WAT 1033 143.991 22.719 69.709 1.00 0.00 O ATOM 13810 H1 WAT 1033 144.064 23.640 69.957 1.00 0.00 H ATOM 13811 H2 WAT 1033 144.897 22.424 69.614 1.00 0.00 H TER 13813 WAT 1033 ATOM 13813 O WAT 1034 131.929 62.918 103.038 1.00 0.00 O ATOM 13814 H1 WAT 1034 130.997 62.769 103.197 1.00 0.00 H ATOM 13815 H2 WAT 1034 132.371 62.419 103.725 1.00 0.00 H TER 13817 WAT 1034 ATOM 13817 O WAT 1035 20.191 3.916 131.553 1.00 0.00 O ATOM 13818 H1 WAT 1035 19.950 3.555 130.700 1.00 0.00 H ATOM 13819 H2 WAT 1035 20.389 3.149 132.090 1.00 0.00 H TER 13821 WAT 1035 ATOM 13821 O WAT 1036 127.515 90.622 3.918 1.00 0.00 O ATOM 13822 H1 WAT 1036 128.056 90.774 3.143 1.00 0.00 H ATOM 13823 H2 WAT 1036 126.999 91.423 4.010 1.00 0.00 H TER 13825 WAT 1036 ATOM 13825 O WAT 1037 25.317 143.674 99.897 1.00 0.00 O ATOM 13826 H1 WAT 1037 25.654 143.937 100.753 1.00 0.00 H ATOM 13827 H2 WAT 1037 24.862 142.848 100.061 1.00 0.00 H TER 13829 WAT 1037 ATOM 13829 O WAT 1038 83.268 15.358 130.797 1.00 0.00 O ATOM 13830 H1 WAT 1038 82.339 15.467 131.000 1.00 0.00 H ATOM 13831 H2 WAT 1038 83.337 15.578 129.868 1.00 0.00 H TER 13833 WAT 1038 ATOM 13833 O WAT 1039 19.932 77.749 122.561 1.00 0.00 O ATOM 13834 H1 WAT 1039 20.194 78.175 121.745 1.00 0.00 H ATOM 13835 H2 WAT 1039 19.342 78.377 122.979 1.00 0.00 H TER 13837 WAT 1039 ATOM 13837 O WAT 1040 6.856 97.507 156.827 1.00 0.00 O ATOM 13838 H1 WAT 1040 6.171 97.707 156.189 1.00 0.00 H ATOM 13839 H2 WAT 1040 6.387 97.134 157.573 1.00 0.00 H TER 13841 WAT 1040 ATOM 13841 O WAT 1041 125.288 10.015 84.259 1.00 0.00 O ATOM 13842 H1 WAT 1041 126.008 9.498 83.899 1.00 0.00 H ATOM 13843 H2 WAT 1041 125.093 9.602 85.100 1.00 0.00 H TER 13845 WAT 1041 ATOM 13845 O WAT 1042 73.502 128.626 118.817 1.00 0.00 O ATOM 13846 H1 WAT 1042 72.740 128.641 118.239 1.00 0.00 H ATOM 13847 H2 WAT 1042 73.164 128.909 119.667 1.00 0.00 H TER 13849 WAT 1042 ATOM 13849 O WAT 1043 12.819 84.976 16.694 1.00 0.00 O ATOM 13850 H1 WAT 1043 12.923 84.036 16.544 1.00 0.00 H ATOM 13851 H2 WAT 1043 11.878 85.096 16.818 1.00 0.00 H TER 13853 WAT 1043 ATOM 13853 O WAT 1044 85.752 91.123 109.974 1.00 0.00 O ATOM 13854 H1 WAT 1044 86.513 91.431 110.466 1.00 0.00 H ATOM 13855 H2 WAT 1044 86.066 90.349 109.507 1.00 0.00 H TER 13857 WAT 1044 ATOM 13857 O WAT 1045 126.058 127.622 72.864 1.00 0.00 O ATOM 13858 H1 WAT 1045 125.317 128.095 72.484 1.00 0.00 H ATOM 13859 H2 WAT 1045 126.317 126.999 72.185 1.00 0.00 H TER 13861 WAT 1045 ATOM 13861 O WAT 1046 18.263 35.329 84.665 1.00 0.00 O ATOM 13862 H1 WAT 1046 17.996 34.812 83.905 1.00 0.00 H ATOM 13863 H2 WAT 1046 19.206 35.182 84.735 1.00 0.00 H TER 13865 WAT 1046 ATOM 13865 O WAT 1047 9.605 102.814 76.216 1.00 0.00 O ATOM 13866 H1 WAT 1047 8.784 103.134 76.591 1.00 0.00 H ATOM 13867 H2 WAT 1047 10.167 103.588 76.174 1.00 0.00 H TER 13869 WAT 1047 ATOM 13869 O WAT 1048 122.530 100.384 127.043 1.00 0.00 O ATOM 13870 H1 WAT 1048 121.985 99.624 126.841 1.00 0.00 H ATOM 13871 H2 WAT 1048 122.262 101.047 126.407 1.00 0.00 H TER 13873 WAT 1048 ATOM 13873 O WAT 1049 133.891 29.945 133.587 1.00 0.00 O ATOM 13874 H1 WAT 1049 134.699 29.454 133.731 1.00 0.00 H ATOM 13875 H2 WAT 1049 133.405 29.852 134.407 1.00 0.00 H TER 13877 WAT 1049 ATOM 13877 O WAT 1050 54.702 61.342 14.453 1.00 0.00 O ATOM 13878 H1 WAT 1050 54.399 60.698 13.813 1.00 0.00 H ATOM 13879 H2 WAT 1050 54.915 62.116 13.933 1.00 0.00 H TER 13881 WAT 1050 ATOM 13881 O WAT 1051 30.310 86.831 70.555 1.00 0.00 O ATOM 13882 H1 WAT 1051 30.272 86.695 71.502 1.00 0.00 H ATOM 13883 H2 WAT 1051 29.882 86.058 70.186 1.00 0.00 H TER 13885 WAT 1051 ATOM 13885 O WAT 1052 54.403 82.300 71.216 1.00 0.00 O ATOM 13886 H1 WAT 1052 54.794 82.564 72.049 1.00 0.00 H ATOM 13887 H2 WAT 1052 54.983 81.614 70.886 1.00 0.00 H TER 13889 WAT 1052 ATOM 13889 O WAT 1053 25.379 37.741 100.587 1.00 0.00 O ATOM 13890 H1 WAT 1053 25.442 37.553 99.651 1.00 0.00 H ATOM 13891 H2 WAT 1053 26.146 38.281 100.775 1.00 0.00 H TER 13893 WAT 1053 ATOM 13893 O WAT 1054 112.812 76.696 12.144 1.00 0.00 O ATOM 13894 H1 WAT 1054 112.730 77.599 12.450 1.00 0.00 H ATOM 13895 H2 WAT 1054 113.522 76.724 11.502 1.00 0.00 H TER 13897 WAT 1054 ATOM 13897 O WAT 1055 52.872 26.906 18.122 1.00 0.00 O ATOM 13898 H1 WAT 1055 53.308 26.166 18.545 1.00 0.00 H ATOM 13899 H2 WAT 1055 52.733 26.618 17.219 1.00 0.00 H TER 13901 WAT 1055 ATOM 13901 O WAT 1056 124.790 102.756 15.897 1.00 0.00 O ATOM 13902 H1 WAT 1056 125.132 102.793 15.003 1.00 0.00 H ATOM 13903 H2 WAT 1056 124.681 103.672 16.150 1.00 0.00 H TER 13905 WAT 1056 ATOM 13905 O WAT 1057 122.870 126.966 101.281 1.00 0.00 O ATOM 13906 H1 WAT 1057 122.310 127.515 101.829 1.00 0.00 H ATOM 13907 H2 WAT 1057 122.262 126.385 100.824 1.00 0.00 H TER 13909 WAT 1057 ATOM 13909 O WAT 1058 37.180 109.017 13.619 1.00 0.00 O ATOM 13910 H1 WAT 1058 36.969 108.953 12.687 1.00 0.00 H ATOM 13911 H2 WAT 1058 36.590 108.392 14.041 1.00 0.00 H TER 13913 WAT 1058 ATOM 13913 O WAT 1059 144.538 145.505 135.342 1.00 0.00 O ATOM 13914 H1 WAT 1059 144.254 144.673 134.964 1.00 0.00 H ATOM 13915 H2 WAT 1059 144.468 146.132 134.622 1.00 0.00 H TER 13917 WAT 1059 ATOM 13917 O WAT 1060 31.021 38.349 112.029 1.00 0.00 O ATOM 13918 H1 WAT 1060 31.324 39.174 111.650 1.00 0.00 H ATOM 13919 H2 WAT 1060 30.094 38.304 111.794 1.00 0.00 H TER 13921 WAT 1060 ATOM 13921 O WAT 1061 57.621 142.567 109.261 1.00 0.00 O ATOM 13922 H1 WAT 1061 57.446 142.809 110.170 1.00 0.00 H ATOM 13923 H2 WAT 1061 58.507 142.887 109.094 1.00 0.00 H TER 13925 WAT 1061 ATOM 13925 O WAT 1062 78.074 71.685 10.847 1.00 0.00 O ATOM 13926 H1 WAT 1062 77.645 72.018 11.635 1.00 0.00 H ATOM 13927 H2 WAT 1062 78.382 70.812 11.091 1.00 0.00 H TER 13929 WAT 1062 ATOM 13929 O WAT 1063 87.548 105.722 154.033 1.00 0.00 O ATOM 13930 H1 WAT 1063 86.699 105.287 154.122 1.00 0.00 H ATOM 13931 H2 WAT 1063 87.360 106.513 153.528 1.00 0.00 H TER 13933 WAT 1063 ATOM 13933 O WAT 1064 30.917 94.680 132.460 1.00 0.00 O ATOM 13934 H1 WAT 1064 31.564 95.349 132.236 1.00 0.00 H ATOM 13935 H2 WAT 1064 31.299 93.862 132.143 1.00 0.00 H TER 13937 WAT 1064 ATOM 13937 O WAT 1065 25.826 105.191 77.935 1.00 0.00 O ATOM 13938 H1 WAT 1065 25.951 105.013 78.867 1.00 0.00 H ATOM 13939 H2 WAT 1065 26.585 105.721 77.689 1.00 0.00 H TER 13941 WAT 1065 ATOM 13941 O WAT 1066 22.214 31.475 12.082 1.00 0.00 O ATOM 13942 H1 WAT 1066 22.765 30.699 12.190 1.00 0.00 H ATOM 13943 H2 WAT 1066 22.659 32.156 12.586 1.00 0.00 H TER 13945 WAT 1066 ATOM 13945 O WAT 1067 67.974 11.537 65.854 1.00 0.00 O ATOM 13946 H1 WAT 1067 68.499 11.776 66.619 1.00 0.00 H ATOM 13947 H2 WAT 1067 67.554 12.354 65.588 1.00 0.00 H TER 13949 WAT 1067 ATOM 13949 O WAT 1068 70.066 97.276 26.672 1.00 0.00 O ATOM 13950 H1 WAT 1068 70.807 96.699 26.490 1.00 0.00 H ATOM 13951 H2 WAT 1068 69.841 97.096 27.585 1.00 0.00 H TER 13953 WAT 1068 ATOM 13953 O WAT 1069 91.417 88.686 59.246 1.00 0.00 O ATOM 13954 H1 WAT 1069 90.943 89.144 58.551 1.00 0.00 H ATOM 13955 H2 WAT 1069 92.038 89.334 59.579 1.00 0.00 H TER 13957 WAT 1069 ATOM 13957 O WAT 1070 127.137 47.873 150.730 1.00 0.00 O ATOM 13958 H1 WAT 1070 126.672 48.688 150.542 1.00 0.00 H ATOM 13959 H2 WAT 1070 126.476 47.189 150.618 1.00 0.00 H TER 13961 WAT 1070 ATOM 13961 O WAT 1071 70.614 69.955 108.347 1.00 0.00 O ATOM 13962 H1 WAT 1071 71.098 70.377 107.637 1.00 0.00 H ATOM 13963 H2 WAT 1071 69.704 70.212 108.203 1.00 0.00 H TER 13965 WAT 1071 ATOM 13965 O WAT 1072 136.633 115.547 6.762 1.00 0.00 O ATOM 13966 H1 WAT 1072 136.076 116.316 6.645 1.00 0.00 H ATOM 13967 H2 WAT 1072 136.148 114.834 6.346 1.00 0.00 H TER 13969 WAT 1072 ATOM 13969 O WAT 1073 104.384 49.893 155.969 1.00 0.00 O ATOM 13970 H1 WAT 1073 105.120 50.230 156.480 1.00 0.00 H ATOM 13971 H2 WAT 1073 103.616 50.062 156.515 1.00 0.00 H TER 13973 WAT 1073 ATOM 13973 O WAT 1074 110.318 144.224 85.532 1.00 0.00 O ATOM 13974 H1 WAT 1074 110.435 143.324 85.836 1.00 0.00 H ATOM 13975 H2 WAT 1074 110.352 144.752 86.330 1.00 0.00 H TER 13977 WAT 1074 ATOM 13977 O WAT 1075 58.127 89.700 110.498 1.00 0.00 O ATOM 13978 H1 WAT 1075 58.565 90.378 109.983 1.00 0.00 H ATOM 13979 H2 WAT 1075 57.195 89.832 110.326 1.00 0.00 H TER 13981 WAT 1075 ATOM 13981 O WAT 1076 144.697 127.583 76.414 1.00 0.00 O ATOM 13982 H1 WAT 1076 144.651 128.537 76.359 1.00 0.00 H ATOM 13983 H2 WAT 1076 144.433 127.382 77.312 1.00 0.00 H TER 13985 WAT 1076 ATOM 13985 O WAT 1077 53.889 51.999 10.307 1.00 0.00 O ATOM 13986 H1 WAT 1077 53.754 52.793 10.824 1.00 0.00 H ATOM 13987 H2 WAT 1077 53.869 52.299 9.398 1.00 0.00 H TER 13989 WAT 1077 ATOM 13989 O WAT 1078 31.797 30.903 17.561 1.00 0.00 O ATOM 13990 H1 WAT 1078 32.588 31.039 18.081 1.00 0.00 H ATOM 13991 H2 WAT 1078 32.063 30.291 16.875 1.00 0.00 H TER 13993 WAT 1078 ATOM 13993 O WAT 1079 57.689 96.715 88.570 1.00 0.00 O ATOM 13994 H1 WAT 1079 58.392 96.977 87.975 1.00 0.00 H ATOM 13995 H2 WAT 1079 57.964 95.861 88.903 1.00 0.00 H TER 13997 WAT 1079 ATOM 13997 O WAT 1080 11.697 48.270 21.240 1.00 0.00 O ATOM 13998 H1 WAT 1080 12.549 47.861 21.390 1.00 0.00 H ATOM 13999 H2 WAT 1080 11.238 47.663 20.660 1.00 0.00 H TER 14001 WAT 1080 ATOM 14001 O WAT 1081 143.044 76.858 145.322 1.00 0.00 O ATOM 14002 H1 WAT 1081 143.616 76.299 145.847 1.00 0.00 H ATOM 14003 H2 WAT 1081 143.171 77.736 145.682 1.00 0.00 H TER 14005 WAT 1081 ATOM 14005 O WAT 1082 65.638 103.857 115.150 1.00 0.00 O ATOM 14006 H1 WAT 1082 66.467 104.111 115.555 1.00 0.00 H ATOM 14007 H2 WAT 1082 65.133 103.467 115.863 1.00 0.00 H TER 14009 WAT 1082 ATOM 14009 O WAT 1083 67.335 110.124 144.074 1.00 0.00 O ATOM 14010 H1 WAT 1083 67.666 110.590 144.842 1.00 0.00 H ATOM 14011 H2 WAT 1083 66.383 110.184 144.149 1.00 0.00 H TER 14013 WAT 1083 ATOM 14013 O WAT 1084 35.043 125.942 10.956 1.00 0.00 O ATOM 14014 H1 WAT 1084 34.570 126.632 11.423 1.00 0.00 H ATOM 14015 H2 WAT 1084 34.892 126.133 10.030 1.00 0.00 H TER 14017 WAT 1084 ATOM 14017 O WAT 1085 39.417 61.263 120.074 1.00 0.00 O ATOM 14018 H1 WAT 1085 40.363 61.408 120.079 1.00 0.00 H ATOM 14019 H2 WAT 1085 39.193 61.116 120.993 1.00 0.00 H TER 14021 WAT 1085 ATOM 14021 O WAT 1086 67.963 102.347 138.085 1.00 0.00 O ATOM 14022 H1 WAT 1086 67.260 102.595 138.685 1.00 0.00 H ATOM 14023 H2 WAT 1086 68.707 102.887 138.352 1.00 0.00 H TER 14025 WAT 1086 ATOM 14025 O WAT 1087 67.590 17.832 81.687 1.00 0.00 O ATOM 14026 H1 WAT 1087 67.942 16.968 81.473 1.00 0.00 H ATOM 14027 H2 WAT 1087 67.118 17.701 82.510 1.00 0.00 H TER 14029 WAT 1087 ATOM 14029 O WAT 1088 0.567 62.123 142.628 1.00 0.00 O ATOM 14030 H1 WAT 1088 0.693 61.866 141.714 1.00 0.00 H ATOM 14031 H2 WAT 1088 1.099 61.503 143.127 1.00 0.00 H TER 14033 WAT 1088 ATOM 14033 O WAT 1089 18.085 6.102 54.738 1.00 0.00 O ATOM 14034 H1 WAT 1089 18.877 6.399 55.186 1.00 0.00 H ATOM 14035 H2 WAT 1089 18.189 5.152 54.673 1.00 0.00 H TER 14037 WAT 1089 ATOM 14037 O WAT 1090 103.663 125.527 124.249 1.00 0.00 O ATOM 14038 H1 WAT 1090 103.249 124.768 124.661 1.00 0.00 H ATOM 14039 H2 WAT 1090 102.944 126.141 124.102 1.00 0.00 H TER 14041 WAT 1090 ATOM 14041 O WAT 1091 36.133 99.894 113.803 1.00 0.00 O ATOM 14042 H1 WAT 1091 36.958 100.375 113.744 1.00 0.00 H ATOM 14043 H2 WAT 1091 35.477 100.500 113.458 1.00 0.00 H TER 14045 WAT 1091 ATOM 14045 O WAT 1092 101.072 44.812 133.535 1.00 0.00 O ATOM 14046 H1 WAT 1092 100.296 45.369 133.599 1.00 0.00 H ATOM 14047 H2 WAT 1092 101.746 45.383 133.168 1.00 0.00 H TER 14049 WAT 1092 ATOM 14049 O WAT 1093 134.338 74.054 84.128 1.00 0.00 O ATOM 14050 H1 WAT 1093 133.669 74.311 84.763 1.00 0.00 H ATOM 14051 H2 WAT 1093 133.957 74.270 83.277 1.00 0.00 H TER 14053 WAT 1093 ATOM 14053 O WAT 1094 16.934 89.709 98.022 1.00 0.00 O ATOM 14054 H1 WAT 1094 17.829 89.471 98.264 1.00 0.00 H ATOM 14055 H2 WAT 1094 16.667 89.033 97.399 1.00 0.00 H TER 14057 WAT 1094 ATOM 14057 O WAT 1095 82.447 16.997 158.317 1.00 0.00 O ATOM 14058 H1 WAT 1095 81.989 17.464 159.015 1.00 0.00 H ATOM 14059 H2 WAT 1095 82.353 17.562 157.550 1.00 0.00 H TER 14061 WAT 1095 ATOM 14061 O WAT 1096 13.673 65.639 157.399 1.00 0.00 O ATOM 14062 H1 WAT 1096 12.857 65.478 157.874 1.00 0.00 H ATOM 14063 H2 WAT 1096 14.049 64.768 157.267 1.00 0.00 H TER 14065 WAT 1096 ATOM 14065 O WAT 1097 1.030 60.475 5.538 1.00 0.00 O ATOM 14066 H1 WAT 1097 0.699 60.326 4.653 1.00 0.00 H ATOM 14067 H2 WAT 1097 0.783 61.377 5.739 1.00 0.00 H TER 14069 WAT 1097 ATOM 14069 O WAT 1098 107.486 140.967 16.256 1.00 0.00 O ATOM 14070 H1 WAT 1098 106.631 140.741 15.889 1.00 0.00 H ATOM 14071 H2 WAT 1098 107.334 141.027 17.199 1.00 0.00 H TER 14073 WAT 1098 ATOM 14073 O WAT 1099 0.334 37.321 137.628 1.00 0.00 O ATOM 14074 H1 WAT 1099 -0.350 36.660 137.743 1.00 0.00 H ATOM 14075 H2 WAT 1099 1.100 36.825 137.340 1.00 0.00 H TER 14077 WAT 1099 ATOM 14077 O WAT 1100 50.989 119.821 0.191 1.00 0.00 O ATOM 14078 H1 WAT 1100 50.204 119.451 -0.213 1.00 0.00 H ATOM 14079 H2 WAT 1100 50.821 119.769 1.132 1.00 0.00 H TER 14081 WAT 1100 ATOM 14081 O WAT 1101 12.065 44.153 113.455 1.00 0.00 O ATOM 14082 H1 WAT 1101 12.685 44.866 113.606 1.00 0.00 H ATOM 14083 H2 WAT 1101 11.486 44.480 112.766 1.00 0.00 H TER 14085 WAT 1101 ATOM 14085 O WAT 1102 74.961 61.927 158.850 1.00 0.00 O ATOM 14086 H1 WAT 1102 74.373 61.200 158.646 1.00 0.00 H ATOM 14087 H2 WAT 1102 75.571 61.955 158.113 1.00 0.00 H TER 14089 WAT 1102 ATOM 14089 O WAT 1103 37.528 63.607 8.812 1.00 0.00 O ATOM 14090 H1 WAT 1103 38.369 63.407 8.401 1.00 0.00 H ATOM 14091 H2 WAT 1103 37.371 64.527 8.601 1.00 0.00 H TER 14093 WAT 1103 ATOM 14093 O WAT 1104 115.249 83.549 136.148 1.00 0.00 O ATOM 14094 H1 WAT 1104 115.204 84.467 135.880 1.00 0.00 H ATOM 14095 H2 WAT 1104 116.175 83.320 136.065 1.00 0.00 H TER 14097 WAT 1104 ATOM 14097 O WAT 1105 42.372 16.857 63.549 1.00 0.00 O ATOM 14098 H1 WAT 1105 42.804 16.022 63.370 1.00 0.00 H ATOM 14099 H2 WAT 1105 41.490 16.754 63.191 1.00 0.00 H TER 14101 WAT 1105 ATOM 14101 O WAT 1106 74.591 47.230 5.766 1.00 0.00 O ATOM 14102 H1 WAT 1106 74.737 46.288 5.853 1.00 0.00 H ATOM 14103 H2 WAT 1106 73.842 47.410 6.334 1.00 0.00 H TER 14105 WAT 1106 ATOM 14105 O WAT 1107 1.910 142.836 72.598 1.00 0.00 O ATOM 14106 H1 WAT 1107 2.841 142.898 72.811 1.00 0.00 H ATOM 14107 H2 WAT 1107 1.568 143.714 72.766 1.00 0.00 H TER 14109 WAT 1107 ATOM 14109 O WAT 1108 3.255 99.628 143.721 1.00 0.00 O ATOM 14110 H1 WAT 1108 2.907 98.965 144.317 1.00 0.00 H ATOM 14111 H2 WAT 1108 3.852 99.145 143.149 1.00 0.00 H TER 14113 WAT 1108 ATOM 14113 O WAT 1109 32.179 56.104 5.082 1.00 0.00 O ATOM 14114 H1 WAT 1109 32.086 56.039 6.033 1.00 0.00 H ATOM 14115 H2 WAT 1109 31.282 56.184 4.759 1.00 0.00 H TER 14117 WAT 1109 ATOM 14117 O WAT 1110 93.825 46.129 147.675 1.00 0.00 O ATOM 14118 H1 WAT 1110 93.206 46.650 148.186 1.00 0.00 H ATOM 14119 H2 WAT 1110 94.580 46.704 147.555 1.00 0.00 H TER 14121 WAT 1110 ATOM 14121 O WAT 1111 142.421 80.807 122.342 1.00 0.00 O ATOM 14122 H1 WAT 1111 141.495 81.039 122.413 1.00 0.00 H ATOM 14123 H2 WAT 1111 142.418 79.884 122.089 1.00 0.00 H TER 14125 WAT 1111 ATOM 14125 O WAT 1112 124.654 118.176 141.685 1.00 0.00 O ATOM 14126 H1 WAT 1112 124.962 118.769 141.000 1.00 0.00 H ATOM 14127 H2 WAT 1112 124.046 118.703 142.204 1.00 0.00 H TER 14129 WAT 1112 ATOM 14129 O WAT 1113 114.492 89.967 1.584 1.00 0.00 O ATOM 14130 H1 WAT 1113 113.786 89.503 1.134 1.00 0.00 H ATOM 14131 H2 WAT 1113 114.430 89.675 2.493 1.00 0.00 H TER 14133 WAT 1113 ATOM 14133 O WAT 1114 12.959 46.038 17.712 1.00 0.00 O ATOM 14134 H1 WAT 1114 12.565 45.268 17.302 1.00 0.00 H ATOM 14135 H2 WAT 1114 13.416 46.482 16.997 1.00 0.00 H TER 14137 WAT 1114 ATOM 14137 O WAT 1115 88.086 49.744 154.532 1.00 0.00 O ATOM 14138 H1 WAT 1115 88.491 50.578 154.773 1.00 0.00 H ATOM 14139 H2 WAT 1115 88.184 49.197 155.312 1.00 0.00 H TER 14141 WAT 1115 ATOM 14141 O WAT 1116 27.671 6.677 101.468 1.00 0.00 O ATOM 14142 H1 WAT 1116 27.367 7.275 100.785 1.00 0.00 H ATOM 14143 H2 WAT 1116 28.565 6.452 101.209 1.00 0.00 H TER 14145 WAT 1116 ATOM 14145 O WAT 1117 61.722 69.839 102.443 1.00 0.00 O ATOM 14146 H1 WAT 1117 61.669 70.714 102.057 1.00 0.00 H ATOM 14147 H2 WAT 1117 62.250 69.336 101.824 1.00 0.00 H TER 14149 WAT 1117 ATOM 14149 O WAT 1118 54.783 30.106 91.277 1.00 0.00 O ATOM 14150 H1 WAT 1118 54.267 30.447 92.007 1.00 0.00 H ATOM 14151 H2 WAT 1118 55.259 29.363 91.647 1.00 0.00 H TER 14153 WAT 1118 ATOM 14153 O WAT 1119 1.289 84.832 20.926 1.00 0.00 O ATOM 14154 H1 WAT 1119 1.709 84.011 21.182 1.00 0.00 H ATOM 14155 H2 WAT 1119 1.984 85.335 20.501 1.00 0.00 H TER 14157 WAT 1119 ATOM 14157 O WAT 1120 141.985 59.017 1.554 1.00 0.00 O ATOM 14158 H1 WAT 1120 142.025 59.251 2.481 1.00 0.00 H ATOM 14159 H2 WAT 1120 141.731 59.828 1.113 1.00 0.00 H TER 14161 WAT 1120 ATOM 14161 O WAT 1121 2.270 138.256 68.391 1.00 0.00 O ATOM 14162 H1 WAT 1121 3.039 137.968 67.900 1.00 0.00 H ATOM 14163 H2 WAT 1121 1.827 137.444 68.640 1.00 0.00 H TER 14165 WAT 1121 ATOM 14165 O WAT 1122 49.382 113.555 86.472 1.00 0.00 O ATOM 14166 H1 WAT 1122 48.533 113.985 86.364 1.00 0.00 H ATOM 14167 H2 WAT 1122 49.166 112.661 86.736 1.00 0.00 H TER 14169 WAT 1122 ATOM 14169 O WAT 1123 73.025 46.703 126.111 1.00 0.00 O ATOM 14170 H1 WAT 1123 73.772 47.267 125.909 1.00 0.00 H ATOM 14171 H2 WAT 1123 72.307 47.311 126.286 1.00 0.00 H TER 14173 WAT 1123 ATOM 14173 O WAT 1124 86.950 93.685 124.354 1.00 0.00 O ATOM 14174 H1 WAT 1124 87.458 93.711 125.165 1.00 0.00 H ATOM 14175 H2 WAT 1124 87.483 94.169 123.723 1.00 0.00 H TER 14177 WAT 1124 ATOM 14177 O WAT 1125 78.799 62.176 14.980 1.00 0.00 O ATOM 14178 H1 WAT 1125 79.194 62.052 15.843 1.00 0.00 H ATOM 14179 H2 WAT 1125 78.348 61.351 14.802 1.00 0.00 H TER 14181 WAT 1125 ATOM 14181 O WAT 1126 109.864 94.842 120.408 1.00 0.00 O ATOM 14182 H1 WAT 1126 109.603 95.738 120.618 1.00 0.00 H ATOM 14183 H2 WAT 1126 110.816 94.838 120.514 1.00 0.00 H TER 14185 WAT 1126 ATOM 14185 O WAT 1127 130.246 35.534 10.032 1.00 0.00 O ATOM 14186 H1 WAT 1127 129.475 35.076 10.367 1.00 0.00 H ATOM 14187 H2 WAT 1127 129.892 36.302 9.583 1.00 0.00 H TER 14189 WAT 1127 ATOM 14189 O WAT 1128 137.177 99.044 146.219 1.00 0.00 O ATOM 14190 H1 WAT 1128 137.091 99.358 147.119 1.00 0.00 H ATOM 14191 H2 WAT 1128 137.703 99.713 145.781 1.00 0.00 H TER 14193 WAT 1128 ATOM 14193 O WAT 1129 60.543 128.274 138.984 1.00 0.00 O ATOM 14194 H1 WAT 1129 59.799 128.320 138.383 1.00 0.00 H ATOM 14195 H2 WAT 1129 60.789 129.187 139.132 1.00 0.00 H TER 14197 WAT 1129 ATOM 14197 O WAT 1130 66.603 120.239 80.245 1.00 0.00 O ATOM 14198 H1 WAT 1130 65.800 120.170 79.727 1.00 0.00 H ATOM 14199 H2 WAT 1130 66.388 120.864 80.937 1.00 0.00 H TER 14201 WAT 1130 ATOM 14201 O WAT 1131 13.945 71.275 138.472 1.00 0.00 O ATOM 14202 H1 WAT 1131 13.422 71.450 139.255 1.00 0.00 H ATOM 14203 H2 WAT 1131 13.443 70.617 137.991 1.00 0.00 H TER 14205 WAT 1131 ATOM 14205 O WAT 1132 140.580 102.741 91.456 1.00 0.00 O ATOM 14206 H1 WAT 1132 141.254 102.363 92.021 1.00 0.00 H ATOM 14207 H2 WAT 1132 140.859 103.646 91.322 1.00 0.00 H TER 14209 WAT 1132 ATOM 14209 O WAT 1133 136.971 96.773 157.669 1.00 0.00 O ATOM 14210 H1 WAT 1133 136.586 97.648 157.615 1.00 0.00 H ATOM 14211 H2 WAT 1133 137.311 96.715 158.562 1.00 0.00 H TER 14213 WAT 1133 ATOM 14213 O WAT 1134 30.380 138.090 112.002 1.00 0.00 O ATOM 14214 H1 WAT 1134 29.919 137.390 112.464 1.00 0.00 H ATOM 14215 H2 WAT 1134 30.782 138.611 112.698 1.00 0.00 H TER 14217 WAT 1134 ATOM 14217 O WAT 1135 32.057 38.763 90.805 1.00 0.00 O ATOM 14218 H1 WAT 1135 32.999 38.922 90.756 1.00 0.00 H ATOM 14219 H2 WAT 1135 31.797 38.583 89.901 1.00 0.00 H TER 14221 WAT 1135 ATOM 14221 O WAT 1136 94.341 75.747 73.662 1.00 0.00 O ATOM 14222 H1 WAT 1136 93.973 74.863 73.685 1.00 0.00 H ATOM 14223 H2 WAT 1136 93.805 76.245 74.280 1.00 0.00 H TER 14225 WAT 1136 ATOM 14225 O WAT 1137 25.231 56.612 103.795 1.00 0.00 O ATOM 14226 H1 WAT 1137 24.769 56.889 104.587 1.00 0.00 H ATOM 14227 H2 WAT 1137 24.703 56.959 103.076 1.00 0.00 H TER 14229 WAT 1137 ATOM 14229 O WAT 1138 24.162 36.928 8.297 1.00 0.00 O ATOM 14230 H1 WAT 1138 24.643 36.965 7.470 1.00 0.00 H ATOM 14231 H2 WAT 1138 23.984 35.997 8.428 1.00 0.00 H TER 14233 WAT 1138 ATOM 14233 O WAT 1139 32.031 90.925 135.548 1.00 0.00 O ATOM 14234 H1 WAT 1139 32.393 91.029 134.668 1.00 0.00 H ATOM 14235 H2 WAT 1139 32.297 91.719 136.012 1.00 0.00 H TER 14237 WAT 1139 ATOM 14237 O WAT 1140 134.419 27.999 126.768 1.00 0.00 O ATOM 14238 H1 WAT 1140 134.771 27.229 126.321 1.00 0.00 H ATOM 14239 H2 WAT 1140 134.357 27.735 127.686 1.00 0.00 H TER 14241 WAT 1140 ATOM 14241 O WAT 1141 13.296 36.158 70.799 1.00 0.00 O ATOM 14242 H1 WAT 1141 13.753 36.931 70.468 1.00 0.00 H ATOM 14243 H2 WAT 1141 13.116 36.362 71.717 1.00 0.00 H TER 14245 WAT 1141 ATOM 14245 O WAT 1142 110.098 63.281 119.254 1.00 0.00 O ATOM 14246 H1 WAT 1142 111.044 63.253 119.111 1.00 0.00 H ATOM 14247 H2 WAT 1142 109.985 63.005 120.163 1.00 0.00 H TER 14249 WAT 1142 ATOM 14249 O WAT 1143 24.872 49.555 108.465 1.00 0.00 O ATOM 14250 H1 WAT 1143 23.997 49.322 108.154 1.00 0.00 H ATOM 14251 H2 WAT 1143 25.315 49.908 107.693 1.00 0.00 H TER 14253 WAT 1143 ATOM 14253 O WAT 1144 43.467 108.198 0.846 1.00 0.00 O ATOM 14254 H1 WAT 1144 43.854 107.430 0.425 1.00 0.00 H ATOM 14255 H2 WAT 1144 44.063 108.915 0.630 1.00 0.00 H TER 14257 WAT 1144 ATOM 14257 O WAT 1145 100.171 108.463 73.959 1.00 0.00 O ATOM 14258 H1 WAT 1145 100.857 108.183 74.565 1.00 0.00 H ATOM 14259 H2 WAT 1145 99.588 107.706 73.892 1.00 0.00 H TER 14261 WAT 1145 ATOM 14261 O WAT 1146 55.208 9.468 155.284 1.00 0.00 O ATOM 14262 H1 WAT 1146 55.995 9.230 154.792 1.00 0.00 H ATOM 14263 H2 WAT 1146 54.927 8.650 155.695 1.00 0.00 H TER 14265 WAT 1146 ATOM 14265 O WAT 1147 104.265 0.287 86.989 1.00 0.00 O ATOM 14266 H1 WAT 1147 104.078 -0.417 87.609 1.00 0.00 H ATOM 14267 H2 WAT 1147 104.561 1.015 87.535 1.00 0.00 H TER 14269 WAT 1147 ATOM 14269 O WAT 1148 131.498 137.803 85.068 1.00 0.00 O ATOM 14270 H1 WAT 1148 131.754 137.164 85.733 1.00 0.00 H ATOM 14271 H2 WAT 1148 130.972 138.446 85.544 1.00 0.00 H TER 14273 WAT 1148 ATOM 14273 O WAT 1149 36.514 101.976 98.698 1.00 0.00 O ATOM 14274 H1 WAT 1149 35.709 101.892 99.208 1.00 0.00 H ATOM 14275 H2 WAT 1149 36.582 102.912 98.511 1.00 0.00 H TER 14277 WAT 1149 ATOM 14277 O WAT 1150 53.507 49.685 84.911 1.00 0.00 O ATOM 14278 H1 WAT 1150 53.210 49.232 84.123 1.00 0.00 H ATOM 14279 H2 WAT 1150 54.170 49.104 85.286 1.00 0.00 H TER 14281 WAT 1150 ATOM 14281 O WAT 1151 33.469 117.518 150.537 1.00 0.00 O ATOM 14282 H1 WAT 1151 34.223 118.107 150.548 1.00 0.00 H ATOM 14283 H2 WAT 1151 33.710 116.810 151.135 1.00 0.00 H TER 14285 WAT 1151 ATOM 14285 O WAT 1152 82.947 141.892 20.857 1.00 0.00 O ATOM 14286 H1 WAT 1152 82.447 141.671 21.643 1.00 0.00 H ATOM 14287 H2 WAT 1152 82.562 142.713 20.551 1.00 0.00 H TER 14289 WAT 1152 ATOM 14289 O WAT 1153 79.011 22.958 58.231 1.00 0.00 O ATOM 14290 H1 WAT 1153 78.919 22.013 58.110 1.00 0.00 H ATOM 14291 H2 WAT 1153 79.215 23.293 57.358 1.00 0.00 H TER 14293 WAT 1153 ATOM 14293 O WAT 1154 44.272 31.999 71.601 1.00 0.00 O ATOM 14294 H1 WAT 1154 43.858 32.836 71.389 1.00 0.00 H ATOM 14295 H2 WAT 1154 45.020 31.944 71.006 1.00 0.00 H TER 14297 WAT 1154 ATOM 14297 O WAT 1155 31.860 4.651 62.335 1.00 0.00 O ATOM 14298 H1 WAT 1155 32.569 5.012 61.802 1.00 0.00 H ATOM 14299 H2 WAT 1155 31.078 5.116 62.040 1.00 0.00 H TER 14301 WAT 1155 ATOM 14301 O WAT 1156 79.673 33.110 113.645 1.00 0.00 O ATOM 14302 H1 WAT 1156 78.981 33.690 113.963 1.00 0.00 H ATOM 14303 H2 WAT 1156 79.395 32.866 112.762 1.00 0.00 H TER 14305 WAT 1156 ATOM 14305 O WAT 1157 119.523 58.504 8.912 1.00 0.00 O ATOM 14306 H1 WAT 1157 119.038 59.138 8.384 1.00 0.00 H ATOM 14307 H2 WAT 1157 120.028 59.040 9.524 1.00 0.00 H TER 14309 WAT 1157 ATOM 14309 O WAT 1158 73.988 8.325 128.433 1.00 0.00 O ATOM 14310 H1 WAT 1158 73.425 7.938 129.104 1.00 0.00 H ATOM 14311 H2 WAT 1158 74.188 9.201 128.765 1.00 0.00 H TER 14313 WAT 1158 ATOM 14313 O WAT 1159 120.870 51.893 149.959 1.00 0.00 O ATOM 14314 H1 WAT 1159 120.062 52.349 149.721 1.00 0.00 H ATOM 14315 H2 WAT 1159 121.568 52.432 149.587 1.00 0.00 H TER 14317 WAT 1159 ATOM 14317 O WAT 1160 82.697 52.380 65.112 1.00 0.00 O ATOM 14318 H1 WAT 1160 82.964 51.727 64.466 1.00 0.00 H ATOM 14319 H2 WAT 1160 81.993 51.957 65.604 1.00 0.00 H TER 14321 WAT 1160 ATOM 14321 O WAT 1161 65.386 61.514 149.873 1.00 0.00 O ATOM 14322 H1 WAT 1161 64.606 61.111 149.491 1.00 0.00 H ATOM 14323 H2 WAT 1161 65.423 61.167 150.764 1.00 0.00 H TER 14325 WAT 1161 ATOM 14325 O WAT 1162 12.755 25.295 142.116 1.00 0.00 O ATOM 14326 H1 WAT 1162 12.180 25.761 142.722 1.00 0.00 H ATOM 14327 H2 WAT 1162 13.412 25.943 141.862 1.00 0.00 H TER 14329 WAT 1162 ATOM 14329 O WAT 1163 33.439 142.421 1.817 1.00 0.00 O ATOM 14330 H1 WAT 1163 33.253 142.938 1.033 1.00 0.00 H ATOM 14331 H2 WAT 1163 33.877 143.033 2.409 1.00 0.00 H TER 14333 WAT 1163 ATOM 14333 O WAT 1164 89.402 53.318 146.430 1.00 0.00 O ATOM 14334 H1 WAT 1164 88.526 53.131 146.092 1.00 0.00 H ATOM 14335 H2 WAT 1164 89.748 53.987 145.839 1.00 0.00 H TER 14337 WAT 1164 ATOM 14337 O WAT 1165 124.055 103.032 62.700 1.00 0.00 O ATOM 14338 H1 WAT 1165 123.142 103.310 62.626 1.00 0.00 H ATOM 14339 H2 WAT 1165 124.005 102.122 62.993 1.00 0.00 H TER 14341 WAT 1165 ATOM 14341 O WAT 1166 126.680 137.482 71.010 1.00 0.00 O ATOM 14342 H1 WAT 1166 126.678 136.580 71.330 1.00 0.00 H ATOM 14343 H2 WAT 1166 126.362 138.000 71.750 1.00 0.00 H TER 14345 WAT 1166 ATOM 14345 O WAT 1167 57.439 125.898 127.933 1.00 0.00 O ATOM 14346 H1 WAT 1167 56.623 126.251 128.289 1.00 0.00 H ATOM 14347 H2 WAT 1167 57.158 125.298 127.242 1.00 0.00 H TER 14349 WAT 1167 ATOM 14349 O WAT 1168 4.513 50.970 94.262 1.00 0.00 O ATOM 14350 H1 WAT 1168 4.343 50.821 93.332 1.00 0.00 H ATOM 14351 H2 WAT 1168 4.229 51.871 94.416 1.00 0.00 H TER 14353 WAT 1168 ATOM 14353 O WAT 1169 4.227 128.602 116.930 1.00 0.00 O ATOM 14354 H1 WAT 1169 5.046 128.335 116.511 1.00 0.00 H ATOM 14355 H2 WAT 1169 4.142 129.532 116.719 1.00 0.00 H TER 14357 WAT 1169 ATOM 14357 O WAT 1170 20.778 15.724 23.127 1.00 0.00 O ATOM 14358 H1 WAT 1170 20.713 16.556 23.598 1.00 0.00 H ATOM 14359 H2 WAT 1170 20.178 15.140 23.590 1.00 0.00 H TER 14361 WAT 1170 ATOM 14361 O WAT 1171 68.541 117.477 53.482 1.00 0.00 O ATOM 14362 H1 WAT 1171 68.459 116.602 53.862 1.00 0.00 H ATOM 14363 H2 WAT 1171 68.669 118.054 54.235 1.00 0.00 H TER 14365 WAT 1171 ATOM 14365 O WAT 1172 57.016 134.672 102.950 1.00 0.00 O ATOM 14366 H1 WAT 1172 57.159 133.843 103.407 1.00 0.00 H ATOM 14367 H2 WAT 1172 56.456 135.177 103.540 1.00 0.00 H TER 14369 WAT 1172 ATOM 14369 O WAT 1173 90.234 36.627 5.120 1.00 0.00 O ATOM 14370 H1 WAT 1173 89.705 37.346 4.773 1.00 0.00 H ATOM 14371 H2 WAT 1173 91.134 36.949 5.077 1.00 0.00 H TER 14373 WAT 1173 ATOM 14373 O WAT 1174 60.707 84.850 130.095 1.00 0.00 O ATOM 14374 H1 WAT 1174 61.068 84.047 129.720 1.00 0.00 H ATOM 14375 H2 WAT 1174 61.112 84.914 130.960 1.00 0.00 H TER 14377 WAT 1174 ATOM 14377 O WAT 1175 78.918 58.199 136.804 1.00 0.00 O ATOM 14378 H1 WAT 1175 78.658 59.082 137.066 1.00 0.00 H ATOM 14379 H2 WAT 1175 78.204 57.638 137.109 1.00 0.00 H TER 14381 WAT 1175 ATOM 14381 O WAT 1176 22.115 2.239 79.559 1.00 0.00 O ATOM 14382 H1 WAT 1176 22.005 1.483 78.983 1.00 0.00 H ATOM 14383 H2 WAT 1176 21.282 2.708 79.501 1.00 0.00 H TER 14385 WAT 1176 ATOM 14385 O WAT 1177 67.676 130.634 112.699 1.00 0.00 O ATOM 14386 H1 WAT 1177 67.114 130.073 112.165 1.00 0.00 H ATOM 14387 H2 WAT 1177 67.884 130.103 113.467 1.00 0.00 H TER 14389 WAT 1177 ATOM 14389 O WAT 1178 77.588 35.451 70.836 1.00 0.00 O ATOM 14390 H1 WAT 1178 78.096 34.775 70.388 1.00 0.00 H ATOM 14391 H2 WAT 1178 78.245 36.003 71.260 1.00 0.00 H TER 14393 WAT 1178 ATOM 14393 O WAT 1179 145.956 143.868 152.045 1.00 0.00 O ATOM 14394 H1 WAT 1179 145.334 144.568 151.849 1.00 0.00 H ATOM 14395 H2 WAT 1179 145.434 143.066 152.008 1.00 0.00 H TER 14397 WAT 1179 ATOM 14397 O WAT 1180 119.489 99.061 155.826 1.00 0.00 O ATOM 14398 H1 WAT 1180 119.560 99.363 156.731 1.00 0.00 H ATOM 14399 H2 WAT 1180 119.717 99.827 155.299 1.00 0.00 H TER 14401 WAT 1180 ATOM 14401 O WAT 1181 83.000 68.142 107.016 1.00 0.00 O ATOM 14402 H1 WAT 1181 82.435 68.910 107.105 1.00 0.00 H ATOM 14403 H2 WAT 1181 82.492 67.425 107.394 1.00 0.00 H TER 14405 WAT 1181 ATOM 14405 O WAT 1182 46.404 112.109 58.316 1.00 0.00 O ATOM 14406 H1 WAT 1182 46.315 111.298 57.815 1.00 0.00 H ATOM 14407 H2 WAT 1182 47.322 112.357 58.210 1.00 0.00 H TER 14409 WAT 1182 ATOM 14409 O WAT 1183 136.518 139.928 75.488 1.00 0.00 O ATOM 14410 H1 WAT 1183 135.782 140.538 75.543 1.00 0.00 H ATOM 14411 H2 WAT 1183 136.314 139.374 74.735 1.00 0.00 H TER 14413 WAT 1183 ATOM 14413 O WAT 1184 114.849 137.070 154.148 1.00 0.00 O ATOM 14414 H1 WAT 1184 115.316 136.457 153.580 1.00 0.00 H ATOM 14415 H2 WAT 1184 113.986 137.160 153.746 1.00 0.00 H TER 14417 WAT 1184 ATOM 14417 O WAT 1185 14.996 92.385 130.337 1.00 0.00 O ATOM 14418 H1 WAT 1185 14.750 92.927 131.087 1.00 0.00 H ATOM 14419 H2 WAT 1185 14.409 91.630 130.385 1.00 0.00 H TER 14421 WAT 1185 ATOM 14421 O WAT 1186 119.900 9.607 97.854 1.00 0.00 O ATOM 14422 H1 WAT 1186 120.178 10.301 98.451 1.00 0.00 H ATOM 14423 H2 WAT 1186 119.735 8.854 98.422 1.00 0.00 H TER 14425 WAT 1186 ATOM 14425 O WAT 1187 117.891 32.715 20.206 1.00 0.00 O ATOM 14426 H1 WAT 1187 118.551 33.032 19.590 1.00 0.00 H ATOM 14427 H2 WAT 1187 118.318 32.767 21.062 1.00 0.00 H TER 14429 WAT 1187 ATOM 14429 O WAT 1188 71.509 14.267 127.395 1.00 0.00 O ATOM 14430 H1 WAT 1188 70.563 14.202 127.259 1.00 0.00 H ATOM 14431 H2 WAT 1188 71.848 13.413 127.127 1.00 0.00 H TER 14433 WAT 1188 ATOM 14433 O WAT 1189 56.970 28.727 70.777 1.00 0.00 O ATOM 14434 H1 WAT 1189 57.188 28.129 70.062 1.00 0.00 H ATOM 14435 H2 WAT 1189 57.614 28.533 71.457 1.00 0.00 H TER 14437 WAT 1189 ATOM 14437 O WAT 1190 67.612 43.605 69.962 1.00 0.00 O ATOM 14438 H1 WAT 1190 67.985 42.769 69.682 1.00 0.00 H ATOM 14439 H2 WAT 1190 67.332 44.027 69.150 1.00 0.00 H TER 14441 WAT 1190 ATOM 14441 O WAT 1191 39.111 21.413 114.855 1.00 0.00 O ATOM 14442 H1 WAT 1191 40.003 21.687 114.641 1.00 0.00 H ATOM 14443 H2 WAT 1191 39.221 20.738 115.525 1.00 0.00 H TER 14445 WAT 1191 ATOM 14445 O WAT 1192 29.310 53.733 91.167 1.00 0.00 O ATOM 14446 H1 WAT 1192 28.360 53.844 91.125 1.00 0.00 H ATOM 14447 H2 WAT 1192 29.438 52.788 91.251 1.00 0.00 H TER 14449 WAT 1192 ATOM 14449 O WAT 1193 125.207 136.550 141.762 1.00 0.00 O ATOM 14450 H1 WAT 1193 125.248 136.319 142.691 1.00 0.00 H ATOM 14451 H2 WAT 1193 124.438 137.115 141.690 1.00 0.00 H TER 14453 WAT 1193 ATOM 14453 O WAT 1194 98.384 109.878 97.416 1.00 0.00 O ATOM 14454 H1 WAT 1194 97.943 110.194 98.205 1.00 0.00 H ATOM 14455 H2 WAT 1194 98.541 110.667 96.898 1.00 0.00 H TER 14457 WAT 1194 ATOM 14457 O WAT 1195 131.305 32.273 124.175 1.00 0.00 O ATOM 14458 H1 WAT 1195 131.591 32.107 125.073 1.00 0.00 H ATOM 14459 H2 WAT 1195 131.068 31.410 123.835 1.00 0.00 H TER 14461 WAT 1195 ATOM 14461 O WAT 1196 64.976 69.653 99.733 1.00 0.00 O ATOM 14462 H1 WAT 1196 65.195 70.033 98.882 1.00 0.00 H ATOM 14463 H2 WAT 1196 64.971 70.398 100.333 1.00 0.00 H TER 14465 WAT 1196 ATOM 14465 O WAT 1197 15.371 37.031 96.590 1.00 0.00 O ATOM 14466 H1 WAT 1197 14.822 37.599 96.050 1.00 0.00 H ATOM 14467 H2 WAT 1197 16.113 36.809 96.027 1.00 0.00 H TER 14469 WAT 1197 ATOM 14469 O WAT 1198 9.005 86.744 19.301 1.00 0.00 O ATOM 14470 H1 WAT 1198 8.548 87.118 20.054 1.00 0.00 H ATOM 14471 H2 WAT 1198 8.305 86.427 18.730 1.00 0.00 H TER 14473 WAT 1198 ATOM 14473 O WAT 1199 20.916 35.218 69.578 1.00 0.00 O ATOM 14474 H1 WAT 1199 20.055 34.820 69.708 1.00 0.00 H ATOM 14475 H2 WAT 1199 21.516 34.475 69.513 1.00 0.00 H TER 14477 WAT 1199 ATOM 14477 O WAT 1200 122.790 71.472 6.262 1.00 0.00 O ATOM 14478 H1 WAT 1200 121.847 71.388 6.397 1.00 0.00 H ATOM 14479 H2 WAT 1200 122.884 72.245 5.705 1.00 0.00 H TER 14481 WAT 1200 ATOM 14481 O WAT 1201 135.778 54.901 3.430 1.00 0.00 O ATOM 14482 H1 WAT 1201 136.082 55.063 2.537 1.00 0.00 H ATOM 14483 H2 WAT 1201 134.841 55.098 3.403 1.00 0.00 H TER 14485 WAT 1201 ATOM 14485 O WAT 1202 62.330 28.286 71.154 1.00 0.00 O ATOM 14486 H1 WAT 1202 61.429 27.999 71.299 1.00 0.00 H ATOM 14487 H2 WAT 1202 62.696 28.378 72.034 1.00 0.00 H TER 14489 WAT 1202 ATOM 14489 O WAT 1203 127.609 135.853 67.254 1.00 0.00 O ATOM 14490 H1 WAT 1203 127.027 136.486 67.675 1.00 0.00 H ATOM 14491 H2 WAT 1203 127.536 136.045 66.319 1.00 0.00 H TER 14493 WAT 1203 ATOM 14493 O WAT 1204 143.823 0.462 141.697 1.00 0.00 O ATOM 14494 H1 WAT 1204 144.540 0.336 142.317 1.00 0.00 H ATOM 14495 H2 WAT 1204 143.441 -0.409 141.591 1.00 0.00 H TER 14497 WAT 1204 ATOM 14497 O WAT 1205 23.896 92.661 60.484 1.00 0.00 O ATOM 14498 H1 WAT 1205 23.053 92.915 60.107 1.00 0.00 H ATOM 14499 H2 WAT 1205 24.292 93.486 60.763 1.00 0.00 H TER 14501 WAT 1205 ATOM 14501 O WAT 1206 76.268 78.029 151.188 1.00 0.00 O ATOM 14502 H1 WAT 1206 75.974 78.896 150.909 1.00 0.00 H ATOM 14503 H2 WAT 1206 75.537 77.449 150.977 1.00 0.00 H TER 14505 WAT 1206 ATOM 14505 O WAT 1207 38.644 135.803 126.945 1.00 0.00 O ATOM 14506 H1 WAT 1207 39.351 136.206 127.449 1.00 0.00 H ATOM 14507 H2 WAT 1207 37.872 136.330 127.150 1.00 0.00 H TER 14509 WAT 1207 ATOM 14509 O WAT 1208 -0.146 18.177 10.133 1.00 0.00 O ATOM 14510 H1 WAT 1208 0.171 18.984 10.539 1.00 0.00 H ATOM 14511 H2 WAT 1208 0.346 17.481 10.568 1.00 0.00 H TER 14513 WAT 1208 ATOM 14513 O WAT 1209 78.025 18.067 21.180 1.00 0.00 O ATOM 14514 H1 WAT 1209 78.512 17.690 20.447 1.00 0.00 H ATOM 14515 H2 WAT 1209 78.700 18.318 21.812 1.00 0.00 H TER 14517 WAT 1209 ATOM 14517 O WAT 1210 10.876 17.389 156.251 1.00 0.00 O ATOM 14518 H1 WAT 1210 10.238 17.541 155.553 1.00 0.00 H ATOM 14519 H2 WAT 1210 10.795 16.457 156.450 1.00 0.00 H TER 14521 WAT 1210 ATOM 14521 O WAT 1211 48.661 40.727 81.734 1.00 0.00 O ATOM 14522 H1 WAT 1211 49.113 39.963 81.377 1.00 0.00 H ATOM 14523 H2 WAT 1211 48.121 41.045 81.011 1.00 0.00 H TER 14525 WAT 1211 ATOM 14525 O WAT 1212 124.593 34.895 85.033 1.00 0.00 O ATOM 14526 H1 WAT 1212 123.818 35.421 84.837 1.00 0.00 H ATOM 14527 H2 WAT 1212 125.294 35.536 85.153 1.00 0.00 H TER 14529 WAT 1212 ATOM 14529 O WAT 1213 86.160 17.374 70.030 1.00 0.00 O ATOM 14530 H1 WAT 1213 86.227 17.676 69.124 1.00 0.00 H ATOM 14531 H2 WAT 1213 86.898 17.790 70.476 1.00 0.00 H TER 14533 WAT 1213 ATOM 14533 O WAT 1214 91.936 109.986 125.125 1.00 0.00 O ATOM 14534 H1 WAT 1214 92.135 109.095 125.414 1.00 0.00 H ATOM 14535 H2 WAT 1214 91.844 109.914 124.175 1.00 0.00 H TER 14537 WAT 1214 ATOM 14537 O WAT 1215 140.039 60.951 105.605 1.00 0.00 O ATOM 14538 H1 WAT 1215 140.841 61.103 106.105 1.00 0.00 H ATOM 14539 H2 WAT 1215 140.027 60.006 105.453 1.00 0.00 H TER 14541 WAT 1215 ATOM 14541 O WAT 1216 120.248 101.365 10.860 1.00 0.00 O ATOM 14542 H1 WAT 1216 119.728 101.742 11.570 1.00 0.00 H ATOM 14543 H2 WAT 1216 120.329 102.072 10.220 1.00 0.00 H TER 14545 WAT 1216 ATOM 14545 O WAT 1217 109.412 104.514 88.707 1.00 0.00 O ATOM 14546 H1 WAT 1217 109.999 105.131 88.271 1.00 0.00 H ATOM 14547 H2 WAT 1217 109.816 103.658 88.564 1.00 0.00 H TER 14549 WAT 1217 ATOM 14549 O WAT 1218 70.447 52.748 17.203 1.00 0.00 O ATOM 14550 H1 WAT 1218 70.941 53.206 17.883 1.00 0.00 H ATOM 14551 H2 WAT 1218 70.087 53.446 16.656 1.00 0.00 H TER 14553 WAT 1218 ATOM 14553 O WAT 1219 83.552 44.241 14.228 1.00 0.00 O ATOM 14554 H1 WAT 1219 83.933 44.752 13.513 1.00 0.00 H ATOM 14555 H2 WAT 1219 82.640 44.108 13.968 1.00 0.00 H TER 14557 WAT 1219 ATOM 14557 O WAT 1220 135.687 35.458 120.642 1.00 0.00 O ATOM 14558 H1 WAT 1220 136.457 35.516 121.208 1.00 0.00 H ATOM 14559 H2 WAT 1220 135.702 34.561 120.308 1.00 0.00 H TER 14561 WAT 1220 ATOM 14561 O WAT 1221 60.769 74.358 112.734 1.00 0.00 O ATOM 14562 H1 WAT 1221 60.754 74.786 111.878 1.00 0.00 H ATOM 14563 H2 WAT 1221 60.114 73.664 112.666 1.00 0.00 H TER 14565 WAT 1221 ATOM 14565 O WAT 1222 64.248 28.015 116.860 1.00 0.00 O ATOM 14566 H1 WAT 1222 64.391 27.893 115.922 1.00 0.00 H ATOM 14567 H2 WAT 1222 63.818 28.867 116.928 1.00 0.00 H TER 14569 WAT 1222 ATOM 14569 O WAT 1223 48.554 77.929 100.248 1.00 0.00 O ATOM 14570 H1 WAT 1223 47.794 78.020 100.823 1.00 0.00 H ATOM 14571 H2 WAT 1223 49.226 78.478 100.651 1.00 0.00 H TER 14573 WAT 1223 ATOM 14573 O WAT 1224 69.643 5.145 129.638 1.00 0.00 O ATOM 14574 H1 WAT 1224 69.553 4.926 130.566 1.00 0.00 H ATOM 14575 H2 WAT 1224 69.062 5.895 129.512 1.00 0.00 H TER 14577 WAT 1224 ATOM 14577 O WAT 1225 59.317 137.299 21.485 1.00 0.00 O ATOM 14578 H1 WAT 1225 58.683 136.756 21.953 1.00 0.00 H ATOM 14579 H2 WAT 1225 58.978 137.348 20.591 1.00 0.00 H TER 14581 WAT 1225 ATOM 14581 O WAT 1226 37.792 141.198 100.894 1.00 0.00 O ATOM 14582 H1 WAT 1226 38.305 141.878 100.457 1.00 0.00 H ATOM 14583 H2 WAT 1226 37.680 140.518 100.230 1.00 0.00 H TER 14585 WAT 1226 ATOM 14585 O WAT 1227 120.378 104.812 100.712 1.00 0.00 O ATOM 14586 H1 WAT 1227 121.177 104.884 100.190 1.00 0.00 H ATOM 14587 H2 WAT 1227 119.722 105.300 100.214 1.00 0.00 H TER 14589 WAT 1227 ATOM 14589 O WAT 1228 92.765 104.585 79.808 1.00 0.00 O ATOM 14590 H1 WAT 1228 91.905 104.232 80.035 1.00 0.00 H ATOM 14591 H2 WAT 1228 93.219 103.857 79.384 1.00 0.00 H TER 14593 WAT 1228 ATOM 14593 O WAT 1229 66.475 58.837 154.267 1.00 0.00 O ATOM 14594 H1 WAT 1229 67.225 58.768 153.675 1.00 0.00 H ATOM 14595 H2 WAT 1229 66.099 57.957 154.279 1.00 0.00 H TER 14597 WAT 1229 ATOM 14597 O WAT 1230 26.488 84.756 127.840 1.00 0.00 O ATOM 14598 H1 WAT 1230 26.140 85.624 128.048 1.00 0.00 H ATOM 14599 H2 WAT 1230 26.369 84.252 128.644 1.00 0.00 H TER 14601 WAT 1230 ATOM 14601 O WAT 1231 143.815 16.950 21.250 1.00 0.00 O ATOM 14602 H1 WAT 1231 144.035 16.215 20.678 1.00 0.00 H ATOM 14603 H2 WAT 1231 144.519 16.969 21.898 1.00 0.00 H TER 14605 WAT 1231 ATOM 14605 O WAT 1232 105.956 40.689 15.881 1.00 0.00 O ATOM 14606 H1 WAT 1232 106.213 40.481 16.779 1.00 0.00 H ATOM 14607 H2 WAT 1232 105.184 40.146 15.721 1.00 0.00 H TER 14609 WAT 1232 ATOM 14609 O WAT 1233 111.168 143.241 108.139 1.00 0.00 O ATOM 14610 H1 WAT 1233 112.099 143.052 108.258 1.00 0.00 H ATOM 14611 H2 WAT 1233 110.927 143.754 108.911 1.00 0.00 H TER 14613 WAT 1233 ATOM 14613 O WAT 1234 116.428 25.773 158.529 1.00 0.00 O ATOM 14614 H1 WAT 1234 116.580 26.525 157.958 1.00 0.00 H ATOM 14615 H2 WAT 1234 117.302 25.421 158.700 1.00 0.00 H TER 14617 WAT 1234 ATOM 14617 O WAT 1235 86.627 28.754 0.710 1.00 0.00 O ATOM 14618 H1 WAT 1235 86.009 28.028 0.800 1.00 0.00 H ATOM 14619 H2 WAT 1235 86.675 29.136 1.587 1.00 0.00 H TER 14621 WAT 1235 ATOM 14621 O WAT 1236 40.080 144.212 148.601 1.00 0.00 O ATOM 14622 H1 WAT 1236 39.802 143.581 149.265 1.00 0.00 H ATOM 14623 H2 WAT 1236 39.737 145.051 148.909 1.00 0.00 H TER 14625 WAT 1236 ATOM 14625 O WAT 1237 140.580 122.526 148.670 1.00 0.00 O ATOM 14626 H1 WAT 1237 141.171 122.694 149.404 1.00 0.00 H ATOM 14627 H2 WAT 1237 141.098 122.738 147.893 1.00 0.00 H TER 14629 WAT 1237 ATOM 14629 O WAT 1238 133.936 138.257 5.453 1.00 0.00 O ATOM 14630 H1 WAT 1238 134.331 137.734 6.150 1.00 0.00 H ATOM 14631 H2 WAT 1238 133.804 139.120 5.846 1.00 0.00 H TER 14633 WAT 1238 ATOM 14633 O WAT 1239 38.467 37.707 8.274 1.00 0.00 O ATOM 14634 H1 WAT 1239 37.996 37.486 9.077 1.00 0.00 H ATOM 14635 H2 WAT 1239 38.039 37.187 7.594 1.00 0.00 H TER 14637 WAT 1239 ATOM 14637 O WAT 1240 54.140 51.345 105.072 1.00 0.00 O ATOM 14638 H1 WAT 1240 54.726 50.695 104.684 1.00 0.00 H ATOM 14639 H2 WAT 1240 54.676 52.134 105.150 1.00 0.00 H TER 14641 WAT 1240 ATOM 14641 O WAT 1241 91.603 57.756 115.316 1.00 0.00 O ATOM 14642 H1 WAT 1241 91.182 58.457 114.819 1.00 0.00 H ATOM 14643 H2 WAT 1241 91.332 56.952 114.872 1.00 0.00 H TER 14645 WAT 1241 ATOM 14645 O WAT 1242 78.947 111.336 108.781 1.00 0.00 O ATOM 14646 H1 WAT 1242 79.192 112.086 108.239 1.00 0.00 H ATOM 14647 H2 WAT 1242 78.752 111.714 109.639 1.00 0.00 H TER 14649 WAT 1242 ATOM 14649 O WAT 1243 72.936 68.009 145.916 1.00 0.00 O ATOM 14650 H1 WAT 1243 72.748 68.232 145.004 1.00 0.00 H ATOM 14651 H2 WAT 1243 72.912 67.053 145.939 1.00 0.00 H TER 14653 WAT 1243 ATOM 14653 O WAT 1244 131.713 31.714 127.148 1.00 0.00 O ATOM 14654 H1 WAT 1244 130.827 31.901 127.458 1.00 0.00 H ATOM 14655 H2 WAT 1244 132.280 31.971 127.875 1.00 0.00 H TER 14657 WAT 1244 ATOM 14657 O WAT 1245 73.535 15.336 123.369 1.00 0.00 O ATOM 14658 H1 WAT 1245 73.037 14.689 122.871 1.00 0.00 H ATOM 14659 H2 WAT 1245 73.288 16.177 122.984 1.00 0.00 H TER 14661 WAT 1245 ATOM 14661 O WAT 1246 48.196 22.430 92.897 1.00 0.00 O ATOM 14662 H1 WAT 1246 48.047 21.893 93.676 1.00 0.00 H ATOM 14663 H2 WAT 1246 48.894 21.977 92.424 1.00 0.00 H TER 14665 WAT 1246 ATOM 14665 O WAT 1247 134.905 80.075 112.863 1.00 0.00 O ATOM 14666 H1 WAT 1247 134.351 80.817 113.105 1.00 0.00 H ATOM 14667 H2 WAT 1247 135.742 80.470 112.618 1.00 0.00 H TER 14669 WAT 1247 ATOM 14669 O WAT 1248 93.615 130.607 64.605 1.00 0.00 O ATOM 14670 H1 WAT 1248 93.147 130.403 63.795 1.00 0.00 H ATOM 14671 H2 WAT 1248 93.550 129.807 65.127 1.00 0.00 H TER 14673 WAT 1248 ATOM 14673 O WAT 1249 22.575 29.078 125.288 1.00 0.00 O ATOM 14674 H1 WAT 1249 23.409 28.610 125.241 1.00 0.00 H ATOM 14675 H2 WAT 1249 22.201 28.988 124.411 1.00 0.00 H TER 14677 WAT 1249 ATOM 14677 O WAT 1250 0.048 112.650 152.922 1.00 0.00 O ATOM 14678 H1 WAT 1250 -0.433 112.590 152.097 1.00 0.00 H ATOM 14679 H2 WAT 1250 0.935 112.904 152.665 1.00 0.00 H TER 14681 WAT 1250 ATOM 14681 O WAT 1251 95.290 44.551 80.634 1.00 0.00 O ATOM 14682 H1 WAT 1251 94.508 44.142 81.005 1.00 0.00 H ATOM 14683 H2 WAT 1251 95.557 43.961 79.928 1.00 0.00 H TER 14685 WAT 1251 ATOM 14685 O WAT 1252 72.012 12.602 110.318 1.00 0.00 O ATOM 14686 H1 WAT 1252 71.161 12.239 110.563 1.00 0.00 H ATOM 14687 H2 WAT 1252 71.888 12.917 109.422 1.00 0.00 H TER 14689 WAT 1252 ATOM 14689 O WAT 1253 130.293 79.150 102.074 1.00 0.00 O ATOM 14690 H1 WAT 1253 129.891 79.926 102.466 1.00 0.00 H ATOM 14691 H2 WAT 1253 130.957 79.499 101.480 1.00 0.00 H TER 14693 WAT 1253 ATOM 14693 O WAT 1254 73.386 16.178 67.142 1.00 0.00 O ATOM 14694 H1 WAT 1254 73.286 15.261 66.887 1.00 0.00 H ATOM 14695 H2 WAT 1254 72.884 16.665 66.489 1.00 0.00 H TER 14697 WAT 1254 ATOM 14697 O WAT 1255 117.225 115.883 148.292 1.00 0.00 O ATOM 14698 H1 WAT 1255 117.640 115.677 147.454 1.00 0.00 H ATOM 14699 H2 WAT 1255 117.100 116.832 148.270 1.00 0.00 H TER 14701 WAT 1255 ATOM 14701 O WAT 1256 27.098 26.401 125.048 1.00 0.00 O ATOM 14702 H1 WAT 1256 27.335 27.152 124.504 1.00 0.00 H ATOM 14703 H2 WAT 1256 27.492 26.589 125.900 1.00 0.00 H TER 14705 WAT 1256 ATOM 14705 O WAT 1257 118.642 12.606 74.833 1.00 0.00 O ATOM 14706 H1 WAT 1257 118.105 11.977 74.351 1.00 0.00 H ATOM 14707 H2 WAT 1257 119.183 12.067 75.410 1.00 0.00 H TER 14709 WAT 1257 ATOM 14709 O WAT 1258 59.335 111.572 81.986 1.00 0.00 O ATOM 14710 H1 WAT 1258 59.793 110.731 81.988 1.00 0.00 H ATOM 14711 H2 WAT 1258 59.521 111.948 82.846 1.00 0.00 H TER 14713 WAT 1258 ATOM 14713 O WAT 1259 74.914 141.651 146.790 1.00 0.00 O ATOM 14714 H1 WAT 1259 75.311 142.456 147.123 1.00 0.00 H ATOM 14715 H2 WAT 1259 73.980 141.851 146.731 1.00 0.00 H TER 14717 WAT 1259 ATOM 14717 O WAT 1260 124.829 116.244 150.799 1.00 0.00 O ATOM 14718 H1 WAT 1260 124.904 117.000 151.381 1.00 0.00 H ATOM 14719 H2 WAT 1260 124.085 115.750 151.143 1.00 0.00 H TER 14721 WAT 1260 ATOM 14721 O WAT 1261 63.181 87.391 128.385 1.00 0.00 O ATOM 14722 H1 WAT 1261 62.235 87.374 128.243 1.00 0.00 H ATOM 14723 H2 WAT 1261 63.282 87.720 129.279 1.00 0.00 H TER 14725 WAT 1261 ATOM 14725 O WAT 1262 3.130 10.422 11.611 1.00 0.00 O ATOM 14726 H1 WAT 1262 3.484 10.249 10.739 1.00 0.00 H ATOM 14727 H2 WAT 1262 2.186 10.294 11.517 1.00 0.00 H TER 14729 WAT 1262 ATOM 14729 O WAT 1263 100.477 131.303 16.075 1.00 0.00 O ATOM 14730 H1 WAT 1263 101.422 131.216 16.203 1.00 0.00 H ATOM 14731 H2 WAT 1263 100.214 131.987 16.689 1.00 0.00 H TER 14733 WAT 1263 ATOM 14733 O WAT 1264 1.889 88.244 89.548 1.00 0.00 O ATOM 14734 H1 WAT 1264 1.273 88.731 90.095 1.00 0.00 H ATOM 14735 H2 WAT 1264 1.627 87.329 89.649 1.00 0.00 H TER 14737 WAT 1264 ATOM 14737 O WAT 1265 40.587 85.449 20.736 1.00 0.00 O ATOM 14738 H1 WAT 1265 39.729 85.632 20.351 1.00 0.00 H ATOM 14739 H2 WAT 1265 40.909 86.303 21.023 1.00 0.00 H TER 14741 WAT 1265 ATOM 14741 O WAT 1266 131.211 114.358 104.803 1.00 0.00 O ATOM 14742 H1 WAT 1266 132.101 114.006 104.800 1.00 0.00 H ATOM 14743 H2 WAT 1266 131.305 115.244 105.152 1.00 0.00 H TER 14745 WAT 1266 ATOM 14745 O WAT 1267 45.687 118.451 132.116 1.00 0.00 O ATOM 14746 H1 WAT 1267 45.096 118.210 132.829 1.00 0.00 H ATOM 14747 H2 WAT 1267 45.435 117.877 131.392 1.00 0.00 H TER 14749 WAT 1267 ATOM 14749 O WAT 1268 77.927 37.729 105.551 1.00 0.00 O ATOM 14750 H1 WAT 1268 77.984 38.570 106.004 1.00 0.00 H ATOM 14751 H2 WAT 1268 77.401 37.179 106.132 1.00 0.00 H TER 14753 WAT 1268 ATOM 14753 O WAT 1269 23.548 70.580 149.405 1.00 0.00 O ATOM 14754 H1 WAT 1269 22.655 70.725 149.717 1.00 0.00 H ATOM 14755 H2 WAT 1269 24.045 70.364 150.194 1.00 0.00 H TER 14757 WAT 1269 ATOM 14757 O WAT 1270 34.601 27.620 97.990 1.00 0.00 O ATOM 14758 H1 WAT 1270 35.327 27.317 98.536 1.00 0.00 H ATOM 14759 H2 WAT 1270 34.971 28.338 97.477 1.00 0.00 H TER 14761 WAT 1270 ATOM 14761 O WAT 1271 52.765 56.888 1.649 1.00 0.00 O ATOM 14762 H1 WAT 1271 53.019 56.344 2.395 1.00 0.00 H ATOM 14763 H2 WAT 1271 53.394 56.663 0.964 1.00 0.00 H TER 14765 WAT 1271 ATOM 14765 O WAT 1272 139.390 33.802 95.538 1.00 0.00 O ATOM 14766 H1 WAT 1272 138.760 33.101 95.704 1.00 0.00 H ATOM 14767 H2 WAT 1272 139.638 34.113 96.408 1.00 0.00 H TER 14769 WAT 1272 ATOM 14769 O WAT 1273 79.621 11.667 91.490 1.00 0.00 O ATOM 14770 H1 WAT 1273 79.863 10.861 91.947 1.00 0.00 H ATOM 14771 H2 WAT 1273 80.456 12.056 91.233 1.00 0.00 H TER 14773 WAT 1273 ATOM 14773 O WAT 1274 74.883 2.917 7.769 1.00 0.00 O ATOM 14774 H1 WAT 1274 74.266 2.523 8.387 1.00 0.00 H ATOM 14775 H2 WAT 1274 75.592 2.278 7.698 1.00 0.00 H TER 14777 WAT 1274 ATOM 14777 O WAT 1275 11.193 118.531 18.840 1.00 0.00 O ATOM 14778 H1 WAT 1275 11.870 119.105 18.482 1.00 0.00 H ATOM 14779 H2 WAT 1275 11.045 117.879 18.155 1.00 0.00 H TER 14781 WAT 1275 ATOM 14781 O WAT 1276 95.336 14.192 123.059 1.00 0.00 O ATOM 14782 H1 WAT 1276 96.076 13.641 122.806 1.00 0.00 H ATOM 14783 H2 WAT 1276 95.738 14.974 123.438 1.00 0.00 H TER 14785 WAT 1276 ATOM 14785 O WAT 1277 42.051 59.924 136.497 1.00 0.00 O ATOM 14786 H1 WAT 1277 41.521 60.297 135.792 1.00 0.00 H ATOM 14787 H2 WAT 1277 41.513 60.028 137.282 1.00 0.00 H TER 14789 WAT 1277 ATOM 14789 O WAT 1278 134.312 136.106 1.577 1.00 0.00 O ATOM 14790 H1 WAT 1278 133.367 136.226 1.678 1.00 0.00 H ATOM 14791 H2 WAT 1278 134.694 136.917 1.913 1.00 0.00 H TER 14793 WAT 1278 ATOM 14793 O WAT 1279 83.631 124.143 60.189 1.00 0.00 O ATOM 14794 H1 WAT 1279 83.116 124.936 60.033 1.00 0.00 H ATOM 14795 H2 WAT 1279 83.970 123.905 59.327 1.00 0.00 H TER 14797 WAT 1279 ATOM 14797 O WAT 1280 18.900 91.884 13.275 1.00 0.00 O ATOM 14798 H1 WAT 1280 19.246 91.997 14.160 1.00 0.00 H ATOM 14799 H2 WAT 1280 17.950 91.943 13.380 1.00 0.00 H TER 14801 WAT 1280 ATOM 14801 O WAT 1281 116.365 57.306 92.754 1.00 0.00 O ATOM 14802 H1 WAT 1281 115.611 56.922 93.202 1.00 0.00 H ATOM 14803 H2 WAT 1281 116.572 56.684 92.057 1.00 0.00 H TER 14805 WAT 1281 ATOM 14805 O WAT 1282 2.347 2.572 97.507 1.00 0.00 O ATOM 14806 H1 WAT 1282 3.097 2.189 97.050 1.00 0.00 H ATOM 14807 H2 WAT 1282 1.738 1.842 97.620 1.00 0.00 H TER 14809 WAT 1282 ATOM 14809 O WAT 1283 142.664 71.836 88.943 1.00 0.00 O ATOM 14810 H1 WAT 1283 141.781 72.092 88.677 1.00 0.00 H ATOM 14811 H2 WAT 1283 142.940 72.522 89.550 1.00 0.00 H TER 14813 WAT 1283 ATOM 14813 O WAT 1284 49.904 143.805 151.147 1.00 0.00 O ATOM 14814 H1 WAT 1284 49.326 143.132 151.506 1.00 0.00 H ATOM 14815 H2 WAT 1284 50.425 144.097 151.894 1.00 0.00 H TER 14817 WAT 1284 ATOM 14817 O WAT 1285 12.365 86.235 74.148 1.00 0.00 O ATOM 14818 H1 WAT 1285 11.854 86.941 74.544 1.00 0.00 H ATOM 14819 H2 WAT 1285 12.574 85.652 74.879 1.00 0.00 H TER 14821 WAT 1285 ATOM 14821 O WAT 1286 139.374 64.807 60.154 1.00 0.00 O ATOM 14822 H1 WAT 1286 138.577 65.329 60.059 1.00 0.00 H ATOM 14823 H2 WAT 1286 139.539 64.461 59.277 1.00 0.00 H TER 14825 WAT 1286 ATOM 14825 O WAT 1287 68.804 53.840 136.369 1.00 0.00 O ATOM 14826 H1 WAT 1287 68.558 54.763 136.306 1.00 0.00 H ATOM 14827 H2 WAT 1287 67.993 53.364 136.192 1.00 0.00 H TER 14829 WAT 1287 ATOM 14829 O WAT 1288 116.435 30.059 105.967 1.00 0.00 O ATOM 14830 H1 WAT 1288 116.380 30.584 106.766 1.00 0.00 H ATOM 14831 H2 WAT 1288 117.151 30.455 105.470 1.00 0.00 H TER 14833 WAT 1288 ATOM 14833 O WAT 1289 140.646 115.196 76.776 1.00 0.00 O ATOM 14834 H1 WAT 1289 140.653 114.273 77.027 1.00 0.00 H ATOM 14835 H2 WAT 1289 141.503 115.342 76.375 1.00 0.00 H TER 14837 WAT 1289 ATOM 14837 O WAT 1290 90.587 140.311 135.518 1.00 0.00 O ATOM 14838 H1 WAT 1290 90.565 140.359 134.562 1.00 0.00 H ATOM 14839 H2 WAT 1290 89.829 140.822 135.801 1.00 0.00 H TER 14841 WAT 1290 ATOM 14841 O WAT 1291 3.610 7.665 114.138 1.00 0.00 O ATOM 14842 H1 WAT 1291 3.570 7.629 113.183 1.00 0.00 H ATOM 14843 H2 WAT 1291 2.863 7.141 114.429 1.00 0.00 H TER 14845 WAT 1291 ATOM 14845 O WAT 1292 62.989 48.879 3.372 1.00 0.00 O ATOM 14846 H1 WAT 1292 63.879 49.196 3.218 1.00 0.00 H ATOM 14847 H2 WAT 1292 63.098 48.149 3.982 1.00 0.00 H TER 14849 WAT 1292 ATOM 14849 O WAT 1293 128.044 79.934 117.910 1.00 0.00 O ATOM 14850 H1 WAT 1293 127.134 79.646 117.979 1.00 0.00 H ATOM 14851 H2 WAT 1293 128.365 79.930 118.812 1.00 0.00 H TER 14853 WAT 1293 ATOM 14853 O WAT 1294 24.057 81.870 150.516 1.00 0.00 O ATOM 14854 H1 WAT 1294 24.745 81.391 150.053 1.00 0.00 H ATOM 14855 H2 WAT 1294 23.495 81.187 150.882 1.00 0.00 H TER 14857 WAT 1294 ATOM 14857 O WAT 1295 138.317 87.010 128.515 1.00 0.00 O ATOM 14858 H1 WAT 1295 138.804 87.547 127.890 1.00 0.00 H ATOM 14859 H2 WAT 1295 138.709 87.215 129.364 1.00 0.00 H TER 14861 WAT 1295 ATOM 14861 O WAT 1296 131.328 73.936 17.607 1.00 0.00 O ATOM 14862 H1 WAT 1296 131.732 73.171 18.018 1.00 0.00 H ATOM 14863 H2 WAT 1296 131.352 74.612 18.284 1.00 0.00 H TER 14865 WAT 1296 ATOM 14865 O WAT 1297 117.744 119.716 118.946 1.00 0.00 O ATOM 14866 H1 WAT 1297 118.442 119.178 119.320 1.00 0.00 H ATOM 14867 H2 WAT 1297 117.807 120.548 119.415 1.00 0.00 H TER 14869 WAT 1297 ATOM 14869 O WAT 1298 118.868 24.785 62.911 1.00 0.00 O ATOM 14870 H1 WAT 1298 118.727 25.205 63.760 1.00 0.00 H ATOM 14871 H2 WAT 1298 117.998 24.491 62.641 1.00 0.00 H TER 14873 WAT 1298 ATOM 14873 O WAT 1299 48.736 88.454 31.025 1.00 0.00 O ATOM 14874 H1 WAT 1299 47.804 88.673 31.021 1.00 0.00 H ATOM 14875 H2 WAT 1299 48.844 87.850 30.290 1.00 0.00 H TER 14877 WAT 1299 ATOM 14877 O WAT 1300 99.291 42.521 134.584 1.00 0.00 O ATOM 14878 H1 WAT 1300 98.654 43.210 134.774 1.00 0.00 H ATOM 14879 H2 WAT 1300 100.137 42.968 134.589 1.00 0.00 H TER 14881 WAT 1300 ATOM 14881 O WAT 1301 134.449 16.675 133.445 1.00 0.00 O ATOM 14882 H1 WAT 1301 133.822 16.096 133.878 1.00 0.00 H ATOM 14883 H2 WAT 1301 134.001 17.519 133.394 1.00 0.00 H TER 14885 WAT 1301 ATOM 14885 O WAT 1302 96.196 34.330 13.315 1.00 0.00 O ATOM 14886 H1 WAT 1302 95.666 35.006 12.893 1.00 0.00 H ATOM 14887 H2 WAT 1302 96.229 33.617 12.677 1.00 0.00 H TER 14889 WAT 1302 ATOM 14889 O WAT 1303 62.751 143.082 93.283 1.00 0.00 O ATOM 14890 H1 WAT 1303 62.028 142.457 93.240 1.00 0.00 H ATOM 14891 H2 WAT 1303 62.462 143.741 93.914 1.00 0.00 H TER 14893 WAT 1303 ATOM 14893 O WAT 1304 69.016 35.902 142.064 1.00 0.00 O ATOM 14894 H1 WAT 1304 68.908 36.675 142.618 1.00 0.00 H ATOM 14895 H2 WAT 1304 69.023 35.167 142.677 1.00 0.00 H TER 14897 WAT 1304 ATOM 14897 O WAT 1305 81.466 9.903 111.225 1.00 0.00 O ATOM 14898 H1 WAT 1305 81.447 9.008 111.566 1.00 0.00 H ATOM 14899 H2 WAT 1305 81.105 10.436 111.933 1.00 0.00 H TER 14901 WAT 1305 ATOM 14901 O WAT 1306 117.208 45.097 144.251 1.00 0.00 O ATOM 14902 H1 WAT 1306 117.840 45.757 144.536 1.00 0.00 H ATOM 14903 H2 WAT 1306 116.611 45.570 143.671 1.00 0.00 H TER 14905 WAT 1306 ATOM 14905 O WAT 1307 108.969 69.377 67.320 1.00 0.00 O ATOM 14906 H1 WAT 1307 108.690 68.461 67.340 1.00 0.00 H ATOM 14907 H2 WAT 1307 108.152 69.876 67.310 1.00 0.00 H TER 14909 WAT 1307 ATOM 14909 O WAT 1308 70.410 116.060 86.333 1.00 0.00 O ATOM 14910 H1 WAT 1308 70.096 116.382 85.488 1.00 0.00 H ATOM 14911 H2 WAT 1308 71.291 116.424 86.415 1.00 0.00 H TER 14913 WAT 1308 ATOM 14913 O WAT 1309 116.641 76.105 75.736 1.00 0.00 O ATOM 14914 H1 WAT 1309 115.793 75.930 76.144 1.00 0.00 H ATOM 14915 H2 WAT 1309 117.279 75.715 76.333 1.00 0.00 H TER 14917 WAT 1309 ATOM 14917 O WAT 1310 108.252 88.763 99.043 1.00 0.00 O ATOM 14918 H1 WAT 1310 108.651 88.555 99.888 1.00 0.00 H ATOM 14919 H2 WAT 1310 108.350 89.712 98.959 1.00 0.00 H TER 14921 WAT 1310 ATOM 14921 O WAT 1311 18.989 59.696 7.426 1.00 0.00 O ATOM 14922 H1 WAT 1311 18.877 59.650 6.477 1.00 0.00 H ATOM 14923 H2 WAT 1311 18.172 60.079 7.746 1.00 0.00 H TER 14925 WAT 1311 ATOM 14925 O WAT 1312 14.466 138.686 24.763 1.00 0.00 O ATOM 14926 H1 WAT 1312 14.899 139.516 24.563 1.00 0.00 H ATOM 14927 H2 WAT 1312 14.445 138.219 23.928 1.00 0.00 H TER 14929 WAT 1312 ATOM 14929 O WAT 1313 96.066 9.456 134.414 1.00 0.00 O ATOM 14930 H1 WAT 1313 96.057 9.343 133.464 1.00 0.00 H ATOM 14931 H2 WAT 1313 96.619 8.743 134.735 1.00 0.00 H TER 14933 WAT 1313 ATOM 14933 O WAT 1314 111.885 122.856 145.946 1.00 0.00 O ATOM 14934 H1 WAT 1314 112.477 123.599 145.825 1.00 0.00 H ATOM 14935 H2 WAT 1314 111.421 122.781 145.112 1.00 0.00 H TER 14937 WAT 1314 ATOM 14937 O WAT 1315 91.587 1.215 92.834 1.00 0.00 O ATOM 14938 H1 WAT 1315 92.145 1.991 92.879 1.00 0.00 H ATOM 14939 H2 WAT 1315 91.160 1.176 93.690 1.00 0.00 H TER 14941 WAT 1315 ATOM 14941 O WAT 1316 95.966 126.941 134.786 1.00 0.00 O ATOM 14942 H1 WAT 1316 95.074 126.747 135.073 1.00 0.00 H ATOM 14943 H2 WAT 1316 96.428 127.188 135.587 1.00 0.00 H TER 14945 WAT 1316 ATOM 14945 O WAT 1317 21.328 48.724 132.873 1.00 0.00 O ATOM 14946 H1 WAT 1317 20.986 48.328 132.072 1.00 0.00 H ATOM 14947 H2 WAT 1317 20.909 48.234 133.580 1.00 0.00 H TER 14949 WAT 1317 ATOM 14949 O WAT 1318 81.595 145.130 114.481 1.00 0.00 O ATOM 14950 H1 WAT 1318 82.310 145.551 114.957 1.00 0.00 H ATOM 14951 H2 WAT 1318 81.281 145.803 113.877 1.00 0.00 H TER 14953 WAT 1318 ATOM 14953 O WAT 1319 12.334 74.564 104.705 1.00 0.00 O ATOM 14954 H1 WAT 1319 12.766 75.111 105.361 1.00 0.00 H ATOM 14955 H2 WAT 1319 12.471 73.668 105.012 1.00 0.00 H TER 14957 WAT 1319 ATOM 14957 O WAT 1320 27.198 58.912 133.237 1.00 0.00 O ATOM 14958 H1 WAT 1320 26.703 59.700 133.015 1.00 0.00 H ATOM 14959 H2 WAT 1320 27.505 58.576 132.395 1.00 0.00 H TER 14961 WAT 1320 ATOM 14961 O WAT 1321 63.978 107.695 8.791 1.00 0.00 O ATOM 14962 H1 WAT 1321 64.088 106.998 8.145 1.00 0.00 H ATOM 14963 H2 WAT 1321 64.204 107.286 9.627 1.00 0.00 H TER 14965 WAT 1321 ATOM 14965 O WAT 1322 29.424 30.591 12.505 1.00 0.00 O ATOM 14966 H1 WAT 1322 29.125 31.476 12.711 1.00 0.00 H ATOM 14967 H2 WAT 1322 29.864 30.678 11.659 1.00 0.00 H TER 14969 WAT 1322 ATOM 14969 O WAT 1323 73.174 43.176 63.066 1.00 0.00 O ATOM 14970 H1 WAT 1323 73.921 42.808 62.594 1.00 0.00 H ATOM 14971 H2 WAT 1323 73.359 44.114 63.114 1.00 0.00 H TER 14973 WAT 1323 ATOM 14973 O WAT 1324 97.916 40.770 81.387 1.00 0.00 O ATOM 14974 H1 WAT 1324 97.165 40.743 81.981 1.00 0.00 H ATOM 14975 H2 WAT 1324 97.528 40.779 80.512 1.00 0.00 H TER 14977 WAT 1324 ATOM 14977 O WAT 1325 56.406 9.333 66.723 1.00 0.00 O ATOM 14978 H1 WAT 1325 56.189 9.363 67.655 1.00 0.00 H ATOM 14979 H2 WAT 1325 55.970 10.100 66.351 1.00 0.00 H TER 14981 WAT 1325 ATOM 14981 O WAT 1326 85.446 71.850 73.037 1.00 0.00 O ATOM 14982 H1 WAT 1326 86.252 72.363 73.104 1.00 0.00 H ATOM 14983 H2 WAT 1326 84.746 72.482 73.197 1.00 0.00 H TER 14985 WAT 1326 ATOM 14985 O WAT 1327 66.479 116.057 56.235 1.00 0.00 O ATOM 14986 H1 WAT 1327 67.356 115.952 55.866 1.00 0.00 H ATOM 14987 H2 WAT 1327 65.974 116.475 55.538 1.00 0.00 H TER 14989 WAT 1327 ATOM 14989 O WAT 1328 22.338 26.615 138.339 1.00 0.00 O ATOM 14990 H1 WAT 1328 21.831 27.382 138.072 1.00 0.00 H ATOM 14991 H2 WAT 1328 21.688 26.014 138.704 1.00 0.00 H TER 14993 WAT 1328 ATOM 14993 O WAT 1329 134.116 55.797 12.684 1.00 0.00 O ATOM 14994 H1 WAT 1329 133.325 56.289 12.464 1.00 0.00 H ATOM 14995 H2 WAT 1329 134.300 55.277 11.902 1.00 0.00 H TER 14997 WAT 1329 ATOM 14997 O WAT 1330 78.121 54.776 133.149 1.00 0.00 O ATOM 14998 H1 WAT 1330 77.794 54.136 132.516 1.00 0.00 H ATOM 14999 H2 WAT 1330 78.641 55.386 132.626 1.00 0.00 H TER 15001 WAT 1330 ATOM 15001 O WAT 1331 139.925 3.733 107.883 1.00 0.00 O ATOM 15002 H1 WAT 1331 139.092 3.529 108.309 1.00 0.00 H ATOM 15003 H2 WAT 1331 139.748 3.630 106.948 1.00 0.00 H TER 15005 WAT 1331 ATOM 15005 O WAT 1332 88.189 76.675 8.468 1.00 0.00 O ATOM 15006 H1 WAT 1332 87.802 76.403 7.636 1.00 0.00 H ATOM 15007 H2 WAT 1332 88.085 75.914 9.040 1.00 0.00 H TER 15009 WAT 1332 ATOM 15009 O WAT 1333 79.129 97.436 12.889 1.00 0.00 O ATOM 15010 H1 WAT 1333 79.290 98.349 12.653 1.00 0.00 H ATOM 15011 H2 WAT 1333 78.370 97.470 13.472 1.00 0.00 H TER 15013 WAT 1333 ATOM 15013 O WAT 1334 116.142 41.320 92.210 1.00 0.00 O ATOM 15014 H1 WAT 1334 116.860 41.219 92.834 1.00 0.00 H ATOM 15015 H2 WAT 1334 116.447 41.993 91.601 1.00 0.00 H TER 15017 WAT 1334 ATOM 15017 O WAT 1335 110.264 97.124 13.587 1.00 0.00 O ATOM 15018 H1 WAT 1335 110.404 96.508 14.305 1.00 0.00 H ATOM 15019 H2 WAT 1335 109.397 97.494 13.755 1.00 0.00 H TER 15021 WAT 1335 ATOM 15021 O WAT 1336 118.815 84.928 14.166 1.00 0.00 O ATOM 15022 H1 WAT 1336 119.009 84.205 13.570 1.00 0.00 H ATOM 15023 H2 WAT 1336 118.203 85.482 13.681 1.00 0.00 H TER 15025 WAT 1336 ATOM 15025 O WAT 1337 140.908 21.389 70.914 1.00 0.00 O ATOM 15026 H1 WAT 1337 140.002 21.153 71.110 1.00 0.00 H ATOM 15027 H2 WAT 1337 141.216 20.694 70.333 1.00 0.00 H TER 15029 WAT 1337 ATOM 15029 O WAT 1338 113.855 34.116 74.431 1.00 0.00 O ATOM 15030 H1 WAT 1338 112.938 33.884 74.575 1.00 0.00 H ATOM 15031 H2 WAT 1338 113.885 34.421 73.524 1.00 0.00 H TER 15033 WAT 1338 ATOM 15033 O WAT 1339 55.353 84.607 109.277 1.00 0.00 O ATOM 15034 H1 WAT 1339 55.009 85.202 108.611 1.00 0.00 H ATOM 15035 H2 WAT 1339 56.119 85.060 109.630 1.00 0.00 H TER 15037 WAT 1339 ATOM 15037 O WAT 1340 67.268 102.559 97.763 1.00 0.00 O ATOM 15038 H1 WAT 1340 66.803 102.554 98.600 1.00 0.00 H ATOM 15039 H2 WAT 1340 67.922 103.252 97.856 1.00 0.00 H TER 15041 WAT 1340 ATOM 15041 O WAT 1341 77.198 1.100 146.581 1.00 0.00 O ATOM 15042 H1 WAT 1341 76.867 1.786 147.161 1.00 0.00 H ATOM 15043 H2 WAT 1341 77.991 1.473 146.197 1.00 0.00 H TER 15045 WAT 1341 ATOM 15045 O WAT 1342 57.415 134.788 145.396 1.00 0.00 O ATOM 15046 H1 WAT 1342 57.614 135.669 145.713 1.00 0.00 H ATOM 15047 H2 WAT 1342 58.199 134.278 145.596 1.00 0.00 H TER 15049 WAT 1342 ATOM 15049 O WAT 1343 47.082 39.902 140.041 1.00 0.00 O ATOM 15050 H1 WAT 1343 46.636 40.234 140.820 1.00 0.00 H ATOM 15051 H2 WAT 1343 47.462 39.069 140.320 1.00 0.00 H TER 15053 WAT 1343 ATOM 15053 O WAT 1344 133.374 57.238 118.677 1.00 0.00 O ATOM 15054 H1 WAT 1344 133.396 56.509 118.058 1.00 0.00 H ATOM 15055 H2 WAT 1344 133.459 58.019 118.130 1.00 0.00 H TER 15057 WAT 1344 ATOM 15057 O WAT 1345 54.784 0.382 65.929 1.00 0.00 O ATOM 15058 H1 WAT 1345 55.704 0.594 66.085 1.00 0.00 H ATOM 15059 H2 WAT 1345 54.343 1.231 65.904 1.00 0.00 H TER 15061 WAT 1345 ATOM 15061 O WAT 1346 102.450 138.120 11.895 1.00 0.00 O ATOM 15062 H1 WAT 1346 101.777 138.244 12.565 1.00 0.00 H ATOM 15063 H2 WAT 1346 102.760 137.225 12.030 1.00 0.00 H TER 15065 WAT 1346 ATOM 15065 O WAT 1347 91.763 135.586 16.837 1.00 0.00 O ATOM 15066 H1 WAT 1347 92.273 135.058 17.451 1.00 0.00 H ATOM 15067 H2 WAT 1347 91.557 136.386 17.322 1.00 0.00 H TER 15069 WAT 1347 ATOM 15069 O WAT 1348 23.476 59.883 69.452 1.00 0.00 O ATOM 15070 H1 WAT 1348 24.088 60.069 70.164 1.00 0.00 H ATOM 15071 H2 WAT 1348 23.931 59.239 68.909 1.00 0.00 H TER 15073 WAT 1348 ATOM 15073 O WAT 1349 79.629 112.533 66.976 1.00 0.00 O ATOM 15074 H1 WAT 1349 80.576 112.652 66.909 1.00 0.00 H ATOM 15075 H2 WAT 1349 79.419 111.893 66.296 1.00 0.00 H TER 15077 WAT 1349 ATOM 15077 O WAT 1350 117.668 71.746 149.977 1.00 0.00 O ATOM 15078 H1 WAT 1350 116.777 71.396 149.972 1.00 0.00 H ATOM 15079 H2 WAT 1350 118.176 71.117 149.465 1.00 0.00 H TER 15081 WAT 1350 ATOM 15081 O WAT 1351 50.508 41.609 73.362 1.00 0.00 O ATOM 15082 H1 WAT 1351 50.948 42.413 73.637 1.00 0.00 H ATOM 15083 H2 WAT 1351 50.258 41.771 72.453 1.00 0.00 H TER 15085 WAT 1351 ATOM 15085 O WAT 1352 69.640 20.281 8.725 1.00 0.00 O ATOM 15086 H1 WAT 1352 69.889 21.169 8.468 1.00 0.00 H ATOM 15087 H2 WAT 1352 68.788 20.142 8.312 1.00 0.00 H TER 15089 WAT 1352 ATOM 15089 O WAT 1353 81.104 22.717 74.358 1.00 0.00 O ATOM 15090 H1 WAT 1353 81.487 23.030 75.177 1.00 0.00 H ATOM 15091 H2 WAT 1353 81.774 22.894 73.697 1.00 0.00 H TER 15093 WAT 1353 ATOM 15093 O WAT 1354 3.111 84.459 8.685 1.00 0.00 O ATOM 15094 H1 WAT 1354 3.321 85.323 9.040 1.00 0.00 H ATOM 15095 H2 WAT 1354 3.446 83.844 9.338 1.00 0.00 H TER 15097 WAT 1354 ATOM 15097 O WAT 1355 2.272 62.387 99.845 1.00 0.00 O ATOM 15098 H1 WAT 1355 2.571 61.855 99.107 1.00 0.00 H ATOM 15099 H2 WAT 1355 1.316 62.350 99.794 1.00 0.00 H TER 15101 WAT 1355 ATOM 15101 O WAT 1356 121.357 122.826 92.208 1.00 0.00 O ATOM 15102 H1 WAT 1356 120.658 122.419 92.719 1.00 0.00 H ATOM 15103 H2 WAT 1356 121.032 122.817 91.308 1.00 0.00 H TER 15105 WAT 1356 ATOM 15105 O WAT 1357 18.550 33.875 58.210 1.00 0.00 O ATOM 15106 H1 WAT 1357 19.281 33.899 58.827 1.00 0.00 H ATOM 15107 H2 WAT 1357 17.769 33.900 58.763 1.00 0.00 H TER 15109 WAT 1357 ATOM 15109 O WAT 1358 40.990 96.561 150.503 1.00 0.00 O ATOM 15110 H1 WAT 1358 40.531 96.406 151.329 1.00 0.00 H ATOM 15111 H2 WAT 1358 41.403 95.723 150.297 1.00 0.00 H TER 15113 WAT 1358 ATOM 15113 O WAT 1359 130.310 82.355 146.164 1.00 0.00 O ATOM 15114 H1 WAT 1359 129.748 82.142 145.419 1.00 0.00 H ATOM 15115 H2 WAT 1359 130.216 83.302 146.272 1.00 0.00 H TER 15117 WAT 1359 ATOM 15117 O WAT 1360 54.818 102.187 102.912 1.00 0.00 O ATOM 15118 H1 WAT 1360 54.163 102.676 102.414 1.00 0.00 H ATOM 15119 H2 WAT 1360 55.635 102.328 102.434 1.00 0.00 H TER 15121 WAT 1360 ATOM 15121 O WAT 1361 69.648 70.042 114.869 1.00 0.00 O ATOM 15122 H1 WAT 1361 69.600 69.125 114.601 1.00 0.00 H ATOM 15123 H2 WAT 1361 68.753 70.263 115.129 1.00 0.00 H TER 15125 WAT 1361 ATOM 15125 O WAT 1362 41.594 98.542 15.443 1.00 0.00 O ATOM 15126 H1 WAT 1362 42.075 99.356 15.590 1.00 0.00 H ATOM 15127 H2 WAT 1362 41.152 98.674 14.604 1.00 0.00 H TER 15129 WAT 1362 ATOM 15129 O WAT 1363 43.124 73.866 136.717 1.00 0.00 O ATOM 15130 H1 WAT 1363 43.816 73.903 136.057 1.00 0.00 H ATOM 15131 H2 WAT 1363 42.838 74.774 136.815 1.00 0.00 H TER 15133 WAT 1363 ATOM 15133 O WAT 1364 104.416 118.372 119.318 1.00 0.00 O ATOM 15134 H1 WAT 1364 104.915 119.189 119.335 1.00 0.00 H ATOM 15135 H2 WAT 1364 104.300 118.143 120.241 1.00 0.00 H TER 15137 WAT 1364 ATOM 15137 O WAT 1365 108.647 13.130 120.840 1.00 0.00 O ATOM 15138 H1 WAT 1365 109.493 13.392 121.201 1.00 0.00 H ATOM 15139 H2 WAT 1365 108.719 12.183 120.723 1.00 0.00 H TER 15141 WAT 1365 ATOM 15141 O WAT 1366 84.739 60.822 78.554 1.00 0.00 O ATOM 15142 H1 WAT 1366 84.517 61.672 78.173 1.00 0.00 H ATOM 15143 H2 WAT 1366 84.101 60.702 79.258 1.00 0.00 H TER 15145 WAT 1366 ATOM 15145 O WAT 1367 130.898 127.116 7.194 1.00 0.00 O ATOM 15146 H1 WAT 1367 130.574 126.230 7.034 1.00 0.00 H ATOM 15147 H2 WAT 1367 131.065 127.471 6.320 1.00 0.00 H TER 15149 WAT 1367 ATOM 15149 O WAT 1368 124.021 19.856 152.470 1.00 0.00 O ATOM 15150 H1 WAT 1368 123.143 19.591 152.746 1.00 0.00 H ATOM 15151 H2 WAT 1368 123.922 20.768 152.199 1.00 0.00 H TER 15153 WAT 1368 ATOM 15153 O WAT 1369 116.730 128.443 117.170 1.00 0.00 O ATOM 15154 H1 WAT 1369 115.892 128.143 117.521 1.00 0.00 H ATOM 15155 H2 WAT 1369 116.636 128.359 116.221 1.00 0.00 H TER 15157 WAT 1369 ATOM 15157 O WAT 1370 126.036 28.773 109.240 1.00 0.00 O ATOM 15158 H1 WAT 1370 126.410 28.221 108.554 1.00 0.00 H ATOM 15159 H2 WAT 1370 126.724 28.830 109.903 1.00 0.00 H TER 15161 WAT 1370 ATOM 15161 O WAT 1371 39.386 35.473 12.331 1.00 0.00 O ATOM 15162 H1 WAT 1371 39.095 34.715 11.824 1.00 0.00 H ATOM 15163 H2 WAT 1371 39.521 35.133 13.215 1.00 0.00 H TER 15165 WAT 1371 ATOM 15165 O WAT 1372 119.256 114.608 72.921 1.00 0.00 O ATOM 15166 H1 WAT 1372 118.818 114.845 72.103 1.00 0.00 H ATOM 15167 H2 WAT 1372 119.972 114.033 72.652 1.00 0.00 H TER 15169 WAT 1372 ATOM 15169 O WAT 1373 26.020 72.731 5.657 1.00 0.00 O ATOM 15170 H1 WAT 1373 26.171 73.417 6.307 1.00 0.00 H ATOM 15171 H2 WAT 1373 26.890 72.374 5.478 1.00 0.00 H TER 15173 WAT 1373 ATOM 15173 O WAT 1374 142.395 49.412 109.264 1.00 0.00 O ATOM 15174 H1 WAT 1374 143.241 49.299 108.831 1.00 0.00 H ATOM 15175 H2 WAT 1374 141.794 48.862 108.762 1.00 0.00 H TER 15177 WAT 1374 ATOM 15177 O WAT 1375 57.901 11.422 113.688 1.00 0.00 O ATOM 15178 H1 WAT 1375 57.368 10.908 113.082 1.00 0.00 H ATOM 15179 H2 WAT 1375 58.649 10.859 113.886 1.00 0.00 H TER 15181 WAT 1375 ATOM 15181 O WAT 1376 52.097 20.464 121.297 1.00 0.00 O ATOM 15182 H1 WAT 1376 52.696 20.895 120.686 1.00 0.00 H ATOM 15183 H2 WAT 1376 52.474 19.594 121.428 1.00 0.00 H TER 15185 WAT 1376 ATOM 15185 O WAT 1377 64.260 47.374 84.865 1.00 0.00 O ATOM 15186 H1 WAT 1377 64.367 48.115 85.461 1.00 0.00 H ATOM 15187 H2 WAT 1377 63.650 47.689 84.198 1.00 0.00 H TER 15189 WAT 1377 ATOM 15189 O WAT 1378 86.749 106.316 125.390 1.00 0.00 O ATOM 15190 H1 WAT 1378 86.632 107.074 124.816 1.00 0.00 H ATOM 15191 H2 WAT 1378 86.747 105.565 124.798 1.00 0.00 H TER 15193 WAT 1378 ATOM 15193 O WAT 1379 100.224 72.137 132.702 1.00 0.00 O ATOM 15194 H1 WAT 1379 100.977 71.649 133.037 1.00 0.00 H ATOM 15195 H2 WAT 1379 99.478 71.556 132.847 1.00 0.00 H TER 15197 WAT 1379 ATOM 15197 O WAT 1380 132.293 42.267 9.656 1.00 0.00 O ATOM 15198 H1 WAT 1380 132.600 42.806 8.927 1.00 0.00 H ATOM 15199 H2 WAT 1380 132.583 42.735 10.439 1.00 0.00 H TER 15201 WAT 1380 ATOM 15201 O WAT 1381 121.980 23.665 87.728 1.00 0.00 O ATOM 15202 H1 WAT 1381 121.823 23.944 86.826 1.00 0.00 H ATOM 15203 H2 WAT 1381 122.022 22.710 87.679 1.00 0.00 H TER 15205 WAT 1381 ATOM 15205 O WAT 1382 64.472 85.573 21.806 1.00 0.00 O ATOM 15206 H1 WAT 1382 64.965 86.264 22.248 1.00 0.00 H ATOM 15207 H2 WAT 1382 64.679 84.779 22.298 1.00 0.00 H TER 15209 WAT 1382 ATOM 15209 O WAT 1383 138.481 144.004 88.561 1.00 0.00 O ATOM 15210 H1 WAT 1383 138.968 143.949 87.739 1.00 0.00 H ATOM 15211 H2 WAT 1383 137.726 144.556 88.357 1.00 0.00 H TER 15213 WAT 1383 ATOM 15213 O WAT 1384 58.965 46.440 113.900 1.00 0.00 O ATOM 15214 H1 WAT 1384 58.702 47.353 114.014 1.00 0.00 H ATOM 15215 H2 WAT 1384 59.883 46.420 114.169 1.00 0.00 H TER 15217 WAT 1384 ATOM 15217 O WAT 1385 11.664 134.258 8.421 1.00 0.00 O ATOM 15218 H1 WAT 1385 11.749 134.728 9.250 1.00 0.00 H ATOM 15219 H2 WAT 1385 10.762 134.420 8.144 1.00 0.00 H TER 15221 WAT 1385 ATOM 15221 O WAT 1386 18.951 62.331 110.312 1.00 0.00 O ATOM 15222 H1 WAT 1386 18.211 62.447 110.907 1.00 0.00 H ATOM 15223 H2 WAT 1386 18.599 62.542 109.447 1.00 0.00 H TER 15225 WAT 1386 ATOM 15225 O WAT 1387 23.997 23.767 153.533 1.00 0.00 O ATOM 15226 H1 WAT 1387 24.155 22.974 154.045 1.00 0.00 H ATOM 15227 H2 WAT 1387 23.869 24.453 154.187 1.00 0.00 H TER 15229 WAT 1387 ATOM 15229 O WAT 1388 29.025 63.622 65.471 1.00 0.00 O ATOM 15230 H1 WAT 1388 28.445 64.379 65.543 1.00 0.00 H ATOM 15231 H2 WAT 1388 29.716 63.787 66.113 1.00 0.00 H TER 15233 WAT 1388 ATOM 15233 O WAT 1389 65.962 51.198 69.237 1.00 0.00 O ATOM 15234 H1 WAT 1389 65.405 51.974 69.178 1.00 0.00 H ATOM 15235 H2 WAT 1389 65.416 50.486 68.905 1.00 0.00 H TER 15237 WAT 1389 ATOM 15237 O WAT 1390 89.347 46.663 84.012 1.00 0.00 O ATOM 15238 H1 WAT 1390 89.637 46.868 84.900 1.00 0.00 H ATOM 15239 H2 WAT 1390 90.144 46.706 83.483 1.00 0.00 H TER 15241 WAT 1390 ATOM 15241 O WAT 1391 85.841 117.749 131.151 1.00 0.00 O ATOM 15242 H1 WAT 1391 85.677 116.816 131.017 1.00 0.00 H ATOM 15243 H2 WAT 1391 85.340 117.970 131.937 1.00 0.00 H TER 15245 WAT 1391 ATOM 15245 O WAT 1392 20.849 67.820 105.149 1.00 0.00 O ATOM 15246 H1 WAT 1392 20.606 67.387 104.330 1.00 0.00 H ATOM 15247 H2 WAT 1392 20.630 67.185 105.830 1.00 0.00 H TER 15249 WAT 1392 ATOM 15249 O WAT 1393 44.633 83.832 112.544 1.00 0.00 O ATOM 15250 H1 WAT 1393 45.006 83.160 113.113 1.00 0.00 H ATOM 15251 H2 WAT 1393 44.565 84.607 113.102 1.00 0.00 H TER 15253 WAT 1393 ATOM 15253 O WAT 1394 47.857 51.321 145.368 1.00 0.00 O ATOM 15254 H1 WAT 1394 48.500 50.730 145.760 1.00 0.00 H ATOM 15255 H2 WAT 1394 48.227 52.195 145.493 1.00 0.00 H TER 15257 WAT 1394 ATOM 15257 O WAT 1395 50.493 2.242 103.982 1.00 0.00 O ATOM 15258 H1 WAT 1395 50.897 1.703 103.302 1.00 0.00 H ATOM 15259 H2 WAT 1395 49.697 2.585 103.574 1.00 0.00 H TER 15261 WAT 1395 ATOM 15261 O WAT 1396 97.899 121.713 156.699 1.00 0.00 O ATOM 15262 H1 WAT 1396 97.817 121.315 155.833 1.00 0.00 H ATOM 15263 H2 WAT 1396 97.367 122.507 156.650 1.00 0.00 H TER 15265 WAT 1396 ATOM 15265 O WAT 1397 31.900 131.463 143.123 1.00 0.00 O ATOM 15266 H1 WAT 1397 31.259 130.956 142.625 1.00 0.00 H ATOM 15267 H2 WAT 1397 32.577 131.685 142.483 1.00 0.00 H TER 15269 WAT 1397 ATOM 15269 O WAT 1398 65.890 76.111 83.180 1.00 0.00 O ATOM 15270 H1 WAT 1398 64.943 76.212 83.090 1.00 0.00 H ATOM 15271 H2 WAT 1398 66.008 75.211 83.485 1.00 0.00 H TER 15273 WAT 1398 ATOM 15273 O WAT 1399 90.296 14.100 6.364 1.00 0.00 O ATOM 15274 H1 WAT 1399 90.146 13.941 5.432 1.00 0.00 H ATOM 15275 H2 WAT 1399 91.122 14.584 6.395 1.00 0.00 H TER 15277 WAT 1399 ATOM 15277 O WAT 1400 31.752 14.082 62.598 1.00 0.00 O ATOM 15278 H1 WAT 1400 32.073 14.688 63.266 1.00 0.00 H ATOM 15279 H2 WAT 1400 30.836 14.329 62.471 1.00 0.00 H TER 15281 WAT 1400 ATOM 15281 O WAT 1401 18.696 24.804 87.359 1.00 0.00 O ATOM 15282 H1 WAT 1401 18.194 25.612 87.468 1.00 0.00 H ATOM 15283 H2 WAT 1401 19.608 25.074 87.460 1.00 0.00 H TER 15285 WAT 1401 ATOM 15285 O WAT 1402 116.500 114.010 17.024 1.00 0.00 O ATOM 15286 H1 WAT 1402 117.360 113.875 17.421 1.00 0.00 H ATOM 15287 H2 WAT 1402 116.132 114.756 17.499 1.00 0.00 H TER 15289 WAT 1402 ATOM 15289 O WAT 1403 139.909 91.679 73.900 1.00 0.00 O ATOM 15290 H1 WAT 1403 139.030 91.739 73.526 1.00 0.00 H ATOM 15291 H2 WAT 1403 139.837 92.111 74.751 1.00 0.00 H TER 15293 WAT 1403 ATOM 15293 O WAT 1404 122.838 24.803 114.143 1.00 0.00 O ATOM 15294 H1 WAT 1404 123.455 24.501 114.810 1.00 0.00 H ATOM 15295 H2 WAT 1404 122.303 25.458 114.591 1.00 0.00 H TER 15297 WAT 1404 ATOM 15297 O WAT 1405 103.977 19.259 20.983 1.00 0.00 O ATOM 15298 H1 WAT 1405 103.479 19.928 21.453 1.00 0.00 H ATOM 15299 H2 WAT 1405 104.808 19.684 20.771 1.00 0.00 H TER 15301 WAT 1405 ATOM 15301 O WAT 1406 114.794 72.759 14.329 1.00 0.00 O ATOM 15302 H1 WAT 1406 114.469 72.418 15.162 1.00 0.00 H ATOM 15303 H2 WAT 1406 115.747 72.713 14.406 1.00 0.00 H TER 15305 WAT 1406 ATOM 15305 O WAT 1407 2.013 74.249 2.418 1.00 0.00 O ATOM 15306 H1 WAT 1407 1.925 74.643 1.550 1.00 0.00 H ATOM 15307 H2 WAT 1407 2.484 73.430 2.264 1.00 0.00 H TER 15309 WAT 1407 ATOM 15309 O WAT 1408 26.923 62.128 69.482 1.00 0.00 O ATOM 15310 H1 WAT 1408 27.782 62.026 69.071 1.00 0.00 H ATOM 15311 H2 WAT 1408 26.299 62.015 68.765 1.00 0.00 H TER 15313 WAT 1408 ATOM 15313 O WAT 1409 108.543 90.331 53.977 1.00 0.00 O ATOM 15314 H1 WAT 1409 107.683 89.984 54.214 1.00 0.00 H ATOM 15315 H2 WAT 1409 109.062 89.556 53.759 1.00 0.00 H TER 15317 WAT 1409 ATOM 15317 O WAT 1410 110.938 140.176 127.402 1.00 0.00 O ATOM 15318 H1 WAT 1410 111.474 140.967 127.475 1.00 0.00 H ATOM 15319 H2 WAT 1410 111.035 139.743 128.250 1.00 0.00 H TER 15321 WAT 1410 ATOM 15321 O WAT 1411 142.327 95.268 129.338 1.00 0.00 O ATOM 15322 H1 WAT 1411 141.817 95.641 128.619 1.00 0.00 H ATOM 15323 H2 WAT 1411 142.212 94.322 129.248 1.00 0.00 H TER 15325 WAT 1411 ATOM 15325 O WAT 1412 30.018 108.333 154.667 1.00 0.00 O ATOM 15326 H1 WAT 1412 29.097 108.332 154.404 1.00 0.00 H ATOM 15327 H2 WAT 1412 30.272 107.410 154.654 1.00 0.00 H TER 15329 WAT 1412 ATOM 15329 O WAT 1413 139.726 95.411 21.276 1.00 0.00 O ATOM 15330 H1 WAT 1413 139.601 95.839 22.123 1.00 0.00 H ATOM 15331 H2 WAT 1413 140.529 95.800 20.927 1.00 0.00 H TER 15333 WAT 1413 ATOM 15333 O WAT 1414 115.955 46.876 129.203 1.00 0.00 O ATOM 15334 H1 WAT 1414 116.508 46.893 128.422 1.00 0.00 H ATOM 15335 H2 WAT 1414 115.189 46.364 128.943 1.00 0.00 H TER 15337 WAT 1414 ATOM 15337 O WAT 1415 6.955 103.877 95.586 1.00 0.00 O ATOM 15338 H1 WAT 1415 7.306 104.333 96.351 1.00 0.00 H ATOM 15339 H2 WAT 1415 7.440 103.053 95.554 1.00 0.00 H TER 15341 WAT 1415 ATOM 15341 O WAT 1416 105.383 3.983 135.749 1.00 0.00 O ATOM 15342 H1 WAT 1416 106.224 3.974 136.207 1.00 0.00 H ATOM 15343 H2 WAT 1416 104.730 4.006 136.448 1.00 0.00 H TER 15345 WAT 1416 ATOM 15345 O WAT 1417 2.803 85.649 152.843 1.00 0.00 O ATOM 15346 H1 WAT 1417 2.319 85.773 152.026 1.00 0.00 H ATOM 15347 H2 WAT 1417 2.167 85.847 153.530 1.00 0.00 H TER 15349 WAT 1417 ATOM 15349 O WAT 1418 4.534 76.784 16.592 1.00 0.00 O ATOM 15350 H1 WAT 1418 4.384 77.184 17.448 1.00 0.00 H ATOM 15351 H2 WAT 1418 3.743 76.984 16.092 1.00 0.00 H TER 15353 WAT 1418 ATOM 15353 O WAT 1419 129.764 75.728 96.513 1.00 0.00 O ATOM 15354 H1 WAT 1419 129.820 75.838 97.462 1.00 0.00 H ATOM 15355 H2 WAT 1419 130.250 76.472 96.156 1.00 0.00 H TER 15357 WAT 1419 ATOM 15357 O WAT 1420 110.277 31.184 17.277 1.00 0.00 O ATOM 15358 H1 WAT 1420 110.561 30.321 16.975 1.00 0.00 H ATOM 15359 H2 WAT 1420 110.592 31.788 16.604 1.00 0.00 H TER 15361 WAT 1420 ATOM 15361 O WAT 1421 128.251 71.419 92.548 1.00 0.00 O ATOM 15362 H1 WAT 1421 128.309 72.173 93.135 1.00 0.00 H ATOM 15363 H2 WAT 1421 127.374 71.067 92.698 1.00 0.00 H TER 15365 WAT 1421 ATOM 15365 O WAT 1422 56.070 80.572 128.959 1.00 0.00 O ATOM 15366 H1 WAT 1422 55.291 80.414 129.491 1.00 0.00 H ATOM 15367 H2 WAT 1422 55.870 80.167 128.115 1.00 0.00 H TER 15369 WAT 1422 ATOM 15369 O WAT 1423 44.709 69.831 90.430 1.00 0.00 O ATOM 15370 H1 WAT 1423 45.405 69.337 90.862 1.00 0.00 H ATOM 15371 H2 WAT 1423 44.428 69.268 89.708 1.00 0.00 H TER 15373 WAT 1423 ATOM 15373 O WAT 1424 34.134 72.615 62.586 1.00 0.00 O ATOM 15374 H1 WAT 1424 34.211 72.522 63.535 1.00 0.00 H ATOM 15375 H2 WAT 1424 33.285 72.225 62.375 1.00 0.00 H TER 15377 WAT 1424 ATOM 15377 O WAT 1425 52.206 88.602 119.219 1.00 0.00 O ATOM 15378 H1 WAT 1425 51.943 88.603 120.139 1.00 0.00 H ATOM 15379 H2 WAT 1425 52.692 87.785 119.109 1.00 0.00 H TER 15381 WAT 1425 ATOM 15381 O WAT 1426 108.265 20.616 92.156 1.00 0.00 O ATOM 15382 H1 WAT 1426 109.152 20.256 92.139 1.00 0.00 H ATOM 15383 H2 WAT 1426 107.722 19.899 92.483 1.00 0.00 H TER 15385 WAT 1426 ATOM 15385 O WAT 1427 40.748 35.102 71.939 1.00 0.00 O ATOM 15386 H1 WAT 1427 40.530 34.690 71.103 1.00 0.00 H ATOM 15387 H2 WAT 1427 40.280 35.936 71.924 1.00 0.00 H TER 15389 WAT 1427 ATOM 15389 O WAT 1428 100.119 140.145 120.166 1.00 0.00 O ATOM 15390 H1 WAT 1428 100.234 139.476 119.491 1.00 0.00 H ATOM 15391 H2 WAT 1428 99.647 140.852 119.726 1.00 0.00 H TER 15393 WAT 1428 ATOM 15393 O WAT 1429 107.768 144.097 150.225 1.00 0.00 O ATOM 15394 H1 WAT 1429 108.377 144.529 150.823 1.00 0.00 H ATOM 15395 H2 WAT 1429 107.034 144.706 150.149 1.00 0.00 H TER 15397 WAT 1429 ATOM 15397 O WAT 1430 46.558 99.499 78.291 1.00 0.00 O ATOM 15398 H1 WAT 1430 45.728 99.734 78.706 1.00 0.00 H ATOM 15399 H2 WAT 1430 46.995 100.338 78.141 1.00 0.00 H TER 15401 WAT 1430 ATOM 15401 O WAT 1431 86.340 5.935 66.345 1.00 0.00 O ATOM 15402 H1 WAT 1431 86.535 5.122 66.810 1.00 0.00 H ATOM 15403 H2 WAT 1431 86.471 5.720 65.421 1.00 0.00 H TER 15405 WAT 1431 ATOM 15405 O WAT 1432 46.624 3.331 133.226 1.00 0.00 O ATOM 15406 H1 WAT 1432 46.972 2.958 132.416 1.00 0.00 H ATOM 15407 H2 WAT 1432 47.371 3.775 133.626 1.00 0.00 H TER 15409 WAT 1432 ATOM 15409 O WAT 1433 86.501 138.443 143.430 1.00 0.00 O ATOM 15410 H1 WAT 1433 87.143 137.766 143.212 1.00 0.00 H ATOM 15411 H2 WAT 1433 86.832 138.834 144.239 1.00 0.00 H TER 15413 WAT 1433 ATOM 15413 O WAT 1434 11.640 26.401 58.185 1.00 0.00 O ATOM 15414 H1 WAT 1434 11.224 25.614 57.832 1.00 0.00 H ATOM 15415 H2 WAT 1434 12.563 26.311 57.948 1.00 0.00 H TER 15417 WAT 1434 ATOM 15417 O WAT 1435 3.103 75.511 62.427 1.00 0.00 O ATOM 15418 H1 WAT 1435 2.939 75.506 63.370 1.00 0.00 H ATOM 15419 H2 WAT 1435 3.098 74.587 62.178 1.00 0.00 H TER 15421 WAT 1435 ATOM 15421 O WAT 1436 0.807 136.575 129.341 1.00 0.00 O ATOM 15422 H1 WAT 1436 0.466 135.946 129.977 1.00 0.00 H ATOM 15423 H2 WAT 1436 0.845 137.403 129.820 1.00 0.00 H TER 15425 WAT 1436 ATOM 15425 O WAT 1437 86.716 98.639 60.332 1.00 0.00 O ATOM 15426 H1 WAT 1437 85.818 98.568 60.008 1.00 0.00 H ATOM 15427 H2 WAT 1437 86.743 99.485 60.779 1.00 0.00 H TER 15429 WAT 1437 ATOM 15429 O WAT 1438 87.081 29.849 11.022 1.00 0.00 O ATOM 15430 H1 WAT 1438 86.475 29.286 11.504 1.00 0.00 H ATOM 15431 H2 WAT 1438 87.193 30.616 11.583 1.00 0.00 H TER 15433 WAT 1438 ATOM 15433 O WAT 1439 129.186 91.226 85.799 1.00 0.00 O ATOM 15434 H1 WAT 1439 129.978 90.689 85.828 1.00 0.00 H ATOM 15435 H2 WAT 1439 129.351 91.859 85.100 1.00 0.00 H TER 15437 WAT 1439 ATOM 15437 O WAT 1440 62.928 132.477 138.939 1.00 0.00 O ATOM 15438 H1 WAT 1440 63.155 132.917 139.758 1.00 0.00 H ATOM 15439 H2 WAT 1440 62.552 133.166 138.392 1.00 0.00 H TER 15441 WAT 1440 ATOM 15441 O WAT 1441 102.639 68.111 65.866 1.00 0.00 O ATOM 15442 H1 WAT 1441 102.755 67.769 64.979 1.00 0.00 H ATOM 15443 H2 WAT 1441 103.518 68.374 66.138 1.00 0.00 H TER 15445 WAT 1441 ATOM 15445 O WAT 1442 138.361 108.583 67.818 1.00 0.00 O ATOM 15446 H1 WAT 1442 138.914 109.203 68.293 1.00 0.00 H ATOM 15447 H2 WAT 1442 138.474 107.755 68.284 1.00 0.00 H TER 15449 WAT 1442 ATOM 15449 O WAT 1443 135.535 55.179 86.712 1.00 0.00 O ATOM 15450 H1 WAT 1443 135.229 54.587 87.399 1.00 0.00 H ATOM 15451 H2 WAT 1443 135.472 56.051 87.103 1.00 0.00 H TER 15453 WAT 1443 ATOM 15453 O WAT 1444 130.497 10.164 135.635 1.00 0.00 O ATOM 15454 H1 WAT 1444 130.337 9.238 135.450 1.00 0.00 H ATOM 15455 H2 WAT 1444 131.436 10.213 135.813 1.00 0.00 H TER 15457 WAT 1444 ATOM 15457 O WAT 1445 57.368 12.974 49.460 1.00 0.00 O ATOM 15458 H1 WAT 1445 58.222 13.278 49.152 1.00 0.00 H ATOM 15459 H2 WAT 1445 57.433 13.006 50.414 1.00 0.00 H TER 15461 WAT 1445 ATOM 15461 O WAT 1446 136.232 49.809 117.622 1.00 0.00 O ATOM 15462 H1 WAT 1446 136.401 48.892 117.838 1.00 0.00 H ATOM 15463 H2 WAT 1446 136.409 49.871 116.684 1.00 0.00 H TER 15465 WAT 1446 ATOM 15465 O WAT 1447 10.239 116.986 16.954 1.00 0.00 O ATOM 15466 H1 WAT 1447 9.454 116.507 17.218 1.00 0.00 H ATOM 15467 H2 WAT 1447 10.386 116.723 16.046 1.00 0.00 H TER 15469 WAT 1447 ATOM 15469 O WAT 1448 35.423 116.823 137.108 1.00 0.00 O ATOM 15470 H1 WAT 1448 35.073 116.393 136.328 1.00 0.00 H ATOM 15471 H2 WAT 1448 35.408 116.145 137.783 1.00 0.00 H TER 15473 WAT 1448 ATOM 15473 O WAT 1449 92.811 127.819 150.401 1.00 0.00 O ATOM 15474 H1 WAT 1449 92.649 128.194 149.535 1.00 0.00 H ATOM 15475 H2 WAT 1449 92.120 127.166 150.512 1.00 0.00 H TER 15477 WAT 1449 ATOM 15477 O WAT 1450 90.040 108.590 0.083 1.00 0.00 O ATOM 15478 H1 WAT 1450 90.981 108.528 -0.082 1.00 0.00 H ATOM 15479 H2 WAT 1450 89.951 109.325 0.690 1.00 0.00 H TER 15481 WAT 1450 ATOM 15481 O WAT 1451 137.327 14.824 64.523 1.00 0.00 O ATOM 15482 H1 WAT 1451 137.655 14.205 63.871 1.00 0.00 H ATOM 15483 H2 WAT 1451 136.379 14.696 64.520 1.00 0.00 H TER 15485 WAT 1451 ATOM 15485 O WAT 1452 144.865 46.019 114.630 1.00 0.00 O ATOM 15486 H1 WAT 1452 145.025 45.755 113.724 1.00 0.00 H ATOM 15487 H2 WAT 1452 145.301 45.349 115.156 1.00 0.00 H TER 15489 WAT 1452 ATOM 15489 O WAT 1453 0.974 4.835 96.677 1.00 0.00 O ATOM 15490 H1 WAT 1453 1.513 4.150 97.072 1.00 0.00 H ATOM 15491 H2 WAT 1453 0.683 4.461 95.845 1.00 0.00 H TER 15493 WAT 1453 ATOM 15493 O WAT 1454 46.402 36.524 143.821 1.00 0.00 O ATOM 15494 H1 WAT 1454 45.879 35.784 143.511 1.00 0.00 H ATOM 15495 H2 WAT 1454 45.951 37.296 143.480 1.00 0.00 H TER 15497 WAT 1454 ATOM 15497 O WAT 1455 141.113 140.228 71.832 1.00 0.00 O ATOM 15498 H1 WAT 1455 140.373 139.961 71.286 1.00 0.00 H ATOM 15499 H2 WAT 1455 141.749 140.589 71.215 1.00 0.00 H TER 15501 WAT 1455 ATOM 15501 O WAT 1456 54.342 44.167 64.052 1.00 0.00 O ATOM 15502 H1 WAT 1456 53.885 43.838 64.826 1.00 0.00 H ATOM 15503 H2 WAT 1456 53.788 44.877 63.729 1.00 0.00 H TER 15505 WAT 1456 ATOM 15505 O WAT 1457 30.941 26.235 147.986 1.00 0.00 O ATOM 15506 H1 WAT 1457 31.624 25.653 148.320 1.00 0.00 H ATOM 15507 H2 WAT 1457 30.802 26.869 148.689 1.00 0.00 H TER 15509 WAT 1457 ATOM 15509 O WAT 1458 6.558 141.327 55.623 1.00 0.00 O ATOM 15510 H1 WAT 1458 6.572 140.609 56.255 1.00 0.00 H ATOM 15511 H2 WAT 1458 7.069 141.003 54.881 1.00 0.00 H TER 15513 WAT 1458 ATOM 15513 O WAT 1459 78.602 43.666 91.973 1.00 0.00 O ATOM 15514 H1 WAT 1459 78.470 44.526 91.575 1.00 0.00 H ATOM 15515 H2 WAT 1459 77.970 43.633 92.690 1.00 0.00 H TER 15517 WAT 1459 ATOM 15517 O WAT 1460 32.711 90.931 83.564 1.00 0.00 O ATOM 15518 H1 WAT 1460 33.474 90.863 82.989 1.00 0.00 H ATOM 15519 H2 WAT 1460 33.068 90.841 84.447 1.00 0.00 H TER 15521 WAT 1460 ATOM 15521 O WAT 1461 115.409 122.286 125.111 1.00 0.00 O ATOM 15522 H1 WAT 1461 115.647 122.929 125.779 1.00 0.00 H ATOM 15523 H2 WAT 1461 114.639 121.843 125.468 1.00 0.00 H TER 15525 WAT 1461 ATOM 15525 O WAT 1462 131.544 136.452 1.841 1.00 0.00 O ATOM 15526 H1 WAT 1462 131.148 135.983 2.575 1.00 0.00 H ATOM 15527 H2 WAT 1462 130.800 136.784 1.339 1.00 0.00 H TER 15529 WAT 1462 ATOM 15529 O WAT 1463 79.700 116.191 113.861 1.00 0.00 O ATOM 15530 H1 WAT 1463 80.279 116.530 113.179 1.00 0.00 H ATOM 15531 H2 WAT 1463 79.410 116.970 114.337 1.00 0.00 H TER 15533 WAT 1463 ATOM 15533 O WAT 1464 35.903 144.301 66.742 1.00 0.00 O ATOM 15534 H1 WAT 1464 35.831 145.255 66.716 1.00 0.00 H ATOM 15535 H2 WAT 1464 36.116 144.103 67.654 1.00 0.00 H TER 15537 WAT 1464 ATOM 15537 O WAT 1465 64.159 11.255 56.450 1.00 0.00 O ATOM 15538 H1 WAT 1465 63.513 10.655 56.823 1.00 0.00 H ATOM 15539 H2 WAT 1465 63.759 11.564 55.638 1.00 0.00 H TER 15541 WAT 1465 ATOM 15541 O WAT 1466 112.252 85.622 74.594 1.00 0.00 O ATOM 15542 H1 WAT 1466 112.552 86.420 75.029 1.00 0.00 H ATOM 15543 H2 WAT 1466 111.326 85.557 74.824 1.00 0.00 H TER 15545 WAT 1466 ATOM 15545 O WAT 1467 58.765 117.354 144.458 1.00 0.00 O ATOM 15546 H1 WAT 1467 58.410 117.299 145.345 1.00 0.00 H ATOM 15547 H2 WAT 1467 59.690 117.128 144.556 1.00 0.00 H TER 15549 WAT 1467 ATOM 15549 O WAT 1468 57.171 56.568 18.566 1.00 0.00 O ATOM 15550 H1 WAT 1468 56.888 55.905 17.937 1.00 0.00 H ATOM 15551 H2 WAT 1468 58.102 56.694 18.381 1.00 0.00 H TER 15553 WAT 1468 ATOM 15553 O WAT 1469 47.467 32.382 13.594 1.00 0.00 O ATOM 15554 H1 WAT 1469 47.080 32.194 14.449 1.00 0.00 H ATOM 15555 H2 WAT 1469 46.856 32.994 13.184 1.00 0.00 H TER 15557 WAT 1469 ATOM 15557 O WAT 1470 47.748 4.033 81.102 1.00 0.00 O ATOM 15558 H1 WAT 1470 48.452 3.622 81.603 1.00 0.00 H ATOM 15559 H2 WAT 1470 47.617 3.452 80.353 1.00 0.00 H TER 15561 WAT 1470 ATOM 15561 O WAT 1471 144.602 106.067 23.880 1.00 0.00 O ATOM 15562 H1 WAT 1471 143.822 105.517 23.954 1.00 0.00 H ATOM 15563 H2 WAT 1471 144.290 106.951 24.074 1.00 0.00 H TER 15565 WAT 1471 ATOM 15565 O WAT 1472 45.441 56.487 108.466 1.00 0.00 O ATOM 15566 H1 WAT 1472 44.771 56.032 107.957 1.00 0.00 H ATOM 15567 H2 WAT 1472 46.268 56.238 108.053 1.00 0.00 H TER 15569 WAT 1472 ATOM 15569 O WAT 1473 1.679 76.279 60.273 1.00 0.00 O ATOM 15570 H1 WAT 1473 2.395 76.140 59.653 1.00 0.00 H ATOM 15571 H2 WAT 1473 2.081 76.164 61.133 1.00 0.00 H TER 15573 WAT 1473 ATOM 15573 O WAT 1474 43.009 88.726 104.214 1.00 0.00 O ATOM 15574 H1 WAT 1474 42.299 88.496 104.815 1.00 0.00 H ATOM 15575 H2 WAT 1474 43.107 87.956 103.654 1.00 0.00 H TER 15577 WAT 1474 ATOM 15577 O WAT 1475 73.963 118.153 122.717 1.00 0.00 O ATOM 15578 H1 WAT 1475 74.910 118.087 122.597 1.00 0.00 H ATOM 15579 H2 WAT 1475 73.682 117.258 122.906 1.00 0.00 H TER 15581 WAT 1475 ATOM 15581 O WAT 1476 93.764 44.900 1.912 1.00 0.00 O ATOM 15582 H1 WAT 1476 93.820 45.829 2.133 1.00 0.00 H ATOM 15583 H2 WAT 1476 94.250 44.459 2.609 1.00 0.00 H TER 15585 WAT 1476 ATOM 15585 O WAT 1477 32.763 110.357 116.331 1.00 0.00 O ATOM 15586 H1 WAT 1477 32.745 109.426 116.551 1.00 0.00 H ATOM 15587 H2 WAT 1477 32.145 110.444 115.605 1.00 0.00 H TER 15589 WAT 1477 ATOM 15589 O WAT 1478 21.189 79.940 96.386 1.00 0.00 O ATOM 15590 H1 WAT 1478 22.129 79.899 96.560 1.00 0.00 H ATOM 15591 H2 WAT 1478 21.017 80.865 96.213 1.00 0.00 H TER 15593 WAT 1478 ATOM 15593 O WAT 1479 87.131 127.703 125.290 1.00 0.00 O ATOM 15594 H1 WAT 1479 88.017 127.513 125.597 1.00 0.00 H ATOM 15595 H2 WAT 1479 86.966 128.602 125.573 1.00 0.00 H TER 15597 WAT 1479 ATOM 15597 O WAT 1480 66.944 17.097 0.269 1.00 0.00 O ATOM 15598 H1 WAT 1480 66.419 17.572 0.913 1.00 0.00 H ATOM 15599 H2 WAT 1480 67.286 16.343 0.750 1.00 0.00 H TER 15601 WAT 1480 ATOM 15601 O WAT 1481 38.704 80.426 141.600 1.00 0.00 O ATOM 15602 H1 WAT 1481 39.152 80.242 142.426 1.00 0.00 H ATOM 15603 H2 WAT 1481 39.372 80.839 141.052 1.00 0.00 H TER 15605 WAT 1481 ATOM 15605 O WAT 1482 137.273 79.166 123.647 1.00 0.00 O ATOM 15606 H1 WAT 1482 137.780 79.502 122.908 1.00 0.00 H ATOM 15607 H2 WAT 1482 136.893 79.946 124.051 1.00 0.00 H TER 15609 WAT 1482 ATOM 15609 O WAT 1483 5.355 143.693 145.855 1.00 0.00 O ATOM 15610 H1 WAT 1483 5.754 142.893 146.197 1.00 0.00 H ATOM 15611 H2 WAT 1483 4.464 143.684 146.205 1.00 0.00 H TER 15613 WAT 1483 ATOM 15613 O WAT 1484 101.691 109.458 9.723 1.00 0.00 O ATOM 15614 H1 WAT 1484 102.418 109.120 9.199 1.00 0.00 H ATOM 15615 H2 WAT 1484 100.909 109.231 9.221 1.00 0.00 H TER 15617 WAT 1484 ATOM 15617 O WAT 1485 69.731 136.496 11.721 1.00 0.00 O ATOM 15618 H1 WAT 1485 69.556 136.580 12.658 1.00 0.00 H ATOM 15619 H2 WAT 1485 69.388 137.305 11.340 1.00 0.00 H TER 15621 WAT 1485 ATOM 15621 O WAT 1486 13.665 62.610 5.769 1.00 0.00 O ATOM 15622 H1 WAT 1486 13.051 62.355 5.081 1.00 0.00 H ATOM 15623 H2 WAT 1486 13.724 63.562 5.697 1.00 0.00 H TER 15625 WAT 1486 ATOM 15625 O WAT 1487 129.791 140.607 154.316 1.00 0.00 O ATOM 15626 H1 WAT 1487 129.416 141.267 154.899 1.00 0.00 H ATOM 15627 H2 WAT 1487 129.259 139.825 154.465 1.00 0.00 H TER 15629 WAT 1487 ATOM 15629 O WAT 1488 21.471 13.572 108.471 1.00 0.00 O ATOM 15630 H1 WAT 1488 20.776 13.011 108.128 1.00 0.00 H ATOM 15631 H2 WAT 1488 21.229 13.720 109.386 1.00 0.00 H TER 15633 WAT 1488 ATOM 15633 O WAT 1489 12.062 120.287 88.594 1.00 0.00 O ATOM 15634 H1 WAT 1489 12.864 119.781 88.469 1.00 0.00 H ATOM 15635 H2 WAT 1489 12.366 121.177 88.772 1.00 0.00 H TER 15637 WAT 1489 ATOM 15637 O WAT 1490 3.600 131.696 150.893 1.00 0.00 O ATOM 15638 H1 WAT 1490 3.130 132.096 151.624 1.00 0.00 H ATOM 15639 H2 WAT 1490 3.119 130.888 150.712 1.00 0.00 H TER 15641 WAT 1490 ATOM 15641 O WAT 1491 36.098 61.351 122.592 1.00 0.00 O ATOM 15642 H1 WAT 1491 35.397 60.727 122.780 1.00 0.00 H ATOM 15643 H2 WAT 1491 36.900 60.890 122.837 1.00 0.00 H TER 15645 WAT 1491 ATOM 15645 O WAT 1492 58.948 97.219 106.612 1.00 0.00 O ATOM 15646 H1 WAT 1492 59.230 96.764 105.819 1.00 0.00 H ATOM 15647 H2 WAT 1492 58.606 98.056 106.299 1.00 0.00 H TER 15649 WAT 1492 ATOM 15649 O WAT 1493 64.860 139.357 84.814 1.00 0.00 O ATOM 15650 H1 WAT 1493 64.445 139.418 85.674 1.00 0.00 H ATOM 15651 H2 WAT 1493 64.973 140.266 84.537 1.00 0.00 H TER 15653 WAT 1493 ATOM 15653 O WAT 1494 18.251 48.569 77.018 1.00 0.00 O ATOM 15654 H1 WAT 1494 19.186 48.426 77.159 1.00 0.00 H ATOM 15655 H2 WAT 1494 17.845 48.348 77.856 1.00 0.00 H TER 15657 WAT 1494 ATOM 15657 O WAT 1495 116.189 102.534 140.016 1.00 0.00 O ATOM 15658 H1 WAT 1495 115.652 103.020 139.390 1.00 0.00 H ATOM 15659 H2 WAT 1495 116.737 103.201 140.430 1.00 0.00 H TER 15661 WAT 1495 ATOM 15661 O WAT 1496 106.586 142.848 90.258 1.00 0.00 O ATOM 15662 H1 WAT 1496 106.001 142.363 90.840 1.00 0.00 H ATOM 15663 H2 WAT 1496 107.150 143.348 90.848 1.00 0.00 H TER 15665 WAT 1496 ATOM 15665 O WAT 1497 55.392 129.031 121.571 1.00 0.00 O ATOM 15666 H1 WAT 1497 55.862 128.736 122.350 1.00 0.00 H ATOM 15667 H2 WAT 1497 56.063 129.080 120.890 1.00 0.00 H TER 15669 WAT 1497 ATOM 15669 O WAT 1498 139.473 106.614 100.929 1.00 0.00 O ATOM 15670 H1 WAT 1498 140.319 107.051 101.028 1.00 0.00 H ATOM 15671 H2 WAT 1498 139.047 106.724 101.779 1.00 0.00 H TER 15673 WAT 1498 ATOM 15673 O WAT 1499 57.568 140.904 52.461 1.00 0.00 O ATOM 15674 H1 WAT 1499 57.020 141.688 52.491 1.00 0.00 H ATOM 15675 H2 WAT 1499 58.178 141.009 53.192 1.00 0.00 H TER 15677 WAT 1499 ATOM 15677 O WAT 1500 45.430 83.214 68.833 1.00 0.00 O ATOM 15678 H1 WAT 1500 45.788 83.836 69.466 1.00 0.00 H ATOM 15679 H2 WAT 1500 46.105 82.541 68.750 1.00 0.00 H TER 15681 WAT 1500 ATOM 15681 O WAT 1501 118.765 61.604 26.714 1.00 0.00 O ATOM 15682 H1 WAT 1501 117.879 61.818 26.423 1.00 0.00 H ATOM 15683 H2 WAT 1501 118.793 60.648 26.716 1.00 0.00 H TER 15685 WAT 1501 ATOM 15685 O WAT 1502 112.285 51.589 142.240 1.00 0.00 O ATOM 15686 H1 WAT 1502 111.589 51.653 141.586 1.00 0.00 H ATOM 15687 H2 WAT 1502 112.701 50.745 142.065 1.00 0.00 H TER 15689 WAT 1502 ATOM 15689 O WAT 1503 142.265 92.099 156.208 1.00 0.00 O ATOM 15690 H1 WAT 1503 141.779 91.956 157.021 1.00 0.00 H ATOM 15691 H2 WAT 1503 141.606 92.404 155.585 1.00 0.00 H TER 15693 WAT 1503 ATOM 15693 O WAT 1504 82.231 107.550 10.779 1.00 0.00 O ATOM 15694 H1 WAT 1504 82.587 108.323 10.341 1.00 0.00 H ATOM 15695 H2 WAT 1504 81.344 107.806 11.033 1.00 0.00 H TER 15697 WAT 1504 ATOM 15697 O WAT 1505 79.214 143.632 150.092 1.00 0.00 O ATOM 15698 H1 WAT 1505 78.971 142.985 149.429 1.00 0.00 H ATOM 15699 H2 WAT 1505 80.034 143.302 150.459 1.00 0.00 H TER 15701 WAT 1505 ATOM 15701 O WAT 1506 10.599 69.177 70.815 1.00 0.00 O ATOM 15702 H1 WAT 1506 10.963 68.304 70.666 1.00 0.00 H ATOM 15703 H2 WAT 1506 11.228 69.771 70.405 1.00 0.00 H TER 15705 WAT 1506 ATOM 15705 O WAT 1507 7.342 9.078 73.774 1.00 0.00 O ATOM 15706 H1 WAT 1507 8.050 9.108 74.418 1.00 0.00 H ATOM 15707 H2 WAT 1507 7.302 8.160 73.504 1.00 0.00 H TER 15709 WAT 1507 ATOM 15709 O WAT 1508 118.969 141.196 9.163 1.00 0.00 O ATOM 15710 H1 WAT 1508 119.376 140.864 9.963 1.00 0.00 H ATOM 15711 H2 WAT 1508 118.593 140.421 8.746 1.00 0.00 H TER 15713 WAT 1508 ATOM 15713 O WAT 1509 55.071 33.911 141.766 1.00 0.00 O ATOM 15714 H1 WAT 1509 55.676 33.283 142.160 1.00 0.00 H ATOM 15715 H2 WAT 1509 55.125 34.683 142.330 1.00 0.00 H TER 15717 WAT 1509 ATOM 15717 O WAT 1510 73.595 73.343 113.058 1.00 0.00 O ATOM 15718 H1 WAT 1510 73.771 74.042 113.687 1.00 0.00 H ATOM 15719 H2 WAT 1510 73.232 72.632 113.585 1.00 0.00 H TER 15721 WAT 1510 ATOM 15721 O WAT 1511 106.413 39.786 140.528 1.00 0.00 O ATOM 15722 H1 WAT 1511 106.322 40.736 140.606 1.00 0.00 H ATOM 15723 H2 WAT 1511 105.866 39.554 139.777 1.00 0.00 H TER 15725 WAT 1511 ATOM 15725 O WAT 1512 133.601 117.631 67.188 1.00 0.00 O ATOM 15726 H1 WAT 1512 134.489 117.752 66.851 1.00 0.00 H ATOM 15727 H2 WAT 1512 133.441 116.690 67.112 1.00 0.00 H TER 15729 WAT 1512 ATOM 15729 O WAT 1513 109.743 58.889 134.531 1.00 0.00 O ATOM 15730 H1 WAT 1513 109.333 58.419 135.258 1.00 0.00 H ATOM 15731 H2 WAT 1513 109.452 58.421 133.749 1.00 0.00 H TER 15733 WAT 1513 ATOM 15733 O WAT 1514 126.664 116.651 137.747 1.00 0.00 O ATOM 15734 H1 WAT 1514 126.327 116.457 138.622 1.00 0.00 H ATOM 15735 H2 WAT 1514 127.166 117.459 137.857 1.00 0.00 H TER 15737 WAT 1514 ATOM 15737 O WAT 1515 127.612 74.221 101.199 1.00 0.00 O ATOM 15738 H1 WAT 1515 127.364 74.746 101.960 1.00 0.00 H ATOM 15739 H2 WAT 1515 126.886 74.332 100.585 1.00 0.00 H TER 15741 WAT 1515 ATOM 15741 O WAT 1516 138.702 12.287 99.619 1.00 0.00 O ATOM 15742 H1 WAT 1516 139.347 12.920 99.303 1.00 0.00 H ATOM 15743 H2 WAT 1516 137.856 12.702 99.449 1.00 0.00 H TER 15745 WAT 1516 ATOM 15745 O WAT 1517 99.757 19.960 150.354 1.00 0.00 O ATOM 15746 H1 WAT 1517 99.964 19.413 149.596 1.00 0.00 H ATOM 15747 H2 WAT 1517 99.261 20.694 149.992 1.00 0.00 H TER 15749 WAT 1517 ATOM 15749 O WAT 1518 36.037 69.377 121.529 1.00 0.00 O ATOM 15750 H1 WAT 1518 36.258 70.305 121.451 1.00 0.00 H ATOM 15751 H2 WAT 1518 35.791 69.266 122.447 1.00 0.00 H TER 15753 WAT 1518 ATOM 15753 O WAT 1519 103.563 130.501 107.982 1.00 0.00 O ATOM 15754 H1 WAT 1519 104.416 130.628 108.397 1.00 0.00 H ATOM 15755 H2 WAT 1519 103.653 130.906 107.120 1.00 0.00 H TER 15757 WAT 1519 ATOM 15757 O WAT 1520 34.580 104.572 125.965 1.00 0.00 O ATOM 15758 H1 WAT 1520 33.658 104.428 126.180 1.00 0.00 H ATOM 15759 H2 WAT 1520 34.717 104.082 125.154 1.00 0.00 H TER 15761 WAT 1520 ATOM 15761 O WAT 1521 139.015 122.073 75.506 1.00 0.00 O ATOM 15762 H1 WAT 1521 139.317 121.611 74.724 1.00 0.00 H ATOM 15763 H2 WAT 1521 138.070 122.157 75.385 1.00 0.00 H TER 15765 WAT 1521 ATOM 15765 O WAT 1522 29.247 59.592 148.065 1.00 0.00 O ATOM 15766 H1 WAT 1522 29.783 59.371 147.304 1.00 0.00 H ATOM 15767 H2 WAT 1522 29.736 59.247 148.811 1.00 0.00 H TER 15769 WAT 1522 ATOM 15769 O WAT 1523 83.451 61.632 154.579 1.00 0.00 O ATOM 15770 H1 WAT 1523 84.030 60.998 155.002 1.00 0.00 H ATOM 15771 H2 WAT 1523 82.971 61.121 153.929 1.00 0.00 H TER 15773 WAT 1523 ATOM 15773 O WAT 1524 68.792 3.085 63.181 1.00 0.00 O ATOM 15774 H1 WAT 1524 69.676 3.017 62.823 1.00 0.00 H ATOM 15775 H2 WAT 1524 68.858 2.700 64.055 1.00 0.00 H TER 15777 WAT 1524 ATOM 15777 O WAT 1525 47.310 43.547 147.447 1.00 0.00 O ATOM 15778 H1 WAT 1525 46.676 44.256 147.556 1.00 0.00 H ATOM 15779 H2 WAT 1525 47.492 43.249 148.338 1.00 0.00 H TER 15781 WAT 1525 ATOM 15781 O WAT 1526 95.290 137.548 155.099 1.00 0.00 O ATOM 15782 H1 WAT 1526 94.607 137.359 155.742 1.00 0.00 H ATOM 15783 H2 WAT 1526 95.606 138.421 155.334 1.00 0.00 H TER 15785 WAT 1526 ATOM 15785 O WAT 1527 131.554 119.613 120.169 1.00 0.00 O ATOM 15786 H1 WAT 1527 132.022 120.392 120.468 1.00 0.00 H ATOM 15787 H2 WAT 1527 131.738 119.569 119.231 1.00 0.00 H TER 15789 WAT 1527 ATOM 15789 O WAT 1528 111.777 40.204 72.578 1.00 0.00 O ATOM 15790 H1 WAT 1528 112.425 39.750 73.117 1.00 0.00 H ATOM 15791 H2 WAT 1528 111.979 41.132 72.693 1.00 0.00 H TER 15793 WAT 1528 ATOM 15793 O WAT 1529 59.567 134.562 141.338 1.00 0.00 O ATOM 15794 H1 WAT 1529 59.477 133.729 140.875 1.00 0.00 H ATOM 15795 H2 WAT 1529 58.712 134.702 141.747 1.00 0.00 H TER 15797 WAT 1529 ATOM 15797 O WAT 1530 80.652 9.091 149.846 1.00 0.00 O ATOM 15798 H1 WAT 1530 81.316 9.777 149.911 1.00 0.00 H ATOM 15799 H2 WAT 1530 80.716 8.616 150.675 1.00 0.00 H TER 15801 WAT 1530 ATOM 15801 O WAT 1531 95.723 12.694 96.888 1.00 0.00 O ATOM 15802 H1 WAT 1531 95.496 11.995 97.502 1.00 0.00 H ATOM 15803 H2 WAT 1531 96.342 12.288 96.281 1.00 0.00 H TER 15805 WAT 1531 ATOM 15805 O WAT 1532 88.314 97.077 77.178 1.00 0.00 O ATOM 15806 H1 WAT 1532 89.198 96.867 77.480 1.00 0.00 H ATOM 15807 H2 WAT 1532 87.737 96.601 77.776 1.00 0.00 H TER 15809 WAT 1532 ATOM 15809 O WAT 1533 31.924 90.527 9.313 1.00 0.00 O ATOM 15810 H1 WAT 1533 31.117 90.025 9.420 1.00 0.00 H ATOM 15811 H2 WAT 1533 32.516 90.173 9.977 1.00 0.00 H TER 15813 WAT 1533 ATOM 15813 O WAT 1534 111.235 56.923 10.069 1.00 0.00 O ATOM 15814 H1 WAT 1534 111.015 56.937 9.137 1.00 0.00 H ATOM 15815 H2 WAT 1534 110.412 57.127 10.512 1.00 0.00 H TER 15817 WAT 1534 ATOM 15817 O WAT 1535 72.465 110.964 73.531 1.00 0.00 O ATOM 15818 H1 WAT 1535 72.779 111.833 73.278 1.00 0.00 H ATOM 15819 H2 WAT 1535 73.039 110.357 73.065 1.00 0.00 H TER 15821 WAT 1535 ATOM 15821 O WAT 1536 15.108 95.888 19.722 1.00 0.00 O ATOM 15822 H1 WAT 1536 14.322 95.716 20.242 1.00 0.00 H ATOM 15823 H2 WAT 1536 15.280 95.063 19.269 1.00 0.00 H TER 15825 WAT 1536 ATOM 15825 O WAT 1537 97.278 124.987 73.870 1.00 0.00 O ATOM 15826 H1 WAT 1537 97.820 124.199 73.861 1.00 0.00 H ATOM 15827 H2 WAT 1537 96.408 124.682 73.612 1.00 0.00 H TER 15829 WAT 1537 ATOM 15829 O WAT 1538 -0.001 29.094 140.034 1.00 0.00 O ATOM 15830 H1 WAT 1538 0.888 29.409 140.198 1.00 0.00 H ATOM 15831 H2 WAT 1538 -0.484 29.317 140.829 1.00 0.00 H TER 15833 WAT 1538 ATOM 15833 O WAT 1539 129.477 48.130 148.834 1.00 0.00 O ATOM 15834 H1 WAT 1539 128.721 48.085 149.419 1.00 0.00 H ATOM 15835 H2 WAT 1539 129.116 47.960 147.964 1.00 0.00 H TER 15837 WAT 1539 ATOM 15837 O WAT 1540 31.890 108.216 108.424 1.00 0.00 O ATOM 15838 H1 WAT 1540 31.778 109.140 108.199 1.00 0.00 H ATOM 15839 H2 WAT 1540 31.315 108.082 109.178 1.00 0.00 H TER 15841 WAT 1540 ATOM 15841 O WAT 1541 34.529 62.103 83.252 1.00 0.00 O ATOM 15842 H1 WAT 1541 35.399 61.711 83.325 1.00 0.00 H ATOM 15843 H2 WAT 1541 34.631 62.982 83.617 1.00 0.00 H TER 15845 WAT 1541 ATOM 15845 O WAT 1542 72.018 25.833 101.777 1.00 0.00 O ATOM 15846 H1 WAT 1542 72.353 25.256 102.464 1.00 0.00 H ATOM 15847 H2 WAT 1542 72.429 26.680 101.955 1.00 0.00 H TER 15849 WAT 1542 ATOM 15849 O WAT 1543 7.138 101.644 136.204 1.00 0.00 O ATOM 15850 H1 WAT 1543 7.083 100.689 136.189 1.00 0.00 H ATOM 15851 H2 WAT 1543 6.575 101.928 135.484 1.00 0.00 H TER 15853 WAT 1543 ATOM 15853 O WAT 1544 0.776 46.241 66.452 1.00 0.00 O ATOM 15854 H1 WAT 1544 0.124 46.573 65.835 1.00 0.00 H ATOM 15855 H2 WAT 1544 0.633 45.295 66.466 1.00 0.00 H TER 15857 WAT 1544 ATOM 15857 O WAT 1545 61.803 63.147 67.026 1.00 0.00 O ATOM 15858 H1 WAT 1545 62.386 62.405 67.187 1.00 0.00 H ATOM 15859 H2 WAT 1545 61.410 63.332 67.879 1.00 0.00 H TER 15861 WAT 1545 ATOM 15861 O WAT 1546 103.549 135.332 12.033 1.00 0.00 O ATOM 15862 H1 WAT 1546 103.326 134.685 11.363 1.00 0.00 H ATOM 15863 H2 WAT 1546 103.969 134.824 12.727 1.00 0.00 H TER 15865 WAT 1546 ATOM 15865 O WAT 1547 91.641 99.892 149.988 1.00 0.00 O ATOM 15866 H1 WAT 1547 91.997 99.856 149.101 1.00 0.00 H ATOM 15867 H2 WAT 1547 91.841 99.034 150.362 1.00 0.00 H TER 15869 WAT 1547 ATOM 15869 O WAT 1548 114.220 47.193 97.994 1.00 0.00 O ATOM 15870 H1 WAT 1548 115.019 47.533 97.589 1.00 0.00 H ATOM 15871 H2 WAT 1548 114.531 46.651 98.719 1.00 0.00 H TER 15873 WAT 1548 ATOM 15873 O WAT 1549 46.321 88.425 114.768 1.00 0.00 O ATOM 15874 H1 WAT 1549 45.842 89.225 114.549 1.00 0.00 H ATOM 15875 H2 WAT 1549 45.797 88.014 115.456 1.00 0.00 H TER 15877 WAT 1549 ATOM 15877 O WAT 1550 45.887 100.486 118.332 1.00 0.00 O ATOM 15878 H1 WAT 1550 45.962 100.801 117.431 1.00 0.00 H ATOM 15879 H2 WAT 1550 45.434 99.646 118.255 1.00 0.00 H TER 15881 WAT 1550 ATOM 15881 O WAT 1551 2.870 103.319 11.874 1.00 0.00 O ATOM 15882 H1 WAT 1551 2.481 103.131 12.728 1.00 0.00 H ATOM 15883 H2 WAT 1551 3.163 102.467 11.552 1.00 0.00 H TER 15885 WAT 1551 ATOM 15885 O WAT 1552 99.096 34.549 60.120 1.00 0.00 O ATOM 15886 H1 WAT 1552 98.678 34.500 59.260 1.00 0.00 H ATOM 15887 H2 WAT 1552 99.717 33.821 60.126 1.00 0.00 H TER 15889 WAT 1552 ATOM 15889 O WAT 1553 29.688 111.920 90.951 1.00 0.00 O ATOM 15890 H1 WAT 1553 29.557 112.504 90.204 1.00 0.00 H ATOM 15891 H2 WAT 1553 28.803 111.723 91.259 1.00 0.00 H TER 15893 WAT 1553 ATOM 15893 O WAT 1554 40.114 17.238 119.906 1.00 0.00 O ATOM 15894 H1 WAT 1554 39.704 16.396 119.712 1.00 0.00 H ATOM 15895 H2 WAT 1554 39.785 17.472 120.774 1.00 0.00 H TER 15897 WAT 1554 ATOM 15897 O WAT 1555 108.635 110.358 110.225 1.00 0.00 O ATOM 15898 H1 WAT 1555 108.227 109.636 110.702 1.00 0.00 H ATOM 15899 H2 WAT 1555 108.628 111.089 110.843 1.00 0.00 H TER 15901 WAT 1555 ATOM 15901 O WAT 1556 44.059 89.828 90.751 1.00 0.00 O ATOM 15902 H1 WAT 1556 43.904 89.295 91.531 1.00 0.00 H ATOM 15903 H2 WAT 1556 43.611 89.359 90.047 1.00 0.00 H TER 15905 WAT 1556 ATOM 15905 O WAT 1557 76.427 73.544 115.598 1.00 0.00 O ATOM 15906 H1 WAT 1557 77.124 73.719 114.967 1.00 0.00 H ATOM 15907 H2 WAT 1557 75.761 74.204 115.409 1.00 0.00 H TER 15909 WAT 1557 ATOM 15909 O WAT 1558 139.979 108.182 13.465 1.00 0.00 O ATOM 15910 H1 WAT 1558 139.642 108.971 13.040 1.00 0.00 H ATOM 15911 H2 WAT 1558 140.883 108.398 13.690 1.00 0.00 H TER 15913 WAT 1558 ATOM 15913 O WAT 1559 73.857 104.993 70.138 1.00 0.00 O ATOM 15914 H1 WAT 1559 74.102 105.097 69.219 1.00 0.00 H ATOM 15915 H2 WAT 1559 74.336 104.216 70.427 1.00 0.00 H TER 15917 WAT 1559 ATOM 15917 O WAT 1560 27.488 124.986 121.528 1.00 0.00 O ATOM 15918 H1 WAT 1560 27.747 124.746 122.418 1.00 0.00 H ATOM 15919 H2 WAT 1560 28.109 124.523 120.965 1.00 0.00 H TER 15921 WAT 1560 ATOM 15921 O WAT 1561 7.308 99.678 8.422 1.00 0.00 O ATOM 15922 H1 WAT 1561 6.507 99.633 7.899 1.00 0.00 H ATOM 15923 H2 WAT 1561 7.863 100.303 7.956 1.00 0.00 H TER 15925 WAT 1561 ATOM 15925 O WAT 1562 70.108 105.292 101.618 1.00 0.00 O ATOM 15926 H1 WAT 1562 70.922 104.811 101.467 1.00 0.00 H ATOM 15927 H2 WAT 1562 69.903 105.131 102.539 1.00 0.00 H TER 15929 WAT 1562 ATOM 15929 O WAT 1563 53.597 89.498 105.896 1.00 0.00 O ATOM 15930 H1 WAT 1563 53.743 90.104 106.622 1.00 0.00 H ATOM 15931 H2 WAT 1563 52.995 88.842 106.248 1.00 0.00 H TER 15933 WAT 1563 ATOM 15933 O WAT 1564 82.393 109.211 80.543 1.00 0.00 O ATOM 15934 H1 WAT 1564 83.068 108.585 80.281 1.00 0.00 H ATOM 15935 H2 WAT 1564 81.571 108.731 80.447 1.00 0.00 H TER 15937 WAT 1564 ATOM 15937 O WAT 1565 41.948 91.650 129.470 1.00 0.00 O ATOM 15938 H1 WAT 1565 41.102 92.077 129.609 1.00 0.00 H ATOM 15939 H2 WAT 1565 42.537 92.079 130.090 1.00 0.00 H TER 15941 WAT 1565 ATOM 15941 O WAT 1566 40.999 127.016 22.130 1.00 0.00 O ATOM 15942 H1 WAT 1566 40.057 127.181 22.079 1.00 0.00 H ATOM 15943 H2 WAT 1566 41.304 127.085 21.225 1.00 0.00 H TER 15945 WAT 1566 ATOM 15945 O WAT 1567 72.483 130.467 72.687 1.00 0.00 O ATOM 15946 H1 WAT 1567 72.626 130.216 73.600 1.00 0.00 H ATOM 15947 H2 WAT 1567 72.454 131.423 72.704 1.00 0.00 H TER 15949 WAT 1567 ATOM 15949 O WAT 1568 108.332 16.481 18.010 1.00 0.00 O ATOM 15950 H1 WAT 1568 109.138 16.198 17.578 1.00 0.00 H ATOM 15951 H2 WAT 1568 108.624 16.857 18.840 1.00 0.00 H TER 15953 WAT 1568 ATOM 15953 O WAT 1569 117.727 131.636 1.400 1.00 0.00 O ATOM 15954 H1 WAT 1569 118.483 131.878 1.936 1.00 0.00 H ATOM 15955 H2 WAT 1569 118.099 131.418 0.546 1.00 0.00 H TER 15957 WAT 1569 ATOM 15957 O WAT 1570 134.349 116.985 77.712 1.00 0.00 O ATOM 15958 H1 WAT 1570 133.566 117.164 78.233 1.00 0.00 H ATOM 15959 H2 WAT 1570 135.051 116.899 78.358 1.00 0.00 H TER 15961 WAT 1570 ATOM 15961 O WAT 1571 86.721 110.630 14.836 1.00 0.00 O ATOM 15962 H1 WAT 1571 87.512 110.701 15.370 1.00 0.00 H ATOM 15963 H2 WAT 1571 86.640 111.484 14.413 1.00 0.00 H TER 15965 WAT 1571 ATOM 15965 O WAT 1572 52.844 83.397 60.532 1.00 0.00 O ATOM 15966 H1 WAT 1572 53.306 84.234 60.584 1.00 0.00 H ATOM 15967 H2 WAT 1572 52.287 83.479 59.758 1.00 0.00 H TER 15969 WAT 1572 ATOM 15969 O WAT 1573 30.094 102.321 83.883 1.00 0.00 O ATOM 15970 H1 WAT 1573 29.242 102.589 83.537 1.00 0.00 H ATOM 15971 H2 WAT 1573 30.053 101.365 83.906 1.00 0.00 H TER 15973 WAT 1573 ATOM 15973 O WAT 1574 122.724 98.023 111.997 1.00 0.00 O ATOM 15974 H1 WAT 1574 122.717 98.896 112.388 1.00 0.00 H ATOM 15975 H2 WAT 1574 121.845 97.681 112.157 1.00 0.00 H TER 15977 WAT 1574 ATOM 15977 O WAT 1575 27.125 130.608 1.760 1.00 0.00 O ATOM 15978 H1 WAT 1575 26.388 130.158 2.172 1.00 0.00 H ATOM 15979 H2 WAT 1575 27.531 131.104 2.471 1.00 0.00 H TER 15981 WAT 1575 ATOM 15981 O WAT 1576 78.953 70.133 128.205 1.00 0.00 O ATOM 15982 H1 WAT 1576 78.506 70.953 127.993 1.00 0.00 H ATOM 15983 H2 WAT 1576 79.797 70.198 127.758 1.00 0.00 H TER 15985 WAT 1576 ATOM 15985 O WAT 1577 51.882 109.329 62.045 1.00 0.00 O ATOM 15986 H1 WAT 1577 51.574 108.527 61.622 1.00 0.00 H ATOM 15987 H2 WAT 1577 52.691 109.071 62.487 1.00 0.00 H TER 15989 WAT 1577 ATOM 15989 O WAT 1578 127.668 23.172 61.182 1.00 0.00 O ATOM 15990 H1 WAT 1578 128.329 22.520 61.415 1.00 0.00 H ATOM 15991 H2 WAT 1578 128.026 23.609 60.408 1.00 0.00 H TER 15993 WAT 1578 ATOM 15993 O WAT 1579 110.778 10.884 9.068 1.00 0.00 O ATOM 15994 H1 WAT 1579 109.877 11.204 9.098 1.00 0.00 H ATOM 15995 H2 WAT 1579 111.158 11.159 9.902 1.00 0.00 H TER 15997 WAT 1579 ATOM 15997 O WAT 1580 139.133 37.722 151.247 1.00 0.00 O ATOM 15998 H1 WAT 1580 138.300 37.281 151.415 1.00 0.00 H ATOM 15999 H2 WAT 1580 139.798 37.102 151.547 1.00 0.00 H TER 16001 WAT 1580 ATOM 16001 O WAT 1581 13.584 106.433 132.538 1.00 0.00 O ATOM 16002 H1 WAT 1581 13.724 106.195 133.455 1.00 0.00 H ATOM 16003 H2 WAT 1581 12.633 106.420 132.430 1.00 0.00 H TER 16005 WAT 1581 ATOM 16005 O WAT 1582 95.973 42.025 6.015 1.00 0.00 O ATOM 16006 H1 WAT 1582 95.690 42.030 6.929 1.00 0.00 H ATOM 16007 H2 WAT 1582 96.742 42.594 5.999 1.00 0.00 H TER 16009 WAT 1582 ATOM 16009 O WAT 1583 58.709 134.881 0.772 1.00 0.00 O ATOM 16010 H1 WAT 1583 57.795 135.139 0.895 1.00 0.00 H ATOM 16011 H2 WAT 1583 58.703 133.928 0.867 1.00 0.00 H TER 16013 WAT 1583 ATOM 16013 O WAT 1584 96.549 63.287 116.809 1.00 0.00 O ATOM 16014 H1 WAT 1584 96.039 62.967 117.553 1.00 0.00 H ATOM 16015 H2 WAT 1584 96.158 64.135 116.599 1.00 0.00 H TER 16017 WAT 1584 ATOM 16017 O WAT 1585 16.136 78.100 92.569 1.00 0.00 O ATOM 16018 H1 WAT 1585 16.947 78.029 93.072 1.00 0.00 H ATOM 16019 H2 WAT 1585 15.445 78.120 93.232 1.00 0.00 H TER 16021 WAT 1585 ATOM 16021 O WAT 1586 86.235 77.564 153.923 1.00 0.00 O ATOM 16022 H1 WAT 1586 87.108 77.837 153.641 1.00 0.00 H ATOM 16023 H2 WAT 1586 85.673 78.312 153.720 1.00 0.00 H TER 16025 WAT 1586 ATOM 16025 O WAT 1587 109.346 103.048 91.544 1.00 0.00 O ATOM 16026 H1 WAT 1587 109.789 103.761 91.085 1.00 0.00 H ATOM 16027 H2 WAT 1587 108.567 103.454 91.923 1.00 0.00 H TER 16029 WAT 1587 ATOM 16029 O WAT 1588 60.403 81.579 82.570 1.00 0.00 O ATOM 16030 H1 WAT 1588 59.976 82.433 82.629 1.00 0.00 H ATOM 16031 H2 WAT 1588 60.750 81.545 81.679 1.00 0.00 H TER 16033 WAT 1588 ATOM 16033 O WAT 1589 64.786 49.816 86.421 1.00 0.00 O ATOM 16034 H1 WAT 1589 64.125 50.270 86.943 1.00 0.00 H ATOM 16035 H2 WAT 1589 65.270 49.287 87.055 1.00 0.00 H TER 16037 WAT 1589 ATOM 16037 O WAT 1590 49.192 75.841 134.882 1.00 0.00 O ATOM 16038 H1 WAT 1590 49.463 76.759 134.902 1.00 0.00 H ATOM 16039 H2 WAT 1590 48.240 75.875 134.790 1.00 0.00 H TER 16041 WAT 1590 ATOM 16041 O WAT 1591 5.065 95.351 142.509 1.00 0.00 O ATOM 16042 H1 WAT 1591 5.116 95.248 143.460 1.00 0.00 H ATOM 16043 H2 WAT 1591 5.918 95.059 142.190 1.00 0.00 H TER 16045 WAT 1591 ATOM 16045 O WAT 1592 28.639 67.262 124.638 1.00 0.00 O ATOM 16046 H1 WAT 1592 28.236 68.100 124.411 1.00 0.00 H ATOM 16047 H2 WAT 1592 28.657 66.774 123.815 1.00 0.00 H TER 16049 WAT 1592 ATOM 16049 O WAT 1593 25.031 85.896 154.569 1.00 0.00 O ATOM 16050 H1 WAT 1593 25.760 85.276 154.597 1.00 0.00 H ATOM 16051 H2 WAT 1593 25.426 86.717 154.274 1.00 0.00 H TER 16053 WAT 1593 ATOM 16053 O WAT 1594 123.828 88.435 70.477 1.00 0.00 O ATOM 16054 H1 WAT 1594 122.986 88.884 70.539 1.00 0.00 H ATOM 16055 H2 WAT 1594 124.234 88.566 71.334 1.00 0.00 H TER 16057 WAT 1594 ATOM 16057 O WAT 1595 91.107 72.035 153.597 1.00 0.00 O ATOM 16058 H1 WAT 1595 91.686 72.151 152.844 1.00 0.00 H ATOM 16059 H2 WAT 1595 91.606 71.482 154.199 1.00 0.00 H TER 16061 WAT 1595 ATOM 16061 O WAT 1596 125.211 20.220 78.331 1.00 0.00 O ATOM 16062 H1 WAT 1596 126.024 20.487 78.760 1.00 0.00 H ATOM 16063 H2 WAT 1596 124.629 19.979 79.052 1.00 0.00 H TER 16065 WAT 1596 ATOM 16065 O WAT 1597 26.424 70.269 104.653 1.00 0.00 O ATOM 16066 H1 WAT 1597 25.634 70.328 105.190 1.00 0.00 H ATOM 16067 H2 WAT 1597 26.462 71.105 104.189 1.00 0.00 H TER 16069 WAT 1597 ATOM 16069 O WAT 1598 33.607 52.534 118.078 1.00 0.00 O ATOM 16070 H1 WAT 1598 34.219 51.831 118.297 1.00 0.00 H ATOM 16071 H2 WAT 1598 33.971 53.310 118.504 1.00 0.00 H TER 16073 WAT 1598 ATOM 16073 O WAT 1599 113.656 40.713 65.278 1.00 0.00 O ATOM 16074 H1 WAT 1599 113.341 41.462 65.784 1.00 0.00 H ATOM 16075 H2 WAT 1599 112.862 40.238 65.033 1.00 0.00 H TER 16077 WAT 1599 ATOM 16077 O WAT 1600 45.641 59.325 10.917 1.00 0.00 O ATOM 16078 H1 WAT 1600 46.016 58.777 11.606 1.00 0.00 H ATOM 16079 H2 WAT 1600 45.888 60.217 11.161 1.00 0.00 H TER 16081 WAT 1600 ATOM 16081 O WAT 1601 98.637 46.477 133.654 1.00 0.00 O ATOM 16082 H1 WAT 1601 98.922 47.264 134.119 1.00 0.00 H ATOM 16083 H2 WAT 1601 97.875 46.760 133.149 1.00 0.00 H TER 16085 WAT 1601 ATOM 16085 O WAT 1602 99.499 41.287 109.751 1.00 0.00 O ATOM 16086 H1 WAT 1602 98.564 41.234 109.947 1.00 0.00 H ATOM 16087 H2 WAT 1602 99.684 40.495 109.247 1.00 0.00 H TER 16089 WAT 1602 ATOM 16089 O WAT 1603 10.493 80.182 73.452 1.00 0.00 O ATOM 16090 H1 WAT 1603 10.631 81.113 73.279 1.00 0.00 H ATOM 16091 H2 WAT 1603 11.376 79.823 73.547 1.00 0.00 H TER 16093 WAT 1603 ATOM 16093 O WAT 1604 30.485 68.030 103.790 1.00 0.00 O ATOM 16094 H1 WAT 1604 29.888 68.193 104.520 1.00 0.00 H ATOM 16095 H2 WAT 1604 29.970 68.236 103.009 1.00 0.00 H TER 16097 WAT 1604 ATOM 16097 O WAT 1605 4.367 5.213 120.071 1.00 0.00 O ATOM 16098 H1 WAT 1605 3.737 4.957 119.397 1.00 0.00 H ATOM 16099 H2 WAT 1605 4.718 6.050 119.765 1.00 0.00 H TER 16101 WAT 1605 ATOM 16101 O WAT 1606 67.019 81.039 127.693 1.00 0.00 O ATOM 16102 H1 WAT 1606 66.297 81.661 127.786 1.00 0.00 H ATOM 16103 H2 WAT 1606 67.629 81.468 127.093 1.00 0.00 H TER 16105 WAT 1606 ATOM 16105 O WAT 1607 14.921 113.402 54.381 1.00 0.00 O ATOM 16106 H1 WAT 1607 14.694 113.607 55.288 1.00 0.00 H ATOM 16107 H2 WAT 1607 14.084 113.402 53.918 1.00 0.00 H TER 16109 WAT 1607 ATOM 16109 O WAT 1608 142.998 116.883 93.724 1.00 0.00 O ATOM 16110 H1 WAT 1608 143.405 116.246 93.137 1.00 0.00 H ATOM 16111 H2 WAT 1608 143.165 116.540 94.602 1.00 0.00 H TER 16113 WAT 1608 ATOM 16113 O WAT 1609 15.647 42.635 6.149 1.00 0.00 O ATOM 16114 H1 WAT 1609 15.672 43.527 5.801 1.00 0.00 H ATOM 16115 H2 WAT 1609 15.089 42.155 5.537 1.00 0.00 H TER 16117 WAT 1609 ATOM 16117 O WAT 1610 143.336 139.742 12.997 1.00 0.00 O ATOM 16118 H1 WAT 1610 142.798 140.166 13.666 1.00 0.00 H ATOM 16119 H2 WAT 1610 143.166 138.807 13.111 1.00 0.00 H TER 16121 WAT 1610 ATOM 16121 O WAT 1611 82.994 2.625 68.859 1.00 0.00 O ATOM 16122 H1 WAT 1611 82.371 2.093 69.353 1.00 0.00 H ATOM 16123 H2 WAT 1611 83.364 2.023 68.213 1.00 0.00 H TER 16125 WAT 1611 ATOM 16125 O WAT 1612 114.464 22.253 78.807 1.00 0.00 O ATOM 16126 H1 WAT 1612 114.593 22.119 77.868 1.00 0.00 H ATOM 16127 H2 WAT 1612 113.746 22.883 78.863 1.00 0.00 H TER 16129 WAT 1612 ATOM 16129 O WAT 1613 40.522 59.967 74.111 1.00 0.00 O ATOM 16130 H1 WAT 1613 40.477 59.444 74.912 1.00 0.00 H ATOM 16131 H2 WAT 1613 40.896 59.374 73.459 1.00 0.00 H TER 16133 WAT 1613 ATOM 16133 O WAT 1614 91.133 111.578 65.775 1.00 0.00 O ATOM 16134 H1 WAT 1614 90.506 110.914 65.487 1.00 0.00 H ATOM 16135 H2 WAT 1614 90.669 112.067 66.455 1.00 0.00 H TER 16137 WAT 1614 ATOM 16137 O WAT 1615 145.415 85.630 76.041 1.00 0.00 O ATOM 16138 H1 WAT 1615 146.127 85.001 76.157 1.00 0.00 H ATOM 16139 H2 WAT 1615 145.854 86.447 75.805 1.00 0.00 H TER 16141 WAT 1615 ATOM 16141 O WAT 1616 8.397 27.309 114.751 1.00 0.00 O ATOM 16142 H1 WAT 1616 8.310 27.418 115.698 1.00 0.00 H ATOM 16143 H2 WAT 1616 7.997 26.458 114.569 1.00 0.00 H TER 16145 WAT 1616 ATOM 16145 O WAT 1617 20.307 43.101 153.115 1.00 0.00 O ATOM 16146 H1 WAT 1617 21.258 43.206 153.102 1.00 0.00 H ATOM 16147 H2 WAT 1617 20.009 43.707 153.793 1.00 0.00 H TER 16149 WAT 1617 ATOM 16149 O WAT 1618 84.911 120.848 17.216 1.00 0.00 O ATOM 16150 H1 WAT 1618 84.259 120.874 17.917 1.00 0.00 H ATOM 16151 H2 WAT 1618 85.475 120.108 17.441 1.00 0.00 H TER 16153 WAT 1618 ATOM 16153 O WAT 1619 23.615 19.681 126.042 1.00 0.00 O ATOM 16154 H1 WAT 1619 22.825 20.026 125.625 1.00 0.00 H ATOM 16155 H2 WAT 1619 24.309 20.285 125.777 1.00 0.00 H TER 16157 WAT 1619 ATOM 16157 O WAT 1620 31.820 85.478 139.619 1.00 0.00 O ATOM 16158 H1 WAT 1620 32.346 85.134 138.897 1.00 0.00 H ATOM 16159 H2 WAT 1620 31.142 84.817 139.757 1.00 0.00 H TER 16161 WAT 1620 ATOM 16161 O WAT 1621 16.378 43.072 152.808 1.00 0.00 O ATOM 16162 H1 WAT 1621 16.405 44.009 152.619 1.00 0.00 H ATOM 16163 H2 WAT 1621 17.056 42.695 152.247 1.00 0.00 H TER 16165 WAT 1621 ATOM 16165 O WAT 1622 99.133 6.643 56.418 1.00 0.00 O ATOM 16166 H1 WAT 1622 98.582 6.451 55.659 1.00 0.00 H ATOM 16167 H2 WAT 1622 99.786 7.261 56.089 1.00 0.00 H TER 16169 WAT 1622 ATOM 16169 O WAT 1623 68.894 45.402 97.990 1.00 0.00 O ATOM 16170 H1 WAT 1623 68.089 45.127 97.550 1.00 0.00 H ATOM 16171 H2 WAT 1623 68.863 44.964 98.841 1.00 0.00 H TER 16173 WAT 1623 ATOM 16173 O WAT 1624 88.510 100.244 11.250 1.00 0.00 O ATOM 16174 H1 WAT 1624 88.155 100.993 11.729 1.00 0.00 H ATOM 16175 H2 WAT 1624 88.449 100.498 10.330 1.00 0.00 H TER 16177 WAT 1624 ATOM 16177 O WAT 1625 114.930 130.574 133.750 1.00 0.00 O ATOM 16178 H1 WAT 1625 114.906 130.791 134.682 1.00 0.00 H ATOM 16179 H2 WAT 1625 114.046 130.763 133.437 1.00 0.00 H TER 16181 WAT 1625 ATOM 16181 O WAT 1626 85.593 83.933 134.710 1.00 0.00 O ATOM 16182 H1 WAT 1626 85.695 83.326 135.443 1.00 0.00 H ATOM 16183 H2 WAT 1626 85.575 83.372 133.935 1.00 0.00 H TER 16185 WAT 1626 ATOM 16185 O WAT 1627 9.474 71.907 157.285 1.00 0.00 O ATOM 16186 H1 WAT 1627 8.609 71.533 157.116 1.00 0.00 H ATOM 16187 H2 WAT 1627 10.085 71.201 157.073 1.00 0.00 H TER 16189 WAT 1627 ATOM 16189 O WAT 1628 13.258 100.525 55.847 1.00 0.00 O ATOM 16190 H1 WAT 1628 14.033 100.293 56.359 1.00 0.00 H ATOM 16191 H2 WAT 1628 12.525 100.165 56.346 1.00 0.00 H TER 16193 WAT 1628 ATOM 16193 O WAT 1629 75.292 83.951 153.544 1.00 0.00 O ATOM 16194 H1 WAT 1629 75.730 84.658 154.019 1.00 0.00 H ATOM 16195 H2 WAT 1629 74.661 83.598 154.171 1.00 0.00 H TER 16197 WAT 1629 ATOM 16197 O WAT 1630 80.295 3.535 114.215 1.00 0.00 O ATOM 16198 H1 WAT 1630 80.566 4.179 113.562 1.00 0.00 H ATOM 16199 H2 WAT 1630 79.341 3.507 114.143 1.00 0.00 H TER 16201 WAT 1630 ATOM 16201 O WAT 1631 4.082 133.600 88.111 1.00 0.00 O ATOM 16202 H1 WAT 1631 3.847 132.995 87.408 1.00 0.00 H ATOM 16203 H2 WAT 1631 4.409 134.378 87.659 1.00 0.00 H TER 16205 WAT 1631 ATOM 16205 O WAT 1632 86.610 5.794 126.696 1.00 0.00 O ATOM 16206 H1 WAT 1632 86.072 6.391 127.216 1.00 0.00 H ATOM 16207 H2 WAT 1632 87.496 6.148 126.764 1.00 0.00 H TER 16209 WAT 1632 ATOM 16209 O WAT 1633 64.691 70.756 134.117 1.00 0.00 O ATOM 16210 H1 WAT 1633 65.409 71.369 134.276 1.00 0.00 H ATOM 16211 H2 WAT 1633 64.249 70.679 134.963 1.00 0.00 H TER 16213 WAT 1633 ATOM 16213 O WAT 1634 100.342 58.441 66.677 1.00 0.00 O ATOM 16214 H1 WAT 1634 101.107 58.854 67.077 1.00 0.00 H ATOM 16215 H2 WAT 1634 100.589 58.316 65.761 1.00 0.00 H TER 16217 WAT 1634 ATOM 16217 O WAT 1635 122.450 83.637 134.765 1.00 0.00 O ATOM 16218 H1 WAT 1635 123.146 84.039 134.245 1.00 0.00 H ATOM 16219 H2 WAT 1635 121.640 83.920 134.342 1.00 0.00 H TER 16221 WAT 1635 ATOM 16221 O WAT 1636 39.073 62.104 0.430 1.00 0.00 O ATOM 16222 H1 WAT 1636 39.444 61.968 1.302 1.00 0.00 H ATOM 16223 H2 WAT 1636 38.998 61.224 0.062 1.00 0.00 H TER 16225 WAT 1636 ATOM 16225 O WAT 1637 100.663 75.981 126.446 1.00 0.00 O ATOM 16226 H1 WAT 1637 101.174 76.775 126.603 1.00 0.00 H ATOM 16227 H2 WAT 1637 101.275 75.265 126.620 1.00 0.00 H TER 16229 WAT 1637 ATOM 16229 O WAT 1638 27.133 53.170 108.161 1.00 0.00 O ATOM 16230 H1 WAT 1638 28.068 53.344 108.268 1.00 0.00 H ATOM 16231 H2 WAT 1638 26.710 53.723 108.818 1.00 0.00 H TER 16233 WAT 1638 ATOM 16233 O WAT 1639 33.955 99.986 69.241 1.00 0.00 O ATOM 16234 H1 WAT 1639 34.322 99.194 69.634 1.00 0.00 H ATOM 16235 H2 WAT 1639 34.410 100.069 68.403 1.00 0.00 H TER 16237 WAT 1639 ATOM 16237 O WAT 1640 65.161 144.280 109.765 1.00 0.00 O ATOM 16238 H1 WAT 1640 64.269 144.616 109.850 1.00 0.00 H ATOM 16239 H2 WAT 1640 65.373 143.937 110.633 1.00 0.00 H TER 16241 WAT 1640 ATOM 16241 O WAT 1641 131.919 105.395 154.623 1.00 0.00 O ATOM 16242 H1 WAT 1641 131.357 105.983 154.119 1.00 0.00 H ATOM 16243 H2 WAT 1641 132.572 105.971 155.020 1.00 0.00 H TER 16245 WAT 1641 ATOM 16245 O WAT 1642 110.424 82.799 69.431 1.00 0.00 O ATOM 16246 H1 WAT 1642 111.142 82.746 68.800 1.00 0.00 H ATOM 16247 H2 WAT 1642 110.083 81.906 69.482 1.00 0.00 H TER 16249 WAT 1642 ATOM 16249 O WAT 1643 25.797 3.697 58.077 1.00 0.00 O ATOM 16250 H1 WAT 1643 25.806 3.680 57.120 1.00 0.00 H ATOM 16251 H2 WAT 1643 26.451 4.355 58.311 1.00 0.00 H TER 16253 WAT 1643 ATOM 16253 O WAT 1644 69.349 139.840 0.669 1.00 0.00 O ATOM 16254 H1 WAT 1644 68.949 139.081 1.094 1.00 0.00 H ATOM 16255 H2 WAT 1644 69.809 140.295 1.374 1.00 0.00 H TER 16257 WAT 1644 ATOM 16257 O WAT 1645 78.034 77.487 157.610 1.00 0.00 O ATOM 16258 H1 WAT 1645 78.678 78.186 157.718 1.00 0.00 H ATOM 16259 H2 WAT 1645 77.925 77.123 158.488 1.00 0.00 H TER 16261 WAT 1645 ATOM 16261 O WAT 1646 113.285 38.700 122.482 1.00 0.00 O ATOM 16262 H1 WAT 1646 112.891 39.009 121.666 1.00 0.00 H ATOM 16263 H2 WAT 1646 112.738 37.961 122.747 1.00 0.00 H TER 16265 WAT 1646 ATOM 16265 O WAT 1647 141.610 0.903 87.323 1.00 0.00 O ATOM 16266 H1 WAT 1647 141.488 1.332 88.170 1.00 0.00 H ATOM 16267 H2 WAT 1647 142.099 1.539 86.800 1.00 0.00 H TER 16269 WAT 1647 ATOM 16269 O WAT 1648 98.604 16.363 80.752 1.00 0.00 O ATOM 16270 H1 WAT 1648 98.606 16.489 79.803 1.00 0.00 H ATOM 16271 H2 WAT 1648 98.495 17.244 81.110 1.00 0.00 H TER 16273 WAT 1648 ATOM 16273 O WAT 1649 66.853 107.402 135.639 1.00 0.00 O ATOM 16274 H1 WAT 1649 67.453 107.222 136.362 1.00 0.00 H ATOM 16275 H2 WAT 1649 67.388 107.861 134.992 1.00 0.00 H TER 16277 WAT 1649 ATOM 16277 O WAT 1650 25.874 50.575 53.523 1.00 0.00 O ATOM 16278 H1 WAT 1650 25.651 50.175 54.363 1.00 0.00 H ATOM 16279 H2 WAT 1650 25.809 49.858 52.892 1.00 0.00 H TER 16281 WAT 1650 ATOM 16281 O WAT 1651 70.426 101.600 20.645 1.00 0.00 O ATOM 16282 H1 WAT 1651 70.609 101.670 19.708 1.00 0.00 H ATOM 16283 H2 WAT 1651 70.409 102.505 20.954 1.00 0.00 H TER 16285 WAT 1651 ATOM 16285 O WAT 1652 16.179 63.168 108.033 1.00 0.00 O ATOM 16286 H1 WAT 1652 17.119 63.200 107.858 1.00 0.00 H ATOM 16287 H2 WAT 1652 15.832 63.960 107.623 1.00 0.00 H TER 16289 WAT 1652 ATOM 16289 O WAT 1653 115.682 136.783 146.380 1.00 0.00 O ATOM 16290 H1 WAT 1653 116.124 136.110 146.899 1.00 0.00 H ATOM 16291 H2 WAT 1653 115.489 137.480 147.007 1.00 0.00 H TER 16293 WAT 1653 ATOM 16293 O WAT 1654 88.395 15.675 112.836 1.00 0.00 O ATOM 16294 H1 WAT 1654 88.029 16.431 113.294 1.00 0.00 H ATOM 16295 H2 WAT 1654 87.643 15.105 112.675 1.00 0.00 H TER 16297 WAT 1654 ATOM 16297 O WAT 1655 106.116 42.135 144.554 1.00 0.00 O ATOM 16298 H1 WAT 1655 106.580 42.544 143.824 1.00 0.00 H ATOM 16299 H2 WAT 1655 106.121 42.800 145.244 1.00 0.00 H TER 16301 WAT 1655 ATOM 16301 O WAT 1656 0.956 136.583 141.911 1.00 0.00 O ATOM 16302 H1 WAT 1656 0.106 136.938 142.172 1.00 0.00 H ATOM 16303 H2 WAT 1656 1.127 135.884 142.542 1.00 0.00 H TER 16305 WAT 1656 ATOM 16305 O WAT 1657 27.233 129.485 118.698 1.00 0.00 O ATOM 16306 H1 WAT 1657 26.519 130.005 118.330 1.00 0.00 H ATOM 16307 H2 WAT 1657 26.841 129.033 119.445 1.00 0.00 H TER 16309 WAT 1657 ATOM 16309 O WAT 1658 120.404 84.198 79.304 1.00 0.00 O ATOM 16310 H1 WAT 1658 120.200 84.706 80.090 1.00 0.00 H ATOM 16311 H2 WAT 1658 121.122 83.624 79.569 1.00 0.00 H TER 16313 WAT 1658 ATOM 16313 O WAT 1659 80.316 100.609 141.915 1.00 0.00 O ATOM 16314 H1 WAT 1659 79.795 100.942 142.645 1.00 0.00 H ATOM 16315 H2 WAT 1659 79.677 100.431 141.226 1.00 0.00 H TER 16317 WAT 1659 ATOM 16317 O WAT 1660 112.429 67.416 76.598 1.00 0.00 O ATOM 16318 H1 WAT 1660 112.763 68.309 76.520 1.00 0.00 H ATOM 16319 H2 WAT 1660 111.533 67.521 76.918 1.00 0.00 H TER 16321 WAT 1660 ATOM 16321 O WAT 1661 43.434 98.401 85.864 1.00 0.00 O ATOM 16322 H1 WAT 1661 42.582 98.835 85.896 1.00 0.00 H ATOM 16323 H2 WAT 1661 43.330 97.719 85.200 1.00 0.00 H TER 16325 WAT 1661 ATOM 16325 O WAT 1662 41.639 39.304 74.583 1.00 0.00 O ATOM 16326 H1 WAT 1662 41.623 40.082 75.140 1.00 0.00 H ATOM 16327 H2 WAT 1662 42.162 38.669 75.072 1.00 0.00 H TER 16329 WAT 1662 ATOM 16329 O WAT 1663 107.504 125.637 58.768 1.00 0.00 O ATOM 16330 H1 WAT 1663 107.509 124.680 58.762 1.00 0.00 H ATOM 16331 H2 WAT 1663 108.414 125.883 58.602 1.00 0.00 H TER 16333 WAT 1663 ATOM 16333 O WAT 1664 79.373 80.793 95.726 1.00 0.00 O ATOM 16334 H1 WAT 1664 78.523 81.211 95.595 1.00 0.00 H ATOM 16335 H2 WAT 1664 79.866 81.414 96.262 1.00 0.00 H TER 16337 WAT 1664 ATOM 16337 O WAT 1665 111.426 18.433 112.310 1.00 0.00 O ATOM 16338 H1 WAT 1665 111.485 18.165 113.227 1.00 0.00 H ATOM 16339 H2 WAT 1665 112.069 17.886 111.859 1.00 0.00 H TER 16341 WAT 1665 ATOM 16341 O WAT 1666 80.515 29.164 13.766 1.00 0.00 O ATOM 16342 H1 WAT 1666 80.233 28.933 12.880 1.00 0.00 H ATOM 16343 H2 WAT 1666 81.001 29.981 13.657 1.00 0.00 H TER 16345 WAT 1666 ATOM 16345 O WAT 1667 36.592 31.375 88.477 1.00 0.00 O ATOM 16346 H1 WAT 1667 36.389 32.299 88.622 1.00 0.00 H ATOM 16347 H2 WAT 1667 36.678 31.295 87.527 1.00 0.00 H TER 16349 WAT 1667 ATOM 16349 O WAT 1668 27.677 123.538 67.221 1.00 0.00 O ATOM 16350 H1 WAT 1668 26.772 123.740 66.985 1.00 0.00 H ATOM 16351 H2 WAT 1668 28.155 124.350 67.052 1.00 0.00 H TER 16353 WAT 1668 ATOM 16353 O WAT 1669 80.817 95.131 16.298 1.00 0.00 O ATOM 16354 H1 WAT 1669 81.392 94.656 16.898 1.00 0.00 H ATOM 16355 H2 WAT 1669 79.932 94.915 16.592 1.00 0.00 H TER 16357 WAT 1669 ATOM 16357 O WAT 1670 50.637 99.778 1.704 1.00 0.00 O ATOM 16358 H1 WAT 1670 51.182 99.104 2.109 1.00 0.00 H ATOM 16359 H2 WAT 1670 50.874 100.585 2.161 1.00 0.00 H TER 16361 WAT 1670 ATOM 16361 O WAT 1671 51.743 96.997 137.829 1.00 0.00 O ATOM 16362 H1 WAT 1671 51.707 97.709 138.468 1.00 0.00 H ATOM 16363 H2 WAT 1671 51.795 97.438 136.982 1.00 0.00 H TER 16365 WAT 1671 ATOM 16365 O WAT 1672 141.847 107.978 73.447 1.00 0.00 O ATOM 16366 H1 WAT 1672 142.737 108.024 73.098 1.00 0.00 H ATOM 16367 H2 WAT 1672 141.543 107.101 73.213 1.00 0.00 H TER 16369 WAT 1672 ATOM 16369 O WAT 1673 90.521 47.196 134.477 1.00 0.00 O ATOM 16370 H1 WAT 1673 89.951 47.939 134.278 1.00 0.00 H ATOM 16371 H2 WAT 1673 90.276 46.528 133.837 1.00 0.00 H TER 16373 WAT 1673 ATOM 16373 O WAT 1674 137.827 125.860 5.401 1.00 0.00 O ATOM 16374 H1 WAT 1674 137.230 125.507 4.741 1.00 0.00 H ATOM 16375 H2 WAT 1674 137.835 126.803 5.236 1.00 0.00 H TER 16377 WAT 1674 ATOM 16377 O WAT 1675 118.143 139.726 4.632 1.00 0.00 O ATOM 16378 H1 WAT 1675 118.414 139.325 3.806 1.00 0.00 H ATOM 16379 H2 WAT 1675 118.177 140.667 4.464 1.00 0.00 H TER 16381 WAT 1675 ATOM 16381 O WAT 1676 34.057 97.600 139.024 1.00 0.00 O ATOM 16382 H1 WAT 1676 34.142 98.084 138.202 1.00 0.00 H ATOM 16383 H2 WAT 1676 34.594 98.091 139.647 1.00 0.00 H TER 16385 WAT 1676 ATOM 16385 O WAT 1677 79.335 85.904 135.127 1.00 0.00 O ATOM 16386 H1 WAT 1677 78.727 85.228 135.425 1.00 0.00 H ATOM 16387 H2 WAT 1677 79.280 85.872 134.171 1.00 0.00 H TER 16389 WAT 1677 ATOM 16389 O WAT 1678 20.471 45.035 80.782 1.00 0.00 O ATOM 16390 H1 WAT 1678 20.495 44.598 81.634 1.00 0.00 H ATOM 16391 H2 WAT 1678 20.950 45.852 80.918 1.00 0.00 H TER 16393 WAT 1678 ATOM 16393 O WAT 1679 28.922 83.000 0.157 1.00 0.00 O ATOM 16394 H1 WAT 1679 29.157 83.774 -0.355 1.00 0.00 H ATOM 16395 H2 WAT 1679 29.483 83.046 0.931 1.00 0.00 H TER 16397 WAT 1679 ATOM 16397 O WAT 1680 59.618 0.472 135.737 1.00 0.00 O ATOM 16398 H1 WAT 1680 59.496 -0.207 136.401 1.00 0.00 H ATOM 16399 H2 WAT 1680 58.737 0.643 135.405 1.00 0.00 H TER 16401 WAT 1680 ATOM 16401 O WAT 1681 70.470 110.536 155.941 1.00 0.00 O ATOM 16402 H1 WAT 1681 70.697 109.724 156.394 1.00 0.00 H ATOM 16403 H2 WAT 1681 71.309 110.889 155.647 1.00 0.00 H TER 16405 WAT 1681 ATOM 16405 O WAT 1682 135.947 76.667 141.189 1.00 0.00 O ATOM 16406 H1 WAT 1682 135.573 75.811 141.399 1.00 0.00 H ATOM 16407 H2 WAT 1682 135.424 76.983 140.453 1.00 0.00 H TER 16409 WAT 1682 ATOM 16409 O WAT 1683 44.883 109.905 80.762 1.00 0.00 O ATOM 16410 H1 WAT 1683 45.721 110.360 80.673 1.00 0.00 H ATOM 16411 H2 WAT 1683 44.369 110.203 80.011 1.00 0.00 H TER 16413 WAT 1683 ATOM 16413 O WAT 1684 30.466 134.449 88.181 1.00 0.00 O ATOM 16414 H1 WAT 1684 31.289 134.936 88.240 1.00 0.00 H ATOM 16415 H2 WAT 1684 30.735 133.538 88.060 1.00 0.00 H TER 16417 WAT 1684 ATOM 16417 O WAT 1685 17.985 69.182 154.763 1.00 0.00 O ATOM 16418 H1 WAT 1685 18.921 69.021 154.646 1.00 0.00 H ATOM 16419 H2 WAT 1685 17.593 68.308 154.784 1.00 0.00 H TER 16421 WAT 1685 ATOM 16421 O WAT 1686 117.069 98.624 11.375 1.00 0.00 O ATOM 16422 H1 WAT 1686 117.367 99.035 10.564 1.00 0.00 H ATOM 16423 H2 WAT 1686 116.936 99.355 11.979 1.00 0.00 H TER 16425 WAT 1686 ATOM 16425 O WAT 1687 6.590 93.706 99.693 1.00 0.00 O ATOM 16426 H1 WAT 1687 6.152 93.994 100.494 1.00 0.00 H ATOM 16427 H2 WAT 1687 6.057 92.976 99.378 1.00 0.00 H TER 16429 WAT 1687 ATOM 16429 O WAT 1688 82.047 128.972 144.414 1.00 0.00 O ATOM 16430 H1 WAT 1688 81.623 128.212 144.813 1.00 0.00 H ATOM 16431 H2 WAT 1688 81.353 129.394 143.907 1.00 0.00 H TER 16433 WAT 1688 ATOM 16433 O WAT 1689 75.881 122.054 62.659 1.00 0.00 O ATOM 16434 H1 WAT 1689 75.582 121.382 62.047 1.00 0.00 H ATOM 16435 H2 WAT 1689 75.917 121.608 63.506 1.00 0.00 H TER 16437 WAT 1689 ATOM 16437 O WAT 1690 113.180 142.152 63.722 1.00 0.00 O ATOM 16438 H1 WAT 1690 112.396 142.511 63.307 1.00 0.00 H ATOM 16439 H2 WAT 1690 113.874 142.281 63.076 1.00 0.00 H TER 16441 WAT 1690 ATOM 16441 O WAT 1691 68.361 -0.097 134.064 1.00 0.00 O ATOM 16442 H1 WAT 1691 68.374 0.028 135.013 1.00 0.00 H ATOM 16443 H2 WAT 1691 68.035 0.734 133.717 1.00 0.00 H TER 16445 WAT 1691 ATOM 16445 O WAT 1692 135.537 21.168 17.244 1.00 0.00 O ATOM 16446 H1 WAT 1692 135.685 21.076 18.185 1.00 0.00 H ATOM 16447 H2 WAT 1692 134.804 21.780 17.175 1.00 0.00 H TER 16449 WAT 1692 ATOM 16449 O WAT 1693 103.131 17.319 17.558 1.00 0.00 O ATOM 16450 H1 WAT 1693 102.834 18.087 18.047 1.00 0.00 H ATOM 16451 H2 WAT 1693 103.423 17.670 16.717 1.00 0.00 H TER 16453 WAT 1693 ATOM 16453 O WAT 1694 118.373 21.565 150.455 1.00 0.00 O ATOM 16454 H1 WAT 1694 118.871 20.749 150.507 1.00 0.00 H ATOM 16455 H2 WAT 1694 118.669 22.075 151.210 1.00 0.00 H TER 16457 WAT 1694 ATOM 16457 O WAT 1695 2.409 133.734 77.802 1.00 0.00 O ATOM 16458 H1 WAT 1695 2.151 134.490 77.274 1.00 0.00 H ATOM 16459 H2 WAT 1695 2.815 133.133 77.178 1.00 0.00 H TER 16461 WAT 1695 ATOM 16461 O WAT 1696 127.874 38.046 65.478 1.00 0.00 O ATOM 16462 H1 WAT 1696 127.071 37.688 65.100 1.00 0.00 H ATOM 16463 H2 WAT 1696 128.162 37.381 66.103 1.00 0.00 H TER 16465 WAT 1696 ATOM 16465 O WAT 1697 23.450 74.144 1.643 1.00 0.00 O ATOM 16466 H1 WAT 1697 23.363 75.072 1.860 1.00 0.00 H ATOM 16467 H2 WAT 1697 22.581 73.778 1.804 1.00 0.00 H TER 16469 WAT 1697 ATOM 16469 O WAT 1698 92.027 34.986 133.546 1.00 0.00 O ATOM 16470 H1 WAT 1698 92.761 35.085 132.939 1.00 0.00 H ATOM 16471 H2 WAT 1698 91.399 35.655 133.274 1.00 0.00 H TER 16473 WAT 1698 ATOM 16473 O WAT 1699 44.596 131.472 2.084 1.00 0.00 O ATOM 16474 H1 WAT 1699 44.155 130.714 2.468 1.00 0.00 H ATOM 16475 H2 WAT 1699 45.452 131.139 1.815 1.00 0.00 H TER 16477 WAT 1699 ATOM 16477 O WAT 1700 128.568 81.676 115.666 1.00 0.00 O ATOM 16478 H1 WAT 1700 129.328 81.997 116.153 1.00 0.00 H ATOM 16479 H2 WAT 1700 128.288 80.896 116.145 1.00 0.00 H TER 16481 WAT 1700 ATOM 16481 O WAT 1701 124.945 85.781 78.015 1.00 0.00 O ATOM 16482 H1 WAT 1701 124.046 85.663 77.706 1.00 0.00 H ATOM 16483 H2 WAT 1701 124.985 86.697 78.290 1.00 0.00 H TER 16485 WAT 1701 ATOM 16485 O WAT 1702 88.159 6.444 133.055 1.00 0.00 O ATOM 16486 H1 WAT 1702 89.063 6.499 133.363 1.00 0.00 H ATOM 16487 H2 WAT 1702 88.236 6.290 132.113 1.00 0.00 H TER 16489 WAT 1702 ATOM 16489 O WAT 1703 58.502 11.584 55.169 1.00 0.00 O ATOM 16490 H1 WAT 1703 59.274 11.322 54.667 1.00 0.00 H ATOM 16491 H2 WAT 1703 58.569 11.092 55.987 1.00 0.00 H TER 16493 WAT 1703 ATOM 16493 O WAT 1704 103.586 37.520 143.266 1.00 0.00 O ATOM 16494 H1 WAT 1704 103.576 38.361 142.809 1.00 0.00 H ATOM 16495 H2 WAT 1704 103.979 36.912 142.640 1.00 0.00 H TER 16497 WAT 1704 ATOM 16497 O WAT 1705 51.727 109.970 154.105 1.00 0.00 O ATOM 16498 H1 WAT 1705 50.856 109.733 153.786 1.00 0.00 H ATOM 16499 H2 WAT 1705 52.024 109.197 154.585 1.00 0.00 H TER 16501 WAT 1705 ATOM 16501 O WAT 1706 69.921 103.341 25.833 1.00 0.00 O ATOM 16502 H1 WAT 1706 70.870 103.256 25.744 1.00 0.00 H ATOM 16503 H2 WAT 1706 69.802 103.965 26.549 1.00 0.00 H TER 16505 WAT 1706 ATOM 16505 O WAT 1707 105.854 105.970 125.575 1.00 0.00 O ATOM 16506 H1 WAT 1707 105.008 106.297 125.880 1.00 0.00 H ATOM 16507 H2 WAT 1707 105.660 105.552 124.735 1.00 0.00 H TER 16509 WAT 1707 ATOM 16509 O WAT 1708 39.079 59.467 158.119 1.00 0.00 O ATOM 16510 H1 WAT 1708 39.490 59.210 157.294 1.00 0.00 H ATOM 16511 H2 WAT 1708 39.631 59.074 158.795 1.00 0.00 H TER 16513 WAT 1708 ATOM 16513 O WAT 1709 41.986 90.265 82.448 1.00 0.00 O ATOM 16514 H1 WAT 1709 41.291 89.612 82.532 1.00 0.00 H ATOM 16515 H2 WAT 1709 42.244 90.223 81.527 1.00 0.00 H TER 16517 WAT 1709 ATOM 16517 O WAT 1710 14.146 32.928 60.084 1.00 0.00 O ATOM 16518 H1 WAT 1710 14.627 32.821 59.263 1.00 0.00 H ATOM 16519 H2 WAT 1710 13.881 33.848 60.087 1.00 0.00 H TER 16521 WAT 1710 ATOM 16521 O WAT 1711 50.347 135.825 157.612 1.00 0.00 O ATOM 16522 H1 WAT 1711 49.532 136.130 157.214 1.00 0.00 H ATOM 16523 H2 WAT 1711 51.026 136.061 156.979 1.00 0.00 H TER 16525 WAT 1711 ATOM 16525 O WAT 1712 65.805 2.597 14.136 1.00 0.00 O ATOM 16526 H1 WAT 1712 64.996 2.697 14.638 1.00 0.00 H ATOM 16527 H2 WAT 1712 65.763 1.706 13.789 1.00 0.00 H TER 16529 WAT 1712 ATOM 16529 O WAT 1713 142.194 136.121 112.257 1.00 0.00 O ATOM 16530 H1 WAT 1713 141.279 135.863 112.147 1.00 0.00 H ATOM 16531 H2 WAT 1713 142.447 136.477 111.405 1.00 0.00 H TER 16533 WAT 1713 ATOM 16533 O WAT 1714 143.870 129.715 109.345 1.00 0.00 O ATOM 16534 H1 WAT 1714 144.642 129.976 108.844 1.00 0.00 H ATOM 16535 H2 WAT 1714 144.178 129.002 109.906 1.00 0.00 H TER 16537 WAT 1714 ATOM 16537 O WAT 1715 44.705 17.194 82.408 1.00 0.00 O ATOM 16538 H1 WAT 1715 44.604 16.292 82.105 1.00 0.00 H ATOM 16539 H2 WAT 1715 45.650 17.349 82.387 1.00 0.00 H TER 16541 WAT 1715 ATOM 16541 O WAT 1716 56.538 27.717 130.321 1.00 0.00 O ATOM 16542 H1 WAT 1716 57.398 28.115 130.454 1.00 0.00 H ATOM 16543 H2 WAT 1716 56.720 26.784 130.212 1.00 0.00 H TER 16545 WAT 1716 ATOM 16545 O WAT 1717 100.692 106.683 136.541 1.00 0.00 O ATOM 16546 H1 WAT 1717 100.104 106.716 137.296 1.00 0.00 H ATOM 16547 H2 WAT 1717 100.655 107.564 136.169 1.00 0.00 H TER 16549 WAT 1717 ATOM 16549 O WAT 1718 95.530 77.378 106.635 1.00 0.00 O ATOM 16550 H1 WAT 1718 95.098 78.185 106.354 1.00 0.00 H ATOM 16551 H2 WAT 1718 94.812 76.797 106.884 1.00 0.00 H TER 16553 WAT 1718 ATOM 16553 O WAT 1719 80.267 78.523 67.590 1.00 0.00 O ATOM 16554 H1 WAT 1719 79.618 78.715 68.266 1.00 0.00 H ATOM 16555 H2 WAT 1719 80.931 79.205 67.694 1.00 0.00 H TER 16557 WAT 1719 ATOM 16557 O WAT 1720 59.978 84.368 76.056 1.00 0.00 O ATOM 16558 H1 WAT 1720 60.621 83.739 76.382 1.00 0.00 H ATOM 16559 H2 WAT 1720 60.503 85.102 75.735 1.00 0.00 H TER 16561 WAT 1720 ATOM 16561 O WAT 1721 143.019 98.140 11.921 1.00 0.00 O ATOM 16562 H1 WAT 1721 143.685 97.713 12.459 1.00 0.00 H ATOM 16563 H2 WAT 1721 142.259 97.561 11.975 1.00 0.00 H TER 16565 WAT 1721 ATOM 16565 O WAT 1722 105.054 6.325 99.176 1.00 0.00 O ATOM 16566 H1 WAT 1722 104.852 6.527 98.263 1.00 0.00 H ATOM 16567 H2 WAT 1722 105.015 7.170 99.623 1.00 0.00 H TER 16569 WAT 1722 ATOM 16569 O WAT 1723 42.719 104.365 105.488 1.00 0.00 O ATOM 16570 H1 WAT 1723 43.442 104.060 106.037 1.00 0.00 H ATOM 16571 H2 WAT 1723 42.958 105.261 105.253 1.00 0.00 H TER 16573 WAT 1723 ATOM 16573 O WAT 1724 11.416 23.157 123.178 1.00 0.00 O ATOM 16574 H1 WAT 1724 11.248 24.060 122.907 1.00 0.00 H ATOM 16575 H2 WAT 1724 12.371 23.091 123.209 1.00 0.00 H TER 16577 WAT 1724 ATOM 16577 O WAT 1725 27.722 136.793 6.541 1.00 0.00 O ATOM 16578 H1 WAT 1725 27.373 136.398 7.341 1.00 0.00 H ATOM 16579 H2 WAT 1725 27.031 136.667 5.891 1.00 0.00 H TER 16581 WAT 1725 ATOM 16581 O WAT 1726 121.945 59.614 110.564 1.00 0.00 O ATOM 16582 H1 WAT 1726 122.147 60.545 110.652 1.00 0.00 H ATOM 16583 H2 WAT 1726 122.611 59.173 111.093 1.00 0.00 H TER 16585 WAT 1726 ATOM 16585 O WAT 1727 52.688 58.132 97.983 1.00 0.00 O ATOM 16586 H1 WAT 1727 53.564 57.803 97.778 1.00 0.00 H ATOM 16587 H2 WAT 1727 52.670 59.014 97.611 1.00 0.00 H TER 16589 WAT 1727 ATOM 16589 O WAT 1728 113.466 31.384 146.270 1.00 0.00 O ATOM 16590 H1 WAT 1728 114.096 32.029 146.591 1.00 0.00 H ATOM 16591 H2 WAT 1728 112.749 31.414 146.904 1.00 0.00 H TER 16593 WAT 1728 ATOM 16593 O WAT 1729 18.503 113.649 13.512 1.00 0.00 O ATOM 16594 H1 WAT 1729 17.687 113.216 13.763 1.00 0.00 H ATOM 16595 H2 WAT 1729 18.462 114.504 13.941 1.00 0.00 H TER 16597 WAT 1729 ATOM 16597 O WAT 1730 43.564 139.203 -0.040 1.00 0.00 O ATOM 16598 H1 WAT 1730 44.078 138.946 0.725 1.00 0.00 H ATOM 16599 H2 WAT 1730 42.658 139.204 0.269 1.00 0.00 H TER 16601 WAT 1730 ATOM 16601 O WAT 1731 48.866 54.854 21.366 1.00 0.00 O ATOM 16602 H1 WAT 1731 48.950 54.389 22.198 1.00 0.00 H ATOM 16603 H2 WAT 1731 48.780 54.161 20.711 1.00 0.00 H TER 16605 WAT 1731 ATOM 16605 O WAT 1732 55.466 3.194 64.031 1.00 0.00 O ATOM 16606 H1 WAT 1732 54.673 3.163 64.566 1.00 0.00 H ATOM 16607 H2 WAT 1732 55.230 2.733 63.226 1.00 0.00 H TER 16609 WAT 1732 ATOM 16609 O WAT 1733 2.162 3.354 153.362 1.00 0.00 O ATOM 16610 H1 WAT 1733 2.092 4.064 154.000 1.00 0.00 H ATOM 16611 H2 WAT 1733 2.958 2.885 153.613 1.00 0.00 H TER 16613 WAT 1733 ATOM 16613 O WAT 1734 139.945 34.198 87.952 1.00 0.00 O ATOM 16614 H1 WAT 1734 140.702 34.363 88.514 1.00 0.00 H ATOM 16615 H2 WAT 1734 139.868 33.244 87.928 1.00 0.00 H TER 16617 WAT 1734 ATOM 16617 O WAT 1735 52.527 27.721 124.302 1.00 0.00 O ATOM 16618 H1 WAT 1735 53.222 28.345 124.514 1.00 0.00 H ATOM 16619 H2 WAT 1735 52.989 26.957 123.959 1.00 0.00 H TER 16621 WAT 1735 ATOM 16621 O WAT 1736 132.419 95.794 128.303 1.00 0.00 O ATOM 16622 H1 WAT 1736 133.039 95.462 128.953 1.00 0.00 H ATOM 16623 H2 WAT 1736 132.931 95.861 127.497 1.00 0.00 H TER 16625 WAT 1736 ATOM 16625 O WAT 1737 52.864 31.949 77.035 1.00 0.00 O ATOM 16626 H1 WAT 1737 52.556 32.855 77.056 1.00 0.00 H ATOM 16627 H2 WAT 1737 52.571 31.617 76.186 1.00 0.00 H TER 16629 WAT 1737 ATOM 16629 O WAT 1738 74.793 14.558 129.333 1.00 0.00 O ATOM 16630 H1 WAT 1738 75.239 14.921 128.568 1.00 0.00 H ATOM 16631 H2 WAT 1738 74.538 15.324 129.847 1.00 0.00 H TER 16633 WAT 1738 ATOM 16633 O WAT 1739 47.243 58.016 76.812 1.00 0.00 O ATOM 16634 H1 WAT 1739 47.532 57.549 76.028 1.00 0.00 H ATOM 16635 H2 WAT 1739 46.497 58.539 76.517 1.00 0.00 H TER 16637 WAT 1739 ATOM 16637 O WAT 1740 123.193 51.653 123.995 1.00 0.00 O ATOM 16638 H1 WAT 1740 123.787 52.184 124.526 1.00 0.00 H ATOM 16639 H2 WAT 1740 122.531 52.272 123.685 1.00 0.00 H TER 16641 WAT 1740 ATOM 16641 O WAT 1741 45.658 52.094 65.015 1.00 0.00 O ATOM 16642 H1 WAT 1741 45.033 52.499 65.616 1.00 0.00 H ATOM 16643 H2 WAT 1741 45.126 51.510 64.474 1.00 0.00 H TER 16645 WAT 1741 ATOM 16645 O WAT 1742 136.166 90.629 86.745 1.00 0.00 O ATOM 16646 H1 WAT 1742 135.519 90.776 87.434 1.00 0.00 H ATOM 16647 H2 WAT 1742 136.995 90.529 87.213 1.00 0.00 H TER 16649 WAT 1742 ATOM 16649 O WAT 1743 119.007 122.984 4.456 1.00 0.00 O ATOM 16650 H1 WAT 1743 119.521 122.679 5.203 1.00 0.00 H ATOM 16651 H2 WAT 1743 118.988 122.238 3.857 1.00 0.00 H TER 16653 WAT 1743 ATOM 16653 O WAT 1744 69.206 143.384 2.149 1.00 0.00 O ATOM 16654 H1 WAT 1744 69.907 142.736 2.223 1.00 0.00 H ATOM 16655 H2 WAT 1744 68.992 143.610 3.054 1.00 0.00 H TER 16657 WAT 1744 ATOM 16657 O WAT 1745 31.178 10.076 142.576 1.00 0.00 O ATOM 16658 H1 WAT 1745 32.061 9.707 142.548 1.00 0.00 H ATOM 16659 H2 WAT 1745 30.667 9.437 143.072 1.00 0.00 H TER 16661 WAT 1745 ATOM 16661 O WAT 1746 97.147 144.576 147.625 1.00 0.00 O ATOM 16662 H1 WAT 1746 97.650 145.325 147.946 1.00 0.00 H ATOM 16663 H2 WAT 1746 96.416 144.966 147.146 1.00 0.00 H TER 16665 WAT 1746 ATOM 16665 O WAT 1747 23.750 22.592 76.239 1.00 0.00 O ATOM 16666 H1 WAT 1747 24.606 22.286 75.939 1.00 0.00 H ATOM 16667 H2 WAT 1747 23.919 22.969 77.102 1.00 0.00 H TER 16669 WAT 1747 ATOM 16669 O WAT 1748 109.567 54.042 64.060 1.00 0.00 O ATOM 16670 H1 WAT 1748 108.945 53.338 63.877 1.00 0.00 H ATOM 16671 H2 WAT 1748 109.455 54.656 63.334 1.00 0.00 H TER 16673 WAT 1748 ATOM 16673 O WAT 1749 127.361 76.347 148.142 1.00 0.00 O ATOM 16674 H1 WAT 1749 128.318 76.340 148.152 1.00 0.00 H ATOM 16675 H2 WAT 1749 127.121 75.562 147.650 1.00 0.00 H TER 16677 WAT 1749 ATOM 16677 O WAT 1750 52.926 29.380 141.295 1.00 0.00 O ATOM 16678 H1 WAT 1750 52.492 29.851 140.584 1.00 0.00 H ATOM 16679 H2 WAT 1750 53.843 29.649 141.235 1.00 0.00 H TER 16681 WAT 1750 ATOM 16681 O WAT 1751 16.015 94.263 66.373 1.00 0.00 O ATOM 16682 H1 WAT 1751 15.746 95.105 66.740 1.00 0.00 H ATOM 16683 H2 WAT 1751 16.543 94.493 65.609 1.00 0.00 H TER 16685 WAT 1751 ATOM 16685 O WAT 1752 72.571 120.667 74.044 1.00 0.00 O ATOM 16686 H1 WAT 1752 73.255 121.319 74.195 1.00 0.00 H ATOM 16687 H2 WAT 1752 72.461 120.652 73.093 1.00 0.00 H TER 16689 WAT 1752 ATOM 16689 O WAT 1753 10.128 23.402 145.147 1.00 0.00 O ATOM 16690 H1 WAT 1753 10.407 24.275 144.869 1.00 0.00 H ATOM 16691 H2 WAT 1753 10.397 22.826 144.431 1.00 0.00 H TER 16693 WAT 1753 ATOM 16693 O WAT 1754 98.571 44.950 58.694 1.00 0.00 O ATOM 16694 H1 WAT 1754 98.939 44.300 59.292 1.00 0.00 H ATOM 16695 H2 WAT 1754 98.185 45.612 59.268 1.00 0.00 H TER 16697 WAT 1754 ATOM 16697 O WAT 1755 21.144 40.535 105.307 1.00 0.00 O ATOM 16698 H1 WAT 1755 20.959 41.300 104.761 1.00 0.00 H ATOM 16699 H2 WAT 1755 21.992 40.220 104.997 1.00 0.00 H TER 16701 WAT 1755 ATOM 16701 O WAT 1756 105.207 120.428 141.881 1.00 0.00 O ATOM 16702 H1 WAT 1756 104.849 121.300 141.715 1.00 0.00 H ATOM 16703 H2 WAT 1756 106.064 120.592 142.274 1.00 0.00 H TER 16705 WAT 1756 ATOM 16705 O WAT 1757 97.551 101.328 76.412 1.00 0.00 O ATOM 16706 H1 WAT 1757 97.478 100.725 75.672 1.00 0.00 H ATOM 16707 H2 WAT 1757 98.492 101.475 76.509 1.00 0.00 H TER 16709 WAT 1757 ATOM 16709 O WAT 1758 43.035 57.286 153.064 1.00 0.00 O ATOM 16710 H1 WAT 1758 42.338 57.864 153.376 1.00 0.00 H ATOM 16711 H2 WAT 1758 42.907 57.247 152.116 1.00 0.00 H TER 16713 WAT 1758 ATOM 16713 O WAT 1759 35.127 89.178 88.611 1.00 0.00 O ATOM 16714 H1 WAT 1759 35.451 88.355 88.245 1.00 0.00 H ATOM 16715 H2 WAT 1759 35.597 89.857 88.127 1.00 0.00 H TER 16717 WAT 1759 ATOM 16717 O WAT 1760 0.550 23.460 155.841 1.00 0.00 O ATOM 16718 H1 WAT 1760 -0.352 23.166 155.970 1.00 0.00 H ATOM 16719 H2 WAT 1760 0.916 23.504 156.725 1.00 0.00 H TER 16721 WAT 1760 ATOM 16721 O WAT 1761 42.764 20.045 141.713 1.00 0.00 O ATOM 16722 H1 WAT 1761 43.618 20.447 141.868 1.00 0.00 H ATOM 16723 H2 WAT 1761 42.420 20.500 140.945 1.00 0.00 H TER 16725 WAT 1761 ATOM 16725 O WAT 1762 104.504 115.446 77.191 1.00 0.00 O ATOM 16726 H1 WAT 1762 104.917 114.868 76.549 1.00 0.00 H ATOM 16727 H2 WAT 1762 104.063 116.113 76.665 1.00 0.00 H TER 16729 WAT 1762 ATOM 16729 O WAT 1763 84.897 25.697 114.895 1.00 0.00 O ATOM 16730 H1 WAT 1763 84.340 24.954 114.663 1.00 0.00 H ATOM 16731 H2 WAT 1763 84.559 26.422 114.369 1.00 0.00 H TER 16733 WAT 1763 ATOM 16733 O WAT 1764 105.825 76.793 61.204 1.00 0.00 O ATOM 16734 H1 WAT 1764 106.380 77.549 61.011 1.00 0.00 H ATOM 16735 H2 WAT 1764 106.437 76.109 61.475 1.00 0.00 H TER 16737 WAT 1764 ATOM 16737 O WAT 1765 82.558 88.916 7.370 1.00 0.00 O ATOM 16738 H1 WAT 1765 81.769 88.573 7.791 1.00 0.00 H ATOM 16739 H2 WAT 1765 82.855 89.616 7.951 1.00 0.00 H TER 16741 WAT 1765 ATOM 16741 O WAT 1766 10.154 99.144 157.675 1.00 0.00 O ATOM 16742 H1 WAT 1766 9.748 98.885 158.502 1.00 0.00 H ATOM 16743 H2 WAT 1766 9.824 98.510 157.038 1.00 0.00 H TER 16745 WAT 1766 ATOM 16745 O WAT 1767 22.918 11.857 20.550 1.00 0.00 O ATOM 16746 H1 WAT 1767 23.217 12.692 20.189 1.00 0.00 H ATOM 16747 H2 WAT 1767 22.224 12.096 21.164 1.00 0.00 H TER 16749 WAT 1767 ATOM 16749 O WAT 1768 124.941 41.343 154.973 1.00 0.00 O ATOM 16750 H1 WAT 1768 125.732 41.191 154.456 1.00 0.00 H ATOM 16751 H2 WAT 1768 124.953 40.652 155.636 1.00 0.00 H TER 16753 WAT 1768 ATOM 16753 O WAT 1769 106.033 130.355 115.626 1.00 0.00 O ATOM 16754 H1 WAT 1769 106.222 129.425 115.494 1.00 0.00 H ATOM 16755 H2 WAT 1769 105.926 130.445 116.573 1.00 0.00 H TER 16757 WAT 1769 ATOM 16757 O WAT 1770 10.063 131.910 15.279 1.00 0.00 O ATOM 16758 H1 WAT 1770 9.997 132.513 16.019 1.00 0.00 H ATOM 16759 H2 WAT 1770 9.951 132.465 14.507 1.00 0.00 H TER 16761 WAT 1770 ATOM 16761 O WAT 1771 26.947 17.785 76.293 1.00 0.00 O ATOM 16762 H1 WAT 1771 27.065 17.068 75.670 1.00 0.00 H ATOM 16763 H2 WAT 1771 27.657 18.395 76.094 1.00 0.00 H TER 16765 WAT 1771 ATOM 16765 O WAT 1772 23.947 120.270 132.883 1.00 0.00 O ATOM 16766 H1 WAT 1772 24.763 120.271 132.382 1.00 0.00 H ATOM 16767 H2 WAT 1772 23.295 119.916 132.279 1.00 0.00 H TER 16769 WAT 1772 ATOM 16769 O WAT 1773 136.137 127.597 125.813 1.00 0.00 O ATOM 16770 H1 WAT 1773 135.883 126.803 125.341 1.00 0.00 H ATOM 16771 H2 WAT 1773 135.368 128.164 125.757 1.00 0.00 H TER 16773 WAT 1773 ATOM 16773 O WAT 1774 58.240 55.039 88.274 1.00 0.00 O ATOM 16774 H1 WAT 1774 58.418 55.914 87.928 1.00 0.00 H ATOM 16775 H2 WAT 1774 57.883 55.196 89.149 1.00 0.00 H TER 16777 WAT 1774 ATOM 16777 O WAT 1775 88.500 1.317 137.833 1.00 0.00 O ATOM 16778 H1 WAT 1775 89.362 1.733 137.839 1.00 0.00 H ATOM 16779 H2 WAT 1775 88.083 1.643 137.035 1.00 0.00 H TER 16781 WAT 1775 ATOM 16781 O WAT 1776 29.011 33.142 73.983 1.00 0.00 O ATOM 16782 H1 WAT 1776 28.971 33.591 74.828 1.00 0.00 H ATOM 16783 H2 WAT 1776 29.927 32.879 73.895 1.00 0.00 H TER 16785 WAT 1776 ATOM 16785 O WAT 1777 74.899 136.961 111.434 1.00 0.00 O ATOM 16786 H1 WAT 1777 74.951 136.696 112.352 1.00 0.00 H ATOM 16787 H2 WAT 1777 75.694 136.608 111.036 1.00 0.00 H TER 16789 WAT 1777 ATOM 16789 O WAT 1778 41.678 108.618 132.005 1.00 0.00 O ATOM 16790 H1 WAT 1778 41.914 107.690 132.023 1.00 0.00 H ATOM 16791 H2 WAT 1778 40.805 108.635 131.613 1.00 0.00 H TER 16793 WAT 1778 ATOM 16793 O WAT 1779 77.560 69.827 144.617 1.00 0.00 O ATOM 16794 H1 WAT 1779 78.514 69.791 144.687 1.00 0.00 H ATOM 16795 H2 WAT 1779 77.387 70.621 144.112 1.00 0.00 H TER 16797 WAT 1779 ATOM 16797 O WAT 1780 12.020 46.342 136.571 1.00 0.00 O ATOM 16798 H1 WAT 1780 11.619 46.236 135.709 1.00 0.00 H ATOM 16799 H2 WAT 1780 12.713 45.682 136.595 1.00 0.00 H TER 16801 WAT 1780 ATOM 16801 O WAT 1781 142.514 43.201 132.318 1.00 0.00 O ATOM 16802 H1 WAT 1781 141.774 42.681 132.630 1.00 0.00 H ATOM 16803 H2 WAT 1781 142.714 43.793 133.042 1.00 0.00 H TER 16805 WAT 1781 ATOM 16805 O WAT 1782 115.961 57.288 139.411 1.00 0.00 O ATOM 16806 H1 WAT 1782 115.516 56.662 138.841 1.00 0.00 H ATOM 16807 H2 WAT 1782 115.433 58.084 139.352 1.00 0.00 H TER 16809 WAT 1782 ATOM 16809 O WAT 1783 144.495 121.933 103.400 1.00 0.00 O ATOM 16810 H1 WAT 1783 144.343 122.304 104.269 1.00 0.00 H ATOM 16811 H2 WAT 1783 144.922 122.636 102.911 1.00 0.00 H TER 16813 WAT 1783 ATOM 16813 O WAT 1784 138.119 19.104 15.858 1.00 0.00 O ATOM 16814 H1 WAT 1784 138.646 19.054 16.656 1.00 0.00 H ATOM 16815 H2 WAT 1784 137.513 18.366 15.925 1.00 0.00 H TER 16817 WAT 1784 ATOM 16817 O WAT 1785 27.744 31.388 70.418 1.00 0.00 O ATOM 16818 H1 WAT 1785 27.157 31.652 71.125 1.00 0.00 H ATOM 16819 H2 WAT 1785 28.505 31.015 70.864 1.00 0.00 H TER 16821 WAT 1785 ATOM 16821 O WAT 1786 12.467 4.613 157.490 1.00 0.00 O ATOM 16822 H1 WAT 1786 13.266 4.213 157.834 1.00 0.00 H ATOM 16823 H2 WAT 1786 12.698 4.881 156.601 1.00 0.00 H TER 16825 WAT 1786 ATOM 16825 O WAT 1787 44.539 44.390 84.633 1.00 0.00 O ATOM 16826 H1 WAT 1787 45.487 44.435 84.764 1.00 0.00 H ATOM 16827 H2 WAT 1787 44.436 44.162 83.710 1.00 0.00 H TER 16829 WAT 1787 ATOM 16829 O WAT 1788 66.796 92.995 149.319 1.00 0.00 O ATOM 16830 H1 WAT 1788 67.441 93.264 148.665 1.00 0.00 H ATOM 16831 H2 WAT 1788 66.824 93.686 149.981 1.00 0.00 H TER 16833 WAT 1788 ATOM 16833 O WAT 1789 66.437 66.144 78.117 1.00 0.00 O ATOM 16834 H1 WAT 1789 65.784 65.722 77.559 1.00 0.00 H ATOM 16835 H2 WAT 1789 66.405 67.068 77.867 1.00 0.00 H TER 16837 WAT 1789 ATOM 16837 O WAT 1790 27.492 39.409 81.782 1.00 0.00 O ATOM 16838 H1 WAT 1790 27.560 40.063 81.087 1.00 0.00 H ATOM 16839 H2 WAT 1790 26.638 39.000 81.643 1.00 0.00 H TER 16841 WAT 1790 ATOM 16841 O WAT 1791 69.902 12.569 51.490 1.00 0.00 O ATOM 16842 H1 WAT 1791 69.860 13.524 51.535 1.00 0.00 H ATOM 16843 H2 WAT 1791 69.045 12.307 51.156 1.00 0.00 H TER 16845 WAT 1791 ATOM 16845 O WAT 1792 14.509 15.075 3.090 1.00 0.00 O ATOM 16846 H1 WAT 1792 14.998 14.864 2.295 1.00 0.00 H ATOM 16847 H2 WAT 1792 13.937 15.798 2.834 1.00 0.00 H TER 16849 WAT 1792 ATOM 16849 O WAT 1793 70.154 3.458 24.803 1.00 0.00 O ATOM 16850 H1 WAT 1793 69.215 3.313 24.924 1.00 0.00 H ATOM 16851 H2 WAT 1793 70.473 3.700 25.672 1.00 0.00 H TER 16853 WAT 1793 ATOM 16853 O WAT 1794 30.131 120.220 20.694 1.00 0.00 O ATOM 16854 H1 WAT 1794 29.441 120.690 21.163 1.00 0.00 H ATOM 16855 H2 WAT 1794 30.922 120.736 20.851 1.00 0.00 H TER 16857 WAT 1794 ATOM 16857 O WAT 1795 72.387 71.029 110.439 1.00 0.00 O ATOM 16858 H1 WAT 1795 71.772 71.247 111.139 1.00 0.00 H ATOM 16859 H2 WAT 1795 71.862 70.548 109.800 1.00 0.00 H TER 16861 WAT 1795 ATOM 16861 O WAT 1796 32.288 53.331 66.481 1.00 0.00 O ATOM 16862 H1 WAT 1796 33.227 53.162 66.403 1.00 0.00 H ATOM 16863 H2 WAT 1796 31.911 52.961 65.683 1.00 0.00 H TER 16865 WAT 1796 ATOM 16865 O WAT 1797 73.369 54.868 1.649 1.00 0.00 O ATOM 16866 H1 WAT 1797 73.158 53.989 1.335 1.00 0.00 H ATOM 16867 H2 WAT 1797 74.293 54.820 1.892 1.00 0.00 H TER 16869 WAT 1797 ATOM 16869 O WAT 1798 77.779 27.309 76.954 1.00 0.00 O ATOM 16870 H1 WAT 1798 77.209 28.070 77.067 1.00 0.00 H ATOM 16871 H2 WAT 1798 77.584 26.993 76.072 1.00 0.00 H TER 16873 WAT 1798 ATOM 16873 O WAT 1799 40.530 143.375 143.370 1.00 0.00 O ATOM 16874 H1 WAT 1799 39.746 143.773 143.748 1.00 0.00 H ATOM 16875 H2 WAT 1799 40.998 143.007 144.120 1.00 0.00 H TER 16877 WAT 1799 ATOM 16877 O WAT 1800 18.383 50.094 143.433 1.00 0.00 O ATOM 16878 H1 WAT 1800 17.632 49.941 142.859 1.00 0.00 H ATOM 16879 H2 WAT 1800 18.844 49.255 143.453 1.00 0.00 H TER 16881 WAT 1800 ATOM 16881 O WAT 1801 8.145 8.829 61.532 1.00 0.00 O ATOM 16882 H1 WAT 1801 8.718 8.186 61.113 1.00 0.00 H ATOM 16883 H2 WAT 1801 7.271 8.442 61.479 1.00 0.00 H TER 16885 WAT 1801 ATOM 16885 O WAT 1802 136.659 90.086 154.645 1.00 0.00 O ATOM 16886 H1 WAT 1802 135.761 89.784 154.780 1.00 0.00 H ATOM 16887 H2 WAT 1802 136.858 90.603 155.426 1.00 0.00 H TER 16889 WAT 1802 ATOM 16889 O WAT 1803 137.414 71.817 69.582 1.00 0.00 O ATOM 16890 H1 WAT 1803 136.523 71.682 69.904 1.00 0.00 H ATOM 16891 H2 WAT 1803 137.937 71.158 70.040 1.00 0.00 H TER 16893 WAT 1803 ATOM 16893 O WAT 1804 58.332 96.649 120.712 1.00 0.00 O ATOM 16894 H1 WAT 1804 59.168 97.015 121.001 1.00 0.00 H ATOM 16895 H2 WAT 1804 58.572 95.868 120.214 1.00 0.00 H TER 16897 WAT 1804 ATOM 16897 O WAT 1805 76.252 55.605 145.957 1.00 0.00 O ATOM 16898 H1 WAT 1805 75.322 55.678 146.171 1.00 0.00 H ATOM 16899 H2 WAT 1805 76.515 56.496 145.726 1.00 0.00 H TER 16901 WAT 1805 ATOM 16901 O WAT 1806 115.703 6.882 119.758 1.00 0.00 O ATOM 16902 H1 WAT 1806 115.069 7.297 120.343 1.00 0.00 H ATOM 16903 H2 WAT 1806 115.193 6.229 119.278 1.00 0.00 H TER 16905 WAT 1806 ATOM 16905 O WAT 1807 58.415 41.781 60.071 1.00 0.00 O ATOM 16906 H1 WAT 1807 59.224 41.459 59.674 1.00 0.00 H ATOM 16907 H2 WAT 1807 57.783 41.075 59.934 1.00 0.00 H TER 16909 WAT 1807 ATOM 16909 O WAT 1808 135.035 44.607 122.666 1.00 0.00 O ATOM 16910 H1 WAT 1808 135.296 43.893 122.084 1.00 0.00 H ATOM 16911 H2 WAT 1808 135.856 44.916 123.050 1.00 0.00 H TER 16913 WAT 1808 ATOM 16913 O WAT 1809 5.916 78.306 88.641 1.00 0.00 O ATOM 16914 H1 WAT 1809 5.152 78.805 88.930 1.00 0.00 H ATOM 16915 H2 WAT 1809 5.642 77.903 87.817 1.00 0.00 H TER 16917 WAT 1809 ATOM 16917 O WAT 1810 143.570 128.508 143.222 1.00 0.00 O ATOM 16918 H1 WAT 1810 143.833 128.324 142.320 1.00 0.00 H ATOM 16919 H2 WAT 1810 142.805 127.952 143.366 1.00 0.00 H TER 16921 WAT 1810 ATOM 16921 O WAT 1811 138.467 123.738 151.604 1.00 0.00 O ATOM 16922 H1 WAT 1811 138.082 124.060 150.789 1.00 0.00 H ATOM 16923 H2 WAT 1811 137.715 123.515 152.152 1.00 0.00 H TER 16925 WAT 1811 ATOM 16925 O WAT 1812 110.233 90.909 141.950 1.00 0.00 O ATOM 16926 H1 WAT 1812 110.410 90.699 141.033 1.00 0.00 H ATOM 16927 H2 WAT 1812 110.827 91.633 142.149 1.00 0.00 H TER 16929 WAT 1812 ATOM 16929 O WAT 1813 101.875 119.441 76.582 1.00 0.00 O ATOM 16930 H1 WAT 1813 102.218 120.018 75.900 1.00 0.00 H ATOM 16931 H2 WAT 1813 102.235 118.579 76.371 1.00 0.00 H TER 16933 WAT 1813 ATOM 16933 O WAT 1814 114.440 145.847 106.870 1.00 0.00 O ATOM 16934 H1 WAT 1814 115.287 145.850 106.424 1.00 0.00 H ATOM 16935 H2 WAT 1814 113.846 145.418 106.254 1.00 0.00 H TER 16937 WAT 1814 ATOM 16937 O WAT 1815 24.144 65.986 128.250 1.00 0.00 O ATOM 16938 H1 WAT 1815 23.757 65.319 128.816 1.00 0.00 H ATOM 16939 H2 WAT 1815 23.547 66.730 128.313 1.00 0.00 H TER 16941 WAT 1815 ATOM 16941 O WAT 1816 19.747 20.522 121.738 1.00 0.00 O ATOM 16942 H1 WAT 1816 19.840 19.569 121.735 1.00 0.00 H ATOM 16943 H2 WAT 1816 18.988 20.686 122.298 1.00 0.00 H TER 16945 WAT 1816 ATOM 16945 O WAT 1817 58.046 120.453 133.408 1.00 0.00 O ATOM 16946 H1 WAT 1817 57.849 120.383 134.342 1.00 0.00 H ATOM 16947 H2 WAT 1817 57.370 121.037 133.064 1.00 0.00 H TER 16949 WAT 1817 ATOM 16949 O WAT 1818 87.249 114.713 74.492 1.00 0.00 O ATOM 16950 H1 WAT 1818 86.847 115.168 75.232 1.00 0.00 H ATOM 16951 H2 WAT 1818 86.509 114.374 73.988 1.00 0.00 H TER 16953 WAT 1818 ATOM 16953 O WAT 1819 29.360 103.465 101.596 1.00 0.00 O ATOM 16954 H1 WAT 1819 29.688 103.183 100.742 1.00 0.00 H ATOM 16955 H2 WAT 1819 29.853 102.940 102.226 1.00 0.00 H TER 16957 WAT 1819 ATOM 16957 O WAT 1820 142.415 88.776 125.910 1.00 0.00 O ATOM 16958 H1 WAT 1820 142.320 88.052 125.291 1.00 0.00 H ATOM 16959 H2 WAT 1820 142.859 88.389 126.664 1.00 0.00 H TER 16961 WAT 1820 ATOM 16961 O WAT 1821 106.971 40.648 123.238 1.00 0.00 O ATOM 16962 H1 WAT 1821 107.507 41.438 123.166 1.00 0.00 H ATOM 16963 H2 WAT 1821 106.109 40.968 123.506 1.00 0.00 H TER 16965 WAT 1821 ATOM 16965 O WAT 1822 68.674 70.787 93.186 1.00 0.00 O ATOM 16966 H1 WAT 1822 67.996 71.126 92.601 1.00 0.00 H ATOM 16967 H2 WAT 1822 69.305 71.503 93.262 1.00 0.00 H TER 16969 WAT 1822 ATOM 16969 O WAT 1823 24.967 129.466 67.026 1.00 0.00 O ATOM 16970 H1 WAT 1823 24.077 129.417 66.677 1.00 0.00 H ATOM 16971 H2 WAT 1823 24.952 128.904 67.801 1.00 0.00 H TER 16973 WAT 1823 ATOM 16973 O WAT 1824 103.961 89.345 131.301 1.00 0.00 O ATOM 16974 H1 WAT 1824 103.719 89.005 132.162 1.00 0.00 H ATOM 16975 H2 WAT 1824 103.346 88.928 130.697 1.00 0.00 H TER 16977 WAT 1824 ATOM 16977 O WAT 1825 19.367 18.035 98.035 1.00 0.00 O ATOM 16978 H1 WAT 1825 20.261 17.940 98.364 1.00 0.00 H ATOM 16979 H2 WAT 1825 18.851 18.265 98.808 1.00 0.00 H TER 16981 WAT 1825 ATOM 16981 O WAT 1826 57.656 29.971 145.059 1.00 0.00 O ATOM 16982 H1 WAT 1826 57.709 30.838 144.656 1.00 0.00 H ATOM 16983 H2 WAT 1826 57.664 30.145 146.001 1.00 0.00 H TER 16985 WAT 1826 ATOM 16985 O WAT 1827 115.611 136.482 78.647 1.00 0.00 O ATOM 16986 H1 WAT 1827 115.301 137.331 78.964 1.00 0.00 H ATOM 16987 H2 WAT 1827 115.730 136.608 77.706 1.00 0.00 H TER 16989 WAT 1827 ATOM 16989 O WAT 1828 93.631 72.962 106.704 1.00 0.00 O ATOM 16990 H1 WAT 1828 93.216 73.825 106.684 1.00 0.00 H ATOM 16991 H2 WAT 1828 93.310 72.523 105.917 1.00 0.00 H TER 16993 WAT 1828 ATOM 16993 O WAT 1829 130.245 7.774 62.198 1.00 0.00 O ATOM 16994 H1 WAT 1829 129.365 7.434 62.362 1.00 0.00 H ATOM 16995 H2 WAT 1829 130.560 7.270 61.448 1.00 0.00 H TER 16997 WAT 1829 ATOM 16997 O WAT 1830 140.996 93.932 96.985 1.00 0.00 O ATOM 16998 H1 WAT 1830 141.672 93.296 97.215 1.00 0.00 H ATOM 16999 H2 WAT 1830 141.477 94.666 96.602 1.00 0.00 H TER 17001 WAT 1830 ATOM 17001 O WAT 1831 22.592 108.526 73.672 1.00 0.00 O ATOM 17002 H1 WAT 1831 22.095 108.604 74.486 1.00 0.00 H ATOM 17003 H2 WAT 1831 23.025 109.375 73.574 1.00 0.00 H TER 17005 WAT 1831 ATOM 17005 O WAT 1832 74.156 140.751 93.985 1.00 0.00 O ATOM 17006 H1 WAT 1832 74.361 140.512 93.082 1.00 0.00 H ATOM 17007 H2 WAT 1832 74.017 139.914 94.429 1.00 0.00 H TER 17009 WAT 1832 ATOM 17009 O WAT 1833 132.327 108.071 133.586 1.00 0.00 O ATOM 17010 H1 WAT 1833 133.236 107.942 133.316 1.00 0.00 H ATOM 17011 H2 WAT 1833 132.352 108.016 134.542 1.00 0.00 H TER 17013 WAT 1833 ATOM 17013 O WAT 1834 33.498 49.922 72.741 1.00 0.00 O ATOM 17014 H1 WAT 1834 33.929 50.549 72.160 1.00 0.00 H ATOM 17015 H2 WAT 1834 34.044 49.137 72.693 1.00 0.00 H TER 17017 WAT 1834 ATOM 17017 O WAT 1835 28.590 12.107 59.783 1.00 0.00 O ATOM 17018 H1 WAT 1835 28.437 13.019 59.539 1.00 0.00 H ATOM 17019 H2 WAT 1835 27.729 11.693 59.715 1.00 0.00 H TER 17021 WAT 1835 ATOM 17021 O WAT 1836 41.013 71.253 62.521 1.00 0.00 O ATOM 17022 H1 WAT 1836 41.736 70.725 62.181 1.00 0.00 H ATOM 17023 H2 WAT 1836 40.226 70.767 62.274 1.00 0.00 H TER 17025 WAT 1836 ATOM 17025 O WAT 1837 10.828 3.342 74.445 1.00 0.00 O ATOM 17026 H1 WAT 1837 10.812 3.087 73.522 1.00 0.00 H ATOM 17027 H2 WAT 1837 10.550 4.258 74.444 1.00 0.00 H TER 17029 WAT 1837 ATOM 17029 O WAT 1838 138.496 41.667 151.541 1.00 0.00 O ATOM 17030 H1 WAT 1838 137.767 41.070 151.709 1.00 0.00 H ATOM 17031 H2 WAT 1838 139.276 41.117 151.609 1.00 0.00 H TER 17033 WAT 1838 ATOM 17033 O WAT 1839 35.514 128.098 131.483 1.00 0.00 O ATOM 17034 H1 WAT 1839 36.276 127.708 131.054 1.00 0.00 H ATOM 17035 H2 WAT 1839 35.719 129.031 131.534 1.00 0.00 H TER 17037 WAT 1839 ATOM 17037 O WAT 1840 90.423 5.455 82.685 1.00 0.00 O ATOM 17038 H1 WAT 1840 89.641 5.936 82.956 1.00 0.00 H ATOM 17039 H2 WAT 1840 91.107 6.122 82.627 1.00 0.00 H TER 17041 WAT 1840 ATOM 17041 O WAT 1841 48.356 32.404 81.160 1.00 0.00 O ATOM 17042 H1 WAT 1841 48.545 32.348 80.223 1.00 0.00 H ATOM 17043 H2 WAT 1841 48.941 33.090 81.482 1.00 0.00 H TER 17045 WAT 1841 ATOM 17045 O WAT 1842 122.155 113.510 127.196 1.00 0.00 O ATOM 17046 H1 WAT 1842 121.637 113.406 126.398 1.00 0.00 H ATOM 17047 H2 WAT 1842 121.548 113.294 127.904 1.00 0.00 H TER 17049 WAT 1842 ATOM 17049 O WAT 1843 57.317 18.721 86.638 1.00 0.00 O ATOM 17050 H1 WAT 1843 57.553 19.558 86.238 1.00 0.00 H ATOM 17051 H2 WAT 1843 58.082 18.480 87.160 1.00 0.00 H TER 17053 WAT 1843 ATOM 17053 O WAT 1844 74.248 130.868 69.755 1.00 0.00 O ATOM 17054 H1 WAT 1844 74.402 131.055 70.681 1.00 0.00 H ATOM 17055 H2 WAT 1844 75.124 130.821 69.372 1.00 0.00 H TER 17057 WAT 1844 ATOM 17057 O WAT 1845 95.234 24.755 110.914 1.00 0.00 O ATOM 17058 H1 WAT 1845 96.075 25.011 111.294 1.00 0.00 H ATOM 17059 H2 WAT 1845 94.729 24.419 111.654 1.00 0.00 H TER 17061 WAT 1845 ATOM 17061 O WAT 1846 113.477 62.276 69.699 1.00 0.00 O ATOM 17062 H1 WAT 1846 113.441 63.187 69.989 1.00 0.00 H ATOM 17063 H2 WAT 1846 114.408 62.109 69.550 1.00 0.00 H TER 17065 WAT 1846 ATOM 17065 O WAT 1847 126.912 41.167 145.661 1.00 0.00 O ATOM 17066 H1 WAT 1847 126.367 41.072 144.880 1.00 0.00 H ATOM 17067 H2 WAT 1847 127.801 40.987 145.356 1.00 0.00 H TER 17069 WAT 1847 ATOM 17069 O WAT 1848 86.727 91.877 22.249 1.00 0.00 O ATOM 17070 H1 WAT 1848 86.653 91.915 23.202 1.00 0.00 H ATOM 17071 H2 WAT 1848 87.666 91.956 22.078 1.00 0.00 H TER 17073 WAT 1848 ATOM 17073 O WAT 1849 83.555 31.740 72.509 1.00 0.00 O ATOM 17074 H1 WAT 1849 84.209 31.943 71.840 1.00 0.00 H ATOM 17075 H2 WAT 1849 83.197 32.591 72.760 1.00 0.00 H TER 17077 WAT 1849 ATOM 17077 O WAT 1850 15.635 19.206 131.942 1.00 0.00 O ATOM 17078 H1 WAT 1850 14.875 18.870 131.466 1.00 0.00 H ATOM 17079 H2 WAT 1850 15.299 19.960 132.427 1.00 0.00 H TER 17081 WAT 1850 ATOM 17081 O WAT 1851 91.807 32.928 96.894 1.00 0.00 O ATOM 17082 H1 WAT 1851 92.136 33.177 97.758 1.00 0.00 H ATOM 17083 H2 WAT 1851 91.239 32.176 97.061 1.00 0.00 H TER 17085 WAT 1851 ATOM 17085 O WAT 1852 69.443 132.604 117.586 1.00 0.00 O ATOM 17086 H1 WAT 1852 69.138 132.962 118.420 1.00 0.00 H ATOM 17087 H2 WAT 1852 70.385 132.485 117.708 1.00 0.00 H TER 17089 WAT 1852 ATOM 17089 O WAT 1853 84.010 39.415 76.398 1.00 0.00 O ATOM 17090 H1 WAT 1853 83.060 39.531 76.435 1.00 0.00 H ATOM 17091 H2 WAT 1853 84.216 38.880 77.164 1.00 0.00 H TER 17093 WAT 1853 ATOM 17093 O WAT 1854 21.539 87.981 13.517 1.00 0.00 O ATOM 17094 H1 WAT 1854 22.219 88.643 13.388 1.00 0.00 H ATOM 17095 H2 WAT 1854 20.950 88.366 14.166 1.00 0.00 H TER 17097 WAT 1854 ATOM 17097 O WAT 1855 30.312 117.262 9.914 1.00 0.00 O ATOM 17098 H1 WAT 1855 31.022 116.776 10.333 1.00 0.00 H ATOM 17099 H2 WAT 1855 29.735 117.512 10.635 1.00 0.00 H TER 17101 WAT 1855 ATOM 17101 O WAT 1856 99.999 106.370 146.222 1.00 0.00 O ATOM 17102 H1 WAT 1856 99.819 107.264 145.932 1.00 0.00 H ATOM 17103 H2 WAT 1856 99.900 105.837 145.434 1.00 0.00 H TER 17105 WAT 1856 ATOM 17105 O WAT 1857 17.247 79.714 138.803 1.00 0.00 O ATOM 17106 H1 WAT 1857 16.565 79.042 138.816 1.00 0.00 H ATOM 17107 H2 WAT 1857 16.880 80.418 138.268 1.00 0.00 H TER 17109 WAT 1857 ATOM 17109 O WAT 1858 18.763 80.898 140.834 1.00 0.00 O ATOM 17110 H1 WAT 1858 17.969 80.720 140.329 1.00 0.00 H ATOM 17111 H2 WAT 1858 18.699 81.826 141.062 1.00 0.00 H TER 17113 WAT 1858 ATOM 17113 O WAT 1859 59.035 70.868 22.841 1.00 0.00 O ATOM 17114 H1 WAT 1859 58.741 71.298 22.039 1.00 0.00 H ATOM 17115 H2 WAT 1859 59.981 71.013 22.858 1.00 0.00 H TER 17117 WAT 1859 ATOM 17117 O WAT 1860 106.414 81.936 72.862 1.00 0.00 O ATOM 17118 H1 WAT 1860 106.256 81.670 71.956 1.00 0.00 H ATOM 17119 H2 WAT 1860 106.034 82.812 72.924 1.00 0.00 H TER 17121 WAT 1860 ATOM 17121 O WAT 1861 143.636 115.778 96.253 1.00 0.00 O ATOM 17122 H1 WAT 1861 143.161 114.948 96.290 1.00 0.00 H ATOM 17123 H2 WAT 1861 144.544 115.543 96.444 1.00 0.00 H TER 17125 WAT 1861 ATOM 17125 O WAT 1862 52.482 0.782 10.618 1.00 0.00 O ATOM 17126 H1 WAT 1862 51.966 1.446 10.162 1.00 0.00 H ATOM 17127 H2 WAT 1862 53.287 0.710 10.105 1.00 0.00 H TER 17129 WAT 1862 ATOM 17129 O WAT 1863 60.889 58.422 141.944 1.00 0.00 O ATOM 17130 H1 WAT 1863 60.909 58.660 142.871 1.00 0.00 H ATOM 17131 H2 WAT 1863 61.809 58.296 141.710 1.00 0.00 H TER 17133 WAT 1863 ATOM 17133 O WAT 1864 110.318 33.073 72.217 1.00 0.00 O ATOM 17134 H1 WAT 1864 110.808 33.490 72.926 1.00 0.00 H ATOM 17135 H2 WAT 1864 110.990 32.662 71.672 1.00 0.00 H TER 17137 WAT 1864 ATOM 17137 O WAT 1865 76.869 30.521 116.268 1.00 0.00 O ATOM 17138 H1 WAT 1865 76.265 29.981 115.757 1.00 0.00 H ATOM 17139 H2 WAT 1865 76.344 31.272 116.544 1.00 0.00 H TER 17141 WAT 1865 ATOM 17141 O WAT 1866 22.921 81.753 11.330 1.00 0.00 O ATOM 17142 H1 WAT 1866 22.948 81.193 12.105 1.00 0.00 H ATOM 17143 H2 WAT 1866 23.530 81.343 10.716 1.00 0.00 H TER 17145 WAT 1866 ATOM 17145 O WAT 1867 108.915 113.318 150.145 1.00 0.00 O ATOM 17146 H1 WAT 1867 108.458 114.025 150.600 1.00 0.00 H ATOM 17147 H2 WAT 1867 108.432 113.209 149.326 1.00 0.00 H TER 17149 WAT 1867 ATOM 17149 O WAT 1868 114.973 78.251 152.855 1.00 0.00 O ATOM 17150 H1 WAT 1868 115.753 78.036 153.367 1.00 0.00 H ATOM 17151 H2 WAT 1868 114.287 77.691 153.218 1.00 0.00 H TER 17153 WAT 1868 ATOM 17153 O WAT 1869 90.108 104.269 152.770 1.00 0.00 O ATOM 17154 H1 WAT 1869 90.323 103.503 152.239 1.00 0.00 H ATOM 17155 H2 WAT 1869 89.740 103.907 153.576 1.00 0.00 H TER 17157 WAT 1869 ATOM 17157 O WAT 1870 66.095 134.725 62.316 1.00 0.00 O ATOM 17158 H1 WAT 1870 66.822 134.204 62.657 1.00 0.00 H ATOM 17159 H2 WAT 1870 66.290 134.828 61.385 1.00 0.00 H TER 17161 WAT 1870 ATOM 17161 O WAT 1871 24.078 107.665 63.030 1.00 0.00 O ATOM 17162 H1 WAT 1871 23.766 108.570 63.040 1.00 0.00 H ATOM 17163 H2 WAT 1871 24.791 107.651 63.669 1.00 0.00 H TER 17165 WAT 1871 ATOM 17165 O WAT 1872 40.617 36.547 153.279 1.00 0.00 O ATOM 17166 H1 WAT 1872 41.320 36.103 152.806 1.00 0.00 H ATOM 17167 H2 WAT 1872 40.108 36.985 152.597 1.00 0.00 H TER 17169 WAT 1872 ATOM 17169 O WAT 1873 96.313 69.706 77.654 1.00 0.00 O ATOM 17170 H1 WAT 1873 96.434 69.414 76.751 1.00 0.00 H ATOM 17171 H2 WAT 1873 96.442 68.917 78.181 1.00 0.00 H TER 17173 WAT 1873 ATOM 17173 O WAT 1874 106.800 29.699 14.312 1.00 0.00 O ATOM 17174 H1 WAT 1874 107.593 29.887 13.810 1.00 0.00 H ATOM 17175 H2 WAT 1874 106.823 28.752 14.449 1.00 0.00 H TER 17177 WAT 1874 ATOM 17177 O WAT 1875 7.947 66.476 65.080 1.00 0.00 O ATOM 17178 H1 WAT 1875 8.846 66.794 64.993 1.00 0.00 H ATOM 17179 H2 WAT 1875 7.569 66.586 64.208 1.00 0.00 H TER 17181 WAT 1875 ATOM 17181 O WAT 1876 77.790 142.875 87.939 1.00 0.00 O ATOM 17182 H1 WAT 1876 78.201 143.074 88.781 1.00 0.00 H ATOM 17183 H2 WAT 1876 77.077 143.509 87.864 1.00 0.00 H TER 17185 WAT 1876 ATOM 17185 O WAT 1877 96.501 78.462 71.002 1.00 0.00 O ATOM 17186 H1 WAT 1877 95.705 78.090 70.622 1.00 0.00 H ATOM 17187 H2 WAT 1877 96.274 79.373 71.189 1.00 0.00 H TER 17189 WAT 1877 ATOM 17189 O WAT 1878 100.397 3.418 70.788 1.00 0.00 O ATOM 17190 H1 WAT 1878 101.240 2.998 70.954 1.00 0.00 H ATOM 17191 H2 WAT 1878 99.750 2.733 70.958 1.00 0.00 H TER 17193 WAT 1878 ATOM 17193 O WAT 1879 15.380 141.386 157.205 1.00 0.00 O ATOM 17194 H1 WAT 1879 15.510 140.485 157.502 1.00 0.00 H ATOM 17195 H2 WAT 1879 15.604 141.924 157.965 1.00 0.00 H TER 17197 WAT 1879 ATOM 17197 O WAT 1880 21.646 36.224 90.283 1.00 0.00 O ATOM 17198 H1 WAT 1880 21.746 37.158 90.101 1.00 0.00 H ATOM 17199 H2 WAT 1880 20.736 36.032 90.056 1.00 0.00 H TER 17201 WAT 1880 ATOM 17201 O WAT 1881 142.706 52.082 3.756 1.00 0.00 O ATOM 17202 H1 WAT 1881 143.481 52.526 4.100 1.00 0.00 H ATOM 17203 H2 WAT 1881 141.968 52.569 4.123 1.00 0.00 H TER 17205 WAT 1881 ATOM 17205 O WAT 1882 62.419 44.932 114.979 1.00 0.00 O ATOM 17206 H1 WAT 1882 62.319 44.032 114.670 1.00 0.00 H ATOM 17207 H2 WAT 1882 62.960 45.355 114.311 1.00 0.00 H TER 17209 WAT 1882 ATOM 17209 O WAT 1883 142.000 116.283 135.890 1.00 0.00 O ATOM 17210 H1 WAT 1883 142.164 117.065 136.416 1.00 0.00 H ATOM 17211 H2 WAT 1883 142.485 116.434 135.079 1.00 0.00 H TER 17213 WAT 1883 ATOM 17213 O WAT 1884 113.099 22.707 68.648 1.00 0.00 O ATOM 17214 H1 WAT 1884 112.885 21.863 69.045 1.00 0.00 H ATOM 17215 H2 WAT 1884 112.296 23.222 68.730 1.00 0.00 H TER 17217 WAT 1884 ATOM 17217 O WAT 1885 116.747 63.025 9.079 1.00 0.00 O ATOM 17218 H1 WAT 1885 116.025 62.836 9.678 1.00 0.00 H ATOM 17219 H2 WAT 1885 116.559 62.497 8.303 1.00 0.00 H TER 17221 WAT 1885 ATOM 17221 O WAT 1886 43.093 7.028 153.415 1.00 0.00 O ATOM 17222 H1 WAT 1886 42.694 7.704 152.868 1.00 0.00 H ATOM 17223 H2 WAT 1886 42.392 6.392 153.560 1.00 0.00 H TER 17225 WAT 1886 ATOM 17225 O WAT 1887 41.045 53.811 151.725 1.00 0.00 O ATOM 17226 H1 WAT 1887 41.968 54.024 151.864 1.00 0.00 H ATOM 17227 H2 WAT 1887 41.034 52.862 151.606 1.00 0.00 H TER 17229 WAT 1887 ATOM 17229 O WAT 1888 121.201 34.858 95.448 1.00 0.00 O ATOM 17230 H1 WAT 1888 121.621 35.199 94.658 1.00 0.00 H ATOM 17231 H2 WAT 1888 120.418 34.411 95.129 1.00 0.00 H TER 17233 WAT 1888 ATOM 17233 O WAT 1889 118.994 25.864 72.427 1.00 0.00 O ATOM 17234 H1 WAT 1889 118.396 25.244 72.009 1.00 0.00 H ATOM 17235 H2 WAT 1889 119.426 25.354 73.113 1.00 0.00 H TER 17237 WAT 1889 ATOM 17237 O WAT 1890 141.128 38.466 140.166 1.00 0.00 O ATOM 17238 H1 WAT 1890 140.521 38.674 139.455 1.00 0.00 H ATOM 17239 H2 WAT 1890 141.021 39.184 140.790 1.00 0.00 H TER 17241 WAT 1890 ATOM 17241 O WAT 1891 25.935 117.719 94.627 1.00 0.00 O ATOM 17242 H1 WAT 1891 25.430 116.913 94.735 1.00 0.00 H ATOM 17243 H2 WAT 1891 26.815 117.492 94.928 1.00 0.00 H TER 17245 WAT 1891 ATOM 17245 O WAT 1892 7.910 112.816 56.221 1.00 0.00 O ATOM 17246 H1 WAT 1892 8.302 112.804 57.094 1.00 0.00 H ATOM 17247 H2 WAT 1892 7.256 112.117 56.242 1.00 0.00 H TER 17249 WAT 1892 ATOM 17249 O WAT 1893 138.203 132.055 10.807 1.00 0.00 O ATOM 17250 H1 WAT 1893 137.971 131.672 9.961 1.00 0.00 H ATOM 17251 H2 WAT 1893 137.395 132.468 11.112 1.00 0.00 H TER 17253 WAT 1893 ATOM 17253 O WAT 1894 50.140 76.334 129.991 1.00 0.00 O ATOM 17254 H1 WAT 1894 49.433 76.961 130.148 1.00 0.00 H ATOM 17255 H2 WAT 1894 49.701 75.564 129.630 1.00 0.00 H TER 17257 WAT 1894 ATOM 17257 O WAT 1895 8.819 93.291 148.313 1.00 0.00 O ATOM 17258 H1 WAT 1895 9.078 93.717 149.129 1.00 0.00 H ATOM 17259 H2 WAT 1895 7.899 93.063 148.443 1.00 0.00 H TER 17261 WAT 1895 ATOM 17261 O WAT 1896 39.742 64.515 110.622 1.00 0.00 O ATOM 17262 H1 WAT 1896 39.899 63.610 110.894 1.00 0.00 H ATOM 17263 H2 WAT 1896 38.793 64.569 110.508 1.00 0.00 H TER 17265 WAT 1896 ATOM 17265 O WAT 1897 89.672 74.958 102.196 1.00 0.00 O ATOM 17266 H1 WAT 1897 89.884 75.883 102.070 1.00 0.00 H ATOM 17267 H2 WAT 1897 90.334 74.489 101.688 1.00 0.00 H TER 17269 WAT 1897 ATOM 17269 O WAT 1898 70.354 78.148 28.908 1.00 0.00 O ATOM 17270 H1 WAT 1898 70.732 77.385 28.471 1.00 0.00 H ATOM 17271 H2 WAT 1898 71.078 78.771 28.971 1.00 0.00 H TER 17273 WAT 1898 ATOM 17273 O WAT 1899 145.175 111.549 115.209 1.00 0.00 O ATOM 17274 H1 WAT 1899 145.677 112.041 115.859 1.00 0.00 H ATOM 17275 H2 WAT 1899 145.836 111.186 114.620 1.00 0.00 H TER 17277 WAT 1899 ATOM 17277 O WAT 1900 83.646 57.757 117.987 1.00 0.00 O ATOM 17278 H1 WAT 1900 84.315 58.006 118.625 1.00 0.00 H ATOM 17279 H2 WAT 1900 82.866 58.243 118.256 1.00 0.00 H TER 17281 WAT 1900 ATOM 17281 O WAT 1901 115.145 8.358 124.813 1.00 0.00 O ATOM 17282 H1 WAT 1901 115.780 9.073 124.776 1.00 0.00 H ATOM 17283 H2 WAT 1901 115.646 7.579 124.572 1.00 0.00 H TER 17285 WAT 1901 ATOM 17285 O WAT 1902 65.525 20.102 70.084 1.00 0.00 O ATOM 17286 H1 WAT 1902 65.564 20.599 69.267 1.00 0.00 H ATOM 17287 H2 WAT 1902 64.602 20.128 70.337 1.00 0.00 H TER 17289 WAT 1902 ATOM 17289 O WAT 1903 58.018 37.479 88.197 1.00 0.00 O ATOM 17290 H1 WAT 1903 57.765 38.055 88.919 1.00 0.00 H ATOM 17291 H2 WAT 1903 57.252 37.465 87.623 1.00 0.00 H TER 17293 WAT 1903 ATOM 17293 O WAT 1904 65.898 64.461 4.711 1.00 0.00 O ATOM 17294 H1 WAT 1904 66.628 63.843 4.660 1.00 0.00 H ATOM 17295 H2 WAT 1904 66.075 65.097 4.018 1.00 0.00 H TER 17297 WAT 1904 ATOM 17297 O WAT 1905 72.577 51.137 116.515 1.00 0.00 O ATOM 17298 H1 WAT 1905 71.626 51.210 116.441 1.00 0.00 H ATOM 17299 H2 WAT 1905 72.715 50.410 117.122 1.00 0.00 H TER 17301 WAT 1905 ATOM 17301 O WAT 1906 79.649 34.890 143.253 1.00 0.00 O ATOM 17302 H1 WAT 1906 80.061 35.750 143.335 1.00 0.00 H ATOM 17303 H2 WAT 1906 79.558 34.581 144.155 1.00 0.00 H TER 17305 WAT 1906 ATOM 17305 O WAT 1907 22.719 130.072 119.325 1.00 0.00 O ATOM 17306 H1 WAT 1907 22.449 130.794 119.893 1.00 0.00 H ATOM 17307 H2 WAT 1907 23.299 129.542 119.871 1.00 0.00 H TER 17309 WAT 1907 ATOM 17309 O WAT 1908 53.919 142.959 121.445 1.00 0.00 O ATOM 17310 H1 WAT 1908 53.069 142.521 121.496 1.00 0.00 H ATOM 17311 H2 WAT 1908 53.853 143.684 122.065 1.00 0.00 H TER 17313 WAT 1908 ATOM 17313 O WAT 1909 112.921 42.183 88.814 1.00 0.00 O ATOM 17314 H1 WAT 1909 113.862 42.343 88.875 1.00 0.00 H ATOM 17315 H2 WAT 1909 112.820 41.257 89.035 1.00 0.00 H TER 17317 WAT 1909 ATOM 17317 O WAT 1910 94.793 110.831 149.267 1.00 0.00 O ATOM 17318 H1 WAT 1910 94.763 110.748 150.220 1.00 0.00 H ATOM 17319 H2 WAT 1910 95.725 110.897 149.062 1.00 0.00 H TER 17321 WAT 1910 ATOM 17321 O WAT 1911 142.448 23.300 140.237 1.00 0.00 O ATOM 17322 H1 WAT 1911 143.013 22.529 140.189 1.00 0.00 H ATOM 17323 H2 WAT 1911 141.699 23.015 140.759 1.00 0.00 H TER 17325 WAT 1911 ATOM 17325 O WAT 1912 109.453 110.528 85.988 1.00 0.00 O ATOM 17326 H1 WAT 1912 109.289 111.273 86.565 1.00 0.00 H ATOM 17327 H2 WAT 1912 109.162 110.824 85.125 1.00 0.00 H TER 17329 WAT 1912 ATOM 17329 O WAT 1913 132.851 14.588 98.116 1.00 0.00 O ATOM 17330 H1 WAT 1913 133.224 13.928 98.700 1.00 0.00 H ATOM 17331 H2 WAT 1913 131.908 14.422 98.138 1.00 0.00 H TER 17333 WAT 1913 ATOM 17333 O WAT 1914 127.887 118.678 152.950 1.00 0.00 O ATOM 17334 H1 WAT 1914 128.091 117.799 152.631 1.00 0.00 H ATOM 17335 H2 WAT 1914 126.979 118.824 152.684 1.00 0.00 H TER 17337 WAT 1914 ATOM 17337 O WAT 1915 35.088 35.066 144.013 1.00 0.00 O ATOM 17338 H1 WAT 1915 34.879 35.645 144.747 1.00 0.00 H ATOM 17339 H2 WAT 1915 34.237 34.836 143.640 1.00 0.00 H TER 17341 WAT 1915 ATOM 17341 O WAT 1916 37.446 20.741 119.682 1.00 0.00 O ATOM 17342 H1 WAT 1916 37.864 21.249 120.377 1.00 0.00 H ATOM 17343 H2 WAT 1916 36.622 21.198 119.514 1.00 0.00 H TER 17345 WAT 1916 ATOM 17345 O WAT 1917 126.537 42.983 133.067 1.00 0.00 O ATOM 17346 H1 WAT 1917 125.752 43.486 133.284 1.00 0.00 H ATOM 17347 H2 WAT 1917 127.023 42.930 133.890 1.00 0.00 H TER 17349 WAT 1917 ATOM 17349 O WAT 1918 130.256 23.017 66.981 1.00 0.00 O ATOM 17350 H1 WAT 1918 130.324 22.471 66.198 1.00 0.00 H ATOM 17351 H2 WAT 1918 131.047 22.818 67.481 1.00 0.00 H TER 17353 WAT 1918 ATOM 17353 O WAT 1919 14.811 135.263 112.862 1.00 0.00 O ATOM 17354 H1 WAT 1919 15.579 135.377 113.421 1.00 0.00 H ATOM 17355 H2 WAT 1919 15.166 134.968 112.023 1.00 0.00 H TER 17357 WAT 1919 ATOM 17357 O WAT 1920 58.785 44.189 58.772 1.00 0.00 O ATOM 17358 H1 WAT 1920 58.426 43.471 59.294 1.00 0.00 H ATOM 17359 H2 WAT 1920 59.727 44.022 58.749 1.00 0.00 H TER 17361 WAT 1920 ATOM 17361 O WAT 1921 92.588 43.254 90.392 1.00 0.00 O ATOM 17362 H1 WAT 1921 92.852 42.363 90.165 1.00 0.00 H ATOM 17363 H2 WAT 1921 93.404 43.754 90.391 1.00 0.00 H TER 17365 WAT 1921 ATOM 17365 O WAT 1922 112.657 36.466 116.106 1.00 0.00 O ATOM 17366 H1 WAT 1922 112.556 37.276 115.606 1.00 0.00 H ATOM 17367 H2 WAT 1922 112.005 35.872 115.734 1.00 0.00 H TER 17369 WAT 1922 ATOM 17369 O WAT 1923 48.443 28.261 11.236 1.00 0.00 O ATOM 17370 H1 WAT 1923 48.459 27.502 11.819 1.00 0.00 H ATOM 17371 H2 WAT 1923 47.931 28.917 11.710 1.00 0.00 H TER 17373 WAT 1923 ATOM 17373 O WAT 1924 107.834 3.569 150.499 1.00 0.00 O ATOM 17374 H1 WAT 1924 108.172 3.383 151.375 1.00 0.00 H ATOM 17375 H2 WAT 1924 108.428 3.105 149.909 1.00 0.00 H TER 17377 WAT 1924 ATOM 17377 O WAT 1925 117.375 35.513 152.282 1.00 0.00 O ATOM 17378 H1 WAT 1925 116.958 35.767 151.458 1.00 0.00 H ATOM 17379 H2 WAT 1925 117.662 36.340 152.669 1.00 0.00 H TER 17381 WAT 1925 ATOM 17381 O WAT 1926 55.700 58.430 100.222 1.00 0.00 O ATOM 17382 H1 WAT 1926 55.002 59.002 100.542 1.00 0.00 H ATOM 17383 H2 WAT 1926 55.639 57.648 100.770 1.00 0.00 H TER 17385 WAT 1926 ATOM 17385 O WAT 1927 37.698 98.547 118.423 1.00 0.00 O ATOM 17386 H1 WAT 1927 38.389 97.912 118.614 1.00 0.00 H ATOM 17387 H2 WAT 1927 38.106 99.170 117.821 1.00 0.00 H TER 17389 WAT 1927 ATOM 17389 O WAT 1928 99.035 34.316 22.764 1.00 0.00 O ATOM 17390 H1 WAT 1928 99.902 34.026 22.480 1.00 0.00 H ATOM 17391 H2 WAT 1928 98.524 33.510 22.835 1.00 0.00 H TER 17393 WAT 1928 ATOM 17393 O WAT 1929 91.567 96.525 158.147 1.00 0.00 O ATOM 17394 H1 WAT 1929 90.747 96.948 157.896 1.00 0.00 H ATOM 17395 H2 WAT 1929 91.640 96.683 159.089 1.00 0.00 H TER 17397 WAT 1929 ATOM 17397 O WAT 1930 11.624 59.594 8.305 1.00 0.00 O ATOM 17398 H1 WAT 1930 12.422 59.262 7.893 1.00 0.00 H ATOM 17399 H2 WAT 1930 11.767 60.538 8.376 1.00 0.00 H TER 17401 WAT 1930 ATOM 17401 O WAT 1931 60.412 25.947 110.384 1.00 0.00 O ATOM 17402 H1 WAT 1931 60.150 25.386 109.655 1.00 0.00 H ATOM 17403 H2 WAT 1931 60.337 25.387 111.157 1.00 0.00 H TER 17405 WAT 1931 ATOM 17405 O WAT 1932 18.422 2.468 84.797 1.00 0.00 O ATOM 17406 H1 WAT 1932 18.053 1.849 84.167 1.00 0.00 H ATOM 17407 H2 WAT 1932 18.652 1.930 85.555 1.00 0.00 H TER 17409 WAT 1932 ATOM 17409 O WAT 1933 31.967 111.930 6.274 1.00 0.00 O ATOM 17410 H1 WAT 1933 31.154 111.702 5.823 1.00 0.00 H ATOM 17411 H2 WAT 1933 31.692 112.169 7.159 1.00 0.00 H TER 17413 WAT 1933 ATOM 17413 O WAT 1934 133.967 138.335 127.161 1.00 0.00 O ATOM 17414 H1 WAT 1934 134.799 138.127 126.735 1.00 0.00 H ATOM 17415 H2 WAT 1934 133.335 138.381 126.443 1.00 0.00 H TER 17417 WAT 1934 ATOM 17417 O WAT 1935 23.908 22.520 138.287 1.00 0.00 O ATOM 17418 H1 WAT 1935 23.428 22.046 137.608 1.00 0.00 H ATOM 17419 H2 WAT 1935 24.517 21.873 138.645 1.00 0.00 H TER 17421 WAT 1935 ATOM 17421 O WAT 1936 37.456 110.678 126.543 1.00 0.00 O ATOM 17422 H1 WAT 1936 37.797 110.596 127.434 1.00 0.00 H ATOM 17423 H2 WAT 1936 36.565 111.008 126.657 1.00 0.00 H TER 17425 WAT 1936 ATOM 17425 O WAT 1937 69.790 103.803 61.694 1.00 0.00 O ATOM 17426 H1 WAT 1937 69.233 103.929 60.926 1.00 0.00 H ATOM 17427 H2 WAT 1937 70.518 103.269 61.377 1.00 0.00 H TER 17429 WAT 1937 ATOM 17429 O WAT 1938 87.653 40.334 115.039 1.00 0.00 O ATOM 17430 H1 WAT 1938 88.544 40.554 115.309 1.00 0.00 H ATOM 17431 H2 WAT 1938 87.248 41.177 114.836 1.00 0.00 H TER 17433 WAT 1938 ATOM 17433 O WAT 1939 51.345 85.429 153.982 1.00 0.00 O ATOM 17434 H1 WAT 1939 51.949 86.141 153.772 1.00 0.00 H ATOM 17435 H2 WAT 1939 51.831 84.875 154.593 1.00 0.00 H TER 17437 WAT 1939 ATOM 17437 O WAT 1940 121.456 132.440 70.398 1.00 0.00 O ATOM 17438 H1 WAT 1940 120.937 132.084 69.676 1.00 0.00 H ATOM 17439 H2 WAT 1940 120.889 133.100 70.798 1.00 0.00 H TER 17441 WAT 1940 ATOM 17441 O WAT 1941 63.752 57.167 67.974 1.00 0.00 O ATOM 17442 H1 WAT 1941 62.919 57.455 67.602 1.00 0.00 H ATOM 17443 H2 WAT 1941 64.229 56.794 67.233 1.00 0.00 H TER 17445 WAT 1941 ATOM 17445 O WAT 1942 121.113 21.425 67.983 1.00 0.00 O ATOM 17446 H1 WAT 1942 120.623 20.617 67.827 1.00 0.00 H ATOM 17447 H2 WAT 1942 120.899 21.664 68.884 1.00 0.00 H TER 17449 WAT 1942 ATOM 17449 O WAT 1943 92.230 73.584 64.193 1.00 0.00 O ATOM 17450 H1 WAT 1943 91.896 72.797 63.761 1.00 0.00 H ATOM 17451 H2 WAT 1943 91.992 74.300 63.604 1.00 0.00 H TER 17453 WAT 1943 ATOM 17453 O WAT 1944 36.621 95.361 136.887 1.00 0.00 O ATOM 17454 H1 WAT 1944 36.154 95.475 137.714 1.00 0.00 H ATOM 17455 H2 WAT 1944 37.381 95.938 136.959 1.00 0.00 H TER 17457 WAT 1944 ATOM 17457 O WAT 1945 85.778 34.180 121.224 1.00 0.00 O ATOM 17458 H1 WAT 1945 85.657 33.233 121.300 1.00 0.00 H ATOM 17459 H2 WAT 1945 84.917 34.548 121.422 1.00 0.00 H TER 17461 WAT 1945 ATOM 17461 O WAT 1946 82.505 109.860 31.058 1.00 0.00 O ATOM 17462 H1 WAT 1946 82.734 108.977 31.349 1.00 0.00 H ATOM 17463 H2 WAT 1946 82.568 109.822 30.103 1.00 0.00 H TER 17465 WAT 1946 ATOM 17465 O WAT 1947 15.769 123.711 89.573 1.00 0.00 O ATOM 17466 H1 WAT 1947 16.356 124.461 89.674 1.00 0.00 H ATOM 17467 H2 WAT 1947 16.075 123.273 88.779 1.00 0.00 H TER 17469 WAT 1947 ATOM 17469 O WAT 1948 101.359 75.550 87.485 1.00 0.00 O ATOM 17470 H1 WAT 1948 102.126 74.978 87.455 1.00 0.00 H ATOM 17471 H2 WAT 1948 101.614 76.320 86.978 1.00 0.00 H TER 17473 WAT 1948 ATOM 17473 O WAT 1949 76.730 48.464 18.944 1.00 0.00 O ATOM 17474 H1 WAT 1949 76.761 47.845 19.673 1.00 0.00 H ATOM 17475 H2 WAT 1949 76.872 49.319 19.349 1.00 0.00 H TER 17477 WAT 1949 ATOM 17477 O WAT 1950 44.025 110.900 125.762 1.00 0.00 O ATOM 17478 H1 WAT 1950 43.799 110.281 125.068 1.00 0.00 H ATOM 17479 H2 WAT 1950 43.619 111.723 125.490 1.00 0.00 H TER 17481 WAT 1950 ATOM 17481 O WAT 1951 136.719 134.121 155.230 1.00 0.00 O ATOM 17482 H1 WAT 1951 136.081 134.431 154.587 1.00 0.00 H ATOM 17483 H2 WAT 1951 136.374 133.276 155.521 1.00 0.00 H TER 17485 WAT 1951 ATOM 17485 O WAT 1952 43.017 128.700 117.886 1.00 0.00 O ATOM 17486 H1 WAT 1952 43.160 129.086 117.022 1.00 0.00 H ATOM 17487 H2 WAT 1952 43.724 129.054 118.426 1.00 0.00 H TER 17489 WAT 1952 ATOM 17489 O WAT 1953 96.333 58.451 152.405 1.00 0.00 O ATOM 17490 H1 WAT 1953 95.691 59.141 152.567 1.00 0.00 H ATOM 17491 H2 WAT 1953 96.330 58.339 151.454 1.00 0.00 H TER 17493 WAT 1953 ATOM 17493 O WAT 1954 65.522 40.046 151.256 1.00 0.00 O ATOM 17494 H1 WAT 1954 65.050 39.216 151.184 1.00 0.00 H ATOM 17495 H2 WAT 1954 64.893 40.705 150.964 1.00 0.00 H TER 17497 WAT 1954 ATOM 17497 O WAT 1955 17.503 130.709 16.924 1.00 0.00 O ATOM 17498 H1 WAT 1955 17.096 131.360 17.495 1.00 0.00 H ATOM 17499 H2 WAT 1955 17.050 130.808 16.086 1.00 0.00 H TER 17501 WAT 1955 ATOM 17501 O WAT 1956 81.136 140.320 121.131 1.00 0.00 O ATOM 17502 H1 WAT 1956 80.887 139.503 121.562 1.00 0.00 H ATOM 17503 H2 WAT 1956 80.432 140.931 121.349 1.00 0.00 H TER 17505 WAT 1956 ATOM 17505 O WAT 1957 116.774 107.247 96.928 1.00 0.00 O ATOM 17506 H1 WAT 1957 116.129 107.851 97.297 1.00 0.00 H ATOM 17507 H2 WAT 1957 116.661 107.327 95.980 1.00 0.00 H TER 17509 WAT 1957 ATOM 17509 O WAT 1958 122.968 96.210 118.614 1.00 0.00 O ATOM 17510 H1 WAT 1958 122.753 97.138 118.710 1.00 0.00 H ATOM 17511 H2 WAT 1958 122.134 95.757 118.735 1.00 0.00 H TER 17513 WAT 1958 ATOM 17513 O WAT 1959 133.729 34.128 138.545 1.00 0.00 O ATOM 17514 H1 WAT 1959 134.219 33.435 138.102 1.00 0.00 H ATOM 17515 H2 WAT 1959 134.218 34.928 138.353 1.00 0.00 H TER 17517 WAT 1959 ATOM 17517 O WAT 1960 131.958 31.812 19.393 1.00 0.00 O ATOM 17518 H1 WAT 1960 132.710 31.219 19.397 1.00 0.00 H ATOM 17519 H2 WAT 1960 131.333 31.411 19.996 1.00 0.00 H TER 17521 WAT 1960 ATOM 17521 O WAT 1961 58.100 76.252 155.701 1.00 0.00 O ATOM 17522 H1 WAT 1961 57.655 76.853 155.103 1.00 0.00 H ATOM 17523 H2 WAT 1961 58.909 76.705 155.938 1.00 0.00 H TER 17525 WAT 1961 ATOM 17525 O WAT 1962 18.318 53.866 84.415 1.00 0.00 O ATOM 17526 H1 WAT 1962 17.967 53.239 85.047 1.00 0.00 H ATOM 17527 H2 WAT 1962 18.952 53.362 83.904 1.00 0.00 H TER 17529 WAT 1962 ATOM 17529 O WAT 1963 16.039 15.861 135.373 1.00 0.00 O ATOM 17530 H1 WAT 1963 16.767 16.107 134.803 1.00 0.00 H ATOM 17531 H2 WAT 1963 16.456 15.463 136.137 1.00 0.00 H TER 17533 WAT 1963 ATOM 17533 O WAT 1964 11.282 26.503 90.003 1.00 0.00 O ATOM 17534 H1 WAT 1964 12.235 26.528 90.088 1.00 0.00 H ATOM 17535 H2 WAT 1964 10.996 27.377 90.267 1.00 0.00 H TER 17537 WAT 1964 ATOM 17537 O WAT 1965 4.115 10.201 136.447 1.00 0.00 O ATOM 17538 H1 WAT 1965 4.985 9.846 136.629 1.00 0.00 H ATOM 17539 H2 WAT 1965 3.793 10.496 137.299 1.00 0.00 H TER 17541 WAT 1965 ATOM 17541 O WAT 1966 111.567 74.199 150.563 1.00 0.00 O ATOM 17542 H1 WAT 1966 111.026 73.713 149.941 1.00 0.00 H ATOM 17543 H2 WAT 1966 111.426 75.118 150.334 1.00 0.00 H TER 17545 WAT 1966 ATOM 17545 O WAT 1967 99.268 91.403 21.973 1.00 0.00 O ATOM 17546 H1 WAT 1967 99.936 91.886 22.459 1.00 0.00 H ATOM 17547 H2 WAT 1967 98.633 91.138 22.639 1.00 0.00 H TER 17549 WAT 1967 ATOM 17549 O WAT 1968 82.327 129.835 7.552 1.00 0.00 O ATOM 17550 H1 WAT 1968 81.928 128.967 7.624 1.00 0.00 H ATOM 17551 H2 WAT 1968 82.382 129.995 6.610 1.00 0.00 H TER 17553 WAT 1968 ATOM 17553 O WAT 1969 81.248 0.481 9.772 1.00 0.00 O ATOM 17554 H1 WAT 1969 80.612 1.111 9.434 1.00 0.00 H ATOM 17555 H2 WAT 1969 82.050 0.664 9.284 1.00 0.00 H TER 17557 WAT 1969 ATOM 17557 O WAT 1970 51.190 22.529 83.856 1.00 0.00 O ATOM 17558 H1 WAT 1970 50.930 22.927 84.687 1.00 0.00 H ATOM 17559 H2 WAT 1970 52.146 22.500 83.892 1.00 0.00 H TER 17561 WAT 1970 ATOM 17561 O WAT 1971 81.325 122.014 105.650 1.00 0.00 O ATOM 17562 H1 WAT 1971 80.509 121.552 105.845 1.00 0.00 H ATOM 17563 H2 WAT 1971 81.125 122.935 105.819 1.00 0.00 H TER 17565 WAT 1971 ATOM 17565 O WAT 1972 40.156 38.062 82.068 1.00 0.00 O ATOM 17566 H1 WAT 1972 39.356 37.734 82.478 1.00 0.00 H ATOM 17567 H2 WAT 1972 40.368 37.409 81.400 1.00 0.00 H TER 17569 WAT 1972 ATOM 17569 O WAT 1973 143.543 24.448 7.941 1.00 0.00 O ATOM 17570 H1 WAT 1973 142.710 24.356 7.479 1.00 0.00 H ATOM 17571 H2 WAT 1973 144.116 23.799 7.533 1.00 0.00 H TER 17573 WAT 1973 ATOM 17573 O WAT 1974 43.099 94.399 141.839 1.00 0.00 O ATOM 17574 H1 WAT 1974 44.018 94.345 141.577 1.00 0.00 H ATOM 17575 H2 WAT 1974 42.694 94.960 141.177 1.00 0.00 H TER 17577 WAT 1974 ATOM 17577 O WAT 1975 108.654 91.372 98.234 1.00 0.00 O ATOM 17578 H1 WAT 1975 108.887 91.310 97.307 1.00 0.00 H ATOM 17579 H2 WAT 1975 108.691 92.308 98.428 1.00 0.00 H TER 17581 WAT 1975 ATOM 17581 O WAT 1976 10.055 130.371 91.996 1.00 0.00 O ATOM 17582 H1 WAT 1976 10.916 129.955 91.956 1.00 0.00 H ATOM 17583 H2 WAT 1976 10.060 131.003 91.278 1.00 0.00 H TER 17585 WAT 1976 ATOM 17585 O WAT 1977 37.471 108.428 6.956 1.00 0.00 O ATOM 17586 H1 WAT 1977 37.481 107.791 7.670 1.00 0.00 H ATOM 17587 H2 WAT 1977 38.386 108.497 6.684 1.00 0.00 H TER 17589 WAT 1977 ATOM 17589 O WAT 1978 127.981 18.220 116.628 1.00 0.00 O ATOM 17590 H1 WAT 1978 127.672 19.014 116.191 1.00 0.00 H ATOM 17591 H2 WAT 1978 127.716 18.331 117.541 1.00 0.00 H TER 17593 WAT 1978 ATOM 17593 O WAT 1979 85.263 125.040 15.443 1.00 0.00 O ATOM 17594 H1 WAT 1979 84.430 125.336 15.812 1.00 0.00 H ATOM 17595 H2 WAT 1979 85.929 125.459 15.988 1.00 0.00 H TER 17597 WAT 1979 ATOM 17597 O WAT 1980 108.666 22.547 75.204 1.00 0.00 O ATOM 17598 H1 WAT 1980 107.709 22.576 75.234 1.00 0.00 H ATOM 17599 H2 WAT 1980 108.867 21.700 74.806 1.00 0.00 H TER 17601 WAT 1980 ATOM 17601 O WAT 1981 7.593 102.160 18.520 1.00 0.00 O ATOM 17602 H1 WAT 1981 7.110 101.338 18.428 1.00 0.00 H ATOM 17603 H2 WAT 1981 7.434 102.431 19.424 1.00 0.00 H TER 17605 WAT 1981 ATOM 17605 O WAT 1982 103.690 41.234 1.045 1.00 0.00 O ATOM 17606 H1 WAT 1982 104.232 40.837 1.727 1.00 0.00 H ATOM 17607 H2 WAT 1982 103.517 42.120 1.363 1.00 0.00 H TER 17609 WAT 1982 ATOM 17609 O WAT 1983 130.478 51.018 149.002 1.00 0.00 O ATOM 17610 H1 WAT 1983 130.030 51.452 149.728 1.00 0.00 H ATOM 17611 H2 WAT 1983 130.369 50.083 149.178 1.00 0.00 H TER 17613 WAT 1983 ATOM 17613 O WAT 1984 65.609 39.774 114.246 1.00 0.00 O ATOM 17614 H1 WAT 1984 65.714 38.850 114.474 1.00 0.00 H ATOM 17615 H2 WAT 1984 65.836 40.244 115.048 1.00 0.00 H TER 17617 WAT 1984 ATOM 17617 O WAT 1985 36.578 65.903 20.680 1.00 0.00 O ATOM 17618 H1 WAT 1985 36.322 64.992 20.537 1.00 0.00 H ATOM 17619 H2 WAT 1985 35.919 66.414 20.208 1.00 0.00 H TER 17621 WAT 1985 ATOM 17621 O WAT 1986 11.047 36.619 138.662 1.00 0.00 O ATOM 17622 H1 WAT 1986 10.343 36.683 138.016 1.00 0.00 H ATOM 17623 H2 WAT 1986 11.298 37.527 138.833 1.00 0.00 H TER 17625 WAT 1986 ATOM 17625 O WAT 1987 7.037 29.800 73.582 1.00 0.00 O ATOM 17626 H1 WAT 1987 7.039 29.440 74.468 1.00 0.00 H ATOM 17627 H2 WAT 1987 7.687 30.502 73.607 1.00 0.00 H TER 17629 WAT 1987 ATOM 17629 O WAT 1988 68.523 104.374 141.342 1.00 0.00 O ATOM 17630 H1 WAT 1988 67.639 104.662 141.567 1.00 0.00 H ATOM 17631 H2 WAT 1988 68.477 103.418 141.365 1.00 0.00 H TER 17633 WAT 1988 ATOM 17633 O WAT 1989 69.154 145.575 147.244 1.00 0.00 O ATOM 17634 H1 WAT 1989 68.302 145.289 147.571 1.00 0.00 H ATOM 17635 H2 WAT 1989 69.788 145.147 147.820 1.00 0.00 H TER 17637 WAT 1989 ATOM 17637 O WAT 1990 75.789 24.990 73.350 1.00 0.00 O ATOM 17638 H1 WAT 1990 75.789 24.728 72.429 1.00 0.00 H ATOM 17639 H2 WAT 1990 75.118 25.670 73.406 1.00 0.00 H TER 17641 WAT 1990 ATOM 17641 O WAT 1991 100.793 50.116 127.832 1.00 0.00 O ATOM 17642 H1 WAT 1991 100.280 49.601 128.454 1.00 0.00 H ATOM 17643 H2 WAT 1991 101.062 50.891 128.326 1.00 0.00 H TER 17645 WAT 1991 ATOM 17645 O WAT 1992 9.535 1.898 150.613 1.00 0.00 O ATOM 17646 H1 WAT 1992 8.644 1.693 150.329 1.00 0.00 H ATOM 17647 H2 WAT 1992 9.782 2.662 150.091 1.00 0.00 H TER 17649 WAT 1992 ATOM 17649 O WAT 1993 7.487 112.047 96.914 1.00 0.00 O ATOM 17650 H1 WAT 1993 7.575 112.368 97.812 1.00 0.00 H ATOM 17651 H2 WAT 1993 8.020 111.252 96.892 1.00 0.00 H TER 17653 WAT 1993 ATOM 17653 O WAT 1994 66.934 47.353 104.352 1.00 0.00 O ATOM 17654 H1 WAT 1994 66.867 47.378 105.307 1.00 0.00 H ATOM 17655 H2 WAT 1994 67.874 47.296 104.179 1.00 0.00 H TER 17657 WAT 1994 ATOM 17657 O WAT 1995 35.272 72.727 73.355 1.00 0.00 O ATOM 17658 H1 WAT 1995 35.461 73.497 73.892 1.00 0.00 H ATOM 17659 H2 WAT 1995 34.695 73.051 72.665 1.00 0.00 H TER 17661 WAT 1995 ATOM 17661 O WAT 1996 37.394 82.227 153.025 1.00 0.00 O ATOM 17662 H1 WAT 1996 37.908 82.416 153.811 1.00 0.00 H ATOM 17663 H2 WAT 1996 37.798 82.763 152.342 1.00 0.00 H TER 17665 WAT 1996 ATOM 17665 O WAT 1997 23.496 88.333 138.321 1.00 0.00 O ATOM 17666 H1 WAT 1997 22.636 88.736 138.439 1.00 0.00 H ATOM 17667 H2 WAT 1997 23.395 87.776 137.549 1.00 0.00 H TER 17669 WAT 1997 ATOM 17669 O WAT 1998 28.358 128.801 59.593 1.00 0.00 O ATOM 17670 H1 WAT 1998 27.942 128.159 60.168 1.00 0.00 H ATOM 17671 H2 WAT 1998 28.672 128.288 58.849 1.00 0.00 H TER 17673 WAT 1998 ATOM 17673 O WAT 1999 125.740 64.077 107.432 1.00 0.00 O ATOM 17674 H1 WAT 1999 124.994 64.649 107.611 1.00 0.00 H ATOM 17675 H2 WAT 1999 125.472 63.221 107.765 1.00 0.00 H TER 17677 WAT 1999 ATOM 17677 O WAT 2000 129.368 17.330 11.209 1.00 0.00 O ATOM 17678 H1 WAT 2000 129.031 17.978 10.591 1.00 0.00 H ATOM 17679 H2 WAT 2000 128.825 16.555 11.064 1.00 0.00 H TER 17681 WAT 2000 ATOM 17681 O WAT 2001 93.946 70.810 13.541 1.00 0.00 O ATOM 17682 H1 WAT 2001 94.361 70.143 12.994 1.00 0.00 H ATOM 17683 H2 WAT 2001 94.666 71.191 14.043 1.00 0.00 H TER 17685 WAT 2001 ATOM 17685 O WAT 2002 95.911 102.883 154.786 1.00 0.00 O ATOM 17686 H1 WAT 2002 96.312 102.660 153.946 1.00 0.00 H ATOM 17687 H2 WAT 2002 96.532 102.564 155.441 1.00 0.00 H TER 17689 WAT 2002 ATOM 17689 O WAT 2003 97.080 11.540 19.267 1.00 0.00 O ATOM 17690 H1 WAT 2003 97.293 12.350 18.804 1.00 0.00 H ATOM 17691 H2 WAT 2003 97.275 10.846 18.638 1.00 0.00 H TER 17693 WAT 2003 ATOM 17693 O WAT 2004 67.555 33.879 80.786 1.00 0.00 O ATOM 17694 H1 WAT 2004 68.389 33.582 80.420 1.00 0.00 H ATOM 17695 H2 WAT 2004 67.470 34.784 80.486 1.00 0.00 H TER 17697 WAT 2004 ATOM 17697 O WAT 2005 0.710 104.096 157.185 1.00 0.00 O ATOM 17698 H1 WAT 2005 -0.103 103.764 157.565 1.00 0.00 H ATOM 17699 H2 WAT 2005 1.216 104.406 157.936 1.00 0.00 H TER 17701 WAT 2005 ATOM 17701 O WAT 2006 99.522 51.054 10.047 1.00 0.00 O ATOM 17702 H1 WAT 2006 99.328 50.554 10.840 1.00 0.00 H ATOM 17703 H2 WAT 2006 99.656 50.390 9.372 1.00 0.00 H TER 17705 WAT 2006 ATOM 17705 O WAT 2007 12.578 144.060 90.563 1.00 0.00 O ATOM 17706 H1 WAT 2007 11.784 144.563 90.746 1.00 0.00 H ATOM 17707 H2 WAT 2007 12.377 143.176 90.868 1.00 0.00 H TER 17709 WAT 2007 ATOM 17709 O WAT 2008 140.417 14.900 103.594 1.00 0.00 O ATOM 17710 H1 WAT 2008 140.825 14.349 104.263 1.00 0.00 H ATOM 17711 H2 WAT 2008 139.973 14.282 103.013 1.00 0.00 H TER 17713 WAT 2008 ATOM 17713 O WAT 2009 137.518 124.672 148.989 1.00 0.00 O ATOM 17714 H1 WAT 2009 136.976 125.456 149.078 1.00 0.00 H ATOM 17715 H2 WAT 2009 138.305 124.976 148.538 1.00 0.00 H TER 17717 WAT 2009 ATOM 17717 O WAT 2010 139.143 86.496 81.360 1.00 0.00 O ATOM 17718 H1 WAT 2010 139.781 87.111 81.000 1.00 0.00 H ATOM 17719 H2 WAT 2010 139.236 85.711 80.821 1.00 0.00 H TER 17721 WAT 2010 ATOM 17721 O WAT 2011 100.986 9.751 0.791 1.00 0.00 O ATOM 17722 H1 WAT 2011 101.071 10.042 -0.117 1.00 0.00 H ATOM 17723 H2 WAT 2011 101.879 9.777 1.135 1.00 0.00 H TER 17725 WAT 2011 ATOM 17725 O WAT 2012 27.098 112.404 75.380 1.00 0.00 O ATOM 17726 H1 WAT 2012 27.038 111.451 75.318 1.00 0.00 H ATOM 17727 H2 WAT 2012 26.731 112.611 76.240 1.00 0.00 H TER 17729 WAT 2012 ATOM 17729 O WAT 2013 70.253 140.017 71.229 1.00 0.00 O ATOM 17730 H1 WAT 2013 70.690 139.372 70.674 1.00 0.00 H ATOM 17731 H2 WAT 2013 69.330 139.764 71.208 1.00 0.00 H TER 17733 WAT 2013 ATOM 17733 O WAT 2014 36.712 116.333 59.690 1.00 0.00 O ATOM 17734 H1 WAT 2014 37.560 115.929 59.509 1.00 0.00 H ATOM 17735 H2 WAT 2014 36.552 116.903 58.938 1.00 0.00 H TER 17737 WAT 2014 ATOM 17737 O WAT 2015 38.723 30.273 11.414 1.00 0.00 O ATOM 17738 H1 WAT 2015 38.939 29.729 12.172 1.00 0.00 H ATOM 17739 H2 WAT 2015 37.808 30.067 11.225 1.00 0.00 H TER 17741 WAT 2015 ATOM 17741 O WAT 2016 60.528 126.099 66.759 1.00 0.00 O ATOM 17742 H1 WAT 2016 59.984 125.320 66.636 1.00 0.00 H ATOM 17743 H2 WAT 2016 60.800 126.342 65.874 1.00 0.00 H TER 17745 WAT 2016 ATOM 17745 O WAT 2017 125.160 56.796 94.058 1.00 0.00 O ATOM 17746 H1 WAT 2017 124.455 57.347 93.718 1.00 0.00 H ATOM 17747 H2 WAT 2017 124.714 56.021 94.400 1.00 0.00 H TER 17749 WAT 2017 ATOM 17749 O WAT 2018 68.528 7.136 61.875 1.00 0.00 O ATOM 17750 H1 WAT 2018 68.194 7.097 62.771 1.00 0.00 H ATOM 17751 H2 WAT 2018 69.250 7.763 61.916 1.00 0.00 H TER 17753 WAT 2018 ATOM 17753 O WAT 2019 24.502 54.519 156.310 1.00 0.00 O ATOM 17754 H1 WAT 2019 25.320 54.466 155.817 1.00 0.00 H ATOM 17755 H2 WAT 2019 24.225 53.608 156.414 1.00 0.00 H TER 17757 WAT 2019 ATOM 17757 O WAT 2020 1.280 134.378 88.808 1.00 0.00 O ATOM 17758 H1 WAT 2020 2.108 134.061 88.448 1.00 0.00 H ATOM 17759 H2 WAT 2020 1.267 134.048 89.706 1.00 0.00 H TER 17761 WAT 2020 ATOM 17761 O WAT 2021 83.084 37.014 96.819 1.00 0.00 O ATOM 17762 H1 WAT 2021 82.893 37.951 96.782 1.00 0.00 H ATOM 17763 H2 WAT 2021 82.445 36.663 97.440 1.00 0.00 H TER 17765 WAT 2021 ATOM 17765 O WAT 2022 83.579 1.776 100.039 1.00 0.00 O ATOM 17766 H1 WAT 2022 82.641 1.934 99.938 1.00 0.00 H ATOM 17767 H2 WAT 2022 83.669 0.824 99.985 1.00 0.00 H TER 17769 WAT 2022 ATOM 17769 O WAT 2023 7.159 116.832 59.887 1.00 0.00 O ATOM 17770 H1 WAT 2023 6.374 116.885 59.342 1.00 0.00 H ATOM 17771 H2 WAT 2023 7.841 117.256 59.367 1.00 0.00 H TER 17773 WAT 2023 ATOM 17773 O WAT 2024 124.275 62.660 70.983 1.00 0.00 O ATOM 17774 H1 WAT 2024 124.501 63.135 71.783 1.00 0.00 H ATOM 17775 H2 WAT 2024 123.387 62.952 70.774 1.00 0.00 H TER 17777 WAT 2024 ATOM 17777 O WAT 2025 44.413 61.108 136.562 1.00 0.00 O ATOM 17778 H1 WAT 2025 44.108 61.813 135.992 1.00 0.00 H ATOM 17779 H2 WAT 2025 43.661 60.520 136.640 1.00 0.00 H TER 17781 WAT 2025 ATOM 17781 O WAT 2026 20.487 9.739 106.532 1.00 0.00 O ATOM 17782 H1 WAT 2026 21.250 9.179 106.388 1.00 0.00 H ATOM 17783 H2 WAT 2026 19.784 9.317 106.038 1.00 0.00 H TER 17785 WAT 2026 ATOM 17785 O WAT 2027 49.753 43.548 86.942 1.00 0.00 O ATOM 17786 H1 WAT 2027 48.809 43.525 86.787 1.00 0.00 H ATOM 17787 H2 WAT 2027 49.852 43.293 87.859 1.00 0.00 H TER 17789 WAT 2027 ATOM 17789 O WAT 2028 80.513 51.486 71.986 1.00 0.00 O ATOM 17790 H1 WAT 2028 81.233 51.509 72.616 1.00 0.00 H ATOM 17791 H2 WAT 2028 80.943 51.461 71.131 1.00 0.00 H TER 17793 WAT 2028 ATOM 17793 O WAT 2029 42.598 63.360 88.423 1.00 0.00 O ATOM 17794 H1 WAT 2029 42.771 63.489 89.356 1.00 0.00 H ATOM 17795 H2 WAT 2029 42.308 62.450 88.357 1.00 0.00 H TER 17797 WAT 2029 ATOM 17797 O WAT 2030 80.207 120.914 82.399 1.00 0.00 O ATOM 17798 H1 WAT 2030 79.894 121.556 81.763 1.00 0.00 H ATOM 17799 H2 WAT 2030 81.109 121.178 82.583 1.00 0.00 H TER 17801 WAT 2030 ATOM 17801 O WAT 2031 38.633 133.806 110.735 1.00 0.00 O ATOM 17802 H1 WAT 2031 39.026 134.667 110.880 1.00 0.00 H ATOM 17803 H2 WAT 2031 39.378 133.207 110.693 1.00 0.00 H TER 17805 WAT 2031 ATOM 17805 O WAT 2032 102.716 108.916 71.260 1.00 0.00 O ATOM 17806 H1 WAT 2032 103.520 109.380 71.494 1.00 0.00 H ATOM 17807 H2 WAT 2032 102.536 109.187 70.359 1.00 0.00 H TER 17809 WAT 2032 ATOM 17809 O WAT 2033 79.793 15.751 136.961 1.00 0.00 O ATOM 17810 H1 WAT 2033 80.291 15.009 137.305 1.00 0.00 H ATOM 17811 H2 WAT 2033 79.925 16.446 137.605 1.00 0.00 H TER 17813 WAT 2033 ATOM 17813 O WAT 2034 42.936 7.777 97.430 1.00 0.00 O ATOM 17814 H1 WAT 2034 42.376 7.006 97.524 1.00 0.00 H ATOM 17815 H2 WAT 2034 43.716 7.452 96.980 1.00 0.00 H TER 17817 WAT 2034 ATOM 17817 O WAT 2035 12.519 120.849 156.870 1.00 0.00 O ATOM 17818 H1 WAT 2035 11.733 121.317 157.151 1.00 0.00 H ATOM 17819 H2 WAT 2035 12.287 119.923 156.944 1.00 0.00 H TER 17821 WAT 2035 ATOM 17821 O WAT 2036 62.063 15.642 146.684 1.00 0.00 O ATOM 17822 H1 WAT 2036 61.214 15.220 146.815 1.00 0.00 H ATOM 17823 H2 WAT 2036 61.853 16.568 146.564 1.00 0.00 H TER 17825 WAT 2036 ATOM 17825 O WAT 2037 26.956 29.297 126.572 1.00 0.00 O ATOM 17826 H1 WAT 2037 26.151 29.569 127.012 1.00 0.00 H ATOM 17827 H2 WAT 2037 27.639 29.842 126.963 1.00 0.00 H TER 17829 WAT 2037 ATOM 17829 O WAT 2038 137.952 131.908 135.147 1.00 0.00 O ATOM 17830 H1 WAT 2038 137.150 131.839 134.629 1.00 0.00 H ATOM 17831 H2 WAT 2038 137.648 132.079 136.038 1.00 0.00 H TER 17833 WAT 2038 ATOM 17833 O WAT 2039 66.189 26.801 14.245 1.00 0.00 O ATOM 17834 H1 WAT 2039 66.454 26.697 13.332 1.00 0.00 H ATOM 17835 H2 WAT 2039 65.377 26.298 14.318 1.00 0.00 H TER 17837 WAT 2039 ATOM 17837 O WAT 2040 145.320 87.032 21.283 1.00 0.00 O ATOM 17838 H1 WAT 2040 145.810 87.496 21.962 1.00 0.00 H ATOM 17839 H2 WAT 2040 145.650 86.134 21.321 1.00 0.00 H TER 17841 WAT 2040 ATOM 17841 O WAT 2041 85.883 34.440 149.225 1.00 0.00 O ATOM 17842 H1 WAT 2041 85.918 33.648 148.689 1.00 0.00 H ATOM 17843 H2 WAT 2041 85.495 35.101 148.651 1.00 0.00 H TER 17845 WAT 2041 ATOM 17845 O WAT 2042 61.495 58.793 87.086 1.00 0.00 O ATOM 17846 H1 WAT 2042 62.348 59.223 87.042 1.00 0.00 H ATOM 17847 H2 WAT 2042 61.133 58.885 86.205 1.00 0.00 H TER 17849 WAT 2042 ATOM 17849 O WAT 2043 60.767 39.330 114.675 1.00 0.00 O ATOM 17850 H1 WAT 2043 60.523 38.536 114.199 1.00 0.00 H ATOM 17851 H2 WAT 2043 60.045 39.475 115.286 1.00 0.00 H TER 17853 WAT 2043 ATOM 17853 O WAT 2044 47.692 62.422 152.154 1.00 0.00 O ATOM 17854 H1 WAT 2044 47.469 62.158 153.047 1.00 0.00 H ATOM 17855 H2 WAT 2044 46.947 62.951 151.868 1.00 0.00 H TER 17857 WAT 2044 ATOM 17857 O WAT 2045 7.708 73.609 69.096 1.00 0.00 O ATOM 17858 H1 WAT 2045 7.837 73.501 68.154 1.00 0.00 H ATOM 17859 H2 WAT 2045 6.765 73.503 69.222 1.00 0.00 H TER 17861 WAT 2045 ATOM 17861 O WAT 2046 9.541 87.215 14.441 1.00 0.00 O ATOM 17862 H1 WAT 2046 8.620 87.083 14.215 1.00 0.00 H ATOM 17863 H2 WAT 2046 9.990 87.263 13.597 1.00 0.00 H TER 17865 WAT 2046 ATOM 17865 O WAT 2047 82.130 96.371 146.484 1.00 0.00 O ATOM 17866 H1 WAT 2047 81.651 95.643 146.087 1.00 0.00 H ATOM 17867 H2 WAT 2047 81.460 96.872 146.949 1.00 0.00 H TER 17869 WAT 2047 ATOM 17869 O WAT 2048 107.957 31.564 83.237 1.00 0.00 O ATOM 17870 H1 WAT 2048 107.899 30.991 84.001 1.00 0.00 H ATOM 17871 H2 WAT 2048 108.857 31.463 82.929 1.00 0.00 H TER 17873 WAT 2048 ATOM 17873 O WAT 2049 77.569 80.618 88.644 1.00 0.00 O ATOM 17874 H1 WAT 2049 77.283 79.708 88.568 1.00 0.00 H ATOM 17875 H2 WAT 2049 78.515 80.562 88.778 1.00 0.00 H TER 17877 WAT 2049 ATOM 17877 O WAT 2050 105.426 86.887 131.448 1.00 0.00 O ATOM 17878 H1 WAT 2050 105.038 86.510 130.658 1.00 0.00 H ATOM 17879 H2 WAT 2050 105.243 87.824 131.380 1.00 0.00 H TER 17881 WAT 2050 ATOM 17881 O WAT 2051 57.002 127.575 101.172 1.00 0.00 O ATOM 17882 H1 WAT 2051 57.229 128.357 100.668 1.00 0.00 H ATOM 17883 H2 WAT 2051 57.343 126.848 100.652 1.00 0.00 H TER 17885 WAT 2051 ATOM 17885 O WAT 2052 84.909 128.113 110.762 1.00 0.00 O ATOM 17886 H1 WAT 2052 85.501 128.678 111.258 1.00 0.00 H ATOM 17887 H2 WAT 2052 85.480 127.450 110.374 1.00 0.00 H TER 17889 WAT 2052 ATOM 17889 O WAT 2053 62.454 144.796 110.199 1.00 0.00 O ATOM 17890 H1 WAT 2053 61.514 144.731 110.031 1.00 0.00 H ATOM 17891 H2 WAT 2053 62.534 145.497 110.845 1.00 0.00 H TER 17893 WAT 2053 ATOM 17893 O WAT 2054 15.063 6.424 131.124 1.00 0.00 O ATOM 17894 H1 WAT 2054 15.319 5.524 130.923 1.00 0.00 H ATOM 17895 H2 WAT 2054 15.830 6.801 131.556 1.00 0.00 H TER 17897 WAT 2054 ATOM 17897 O WAT 2055 31.193 87.426 3.210 1.00 0.00 O ATOM 17898 H1 WAT 2055 31.282 86.493 3.407 1.00 0.00 H ATOM 17899 H2 WAT 2055 31.561 87.521 2.331 1.00 0.00 H TER 17901 WAT 2055 ATOM 17901 O WAT 2056 112.210 29.220 66.549 1.00 0.00 O ATOM 17902 H1 WAT 2056 111.262 29.301 66.657 1.00 0.00 H ATOM 17903 H2 WAT 2056 112.343 28.314 66.272 1.00 0.00 H TER 17905 WAT 2056 ATOM 17905 O WAT 2057 32.667 24.412 149.505 1.00 0.00 O ATOM 17906 H1 WAT 2057 32.323 23.537 149.322 1.00 0.00 H ATOM 17907 H2 WAT 2057 33.034 24.344 150.387 1.00 0.00 H TER 17909 WAT 2057 ATOM 17909 O WAT 2058 43.894 100.812 71.353 1.00 0.00 O ATOM 17910 H1 WAT 2058 44.709 101.076 70.926 1.00 0.00 H ATOM 17911 H2 WAT 2058 43.237 101.418 71.011 1.00 0.00 H TER 17913 WAT 2058 ATOM 17913 O WAT 2059 121.216 109.329 98.709 1.00 0.00 O ATOM 17914 H1 WAT 2059 120.563 109.183 99.395 1.00 0.00 H ATOM 17915 H2 WAT 2059 121.593 110.184 98.916 1.00 0.00 H TER 17917 WAT 2059 ATOM 17917 O WAT 2060 6.036 114.648 147.536 1.00 0.00 O ATOM 17918 H1 WAT 2060 5.424 114.557 148.267 1.00 0.00 H ATOM 17919 H2 WAT 2060 6.241 113.748 147.283 1.00 0.00 H TER 17921 WAT 2060 ATOM 17921 O WAT 2061 140.972 118.973 152.624 1.00 0.00 O ATOM 17922 H1 WAT 2061 141.810 119.387 152.833 1.00 0.00 H ATOM 17923 H2 WAT 2061 140.486 119.643 152.145 1.00 0.00 H TER 17925 WAT 2061 ATOM 17925 O WAT 2062 69.492 32.180 138.187 1.00 0.00 O ATOM 17926 H1 WAT 2062 68.860 32.863 137.960 1.00 0.00 H ATOM 17927 H2 WAT 2062 68.969 31.381 138.249 1.00 0.00 H TER 17929 WAT 2062 ATOM 17929 O WAT 2063 136.381 134.327 22.634 1.00 0.00 O ATOM 17930 H1 WAT 2063 137.098 134.930 22.835 1.00 0.00 H ATOM 17931 H2 WAT 2063 135.817 134.817 22.036 1.00 0.00 H TER 17933 WAT 2063 ATOM 17933 O WAT 2064 42.116 6.211 110.506 1.00 0.00 O ATOM 17934 H1 WAT 2064 41.281 6.568 110.809 1.00 0.00 H ATOM 17935 H2 WAT 2064 41.884 5.669 109.752 1.00 0.00 H TER 17937 WAT 2064 ATOM 17937 O WAT 2065 54.277 32.666 61.643 1.00 0.00 O ATOM 17938 H1 WAT 2065 54.889 33.396 61.547 1.00 0.00 H ATOM 17939 H2 WAT 2065 54.233 32.274 60.771 1.00 0.00 H TER 17941 WAT 2065 ATOM 17941 O WAT 2066 139.004 77.839 152.125 1.00 0.00 O ATOM 17942 H1 WAT 2066 139.774 78.336 151.851 1.00 0.00 H ATOM 17943 H2 WAT 2066 138.273 78.446 152.009 1.00 0.00 H TER 17945 WAT 2066 ATOM 17945 O WAT 2067 21.714 105.468 141.316 1.00 0.00 O ATOM 17946 H1 WAT 2067 22.670 105.475 141.352 1.00 0.00 H ATOM 17947 H2 WAT 2067 21.447 106.175 141.904 1.00 0.00 H TER 17949 WAT 2067 ATOM 17949 O WAT 2068 38.893 104.182 148.321 1.00 0.00 O ATOM 17950 H1 WAT 2068 39.151 103.260 148.340 1.00 0.00 H ATOM 17951 H2 WAT 2068 39.528 104.620 148.887 1.00 0.00 H TER 17953 WAT 2068 ATOM 17953 O WAT 2069 107.879 29.607 6.736 1.00 0.00 O ATOM 17954 H1 WAT 2069 107.534 28.730 6.574 1.00 0.00 H ATOM 17955 H2 WAT 2069 107.497 30.146 6.043 1.00 0.00 H TER 17957 WAT 2069 ATOM 17957 O WAT 2070 12.644 145.561 3.732 1.00 0.00 O ATOM 17958 H1 WAT 2070 12.640 145.211 2.842 1.00 0.00 H ATOM 17959 H2 WAT 2070 11.745 145.443 4.041 1.00 0.00 H TER 17961 WAT 2070 ATOM 17961 O WAT 2071 10.663 103.405 106.238 1.00 0.00 O ATOM 17962 H1 WAT 2071 11.129 103.878 105.548 1.00 0.00 H ATOM 17963 H2 WAT 2071 10.976 103.799 107.052 1.00 0.00 H TER 17965 WAT 2071 ATOM 17965 O WAT 2072 58.163 26.464 98.820 1.00 0.00 O ATOM 17966 H1 WAT 2072 57.351 26.644 99.294 1.00 0.00 H ATOM 17967 H2 WAT 2072 58.345 27.272 98.340 1.00 0.00 H TER 17969 WAT 2072 ATOM 17969 O WAT 2073 123.728 77.377 146.214 1.00 0.00 O ATOM 17970 H1 WAT 2073 123.984 77.767 147.050 1.00 0.00 H ATOM 17971 H2 WAT 2073 123.590 78.124 145.633 1.00 0.00 H TER 17973 WAT 2073 ATOM 17973 O WAT 2074 23.359 18.056 105.854 1.00 0.00 O ATOM 17974 H1 WAT 2074 23.224 17.252 105.353 1.00 0.00 H ATOM 17975 H2 WAT 2074 22.913 17.898 106.686 1.00 0.00 H TER 17977 WAT 2074 ATOM 17977 O WAT 2075 5.769 144.263 88.788 1.00 0.00 O ATOM 17978 H1 WAT 2075 4.926 144.230 88.335 1.00 0.00 H ATOM 17979 H2 WAT 2075 6.340 143.694 88.272 1.00 0.00 H TER 17981 WAT 2075 ATOM 17981 O WAT 2076 10.137 14.863 112.470 1.00 0.00 O ATOM 17982 H1 WAT 2076 9.876 14.432 111.656 1.00 0.00 H ATOM 17983 H2 WAT 2076 10.675 14.214 112.922 1.00 0.00 H TER 17985 WAT 2076 ATOM 17985 O WAT 2077 31.603 23.309 22.812 1.00 0.00 O ATOM 17986 H1 WAT 2077 30.808 22.925 22.441 1.00 0.00 H ATOM 17987 H2 WAT 2077 31.303 23.766 23.598 1.00 0.00 H TER 17989 WAT 2077 ATOM 17989 O WAT 2078 45.514 49.358 119.564 1.00 0.00 O ATOM 17990 H1 WAT 2078 45.106 49.772 118.804 1.00 0.00 H ATOM 17991 H2 WAT 2078 46.451 49.509 119.445 1.00 0.00 H TER 17993 WAT 2078 ATOM 17993 O WAT 2079 35.542 127.845 107.417 1.00 0.00 O ATOM 17994 H1 WAT 2079 36.058 127.052 107.563 1.00 0.00 H ATOM 17995 H2 WAT 2079 34.816 127.559 106.863 1.00 0.00 H TER 17997 WAT 2079 ATOM 17997 O WAT 2080 6.142 15.488 86.254 1.00 0.00 O ATOM 17998 H1 WAT 2080 5.285 15.453 85.829 1.00 0.00 H ATOM 17999 H2 WAT 2080 6.030 16.114 86.969 1.00 0.00 H TER 18001 WAT 2080 ATOM 18001 O WAT 2081 136.653 52.345 113.484 1.00 0.00 O ATOM 18002 H1 WAT 2081 137.054 52.412 112.618 1.00 0.00 H ATOM 18003 H2 WAT 2081 135.716 52.253 113.308 1.00 0.00 H TER 18005 WAT 2081 ATOM 18005 O WAT 2082 79.308 122.065 98.478 1.00 0.00 O ATOM 18006 H1 WAT 2082 79.619 122.152 99.379 1.00 0.00 H ATOM 18007 H2 WAT 2082 78.731 121.302 98.496 1.00 0.00 H TER 18009 WAT 2082 ATOM 18009 O WAT 2083 40.811 69.580 100.185 1.00 0.00 O ATOM 18010 H1 WAT 2083 40.700 70.377 100.702 1.00 0.00 H ATOM 18011 H2 WAT 2083 39.919 69.310 99.966 1.00 0.00 H TER 18013 WAT 2083 ATOM 18013 O WAT 2084 128.467 101.356 95.267 1.00 0.00 O ATOM 18014 H1 WAT 2084 129.061 100.716 94.874 1.00 0.00 H ATOM 18015 H2 WAT 2084 128.990 101.783 95.945 1.00 0.00 H TER 18017 WAT 2084 ATOM 18017 O WAT 2085 73.070 103.139 142.804 1.00 0.00 O ATOM 18018 H1 WAT 2085 73.982 103.244 142.532 1.00 0.00 H ATOM 18019 H2 WAT 2085 72.560 103.484 142.071 1.00 0.00 H TER 18021 WAT 2085 ATOM 18021 O WAT 2086 34.754 132.677 60.069 1.00 0.00 O ATOM 18022 H1 WAT 2086 35.095 131.869 60.452 1.00 0.00 H ATOM 18023 H2 WAT 2086 35.319 133.365 60.420 1.00 0.00 H TER 18025 WAT 2086 ATOM 18025 O WAT 2087 41.511 121.275 102.925 1.00 0.00 O ATOM 18026 H1 WAT 2087 41.197 122.179 102.936 1.00 0.00 H ATOM 18027 H2 WAT 2087 40.803 120.781 102.511 1.00 0.00 H TER 18029 WAT 2087 ATOM 18029 O WAT 2088 50.267 33.002 13.559 1.00 0.00 O ATOM 18030 H1 WAT 2088 50.344 33.906 13.866 1.00 0.00 H ATOM 18031 H2 WAT 2088 49.363 32.758 13.758 1.00 0.00 H TER 18033 WAT 2088 ATOM 18033 O WAT 2089 51.731 33.976 10.194 1.00 0.00 O ATOM 18034 H1 WAT 2089 52.469 33.595 10.668 1.00 0.00 H ATOM 18035 H2 WAT 2089 52.002 33.963 9.276 1.00 0.00 H TER 18037 WAT 2089 ATOM 18037 O WAT 2090 4.227 36.733 80.421 1.00 0.00 O ATOM 18038 H1 WAT 2090 3.788 37.426 79.928 1.00 0.00 H ATOM 18039 H2 WAT 2090 4.160 37.009 81.335 1.00 0.00 H TER 18041 WAT 2090 ATOM 18041 O WAT 2091 90.284 67.030 11.789 1.00 0.00 O ATOM 18042 H1 WAT 2091 90.816 67.515 11.159 1.00 0.00 H ATOM 18043 H2 WAT 2091 90.918 66.657 12.402 1.00 0.00 H TER 18045 WAT 2091 ATOM 18045 O WAT 2092 113.166 69.278 141.929 1.00 0.00 O ATOM 18046 H1 WAT 2092 113.552 68.414 141.787 1.00 0.00 H ATOM 18047 H2 WAT 2092 112.521 69.370 141.228 1.00 0.00 H TER 18049 WAT 2092 ATOM 18049 O WAT 2093 19.309 52.876 14.900 1.00 0.00 O ATOM 18050 H1 WAT 2093 19.394 53.117 15.823 1.00 0.00 H ATOM 18051 H2 WAT 2093 19.439 51.927 14.888 1.00 0.00 H TER 18053 WAT 2093 ATOM 18053 O WAT 2094 32.681 109.788 17.424 1.00 0.00 O ATOM 18054 H1 WAT 2094 33.566 109.954 17.100 1.00 0.00 H ATOM 18055 H2 WAT 2094 32.520 108.867 17.218 1.00 0.00 H TER 18057 WAT 2094 ATOM 18057 O WAT 2095 78.807 6.929 57.473 1.00 0.00 O ATOM 18058 H1 WAT 2095 78.141 6.371 57.071 1.00 0.00 H ATOM 18059 H2 WAT 2095 78.937 6.558 58.345 1.00 0.00 H TER 18061 WAT 2095 ATOM 18061 O WAT 2096 18.106 138.663 77.584 1.00 0.00 O ATOM 18062 H1 WAT 2096 18.528 138.653 78.443 1.00 0.00 H ATOM 18063 H2 WAT 2096 18.824 138.796 76.965 1.00 0.00 H TER 18065 WAT 2096 ATOM 18065 O WAT 2097 51.841 28.916 20.157 1.00 0.00 O ATOM 18066 H1 WAT 2097 52.326 28.118 19.947 1.00 0.00 H ATOM 18067 H2 WAT 2097 51.172 28.632 20.780 1.00 0.00 H TER 18069 WAT 2097 ATOM 18069 O WAT 2098 19.566 91.785 16.000 1.00 0.00 O ATOM 18070 H1 WAT 2098 20.419 91.961 15.604 1.00 0.00 H ATOM 18071 H2 WAT 2098 19.265 92.639 16.311 1.00 0.00 H TER 18073 WAT 2098 ATOM 18073 O WAT 2099 14.119 17.423 150.782 1.00 0.00 O ATOM 18074 H1 WAT 2099 14.692 18.184 150.875 1.00 0.00 H ATOM 18075 H2 WAT 2099 13.268 17.724 151.101 1.00 0.00 H TER 18077 WAT 2099 ATOM 18077 O WAT 2100 38.562 56.204 26.261 1.00 0.00 O ATOM 18078 H1 WAT 2100 39.161 55.592 25.832 1.00 0.00 H ATOM 18079 H2 WAT 2100 38.379 56.866 25.595 1.00 0.00 H TER 18081 WAT 2100 ATOM 18081 O WAT 2101 100.524 13.080 143.101 1.00 0.00 O ATOM 18082 H1 WAT 2101 99.759 12.785 143.595 1.00 0.00 H ATOM 18083 H2 WAT 2101 101.156 13.340 143.771 1.00 0.00 H TER 18085 WAT 2101 ATOM 18085 O WAT 2102 80.216 30.066 89.509 1.00 0.00 O ATOM 18086 H1 WAT 2102 79.526 29.923 90.156 1.00 0.00 H ATOM 18087 H2 WAT 2102 80.722 30.801 89.856 1.00 0.00 H TER 18089 WAT 2102 ATOM 18089 O WAT 2103 96.235 71.146 107.964 1.00 0.00 O ATOM 18090 H1 WAT 2103 96.104 71.979 107.512 1.00 0.00 H ATOM 18091 H2 WAT 2103 95.959 70.484 107.331 1.00 0.00 H TER 18093 WAT 2103 ATOM 18093 O WAT 2104 125.139 129.697 70.394 1.00 0.00 O ATOM 18094 H1 WAT 2104 125.973 129.880 70.827 1.00 0.00 H ATOM 18095 H2 WAT 2104 125.366 129.602 69.469 1.00 0.00 H TER 18097 WAT 2104 ATOM 18097 O WAT 2105 19.543 99.877 7.160 1.00 0.00 O ATOM 18098 H1 WAT 2105 19.715 100.495 6.449 1.00 0.00 H ATOM 18099 H2 WAT 2105 18.735 100.193 7.562 1.00 0.00 H TER 18101 WAT 2105 ATOM 18101 O WAT 2106 18.061 123.803 22.614 1.00 0.00 O ATOM 18102 H1 WAT 2106 17.267 124.261 22.339 1.00 0.00 H ATOM 18103 H2 WAT 2106 18.705 124.499 22.746 1.00 0.00 H TER 18105 WAT 2106 ATOM 18105 O WAT 2107 141.375 39.197 13.286 1.00 0.00 O ATOM 18106 H1 WAT 2107 141.190 39.210 12.346 1.00 0.00 H ATOM 18107 H2 WAT 2107 140.819 39.886 13.649 1.00 0.00 H TER 18109 WAT 2107 ATOM 18109 O WAT 2108 93.783 78.749 130.741 1.00 0.00 O ATOM 18110 H1 WAT 2108 93.768 78.047 131.392 1.00 0.00 H ATOM 18111 H2 WAT 2108 93.073 78.530 130.137 1.00 0.00 H TER 18113 WAT 2108 ATOM 18113 O WAT 2109 143.187 30.842 68.385 1.00 0.00 O ATOM 18114 H1 WAT 2109 143.872 31.125 68.990 1.00 0.00 H ATOM 18115 H2 WAT 2109 142.756 31.653 68.115 1.00 0.00 H TER 18117 WAT 2109 ATOM 18117 O WAT 2110 41.621 118.587 59.488 1.00 0.00 O ATOM 18118 H1 WAT 2110 41.860 118.178 58.656 1.00 0.00 H ATOM 18119 H2 WAT 2110 40.855 119.122 59.280 1.00 0.00 H TER 18121 WAT 2110 ATOM 18121 O WAT 2111 128.422 116.709 130.017 1.00 0.00 O ATOM 18122 H1 WAT 2111 128.297 116.923 130.942 1.00 0.00 H ATOM 18123 H2 WAT 2111 128.426 117.557 129.574 1.00 0.00 H TER 18125 WAT 2111 ATOM 18125 O WAT 2112 86.309 137.058 134.104 1.00 0.00 O ATOM 18126 H1 WAT 2112 86.606 136.612 134.896 1.00 0.00 H ATOM 18127 H2 WAT 2112 86.174 137.965 134.376 1.00 0.00 H TER 18129 WAT 2112 ATOM 18129 O WAT 2113 98.800 39.585 114.483 1.00 0.00 O ATOM 18130 H1 WAT 2113 99.465 39.296 115.108 1.00 0.00 H ATOM 18131 H2 WAT 2113 99.289 40.076 113.823 1.00 0.00 H TER 18133 WAT 2113 ATOM 18133 O WAT 2114 127.846 67.139 7.278 1.00 0.00 O ATOM 18134 H1 WAT 2114 127.290 66.746 7.951 1.00 0.00 H ATOM 18135 H2 WAT 2114 127.779 68.081 7.433 1.00 0.00 H TER 18137 WAT 2114 ATOM 18137 O WAT 2115 130.646 52.579 155.479 1.00 0.00 O ATOM 18138 H1 WAT 2115 131.121 53.372 155.727 1.00 0.00 H ATOM 18139 H2 WAT 2115 129.790 52.672 155.897 1.00 0.00 H TER 18141 WAT 2115 ATOM 18141 O WAT 2116 113.990 136.761 137.593 1.00 0.00 O ATOM 18142 H1 WAT 2116 113.812 135.833 137.440 1.00 0.00 H ATOM 18143 H2 WAT 2116 114.819 136.923 137.143 1.00 0.00 H TER 18145 WAT 2116 ATOM 18145 O WAT 2117 126.348 14.280 128.718 1.00 0.00 O ATOM 18146 H1 WAT 2117 126.670 14.977 129.290 1.00 0.00 H ATOM 18147 H2 WAT 2117 126.567 13.471 129.179 1.00 0.00 H TER 18149 WAT 2117 ATOM 18149 O WAT 2118 15.208 118.365 11.776 1.00 0.00 O ATOM 18150 H1 WAT 2118 15.573 117.513 12.016 1.00 0.00 H ATOM 18151 H2 WAT 2118 14.289 118.315 12.038 1.00 0.00 H TER 18153 WAT 2118 ATOM 18153 O WAT 2119 116.465 128.167 0.844 1.00 0.00 O ATOM 18154 H1 WAT 2119 117.018 127.546 1.318 1.00 0.00 H ATOM 18155 H2 WAT 2119 115.887 128.533 1.513 1.00 0.00 H TER 18157 WAT 2119 ATOM 18157 O WAT 2120 35.720 121.392 122.825 1.00 0.00 O ATOM 18158 H1 WAT 2120 35.228 120.572 122.789 1.00 0.00 H ATOM 18159 H2 WAT 2120 36.247 121.321 123.621 1.00 0.00 H TER 18161 WAT 2120 ATOM 18161 O WAT 2121 94.009 53.341 54.372 1.00 0.00 O ATOM 18162 H1 WAT 2121 93.689 54.014 54.974 1.00 0.00 H ATOM 18163 H2 WAT 2121 93.301 52.699 54.334 1.00 0.00 H TER 18165 WAT 2121 ATOM 18165 O WAT 2122 4.971 135.865 135.271 1.00 0.00 O ATOM 18166 H1 WAT 2122 4.494 135.996 134.452 1.00 0.00 H ATOM 18167 H2 WAT 2122 4.401 135.300 135.792 1.00 0.00 H TER 18169 WAT 2122 ATOM 18169 O WAT 2123 1.448 10.017 105.919 1.00 0.00 O ATOM 18170 H1 WAT 2123 2.399 10.106 105.970 1.00 0.00 H ATOM 18171 H2 WAT 2123 1.143 10.185 106.811 1.00 0.00 H TER 18173 WAT 2123 ATOM 18173 O WAT 2124 139.509 140.819 145.253 1.00 0.00 O ATOM 18174 H1 WAT 2124 139.709 140.487 144.378 1.00 0.00 H ATOM 18175 H2 WAT 2124 140.227 140.502 145.800 1.00 0.00 H TER 18177 WAT 2124 ATOM 18177 O WAT 2125 42.026 52.527 112.041 1.00 0.00 O ATOM 18178 H1 WAT 2125 42.842 52.327 111.581 1.00 0.00 H ATOM 18179 H2 WAT 2125 42.301 52.762 112.927 1.00 0.00 H TER 18181 WAT 2125 ATOM 18181 O WAT 2126 103.801 48.534 141.380 1.00 0.00 O ATOM 18182 H1 WAT 2126 104.279 48.028 142.037 1.00 0.00 H ATOM 18183 H2 WAT 2126 103.505 49.315 141.848 1.00 0.00 H TER 18185 WAT 2126 ATOM 18185 O WAT 2127 27.203 77.067 148.466 1.00 0.00 O ATOM 18186 H1 WAT 2127 27.283 77.701 147.754 1.00 0.00 H ATOM 18187 H2 WAT 2127 27.482 77.547 149.246 1.00 0.00 H TER 18189 WAT 2127 ATOM 18189 O WAT 2128 58.861 85.901 98.462 1.00 0.00 O ATOM 18190 H1 WAT 2128 59.670 85.864 97.952 1.00 0.00 H ATOM 18191 H2 WAT 2128 59.032 85.347 99.223 1.00 0.00 H TER 18193 WAT 2128 ATOM 18193 O WAT 2129 131.169 108.904 7.420 1.00 0.00 O ATOM 18194 H1 WAT 2129 131.670 109.130 8.204 1.00 0.00 H ATOM 18195 H2 WAT 2129 131.457 109.536 6.761 1.00 0.00 H TER 18197 WAT 2129 ATOM 18197 O WAT 2130 60.971 21.727 1.157 1.00 0.00 O ATOM 18198 H1 WAT 2130 61.387 21.928 0.319 1.00 0.00 H ATOM 18199 H2 WAT 2130 60.505 22.529 1.392 1.00 0.00 H TER 18201 WAT 2130 ATOM 18201 O WAT 2131 26.047 46.927 143.457 1.00 0.00 O ATOM 18202 H1 WAT 2131 26.107 46.392 142.665 1.00 0.00 H ATOM 18203 H2 WAT 2131 25.135 47.214 143.484 1.00 0.00 H TER 18205 WAT 2131 ATOM 18205 O WAT 2132 57.518 34.951 140.233 1.00 0.00 O ATOM 18206 H1 WAT 2132 56.683 34.781 140.670 1.00 0.00 H ATOM 18207 H2 WAT 2132 57.275 35.379 139.412 1.00 0.00 H TER 18209 WAT 2132 ATOM 18209 O WAT 2133 43.828 102.388 78.710 1.00 0.00 O ATOM 18210 H1 WAT 2133 43.597 102.041 77.848 1.00 0.00 H ATOM 18211 H2 WAT 2133 44.465 103.079 78.527 1.00 0.00 H TER 18213 WAT 2133 ATOM 18213 O WAT 2134 12.436 97.534 80.533 1.00 0.00 O ATOM 18214 H1 WAT 2134 12.822 98.262 80.046 1.00 0.00 H ATOM 18215 H2 WAT 2134 12.997 96.786 80.328 1.00 0.00 H TER 18217 WAT 2134 ATOM 18217 O WAT 2135 28.326 97.538 107.867 1.00 0.00 O ATOM 18218 H1 WAT 2135 28.824 96.806 108.232 1.00 0.00 H ATOM 18219 H2 WAT 2135 28.073 98.059 108.629 1.00 0.00 H TER 18221 WAT 2135 ATOM 18221 O WAT 2136 22.670 130.944 3.404 1.00 0.00 O ATOM 18222 H1 WAT 2136 23.372 130.338 3.166 1.00 0.00 H ATOM 18223 H2 WAT 2136 22.171 131.061 2.596 1.00 0.00 H TER 18225 WAT 2136 ATOM 18225 O WAT 2137 103.503 98.508 119.610 1.00 0.00 O ATOM 18226 H1 WAT 2137 103.610 97.631 119.977 1.00 0.00 H ATOM 18227 H2 WAT 2137 104.101 98.530 118.862 1.00 0.00 H TER 18229 WAT 2137 ATOM 18229 O WAT 2138 89.732 60.351 89.385 1.00 0.00 O ATOM 18230 H1 WAT 2138 89.136 60.608 90.089 1.00 0.00 H ATOM 18231 H2 WAT 2138 89.204 60.416 88.589 1.00 0.00 H TER 18233 WAT 2138 ATOM 18233 O WAT 2139 8.611 44.396 7.024 1.00 0.00 O ATOM 18234 H1 WAT 2139 8.312 45.083 6.428 1.00 0.00 H ATOM 18235 H2 WAT 2139 9.558 44.526 7.084 1.00 0.00 H TER 18237 WAT 2139 ATOM 18237 O WAT 2140 135.678 6.221 141.502 1.00 0.00 O ATOM 18238 H1 WAT 2140 135.476 5.548 142.152 1.00 0.00 H ATOM 18239 H2 WAT 2140 134.844 6.390 141.066 1.00 0.00 H TER 18241 WAT 2140 ATOM 18241 O WAT 2141 25.047 136.788 122.489 1.00 0.00 O ATOM 18242 H1 WAT 2141 25.270 136.421 123.344 1.00 0.00 H ATOM 18243 H2 WAT 2141 25.311 137.706 122.547 1.00 0.00 H TER 18245 WAT 2141 ATOM 18245 O WAT 2142 37.700 88.924 138.639 1.00 0.00 O ATOM 18246 H1 WAT 2142 37.317 88.557 139.436 1.00 0.00 H ATOM 18247 H2 WAT 2142 37.042 89.542 138.320 1.00 0.00 H TER 18249 WAT 2142 ATOM 18249 O WAT 2143 124.154 38.803 15.718 1.00 0.00 O ATOM 18250 H1 WAT 2143 123.501 39.172 16.312 1.00 0.00 H ATOM 18251 H2 WAT 2143 124.748 39.530 15.533 1.00 0.00 H TER 18253 WAT 2143 ATOM 18253 O WAT 2144 0.141 139.633 140.581 1.00 0.00 O ATOM 18254 H1 WAT 2144 0.889 140.125 140.919 1.00 0.00 H ATOM 18255 H2 WAT 2144 -0.500 140.304 140.344 1.00 0.00 H TER 18257 WAT 2144 ATOM 18257 O WAT 2145 141.575 144.665 115.074 1.00 0.00 O ATOM 18258 H1 WAT 2145 142.295 144.088 115.329 1.00 0.00 H ATOM 18259 H2 WAT 2145 141.128 144.194 114.371 1.00 0.00 H TER 18261 WAT 2145 ATOM 18261 O WAT 2146 28.106 109.111 109.967 1.00 0.00 O ATOM 18262 H1 WAT 2146 27.498 108.831 109.283 1.00 0.00 H ATOM 18263 H2 WAT 2146 28.409 109.973 109.681 1.00 0.00 H TER 18265 WAT 2146 ATOM 18265 O WAT 2147 132.000 75.241 125.370 1.00 0.00 O ATOM 18266 H1 WAT 2147 131.231 74.880 125.812 1.00 0.00 H ATOM 18267 H2 WAT 2147 132.635 75.383 126.072 1.00 0.00 H TER 18269 WAT 2147 ATOM 18269 O WAT 2148 136.919 110.460 123.920 1.00 0.00 O ATOM 18270 H1 WAT 2148 136.289 110.759 124.575 1.00 0.00 H ATOM 18271 H2 WAT 2148 137.309 109.674 124.303 1.00 0.00 H TER 18273 WAT 2148 ATOM 18273 O WAT 2149 135.221 25.906 134.143 1.00 0.00 O ATOM 18274 H1 WAT 2149 135.738 25.626 133.388 1.00 0.00 H ATOM 18275 H2 WAT 2149 135.615 26.737 134.409 1.00 0.00 H TER 18277 WAT 2149 ATOM 18277 O WAT 2150 54.049 117.961 124.432 1.00 0.00 O ATOM 18278 H1 WAT 2150 53.482 117.189 124.436 1.00 0.00 H ATOM 18279 H2 WAT 2150 54.894 117.639 124.746 1.00 0.00 H TER 18281 WAT 2150 ATOM 18281 O WAT 2151 97.360 83.270 16.707 1.00 0.00 O ATOM 18282 H1 WAT 2151 98.142 83.300 17.258 1.00 0.00 H ATOM 18283 H2 WAT 2151 96.861 82.524 17.040 1.00 0.00 H TER 18285 WAT 2151 ATOM 18285 O WAT 2152 122.655 134.808 72.938 1.00 0.00 O ATOM 18286 H1 WAT 2152 122.018 134.097 73.009 1.00 0.00 H ATOM 18287 H2 WAT 2152 122.127 135.584 72.750 1.00 0.00 H TER 18289 WAT 2152 ATOM 18289 O WAT 2153 76.685 60.360 19.874 1.00 0.00 O ATOM 18290 H1 WAT 2153 77.360 61.038 19.905 1.00 0.00 H ATOM 18291 H2 WAT 2153 76.576 60.089 20.785 1.00 0.00 H TER 18293 WAT 2153 ATOM 18293 O WAT 2154 112.709 96.124 93.680 1.00 0.00 O ATOM 18294 H1 WAT 2154 112.519 96.462 92.804 1.00 0.00 H ATOM 18295 H2 WAT 2154 111.942 95.598 93.905 1.00 0.00 H TER 18297 WAT 2154 ATOM 18297 O WAT 2155 73.455 15.214 108.413 1.00 0.00 O ATOM 18298 H1 WAT 2155 73.873 14.649 109.062 1.00 0.00 H ATOM 18299 H2 WAT 2155 74.164 15.462 107.819 1.00 0.00 H TER 18301 WAT 2155 ATOM 18301 O WAT 2156 67.830 81.555 1.407 1.00 0.00 O ATOM 18302 H1 WAT 2156 67.500 81.461 0.513 1.00 0.00 H ATOM 18303 H2 WAT 2156 67.260 80.992 1.932 1.00 0.00 H TER 18305 WAT 2156 ATOM 18305 O WAT 2157 5.020 130.580 68.606 1.00 0.00 O ATOM 18306 H1 WAT 2157 4.705 129.771 68.203 1.00 0.00 H ATOM 18307 H2 WAT 2157 5.057 131.209 67.885 1.00 0.00 H TER 18309 WAT 2157 ATOM 18309 O WAT 2158 115.408 136.819 63.859 1.00 0.00 O ATOM 18310 H1 WAT 2158 115.810 136.295 63.165 1.00 0.00 H ATOM 18311 H2 WAT 2158 116.000 137.563 63.969 1.00 0.00 H TER 18313 WAT 2158 ATOM 18313 O WAT 2159 128.839 116.436 28.389 1.00 0.00 O ATOM 18314 H1 WAT 2159 128.346 116.592 27.584 1.00 0.00 H ATOM 18315 H2 WAT 2159 129.237 115.575 28.264 1.00 0.00 H TER 18317 WAT 2159 ATOM 18317 O WAT 2160 32.301 5.160 1.606 1.00 0.00 O ATOM 18318 H1 WAT 2160 33.203 4.971 1.346 1.00 0.00 H ATOM 18319 H2 WAT 2160 31.765 4.677 0.977 1.00 0.00 H TER 18321 WAT 2160 ATOM 18321 O WAT 2161 101.413 41.528 156.317 1.00 0.00 O ATOM 18322 H1 WAT 2161 100.609 41.639 156.824 1.00 0.00 H ATOM 18323 H2 WAT 2161 101.500 40.580 156.211 1.00 0.00 H TER 18325 WAT 2161 ATOM 18325 O WAT 2162 56.981 114.215 130.048 1.00 0.00 O ATOM 18326 H1 WAT 2162 57.457 114.850 130.584 1.00 0.00 H ATOM 18327 H2 WAT 2162 57.170 114.474 129.146 1.00 0.00 H TER 18329 WAT 2162 ATOM 18329 O WAT 2163 84.632 45.999 86.904 1.00 0.00 O ATOM 18330 H1 WAT 2163 85.541 45.701 86.863 1.00 0.00 H ATOM 18331 H2 WAT 2163 84.162 45.416 86.307 1.00 0.00 H TER 18333 WAT 2163 ATOM 18333 O WAT 2164 38.521 120.935 4.081 1.00 0.00 O ATOM 18334 H1 WAT 2164 39.401 120.609 4.267 1.00 0.00 H ATOM 18335 H2 WAT 2164 38.642 121.871 3.919 1.00 0.00 H TER 18337 WAT 2164 ATOM 18337 O WAT 2165 91.050 115.116 74.241 1.00 0.00 O ATOM 18338 H1 WAT 2165 90.619 114.618 73.546 1.00 0.00 H ATOM 18339 H2 WAT 2165 91.876 114.657 74.388 1.00 0.00 H TER 18341 WAT 2165 ATOM 18341 O WAT 2166 32.056 48.636 98.938 1.00 0.00 O ATOM 18342 H1 WAT 2166 32.729 47.966 99.056 1.00 0.00 H ATOM 18343 H2 WAT 2166 31.743 48.506 98.043 1.00 0.00 H TER 18345 WAT 2166 ATOM 18345 O WAT 2167 92.675 59.095 5.820 1.00 0.00 O ATOM 18346 H1 WAT 2167 93.229 59.240 6.587 1.00 0.00 H ATOM 18347 H2 WAT 2167 91.781 59.147 6.159 1.00 0.00 H TER 18349 WAT 2167 ATOM 18349 O WAT 2168 34.651 65.690 94.712 1.00 0.00 O ATOM 18350 H1 WAT 2168 34.569 64.985 94.071 1.00 0.00 H ATOM 18351 H2 WAT 2168 35.516 66.065 94.547 1.00 0.00 H TER 18353 WAT 2168 ATOM 18353 O WAT 2169 86.482 104.107 73.584 1.00 0.00 O ATOM 18354 H1 WAT 2169 87.046 103.788 72.880 1.00 0.00 H ATOM 18355 H2 WAT 2169 85.655 103.642 73.459 1.00 0.00 H TER 18357 WAT 2169 ATOM 18357 O WAT 2170 33.723 138.228 106.790 1.00 0.00 O ATOM 18358 H1 WAT 2170 33.966 138.195 107.716 1.00 0.00 H ATOM 18359 H2 WAT 2170 34.382 138.795 106.390 1.00 0.00 H TER 18361 WAT 2170 ATOM 18361 O WAT 2171 92.304 98.492 7.072 1.00 0.00 O ATOM 18362 H1 WAT 2171 92.085 97.752 6.505 1.00 0.00 H ATOM 18363 H2 WAT 2171 92.558 99.190 6.467 1.00 0.00 H TER 18365 WAT 2171 ATOM 18365 O WAT 2172 52.763 47.297 83.445 1.00 0.00 O ATOM 18366 H1 WAT 2172 53.054 47.152 84.345 1.00 0.00 H ATOM 18367 H2 WAT 2172 51.809 47.339 83.505 1.00 0.00 H TER 18369 WAT 2172 ATOM 18369 O WAT 2173 88.108 38.457 11.900 1.00 0.00 O ATOM 18370 H1 WAT 2173 88.074 38.514 12.855 1.00 0.00 H ATOM 18371 H2 WAT 2173 88.339 37.545 11.723 1.00 0.00 H TER 18373 WAT 2173 ATOM 18373 O WAT 2174 22.729 89.928 119.352 1.00 0.00 O ATOM 18374 H1 WAT 2174 23.252 90.000 118.554 1.00 0.00 H ATOM 18375 H2 WAT 2174 22.752 88.996 119.571 1.00 0.00 H TER 18377 WAT 2174 ATOM 18377 O WAT 2175 101.236 20.700 158.121 1.00 0.00 O ATOM 18378 H1 WAT 2175 101.514 21.612 158.036 1.00 0.00 H ATOM 18379 H2 WAT 2175 102.049 20.214 158.257 1.00 0.00 H TER 18381 WAT 2175 ATOM 18381 O WAT 2176 50.243 34.272 81.303 1.00 0.00 O ATOM 18382 H1 WAT 2176 51.084 34.332 81.756 1.00 0.00 H ATOM 18383 H2 WAT 2176 50.039 35.173 81.055 1.00 0.00 H TER 18385 WAT 2176 ATOM 18385 O WAT 2177 24.609 44.893 130.270 1.00 0.00 O ATOM 18386 H1 WAT 2177 24.100 44.095 130.126 1.00 0.00 H ATOM 18387 H2 WAT 2177 25.449 44.722 129.843 1.00 0.00 H TER 18389 WAT 2177 ATOM 18389 O WAT 2178 138.843 70.716 115.494 1.00 0.00 O ATOM 18390 H1 WAT 2178 139.348 69.914 115.357 1.00 0.00 H ATOM 18391 H2 WAT 2178 138.065 70.431 115.973 1.00 0.00 H TER 18393 WAT 2178 ATOM 18393 O WAT 2179 123.898 65.011 103.451 1.00 0.00 O ATOM 18394 H1 WAT 2179 123.539 64.123 103.458 1.00 0.00 H ATOM 18395 H2 WAT 2179 123.963 65.235 102.522 1.00 0.00 H TER 18397 WAT 2179 ATOM 18397 O WAT 2180 2.252 84.980 122.303 1.00 0.00 O ATOM 18398 H1 WAT 2180 1.508 85.200 122.864 1.00 0.00 H ATOM 18399 H2 WAT 2180 2.267 85.673 121.643 1.00 0.00 H TER 18401 WAT 2180 ATOM 18401 O WAT 2181 20.780 47.710 158.661 1.00 0.00 O ATOM 18402 H1 WAT 2181 20.990 47.132 157.927 1.00 0.00 H ATOM 18403 H2 WAT 2181 20.860 48.593 158.301 1.00 0.00 H TER 18405 WAT 2181 ATOM 18405 O WAT 2182 136.349 88.732 103.941 1.00 0.00 O ATOM 18406 H1 WAT 2182 135.775 88.479 104.664 1.00 0.00 H ATOM 18407 H2 WAT 2182 136.882 89.444 104.295 1.00 0.00 H TER 18409 WAT 2182 ATOM 18409 O WAT 2183 19.255 14.095 94.801 1.00 0.00 O ATOM 18410 H1 WAT 2183 18.379 13.759 94.612 1.00 0.00 H ATOM 18411 H2 WAT 2183 19.699 13.369 95.240 1.00 0.00 H TER 18413 WAT 2183 ATOM 18413 O WAT 2184 67.056 0.726 88.953 1.00 0.00 O ATOM 18414 H1 WAT 2184 66.921 1.578 89.367 1.00 0.00 H ATOM 18415 H2 WAT 2184 67.319 0.150 89.671 1.00 0.00 H TER 18417 WAT 2184 ATOM 18417 O WAT 2185 113.156 26.555 80.901 1.00 0.00 O ATOM 18418 H1 WAT 2185 112.322 26.106 81.037 1.00 0.00 H ATOM 18419 H2 WAT 2185 113.304 26.504 79.956 1.00 0.00 H TER 18421 WAT 2185 ATOM 18421 O WAT 2186 95.023 45.355 92.372 1.00 0.00 O ATOM 18422 H1 WAT 2186 94.400 44.999 93.006 1.00 0.00 H ATOM 18423 H2 WAT 2186 95.853 44.931 92.589 1.00 0.00 H TER 18425 WAT 2186 ATOM 18425 O WAT 2187 81.184 18.154 146.915 1.00 0.00 O ATOM 18426 H1 WAT 2187 81.091 19.099 147.035 1.00 0.00 H ATOM 18427 H2 WAT 2187 81.388 17.820 147.788 1.00 0.00 H TER 18429 WAT 2187 ATOM 18429 O WAT 2188 137.980 34.326 113.998 1.00 0.00 O ATOM 18430 H1 WAT 2188 138.886 34.248 113.699 1.00 0.00 H ATOM 18431 H2 WAT 2188 137.601 35.004 113.439 1.00 0.00 H TER 18433 WAT 2188 ATOM 18433 O WAT 2189 95.064 33.493 158.331 1.00 0.00 O ATOM 18434 H1 WAT 2189 95.410 33.703 159.198 1.00 0.00 H ATOM 18435 H2 WAT 2189 95.493 32.670 158.095 1.00 0.00 H TER 18437 WAT 2189 ATOM 18437 O WAT 2190 44.863 10.226 132.070 1.00 0.00 O ATOM 18438 H1 WAT 2190 45.379 11.009 132.266 1.00 0.00 H ATOM 18439 H2 WAT 2190 45.454 9.497 132.258 1.00 0.00 H TER 18441 WAT 2190 ATOM 18441 O WAT 2191 71.917 59.229 2.244 1.00 0.00 O ATOM 18442 H1 WAT 2191 72.619 59.150 2.890 1.00 0.00 H ATOM 18443 H2 WAT 2191 71.116 59.269 2.766 1.00 0.00 H TER 18445 WAT 2191 ATOM 18445 O WAT 2192 53.546 4.955 133.746 1.00 0.00 O ATOM 18446 H1 WAT 2192 52.712 5.360 133.983 1.00 0.00 H ATOM 18447 H2 WAT 2192 53.422 4.663 132.842 1.00 0.00 H TER 18449 WAT 2192 ATOM 18449 O WAT 2193 45.530 84.797 20.438 1.00 0.00 O ATOM 18450 H1 WAT 2193 46.075 84.022 20.574 1.00 0.00 H ATOM 18451 H2 WAT 2193 45.754 85.096 19.557 1.00 0.00 H TER 18453 WAT 2193 ATOM 18453 O WAT 2194 72.021 62.466 85.845 1.00 0.00 O ATOM 18454 H1 WAT 2194 72.887 62.083 85.989 1.00 0.00 H ATOM 18455 H2 WAT 2194 71.890 62.411 84.899 1.00 0.00 H TER 18457 WAT 2194 ATOM 18457 O WAT 2195 85.986 124.772 143.854 1.00 0.00 O ATOM 18458 H1 WAT 2195 85.655 123.906 143.614 1.00 0.00 H ATOM 18459 H2 WAT 2195 86.724 124.592 144.438 1.00 0.00 H TER 18461 WAT 2195 ATOM 18461 O WAT 2196 86.078 74.784 77.979 1.00 0.00 O ATOM 18462 H1 WAT 2196 85.324 74.197 77.932 1.00 0.00 H ATOM 18463 H2 WAT 2196 85.937 75.294 78.777 1.00 0.00 H TER 18465 WAT 2196 ATOM 18465 O WAT 2197 80.501 36.874 9.040 1.00 0.00 O ATOM 18466 H1 WAT 2197 79.917 36.117 8.996 1.00 0.00 H ATOM 18467 H2 WAT 2197 81.286 36.546 9.479 1.00 0.00 H TER 18469 WAT 2197 ATOM 18469 O WAT 2198 7.358 20.927 151.198 1.00 0.00 O ATOM 18470 H1 WAT 2198 8.105 21.507 151.347 1.00 0.00 H ATOM 18471 H2 WAT 2198 7.014 21.193 150.345 1.00 0.00 H TER 18473 WAT 2198 ATOM 18473 O WAT 2199 27.412 96.041 65.951 1.00 0.00 O ATOM 18474 H1 WAT 2199 27.637 96.441 65.111 1.00 0.00 H ATOM 18475 H2 WAT 2199 27.089 96.768 66.483 1.00 0.00 H TER 18477 WAT 2199 ATOM 18477 O WAT 2200 130.677 73.119 0.232 1.00 0.00 O ATOM 18478 H1 WAT 2200 130.062 72.784 0.884 1.00 0.00 H ATOM 18479 H2 WAT 2200 130.721 74.059 0.404 1.00 0.00 H TER 18481 WAT 2200 ATOM 18481 O WAT 2201 42.912 59.482 17.125 1.00 0.00 O ATOM 18482 H1 WAT 2201 42.671 59.604 18.043 1.00 0.00 H ATOM 18483 H2 WAT 2201 43.183 58.565 17.068 1.00 0.00 H TER 18485 WAT 2201 ATOM 18485 O WAT 2202 49.945 62.338 6.118 1.00 0.00 O ATOM 18486 H1 WAT 2202 49.537 62.818 6.838 1.00 0.00 H ATOM 18487 H2 WAT 2202 50.028 62.983 5.416 1.00 0.00 H TER 18489 WAT 2202 ATOM 18489 O WAT 2203 51.852 145.464 83.162 1.00 0.00 O ATOM 18490 H1 WAT 2203 52.187 144.806 82.552 1.00 0.00 H ATOM 18491 H2 WAT 2203 51.661 146.224 82.612 1.00 0.00 H TER 18493 WAT 2203 ATOM 18493 O WAT 2204 1.446 98.240 0.643 1.00 0.00 O ATOM 18494 H1 WAT 2204 0.799 97.918 0.016 1.00 0.00 H ATOM 18495 H2 WAT 2204 1.521 97.538 1.290 1.00 0.00 H TER 18497 WAT 2204 ATOM 18497 O WAT 2205 61.959 48.756 80.743 1.00 0.00 O ATOM 18498 H1 WAT 2205 61.066 48.742 80.400 1.00 0.00 H ATOM 18499 H2 WAT 2205 62.074 49.646 81.077 1.00 0.00 H TER 18501 WAT 2205 ATOM 18501 O WAT 2206 59.810 45.824 82.702 1.00 0.00 O ATOM 18502 H1 WAT 2206 59.688 45.347 83.523 1.00 0.00 H ATOM 18503 H2 WAT 2206 59.027 46.368 82.622 1.00 0.00 H TER 18505 WAT 2206 ATOM 18505 O WAT 2207 19.081 76.923 108.803 1.00 0.00 O ATOM 18506 H1 WAT 2207 18.646 76.940 109.655 1.00 0.00 H ATOM 18507 H2 WAT 2207 19.360 76.013 108.695 1.00 0.00 H TER 18509 WAT 2207 ATOM 18509 O WAT 2208 65.761 7.879 149.905 1.00 0.00 O ATOM 18510 H1 WAT 2208 65.125 7.262 149.542 1.00 0.00 H ATOM 18511 H2 WAT 2208 66.451 7.929 149.243 1.00 0.00 H TER 18513 WAT 2208 ATOM 18513 O WAT 2209 48.660 136.803 99.249 1.00 0.00 O ATOM 18514 H1 WAT 2209 48.577 137.741 99.082 1.00 0.00 H ATOM 18515 H2 WAT 2209 48.050 136.395 98.635 1.00 0.00 H TER 18517 WAT 2209 ATOM 18517 O WAT 2210 123.798 0.466 127.423 1.00 0.00 O ATOM 18518 H1 WAT 2210 122.945 0.345 127.006 1.00 0.00 H ATOM 18519 H2 WAT 2210 123.699 1.263 127.944 1.00 0.00 H TER 18521 WAT 2210 ATOM 18521 O WAT 2211 124.372 51.428 132.079 1.00 0.00 O ATOM 18522 H1 WAT 2211 125.313 51.606 132.086 1.00 0.00 H ATOM 18523 H2 WAT 2211 123.965 52.287 132.188 1.00 0.00 H TER 18525 WAT 2211 ATOM 18525 O WAT 2212 9.928 93.140 22.053 1.00 0.00 O ATOM 18526 H1 WAT 2212 9.960 92.984 21.109 1.00 0.00 H ATOM 18527 H2 WAT 2212 10.145 94.068 22.150 1.00 0.00 H TER 18529 WAT 2212 ATOM 18529 O WAT 2213 84.123 109.683 125.434 1.00 0.00 O ATOM 18530 H1 WAT 2213 84.041 110.295 124.702 1.00 0.00 H ATOM 18531 H2 WAT 2213 83.639 110.098 126.148 1.00 0.00 H TER 18533 WAT 2213 ATOM 18533 O WAT 2214 133.709 145.750 148.386 1.00 0.00 O ATOM 18534 H1 WAT 2214 134.455 146.317 148.190 1.00 0.00 H ATOM 18535 H2 WAT 2214 133.861 145.457 149.284 1.00 0.00 H TER 18537 WAT 2214 ATOM 18537 O WAT 2215 141.643 27.393 133.527 1.00 0.00 O ATOM 18538 H1 WAT 2215 142.386 27.322 134.127 1.00 0.00 H ATOM 18539 H2 WAT 2215 140.882 27.166 134.060 1.00 0.00 H TER 18541 WAT 2215 ATOM 18541 O WAT 2216 124.853 96.823 67.900 1.00 0.00 O ATOM 18542 H1 WAT 2216 125.612 96.461 67.443 1.00 0.00 H ATOM 18543 H2 WAT 2216 124.217 96.998 67.207 1.00 0.00 H TER 18545 WAT 2216 ATOM 18545 O WAT 2217 118.549 17.461 108.244 1.00 0.00 O ATOM 18546 H1 WAT 2217 119.047 16.951 107.605 1.00 0.00 H ATOM 18547 H2 WAT 2217 118.973 18.319 108.247 1.00 0.00 H TER 18549 WAT 2217 ATOM 18549 O WAT 2218 26.609 101.892 155.926 1.00 0.00 O ATOM 18550 H1 WAT 2218 26.697 102.397 156.734 1.00 0.00 H ATOM 18551 H2 WAT 2218 27.467 101.486 155.802 1.00 0.00 H TER 18553 WAT 2218 ATOM 18553 O WAT 2219 116.432 77.715 112.894 1.00 0.00 O ATOM 18554 H1 WAT 2219 116.323 78.502 113.428 1.00 0.00 H ATOM 18555 H2 WAT 2219 116.021 77.019 113.407 1.00 0.00 H TER 18557 WAT 2219 ATOM 18557 O WAT 2220 70.852 77.747 68.986 1.00 0.00 O ATOM 18558 H1 WAT 2220 70.880 76.943 69.505 1.00 0.00 H ATOM 18559 H2 WAT 2220 70.120 77.618 68.383 1.00 0.00 H TER 18561 WAT 2220 ATOM 18561 O WAT 2221 44.267 53.838 88.609 1.00 0.00 O ATOM 18562 H1 WAT 2221 45.062 54.164 88.189 1.00 0.00 H ATOM 18563 H2 WAT 2221 44.254 52.903 88.405 1.00 0.00 H TER 18565 WAT 2221 ATOM 18565 O WAT 2222 24.727 71.481 3.378 1.00 0.00 O ATOM 18566 H1 WAT 2222 24.820 72.194 2.746 1.00 0.00 H ATOM 18567 H2 WAT 2222 25.185 71.792 4.159 1.00 0.00 H TER 18569 WAT 2222 ATOM 18569 O WAT 2223 122.421 103.317 5.512 1.00 0.00 O ATOM 18570 H1 WAT 2223 122.150 103.833 4.753 1.00 0.00 H ATOM 18571 H2 WAT 2223 123.070 102.705 5.166 1.00 0.00 H TER 18573 WAT 2223 ATOM 18573 O WAT 2224 113.833 124.566 84.778 1.00 0.00 O ATOM 18574 H1 WAT 2224 114.400 125.328 84.664 1.00 0.00 H ATOM 18575 H2 WAT 2224 112.983 124.933 85.023 1.00 0.00 H TER 18577 WAT 2224 ATOM 18577 O WAT 2225 107.178 106.677 22.658 1.00 0.00 O ATOM 18578 H1 WAT 2225 107.932 106.787 23.236 1.00 0.00 H ATOM 18579 H2 WAT 2225 106.503 106.290 23.216 1.00 0.00 H TER 18581 WAT 2225 ATOM 18581 O WAT 2226 35.227 82.216 149.796 1.00 0.00 O ATOM 18582 H1 WAT 2226 34.955 82.721 150.562 1.00 0.00 H ATOM 18583 H2 WAT 2226 34.407 81.951 149.380 1.00 0.00 H TER 18585 WAT 2226 ATOM 18585 O WAT 2227 144.939 41.582 134.719 1.00 0.00 O ATOM 18586 H1 WAT 2227 145.021 40.939 135.424 1.00 0.00 H ATOM 18587 H2 WAT 2227 144.170 41.299 134.225 1.00 0.00 H TER 18589 WAT 2227 ATOM 18589 O WAT 2228 109.143 143.246 7.608 1.00 0.00 O ATOM 18590 H1 WAT 2228 109.686 142.714 8.190 1.00 0.00 H ATOM 18591 H2 WAT 2228 109.568 144.103 7.601 1.00 0.00 H TER 18593 WAT 2228 ATOM 18593 O WAT 2229 116.622 25.710 127.799 1.00 0.00 O ATOM 18594 H1 WAT 2229 116.762 25.235 128.618 1.00 0.00 H ATOM 18595 H2 WAT 2229 116.567 26.629 128.060 1.00 0.00 H TER 18597 WAT 2229 ATOM 18597 O WAT 2230 15.289 28.740 75.101 1.00 0.00 O ATOM 18598 H1 WAT 2230 15.146 27.816 75.305 1.00 0.00 H ATOM 18599 H2 WAT 2230 15.473 29.146 75.948 1.00 0.00 H TER 18601 WAT 2230 ATOM 18601 O WAT 2231 37.955 56.072 79.834 1.00 0.00 O ATOM 18602 H1 WAT 2231 38.226 55.736 80.689 1.00 0.00 H ATOM 18603 H2 WAT 2231 37.605 56.943 80.018 1.00 0.00 H TER 18605 WAT 2231 ATOM 18605 O WAT 2232 58.977 43.800 97.699 1.00 0.00 O ATOM 18606 H1 WAT 2232 59.554 43.961 98.445 1.00 0.00 H ATOM 18607 H2 WAT 2232 59.035 44.599 97.175 1.00 0.00 H TER 18609 WAT 2232 ATOM 18609 O WAT 2233 129.186 69.123 104.094 1.00 0.00 O ATOM 18610 H1 WAT 2233 129.226 69.920 104.622 1.00 0.00 H ATOM 18611 H2 WAT 2233 129.078 68.418 104.732 1.00 0.00 H TER 18613 WAT 2233 ATOM 18613 O WAT 2234 115.198 108.428 109.707 1.00 0.00 O ATOM 18614 H1 WAT 2234 114.299 108.300 110.012 1.00 0.00 H ATOM 18615 H2 WAT 2234 115.361 107.685 109.126 1.00 0.00 H TER 18617 WAT 2234 ATOM 18617 O WAT 2235 98.973 29.583 99.049 1.00 0.00 O ATOM 18618 H1 WAT 2235 98.654 30.369 99.493 1.00 0.00 H ATOM 18619 H2 WAT 2235 99.276 29.896 98.196 1.00 0.00 H TER 18621 WAT 2235 ATOM 18621 O WAT 2236 101.302 94.643 98.765 1.00 0.00 O ATOM 18622 H1 WAT 2236 101.624 93.784 98.494 1.00 0.00 H ATOM 18623 H2 WAT 2236 101.368 94.634 99.720 1.00 0.00 H TER 18625 WAT 2236 ATOM 18625 O WAT 2237 136.091 132.051 14.500 1.00 0.00 O ATOM 18626 H1 WAT 2237 136.981 132.247 14.793 1.00 0.00 H ATOM 18627 H2 WAT 2237 136.129 132.134 13.548 1.00 0.00 H TER 18629 WAT 2237 ATOM 18629 O WAT 2238 8.401 145.834 3.179 1.00 0.00 O ATOM 18630 H1 WAT 2238 8.974 145.166 3.556 1.00 0.00 H ATOM 18631 H2 WAT 2238 7.526 145.600 3.489 1.00 0.00 H TER 18633 WAT 2238 ATOM 18633 O WAT 2239 22.256 45.876 144.691 1.00 0.00 O ATOM 18634 H1 WAT 2239 22.634 46.264 143.902 1.00 0.00 H ATOM 18635 H2 WAT 2239 21.360 45.650 144.442 1.00 0.00 H TER 18637 WAT 2239 ATOM 18637 O WAT 2240 38.058 47.261 133.280 1.00 0.00 O ATOM 18638 H1 WAT 2240 38.340 46.376 133.510 1.00 0.00 H ATOM 18639 H2 WAT 2240 37.892 47.686 134.122 1.00 0.00 H TER 18641 WAT 2240 ATOM 18641 O WAT 2241 9.300 77.379 21.138 1.00 0.00 O ATOM 18642 H1 WAT 2241 8.651 76.733 21.417 1.00 0.00 H ATOM 18643 H2 WAT 2241 8.789 78.052 20.687 1.00 0.00 H TER 18645 WAT 2241 ATOM 18645 O WAT 2242 56.973 0.970 60.234 1.00 0.00 O ATOM 18646 H1 WAT 2242 57.562 1.718 60.141 1.00 0.00 H ATOM 18647 H2 WAT 2242 56.172 1.340 60.605 1.00 0.00 H TER 18649 WAT 2242 ATOM 18649 O WAT 2243 117.692 15.450 14.892 1.00 0.00 O ATOM 18650 H1 WAT 2243 116.945 14.935 14.585 1.00 0.00 H ATOM 18651 H2 WAT 2243 117.468 15.682 15.793 1.00 0.00 H TER 18653 WAT 2243 ATOM 18653 O WAT 2244 73.508 22.591 139.340 1.00 0.00 O ATOM 18654 H1 WAT 2244 72.765 22.203 138.877 1.00 0.00 H ATOM 18655 H2 WAT 2244 74.030 21.841 139.626 1.00 0.00 H TER 18657 WAT 2244 ATOM 18657 O WAT 2245 101.844 108.783 2.070 1.00 0.00 O ATOM 18658 H1 WAT 2245 101.120 108.918 2.681 1.00 0.00 H ATOM 18659 H2 WAT 2245 102.623 109.052 2.557 1.00 0.00 H TER 18661 WAT 2245 ATOM 18661 O WAT 2246 42.054 22.067 72.062 1.00 0.00 O ATOM 18662 H1 WAT 2246 42.011 21.145 71.806 1.00 0.00 H ATOM 18663 H2 WAT 2246 41.140 22.324 72.186 1.00 0.00 H TER 18665 WAT 2246 ATOM 18665 O WAT 2247 24.862 42.770 74.402 1.00 0.00 O ATOM 18666 H1 WAT 2247 24.329 42.785 75.197 1.00 0.00 H ATOM 18667 H2 WAT 2247 25.030 41.841 74.244 1.00 0.00 H TER 18669 WAT 2247 ATOM 18669 O WAT 2248 20.263 118.544 144.227 1.00 0.00 O ATOM 18670 H1 WAT 2248 19.536 118.908 143.722 1.00 0.00 H ATOM 18671 H2 WAT 2248 21.046 118.927 143.831 1.00 0.00 H TER 18673 WAT 2248 ATOM 18673 O WAT 2249 84.101 131.385 89.320 1.00 0.00 O ATOM 18674 H1 WAT 2249 84.507 130.590 88.976 1.00 0.00 H ATOM 18675 H2 WAT 2249 84.653 131.635 90.061 1.00 0.00 H TER 18677 WAT 2249 ATOM 18677 O WAT 2250 6.143 87.805 63.942 1.00 0.00 O ATOM 18678 H1 WAT 2250 5.943 88.692 63.642 1.00 0.00 H ATOM 18679 H2 WAT 2250 6.924 87.556 63.447 1.00 0.00 H TER 18681 WAT 2250 ATOM 18681 O WAT 2251 28.120 134.121 2.474 1.00 0.00 O ATOM 18682 H1 WAT 2251 28.108 135.008 2.832 1.00 0.00 H ATOM 18683 H2 WAT 2251 29.048 133.926 2.347 1.00 0.00 H TER 18685 WAT 2251 ATOM 18685 O WAT 2252 14.166 61.657 73.680 1.00 0.00 O ATOM 18686 H1 WAT 2252 14.112 61.575 74.632 1.00 0.00 H ATOM 18687 H2 WAT 2252 13.567 60.988 73.348 1.00 0.00 H TER 18689 WAT 2252 ATOM 18689 O WAT 2253 76.367 72.945 1.872 1.00 0.00 O ATOM 18690 H1 WAT 2253 76.290 72.787 2.812 1.00 0.00 H ATOM 18691 H2 WAT 2253 75.470 73.108 1.581 1.00 0.00 H TER 18693 WAT 2253 ATOM 18693 O WAT 2254 41.586 125.031 129.170 1.00 0.00 O ATOM 18694 H1 WAT 2254 42.061 124.884 129.988 1.00 0.00 H ATOM 18695 H2 WAT 2254 41.798 125.932 128.929 1.00 0.00 H TER 18697 WAT 2254 ATOM 18697 O WAT 2255 142.053 19.019 157.142 1.00 0.00 O ATOM 18698 H1 WAT 2255 142.573 18.217 157.201 1.00 0.00 H ATOM 18699 H2 WAT 2255 141.199 18.777 157.500 1.00 0.00 H TER 18701 WAT 2255 ATOM 18701 O WAT 2256 144.380 137.877 141.909 1.00 0.00 O ATOM 18702 H1 WAT 2256 144.776 138.435 141.239 1.00 0.00 H ATOM 18703 H2 WAT 2256 144.459 138.382 142.718 1.00 0.00 H TER 18705 WAT 2256 ATOM 18705 O WAT 2257 39.304 33.741 145.570 1.00 0.00 O ATOM 18706 H1 WAT 2257 38.863 34.430 145.073 1.00 0.00 H ATOM 18707 H2 WAT 2257 38.599 33.150 145.837 1.00 0.00 H TER 18709 WAT 2257 ATOM 18709 O WAT 2258 3.940 8.039 152.007 1.00 0.00 O ATOM 18710 H1 WAT 2258 2.990 8.112 152.094 1.00 0.00 H ATOM 18711 H2 WAT 2258 4.105 7.097 151.962 1.00 0.00 H TER 18713 WAT 2258 ATOM 18713 O WAT 2259 78.313 119.499 119.279 1.00 0.00 O ATOM 18714 H1 WAT 2259 78.767 119.255 120.085 1.00 0.00 H ATOM 18715 H2 WAT 2259 78.451 118.756 118.691 1.00 0.00 H TER 18717 WAT 2259 ATOM 18717 O WAT 2260 54.396 8.267 77.573 1.00 0.00 O ATOM 18718 H1 WAT 2260 54.924 8.404 78.360 1.00 0.00 H ATOM 18719 H2 WAT 2260 54.542 7.350 77.343 1.00 0.00 H TER 18721 WAT 2260 ATOM 18721 O WAT 2261 20.314 28.588 116.770 1.00 0.00 O ATOM 18722 H1 WAT 2261 20.682 28.007 117.436 1.00 0.00 H ATOM 18723 H2 WAT 2261 21.035 29.171 116.535 1.00 0.00 H TER 18725 WAT 2261 ATOM 18725 O WAT 2262 41.973 99.559 147.074 1.00 0.00 O ATOM 18726 H1 WAT 2262 42.071 100.032 147.900 1.00 0.00 H ATOM 18727 H2 WAT 2262 42.486 98.759 147.194 1.00 0.00 H TER 18729 WAT 2262 ATOM 18729 O WAT 2263 102.009 95.747 0.176 1.00 0.00 O ATOM 18730 H1 WAT 2263 102.389 95.371 0.970 1.00 0.00 H ATOM 18731 H2 WAT 2263 101.074 95.813 0.366 1.00 0.00 H TER 18733 WAT 2263 ATOM 18733 O WAT 2264 61.504 111.477 117.698 1.00 0.00 O ATOM 18734 H1 WAT 2264 61.833 112.376 117.710 1.00 0.00 H ATOM 18735 H2 WAT 2264 61.970 111.061 116.974 1.00 0.00 H TER 18737 WAT 2264 ATOM 18737 O WAT 2265 26.935 73.392 73.869 1.00 0.00 O ATOM 18738 H1 WAT 2265 27.461 72.600 73.980 1.00 0.00 H ATOM 18739 H2 WAT 2265 26.708 73.399 72.939 1.00 0.00 H TER 18741 WAT 2265 ATOM 18741 O WAT 2266 26.951 70.771 118.662 1.00 0.00 O ATOM 18742 H1 WAT 2266 26.624 70.076 118.090 1.00 0.00 H ATOM 18743 H2 WAT 2266 26.170 71.109 119.099 1.00 0.00 H TER 18745 WAT 2266 ATOM 18745 O WAT 2267 84.504 88.009 5.162 1.00 0.00 O ATOM 18746 H1 WAT 2267 84.774 87.098 5.273 1.00 0.00 H ATOM 18747 H2 WAT 2267 83.800 88.130 5.798 1.00 0.00 H TER 18749 WAT 2267 ATOM 18749 O WAT 2268 20.826 101.825 145.984 1.00 0.00 O ATOM 18750 H1 WAT 2268 20.927 102.005 146.918 1.00 0.00 H ATOM 18751 H2 WAT 2268 20.407 102.610 145.632 1.00 0.00 H TER 18753 WAT 2268 ATOM 18753 O WAT 2269 89.910 122.154 145.825 1.00 0.00 O ATOM 18754 H1 WAT 2269 89.853 121.771 144.950 1.00 0.00 H ATOM 18755 H2 WAT 2269 89.316 122.904 145.798 1.00 0.00 H TER 18757 WAT 2269 ATOM 18757 O WAT 2270 4.287 5.482 89.657 1.00 0.00 O ATOM 18758 H1 WAT 2270 3.463 4.999 89.722 1.00 0.00 H ATOM 18759 H2 WAT 2270 4.604 5.536 90.558 1.00 0.00 H TER 18761 WAT 2270 ATOM 18761 O WAT 2271 7.929 98.942 56.366 1.00 0.00 O ATOM 18762 H1 WAT 2271 7.321 98.677 55.676 1.00 0.00 H ATOM 18763 H2 WAT 2271 8.618 99.422 55.907 1.00 0.00 H TER 18765 WAT 2271 ATOM 18765 O WAT 2272 94.377 87.199 132.227 1.00 0.00 O ATOM 18766 H1 WAT 2272 93.463 87.468 132.138 1.00 0.00 H ATOM 18767 H2 WAT 2272 94.773 87.413 131.382 1.00 0.00 H TER 18769 WAT 2272 ATOM 18769 O WAT 2273 131.461 26.523 141.556 1.00 0.00 O ATOM 18770 H1 WAT 2273 130.867 26.998 140.975 1.00 0.00 H ATOM 18771 H2 WAT 2273 131.904 27.208 142.057 1.00 0.00 H TER 18773 WAT 2273 ATOM 18773 O WAT 2274 84.194 36.017 118.117 1.00 0.00 O ATOM 18774 H1 WAT 2274 83.937 35.820 119.018 1.00 0.00 H ATOM 18775 H2 WAT 2274 83.846 35.288 117.604 1.00 0.00 H TER 18777 WAT 2274 ATOM 18777 O WAT 2275 26.157 53.910 59.684 1.00 0.00 O ATOM 18778 H1 WAT 2275 26.909 53.864 59.092 1.00 0.00 H ATOM 18779 H2 WAT 2275 26.490 54.360 60.460 1.00 0.00 H TER 18781 WAT 2275 ATOM 18781 O WAT 2276 112.338 111.951 130.282 1.00 0.00 O ATOM 18782 H1 WAT 2276 112.989 112.652 130.300 1.00 0.00 H ATOM 18783 H2 WAT 2276 112.708 111.266 130.838 1.00 0.00 H TER 18785 WAT 2276 ATOM 18785 O WAT 2277 0.183 96.994 110.789 1.00 0.00 O ATOM 18786 H1 WAT 2277 -0.349 97.789 110.742 1.00 0.00 H ATOM 18787 H2 WAT 2277 0.791 97.155 111.509 1.00 0.00 H TER 18789 WAT 2277 ATOM 18789 O WAT 2278 144.866 87.309 147.390 1.00 0.00 O ATOM 18790 H1 WAT 2278 144.392 87.540 146.592 1.00 0.00 H ATOM 18791 H2 WAT 2278 144.226 86.832 147.919 1.00 0.00 H TER 18793 WAT 2278 ATOM 18793 O WAT 2279 134.922 107.633 132.281 1.00 0.00 O ATOM 18794 H1 WAT 2279 135.162 108.225 131.568 1.00 0.00 H ATOM 18795 H2 WAT 2279 134.934 106.762 131.884 1.00 0.00 H TER 18797 WAT 2279 ATOM 18797 O WAT 2280 47.722 128.804 104.194 1.00 0.00 O ATOM 18798 H1 WAT 2280 47.339 128.702 103.322 1.00 0.00 H ATOM 18799 H2 WAT 2280 48.636 129.034 104.028 1.00 0.00 H TER 18801 WAT 2280 ATOM 18801 O WAT 2281 21.197 82.648 2.014 1.00 0.00 O ATOM 18802 H1 WAT 2281 22.069 82.479 2.373 1.00 0.00 H ATOM 18803 H2 WAT 2281 20.766 81.793 2.019 1.00 0.00 H TER 18805 WAT 2281 ATOM 18805 O WAT 2282 22.569 32.427 99.249 1.00 0.00 O ATOM 18806 H1 WAT 2282 22.065 31.789 98.743 1.00 0.00 H ATOM 18807 H2 WAT 2282 21.910 33.007 99.628 1.00 0.00 H TER 18809 WAT 2282 ATOM 18809 O WAT 2283 15.148 5.020 157.681 1.00 0.00 O ATOM 18810 H1 WAT 2283 15.641 5.063 156.862 1.00 0.00 H ATOM 18811 H2 WAT 2283 14.394 5.592 157.536 1.00 0.00 H TER 18813 WAT 2283 ATOM 18813 O WAT 2284 91.452 61.852 139.080 1.00 0.00 O ATOM 18814 H1 WAT 2284 91.147 60.974 138.850 1.00 0.00 H ATOM 18815 H2 WAT 2284 90.674 62.293 139.422 1.00 0.00 H TER 18817 WAT 2284 ATOM 18817 O WAT 2285 24.347 77.136 59.706 1.00 0.00 O ATOM 18818 H1 WAT 2285 23.884 76.557 59.101 1.00 0.00 H ATOM 18819 H2 WAT 2285 24.377 76.647 60.529 1.00 0.00 H TER 18821 WAT 2285 ATOM 18821 O WAT 2286 68.864 133.417 14.155 1.00 0.00 O ATOM 18822 H1 WAT 2286 69.765 133.694 14.319 1.00 0.00 H ATOM 18823 H2 WAT 2286 68.795 132.561 14.579 1.00 0.00 H TER 18825 WAT 2286 ATOM 18825 O WAT 2287 67.362 73.955 137.187 1.00 0.00 O ATOM 18826 H1 WAT 2287 66.638 73.650 137.733 1.00 0.00 H ATOM 18827 H2 WAT 2287 67.188 73.577 136.325 1.00 0.00 H TER 18829 WAT 2287 ATOM 18829 O WAT 2288 108.165 17.053 121.057 1.00 0.00 O ATOM 18830 H1 WAT 2288 107.927 17.881 120.641 1.00 0.00 H ATOM 18831 H2 WAT 2288 108.133 16.411 120.348 1.00 0.00 H TER 18833 WAT 2288 ATOM 18833 O WAT 2289 118.214 138.816 17.084 1.00 0.00 O ATOM 18834 H1 WAT 2289 119.076 138.889 17.494 1.00 0.00 H ATOM 18835 H2 WAT 2289 117.597 138.862 17.814 1.00 0.00 H TER 18837 WAT 2289 ATOM 18837 O WAT 2290 14.154 126.227 75.791 1.00 0.00 O ATOM 18838 H1 WAT 2290 13.224 126.453 75.772 1.00 0.00 H ATOM 18839 H2 WAT 2290 14.261 125.597 75.078 1.00 0.00 H TER 18841 WAT 2290 ATOM 18841 O WAT 2291 18.182 139.680 133.131 1.00 0.00 O ATOM 18842 H1 WAT 2291 18.582 139.193 132.410 1.00 0.00 H ATOM 18843 H2 WAT 2291 17.734 140.412 132.707 1.00 0.00 H TER 18845 WAT 2291 ATOM 18845 O WAT 2292 19.125 104.839 92.117 1.00 0.00 O ATOM 18846 H1 WAT 2292 18.280 105.271 91.990 1.00 0.00 H ATOM 18847 H2 WAT 2292 19.769 105.483 91.823 1.00 0.00 H TER 18849 WAT 2292 ATOM 18849 O WAT 2293 122.990 42.704 23.486 1.00 0.00 O ATOM 18850 H1 WAT 2293 122.628 43.481 23.061 1.00 0.00 H ATOM 18851 H2 WAT 2293 123.054 42.055 22.785 1.00 0.00 H TER 18853 WAT 2293 ATOM 18853 O WAT 2294 14.547 34.883 141.344 1.00 0.00 O ATOM 18854 H1 WAT 2294 15.393 34.451 141.467 1.00 0.00 H ATOM 18855 H2 WAT 2294 13.961 34.442 141.959 1.00 0.00 H TER 18857 WAT 2294 ATOM 18857 O WAT 2295 139.807 75.363 5.844 1.00 0.00 O ATOM 18858 H1 WAT 2295 139.489 74.970 6.658 1.00 0.00 H ATOM 18859 H2 WAT 2295 139.949 74.619 5.259 1.00 0.00 H TER 18861 WAT 2295 ATOM 18861 O WAT 2296 107.571 52.248 136.430 1.00 0.00 O ATOM 18862 H1 WAT 2296 108.241 51.759 136.908 1.00 0.00 H ATOM 18863 H2 WAT 2296 107.037 52.652 137.113 1.00 0.00 H TER 18865 WAT 2296 ATOM 18865 O WAT 2297 6.879 30.186 147.198 1.00 0.00 O ATOM 18866 H1 WAT 2297 6.838 30.928 146.595 1.00 0.00 H ATOM 18867 H2 WAT 2297 6.385 30.475 147.966 1.00 0.00 H TER 18869 WAT 2297 ATOM 18869 O WAT 2298 135.497 0.014 108.988 1.00 0.00 O ATOM 18870 H1 WAT 2298 134.676 -0.067 108.504 1.00 0.00 H ATOM 18871 H2 WAT 2298 135.277 0.557 109.745 1.00 0.00 H TER 18873 WAT 2298 ATOM 18873 O WAT 2299 116.944 132.546 118.504 1.00 0.00 O ATOM 18874 H1 WAT 2299 116.903 132.659 117.554 1.00 0.00 H ATOM 18875 H2 WAT 2299 117.534 131.803 118.631 1.00 0.00 H TER 18877 WAT 2299 ATOM 18877 O WAT 2300 14.219 58.041 102.167 1.00 0.00 O ATOM 18878 H1 WAT 2300 14.954 57.875 102.757 1.00 0.00 H ATOM 18879 H2 WAT 2300 14.610 58.052 101.293 1.00 0.00 H TER 18881 WAT 2300 ATOM 18881 O WAT 2301 143.014 3.016 115.427 1.00 0.00 O ATOM 18882 H1 WAT 2301 142.513 2.914 116.236 1.00 0.00 H ATOM 18883 H2 WAT 2301 142.550 2.473 114.789 1.00 0.00 H TER 18885 WAT 2301 ATOM 18885 O WAT 2302 21.314 128.080 17.730 1.00 0.00 O ATOM 18886 H1 WAT 2302 21.493 128.994 17.951 1.00 0.00 H ATOM 18887 H2 WAT 2302 21.381 128.047 16.776 1.00 0.00 H TER 18889 WAT 2302 ATOM 18889 O WAT 2303 142.617 105.783 124.912 1.00 0.00 O ATOM 18890 H1 WAT 2303 142.001 105.081 125.122 1.00 0.00 H ATOM 18891 H2 WAT 2303 142.193 106.578 125.236 1.00 0.00 H TER 18893 WAT 2303 ATOM 18893 O WAT 2304 119.292 18.474 6.079 1.00 0.00 O ATOM 18894 H1 WAT 2304 119.253 19.415 5.907 1.00 0.00 H ATOM 18895 H2 WAT 2304 119.518 18.410 7.007 1.00 0.00 H TER 18897 WAT 2304 ATOM 18897 O WAT 2305 46.977 26.273 64.732 1.00 0.00 O ATOM 18898 H1 WAT 2305 46.864 26.582 65.631 1.00 0.00 H ATOM 18899 H2 WAT 2305 46.207 26.602 64.268 1.00 0.00 H TER 18901 WAT 2305 ATOM 18901 O WAT 2306 131.404 113.098 63.262 1.00 0.00 O ATOM 18902 H1 WAT 2306 131.120 112.185 63.223 1.00 0.00 H ATOM 18903 H2 WAT 2306 131.161 113.462 62.410 1.00 0.00 H TER 18905 WAT 2306 ATOM 18905 O WAT 2307 84.609 116.184 90.854 1.00 0.00 O ATOM 18906 H1 WAT 2307 84.803 115.370 91.317 1.00 0.00 H ATOM 18907 H2 WAT 2307 84.062 115.916 90.116 1.00 0.00 H TER 18909 WAT 2307 ATOM 18909 O WAT 2308 90.666 77.335 151.871 1.00 0.00 O ATOM 18910 H1 WAT 2308 90.125 77.795 152.514 1.00 0.00 H ATOM 18911 H2 WAT 2308 90.052 77.074 151.185 1.00 0.00 H TER 18913 WAT 2308 ATOM 18913 O WAT 2309 27.280 49.628 150.628 1.00 0.00 O ATOM 18914 H1 WAT 2309 27.554 48.737 150.848 1.00 0.00 H ATOM 18915 H2 WAT 2309 27.168 49.615 149.677 1.00 0.00 H TER 18917 WAT 2309 ATOM 18917 O WAT 2310 142.033 73.644 25.601 1.00 0.00 O ATOM 18918 H1 WAT 2310 141.085 73.681 25.475 1.00 0.00 H ATOM 18919 H2 WAT 2310 142.397 73.980 24.782 1.00 0.00 H TER 18921 WAT 2310 ATOM 18921 O WAT 2311 30.108 142.496 15.834 1.00 0.00 O ATOM 18922 H1 WAT 2311 30.131 142.357 16.781 1.00 0.00 H ATOM 18923 H2 WAT 2311 29.205 142.754 15.652 1.00 0.00 H TER 18925 WAT 2311 ATOM 18925 O WAT 2312 55.884 87.605 152.098 1.00 0.00 O ATOM 18926 H1 WAT 2312 55.915 87.540 153.052 1.00 0.00 H ATOM 18927 H2 WAT 2312 55.272 86.919 151.831 1.00 0.00 H TER 18929 WAT 2312 ATOM 18929 O WAT 2313 49.174 87.510 82.057 1.00 0.00 O ATOM 18930 H1 WAT 2313 48.707 88.289 82.358 1.00 0.00 H ATOM 18931 H2 WAT 2313 49.768 87.833 81.379 1.00 0.00 H TER 18933 WAT 2313 ATOM 18933 O WAT 2314 48.411 34.837 130.481 1.00 0.00 O ATOM 18934 H1 WAT 2314 49.199 34.557 130.947 1.00 0.00 H ATOM 18935 H2 WAT 2314 48.127 35.626 130.943 1.00 0.00 H TER 18937 WAT 2314 ATOM 18937 O WAT 2315 0.279 115.741 133.021 1.00 0.00 O ATOM 18938 H1 WAT 2315 1.181 115.475 133.198 1.00 0.00 H ATOM 18939 H2 WAT 2315 0.351 116.643 132.711 1.00 0.00 H TER 18941 WAT 2315 ATOM 18941 O WAT 2316 101.453 116.600 134.187 1.00 0.00 O ATOM 18942 H1 WAT 2316 101.728 116.816 135.078 1.00 0.00 H ATOM 18943 H2 WAT 2316 100.649 117.103 134.056 1.00 0.00 H TER 18945 WAT 2316 ATOM 18945 O WAT 2317 79.373 46.764 155.138 1.00 0.00 O ATOM 18946 H1 WAT 2317 79.560 45.898 154.775 1.00 0.00 H ATOM 18947 H2 WAT 2317 78.606 47.067 154.652 1.00 0.00 H TER 18949 WAT 2317 ATOM 18949 O WAT 2318 75.098 57.202 8.065 1.00 0.00 O ATOM 18950 H1 WAT 2318 75.943 57.601 8.271 1.00 0.00 H ATOM 18951 H2 WAT 2318 74.479 57.932 8.081 1.00 0.00 H TER 18953 WAT 2318 ATOM 18953 O WAT 2319 7.495 28.102 120.195 1.00 0.00 O ATOM 18954 H1 WAT 2319 7.258 29.028 120.146 1.00 0.00 H ATOM 18955 H2 WAT 2319 7.861 27.902 119.333 1.00 0.00 H TER 18957 WAT 2319 ATOM 18957 O WAT 2320 53.272 90.290 87.079 1.00 0.00 O ATOM 18958 H1 WAT 2320 53.375 89.518 87.637 1.00 0.00 H ATOM 18959 H2 WAT 2320 53.758 90.076 86.283 1.00 0.00 H TER 18961 WAT 2320 ATOM 18961 O WAT 2321 14.098 60.798 97.271 1.00 0.00 O ATOM 18962 H1 WAT 2321 13.774 61.551 96.778 1.00 0.00 H ATOM 18963 H2 WAT 2321 14.873 60.511 96.788 1.00 0.00 H TER 18965 WAT 2321 ATOM 18965 O WAT 2322 91.691 108.862 70.185 1.00 0.00 O ATOM 18966 H1 WAT 2322 92.633 108.704 70.116 1.00 0.00 H ATOM 18967 H2 WAT 2322 91.548 109.054 71.112 1.00 0.00 H TER 18969 WAT 2322 ATOM 18969 O WAT 2323 64.110 44.955 81.823 1.00 0.00 O ATOM 18970 H1 WAT 2323 64.166 44.315 81.113 1.00 0.00 H ATOM 18971 H2 WAT 2323 63.191 44.936 82.090 1.00 0.00 H TER 18973 WAT 2323 ATOM 18973 O WAT 2324 25.848 9.332 90.345 1.00 0.00 O ATOM 18974 H1 WAT 2324 24.992 8.918 90.238 1.00 0.00 H ATOM 18975 H2 WAT 2324 25.864 9.616 91.259 1.00 0.00 H TER 18977 WAT 2324 ATOM 18977 O WAT 2325 127.829 61.849 155.750 1.00 0.00 O ATOM 18978 H1 WAT 2325 128.734 61.798 155.444 1.00 0.00 H ATOM 18979 H2 WAT 2325 127.805 61.284 156.522 1.00 0.00 H TER 18981 WAT 2325 ATOM 18981 O WAT 2326 58.965 145.869 102.783 1.00 0.00 O ATOM 18982 H1 WAT 2326 59.586 146.527 102.470 1.00 0.00 H ATOM 18983 H2 WAT 2326 59.473 145.059 102.818 1.00 0.00 H TER 18985 WAT 2326 ATOM 18985 O WAT 2327 22.930 122.288 56.358 1.00 0.00 O ATOM 18986 H1 WAT 2327 22.912 121.577 55.718 1.00 0.00 H ATOM 18987 H2 WAT 2327 22.736 123.075 55.848 1.00 0.00 H TER 18989 WAT 2327 ATOM 18989 O WAT 2328 83.505 102.278 102.165 1.00 0.00 O ATOM 18990 H1 WAT 2328 83.450 101.997 101.251 1.00 0.00 H ATOM 18991 H2 WAT 2328 82.799 102.917 102.262 1.00 0.00 H TER 18993 WAT 2328 ATOM 18993 O WAT 2329 37.783 89.649 115.051 1.00 0.00 O ATOM 18994 H1 WAT 2329 38.473 90.235 115.360 1.00 0.00 H ATOM 18995 H2 WAT 2329 38.131 89.276 114.241 1.00 0.00 H TER 18997 WAT 2329 ATOM 18997 O WAT 2330 124.964 6.564 146.549 1.00 0.00 O ATOM 18998 H1 WAT 2330 125.443 6.040 147.191 1.00 0.00 H ATOM 18999 H2 WAT 2330 124.904 6.002 145.777 1.00 0.00 H TER 19001 WAT 2330 ATOM 19001 O WAT 2331 60.346 10.037 63.095 1.00 0.00 O ATOM 19002 H1 WAT 2331 60.670 9.140 63.180 1.00 0.00 H ATOM 19003 H2 WAT 2331 61.012 10.574 63.526 1.00 0.00 H TER 19005 WAT 2331 ATOM 19005 O WAT 2332 6.679 65.142 87.131 1.00 0.00 O ATOM 19006 H1 WAT 2332 6.783 65.684 87.913 1.00 0.00 H ATOM 19007 H2 WAT 2332 5.772 65.285 86.859 1.00 0.00 H TER 19009 WAT 2332 ATOM 19009 O WAT 2333 20.850 130.097 97.731 1.00 0.00 O ATOM 19010 H1 WAT 2333 21.311 130.079 98.570 1.00 0.00 H ATOM 19011 H2 WAT 2333 20.650 131.021 97.586 1.00 0.00 H TER 19013 WAT 2333 ATOM 19013 O WAT 2334 93.256 107.417 138.814 1.00 0.00 O ATOM 19014 H1 WAT 2334 92.622 106.981 138.245 1.00 0.00 H ATOM 19015 H2 WAT 2334 93.243 106.906 139.623 1.00 0.00 H TER 19017 WAT 2334 ATOM 19017 O WAT 2335 4.896 78.009 143.187 1.00 0.00 O ATOM 19018 H1 WAT 2335 4.504 77.142 143.082 1.00 0.00 H ATOM 19019 H2 WAT 2335 5.835 77.862 143.074 1.00 0.00 H TER 19021 WAT 2335 ATOM 19021 O WAT 2336 27.745 3.179 23.932 1.00 0.00 O ATOM 19022 H1 WAT 2336 27.948 4.047 24.279 1.00 0.00 H ATOM 19023 H2 WAT 2336 28.141 2.572 24.557 1.00 0.00 H TER 19025 WAT 2336 ATOM 19025 O WAT 2337 91.037 122.687 155.535 1.00 0.00 O ATOM 19026 H1 WAT 2337 91.580 121.910 155.664 1.00 0.00 H ATOM 19027 H2 WAT 2337 91.331 123.300 156.209 1.00 0.00 H TER 19029 WAT 2337 ATOM 19029 O WAT 2338 19.227 98.324 75.358 1.00 0.00 O ATOM 19030 H1 WAT 2338 18.790 98.862 74.698 1.00 0.00 H ATOM 19031 H2 WAT 2338 19.294 98.893 76.124 1.00 0.00 H TER 19033 WAT 2338 ATOM 19033 O WAT 2339 118.619 84.872 120.246 1.00 0.00 O ATOM 19034 H1 WAT 2339 118.420 85.642 120.779 1.00 0.00 H ATOM 19035 H2 WAT 2339 117.793 84.390 120.205 1.00 0.00 H TER 19037 WAT 2339 ATOM 19037 O WAT 2340 131.235 5.329 104.411 1.00 0.00 O ATOM 19038 H1 WAT 2340 131.356 4.733 105.150 1.00 0.00 H ATOM 19039 H2 WAT 2340 130.947 6.150 104.809 1.00 0.00 H TER 19041 WAT 2340 ATOM 19041 O WAT 2341 92.498 62.512 104.402 1.00 0.00 O ATOM 19042 H1 WAT 2341 92.706 61.877 105.088 1.00 0.00 H ATOM 19043 H2 WAT 2341 93.204 63.156 104.449 1.00 0.00 H TER 19045 WAT 2341 ATOM 19045 O WAT 2342 141.037 99.665 114.712 1.00 0.00 O ATOM 19046 H1 WAT 2342 140.351 99.053 114.444 1.00 0.00 H ATOM 19047 H2 WAT 2342 140.740 100.514 114.387 1.00 0.00 H TER 19049 WAT 2342 ATOM 19049 O WAT 2343 109.948 50.807 88.740 1.00 0.00 O ATOM 19050 H1 WAT 2343 109.601 50.765 87.849 1.00 0.00 H ATOM 19051 H2 WAT 2343 110.497 50.027 88.819 1.00 0.00 H TER 19053 WAT 2343 ATOM 19053 O WAT 2344 61.359 81.725 101.884 1.00 0.00 O ATOM 19054 H1 WAT 2344 61.784 82.583 101.895 1.00 0.00 H ATOM 19055 H2 WAT 2344 61.996 81.137 102.289 1.00 0.00 H TER 19057 WAT 2344 ATOM 19057 O WAT 2345 53.136 67.932 102.372 1.00 0.00 O ATOM 19058 H1 WAT 2345 53.139 67.129 102.894 1.00 0.00 H ATOM 19059 H2 WAT 2345 52.398 67.824 101.772 1.00 0.00 H TER 19061 WAT 2345 ATOM 19061 O WAT 2346 85.701 39.645 117.025 1.00 0.00 O ATOM 19062 H1 WAT 2346 85.876 40.438 117.532 1.00 0.00 H ATOM 19063 H2 WAT 2346 86.378 39.639 116.348 1.00 0.00 H TER 19065 WAT 2346 ATOM 19065 O WAT 2347 139.981 5.689 117.710 1.00 0.00 O ATOM 19066 H1 WAT 2347 140.845 5.289 117.816 1.00 0.00 H ATOM 19067 H2 WAT 2347 139.825 6.144 118.538 1.00 0.00 H TER 19069 WAT 2347 ATOM 19069 O WAT 2348 106.278 0.483 126.691 1.00 0.00 O ATOM 19070 H1 WAT 2348 106.222 -0.450 126.897 1.00 0.00 H ATOM 19071 H2 WAT 2348 105.477 0.858 127.057 1.00 0.00 H TER 19073 WAT 2348 ATOM 19073 O WAT 2349 133.015 60.026 69.879 1.00 0.00 O ATOM 19074 H1 WAT 2349 133.838 60.056 70.366 1.00 0.00 H ATOM 19075 H2 WAT 2349 133.043 59.192 69.411 1.00 0.00 H TER 19077 WAT 2349 ATOM 19077 O WAT 2350 108.498 12.255 144.474 1.00 0.00 O ATOM 19078 H1 WAT 2350 107.584 12.043 144.660 1.00 0.00 H ATOM 19079 H2 WAT 2350 108.965 11.427 144.591 1.00 0.00 H TER 19081 WAT 2350 ATOM 19081 O WAT 2351 127.801 137.560 129.984 1.00 0.00 O ATOM 19082 H1 WAT 2351 128.479 138.217 129.827 1.00 0.00 H ATOM 19083 H2 WAT 2351 126.996 138.067 130.092 1.00 0.00 H TER 19085 WAT 2351 ATOM 19085 O WAT 2352 109.374 22.898 155.281 1.00 0.00 O ATOM 19086 H1 WAT 2352 109.953 23.592 155.595 1.00 0.00 H ATOM 19087 H2 WAT 2352 109.670 22.112 155.742 1.00 0.00 H TER 19089 WAT 2352 ATOM 19089 O WAT 2353 54.826 62.426 127.406 1.00 0.00 O ATOM 19090 H1 WAT 2353 54.253 62.278 126.654 1.00 0.00 H ATOM 19091 H2 WAT 2353 54.234 62.450 128.158 1.00 0.00 H TER 19093 WAT 2353 ATOM 19093 O WAT 2354 72.597 97.951 79.068 1.00 0.00 O ATOM 19094 H1 WAT 2354 72.917 98.700 79.572 1.00 0.00 H ATOM 19095 H2 WAT 2354 73.345 97.355 79.024 1.00 0.00 H TER 19097 WAT 2354 ATOM 19097 O WAT 2355 87.551 61.137 93.990 1.00 0.00 O ATOM 19098 H1 WAT 2355 87.679 61.071 93.043 1.00 0.00 H ATOM 19099 H2 WAT 2355 88.423 61.325 94.337 1.00 0.00 H TER 19101 WAT 2355 ATOM 19101 O WAT 2356 111.783 110.468 16.984 1.00 0.00 O ATOM 19102 H1 WAT 2356 111.174 111.108 17.352 1.00 0.00 H ATOM 19103 H2 WAT 2356 112.625 110.924 16.963 1.00 0.00 H TER 19105 WAT 2356 ATOM 19105 O WAT 2357 117.846 110.433 9.556 1.00 0.00 O ATOM 19106 H1 WAT 2357 117.416 109.584 9.657 1.00 0.00 H ATOM 19107 H2 WAT 2357 117.767 110.845 10.416 1.00 0.00 H TER 19109 WAT 2357 ATOM 19109 O WAT 2358 35.912 64.465 128.005 1.00 0.00 O ATOM 19110 H1 WAT 2358 36.053 63.802 127.329 1.00 0.00 H ATOM 19111 H2 WAT 2358 34.973 64.648 127.969 1.00 0.00 H TER 19113 WAT 2358 ATOM 19113 O WAT 2359 104.622 118.114 97.816 1.00 0.00 O ATOM 19114 H1 WAT 2359 105.145 118.746 97.323 1.00 0.00 H ATOM 19115 H2 WAT 2359 104.536 117.364 97.227 1.00 0.00 H TER 19117 WAT 2359 ATOM 19117 O WAT 2360 28.532 126.221 98.193 1.00 0.00 O ATOM 19118 H1 WAT 2360 28.751 127.030 97.730 1.00 0.00 H ATOM 19119 H2 WAT 2360 29.364 125.924 98.562 1.00 0.00 H TER 19121 WAT 2360 ATOM 19121 O WAT 2361 102.866 31.473 94.453 1.00 0.00 O ATOM 19122 H1 WAT 2361 103.606 30.891 94.276 1.00 0.00 H ATOM 19123 H2 WAT 2361 103.227 32.355 94.360 1.00 0.00 H TER 19125 WAT 2361 ATOM 19125 O WAT 2362 28.405 65.873 100.242 1.00 0.00 O ATOM 19126 H1 WAT 2362 27.994 66.019 99.389 1.00 0.00 H ATOM 19127 H2 WAT 2362 27.737 66.131 100.877 1.00 0.00 H TER 19129 WAT 2362 ATOM 19129 O WAT 2363 123.827 39.761 67.980 1.00 0.00 O ATOM 19130 H1 WAT 2363 124.634 39.862 67.476 1.00 0.00 H ATOM 19131 H2 WAT 2363 124.010 39.040 68.582 1.00 0.00 H TER 19133 WAT 2363 ATOM 19133 O WAT 2364 26.617 130.306 17.763 1.00 0.00 O ATOM 19134 H1 WAT 2364 26.424 130.025 18.657 1.00 0.00 H ATOM 19135 H2 WAT 2364 25.905 129.940 17.238 1.00 0.00 H TER 19137 WAT 2364 ATOM 19137 O WAT 2365 57.632 121.429 152.329 1.00 0.00 O ATOM 19138 H1 WAT 2365 56.976 121.206 152.990 1.00 0.00 H ATOM 19139 H2 WAT 2365 57.887 120.588 151.951 1.00 0.00 H TER 19141 WAT 2365 ATOM 19141 O WAT 2366 47.313 93.481 68.223 1.00 0.00 O ATOM 19142 H1 WAT 2366 47.040 92.985 68.995 1.00 0.00 H ATOM 19143 H2 WAT 2366 46.495 93.692 67.772 1.00 0.00 H TER 19145 WAT 2366 ATOM 19145 O WAT 2367 118.190 77.589 138.705 1.00 0.00 O ATOM 19146 H1 WAT 2367 117.376 77.395 138.240 1.00 0.00 H ATOM 19147 H2 WAT 2367 118.696 76.779 138.652 1.00 0.00 H TER 19149 WAT 2367 ATOM 19149 O WAT 2368 22.346 57.448 113.289 1.00 0.00 O ATOM 19150 H1 WAT 2368 22.569 58.023 114.021 1.00 0.00 H ATOM 19151 H2 WAT 2368 23.189 57.112 112.984 1.00 0.00 H TER 19153 WAT 2368 ATOM 19153 O WAT 2369 75.492 60.169 136.673 1.00 0.00 O ATOM 19154 H1 WAT 2369 74.870 60.316 137.386 1.00 0.00 H ATOM 19155 H2 WAT 2369 75.505 59.219 136.558 1.00 0.00 H TER 19157 WAT 2369 ATOM 19157 O WAT 2370 28.453 70.536 152.284 1.00 0.00 O ATOM 19158 H1 WAT 2370 28.357 70.022 151.483 1.00 0.00 H ATOM 19159 H2 WAT 2370 27.580 70.894 152.445 1.00 0.00 H TER 19161 WAT 2370 ATOM 19161 O WAT 2371 78.795 47.142 152.213 1.00 0.00 O ATOM 19162 H1 WAT 2371 78.403 47.796 151.633 1.00 0.00 H ATOM 19163 H2 WAT 2371 79.702 47.430 152.319 1.00 0.00 H TER 19165 WAT 2371 ATOM 19165 O WAT 2372 83.411 68.439 122.371 1.00 0.00 O ATOM 19166 H1 WAT 2372 84.331 68.193 122.462 1.00 0.00 H ATOM 19167 H2 WAT 2372 83.164 68.769 123.235 1.00 0.00 H TER 19169 WAT 2372 ATOM 19169 O WAT 2373 125.167 142.143 67.477 1.00 0.00 O ATOM 19170 H1 WAT 2373 124.411 141.938 68.028 1.00 0.00 H ATOM 19171 H2 WAT 2373 124.941 141.785 66.619 1.00 0.00 H TER 19173 WAT 2373 ATOM 19173 O WAT 2374 42.796 56.480 85.830 1.00 0.00 O ATOM 19174 H1 WAT 2374 42.510 57.384 85.962 1.00 0.00 H ATOM 19175 H2 WAT 2374 42.423 56.000 86.569 1.00 0.00 H TER 19177 WAT 2374 ATOM 19177 O WAT 2375 118.874 143.833 86.877 1.00 0.00 O ATOM 19178 H1 WAT 2375 118.053 143.942 87.359 1.00 0.00 H ATOM 19179 H2 WAT 2375 119.358 144.642 87.043 1.00 0.00 H TER 19181 WAT 2375 ATOM 19181 O WAT 2376 53.650 60.483 136.880 1.00 0.00 O ATOM 19182 H1 WAT 2376 53.157 61.299 136.967 1.00 0.00 H ATOM 19183 H2 WAT 2376 53.464 60.004 137.688 1.00 0.00 H TER 19185 WAT 2376 ATOM 19185 O WAT 2377 60.913 131.879 121.671 1.00 0.00 O ATOM 19186 H1 WAT 2377 61.682 132.284 121.272 1.00 0.00 H ATOM 19187 H2 WAT 2377 60.641 132.497 122.349 1.00 0.00 H TER 19189 WAT 2377 ATOM 19189 O WAT 2378 38.985 72.215 78.237 1.00 0.00 O ATOM 19190 H1 WAT 2378 39.473 72.879 77.750 1.00 0.00 H ATOM 19191 H2 WAT 2378 39.413 71.390 78.010 1.00 0.00 H TER 19193 WAT 2378 ATOM 19193 O WAT 2379 5.199 55.149 141.343 1.00 0.00 O ATOM 19194 H1 WAT 2379 5.242 56.104 141.391 1.00 0.00 H ATOM 19195 H2 WAT 2379 4.818 54.969 140.484 1.00 0.00 H TER 19197 WAT 2379 ATOM 19197 O WAT 2380 80.840 110.508 63.557 1.00 0.00 O ATOM 19198 H1 WAT 2380 80.523 111.377 63.311 1.00 0.00 H ATOM 19199 H2 WAT 2380 81.409 110.246 62.833 1.00 0.00 H TER 19201 WAT 2380 ATOM 19201 O WAT 2381 27.090 67.933 113.889 1.00 0.00 O ATOM 19202 H1 WAT 2381 27.912 68.380 114.092 1.00 0.00 H ATOM 19203 H2 WAT 2381 26.412 68.495 114.265 1.00 0.00 H TER 19205 WAT 2381 ATOM 19205 O WAT 2382 89.643 79.839 97.977 1.00 0.00 O ATOM 19206 H1 WAT 2382 90.195 79.615 98.726 1.00 0.00 H ATOM 19207 H2 WAT 2382 89.664 80.795 97.942 1.00 0.00 H TER 19209 WAT 2382 ATOM 19209 O WAT 2383 35.518 129.007 141.039 1.00 0.00 O ATOM 19210 H1 WAT 2383 35.914 128.578 141.797 1.00 0.00 H ATOM 19211 H2 WAT 2383 35.180 129.834 141.381 1.00 0.00 H TER 19213 WAT 2383 ATOM 19213 O WAT 2384 115.719 121.741 56.909 1.00 0.00 O ATOM 19214 H1 WAT 2384 115.348 120.862 56.832 1.00 0.00 H ATOM 19215 H2 WAT 2384 116.497 121.625 57.454 1.00 0.00 H TER 19217 WAT 2384 ATOM 19217 O WAT 2385 71.000 121.679 85.371 1.00 0.00 O ATOM 19218 H1 WAT 2385 70.538 120.983 84.904 1.00 0.00 H ATOM 19219 H2 WAT 2385 71.159 122.349 84.705 1.00 0.00 H TER 19221 WAT 2385 ATOM 19221 O WAT 2386 65.943 81.158 122.336 1.00 0.00 O ATOM 19222 H1 WAT 2386 65.808 82.073 122.090 1.00 0.00 H ATOM 19223 H2 WAT 2386 65.098 80.877 122.688 1.00 0.00 H TER 19225 WAT 2386 ATOM 19225 O WAT 2387 14.059 56.354 96.957 1.00 0.00 O ATOM 19226 H1 WAT 2387 14.909 56.249 96.529 1.00 0.00 H ATOM 19227 H2 WAT 2387 13.423 56.303 96.244 1.00 0.00 H TER 19229 WAT 2387 ATOM 19229 O WAT 2388 114.801 118.079 14.023 1.00 0.00 O ATOM 19230 H1 WAT 2388 114.453 118.920 13.728 1.00 0.00 H ATOM 19231 H2 WAT 2388 115.625 117.980 13.545 1.00 0.00 H TER 19233 WAT 2388 ATOM 19233 O WAT 2389 119.360 52.420 10.797 1.00 0.00 O ATOM 19234 H1 WAT 2389 119.211 51.704 11.414 1.00 0.00 H ATOM 19235 H2 WAT 2389 120.312 52.487 10.733 1.00 0.00 H TER 19237 WAT 2389 ATOM 19237 O WAT 2390 83.323 73.202 126.324 1.00 0.00 O ATOM 19238 H1 WAT 2390 82.724 73.356 125.593 1.00 0.00 H ATOM 19239 H2 WAT 2390 83.918 72.522 126.006 1.00 0.00 H TER 19241 WAT 2390 ATOM 19241 O WAT 2391 74.505 83.103 106.694 1.00 0.00 O ATOM 19242 H1 WAT 2391 73.914 82.492 107.133 1.00 0.00 H ATOM 19243 H2 WAT 2391 74.232 83.966 107.006 1.00 0.00 H TER 19245 WAT 2391 ATOM 19245 O WAT 2392 1.218 27.749 120.114 1.00 0.00 O ATOM 19246 H1 WAT 2392 2.128 27.873 119.843 1.00 0.00 H ATOM 19247 H2 WAT 2392 1.216 26.909 120.573 1.00 0.00 H TER 19249 WAT 2392 ATOM 19249 O WAT 2393 70.597 66.532 24.714 1.00 0.00 O ATOM 19250 H1 WAT 2393 71.460 66.900 24.524 1.00 0.00 H ATOM 19251 H2 WAT 2393 70.504 65.808 24.094 1.00 0.00 H TER 19253 WAT 2393 ATOM 19253 O WAT 2394 20.517 103.022 0.350 1.00 0.00 O ATOM 19254 H1 WAT 2394 20.238 102.478 1.087 1.00 0.00 H ATOM 19255 H2 WAT 2394 19.739 103.530 0.118 1.00 0.00 H TER 19257 WAT 2394 ATOM 19257 O WAT 2395 119.812 44.007 67.456 1.00 0.00 O ATOM 19258 H1 WAT 2395 119.278 44.086 66.666 1.00 0.00 H ATOM 19259 H2 WAT 2395 120.631 44.452 67.237 1.00 0.00 H TER 19261 WAT 2395 ATOM 19261 O WAT 2396 15.978 40.996 121.791 1.00 0.00 O ATOM 19262 H1 WAT 2396 15.296 41.412 121.263 1.00 0.00 H ATOM 19263 H2 WAT 2396 16.079 41.573 122.549 1.00 0.00 H TER 19265 WAT 2396 ATOM 19265 O WAT 2397 143.611 71.249 122.133 1.00 0.00 O ATOM 19266 H1 WAT 2397 144.278 71.850 121.801 1.00 0.00 H ATOM 19267 H2 WAT 2397 143.348 70.736 121.369 1.00 0.00 H TER 19269 WAT 2397 ATOM 19269 O WAT 2398 132.750 136.140 113.198 1.00 0.00 O ATOM 19270 H1 WAT 2398 132.517 135.568 112.466 1.00 0.00 H ATOM 19271 H2 WAT 2398 132.991 136.970 112.786 1.00 0.00 H TER 19273 WAT 2398 ATOM 19273 O WAT 2399 101.683 136.889 120.428 1.00 0.00 O ATOM 19274 H1 WAT 2399 102.227 136.153 120.150 1.00 0.00 H ATOM 19275 H2 WAT 2399 102.251 137.404 121.001 1.00 0.00 H TER 19277 WAT 2399 ATOM 19277 O WAT 2400 86.383 102.839 4.853 1.00 0.00 O ATOM 19278 H1 WAT 2400 86.067 102.669 3.966 1.00 0.00 H ATOM 19279 H2 WAT 2400 87.315 102.625 4.820 1.00 0.00 H TER 19281 WAT 2400 ATOM 19281 O WAT 2401 14.346 0.367 82.410 1.00 0.00 O ATOM 19282 H1 WAT 2401 15.277 0.491 82.593 1.00 0.00 H ATOM 19283 H2 WAT 2401 13.908 0.597 83.229 1.00 0.00 H TER 19285 WAT 2401 ATOM 19285 O WAT 2402 126.231 117.709 108.067 1.00 0.00 O ATOM 19286 H1 WAT 2402 127.010 117.481 107.560 1.00 0.00 H ATOM 19287 H2 WAT 2402 125.575 117.066 107.801 1.00 0.00 H TER 19289 WAT 2402 ATOM 19289 O WAT 2403 76.776 108.761 70.332 1.00 0.00 O ATOM 19290 H1 WAT 2403 76.891 107.836 70.547 1.00 0.00 H ATOM 19291 H2 WAT 2403 77.175 109.229 71.066 1.00 0.00 H TER 19293 WAT 2403 ATOM 19293 O WAT 2404 6.344 130.116 71.158 1.00 0.00 O ATOM 19294 H1 WAT 2404 6.848 130.930 71.190 1.00 0.00 H ATOM 19295 H2 WAT 2404 5.903 130.141 70.309 1.00 0.00 H TER 19297 WAT 2404 ATOM 19297 O WAT 2405 80.719 90.820 66.546 1.00 0.00 O ATOM 19298 H1 WAT 2405 81.412 90.289 66.937 1.00 0.00 H ATOM 19299 H2 WAT 2405 80.910 90.811 65.608 1.00 0.00 H TER 19301 WAT 2405 ATOM 19301 O WAT 2406 105.754 66.305 93.119 1.00 0.00 O ATOM 19302 H1 WAT 2406 104.937 66.614 92.728 1.00 0.00 H ATOM 19303 H2 WAT 2406 105.519 65.481 93.546 1.00 0.00 H TER 19305 WAT 2406 ATOM 19305 O WAT 2407 53.504 95.230 67.419 1.00 0.00 O ATOM 19306 H1 WAT 2407 52.895 95.153 66.685 1.00 0.00 H ATOM 19307 H2 WAT 2407 54.157 95.864 67.124 1.00 0.00 H TER 19309 WAT 2407 ATOM 19309 O WAT 2408 107.973 120.507 142.916 1.00 0.00 O ATOM 19310 H1 WAT 2408 108.866 120.364 142.603 1.00 0.00 H ATOM 19311 H2 WAT 2408 107.894 121.459 142.988 1.00 0.00 H TER 19313 WAT 2408 ATOM 19313 O WAT 2409 39.931 17.423 78.061 1.00 0.00 O ATOM 19314 H1 WAT 2409 39.930 18.353 78.287 1.00 0.00 H ATOM 19315 H2 WAT 2409 40.828 17.246 77.777 1.00 0.00 H TER 19317 WAT 2409 ATOM 19317 O WAT 2410 124.383 27.842 103.215 1.00 0.00 O ATOM 19318 H1 WAT 2410 124.396 27.433 102.350 1.00 0.00 H ATOM 19319 H2 WAT 2410 123.739 28.546 103.137 1.00 0.00 H TER 19321 WAT 2410 ATOM 19321 O WAT 2411 76.988 93.062 15.009 1.00 0.00 O ATOM 19322 H1 WAT 2411 76.968 93.249 14.071 1.00 0.00 H ATOM 19323 H2 WAT 2411 77.689 92.417 15.110 1.00 0.00 H TER 19325 WAT 2411 ATOM 19325 O WAT 2412 48.081 18.082 54.399 1.00 0.00 O ATOM 19326 H1 WAT 2412 48.641 17.410 54.788 1.00 0.00 H ATOM 19327 H2 WAT 2412 47.939 18.713 55.104 1.00 0.00 H TER 19329 WAT 2412 ATOM 19329 O WAT 2413 115.929 0.374 115.902 1.00 0.00 O ATOM 19330 H1 WAT 2413 114.997 0.343 116.117 1.00 0.00 H ATOM 19331 H2 WAT 2413 116.171 1.293 116.017 1.00 0.00 H TER 19333 WAT 2413 ATOM 19333 O WAT 2414 107.808 16.085 124.038 1.00 0.00 O ATOM 19334 H1 WAT 2414 107.379 15.639 124.769 1.00 0.00 H ATOM 19335 H2 WAT 2414 107.417 15.694 123.257 1.00 0.00 H TER 19337 WAT 2414 ATOM 19337 O WAT 2415 58.339 58.211 82.192 1.00 0.00 O ATOM 19338 H1 WAT 2415 58.438 58.697 81.374 1.00 0.00 H ATOM 19339 H2 WAT 2415 57.404 58.261 82.389 1.00 0.00 H TER 19341 WAT 2415 ATOM 19341 O WAT 2416 15.167 113.059 125.501 1.00 0.00 O ATOM 19342 H1 WAT 2416 14.237 113.270 125.420 1.00 0.00 H ATOM 19343 H2 WAT 2416 15.608 113.702 124.946 1.00 0.00 H TER 19345 WAT 2416 ATOM 19345 O WAT 2417 37.818 34.170 8.971 1.00 0.00 O ATOM 19346 H1 WAT 2417 38.331 34.165 8.163 1.00 0.00 H ATOM 19347 H2 WAT 2417 37.186 33.459 8.859 1.00 0.00 H TER 19349 WAT 2417 ATOM 19349 O WAT 2418 123.994 131.889 100.668 1.00 0.00 O ATOM 19350 H1 WAT 2418 124.156 132.104 101.587 1.00 0.00 H ATOM 19351 H2 WAT 2418 123.304 131.226 100.695 1.00 0.00 H TER 19353 WAT 2418 ATOM 19353 O WAT 2419 76.109 126.062 101.795 1.00 0.00 O ATOM 19354 H1 WAT 2419 75.578 125.298 101.570 1.00 0.00 H ATOM 19355 H2 WAT 2419 75.548 126.811 101.594 1.00 0.00 H TER 19357 WAT 2419 ATOM 19357 O WAT 2420 53.751 6.320 60.213 1.00 0.00 O ATOM 19358 H1 WAT 2420 52.829 6.282 60.465 1.00 0.00 H ATOM 19359 H2 WAT 2420 53.770 6.912 59.462 1.00 0.00 H TER 19361 WAT 2420 ATOM 19361 O WAT 2421 116.166 17.609 106.769 1.00 0.00 O ATOM 19362 H1 WAT 2421 116.967 17.431 107.262 1.00 0.00 H ATOM 19363 H2 WAT 2421 115.458 17.353 107.360 1.00 0.00 H TER 19365 WAT 2421 ATOM 19365 O WAT 2422 102.095 20.220 7.448 1.00 0.00 O ATOM 19366 H1 WAT 2422 102.268 19.841 6.587 1.00 0.00 H ATOM 19367 H2 WAT 2422 102.717 19.786 8.031 1.00 0.00 H TER 19369 WAT 2422 ATOM 19369 O WAT 2423 129.112 122.098 68.535 1.00 0.00 O ATOM 19370 H1 WAT 2423 128.975 121.539 69.300 1.00 0.00 H ATOM 19371 H2 WAT 2423 128.441 121.820 67.912 1.00 0.00 H TER 19373 WAT 2423 ATOM 19373 O WAT 2424 73.662 35.059 76.955 1.00 0.00 O ATOM 19374 H1 WAT 2424 74.240 34.306 77.080 1.00 0.00 H ATOM 19375 H2 WAT 2424 73.907 35.667 77.652 1.00 0.00 H TER 19377 WAT 2424 ATOM 19377 O WAT 2425 67.376 2.837 24.769 1.00 0.00 O ATOM 19378 H1 WAT 2425 66.814 2.089 24.972 1.00 0.00 H ATOM 19379 H2 WAT 2425 67.067 3.533 25.349 1.00 0.00 H TER 19381 WAT 2425 ATOM 19381 O WAT 2426 99.443 12.002 115.012 1.00 0.00 O ATOM 19382 H1 WAT 2426 99.585 12.448 115.847 1.00 0.00 H ATOM 19383 H2 WAT 2426 98.526 11.726 115.041 1.00 0.00 H TER 19385 WAT 2426 ATOM 19385 O WAT 2427 69.485 75.882 83.441 1.00 0.00 O ATOM 19386 H1 WAT 2427 68.794 76.493 83.182 1.00 0.00 H ATOM 19387 H2 WAT 2427 70.026 75.787 82.657 1.00 0.00 H TER 19389 WAT 2427 ATOM 19389 O WAT 2428 60.474 137.050 58.570 1.00 0.00 O ATOM 19390 H1 WAT 2428 60.932 136.416 58.018 1.00 0.00 H ATOM 19391 H2 WAT 2428 59.691 136.587 58.867 1.00 0.00 H TER 19393 WAT 2428 ATOM 19393 O WAT 2429 9.419 23.434 6.832 1.00 0.00 O ATOM 19394 H1 WAT 2429 10.037 23.824 7.450 1.00 0.00 H ATOM 19395 H2 WAT 2429 8.564 23.769 7.103 1.00 0.00 H TER 19397 WAT 2429 ATOM 19397 O WAT 2430 123.937 13.497 89.008 1.00 0.00 O ATOM 19398 H1 WAT 2430 123.209 13.241 89.575 1.00 0.00 H ATOM 19399 H2 WAT 2430 124.543 13.956 89.590 1.00 0.00 H TER 19401 WAT 2430 ATOM 19401 O WAT 2431 15.552 25.354 97.745 1.00 0.00 O ATOM 19402 H1 WAT 2431 15.045 25.172 98.537 1.00 0.00 H ATOM 19403 H2 WAT 2431 15.093 26.083 97.328 1.00 0.00 H TER 19405 WAT 2431 ATOM 19405 O WAT 2432 23.385 34.699 128.886 1.00 0.00 O ATOM 19406 H1 WAT 2432 23.267 35.008 129.784 1.00 0.00 H ATOM 19407 H2 WAT 2432 22.589 34.202 128.698 1.00 0.00 H TER 19409 WAT 2432 ATOM 19409 O WAT 2433 52.862 73.881 94.349 1.00 0.00 O ATOM 19410 H1 WAT 2433 53.549 74.546 94.310 1.00 0.00 H ATOM 19411 H2 WAT 2433 52.162 74.288 94.859 1.00 0.00 H TER 19413 WAT 2433 ATOM 19413 O WAT 2434 99.305 112.663 111.928 1.00 0.00 O ATOM 19414 H1 WAT 2434 99.561 113.279 112.613 1.00 0.00 H ATOM 19415 H2 WAT 2434 98.407 112.416 112.150 1.00 0.00 H TER 19417 WAT 2434 ATOM 19417 O WAT 2435 54.879 15.367 62.399 1.00 0.00 O ATOM 19418 H1 WAT 2435 54.431 16.197 62.561 1.00 0.00 H ATOM 19419 H2 WAT 2435 54.462 14.748 62.998 1.00 0.00 H TER 19421 WAT 2435 ATOM 19421 O WAT 2436 70.794 33.198 86.444 1.00 0.00 O ATOM 19422 H1 WAT 2436 70.405 33.983 86.830 1.00 0.00 H ATOM 19423 H2 WAT 2436 71.089 32.684 87.196 1.00 0.00 H TER 19425 WAT 2436 ATOM 19425 O WAT 2437 8.249 58.016 145.639 1.00 0.00 O ATOM 19426 H1 WAT 2437 8.474 58.907 145.907 1.00 0.00 H ATOM 19427 H2 WAT 2437 8.800 57.850 144.873 1.00 0.00 H TER 19429 WAT 2437 ATOM 19429 O WAT 2438 122.913 121.017 106.156 1.00 0.00 O ATOM 19430 H1 WAT 2438 123.198 121.016 107.069 1.00 0.00 H ATOM 19431 H2 WAT 2438 122.081 121.491 106.165 1.00 0.00 H TER 19433 WAT 2438 ATOM 19433 O WAT 2439 142.417 141.919 90.635 1.00 0.00 O ATOM 19434 H1 WAT 2439 142.388 142.212 91.546 1.00 0.00 H ATOM 19435 H2 WAT 2439 143.185 141.350 90.590 1.00 0.00 H TER 19437 WAT 2439 ATOM 19437 O WAT 2440 92.136 23.956 20.916 1.00 0.00 O ATOM 19438 H1 WAT 2440 91.319 23.813 20.439 1.00 0.00 H ATOM 19439 H2 WAT 2440 92.165 24.901 21.064 1.00 0.00 H TER 19441 WAT 2440 ATOM 19441 O WAT 2441 116.769 66.838 66.887 1.00 0.00 O ATOM 19442 H1 WAT 2441 117.136 67.218 66.089 1.00 0.00 H ATOM 19443 H2 WAT 2441 117.520 66.732 67.470 1.00 0.00 H TER 19445 WAT 2441 ATOM 19445 O WAT 2442 -0.053 143.938 121.070 1.00 0.00 O ATOM 19446 H1 WAT 2442 -0.457 143.463 121.796 1.00 0.00 H ATOM 19447 H2 WAT 2442 0.850 144.086 121.352 1.00 0.00 H TER 19449 WAT 2442 ATOM 19449 O WAT 2443 83.417 61.172 17.019 1.00 0.00 O ATOM 19450 H1 WAT 2443 82.764 61.695 17.485 1.00 0.00 H ATOM 19451 H2 WAT 2443 83.535 61.624 16.184 1.00 0.00 H TER 19453 WAT 2443 ATOM 19453 O WAT 2444 143.565 117.208 15.707 1.00 0.00 O ATOM 19454 H1 WAT 2444 144.522 117.184 15.720 1.00 0.00 H ATOM 19455 H2 WAT 2444 143.304 116.801 16.533 1.00 0.00 H TER 19457 WAT 2444 ATOM 19457 O WAT 2445 59.969 62.274 143.446 1.00 0.00 O ATOM 19458 H1 WAT 2445 60.833 62.534 143.125 1.00 0.00 H ATOM 19459 H2 WAT 2445 59.724 62.965 144.062 1.00 0.00 H TER 19461 WAT 2445 ATOM 19461 O WAT 2446 0.680 111.170 56.040 1.00 0.00 O ATOM 19462 H1 WAT 2446 -0.189 111.548 55.903 1.00 0.00 H ATOM 19463 H2 WAT 2446 0.843 111.277 56.977 1.00 0.00 H TER 19465 WAT 2446 ATOM 19465 O WAT 2447 4.049 24.547 89.990 1.00 0.00 O ATOM 19466 H1 WAT 2447 5.001 24.608 90.066 1.00 0.00 H ATOM 19467 H2 WAT 2447 3.734 24.572 90.894 1.00 0.00 H TER 19469 WAT 2447 ATOM 19469 O WAT 2448 25.969 110.556 107.860 1.00 0.00 O ATOM 19470 H1 WAT 2448 25.140 110.525 107.383 1.00 0.00 H ATOM 19471 H2 WAT 2448 26.614 110.814 107.202 1.00 0.00 H TER 19473 WAT 2448 ATOM 19473 O WAT 2449 110.518 15.617 93.742 1.00 0.00 O ATOM 19474 H1 WAT 2449 110.836 16.456 94.076 1.00 0.00 H ATOM 19475 H2 WAT 2449 111.258 15.259 93.251 1.00 0.00 H TER 19477 WAT 2449 ATOM 19477 O WAT 2450 142.931 137.215 94.151 1.00 0.00 O ATOM 19478 H1 WAT 2450 142.010 137.206 93.892 1.00 0.00 H ATOM 19479 H2 WAT 2450 143.221 138.109 93.974 1.00 0.00 H TER 19481 WAT 2450 ATOM 19481 O WAT 2451 128.989 28.279 101.561 1.00 0.00 O ATOM 19482 H1 WAT 2451 128.192 28.803 101.653 1.00 0.00 H ATOM 19483 H2 WAT 2451 129.695 28.868 101.827 1.00 0.00 H TER 19485 WAT 2451 ATOM 19485 O WAT 2452 57.462 67.980 118.055 1.00 0.00 O ATOM 19486 H1 WAT 2452 57.849 67.920 118.928 1.00 0.00 H ATOM 19487 H2 WAT 2452 56.701 68.550 118.169 1.00 0.00 H TER 19489 WAT 2452 ATOM 19489 O WAT 2453 37.245 132.815 50.722 1.00 0.00 O ATOM 19490 H1 WAT 2453 36.582 132.631 50.057 1.00 0.00 H ATOM 19491 H2 WAT 2453 37.792 133.498 50.333 1.00 0.00 H TER 19493 WAT 2453 ATOM 19493 O WAT 2454 28.530 141.026 2.163 1.00 0.00 O ATOM 19494 H1 WAT 2454 27.930 141.333 1.485 1.00 0.00 H ATOM 19495 H2 WAT 2454 29.395 141.305 1.862 1.00 0.00 H TER 19497 WAT 2454 ATOM 19497 O WAT 2455 5.804 75.545 149.458 1.00 0.00 O ATOM 19498 H1 WAT 2455 5.253 74.774 149.587 1.00 0.00 H ATOM 19499 H2 WAT 2455 5.194 76.283 149.487 1.00 0.00 H TER 19501 WAT 2455 ATOM 19501 O WAT 2456 107.130 27.934 123.188 1.00 0.00 O ATOM 19502 H1 WAT 2456 107.929 28.097 122.686 1.00 0.00 H ATOM 19503 H2 WAT 2456 106.422 28.227 122.614 1.00 0.00 H TER 19505 WAT 2456 ATOM 19505 O WAT 2457 145.500 54.144 115.506 1.00 0.00 O ATOM 19506 H1 WAT 2457 145.062 53.308 115.667 1.00 0.00 H ATOM 19507 H2 WAT 2457 146.427 53.918 115.431 1.00 0.00 H TER 19509 WAT 2457 ATOM 19509 O WAT 2458 121.038 116.943 11.235 1.00 0.00 O ATOM 19510 H1 WAT 2458 120.111 117.101 11.060 1.00 0.00 H ATOM 19511 H2 WAT 2458 121.385 117.800 11.481 1.00 0.00 H TER 19513 WAT 2458 ATOM 19513 O WAT 2459 92.671 135.622 141.151 1.00 0.00 O ATOM 19514 H1 WAT 2459 91.841 136.087 141.045 1.00 0.00 H ATOM 19515 H2 WAT 2459 93.335 136.311 141.136 1.00 0.00 H TER 19517 WAT 2459 ATOM 19517 O WAT 2460 54.111 7.933 57.788 1.00 0.00 O ATOM 19518 H1 WAT 2460 53.759 7.302 57.159 1.00 0.00 H ATOM 19519 H2 WAT 2460 53.459 8.633 57.814 1.00 0.00 H TER 19521 WAT 2460 ATOM 19521 O WAT 2461 128.610 22.594 123.525 1.00 0.00 O ATOM 19522 H1 WAT 2461 128.656 22.457 122.579 1.00 0.00 H ATOM 19523 H2 WAT 2461 128.101 23.398 123.626 1.00 0.00 H TER 19525 WAT 2461 ATOM 19525 O WAT 2462 49.968 46.985 64.041 1.00 0.00 O ATOM 19526 H1 WAT 2462 50.877 47.118 63.775 1.00 0.00 H ATOM 19527 H2 WAT 2462 49.456 47.474 63.396 1.00 0.00 H TER 19529 WAT 2462 ATOM 19529 O WAT 2463 89.210 115.975 135.315 1.00 0.00 O ATOM 19530 H1 WAT 2463 89.064 116.623 136.004 1.00 0.00 H ATOM 19531 H2 WAT 2463 88.859 116.384 134.524 1.00 0.00 H TER 19533 WAT 2463 ATOM 19533 O WAT 2464 13.198 29.163 133.008 1.00 0.00 O ATOM 19534 H1 WAT 2464 12.530 29.454 133.629 1.00 0.00 H ATOM 19535 H2 WAT 2464 13.032 29.679 132.219 1.00 0.00 H TER 19537 WAT 2464 ATOM 19537 O WAT 2465 54.669 25.271 135.389 1.00 0.00 O ATOM 19538 H1 WAT 2465 55.223 25.669 134.717 1.00 0.00 H ATOM 19539 H2 WAT 2465 54.958 25.675 136.207 1.00 0.00 H TER 19541 WAT 2465 ATOM 19541 O WAT 2466 62.098 76.105 151.718 1.00 0.00 O ATOM 19542 H1 WAT 2466 63.022 75.875 151.613 1.00 0.00 H ATOM 19543 H2 WAT 2466 61.855 76.506 150.883 1.00 0.00 H TER 19545 WAT 2466 ATOM 19545 O WAT 2467 6.457 59.006 139.491 1.00 0.00 O ATOM 19546 H1 WAT 2467 6.426 59.953 139.359 1.00 0.00 H ATOM 19547 H2 WAT 2467 6.007 58.865 140.324 1.00 0.00 H TER 19549 WAT 2467 ATOM 19549 O WAT 2468 94.570 99.552 95.347 1.00 0.00 O ATOM 19550 H1 WAT 2468 95.447 99.278 95.615 1.00 0.00 H ATOM 19551 H2 WAT 2468 93.986 98.905 95.742 1.00 0.00 H TER 19553 WAT 2468 ATOM 19553 O WAT 2469 112.086 37.154 0.740 1.00 0.00 O ATOM 19554 H1 WAT 2469 111.193 36.841 0.592 1.00 0.00 H ATOM 19555 H2 WAT 2469 112.262 36.949 1.658 1.00 0.00 H TER 19557 WAT 2469 ATOM 19557 O WAT 2470 52.173 48.786 115.598 1.00 0.00 O ATOM 19558 H1 WAT 2470 52.851 49.456 115.515 1.00 0.00 H ATOM 19559 H2 WAT 2470 52.407 48.127 114.944 1.00 0.00 H TER 19561 WAT 2470 ATOM 19561 O WAT 2471 17.339 103.684 151.185 1.00 0.00 O ATOM 19562 H1 WAT 2471 16.992 104.574 151.244 1.00 0.00 H ATOM 19563 H2 WAT 2471 17.151 103.297 152.040 1.00 0.00 H TER 19565 WAT 2471 ATOM 19565 O WAT 2472 141.591 95.293 106.062 1.00 0.00 O ATOM 19566 H1 WAT 2472 142.469 94.994 106.299 1.00 0.00 H ATOM 19567 H2 WAT 2472 141.021 94.915 106.731 1.00 0.00 H TER 19569 WAT 2472 ATOM 19569 O WAT 2473 47.217 130.920 118.867 1.00 0.00 O ATOM 19570 H1 WAT 2473 46.812 130.081 118.644 1.00 0.00 H ATOM 19571 H2 WAT 2473 47.168 130.963 119.822 1.00 0.00 H TER 19573 WAT 2473 ATOM 19573 O WAT 2474 55.690 36.435 78.838 1.00 0.00 O ATOM 19574 H1 WAT 2474 55.134 35.813 78.369 1.00 0.00 H ATOM 19575 H2 WAT 2474 56.020 37.022 78.158 1.00 0.00 H TER 19577 WAT 2474 ATOM 19577 O WAT 2475 118.593 132.922 143.891 1.00 0.00 O ATOM 19578 H1 WAT 2475 118.755 132.011 143.644 1.00 0.00 H ATOM 19579 H2 WAT 2475 119.367 133.394 143.583 1.00 0.00 H TER 19581 WAT 2475 ATOM 19581 O WAT 2476 62.250 42.624 87.051 1.00 0.00 O ATOM 19582 H1 WAT 2476 63.054 42.231 87.391 1.00 0.00 H ATOM 19583 H2 WAT 2476 62.549 43.367 86.528 1.00 0.00 H TER 19585 WAT 2476 ATOM 19585 O WAT 2477 22.621 69.076 113.729 1.00 0.00 O ATOM 19586 H1 WAT 2477 22.609 68.322 114.318 1.00 0.00 H ATOM 19587 H2 WAT 2477 23.059 69.764 114.230 1.00 0.00 H TER 19589 WAT 2477 ATOM 19589 O WAT 2478 80.971 25.796 157.408 1.00 0.00 O ATOM 19590 H1 WAT 2478 81.824 26.197 157.239 1.00 0.00 H ATOM 19591 H2 WAT 2478 81.126 25.205 158.145 1.00 0.00 H TER 19593 WAT 2478 ATOM 19593 O WAT 2479 20.266 144.890 71.834 1.00 0.00 O ATOM 19594 H1 WAT 2479 20.316 144.411 72.661 1.00 0.00 H ATOM 19595 H2 WAT 2479 21.118 145.319 71.754 1.00 0.00 H TER 19597 WAT 2479 ATOM 19597 O WAT 2480 5.537 51.759 103.874 1.00 0.00 O ATOM 19598 H1 WAT 2480 4.994 51.636 104.653 1.00 0.00 H ATOM 19599 H2 WAT 2480 6.082 50.974 103.836 1.00 0.00 H TER 19601 WAT 2480 ATOM 19601 O WAT 2481 33.752 66.186 147.668 1.00 0.00 O ATOM 19602 H1 WAT 2481 33.881 65.362 147.197 1.00 0.00 H ATOM 19603 H2 WAT 2481 33.582 65.921 148.572 1.00 0.00 H TER 19605 WAT 2481 ATOM 19605 O WAT 2482 4.403 49.182 67.776 1.00 0.00 O ATOM 19606 H1 WAT 2482 3.507 48.856 67.700 1.00 0.00 H ATOM 19607 H2 WAT 2482 4.834 48.562 68.365 1.00 0.00 H TER 19609 WAT 2482 ATOM 19609 O WAT 2483 7.344 54.120 90.245 1.00 0.00 O ATOM 19610 H1 WAT 2483 7.130 54.172 89.313 1.00 0.00 H ATOM 19611 H2 WAT 2483 7.502 55.027 90.506 1.00 0.00 H TER 19613 WAT 2483 ATOM 19613 O WAT 2484 74.839 54.202 16.695 1.00 0.00 O ATOM 19614 H1 WAT 2484 75.318 54.995 16.455 1.00 0.00 H ATOM 19615 H2 WAT 2484 73.955 54.345 16.358 1.00 0.00 H TER 19617 WAT 2484 ATOM 19617 O WAT 2485 88.383 36.437 87.784 1.00 0.00 O ATOM 19618 H1 WAT 2485 88.928 37.213 87.912 1.00 0.00 H ATOM 19619 H2 WAT 2485 88.598 36.136 86.901 1.00 0.00 H TER 19621 WAT 2485 ATOM 19621 O WAT 2486 96.441 58.529 57.206 1.00 0.00 O ATOM 19622 H1 WAT 2486 95.766 59.203 57.285 1.00 0.00 H ATOM 19623 H2 WAT 2486 96.972 58.627 57.996 1.00 0.00 H TER 19625 WAT 2486 ATOM 19625 O WAT 2487 62.004 59.655 135.607 1.00 0.00 O ATOM 19626 H1 WAT 2487 62.704 59.089 135.282 1.00 0.00 H ATOM 19627 H2 WAT 2487 61.662 60.087 134.824 1.00 0.00 H TER 19629 WAT 2487 ATOM 19629 O WAT 2488 29.311 7.861 78.351 1.00 0.00 O ATOM 19630 H1 WAT 2488 29.298 7.567 79.262 1.00 0.00 H ATOM 19631 H2 WAT 2488 28.782 7.214 77.883 1.00 0.00 H TER 19633 WAT 2488 ATOM 19633 O WAT 2489 18.043 2.983 94.612 1.00 0.00 O ATOM 19634 H1 WAT 2489 18.332 3.232 95.490 1.00 0.00 H ATOM 19635 H2 WAT 2489 17.527 3.730 94.310 1.00 0.00 H TER 19637 WAT 2489 ATOM 19637 O WAT 2490 134.145 129.981 12.067 1.00 0.00 O ATOM 19638 H1 WAT 2490 133.952 129.461 11.288 1.00 0.00 H ATOM 19639 H2 WAT 2490 134.862 130.556 11.800 1.00 0.00 H TER 19641 WAT 2490 ATOM 19641 O WAT 2491 34.688 42.425 147.009 1.00 0.00 O ATOM 19642 H1 WAT 2491 35.387 41.786 147.150 1.00 0.00 H ATOM 19643 H2 WAT 2491 34.375 42.244 146.123 1.00 0.00 H TER 19645 WAT 2491 ATOM 19645 O WAT 2492 35.588 145.995 83.055 1.00 0.00 O ATOM 19646 H1 WAT 2492 35.622 145.373 83.782 1.00 0.00 H ATOM 19647 H2 WAT 2492 35.953 145.514 82.312 1.00 0.00 H TER 19649 WAT 2492 ATOM 19649 O WAT 2493 106.963 141.498 12.847 1.00 0.00 O ATOM 19650 H1 WAT 2493 106.202 141.791 13.348 1.00 0.00 H ATOM 19651 H2 WAT 2493 107.695 141.999 13.207 1.00 0.00 H TER 19653 WAT 2493 ATOM 19653 O WAT 2494 97.021 133.854 110.766 1.00 0.00 O ATOM 19654 H1 WAT 2494 97.591 133.242 111.234 1.00 0.00 H ATOM 19655 H2 WAT 2494 96.749 134.484 111.433 1.00 0.00 H TER 19657 WAT 2494 ATOM 19657 O WAT 2495 55.850 23.948 57.861 1.00 0.00 O ATOM 19658 H1 WAT 2495 55.780 24.901 57.906 1.00 0.00 H ATOM 19659 H2 WAT 2495 56.529 23.788 57.206 1.00 0.00 H TER 19661 WAT 2495 ATOM 19661 O WAT 2496 64.472 12.432 62.878 1.00 0.00 O ATOM 19662 H1 WAT 2496 65.167 11.811 63.095 1.00 0.00 H ATOM 19663 H2 WAT 2496 63.732 12.162 63.421 1.00 0.00 H TER 19665 WAT 2496 ATOM 19665 O WAT 2497 80.110 23.916 116.771 1.00 0.00 O ATOM 19666 H1 WAT 2497 79.220 23.820 117.110 1.00 0.00 H ATOM 19667 H2 WAT 2497 80.669 23.557 117.460 1.00 0.00 H TER 19669 WAT 2497 ATOM 19669 O WAT 2498 46.483 27.947 141.082 1.00 0.00 O ATOM 19670 H1 WAT 2498 47.391 27.659 140.988 1.00 0.00 H ATOM 19671 H2 WAT 2498 46.091 27.788 140.223 1.00 0.00 H TER 19673 WAT 2498 ATOM 19673 O WAT 2499 47.856 142.255 78.858 1.00 0.00 O ATOM 19674 H1 WAT 2499 47.223 141.861 79.459 1.00 0.00 H ATOM 19675 H2 WAT 2499 48.705 142.112 79.276 1.00 0.00 H TER 19677 WAT 2499 ATOM 19677 O WAT 2500 16.979 30.863 152.618 1.00 0.00 O ATOM 19678 H1 WAT 2500 16.704 31.716 152.282 1.00 0.00 H ATOM 19679 H2 WAT 2500 17.620 31.069 153.298 1.00 0.00 H TER 19681 WAT 2500 ATOM 19681 O WAT 2501 84.189 97.252 143.026 1.00 0.00 O ATOM 19682 H1 WAT 2501 84.071 96.523 143.635 1.00 0.00 H ATOM 19683 H2 WAT 2501 83.308 97.438 142.702 1.00 0.00 H TER 19685 WAT 2501 ATOM 19685 O WAT 2502 109.669 19.488 107.065 1.00 0.00 O ATOM 19686 H1 WAT 2502 109.574 20.159 106.390 1.00 0.00 H ATOM 19687 H2 WAT 2502 109.524 18.662 106.605 1.00 0.00 H TER 19689 WAT 2502 ATOM 19689 O WAT 2503 41.098 2.126 3.112 1.00 0.00 O ATOM 19690 H1 WAT 2503 41.088 1.169 3.153 1.00 0.00 H ATOM 19691 H2 WAT 2503 40.265 2.391 3.502 1.00 0.00 H TER 19693 WAT 2503 ATOM 19693 O WAT 2504 82.429 38.325 91.027 1.00 0.00 O ATOM 19694 H1 WAT 2504 82.139 38.416 91.935 1.00 0.00 H ATOM 19695 H2 WAT 2504 83.231 38.844 90.979 1.00 0.00 H TER 19697 WAT 2504 ATOM 19697 O WAT 2505 127.882 13.026 132.171 1.00 0.00 O ATOM 19698 H1 WAT 2505 128.443 12.297 132.436 1.00 0.00 H ATOM 19699 H2 WAT 2505 128.475 13.774 132.108 1.00 0.00 H TER 19701 WAT 2505 ATOM 19701 O WAT 2506 90.359 60.058 14.801 1.00 0.00 O ATOM 19702 H1 WAT 2506 89.661 60.663 15.052 1.00 0.00 H ATOM 19703 H2 WAT 2506 89.957 59.191 14.860 1.00 0.00 H TER 19705 WAT 2506 ATOM 19705 O WAT 2507 81.129 137.441 81.141 1.00 0.00 O ATOM 19706 H1 WAT 2507 80.576 137.525 81.918 1.00 0.00 H ATOM 19707 H2 WAT 2507 81.441 138.330 80.973 1.00 0.00 H TER 19709 WAT 2507 ATOM 19709 O WAT 2508 107.928 77.903 124.945 1.00 0.00 O ATOM 19710 H1 WAT 2508 108.036 77.255 124.249 1.00 0.00 H ATOM 19711 H2 WAT 2508 108.053 77.408 125.755 1.00 0.00 H TER 19713 WAT 2508 ATOM 19713 O WAT 2509 63.778 76.864 118.828 1.00 0.00 O ATOM 19714 H1 WAT 2509 63.140 76.200 119.089 1.00 0.00 H ATOM 19715 H2 WAT 2509 63.947 76.684 117.903 1.00 0.00 H TER 19717 WAT 2509 ATOM 19717 O WAT 2510 32.229 47.874 5.615 1.00 0.00 O ATOM 19718 H1 WAT 2510 32.636 47.064 5.308 1.00 0.00 H ATOM 19719 H2 WAT 2510 32.083 48.385 4.819 1.00 0.00 H TER 19721 WAT 2510 ATOM 19721 O WAT 2511 69.716 71.528 138.519 1.00 0.00 O ATOM 19722 H1 WAT 2511 69.205 71.558 139.327 1.00 0.00 H ATOM 19723 H2 WAT 2511 69.756 72.439 138.227 1.00 0.00 H TER 19725 WAT 2511 ATOM 19725 O WAT 2512 47.152 72.368 20.142 1.00 0.00 O ATOM 19726 H1 WAT 2512 48.020 71.971 20.064 1.00 0.00 H ATOM 19727 H2 WAT 2512 46.572 71.637 20.355 1.00 0.00 H TER 19729 WAT 2512 ATOM 19729 O WAT 2513 140.590 29.626 118.421 1.00 0.00 O ATOM 19730 H1 WAT 2513 140.058 29.323 117.685 1.00 0.00 H ATOM 19731 H2 WAT 2513 139.956 29.969 119.050 1.00 0.00 H TER 19733 WAT 2513 ATOM 19733 O WAT 2514 144.877 94.589 85.477 1.00 0.00 O ATOM 19734 H1 WAT 2514 144.960 94.183 86.340 1.00 0.00 H ATOM 19735 H2 WAT 2514 145.311 95.437 85.569 1.00 0.00 H TER 19737 WAT 2514 ATOM 19737 O WAT 2515 17.904 116.756 158.660 1.00 0.00 O ATOM 19738 H1 WAT 2515 18.179 116.916 157.758 1.00 0.00 H ATOM 19739 H2 WAT 2515 17.196 117.382 158.809 1.00 0.00 H TER 19741 WAT 2515 ATOM 19741 O WAT 2516 29.885 110.325 19.170 1.00 0.00 O ATOM 19742 H1 WAT 2516 29.544 110.130 20.043 1.00 0.00 H ATOM 19743 H2 WAT 2516 30.836 110.278 19.269 1.00 0.00 H TER 19745 WAT 2516 ATOM 19745 O WAT 2517 22.161 118.159 121.876 1.00 0.00 O ATOM 19746 H1 WAT 2517 23.077 118.200 122.155 1.00 0.00 H ATOM 19747 H2 WAT 2517 21.739 117.597 122.526 1.00 0.00 H TER 19749 WAT 2517 ATOM 19749 O WAT 2518 96.874 95.847 115.275 1.00 0.00 O ATOM 19750 H1 WAT 2518 96.032 96.302 115.240 1.00 0.00 H ATOM 19751 H2 WAT 2518 96.878 95.290 114.496 1.00 0.00 H TER 19753 WAT 2518 ATOM 19753 O WAT 2519 31.097 3.198 94.594 1.00 0.00 O ATOM 19754 H1 WAT 2519 31.070 3.840 95.304 1.00 0.00 H ATOM 19755 H2 WAT 2519 31.754 2.560 94.873 1.00 0.00 H TER 19757 WAT 2519 ATOM 19757 O WAT 2520 135.823 52.247 83.065 1.00 0.00 O ATOM 19758 H1 WAT 2520 135.856 53.107 83.483 1.00 0.00 H ATOM 19759 H2 WAT 2520 136.390 52.331 82.298 1.00 0.00 H TER 19761 WAT 2520 ATOM 19761 O WAT 2521 112.505 95.476 4.204 1.00 0.00 O ATOM 19762 H1 WAT 2521 112.192 96.336 3.922 1.00 0.00 H ATOM 19763 H2 WAT 2521 112.469 94.938 3.413 1.00 0.00 H TER 19765 WAT 2521 ATOM 19765 O WAT 2522 79.108 44.693 149.089 1.00 0.00 O ATOM 19766 H1 WAT 2522 79.427 44.670 149.991 1.00 0.00 H ATOM 19767 H2 WAT 2522 78.853 43.790 148.902 1.00 0.00 H TER 19769 WAT 2522 ATOM 19769 O WAT 2523 75.164 0.932 149.158 1.00 0.00 O ATOM 19770 H1 WAT 2523 74.723 0.852 150.004 1.00 0.00 H ATOM 19771 H2 WAT 2523 75.252 0.031 148.848 1.00 0.00 H TER 19773 WAT 2523 ATOM 19773 O WAT 2524 99.604 41.560 103.926 1.00 0.00 O ATOM 19774 H1 WAT 2524 99.273 41.790 104.794 1.00 0.00 H ATOM 19775 H2 WAT 2524 100.127 40.772 104.070 1.00 0.00 H TER 19777 WAT 2524 ATOM 19777 O WAT 2525 4.484 140.784 138.768 1.00 0.00 O ATOM 19778 H1 WAT 2525 4.860 139.914 138.636 1.00 0.00 H ATOM 19779 H2 WAT 2525 5.226 141.329 139.030 1.00 0.00 H TER 19781 WAT 2525 ATOM 19781 O WAT 2526 73.590 114.337 92.262 1.00 0.00 O ATOM 19782 H1 WAT 2526 73.606 113.853 93.088 1.00 0.00 H ATOM 19783 H2 WAT 2526 72.715 114.178 91.908 1.00 0.00 H TER 19785 WAT 2526 ATOM 19785 O WAT 2527 121.078 40.766 128.314 1.00 0.00 O ATOM 19786 H1 WAT 2527 120.685 41.639 128.316 1.00 0.00 H ATOM 19787 H2 WAT 2527 120.985 40.459 129.216 1.00 0.00 H TER 19789 WAT 2527 ATOM 19789 O WAT 2528 14.176 57.051 120.245 1.00 0.00 O ATOM 19790 H1 WAT 2528 13.651 56.692 119.530 1.00 0.00 H ATOM 19791 H2 WAT 2528 13.551 57.541 120.779 1.00 0.00 H TER 19793 WAT 2528 ATOM 19793 O WAT 2529 34.466 69.926 132.444 1.00 0.00 O ATOM 19794 H1 WAT 2529 34.606 70.796 132.070 1.00 0.00 H ATOM 19795 H2 WAT 2529 35.166 69.390 132.073 1.00 0.00 H TER 19797 WAT 2529 ATOM 19797 O WAT 2530 44.160 134.390 96.240 1.00 0.00 O ATOM 19798 H1 WAT 2530 43.839 134.979 96.922 1.00 0.00 H ATOM 19799 H2 WAT 2530 44.688 134.949 95.669 1.00 0.00 H TER 19801 WAT 2530 ATOM 19801 O WAT 2531 110.353 56.658 7.446 1.00 0.00 O ATOM 19802 H1 WAT 2531 110.392 57.351 6.788 1.00 0.00 H ATOM 19803 H2 WAT 2531 109.579 56.147 7.211 1.00 0.00 H TER 19805 WAT 2531 ATOM 19805 O WAT 2532 44.160 36.006 103.116 1.00 0.00 O ATOM 19806 H1 WAT 2532 45.056 35.816 103.393 1.00 0.00 H ATOM 19807 H2 WAT 2532 43.718 35.157 103.132 1.00 0.00 H TER 19809 WAT 2532 ATOM 19809 O WAT 2533 65.550 50.143 57.634 1.00 0.00 O ATOM 19810 H1 WAT 2533 66.369 49.711 57.876 1.00 0.00 H ATOM 19811 H2 WAT 2533 65.776 50.679 56.874 1.00 0.00 H TER 19813 WAT 2533 ATOM 19813 O WAT 2534 77.914 32.870 83.614 1.00 0.00 O ATOM 19814 H1 WAT 2534 78.164 33.744 83.913 1.00 0.00 H ATOM 19815 H2 WAT 2534 78.735 32.470 83.327 1.00 0.00 H TER 19817 WAT 2534 ATOM 19817 O WAT 2535 68.413 46.879 71.403 1.00 0.00 O ATOM 19818 H1 WAT 2535 68.699 46.553 70.549 1.00 0.00 H ATOM 19819 H2 WAT 2535 67.473 47.028 71.299 1.00 0.00 H TER 19821 WAT 2535 ATOM 19821 O WAT 2536 68.431 10.021 141.045 1.00 0.00 O ATOM 19822 H1 WAT 2536 68.227 10.877 140.668 1.00 0.00 H ATOM 19823 H2 WAT 2536 69.296 10.133 141.439 1.00 0.00 H TER 19825 WAT 2536 ATOM 19825 O WAT 2537 81.218 29.629 73.588 1.00 0.00 O ATOM 19826 H1 WAT 2537 80.770 30.370 73.181 1.00 0.00 H ATOM 19827 H2 WAT 2537 80.638 29.359 74.299 1.00 0.00 H TER 19829 WAT 2537 ATOM 19829 O WAT 2538 69.683 54.938 148.422 1.00 0.00 O ATOM 19830 H1 WAT 2538 70.488 55.026 147.911 1.00 0.00 H ATOM 19831 H2 WAT 2538 68.992 55.243 147.834 1.00 0.00 H TER 19833 WAT 2538 ATOM 19833 O WAT 2539 59.292 81.659 6.836 1.00 0.00 O ATOM 19834 H1 WAT 2539 59.586 81.072 7.533 1.00 0.00 H ATOM 19835 H2 WAT 2539 60.079 81.826 6.317 1.00 0.00 H TER 19837 WAT 2539 ATOM 19837 O WAT 2540 49.433 5.175 67.629 1.00 0.00 O ATOM 19838 H1 WAT 2540 49.219 5.949 68.150 1.00 0.00 H ATOM 19839 H2 WAT 2540 49.680 5.525 66.772 1.00 0.00 H TER 19841 WAT 2540 ATOM 19841 O WAT 2541 141.894 77.993 64.911 1.00 0.00 O ATOM 19842 H1 WAT 2541 142.362 77.305 64.438 1.00 0.00 H ATOM 19843 H2 WAT 2541 141.330 78.397 64.250 1.00 0.00 H TER 19845 WAT 2541 ATOM 19845 O WAT 2542 112.365 33.386 134.550 1.00 0.00 O ATOM 19846 H1 WAT 2542 113.104 33.983 134.428 1.00 0.00 H ATOM 19847 H2 WAT 2542 111.929 33.704 135.341 1.00 0.00 H TER 19849 WAT 2542 ATOM 19849 O WAT 2543 67.672 68.777 132.059 1.00 0.00 O ATOM 19850 H1 WAT 2543 66.811 68.569 132.423 1.00 0.00 H ATOM 19851 H2 WAT 2543 67.913 67.999 131.557 1.00 0.00 H TER 19853 WAT 2543 ATOM 19853 O WAT 2544 75.002 35.644 141.540 1.00 0.00 O ATOM 19854 H1 WAT 2544 74.703 35.804 142.435 1.00 0.00 H ATOM 19855 H2 WAT 2544 74.807 36.457 141.074 1.00 0.00 H TER 19857 WAT 2544 ATOM 19857 O WAT 2545 71.221 104.829 148.740 1.00 0.00 O ATOM 19858 H1 WAT 2545 71.215 105.555 149.364 1.00 0.00 H ATOM 19859 H2 WAT 2545 70.316 104.521 148.722 1.00 0.00 H TER 19861 WAT 2545 ATOM 19861 O WAT 2546 67.881 60.479 87.565 1.00 0.00 O ATOM 19862 H1 WAT 2546 68.492 61.186 87.359 1.00 0.00 H ATOM 19863 H2 WAT 2546 67.086 60.700 87.081 1.00 0.00 H TER 19865 WAT 2546 ATOM 19865 O WAT 2547 112.230 32.547 86.435 1.00 0.00 O ATOM 19866 H1 WAT 2547 112.384 31.686 86.822 1.00 0.00 H ATOM 19867 H2 WAT 2547 112.891 33.111 86.835 1.00 0.00 H TER 19869 WAT 2547 ATOM 19869 O WAT 2548 42.117 3.870 10.602 1.00 0.00 O ATOM 19870 H1 WAT 2548 42.764 3.868 9.896 1.00 0.00 H ATOM 19871 H2 WAT 2548 42.592 3.533 11.361 1.00 0.00 H TER 19873 WAT 2548 ATOM 19873 O WAT 2549 15.201 76.098 88.458 1.00 0.00 O ATOM 19874 H1 WAT 2549 15.322 77.034 88.613 1.00 0.00 H ATOM 19875 H2 WAT 2549 14.707 75.791 89.218 1.00 0.00 H TER 19877 WAT 2549 ATOM 19877 O WAT 2550 9.990 57.687 143.686 1.00 0.00 O ATOM 19878 H1 WAT 2550 10.583 57.107 144.163 1.00 0.00 H ATOM 19879 H2 WAT 2550 9.741 57.187 142.908 1.00 0.00 H TER 19881 WAT 2550 ATOM 19881 O WAT 2551 64.821 67.536 122.929 1.00 0.00 O ATOM 19882 H1 WAT 2551 64.290 66.911 123.424 1.00 0.00 H ATOM 19883 H2 WAT 2551 65.156 68.141 123.590 1.00 0.00 H TER 19885 WAT 2551 ATOM 19885 O WAT 2552 7.356 86.703 92.254 1.00 0.00 O ATOM 19886 H1 WAT 2552 7.976 87.417 92.400 1.00 0.00 H ATOM 19887 H2 WAT 2552 7.190 86.347 93.127 1.00 0.00 H TER 19889 WAT 2552 ATOM 19889 O WAT 2553 19.578 52.586 108.985 1.00 0.00 O ATOM 19890 H1 WAT 2553 20.224 52.963 108.388 1.00 0.00 H ATOM 19891 H2 WAT 2553 18.797 53.126 108.866 1.00 0.00 H TER 19893 WAT 2553 ATOM 19893 O WAT 2554 21.358 51.595 114.134 1.00 0.00 O ATOM 19894 H1 WAT 2554 21.217 50.674 113.915 1.00 0.00 H ATOM 19895 H2 WAT 2554 20.571 52.039 113.818 1.00 0.00 H TER 19897 WAT 2554 ATOM 19897 O WAT 2555 77.249 105.484 75.587 1.00 0.00 O ATOM 19898 H1 WAT 2555 77.245 106.438 75.517 1.00 0.00 H ATOM 19899 H2 WAT 2555 77.009 105.178 74.712 1.00 0.00 H TER 19901 WAT 2555 ATOM 19901 O WAT 2556 107.133 127.952 114.586 1.00 0.00 O ATOM 19902 H1 WAT 2556 107.091 126.996 114.616 1.00 0.00 H ATOM 19903 H2 WAT 2556 108.060 128.156 114.707 1.00 0.00 H TER 19905 WAT 2556 ATOM 19905 O WAT 2557 108.658 103.328 100.833 1.00 0.00 O ATOM 19906 H1 WAT 2557 109.164 103.018 100.082 1.00 0.00 H ATOM 19907 H2 WAT 2557 108.614 102.573 101.420 1.00 0.00 H TER 19909 WAT 2557 ATOM 19909 O WAT 2558 19.380 114.214 60.372 1.00 0.00 O ATOM 19910 H1 WAT 2558 18.792 113.476 60.207 1.00 0.00 H ATOM 19911 H2 WAT 2558 18.798 114.933 60.617 1.00 0.00 H TER 19913 WAT 2558 ATOM 19913 O WAT 2559 131.784 13.877 149.822 1.00 0.00 O ATOM 19914 H1 WAT 2559 131.199 13.291 149.342 1.00 0.00 H ATOM 19915 H2 WAT 2559 132.592 13.375 149.927 1.00 0.00 H TER 19917 WAT 2559 ATOM 19917 O WAT 2560 33.943 9.279 137.129 1.00 0.00 O ATOM 19918 H1 WAT 2560 33.815 9.615 136.242 1.00 0.00 H ATOM 19919 H2 WAT 2560 34.691 8.686 137.055 1.00 0.00 H TER 19921 WAT 2560 ATOM 19921 O WAT 2561 81.125 74.285 65.954 1.00 0.00 O ATOM 19922 H1 WAT 2561 80.836 75.132 65.615 1.00 0.00 H ATOM 19923 H2 WAT 2561 80.324 73.865 66.267 1.00 0.00 H TER 19925 WAT 2561 ATOM 19925 O WAT 2562 70.823 104.069 64.563 1.00 0.00 O ATOM 19926 H1 WAT 2562 70.111 103.444 64.703 1.00 0.00 H ATOM 19927 H2 WAT 2562 70.763 104.295 63.635 1.00 0.00 H TER 19929 WAT 2562 ATOM 19929 O WAT 2563 141.090 129.609 9.008 1.00 0.00 O ATOM 19930 H1 WAT 2563 140.553 129.275 9.727 1.00 0.00 H ATOM 19931 H2 WAT 2563 141.668 130.252 9.419 1.00 0.00 H TER 19933 WAT 2563 ATOM 19933 O WAT 2564 45.176 91.714 94.278 1.00 0.00 O ATOM 19934 H1 WAT 2564 45.776 91.509 94.996 1.00 0.00 H ATOM 19935 H2 WAT 2564 45.568 91.295 93.512 1.00 0.00 H TER 19937 WAT 2564 ATOM 19937 O WAT 2565 70.244 39.333 1.989 1.00 0.00 O ATOM 19938 H1 WAT 2565 69.543 39.791 2.452 1.00 0.00 H ATOM 19939 H2 WAT 2565 70.535 38.658 2.603 1.00 0.00 H TER 19941 WAT 2565 ATOM 19941 O WAT 2566 14.850 9.787 72.605 1.00 0.00 O ATOM 19942 H1 WAT 2566 14.860 10.741 72.523 1.00 0.00 H ATOM 19943 H2 WAT 2566 15.678 9.575 73.037 1.00 0.00 H TER 19945 WAT 2566 ATOM 19945 O WAT 2567 3.247 144.660 142.578 1.00 0.00 O ATOM 19946 H1 WAT 2567 3.333 145.455 143.105 1.00 0.00 H ATOM 19947 H2 WAT 2567 4.043 144.162 142.765 1.00 0.00 H TER 19949 WAT 2567 ATOM 19949 O WAT 2568 93.165 93.703 148.403 1.00 0.00 O ATOM 19950 H1 WAT 2568 94.012 93.874 148.815 1.00 0.00 H ATOM 19951 H2 WAT 2568 92.607 93.401 149.120 1.00 0.00 H TER 19953 WAT 2568 ATOM 19953 O WAT 2569 70.346 92.108 25.211 1.00 0.00 O ATOM 19954 H1 WAT 2569 69.638 92.423 25.773 1.00 0.00 H ATOM 19955 H2 WAT 2569 71.029 91.831 25.821 1.00 0.00 H TER 19957 WAT 2569 ATOM 19957 O WAT 2570 74.289 12.441 91.105 1.00 0.00 O ATOM 19958 H1 WAT 2570 75.119 12.058 91.389 1.00 0.00 H ATOM 19959 H2 WAT 2570 73.936 12.857 91.892 1.00 0.00 H TER 19961 WAT 2570 ATOM 19961 O WAT 2571 117.742 138.871 92.061 1.00 0.00 O ATOM 19962 H1 WAT 2571 117.848 138.799 93.010 1.00 0.00 H ATOM 19963 H2 WAT 2571 118.612 138.684 91.708 1.00 0.00 H TER 19965 WAT 2571 ATOM 19965 O WAT 2572 46.304 119.694 0.663 1.00 0.00 O ATOM 19966 H1 WAT 2572 46.984 119.308 0.111 1.00 0.00 H ATOM 19967 H2 WAT 2572 46.479 119.345 1.537 1.00 0.00 H TER 19969 WAT 2572 ATOM 19969 O WAT 2573 115.164 116.772 82.294 1.00 0.00 O ATOM 19970 H1 WAT 2573 114.749 117.236 81.566 1.00 0.00 H ATOM 19971 H2 WAT 2573 115.928 116.349 81.903 1.00 0.00 H TER 19973 WAT 2573 ATOM 19973 O WAT 2574 140.136 2.609 116.572 1.00 0.00 O ATOM 19974 H1 WAT 2574 139.529 2.942 117.233 1.00 0.00 H ATOM 19975 H2 WAT 2574 139.648 1.918 116.124 1.00 0.00 H TER 19977 WAT 2574 ATOM 19977 O WAT 2575 44.989 97.859 118.006 1.00 0.00 O ATOM 19978 H1 WAT 2575 44.362 97.139 117.936 1.00 0.00 H ATOM 19979 H2 WAT 2575 45.834 97.461 117.796 1.00 0.00 H TER 19981 WAT 2575 ATOM 19981 O WAT 2576 79.257 72.988 87.633 1.00 0.00 O ATOM 19982 H1 WAT 2576 78.812 72.409 88.252 1.00 0.00 H ATOM 19983 H2 WAT 2576 79.724 72.394 87.044 1.00 0.00 H TER 19985 WAT 2576 ATOM 19985 O WAT 2577 27.341 118.723 15.510 1.00 0.00 O ATOM 19986 H1 WAT 2577 28.117 118.169 15.590 1.00 0.00 H ATOM 19987 H2 WAT 2577 26.824 118.313 14.816 1.00 0.00 H TER 19989 WAT 2577 ATOM 19989 O WAT 2578 90.605 119.813 136.470 1.00 0.00 O ATOM 19990 H1 WAT 2578 90.564 120.362 137.253 1.00 0.00 H ATOM 19991 H2 WAT 2578 90.648 120.434 135.743 1.00 0.00 H TER 19993 WAT 2578 ATOM 19993 O WAT 2579 28.117 100.713 121.248 1.00 0.00 O ATOM 19994 H1 WAT 2579 28.362 99.789 121.302 1.00 0.00 H ATOM 19995 H2 WAT 2579 27.683 100.795 120.399 1.00 0.00 H TER 19997 WAT 2579 ATOM 19997 O WAT 2580 130.932 136.237 139.295 1.00 0.00 O ATOM 19998 H1 WAT 2580 130.264 136.920 139.245 1.00 0.00 H ATOM 19999 H2 WAT 2580 130.720 135.752 140.093 1.00 0.00 H TER 20001 WAT 2580 ATOM 20001 O WAT 2581 67.340 60.455 124.280 1.00 0.00 O ATOM 20002 H1 WAT 2581 67.041 59.689 123.791 1.00 0.00 H ATOM 20003 H2 WAT 2581 68.115 60.755 123.806 1.00 0.00 H TER 20005 WAT 2581 ATOM 20005 O WAT 2582 50.657 17.993 119.019 1.00 0.00 O ATOM 20006 H1 WAT 2582 49.905 17.746 119.558 1.00 0.00 H ATOM 20007 H2 WAT 2582 51.238 17.234 119.058 1.00 0.00 H TER 20009 WAT 2582 ATOM 20009 O WAT 2583 70.598 115.479 73.970 1.00 0.00 O ATOM 20010 H1 WAT 2583 69.836 115.652 74.522 1.00 0.00 H ATOM 20011 H2 WAT 2583 70.825 116.332 73.600 1.00 0.00 H TER 20013 WAT 2583 ATOM 20013 O WAT 2584 33.157 14.878 93.271 1.00 0.00 O ATOM 20014 H1 WAT 2584 33.862 15.079 93.886 1.00 0.00 H ATOM 20015 H2 WAT 2584 33.605 14.688 92.446 1.00 0.00 H TER 20017 WAT 2584 ATOM 20017 O WAT 2585 71.917 136.435 102.289 1.00 0.00 O ATOM 20018 H1 WAT 2585 71.630 136.905 103.071 1.00 0.00 H ATOM 20019 H2 WAT 2585 72.481 137.057 101.829 1.00 0.00 H TER 20021 WAT 2585 ATOM 20021 O WAT 2586 27.454 99.570 59.044 1.00 0.00 O ATOM 20022 H1 WAT 2586 27.348 99.810 58.123 1.00 0.00 H ATOM 20023 H2 WAT 2586 26.620 99.809 59.450 1.00 0.00 H TER 20025 WAT 2586 ATOM 20025 O WAT 2587 136.624 9.241 96.015 1.00 0.00 O ATOM 20026 H1 WAT 2587 136.933 8.367 96.252 1.00 0.00 H ATOM 20027 H2 WAT 2587 136.964 9.384 95.131 1.00 0.00 H TER 20029 WAT 2587 ATOM 20029 O WAT 2588 40.385 76.259 4.192 1.00 0.00 O ATOM 20030 H1 WAT 2588 41.263 76.293 4.570 1.00 0.00 H ATOM 20031 H2 WAT 2588 40.292 77.090 3.725 1.00 0.00 H TER 20033 WAT 2588 ATOM 20033 O WAT 2589 92.016 123.442 138.938 1.00 0.00 O ATOM 20034 H1 WAT 2589 91.187 123.058 139.224 1.00 0.00 H ATOM 20035 H2 WAT 2589 91.980 124.347 139.247 1.00 0.00 H TER 20037 WAT 2589 ATOM 20037 O WAT 2590 107.788 41.808 70.692 1.00 0.00 O ATOM 20038 H1 WAT 2590 106.908 41.563 70.978 1.00 0.00 H ATOM 20039 H2 WAT 2590 107.746 41.780 69.736 1.00 0.00 H TER 20041 WAT 2590 ATOM 20041 O WAT 2591 38.059 17.619 115.449 1.00 0.00 O ATOM 20042 H1 WAT 2591 37.885 18.343 116.051 1.00 0.00 H ATOM 20043 H2 WAT 2591 38.137 16.851 116.014 1.00 0.00 H TER 20045 WAT 2591 ATOM 20045 O WAT 2592 126.192 1.797 98.588 1.00 0.00 O ATOM 20046 H1 WAT 2592 125.935 0.926 98.286 1.00 0.00 H ATOM 20047 H2 WAT 2592 126.652 2.183 97.842 1.00 0.00 H TER 20049 WAT 2592 ATOM 20049 O WAT 2593 69.491 91.787 152.679 1.00 0.00 O ATOM 20050 H1 WAT 2593 70.178 91.713 153.341 1.00 0.00 H ATOM 20051 H2 WAT 2593 69.252 92.714 152.685 1.00 0.00 H TER 20053 WAT 2593 ATOM 20053 O WAT 2594 51.231 136.208 124.199 1.00 0.00 O ATOM 20054 H1 WAT 2594 51.248 137.079 124.595 1.00 0.00 H ATOM 20055 H2 WAT 2594 52.053 136.150 123.712 1.00 0.00 H TER 20057 WAT 2594 ATOM 20057 O WAT 2595 105.487 30.077 144.800 1.00 0.00 O ATOM 20058 H1 WAT 2595 105.964 29.254 144.908 1.00 0.00 H ATOM 20059 H2 WAT 2595 106.165 30.752 144.825 1.00 0.00 H TER 20061 WAT 2595 ATOM 20061 O WAT 2596 60.617 15.167 154.147 1.00 0.00 O ATOM 20062 H1 WAT 2596 60.028 14.739 153.526 1.00 0.00 H ATOM 20063 H2 WAT 2596 61.491 15.038 153.776 1.00 0.00 H TER 20065 WAT 2596 ATOM 20065 O WAT 2597 134.468 29.779 14.653 1.00 0.00 O ATOM 20066 H1 WAT 2597 134.815 29.046 14.146 1.00 0.00 H ATOM 20067 H2 WAT 2597 133.753 30.124 14.118 1.00 0.00 H TER 20069 WAT 2597 ATOM 20069 O WAT 2598 33.418 58.090 19.015 1.00 0.00 O ATOM 20070 H1 WAT 2598 33.444 57.969 19.964 1.00 0.00 H ATOM 20071 H2 WAT 2598 32.740 57.485 18.715 1.00 0.00 H TER 20073 WAT 2598 ATOM 20073 O WAT 2599 95.013 32.299 123.195 1.00 0.00 O ATOM 20074 H1 WAT 2599 95.440 33.151 123.282 1.00 0.00 H ATOM 20075 H2 WAT 2599 94.297 32.324 123.829 1.00 0.00 H TER 20077 WAT 2599 ATOM 20077 O WAT 2600 112.518 135.924 87.838 1.00 0.00 O ATOM 20078 H1 WAT 2600 112.313 135.958 86.904 1.00 0.00 H ATOM 20079 H2 WAT 2600 113.393 135.536 87.877 1.00 0.00 H TER 20081 WAT 2600 ATOM 20081 O WAT 2601 114.522 50.194 66.578 1.00 0.00 O ATOM 20082 H1 WAT 2601 114.472 49.649 65.792 1.00 0.00 H ATOM 20083 H2 WAT 2601 115.278 50.761 66.429 1.00 0.00 H TER 20085 WAT 2601 ATOM 20085 O WAT 2602 25.270 64.600 8.420 1.00 0.00 O ATOM 20086 H1 WAT 2602 24.788 65.362 8.743 1.00 0.00 H ATOM 20087 H2 WAT 2602 24.773 63.848 8.741 1.00 0.00 H TER 20089 WAT 2602 ATOM 20089 O WAT 2603 49.301 107.247 156.653 1.00 0.00 O ATOM 20090 H1 WAT 2603 48.510 106.713 156.725 1.00 0.00 H ATOM 20091 H2 WAT 2603 49.790 107.060 157.454 1.00 0.00 H TER 20093 WAT 2603 ATOM 20093 O WAT 2604 67.836 6.206 154.834 1.00 0.00 O ATOM 20094 H1 WAT 2604 67.842 6.356 153.889 1.00 0.00 H ATOM 20095 H2 WAT 2604 68.761 6.188 155.080 1.00 0.00 H TER 20097 WAT 2604 ATOM 20097 O WAT 2605 98.747 34.640 4.895 1.00 0.00 O ATOM 20098 H1 WAT 2605 98.559 33.897 4.322 1.00 0.00 H ATOM 20099 H2 WAT 2605 99.406 34.311 5.506 1.00 0.00 H TER 20101 WAT 2605 ATOM 20101 O WAT 2606 140.167 88.394 114.898 1.00 0.00 O ATOM 20102 H1 WAT 2606 140.772 87.923 115.470 1.00 0.00 H ATOM 20103 H2 WAT 2606 140.732 88.920 114.332 1.00 0.00 H TER 20105 WAT 2606 ATOM 20105 O WAT 2607 -0.173 39.367 131.276 1.00 0.00 O ATOM 20106 H1 WAT 2607 0.552 39.822 130.846 1.00 0.00 H ATOM 20107 H2 WAT 2607 0.217 38.988 132.064 1.00 0.00 H TER 20109 WAT 2607 ATOM 20109 O WAT 2608 135.440 79.069 129.224 1.00 0.00 O ATOM 20110 H1 WAT 2608 135.896 78.384 129.713 1.00 0.00 H ATOM 20111 H2 WAT 2608 135.914 79.872 129.438 1.00 0.00 H TER 20113 WAT 2608 ATOM 20113 O WAT 2609 68.453 113.039 66.026 1.00 0.00 O ATOM 20114 H1 WAT 2609 68.916 113.766 65.611 1.00 0.00 H ATOM 20115 H2 WAT 2609 67.526 113.250 65.914 1.00 0.00 H TER 20117 WAT 2609 ATOM 20117 O WAT 2610 141.031 23.473 114.745 1.00 0.00 O ATOM 20118 H1 WAT 2610 141.207 22.533 114.781 1.00 0.00 H ATOM 20119 H2 WAT 2610 141.742 23.830 114.213 1.00 0.00 H TER 20121 WAT 2610 ATOM 20121 O WAT 2611 2.594 125.294 104.953 1.00 0.00 O ATOM 20122 H1 WAT 2611 2.497 126.219 104.725 1.00 0.00 H ATOM 20123 H2 WAT 2611 2.953 124.889 104.164 1.00 0.00 H TER 20125 WAT 2611 ATOM 20125 O WAT 2612 60.648 89.455 98.023 1.00 0.00 O ATOM 20126 H1 WAT 2612 59.812 89.054 98.262 1.00 0.00 H ATOM 20127 H2 WAT 2612 61.131 88.757 97.581 1.00 0.00 H TER 20129 WAT 2612 ATOM 20129 O WAT 2613 28.084 3.423 104.258 1.00 0.00 O ATOM 20130 H1 WAT 2613 27.445 3.713 103.607 1.00 0.00 H ATOM 20131 H2 WAT 2613 28.805 3.063 103.741 1.00 0.00 H TER 20133 WAT 2613 ATOM 20133 O WAT 2614 44.483 8.785 108.601 1.00 0.00 O ATOM 20134 H1 WAT 2614 44.388 9.331 107.820 1.00 0.00 H ATOM 20135 H2 WAT 2614 43.771 8.148 108.536 1.00 0.00 H TER 20137 WAT 2614 ATOM 20137 O WAT 2615 16.135 27.800 6.898 1.00 0.00 O ATOM 20138 H1 WAT 2615 15.695 27.149 7.446 1.00 0.00 H ATOM 20139 H2 WAT 2615 16.499 27.294 6.172 1.00 0.00 H TER 20141 WAT 2615 ATOM 20141 O WAT 2616 35.197 15.093 116.099 1.00 0.00 O ATOM 20142 H1 WAT 2616 34.698 15.415 115.348 1.00 0.00 H ATOM 20143 H2 WAT 2616 34.546 14.992 116.793 1.00 0.00 H TER 20145 WAT 2616 ATOM 20145 O WAT 2617 88.019 16.031 93.944 1.00 0.00 O ATOM 20146 H1 WAT 2617 88.726 16.299 94.532 1.00 0.00 H ATOM 20147 H2 WAT 2617 87.675 16.852 93.593 1.00 0.00 H TER 20149 WAT 2617 ATOM 20149 O WAT 2618 54.771 32.899 25.826 1.00 0.00 O ATOM 20150 H1 WAT 2618 55.427 33.097 25.158 1.00 0.00 H ATOM 20151 H2 WAT 2618 55.254 32.924 26.652 1.00 0.00 H TER 20153 WAT 2618 ATOM 20153 O WAT 2619 93.358 6.239 7.910 1.00 0.00 O ATOM 20154 H1 WAT 2619 93.685 6.125 7.018 1.00 0.00 H ATOM 20155 H2 WAT 2619 92.525 5.770 7.922 1.00 0.00 H TER 20157 WAT 2619 ATOM 20157 O WAT 2620 106.717 105.069 63.310 1.00 0.00 O ATOM 20158 H1 WAT 2620 107.104 104.357 62.801 1.00 0.00 H ATOM 20159 H2 WAT 2620 106.321 105.644 62.654 1.00 0.00 H TER 20161 WAT 2620 ATOM 20161 O WAT 2621 55.525 0.764 138.074 1.00 0.00 O ATOM 20162 H1 WAT 2621 55.673 -0.142 138.345 1.00 0.00 H ATOM 20163 H2 WAT 2621 54.815 0.709 137.434 1.00 0.00 H TER 20165 WAT 2621 ATOM 20165 O WAT 2622 35.618 46.369 58.686 1.00 0.00 O ATOM 20166 H1 WAT 2622 35.656 47.325 58.706 1.00 0.00 H ATOM 20167 H2 WAT 2622 35.202 46.128 59.513 1.00 0.00 H TER 20169 WAT 2622 ATOM 20169 O WAT 2623 133.712 110.076 83.663 1.00 0.00 O ATOM 20170 H1 WAT 2623 133.404 110.646 84.368 1.00 0.00 H ATOM 20171 H2 WAT 2623 134.634 110.308 83.553 1.00 0.00 H TER 20173 WAT 2623 ATOM 20173 O WAT 2624 7.780 59.155 17.355 1.00 0.00 O ATOM 20174 H1 WAT 2624 7.355 58.679 16.642 1.00 0.00 H ATOM 20175 H2 WAT 2624 7.440 58.746 18.151 1.00 0.00 H TER 20177 WAT 2624 ATOM 20177 O WAT 2625 101.134 68.936 63.003 1.00 0.00 O ATOM 20178 H1 WAT 2625 101.733 68.255 63.310 1.00 0.00 H ATOM 20179 H2 WAT 2625 101.201 68.900 62.048 1.00 0.00 H TER 20181 WAT 2625 ATOM 20181 O WAT 2626 145.748 66.589 23.178 1.00 0.00 O ATOM 20182 H1 WAT 2626 145.345 66.278 23.988 1.00 0.00 H ATOM 20183 H2 WAT 2626 146.432 65.946 22.989 1.00 0.00 H TER 20185 WAT 2626 ATOM 20185 O WAT 2627 142.012 119.293 9.768 1.00 0.00 O ATOM 20186 H1 WAT 2627 141.395 119.924 10.139 1.00 0.00 H ATOM 20187 H2 WAT 2627 142.126 118.637 10.456 1.00 0.00 H TER 20189 WAT 2627 ATOM 20189 O WAT 2628 95.131 9.545 51.619 1.00 0.00 O ATOM 20190 H1 WAT 2628 96.043 9.256 51.597 1.00 0.00 H ATOM 20191 H2 WAT 2628 95.150 10.429 51.253 1.00 0.00 H TER 20193 WAT 2628 ATOM 20193 O WAT 2629 65.490 143.923 106.503 1.00 0.00 O ATOM 20194 H1 WAT 2629 66.276 143.494 106.842 1.00 0.00 H ATOM 20195 H2 WAT 2629 64.857 143.213 106.396 1.00 0.00 H TER 20197 WAT 2629 ATOM 20197 O WAT 2630 30.459 53.539 88.259 1.00 0.00 O ATOM 20198 H1 WAT 2630 29.774 53.799 87.643 1.00 0.00 H ATOM 20199 H2 WAT 2630 30.203 53.946 89.087 1.00 0.00 H TER 20201 WAT 2630 ATOM 20201 O WAT 2631 17.628 94.794 81.753 1.00 0.00 O ATOM 20202 H1 WAT 2631 18.014 95.664 81.850 1.00 0.00 H ATOM 20203 H2 WAT 2631 18.376 94.197 81.764 1.00 0.00 H TER 20205 WAT 2631 ATOM 20205 O WAT 2632 106.325 101.156 68.616 1.00 0.00 O ATOM 20206 H1 WAT 2632 105.754 100.521 69.049 1.00 0.00 H ATOM 20207 H2 WAT 2632 107.175 100.719 68.567 1.00 0.00 H TER 20209 WAT 2632 ATOM 20209 O WAT 2633 36.941 56.287 143.839 1.00 0.00 O ATOM 20210 H1 WAT 2633 36.986 57.240 143.754 1.00 0.00 H ATOM 20211 H2 WAT 2633 37.718 55.969 143.380 1.00 0.00 H TER 20213 WAT 2633 ATOM 20213 O WAT 2634 93.880 42.413 94.486 1.00 0.00 O ATOM 20214 H1 WAT 2634 93.911 43.012 95.231 1.00 0.00 H ATOM 20215 H2 WAT 2634 94.794 42.172 94.333 1.00 0.00 H TER 20217 WAT 2634 ATOM 20217 O WAT 2635 85.465 29.572 150.940 1.00 0.00 O ATOM 20218 H1 WAT 2635 85.666 29.172 150.094 1.00 0.00 H ATOM 20219 H2 WAT 2635 85.332 28.831 151.531 1.00 0.00 H TER 20221 WAT 2635 ATOM 20221 O WAT 2636 103.755 104.905 131.811 1.00 0.00 O ATOM 20222 H1 WAT 2636 103.609 105.185 130.907 1.00 0.00 H ATOM 20223 H2 WAT 2636 102.916 104.536 132.086 1.00 0.00 H TER 20225 WAT 2636 ATOM 20225 O WAT 2637 33.026 36.472 62.496 1.00 0.00 O ATOM 20226 H1 WAT 2637 33.392 37.146 61.923 1.00 0.00 H ATOM 20227 H2 WAT 2637 33.625 36.439 63.241 1.00 0.00 H TER 20229 WAT 2637 ATOM 20229 O WAT 2638 54.846 62.809 108.781 1.00 0.00 O ATOM 20230 H1 WAT 2638 54.035 63.061 109.222 1.00 0.00 H ATOM 20231 H2 WAT 2638 54.679 62.981 107.855 1.00 0.00 H TER 20233 WAT 2638 ATOM 20233 O WAT 2639 139.453 137.581 10.843 1.00 0.00 O ATOM 20234 H1 WAT 2639 138.970 136.799 11.108 1.00 0.00 H ATOM 20235 H2 WAT 2639 140.217 137.597 11.419 1.00 0.00 H TER 20237 WAT 2639 ATOM 20237 O WAT 2640 69.543 106.617 71.591 1.00 0.00 O ATOM 20238 H1 WAT 2640 70.487 106.475 71.665 1.00 0.00 H ATOM 20239 H2 WAT 2640 69.174 105.737 71.517 1.00 0.00 H TER 20241 WAT 2640 ATOM 20241 O WAT 2641 133.079 54.827 90.457 1.00 0.00 O ATOM 20242 H1 WAT 2641 133.523 54.228 89.857 1.00 0.00 H ATOM 20243 H2 WAT 2641 133.788 55.260 90.932 1.00 0.00 H TER 20245 WAT 2641 ATOM 20245 O WAT 2642 34.004 27.298 135.117 1.00 0.00 O ATOM 20246 H1 WAT 2642 33.557 26.908 135.868 1.00 0.00 H ATOM 20247 H2 WAT 2642 34.666 26.652 134.870 1.00 0.00 H TER 20249 WAT 2642 ATOM 20249 O WAT 2643 120.929 69.249 146.692 1.00 0.00 O ATOM 20250 H1 WAT 2643 120.824 69.586 145.802 1.00 0.00 H ATOM 20251 H2 WAT 2643 121.094 68.313 146.576 1.00 0.00 H TER 20253 WAT 2643 ATOM 20253 O WAT 2644 93.059 65.254 121.732 1.00 0.00 O ATOM 20254 H1 WAT 2644 93.891 64.842 121.503 1.00 0.00 H ATOM 20255 H2 WAT 2644 92.859 65.821 120.987 1.00 0.00 H TER 20257 WAT 2644 ATOM 20257 O WAT 2645 114.329 43.513 126.362 1.00 0.00 O ATOM 20258 H1 WAT 2645 114.850 44.013 125.734 1.00 0.00 H ATOM 20259 H2 WAT 2645 114.045 42.740 125.874 1.00 0.00 H TER 20261 WAT 2645 ATOM 20261 O WAT 2646 5.685 101.429 155.974 1.00 0.00 O ATOM 20262 H1 WAT 2646 5.598 102.380 156.038 1.00 0.00 H ATOM 20263 H2 WAT 2646 6.333 101.203 156.642 1.00 0.00 H TER 20265 WAT 2646 ATOM 20265 O WAT 2647 18.777 55.987 135.331 1.00 0.00 O ATOM 20266 H1 WAT 2647 19.551 55.436 135.215 1.00 0.00 H ATOM 20267 H2 WAT 2647 18.786 56.221 136.260 1.00 0.00 H TER 20269 WAT 2647 ATOM 20269 O WAT 2648 41.555 102.218 151.525 1.00 0.00 O ATOM 20270 H1 WAT 2648 41.065 102.675 150.842 1.00 0.00 H ATOM 20271 H2 WAT 2648 41.896 101.435 151.092 1.00 0.00 H TER 20273 WAT 2648 ATOM 20273 O WAT 2649 121.436 59.821 142.959 1.00 0.00 O ATOM 20274 H1 WAT 2649 120.549 59.474 143.054 1.00 0.00 H ATOM 20275 H2 WAT 2649 121.862 59.625 143.793 1.00 0.00 H TER 20277 WAT 2649 ATOM 20277 O WAT 2650 84.124 142.078 83.851 1.00 0.00 O ATOM 20278 H1 WAT 2650 83.818 142.202 82.952 1.00 0.00 H ATOM 20279 H2 WAT 2650 85.065 142.252 83.810 1.00 0.00 H TER 20281 WAT 2650 ATOM 20281 O WAT 2651 30.208 59.842 113.344 1.00 0.00 O ATOM 20282 H1 WAT 2651 30.586 59.055 113.737 1.00 0.00 H ATOM 20283 H2 WAT 2651 30.955 60.297 112.953 1.00 0.00 H TER 20285 WAT 2651 ATOM 20285 O WAT 2652 94.767 124.055 103.537 1.00 0.00 O ATOM 20286 H1 WAT 2652 94.824 124.561 102.727 1.00 0.00 H ATOM 20287 H2 WAT 2652 95.060 124.660 104.218 1.00 0.00 H TER 20289 WAT 2652 ATOM 20289 O WAT 2653 2.887 2.982 115.304 1.00 0.00 O ATOM 20290 H1 WAT 2653 3.277 2.155 115.022 1.00 0.00 H ATOM 20291 H2 WAT 2653 1.948 2.801 115.353 1.00 0.00 H TER 20293 WAT 2653 ATOM 20293 O WAT 2654 40.028 62.311 91.240 1.00 0.00 O ATOM 20294 H1 WAT 2654 40.510 61.656 91.744 1.00 0.00 H ATOM 20295 H2 WAT 2654 40.309 63.150 91.607 1.00 0.00 H TER 20297 WAT 2654 ATOM 20297 O WAT 2655 74.160 26.276 82.105 1.00 0.00 O ATOM 20298 H1 WAT 2655 74.279 26.002 83.015 1.00 0.00 H ATOM 20299 H2 WAT 2655 74.991 26.685 81.867 1.00 0.00 H TER 20301 WAT 2655 ATOM 20301 O WAT 2656 3.049 115.385 90.937 1.00 0.00 O ATOM 20302 H1 WAT 2656 3.861 114.922 91.144 1.00 0.00 H ATOM 20303 H2 WAT 2656 2.546 114.762 90.412 1.00 0.00 H TER 20305 WAT 2656 ATOM 20305 O WAT 2657 134.982 128.881 91.235 1.00 0.00 O ATOM 20306 H1 WAT 2657 134.407 129.597 90.965 1.00 0.00 H ATOM 20307 H2 WAT 2657 135.592 128.776 90.505 1.00 0.00 H TER 20309 WAT 2657 ATOM 20309 O WAT 2658 55.132 16.687 18.521 1.00 0.00 O ATOM 20310 H1 WAT 2658 55.953 16.212 18.397 1.00 0.00 H ATOM 20311 H2 WAT 2658 54.753 16.307 19.314 1.00 0.00 H TER 20313 WAT 2658 ATOM 20313 O WAT 2659 45.732 22.991 0.993 1.00 0.00 O ATOM 20314 H1 WAT 2659 46.317 22.967 1.749 1.00 0.00 H ATOM 20315 H2 WAT 2659 46.263 22.662 0.268 1.00 0.00 H TER 20317 WAT 2659 ATOM 20317 O WAT 2660 63.997 2.972 92.015 1.00 0.00 O ATOM 20318 H1 WAT 2660 63.782 2.779 91.103 1.00 0.00 H ATOM 20319 H2 WAT 2660 63.252 2.635 92.513 1.00 0.00 H TER 20321 WAT 2660 ATOM 20321 O WAT 2661 111.629 50.752 115.180 1.00 0.00 O ATOM 20322 H1 WAT 2661 111.951 49.913 115.511 1.00 0.00 H ATOM 20323 H2 WAT 2661 111.379 51.239 115.965 1.00 0.00 H TER 20325 WAT 2661 ATOM 20325 O WAT 2662 49.924 135.245 92.094 1.00 0.00 O ATOM 20326 H1 WAT 2662 48.976 135.309 92.209 1.00 0.00 H ATOM 20327 H2 WAT 2662 50.054 134.415 91.635 1.00 0.00 H TER 20329 WAT 2662 ATOM 20329 O WAT 2663 57.348 79.526 61.827 1.00 0.00 O ATOM 20330 H1 WAT 2663 57.308 78.886 62.538 1.00 0.00 H ATOM 20331 H2 WAT 2663 58.060 79.218 61.267 1.00 0.00 H TER 20333 WAT 2663 ATOM 20333 O WAT 2664 76.456 24.845 97.100 1.00 0.00 O ATOM 20334 H1 WAT 2664 76.115 24.215 96.464 1.00 0.00 H ATOM 20335 H2 WAT 2664 75.802 25.544 97.118 1.00 0.00 H TER 20337 WAT 2664 ATOM 20337 O WAT 2665 34.788 55.088 56.647 1.00 0.00 O ATOM 20338 H1 WAT 2665 35.375 55.815 56.439 1.00 0.00 H ATOM 20339 H2 WAT 2665 34.173 55.451 57.285 1.00 0.00 H TER 20341 WAT 2665 ATOM 20341 O WAT 2666 65.225 136.202 56.369 1.00 0.00 O ATOM 20342 H1 WAT 2666 64.685 136.464 55.624 1.00 0.00 H ATOM 20343 H2 WAT 2666 65.008 136.832 57.056 1.00 0.00 H TER 20345 WAT 2666 ATOM 20345 O WAT 2667 44.069 90.856 119.673 1.00 0.00 O ATOM 20346 H1 WAT 2667 44.880 90.786 119.170 1.00 0.00 H ATOM 20347 H2 WAT 2667 43.954 91.795 119.814 1.00 0.00 H TER 20349 WAT 2667 ATOM 20349 O WAT 2668 77.159 124.883 54.023 1.00 0.00 O ATOM 20350 H1 WAT 2668 76.975 125.730 53.617 1.00 0.00 H ATOM 20351 H2 WAT 2668 78.115 124.833 54.052 1.00 0.00 H TER 20353 WAT 2668 ATOM 20353 O WAT 2669 112.053 83.575 152.924 1.00 0.00 O ATOM 20354 H1 WAT 2669 112.202 83.684 153.863 1.00 0.00 H ATOM 20355 H2 WAT 2669 111.738 82.676 152.833 1.00 0.00 H TER 20357 WAT 2669 ATOM 20357 O WAT 2670 71.969 63.966 20.761 1.00 0.00 O ATOM 20358 H1 WAT 2670 71.382 63.340 20.337 1.00 0.00 H ATOM 20359 H2 WAT 2670 72.563 63.424 21.280 1.00 0.00 H TER 20361 WAT 2670 ATOM 20361 O WAT 2671 82.476 4.808 94.473 1.00 0.00 O ATOM 20362 H1 WAT 2671 81.723 5.053 95.012 1.00 0.00 H ATOM 20363 H2 WAT 2671 82.334 3.884 94.269 1.00 0.00 H TER 20365 WAT 2671 ATOM 20365 O WAT 2672 -0.063 140.477 117.844 1.00 0.00 O ATOM 20366 H1 WAT 2672 0.470 139.760 118.187 1.00 0.00 H ATOM 20367 H2 WAT 2672 0.086 140.454 116.899 1.00 0.00 H TER 20369 WAT 2672 ATOM 20369 O WAT 2673 74.926 110.408 142.131 1.00 0.00 O ATOM 20370 H1 WAT 2673 74.969 109.881 141.333 1.00 0.00 H ATOM 20371 H2 WAT 2673 74.110 110.901 142.048 1.00 0.00 H TER 20373 WAT 2673 ATOM 20373 O WAT 2674 43.435 95.577 118.020 1.00 0.00 O ATOM 20374 H1 WAT 2674 42.543 95.361 118.292 1.00 0.00 H ATOM 20375 H2 WAT 2674 43.568 95.077 117.215 1.00 0.00 H TER 20377 WAT 2674 ATOM 20377 O WAT 2675 8.604 76.010 111.886 1.00 0.00 O ATOM 20378 H1 WAT 2675 8.851 75.096 112.029 1.00 0.00 H ATOM 20379 H2 WAT 2675 8.658 76.411 112.753 1.00 0.00 H TER 20381 WAT 2675 ATOM 20381 O WAT 2676 51.809 106.814 18.651 1.00 0.00 O ATOM 20382 H1 WAT 2676 52.039 106.352 19.457 1.00 0.00 H ATOM 20383 H2 WAT 2676 51.719 107.729 18.916 1.00 0.00 H TER 20385 WAT 2676 ATOM 20385 O WAT 2677 117.143 37.483 86.439 1.00 0.00 O ATOM 20386 H1 WAT 2677 117.634 37.519 85.618 1.00 0.00 H ATOM 20387 H2 WAT 2677 117.101 38.392 86.734 1.00 0.00 H TER 20389 WAT 2677 ATOM 20389 O WAT 2678 58.441 143.244 57.286 1.00 0.00 O ATOM 20390 H1 WAT 2678 59.351 143.170 57.000 1.00 0.00 H ATOM 20391 H2 WAT 2678 58.249 142.401 57.697 1.00 0.00 H TER 20393 WAT 2678 ATOM 20393 O WAT 2679 124.184 13.804 13.918 1.00 0.00 O ATOM 20394 H1 WAT 2679 125.012 13.565 14.335 1.00 0.00 H ATOM 20395 H2 WAT 2679 123.782 14.426 14.525 1.00 0.00 H TER 20397 WAT 2679 ATOM 20397 O WAT 2680 91.202 106.801 68.083 1.00 0.00 O ATOM 20398 H1 WAT 2680 90.420 106.370 68.429 1.00 0.00 H ATOM 20399 H2 WAT 2680 91.330 107.559 68.653 1.00 0.00 H TER 20401 WAT 2680 ATOM 20401 O WAT 2681 16.949 67.119 70.260 1.00 0.00 O ATOM 20402 H1 WAT 2681 17.174 66.550 70.996 1.00 0.00 H ATOM 20403 H2 WAT 2681 17.060 66.565 69.487 1.00 0.00 H TER 20405 WAT 2681 ATOM 20405 O WAT 2682 33.790 126.615 79.412 1.00 0.00 O ATOM 20406 H1 WAT 2682 33.721 125.761 79.839 1.00 0.00 H ATOM 20407 H2 WAT 2682 33.524 126.452 78.507 1.00 0.00 H TER 20409 WAT 2682 ATOM 20409 O WAT 2683 98.108 38.526 16.724 1.00 0.00 O ATOM 20410 H1 WAT 2683 97.898 37.935 16.000 1.00 0.00 H ATOM 20411 H2 WAT 2683 97.264 38.896 16.984 1.00 0.00 H TER 20413 WAT 2683 ATOM 20413 O WAT 2684 125.765 112.385 16.755 1.00 0.00 O ATOM 20414 H1 WAT 2684 125.174 113.050 17.109 1.00 0.00 H ATOM 20415 H2 WAT 2684 126.340 112.868 16.161 1.00 0.00 H TER 20417 WAT 2684 ATOM 20417 O WAT 2685 27.070 113.276 99.608 1.00 0.00 O ATOM 20418 H1 WAT 2685 27.107 114.051 100.168 1.00 0.00 H ATOM 20419 H2 WAT 2685 27.830 112.756 99.869 1.00 0.00 H TER 20421 WAT 2685 ATOM 20421 O WAT 2686 1.357 38.781 109.760 1.00 0.00 O ATOM 20422 H1 WAT 2686 0.990 38.813 110.643 1.00 0.00 H ATOM 20423 H2 WAT 2686 1.023 39.570 109.333 1.00 0.00 H TER 20425 WAT 2686 ATOM 20425 O WAT 2687 126.873 73.828 147.365 1.00 0.00 O ATOM 20426 H1 WAT 2687 126.172 73.520 147.939 1.00 0.00 H ATOM 20427 H2 WAT 2687 127.680 73.564 147.808 1.00 0.00 H TER 20429 WAT 2687 ATOM 20429 O WAT 2688 17.845 120.133 11.652 1.00 0.00 O ATOM 20430 H1 WAT 2688 17.121 120.043 12.272 1.00 0.00 H ATOM 20431 H2 WAT 2688 18.496 120.656 12.118 1.00 0.00 H TER 20433 WAT 2688 ATOM 20433 O WAT 2689 105.839 3.496 86.139 1.00 0.00 O ATOM 20434 H1 WAT 2689 105.908 3.213 87.051 1.00 0.00 H ATOM 20435 H2 WAT 2689 105.053 4.042 86.117 1.00 0.00 H TER 20437 WAT 2689 ATOM 20437 O WAT 2690 143.648 120.883 138.935 1.00 0.00 O ATOM 20438 H1 WAT 2690 143.773 120.762 137.994 1.00 0.00 H ATOM 20439 H2 WAT 2690 143.812 120.018 139.312 1.00 0.00 H TER 20441 WAT 2690 ATOM 20441 O WAT 2691 115.990 102.010 120.976 1.00 0.00 O ATOM 20442 H1 WAT 2691 115.712 102.828 121.388 1.00 0.00 H ATOM 20443 H2 WAT 2691 115.181 101.623 120.641 1.00 0.00 H TER 20445 WAT 2691 ATOM 20445 O WAT 2692 144.472 30.972 118.057 1.00 0.00 O ATOM 20446 H1 WAT 2692 144.091 30.094 118.044 1.00 0.00 H ATOM 20447 H2 WAT 2692 145.087 30.978 117.323 1.00 0.00 H TER 20449 WAT 2692 ATOM 20449 O WAT 2693 87.666 47.840 5.279 1.00 0.00 O ATOM 20450 H1 WAT 2693 88.255 48.149 4.590 1.00 0.00 H ATOM 20451 H2 WAT 2693 87.148 48.610 5.514 1.00 0.00 H TER 20453 WAT 2693 ATOM 20453 O WAT 2694 49.768 123.154 2.058 1.00 0.00 O ATOM 20454 H1 WAT 2694 48.864 122.900 1.873 1.00 0.00 H ATOM 20455 H2 WAT 2694 49.726 124.098 2.209 1.00 0.00 H TER 20457 WAT 2694 ATOM 20457 O WAT 2695 130.522 46.834 94.222 1.00 0.00 O ATOM 20458 H1 WAT 2695 131.373 47.109 94.564 1.00 0.00 H ATOM 20459 H2 WAT 2695 129.885 47.253 94.799 1.00 0.00 H TER 20461 WAT 2695 ATOM 20461 O WAT 2696 74.444 143.825 154.808 1.00 0.00 O ATOM 20462 H1 WAT 2696 73.535 143.897 155.097 1.00 0.00 H ATOM 20463 H2 WAT 2696 74.801 143.098 155.319 1.00 0.00 H TER 20465 WAT 2696 ATOM 20465 O WAT 2697 6.407 3.266 112.463 1.00 0.00 O ATOM 20466 H1 WAT 2697 6.879 3.033 113.262 1.00 0.00 H ATOM 20467 H2 WAT 2697 5.833 3.986 112.724 1.00 0.00 H TER 20469 WAT 2697 ATOM 20469 O WAT 2698 93.994 34.930 92.513 1.00 0.00 O ATOM 20470 H1 WAT 2698 93.703 34.343 93.211 1.00 0.00 H ATOM 20471 H2 WAT 2698 94.950 34.889 92.548 1.00 0.00 H TER 20473 WAT 2698 ATOM 20473 O WAT 2699 95.061 88.867 19.416 1.00 0.00 O ATOM 20474 H1 WAT 2699 94.171 89.095 19.147 1.00 0.00 H ATOM 20475 H2 WAT 2699 94.947 88.389 20.237 1.00 0.00 H TER 20477 WAT 2699 ATOM 20477 O WAT 2700 92.135 42.298 121.781 1.00 0.00 O ATOM 20478 H1 WAT 2700 92.653 42.035 121.020 1.00 0.00 H ATOM 20479 H2 WAT 2700 91.234 42.329 121.458 1.00 0.00 H TER 20481 WAT 2700 ATOM 20481 O WAT 2701 135.913 29.527 118.397 1.00 0.00 O ATOM 20482 H1 WAT 2701 134.966 29.483 118.527 1.00 0.00 H ATOM 20483 H2 WAT 2701 136.277 29.489 119.282 1.00 0.00 H TER 20485 WAT 2701 ATOM 20485 O WAT 2702 79.330 111.943 8.671 1.00 0.00 O ATOM 20486 H1 WAT 2702 79.905 111.445 9.252 1.00 0.00 H ATOM 20487 H2 WAT 2702 78.691 112.349 9.257 1.00 0.00 H TER 20489 WAT 2702 ATOM 20489 O WAT 2703 80.322 105.589 75.522 1.00 0.00 O ATOM 20490 H1 WAT 2703 80.325 106.515 75.277 1.00 0.00 H ATOM 20491 H2 WAT 2703 79.735 105.176 74.889 1.00 0.00 H TER 20493 WAT 2703 ATOM 20493 O WAT 2704 28.065 131.096 4.395 1.00 0.00 O ATOM 20494 H1 WAT 2704 28.826 131.577 4.721 1.00 0.00 H ATOM 20495 H2 WAT 2704 27.890 130.440 5.070 1.00 0.00 H TER 20497 WAT 2704 ATOM 20497 O WAT 2705 64.402 53.322 68.857 1.00 0.00 O ATOM 20498 H1 WAT 2705 64.686 54.157 69.229 1.00 0.00 H ATOM 20499 H2 WAT 2705 64.231 53.516 67.935 1.00 0.00 H TER 20501 WAT 2705 ATOM 20501 O WAT 2706 55.320 46.299 126.348 1.00 0.00 O ATOM 20502 H1 WAT 2706 54.747 47.039 126.548 1.00 0.00 H ATOM 20503 H2 WAT 2706 55.872 46.610 125.630 1.00 0.00 H TER 20505 WAT 2706 ATOM 20505 O WAT 2707 82.419 12.676 90.953 1.00 0.00 O ATOM 20506 H1 WAT 2707 82.924 13.413 90.609 1.00 0.00 H ATOM 20507 H2 WAT 2707 82.911 11.901 90.683 1.00 0.00 H TER 20509 WAT 2707 ATOM 20509 O WAT 2708 77.699 65.919 91.428 1.00 0.00 O ATOM 20510 H1 WAT 2708 78.414 65.410 91.045 1.00 0.00 H ATOM 20511 H2 WAT 2708 77.222 65.291 91.971 1.00 0.00 H TER 20513 WAT 2708 ATOM 20513 O WAT 2709 60.801 22.471 82.046 1.00 0.00 O ATOM 20514 H1 WAT 2709 60.705 22.699 82.970 1.00 0.00 H ATOM 20515 H2 WAT 2709 61.630 22.872 81.785 1.00 0.00 H TER 20517 WAT 2709 ATOM 20517 O WAT 2710 70.825 24.524 0.946 1.00 0.00 O ATOM 20518 H1 WAT 2710 71.205 25.350 0.648 1.00 0.00 H ATOM 20519 H2 WAT 2710 70.387 24.169 0.172 1.00 0.00 H TER 20521 WAT 2710 ATOM 20521 O WAT 2711 8.277 22.741 136.489 1.00 0.00 O ATOM 20522 H1 WAT 2711 8.609 23.306 137.187 1.00 0.00 H ATOM 20523 H2 WAT 2711 7.325 22.782 136.581 1.00 0.00 H TER 20525 WAT 2711 ATOM 20525 O WAT 2712 19.022 103.158 75.821 1.00 0.00 O ATOM 20526 H1 WAT 2712 19.841 102.664 75.862 1.00 0.00 H ATOM 20527 H2 WAT 2712 18.344 102.514 76.026 1.00 0.00 H TER 20529 WAT 2712 ATOM 20529 O WAT 2713 117.885 90.565 128.605 1.00 0.00 O ATOM 20530 H1 WAT 2713 118.243 89.741 128.937 1.00 0.00 H ATOM 20531 H2 WAT 2713 118.415 90.762 127.833 1.00 0.00 H TER 20533 WAT 2713 ATOM 20533 O WAT 2714 55.863 88.528 144.501 1.00 0.00 O ATOM 20534 H1 WAT 2714 55.248 89.042 143.977 1.00 0.00 H ATOM 20535 H2 WAT 2714 56.395 89.182 144.955 1.00 0.00 H TER 20537 WAT 2714 ATOM 20537 O WAT 2715 114.847 42.855 156.025 1.00 0.00 O ATOM 20538 H1 WAT 2715 115.494 42.672 155.344 1.00 0.00 H ATOM 20539 H2 WAT 2715 115.047 42.228 156.720 1.00 0.00 H TER 20541 WAT 2715 ATOM 20541 O WAT 2716 1.974 124.593 115.687 1.00 0.00 O ATOM 20542 H1 WAT 2716 1.191 124.348 115.192 1.00 0.00 H ATOM 20543 H2 WAT 2716 2.608 124.854 115.018 1.00 0.00 H TER 20545 WAT 2716 ATOM 20545 O WAT 2717 73.830 35.197 64.924 1.00 0.00 O ATOM 20546 H1 WAT 2717 74.532 35.720 64.537 1.00 0.00 H ATOM 20547 H2 WAT 2717 73.427 35.777 65.570 1.00 0.00 H TER 20549 WAT 2717 ATOM 20549 O WAT 2718 89.627 2.658 87.184 1.00 0.00 O ATOM 20550 H1 WAT 2718 89.551 2.133 87.981 1.00 0.00 H ATOM 20551 H2 WAT 2718 89.956 2.047 86.525 1.00 0.00 H TER 20553 WAT 2718 ATOM 20553 O WAT 2719 65.795 118.508 111.880 1.00 0.00 O ATOM 20554 H1 WAT 2719 65.338 118.313 111.062 1.00 0.00 H ATOM 20555 H2 WAT 2719 66.332 117.733 112.045 1.00 0.00 H TER 20557 WAT 2719 ATOM 20557 O WAT 2720 17.689 116.210 83.894 1.00 0.00 O ATOM 20558 H1 WAT 2720 17.518 115.797 83.048 1.00 0.00 H ATOM 20559 H2 WAT 2720 18.273 116.941 83.691 1.00 0.00 H TER 20561 WAT 2720 ATOM 20561 O WAT 2721 4.932 71.166 61.569 1.00 0.00 O ATOM 20562 H1 WAT 2721 4.264 71.852 61.577 1.00 0.00 H ATOM 20563 H2 WAT 2721 4.826 70.740 60.718 1.00 0.00 H TER 20565 WAT 2721 ATOM 20565 O WAT 2722 18.435 137.898 80.273 1.00 0.00 O ATOM 20566 H1 WAT 2722 18.746 138.583 80.865 1.00 0.00 H ATOM 20567 H2 WAT 2722 19.154 137.266 80.241 1.00 0.00 H TER 20569 WAT 2722 ATOM 20569 O WAT 2723 120.150 18.154 84.136 1.00 0.00 O ATOM 20570 H1 WAT 2723 120.420 17.374 84.621 1.00 0.00 H ATOM 20571 H2 WAT 2723 120.608 18.085 83.298 1.00 0.00 H TER 20573 WAT 2723 ATOM 20573 O WAT 2724 32.044 94.202 96.125 1.00 0.00 O ATOM 20574 H1 WAT 2724 32.975 94.421 96.161 1.00 0.00 H ATOM 20575 H2 WAT 2724 31.682 94.803 95.474 1.00 0.00 H TER 20577 WAT 2724 ATOM 20577 O WAT 2725 20.805 78.817 80.496 1.00 0.00 O ATOM 20578 H1 WAT 2725 20.519 78.589 79.611 1.00 0.00 H ATOM 20579 H2 WAT 2725 20.329 79.622 80.701 1.00 0.00 H TER 20581 WAT 2725 ATOM 20581 O WAT 2726 91.778 92.487 150.580 1.00 0.00 O ATOM 20582 H1 WAT 2726 92.111 91.595 150.678 1.00 0.00 H ATOM 20583 H2 WAT 2726 91.002 92.393 150.027 1.00 0.00 H TER 20585 WAT 2726 ATOM 20585 O WAT 2727 25.056 101.598 135.372 1.00 0.00 O ATOM 20586 H1 WAT 2727 24.106 101.721 135.381 1.00 0.00 H ATOM 20587 H2 WAT 2727 25.177 100.687 135.105 1.00 0.00 H TER 20589 WAT 2727 ATOM 20589 O WAT 2728 133.229 144.598 124.844 1.00 0.00 O ATOM 20590 H1 WAT 2728 134.165 144.563 125.044 1.00 0.00 H ATOM 20591 H2 WAT 2728 133.181 145.050 124.002 1.00 0.00 H TER 20593 WAT 2728 ATOM 20593 O WAT 2729 49.767 93.487 14.382 1.00 0.00 O ATOM 20594 H1 WAT 2729 49.548 93.930 15.202 1.00 0.00 H ATOM 20595 H2 WAT 2729 49.620 92.559 14.565 1.00 0.00 H TER 20597 WAT 2729 ATOM 20597 O WAT 2730 72.349 20.803 14.691 1.00 0.00 O ATOM 20598 H1 WAT 2730 73.177 21.058 14.284 1.00 0.00 H ATOM 20599 H2 WAT 2730 71.857 21.621 14.766 1.00 0.00 H TER 20601 WAT 2730 ATOM 20601 O WAT 2731 46.277 45.723 75.361 1.00 0.00 O ATOM 20602 H1 WAT 2731 46.315 46.558 75.827 1.00 0.00 H ATOM 20603 H2 WAT 2731 45.473 45.773 74.844 1.00 0.00 H TER 20605 WAT 2731 ATOM 20605 O WAT 2732 7.353 92.775 8.470 1.00 0.00 O ATOM 20606 H1 WAT 2732 6.469 92.762 8.834 1.00 0.00 H ATOM 20607 H2 WAT 2732 7.424 93.628 8.043 1.00 0.00 H TER 20609 WAT 2732 ATOM 20609 O WAT 2733 10.779 25.274 75.022 1.00 0.00 O ATOM 20610 H1 WAT 2733 10.908 26.183 74.749 1.00 0.00 H ATOM 20611 H2 WAT 2733 11.145 25.236 75.905 1.00 0.00 H TER 20613 WAT 2733 ATOM 20613 O WAT 2734 127.144 55.215 89.847 1.00 0.00 O ATOM 20614 H1 WAT 2734 127.451 54.534 89.247 1.00 0.00 H ATOM 20615 H2 WAT 2734 126.199 55.256 89.699 1.00 0.00 H TER 20617 WAT 2734 ATOM 20617 O WAT 2735 130.753 25.392 107.861 1.00 0.00 O ATOM 20618 H1 WAT 2735 130.014 25.928 108.149 1.00 0.00 H ATOM 20619 H2 WAT 2735 130.499 24.496 108.080 1.00 0.00 H TER 20621 WAT 2735 ATOM 20621 O WAT 2736 34.207 137.033 113.410 1.00 0.00 O ATOM 20622 H1 WAT 2736 34.999 137.462 113.086 1.00 0.00 H ATOM 20623 H2 WAT 2736 33.572 137.744 113.505 1.00 0.00 H TER 20625 WAT 2736 ATOM 20625 O WAT 2737 101.453 95.299 68.717 1.00 0.00 O ATOM 20626 H1 WAT 2737 101.655 96.226 68.586 1.00 0.00 H ATOM 20627 H2 WAT 2737 102.089 94.837 68.171 1.00 0.00 H TER 20629 WAT 2737 ATOM 20629 O WAT 2738 41.671 82.513 91.243 1.00 0.00 O ATOM 20630 H1 WAT 2738 41.778 82.384 90.301 1.00 0.00 H ATOM 20631 H2 WAT 2738 40.723 82.520 91.378 1.00 0.00 H TER 20633 WAT 2738 ATOM 20633 O WAT 2739 101.762 22.828 73.625 1.00 0.00 O ATOM 20634 H1 WAT 2739 101.195 23.562 73.863 1.00 0.00 H ATOM 20635 H2 WAT 2739 101.353 22.454 72.844 1.00 0.00 H TER 20637 WAT 2739 ATOM 20637 O WAT 2740 106.069 112.485 71.287 1.00 0.00 O ATOM 20638 H1 WAT 2740 107.003 112.417 71.087 1.00 0.00 H ATOM 20639 H2 WAT 2740 105.889 113.424 71.273 1.00 0.00 H TER 20641 WAT 2740 ATOM 20641 O WAT 2741 63.039 25.653 4.570 1.00 0.00 O ATOM 20642 H1 WAT 2741 63.839 25.686 4.045 1.00 0.00 H ATOM 20643 H2 WAT 2741 63.347 25.659 5.477 1.00 0.00 H TER 20645 WAT 2741 ATOM 20645 O WAT 2742 40.482 82.000 121.750 1.00 0.00 O ATOM 20646 H1 WAT 2742 41.009 81.710 122.495 1.00 0.00 H ATOM 20647 H2 WAT 2742 41.024 81.810 120.985 1.00 0.00 H TER 20649 WAT 2742 ATOM 20649 O WAT 2743 111.900 100.837 142.223 1.00 0.00 O ATOM 20650 H1 WAT 2743 112.786 101.195 142.278 1.00 0.00 H ATOM 20651 H2 WAT 2743 111.606 100.785 143.132 1.00 0.00 H TER 20653 WAT 2743 ATOM 20653 O WAT 2744 106.021 29.906 61.539 1.00 0.00 O ATOM 20654 H1 WAT 2744 106.963 29.855 61.376 1.00 0.00 H ATOM 20655 H2 WAT 2744 105.667 30.338 60.762 1.00 0.00 H TER 20657 WAT 2744 ATOM 20657 O WAT 2745 16.394 10.844 112.558 1.00 0.00 O ATOM 20658 H1 WAT 2745 16.797 10.042 112.226 1.00 0.00 H ATOM 20659 H2 WAT 2745 15.464 10.748 112.352 1.00 0.00 H TER 20661 WAT 2745 ATOM 20661 O WAT 2746 136.809 144.776 134.564 1.00 0.00 O ATOM 20662 H1 WAT 2746 135.973 144.968 134.988 1.00 0.00 H ATOM 20663 H2 WAT 2746 136.593 144.695 133.635 1.00 0.00 H TER 20665 WAT 2746 ATOM 20665 O WAT 2747 74.529 110.882 157.740 1.00 0.00 O ATOM 20666 H1 WAT 2747 73.891 111.199 157.101 1.00 0.00 H ATOM 20667 H2 WAT 2747 74.118 110.109 158.126 1.00 0.00 H TER 20669 WAT 2747 ATOM 20669 O WAT 2748 100.697 12.745 133.954 1.00 0.00 O ATOM 20670 H1 WAT 2748 101.131 11.920 133.735 1.00 0.00 H ATOM 20671 H2 WAT 2748 101.335 13.420 133.723 1.00 0.00 H TER 20673 WAT 2748 ATOM 20673 O WAT 2749 51.989 74.818 20.945 1.00 0.00 O ATOM 20674 H1 WAT 2749 51.144 74.425 21.164 1.00 0.00 H ATOM 20675 H2 WAT 2749 51.770 75.551 20.370 1.00 0.00 H TER 20677 WAT 2749 ATOM 20677 O WAT 2750 78.015 47.044 64.992 1.00 0.00 O ATOM 20678 H1 WAT 2750 77.227 46.932 65.523 1.00 0.00 H ATOM 20679 H2 WAT 2750 78.735 47.014 65.622 1.00 0.00 H TER 20681 WAT 2750 ATOM 20681 O WAT 2751 57.885 103.156 84.215 1.00 0.00 O ATOM 20682 H1 WAT 2751 56.977 102.871 84.316 1.00 0.00 H ATOM 20683 H2 WAT 2751 58.307 102.445 83.732 1.00 0.00 H TER 20685 WAT 2751 ATOM 20685 O WAT 2752 55.012 56.034 31.836 1.00 0.00 O ATOM 20686 H1 WAT 2752 54.690 56.147 30.941 1.00 0.00 H ATOM 20687 H2 WAT 2752 55.072 55.086 31.951 1.00 0.00 H TER 20689 WAT 2752 ATOM 20689 O WAT 2753 138.943 104.813 152.345 1.00 0.00 O ATOM 20690 H1 WAT 2753 138.120 105.296 152.267 1.00 0.00 H ATOM 20691 H2 WAT 2753 139.452 105.309 152.986 1.00 0.00 H TER 20693 WAT 2753 ATOM 20693 O WAT 2754 11.557 7.244 3.213 1.00 0.00 O ATOM 20694 H1 WAT 2754 11.441 6.752 4.025 1.00 0.00 H ATOM 20695 H2 WAT 2754 12.143 6.702 2.685 1.00 0.00 H TER 20697 WAT 2754 ATOM 20697 O WAT 2755 121.933 1.933 95.081 1.00 0.00 O ATOM 20698 H1 WAT 2755 122.572 2.642 95.151 1.00 0.00 H ATOM 20699 H2 WAT 2755 122.380 1.257 94.571 1.00 0.00 H TER 20701 WAT 2755 ATOM 20701 O WAT 2756 3.694 76.720 25.650 1.00 0.00 O ATOM 20702 H1 WAT 2756 4.112 76.254 26.374 1.00 0.00 H ATOM 20703 H2 WAT 2756 4.356 76.730 24.959 1.00 0.00 H TER 20705 WAT 2756 ATOM 20705 O WAT 2757 69.265 31.639 10.934 1.00 0.00 O ATOM 20706 H1 WAT 2757 69.607 31.812 10.057 1.00 0.00 H ATOM 20707 H2 WAT 2757 68.758 32.421 11.152 1.00 0.00 H TER 20709 WAT 2757 ATOM 20709 O WAT 2758 27.858 118.306 134.690 1.00 0.00 O ATOM 20710 H1 WAT 2758 26.985 118.677 134.818 1.00 0.00 H ATOM 20711 H2 WAT 2758 27.725 117.589 134.070 1.00 0.00 H TER 20713 WAT 2758 ATOM 20713 O WAT 2759 15.131 41.942 64.295 1.00 0.00 O ATOM 20714 H1 WAT 2759 14.890 41.582 63.441 1.00 0.00 H ATOM 20715 H2 WAT 2759 15.553 42.777 64.093 1.00 0.00 H TER 20717 WAT 2759 ATOM 20717 O WAT 2760 26.596 81.677 11.971 1.00 0.00 O ATOM 20718 H1 WAT 2760 25.900 81.378 11.385 1.00 0.00 H ATOM 20719 H2 WAT 2760 26.140 82.179 12.647 1.00 0.00 H TER 20721 WAT 2760 ATOM 20721 O WAT 2761 68.762 99.180 19.648 1.00 0.00 O ATOM 20722 H1 WAT 2761 69.394 99.803 20.006 1.00 0.00 H ATOM 20723 H2 WAT 2761 68.005 99.717 19.412 1.00 0.00 H TER 20725 WAT 2761 ATOM 20725 O WAT 2762 50.136 142.386 55.001 1.00 0.00 O ATOM 20726 H1 WAT 2762 50.880 142.115 54.462 1.00 0.00 H ATOM 20727 H2 WAT 2762 50.299 143.311 55.186 1.00 0.00 H TER 20729 WAT 2762 ATOM 20729 O WAT 2763 89.376 125.459 14.830 1.00 0.00 O ATOM 20730 H1 WAT 2763 89.294 124.505 14.806 1.00 0.00 H ATOM 20731 H2 WAT 2763 88.944 125.716 15.644 1.00 0.00 H TER 20733 WAT 2763 ATOM 20733 O WAT 2764 74.997 57.048 98.254 1.00 0.00 O ATOM 20734 H1 WAT 2764 74.575 57.175 99.104 1.00 0.00 H ATOM 20735 H2 WAT 2764 74.362 56.545 97.744 1.00 0.00 H TER 20737 WAT 2764 ATOM 20737 O WAT 2765 134.242 40.240 61.763 1.00 0.00 O ATOM 20738 H1 WAT 2765 135.163 40.409 61.561 1.00 0.00 H ATOM 20739 H2 WAT 2765 133.869 41.106 61.926 1.00 0.00 H TER 20741 WAT 2765 ATOM 20741 O WAT 2766 44.882 21.277 120.162 1.00 0.00 O ATOM 20742 H1 WAT 2766 44.332 21.614 119.455 1.00 0.00 H ATOM 20743 H2 WAT 2766 44.793 21.922 120.863 1.00 0.00 H TER 20745 WAT 2766 ATOM 20745 O WAT 2767 71.620 113.014 70.385 1.00 0.00 O ATOM 20746 H1 WAT 2767 71.738 113.246 71.306 1.00 0.00 H ATOM 20747 H2 WAT 2767 70.746 112.625 70.346 1.00 0.00 H TER 20749 WAT 2767 ATOM 20749 O WAT 2768 98.453 43.277 76.761 1.00 0.00 O ATOM 20750 H1 WAT 2768 99.335 43.034 76.480 1.00 0.00 H ATOM 20751 H2 WAT 2768 98.201 43.987 76.171 1.00 0.00 H TER 20753 WAT 2768 ATOM 20753 O WAT 2769 24.603 136.181 4.410 1.00 0.00 O ATOM 20754 H1 WAT 2769 23.774 135.970 3.979 1.00 0.00 H ATOM 20755 H2 WAT 2769 25.166 135.429 4.226 1.00 0.00 H TER 20757 WAT 2769 ATOM 20757 O WAT 2770 70.518 24.662 4.318 1.00 0.00 O ATOM 20758 H1 WAT 2770 71.422 24.973 4.366 1.00 0.00 H ATOM 20759 H2 WAT 2770 70.060 25.152 5.001 1.00 0.00 H TER 20761 WAT 2770 ATOM 20761 O WAT 2771 66.839 7.986 15.038 1.00 0.00 O ATOM 20762 H1 WAT 2771 66.824 8.088 15.989 1.00 0.00 H ATOM 20763 H2 WAT 2771 66.345 8.737 14.709 1.00 0.00 H TER 20765 WAT 2771 ATOM 20765 O WAT 2772 104.359 41.625 98.479 1.00 0.00 O ATOM 20766 H1 WAT 2772 104.464 42.038 99.336 1.00 0.00 H ATOM 20767 H2 WAT 2772 105.245 41.593 98.118 1.00 0.00 H TER 20769 WAT 2772 ATOM 20769 O WAT 2773 116.377 74.432 96.338 1.00 0.00 O ATOM 20770 H1 WAT 2773 116.449 74.964 95.545 1.00 0.00 H ATOM 20771 H2 WAT 2773 115.570 74.734 96.756 1.00 0.00 H TER 20773 WAT 2773 ATOM 20773 O WAT 2774 30.638 121.261 4.420 1.00 0.00 O ATOM 20774 H1 WAT 2774 31.297 120.571 4.493 1.00 0.00 H ATOM 20775 H2 WAT 2774 30.655 121.512 3.497 1.00 0.00 H TER 20777 WAT 2774 ATOM 20777 O WAT 2775 5.001 0.707 121.353 1.00 0.00 O ATOM 20778 H1 WAT 2775 4.740 0.879 120.448 1.00 0.00 H ATOM 20779 H2 WAT 2775 5.668 0.023 121.283 1.00 0.00 H TER 20781 WAT 2775 ATOM 20781 O WAT 2776 82.128 116.068 132.744 1.00 0.00 O ATOM 20782 H1 WAT 2776 82.553 116.903 132.548 1.00 0.00 H ATOM 20783 H2 WAT 2776 82.256 115.950 133.686 1.00 0.00 H TER 20785 WAT 2776 ATOM 20785 O WAT 2777 50.880 11.379 106.985 1.00 0.00 O ATOM 20786 H1 WAT 2777 50.747 11.611 106.066 1.00 0.00 H ATOM 20787 H2 WAT 2777 50.937 12.220 107.438 1.00 0.00 H TER 20789 WAT 2777 ATOM 20789 O WAT 2778 42.249 74.351 155.221 1.00 0.00 O ATOM 20790 H1 WAT 2778 42.689 74.910 155.862 1.00 0.00 H ATOM 20791 H2 WAT 2778 41.870 74.962 154.589 1.00 0.00 H TER 20793 WAT 2778 ATOM 20793 O WAT 2779 33.073 108.990 90.847 1.00 0.00 O ATOM 20794 H1 WAT 2779 33.517 109.142 90.013 1.00 0.00 H ATOM 20795 H2 WAT 2779 32.823 109.863 91.148 1.00 0.00 H TER 20797 WAT 2779 ATOM 20797 O WAT 2780 4.689 44.610 121.835 1.00 0.00 O ATOM 20798 H1 WAT 2780 4.547 44.984 120.965 1.00 0.00 H ATOM 20799 H2 WAT 2780 3.972 44.958 122.365 1.00 0.00 H TER 20801 WAT 2780 ATOM 20801 O WAT 2781 113.653 84.130 95.168 1.00 0.00 O ATOM 20802 H1 WAT 2781 113.848 84.972 94.757 1.00 0.00 H ATOM 20803 H2 WAT 2781 114.106 84.163 96.010 1.00 0.00 H TER 20805 WAT 2781 ATOM 20805 O WAT 2782 22.073 57.907 125.364 1.00 0.00 O ATOM 20806 H1 WAT 2782 21.719 57.289 126.004 1.00 0.00 H ATOM 20807 H2 WAT 2782 21.517 58.681 125.445 1.00 0.00 H TER 20809 WAT 2782 ATOM 20809 O WAT 2783 73.760 37.778 59.915 1.00 0.00 O ATOM 20810 H1 WAT 2783 74.390 37.235 59.442 1.00 0.00 H ATOM 20811 H2 WAT 2783 73.120 37.156 60.261 1.00 0.00 H TER 20813 WAT 2783 ATOM 20813 O WAT 2784 85.482 96.850 111.594 1.00 0.00 O ATOM 20814 H1 WAT 2784 85.670 97.068 112.507 1.00 0.00 H ATOM 20815 H2 WAT 2784 85.448 95.894 111.578 1.00 0.00 H TER 20817 WAT 2784 ATOM 20817 O WAT 2785 14.637 82.298 147.853 1.00 0.00 O ATOM 20818 H1 WAT 2785 14.292 81.562 147.346 1.00 0.00 H ATOM 20819 H2 WAT 2785 15.575 82.122 147.923 1.00 0.00 H TER 20821 WAT 2785 ATOM 20821 O WAT 2786 17.606 6.101 65.392 1.00 0.00 O ATOM 20822 H1 WAT 2786 16.978 6.494 65.999 1.00 0.00 H ATOM 20823 H2 WAT 2786 18.436 6.535 65.592 1.00 0.00 H TER 20825 WAT 2786 ATOM 20825 O WAT 2787 111.206 43.195 103.802 1.00 0.00 O ATOM 20826 H1 WAT 2787 111.086 42.854 104.688 1.00 0.00 H ATOM 20827 H2 WAT 2787 111.111 44.143 103.895 1.00 0.00 H TER 20829 WAT 2787 ATOM 20829 O WAT 2788 76.556 74.548 153.865 1.00 0.00 O ATOM 20830 H1 WAT 2788 76.198 73.846 153.322 1.00 0.00 H ATOM 20831 H2 WAT 2788 76.519 75.325 153.306 1.00 0.00 H TER 20833 WAT 2788 ATOM 20833 O WAT 2789 136.483 134.078 6.599 1.00 0.00 O ATOM 20834 H1 WAT 2789 136.612 134.742 7.276 1.00 0.00 H ATOM 20835 H2 WAT 2789 135.535 134.047 6.472 1.00 0.00 H TER 20837 WAT 2789 ATOM 20837 O WAT 2790 6.423 35.522 114.929 1.00 0.00 O ATOM 20838 H1 WAT 2790 7.309 35.598 115.283 1.00 0.00 H ATOM 20839 H2 WAT 2790 5.940 36.241 115.336 1.00 0.00 H TER 20841 WAT 2790 ATOM 20841 O WAT 2791 132.915 24.350 6.329 1.00 0.00 O ATOM 20842 H1 WAT 2791 133.436 25.150 6.270 1.00 0.00 H ATOM 20843 H2 WAT 2791 132.765 24.093 5.419 1.00 0.00 H TER 20845 WAT 2791 ATOM 20845 O WAT 2792 95.704 140.031 14.155 1.00 0.00 O ATOM 20846 H1 WAT 2792 96.182 140.478 13.458 1.00 0.00 H ATOM 20847 H2 WAT 2792 94.893 139.738 13.740 1.00 0.00 H TER 20849 WAT 2792 ATOM 20849 O WAT 2793 106.666 116.457 154.066 1.00 0.00 O ATOM 20850 H1 WAT 2793 106.634 117.359 153.749 1.00 0.00 H ATOM 20851 H2 WAT 2793 107.178 116.504 154.873 1.00 0.00 H TER 20853 WAT 2793 ATOM 20853 O WAT 2794 51.168 29.603 26.474 1.00 0.00 O ATOM 20854 H1 WAT 2794 51.873 29.321 27.058 1.00 0.00 H ATOM 20855 H2 WAT 2794 51.373 30.517 26.275 1.00 0.00 H TER 20857 WAT 2794 ATOM 20857 O WAT 2795 51.200 73.732 101.400 1.00 0.00 O ATOM 20858 H1 WAT 2795 51.592 73.912 100.546 1.00 0.00 H ATOM 20859 H2 WAT 2795 50.408 74.270 101.418 1.00 0.00 H TER 20861 WAT 2795 ATOM 20861 O WAT 2796 121.785 105.595 105.450 1.00 0.00 O ATOM 20862 H1 WAT 2796 121.476 105.753 104.558 1.00 0.00 H ATOM 20863 H2 WAT 2796 121.443 104.730 105.673 1.00 0.00 H TER 20865 WAT 2796 ATOM 20865 O WAT 2797 70.378 71.430 144.364 1.00 0.00 O ATOM 20866 H1 WAT 2797 71.287 71.438 144.064 1.00 0.00 H ATOM 20867 H2 WAT 2797 69.877 71.760 143.618 1.00 0.00 H TER 20869 WAT 2797 ATOM 20869 O WAT 2798 30.915 101.547 76.600 1.00 0.00 O ATOM 20870 H1 WAT 2798 31.533 101.792 75.911 1.00 0.00 H ATOM 20871 H2 WAT 2798 30.325 102.297 76.671 1.00 0.00 H TER 20873 WAT 2798 ATOM 20873 O WAT 2799 108.411 124.318 84.231 1.00 0.00 O ATOM 20874 H1 WAT 2799 108.494 124.562 85.152 1.00 0.00 H ATOM 20875 H2 WAT 2799 107.742 124.910 83.886 1.00 0.00 H TER 20877 WAT 2799 ATOM 20877 O WAT 2800 31.453 31.698 127.602 1.00 0.00 O ATOM 20878 H1 WAT 2800 31.992 30.907 127.615 1.00 0.00 H ATOM 20879 H2 WAT 2800 31.940 32.312 127.053 1.00 0.00 H TER 20881 WAT 2800 ATOM 20881 O WAT 2801 81.346 113.600 79.120 1.00 0.00 O ATOM 20882 H1 WAT 2801 81.595 113.673 80.042 1.00 0.00 H ATOM 20883 H2 WAT 2801 81.968 112.971 78.754 1.00 0.00 H TER 20885 WAT 2801 ATOM 20885 O WAT 2802 36.189 71.426 134.768 1.00 0.00 O ATOM 20886 H1 WAT 2802 35.313 71.664 135.069 1.00 0.00 H ATOM 20887 H2 WAT 2802 36.037 70.789 134.069 1.00 0.00 H TER 20889 WAT 2802 ATOM 20889 O WAT 2803 45.539 107.969 59.925 1.00 0.00 O ATOM 20890 H1 WAT 2803 45.977 107.205 60.300 1.00 0.00 H ATOM 20891 H2 WAT 2803 45.292 107.694 59.042 1.00 0.00 H TER 20893 WAT 2803 ATOM 20893 O WAT 2804 117.415 18.385 153.513 1.00 0.00 O ATOM 20894 H1 WAT 2804 116.726 17.721 153.487 1.00 0.00 H ATOM 20895 H2 WAT 2804 117.011 19.165 153.134 1.00 0.00 H TER 20897 WAT 2804 ATOM 20897 O WAT 2805 117.876 114.056 66.518 1.00 0.00 O ATOM 20898 H1 WAT 2805 117.026 114.391 66.235 1.00 0.00 H ATOM 20899 H2 WAT 2805 117.756 113.107 66.567 1.00 0.00 H TER 20901 WAT 2805 ATOM 20901 O WAT 2806 134.977 52.988 120.907 1.00 0.00 O ATOM 20902 H1 WAT 2806 135.163 52.960 121.845 1.00 0.00 H ATOM 20903 H2 WAT 2806 134.673 53.882 120.750 1.00 0.00 H TER 20905 WAT 2806 ATOM 20905 O WAT 2807 140.052 79.644 74.296 1.00 0.00 O ATOM 20906 H1 WAT 2807 140.508 79.904 73.495 1.00 0.00 H ATOM 20907 H2 WAT 2807 140.567 78.912 74.637 1.00 0.00 H TER 20909 WAT 2807 ATOM 20909 O WAT 2808 122.031 0.524 11.246 1.00 0.00 O ATOM 20910 H1 WAT 2808 122.175 1.242 11.862 1.00 0.00 H ATOM 20911 H2 WAT 2808 122.155 0.920 10.383 1.00 0.00 H TER 20913 WAT 2808 ATOM 20913 O WAT 2809 120.041 60.075 63.834 1.00 0.00 O ATOM 20914 H1 WAT 2809 119.574 59.247 63.726 1.00 0.00 H ATOM 20915 H2 WAT 2809 119.369 60.694 64.119 1.00 0.00 H TER 20917 WAT 2809 ATOM 20917 O WAT 2810 30.165 109.900 5.529 1.00 0.00 O ATOM 20918 H1 WAT 2810 29.727 109.691 4.703 1.00 0.00 H ATOM 20919 H2 WAT 2810 30.945 109.344 5.533 1.00 0.00 H TER 20921 WAT 2810 ATOM 20921 O WAT 2811 144.326 114.022 15.575 1.00 0.00 O ATOM 20922 H1 WAT 2811 144.733 113.164 15.699 1.00 0.00 H ATOM 20923 H2 WAT 2811 144.481 114.482 16.399 1.00 0.00 H TER 20925 WAT 2811 ATOM 20925 O WAT 2812 51.369 108.411 3.435 1.00 0.00 O ATOM 20926 H1 WAT 2812 51.419 107.491 3.696 1.00 0.00 H ATOM 20927 H2 WAT 2812 50.432 108.604 3.417 1.00 0.00 H TER 20929 WAT 2812 ATOM 20929 O WAT 2813 77.034 10.076 2.438 1.00 0.00 O ATOM 20930 H1 WAT 2813 76.639 10.723 1.854 1.00 0.00 H ATOM 20931 H2 WAT 2813 77.252 9.339 1.868 1.00 0.00 H TER 20933 WAT 2813 ATOM 20933 O WAT 2814 133.498 12.109 79.415 1.00 0.00 O ATOM 20934 H1 WAT 2814 133.141 11.594 80.138 1.00 0.00 H ATOM 20935 H2 WAT 2814 132.728 12.472 78.976 1.00 0.00 H TER 20937 WAT 2814 ATOM 20937 O WAT 2815 125.174 38.713 128.746 1.00 0.00 O ATOM 20938 H1 WAT 2815 124.627 37.974 129.012 1.00 0.00 H ATOM 20939 H2 WAT 2815 124.573 39.458 128.721 1.00 0.00 H TER 20941 WAT 2815 ATOM 20941 O WAT 2816 67.365 45.539 4.398 1.00 0.00 O ATOM 20942 H1 WAT 2816 67.155 46.464 4.265 1.00 0.00 H ATOM 20943 H2 WAT 2816 66.639 45.067 3.990 1.00 0.00 H TER 20945 WAT 2816 ATOM 20945 O WAT 2817 33.096 125.913 146.927 1.00 0.00 O ATOM 20946 H1 WAT 2817 32.320 126.474 146.933 1.00 0.00 H ATOM 20947 H2 WAT 2817 33.832 126.523 146.954 1.00 0.00 H TER 20949 WAT 2817 ATOM 20949 O WAT 2818 97.762 89.639 107.956 1.00 0.00 O ATOM 20950 H1 WAT 2818 97.250 89.884 107.185 1.00 0.00 H ATOM 20951 H2 WAT 2818 97.113 89.317 108.582 1.00 0.00 H TER 20953 WAT 2818 ATOM 20953 O WAT 2819 136.086 70.285 16.972 1.00 0.00 O ATOM 20954 H1 WAT 2819 135.858 70.200 17.898 1.00 0.00 H ATOM 20955 H2 WAT 2819 135.669 71.101 16.696 1.00 0.00 H TER 20957 WAT 2819 ATOM 20957 O WAT 2820 132.382 96.055 105.511 1.00 0.00 O ATOM 20958 H1 WAT 2820 132.943 96.206 106.272 1.00 0.00 H ATOM 20959 H2 WAT 2820 131.599 96.577 105.684 1.00 0.00 H TER 20961 WAT 2820 ATOM 20961 O WAT 2821 12.709 141.619 124.297 1.00 0.00 O ATOM 20962 H1 WAT 2821 12.593 142.164 125.075 1.00 0.00 H ATOM 20963 H2 WAT 2821 11.909 141.753 123.789 1.00 0.00 H TER 20965 WAT 2821 ATOM 20965 O WAT 2822 113.046 25.069 113.185 1.00 0.00 O ATOM 20966 H1 WAT 2822 113.190 24.425 113.878 1.00 0.00 H ATOM 20967 H2 WAT 2822 112.719 24.557 112.446 1.00 0.00 H TER 20969 WAT 2822 ATOM 20969 O WAT 2823 86.237 6.021 118.641 1.00 0.00 O ATOM 20970 H1 WAT 2823 85.507 5.404 118.606 1.00 0.00 H ATOM 20971 H2 WAT 2823 86.928 5.548 119.104 1.00 0.00 H TER 20973 WAT 2823 ATOM 20973 O WAT 2824 50.707 47.907 138.448 1.00 0.00 O ATOM 20974 H1 WAT 2824 50.731 48.852 138.600 1.00 0.00 H ATOM 20975 H2 WAT 2824 50.633 47.819 137.498 1.00 0.00 H TER 20977 WAT 2824 ATOM 20977 O WAT 2825 79.075 72.071 118.921 1.00 0.00 O ATOM 20978 H1 WAT 2825 79.154 72.802 118.308 1.00 0.00 H ATOM 20979 H2 WAT 2825 79.026 72.486 119.782 1.00 0.00 H TER 20981 WAT 2825 ATOM 20981 O WAT 2826 42.757 55.749 29.157 1.00 0.00 O ATOM 20982 H1 WAT 2826 43.550 55.234 29.305 1.00 0.00 H ATOM 20983 H2 WAT 2826 42.057 55.230 29.554 1.00 0.00 H TER 20985 WAT 2826 ATOM 20985 O WAT 2827 59.753 137.216 136.259 1.00 0.00 O ATOM 20986 H1 WAT 2827 59.706 138.170 136.196 1.00 0.00 H ATOM 20987 H2 WAT 2827 59.179 136.997 136.993 1.00 0.00 H TER 20989 WAT 2827 ATOM 20989 O WAT 2828 16.994 103.019 118.910 1.00 0.00 O ATOM 20990 H1 WAT 2828 17.618 103.709 119.135 1.00 0.00 H ATOM 20991 H2 WAT 2828 17.308 102.673 118.075 1.00 0.00 H TER 20993 WAT 2828 ATOM 20993 O WAT 2829 101.034 31.357 103.180 1.00 0.00 O ATOM 20994 H1 WAT 2829 100.778 30.665 102.570 1.00 0.00 H ATOM 20995 H2 WAT 2829 100.652 32.154 102.813 1.00 0.00 H TER 20997 WAT 2829 ATOM 20997 O WAT 2830 19.253 135.899 56.275 1.00 0.00 O ATOM 20998 H1 WAT 2830 18.491 135.946 55.697 1.00 0.00 H ATOM 20999 H2 WAT 2830 18.946 135.403 57.035 1.00 0.00 H TER 21001 WAT 2830 ATOM 21001 O WAT 2831 63.665 65.177 112.899 1.00 0.00 O ATOM 21002 H1 WAT 2831 63.915 65.989 113.340 1.00 0.00 H ATOM 21003 H2 WAT 2831 62.708 65.203 112.873 1.00 0.00 H TER 21005 WAT 2831 ATOM 21005 O WAT 2832 47.908 101.175 61.177 1.00 0.00 O ATOM 21006 H1 WAT 2832 48.278 101.099 60.297 1.00 0.00 H ATOM 21007 H2 WAT 2832 48.065 100.320 61.577 1.00 0.00 H TER 21009 WAT 2832 ATOM 21009 O WAT 2833 49.421 26.347 107.250 1.00 0.00 O ATOM 21010 H1 WAT 2833 50.180 26.794 107.623 1.00 0.00 H ATOM 21011 H2 WAT 2833 48.731 26.458 107.904 1.00 0.00 H TER 21013 WAT 2833 ATOM 21013 O WAT 2834 5.295 21.674 66.220 1.00 0.00 O ATOM 21014 H1 WAT 2834 5.368 21.764 67.171 1.00 0.00 H ATOM 21015 H2 WAT 2834 4.602 22.287 65.974 1.00 0.00 H TER 21017 WAT 2834 ATOM 21017 O WAT 2835 111.317 123.423 125.540 1.00 0.00 O ATOM 21018 H1 WAT 2835 111.826 124.176 125.841 1.00 0.00 H ATOM 21019 H2 WAT 2835 111.494 123.374 124.601 1.00 0.00 H TER 21021 WAT 2835 ATOM 21021 O WAT 2836 103.657 61.492 121.591 1.00 0.00 O ATOM 21022 H1 WAT 2836 104.112 61.022 120.892 1.00 0.00 H ATOM 21023 H2 WAT 2836 103.897 61.023 122.391 1.00 0.00 H TER 21025 WAT 2836 ATOM 21025 O WAT 2837 123.746 106.519 150.987 1.00 0.00 O ATOM 21026 H1 WAT 2837 123.384 106.412 151.867 1.00 0.00 H ATOM 21027 H2 WAT 2837 123.819 107.467 150.872 1.00 0.00 H TER 21029 WAT 2837 ATOM 21029 O WAT 2838 30.188 33.053 123.033 1.00 0.00 O ATOM 21030 H1 WAT 2838 29.446 32.508 123.293 1.00 0.00 H ATOM 21031 H2 WAT 2838 30.558 32.607 122.271 1.00 0.00 H TER 21033 WAT 2838 ATOM 21033 O WAT 2839 18.410 82.714 154.063 1.00 0.00 O ATOM 21034 H1 WAT 2839 19.361 82.697 154.176 1.00 0.00 H ATOM 21035 H2 WAT 2839 18.236 83.546 153.623 1.00 0.00 H TER 21037 WAT 2839 ATOM 21037 O WAT 2840 98.198 69.852 66.617 1.00 0.00 O ATOM 21038 H1 WAT 2840 99.141 69.914 66.770 1.00 0.00 H ATOM 21039 H2 WAT 2840 98.093 70.043 65.685 1.00 0.00 H TER 21041 WAT 2840 ATOM 21041 O WAT 2841 136.343 68.113 8.574 1.00 0.00 O ATOM 21042 H1 WAT 2841 135.802 68.710 8.057 1.00 0.00 H ATOM 21043 H2 WAT 2841 136.627 68.634 9.324 1.00 0.00 H TER 21045 WAT 2841 ATOM 21045 O WAT 2842 104.050 20.744 98.759 1.00 0.00 O ATOM 21046 H1 WAT 2842 103.245 20.328 98.451 1.00 0.00 H ATOM 21047 H2 WAT 2842 103.987 20.711 99.713 1.00 0.00 H TER 21049 WAT 2842 ATOM 21049 O WAT 2843 10.296 112.068 144.725 1.00 0.00 O ATOM 21050 H1 WAT 2843 10.842 112.853 144.766 1.00 0.00 H ATOM 21051 H2 WAT 2843 10.167 111.818 145.640 1.00 0.00 H TER 21053 WAT 2843 ATOM 21053 O WAT 2844 41.716 124.235 22.021 1.00 0.00 O ATOM 21054 H1 WAT 2844 42.223 124.018 22.803 1.00 0.00 H ATOM 21055 H2 WAT 2844 41.466 125.150 22.144 1.00 0.00 H TER 21057 WAT 2844 ATOM 21057 O WAT 2845 132.165 38.299 14.023 1.00 0.00 O ATOM 21058 H1 WAT 2845 132.735 39.017 13.751 1.00 0.00 H ATOM 21059 H2 WAT 2845 132.104 38.388 14.974 1.00 0.00 H TER 21061 WAT 2845 ATOM 21061 O WAT 2846 50.089 142.364 10.819 1.00 0.00 O ATOM 21062 H1 WAT 2846 50.171 143.150 11.360 1.00 0.00 H ATOM 21063 H2 WAT 2846 49.201 142.408 10.465 1.00 0.00 H TER 21065 WAT 2846 ATOM 21065 O WAT 2847 107.334 113.952 106.551 1.00 0.00 O ATOM 21066 H1 WAT 2847 106.699 113.241 106.460 1.00 0.00 H ATOM 21067 H2 WAT 2847 106.909 114.579 107.137 1.00 0.00 H TER 21069 WAT 2847 ATOM 21069 O WAT 2848 14.569 7.319 85.696 1.00 0.00 O ATOM 21070 H1 WAT 2848 13.744 7.191 85.228 1.00 0.00 H ATOM 21071 H2 WAT 2848 14.364 7.971 86.366 1.00 0.00 H TER 21073 WAT 2848 ATOM 21073 O WAT 2849 103.871 141.765 63.921 1.00 0.00 O ATOM 21074 H1 WAT 2849 102.953 142.029 63.991 1.00 0.00 H ATOM 21075 H2 WAT 2849 104.332 142.563 63.664 1.00 0.00 H TER 21077 WAT 2849 ATOM 21077 O WAT 2850 138.342 48.395 137.214 1.00 0.00 O ATOM 21078 H1 WAT 2850 138.030 48.098 138.069 1.00 0.00 H ATOM 21079 H2 WAT 2850 139.293 48.442 137.309 1.00 0.00 H TER 21081 WAT 2850 ATOM 21081 O WAT 2851 1.518 35.918 10.609 1.00 0.00 O ATOM 21082 H1 WAT 2851 1.491 35.702 11.541 1.00 0.00 H ATOM 21083 H2 WAT 2851 2.429 36.164 10.447 1.00 0.00 H TER 21085 WAT 2851 ATOM 21085 O WAT 2852 81.526 22.471 124.903 1.00 0.00 O ATOM 21086 H1 WAT 2852 81.930 23.329 124.773 1.00 0.00 H ATOM 21087 H2 WAT 2852 81.223 22.215 124.031 1.00 0.00 H TER 21089 WAT 2852 ATOM 21089 O WAT 2853 140.780 31.121 123.590 1.00 0.00 O ATOM 21090 H1 WAT 2853 139.965 30.619 123.596 1.00 0.00 H ATOM 21091 H2 WAT 2853 141.469 30.458 123.554 1.00 0.00 H TER 21093 WAT 2853 ATOM 21093 O WAT 2854 53.087 19.217 115.476 1.00 0.00 O ATOM 21094 H1 WAT 2854 52.331 18.964 114.947 1.00 0.00 H ATOM 21095 H2 WAT 2854 52.751 19.256 116.371 1.00 0.00 H TER 21097 WAT 2854 ATOM 21097 O WAT 2855 138.374 44.858 121.390 1.00 0.00 O ATOM 21098 H1 WAT 2855 138.367 44.604 120.467 1.00 0.00 H ATOM 21099 H2 WAT 2855 138.575 44.049 121.860 1.00 0.00 H TER 21101 WAT 2855 ATOM 21101 O WAT 2856 104.577 103.224 96.671 1.00 0.00 O ATOM 21102 H1 WAT 2856 104.452 102.785 95.829 1.00 0.00 H ATOM 21103 H2 WAT 2856 105.519 103.171 96.831 1.00 0.00 H TER 21105 WAT 2856 ATOM 21105 O WAT 2857 63.886 25.404 100.923 1.00 0.00 O ATOM 21106 H1 WAT 2857 63.133 25.095 101.428 1.00 0.00 H ATOM 21107 H2 WAT 2857 64.646 25.128 101.435 1.00 0.00 H TER 21109 WAT 2857 ATOM 21109 O WAT 2858 45.410 16.723 134.891 1.00 0.00 O ATOM 21110 H1 WAT 2858 46.023 17.065 134.240 1.00 0.00 H ATOM 21111 H2 WAT 2858 44.559 16.747 134.453 1.00 0.00 H TER 21113 WAT 2858 ATOM 21113 O WAT 2859 63.289 89.365 66.087 1.00 0.00 O ATOM 21114 H1 WAT 2859 64.115 89.052 65.717 1.00 0.00 H ATOM 21115 H2 WAT 2859 63.509 90.207 66.484 1.00 0.00 H TER 21117 WAT 2859 ATOM 21117 O WAT 2860 83.469 4.791 76.748 1.00 0.00 O ATOM 21118 H1 WAT 2860 83.144 4.194 77.421 1.00 0.00 H ATOM 21119 H2 WAT 2860 82.773 5.441 76.648 1.00 0.00 H TER 21121 WAT 2860 ATOM 21121 O WAT 2861 31.002 19.507 99.464 1.00 0.00 O ATOM 21122 H1 WAT 2861 31.766 19.582 98.893 1.00 0.00 H ATOM 21123 H2 WAT 2861 31.065 18.627 99.836 1.00 0.00 H TER 21125 WAT 2861 ATOM 21125 O WAT 2862 83.888 132.030 61.114 1.00 0.00 O ATOM 21126 H1 WAT 2862 84.633 132.540 60.796 1.00 0.00 H ATOM 21127 H2 WAT 2862 83.296 131.976 60.364 1.00 0.00 H TER 21129 WAT 2862 ATOM 21129 O WAT 2863 145.289 98.878 127.196 1.00 0.00 O ATOM 21130 H1 WAT 2863 145.159 98.982 126.253 1.00 0.00 H ATOM 21131 H2 WAT 2863 145.356 97.932 127.327 1.00 0.00 H TER 21133 WAT 2863 ATOM 21133 O WAT 2864 69.752 84.441 65.780 1.00 0.00 O ATOM 21134 H1 WAT 2864 68.958 84.838 66.138 1.00 0.00 H ATOM 21135 H2 WAT 2864 70.458 85.023 66.059 1.00 0.00 H TER 21137 WAT 2864 ATOM 21137 O WAT 2865 78.447 44.386 65.354 1.00 0.00 O ATOM 21138 H1 WAT 2865 77.668 44.005 65.761 1.00 0.00 H ATOM 21139 H2 WAT 2865 78.190 45.283 65.140 1.00 0.00 H TER 21141 WAT 2865 ATOM 21141 O WAT 2866 22.002 125.842 19.851 1.00 0.00 O ATOM 21142 H1 WAT 2866 22.490 126.512 20.330 1.00 0.00 H ATOM 21143 H2 WAT 2866 22.283 125.946 18.942 1.00 0.00 H TER 21145 WAT 2866 ATOM 21145 O WAT 2867 90.913 141.908 77.812 1.00 0.00 O ATOM 21146 H1 WAT 2867 89.989 141.665 77.758 1.00 0.00 H ATOM 21147 H2 WAT 2867 91.173 142.062 76.904 1.00 0.00 H TER 21149 WAT 2867 ATOM 21149 O WAT 2868 62.872 128.345 104.599 1.00 0.00 O ATOM 21150 H1 WAT 2868 62.694 128.565 103.685 1.00 0.00 H ATOM 21151 H2 WAT 2868 63.649 128.858 104.822 1.00 0.00 H TER 21153 WAT 2868 ATOM 21153 O WAT 2869 36.474 134.242 79.595 1.00 0.00 O ATOM 21154 H1 WAT 2869 36.206 133.656 78.888 1.00 0.00 H ATOM 21155 H2 WAT 2869 36.895 134.978 79.150 1.00 0.00 H TER 21157 WAT 2869 ATOM 21157 O WAT 2870 62.681 54.673 5.445 1.00 0.00 O ATOM 21158 H1 WAT 2870 63.132 55.513 5.523 1.00 0.00 H ATOM 21159 H2 WAT 2870 61.967 54.840 4.830 1.00 0.00 H TER 21161 WAT 2870 ATOM 21161 O WAT 2871 50.294 62.084 95.563 1.00 0.00 O ATOM 21162 H1 WAT 2871 50.695 62.249 94.710 1.00 0.00 H ATOM 21163 H2 WAT 2871 49.440 62.513 95.513 1.00 0.00 H TER 21165 WAT 2871 ATOM 21165 O WAT 2872 15.361 102.907 107.002 1.00 0.00 O ATOM 21166 H1 WAT 2872 14.675 103.318 107.528 1.00 0.00 H ATOM 21167 H2 WAT 2872 15.971 103.618 106.804 1.00 0.00 H TER 21169 WAT 2872 ATOM 21169 O WAT 2873 37.670 129.659 93.137 1.00 0.00 O ATOM 21170 H1 WAT 2873 38.367 129.085 92.820 1.00 0.00 H ATOM 21171 H2 WAT 2873 38.042 130.081 93.912 1.00 0.00 H TER 21173 WAT 2873 ATOM 21173 O WAT 2874 71.132 59.536 120.097 1.00 0.00 O ATOM 21174 H1 WAT 2874 71.727 58.813 120.298 1.00 0.00 H ATOM 21175 H2 WAT 2874 71.388 60.232 120.701 1.00 0.00 H TER 21177 WAT 2874 ATOM 21177 O WAT 2875 110.648 20.773 142.642 1.00 0.00 O ATOM 21178 H1 WAT 2875 110.889 21.538 142.121 1.00 0.00 H ATOM 21179 H2 WAT 2875 111.192 20.066 142.295 1.00 0.00 H TER 21181 WAT 2875 ATOM 21181 O WAT 2876 66.408 62.465 11.335 1.00 0.00 O ATOM 21182 H1 WAT 2876 66.789 62.254 10.482 1.00 0.00 H ATOM 21183 H2 WAT 2876 66.535 61.673 11.857 1.00 0.00 H TER 21185 WAT 2876 ATOM 21185 O WAT 2877 18.311 44.772 90.923 1.00 0.00 O ATOM 21186 H1 WAT 2877 17.983 43.885 91.070 1.00 0.00 H ATOM 21187 H2 WAT 2877 19.261 44.694 91.011 1.00 0.00 H TER 21189 WAT 2877 ATOM 21189 O WAT 2878 32.261 123.457 4.753 1.00 0.00 O ATOM 21190 H1 WAT 2878 31.623 122.745 4.709 1.00 0.00 H ATOM 21191 H2 WAT 2878 32.395 123.715 3.841 1.00 0.00 H TER 21193 WAT 2878 ATOM 21193 O WAT 2879 42.885 91.829 115.475 1.00 0.00 O ATOM 21194 H1 WAT 2879 43.656 91.339 115.188 1.00 0.00 H ATOM 21195 H2 WAT 2879 43.111 92.745 115.314 1.00 0.00 H TER 21197 WAT 2879 ATOM 21197 O WAT 2880 41.525 72.305 129.150 1.00 0.00 O ATOM 21198 H1 WAT 2880 40.802 72.913 129.306 1.00 0.00 H ATOM 21199 H2 WAT 2880 41.117 71.439 129.166 1.00 0.00 H TER 21201 WAT 2880 ATOM 21201 O WAT 2881 91.076 103.509 72.796 1.00 0.00 O ATOM 21202 H1 WAT 2881 91.038 104.278 73.366 1.00 0.00 H ATOM 21203 H2 WAT 2881 90.689 102.806 73.318 1.00 0.00 H TER 21205 WAT 2881 ATOM 21205 O WAT 2882 119.363 144.651 19.358 1.00 0.00 O ATOM 21206 H1 WAT 2882 120.157 144.994 18.948 1.00 0.00 H ATOM 21207 H2 WAT 2882 119.524 143.711 19.442 1.00 0.00 H TER 21209 WAT 2882 ATOM 21209 O WAT 2883 116.151 86.243 135.444 1.00 0.00 O ATOM 21210 H1 WAT 2883 116.961 86.150 135.944 1.00 0.00 H ATOM 21211 H2 WAT 2883 116.428 86.611 134.605 1.00 0.00 H TER 21213 WAT 2883 ATOM 21213 O WAT 2884 127.615 23.143 91.046 1.00 0.00 O ATOM 21214 H1 WAT 2884 128.182 23.356 90.306 1.00 0.00 H ATOM 21215 H2 WAT 2884 127.541 23.962 91.535 1.00 0.00 H TER 21217 WAT 2884 ATOM 21217 O WAT 2885 41.262 130.930 2.318 1.00 0.00 O ATOM 21218 H1 WAT 2885 41.407 131.267 1.434 1.00 0.00 H ATOM 21219 H2 WAT 2885 41.528 130.012 2.272 1.00 0.00 H TER 21221 WAT 2885 ATOM 21221 O WAT 2886 141.574 124.434 141.530 1.00 0.00 O ATOM 21222 H1 WAT 2886 140.682 124.403 141.185 1.00 0.00 H ATOM 21223 H2 WAT 2886 141.956 123.592 141.283 1.00 0.00 H TER 21225 WAT 2886 ATOM 21225 O WAT 2887 122.860 92.610 151.018 1.00 0.00 O ATOM 21226 H1 WAT 2887 122.620 92.206 150.184 1.00 0.00 H ATOM 21227 H2 WAT 2887 123.687 92.191 151.258 1.00 0.00 H TER 21229 WAT 2887 ATOM 21229 O WAT 2888 63.759 74.480 3.595 1.00 0.00 O ATOM 21230 H1 WAT 2888 63.410 75.283 3.983 1.00 0.00 H ATOM 21231 H2 WAT 2888 64.227 74.051 4.311 1.00 0.00 H TER 21233 WAT 2888 ATOM 21233 O WAT 2889 20.786 51.875 11.239 1.00 0.00 O ATOM 21234 H1 WAT 2889 20.607 50.983 11.534 1.00 0.00 H ATOM 21235 H2 WAT 2889 20.608 51.858 10.299 1.00 0.00 H TER 21237 WAT 2889 ATOM 21237 O WAT 2890 26.046 29.456 5.252 1.00 0.00 O ATOM 21238 H1 WAT 2890 26.452 30.320 5.184 1.00 0.00 H ATOM 21239 H2 WAT 2890 25.273 29.510 4.690 1.00 0.00 H TER 21241 WAT 2890 ATOM 21241 O WAT 2891 98.705 143.961 96.059 1.00 0.00 O ATOM 21242 H1 WAT 2891 98.924 144.741 96.570 1.00 0.00 H ATOM 21243 H2 WAT 2891 97.764 143.845 96.190 1.00 0.00 H TER 21245 WAT 2891 ATOM 21245 O WAT 2892 51.581 78.411 139.739 1.00 0.00 O ATOM 21246 H1 WAT 2892 52.075 79.229 139.785 1.00 0.00 H ATOM 21247 H2 WAT 2892 52.046 77.816 140.327 1.00 0.00 H TER 21249 WAT 2892 ATOM 21249 O WAT 2893 109.199 14.229 152.656 1.00 0.00 O ATOM 21250 H1 WAT 2893 110.087 14.189 153.010 1.00 0.00 H ATOM 21251 H2 WAT 2893 108.817 15.011 153.052 1.00 0.00 H TER 21253 WAT 2893 ATOM 21253 O WAT 2894 125.380 77.953 88.007 1.00 0.00 O ATOM 21254 H1 WAT 2894 124.485 78.092 87.699 1.00 0.00 H ATOM 21255 H2 WAT 2894 125.712 77.238 87.465 1.00 0.00 H TER 21257 WAT 2894 ATOM 21257 O WAT 2895 4.826 9.392 126.158 1.00 0.00 O ATOM 21258 H1 WAT 2895 5.009 9.318 125.221 1.00 0.00 H ATOM 21259 H2 WAT 2895 4.657 8.493 126.441 1.00 0.00 H TER 21261 WAT 2895 ATOM 21261 O WAT 2896 144.709 44.449 76.443 1.00 0.00 O ATOM 21262 H1 WAT 2896 144.180 44.665 77.210 1.00 0.00 H ATOM 21263 H2 WAT 2896 145.613 44.481 76.758 1.00 0.00 H TER 21265 WAT 2896 ATOM 21265 O WAT 2897 62.597 96.764 8.297 1.00 0.00 O ATOM 21266 H1 WAT 2897 61.954 96.374 8.889 1.00 0.00 H ATOM 21267 H2 WAT 2897 62.150 97.524 7.925 1.00 0.00 H TER 21269 WAT 2897 ATOM 21269 O WAT 2898 134.109 7.806 120.821 1.00 0.00 O ATOM 21270 H1 WAT 2898 133.949 8.741 120.695 1.00 0.00 H ATOM 21271 H2 WAT 2898 133.259 7.450 121.079 1.00 0.00 H TER 21273 WAT 2898 ATOM 21273 O WAT 2899 28.581 144.013 144.390 1.00 0.00 O ATOM 21274 H1 WAT 2899 27.789 144.547 144.460 1.00 0.00 H ATOM 21275 H2 WAT 2899 28.782 143.763 145.291 1.00 0.00 H TER 21277 WAT 2899 ATOM 21277 O WAT 2900 103.611 121.812 120.923 1.00 0.00 O ATOM 21278 H1 WAT 2900 103.727 122.475 120.241 1.00 0.00 H ATOM 21279 H2 WAT 2900 104.500 121.519 121.125 1.00 0.00 H TER 21281 WAT 2900 ATOM 21281 O WAT 2901 70.000 89.640 113.100 1.00 0.00 O ATOM 21282 H1 WAT 2901 69.743 89.520 112.186 1.00 0.00 H ATOM 21283 H2 WAT 2901 70.848 90.081 113.055 1.00 0.00 H TER 21285 WAT 2901 ATOM 21285 O WAT 2902 55.831 111.301 12.700 1.00 0.00 O ATOM 21286 H1 WAT 2902 54.905 111.230 12.933 1.00 0.00 H ATOM 21287 H2 WAT 2902 56.271 111.504 13.525 1.00 0.00 H TER 21289 WAT 2902 ATOM 21289 O WAT 2903 29.503 98.387 124.807 1.00 0.00 O ATOM 21290 H1 WAT 2903 28.786 99.020 124.821 1.00 0.00 H ATOM 21291 H2 WAT 2903 29.092 97.555 125.040 1.00 0.00 H TER 21293 WAT 2903 ATOM 21293 O WAT 2904 125.337 13.886 158.063 1.00 0.00 O ATOM 21294 H1 WAT 2904 124.839 13.786 158.874 1.00 0.00 H ATOM 21295 H2 WAT 2904 125.236 14.809 157.831 1.00 0.00 H TER 21297 WAT 2904 ATOM 21297 O WAT 2905 131.890 127.633 21.523 1.00 0.00 O ATOM 21298 H1 WAT 2905 132.643 127.047 21.590 1.00 0.00 H ATOM 21299 H2 WAT 2905 131.442 127.545 22.364 1.00 0.00 H TER 21301 WAT 2905 ATOM 21301 O WAT 2906 92.073 84.651 136.999 1.00 0.00 O ATOM 21302 H1 WAT 2906 91.499 84.451 137.740 1.00 0.00 H ATOM 21303 H2 WAT 2906 91.733 85.474 136.648 1.00 0.00 H TER 21305 WAT 2906 ATOM 21305 O WAT 2907 57.236 13.597 93.023 1.00 0.00 O ATOM 21306 H1 WAT 2907 57.858 13.409 92.320 1.00 0.00 H ATOM 21307 H2 WAT 2907 56.405 13.239 92.710 1.00 0.00 H TER 21309 WAT 2907 ATOM 21309 O WAT 2908 96.371 9.144 66.070 1.00 0.00 O ATOM 21310 H1 WAT 2908 95.905 9.316 65.252 1.00 0.00 H ATOM 21311 H2 WAT 2908 97.260 8.918 65.796 1.00 0.00 H TER 21313 WAT 2908 ATOM 21313 O WAT 2909 90.384 97.590 93.896 1.00 0.00 O ATOM 21314 H1 WAT 2909 90.727 96.718 94.094 1.00 0.00 H ATOM 21315 H2 WAT 2909 90.190 97.971 94.753 1.00 0.00 H TER 21317 WAT 2909 ATOM 21317 O WAT 2910 63.811 87.708 73.786 1.00 0.00 O ATOM 21318 H1 WAT 2910 64.275 87.985 72.996 1.00 0.00 H ATOM 21319 H2 WAT 2910 64.498 87.376 74.364 1.00 0.00 H TER 21321 WAT 2910 ATOM 21321 O WAT 2911 19.603 52.386 144.243 1.00 0.00 O ATOM 21322 H1 WAT 2911 19.083 51.632 143.966 1.00 0.00 H ATOM 21323 H2 WAT 2911 19.826 52.201 145.155 1.00 0.00 H TER 21325 WAT 2911 ATOM 21325 O WAT 2912 5.155 102.834 116.316 1.00 0.00 O ATOM 21326 H1 WAT 2912 6.014 102.426 116.207 1.00 0.00 H ATOM 21327 H2 WAT 2912 5.028 102.874 117.264 1.00 0.00 H TER 21329 WAT 2912 ATOM 21329 O WAT 2913 29.686 17.862 114.009 1.00 0.00 O ATOM 21330 H1 WAT 2913 30.459 18.247 113.595 1.00 0.00 H ATOM 21331 H2 WAT 2913 29.603 18.328 114.841 1.00 0.00 H TER 21333 WAT 2913 ATOM 21333 O WAT 2914 25.039 98.777 120.873 1.00 0.00 O ATOM 21334 H1 WAT 2914 24.787 98.897 121.789 1.00 0.00 H ATOM 21335 H2 WAT 2914 25.289 97.855 120.812 1.00 0.00 H TER 21337 WAT 2914 ATOM 21337 O WAT 2915 124.165 81.194 109.963 1.00 0.00 O ATOM 21338 H1 WAT 2915 124.987 81.655 110.130 1.00 0.00 H ATOM 21339 H2 WAT 2915 123.485 81.817 110.218 1.00 0.00 H TER 21341 WAT 2915 ATOM 21341 O WAT 2916 100.248 47.332 60.528 1.00 0.00 O ATOM 21342 H1 WAT 2916 100.695 47.485 59.696 1.00 0.00 H ATOM 21343 H2 WAT 2916 99.320 47.289 60.298 1.00 0.00 H TER 21345 WAT 2916 ATOM 21345 O WAT 2917 30.800 77.181 11.484 1.00 0.00 O ATOM 21346 H1 WAT 2917 30.663 76.243 11.616 1.00 0.00 H ATOM 21347 H2 WAT 2917 31.479 77.232 10.812 1.00 0.00 H TER 21349 WAT 2917 ATOM 21349 O WAT 2918 107.591 126.403 135.930 1.00 0.00 O ATOM 21350 H1 WAT 2918 107.000 126.846 136.539 1.00 0.00 H ATOM 21351 H2 WAT 2918 107.099 125.639 135.631 1.00 0.00 H TER 21353 WAT 2918 ATOM 21353 O WAT 2919 89.907 38.474 151.900 1.00 0.00 O ATOM 21354 H1 WAT 2919 90.021 39.328 152.318 1.00 0.00 H ATOM 21355 H2 WAT 2919 89.789 37.865 152.629 1.00 0.00 H TER 21357 WAT 2919 ATOM 21357 O WAT 2920 36.168 88.640 131.918 1.00 0.00 O ATOM 21358 H1 WAT 2920 35.714 87.813 131.754 1.00 0.00 H ATOM 21359 H2 WAT 2920 36.024 89.154 131.123 1.00 0.00 H TER 21361 WAT 2920 ATOM 21361 O WAT 2921 109.488 87.163 125.191 1.00 0.00 O ATOM 21362 H1 WAT 2921 109.445 88.119 125.181 1.00 0.00 H ATOM 21363 H2 WAT 2921 108.603 86.881 124.957 1.00 0.00 H TER 21365 WAT 2921 ATOM 21365 O WAT 2922 26.266 57.181 155.527 1.00 0.00 O ATOM 21366 H1 WAT 2922 26.504 58.107 155.482 1.00 0.00 H ATOM 21367 H2 WAT 2922 25.336 57.184 155.756 1.00 0.00 H TER 21369 WAT 2922 ATOM 21369 O WAT 2923 54.421 105.917 83.328 1.00 0.00 O ATOM 21370 H1 WAT 2923 55.084 105.664 83.969 1.00 0.00 H ATOM 21371 H2 WAT 2923 53.819 106.480 83.814 1.00 0.00 H TER 21373 WAT 2923 ATOM 21373 O WAT 2924 31.457 5.127 121.904 1.00 0.00 O ATOM 21374 H1 WAT 2924 30.943 5.835 122.291 1.00 0.00 H ATOM 21375 H2 WAT 2924 31.767 5.483 121.071 1.00 0.00 H TER 21377 WAT 2924 ATOM 21377 O WAT 2925 78.665 59.203 129.532 1.00 0.00 O ATOM 21378 H1 WAT 2925 78.073 58.452 129.477 1.00 0.00 H ATOM 21379 H2 WAT 2925 78.087 59.965 129.503 1.00 0.00 H TER 21381 WAT 2925 ATOM 21381 O WAT 2926 135.772 1.470 147.744 1.00 0.00 O ATOM 21382 H1 WAT 2926 135.051 2.096 147.820 1.00 0.00 H ATOM 21383 H2 WAT 2926 136.493 1.876 148.226 1.00 0.00 H TER 21385 WAT 2926 ATOM 21385 O WAT 2927 91.318 59.629 79.660 1.00 0.00 O ATOM 21386 H1 WAT 2927 90.783 60.171 79.080 1.00 0.00 H ATOM 21387 H2 WAT 2927 92.021 59.300 79.100 1.00 0.00 H TER 21389 WAT 2927 ATOM 21389 O WAT 2928 6.807 36.357 96.527 1.00 0.00 O ATOM 21390 H1 WAT 2928 7.744 36.450 96.702 1.00 0.00 H ATOM 21391 H2 WAT 2928 6.446 37.230 96.684 1.00 0.00 H TER 21393 WAT 2928 ATOM 21393 O WAT 2929 131.974 98.675 152.766 1.00 0.00 O ATOM 21394 H1 WAT 2929 131.918 98.022 153.464 1.00 0.00 H ATOM 21395 H2 WAT 2929 131.989 98.160 151.959 1.00 0.00 H TER 21397 WAT 2929 ATOM 21397 O WAT 2930 71.031 84.162 132.048 1.00 0.00 O ATOM 21398 H1 WAT 2930 70.514 84.835 131.604 1.00 0.00 H ATOM 21399 H2 WAT 2930 70.564 84.004 132.868 1.00 0.00 H TER 21401 WAT 2930 ATOM 21401 O WAT 2931 58.674 74.785 71.043 1.00 0.00 O ATOM 21402 H1 WAT 2931 58.595 74.319 70.210 1.00 0.00 H ATOM 21403 H2 WAT 2931 59.280 74.254 71.558 1.00 0.00 H TER 21405 WAT 2931 ATOM 21405 O WAT 2932 20.109 113.406 118.296 1.00 0.00 O ATOM 21406 H1 WAT 2932 20.026 113.770 119.178 1.00 0.00 H ATOM 21407 H2 WAT 2932 20.243 112.469 118.435 1.00 0.00 H TER 21409 WAT 2932 ATOM 21409 O WAT 2933 113.590 98.653 131.598 1.00 0.00 O ATOM 21410 H1 WAT 2933 113.322 99.518 131.907 1.00 0.00 H ATOM 21411 H2 WAT 2933 112.804 98.114 131.685 1.00 0.00 H TER 21413 WAT 2933 ATOM 21413 O WAT 2934 11.853 18.434 100.175 1.00 0.00 O ATOM 21414 H1 WAT 2934 11.552 19.145 100.740 1.00 0.00 H ATOM 21415 H2 WAT 2934 12.552 18.825 99.650 1.00 0.00 H TER 21417 WAT 2934 ATOM 21417 O WAT 2935 51.507 92.406 17.324 1.00 0.00 O ATOM 21418 H1 WAT 2935 51.401 91.532 17.698 1.00 0.00 H ATOM 21419 H2 WAT 2935 51.606 92.981 18.083 1.00 0.00 H TER 21421 WAT 2935 ATOM 21421 O WAT 2936 124.911 37.767 18.304 1.00 0.00 O ATOM 21422 H1 WAT 2936 124.700 38.190 17.472 1.00 0.00 H ATOM 21423 H2 WAT 2936 124.652 38.404 18.970 1.00 0.00 H TER 21425 WAT 2936 ATOM 21425 O WAT 2937 89.520 26.901 7.102 1.00 0.00 O ATOM 21426 H1 WAT 2937 89.281 25.977 7.032 1.00 0.00 H ATOM 21427 H2 WAT 2937 89.110 27.193 7.916 1.00 0.00 H TER 21429 WAT 2937 ATOM 21429 O WAT 2938 143.284 53.588 128.947 1.00 0.00 O ATOM 21430 H1 WAT 2938 143.564 52.818 128.451 1.00 0.00 H ATOM 21431 H2 WAT 2938 143.051 53.245 129.810 1.00 0.00 H TER 21433 WAT 2938 ATOM 21433 O WAT 2939 134.474 129.971 87.686 1.00 0.00 O ATOM 21434 H1 WAT 2939 135.318 129.588 87.447 1.00 0.00 H ATOM 21435 H2 WAT 2939 134.700 130.764 88.173 1.00 0.00 H TER 21437 WAT 2939 ATOM 21437 O WAT 2940 48.772 7.394 62.529 1.00 0.00 O ATOM 21438 H1 WAT 2940 49.197 7.006 63.294 1.00 0.00 H ATOM 21439 H2 WAT 2940 48.558 6.648 61.969 1.00 0.00 H TER 21441 WAT 2940 ATOM 21441 O WAT 2941 138.778 18.314 69.103 1.00 0.00 O ATOM 21442 H1 WAT 2941 138.769 17.902 68.239 1.00 0.00 H ATOM 21443 H2 WAT 2941 138.948 17.594 69.710 1.00 0.00 H TER 21445 WAT 2941 ATOM 21445 O WAT 2942 134.557 123.001 24.387 1.00 0.00 O ATOM 21446 H1 WAT 2942 135.494 123.023 24.192 1.00 0.00 H ATOM 21447 H2 WAT 2942 134.170 123.629 23.776 1.00 0.00 H TER 21449 WAT 2942 ATOM 21449 O WAT 2943 56.837 105.518 101.331 1.00 0.00 O ATOM 21450 H1 WAT 2943 55.966 105.887 101.479 1.00 0.00 H ATOM 21451 H2 WAT 2943 57.118 105.895 100.497 1.00 0.00 H TER 21453 WAT 2943 ATOM 21453 O WAT 2944 29.947 130.650 70.588 1.00 0.00 O ATOM 21454 H1 WAT 2944 30.712 130.190 70.241 1.00 0.00 H ATOM 21455 H2 WAT 2944 29.377 129.953 70.914 1.00 0.00 H TER 21457 WAT 2944 ATOM 21457 O WAT 2945 0.323 116.225 112.183 1.00 0.00 O ATOM 21458 H1 WAT 2945 0.629 116.743 111.438 1.00 0.00 H ATOM 21459 H2 WAT 2945 0.982 115.538 112.285 1.00 0.00 H TER 21461 WAT 2945 ATOM 21461 O WAT 2946 113.942 33.190 21.198 1.00 0.00 O ATOM 21462 H1 WAT 2946 114.320 33.142 22.076 1.00 0.00 H ATOM 21463 H2 WAT 2946 114.531 33.770 20.716 1.00 0.00 H TER 21465 WAT 2946 ATOM 21465 O WAT 2947 41.196 97.536 91.026 1.00 0.00 O ATOM 21466 H1 WAT 2947 40.485 97.659 91.654 1.00 0.00 H ATOM 21467 H2 WAT 2947 41.630 98.389 90.985 1.00 0.00 H TER 21469 WAT 2947 ATOM 21469 O WAT 2948 31.983 17.931 141.315 1.00 0.00 O ATOM 21470 H1 WAT 2948 32.774 17.458 141.053 1.00 0.00 H ATOM 21471 H2 WAT 2948 31.486 18.032 140.503 1.00 0.00 H TER 21473 WAT 2948 ATOM 21473 O WAT 2949 7.653 47.917 148.086 1.00 0.00 O ATOM 21474 H1 WAT 2949 7.663 47.311 147.345 1.00 0.00 H ATOM 21475 H2 WAT 2949 6.757 47.873 148.420 1.00 0.00 H TER 21477 WAT 2949 ATOM 21477 O WAT 2950 101.136 33.155 149.008 1.00 0.00 O ATOM 21478 H1 WAT 2950 101.539 34.006 148.837 1.00 0.00 H ATOM 21479 H2 WAT 2950 101.775 32.519 148.687 1.00 0.00 H TER 21481 WAT 2950 ATOM 21481 O WAT 2951 85.803 125.941 122.216 1.00 0.00 O ATOM 21482 H1 WAT 2951 86.760 125.918 122.226 1.00 0.00 H ATOM 21483 H2 WAT 2951 85.588 126.834 121.948 1.00 0.00 H TER 21485 WAT 2951 ATOM 21485 O WAT 2952 100.804 94.952 19.442 1.00 0.00 O ATOM 21486 H1 WAT 2952 101.129 94.754 18.564 1.00 0.00 H ATOM 21487 H2 WAT 2952 101.400 94.487 20.029 1.00 0.00 H TER 21489 WAT 2952 ATOM 21489 O WAT 2953 105.903 116.240 146.411 1.00 0.00 O ATOM 21490 H1 WAT 2953 105.922 116.602 145.525 1.00 0.00 H ATOM 21491 H2 WAT 2953 106.767 115.843 146.526 1.00 0.00 H TER 21493 WAT 2953 ATOM 21493 O WAT 2954 69.034 120.431 76.956 1.00 0.00 O ATOM 21494 H1 WAT 2954 69.911 120.047 76.987 1.00 0.00 H ATOM 21495 H2 WAT 2954 69.091 121.102 76.275 1.00 0.00 H TER 21497 WAT 2954 ATOM 21497 O WAT 2955 139.100 49.889 55.035 1.00 0.00 O ATOM 21498 H1 WAT 2955 138.587 49.123 55.294 1.00 0.00 H ATOM 21499 H2 WAT 2955 139.196 50.396 55.842 1.00 0.00 H TER 21501 WAT 2955 ATOM 21501 O WAT 2956 10.960 84.188 123.507 1.00 0.00 O ATOM 21502 H1 WAT 2956 11.097 84.669 122.691 1.00 0.00 H ATOM 21503 H2 WAT 2956 10.077 83.826 123.426 1.00 0.00 H TER 21505 WAT 2956 ATOM 21505 O WAT 2957 85.522 88.231 14.558 1.00 0.00 O ATOM 21506 H1 WAT 2957 86.209 87.585 14.725 1.00 0.00 H ATOM 21507 H2 WAT 2957 85.731 88.959 15.145 1.00 0.00 H TER 21509 WAT 2957 ATOM 21509 O WAT 2958 133.679 58.013 8.869 1.00 0.00 O ATOM 21510 H1 WAT 2958 134.317 58.009 9.583 1.00 0.00 H ATOM 21511 H2 WAT 2958 134.189 57.786 8.092 1.00 0.00 H TER 21513 WAT 2958 ATOM 21513 O WAT 2959 92.258 60.774 58.868 1.00 0.00 O ATOM 21514 H1 WAT 2959 91.422 60.750 58.404 1.00 0.00 H ATOM 21515 H2 WAT 2959 92.110 61.375 59.598 1.00 0.00 H TER 21517 WAT 2959 ATOM 21517 O WAT 2960 91.371 134.537 65.144 1.00 0.00 O ATOM 21518 H1 WAT 2960 92.321 134.642 65.199 1.00 0.00 H ATOM 21519 H2 WAT 2960 91.233 134.025 64.347 1.00 0.00 H TER 21521 WAT 2960 ATOM 21521 O WAT 2961 63.419 46.377 4.516 1.00 0.00 O ATOM 21522 H1 WAT 2961 64.042 46.073 3.855 1.00 0.00 H ATOM 21523 H2 WAT 2961 63.526 45.766 5.245 1.00 0.00 H TER 21525 WAT 2961 ATOM 21525 O WAT 2962 105.947 15.354 59.942 1.00 0.00 O ATOM 21526 H1 WAT 2962 106.694 15.914 60.156 1.00 0.00 H ATOM 21527 H2 WAT 2962 106.333 14.493 59.779 1.00 0.00 H TER 21529 WAT 2962 ATOM 21529 O WAT 2963 109.541 71.530 146.697 1.00 0.00 O ATOM 21530 H1 WAT 2963 108.712 71.063 146.592 1.00 0.00 H ATOM 21531 H2 WAT 2963 110.212 70.859 146.573 1.00 0.00 H TER 21533 WAT 2963 ATOM 21533 O WAT 2964 55.046 47.461 6.415 1.00 0.00 O ATOM 21534 H1 WAT 2964 54.332 46.978 6.831 1.00 0.00 H ATOM 21535 H2 WAT 2964 55.241 48.172 7.025 1.00 0.00 H TER 21537 WAT 2964 ATOM 21537 O WAT 2965 126.216 96.480 14.650 1.00 0.00 O ATOM 21538 H1 WAT 2965 125.536 96.905 15.174 1.00 0.00 H ATOM 21539 H2 WAT 2965 125.901 96.547 13.749 1.00 0.00 H TER 21541 WAT 2965 ATOM 21541 O WAT 2966 59.658 52.728 87.678 1.00 0.00 O ATOM 21542 H1 WAT 2966 59.100 53.487 87.849 1.00 0.00 H ATOM 21543 H2 WAT 2966 60.064 52.915 86.832 1.00 0.00 H TER 21545 WAT 2966 ATOM 21545 O WAT 2967 98.660 63.643 121.088 1.00 0.00 O ATOM 21546 H1 WAT 2967 99.557 63.785 121.391 1.00 0.00 H ATOM 21547 H2 WAT 2967 98.293 64.523 121.007 1.00 0.00 H TER 21549 WAT 2967 ATOM 21549 O WAT 2968 36.649 18.582 8.020 1.00 0.00 O ATOM 21550 H1 WAT 2968 37.529 18.217 7.935 1.00 0.00 H ATOM 21551 H2 WAT 2968 36.738 19.274 8.675 1.00 0.00 H TER 21553 WAT 2968 ATOM 21553 O WAT 2969 30.326 8.007 95.655 1.00 0.00 O ATOM 21554 H1 WAT 2969 30.914 7.261 95.772 1.00 0.00 H ATOM 21555 H2 WAT 2969 29.845 7.810 94.851 1.00 0.00 H TER 21557 WAT 2969 ATOM 21557 O WAT 2970 32.855 29.145 127.604 1.00 0.00 O ATOM 21558 H1 WAT 2970 33.757 28.921 127.834 1.00 0.00 H ATOM 21559 H2 WAT 2970 32.810 29.011 126.657 1.00 0.00 H TER 21561 WAT 2970 ATOM 21561 O WAT 2971 2.211 95.879 126.650 1.00 0.00 O ATOM 21562 H1 WAT 2971 1.840 96.593 126.130 1.00 0.00 H ATOM 21563 H2 WAT 2971 1.785 95.958 127.503 1.00 0.00 H TER 21565 WAT 2971 ATOM 21565 O WAT 2972 5.564 28.583 93.180 1.00 0.00 O ATOM 21566 H1 WAT 2972 5.449 29.456 93.555 1.00 0.00 H ATOM 21567 H2 WAT 2972 6.450 28.327 93.438 1.00 0.00 H TER 21569 WAT 2972 ATOM 21569 O WAT 2973 47.955 84.229 110.709 1.00 0.00 O ATOM 21570 H1 WAT 2973 47.364 83.703 111.247 1.00 0.00 H ATOM 21571 H2 WAT 2973 47.403 84.560 110.001 1.00 0.00 H TER 21573 WAT 2973 ATOM 21573 O WAT 2974 9.533 105.067 100.903 1.00 0.00 O ATOM 21574 H1 WAT 2974 9.917 104.275 100.528 1.00 0.00 H ATOM 21575 H2 WAT 2974 10.284 105.571 101.216 1.00 0.00 H TER 21577 WAT 2974 ATOM 21577 O WAT 2975 69.717 120.363 156.827 1.00 0.00 O ATOM 21578 H1 WAT 2975 69.887 121.300 156.734 1.00 0.00 H ATOM 21579 H2 WAT 2975 68.841 120.241 156.461 1.00 0.00 H TER 21581 WAT 2975 ATOM 21581 O WAT 2976 103.910 113.995 98.328 1.00 0.00 O ATOM 21582 H1 WAT 2976 103.064 114.121 98.758 1.00 0.00 H ATOM 21583 H2 WAT 2976 103.940 114.676 97.655 1.00 0.00 H TER 21585 WAT 2976 ATOM 21585 O WAT 2977 71.604 87.809 152.452 1.00 0.00 O ATOM 21586 H1 WAT 2977 70.940 87.763 151.764 1.00 0.00 H ATOM 21587 H2 WAT 2977 71.103 87.900 153.262 1.00 0.00 H TER 21589 WAT 2977 ATOM 21589 O WAT 2978 48.750 49.049 154.810 1.00 0.00 O ATOM 21590 H1 WAT 2978 49.246 48.291 154.503 1.00 0.00 H ATOM 21591 H2 WAT 2978 49.375 49.546 155.339 1.00 0.00 H TER 21593 WAT 2978 ATOM 21593 O WAT 2979 125.135 77.985 106.501 1.00 0.00 O ATOM 21594 H1 WAT 2979 125.001 77.147 106.057 1.00 0.00 H ATOM 21595 H2 WAT 2979 124.259 78.249 106.783 1.00 0.00 H TER 21597 WAT 2979 ATOM 21597 O WAT 2980 119.381 86.507 101.442 1.00 0.00 O ATOM 21598 H1 WAT 2980 119.551 87.137 100.742 1.00 0.00 H ATOM 21599 H2 WAT 2980 119.094 85.715 100.987 1.00 0.00 H TER 21601 WAT 2980 ATOM 21601 O WAT 2981 87.325 59.879 153.324 1.00 0.00 O ATOM 21602 H1 WAT 2981 87.340 58.939 153.147 1.00 0.00 H ATOM 21603 H2 WAT 2981 86.701 59.977 154.044 1.00 0.00 H TER 21605 WAT 2981 ATOM 21605 O WAT 2982 135.927 89.815 142.716 1.00 0.00 O ATOM 21606 H1 WAT 2982 136.015 89.995 141.780 1.00 0.00 H ATOM 21607 H2 WAT 2982 136.819 89.880 143.057 1.00 0.00 H TER 21609 WAT 2982 ATOM 21609 O WAT 2983 119.514 137.597 153.282 1.00 0.00 O ATOM 21610 H1 WAT 2983 119.033 138.249 152.772 1.00 0.00 H ATOM 21611 H2 WAT 2983 119.142 136.758 153.009 1.00 0.00 H TER 21613 WAT 2983 ATOM 21613 O WAT 2984 17.012 13.059 93.598 1.00 0.00 O ATOM 21614 H1 WAT 2984 17.511 13.317 92.823 1.00 0.00 H ATOM 21615 H2 WAT 2984 16.326 13.722 93.674 1.00 0.00 H TER 21617 WAT 2984 ATOM 21617 O WAT 2985 71.664 128.060 157.079 1.00 0.00 O ATOM 21618 H1 WAT 2985 72.342 127.691 157.644 1.00 0.00 H ATOM 21619 H2 WAT 2985 71.494 128.928 157.445 1.00 0.00 H TER 21621 WAT 2985 ATOM 21621 O WAT 2986 114.917 18.451 98.948 1.00 0.00 O ATOM 21622 H1 WAT 2986 114.579 19.259 99.335 1.00 0.00 H ATOM 21623 H2 WAT 2986 114.136 17.925 98.775 1.00 0.00 H TER 21625 WAT 2986 ATOM 21625 O WAT 2987 66.685 31.086 80.970 1.00 0.00 O ATOM 21626 H1 WAT 2987 66.354 31.002 81.864 1.00 0.00 H ATOM 21627 H2 WAT 2987 66.878 32.019 80.873 1.00 0.00 H TER 21629 WAT 2987 ATOM 21629 O WAT 2988 3.439 14.693 136.301 1.00 0.00 O ATOM 21630 H1 WAT 2988 3.371 13.907 135.760 1.00 0.00 H ATOM 21631 H2 WAT 2988 2.584 14.766 136.727 1.00 0.00 H TER 21633 WAT 2988 ATOM 21633 O WAT 2989 123.219 11.790 12.392 1.00 0.00 O ATOM 21634 H1 WAT 2989 123.635 12.423 12.977 1.00 0.00 H ATOM 21635 H2 WAT 2989 123.791 11.023 12.425 1.00 0.00 H TER 21637 WAT 2989 ATOM 21637 O WAT 2990 133.443 62.220 10.587 1.00 0.00 O ATOM 21638 H1 WAT 2990 132.739 62.713 11.010 1.00 0.00 H ATOM 21639 H2 WAT 2990 134.221 62.766 10.704 1.00 0.00 H TER 21641 WAT 2990 ATOM 21641 O WAT 2991 122.950 57.024 7.983 1.00 0.00 O ATOM 21642 H1 WAT 2991 122.337 57.662 7.616 1.00 0.00 H ATOM 21643 H2 WAT 2991 123.800 57.272 7.619 1.00 0.00 H TER 21645 WAT 2991 ATOM 21645 O WAT 2992 19.734 124.336 90.066 1.00 0.00 O ATOM 21646 H1 WAT 2992 18.961 124.165 90.604 1.00 0.00 H ATOM 21647 H2 WAT 2992 19.899 123.507 89.616 1.00 0.00 H TER 21649 WAT 2992 ATOM 21649 O WAT 2993 40.495 124.908 71.815 1.00 0.00 O ATOM 21650 H1 WAT 2993 40.975 125.072 71.003 1.00 0.00 H ATOM 21651 H2 WAT 2993 40.107 124.042 71.693 1.00 0.00 H TER 21653 WAT 2993 ATOM 21653 O WAT 2994 3.087 82.839 151.520 1.00 0.00 O ATOM 21654 H1 WAT 2994 2.180 82.539 151.586 1.00 0.00 H ATOM 21655 H2 WAT 2994 3.185 83.463 152.239 1.00 0.00 H TER 21657 WAT 2994 ATOM 21657 O WAT 2995 50.181 91.946 96.398 1.00 0.00 O ATOM 21658 H1 WAT 2995 51.105 92.193 96.431 1.00 0.00 H ATOM 21659 H2 WAT 2995 50.117 91.180 96.967 1.00 0.00 H TER 21661 WAT 2995 ATOM 21661 O WAT 2996 93.089 85.663 72.062 1.00 0.00 O ATOM 21662 H1 WAT 2996 92.349 86.153 72.420 1.00 0.00 H ATOM 21663 H2 WAT 2996 93.497 86.267 71.441 1.00 0.00 H TER 21665 WAT 2996 ATOM 21665 O WAT 2997 4.267 95.781 146.939 1.00 0.00 O ATOM 21666 H1 WAT 2997 4.586 96.344 147.644 1.00 0.00 H ATOM 21667 H2 WAT 2997 3.569 95.264 147.342 1.00 0.00 H TER 21669 WAT 2997 ATOM 21669 O WAT 2998 4.828 99.899 95.383 1.00 0.00 O ATOM 21670 H1 WAT 2998 5.591 99.579 94.900 1.00 0.00 H ATOM 21671 H2 WAT 2998 5.049 99.754 96.303 1.00 0.00 H TER 21673 WAT 2998 ATOM 21673 O WAT 2999 6.786 111.720 145.537 1.00 0.00 O ATOM 21674 H1 WAT 2999 5.838 111.603 145.591 1.00 0.00 H ATOM 21675 H2 WAT 2999 6.936 112.056 144.653 1.00 0.00 H TER 21677 WAT 2999 ATOM 21677 O WAT 3000 95.467 61.465 61.704 1.00 0.00 O ATOM 21678 H1 WAT 3000 96.319 61.308 62.109 1.00 0.00 H ATOM 21679 H2 WAT 3000 95.673 61.736 60.809 1.00 0.00 H TER 21681 WAT 3000 ATOM 21681 O WAT 3001 49.347 65.617 104.076 1.00 0.00 O ATOM 21682 H1 WAT 3001 49.885 65.671 103.286 1.00 0.00 H ATOM 21683 H2 WAT 3001 48.504 65.284 103.770 1.00 0.00 H TER 21685 WAT 3001 ATOM 21685 O WAT 3002 29.161 53.673 22.197 1.00 0.00 O ATOM 21686 H1 WAT 3002 30.080 53.832 21.984 1.00 0.00 H ATOM 21687 H2 WAT 3002 29.187 53.145 22.995 1.00 0.00 H TER 21689 WAT 3002 ATOM 21689 O WAT 3003 63.814 82.327 151.079 1.00 0.00 O ATOM 21690 H1 WAT 3003 64.643 81.877 150.917 1.00 0.00 H ATOM 21691 H2 WAT 3003 64.064 83.234 151.255 1.00 0.00 H TER 21693 WAT 3003 ATOM 21693 O WAT 3004 116.373 42.809 137.093 1.00 0.00 O ATOM 21694 H1 WAT 3004 116.719 43.248 137.870 1.00 0.00 H ATOM 21695 H2 WAT 3004 115.457 43.082 137.051 1.00 0.00 H TER 21697 WAT 3004 ATOM 21697 O WAT 3005 136.468 123.225 132.400 1.00 0.00 O ATOM 21698 H1 WAT 3005 135.903 122.965 131.672 1.00 0.00 H ATOM 21699 H2 WAT 3005 136.762 124.107 132.171 1.00 0.00 H TER 21701 WAT 3005 ATOM 21701 O WAT 3006 108.579 45.856 118.571 1.00 0.00 O ATOM 21702 H1 WAT 3006 109.049 46.135 119.356 1.00 0.00 H ATOM 21703 H2 WAT 3006 108.521 44.904 118.652 1.00 0.00 H TER 21705 WAT 3006 ATOM 21705 O WAT 3007 135.267 15.234 128.190 1.00 0.00 O ATOM 21706 H1 WAT 3007 134.446 15.725 128.151 1.00 0.00 H ATOM 21707 H2 WAT 3007 135.014 14.330 128.006 1.00 0.00 H TER 21709 WAT 3007 ATOM 21709 O WAT 3008 31.891 79.732 128.684 1.00 0.00 O ATOM 21710 H1 WAT 3008 31.238 80.403 128.885 1.00 0.00 H ATOM 21711 H2 WAT 3008 31.833 79.115 129.413 1.00 0.00 H TER 21713 WAT 3008 ATOM 21713 O WAT 3009 33.913 68.621 79.876 1.00 0.00 O ATOM 21714 H1 WAT 3009 34.488 69.290 80.249 1.00 0.00 H ATOM 21715 H2 WAT 3009 33.868 68.836 78.944 1.00 0.00 H TER 21717 WAT 3009 ATOM 21717 O WAT 3010 26.624 82.679 109.702 1.00 0.00 O ATOM 21718 H1 WAT 3010 27.515 83.023 109.758 1.00 0.00 H ATOM 21719 H2 WAT 3010 26.293 82.724 110.599 1.00 0.00 H TER 21721 WAT 3010 ATOM 21721 O WAT 3011 19.267 46.573 72.659 1.00 0.00 O ATOM 21722 H1 WAT 3011 18.914 45.689 72.759 1.00 0.00 H ATOM 21723 H2 WAT 3011 19.243 46.942 73.542 1.00 0.00 H TER 21725 WAT 3011 ATOM 21725 O WAT 3012 71.066 36.683 152.548 1.00 0.00 O ATOM 21726 H1 WAT 3012 71.163 35.787 152.226 1.00 0.00 H ATOM 21727 H2 WAT 3012 70.956 36.587 153.494 1.00 0.00 H TER 21729 WAT 3012 ATOM 21729 O WAT 3013 142.913 82.082 141.784 1.00 0.00 O ATOM 21730 H1 WAT 3013 143.341 82.029 140.930 1.00 0.00 H ATOM 21731 H2 WAT 3013 142.729 83.014 141.903 1.00 0.00 H TER 21733 WAT 3013 ATOM 21733 O WAT 3014 58.680 116.889 63.662 1.00 0.00 O ATOM 21734 H1 WAT 3014 59.269 116.866 64.417 1.00 0.00 H ATOM 21735 H2 WAT 3014 57.839 117.170 64.024 1.00 0.00 H TER 21737 WAT 3014 ATOM 21737 O WAT 3015 13.293 58.350 89.207 1.00 0.00 O ATOM 21738 H1 WAT 3015 14.202 58.377 88.906 1.00 0.00 H ATOM 21739 H2 WAT 3015 13.037 57.433 89.113 1.00 0.00 H TER 21741 WAT 3015 ATOM 21741 O WAT 3016 4.502 123.681 57.396 1.00 0.00 O ATOM 21742 H1 WAT 3016 4.765 122.881 57.850 1.00 0.00 H ATOM 21743 H2 WAT 3016 4.310 124.303 58.098 1.00 0.00 H TER 21745 WAT 3016 ATOM 21745 O WAT 3017 78.816 133.234 109.772 1.00 0.00 O ATOM 21746 H1 WAT 3017 78.900 132.624 110.505 1.00 0.00 H ATOM 21747 H2 WAT 3017 78.262 133.939 110.108 1.00 0.00 H TER 21749 WAT 3017 ATOM 21749 O WAT 3018 7.266 24.636 0.088 1.00 0.00 O ATOM 21750 H1 WAT 3018 6.572 25.188 0.449 1.00 0.00 H ATOM 21751 H2 WAT 3018 7.057 23.755 0.399 1.00 0.00 H TER 21753 WAT 3018 ATOM 21753 O WAT 3019 145.742 113.296 117.569 1.00 0.00 O ATOM 21754 H1 WAT 3019 145.008 112.915 118.052 1.00 0.00 H ATOM 21755 H2 WAT 3019 146.519 112.992 118.037 1.00 0.00 H TER 21757 WAT 3019 ATOM 21757 O WAT 3020 77.208 30.460 74.279 1.00 0.00 O ATOM 21758 H1 WAT 3020 76.754 31.250 73.985 1.00 0.00 H ATOM 21759 H2 WAT 3020 77.142 29.857 73.539 1.00 0.00 H TER 21761 WAT 3020 ATOM 21761 O WAT 3021 1.923 77.356 21.788 1.00 0.00 O ATOM 21762 H1 WAT 3021 1.888 76.684 22.469 1.00 0.00 H ATOM 21763 H2 WAT 3021 2.333 78.109 22.214 1.00 0.00 H TER 21765 WAT 3021 ATOM 21765 O WAT 3022 133.958 45.892 157.935 1.00 0.00 O ATOM 21766 H1 WAT 3022 134.436 46.461 157.331 1.00 0.00 H ATOM 21767 H2 WAT 3022 133.902 46.397 158.746 1.00 0.00 H TER 21769 WAT 3022 ATOM 21769 O WAT 3023 41.928 120.520 61.986 1.00 0.00 O ATOM 21770 H1 WAT 3023 42.628 120.699 61.359 1.00 0.00 H ATOM 21771 H2 WAT 3023 41.836 121.333 62.482 1.00 0.00 H TER 21773 WAT 3023 ATOM 21773 O WAT 3024 134.628 10.565 120.093 1.00 0.00 O ATOM 21774 H1 WAT 3024 134.991 11.112 120.790 1.00 0.00 H ATOM 21775 H2 WAT 3024 133.724 10.865 119.999 1.00 0.00 H TER 21777 WAT 3024 ATOM 21777 O WAT 3025 127.026 11.115 8.270 1.00 0.00 O ATOM 21778 H1 WAT 3025 127.442 11.940 8.019 1.00 0.00 H ATOM 21779 H2 WAT 3025 126.721 11.263 9.165 1.00 0.00 H TER 21781 WAT 3025 ATOM 21781 O WAT 3026 13.384 27.548 77.546 1.00 0.00 O ATOM 21782 H1 WAT 3026 12.798 26.792 77.551 1.00 0.00 H ATOM 21783 H2 WAT 3026 12.936 28.202 78.082 1.00 0.00 H TER 21785 WAT 3026 ATOM 21785 O WAT 3027 118.646 113.436 141.957 1.00 0.00 O ATOM 21786 H1 WAT 3027 118.086 113.933 142.554 1.00 0.00 H ATOM 21787 H2 WAT 3027 119.534 113.728 142.164 1.00 0.00 H TER 21789 WAT 3027 ATOM 21789 O WAT 3028 28.292 3.065 147.810 1.00 0.00 O ATOM 21790 H1 WAT 3028 27.550 2.702 147.327 1.00 0.00 H ATOM 21791 H2 WAT 3028 27.960 3.883 148.181 1.00 0.00 H TER 21793 WAT 3028 ATOM 21793 O WAT 3029 89.612 96.250 87.970 1.00 0.00 O ATOM 21794 H1 WAT 3029 88.660 96.163 87.924 1.00 0.00 H ATOM 21795 H2 WAT 3029 89.765 96.829 88.716 1.00 0.00 H TER 21797 WAT 3029 ATOM 21797 O WAT 3030 17.806 133.648 103.209 1.00 0.00 O ATOM 21798 H1 WAT 3030 18.692 133.295 103.285 1.00 0.00 H ATOM 21799 H2 WAT 3030 17.614 133.616 102.272 1.00 0.00 H TER 21801 WAT 3030 ATOM 21801 O WAT 3031 28.707 36.442 140.878 1.00 0.00 O ATOM 21802 H1 WAT 3031 28.777 36.678 139.954 1.00 0.00 H ATOM 21803 H2 WAT 3031 28.602 35.490 140.875 1.00 0.00 H TER 21805 WAT 3031 ATOM 21805 O WAT 3032 34.112 30.234 19.169 1.00 0.00 O ATOM 21806 H1 WAT 3032 34.912 29.856 19.534 1.00 0.00 H ATOM 21807 H2 WAT 3032 33.863 30.915 19.794 1.00 0.00 H TER 21809 WAT 3032 ATOM 21809 O WAT 3033 53.326 66.348 117.663 1.00 0.00 O ATOM 21810 H1 WAT 3033 54.170 66.574 117.272 1.00 0.00 H ATOM 21811 H2 WAT 3033 53.464 65.481 118.046 1.00 0.00 H TER 21813 WAT 3033 ATOM 21813 O WAT 3034 108.826 143.169 93.906 1.00 0.00 O ATOM 21814 H1 WAT 3034 107.941 143.351 93.591 1.00 0.00 H ATOM 21815 H2 WAT 3034 108.894 142.215 93.890 1.00 0.00 H TER 21817 WAT 3034 ATOM 21817 O WAT 3035 72.555 96.997 70.603 1.00 0.00 O ATOM 21818 H1 WAT 3035 72.643 96.053 70.468 1.00 0.00 H ATOM 21819 H2 WAT 3035 71.611 97.154 70.592 1.00 0.00 H TER 21821 WAT 3035 ATOM 21821 O WAT 3036 119.742 46.195 74.010 1.00 0.00 O ATOM 21822 H1 WAT 3036 120.098 45.321 74.168 1.00 0.00 H ATOM 21823 H2 WAT 3036 120.427 46.791 74.314 1.00 0.00 H TER 21825 WAT 3036 ATOM 21825 O WAT 3037 2.045 25.578 121.510 1.00 0.00 O ATOM 21826 H1 WAT 3037 1.789 24.674 121.691 1.00 0.00 H ATOM 21827 H2 WAT 3037 2.815 25.501 120.946 1.00 0.00 H TER 21829 WAT 3037 ATOM 21829 O WAT 3038 22.880 136.860 96.417 1.00 0.00 O ATOM 21830 H1 WAT 3038 22.785 136.063 96.939 1.00 0.00 H ATOM 21831 H2 WAT 3038 22.240 136.763 95.712 1.00 0.00 H TER 21833 WAT 3038 ATOM 21833 O WAT 3039 96.257 0.665 92.972 1.00 0.00 O ATOM 21834 H1 WAT 3039 95.400 0.241 93.015 1.00 0.00 H ATOM 21835 H2 WAT 3039 96.191 1.265 92.229 1.00 0.00 H TER 21837 WAT 3039 ATOM 21837 O WAT 3040 19.383 136.285 156.335 1.00 0.00 O ATOM 21838 H1 WAT 3040 20.021 136.522 157.007 1.00 0.00 H ATOM 21839 H2 WAT 3040 18.886 135.563 156.720 1.00 0.00 H TER 21841 WAT 3040 ATOM 21841 O WAT 3041 144.843 139.553 144.252 1.00 0.00 O ATOM 21842 H1 WAT 3041 144.565 140.398 144.606 1.00 0.00 H ATOM 21843 H2 WAT 3041 144.606 138.920 144.930 1.00 0.00 H TER 21845 WAT 3041 ATOM 21845 O WAT 3042 12.402 17.523 2.656 1.00 0.00 O ATOM 21846 H1 WAT 3042 11.894 17.334 3.445 1.00 0.00 H ATOM 21847 H2 WAT 3042 12.507 18.475 2.661 1.00 0.00 H TER 21849 WAT 3042 ATOM 21849 O WAT 3043 114.711 118.974 152.739 1.00 0.00 O ATOM 21850 H1 WAT 3043 114.373 119.565 152.065 1.00 0.00 H ATOM 21851 H2 WAT 3043 113.928 118.617 153.158 1.00 0.00 H TER 21853 WAT 3043 ATOM 21853 O WAT 3044 76.708 18.573 88.539 1.00 0.00 O ATOM 21854 H1 WAT 3044 76.968 17.663 88.396 1.00 0.00 H ATOM 21855 H2 WAT 3044 77.462 18.972 88.973 1.00 0.00 H TER 21857 WAT 3044 ATOM 21857 O WAT 3045 93.331 58.669 133.321 1.00 0.00 O ATOM 21858 H1 WAT 3045 92.963 58.782 134.198 1.00 0.00 H ATOM 21859 H2 WAT 3045 92.766 59.196 132.755 1.00 0.00 H TER 21861 WAT 3045 ATOM 21861 O WAT 3046 25.357 97.238 143.943 1.00 0.00 O ATOM 21862 H1 WAT 3046 25.116 97.468 144.840 1.00 0.00 H ATOM 21863 H2 WAT 3046 25.235 98.048 143.447 1.00 0.00 H TER 21865 WAT 3046 ATOM 21865 O WAT 3047 92.086 142.708 143.990 1.00 0.00 O ATOM 21866 H1 WAT 3047 92.355 142.085 143.315 1.00 0.00 H ATOM 21867 H2 WAT 3047 92.667 142.527 144.729 1.00 0.00 H TER 21869 WAT 3047 ATOM 21869 O WAT 3048 100.142 81.669 105.888 1.00 0.00 O ATOM 21870 H1 WAT 3048 100.374 82.557 105.617 1.00 0.00 H ATOM 21871 H2 WAT 3048 100.896 81.137 105.634 1.00 0.00 H TER 21873 WAT 3048 ATOM 21873 O WAT 3049 144.609 83.790 93.925 1.00 0.00 O ATOM 21874 H1 WAT 3049 144.273 83.598 93.049 1.00 0.00 H ATOM 21875 H2 WAT 3049 143.827 83.972 94.446 1.00 0.00 H TER 21877 WAT 3049 ATOM 21877 O WAT 3050 85.688 48.007 13.442 1.00 0.00 O ATOM 21878 H1 WAT 3050 84.913 47.528 13.734 1.00 0.00 H ATOM 21879 H2 WAT 3050 86.425 47.461 13.719 1.00 0.00 H TER 21881 WAT 3050 ATOM 21881 O WAT 3051 42.599 141.712 79.655 1.00 0.00 O ATOM 21882 H1 WAT 3051 42.277 140.815 79.562 1.00 0.00 H ATOM 21883 H2 WAT 3051 42.541 141.890 80.594 1.00 0.00 H TER 21885 WAT 3051 ATOM 21885 O WAT 3052 145.709 10.531 108.048 1.00 0.00 O ATOM 21886 H1 WAT 3052 145.981 10.739 108.942 1.00 0.00 H ATOM 21887 H2 WAT 3052 144.790 10.797 108.009 1.00 0.00 H TER 21889 WAT 3052 ATOM 21889 O WAT 3053 28.491 64.527 136.269 1.00 0.00 O ATOM 21890 H1 WAT 3053 29.405 64.795 136.177 1.00 0.00 H ATOM 21891 H2 WAT 3053 28.092 65.215 136.802 1.00 0.00 H TER 21893 WAT 3053 ATOM 21893 O WAT 3054 131.276 75.372 133.171 1.00 0.00 O ATOM 21894 H1 WAT 3054 131.955 74.699 133.225 1.00 0.00 H ATOM 21895 H2 WAT 3054 131.677 76.149 133.560 1.00 0.00 H TER 21897 WAT 3054 ATOM 21897 O WAT 3055 95.566 117.782 90.736 1.00 0.00 O ATOM 21898 H1 WAT 3055 94.829 117.548 90.171 1.00 0.00 H ATOM 21899 H2 WAT 3055 95.520 117.157 91.460 1.00 0.00 H TER 21901 WAT 3055 ATOM 21901 O WAT 3056 1.845 121.890 128.362 1.00 0.00 O ATOM 21902 H1 WAT 3056 1.445 121.789 127.498 1.00 0.00 H ATOM 21903 H2 WAT 3056 2.516 121.208 128.396 1.00 0.00 H TER 21905 WAT 3056 ATOM 21905 O WAT 3057 55.726 16.410 117.661 1.00 0.00 O ATOM 21906 H1 WAT 3057 55.526 15.841 118.404 1.00 0.00 H ATOM 21907 H2 WAT 3057 56.651 16.631 117.769 1.00 0.00 H TER 21909 WAT 3057 ATOM 21909 O WAT 3058 133.492 86.212 10.932 1.00 0.00 O ATOM 21910 H1 WAT 3058 132.538 86.251 10.994 1.00 0.00 H ATOM 21911 H2 WAT 3058 133.752 87.097 10.674 1.00 0.00 H TER 21913 WAT 3058 ATOM 21913 O WAT 3059 52.896 126.457 66.060 1.00 0.00 O ATOM 21914 H1 WAT 3059 52.838 127.404 66.186 1.00 0.00 H ATOM 21915 H2 WAT 3059 53.383 126.143 66.822 1.00 0.00 H TER 21917 WAT 3059 ATOM 21917 O WAT 3060 41.933 12.323 117.801 1.00 0.00 O ATOM 21918 H1 WAT 3060 42.001 13.230 117.502 1.00 0.00 H ATOM 21919 H2 WAT 3060 42.408 11.817 117.142 1.00 0.00 H TER 21921 WAT 3060 ATOM 21921 O WAT 3061 28.587 91.281 72.662 1.00 0.00 O ATOM 21922 H1 WAT 3061 28.411 91.565 73.559 1.00 0.00 H ATOM 21923 H2 WAT 3061 28.079 91.880 72.116 1.00 0.00 H TER 21925 WAT 3061 ATOM 21925 O WAT 3062 27.778 117.318 144.639 1.00 0.00 O ATOM 21926 H1 WAT 3062 28.238 116.481 144.588 1.00 0.00 H ATOM 21927 H2 WAT 3062 26.872 117.082 144.838 1.00 0.00 H TER 21929 WAT 3062 ATOM 21929 O WAT 3063 137.394 114.105 78.333 1.00 0.00 O ATOM 21930 H1 WAT 3063 136.969 114.800 78.836 1.00 0.00 H ATOM 21931 H2 WAT 3063 136.790 113.929 77.611 1.00 0.00 H TER 21933 WAT 3063 ATOM 21933 O WAT 3064 7.429 43.125 13.050 1.00 0.00 O ATOM 21934 H1 WAT 3064 7.859 42.341 12.708 1.00 0.00 H ATOM 21935 H2 WAT 3064 8.146 43.735 13.224 1.00 0.00 H TER 21937 WAT 3064 ATOM 21937 O WAT 3065 53.267 121.721 9.447 1.00 0.00 O ATOM 21938 H1 WAT 3065 52.921 121.876 8.568 1.00 0.00 H ATOM 21939 H2 WAT 3065 54.045 122.277 9.499 1.00 0.00 H TER 21941 WAT 3065 ATOM 21941 O WAT 3066 81.809 70.560 127.333 1.00 0.00 O ATOM 21942 H1 WAT 3066 81.507 71.467 127.381 1.00 0.00 H ATOM 21943 H2 WAT 3066 82.050 70.436 126.415 1.00 0.00 H TER 21945 WAT 3066 ATOM 21945 O WAT 3067 75.286 127.870 89.330 1.00 0.00 O ATOM 21946 H1 WAT 3067 75.824 128.586 88.990 1.00 0.00 H ATOM 21947 H2 WAT 3067 75.134 127.305 88.572 1.00 0.00 H TER 21949 WAT 3067 ATOM 21949 O WAT 3068 63.101 100.437 72.383 1.00 0.00 O ATOM 21950 H1 WAT 3068 62.785 100.033 73.191 1.00 0.00 H ATOM 21951 H2 WAT 3068 62.541 100.072 71.698 1.00 0.00 H TER 21953 WAT 3068 ATOM 21953 O WAT 3069 56.585 68.500 9.984 1.00 0.00 O ATOM 21954 H1 WAT 3069 55.954 68.027 9.440 1.00 0.00 H ATOM 21955 H2 WAT 3069 57.313 68.692 9.393 1.00 0.00 H TER 21957 WAT 3069 ATOM 21957 O WAT 3070 57.424 120.596 94.540 1.00 0.00 O ATOM 21958 H1 WAT 3070 58.184 120.270 95.022 1.00 0.00 H ATOM 21959 H2 WAT 3070 57.150 119.856 93.998 1.00 0.00 H TER 21961 WAT 3070 ATOM 21961 O WAT 3071 18.348 119.224 84.564 1.00 0.00 O ATOM 21962 H1 WAT 3071 18.380 119.541 83.661 1.00 0.00 H ATOM 21963 H2 WAT 3071 19.217 119.416 84.916 1.00 0.00 H TER 21965 WAT 3071 ATOM 21965 O WAT 3072 129.887 80.239 3.725 1.00 0.00 O ATOM 21966 H1 WAT 3072 130.283 80.215 4.596 1.00 0.00 H ATOM 21967 H2 WAT 3072 129.878 79.325 3.441 1.00 0.00 H TER 21969 WAT 3072 ATOM 21969 O WAT 3073 131.818 107.618 107.572 1.00 0.00 O ATOM 21970 H1 WAT 3073 131.009 107.263 107.942 1.00 0.00 H ATOM 21971 H2 WAT 3073 131.538 108.075 106.779 1.00 0.00 H TER 21973 WAT 3073 ATOM 21973 O WAT 3074 131.094 142.943 21.590 1.00 0.00 O ATOM 21974 H1 WAT 3074 131.312 142.481 20.781 1.00 0.00 H ATOM 21975 H2 WAT 3074 130.415 143.567 21.334 1.00 0.00 H TER 21977 WAT 3074 ATOM 21977 O WAT 3075 61.655 105.149 5.019 1.00 0.00 O ATOM 21978 H1 WAT 3075 61.345 105.902 5.523 1.00 0.00 H ATOM 21979 H2 WAT 3075 61.089 104.428 5.293 1.00 0.00 H TER 21981 WAT 3075 ATOM 21981 O WAT 3076 1.708 17.039 62.102 1.00 0.00 O ATOM 21982 H1 WAT 3076 0.831 16.697 62.277 1.00 0.00 H ATOM 21983 H2 WAT 3076 1.976 16.607 61.291 1.00 0.00 H TER 21985 WAT 3076 ATOM 21985 O WAT 3077 22.613 71.039 67.947 1.00 0.00 O ATOM 21986 H1 WAT 3077 23.471 71.266 68.307 1.00 0.00 H ATOM 21987 H2 WAT 3077 22.236 71.878 67.682 1.00 0.00 H TER 21989 WAT 3077 ATOM 21989 O WAT 3078 45.910 141.944 121.041 1.00 0.00 O ATOM 21990 H1 WAT 3078 45.557 142.512 120.356 1.00 0.00 H ATOM 21991 H2 WAT 3078 45.938 142.498 121.821 1.00 0.00 H TER 21993 WAT 3078 ATOM 21993 O WAT 3079 102.680 58.379 123.236 1.00 0.00 O ATOM 21994 H1 WAT 3079 101.768 58.367 123.524 1.00 0.00 H ATOM 21995 H2 WAT 3079 102.756 57.626 122.649 1.00 0.00 H TER 21997 WAT 3079 ATOM 21997 O WAT 3080 139.289 17.614 122.252 1.00 0.00 O ATOM 21998 H1 WAT 3080 139.215 16.946 122.934 1.00 0.00 H ATOM 21999 H2 WAT 3080 139.535 17.127 121.466 1.00 0.00 H TER 22001 WAT 3080 ATOM 22001 O WAT 3081 1.218 63.105 18.801 1.00 0.00 O ATOM 22002 H1 WAT 3081 0.577 63.379 18.145 1.00 0.00 H ATOM 22003 H2 WAT 3081 1.553 63.925 19.165 1.00 0.00 H TER 22005 WAT 3081 ATOM 22005 O WAT 3082 4.882 28.708 131.659 1.00 0.00 O ATOM 22006 H1 WAT 3082 5.266 28.933 132.507 1.00 0.00 H ATOM 22007 H2 WAT 3082 5.552 28.180 131.225 1.00 0.00 H TER 22009 WAT 3082 ATOM 22009 O WAT 3083 76.655 65.708 152.675 1.00 0.00 O ATOM 22010 H1 WAT 3083 75.702 65.777 152.627 1.00 0.00 H ATOM 22011 H2 WAT 3083 76.872 66.000 153.560 1.00 0.00 H TER 22013 WAT 3083 ATOM 22013 O WAT 3084 104.344 85.592 134.636 1.00 0.00 O ATOM 22014 H1 WAT 3084 104.482 85.512 135.579 1.00 0.00 H ATOM 22015 H2 WAT 3084 105.178 85.918 134.298 1.00 0.00 H TER 22017 WAT 3084 ATOM 22017 O WAT 3085 118.800 38.275 117.990 1.00 0.00 O ATOM 22018 H1 WAT 3085 118.655 37.527 117.409 1.00 0.00 H ATOM 22019 H2 WAT 3085 118.303 38.988 117.590 1.00 0.00 H TER 22021 WAT 3085 ATOM 22021 O WAT 3086 102.050 51.357 57.992 1.00 0.00 O ATOM 22022 H1 WAT 3086 101.455 51.439 58.737 1.00 0.00 H ATOM 22023 H2 WAT 3086 101.490 51.477 57.225 1.00 0.00 H TER 22025 WAT 3086 ATOM 22025 O WAT 3087 116.095 52.680 126.410 1.00 0.00 O ATOM 22026 H1 WAT 3087 115.189 52.436 126.599 1.00 0.00 H ATOM 22027 H2 WAT 3087 116.096 52.890 125.476 1.00 0.00 H TER 22029 WAT 3087 ATOM 22029 O WAT 3088 30.971 87.055 120.077 1.00 0.00 O ATOM 22030 H1 WAT 3088 30.454 87.435 119.367 1.00 0.00 H ATOM 22031 H2 WAT 3088 31.564 86.444 119.641 1.00 0.00 H TER 22033 WAT 3088 ATOM 22033 O WAT 3089 107.897 13.774 101.719 1.00 0.00 O ATOM 22034 H1 WAT 3089 107.014 13.844 102.081 1.00 0.00 H ATOM 22035 H2 WAT 3089 107.954 12.873 101.400 1.00 0.00 H TER 22037 WAT 3089 ATOM 22037 O WAT 3090 110.345 38.171 154.605 1.00 0.00 O ATOM 22038 H1 WAT 3090 110.698 38.347 153.733 1.00 0.00 H ATOM 22039 H2 WAT 3090 110.993 38.541 155.205 1.00 0.00 H TER 22041 WAT 3090 ATOM 22041 O WAT 3091 142.595 64.978 1.755 1.00 0.00 O ATOM 22042 H1 WAT 3091 142.054 65.421 2.408 1.00 0.00 H ATOM 22043 H2 WAT 3091 143.132 64.369 2.262 1.00 0.00 H TER 22045 WAT 3091 ATOM 22045 O WAT 3092 116.189 69.202 143.282 1.00 0.00 O ATOM 22046 H1 WAT 3092 115.578 68.652 142.791 1.00 0.00 H ATOM 22047 H2 WAT 3092 116.269 69.999 142.757 1.00 0.00 H TER 22049 WAT 3092 ATOM 22049 O WAT 3093 94.540 73.642 16.506 1.00 0.00 O ATOM 22050 H1 WAT 3093 94.237 73.663 17.414 1.00 0.00 H ATOM 22051 H2 WAT 3093 95.092 72.862 16.455 1.00 0.00 H TER 22053 WAT 3093 ATOM 22053 O WAT 3094 141.660 93.779 89.591 1.00 0.00 O ATOM 22054 H1 WAT 3094 142.226 93.712 90.360 1.00 0.00 H ATOM 22055 H2 WAT 3094 141.207 92.936 89.554 1.00 0.00 H TER 22057 WAT 3094 ATOM 22057 O WAT 3095 12.004 51.924 18.099 1.00 0.00 O ATOM 22058 H1 WAT 3095 11.523 52.748 18.028 1.00 0.00 H ATOM 22059 H2 WAT 3095 11.435 51.359 18.622 1.00 0.00 H TER 22061 WAT 3095 ATOM 22061 O WAT 3096 55.215 59.912 128.974 1.00 0.00 O ATOM 22062 H1 WAT 3096 55.025 60.061 128.047 1.00 0.00 H ATOM 22063 H2 WAT 3096 54.720 59.124 129.196 1.00 0.00 H TER 22065 WAT 3096 ATOM 22065 O WAT 3097 90.439 129.360 82.179 1.00 0.00 O ATOM 22066 H1 WAT 3097 90.804 128.482 82.071 1.00 0.00 H ATOM 22067 H2 WAT 3097 89.779 129.262 82.865 1.00 0.00 H TER 22069 WAT 3097 ATOM 22069 O WAT 3098 17.504 125.594 20.096 1.00 0.00 O ATOM 22070 H1 WAT 3098 17.269 124.783 19.644 1.00 0.00 H ATOM 22071 H2 WAT 3098 16.847 125.681 20.787 1.00 0.00 H TER 22073 WAT 3098 ATOM 22073 O WAT 3099 14.489 49.135 83.935 1.00 0.00 O ATOM 22074 H1 WAT 3099 14.137 48.374 84.397 1.00 0.00 H ATOM 22075 H2 WAT 3099 14.452 49.843 84.577 1.00 0.00 H TER 22077 WAT 3099 ATOM 22077 O WAT 3100 112.086 121.445 108.826 1.00 0.00 O ATOM 22078 H1 WAT 3100 111.622 122.280 108.887 1.00 0.00 H ATOM 22079 H2 WAT 3100 112.884 121.649 108.339 1.00 0.00 H TER 22081 WAT 3100 ATOM 22081 O WAT 3101 78.376 59.189 105.443 1.00 0.00 O ATOM 22082 H1 WAT 3101 78.557 58.559 104.746 1.00 0.00 H ATOM 22083 H2 WAT 3101 79.072 59.841 105.363 1.00 0.00 H TER 22085 WAT 3101 ATOM 22085 O WAT 3102 94.050 41.348 119.589 1.00 0.00 O ATOM 22086 H1 WAT 3102 94.004 40.431 119.321 1.00 0.00 H ATOM 22087 H2 WAT 3102 94.983 41.510 119.731 1.00 0.00 H TER 22089 WAT 3102 ATOM 22089 O WAT 3103 130.565 63.919 142.660 1.00 0.00 O ATOM 22090 H1 WAT 3103 129.861 64.420 142.247 1.00 0.00 H ATOM 22091 H2 WAT 3103 130.118 63.197 143.102 1.00 0.00 H TER 22093 WAT 3103 ATOM 22093 O WAT 3104 12.635 41.543 68.410 1.00 0.00 O ATOM 22094 H1 WAT 3104 13.379 41.737 68.981 1.00 0.00 H ATOM 22095 H2 WAT 3104 12.725 42.158 67.682 1.00 0.00 H TER 22097 WAT 3104 ATOM 22097 O WAT 3105 8.043 102.137 105.396 1.00 0.00 O ATOM 22098 H1 WAT 3105 8.228 102.317 104.475 1.00 0.00 H ATOM 22099 H2 WAT 3105 8.802 102.483 105.865 1.00 0.00 H TER 22101 WAT 3105 ATOM 22101 O WAT 3106 123.030 136.436 84.639 1.00 0.00 O ATOM 22102 H1 WAT 3106 123.406 137.044 85.276 1.00 0.00 H ATOM 22103 H2 WAT 3106 123.228 135.568 84.991 1.00 0.00 H TER 22105 WAT 3106 ATOM 22105 O WAT 3107 39.577 116.609 95.328 1.00 0.00 O ATOM 22106 H1 WAT 3107 39.347 115.913 95.944 1.00 0.00 H ATOM 22107 H2 WAT 3107 39.675 117.389 95.874 1.00 0.00 H TER 22109 WAT 3107 ATOM 22109 O WAT 3108 63.927 132.953 122.309 1.00 0.00 O ATOM 22110 H1 WAT 3108 63.625 132.875 121.404 1.00 0.00 H ATOM 22111 H2 WAT 3108 63.397 133.660 122.679 1.00 0.00 H TER 22113 WAT 3108 ATOM 22113 O WAT 3109 77.178 127.110 136.073 1.00 0.00 O ATOM 22114 H1 WAT 3109 76.783 127.372 135.241 1.00 0.00 H ATOM 22115 H2 WAT 3109 76.764 126.273 136.281 1.00 0.00 H TER 22117 WAT 3109 ATOM 22117 O WAT 3110 132.327 106.459 111.442 1.00 0.00 O ATOM 22118 H1 WAT 3110 132.079 106.093 112.291 1.00 0.00 H ATOM 22119 H2 WAT 3110 132.652 105.710 110.944 1.00 0.00 H TER 22121 WAT 3110 ATOM 22121 O WAT 3111 137.065 57.188 24.990 1.00 0.00 O ATOM 22122 H1 WAT 3111 137.471 57.217 24.124 1.00 0.00 H ATOM 22123 H2 WAT 3111 136.272 57.718 24.901 1.00 0.00 H TER 22125 WAT 3111 ATOM 22125 O WAT 3112 145.474 136.000 74.210 1.00 0.00 O ATOM 22126 H1 WAT 3112 145.391 136.904 73.908 1.00 0.00 H ATOM 22127 H2 WAT 3112 145.699 135.505 73.422 1.00 0.00 H TER 22129 WAT 3112 ATOM 22129 O WAT 3113 64.007 1.010 86.975 1.00 0.00 O ATOM 22130 H1 WAT 3113 64.886 0.681 86.786 1.00 0.00 H ATOM 22131 H2 WAT 3113 63.465 0.223 87.040 1.00 0.00 H TER 22133 WAT 3113 ATOM 22133 O WAT 3114 20.699 113.219 86.826 1.00 0.00 O ATOM 22134 H1 WAT 3114 19.767 113.274 87.037 1.00 0.00 H ATOM 22135 H2 WAT 3114 20.742 113.392 85.885 1.00 0.00 H TER 22137 WAT 3114 ATOM 22137 O WAT 3115 114.002 122.428 103.759 1.00 0.00 O ATOM 22138 H1 WAT 3115 114.315 121.608 103.378 1.00 0.00 H ATOM 22139 H2 WAT 3115 113.296 122.709 103.176 1.00 0.00 H TER 22141 WAT 3115 ATOM 22141 O WAT 3116 85.693 30.752 96.837 1.00 0.00 O ATOM 22142 H1 WAT 3116 84.892 30.964 96.359 1.00 0.00 H ATOM 22143 H2 WAT 3116 86.398 30.926 96.214 1.00 0.00 H TER 22145 WAT 3116 ATOM 22145 O WAT 3117 110.413 77.509 74.817 1.00 0.00 O ATOM 22146 H1 WAT 3117 110.227 78.120 75.530 1.00 0.00 H ATOM 22147 H2 WAT 3117 110.474 78.061 74.038 1.00 0.00 H TER 22149 WAT 3117 ATOM 22149 O WAT 3118 38.746 125.661 64.675 1.00 0.00 O ATOM 22150 H1 WAT 3118 37.914 125.466 64.244 1.00 0.00 H ATOM 22151 H2 WAT 3118 39.320 125.950 63.966 1.00 0.00 H TER 22153 WAT 3118 ATOM 22153 O WAT 3119 133.282 28.427 78.443 1.00 0.00 O ATOM 22154 H1 WAT 3119 134.149 28.201 78.781 1.00 0.00 H ATOM 22155 H2 WAT 3119 133.092 27.747 77.797 1.00 0.00 H TER 22157 WAT 3119 ATOM 22157 O WAT 3120 84.178 70.535 16.760 1.00 0.00 O ATOM 22158 H1 WAT 3120 83.354 71.021 16.786 1.00 0.00 H ATOM 22159 H2 WAT 3120 84.384 70.463 15.827 1.00 0.00 H TER 22161 WAT 3120 ATOM 22161 O WAT 3121 125.243 128.997 98.018 1.00 0.00 O ATOM 22162 H1 WAT 3121 124.538 129.536 97.658 1.00 0.00 H ATOM 22163 H2 WAT 3121 124.960 128.097 97.860 1.00 0.00 H TER 22165 WAT 3121 ATOM 22165 O WAT 3122 79.048 38.139 153.376 1.00 0.00 O ATOM 22166 H1 WAT 3122 78.721 38.135 154.275 1.00 0.00 H ATOM 22167 H2 WAT 3122 79.353 39.035 153.236 1.00 0.00 H TER 22169 WAT 3122 ATOM 22169 O WAT 3123 15.556 128.661 124.009 1.00 0.00 O ATOM 22170 H1 WAT 3123 15.384 128.792 123.076 1.00 0.00 H ATOM 22171 H2 WAT 3123 15.032 127.896 124.244 1.00 0.00 H TER 22173 WAT 3123 ATOM 22173 O WAT 3124 126.477 79.598 126.693 1.00 0.00 O ATOM 22174 H1 WAT 3124 125.592 79.813 126.989 1.00 0.00 H ATOM 22175 H2 WAT 3124 126.654 78.738 127.074 1.00 0.00 H TER 22177 WAT 3124 ATOM 22177 O WAT 3125 52.311 116.875 95.391 1.00 0.00 O ATOM 22178 H1 WAT 3125 51.945 117.408 96.096 1.00 0.00 H ATOM 22179 H2 WAT 3125 51.835 117.154 94.609 1.00 0.00 H TER 22181 WAT 3125 ATOM 22181 O WAT 3126 115.268 107.802 14.205 1.00 0.00 O ATOM 22182 H1 WAT 3126 114.838 107.516 13.398 1.00 0.00 H ATOM 22183 H2 WAT 3126 115.685 107.011 14.546 1.00 0.00 H TER 22185 WAT 3126 ATOM 22185 O WAT 3127 113.974 102.658 94.285 1.00 0.00 O ATOM 22186 H1 WAT 3127 114.345 101.823 93.999 1.00 0.00 H ATOM 22187 H2 WAT 3127 114.643 103.306 94.062 1.00 0.00 H TER 22189 WAT 3127 ATOM 22189 O WAT 3128 108.832 66.975 2.525 1.00 0.00 O ATOM 22190 H1 WAT 3128 107.959 67.034 2.137 1.00 0.00 H ATOM 22191 H2 WAT 3128 108.745 67.404 3.376 1.00 0.00 H TER 22193 WAT 3128 ATOM 22193 O WAT 3129 123.634 15.715 86.957 1.00 0.00 O ATOM 22194 H1 WAT 3129 123.416 14.988 87.540 1.00 0.00 H ATOM 22195 H2 WAT 3129 124.385 15.401 86.454 1.00 0.00 H TER 22197 WAT 3129 ATOM 22197 O WAT 3130 1.257 2.843 134.416 1.00 0.00 O ATOM 22198 H1 WAT 3130 0.538 2.583 134.992 1.00 0.00 H ATOM 22199 H2 WAT 3130 0.849 2.947 133.557 1.00 0.00 H TER 22201 WAT 3130 ATOM 22201 O WAT 3131 11.272 128.475 103.282 1.00 0.00 O ATOM 22202 H1 WAT 3131 11.450 129.145 102.622 1.00 0.00 H ATOM 22203 H2 WAT 3131 12.125 128.292 103.675 1.00 0.00 H TER 22205 WAT 3131 ATOM 22205 O WAT 3132 8.959 27.126 78.661 1.00 0.00 O ATOM 22206 H1 WAT 3132 8.821 27.539 79.513 1.00 0.00 H ATOM 22207 H2 WAT 3132 8.344 27.570 78.077 1.00 0.00 H TER 22209 WAT 3132 ATOM 22209 O WAT 3133 76.341 55.614 111.038 1.00 0.00 O ATOM 22210 H1 WAT 3133 76.937 54.978 111.434 1.00 0.00 H ATOM 22211 H2 WAT 3133 76.915 56.292 110.682 1.00 0.00 H TER 22213 WAT 3133 ATOM 22213 O WAT 3134 101.805 92.465 74.210 1.00 0.00 O ATOM 22214 H1 WAT 3134 101.462 91.595 74.414 1.00 0.00 H ATOM 22215 H2 WAT 3134 102.654 92.298 73.800 1.00 0.00 H TER 22217 WAT 3134 ATOM 22217 O WAT 3135 55.017 5.558 102.354 1.00 0.00 O ATOM 22218 H1 WAT 3135 54.200 6.050 102.269 1.00 0.00 H ATOM 22219 H2 WAT 3135 55.583 5.914 101.669 1.00 0.00 H TER 22221 WAT 3135 ATOM 22221 O WAT 3136 91.360 113.980 134.549 1.00 0.00 O ATOM 22222 H1 WAT 3136 91.907 113.917 135.332 1.00 0.00 H ATOM 22223 H2 WAT 3136 90.536 114.354 134.862 1.00 0.00 H TER 22225 WAT 3136 ATOM 22225 O WAT 3137 113.892 10.444 85.550 1.00 0.00 O ATOM 22226 H1 WAT 3137 112.954 10.392 85.367 1.00 0.00 H ATOM 22227 H2 WAT 3137 114.291 9.827 84.936 1.00 0.00 H TER 22229 WAT 3137 ATOM 22229 O WAT 3138 55.989 127.735 80.331 1.00 0.00 O ATOM 22230 H1 WAT 3138 56.721 128.266 80.015 1.00 0.00 H ATOM 22231 H2 WAT 3138 56.277 127.416 81.186 1.00 0.00 H TER 22233 WAT 3138 ATOM 22233 O WAT 3139 121.990 35.843 125.061 1.00 0.00 O ATOM 22234 H1 WAT 3139 121.749 36.598 124.524 1.00 0.00 H ATOM 22235 H2 WAT 3139 121.582 36.014 125.910 1.00 0.00 H TER 22237 WAT 3139 ATOM 22237 O WAT 3140 5.866 83.146 1.815 1.00 0.00 O ATOM 22238 H1 WAT 3140 5.661 82.229 2.000 1.00 0.00 H ATOM 22239 H2 WAT 3140 5.451 83.632 2.527 1.00 0.00 H TER 22241 WAT 3140 ATOM 22241 O WAT 3141 117.182 102.358 158.293 1.00 0.00 O ATOM 22242 H1 WAT 3141 118.068 102.170 158.602 1.00 0.00 H ATOM 22243 H2 WAT 3141 116.732 101.514 158.327 1.00 0.00 H TER 22245 WAT 3141 ATOM 22245 O WAT 3142 36.956 117.193 16.303 1.00 0.00 O ATOM 22246 H1 WAT 3142 36.463 116.906 15.534 1.00 0.00 H ATOM 22247 H2 WAT 3142 37.352 118.023 16.037 1.00 0.00 H TER 22249 WAT 3142 ATOM 22249 O WAT 3143 21.162 23.451 132.390 1.00 0.00 O ATOM 22250 H1 WAT 3143 21.590 23.850 131.633 1.00 0.00 H ATOM 22251 H2 WAT 3143 20.227 23.578 132.231 1.00 0.00 H TER 22253 WAT 3143 ATOM 22253 O WAT 3144 34.266 119.332 2.065 1.00 0.00 O ATOM 22254 H1 WAT 3144 34.330 120.230 1.739 1.00 0.00 H ATOM 22255 H2 WAT 3144 33.881 119.421 2.936 1.00 0.00 H TER 22257 WAT 3144 ATOM 22257 O WAT 3145 83.251 134.840 8.805 1.00 0.00 O ATOM 22258 H1 WAT 3145 82.627 134.255 8.376 1.00 0.00 H ATOM 22259 H2 WAT 3145 83.996 134.278 9.023 1.00 0.00 H TER 22261 WAT 3145 ATOM 22261 O WAT 3146 51.612 10.938 137.086 1.00 0.00 O ATOM 22262 H1 WAT 3146 50.801 11.015 137.589 1.00 0.00 H ATOM 22263 H2 WAT 3146 51.457 10.204 136.492 1.00 0.00 H TER 22265 WAT 3146 ATOM 22265 O WAT 3147 142.265 41.819 104.578 1.00 0.00 O ATOM 22266 H1 WAT 3147 143.219 41.758 104.526 1.00 0.00 H ATOM 22267 H2 WAT 3147 142.103 42.633 105.056 1.00 0.00 H TER 22269 WAT 3147 ATOM 22269 O WAT 3148 23.937 125.671 120.352 1.00 0.00 O ATOM 22270 H1 WAT 3148 24.814 126.026 120.208 1.00 0.00 H ATOM 22271 H2 WAT 3148 23.417 126.423 120.636 1.00 0.00 H TER 22273 WAT 3148 ATOM 22273 O WAT 3149 111.074 142.514 157.854 1.00 0.00 O ATOM 22274 H1 WAT 3149 110.196 142.159 157.993 1.00 0.00 H ATOM 22275 H2 WAT 3149 111.577 142.212 158.610 1.00 0.00 H TER 22277 WAT 3149 ATOM 22277 O WAT 3150 144.052 134.081 9.119 1.00 0.00 O ATOM 22278 H1 WAT 3150 144.060 134.938 9.544 1.00 0.00 H ATOM 22279 H2 WAT 3150 143.441 134.182 8.389 1.00 0.00 H TER 22281 WAT 3150 ATOM 22281 O WAT 3151 98.335 94.867 18.131 1.00 0.00 O ATOM 22282 H1 WAT 3151 99.231 94.833 18.465 1.00 0.00 H ATOM 22283 H2 WAT 3151 98.095 93.950 17.996 1.00 0.00 H TER 22285 WAT 3151 ATOM 22285 O WAT 3152 49.623 38.611 62.530 1.00 0.00 O ATOM 22286 H1 WAT 3152 49.108 38.765 61.737 1.00 0.00 H ATOM 22287 H2 WAT 3152 50.224 39.355 62.573 1.00 0.00 H TER 22289 WAT 3152 ATOM 22289 O WAT 3153 129.849 66.202 104.667 1.00 0.00 O ATOM 22290 H1 WAT 3153 130.596 66.615 104.234 1.00 0.00 H ATOM 22291 H2 WAT 3153 130.199 65.382 105.017 1.00 0.00 H TER 22293 WAT 3153 ATOM 22293 O WAT 3154 72.896 100.958 131.416 1.00 0.00 O ATOM 22294 H1 WAT 3154 73.343 100.887 132.259 1.00 0.00 H ATOM 22295 H2 WAT 3154 72.503 101.831 131.426 1.00 0.00 H TER 22297 WAT 3154 ATOM 22297 O WAT 3155 96.224 31.083 125.676 1.00 0.00 O ATOM 22298 H1 WAT 3155 95.759 30.262 125.839 1.00 0.00 H ATOM 22299 H2 WAT 3155 95.703 31.524 125.005 1.00 0.00 H TER 22301 WAT 3155 ATOM 22301 O WAT 3156 48.357 33.327 109.565 1.00 0.00 O ATOM 22302 H1 WAT 3156 48.129 32.464 109.913 1.00 0.00 H ATOM 22303 H2 WAT 3156 47.550 33.640 109.155 1.00 0.00 H TER 22305 WAT 3156 ATOM 22305 O WAT 3157 14.625 31.907 135.303 1.00 0.00 O ATOM 22306 H1 WAT 3157 14.821 32.689 135.819 1.00 0.00 H ATOM 22307 H2 WAT 3157 14.330 32.245 134.458 1.00 0.00 H TER 22309 WAT 3157 ATOM 22309 O WAT 3158 99.621 124.293 61.826 1.00 0.00 O ATOM 22310 H1 WAT 3158 100.395 124.754 61.505 1.00 0.00 H ATOM 22311 H2 WAT 3158 99.853 123.366 61.769 1.00 0.00 H TER 22313 WAT 3158 ATOM 22313 O WAT 3159 61.208 45.476 80.196 1.00 0.00 O ATOM 22314 H1 WAT 3159 60.830 45.042 80.960 1.00 0.00 H ATOM 22315 H2 WAT 3159 60.452 45.811 79.713 1.00 0.00 H TER 22317 WAT 3159 ATOM 22317 O WAT 3160 68.172 144.902 128.981 1.00 0.00 O ATOM 22318 H1 WAT 3160 68.251 145.204 128.076 1.00 0.00 H ATOM 22319 H2 WAT 3160 68.430 145.659 129.508 1.00 0.00 H TER 22321 WAT 3160 ATOM 22321 O WAT 3161 86.511 66.450 150.975 1.00 0.00 O ATOM 22322 H1 WAT 3161 86.493 66.480 150.018 1.00 0.00 H ATOM 22323 H2 WAT 3161 87.073 65.703 151.180 1.00 0.00 H TER 22325 WAT 3161 ATOM 22325 O WAT 3162 117.907 82.194 147.263 1.00 0.00 O ATOM 22326 H1 WAT 3162 118.380 82.936 147.639 1.00 0.00 H ATOM 22327 H2 WAT 3162 118.376 81.995 146.453 1.00 0.00 H TER 22329 WAT 3162 ATOM 22329 O WAT 3163 123.277 135.363 6.475 1.00 0.00 O ATOM 22330 H1 WAT 3163 123.990 135.746 5.963 1.00 0.00 H ATOM 22331 H2 WAT 3163 122.990 134.609 5.960 1.00 0.00 H TER 22333 WAT 3163 ATOM 22333 O WAT 3164 26.175 144.366 123.518 1.00 0.00 O ATOM 22334 H1 WAT 3164 27.004 144.734 123.212 1.00 0.00 H ATOM 22335 H2 WAT 3164 26.408 143.867 124.301 1.00 0.00 H TER 22337 WAT 3164 ATOM 22337 O WAT 3165 30.773 131.351 128.860 1.00 0.00 O ATOM 22338 H1 WAT 3165 30.524 131.711 128.008 1.00 0.00 H ATOM 22339 H2 WAT 3165 29.959 131.345 129.364 1.00 0.00 H TER 22341 WAT 3165 ATOM 22341 O WAT 3166 86.687 71.414 76.305 1.00 0.00 O ATOM 22342 H1 WAT 3166 87.253 72.070 75.898 1.00 0.00 H ATOM 22343 H2 WAT 3166 86.782 70.640 75.750 1.00 0.00 H TER 22345 WAT 3166 ATOM 22345 O WAT 3167 82.959 144.069 111.980 1.00 0.00 O ATOM 22346 H1 WAT 3167 82.561 144.097 112.850 1.00 0.00 H ATOM 22347 H2 WAT 3167 83.847 144.401 112.113 1.00 0.00 H TER 22349 WAT 3167 ATOM 22349 O WAT 3168 94.448 90.646 157.282 1.00 0.00 O ATOM 22350 H1 WAT 3168 93.760 90.934 156.681 1.00 0.00 H ATOM 22351 H2 WAT 3168 93.986 90.136 157.947 1.00 0.00 H TER 22353 WAT 3168 ATOM 22353 O WAT 3169 120.717 45.763 71.203 1.00 0.00 O ATOM 22354 H1 WAT 3169 120.589 45.762 72.152 1.00 0.00 H ATOM 22355 H2 WAT 3169 119.908 45.390 70.853 1.00 0.00 H TER 22357 WAT 3169 ATOM 22357 O WAT 3170 101.284 77.685 93.461 1.00 0.00 O ATOM 22358 H1 WAT 3170 101.515 77.821 92.543 1.00 0.00 H ATOM 22359 H2 WAT 3170 100.345 77.868 93.502 1.00 0.00 H TER 22361 WAT 3170 ATOM 22361 O WAT 3171 81.047 13.404 109.883 1.00 0.00 O ATOM 22362 H1 WAT 3171 80.510 12.847 109.318 1.00 0.00 H ATOM 22363 H2 WAT 3171 81.901 12.973 109.900 1.00 0.00 H TER 22365 WAT 3171 ATOM 22365 O WAT 3172 77.053 115.257 84.444 1.00 0.00 O ATOM 22366 H1 WAT 3172 76.737 114.927 85.285 1.00 0.00 H ATOM 22367 H2 WAT 3172 77.249 114.469 83.936 1.00 0.00 H TER 22369 WAT 3172 ATOM 22369 O WAT 3173 141.852 73.933 61.144 1.00 0.00 O ATOM 22370 H1 WAT 3173 141.706 73.510 60.297 1.00 0.00 H ATOM 22371 H2 WAT 3173 140.989 73.939 61.559 1.00 0.00 H TER 22373 WAT 3173 ATOM 22373 O WAT 3174 31.372 103.518 69.975 1.00 0.00 O ATOM 22374 H1 WAT 3174 32.222 103.282 70.346 1.00 0.00 H ATOM 22375 H2 WAT 3174 30.820 102.752 70.132 1.00 0.00 H TER 22377 WAT 3174 ATOM 22377 O WAT 3175 63.538 123.382 66.190 1.00 0.00 O ATOM 22378 H1 WAT 3175 63.447 123.190 65.257 1.00 0.00 H ATOM 22379 H2 WAT 3175 62.672 123.207 66.557 1.00 0.00 H TER 22381 WAT 3175 ATOM 22381 O WAT 3176 114.395 64.694 16.869 1.00 0.00 O ATOM 22382 H1 WAT 3176 115.113 65.079 16.368 1.00 0.00 H ATOM 22383 H2 WAT 3176 114.507 63.750 16.762 1.00 0.00 H TER 22385 WAT 3176 ATOM 22385 O WAT 3177 91.076 75.179 154.025 1.00 0.00 O ATOM 22386 H1 WAT 3177 91.399 74.381 154.443 1.00 0.00 H ATOM 22387 H2 WAT 3177 90.626 74.872 153.238 1.00 0.00 H TER 22389 WAT 3177 ATOM 22389 O WAT 3178 17.245 143.392 113.826 1.00 0.00 O ATOM 22390 H1 WAT 3178 16.688 143.518 114.594 1.00 0.00 H ATOM 22391 H2 WAT 3178 17.011 144.112 113.240 1.00 0.00 H TER 22393 WAT 3178 ATOM 22393 O WAT 3179 47.455 142.421 73.197 1.00 0.00 O ATOM 22394 H1 WAT 3179 47.578 142.181 74.115 1.00 0.00 H ATOM 22395 H2 WAT 3179 48.118 143.092 73.034 1.00 0.00 H TER 22397 WAT 3179 ATOM 22397 O WAT 3180 15.008 94.150 128.282 1.00 0.00 O ATOM 22398 H1 WAT 3180 14.833 93.457 128.919 1.00 0.00 H ATOM 22399 H2 WAT 3180 14.726 93.783 127.444 1.00 0.00 H TER 22401 WAT 3180 ATOM 22401 O WAT 3181 108.615 11.053 100.928 1.00 0.00 O ATOM 22402 H1 WAT 3181 108.211 10.644 100.163 1.00 0.00 H ATOM 22403 H2 WAT 3181 109.543 11.119 100.702 1.00 0.00 H TER 22405 WAT 3181 ATOM 22405 O WAT 3182 138.910 126.122 155.325 1.00 0.00 O ATOM 22406 H1 WAT 3182 139.476 125.406 155.039 1.00 0.00 H ATOM 22407 H2 WAT 3182 138.446 126.392 154.533 1.00 0.00 H TER 22409 WAT 3182 ATOM 22409 O WAT 3183 127.265 17.900 12.947 1.00 0.00 O ATOM 22410 H1 WAT 3183 128.133 17.677 12.611 1.00 0.00 H ATOM 22411 H2 WAT 3183 126.990 17.123 13.434 1.00 0.00 H TER 22413 WAT 3183 ATOM 22413 O WAT 3184 113.341 144.762 113.747 1.00 0.00 O ATOM 22414 H1 WAT 3184 112.596 144.171 113.862 1.00 0.00 H ATOM 22415 H2 WAT 3184 114.093 144.180 113.638 1.00 0.00 H TER 22417 WAT 3184 ATOM 22417 O WAT 3185 12.710 113.486 61.054 1.00 0.00 O ATOM 22418 H1 WAT 3185 12.575 112.938 61.827 1.00 0.00 H ATOM 22419 H2 WAT 3185 12.854 112.863 60.342 1.00 0.00 H TER 22421 WAT 3185 ATOM 22421 O WAT 3186 142.904 22.244 117.142 1.00 0.00 O ATOM 22422 H1 WAT 3186 143.458 22.959 116.828 1.00 0.00 H ATOM 22423 H2 WAT 3186 143.490 21.700 117.668 1.00 0.00 H TER 22425 WAT 3186 ATOM 22425 O WAT 3187 13.250 59.048 130.154 1.00 0.00 O ATOM 22426 H1 WAT 3187 12.643 59.470 130.762 1.00 0.00 H ATOM 22427 H2 WAT 3187 12.686 58.581 129.538 1.00 0.00 H TER 22429 WAT 3187 ATOM 22429 O WAT 3188 113.020 0.402 97.385 1.00 0.00 O ATOM 22430 H1 WAT 3188 112.848 1.248 97.799 1.00 0.00 H ATOM 22431 H2 WAT 3188 112.841 0.549 96.456 1.00 0.00 H TER 22433 WAT 3188 ATOM 22433 O WAT 3189 6.460 49.330 16.612 1.00 0.00 O ATOM 22434 H1 WAT 3189 6.786 50.222 16.492 1.00 0.00 H ATOM 22435 H2 WAT 3189 5.558 49.443 16.912 1.00 0.00 H TER 22437 WAT 3189 ATOM 22437 O WAT 3190 4.514 79.797 97.489 1.00 0.00 O ATOM 22438 H1 WAT 3190 4.994 79.103 97.942 1.00 0.00 H ATOM 22439 H2 WAT 3190 4.177 79.377 96.698 1.00 0.00 H TER 22441 WAT 3190 ATOM 22441 O WAT 3191 6.147 35.456 11.808 1.00 0.00 O ATOM 22442 H1 WAT 3191 6.277 36.056 11.074 1.00 0.00 H ATOM 22443 H2 WAT 3191 5.438 35.849 12.317 1.00 0.00 H TER 22445 WAT 3191 ATOM 22445 O WAT 3192 103.236 94.196 66.707 1.00 0.00 O ATOM 22446 H1 WAT 3192 103.601 94.369 65.839 1.00 0.00 H ATOM 22447 H2 WAT 3192 103.420 93.270 66.864 1.00 0.00 H TER 22449 WAT 3192 ATOM 22449 O WAT 3193 53.632 120.225 69.104 1.00 0.00 O ATOM 22450 H1 WAT 3193 52.912 119.607 69.228 1.00 0.00 H ATOM 22451 H2 WAT 3193 53.953 120.044 68.220 1.00 0.00 H TER 22453 WAT 3193 ATOM 22453 O WAT 3194 97.268 115.382 3.309 1.00 0.00 O ATOM 22454 H1 WAT 3194 97.548 115.931 4.041 1.00 0.00 H ATOM 22455 H2 WAT 3194 98.074 114.966 3.000 1.00 0.00 H TER 22457 WAT 3194 ATOM 22457 O WAT 3195 88.198 27.608 92.003 1.00 0.00 O ATOM 22458 H1 WAT 3195 88.891 27.214 91.473 1.00 0.00 H ATOM 22459 H2 WAT 3195 87.386 27.349 91.567 1.00 0.00 H TER 22461 WAT 3195 ATOM 22461 O WAT 3196 130.698 108.189 147.964 1.00 0.00 O ATOM 22462 H1 WAT 3196 130.928 107.753 148.785 1.00 0.00 H ATOM 22463 H2 WAT 3196 131.254 108.968 147.943 1.00 0.00 H TER 22465 WAT 3196 ATOM 22465 O WAT 3197 116.365 78.631 124.911 1.00 0.00 O ATOM 22466 H1 WAT 3197 115.867 78.914 124.144 1.00 0.00 H ATOM 22467 H2 WAT 3197 115.792 78.003 125.351 1.00 0.00 H TER 22469 WAT 3197 ATOM 22469 O WAT 3198 140.772 110.600 114.293 1.00 0.00 O ATOM 22470 H1 WAT 3198 139.853 110.335 114.280 1.00 0.00 H ATOM 22471 H2 WAT 3198 140.878 111.055 115.129 1.00 0.00 H TER 22473 WAT 3198 ATOM 22473 O WAT 3199 16.381 51.485 153.536 1.00 0.00 O ATOM 22474 H1 WAT 3199 15.977 52.325 153.753 1.00 0.00 H ATOM 22475 H2 WAT 3199 16.135 51.329 152.624 1.00 0.00 H TER 22477 WAT 3199 ATOM 22477 O WAT 3200 31.240 72.039 62.429 1.00 0.00 O ATOM 22478 H1 WAT 3200 30.644 72.372 61.758 1.00 0.00 H ATOM 22479 H2 WAT 3200 31.220 71.089 62.317 1.00 0.00 H TER 22481 WAT 3200 ATOM 22481 O WAT 3201 2.677 96.428 74.040 1.00 0.00 O ATOM 22482 H1 WAT 3201 2.498 96.950 73.258 1.00 0.00 H ATOM 22483 H2 WAT 3201 3.047 97.052 74.665 1.00 0.00 H TER 22485 WAT 3201 ATOM 22485 O WAT 3202 81.254 4.669 72.258 1.00 0.00 O ATOM 22486 H1 WAT 3202 81.461 3.916 72.811 1.00 0.00 H ATOM 22487 H2 WAT 3202 80.862 4.288 71.472 1.00 0.00 H TER 22489 WAT 3202 ATOM 22489 O WAT 3203 84.492 33.233 -0.181 1.00 0.00 O ATOM 22490 H1 WAT 3203 85.249 32.650 -0.243 1.00 0.00 H ATOM 22491 H2 WAT 3203 84.086 33.010 0.656 1.00 0.00 H TER 22493 WAT 3203 ATOM 22493 O WAT 3204 28.632 11.619 132.514 1.00 0.00 O ATOM 22494 H1 WAT 3204 27.776 11.978 132.281 1.00 0.00 H ATOM 22495 H2 WAT 3204 29.260 12.199 132.084 1.00 0.00 H TER 22497 WAT 3204 ATOM 22497 O WAT 3205 31.723 95.885 11.687 1.00 0.00 O ATOM 22498 H1 WAT 3205 32.419 95.280 11.431 1.00 0.00 H ATOM 22499 H2 WAT 3205 32.183 96.627 12.080 1.00 0.00 H TER 22501 WAT 3205 ATOM 22501 O WAT 3206 4.591 31.012 1.582 1.00 0.00 O ATOM 22502 H1 WAT 3206 4.466 30.163 1.157 1.00 0.00 H ATOM 22503 H2 WAT 3206 5.327 30.875 2.178 1.00 0.00 H TER 22505 WAT 3206 ATOM 22505 O WAT 3207 36.717 37.768 103.741 1.00 0.00 O ATOM 22506 H1 WAT 3207 37.635 37.891 103.499 1.00 0.00 H ATOM 22507 H2 WAT 3207 36.362 37.202 103.055 1.00 0.00 H TER 22509 WAT 3207 ATOM 22509 O WAT 3208 118.166 120.968 2.558 1.00 0.00 O ATOM 22510 H1 WAT 3208 117.291 120.776 2.219 1.00 0.00 H ATOM 22511 H2 WAT 3208 118.722 121.000 1.779 1.00 0.00 H TER 22513 WAT 3208 ATOM 22513 O WAT 3209 16.122 9.652 1.814 1.00 0.00 O ATOM 22514 H1 WAT 3209 15.810 8.967 2.406 1.00 0.00 H ATOM 22515 H2 WAT 3209 16.654 9.186 1.168 1.00 0.00 H TER 22517 WAT 3209 ATOM 22517 O WAT 3210 12.481 128.511 55.528 1.00 0.00 O ATOM 22518 H1 WAT 3210 12.554 129.400 55.179 1.00 0.00 H ATOM 22519 H2 WAT 3210 11.556 128.288 55.424 1.00 0.00 H TER 22521 WAT 3210 ATOM 22521 O WAT 3211 3.557 143.583 13.572 1.00 0.00 O ATOM 22522 H1 WAT 3211 2.924 143.299 14.232 1.00 0.00 H ATOM 22523 H2 WAT 3211 3.609 144.532 13.684 1.00 0.00 H TER 22525 WAT 3211 ATOM 22525 O WAT 3212 67.859 50.560 0.529 1.00 0.00 O ATOM 22526 H1 WAT 3212 67.708 51.499 0.639 1.00 0.00 H ATOM 22527 H2 WAT 3212 67.274 50.305 -0.184 1.00 0.00 H TER 22529 WAT 3212 ATOM 22529 O WAT 3213 132.517 57.052 128.101 1.00 0.00 O ATOM 22530 H1 WAT 3213 132.964 57.635 128.715 1.00 0.00 H ATOM 22531 H2 WAT 3213 132.999 57.153 127.280 1.00 0.00 H TER 22533 WAT 3213 ATOM 22533 O WAT 3214 13.524 120.043 8.706 1.00 0.00 O ATOM 22534 H1 WAT 3214 13.240 119.767 7.835 1.00 0.00 H ATOM 22535 H2 WAT 3214 12.803 119.793 9.284 1.00 0.00 H TER 22537 WAT 3214 ATOM 22537 O WAT 3215 71.219 145.584 12.948 1.00 0.00 O ATOM 22538 H1 WAT 3215 71.467 145.243 13.808 1.00 0.00 H ATOM 22539 H2 WAT 3215 70.839 144.833 12.493 1.00 0.00 H TER 22541 WAT 3215 ATOM 22541 O WAT 3216 51.470 10.668 119.997 1.00 0.00 O ATOM 22542 H1 WAT 3216 52.384 10.524 119.752 1.00 0.00 H ATOM 22543 H2 WAT 3216 51.431 11.593 120.238 1.00 0.00 H TER 22545 WAT 3216 ATOM 22545 O WAT 3217 7.964 33.679 59.921 1.00 0.00 O ATOM 22546 H1 WAT 3217 8.341 33.861 59.060 1.00 0.00 H ATOM 22547 H2 WAT 3217 7.106 34.102 59.900 1.00 0.00 H TER 22549 WAT 3217 ATOM 22549 O WAT 3218 141.415 24.423 144.882 1.00 0.00 O ATOM 22550 H1 WAT 3218 142.120 24.974 144.544 1.00 0.00 H ATOM 22551 H2 WAT 3218 140.680 24.582 144.290 1.00 0.00 H TER 22553 WAT 3218 ATOM 22553 O WAT 3219 117.756 2.002 7.597 1.00 0.00 O ATOM 22554 H1 WAT 3219 117.079 2.678 7.629 1.00 0.00 H ATOM 22555 H2 WAT 3219 118.139 2.005 8.474 1.00 0.00 H TER 22557 WAT 3219 ATOM 22557 O WAT 3220 101.336 134.292 8.368 1.00 0.00 O ATOM 22558 H1 WAT 3220 100.855 135.028 8.746 1.00 0.00 H ATOM 22559 H2 WAT 3220 102.081 134.166 8.956 1.00 0.00 H TER 22561 WAT 3220 ATOM 22561 O WAT 3221 122.223 78.382 66.208 1.00 0.00 O ATOM 22562 H1 WAT 3221 122.740 78.665 65.453 1.00 0.00 H ATOM 22563 H2 WAT 3221 122.588 77.529 66.442 1.00 0.00 H TER 22565 WAT 3221 ATOM 22565 O WAT 3222 33.383 92.964 28.675 1.00 0.00 O ATOM 22566 H1 WAT 3222 33.637 92.048 28.565 1.00 0.00 H ATOM 22567 H2 WAT 3222 33.597 93.375 27.837 1.00 0.00 H TER 22569 WAT 3222 ATOM 22569 O WAT 3223 85.362 123.932 8.333 1.00 0.00 O ATOM 22570 H1 WAT 3223 84.499 124.081 8.721 1.00 0.00 H ATOM 22571 H2 WAT 3223 85.956 123.887 9.082 1.00 0.00 H TER 22573 WAT 3223 ATOM 22573 O WAT 3224 121.697 22.279 18.652 1.00 0.00 O ATOM 22574 H1 WAT 3224 121.545 23.223 18.709 1.00 0.00 H ATOM 22575 H2 WAT 3224 122.625 22.173 18.861 1.00 0.00 H TER 22577 WAT 3224 ATOM 22577 O WAT 3225 32.419 109.733 0.193 1.00 0.00 O ATOM 22578 H1 WAT 3225 33.244 109.560 0.647 1.00 0.00 H ATOM 22579 H2 WAT 3225 32.313 108.992 -0.403 1.00 0.00 H TER 22581 WAT 3225 ATOM 22581 O WAT 3226 120.975 2.058 85.293 1.00 0.00 O ATOM 22582 H1 WAT 3226 121.930 2.091 85.357 1.00 0.00 H ATOM 22583 H2 WAT 3226 120.804 1.841 84.376 1.00 0.00 H TER 22585 WAT 3226 ATOM 22585 O WAT 3227 90.691 96.793 78.355 1.00 0.00 O ATOM 22586 H1 WAT 3227 91.092 97.478 77.821 1.00 0.00 H ATOM 22587 H2 WAT 3227 90.775 97.109 79.254 1.00 0.00 H TER 22589 WAT 3227 ATOM 22589 O WAT 3228 125.006 57.490 115.231 1.00 0.00 O ATOM 22590 H1 WAT 3228 124.936 57.205 114.320 1.00 0.00 H ATOM 22591 H2 WAT 3228 125.555 58.273 115.196 1.00 0.00 H TER 22593 WAT 3228 ATOM 22593 O WAT 3229 63.793 31.489 104.950 1.00 0.00 O ATOM 22594 H1 WAT 3229 63.468 30.971 105.686 1.00 0.00 H ATOM 22595 H2 WAT 3229 64.738 31.339 104.951 1.00 0.00 H TER 22597 WAT 3229 ATOM 22597 O WAT 3230 109.770 31.478 143.963 1.00 0.00 O ATOM 22598 H1 WAT 3230 109.808 30.810 144.647 1.00 0.00 H ATOM 22599 H2 WAT 3230 109.236 31.085 143.273 1.00 0.00 H TER 22601 WAT 3230 ATOM 22601 O WAT 3231 66.403 55.581 126.401 1.00 0.00 O ATOM 22602 H1 WAT 3231 65.486 55.378 126.217 1.00 0.00 H ATOM 22603 H2 WAT 3231 66.848 55.466 125.562 1.00 0.00 H TER 22605 WAT 3231 ATOM 22605 O WAT 3232 53.695 39.597 112.090 1.00 0.00 O ATOM 22606 H1 WAT 3232 54.432 38.986 112.100 1.00 0.00 H ATOM 22607 H2 WAT 3232 53.958 40.278 111.471 1.00 0.00 H TER 22609 WAT 3232 ATOM 22609 O WAT 3233 43.935 44.699 157.227 1.00 0.00 O ATOM 22610 H1 WAT 3233 43.231 44.395 156.654 1.00 0.00 H ATOM 22611 H2 WAT 3233 43.919 45.652 157.139 1.00 0.00 H TER 22613 WAT 3233 ATOM 22613 O WAT 3234 34.770 114.207 64.942 1.00 0.00 O ATOM 22614 H1 WAT 3234 34.494 113.302 64.794 1.00 0.00 H ATOM 22615 H2 WAT 3234 35.702 114.141 65.150 1.00 0.00 H TER 22617 WAT 3234 ATOM 22617 O WAT 3235 0.979 132.430 133.151 1.00 0.00 O ATOM 22618 H1 WAT 3235 1.442 132.886 133.854 1.00 0.00 H ATOM 22619 H2 WAT 3235 1.572 132.481 132.401 1.00 0.00 H TER 22621 WAT 3235 ATOM 22621 O WAT 3236 36.347 21.613 90.968 1.00 0.00 O ATOM 22622 H1 WAT 3236 37.118 21.297 91.439 1.00 0.00 H ATOM 22623 H2 WAT 3236 36.036 20.851 90.479 1.00 0.00 H TER 22625 WAT 3236 ATOM 22625 O WAT 3237 2.073 56.648 133.472 1.00 0.00 O ATOM 22626 H1 WAT 3237 2.504 57.343 132.975 1.00 0.00 H ATOM 22627 H2 WAT 3237 1.671 56.091 132.806 1.00 0.00 H TER 22629 WAT 3237 ATOM 22629 O WAT 3238 92.606 89.134 121.012 1.00 0.00 O ATOM 22630 H1 WAT 3238 92.065 89.113 120.222 1.00 0.00 H ATOM 22631 H2 WAT 3238 92.126 89.701 121.616 1.00 0.00 H TER 22633 WAT 3238 ATOM 22633 O WAT 3239 110.598 20.307 65.444 1.00 0.00 O ATOM 22634 H1 WAT 3239 111.476 20.039 65.173 1.00 0.00 H ATOM 22635 H2 WAT 3239 110.525 21.217 65.156 1.00 0.00 H TER 22637 WAT 3239 ATOM 22637 O WAT 3240 84.039 96.146 99.362 1.00 0.00 O ATOM 22638 H1 WAT 3240 83.648 95.884 100.195 1.00 0.00 H ATOM 22639 H2 WAT 3240 83.544 95.660 98.702 1.00 0.00 H TER 22641 WAT 3240 ATOM 22641 O WAT 3241 62.532 122.565 94.764 1.00 0.00 O ATOM 22642 H1 WAT 3241 63.143 122.498 95.498 1.00 0.00 H ATOM 22643 H2 WAT 3241 61.669 122.618 95.175 1.00 0.00 H TER 22645 WAT 3241 ATOM 22645 O WAT 3242 145.372 95.069 154.129 1.00 0.00 O ATOM 22646 H1 WAT 3242 145.687 95.971 154.180 1.00 0.00 H ATOM 22647 H2 WAT 3242 145.568 94.797 153.233 1.00 0.00 H TER 22649 WAT 3242 ATOM 22649 O WAT 3243 57.991 17.715 78.573 1.00 0.00 O ATOM 22650 H1 WAT 3243 57.611 18.587 78.684 1.00 0.00 H ATOM 22651 H2 WAT 3243 58.023 17.353 79.458 1.00 0.00 H TER 22653 WAT 3243 ATOM 22653 O WAT 3244 135.998 109.160 8.691 1.00 0.00 O ATOM 22654 H1 WAT 3244 136.338 108.271 8.801 1.00 0.00 H ATOM 22655 H2 WAT 3244 135.098 109.114 9.013 1.00 0.00 H TER 22657 WAT 3244 ATOM 22657 O WAT 3245 38.936 38.742 14.627 1.00 0.00 O ATOM 22658 H1 WAT 3245 38.693 37.893 14.995 1.00 0.00 H ATOM 22659 H2 WAT 3245 39.578 39.094 15.243 1.00 0.00 H TER 22661 WAT 3245 ATOM 22661 O WAT 3246 133.580 106.815 95.839 1.00 0.00 O ATOM 22662 H1 WAT 3246 133.453 106.705 94.897 1.00 0.00 H ATOM 22663 H2 WAT 3246 134.042 106.022 96.112 1.00 0.00 H TER 22665 WAT 3246 ATOM 22665 O WAT 3247 91.344 64.924 102.930 1.00 0.00 O ATOM 22666 H1 WAT 3247 91.402 64.049 103.314 1.00 0.00 H ATOM 22667 H2 WAT 3247 92.045 64.947 102.279 1.00 0.00 H TER 22669 WAT 3247 ATOM 22669 O WAT 3248 101.656 130.430 139.776 1.00 0.00 O ATOM 22670 H1 WAT 3248 101.615 130.501 138.823 1.00 0.00 H ATOM 22671 H2 WAT 3248 102.093 131.234 140.057 1.00 0.00 H TER 22673 WAT 3248 ATOM 22673 O WAT 3249 118.587 98.135 130.231 1.00 0.00 O ATOM 22674 H1 WAT 3249 119.008 98.785 129.668 1.00 0.00 H ATOM 22675 H2 WAT 3249 119.051 97.319 130.044 1.00 0.00 H TER 22677 WAT 3249 ATOM 22677 O WAT 3250 65.804 68.887 108.643 1.00 0.00 O ATOM 22678 H1 WAT 3250 65.855 68.883 109.599 1.00 0.00 H ATOM 22679 H2 WAT 3250 65.148 68.221 108.436 1.00 0.00 H TER 22681 WAT 3250 ATOM 22681 O WAT 3251 120.606 9.671 74.677 1.00 0.00 O ATOM 22682 H1 WAT 3251 121.213 8.985 74.399 1.00 0.00 H ATOM 22683 H2 WAT 3251 120.237 10.010 73.862 1.00 0.00 H TER 22685 WAT 3251 ATOM 22685 O WAT 3252 71.111 4.321 55.745 1.00 0.00 O ATOM 22686 H1 WAT 3252 71.808 4.864 56.113 1.00 0.00 H ATOM 22687 H2 WAT 3252 70.305 4.794 55.951 1.00 0.00 H TER 22689 WAT 3252 ATOM 22689 O WAT 3253 80.974 113.298 5.225 1.00 0.00 O ATOM 22690 H1 WAT 3253 81.789 113.673 5.560 1.00 0.00 H ATOM 22691 H2 WAT 3253 80.652 113.946 4.599 1.00 0.00 H TER 22693 WAT 3253 ATOM 22693 O WAT 3254 16.220 61.242 83.564 1.00 0.00 O ATOM 22694 H1 WAT 3254 15.534 61.811 83.913 1.00 0.00 H ATOM 22695 H2 WAT 3254 16.949 61.834 83.377 1.00 0.00 H TER 22697 WAT 3254 ATOM 22697 O WAT 3255 35.170 135.870 110.861 1.00 0.00 O ATOM 22698 H1 WAT 3255 34.325 136.121 111.233 1.00 0.00 H ATOM 22699 H2 WAT 3255 35.484 135.167 111.430 1.00 0.00 H TER 22701 WAT 3255 ATOM 22701 O WAT 3256 36.244 59.559 106.251 1.00 0.00 O ATOM 22702 H1 WAT 3256 36.104 59.954 105.391 1.00 0.00 H ATOM 22703 H2 WAT 3256 36.576 60.275 106.793 1.00 0.00 H TER 22705 WAT 3256 ATOM 22705 O WAT 3257 120.483 31.828 124.041 1.00 0.00 O ATOM 22706 H1 WAT 3257 120.593 32.002 124.975 1.00 0.00 H ATOM 22707 H2 WAT 3257 120.157 30.929 124.000 1.00 0.00 H TER 22709 WAT 3257 ATOM 22709 O WAT 3258 140.860 90.240 152.964 1.00 0.00 O ATOM 22710 H1 WAT 3258 140.375 90.829 152.385 1.00 0.00 H ATOM 22711 H2 WAT 3258 140.186 89.825 153.503 1.00 0.00 H TER 22713 WAT 3258 ATOM 22713 O WAT 3259 118.945 22.603 56.270 1.00 0.00 O ATOM 22714 H1 WAT 3259 118.010 22.806 56.267 1.00 0.00 H ATOM 22715 H2 WAT 3259 119.267 22.944 55.435 1.00 0.00 H TER 22717 WAT 3259 ATOM 22717 O WAT 3260 9.704 5.988 73.869 1.00 0.00 O ATOM 22718 H1 WAT 3260 10.315 6.218 73.169 1.00 0.00 H ATOM 22719 H2 WAT 3260 8.931 6.526 73.698 1.00 0.00 H TER 22721 WAT 3260 ATOM 22721 O WAT 3261 69.109 32.090 116.753 1.00 0.00 O ATOM 22722 H1 WAT 3261 68.213 32.397 116.615 1.00 0.00 H ATOM 22723 H2 WAT 3261 69.543 32.233 115.912 1.00 0.00 H TER 22725 WAT 3261 ATOM 22725 O WAT 3262 144.187 12.536 127.772 1.00 0.00 O ATOM 22726 H1 WAT 3262 144.032 11.689 127.355 1.00 0.00 H ATOM 22727 H2 WAT 3262 144.930 12.905 127.295 1.00 0.00 H TER 22729 WAT 3262 ATOM 22729 O WAT 3263 16.128 105.723 147.127 1.00 0.00 O ATOM 22730 H1 WAT 3263 17.082 105.666 147.067 1.00 0.00 H ATOM 22731 H2 WAT 3263 15.969 106.441 147.740 1.00 0.00 H TER 22733 WAT 3263 ATOM 22733 O WAT 3264 8.686 52.881 138.700 1.00 0.00 O ATOM 22734 H1 WAT 3264 8.870 51.959 138.882 1.00 0.00 H ATOM 22735 H2 WAT 3264 8.215 53.189 139.474 1.00 0.00 H TER 22737 WAT 3264 ATOM 22737 O WAT 3265 85.934 143.402 87.947 1.00 0.00 O ATOM 22738 H1 WAT 3265 85.407 143.057 88.668 1.00 0.00 H ATOM 22739 H2 WAT 3265 86.397 144.150 88.325 1.00 0.00 H TER 22741 WAT 3265 ATOM 22741 O WAT 3266 107.382 136.192 119.596 1.00 0.00 O ATOM 22742 H1 WAT 3266 107.268 137.083 119.926 1.00 0.00 H ATOM 22743 H2 WAT 3266 108.264 136.186 119.224 1.00 0.00 H TER 22745 WAT 3266 ATOM 22745 O WAT 3267 121.365 32.046 134.809 1.00 0.00 O ATOM 22746 H1 WAT 3267 121.894 32.468 134.132 1.00 0.00 H ATOM 22747 H2 WAT 3267 120.772 31.470 134.325 1.00 0.00 H TER 22749 WAT 3267 ATOM 22749 O WAT 3268 136.278 124.099 117.830 1.00 0.00 O ATOM 22750 H1 WAT 3268 135.884 123.227 117.790 1.00 0.00 H ATOM 22751 H2 WAT 3268 135.595 124.686 117.507 1.00 0.00 H TER 22753 WAT 3268 ATOM 22753 O WAT 3269 132.425 121.622 65.314 1.00 0.00 O ATOM 22754 H1 WAT 3269 133.110 122.118 64.866 1.00 0.00 H ATOM 22755 H2 WAT 3269 131.723 122.258 65.455 1.00 0.00 H TER 22757 WAT 3269 ATOM 22757 O WAT 3270 110.512 127.605 127.209 1.00 0.00 O ATOM 22758 H1 WAT 3270 110.066 126.758 127.225 1.00 0.00 H ATOM 22759 H2 WAT 3270 110.760 127.762 128.120 1.00 0.00 H TER 22761 WAT 3270 ATOM 22761 O WAT 3271 75.940 44.904 8.878 1.00 0.00 O ATOM 22762 H1 WAT 3271 75.532 44.651 9.706 1.00 0.00 H ATOM 22763 H2 WAT 3271 75.851 45.856 8.847 1.00 0.00 H TER 22765 WAT 3271 ATOM 22765 O WAT 3272 76.205 81.648 86.364 1.00 0.00 O ATOM 22766 H1 WAT 3272 76.723 81.069 86.923 1.00 0.00 H ATOM 22767 H2 WAT 3272 76.450 82.531 86.641 1.00 0.00 H TER 22769 WAT 3272 ATOM 22769 O WAT 3273 60.960 30.928 147.066 1.00 0.00 O ATOM 22770 H1 WAT 3273 61.018 30.577 147.954 1.00 0.00 H ATOM 22771 H2 WAT 3273 61.166 30.183 146.501 1.00 0.00 H TER 22773 WAT 3273 ATOM 22773 O WAT 3274 29.405 79.649 146.197 1.00 0.00 O ATOM 22774 H1 WAT 3274 29.989 78.908 146.039 1.00 0.00 H ATOM 22775 H2 WAT 3274 29.314 79.683 147.149 1.00 0.00 H TER 22777 WAT 3274 ATOM 22777 O WAT 3275 108.328 119.110 128.996 1.00 0.00 O ATOM 22778 H1 WAT 3275 107.752 118.617 129.580 1.00 0.00 H ATOM 22779 H2 WAT 3275 108.508 118.508 128.273 1.00 0.00 H TER 22781 WAT 3275 ATOM 22781 O WAT 3276 3.370 93.341 151.824 1.00 0.00 O ATOM 22782 H1 WAT 3276 3.377 94.296 151.893 1.00 0.00 H ATOM 22783 H2 WAT 3276 2.464 93.094 152.012 1.00 0.00 H TER 22785 WAT 3276 ATOM 22785 O WAT 3277 57.457 40.074 109.239 1.00 0.00 O ATOM 22786 H1 WAT 3277 58.384 39.984 109.020 1.00 0.00 H ATOM 22787 H2 WAT 3277 57.312 41.019 109.283 1.00 0.00 H TER 22789 WAT 3277 ATOM 22789 O WAT 3278 88.068 19.784 126.743 1.00 0.00 O ATOM 22790 H1 WAT 3278 88.787 20.134 127.270 1.00 0.00 H ATOM 22791 H2 WAT 3278 88.458 19.621 125.884 1.00 0.00 H TER 22793 WAT 3278 ATOM 22793 O WAT 3279 100.976 133.459 137.875 1.00 0.00 O ATOM 22794 H1 WAT 3279 101.068 132.509 137.808 1.00 0.00 H ATOM 22795 H2 WAT 3279 101.873 133.782 137.957 1.00 0.00 H TER 22797 WAT 3279 ATOM 22797 O WAT 3280 134.058 105.215 158.761 1.00 0.00 O ATOM 22798 H1 WAT 3280 133.747 104.310 158.729 1.00 0.00 H ATOM 22799 H2 WAT 3280 133.594 105.653 158.048 1.00 0.00 H TER 22801 WAT 3280 ATOM 22801 O WAT 3281 25.497 53.832 63.758 1.00 0.00 O ATOM 22802 H1 WAT 3281 25.659 53.108 63.153 1.00 0.00 H ATOM 22803 H2 WAT 3281 26.344 53.990 64.175 1.00 0.00 H TER 22805 WAT 3281 ATOM 22805 O WAT 3282 119.357 64.749 60.678 1.00 0.00 O ATOM 22806 H1 WAT 3282 119.060 63.856 60.852 1.00 0.00 H ATOM 22807 H2 WAT 3282 118.606 65.299 60.902 1.00 0.00 H TER 22809 WAT 3282 ATOM 22809 O WAT 3283 109.177 125.399 11.888 1.00 0.00 O ATOM 22810 H1 WAT 3283 108.786 124.661 11.420 1.00 0.00 H ATOM 22811 H2 WAT 3283 108.460 126.024 11.991 1.00 0.00 H TER 22813 WAT 3283 ATOM 22813 O WAT 3284 67.914 76.152 153.003 1.00 0.00 O ATOM 22814 H1 WAT 3284 68.494 75.487 153.373 1.00 0.00 H ATOM 22815 H2 WAT 3284 67.822 75.905 152.083 1.00 0.00 H TER 22817 WAT 3284 ATOM 22817 O WAT 3285 74.958 129.524 111.729 1.00 0.00 O ATOM 22818 H1 WAT 3285 74.841 130.211 112.386 1.00 0.00 H ATOM 22819 H2 WAT 3285 74.359 129.765 111.022 1.00 0.00 H TER 22821 WAT 3285 ATOM 22821 O WAT 3286 15.189 13.944 5.511 1.00 0.00 O ATOM 22822 H1 WAT 3286 14.675 13.216 5.861 1.00 0.00 H ATOM 22823 H2 WAT 3286 14.726 14.204 4.715 1.00 0.00 H TER 22825 WAT 3286 ATOM 22825 O WAT 3287 86.551 67.976 132.290 1.00 0.00 O ATOM 22826 H1 WAT 3287 85.935 68.709 132.307 1.00 0.00 H ATOM 22827 H2 WAT 3287 85.997 67.199 132.224 1.00 0.00 H TER 22829 WAT 3287 ATOM 22829 O WAT 3288 51.867 129.597 113.821 1.00 0.00 O ATOM 22830 H1 WAT 3288 51.266 130.233 114.209 1.00 0.00 H ATOM 22831 H2 WAT 3288 51.346 128.798 113.733 1.00 0.00 H TER 22833 WAT 3288 ATOM 22833 O WAT 3289 15.538 115.764 144.315 1.00 0.00 O ATOM 22834 H1 WAT 3289 15.482 116.720 144.326 1.00 0.00 H ATOM 22835 H2 WAT 3289 14.847 115.491 143.712 1.00 0.00 H TER 22837 WAT 3289 ATOM 22837 O WAT 3290 77.422 43.472 94.386 1.00 0.00 O ATOM 22838 H1 WAT 3290 76.643 42.950 94.193 1.00 0.00 H ATOM 22839 H2 WAT 3290 77.987 42.883 94.886 1.00 0.00 H TER 22841 WAT 3290 ATOM 22841 O WAT 3291 85.079 23.963 10.154 1.00 0.00 O ATOM 22842 H1 WAT 3291 85.829 24.533 10.320 1.00 0.00 H ATOM 22843 H2 WAT 3291 84.334 24.559 10.090 1.00 0.00 H TER 22845 WAT 3291 ATOM 22845 O WAT 3292 87.971 66.731 15.073 1.00 0.00 O ATOM 22846 H1 WAT 3292 87.741 66.134 15.785 1.00 0.00 H ATOM 22847 H2 WAT 3292 88.071 66.165 14.308 1.00 0.00 H TER 22849 WAT 3292 ATOM 22849 O WAT 3293 86.666 29.882 126.858 1.00 0.00 O ATOM 22850 H1 WAT 3293 86.428 28.955 126.873 1.00 0.00 H ATOM 22851 H2 WAT 3293 87.622 29.883 126.808 1.00 0.00 H TER 22853 WAT 3293 ATOM 22853 O WAT 3294 69.238 97.434 129.510 1.00 0.00 O ATOM 22854 H1 WAT 3294 69.847 97.703 130.197 1.00 0.00 H ATOM 22855 H2 WAT 3294 68.371 97.573 129.891 1.00 0.00 H TER 22857 WAT 3294 ATOM 22857 O WAT 3295 90.171 42.444 74.410 1.00 0.00 O ATOM 22858 H1 WAT 3295 90.059 42.276 73.475 1.00 0.00 H ATOM 22859 H2 WAT 3295 90.460 43.355 74.458 1.00 0.00 H TER 22861 WAT 3295 ATOM 22861 O WAT 3296 130.825 113.591 5.108 1.00 0.00 O ATOM 22862 H1 WAT 3296 130.116 113.439 4.483 1.00 0.00 H ATOM 22863 H2 WAT 3296 130.382 113.874 5.908 1.00 0.00 H TER 22865 WAT 3296 ATOM 22865 O WAT 3297 53.598 2.070 134.434 1.00 0.00 O ATOM 22866 H1 WAT 3297 53.856 2.980 134.580 1.00 0.00 H ATOM 22867 H2 WAT 3297 53.317 1.759 135.295 1.00 0.00 H TER 22869 WAT 3297 ATOM 22869 O WAT 3298 73.235 106.209 2.172 1.00 0.00 O ATOM 22870 H1 WAT 3298 73.650 105.949 2.995 1.00 0.00 H ATOM 22871 H2 WAT 3298 72.352 105.843 2.223 1.00 0.00 H TER 22873 WAT 3298 ATOM 22873 O WAT 3299 75.618 61.865 65.815 1.00 0.00 O ATOM 22874 H1 WAT 3299 76.016 62.691 65.541 1.00 0.00 H ATOM 22875 H2 WAT 3299 76.141 61.191 65.381 1.00 0.00 H TER 22877 WAT 3299 ATOM 22877 O WAT 3300 98.127 126.902 121.723 1.00 0.00 O ATOM 22878 H1 WAT 3300 97.505 127.487 122.155 1.00 0.00 H ATOM 22879 H2 WAT 3300 97.994 127.057 120.788 1.00 0.00 H TER 22881 WAT 3300 ATOM 22881 O WAT 3301 67.831 7.365 139.978 1.00 0.00 O ATOM 22882 H1 WAT 3301 66.888 7.239 140.088 1.00 0.00 H ATOM 22883 H2 WAT 3301 67.986 8.268 140.256 1.00 0.00 H TER 22885 WAT 3301 ATOM 22885 O WAT 3302 129.843 59.968 9.534 1.00 0.00 O ATOM 22886 H1 WAT 3302 130.739 60.042 9.203 1.00 0.00 H ATOM 22887 H2 WAT 3302 129.658 59.029 9.517 1.00 0.00 H TER 22889 WAT 3302 ATOM 22889 O WAT 3303 30.696 56.401 156.986 1.00 0.00 O ATOM 22890 H1 WAT 3303 31.105 57.259 157.104 1.00 0.00 H ATOM 22891 H2 WAT 3303 30.711 56.007 157.858 1.00 0.00 H TER 22893 WAT 3303 ATOM 22893 O WAT 3304 17.872 11.241 3.344 1.00 0.00 O ATOM 22894 H1 WAT 3304 18.717 11.100 2.918 1.00 0.00 H ATOM 22895 H2 WAT 3304 17.239 10.813 2.768 1.00 0.00 H TER 22897 WAT 3304 ATOM 22897 O WAT 3305 103.922 127.228 13.729 1.00 0.00 O ATOM 22898 H1 WAT 3305 104.383 126.908 12.953 1.00 0.00 H ATOM 22899 H2 WAT 3305 103.086 127.553 13.394 1.00 0.00 H TER 22901 WAT 3305 ATOM 22901 O WAT 3306 101.028 28.474 11.759 1.00 0.00 O ATOM 22902 H1 WAT 3306 101.380 28.876 12.553 1.00 0.00 H ATOM 22903 H2 WAT 3306 101.795 28.322 11.207 1.00 0.00 H TER 22905 WAT 3306 ATOM 22905 O WAT 3307 73.587 79.995 65.189 1.00 0.00 O ATOM 22906 H1 WAT 3307 72.863 80.591 65.384 1.00 0.00 H ATOM 22907 H2 WAT 3307 73.702 79.489 65.993 1.00 0.00 H TER 22909 WAT 3307 ATOM 22909 O WAT 3308 99.923 77.240 10.722 1.00 0.00 O ATOM 22910 H1 WAT 3308 100.752 77.278 10.245 1.00 0.00 H ATOM 22911 H2 WAT 3308 99.484 76.462 10.378 1.00 0.00 H TER 22913 WAT 3308 ATOM 22913 O WAT 3309 28.163 61.992 154.107 1.00 0.00 O ATOM 22914 H1 WAT 3309 27.647 61.243 154.404 1.00 0.00 H ATOM 22915 H2 WAT 3309 29.039 61.835 154.461 1.00 0.00 H TER 22917 WAT 3309 ATOM 22917 O WAT 3310 53.237 15.871 153.585 1.00 0.00 O ATOM 22918 H1 WAT 3310 52.329 15.850 153.282 1.00 0.00 H ATOM 22919 H2 WAT 3310 53.238 16.513 154.295 1.00 0.00 H TER 22921 WAT 3310 ATOM 22921 O WAT 3311 94.560 32.146 26.768 1.00 0.00 O ATOM 22922 H1 WAT 3311 95.147 32.790 27.164 1.00 0.00 H ATOM 22923 H2 WAT 3311 95.051 31.325 26.796 1.00 0.00 H TER 22925 WAT 3311 ATOM 22925 O WAT 3312 72.575 143.940 145.163 1.00 0.00 O ATOM 22926 H1 WAT 3312 72.759 144.131 144.244 1.00 0.00 H ATOM 22927 H2 WAT 3312 72.479 142.988 145.195 1.00 0.00 H TER 22929 WAT 3312 ATOM 22929 O WAT 3313 48.065 72.756 129.210 1.00 0.00 O ATOM 22930 H1 WAT 3313 47.538 72.015 129.508 1.00 0.00 H ATOM 22931 H2 WAT 3313 48.769 72.359 128.698 1.00 0.00 H TER 22933 WAT 3313 ATOM 22933 O WAT 3314 137.598 46.968 69.247 1.00 0.00 O ATOM 22934 H1 WAT 3314 138.099 47.722 69.559 1.00 0.00 H ATOM 22935 H2 WAT 3314 137.613 46.351 69.979 1.00 0.00 H TER 22937 WAT 3314 ATOM 22937 O WAT 3315 65.800 2.841 108.883 1.00 0.00 O ATOM 22938 H1 WAT 3315 65.814 2.884 107.927 1.00 0.00 H ATOM 22939 H2 WAT 3315 66.586 2.345 109.112 1.00 0.00 H TER 22941 WAT 3315 ATOM 22941 O WAT 3316 86.431 61.929 2.412 1.00 0.00 O ATOM 22942 H1 WAT 3316 86.338 62.797 2.020 1.00 0.00 H ATOM 22943 H2 WAT 3316 86.565 61.343 1.667 1.00 0.00 H TER 22945 WAT 3316 ATOM 22945 O WAT 3317 2.124 95.129 77.767 1.00 0.00 O ATOM 22946 H1 WAT 3317 2.382 94.553 77.047 1.00 0.00 H ATOM 22947 H2 WAT 3317 2.909 95.198 78.311 1.00 0.00 H TER 22949 WAT 3317 ATOM 22949 O WAT 3318 70.924 52.544 65.443 1.00 0.00 O ATOM 22950 H1 WAT 3318 70.502 52.083 64.718 1.00 0.00 H ATOM 22951 H2 WAT 3318 71.811 52.721 65.130 1.00 0.00 H TER 22953 WAT 3318 ATOM 22953 O WAT 3319 15.952 142.952 0.703 1.00 0.00 O ATOM 22954 H1 WAT 3319 16.062 143.899 0.785 1.00 0.00 H ATOM 22955 H2 WAT 3319 15.488 142.695 1.500 1.00 0.00 H TER 22957 WAT 3319 ATOM 22957 O WAT 3320 78.025 129.869 7.854 1.00 0.00 O ATOM 22958 H1 WAT 3320 77.436 129.395 7.267 1.00 0.00 H ATOM 22959 H2 WAT 3320 78.430 130.536 7.299 1.00 0.00 H TER 22961 WAT 3320 ATOM 22961 O WAT 3321 115.580 140.215 75.574 1.00 0.00 O ATOM 22962 H1 WAT 3321 115.365 140.505 76.460 1.00 0.00 H ATOM 22963 H2 WAT 3321 116.022 140.966 75.177 1.00 0.00 H TER 22965 WAT 3321 ATOM 22965 O WAT 3322 3.163 115.123 63.072 1.00 0.00 O ATOM 22966 H1 WAT 3322 3.465 115.729 63.749 1.00 0.00 H ATOM 22967 H2 WAT 3322 3.270 115.606 62.253 1.00 0.00 H TER 22969 WAT 3322 ATOM 22969 O WAT 3323 145.641 101.287 145.568 1.00 0.00 O ATOM 22970 H1 WAT 3323 146.260 101.645 144.933 1.00 0.00 H ATOM 22971 H2 WAT 3323 145.360 102.043 146.083 1.00 0.00 H TER 22973 WAT 3323 ATOM 22973 O WAT 3324 124.524 10.434 148.016 1.00 0.00 O ATOM 22974 H1 WAT 3324 125.309 10.718 147.547 1.00 0.00 H ATOM 22975 H2 WAT 3324 124.790 9.633 148.466 1.00 0.00 H TER 22977 WAT 3324 ATOM 22977 O WAT 3325 61.862 73.437 1.947 1.00 0.00 O ATOM 22978 H1 WAT 3325 62.322 73.103 1.176 1.00 0.00 H ATOM 22979 H2 WAT 3325 62.560 73.687 2.552 1.00 0.00 H TER 22981 WAT 3325 ATOM 22981 O WAT 3326 87.694 100.353 116.906 1.00 0.00 O ATOM 22982 H1 WAT 3326 88.459 100.883 117.130 1.00 0.00 H ATOM 22983 H2 WAT 3326 86.946 100.921 117.092 1.00 0.00 H TER 22985 WAT 3326 ATOM 22985 O WAT 3327 99.598 73.065 125.478 1.00 0.00 O ATOM 22986 H1 WAT 3327 99.035 72.563 126.068 1.00 0.00 H ATOM 22987 H2 WAT 3327 99.123 73.883 125.332 1.00 0.00 H TER 22989 WAT 3327 ATOM 22989 O WAT 3328 6.338 72.429 119.645 1.00 0.00 O ATOM 22990 H1 WAT 3328 5.866 71.733 120.103 1.00 0.00 H ATOM 22991 H2 WAT 3328 7.039 72.679 120.247 1.00 0.00 H TER 22993 WAT 3328 ATOM 22993 O WAT 3329 67.908 61.978 81.873 1.00 0.00 O ATOM 22994 H1 WAT 3329 67.322 61.516 82.472 1.00 0.00 H ATOM 22995 H2 WAT 3329 67.323 62.399 81.243 1.00 0.00 H TER 22997 WAT 3329 ATOM 22997 O WAT 3330 138.291 38.317 115.955 1.00 0.00 O ATOM 22998 H1 WAT 3330 139.145 38.177 116.363 1.00 0.00 H ATOM 22999 H2 WAT 3330 138.462 38.263 115.014 1.00 0.00 H TER 23001 WAT 3330 ATOM 23001 O WAT 3331 19.299 104.673 119.352 1.00 0.00 O ATOM 23002 H1 WAT 3331 20.146 104.232 119.279 1.00 0.00 H ATOM 23003 H2 WAT 3331 19.434 105.340 120.024 1.00 0.00 H TER 23005 WAT 3331 ATOM 23005 O WAT 3332 26.459 64.199 154.782 1.00 0.00 O ATOM 23006 H1 WAT 3332 27.075 63.566 154.411 1.00 0.00 H ATOM 23007 H2 WAT 3332 26.614 65.003 154.286 1.00 0.00 H TER 23009 WAT 3332 ATOM 23009 O WAT 3333 104.023 35.802 27.994 1.00 0.00 O ATOM 23010 H1 WAT 3333 103.271 35.420 28.446 1.00 0.00 H ATOM 23011 H2 WAT 3333 104.571 36.153 28.696 1.00 0.00 H TER 23013 WAT 3333 ATOM 23013 O WAT 3334 5.192 89.029 156.497 1.00 0.00 O ATOM 23014 H1 WAT 3334 4.839 89.290 155.646 1.00 0.00 H ATOM 23015 H2 WAT 3334 4.521 88.458 156.870 1.00 0.00 H TER 23017 WAT 3334 ATOM 23017 O WAT 3335 84.731 118.594 109.043 1.00 0.00 O ATOM 23018 H1 WAT 3335 84.413 117.693 109.111 1.00 0.00 H ATOM 23019 H2 WAT 3335 83.945 119.114 108.877 1.00 0.00 H TER 23021 WAT 3335 ATOM 23021 O WAT 3336 26.254 73.059 71.041 1.00 0.00 O ATOM 23022 H1 WAT 3336 25.932 73.913 70.752 1.00 0.00 H ATOM 23023 H2 WAT 3336 27.206 73.157 71.059 1.00 0.00 H TER 23025 WAT 3336 ATOM 23025 O WAT 3337 73.271 73.092 90.694 1.00 0.00 O ATOM 23026 H1 WAT 3337 72.952 72.832 91.558 1.00 0.00 H ATOM 23027 H2 WAT 3337 74.217 73.183 90.805 1.00 0.00 H TER 23029 WAT 3337 ATOM 23029 O WAT 3338 98.602 59.420 143.865 1.00 0.00 O ATOM 23030 H1 WAT 3338 97.828 59.433 144.427 1.00 0.00 H ATOM 23031 H2 WAT 3338 98.794 58.491 143.742 1.00 0.00 H TER 23033 WAT 3338 ATOM 23033 O WAT 3339 42.861 9.396 7.351 1.00 0.00 O ATOM 23034 H1 WAT 3339 42.597 8.476 7.367 1.00 0.00 H ATOM 23035 H2 WAT 3339 42.990 9.625 8.271 1.00 0.00 H TER 23037 WAT 3339 ATOM 23037 O WAT 3340 9.205 9.373 8.142 1.00 0.00 O ATOM 23038 H1 WAT 3340 9.479 9.786 7.323 1.00 0.00 H ATOM 23039 H2 WAT 3340 10.009 8.998 8.501 1.00 0.00 H TER 23041 WAT 3340 ATOM 23041 O WAT 3341 10.182 20.274 95.992 1.00 0.00 O ATOM 23042 H1 WAT 3341 10.805 20.484 96.688 1.00 0.00 H ATOM 23043 H2 WAT 3341 9.664 19.550 96.344 1.00 0.00 H TER 23045 WAT 3341 ATOM 23045 O WAT 3342 70.655 58.902 136.003 1.00 0.00 O ATOM 23046 H1 WAT 3342 71.129 58.963 135.173 1.00 0.00 H ATOM 23047 H2 WAT 3342 71.150 58.262 136.515 1.00 0.00 H TER 23049 WAT 3342 ATOM 23049 O WAT 3343 96.663 93.298 103.548 1.00 0.00 O ATOM 23050 H1 WAT 3343 96.455 92.426 103.212 1.00 0.00 H ATOM 23051 H2 WAT 3343 96.015 93.451 104.235 1.00 0.00 H TER 23053 WAT 3343 ATOM 23053 O WAT 3344 27.119 86.490 21.011 1.00 0.00 O ATOM 23054 H1 WAT 3344 26.307 86.552 21.513 1.00 0.00 H ATOM 23055 H2 WAT 3344 27.089 85.620 20.613 1.00 0.00 H TER 23057 WAT 3344 ATOM 23057 O WAT 3345 34.788 112.219 115.753 1.00 0.00 O ATOM 23058 H1 WAT 3345 35.442 111.777 115.212 1.00 0.00 H ATOM 23059 H2 WAT 3345 34.142 111.541 115.951 1.00 0.00 H TER 23061 WAT 3345 ATOM 23061 O WAT 3346 136.457 91.032 9.132 1.00 0.00 O ATOM 23062 H1 WAT 3346 136.305 91.364 10.017 1.00 0.00 H ATOM 23063 H2 WAT 3346 137.055 90.295 9.252 1.00 0.00 H TER 23065 WAT 3346 ATOM 23065 O WAT 3347 88.146 45.392 62.292 1.00 0.00 O ATOM 23066 H1 WAT 3347 88.942 45.543 61.782 1.00 0.00 H ATOM 23067 H2 WAT 3347 87.434 45.515 61.665 1.00 0.00 H TER 23069 WAT 3347 ATOM 23069 O WAT 3348 130.495 28.623 124.607 1.00 0.00 O ATOM 23070 H1 WAT 3348 129.721 29.184 124.647 1.00 0.00 H ATOM 23071 H2 WAT 3348 130.934 28.760 125.447 1.00 0.00 H TER 23073 WAT 3348 ATOM 23073 O WAT 3349 143.003 130.261 85.415 1.00 0.00 O ATOM 23074 H1 WAT 3349 142.674 130.699 84.630 1.00 0.00 H ATOM 23075 H2 WAT 3349 142.696 130.807 86.139 1.00 0.00 H TER 23077 WAT 3349 ATOM 23077 O WAT 3350 127.077 6.569 152.335 1.00 0.00 O ATOM 23078 H1 WAT 3350 126.343 7.127 152.591 1.00 0.00 H ATOM 23079 H2 WAT 3350 127.390 6.193 153.158 1.00 0.00 H TER 23081 WAT 3350 ATOM 23081 O WAT 3351 87.069 38.630 107.578 1.00 0.00 O ATOM 23082 H1 WAT 3351 86.144 38.856 107.485 1.00 0.00 H ATOM 23083 H2 WAT 3351 87.523 39.228 106.984 1.00 0.00 H TER 23085 WAT 3351 ATOM 23085 O WAT 3352 5.290 55.083 78.091 1.00 0.00 O ATOM 23086 H1 WAT 3352 4.775 55.040 77.285 1.00 0.00 H ATOM 23087 H2 WAT 3352 4.987 54.337 78.609 1.00 0.00 H TER 23089 WAT 3352 ATOM 23089 O WAT 3353 41.299 113.109 122.049 1.00 0.00 O ATOM 23090 H1 WAT 3353 40.455 112.670 122.156 1.00 0.00 H ATOM 23091 H2 WAT 3353 41.869 112.694 122.695 1.00 0.00 H TER 23093 WAT 3353 ATOM 23093 O WAT 3354 133.379 51.093 11.584 1.00 0.00 O ATOM 23094 H1 WAT 3354 133.080 50.214 11.818 1.00 0.00 H ATOM 23095 H2 WAT 3354 133.189 51.625 12.357 1.00 0.00 H TER 23097 WAT 3354 ATOM 23097 O WAT 3355 133.735 37.052 87.139 1.00 0.00 O ATOM 23098 H1 WAT 3355 134.300 36.419 86.695 1.00 0.00 H ATOM 23099 H2 WAT 3355 134.305 37.800 87.313 1.00 0.00 H TER 23101 WAT 3355 ATOM 23101 O WAT 3356 55.967 37.779 117.622 1.00 0.00 O ATOM 23102 H1 WAT 3356 56.595 37.060 117.554 1.00 0.00 H ATOM 23103 H2 WAT 3356 56.164 38.192 118.463 1.00 0.00 H TER 23105 WAT 3356 ATOM 23105 O WAT 3357 44.460 90.993 87.680 1.00 0.00 O ATOM 23106 H1 WAT 3357 44.278 90.586 86.833 1.00 0.00 H ATOM 23107 H2 WAT 3357 44.842 90.291 88.207 1.00 0.00 H TER 23109 WAT 3357 ATOM 23109 O WAT 3358 114.988 35.274 113.367 1.00 0.00 O ATOM 23110 H1 WAT 3358 115.491 34.526 113.045 1.00 0.00 H ATOM 23111 H2 WAT 3358 114.103 34.931 113.494 1.00 0.00 H TER 23113 WAT 3358 ATOM 23113 O WAT 3359 41.286 92.640 73.090 1.00 0.00 O ATOM 23114 H1 WAT 3359 41.488 92.636 74.026 1.00 0.00 H ATOM 23115 H2 WAT 3359 41.721 91.859 72.748 1.00 0.00 H TER 23117 WAT 3359 ATOM 23117 O WAT 3360 10.987 78.898 82.278 1.00 0.00 O ATOM 23118 H1 WAT 3360 10.797 78.450 81.453 1.00 0.00 H ATOM 23119 H2 WAT 3360 11.530 79.644 82.026 1.00 0.00 H TER 23121 WAT 3360 ATOM 23121 O WAT 3361 91.695 15.256 78.930 1.00 0.00 O ATOM 23122 H1 WAT 3361 91.434 14.712 79.673 1.00 0.00 H ATOM 23123 H2 WAT 3361 92.651 15.283 78.977 1.00 0.00 H TER 23125 WAT 3361 ATOM 23125 O WAT 3362 5.147 70.341 23.559 1.00 0.00 O ATOM 23126 H1 WAT 3362 4.653 70.992 24.057 1.00 0.00 H ATOM 23127 H2 WAT 3362 5.937 70.190 24.079 1.00 0.00 H TER 23129 WAT 3362 ATOM 23129 O WAT 3363 91.689 63.643 90.172 1.00 0.00 O ATOM 23130 H1 WAT 3363 92.227 62.870 89.999 1.00 0.00 H ATOM 23131 H2 WAT 3363 91.815 63.818 91.104 1.00 0.00 H TER 23133 WAT 3363 ATOM 23133 O WAT 3364 15.865 110.679 68.982 1.00 0.00 O ATOM 23134 H1 WAT 3364 15.961 111.254 69.741 1.00 0.00 H ATOM 23135 H2 WAT 3364 16.671 110.163 68.968 1.00 0.00 H TER 23137 WAT 3364 ATOM 23137 O WAT 3365 138.228 63.047 7.173 1.00 0.00 O ATOM 23138 H1 WAT 3365 138.779 63.114 6.394 1.00 0.00 H ATOM 23139 H2 WAT 3365 138.606 63.675 7.788 1.00 0.00 H TER 23141 WAT 3365 ATOM 23141 O WAT 3366 91.768 51.952 127.204 1.00 0.00 O ATOM 23142 H1 WAT 3366 91.712 52.903 127.111 1.00 0.00 H ATOM 23143 H2 WAT 3366 91.332 51.765 128.035 1.00 0.00 H TER 23145 WAT 3366 ATOM 23145 O WAT 3367 144.683 42.795 130.354 1.00 0.00 O ATOM 23146 H1 WAT 3367 144.024 42.682 131.039 1.00 0.00 H ATOM 23147 H2 WAT 3367 145.519 42.660 130.802 1.00 0.00 H TER 23149 WAT 3367 ATOM 23149 O WAT 3368 64.783 15.639 59.474 1.00 0.00 O ATOM 23150 H1 WAT 3368 65.553 16.059 59.090 1.00 0.00 H ATOM 23151 H2 WAT 3368 64.916 14.704 59.315 1.00 0.00 H TER 23153 WAT 3368 ATOM 23153 O WAT 3369 86.282 71.342 108.934 1.00 0.00 O ATOM 23154 H1 WAT 3369 85.446 71.805 108.889 1.00 0.00 H ATOM 23155 H2 WAT 3369 86.090 70.466 108.599 1.00 0.00 H TER 23157 WAT 3369 ATOM 23157 O WAT 3370 83.488 9.339 12.321 1.00 0.00 O ATOM 23158 H1 WAT 3370 82.616 8.942 12.306 1.00 0.00 H ATOM 23159 H2 WAT 3370 83.420 10.043 12.965 1.00 0.00 H TER 23161 WAT 3370 ATOM 23161 O WAT 3371 122.725 69.298 69.835 1.00 0.00 O ATOM 23162 H1 WAT 3371 123.188 68.706 69.243 1.00 0.00 H ATOM 23163 H2 WAT 3371 122.456 68.743 70.568 1.00 0.00 H TER 23165 WAT 3371 ATOM 23165 O WAT 3372 89.312 18.356 83.648 1.00 0.00 O ATOM 23166 H1 WAT 3372 88.681 18.544 84.342 1.00 0.00 H ATOM 23167 H2 WAT 3372 89.966 17.794 84.063 1.00 0.00 H TER 23169 WAT 3372 ATOM 23169 O WAT 3373 86.086 40.072 10.746 1.00 0.00 O ATOM 23170 H1 WAT 3373 85.471 39.444 10.367 1.00 0.00 H ATOM 23171 H2 WAT 3373 86.754 39.530 11.167 1.00 0.00 H TER 23173 WAT 3373 ATOM 23173 O WAT 3374 31.754 78.133 66.983 1.00 0.00 O ATOM 23174 H1 WAT 3374 31.366 78.491 66.185 1.00 0.00 H ATOM 23175 H2 WAT 3374 32.418 78.775 67.235 1.00 0.00 H TER 23177 WAT 3374 ATOM 23177 O WAT 3375 78.727 83.197 10.042 1.00 0.00 O ATOM 23178 H1 WAT 3375 78.713 83.230 10.999 1.00 0.00 H ATOM 23179 H2 WAT 3375 79.600 83.511 9.805 1.00 0.00 H TER 23181 WAT 3375 ATOM 23181 O WAT 3376 46.355 59.671 86.664 1.00 0.00 O ATOM 23182 H1 WAT 3376 45.773 59.003 86.304 1.00 0.00 H ATOM 23183 H2 WAT 3376 46.075 59.767 87.575 1.00 0.00 H TER 23185 WAT 3376 ATOM 23185 O WAT 3377 89.798 130.708 55.723 1.00 0.00 O ATOM 23186 H1 WAT 3377 90.035 131.538 55.308 1.00 0.00 H ATOM 23187 H2 WAT 3377 89.147 130.947 56.382 1.00 0.00 H TER 23189 WAT 3377 ATOM 23189 O WAT 3378 137.048 57.261 135.728 1.00 0.00 O ATOM 23190 H1 WAT 3378 137.587 56.629 136.203 1.00 0.00 H ATOM 23191 H2 WAT 3378 136.149 57.043 135.974 1.00 0.00 H TER 23193 WAT 3378 ATOM 23193 O WAT 3379 78.704 120.567 109.746 1.00 0.00 O ATOM 23194 H1 WAT 3379 78.748 120.565 108.790 1.00 0.00 H ATOM 23195 H2 WAT 3379 78.831 121.484 109.990 1.00 0.00 H TER 23197 WAT 3379 ATOM 23197 O WAT 3380 47.808 39.670 146.930 1.00 0.00 O ATOM 23198 H1 WAT 3380 48.222 38.976 146.417 1.00 0.00 H ATOM 23199 H2 WAT 3380 48.539 40.188 147.266 1.00 0.00 H TER 23201 WAT 3380 ATOM 23201 O WAT 3381 51.469 125.978 138.381 1.00 0.00 O ATOM 23202 H1 WAT 3381 52.353 126.310 138.228 1.00 0.00 H ATOM 23203 H2 WAT 3381 50.898 126.728 138.213 1.00 0.00 H TER 23205 WAT 3381 ATOM 23205 O WAT 3382 82.632 24.101 93.371 1.00 0.00 O ATOM 23206 H1 WAT 3382 83.271 24.604 92.867 1.00 0.00 H ATOM 23207 H2 WAT 3382 81.833 24.132 92.844 1.00 0.00 H TER 23209 WAT 3382 ATOM 23209 O WAT 3383 44.052 34.509 26.927 1.00 0.00 O ATOM 23210 H1 WAT 3383 43.445 33.802 26.710 1.00 0.00 H ATOM 23211 H2 WAT 3383 43.490 35.225 27.223 1.00 0.00 H TER 23213 WAT 3383 ATOM 23213 O WAT 3384 0.423 35.642 55.164 1.00 0.00 O ATOM 23214 H1 WAT 3384 0.517 34.697 55.285 1.00 0.00 H ATOM 23215 H2 WAT 3384 0.350 35.756 54.217 1.00 0.00 H TER 23217 WAT 3384 ATOM 23217 O WAT 3385 70.052 91.204 145.134 1.00 0.00 O ATOM 23218 H1 WAT 3385 70.813 90.643 144.981 1.00 0.00 H ATOM 23219 H2 WAT 3385 69.511 91.092 144.352 1.00 0.00 H TER 23221 WAT 3385 ATOM 23221 O WAT 3386 6.125 1.391 76.294 1.00 0.00 O ATOM 23222 H1 WAT 3386 6.815 1.778 76.832 1.00 0.00 H ATOM 23223 H2 WAT 3386 5.348 1.406 76.853 1.00 0.00 H TER 23225 WAT 3386 ATOM 23225 O WAT 3387 64.115 141.068 147.437 1.00 0.00 O ATOM 23226 H1 WAT 3387 64.646 141.842 147.621 1.00 0.00 H ATOM 23227 H2 WAT 3387 64.568 140.634 146.713 1.00 0.00 H TER 23229 WAT 3387 ATOM 23229 O WAT 3388 0.505 91.582 79.153 1.00 0.00 O ATOM 23230 H1 WAT 3388 0.229 91.957 79.989 1.00 0.00 H ATOM 23231 H2 WAT 3388 1.298 92.066 78.923 1.00 0.00 H TER 23233 WAT 3388 ATOM 23233 O WAT 3389 90.207 95.676 3.310 1.00 0.00 O ATOM 23234 H1 WAT 3389 89.830 94.807 3.171 1.00 0.00 H ATOM 23235 H2 WAT 3389 89.602 96.105 3.915 1.00 0.00 H TER 23237 WAT 3389 ATOM 23237 O WAT 3390 84.341 70.128 114.075 1.00 0.00 O ATOM 23238 H1 WAT 3390 84.418 70.911 113.530 1.00 0.00 H ATOM 23239 H2 WAT 3390 83.475 69.776 113.869 1.00 0.00 H TER 23241 WAT 3390 ATOM 23241 O WAT 3391 122.264 101.651 156.654 1.00 0.00 O ATOM 23242 H1 WAT 3391 123.143 101.273 156.636 1.00 0.00 H ATOM 23243 H2 WAT 3391 122.285 102.273 157.381 1.00 0.00 H TER 23245 WAT 3391 ATOM 23245 O WAT 3392 128.065 145.067 138.552 1.00 0.00 O ATOM 23246 H1 WAT 3392 128.725 145.751 138.434 1.00 0.00 H ATOM 23247 H2 WAT 3392 128.258 144.427 137.867 1.00 0.00 H TER 23249 WAT 3392 ATOM 23249 O WAT 3393 20.890 36.935 139.528 1.00 0.00 O ATOM 23250 H1 WAT 3393 20.421 36.375 138.910 1.00 0.00 H ATOM 23251 H2 WAT 3393 20.700 36.555 140.386 1.00 0.00 H TER 23253 WAT 3393 ATOM 23253 O WAT 3394 113.468 86.140 2.563 1.00 0.00 O ATOM 23254 H1 WAT 3394 113.703 86.913 3.077 1.00 0.00 H ATOM 23255 H2 WAT 3394 114.293 85.852 2.174 1.00 0.00 H TER 23257 WAT 3394 ATOM 23257 O WAT 3395 125.892 105.045 5.001 1.00 0.00 O ATOM 23258 H1 WAT 3395 125.140 105.549 4.689 1.00 0.00 H ATOM 23259 H2 WAT 3395 126.468 105.697 5.400 1.00 0.00 H TER 23261 WAT 3395 ATOM 23261 O WAT 3396 9.221 85.334 75.852 1.00 0.00 O ATOM 23262 H1 WAT 3396 9.013 84.436 75.592 1.00 0.00 H ATOM 23263 H2 WAT 3396 10.054 85.261 76.317 1.00 0.00 H TER 23265 WAT 3396 ATOM 23265 O WAT 3397 107.599 83.423 124.118 1.00 0.00 O ATOM 23266 H1 WAT 3397 107.364 84.289 124.452 1.00 0.00 H ATOM 23267 H2 WAT 3397 106.929 82.839 124.472 1.00 0.00 H TER 23269 WAT 3397 ATOM 23269 O WAT 3398 37.656 127.800 80.419 1.00 0.00 O ATOM 23270 H1 WAT 3398 37.253 128.589 80.781 1.00 0.00 H ATOM 23271 H2 WAT 3398 38.591 127.906 80.597 1.00 0.00 H TER 23273 WAT 3398 ATOM 23273 O WAT 3399 31.218 79.594 141.042 1.00 0.00 O ATOM 23274 H1 WAT 3399 30.332 79.837 141.313 1.00 0.00 H ATOM 23275 H2 WAT 3399 31.690 79.457 141.864 1.00 0.00 H TER 23277 WAT 3399 ATOM 23277 O WAT 3400 78.978 104.305 0.153 1.00 0.00 O ATOM 23278 H1 WAT 3400 79.830 104.697 -0.041 1.00 0.00 H ATOM 23279 H2 WAT 3400 79.174 103.388 0.343 1.00 0.00 H TER 23281 WAT 3400 ATOM 23281 O WAT 3401 9.784 128.254 66.982 1.00 0.00 O ATOM 23282 H1 WAT 3401 8.844 128.116 66.870 1.00 0.00 H ATOM 23283 H2 WAT 3401 10.068 128.651 66.158 1.00 0.00 H TER 23285 WAT 3401 ATOM 23285 O WAT 3402 25.703 30.593 16.238 1.00 0.00 O ATOM 23286 H1 WAT 3402 24.913 30.075 16.394 1.00 0.00 H ATOM 23287 H2 WAT 3402 26.114 30.179 15.479 1.00 0.00 H TER 23289 WAT 3402 ATOM 23289 O WAT 3403 25.404 34.507 116.956 1.00 0.00 O ATOM 23290 H1 WAT 3403 25.143 34.701 117.856 1.00 0.00 H ATOM 23291 H2 WAT 3403 24.604 34.185 116.539 1.00 0.00 H TER 23293 WAT 3403 ATOM 23293 O WAT 3404 56.507 111.303 74.048 1.00 0.00 O ATOM 23294 H1 WAT 3404 55.898 111.406 73.317 1.00 0.00 H ATOM 23295 H2 WAT 3404 57.255 111.852 73.815 1.00 0.00 H TER 23297 WAT 3404 ATOM 23297 O WAT 3405 7.255 54.614 113.462 1.00 0.00 O ATOM 23298 H1 WAT 3405 6.453 54.155 113.211 1.00 0.00 H ATOM 23299 H2 WAT 3405 7.211 55.448 112.994 1.00 0.00 H TER 23301 WAT 3405 ATOM 23301 O WAT 3406 94.919 132.590 136.711 1.00 0.00 O ATOM 23302 H1 WAT 3406 95.678 132.793 136.165 1.00 0.00 H ATOM 23303 H2 WAT 3406 94.274 133.260 136.484 1.00 0.00 H TER 23305 WAT 3406 ATOM 23305 O WAT 3407 3.280 7.097 77.756 1.00 0.00 O ATOM 23306 H1 WAT 3407 3.732 6.510 78.362 1.00 0.00 H ATOM 23307 H2 WAT 3407 3.377 7.966 78.146 1.00 0.00 H TER 23309 WAT 3407 ATOM 23309 O WAT 3408 126.736 75.287 103.639 1.00 0.00 O ATOM 23310 H1 WAT 3408 127.362 75.825 104.124 1.00 0.00 H ATOM 23311 H2 WAT 3408 126.907 74.394 103.936 1.00 0.00 H TER 23313 WAT 3408 ATOM 23313 O WAT 3409 13.882 122.302 60.667 1.00 0.00 O ATOM 23314 H1 WAT 3409 14.128 121.530 60.157 1.00 0.00 H ATOM 23315 H2 WAT 3409 14.656 122.865 60.638 1.00 0.00 H TER 23317 WAT 3409 ATOM 23317 O WAT 3410 128.837 54.897 127.958 1.00 0.00 O ATOM 23318 H1 WAT 3410 129.519 54.961 128.626 1.00 0.00 H ATOM 23319 H2 WAT 3410 129.133 54.194 127.380 1.00 0.00 H TER 23321 WAT 3410 ATOM 23321 O WAT 3411 38.416 99.406 128.808 1.00 0.00 O ATOM 23322 H1 WAT 3411 38.260 99.479 127.866 1.00 0.00 H ATOM 23323 H2 WAT 3411 38.328 98.471 128.993 1.00 0.00 H TER 23325 WAT 3411 ATOM 23325 O WAT 3412 32.443 136.613 110.824 1.00 0.00 O ATOM 23326 H1 WAT 3412 32.084 136.338 109.981 1.00 0.00 H ATOM 23327 H2 WAT 3412 31.766 137.176 111.201 1.00 0.00 H TER 23329 WAT 3412 ATOM 23329 O WAT 3413 43.766 115.254 93.107 1.00 0.00 O ATOM 23330 H1 WAT 3413 42.848 115.401 92.878 1.00 0.00 H ATOM 23331 H2 WAT 3413 43.876 114.305 93.060 1.00 0.00 H TER 23333 WAT 3413 ATOM 23333 O WAT 3414 44.581 140.139 69.553 1.00 0.00 O ATOM 23334 H1 WAT 3414 44.295 139.851 68.686 1.00 0.00 H ATOM 23335 H2 WAT 3414 43.822 139.993 70.116 1.00 0.00 H TER 23337 WAT 3414 ATOM 23337 O WAT 3415 60.663 51.732 123.371 1.00 0.00 O ATOM 23338 H1 WAT 3415 60.269 51.169 122.704 1.00 0.00 H ATOM 23339 H2 WAT 3415 61.417 51.236 123.688 1.00 0.00 H TER 23341 WAT 3415 ATOM 23341 O WAT 3416 108.778 105.502 2.764 1.00 0.00 O ATOM 23342 H1 WAT 3416 109.385 104.815 2.490 1.00 0.00 H ATOM 23343 H2 WAT 3416 108.744 106.102 2.019 1.00 0.00 H TER 23345 WAT 3416 ATOM 23345 O WAT 3417 65.525 123.924 14.895 1.00 0.00 O ATOM 23346 H1 WAT 3417 65.913 123.122 15.245 1.00 0.00 H ATOM 23347 H2 WAT 3417 65.370 123.732 13.971 1.00 0.00 H TER 23349 WAT 3417 ATOM 23349 O WAT 3418 145.574 31.280 129.066 1.00 0.00 O ATOM 23350 H1 WAT 3418 145.350 31.626 129.930 1.00 0.00 H ATOM 23351 H2 WAT 3418 144.731 31.177 128.623 1.00 0.00 H TER 23353 WAT 3418 ATOM 23353 O WAT 3419 66.065 69.676 8.073 1.00 0.00 O ATOM 23354 H1 WAT 3419 66.415 68.796 8.211 1.00 0.00 H ATOM 23355 H2 WAT 3419 65.920 69.731 7.129 1.00 0.00 H TER 23357 WAT 3419 ATOM 23357 O WAT 3420 86.343 82.506 143.417 1.00 0.00 O ATOM 23358 H1 WAT 3420 86.800 82.179 142.642 1.00 0.00 H ATOM 23359 H2 WAT 3420 87.037 82.870 143.967 1.00 0.00 H TER 23361 WAT 3420 ATOM 23361 O WAT 3421 134.615 24.277 103.614 1.00 0.00 O ATOM 23362 H1 WAT 3421 133.955 24.925 103.858 1.00 0.00 H ATOM 23363 H2 WAT 3421 135.359 24.795 103.307 1.00 0.00 H TER 23365 WAT 3421 ATOM 23365 O WAT 3422 28.685 78.694 153.407 1.00 0.00 O ATOM 23366 H1 WAT 3422 29.370 78.940 154.029 1.00 0.00 H ATOM 23367 H2 WAT 3422 27.882 78.681 153.928 1.00 0.00 H TER 23369 WAT 3422 ATOM 23369 O WAT 3423 38.460 76.423 120.233 1.00 0.00 O ATOM 23370 H1 WAT 3423 38.252 75.626 120.720 1.00 0.00 H ATOM 23371 H2 WAT 3423 38.216 76.221 119.329 1.00 0.00 H TER 23373 WAT 3423 ATOM 23373 O WAT 3424 79.231 144.727 122.389 1.00 0.00 O ATOM 23374 H1 WAT 3424 79.090 145.132 121.533 1.00 0.00 H ATOM 23375 H2 WAT 3424 79.326 143.794 122.200 1.00 0.00 H TER 23377 WAT 3424 ATOM 23377 O WAT 3425 116.203 21.572 117.716 1.00 0.00 O ATOM 23378 H1 WAT 3425 117.060 21.178 117.553 1.00 0.00 H ATOM 23379 H2 WAT 3425 116.380 22.510 117.784 1.00 0.00 H TER 23381 WAT 3425 ATOM 23381 O WAT 3426 41.116 57.572 113.527 1.00 0.00 O ATOM 23382 H1 WAT 3426 41.767 56.896 113.716 1.00 0.00 H ATOM 23383 H2 WAT 3426 40.822 57.868 114.389 1.00 0.00 H TER 23385 WAT 3426 ATOM 23385 O WAT 3427 112.643 7.793 155.861 1.00 0.00 O ATOM 23386 H1 WAT 3427 113.248 7.302 156.417 1.00 0.00 H ATOM 23387 H2 WAT 3427 113.055 7.790 154.997 1.00 0.00 H TER 23389 WAT 3427 ATOM 23389 O WAT 3428 83.902 60.462 112.695 1.00 0.00 O ATOM 23390 H1 WAT 3428 83.680 59.532 112.667 1.00 0.00 H ATOM 23391 H2 WAT 3428 83.520 60.775 113.516 1.00 0.00 H TER 23393 WAT 3428 ATOM 23393 O WAT 3429 44.033 92.745 2.075 1.00 0.00 O ATOM 23394 H1 WAT 3429 43.248 93.127 1.682 1.00 0.00 H ATOM 23395 H2 WAT 3429 43.869 92.777 3.017 1.00 0.00 H TER 23397 WAT 3429 ATOM 23397 O WAT 3430 35.817 60.069 140.507 1.00 0.00 O ATOM 23398 H1 WAT 3430 35.125 60.523 140.987 1.00 0.00 H ATOM 23399 H2 WAT 3430 36.212 60.747 139.959 1.00 0.00 H TER 23401 WAT 3430 ATOM 23401 O WAT 3431 101.169 42.633 17.539 1.00 0.00 O ATOM 23402 H1 WAT 3431 100.791 41.753 17.530 1.00 0.00 H ATOM 23403 H2 WAT 3431 100.707 43.099 16.841 1.00 0.00 H TER 23405 WAT 3431 ATOM 23405 O WAT 3432 77.368 78.660 91.553 1.00 0.00 O ATOM 23406 H1 WAT 3432 77.406 79.615 91.502 1.00 0.00 H ATOM 23407 H2 WAT 3432 77.249 78.376 90.647 1.00 0.00 H TER 23409 WAT 3432 ATOM 23409 O WAT 3433 17.146 42.395 135.070 1.00 0.00 O ATOM 23410 H1 WAT 3433 17.233 41.945 134.229 1.00 0.00 H ATOM 23411 H2 WAT 3433 16.636 43.180 134.870 1.00 0.00 H TER 23413 WAT 3433 ATOM 23413 O WAT 3434 76.700 80.047 135.122 1.00 0.00 O ATOM 23414 H1 WAT 3434 75.828 80.440 135.169 1.00 0.00 H ATOM 23415 H2 WAT 3434 77.155 80.381 135.895 1.00 0.00 H TER 23417 WAT 3434 ATOM 23417 O WAT 3435 63.429 104.201 105.488 1.00 0.00 O ATOM 23418 H1 WAT 3435 63.333 104.230 104.536 1.00 0.00 H ATOM 23419 H2 WAT 3435 63.258 105.099 105.773 1.00 0.00 H TER 23421 WAT 3435 ATOM 23421 O WAT 3436 138.757 96.172 1.222 1.00 0.00 O ATOM 23422 H1 WAT 3436 138.138 95.609 1.689 1.00 0.00 H ATOM 23423 H2 WAT 3436 139.037 96.813 1.876 1.00 0.00 H TER 23425 WAT 3436 ATOM 23425 O WAT 3437 109.344 105.130 84.116 1.00 0.00 O ATOM 23426 H1 WAT 3437 109.095 104.227 83.917 1.00 0.00 H ATOM 23427 H2 WAT 3437 110.046 105.327 83.497 1.00 0.00 H TER 23429 WAT 3437 ATOM 23429 O WAT 3438 26.938 0.918 7.983 1.00 0.00 O ATOM 23430 H1 WAT 3438 27.024 1.852 8.174 1.00 0.00 H ATOM 23431 H2 WAT 3438 27.670 0.510 8.445 1.00 0.00 H TER 23433 WAT 3438 ATOM 23433 O WAT 3439 122.828 22.183 143.153 1.00 0.00 O ATOM 23434 H1 WAT 3439 122.562 21.759 142.337 1.00 0.00 H ATOM 23435 H2 WAT 3439 123.716 21.862 143.311 1.00 0.00 H TER 23437 WAT 3439 ATOM 23437 O WAT 3440 81.277 36.298 153.595 1.00 0.00 O ATOM 23438 H1 WAT 3440 81.407 35.875 154.444 1.00 0.00 H ATOM 23439 H2 WAT 3440 80.368 36.596 153.612 1.00 0.00 H TER 23441 WAT 3440 ATOM 23441 O WAT 3441 134.684 84.509 100.253 1.00 0.00 O ATOM 23442 H1 WAT 3441 133.900 84.689 99.733 1.00 0.00 H ATOM 23443 H2 WAT 3441 134.484 84.864 101.119 1.00 0.00 H TER 23445 WAT 3441 ATOM 23445 O WAT 3442 53.856 43.684 149.445 1.00 0.00 O ATOM 23446 H1 WAT 3442 52.927 43.770 149.660 1.00 0.00 H ATOM 23447 H2 WAT 3442 53.909 43.913 148.518 1.00 0.00 H TER 23449 WAT 3442 ATOM 23449 O WAT 3443 9.500 141.221 66.219 1.00 0.00 O ATOM 23450 H1 WAT 3443 10.192 140.579 66.056 1.00 0.00 H ATOM 23451 H2 WAT 3443 9.863 141.799 66.889 1.00 0.00 H TER 23453 WAT 3443 ATOM 23453 O WAT 3444 34.145 101.598 4.147 1.00 0.00 O ATOM 23454 H1 WAT 3444 33.191 101.541 4.206 1.00 0.00 H ATOM 23455 H2 WAT 3444 34.415 101.971 4.987 1.00 0.00 H TER 23457 WAT 3444 ATOM 23457 O WAT 3445 109.880 41.184 60.751 1.00 0.00 O ATOM 23458 H1 WAT 3445 109.501 40.629 60.069 1.00 0.00 H ATOM 23459 H2 WAT 3445 110.060 42.015 60.311 1.00 0.00 H TER 23461 WAT 3445 ATOM 23461 O WAT 3446 28.153 84.534 143.362 1.00 0.00 O ATOM 23462 H1 WAT 3446 27.504 83.831 143.333 1.00 0.00 H ATOM 23463 H2 WAT 3446 27.874 85.146 142.682 1.00 0.00 H TER 23465 WAT 3446 ATOM 23465 O WAT 3447 134.284 112.657 119.259 1.00 0.00 O ATOM 23466 H1 WAT 3447 133.563 113.051 118.768 1.00 0.00 H ATOM 23467 H2 WAT 3447 133.858 112.188 119.976 1.00 0.00 H TER 23469 WAT 3447 ATOM 23469 O WAT 3448 137.902 50.564 146.552 1.00 0.00 O ATOM 23470 H1 WAT 3448 137.072 51.018 146.696 1.00 0.00 H ATOM 23471 H2 WAT 3448 137.736 49.665 146.833 1.00 0.00 H TER 23473 WAT 3448 ATOM 23473 O WAT 3449 14.951 2.214 7.924 1.00 0.00 O ATOM 23474 H1 WAT 3449 15.244 1.347 8.205 1.00 0.00 H ATOM 23475 H2 WAT 3449 14.809 2.125 6.982 1.00 0.00 H TER 23477 WAT 3449 ATOM 23477 O WAT 3450 13.454 25.119 4.504 1.00 0.00 O ATOM 23478 H1 WAT 3450 14.369 24.866 4.625 1.00 0.00 H ATOM 23479 H2 WAT 3450 13.038 24.341 4.131 1.00 0.00 H TER 23481 WAT 3450 ATOM 23481 O WAT 3451 19.502 30.956 100.282 1.00 0.00 O ATOM 23482 H1 WAT 3451 19.704 31.071 99.353 1.00 0.00 H ATOM 23483 H2 WAT 3451 20.152 31.493 100.736 1.00 0.00 H TER 23485 WAT 3451 ATOM 23485 O WAT 3452 141.025 140.441 123.745 1.00 0.00 O ATOM 23486 H1 WAT 3452 141.360 140.849 122.947 1.00 0.00 H ATOM 23487 H2 WAT 3452 141.777 140.415 124.336 1.00 0.00 H TER 23489 WAT 3452 ATOM 23489 O WAT 3453 142.922 71.250 16.226 1.00 0.00 O ATOM 23490 H1 WAT 3453 143.152 72.162 16.405 1.00 0.00 H ATOM 23491 H2 WAT 3453 142.791 70.863 17.092 1.00 0.00 H TER 23493 WAT 3453 ATOM 23493 O WAT 3454 54.392 5.141 113.500 1.00 0.00 O ATOM 23494 H1 WAT 3454 53.995 6.012 113.479 1.00 0.00 H ATOM 23495 H2 WAT 3454 54.298 4.857 114.410 1.00 0.00 H TER 23497 WAT 3454 ATOM 23497 O WAT 3455 10.829 125.208 84.248 1.00 0.00 O ATOM 23498 H1 WAT 3455 10.072 125.744 84.486 1.00 0.00 H ATOM 23499 H2 WAT 3455 10.528 124.685 83.505 1.00 0.00 H TER 23501 WAT 3455 ATOM 23501 O WAT 3456 144.315 60.122 73.635 1.00 0.00 O ATOM 23502 H1 WAT 3456 144.827 59.599 74.253 1.00 0.00 H ATOM 23503 H2 WAT 3456 144.687 61.001 73.700 1.00 0.00 H TER 23505 WAT 3456 ATOM 23505 O WAT 3457 86.891 139.835 11.785 1.00 0.00 O ATOM 23506 H1 WAT 3457 86.343 139.626 11.028 1.00 0.00 H ATOM 23507 H2 WAT 3457 86.868 140.790 11.842 1.00 0.00 H TER 23509 WAT 3457 ATOM 23509 O WAT 3458 56.185 23.211 73.738 1.00 0.00 O ATOM 23510 H1 WAT 3458 55.387 23.466 74.202 1.00 0.00 H ATOM 23511 H2 WAT 3458 56.069 22.277 73.559 1.00 0.00 H TER 23513 WAT 3458 ATOM 23513 O WAT 3459 84.608 62.986 116.952 1.00 0.00 O ATOM 23514 H1 WAT 3459 85.100 63.772 116.713 1.00 0.00 H ATOM 23515 H2 WAT 3459 84.666 62.948 117.907 1.00 0.00 H TER 23517 WAT 3459 ATOM 23517 O WAT 3460 107.099 139.110 72.575 1.00 0.00 O ATOM 23518 H1 WAT 3460 107.885 139.657 72.583 1.00 0.00 H ATOM 23519 H2 WAT 3460 106.523 139.508 73.228 1.00 0.00 H TER 23521 WAT 3460 ATOM 23521 O WAT 3461 100.475 12.713 59.930 1.00 0.00 O ATOM 23522 H1 WAT 3461 100.630 13.589 59.577 1.00 0.00 H ATOM 23523 H2 WAT 3461 100.994 12.684 60.734 1.00 0.00 H TER 23525 WAT 3461 ATOM 23525 O WAT 3462 106.141 142.642 120.532 1.00 0.00 O ATOM 23526 H1 WAT 3462 106.386 143.566 120.559 1.00 0.00 H ATOM 23527 H2 WAT 3462 106.663 142.235 121.223 1.00 0.00 H TER 23529 WAT 3462 ATOM 23529 O WAT 3463 69.608 38.671 13.147 1.00 0.00 O ATOM 23530 H1 WAT 3463 69.258 39.389 12.621 1.00 0.00 H ATOM 23531 H2 WAT 3463 68.834 38.227 13.492 1.00 0.00 H TER 23533 WAT 3463 ATOM 23533 O WAT 3464 2.556 19.041 93.455 1.00 0.00 O ATOM 23534 H1 WAT 3464 1.670 19.403 93.427 1.00 0.00 H ATOM 23535 H2 WAT 3464 3.071 19.702 93.917 1.00 0.00 H TER 23537 WAT 3464 ATOM 23537 O WAT 3465 93.000 130.896 17.322 1.00 0.00 O ATOM 23538 H1 WAT 3465 93.709 131.535 17.391 1.00 0.00 H ATOM 23539 H2 WAT 3465 92.528 130.971 18.151 1.00 0.00 H TER 23541 WAT 3465 ATOM 23541 O WAT 3466 135.803 56.221 21.258 1.00 0.00 O ATOM 23542 H1 WAT 3466 135.228 56.342 22.014 1.00 0.00 H ATOM 23543 H2 WAT 3466 136.685 56.362 21.604 1.00 0.00 H TER 23545 WAT 3466 ATOM 23545 O WAT 3467 62.855 21.135 107.222 1.00 0.00 O ATOM 23546 H1 WAT 3467 62.219 20.525 107.596 1.00 0.00 H ATOM 23547 H2 WAT 3467 62.323 21.840 106.852 1.00 0.00 H TER 23549 WAT 3467 ATOM 23549 O WAT 3468 14.168 12.372 95.946 1.00 0.00 O ATOM 23550 H1 WAT 3468 13.654 12.126 95.177 1.00 0.00 H ATOM 23551 H2 WAT 3468 13.712 13.133 96.305 1.00 0.00 H TER 23553 WAT 3468 ATOM 23553 O WAT 3469 94.174 125.965 16.287 1.00 0.00 O ATOM 23554 H1 WAT 3469 94.010 126.749 16.812 1.00 0.00 H ATOM 23555 H2 WAT 3469 93.350 125.478 16.319 1.00 0.00 H TER 23557 WAT 3469 ATOM 23557 O WAT 3470 134.959 110.754 90.677 1.00 0.00 O ATOM 23558 H1 WAT 3470 135.076 109.808 90.592 1.00 0.00 H ATOM 23559 H2 WAT 3470 134.049 110.907 90.424 1.00 0.00 H TER 23561 WAT 3470 ATOM 23561 O WAT 3471 98.034 84.496 138.700 1.00 0.00 O ATOM 23562 H1 WAT 3471 97.237 84.224 139.155 1.00 0.00 H ATOM 23563 H2 WAT 3471 97.748 85.199 138.116 1.00 0.00 H TER 23565 WAT 3471 ATOM 23565 O WAT 3472 117.072 1.759 96.724 1.00 0.00 O ATOM 23566 H1 WAT 3472 117.828 2.268 96.433 1.00 0.00 H ATOM 23567 H2 WAT 3472 117.423 0.885 96.895 1.00 0.00 H TER 23569 WAT 3472 ATOM 23569 O WAT 3473 109.313 6.600 104.885 1.00 0.00 O ATOM 23570 H1 WAT 3473 109.557 6.654 103.961 1.00 0.00 H ATOM 23571 H2 WAT 3473 110.112 6.314 105.327 1.00 0.00 H TER 23573 WAT 3473 ATOM 23573 O WAT 3474 102.089 145.100 140.956 1.00 0.00 O ATOM 23574 H1 WAT 3474 101.996 144.644 140.119 1.00 0.00 H ATOM 23575 H2 WAT 3474 102.428 144.435 141.555 1.00 0.00 H TER 23577 WAT 3474 ATOM 23577 O WAT 3475 103.999 45.111 122.737 1.00 0.00 O ATOM 23578 H1 WAT 3475 103.746 45.617 121.965 1.00 0.00 H ATOM 23579 H2 WAT 3475 103.811 44.203 122.501 1.00 0.00 H TER 23581 WAT 3475 ATOM 23581 O WAT 3476 21.269 145.453 137.873 1.00 0.00 O ATOM 23582 H1 WAT 3476 21.567 145.743 138.735 1.00 0.00 H ATOM 23583 H2 WAT 3476 21.626 146.101 137.266 1.00 0.00 H TER 23585 WAT 3476 ATOM 23585 O WAT 3477 107.843 121.158 107.155 1.00 0.00 O ATOM 23586 H1 WAT 3477 107.603 120.234 107.227 1.00 0.00 H ATOM 23587 H2 WAT 3477 108.794 121.151 107.052 1.00 0.00 H TER 23589 WAT 3477 ATOM 23589 O WAT 3478 33.850 18.681 70.903 1.00 0.00 O ATOM 23590 H1 WAT 3478 33.974 18.091 70.160 1.00 0.00 H ATOM 23591 H2 WAT 3478 33.510 19.487 70.515 1.00 0.00 H TER 23593 WAT 3478 ATOM 23593 O WAT 3479 58.782 124.175 152.588 1.00 0.00 O ATOM 23594 H1 WAT 3479 58.279 124.689 153.220 1.00 0.00 H ATOM 23595 H2 WAT 3479 58.380 123.307 152.612 1.00 0.00 H TER 23597 WAT 3479 ATOM 23597 O WAT 3480 73.703 45.268 99.295 1.00 0.00 O ATOM 23598 H1 WAT 3480 74.273 44.503 99.376 1.00 0.00 H ATOM 23599 H2 WAT 3480 73.904 45.799 100.066 1.00 0.00 H TER 23601 WAT 3480 ATOM 23601 O WAT 3481 136.164 76.680 1.132 1.00 0.00 O ATOM 23602 H1 WAT 3481 136.496 75.783 1.089 1.00 0.00 H ATOM 23603 H2 WAT 3481 136.802 77.146 1.672 1.00 0.00 H TER 23605 WAT 3481 ATOM 23605 O WAT 3482 29.738 62.613 111.482 1.00 0.00 O ATOM 23606 H1 WAT 3482 29.199 62.470 112.260 1.00 0.00 H ATOM 23607 H2 WAT 3482 29.190 62.321 110.754 1.00 0.00 H TER 23609 WAT 3482 ATOM 23609 O WAT 3483 115.127 17.759 156.645 1.00 0.00 O ATOM 23610 H1 WAT 3483 114.362 18.330 156.718 1.00 0.00 H ATOM 23611 H2 WAT 3483 114.847 17.057 156.057 1.00 0.00 H TER 23613 WAT 3483 ATOM 23613 O WAT 3484 85.722 113.628 0.235 1.00 0.00 O ATOM 23614 H1 WAT 3484 86.611 113.465 0.548 1.00 0.00 H ATOM 23615 H2 WAT 3484 85.173 113.535 1.013 1.00 0.00 H TER 23617 WAT 3484 ATOM 23617 O WAT 3485 127.095 43.841 85.476 1.00 0.00 O ATOM 23618 H1 WAT 3485 128.017 43.748 85.236 1.00 0.00 H ATOM 23619 H2 WAT 3485 126.819 42.955 85.713 1.00 0.00 H TER 23621 WAT 3485 ATOM 23621 O WAT 3486 42.895 28.586 8.547 1.00 0.00 O ATOM 23622 H1 WAT 3486 43.206 27.722 8.276 1.00 0.00 H ATOM 23623 H2 WAT 3486 42.145 28.404 9.114 1.00 0.00 H TER 23625 WAT 3486 ATOM 23625 O WAT 3487 35.809 108.643 113.277 1.00 0.00 O ATOM 23626 H1 WAT 3487 35.432 108.123 113.987 1.00 0.00 H ATOM 23627 H2 WAT 3487 36.393 108.037 112.821 1.00 0.00 H TER 23629 WAT 3487 ATOM 23629 O WAT 3488 68.927 62.858 17.352 1.00 0.00 O ATOM 23630 H1 WAT 3488 68.160 63.214 16.904 1.00 0.00 H ATOM 23631 H2 WAT 3488 69.645 63.436 17.094 1.00 0.00 H TER 23633 WAT 3488 ATOM 23633 O WAT 3489 77.791 67.415 105.869 1.00 0.00 O ATOM 23634 H1 WAT 3489 77.216 67.395 105.104 1.00 0.00 H ATOM 23635 H2 WAT 3489 77.227 67.705 106.586 1.00 0.00 H TER 23637 WAT 3489 ATOM 23637 O WAT 3490 29.302 54.548 66.967 1.00 0.00 O ATOM 23638 H1 WAT 3490 29.316 54.472 67.921 1.00 0.00 H ATOM 23639 H2 WAT 3490 29.663 55.418 66.791 1.00 0.00 H TER 23641 WAT 3490 ATOM 23641 O WAT 3491 69.347 93.743 148.265 1.00 0.00 O ATOM 23642 H1 WAT 3491 70.148 94.061 148.682 1.00 0.00 H ATOM 23643 H2 WAT 3491 69.475 93.923 147.334 1.00 0.00 H TER 23645 WAT 3491 ATOM 23645 O WAT 3492 25.677 10.233 70.116 1.00 0.00 O ATOM 23646 H1 WAT 3492 25.046 10.384 70.820 1.00 0.00 H ATOM 23647 H2 WAT 3492 25.138 10.112 69.334 1.00 0.00 H TER 23649 WAT 3492 ATOM 23649 O WAT 3493 128.055 58.108 101.668 1.00 0.00 O ATOM 23650 H1 WAT 3493 127.189 58.436 101.910 1.00 0.00 H ATOM 23651 H2 WAT 3493 128.090 58.202 100.716 1.00 0.00 H TER 23653 WAT 3493 ATOM 23653 O WAT 3494 118.836 23.680 76.776 1.00 0.00 O ATOM 23654 H1 WAT 3494 117.895 23.852 76.810 1.00 0.00 H ATOM 23655 H2 WAT 3494 119.172 24.021 77.604 1.00 0.00 H TER 23657 WAT 3494 ATOM 23657 O WAT 3495 47.982 54.920 63.877 1.00 0.00 O ATOM 23658 H1 WAT 3495 48.323 54.839 62.986 1.00 0.00 H ATOM 23659 H2 WAT 3495 47.935 54.020 64.198 1.00 0.00 H TER 23661 WAT 3495 ATOM 23661 O WAT 3496 53.213 42.085 76.059 1.00 0.00 O ATOM 23662 H1 WAT 3496 54.030 41.602 76.181 1.00 0.00 H ATOM 23663 H2 WAT 3496 53.341 42.571 75.244 1.00 0.00 H TER 23665 WAT 3496 ATOM 23665 O WAT 3497 86.637 70.193 96.829 1.00 0.00 O ATOM 23666 H1 WAT 3497 86.291 70.196 97.721 1.00 0.00 H ATOM 23667 H2 WAT 3497 87.350 70.832 96.846 1.00 0.00 H TER 23669 WAT 3497 ATOM 23669 O WAT 3498 117.872 34.583 78.515 1.00 0.00 O ATOM 23670 H1 WAT 3498 117.573 35.299 77.955 1.00 0.00 H ATOM 23671 H2 WAT 3498 117.465 33.801 78.142 1.00 0.00 H TER 23673 WAT 3498 ATOM 23673 O WAT 3499 3.188 2.307 140.154 1.00 0.00 O ATOM 23674 H1 WAT 3499 2.786 2.673 140.941 1.00 0.00 H ATOM 23675 H2 WAT 3499 3.640 3.047 139.749 1.00 0.00 H TER 23677 WAT 3499 ATOM 23677 O WAT 3500 31.342 74.912 148.578 1.00 0.00 O ATOM 23678 H1 WAT 3500 31.575 75.839 148.536 1.00 0.00 H ATOM 23679 H2 WAT 3500 30.402 74.893 148.399 1.00 0.00 H TER 23681 WAT 3500 ATOM 23681 O WAT 3501 30.846 99.148 107.325 1.00 0.00 O ATOM 23682 H1 WAT 3501 30.232 98.563 107.770 1.00 0.00 H ATOM 23683 H2 WAT 3501 31.586 98.587 107.093 1.00 0.00 H TER 23685 WAT 3501 ATOM 23685 O WAT 3502 108.821 126.636 111.031 1.00 0.00 O ATOM 23686 H1 WAT 3502 108.155 126.138 110.557 1.00 0.00 H ATOM 23687 H2 WAT 3502 108.324 127.287 111.527 1.00 0.00 H TER 23689 WAT 3502 ATOM 23689 O WAT 3503 23.218 128.577 59.671 1.00 0.00 O ATOM 23690 H1 WAT 3503 23.335 128.679 60.615 1.00 0.00 H ATOM 23691 H2 WAT 3503 23.769 129.258 59.286 1.00 0.00 H TER 23693 WAT 3503 ATOM 23693 O WAT 3504 5.145 26.504 117.496 1.00 0.00 O ATOM 23694 H1 WAT 3504 5.070 26.704 116.563 1.00 0.00 H ATOM 23695 H2 WAT 3504 6.071 26.638 117.697 1.00 0.00 H TER 23697 WAT 3504 ATOM 23697 O WAT 3505 64.040 68.060 154.730 1.00 0.00 O ATOM 23698 H1 WAT 3505 64.699 68.329 155.371 1.00 0.00 H ATOM 23699 H2 WAT 3505 63.689 67.240 155.077 1.00 0.00 H TER 23701 WAT 3505 ATOM 23701 O WAT 3506 53.118 86.368 9.896 1.00 0.00 O ATOM 23702 H1 WAT 3506 53.740 87.095 9.868 1.00 0.00 H ATOM 23703 H2 WAT 3506 53.610 85.620 9.556 1.00 0.00 H TER 23705 WAT 3506 ATOM 23705 O WAT 3507 31.804 30.716 86.478 1.00 0.00 O ATOM 23706 H1 WAT 3507 32.391 31.266 85.959 1.00 0.00 H ATOM 23707 H2 WAT 3507 32.208 30.688 87.346 1.00 0.00 H TER 23709 WAT 3507 ATOM 23709 O WAT 3508 51.578 15.450 129.592 1.00 0.00 O ATOM 23710 H1 WAT 3508 52.531 15.511 129.658 1.00 0.00 H ATOM 23711 H2 WAT 3508 51.287 16.356 129.485 1.00 0.00 H TER 23713 WAT 3508 ATOM 23713 O WAT 3509 101.048 112.903 155.176 1.00 0.00 O ATOM 23714 H1 WAT 3509 101.566 113.394 154.538 1.00 0.00 H ATOM 23715 H2 WAT 3509 100.283 112.604 154.686 1.00 0.00 H TER 23717 WAT 3509 ATOM 23717 O WAT 3510 55.035 27.921 62.486 1.00 0.00 O ATOM 23718 H1 WAT 3510 54.193 28.264 62.785 1.00 0.00 H ATOM 23719 H2 WAT 3510 54.940 26.970 62.542 1.00 0.00 H TER 23721 WAT 3510 ATOM 23721 O WAT 3511 67.325 89.529 145.264 1.00 0.00 O ATOM 23722 H1 WAT 3511 67.542 88.639 144.985 1.00 0.00 H ATOM 23723 H2 WAT 3511 67.577 89.558 146.187 1.00 0.00 H TER 23725 WAT 3511 ATOM 23725 O WAT 3512 43.483 136.115 106.783 1.00 0.00 O ATOM 23726 H1 WAT 3512 44.409 136.202 106.554 1.00 0.00 H ATOM 23727 H2 WAT 3512 43.015 136.448 106.017 1.00 0.00 H TER 23729 WAT 3512 ATOM 23729 O WAT 3513 110.494 139.393 23.553 1.00 0.00 O ATOM 23730 H1 WAT 3513 111.253 139.884 23.867 1.00 0.00 H ATOM 23731 H2 WAT 3513 110.817 138.499 23.437 1.00 0.00 H TER 23733 WAT 3513 ATOM 23733 O WAT 3514 90.270 71.258 63.920 1.00 0.00 O ATOM 23734 H1 WAT 3514 90.226 71.392 62.973 1.00 0.00 H ATOM 23735 H2 WAT 3514 89.582 71.821 64.274 1.00 0.00 H TER 23737 WAT 3514 ATOM 23737 O WAT 3515 115.458 113.562 70.489 1.00 0.00 O ATOM 23738 H1 WAT 3515 116.140 114.092 70.901 1.00 0.00 H ATOM 23739 H2 WAT 3515 114.707 113.638 71.077 1.00 0.00 H TER 23741 WAT 3515 ATOM 23741 O WAT 3516 90.305 58.952 60.829 1.00 0.00 O ATOM 23742 H1 WAT 3516 90.695 58.751 59.978 1.00 0.00 H ATOM 23743 H2 WAT 3516 90.496 59.880 60.966 1.00 0.00 H TER 23745 WAT 3516 ATOM 23745 O WAT 3517 90.694 81.256 55.149 1.00 0.00 O ATOM 23746 H1 WAT 3517 91.564 80.877 55.020 1.00 0.00 H ATOM 23747 H2 WAT 3517 90.520 81.141 56.083 1.00 0.00 H TER 23749 WAT 3517 ATOM 23749 O WAT 3518 100.721 104.743 127.078 1.00 0.00 O ATOM 23750 H1 WAT 3518 100.499 104.474 126.187 1.00 0.00 H ATOM 23751 H2 WAT 3518 100.539 103.971 127.614 1.00 0.00 H TER 23753 WAT 3518 ATOM 23753 O WAT 3519 131.208 9.779 67.200 1.00 0.00 O ATOM 23754 H1 WAT 3519 131.784 10.542 67.240 1.00 0.00 H ATOM 23755 H2 WAT 3519 131.531 9.199 67.890 1.00 0.00 H TER 23757 WAT 3519 ATOM 23757 O WAT 3520 144.255 31.391 148.925 1.00 0.00 O ATOM 23758 H1 WAT 3520 143.492 30.838 148.756 1.00 0.00 H ATOM 23759 H2 WAT 3520 144.923 30.785 149.244 1.00 0.00 H TER 23761 WAT 3520 ATOM 23761 O WAT 3521 68.856 51.142 94.856 1.00 0.00 O ATOM 23762 H1 WAT 3521 68.460 51.285 95.716 1.00 0.00 H ATOM 23763 H2 WAT 3521 69.352 51.943 94.684 1.00 0.00 H TER 23765 WAT 3521 ATOM 23765 O WAT 3522 66.529 103.817 151.339 1.00 0.00 O ATOM 23766 H1 WAT 3522 66.576 104.613 151.869 1.00 0.00 H ATOM 23767 H2 WAT 3522 67.231 103.916 150.696 1.00 0.00 H TER 23769 WAT 3522 ATOM 23769 O WAT 3523 102.975 141.670 89.376 1.00 0.00 O ATOM 23770 H1 WAT 3523 102.135 141.226 89.263 1.00 0.00 H ATOM 23771 H2 WAT 3523 103.228 141.479 90.279 1.00 0.00 H TER 23773 WAT 3523 ATOM 23773 O WAT 3524 50.754 106.351 133.844 1.00 0.00 O ATOM 23774 H1 WAT 3524 51.441 106.968 133.592 1.00 0.00 H ATOM 23775 H2 WAT 3524 50.002 106.903 134.059 1.00 0.00 H TER 23777 WAT 3524 ATOM 23777 O WAT 3525 22.829 91.941 68.886 1.00 0.00 O ATOM 23778 H1 WAT 3525 22.224 91.352 69.336 1.00 0.00 H ATOM 23779 H2 WAT 3525 23.544 92.073 69.510 1.00 0.00 H TER 23781 WAT 3525 ATOM 23781 O WAT 3526 111.598 33.966 141.242 1.00 0.00 O ATOM 23782 H1 WAT 3526 111.754 33.372 140.507 1.00 0.00 H ATOM 23783 H2 WAT 3526 111.966 33.512 142.000 1.00 0.00 H TER 23785 WAT 3526 ATOM 23785 O WAT 3527 9.441 10.008 84.639 1.00 0.00 O ATOM 23786 H1 WAT 3527 8.632 10.134 84.142 1.00 0.00 H ATOM 23787 H2 WAT 3527 9.217 9.351 85.298 1.00 0.00 H TER 23789 WAT 3527 ATOM 23789 O WAT 3528 16.279 6.084 108.909 1.00 0.00 O ATOM 23790 H1 WAT 3528 15.634 6.027 108.204 1.00 0.00 H ATOM 23791 H2 WAT 3528 16.503 5.174 109.102 1.00 0.00 H TER 23793 WAT 3528 ATOM 23793 O WAT 3529 121.976 62.886 103.227 1.00 0.00 O ATOM 23794 H1 WAT 3529 121.365 63.605 103.065 1.00 0.00 H ATOM 23795 H2 WAT 3529 121.661 62.174 102.670 1.00 0.00 H TER 23797 WAT 3529 ATOM 23797 O WAT 3530 123.578 44.169 132.724 1.00 0.00 O ATOM 23798 H1 WAT 3530 122.839 43.560 132.707 1.00 0.00 H ATOM 23799 H2 WAT 3530 123.174 45.033 132.796 1.00 0.00 H TER 23801 WAT 3530 ATOM 23801 O WAT 3531 73.591 88.401 14.834 1.00 0.00 O ATOM 23802 H1 WAT 3531 74.519 88.179 14.760 1.00 0.00 H ATOM 23803 H2 WAT 3531 73.566 89.120 15.466 1.00 0.00 H TER 23805 WAT 3531 ATOM 23805 O WAT 3532 120.541 141.221 2.355 1.00 0.00 O ATOM 23806 H1 WAT 3532 120.623 142.171 2.432 1.00 0.00 H ATOM 23807 H2 WAT 3532 121.400 140.884 2.610 1.00 0.00 H TER 23809 WAT 3532 ATOM 23809 O WAT 3533 57.691 123.235 63.867 1.00 0.00 O ATOM 23810 H1 WAT 3533 57.595 122.294 63.726 1.00 0.00 H ATOM 23811 H2 WAT 3533 57.207 123.407 64.675 1.00 0.00 H TER 23813 WAT 3533 ATOM 23813 O WAT 3534 93.480 21.578 131.290 1.00 0.00 O ATOM 23814 H1 WAT 3534 92.761 21.064 130.923 1.00 0.00 H ATOM 23815 H2 WAT 3534 93.458 21.386 132.228 1.00 0.00 H TER 23817 WAT 3534 ATOM 23817 O WAT 3535 141.162 108.217 107.703 1.00 0.00 O ATOM 23818 H1 WAT 3535 141.123 108.174 106.747 1.00 0.00 H ATOM 23819 H2 WAT 3535 141.971 108.693 107.888 1.00 0.00 H TER 23821 WAT 3535 ATOM 23821 O WAT 3536 137.546 144.150 97.292 1.00 0.00 O ATOM 23822 H1 WAT 3536 137.140 143.297 97.138 1.00 0.00 H ATOM 23823 H2 WAT 3536 136.858 144.783 97.086 1.00 0.00 H TER 23825 WAT 3536 ATOM 23825 O WAT 3537 16.037 11.303 122.117 1.00 0.00 O ATOM 23826 H1 WAT 3537 16.254 12.189 122.406 1.00 0.00 H ATOM 23827 H2 WAT 3537 15.102 11.214 122.301 1.00 0.00 H TER 23829 WAT 3537 ATOM 23829 O WAT 3538 92.953 81.086 20.486 1.00 0.00 O ATOM 23830 H1 WAT 3538 93.264 81.632 21.208 1.00 0.00 H ATOM 23831 H2 WAT 3538 93.738 80.642 20.166 1.00 0.00 H TER 23833 WAT 3538 ATOM 23833 O WAT 3539 120.958 29.919 92.973 1.00 0.00 O ATOM 23834 H1 WAT 3539 121.423 30.482 93.592 1.00 0.00 H ATOM 23835 H2 WAT 3539 121.351 30.121 92.124 1.00 0.00 H TER 23837 WAT 3539 ATOM 23837 O WAT 3540 13.550 105.435 74.346 1.00 0.00 O ATOM 23838 H1 WAT 3540 14.476 105.195 74.350 1.00 0.00 H ATOM 23839 H2 WAT 3540 13.340 105.565 73.421 1.00 0.00 H TER 23841 WAT 3540 ATOM 23841 O WAT 3541 21.324 119.057 23.789 1.00 0.00 O ATOM 23842 H1 WAT 3541 21.937 119.453 23.170 1.00 0.00 H ATOM 23843 H2 WAT 3541 21.202 118.164 23.468 1.00 0.00 H TER 23845 WAT 3541 ATOM 23845 O WAT 3542 35.776 86.125 68.906 1.00 0.00 O ATOM 23846 H1 WAT 3542 36.366 85.388 68.749 1.00 0.00 H ATOM 23847 H2 WAT 3542 35.032 85.743 69.370 1.00 0.00 H TER 23849 WAT 3542 ATOM 23849 O WAT 3543 37.282 110.817 158.679 1.00 0.00 O ATOM 23850 H1 WAT 3543 37.447 111.748 158.828 1.00 0.00 H ATOM 23851 H2 WAT 3543 38.150 110.414 158.690 1.00 0.00 H TER 23853 WAT 3543 ATOM 23853 O WAT 3544 96.847 29.915 102.119 1.00 0.00 O ATOM 23854 H1 WAT 3544 97.125 29.281 102.779 1.00 0.00 H ATOM 23855 H2 WAT 3544 96.165 29.463 101.623 1.00 0.00 H TER 23857 WAT 3544 ATOM 23857 O WAT 3545 138.015 7.458 134.705 1.00 0.00 O ATOM 23858 H1 WAT 3545 137.953 6.651 134.195 1.00 0.00 H ATOM 23859 H2 WAT 3545 137.604 8.123 134.153 1.00 0.00 H TER 23861 WAT 3545 ATOM 23861 O WAT 3546 75.675 10.124 111.753 1.00 0.00 O ATOM 23862 H1 WAT 3546 75.280 10.144 110.882 1.00 0.00 H ATOM 23863 H2 WAT 3546 74.929 10.135 112.354 1.00 0.00 H TER 23865 WAT 3546 ATOM 23865 O WAT 3547 40.437 16.747 130.375 1.00 0.00 O ATOM 23866 H1 WAT 3547 39.952 15.923 130.336 1.00 0.00 H ATOM 23867 H2 WAT 3547 40.939 16.769 129.560 1.00 0.00 H TER 23869 WAT 3547 ATOM 23869 O WAT 3548 82.355 72.977 75.887 1.00 0.00 O ATOM 23870 H1 WAT 3548 83.060 72.806 76.510 1.00 0.00 H ATOM 23871 H2 WAT 3548 81.573 72.617 76.305 1.00 0.00 H TER 23873 WAT 3548 ATOM 23873 O WAT 3549 92.739 42.657 8.608 1.00 0.00 O ATOM 23874 H1 WAT 3549 92.741 42.841 7.668 1.00 0.00 H ATOM 23875 H2 WAT 3549 91.903 42.217 8.764 1.00 0.00 H TER 23877 WAT 3549 ATOM 23877 O WAT 3550 113.116 33.762 119.454 1.00 0.00 O ATOM 23878 H1 WAT 3550 113.354 34.520 119.988 1.00 0.00 H ATOM 23879 H2 WAT 3550 112.416 33.333 119.946 1.00 0.00 H TER 23881 WAT 3550 ATOM 23881 O WAT 3551 30.034 30.649 100.618 1.00 0.00 O ATOM 23882 H1 WAT 3551 30.763 30.293 100.110 1.00 0.00 H ATOM 23883 H2 WAT 3551 30.276 30.487 101.530 1.00 0.00 H TER 23885 WAT 3551 ATOM 23885 O WAT 3552 128.676 39.008 6.369 1.00 0.00 O ATOM 23886 H1 WAT 3552 129.545 38.828 6.727 1.00 0.00 H ATOM 23887 H2 WAT 3552 128.792 38.953 5.420 1.00 0.00 H TER 23889 WAT 3552 ATOM 23889 O WAT 3553 126.984 133.062 96.083 1.00 0.00 O ATOM 23890 H1 WAT 3553 126.600 132.639 96.851 1.00 0.00 H ATOM 23891 H2 WAT 3553 127.925 133.068 96.259 1.00 0.00 H TER 23893 WAT 3553 ATOM 23893 O WAT 3554 132.871 109.394 75.750 1.00 0.00 O ATOM 23894 H1 WAT 3554 132.722 108.478 75.985 1.00 0.00 H ATOM 23895 H2 WAT 3554 132.365 109.892 76.392 1.00 0.00 H TER 23897 WAT 3554 ATOM 23897 O WAT 3555 37.619 20.321 3.998 1.00 0.00 O ATOM 23898 H1 WAT 3555 38.218 19.828 3.437 1.00 0.00 H ATOM 23899 H2 WAT 3555 37.018 19.661 4.344 1.00 0.00 H TER 23901 WAT 3555 ATOM 23901 O WAT 3556 6.040 131.474 143.336 1.00 0.00 O ATOM 23902 H1 WAT 3556 5.428 130.900 143.796 1.00 0.00 H ATOM 23903 H2 WAT 3556 5.955 131.228 142.415 1.00 0.00 H TER 23905 WAT 3556 ATOM 23905 O WAT 3557 107.051 89.273 134.225 1.00 0.00 O ATOM 23906 H1 WAT 3557 106.422 89.883 134.609 1.00 0.00 H ATOM 23907 H2 WAT 3557 107.884 89.494 134.641 1.00 0.00 H TER 23909 WAT 3557 ATOM 23909 O WAT 3558 40.361 10.201 81.622 1.00 0.00 O ATOM 23910 H1 WAT 3558 39.884 10.459 80.834 1.00 0.00 H ATOM 23911 H2 WAT 3558 39.688 10.132 82.299 1.00 0.00 H TER 23913 WAT 3558 ATOM 23913 O WAT 3559 40.662 18.486 139.303 1.00 0.00 O ATOM 23914 H1 WAT 3559 40.600 19.440 139.350 1.00 0.00 H ATOM 23915 H2 WAT 3559 40.196 18.255 138.500 1.00 0.00 H TER 23917 WAT 3559 ATOM 23917 O WAT 3560 103.281 5.173 85.957 1.00 0.00 O ATOM 23918 H1 WAT 3560 103.601 5.897 86.495 1.00 0.00 H ATOM 23919 H2 WAT 3560 102.540 4.819 86.447 1.00 0.00 H TER 23921 WAT 3560 ATOM 23921 O WAT 3561 109.716 97.871 120.758 1.00 0.00 O ATOM 23922 H1 WAT 3561 110.216 98.300 120.063 1.00 0.00 H ATOM 23923 H2 WAT 3561 110.261 97.966 121.539 1.00 0.00 H TER 23925 WAT 3561 ATOM 23925 O WAT 3562 22.927 130.270 82.863 1.00 0.00 O ATOM 23926 H1 WAT 3562 23.086 130.695 82.020 1.00 0.00 H ATOM 23927 H2 WAT 3562 22.561 129.415 82.634 1.00 0.00 H TER 23929 WAT 3562 ATOM 23929 O WAT 3563 125.958 44.916 70.832 1.00 0.00 O ATOM 23930 H1 WAT 3563 126.408 44.099 70.619 1.00 0.00 H ATOM 23931 H2 WAT 3563 126.657 45.568 70.882 1.00 0.00 H TER 23933 WAT 3563 ATOM 23933 O WAT 3564 135.546 12.852 72.111 1.00 0.00 O ATOM 23934 H1 WAT 3564 135.211 13.744 72.198 1.00 0.00 H ATOM 23935 H2 WAT 3564 135.217 12.554 71.262 1.00 0.00 H TER 23937 WAT 3564 ATOM 23937 O WAT 3565 53.503 34.818 157.557 1.00 0.00 O ATOM 23938 H1 WAT 3565 53.372 35.764 157.626 1.00 0.00 H ATOM 23939 H2 WAT 3565 52.617 34.457 157.507 1.00 0.00 H TER 23941 WAT 3565 ATOM 23941 O WAT 3566 80.343 97.480 77.834 1.00 0.00 O ATOM 23942 H1 WAT 3566 80.538 96.543 77.844 1.00 0.00 H ATOM 23943 H2 WAT 3566 80.888 97.845 78.531 1.00 0.00 H TER 23945 WAT 3566 ATOM 23945 O WAT 3567 44.710 39.050 26.567 1.00 0.00 O ATOM 23946 H1 WAT 3567 45.609 38.919 26.268 1.00 0.00 H ATOM 23947 H2 WAT 3567 44.218 39.248 25.770 1.00 0.00 H TER 23949 WAT 3567 ATOM 23949 O WAT 3568 128.475 14.120 104.742 1.00 0.00 O ATOM 23950 H1 WAT 3568 129.116 13.455 104.992 1.00 0.00 H ATOM 23951 H2 WAT 3568 127.901 14.197 105.504 1.00 0.00 H TER 23953 WAT 3568 ATOM 23953 O WAT 3569 18.639 127.970 133.440 1.00 0.00 O ATOM 23954 H1 WAT 3569 18.529 128.221 134.357 1.00 0.00 H ATOM 23955 H2 WAT 3569 19.509 128.293 133.206 1.00 0.00 H TER 23957 WAT 3569 ATOM 23957 O WAT 3570 74.276 24.543 79.896 1.00 0.00 O ATOM 23958 H1 WAT 3570 74.338 25.093 80.677 1.00 0.00 H ATOM 23959 H2 WAT 3570 74.737 23.738 80.133 1.00 0.00 H TER 23961 WAT 3570 ATOM 23961 O WAT 3571 97.268 10.046 84.661 1.00 0.00 O ATOM 23962 H1 WAT 3571 97.293 10.830 84.112 1.00 0.00 H ATOM 23963 H2 WAT 3571 96.396 9.680 84.516 1.00 0.00 H TER 23965 WAT 3571 ATOM 23965 O WAT 3572 12.575 41.670 112.370 1.00 0.00 O ATOM 23966 H1 WAT 3572 12.924 40.929 112.865 1.00 0.00 H ATOM 23967 H2 WAT 3572 12.868 42.441 112.854 1.00 0.00 H TER 23969 WAT 3572 ATOM 23969 O WAT 3573 142.126 124.128 68.017 1.00 0.00 O ATOM 23970 H1 WAT 3573 142.204 124.761 68.731 1.00 0.00 H ATOM 23971 H2 WAT 3573 142.966 123.668 68.012 1.00 0.00 H TER 23973 WAT 3573 ATOM 23973 O WAT 3574 33.323 131.834 55.443 1.00 0.00 O ATOM 23974 H1 WAT 3574 33.869 132.295 54.806 1.00 0.00 H ATOM 23975 H2 WAT 3574 33.395 130.911 55.197 1.00 0.00 H TER 23977 WAT 3574 ATOM 23977 O WAT 3575 57.248 64.890 107.071 1.00 0.00 O ATOM 23978 H1 WAT 3575 56.374 65.044 106.714 1.00 0.00 H ATOM 23979 H2 WAT 3575 57.174 65.124 107.997 1.00 0.00 H TER 23981 WAT 3575 ATOM 23981 O WAT 3576 118.838 46.918 101.364 1.00 0.00 O ATOM 23982 H1 WAT 3576 118.642 47.855 101.360 1.00 0.00 H ATOM 23983 H2 WAT 3576 118.492 46.605 102.200 1.00 0.00 H TER 23985 WAT 3576 ATOM 23985 O WAT 3577 5.479 129.894 95.324 1.00 0.00 O ATOM 23986 H1 WAT 3577 6.315 129.622 95.702 1.00 0.00 H ATOM 23987 H2 WAT 3577 5.718 130.352 94.518 1.00 0.00 H TER 23989 WAT 3577 ATOM 23989 O WAT 3578 121.988 29.497 102.967 1.00 0.00 O ATOM 23990 H1 WAT 3578 121.357 30.193 103.152 1.00 0.00 H ATOM 23991 H2 WAT 3578 122.026 29.456 102.011 1.00 0.00 H TER 23993 WAT 3578 ATOM 23993 O WAT 3579 18.400 138.043 118.134 1.00 0.00 O ATOM 23994 H1 WAT 3579 18.932 137.289 118.390 1.00 0.00 H ATOM 23995 H2 WAT 3579 19.035 138.691 117.829 1.00 0.00 H TER 23997 WAT 3579 ATOM 23997 O WAT 3580 122.955 47.976 7.387 1.00 0.00 O ATOM 23998 H1 WAT 3580 122.814 48.235 6.477 1.00 0.00 H ATOM 23999 H2 WAT 3580 122.685 47.058 7.420 1.00 0.00 H TER 24001 WAT 3580 ATOM 24001 O WAT 3581 86.040 132.261 91.606 1.00 0.00 O ATOM 24002 H1 WAT 3581 86.730 131.607 91.492 1.00 0.00 H ATOM 24003 H2 WAT 3581 85.612 132.017 92.427 1.00 0.00 H TER 24005 WAT 3581 ATOM 24005 O WAT 3582 61.621 62.440 111.732 1.00 0.00 O ATOM 24006 H1 WAT 3582 61.244 63.287 111.970 1.00 0.00 H ATOM 24007 H2 WAT 3582 61.551 62.407 110.778 1.00 0.00 H TER 24009 WAT 3582 ATOM 24009 O WAT 3583 95.673 116.887 153.272 1.00 0.00 O ATOM 24010 H1 WAT 3583 96.147 116.290 153.851 1.00 0.00 H ATOM 24011 H2 WAT 3583 95.177 116.312 152.689 1.00 0.00 H TER 24013 WAT 3583 ATOM 24013 O WAT 3584 126.439 74.489 10.703 1.00 0.00 O ATOM 24014 H1 WAT 3584 127.104 73.965 10.258 1.00 0.00 H ATOM 24015 H2 WAT 3584 126.921 74.959 11.384 1.00 0.00 H TER 24017 WAT 3584 ATOM 24017 O WAT 3585 12.741 120.712 98.650 1.00 0.00 O ATOM 24018 H1 WAT 3585 12.653 120.925 99.579 1.00 0.00 H ATOM 24019 H2 WAT 3585 13.333 119.960 98.631 1.00 0.00 H TER 24021 WAT 3585 ATOM 24021 O WAT 3586 108.792 129.434 112.314 1.00 0.00 O ATOM 24022 H1 WAT 3586 109.310 129.272 113.102 1.00 0.00 H ATOM 24023 H2 WAT 3586 108.809 130.386 112.208 1.00 0.00 H TER 24025 WAT 3586 ATOM 24025 O WAT 3587 78.958 142.250 113.826 1.00 0.00 O ATOM 24026 H1 WAT 3587 78.846 141.367 113.474 1.00 0.00 H ATOM 24027 H2 WAT 3587 78.320 142.307 114.538 1.00 0.00 H TER 24029 WAT 3587 ATOM 24029 O WAT 3588 68.978 44.427 125.056 1.00 0.00 O ATOM 24030 H1 WAT 3588 69.579 44.353 125.797 1.00 0.00 H ATOM 24031 H2 WAT 3588 69.502 44.826 124.362 1.00 0.00 H TER 24033 WAT 3588 ATOM 24033 O WAT 3589 83.173 57.986 63.424 1.00 0.00 O ATOM 24034 H1 WAT 3589 83.858 58.611 63.185 1.00 0.00 H ATOM 24035 H2 WAT 3589 83.183 57.338 62.720 1.00 0.00 H TER 24037 WAT 3589 ATOM 24037 O WAT 3590 76.180 39.582 118.285 1.00 0.00 O ATOM 24038 H1 WAT 3590 77.078 39.496 118.605 1.00 0.00 H ATOM 24039 H2 WAT 3590 75.994 38.742 117.866 1.00 0.00 H TER 24041 WAT 3590 ATOM 24041 O WAT 3591 42.059 81.893 103.400 1.00 0.00 O ATOM 24042 H1 WAT 3591 42.659 82.040 104.131 1.00 0.00 H ATOM 24043 H2 WAT 3591 41.798 80.976 103.484 1.00 0.00 H TER 24045 WAT 3591 ATOM 24045 O WAT 3592 58.600 76.475 15.823 1.00 0.00 O ATOM 24046 H1 WAT 3592 59.422 76.353 16.298 1.00 0.00 H ATOM 24047 H2 WAT 3592 58.100 77.086 16.363 1.00 0.00 H TER 24049 WAT 3592 ATOM 24049 O WAT 3593 29.781 17.296 12.266 1.00 0.00 O ATOM 24050 H1 WAT 3593 29.890 18.083 11.732 1.00 0.00 H ATOM 24051 H2 WAT 3593 29.154 17.551 12.942 1.00 0.00 H TER 24053 WAT 3593 ATOM 24053 O WAT 3594 132.017 133.058 64.656 1.00 0.00 O ATOM 24054 H1 WAT 3594 131.616 132.284 64.260 1.00 0.00 H ATOM 24055 H2 WAT 3594 132.625 133.379 63.990 1.00 0.00 H TER 24057 WAT 3594 ATOM 24057 O WAT 3595 118.778 74.033 23.523 1.00 0.00 O ATOM 24058 H1 WAT 3595 118.428 74.490 24.288 1.00 0.00 H ATOM 24059 H2 WAT 3595 119.039 73.174 23.856 1.00 0.00 H TER 24061 WAT 3595 ATOM 24061 O WAT 3596 69.382 143.594 88.215 1.00 0.00 O ATOM 24062 H1 WAT 3596 68.735 142.900 88.337 1.00 0.00 H ATOM 24063 H2 WAT 3596 68.987 144.365 88.624 1.00 0.00 H TER 24065 WAT 3596 ATOM 24065 O WAT 3597 103.392 42.247 121.930 1.00 0.00 O ATOM 24066 H1 WAT 3597 103.736 41.767 121.176 1.00 0.00 H ATOM 24067 H2 WAT 3597 102.454 42.327 121.754 1.00 0.00 H TER 24069 WAT 3597 ATOM 24069 O WAT 3598 112.254 126.495 74.466 1.00 0.00 O ATOM 24070 H1 WAT 3598 111.455 127.022 74.495 1.00 0.00 H ATOM 24071 H2 WAT 3598 112.939 127.082 74.786 1.00 0.00 H TER 24073 WAT 3598 ATOM 24073 O WAT 3599 69.194 50.540 102.015 1.00 0.00 O ATOM 24074 H1 WAT 3599 69.794 50.869 101.346 1.00 0.00 H ATOM 24075 H2 WAT 3599 69.014 49.637 101.753 1.00 0.00 H TER 24077 WAT 3599 ATOM 24077 O WAT 3600 128.482 1.934 52.400 1.00 0.00 O ATOM 24078 H1 WAT 3600 127.659 2.368 52.174 1.00 0.00 H ATOM 24079 H2 WAT 3600 128.796 2.405 53.172 1.00 0.00 H TER 24081 WAT 3600 ATOM 24081 O WAT 3601 112.270 129.219 155.867 1.00 0.00 O ATOM 24082 H1 WAT 3601 113.035 129.165 155.295 1.00 0.00 H ATOM 24083 H2 WAT 3601 112.495 128.672 156.620 1.00 0.00 H TER 24085 WAT 3601 ATOM 24085 O WAT 3602 29.153 138.852 158.515 1.00 0.00 O ATOM 24086 H1 WAT 3602 28.569 138.096 158.452 1.00 0.00 H ATOM 24087 H2 WAT 3602 29.614 138.731 159.345 1.00 0.00 H TER 24089 WAT 3602 ATOM 24089 O WAT 3603 17.179 127.078 63.268 1.00 0.00 O ATOM 24090 H1 WAT 3603 17.431 127.305 62.373 1.00 0.00 H ATOM 24091 H2 WAT 3603 17.101 127.920 63.716 1.00 0.00 H TER 24093 WAT 3603 ATOM 24093 O WAT 3604 73.662 82.792 142.484 1.00 0.00 O ATOM 24094 H1 WAT 3604 73.532 82.504 141.580 1.00 0.00 H ATOM 24095 H2 WAT 3604 74.063 83.657 142.404 1.00 0.00 H TER 24097 WAT 3604 ATOM 24097 O WAT 3605 58.196 7.157 85.706 1.00 0.00 O ATOM 24098 H1 WAT 3605 57.403 7.285 85.185 1.00 0.00 H ATOM 24099 H2 WAT 3605 58.909 7.433 85.129 1.00 0.00 H TER 24101 WAT 3605 ATOM 24101 O WAT 3606 37.296 119.697 96.608 1.00 0.00 O ATOM 24102 H1 WAT 3606 38.202 119.388 96.597 1.00 0.00 H ATOM 24103 H2 WAT 3606 37.368 120.651 96.639 1.00 0.00 H TER 24105 WAT 3606 ATOM 24105 O WAT 3607 22.735 88.100 0.571 1.00 0.00 O ATOM 24106 H1 WAT 3607 22.926 88.970 0.922 1.00 0.00 H ATOM 24107 H2 WAT 3607 23.303 87.511 1.068 1.00 0.00 H TER 24109 WAT 3607 ATOM 24109 O WAT 3608 132.194 36.299 135.203 1.00 0.00 O ATOM 24110 H1 WAT 3608 132.120 35.532 134.635 1.00 0.00 H ATOM 24111 H2 WAT 3608 131.908 35.989 136.063 1.00 0.00 H TER 24113 WAT 3608 ATOM 24113 O WAT 3609 138.421 35.494 75.062 1.00 0.00 O ATOM 24114 H1 WAT 3609 137.742 35.293 74.417 1.00 0.00 H ATOM 24115 H2 WAT 3609 138.927 36.202 74.664 1.00 0.00 H TER 24117 WAT 3609 ATOM 24117 O WAT 3610 5.234 32.053 73.038 1.00 0.00 O ATOM 24118 H1 WAT 3610 5.465 31.162 73.300 1.00 0.00 H ATOM 24119 H2 WAT 3610 6.006 32.575 73.259 1.00 0.00 H TER 24121 WAT 3610 ATOM 24121 O WAT 3611 69.751 115.946 59.945 1.00 0.00 O ATOM 24122 H1 WAT 3611 70.040 115.123 59.551 1.00 0.00 H ATOM 24123 H2 WAT 3611 68.798 115.867 59.993 1.00 0.00 H TER 24125 WAT 3611 ATOM 24125 O WAT 3612 6.764 31.763 132.207 1.00 0.00 O ATOM 24126 H1 WAT 3612 7.397 31.371 132.809 1.00 0.00 H ATOM 24127 H2 WAT 3612 6.059 32.078 132.772 1.00 0.00 H TER 24129 WAT 3612 ATOM 24129 O WAT 3613 139.280 70.295 1.523 1.00 0.00 O ATOM 24130 H1 WAT 3613 139.803 71.096 1.565 1.00 0.00 H ATOM 24131 H2 WAT 3613 139.251 69.981 2.426 1.00 0.00 H TER 24133 WAT 3613 ATOM 24133 O WAT 3614 114.955 135.471 101.214 1.00 0.00 O ATOM 24134 H1 WAT 3614 114.583 135.361 102.089 1.00 0.00 H ATOM 24135 H2 WAT 3614 115.350 134.622 101.014 1.00 0.00 H TER 24137 WAT 3614 ATOM 24137 O WAT 3615 100.733 71.469 137.235 1.00 0.00 O ATOM 24138 H1 WAT 3615 100.698 71.234 138.162 1.00 0.00 H ATOM 24139 H2 WAT 3615 99.843 71.321 136.916 1.00 0.00 H TER 24141 WAT 3615 ATOM 24141 O WAT 3616 71.721 115.229 141.706 1.00 0.00 O ATOM 24142 H1 WAT 3616 71.162 115.292 140.931 1.00 0.00 H ATOM 24143 H2 WAT 3616 71.115 115.290 142.444 1.00 0.00 H TER 24145 WAT 3616 ATOM 24145 O WAT 3617 48.429 28.955 124.885 1.00 0.00 O ATOM 24146 H1 WAT 3617 48.156 28.810 125.791 1.00 0.00 H ATOM 24147 H2 WAT 3617 48.739 28.099 124.588 1.00 0.00 H TER 24149 WAT 3617 ATOM 24149 O WAT 3618 61.539 128.518 154.375 1.00 0.00 O ATOM 24150 H1 WAT 3618 61.502 127.851 155.061 1.00 0.00 H ATOM 24151 H2 WAT 3618 62.474 128.667 154.237 1.00 0.00 H TER 24153 WAT 3618 ATOM 24153 O WAT 3619 39.707 64.110 148.646 1.00 0.00 O ATOM 24154 H1 WAT 3619 40.261 64.885 148.550 1.00 0.00 H ATOM 24155 H2 WAT 3619 38.954 64.282 148.080 1.00 0.00 H TER 24157 WAT 3619 ATOM 24157 O WAT 3620 50.978 29.029 133.817 1.00 0.00 O ATOM 24158 H1 WAT 3620 50.223 28.653 133.364 1.00 0.00 H ATOM 24159 H2 WAT 3620 51.572 28.291 133.945 1.00 0.00 H TER 24161 WAT 3620 ATOM 24161 O WAT 3621 22.884 102.838 59.135 1.00 0.00 O ATOM 24162 H1 WAT 3621 22.254 102.192 59.453 1.00 0.00 H ATOM 24163 H2 WAT 3621 22.482 103.683 59.335 1.00 0.00 H TER 24165 WAT 3621 ATOM 24165 O WAT 3622 133.145 47.901 65.205 1.00 0.00 O ATOM 24166 H1 WAT 3622 132.298 48.295 65.415 1.00 0.00 H ATOM 24167 H2 WAT 3622 133.000 46.959 65.297 1.00 0.00 H TER 24169 WAT 3622 ATOM 24169 O WAT 3623 57.825 96.574 155.966 1.00 0.00 O ATOM 24170 H1 WAT 3623 58.104 97.025 155.169 1.00 0.00 H ATOM 24171 H2 WAT 3623 58.624 96.173 156.307 1.00 0.00 H TER 24173 WAT 3623 ATOM 24173 O WAT 3624 45.382 125.305 92.419 1.00 0.00 O ATOM 24174 H1 WAT 3624 46.289 125.162 92.687 1.00 0.00 H ATOM 24175 H2 WAT 3624 45.440 125.547 91.494 1.00 0.00 H TER 24177 WAT 3624 ATOM 24177 O WAT 3625 112.870 83.159 2.495 1.00 0.00 O ATOM 24178 H1 WAT 3625 112.122 83.556 2.941 1.00 0.00 H ATOM 24179 H2 WAT 3625 112.916 82.271 2.849 1.00 0.00 H TER 24181 WAT 3625 ATOM 24181 O WAT 3626 137.364 121.142 20.421 1.00 0.00 O ATOM 24182 H1 WAT 3626 136.889 120.325 20.577 1.00 0.00 H ATOM 24183 H2 WAT 3626 137.924 121.244 21.190 1.00 0.00 H TER 24185 WAT 3626 ATOM 24185 O WAT 3627 80.774 35.601 156.191 1.00 0.00 O ATOM 24186 H1 WAT 3627 81.350 35.030 156.700 1.00 0.00 H ATOM 24187 H2 WAT 3627 80.040 35.785 156.777 1.00 0.00 H TER 24189 WAT 3627 ATOM 24189 O WAT 3628 41.858 45.580 118.197 1.00 0.00 O ATOM 24190 H1 WAT 3628 41.148 45.147 118.671 1.00 0.00 H ATOM 24191 H2 WAT 3628 41.522 46.456 118.008 1.00 0.00 H TER 24193 WAT 3628 ATOM 24193 O WAT 3629 120.202 26.908 142.575 1.00 0.00 O ATOM 24194 H1 WAT 3629 119.506 26.816 143.225 1.00 0.00 H ATOM 24195 H2 WAT 3629 119.978 26.275 141.893 1.00 0.00 H TER 24197 WAT 3629 ATOM 24197 O WAT 3630 102.198 135.014 94.618 1.00 0.00 O ATOM 24198 H1 WAT 3630 103.132 135.224 94.603 1.00 0.00 H ATOM 24199 H2 WAT 3630 102.054 134.629 95.483 1.00 0.00 H TER 24201 WAT 3630 ATOM 24201 O WAT 3631 73.414 82.824 158.084 1.00 0.00 O ATOM 24202 H1 WAT 3631 74.253 82.529 158.438 1.00 0.00 H ATOM 24203 H2 WAT 3631 72.771 82.218 158.453 1.00 0.00 H TER 24205 WAT 3631 ATOM 24205 O WAT 3632 143.745 116.956 113.568 1.00 0.00 O ATOM 24206 H1 WAT 3632 144.305 116.706 112.834 1.00 0.00 H ATOM 24207 H2 WAT 3632 144.207 116.634 114.342 1.00 0.00 H TER 24209 WAT 3632 ATOM 24209 O WAT 3633 34.704 122.638 8.449 1.00 0.00 O ATOM 24210 H1 WAT 3633 35.329 121.997 8.790 1.00 0.00 H ATOM 24211 H2 WAT 3633 34.518 122.340 7.559 1.00 0.00 H TER 24213 WAT 3633 ATOM 24213 O WAT 3634 46.558 64.212 128.523 1.00 0.00 O ATOM 24214 H1 WAT 3634 46.014 64.977 128.335 1.00 0.00 H ATOM 24215 H2 WAT 3634 46.334 63.974 129.422 1.00 0.00 H TER 24217 WAT 3634 ATOM 24217 O WAT 3635 44.671 42.513 16.453 1.00 0.00 O ATOM 24218 H1 WAT 3635 45.337 42.918 15.897 1.00 0.00 H ATOM 24219 H2 WAT 3635 45.164 41.943 17.042 1.00 0.00 H TER 24221 WAT 3635 ATOM 24221 O WAT 3636 31.462 73.331 122.818 1.00 0.00 O ATOM 24222 H1 WAT 3636 30.735 73.425 122.203 1.00 0.00 H ATOM 24223 H2 WAT 3636 31.434 74.128 123.346 1.00 0.00 H TER 24225 WAT 3636 ATOM 24225 O WAT 3637 140.443 80.191 15.602 1.00 0.00 O ATOM 24226 H1 WAT 3637 141.329 79.894 15.394 1.00 0.00 H ATOM 24227 H2 WAT 3637 139.982 79.399 15.875 1.00 0.00 H TER 24229 WAT 3637 ATOM 24229 O WAT 3638 89.030 5.903 5.356 1.00 0.00 O ATOM 24230 H1 WAT 3638 88.390 6.515 5.718 1.00 0.00 H ATOM 24231 H2 WAT 3638 89.711 6.462 4.981 1.00 0.00 H TER 24233 WAT 3638 ATOM 24233 O WAT 3639 37.902 77.573 135.880 1.00 0.00 O ATOM 24234 H1 WAT 3639 38.150 77.617 134.957 1.00 0.00 H ATOM 24235 H2 WAT 3639 37.911 76.638 136.087 1.00 0.00 H TER 24237 WAT 3639 ATOM 24237 O WAT 3640 3.260 40.337 136.960 1.00 0.00 O ATOM 24238 H1 WAT 3640 3.748 39.523 137.085 1.00 0.00 H ATOM 24239 H2 WAT 3640 3.327 40.788 137.801 1.00 0.00 H TER 24241 WAT 3640 ATOM 24241 O WAT 3641 107.185 22.782 116.152 1.00 0.00 O ATOM 24242 H1 WAT 3641 108.016 23.164 115.869 1.00 0.00 H ATOM 24243 H2 WAT 3641 107.127 22.998 117.083 1.00 0.00 H TER 24245 WAT 3641 ATOM 24245 O WAT 3642 45.159 121.094 91.524 1.00 0.00 O ATOM 24246 H1 WAT 3642 45.369 120.300 91.034 1.00 0.00 H ATOM 24247 H2 WAT 3642 45.557 120.958 92.384 1.00 0.00 H TER 24249 WAT 3642 ATOM 24249 O WAT 3643 75.389 97.860 20.538 1.00 0.00 O ATOM 24250 H1 WAT 3643 75.268 98.060 21.466 1.00 0.00 H ATOM 24251 H2 WAT 3643 74.574 98.144 20.124 1.00 0.00 H TER 24253 WAT 3643 ATOM 24253 O WAT 3644 40.653 12.599 157.066 1.00 0.00 O ATOM 24254 H1 WAT 3644 40.293 12.081 157.787 1.00 0.00 H ATOM 24255 H2 WAT 3644 40.437 13.504 157.290 1.00 0.00 H TER 24257 WAT 3644 ATOM 24257 O WAT 3645 87.057 135.542 78.279 1.00 0.00 O ATOM 24258 H1 WAT 3645 87.699 136.148 77.908 1.00 0.00 H ATOM 24259 H2 WAT 3645 86.309 135.593 77.684 1.00 0.00 H TER 24261 WAT 3645 ATOM 24261 O WAT 3646 39.952 111.840 86.114 1.00 0.00 O ATOM 24262 H1 WAT 3646 40.003 110.887 86.190 1.00 0.00 H ATOM 24263 H2 WAT 3646 40.846 112.141 86.275 1.00 0.00 H TER 24265 WAT 3646 ATOM 24265 O WAT 3647 48.651 77.192 103.757 1.00 0.00 O ATOM 24266 H1 WAT 3647 48.656 78.098 103.448 1.00 0.00 H ATOM 24267 H2 WAT 3647 48.097 77.207 104.537 1.00 0.00 H TER 24269 WAT 3647 ATOM 24269 O WAT 3648 108.908 127.663 90.501 1.00 0.00 O ATOM 24270 H1 WAT 3648 109.590 127.994 91.085 1.00 0.00 H ATOM 24271 H2 WAT 3648 108.146 128.211 90.689 1.00 0.00 H TER 24273 WAT 3648 ATOM 24273 O WAT 3649 130.177 84.537 155.892 1.00 0.00 O ATOM 24274 H1 WAT 3649 130.149 84.120 155.030 1.00 0.00 H ATOM 24275 H2 WAT 3649 130.009 83.824 156.508 1.00 0.00 H TER 24277 WAT 3649 ATOM 24277 O WAT 3650 108.448 57.565 16.706 1.00 0.00 O ATOM 24278 H1 WAT 3650 108.488 57.505 17.660 1.00 0.00 H ATOM 24279 H2 WAT 3650 108.770 56.718 16.398 1.00 0.00 H TER 24281 WAT 3650 ATOM 24281 O WAT 3651 85.445 69.503 71.719 1.00 0.00 O ATOM 24282 H1 WAT 3651 86.314 69.158 71.923 1.00 0.00 H ATOM 24283 H2 WAT 3651 85.369 70.293 72.253 1.00 0.00 H TER 24285 WAT 3651 ATOM 24285 O WAT 3652 67.037 21.236 67.812 1.00 0.00 O ATOM 24286 H1 WAT 3652 67.384 21.594 66.994 1.00 0.00 H ATOM 24287 H2 WAT 3652 67.766 20.742 68.185 1.00 0.00 H TER 24289 WAT 3652 ATOM 24289 O WAT 3653 10.347 96.437 16.253 1.00 0.00 O ATOM 24290 H1 WAT 3653 10.638 95.689 16.775 1.00 0.00 H ATOM 24291 H2 WAT 3653 10.567 96.200 15.352 1.00 0.00 H TER 24293 WAT 3653 ATOM 24293 O WAT 3654 90.381 121.307 116.621 1.00 0.00 O ATOM 24294 H1 WAT 3654 90.447 121.977 115.941 1.00 0.00 H ATOM 24295 H2 WAT 3654 90.978 120.615 116.335 1.00 0.00 H TER 24297 WAT 3654 ATOM 24297 O WAT 3655 14.759 59.335 69.898 1.00 0.00 O ATOM 24298 H1 WAT 3655 14.347 60.068 70.355 1.00 0.00 H ATOM 24299 H2 WAT 3655 15.546 59.710 69.504 1.00 0.00 H TER 24301 WAT 3655 ATOM 24301 O WAT 3656 58.942 81.842 25.975 1.00 0.00 O ATOM 24302 H1 WAT 3656 59.871 81.698 26.153 1.00 0.00 H ATOM 24303 H2 WAT 3656 58.694 81.118 25.399 1.00 0.00 H TER 24305 WAT 3656 ATOM 24305 O WAT 3657 38.719 55.761 14.234 1.00 0.00 O ATOM 24306 H1 WAT 3657 38.295 56.490 13.782 1.00 0.00 H ATOM 24307 H2 WAT 3657 38.026 55.378 14.773 1.00 0.00 H TER 24309 WAT 3657 ATOM 24309 O WAT 3658 77.752 20.113 142.556 1.00 0.00 O ATOM 24310 H1 WAT 3658 77.691 19.160 142.501 1.00 0.00 H ATOM 24311 H2 WAT 3658 78.207 20.277 143.382 1.00 0.00 H TER 24313 WAT 3658 ATOM 24313 O WAT 3659 22.172 139.385 17.323 1.00 0.00 O ATOM 24314 H1 WAT 3659 22.418 138.460 17.313 1.00 0.00 H ATOM 24315 H2 WAT 3659 21.218 139.379 17.390 1.00 0.00 H TER 24317 WAT 3659 ATOM 24317 O WAT 3660 37.649 96.776 128.696 1.00 0.00 O ATOM 24318 H1 WAT 3660 36.729 96.691 128.948 1.00 0.00 H ATOM 24319 H2 WAT 3660 38.136 96.456 129.455 1.00 0.00 H TER 24321 WAT 3660 ATOM 24321 O WAT 3661 75.442 34.297 67.372 1.00 0.00 O ATOM 24322 H1 WAT 3661 74.978 33.466 67.469 1.00 0.00 H ATOM 24323 H2 WAT 3661 75.786 34.276 66.479 1.00 0.00 H TER 24325 WAT 3661 ATOM 24325 O WAT 3662 123.933 100.546 149.139 1.00 0.00 O ATOM 24326 H1 WAT 3662 123.623 100.405 150.033 1.00 0.00 H ATOM 24327 H2 WAT 3662 123.786 99.709 148.699 1.00 0.00 H TER 24329 WAT 3662 ATOM 24329 O WAT 3663 121.840 136.864 56.890 1.00 0.00 O ATOM 24330 H1 WAT 3663 120.891 136.797 56.780 1.00 0.00 H ATOM 24331 H2 WAT 3663 121.980 137.746 57.233 1.00 0.00 H TER 24333 WAT 3663 ATOM 24333 O WAT 3664 49.761 33.748 149.705 1.00 0.00 O ATOM 24334 H1 WAT 3664 49.896 34.686 149.842 1.00 0.00 H ATOM 24335 H2 WAT 3664 49.444 33.426 150.549 1.00 0.00 H TER 24337 WAT 3664 ATOM 24337 O WAT 3665 4.359 61.775 114.976 1.00 0.00 O ATOM 24338 H1 WAT 3665 4.772 60.913 115.035 1.00 0.00 H ATOM 24339 H2 WAT 3665 3.425 61.586 114.886 1.00 0.00 H TER 24341 WAT 3665 ATOM 24341 O WAT 3666 121.646 18.263 4.681 1.00 0.00 O ATOM 24342 H1 WAT 3666 120.801 18.258 5.130 1.00 0.00 H ATOM 24343 H2 WAT 3666 121.667 19.101 4.219 1.00 0.00 H TER 24345 WAT 3666 ATOM 24345 O WAT 3667 53.533 1.162 91.475 1.00 0.00 O ATOM 24346 H1 WAT 3667 53.177 0.502 90.880 1.00 0.00 H ATOM 24347 H2 WAT 3667 53.816 1.874 90.900 1.00 0.00 H TER 24349 WAT 3667 ATOM 24349 O WAT 3668 113.659 127.936 68.540 1.00 0.00 O ATOM 24350 H1 WAT 3668 113.203 127.853 67.702 1.00 0.00 H ATOM 24351 H2 WAT 3668 114.416 128.490 68.347 1.00 0.00 H TER 24353 WAT 3668 ATOM 24353 O WAT 3669 82.728 25.920 10.543 1.00 0.00 O ATOM 24354 H1 WAT 3669 82.743 25.768 11.488 1.00 0.00 H ATOM 24355 H2 WAT 3669 83.051 26.815 10.439 1.00 0.00 H TER 24357 WAT 3669 ATOM 24357 O WAT 3670 86.470 82.053 72.701 1.00 0.00 O ATOM 24358 H1 WAT 3670 87.181 82.062 73.342 1.00 0.00 H ATOM 24359 H2 WAT 3670 85.672 82.053 73.229 1.00 0.00 H TER 24361 WAT 3670 ATOM 24361 O WAT 3671 83.204 39.956 154.406 1.00 0.00 O ATOM 24362 H1 WAT 3671 82.944 39.201 154.933 1.00 0.00 H ATOM 24363 H2 WAT 3671 83.966 40.315 154.861 1.00 0.00 H TER 24365 WAT 3671 ATOM 24365 O WAT 3672 88.403 3.051 145.396 1.00 0.00 O ATOM 24366 H1 WAT 3672 87.564 3.511 145.396 1.00 0.00 H ATOM 24367 H2 WAT 3672 88.356 2.467 146.153 1.00 0.00 H TER 24369 WAT 3672 ATOM 24369 O WAT 3673 93.305 143.817 141.149 1.00 0.00 O ATOM 24370 H1 WAT 3673 93.730 144.339 141.829 1.00 0.00 H ATOM 24371 H2 WAT 3673 93.299 142.926 141.498 1.00 0.00 H TER 24373 WAT 3673 ATOM 24373 O WAT 3674 137.379 66.586 80.628 1.00 0.00 O ATOM 24374 H1 WAT 3674 137.063 65.854 80.100 1.00 0.00 H ATOM 24375 H2 WAT 3674 138.261 66.326 80.894 1.00 0.00 H TER 24377 WAT 3674 ATOM 24377 O WAT 3675 82.725 130.930 25.602 1.00 0.00 O ATOM 24378 H1 WAT 3675 82.335 130.640 24.777 1.00 0.00 H ATOM 24379 H2 WAT 3675 82.102 130.649 26.273 1.00 0.00 H TER 24381 WAT 3675 ATOM 24381 O WAT 3676 106.976 81.873 146.088 1.00 0.00 O ATOM 24382 H1 WAT 3676 106.584 81.087 146.469 1.00 0.00 H ATOM 24383 H2 WAT 3676 106.291 82.539 146.157 1.00 0.00 H TER 24385 WAT 3676 ATOM 24385 O WAT 3677 70.565 38.383 71.553 1.00 0.00 O ATOM 24386 H1 WAT 3677 70.298 37.798 70.844 1.00 0.00 H ATOM 24387 H2 WAT 3677 69.817 38.968 71.676 1.00 0.00 H TER 24389 WAT 3677 ATOM 24389 O WAT 3678 126.826 136.967 18.957 1.00 0.00 O ATOM 24390 H1 WAT 3678 127.034 136.349 19.658 1.00 0.00 H ATOM 24391 H2 WAT 3678 126.475 137.733 19.410 1.00 0.00 H TER 24393 WAT 3678 ATOM 24393 O WAT 3679 145.024 131.863 20.107 1.00 0.00 O ATOM 24394 H1 WAT 3679 144.281 131.359 20.439 1.00 0.00 H ATOM 24395 H2 WAT 3679 145.535 132.078 20.887 1.00 0.00 H TER 24397 WAT 3679 ATOM 24397 O WAT 3680 82.183 122.249 17.244 1.00 0.00 O ATOM 24398 H1 WAT 3680 82.692 121.829 17.937 1.00 0.00 H ATOM 24399 H2 WAT 3680 82.075 123.153 17.540 1.00 0.00 H TER 24401 WAT 3680 ATOM 24401 O WAT 3681 72.336 51.656 127.530 1.00 0.00 O ATOM 24402 H1 WAT 3681 71.932 52.496 127.312 1.00 0.00 H ATOM 24403 H2 WAT 3681 71.700 51.002 127.239 1.00 0.00 H TER 24405 WAT 3681 ATOM 24405 O WAT 3682 97.145 28.363 58.154 1.00 0.00 O ATOM 24406 H1 WAT 3682 97.276 27.414 58.162 1.00 0.00 H ATOM 24407 H2 WAT 3682 96.276 28.487 58.535 1.00 0.00 H TER 24409 WAT 3682 ATOM 24409 O WAT 3683 140.574 48.521 7.169 1.00 0.00 O ATOM 24410 H1 WAT 3683 141.055 48.858 6.413 1.00 0.00 H ATOM 24411 H2 WAT 3683 141.242 48.101 7.710 1.00 0.00 H TER 24413 WAT 3683 ATOM 24413 O WAT 3684 125.049 5.709 77.325 1.00 0.00 O ATOM 24414 H1 WAT 3684 125.919 5.749 76.926 1.00 0.00 H ATOM 24415 H2 WAT 3684 124.500 6.248 76.756 1.00 0.00 H TER 24417 WAT 3684 ATOM 24417 O WAT 3685 65.574 142.552 144.594 1.00 0.00 O ATOM 24418 H1 WAT 3685 66.497 142.763 144.448 1.00 0.00 H ATOM 24419 H2 WAT 3685 65.237 143.291 145.100 1.00 0.00 H TER 24421 WAT 3685 ATOM 24421 O WAT 3686 109.676 48.635 69.415 1.00 0.00 O ATOM 24422 H1 WAT 3686 108.894 49.006 69.824 1.00 0.00 H ATOM 24423 H2 WAT 3686 109.615 48.901 68.497 1.00 0.00 H TER 24425 WAT 3686 ATOM 24425 O WAT 3687 56.980 46.854 108.841 1.00 0.00 O ATOM 24426 H1 WAT 3687 56.737 46.083 108.327 1.00 0.00 H ATOM 24427 H2 WAT 3687 56.476 46.770 109.651 1.00 0.00 H TER 24429 WAT 3687 ATOM 24429 O WAT 3688 19.107 128.408 54.152 1.00 0.00 O ATOM 24430 H1 WAT 3688 18.714 127.573 53.898 1.00 0.00 H ATOM 24431 H2 WAT 3688 18.731 128.598 55.012 1.00 0.00 H TER 24433 WAT 3688 ATOM 24433 O WAT 3689 21.085 96.937 115.097 1.00 0.00 O ATOM 24434 H1 WAT 3689 21.175 96.140 115.618 1.00 0.00 H ATOM 24435 H2 WAT 3689 20.160 96.961 114.853 1.00 0.00 H TER 24437 WAT 3689 ATOM 24437 O WAT 3690 1.671 79.331 87.945 1.00 0.00 O ATOM 24438 H1 WAT 3690 0.905 79.676 87.487 1.00 0.00 H ATOM 24439 H2 WAT 3690 1.518 78.387 87.991 1.00 0.00 H TER 24441 WAT 3690 ATOM 24441 O WAT 3691 70.140 37.082 108.583 1.00 0.00 O ATOM 24442 H1 WAT 3691 70.112 37.138 107.628 1.00 0.00 H ATOM 24443 H2 WAT 3691 71.068 37.172 108.801 1.00 0.00 H TER 24445 WAT 3691 ATOM 24445 O WAT 3692 105.776 9.556 71.544 1.00 0.00 O ATOM 24446 H1 WAT 3692 106.137 9.231 72.368 1.00 0.00 H ATOM 24447 H2 WAT 3692 104.846 9.335 71.586 1.00 0.00 H TER 24449 WAT 3692 ATOM 24449 O WAT 3693 130.137 129.324 77.494 1.00 0.00 O ATOM 24450 H1 WAT 3693 130.203 129.636 76.591 1.00 0.00 H ATOM 24451 H2 WAT 3693 129.755 128.450 77.417 1.00 0.00 H TER 24453 WAT 3693 ATOM 24453 O WAT 3694 12.163 125.952 9.413 1.00 0.00 O ATOM 24454 H1 WAT 3694 11.866 125.089 9.702 1.00 0.00 H ATOM 24455 H2 WAT 3694 13.025 126.056 9.817 1.00 0.00 H TER 24457 WAT 3694 ATOM 24457 O WAT 3695 5.815 48.271 106.431 1.00 0.00 O ATOM 24458 H1 WAT 3695 5.570 47.395 106.729 1.00 0.00 H ATOM 24459 H2 WAT 3695 6.487 48.556 107.050 1.00 0.00 H TER 24461 WAT 3695 ATOM 24461 O WAT 3696 55.077 143.185 83.625 1.00 0.00 O ATOM 24462 H1 WAT 3696 55.567 142.600 83.047 1.00 0.00 H ATOM 24463 H2 WAT 3696 54.677 142.604 84.272 1.00 0.00 H TER 24465 WAT 3696 ATOM 24465 O WAT 3697 12.881 63.791 78.944 1.00 0.00 O ATOM 24466 H1 WAT 3697 13.562 64.460 78.886 1.00 0.00 H ATOM 24467 H2 WAT 3697 13.193 63.190 79.621 1.00 0.00 H TER 24469 WAT 3697 ATOM 24469 O WAT 3698 144.311 108.384 19.670 1.00 0.00 O ATOM 24470 H1 WAT 3698 144.602 107.600 19.204 1.00 0.00 H ATOM 24471 H2 WAT 3698 143.826 108.048 20.424 1.00 0.00 H TER 24473 WAT 3698 ATOM 24473 O WAT 3699 35.893 75.152 150.344 1.00 0.00 O ATOM 24474 H1 WAT 3699 36.760 74.813 150.125 1.00 0.00 H ATOM 24475 H2 WAT 3699 35.955 76.093 150.178 1.00 0.00 H TER 24477 WAT 3699 ATOM 24477 O WAT 3700 81.726 39.852 135.200 1.00 0.00 O ATOM 24478 H1 WAT 3700 82.463 40.448 135.335 1.00 0.00 H ATOM 24479 H2 WAT 3700 81.286 40.189 134.419 1.00 0.00 H TER 24481 WAT 3700 ATOM 24481 O WAT 3701 139.310 64.275 137.958 1.00 0.00 O ATOM 24482 H1 WAT 3701 139.086 63.645 138.643 1.00 0.00 H ATOM 24483 H2 WAT 3701 139.659 63.740 137.246 1.00 0.00 H TER 24485 WAT 3701 ATOM 24485 O WAT 3702 24.417 117.671 60.735 1.00 0.00 O ATOM 24486 H1 WAT 3702 24.064 118.475 60.353 1.00 0.00 H ATOM 24487 H2 WAT 3702 24.719 117.161 59.984 1.00 0.00 H TER 24489 WAT 3702 ATOM 24489 O WAT 3703 84.050 122.362 151.865 1.00 0.00 O ATOM 24490 H1 WAT 3703 84.194 123.131 152.416 1.00 0.00 H ATOM 24491 H2 WAT 3703 83.912 121.646 152.485 1.00 0.00 H TER 24493 WAT 3703 ATOM 24493 O WAT 3704 1.605 37.371 157.863 1.00 0.00 O ATOM 24494 H1 WAT 3704 1.905 38.270 157.996 1.00 0.00 H ATOM 24495 H2 WAT 3704 0.659 37.411 158.000 1.00 0.00 H TER 24497 WAT 3704 ATOM 24497 O WAT 3705 64.206 46.820 113.794 1.00 0.00 O ATOM 24498 H1 WAT 3705 64.686 47.222 114.518 1.00 0.00 H ATOM 24499 H2 WAT 3705 64.873 46.343 113.300 1.00 0.00 H TER 24501 WAT 3705 ATOM 24501 O WAT 3706 22.061 4.762 138.183 1.00 0.00 O ATOM 24502 H1 WAT 3706 22.959 5.081 138.103 1.00 0.00 H ATOM 24503 H2 WAT 3706 21.802 4.547 137.287 1.00 0.00 H TER 24505 WAT 3706 ATOM 24505 O WAT 3707 142.426 68.348 139.186 1.00 0.00 O ATOM 24506 H1 WAT 3707 142.298 67.871 140.006 1.00 0.00 H ATOM 24507 H2 WAT 3707 142.926 67.747 138.634 1.00 0.00 H TER 24509 WAT 3707 ATOM 24509 O WAT 3708 59.489 97.616 86.370 1.00 0.00 O ATOM 24510 H1 WAT 3708 59.751 98.522 86.535 1.00 0.00 H ATOM 24511 H2 WAT 3708 60.293 97.183 86.084 1.00 0.00 H TER 24513 WAT 3708 ATOM 24513 O WAT 3709 14.126 42.122 127.705 1.00 0.00 O ATOM 24514 H1 WAT 3709 13.336 42.291 128.217 1.00 0.00 H ATOM 24515 H2 WAT 3709 13.815 42.039 126.804 1.00 0.00 H TER 24517 WAT 3709 ATOM 24517 O WAT 3710 39.781 47.320 93.481 1.00 0.00 O ATOM 24518 H1 WAT 3710 39.630 46.721 94.212 1.00 0.00 H ATOM 24519 H2 WAT 3710 39.554 46.812 92.703 1.00 0.00 H TER 24521 WAT 3710 ATOM 24521 O WAT 3711 33.766 80.412 143.062 1.00 0.00 O ATOM 24522 H1 WAT 3711 33.086 79.977 143.577 1.00 0.00 H ATOM 24523 H2 WAT 3711 34.409 80.701 143.710 1.00 0.00 H TER 24525 WAT 3711 ATOM 24525 O WAT 3712 106.109 90.020 116.271 1.00 0.00 O ATOM 24526 H1 WAT 3712 106.946 89.556 116.293 1.00 0.00 H ATOM 24527 H2 WAT 3712 105.968 90.301 117.175 1.00 0.00 H TER 24529 WAT 3712 ATOM 24529 O WAT 3713 83.930 101.915 21.269 1.00 0.00 O ATOM 24530 H1 WAT 3713 83.773 101.912 22.213 1.00 0.00 H ATOM 24531 H2 WAT 3713 84.773 101.474 21.165 1.00 0.00 H TER 24533 WAT 3713 ATOM 24533 O WAT 3714 44.174 44.246 80.109 1.00 0.00 O ATOM 24534 H1 WAT 3714 44.699 44.136 79.316 1.00 0.00 H ATOM 24535 H2 WAT 3714 44.460 43.538 80.686 1.00 0.00 H TER 24537 WAT 3714 ATOM 24537 O WAT 3715 140.491 144.822 70.627 1.00 0.00 O ATOM 24538 H1 WAT 3715 139.823 144.427 70.066 1.00 0.00 H ATOM 24539 H2 WAT 3715 141.208 144.188 70.629 1.00 0.00 H TER 24541 WAT 3715 ATOM 24541 O WAT 3716 62.536 86.397 71.779 1.00 0.00 O ATOM 24542 H1 WAT 3716 62.952 86.555 72.627 1.00 0.00 H ATOM 24543 H2 WAT 3716 62.073 87.212 71.584 1.00 0.00 H TER 24545 WAT 3716 ATOM 24545 O WAT 3717 126.553 93.850 19.229 1.00 0.00 O ATOM 24546 H1 WAT 3717 127.119 94.442 18.733 1.00 0.00 H ATOM 24547 H2 WAT 3717 127.083 93.587 19.981 1.00 0.00 H TER 24549 WAT 3717 ATOM 24549 O WAT 3718 122.319 31.136 119.633 1.00 0.00 O ATOM 24550 H1 WAT 3718 121.691 31.650 119.125 1.00 0.00 H ATOM 24551 H2 WAT 3718 122.369 30.298 119.174 1.00 0.00 H TER 24553 WAT 3718 ATOM 24553 O WAT 3719 35.918 114.779 99.435 1.00 0.00 O ATOM 24554 H1 WAT 3719 36.094 115.550 99.974 1.00 0.00 H ATOM 24555 H2 WAT 3719 36.626 114.171 99.648 1.00 0.00 H TER 24557 WAT 3719 ATOM 24557 O WAT 3720 26.608 89.969 116.412 1.00 0.00 O ATOM 24558 H1 WAT 3720 26.968 89.098 116.243 1.00 0.00 H ATOM 24559 H2 WAT 3720 26.859 90.484 115.645 1.00 0.00 H TER 24561 WAT 3720 ATOM 24561 O WAT 3721 107.715 78.247 16.352 1.00 0.00 O ATOM 24562 H1 WAT 3721 106.859 78.676 16.356 1.00 0.00 H ATOM 24563 H2 WAT 3721 107.594 77.466 16.893 1.00 0.00 H TER 24565 WAT 3721 ATOM 24565 O WAT 3722 18.550 71.243 103.695 1.00 0.00 O ATOM 24566 H1 WAT 3722 18.938 72.060 104.009 1.00 0.00 H ATOM 24567 H2 WAT 3722 18.493 70.690 104.474 1.00 0.00 H TER 24569 WAT 3722 ATOM 24569 O WAT 3723 94.315 66.887 11.554 1.00 0.00 O ATOM 24570 H1 WAT 3723 93.705 67.409 11.033 1.00 0.00 H ATOM 24571 H2 WAT 3723 94.615 66.202 10.956 1.00 0.00 H TER 24573 WAT 3723 ATOM 24573 O WAT 3724 61.321 79.806 127.303 1.00 0.00 O ATOM 24574 H1 WAT 3724 61.211 79.171 128.010 1.00 0.00 H ATOM 24575 H2 WAT 3724 61.144 79.310 126.504 1.00 0.00 H TER 24577 WAT 3724 ATOM 24577 O WAT 3725 144.704 98.413 101.920 1.00 0.00 O ATOM 24578 H1 WAT 3725 143.890 98.032 101.591 1.00 0.00 H ATOM 24579 H2 WAT 3725 144.779 98.082 102.815 1.00 0.00 H TER 24581 WAT 3725 ATOM 24581 O WAT 3726 120.562 8.003 91.749 1.00 0.00 O ATOM 24582 H1 WAT 3726 121.188 8.709 91.912 1.00 0.00 H ATOM 24583 H2 WAT 3726 120.982 7.222 92.111 1.00 0.00 H TER 24585 WAT 3726 ATOM 24585 O WAT 3727 119.027 46.770 135.521 1.00 0.00 O ATOM 24586 H1 WAT 3727 119.007 46.664 136.472 1.00 0.00 H ATOM 24587 H2 WAT 3727 119.868 46.397 135.256 1.00 0.00 H TER 24589 WAT 3727 ATOM 24589 O WAT 3728 63.539 99.396 95.881 1.00 0.00 O ATOM 24590 H1 WAT 3728 62.963 99.216 95.138 1.00 0.00 H ATOM 24591 H2 WAT 3728 64.418 99.202 95.555 1.00 0.00 H TER 24593 WAT 3728 ATOM 24593 O WAT 3729 66.168 126.908 11.912 1.00 0.00 O ATOM 24594 H1 WAT 3729 65.653 127.149 12.682 1.00 0.00 H ATOM 24595 H2 WAT 3729 67.061 126.807 12.244 1.00 0.00 H TER 24597 WAT 3729 ATOM 24597 O WAT 3730 127.014 38.815 89.913 1.00 0.00 O ATOM 24598 H1 WAT 3730 127.966 38.839 90.009 1.00 0.00 H ATOM 24599 H2 WAT 3730 126.712 38.285 90.651 1.00 0.00 H TER 24601 WAT 3730 ATOM 24601 O WAT 3731 143.203 90.193 138.400 1.00 0.00 O ATOM 24602 H1 WAT 3731 143.888 90.040 139.050 1.00 0.00 H ATOM 24603 H2 WAT 3731 142.507 90.637 138.884 1.00 0.00 H TER 24605 WAT 3731 ATOM 24605 O WAT 3732 120.513 58.973 108.414 1.00 0.00 O ATOM 24606 H1 WAT 3732 121.059 58.490 107.794 1.00 0.00 H ATOM 24607 H2 WAT 3732 121.070 59.090 109.184 1.00 0.00 H TER 24609 WAT 3732 ATOM 24609 O WAT 3733 15.842 87.873 154.157 1.00 0.00 O ATOM 24610 H1 WAT 3733 16.364 87.363 154.777 1.00 0.00 H ATOM 24611 H2 WAT 3733 15.171 87.264 153.851 1.00 0.00 H TER 24613 WAT 3733 ATOM 24613 O WAT 3734 115.988 76.517 87.902 1.00 0.00 O ATOM 24614 H1 WAT 3734 116.742 75.953 87.731 1.00 0.00 H ATOM 24615 H2 WAT 3734 115.985 77.139 87.175 1.00 0.00 H TER 24617 WAT 3734 ATOM 24617 O WAT 3735 139.594 74.477 97.595 1.00 0.00 O ATOM 24618 H1 WAT 3735 139.044 73.767 97.927 1.00 0.00 H ATOM 24619 H2 WAT 3735 140.490 74.178 97.748 1.00 0.00 H TER 24621 WAT 3735 ATOM 24621 O WAT 3736 41.281 41.108 151.425 1.00 0.00 O ATOM 24622 H1 WAT 3736 41.612 41.865 151.909 1.00 0.00 H ATOM 24623 H2 WAT 3736 41.994 40.873 150.831 1.00 0.00 H TER 24625 WAT 3736 ATOM 24625 O WAT 3737 139.859 8.185 89.827 1.00 0.00 O ATOM 24626 H1 WAT 3737 139.184 7.507 89.824 1.00 0.00 H ATOM 24627 H2 WAT 3737 140.667 7.719 89.608 1.00 0.00 H TER 24629 WAT 3737 ATOM 24629 O WAT 3738 130.889 135.514 94.746 1.00 0.00 O ATOM 24630 H1 WAT 3738 131.578 135.586 95.406 1.00 0.00 H ATOM 24631 H2 WAT 3738 130.130 135.940 95.145 1.00 0.00 H TER 24633 WAT 3738 ATOM 24633 O WAT 3739 51.452 71.836 156.936 1.00 0.00 O ATOM 24634 H1 WAT 3739 51.416 71.817 155.980 1.00 0.00 H ATOM 24635 H2 WAT 3739 52.386 71.787 157.141 1.00 0.00 H TER 24637 WAT 3739 ATOM 24637 O WAT 3740 38.488 116.972 154.151 1.00 0.00 O ATOM 24638 H1 WAT 3740 37.954 116.277 153.768 1.00 0.00 H ATOM 24639 H2 WAT 3740 38.800 117.476 153.399 1.00 0.00 H TER 24641 WAT 3740 ATOM 24641 O WAT 3741 76.400 7.267 143.299 1.00 0.00 O ATOM 24642 H1 WAT 3741 75.788 7.441 144.014 1.00 0.00 H ATOM 24643 H2 WAT 3741 77.067 7.948 143.384 1.00 0.00 H TER 24645 WAT 3741 ATOM 24645 O WAT 3742 1.156 123.172 105.847 1.00 0.00 O ATOM 24646 H1 WAT 3742 1.680 123.832 105.393 1.00 0.00 H ATOM 24647 H2 WAT 3742 1.437 123.229 106.760 1.00 0.00 H TER 24649 WAT 3742 ATOM 24649 O WAT 3743 63.146 124.887 144.172 1.00 0.00 O ATOM 24650 H1 WAT 3743 63.511 125.304 143.391 1.00 0.00 H ATOM 24651 H2 WAT 3743 62.206 124.834 143.998 1.00 0.00 H TER 24653 WAT 3743 ATOM 24653 O WAT 3744 104.235 110.780 158.454 1.00 0.00 O ATOM 24654 H1 WAT 3744 104.689 109.941 158.374 1.00 0.00 H ATOM 24655 H2 WAT 3744 103.859 110.934 157.588 1.00 0.00 H TER 24657 WAT 3744 ATOM 24657 O WAT 3745 75.295 67.197 120.599 1.00 0.00 O ATOM 24658 H1 WAT 3745 74.625 66.960 119.958 1.00 0.00 H ATOM 24659 H2 WAT 3745 75.907 67.751 120.113 1.00 0.00 H TER 24661 WAT 3745 ATOM 24661 O WAT 3746 98.378 25.123 6.757 1.00 0.00 O ATOM 24662 H1 WAT 3746 98.580 25.972 6.363 1.00 0.00 H ATOM 24663 H2 WAT 3746 97.515 24.897 6.411 1.00 0.00 H TER 24665 WAT 3746 ATOM 24665 O WAT 3747 46.086 68.067 94.303 1.00 0.00 O ATOM 24666 H1 WAT 3747 46.642 68.555 94.911 1.00 0.00 H ATOM 24667 H2 WAT 3747 45.230 68.489 94.370 1.00 0.00 H TER 24669 WAT 3747 ATOM 24669 O WAT 3748 42.521 2.466 101.360 1.00 0.00 O ATOM 24670 H1 WAT 3748 42.886 1.999 102.112 1.00 0.00 H ATOM 24671 H2 WAT 3748 43.160 3.153 101.171 1.00 0.00 H TER 24673 WAT 3748 ATOM 24673 O WAT 3749 139.012 124.516 86.836 1.00 0.00 O ATOM 24674 H1 WAT 3749 138.812 123.605 87.052 1.00 0.00 H ATOM 24675 H2 WAT 3749 139.012 124.968 87.680 1.00 0.00 H TER 24677 WAT 3749 ATOM 24677 O WAT 3750 115.920 128.957 67.705 1.00 0.00 O ATOM 24678 H1 WAT 3750 116.178 129.864 67.541 1.00 0.00 H ATOM 24679 H2 WAT 3750 115.776 128.588 66.833 1.00 0.00 H TER 24681 WAT 3750 ATOM 24681 O WAT 3751 102.918 121.362 74.627 1.00 0.00 O ATOM 24682 H1 WAT 3751 102.838 122.252 74.971 1.00 0.00 H ATOM 24683 H2 WAT 3751 103.778 121.344 74.208 1.00 0.00 H TER 24685 WAT 3751 ATOM 24685 O WAT 3752 62.489 141.565 140.854 1.00 0.00 O ATOM 24686 H1 WAT 3752 62.465 140.727 141.317 1.00 0.00 H ATOM 24687 H2 WAT 3752 63.334 141.946 141.092 1.00 0.00 H TER 24689 WAT 3752 ATOM 24689 O WAT 3753 125.925 136.557 7.996 1.00 0.00 O ATOM 24690 H1 WAT 3753 125.303 136.958 8.603 1.00 0.00 H ATOM 24691 H2 WAT 3753 126.350 137.298 7.565 1.00 0.00 H TER 24693 WAT 3753 ATOM 24693 O WAT 3754 27.617 112.137 6.655 1.00 0.00 O ATOM 24694 H1 WAT 3754 28.140 112.084 5.856 1.00 0.00 H ATOM 24695 H2 WAT 3754 27.270 111.253 6.773 1.00 0.00 H TER 24697 WAT 3754 ATOM 24697 O WAT 3755 74.459 116.537 84.079 1.00 0.00 O ATOM 24698 H1 WAT 3755 73.988 116.472 84.910 1.00 0.00 H ATOM 24699 H2 WAT 3755 75.250 116.015 84.211 1.00 0.00 H TER 24701 WAT 3755 ATOM 24701 O WAT 3756 96.592 63.535 75.911 1.00 0.00 O ATOM 24702 H1 WAT 3756 96.648 64.356 76.399 1.00 0.00 H ATOM 24703 H2 WAT 3756 96.379 63.801 75.017 1.00 0.00 H TER 24705 WAT 3756 ATOM 24705 O WAT 3757 132.712 97.177 12.240 1.00 0.00 O ATOM 24706 H1 WAT 3757 131.956 97.752 12.120 1.00 0.00 H ATOM 24707 H2 WAT 3757 132.614 96.835 13.129 1.00 0.00 H TER 24709 WAT 3757 ATOM 24709 O WAT 3758 15.181 34.426 8.559 1.00 0.00 O ATOM 24710 H1 WAT 3758 15.589 33.562 8.510 1.00 0.00 H ATOM 24711 H2 WAT 3758 14.466 34.319 9.186 1.00 0.00 H TER 24713 WAT 3758 ATOM 24713 O WAT 3759 111.013 26.478 133.535 1.00 0.00 O ATOM 24714 H1 WAT 3759 110.503 25.676 133.418 1.00 0.00 H ATOM 24715 H2 WAT 3759 110.700 27.063 132.845 1.00 0.00 H TER 24717 WAT 3759 ATOM 24717 O WAT 3760 36.558 114.326 85.926 1.00 0.00 O ATOM 24718 H1 WAT 3760 37.159 113.896 85.316 1.00 0.00 H ATOM 24719 H2 WAT 3760 35.910 113.654 86.137 1.00 0.00 H TER 24721 WAT 3760 ATOM 24721 O WAT 3761 46.659 61.929 115.285 1.00 0.00 O ATOM 24722 H1 WAT 3761 46.036 62.529 114.875 1.00 0.00 H ATOM 24723 H2 WAT 3761 47.518 62.287 115.062 1.00 0.00 H TER 24725 WAT 3761 ATOM 24725 O WAT 3762 144.124 142.390 62.880 1.00 0.00 O ATOM 24726 H1 WAT 3762 144.126 142.932 62.090 1.00 0.00 H ATOM 24727 H2 WAT 3762 144.197 141.493 62.555 1.00 0.00 H TER 24729 WAT 3762 ATOM 24729 O WAT 3763 129.413 37.478 89.417 1.00 0.00 O ATOM 24730 H1 WAT 3763 129.550 37.132 90.299 1.00 0.00 H ATOM 24731 H2 WAT 3763 130.257 37.863 89.177 1.00 0.00 H TER 24733 WAT 3763 ATOM 24733 O WAT 3764 31.020 140.051 122.539 1.00 0.00 O ATOM 24734 H1 WAT 3764 30.168 139.702 122.800 1.00 0.00 H ATOM 24735 H2 WAT 3764 31.277 139.517 121.787 1.00 0.00 H TER 24737 WAT 3764 ATOM 24737 O WAT 3765 -0.194 73.645 3.820 1.00 0.00 O ATOM 24738 H1 WAT 3765 0.536 73.889 3.252 1.00 0.00 H ATOM 24739 H2 WAT 3765 0.169 73.677 4.705 1.00 0.00 H TER 24741 WAT 3765 ATOM 24741 O WAT 3766 31.000 0.742 2.587 1.00 0.00 O ATOM 24742 H1 WAT 3766 31.351 0.570 1.713 1.00 0.00 H ATOM 24743 H2 WAT 3766 31.312 1.622 2.801 1.00 0.00 H TER 24745 WAT 3766 ATOM 24745 O WAT 3767 105.520 142.620 138.193 1.00 0.00 O ATOM 24746 H1 WAT 3767 106.034 141.860 137.918 1.00 0.00 H ATOM 24747 H2 WAT 3767 106.172 143.300 138.364 1.00 0.00 H TER 24749 WAT 3767 ATOM 24749 O WAT 3768 0.354 77.558 112.687 1.00 0.00 O ATOM 24750 H1 WAT 3768 -0.046 78.157 113.318 1.00 0.00 H ATOM 24751 H2 WAT 3768 0.502 76.753 113.182 1.00 0.00 H TER 24753 WAT 3768 ATOM 24753 O WAT 3769 22.108 71.058 152.906 1.00 0.00 O ATOM 24754 H1 WAT 3769 21.664 70.800 152.098 1.00 0.00 H ATOM 24755 H2 WAT 3769 22.044 70.287 153.470 1.00 0.00 H TER 24757 WAT 3769 ATOM 24757 O WAT 3770 80.415 29.516 127.556 1.00 0.00 O ATOM 24758 H1 WAT 3770 80.007 28.662 127.410 1.00 0.00 H ATOM 24759 H2 WAT 3770 81.308 29.415 127.228 1.00 0.00 H TER 24761 WAT 3770 ATOM 24761 O WAT 3771 88.938 93.140 102.153 1.00 0.00 O ATOM 24762 H1 WAT 3771 88.167 92.594 101.997 1.00 0.00 H ATOM 24763 H2 WAT 3771 89.060 93.116 103.102 1.00 0.00 H TER 24765 WAT 3771 ATOM 24765 O WAT 3772 115.070 91.303 142.414 1.00 0.00 O ATOM 24766 H1 WAT 3772 114.999 91.596 141.505 1.00 0.00 H ATOM 24767 H2 WAT 3772 114.981 90.351 142.366 1.00 0.00 H TER 24769 WAT 3772 ATOM 24769 O WAT 3773 143.563 23.167 2.976 1.00 0.00 O ATOM 24770 H1 WAT 3773 144.104 22.672 2.361 1.00 0.00 H ATOM 24771 H2 WAT 3773 142.778 23.392 2.477 1.00 0.00 H TER 24773 WAT 3773 ATOM 24773 O WAT 3774 26.056 89.412 17.048 1.00 0.00 O ATOM 24774 H1 WAT 3774 26.015 88.496 16.775 1.00 0.00 H ATOM 24775 H2 WAT 3774 26.940 89.518 17.399 1.00 0.00 H TER 24777 WAT 3774 ATOM 24777 O WAT 3775 16.173 88.352 84.451 1.00 0.00 O ATOM 24778 H1 WAT 3775 16.146 87.792 83.675 1.00 0.00 H ATOM 24779 H2 WAT 3775 15.297 88.280 84.829 1.00 0.00 H TER 24781 WAT 3775 ATOM 24781 O WAT 3776 126.697 54.186 71.713 1.00 0.00 O ATOM 24782 H1 WAT 3776 125.904 53.701 71.943 1.00 0.00 H ATOM 24783 H2 WAT 3776 126.646 54.989 72.231 1.00 0.00 H TER 24785 WAT 3776 ATOM 24785 O WAT 3777 140.298 16.206 109.183 1.00 0.00 O ATOM 24786 H1 WAT 3777 140.091 16.635 108.353 1.00 0.00 H ATOM 24787 H2 WAT 3777 140.933 15.528 108.951 1.00 0.00 H TER 24789 WAT 3777 ATOM 24789 O WAT 3778 110.518 100.703 76.408 1.00 0.00 O ATOM 24790 H1 WAT 3778 111.417 101.032 76.412 1.00 0.00 H ATOM 24791 H2 WAT 3778 110.470 100.150 75.628 1.00 0.00 H TER 24793 WAT 3778 ATOM 24793 O WAT 3779 129.574 143.361 131.281 1.00 0.00 O ATOM 24794 H1 WAT 3779 129.921 143.901 130.570 1.00 0.00 H ATOM 24795 H2 WAT 3779 129.920 143.764 132.077 1.00 0.00 H TER 24797 WAT 3779 ATOM 24797 O WAT 3780 86.962 62.934 8.587 1.00 0.00 O ATOM 24798 H1 WAT 3780 87.750 63.398 8.303 1.00 0.00 H ATOM 24799 H2 WAT 3780 86.265 63.587 8.531 1.00 0.00 H TER 24801 WAT 3780 ATOM 24801 O WAT 3781 57.682 57.291 155.437 1.00 0.00 O ATOM 24802 H1 WAT 3781 57.910 58.096 155.902 1.00 0.00 H ATOM 24803 H2 WAT 3781 57.512 56.654 156.131 1.00 0.00 H TER 24805 WAT 3781 ATOM 24805 O WAT 3782 32.357 89.660 123.364 1.00 0.00 O ATOM 24806 H1 WAT 3782 32.835 88.920 122.989 1.00 0.00 H ATOM 24807 H2 WAT 3782 32.395 90.337 122.689 1.00 0.00 H TER 24809 WAT 3782 ATOM 24809 O WAT 3783 100.758 30.606 84.276 1.00 0.00 O ATOM 24810 H1 WAT 3783 100.329 29.787 84.028 1.00 0.00 H ATOM 24811 H2 WAT 3783 101.694 30.416 84.209 1.00 0.00 H TER 24813 WAT 3783 ATOM 24813 O WAT 3784 56.345 99.381 120.624 1.00 0.00 O ATOM 24814 H1 WAT 3784 56.772 98.556 120.854 1.00 0.00 H ATOM 24815 H2 WAT 3784 57.007 100.050 120.799 1.00 0.00 H TER 24817 WAT 3784 ATOM 24817 O WAT 3785 113.933 107.935 16.777 1.00 0.00 O ATOM 24818 H1 WAT 3785 114.293 107.815 15.898 1.00 0.00 H ATOM 24819 H2 WAT 3785 114.069 107.091 17.208 1.00 0.00 H TER 24821 WAT 3785 ATOM 24821 O WAT 3786 128.405 55.341 104.861 1.00 0.00 O ATOM 24822 H1 WAT 3786 129.082 55.235 105.530 1.00 0.00 H ATOM 24823 H2 WAT 3786 127.586 55.391 105.355 1.00 0.00 H TER 24825 WAT 3786 ATOM 24825 O WAT 3787 84.639 1.508 83.123 1.00 0.00 O ATOM 24826 H1 WAT 3787 83.754 1.204 83.323 1.00 0.00 H ATOM 24827 H2 WAT 3787 85.039 1.662 83.978 1.00 0.00 H TER 24829 WAT 3787 ATOM 24829 O WAT 3788 -0.202 102.502 133.611 1.00 0.00 O ATOM 24830 H1 WAT 3788 0.244 101.660 133.707 1.00 0.00 H ATOM 24831 H2 WAT 3788 0.383 103.021 133.060 1.00 0.00 H TER 24833 WAT 3788 ATOM 24833 O WAT 3789 138.226 96.554 18.445 1.00 0.00 O ATOM 24834 H1 WAT 3789 138.290 97.425 18.836 1.00 0.00 H ATOM 24835 H2 WAT 3789 137.421 96.186 18.809 1.00 0.00 H TER 24837 WAT 3789 ATOM 24837 O WAT 3790 99.376 113.597 94.335 1.00 0.00 O ATOM 24838 H1 WAT 3790 99.312 113.196 95.201 1.00 0.00 H ATOM 24839 H2 WAT 3790 100.233 113.324 94.007 1.00 0.00 H TER 24841 WAT 3790 ATOM 24841 O WAT 3791 85.447 12.946 124.576 1.00 0.00 O ATOM 24842 H1 WAT 3791 85.118 13.788 124.261 1.00 0.00 H ATOM 24843 H2 WAT 3791 85.516 13.055 125.524 1.00 0.00 H TER 24845 WAT 3791 ATOM 24845 O WAT 3792 51.122 134.194 99.256 1.00 0.00 O ATOM 24846 H1 WAT 3792 50.980 135.041 99.677 1.00 0.00 H ATOM 24847 H2 WAT 3792 51.821 134.356 98.622 1.00 0.00 H TER 24849 WAT 3792 ATOM 24849 O WAT 3793 125.071 65.893 96.864 1.00 0.00 O ATOM 24850 H1 WAT 3793 124.945 66.528 96.158 1.00 0.00 H ATOM 24851 H2 WAT 3793 124.261 65.937 97.372 1.00 0.00 H TER 24853 WAT 3793 ATOM 24853 O WAT 3794 56.464 22.413 52.549 1.00 0.00 O ATOM 24854 H1 WAT 3794 55.569 22.205 52.281 1.00 0.00 H ATOM 24855 H2 WAT 3794 57.014 21.838 52.017 1.00 0.00 H TER 24857 WAT 3794 ATOM 24857 O WAT 3795 94.726 138.810 118.819 1.00 0.00 O ATOM 24858 H1 WAT 3795 95.499 138.249 118.763 1.00 0.00 H ATOM 24859 H2 WAT 3795 94.126 138.333 119.393 1.00 0.00 H TER 24861 WAT 3795 ATOM 24861 O WAT 3796 104.826 51.832 74.693 1.00 0.00 O ATOM 24862 H1 WAT 3796 104.878 52.361 73.897 1.00 0.00 H ATOM 24863 H2 WAT 3796 104.971 52.455 75.405 1.00 0.00 H TER 24865 WAT 3796 ATOM 24865 O WAT 3797 126.395 145.020 123.083 1.00 0.00 O ATOM 24866 H1 WAT 3797 126.756 144.142 122.964 1.00 0.00 H ATOM 24867 H2 WAT 3797 125.483 144.872 123.332 1.00 0.00 H TER 24869 WAT 3797 ATOM 24869 O WAT 3798 56.101 57.501 67.611 1.00 0.00 O ATOM 24870 H1 WAT 3798 55.855 56.635 67.937 1.00 0.00 H ATOM 24871 H2 WAT 3798 55.401 57.735 67.002 1.00 0.00 H TER 24873 WAT 3798 ATOM 24873 O WAT 3799 33.926 117.600 156.431 1.00 0.00 O ATOM 24874 H1 WAT 3799 33.676 118.359 155.905 1.00 0.00 H ATOM 24875 H2 WAT 3799 34.875 117.533 156.319 1.00 0.00 H TER 24877 WAT 3799 ATOM 24877 O WAT 3800 24.673 141.001 17.286 1.00 0.00 O ATOM 24878 H1 WAT 3800 24.601 141.949 17.402 1.00 0.00 H ATOM 24879 H2 WAT 3800 24.116 140.810 16.531 1.00 0.00 H TER 24881 WAT 3800 ATOM 24881 O WAT 3801 28.875 35.535 92.283 1.00 0.00 O ATOM 24882 H1 WAT 3801 28.061 36.037 92.250 1.00 0.00 H ATOM 24883 H2 WAT 3801 29.045 35.414 93.217 1.00 0.00 H TER 24885 WAT 3801 ATOM 24885 O WAT 3802 128.006 18.534 92.438 1.00 0.00 O ATOM 24886 H1 WAT 3802 127.854 17.705 92.892 1.00 0.00 H ATOM 24887 H2 WAT 3802 127.823 18.341 91.518 1.00 0.00 H TER 24889 WAT 3802 ATOM 24889 O WAT 3803 17.750 28.474 26.079 1.00 0.00 O ATOM 24890 H1 WAT 3803 16.946 28.558 25.567 1.00 0.00 H ATOM 24891 H2 WAT 3803 18.027 27.568 25.945 1.00 0.00 H TER 24893 WAT 3803 ATOM 24893 O WAT 3804 143.196 97.945 118.521 1.00 0.00 O ATOM 24894 H1 WAT 3804 142.473 98.427 118.119 1.00 0.00 H ATOM 24895 H2 WAT 3804 143.575 98.561 119.148 1.00 0.00 H TER 24897 WAT 3804 ATOM 24897 O WAT 3805 123.712 109.091 85.153 1.00 0.00 O ATOM 24898 H1 WAT 3805 124.635 109.179 85.391 1.00 0.00 H ATOM 24899 H2 WAT 3805 123.726 108.838 84.230 1.00 0.00 H TER 24901 WAT 3805 ATOM 24901 O WAT 3806 101.077 35.707 62.131 1.00 0.00 O ATOM 24902 H1 WAT 3806 100.321 35.454 61.601 1.00 0.00 H ATOM 24903 H2 WAT 3806 100.705 35.937 62.983 1.00 0.00 H TER 24905 WAT 3806 ATOM 24905 O WAT 3807 108.862 20.146 146.970 1.00 0.00 O ATOM 24906 H1 WAT 3807 109.590 19.985 146.370 1.00 0.00 H ATOM 24907 H2 WAT 3807 109.228 20.722 147.641 1.00 0.00 H TER 24909 WAT 3807 ATOM 24909 O WAT 3808 132.421 27.320 158.263 1.00 0.00 O ATOM 24910 H1 WAT 3808 133.233 27.289 158.769 1.00 0.00 H ATOM 24911 H2 WAT 3808 132.650 27.808 157.472 1.00 0.00 H TER 24913 WAT 3808 ATOM 24913 O WAT 3809 40.944 44.003 2.837 1.00 0.00 O ATOM 24914 H1 WAT 3809 41.254 44.434 2.041 1.00 0.00 H ATOM 24915 H2 WAT 3809 41.400 43.161 2.847 1.00 0.00 H TER 24917 WAT 3809 ATOM 24917 O WAT 3810 3.071 51.901 136.051 1.00 0.00 O ATOM 24918 H1 WAT 3810 3.256 52.753 135.656 1.00 0.00 H ATOM 24919 H2 WAT 3810 3.919 51.598 136.375 1.00 0.00 H TER 24921 WAT 3810 ATOM 24921 O WAT 3811 78.331 55.831 86.837 1.00 0.00 O ATOM 24922 H1 WAT 3811 79.161 56.193 86.526 1.00 0.00 H ATOM 24923 H2 WAT 3811 77.715 55.997 86.124 1.00 0.00 H TER 24925 WAT 3811 ATOM 24925 O WAT 3812 47.432 43.067 142.960 1.00 0.00 O ATOM 24926 H1 WAT 3812 46.780 42.427 142.676 1.00 0.00 H ATOM 24927 H2 WAT 3812 47.932 43.267 142.168 1.00 0.00 H TER 24929 WAT 3812 ATOM 24929 O WAT 3813 93.245 24.627 54.786 1.00 0.00 O ATOM 24930 H1 WAT 3813 92.696 25.258 55.252 1.00 0.00 H ATOM 24931 H2 WAT 3813 93.230 24.924 53.876 1.00 0.00 H TER 24933 WAT 3813 ATOM 24933 O WAT 3814 122.145 12.835 79.400 1.00 0.00 O ATOM 24934 H1 WAT 3814 122.710 13.550 79.108 1.00 0.00 H ATOM 24935 H2 WAT 3814 121.429 13.269 79.863 1.00 0.00 H TER 24937 WAT 3814 ATOM 24937 O WAT 3815 56.299 144.413 126.788 1.00 0.00 O ATOM 24938 H1 WAT 3815 55.371 144.301 126.994 1.00 0.00 H ATOM 24939 H2 WAT 3815 56.562 143.577 126.404 1.00 0.00 H TER 24941 WAT 3815 ATOM 24941 O WAT 3816 11.927 43.081 129.265 1.00 0.00 O ATOM 24942 H1 WAT 3816 11.943 42.899 130.205 1.00 0.00 H ATOM 24943 H2 WAT 3816 12.001 44.033 129.204 1.00 0.00 H TER 24945 WAT 3816 ATOM 24945 O WAT 3817 57.229 1.691 67.053 1.00 0.00 O ATOM 24946 H1 WAT 3817 56.357 2.023 67.270 1.00 0.00 H ATOM 24947 H2 WAT 3817 57.430 2.085 66.204 1.00 0.00 H TER 24949 WAT 3817 ATOM 24949 O WAT 3818 2.378 32.227 57.143 1.00 0.00 O ATOM 24950 H1 WAT 3818 2.114 33.038 57.578 1.00 0.00 H ATOM 24951 H2 WAT 3818 2.703 32.510 56.288 1.00 0.00 H TER 24953 WAT 3818 ATOM 24953 O WAT 3819 75.415 84.710 58.517 1.00 0.00 O ATOM 24954 H1 WAT 3819 76.296 85.036 58.699 1.00 0.00 H ATOM 24955 H2 WAT 3819 75.530 84.104 57.785 1.00 0.00 H TER 24957 WAT 3819 ATOM 24957 O WAT 3820 9.047 99.179 115.365 1.00 0.00 O ATOM 24958 H1 WAT 3820 9.199 98.582 116.097 1.00 0.00 H ATOM 24959 H2 WAT 3820 9.018 98.612 114.594 1.00 0.00 H TER 24961 WAT 3820 ATOM 24961 O WAT 3821 109.095 98.420 21.001 1.00 0.00 O ATOM 24962 H1 WAT 3821 109.149 99.240 21.491 1.00 0.00 H ATOM 24963 H2 WAT 3821 109.146 97.737 21.671 1.00 0.00 H TER 24965 WAT 3821 ATOM 24965 O WAT 3822 55.843 131.026 140.789 1.00 0.00 O ATOM 24966 H1 WAT 3822 55.682 131.925 141.073 1.00 0.00 H ATOM 24967 H2 WAT 3822 56.711 130.817 141.136 1.00 0.00 H TER 24969 WAT 3822 ATOM 24969 O WAT 3823 69.626 88.652 75.848 1.00 0.00 O ATOM 24970 H1 WAT 3823 70.322 88.147 75.428 1.00 0.00 H ATOM 24971 H2 WAT 3823 69.057 88.920 75.126 1.00 0.00 H TER 24973 WAT 3823 ATOM 24973 O WAT 3824 37.770 46.358 9.176 1.00 0.00 O ATOM 24974 H1 WAT 3824 37.889 46.289 8.229 1.00 0.00 H ATOM 24975 H2 WAT 3824 36.860 46.099 9.322 1.00 0.00 H TER 24977 WAT 3824 ATOM 24977 O WAT 3825 87.950 46.509 14.441 1.00 0.00 O ATOM 24978 H1 WAT 3825 87.491 46.625 15.273 1.00 0.00 H ATOM 24979 H2 WAT 3825 88.828 46.856 14.602 1.00 0.00 H TER 24981 WAT 3825 ATOM 24981 O WAT 3826 11.274 76.170 124.364 1.00 0.00 O ATOM 24982 H1 WAT 3826 11.835 76.815 123.934 1.00 0.00 H ATOM 24983 H2 WAT 3826 11.045 75.551 123.670 1.00 0.00 H TER 24985 WAT 3826 ATOM 24985 O WAT 3827 54.452 9.485 84.943 1.00 0.00 O ATOM 24986 H1 WAT 3827 54.961 8.696 84.756 1.00 0.00 H ATOM 24987 H2 WAT 3827 53.623 9.158 85.291 1.00 0.00 H TER 24989 WAT 3827 ATOM 24989 O WAT 3828 37.518 141.442 76.947 1.00 0.00 O ATOM 24990 H1 WAT 3828 37.921 141.071 76.162 1.00 0.00 H ATOM 24991 H2 WAT 3828 38.256 141.653 77.519 1.00 0.00 H TER 24993 WAT 3828 ATOM 24993 O WAT 3829 145.297 0.547 126.730 1.00 0.00 O ATOM 24994 H1 WAT 3829 145.251 0.008 125.940 1.00 0.00 H ATOM 24995 H2 WAT 3829 145.323 -0.084 127.449 1.00 0.00 H TER 24997 WAT 3829 ATOM 24997 O WAT 3830 45.941 20.077 70.443 1.00 0.00 O ATOM 24998 H1 WAT 3830 46.094 19.543 69.664 1.00 0.00 H ATOM 24999 H2 WAT 3830 45.460 19.501 71.038 1.00 0.00 H TER 25001 WAT 3830 ATOM 25001 O WAT 3831 86.619 47.433 146.974 1.00 0.00 O ATOM 25002 H1 WAT 3831 86.489 46.508 146.765 1.00 0.00 H ATOM 25003 H2 WAT 3831 87.307 47.433 147.639 1.00 0.00 H TER 25005 WAT 3831 ATOM 25005 O WAT 3832 94.065 141.035 142.439 1.00 0.00 O ATOM 25006 H1 WAT 3832 95.008 141.191 142.487 1.00 0.00 H ATOM 25007 H2 WAT 3832 93.972 140.317 141.813 1.00 0.00 H TER 25009 WAT 3832 ATOM 25009 O WAT 3833 20.561 74.531 12.396 1.00 0.00 O ATOM 25010 H1 WAT 3833 21.177 74.888 11.757 1.00 0.00 H ATOM 25011 H2 WAT 3833 20.974 73.723 12.702 1.00 0.00 H TER 25013 WAT 3833 ATOM 25013 O WAT 3834 97.021 40.747 71.241 1.00 0.00 O ATOM 25014 H1 WAT 3834 96.912 41.303 70.469 1.00 0.00 H ATOM 25015 H2 WAT 3834 97.962 40.762 71.415 1.00 0.00 H TER 25017 WAT 3834 ATOM 25017 O WAT 3835 76.552 56.655 138.272 1.00 0.00 O ATOM 25018 H1 WAT 3835 75.979 56.873 137.537 1.00 0.00 H ATOM 25019 H2 WAT 3835 76.347 57.311 138.938 1.00 0.00 H TER 25021 WAT 3835 ATOM 25021 O WAT 3836 37.261 26.885 4.680 1.00 0.00 O ATOM 25022 H1 WAT 3836 38.164 26.619 4.509 1.00 0.00 H ATOM 25023 H2 WAT 3836 37.326 27.496 5.413 1.00 0.00 H TER 25025 WAT 3836 ATOM 25025 O WAT 3837 11.672 87.785 94.079 1.00 0.00 O ATOM 25026 H1 WAT 3837 12.212 87.115 93.660 1.00 0.00 H ATOM 25027 H2 WAT 3837 12.116 88.610 93.879 1.00 0.00 H TER 25029 WAT 3837 ATOM 25029 O WAT 3838 46.703 14.706 142.402 1.00 0.00 O ATOM 25030 H1 WAT 3838 45.974 15.263 142.129 1.00 0.00 H ATOM 25031 H2 WAT 3838 46.462 14.408 143.279 1.00 0.00 H TER 25033 WAT 3838 ATOM 25033 O WAT 3839 30.206 31.463 153.784 1.00 0.00 O ATOM 25034 H1 WAT 3839 30.770 32.063 153.296 1.00 0.00 H ATOM 25035 H2 WAT 3839 29.563 32.030 154.209 1.00 0.00 H TER 25037 WAT 3839 ATOM 25037 O WAT 3840 128.222 44.633 67.789 1.00 0.00 O ATOM 25038 H1 WAT 3840 128.225 43.975 68.483 1.00 0.00 H ATOM 25039 H2 WAT 3840 127.296 44.752 67.576 1.00 0.00 H TER 25041 WAT 3840 ATOM 25041 O WAT 3841 143.388 63.614 82.073 1.00 0.00 O ATOM 25042 H1 WAT 3841 143.372 64.169 81.294 1.00 0.00 H ATOM 25043 H2 WAT 3841 142.619 63.884 82.575 1.00 0.00 H TER 25045 WAT 3841 ATOM 25045 O WAT 3842 137.588 3.060 17.963 1.00 0.00 O ATOM 25046 H1 WAT 3842 138.276 3.725 17.980 1.00 0.00 H ATOM 25047 H2 WAT 3842 136.950 3.359 18.611 1.00 0.00 H TER 25049 WAT 3842 ATOM 25049 O WAT 3843 144.254 127.469 68.618 1.00 0.00 O ATOM 25050 H1 WAT 3843 144.725 127.225 67.822 1.00 0.00 H ATOM 25051 H2 WAT 3843 143.330 127.374 68.388 1.00 0.00 H TER 25053 WAT 3843 ATOM 25053 O WAT 3844 130.375 12.171 105.414 1.00 0.00 O ATOM 25054 H1 WAT 3844 130.457 11.814 104.529 1.00 0.00 H ATOM 25055 H2 WAT 3844 131.225 12.573 105.590 1.00 0.00 H TER 25057 WAT 3844 ATOM 25057 O WAT 3845 59.921 18.161 146.206 1.00 0.00 O ATOM 25058 H1 WAT 3845 60.563 18.752 145.814 1.00 0.00 H ATOM 25059 H2 WAT 3845 59.372 17.884 145.473 1.00 0.00 H TER 25061 WAT 3845 ATOM 25061 O WAT 3846 102.099 20.771 152.274 1.00 0.00 O ATOM 25062 H1 WAT 3846 102.366 20.325 153.078 1.00 0.00 H ATOM 25063 H2 WAT 3846 101.338 20.277 151.968 1.00 0.00 H TER 25065 WAT 3846 ATOM 25065 O WAT 3847 131.040 54.214 79.613 1.00 0.00 O ATOM 25066 H1 WAT 3847 130.150 54.158 79.961 1.00 0.00 H ATOM 25067 H2 WAT 3847 131.289 55.130 79.738 1.00 0.00 H TER 25069 WAT 3847 ATOM 25069 O WAT 3848 98.717 121.643 4.704 1.00 0.00 O ATOM 25070 H1 WAT 3848 98.449 122.436 5.168 1.00 0.00 H ATOM 25071 H2 WAT 3848 99.312 121.953 4.022 1.00 0.00 H TER 25073 WAT 3848 ATOM 25073 O WAT 3849 112.543 138.165 97.713 1.00 0.00 O ATOM 25074 H1 WAT 3849 112.004 137.404 97.496 1.00 0.00 H ATOM 25075 H2 WAT 3849 112.531 138.202 98.669 1.00 0.00 H TER 25077 WAT 3849 ATOM 25077 O WAT 3850 63.474 138.956 141.916 1.00 0.00 O ATOM 25078 H1 WAT 3850 64.189 139.076 141.291 1.00 0.00 H ATOM 25079 H2 WAT 3850 63.746 138.210 142.451 1.00 0.00 H TER 25081 WAT 3850 ATOM 25081 O WAT 3851 108.971 28.027 149.267 1.00 0.00 O ATOM 25082 H1 WAT 3851 109.833 28.140 148.867 1.00 0.00 H ATOM 25083 H2 WAT 3851 108.581 27.294 148.790 1.00 0.00 H TER 25085 WAT 3851 ATOM 25085 O WAT 3852 38.786 62.664 4.592 1.00 0.00 O ATOM 25086 H1 WAT 3852 39.555 62.268 4.182 1.00 0.00 H ATOM 25087 H2 WAT 3852 38.624 63.456 4.080 1.00 0.00 H TER 25089 WAT 3852 ATOM 25089 O WAT 3853 77.754 21.245 117.297 1.00 0.00 O ATOM 25090 H1 WAT 3853 78.633 21.510 117.566 1.00 0.00 H ATOM 25091 H2 WAT 3853 77.228 22.041 117.379 1.00 0.00 H TER 25093 WAT 3853 ATOM 25093 O WAT 3854 87.852 11.581 75.473 1.00 0.00 O ATOM 25094 H1 WAT 3854 87.594 11.025 76.208 1.00 0.00 H ATOM 25095 H2 WAT 3854 88.649 12.019 75.773 1.00 0.00 H TER 25097 WAT 3854 ATOM 25097 O WAT 3855 36.268 112.061 149.466 1.00 0.00 O ATOM 25098 H1 WAT 3855 37.156 112.231 149.151 1.00 0.00 H ATOM 25099 H2 WAT 3855 36.329 111.214 149.908 1.00 0.00 H TER 25101 WAT 3855 ATOM 25101 O WAT 3856 128.877 43.769 143.911 1.00 0.00 O ATOM 25102 H1 WAT 3856 128.762 43.792 144.861 1.00 0.00 H ATOM 25103 H2 WAT 3856 128.021 44.015 143.560 1.00 0.00 H TER 25105 WAT 3856 ATOM 25105 O WAT 3857 106.549 15.379 11.738 1.00 0.00 O ATOM 25106 H1 WAT 3857 107.296 14.864 11.433 1.00 0.00 H ATOM 25107 H2 WAT 3857 105.952 14.733 12.117 1.00 0.00 H TER 25109 WAT 3857 ATOM 25109 O WAT 3858 50.140 0.013 2.494 1.00 0.00 O ATOM 25110 H1 WAT 3858 51.015 -0.254 2.773 1.00 0.00 H ATOM 25111 H2 WAT 3858 50.251 0.283 1.582 1.00 0.00 H TER 25113 WAT 3858 ATOM 25113 O WAT 3859 145.582 31.050 21.701 1.00 0.00 O ATOM 25114 H1 WAT 3859 145.157 30.427 21.112 1.00 0.00 H ATOM 25115 H2 WAT 3859 146.283 31.436 21.176 1.00 0.00 H TER 25117 WAT 3859 ATOM 25117 O WAT 3860 14.671 36.806 115.220 1.00 0.00 O ATOM 25118 H1 WAT 3860 14.593 37.116 114.318 1.00 0.00 H ATOM 25119 H2 WAT 3860 15.500 37.171 115.528 1.00 0.00 H TER 25121 WAT 3860 ATOM 25121 O WAT 3861 6.710 19.079 142.418 1.00 0.00 O ATOM 25122 H1 WAT 3861 6.887 19.701 141.713 1.00 0.00 H ATOM 25123 H2 WAT 3861 7.243 19.388 143.150 1.00 0.00 H TER 25125 WAT 3861 ATOM 25125 O WAT 3862 4.175 133.227 3.024 1.00 0.00 O ATOM 25126 H1 WAT 3862 3.655 133.097 3.817 1.00 0.00 H ATOM 25127 H2 WAT 3862 5.026 133.529 3.342 1.00 0.00 H TER 25129 WAT 3862 ATOM 25129 O WAT 3863 89.558 110.550 82.317 1.00 0.00 O ATOM 25130 H1 WAT 3863 90.205 110.756 81.643 1.00 0.00 H ATOM 25131 H2 WAT 3863 89.407 109.610 82.226 1.00 0.00 H TER 25133 WAT 3863 ATOM 25133 O WAT 3864 76.920 130.973 153.501 1.00 0.00 O ATOM 25134 H1 WAT 3864 76.377 131.758 153.568 1.00 0.00 H ATOM 25135 H2 WAT 3864 76.514 130.350 154.104 1.00 0.00 H TER 25137 WAT 3864 ATOM 25137 O WAT 3865 10.134 30.198 107.491 1.00 0.00 O ATOM 25138 H1 WAT 3865 9.663 29.882 108.263 1.00 0.00 H ATOM 25139 H2 WAT 3865 11.012 30.401 107.813 1.00 0.00 H TER 25141 WAT 3865 ATOM 25141 O WAT 3866 38.135 39.401 153.327 1.00 0.00 O ATOM 25142 H1 WAT 3866 38.973 39.343 153.785 1.00 0.00 H ATOM 25143 H2 WAT 3866 38.041 40.329 153.115 1.00 0.00 H TER 25145 WAT 3866 ATOM 25145 O WAT 3867 9.020 30.943 133.687 1.00 0.00 O ATOM 25146 H1 WAT 3867 9.797 31.217 133.199 1.00 0.00 H ATOM 25147 H2 WAT 3867 9.267 31.045 134.607 1.00 0.00 H TER 25149 WAT 3867 ATOM 25149 O WAT 3868 93.447 90.594 144.768 1.00 0.00 O ATOM 25150 H1 WAT 3868 94.126 90.457 145.429 1.00 0.00 H ATOM 25151 H2 WAT 3868 93.603 89.909 144.118 1.00 0.00 H TER 25153 WAT 3868 ATOM 25153 O WAT 3869 136.962 14.322 91.260 1.00 0.00 O ATOM 25154 H1 WAT 3869 136.970 13.379 91.096 1.00 0.00 H ATOM 25155 H2 WAT 3869 136.533 14.414 92.110 1.00 0.00 H TER 25157 WAT 3869 ATOM 25157 O WAT 3870 56.086 3.304 139.233 1.00 0.00 O ATOM 25158 H1 WAT 3870 56.127 2.350 139.293 1.00 0.00 H ATOM 25159 H2 WAT 3870 55.895 3.592 140.126 1.00 0.00 H TER 25161 WAT 3870 ATOM 25161 O WAT 3871 106.256 88.634 152.859 1.00 0.00 O ATOM 25162 H1 WAT 3871 105.924 88.545 153.752 1.00 0.00 H ATOM 25163 H2 WAT 3871 106.678 87.796 152.675 1.00 0.00 H TER 25165 WAT 3871 ATOM 25165 O WAT 3872 94.211 7.109 116.899 1.00 0.00 O ATOM 25166 H1 WAT 3872 94.562 6.915 116.029 1.00 0.00 H ATOM 25167 H2 WAT 3872 94.760 7.823 117.224 1.00 0.00 H TER 25169 WAT 3872 ATOM 25169 O WAT 3873 17.707 90.324 17.756 1.00 0.00 O ATOM 25170 H1 WAT 3873 17.817 89.385 17.602 1.00 0.00 H ATOM 25171 H2 WAT 3873 18.420 90.732 17.263 1.00 0.00 H TER 25173 WAT 3873 ATOM 25173 O WAT 3874 46.548 70.745 130.129 1.00 0.00 O ATOM 25174 H1 WAT 3874 46.365 70.639 131.063 1.00 0.00 H ATOM 25175 H2 WAT 3874 45.749 71.129 129.770 1.00 0.00 H TER 25177 WAT 3874 ATOM 25177 O WAT 3875 126.248 72.871 151.441 1.00 0.00 O ATOM 25178 H1 WAT 3875 126.098 71.965 151.169 1.00 0.00 H ATOM 25179 H2 WAT 3875 126.129 72.859 152.390 1.00 0.00 H TER 25181 WAT 3875 ATOM 25181 O WAT 3876 71.069 99.936 70.372 1.00 0.00 O ATOM 25182 H1 WAT 3876 71.438 100.647 70.896 1.00 0.00 H ATOM 25183 H2 WAT 3876 70.125 100.090 70.390 1.00 0.00 H TER 25185 WAT 3876 ATOM 25185 O WAT 3877 14.024 92.055 123.152 1.00 0.00 O ATOM 25186 H1 WAT 3877 14.397 91.411 122.551 1.00 0.00 H ATOM 25187 H2 WAT 3877 14.535 92.850 122.998 1.00 0.00 H TER 25189 WAT 3877 ATOM 25189 O WAT 3878 58.635 94.600 23.879 1.00 0.00 O ATOM 25190 H1 WAT 3878 57.836 94.983 23.517 1.00 0.00 H ATOM 25191 H2 WAT 3878 58.493 93.655 23.826 1.00 0.00 H TER 25193 WAT 3878 ATOM 25193 O WAT 3879 140.377 139.792 101.440 1.00 0.00 O ATOM 25194 H1 WAT 3879 140.011 139.198 102.095 1.00 0.00 H ATOM 25195 H2 WAT 3879 139.879 139.608 100.644 1.00 0.00 H TER 25197 WAT 3879 ATOM 25197 O WAT 3880 111.937 105.434 145.908 1.00 0.00 O ATOM 25198 H1 WAT 3880 112.600 105.164 146.543 1.00 0.00 H ATOM 25199 H2 WAT 3880 111.980 106.390 145.908 1.00 0.00 H TER 25201 WAT 3880 ATOM 25201 O WAT 3881 60.234 127.480 151.810 1.00 0.00 O ATOM 25202 H1 WAT 3881 60.509 127.528 152.725 1.00 0.00 H ATOM 25203 H2 WAT 3881 61.010 127.736 151.312 1.00 0.00 H TER 25205 WAT 3881 ATOM 25205 O WAT 3882 122.995 130.613 5.879 1.00 0.00 O ATOM 25206 H1 WAT 3882 123.450 130.598 6.721 1.00 0.00 H ATOM 25207 H2 WAT 3882 123.625 130.245 5.260 1.00 0.00 H TER 25209 WAT 3882 ATOM 25209 O WAT 3883 92.323 0.439 53.924 1.00 0.00 O ATOM 25210 H1 WAT 3883 93.226 0.643 53.678 1.00 0.00 H ATOM 25211 H2 WAT 3883 91.789 0.970 53.334 1.00 0.00 H TER 25213 WAT 3883 ATOM 25213 O WAT 3884 100.483 17.695 135.803 1.00 0.00 O ATOM 25214 H1 WAT 3884 100.644 17.772 136.744 1.00 0.00 H ATOM 25215 H2 WAT 3884 101.233 17.201 135.472 1.00 0.00 H TER 25217 WAT 3884 ATOM 25217 O WAT 3885 78.633 4.574 94.288 1.00 0.00 O ATOM 25218 H1 WAT 3885 79.000 4.894 93.464 1.00 0.00 H ATOM 25219 H2 WAT 3885 77.713 4.402 94.090 1.00 0.00 H TER 25221 WAT 3885 ATOM 25221 O WAT 3886 139.586 92.078 151.532 1.00 0.00 O ATOM 25222 H1 WAT 3886 139.467 91.890 150.601 1.00 0.00 H ATOM 25223 H2 WAT 3886 140.318 92.695 151.560 1.00 0.00 H TER 25225 WAT 3886 ATOM 25225 O WAT 3887 115.311 25.142 98.388 1.00 0.00 O ATOM 25226 H1 WAT 3887 114.394 25.097 98.659 1.00 0.00 H ATOM 25227 H2 WAT 3887 115.558 26.056 98.528 1.00 0.00 H TER 25229 WAT 3887 ATOM 25229 O WAT 3888 114.535 4.613 139.698 1.00 0.00 O ATOM 25230 H1 WAT 3888 114.229 4.991 140.522 1.00 0.00 H ATOM 25231 H2 WAT 3888 113.941 3.881 139.534 1.00 0.00 H TER 25233 WAT 3888 ATOM 25233 O WAT 3889 74.601 95.477 115.414 1.00 0.00 O ATOM 25234 H1 WAT 3889 75.525 95.649 115.235 1.00 0.00 H ATOM 25235 H2 WAT 3889 74.162 96.306 115.225 1.00 0.00 H TER 25237 WAT 3889 ATOM 25237 O WAT 3890 72.405 107.107 112.396 1.00 0.00 O ATOM 25238 H1 WAT 3890 73.135 107.261 112.995 1.00 0.00 H ATOM 25239 H2 WAT 3890 72.011 107.970 112.271 1.00 0.00 H TER 25241 WAT 3890 ATOM 25241 O WAT 3891 104.691 122.843 118.491 1.00 0.00 O ATOM 25242 H1 WAT 3891 104.955 123.618 118.986 1.00 0.00 H ATOM 25243 H2 WAT 3891 103.902 123.116 118.023 1.00 0.00 H TER 25245 WAT 3891 ATOM 25245 O WAT 3892 29.653 98.608 22.006 1.00 0.00 O ATOM 25246 H1 WAT 3892 29.086 97.933 22.379 1.00 0.00 H ATOM 25247 H2 WAT 3892 30.502 98.467 22.424 1.00 0.00 H TER 25249 WAT 3892 ATOM 25249 O WAT 3893 121.082 99.280 158.354 1.00 0.00 O ATOM 25250 H1 WAT 3893 121.513 100.110 158.148 1.00 0.00 H ATOM 25251 H2 WAT 3893 121.490 98.645 157.765 1.00 0.00 H TER 25253 WAT 3893 ATOM 25253 O WAT 3894 63.843 65.671 116.259 1.00 0.00 O ATOM 25254 H1 WAT 3894 63.366 65.050 116.810 1.00 0.00 H ATOM 25255 H2 WAT 3894 63.276 66.441 116.218 1.00 0.00 H TER 25257 WAT 3894 ATOM 25257 O WAT 3895 120.298 57.629 75.174 1.00 0.00 O ATOM 25258 H1 WAT 3895 120.152 58.271 74.480 1.00 0.00 H ATOM 25259 H2 WAT 3895 119.931 58.037 75.958 1.00 0.00 H TER 25261 WAT 3895 ATOM 25261 O WAT 3896 36.557 93.329 0.639 1.00 0.00 O ATOM 25262 H1 WAT 3896 37.143 92.870 1.242 1.00 0.00 H ATOM 25263 H2 WAT 3896 36.913 94.216 0.588 1.00 0.00 H TER 25265 WAT 3896 ATOM 25265 O WAT 3897 1.070 33.623 147.827 1.00 0.00 O ATOM 25266 H1 WAT 3897 1.696 34.241 147.450 1.00 0.00 H ATOM 25267 H2 WAT 3897 0.888 33.969 148.701 1.00 0.00 H TER 25269 WAT 3897 ATOM 25269 O WAT 3898 20.612 47.889 137.200 1.00 0.00 O ATOM 25270 H1 WAT 3898 20.444 48.825 137.311 1.00 0.00 H ATOM 25271 H2 WAT 3898 21.551 47.793 137.363 1.00 0.00 H TER 25273 WAT 3898 ATOM 25273 O WAT 3899 123.334 78.590 78.371 1.00 0.00 O ATOM 25274 H1 WAT 3899 123.677 79.483 78.344 1.00 0.00 H ATOM 25275 H2 WAT 3899 123.154 78.375 77.456 1.00 0.00 H TER 25277 WAT 3899 ATOM 25277 O WAT 3900 25.561 15.537 16.761 1.00 0.00 O ATOM 25278 H1 WAT 3900 25.165 16.268 17.235 1.00 0.00 H ATOM 25279 H2 WAT 3900 26.465 15.812 16.608 1.00 0.00 H TER 25281 WAT 3900 ATOM 25281 O WAT 3901 35.375 70.432 102.201 1.00 0.00 O ATOM 25282 H1 WAT 3901 34.801 69.831 102.677 1.00 0.00 H ATOM 25283 H2 WAT 3901 35.077 70.379 101.293 1.00 0.00 H TER 25285 WAT 3901 ATOM 25285 O WAT 3902 111.524 99.738 114.726 1.00 0.00 O ATOM 25286 H1 WAT 3902 110.710 99.482 115.158 1.00 0.00 H ATOM 25287 H2 WAT 3902 111.305 100.547 114.263 1.00 0.00 H TER 25289 WAT 3902 ATOM 25289 O WAT 3903 54.531 58.630 60.543 1.00 0.00 O ATOM 25290 H1 WAT 3903 55.255 58.246 60.048 1.00 0.00 H ATOM 25291 H2 WAT 3903 54.479 58.102 61.339 1.00 0.00 H TER 25293 WAT 3903 ATOM 25293 O WAT 3904 139.286 100.010 103.282 1.00 0.00 O ATOM 25294 H1 WAT 3904 140.067 100.550 103.160 1.00 0.00 H ATOM 25295 H2 WAT 3904 138.896 100.332 104.094 1.00 0.00 H TER 25297 WAT 3904 ATOM 25297 O WAT 3905 26.922 112.740 151.360 1.00 0.00 O ATOM 25298 H1 WAT 3905 26.883 113.629 151.712 1.00 0.00 H ATOM 25299 H2 WAT 3905 27.565 112.292 151.910 1.00 0.00 H TER 25301 WAT 3905 ATOM 25301 O WAT 3906 46.441 143.850 102.149 1.00 0.00 O ATOM 25302 H1 WAT 3906 46.521 143.282 102.915 1.00 0.00 H ATOM 25303 H2 WAT 3906 45.510 143.823 101.927 1.00 0.00 H TER 25305 WAT 3906 ATOM 25305 O WAT 3907 143.029 9.970 4.519 1.00 0.00 O ATOM 25306 H1 WAT 3907 142.619 9.827 3.666 1.00 0.00 H ATOM 25307 H2 WAT 3907 143.486 10.806 4.428 1.00 0.00 H TER 25309 WAT 3907 ATOM 25309 O WAT 3908 77.828 25.877 140.590 1.00 0.00 O ATOM 25310 H1 WAT 3908 77.654 25.536 141.467 1.00 0.00 H ATOM 25311 H2 WAT 3908 77.563 26.796 140.633 1.00 0.00 H TER 25313 WAT 3908 ATOM 25313 O WAT 3909 80.572 93.870 118.790 1.00 0.00 O ATOM 25314 H1 WAT 3909 80.171 93.406 118.055 1.00 0.00 H ATOM 25315 H2 WAT 3909 80.575 94.789 118.520 1.00 0.00 H TER 25317 WAT 3909 ATOM 25317 O WAT 3910 10.801 25.228 156.039 1.00 0.00 O ATOM 25318 H1 WAT 3910 10.367 25.371 155.198 1.00 0.00 H ATOM 25319 H2 WAT 3910 10.942 24.282 156.079 1.00 0.00 H TER 25321 WAT 3910 ATOM 25321 O WAT 3911 46.434 113.873 153.153 1.00 0.00 O ATOM 25322 H1 WAT 3911 46.748 112.972 153.075 1.00 0.00 H ATOM 25323 H2 WAT 3911 47.099 114.398 152.709 1.00 0.00 H TER 25325 WAT 3911 ATOM 25325 O WAT 3912 135.805 93.897 4.645 1.00 0.00 O ATOM 25326 H1 WAT 3912 136.023 94.468 5.382 1.00 0.00 H ATOM 25327 H2 WAT 3912 134.921 93.585 4.838 1.00 0.00 H TER 25329 WAT 3912 ATOM 25329 O WAT 3913 31.693 22.515 112.774 1.00 0.00 O ATOM 25330 H1 WAT 3913 31.307 23.306 113.152 1.00 0.00 H ATOM 25331 H2 WAT 3913 30.962 21.900 112.709 1.00 0.00 H TER 25333 WAT 3913 ATOM 25333 O WAT 3914 1.734 97.126 133.713 1.00 0.00 O ATOM 25334 H1 WAT 3914 2.315 96.879 132.994 1.00 0.00 H ATOM 25335 H2 WAT 3914 0.858 97.117 133.328 1.00 0.00 H TER 25337 WAT 3914 ATOM 25337 O WAT 3915 11.355 54.980 98.841 1.00 0.00 O ATOM 25338 H1 WAT 3915 12.123 54.831 99.392 1.00 0.00 H ATOM 25339 H2 WAT 3915 10.621 55.005 99.455 1.00 0.00 H TER 25341 WAT 3915 ATOM 25341 O WAT 3916 140.706 19.326 9.910 1.00 0.00 O ATOM 25342 H1 WAT 3916 141.567 18.912 9.972 1.00 0.00 H ATOM 25343 H2 WAT 3916 140.895 20.261 9.841 1.00 0.00 H TER 25345 WAT 3916 ATOM 25345 O WAT 3917 21.505 40.235 19.380 1.00 0.00 O ATOM 25346 H1 WAT 3917 21.247 39.632 20.077 1.00 0.00 H ATOM 25347 H2 WAT 3917 20.912 40.980 19.477 1.00 0.00 H TER 25349 WAT 3917 ATOM 25349 O WAT 3918 131.356 118.097 122.715 1.00 0.00 O ATOM 25350 H1 WAT 3918 131.355 117.298 123.241 1.00 0.00 H ATOM 25351 H2 WAT 3918 131.359 117.788 121.809 1.00 0.00 H TER 25353 WAT 3918 ATOM 25353 O WAT 3919 20.794 61.177 66.124 1.00 0.00 O ATOM 25354 H1 WAT 3919 20.199 61.273 65.380 1.00 0.00 H ATOM 25355 H2 WAT 3919 20.831 62.050 66.514 1.00 0.00 H TER 25357 WAT 3919 ATOM 25357 O WAT 3920 100.915 35.100 123.626 1.00 0.00 O ATOM 25358 H1 WAT 3920 100.810 34.148 123.627 1.00 0.00 H ATOM 25359 H2 WAT 3920 100.143 35.425 123.163 1.00 0.00 H TER 25361 WAT 3920 ATOM 25361 O WAT 3921 132.203 35.531 12.077 1.00 0.00 O ATOM 25362 H1 WAT 3921 132.991 35.120 11.721 1.00 0.00 H ATOM 25363 H2 WAT 3921 131.590 35.553 11.341 1.00 0.00 H TER 25365 WAT 3921 ATOM 25365 O WAT 3922 129.357 61.313 22.310 1.00 0.00 O ATOM 25366 H1 WAT 3922 128.702 61.749 22.855 1.00 0.00 H ATOM 25367 H2 WAT 3922 129.162 61.607 21.420 1.00 0.00 H TER 25369 WAT 3922 ATOM 25369 O WAT 3923 115.529 86.865 68.420 1.00 0.00 O ATOM 25370 H1 WAT 3923 115.238 87.648 68.888 1.00 0.00 H ATOM 25371 H2 WAT 3923 116.442 87.046 68.197 1.00 0.00 H TER 25373 WAT 3923 ATOM 25373 O WAT 3924 140.809 28.138 55.433 1.00 0.00 O ATOM 25374 H1 WAT 3924 141.249 27.615 56.103 1.00 0.00 H ATOM 25375 H2 WAT 3924 141.482 28.740 55.117 1.00 0.00 H TER 25377 WAT 3924 ATOM 25377 O WAT 3925 95.632 47.086 83.109 1.00 0.00 O ATOM 25378 H1 WAT 3925 96.332 47.704 82.898 1.00 0.00 H ATOM 25379 H2 WAT 3925 96.009 46.225 82.926 1.00 0.00 H TER 25381 WAT 3925 ATOM 25381 O WAT 3926 41.783 26.514 81.886 1.00 0.00 O ATOM 25382 H1 WAT 3926 41.562 25.663 82.265 1.00 0.00 H ATOM 25383 H2 WAT 3926 41.038 27.074 82.103 1.00 0.00 H TER 25385 WAT 3926 ATOM 25385 O WAT 3927 70.225 134.851 105.999 1.00 0.00 O ATOM 25386 H1 WAT 3927 69.855 134.014 105.717 1.00 0.00 H ATOM 25387 H2 WAT 3927 69.820 135.017 106.850 1.00 0.00 H TER 25389 WAT 3927 ATOM 25389 O WAT 3928 53.609 129.737 85.815 1.00 0.00 O ATOM 25390 H1 WAT 3928 53.769 130.510 85.274 1.00 0.00 H ATOM 25391 H2 WAT 3928 53.536 129.017 85.189 1.00 0.00 H TER 25393 WAT 3928 ATOM 25393 O WAT 3929 19.666 65.551 14.346 1.00 0.00 O ATOM 25394 H1 WAT 3929 19.745 65.386 15.285 1.00 0.00 H ATOM 25395 H2 WAT 3929 20.363 65.027 13.951 1.00 0.00 H TER 25397 WAT 3929 ATOM 25397 O WAT 3930 126.500 86.909 71.438 1.00 0.00 O ATOM 25398 H1 WAT 3930 127.021 87.011 70.641 1.00 0.00 H ATOM 25399 H2 WAT 3930 126.208 87.797 71.648 1.00 0.00 H TER 25401 WAT 3930 ATOM 25401 O WAT 3931 71.323 59.601 111.646 1.00 0.00 O ATOM 25402 H1 WAT 3931 72.148 59.644 111.163 1.00 0.00 H ATOM 25403 H2 WAT 3931 70.848 58.874 111.245 1.00 0.00 H TER 25405 WAT 3931 ATOM 25405 O WAT 3932 47.749 83.878 72.305 1.00 0.00 O ATOM 25406 H1 WAT 3932 47.013 83.520 72.802 1.00 0.00 H ATOM 25407 H2 WAT 3932 48.313 84.280 72.966 1.00 0.00 H TER 25409 WAT 3932 ATOM 25409 O WAT 3933 32.869 72.644 111.349 1.00 0.00 O ATOM 25410 H1 WAT 3933 33.403 72.748 112.137 1.00 0.00 H ATOM 25411 H2 WAT 3933 32.680 71.706 111.310 1.00 0.00 H TER 25413 WAT 3933 ATOM 25413 O WAT 3934 7.369 47.589 101.936 1.00 0.00 O ATOM 25414 H1 WAT 3934 7.924 47.687 101.162 1.00 0.00 H ATOM 25415 H2 WAT 3934 6.476 47.579 101.591 1.00 0.00 H TER 25417 WAT 3934 ATOM 25417 O WAT 3935 138.183 136.572 84.634 1.00 0.00 O ATOM 25418 H1 WAT 3935 138.111 136.130 85.480 1.00 0.00 H ATOM 25419 H2 WAT 3935 137.387 137.100 84.571 1.00 0.00 H TER 25421 WAT 3935 ATOM 25421 O WAT 3936 84.368 91.618 116.885 1.00 0.00 O ATOM 25422 H1 WAT 3936 84.855 92.395 116.608 1.00 0.00 H ATOM 25423 H2 WAT 3936 84.313 91.077 116.098 1.00 0.00 H TER 25425 WAT 3936 ATOM 25425 O WAT 3937 89.897 126.136 104.721 1.00 0.00 O ATOM 25426 H1 WAT 3937 90.173 126.724 105.424 1.00 0.00 H ATOM 25427 H2 WAT 3937 89.334 125.494 105.152 1.00 0.00 H TER 25429 WAT 3937 ATOM 25429 O WAT 3938 128.731 68.686 112.731 1.00 0.00 O ATOM 25430 H1 WAT 3938 127.836 68.741 113.064 1.00 0.00 H ATOM 25431 H2 WAT 3938 129.205 69.372 113.202 1.00 0.00 H TER 25433 WAT 3938 ATOM 25433 O WAT 3939 131.698 62.602 110.169 1.00 0.00 O ATOM 25434 H1 WAT 3939 130.767 62.658 109.956 1.00 0.00 H ATOM 25435 H2 WAT 3939 131.922 63.472 110.500 1.00 0.00 H TER 25437 WAT 3939 ATOM 25437 O WAT 3940 115.143 108.344 143.114 1.00 0.00 O ATOM 25438 H1 WAT 3940 115.614 107.853 142.441 1.00 0.00 H ATOM 25439 H2 WAT 3940 115.146 109.247 142.798 1.00 0.00 H TER 25441 WAT 3940 ATOM 25441 O WAT 3941 88.160 144.658 76.259 1.00 0.00 O ATOM 25442 H1 WAT 3941 88.989 144.978 76.614 1.00 0.00 H ATOM 25443 H2 WAT 3941 88.324 144.557 75.321 1.00 0.00 H TER 25445 WAT 3941 ATOM 25445 O WAT 3942 110.918 74.838 15.223 1.00 0.00 O ATOM 25446 H1 WAT 3942 111.567 75.130 15.863 1.00 0.00 H ATOM 25447 H2 WAT 3942 111.436 74.516 14.486 1.00 0.00 H TER 25449 WAT 3942 ATOM 25449 O WAT 3943 10.590 12.299 146.515 1.00 0.00 O ATOM 25450 H1 WAT 3943 11.154 12.200 145.748 1.00 0.00 H ATOM 25451 H2 WAT 3943 10.249 13.191 146.448 1.00 0.00 H TER 25453 WAT 3943 ATOM 25453 O WAT 3944 142.205 100.339 86.780 1.00 0.00 O ATOM 25454 H1 WAT 3944 141.539 99.919 86.234 1.00 0.00 H ATOM 25455 H2 WAT 3944 142.852 100.668 86.156 1.00 0.00 H TER 25457 WAT 3944 ATOM 25457 O WAT 3945 122.800 77.910 75.754 1.00 0.00 O ATOM 25458 H1 WAT 3945 122.993 78.628 75.151 1.00 0.00 H ATOM 25459 H2 WAT 3945 122.951 77.117 75.239 1.00 0.00 H TER 25461 WAT 3945 ATOM 25461 O WAT 3946 124.296 111.845 132.377 1.00 0.00 O ATOM 25462 H1 WAT 3946 124.817 112.642 132.280 1.00 0.00 H ATOM 25463 H2 WAT 3946 124.305 111.445 131.508 1.00 0.00 H TER 25465 WAT 3946 ATOM 25465 O WAT 3947 22.454 101.008 99.535 1.00 0.00 O ATOM 25466 H1 WAT 3947 22.329 100.304 98.900 1.00 0.00 H ATOM 25467 H2 WAT 3947 23.249 101.454 99.245 1.00 0.00 H TER 25469 WAT 3947 ATOM 25469 O WAT 3948 47.771 145.583 143.504 1.00 0.00 O ATOM 25470 H1 WAT 3948 46.903 145.929 143.708 1.00 0.00 H ATOM 25471 H2 WAT 3948 48.335 145.929 144.195 1.00 0.00 H TER 25473 WAT 3948 ATOM 25473 O WAT 3949 118.540 78.441 2.418 1.00 0.00 O ATOM 25474 H1 WAT 3949 117.714 78.088 2.089 1.00 0.00 H ATOM 25475 H2 WAT 3949 118.652 79.267 1.946 1.00 0.00 H TER 25477 WAT 3949 ATOM 25477 O WAT 3950 70.908 118.033 143.725 1.00 0.00 O ATOM 25478 H1 WAT 3950 70.366 117.326 144.075 1.00 0.00 H ATOM 25479 H2 WAT 3950 71.807 117.759 143.905 1.00 0.00 H TER 25481 WAT 3950 ATOM 25481 O WAT 3951 67.105 41.857 83.215 1.00 0.00 O ATOM 25482 H1 WAT 3951 67.208 41.916 82.265 1.00 0.00 H ATOM 25483 H2 WAT 3951 67.637 41.103 83.467 1.00 0.00 H TER 25485 WAT 3951 ATOM 25485 O WAT 3952 58.751 75.441 23.652 1.00 0.00 O ATOM 25486 H1 WAT 3952 58.960 76.125 24.288 1.00 0.00 H ATOM 25487 H2 WAT 3952 59.547 74.911 23.601 1.00 0.00 H TER 25489 WAT 3952 ATOM 25489 O WAT 3953 116.232 72.264 80.008 1.00 0.00 O ATOM 25490 H1 WAT 3953 116.399 71.455 80.491 1.00 0.00 H ATOM 25491 H2 WAT 3953 116.949 72.846 80.261 1.00 0.00 H TER 25493 WAT 3953 ATOM 25493 O WAT 3954 124.712 18.745 102.865 1.00 0.00 O ATOM 25494 H1 WAT 3954 124.962 17.999 102.319 1.00 0.00 H ATOM 25495 H2 WAT 3954 123.785 18.884 102.670 1.00 0.00 H TER 25497 WAT 3954 ATOM 25497 O WAT 3955 19.960 41.977 73.835 1.00 0.00 O ATOM 25498 H1 WAT 3955 20.772 42.306 74.220 1.00 0.00 H ATOM 25499 H2 WAT 3955 20.244 41.481 73.067 1.00 0.00 H TER 25501 WAT 3955 ATOM 25501 O WAT 3956 84.570 137.814 75.106 1.00 0.00 O ATOM 25502 H1 WAT 3956 84.651 136.981 75.570 1.00 0.00 H ATOM 25503 H2 WAT 3956 85.026 137.671 74.276 1.00 0.00 H TER 25505 WAT 3956 ATOM 25505 O WAT 3957 17.794 127.440 60.590 1.00 0.00 O ATOM 25506 H1 WAT 3957 16.842 127.526 60.536 1.00 0.00 H ATOM 25507 H2 WAT 3957 18.130 128.139 60.029 1.00 0.00 H TER 25509 WAT 3957 ATOM 25509 O WAT 3958 83.835 77.167 98.807 1.00 0.00 O ATOM 25510 H1 WAT 3958 83.867 76.253 98.526 1.00 0.00 H ATOM 25511 H2 WAT 3958 83.946 77.670 98.000 1.00 0.00 H TER 25513 WAT 3958 ATOM 25513 O WAT 3959 63.000 61.841 115.611 1.00 0.00 O ATOM 25514 H1 WAT 3959 63.940 61.918 115.772 1.00 0.00 H ATOM 25515 H2 WAT 3959 62.934 61.603 114.686 1.00 0.00 H TER 25517 WAT 3959 ATOM 25517 O WAT 3960 52.696 57.148 19.149 1.00 0.00 O ATOM 25518 H1 WAT 3960 53.043 56.272 19.319 1.00 0.00 H ATOM 25519 H2 WAT 3960 52.160 57.345 19.918 1.00 0.00 H TER 25521 WAT 3960 ATOM 25521 O WAT 3961 79.415 73.720 14.366 1.00 0.00 O ATOM 25522 H1 WAT 3961 79.909 74.139 13.662 1.00 0.00 H ATOM 25523 H2 WAT 3961 78.528 73.631 14.017 1.00 0.00 H TER 25525 WAT 3961 ATOM 25525 O WAT 3962 38.840 92.894 110.374 1.00 0.00 O ATOM 25526 H1 WAT 3962 38.507 92.453 111.156 1.00 0.00 H ATOM 25527 H2 WAT 3962 38.111 93.437 110.076 1.00 0.00 H TER 25529 WAT 3962 ATOM 25529 O WAT 3963 94.784 121.045 111.625 1.00 0.00 O ATOM 25530 H1 WAT 3963 94.548 120.391 110.967 1.00 0.00 H ATOM 25531 H2 WAT 3963 95.647 120.772 111.936 1.00 0.00 H TER 25533 WAT 3963 ATOM 25533 O WAT 3964 82.016 74.183 123.963 1.00 0.00 O ATOM 25534 H1 WAT 3964 81.190 74.394 124.399 1.00 0.00 H ATOM 25535 H2 WAT 3964 82.357 75.028 123.672 1.00 0.00 H TER 25537 WAT 3964 ATOM 25537 O WAT 3965 28.665 29.055 80.273 1.00 0.00 O ATOM 25538 H1 WAT 3965 27.829 28.859 80.696 1.00 0.00 H ATOM 25539 H2 WAT 3965 29.242 28.339 80.538 1.00 0.00 H TER 25541 WAT 3965 ATOM 25541 O WAT 3966 40.075 17.558 124.873 1.00 0.00 O ATOM 25542 H1 WAT 3966 40.675 18.268 125.100 1.00 0.00 H ATOM 25543 H2 WAT 3966 40.612 16.767 124.920 1.00 0.00 H TER 25545 WAT 3966 ATOM 25545 O WAT 3967 114.393 15.689 82.775 1.00 0.00 O ATOM 25546 H1 WAT 3967 114.124 15.542 83.682 1.00 0.00 H ATOM 25547 H2 WAT 3967 114.443 14.813 82.395 1.00 0.00 H TER 25549 WAT 3967 ATOM 25549 O WAT 3968 34.607 56.487 87.880 1.00 0.00 O ATOM 25550 H1 WAT 3968 35.126 55.759 87.537 1.00 0.00 H ATOM 25551 H2 WAT 3968 34.421 56.242 88.787 1.00 0.00 H TER 25553 WAT 3968 ATOM 25553 O WAT 3969 4.079 77.420 153.556 1.00 0.00 O ATOM 25554 H1 WAT 3969 4.325 78.345 153.551 1.00 0.00 H ATOM 25555 H2 WAT 3969 4.702 77.003 152.960 1.00 0.00 H TER 25557 WAT 3969 ATOM 25557 O WAT 3970 118.798 49.056 65.859 1.00 0.00 O ATOM 25558 H1 WAT 3970 118.089 48.413 65.822 1.00 0.00 H ATOM 25559 H2 WAT 3970 118.991 49.252 64.942 1.00 0.00 H TER 25561 WAT 3970 ATOM 25561 O WAT 3971 26.137 75.445 93.394 1.00 0.00 O ATOM 25562 H1 WAT 3971 26.510 76.142 92.855 1.00 0.00 H ATOM 25563 H2 WAT 3971 25.949 74.739 92.776 1.00 0.00 H TER 25565 WAT 3971 ATOM 25565 O WAT 3972 93.615 139.047 115.155 1.00 0.00 O ATOM 25566 H1 WAT 3972 92.993 139.204 115.866 1.00 0.00 H ATOM 25567 H2 WAT 3972 94.176 138.342 115.478 1.00 0.00 H TER 25569 WAT 3972 ATOM 25569 O WAT 3973 121.311 5.408 83.645 1.00 0.00 O ATOM 25570 H1 WAT 3973 121.195 5.321 84.591 1.00 0.00 H ATOM 25571 H2 WAT 3973 120.433 5.292 83.284 1.00 0.00 H TER 25573 WAT 3973 ATOM 25573 O WAT 3974 8.923 101.551 14.307 1.00 0.00 O ATOM 25574 H1 WAT 3974 8.344 102.060 14.874 1.00 0.00 H ATOM 25575 H2 WAT 3974 8.370 100.847 13.970 1.00 0.00 H TER 25577 WAT 3974 ATOM 25577 O WAT 3975 121.739 69.061 139.158 1.00 0.00 O ATOM 25578 H1 WAT 3975 121.303 68.734 138.371 1.00 0.00 H ATOM 25579 H2 WAT 3975 122.443 69.620 138.828 1.00 0.00 H TER 25581 WAT 3975 ATOM 25581 O WAT 3976 86.076 137.251 4.589 1.00 0.00 O ATOM 25582 H1 WAT 3976 86.649 136.489 4.675 1.00 0.00 H ATOM 25583 H2 WAT 3976 86.273 137.603 3.721 1.00 0.00 H TER 25585 WAT 3976 ATOM 25585 O WAT 3977 126.582 70.721 82.229 1.00 0.00 O ATOM 25586 H1 WAT 3977 127.082 69.907 82.301 1.00 0.00 H ATOM 25587 H2 WAT 3977 126.373 70.792 81.298 1.00 0.00 H TER 25589 WAT 3977 ATOM 25589 O WAT 3978 71.257 47.415 137.005 1.00 0.00 O ATOM 25590 H1 WAT 3978 70.408 47.500 136.570 1.00 0.00 H ATOM 25591 H2 WAT 3978 71.043 47.347 137.936 1.00 0.00 H TER 25593 WAT 3978 ATOM 25593 O WAT 3979 80.596 61.931 88.155 1.00 0.00 O ATOM 25594 H1 WAT 3979 80.255 61.063 88.371 1.00 0.00 H ATOM 25595 H2 WAT 3979 80.207 62.136 87.305 1.00 0.00 H TER 25597 WAT 3979 ATOM 25597 O WAT 3980 22.325 96.183 122.007 1.00 0.00 O ATOM 25598 H1 WAT 3980 21.516 96.561 121.664 1.00 0.00 H ATOM 25599 H2 WAT 3980 22.658 95.640 121.292 1.00 0.00 H TER 25601 WAT 3980 ATOM 25601 O WAT 3981 13.782 98.615 121.634 1.00 0.00 O ATOM 25602 H1 WAT 3981 13.327 99.297 122.129 1.00 0.00 H ATOM 25603 H2 WAT 3981 14.637 98.995 121.433 1.00 0.00 H TER 25605 WAT 3981 ATOM 25605 O WAT 3982 44.995 95.152 71.357 1.00 0.00 O ATOM 25606 H1 WAT 3982 45.191 94.339 70.891 1.00 0.00 H ATOM 25607 H2 WAT 3982 45.285 95.845 70.763 1.00 0.00 H TER 25609 WAT 3982 ATOM 25609 O WAT 3983 35.048 77.326 131.303 1.00 0.00 O ATOM 25610 H1 WAT 3983 35.432 77.254 130.429 1.00 0.00 H ATOM 25611 H2 WAT 3983 34.168 77.671 131.150 1.00 0.00 H TER 25613 WAT 3983 ATOM 25613 O WAT 3984 24.412 2.541 18.488 1.00 0.00 O ATOM 25614 H1 WAT 3984 25.102 3.022 18.946 1.00 0.00 H ATOM 25615 H2 WAT 3984 24.185 1.824 19.081 1.00 0.00 H TER 25617 WAT 3984 ATOM 25617 O WAT 3985 21.048 9.855 100.349 1.00 0.00 O ATOM 25618 H1 WAT 3985 20.576 9.673 99.536 1.00 0.00 H ATOM 25619 H2 WAT 3985 21.834 10.324 100.069 1.00 0.00 H TER 25621 WAT 3985 ATOM 25621 O WAT 3986 120.861 57.277 95.274 1.00 0.00 O ATOM 25622 H1 WAT 3986 121.258 56.486 95.638 1.00 0.00 H ATOM 25623 H2 WAT 3986 120.753 57.859 96.027 1.00 0.00 H TER 25625 WAT 3986 ATOM 25625 O WAT 3987 99.087 40.531 139.608 1.00 0.00 O ATOM 25626 H1 WAT 3987 99.086 41.219 140.274 1.00 0.00 H ATOM 25627 H2 WAT 3987 98.664 40.932 138.849 1.00 0.00 H TER 25629 WAT 3987 ATOM 25629 O WAT 3988 18.031 127.552 1.990 1.00 0.00 O ATOM 25630 H1 WAT 3988 17.857 127.125 2.828 1.00 0.00 H ATOM 25631 H2 WAT 3988 18.985 127.603 1.940 1.00 0.00 H TER 25633 WAT 3988 ATOM 25633 O WAT 3989 82.872 132.844 77.648 1.00 0.00 O ATOM 25634 H1 WAT 3989 82.588 131.938 77.773 1.00 0.00 H ATOM 25635 H2 WAT 3989 82.667 133.035 76.733 1.00 0.00 H TER 25637 WAT 3989 ATOM 25637 O WAT 3990 73.808 0.248 90.089 1.00 0.00 O ATOM 25638 H1 WAT 3990 73.192 0.283 89.357 1.00 0.00 H ATOM 25639 H2 WAT 3990 73.578 1.001 90.632 1.00 0.00 H TER 25641 WAT 3990 ATOM 25641 O WAT 3991 108.753 56.153 4.255 1.00 0.00 O ATOM 25642 H1 WAT 3991 109.227 56.917 4.585 1.00 0.00 H ATOM 25643 H2 WAT 3991 107.908 56.184 4.703 1.00 0.00 H TER 25645 WAT 3991 ATOM 25645 O WAT 3992 17.549 86.474 93.878 1.00 0.00 O ATOM 25646 H1 WAT 3992 17.940 85.620 93.691 1.00 0.00 H ATOM 25647 H2 WAT 3992 16.982 86.647 93.127 1.00 0.00 H TER 25649 WAT 3992 ATOM 25649 O WAT 3993 96.385 119.264 115.258 1.00 0.00 O ATOM 25650 H1 WAT 3993 97.334 119.150 115.201 1.00 0.00 H ATOM 25651 H2 WAT 3993 96.048 118.387 115.441 1.00 0.00 H TER 25653 WAT 3993 ATOM 25653 O WAT 3994 136.257 86.047 68.461 1.00 0.00 O ATOM 25654 H1 WAT 3994 136.884 86.734 68.233 1.00 0.00 H ATOM 25655 H2 WAT 3994 136.408 85.360 67.812 1.00 0.00 H TER 25657 WAT 3994 ATOM 25657 O WAT 3995 10.658 94.326 137.115 1.00 0.00 O ATOM 25658 H1 WAT 3995 11.173 94.432 137.915 1.00 0.00 H ATOM 25659 H2 WAT 3995 9.844 93.916 137.407 1.00 0.00 H TER 25661 WAT 3995 ATOM 25661 O WAT 3996 63.792 84.246 70.303 1.00 0.00 O ATOM 25662 H1 WAT 3996 64.679 84.334 69.955 1.00 0.00 H ATOM 25663 H2 WAT 3996 63.567 85.123 70.612 1.00 0.00 H TER 25665 WAT 3996 ATOM 25665 O WAT 3997 25.904 142.870 119.665 1.00 0.00 O ATOM 25666 H1 WAT 3997 26.184 143.782 119.740 1.00 0.00 H ATOM 25667 H2 WAT 3997 26.719 142.368 119.678 1.00 0.00 H TER 25669 WAT 3997 ATOM 25669 O WAT 3998 6.040 36.203 74.981 1.00 0.00 O ATOM 25670 H1 WAT 3998 6.449 35.467 74.524 1.00 0.00 H ATOM 25671 H2 WAT 3998 6.186 36.018 75.909 1.00 0.00 H TER 25673 WAT 3998 ATOM 25673 O WAT 3999 144.708 73.608 104.693 1.00 0.00 O ATOM 25674 H1 WAT 3999 144.631 73.356 105.613 1.00 0.00 H ATOM 25675 H2 WAT 3999 143.834 73.920 104.456 1.00 0.00 H TER 25677 WAT 3999 ATOM 25677 O WAT 4000 50.146 11.322 0.785 1.00 0.00 O ATOM 25678 H1 WAT 4000 50.198 10.431 0.438 1.00 0.00 H ATOM 25679 H2 WAT 4000 50.968 11.442 1.260 1.00 0.00 H TER 25681 WAT 4000 ATOM 25681 O WAT 4001 31.895 53.660 71.581 1.00 0.00 O ATOM 25682 H1 WAT 4001 31.252 54.324 71.826 1.00 0.00 H ATOM 25683 H2 WAT 4001 32.608 53.773 72.209 1.00 0.00 H TER 25685 WAT 4001 ATOM 25685 O WAT 4002 87.018 18.357 57.777 1.00 0.00 O ATOM 25686 H1 WAT 4002 86.355 18.624 58.414 1.00 0.00 H ATOM 25687 H2 WAT 4002 86.731 17.494 57.480 1.00 0.00 H TER 25689 WAT 4002 ATOM 25689 O WAT 4003 123.368 138.541 114.559 1.00 0.00 O ATOM 25690 H1 WAT 4003 124.205 138.999 114.485 1.00 0.00 H ATOM 25691 H2 WAT 4003 122.858 138.853 113.811 1.00 0.00 H TER 25693 WAT 4003 ATOM 25693 O WAT 4004 78.356 65.209 97.242 1.00 0.00 O ATOM 25694 H1 WAT 4004 77.729 65.416 97.935 1.00 0.00 H ATOM 25695 H2 WAT 4004 79.201 65.163 97.689 1.00 0.00 H TER 25697 WAT 4004 ATOM 25697 O WAT 4005 143.392 137.763 87.442 1.00 0.00 O ATOM 25698 H1 WAT 4005 142.699 137.857 88.096 1.00 0.00 H ATOM 25699 H2 WAT 4005 143.555 138.655 87.135 1.00 0.00 H TER 25701 WAT 4005 ATOM 25701 O WAT 4006 105.461 126.120 57.032 1.00 0.00 O ATOM 25702 H1 WAT 4006 105.832 126.068 56.151 1.00 0.00 H ATOM 25703 H2 WAT 4006 106.221 126.116 57.613 1.00 0.00 H TER 25705 WAT 4006 ATOM 25705 O WAT 4007 95.599 101.704 150.032 1.00 0.00 O ATOM 25706 H1 WAT 4007 94.882 102.327 150.142 1.00 0.00 H ATOM 25707 H2 WAT 4007 96.194 101.891 150.758 1.00 0.00 H TER 25709 WAT 4007 ATOM 25709 O WAT 4008 40.643 36.637 9.695 1.00 0.00 O ATOM 25710 H1 WAT 4008 39.984 37.043 9.132 1.00 0.00 H ATOM 25711 H2 WAT 4008 40.188 36.481 10.522 1.00 0.00 H TER 25713 WAT 4008 ATOM 25713 O WAT 4009 102.377 123.345 67.358 1.00 0.00 O ATOM 25714 H1 WAT 4009 101.735 123.532 66.674 1.00 0.00 H ATOM 25715 H2 WAT 4009 103.191 123.730 67.034 1.00 0.00 H TER 25717 WAT 4009 ATOM 25717 O WAT 4010 128.205 60.099 6.766 1.00 0.00 O ATOM 25718 H1 WAT 4010 128.288 59.164 6.952 1.00 0.00 H ATOM 25719 H2 WAT 4010 128.884 60.511 7.301 1.00 0.00 H TER 25721 WAT 4010 ATOM 25721 O WAT 4011 40.983 4.148 127.328 1.00 0.00 O ATOM 25722 H1 WAT 4011 41.783 3.648 127.170 1.00 0.00 H ATOM 25723 H2 WAT 4011 40.792 4.007 128.256 1.00 0.00 H TER 25725 WAT 4011 ATOM 25725 O WAT 4012 62.620 30.313 81.811 1.00 0.00 O ATOM 25726 H1 WAT 4012 62.232 30.206 82.679 1.00 0.00 H ATOM 25727 H2 WAT 4012 62.779 31.254 81.734 1.00 0.00 H TER 25729 WAT 4012 ATOM 25729 O WAT 4013 78.559 122.964 129.936 1.00 0.00 O ATOM 25730 H1 WAT 4013 79.027 122.403 130.555 1.00 0.00 H ATOM 25731 H2 WAT 4013 77.665 122.622 129.932 1.00 0.00 H TER 25733 WAT 4013 ATOM 25733 O WAT 4014 41.533 93.104 27.586 1.00 0.00 O ATOM 25734 H1 WAT 4014 41.896 93.941 27.877 1.00 0.00 H ATOM 25735 H2 WAT 4014 41.117 93.302 26.747 1.00 0.00 H TER 25737 WAT 4014 ATOM 25737 O WAT 4015 35.076 102.849 87.133 1.00 0.00 O ATOM 25738 H1 WAT 4015 35.858 102.460 87.525 1.00 0.00 H ATOM 25739 H2 WAT 4015 35.080 102.535 86.229 1.00 0.00 H TER 25741 WAT 4015 ATOM 25741 O WAT 4016 139.184 12.236 141.423 1.00 0.00 O ATOM 25742 H1 WAT 4016 140.101 12.470 141.565 1.00 0.00 H ATOM 25743 H2 WAT 4016 138.689 12.929 141.860 1.00 0.00 H TER 25745 WAT 4016 ATOM 25745 O WAT 4017 131.881 131.868 147.294 1.00 0.00 O ATOM 25746 H1 WAT 4017 132.428 131.087 147.376 1.00 0.00 H ATOM 25747 H2 WAT 4017 132.266 132.355 146.566 1.00 0.00 H TER 25749 WAT 4017 ATOM 25749 O WAT 4018 0.962 90.060 99.248 1.00 0.00 O ATOM 25750 H1 WAT 4018 0.388 90.503 98.623 1.00 0.00 H ATOM 25751 H2 WAT 4018 0.801 90.506 100.080 1.00 0.00 H TER 25753 WAT 4018 ATOM 25753 O WAT 4019 97.713 71.756 12.226 1.00 0.00 O ATOM 25754 H1 WAT 4019 98.094 71.524 11.379 1.00 0.00 H ATOM 25755 H2 WAT 4019 98.291 72.436 12.571 1.00 0.00 H TER 25757 WAT 4019 ATOM 25757 O WAT 4020 57.541 72.518 125.148 1.00 0.00 O ATOM 25758 H1 WAT 4020 57.229 71.954 125.855 1.00 0.00 H ATOM 25759 H2 WAT 4020 57.461 71.981 124.360 1.00 0.00 H TER 25761 WAT 4020 ATOM 25761 O WAT 4021 90.870 54.327 101.031 1.00 0.00 O ATOM 25762 H1 WAT 4021 91.809 54.174 100.928 1.00 0.00 H ATOM 25763 H2 WAT 4021 90.474 53.913 100.264 1.00 0.00 H TER 25765 WAT 4021 ATOM 25765 O WAT 4022 130.785 16.825 121.951 1.00 0.00 O ATOM 25766 H1 WAT 4022 131.105 17.558 121.425 1.00 0.00 H ATOM 25767 H2 WAT 4022 129.871 17.043 122.133 1.00 0.00 H TER 25769 WAT 4022 ATOM 25769 O WAT 4023 10.670 72.586 146.932 1.00 0.00 O ATOM 25770 H1 WAT 4023 10.597 72.712 145.987 1.00 0.00 H ATOM 25771 H2 WAT 4023 10.672 73.472 147.294 1.00 0.00 H TER 25773 WAT 4023 ATOM 25773 O WAT 4024 5.968 62.918 129.260 1.00 0.00 O ATOM 25774 H1 WAT 4024 6.358 63.416 128.541 1.00 0.00 H ATOM 25775 H2 WAT 4024 5.105 63.314 129.385 1.00 0.00 H TER 25777 WAT 4024 ATOM 25777 O WAT 4025 62.459 84.981 10.547 1.00 0.00 O ATOM 25778 H1 WAT 4025 63.352 84.655 10.653 1.00 0.00 H ATOM 25779 H2 WAT 4025 62.125 84.521 9.777 1.00 0.00 H TER 25781 WAT 4025 ATOM 25781 O WAT 4026 13.238 132.616 72.545 1.00 0.00 O ATOM 25782 H1 WAT 4026 12.423 132.456 72.068 1.00 0.00 H ATOM 25783 H2 WAT 4026 13.889 132.770 71.861 1.00 0.00 H TER 25785 WAT 4026 ATOM 25785 O WAT 4027 104.445 107.708 27.199 1.00 0.00 O ATOM 25786 H1 WAT 4027 103.573 108.055 27.388 1.00 0.00 H ATOM 25787 H2 WAT 4027 104.390 106.781 27.433 1.00 0.00 H TER 25789 WAT 4027 ATOM 25789 O WAT 4028 102.308 37.492 85.584 1.00 0.00 O ATOM 25790 H1 WAT 4028 102.620 37.744 84.715 1.00 0.00 H ATOM 25791 H2 WAT 4028 101.906 38.287 85.934 1.00 0.00 H TER 25793 WAT 4028 ATOM 25793 O WAT 4029 121.844 94.883 108.647 1.00 0.00 O ATOM 25794 H1 WAT 4029 121.752 95.794 108.928 1.00 0.00 H ATOM 25795 H2 WAT 4029 122.697 94.852 108.213 1.00 0.00 H TER 25797 WAT 4029 ATOM 25797 O WAT 4030 123.126 35.182 102.356 1.00 0.00 O ATOM 25798 H1 WAT 4030 122.869 34.309 102.058 1.00 0.00 H ATOM 25799 H2 WAT 4030 122.645 35.781 101.785 1.00 0.00 H TER 25801 WAT 4030 ATOM 25801 O WAT 4031 118.191 72.551 84.643 1.00 0.00 O ATOM 25802 H1 WAT 4031 118.062 73.488 84.791 1.00 0.00 H ATOM 25803 H2 WAT 4031 117.321 72.169 84.760 1.00 0.00 H TER 25805 WAT 4031 ATOM 25805 O WAT 4032 8.951 104.565 18.999 1.00 0.00 O ATOM 25806 H1 WAT 4032 8.651 103.676 18.810 1.00 0.00 H ATOM 25807 H2 WAT 4032 8.405 104.852 19.731 1.00 0.00 H TER 25809 WAT 4032 ATOM 25809 O WAT 4033 104.906 31.979 113.772 1.00 0.00 O ATOM 25810 H1 WAT 4033 104.925 32.594 114.505 1.00 0.00 H ATOM 25811 H2 WAT 4033 105.231 32.484 113.027 1.00 0.00 H TER 25813 WAT 4033 ATOM 25813 O WAT 4034 23.662 65.796 64.952 1.00 0.00 O ATOM 25814 H1 WAT 4034 24.294 65.286 65.458 1.00 0.00 H ATOM 25815 H2 WAT 4034 23.239 65.154 64.381 1.00 0.00 H TER 25817 WAT 4034 ATOM 25817 O WAT 4035 61.304 120.168 141.554 1.00 0.00 O ATOM 25818 H1 WAT 4035 62.064 119.960 142.097 1.00 0.00 H ATOM 25819 H2 WAT 4035 61.239 121.122 141.587 1.00 0.00 H TER 25821 WAT 4035 ATOM 25821 O WAT 4036 3.706 97.485 14.808 1.00 0.00 O ATOM 25822 H1 WAT 4036 3.623 98.434 14.715 1.00 0.00 H ATOM 25823 H2 WAT 4036 2.804 97.168 14.855 1.00 0.00 H TER 25825 WAT 4036 ATOM 25825 O WAT 4037 66.050 43.380 130.759 1.00 0.00 O ATOM 25826 H1 WAT 4037 66.816 43.028 130.306 1.00 0.00 H ATOM 25827 H2 WAT 4037 65.779 42.678 131.351 1.00 0.00 H TER 25829 WAT 4037 ATOM 25829 O WAT 4038 45.264 123.784 140.511 1.00 0.00 O ATOM 25830 H1 WAT 4038 45.028 122.857 140.515 1.00 0.00 H ATOM 25831 H2 WAT 4038 46.029 123.834 139.937 1.00 0.00 H TER 25833 WAT 4038 ATOM 25833 O WAT 4039 17.587 105.767 81.486 1.00 0.00 O ATOM 25834 H1 WAT 4039 16.820 105.755 82.058 1.00 0.00 H ATOM 25835 H2 WAT 4039 17.390 106.440 80.835 1.00 0.00 H TER 25837 WAT 4039 ATOM 25837 O WAT 4040 36.731 33.127 149.567 1.00 0.00 O ATOM 25838 H1 WAT 4040 36.463 32.427 148.972 1.00 0.00 H ATOM 25839 H2 WAT 4040 36.223 32.972 150.363 1.00 0.00 H TER 25841 WAT 4040 ATOM 25841 O WAT 4041 124.941 93.189 97.671 1.00 0.00 O ATOM 25842 H1 WAT 4041 125.198 93.242 96.750 1.00 0.00 H ATOM 25843 H2 WAT 4041 124.128 92.684 97.664 1.00 0.00 H TER 25845 WAT 4041 ATOM 25845 O WAT 4042 29.301 122.632 84.189 1.00 0.00 O ATOM 25846 H1 WAT 4042 29.418 123.494 84.587 1.00 0.00 H ATOM 25847 H2 WAT 4042 28.359 122.469 84.243 1.00 0.00 H TER 25849 WAT 4042 ATOM 25849 O WAT 4043 67.892 16.556 9.439 1.00 0.00 O ATOM 25850 H1 WAT 4043 68.511 17.055 8.906 1.00 0.00 H ATOM 25851 H2 WAT 4043 67.427 16.003 8.812 1.00 0.00 H TER 25853 WAT 4043 ATOM 25853 O WAT 4044 104.405 24.458 104.266 1.00 0.00 O ATOM 25854 H1 WAT 4044 103.833 23.782 104.630 1.00 0.00 H ATOM 25855 H2 WAT 4044 104.250 25.225 104.817 1.00 0.00 H TER 25857 WAT 4044 ATOM 25857 O WAT 4045 111.541 114.989 139.473 1.00 0.00 O ATOM 25858 H1 WAT 4045 111.174 115.714 139.977 1.00 0.00 H ATOM 25859 H2 WAT 4045 111.800 114.345 140.133 1.00 0.00 H TER 25861 WAT 4045 ATOM 25861 O WAT 4046 140.607 133.645 57.784 1.00 0.00 O ATOM 25862 H1 WAT 4046 140.072 133.746 58.572 1.00 0.00 H ATOM 25863 H2 WAT 4046 140.813 134.541 57.519 1.00 0.00 H TER 25865 WAT 4046 ATOM 25865 O WAT 4047 126.187 40.665 136.997 1.00 0.00 O ATOM 25866 H1 WAT 4047 126.228 41.196 137.792 1.00 0.00 H ATOM 25867 H2 WAT 4047 126.713 41.147 136.359 1.00 0.00 H TER 25869 WAT 4047 ATOM 25869 O WAT 4048 71.503 46.300 4.137 1.00 0.00 O ATOM 25870 H1 WAT 4048 71.413 46.117 5.073 1.00 0.00 H ATOM 25871 H2 WAT 4048 71.972 45.542 3.789 1.00 0.00 H TER 25873 WAT 4048 ATOM 25873 O WAT 4049 38.037 111.137 111.853 1.00 0.00 O ATOM 25874 H1 WAT 4049 38.922 111.491 111.937 1.00 0.00 H ATOM 25875 H2 WAT 4049 38.154 110.308 111.388 1.00 0.00 H TER 25877 WAT 4049 ATOM 25877 O WAT 4050 65.544 44.576 26.491 1.00 0.00 O ATOM 25878 H1 WAT 4050 65.383 43.690 26.167 1.00 0.00 H ATOM 25879 H2 WAT 4050 66.359 44.842 26.067 1.00 0.00 H TER 25881 WAT 4050 ATOM 25881 O WAT 4051 138.512 129.739 113.676 1.00 0.00 O ATOM 25882 H1 WAT 4051 137.902 130.155 114.286 1.00 0.00 H ATOM 25883 H2 WAT 4051 139.105 130.444 113.414 1.00 0.00 H TER 25885 WAT 4051 ATOM 25885 O WAT 4052 47.972 121.784 135.238 1.00 0.00 O ATOM 25886 H1 WAT 4052 48.332 122.619 134.938 1.00 0.00 H ATOM 25887 H2 WAT 4052 47.956 121.858 136.192 1.00 0.00 H TER 25889 WAT 4052 ATOM 25889 O WAT 4053 79.557 64.431 157.603 1.00 0.00 O ATOM 25890 H1 WAT 4053 79.634 65.136 156.961 1.00 0.00 H ATOM 25891 H2 WAT 4053 79.703 63.630 157.098 1.00 0.00 H TER 25893 WAT 4053 ATOM 25893 O WAT 4054 68.785 77.881 138.608 1.00 0.00 O ATOM 25894 H1 WAT 4054 69.482 77.798 137.957 1.00 0.00 H ATOM 25895 H2 WAT 4054 68.189 77.158 138.415 1.00 0.00 H TER 25897 WAT 4054 ATOM 25897 O WAT 4055 114.642 63.043 10.759 1.00 0.00 O ATOM 25898 H1 WAT 4055 114.132 62.254 10.941 1.00 0.00 H ATOM 25899 H2 WAT 4055 114.210 63.731 11.266 1.00 0.00 H TER 25901 WAT 4055 ATOM 25901 O WAT 4056 35.299 60.920 157.747 1.00 0.00 O ATOM 25902 H1 WAT 4056 35.220 61.736 157.252 1.00 0.00 H ATOM 25903 H2 WAT 4056 35.846 60.359 157.196 1.00 0.00 H TER 25905 WAT 4056 ATOM 25905 O WAT 4057 108.012 69.541 120.405 1.00 0.00 O ATOM 25906 H1 WAT 4057 107.061 69.449 120.344 1.00 0.00 H ATOM 25907 H2 WAT 4057 108.157 70.484 120.489 1.00 0.00 H TER 25909 WAT 4057 ATOM 25909 O WAT 4058 79.186 56.650 131.332 1.00 0.00 O ATOM 25910 H1 WAT 4058 78.564 56.697 130.605 1.00 0.00 H ATOM 25911 H2 WAT 4058 78.942 57.379 131.903 1.00 0.00 H TER 25913 WAT 4058 ATOM 25913 O WAT 4059 139.007 19.473 140.343 1.00 0.00 O ATOM 25914 H1 WAT 4059 139.940 19.687 140.320 1.00 0.00 H ATOM 25915 H2 WAT 4059 138.732 19.504 139.427 1.00 0.00 H TER 25917 WAT 4059 ATOM 25917 O WAT 4060 68.366 6.156 101.561 1.00 0.00 O ATOM 25918 H1 WAT 4060 68.865 5.439 101.169 1.00 0.00 H ATOM 25919 H2 WAT 4060 67.455 5.964 101.337 1.00 0.00 H TER 25921 WAT 4060 ATOM 25921 O WAT 4061 47.879 145.208 22.424 1.00 0.00 O ATOM 25922 H1 WAT 4061 48.080 146.091 22.733 1.00 0.00 H ATOM 25923 H2 WAT 4061 48.048 144.645 23.179 1.00 0.00 H TER 25925 WAT 4061 ATOM 25925 O WAT 4062 58.591 5.585 0.973 1.00 0.00 O ATOM 25926 H1 WAT 4062 58.150 5.855 1.778 1.00 0.00 H ATOM 25927 H2 WAT 4062 58.448 6.312 0.366 1.00 0.00 H TER 25929 WAT 4062 ATOM 25929 O WAT 4063 32.791 33.386 147.825 1.00 0.00 O ATOM 25930 H1 WAT 4063 32.505 33.947 148.546 1.00 0.00 H ATOM 25931 H2 WAT 4063 32.149 33.540 147.132 1.00 0.00 H TER 25933 WAT 4063 ATOM 25933 O WAT 4064 98.901 127.669 65.600 1.00 0.00 O ATOM 25934 H1 WAT 4064 98.257 127.741 66.305 1.00 0.00 H ATOM 25935 H2 WAT 4064 98.573 126.958 65.049 1.00 0.00 H TER 25937 WAT 4064 ATOM 25937 O WAT 4065 122.778 40.444 153.089 1.00 0.00 O ATOM 25938 H1 WAT 4065 122.102 40.054 153.644 1.00 0.00 H ATOM 25939 H2 WAT 4065 123.499 40.635 153.689 1.00 0.00 H TER 25941 WAT 4065 ATOM 25941 O WAT 4066 31.230 102.242 3.658 1.00 0.00 O ATOM 25942 H1 WAT 4066 30.372 102.355 3.249 1.00 0.00 H ATOM 25943 H2 WAT 4066 31.043 102.179 4.594 1.00 0.00 H TER 25945 WAT 4066 ATOM 25945 O WAT 4067 30.160 60.196 132.478 1.00 0.00 O ATOM 25946 H1 WAT 4067 29.771 60.896 133.002 1.00 0.00 H ATOM 25947 H2 WAT 4067 29.496 59.993 131.819 1.00 0.00 H TER 25949 WAT 4067 ATOM 25949 O WAT 4068 74.315 21.069 154.202 1.00 0.00 O ATOM 25950 H1 WAT 4068 73.693 21.695 153.833 1.00 0.00 H ATOM 25951 H2 WAT 4068 73.889 20.218 154.100 1.00 0.00 H TER 25953 WAT 4068 ATOM 25953 O WAT 4069 128.056 100.376 137.431 1.00 0.00 O ATOM 25954 H1 WAT 4069 127.237 99.895 137.555 1.00 0.00 H ATOM 25955 H2 WAT 4069 128.404 100.487 138.316 1.00 0.00 H TER 25957 WAT 4069 ATOM 25957 O WAT 4070 91.897 63.914 15.406 1.00 0.00 O ATOM 25958 H1 WAT 4070 92.569 63.636 14.783 1.00 0.00 H ATOM 25959 H2 WAT 4070 91.074 63.829 14.925 1.00 0.00 H TER 25961 WAT 4070 ATOM 25961 O WAT 4071 85.652 21.143 101.895 1.00 0.00 O ATOM 25962 H1 WAT 4071 86.542 21.429 102.101 1.00 0.00 H ATOM 25963 H2 WAT 4071 85.153 21.956 101.807 1.00 0.00 H TER 25965 WAT 4071 ATOM 25965 O WAT 4072 123.657 7.200 85.037 1.00 0.00 O ATOM 25966 H1 WAT 4072 124.228 7.761 85.562 1.00 0.00 H ATOM 25967 H2 WAT 4072 123.845 6.313 85.343 1.00 0.00 H TER 25969 WAT 4072 ATOM 25969 O WAT 4073 64.200 119.921 78.848 1.00 0.00 O ATOM 25970 H1 WAT 4073 64.424 119.894 77.918 1.00 0.00 H ATOM 25971 H2 WAT 4073 63.403 119.395 78.917 1.00 0.00 H TER 25973 WAT 4073 ATOM 25973 O WAT 4074 2.477 28.039 76.767 1.00 0.00 O ATOM 25974 H1 WAT 4074 2.915 28.821 77.106 1.00 0.00 H ATOM 25975 H2 WAT 4074 1.578 28.111 77.088 1.00 0.00 H TER 25977 WAT 4074 ATOM 25977 O WAT 4075 76.116 123.047 4.319 1.00 0.00 O ATOM 25978 H1 WAT 4075 75.846 123.836 3.850 1.00 0.00 H ATOM 25979 H2 WAT 4075 76.987 123.256 4.658 1.00 0.00 H TER 25981 WAT 4075 ATOM 25981 O WAT 4076 33.758 33.180 16.291 1.00 0.00 O ATOM 25982 H1 WAT 4076 34.190 32.363 16.538 1.00 0.00 H ATOM 25983 H2 WAT 4076 33.858 33.745 17.057 1.00 0.00 H TER 25985 WAT 4076 ATOM 25985 O WAT 4077 42.220 138.067 155.525 1.00 0.00 O ATOM 25986 H1 WAT 4077 42.831 137.609 156.102 1.00 0.00 H ATOM 25987 H2 WAT 4077 41.866 138.774 156.065 1.00 0.00 H TER 25989 WAT 4077 ATOM 25989 O WAT 4078 68.420 107.211 140.532 1.00 0.00 O ATOM 25990 H1 WAT 4078 68.783 106.326 140.509 1.00 0.00 H ATOM 25991 H2 WAT 4078 68.315 107.403 141.464 1.00 0.00 H TER 25993 WAT 4078 ATOM 25993 O WAT 4079 92.876 74.591 9.005 1.00 0.00 O ATOM 25994 H1 WAT 4079 93.791 74.745 8.770 1.00 0.00 H ATOM 25995 H2 WAT 4079 92.916 73.953 9.717 1.00 0.00 H TER 25997 WAT 4079 ATOM 25997 O WAT 4080 77.658 56.446 81.719 1.00 0.00 O ATOM 25998 H1 WAT 4080 77.703 56.789 82.611 1.00 0.00 H ATOM 25999 H2 WAT 4080 76.957 55.795 81.747 1.00 0.00 H TER 26001 WAT 4080 ATOM 26001 O WAT 4081 50.235 42.467 83.745 1.00 0.00 O ATOM 26002 H1 WAT 4081 50.031 43.006 84.509 1.00 0.00 H ATOM 26003 H2 WAT 4081 49.885 42.959 83.003 1.00 0.00 H TER 26005 WAT 4081 ATOM 26005 O WAT 4082 40.714 100.448 88.500 1.00 0.00 O ATOM 26006 H1 WAT 4082 41.651 100.644 88.466 1.00 0.00 H ATOM 26007 H2 WAT 4082 40.598 99.730 87.878 1.00 0.00 H TER 26009 WAT 4082 ATOM 26009 O WAT 4083 119.123 92.318 105.490 1.00 0.00 O ATOM 26010 H1 WAT 4083 119.376 91.545 105.994 1.00 0.00 H ATOM 26011 H2 WAT 4083 119.619 93.035 105.885 1.00 0.00 H TER 26013 WAT 4083 ATOM 26013 O WAT 4084 25.217 21.594 95.910 1.00 0.00 O ATOM 26014 H1 WAT 4084 26.102 21.789 96.218 1.00 0.00 H ATOM 26015 H2 WAT 4084 24.643 22.019 96.547 1.00 0.00 H TER 26017 WAT 4084 ATOM 26017 O WAT 4085 65.548 85.076 72.541 1.00 0.00 O ATOM 26018 H1 WAT 4085 65.783 85.638 73.280 1.00 0.00 H ATOM 26019 H2 WAT 4085 66.300 84.494 72.434 1.00 0.00 H TER 26021 WAT 4085 ATOM 26021 O WAT 4086 56.457 132.014 110.154 1.00 0.00 O ATOM 26022 H1 WAT 4086 56.855 132.881 110.074 1.00 0.00 H ATOM 26023 H2 WAT 4086 55.536 132.190 110.346 1.00 0.00 H TER 26025 WAT 4086 ATOM 26025 O WAT 4087 9.732 113.714 148.993 1.00 0.00 O ATOM 26026 H1 WAT 4087 8.885 113.831 149.425 1.00 0.00 H ATOM 26027 H2 WAT 4087 10.376 113.932 149.666 1.00 0.00 H TER 26029 WAT 4087 ATOM 26029 O WAT 4088 54.993 26.865 84.313 1.00 0.00 O ATOM 26030 H1 WAT 4088 54.586 26.687 85.161 1.00 0.00 H ATOM 26031 H2 WAT 4088 55.921 26.670 84.447 1.00 0.00 H TER 26033 WAT 4088 ATOM 26033 O WAT 4089 18.460 92.670 76.411 1.00 0.00 O ATOM 26034 H1 WAT 4089 18.754 93.530 76.110 1.00 0.00 H ATOM 26035 H2 WAT 4089 17.603 92.552 76.002 1.00 0.00 H TER 26037 WAT 4089 ATOM 26037 O WAT 4090 30.851 10.464 78.966 1.00 0.00 O ATOM 26038 H1 WAT 4090 30.557 9.695 78.478 1.00 0.00 H ATOM 26039 H2 WAT 4090 31.787 10.525 78.775 1.00 0.00 H TER 26041 WAT 4090 ATOM 26041 O WAT 4091 34.266 13.534 135.131 1.00 0.00 O ATOM 26042 H1 WAT 4091 33.401 13.381 134.750 1.00 0.00 H ATOM 26043 H2 WAT 4091 34.461 14.448 134.921 1.00 0.00 H TER 26045 WAT 4091 ATOM 26045 O WAT 4092 52.855 93.825 83.961 1.00 0.00 O ATOM 26046 H1 WAT 4092 52.770 94.697 83.577 1.00 0.00 H ATOM 26047 H2 WAT 4092 53.171 93.984 84.850 1.00 0.00 H TER 26049 WAT 4092 ATOM 26049 O WAT 4093 133.988 116.966 121.389 1.00 0.00 O ATOM 26050 H1 WAT 4093 133.318 117.418 121.902 1.00 0.00 H ATOM 26051 H2 WAT 4093 134.805 117.138 121.858 1.00 0.00 H TER 26053 WAT 4093 ATOM 26053 O WAT 4094 11.646 47.894 101.372 1.00 0.00 O ATOM 26054 H1 WAT 4094 10.806 47.910 100.913 1.00 0.00 H ATOM 26055 H2 WAT 4094 12.299 47.846 100.674 1.00 0.00 H TER 26057 WAT 4094 ATOM 26057 O WAT 4095 96.989 117.610 56.526 1.00 0.00 O ATOM 26058 H1 WAT 4095 97.936 117.679 56.647 1.00 0.00 H ATOM 26059 H2 WAT 4095 96.660 117.319 57.376 1.00 0.00 H TER 26061 WAT 4095 ATOM 26061 O WAT 4096 66.632 80.023 101.733 1.00 0.00 O ATOM 26062 H1 WAT 4096 66.199 80.852 101.527 1.00 0.00 H ATOM 26063 H2 WAT 4096 67.122 79.805 100.940 1.00 0.00 H TER 26065 WAT 4096 ATOM 26065 O WAT 4097 15.221 143.714 22.009 1.00 0.00 O ATOM 26066 H1 WAT 4097 14.837 143.016 21.479 1.00 0.00 H ATOM 26067 H2 WAT 4097 15.293 143.337 22.886 1.00 0.00 H TER 26069 WAT 4097 ATOM 26069 O WAT 4098 59.903 125.868 106.511 1.00 0.00 O ATOM 26070 H1 WAT 4098 59.423 125.577 107.287 1.00 0.00 H ATOM 26071 H2 WAT 4098 59.627 126.776 106.385 1.00 0.00 H TER 26073 WAT 4098 ATOM 26073 O WAT 4099 121.886 29.449 55.383 1.00 0.00 O ATOM 26074 H1 WAT 4099 121.591 29.291 56.280 1.00 0.00 H ATOM 26075 H2 WAT 4099 121.104 29.317 54.847 1.00 0.00 H TER 26077 WAT 4099 ATOM 26077 O WAT 4100 74.884 22.109 53.290 1.00 0.00 O ATOM 26078 H1 WAT 4100 75.337 22.878 52.945 1.00 0.00 H ATOM 26079 H2 WAT 4100 74.569 21.647 52.513 1.00 0.00 H TER 26081 WAT 4100 ATOM 26081 O WAT 4101 69.824 40.100 125.612 1.00 0.00 O ATOM 26082 H1 WAT 4101 69.838 39.645 126.454 1.00 0.00 H ATOM 26083 H2 WAT 4101 70.378 39.567 125.042 1.00 0.00 H TER 26085 WAT 4101 ATOM 26085 O WAT 4102 57.763 44.821 102.528 1.00 0.00 O ATOM 26086 H1 WAT 4102 58.362 44.421 103.159 1.00 0.00 H ATOM 26087 H2 WAT 4102 58.292 45.481 102.080 1.00 0.00 H TER 26089 WAT 4102 ATOM 26089 O WAT 4103 135.848 48.520 65.141 1.00 0.00 O ATOM 26090 H1 WAT 4103 135.910 47.925 64.394 1.00 0.00 H ATOM 26091 H2 WAT 4103 134.913 48.553 65.344 1.00 0.00 H TER 26093 WAT 4103 ATOM 26093 O WAT 4104 76.412 93.062 144.857 1.00 0.00 O ATOM 26094 H1 WAT 4104 75.507 93.372 144.864 1.00 0.00 H ATOM 26095 H2 WAT 4104 76.836 93.573 144.167 1.00 0.00 H TER 26097 WAT 4104 ATOM 26097 O WAT 4105 104.154 28.549 156.809 1.00 0.00 O ATOM 26098 H1 WAT 4105 104.860 29.067 156.422 1.00 0.00 H ATOM 26099 H2 WAT 4105 104.603 27.866 157.307 1.00 0.00 H TER 26101 WAT 4105 ATOM 26101 O WAT 4106 103.126 104.847 101.759 1.00 0.00 O ATOM 26102 H1 WAT 4106 104.013 105.207 101.727 1.00 0.00 H ATOM 26103 H2 WAT 4106 102.905 104.675 100.844 1.00 0.00 H TER 26105 WAT 4106 ATOM 26105 O WAT 4107 47.949 69.767 74.463 1.00 0.00 O ATOM 26106 H1 WAT 4107 48.032 70.209 73.618 1.00 0.00 H ATOM 26107 H2 WAT 4107 47.042 69.925 74.727 1.00 0.00 H TER 26109 WAT 4107 ATOM 26109 O WAT 4108 133.030 28.968 88.495 1.00 0.00 O ATOM 26110 H1 WAT 4108 133.953 28.819 88.287 1.00 0.00 H ATOM 26111 H2 WAT 4108 132.644 29.264 87.671 1.00 0.00 H TER 26113 WAT 4108 ATOM 26113 O WAT 4109 118.599 121.449 93.917 1.00 0.00 O ATOM 26114 H1 WAT 4109 119.054 120.911 94.564 1.00 0.00 H ATOM 26115 H2 WAT 4109 117.891 121.866 94.407 1.00 0.00 H TER 26117 WAT 4109 ATOM 26117 O WAT 4110 72.314 99.825 17.340 1.00 0.00 O ATOM 26118 H1 WAT 4110 71.483 99.351 17.326 1.00 0.00 H ATOM 26119 H2 WAT 4110 72.510 99.991 16.418 1.00 0.00 H TER 26121 WAT 4110 ATOM 26121 O WAT 4111 74.736 57.436 136.390 1.00 0.00 O ATOM 26122 H1 WAT 4111 74.827 57.268 135.452 1.00 0.00 H ATOM 26123 H2 WAT 4111 73.801 57.326 136.563 1.00 0.00 H TER 26125 WAT 4111 ATOM 26125 O WAT 4112 42.813 38.504 16.217 1.00 0.00 O ATOM 26126 H1 WAT 4112 43.423 39.061 16.702 1.00 0.00 H ATOM 26127 H2 WAT 4112 42.911 37.639 16.615 1.00 0.00 H TER 26129 WAT 4112 ATOM 26129 O WAT 4113 120.096 123.469 59.280 1.00 0.00 O ATOM 26130 H1 WAT 4113 120.987 123.465 59.628 1.00 0.00 H ATOM 26131 H2 WAT 4113 119.599 124.001 59.900 1.00 0.00 H TER 26133 WAT 4113 ATOM 26133 O WAT 4114 86.612 100.052 7.038 1.00 0.00 O ATOM 26134 H1 WAT 4114 86.996 99.297 7.483 1.00 0.00 H ATOM 26135 H2 WAT 4114 85.785 100.205 7.495 1.00 0.00 H TER 26137 WAT 4114 ATOM 26137 O WAT 4115 38.847 62.655 124.681 1.00 0.00 O ATOM 26138 H1 WAT 4115 39.020 61.838 124.213 1.00 0.00 H ATOM 26139 H2 WAT 4115 39.527 63.255 124.376 1.00 0.00 H TER 26141 WAT 4115 ATOM 26141 O WAT 4116 84.070 41.347 135.543 1.00 0.00 O ATOM 26142 H1 WAT 4116 84.292 40.536 136.000 1.00 0.00 H ATOM 26143 H2 WAT 4116 83.817 41.953 136.239 1.00 0.00 H TER 26145 WAT 4116 ATOM 26145 O WAT 4117 54.147 114.057 97.777 1.00 0.00 O ATOM 26146 H1 WAT 4117 54.174 113.831 98.707 1.00 0.00 H ATOM 26147 H2 WAT 4117 54.114 113.213 97.326 1.00 0.00 H TER 26149 WAT 4117 ATOM 26149 O WAT 4118 86.062 32.228 147.191 1.00 0.00 O ATOM 26150 H1 WAT 4118 85.325 31.772 147.597 1.00 0.00 H ATOM 26151 H2 WAT 4118 85.662 32.967 146.732 1.00 0.00 H TER 26153 WAT 4118 ATOM 26153 O WAT 4119 90.465 56.075 89.716 1.00 0.00 O ATOM 26154 H1 WAT 4119 90.801 56.947 89.921 1.00 0.00 H ATOM 26155 H2 WAT 4119 90.953 55.805 88.938 1.00 0.00 H TER 26157 WAT 4119 ATOM 26157 O WAT 4120 110.086 29.473 145.854 1.00 0.00 O ATOM 26158 H1 WAT 4120 110.281 28.928 145.092 1.00 0.00 H ATOM 26159 H2 WAT 4120 110.736 29.214 146.507 1.00 0.00 H TER 26161 WAT 4120 ATOM 26161 O WAT 4121 45.838 37.537 4.559 1.00 0.00 O ATOM 26162 H1 WAT 4121 44.920 37.579 4.828 1.00 0.00 H ATOM 26163 H2 WAT 4121 45.859 37.976 3.708 1.00 0.00 H TER 26165 WAT 4121 ATOM 26165 O WAT 4122 118.709 139.051 7.225 1.00 0.00 O ATOM 26166 H1 WAT 4122 119.589 139.405 7.100 1.00 0.00 H ATOM 26167 H2 WAT 4122 118.269 139.202 6.388 1.00 0.00 H TER 26169 WAT 4122 ATOM 26169 O WAT 4123 20.866 112.503 68.707 1.00 0.00 O ATOM 26170 H1 WAT 4123 21.222 113.038 69.417 1.00 0.00 H ATOM 26171 H2 WAT 4123 19.928 112.693 68.712 1.00 0.00 H TER 26173 WAT 4123 ATOM 26173 O WAT 4124 99.219 110.548 151.601 1.00 0.00 O ATOM 26174 H1 WAT 4124 98.588 110.886 150.966 1.00 0.00 H ATOM 26175 H2 WAT 4124 99.126 111.122 152.361 1.00 0.00 H TER 26177 WAT 4124 ATOM 26177 O WAT 4125 9.031 64.737 110.698 1.00 0.00 O ATOM 26178 H1 WAT 4125 9.983 64.662 110.636 1.00 0.00 H ATOM 26179 H2 WAT 4125 8.886 65.563 111.159 1.00 0.00 H TER 26181 WAT 4125 ATOM 26181 O WAT 4126 29.342 104.669 65.633 1.00 0.00 O ATOM 26182 H1 WAT 4126 29.816 105.166 64.966 1.00 0.00 H ATOM 26183 H2 WAT 4126 28.423 104.738 65.375 1.00 0.00 H TER 26185 WAT 4126 ATOM 26185 O WAT 4127 131.549 51.563 122.749 1.00 0.00 O ATOM 26186 H1 WAT 4127 132.177 51.447 122.036 1.00 0.00 H ATOM 26187 H2 WAT 4127 130.817 52.032 122.349 1.00 0.00 H TER 26189 WAT 4127 ATOM 26189 O WAT 4128 108.243 123.128 3.336 1.00 0.00 O ATOM 26190 H1 WAT 4128 108.648 122.620 2.633 1.00 0.00 H ATOM 26191 H2 WAT 4128 107.480 122.610 3.596 1.00 0.00 H TER 26193 WAT 4128 ATOM 26193 O WAT 4129 10.156 78.611 137.539 1.00 0.00 O ATOM 26194 H1 WAT 4129 10.015 79.362 136.963 1.00 0.00 H ATOM 26195 H2 WAT 4129 9.301 78.185 137.590 1.00 0.00 H TER 26197 WAT 4129 ATOM 26197 O WAT 4130 58.902 11.288 137.250 1.00 0.00 O ATOM 26198 H1 WAT 4130 58.824 10.393 136.920 1.00 0.00 H ATOM 26199 H2 WAT 4130 59.832 11.498 137.157 1.00 0.00 H TER 26201 WAT 4130 ATOM 26201 O WAT 4131 83.337 75.771 143.170 1.00 0.00 O ATOM 26202 H1 WAT 4131 82.893 75.772 144.017 1.00 0.00 H ATOM 26203 H2 WAT 4131 82.861 75.123 142.650 1.00 0.00 H TER 26205 WAT 4131 ATOM 26205 O WAT 4132 143.710 36.050 83.040 1.00 0.00 O ATOM 26206 H1 WAT 4132 143.770 36.980 83.259 1.00 0.00 H ATOM 26207 H2 WAT 4132 143.016 36.004 82.382 1.00 0.00 H TER 26209 WAT 4132 ATOM 26209 O WAT 4133 37.001 5.526 140.766 1.00 0.00 O ATOM 26210 H1 WAT 4133 37.065 5.435 139.815 1.00 0.00 H ATOM 26211 H2 WAT 4133 36.216 6.057 140.903 1.00 0.00 H TER 26213 WAT 4133 ATOM 26213 O WAT 4134 94.744 15.663 130.080 1.00 0.00 O ATOM 26214 H1 WAT 4134 95.079 16.375 129.535 1.00 0.00 H ATOM 26215 H2 WAT 4134 94.057 15.259 129.549 1.00 0.00 H TER 26217 WAT 4134 ATOM 26217 O WAT 4135 134.409 98.028 92.313 1.00 0.00 O ATOM 26218 H1 WAT 4135 134.391 98.970 92.147 1.00 0.00 H ATOM 26219 H2 WAT 4135 133.896 97.916 93.114 1.00 0.00 H TER 26221 WAT 4135 ATOM 26221 O WAT 4136 129.011 56.445 51.109 1.00 0.00 O ATOM 26222 H1 WAT 4136 129.899 56.799 51.144 1.00 0.00 H ATOM 26223 H2 WAT 4136 128.930 55.922 51.906 1.00 0.00 H TER 26225 WAT 4136 ATOM 26225 O WAT 4137 74.697 28.944 146.310 1.00 0.00 O ATOM 26226 H1 WAT 4137 75.314 28.329 145.914 1.00 0.00 H ATOM 26227 H2 WAT 4137 73.964 28.977 145.696 1.00 0.00 H TER 26229 WAT 4137 ATOM 26229 O WAT 4138 116.952 49.782 141.107 1.00 0.00 O ATOM 26230 H1 WAT 4138 117.703 50.323 141.351 1.00 0.00 H ATOM 26231 H2 WAT 4138 117.333 49.035 140.645 1.00 0.00 H TER 26233 WAT 4138 ATOM 26233 O WAT 4139 88.520 90.852 81.357 1.00 0.00 O ATOM 26234 H1 WAT 4139 87.911 90.277 80.895 1.00 0.00 H ATOM 26235 H2 WAT 4139 88.470 90.570 82.271 1.00 0.00 H TER 26237 WAT 4139 ATOM 26237 O WAT 4140 112.031 0.516 94.677 1.00 0.00 O ATOM 26238 H1 WAT 4140 111.268 1.081 94.795 1.00 0.00 H ATOM 26239 H2 WAT 4140 111.748 -0.139 94.039 1.00 0.00 H TER 26241 WAT 4140 ATOM 26241 O WAT 4141 108.635 102.306 84.329 1.00 0.00 O ATOM 26242 H1 WAT 4141 108.529 102.240 85.278 1.00 0.00 H ATOM 26243 H2 WAT 4141 107.760 102.518 84.004 1.00 0.00 H TER 26245 WAT 4141 ATOM 26245 O WAT 4142 51.563 54.861 104.839 1.00 0.00 O ATOM 26246 H1 WAT 4142 51.397 54.470 105.697 1.00 0.00 H ATOM 26247 H2 WAT 4142 51.970 54.159 104.331 1.00 0.00 H TER 26249 WAT 4142 ATOM 26249 O WAT 4143 31.934 57.795 75.622 1.00 0.00 O ATOM 26250 H1 WAT 4143 31.864 57.138 76.314 1.00 0.00 H ATOM 26251 H2 WAT 4143 31.776 58.628 76.066 1.00 0.00 H TER 26253 WAT 4143 ATOM 26253 O WAT 4144 126.497 75.356 93.119 1.00 0.00 O ATOM 26254 H1 WAT 4144 126.604 75.352 94.070 1.00 0.00 H ATOM 26255 H2 WAT 4144 125.747 74.783 92.960 1.00 0.00 H TER 26257 WAT 4144 ATOM 26257 O WAT 4145 97.235 95.529 86.515 1.00 0.00 O ATOM 26258 H1 WAT 4145 97.502 94.626 86.685 1.00 0.00 H ATOM 26259 H2 WAT 4145 96.287 95.526 86.642 1.00 0.00 H TER 26261 WAT 4145 ATOM 26261 O WAT 4146 98.784 69.936 153.345 1.00 0.00 O ATOM 26262 H1 WAT 4146 98.615 69.500 152.510 1.00 0.00 H ATOM 26263 H2 WAT 4146 98.476 69.315 154.006 1.00 0.00 H TER 26265 WAT 4146 ATOM 26265 O WAT 4147 21.192 58.577 84.934 1.00 0.00 O ATOM 26266 H1 WAT 4147 22.024 58.962 85.212 1.00 0.00 H ATOM 26267 H2 WAT 4147 20.653 58.574 85.725 1.00 0.00 H TER 26269 WAT 4147 ATOM 26269 O WAT 4148 52.649 50.786 153.116 1.00 0.00 O ATOM 26270 H1 WAT 4148 51.817 51.201 152.888 1.00 0.00 H ATOM 26271 H2 WAT 4148 52.756 50.091 152.467 1.00 0.00 H TER 26273 WAT 4148 ATOM 26273 O WAT 4149 36.111 11.967 116.841 1.00 0.00 O ATOM 26274 H1 WAT 4149 36.086 12.724 116.256 1.00 0.00 H ATOM 26275 H2 WAT 4149 36.227 11.217 116.258 1.00 0.00 H TER 26277 WAT 4149 ATOM 26277 O WAT 4150 32.221 51.970 5.377 1.00 0.00 O ATOM 26278 H1 WAT 4150 31.391 52.423 5.528 1.00 0.00 H ATOM 26279 H2 WAT 4150 32.691 52.047 6.207 1.00 0.00 H TER 26281 WAT 4150 ATOM 26281 O WAT 4151 103.057 131.332 17.232 1.00 0.00 O ATOM 26282 H1 WAT 4151 103.739 131.695 16.667 1.00 0.00 H ATOM 26283 H2 WAT 4151 103.369 130.454 17.451 1.00 0.00 H TER 26285 WAT 4151 ATOM 26285 O WAT 4152 79.068 69.865 16.069 1.00 0.00 O ATOM 26286 H1 WAT 4152 79.792 69.329 15.745 1.00 0.00 H ATOM 26287 H2 WAT 4152 78.514 70.007 15.301 1.00 0.00 H TER 26289 WAT 4152 ATOM 26289 O WAT 4153 15.644 14.973 142.337 1.00 0.00 O ATOM 26290 H1 WAT 4153 15.786 14.956 143.283 1.00 0.00 H ATOM 26291 H2 WAT 4153 15.368 15.870 142.151 1.00 0.00 H TER 26293 WAT 4153 ATOM 26293 O WAT 4154 24.921 128.740 100.062 1.00 0.00 O ATOM 26294 H1 WAT 4154 25.112 128.296 99.236 1.00 0.00 H ATOM 26295 H2 WAT 4154 24.406 129.506 99.809 1.00 0.00 H TER 26297 WAT 4154 ATOM 26297 O WAT 4155 104.627 53.321 85.347 1.00 0.00 O ATOM 26298 H1 WAT 4155 104.288 54.121 84.946 1.00 0.00 H ATOM 26299 H2 WAT 4155 105.450 53.153 84.889 1.00 0.00 H TER 26301 WAT 4155 ATOM 26301 O WAT 4156 97.078 67.118 104.128 1.00 0.00 O ATOM 26302 H1 WAT 4156 97.019 66.821 105.037 1.00 0.00 H ATOM 26303 H2 WAT 4156 97.710 67.836 104.152 1.00 0.00 H TER 26305 WAT 4156 ATOM 26305 O WAT 4157 20.907 42.246 16.978 1.00 0.00 O ATOM 26306 H1 WAT 4157 20.034 42.103 16.613 1.00 0.00 H ATOM 26307 H2 WAT 4157 21.415 41.488 16.689 1.00 0.00 H TER 26309 WAT 4157 ATOM 26309 O WAT 4158 31.313 130.711 50.037 1.00 0.00 O ATOM 26310 H1 WAT 4158 30.405 130.979 49.894 1.00 0.00 H ATOM 26311 H2 WAT 4158 31.503 130.977 50.936 1.00 0.00 H TER 26313 WAT 4158 ATOM 26313 O WAT 4159 55.305 26.568 57.741 1.00 0.00 O ATOM 26314 H1 WAT 4159 54.727 27.180 57.287 1.00 0.00 H ATOM 26315 H2 WAT 4159 55.362 26.909 58.634 1.00 0.00 H TER 26317 WAT 4159 ATOM 26317 O WAT 4160 98.913 131.244 62.274 1.00 0.00 O ATOM 26318 H1 WAT 4160 98.018 131.345 61.948 1.00 0.00 H ATOM 26319 H2 WAT 4160 99.451 131.189 61.485 1.00 0.00 H TER 26321 WAT 4160 ATOM 26321 O WAT 4161 20.690 116.320 127.337 1.00 0.00 O ATOM 26322 H1 WAT 4161 20.430 116.353 128.257 1.00 0.00 H ATOM 26323 H2 WAT 4161 20.268 117.083 126.941 1.00 0.00 H TER 26325 WAT 4161 ATOM 26325 O WAT 4162 2.282 132.565 19.528 1.00 0.00 O ATOM 26326 H1 WAT 4162 2.158 132.793 20.449 1.00 0.00 H ATOM 26327 H2 WAT 4162 2.115 133.379 19.054 1.00 0.00 H TER 26329 WAT 4162 ATOM 26329 O WAT 4163 58.787 139.669 13.692 1.00 0.00 O ATOM 26330 H1 WAT 4163 59.067 139.032 13.034 1.00 0.00 H ATOM 26331 H2 WAT 4163 58.308 139.150 14.339 1.00 0.00 H TER 26333 WAT 4163 ATOM 26333 O WAT 4164 79.477 45.299 158.082 1.00 0.00 O ATOM 26334 H1 WAT 4164 79.375 45.777 157.258 1.00 0.00 H ATOM 26335 H2 WAT 4164 80.423 45.185 158.176 1.00 0.00 H TER 26337 WAT 4164 ATOM 26337 O WAT 4165 6.073 95.720 55.489 1.00 0.00 O ATOM 26338 H1 WAT 4165 6.066 96.580 55.067 1.00 0.00 H ATOM 26339 H2 WAT 4165 6.991 95.572 55.715 1.00 0.00 H TER 26341 WAT 4165 ATOM 26341 O WAT 4166 54.082 10.853 132.188 1.00 0.00 O ATOM 26342 H1 WAT 4166 54.847 11.303 131.828 1.00 0.00 H ATOM 26343 H2 WAT 4166 53.512 10.708 131.433 1.00 0.00 H TER 26345 WAT 4166 ATOM 26345 O WAT 4167 109.467 78.085 25.495 1.00 0.00 O ATOM 26346 H1 WAT 4167 110.002 78.769 25.091 1.00 0.00 H ATOM 26347 H2 WAT 4167 108.667 78.535 25.765 1.00 0.00 H TER 26349 WAT 4167 ATOM 26349 O WAT 4168 107.485 10.011 135.321 1.00 0.00 O ATOM 26350 H1 WAT 4168 107.569 9.731 134.409 1.00 0.00 H ATOM 26351 H2 WAT 4168 106.851 9.403 135.701 1.00 0.00 H TER 26353 WAT 4168 ATOM 26353 O WAT 4169 36.381 81.133 131.466 1.00 0.00 O ATOM 26354 H1 WAT 4169 35.977 80.433 130.953 1.00 0.00 H ATOM 26355 H2 WAT 4169 35.665 81.491 131.989 1.00 0.00 H TER 26357 WAT 4169 ATOM 26357 O WAT 4170 99.127 22.032 74.938 1.00 0.00 O ATOM 26358 H1 WAT 4170 98.438 21.460 74.601 1.00 0.00 H ATOM 26359 H2 WAT 4170 99.877 21.866 74.367 1.00 0.00 H TER 26361 WAT 4170 ATOM 26361 O WAT 4171 94.011 47.989 76.732 1.00 0.00 O ATOM 26362 H1 WAT 4171 94.853 47.831 77.159 1.00 0.00 H ATOM 26363 H2 WAT 4171 93.390 47.449 77.221 1.00 0.00 H TER 26365 WAT 4171 ATOM 26365 O WAT 4172 108.919 30.470 132.085 1.00 0.00 O ATOM 26366 H1 WAT 4172 109.069 29.701 132.634 1.00 0.00 H ATOM 26367 H2 WAT 4172 108.621 31.145 132.694 1.00 0.00 H TER 26369 WAT 4172 ATOM 26369 O WAT 4173 81.734 88.528 128.187 1.00 0.00 O ATOM 26370 H1 WAT 4173 81.501 89.417 127.919 1.00 0.00 H ATOM 26371 H2 WAT 4173 81.213 88.371 128.974 1.00 0.00 H TER 26373 WAT 4173 ATOM 26373 O WAT 4174 116.747 120.270 121.919 1.00 0.00 O ATOM 26374 H1 WAT 4174 116.726 119.647 121.192 1.00 0.00 H ATOM 26375 H2 WAT 4174 115.826 120.427 122.126 1.00 0.00 H TER 26377 WAT 4174 ATOM 26377 O WAT 4175 62.902 29.020 88.270 1.00 0.00 O ATOM 26378 H1 WAT 4175 61.961 29.197 88.292 1.00 0.00 H ATOM 26379 H2 WAT 4175 63.023 28.458 87.505 1.00 0.00 H TER 26381 WAT 4175 ATOM 26381 O WAT 4176 35.582 7.465 0.971 1.00 0.00 O ATOM 26382 H1 WAT 4176 35.456 6.517 0.981 1.00 0.00 H ATOM 26383 H2 WAT 4176 35.075 7.782 1.719 1.00 0.00 H TER 26385 WAT 4176 ATOM 26385 O WAT 4177 142.919 99.539 28.860 1.00 0.00 O ATOM 26386 H1 WAT 4177 143.404 100.344 29.040 1.00 0.00 H ATOM 26387 H2 WAT 4177 142.045 99.836 28.609 1.00 0.00 H TER 26389 WAT 4177 ATOM 26389 O WAT 4178 20.704 82.301 93.780 1.00 0.00 O ATOM 26390 H1 WAT 4178 20.977 82.465 94.682 1.00 0.00 H ATOM 26391 H2 WAT 4178 21.522 82.154 93.305 1.00 0.00 H TER 26393 WAT 4178 ATOM 26393 O WAT 4179 135.216 5.488 105.466 1.00 0.00 O ATOM 26394 H1 WAT 4179 134.985 4.831 106.122 1.00 0.00 H ATOM 26395 H2 WAT 4179 135.221 6.316 105.947 1.00 0.00 H TER 26397 WAT 4179 ATOM 26397 O WAT 4180 101.460 75.620 106.136 1.00 0.00 O ATOM 26398 H1 WAT 4180 102.305 76.032 106.315 1.00 0.00 H ATOM 26399 H2 WAT 4180 100.981 76.269 105.620 1.00 0.00 H TER 26401 WAT 4180 ATOM 26401 O WAT 4181 23.402 59.937 81.936 1.00 0.00 O ATOM 26402 H1 WAT 4181 24.266 59.886 82.345 1.00 0.00 H ATOM 26403 H2 WAT 4181 23.552 59.681 81.026 1.00 0.00 H TER 26405 WAT 4181 ATOM 26405 O WAT 4182 43.620 138.502 144.381 1.00 0.00 O ATOM 26406 H1 WAT 4182 44.080 139.340 144.428 1.00 0.00 H ATOM 26407 H2 WAT 4182 43.004 138.525 145.113 1.00 0.00 H TER 26409 WAT 4182 ATOM 26409 O WAT 4183 27.144 63.375 57.379 1.00 0.00 O ATOM 26410 H1 WAT 4183 27.169 62.637 57.988 1.00 0.00 H ATOM 26411 H2 WAT 4183 26.529 63.104 56.698 1.00 0.00 H TER 26413 WAT 4183 ATOM 26413 O WAT 4184 31.568 36.512 136.491 1.00 0.00 O ATOM 26414 H1 WAT 4184 30.806 36.919 136.902 1.00 0.00 H ATOM 26415 H2 WAT 4184 31.202 35.957 135.802 1.00 0.00 H TER 26417 WAT 4184 ATOM 26417 O WAT 4185 97.495 88.980 101.412 1.00 0.00 O ATOM 26418 H1 WAT 4185 97.730 88.062 101.549 1.00 0.00 H ATOM 26419 H2 WAT 4185 98.333 89.426 101.287 1.00 0.00 H TER 26421 WAT 4185 ATOM 26421 O WAT 4186 72.665 61.661 126.795 1.00 0.00 O ATOM 26422 H1 WAT 4186 73.422 61.137 127.058 1.00 0.00 H ATOM 26423 H2 WAT 4186 71.961 61.373 127.375 1.00 0.00 H TER 26425 WAT 4186 ATOM 26425 O WAT 4187 63.286 11.107 158.108 1.00 0.00 O ATOM 26426 H1 WAT 4187 62.668 11.017 158.834 1.00 0.00 H ATOM 26427 H2 WAT 4187 62.822 10.744 157.353 1.00 0.00 H TER 26429 WAT 4187 ATOM 26429 O WAT 4188 91.065 37.420 136.695 1.00 0.00 O ATOM 26430 H1 WAT 4188 91.845 36.892 136.528 1.00 0.00 H ATOM 26431 H2 WAT 4188 91.339 38.048 137.363 1.00 0.00 H TER 26433 WAT 4188 ATOM 26433 O WAT 4189 122.053 81.088 75.852 1.00 0.00 O ATOM 26434 H1 WAT 4189 121.127 80.915 76.020 1.00 0.00 H ATOM 26435 H2 WAT 4189 122.207 80.737 74.975 1.00 0.00 H TER 26437 WAT 4189 ATOM 26437 O WAT 4190 1.500 1.640 24.996 1.00 0.00 O ATOM 26438 H1 WAT 4190 2.014 1.875 24.223 1.00 0.00 H ATOM 26439 H2 WAT 4190 1.892 0.823 25.305 1.00 0.00 H TER 26441 WAT 4190 ATOM 26441 O WAT 4191 97.500 26.479 91.093 1.00 0.00 O ATOM 26442 H1 WAT 4191 98.404 26.652 91.354 1.00 0.00 H ATOM 26443 H2 WAT 4191 97.347 27.067 90.353 1.00 0.00 H TER 26445 WAT 4191 ATOM 26445 O WAT 4192 104.985 41.147 108.098 1.00 0.00 O ATOM 26446 H1 WAT 4192 105.390 40.309 107.874 1.00 0.00 H ATOM 26447 H2 WAT 4192 105.603 41.558 108.702 1.00 0.00 H TER 26449 WAT 4192 ATOM 26449 O WAT 4193 46.649 9.364 100.007 1.00 0.00 O ATOM 26450 H1 WAT 4193 47.557 9.565 100.232 1.00 0.00 H ATOM 26451 H2 WAT 4193 46.169 9.472 100.828 1.00 0.00 H TER 26453 WAT 4193 ATOM 26453 O WAT 4194 7.241 84.945 127.666 1.00 0.00 O ATOM 26454 H1 WAT 4194 6.693 84.920 126.882 1.00 0.00 H ATOM 26455 H2 WAT 4194 8.137 84.881 127.333 1.00 0.00 H TER 26457 WAT 4194 ATOM 26457 O WAT 4195 121.640 63.546 126.764 1.00 0.00 O ATOM 26458 H1 WAT 4195 121.101 64.292 126.503 1.00 0.00 H ATOM 26459 H2 WAT 4195 122.498 63.926 126.956 1.00 0.00 H TER 26461 WAT 4195 ATOM 26461 O WAT 4196 50.666 99.418 123.364 1.00 0.00 O ATOM 26462 H1 WAT 4196 50.103 98.644 123.380 1.00 0.00 H ATOM 26463 H2 WAT 4196 51.535 99.087 123.592 1.00 0.00 H TER 26465 WAT 4196 ATOM 26465 O WAT 4197 86.587 106.194 93.660 1.00 0.00 O ATOM 26466 H1 WAT 4197 87.495 106.144 93.957 1.00 0.00 H ATOM 26467 H2 WAT 4197 86.206 105.352 93.912 1.00 0.00 H TER 26469 WAT 4197 ATOM 26469 O WAT 4198 129.549 43.500 87.548 1.00 0.00 O ATOM 26470 H1 WAT 4198 130.458 43.502 87.849 1.00 0.00 H ATOM 26471 H2 WAT 4198 129.030 43.455 88.351 1.00 0.00 H TER 26473 WAT 4198 ATOM 26473 O WAT 4199 95.775 98.757 80.611 1.00 0.00 O ATOM 26474 H1 WAT 4199 96.144 98.558 81.471 1.00 0.00 H ATOM 26475 H2 WAT 4199 96.419 98.417 79.990 1.00 0.00 H TER 26477 WAT 4199 ATOM 26477 O WAT 4200 104.272 4.604 63.523 1.00 0.00 O ATOM 26478 H1 WAT 4200 103.744 4.789 62.747 1.00 0.00 H ATOM 26479 H2 WAT 4200 105.174 4.594 63.203 1.00 0.00 H TER 26481 WAT 4200 ATOM 26481 O WAT 4201 105.169 136.221 60.361 1.00 0.00 O ATOM 26482 H1 WAT 4201 104.891 135.306 60.323 1.00 0.00 H ATOM 26483 H2 WAT 4201 105.233 136.491 59.445 1.00 0.00 H TER 26485 WAT 4201 ATOM 26485 O WAT 4202 28.950 129.995 -0.090 1.00 0.00 O ATOM 26486 H1 WAT 4202 29.721 130.206 0.435 1.00 0.00 H ATOM 26487 H2 WAT 4202 28.224 130.417 0.370 1.00 0.00 H TER 26489 WAT 4202 ATOM 26489 O WAT 4203 113.465 9.657 81.049 1.00 0.00 O ATOM 26490 H1 WAT 4203 114.380 9.778 80.796 1.00 0.00 H ATOM 26491 H2 WAT 4203 113.435 8.776 81.423 1.00 0.00 H TER 26493 WAT 4203 ATOM 26493 O WAT 4204 80.288 45.985 4.240 1.00 0.00 O ATOM 26494 H1 WAT 4204 79.944 46.859 4.422 1.00 0.00 H ATOM 26495 H2 WAT 4204 80.881 45.804 4.969 1.00 0.00 H TER 26497 WAT 4204 ATOM 26497 O WAT 4205 8.980 73.513 106.401 1.00 0.00 O ATOM 26498 H1 WAT 4205 8.639 73.668 107.282 1.00 0.00 H ATOM 26499 H2 WAT 4205 8.892 74.356 105.957 1.00 0.00 H TER 26501 WAT 4205 ATOM 26501 O WAT 4206 101.947 14.120 6.479 1.00 0.00 O ATOM 26502 H1 WAT 4206 101.627 14.860 5.963 1.00 0.00 H ATOM 26503 H2 WAT 4206 102.779 13.884 6.068 1.00 0.00 H TER 26505 WAT 4206 ATOM 26505 O WAT 4207 123.922 104.781 0.561 1.00 0.00 O ATOM 26506 H1 WAT 4207 123.076 104.372 0.741 1.00 0.00 H ATOM 26507 H2 WAT 4207 124.309 104.237 -0.126 1.00 0.00 H TER 26509 WAT 4207 ATOM 26509 O WAT 4208 68.252 133.482 86.701 1.00 0.00 O ATOM 26510 H1 WAT 4208 69.202 133.465 86.591 1.00 0.00 H ATOM 26511 H2 WAT 4208 68.121 133.677 87.629 1.00 0.00 H TER 26513 WAT 4208 ATOM 26513 O WAT 4209 99.465 105.275 11.939 1.00 0.00 O ATOM 26514 H1 WAT 4209 99.607 104.565 12.565 1.00 0.00 H ATOM 26515 H2 WAT 4209 100.180 105.184 11.308 1.00 0.00 H TER 26517 WAT 4209 ATOM 26517 O WAT 4210 89.697 64.936 154.029 1.00 0.00 O ATOM 26518 H1 WAT 4210 88.966 64.587 154.539 1.00 0.00 H ATOM 26519 H2 WAT 4210 89.390 65.789 153.722 1.00 0.00 H TER 26521 WAT 4210 ATOM 26521 O WAT 4211 5.966 91.012 106.174 1.00 0.00 O ATOM 26522 H1 WAT 4211 6.381 91.318 105.368 1.00 0.00 H ATOM 26523 H2 WAT 4211 6.439 90.210 106.398 1.00 0.00 H TER 26525 WAT 4211 ATOM 26525 O WAT 4212 33.805 13.287 22.485 1.00 0.00 O ATOM 26526 H1 WAT 4212 33.480 13.915 23.129 1.00 0.00 H ATOM 26527 H2 WAT 4212 33.057 12.717 22.307 1.00 0.00 H TER 26529 WAT 4212 ATOM 26529 O WAT 4213 143.432 104.707 62.235 1.00 0.00 O ATOM 26530 H1 WAT 4213 143.606 105.520 62.711 1.00 0.00 H ATOM 26531 H2 WAT 4213 143.473 104.024 62.904 1.00 0.00 H TER 26533 WAT 4213 ATOM 26533 O WAT 4214 120.850 90.842 59.813 1.00 0.00 O ATOM 26534 H1 WAT 4214 120.203 90.622 59.143 1.00 0.00 H ATOM 26535 H2 WAT 4214 120.387 91.430 60.409 1.00 0.00 H TER 26537 WAT 4214 ATOM 26537 O WAT 4215 6.031 121.920 117.873 1.00 0.00 O ATOM 26538 H1 WAT 4215 5.257 121.459 118.196 1.00 0.00 H ATOM 26539 H2 WAT 4215 6.274 121.448 117.076 1.00 0.00 H TER 26541 WAT 4215 ATOM 26541 O WAT 4216 96.319 144.642 58.258 1.00 0.00 O ATOM 26542 H1 WAT 4216 96.252 145.532 57.913 1.00 0.00 H ATOM 26543 H2 WAT 4216 97.229 144.565 58.547 1.00 0.00 H TER 26545 WAT 4216 ATOM 26545 O WAT 4217 50.082 3.082 99.109 1.00 0.00 O ATOM 26546 H1 WAT 4217 50.701 3.330 99.795 1.00 0.00 H ATOM 26547 H2 WAT 4217 49.257 3.490 99.371 1.00 0.00 H TER 26549 WAT 4217 ATOM 26549 O WAT 4218 122.999 49.082 16.160 1.00 0.00 O ATOM 26550 H1 WAT 4218 122.996 48.638 15.312 1.00 0.00 H ATOM 26551 H2 WAT 4218 122.085 49.324 16.307 1.00 0.00 H TER 26553 WAT 4218 ATOM 26553 O WAT 4219 133.023 32.696 93.875 1.00 0.00 O ATOM 26554 H1 WAT 4219 133.866 32.602 94.319 1.00 0.00 H ATOM 26555 H2 WAT 4219 132.451 32.063 94.309 1.00 0.00 H TER 26557 WAT 4219 ATOM 26557 O WAT 4220 78.852 20.700 102.035 1.00 0.00 O ATOM 26558 H1 WAT 4220 79.754 20.958 102.225 1.00 0.00 H ATOM 26559 H2 WAT 4220 78.427 21.508 101.747 1.00 0.00 H TER 26561 WAT 4220 ATOM 26561 O WAT 4221 97.467 65.588 124.241 1.00 0.00 O ATOM 26562 H1 WAT 4221 98.130 65.081 123.773 1.00 0.00 H ATOM 26563 H2 WAT 4221 97.590 66.486 123.932 1.00 0.00 H TER 26565 WAT 4221 ATOM 26565 O WAT 4222 46.067 82.821 57.471 1.00 0.00 O ATOM 26566 H1 WAT 4222 45.897 81.898 57.659 1.00 0.00 H ATOM 26567 H2 WAT 4222 45.298 83.280 57.808 1.00 0.00 H TER 26569 WAT 4222 ATOM 26569 O WAT 4223 90.245 42.993 95.400 1.00 0.00 O ATOM 26570 H1 WAT 4223 90.825 42.498 94.820 1.00 0.00 H ATOM 26571 H2 WAT 4223 90.254 43.882 95.046 1.00 0.00 H TER 26573 WAT 4223 ATOM 26573 O WAT 4224 2.990 9.486 6.203 1.00 0.00 O ATOM 26574 H1 WAT 4224 3.282 10.388 6.336 1.00 0.00 H ATOM 26575 H2 WAT 4224 2.606 9.233 7.043 1.00 0.00 H TER 26577 WAT 4224 ATOM 26577 O WAT 4225 50.863 19.378 146.320 1.00 0.00 O ATOM 26578 H1 WAT 4225 51.472 18.698 146.607 1.00 0.00 H ATOM 26579 H2 WAT 4225 51.403 20.163 146.232 1.00 0.00 H TER 26581 WAT 4225 ATOM 26581 O WAT 4226 127.163 3.560 111.912 1.00 0.00 O ATOM 26582 H1 WAT 4226 126.267 3.229 111.980 1.00 0.00 H ATOM 26583 H2 WAT 4226 127.365 3.514 110.978 1.00 0.00 H TER 26585 WAT 4226 ATOM 26585 O WAT 4227 101.191 70.586 121.605 1.00 0.00 O ATOM 26586 H1 WAT 4227 100.338 70.812 121.975 1.00 0.00 H ATOM 26587 H2 WAT 4227 100.986 70.118 120.796 1.00 0.00 H TER 26589 WAT 4227 ATOM 26589 O WAT 4228 45.932 88.432 126.706 1.00 0.00 O ATOM 26590 H1 WAT 4228 46.851 88.253 126.904 1.00 0.00 H ATOM 26591 H2 WAT 4228 45.938 88.740 125.799 1.00 0.00 H TER 26593 WAT 4228 ATOM 26593 O WAT 4229 20.853 26.632 65.509 1.00 0.00 O ATOM 26594 H1 WAT 4229 21.057 27.054 64.675 1.00 0.00 H ATOM 26595 H2 WAT 4229 21.154 25.730 65.401 1.00 0.00 H TER 26597 WAT 4229 ATOM 26597 O WAT 4230 34.147 120.295 75.207 1.00 0.00 O ATOM 26598 H1 WAT 4230 33.648 120.054 75.987 1.00 0.00 H ATOM 26599 H2 WAT 4230 34.995 119.865 75.323 1.00 0.00 H TER 26601 WAT 4230 ATOM 26601 O WAT 4231 41.424 115.715 10.817 1.00 0.00 O ATOM 26602 H1 WAT 4231 41.822 115.049 11.377 1.00 0.00 H ATOM 26603 H2 WAT 4231 40.576 115.895 11.224 1.00 0.00 H TER 26605 WAT 4231 ATOM 26605 O WAT 4232 86.988 74.973 102.840 1.00 0.00 O ATOM 26606 H1 WAT 4232 87.017 75.405 103.693 1.00 0.00 H ATOM 26607 H2 WAT 4232 87.888 75.018 102.518 1.00 0.00 H TER 26609 WAT 4232 ATOM 26609 O WAT 4233 14.187 118.965 108.270 1.00 0.00 O ATOM 26610 H1 WAT 4233 14.219 119.635 107.587 1.00 0.00 H ATOM 26611 H2 WAT 4233 15.068 118.964 108.646 1.00 0.00 H TER 26613 WAT 4233 ATOM 26613 O WAT 4234 91.255 110.007 95.270 1.00 0.00 O ATOM 26614 H1 WAT 4234 91.925 110.667 95.093 1.00 0.00 H ATOM 26615 H2 WAT 4234 91.391 109.341 94.596 1.00 0.00 H TER 26617 WAT 4234 ATOM 26617 O WAT 4235 135.380 96.951 5.054 1.00 0.00 O ATOM 26618 H1 WAT 4235 135.180 97.793 5.463 1.00 0.00 H ATOM 26619 H2 WAT 4235 136.052 96.566 5.617 1.00 0.00 H TER 26621 WAT 4235 ATOM 26621 O WAT 4236 144.714 17.189 70.351 1.00 0.00 O ATOM 26622 H1 WAT 4236 144.105 16.547 70.716 1.00 0.00 H ATOM 26623 H2 WAT 4236 145.554 16.980 70.761 1.00 0.00 H TER 26625 WAT 4236 ATOM 26625 O WAT 4237 91.528 2.254 115.584 1.00 0.00 O ATOM 26626 H1 WAT 4237 92.083 1.833 116.241 1.00 0.00 H ATOM 26627 H2 WAT 4237 90.786 1.658 115.480 1.00 0.00 H TER 26629 WAT 4237 ATOM 26629 O WAT 4238 40.507 97.421 61.157 1.00 0.00 O ATOM 26630 H1 WAT 4238 40.946 98.021 61.759 1.00 0.00 H ATOM 26631 H2 WAT 4238 39.585 97.672 61.197 1.00 0.00 H TER 26633 WAT 4238 ATOM 26633 O WAT 4239 78.120 139.158 117.844 1.00 0.00 O ATOM 26634 H1 WAT 4239 77.306 139.617 118.052 1.00 0.00 H ATOM 26635 H2 WAT 4239 77.943 138.244 118.065 1.00 0.00 H TER 26637 WAT 4239 ATOM 26637 O WAT 4240 63.233 145.455 149.826 1.00 0.00 O ATOM 26638 H1 WAT 4240 63.385 145.768 150.718 1.00 0.00 H ATOM 26639 H2 WAT 4240 62.406 144.976 149.878 1.00 0.00 H TER 26641 WAT 4240 ATOM 26641 O WAT 4241 129.705 19.594 5.214 1.00 0.00 O ATOM 26642 H1 WAT 4241 129.337 20.403 4.860 1.00 0.00 H ATOM 26643 H2 WAT 4241 129.376 18.907 4.635 1.00 0.00 H TER 26645 WAT 4241 ATOM 26645 O WAT 4242 6.774 26.990 130.245 1.00 0.00 O ATOM 26646 H1 WAT 4242 7.203 27.799 129.968 1.00 0.00 H ATOM 26647 H2 WAT 4242 7.365 26.617 130.899 1.00 0.00 H TER 26649 WAT 4242 ATOM 26649 O WAT 4243 90.166 112.716 19.183 1.00 0.00 O ATOM 26650 H1 WAT 4243 90.791 111.990 19.174 1.00 0.00 H ATOM 26651 H2 WAT 4243 89.691 112.613 20.007 1.00 0.00 H TER 26653 WAT 4243 ATOM 26653 O WAT 4244 9.048 61.393 117.954 1.00 0.00 O ATOM 26654 H1 WAT 4244 8.389 60.838 118.372 1.00 0.00 H ATOM 26655 H2 WAT 4244 9.692 60.777 117.604 1.00 0.00 H TER 26657 WAT 4244 ATOM 26657 O WAT 4245 109.447 99.835 147.420 1.00 0.00 O ATOM 26658 H1 WAT 4245 109.889 100.082 148.232 1.00 0.00 H ATOM 26659 H2 WAT 4245 109.296 98.893 147.506 1.00 0.00 H TER 26661 WAT 4245 ATOM 26661 O WAT 4246 133.203 70.860 73.480 1.00 0.00 O ATOM 26662 H1 WAT 4246 133.066 70.219 72.782 1.00 0.00 H ATOM 26663 H2 WAT 4246 133.851 70.452 74.055 1.00 0.00 H TER 26665 WAT 4246 ATOM 26665 O WAT 4247 76.286 15.380 126.987 1.00 0.00 O ATOM 26666 H1 WAT 4247 76.519 16.198 127.428 1.00 0.00 H ATOM 26667 H2 WAT 4247 76.166 15.629 126.071 1.00 0.00 H TER 26669 WAT 4247 ATOM 26669 O WAT 4248 30.745 81.829 12.960 1.00 0.00 O ATOM 26670 H1 WAT 4248 30.449 81.962 12.060 1.00 0.00 H ATOM 26671 H2 WAT 4248 30.312 82.520 13.460 1.00 0.00 H TER 26673 WAT 4248 ATOM 26673 O WAT 4249 67.734 9.131 59.864 1.00 0.00 O ATOM 26674 H1 WAT 4249 67.899 8.721 59.015 1.00 0.00 H ATOM 26675 H2 WAT 4249 67.796 8.412 60.493 1.00 0.00 H TER 26677 WAT 4249 ATOM 26677 O WAT 4250 64.435 56.083 1.649 1.00 0.00 O ATOM 26678 H1 WAT 4250 63.965 55.925 0.830 1.00 0.00 H ATOM 26679 H2 WAT 4250 64.009 55.508 2.285 1.00 0.00 H TER 26681 WAT 4250 ATOM 26681 O WAT 4251 44.428 44.340 2.550 1.00 0.00 O ATOM 26682 H1 WAT 4251 45.350 44.113 2.675 1.00 0.00 H ATOM 26683 H2 WAT 4251 44.029 44.203 3.409 1.00 0.00 H TER 26685 WAT 4251 ATOM 26685 O WAT 4252 97.218 52.208 86.783 1.00 0.00 O ATOM 26686 H1 WAT 4252 96.351 51.854 86.981 1.00 0.00 H ATOM 26687 H2 WAT 4252 97.727 52.056 87.579 1.00 0.00 H TER 26689 WAT 4252 ATOM 26689 O WAT 4253 54.770 23.590 16.102 1.00 0.00 O ATOM 26690 H1 WAT 4253 55.499 23.856 16.662 1.00 0.00 H ATOM 26691 H2 WAT 4253 54.175 24.340 16.112 1.00 0.00 H TER 26693 WAT 4253 ATOM 26693 O WAT 4254 70.154 131.289 53.573 1.00 0.00 O ATOM 26694 H1 WAT 4254 70.056 131.966 54.243 1.00 0.00 H ATOM 26695 H2 WAT 4254 70.809 131.641 52.970 1.00 0.00 H TER 26697 WAT 4254 ATOM 26697 O WAT 4255 0.896 66.591 7.849 1.00 0.00 O ATOM 26698 H1 WAT 4255 0.149 66.498 7.258 1.00 0.00 H ATOM 26699 H2 WAT 4255 0.580 66.258 8.689 1.00 0.00 H TER 26701 WAT 4255 ATOM 26701 O WAT 4256 3.574 92.135 15.428 1.00 0.00 O ATOM 26702 H1 WAT 4256 3.592 91.192 15.264 1.00 0.00 H ATOM 26703 H2 WAT 4256 2.755 92.280 15.902 1.00 0.00 H TER 26705 WAT 4256 ATOM 26705 O WAT 4257 94.354 130.413 21.262 1.00 0.00 O ATOM 26706 H1 WAT 4257 94.423 129.546 21.661 1.00 0.00 H ATOM 26707 H2 WAT 4257 93.487 130.422 20.857 1.00 0.00 H TER 26709 WAT 4257 ATOM 26709 O WAT 4258 96.060 85.952 12.908 1.00 0.00 O ATOM 26710 H1 WAT 4258 96.141 85.882 13.859 1.00 0.00 H ATOM 26711 H2 WAT 4258 96.312 85.089 12.581 1.00 0.00 H TER 26713 WAT 4258 ATOM 26713 O WAT 4259 86.488 54.800 129.561 1.00 0.00 O ATOM 26714 H1 WAT 4259 86.299 54.100 128.936 1.00 0.00 H ATOM 26715 H2 WAT 4259 86.982 54.370 130.259 1.00 0.00 H TER 26717 WAT 4259 ATOM 26717 O WAT 4260 82.549 133.272 67.783 1.00 0.00 O ATOM 26718 H1 WAT 4260 83.079 133.335 66.988 1.00 0.00 H ATOM 26719 H2 WAT 4260 82.271 132.357 67.813 1.00 0.00 H TER 26721 WAT 4260 ATOM 26721 O WAT 4261 94.232 140.288 124.718 1.00 0.00 O ATOM 26722 H1 WAT 4261 93.367 140.581 125.002 1.00 0.00 H ATOM 26723 H2 WAT 4261 94.502 140.934 124.066 1.00 0.00 H TER 26725 WAT 4261 ATOM 26725 O WAT 4262 122.072 54.394 83.988 1.00 0.00 O ATOM 26726 H1 WAT 4262 121.233 54.595 84.401 1.00 0.00 H ATOM 26727 H2 WAT 4262 122.345 55.219 83.586 1.00 0.00 H TER 26729 WAT 4262 ATOM 26729 O WAT 4263 18.723 143.880 129.940 1.00 0.00 O ATOM 26730 H1 WAT 4263 18.462 144.462 129.227 1.00 0.00 H ATOM 26731 H2 WAT 4263 19.368 144.384 130.436 1.00 0.00 H TER 26733 WAT 4263 ATOM 26733 O WAT 4264 121.145 137.162 71.976 1.00 0.00 O ATOM 26734 H1 WAT 4264 121.233 137.111 71.024 1.00 0.00 H ATOM 26735 H2 WAT 4264 120.225 137.380 72.121 1.00 0.00 H TER 26737 WAT 4264 ATOM 26737 O WAT 4265 117.523 114.159 101.223 1.00 0.00 O ATOM 26738 H1 WAT 4265 116.919 113.419 101.163 1.00 0.00 H ATOM 26739 H2 WAT 4265 118.339 113.834 100.844 1.00 0.00 H TER 26741 WAT 4265 ATOM 26741 O WAT 4266 9.146 128.628 9.625 1.00 0.00 O ATOM 26742 H1 WAT 4266 9.752 128.631 8.884 1.00 0.00 H ATOM 26743 H2 WAT 4266 8.587 129.391 9.481 1.00 0.00 H TER 26745 WAT 4266 ATOM 26745 O WAT 4267 22.400 78.993 117.270 1.00 0.00 O ATOM 26746 H1 WAT 4267 22.835 79.094 118.117 1.00 0.00 H ATOM 26747 H2 WAT 4267 23.095 79.129 116.626 1.00 0.00 H TER 26749 WAT 4267 ATOM 26749 O WAT 4268 99.691 58.770 130.227 1.00 0.00 O ATOM 26750 H1 WAT 4268 100.052 58.158 130.869 1.00 0.00 H ATOM 26751 H2 WAT 4268 100.411 58.930 129.617 1.00 0.00 H TER 26753 WAT 4268 ATOM 26753 O WAT 4269 59.185 107.522 71.431 1.00 0.00 O ATOM 26754 H1 WAT 4269 60.006 108.013 71.406 1.00 0.00 H ATOM 26755 H2 WAT 4269 58.504 108.188 71.334 1.00 0.00 H TER 26757 WAT 4269 ATOM 26757 O WAT 4270 100.436 4.973 82.816 1.00 0.00 O ATOM 26758 H1 WAT 4270 99.646 5.500 82.698 1.00 0.00 H ATOM 26759 H2 WAT 4270 100.110 4.100 83.034 1.00 0.00 H TER 26761 WAT 4270 ATOM 26761 O WAT 4271 130.961 138.792 16.747 1.00 0.00 O ATOM 26762 H1 WAT 4271 130.853 137.870 16.514 1.00 0.00 H ATOM 26763 H2 WAT 4271 131.857 138.851 17.080 1.00 0.00 H TER 26765 WAT 4271 ATOM 26765 O WAT 4272 124.738 9.207 87.039 1.00 0.00 O ATOM 26766 H1 WAT 4272 125.593 9.157 87.467 1.00 0.00 H ATOM 26767 H2 WAT 4272 124.139 9.483 87.733 1.00 0.00 H TER 26769 WAT 4272 ATOM 26769 O WAT 4273 80.344 9.043 4.106 1.00 0.00 O ATOM 26770 H1 WAT 4273 80.129 9.141 5.033 1.00 0.00 H ATOM 26771 H2 WAT 4273 79.786 9.682 3.662 1.00 0.00 H TER 26773 WAT 4273 ATOM 26773 O WAT 4274 65.446 89.297 93.535 1.00 0.00 O ATOM 26774 H1 WAT 4274 64.781 89.330 92.847 1.00 0.00 H ATOM 26775 H2 WAT 4274 65.041 88.785 94.235 1.00 0.00 H TER 26777 WAT 4274 ATOM 26777 O WAT 4275 39.902 5.969 117.149 1.00 0.00 O ATOM 26778 H1 WAT 4275 39.255 6.639 116.930 1.00 0.00 H ATOM 26779 H2 WAT 4275 40.657 6.461 117.472 1.00 0.00 H TER 26781 WAT 4275 ATOM 26781 O WAT 4276 84.917 94.704 55.618 1.00 0.00 O ATOM 26782 H1 WAT 4276 84.632 94.610 56.527 1.00 0.00 H ATOM 26783 H2 WAT 4276 85.847 94.477 55.634 1.00 0.00 H TER 26785 WAT 4276 ATOM 26785 O WAT 4277 26.522 25.632 135.400 1.00 0.00 O ATOM 26786 H1 WAT 4277 27.271 25.722 135.989 1.00 0.00 H ATOM 26787 H2 WAT 4277 25.781 25.455 135.979 1.00 0.00 H TER 26789 WAT 4277 ATOM 26789 O WAT 4278 65.846 42.556 135.554 1.00 0.00 O ATOM 26790 H1 WAT 4278 65.674 42.054 134.757 1.00 0.00 H ATOM 26791 H2 WAT 4278 66.628 42.150 135.929 1.00 0.00 H TER 26793 WAT 4278 ATOM 26793 O WAT 4279 36.373 10.348 11.528 1.00 0.00 O ATOM 26794 H1 WAT 4279 35.593 10.198 10.994 1.00 0.00 H ATOM 26795 H2 WAT 4279 36.125 11.059 12.120 1.00 0.00 H TER 26797 WAT 4279 ATOM 26797 O WAT 4280 26.696 121.747 111.819 1.00 0.00 O ATOM 26798 H1 WAT 4280 27.245 121.746 112.602 1.00 0.00 H ATOM 26799 H2 WAT 4280 26.747 122.645 111.491 1.00 0.00 H TER 26801 WAT 4280 ATOM 26801 O WAT 4281 84.846 69.588 94.920 1.00 0.00 O ATOM 26802 H1 WAT 4281 85.496 69.850 95.571 1.00 0.00 H ATOM 26803 H2 WAT 4281 84.038 69.474 95.422 1.00 0.00 H TER 26805 WAT 4281 ATOM 26805 O WAT 4282 113.513 93.767 146.121 1.00 0.00 O ATOM 26806 H1 WAT 4282 114.404 93.645 145.795 1.00 0.00 H ATOM 26807 H2 WAT 4282 113.154 92.881 146.176 1.00 0.00 H TER 26809 WAT 4282 ATOM 26809 O WAT 4283 120.559 47.290 10.904 1.00 0.00 O ATOM 26810 H1 WAT 4283 120.953 48.085 10.546 1.00 0.00 H ATOM 26811 H2 WAT 4283 119.727 47.581 11.277 1.00 0.00 H TER 26813 WAT 4283 ATOM 26813 O WAT 4284 4.911 2.292 17.883 1.00 0.00 O ATOM 26814 H1 WAT 4284 5.261 2.912 17.242 1.00 0.00 H ATOM 26815 H2 WAT 4284 4.688 2.832 18.641 1.00 0.00 H TER 26817 WAT 4284 ATOM 26817 O WAT 4285 52.422 114.589 153.024 1.00 0.00 O ATOM 26818 H1 WAT 4285 52.649 114.874 153.909 1.00 0.00 H ATOM 26819 H2 WAT 4285 52.253 115.401 152.546 1.00 0.00 H TER 26821 WAT 4285 ATOM 26821 O WAT 4286 4.380 29.847 115.760 1.00 0.00 O ATOM 26822 H1 WAT 4286 4.522 30.257 116.613 1.00 0.00 H ATOM 26823 H2 WAT 4286 4.612 30.526 115.126 1.00 0.00 H TER 26825 WAT 4286 ATOM 26825 O WAT 4287 57.431 56.168 30.749 1.00 0.00 O ATOM 26826 H1 WAT 4287 56.635 56.212 31.279 1.00 0.00 H ATOM 26827 H2 WAT 4287 57.478 55.256 30.463 1.00 0.00 H TER 26829 WAT 4287 ATOM 26829 O WAT 4288 30.316 99.049 104.396 1.00 0.00 O ATOM 26830 H1 WAT 4288 30.449 99.387 105.281 1.00 0.00 H ATOM 26831 H2 WAT 4288 31.188 98.775 104.110 1.00 0.00 H TER 26833 WAT 4288 ATOM 26833 O WAT 4289 32.984 16.449 114.554 1.00 0.00 O ATOM 26834 H1 WAT 4289 32.660 16.994 113.837 1.00 0.00 H ATOM 26835 H2 WAT 4289 32.193 16.154 115.006 1.00 0.00 H TER 26837 WAT 4289 ATOM 26837 O WAT 4290 112.337 97.762 17.398 1.00 0.00 O ATOM 26838 H1 WAT 4290 111.394 97.837 17.545 1.00 0.00 H ATOM 26839 H2 WAT 4290 112.546 96.860 17.639 1.00 0.00 H TER 26841 WAT 4290 ATOM 26841 O WAT 4291 45.813 80.019 143.270 1.00 0.00 O ATOM 26842 H1 WAT 4291 45.770 79.786 144.197 1.00 0.00 H ATOM 26843 H2 WAT 4291 45.288 80.816 143.198 1.00 0.00 H TER 26845 WAT 4291 ATOM 26845 O WAT 4292 142.371 99.827 78.590 1.00 0.00 O ATOM 26846 H1 WAT 4292 141.973 98.965 78.466 1.00 0.00 H ATOM 26847 H2 WAT 4292 143.025 99.891 77.894 1.00 0.00 H TER 26849 WAT 4292 ATOM 26849 O WAT 4293 28.656 103.843 140.992 1.00 0.00 O ATOM 26850 H1 WAT 4293 28.117 103.077 140.795 1.00 0.00 H ATOM 26851 H2 WAT 4293 28.397 104.492 140.337 1.00 0.00 H TER 26853 WAT 4293 ATOM 26853 O WAT 4294 106.713 33.530 147.273 1.00 0.00 O ATOM 26854 H1 WAT 4294 106.416 33.439 148.178 1.00 0.00 H ATOM 26855 H2 WAT 4294 106.546 34.448 147.057 1.00 0.00 H TER 26857 WAT 4294 ATOM 26857 O WAT 4295 69.951 119.607 69.806 1.00 0.00 O ATOM 26858 H1 WAT 4295 69.432 120.378 70.033 1.00 0.00 H ATOM 26859 H2 WAT 4295 69.621 119.341 68.948 1.00 0.00 H TER 26861 WAT 4295 ATOM 26861 O WAT 4296 75.255 88.141 115.978 1.00 0.00 O ATOM 26862 H1 WAT 4296 75.706 88.725 115.369 1.00 0.00 H ATOM 26863 H2 WAT 4296 74.989 87.394 115.442 1.00 0.00 H TER 26865 WAT 4296 ATOM 26865 O WAT 4297 34.288 55.853 90.699 1.00 0.00 O ATOM 26866 H1 WAT 4297 34.804 56.553 91.099 1.00 0.00 H ATOM 26867 H2 WAT 4297 34.109 55.246 91.418 1.00 0.00 H TER 26869 WAT 4297 ATOM 26869 O WAT 4298 40.112 107.806 127.507 1.00 0.00 O ATOM 26870 H1 WAT 4298 40.965 107.522 127.835 1.00 0.00 H ATOM 26871 H2 WAT 4298 39.525 107.719 128.258 1.00 0.00 H TER 26873 WAT 4298 ATOM 26873 O WAT 4299 98.882 44.527 131.469 1.00 0.00 O ATOM 26874 H1 WAT 4299 98.266 45.068 131.962 1.00 0.00 H ATOM 26875 H2 WAT 4299 99.555 44.289 132.107 1.00 0.00 H TER 26877 WAT 4299 ATOM 26877 O WAT 4300 39.388 69.931 73.165 1.00 0.00 O ATOM 26878 H1 WAT 4300 39.426 69.109 72.674 1.00 0.00 H ATOM 26879 H2 WAT 4300 40.046 69.828 73.853 1.00 0.00 H TER 26881 WAT 4300 ATOM 26881 O WAT 4301 141.190 33.418 125.132 1.00 0.00 O ATOM 26882 H1 WAT 4301 141.008 32.610 124.652 1.00 0.00 H ATOM 26883 H2 WAT 4301 140.329 33.804 125.288 1.00 0.00 H TER 26885 WAT 4301 ATOM 26885 O WAT 4302 64.012 48.481 102.318 1.00 0.00 O ATOM 26886 H1 WAT 4302 64.454 48.465 103.167 1.00 0.00 H ATOM 26887 H2 WAT 4302 63.517 49.300 102.321 1.00 0.00 H TER 26889 WAT 4302 ATOM 26889 O WAT 4303 18.890 26.342 109.002 1.00 0.00 O ATOM 26890 H1 WAT 4303 17.974 26.289 109.272 1.00 0.00 H ATOM 26891 H2 WAT 4303 18.906 27.035 108.342 1.00 0.00 H TER 26893 WAT 4303 ATOM 26893 O WAT 4304 132.275 1.768 127.324 1.00 0.00 O ATOM 26894 H1 WAT 4304 132.252 2.604 127.791 1.00 0.00 H ATOM 26895 H2 WAT 4304 133.108 1.372 127.582 1.00 0.00 H TER 26897 WAT 4304 ATOM 26897 O WAT 4305 42.689 99.379 101.816 1.00 0.00 O ATOM 26898 H1 WAT 4305 42.069 99.782 102.424 1.00 0.00 H ATOM 26899 H2 WAT 4305 42.696 99.964 101.059 1.00 0.00 H TER 26901 WAT 4305 ATOM 26901 O WAT 4306 98.385 129.905 81.790 1.00 0.00 O ATOM 26902 H1 WAT 4306 97.715 130.482 81.423 1.00 0.00 H ATOM 26903 H2 WAT 4306 99.080 129.897 81.132 1.00 0.00 H TER 26905 WAT 4306 ATOM 26905 O WAT 4307 34.374 121.891 5.894 1.00 0.00 O ATOM 26906 H1 WAT 4307 35.270 121.792 5.573 1.00 0.00 H ATOM 26907 H2 WAT 4307 33.995 122.573 5.340 1.00 0.00 H TER 26909 WAT 4307 ATOM 26909 O WAT 4308 103.283 2.656 109.455 1.00 0.00 O ATOM 26910 H1 WAT 4308 103.245 2.677 110.411 1.00 0.00 H ATOM 26911 H2 WAT 4308 102.967 3.517 109.183 1.00 0.00 H TER 26913 WAT 4308 ATOM 26913 O WAT 4309 142.689 76.123 58.793 1.00 0.00 O ATOM 26914 H1 WAT 4309 141.897 76.370 58.315 1.00 0.00 H ATOM 26915 H2 WAT 4309 142.964 75.298 58.392 1.00 0.00 H TER 26917 WAT 4309 ATOM 26917 O WAT 4310 100.165 21.536 71.181 1.00 0.00 O ATOM 26918 H1 WAT 4310 99.209 21.483 71.174 1.00 0.00 H ATOM 26919 H2 WAT 4310 100.387 21.966 70.355 1.00 0.00 H TER 26921 WAT 4310 ATOM 26921 O WAT 4311 139.743 130.716 106.668 1.00 0.00 O ATOM 26922 H1 WAT 4311 138.888 131.096 106.464 1.00 0.00 H ATOM 26923 H2 WAT 4311 139.948 131.044 107.544 1.00 0.00 H TER 26925 WAT 4311 ATOM 26925 O WAT 4312 116.910 37.377 113.960 1.00 0.00 O ATOM 26926 H1 WAT 4312 116.686 36.630 114.515 1.00 0.00 H ATOM 26927 H2 WAT 4312 117.359 36.990 113.208 1.00 0.00 H TER 26929 WAT 4312 ATOM 26929 O WAT 4313 68.130 66.576 137.456 1.00 0.00 O ATOM 26930 H1 WAT 4313 67.830 66.148 138.258 1.00 0.00 H ATOM 26931 H2 WAT 4313 68.811 67.182 137.749 1.00 0.00 H TER 26933 WAT 4313 ATOM 26933 O WAT 4314 115.723 72.178 22.212 1.00 0.00 O ATOM 26934 H1 WAT 4314 116.168 71.657 22.880 1.00 0.00 H ATOM 26935 H2 WAT 4314 116.079 73.060 22.321 1.00 0.00 H TER 26937 WAT 4314 ATOM 26937 O WAT 4315 32.972 61.945 125.584 1.00 0.00 O ATOM 26938 H1 WAT 4315 33.755 61.809 125.051 1.00 0.00 H ATOM 26939 H2 WAT 4315 32.685 61.062 125.818 1.00 0.00 H TER 26941 WAT 4315 ATOM 26941 O WAT 4316 108.002 134.300 57.322 1.00 0.00 O ATOM 26942 H1 WAT 4316 107.512 134.864 56.723 1.00 0.00 H ATOM 26943 H2 WAT 4316 108.771 134.029 56.821 1.00 0.00 H TER 26945 WAT 4316 ATOM 26945 O WAT 4317 73.532 90.365 10.444 1.00 0.00 O ATOM 26946 H1 WAT 4317 73.303 89.506 10.087 1.00 0.00 H ATOM 26947 H2 WAT 4317 73.032 90.427 11.257 1.00 0.00 H TER 26949 WAT 4317 ATOM 26949 O WAT 4318 51.770 136.587 53.840 1.00 0.00 O ATOM 26950 H1 WAT 4318 51.898 136.388 52.912 1.00 0.00 H ATOM 26951 H2 WAT 4318 52.639 136.836 54.153 1.00 0.00 H TER 26953 WAT 4318 ATOM 26953 O WAT 4319 58.932 132.227 139.787 1.00 0.00 O ATOM 26954 H1 WAT 4319 58.579 131.871 140.603 1.00 0.00 H ATOM 26955 H2 WAT 4319 58.295 131.972 139.119 1.00 0.00 H TER 26957 WAT 4319 ATOM 26957 O WAT 4320 88.105 9.450 133.182 1.00 0.00 O ATOM 26958 H1 WAT 4320 88.047 8.495 133.147 1.00 0.00 H ATOM 26959 H2 WAT 4320 87.817 9.740 132.317 1.00 0.00 H TER 26961 WAT 4320 ATOM 26961 O WAT 4321 17.205 142.265 132.234 1.00 0.00 O ATOM 26962 H1 WAT 4321 17.037 142.838 132.983 1.00 0.00 H ATOM 26963 H2 WAT 4321 17.664 142.822 131.605 1.00 0.00 H TER 26965 WAT 4321 ATOM 26965 O WAT 4322 28.911 48.937 22.235 1.00 0.00 O ATOM 26966 H1 WAT 4322 28.737 48.383 22.996 1.00 0.00 H ATOM 26967 H2 WAT 4322 29.842 49.148 22.300 1.00 0.00 H TER 26969 WAT 4322 ATOM 26969 O WAT 4323 9.385 32.111 122.859 1.00 0.00 O ATOM 26970 H1 WAT 4323 8.466 32.225 122.615 1.00 0.00 H ATOM 26971 H2 WAT 4323 9.574 31.195 122.656 1.00 0.00 H TER 26973 WAT 4323 ATOM 26973 O WAT 4324 62.606 144.287 86.847 1.00 0.00 O ATOM 26974 H1 WAT 4324 61.698 144.057 87.044 1.00 0.00 H ATOM 26975 H2 WAT 4324 63.125 143.630 87.310 1.00 0.00 H TER 26977 WAT 4324 ATOM 26977 O WAT 4325 80.200 63.965 79.409 1.00 0.00 O ATOM 26978 H1 WAT 4325 79.978 63.067 79.654 1.00 0.00 H ATOM 26979 H2 WAT 4325 79.580 64.185 78.714 1.00 0.00 H TER 26981 WAT 4325 ATOM 26981 O WAT 4326 103.711 105.529 3.387 1.00 0.00 O ATOM 26982 H1 WAT 4326 103.289 105.712 2.548 1.00 0.00 H ATOM 26983 H2 WAT 4326 104.582 105.209 3.153 1.00 0.00 H TER 26985 WAT 4326 ATOM 26985 O WAT 4327 25.314 37.199 116.005 1.00 0.00 O ATOM 26986 H1 WAT 4327 26.200 37.438 115.731 1.00 0.00 H ATOM 26987 H2 WAT 4327 25.360 36.257 116.170 1.00 0.00 H TER 26989 WAT 4327 ATOM 26989 O WAT 4328 127.512 52.250 96.581 1.00 0.00 O ATOM 26990 H1 WAT 4328 127.548 51.441 96.071 1.00 0.00 H ATOM 26991 H2 WAT 4328 128.248 52.770 96.257 1.00 0.00 H TER 26993 WAT 4328 ATOM 26993 O WAT 4329 73.348 87.725 119.108 1.00 0.00 O ATOM 26994 H1 WAT 4329 72.812 88.234 119.716 1.00 0.00 H ATOM 26995 H2 WAT 4329 73.272 88.191 118.275 1.00 0.00 H TER 26997 WAT 4329 ATOM 26997 O WAT 4330 3.490 97.171 95.313 1.00 0.00 O ATOM 26998 H1 WAT 4330 3.793 98.065 95.151 1.00 0.00 H ATOM 26999 H2 WAT 4330 3.558 96.737 94.463 1.00 0.00 H TER 27001 WAT 4330 ATOM 27001 O WAT 4331 92.350 109.936 139.662 1.00 0.00 O ATOM 27002 H1 WAT 4331 91.607 110.222 139.130 1.00 0.00 H ATOM 27003 H2 WAT 4331 92.640 109.122 139.251 1.00 0.00 H TER 27005 WAT 4331 ATOM 27005 O WAT 4332 34.217 145.878 72.017 1.00 0.00 O ATOM 27006 H1 WAT 4332 34.135 145.202 72.690 1.00 0.00 H ATOM 27007 H2 WAT 4332 33.976 145.436 71.203 1.00 0.00 H TER 27009 WAT 4332 ATOM 27009 O WAT 4333 119.014 5.587 132.462 1.00 0.00 O ATOM 27010 H1 WAT 4333 119.174 6.487 132.177 1.00 0.00 H ATOM 27011 H2 WAT 4333 118.880 5.656 133.408 1.00 0.00 H TER 27013 WAT 4333 ATOM 27013 O WAT 4334 76.937 73.601 123.942 1.00 0.00 O ATOM 27014 H1 WAT 4334 76.387 74.385 123.925 1.00 0.00 H ATOM 27015 H2 WAT 4334 76.317 72.876 124.031 1.00 0.00 H TER 27017 WAT 4334 ATOM 27017 O WAT 4335 51.576 2.435 68.082 1.00 0.00 O ATOM 27018 H1 WAT 4335 51.447 2.449 67.134 1.00 0.00 H ATOM 27019 H2 WAT 4335 51.253 1.577 68.356 1.00 0.00 H TER 27021 WAT 4335 ATOM 27021 O WAT 4336 33.336 117.009 145.661 1.00 0.00 O ATOM 27022 H1 WAT 4336 32.548 116.601 145.301 1.00 0.00 H ATOM 27023 H2 WAT 4336 33.624 116.409 146.348 1.00 0.00 H TER 27025 WAT 4336 ATOM 27025 O WAT 4337 134.181 9.704 57.295 1.00 0.00 O ATOM 27026 H1 WAT 4337 134.349 10.326 58.003 1.00 0.00 H ATOM 27027 H2 WAT 4337 133.226 9.665 57.232 1.00 0.00 H TER 27029 WAT 4337 ATOM 27029 O WAT 4338 44.948 111.581 144.401 1.00 0.00 O ATOM 27030 H1 WAT 4338 44.463 111.412 145.209 1.00 0.00 H ATOM 27031 H2 WAT 4338 44.743 110.835 143.838 1.00 0.00 H TER 27033 WAT 4338 ATOM 27033 O WAT 4339 134.100 19.465 133.050 1.00 0.00 O ATOM 27034 H1 WAT 4339 134.110 19.965 133.866 1.00 0.00 H ATOM 27035 H2 WAT 4339 133.251 19.668 132.655 1.00 0.00 H TER 27037 WAT 4339 ATOM 27037 O WAT 4340 1.143 37.386 80.891 1.00 0.00 O ATOM 27038 H1 WAT 4340 1.269 37.690 81.790 1.00 0.00 H ATOM 27039 H2 WAT 4340 0.644 38.086 80.470 1.00 0.00 H TER 27041 WAT 4340 ATOM 27041 O WAT 4341 39.493 6.854 111.336 1.00 0.00 O ATOM 27042 H1 WAT 4341 39.050 7.461 110.743 1.00 0.00 H ATOM 27043 H2 WAT 4341 39.190 5.988 111.063 1.00 0.00 H TER 27045 WAT 4341 ATOM 27045 O WAT 4342 121.728 38.262 103.006 1.00 0.00 O ATOM 27046 H1 WAT 4342 122.166 37.714 102.355 1.00 0.00 H ATOM 27047 H2 WAT 4342 122.436 38.760 103.415 1.00 0.00 H TER 27049 WAT 4342 ATOM 27049 O WAT 4343 86.133 123.831 147.955 1.00 0.00 O ATOM 27050 H1 WAT 4343 85.276 124.163 148.221 1.00 0.00 H ATOM 27051 H2 WAT 4343 86.265 123.050 148.493 1.00 0.00 H TER 27053 WAT 4343 ATOM 27053 O WAT 4344 92.786 25.808 144.430 1.00 0.00 O ATOM 27054 H1 WAT 4344 93.735 25.796 144.559 1.00 0.00 H ATOM 27055 H2 WAT 4344 92.655 26.383 143.676 1.00 0.00 H TER 27057 WAT 4344 ATOM 27057 O WAT 4345 102.973 44.068 127.408 1.00 0.00 O ATOM 27058 H1 WAT 4345 103.138 44.540 126.592 1.00 0.00 H ATOM 27059 H2 WAT 4345 103.387 44.604 128.084 1.00 0.00 H TER 27061 WAT 4345 ATOM 27061 O WAT 4346 144.562 120.127 156.213 1.00 0.00 O ATOM 27062 H1 WAT 4346 143.923 120.210 155.505 1.00 0.00 H ATOM 27063 H2 WAT 4346 145.218 120.797 156.024 1.00 0.00 H TER 27065 WAT 4346 ATOM 27065 O WAT 4347 121.998 125.495 146.063 1.00 0.00 O ATOM 27066 H1 WAT 4347 121.239 125.471 145.480 1.00 0.00 H ATOM 27067 H2 WAT 4347 122.487 124.700 145.853 1.00 0.00 H TER 27069 WAT 4347 ATOM 27069 O WAT 4348 121.350 136.275 140.290 1.00 0.00 O ATOM 27070 H1 WAT 4348 122.037 136.910 140.493 1.00 0.00 H ATOM 27071 H2 WAT 4348 121.005 136.557 139.443 1.00 0.00 H TER 27073 WAT 4348 ATOM 27073 O WAT 4349 145.717 25.840 136.871 1.00 0.00 O ATOM 27074 H1 WAT 4349 145.732 25.737 137.823 1.00 0.00 H ATOM 27075 H2 WAT 4349 145.930 24.970 136.533 1.00 0.00 H TER 27077 WAT 4349 ATOM 27077 O WAT 4350 144.734 128.848 117.157 1.00 0.00 O ATOM 27078 H1 WAT 4350 145.481 128.260 117.046 1.00 0.00 H ATOM 27079 H2 WAT 4350 144.060 128.305 117.566 1.00 0.00 H TER 27081 WAT 4350 ATOM 27081 O WAT 4351 32.383 65.789 69.232 1.00 0.00 O ATOM 27082 H1 WAT 4351 33.252 65.779 68.832 1.00 0.00 H ATOM 27083 H2 WAT 4351 32.159 66.718 69.295 1.00 0.00 H TER 27085 WAT 4351 ATOM 27085 O WAT 4352 23.852 83.038 133.396 1.00 0.00 O ATOM 27086 H1 WAT 4352 24.414 83.470 132.753 1.00 0.00 H ATOM 27087 H2 WAT 4352 23.165 82.624 132.875 1.00 0.00 H TER 27089 WAT 4352 ATOM 27089 O WAT 4353 52.996 11.926 158.503 1.00 0.00 O ATOM 27090 H1 WAT 4353 52.384 12.473 158.012 1.00 0.00 H ATOM 27091 H2 WAT 4353 53.034 12.328 159.371 1.00 0.00 H TER 27093 WAT 4353 ATOM 27093 O WAT 4354 56.111 79.115 98.929 1.00 0.00 O ATOM 27094 H1 WAT 4354 55.898 78.398 98.332 1.00 0.00 H ATOM 27095 H2 WAT 4354 57.066 79.101 98.990 1.00 0.00 H TER 27097 WAT 4354 ATOM 27097 O WAT 4355 105.734 29.053 67.348 1.00 0.00 O ATOM 27098 H1 WAT 4355 105.381 29.943 67.360 1.00 0.00 H ATOM 27099 H2 WAT 4355 106.217 28.976 68.171 1.00 0.00 H TER 27101 WAT 4355 ATOM 27101 O WAT 4356 0.692 129.152 94.211 1.00 0.00 O ATOM 27102 H1 WAT 4356 0.715 129.830 94.886 1.00 0.00 H ATOM 27103 H2 WAT 4356 1.292 128.477 94.529 1.00 0.00 H TER 27105 WAT 4356 ATOM 27105 O WAT 4357 61.935 38.336 12.674 1.00 0.00 O ATOM 27106 H1 WAT 4357 62.064 37.439 12.982 1.00 0.00 H ATOM 27107 H2 WAT 4357 61.370 38.737 13.335 1.00 0.00 H TER 27109 WAT 4357 ATOM 27109 O WAT 4358 79.425 126.695 93.516 1.00 0.00 O ATOM 27110 H1 WAT 4358 79.972 126.437 94.258 1.00 0.00 H ATOM 27111 H2 WAT 4358 78.532 126.493 93.795 1.00 0.00 H TER 27113 WAT 4358 ATOM 27113 O WAT 4359 40.662 83.400 128.424 1.00 0.00 O ATOM 27114 H1 WAT 4359 40.339 82.600 128.838 1.00 0.00 H ATOM 27115 H2 WAT 4359 40.878 83.137 127.529 1.00 0.00 H TER 27117 WAT 4359 ATOM 27117 O WAT 4360 133.048 125.102 63.028 1.00 0.00 O ATOM 27118 H1 WAT 4360 133.760 124.508 63.268 1.00 0.00 H ATOM 27119 H2 WAT 4360 133.488 125.867 62.660 1.00 0.00 H TER 27121 WAT 4360 ATOM 27121 O WAT 4361 90.879 144.859 17.871 1.00 0.00 O ATOM 27122 H1 WAT 4361 91.376 144.290 17.284 1.00 0.00 H ATOM 27123 H2 WAT 4361 91.455 145.608 18.025 1.00 0.00 H TER 27125 WAT 4361 ATOM 27125 O WAT 4362 139.998 65.394 143.727 1.00 0.00 O ATOM 27126 H1 WAT 4362 140.714 65.257 144.347 1.00 0.00 H ATOM 27127 H2 WAT 4362 139.287 65.754 144.257 1.00 0.00 H TER 27129 WAT 4362 ATOM 27129 O WAT 4363 62.779 33.356 128.915 1.00 0.00 O ATOM 27130 H1 WAT 4363 62.057 33.807 129.352 1.00 0.00 H ATOM 27131 H2 WAT 4363 63.567 33.721 129.317 1.00 0.00 H TER 27133 WAT 4363 ATOM 27133 O WAT 4364 21.372 15.504 5.896 1.00 0.00 O ATOM 27134 H1 WAT 4364 21.786 15.756 5.070 1.00 0.00 H ATOM 27135 H2 WAT 4364 21.987 14.888 6.293 1.00 0.00 H TER 27137 WAT 4364 ATOM 27137 O WAT 4365 98.849 90.779 69.112 1.00 0.00 O ATOM 27138 H1 WAT 4365 99.417 90.846 69.880 1.00 0.00 H ATOM 27139 H2 WAT 4365 97.963 90.877 69.460 1.00 0.00 H TER 27141 WAT 4365 ATOM 27141 O WAT 4366 55.656 85.957 7.427 1.00 0.00 O ATOM 27142 H1 WAT 4366 55.153 85.497 8.099 1.00 0.00 H ATOM 27143 H2 WAT 4366 54.996 86.397 6.892 1.00 0.00 H TER 27145 WAT 4366 ATOM 27145 O WAT 4367 73.921 89.484 152.533 1.00 0.00 O ATOM 27146 H1 WAT 4367 73.994 89.780 151.625 1.00 0.00 H ATOM 27147 H2 WAT 4367 73.219 88.834 152.517 1.00 0.00 H TER 27149 WAT 4367 ATOM 27149 O WAT 4368 125.617 121.380 87.045 1.00 0.00 O ATOM 27150 H1 WAT 4368 125.917 122.289 87.018 1.00 0.00 H ATOM 27151 H2 WAT 4368 125.637 121.149 87.973 1.00 0.00 H TER 27153 WAT 4368 ATOM 27153 O WAT 4369 18.005 87.466 142.844 1.00 0.00 O ATOM 27154 H1 WAT 4369 17.108 87.493 143.175 1.00 0.00 H ATOM 27155 H2 WAT 4369 18.362 86.645 143.185 1.00 0.00 H TER 27157 WAT 4369 ATOM 27157 O WAT 4370 7.625 104.555 10.407 1.00 0.00 O ATOM 27158 H1 WAT 4370 6.914 105.050 10.001 1.00 0.00 H ATOM 27159 H2 WAT 4370 7.233 103.712 10.631 1.00 0.00 H TER 27161 WAT 4370 ATOM 27161 O WAT 4371 80.047 124.506 113.377 1.00 0.00 O ATOM 27162 H1 WAT 4371 79.591 124.004 112.702 1.00 0.00 H ATOM 27163 H2 WAT 4371 79.391 124.638 114.061 1.00 0.00 H TER 27165 WAT 4371 ATOM 27165 O WAT 4372 135.584 140.566 107.117 1.00 0.00 O ATOM 27166 H1 WAT 4372 135.426 139.809 106.553 1.00 0.00 H ATOM 27167 H2 WAT 4372 135.275 140.290 107.980 1.00 0.00 H TER 27169 WAT 4372 ATOM 27169 O WAT 4373 45.257 143.800 93.516 1.00 0.00 O ATOM 27170 H1 WAT 4373 45.534 143.322 94.297 1.00 0.00 H ATOM 27171 H2 WAT 4373 45.876 143.530 92.837 1.00 0.00 H TER 27173 WAT 4373 ATOM 27173 O WAT 4374 29.189 131.251 117.907 1.00 0.00 O ATOM 27174 H1 WAT 4374 28.594 130.557 118.191 1.00 0.00 H ATOM 27175 H2 WAT 4374 29.850 131.298 118.597 1.00 0.00 H TER 27177 WAT 4374 ATOM 27177 O WAT 4375 84.218 79.372 142.604 1.00 0.00 O ATOM 27178 H1 WAT 4375 83.564 79.032 141.993 1.00 0.00 H ATOM 27179 H2 WAT 4375 85.058 79.187 142.183 1.00 0.00 H TER 27181 WAT 4375 ATOM 27181 O WAT 4376 14.116 9.774 137.319 1.00 0.00 O ATOM 27182 H1 WAT 4376 13.287 9.396 137.613 1.00 0.00 H ATOM 27183 H2 WAT 4376 14.547 10.059 138.125 1.00 0.00 H TER 27185 WAT 4376 ATOM 27185 O WAT 4377 35.529 27.519 143.721 1.00 0.00 O ATOM 27186 H1 WAT 4377 36.100 28.183 144.107 1.00 0.00 H ATOM 27187 H2 WAT 4377 36.122 26.811 143.470 1.00 0.00 H TER 27189 WAT 4377 ATOM 27189 O WAT 4378 136.290 32.859 120.005 1.00 0.00 O ATOM 27190 H1 WAT 4378 136.652 32.523 119.185 1.00 0.00 H ATOM 27191 H2 WAT 4378 135.512 32.323 120.160 1.00 0.00 H TER 27193 WAT 4378 ATOM 27193 O WAT 4379 124.788 94.699 153.670 1.00 0.00 O ATOM 27194 H1 WAT 4379 124.146 94.284 154.245 1.00 0.00 H ATOM 27195 H2 WAT 4379 125.636 94.462 154.048 1.00 0.00 H TER 27197 WAT 4379 ATOM 27197 O WAT 4380 27.865 66.306 65.584 1.00 0.00 O ATOM 27198 H1 WAT 4380 28.428 66.790 64.979 1.00 0.00 H ATOM 27199 H2 WAT 4380 28.041 66.696 66.440 1.00 0.00 H TER 27201 WAT 4380 ATOM 27201 O WAT 4381 132.382 139.230 3.290 1.00 0.00 O ATOM 27202 H1 WAT 4381 132.548 138.712 4.078 1.00 0.00 H ATOM 27203 H2 WAT 4381 133.115 139.024 2.709 1.00 0.00 H TER 27205 WAT 4381 ATOM 27205 O WAT 4382 83.226 91.910 144.591 1.00 0.00 O ATOM 27206 H1 WAT 4382 83.590 91.122 144.188 1.00 0.00 H ATOM 27207 H2 WAT 4382 83.126 91.682 145.516 1.00 0.00 H TER 27209 WAT 4382 ATOM 27209 O WAT 4383 85.364 7.574 60.376 1.00 0.00 O ATOM 27210 H1 WAT 4383 86.109 8.096 60.673 1.00 0.00 H ATOM 27211 H2 WAT 4383 85.750 6.743 60.098 1.00 0.00 H TER 27213 WAT 4383 ATOM 27213 O WAT 4384 83.800 126.796 115.336 1.00 0.00 O ATOM 27214 H1 WAT 4384 83.011 127.202 114.976 1.00 0.00 H ATOM 27215 H2 WAT 4384 83.994 126.076 114.735 1.00 0.00 H TER 27217 WAT 4384 ATOM 27217 O WAT 4385 80.199 100.703 108.084 1.00 0.00 O ATOM 27218 H1 WAT 4385 80.536 101.069 108.901 1.00 0.00 H ATOM 27219 H2 WAT 4385 80.264 101.421 107.455 1.00 0.00 H TER 27221 WAT 4385 ATOM 27221 O WAT 4386 89.059 97.920 157.121 1.00 0.00 O ATOM 27222 H1 WAT 4386 88.400 98.358 157.660 1.00 0.00 H ATOM 27223 H2 WAT 4386 88.724 97.992 156.227 1.00 0.00 H TER 27225 WAT 4386 ATOM 27225 O WAT 4387 94.100 118.275 9.997 1.00 0.00 O ATOM 27226 H1 WAT 4387 93.494 117.735 10.504 1.00 0.00 H ATOM 27227 H2 WAT 4387 93.969 117.995 9.091 1.00 0.00 H TER 27229 WAT 4387 ATOM 27229 O WAT 4388 67.408 1.058 0.914 1.00 0.00 O ATOM 27230 H1 WAT 4388 68.088 1.221 1.568 1.00 0.00 H ATOM 27231 H2 WAT 4388 66.594 1.032 1.416 1.00 0.00 H TER 27233 WAT 4388 ATOM 27233 O WAT 4389 55.763 56.157 110.912 1.00 0.00 O ATOM 27234 H1 WAT 4389 54.856 56.450 110.824 1.00 0.00 H ATOM 27235 H2 WAT 4389 55.847 55.908 111.832 1.00 0.00 H TER 27237 WAT 4389 ATOM 27237 O WAT 4390 85.691 49.786 75.411 1.00 0.00 O ATOM 27238 H1 WAT 4390 85.791 48.934 74.985 1.00 0.00 H ATOM 27239 H2 WAT 4390 86.298 50.360 74.944 1.00 0.00 H TER 27241 WAT 4390 ATOM 27241 O WAT 4391 122.558 118.277 1.248 1.00 0.00 O ATOM 27242 H1 WAT 4391 122.426 118.235 2.195 1.00 0.00 H ATOM 27243 H2 WAT 4391 123.271 117.661 1.079 1.00 0.00 H TER 27245 WAT 4391 ATOM 27245 O WAT 4392 3.140 35.649 141.180 1.00 0.00 O ATOM 27246 H1 WAT 4392 3.338 34.998 140.507 1.00 0.00 H ATOM 27247 H2 WAT 4392 2.923 35.132 141.956 1.00 0.00 H TER 27249 WAT 4392 ATOM 27249 O WAT 4393 114.451 121.691 122.539 1.00 0.00 O ATOM 27250 H1 WAT 4393 114.525 122.490 122.016 1.00 0.00 H ATOM 27251 H2 WAT 4393 114.731 121.953 123.416 1.00 0.00 H TER 27253 WAT 4393 ATOM 27253 O WAT 4394 5.017 36.795 83.262 1.00 0.00 O ATOM 27254 H1 WAT 4394 5.257 37.642 82.887 1.00 0.00 H ATOM 27255 H2 WAT 4394 4.104 36.901 83.529 1.00 0.00 H TER 27257 WAT 4394 ATOM 27257 O WAT 4395 44.757 138.132 2.581 1.00 0.00 O ATOM 27258 H1 WAT 4395 44.291 138.282 3.403 1.00 0.00 H ATOM 27259 H2 WAT 4395 44.994 137.205 2.604 1.00 0.00 H TER 27261 WAT 4395 ATOM 27261 O WAT 4396 143.052 88.114 65.245 1.00 0.00 O ATOM 27262 H1 WAT 4396 143.209 88.160 64.302 1.00 0.00 H ATOM 27263 H2 WAT 4396 143.756 87.557 65.577 1.00 0.00 H TER 27265 WAT 4396 ATOM 27265 O WAT 4397 106.348 127.054 82.052 1.00 0.00 O ATOM 27266 H1 WAT 4397 106.536 126.514 81.284 1.00 0.00 H ATOM 27267 H2 WAT 4397 106.943 127.799 81.973 1.00 0.00 H TER 27269 WAT 4397 ATOM 27269 O WAT 4398 73.161 5.165 118.657 1.00 0.00 O ATOM 27270 H1 WAT 4398 73.121 4.971 119.593 1.00 0.00 H ATOM 27271 H2 WAT 4398 74.055 4.936 118.403 1.00 0.00 H TER 27273 WAT 4398 ATOM 27273 O WAT 4399 79.153 101.464 0.278 1.00 0.00 O ATOM 27274 H1 WAT 4399 79.725 100.706 0.151 1.00 0.00 H ATOM 27275 H2 WAT 4399 78.382 101.274 -0.257 1.00 0.00 H TER 27277 WAT 4399 ATOM 27277 O WAT 4400 77.335 57.963 18.339 1.00 0.00 O ATOM 27278 H1 WAT 4400 78.288 58.029 18.271 1.00 0.00 H ATOM 27279 H2 WAT 4400 77.081 58.714 18.876 1.00 0.00 H TER 27281 WAT 4400 ATOM 27281 O WAT 4401 47.088 14.910 3.321 1.00 0.00 O ATOM 27282 H1 WAT 4401 47.785 14.256 3.371 1.00 0.00 H ATOM 27283 H2 WAT 4401 46.685 14.765 2.465 1.00 0.00 H TER 27285 WAT 4401 ATOM 27285 O WAT 4402 49.374 121.818 122.674 1.00 0.00 O ATOM 27286 H1 WAT 4402 49.962 121.873 121.922 1.00 0.00 H ATOM 27287 H2 WAT 4402 49.141 122.727 122.863 1.00 0.00 H TER 27289 WAT 4402 ATOM 27289 O WAT 4403 71.535 108.145 156.896 1.00 0.00 O ATOM 27290 H1 WAT 4403 71.476 107.227 157.164 1.00 0.00 H ATOM 27291 H2 WAT 4403 71.945 108.116 156.032 1.00 0.00 H TER 27293 WAT 4403 ATOM 27293 O WAT 4404 139.127 39.628 8.663 1.00 0.00 O ATOM 27294 H1 WAT 4404 138.743 38.797 8.941 1.00 0.00 H ATOM 27295 H2 WAT 4404 138.431 40.060 8.167 1.00 0.00 H TER 27297 WAT 4404 ATOM 27297 O WAT 4405 125.958 59.526 0.856 1.00 0.00 O ATOM 27298 H1 WAT 4405 126.209 58.638 1.109 1.00 0.00 H ATOM 27299 H2 WAT 4405 125.002 59.503 0.819 1.00 0.00 H TER 27301 WAT 4405 ATOM 27301 O WAT 4406 138.049 102.820 154.062 1.00 0.00 O ATOM 27302 H1 WAT 4406 137.575 103.244 154.777 1.00 0.00 H ATOM 27303 H2 WAT 4406 138.183 103.515 153.417 1.00 0.00 H TER 27305 WAT 4406 ATOM 27305 O WAT 4407 53.048 2.872 84.347 1.00 0.00 O ATOM 27306 H1 WAT 4407 53.736 3.382 83.918 1.00 0.00 H ATOM 27307 H2 WAT 4407 53.335 1.963 84.261 1.00 0.00 H TER 27309 WAT 4407 ATOM 27309 O WAT 4408 87.270 119.719 128.240 1.00 0.00 O ATOM 27310 H1 WAT 4408 87.731 118.899 128.419 1.00 0.00 H ATOM 27311 H2 WAT 4408 86.990 119.641 127.327 1.00 0.00 H TER 27313 WAT 4408 ATOM 27313 O WAT 4409 7.636 35.748 149.569 1.00 0.00 O ATOM 27314 H1 WAT 4409 7.925 35.470 150.438 1.00 0.00 H ATOM 27315 H2 WAT 4409 7.589 36.702 149.626 1.00 0.00 H TER 27317 WAT 4409 ATOM 27317 O WAT 4410 83.338 4.392 115.815 1.00 0.00 O ATOM 27318 H1 WAT 4410 84.181 4.512 115.377 1.00 0.00 H ATOM 27319 H2 WAT 4410 83.173 5.229 116.250 1.00 0.00 H TER 27321 WAT 4410 ATOM 27321 O WAT 4411 101.762 144.642 127.572 1.00 0.00 O ATOM 27322 H1 WAT 4411 102.153 144.142 126.856 1.00 0.00 H ATOM 27323 H2 WAT 4411 100.824 144.460 127.508 1.00 0.00 H TER 27325 WAT 4411 ATOM 27325 O WAT 4412 57.560 74.019 99.491 1.00 0.00 O ATOM 27326 H1 WAT 4412 58.032 73.191 99.402 1.00 0.00 H ATOM 27327 H2 WAT 4412 56.756 73.788 99.955 1.00 0.00 H TER 27329 WAT 4412 ATOM 27329 O WAT 4413 71.938 60.526 98.107 1.00 0.00 O ATOM 27330 H1 WAT 4413 72.680 60.008 98.419 1.00 0.00 H ATOM 27331 H2 WAT 4413 72.289 61.411 98.007 1.00 0.00 H TER 27333 WAT 4413 ATOM 27333 O WAT 4414 141.421 12.449 84.612 1.00 0.00 O ATOM 27334 H1 WAT 4414 141.988 11.758 84.270 1.00 0.00 H ATOM 27335 H2 WAT 4414 141.439 12.326 85.561 1.00 0.00 H TER 27337 WAT 4414 ATOM 27337 O WAT 4415 84.052 52.412 142.167 1.00 0.00 O ATOM 27338 H1 WAT 4415 84.684 52.396 141.448 1.00 0.00 H ATOM 27339 H2 WAT 4415 83.954 53.340 142.380 1.00 0.00 H TER 27341 WAT 4415 ATOM 27341 O WAT 4416 95.964 50.224 108.080 1.00 0.00 O ATOM 27342 H1 WAT 4416 95.598 49.374 108.324 1.00 0.00 H ATOM 27343 H2 WAT 4416 96.753 50.308 108.616 1.00 0.00 H TER 27345 WAT 4416 ATOM 27345 O WAT 4417 34.128 141.053 15.913 1.00 0.00 O ATOM 27346 H1 WAT 4417 33.370 141.290 16.449 1.00 0.00 H ATOM 27347 H2 WAT 4417 34.281 140.129 16.110 1.00 0.00 H TER 27349 WAT 4417 ATOM 27349 O WAT 4418 97.650 114.514 127.107 1.00 0.00 O ATOM 27350 H1 WAT 4418 97.610 115.448 127.308 1.00 0.00 H ATOM 27351 H2 WAT 4418 98.386 114.431 126.499 1.00 0.00 H TER 27353 WAT 4418 ATOM 27353 O WAT 4419 106.757 39.636 148.709 1.00 0.00 O ATOM 27354 H1 WAT 4419 105.929 39.165 148.806 1.00 0.00 H ATOM 27355 H2 WAT 4419 107.224 39.470 149.528 1.00 0.00 H TER 27357 WAT 4419 ATOM 27357 O WAT 4420 6.492 145.917 147.251 1.00 0.00 O ATOM 27358 H1 WAT 4420 6.044 145.204 146.796 1.00 0.00 H ATOM 27359 H2 WAT 4420 7.306 146.039 146.763 1.00 0.00 H TER 27361 WAT 4420 ATOM 27361 O WAT 4421 103.625 82.821 92.954 1.00 0.00 O ATOM 27362 H1 WAT 4421 103.453 82.197 92.249 1.00 0.00 H ATOM 27363 H2 WAT 4421 103.541 82.306 93.756 1.00 0.00 H TER 27365 WAT 4421 ATOM 27365 O WAT 4422 28.859 119.781 67.100 1.00 0.00 O ATOM 27366 H1 WAT 4422 29.751 120.126 67.060 1.00 0.00 H ATOM 27367 H2 WAT 4422 28.944 118.863 66.842 1.00 0.00 H TER 27369 WAT 4422 ATOM 27369 O WAT 4423 28.885 55.887 123.172 1.00 0.00 O ATOM 27370 H1 WAT 4423 28.386 56.099 123.960 1.00 0.00 H ATOM 27371 H2 WAT 4423 28.393 56.294 122.459 1.00 0.00 H TER 27373 WAT 4423 ATOM 27373 O WAT 4424 117.808 52.422 99.416 1.00 0.00 O ATOM 27374 H1 WAT 4424 118.752 52.397 99.259 1.00 0.00 H ATOM 27375 H2 WAT 4424 117.697 53.071 100.111 1.00 0.00 H TER 27377 WAT 4424 ATOM 27377 O WAT 4425 122.679 16.481 121.977 1.00 0.00 O ATOM 27378 H1 WAT 4425 123.176 16.177 121.218 1.00 0.00 H ATOM 27379 H2 WAT 4425 123.115 16.077 122.727 1.00 0.00 H TER 27381 WAT 4425 ATOM 27381 O WAT 4426 106.633 43.450 84.508 1.00 0.00 O ATOM 27382 H1 WAT 4426 107.130 44.152 84.088 1.00 0.00 H ATOM 27383 H2 WAT 4426 106.129 43.889 85.192 1.00 0.00 H TER 27385 WAT 4426 ATOM 27385 O WAT 4427 122.460 21.350 140.508 1.00 0.00 O ATOM 27386 H1 WAT 4427 122.391 20.472 140.133 1.00 0.00 H ATOM 27387 H2 WAT 4427 123.363 21.616 140.331 1.00 0.00 H TER 27389 WAT 4427 ATOM 27389 O WAT 4428 85.462 3.541 72.665 1.00 0.00 O ATOM 27390 H1 WAT 4428 86.023 3.855 71.956 1.00 0.00 H ATOM 27391 H2 WAT 4428 85.648 4.130 73.396 1.00 0.00 H TER 27393 WAT 4428 ATOM 27393 O WAT 4429 52.871 127.581 79.681 1.00 0.00 O ATOM 27394 H1 WAT 4429 52.703 126.787 79.172 1.00 0.00 H ATOM 27395 H2 WAT 4429 53.803 127.536 79.894 1.00 0.00 H TER 27397 WAT 4429 ATOM 27397 O WAT 4430 124.067 31.834 9.902 1.00 0.00 O ATOM 27398 H1 WAT 4430 123.649 32.097 9.082 1.00 0.00 H ATOM 27399 H2 WAT 4430 124.982 32.095 9.799 1.00 0.00 H TER 27401 WAT 4430 ATOM 27401 O WAT 4431 61.397 91.630 132.717 1.00 0.00 O ATOM 27402 H1 WAT 4431 62.080 91.438 133.358 1.00 0.00 H ATOM 27403 H2 WAT 4431 60.883 92.332 133.117 1.00 0.00 H TER 27405 WAT 4431 ATOM 27405 O WAT 4432 53.478 34.159 72.917 1.00 0.00 O ATOM 27406 H1 WAT 4432 53.685 34.356 72.004 1.00 0.00 H ATOM 27407 H2 WAT 4432 52.758 33.530 72.870 1.00 0.00 H TER 27409 WAT 4432 ATOM 27409 O WAT 4433 68.924 6.975 71.590 1.00 0.00 O ATOM 27410 H1 WAT 4433 69.228 6.156 71.198 1.00 0.00 H ATOM 27411 H2 WAT 4433 69.180 7.651 70.962 1.00 0.00 H TER 27413 WAT 4433 ATOM 27413 O WAT 4434 119.282 67.214 86.936 1.00 0.00 O ATOM 27414 H1 WAT 4434 118.843 67.187 87.786 1.00 0.00 H ATOM 27415 H2 WAT 4434 119.825 66.426 86.922 1.00 0.00 H TER 27417 WAT 4434 ATOM 27417 O WAT 4435 59.086 108.335 140.107 1.00 0.00 O ATOM 27418 H1 WAT 4435 59.001 108.856 139.309 1.00 0.00 H ATOM 27419 H2 WAT 4435 58.302 108.545 140.616 1.00 0.00 H TER 27421 WAT 4435 ATOM 27421 O WAT 4436 19.416 53.905 102.935 1.00 0.00 O ATOM 27422 H1 WAT 4436 20.349 54.104 102.860 1.00 0.00 H ATOM 27423 H2 WAT 4436 19.319 53.537 103.813 1.00 0.00 H TER 27425 WAT 4436 ATOM 27425 O WAT 4437 102.496 120.433 67.841 1.00 0.00 O ATOM 27426 H1 WAT 4437 102.430 121.357 67.598 1.00 0.00 H ATOM 27427 H2 WAT 4437 103.302 120.377 68.354 1.00 0.00 H TER 27429 WAT 4437 ATOM 27429 O WAT 4438 135.242 59.267 151.303 1.00 0.00 O ATOM 27430 H1 WAT 4438 134.977 58.853 150.482 1.00 0.00 H ATOM 27431 H2 WAT 4438 135.635 58.559 151.813 1.00 0.00 H TER 27433 WAT 4438 ATOM 27433 O WAT 4439 40.824 36.678 148.471 1.00 0.00 O ATOM 27434 H1 WAT 4439 40.778 35.745 148.262 1.00 0.00 H ATOM 27435 H2 WAT 4439 39.929 36.912 148.717 1.00 0.00 H TER 27437 WAT 4439 ATOM 27437 O WAT 4440 18.690 108.300 127.684 1.00 0.00 O ATOM 27438 H1 WAT 4440 19.599 108.000 127.718 1.00 0.00 H ATOM 27439 H2 WAT 4440 18.455 108.453 128.599 1.00 0.00 H TER 27441 WAT 4440 ATOM 27441 O WAT 4441 9.030 108.590 99.569 1.00 0.00 O ATOM 27442 H1 WAT 4441 9.122 109.392 100.084 1.00 0.00 H ATOM 27443 H2 WAT 4441 8.320 108.780 98.955 1.00 0.00 H TER 27445 WAT 4441 ATOM 27445 O WAT 4442 38.175 127.171 138.336 1.00 0.00 O ATOM 27446 H1 WAT 4442 37.949 128.098 138.259 1.00 0.00 H ATOM 27447 H2 WAT 4442 39.078 127.119 138.024 1.00 0.00 H TER 27449 WAT 4442 ATOM 27449 O WAT 4443 22.757 131.563 91.853 1.00 0.00 O ATOM 27450 H1 WAT 4443 22.022 131.926 92.347 1.00 0.00 H ATOM 27451 H2 WAT 4443 22.352 131.147 91.092 1.00 0.00 H TER 27453 WAT 4443 ATOM 27453 O WAT 4444 52.963 2.842 65.594 1.00 0.00 O ATOM 27454 H1 WAT 4444 53.105 3.725 65.933 1.00 0.00 H ATOM 27455 H2 WAT 4444 52.608 2.976 64.715 1.00 0.00 H TER 27457 WAT 4444 ATOM 27457 O WAT 4445 57.657 142.071 12.695 1.00 0.00 O ATOM 27458 H1 WAT 4445 58.001 141.263 13.075 1.00 0.00 H ATOM 27459 H2 WAT 4445 57.365 142.585 13.447 1.00 0.00 H TER 27461 WAT 4445 ATOM 27461 O WAT 4446 85.784 76.012 92.614 1.00 0.00 O ATOM 27462 H1 WAT 4446 85.151 76.349 91.981 1.00 0.00 H ATOM 27463 H2 WAT 4446 86.088 76.787 93.085 1.00 0.00 H TER 27465 WAT 4446 ATOM 27465 O WAT 4447 19.339 74.659 93.570 1.00 0.00 O ATOM 27466 H1 WAT 4447 19.994 74.007 93.820 1.00 0.00 H ATOM 27467 H2 WAT 4447 19.412 75.341 94.237 1.00 0.00 H TER 27469 WAT 4447 ATOM 27469 O WAT 4448 99.648 103.002 96.994 1.00 0.00 O ATOM 27470 H1 WAT 4448 99.096 103.018 97.775 1.00 0.00 H ATOM 27471 H2 WAT 4448 100.543 103.043 97.332 1.00 0.00 H TER 27473 WAT 4448 ATOM 27473 O WAT 4449 93.660 144.073 54.475 1.00 0.00 O ATOM 27474 H1 WAT 4449 93.495 145.005 54.615 1.00 0.00 H ATOM 27475 H2 WAT 4449 93.961 143.752 55.325 1.00 0.00 H TER 27477 WAT 4449 ATOM 27477 O WAT 4450 53.005 12.177 4.846 1.00 0.00 O ATOM 27478 H1 WAT 4450 53.928 12.009 5.037 1.00 0.00 H ATOM 27479 H2 WAT 4450 52.606 11.307 4.815 1.00 0.00 H TER 27481 WAT 4450 ATOM 27481 O WAT 4451 67.664 109.289 133.635 1.00 0.00 O ATOM 27482 H1 WAT 4451 66.851 109.241 133.131 1.00 0.00 H ATOM 27483 H2 WAT 4451 68.342 109.457 132.980 1.00 0.00 H TER 27485 WAT 4451 ATOM 27485 O WAT 4452 122.607 125.020 115.488 1.00 0.00 O ATOM 27486 H1 WAT 4452 122.250 125.371 114.672 1.00 0.00 H ATOM 27487 H2 WAT 4452 121.946 124.397 115.790 1.00 0.00 H TER 27489 WAT 4452 ATOM 27489 O WAT 4453 59.102 93.571 10.547 1.00 0.00 O ATOM 27490 H1 WAT 4453 58.602 93.649 9.735 1.00 0.00 H ATOM 27491 H2 WAT 4453 59.897 94.081 10.388 1.00 0.00 H TER 27493 WAT 4453 ATOM 27493 O WAT 4454 99.599 52.933 131.218 1.00 0.00 O ATOM 27494 H1 WAT 4454 99.313 52.024 131.312 1.00 0.00 H ATOM 27495 H2 WAT 4454 100.160 53.087 131.978 1.00 0.00 H TER 27497 WAT 4454 ATOM 27497 O WAT 4455 140.230 9.830 96.096 1.00 0.00 O ATOM 27498 H1 WAT 4455 139.429 10.305 96.319 1.00 0.00 H ATOM 27499 H2 WAT 4455 139.998 9.321 95.319 1.00 0.00 H TER 27501 WAT 4455 ATOM 27501 O WAT 4456 68.848 37.429 151.202 1.00 0.00 O ATOM 27502 H1 WAT 4456 68.766 38.352 150.965 1.00 0.00 H ATOM 27503 H2 WAT 4456 69.667 37.380 151.695 1.00 0.00 H TER 27505 WAT 4456 ATOM 27505 O WAT 4457 118.644 60.519 147.975 1.00 0.00 O ATOM 27506 H1 WAT 4457 119.562 60.250 147.930 1.00 0.00 H ATOM 27507 H2 WAT 4457 118.181 59.738 148.278 1.00 0.00 H TER 27509 WAT 4457 ATOM 27509 O WAT 4458 97.560 8.487 5.383 1.00 0.00 O ATOM 27510 H1 WAT 4458 97.754 8.245 6.288 1.00 0.00 H ATOM 27511 H2 WAT 4458 98.320 8.997 5.103 1.00 0.00 H TER 27513 WAT 4458 ATOM 27513 O WAT 4459 63.239 80.778 123.261 1.00 0.00 O ATOM 27514 H1 WAT 4459 63.054 80.973 122.342 1.00 0.00 H ATOM 27515 H2 WAT 4459 63.218 81.631 123.696 1.00 0.00 H TER 27517 WAT 4459 ATOM 27517 O WAT 4460 63.196 14.953 152.665 1.00 0.00 O ATOM 27518 H1 WAT 4460 62.540 14.719 152.009 1.00 0.00 H ATOM 27519 H2 WAT 4460 63.839 15.475 152.185 1.00 0.00 H TER 27521 WAT 4460 ATOM 27521 O WAT 4461 60.723 96.246 83.167 1.00 0.00 O ATOM 27522 H1 WAT 4461 61.221 96.756 82.528 1.00 0.00 H ATOM 27523 H2 WAT 4461 61.223 96.326 83.980 1.00 0.00 H TER 27525 WAT 4461 ATOM 27525 O WAT 4462 140.740 41.032 71.197 1.00 0.00 O ATOM 27526 H1 WAT 4462 141.413 40.937 70.523 1.00 0.00 H ATOM 27527 H2 WAT 4462 140.897 40.302 71.796 1.00 0.00 H TER 27529 WAT 4462 ATOM 27529 O WAT 4463 86.552 49.550 141.933 1.00 0.00 O ATOM 27530 H1 WAT 4463 85.817 50.069 142.261 1.00 0.00 H ATOM 27531 H2 WAT 4463 86.710 48.900 142.618 1.00 0.00 H TER 27533 WAT 4463 ATOM 27533 O WAT 4464 85.468 49.091 117.374 1.00 0.00 O ATOM 27534 H1 WAT 4464 85.367 49.896 117.882 1.00 0.00 H ATOM 27535 H2 WAT 4464 86.045 49.337 116.650 1.00 0.00 H TER 27537 WAT 4464 ATOM 27537 O WAT 4465 140.006 115.354 129.998 1.00 0.00 O ATOM 27538 H1 WAT 4465 140.612 115.801 129.406 1.00 0.00 H ATOM 27539 H2 WAT 4465 139.359 114.952 129.419 1.00 0.00 H TER 27541 WAT 4465 ATOM 27541 O WAT 4466 86.694 127.444 113.924 1.00 0.00 O ATOM 27542 H1 WAT 4466 86.819 126.513 113.739 1.00 0.00 H ATOM 27543 H2 WAT 4466 85.743 127.557 113.951 1.00 0.00 H TER 27545 WAT 4466 ATOM 27545 O WAT 4467 119.990 68.135 103.609 1.00 0.00 O ATOM 27546 H1 WAT 4467 119.645 68.482 104.431 1.00 0.00 H ATOM 27547 H2 WAT 4467 120.110 67.200 103.776 1.00 0.00 H TER 27549 WAT 4467 ATOM 27549 O WAT 4468 30.279 24.792 63.797 1.00 0.00 O ATOM 27550 H1 WAT 4468 30.343 24.900 62.848 1.00 0.00 H ATOM 27551 H2 WAT 4468 29.418 24.399 63.936 1.00 0.00 H TER 27553 WAT 4468 ATOM 27553 O WAT 4469 23.662 10.073 23.191 1.00 0.00 O ATOM 27554 H1 WAT 4469 23.239 10.741 23.732 1.00 0.00 H ATOM 27555 H2 WAT 4469 22.943 9.661 22.713 1.00 0.00 H TER 27557 WAT 4469 ATOM 27557 O WAT 4470 104.288 108.522 8.384 1.00 0.00 O ATOM 27558 H1 WAT 4470 104.927 108.833 7.742 1.00 0.00 H ATOM 27559 H2 WAT 4470 104.682 107.730 8.749 1.00 0.00 H TER 27561 WAT 4470 ATOM 27561 O WAT 4471 33.663 136.060 147.056 1.00 0.00 O ATOM 27562 H1 WAT 4471 32.950 136.684 147.193 1.00 0.00 H ATOM 27563 H2 WAT 4471 33.627 135.485 147.820 1.00 0.00 H TER 27565 WAT 4471 ATOM 27565 O WAT 4472 1.853 91.653 107.285 1.00 0.00 O ATOM 27566 H1 WAT 4472 2.576 92.281 107.281 1.00 0.00 H ATOM 27567 H2 WAT 4472 1.174 92.066 106.752 1.00 0.00 H TER 27569 WAT 4472 ATOM 27569 O WAT 4473 40.926 108.813 142.095 1.00 0.00 O ATOM 27570 H1 WAT 4473 41.489 108.148 142.493 1.00 0.00 H ATOM 27571 H2 WAT 4473 41.465 109.203 141.407 1.00 0.00 H TER 27573 WAT 4473 ATOM 27573 O WAT 4474 105.635 88.801 147.077 1.00 0.00 O ATOM 27574 H1 WAT 4474 106.327 89.411 147.331 1.00 0.00 H ATOM 27575 H2 WAT 4474 105.980 87.938 147.303 1.00 0.00 H TER 27577 WAT 4474 ATOM 27577 O WAT 4475 25.054 62.622 55.502 1.00 0.00 O ATOM 27578 H1 WAT 4475 24.186 63.002 55.639 1.00 0.00 H ATOM 27579 H2 WAT 4475 24.883 61.705 55.291 1.00 0.00 H TER 27581 WAT 4475 ATOM 27581 O WAT 4476 95.645 83.116 10.926 1.00 0.00 O ATOM 27582 H1 WAT 4476 94.884 83.496 11.364 1.00 0.00 H ATOM 27583 H2 WAT 4476 96.207 83.866 10.727 1.00 0.00 H TER 27585 WAT 4476 ATOM 27585 O WAT 4477 16.208 113.934 155.595 1.00 0.00 O ATOM 27586 H1 WAT 4477 16.833 113.215 155.686 1.00 0.00 H ATOM 27587 H2 WAT 4477 16.236 114.384 156.440 1.00 0.00 H TER 27589 WAT 4477 ATOM 27589 O WAT 4478 43.249 32.015 154.022 1.00 0.00 O ATOM 27590 H1 WAT 4478 42.722 31.830 154.799 1.00 0.00 H ATOM 27591 H2 WAT 4478 44.098 31.614 154.207 1.00 0.00 H TER 27593 WAT 4478 ATOM 27593 O WAT 4479 61.372 95.311 122.725 1.00 0.00 O ATOM 27594 H1 WAT 4479 61.642 94.450 123.044 1.00 0.00 H ATOM 27595 H2 WAT 4479 61.794 95.931 123.320 1.00 0.00 H TER 27597 WAT 4479 ATOM 27597 O WAT 4480 14.818 104.169 114.995 1.00 0.00 O ATOM 27598 H1 WAT 4480 13.973 104.565 114.782 1.00 0.00 H ATOM 27599 H2 WAT 4480 14.739 103.917 115.915 1.00 0.00 H TER 27601 WAT 4480 ATOM 27601 O WAT 4481 79.799 15.111 107.984 1.00 0.00 O ATOM 27602 H1 WAT 4481 80.361 14.482 108.437 1.00 0.00 H ATOM 27603 H2 WAT 4481 78.979 14.639 107.840 1.00 0.00 H TER 27605 WAT 4481 ATOM 27605 O WAT 4482 36.055 78.076 79.389 1.00 0.00 O ATOM 27606 H1 WAT 4482 36.292 78.962 79.666 1.00 0.00 H ATOM 27607 H2 WAT 4482 35.847 78.164 78.459 1.00 0.00 H TER 27609 WAT 4482 ATOM 27609 O WAT 4483 81.855 76.276 4.341 1.00 0.00 O ATOM 27610 H1 WAT 4483 82.288 76.896 3.755 1.00 0.00 H ATOM 27611 H2 WAT 4483 81.055 76.725 4.616 1.00 0.00 H TER 27613 WAT 4483 ATOM 27613 O WAT 4484 51.905 11.285 17.243 1.00 0.00 O ATOM 27614 H1 WAT 4484 52.255 10.499 16.825 1.00 0.00 H ATOM 27615 H2 WAT 4484 51.735 11.886 16.518 1.00 0.00 H TER 27617 WAT 4484 ATOM 27617 O WAT 4485 45.629 126.286 86.325 1.00 0.00 O ATOM 27618 H1 WAT 4485 44.838 126.314 85.786 1.00 0.00 H ATOM 27619 H2 WAT 4485 45.936 125.382 86.251 1.00 0.00 H TER 27621 WAT 4485 ATOM 27621 O WAT 4486 16.621 89.054 110.102 1.00 0.00 O ATOM 27622 H1 WAT 4486 17.202 88.324 109.887 1.00 0.00 H ATOM 27623 H2 WAT 4486 17.147 89.621 110.666 1.00 0.00 H TER 27625 WAT 4486 ATOM 27625 O WAT 4487 80.891 91.075 127.455 1.00 0.00 O ATOM 27626 H1 WAT 4487 80.692 91.859 126.943 1.00 0.00 H ATOM 27627 H2 WAT 4487 80.063 90.595 127.491 1.00 0.00 H TER 27629 WAT 4487 ATOM 27629 O WAT 4488 111.345 100.977 96.124 1.00 0.00 O ATOM 27630 H1 WAT 4488 112.033 100.335 95.947 1.00 0.00 H ATOM 27631 H2 WAT 4488 111.348 101.550 95.357 1.00 0.00 H TER 27633 WAT 4488 ATOM 27633 O WAT 4489 73.220 60.445 12.641 1.00 0.00 O ATOM 27634 H1 WAT 4489 73.287 59.492 12.579 1.00 0.00 H ATOM 27635 H2 WAT 4489 73.581 60.764 11.814 1.00 0.00 H TER 27637 WAT 4489 ATOM 27637 O WAT 4490 73.955 132.266 156.698 1.00 0.00 O ATOM 27638 H1 WAT 4490 73.071 132.634 156.714 1.00 0.00 H ATOM 27639 H2 WAT 4490 74.502 132.938 157.104 1.00 0.00 H TER 27641 WAT 4490 ATOM 27641 O WAT 4491 86.811 76.205 105.449 1.00 0.00 O ATOM 27642 H1 WAT 4491 86.364 75.969 106.261 1.00 0.00 H ATOM 27643 H2 WAT 4491 86.693 77.152 105.376 1.00 0.00 H TER 27645 WAT 4491 ATOM 27645 O WAT 4492 95.506 37.359 100.283 1.00 0.00 O ATOM 27646 H1 WAT 4492 94.570 37.466 100.111 1.00 0.00 H ATOM 27647 H2 WAT 4492 95.561 37.214 101.227 1.00 0.00 H TER 27649 WAT 4492 ATOM 27649 O WAT 4493 142.838 137.712 109.902 1.00 0.00 O ATOM 27650 H1 WAT 4493 143.002 137.611 108.964 1.00 0.00 H ATOM 27651 H2 WAT 4493 143.253 138.544 110.130 1.00 0.00 H TER 27653 WAT 4493 ATOM 27653 O WAT 4494 20.042 107.737 148.090 1.00 0.00 O ATOM 27654 H1 WAT 4494 19.643 108.388 148.668 1.00 0.00 H ATOM 27655 H2 WAT 4494 20.921 107.608 148.446 1.00 0.00 H TER 27657 WAT 4494 ATOM 27657 O WAT 4495 95.316 12.906 6.121 1.00 0.00 O ATOM 27658 H1 WAT 4495 95.949 13.452 6.587 1.00 0.00 H ATOM 27659 H2 WAT 4495 95.734 12.046 6.070 1.00 0.00 H TER 27661 WAT 4495 ATOM 27661 O WAT 4496 139.850 56.776 154.949 1.00 0.00 O ATOM 27662 H1 WAT 4496 140.649 56.445 154.539 1.00 0.00 H ATOM 27663 H2 WAT 4496 139.296 56.003 155.053 1.00 0.00 H TER 27665 WAT 4496 ATOM 27665 O WAT 4497 96.155 4.846 157.783 1.00 0.00 O ATOM 27666 H1 WAT 4497 95.834 4.290 158.493 1.00 0.00 H ATOM 27667 H2 WAT 4497 95.471 4.801 157.116 1.00 0.00 H TER 27669 WAT 4497 ATOM 27669 O WAT 4498 83.035 91.916 111.233 1.00 0.00 O ATOM 27670 H1 WAT 4498 82.762 91.461 112.031 1.00 0.00 H ATOM 27671 H2 WAT 4498 83.799 91.427 110.928 1.00 0.00 H TER 27673 WAT 4498 ATOM 27673 O WAT 4499 88.700 69.175 118.898 1.00 0.00 O ATOM 27674 H1 WAT 4499 89.213 69.926 118.600 1.00 0.00 H ATOM 27675 H2 WAT 4499 88.373 69.435 119.760 1.00 0.00 H TER 27677 WAT 4499 ATOM 27677 O WAT 4500 114.558 99.622 136.114 1.00 0.00 O ATOM 27678 H1 WAT 4500 113.709 99.943 136.419 1.00 0.00 H ATOM 27679 H2 WAT 4500 115.170 99.868 136.807 1.00 0.00 H TER 27681 WAT 4500 ATOM 27681 O WAT 4501 141.980 31.309 0.369 1.00 0.00 O ATOM 27682 H1 WAT 4501 142.190 31.302 -0.565 1.00 0.00 H ATOM 27683 H2 WAT 4501 142.153 32.209 0.647 1.00 0.00 H TER 27685 WAT 4501 ATOM 27685 O WAT 4502 89.874 123.870 150.993 1.00 0.00 O ATOM 27686 H1 WAT 4502 90.534 123.605 151.633 1.00 0.00 H ATOM 27687 H2 WAT 4502 89.106 123.340 151.207 1.00 0.00 H TER 27689 WAT 4502 ATOM 27689 O WAT 4503 119.124 127.368 18.653 1.00 0.00 O ATOM 27690 H1 WAT 4503 119.904 126.943 18.295 1.00 0.00 H ATOM 27691 H2 WAT 4503 118.844 127.972 17.965 1.00 0.00 H TER 27693 WAT 4503 ATOM 27693 O WAT 4504 90.688 19.681 113.765 1.00 0.00 O ATOM 27694 H1 WAT 4504 90.567 19.463 112.841 1.00 0.00 H ATOM 27695 H2 WAT 4504 89.913 19.323 114.199 1.00 0.00 H TER 27697 WAT 4504 ATOM 27697 O WAT 4505 101.506 38.304 106.085 1.00 0.00 O ATOM 27698 H1 WAT 4505 101.464 38.327 105.129 1.00 0.00 H ATOM 27699 H2 WAT 4505 101.974 39.105 106.324 1.00 0.00 H TER 27701 WAT 4505 ATOM 27701 O WAT 4506 110.801 72.937 97.738 1.00 0.00 O ATOM 27702 H1 WAT 4506 109.870 72.716 97.755 1.00 0.00 H ATOM 27703 H2 WAT 4506 111.213 72.206 97.278 1.00 0.00 H TER 27705 WAT 4506 ATOM 27705 O WAT 4507 98.593 46.425 127.316 1.00 0.00 O ATOM 27706 H1 WAT 4507 98.679 45.480 127.190 1.00 0.00 H ATOM 27707 H2 WAT 4507 99.306 46.802 126.801 1.00 0.00 H TER 27709 WAT 4507 ATOM 27709 O WAT 4508 44.854 94.689 137.962 1.00 0.00 O ATOM 27710 H1 WAT 4508 45.370 93.904 137.781 1.00 0.00 H ATOM 27711 H2 WAT 4508 45.446 95.257 138.454 1.00 0.00 H TER 27713 WAT 4508 ATOM 27713 O WAT 4509 27.872 97.857 69.509 1.00 0.00 O ATOM 27714 H1 WAT 4509 28.033 98.362 68.713 1.00 0.00 H ATOM 27715 H2 WAT 4509 28.744 97.686 69.865 1.00 0.00 H TER 27717 WAT 4509 ATOM 27717 O WAT 4510 125.727 128.221 110.262 1.00 0.00 O ATOM 27718 H1 WAT 4510 124.815 128.507 110.304 1.00 0.00 H ATOM 27719 H2 WAT 4510 125.826 127.623 111.003 1.00 0.00 H TER 27721 WAT 4510 ATOM 27721 O WAT 4511 141.741 37.131 8.311 1.00 0.00 O ATOM 27722 H1 WAT 4511 140.975 37.176 7.739 1.00 0.00 H ATOM 27723 H2 WAT 4511 142.242 36.384 7.984 1.00 0.00 H TER 27725 WAT 4511 ATOM 27725 O WAT 4512 139.932 31.205 10.068 1.00 0.00 O ATOM 27726 H1 WAT 4512 139.899 32.015 9.559 1.00 0.00 H ATOM 27727 H2 WAT 4512 140.546 30.647 9.591 1.00 0.00 H TER 27729 WAT 4512 ATOM 27729 O WAT 4513 119.293 22.045 21.105 1.00 0.00 O ATOM 27730 H1 WAT 4513 118.889 22.912 21.104 1.00 0.00 H ATOM 27731 H2 WAT 4513 118.813 21.558 21.775 1.00 0.00 H TER 27733 WAT 4513 ATOM 27733 O WAT 4514 93.293 121.373 147.657 1.00 0.00 O ATOM 27734 H1 WAT 4514 93.370 122.182 148.163 1.00 0.00 H ATOM 27735 H2 WAT 4514 92.511 120.946 148.006 1.00 0.00 H TER 27737 WAT 4514 ATOM 27737 O WAT 4515 53.017 134.516 148.989 1.00 0.00 O ATOM 27738 H1 WAT 4515 52.988 133.655 149.405 1.00 0.00 H ATOM 27739 H2 WAT 4515 53.131 135.130 149.715 1.00 0.00 H TER 27741 WAT 4515 ATOM 27741 O WAT 4516 54.400 7.171 156.705 1.00 0.00 O ATOM 27742 H1 WAT 4516 53.556 7.507 156.403 1.00 0.00 H ATOM 27743 H2 WAT 4516 54.175 6.449 157.292 1.00 0.00 H TER 27745 WAT 4516 ATOM 27745 O WAT 4517 142.274 52.204 125.617 1.00 0.00 O ATOM 27746 H1 WAT 4517 142.174 51.285 125.366 1.00 0.00 H ATOM 27747 H2 WAT 4517 143.154 52.438 125.322 1.00 0.00 H TER 27749 WAT 4517 ATOM 27749 O WAT 4518 66.337 140.827 73.211 1.00 0.00 O ATOM 27750 H1 WAT 4518 65.424 140.843 73.498 1.00 0.00 H ATOM 27751 H2 WAT 4518 66.463 141.667 72.770 1.00 0.00 H TER 27753 WAT 4518 ATOM 27753 O WAT 4519 62.130 48.361 71.229 1.00 0.00 O ATOM 27754 H1 WAT 4519 61.249 48.728 71.169 1.00 0.00 H ATOM 27755 H2 WAT 4519 61.998 47.414 71.187 1.00 0.00 H TER 27757 WAT 4519 ATOM 27757 O WAT 4520 123.496 26.466 94.267 1.00 0.00 O ATOM 27758 H1 WAT 4520 122.918 26.213 93.547 1.00 0.00 H ATOM 27759 H2 WAT 4520 123.085 26.094 95.047 1.00 0.00 H TER 27761 WAT 4520 ATOM 27761 O WAT 4521 99.534 102.518 131.647 1.00 0.00 O ATOM 27762 H1 WAT 4521 98.977 103.277 131.821 1.00 0.00 H ATOM 27763 H2 WAT 4521 100.285 102.634 132.229 1.00 0.00 H TER 27765 WAT 4521 ATOM 27765 O WAT 4522 89.955 41.887 71.719 1.00 0.00 O ATOM 27766 H1 WAT 4522 90.759 41.636 71.264 1.00 0.00 H ATOM 27767 H2 WAT 4522 89.936 42.843 71.662 1.00 0.00 H TER 27769 WAT 4522 ATOM 27769 O WAT 4523 79.229 34.270 66.207 1.00 0.00 O ATOM 27770 H1 WAT 4523 79.634 34.408 67.063 1.00 0.00 H ATOM 27771 H2 WAT 4523 79.139 35.149 65.839 1.00 0.00 H TER 27773 WAT 4523 ATOM 27773 O WAT 4524 81.792 34.172 3.783 1.00 0.00 O ATOM 27774 H1 WAT 4524 81.511 35.020 3.438 1.00 0.00 H ATOM 27775 H2 WAT 4524 82.359 34.391 4.523 1.00 0.00 H TER 27777 WAT 4524 ATOM 27777 O WAT 4525 56.223 53.316 147.579 1.00 0.00 O ATOM 27778 H1 WAT 4525 56.716 52.627 148.024 1.00 0.00 H ATOM 27779 H2 WAT 4525 55.970 52.926 146.742 1.00 0.00 H TER 27781 WAT 4525 ATOM 27781 O WAT 4526 23.625 50.958 138.522 1.00 0.00 O ATOM 27782 H1 WAT 4526 24.131 51.349 137.809 1.00 0.00 H ATOM 27783 H2 WAT 4526 24.261 50.434 139.008 1.00 0.00 H TER 27785 WAT 4526 ATOM 27785 O WAT 4527 41.781 95.999 20.541 1.00 0.00 O ATOM 27786 H1 WAT 4527 42.524 96.167 19.962 1.00 0.00 H ATOM 27787 H2 WAT 4527 42.049 95.241 21.061 1.00 0.00 H TER 27789 WAT 4527 ATOM 27789 O WAT 4528 87.852 14.013 106.786 1.00 0.00 O ATOM 27790 H1 WAT 4528 88.081 13.469 107.539 1.00 0.00 H ATOM 27791 H2 WAT 4528 88.400 14.792 106.877 1.00 0.00 H TER 27793 WAT 4528 ATOM 27793 O WAT 4529 29.745 109.350 75.612 1.00 0.00 O ATOM 27794 H1 WAT 4529 30.241 108.619 75.980 1.00 0.00 H ATOM 27795 H2 WAT 4529 28.879 109.279 76.014 1.00 0.00 H TER 27797 WAT 4529 ATOM 27797 O WAT 4530 89.098 127.642 95.044 1.00 0.00 O ATOM 27798 H1 WAT 4530 89.410 127.974 95.886 1.00 0.00 H ATOM 27799 H2 WAT 4530 89.474 126.764 94.979 1.00 0.00 H TER 27801 WAT 4530 ATOM 27801 O WAT 4531 65.126 27.626 19.446 1.00 0.00 O ATOM 27802 H1 WAT 4531 64.483 28.333 19.502 1.00 0.00 H ATOM 27803 H2 WAT 4531 65.913 27.986 19.854 1.00 0.00 H TER 27805 WAT 4531 ATOM 27805 O WAT 4532 69.028 65.761 1.499 1.00 0.00 O ATOM 27806 H1 WAT 4532 68.225 66.085 1.907 1.00 0.00 H ATOM 27807 H2 WAT 4532 69.733 66.185 1.988 1.00 0.00 H TER 27809 WAT 4532 ATOM 27809 O WAT 4533 138.237 111.649 121.500 1.00 0.00 O ATOM 27810 H1 WAT 4533 137.993 111.159 122.285 1.00 0.00 H ATOM 27811 H2 WAT 4533 138.985 112.181 121.772 1.00 0.00 H TER 27813 WAT 4533 ATOM 27813 O WAT 4534 96.343 34.997 58.031 1.00 0.00 O ATOM 27814 H1 WAT 4534 96.322 35.555 57.253 1.00 0.00 H ATOM 27815 H2 WAT 4534 95.697 34.313 57.852 1.00 0.00 H TER 27817 WAT 4534 ATOM 27817 O WAT 4535 9.948 5.466 158.067 1.00 0.00 O ATOM 27818 H1 WAT 4535 9.379 4.748 157.790 1.00 0.00 H ATOM 27819 H2 WAT 4535 10.835 5.119 157.972 1.00 0.00 H TER 27821 WAT 4535 ATOM 27821 O WAT 4536 46.307 61.965 11.640 1.00 0.00 O ATOM 27822 H1 WAT 4536 47.023 62.072 12.266 1.00 0.00 H ATOM 27823 H2 WAT 4536 45.566 62.415 12.044 1.00 0.00 H TER 27825 WAT 4536 ATOM 27825 O WAT 4537 89.243 16.916 6.339 1.00 0.00 O ATOM 27826 H1 WAT 4537 89.043 16.599 5.458 1.00 0.00 H ATOM 27827 H2 WAT 4537 88.713 16.367 6.917 1.00 0.00 H TER 27829 WAT 4537 ATOM 27829 O WAT 4538 63.922 44.912 157.660 1.00 0.00 O ATOM 27830 H1 WAT 4538 62.974 44.780 157.675 1.00 0.00 H ATOM 27831 H2 WAT 4538 64.259 44.175 157.150 1.00 0.00 H TER 27833 WAT 4538 ATOM 27833 O WAT 4539 16.237 89.532 123.711 1.00 0.00 O ATOM 27834 H1 WAT 4539 16.967 89.984 123.288 1.00 0.00 H ATOM 27835 H2 WAT 4539 16.495 88.610 123.712 1.00 0.00 H TER 27837 WAT 4539 ATOM 27837 O WAT 4540 130.741 106.648 81.856 1.00 0.00 O ATOM 27838 H1 WAT 4540 131.512 107.118 82.173 1.00 0.00 H ATOM 27839 H2 WAT 4540 130.333 106.295 82.647 1.00 0.00 H TER 27841 WAT 4540 ATOM 27841 O WAT 4541 57.029 103.511 8.221 1.00 0.00 O ATOM 27842 H1 WAT 4541 56.989 103.749 7.295 1.00 0.00 H ATOM 27843 H2 WAT 4541 57.726 102.856 8.270 1.00 0.00 H TER 27845 WAT 4541 ATOM 27845 O WAT 4542 138.795 34.556 118.851 1.00 0.00 O ATOM 27846 H1 WAT 4542 138.542 34.810 117.963 1.00 0.00 H ATOM 27847 H2 WAT 4542 137.993 34.204 119.237 1.00 0.00 H TER 27849 WAT 4542 ATOM 27849 O WAT 4543 130.062 138.248 156.980 1.00 0.00 O ATOM 27850 H1 WAT 4543 130.961 138.065 156.708 1.00 0.00 H ATOM 27851 H2 WAT 4543 130.144 138.959 157.615 1.00 0.00 H TER 27853 WAT 4543 ATOM 27853 O WAT 4544 132.063 53.190 94.191 1.00 0.00 O ATOM 27854 H1 WAT 4544 131.767 53.748 93.472 1.00 0.00 H ATOM 27855 H2 WAT 4544 132.117 52.315 93.808 1.00 0.00 H TER 27857 WAT 4544 ATOM 27857 O WAT 4545 87.749 33.899 157.885 1.00 0.00 O ATOM 27858 H1 WAT 4545 87.468 32.987 157.956 1.00 0.00 H ATOM 27859 H2 WAT 4545 87.034 34.334 157.420 1.00 0.00 H TER 27861 WAT 4545 ATOM 27861 O WAT 4546 65.759 100.767 141.286 1.00 0.00 O ATOM 27862 H1 WAT 4546 65.479 101.458 141.886 1.00 0.00 H ATOM 27863 H2 WAT 4546 65.761 101.184 140.424 1.00 0.00 H TER 27865 WAT 4546 ATOM 27865 O WAT 4547 20.495 18.522 152.370 1.00 0.00 O ATOM 27866 H1 WAT 4547 19.988 18.013 151.738 1.00 0.00 H ATOM 27867 H2 WAT 4547 20.003 18.447 153.188 1.00 0.00 H TER 27869 WAT 4547 ATOM 27869 O WAT 4548 35.670 46.893 122.498 1.00 0.00 O ATOM 27870 H1 WAT 4548 35.885 46.554 123.367 1.00 0.00 H ATOM 27871 H2 WAT 4548 35.881 47.825 122.546 1.00 0.00 H TER 27873 WAT 4548 ATOM 27873 O WAT 4549 109.534 108.561 10.242 1.00 0.00 O ATOM 27874 H1 WAT 4549 109.222 109.463 10.173 1.00 0.00 H ATOM 27875 H2 WAT 4549 109.517 108.373 11.181 1.00 0.00 H TER 27877 WAT 4549 ATOM 27877 O WAT 4550 24.333 136.757 79.992 1.00 0.00 O ATOM 27878 H1 WAT 4550 24.156 136.933 80.916 1.00 0.00 H ATOM 27879 H2 WAT 4550 23.960 137.506 79.529 1.00 0.00 H TER 27881 WAT 4550 ATOM 27881 O WAT 4551 50.384 126.817 76.137 1.00 0.00 O ATOM 27882 H1 WAT 4551 51.326 126.798 75.967 1.00 0.00 H ATOM 27883 H2 WAT 4551 50.113 125.901 76.085 1.00 0.00 H TER 27885 WAT 4551 ATOM 27885 O WAT 4552 83.891 116.075 69.426 1.00 0.00 O ATOM 27886 H1 WAT 4552 84.592 115.451 69.616 1.00 0.00 H ATOM 27887 H2 WAT 4552 84.323 116.929 69.435 1.00 0.00 H TER 27889 WAT 4552 ATOM 27889 O WAT 4553 140.205 45.541 156.243 1.00 0.00 O ATOM 27890 H1 WAT 4553 139.715 45.978 155.546 1.00 0.00 H ATOM 27891 H2 WAT 4553 140.834 46.198 156.541 1.00 0.00 H TER 27893 WAT 4553 ATOM 27893 O WAT 4554 110.472 82.765 88.211 1.00 0.00 O ATOM 27894 H1 WAT 4554 111.033 81.992 88.281 1.00 0.00 H ATOM 27895 H2 WAT 4554 110.377 83.074 89.112 1.00 0.00 H TER 27897 WAT 4554 ATOM 27897 O WAT 4555 66.286 9.600 67.525 1.00 0.00 O ATOM 27898 H1 WAT 4555 67.082 10.056 67.250 1.00 0.00 H ATOM 27899 H2 WAT 4555 66.214 9.787 68.461 1.00 0.00 H TER 27901 WAT 4555 ATOM 27901 O WAT 4556 142.817 108.998 133.309 1.00 0.00 O ATOM 27902 H1 WAT 4556 141.874 108.982 133.473 1.00 0.00 H ATOM 27903 H2 WAT 4556 143.105 108.101 133.476 1.00 0.00 H TER 27905 WAT 4556 ATOM 27905 O WAT 4557 42.320 15.904 77.127 1.00 0.00 O ATOM 27906 H1 WAT 4557 41.525 15.402 77.304 1.00 0.00 H ATOM 27907 H2 WAT 4557 42.948 15.601 77.783 1.00 0.00 H TER 27909 WAT 4557 ATOM 27909 O WAT 4558 122.552 88.076 103.617 1.00 0.00 O ATOM 27910 H1 WAT 4558 122.752 87.523 102.861 1.00 0.00 H ATOM 27911 H2 WAT 4558 122.047 88.803 103.254 1.00 0.00 H TER 27913 WAT 4558 ATOM 27913 O WAT 4559 7.146 5.043 135.158 1.00 0.00 O ATOM 27914 H1 WAT 4559 6.279 4.712 135.395 1.00 0.00 H ATOM 27915 H2 WAT 4559 7.233 5.860 135.649 1.00 0.00 H TER 27917 WAT 4559 ATOM 27917 O WAT 4560 48.145 131.851 80.073 1.00 0.00 O ATOM 27918 H1 WAT 4560 48.140 131.729 79.124 1.00 0.00 H ATOM 27919 H2 WAT 4560 47.312 132.282 80.263 1.00 0.00 H TER 27921 WAT 4560 ATOM 27921 O WAT 4561 110.718 99.661 139.283 1.00 0.00 O ATOM 27922 H1 WAT 4561 109.872 99.929 139.642 1.00 0.00 H ATOM 27923 H2 WAT 4561 111.317 99.699 140.029 1.00 0.00 H TER 27925 WAT 4561 ATOM 27925 O WAT 4562 116.684 81.282 86.600 1.00 0.00 O ATOM 27926 H1 WAT 4562 117.547 81.690 86.534 1.00 0.00 H ATOM 27927 H2 WAT 4562 116.821 80.383 86.301 1.00 0.00 H TER 27929 WAT 4562 ATOM 27929 O WAT 4563 137.063 25.995 5.029 1.00 0.00 O ATOM 27930 H1 WAT 4563 136.890 25.414 5.770 1.00 0.00 H ATOM 27931 H2 WAT 4563 137.347 25.409 4.327 1.00 0.00 H TER 27933 WAT 4563 ATOM 27933 O WAT 4564 25.986 96.101 108.297 1.00 0.00 O ATOM 27934 H1 WAT 4564 26.729 96.513 107.857 1.00 0.00 H ATOM 27935 H2 WAT 4564 25.445 96.834 108.591 1.00 0.00 H TER 27937 WAT 4564 ATOM 27937 O WAT 4565 112.094 31.182 74.427 1.00 0.00 O ATOM 27938 H1 WAT 4565 111.445 31.366 75.106 1.00 0.00 H ATOM 27939 H2 WAT 4565 111.810 30.353 74.043 1.00 0.00 H TER 27941 WAT 4565 ATOM 27941 O WAT 4566 44.314 32.168 76.429 1.00 0.00 O ATOM 27942 H1 WAT 4566 44.701 32.593 75.663 1.00 0.00 H ATOM 27943 H2 WAT 4566 43.437 31.913 76.144 1.00 0.00 H TER 27945 WAT 4566 ATOM 27945 O WAT 4567 96.029 65.749 118.077 1.00 0.00 O ATOM 27946 H1 WAT 4567 95.306 66.114 117.567 1.00 0.00 H ATOM 27947 H2 WAT 4567 96.506 66.515 118.398 1.00 0.00 H TER 27949 WAT 4567 ATOM 27949 O WAT 4568 54.539 67.237 109.822 1.00 0.00 O ATOM 27950 H1 WAT 4568 54.690 68.180 109.898 1.00 0.00 H ATOM 27951 H2 WAT 4568 53.597 67.134 109.960 1.00 0.00 H TER 27953 WAT 4568 ATOM 27953 O WAT 4569 144.802 3.542 91.786 1.00 0.00 O ATOM 27954 H1 WAT 4569 144.609 4.123 91.050 1.00 0.00 H ATOM 27955 H2 WAT 4569 144.717 2.661 91.424 1.00 0.00 H TER 27957 WAT 4569 ATOM 27957 O WAT 4570 116.363 119.020 20.632 1.00 0.00 O ATOM 27958 H1 WAT 4570 115.977 119.581 21.305 1.00 0.00 H ATOM 27959 H2 WAT 4570 116.126 119.439 19.805 1.00 0.00 H TER 27961 WAT 4570 ATOM 27961 O WAT 4571 109.995 58.552 5.051 1.00 0.00 O ATOM 27962 H1 WAT 4571 109.402 58.941 5.693 1.00 0.00 H ATOM 27963 H2 WAT 4571 110.535 59.283 4.749 1.00 0.00 H TER 27965 WAT 4571 ATOM 27965 O WAT 4572 53.374 135.410 13.221 1.00 0.00 O ATOM 27966 H1 WAT 4572 53.857 136.226 13.089 1.00 0.00 H ATOM 27967 H2 WAT 4572 54.050 134.733 13.249 1.00 0.00 H TER 27969 WAT 4572 ATOM 27969 O WAT 4573 100.772 40.036 96.629 1.00 0.00 O ATOM 27970 H1 WAT 4573 101.539 39.925 97.191 1.00 0.00 H ATOM 27971 H2 WAT 4573 100.646 40.984 96.581 1.00 0.00 H TER 27973 WAT 4573 ATOM 27973 O WAT 4574 22.688 78.027 134.936 1.00 0.00 O ATOM 27974 H1 WAT 4574 21.932 78.613 134.962 1.00 0.00 H ATOM 27975 H2 WAT 4574 22.875 77.835 135.855 1.00 0.00 H TER 27977 WAT 4574 ATOM 27977 O WAT 4575 25.492 95.085 125.344 1.00 0.00 O ATOM 27978 H1 WAT 4575 25.363 94.884 126.271 1.00 0.00 H ATOM 27979 H2 WAT 4575 24.906 95.823 125.175 1.00 0.00 H TER 27981 WAT 4575 ATOM 27981 O WAT 4576 139.417 106.275 75.177 1.00 0.00 O ATOM 27982 H1 WAT 4576 140.078 106.908 75.458 1.00 0.00 H ATOM 27983 H2 WAT 4576 139.670 105.458 75.608 1.00 0.00 H TER 27985 WAT 4576 ATOM 27985 O WAT 4577 21.649 118.004 57.637 1.00 0.00 O ATOM 27986 H1 WAT 4577 22.489 117.738 57.263 1.00 0.00 H ATOM 27987 H2 WAT 4577 21.220 117.181 57.872 1.00 0.00 H TER 27989 WAT 4577 ATOM 27989 O WAT 4578 32.825 29.763 105.537 1.00 0.00 O ATOM 27990 H1 WAT 4578 32.134 29.677 106.194 1.00 0.00 H ATOM 27991 H2 WAT 4578 32.357 29.905 104.715 1.00 0.00 H TER 27993 WAT 4578 ATOM 27993 O WAT 4579 42.977 4.642 4.581 1.00 0.00 O ATOM 27994 H1 WAT 4579 43.444 4.267 3.835 1.00 0.00 H ATOM 27995 H2 WAT 4579 42.599 3.886 5.031 1.00 0.00 H TER 27997 WAT 4579 ATOM 27997 O WAT 4580 122.861 0.147 14.370 1.00 0.00 O ATOM 27998 H1 WAT 4580 121.905 0.116 14.325 1.00 0.00 H ATOM 27999 H2 WAT 4580 123.077 1.072 14.250 1.00 0.00 H TER 28001 WAT 4580 ATOM 28001 O WAT 4581 83.072 36.052 9.780 1.00 0.00 O ATOM 28002 H1 WAT 4581 83.230 35.910 10.713 1.00 0.00 H ATOM 28003 H2 WAT 4581 83.327 35.227 9.366 1.00 0.00 H TER 28005 WAT 4581 ATOM 28005 O WAT 4582 26.871 55.606 125.258 1.00 0.00 O ATOM 28006 H1 WAT 4582 26.094 55.187 125.628 1.00 0.00 H ATOM 28007 H2 WAT 4582 26.567 56.469 124.976 1.00 0.00 H TER 28009 WAT 4582 ATOM 28009 O WAT 4583 133.324 107.125 15.487 1.00 0.00 O ATOM 28010 H1 WAT 4583 133.048 106.209 15.464 1.00 0.00 H ATOM 28011 H2 WAT 4583 134.216 107.115 15.140 1.00 0.00 H TER 28013 WAT 4583 ATOM 28013 O WAT 4584 145.681 89.507 14.769 1.00 0.00 O ATOM 28014 H1 WAT 4584 145.466 90.233 14.183 1.00 0.00 H ATOM 28015 H2 WAT 4584 144.927 88.921 14.710 1.00 0.00 H TER 28017 WAT 4584 ATOM 28017 O WAT 4585 133.616 128.226 151.743 1.00 0.00 O ATOM 28018 H1 WAT 4585 133.523 128.655 152.593 1.00 0.00 H ATOM 28019 H2 WAT 4585 133.726 128.946 151.122 1.00 0.00 H TER 28021 WAT 4585 ATOM 28021 O WAT 4586 115.001 49.271 105.668 1.00 0.00 O ATOM 28022 H1 WAT 4586 114.803 48.535 106.247 1.00 0.00 H ATOM 28023 H2 WAT 4586 114.191 49.779 105.640 1.00 0.00 H TER 28025 WAT 4586 ATOM 28025 O WAT 4587 5.497 43.511 135.566 1.00 0.00 O ATOM 28026 H1 WAT 4587 4.558 43.418 135.726 1.00 0.00 H ATOM 28027 H2 WAT 4587 5.899 43.406 136.428 1.00 0.00 H TER 28029 WAT 4587 ATOM 28029 O WAT 4588 14.458 67.116 13.307 1.00 0.00 O ATOM 28030 H1 WAT 4588 14.692 66.820 14.186 1.00 0.00 H ATOM 28031 H2 WAT 4588 13.580 66.764 13.162 1.00 0.00 H TER 28033 WAT 4588 ATOM 28033 O WAT 4589 11.594 72.887 136.946 1.00 0.00 O ATOM 28034 H1 WAT 4589 12.186 72.205 137.265 1.00 0.00 H ATOM 28035 H2 WAT 4589 12.054 73.707 137.127 1.00 0.00 H TER 28037 WAT 4589 ATOM 28037 O WAT 4590 110.545 99.717 60.974 1.00 0.00 O ATOM 28038 H1 WAT 4590 110.035 99.941 61.753 1.00 0.00 H ATOM 28039 H2 WAT 4590 110.733 98.783 61.071 1.00 0.00 H TER 28041 WAT 4590 ATOM 28041 O WAT 4591 18.664 0.055 111.468 1.00 0.00 O ATOM 28042 H1 WAT 4591 17.751 -0.112 111.700 1.00 0.00 H ATOM 28043 H2 WAT 4591 18.956 0.712 112.099 1.00 0.00 H TER 28045 WAT 4591 ATOM 28045 O WAT 4592 7.114 34.199 139.955 1.00 0.00 O ATOM 28046 H1 WAT 4592 7.019 35.013 139.460 1.00 0.00 H ATOM 28047 H2 WAT 4592 7.010 34.462 140.870 1.00 0.00 H TER 28049 WAT 4592 ATOM 28049 O WAT 4593 126.561 43.863 140.930 1.00 0.00 O ATOM 28050 H1 WAT 4593 126.303 43.217 140.272 1.00 0.00 H ATOM 28051 H2 WAT 4593 125.753 44.332 141.136 1.00 0.00 H TER 28053 WAT 4593 ATOM 28053 O WAT 4594 64.258 96.417 131.875 1.00 0.00 O ATOM 28054 H1 WAT 4594 63.655 97.094 132.183 1.00 0.00 H ATOM 28055 H2 WAT 4594 64.156 95.702 132.503 1.00 0.00 H TER 28057 WAT 4594 ATOM 28057 O WAT 4595 67.169 131.366 129.283 1.00 0.00 O ATOM 28058 H1 WAT 4595 67.622 131.370 128.439 1.00 0.00 H ATOM 28059 H2 WAT 4595 67.563 130.638 129.763 1.00 0.00 H TER 28061 WAT 4595 ATOM 28061 O WAT 4596 69.097 95.476 121.708 1.00 0.00 O ATOM 28062 H1 WAT 4596 68.269 95.847 121.402 1.00 0.00 H ATOM 28063 H2 WAT 4596 69.533 95.172 120.912 1.00 0.00 H TER 28065 WAT 4596 ATOM 28065 O WAT 4597 38.683 91.526 77.684 1.00 0.00 O ATOM 28066 H1 WAT 4597 39.092 90.675 77.843 1.00 0.00 H ATOM 28067 H2 WAT 4597 38.418 91.830 78.552 1.00 0.00 H TER 28069 WAT 4597 ATOM 28069 O WAT 4598 0.839 134.210 7.095 1.00 0.00 O ATOM 28070 H1 WAT 4598 0.456 135.086 7.043 1.00 0.00 H ATOM 28071 H2 WAT 4598 0.171 133.634 6.724 1.00 0.00 H TER 28073 WAT 4598 ATOM 28073 O WAT 4599 102.663 117.627 110.817 1.00 0.00 O ATOM 28074 H1 WAT 4599 102.746 118.542 111.083 1.00 0.00 H ATOM 28075 H2 WAT 4599 103.081 117.133 111.523 1.00 0.00 H TER 28077 WAT 4599 ATOM 28077 O WAT 4600 87.935 57.492 115.995 1.00 0.00 O ATOM 28078 H1 WAT 4600 87.058 57.855 115.876 1.00 0.00 H ATOM 28079 H2 WAT 4600 88.381 57.666 115.167 1.00 0.00 H TER 28081 WAT 4600 ATOM 28081 O WAT 4601 20.155 7.870 76.493 1.00 0.00 O ATOM 28082 H1 WAT 4601 20.557 8.609 76.035 1.00 0.00 H ATOM 28083 H2 WAT 4601 20.737 7.131 76.313 1.00 0.00 H TER 28085 WAT 4601 ATOM 28085 O WAT 4602 134.607 62.931 112.650 1.00 0.00 O ATOM 28086 H1 WAT 4602 134.111 62.211 113.039 1.00 0.00 H ATOM 28087 H2 WAT 4602 133.943 63.579 112.414 1.00 0.00 H TER 28089 WAT 4602 ATOM 28089 O WAT 4603 108.909 87.775 140.233 1.00 0.00 O ATOM 28090 H1 WAT 4603 108.259 88.328 140.667 1.00 0.00 H ATOM 28091 H2 WAT 4603 108.454 87.426 139.467 1.00 0.00 H TER 28093 WAT 4603 ATOM 28093 O WAT 4604 38.318 62.498 136.614 1.00 0.00 O ATOM 28094 H1 WAT 4604 37.677 62.124 137.220 1.00 0.00 H ATOM 28095 H2 WAT 4604 39.032 62.799 137.176 1.00 0.00 H TER 28097 WAT 4604 ATOM 28097 O WAT 4605 22.691 72.417 131.444 1.00 0.00 O ATOM 28098 H1 WAT 4605 22.375 72.560 132.336 1.00 0.00 H ATOM 28099 H2 WAT 4605 22.540 73.252 131.000 1.00 0.00 H TER 28101 WAT 4605 ATOM 28101 O WAT 4606 70.636 134.413 139.587 1.00 0.00 O ATOM 28102 H1 WAT 4606 71.047 133.648 139.988 1.00 0.00 H ATOM 28103 H2 WAT 4606 71.175 135.151 139.870 1.00 0.00 H TER 28105 WAT 4606 ATOM 28105 O WAT 4607 42.032 81.529 109.012 1.00 0.00 O ATOM 28106 H1 WAT 4607 41.161 81.712 109.365 1.00 0.00 H ATOM 28107 H2 WAT 4607 41.920 80.727 108.502 1.00 0.00 H TER 28109 WAT 4607 ATOM 28109 O WAT 4608 70.442 143.673 7.676 1.00 0.00 O ATOM 28110 H1 WAT 4608 70.746 143.214 8.459 1.00 0.00 H ATOM 28111 H2 WAT 4608 69.901 144.388 8.013 1.00 0.00 H TER 28113 WAT 4608 ATOM 28113 O WAT 4609 66.059 117.590 100.744 1.00 0.00 O ATOM 28114 H1 WAT 4609 66.226 116.716 100.390 1.00 0.00 H ATOM 28115 H2 WAT 4609 65.109 117.694 100.686 1.00 0.00 H TER 28117 WAT 4609 ATOM 28117 O WAT 4610 33.315 71.377 75.431 1.00 0.00 O ATOM 28118 H1 WAT 4610 33.873 71.669 74.710 1.00 0.00 H ATOM 28119 H2 WAT 4610 32.844 72.164 75.703 1.00 0.00 H TER 28121 WAT 4610 ATOM 28121 O WAT 4611 87.742 120.973 139.987 1.00 0.00 O ATOM 28122 H1 WAT 4611 87.871 121.651 140.650 1.00 0.00 H ATOM 28123 H2 WAT 4611 86.931 121.222 139.543 1.00 0.00 H TER 28125 WAT 4611 ATOM 28125 O WAT 4612 136.370 144.437 103.018 1.00 0.00 O ATOM 28126 H1 WAT 4612 135.419 144.373 102.939 1.00 0.00 H ATOM 28127 H2 WAT 4612 136.510 144.955 103.810 1.00 0.00 H TER 28129 WAT 4612 ATOM 28129 O WAT 4613 13.566 107.581 137.460 1.00 0.00 O ATOM 28130 H1 WAT 4613 14.157 107.201 138.109 1.00 0.00 H ATOM 28131 H2 WAT 4613 14.145 107.920 136.777 1.00 0.00 H TER 28133 WAT 4613 ATOM 28133 O WAT 4614 93.101 42.710 117.503 1.00 0.00 O ATOM 28134 H1 WAT 4614 93.587 42.388 118.263 1.00 0.00 H ATOM 28135 H2 WAT 4614 93.365 42.132 116.788 1.00 0.00 H TER 28137 WAT 4614 ATOM 28137 O WAT 4615 57.467 132.710 126.671 1.00 0.00 O ATOM 28138 H1 WAT 4615 56.740 132.601 126.058 1.00 0.00 H ATOM 28139 H2 WAT 4615 57.688 133.639 126.618 1.00 0.00 H TER 28141 WAT 4615 ATOM 28141 O WAT 4616 120.121 140.954 127.189 1.00 0.00 O ATOM 28142 H1 WAT 4616 119.832 140.164 127.647 1.00 0.00 H ATOM 28143 H2 WAT 4616 119.533 141.024 126.437 1.00 0.00 H TER 28145 WAT 4616 ATOM 28145 O WAT 4617 83.427 88.446 65.234 1.00 0.00 O ATOM 28146 H1 WAT 4617 84.311 88.685 64.954 1.00 0.00 H ATOM 28147 H2 WAT 4617 82.850 88.933 64.646 1.00 0.00 H TER 28149 WAT 4617 ATOM 28149 O WAT 4618 66.912 134.143 129.430 1.00 0.00 O ATOM 28150 H1 WAT 4618 66.812 133.191 129.431 1.00 0.00 H ATOM 28151 H2 WAT 4618 67.109 134.363 128.519 1.00 0.00 H TER 28153 WAT 4618 ATOM 28153 O WAT 4619 119.534 46.781 124.774 1.00 0.00 O ATOM 28154 H1 WAT 4619 120.468 46.733 124.571 1.00 0.00 H ATOM 28155 H2 WAT 4619 119.382 46.053 125.376 1.00 0.00 H TER 28157 WAT 4619 ATOM 28157 O WAT 4620 80.458 43.316 13.636 1.00 0.00 O ATOM 28158 H1 WAT 4620 80.103 42.552 14.090 1.00 0.00 H ATOM 28159 H2 WAT 4620 80.431 43.079 12.709 1.00 0.00 H TER 28161 WAT 4620 ATOM 28161 O WAT 4621 25.405 33.007 143.912 1.00 0.00 O ATOM 28162 H1 WAT 4621 24.849 33.665 143.494 1.00 0.00 H ATOM 28163 H2 WAT 4621 25.366 32.252 143.325 1.00 0.00 H TER 28165 WAT 4621 ATOM 28165 O WAT 4622 128.406 82.408 152.261 1.00 0.00 O ATOM 28166 H1 WAT 4622 128.363 81.875 151.467 1.00 0.00 H ATOM 28167 H2 WAT 4622 127.826 81.964 152.879 1.00 0.00 H TER 28169 WAT 4622 ATOM 28169 O WAT 4623 75.030 3.945 123.971 1.00 0.00 O ATOM 28170 H1 WAT 4623 75.491 3.129 124.167 1.00 0.00 H ATOM 28171 H2 WAT 4623 74.346 4.000 124.639 1.00 0.00 H TER 28173 WAT 4623 ATOM 28173 O WAT 4624 40.933 43.679 63.360 1.00 0.00 O ATOM 28174 H1 WAT 4624 41.089 43.977 62.464 1.00 0.00 H ATOM 28175 H2 WAT 4624 41.776 43.326 63.645 1.00 0.00 H TER 28177 WAT 4624 ATOM 28177 O WAT 4625 99.626 142.115 69.040 1.00 0.00 O ATOM 28178 H1 WAT 4625 99.475 143.022 68.776 1.00 0.00 H ATOM 28179 H2 WAT 4625 100.579 142.023 69.046 1.00 0.00 H TER 28181 WAT 4625 ATOM 28181 O WAT 4626 99.643 11.084 12.786 1.00 0.00 O ATOM 28182 H1 WAT 4626 99.261 11.417 11.974 1.00 0.00 H ATOM 28183 H2 WAT 4626 98.913 10.663 13.240 1.00 0.00 H TER 28185 WAT 4626 ATOM 28185 O WAT 4627 98.673 68.544 116.002 1.00 0.00 O ATOM 28186 H1 WAT 4627 99.472 68.025 116.084 1.00 0.00 H ATOM 28187 H2 WAT 4627 98.109 68.027 115.426 1.00 0.00 H TER 28189 WAT 4627 ATOM 28189 O WAT 4628 98.850 102.214 5.788 1.00 0.00 O ATOM 28190 H1 WAT 4628 99.426 101.449 5.769 1.00 0.00 H ATOM 28191 H2 WAT 4628 98.358 102.123 6.604 1.00 0.00 H TER 28193 WAT 4628 ATOM 28193 O WAT 4629 49.646 22.562 74.803 1.00 0.00 O ATOM 28194 H1 WAT 4629 49.429 22.686 75.728 1.00 0.00 H ATOM 28195 H2 WAT 4629 48.883 22.896 74.332 1.00 0.00 H TER 28197 WAT 4629 ATOM 28197 O WAT 4630 51.915 99.529 139.756 1.00 0.00 O ATOM 28198 H1 WAT 4630 51.130 99.712 140.272 1.00 0.00 H ATOM 28199 H2 WAT 4630 52.364 100.373 139.696 1.00 0.00 H TER 28201 WAT 4630 ATOM 28201 O WAT 4631 17.219 30.084 94.156 1.00 0.00 O ATOM 28202 H1 WAT 4631 18.016 30.547 93.900 1.00 0.00 H ATOM 28203 H2 WAT 4631 16.725 29.989 93.342 1.00 0.00 H TER 28205 WAT 4631 ATOM 28205 O WAT 4632 15.463 52.980 58.162 1.00 0.00 O ATOM 28206 H1 WAT 4632 15.629 52.153 58.615 1.00 0.00 H ATOM 28207 H2 WAT 4632 14.775 52.774 57.530 1.00 0.00 H TER 28209 WAT 4632 ATOM 28209 O WAT 4633 33.334 19.008 109.763 1.00 0.00 O ATOM 28210 H1 WAT 4633 34.097 19.213 110.302 1.00 0.00 H ATOM 28211 H2 WAT 4633 33.687 18.890 108.881 1.00 0.00 H TER 28213 WAT 4633 ATOM 28213 O WAT 4634 57.743 61.418 9.146 1.00 0.00 O ATOM 28214 H1 WAT 4634 57.826 62.310 9.485 1.00 0.00 H ATOM 28215 H2 WAT 4634 57.831 61.514 8.198 1.00 0.00 H TER 28217 WAT 4634 ATOM 28217 O WAT 4635 83.117 42.186 23.030 1.00 0.00 O ATOM 28218 H1 WAT 4635 82.828 41.619 23.745 1.00 0.00 H ATOM 28219 H2 WAT 4635 83.132 43.064 23.411 1.00 0.00 H TER 28221 WAT 4635 ATOM 28221 O WAT 4636 135.383 44.792 22.965 1.00 0.00 O ATOM 28222 H1 WAT 4636 134.468 45.029 23.112 1.00 0.00 H ATOM 28223 H2 WAT 4636 135.578 44.152 23.649 1.00 0.00 H TER 28225 WAT 4636 ATOM 28225 O WAT 4637 114.594 119.585 59.540 1.00 0.00 O ATOM 28226 H1 WAT 4637 113.733 119.186 59.664 1.00 0.00 H ATOM 28227 H2 WAT 4637 114.717 119.602 58.591 1.00 0.00 H TER 28229 WAT 4637 ATOM 28229 O WAT 4638 15.272 126.186 78.277 1.00 0.00 O ATOM 28230 H1 WAT 4638 15.324 125.233 78.360 1.00 0.00 H ATOM 28231 H2 WAT 4638 15.123 126.337 77.343 1.00 0.00 H TER 28233 WAT 4638 ATOM 28233 O WAT 4639 95.245 128.265 98.065 1.00 0.00 O ATOM 28234 H1 WAT 4639 94.449 128.711 98.355 1.00 0.00 H ATOM 28235 H2 WAT 4639 95.233 128.350 97.111 1.00 0.00 H TER 28237 WAT 4639 ATOM 28237 O WAT 4640 36.780 88.385 121.513 1.00 0.00 O ATOM 28238 H1 WAT 4640 37.286 88.541 120.716 1.00 0.00 H ATOM 28239 H2 WAT 4640 35.878 88.288 121.209 1.00 0.00 H TER 28241 WAT 4640 ATOM 28241 O WAT 4641 141.451 40.066 154.813 1.00 0.00 O ATOM 28242 H1 WAT 4641 141.519 40.122 153.860 1.00 0.00 H ATOM 28243 H2 WAT 4641 141.159 40.936 155.084 1.00 0.00 H TER 28245 WAT 4641 ATOM 28245 O WAT 4642 67.051 131.560 100.767 1.00 0.00 O ATOM 28246 H1 WAT 4642 67.228 132.472 100.994 1.00 0.00 H ATOM 28247 H2 WAT 4642 67.829 131.085 101.059 1.00 0.00 H TER 28249 WAT 4642 ATOM 28249 O WAT 4643 114.243 29.838 133.043 1.00 0.00 O ATOM 28250 H1 WAT 4643 113.539 30.138 132.467 1.00 0.00 H ATOM 28251 H2 WAT 4643 114.232 28.885 132.958 1.00 0.00 H TER 28253 WAT 4643 ATOM 28253 O WAT 4644 42.245 78.090 138.509 1.00 0.00 O ATOM 28254 H1 WAT 4644 43.027 78.626 138.647 1.00 0.00 H ATOM 28255 H2 WAT 4644 41.625 78.678 138.078 1.00 0.00 H TER 28257 WAT 4644 ATOM 28257 O WAT 4645 86.303 30.513 133.917 1.00 0.00 O ATOM 28258 H1 WAT 4645 85.992 30.060 133.133 1.00 0.00 H ATOM 28259 H2 WAT 4645 86.532 29.810 134.525 1.00 0.00 H TER 28261 WAT 4645 ATOM 28261 O WAT 4646 84.361 23.213 7.572 1.00 0.00 O ATOM 28262 H1 WAT 4646 84.343 22.257 7.595 1.00 0.00 H ATOM 28263 H2 WAT 4646 84.649 23.469 8.448 1.00 0.00 H TER 28265 WAT 4646 ATOM 28265 O WAT 4647 39.560 50.212 8.072 1.00 0.00 O ATOM 28266 H1 WAT 4647 38.799 49.846 8.523 1.00 0.00 H ATOM 28267 H2 WAT 4647 40.312 49.882 8.564 1.00 0.00 H TER 28269 WAT 4647 ATOM 28269 O WAT 4648 56.353 51.591 110.870 1.00 0.00 O ATOM 28270 H1 WAT 4648 56.865 52.231 110.375 1.00 0.00 H ATOM 28271 H2 WAT 4648 56.980 50.903 111.091 1.00 0.00 H TER 28273 WAT 4648 ATOM 28273 O WAT 4649 116.219 101.635 67.696 1.00 0.00 O ATOM 28274 H1 WAT 4649 116.209 100.822 67.192 1.00 0.00 H ATOM 28275 H2 WAT 4649 115.718 101.433 68.487 1.00 0.00 H TER 28277 WAT 4649 ATOM 28277 O WAT 4650 101.364 18.658 130.376 1.00 0.00 O ATOM 28278 H1 WAT 4650 101.839 19.222 129.766 1.00 0.00 H ATOM 28279 H2 WAT 4650 101.088 19.246 131.079 1.00 0.00 H TER 28281 WAT 4650 ATOM 28281 O WAT 4651 139.184 127.483 91.011 1.00 0.00 O ATOM 28282 H1 WAT 4651 138.248 127.577 90.833 1.00 0.00 H ATOM 28283 H2 WAT 4651 139.272 127.678 91.944 1.00 0.00 H TER 28285 WAT 4651 ATOM 28285 O WAT 4652 43.466 3.284 57.609 1.00 0.00 O ATOM 28286 H1 WAT 4652 43.785 2.404 57.407 1.00 0.00 H ATOM 28287 H2 WAT 4652 42.533 3.165 57.785 1.00 0.00 H TER 28289 WAT 4652 ATOM 28289 O WAT 4653 36.427 19.187 82.384 1.00 0.00 O ATOM 28290 H1 WAT 4653 36.317 18.908 83.293 1.00 0.00 H ATOM 28291 H2 WAT 4653 35.538 19.203 82.030 1.00 0.00 H TER 28293 WAT 4653 ATOM 28293 O WAT 4654 105.457 127.966 137.747 1.00 0.00 O ATOM 28294 H1 WAT 4654 105.395 128.736 137.181 1.00 0.00 H ATOM 28295 H2 WAT 4654 105.915 128.279 138.527 1.00 0.00 H TER 28297 WAT 4654 ATOM 28297 O WAT 4655 124.006 31.488 57.682 1.00 0.00 O ATOM 28298 H1 WAT 4655 124.041 31.570 56.729 1.00 0.00 H ATOM 28299 H2 WAT 4655 123.588 32.296 57.977 1.00 0.00 H TER 28301 WAT 4655 ATOM 28301 O WAT 4656 22.946 76.175 109.516 1.00 0.00 O ATOM 28302 H1 WAT 4656 23.804 76.386 109.884 1.00 0.00 H ATOM 28303 H2 WAT 4656 22.534 75.615 110.175 1.00 0.00 H TER 28305 WAT 4656 ATOM 28305 O WAT 4657 69.715 140.751 121.278 1.00 0.00 O ATOM 28306 H1 WAT 4657 70.242 141.533 121.111 1.00 0.00 H ATOM 28307 H2 WAT 4657 70.294 140.174 121.776 1.00 0.00 H TER 28309 WAT 4657 ATOM 28309 O WAT 4658 71.885 112.897 83.372 1.00 0.00 O ATOM 28310 H1 WAT 4658 71.466 112.955 84.230 1.00 0.00 H ATOM 28311 H2 WAT 4658 71.991 113.807 83.094 1.00 0.00 H TER 28313 WAT 4658 ATOM 28313 O WAT 4659 73.804 55.214 75.298 1.00 0.00 O ATOM 28314 H1 WAT 4659 74.223 54.383 75.523 1.00 0.00 H ATOM 28315 H2 WAT 4659 74.529 55.834 75.223 1.00 0.00 H TER 28317 WAT 4659 ATOM 28317 O WAT 4660 139.092 66.301 96.564 1.00 0.00 O ATOM 28318 H1 WAT 4660 138.863 65.384 96.412 1.00 0.00 H ATOM 28319 H2 WAT 4660 138.468 66.795 96.033 1.00 0.00 H TER 28321 WAT 4660 ATOM 28321 O WAT 4661 49.143 100.921 155.926 1.00 0.00 O ATOM 28322 H1 WAT 4661 49.665 101.233 155.187 1.00 0.00 H ATOM 28323 H2 WAT 4661 49.264 99.971 155.920 1.00 0.00 H TER 28325 WAT 4661 ATOM 28325 O WAT 4662 100.347 102.419 154.770 1.00 0.00 O ATOM 28326 H1 WAT 4662 99.780 101.649 154.724 1.00 0.00 H ATOM 28327 H2 WAT 4662 101.128 102.170 154.275 1.00 0.00 H TER 28329 WAT 4662 ATOM 28329 O WAT 4663 103.093 12.725 57.936 1.00 0.00 O ATOM 28330 H1 WAT 4663 102.873 13.516 57.444 1.00 0.00 H ATOM 28331 H2 WAT 4663 102.956 12.010 57.314 1.00 0.00 H TER 28333 WAT 4663 ATOM 28333 O WAT 4664 78.479 79.609 69.337 1.00 0.00 O ATOM 28334 H1 WAT 4664 78.749 80.108 70.108 1.00 0.00 H ATOM 28335 H2 WAT 4664 77.967 78.881 69.690 1.00 0.00 H TER 28337 WAT 4664 ATOM 28337 O WAT 4665 28.639 51.769 61.993 1.00 0.00 O ATOM 28338 H1 WAT 4665 29.103 52.590 61.827 1.00 0.00 H ATOM 28339 H2 WAT 4665 28.554 51.364 61.130 1.00 0.00 H TER 28341 WAT 4665 ATOM 28341 O WAT 4666 131.631 20.540 82.756 1.00 0.00 O ATOM 28342 H1 WAT 4666 131.097 20.051 83.383 1.00 0.00 H ATOM 28343 H2 WAT 4666 131.007 20.841 82.095 1.00 0.00 H TER 28345 WAT 4666 ATOM 28345 O WAT 4667 10.472 66.886 2.406 1.00 0.00 O ATOM 28346 H1 WAT 4667 10.762 67.668 2.876 1.00 0.00 H ATOM 28347 H2 WAT 4667 9.573 66.747 2.705 1.00 0.00 H TER 28349 WAT 4667 ATOM 28349 O WAT 4668 42.787 137.261 152.829 1.00 0.00 O ATOM 28350 H1 WAT 4668 42.875 138.122 152.422 1.00 0.00 H ATOM 28351 H2 WAT 4668 42.448 137.443 153.705 1.00 0.00 H TER 28353 WAT 4668 ATOM 28353 O WAT 4669 118.226 52.114 72.329 1.00 0.00 O ATOM 28354 H1 WAT 4669 118.456 53.012 72.092 1.00 0.00 H ATOM 28355 H2 WAT 4669 118.422 51.602 71.544 1.00 0.00 H TER 28357 WAT 4669 ATOM 28357 O WAT 4670 80.013 94.798 23.776 1.00 0.00 O ATOM 28358 H1 WAT 4670 80.367 95.503 24.317 1.00 0.00 H ATOM 28359 H2 WAT 4670 79.735 94.130 24.403 1.00 0.00 H TER 28361 WAT 4670 ATOM 28361 O WAT 4671 72.631 15.799 119.552 1.00 0.00 O ATOM 28362 H1 WAT 4671 72.961 15.597 118.676 1.00 0.00 H ATOM 28363 H2 WAT 4671 73.411 16.038 120.053 1.00 0.00 H TER 28365 WAT 4671 ATOM 28365 O WAT 4672 141.195 123.545 25.586 1.00 0.00 O ATOM 28366 H1 WAT 4672 141.205 122.635 25.288 1.00 0.00 H ATOM 28367 H2 WAT 4672 141.635 124.030 24.888 1.00 0.00 H TER 28369 WAT 4672 ATOM 28369 O WAT 4673 13.579 12.890 18.886 1.00 0.00 O ATOM 28370 H1 WAT 4673 13.438 12.978 19.828 1.00 0.00 H ATOM 28371 H2 WAT 4673 13.728 13.785 18.581 1.00 0.00 H TER 28373 WAT 4673 ATOM 28373 O WAT 4674 132.231 53.825 145.323 1.00 0.00 O ATOM 28374 H1 WAT 4674 132.822 54.016 146.051 1.00 0.00 H ATOM 28375 H2 WAT 4674 132.608 53.051 144.905 1.00 0.00 H TER 28377 WAT 4674 ATOM 28377 O WAT 4675 48.825 6.512 49.463 1.00 0.00 O ATOM 28378 H1 WAT 4675 49.659 6.424 49.001 1.00 0.00 H ATOM 28379 H2 WAT 4675 48.873 7.372 49.881 1.00 0.00 H TER 28381 WAT 4675 ATOM 28381 O WAT 4676 20.103 25.044 28.399 1.00 0.00 O ATOM 28382 H1 WAT 4676 20.076 25.434 27.525 1.00 0.00 H ATOM 28383 H2 WAT 4676 21.026 24.833 28.538 1.00 0.00 H TER 28385 WAT 4676 ATOM 28385 O WAT 4677 141.721 0.250 82.971 1.00 0.00 O ATOM 28386 H1 WAT 4677 142.502 0.802 83.021 1.00 0.00 H ATOM 28387 H2 WAT 4677 141.110 0.642 83.594 1.00 0.00 H TER 28389 WAT 4677 ATOM 28389 O WAT 4678 111.674 57.353 117.987 1.00 0.00 O ATOM 28390 H1 WAT 4678 112.320 57.590 118.652 1.00 0.00 H ATOM 28391 H2 WAT 4678 111.395 56.470 118.228 1.00 0.00 H TER 28393 WAT 4678 ATOM 28393 O WAT 4679 125.349 131.504 73.145 1.00 0.00 O ATOM 28394 H1 WAT 4679 125.156 132.292 72.636 1.00 0.00 H ATOM 28395 H2 WAT 4679 124.903 131.643 73.980 1.00 0.00 H TER 28397 WAT 4679 ATOM 28397 O WAT 4680 51.979 109.544 18.503 1.00 0.00 O ATOM 28398 H1 WAT 4680 52.734 109.462 19.085 1.00 0.00 H ATOM 28399 H2 WAT 4680 51.246 109.739 19.087 1.00 0.00 H TER 28401 WAT 4680 ATOM 28401 O WAT 4681 111.072 36.098 66.656 1.00 0.00 O ATOM 28402 H1 WAT 4681 111.971 36.419 66.731 1.00 0.00 H ATOM 28403 H2 WAT 4681 110.530 36.881 66.751 1.00 0.00 H TER 28405 WAT 4681 ATOM 28405 O WAT 4682 39.810 80.872 81.766 1.00 0.00 O ATOM 28406 H1 WAT 4682 39.960 80.993 82.704 1.00 0.00 H ATOM 28407 H2 WAT 4682 40.454 81.441 81.345 1.00 0.00 H TER 28409 WAT 4682 ATOM 28409 O WAT 4683 26.937 132.673 100.196 1.00 0.00 O ATOM 28410 H1 WAT 4683 26.719 132.557 101.121 1.00 0.00 H ATOM 28411 H2 WAT 4683 27.541 131.957 100.000 1.00 0.00 H TER 28413 WAT 4683 ATOM 28413 O WAT 4684 26.354 104.845 94.220 1.00 0.00 O ATOM 28414 H1 WAT 4684 26.959 105.563 94.035 1.00 0.00 H ATOM 28415 H2 WAT 4684 26.263 104.387 93.385 1.00 0.00 H TER 28417 WAT 4684 ATOM 28417 O WAT 4685 130.911 52.386 89.165 1.00 0.00 O ATOM 28418 H1 WAT 4685 131.557 52.965 88.760 1.00 0.00 H ATOM 28419 H2 WAT 4685 130.132 52.932 89.268 1.00 0.00 H TER 28421 WAT 4685 ATOM 28421 O WAT 4686 1.447 145.291 89.867 1.00 0.00 O ATOM 28422 H1 WAT 4686 1.486 145.758 89.033 1.00 0.00 H ATOM 28423 H2 WAT 4686 2.227 145.580 90.340 1.00 0.00 H TER 28425 WAT 4686 ATOM 28425 O WAT 4687 118.708 6.176 135.259 1.00 0.00 O ATOM 28426 H1 WAT 4687 118.291 7.012 135.047 1.00 0.00 H ATOM 28427 H2 WAT 4687 118.086 5.740 135.842 1.00 0.00 H TER 28429 WAT 4687 ATOM 28429 O WAT 4688 30.549 38.175 114.850 1.00 0.00 O ATOM 28430 H1 WAT 4688 31.036 37.354 114.925 1.00 0.00 H ATOM 28431 H2 WAT 4688 30.641 38.424 113.931 1.00 0.00 H TER 28433 WAT 4688 ATOM 28433 O WAT 4689 54.809 61.182 90.198 1.00 0.00 O ATOM 28434 H1 WAT 4689 55.238 61.621 90.934 1.00 0.00 H ATOM 28435 H2 WAT 4689 54.584 61.891 89.596 1.00 0.00 H TER 28437 WAT 4689 ATOM 28437 O WAT 4690 74.200 6.456 157.322 1.00 0.00 O ATOM 28438 H1 WAT 4690 74.151 6.358 156.371 1.00 0.00 H ATOM 28439 H2 WAT 4690 74.053 5.573 157.661 1.00 0.00 H TER 28441 WAT 4690 ATOM 28441 O WAT 4691 6.720 64.781 138.905 1.00 0.00 O ATOM 28442 H1 WAT 4691 6.756 64.997 137.973 1.00 0.00 H ATOM 28443 H2 WAT 4691 6.867 65.616 139.350 1.00 0.00 H TER 28445 WAT 4691 ATOM 28445 O WAT 4692 66.077 47.068 107.015 1.00 0.00 O ATOM 28446 H1 WAT 4692 65.998 47.967 107.333 1.00 0.00 H ATOM 28447 H2 WAT 4692 65.182 46.728 107.034 1.00 0.00 H TER 28449 WAT 4692 ATOM 28449 O WAT 4693 5.339 120.799 66.406 1.00 0.00 O ATOM 28450 H1 WAT 4693 5.868 121.448 66.870 1.00 0.00 H ATOM 28451 H2 WAT 4693 5.416 120.005 66.935 1.00 0.00 H TER 28453 WAT 4693 ATOM 28453 O WAT 4694 111.946 105.694 63.442 1.00 0.00 O ATOM 28454 H1 WAT 4694 111.877 106.175 62.617 1.00 0.00 H ATOM 28455 H2 WAT 4694 111.146 105.917 63.917 1.00 0.00 H TER 28457 WAT 4694 ATOM 28457 O WAT 4695 33.468 106.829 65.394 1.00 0.00 O ATOM 28458 H1 WAT 4695 32.918 107.607 65.308 1.00 0.00 H ATOM 28459 H2 WAT 4695 33.483 106.649 66.334 1.00 0.00 H TER 28461 WAT 4695 ATOM 28461 O WAT 4696 125.967 17.882 131.821 1.00 0.00 O ATOM 28462 H1 WAT 4696 125.514 18.671 131.523 1.00 0.00 H ATOM 28463 H2 WAT 4696 125.310 17.406 132.329 1.00 0.00 H TER 28465 WAT 4696 ATOM 28465 O WAT 4697 31.554 29.026 134.767 1.00 0.00 O ATOM 28466 H1 WAT 4697 31.207 29.220 133.896 1.00 0.00 H ATOM 28467 H2 WAT 4697 32.397 28.603 134.601 1.00 0.00 H TER 28469 WAT 4697 ATOM 28469 O WAT 4698 138.647 21.132 113.323 1.00 0.00 O ATOM 28470 H1 WAT 4698 137.896 20.953 112.757 1.00 0.00 H ATOM 28471 H2 WAT 4698 139.027 21.936 112.969 1.00 0.00 H TER 28473 WAT 4698 ATOM 28473 O WAT 4699 35.465 121.360 111.789 1.00 0.00 O ATOM 28474 H1 WAT 4699 34.643 121.444 111.305 1.00 0.00 H ATOM 28475 H2 WAT 4699 36.129 121.706 111.193 1.00 0.00 H TER 28477 WAT 4699 ATOM 28477 O WAT 4700 94.954 111.302 129.089 1.00 0.00 O ATOM 28478 H1 WAT 4700 94.330 111.797 128.558 1.00 0.00 H ATOM 28479 H2 WAT 4700 94.604 111.353 129.978 1.00 0.00 H TER 28481 WAT 4700 ATOM 28481 O WAT 4701 70.008 21.236 98.227 1.00 0.00 O ATOM 28482 H1 WAT 4701 69.502 21.865 98.741 1.00 0.00 H ATOM 28483 H2 WAT 4701 70.848 21.669 98.076 1.00 0.00 H TER 28485 WAT 4701 ATOM 28485 O WAT 4702 32.769 98.245 78.190 1.00 0.00 O ATOM 28486 H1 WAT 4702 32.843 98.329 77.240 1.00 0.00 H ATOM 28487 H2 WAT 4702 32.116 97.557 78.320 1.00 0.00 H TER 28489 WAT 4702 ATOM 28489 O WAT 4703 118.521 117.944 145.621 1.00 0.00 O ATOM 28490 H1 WAT 4703 118.802 117.041 145.770 1.00 0.00 H ATOM 28491 H2 WAT 4703 119.224 118.477 145.992 1.00 0.00 H TER 28493 WAT 4703 ATOM 28493 O WAT 4704 143.874 52.248 71.133 1.00 0.00 O ATOM 28494 H1 WAT 4704 144.181 52.720 70.359 1.00 0.00 H ATOM 28495 H2 WAT 4704 142.923 52.359 71.121 1.00 0.00 H TER 28497 WAT 4704 ATOM 28497 O WAT 4705 65.880 107.304 79.797 1.00 0.00 O ATOM 28498 H1 WAT 4705 65.077 107.249 80.316 1.00 0.00 H ATOM 28499 H2 WAT 4705 65.609 107.720 78.979 1.00 0.00 H TER 28501 WAT 4705 ATOM 28501 O WAT 4706 104.037 11.325 85.173 1.00 0.00 O ATOM 28502 H1 WAT 4706 104.819 11.410 85.719 1.00 0.00 H ATOM 28503 H2 WAT 4706 103.818 10.394 85.212 1.00 0.00 H TER 28505 WAT 4706 ATOM 28505 O WAT 4707 98.176 53.993 115.253 1.00 0.00 O ATOM 28506 H1 WAT 4707 98.087 53.317 114.581 1.00 0.00 H ATOM 28507 H2 WAT 4707 99.036 53.833 115.641 1.00 0.00 H TER 28509 WAT 4707 ATOM 28509 O WAT 4708 17.899 75.662 72.379 1.00 0.00 O ATOM 28510 H1 WAT 4708 18.225 74.909 72.872 1.00 0.00 H ATOM 28511 H2 WAT 4708 17.525 76.241 73.044 1.00 0.00 H TER 28513 WAT 4708 ATOM 28513 O WAT 4709 21.011 94.195 85.759 1.00 0.00 O ATOM 28514 H1 WAT 4709 21.711 93.596 85.500 1.00 0.00 H ATOM 28515 H2 WAT 4709 20.205 93.696 85.622 1.00 0.00 H TER 28517 WAT 4709 ATOM 28517 O WAT 4710 126.159 125.870 89.056 1.00 0.00 O ATOM 28518 H1 WAT 4710 125.467 125.314 89.413 1.00 0.00 H ATOM 28519 H2 WAT 4710 125.697 126.514 88.519 1.00 0.00 H TER 28521 WAT 4710 ATOM 28521 O WAT 4711 50.652 93.588 122.402 1.00 0.00 O ATOM 28522 H1 WAT 4711 51.576 93.541 122.647 1.00 0.00 H ATOM 28523 H2 WAT 4711 50.597 94.344 121.818 1.00 0.00 H TER 28525 WAT 4711 ATOM 28525 O WAT 4712 60.781 10.130 107.704 1.00 0.00 O ATOM 28526 H1 WAT 4712 60.193 10.509 108.357 1.00 0.00 H ATOM 28527 H2 WAT 4712 61.189 9.388 108.151 1.00 0.00 H TER 28529 WAT 4712 ATOM 28529 O WAT 4713 26.011 45.425 138.888 1.00 0.00 O ATOM 28530 H1 WAT 4713 26.473 45.665 138.085 1.00 0.00 H ATOM 28531 H2 WAT 4713 25.827 46.260 139.317 1.00 0.00 H TER 28533 WAT 4713 ATOM 28533 O WAT 4714 2.549 12.980 98.850 1.00 0.00 O ATOM 28534 H1 WAT 4714 3.432 12.734 98.571 1.00 0.00 H ATOM 28535 H2 WAT 4714 2.292 13.676 98.246 1.00 0.00 H TER 28537 WAT 4714 ATOM 28537 O WAT 4715 74.609 6.252 72.096 1.00 0.00 O ATOM 28538 H1 WAT 4715 73.804 5.752 71.956 1.00 0.00 H ATOM 28539 H2 WAT 4715 74.692 6.796 71.313 1.00 0.00 H TER 28541 WAT 4715 ATOM 28541 O WAT 4716 123.471 13.583 10.338 1.00 0.00 O ATOM 28542 H1 WAT 4716 123.193 12.994 11.039 1.00 0.00 H ATOM 28543 H2 WAT 4716 123.597 14.427 10.770 1.00 0.00 H TER 28545 WAT 4716 ATOM 28545 O WAT 4717 122.593 11.553 154.556 1.00 0.00 O ATOM 28546 H1 WAT 4717 122.633 11.989 153.705 1.00 0.00 H ATOM 28547 H2 WAT 4717 123.025 12.161 155.156 1.00 0.00 H TER 28549 WAT 4717 ATOM 28549 O WAT 4718 29.693 28.525 156.009 1.00 0.00 O ATOM 28550 H1 WAT 4718 30.230 29.279 156.252 1.00 0.00 H ATOM 28551 H2 WAT 4718 28.950 28.902 155.537 1.00 0.00 H TER 28553 WAT 4718 ATOM 28553 O WAT 4719 6.577 111.904 88.913 1.00 0.00 O ATOM 28554 H1 WAT 4719 6.661 111.539 89.794 1.00 0.00 H ATOM 28555 H2 WAT 4719 6.121 111.225 88.415 1.00 0.00 H TER 28557 WAT 4719 ATOM 28557 O WAT 4720 91.472 36.329 150.594 1.00 0.00 O ATOM 28558 H1 WAT 4720 90.835 36.901 151.023 1.00 0.00 H ATOM 28559 H2 WAT 4720 91.093 35.452 150.667 1.00 0.00 H TER 28561 WAT 4720 ATOM 28561 O WAT 4721 86.735 -0.068 88.964 1.00 0.00 O ATOM 28562 H1 WAT 4721 87.591 0.359 88.932 1.00 0.00 H ATOM 28563 H2 WAT 4721 86.123 0.638 89.173 1.00 0.00 H TER 28565 WAT 4721 ATOM 28565 O WAT 4722 67.195 83.995 143.281 1.00 0.00 O ATOM 28566 H1 WAT 4722 67.093 83.694 142.378 1.00 0.00 H ATOM 28567 H2 WAT 4722 67.871 83.426 143.648 1.00 0.00 H TER 28569 WAT 4722 ATOM 28569 O WAT 4723 36.329 27.045 56.086 1.00 0.00 O ATOM 28570 H1 WAT 4723 36.117 27.757 56.690 1.00 0.00 H ATOM 28571 H2 WAT 4723 37.109 27.350 55.621 1.00 0.00 H TER 28573 WAT 4723 ATOM 28573 O WAT 4724 114.196 114.654 116.613 1.00 0.00 O ATOM 28574 H1 WAT 4724 114.971 114.166 116.336 1.00 0.00 H ATOM 28575 H2 WAT 4724 114.530 115.304 117.232 1.00 0.00 H TER 28577 WAT 4724 ATOM 28577 O WAT 4725 83.234 19.221 81.028 1.00 0.00 O ATOM 28578 H1 WAT 4725 84.185 19.237 81.139 1.00 0.00 H ATOM 28579 H2 WAT 4725 83.095 19.475 80.116 1.00 0.00 H TER 28581 WAT 4725 ATOM 28581 O WAT 4726 12.847 38.454 110.287 1.00 0.00 O ATOM 28582 H1 WAT 4726 13.305 38.637 111.107 1.00 0.00 H ATOM 28583 H2 WAT 4726 12.145 37.851 110.534 1.00 0.00 H TER 28585 WAT 4726 ATOM 28585 O WAT 4727 8.427 140.010 138.309 1.00 0.00 O ATOM 28586 H1 WAT 4727 8.005 139.152 138.340 1.00 0.00 H ATOM 28587 H2 WAT 4727 8.319 140.299 137.403 1.00 0.00 H TER 28589 WAT 4727 ATOM 28589 O WAT 4728 43.577 44.267 147.318 1.00 0.00 O ATOM 28590 H1 WAT 4728 43.017 44.627 146.631 1.00 0.00 H ATOM 28591 H2 WAT 4728 44.173 43.677 146.856 1.00 0.00 H TER 28593 WAT 4728 ATOM 28593 O WAT 4729 6.824 129.411 21.180 1.00 0.00 O ATOM 28594 H1 WAT 4729 6.264 128.636 21.207 1.00 0.00 H ATOM 28595 H2 WAT 4729 7.664 129.113 21.530 1.00 0.00 H TER 28597 WAT 4729 ATOM 28597 O WAT 4730 42.027 66.333 126.185 1.00 0.00 O ATOM 28598 H1 WAT 4730 42.354 66.998 125.579 1.00 0.00 H ATOM 28599 H2 WAT 4730 41.075 66.426 126.152 1.00 0.00 H TER 28601 WAT 4730 ATOM 28601 O WAT 4731 58.450 39.137 19.261 1.00 0.00 O ATOM 28602 H1 WAT 4731 57.853 39.734 19.712 1.00 0.00 H ATOM 28603 H2 WAT 4731 57.932 38.346 19.113 1.00 0.00 H TER 28605 WAT 4731 ATOM 28605 O WAT 4732 27.749 48.504 116.227 1.00 0.00 O ATOM 28606 H1 WAT 4732 26.971 48.752 116.726 1.00 0.00 H ATOM 28607 H2 WAT 4732 28.426 48.371 116.890 1.00 0.00 H TER 28609 WAT 4732 ATOM 28609 O WAT 4733 121.540 145.546 98.214 1.00 0.00 O ATOM 28610 H1 WAT 4733 121.895 145.535 99.103 1.00 0.00 H ATOM 28611 H2 WAT 4733 120.622 145.793 98.326 1.00 0.00 H TER 28613 WAT 4733 ATOM 28613 O WAT 4734 75.922 51.702 15.004 1.00 0.00 O ATOM 28614 H1 WAT 4734 76.662 52.305 14.930 1.00 0.00 H ATOM 28615 H2 WAT 4734 75.173 52.200 14.677 1.00 0.00 H TER 28617 WAT 4734 ATOM 28617 O WAT 4735 106.097 143.565 130.474 1.00 0.00 O ATOM 28618 H1 WAT 4735 106.111 142.656 130.774 1.00 0.00 H ATOM 28619 H2 WAT 4735 107.019 143.817 130.428 1.00 0.00 H TER 28621 WAT 4735 ATOM 28621 O WAT 4736 12.112 136.949 56.222 1.00 0.00 O ATOM 28622 H1 WAT 4736 13.017 137.182 56.016 1.00 0.00 H ATOM 28623 H2 WAT 4736 11.587 137.468 55.612 1.00 0.00 H TER 28625 WAT 4736 ATOM 28625 O WAT 4737 47.597 121.324 61.727 1.00 0.00 O ATOM 28626 H1 WAT 4737 46.906 121.569 61.111 1.00 0.00 H ATOM 28627 H2 WAT 4737 47.127 121.010 62.500 1.00 0.00 H TER 28629 WAT 4737 ATOM 28629 O WAT 4738 43.059 143.898 77.565 1.00 0.00 O ATOM 28630 H1 WAT 4738 43.767 144.488 77.827 1.00 0.00 H ATOM 28631 H2 WAT 4738 42.932 143.326 78.321 1.00 0.00 H TER 28633 WAT 4738 ATOM 28633 O WAT 4739 137.277 3.784 124.778 1.00 0.00 O ATOM 28634 H1 WAT 4739 137.987 4.320 125.132 1.00 0.00 H ATOM 28635 H2 WAT 4739 136.488 4.117 125.205 1.00 0.00 H TER 28637 WAT 4739 ATOM 28637 O WAT 4740 45.725 91.020 152.998 1.00 0.00 O ATOM 28638 H1 WAT 4740 46.219 91.051 152.178 1.00 0.00 H ATOM 28639 H2 WAT 4740 45.698 90.091 153.225 1.00 0.00 H TER 28641 WAT 4740 ATOM 28641 O WAT 4741 111.631 83.394 122.197 1.00 0.00 O ATOM 28642 H1 WAT 4741 111.826 83.529 121.270 1.00 0.00 H ATOM 28643 H2 WAT 4741 110.835 82.863 122.200 1.00 0.00 H TER 28645 WAT 4741 ATOM 28645 O WAT 4742 77.870 121.052 144.136 1.00 0.00 O ATOM 28646 H1 WAT 4742 78.527 121.207 143.458 1.00 0.00 H ATOM 28647 H2 WAT 4742 77.057 120.903 143.652 1.00 0.00 H TER 28649 WAT 4742 ATOM 28649 O WAT 4743 22.280 56.666 83.060 1.00 0.00 O ATOM 28650 H1 WAT 4743 22.385 57.347 83.725 1.00 0.00 H ATOM 28651 H2 WAT 4743 21.354 56.428 83.104 1.00 0.00 H TER 28653 WAT 4743 ATOM 28653 O WAT 4744 131.628 17.681 134.487 1.00 0.00 O ATOM 28654 H1 WAT 4744 130.800 17.414 134.886 1.00 0.00 H ATOM 28655 H2 WAT 4744 132.248 17.706 135.215 1.00 0.00 H TER 28657 WAT 4744 ATOM 28657 O WAT 4745 18.810 13.176 65.406 1.00 0.00 O ATOM 28658 H1 WAT 4745 18.590 14.108 65.413 1.00 0.00 H ATOM 28659 H2 WAT 4745 19.163 13.020 64.530 1.00 0.00 H TER 28661 WAT 4745 ATOM 28661 O WAT 4746 37.963 36.934 151.714 1.00 0.00 O ATOM 28662 H1 WAT 4746 37.870 37.634 152.361 1.00 0.00 H ATOM 28663 H2 WAT 4746 37.087 36.555 151.643 1.00 0.00 H TER 28665 WAT 4746 ATOM 28665 O WAT 4747 123.319 8.873 155.331 1.00 0.00 O ATOM 28666 H1 WAT 4747 122.815 8.149 154.959 1.00 0.00 H ATOM 28667 H2 WAT 4747 122.793 9.651 155.144 1.00 0.00 H TER 28669 WAT 4747 ATOM 28669 O WAT 4748 46.256 44.337 136.972 1.00 0.00 O ATOM 28670 H1 WAT 4748 46.599 44.247 136.083 1.00 0.00 H ATOM 28671 H2 WAT 4748 45.861 43.486 137.163 1.00 0.00 H TER 28673 WAT 4748 ATOM 28673 O WAT 4749 111.049 122.871 128.991 1.00 0.00 O ATOM 28674 H1 WAT 4749 110.760 121.981 129.191 1.00 0.00 H ATOM 28675 H2 WAT 4749 110.727 123.034 128.105 1.00 0.00 H TER 28677 WAT 4749 ATOM 28677 O WAT 4750 121.655 63.752 -0.156 1.00 0.00 O ATOM 28678 H1 WAT 4750 121.130 62.962 -0.021 1.00 0.00 H ATOM 28679 H2 WAT 4750 121.332 64.369 0.500 1.00 0.00 H TER 28681 WAT 4750 ATOM 28681 O WAT 4751 56.066 34.686 91.991 1.00 0.00 O ATOM 28682 H1 WAT 4751 56.473 34.593 92.852 1.00 0.00 H ATOM 28683 H2 WAT 4751 56.325 33.896 91.517 1.00 0.00 H TER 28685 WAT 4751 ATOM 28685 O WAT 4752 31.274 130.396 125.971 1.00 0.00 O ATOM 28686 H1 WAT 4752 30.355 130.303 125.716 1.00 0.00 H ATOM 28687 H2 WAT 4752 31.348 129.900 126.786 1.00 0.00 H TER 28689 WAT 4752 ATOM 28689 O WAT 4753 138.641 114.097 97.464 1.00 0.00 O ATOM 28690 H1 WAT 4753 139.452 113.697 97.776 1.00 0.00 H ATOM 28691 H2 WAT 4753 137.992 113.874 98.132 1.00 0.00 H TER 28693 WAT 4753 ATOM 28693 O WAT 4754 11.236 132.198 138.778 1.00 0.00 O ATOM 28694 H1 WAT 4754 11.472 132.801 138.073 1.00 0.00 H ATOM 28695 H2 WAT 4754 12.004 132.186 139.349 1.00 0.00 H TER 28697 WAT 4754 ATOM 28697 O WAT 4755 97.783 8.208 106.028 1.00 0.00 O ATOM 28698 H1 WAT 4755 97.178 7.471 106.105 1.00 0.00 H ATOM 28699 H2 WAT 4755 98.608 7.881 106.387 1.00 0.00 H TER 28701 WAT 4755 ATOM 28701 O WAT 4756 136.951 52.434 15.798 1.00 0.00 O ATOM 28702 H1 WAT 4756 136.122 51.980 15.951 1.00 0.00 H ATOM 28703 H2 WAT 4756 137.491 51.796 15.332 1.00 0.00 H TER 28705 WAT 4756 ATOM 28705 O WAT 4757 125.831 49.536 124.930 1.00 0.00 O ATOM 28706 H1 WAT 4757 126.284 49.794 125.733 1.00 0.00 H ATOM 28707 H2 WAT 4757 124.961 49.926 125.011 1.00 0.00 H TER 28709 WAT 4757 ATOM 28709 O WAT 4758 115.551 61.695 113.357 1.00 0.00 O ATOM 28710 H1 WAT 4758 115.551 62.584 113.002 1.00 0.00 H ATOM 28711 H2 WAT 4758 116.152 61.734 114.101 1.00 0.00 H TER 28713 WAT 4758 ATOM 28713 O WAT 4759 127.951 96.642 82.285 1.00 0.00 O ATOM 28714 H1 WAT 4759 128.657 96.474 82.909 1.00 0.00 H ATOM 28715 H2 WAT 4759 128.025 97.575 82.085 1.00 0.00 H TER 28717 WAT 4759 ATOM 28717 O WAT 4760 95.083 37.793 56.971 1.00 0.00 O ATOM 28718 H1 WAT 4760 94.512 37.235 57.499 1.00 0.00 H ATOM 28719 H2 WAT 4760 94.835 38.686 57.212 1.00 0.00 H TER 28721 WAT 4760 ATOM 28721 O WAT 4761 64.190 6.487 20.333 1.00 0.00 O ATOM 28722 H1 WAT 4761 63.709 6.991 20.990 1.00 0.00 H ATOM 28723 H2 WAT 4761 64.257 7.076 19.581 1.00 0.00 H TER 28725 WAT 4761 ATOM 28725 O WAT 4762 17.187 17.620 99.887 1.00 0.00 O ATOM 28726 H1 WAT 4762 17.314 16.688 100.064 1.00 0.00 H ATOM 28727 H2 WAT 4762 16.515 17.894 100.510 1.00 0.00 H TER 28729 WAT 4762 ATOM 28729 O WAT 4763 40.383 116.701 98.667 1.00 0.00 O ATOM 28730 H1 WAT 4763 41.129 117.169 99.041 1.00 0.00 H ATOM 28731 H2 WAT 4763 40.004 117.316 98.039 1.00 0.00 H TER 28733 WAT 4763 ATOM 28733 O WAT 4764 52.004 129.912 68.983 1.00 0.00 O ATOM 28734 H1 WAT 4764 51.207 129.382 68.971 1.00 0.00 H ATOM 28735 H2 WAT 4764 52.576 129.470 69.611 1.00 0.00 H TER 28737 WAT 4764 ATOM 28737 O WAT 4765 102.484 15.152 56.758 1.00 0.00 O ATOM 28738 H1 WAT 4765 102.546 15.458 55.853 1.00 0.00 H ATOM 28739 H2 WAT 4765 103.150 15.654 57.227 1.00 0.00 H TER 28741 WAT 4765 ATOM 28741 O WAT 4766 122.729 123.131 73.044 1.00 0.00 O ATOM 28742 H1 WAT 4766 123.327 123.017 72.305 1.00 0.00 H ATOM 28743 H2 WAT 4766 122.910 122.386 73.617 1.00 0.00 H TER 28745 WAT 4766 ATOM 28745 O WAT 4767 129.371 18.652 80.888 1.00 0.00 O ATOM 28746 H1 WAT 4767 128.760 18.209 81.477 1.00 0.00 H ATOM 28747 H2 WAT 4767 129.228 19.584 81.054 1.00 0.00 H TER 28749 WAT 4767 ATOM 28749 O WAT 4768 89.933 42.363 99.815 1.00 0.00 O ATOM 28750 H1 WAT 4768 89.452 42.527 99.004 1.00 0.00 H ATOM 28751 H2 WAT 4768 89.896 41.413 99.928 1.00 0.00 H TER 28753 WAT 4768 ATOM 28753 O WAT 4769 51.021 4.716 149.347 1.00 0.00 O ATOM 28754 H1 WAT 4769 51.971 4.777 149.448 1.00 0.00 H ATOM 28755 H2 WAT 4769 50.747 5.606 149.125 1.00 0.00 H TER 28757 WAT 4769 ATOM 28757 O WAT 4770 144.501 59.557 99.937 1.00 0.00 O ATOM 28758 H1 WAT 4770 143.577 59.382 99.758 1.00 0.00 H ATOM 28759 H2 WAT 4770 144.591 59.430 100.882 1.00 0.00 H TER 28761 WAT 4770 ATOM 28761 O WAT 4771 4.549 47.947 123.891 1.00 0.00 O ATOM 28762 H1 WAT 4771 5.420 48.337 123.818 1.00 0.00 H ATOM 28763 H2 WAT 4771 4.269 48.151 124.783 1.00 0.00 H TER 28765 WAT 4771 ATOM 28765 O WAT 4772 18.263 72.236 69.941 1.00 0.00 O ATOM 28766 H1 WAT 4772 18.636 71.357 70.003 1.00 0.00 H ATOM 28767 H2 WAT 4772 18.295 72.445 69.007 1.00 0.00 H TER 28769 WAT 4772 ATOM 28769 O WAT 4773 80.312 27.922 123.408 1.00 0.00 O ATOM 28770 H1 WAT 4773 80.630 28.802 123.610 1.00 0.00 H ATOM 28771 H2 WAT 4773 80.615 27.757 122.515 1.00 0.00 H TER 28773 WAT 4773 ATOM 28773 O WAT 4774 13.343 53.075 85.532 1.00 0.00 O ATOM 28774 H1 WAT 4774 12.526 52.577 85.514 1.00 0.00 H ATOM 28775 H2 WAT 4774 13.273 53.677 84.790 1.00 0.00 H TER 28777 WAT 4774 ATOM 28777 O WAT 4775 68.913 122.479 149.434 1.00 0.00 O ATOM 28778 H1 WAT 4775 68.819 122.658 148.498 1.00 0.00 H ATOM 28779 H2 WAT 4775 69.525 123.147 149.744 1.00 0.00 H TER 28781 WAT 4775 ATOM 28781 O WAT 4776 84.318 61.839 64.328 1.00 0.00 O ATOM 28782 H1 WAT 4776 84.498 62.105 65.230 1.00 0.00 H ATOM 28783 H2 WAT 4776 83.369 61.714 64.301 1.00 0.00 H TER 28785 WAT 4776 ATOM 28785 O WAT 4777 39.541 45.117 134.206 1.00 0.00 O ATOM 28786 H1 WAT 4777 39.615 44.278 134.661 1.00 0.00 H ATOM 28787 H2 WAT 4777 40.399 45.527 134.320 1.00 0.00 H TER 28789 WAT 4777 ATOM 28789 O WAT 4778 73.342 96.518 145.644 1.00 0.00 O ATOM 28790 H1 WAT 4778 73.098 96.830 146.515 1.00 0.00 H ATOM 28791 H2 WAT 4778 73.372 95.566 145.730 1.00 0.00 H TER 28793 WAT 4778 ATOM 28793 O WAT 4779 85.233 30.948 14.721 1.00 0.00 O ATOM 28794 H1 WAT 4779 84.547 31.198 15.340 1.00 0.00 H ATOM 28795 H2 WAT 4779 85.171 29.995 14.666 1.00 0.00 H TER 28797 WAT 4779 ATOM 28797 O WAT 4780 91.920 92.271 10.969 1.00 0.00 O ATOM 28798 H1 WAT 4780 91.830 92.296 11.922 1.00 0.00 H ATOM 28799 H2 WAT 4780 91.028 92.384 10.641 1.00 0.00 H TER 28801 WAT 4780 ATOM 28801 O WAT 4781 96.173 139.419 97.018 1.00 0.00 O ATOM 28802 H1 WAT 4781 96.770 139.508 97.760 1.00 0.00 H ATOM 28803 H2 WAT 4781 95.428 139.978 97.241 1.00 0.00 H TER 28805 WAT 4781 ATOM 28805 O WAT 4782 53.594 144.113 152.149 1.00 0.00 O ATOM 28806 H1 WAT 4782 53.254 144.711 151.484 1.00 0.00 H ATOM 28807 H2 WAT 4782 54.506 144.379 152.266 1.00 0.00 H TER 28809 WAT 4782 ATOM 28809 O WAT 4783 132.512 91.304 105.508 1.00 0.00 O ATOM 28810 H1 WAT 4783 132.348 90.982 104.622 1.00 0.00 H ATOM 28811 H2 WAT 4783 132.021 92.125 105.559 1.00 0.00 H TER 28813 WAT 4783 ATOM 28813 O WAT 4784 100.675 126.433 15.140 1.00 0.00 O ATOM 28814 H1 WAT 4784 100.341 127.136 14.584 1.00 0.00 H ATOM 28815 H2 WAT 4784 99.907 125.894 15.333 1.00 0.00 H TER 28817 WAT 4784 ATOM 28817 O WAT 4785 71.410 30.899 101.067 1.00 0.00 O ATOM 28818 H1 WAT 4785 71.003 30.185 101.557 1.00 0.00 H ATOM 28819 H2 WAT 4785 71.643 30.509 100.224 1.00 0.00 H TER 28821 WAT 4785 ATOM 28821 O WAT 4786 57.008 37.377 122.030 1.00 0.00 O ATOM 28822 H1 WAT 4786 57.615 36.741 121.652 1.00 0.00 H ATOM 28823 H2 WAT 4786 56.485 36.871 122.651 1.00 0.00 H TER 28825 WAT 4786 ATOM 28825 O WAT 4787 72.851 20.401 86.792 1.00 0.00 O ATOM 28826 H1 WAT 4787 73.350 21.081 87.244 1.00 0.00 H ATOM 28827 H2 WAT 4787 73.282 20.314 85.941 1.00 0.00 H TER 28829 WAT 4787 ATOM 28829 O WAT 4788 65.189 17.545 118.759 1.00 0.00 O ATOM 28830 H1 WAT 4788 64.289 17.710 119.041 1.00 0.00 H ATOM 28831 H2 WAT 4788 65.720 17.732 119.533 1.00 0.00 H TER 28833 WAT 4788 ATOM 28833 O WAT 4789 46.099 27.120 4.667 1.00 0.00 O ATOM 28834 H1 WAT 4789 45.755 27.602 3.915 1.00 0.00 H ATOM 28835 H2 WAT 4789 46.447 27.797 5.246 1.00 0.00 H TER 28837 WAT 4789 ATOM 28837 O WAT 4790 121.761 62.359 87.460 1.00 0.00 O ATOM 28838 H1 WAT 4790 122.318 63.138 87.466 1.00 0.00 H ATOM 28839 H2 WAT 4790 121.935 61.933 88.299 1.00 0.00 H TER 28841 WAT 4790 ATOM 28841 O WAT 4791 38.613 91.730 112.887 1.00 0.00 O ATOM 28842 H1 WAT 4791 37.813 91.375 112.500 1.00 0.00 H ATOM 28843 H2 WAT 4791 39.103 90.959 113.174 1.00 0.00 H TER 28845 WAT 4791 ATOM 28845 O WAT 4792 102.101 72.832 86.437 1.00 0.00 O ATOM 28846 H1 WAT 4792 101.155 72.892 86.305 1.00 0.00 H ATOM 28847 H2 WAT 4792 102.456 72.682 85.560 1.00 0.00 H TER 28849 WAT 4792 ATOM 28849 O WAT 4793 75.241 13.387 140.395 1.00 0.00 O ATOM 28850 H1 WAT 4793 75.074 12.446 140.449 1.00 0.00 H ATOM 28851 H2 WAT 4793 75.319 13.563 139.458 1.00 0.00 H TER 28853 WAT 4793 ATOM 28853 O WAT 4794 25.887 58.796 0.748 1.00 0.00 O ATOM 28854 H1 WAT 4794 26.073 58.562 1.657 1.00 0.00 H ATOM 28855 H2 WAT 4794 24.941 58.679 0.660 1.00 0.00 H TER 28857 WAT 4794 ATOM 28857 O WAT 4795 4.607 87.367 77.223 1.00 0.00 O ATOM 28858 H1 WAT 4795 4.564 87.317 78.178 1.00 0.00 H ATOM 28859 H2 WAT 4795 4.643 86.454 76.937 1.00 0.00 H TER 28861 WAT 4795 ATOM 28861 O WAT 4796 23.947 29.430 66.752 1.00 0.00 O ATOM 28862 H1 WAT 4796 23.535 29.675 65.923 1.00 0.00 H ATOM 28863 H2 WAT 4796 24.884 29.549 66.599 1.00 0.00 H TER 28865 WAT 4796 ATOM 28865 O WAT 4797 72.542 81.784 115.508 1.00 0.00 O ATOM 28866 H1 WAT 4797 72.286 80.861 115.509 1.00 0.00 H ATOM 28867 H2 WAT 4797 73.462 81.777 115.243 1.00 0.00 H TER 28869 WAT 4797 ATOM 28869 O WAT 4798 13.022 90.151 93.752 1.00 0.00 O ATOM 28870 H1 WAT 4798 13.434 90.934 94.118 1.00 0.00 H ATOM 28871 H2 WAT 4798 12.941 90.338 92.817 1.00 0.00 H TER 28873 WAT 4798 ATOM 28873 O WAT 4799 19.404 90.862 0.126 1.00 0.00 O ATOM 28874 H1 WAT 4799 19.765 91.532 0.707 1.00 0.00 H ATOM 28875 H2 WAT 4799 18.991 90.231 0.716 1.00 0.00 H TER 28877 WAT 4799 ATOM 28877 O WAT 4800 33.692 101.685 59.428 1.00 0.00 O ATOM 28878 H1 WAT 4800 33.269 100.854 59.209 1.00 0.00 H ATOM 28879 H2 WAT 4800 34.622 101.531 59.261 1.00 0.00 H TER 28881 WAT 4800 ATOM 28881 O WAT 4801 111.168 141.039 73.645 1.00 0.00 O ATOM 28882 H1 WAT 4801 110.487 140.932 72.980 1.00 0.00 H ATOM 28883 H2 WAT 4801 111.069 141.943 73.945 1.00 0.00 H TER 28885 WAT 4801 ATOM 28885 O WAT 4802 11.513 23.490 9.979 1.00 0.00 O ATOM 28886 H1 WAT 4802 12.038 22.984 9.359 1.00 0.00 H ATOM 28887 H2 WAT 4802 11.309 24.301 9.513 1.00 0.00 H TER 28889 WAT 4802 ATOM 28889 O WAT 4803 21.285 94.710 153.723 1.00 0.00 O ATOM 28890 H1 WAT 4803 21.682 94.872 154.578 1.00 0.00 H ATOM 28891 H2 WAT 4803 21.753 95.295 153.127 1.00 0.00 H TER 28893 WAT 4803 ATOM 28893 O WAT 4804 113.672 138.548 117.090 1.00 0.00 O ATOM 28894 H1 WAT 4804 113.703 138.477 116.136 1.00 0.00 H ATOM 28895 H2 WAT 4804 114.573 138.745 117.345 1.00 0.00 H TER 28897 WAT 4804 ATOM 28897 O WAT 4805 1.929 41.573 70.239 1.00 0.00 O ATOM 28898 H1 WAT 4805 1.433 42.365 70.031 1.00 0.00 H ATOM 28899 H2 WAT 4805 2.460 41.814 70.998 1.00 0.00 H TER 28901 WAT 4805 ATOM 28901 O WAT 4806 138.200 18.537 98.427 1.00 0.00 O ATOM 28902 H1 WAT 4806 138.284 18.000 97.640 1.00 0.00 H ATOM 28903 H2 WAT 4806 138.737 19.309 98.249 1.00 0.00 H TER 28905 WAT 4806 ATOM 28905 O WAT 4807 1.735 27.732 11.558 1.00 0.00 O ATOM 28906 H1 WAT 4807 0.801 27.904 11.679 1.00 0.00 H ATOM 28907 H2 WAT 4807 2.007 28.352 10.882 1.00 0.00 H TER 28909 WAT 4807 ATOM 28909 O WAT 4808 103.742 123.293 108.468 1.00 0.00 O ATOM 28910 H1 WAT 4808 103.874 124.046 107.893 1.00 0.00 H ATOM 28911 H2 WAT 4808 102.802 123.293 108.650 1.00 0.00 H TER 28913 WAT 4808 ATOM 28913 O WAT 4809 41.724 135.002 61.371 1.00 0.00 O ATOM 28914 H1 WAT 4809 41.093 135.115 60.660 1.00 0.00 H ATOM 28915 H2 WAT 4809 42.438 134.500 60.979 1.00 0.00 H TER 28917 WAT 4809 ATOM 28917 O WAT 4810 106.953 53.587 147.865 1.00 0.00 O ATOM 28918 H1 WAT 4810 106.519 53.363 147.042 1.00 0.00 H ATOM 28919 H2 WAT 4810 107.385 54.423 147.689 1.00 0.00 H TER 28921 WAT 4810 ATOM 28921 O WAT 4811 13.602 17.894 20.540 1.00 0.00 O ATOM 28922 H1 WAT 4811 14.168 17.180 20.835 1.00 0.00 H ATOM 28923 H2 WAT 4811 13.307 17.622 19.671 1.00 0.00 H TER 28925 WAT 4811 ATOM 28925 O WAT 4812 117.565 33.808 15.523 1.00 0.00 O ATOM 28926 H1 WAT 4812 117.666 34.646 15.071 1.00 0.00 H ATOM 28927 H2 WAT 4812 117.624 33.152 14.829 1.00 0.00 H TER 28929 WAT 4812 ATOM 28929 O WAT 4813 40.456 93.187 93.539 1.00 0.00 O ATOM 28930 H1 WAT 4813 40.448 93.282 92.587 1.00 0.00 H ATOM 28931 H2 WAT 4813 40.289 94.070 93.869 1.00 0.00 H TER 28933 WAT 4813 ATOM 28933 O WAT 4814 47.471 38.729 25.761 1.00 0.00 O ATOM 28934 H1 WAT 4814 47.886 37.988 25.318 1.00 0.00 H ATOM 28935 H2 WAT 4814 47.660 39.480 25.199 1.00 0.00 H TER 28937 WAT 4814 ATOM 28937 O WAT 4815 53.607 48.320 96.863 1.00 0.00 O ATOM 28938 H1 WAT 4815 52.741 48.022 97.143 1.00 0.00 H ATOM 28939 H2 WAT 4815 53.948 48.805 97.615 1.00 0.00 H TER 28941 WAT 4815 ATOM 28941 O WAT 4816 138.869 86.080 10.186 1.00 0.00 O ATOM 28942 H1 WAT 4816 138.119 86.161 10.775 1.00 0.00 H ATOM 28943 H2 WAT 4816 138.912 85.146 9.979 1.00 0.00 H TER 28945 WAT 4816 ATOM 28945 O WAT 4817 110.062 139.585 6.838 1.00 0.00 O ATOM 28946 H1 WAT 4817 109.940 138.752 7.293 1.00 0.00 H ATOM 28947 H2 WAT 4817 110.226 140.218 7.537 1.00 0.00 H TER 28949 WAT 4817 ATOM 28949 O WAT 4818 14.836 49.079 138.347 1.00 0.00 O ATOM 28950 H1 WAT 4818 15.701 48.740 138.577 1.00 0.00 H ATOM 28951 H2 WAT 4818 14.666 48.730 137.472 1.00 0.00 H TER 28953 WAT 4818 ATOM 28953 O WAT 4819 50.915 135.986 14.325 1.00 0.00 O ATOM 28954 H1 WAT 4819 51.739 135.882 13.850 1.00 0.00 H ATOM 28955 H2 WAT 4819 50.329 136.409 13.698 1.00 0.00 H TER 28957 WAT 4819 ATOM 28957 O WAT 4820 68.312 72.072 151.187 1.00 0.00 O ATOM 28958 H1 WAT 4820 68.849 71.744 150.466 1.00 0.00 H ATOM 28959 H2 WAT 4820 68.145 72.987 150.965 1.00 0.00 H TER 28961 WAT 4820 ATOM 28961 O WAT 4821 30.725 95.047 127.419 1.00 0.00 O ATOM 28962 H1 WAT 4821 31.204 94.372 127.898 1.00 0.00 H ATOM 28963 H2 WAT 4821 30.371 95.619 128.100 1.00 0.00 H TER 28965 WAT 4821 ATOM 28965 O WAT 4822 54.933 78.569 60.874 1.00 0.00 O ATOM 28966 H1 WAT 4822 55.376 78.078 60.182 1.00 0.00 H ATOM 28967 H2 WAT 4822 55.643 78.917 61.413 1.00 0.00 H TER 28969 WAT 4822 ATOM 28969 O WAT 4823 67.201 30.095 9.863 1.00 0.00 O ATOM 28970 H1 WAT 4823 66.486 29.928 10.476 1.00 0.00 H ATOM 28971 H2 WAT 4823 67.831 30.613 10.365 1.00 0.00 H TER 28973 WAT 4823 ATOM 28973 O WAT 4824 60.685 131.182 129.283 1.00 0.00 O ATOM 28974 H1 WAT 4824 60.110 131.856 129.645 1.00 0.00 H ATOM 28975 H2 WAT 4824 60.122 130.680 128.693 1.00 0.00 H TER 28977 WAT 4824 ATOM 28977 O WAT 4825 136.507 72.256 136.216 1.00 0.00 O ATOM 28978 H1 WAT 4825 136.264 71.630 135.533 1.00 0.00 H ATOM 28979 H2 WAT 4825 136.561 73.096 135.761 1.00 0.00 H TER 28981 WAT 4825 ATOM 28981 O WAT 4826 30.283 88.526 10.327 1.00 0.00 O ATOM 28982 H1 WAT 4826 29.361 88.462 10.076 1.00 0.00 H ATOM 28983 H2 WAT 4826 30.264 88.843 11.230 1.00 0.00 H TER 28985 WAT 4826 ATOM 28985 O WAT 4827 40.890 10.057 76.276 1.00 0.00 O ATOM 28986 H1 WAT 4827 40.869 10.997 76.096 1.00 0.00 H ATOM 28987 H2 WAT 4827 41.816 9.821 76.208 1.00 0.00 H TER 28989 WAT 4827 ATOM 28989 O WAT 4828 132.618 90.973 99.262 1.00 0.00 O ATOM 28990 H1 WAT 4828 132.196 91.270 98.456 1.00 0.00 H ATOM 28991 H2 WAT 4828 133.237 90.302 98.975 1.00 0.00 H TER 28993 WAT 4828 ATOM 28993 O WAT 4829 117.264 97.082 150.192 1.00 0.00 O ATOM 28994 H1 WAT 4829 117.115 97.912 149.737 1.00 0.00 H ATOM 28995 H2 WAT 4829 117.107 96.413 149.526 1.00 0.00 H TER 28997 WAT 4829 ATOM 28997 O WAT 4830 107.583 16.602 153.569 1.00 0.00 O ATOM 28998 H1 WAT 4830 107.130 17.443 153.505 1.00 0.00 H ATOM 28999 H2 WAT 4830 108.350 16.785 154.113 1.00 0.00 H TER 29001 WAT 4830 ATOM 29001 O WAT 4831 40.086 14.937 115.487 1.00 0.00 O ATOM 29002 H1 WAT 4831 39.250 14.885 115.950 1.00 0.00 H ATOM 29003 H2 WAT 4831 40.017 14.281 114.793 1.00 0.00 H TER 29005 WAT 4831 ATOM 29005 O WAT 4832 76.944 74.179 64.812 1.00 0.00 O ATOM 29006 H1 WAT 4832 76.050 74.060 64.492 1.00 0.00 H ATOM 29007 H2 WAT 4832 77.352 74.764 64.174 1.00 0.00 H TER 29009 WAT 4832 ATOM 29009 O WAT 4833 39.455 130.221 67.306 1.00 0.00 O ATOM 29010 H1 WAT 4833 39.074 130.008 66.454 1.00 0.00 H ATOM 29011 H2 WAT 4833 38.702 130.307 67.891 1.00 0.00 H TER 29013 WAT 4833 ATOM 29013 O WAT 4834 88.780 66.890 81.367 1.00 0.00 O ATOM 29014 H1 WAT 4834 88.123 66.239 81.615 1.00 0.00 H ATOM 29015 H2 WAT 4834 89.487 66.769 82.001 1.00 0.00 H TER 29017 WAT 4834 ATOM 29017 O WAT 4835 64.015 112.813 1.560 1.00 0.00 O ATOM 29018 H1 WAT 4835 63.496 112.184 1.059 1.00 0.00 H ATOM 29019 H2 WAT 4835 63.441 113.079 2.279 1.00 0.00 H TER 29021 WAT 4835 ATOM 29021 O WAT 4836 125.172 22.298 112.659 1.00 0.00 O ATOM 29022 H1 WAT 4836 124.500 21.785 113.109 1.00 0.00 H ATOM 29023 H2 WAT 4836 124.681 22.961 112.173 1.00 0.00 H TER 29025 WAT 4836 ATOM 29025 O WAT 4837 82.986 140.613 142.549 1.00 0.00 O ATOM 29026 H1 WAT 4837 83.564 141.350 142.746 1.00 0.00 H ATOM 29027 H2 WAT 4837 83.449 139.848 142.890 1.00 0.00 H TER 29029 WAT 4837 ATOM 29029 O WAT 4838 144.699 32.469 107.039 1.00 0.00 O ATOM 29030 H1 WAT 4838 143.941 32.463 106.454 1.00 0.00 H ATOM 29031 H2 WAT 4838 145.128 31.628 106.883 1.00 0.00 H TER 29033 WAT 4838 ATOM 29033 O WAT 4839 45.081 21.361 103.749 1.00 0.00 O ATOM 29034 H1 WAT 4839 45.224 22.249 103.420 1.00 0.00 H ATOM 29035 H2 WAT 4839 45.884 20.891 103.526 1.00 0.00 H TER 29037 WAT 4839 ATOM 29037 O WAT 4840 44.363 59.751 94.319 1.00 0.00 O ATOM 29038 H1 WAT 4840 44.545 59.003 93.751 1.00 0.00 H ATOM 29039 H2 WAT 4840 45.220 60.148 94.475 1.00 0.00 H TER 29041 WAT 4840 ATOM 29041 O WAT 4841 117.388 104.057 118.330 1.00 0.00 O ATOM 29042 H1 WAT 4841 116.466 104.107 118.580 1.00 0.00 H ATOM 29043 H2 WAT 4841 117.862 104.378 119.097 1.00 0.00 H TER 29045 WAT 4841 ATOM 29045 O WAT 4842 141.290 69.126 142.610 1.00 0.00 O ATOM 29046 H1 WAT 4842 140.931 69.733 141.962 1.00 0.00 H ATOM 29047 H2 WAT 4842 141.201 68.263 142.205 1.00 0.00 H TER 29049 WAT 4842 ATOM 29049 O WAT 4843 2.462 127.840 98.940 1.00 0.00 O ATOM 29050 H1 WAT 4843 2.150 127.181 98.320 1.00 0.00 H ATOM 29051 H2 WAT 4843 1.684 128.083 99.442 1.00 0.00 H TER 29053 WAT 4843 ATOM 29053 O WAT 4844 8.106 0.628 91.916 1.00 0.00 O ATOM 29054 H1 WAT 4844 8.153 -0.151 92.469 1.00 0.00 H ATOM 29055 H2 WAT 4844 8.220 1.360 92.522 1.00 0.00 H TER 29057 WAT 4844 ATOM 29057 O WAT 4845 36.193 128.726 63.664 1.00 0.00 O ATOM 29058 H1 WAT 4845 35.980 129.520 63.172 1.00 0.00 H ATOM 29059 H2 WAT 4845 36.357 128.065 62.991 1.00 0.00 H TER 29061 WAT 4845 ATOM 29061 O WAT 4846 10.272 45.006 148.787 1.00 0.00 O ATOM 29062 H1 WAT 4846 11.068 44.682 149.210 1.00 0.00 H ATOM 29063 H2 WAT 4846 9.753 45.372 149.503 1.00 0.00 H TER 29065 WAT 4846 ATOM 29065 O WAT 4847 6.005 59.560 84.139 1.00 0.00 O ATOM 29066 H1 WAT 4847 6.822 59.878 84.524 1.00 0.00 H ATOM 29067 H2 WAT 4847 5.515 59.201 84.878 1.00 0.00 H TER 29069 WAT 4847 ATOM 29069 O WAT 4848 93.563 8.089 79.069 1.00 0.00 O ATOM 29070 H1 WAT 4848 93.880 7.186 79.068 1.00 0.00 H ATOM 29071 H2 WAT 4848 93.862 8.449 78.234 1.00 0.00 H TER 29073 WAT 4848 ATOM 29073 O WAT 4849 50.920 64.401 68.725 1.00 0.00 O ATOM 29074 H1 WAT 4849 50.100 64.254 69.197 1.00 0.00 H ATOM 29075 H2 WAT 4849 51.601 64.113 69.333 1.00 0.00 H TER 29077 WAT 4849 ATOM 29077 O WAT 4850 103.825 105.705 148.989 1.00 0.00 O ATOM 29078 H1 WAT 4850 103.048 105.150 149.061 1.00 0.00 H ATOM 29079 H2 WAT 4850 104.063 105.902 149.895 1.00 0.00 H TER 29081 WAT 4850 ATOM 29081 O WAT 4851 121.041 82.242 24.699 1.00 0.00 O ATOM 29082 H1 WAT 4851 120.500 81.485 24.472 1.00 0.00 H ATOM 29083 H2 WAT 4851 120.933 82.337 25.646 1.00 0.00 H TER 29085 WAT 4851 ATOM 29085 O WAT 4852 80.109 70.505 116.915 1.00 0.00 O ATOM 29086 H1 WAT 4852 80.055 70.709 117.849 1.00 0.00 H ATOM 29087 H2 WAT 4852 80.765 69.810 116.860 1.00 0.00 H TER 29089 WAT 4852 ATOM 29089 O WAT 4853 38.121 67.930 12.083 1.00 0.00 O ATOM 29090 H1 WAT 4853 38.109 68.658 12.703 1.00 0.00 H ATOM 29091 H2 WAT 4853 37.208 67.831 11.812 1.00 0.00 H TER 29093 WAT 4853 ATOM 29093 O WAT 4854 85.413 80.718 79.437 1.00 0.00 O ATOM 29094 H1 WAT 4854 85.620 81.383 78.781 1.00 0.00 H ATOM 29095 H2 WAT 4854 86.130 80.087 79.373 1.00 0.00 H TER 29097 WAT 4854 ATOM 29097 O WAT 4855 87.939 7.363 73.377 1.00 0.00 O ATOM 29098 H1 WAT 4855 88.788 7.126 73.750 1.00 0.00 H ATOM 29099 H2 WAT 4855 87.301 6.896 73.916 1.00 0.00 H TER 29101 WAT 4855 ATOM 29101 O WAT 4856 26.482 48.904 75.416 1.00 0.00 O ATOM 29102 H1 WAT 4856 26.679 49.813 75.190 1.00 0.00 H ATOM 29103 H2 WAT 4856 27.339 48.481 75.473 1.00 0.00 H TER 29105 WAT 4856 ATOM 29105 O WAT 4857 135.089 63.407 88.710 1.00 0.00 O ATOM 29106 H1 WAT 4857 135.108 64.294 89.070 1.00 0.00 H ATOM 29107 H2 WAT 4857 134.330 63.402 88.126 1.00 0.00 H TER 29109 WAT 4857 ATOM 29109 O WAT 4858 106.384 116.300 132.933 1.00 0.00 O ATOM 29110 H1 WAT 4858 107.137 115.810 132.604 1.00 0.00 H ATOM 29111 H2 WAT 4858 106.363 116.106 133.870 1.00 0.00 H TER 29113 WAT 4858 ATOM 29113 O WAT 4859 142.985 93.025 68.990 1.00 0.00 O ATOM 29114 H1 WAT 4859 142.886 93.492 69.820 1.00 0.00 H ATOM 29115 H2 WAT 4859 143.924 92.853 68.921 1.00 0.00 H TER 29117 WAT 4859 ATOM 29117 O WAT 4860 10.863 93.335 93.541 1.00 0.00 O ATOM 29118 H1 WAT 4860 11.817 93.284 93.599 1.00 0.00 H ATOM 29119 H2 WAT 4860 10.558 93.136 94.427 1.00 0.00 H TER 29121 WAT 4860 ATOM 29121 O WAT 4861 1.660 4.463 70.612 1.00 0.00 O ATOM 29122 H1 WAT 4861 1.966 5.338 70.851 1.00 0.00 H ATOM 29123 H2 WAT 4861 2.408 3.892 70.788 1.00 0.00 H TER 29125 WAT 4861 ATOM 29125 O WAT 4862 82.388 46.134 65.683 1.00 0.00 O ATOM 29126 H1 WAT 4862 81.567 46.416 66.087 1.00 0.00 H ATOM 29127 H2 WAT 4862 82.442 46.641 64.873 1.00 0.00 H TER 29129 WAT 4862 ATOM 29129 O WAT 4863 66.513 23.949 19.907 1.00 0.00 O ATOM 29130 H1 WAT 4863 67.288 24.511 19.900 1.00 0.00 H ATOM 29131 H2 WAT 4863 66.030 24.197 19.119 1.00 0.00 H TER 29133 WAT 4863 ATOM 29133 O WAT 4864 56.712 103.068 137.010 1.00 0.00 O ATOM 29134 H1 WAT 4864 56.837 103.981 136.752 1.00 0.00 H ATOM 29135 H2 WAT 4864 57.196 102.565 136.356 1.00 0.00 H TER 29137 WAT 4864 ATOM 29137 O WAT 4865 67.264 26.622 64.683 1.00 0.00 O ATOM 29138 H1 WAT 4865 67.679 26.225 65.448 1.00 0.00 H ATOM 29139 H2 WAT 4865 67.828 26.377 63.950 1.00 0.00 H TER 29141 WAT 4865 ATOM 29141 O WAT 4866 105.487 68.617 14.396 1.00 0.00 O ATOM 29142 H1 WAT 4866 104.806 68.130 14.859 1.00 0.00 H ATOM 29143 H2 WAT 4866 106.285 68.110 14.541 1.00 0.00 H TER 29145 WAT 4866 ATOM 29145 O WAT 4867 91.886 41.639 104.287 1.00 0.00 O ATOM 29146 H1 WAT 4867 92.379 40.961 103.826 1.00 0.00 H ATOM 29147 H2 WAT 4867 92.261 42.462 103.974 1.00 0.00 H TER 29149 WAT 4867 ATOM 29149 O WAT 4868 71.624 129.880 64.514 1.00 0.00 O ATOM 29150 H1 WAT 4868 72.237 130.526 64.163 1.00 0.00 H ATOM 29151 H2 WAT 4868 72.066 129.527 65.287 1.00 0.00 H TER 29153 WAT 4868 ATOM 29153 O WAT 4869 133.026 135.187 118.889 1.00 0.00 O ATOM 29154 H1 WAT 4869 133.089 135.457 119.805 1.00 0.00 H ATOM 29155 H2 WAT 4869 132.850 134.246 118.928 1.00 0.00 H TER 29157 WAT 4869 ATOM 29157 O WAT 4870 61.075 31.663 155.961 1.00 0.00 O ATOM 29158 H1 WAT 4870 60.282 31.760 155.434 1.00 0.00 H ATOM 29159 H2 WAT 4870 61.253 32.545 156.289 1.00 0.00 H TER 29161 WAT 4870 ATOM 29161 O WAT 4871 99.820 47.477 153.972 1.00 0.00 O ATOM 29162 H1 WAT 4871 100.765 47.558 154.101 1.00 0.00 H ATOM 29163 H2 WAT 4871 99.465 48.315 154.270 1.00 0.00 H TER 29165 WAT 4871 ATOM 29165 O WAT 4872 136.736 71.678 100.700 1.00 0.00 O ATOM 29166 H1 WAT 4872 135.968 71.139 100.510 1.00 0.00 H ATOM 29167 H2 WAT 4872 137.110 71.291 101.491 1.00 0.00 H TER 29169 WAT 4872 ATOM 29169 O WAT 4873 109.602 42.480 111.697 1.00 0.00 O ATOM 29170 H1 WAT 4873 108.905 42.192 111.108 1.00 0.00 H ATOM 29171 H2 WAT 4873 110.381 42.013 111.394 1.00 0.00 H TER 29173 WAT 4873 ATOM 29173 O WAT 4874 131.940 15.705 91.392 1.00 0.00 O ATOM 29174 H1 WAT 4874 132.767 15.334 91.084 1.00 0.00 H ATOM 29175 H2 WAT 4874 131.353 14.953 91.468 1.00 0.00 H TER 29177 WAT 4874 ATOM 29177 O WAT 4875 98.470 22.865 142.401 1.00 0.00 O ATOM 29178 H1 WAT 4875 98.332 23.536 141.732 1.00 0.00 H ATOM 29179 H2 WAT 4875 99.352 23.034 142.732 1.00 0.00 H TER 29181 WAT 4875 ATOM 29181 O WAT 4876 68.858 138.535 10.255 1.00 0.00 O ATOM 29182 H1 WAT 4876 68.236 139.249 10.391 1.00 0.00 H ATOM 29183 H2 WAT 4876 69.383 138.813 9.505 1.00 0.00 H TER 29185 WAT 4876 ATOM 29185 O WAT 4877 121.336 68.189 1.627 1.00 0.00 O ATOM 29186 H1 WAT 4877 120.620 67.696 1.226 1.00 0.00 H ATOM 29187 H2 WAT 4877 121.784 67.551 2.183 1.00 0.00 H TER 29189 WAT 4877 ATOM 29189 O WAT 4878 133.104 32.723 153.682 1.00 0.00 O ATOM 29190 H1 WAT 4878 132.909 33.035 154.565 1.00 0.00 H ATOM 29191 H2 WAT 4878 132.840 31.803 153.688 1.00 0.00 H TER 29193 WAT 4878 ATOM 29193 O WAT 4879 144.115 138.300 155.323 1.00 0.00 O ATOM 29194 H1 WAT 4879 143.520 139.043 155.227 1.00 0.00 H ATOM 29195 H2 WAT 4879 144.037 137.821 154.498 1.00 0.00 H TER 29197 WAT 4879 ATOM 29197 O WAT 4880 64.244 53.832 139.361 1.00 0.00 O ATOM 29198 H1 WAT 4880 64.697 54.606 139.693 1.00 0.00 H ATOM 29199 H2 WAT 4880 63.445 53.778 139.887 1.00 0.00 H TER 29201 WAT 4880 ATOM 29201 O WAT 4881 95.200 116.733 105.523 1.00 0.00 O ATOM 29202 H1 WAT 4881 94.566 116.059 105.769 1.00 0.00 H ATOM 29203 H2 WAT 4881 94.904 117.519 105.982 1.00 0.00 H TER 29205 WAT 4881 ATOM 29205 O WAT 4882 137.303 87.659 3.544 1.00 0.00 O ATOM 29206 H1 WAT 4882 137.229 87.742 4.495 1.00 0.00 H ATOM 29207 H2 WAT 4882 137.243 88.557 3.219 1.00 0.00 H TER 29209 WAT 4882 ATOM 29209 O WAT 4883 52.233 130.082 130.541 1.00 0.00 O ATOM 29210 H1 WAT 4883 52.513 130.707 129.872 1.00 0.00 H ATOM 29211 H2 WAT 4883 52.962 130.052 131.161 1.00 0.00 H TER 29213 WAT 4883 ATOM 29213 O WAT 4884 32.922 144.281 86.227 1.00 0.00 O ATOM 29214 H1 WAT 4884 33.871 144.367 86.136 1.00 0.00 H ATOM 29215 H2 WAT 4884 32.795 143.971 87.123 1.00 0.00 H TER 29217 WAT 4884 ATOM 29217 O WAT 4885 13.076 54.812 151.145 1.00 0.00 O ATOM 29218 H1 WAT 4885 14.021 54.694 151.239 1.00 0.00 H ATOM 29219 H2 WAT 4885 12.876 54.460 150.277 1.00 0.00 H TER 29221 WAT 4885 ATOM 29221 O WAT 4886 22.758 3.342 14.395 1.00 0.00 O ATOM 29222 H1 WAT 4886 21.862 3.397 14.064 1.00 0.00 H ATOM 29223 H2 WAT 4886 22.675 3.491 15.337 1.00 0.00 H TER 29225 WAT 4886 ATOM 29225 O WAT 4887 39.028 22.664 134.457 1.00 0.00 O ATOM 29226 H1 WAT 4887 38.404 23.296 134.102 1.00 0.00 H ATOM 29227 H2 WAT 4887 39.784 23.192 134.713 1.00 0.00 H TER 29229 WAT 4887 ATOM 29229 O WAT 4888 28.209 39.572 109.711 1.00 0.00 O ATOM 29230 H1 WAT 4888 28.821 38.952 109.315 1.00 0.00 H ATOM 29231 H2 WAT 4888 28.156 39.304 110.628 1.00 0.00 H TER 29233 WAT 4888 ATOM 29233 O WAT 4889 8.072 67.811 153.710 1.00 0.00 O ATOM 29234 H1 WAT 4889 8.848 68.367 153.782 1.00 0.00 H ATOM 29235 H2 WAT 4889 7.409 68.255 154.237 1.00 0.00 H TER 29237 WAT 4889 ATOM 29237 O WAT 4890 30.991 33.707 11.248 1.00 0.00 O ATOM 29238 H1 WAT 4890 30.453 34.177 10.610 1.00 0.00 H ATOM 29239 H2 WAT 4890 31.196 32.875 10.821 1.00 0.00 H TER 29241 WAT 4890 ATOM 29241 O WAT 4891 80.583 125.257 101.471 1.00 0.00 O ATOM 29242 H1 WAT 4891 80.496 125.865 102.205 1.00 0.00 H ATOM 29243 H2 WAT 4891 79.830 125.448 100.912 1.00 0.00 H TER 29245 WAT 4891 ATOM 29245 O WAT 4892 37.227 77.508 63.618 1.00 0.00 O ATOM 29246 H1 WAT 4892 37.327 78.106 62.877 1.00 0.00 H ATOM 29247 H2 WAT 4892 36.924 78.064 64.335 1.00 0.00 H TER 29249 WAT 4892 ATOM 29249 O WAT 4893 109.379 110.516 129.844 1.00 0.00 O ATOM 29250 H1 WAT 4893 110.116 109.917 129.727 1.00 0.00 H ATOM 29251 H2 WAT 4893 108.614 109.943 129.914 1.00 0.00 H TER 29253 WAT 4893 ATOM 29253 O WAT 4894 132.516 97.913 88.083 1.00 0.00 O ATOM 29254 H1 WAT 4894 131.927 97.788 88.827 1.00 0.00 H ATOM 29255 H2 WAT 4894 132.880 97.044 87.918 1.00 0.00 H TER 29257 WAT 4894 ATOM 29257 O WAT 4895 109.501 26.408 96.588 1.00 0.00 O ATOM 29258 H1 WAT 4895 109.756 26.081 97.451 1.00 0.00 H ATOM 29259 H2 WAT 4895 108.975 25.703 96.211 1.00 0.00 H TER 29261 WAT 4895 ATOM 29261 O WAT 4896 22.969 91.852 141.713 1.00 0.00 O ATOM 29262 H1 WAT 4896 23.887 91.603 141.816 1.00 0.00 H ATOM 29263 H2 WAT 4896 22.479 91.080 141.997 1.00 0.00 H TER 29265 WAT 4896 ATOM 29265 O WAT 4897 97.433 123.998 2.036 1.00 0.00 O ATOM 29266 H1 WAT 4897 98.176 123.395 2.049 1.00 0.00 H ATOM 29267 H2 WAT 4897 97.817 124.847 1.814 1.00 0.00 H TER 29269 WAT 4897 ATOM 29269 O WAT 4898 133.588 88.916 27.036 1.00 0.00 O ATOM 29270 H1 WAT 4898 134.225 89.153 26.362 1.00 0.00 H ATOM 29271 H2 WAT 4898 133.664 87.965 27.113 1.00 0.00 H TER 29273 WAT 4898 ATOM 29273 O WAT 4899 95.169 96.350 96.689 1.00 0.00 O ATOM 29274 H1 WAT 4899 94.586 95.600 96.576 1.00 0.00 H ATOM 29275 H2 WAT 4899 95.865 96.212 96.046 1.00 0.00 H TER 29277 WAT 4899 ATOM 29277 O WAT 4900 123.404 92.782 125.655 1.00 0.00 O ATOM 29278 H1 WAT 4900 123.424 93.727 125.803 1.00 0.00 H ATOM 29279 H2 WAT 4900 122.807 92.668 124.915 1.00 0.00 H TER 29281 WAT 4900 ATOM 29281 O WAT 4901 2.841 30.645 100.079 1.00 0.00 O ATOM 29282 H1 WAT 4901 3.004 30.560 101.019 1.00 0.00 H ATOM 29283 H2 WAT 4901 1.915 30.878 100.017 1.00 0.00 H TER 29285 WAT 4901 ATOM 29285 O WAT 4902 116.387 32.659 68.307 1.00 0.00 O ATOM 29286 H1 WAT 4902 115.527 32.301 68.087 1.00 0.00 H ATOM 29287 H2 WAT 4902 116.535 33.344 67.655 1.00 0.00 H TER 29289 WAT 4902 ATOM 29289 O WAT 4903 110.466 128.506 109.621 1.00 0.00 O ATOM 29290 H1 WAT 4903 110.445 129.207 110.272 1.00 0.00 H ATOM 29291 H2 WAT 4903 109.787 127.894 109.906 1.00 0.00 H TER 29293 WAT 4903 ATOM 29293 O WAT 4904 19.956 97.194 120.548 1.00 0.00 O ATOM 29294 H1 WAT 4904 20.138 97.872 119.897 1.00 0.00 H ATOM 29295 H2 WAT 4904 19.424 96.550 120.081 1.00 0.00 H TER 29297 WAT 4904 ATOM 29297 O WAT 4905 130.270 116.007 99.224 1.00 0.00 O ATOM 29298 H1 WAT 4905 130.509 116.826 99.657 1.00 0.00 H ATOM 29299 H2 WAT 4905 129.737 116.278 98.476 1.00 0.00 H TER 29301 WAT 4905 ATOM 29301 O WAT 4906 132.609 113.871 136.420 1.00 0.00 O ATOM 29302 H1 WAT 4906 132.458 114.713 135.990 1.00 0.00 H ATOM 29303 H2 WAT 4906 133.515 113.918 136.725 1.00 0.00 H TER 29305 WAT 4906 ATOM 29305 O WAT 4907 123.640 6.194 14.579 1.00 0.00 O ATOM 29306 H1 WAT 4907 123.575 6.413 15.508 1.00 0.00 H ATOM 29307 H2 WAT 4907 123.835 7.027 14.149 1.00 0.00 H TER 29309 WAT 4907 ATOM 29309 O WAT 4908 4.614 124.821 64.807 1.00 0.00 O ATOM 29310 H1 WAT 4908 4.004 125.237 64.197 1.00 0.00 H ATOM 29311 H2 WAT 4908 5.092 124.188 64.272 1.00 0.00 H TER 29313 WAT 4908 ATOM 29313 O WAT 4909 113.569 89.683 100.361 1.00 0.00 O ATOM 29314 H1 WAT 4909 112.923 90.367 100.186 1.00 0.00 H ATOM 29315 H2 WAT 4909 113.084 88.864 100.256 1.00 0.00 H TER 29317 WAT 4909 ATOM 29317 O WAT 4910 40.134 85.468 9.741 1.00 0.00 O ATOM 29318 H1 WAT 4910 39.585 84.924 9.175 1.00 0.00 H ATOM 29319 H2 WAT 4910 39.524 85.844 10.376 1.00 0.00 H TER 29321 WAT 4910 ATOM 29321 O WAT 4911 89.352 85.264 72.261 1.00 0.00 O ATOM 29322 H1 WAT 4911 88.869 85.613 73.010 1.00 0.00 H ATOM 29323 H2 WAT 4911 89.957 84.627 72.642 1.00 0.00 H TER 29325 WAT 4911 ATOM 29325 O WAT 4912 64.596 40.992 87.799 1.00 0.00 O ATOM 29326 H1 WAT 4912 65.216 41.702 87.966 1.00 0.00 H ATOM 29327 H2 WAT 4912 64.786 40.713 86.903 1.00 0.00 H TER 29329 WAT 4912 ATOM 29329 O WAT 4913 91.695 84.082 9.441 1.00 0.00 O ATOM 29330 H1 WAT 4913 91.444 83.795 8.563 1.00 0.00 H ATOM 29331 H2 WAT 4913 91.786 85.032 9.365 1.00 0.00 H TER 29333 WAT 4913 ATOM 29333 O WAT 4914 36.828 14.040 143.021 1.00 0.00 O ATOM 29334 H1 WAT 4914 37.694 13.643 143.114 1.00 0.00 H ATOM 29335 H2 WAT 4914 36.345 13.431 142.463 1.00 0.00 H TER 29337 WAT 4914 ATOM 29337 O WAT 4915 53.590 29.050 120.362 1.00 0.00 O ATOM 29338 H1 WAT 4915 54.152 28.349 120.693 1.00 0.00 H ATOM 29339 H2 WAT 4915 53.753 29.061 119.419 1.00 0.00 H TER 29341 WAT 4915 ATOM 29341 O WAT 4916 11.495 59.639 12.093 1.00 0.00 O ATOM 29342 H1 WAT 4916 12.402 59.464 12.343 1.00 0.00 H ATOM 29343 H2 WAT 4916 11.065 59.889 12.910 1.00 0.00 H TER 29345 WAT 4916 ATOM 29345 O WAT 4917 134.795 67.546 91.863 1.00 0.00 O ATOM 29346 H1 WAT 4917 134.559 68.435 92.129 1.00 0.00 H ATOM 29347 H2 WAT 4917 134.440 66.987 92.554 1.00 0.00 H TER 29349 WAT 4917 ATOM 29349 O WAT 4918 19.224 3.315 135.801 1.00 0.00 O ATOM 29350 H1 WAT 4918 18.609 3.714 135.186 1.00 0.00 H ATOM 29351 H2 WAT 4918 20.082 3.636 135.523 1.00 0.00 H TER 29353 WAT 4918 ATOM 29353 O WAT 4919 41.529 30.402 158.614 1.00 0.00 O ATOM 29354 H1 WAT 4919 40.968 29.645 158.781 1.00 0.00 H ATOM 29355 H2 WAT 4919 42.400 30.122 158.896 1.00 0.00 H TER 29357 WAT 4919 ATOM 29357 O WAT 4920 125.151 45.183 88.205 1.00 0.00 O ATOM 29358 H1 WAT 4920 125.873 45.706 87.856 1.00 0.00 H ATOM 29359 H2 WAT 4920 125.053 45.484 89.109 1.00 0.00 H TER 29361 WAT 4920 ATOM 29361 O WAT 4921 14.148 121.236 79.394 1.00 0.00 O ATOM 29362 H1 WAT 4921 14.220 120.323 79.674 1.00 0.00 H ATOM 29363 H2 WAT 4921 14.376 121.744 80.173 1.00 0.00 H TER 29365 WAT 4921 ATOM 29365 O WAT 4922 110.300 13.748 1.811 1.00 0.00 O ATOM 29366 H1 WAT 4922 110.613 14.487 2.334 1.00 0.00 H ATOM 29367 H2 WAT 4922 110.016 14.142 0.986 1.00 0.00 H TER 29369 WAT 4922 ATOM 29369 O WAT 4923 86.542 10.876 101.684 1.00 0.00 O ATOM 29370 H1 WAT 4923 87.049 10.117 101.396 1.00 0.00 H ATOM 29371 H2 WAT 4923 86.479 10.776 102.634 1.00 0.00 H TER 29373 WAT 4923 ATOM 29373 O WAT 4924 44.144 35.571 149.106 1.00 0.00 O ATOM 29374 H1 WAT 4924 43.267 35.223 149.268 1.00 0.00 H ATOM 29375 H2 WAT 4924 44.649 34.816 148.803 1.00 0.00 H TER 29377 WAT 4924 ATOM 29377 O WAT 4925 77.973 19.239 148.476 1.00 0.00 O ATOM 29378 H1 WAT 4925 77.937 18.392 148.920 1.00 0.00 H ATOM 29379 H2 WAT 4925 78.896 19.490 148.512 1.00 0.00 H TER 29381 WAT 4925 ATOM 29381 O WAT 4926 0.356 105.277 145.786 1.00 0.00 O ATOM 29382 H1 WAT 4926 1.106 105.853 145.635 1.00 0.00 H ATOM 29383 H2 WAT 4926 -0.376 105.719 145.357 1.00 0.00 H TER 29385 WAT 4926 ATOM 29385 O WAT 4927 84.711 59.568 56.554 1.00 0.00 O ATOM 29386 H1 WAT 4927 83.791 59.383 56.367 1.00 0.00 H ATOM 29387 H2 WAT 4927 84.688 60.193 57.278 1.00 0.00 H TER 29389 WAT 4927 ATOM 29389 O WAT 4928 58.535 83.664 82.587 1.00 0.00 O ATOM 29390 H1 WAT 4928 58.850 84.371 83.151 1.00 0.00 H ATOM 29391 H2 WAT 4928 57.582 83.699 82.670 1.00 0.00 H TER 29393 WAT 4928 ATOM 29393 O WAT 4929 85.140 10.520 73.576 1.00 0.00 O ATOM 29394 H1 WAT 4929 84.477 9.961 73.171 1.00 0.00 H ATOM 29395 H2 WAT 4929 84.764 10.764 74.421 1.00 0.00 H TER 29397 WAT 4929 ATOM 29397 O WAT 4930 33.387 106.051 72.021 1.00 0.00 O ATOM 29398 H1 WAT 4930 33.028 105.519 72.730 1.00 0.00 H ATOM 29399 H2 WAT 4930 34.295 105.761 71.940 1.00 0.00 H TER 29401 WAT 4930 ATOM 29401 O WAT 4931 88.560 60.152 101.213 1.00 0.00 O ATOM 29402 H1 WAT 4931 88.688 61.086 101.379 1.00 0.00 H ATOM 29403 H2 WAT 4931 89.274 59.725 101.686 1.00 0.00 H TER 29405 WAT 4931 ATOM 29405 O WAT 4932 137.060 25.041 148.250 1.00 0.00 O ATOM 29406 H1 WAT 4932 136.757 25.889 148.574 1.00 0.00 H ATOM 29407 H2 WAT 4932 136.353 24.434 148.471 1.00 0.00 H TER 29409 WAT 4932 ATOM 29409 O WAT 4933 83.638 121.599 97.100 1.00 0.00 O ATOM 29410 H1 WAT 4933 84.389 122.177 96.965 1.00 0.00 H ATOM 29411 H2 WAT 4933 83.728 120.928 96.423 1.00 0.00 H TER 29413 WAT 4933 ATOM 29413 O WAT 4934 105.089 101.362 126.175 1.00 0.00 O ATOM 29414 H1 WAT 4934 104.709 102.153 125.792 1.00 0.00 H ATOM 29415 H2 WAT 4934 105.608 100.979 125.467 1.00 0.00 H TER 29417 WAT 4934 ATOM 29417 O WAT 4935 37.267 118.890 129.412 1.00 0.00 O ATOM 29418 H1 WAT 4935 36.723 118.335 129.971 1.00 0.00 H ATOM 29419 H2 WAT 4935 36.655 119.522 129.034 1.00 0.00 H TER 29421 WAT 4935 ATOM 29421 O WAT 4936 97.298 50.171 111.093 1.00 0.00 O ATOM 29422 H1 WAT 4936 98.114 50.248 110.597 1.00 0.00 H ATOM 29423 H2 WAT 4936 96.863 51.014 110.968 1.00 0.00 H TER 29425 WAT 4936 ATOM 29425 O WAT 4937 116.951 77.942 145.931 1.00 0.00 O ATOM 29426 H1 WAT 4937 117.615 78.261 145.319 1.00 0.00 H ATOM 29427 H2 WAT 4937 116.342 78.675 146.026 1.00 0.00 H TER 29429 WAT 4937 ATOM 29429 O WAT 4938 53.250 113.691 78.436 1.00 0.00 O ATOM 29430 H1 WAT 4938 53.809 113.532 77.675 1.00 0.00 H ATOM 29431 H2 WAT 4938 52.625 114.353 78.140 1.00 0.00 H TER 29433 WAT 4938 ATOM 29433 O WAT 4939 35.003 79.863 145.645 1.00 0.00 O ATOM 29434 H1 WAT 4939 35.779 79.934 146.202 1.00 0.00 H ATOM 29435 H2 WAT 4939 34.574 79.058 145.933 1.00 0.00 H TER 29437 WAT 4939 ATOM 29437 O WAT 4940 8.639 63.054 84.948 1.00 0.00 O ATOM 29438 H1 WAT 4940 9.042 63.599 85.625 1.00 0.00 H ATOM 29439 H2 WAT 4940 7.723 63.331 84.931 1.00 0.00 H TER 29441 WAT 4940 ATOM 29441 O WAT 4941 42.476 11.018 132.890 1.00 0.00 O ATOM 29442 H1 WAT 4941 41.860 10.937 132.162 1.00 0.00 H ATOM 29443 H2 WAT 4941 43.336 10.887 132.491 1.00 0.00 H TER 29445 WAT 4941 ATOM 29445 O WAT 4942 136.630 68.597 134.286 1.00 0.00 O ATOM 29446 H1 WAT 4942 136.506 67.839 134.857 1.00 0.00 H ATOM 29447 H2 WAT 4942 137.428 69.014 134.611 1.00 0.00 H TER 29449 WAT 4942 ATOM 29449 O WAT 4943 116.347 23.573 115.201 1.00 0.00 O ATOM 29450 H1 WAT 4943 116.620 24.342 114.702 1.00 0.00 H ATOM 29451 H2 WAT 4943 117.148 23.263 115.622 1.00 0.00 H TER 29453 WAT 4943 ATOM 29453 O WAT 4944 126.521 43.919 7.037 1.00 0.00 O ATOM 29454 H1 WAT 4944 125.943 43.515 7.684 1.00 0.00 H ATOM 29455 H2 WAT 4944 125.961 44.070 6.275 1.00 0.00 H TER 29457 WAT 4944 ATOM 29457 O WAT 4945 34.743 112.279 10.326 1.00 0.00 O ATOM 29458 H1 WAT 4945 34.127 111.970 10.992 1.00 0.00 H ATOM 29459 H2 WAT 4945 34.309 112.091 9.494 1.00 0.00 H TER 29461 WAT 4945 ATOM 29461 O WAT 4946 104.064 26.385 106.282 1.00 0.00 O ATOM 29462 H1 WAT 4946 104.178 27.336 106.298 1.00 0.00 H ATOM 29463 H2 WAT 4946 104.063 26.129 107.204 1.00 0.00 H TER 29465 WAT 4946 ATOM 29465 O WAT 4947 37.579 97.477 60.969 1.00 0.00 O ATOM 29466 H1 WAT 4947 37.116 98.291 61.167 1.00 0.00 H ATOM 29467 H2 WAT 4947 37.266 97.229 60.099 1.00 0.00 H TER 29469 WAT 4947 ATOM 29469 O WAT 4948 143.495 50.836 57.042 1.00 0.00 O ATOM 29470 H1 WAT 4948 142.796 51.018 57.670 1.00 0.00 H ATOM 29471 H2 WAT 4948 143.037 50.549 56.252 1.00 0.00 H TER 29473 WAT 4948 ATOM 29473 O WAT 4949 124.663 10.549 114.904 1.00 0.00 O ATOM 29474 H1 WAT 4949 124.248 9.702 114.741 1.00 0.00 H ATOM 29475 H2 WAT 4949 124.602 11.010 114.067 1.00 0.00 H TER 29477 WAT 4949 ATOM 29477 O WAT 4950 103.851 38.797 15.759 1.00 0.00 O ATOM 29478 H1 WAT 4950 102.990 38.880 15.349 1.00 0.00 H ATOM 29479 H2 WAT 4950 103.697 38.256 16.534 1.00 0.00 H TER 29481 WAT 4950 ATOM 29481 O WAT 4951 100.789 142.465 147.666 1.00 0.00 O ATOM 29482 H1 WAT 4951 101.069 143.174 147.087 1.00 0.00 H ATOM 29483 H2 WAT 4951 100.939 142.803 148.548 1.00 0.00 H TER 29485 WAT 4951 ATOM 29485 O WAT 4952 128.294 132.115 130.677 1.00 0.00 O ATOM 29486 H1 WAT 4952 128.900 131.604 130.140 1.00 0.00 H ATOM 29487 H2 WAT 4952 128.859 132.615 131.266 1.00 0.00 H TER 29489 WAT 4952 ATOM 29489 O WAT 4953 54.892 108.039 138.756 1.00 0.00 O ATOM 29490 H1 WAT 4953 54.695 108.844 139.236 1.00 0.00 H ATOM 29491 H2 WAT 4953 55.521 107.577 139.310 1.00 0.00 H TER 29493 WAT 4953 ATOM 29493 O WAT 4954 8.465 104.637 146.555 1.00 0.00 O ATOM 29494 H1 WAT 4954 8.311 104.296 147.436 1.00 0.00 H ATOM 29495 H2 WAT 4954 9.017 105.407 146.690 1.00 0.00 H TER 29497 WAT 4954 ATOM 29497 O WAT 4955 139.051 143.654 94.940 1.00 0.00 O ATOM 29498 H1 WAT 4955 139.360 142.821 95.297 1.00 0.00 H ATOM 29499 H2 WAT 4955 138.545 144.046 95.651 1.00 0.00 H TER 29501 WAT 4955 ATOM 29501 O WAT 4956 67.698 31.762 125.529 1.00 0.00 O ATOM 29502 H1 WAT 4956 68.027 32.363 124.860 1.00 0.00 H ATOM 29503 H2 WAT 4956 66.917 31.371 125.136 1.00 0.00 H TER 29505 WAT 4956 ATOM 29505 O WAT 4957 34.569 124.881 138.996 1.00 0.00 O ATOM 29506 H1 WAT 4957 33.709 124.779 139.404 1.00 0.00 H ATOM 29507 H2 WAT 4957 34.619 125.810 138.772 1.00 0.00 H TER 29509 WAT 4957 ATOM 29509 O WAT 4958 129.841 21.399 61.092 1.00 0.00 O ATOM 29510 H1 WAT 4958 130.342 21.798 60.381 1.00 0.00 H ATOM 29511 H2 WAT 4958 130.473 20.846 61.551 1.00 0.00 H TER 29513 WAT 4958 ATOM 29513 O WAT 4959 79.610 24.424 87.446 1.00 0.00 O ATOM 29514 H1 WAT 4959 79.243 23.695 87.946 1.00 0.00 H ATOM 29515 H2 WAT 4959 79.517 24.158 86.531 1.00 0.00 H TER 29517 WAT 4959 ATOM 29517 O WAT 4960 138.803 34.367 3.523 1.00 0.00 O ATOM 29518 H1 WAT 4960 138.045 34.951 3.563 1.00 0.00 H ATOM 29519 H2 WAT 4960 138.454 33.545 3.179 1.00 0.00 H TER 29521 WAT 4960 ATOM 29521 O WAT 4961 54.825 109.222 103.969 1.00 0.00 O ATOM 29522 H1 WAT 4961 54.028 108.701 103.867 1.00 0.00 H ATOM 29523 H2 WAT 4961 55.527 108.649 103.661 1.00 0.00 H TER 29525 WAT 4961 ATOM 29525 O WAT 4962 4.079 54.422 75.780 1.00 0.00 O ATOM 29526 H1 WAT 4962 3.500 55.099 75.429 1.00 0.00 H ATOM 29527 H2 WAT 4962 4.646 54.187 75.045 1.00 0.00 H TER 29529 WAT 4962 ATOM 29529 O WAT 4963 144.346 104.390 119.392 1.00 0.00 O ATOM 29530 H1 WAT 4963 144.714 105.231 119.665 1.00 0.00 H ATOM 29531 H2 WAT 4963 143.409 104.558 119.295 1.00 0.00 H TER 29533 WAT 4963 ATOM 29533 O WAT 4964 111.492 13.299 154.525 1.00 0.00 O ATOM 29534 H1 WAT 4964 110.890 13.331 155.269 1.00 0.00 H ATOM 29535 H2 WAT 4964 112.302 12.942 154.887 1.00 0.00 H TER 29537 WAT 4964 ATOM 29537 O WAT 4965 87.833 2.573 79.898 1.00 0.00 O ATOM 29538 H1 WAT 4965 88.642 3.078 79.813 1.00 0.00 H ATOM 29539 H2 WAT 4965 87.322 3.047 80.554 1.00 0.00 H TER 29541 WAT 4965 ATOM 29541 O WAT 4966 133.334 66.446 27.098 1.00 0.00 O ATOM 29542 H1 WAT 4966 132.802 65.653 27.169 1.00 0.00 H ATOM 29543 H2 WAT 4966 133.703 66.409 26.216 1.00 0.00 H TER 29545 WAT 4966 ATOM 29545 O WAT 4967 131.804 44.033 133.103 1.00 0.00 O ATOM 29546 H1 WAT 4967 132.323 43.253 133.302 1.00 0.00 H ATOM 29547 H2 WAT 4967 131.686 44.464 133.950 1.00 0.00 H TER 29549 WAT 4967 ATOM 29549 O WAT 4968 55.790 96.349 66.056 1.00 0.00 O ATOM 29550 H1 WAT 4968 56.396 96.907 65.569 1.00 0.00 H ATOM 29551 H2 WAT 4968 55.394 95.786 65.390 1.00 0.00 H TER 29553 WAT 4968 ATOM 29553 O WAT 4969 119.994 67.505 91.622 1.00 0.00 O ATOM 29554 H1 WAT 4969 119.703 68.050 92.353 1.00 0.00 H ATOM 29555 H2 WAT 4969 120.860 67.845 91.399 1.00 0.00 H TER 29557 WAT 4969 ATOM 29557 O WAT 4970 56.292 24.180 111.012 1.00 0.00 O ATOM 29558 H1 WAT 4970 57.012 23.790 110.515 1.00 0.00 H ATOM 29559 H2 WAT 4970 56.262 23.675 111.825 1.00 0.00 H TER 29561 WAT 4970 ATOM 29561 O WAT 4971 138.771 53.803 137.752 1.00 0.00 O ATOM 29562 H1 WAT 4971 139.657 53.515 137.973 1.00 0.00 H ATOM 29563 H2 WAT 4971 138.330 53.010 137.448 1.00 0.00 H TER 29565 WAT 4971 ATOM 29565 O WAT 4972 2.484 95.484 157.532 1.00 0.00 O ATOM 29566 H1 WAT 4972 3.061 95.849 158.203 1.00 0.00 H ATOM 29567 H2 WAT 4972 1.772 95.075 158.026 1.00 0.00 H TER 29569 WAT 4972 ATOM 29569 O WAT 4973 122.497 58.752 145.579 1.00 0.00 O ATOM 29570 H1 WAT 4973 122.268 59.172 146.408 1.00 0.00 H ATOM 29571 H2 WAT 4973 123.382 58.414 145.718 1.00 0.00 H TER 29573 WAT 4973 ATOM 29573 O WAT 4974 89.192 142.654 85.235 1.00 0.00 O ATOM 29574 H1 WAT 4974 89.928 142.078 85.030 1.00 0.00 H ATOM 29575 H2 WAT 4974 88.708 142.189 85.918 1.00 0.00 H TER 29577 WAT 4974 ATOM 29577 O WAT 4975 132.470 16.624 116.885 1.00 0.00 O ATOM 29578 H1 WAT 4975 132.854 15.846 117.289 1.00 0.00 H ATOM 29579 H2 WAT 4975 131.545 16.403 116.772 1.00 0.00 H TER 29581 WAT 4975 ATOM 29581 O WAT 4976 41.998 27.184 147.621 1.00 0.00 O ATOM 29582 H1 WAT 4976 41.286 27.474 148.191 1.00 0.00 H ATOM 29583 H2 WAT 4976 41.949 27.766 146.863 1.00 0.00 H TER 29585 WAT 4976 ATOM 29585 O WAT 4977 142.568 55.039 2.463 1.00 0.00 O ATOM 29586 H1 WAT 4977 143.355 54.648 2.841 1.00 0.00 H ATOM 29587 H2 WAT 4977 142.189 54.343 1.925 1.00 0.00 H TER 29589 WAT 4977 ATOM 29589 O WAT 4978 140.874 72.071 106.171 1.00 0.00 O ATOM 29590 H1 WAT 4978 140.578 71.167 106.067 1.00 0.00 H ATOM 29591 H2 WAT 4978 141.611 72.014 106.780 1.00 0.00 H TER 29593 WAT 4978 ATOM 29593 O WAT 4979 39.681 108.335 117.561 1.00 0.00 O ATOM 29594 H1 WAT 4979 39.110 107.928 118.213 1.00 0.00 H ATOM 29595 H2 WAT 4979 39.196 109.104 117.264 1.00 0.00 H TER 29597 WAT 4979 ATOM 29597 O WAT 4980 59.608 75.662 4.457 1.00 0.00 O ATOM 29598 H1 WAT 4980 59.438 74.735 4.291 1.00 0.00 H ATOM 29599 H2 WAT 4980 59.989 75.683 5.335 1.00 0.00 H TER 29601 WAT 4980 ATOM 29601 O WAT 4981 127.434 82.265 12.214 1.00 0.00 O ATOM 29602 H1 WAT 4981 126.708 82.323 11.592 1.00 0.00 H ATOM 29603 H2 WAT 4981 128.200 82.550 11.714 1.00 0.00 H TER 29605 WAT 4981 ATOM 29605 O WAT 4982 20.505 2.944 83.333 1.00 0.00 O ATOM 29606 H1 WAT 4982 20.612 2.153 82.805 1.00 0.00 H ATOM 29607 H2 WAT 4982 19.713 2.784 83.847 1.00 0.00 H TER 29609 WAT 4982 ATOM 29609 O WAT 4983 105.662 129.930 102.558 1.00 0.00 O ATOM 29610 H1 WAT 4983 105.831 130.791 102.942 1.00 0.00 H ATOM 29611 H2 WAT 4983 105.909 130.026 101.638 1.00 0.00 H TER 29613 WAT 4983 ATOM 29613 O WAT 4984 100.398 87.620 149.328 1.00 0.00 O ATOM 29614 H1 WAT 4984 100.508 88.565 149.221 1.00 0.00 H ATOM 29615 H2 WAT 4984 100.885 87.411 150.125 1.00 0.00 H TER 29617 WAT 4984 ATOM 29617 O WAT 4985 16.708 129.981 72.451 1.00 0.00 O ATOM 29618 H1 WAT 4985 15.961 129.485 72.116 1.00 0.00 H ATOM 29619 H2 WAT 4985 17.210 130.213 71.670 1.00 0.00 H TER 29621 WAT 4985 ATOM 29621 O WAT 4986 1.072 105.156 63.141 1.00 0.00 O ATOM 29622 H1 WAT 4986 1.620 104.500 63.573 1.00 0.00 H ATOM 29623 H2 WAT 4986 0.548 105.534 63.848 1.00 0.00 H TER 29625 WAT 4986 ATOM 29625 O WAT 4987 77.731 100.291 9.657 1.00 0.00 O ATOM 29626 H1 WAT 4987 76.797 100.388 9.843 1.00 0.00 H ATOM 29627 H2 WAT 4987 78.011 101.164 9.381 1.00 0.00 H TER 29629 WAT 4987 ATOM 29629 O WAT 4988 60.986 43.432 124.774 1.00 0.00 O ATOM 29630 H1 WAT 4988 61.388 42.883 124.101 1.00 0.00 H ATOM 29631 H2 WAT 4988 61.197 44.328 124.510 1.00 0.00 H TER 29633 WAT 4988 ATOM 29633 O WAT 4989 58.862 107.420 17.272 1.00 0.00 O ATOM 29634 H1 WAT 4989 59.368 107.114 16.519 1.00 0.00 H ATOM 29635 H2 WAT 4989 59.047 108.358 17.319 1.00 0.00 H TER 29637 WAT 4989 ATOM 29637 O WAT 4990 134.847 91.154 134.056 1.00 0.00 O ATOM 29638 H1 WAT 4990 134.103 91.740 134.195 1.00 0.00 H ATOM 29639 H2 WAT 4990 134.742 90.842 133.157 1.00 0.00 H TER 29641 WAT 4990 ATOM 29641 O WAT 4991 95.063 37.261 121.262 1.00 0.00 O ATOM 29642 H1 WAT 4991 94.349 36.764 120.863 1.00 0.00 H ATOM 29643 H2 WAT 4991 95.701 37.372 120.558 1.00 0.00 H TER 29645 WAT 4991 ATOM 29645 O WAT 4992 118.050 18.067 102.286 1.00 0.00 O ATOM 29646 H1 WAT 4992 118.248 18.959 102.003 1.00 0.00 H ATOM 29647 H2 WAT 4992 118.885 17.603 102.215 1.00 0.00 H TER 29649 WAT 4992 ATOM 29649 O WAT 4993 45.856 65.860 111.227 1.00 0.00 O ATOM 29650 H1 WAT 4993 45.913 66.541 110.557 1.00 0.00 H ATOM 29651 H2 WAT 4993 45.143 65.293 110.933 1.00 0.00 H TER 29653 WAT 4993 ATOM 29653 O WAT 4994 23.799 28.546 154.033 1.00 0.00 O ATOM 29654 H1 WAT 4994 23.940 28.526 153.087 1.00 0.00 H ATOM 29655 H2 WAT 4994 24.312 29.296 154.336 1.00 0.00 H TER 29657 WAT 4994 ATOM 29657 O WAT 4995 22.432 120.661 101.382 1.00 0.00 O ATOM 29658 H1 WAT 4995 23.107 120.684 102.060 1.00 0.00 H ATOM 29659 H2 WAT 4995 22.851 121.048 100.613 1.00 0.00 H TER 29661 WAT 4995 ATOM 29661 O WAT 4996 6.335 15.903 82.118 1.00 0.00 O ATOM 29662 H1 WAT 4996 7.086 15.940 82.710 1.00 0.00 H ATOM 29663 H2 WAT 4996 6.686 16.168 81.268 1.00 0.00 H TER 29665 WAT 4996 ATOM 29665 O WAT 4997 110.685 92.951 108.303 1.00 0.00 O ATOM 29666 H1 WAT 4997 110.306 93.787 108.573 1.00 0.00 H ATOM 29667 H2 WAT 4997 111.494 93.190 107.849 1.00 0.00 H TER 29669 WAT 4997 ATOM 29669 O WAT 4998 18.923 114.059 129.482 1.00 0.00 O ATOM 29670 H1 WAT 4998 18.197 114.546 129.093 1.00 0.00 H ATOM 29671 H2 WAT 4998 18.677 113.954 130.401 1.00 0.00 H TER 29673 WAT 4998 ATOM 29673 O WAT 4999 107.583 55.557 139.863 1.00 0.00 O ATOM 29674 H1 WAT 4999 107.072 55.121 140.545 1.00 0.00 H ATOM 29675 H2 WAT 4999 108.181 56.130 140.342 1.00 0.00 H TER 29677 WAT 4999 ATOM 29677 O WAT 5000 84.075 0.307 77.219 1.00 0.00 O ATOM 29678 H1 WAT 5000 84.362 0.761 76.427 1.00 0.00 H ATOM 29679 H2 WAT 5000 84.722 0.548 77.881 1.00 0.00 H TER 29681 WAT 5000 ATOM 29681 O WAT 5001 79.318 137.815 13.708 1.00 0.00 O ATOM 29682 H1 WAT 5001 78.922 137.545 12.879 1.00 0.00 H ATOM 29683 H2 WAT 5001 80.241 137.955 13.498 1.00 0.00 H TER 29685 WAT 5001 ATOM 29685 O WAT 5002 4.600 2.188 154.387 1.00 0.00 O ATOM 29686 H1 WAT 5002 4.423 1.881 155.276 1.00 0.00 H ATOM 29687 H2 WAT 5002 5.276 2.856 154.494 1.00 0.00 H TER 29689 WAT 5002 ATOM 29689 O WAT 5003 92.657 118.627 61.924 1.00 0.00 O ATOM 29690 H1 WAT 5003 92.846 119.055 61.089 1.00 0.00 H ATOM 29691 H2 WAT 5003 93.432 118.797 62.461 1.00 0.00 H TER 29693 WAT 5003 ATOM 29693 O WAT 5004 99.087 134.610 55.136 1.00 0.00 O ATOM 29694 H1 WAT 5004 99.773 133.991 55.388 1.00 0.00 H ATOM 29695 H2 WAT 5004 98.474 134.089 54.617 1.00 0.00 H TER 29697 WAT 5004 ATOM 29697 O WAT 5005 28.914 58.260 117.296 1.00 0.00 O ATOM 29698 H1 WAT 5005 28.944 57.546 117.932 1.00 0.00 H ATOM 29699 H2 WAT 5005 28.007 58.565 117.321 1.00 0.00 H TER 29701 WAT 5005 ATOM 29701 O WAT 5006 82.710 112.831 22.086 1.00 0.00 O ATOM 29702 H1 WAT 5006 81.780 112.743 22.293 1.00 0.00 H ATOM 29703 H2 WAT 5006 82.759 112.689 21.140 1.00 0.00 H TER 29705 WAT 5006 ATOM 29705 O WAT 5007 125.465 84.594 134.337 1.00 0.00 O ATOM 29706 H1 WAT 5007 125.626 85.472 134.681 1.00 0.00 H ATOM 29707 H2 WAT 5007 126.053 84.520 133.585 1.00 0.00 H TER 29709 WAT 5007 ATOM 29709 O WAT 5008 82.006 122.577 6.890 1.00 0.00 O ATOM 29710 H1 WAT 5008 82.130 123.457 7.247 1.00 0.00 H ATOM 29711 H2 WAT 5008 82.212 121.992 7.619 1.00 0.00 H TER 29713 WAT 5008 ATOM 29713 O WAT 5009 124.616 67.587 94.692 1.00 0.00 O ATOM 29714 H1 WAT 5009 124.193 66.877 94.209 1.00 0.00 H ATOM 29715 H2 WAT 5009 124.058 68.349 94.536 1.00 0.00 H TER 29717 WAT 5009 ATOM 29717 O WAT 5010 84.092 90.509 62.629 1.00 0.00 O ATOM 29718 H1 WAT 5010 84.316 89.977 61.866 1.00 0.00 H ATOM 29719 H2 WAT 5010 84.559 91.333 62.493 1.00 0.00 H TER 29721 WAT 5010 ATOM 29721 O WAT 5011 32.543 59.631 151.660 1.00 0.00 O ATOM 29722 H1 WAT 5011 32.303 59.151 150.867 1.00 0.00 H ATOM 29723 H2 WAT 5011 32.466 58.986 152.363 1.00 0.00 H TER 29725 WAT 5011 ATOM 29725 O WAT 5012 74.552 111.463 4.880 1.00 0.00 O ATOM 29726 H1 WAT 5012 74.249 110.575 4.689 1.00 0.00 H ATOM 29727 H2 WAT 5012 75.428 111.344 5.245 1.00 0.00 H TER 29729 WAT 5012 ATOM 29729 O WAT 5013 140.114 20.500 12.717 1.00 0.00 O ATOM 29730 H1 WAT 5013 140.102 19.549 12.824 1.00 0.00 H ATOM 29731 H2 WAT 5013 139.813 20.644 11.820 1.00 0.00 H TER 29733 WAT 5013 ATOM 29733 O WAT 5014 120.296 121.765 6.663 1.00 0.00 O ATOM 29734 H1 WAT 5014 120.505 120.871 6.935 1.00 0.00 H ATOM 29735 H2 WAT 5014 120.001 122.197 7.465 1.00 0.00 H TER 29737 WAT 5014 ATOM 29737 O WAT 5015 133.549 103.801 127.133 1.00 0.00 O ATOM 29738 H1 WAT 5015 133.056 104.615 127.031 1.00 0.00 H ATOM 29739 H2 WAT 5015 134.410 104.080 127.445 1.00 0.00 H TER 29741 WAT 5015 ATOM 29741 O WAT 5016 69.884 120.524 122.610 1.00 0.00 O ATOM 29742 H1 WAT 5016 70.020 121.240 121.989 1.00 0.00 H ATOM 29743 H2 WAT 5016 69.641 120.960 123.427 1.00 0.00 H TER 29745 WAT 5016 ATOM 29745 O WAT 5017 25.467 39.764 77.300 1.00 0.00 O ATOM 29746 H1 WAT 5017 26.417 39.881 77.287 1.00 0.00 H ATOM 29747 H2 WAT 5017 25.310 39.164 78.030 1.00 0.00 H TER 29749 WAT 5017 ATOM 29749 O WAT 5018 133.430 81.253 6.943 1.00 0.00 O ATOM 29750 H1 WAT 5018 133.762 80.917 7.775 1.00 0.00 H ATOM 29751 H2 WAT 5018 132.552 80.879 6.867 1.00 0.00 H TER 29753 WAT 5018 ATOM 29753 O WAT 5019 88.627 24.933 139.046 1.00 0.00 O ATOM 29754 H1 WAT 5019 89.388 25.113 139.598 1.00 0.00 H ATOM 29755 H2 WAT 5019 88.739 24.022 138.775 1.00 0.00 H TER 29757 WAT 5019 ATOM 29757 O WAT 5020 105.213 132.178 137.574 1.00 0.00 O ATOM 29758 H1 WAT 5020 105.038 131.624 138.335 1.00 0.00 H ATOM 29759 H2 WAT 5020 104.352 132.501 137.310 1.00 0.00 H TER 29761 WAT 5020 ATOM 29761 O WAT 5021 130.916 95.544 93.590 1.00 0.00 O ATOM 29762 H1 WAT 5021 131.328 95.604 92.728 1.00 0.00 H ATOM 29763 H2 WAT 5021 131.397 94.848 94.037 1.00 0.00 H TER 29765 WAT 5021 ATOM 29765 O WAT 5022 47.399 81.419 68.793 1.00 0.00 O ATOM 29766 H1 WAT 5022 47.463 80.722 69.445 1.00 0.00 H ATOM 29767 H2 WAT 5022 48.145 81.989 68.978 1.00 0.00 H TER 29769 WAT 5022 ATOM 29769 O WAT 5023 27.711 19.498 17.974 1.00 0.00 O ATOM 29770 H1 WAT 5023 27.786 18.569 17.754 1.00 0.00 H ATOM 29771 H2 WAT 5023 27.492 19.507 18.906 1.00 0.00 H TER 29773 WAT 5023 ATOM 29773 O WAT 5024 109.018 69.145 9.368 1.00 0.00 O ATOM 29774 H1 WAT 5024 109.648 69.863 9.303 1.00 0.00 H ATOM 29775 H2 WAT 5024 108.338 69.476 9.955 1.00 0.00 H TER 29777 WAT 5024 ATOM 29777 O WAT 5025 100.891 47.171 142.510 1.00 0.00 O ATOM 29778 H1 WAT 5025 100.137 46.686 142.845 1.00 0.00 H ATOM 29779 H2 WAT 5025 100.579 48.072 142.427 1.00 0.00 H TER 29781 WAT 5025 ATOM 29781 O WAT 5026 142.199 107.468 117.710 1.00 0.00 O ATOM 29782 H1 WAT 5026 142.623 108.093 117.121 1.00 0.00 H ATOM 29783 H2 WAT 5026 142.094 107.946 118.532 1.00 0.00 H TER 29785 WAT 5026 ATOM 29785 O WAT 5027 101.656 12.883 104.692 1.00 0.00 O ATOM 29786 H1 WAT 5027 100.899 12.413 104.341 1.00 0.00 H ATOM 29787 H2 WAT 5027 101.498 13.798 104.459 1.00 0.00 H TER 29789 WAT 5027 ATOM 29789 O WAT 5028 99.818 99.600 78.719 1.00 0.00 O ATOM 29790 H1 WAT 5028 100.529 100.232 78.617 1.00 0.00 H ATOM 29791 H2 WAT 5028 99.965 98.959 78.023 1.00 0.00 H TER 29793 WAT 5028 ATOM 29793 O WAT 5029 55.245 82.489 153.299 1.00 0.00 O ATOM 29794 H1 WAT 5029 55.109 82.104 154.165 1.00 0.00 H ATOM 29795 H2 WAT 5029 55.893 83.179 153.443 1.00 0.00 H TER 29797 WAT 5029 ATOM 29797 O WAT 5030 118.658 34.259 125.717 1.00 0.00 O ATOM 29798 H1 WAT 5030 119.403 34.773 125.408 1.00 0.00 H ATOM 29799 H2 WAT 5030 118.334 33.811 124.935 1.00 0.00 H TER 29801 WAT 5030 ATOM 29801 O WAT 5031 129.922 114.766 25.980 1.00 0.00 O ATOM 29802 H1 WAT 5031 129.430 114.231 25.357 1.00 0.00 H ATOM 29803 H2 WAT 5031 130.359 115.423 25.439 1.00 0.00 H TER 29805 WAT 5031 ATOM 29805 O WAT 5032 67.928 72.995 111.985 1.00 0.00 O ATOM 29806 H1 WAT 5032 67.163 73.416 112.377 1.00 0.00 H ATOM 29807 H2 WAT 5032 67.591 72.571 111.196 1.00 0.00 H TER 29809 WAT 5032 ATOM 29809 O WAT 5033 145.366 2.403 88.178 1.00 0.00 O ATOM 29810 H1 WAT 5033 144.924 1.781 88.756 1.00 0.00 H ATOM 29811 H2 WAT 5033 144.741 2.557 87.469 1.00 0.00 H TER 29813 WAT 5033 ATOM 29813 O WAT 5034 96.552 0.341 0.338 1.00 0.00 O ATOM 29814 H1 WAT 5034 96.020 0.097 -0.419 1.00 0.00 H ATOM 29815 H2 WAT 5034 97.420 0.516 -0.026 1.00 0.00 H TER 29817 WAT 5034 ATOM 29817 O WAT 5035 93.538 25.647 104.968 1.00 0.00 O ATOM 29818 H1 WAT 5035 93.847 26.354 105.534 1.00 0.00 H ATOM 29819 H2 WAT 5035 93.175 26.094 104.203 1.00 0.00 H TER 29821 WAT 5035 ATOM 29821 O WAT 5036 88.232 81.269 128.951 1.00 0.00 O ATOM 29822 H1 WAT 5036 87.460 81.371 128.395 1.00 0.00 H ATOM 29823 H2 WAT 5036 88.536 82.164 129.105 1.00 0.00 H TER 29825 WAT 5036 ATOM 29825 O WAT 5037 94.278 102.090 58.447 1.00 0.00 O ATOM 29826 H1 WAT 5037 94.335 103.029 58.270 1.00 0.00 H ATOM 29827 H2 WAT 5037 94.187 101.688 57.583 1.00 0.00 H TER 29829 WAT 5037 ATOM 29829 O WAT 5038 2.719 70.943 7.765 1.00 0.00 O ATOM 29830 H1 WAT 5038 2.510 71.134 6.851 1.00 0.00 H ATOM 29831 H2 WAT 5038 3.611 71.270 7.880 1.00 0.00 H TER 29833 WAT 5038 ATOM 29833 O WAT 5039 110.852 11.166 110.208 1.00 0.00 O ATOM 29834 H1 WAT 5039 110.717 10.223 110.115 1.00 0.00 H ATOM 29835 H2 WAT 5039 110.471 11.542 109.415 1.00 0.00 H TER 29837 WAT 5039 ATOM 29837 O WAT 5040 4.259 115.442 23.380 1.00 0.00 O ATOM 29838 H1 WAT 5040 4.739 114.675 23.070 1.00 0.00 H ATOM 29839 H2 WAT 5040 4.926 115.992 23.791 1.00 0.00 H TER 29841 WAT 5040 ATOM 29841 O WAT 5041 53.876 133.964 74.804 1.00 0.00 O ATOM 29842 H1 WAT 5041 52.954 134.183 74.938 1.00 0.00 H ATOM 29843 H2 WAT 5041 54.300 134.805 74.637 1.00 0.00 H TER 29845 WAT 5041 ATOM 29845 O WAT 5042 44.344 116.761 0.613 1.00 0.00 O ATOM 29846 H1 WAT 5042 44.639 117.497 0.078 1.00 0.00 H ATOM 29847 H2 WAT 5042 45.150 116.369 0.947 1.00 0.00 H TER 29849 WAT 5042 ATOM 29849 O WAT 5043 108.083 51.801 63.582 1.00 0.00 O ATOM 29850 H1 WAT 5043 107.542 52.300 62.970 1.00 0.00 H ATOM 29851 H2 WAT 5043 108.450 51.092 63.053 1.00 0.00 H TER 29853 WAT 5043 ATOM 29853 O WAT 5044 14.065 120.998 114.757 1.00 0.00 O ATOM 29854 H1 WAT 5044 14.235 121.899 115.032 1.00 0.00 H ATOM 29855 H2 WAT 5044 14.466 120.459 115.439 1.00 0.00 H TER 29857 WAT 5044 ATOM 29857 O WAT 5045 3.741 83.506 102.232 1.00 0.00 O ATOM 29858 H1 WAT 5045 3.692 84.346 101.776 1.00 0.00 H ATOM 29859 H2 WAT 5045 4.569 83.124 101.941 1.00 0.00 H TER 29861 WAT 5045 ATOM 29861 O WAT 5046 118.564 141.374 110.160 1.00 0.00 O ATOM 29862 H1 WAT 5046 118.985 142.234 110.172 1.00 0.00 H ATOM 29863 H2 WAT 5046 119.201 140.802 109.730 1.00 0.00 H TER 29865 WAT 5046 ATOM 29865 O WAT 5047 112.891 41.391 125.228 1.00 0.00 O ATOM 29866 H1 WAT 5047 113.163 41.453 124.313 1.00 0.00 H ATOM 29867 H2 WAT 5047 113.114 40.496 125.485 1.00 0.00 H TER 29869 WAT 5047 ATOM 29869 O WAT 5048 25.315 129.380 91.764 1.00 0.00 O ATOM 29870 H1 WAT 5048 25.692 130.260 91.759 1.00 0.00 H ATOM 29871 H2 WAT 5048 25.599 128.994 90.936 1.00 0.00 H TER 29873 WAT 5048 ATOM 29873 O WAT 5049 81.694 68.832 88.470 1.00 0.00 O ATOM 29874 H1 WAT 5049 82.143 67.991 88.383 1.00 0.00 H ATOM 29875 H2 WAT 5049 81.461 69.072 87.573 1.00 0.00 H TER 29877 WAT 5049 ATOM 29877 O WAT 5050 134.839 54.354 10.186 1.00 0.00 O ATOM 29878 H1 WAT 5050 135.682 54.790 10.061 1.00 0.00 H ATOM 29879 H2 WAT 5050 135.040 53.420 10.117 1.00 0.00 H TER 29881 WAT 5050 ATOM 29881 O WAT 5051 44.536 4.802 106.603 1.00 0.00 O ATOM 29882 H1 WAT 5051 44.589 4.182 107.330 1.00 0.00 H ATOM 29883 H2 WAT 5051 44.059 4.331 105.920 1.00 0.00 H TER 29885 WAT 5051 ATOM 29885 O WAT 5052 116.728 86.748 91.860 1.00 0.00 O ATOM 29886 H1 WAT 5052 115.793 86.699 91.662 1.00 0.00 H ATOM 29887 H2 WAT 5052 116.923 87.685 91.869 1.00 0.00 H TER 29889 WAT 5052 ATOM 29889 O WAT 5053 56.493 114.595 74.268 1.00 0.00 O ATOM 29890 H1 WAT 5053 57.278 114.048 74.260 1.00 0.00 H ATOM 29891 H2 WAT 5053 56.543 115.074 75.095 1.00 0.00 H TER 29893 WAT 5053 ATOM 29893 O WAT 5054 125.785 64.056 136.013 1.00 0.00 O ATOM 29894 H1 WAT 5054 125.496 63.457 135.325 1.00 0.00 H ATOM 29895 H2 WAT 5054 125.034 64.126 136.602 1.00 0.00 H TER 29897 WAT 5054 ATOM 29897 O WAT 5055 40.250 111.816 101.564 1.00 0.00 O ATOM 29898 H1 WAT 5055 39.634 112.530 101.397 1.00 0.00 H ATOM 29899 H2 WAT 5055 40.977 112.231 102.028 1.00 0.00 H TER 29901 WAT 5055 ATOM 29901 O WAT 5056 114.263 36.372 95.895 1.00 0.00 O ATOM 29902 H1 WAT 5056 115.127 36.005 96.083 1.00 0.00 H ATOM 29903 H2 WAT 5056 114.225 36.421 94.940 1.00 0.00 H TER 29905 WAT 5056 ATOM 29905 O WAT 5057 73.119 1.452 100.430 1.00 0.00 O ATOM 29906 H1 WAT 5057 72.507 1.216 99.733 1.00 0.00 H ATOM 29907 H2 WAT 5057 73.818 1.930 99.983 1.00 0.00 H TER 29909 WAT 5057 ATOM 29909 O WAT 5058 119.844 9.637 22.993 1.00 0.00 O ATOM 29910 H1 WAT 5058 119.375 10.396 23.340 1.00 0.00 H ATOM 29911 H2 WAT 5058 119.487 8.893 23.479 1.00 0.00 H TER 29913 WAT 5058 ATOM 29913 O WAT 5059 39.764 27.043 67.829 1.00 0.00 O ATOM 29914 H1 WAT 5059 39.931 27.395 66.955 1.00 0.00 H ATOM 29915 H2 WAT 5059 40.177 27.670 68.423 1.00 0.00 H TER 29917 WAT 5059 ATOM 29917 O WAT 5060 34.853 119.715 64.055 1.00 0.00 O ATOM 29918 H1 WAT 5060 35.127 120.588 63.774 1.00 0.00 H ATOM 29919 H2 WAT 5060 34.410 119.345 63.291 1.00 0.00 H TER 29921 WAT 5060 ATOM 29921 O WAT 5061 48.175 66.400 88.393 1.00 0.00 O ATOM 29922 H1 WAT 5061 47.669 66.983 87.826 1.00 0.00 H ATOM 29923 H2 WAT 5061 47.942 65.519 88.100 1.00 0.00 H TER 29925 WAT 5061 ATOM 29925 O WAT 5062 60.841 101.788 134.696 1.00 0.00 O ATOM 29926 H1 WAT 5062 60.648 102.502 134.089 1.00 0.00 H ATOM 29927 H2 WAT 5062 60.004 101.604 135.123 1.00 0.00 H TER 29929 WAT 5062 ATOM 29929 O WAT 5063 50.404 66.578 63.288 1.00 0.00 O ATOM 29930 H1 WAT 5063 50.886 66.211 64.029 1.00 0.00 H ATOM 29931 H2 WAT 5063 49.485 66.399 63.488 1.00 0.00 H TER 29933 WAT 5063 ATOM 29933 O WAT 5064 67.229 96.975 11.329 1.00 0.00 O ATOM 29934 H1 WAT 5064 66.772 96.135 11.352 1.00 0.00 H ATOM 29935 H2 WAT 5064 67.974 96.827 10.746 1.00 0.00 H TER 29937 WAT 5064 ATOM 29937 O WAT 5065 28.096 125.012 7.629 1.00 0.00 O ATOM 29938 H1 WAT 5065 28.560 124.793 8.437 1.00 0.00 H ATOM 29939 H2 WAT 5065 28.746 124.884 6.938 1.00 0.00 H TER 29941 WAT 5065 ATOM 29941 O WAT 5066 2.612 133.874 9.137 1.00 0.00 O ATOM 29942 H1 WAT 5066 3.475 134.048 8.760 1.00 0.00 H ATOM 29943 H2 WAT 5066 1.997 134.089 8.436 1.00 0.00 H TER 29945 WAT 5066 ATOM 29945 O WAT 5067 50.129 24.058 59.838 1.00 0.00 O ATOM 29946 H1 WAT 5067 49.554 23.304 59.707 1.00 0.00 H ATOM 29947 H2 WAT 5067 49.725 24.759 59.327 1.00 0.00 H TER 29949 WAT 5067 ATOM 29949 O WAT 5068 94.579 136.020 149.434 1.00 0.00 O ATOM 29950 H1 WAT 5068 94.496 135.771 150.355 1.00 0.00 H ATOM 29951 H2 WAT 5068 94.749 136.961 149.454 1.00 0.00 H TER 29953 WAT 5068 ATOM 29953 O WAT 5069 19.474 99.333 126.787 1.00 0.00 O ATOM 29954 H1 WAT 5069 19.672 99.440 125.857 1.00 0.00 H ATOM 29955 H2 WAT 5069 19.331 98.392 126.894 1.00 0.00 H TER 29957 WAT 5069 ATOM 29957 O WAT 5070 102.257 45.620 94.239 1.00 0.00 O ATOM 29958 H1 WAT 5070 102.280 44.671 94.362 1.00 0.00 H ATOM 29959 H2 WAT 5070 102.785 45.772 93.455 1.00 0.00 H TER 29961 WAT 5070 ATOM 29961 O WAT 5071 36.415 96.702 9.480 1.00 0.00 O ATOM 29962 H1 WAT 5071 37.158 96.343 9.965 1.00 0.00 H ATOM 29963 H2 WAT 5071 35.942 95.932 9.162 1.00 0.00 H TER 29965 WAT 5071 ATOM 29965 O WAT 5072 7.844 93.234 13.622 1.00 0.00 O ATOM 29966 H1 WAT 5072 6.998 92.932 13.292 1.00 0.00 H ATOM 29967 H2 WAT 5072 8.462 92.552 13.357 1.00 0.00 H TER 29969 WAT 5072 ATOM 29969 O WAT 5073 72.106 1.901 1.044 1.00 0.00 O ATOM 29970 H1 WAT 5073 71.796 1.019 0.837 1.00 0.00 H ATOM 29971 H2 WAT 5073 72.771 1.768 1.720 1.00 0.00 H TER 29973 WAT 5073 ATOM 29973 O WAT 5074 82.362 102.898 68.250 1.00 0.00 O ATOM 29974 H1 WAT 5074 82.972 103.315 68.859 1.00 0.00 H ATOM 29975 H2 WAT 5074 82.922 102.427 67.634 1.00 0.00 H TER 29977 WAT 5074 ATOM 29977 O WAT 5075 59.793 2.634 125.731 1.00 0.00 O ATOM 29978 H1 WAT 5075 59.473 1.733 125.762 1.00 0.00 H ATOM 29979 H2 WAT 5075 60.374 2.708 126.489 1.00 0.00 H TER 29981 WAT 5075 ATOM 29981 O WAT 5076 68.108 19.671 116.613 1.00 0.00 O ATOM 29982 H1 WAT 5076 68.323 19.628 115.681 1.00 0.00 H ATOM 29983 H2 WAT 5076 67.152 19.636 116.640 1.00 0.00 H TER 29985 WAT 5076 ATOM 29985 O WAT 5077 32.594 141.353 107.226 1.00 0.00 O ATOM 29986 H1 WAT 5077 32.724 141.408 108.172 1.00 0.00 H ATOM 29987 H2 WAT 5077 32.225 140.481 107.085 1.00 0.00 H TER 29989 WAT 5077 ATOM 29989 O WAT 5078 103.543 16.404 124.451 1.00 0.00 O ATOM 29990 H1 WAT 5078 104.160 16.772 123.818 1.00 0.00 H ATOM 29991 H2 WAT 5078 103.654 16.943 125.234 1.00 0.00 H TER 29993 WAT 5078 ATOM 29993 O WAT 5079 45.809 86.027 146.516 1.00 0.00 O ATOM 29994 H1 WAT 5079 46.537 86.590 146.255 1.00 0.00 H ATOM 29995 H2 WAT 5079 45.060 86.357 146.019 1.00 0.00 H TER 29997 WAT 5079 ATOM 29997 O WAT 5080 140.877 118.165 106.898 1.00 0.00 O ATOM 29998 H1 WAT 5080 140.723 118.644 106.083 1.00 0.00 H ATOM 29999 H2 WAT 5080 141.069 117.271 106.617 1.00 0.00 H TER 30001 WAT 5080 ATOM 30001 O WAT 5081 83.904 80.479 122.074 1.00 0.00 O ATOM 30002 H1 WAT 5081 84.861 80.467 122.088 1.00 0.00 H ATOM 30003 H2 WAT 5081 83.666 81.222 122.629 1.00 0.00 H TER 30005 WAT 5081 ATOM 30005 O WAT 5082 14.069 124.655 73.219 1.00 0.00 O ATOM 30006 H1 WAT 5082 14.678 124.984 72.558 1.00 0.00 H ATOM 30007 H2 WAT 5082 14.322 123.741 73.344 1.00 0.00 H TER 30009 WAT 5082 ATOM 30009 O WAT 5083 75.945 105.073 72.980 1.00 0.00 O ATOM 30010 H1 WAT 5083 75.561 104.198 72.916 1.00 0.00 H ATOM 30011 H2 WAT 5083 76.503 105.146 72.206 1.00 0.00 H TER 30013 WAT 5083 ATOM 30013 O WAT 5084 34.293 91.399 148.478 1.00 0.00 O ATOM 30014 H1 WAT 5084 33.480 91.711 148.876 1.00 0.00 H ATOM 30015 H2 WAT 5084 34.309 91.809 147.613 1.00 0.00 H TER 30017 WAT 5084 ATOM 30017 O WAT 5085 107.435 116.928 125.153 1.00 0.00 O ATOM 30018 H1 WAT 5085 108.087 116.899 125.853 1.00 0.00 H ATOM 30019 H2 WAT 5085 107.541 116.096 124.692 1.00 0.00 H TER 30021 WAT 5085 ATOM 30021 O WAT 5086 139.590 7.528 100.189 1.00 0.00 O ATOM 30022 H1 WAT 5086 139.906 6.647 100.392 1.00 0.00 H ATOM 30023 H2 WAT 5086 140.151 7.825 99.473 1.00 0.00 H TER 30025 WAT 5086 ATOM 30025 O WAT 5087 25.813 43.114 126.745 1.00 0.00 O ATOM 30026 H1 WAT 5087 26.153 43.942 127.086 1.00 0.00 H ATOM 30027 H2 WAT 5087 26.556 42.513 126.788 1.00 0.00 H TER 30029 WAT 5087 ATOM 30029 O WAT 5088 83.461 25.836 67.956 1.00 0.00 O ATOM 30030 H1 WAT 5088 83.249 26.754 68.124 1.00 0.00 H ATOM 30031 H2 WAT 5088 83.582 25.455 68.826 1.00 0.00 H TER 30033 WAT 5088 ATOM 30033 O WAT 5089 29.468 145.680 104.624 1.00 0.00 O ATOM 30034 H1 WAT 5089 29.445 146.174 105.443 1.00 0.00 H ATOM 30035 H2 WAT 5089 28.736 145.068 104.693 1.00 0.00 H TER 30037 WAT 5089 ATOM 30037 O WAT 5090 16.968 49.110 66.344 1.00 0.00 O ATOM 30038 H1 WAT 5090 16.622 48.780 65.515 1.00 0.00 H ATOM 30039 H2 WAT 5090 17.874 49.348 66.147 1.00 0.00 H TER 30041 WAT 5090 ATOM 30041 O WAT 5091 102.119 121.628 143.488 1.00 0.00 O ATOM 30042 H1 WAT 5091 102.137 120.715 143.776 1.00 0.00 H ATOM 30043 H2 WAT 5091 101.248 121.939 143.734 1.00 0.00 H TER 30045 WAT 5091 ATOM 30045 O WAT 5092 101.783 89.832 153.914 1.00 0.00 O ATOM 30046 H1 WAT 5092 102.139 89.442 154.712 1.00 0.00 H ATOM 30047 H2 WAT 5092 101.549 89.083 153.365 1.00 0.00 H TER 30049 WAT 5092 ATOM 30049 O WAT 5093 13.828 71.923 95.055 1.00 0.00 O ATOM 30050 H1 WAT 5093 13.968 71.439 94.241 1.00 0.00 H ATOM 30051 H2 WAT 5093 12.878 71.926 95.172 1.00 0.00 H TER 30053 WAT 5093 ATOM 30053 O WAT 5094 95.649 21.361 142.892 1.00 0.00 O ATOM 30054 H1 WAT 5094 96.440 21.901 142.878 1.00 0.00 H ATOM 30055 H2 WAT 5094 95.828 20.690 143.550 1.00 0.00 H TER 30057 WAT 5094 ATOM 30057 O WAT 5095 113.093 24.208 147.202 1.00 0.00 O ATOM 30058 H1 WAT 5095 113.435 25.065 146.948 1.00 0.00 H ATOM 30059 H2 WAT 5095 112.321 24.405 147.732 1.00 0.00 H TER 30061 WAT 5095 ATOM 30061 O WAT 5096 91.358 109.918 122.385 1.00 0.00 O ATOM 30062 H1 WAT 5096 92.176 109.868 121.891 1.00 0.00 H ATOM 30063 H2 WAT 5096 91.174 110.855 122.449 1.00 0.00 H TER 30065 WAT 5096 ATOM 30065 O WAT 5097 114.126 68.694 153.528 1.00 0.00 O ATOM 30066 H1 WAT 5097 114.008 69.300 152.796 1.00 0.00 H ATOM 30067 H2 WAT 5097 113.465 68.959 154.167 1.00 0.00 H TER 30069 WAT 5097 ATOM 30069 O WAT 5098 142.027 108.933 91.129 1.00 0.00 O ATOM 30070 H1 WAT 5098 142.806 109.349 91.500 1.00 0.00 H ATOM 30071 H2 WAT 5098 141.591 109.632 90.642 1.00 0.00 H TER 30073 WAT 5098 ATOM 30073 O WAT 5099 76.480 54.582 2.603 1.00 0.00 O ATOM 30074 H1 WAT 5099 77.419 54.615 2.786 1.00 0.00 H ATOM 30075 H2 WAT 5099 76.414 54.103 1.777 1.00 0.00 H TER 30077 WAT 5099 ATOM 30077 O WAT 5100 128.445 57.393 3.663 1.00 0.00 O ATOM 30078 H1 WAT 5100 128.591 58.281 3.990 1.00 0.00 H ATOM 30079 H2 WAT 5100 128.568 56.833 4.428 1.00 0.00 H TER 30081 WAT 5100 ATOM 30081 O WAT 5101 100.864 102.484 74.910 1.00 0.00 O ATOM 30082 H1 WAT 5101 100.409 102.541 75.751 1.00 0.00 H ATOM 30083 H2 WAT 5101 101.462 101.744 75.012 1.00 0.00 H TER 30085 WAT 5101 ATOM 30085 O WAT 5102 45.197 127.923 113.320 1.00 0.00 O ATOM 30086 H1 WAT 5102 45.977 128.452 113.489 1.00 0.00 H ATOM 30087 H2 WAT 5102 45.506 127.018 113.366 1.00 0.00 H TER 30089 WAT 5102 ATOM 30089 O WAT 5103 86.080 15.942 101.302 1.00 0.00 O ATOM 30090 H1 WAT 5103 86.728 15.894 100.600 1.00 0.00 H ATOM 30091 H2 WAT 5103 86.471 15.450 102.024 1.00 0.00 H TER 30093 WAT 5103 ATOM 30093 O WAT 5104 29.276 145.942 109.554 1.00 0.00 O ATOM 30094 H1 WAT 5104 28.498 145.385 109.537 1.00 0.00 H ATOM 30095 H2 WAT 5104 29.488 146.030 110.483 1.00 0.00 H TER 30097 WAT 5104 ATOM 30097 O WAT 5105 84.231 90.148 13.025 1.00 0.00 O ATOM 30098 H1 WAT 5105 83.491 89.639 12.695 1.00 0.00 H ATOM 30099 H2 WAT 5105 84.827 89.494 13.391 1.00 0.00 H TER 30101 WAT 5105 ATOM 30101 O WAT 5106 47.177 132.858 100.236 1.00 0.00 O ATOM 30102 H1 WAT 5106 46.666 132.374 100.885 1.00 0.00 H ATOM 30103 H2 WAT 5106 46.549 133.066 99.544 1.00 0.00 H TER 30105 WAT 5106 ATOM 30105 O WAT 5107 125.612 24.482 62.766 1.00 0.00 O ATOM 30106 H1 WAT 5107 126.492 24.216 62.499 1.00 0.00 H ATOM 30107 H2 WAT 5107 125.110 23.667 62.784 1.00 0.00 H TER 30109 WAT 5107 ATOM 30109 O WAT 5108 126.396 107.069 107.727 1.00 0.00 O ATOM 30110 H1 WAT 5108 126.736 107.897 107.390 1.00 0.00 H ATOM 30111 H2 WAT 5108 125.513 107.006 107.363 1.00 0.00 H TER 30113 WAT 5108 ATOM 30113 O WAT 5109 101.218 132.099 19.770 1.00 0.00 O ATOM 30114 H1 WAT 5109 100.983 132.634 20.527 1.00 0.00 H ATOM 30115 H2 WAT 5109 100.865 132.577 19.019 1.00 0.00 H TER 30117 WAT 5109 ATOM 30117 O WAT 5110 33.975 115.965 107.892 1.00 0.00 O ATOM 30118 H1 WAT 5110 34.411 115.851 107.047 1.00 0.00 H ATOM 30119 H2 WAT 5110 33.900 115.078 108.244 1.00 0.00 H TER 30121 WAT 5110 ATOM 30121 O WAT 5111 131.043 88.998 28.070 1.00 0.00 O ATOM 30122 H1 WAT 5111 131.953 89.139 27.809 1.00 0.00 H ATOM 30123 H2 WAT 5111 131.051 89.093 29.023 1.00 0.00 H TER 30125 WAT 5111 ATOM 30125 O WAT 5112 10.804 63.931 114.213 1.00 0.00 O ATOM 30126 H1 WAT 5112 10.253 63.666 114.950 1.00 0.00 H ATOM 30127 H2 WAT 5112 10.481 64.800 113.973 1.00 0.00 H TER 30129 WAT 5112 ATOM 30129 O WAT 5113 114.769 97.960 91.062 1.00 0.00 O ATOM 30130 H1 WAT 5113 115.127 97.140 91.403 1.00 0.00 H ATOM 30131 H2 WAT 5113 114.511 98.451 91.843 1.00 0.00 H TER 30133 WAT 5113 ATOM 30133 O WAT 5114 88.017 105.266 134.615 1.00 0.00 O ATOM 30134 H1 WAT 5114 87.397 104.660 134.209 1.00 0.00 H ATOM 30135 H2 WAT 5114 87.528 105.659 135.338 1.00 0.00 H TER 30137 WAT 5114 ATOM 30137 O WAT 5115 50.554 26.847 54.831 1.00 0.00 O ATOM 30138 H1 WAT 5115 50.127 25.997 54.940 1.00 0.00 H ATOM 30139 H2 WAT 5115 51.348 26.653 54.332 1.00 0.00 H TER 30141 WAT 5115 ATOM 30141 O WAT 5116 112.685 115.349 157.051 1.00 0.00 O ATOM 30142 H1 WAT 5116 112.721 115.212 157.998 1.00 0.00 H ATOM 30143 H2 WAT 5116 113.599 115.460 156.790 1.00 0.00 H TER 30145 WAT 5116 ATOM 30145 O WAT 5117 73.519 4.319 115.879 1.00 0.00 O ATOM 30146 H1 WAT 5117 73.145 4.156 116.745 1.00 0.00 H ATOM 30147 H2 WAT 5117 73.060 5.097 115.562 1.00 0.00 H TER 30149 WAT 5117 ATOM 30149 O WAT 5118 97.815 80.906 80.392 1.00 0.00 O ATOM 30150 H1 WAT 5118 98.330 80.119 80.216 1.00 0.00 H ATOM 30151 H2 WAT 5118 98.335 81.396 81.029 1.00 0.00 H TER 30153 WAT 5118 ATOM 30153 O WAT 5119 15.358 107.884 127.557 1.00 0.00 O ATOM 30154 H1 WAT 5119 16.051 107.954 128.213 1.00 0.00 H ATOM 30155 H2 WAT 5119 14.996 108.768 127.495 1.00 0.00 H TER 30157 WAT 5119 ATOM 30157 O WAT 5120 114.157 91.061 117.593 1.00 0.00 O ATOM 30158 H1 WAT 5120 113.328 91.386 117.945 1.00 0.00 H ATOM 30159 H2 WAT 5120 114.077 91.181 116.646 1.00 0.00 H TER 30161 WAT 5120 ATOM 30161 O WAT 5121 68.500 114.131 157.973 1.00 0.00 O ATOM 30162 H1 WAT 5121 69.269 114.672 157.795 1.00 0.00 H ATOM 30163 H2 WAT 5121 67.792 114.760 158.111 1.00 0.00 H TER 30165 WAT 5121 ATOM 30165 O WAT 5122 7.241 66.136 105.079 1.00 0.00 O ATOM 30166 H1 WAT 5122 6.613 66.111 105.801 1.00 0.00 H ATOM 30167 H2 WAT 5122 6.838 65.605 104.392 1.00 0.00 H TER 30169 WAT 5122 ATOM 30169 O WAT 5123 32.140 83.033 76.134 1.00 0.00 O ATOM 30170 H1 WAT 5123 32.997 83.303 75.805 1.00 0.00 H ATOM 30171 H2 WAT 5123 32.301 82.777 77.042 1.00 0.00 H TER 30173 WAT 5123 ATOM 30173 O WAT 5124 32.919 143.272 7.851 1.00 0.00 O ATOM 30174 H1 WAT 5124 33.527 142.603 7.535 1.00 0.00 H ATOM 30175 H2 WAT 5124 32.744 143.818 7.084 1.00 0.00 H TER 30177 WAT 5124 ATOM 30177 O WAT 5125 130.218 13.667 91.116 1.00 0.00 O ATOM 30178 H1 WAT 5125 130.313 12.799 90.724 1.00 0.00 H ATOM 30179 H2 WAT 5125 129.373 13.636 91.563 1.00 0.00 H TER 30181 WAT 5125 ATOM 30181 O WAT 5126 125.871 116.103 90.488 1.00 0.00 O ATOM 30182 H1 WAT 5126 126.021 115.362 91.075 1.00 0.00 H ATOM 30183 H2 WAT 5126 125.392 116.737 91.022 1.00 0.00 H TER 30185 WAT 5126 ATOM 30185 O WAT 5127 32.871 133.380 90.270 1.00 0.00 O ATOM 30186 H1 WAT 5127 32.536 133.765 91.080 1.00 0.00 H ATOM 30187 H2 WAT 5127 32.965 134.123 89.674 1.00 0.00 H TER 30189 WAT 5127 ATOM 30189 O WAT 5128 118.514 68.299 59.776 1.00 0.00 O ATOM 30190 H1 WAT 5128 118.207 67.646 60.405 1.00 0.00 H ATOM 30191 H2 WAT 5128 118.845 69.016 60.317 1.00 0.00 H TER 30193 WAT 5128 ATOM 30193 O WAT 5129 42.498 48.700 69.227 1.00 0.00 O ATOM 30194 H1 WAT 5129 41.569 48.527 69.380 1.00 0.00 H ATOM 30195 H2 WAT 5129 42.794 49.144 70.021 1.00 0.00 H TER 30197 WAT 5129 ATOM 30197 O WAT 5130 57.761 15.960 17.833 1.00 0.00 O ATOM 30198 H1 WAT 5130 57.979 16.821 18.191 1.00 0.00 H ATOM 30199 H2 WAT 5130 58.336 15.864 17.074 1.00 0.00 H TER 30201 WAT 5130 ATOM 30201 O WAT 5131 106.999 134.109 98.158 1.00 0.00 O ATOM 30202 H1 WAT 5131 107.023 134.919 97.649 1.00 0.00 H ATOM 30203 H2 WAT 5131 106.161 133.707 97.930 1.00 0.00 H TER 30205 WAT 5131 ATOM 30205 O WAT 5132 67.461 109.804 107.487 1.00 0.00 O ATOM 30206 H1 WAT 5132 66.894 110.562 107.627 1.00 0.00 H ATOM 30207 H2 WAT 5132 67.333 109.262 108.266 1.00 0.00 H TER 30209 WAT 5132 ATOM 30209 O WAT 5133 12.588 108.484 5.685 1.00 0.00 O ATOM 30210 H1 WAT 5133 11.797 108.808 5.254 1.00 0.00 H ATOM 30211 H2 WAT 5133 12.288 108.190 6.545 1.00 0.00 H TER 30213 WAT 5133 ATOM 30213 O WAT 5134 98.496 75.175 61.043 1.00 0.00 O ATOM 30214 H1 WAT 5134 98.934 75.972 60.746 1.00 0.00 H ATOM 30215 H2 WAT 5134 98.870 75.004 61.908 1.00 0.00 H TER 30217 WAT 5134 ATOM 30217 O WAT 5135 129.508 40.077 144.607 1.00 0.00 O ATOM 30218 H1 WAT 5135 129.599 40.640 143.838 1.00 0.00 H ATOM 30219 H2 WAT 5135 130.369 40.102 145.025 1.00 0.00 H TER 30221 WAT 5135 ATOM 30221 O WAT 5136 100.128 46.564 14.229 1.00 0.00 O ATOM 30222 H1 WAT 5136 100.959 47.003 14.408 1.00 0.00 H ATOM 30223 H2 WAT 5136 99.900 46.835 13.340 1.00 0.00 H TER 30225 WAT 5136 ATOM 30225 O WAT 5137 1.209 112.736 77.301 1.00 0.00 O ATOM 30226 H1 WAT 5137 0.497 112.658 76.666 1.00 0.00 H ATOM 30227 H2 WAT 5137 0.850 113.287 77.997 1.00 0.00 H TER 30229 WAT 5137 ATOM 30229 O WAT 5138 122.821 42.564 108.268 1.00 0.00 O ATOM 30230 H1 WAT 5138 122.388 41.712 108.325 1.00 0.00 H ATOM 30231 H2 WAT 5138 123.353 42.509 107.474 1.00 0.00 H TER 30233 WAT 5138 ATOM 30233 O WAT 5139 48.753 26.474 2.537 1.00 0.00 O ATOM 30234 H1 WAT 5139 48.924 26.425 3.477 1.00 0.00 H ATOM 30235 H2 WAT 5139 49.125 25.666 2.183 1.00 0.00 H TER 30237 WAT 5139 ATOM 30237 O WAT 5140 70.483 64.644 145.479 1.00 0.00 O ATOM 30238 H1 WAT 5140 71.245 64.081 145.347 1.00 0.00 H ATOM 30239 H2 WAT 5140 70.363 65.087 144.639 1.00 0.00 H TER 30241 WAT 5140 ATOM 30241 O WAT 5141 24.265 143.920 17.620 1.00 0.00 O ATOM 30242 H1 WAT 5141 23.558 143.846 18.262 1.00 0.00 H ATOM 30243 H2 WAT 5141 23.822 144.136 16.800 1.00 0.00 H TER 30245 WAT 5141 ATOM 30245 O WAT 5142 22.181 33.484 79.979 1.00 0.00 O ATOM 30246 H1 WAT 5142 22.881 33.004 79.537 1.00 0.00 H ATOM 30247 H2 WAT 5142 22.433 34.404 79.898 1.00 0.00 H TER 30249 WAT 5142 ATOM 30249 O WAT 5143 9.994 62.832 13.077 1.00 0.00 O ATOM 30250 H1 WAT 5143 10.926 62.807 12.861 1.00 0.00 H ATOM 30251 H2 WAT 5143 9.970 62.802 14.034 1.00 0.00 H TER 30253 WAT 5143 ATOM 30253 O WAT 5144 48.121 122.845 79.304 1.00 0.00 O ATOM 30254 H1 WAT 5144 47.298 122.646 78.858 1.00 0.00 H ATOM 30255 H2 WAT 5144 47.859 123.332 80.085 1.00 0.00 H TER 30257 WAT 5144 ATOM 30257 O WAT 5145 107.907 0.622 6.287 1.00 0.00 O ATOM 30258 H1 WAT 5145 108.586 0.253 6.851 1.00 0.00 H ATOM 30259 H2 WAT 5145 108.086 1.562 6.279 1.00 0.00 H TER 30261 WAT 5145 ATOM 30261 O WAT 5146 3.815 131.376 116.439 1.00 0.00 O ATOM 30262 H1 WAT 5146 3.500 132.231 116.735 1.00 0.00 H ATOM 30263 H2 WAT 5146 3.364 131.229 115.608 1.00 0.00 H TER 30265 WAT 5146 ATOM 30265 O WAT 5147 25.164 141.981 71.142 1.00 0.00 O ATOM 30266 H1 WAT 5147 26.004 142.027 71.600 1.00 0.00 H ATOM 30267 H2 WAT 5147 25.392 141.728 70.247 1.00 0.00 H TER 30269 WAT 5147 ATOM 30269 O WAT 5148 108.486 123.481 98.331 1.00 0.00 O ATOM 30270 H1 WAT 5148 107.572 123.576 98.596 1.00 0.00 H ATOM 30271 H2 WAT 5148 108.524 122.627 97.900 1.00 0.00 H TER 30273 WAT 5148 ATOM 30273 O WAT 5149 14.062 3.952 130.267 1.00 0.00 O ATOM 30274 H1 WAT 5149 14.280 3.142 130.729 1.00 0.00 H ATOM 30275 H2 WAT 5149 14.544 3.894 129.442 1.00 0.00 H TER 30277 WAT 5149 ATOM 30277 O WAT 5150 0.484 2.109 16.408 1.00 0.00 O ATOM 30278 H1 WAT 5150 1.172 1.696 16.930 1.00 0.00 H ATOM 30279 H2 WAT 5150 0.689 3.043 16.437 1.00 0.00 H TER 30281 WAT 5150 ATOM 30281 O WAT 5151 122.112 103.419 133.537 1.00 0.00 O ATOM 30282 H1 WAT 5151 122.229 102.647 132.982 1.00 0.00 H ATOM 30283 H2 WAT 5151 122.933 103.903 133.450 1.00 0.00 H TER 30285 WAT 5151 ATOM 30285 O WAT 5152 117.195 115.494 71.363 1.00 0.00 O ATOM 30286 H1 WAT 5152 116.547 116.085 71.748 1.00 0.00 H ATOM 30287 H2 WAT 5152 117.388 115.876 70.507 1.00 0.00 H TER 30289 WAT 5152 ATOM 30289 O WAT 5153 18.049 134.137 10.448 1.00 0.00 O ATOM 30290 H1 WAT 5153 17.379 133.456 10.506 1.00 0.00 H ATOM 30291 H2 WAT 5153 17.570 134.955 10.579 1.00 0.00 H TER 30293 WAT 5153 ATOM 30293 O WAT 5154 38.941 115.027 105.458 1.00 0.00 O ATOM 30294 H1 WAT 5154 39.413 114.217 105.267 1.00 0.00 H ATOM 30295 H2 WAT 5154 39.503 115.720 105.111 1.00 0.00 H TER 30297 WAT 5154 ATOM 30297 O WAT 5155 110.411 123.473 67.417 1.00 0.00 O ATOM 30298 H1 WAT 5155 110.665 123.570 68.335 1.00 0.00 H ATOM 30299 H2 WAT 5155 110.164 122.552 67.333 1.00 0.00 H TER 30301 WAT 5155 ATOM 30301 O WAT 5156 57.565 9.939 81.932 1.00 0.00 O ATOM 30302 H1 WAT 5156 57.330 10.330 82.773 1.00 0.00 H ATOM 30303 H2 WAT 5156 58.392 10.359 81.695 1.00 0.00 H TER 30305 WAT 5156 ATOM 30305 O WAT 5157 129.319 30.919 106.792 1.00 0.00 O ATOM 30306 H1 WAT 5157 128.829 30.294 106.258 1.00 0.00 H ATOM 30307 H2 WAT 5157 129.796 30.376 107.419 1.00 0.00 H TER 30309 WAT 5157 ATOM 30309 O WAT 5158 140.706 18.992 79.642 1.00 0.00 O ATOM 30310 H1 WAT 5158 140.376 19.758 80.111 1.00 0.00 H ATOM 30311 H2 WAT 5158 140.665 18.282 80.284 1.00 0.00 H TER 30313 WAT 5158 ATOM 30313 O WAT 5159 119.740 49.060 70.567 1.00 0.00 O ATOM 30314 H1 WAT 5159 119.268 48.604 71.264 1.00 0.00 H ATOM 30315 H2 WAT 5159 119.633 48.500 69.799 1.00 0.00 H TER 30317 WAT 5159 ATOM 30317 O WAT 5160 74.523 31.843 62.599 1.00 0.00 O ATOM 30318 H1 WAT 5160 74.645 30.953 62.270 1.00 0.00 H ATOM 30319 H2 WAT 5160 74.965 31.848 63.448 1.00 0.00 H TER 30321 WAT 5160 ATOM 30321 O WAT 5161 130.761 133.485 75.798 1.00 0.00 O ATOM 30322 H1 WAT 5161 130.422 134.060 75.112 1.00 0.00 H ATOM 30323 H2 WAT 5161 130.004 133.307 76.357 1.00 0.00 H TER 30325 WAT 5161 ATOM 30325 O WAT 5162 118.329 14.713 100.183 1.00 0.00 O ATOM 30326 H1 WAT 5162 117.383 14.709 100.328 1.00 0.00 H ATOM 30327 H2 WAT 5162 118.683 14.194 100.905 1.00 0.00 H TER 30329 WAT 5162 ATOM 30329 O WAT 5163 82.669 111.260 130.449 1.00 0.00 O ATOM 30330 H1 WAT 5163 81.895 111.262 131.012 1.00 0.00 H ATOM 30331 H2 WAT 5163 83.185 112.008 130.748 1.00 0.00 H TER 30333 WAT 5163 ATOM 30333 O WAT 5164 15.251 144.648 13.556 1.00 0.00 O ATOM 30334 H1 WAT 5164 15.089 143.709 13.648 1.00 0.00 H ATOM 30335 H2 WAT 5164 15.891 144.848 14.239 1.00 0.00 H TER 30337 WAT 5164 ATOM 30337 O WAT 5165 32.332 78.359 94.988 1.00 0.00 O ATOM 30338 H1 WAT 5165 31.846 78.329 95.812 1.00 0.00 H ATOM 30339 H2 WAT 5165 31.885 79.029 94.470 1.00 0.00 H TER 30341 WAT 5165 ATOM 30341 O WAT 5166 139.791 107.546 5.522 1.00 0.00 O ATOM 30342 H1 WAT 5166 139.093 106.920 5.328 1.00 0.00 H ATOM 30343 H2 WAT 5166 139.364 108.229 6.038 1.00 0.00 H TER 30345 WAT 5166 ATOM 30345 O WAT 5167 86.919 55.491 110.968 1.00 0.00 O ATOM 30346 H1 WAT 5167 87.102 56.218 110.373 1.00 0.00 H ATOM 30347 H2 WAT 5167 87.752 55.328 111.410 1.00 0.00 H TER 30349 WAT 5167 ATOM 30349 O WAT 5168 51.790 3.411 63.124 1.00 0.00 O ATOM 30350 H1 WAT 5168 51.925 3.213 62.198 1.00 0.00 H ATOM 30351 H2 WAT 5168 51.340 4.256 63.125 1.00 0.00 H TER 30353 WAT 5168 ATOM 30353 O WAT 5169 79.045 100.161 76.372 1.00 0.00 O ATOM 30354 H1 WAT 5169 78.541 99.404 76.074 1.00 0.00 H ATOM 30355 H2 WAT 5169 79.958 99.908 76.239 1.00 0.00 H TER 30357 WAT 5169 ATOM 30357 O WAT 5170 134.357 82.297 107.176 1.00 0.00 O ATOM 30358 H1 WAT 5170 134.697 81.904 106.372 1.00 0.00 H ATOM 30359 H2 WAT 5170 134.942 83.035 107.349 1.00 0.00 H TER 30361 WAT 5170 ATOM 30361 O WAT 5171 17.739 135.073 96.446 1.00 0.00 O ATOM 30362 H1 WAT 5171 18.590 135.503 96.536 1.00 0.00 H ATOM 30363 H2 WAT 5171 17.316 135.530 95.719 1.00 0.00 H TER 30365 WAT 5171 ATOM 30365 O WAT 5172 131.491 105.102 17.975 1.00 0.00 O ATOM 30366 H1 WAT 5172 132.075 104.464 18.386 1.00 0.00 H ATOM 30367 H2 WAT 5172 130.723 105.125 18.546 1.00 0.00 H TER 30369 WAT 5172 ATOM 30369 O WAT 5173 128.483 65.860 142.308 1.00 0.00 O ATOM 30370 H1 WAT 5173 127.704 65.324 142.161 1.00 0.00 H ATOM 30371 H2 WAT 5173 128.348 66.634 141.761 1.00 0.00 H TER 30373 WAT 5173 ATOM 30373 O WAT 5174 15.029 44.660 67.714 1.00 0.00 O ATOM 30374 H1 WAT 5174 15.675 45.322 67.470 1.00 0.00 H ATOM 30375 H2 WAT 5174 14.592 44.438 66.892 1.00 0.00 H TER 30377 WAT 5174 ATOM 30377 O WAT 5175 59.264 70.323 146.444 1.00 0.00 O ATOM 30378 H1 WAT 5175 60.215 70.232 146.386 1.00 0.00 H ATOM 30379 H2 WAT 5175 59.039 69.951 147.297 1.00 0.00 H TER 30381 WAT 5175 ATOM 30381 O WAT 5176 124.872 54.902 150.699 1.00 0.00 O ATOM 30382 H1 WAT 5176 124.671 55.451 151.457 1.00 0.00 H ATOM 30383 H2 WAT 5176 125.242 55.508 150.056 1.00 0.00 H TER 30385 WAT 5176 ATOM 30385 O WAT 5177 131.967 5.381 73.011 1.00 0.00 O ATOM 30386 H1 WAT 5177 131.253 4.796 72.758 1.00 0.00 H ATOM 30387 H2 WAT 5177 132.247 5.786 72.190 1.00 0.00 H TER 30389 WAT 5177 ATOM 30389 O WAT 5178 126.216 145.190 152.327 1.00 0.00 O ATOM 30390 H1 WAT 5178 125.445 145.266 152.890 1.00 0.00 H ATOM 30391 H2 WAT 5178 126.784 144.568 152.781 1.00 0.00 H TER 30393 WAT 5178 ATOM 30393 O WAT 5179 24.453 82.434 71.098 1.00 0.00 O ATOM 30394 H1 WAT 5179 24.483 81.509 70.853 1.00 0.00 H ATOM 30395 H2 WAT 5179 24.756 82.898 70.317 1.00 0.00 H TER 30397 WAT 5179 ATOM 30397 O WAT 5180 122.207 89.479 106.369 1.00 0.00 O ATOM 30398 H1 WAT 5180 122.603 89.467 107.241 1.00 0.00 H ATOM 30399 H2 WAT 5180 122.179 88.559 106.106 1.00 0.00 H TER 30401 WAT 5180 ATOM 30401 O WAT 5181 38.425 127.220 58.343 1.00 0.00 O ATOM 30402 H1 WAT 5181 38.976 127.876 58.770 1.00 0.00 H ATOM 30403 H2 WAT 5181 37.579 127.292 58.784 1.00 0.00 H TER 30405 WAT 5181 ATOM 30405 O WAT 5182 21.834 115.549 152.828 1.00 0.00 O ATOM 30406 H1 WAT 5182 21.070 114.994 152.989 1.00 0.00 H ATOM 30407 H2 WAT 5182 21.798 116.211 153.518 1.00 0.00 H TER 30409 WAT 5182 ATOM 30409 O WAT 5183 120.286 138.726 74.527 1.00 0.00 O ATOM 30410 H1 WAT 5183 120.191 139.401 75.199 1.00 0.00 H ATOM 30411 H2 WAT 5183 119.485 138.791 74.007 1.00 0.00 H TER 30413 WAT 5183 ATOM 30413 O WAT 5184 36.845 70.840 149.672 1.00 0.00 O ATOM 30414 H1 WAT 5184 37.471 70.125 149.556 1.00 0.00 H ATOM 30415 H2 WAT 5184 37.197 71.554 149.141 1.00 0.00 H TER 30417 WAT 5184 ATOM 30417 O WAT 5185 15.902 123.952 63.355 1.00 0.00 O ATOM 30418 H1 WAT 5185 15.139 124.528 63.309 1.00 0.00 H ATOM 30419 H2 WAT 5185 15.630 123.241 63.937 1.00 0.00 H TER 30421 WAT 5185 ATOM 30421 O WAT 5186 93.823 6.693 83.941 1.00 0.00 O ATOM 30422 H1 WAT 5186 93.123 6.606 84.588 1.00 0.00 H ATOM 30423 H2 WAT 5186 94.202 5.816 83.879 1.00 0.00 H TER 30425 WAT 5186 ATOM 30425 O WAT 5187 78.017 135.992 141.012 1.00 0.00 O ATOM 30426 H1 WAT 5187 78.440 136.849 140.958 1.00 0.00 H ATOM 30427 H2 WAT 5187 77.930 135.827 141.951 1.00 0.00 H TER 30429 WAT 5187 ATOM 30429 O WAT 5188 133.717 49.619 157.851 1.00 0.00 O ATOM 30430 H1 WAT 5188 134.644 49.839 157.764 1.00 0.00 H ATOM 30431 H2 WAT 5188 133.678 49.040 158.613 1.00 0.00 H TER 30433 WAT 5188 ATOM 30433 O WAT 5189 134.288 63.155 19.520 1.00 0.00 O ATOM 30434 H1 WAT 5189 133.865 62.331 19.761 1.00 0.00 H ATOM 30435 H2 WAT 5189 135.193 63.054 19.815 1.00 0.00 H TER 30437 WAT 5189 ATOM 30437 O WAT 5190 35.888 145.078 12.859 1.00 0.00 O ATOM 30438 H1 WAT 5190 34.994 145.257 13.151 1.00 0.00 H ATOM 30439 H2 WAT 5190 36.439 145.603 13.439 1.00 0.00 H TER 30441 WAT 5190 ATOM 30441 O WAT 5191 69.996 141.898 128.003 1.00 0.00 O ATOM 30442 H1 WAT 5191 69.929 141.999 127.053 1.00 0.00 H ATOM 30443 H2 WAT 5191 69.928 140.954 128.149 1.00 0.00 H TER 30445 WAT 5191 ATOM 30445 O WAT 5192 141.197 91.541 13.661 1.00 0.00 O ATOM 30446 H1 WAT 5192 141.438 92.409 13.986 1.00 0.00 H ATOM 30447 H2 WAT 5192 140.297 91.643 13.353 1.00 0.00 H TER 30449 WAT 5192 ATOM 30449 O WAT 5193 93.828 66.120 71.740 1.00 0.00 O ATOM 30450 H1 WAT 5193 94.426 66.377 71.037 1.00 0.00 H ATOM 30451 H2 WAT 5193 93.158 65.594 71.303 1.00 0.00 H TER 30453 WAT 5193 ATOM 30453 O WAT 5194 50.893 72.590 15.713 1.00 0.00 O ATOM 30454 H1 WAT 5194 50.951 73.045 16.553 1.00 0.00 H ATOM 30455 H2 WAT 5194 49.954 72.464 15.574 1.00 0.00 H TER 30457 WAT 5194 ATOM 30457 O WAT 5195 60.390 118.146 78.169 1.00 0.00 O ATOM 30458 H1 WAT 5195 59.473 118.405 78.263 1.00 0.00 H ATOM 30459 H2 WAT 5195 60.632 118.440 77.290 1.00 0.00 H TER 30461 WAT 5195 ATOM 30461 O WAT 5196 4.403 71.895 130.704 1.00 0.00 O ATOM 30462 H1 WAT 5196 3.875 71.214 131.121 1.00 0.00 H ATOM 30463 H2 WAT 5196 3.764 72.456 130.263 1.00 0.00 H TER 30465 WAT 5196 ATOM 30465 O WAT 5197 76.155 89.551 131.828 1.00 0.00 O ATOM 30466 H1 WAT 5197 75.541 89.746 131.120 1.00 0.00 H ATOM 30467 H2 WAT 5197 75.781 89.984 132.595 1.00 0.00 H TER 30469 WAT 5197 ATOM 30469 O WAT 5198 75.854 40.093 141.383 1.00 0.00 O ATOM 30470 H1 WAT 5198 74.965 40.340 141.636 1.00 0.00 H ATOM 30471 H2 WAT 5198 76.287 40.924 141.187 1.00 0.00 H TER 30473 WAT 5198 ATOM 30473 O WAT 5199 19.679 107.623 12.455 1.00 0.00 O ATOM 30474 H1 WAT 5199 20.428 107.772 13.031 1.00 0.00 H ATOM 30475 H2 WAT 5199 19.534 106.677 12.491 1.00 0.00 H TER 30477 WAT 5199 ATOM 30477 O WAT 5200 75.959 74.066 97.926 1.00 0.00 O ATOM 30478 H1 WAT 5200 76.435 73.672 97.195 1.00 0.00 H ATOM 30479 H2 WAT 5200 76.644 74.382 98.516 1.00 0.00 H TER 30481 WAT 5200 ATOM 30481 O WAT 5201 70.628 88.775 55.580 1.00 0.00 O ATOM 30482 H1 WAT 5201 69.963 88.520 54.941 1.00 0.00 H ATOM 30483 H2 WAT 5201 70.650 88.050 56.205 1.00 0.00 H TER 30485 WAT 5201 ATOM 30485 O WAT 5202 68.228 31.454 18.240 1.00 0.00 O ATOM 30486 H1 WAT 5202 67.382 31.051 18.437 1.00 0.00 H ATOM 30487 H2 WAT 5202 68.089 32.389 18.397 1.00 0.00 H TER 30489 WAT 5202 ATOM 30489 O WAT 5203 81.983 111.592 137.579 1.00 0.00 O ATOM 30490 H1 WAT 5203 82.520 112.268 137.166 1.00 0.00 H ATOM 30491 H2 WAT 5203 82.136 111.705 138.517 1.00 0.00 H TER 30493 WAT 5203 ATOM 30493 O WAT 5204 57.990 131.094 77.161 1.00 0.00 O ATOM 30494 H1 WAT 5204 57.981 130.491 77.904 1.00 0.00 H ATOM 30495 H2 WAT 5204 58.890 131.418 77.126 1.00 0.00 H TER 30497 WAT 5204 ATOM 30497 O WAT 5205 83.395 118.190 136.738 1.00 0.00 O ATOM 30498 H1 WAT 5205 82.794 117.517 136.417 1.00 0.00 H ATOM 30499 H2 WAT 5205 84.245 117.947 136.371 1.00 0.00 H TER 30501 WAT 5205 ATOM 30501 O WAT 5206 3.514 31.013 86.342 1.00 0.00 O ATOM 30502 H1 WAT 5206 2.636 31.154 85.988 1.00 0.00 H ATOM 30503 H2 WAT 5206 3.790 31.877 86.649 1.00 0.00 H TER 30505 WAT 5206 ATOM 30505 O WAT 5207 3.463 55.302 104.577 1.00 0.00 O ATOM 30506 H1 WAT 5207 4.329 55.373 104.176 1.00 0.00 H ATOM 30507 H2 WAT 5207 2.971 54.731 103.985 1.00 0.00 H TER 30509 WAT 5207 ATOM 30509 O WAT 5208 134.506 93.279 92.537 1.00 0.00 O ATOM 30510 H1 WAT 5208 133.995 93.439 93.330 1.00 0.00 H ATOM 30511 H2 WAT 5208 135.206 93.931 92.567 1.00 0.00 H TER 30513 WAT 5208 ATOM 30513 O WAT 5209 112.322 99.731 19.903 1.00 0.00 O ATOM 30514 H1 WAT 5209 112.171 99.155 20.653 1.00 0.00 H ATOM 30515 H2 WAT 5209 112.674 99.155 19.225 1.00 0.00 H TER 30517 WAT 5209 ATOM 30517 O WAT 5210 117.305 127.941 128.728 1.00 0.00 O ATOM 30518 H1 WAT 5210 116.520 128.483 128.796 1.00 0.00 H ATOM 30519 H2 WAT 5210 117.278 127.381 129.504 1.00 0.00 H TER 30521 WAT 5210 ATOM 30521 O WAT 5211 52.767 12.002 149.935 1.00 0.00 O ATOM 30522 H1 WAT 5211 52.041 12.391 149.447 1.00 0.00 H ATOM 30523 H2 WAT 5211 53.529 12.127 149.369 1.00 0.00 H TER 30525 WAT 5211 ATOM 30525 O WAT 5212 9.264 108.907 150.980 1.00 0.00 O ATOM 30526 H1 WAT 5212 9.180 108.044 151.385 1.00 0.00 H ATOM 30527 H2 WAT 5212 9.418 109.502 151.713 1.00 0.00 H TER 30529 WAT 5212 ATOM 30529 O WAT 5213 56.758 6.865 95.248 1.00 0.00 O ATOM 30530 H1 WAT 5213 57.690 7.049 95.365 1.00 0.00 H ATOM 30531 H2 WAT 5213 56.350 7.176 96.055 1.00 0.00 H TER 30533 WAT 5213 ATOM 30533 O WAT 5214 125.642 124.999 101.663 1.00 0.00 O ATOM 30534 H1 WAT 5214 125.088 125.761 101.494 1.00 0.00 H ATOM 30535 H2 WAT 5214 126.274 125.303 102.315 1.00 0.00 H TER 30537 WAT 5214 ATOM 30537 O WAT 5215 122.906 139.257 72.376 1.00 0.00 O ATOM 30538 H1 WAT 5215 122.513 139.963 72.888 1.00 0.00 H ATOM 30539 H2 WAT 5215 122.254 138.556 72.392 1.00 0.00 H TER 30541 WAT 5215 ATOM 30541 O WAT 5216 55.953 120.979 105.728 1.00 0.00 O ATOM 30542 H1 WAT 5216 55.272 120.593 105.177 1.00 0.00 H ATOM 30543 H2 WAT 5216 55.943 121.910 105.504 1.00 0.00 H TER 30545 WAT 5216 ATOM 30545 O WAT 5217 87.400 115.517 15.140 1.00 0.00 O ATOM 30546 H1 WAT 5217 86.633 114.949 15.075 1.00 0.00 H ATOM 30547 H2 WAT 5217 87.041 116.405 15.141 1.00 0.00 H TER 30549 WAT 5217 ATOM 30549 O WAT 5218 62.081 90.381 110.045 1.00 0.00 O ATOM 30550 H1 WAT 5218 61.865 89.461 109.889 1.00 0.00 H ATOM 30551 H2 WAT 5218 61.247 90.841 109.955 1.00 0.00 H TER 30553 WAT 5218 ATOM 30553 O WAT 5219 19.315 89.663 2.972 1.00 0.00 O ATOM 30554 H1 WAT 5219 19.114 89.321 3.844 1.00 0.00 H ATOM 30555 H2 WAT 5219 19.818 88.965 2.552 1.00 0.00 H TER 30557 WAT 5219 ATOM 30557 O WAT 5220 142.897 49.021 1.135 1.00 0.00 O ATOM 30558 H1 WAT 5220 143.328 49.853 1.330 1.00 0.00 H ATOM 30559 H2 WAT 5220 143.211 48.423 1.814 1.00 0.00 H TER 30561 WAT 5220 ATOM 30561 O WAT 5221 9.701 59.587 111.477 1.00 0.00 O ATOM 30562 H1 WAT 5221 10.274 60.324 111.686 1.00 0.00 H ATOM 30563 H2 WAT 5221 9.961 59.323 110.595 1.00 0.00 H TER 30565 WAT 5221 ATOM 30565 O WAT 5222 51.514 68.304 121.931 1.00 0.00 O ATOM 30566 H1 WAT 5222 52.407 68.490 122.222 1.00 0.00 H ATOM 30567 H2 WAT 5222 51.600 68.123 120.995 1.00 0.00 H TER 30569 WAT 5222 ATOM 30569 O WAT 5223 31.815 17.556 118.856 1.00 0.00 O ATOM 30570 H1 WAT 5223 32.696 17.337 119.159 1.00 0.00 H ATOM 30571 H2 WAT 5223 31.317 17.712 119.659 1.00 0.00 H TER 30573 WAT 5223 ATOM 30573 O WAT 5224 118.316 69.496 21.938 1.00 0.00 O ATOM 30574 H1 WAT 5224 118.839 69.971 22.584 1.00 0.00 H ATOM 30575 H2 WAT 5224 118.962 69.097 21.355 1.00 0.00 H TER 30577 WAT 5224 ATOM 30577 O WAT 5225 72.078 38.832 83.714 1.00 0.00 O ATOM 30578 H1 WAT 5225 72.632 38.851 84.495 1.00 0.00 H ATOM 30579 H2 WAT 5225 71.395 39.479 83.888 1.00 0.00 H TER 30581 WAT 5225 ATOM 30581 O WAT 5226 106.654 59.890 158.609 1.00 0.00 O ATOM 30582 H1 WAT 5226 106.513 59.106 158.078 1.00 0.00 H ATOM 30583 H2 WAT 5226 105.881 60.432 158.445 1.00 0.00 H TER 30585 WAT 5226 ATOM 30585 O WAT 5227 57.108 58.935 22.006 1.00 0.00 O ATOM 30586 H1 WAT 5227 56.444 58.577 21.417 1.00 0.00 H ATOM 30587 H2 WAT 5227 57.922 58.891 21.504 1.00 0.00 H TER 30589 WAT 5227 ATOM 30589 O WAT 5228 3.961 119.606 157.693 1.00 0.00 O ATOM 30590 H1 WAT 5228 4.530 120.366 157.816 1.00 0.00 H ATOM 30591 H2 WAT 5228 3.110 119.979 157.463 1.00 0.00 H TER 30593 WAT 5228 ATOM 30593 O WAT 5229 90.198 74.766 82.438 1.00 0.00 O ATOM 30594 H1 WAT 5229 90.254 73.811 82.393 1.00 0.00 H ATOM 30595 H2 WAT 5229 91.025 75.035 82.840 1.00 0.00 H TER 30597 WAT 5229 ATOM 30597 O WAT 5230 41.448 144.538 63.349 1.00 0.00 O ATOM 30598 H1 WAT 5230 40.993 143.696 63.353 1.00 0.00 H ATOM 30599 H2 WAT 5230 42.084 144.464 62.637 1.00 0.00 H TER 30601 WAT 5230 ATOM 30601 O WAT 5231 17.052 70.587 2.719 1.00 0.00 O ATOM 30602 H1 WAT 5231 16.331 69.968 2.834 1.00 0.00 H ATOM 30603 H2 WAT 5231 17.095 70.733 1.774 1.00 0.00 H TER 30605 WAT 5231 ATOM 30605 O WAT 5232 52.888 41.076 137.695 1.00 0.00 O ATOM 30606 H1 WAT 5232 52.708 41.970 137.406 1.00 0.00 H ATOM 30607 H2 WAT 5232 52.209 40.893 138.345 1.00 0.00 H TER 30609 WAT 5232 ATOM 30609 O WAT 5233 34.332 93.252 146.224 1.00 0.00 O ATOM 30610 H1 WAT 5233 34.786 93.802 146.861 1.00 0.00 H ATOM 30611 H2 WAT 5233 34.987 93.078 145.548 1.00 0.00 H TER 30613 WAT 5233 ATOM 30613 O WAT 5234 2.089 5.280 125.098 1.00 0.00 O ATOM 30614 H1 WAT 5234 1.682 6.121 124.892 1.00 0.00 H ATOM 30615 H2 WAT 5234 1.414 4.798 125.576 1.00 0.00 H TER 30617 WAT 5234 ATOM 30617 O WAT 5235 19.668 7.682 92.991 1.00 0.00 O ATOM 30618 H1 WAT 5235 19.823 8.546 92.609 1.00 0.00 H ATOM 30619 H2 WAT 5235 19.959 7.766 93.899 1.00 0.00 H TER 30621 WAT 5235 ATOM 30621 O WAT 5236 64.473 96.898 126.892 1.00 0.00 O ATOM 30622 H1 WAT 5236 64.688 96.473 127.722 1.00 0.00 H ATOM 30623 H2 WAT 5236 63.990 97.685 127.144 1.00 0.00 H TER 30625 WAT 5236 ATOM 30625 O WAT 5237 132.093 128.258 99.784 1.00 0.00 O ATOM 30626 H1 WAT 5237 132.621 127.893 100.494 1.00 0.00 H ATOM 30627 H2 WAT 5237 131.280 127.753 99.805 1.00 0.00 H TER 30629 WAT 5237 ATOM 30629 O WAT 5238 114.030 47.519 90.089 1.00 0.00 O ATOM 30630 H1 WAT 5238 113.678 47.674 90.966 1.00 0.00 H ATOM 30631 H2 WAT 5238 114.307 48.383 89.786 1.00 0.00 H TER 30633 WAT 5238 ATOM 30633 O WAT 5239 24.664 71.917 82.670 1.00 0.00 O ATOM 30634 H1 WAT 5239 25.258 71.620 81.981 1.00 0.00 H ATOM 30635 H2 WAT 5239 24.123 71.152 82.867 1.00 0.00 H TER 30637 WAT 5239 ATOM 30637 O WAT 5240 13.706 92.584 73.448 1.00 0.00 O ATOM 30638 H1 WAT 5240 14.187 93.248 72.954 1.00 0.00 H ATOM 30639 H2 WAT 5240 13.570 91.872 72.822 1.00 0.00 H TER 30641 WAT 5240 ATOM 30641 O WAT 5241 9.102 113.523 135.597 1.00 0.00 O ATOM 30642 H1 WAT 5241 9.321 112.598 135.714 1.00 0.00 H ATOM 30643 H2 WAT 5241 9.827 113.995 136.005 1.00 0.00 H TER 30645 WAT 5241 ATOM 30645 O WAT 5242 37.590 11.663 106.598 1.00 0.00 O ATOM 30646 H1 WAT 5242 36.923 11.960 105.978 1.00 0.00 H ATOM 30647 H2 WAT 5242 38.093 11.009 106.114 1.00 0.00 H TER 30649 WAT 5242 ATOM 30649 O WAT 5243 105.636 114.928 122.244 1.00 0.00 O ATOM 30650 H1 WAT 5243 105.840 115.327 121.398 1.00 0.00 H ATOM 30651 H2 WAT 5243 104.745 114.595 122.143 1.00 0.00 H TER 30653 WAT 5243 ATOM 30653 O WAT 5244 78.672 30.526 140.181 1.00 0.00 O ATOM 30654 H1 WAT 5244 79.437 29.989 139.976 1.00 0.00 H ATOM 30655 H2 WAT 5244 79.005 31.204 140.769 1.00 0.00 H TER 30657 WAT 5244 ATOM 30657 O WAT 5245 108.883 77.013 98.013 1.00 0.00 O ATOM 30658 H1 WAT 5245 108.709 77.092 98.951 1.00 0.00 H ATOM 30659 H2 WAT 5245 108.016 76.990 97.609 1.00 0.00 H TER 30661 WAT 5245 ATOM 30661 O WAT 5246 18.813 53.576 106.154 1.00 0.00 O ATOM 30662 H1 WAT 5246 18.916 54.305 106.765 1.00 0.00 H ATOM 30663 H2 WAT 5246 17.890 53.334 106.223 1.00 0.00 H TER 30665 WAT 5246 ATOM 30665 O WAT 5247 127.500 57.574 150.095 1.00 0.00 O ATOM 30666 H1 WAT 5247 126.671 57.864 150.475 1.00 0.00 H ATOM 30667 H2 WAT 5247 127.832 58.341 149.629 1.00 0.00 H TER 30669 WAT 5247 ATOM 30669 O WAT 5248 96.807 117.637 96.834 1.00 0.00 O ATOM 30670 H1 WAT 5248 97.293 118.395 96.511 1.00 0.00 H ATOM 30671 H2 WAT 5248 96.922 117.665 97.784 1.00 0.00 H TER 30673 WAT 5248 ATOM 30673 O WAT 5249 115.208 128.463 95.397 1.00 0.00 O ATOM 30674 H1 WAT 5249 115.516 129.232 94.916 1.00 0.00 H ATOM 30675 H2 WAT 5249 114.480 128.787 95.926 1.00 0.00 H TER 30677 WAT 5249 ATOM 30677 O WAT 5250 47.137 108.556 144.296 1.00 0.00 O ATOM 30678 H1 WAT 5250 46.339 108.591 143.769 1.00 0.00 H ATOM 30679 H2 WAT 5250 47.757 109.115 143.829 1.00 0.00 H TER 30681 WAT 5250 ATOM 30681 O WAT 5251 66.762 83.296 110.817 1.00 0.00 O ATOM 30682 H1 WAT 5251 66.162 83.942 110.442 1.00 0.00 H ATOM 30683 H2 WAT 5251 66.204 82.739 111.361 1.00 0.00 H TER 30685 WAT 5251 ATOM 30685 O WAT 5252 12.538 31.378 7.431 1.00 0.00 O ATOM 30686 H1 WAT 5252 13.257 30.889 7.029 1.00 0.00 H ATOM 30687 H2 WAT 5252 11.759 30.854 7.244 1.00 0.00 H TER 30689 WAT 5252 ATOM 30689 O WAT 5253 89.353 28.046 57.626 1.00 0.00 O ATOM 30690 H1 WAT 5253 88.525 27.572 57.555 1.00 0.00 H ATOM 30691 H2 WAT 5253 89.252 28.794 57.037 1.00 0.00 H TER 30693 WAT 5253 ATOM 30693 O WAT 5254 1.722 119.771 106.673 1.00 0.00 O ATOM 30694 H1 WAT 5254 2.605 119.989 106.373 1.00 0.00 H ATOM 30695 H2 WAT 5254 1.252 119.525 105.876 1.00 0.00 H TER 30697 WAT 5254 ATOM 30697 O WAT 5255 103.902 76.544 16.334 1.00 0.00 O ATOM 30698 H1 WAT 5255 104.017 77.489 16.226 1.00 0.00 H ATOM 30699 H2 WAT 5255 104.790 76.189 16.293 1.00 0.00 H TER 30701 WAT 5255 ATOM 30701 O WAT 5256 58.832 70.207 101.914 1.00 0.00 O ATOM 30702 H1 WAT 5256 59.739 70.171 102.220 1.00 0.00 H ATOM 30703 H2 WAT 5256 58.420 69.432 102.296 1.00 0.00 H TER 30705 WAT 5256 ATOM 30705 O WAT 5257 12.300 50.398 77.834 1.00 0.00 O ATOM 30706 H1 WAT 5257 12.408 51.050 78.527 1.00 0.00 H ATOM 30707 H2 WAT 5257 11.698 50.807 77.212 1.00 0.00 H TER 30709 WAT 5257 ATOM 30709 O WAT 5258 24.878 141.741 52.100 1.00 0.00 O ATOM 30710 H1 WAT 5258 25.083 142.674 52.159 1.00 0.00 H ATOM 30711 H2 WAT 5258 25.678 141.342 51.756 1.00 0.00 H TER 30713 WAT 5258 ATOM 30713 O WAT 5259 131.820 19.157 120.781 1.00 0.00 O ATOM 30714 H1 WAT 5259 131.115 19.791 120.648 1.00 0.00 H ATOM 30715 H2 WAT 5259 132.257 19.104 119.931 1.00 0.00 H TER 30717 WAT 5259 ATOM 30717 O WAT 5260 103.160 110.352 116.002 1.00 0.00 O ATOM 30718 H1 WAT 5260 103.283 109.564 115.473 1.00 0.00 H ATOM 30719 H2 WAT 5260 103.176 111.070 115.369 1.00 0.00 H TER 30721 WAT 5260 ATOM 30721 O WAT 5261 64.710 80.883 94.566 1.00 0.00 O ATOM 30722 H1 WAT 5261 64.271 81.689 94.838 1.00 0.00 H ATOM 30723 H2 WAT 5261 64.102 80.474 93.951 1.00 0.00 H TER 30725 WAT 5261 ATOM 30725 O WAT 5262 36.010 40.475 65.111 1.00 0.00 O ATOM 30726 H1 WAT 5262 35.823 40.119 64.243 1.00 0.00 H ATOM 30727 H2 WAT 5262 35.659 41.365 65.086 1.00 0.00 H TER 30729 WAT 5262 ATOM 30729 O WAT 5263 29.282 29.184 86.143 1.00 0.00 O ATOM 30730 H1 WAT 5263 29.176 28.396 85.610 1.00 0.00 H ATOM 30731 H2 WAT 5263 30.139 29.080 86.556 1.00 0.00 H TER 30733 WAT 5263 ATOM 30733 O WAT 5264 23.617 82.089 147.405 1.00 0.00 O ATOM 30734 H1 WAT 5264 24.338 82.398 146.855 1.00 0.00 H ATOM 30735 H2 WAT 5264 23.933 82.207 148.301 1.00 0.00 H TER 30737 WAT 5264 ATOM 30737 O WAT 5265 80.755 40.723 84.191 1.00 0.00 O ATOM 30738 H1 WAT 5265 81.154 40.037 83.656 1.00 0.00 H ATOM 30739 H2 WAT 5265 80.965 41.537 83.733 1.00 0.00 H TER 30741 WAT 5265 ATOM 30741 O WAT 5266 103.250 33.425 100.457 1.00 0.00 O ATOM 30742 H1 WAT 5266 103.225 34.005 101.218 1.00 0.00 H ATOM 30743 H2 WAT 5266 102.330 33.257 100.254 1.00 0.00 H TER 30745 WAT 5266 ATOM 30745 O WAT 5267 27.674 34.317 85.370 1.00 0.00 O ATOM 30746 H1 WAT 5267 28.385 33.679 85.432 1.00 0.00 H ATOM 30747 H2 WAT 5267 27.501 34.572 86.276 1.00 0.00 H TER 30749 WAT 5267 ATOM 30749 O WAT 5268 81.995 21.048 82.478 1.00 0.00 O ATOM 30750 H1 WAT 5268 82.514 21.235 83.261 1.00 0.00 H ATOM 30751 H2 WAT 5268 82.597 20.580 81.899 1.00 0.00 H TER 30753 WAT 5268 ATOM 30753 O WAT 5269 92.702 108.993 2.806 1.00 0.00 O ATOM 30754 H1 WAT 5269 92.365 108.579 3.600 1.00 0.00 H ATOM 30755 H2 WAT 5269 92.413 109.903 2.868 1.00 0.00 H TER 30757 WAT 5269 ATOM 30757 O WAT 5270 50.192 4.699 93.923 1.00 0.00 O ATOM 30758 H1 WAT 5270 51.030 4.856 93.489 1.00 0.00 H ATOM 30759 H2 WAT 5270 49.889 5.569 94.182 1.00 0.00 H TER 30761 WAT 5270 ATOM 30761 O WAT 5271 1.400 49.914 84.989 1.00 0.00 O ATOM 30762 H1 WAT 5271 1.872 49.676 85.787 1.00 0.00 H ATOM 30763 H2 WAT 5271 2.089 50.118 84.356 1.00 0.00 H TER 30765 WAT 5271 ATOM 30765 O WAT 5272 6.584 81.630 110.709 1.00 0.00 O ATOM 30766 H1 WAT 5272 5.799 81.535 111.249 1.00 0.00 H ATOM 30767 H2 WAT 5272 6.365 81.187 109.889 1.00 0.00 H TER 30769 WAT 5272 ATOM 30769 O WAT 5273 140.563 26.044 131.242 1.00 0.00 O ATOM 30770 H1 WAT 5273 140.212 25.205 131.544 1.00 0.00 H ATOM 30771 H2 WAT 5273 141.121 26.342 131.961 1.00 0.00 H TER 30773 WAT 5273 ATOM 30773 O WAT 5274 123.779 17.323 21.398 1.00 0.00 O ATOM 30774 H1 WAT 5274 123.854 17.572 22.319 1.00 0.00 H ATOM 30775 H2 WAT 5274 123.822 18.153 20.922 1.00 0.00 H TER 30777 WAT 5274 ATOM 30777 O WAT 5275 69.492 50.266 127.579 1.00 0.00 O ATOM 30778 H1 WAT 5275 69.394 50.397 128.522 1.00 0.00 H ATOM 30779 H2 WAT 5275 68.740 49.727 127.333 1.00 0.00 H TER 30781 WAT 5275 ATOM 30781 O WAT 5276 103.244 118.320 151.007 1.00 0.00 O ATOM 30782 H1 WAT 5276 103.543 117.414 150.922 1.00 0.00 H ATOM 30783 H2 WAT 5276 103.901 118.834 150.537 1.00 0.00 H TER 30785 WAT 5276 ATOM 30785 O WAT 5277 17.067 101.955 23.183 1.00 0.00 O ATOM 30786 H1 WAT 5277 16.266 101.650 22.759 1.00 0.00 H ATOM 30787 H2 WAT 5277 17.617 101.174 23.247 1.00 0.00 H TER 30789 WAT 5277 ATOM 30789 O WAT 5278 33.012 51.342 109.777 1.00 0.00 O ATOM 30790 H1 WAT 5278 32.077 51.157 109.862 1.00 0.00 H ATOM 30791 H2 WAT 5278 33.099 52.260 110.033 1.00 0.00 H TER 30793 WAT 5278 ATOM 30793 O WAT 5279 23.844 48.036 133.753 1.00 0.00 O ATOM 30794 H1 WAT 5279 22.982 48.397 133.545 1.00 0.00 H ATOM 30795 H2 WAT 5279 24.418 48.376 133.067 1.00 0.00 H TER 30797 WAT 5279 ATOM 30797 O WAT 5280 131.089 9.417 148.491 1.00 0.00 O ATOM 30798 H1 WAT 5280 131.245 9.358 149.434 1.00 0.00 H ATOM 30799 H2 WAT 5280 131.963 9.408 148.102 1.00 0.00 H TER 30801 WAT 5280 ATOM 30801 O WAT 5281 58.163 49.571 0.418 1.00 0.00 O ATOM 30802 H1 WAT 5281 58.929 49.043 0.188 1.00 0.00 H ATOM 30803 H2 WAT 5281 58.193 49.633 1.373 1.00 0.00 H TER 30805 WAT 5281 ATOM 30805 O WAT 5282 12.424 90.069 156.116 1.00 0.00 O ATOM 30806 H1 WAT 5282 12.226 91.002 156.192 1.00 0.00 H ATOM 30807 H2 WAT 5282 12.236 89.713 156.985 1.00 0.00 H TER 30809 WAT 5282 ATOM 30809 O WAT 5283 95.403 55.051 111.651 1.00 0.00 O ATOM 30810 H1 WAT 5283 95.666 55.790 112.200 1.00 0.00 H ATOM 30811 H2 WAT 5283 95.577 55.344 110.757 1.00 0.00 H TER 30813 WAT 5283 ATOM 30813 O WAT 5284 139.563 29.209 4.358 1.00 0.00 O ATOM 30814 H1 WAT 5284 139.693 29.894 5.014 1.00 0.00 H ATOM 30815 H2 WAT 5284 140.231 29.382 3.695 1.00 0.00 H TER 30817 WAT 5284 ATOM 30817 O WAT 5285 26.442 68.857 69.602 1.00 0.00 O ATOM 30818 H1 WAT 5285 25.919 68.397 70.258 1.00 0.00 H ATOM 30819 H2 WAT 5285 25.944 69.653 69.414 1.00 0.00 H TER 30821 WAT 5285 ATOM 30821 O WAT 5286 122.841 97.452 157.117 1.00 0.00 O ATOM 30822 H1 WAT 5286 123.025 97.637 156.196 1.00 0.00 H ATOM 30823 H2 WAT 5286 122.726 96.503 157.152 1.00 0.00 H TER 30825 WAT 5286 ATOM 30825 O WAT 5287 95.504 115.752 72.818 1.00 0.00 O ATOM 30826 H1 WAT 5287 94.561 115.786 72.657 1.00 0.00 H ATOM 30827 H2 WAT 5287 95.630 116.276 73.609 1.00 0.00 H TER 30829 WAT 5287 ATOM 30829 O WAT 5288 8.800 45.633 112.791 1.00 0.00 O ATOM 30830 H1 WAT 5288 9.062 45.839 113.688 1.00 0.00 H ATOM 30831 H2 WAT 5288 9.597 45.754 112.275 1.00 0.00 H TER 30833 WAT 5288 ATOM 30833 O WAT 5289 102.404 105.684 88.699 1.00 0.00 O ATOM 30834 H1 WAT 5289 102.068 106.178 89.447 1.00 0.00 H ATOM 30835 H2 WAT 5289 102.837 104.924 89.089 1.00 0.00 H TER 30837 WAT 5289 ATOM 30837 O WAT 5290 30.035 15.605 141.246 1.00 0.00 O ATOM 30838 H1 WAT 5290 30.057 15.871 142.166 1.00 0.00 H ATOM 30839 H2 WAT 5290 30.955 15.481 141.011 1.00 0.00 H TER 30841 WAT 5290 ATOM 30841 O WAT 5291 58.422 75.673 107.715 1.00 0.00 O ATOM 30842 H1 WAT 5291 57.520 75.424 107.514 1.00 0.00 H ATOM 30843 H2 WAT 5291 58.849 75.735 106.861 1.00 0.00 H TER 30845 WAT 5291 ATOM 30845 O WAT 5292 122.246 109.845 70.662 1.00 0.00 O ATOM 30846 H1 WAT 5292 122.288 109.015 71.137 1.00 0.00 H ATOM 30847 H2 WAT 5292 121.420 109.804 70.181 1.00 0.00 H TER 30849 WAT 5292 ATOM 30849 O WAT 5293 51.504 40.469 153.755 1.00 0.00 O ATOM 30850 H1 WAT 5293 51.097 40.553 152.893 1.00 0.00 H ATOM 30851 H2 WAT 5293 50.952 39.841 154.220 1.00 0.00 H TER 30853 WAT 5293 ATOM 30853 O WAT 5294 49.348 126.248 100.723 1.00 0.00 O ATOM 30854 H1 WAT 5294 48.685 126.000 100.079 1.00 0.00 H ATOM 30855 H2 WAT 5294 48.963 126.007 101.566 1.00 0.00 H TER 30857 WAT 5294 ATOM 30857 O WAT 5295 22.544 100.411 108.086 1.00 0.00 O ATOM 30858 H1 WAT 5295 22.384 100.518 109.023 1.00 0.00 H ATOM 30859 H2 WAT 5295 23.143 101.124 107.862 1.00 0.00 H TER 30861 WAT 5295 ATOM 30861 O WAT 5296 120.127 112.793 129.139 1.00 0.00 O ATOM 30862 H1 WAT 5296 119.609 112.477 129.879 1.00 0.00 H ATOM 30863 H2 WAT 5296 119.586 113.475 128.742 1.00 0.00 H TER 30865 WAT 5296 ATOM 30865 O WAT 5297 18.145 63.757 86.329 1.00 0.00 O ATOM 30866 H1 WAT 5297 17.398 64.228 85.961 1.00 0.00 H ATOM 30867 H2 WAT 5297 17.784 62.916 86.609 1.00 0.00 H TER 30869 WAT 5297 ATOM 30869 O WAT 5298 14.248 49.521 87.890 1.00 0.00 O ATOM 30870 H1 WAT 5298 13.758 50.153 88.417 1.00 0.00 H ATOM 30871 H2 WAT 5298 14.759 50.059 87.286 1.00 0.00 H TER 30873 WAT 5298 ATOM 30873 O WAT 5299 115.270 129.014 7.161 1.00 0.00 O ATOM 30874 H1 WAT 5299 115.964 129.371 6.607 1.00 0.00 H ATOM 30875 H2 WAT 5299 115.616 128.176 7.468 1.00 0.00 H TER 30877 WAT 5299 ATOM 30877 O WAT 5300 105.595 15.152 105.237 1.00 0.00 O ATOM 30878 H1 WAT 5300 106.425 14.772 105.525 1.00 0.00 H ATOM 30879 H2 WAT 5300 105.617 16.052 105.563 1.00 0.00 H TER 30881 WAT 5300 ATOM 30881 O WAT 5301 63.078 5.341 66.349 1.00 0.00 O ATOM 30882 H1 WAT 5301 63.524 5.430 65.507 1.00 0.00 H ATOM 30883 H2 WAT 5301 62.192 5.664 66.186 1.00 0.00 H TER 30885 WAT 5301 ATOM 30885 O WAT 5302 31.132 4.831 150.287 1.00 0.00 O ATOM 30886 H1 WAT 5302 31.095 5.380 151.071 1.00 0.00 H ATOM 30887 H2 WAT 5302 31.901 4.277 150.419 1.00 0.00 H TER 30889 WAT 5302 ATOM 30889 O WAT 5303 88.377 103.017 118.859 1.00 0.00 O ATOM 30890 H1 WAT 5303 88.550 103.950 118.729 1.00 0.00 H ATOM 30891 H2 WAT 5303 89.243 102.629 118.986 1.00 0.00 H TER 30893 WAT 5303 ATOM 30893 O WAT 5304 38.596 68.843 8.974 1.00 0.00 O ATOM 30894 H1 WAT 5304 38.084 69.022 9.763 1.00 0.00 H ATOM 30895 H2 WAT 5304 39.417 68.475 9.300 1.00 0.00 H TER 30897 WAT 5304 ATOM 30897 O WAT 5305 1.151 136.284 134.924 1.00 0.00 O ATOM 30898 H1 WAT 5305 1.535 137.131 134.696 1.00 0.00 H ATOM 30899 H2 WAT 5305 1.776 135.895 135.536 1.00 0.00 H TER 30901 WAT 5305 ATOM 30901 O WAT 5306 6.187 120.949 143.098 1.00 0.00 O ATOM 30902 H1 WAT 5306 5.679 120.323 143.614 1.00 0.00 H ATOM 30903 H2 WAT 5306 6.351 121.677 143.698 1.00 0.00 H TER 30905 WAT 5306 ATOM 30905 O WAT 5307 8.438 18.061 154.916 1.00 0.00 O ATOM 30906 H1 WAT 5307 8.353 17.778 155.826 1.00 0.00 H ATOM 30907 H2 WAT 5307 8.468 17.247 154.413 1.00 0.00 H TER 30909 WAT 5307 ATOM 30909 O WAT 5308 35.813 129.814 81.319 1.00 0.00 O ATOM 30910 H1 WAT 5308 35.798 129.373 82.169 1.00 0.00 H ATOM 30911 H2 WAT 5308 35.801 130.747 81.534 1.00 0.00 H TER 30913 WAT 5308 ATOM 30913 O WAT 5309 71.812 76.888 96.998 1.00 0.00 O ATOM 30914 H1 WAT 5309 71.650 77.503 97.714 1.00 0.00 H ATOM 30915 H2 WAT 5309 72.078 77.441 96.264 1.00 0.00 H TER 30917 WAT 5309 ATOM 30917 O WAT 5310 137.929 89.156 70.776 1.00 0.00 O ATOM 30918 H1 WAT 5310 138.248 88.744 69.973 1.00 0.00 H ATOM 30919 H2 WAT 5310 138.462 89.946 70.868 1.00 0.00 H TER 30921 WAT 5310 ATOM 30921 O WAT 5311 79.819 93.860 91.515 1.00 0.00 O ATOM 30922 H1 WAT 5311 79.046 94.372 91.754 1.00 0.00 H ATOM 30923 H2 WAT 5311 80.301 94.424 90.909 1.00 0.00 H TER 30925 WAT 5311 ATOM 30925 O WAT 5312 81.573 136.287 75.444 1.00 0.00 O ATOM 30926 H1 WAT 5312 81.495 136.960 76.120 1.00 0.00 H ATOM 30927 H2 WAT 5312 80.872 136.489 74.824 1.00 0.00 H TER 30929 WAT 5312 ATOM 30929 O WAT 5313 21.370 18.064 100.208 1.00 0.00 O ATOM 30930 H1 WAT 5313 21.850 18.699 100.740 1.00 0.00 H ATOM 30931 H2 WAT 5313 21.093 17.391 100.829 1.00 0.00 H TER 30933 WAT 5313 ATOM 30933 O WAT 5314 7.183 121.873 104.642 1.00 0.00 O ATOM 30934 H1 WAT 5314 7.881 122.493 104.430 1.00 0.00 H ATOM 30935 H2 WAT 5314 6.903 122.120 105.523 1.00 0.00 H TER 30937 WAT 5314 ATOM 30937 O WAT 5315 65.097 142.390 80.656 1.00 0.00 O ATOM 30938 H1 WAT 5315 64.272 142.875 80.629 1.00 0.00 H ATOM 30939 H2 WAT 5315 65.158 141.975 79.795 1.00 0.00 H TER 30941 WAT 5315 ATOM 30941 O WAT 5316 131.297 77.427 112.396 1.00 0.00 O ATOM 30942 H1 WAT 5316 131.154 77.887 113.223 1.00 0.00 H ATOM 30943 H2 WAT 5316 131.554 78.113 111.781 1.00 0.00 H TER 30945 WAT 5316 ATOM 30945 O WAT 5317 116.538 125.441 80.657 1.00 0.00 O ATOM 30946 H1 WAT 5317 117.066 124.803 80.178 1.00 0.00 H ATOM 30947 H2 WAT 5317 115.882 124.915 81.113 1.00 0.00 H TER 30949 WAT 5317 ATOM 30949 O WAT 5318 54.115 104.050 112.562 1.00 0.00 O ATOM 30950 H1 WAT 5318 54.848 103.689 113.060 1.00 0.00 H ATOM 30951 H2 WAT 5318 54.411 104.922 112.299 1.00 0.00 H TER 30953 WAT 5318 ATOM 30953 O WAT 5319 12.697 90.192 15.077 1.00 0.00 O ATOM 30954 H1 WAT 5319 13.591 90.395 15.354 1.00 0.00 H ATOM 30955 H2 WAT 5319 12.264 91.044 15.020 1.00 0.00 H TER 30957 WAT 5319 ATOM 30957 O WAT 5320 103.816 90.659 111.348 1.00 0.00 O ATOM 30958 H1 WAT 5320 103.449 91.156 110.617 1.00 0.00 H ATOM 30959 H2 WAT 5320 103.648 91.205 112.117 1.00 0.00 H TER 30961 WAT 5320 ATOM 30961 O WAT 5321 127.533 142.102 141.950 1.00 0.00 O ATOM 30962 H1 WAT 5321 126.647 142.186 141.597 1.00 0.00 H ATOM 30963 H2 WAT 5321 127.470 141.392 142.589 1.00 0.00 H TER 30965 WAT 5321 ATOM 30965 O WAT 5322 46.679 102.539 153.182 1.00 0.00 O ATOM 30966 H1 WAT 5322 47.447 102.046 152.895 1.00 0.00 H ATOM 30967 H2 WAT 5322 46.348 102.953 152.385 1.00 0.00 H TER 30969 WAT 5322 ATOM 30969 O WAT 5323 123.867 22.196 146.210 1.00 0.00 O ATOM 30970 H1 WAT 5323 124.093 21.343 146.579 1.00 0.00 H ATOM 30971 H2 WAT 5323 123.066 22.452 146.669 1.00 0.00 H TER 30973 WAT 5323 ATOM 30973 O WAT 5324 36.208 86.726 87.972 1.00 0.00 O ATOM 30974 H1 WAT 5324 35.753 85.925 88.233 1.00 0.00 H ATOM 30975 H2 WAT 5324 36.872 86.854 88.649 1.00 0.00 H TER 30977 WAT 5324 ATOM 30977 O WAT 5325 91.281 32.458 118.767 1.00 0.00 O ATOM 30978 H1 WAT 5325 92.024 32.248 119.333 1.00 0.00 H ATOM 30979 H2 WAT 5325 90.512 32.316 119.320 1.00 0.00 H TER 30981 WAT 5325 ATOM 30981 O WAT 5326 55.490 114.848 89.737 1.00 0.00 O ATOM 30982 H1 WAT 5326 55.057 114.830 88.883 1.00 0.00 H ATOM 30983 H2 WAT 5326 55.857 113.970 89.838 1.00 0.00 H TER 30985 WAT 5326 ATOM 30985 O WAT 5327 56.561 67.743 75.079 1.00 0.00 O ATOM 30986 H1 WAT 5327 55.807 67.407 75.564 1.00 0.00 H ATOM 30987 H2 WAT 5327 57.091 68.189 75.739 1.00 0.00 H TER 30989 WAT 5327 ATOM 30989 O WAT 5328 38.104 91.717 56.890 1.00 0.00 O ATOM 30990 H1 WAT 5328 37.766 90.880 57.210 1.00 0.00 H ATOM 30991 H2 WAT 5328 37.437 92.356 57.141 1.00 0.00 H TER 30993 WAT 5328 ATOM 30993 O WAT 5329 142.794 133.529 112.946 1.00 0.00 O ATOM 30994 H1 WAT 5329 142.912 134.367 112.499 1.00 0.00 H ATOM 30995 H2 WAT 5329 143.016 132.872 112.286 1.00 0.00 H TER 30997 WAT 5329 ATOM 30997 O WAT 5330 30.681 123.943 93.564 1.00 0.00 O ATOM 30998 H1 WAT 5330 30.181 123.503 92.877 1.00 0.00 H ATOM 30999 H2 WAT 5330 31.298 124.502 93.091 1.00 0.00 H TER 31001 WAT 5330 ATOM 31001 O WAT 5331 66.764 14.492 133.381 1.00 0.00 O ATOM 31002 H1 WAT 5331 66.691 13.756 132.773 1.00 0.00 H ATOM 31003 H2 WAT 5331 67.675 14.776 133.304 1.00 0.00 H TER 31005 WAT 5331 ATOM 31005 O WAT 5332 52.322 75.990 132.042 1.00 0.00 O ATOM 31006 H1 WAT 5332 51.657 76.022 131.354 1.00 0.00 H ATOM 31007 H2 WAT 5332 53.153 75.945 131.570 1.00 0.00 H TER 31009 WAT 5332 ATOM 31009 O WAT 5333 75.570 58.901 140.223 1.00 0.00 O ATOM 31010 H1 WAT 5333 76.354 59.399 140.453 1.00 0.00 H ATOM 31011 H2 WAT 5333 75.037 59.513 139.716 1.00 0.00 H TER 31013 WAT 5333 ATOM 31013 O WAT 5334 41.485 109.843 109.216 1.00 0.00 O ATOM 31014 H1 WAT 5334 42.244 110.071 109.753 1.00 0.00 H ATOM 31015 H2 WAT 5334 41.160 110.683 108.892 1.00 0.00 H TER 31017 WAT 5334 ATOM 31017 O WAT 5335 108.258 52.194 109.472 1.00 0.00 O ATOM 31018 H1 WAT 5335 108.478 51.550 110.145 1.00 0.00 H ATOM 31019 H2 WAT 5335 107.370 51.962 109.200 1.00 0.00 H TER 31021 WAT 5335 ATOM 31021 O WAT 5336 39.662 104.379 130.203 1.00 0.00 O ATOM 31022 H1 WAT 5336 39.222 104.586 131.028 1.00 0.00 H ATOM 31023 H2 WAT 5336 40.582 104.591 130.362 1.00 0.00 H TER 31025 WAT 5336 ATOM 31025 O WAT 5337 48.698 89.363 136.396 1.00 0.00 O ATOM 31026 H1 WAT 5337 49.343 88.658 136.338 1.00 0.00 H ATOM 31027 H2 WAT 5337 48.661 89.577 137.329 1.00 0.00 H TER 31029 WAT 5337 ATOM 31029 O WAT 5338 144.737 34.237 158.608 1.00 0.00 O ATOM 31030 H1 WAT 5338 144.706 35.193 158.569 1.00 0.00 H ATOM 31031 H2 WAT 5338 143.882 33.983 158.955 1.00 0.00 H TER 31033 WAT 5338 ATOM 31033 O WAT 5339 50.234 63.220 140.285 1.00 0.00 O ATOM 31034 H1 WAT 5339 49.305 63.418 140.169 1.00 0.00 H ATOM 31035 H2 WAT 5339 50.301 62.279 140.120 1.00 0.00 H TER 31037 WAT 5339 ATOM 31037 O WAT 5340 4.348 109.833 12.898 1.00 0.00 O ATOM 31038 H1 WAT 5340 4.798 109.614 13.714 1.00 0.00 H ATOM 31039 H2 WAT 5340 3.418 109.745 13.107 1.00 0.00 H TER 31041 WAT 5340 ATOM 31041 O WAT 5341 38.485 143.770 99.818 1.00 0.00 O ATOM 31042 H1 WAT 5341 38.553 144.581 100.323 1.00 0.00 H ATOM 31043 H2 WAT 5341 37.758 143.925 99.215 1.00 0.00 H TER 31045 WAT 5341 ATOM 31045 O WAT 5342 73.979 16.719 145.865 1.00 0.00 O ATOM 31046 H1 WAT 5342 73.326 17.407 145.740 1.00 0.00 H ATOM 31047 H2 WAT 5342 74.518 17.029 146.593 1.00 0.00 H TER 31049 WAT 5342 ATOM 31049 O WAT 5343 19.384 116.502 140.374 1.00 0.00 O ATOM 31050 H1 WAT 5343 19.312 116.311 141.309 1.00 0.00 H ATOM 31051 H2 WAT 5343 18.789 115.880 139.956 1.00 0.00 H TER 31053 WAT 5343 ATOM 31053 O WAT 5344 101.691 84.262 66.503 1.00 0.00 O ATOM 31054 H1 WAT 5344 101.133 83.501 66.341 1.00 0.00 H ATOM 31055 H2 WAT 5344 102.345 84.232 65.805 1.00 0.00 H TER 31057 WAT 5344 ATOM 31057 O WAT 5345 56.445 39.282 14.348 1.00 0.00 O ATOM 31058 H1 WAT 5345 56.883 40.133 14.324 1.00 0.00 H ATOM 31059 H2 WAT 5345 56.801 38.808 13.596 1.00 0.00 H TER 31061 WAT 5345 ATOM 31061 O WAT 5346 55.712 59.230 69.724 1.00 0.00 O ATOM 31062 H1 WAT 5346 55.746 58.688 70.513 1.00 0.00 H ATOM 31063 H2 WAT 5346 55.949 58.634 69.014 1.00 0.00 H TER 31065 WAT 5346 ATOM 31065 O WAT 5347 88.574 127.463 140.232 1.00 0.00 O ATOM 31066 H1 WAT 5347 87.843 127.088 140.723 1.00 0.00 H ATOM 31067 H2 WAT 5347 89.011 128.042 140.856 1.00 0.00 H TER 31069 WAT 5347 ATOM 31069 O WAT 5348 97.678 138.458 54.949 1.00 0.00 O ATOM 31070 H1 WAT 5348 98.415 138.036 54.507 1.00 0.00 H ATOM 31071 H2 WAT 5348 97.386 139.132 54.335 1.00 0.00 H TER 31073 WAT 5348 ATOM 31073 O WAT 5349 93.975 16.209 138.401 1.00 0.00 O ATOM 31074 H1 WAT 5349 93.806 16.347 139.333 1.00 0.00 H ATOM 31075 H2 WAT 5349 93.939 17.086 138.019 1.00 0.00 H TER 31077 WAT 5349 ATOM 31077 O WAT 5350 89.647 18.932 57.063 1.00 0.00 O ATOM 31078 H1 WAT 5350 89.552 19.885 57.070 1.00 0.00 H ATOM 31079 H2 WAT 5350 88.862 18.610 57.507 1.00 0.00 H TER 31081 WAT 5350 ATOM 31081 O WAT 5351 40.817 139.522 16.540 1.00 0.00 O ATOM 31082 H1 WAT 5351 40.942 139.358 15.605 1.00 0.00 H ATOM 31083 H2 WAT 5351 41.389 138.888 16.972 1.00 0.00 H TER 31085 WAT 5351 ATOM 31085 O WAT 5352 39.159 47.257 100.583 1.00 0.00 O ATOM 31086 H1 WAT 5352 39.929 46.777 100.278 1.00 0.00 H ATOM 31087 H2 WAT 5352 39.514 47.955 101.133 1.00 0.00 H TER 31089 WAT 5352 ATOM 31089 O WAT 5353 39.441 39.036 55.938 1.00 0.00 O ATOM 31090 H1 WAT 5353 39.658 39.079 56.869 1.00 0.00 H ATOM 31091 H2 WAT 5353 40.061 39.634 55.520 1.00 0.00 H TER 31093 WAT 5353 ATOM 31093 O WAT 5354 30.051 0.446 53.642 1.00 0.00 O ATOM 31094 H1 WAT 5354 29.877 -0.489 53.535 1.00 0.00 H ATOM 31095 H2 WAT 5354 30.358 0.532 54.544 1.00 0.00 H TER 31097 WAT 5354 ATOM 31097 O WAT 5355 61.204 77.140 116.654 1.00 0.00 O ATOM 31098 H1 WAT 5355 60.780 76.884 115.835 1.00 0.00 H ATOM 31099 H2 WAT 5355 62.091 76.784 116.585 1.00 0.00 H TER 31101 WAT 5355 ATOM 31101 O WAT 5356 18.776 91.890 9.275 1.00 0.00 O ATOM 31102 H1 WAT 5356 18.105 92.171 9.897 1.00 0.00 H ATOM 31103 H2 WAT 5356 19.463 91.507 9.820 1.00 0.00 H TER 31105 WAT 5356 ATOM 31105 O WAT 5357 136.815 32.848 127.896 1.00 0.00 O ATOM 31106 H1 WAT 5357 136.233 33.562 128.158 1.00 0.00 H ATOM 31107 H2 WAT 5357 136.225 32.159 127.589 1.00 0.00 H TER 31109 WAT 5357 ATOM 31109 O WAT 5358 125.802 98.751 4.547 1.00 0.00 O ATOM 31110 H1 WAT 5358 125.364 98.843 5.393 1.00 0.00 H ATOM 31111 H2 WAT 5358 125.290 98.088 4.083 1.00 0.00 H TER 31113 WAT 5358 ATOM 31113 O WAT 5359 89.218 137.077 77.036 1.00 0.00 O ATOM 31114 H1 WAT 5359 89.187 136.580 76.219 1.00 0.00 H ATOM 31115 H2 WAT 5359 90.048 136.823 77.440 1.00 0.00 H TER 31117 WAT 5359 ATOM 31117 O WAT 5360 143.295 60.008 13.146 1.00 0.00 O ATOM 31118 H1 WAT 5360 143.553 60.810 13.601 1.00 0.00 H ATOM 31119 H2 WAT 5360 142.458 59.767 13.543 1.00 0.00 H TER 31121 WAT 5360 ATOM 31121 O WAT 5361 9.078 18.019 116.404 1.00 0.00 O ATOM 31122 H1 WAT 5361 9.080 17.895 117.354 1.00 0.00 H ATOM 31123 H2 WAT 5361 8.312 17.532 116.101 1.00 0.00 H TER 31125 WAT 5361 ATOM 31125 O WAT 5362 63.769 135.881 91.558 1.00 0.00 O ATOM 31126 H1 WAT 5362 63.501 134.998 91.303 1.00 0.00 H ATOM 31127 H2 WAT 5362 63.039 136.439 91.290 1.00 0.00 H TER 31129 WAT 5362 ATOM 31129 O WAT 5363 27.650 137.624 66.023 1.00 0.00 O ATOM 31130 H1 WAT 5363 28.468 137.205 66.291 1.00 0.00 H ATOM 31131 H2 WAT 5363 27.868 138.076 65.208 1.00 0.00 H TER 31133 WAT 5363 ATOM 31133 O WAT 5364 76.202 133.779 71.104 1.00 0.00 O ATOM 31134 H1 WAT 5364 75.895 132.903 71.340 1.00 0.00 H ATOM 31135 H2 WAT 5364 76.361 134.211 71.943 1.00 0.00 H TER 31137 WAT 5364 ATOM 31137 O WAT 5365 46.468 116.060 88.114 1.00 0.00 O ATOM 31138 H1 WAT 5365 46.038 115.590 88.829 1.00 0.00 H ATOM 31139 H2 WAT 5365 47.348 116.243 88.442 1.00 0.00 H TER 31141 WAT 5365 ATOM 31141 O WAT 5366 78.197 6.251 151.184 1.00 0.00 O ATOM 31142 H1 WAT 5366 78.286 5.399 150.755 1.00 0.00 H ATOM 31143 H2 WAT 5366 79.097 6.525 151.362 1.00 0.00 H TER 31145 WAT 5366 ATOM 31145 O WAT 5367 55.656 70.427 117.738 1.00 0.00 O ATOM 31146 H1 WAT 5367 55.733 70.466 116.784 1.00 0.00 H ATOM 31147 H2 WAT 5367 54.773 70.748 117.921 1.00 0.00 H TER 31149 WAT 5367 ATOM 31149 O WAT 5368 17.617 27.651 126.907 1.00 0.00 O ATOM 31150 H1 WAT 5368 18.328 27.897 126.315 1.00 0.00 H ATOM 31151 H2 WAT 5368 17.162 26.941 126.453 1.00 0.00 H TER 31153 WAT 5368 ATOM 31153 O WAT 5369 50.690 104.677 92.625 1.00 0.00 O ATOM 31154 H1 WAT 5369 50.836 105.406 92.022 1.00 0.00 H ATOM 31155 H2 WAT 5369 51.265 103.982 92.303 1.00 0.00 H TER 31157 WAT 5369 ATOM 31157 O WAT 5370 92.058 78.400 13.860 1.00 0.00 O ATOM 31158 H1 WAT 5370 91.308 78.987 13.954 1.00 0.00 H ATOM 31159 H2 WAT 5370 92.612 78.597 14.615 1.00 0.00 H TER 31161 WAT 5370 ATOM 31161 O WAT 5371 120.769 31.168 106.746 1.00 0.00 O ATOM 31162 H1 WAT 5371 119.880 31.520 106.701 1.00 0.00 H ATOM 31163 H2 WAT 5371 121.312 31.834 106.324 1.00 0.00 H TER 31165 WAT 5371 ATOM 31165 O WAT 5372 25.478 129.435 96.619 1.00 0.00 O ATOM 31166 H1 WAT 5372 25.995 129.367 95.816 1.00 0.00 H ATOM 31167 H2 WAT 5372 25.570 128.578 97.036 1.00 0.00 H TER 31169 WAT 5372 ATOM 31169 O WAT 5373 50.677 38.247 71.101 1.00 0.00 O ATOM 31170 H1 WAT 5373 51.489 38.484 70.653 1.00 0.00 H ATOM 31171 H2 WAT 5373 50.962 37.891 71.942 1.00 0.00 H TER 31173 WAT 5373 ATOM 31173 O WAT 5374 22.931 22.656 157.343 1.00 0.00 O ATOM 31174 H1 WAT 5374 22.124 23.127 157.554 1.00 0.00 H ATOM 31175 H2 WAT 5374 23.628 23.294 157.499 1.00 0.00 H TER 31177 WAT 5374 ATOM 31177 O WAT 5375 12.709 123.593 16.920 1.00 0.00 O ATOM 31178 H1 WAT 5375 12.585 122.670 17.141 1.00 0.00 H ATOM 31179 H2 WAT 5375 13.365 123.902 17.544 1.00 0.00 H TER 31181 WAT 5375 ATOM 31181 O WAT 5376 39.869 101.960 22.845 1.00 0.00 O ATOM 31182 H1 WAT 5376 40.611 101.875 23.444 1.00 0.00 H ATOM 31183 H2 WAT 5376 39.156 102.290 23.392 1.00 0.00 H TER 31185 WAT 5376 ATOM 31185 O WAT 5377 71.323 116.768 76.336 1.00 0.00 O ATOM 31186 H1 WAT 5377 71.148 117.700 76.202 1.00 0.00 H ATOM 31187 H2 WAT 5377 71.399 116.410 75.451 1.00 0.00 H TER 31189 WAT 5377 ATOM 31189 O WAT 5378 108.067 36.947 92.194 1.00 0.00 O ATOM 31190 H1 WAT 5378 108.044 37.245 93.103 1.00 0.00 H ATOM 31191 H2 WAT 5378 108.346 37.715 91.696 1.00 0.00 H TER 31193 WAT 5378 ATOM 31193 O WAT 5379 6.736 123.334 80.990 1.00 0.00 O ATOM 31194 H1 WAT 5379 6.621 123.460 81.932 1.00 0.00 H ATOM 31195 H2 WAT 5379 7.638 123.605 80.821 1.00 0.00 H TER 31197 WAT 5379 ATOM 31197 O WAT 5380 124.209 145.255 72.771 1.00 0.00 O ATOM 31198 H1 WAT 5380 123.398 145.596 72.391 1.00 0.00 H ATOM 31199 H2 WAT 5380 124.201 144.323 72.554 1.00 0.00 H TER 31201 WAT 5380 ATOM 31201 O WAT 5381 49.112 62.757 122.227 1.00 0.00 O ATOM 31202 H1 WAT 5381 48.811 63.552 122.668 1.00 0.00 H ATOM 31203 H2 WAT 5381 49.969 62.578 122.613 1.00 0.00 H TER 31205 WAT 5381 ATOM 31205 O WAT 5382 27.400 36.185 145.013 1.00 0.00 O ATOM 31206 H1 WAT 5382 26.765 36.764 144.593 1.00 0.00 H ATOM 31207 H2 WAT 5382 27.460 35.430 144.428 1.00 0.00 H TER 31209 WAT 5382 ATOM 31209 O WAT 5383 102.388 117.477 103.317 1.00 0.00 O ATOM 31210 H1 WAT 5383 102.629 117.122 104.173 1.00 0.00 H ATOM 31211 H2 WAT 5383 101.515 117.125 103.149 1.00 0.00 H TER 31213 WAT 5383 ATOM 31213 O WAT 5384 35.605 76.052 71.848 1.00 0.00 O ATOM 31214 H1 WAT 5384 35.867 76.594 71.103 1.00 0.00 H ATOM 31215 H2 WAT 5384 34.782 75.648 71.572 1.00 0.00 H TER 31217 WAT 5384 ATOM 31217 O WAT 5385 96.156 114.316 99.354 1.00 0.00 O ATOM 31218 H1 WAT 5385 95.712 114.966 99.898 1.00 0.00 H ATOM 31219 H2 WAT 5385 96.740 113.856 99.958 1.00 0.00 H TER 31221 WAT 5385 ATOM 31221 O WAT 5386 92.106 27.309 9.546 1.00 0.00 O ATOM 31222 H1 WAT 5386 93.003 27.405 9.867 1.00 0.00 H ATOM 31223 H2 WAT 5386 91.830 28.201 9.336 1.00 0.00 H TER 31225 WAT 5386 ATOM 31225 O WAT 5387 51.808 29.856 98.300 1.00 0.00 O ATOM 31226 H1 WAT 5387 50.997 29.855 97.792 1.00 0.00 H ATOM 31227 H2 WAT 5387 52.177 28.983 98.164 1.00 0.00 H TER 31229 WAT 5387 ATOM 31229 O WAT 5388 42.934 100.344 67.430 1.00 0.00 O ATOM 31230 H1 WAT 5388 43.609 100.167 66.775 1.00 0.00 H ATOM 31231 H2 WAT 5388 43.204 101.167 67.836 1.00 0.00 H TER 31233 WAT 5388 ATOM 31233 O WAT 5389 73.398 61.506 142.803 1.00 0.00 O ATOM 31234 H1 WAT 5389 72.843 61.383 143.573 1.00 0.00 H ATOM 31235 H2 WAT 5389 73.968 60.737 142.793 1.00 0.00 H TER 31237 WAT 5389 ATOM 31237 O WAT 5390 56.728 66.781 143.859 1.00 0.00 O ATOM 31238 H1 WAT 5390 56.183 66.924 143.085 1.00 0.00 H ATOM 31239 H2 WAT 5390 57.339 66.092 143.597 1.00 0.00 H TER 31241 WAT 5390 ATOM 31241 O WAT 5391 105.858 25.171 12.743 1.00 0.00 O ATOM 31242 H1 WAT 5391 106.623 25.215 12.169 1.00 0.00 H ATOM 31243 H2 WAT 5391 106.212 25.300 13.623 1.00 0.00 H TER 31245 WAT 5391 ATOM 31245 O WAT 5392 86.006 23.611 118.550 1.00 0.00 O ATOM 31246 H1 WAT 5392 86.127 23.861 117.634 1.00 0.00 H ATOM 31247 H2 WAT 5392 86.593 22.865 118.674 1.00 0.00 H TER 31249 WAT 5392 ATOM 31249 O WAT 5393 95.569 117.656 80.953 1.00 0.00 O ATOM 31250 H1 WAT 5393 96.005 116.805 80.901 1.00 0.00 H ATOM 31251 H2 WAT 5393 95.033 117.602 81.745 1.00 0.00 H TER 31253 WAT 5393 ATOM 31253 O WAT 5394 56.866 135.586 18.361 1.00 0.00 O ATOM 31254 H1 WAT 5394 56.237 135.727 17.654 1.00 0.00 H ATOM 31255 H2 WAT 5394 56.411 135.010 18.975 1.00 0.00 H TER 31257 WAT 5394 ATOM 31257 O WAT 5395 129.846 59.837 141.569 1.00 0.00 O ATOM 31258 H1 WAT 5395 130.535 59.234 141.290 1.00 0.00 H ATOM 31259 H2 WAT 5395 130.134 60.693 141.252 1.00 0.00 H TER 31261 WAT 5395 ATOM 31261 O WAT 5396 53.855 62.665 8.879 1.00 0.00 O ATOM 31262 H1 WAT 5396 53.268 63.098 9.498 1.00 0.00 H ATOM 31263 H2 WAT 5396 54.516 63.326 8.673 1.00 0.00 H TER 31265 WAT 5396 ATOM 31265 O WAT 5397 143.410 70.108 4.939 1.00 0.00 O ATOM 31266 H1 WAT 5397 144.339 70.173 4.716 1.00 0.00 H ATOM 31267 H2 WAT 5397 143.352 70.458 5.828 1.00 0.00 H TER 31269 WAT 5397 ATOM 31269 O WAT 5398 15.907 45.541 78.177 1.00 0.00 O ATOM 31270 H1 WAT 5398 15.656 46.452 78.335 1.00 0.00 H ATOM 31271 H2 WAT 5398 16.861 45.539 78.255 1.00 0.00 H TER 31273 WAT 5398 ATOM 31273 O WAT 5399 107.824 138.580 116.409 1.00 0.00 O ATOM 31274 H1 WAT 5399 107.991 139.146 115.656 1.00 0.00 H ATOM 31275 H2 WAT 5399 107.731 137.704 116.034 1.00 0.00 H TER 31277 WAT 5399 ATOM 31277 O WAT 5400 137.700 38.344 103.176 1.00 0.00 O ATOM 31278 H1 WAT 5400 138.592 38.342 102.827 1.00 0.00 H ATOM 31279 H2 WAT 5400 137.140 38.384 102.401 1.00 0.00 H TER 31281 WAT 5400 ATOM 31281 O WAT 5401 56.245 48.722 116.478 1.00 0.00 O ATOM 31282 H1 WAT 5401 56.072 48.115 117.197 1.00 0.00 H ATOM 31283 H2 WAT 5401 55.617 48.474 115.799 1.00 0.00 H TER 31285 WAT 5401 ATOM 31285 O WAT 5402 50.041 90.873 122.965 1.00 0.00 O ATOM 31286 H1 WAT 5402 50.345 90.913 123.871 1.00 0.00 H ATOM 31287 H2 WAT 5402 50.216 91.746 122.614 1.00 0.00 H TER 31289 WAT 5402 ATOM 31289 O WAT 5403 90.221 87.357 109.294 1.00 0.00 O ATOM 31290 H1 WAT 5403 90.338 86.422 109.124 1.00 0.00 H ATOM 31291 H2 WAT 5403 90.488 87.471 110.206 1.00 0.00 H TER 31293 WAT 5403 ATOM 31293 O WAT 5404 1.129 103.206 22.831 1.00 0.00 O ATOM 31294 H1 WAT 5404 1.276 103.026 23.759 1.00 0.00 H ATOM 31295 H2 WAT 5404 0.404 102.629 22.587 1.00 0.00 H TER 31297 WAT 5404 ATOM 31297 O WAT 5405 71.386 23.875 60.029 1.00 0.00 O ATOM 31298 H1 WAT 5405 72.043 23.820 59.335 1.00 0.00 H ATOM 31299 H2 WAT 5405 71.450 24.774 60.349 1.00 0.00 H TER 31301 WAT 5405 ATOM 31301 O WAT 5406 40.337 88.186 80.837 1.00 0.00 O ATOM 31302 H1 WAT 5406 39.477 87.819 81.045 1.00 0.00 H ATOM 31303 H2 WAT 5406 40.224 88.586 79.975 1.00 0.00 H TER 31305 WAT 5406 ATOM 31305 O WAT 5407 65.547 63.271 114.797 1.00 0.00 O ATOM 31306 H1 WAT 5407 65.949 63.840 115.452 1.00 0.00 H ATOM 31307 H2 WAT 5407 64.815 63.782 114.453 1.00 0.00 H TER 31309 WAT 5407 ATOM 31309 O WAT 5408 98.770 54.438 145.093 1.00 0.00 O ATOM 31310 H1 WAT 5408 99.172 55.261 145.370 1.00 0.00 H ATOM 31311 H2 WAT 5408 98.808 53.880 145.869 1.00 0.00 H TER 31313 WAT 5408 ATOM 31313 O WAT 5409 46.198 18.515 110.515 1.00 0.00 O ATOM 31314 H1 WAT 5409 45.836 17.992 111.230 1.00 0.00 H ATOM 31315 H2 WAT 5409 46.341 17.886 109.807 1.00 0.00 H TER 31317 WAT 5409 ATOM 31317 O WAT 5410 93.335 144.009 12.737 1.00 0.00 O ATOM 31318 H1 WAT 5410 93.209 144.956 12.791 1.00 0.00 H ATOM 31319 H2 WAT 5410 92.535 143.639 13.110 1.00 0.00 H TER 31321 WAT 5410 ATOM 31321 O WAT 5411 30.789 11.519 61.529 1.00 0.00 O ATOM 31322 H1 WAT 5411 31.170 12.363 61.771 1.00 0.00 H ATOM 31323 H2 WAT 5411 30.058 11.743 60.953 1.00 0.00 H TER 31325 WAT 5411 ATOM 31325 O WAT 5412 37.687 59.257 62.389 1.00 0.00 O ATOM 31326 H1 WAT 5412 36.807 59.254 62.768 1.00 0.00 H ATOM 31327 H2 WAT 5412 38.208 59.780 62.999 1.00 0.00 H TER 31329 WAT 5412 ATOM 31329 O WAT 5413 53.650 124.019 140.582 1.00 0.00 O ATOM 31330 H1 WAT 5413 52.779 124.179 140.217 1.00 0.00 H ATOM 31331 H2 WAT 5413 54.252 124.383 139.933 1.00 0.00 H TER 31333 WAT 5413 ATOM 31333 O WAT 5414 110.509 21.871 9.120 1.00 0.00 O ATOM 31334 H1 WAT 5414 109.923 22.625 9.056 1.00 0.00 H ATOM 31335 H2 WAT 5414 110.520 21.654 10.052 1.00 0.00 H TER 31337 WAT 5414 ATOM 31337 O WAT 5415 27.847 115.797 59.057 1.00 0.00 O ATOM 31338 H1 WAT 5415 27.023 116.156 58.729 1.00 0.00 H ATOM 31339 H2 WAT 5415 28.512 116.422 58.769 1.00 0.00 H TER 31341 WAT 5415 ATOM 31341 O WAT 5416 61.832 90.605 84.942 1.00 0.00 O ATOM 31342 H1 WAT 5416 62.344 90.801 84.158 1.00 0.00 H ATOM 31343 H2 WAT 5416 62.390 90.019 85.453 1.00 0.00 H TER 31345 WAT 5416 ATOM 31345 O WAT 5417 48.223 10.610 107.980 1.00 0.00 O ATOM 31346 H1 WAT 5417 47.717 11.001 107.268 1.00 0.00 H ATOM 31347 H2 WAT 5417 49.099 10.489 107.614 1.00 0.00 H TER 31349 WAT 5417 ATOM 31349 O WAT 5418 141.671 11.347 87.229 1.00 0.00 O ATOM 31350 H1 WAT 5418 142.523 11.473 87.646 1.00 0.00 H ATOM 31351 H2 WAT 5418 141.840 10.725 86.521 1.00 0.00 H TER 31353 WAT 5418 ATOM 31353 O WAT 5419 47.460 46.046 99.873 1.00 0.00 O ATOM 31354 H1 WAT 5419 47.798 46.528 99.118 1.00 0.00 H ATOM 31355 H2 WAT 5419 47.911 45.203 99.841 1.00 0.00 H TER 31357 WAT 5419 ATOM 31357 O WAT 5420 30.584 141.838 126.924 1.00 0.00 O ATOM 31358 H1 WAT 5420 30.621 141.907 127.878 1.00 0.00 H ATOM 31359 H2 WAT 5420 31.493 141.697 126.659 1.00 0.00 H TER 31361 WAT 5420 ATOM 31361 O WAT 5421 68.551 105.439 14.291 1.00 0.00 O ATOM 31362 H1 WAT 5421 67.857 106.092 14.198 1.00 0.00 H ATOM 31363 H2 WAT 5421 68.569 104.987 13.447 1.00 0.00 H TER 31365 WAT 5421 ATOM 31365 O WAT 5422 121.071 130.384 80.601 1.00 0.00 O ATOM 31366 H1 WAT 5422 121.183 130.212 81.536 1.00 0.00 H ATOM 31367 H2 WAT 5422 121.155 129.525 80.188 1.00 0.00 H TER 31369 WAT 5422 ATOM 31369 O WAT 5423 100.426 123.203 70.265 1.00 0.00 O ATOM 31370 H1 WAT 5423 100.713 123.771 70.980 1.00 0.00 H ATOM 31371 H2 WAT 5423 101.004 123.426 69.535 1.00 0.00 H TER 31373 WAT 5423 ATOM 31373 O WAT 5424 94.350 19.624 76.318 1.00 0.00 O ATOM 31374 H1 WAT 5424 95.229 19.951 76.124 1.00 0.00 H ATOM 31375 H2 WAT 5424 93.974 20.283 76.902 1.00 0.00 H TER 31377 WAT 5424 ATOM 31377 O WAT 5425 80.503 104.472 133.989 1.00 0.00 O ATOM 31378 H1 WAT 5425 80.639 103.525 133.981 1.00 0.00 H ATOM 31379 H2 WAT 5425 80.547 104.728 133.068 1.00 0.00 H TER 31381 WAT 5425 ATOM 31381 O WAT 5426 25.148 118.828 118.180 1.00 0.00 O ATOM 31382 H1 WAT 5426 24.453 119.184 118.733 1.00 0.00 H ATOM 31383 H2 WAT 5426 24.952 117.893 118.120 1.00 0.00 H TER 31385 WAT 5426 ATOM 31385 O WAT 5427 51.783 74.761 83.857 1.00 0.00 O ATOM 31386 H1 WAT 5427 51.197 75.353 84.327 1.00 0.00 H ATOM 31387 H2 WAT 5427 52.659 75.116 84.013 1.00 0.00 H TER 31389 WAT 5427 ATOM 31389 O WAT 5428 41.077 102.005 139.594 1.00 0.00 O ATOM 31390 H1 WAT 5428 41.390 101.540 138.818 1.00 0.00 H ATOM 31391 H2 WAT 5428 41.617 102.794 139.635 1.00 0.00 H TER 31393 WAT 5428 ATOM 31393 O WAT 5429 112.636 7.142 82.195 1.00 0.00 O ATOM 31394 H1 WAT 5429 113.398 6.583 82.343 1.00 0.00 H ATOM 31395 H2 WAT 5429 112.153 7.112 83.021 1.00 0.00 H TER 31397 WAT 5429 ATOM 31397 O WAT 5430 76.076 99.981 69.090 1.00 0.00 O ATOM 31398 H1 WAT 5430 75.925 99.418 68.330 1.00 0.00 H ATOM 31399 H2 WAT 5430 76.897 99.662 69.465 1.00 0.00 H TER 31401 WAT 5430 ATOM 31401 O WAT 5431 70.277 133.465 143.578 1.00 0.00 O ATOM 31402 H1 WAT 5431 69.750 132.667 143.628 1.00 0.00 H ATOM 31403 H2 WAT 5431 69.780 134.044 143.000 1.00 0.00 H TER 31405 WAT 5431 ATOM 31405 O WAT 5432 13.302 145.171 61.884 1.00 0.00 O ATOM 31406 H1 WAT 5432 13.636 145.040 60.997 1.00 0.00 H ATOM 31407 H2 WAT 5432 13.207 146.119 61.967 1.00 0.00 H TER 31409 WAT 5432 ATOM 31409 O WAT 5433 29.325 15.266 78.311 1.00 0.00 O ATOM 31410 H1 WAT 5433 28.511 15.759 78.410 1.00 0.00 H ATOM 31411 H2 WAT 5433 29.978 15.927 78.078 1.00 0.00 H TER 31413 WAT 5433 ATOM 31413 O WAT 5434 45.918 16.675 112.641 1.00 0.00 O ATOM 31414 H1 WAT 5434 45.350 16.150 113.205 1.00 0.00 H ATOM 31415 H2 WAT 5434 46.488 16.035 112.214 1.00 0.00 H TER 31417 WAT 5434 ATOM 31417 O WAT 5435 113.448 138.066 60.499 1.00 0.00 O ATOM 31418 H1 WAT 5435 112.799 138.029 59.796 1.00 0.00 H ATOM 31419 H2 WAT 5435 112.931 138.031 61.304 1.00 0.00 H TER 31421 WAT 5435 ATOM 31421 O WAT 5436 119.033 131.773 116.002 1.00 0.00 O ATOM 31422 H1 WAT 5436 119.543 132.395 116.520 1.00 0.00 H ATOM 31423 H2 WAT 5436 118.180 132.195 115.893 1.00 0.00 H TER 31425 WAT 5436 ATOM 31425 O WAT 5437 69.033 13.685 95.636 1.00 0.00 O ATOM 31426 H1 WAT 5437 69.434 13.066 96.247 1.00 0.00 H ATOM 31427 H2 WAT 5437 68.133 13.781 95.950 1.00 0.00 H TER 31429 WAT 5437 ATOM 31429 O WAT 5438 95.250 94.923 146.137 1.00 0.00 O ATOM 31430 H1 WAT 5438 95.959 94.284 146.063 1.00 0.00 H ATOM 31431 H2 WAT 5438 95.187 95.102 147.075 1.00 0.00 H TER 31433 WAT 5438 ATOM 31433 O WAT 5439 47.049 45.531 139.306 1.00 0.00 O ATOM 31434 H1 WAT 5439 46.717 45.229 138.460 1.00 0.00 H ATOM 31435 H2 WAT 5439 47.443 46.383 139.119 1.00 0.00 H TER 31437 WAT 5439 ATOM 31437 O WAT 5440 68.274 45.487 148.196 1.00 0.00 O ATOM 31438 H1 WAT 5440 69.133 45.828 148.445 1.00 0.00 H ATOM 31439 H2 WAT 5440 68.419 44.552 148.054 1.00 0.00 H TER 31441 WAT 5440 ATOM 31441 O WAT 5441 15.047 64.298 151.834 1.00 0.00 O ATOM 31442 H1 WAT 5441 14.185 63.993 151.550 1.00 0.00 H ATOM 31443 H2 WAT 5441 15.377 63.595 152.393 1.00 0.00 H TER 31445 WAT 5441 ATOM 31445 O WAT 5442 131.032 67.370 100.190 1.00 0.00 O ATOM 31446 H1 WAT 5442 131.471 67.248 99.348 1.00 0.00 H ATOM 31447 H2 WAT 5442 131.409 66.697 100.756 1.00 0.00 H TER 31449 WAT 5442 ATOM 31449 O WAT 5443 54.383 126.363 102.015 1.00 0.00 O ATOM 31450 H1 WAT 5443 55.126 126.957 101.909 1.00 0.00 H ATOM 31451 H2 WAT 5443 53.762 126.631 101.338 1.00 0.00 H TER 31453 WAT 5443 ATOM 31453 O WAT 5444 25.205 12.299 118.378 1.00 0.00 O ATOM 31454 H1 WAT 5444 25.295 12.519 119.305 1.00 0.00 H ATOM 31455 H2 WAT 5444 25.782 12.917 117.929 1.00 0.00 H TER 31457 WAT 5444 ATOM 31457 O WAT 5445 10.004 61.726 82.989 1.00 0.00 O ATOM 31458 H1 WAT 5445 10.539 62.437 82.636 1.00 0.00 H ATOM 31459 H2 WAT 5445 9.683 62.061 83.826 1.00 0.00 H TER 31461 WAT 5445 ATOM 31461 O WAT 5446 19.889 13.022 14.170 1.00 0.00 O ATOM 31462 H1 WAT 5446 19.485 13.536 14.869 1.00 0.00 H ATOM 31463 H2 WAT 5446 20.225 13.675 13.556 1.00 0.00 H TER 31465 WAT 5446 ATOM 31465 O WAT 5447 38.196 0.122 78.556 1.00 0.00 O ATOM 31466 H1 WAT 5447 38.156 0.998 78.172 1.00 0.00 H ATOM 31467 H2 WAT 5447 39.051 -0.217 78.290 1.00 0.00 H TER 31469 WAT 5447 ATOM 31469 O WAT 5448 140.348 35.741 85.291 1.00 0.00 O ATOM 31470 H1 WAT 5448 140.043 34.913 85.660 1.00 0.00 H ATOM 31471 H2 WAT 5448 140.480 36.308 86.050 1.00 0.00 H TER 31473 WAT 5448 ATOM 31473 O WAT 5449 100.867 69.075 74.076 1.00 0.00 O ATOM 31474 H1 WAT 5449 100.823 69.482 74.942 1.00 0.00 H ATOM 31475 H2 WAT 5449 101.432 69.656 73.567 1.00 0.00 H TER 31477 WAT 5449 ATOM 31477 O WAT 5450 52.567 85.241 105.442 1.00 0.00 O ATOM 31478 H1 WAT 5450 53.407 84.923 105.111 1.00 0.00 H ATOM 31479 H2 WAT 5450 52.222 85.786 104.734 1.00 0.00 H TER 31481 WAT 5450 ATOM 31481 O WAT 5451 3.781 109.048 141.676 1.00 0.00 O ATOM 31482 H1 WAT 5451 3.639 109.780 142.275 1.00 0.00 H ATOM 31483 H2 WAT 5451 3.353 108.304 142.100 1.00 0.00 H TER 31485 WAT 5451 ATOM 31485 O WAT 5452 15.457 128.157 84.593 1.00 0.00 O ATOM 31486 H1 WAT 5452 14.815 128.850 84.750 1.00 0.00 H ATOM 31487 H2 WAT 5452 15.490 127.671 85.417 1.00 0.00 H TER 31489 WAT 5452 ATOM 31489 O WAT 5453 7.681 87.990 111.593 1.00 0.00 O ATOM 31490 H1 WAT 5453 7.456 87.281 112.195 1.00 0.00 H ATOM 31491 H2 WAT 5453 7.934 88.717 112.163 1.00 0.00 H TER 31493 WAT 5453 ATOM 31493 O WAT 5454 134.918 84.384 23.472 1.00 0.00 O ATOM 31494 H1 WAT 5454 134.571 84.323 24.362 1.00 0.00 H ATOM 31495 H2 WAT 5454 135.670 83.791 23.467 1.00 0.00 H TER 31497 WAT 5454 ATOM 31497 O WAT 5455 110.808 25.501 81.867 1.00 0.00 O ATOM 31498 H1 WAT 5455 110.536 24.584 81.880 1.00 0.00 H ATOM 31499 H2 WAT 5455 110.541 25.843 82.720 1.00 0.00 H TER 31501 WAT 5455 ATOM 31501 O WAT 5456 13.045 54.847 83.431 1.00 0.00 O ATOM 31502 H1 WAT 5456 12.440 55.484 83.810 1.00 0.00 H ATOM 31503 H2 WAT 5456 12.756 54.753 82.523 1.00 0.00 H TER 31505 WAT 5456 ATOM 31505 O WAT 5457 44.673 70.601 96.988 1.00 0.00 O ATOM 31506 H1 WAT 5457 44.525 71.441 97.424 1.00 0.00 H ATOM 31507 H2 WAT 5457 44.982 70.021 97.684 1.00 0.00 H TER 31509 WAT 5457 ATOM 31509 O WAT 5458 97.665 96.543 60.377 1.00 0.00 O ATOM 31510 H1 WAT 5458 98.006 97.040 59.633 1.00 0.00 H ATOM 31511 H2 WAT 5458 96.887 97.028 60.653 1.00 0.00 H TER 31513 WAT 5458 ATOM 31513 O WAT 5459 138.186 15.094 70.938 1.00 0.00 O ATOM 31514 H1 WAT 5459 137.674 14.579 70.315 1.00 0.00 H ATOM 31515 H2 WAT 5459 138.033 14.670 71.782 1.00 0.00 H TER 31517 WAT 5459 ATOM 31517 O WAT 5460 40.282 26.401 19.623 1.00 0.00 O ATOM 31518 H1 WAT 5460 40.078 25.779 20.322 1.00 0.00 H ATOM 31519 H2 WAT 5460 41.196 26.221 19.402 1.00 0.00 H TER 31521 WAT 5460 ATOM 31521 O WAT 5461 51.200 113.609 110.383 1.00 0.00 O ATOM 31522 H1 WAT 5461 52.043 113.590 110.834 1.00 0.00 H ATOM 31523 H2 WAT 5461 50.943 114.531 110.395 1.00 0.00 H TER 31525 WAT 5461 ATOM 31525 O WAT 5462 65.881 145.963 12.966 1.00 0.00 O ATOM 31526 H1 WAT 5462 66.699 145.944 12.469 1.00 0.00 H ATOM 31527 H2 WAT 5462 66.019 145.336 13.676 1.00 0.00 H TER 31529 WAT 5462 ATOM 31529 O WAT 5463 131.433 87.526 144.865 1.00 0.00 O ATOM 31530 H1 WAT 5463 130.992 88.367 144.745 1.00 0.00 H ATOM 31531 H2 WAT 5463 132.249 87.746 145.314 1.00 0.00 H TER 31533 WAT 5463 ATOM 31533 O WAT 5464 0.482 30.957 156.971 1.00 0.00 O ATOM 31534 H1 WAT 5464 0.067 31.775 157.247 1.00 0.00 H ATOM 31535 H2 WAT 5464 0.905 31.173 156.140 1.00 0.00 H TER 31537 WAT 5464 ATOM 31537 O WAT 5465 134.235 97.653 110.536 1.00 0.00 O ATOM 31538 H1 WAT 5465 133.787 96.913 110.946 1.00 0.00 H ATOM 31539 H2 WAT 5465 133.833 98.426 110.932 1.00 0.00 H TER 31541 WAT 5465 ATOM 31541 O WAT 5466 133.747 111.054 105.673 1.00 0.00 O ATOM 31542 H1 WAT 5466 133.904 111.893 105.239 1.00 0.00 H ATOM 31543 H2 WAT 5466 133.149 110.590 105.087 1.00 0.00 H TER 31545 WAT 5466 ATOM 31545 O WAT 5467 68.537 28.693 54.370 1.00 0.00 O ATOM 31546 H1 WAT 5467 68.189 29.554 54.135 1.00 0.00 H ATOM 31547 H2 WAT 5467 68.596 28.224 53.538 1.00 0.00 H TER 31549 WAT 5467 ATOM 31549 O WAT 5468 74.456 143.652 5.930 1.00 0.00 O ATOM 31550 H1 WAT 5468 74.191 143.858 5.034 1.00 0.00 H ATOM 31551 H2 WAT 5468 73.863 144.165 6.479 1.00 0.00 H TER 31553 WAT 5468 ATOM 31553 O WAT 5469 85.657 58.797 21.236 1.00 0.00 O ATOM 31554 H1 WAT 5469 85.139 59.070 20.479 1.00 0.00 H ATOM 31555 H2 WAT 5469 85.035 58.793 21.963 1.00 0.00 H TER 31557 WAT 5469 ATOM 31557 O WAT 5470 133.622 128.127 70.626 1.00 0.00 O ATOM 31558 H1 WAT 5470 133.825 129.054 70.498 1.00 0.00 H ATOM 31559 H2 WAT 5470 132.738 128.025 70.272 1.00 0.00 H TER 31561 WAT 5470 ATOM 31561 O WAT 5471 133.039 56.012 85.800 1.00 0.00 O ATOM 31562 H1 WAT 5471 132.691 55.879 86.682 1.00 0.00 H ATOM 31563 H2 WAT 5471 133.950 55.725 85.856 1.00 0.00 H TER 31565 WAT 5471 ATOM 31565 O WAT 5472 131.047 59.704 111.536 1.00 0.00 O ATOM 31566 H1 WAT 5472 131.056 60.498 111.001 1.00 0.00 H ATOM 31567 H2 WAT 5472 130.489 59.095 111.051 1.00 0.00 H TER 31569 WAT 5472 ATOM 31569 O WAT 5473 71.552 128.632 111.863 1.00 0.00 O ATOM 31570 H1 WAT 5473 71.686 128.828 112.790 1.00 0.00 H ATOM 31571 H2 WAT 5473 71.233 129.454 111.489 1.00 0.00 H TER 31573 WAT 5473 ATOM 31573 O WAT 5474 62.256 113.392 50.426 1.00 0.00 O ATOM 31574 H1 WAT 5474 61.343 113.620 50.603 1.00 0.00 H ATOM 31575 H2 WAT 5474 62.704 114.235 50.358 1.00 0.00 H TER 31577 WAT 5474 ATOM 31577 O WAT 5475 92.532 92.481 1.575 1.00 0.00 O ATOM 31578 H1 WAT 5475 93.146 93.208 1.472 1.00 0.00 H ATOM 31579 H2 WAT 5475 92.283 92.249 0.681 1.00 0.00 H TER 31581 WAT 5475 ATOM 31581 O WAT 5476 45.898 79.899 57.882 1.00 0.00 O ATOM 31582 H1 WAT 5476 45.692 79.277 57.184 1.00 0.00 H ATOM 31583 H2 WAT 5476 45.463 79.542 58.656 1.00 0.00 H TER 31585 WAT 5476 ATOM 31585 O WAT 5477 119.062 112.743 63.316 1.00 0.00 O ATOM 31586 H1 WAT 5477 118.619 111.940 63.041 1.00 0.00 H ATOM 31587 H2 WAT 5477 119.464 113.081 62.516 1.00 0.00 H TER 31589 WAT 5477 ATOM 31589 O WAT 5478 85.181 118.837 150.444 1.00 0.00 O ATOM 31590 H1 WAT 5478 85.606 118.631 151.277 1.00 0.00 H ATOM 31591 H2 WAT 5478 84.263 118.981 150.673 1.00 0.00 H TER 31593 WAT 5478 ATOM 31593 O WAT 5479 16.988 103.300 84.051 1.00 0.00 O ATOM 31594 H1 WAT 5479 17.937 103.357 83.937 1.00 0.00 H ATOM 31595 H2 WAT 5479 16.814 103.790 84.855 1.00 0.00 H TER 31597 WAT 5479 ATOM 31597 O WAT 5480 49.950 83.893 129.992 1.00 0.00 O ATOM 31598 H1 WAT 5480 50.114 84.442 129.225 1.00 0.00 H ATOM 31599 H2 WAT 5480 50.534 83.143 129.880 1.00 0.00 H TER 31601 WAT 5480 ATOM 31601 O WAT 5481 1.087 22.201 76.634 1.00 0.00 O ATOM 31602 H1 WAT 5481 0.676 21.396 76.319 1.00 0.00 H ATOM 31603 H2 WAT 5481 0.464 22.557 77.267 1.00 0.00 H TER 31605 WAT 5481 ATOM 31605 O WAT 5482 108.564 98.650 102.410 1.00 0.00 O ATOM 31606 H1 WAT 5482 107.926 98.591 101.699 1.00 0.00 H ATOM 31607 H2 WAT 5482 109.063 97.835 102.352 1.00 0.00 H TER 31609 WAT 5482 ATOM 31609 O WAT 5483 99.292 18.673 110.416 1.00 0.00 O ATOM 31610 H1 WAT 5483 99.383 19.360 109.756 1.00 0.00 H ATOM 31611 H2 WAT 5483 98.586 18.979 110.985 1.00 0.00 H TER 31613 WAT 5483 ATOM 31613 O WAT 5484 106.312 98.326 149.420 1.00 0.00 O ATOM 31614 H1 WAT 5484 106.953 97.802 148.938 1.00 0.00 H ATOM 31615 H2 WAT 5484 105.513 98.269 148.896 1.00 0.00 H TER 31617 WAT 5484 ATOM 31617 O WAT 5485 87.148 18.637 85.558 1.00 0.00 O ATOM 31618 H1 WAT 5485 86.200 18.534 85.477 1.00 0.00 H ATOM 31619 H2 WAT 5485 87.265 19.173 86.343 1.00 0.00 H TER 31621 WAT 5485 ATOM 31621 O WAT 5486 71.704 126.580 4.617 1.00 0.00 O ATOM 31622 H1 WAT 5486 72.073 127.458 4.709 1.00 0.00 H ATOM 31623 H2 WAT 5486 71.789 126.192 5.488 1.00 0.00 H TER 31625 WAT 5486 ATOM 31625 O WAT 5487 82.728 93.540 156.283 1.00 0.00 O ATOM 31626 H1 WAT 5487 82.528 94.296 156.836 1.00 0.00 H ATOM 31627 H2 WAT 5487 82.202 92.829 156.650 1.00 0.00 H TER 31629 WAT 5487 ATOM 31629 O WAT 5488 31.239 76.005 132.613 1.00 0.00 O ATOM 31630 H1 WAT 5488 31.692 75.404 132.023 1.00 0.00 H ATOM 31631 H2 WAT 5488 31.428 75.668 133.489 1.00 0.00 H TER 31633 WAT 5488 ATOM 31633 O WAT 5489 53.079 102.010 129.700 1.00 0.00 O ATOM 31634 H1 WAT 5489 52.648 102.704 130.200 1.00 0.00 H ATOM 31635 H2 WAT 5489 53.585 101.525 130.352 1.00 0.00 H TER 31637 WAT 5489 ATOM 31637 O WAT 5490 95.204 80.176 140.057 1.00 0.00 O ATOM 31638 H1 WAT 5490 95.024 79.757 139.216 1.00 0.00 H ATOM 31639 H2 WAT 5490 95.424 81.080 139.833 1.00 0.00 H TER 31641 WAT 5490 ATOM 31641 O WAT 5491 105.668 140.325 149.314 1.00 0.00 O ATOM 31642 H1 WAT 5491 104.930 140.294 149.923 1.00 0.00 H ATOM 31643 H2 WAT 5491 106.397 140.657 149.838 1.00 0.00 H TER 31645 WAT 5491 ATOM 31645 O WAT 5492 49.043 143.312 146.236 1.00 0.00 O ATOM 31646 H1 WAT 5492 48.950 142.705 145.501 1.00 0.00 H ATOM 31647 H2 WAT 5492 49.898 143.104 146.612 1.00 0.00 H TER 31649 WAT 5492 ATOM 31649 O WAT 5493 144.387 10.843 123.735 1.00 0.00 O ATOM 31650 H1 WAT 5493 143.534 10.760 123.310 1.00 0.00 H ATOM 31651 H2 WAT 5493 144.453 11.771 123.961 1.00 0.00 H TER 31653 WAT 5493 ATOM 31653 O WAT 5494 61.417 104.386 62.248 1.00 0.00 O ATOM 31654 H1 WAT 5494 61.667 105.270 61.978 1.00 0.00 H ATOM 31655 H2 WAT 5494 60.594 104.220 61.787 1.00 0.00 H TER 31657 WAT 5494 ATOM 31657 O WAT 5495 101.975 123.934 132.256 1.00 0.00 O ATOM 31658 H1 WAT 5495 101.679 123.450 131.485 1.00 0.00 H ATOM 31659 H2 WAT 5495 102.513 124.642 131.902 1.00 0.00 H TER 31661 WAT 5495 ATOM 31661 O WAT 5496 133.992 104.564 69.426 1.00 0.00 O ATOM 31662 H1 WAT 5496 133.913 104.159 68.562 1.00 0.00 H ATOM 31663 H2 WAT 5496 133.143 104.981 69.573 1.00 0.00 H TER 31665 WAT 5496 ATOM 31665 O WAT 5497 139.011 42.685 148.973 1.00 0.00 O ATOM 31666 H1 WAT 5497 139.110 42.317 149.851 1.00 0.00 H ATOM 31667 H2 WAT 5497 138.948 41.921 148.399 1.00 0.00 H TER 31669 WAT 5497 ATOM 31669 O WAT 5498 138.299 39.051 2.686 1.00 0.00 O ATOM 31670 H1 WAT 5498 139.037 38.536 3.010 1.00 0.00 H ATOM 31671 H2 WAT 5498 138.045 38.618 1.870 1.00 0.00 H TER 31673 WAT 5498 ATOM 31673 O WAT 5499 24.747 114.356 83.881 1.00 0.00 O ATOM 31674 H1 WAT 5499 23.899 114.638 83.537 1.00 0.00 H ATOM 31675 H2 WAT 5499 24.674 114.480 84.827 1.00 0.00 H TER 31677 WAT 5499 ATOM 31677 O WAT 5500 105.711 67.494 82.837 1.00 0.00 O ATOM 31678 H1 WAT 5500 105.475 66.937 82.095 1.00 0.00 H ATOM 31679 H2 WAT 5500 106.417 67.021 83.277 1.00 0.00 H TER 31681 WAT 5500 ATOM 31681 O WAT 5501 11.892 92.698 156.007 1.00 0.00 O ATOM 31682 H1 WAT 5501 11.137 93.200 155.700 1.00 0.00 H ATOM 31683 H2 WAT 5501 12.516 93.361 156.303 1.00 0.00 H TER 31685 WAT 5501 ATOM 31685 O WAT 5502 81.107 4.188 64.832 1.00 0.00 O ATOM 31686 H1 WAT 5502 81.045 4.741 64.053 1.00 0.00 H ATOM 31687 H2 WAT 5502 82.026 3.920 64.862 1.00 0.00 H TER 31689 WAT 5502 ATOM 31689 O WAT 5503 49.093 77.661 79.702 1.00 0.00 O ATOM 31690 H1 WAT 5503 49.397 76.753 79.684 1.00 0.00 H ATOM 31691 H2 WAT 5503 48.256 77.624 80.165 1.00 0.00 H TER 31693 WAT 5503 ATOM 31693 O WAT 5504 141.907 113.366 127.383 1.00 0.00 O ATOM 31694 H1 WAT 5504 142.508 112.733 127.777 1.00 0.00 H ATOM 31695 H2 WAT 5504 141.097 113.272 127.885 1.00 0.00 H TER 31697 WAT 5504 ATOM 31697 O WAT 5505 51.734 38.320 88.831 1.00 0.00 O ATOM 31698 H1 WAT 5505 51.812 39.057 88.225 1.00 0.00 H ATOM 31699 H2 WAT 5505 52.582 38.283 89.273 1.00 0.00 H TER 31701 WAT 5505 ATOM 31701 O WAT 5506 12.890 99.428 69.946 1.00 0.00 O ATOM 31702 H1 WAT 5506 13.025 99.400 70.893 1.00 0.00 H ATOM 31703 H2 WAT 5506 12.601 98.544 69.718 1.00 0.00 H TER 31705 WAT 5506 ATOM 31705 O WAT 5507 77.402 11.622 105.908 1.00 0.00 O ATOM 31706 H1 WAT 5507 77.209 11.778 104.984 1.00 0.00 H ATOM 31707 H2 WAT 5507 77.249 12.467 106.331 1.00 0.00 H TER 31709 WAT 5507 ATOM 31709 O WAT 5508 25.169 139.212 109.973 1.00 0.00 O ATOM 31710 H1 WAT 5508 25.026 138.409 109.472 1.00 0.00 H ATOM 31711 H2 WAT 5508 25.790 138.959 110.657 1.00 0.00 H TER 31713 WAT 5508 ATOM 31713 O WAT 5509 9.648 108.072 84.827 1.00 0.00 O ATOM 31714 H1 WAT 5509 10.420 107.851 85.347 1.00 0.00 H ATOM 31715 H2 WAT 5509 9.124 108.631 85.400 1.00 0.00 H TER 31717 WAT 5509 ATOM 31717 O WAT 5510 56.359 27.720 147.615 1.00 0.00 O ATOM 31718 H1 WAT 5510 57.247 27.911 147.916 1.00 0.00 H ATOM 31719 H2 WAT 5510 56.482 27.195 146.824 1.00 0.00 H TER 31721 WAT 5510 ATOM 31721 O WAT 5511 112.245 105.655 100.153 1.00 0.00 O ATOM 31722 H1 WAT 5511 111.912 105.873 101.023 1.00 0.00 H ATOM 31723 H2 WAT 5511 111.474 105.688 99.587 1.00 0.00 H TER 31725 WAT 5511 ATOM 31725 O WAT 5512 80.478 141.896 70.654 1.00 0.00 O ATOM 31726 H1 WAT 5512 81.405 142.118 70.746 1.00 0.00 H ATOM 31727 H2 WAT 5512 80.162 141.811 71.554 1.00 0.00 H TER 31729 WAT 5512 ATOM 31729 O WAT 5513 76.102 70.601 95.679 1.00 0.00 O ATOM 31730 H1 WAT 5513 76.237 69.673 95.487 1.00 0.00 H ATOM 31731 H2 WAT 5513 75.255 70.633 96.124 1.00 0.00 H TER 31733 WAT 5513 ATOM 31733 O WAT 5514 53.132 135.538 57.174 1.00 0.00 O ATOM 31734 H1 WAT 5514 53.584 136.045 56.500 1.00 0.00 H ATOM 31735 H2 WAT 5514 53.373 134.629 56.993 1.00 0.00 H TER 31737 WAT 5514 ATOM 31737 O WAT 5515 62.683 127.500 2.037 1.00 0.00 O ATOM 31738 H1 WAT 5515 63.090 127.798 1.223 1.00 0.00 H ATOM 31739 H2 WAT 5515 63.285 127.786 2.724 1.00 0.00 H TER 31741 WAT 5515 ATOM 31741 O WAT 5516 4.659 29.619 12.535 1.00 0.00 O ATOM 31742 H1 WAT 5516 5.539 29.296 12.342 1.00 0.00 H ATOM 31743 H2 WAT 5516 4.265 29.769 11.676 1.00 0.00 H TER 31745 WAT 5516 ATOM 31745 O WAT 5517 136.639 124.796 77.199 1.00 0.00 O ATOM 31746 H1 WAT 5517 136.942 123.972 76.818 1.00 0.00 H ATOM 31747 H2 WAT 5517 137.204 124.929 77.961 1.00 0.00 H TER 31749 WAT 5517 ATOM 31749 O WAT 5518 46.886 48.173 3.330 1.00 0.00 O ATOM 31750 H1 WAT 5518 47.808 48.142 3.072 1.00 0.00 H ATOM 31751 H2 WAT 5518 46.906 48.372 4.266 1.00 0.00 H TER 31753 WAT 5518 ATOM 31753 O WAT 5519 22.281 64.230 86.512 1.00 0.00 O ATOM 31754 H1 WAT 5519 22.882 63.963 85.817 1.00 0.00 H ATOM 31755 H2 WAT 5519 22.065 63.417 86.968 1.00 0.00 H TER 31757 WAT 5519 ATOM 31757 O WAT 5520 41.183 65.200 140.180 1.00 0.00 O ATOM 31758 H1 WAT 5520 40.950 65.980 139.676 1.00 0.00 H ATOM 31759 H2 WAT 5520 42.073 65.369 140.487 1.00 0.00 H TER 31761 WAT 5520 ATOM 31761 O WAT 5521 56.875 53.384 155.376 1.00 0.00 O ATOM 31762 H1 WAT 5521 57.274 52.670 154.879 1.00 0.00 H ATOM 31763 H2 WAT 5521 56.485 53.950 154.710 1.00 0.00 H TER 31765 WAT 5521 ATOM 31765 O WAT 5522 46.719 96.659 106.628 1.00 0.00 O ATOM 31766 H1 WAT 5522 47.131 96.242 107.384 1.00 0.00 H ATOM 31767 H2 WAT 5522 46.523 97.549 106.922 1.00 0.00 H TER 31769 WAT 5522 ATOM 31769 O WAT 5523 67.751 89.883 157.063 1.00 0.00 O ATOM 31770 H1 WAT 5523 68.617 89.967 157.461 1.00 0.00 H ATOM 31771 H2 WAT 5523 67.920 89.512 156.197 1.00 0.00 H TER 31773 WAT 5523 ATOM 31773 O WAT 5524 115.669 93.460 144.088 1.00 0.00 O ATOM 31774 H1 WAT 5524 115.519 94.132 143.423 1.00 0.00 H ATOM 31775 H2 WAT 5524 115.472 92.635 143.643 1.00 0.00 H TER 31777 WAT 5524 ATOM 31777 O WAT 5525 20.246 26.923 114.148 1.00 0.00 O ATOM 31778 H1 WAT 5525 20.435 26.079 114.558 1.00 0.00 H ATOM 31779 H2 WAT 5525 21.006 27.466 114.355 1.00 0.00 H TER 31781 WAT 5525 ATOM 31781 O WAT 5526 95.459 94.333 137.316 1.00 0.00 O ATOM 31782 H1 WAT 5526 94.626 94.208 137.770 1.00 0.00 H ATOM 31783 H2 WAT 5526 95.766 93.446 137.127 1.00 0.00 H TER 31785 WAT 5526 ATOM 31785 O WAT 5527 26.424 69.948 78.265 1.00 0.00 O ATOM 31786 H1 WAT 5527 26.330 70.861 77.995 1.00 0.00 H ATOM 31787 H2 WAT 5527 27.143 69.613 77.730 1.00 0.00 H TER 31789 WAT 5527 ATOM 31789 O WAT 5528 122.993 22.398 120.302 1.00 0.00 O ATOM 31790 H1 WAT 5528 122.628 21.519 120.398 1.00 0.00 H ATOM 31791 H2 WAT 5528 122.270 22.983 120.528 1.00 0.00 H TER 31793 WAT 5528 ATOM 31793 O WAT 5529 3.280 66.885 10.389 1.00 0.00 O ATOM 31794 H1 WAT 5529 4.115 67.045 10.827 1.00 0.00 H ATOM 31795 H2 WAT 5529 3.362 67.332 9.546 1.00 0.00 H TER 31797 WAT 5529 ATOM 31797 O WAT 5530 100.544 5.358 116.984 1.00 0.00 O ATOM 31798 H1 WAT 5530 100.071 4.532 117.084 1.00 0.00 H ATOM 31799 H2 WAT 5530 101.242 5.161 116.359 1.00 0.00 H TER 31801 WAT 5530 ATOM 31801 O WAT 5531 127.130 86.816 84.138 1.00 0.00 O ATOM 31802 H1 WAT 5531 127.496 87.566 83.670 1.00 0.00 H ATOM 31803 H2 WAT 5531 127.204 87.052 85.063 1.00 0.00 H TER 31805 WAT 5531 ATOM 31805 O WAT 5532 113.122 1.196 55.293 1.00 0.00 O ATOM 31806 H1 WAT 5532 112.659 1.242 54.456 1.00 0.00 H ATOM 31807 H2 WAT 5532 112.760 0.422 55.725 1.00 0.00 H TER 31809 WAT 5532 ATOM 31809 O WAT 5533 3.308 11.524 63.693 1.00 0.00 O ATOM 31810 H1 WAT 5533 3.633 10.955 62.996 1.00 0.00 H ATOM 31811 H2 WAT 5533 2.883 10.928 64.311 1.00 0.00 H TER 31813 WAT 5533 ATOM 31813 O WAT 5534 101.249 137.140 115.968 1.00 0.00 O ATOM 31814 H1 WAT 5534 100.703 137.601 115.331 1.00 0.00 H ATOM 31815 H2 WAT 5534 100.944 137.457 116.818 1.00 0.00 H TER 31817 WAT 5534 ATOM 31817 O WAT 5535 112.322 103.663 78.325 1.00 0.00 O ATOM 31818 H1 WAT 5535 111.895 104.333 77.791 1.00 0.00 H ATOM 31819 H2 WAT 5535 112.437 102.921 77.732 1.00 0.00 H TER 31821 WAT 5535 ATOM 31821 O WAT 5536 130.217 122.395 128.559 1.00 0.00 O ATOM 31822 H1 WAT 5536 130.609 122.972 129.214 1.00 0.00 H ATOM 31823 H2 WAT 5536 129.322 122.256 128.868 1.00 0.00 H TER 31825 WAT 5536 ATOM 31825 O WAT 5537 134.118 81.108 122.118 1.00 0.00 O ATOM 31826 H1 WAT 5537 134.245 80.489 122.837 1.00 0.00 H ATOM 31827 H2 WAT 5537 134.731 81.819 122.303 1.00 0.00 H TER 31829 WAT 5537 ATOM 31829 O WAT 5538 86.135 63.873 79.790 1.00 0.00 O ATOM 31830 H1 WAT 5538 86.909 63.485 79.382 1.00 0.00 H ATOM 31831 H2 WAT 5538 85.447 63.784 79.131 1.00 0.00 H TER 31833 WAT 5538 ATOM 31833 O WAT 5539 78.037 60.102 141.201 1.00 0.00 O ATOM 31834 H1 WAT 5539 78.257 60.908 140.734 1.00 0.00 H ATOM 31835 H2 WAT 5539 78.531 59.419 140.748 1.00 0.00 H TER 31837 WAT 5539 ATOM 31837 O WAT 5540 118.618 121.323 152.302 1.00 0.00 O ATOM 31838 H1 WAT 5540 118.158 121.590 153.097 1.00 0.00 H ATOM 31839 H2 WAT 5540 118.018 120.715 151.871 1.00 0.00 H TER 31841 WAT 5540 ATOM 31841 O WAT 5541 111.406 46.970 65.138 1.00 0.00 O ATOM 31842 H1 WAT 5541 111.197 47.719 65.695 1.00 0.00 H ATOM 31843 H2 WAT 5541 111.241 46.206 65.691 1.00 0.00 H TER 31845 WAT 5541 ATOM 31845 O WAT 5542 85.119 123.471 95.690 1.00 0.00 O ATOM 31846 H1 WAT 5542 86.027 123.724 95.527 1.00 0.00 H ATOM 31847 H2 WAT 5542 84.698 124.275 95.995 1.00 0.00 H TER 31849 WAT 5542 ATOM 31849 O WAT 5543 42.284 24.180 79.248 1.00 0.00 O ATOM 31850 H1 WAT 5543 41.548 24.036 78.653 1.00 0.00 H ATOM 31851 H2 WAT 5543 42.351 25.132 79.320 1.00 0.00 H TER 31853 WAT 5543 ATOM 31853 O WAT 5544 21.993 70.737 80.380 1.00 0.00 O ATOM 31854 H1 WAT 5544 22.278 71.579 80.736 1.00 0.00 H ATOM 31855 H2 WAT 5544 22.037 70.135 81.123 1.00 0.00 H TER 31857 WAT 5544 ATOM 31857 O WAT 5545 94.874 60.234 88.023 1.00 0.00 O ATOM 31858 H1 WAT 5545 95.697 60.693 87.857 1.00 0.00 H ATOM 31859 H2 WAT 5545 95.089 59.308 87.917 1.00 0.00 H TER 31861 WAT 5545 ATOM 31861 O WAT 5546 38.216 81.942 73.633 1.00 0.00 O ATOM 31862 H1 WAT 5546 38.444 81.101 73.237 1.00 0.00 H ATOM 31863 H2 WAT 5546 38.522 81.871 74.537 1.00 0.00 H TER 31865 WAT 5546 ATOM 31865 O WAT 5547 116.346 48.112 61.927 1.00 0.00 O ATOM 31866 H1 WAT 5547 115.794 47.885 61.178 1.00 0.00 H ATOM 31867 H2 WAT 5547 116.578 49.029 61.784 1.00 0.00 H TER 31869 WAT 5547 ATOM 31869 O WAT 5548 6.192 22.925 97.611 1.00 0.00 O ATOM 31870 H1 WAT 5548 6.903 22.286 97.551 1.00 0.00 H ATOM 31871 H2 WAT 5548 5.445 22.491 97.200 1.00 0.00 H TER 31873 WAT 5548 ATOM 31873 O WAT 5549 42.899 39.936 104.742 1.00 0.00 O ATOM 31874 H1 WAT 5549 42.898 40.892 104.791 1.00 0.00 H ATOM 31875 H2 WAT 5549 43.718 39.719 104.297 1.00 0.00 H TER 31877 WAT 5549 ATOM 31877 O WAT 5550 27.993 50.080 158.337 1.00 0.00 O ATOM 31878 H1 WAT 5550 28.418 49.325 157.929 1.00 0.00 H ATOM 31879 H2 WAT 5550 27.106 49.779 158.532 1.00 0.00 H TER 31881 WAT 5550 ATOM 31881 O WAT 5551 33.085 11.049 157.007 1.00 0.00 O ATOM 31882 H1 WAT 5551 33.588 11.730 157.452 1.00 0.00 H ATOM 31883 H2 WAT 5551 33.573 10.243 157.173 1.00 0.00 H TER 31885 WAT 5551 ATOM 31885 O WAT 5552 1.423 46.375 106.687 1.00 0.00 O ATOM 31886 H1 WAT 5552 1.934 47.022 106.200 1.00 0.00 H ATOM 31887 H2 WAT 5552 0.671 46.191 106.124 1.00 0.00 H TER 31889 WAT 5552 ATOM 31889 O WAT 5553 45.073 32.287 125.060 1.00 0.00 O ATOM 31890 H1 WAT 5553 44.559 31.825 124.398 1.00 0.00 H ATOM 31891 H2 WAT 5553 44.426 32.774 125.570 1.00 0.00 H TER 31893 WAT 5553 ATOM 31893 O WAT 5554 39.339 131.467 101.109 1.00 0.00 O ATOM 31894 H1 WAT 5554 38.414 131.625 100.922 1.00 0.00 H ATOM 31895 H2 WAT 5554 39.805 132.090 100.551 1.00 0.00 H TER 31897 WAT 5554 ATOM 31897 O WAT 5555 24.374 41.115 110.344 1.00 0.00 O ATOM 31898 H1 WAT 5555 24.240 41.403 109.441 1.00 0.00 H ATOM 31899 H2 WAT 5555 24.192 40.176 110.326 1.00 0.00 H TER 31901 WAT 5555 ATOM 31901 O WAT 5556 22.741 27.273 111.777 1.00 0.00 O ATOM 31902 H1 WAT 5556 23.060 26.417 111.490 1.00 0.00 H ATOM 31903 H2 WAT 5556 21.975 27.440 111.226 1.00 0.00 H TER 31905 WAT 5556 ATOM 31905 O WAT 5557 56.933 39.092 132.253 1.00 0.00 O ATOM 31906 H1 WAT 5557 57.049 40.038 132.340 1.00 0.00 H ATOM 31907 H2 WAT 5557 57.595 38.715 132.832 1.00 0.00 H TER 31909 WAT 5557 ATOM 31909 O WAT 5558 103.045 95.675 124.115 1.00 0.00 O ATOM 31910 H1 WAT 5558 102.900 96.607 123.951 1.00 0.00 H ATOM 31911 H2 WAT 5558 103.991 95.560 124.023 1.00 0.00 H TER 31913 WAT 5558 ATOM 31913 O WAT 5559 44.028 93.629 124.388 1.00 0.00 O ATOM 31914 H1 WAT 5559 44.095 93.224 123.524 1.00 0.00 H ATOM 31915 H2 WAT 5559 43.232 93.256 124.767 1.00 0.00 H TER 31917 WAT 5559 ATOM 31917 O WAT 5560 75.321 44.594 5.974 1.00 0.00 O ATOM 31918 H1 WAT 5560 75.517 44.194 5.127 1.00 0.00 H ATOM 31919 H2 WAT 5560 76.175 44.694 6.395 1.00 0.00 H TER 31921 WAT 5560 ATOM 31921 O WAT 5561 35.486 125.004 83.466 1.00 0.00 O ATOM 31922 H1 WAT 5561 35.906 125.780 83.838 1.00 0.00 H ATOM 31923 H2 WAT 5561 34.566 125.251 83.373 1.00 0.00 H TER 31925 WAT 5561 ATOM 31925 O WAT 5562 117.782 139.876 145.349 1.00 0.00 O ATOM 31926 H1 WAT 5562 116.986 140.296 145.024 1.00 0.00 H ATOM 31927 H2 WAT 5562 117.724 139.955 146.301 1.00 0.00 H TER 31929 WAT 5562 ATOM 31929 O WAT 5563 63.910 109.368 63.593 1.00 0.00 O ATOM 31930 H1 WAT 5563 63.092 109.813 63.817 1.00 0.00 H ATOM 31931 H2 WAT 5563 64.043 108.740 64.303 1.00 0.00 H TER 31933 WAT 5563 ATOM 31933 O WAT 5564 46.785 85.625 118.777 1.00 0.00 O ATOM 31934 H1 WAT 5564 46.654 85.698 119.722 1.00 0.00 H ATOM 31935 H2 WAT 5564 46.623 84.701 118.584 1.00 0.00 H TER 31937 WAT 5564 ATOM 31937 O WAT 5565 11.368 31.843 132.375 1.00 0.00 O ATOM 31938 H1 WAT 5565 12.296 32.051 132.484 1.00 0.00 H ATOM 31939 H2 WAT 5565 11.073 32.419 131.671 1.00 0.00 H TER 31941 WAT 5565 ATOM 31941 O WAT 5566 115.177 0.747 62.073 1.00 0.00 O ATOM 31942 H1 WAT 5566 114.870 1.632 62.270 1.00 0.00 H ATOM 31943 H2 WAT 5566 115.557 0.436 62.894 1.00 0.00 H TER 31945 WAT 5566 ATOM 31945 O WAT 5567 131.531 118.221 110.712 1.00 0.00 O ATOM 31946 H1 WAT 5567 131.420 118.804 109.960 1.00 0.00 H ATOM 31947 H2 WAT 5567 130.640 117.960 110.946 1.00 0.00 H TER 31949 WAT 5567 ATOM 31949 O WAT 5568 3.422 25.662 85.143 1.00 0.00 O ATOM 31950 H1 WAT 5568 3.189 25.039 84.455 1.00 0.00 H ATOM 31951 H2 WAT 5568 4.350 25.501 85.308 1.00 0.00 H TER 31953 WAT 5568 ATOM 31953 O WAT 5569 37.188 50.162 109.388 1.00 0.00 O ATOM 31954 H1 WAT 5569 37.670 50.157 110.215 1.00 0.00 H ATOM 31955 H2 WAT 5569 37.564 49.437 108.887 1.00 0.00 H TER 31957 WAT 5569 ATOM 31957 O WAT 5570 32.761 59.414 16.761 1.00 0.00 O ATOM 31958 H1 WAT 5570 33.664 59.395 16.445 1.00 0.00 H ATOM 31959 H2 WAT 5570 32.789 58.945 17.595 1.00 0.00 H TER 31961 WAT 5570 ATOM 31961 O WAT 5571 78.721 93.142 107.674 1.00 0.00 O ATOM 31962 H1 WAT 5571 78.335 92.816 108.487 1.00 0.00 H ATOM 31963 H2 WAT 5571 78.199 92.736 106.982 1.00 0.00 H TER 31965 WAT 5571 ATOM 31965 O WAT 5572 129.224 12.085 78.768 1.00 0.00 O ATOM 31966 H1 WAT 5572 128.685 12.780 79.145 1.00 0.00 H ATOM 31967 H2 WAT 5572 128.626 11.601 78.198 1.00 0.00 H TER 31969 WAT 5572 ATOM 31969 O WAT 5573 24.493 111.741 65.682 1.00 0.00 O ATOM 31970 H1 WAT 5573 23.877 111.370 66.313 1.00 0.00 H ATOM 31971 H2 WAT 5573 24.161 112.622 65.512 1.00 0.00 H TER 31973 WAT 5573 ATOM 31973 O WAT 5574 27.716 144.242 88.300 1.00 0.00 O ATOM 31974 H1 WAT 5574 28.592 144.621 88.227 1.00 0.00 H ATOM 31975 H2 WAT 5574 27.123 144.985 88.193 1.00 0.00 H TER 31977 WAT 5574 ATOM 31977 O WAT 5575 27.476 101.873 146.676 1.00 0.00 O ATOM 31978 H1 WAT 5575 28.011 102.561 147.072 1.00 0.00 H ATOM 31979 H2 WAT 5575 28.008 101.081 146.753 1.00 0.00 H TER 31981 WAT 5575 ATOM 31981 O WAT 5576 118.345 112.662 155.619 1.00 0.00 O ATOM 31982 H1 WAT 5576 118.942 113.262 156.066 1.00 0.00 H ATOM 31983 H2 WAT 5576 118.912 112.137 155.054 1.00 0.00 H TER 31985 WAT 5576 ATOM 31985 O WAT 5577 8.700 112.869 142.654 1.00 0.00 O ATOM 31986 H1 WAT 5577 8.155 113.597 142.951 1.00 0.00 H ATOM 31987 H2 WAT 5577 9.126 112.549 143.449 1.00 0.00 H TER 31989 WAT 5577 ATOM 31989 O WAT 5578 104.654 42.581 105.767 1.00 0.00 O ATOM 31990 H1 WAT 5578 105.020 42.228 106.577 1.00 0.00 H ATOM 31991 H2 WAT 5578 105.244 42.268 105.081 1.00 0.00 H TER 31993 WAT 5578 ATOM 31993 O WAT 5579 65.043 86.505 87.371 1.00 0.00 O ATOM 31994 H1 WAT 5579 65.421 85.969 86.674 1.00 0.00 H ATOM 31995 H2 WAT 5579 64.775 87.313 86.934 1.00 0.00 H TER 31997 WAT 5579 ATOM 31997 O WAT 5580 123.839 23.460 8.949 1.00 0.00 O ATOM 31998 H1 WAT 5580 124.407 23.897 9.584 1.00 0.00 H ATOM 31999 H2 WAT 5580 123.230 22.950 9.483 1.00 0.00 H TER 32001 WAT 5580 ATOM 32001 O WAT 5581 51.777 124.643 79.652 1.00 0.00 O ATOM 32002 H1 WAT 5581 51.139 124.864 80.331 1.00 0.00 H ATOM 32003 H2 WAT 5581 51.570 123.740 79.413 1.00 0.00 H TER 32005 WAT 5581 ATOM 32005 O WAT 5582 136.362 76.121 67.455 1.00 0.00 O ATOM 32006 H1 WAT 5582 136.625 76.488 68.300 1.00 0.00 H ATOM 32007 H2 WAT 5582 136.516 76.829 66.829 1.00 0.00 H TER 32009 WAT 5582 ATOM 32009 O WAT 5583 40.770 103.655 109.010 1.00 0.00 O ATOM 32010 H1 WAT 5583 40.874 104.606 109.035 1.00 0.00 H ATOM 32011 H2 WAT 5583 39.826 103.515 109.082 1.00 0.00 H TER 32013 WAT 5583 ATOM 32013 O WAT 5584 33.185 143.987 59.042 1.00 0.00 O ATOM 32014 H1 WAT 5584 33.400 144.908 58.897 1.00 0.00 H ATOM 32015 H2 WAT 5584 32.864 143.955 59.944 1.00 0.00 H TER 32017 WAT 5584 ATOM 32017 O WAT 5585 136.665 117.079 79.102 1.00 0.00 O ATOM 32018 H1 WAT 5585 137.378 117.235 78.483 1.00 0.00 H ATOM 32019 H2 WAT 5585 136.953 117.501 79.911 1.00 0.00 H TER 32021 WAT 5585 ATOM 32021 O WAT 5586 89.847 33.235 130.544 1.00 0.00 O ATOM 32022 H1 WAT 5586 89.370 32.858 129.805 1.00 0.00 H ATOM 32023 H2 WAT 5586 89.612 32.681 131.288 1.00 0.00 H TER 32025 WAT 5586 ATOM 32025 O WAT 5587 78.634 43.476 137.984 1.00 0.00 O ATOM 32026 H1 WAT 5587 78.062 44.169 137.654 1.00 0.00 H ATOM 32027 H2 WAT 5587 79.002 43.073 137.197 1.00 0.00 H TER 32029 WAT 5587 ATOM 32029 O WAT 5588 42.095 13.886 132.049 1.00 0.00 O ATOM 32030 H1 WAT 5588 42.088 12.937 132.174 1.00 0.00 H ATOM 32031 H2 WAT 5588 41.265 14.076 131.612 1.00 0.00 H TER 32033 WAT 5588 ATOM 32033 O WAT 5589 19.531 81.259 81.006 1.00 0.00 O ATOM 32034 H1 WAT 5589 18.970 81.308 80.232 1.00 0.00 H ATOM 32035 H2 WAT 5589 19.093 81.809 81.655 1.00 0.00 H TER 32037 WAT 5589 ATOM 32037 O WAT 5590 56.638 43.911 65.421 1.00 0.00 O ATOM 32038 H1 WAT 5590 55.826 44.187 64.995 1.00 0.00 H ATOM 32039 H2 WAT 5590 56.355 43.304 66.105 1.00 0.00 H TER 32041 WAT 5590 ATOM 32041 O WAT 5591 28.180 133.223 143.783 1.00 0.00 O ATOM 32042 H1 WAT 5591 27.979 132.931 142.894 1.00 0.00 H ATOM 32043 H2 WAT 5591 27.326 133.405 144.174 1.00 0.00 H TER 32045 WAT 5591 ATOM 32045 O WAT 5592 16.111 3.350 99.105 1.00 0.00 O ATOM 32046 H1 WAT 5592 16.338 3.988 99.781 1.00 0.00 H ATOM 32047 H2 WAT 5592 15.219 3.078 99.321 1.00 0.00 H TER 32049 WAT 5592 ATOM 32049 O WAT 5593 8.285 127.507 53.935 1.00 0.00 O ATOM 32050 H1 WAT 5593 7.479 127.951 54.198 1.00 0.00 H ATOM 32051 H2 WAT 5593 8.869 128.214 53.660 1.00 0.00 H TER 32053 WAT 5593 ATOM 32053 O WAT 5594 137.378 38.931 69.546 1.00 0.00 O ATOM 32054 H1 WAT 5594 137.157 39.681 70.098 1.00 0.00 H ATOM 32055 H2 WAT 5594 137.037 38.174 70.022 1.00 0.00 H TER 32057 WAT 5594 ATOM 32057 O WAT 5595 139.905 73.831 131.803 1.00 0.00 O ATOM 32058 H1 WAT 5595 140.727 73.367 131.641 1.00 0.00 H ATOM 32059 H2 WAT 5595 139.480 73.330 132.499 1.00 0.00 H TER 32061 WAT 5595 ATOM 32061 O WAT 5596 58.952 18.639 7.948 1.00 0.00 O ATOM 32062 H1 WAT 5596 58.476 17.809 7.960 1.00 0.00 H ATOM 32063 H2 WAT 5596 58.607 19.124 8.697 1.00 0.00 H TER 32065 WAT 5596 ATOM 32065 O WAT 5597 85.587 84.201 62.353 1.00 0.00 O ATOM 32066 H1 WAT 5597 85.402 83.922 63.249 1.00 0.00 H ATOM 32067 H2 WAT 5597 86.030 85.043 62.450 1.00 0.00 H TER 32069 WAT 5597 ATOM 32069 O WAT 5598 30.659 91.985 67.205 1.00 0.00 O ATOM 32070 H1 WAT 5598 31.433 91.584 66.811 1.00 0.00 H ATOM 32071 H2 WAT 5598 30.697 91.726 68.126 1.00 0.00 H TER 32073 WAT 5598 ATOM 32073 O WAT 5599 130.711 1.946 156.545 1.00 0.00 O ATOM 32074 H1 WAT 5599 130.210 1.234 156.149 1.00 0.00 H ATOM 32075 H2 WAT 5599 131.461 1.514 156.953 1.00 0.00 H TER 32077 WAT 5599 ATOM 32077 O WAT 5600 86.448 46.321 60.126 1.00 0.00 O ATOM 32078 H1 WAT 5600 86.404 46.202 59.178 1.00 0.00 H ATOM 32079 H2 WAT 5600 86.986 47.104 60.245 1.00 0.00 H TER 32081 WAT 5600 ATOM 32081 O WAT 5601 35.567 117.194 90.196 1.00 0.00 O ATOM 32082 H1 WAT 5601 36.252 116.623 89.848 1.00 0.00 H ATOM 32083 H2 WAT 5601 35.490 116.943 91.116 1.00 0.00 H TER 32085 WAT 5601 ATOM 32085 O WAT 5602 145.296 96.505 89.272 1.00 0.00 O ATOM 32086 H1 WAT 5602 144.598 96.826 88.701 1.00 0.00 H ATOM 32087 H2 WAT 5602 145.622 97.287 89.716 1.00 0.00 H TER 32089 WAT 5602 ATOM 32089 O WAT 5603 133.773 65.262 17.324 1.00 0.00 O ATOM 32090 H1 WAT 5603 134.023 64.721 18.073 1.00 0.00 H ATOM 32091 H2 WAT 5603 133.733 66.152 17.674 1.00 0.00 H TER 32093 WAT 5603 ATOM 32093 O WAT 5604 129.715 68.457 66.134 1.00 0.00 O ATOM 32094 H1 WAT 5604 129.441 69.328 65.849 1.00 0.00 H ATOM 32095 H2 WAT 5604 128.970 67.892 65.927 1.00 0.00 H TER 32097 WAT 5604 ATOM 32097 O WAT 5605 99.383 59.307 61.864 1.00 0.00 O ATOM 32098 H1 WAT 5605 98.685 59.301 61.208 1.00 0.00 H ATOM 32099 H2 WAT 5605 100.192 59.309 61.353 1.00 0.00 H TER 32101 WAT 5605 ATOM 32101 O WAT 5606 110.670 107.974 121.508 1.00 0.00 O ATOM 32102 H1 WAT 5606 110.134 107.208 121.715 1.00 0.00 H ATOM 32103 H2 WAT 5606 110.846 107.897 120.571 1.00 0.00 H TER 32105 WAT 5606 ATOM 32105 O WAT 5607 64.230 14.107 75.329 1.00 0.00 O ATOM 32106 H1 WAT 5607 64.968 13.901 74.755 1.00 0.00 H ATOM 32107 H2 WAT 5607 64.264 15.059 75.430 1.00 0.00 H TER 32109 WAT 5607 ATOM 32109 O WAT 5608 131.320 145.032 108.694 1.00 0.00 O ATOM 32110 H1 WAT 5608 131.061 145.952 108.636 1.00 0.00 H ATOM 32111 H2 WAT 5608 132.144 144.984 108.209 1.00 0.00 H TER 32113 WAT 5608 ATOM 32113 O WAT 5609 138.608 119.035 134.956 1.00 0.00 O ATOM 32114 H1 WAT 5609 138.165 119.031 134.108 1.00 0.00 H ATOM 32115 H2 WAT 5609 138.702 118.110 135.182 1.00 0.00 H TER 32117 WAT 5609 ATOM 32117 O WAT 5610 114.693 70.576 91.002 1.00 0.00 O ATOM 32118 H1 WAT 5610 115.024 69.681 90.918 1.00 0.00 H ATOM 32119 H2 WAT 5610 114.632 70.894 90.101 1.00 0.00 H TER 32121 WAT 5610 ATOM 32121 O WAT 5611 15.724 45.031 106.449 1.00 0.00 O ATOM 32122 H1 WAT 5611 16.290 45.093 107.219 1.00 0.00 H ATOM 32123 H2 WAT 5611 14.836 45.084 106.801 1.00 0.00 H TER 32125 WAT 5611 ATOM 32125 O WAT 5612 100.410 66.357 92.365 1.00 0.00 O ATOM 32126 H1 WAT 5612 99.910 65.722 92.877 1.00 0.00 H ATOM 32127 H2 WAT 5612 100.848 65.833 91.694 1.00 0.00 H TER 32129 WAT 5612 ATOM 32129 O WAT 5613 50.923 124.936 143.180 1.00 0.00 O ATOM 32130 H1 WAT 5613 50.369 124.858 143.957 1.00 0.00 H ATOM 32131 H2 WAT 5613 50.613 124.245 142.594 1.00 0.00 H TER 32133 WAT 5613 ATOM 32133 O WAT 5614 88.578 47.776 80.093 1.00 0.00 O ATOM 32134 H1 WAT 5614 88.274 46.888 80.277 1.00 0.00 H ATOM 32135 H2 WAT 5614 88.125 48.021 79.286 1.00 0.00 H TER 32137 WAT 5614 ATOM 32137 O WAT 5615 102.138 88.465 139.707 1.00 0.00 O ATOM 32138 H1 WAT 5615 102.838 88.928 140.167 1.00 0.00 H ATOM 32139 H2 WAT 5615 102.472 87.574 139.596 1.00 0.00 H TER 32141 WAT 5615 ATOM 32141 O WAT 5616 58.000 70.854 136.766 1.00 0.00 O ATOM 32142 H1 WAT 5616 57.881 70.383 135.942 1.00 0.00 H ATOM 32143 H2 WAT 5616 58.251 71.739 136.502 1.00 0.00 H TER 32145 WAT 5616 ATOM 32145 O WAT 5617 70.946 5.352 12.416 1.00 0.00 O ATOM 32146 H1 WAT 5617 71.349 6.064 12.912 1.00 0.00 H ATOM 32147 H2 WAT 5617 71.290 4.555 12.819 1.00 0.00 H TER 32149 WAT 5617 ATOM 32149 O WAT 5618 14.233 93.773 7.376 1.00 0.00 O ATOM 32150 H1 WAT 5618 14.578 94.621 7.658 1.00 0.00 H ATOM 32151 H2 WAT 5618 14.755 93.547 6.606 1.00 0.00 H TER 32153 WAT 5618 ATOM 32153 O WAT 5619 63.902 130.937 0.610 1.00 0.00 O ATOM 32154 H1 WAT 5619 63.197 130.773 1.236 1.00 0.00 H ATOM 32155 H2 WAT 5619 63.552 131.613 0.028 1.00 0.00 H TER 32157 WAT 5619 ATOM 32157 O WAT 5620 127.710 122.684 56.894 1.00 0.00 O ATOM 32158 H1 WAT 5620 127.556 121.758 56.708 1.00 0.00 H ATOM 32159 H2 WAT 5620 127.146 122.875 57.643 1.00 0.00 H TER 32161 WAT 5620 ATOM 32161 O WAT 5621 72.655 22.219 119.988 1.00 0.00 O ATOM 32162 H1 WAT 5621 71.811 21.827 120.213 1.00 0.00 H ATOM 32163 H2 WAT 5621 72.546 22.523 119.087 1.00 0.00 H TER 32165 WAT 5621 ATOM 32165 O WAT 5622 93.495 54.940 2.165 1.00 0.00 O ATOM 32166 H1 WAT 5622 93.970 55.139 1.359 1.00 0.00 H ATOM 32167 H2 WAT 5622 94.178 54.701 2.792 1.00 0.00 H TER 32169 WAT 5622 ATOM 32169 O WAT 5623 140.864 123.039 16.603 1.00 0.00 O ATOM 32170 H1 WAT 5623 140.510 122.245 16.203 1.00 0.00 H ATOM 32171 H2 WAT 5623 140.501 123.043 17.489 1.00 0.00 H TER 32173 WAT 5623 ATOM 32173 O WAT 5624 30.852 116.317 144.721 1.00 0.00 O ATOM 32174 H1 WAT 5624 30.738 116.450 143.780 1.00 0.00 H ATOM 32175 H2 WAT 5624 30.420 115.481 144.898 1.00 0.00 H TER 32177 WAT 5624 ATOM 32177 O WAT 5625 43.015 78.333 72.780 1.00 0.00 O ATOM 32178 H1 WAT 5625 42.317 78.654 72.209 1.00 0.00 H ATOM 32179 H2 WAT 5625 42.845 77.394 72.861 1.00 0.00 H TER 32181 WAT 5625 ATOM 32181 O WAT 5626 24.128 122.410 69.001 1.00 0.00 O ATOM 32182 H1 WAT 5626 23.471 121.971 68.461 1.00 0.00 H ATOM 32183 H2 WAT 5626 24.958 122.013 68.736 1.00 0.00 H TER 32185 WAT 5626 ATOM 32185 O WAT 5627 73.529 145.547 65.438 1.00 0.00 O ATOM 32186 H1 WAT 5627 73.469 145.706 66.380 1.00 0.00 H ATOM 32187 H2 WAT 5627 72.622 145.573 65.132 1.00 0.00 H TER 32189 WAT 5627 ATOM 32189 O WAT 5628 92.538 44.151 24.960 1.00 0.00 O ATOM 32190 H1 WAT 5628 91.894 44.153 25.668 1.00 0.00 H ATOM 32191 H2 WAT 5628 92.059 44.479 24.199 1.00 0.00 H TER 32193 WAT 5628 ATOM 32193 O WAT 5629 97.714 0.466 103.893 1.00 0.00 O ATOM 32194 H1 WAT 5629 97.987 -0.024 104.670 1.00 0.00 H ATOM 32195 H2 WAT 5629 98.000 1.363 104.063 1.00 0.00 H TER 32197 WAT 5629 ATOM 32197 O WAT 5630 80.527 75.266 97.239 1.00 0.00 O ATOM 32198 H1 WAT 5630 81.444 75.075 97.041 1.00 0.00 H ATOM 32199 H2 WAT 5630 80.547 75.652 98.115 1.00 0.00 H TER 32201 WAT 5630 ATOM 32201 O WAT 5631 124.245 12.917 86.162 1.00 0.00 O ATOM 32202 H1 WAT 5631 124.332 12.874 87.114 1.00 0.00 H ATOM 32203 H2 WAT 5631 123.476 12.383 85.966 1.00 0.00 H TER 32205 WAT 5631 ATOM 32205 O WAT 5632 98.725 71.188 117.156 1.00 0.00 O ATOM 32206 H1 WAT 5632 98.872 70.274 116.914 1.00 0.00 H ATOM 32207 H2 WAT 5632 98.219 71.550 116.429 1.00 0.00 H TER 32209 WAT 5632 ATOM 32209 O WAT 5633 7.395 126.471 111.308 1.00 0.00 O ATOM 32210 H1 WAT 5633 6.514 126.130 111.152 1.00 0.00 H ATOM 32211 H2 WAT 5633 7.978 125.804 110.944 1.00 0.00 H TER 32213 WAT 5633 ATOM 32213 O WAT 5634 30.590 41.005 99.418 1.00 0.00 O ATOM 32214 H1 WAT 5634 30.297 41.431 100.224 1.00 0.00 H ATOM 32215 H2 WAT 5634 30.481 40.070 99.588 1.00 0.00 H TER 32217 WAT 5634 ATOM 32217 O WAT 5635 48.132 30.080 145.102 1.00 0.00 O ATOM 32218 H1 WAT 5635 48.323 29.145 145.027 1.00 0.00 H ATOM 32219 H2 WAT 5635 48.584 30.353 145.901 1.00 0.00 H TER 32221 WAT 5635 ATOM 32221 O WAT 5636 124.327 61.020 123.779 1.00 0.00 O ATOM 32222 H1 WAT 5636 123.714 61.518 123.239 1.00 0.00 H ATOM 32223 H2 WAT 5636 123.864 60.883 124.605 1.00 0.00 H TER 32225 WAT 5636 ATOM 32225 O WAT 5637 130.918 15.447 104.634 1.00 0.00 O ATOM 32226 H1 WAT 5637 130.214 14.801 104.696 1.00 0.00 H ATOM 32227 H2 WAT 5637 131.109 15.682 105.542 1.00 0.00 H TER 32229 WAT 5637 ATOM 32229 O WAT 5638 70.442 26.975 74.656 1.00 0.00 O ATOM 32230 H1 WAT 5638 70.497 26.026 74.764 1.00 0.00 H ATOM 32231 H2 WAT 5638 70.807 27.330 75.467 1.00 0.00 H TER 32233 WAT 5638 ATOM 32233 O WAT 5639 71.196 94.324 13.942 1.00 0.00 O ATOM 32234 H1 WAT 5639 70.757 93.557 14.308 1.00 0.00 H ATOM 32235 H2 WAT 5639 70.811 95.066 14.408 1.00 0.00 H TER 32237 WAT 5639 ATOM 32237 O WAT 5640 9.723 98.112 153.349 1.00 0.00 O ATOM 32238 H1 WAT 5640 8.849 98.436 153.131 1.00 0.00 H ATOM 32239 H2 WAT 5640 10.136 97.948 152.501 1.00 0.00 H TER 32241 WAT 5640 ATOM 32241 O WAT 5641 88.514 56.759 79.892 1.00 0.00 O ATOM 32242 H1 WAT 5641 87.984 57.346 80.431 1.00 0.00 H ATOM 32243 H2 WAT 5641 89.411 56.897 80.198 1.00 0.00 H TER 32245 WAT 5641 ATOM 32245 O WAT 5642 111.594 137.183 82.012 1.00 0.00 O ATOM 32246 H1 WAT 5642 111.080 136.635 81.420 1.00 0.00 H ATOM 32247 H2 WAT 5642 111.097 137.999 82.077 1.00 0.00 H TER 32249 WAT 5642 ATOM 32249 O WAT 5643 77.804 138.316 123.739 1.00 0.00 O ATOM 32250 H1 WAT 5643 78.466 138.197 123.058 1.00 0.00 H ATOM 32251 H2 WAT 5643 78.176 138.978 124.322 1.00 0.00 H TER 32253 WAT 5643 ATOM 32253 O WAT 5644 64.575 3.656 97.576 1.00 0.00 O ATOM 32254 H1 WAT 5644 65.126 3.864 96.822 1.00 0.00 H ATOM 32255 H2 WAT 5644 65.130 3.835 98.335 1.00 0.00 H TER 32257 WAT 5644 ATOM 32257 O WAT 5645 90.459 95.318 108.076 1.00 0.00 O ATOM 32258 H1 WAT 5645 90.711 96.216 108.295 1.00 0.00 H ATOM 32259 H2 WAT 5645 91.146 95.015 107.482 1.00 0.00 H TER 32261 WAT 5645 ATOM 32261 O WAT 5646 88.322 97.437 123.110 1.00 0.00 O ATOM 32262 H1 WAT 5646 88.789 97.098 123.874 1.00 0.00 H ATOM 32263 H2 WAT 5646 87.402 97.442 123.375 1.00 0.00 H TER 32265 WAT 5646 ATOM 32265 O WAT 5647 46.269 61.620 157.994 1.00 0.00 O ATOM 32266 H1 WAT 5647 46.321 61.897 158.909 1.00 0.00 H ATOM 32267 H2 WAT 5647 45.982 62.402 157.523 1.00 0.00 H TER 32269 WAT 5647 ATOM 32269 O WAT 5648 78.493 94.997 66.352 1.00 0.00 O ATOM 32270 H1 WAT 5648 78.922 94.465 67.022 1.00 0.00 H ATOM 32271 H2 WAT 5648 78.048 94.362 65.791 1.00 0.00 H TER 32273 WAT 5648 ATOM 32273 O WAT 5649 96.874 5.319 84.812 1.00 0.00 O ATOM 32274 H1 WAT 5649 96.202 4.680 85.047 1.00 0.00 H ATOM 32275 H2 WAT 5649 96.667 6.090 85.341 1.00 0.00 H TER 32277 WAT 5649 ATOM 32277 O WAT 5650 95.973 133.654 87.505 1.00 0.00 O ATOM 32278 H1 WAT 5650 95.625 132.827 87.838 1.00 0.00 H ATOM 32279 H2 WAT 5650 95.380 133.893 86.793 1.00 0.00 H TER 32281 WAT 5650 ATOM 32281 O WAT 5651 71.171 36.643 63.451 1.00 0.00 O ATOM 32282 H1 WAT 5651 71.906 37.119 63.837 1.00 0.00 H ATOM 32283 H2 WAT 5651 70.484 37.302 63.350 1.00 0.00 H TER 32285 WAT 5651 ATOM 32285 O WAT 5652 66.628 116.293 157.911 1.00 0.00 O ATOM 32286 H1 WAT 5652 66.636 116.585 156.999 1.00 0.00 H ATOM 32287 H2 WAT 5652 65.828 115.774 157.989 1.00 0.00 H TER 32289 WAT 5652 ATOM 32289 O WAT 5653 35.839 34.895 14.919 1.00 0.00 O ATOM 32290 H1 WAT 5653 35.205 34.431 15.465 1.00 0.00 H ATOM 32291 H2 WAT 5653 36.507 34.239 14.718 1.00 0.00 H TER 32293 WAT 5653 ATOM 32293 O WAT 5654 27.968 82.072 74.434 1.00 0.00 O ATOM 32294 H1 WAT 5654 27.160 82.530 74.202 1.00 0.00 H ATOM 32295 H2 WAT 5654 28.021 81.349 73.809 1.00 0.00 H TER 32297 WAT 5654 ATOM 32297 O WAT 5655 134.144 123.224 110.109 1.00 0.00 O ATOM 32298 H1 WAT 5655 134.761 122.774 110.687 1.00 0.00 H ATOM 32299 H2 WAT 5655 133.370 123.372 110.653 1.00 0.00 H TER 32301 WAT 5655 ATOM 32301 O WAT 5656 114.768 101.620 72.025 1.00 0.00 O ATOM 32302 H1 WAT 5656 114.912 102.566 72.026 1.00 0.00 H ATOM 32303 H2 WAT 5656 114.652 101.396 71.102 1.00 0.00 H TER 32305 WAT 5656 ATOM 32305 O WAT 5657 52.864 62.556 68.143 1.00 0.00 O ATOM 32306 H1 WAT 5657 52.837 61.870 68.810 1.00 0.00 H ATOM 32307 H2 WAT 5657 51.957 62.851 68.066 1.00 0.00 H TER 32309 WAT 5657 ATOM 32309 O WAT 5658 34.465 15.532 2.924 1.00 0.00 O ATOM 32310 H1 WAT 5658 33.700 15.803 3.432 1.00 0.00 H ATOM 32311 H2 WAT 5658 34.372 15.990 2.089 1.00 0.00 H TER 32313 WAT 5658 ATOM 32313 O WAT 5659 22.390 31.206 105.175 1.00 0.00 O ATOM 32314 H1 WAT 5659 23.328 31.131 104.999 1.00 0.00 H ATOM 32315 H2 WAT 5659 22.055 30.315 105.069 1.00 0.00 H TER 32317 WAT 5659 ATOM 32317 O WAT 5660 110.040 27.316 144.061 1.00 0.00 O ATOM 32318 H1 WAT 5660 110.954 27.307 143.776 1.00 0.00 H ATOM 32319 H2 WAT 5660 109.990 26.628 144.724 1.00 0.00 H TER 32321 WAT 5660 ATOM 32321 O WAT 5661 29.992 77.791 72.984 1.00 0.00 O ATOM 32322 H1 WAT 5661 29.634 78.661 72.805 1.00 0.00 H ATOM 32323 H2 WAT 5661 30.514 77.905 73.777 1.00 0.00 H TER 32325 WAT 5661 ATOM 32325 O WAT 5662 38.314 58.355 113.234 1.00 0.00 O ATOM 32326 H1 WAT 5662 39.155 57.898 113.249 1.00 0.00 H ATOM 32327 H2 WAT 5662 37.700 57.716 112.873 1.00 0.00 H TER 32329 WAT 5662 ATOM 32329 O WAT 5663 59.998 107.661 95.042 1.00 0.00 O ATOM 32330 H1 WAT 5663 59.404 108.173 95.590 1.00 0.00 H ATOM 32331 H2 WAT 5663 59.850 107.992 94.155 1.00 0.00 H TER 32333 WAT 5663 ATOM 32333 O WAT 5664 30.654 141.909 61.929 1.00 0.00 O ATOM 32334 H1 WAT 5664 29.962 141.711 62.561 1.00 0.00 H ATOM 32335 H2 WAT 5664 30.234 142.479 61.286 1.00 0.00 H TER 32337 WAT 5664 ATOM 32337 O WAT 5665 134.081 131.357 90.716 1.00 0.00 O ATOM 32338 H1 WAT 5665 133.262 131.852 90.755 1.00 0.00 H ATOM 32339 H2 WAT 5665 134.622 131.837 90.090 1.00 0.00 H TER 32341 WAT 5665 ATOM 32341 O WAT 5666 117.463 39.240 140.116 1.00 0.00 O ATOM 32342 H1 WAT 5666 118.290 39.297 140.596 1.00 0.00 H ATOM 32343 H2 WAT 5666 117.696 39.450 139.212 1.00 0.00 H TER 32345 WAT 5666 ATOM 32345 O WAT 5667 68.631 34.001 54.837 1.00 0.00 O ATOM 32346 H1 WAT 5667 68.126 33.955 55.648 1.00 0.00 H ATOM 32347 H2 WAT 5667 69.071 34.850 54.876 1.00 0.00 H TER 32349 WAT 5667 ATOM 32349 O WAT 5668 144.143 66.723 92.615 1.00 0.00 O ATOM 32350 H1 WAT 5668 144.328 66.501 91.702 1.00 0.00 H ATOM 32351 H2 WAT 5668 143.263 66.381 92.771 1.00 0.00 H TER 32353 WAT 5668 ATOM 32353 O WAT 5669 123.700 141.570 158.992 1.00 0.00 O ATOM 32354 H1 WAT 5669 122.969 141.799 158.418 1.00 0.00 H ATOM 32355 H2 WAT 5669 124.410 141.335 158.395 1.00 0.00 H TER 32357 WAT 5669 ATOM 32357 O WAT 5670 84.668 107.625 141.571 1.00 0.00 O ATOM 32358 H1 WAT 5670 84.198 108.357 141.172 1.00 0.00 H ATOM 32359 H2 WAT 5670 85.107 107.194 140.838 1.00 0.00 H TER 32361 WAT 5670 ATOM 32361 O WAT 5671 87.470 88.146 103.971 1.00 0.00 O ATOM 32362 H1 WAT 5671 88.010 87.864 104.709 1.00 0.00 H ATOM 32363 H2 WAT 5671 86.814 87.456 103.877 1.00 0.00 H TER 32365 WAT 5671 ATOM 32365 O WAT 5672 64.043 5.876 78.409 1.00 0.00 O ATOM 32366 H1 WAT 5672 64.100 6.463 77.655 1.00 0.00 H ATOM 32367 H2 WAT 5672 63.440 6.314 79.009 1.00 0.00 H TER 32369 WAT 5672 ATOM 32369 O WAT 5673 109.341 99.243 80.916 1.00 0.00 O ATOM 32370 H1 WAT 5673 108.413 99.397 81.094 1.00 0.00 H ATOM 32371 H2 WAT 5673 109.501 98.353 81.232 1.00 0.00 H TER 32373 WAT 5673 ATOM 32373 O WAT 5674 41.303 4.939 149.515 1.00 0.00 O ATOM 32374 H1 WAT 5674 41.657 5.210 148.668 1.00 0.00 H ATOM 32375 H2 WAT 5674 42.063 4.915 150.096 1.00 0.00 H TER 32377 WAT 5674 ATOM 32377 O WAT 5675 92.940 25.595 65.998 1.00 0.00 O ATOM 32378 H1 WAT 5675 93.051 25.419 65.064 1.00 0.00 H ATOM 32379 H2 WAT 5675 93.787 25.378 66.386 1.00 0.00 H TER 32381 WAT 5675 ATOM 32381 O WAT 5676 21.116 130.384 85.059 1.00 0.00 O ATOM 32382 H1 WAT 5676 21.762 130.546 84.370 1.00 0.00 H ATOM 32383 H2 WAT 5676 20.723 129.543 84.826 1.00 0.00 H TER 32385 WAT 5676 ATOM 32385 O WAT 5677 47.094 26.662 147.514 1.00 0.00 O ATOM 32386 H1 WAT 5677 47.334 25.987 148.148 1.00 0.00 H ATOM 32387 H2 WAT 5677 47.799 26.645 146.867 1.00 0.00 H TER 32389 WAT 5677 ATOM 32389 O WAT 5678 62.157 82.300 26.392 1.00 0.00 O ATOM 32390 H1 WAT 5678 61.474 82.959 26.516 1.00 0.00 H ATOM 32391 H2 WAT 5678 62.397 82.375 25.468 1.00 0.00 H TER 32393 WAT 5678 ATOM 32393 O WAT 5679 49.868 46.199 106.321 1.00 0.00 O ATOM 32394 H1 WAT 5679 49.148 46.169 105.691 1.00 0.00 H ATOM 32395 H2 WAT 5679 50.078 45.280 106.488 1.00 0.00 H TER 32397 WAT 5679 ATOM 32397 O WAT 5680 10.111 38.763 121.662 1.00 0.00 O ATOM 32398 H1 WAT 5680 11.002 38.413 121.638 1.00 0.00 H ATOM 32399 H2 WAT 5680 10.026 39.258 120.848 1.00 0.00 H TER 32401 WAT 5680 ATOM 32401 O WAT 5681 90.100 107.085 110.474 1.00 0.00 O ATOM 32402 H1 WAT 5681 89.924 106.694 111.330 1.00 0.00 H ATOM 32403 H2 WAT 5681 91.030 107.312 110.502 1.00 0.00 H TER 32405 WAT 5681 ATOM 32405 O WAT 5682 58.050 90.220 17.699 1.00 0.00 O ATOM 32406 H1 WAT 5682 57.293 90.692 17.353 1.00 0.00 H ATOM 32407 H2 WAT 5682 57.810 90.011 18.602 1.00 0.00 H TER 32409 WAT 5682 ATOM 32409 O WAT 5683 133.396 143.922 152.957 1.00 0.00 O ATOM 32410 H1 WAT 5683 134.183 143.976 153.500 1.00 0.00 H ATOM 32411 H2 WAT 5683 132.989 143.092 153.208 1.00 0.00 H TER 32413 WAT 5683 ATOM 32413 O WAT 5684 140.571 29.756 101.869 1.00 0.00 O ATOM 32414 H1 WAT 5684 141.494 29.859 101.634 1.00 0.00 H ATOM 32415 H2 WAT 5684 140.205 30.637 101.793 1.00 0.00 H TER 32417 WAT 5684 ATOM 32417 O WAT 5685 65.715 1.577 64.544 1.00 0.00 O ATOM 32418 H1 WAT 5685 65.896 2.510 64.659 1.00 0.00 H ATOM 32419 H2 WAT 5685 65.973 1.393 63.641 1.00 0.00 H TER 32421 WAT 5685 ATOM 32421 O WAT 5686 86.337 57.505 57.888 1.00 0.00 O ATOM 32422 H1 WAT 5686 85.819 57.150 58.610 1.00 0.00 H ATOM 32423 H2 WAT 5686 85.723 58.052 57.398 1.00 0.00 H TER 32425 WAT 5686 ATOM 32425 O WAT 5687 31.547 13.179 85.693 1.00 0.00 O ATOM 32426 H1 WAT 5687 30.688 12.972 85.326 1.00 0.00 H ATOM 32427 H2 WAT 5687 31.499 14.111 85.905 1.00 0.00 H TER 32429 WAT 5687 ATOM 32429 O WAT 5688 17.080 94.862 79.055 1.00 0.00 O ATOM 32430 H1 WAT 5688 17.434 94.936 79.941 1.00 0.00 H ATOM 32431 H2 WAT 5688 16.182 95.185 79.127 1.00 0.00 H TER 32433 WAT 5688 ATOM 32433 O WAT 5689 124.529 98.253 9.773 1.00 0.00 O ATOM 32434 H1 WAT 5689 124.662 99.095 10.208 1.00 0.00 H ATOM 32435 H2 WAT 5689 124.992 98.338 8.940 1.00 0.00 H TER 32437 WAT 5689 ATOM 32437 O WAT 5690 51.743 61.546 79.702 1.00 0.00 O ATOM 32438 H1 WAT 5690 52.093 61.217 80.530 1.00 0.00 H ATOM 32439 H2 WAT 5690 51.817 62.498 79.772 1.00 0.00 H TER 32441 WAT 5690 ATOM 32441 O WAT 5691 26.594 3.308 74.751 1.00 0.00 O ATOM 32442 H1 WAT 5691 27.411 3.182 74.268 1.00 0.00 H ATOM 32443 H2 WAT 5691 26.786 2.988 75.632 1.00 0.00 H TER 32445 WAT 5691 ATOM 32445 O WAT 5692 132.678 118.920 138.001 1.00 0.00 O ATOM 32446 H1 WAT 5692 132.499 119.336 138.844 1.00 0.00 H ATOM 32447 H2 WAT 5692 133.507 118.458 138.134 1.00 0.00 H TER 32449 WAT 5692 ATOM 32449 O WAT 5693 64.182 106.665 119.323 1.00 0.00 O ATOM 32450 H1 WAT 5693 64.745 106.823 118.565 1.00 0.00 H ATOM 32451 H2 WAT 5693 63.892 107.536 119.591 1.00 0.00 H TER 32453 WAT 5693 ATOM 32453 O WAT 5694 33.190 93.506 136.149 1.00 0.00 O ATOM 32454 H1 WAT 5694 33.069 93.734 137.071 1.00 0.00 H ATOM 32455 H2 WAT 5694 32.325 93.622 135.758 1.00 0.00 H TER 32457 WAT 5694 ATOM 32457 O WAT 5695 137.806 31.821 122.181 1.00 0.00 O ATOM 32458 H1 WAT 5695 138.570 31.577 121.659 1.00 0.00 H ATOM 32459 H2 WAT 5695 137.295 32.392 121.606 1.00 0.00 H TER 32461 WAT 5695 ATOM 32461 O WAT 5696 86.272 127.100 13.527 1.00 0.00 O ATOM 32462 H1 WAT 5696 86.906 127.732 13.867 1.00 0.00 H ATOM 32463 H2 WAT 5696 85.783 126.813 14.298 1.00 0.00 H TER 32465 WAT 5696 ATOM 32465 O WAT 5697 97.229 112.728 116.808 1.00 0.00 O ATOM 32466 H1 WAT 5697 96.618 112.248 117.367 1.00 0.00 H ATOM 32467 H2 WAT 5697 96.669 113.210 116.200 1.00 0.00 H TER 32469 WAT 5697 ATOM 32469 O WAT 5698 138.574 104.059 94.945 1.00 0.00 O ATOM 32470 H1 WAT 5698 137.982 103.541 94.400 1.00 0.00 H ATOM 32471 H2 WAT 5698 138.413 104.965 94.680 1.00 0.00 H TER 32473 WAT 5698 ATOM 32473 O WAT 5699 137.356 67.510 127.708 1.00 0.00 O ATOM 32474 H1 WAT 5699 137.630 68.410 127.529 1.00 0.00 H ATOM 32475 H2 WAT 5699 136.495 67.435 127.296 1.00 0.00 H TER 32477 WAT 5699 ATOM 32477 O WAT 5700 87.442 34.727 13.237 1.00 0.00 O ATOM 32478 H1 WAT 5700 88.309 35.132 13.240 1.00 0.00 H ATOM 32479 H2 WAT 5700 87.116 34.865 12.348 1.00 0.00 H TER 32481 WAT 5700 ATOM 32481 O WAT 5701 64.752 92.155 8.030 1.00 0.00 O ATOM 32482 H1 WAT 5701 64.220 91.723 7.362 1.00 0.00 H ATOM 32483 H2 WAT 5701 64.368 91.873 8.861 1.00 0.00 H TER 32485 WAT 5701 ATOM 32485 O WAT 5702 45.559 78.942 145.718 1.00 0.00 O ATOM 32486 H1 WAT 5702 46.394 78.801 146.166 1.00 0.00 H ATOM 32487 H2 WAT 5702 45.311 78.076 145.395 1.00 0.00 H TER 32489 WAT 5702 ATOM 32489 O WAT 5703 132.222 14.143 69.892 1.00 0.00 O ATOM 32490 H1 WAT 5703 131.504 14.696 70.201 1.00 0.00 H ATOM 32491 H2 WAT 5703 132.224 14.262 68.943 1.00 0.00 H TER 32493 WAT 5703 ATOM 32493 O WAT 5704 22.810 9.943 157.288 1.00 0.00 O ATOM 32494 H1 WAT 5704 21.865 9.814 157.373 1.00 0.00 H ATOM 32495 H2 WAT 5704 23.185 9.076 157.440 1.00 0.00 H TER 32497 WAT 5704 ATOM 32497 O WAT 5705 141.356 12.049 71.646 1.00 0.00 O ATOM 32498 H1 WAT 5705 140.458 12.152 71.332 1.00 0.00 H ATOM 32499 H2 WAT 5705 141.661 12.944 71.798 1.00 0.00 H TER 32501 WAT 5705 ATOM 32501 O WAT 5706 3.680 60.885 125.269 1.00 0.00 O ATOM 32502 H1 WAT 5706 4.550 61.131 124.957 1.00 0.00 H ATOM 32503 H2 WAT 5706 3.276 61.712 125.531 1.00 0.00 H TER 32505 WAT 5706 ATOM 32505 O WAT 5707 103.912 12.910 19.437 1.00 0.00 O ATOM 32506 H1 WAT 5707 104.487 12.226 19.778 1.00 0.00 H ATOM 32507 H2 WAT 5707 103.750 13.483 20.187 1.00 0.00 H TER 32509 WAT 5707 ATOM 32509 O WAT 5708 145.362 83.974 85.426 1.00 0.00 O ATOM 32510 H1 WAT 5708 145.074 84.326 86.268 1.00 0.00 H ATOM 32511 H2 WAT 5708 146.153 83.476 85.632 1.00 0.00 H TER 32513 WAT 5708 ATOM 32513 O WAT 5709 57.581 107.527 142.761 1.00 0.00 O ATOM 32514 H1 WAT 5709 57.607 106.685 143.216 1.00 0.00 H ATOM 32515 H2 WAT 5709 56.650 107.686 142.606 1.00 0.00 H TER 32517 WAT 5709 ATOM 32517 O WAT 5710 61.722 38.334 136.589 1.00 0.00 O ATOM 32518 H1 WAT 5710 61.893 37.652 135.940 1.00 0.00 H ATOM 32519 H2 WAT 5710 61.855 37.901 137.433 1.00 0.00 H TER 32521 WAT 5710 ATOM 32521 O WAT 5711 38.594 97.626 112.069 1.00 0.00 O ATOM 32522 H1 WAT 5711 38.360 98.407 111.567 1.00 0.00 H ATOM 32523 H2 WAT 5711 38.838 96.980 111.407 1.00 0.00 H TER 32525 WAT 5711 ATOM 32525 O WAT 5712 52.709 69.387 10.196 1.00 0.00 O ATOM 32526 H1 WAT 5712 52.135 69.454 10.959 1.00 0.00 H ATOM 32527 H2 WAT 5712 53.507 69.846 10.457 1.00 0.00 H TER 32529 WAT 5712 ATOM 32529 O WAT 5713 6.782 138.776 86.663 1.00 0.00 O ATOM 32530 H1 WAT 5713 6.858 139.639 86.255 1.00 0.00 H ATOM 32531 H2 WAT 5713 7.258 138.190 86.074 1.00 0.00 H TER 32533 WAT 5713 ATOM 32533 O WAT 5714 102.104 132.544 110.786 1.00 0.00 O ATOM 32534 H1 WAT 5714 101.365 133.068 111.097 1.00 0.00 H ATOM 32535 H2 WAT 5714 102.379 132.973 109.976 1.00 0.00 H TER 32537 WAT 5714 ATOM 32537 O WAT 5715 44.308 41.744 134.776 1.00 0.00 O ATOM 32538 H1 WAT 5715 43.625 42.389 134.962 1.00 0.00 H ATOM 32539 H2 WAT 5715 44.207 41.085 135.463 1.00 0.00 H TER 32541 WAT 5715 ATOM 32541 O WAT 5716 116.038 44.891 124.482 1.00 0.00 O ATOM 32542 H1 WAT 5716 116.670 45.286 125.082 1.00 0.00 H ATOM 32543 H2 WAT 5716 116.550 44.258 123.978 1.00 0.00 H TER 32545 WAT 5716 ATOM 32545 O WAT 5717 128.160 110.216 102.163 1.00 0.00 O ATOM 32546 H1 WAT 5717 127.404 110.654 101.773 1.00 0.00 H ATOM 32547 H2 WAT 5717 128.128 109.325 101.812 1.00 0.00 H TER 32549 WAT 5717 ATOM 32549 O WAT 5718 85.880 71.920 149.646 1.00 0.00 O ATOM 32550 H1 WAT 5718 85.173 71.335 149.372 1.00 0.00 H ATOM 32551 H2 WAT 5718 86.225 72.277 148.828 1.00 0.00 H TER 32553 WAT 5718 ATOM 32553 O WAT 5719 102.180 105.454 17.599 1.00 0.00 O ATOM 32554 H1 WAT 5719 101.994 105.602 18.526 1.00 0.00 H ATOM 32555 H2 WAT 5719 103.133 105.384 17.553 1.00 0.00 H TER 32557 WAT 5719 ATOM 32557 O WAT 5720 110.870 110.385 145.662 1.00 0.00 O ATOM 32558 H1 WAT 5720 110.905 111.013 146.383 1.00 0.00 H ATOM 32559 H2 WAT 5720 110.236 110.758 145.049 1.00 0.00 H TER 32561 WAT 5720 ATOM 32561 O WAT 5721 120.888 27.294 120.230 1.00 0.00 O ATOM 32562 H1 WAT 5721 120.750 28.049 120.802 1.00 0.00 H ATOM 32563 H2 WAT 5721 120.014 26.926 120.104 1.00 0.00 H TER 32565 WAT 5721 ATOM 32565 O WAT 5722 40.933 119.323 118.800 1.00 0.00 O ATOM 32566 H1 WAT 5722 40.772 118.404 119.016 1.00 0.00 H ATOM 32567 H2 WAT 5722 41.321 119.691 119.593 1.00 0.00 H TER 32569 WAT 5722 ATOM 32569 O WAT 5723 34.347 113.299 81.105 1.00 0.00 O ATOM 32570 H1 WAT 5723 34.751 113.203 80.242 1.00 0.00 H ATOM 32571 H2 WAT 5723 33.931 114.161 81.080 1.00 0.00 H TER 32573 WAT 5723 ATOM 32573 O WAT 5724 24.146 140.479 64.707 1.00 0.00 O ATOM 32574 H1 WAT 5724 24.689 140.051 64.045 1.00 0.00 H ATOM 32575 H2 WAT 5724 24.725 140.582 65.462 1.00 0.00 H TER 32577 WAT 5724 ATOM 32577 O WAT 5725 38.829 141.502 59.406 1.00 0.00 O ATOM 32578 H1 WAT 5725 38.093 141.200 58.873 1.00 0.00 H ATOM 32579 H2 WAT 5725 39.493 141.767 58.769 1.00 0.00 H TER 32581 WAT 5725 ATOM 32581 O WAT 5726 92.117 25.439 6.943 1.00 0.00 O ATOM 32582 H1 WAT 5726 91.693 26.123 7.463 1.00 0.00 H ATOM 32583 H2 WAT 5726 92.021 25.732 6.037 1.00 0.00 H TER 32585 WAT 5726 ATOM 32585 O WAT 5727 143.699 78.874 142.051 1.00 0.00 O ATOM 32586 H1 WAT 5727 142.914 79.355 142.313 1.00 0.00 H ATOM 32587 H2 WAT 5727 143.654 78.844 141.095 1.00 0.00 H TER 32589 WAT 5727 ATOM 32589 O WAT 5728 11.944 115.198 118.368 1.00 0.00 O ATOM 32590 H1 WAT 5728 11.936 114.266 118.588 1.00 0.00 H ATOM 32591 H2 WAT 5728 12.326 115.622 119.137 1.00 0.00 H TER 32593 WAT 5728 ATOM 32593 O WAT 5729 65.439 33.325 21.807 1.00 0.00 O ATOM 32594 H1 WAT 5729 65.993 33.681 21.111 1.00 0.00 H ATOM 32595 H2 WAT 5729 65.641 33.863 22.572 1.00 0.00 H TER 32597 WAT 5729 ATOM 32597 O WAT 5730 36.834 45.255 108.082 1.00 0.00 O ATOM 32598 H1 WAT 5730 37.086 45.147 107.165 1.00 0.00 H ATOM 32599 H2 WAT 5730 35.907 45.493 108.049 1.00 0.00 H TER 32601 WAT 5730 ATOM 32601 O WAT 5731 95.885 23.619 81.264 1.00 0.00 O ATOM 32602 H1 WAT 5731 95.230 23.136 81.768 1.00 0.00 H ATOM 32603 H2 WAT 5731 95.416 24.384 80.932 1.00 0.00 H TER 32605 WAT 5731 ATOM 32605 O WAT 5732 53.474 139.788 94.994 1.00 0.00 O ATOM 32606 H1 WAT 5732 53.747 140.492 95.582 1.00 0.00 H ATOM 32607 H2 WAT 5732 53.536 140.170 94.119 1.00 0.00 H TER 32609 WAT 5732 ATOM 32609 O WAT 5733 88.865 111.536 87.389 1.00 0.00 O ATOM 32610 H1 WAT 5733 88.479 112.405 87.502 1.00 0.00 H ATOM 32611 H2 WAT 5733 89.055 111.478 86.453 1.00 0.00 H TER 32613 WAT 5733 ATOM 32613 O WAT 5734 125.983 44.749 119.483 1.00 0.00 O ATOM 32614 H1 WAT 5734 125.083 44.675 119.166 1.00 0.00 H ATOM 32615 H2 WAT 5734 126.243 45.643 119.260 1.00 0.00 H TER 32617 WAT 5734 ATOM 32617 O WAT 5735 60.755 28.280 90.944 1.00 0.00 O ATOM 32618 H1 WAT 5735 60.225 27.493 90.819 1.00 0.00 H ATOM 32619 H2 WAT 5735 61.133 28.179 91.817 1.00 0.00 H TER 32621 WAT 5735 ATOM 32621 O WAT 5736 109.655 141.104 104.276 1.00 0.00 O ATOM 32622 H1 WAT 5736 110.202 140.345 104.078 1.00 0.00 H ATOM 32623 H2 WAT 5736 108.997 141.113 103.581 1.00 0.00 H TER 32625 WAT 5736 ATOM 32625 O WAT 5737 103.617 99.623 17.156 1.00 0.00 O ATOM 32626 H1 WAT 5737 103.564 98.690 17.363 1.00 0.00 H ATOM 32627 H2 WAT 5737 102.714 99.877 16.964 1.00 0.00 H TER 32629 WAT 5737 ATOM 32629 O WAT 5738 100.492 7.061 9.756 1.00 0.00 O ATOM 32630 H1 WAT 5738 100.475 6.947 10.706 1.00 0.00 H ATOM 32631 H2 WAT 5738 99.613 6.812 9.469 1.00 0.00 H TER 32633 WAT 5738 ATOM 32633 O WAT 5739 135.500 113.675 127.585 1.00 0.00 O ATOM 32634 H1 WAT 5739 135.679 112.898 127.056 1.00 0.00 H ATOM 32635 H2 WAT 5739 135.280 114.354 126.948 1.00 0.00 H TER 32637 WAT 5739 ATOM 32637 O WAT 5740 30.363 81.407 136.644 1.00 0.00 O ATOM 32638 H1 WAT 5740 30.271 80.746 135.957 1.00 0.00 H ATOM 32639 H2 WAT 5740 31.195 81.198 137.068 1.00 0.00 H TER 32641 WAT 5740 ATOM 32641 O WAT 5741 74.657 136.405 105.006 1.00 0.00 O ATOM 32642 H1 WAT 5741 74.476 136.921 105.792 1.00 0.00 H ATOM 32643 H2 WAT 5741 74.088 135.639 105.086 1.00 0.00 H TER 32645 WAT 5741 ATOM 32645 O WAT 5742 32.617 36.133 13.744 1.00 0.00 O ATOM 32646 H1 WAT 5742 32.236 35.258 13.816 1.00 0.00 H ATOM 32647 H2 WAT 5742 31.881 36.695 13.503 1.00 0.00 H TER 32649 WAT 5742 ATOM 32649 O WAT 5743 44.869 110.733 14.191 1.00 0.00 O ATOM 32650 H1 WAT 5743 44.673 111.657 14.347 1.00 0.00 H ATOM 32651 H2 WAT 5743 44.500 110.279 14.949 1.00 0.00 H TER 32653 WAT 5743 ATOM 32653 O WAT 5744 61.762 25.701 143.443 1.00 0.00 O ATOM 32654 H1 WAT 5744 61.367 25.769 142.574 1.00 0.00 H ATOM 32655 H2 WAT 5744 62.615 26.127 143.353 1.00 0.00 H TER 32657 WAT 5744 ATOM 32657 O WAT 5745 72.457 94.897 94.537 1.00 0.00 O ATOM 32658 H1 WAT 5745 72.828 94.464 95.306 1.00 0.00 H ATOM 32659 H2 WAT 5745 72.207 94.178 93.956 1.00 0.00 H TER 32661 WAT 5745 ATOM 32661 O WAT 5746 131.708 18.291 17.941 1.00 0.00 O ATOM 32662 H1 WAT 5746 130.894 17.831 18.147 1.00 0.00 H ATOM 32663 H2 WAT 5746 131.437 19.015 17.377 1.00 0.00 H TER 32665 WAT 5746 ATOM 32665 O WAT 5747 80.070 76.626 89.458 1.00 0.00 O ATOM 32666 H1 WAT 5747 79.621 76.188 90.181 1.00 0.00 H ATOM 32667 H2 WAT 5747 79.551 76.406 88.685 1.00 0.00 H TER 32669 WAT 5747 ATOM 32669 O WAT 5748 2.942 40.118 81.030 1.00 0.00 O ATOM 32670 H1 WAT 5748 2.827 41.061 80.914 1.00 0.00 H ATOM 32671 H2 WAT 5748 2.216 39.856 81.596 1.00 0.00 H TER 32673 WAT 5748 ATOM 32673 O WAT 5749 20.170 57.957 87.773 1.00 0.00 O ATOM 32674 H1 WAT 5749 20.222 58.912 87.730 1.00 0.00 H ATOM 32675 H2 WAT 5749 19.423 57.784 88.345 1.00 0.00 H TER 32677 WAT 5749 ATOM 32677 O WAT 5750 84.384 70.821 145.480 1.00 0.00 O ATOM 32678 H1 WAT 5750 83.483 71.112 145.618 1.00 0.00 H ATOM 32679 H2 WAT 5750 84.299 69.941 145.114 1.00 0.00 H TER 32681 WAT 5750 ATOM 32681 O WAT 5751 16.411 17.206 19.247 1.00 0.00 O ATOM 32682 H1 WAT 5751 16.104 18.083 19.016 1.00 0.00 H ATOM 32683 H2 WAT 5751 17.316 17.180 18.937 1.00 0.00 H TER 32685 WAT 5751 ATOM 32685 O WAT 5752 62.132 137.095 74.173 1.00 0.00 O ATOM 32686 H1 WAT 5752 61.726 137.078 75.039 1.00 0.00 H ATOM 32687 H2 WAT 5752 63.054 137.289 74.345 1.00 0.00 H TER 32689 WAT 5752 ATOM 32689 O WAT 5753 65.134 40.227 119.583 1.00 0.00 O ATOM 32690 H1 WAT 5753 64.887 41.061 119.982 1.00 0.00 H ATOM 32691 H2 WAT 5753 66.090 40.253 119.543 1.00 0.00 H TER 32693 WAT 5753 ATOM 32693 O WAT 5754 69.117 53.061 150.587 1.00 0.00 O ATOM 32694 H1 WAT 5754 69.181 53.408 149.698 1.00 0.00 H ATOM 32695 H2 WAT 5754 70.016 52.825 150.818 1.00 0.00 H TER 32697 WAT 5754 ATOM 32697 O WAT 5755 37.068 11.611 70.016 1.00 0.00 O ATOM 32698 H1 WAT 5755 37.773 12.226 70.218 1.00 0.00 H ATOM 32699 H2 WAT 5755 37.310 10.808 70.477 1.00 0.00 H TER 32701 WAT 5755 ATOM 32701 O WAT 5756 52.058 87.790 107.813 1.00 0.00 O ATOM 32702 H1 WAT 5756 51.227 87.365 107.602 1.00 0.00 H ATOM 32703 H2 WAT 5756 52.639 87.072 108.063 1.00 0.00 H TER 32705 WAT 5756 ATOM 32705 O WAT 5757 80.757 20.838 85.472 1.00 0.00 O ATOM 32706 H1 WAT 5757 80.813 19.973 85.064 1.00 0.00 H ATOM 32707 H2 WAT 5757 80.132 21.319 84.929 1.00 0.00 H TER 32709 WAT 5757 ATOM 32709 O WAT 5758 96.740 34.516 128.574 1.00 0.00 O ATOM 32710 H1 WAT 5758 97.293 33.737 128.506 1.00 0.00 H ATOM 32711 H2 WAT 5758 95.925 34.197 128.962 1.00 0.00 H TER 32713 WAT 5758 ATOM 32713 O WAT 5759 121.761 140.356 151.016 1.00 0.00 O ATOM 32714 H1 WAT 5759 122.271 139.668 151.445 1.00 0.00 H ATOM 32715 H2 WAT 5759 121.910 140.216 150.081 1.00 0.00 H TER 32717 WAT 5759 ATOM 32717 O WAT 5760 12.889 69.500 101.988 1.00 0.00 O ATOM 32718 H1 WAT 5760 13.623 70.038 101.694 1.00 0.00 H ATOM 32719 H2 WAT 5760 12.231 69.595 101.299 1.00 0.00 H TER 32721 WAT 5760 ATOM 32721 O WAT 5761 110.016 75.769 83.768 1.00 0.00 O ATOM 32722 H1 WAT 5761 110.939 75.529 83.692 1.00 0.00 H ATOM 32723 H2 WAT 5761 109.736 75.932 82.867 1.00 0.00 H TER 32725 WAT 5761 ATOM 32725 O WAT 5762 39.337 87.389 125.462 1.00 0.00 O ATOM 32726 H1 WAT 5762 40.225 87.034 125.493 1.00 0.00 H ATOM 32727 H2 WAT 5762 39.406 88.245 125.885 1.00 0.00 H TER 32729 WAT 5762 ATOM 32729 O WAT 5763 48.356 73.634 86.721 1.00 0.00 O ATOM 32730 H1 WAT 5763 48.316 74.541 87.025 1.00 0.00 H ATOM 32731 H2 WAT 5763 49.044 73.233 87.252 1.00 0.00 H TER 32733 WAT 5763 ATOM 32733 O WAT 5764 85.643 54.782 0.013 1.00 0.00 O ATOM 32734 H1 WAT 5764 85.616 54.103 0.688 1.00 0.00 H ATOM 32735 H2 WAT 5764 85.366 55.579 0.464 1.00 0.00 H TER 32737 WAT 5764 ATOM 32737 O WAT 5765 0.496 23.660 150.286 1.00 0.00 O ATOM 32738 H1 WAT 5765 0.806 24.433 149.814 1.00 0.00 H ATOM 32739 H2 WAT 5765 0.626 22.937 149.673 1.00 0.00 H TER 32741 WAT 5765 ATOM 32741 O WAT 5766 14.808 99.705 5.705 1.00 0.00 O ATOM 32742 H1 WAT 5766 14.356 99.064 6.252 1.00 0.00 H ATOM 32743 H2 WAT 5766 14.850 99.297 4.840 1.00 0.00 H TER 32745 WAT 5766 ATOM 32745 O WAT 5767 49.930 59.114 146.405 1.00 0.00 O ATOM 32746 H1 WAT 5767 49.319 58.781 145.747 1.00 0.00 H ATOM 32747 H2 WAT 5767 50.344 59.869 145.987 1.00 0.00 H TER 32749 WAT 5767 ATOM 32749 O WAT 5768 117.696 122.296 120.301 1.00 0.00 O ATOM 32750 H1 WAT 5768 117.414 123.207 120.387 1.00 0.00 H ATOM 32751 H2 WAT 5768 117.433 121.886 121.125 1.00 0.00 H TER 32753 WAT 5768 ATOM 32753 O WAT 5769 2.139 72.029 5.325 1.00 0.00 O ATOM 32754 H1 WAT 5769 2.951 71.752 4.899 1.00 0.00 H ATOM 32755 H2 WAT 5769 2.329 72.909 5.651 1.00 0.00 H TER 32757 WAT 5769 ATOM 32757 O WAT 5770 94.030 9.936 114.380 1.00 0.00 O ATOM 32758 H1 WAT 5770 94.832 10.317 114.739 1.00 0.00 H ATOM 32759 H2 WAT 5770 93.911 10.377 113.539 1.00 0.00 H TER 32761 WAT 5770 ATOM 32761 O WAT 5771 22.330 55.388 79.316 1.00 0.00 O ATOM 32762 H1 WAT 5771 22.217 54.719 78.641 1.00 0.00 H ATOM 32763 H2 WAT 5771 21.447 55.725 79.470 1.00 0.00 H TER 32765 WAT 5771 ATOM 32765 O WAT 5772 70.090 88.578 118.638 1.00 0.00 O ATOM 32766 H1 WAT 5772 69.249 88.871 118.987 1.00 0.00 H ATOM 32767 H2 WAT 5772 69.958 88.547 117.690 1.00 0.00 H TER 32769 WAT 5772 ATOM 32769 O WAT 5773 21.413 64.488 140.484 1.00 0.00 O ATOM 32770 H1 WAT 5773 21.695 64.079 141.302 1.00 0.00 H ATOM 32771 H2 WAT 5773 21.176 65.381 140.732 1.00 0.00 H TER 32773 WAT 5773 ATOM 32773 O WAT 5774 49.967 32.147 6.656 1.00 0.00 O ATOM 32774 H1 WAT 5774 49.106 32.557 6.735 1.00 0.00 H ATOM 32775 H2 WAT 5774 50.304 32.457 5.815 1.00 0.00 H TER 32777 WAT 5774 ATOM 32777 O WAT 5775 94.261 109.203 101.495 1.00 0.00 O ATOM 32778 H1 WAT 5775 94.112 108.549 100.813 1.00 0.00 H ATOM 32779 H2 WAT 5775 93.383 109.472 101.766 1.00 0.00 H TER 32781 WAT 5775 ATOM 32781 O WAT 5776 103.464 102.343 27.757 1.00 0.00 O ATOM 32782 H1 WAT 5776 102.650 102.550 28.216 1.00 0.00 H ATOM 32783 H2 WAT 5776 104.014 101.926 28.421 1.00 0.00 H TER 32785 WAT 5776 ATOM 32785 O WAT 5777 39.827 87.688 71.662 1.00 0.00 O ATOM 32786 H1 WAT 5777 40.236 88.417 72.127 1.00 0.00 H ATOM 32787 H2 WAT 5777 39.816 86.973 72.298 1.00 0.00 H TER 32789 WAT 5777 ATOM 32789 O WAT 5778 85.963 102.986 9.551 1.00 0.00 O ATOM 32790 H1 WAT 5778 86.741 102.696 9.074 1.00 0.00 H ATOM 32791 H2 WAT 5778 86.139 102.749 10.462 1.00 0.00 H TER 32793 WAT 5778 ATOM 32793 O WAT 5779 134.336 17.034 17.899 1.00 0.00 O ATOM 32794 H1 WAT 5779 135.003 17.566 18.333 1.00 0.00 H ATOM 32795 H2 WAT 5779 133.516 17.281 18.327 1.00 0.00 H TER 32797 WAT 5779 ATOM 32797 O WAT 5780 39.514 49.658 62.321 1.00 0.00 O ATOM 32798 H1 WAT 5780 39.261 50.450 61.847 1.00 0.00 H ATOM 32799 H2 WAT 5780 40.146 49.226 61.747 1.00 0.00 H TER 32801 WAT 5780 ATOM 32801 O WAT 5781 35.346 69.718 84.675 1.00 0.00 O ATOM 32802 H1 WAT 5781 35.999 69.168 84.243 1.00 0.00 H ATOM 32803 H2 WAT 5781 35.587 69.693 85.601 1.00 0.00 H TER 32805 WAT 5781 ATOM 32805 O WAT 5782 56.755 80.181 103.137 1.00 0.00 O ATOM 32806 H1 WAT 5782 57.412 80.877 103.104 1.00 0.00 H ATOM 32807 H2 WAT 5782 56.130 80.474 103.800 1.00 0.00 H TER 32809 WAT 5782 ATOM 32809 O WAT 5783 65.317 62.010 108.743 1.00 0.00 O ATOM 32810 H1 WAT 5783 64.932 61.133 108.736 1.00 0.00 H ATOM 32811 H2 WAT 5783 66.251 61.859 108.891 1.00 0.00 H TER 32813 WAT 5783 ATOM 32813 O WAT 5784 69.257 62.851 77.777 1.00 0.00 O ATOM 32814 H1 WAT 5784 69.705 63.128 76.978 1.00 0.00 H ATOM 32815 H2 WAT 5784 69.132 63.659 78.274 1.00 0.00 H TER 32817 WAT 5784 ATOM 32817 O WAT 5785 111.625 31.103 60.438 1.00 0.00 O ATOM 32818 H1 WAT 5785 112.262 31.311 59.755 1.00 0.00 H ATOM 32819 H2 WAT 5785 110.798 30.990 59.969 1.00 0.00 H TER 32821 WAT 5785 ATOM 32821 O WAT 5786 50.176 74.869 3.964 1.00 0.00 O ATOM 32822 H1 WAT 5786 49.224 74.807 4.038 1.00 0.00 H ATOM 32823 H2 WAT 5786 50.469 73.962 3.879 1.00 0.00 H TER 32825 WAT 5786 ATOM 32825 O WAT 5787 30.161 41.040 125.602 1.00 0.00 O ATOM 32826 H1 WAT 5787 30.622 40.729 124.823 1.00 0.00 H ATOM 32827 H2 WAT 5787 30.719 40.773 126.333 1.00 0.00 H TER 32829 WAT 5787 ATOM 32829 O WAT 5788 98.589 115.790 138.975 1.00 0.00 O ATOM 32830 H1 WAT 5788 99.347 116.374 138.934 1.00 0.00 H ATOM 32831 H2 WAT 5788 98.706 115.193 138.236 1.00 0.00 H TER 32833 WAT 5788 ATOM 32833 O WAT 5789 22.542 55.882 109.427 1.00 0.00 O ATOM 32834 H1 WAT 5789 22.590 56.749 109.830 1.00 0.00 H ATOM 32835 H2 WAT 5789 23.163 55.922 108.700 1.00 0.00 H TER 32837 WAT 5789 ATOM 32837 O WAT 5790 103.861 110.991 122.718 1.00 0.00 O ATOM 32838 H1 WAT 5790 104.110 110.162 123.128 1.00 0.00 H ATOM 32839 H2 WAT 5790 103.548 111.532 123.443 1.00 0.00 H TER 32841 WAT 5790 ATOM 32841 O WAT 5791 113.313 54.377 63.102 1.00 0.00 O ATOM 32842 H1 WAT 5791 113.280 53.695 63.773 1.00 0.00 H ATOM 32843 H2 WAT 5791 114.116 54.862 63.293 1.00 0.00 H TER 32845 WAT 5791 ATOM 32845 O WAT 5792 125.928 86.227 129.352 1.00 0.00 O ATOM 32846 H1 WAT 5792 126.840 86.494 129.463 1.00 0.00 H ATOM 32847 H2 WAT 5792 125.797 85.543 130.009 1.00 0.00 H TER 32849 WAT 5792 ATOM 32849 O WAT 5793 54.733 33.317 123.666 1.00 0.00 O ATOM 32850 H1 WAT 5793 54.646 32.691 124.385 1.00 0.00 H ATOM 32851 H2 WAT 5793 54.878 34.159 124.098 1.00 0.00 H TER 32853 WAT 5793 ATOM 32853 O WAT 5794 58.989 136.605 105.642 1.00 0.00 O ATOM 32854 H1 WAT 5794 58.129 136.261 105.401 1.00 0.00 H ATOM 32855 H2 WAT 5794 58.821 137.157 106.406 1.00 0.00 H TER 32857 WAT 5794 ATOM 32857 O WAT 5795 141.396 39.042 129.565 1.00 0.00 O ATOM 32858 H1 WAT 5795 142.144 39.136 130.155 1.00 0.00 H ATOM 32859 H2 WAT 5795 140.653 39.382 130.063 1.00 0.00 H TER 32861 WAT 5795 ATOM 32861 O WAT 5796 43.036 134.505 148.454 1.00 0.00 O ATOM 32862 H1 WAT 5796 42.737 135.260 148.959 1.00 0.00 H ATOM 32863 H2 WAT 5796 43.313 133.869 149.114 1.00 0.00 H TER 32865 WAT 5796 ATOM 32865 O WAT 5797 15.891 68.044 2.824 1.00 0.00 O ATOM 32866 H1 WAT 5797 15.154 67.499 2.549 1.00 0.00 H ATOM 32867 H2 WAT 5797 16.638 67.704 2.331 1.00 0.00 H TER 32869 WAT 5797 ATOM 32869 O WAT 5798 44.360 126.976 147.683 1.00 0.00 O ATOM 32870 H1 WAT 5798 43.634 126.908 148.303 1.00 0.00 H ATOM 32871 H2 WAT 5798 44.417 126.106 147.286 1.00 0.00 H TER 32873 WAT 5798 ATOM 32873 O WAT 5799 6.904 27.863 145.644 1.00 0.00 O ATOM 32874 H1 WAT 5799 6.921 28.780 145.920 1.00 0.00 H ATOM 32875 H2 WAT 5799 6.156 27.805 145.050 1.00 0.00 H TER 32877 WAT 5799 ATOM 32877 O WAT 5800 17.313 36.408 57.620 1.00 0.00 O ATOM 32878 H1 WAT 5800 16.622 36.218 56.985 1.00 0.00 H ATOM 32879 H2 WAT 5800 17.915 35.667 57.548 1.00 0.00 H TER 32881 WAT 5800 ATOM 32881 O WAT 5801 75.079 78.127 69.681 1.00 0.00 O ATOM 32882 H1 WAT 5801 75.313 77.614 70.454 1.00 0.00 H ATOM 32883 H2 WAT 5801 75.274 79.032 69.925 1.00 0.00 H TER 32885 WAT 5801 ATOM 32885 O WAT 5802 10.310 102.541 99.848 1.00 0.00 O ATOM 32886 H1 WAT 5802 11.064 102.040 100.157 1.00 0.00 H ATOM 32887 H2 WAT 5802 10.170 102.235 98.952 1.00 0.00 H TER 32889 WAT 5802 ATOM 32889 O WAT 5803 97.591 52.602 90.866 1.00 0.00 O ATOM 32890 H1 WAT 5803 96.971 53.248 90.529 1.00 0.00 H ATOM 32891 H2 WAT 5803 97.078 51.797 90.945 1.00 0.00 H TER 32893 WAT 5803 ATOM 32893 O WAT 5804 49.815 67.122 141.472 1.00 0.00 O ATOM 32894 H1 WAT 5804 50.041 68.017 141.220 1.00 0.00 H ATOM 32895 H2 WAT 5804 50.213 66.575 140.795 1.00 0.00 H TER 32897 WAT 5804 ATOM 32897 O WAT 5805 67.095 62.448 85.672 1.00 0.00 O ATOM 32898 H1 WAT 5805 67.574 63.172 85.268 1.00 0.00 H ATOM 32899 H2 WAT 5805 66.463 62.873 86.252 1.00 0.00 H TER 32901 WAT 5805 ATOM 32901 O WAT 5806 3.503 139.816 72.882 1.00 0.00 O ATOM 32902 H1 WAT 5806 2.689 139.547 72.457 1.00 0.00 H ATOM 32903 H2 WAT 5806 3.691 139.113 73.505 1.00 0.00 H TER 32905 WAT 5806 ATOM 32905 O WAT 5807 16.327 141.319 99.241 1.00 0.00 O ATOM 32906 H1 WAT 5807 15.457 141.492 99.602 1.00 0.00 H ATOM 32907 H2 WAT 5807 16.271 140.426 98.901 1.00 0.00 H TER 32909 WAT 5807 ATOM 32909 O WAT 5808 60.379 124.677 143.698 1.00 0.00 O ATOM 32910 H1 WAT 5808 59.979 124.079 143.066 1.00 0.00 H ATOM 32911 H2 WAT 5808 59.818 125.452 143.682 1.00 0.00 H TER 32913 WAT 5808 ATOM 32913 O WAT 5809 9.849 42.100 112.938 1.00 0.00 O ATOM 32914 H1 WAT 5809 9.356 42.549 112.251 1.00 0.00 H ATOM 32915 H2 WAT 5809 10.656 41.818 112.507 1.00 0.00 H TER 32917 WAT 5809 ATOM 32917 O WAT 5810 46.584 125.474 56.729 1.00 0.00 O ATOM 32918 H1 WAT 5810 46.089 126.293 56.734 1.00 0.00 H ATOM 32919 H2 WAT 5810 47.299 125.629 56.113 1.00 0.00 H TER 32921 WAT 5810 ATOM 32921 O WAT 5811 86.596 14.994 137.713 1.00 0.00 O ATOM 32922 H1 WAT 5811 87.391 14.649 138.120 1.00 0.00 H ATOM 32923 H2 WAT 5811 86.505 14.494 136.903 1.00 0.00 H TER 32925 WAT 5811 ATOM 32925 O WAT 5812 105.717 68.742 128.071 1.00 0.00 O ATOM 32926 H1 WAT 5812 106.215 68.151 128.636 1.00 0.00 H ATOM 32927 H2 WAT 5812 105.673 69.562 128.562 1.00 0.00 H TER 32929 WAT 5812 ATOM 32929 O WAT 5813 138.237 85.665 153.840 1.00 0.00 O ATOM 32930 H1 WAT 5813 137.557 85.556 153.175 1.00 0.00 H ATOM 32931 H2 WAT 5813 138.151 86.576 154.122 1.00 0.00 H TER 32933 WAT 5813 ATOM 32933 O WAT 5814 81.511 23.689 60.067 1.00 0.00 O ATOM 32934 H1 WAT 5814 82.228 23.801 59.443 1.00 0.00 H ATOM 32935 H2 WAT 5814 81.899 23.897 60.917 1.00 0.00 H TER 32937 WAT 5814 ATOM 32937 O WAT 5815 81.747 15.323 151.064 1.00 0.00 O ATOM 32938 H1 WAT 5815 81.295 15.826 151.742 1.00 0.00 H ATOM 32939 H2 WAT 5815 82.202 15.983 150.541 1.00 0.00 H TER 32941 WAT 5815 ATOM 32941 O WAT 5816 26.485 7.308 84.325 1.00 0.00 O ATOM 32942 H1 WAT 5816 26.076 6.633 84.866 1.00 0.00 H ATOM 32943 H2 WAT 5816 26.160 7.137 83.441 1.00 0.00 H TER 32945 WAT 5816 ATOM 32945 O WAT 5817 53.621 10.737 107.558 1.00 0.00 O ATOM 32946 H1 WAT 5817 52.770 10.860 107.139 1.00 0.00 H ATOM 32947 H2 WAT 5817 54.030 11.601 107.530 1.00 0.00 H TER 32949 WAT 5817 ATOM 32949 O WAT 5818 2.882 43.415 88.489 1.00 0.00 O ATOM 32950 H1 WAT 5818 3.103 42.548 88.830 1.00 0.00 H ATOM 32951 H2 WAT 5818 3.656 43.682 87.994 1.00 0.00 H TER 32953 WAT 5818 ATOM 32953 O WAT 5819 114.621 72.757 75.696 1.00 0.00 O ATOM 32954 H1 WAT 5819 114.445 73.092 74.817 1.00 0.00 H ATOM 32955 H2 WAT 5819 114.688 73.540 76.243 1.00 0.00 H TER 32957 WAT 5819 ATOM 32957 O WAT 5820 79.092 12.571 111.559 1.00 0.00 O ATOM 32958 H1 WAT 5820 78.243 12.695 111.133 1.00 0.00 H ATOM 32959 H2 WAT 5820 79.717 13.002 110.976 1.00 0.00 H TER 32961 WAT 5820 ATOM 32961 O WAT 5821 111.655 57.571 18.926 1.00 0.00 O ATOM 32962 H1 WAT 5821 111.645 56.816 18.337 1.00 0.00 H ATOM 32963 H2 WAT 5821 111.733 58.327 18.344 1.00 0.00 H TER 32965 WAT 5821 ATOM 32965 O WAT 5822 20.301 93.283 127.203 1.00 0.00 O ATOM 32966 H1 WAT 5822 21.011 93.541 127.792 1.00 0.00 H ATOM 32967 H2 WAT 5822 19.502 93.502 127.681 1.00 0.00 H TER 32969 WAT 5822 ATOM 32969 O WAT 5823 48.797 48.773 57.535 1.00 0.00 O ATOM 32970 H1 WAT 5823 49.734 48.898 57.684 1.00 0.00 H ATOM 32971 H2 WAT 5823 48.526 48.157 58.216 1.00 0.00 H TER 32973 WAT 5823 ATOM 32973 O WAT 5824 124.832 15.066 112.409 1.00 0.00 O ATOM 32974 H1 WAT 5824 124.637 15.944 112.082 1.00 0.00 H ATOM 32975 H2 WAT 5824 125.779 14.975 112.298 1.00 0.00 H TER 32977 WAT 5824 ATOM 32977 O WAT 5825 109.015 57.806 12.100 1.00 0.00 O ATOM 32978 H1 WAT 5825 109.570 57.158 12.534 1.00 0.00 H ATOM 32979 H2 WAT 5825 109.589 58.559 11.961 1.00 0.00 H TER 32981 WAT 5825 ATOM 32981 O WAT 5826 68.863 29.135 16.530 1.00 0.00 O ATOM 32982 H1 WAT 5826 68.442 29.754 17.126 1.00 0.00 H ATOM 32983 H2 WAT 5826 68.553 28.276 16.818 1.00 0.00 H TER 32985 WAT 5826 ATOM 32985 O WAT 5827 113.243 83.402 14.804 1.00 0.00 O ATOM 32986 H1 WAT 5827 112.292 83.509 14.785 1.00 0.00 H ATOM 32987 H2 WAT 5827 113.495 83.661 15.690 1.00 0.00 H TER 32989 WAT 5827 ATOM 32989 O WAT 5828 11.858 113.910 150.887 1.00 0.00 O ATOM 32990 H1 WAT 5828 12.075 114.840 150.951 1.00 0.00 H ATOM 32991 H2 WAT 5828 11.531 113.680 151.757 1.00 0.00 H TER 32993 WAT 5828 ATOM 32993 O WAT 5829 40.730 115.532 110.773 1.00 0.00 O ATOM 32994 H1 WAT 5829 41.227 116.094 110.178 1.00 0.00 H ATOM 32995 H2 WAT 5829 40.565 114.735 110.268 1.00 0.00 H TER 32997 WAT 5829 ATOM 32997 O WAT 5830 13.053 101.073 119.250 1.00 0.00 O ATOM 32998 H1 WAT 5830 13.781 100.568 119.613 1.00 0.00 H ATOM 32999 H2 WAT 5830 12.575 100.447 118.706 1.00 0.00 H TER 33001 WAT 5830 ATOM 33001 O WAT 5831 134.695 51.846 91.075 1.00 0.00 O ATOM 33002 H1 WAT 5831 133.800 51.511 91.015 1.00 0.00 H ATOM 33003 H2 WAT 5831 135.238 51.140 90.725 1.00 0.00 H TER 33005 WAT 5831 ATOM 33005 O WAT 5832 137.846 88.729 117.785 1.00 0.00 O ATOM 33006 H1 WAT 5832 137.050 89.174 118.076 1.00 0.00 H ATOM 33007 H2 WAT 5832 137.804 88.764 116.829 1.00 0.00 H TER 33009 WAT 5832 ATOM 33009 O WAT 5833 35.963 21.912 83.480 1.00 0.00 O ATOM 33010 H1 WAT 5833 35.279 22.244 82.899 1.00 0.00 H ATOM 33011 H2 WAT 5833 36.329 21.160 83.015 1.00 0.00 H TER 33013 WAT 5833 ATOM 33013 O WAT 5834 108.379 134.996 11.968 1.00 0.00 O ATOM 33014 H1 WAT 5834 107.622 135.529 11.727 1.00 0.00 H ATOM 33015 H2 WAT 5834 108.877 134.905 11.155 1.00 0.00 H TER 33017 WAT 5834 ATOM 33017 O WAT 5835 121.161 116.436 8.270 1.00 0.00 O ATOM 33018 H1 WAT 5835 122.081 116.215 8.129 1.00 0.00 H ATOM 33019 H2 WAT 5835 121.073 116.498 9.221 1.00 0.00 H TER 33021 WAT 5835 ATOM 33021 O WAT 5836 102.288 94.969 101.378 1.00 0.00 O ATOM 33022 H1 WAT 5836 103.124 94.520 101.250 1.00 0.00 H ATOM 33023 H2 WAT 5836 102.498 95.898 101.282 1.00 0.00 H TER 33025 WAT 5836 ATOM 33025 O WAT 5837 76.813 17.552 111.015 1.00 0.00 O ATOM 33026 H1 WAT 5837 77.331 18.244 111.427 1.00 0.00 H ATOM 33027 H2 WAT 5837 77.434 17.093 110.449 1.00 0.00 H TER 33029 WAT 5837 ATOM 33029 O WAT 5838 117.876 3.580 146.487 1.00 0.00 O ATOM 33030 H1 WAT 5838 118.334 3.061 147.148 1.00 0.00 H ATOM 33031 H2 WAT 5838 117.454 4.281 146.983 1.00 0.00 H TER 33033 WAT 5838 ATOM 33033 O WAT 5839 114.988 140.214 14.215 1.00 0.00 O ATOM 33034 H1 WAT 5839 115.291 140.783 13.507 1.00 0.00 H ATOM 33035 H2 WAT 5839 115.393 139.367 14.032 1.00 0.00 H TER 33037 WAT 5839 ATOM 33037 O WAT 5840 134.180 75.618 89.827 1.00 0.00 O ATOM 33038 H1 WAT 5840 134.816 74.922 89.993 1.00 0.00 H ATOM 33039 H2 WAT 5840 134.417 75.959 88.965 1.00 0.00 H TER 33041 WAT 5840 ATOM 33041 O WAT 5841 68.727 51.147 154.288 1.00 0.00 O ATOM 33042 H1 WAT 5841 67.963 51.123 153.712 1.00 0.00 H ATOM 33043 H2 WAT 5841 68.879 50.232 154.524 1.00 0.00 H TER 33045 WAT 5841 ATOM 33045 O WAT 5842 6.432 113.421 139.058 1.00 0.00 O ATOM 33046 H1 WAT 5842 6.604 114.274 139.455 1.00 0.00 H ATOM 33047 H2 WAT 5842 6.554 113.564 138.120 1.00 0.00 H TER 33049 WAT 5842 ATOM 33049 O WAT 5843 43.199 32.842 117.242 1.00 0.00 O ATOM 33050 H1 WAT 5843 43.824 33.449 116.845 1.00 0.00 H ATOM 33051 H2 WAT 5843 43.192 32.087 116.654 1.00 0.00 H TER 33053 WAT 5843 ATOM 33053 O WAT 5844 43.000 41.483 71.679 1.00 0.00 O ATOM 33054 H1 WAT 5844 42.151 41.545 71.241 1.00 0.00 H ATOM 33055 H2 WAT 5844 42.960 42.142 72.373 1.00 0.00 H TER 33057 WAT 5844 ATOM 33057 O WAT 5845 49.834 59.507 76.429 1.00 0.00 O ATOM 33058 H1 WAT 5845 49.101 58.923 76.619 1.00 0.00 H ATOM 33059 H2 WAT 5845 49.425 60.303 76.089 1.00 0.00 H TER 33061 WAT 5845 ATOM 33061 O WAT 5846 59.433 91.592 3.597 1.00 0.00 O ATOM 33062 H1 WAT 5846 60.311 91.394 3.271 1.00 0.00 H ATOM 33063 H2 WAT 5846 59.302 92.516 3.386 1.00 0.00 H TER 33065 WAT 5846 ATOM 33065 O WAT 5847 73.177 7.987 54.651 1.00 0.00 O ATOM 33066 H1 WAT 5847 73.521 8.585 53.987 1.00 0.00 H ATOM 33067 H2 WAT 5847 73.944 7.501 54.955 1.00 0.00 H TER 33069 WAT 5847 ATOM 33069 O WAT 5848 142.134 73.999 150.357 1.00 0.00 O ATOM 33070 H1 WAT 5848 142.620 73.184 150.484 1.00 0.00 H ATOM 33071 H2 WAT 5848 142.774 74.689 150.531 1.00 0.00 H TER 33073 WAT 5848 ATOM 33073 O WAT 5849 77.688 85.204 22.663 1.00 0.00 O ATOM 33074 H1 WAT 5849 78.292 85.845 23.039 1.00 0.00 H ATOM 33075 H2 WAT 5849 78.225 84.699 22.052 1.00 0.00 H TER 33077 WAT 5849 ATOM 33077 O WAT 5850 125.114 55.974 127.787 1.00 0.00 O ATOM 33078 H1 WAT 5850 124.525 56.665 128.087 1.00 0.00 H ATOM 33079 H2 WAT 5850 125.869 56.441 127.429 1.00 0.00 H TER 33081 WAT 5850 ATOM 33081 O WAT 5851 22.657 128.150 106.736 1.00 0.00 O ATOM 33082 H1 WAT 5851 22.893 128.461 107.610 1.00 0.00 H ATOM 33083 H2 WAT 5851 21.711 128.012 106.779 1.00 0.00 H TER 33085 WAT 5851 ATOM 33085 O WAT 5852 52.425 87.936 111.195 1.00 0.00 O ATOM 33086 H1 WAT 5852 52.879 88.138 112.014 1.00 0.00 H ATOM 33087 H2 WAT 5852 53.122 87.882 110.542 1.00 0.00 H TER 33089 WAT 5852 ATOM 33089 O WAT 5853 55.057 119.790 122.492 1.00 0.00 O ATOM 33090 H1 WAT 5853 55.339 120.578 122.957 1.00 0.00 H ATOM 33091 H2 WAT 5853 54.917 119.142 123.183 1.00 0.00 H TER 33093 WAT 5853 ATOM 33093 O WAT 5854 95.844 83.643 105.398 1.00 0.00 O ATOM 33094 H1 WAT 5854 95.979 83.827 106.327 1.00 0.00 H ATOM 33095 H2 WAT 5854 96.628 83.984 104.969 1.00 0.00 H TER 33097 WAT 5854 ATOM 33097 O WAT 5855 10.422 28.638 14.384 1.00 0.00 O ATOM 33098 H1 WAT 5855 9.521 28.960 14.412 1.00 0.00 H ATOM 33099 H2 WAT 5855 10.880 29.149 15.052 1.00 0.00 H TER 33101 WAT 5855 ATOM 33101 O WAT 5856 64.011 50.113 76.002 1.00 0.00 O ATOM 33102 H1 WAT 5856 63.417 50.345 75.288 1.00 0.00 H ATOM 33103 H2 WAT 5856 64.622 49.488 75.612 1.00 0.00 H TER 33105 WAT 5856 ATOM 33105 O WAT 5857 66.432 22.818 7.891 1.00 0.00 O ATOM 33106 H1 WAT 5857 65.638 23.233 7.557 1.00 0.00 H ATOM 33107 H2 WAT 5857 66.479 21.982 7.427 1.00 0.00 H TER 33109 WAT 5857 ATOM 33109 O WAT 5858 85.920 18.708 7.615 1.00 0.00 O ATOM 33110 H1 WAT 5858 86.028 17.757 7.586 1.00 0.00 H ATOM 33111 H2 WAT 5858 86.123 18.999 6.726 1.00 0.00 H TER 33113 WAT 5858 ATOM 33113 O WAT 5859 14.648 70.917 121.902 1.00 0.00 O ATOM 33114 H1 WAT 5859 14.240 71.148 121.068 1.00 0.00 H ATOM 33115 H2 WAT 5859 15.532 70.634 121.666 1.00 0.00 H TER 33117 WAT 5859 ATOM 33117 O WAT 5860 83.850 143.990 18.649 1.00 0.00 O ATOM 33118 H1 WAT 5860 83.983 144.866 18.289 1.00 0.00 H ATOM 33119 H2 WAT 5860 82.919 143.959 18.867 1.00 0.00 H TER 33121 WAT 5860 ATOM 33121 O WAT 5861 106.256 103.873 69.187 1.00 0.00 O ATOM 33122 H1 WAT 5861 106.593 104.399 68.461 1.00 0.00 H ATOM 33123 H2 WAT 5861 106.468 102.971 68.948 1.00 0.00 H TER 33125 WAT 5861 ATOM 33125 O WAT 5862 142.627 46.183 72.511 1.00 0.00 O ATOM 33126 H1 WAT 5862 143.433 45.889 72.934 1.00 0.00 H ATOM 33127 H2 WAT 5862 142.223 46.772 73.149 1.00 0.00 H TER 33129 WAT 5862 ATOM 33129 O WAT 5863 123.827 140.489 106.984 1.00 0.00 O ATOM 33130 H1 WAT 5863 124.068 140.589 106.063 1.00 0.00 H ATOM 33131 H2 WAT 5863 123.448 139.612 107.039 1.00 0.00 H TER 33133 WAT 5863 ATOM 33133 O WAT 5864 11.575 19.479 141.821 1.00 0.00 O ATOM 33134 H1 WAT 5864 11.339 19.721 142.717 1.00 0.00 H ATOM 33135 H2 WAT 5864 10.933 18.813 141.576 1.00 0.00 H TER 33137 WAT 5864 ATOM 33137 O WAT 5865 80.414 64.191 148.853 1.00 0.00 O ATOM 33138 H1 WAT 5865 80.604 65.034 148.442 1.00 0.00 H ATOM 33139 H2 WAT 5865 80.054 63.655 148.146 1.00 0.00 H TER 33141 WAT 5865 ATOM 33141 O WAT 5866 26.038 45.109 147.834 1.00 0.00 O ATOM 33142 H1 WAT 5866 26.661 45.818 147.992 1.00 0.00 H ATOM 33143 H2 WAT 5866 25.796 45.203 146.913 1.00 0.00 H TER 33145 WAT 5866 ATOM 33145 O WAT 5867 142.274 121.927 126.918 1.00 0.00 O ATOM 33146 H1 WAT 5867 142.193 120.975 126.971 1.00 0.00 H ATOM 33147 H2 WAT 5867 142.780 122.080 126.120 1.00 0.00 H TER 33149 WAT 5867 ATOM 33149 O WAT 5868 135.741 65.409 149.676 1.00 0.00 O ATOM 33150 H1 WAT 5868 135.025 64.774 149.654 1.00 0.00 H ATOM 33151 H2 WAT 5868 135.896 65.563 150.608 1.00 0.00 H TER 33153 WAT 5868 ATOM 33153 O WAT 5869 143.850 43.702 98.939 1.00 0.00 O ATOM 33154 H1 WAT 5869 144.623 43.338 98.507 1.00 0.00 H ATOM 33155 H2 WAT 5869 144.135 43.872 99.837 1.00 0.00 H TER 33157 WAT 5869 ATOM 33157 O WAT 5870 45.872 128.558 8.384 1.00 0.00 O ATOM 33158 H1 WAT 5870 46.744 128.239 8.149 1.00 0.00 H ATOM 33159 H2 WAT 5870 45.274 128.028 7.857 1.00 0.00 H TER 33161 WAT 5870 ATOM 33161 O WAT 5871 52.640 104.049 57.744 1.00 0.00 O ATOM 33162 H1 WAT 5871 53.424 104.571 57.576 1.00 0.00 H ATOM 33163 H2 WAT 5871 52.331 104.350 58.599 1.00 0.00 H TER 33165 WAT 5871 ATOM 33165 O WAT 5872 137.116 17.252 11.162 1.00 0.00 O ATOM 33166 H1 WAT 5872 136.655 16.430 11.334 1.00 0.00 H ATOM 33167 H2 WAT 5872 138.043 17.020 11.207 1.00 0.00 H TER 33169 WAT 5872 ATOM 33169 O WAT 5873 69.953 67.851 158.437 1.00 0.00 O ATOM 33170 H1 WAT 5873 69.459 67.710 157.629 1.00 0.00 H ATOM 33171 H2 WAT 5873 69.591 67.213 159.052 1.00 0.00 H TER 33173 WAT 5873 ATOM 33173 O WAT 5874 66.263 121.912 82.304 1.00 0.00 O ATOM 33174 H1 WAT 5874 66.324 121.060 82.736 1.00 0.00 H ATOM 33175 H2 WAT 5874 65.332 122.016 82.110 1.00 0.00 H TER 33177 WAT 5874 ATOM 33177 O WAT 5875 48.489 55.908 93.800 1.00 0.00 O ATOM 33178 H1 WAT 5875 47.956 55.599 94.532 1.00 0.00 H ATOM 33179 H2 WAT 5875 48.289 55.302 93.086 1.00 0.00 H TER 33181 WAT 5875 ATOM 33181 O WAT 5876 16.170 61.535 115.621 1.00 0.00 O ATOM 33182 H1 WAT 5876 15.952 61.721 116.534 1.00 0.00 H ATOM 33183 H2 WAT 5876 15.550 62.060 115.114 1.00 0.00 H TER 33185 WAT 5876 ATOM 33185 O WAT 5877 59.067 67.940 91.673 1.00 0.00 O ATOM 33186 H1 WAT 5877 58.427 68.564 92.015 1.00 0.00 H ATOM 33187 H2 WAT 5877 58.828 67.106 92.077 1.00 0.00 H TER 33189 WAT 5877 ATOM 33189 O WAT 5878 131.369 34.770 137.414 1.00 0.00 O ATOM 33190 H1 WAT 5878 131.353 33.886 137.049 1.00 0.00 H ATOM 33191 H2 WAT 5878 132.247 34.860 137.786 1.00 0.00 H TER 33193 WAT 5878 ATOM 33193 O WAT 5879 35.876 30.162 91.853 1.00 0.00 O ATOM 33194 H1 WAT 5879 36.136 29.628 91.102 1.00 0.00 H ATOM 33195 H2 WAT 5879 35.168 29.667 92.266 1.00 0.00 H TER 33197 WAT 5879 ATOM 33197 O WAT 5880 70.495 36.852 73.912 1.00 0.00 O ATOM 33198 H1 WAT 5880 70.523 37.307 73.071 1.00 0.00 H ATOM 33199 H2 WAT 5880 71.407 36.620 74.089 1.00 0.00 H TER 33201 WAT 5880 ATOM 33201 O WAT 5881 87.939 65.129 94.682 1.00 0.00 O ATOM 33202 H1 WAT 5881 87.430 65.934 94.778 1.00 0.00 H ATOM 33203 H2 WAT 5881 87.683 64.785 93.826 1.00 0.00 H TER 33205 WAT 5881 ATOM 33205 O WAT 5882 31.494 99.590 86.201 1.00 0.00 O ATOM 33206 H1 WAT 5882 31.587 100.543 86.185 1.00 0.00 H ATOM 33207 H2 WAT 5882 31.083 99.376 85.363 1.00 0.00 H TER 33209 WAT 5882 ATOM 33209 O WAT 5883 128.348 134.829 122.931 1.00 0.00 O ATOM 33210 H1 WAT 5883 128.446 133.886 122.794 1.00 0.00 H ATOM 33211 H2 WAT 5883 128.890 135.227 122.249 1.00 0.00 H TER 33213 WAT 5883 ATOM 33213 O WAT 5884 80.507 23.372 82.119 1.00 0.00 O ATOM 33214 H1 WAT 5884 80.763 22.463 82.275 1.00 0.00 H ATOM 33215 H2 WAT 5884 79.915 23.581 82.842 1.00 0.00 H TER 33217 WAT 5884 ATOM 33217 O WAT 5885 90.398 69.472 139.186 1.00 0.00 O ATOM 33218 H1 WAT 5885 91.294 69.693 139.442 1.00 0.00 H ATOM 33219 H2 WAT 5885 89.907 70.284 139.305 1.00 0.00 H TER 33221 WAT 5885 ATOM 33221 O WAT 5886 76.271 0.806 2.879 1.00 0.00 O ATOM 33222 H1 WAT 5886 76.983 1.422 2.705 1.00 0.00 H ATOM 33223 H2 WAT 5886 76.711 0.007 3.170 1.00 0.00 H TER 33225 WAT 5886 ATOM 33225 O WAT 5887 69.598 23.210 69.700 1.00 0.00 O ATOM 33226 H1 WAT 5887 69.564 23.697 68.877 1.00 0.00 H ATOM 33227 H2 WAT 5887 69.872 23.858 70.350 1.00 0.00 H TER 33229 WAT 5887 ATOM 33229 O WAT 5888 10.254 134.113 87.609 1.00 0.00 O ATOM 33230 H1 WAT 5888 10.934 133.986 88.271 1.00 0.00 H ATOM 33231 H2 WAT 5888 10.616 134.774 87.018 1.00 0.00 H TER 33233 WAT 5888 ATOM 33233 O WAT 5889 80.036 68.210 153.582 1.00 0.00 O ATOM 33234 H1 WAT 5889 80.769 67.914 153.042 1.00 0.00 H ATOM 33235 H2 WAT 5889 80.051 67.631 154.344 1.00 0.00 H TER 33237 WAT 5889 ATOM 33237 O WAT 5890 143.246 79.344 124.718 1.00 0.00 O ATOM 33238 H1 WAT 5890 143.515 79.820 123.933 1.00 0.00 H ATOM 33239 H2 WAT 5890 143.116 78.444 124.420 1.00 0.00 H TER 33241 WAT 5890 ATOM 33241 O WAT 5891 96.558 12.396 103.072 1.00 0.00 O ATOM 33242 H1 WAT 5891 95.889 12.086 102.461 1.00 0.00 H ATOM 33243 H2 WAT 5891 97.072 11.616 103.280 1.00 0.00 H TER 33245 WAT 5891 ATOM 33245 O WAT 5892 27.338 122.337 82.441 1.00 0.00 O ATOM 33246 H1 WAT 5892 26.680 123.007 82.628 1.00 0.00 H ATOM 33247 H2 WAT 5892 28.165 122.728 82.722 1.00 0.00 H TER 33249 WAT 5892 ATOM 33249 O WAT 5893 69.625 76.964 62.930 1.00 0.00 O ATOM 33250 H1 WAT 5893 70.216 77.058 63.677 1.00 0.00 H ATOM 33251 H2 WAT 5893 68.875 76.481 63.277 1.00 0.00 H TER 33253 WAT 5893 ATOM 33253 O WAT 5894 54.669 132.196 90.864 1.00 0.00 O ATOM 33254 H1 WAT 5894 54.433 133.038 90.474 1.00 0.00 H ATOM 33255 H2 WAT 5894 55.443 131.914 90.377 1.00 0.00 H TER 33257 WAT 5894 ATOM 33257 O WAT 5895 99.128 33.777 102.742 1.00 0.00 O ATOM 33258 H1 WAT 5895 99.445 33.896 103.637 1.00 0.00 H ATOM 33259 H2 WAT 5895 99.642 34.395 102.222 1.00 0.00 H TER 33261 WAT 5895 ATOM 33261 O WAT 5896 60.624 144.512 158.467 1.00 0.00 O ATOM 33262 H1 WAT 5896 60.503 143.635 158.103 1.00 0.00 H ATOM 33263 H2 WAT 5896 61.571 144.595 158.581 1.00 0.00 H TER 33265 WAT 5896 ATOM 33265 O WAT 5897 111.764 142.358 147.673 1.00 0.00 O ATOM 33266 H1 WAT 5897 111.096 143.025 147.515 1.00 0.00 H ATOM 33267 H2 WAT 5897 111.969 142.013 146.804 1.00 0.00 H TER 33269 WAT 5897 ATOM 33269 O WAT 5898 28.602 41.350 80.086 1.00 0.00 O ATOM 33270 H1 WAT 5898 27.814 41.869 80.246 1.00 0.00 H ATOM 33271 H2 WAT 5898 29.217 41.635 80.763 1.00 0.00 H TER 33273 WAT 5898 ATOM 33273 O WAT 5899 27.406 63.021 7.681 1.00 0.00 O ATOM 33274 H1 WAT 5899 26.826 63.725 7.971 1.00 0.00 H ATOM 33275 H2 WAT 5899 28.130 63.035 8.307 1.00 0.00 H TER 33277 WAT 5899 ATOM 33277 O WAT 5900 85.091 83.266 97.150 1.00 0.00 O ATOM 33278 H1 WAT 5900 85.338 82.791 96.356 1.00 0.00 H ATOM 33279 H2 WAT 5900 85.613 84.067 97.122 1.00 0.00 H TER 33281 WAT 5900 ATOM 33281 O WAT 5901 55.328 143.355 62.550 1.00 0.00 O ATOM 33282 H1 WAT 5901 55.250 142.435 62.801 1.00 0.00 H ATOM 33283 H2 WAT 5901 54.607 143.790 63.005 1.00 0.00 H TER 33285 WAT 5901 ATOM 33285 O WAT 5902 32.403 45.257 132.546 1.00 0.00 O ATOM 33286 H1 WAT 5902 33.322 45.030 132.401 1.00 0.00 H ATOM 33287 H2 WAT 5902 32.022 44.473 132.942 1.00 0.00 H TER 33289 WAT 5902 ATOM 33289 O WAT 5903 3.309 22.093 158.712 1.00 0.00 O ATOM 33290 H1 WAT 5903 3.410 22.832 158.111 1.00 0.00 H ATOM 33291 H2 WAT 5903 3.107 21.349 158.145 1.00 0.00 H TER 33293 WAT 5903 ATOM 33293 O WAT 5904 94.616 19.965 110.225 1.00 0.00 O ATOM 33294 H1 WAT 5904 94.566 19.012 110.142 1.00 0.00 H ATOM 33295 H2 WAT 5904 94.268 20.148 111.098 1.00 0.00 H TER 33297 WAT 5904 ATOM 33297 O WAT 5905 32.627 36.864 117.354 1.00 0.00 O ATOM 33298 H1 WAT 5905 32.088 37.636 117.182 1.00 0.00 H ATOM 33299 H2 WAT 5905 32.485 36.675 118.281 1.00 0.00 H TER 33301 WAT 5905 ATOM 33301 O WAT 5906 8.002 50.182 139.310 1.00 0.00 O ATOM 33302 H1 WAT 5906 7.099 49.943 139.100 1.00 0.00 H ATOM 33303 H2 WAT 5906 8.509 49.896 138.550 1.00 0.00 H TER 33305 WAT 5906 ATOM 33305 O WAT 5907 108.387 94.596 156.412 1.00 0.00 O ATOM 33306 H1 WAT 5907 108.544 94.731 155.477 1.00 0.00 H ATOM 33307 H2 WAT 5907 107.543 94.147 156.451 1.00 0.00 H TER 33309 WAT 5907 ATOM 33309 O WAT 5908 93.633 104.048 99.848 1.00 0.00 O ATOM 33310 H1 WAT 5908 92.822 103.753 100.262 1.00 0.00 H ATOM 33311 H2 WAT 5908 93.366 104.334 98.975 1.00 0.00 H TER 33313 WAT 5908 ATOM 33313 O WAT 5909 33.555 28.416 21.510 1.00 0.00 O ATOM 33314 H1 WAT 5909 32.947 27.926 22.063 1.00 0.00 H ATOM 33315 H2 WAT 5909 33.063 28.590 20.708 1.00 0.00 H TER 33317 WAT 5909 ATOM 33317 O WAT 5910 137.850 84.010 130.141 1.00 0.00 O ATOM 33318 H1 WAT 5910 137.291 84.786 130.099 1.00 0.00 H ATOM 33319 H2 WAT 5910 138.527 84.236 130.779 1.00 0.00 H TER 33321 WAT 5910 ATOM 33321 O WAT 5911 47.011 24.268 132.955 1.00 0.00 O ATOM 33322 H1 WAT 5911 47.436 24.669 132.197 1.00 0.00 H ATOM 33323 H2 WAT 5911 47.359 24.748 133.706 1.00 0.00 H TER 33325 WAT 5911 ATOM 33325 O WAT 5912 55.216 87.399 158.619 1.00 0.00 O ATOM 33326 H1 WAT 5912 55.232 86.805 159.369 1.00 0.00 H ATOM 33327 H2 WAT 5912 56.085 87.313 158.227 1.00 0.00 H TER 33329 WAT 5912 ATOM 33329 O WAT 5913 86.419 77.553 144.958 1.00 0.00 O ATOM 33330 H1 WAT 5913 86.435 78.479 144.716 1.00 0.00 H ATOM 33331 H2 WAT 5913 86.154 77.101 144.157 1.00 0.00 H TER 33333 WAT 5913 ATOM 33333 O WAT 5914 0.555 95.472 8.797 1.00 0.00 O ATOM 33334 H1 WAT 5914 0.739 95.396 9.733 1.00 0.00 H ATOM 33335 H2 WAT 5914 1.263 96.020 8.457 1.00 0.00 H TER 33337 WAT 5914 ATOM 33337 O WAT 5915 51.121 118.971 6.793 1.00 0.00 O ATOM 33338 H1 WAT 5915 50.774 119.474 7.530 1.00 0.00 H ATOM 33339 H2 WAT 5915 51.890 118.526 7.147 1.00 0.00 H TER 33341 WAT 5915 ATOM 33341 O WAT 5916 56.133 75.934 112.135 1.00 0.00 O ATOM 33342 H1 WAT 5916 55.403 75.770 112.732 1.00 0.00 H ATOM 33343 H2 WAT 5916 55.888 76.737 111.674 1.00 0.00 H TER 33345 WAT 5916 ATOM 33345 O WAT 5917 79.614 18.694 155.586 1.00 0.00 O ATOM 33346 H1 WAT 5917 78.781 18.687 156.057 1.00 0.00 H ATOM 33347 H2 WAT 5917 79.648 19.556 155.171 1.00 0.00 H TER 33349 WAT 5917 ATOM 33349 O WAT 5918 59.769 76.176 94.427 1.00 0.00 O ATOM 33350 H1 WAT 5918 58.918 76.613 94.462 1.00 0.00 H ATOM 33351 H2 WAT 5918 59.564 75.272 94.186 1.00 0.00 H TER 33353 WAT 5918 ATOM 33353 O WAT 5919 16.738 66.772 8.548 1.00 0.00 O ATOM 33354 H1 WAT 5919 17.646 66.472 8.597 1.00 0.00 H ATOM 33355 H2 WAT 5919 16.467 66.865 9.462 1.00 0.00 H TER 33357 WAT 5919 ATOM 33357 O WAT 5920 44.056 48.390 73.498 1.00 0.00 O ATOM 33358 H1 WAT 5920 43.840 48.914 72.726 1.00 0.00 H ATOM 33359 H2 WAT 5920 44.870 48.772 73.826 1.00 0.00 H TER 33361 WAT 5920 ATOM 33361 O WAT 5921 144.154 120.224 68.753 1.00 0.00 O ATOM 33362 H1 WAT 5921 143.301 120.107 69.172 1.00 0.00 H ATOM 33363 H2 WAT 5921 144.406 119.343 68.475 1.00 0.00 H TER 33365 WAT 5921 ATOM 33365 O WAT 5922 30.548 105.092 6.292 1.00 0.00 O ATOM 33366 H1 WAT 5922 30.233 105.300 5.412 1.00 0.00 H ATOM 33367 H2 WAT 5922 30.575 104.136 6.317 1.00 0.00 H TER 33369 WAT 5922 ATOM 33369 O WAT 5923 54.711 27.271 71.203 1.00 0.00 O ATOM 33370 H1 WAT 5923 55.581 27.593 70.966 1.00 0.00 H ATOM 33371 H2 WAT 5923 54.776 26.320 71.117 1.00 0.00 H TER 33373 WAT 5923 ATOM 33373 O WAT 5924 63.632 135.852 105.052 1.00 0.00 O ATOM 33374 H1 WAT 5924 64.135 135.784 105.863 1.00 0.00 H ATOM 33375 H2 WAT 5924 64.280 136.080 104.386 1.00 0.00 H TER 33377 WAT 5924 ATOM 33377 O WAT 5925 133.354 132.489 124.443 1.00 0.00 O ATOM 33378 H1 WAT 5925 133.474 133.428 124.588 1.00 0.00 H ATOM 33379 H2 WAT 5925 134.042 132.254 123.819 1.00 0.00 H TER 33381 WAT 5925 ATOM 33381 O WAT 5926 128.508 43.548 90.300 1.00 0.00 O ATOM 33382 H1 WAT 5926 129.019 42.743 90.394 1.00 0.00 H ATOM 33383 H2 WAT 5926 129.004 44.204 90.789 1.00 0.00 H TER 33385 WAT 5926 ATOM 33385 O WAT 5927 119.037 54.425 5.463 1.00 0.00 O ATOM 33386 H1 WAT 5927 118.866 54.082 6.340 1.00 0.00 H ATOM 33387 H2 WAT 5927 118.232 54.250 4.976 1.00 0.00 H TER 33389 WAT 5927 ATOM 33389 O WAT 5928 109.580 26.589 18.498 1.00 0.00 O ATOM 33390 H1 WAT 5928 109.620 25.779 19.007 1.00 0.00 H ATOM 33391 H2 WAT 5928 109.007 27.163 19.006 1.00 0.00 H TER 33393 WAT 5928 ATOM 33393 O WAT 5929 39.221 -0.071 127.498 1.00 0.00 O ATOM 33394 H1 WAT 5929 38.962 0.678 126.962 1.00 0.00 H ATOM 33395 H2 WAT 5929 40.094 -0.302 127.181 1.00 0.00 H TER 33397 WAT 5929 ATOM 33397 O WAT 5930 57.001 3.135 88.176 1.00 0.00 O ATOM 33398 H1 WAT 5930 56.222 3.666 88.011 1.00 0.00 H ATOM 33399 H2 WAT 5930 57.537 3.246 87.390 1.00 0.00 H TER 33401 WAT 5930 ATOM 33401 O WAT 5931 85.656 116.768 120.427 1.00 0.00 O ATOM 33402 H1 WAT 5931 85.128 116.871 119.635 1.00 0.00 H ATOM 33403 H2 WAT 5931 86.545 116.994 120.153 1.00 0.00 H TER 33405 WAT 5931 ATOM 33405 O WAT 5932 22.036 72.391 72.952 1.00 0.00 O ATOM 33406 H1 WAT 5932 21.183 71.957 72.967 1.00 0.00 H ATOM 33407 H2 WAT 5932 22.642 71.716 72.645 1.00 0.00 H TER 33409 WAT 5932 ATOM 33409 O WAT 5933 122.944 70.103 134.453 1.00 0.00 O ATOM 33410 H1 WAT 5933 123.185 70.180 133.530 1.00 0.00 H ATOM 33411 H2 WAT 5933 123.448 70.789 134.891 1.00 0.00 H TER 33413 WAT 5933 ATOM 33413 O WAT 5934 97.140 143.513 55.390 1.00 0.00 O ATOM 33414 H1 WAT 5934 97.884 143.286 55.948 1.00 0.00 H ATOM 33415 H2 WAT 5934 96.436 142.934 55.682 1.00 0.00 H TER 33417 WAT 5934 ATOM 33417 O WAT 5935 99.226 84.703 148.678 1.00 0.00 O ATOM 33418 H1 WAT 5935 98.875 84.670 149.568 1.00 0.00 H ATOM 33419 H2 WAT 5935 99.850 85.428 148.693 1.00 0.00 H TER 33421 WAT 5935 ATOM 33421 O WAT 5936 126.172 55.502 157.380 1.00 0.00 O ATOM 33422 H1 WAT 5936 125.921 56.157 156.729 1.00 0.00 H ATOM 33423 H2 WAT 5936 125.965 55.908 158.221 1.00 0.00 H TER 33425 WAT 5936 ATOM 33425 O WAT 5937 73.578 15.217 151.974 1.00 0.00 O ATOM 33426 H1 WAT 5937 73.848 14.984 152.862 1.00 0.00 H ATOM 33427 H2 WAT 5937 74.370 15.569 151.568 1.00 0.00 H TER 33429 WAT 5937 ATOM 33429 O WAT 5938 143.486 45.165 158.063 1.00 0.00 O ATOM 33430 H1 WAT 5938 143.052 44.995 158.899 1.00 0.00 H ATOM 33431 H2 WAT 5938 144.395 44.905 158.207 1.00 0.00 H TER 33433 WAT 5938 ATOM 33433 O WAT 5939 19.043 121.371 155.295 1.00 0.00 O ATOM 33434 H1 WAT 5939 18.654 120.634 155.766 1.00 0.00 H ATOM 33435 H2 WAT 5939 18.520 121.448 154.497 1.00 0.00 H TER 33437 WAT 5939 ATOM 33437 O WAT 5940 138.227 70.274 121.231 1.00 0.00 O ATOM 33438 H1 WAT 5940 137.879 71.144 121.034 1.00 0.00 H ATOM 33439 H2 WAT 5940 138.743 70.398 122.028 1.00 0.00 H TER 33441 WAT 5940 ATOM 33441 O WAT 5941 64.676 61.578 131.761 1.00 0.00 O ATOM 33442 H1 WAT 5941 64.400 62.384 132.197 1.00 0.00 H ATOM 33443 H2 WAT 5941 63.858 61.152 131.505 1.00 0.00 H TER 33445 WAT 5941 ATOM 33445 O WAT 5942 39.617 0.638 70.761 1.00 0.00 O ATOM 33446 H1 WAT 5942 39.515 0.978 71.650 1.00 0.00 H ATOM 33447 H2 WAT 5942 40.187 1.272 70.326 1.00 0.00 H TER 33449 WAT 5942 ATOM 33449 O WAT 5943 95.402 105.021 101.668 1.00 0.00 O ATOM 33450 H1 WAT 5943 94.703 104.767 101.065 1.00 0.00 H ATOM 33451 H2 WAT 5943 95.113 104.698 102.521 1.00 0.00 H TER 33453 WAT 5943 ATOM 33453 O WAT 5944 8.013 117.664 111.202 1.00 0.00 O ATOM 33454 H1 WAT 5944 8.012 117.049 111.936 1.00 0.00 H ATOM 33455 H2 WAT 5944 8.310 117.144 110.455 1.00 0.00 H TER 33457 WAT 5944 ATOM 33457 O WAT 5945 45.513 93.040 27.309 1.00 0.00 O ATOM 33458 H1 WAT 5945 46.185 92.484 26.914 1.00 0.00 H ATOM 33459 H2 WAT 5945 44.749 92.470 27.393 1.00 0.00 H TER 33461 WAT 5945 ATOM 33461 O WAT 5946 1.001 127.153 152.858 1.00 0.00 O ATOM 33462 H1 WAT 5946 1.262 126.492 152.216 1.00 0.00 H ATOM 33463 H2 WAT 5946 0.046 127.102 152.879 1.00 0.00 H TER 33465 WAT 5946 ATOM 33465 O WAT 5947 22.601 101.166 103.557 1.00 0.00 O ATOM 33466 H1 WAT 5947 22.185 100.531 102.974 1.00 0.00 H ATOM 33467 H2 WAT 5947 21.870 101.597 104.001 1.00 0.00 H TER 33469 WAT 5947 ATOM 33469 O WAT 5948 8.230 96.948 7.411 1.00 0.00 O ATOM 33470 H1 WAT 5948 8.280 97.829 7.039 1.00 0.00 H ATOM 33471 H2 WAT 5948 7.898 96.405 6.696 1.00 0.00 H TER 33473 WAT 5948 ATOM 33473 O WAT 5949 47.862 138.239 153.477 1.00 0.00 O ATOM 33474 H1 WAT 5949 48.178 137.956 152.619 1.00 0.00 H ATOM 33475 H2 WAT 5949 47.170 138.871 153.281 1.00 0.00 H TER 33477 WAT 5949 ATOM 33477 O WAT 5950 29.285 89.692 133.710 1.00 0.00 O ATOM 33478 H1 WAT 5950 29.680 90.054 134.503 1.00 0.00 H ATOM 33479 H2 WAT 5950 29.711 88.843 133.596 1.00 0.00 H TER 33481 WAT 5950 ATOM 33481 O WAT 5951 137.237 112.233 136.535 1.00 0.00 O ATOM 33482 H1 WAT 5951 137.113 111.682 137.308 1.00 0.00 H ATOM 33483 H2 WAT 5951 137.180 111.627 135.797 1.00 0.00 H TER 33485 WAT 5951 ATOM 33485 O WAT 5952 109.039 115.616 1.377 1.00 0.00 O ATOM 33486 H1 WAT 5952 108.564 115.409 2.181 1.00 0.00 H ATOM 33487 H2 WAT 5952 109.180 114.768 0.957 1.00 0.00 H TER 33489 WAT 5952 ATOM 33489 O WAT 5953 67.072 118.639 76.752 1.00 0.00 O ATOM 33490 H1 WAT 5953 67.843 119.199 76.846 1.00 0.00 H ATOM 33491 H2 WAT 5953 67.265 117.872 77.291 1.00 0.00 H TER 33493 WAT 5953 ATOM 33493 O WAT 5954 23.267 104.607 94.638 1.00 0.00 O ATOM 33494 H1 WAT 5954 23.333 103.900 93.996 1.00 0.00 H ATOM 33495 H2 WAT 5954 24.172 104.883 94.784 1.00 0.00 H TER 33497 WAT 5954 ATOM 33497 O WAT 5955 74.340 12.161 144.250 1.00 0.00 O ATOM 33498 H1 WAT 5955 74.812 12.933 144.563 1.00 0.00 H ATOM 33499 H2 WAT 5955 74.055 11.715 145.047 1.00 0.00 H TER 33501 WAT 5955 ATOM 33501 O WAT 5956 65.360 15.288 86.741 1.00 0.00 O ATOM 33502 H1 WAT 5956 64.508 15.559 87.083 1.00 0.00 H ATOM 33503 H2 WAT 5956 65.268 15.352 85.791 1.00 0.00 H TER 33505 WAT 5956 ATOM 33505 O WAT 5957 125.056 68.228 131.830 1.00 0.00 O ATOM 33506 H1 WAT 5957 125.488 68.267 132.683 1.00 0.00 H ATOM 33507 H2 WAT 5957 124.776 67.317 131.745 1.00 0.00 H TER 33509 WAT 5957 ATOM 33509 O WAT 5958 66.111 103.322 155.923 1.00 0.00 O ATOM 33510 H1 WAT 5958 67.055 103.427 155.807 1.00 0.00 H ATOM 33511 H2 WAT 5958 66.026 102.672 156.620 1.00 0.00 H TER 33513 WAT 5958 ATOM 33513 O WAT 5959 92.638 6.330 158.652 1.00 0.00 O ATOM 33514 H1 WAT 5959 92.230 7.166 158.881 1.00 0.00 H ATOM 33515 H2 WAT 5959 93.173 6.528 157.883 1.00 0.00 H TER 33517 WAT 5959 ATOM 33517 O WAT 5960 52.196 7.309 90.806 1.00 0.00 O ATOM 33518 H1 WAT 5960 52.654 7.710 90.067 1.00 0.00 H ATOM 33519 H2 WAT 5960 52.243 7.964 91.502 1.00 0.00 H TER 33521 WAT 5960 ATOM 33521 O WAT 5961 78.951 30.054 86.998 1.00 0.00 O ATOM 33522 H1 WAT 5961 79.494 29.294 86.789 1.00 0.00 H ATOM 33523 H2 WAT 5961 78.795 29.986 87.940 1.00 0.00 H TER 33525 WAT 5961 ATOM 33525 O WAT 5962 58.858 46.275 72.095 1.00 0.00 O ATOM 33526 H1 WAT 5962 58.576 45.563 72.670 1.00 0.00 H ATOM 33527 H2 WAT 5962 59.790 46.114 71.953 1.00 0.00 H TER 33529 WAT 5962 ATOM 33529 O WAT 5963 27.507 102.465 81.047 1.00 0.00 O ATOM 33530 H1 WAT 5963 28.224 103.090 81.152 1.00 0.00 H ATOM 33531 H2 WAT 5963 27.936 101.650 80.786 1.00 0.00 H TER 33533 WAT 5963 ATOM 33533 O WAT 5964 31.685 12.821 134.129 1.00 0.00 O ATOM 33534 H1 WAT 5964 31.428 13.722 134.327 1.00 0.00 H ATOM 33535 H2 WAT 5964 32.081 12.870 133.259 1.00 0.00 H TER 33537 WAT 5964 ATOM 33537 O WAT 5965 68.265 0.871 137.302 1.00 0.00 O ATOM 33538 H1 WAT 5965 69.190 0.916 137.543 1.00 0.00 H ATOM 33539 H2 WAT 5965 68.012 -0.033 137.492 1.00 0.00 H TER 33541 WAT 5965 ATOM 33541 O WAT 5966 25.643 106.553 7.430 1.00 0.00 O ATOM 33542 H1 WAT 5966 26.264 106.606 6.704 1.00 0.00 H ATOM 33543 H2 WAT 5966 24.786 106.492 7.009 1.00 0.00 H TER 33545 WAT 5966 ATOM 33545 O WAT 5967 0.966 74.703 6.244 1.00 0.00 O ATOM 33546 H1 WAT 5967 1.673 74.916 6.853 1.00 0.00 H ATOM 33547 H2 WAT 5967 1.162 75.217 5.460 1.00 0.00 H TER 33549 WAT 5967 ATOM 33549 O WAT 5968 40.611 117.366 135.835 1.00 0.00 O ATOM 33550 H1 WAT 5968 39.884 117.185 135.239 1.00 0.00 H ATOM 33551 H2 WAT 5968 40.689 118.320 135.834 1.00 0.00 H TER 33553 WAT 5968 ATOM 33553 O WAT 5969 136.124 46.392 63.202 1.00 0.00 O ATOM 33554 H1 WAT 5969 136.665 45.702 63.587 1.00 0.00 H ATOM 33555 H2 WAT 5969 135.231 46.049 63.246 1.00 0.00 H TER 33557 WAT 5969 ATOM 33557 O WAT 5970 92.671 125.248 10.249 1.00 0.00 O ATOM 33558 H1 WAT 5970 91.914 124.803 9.869 1.00 0.00 H ATOM 33559 H2 WAT 5970 92.994 125.813 9.547 1.00 0.00 H TER 33561 WAT 5970 ATOM 33561 O WAT 5971 35.340 138.267 91.253 1.00 0.00 O ATOM 33562 H1 WAT 5971 35.086 137.679 91.965 1.00 0.00 H ATOM 33563 H2 WAT 5971 35.961 138.875 91.654 1.00 0.00 H TER 33565 WAT 5971 ATOM 33565 O WAT 5972 134.184 105.654 61.896 1.00 0.00 O ATOM 33566 H1 WAT 5972 133.591 105.947 61.205 1.00 0.00 H ATOM 33567 H2 WAT 5972 134.895 105.214 61.431 1.00 0.00 H TER 33569 WAT 5972 ATOM 33569 O WAT 5973 13.226 134.094 97.096 1.00 0.00 O ATOM 33570 H1 WAT 5973 12.675 133.312 97.053 1.00 0.00 H ATOM 33571 H2 WAT 5973 14.106 133.759 97.266 1.00 0.00 H TER 33573 WAT 5973 ATOM 33573 O WAT 5974 125.348 97.764 152.049 1.00 0.00 O ATOM 33574 H1 WAT 5974 125.417 97.860 151.099 1.00 0.00 H ATOM 33575 H2 WAT 5974 126.156 97.320 152.304 1.00 0.00 H TER 33577 WAT 5974 ATOM 33577 O WAT 5975 28.073 121.250 127.861 1.00 0.00 O ATOM 33578 H1 WAT 5975 27.445 121.940 127.644 1.00 0.00 H ATOM 33579 H2 WAT 5975 28.457 121.530 128.692 1.00 0.00 H TER 33581 WAT 5975 ATOM 33581 O WAT 5976 81.099 101.494 133.919 1.00 0.00 O ATOM 33582 H1 WAT 5976 82.036 101.561 133.735 1.00 0.00 H ATOM 33583 H2 WAT 5976 81.054 101.058 134.770 1.00 0.00 H TER 33585 WAT 5976 ATOM 33585 O WAT 5977 15.323 66.998 138.178 1.00 0.00 O ATOM 33586 H1 WAT 5977 14.498 66.712 137.784 1.00 0.00 H ATOM 33587 H2 WAT 5977 15.103 67.174 139.092 1.00 0.00 H TER 33589 WAT 5977 ATOM 33589 O WAT 5978 3.400 124.797 154.199 1.00 0.00 O ATOM 33590 H1 WAT 5978 3.268 124.481 155.092 1.00 0.00 H ATOM 33591 H2 WAT 5978 3.193 125.730 154.241 1.00 0.00 H TER 33593 WAT 5978 ATOM 33593 O WAT 5979 89.501 9.475 151.034 1.00 0.00 O ATOM 33594 H1 WAT 5979 88.605 9.549 150.704 1.00 0.00 H ATOM 33595 H2 WAT 5979 89.608 8.543 151.226 1.00 0.00 H TER 33597 WAT 5979 ATOM 33597 O WAT 5980 8.350 121.784 126.725 1.00 0.00 O ATOM 33598 H1 WAT 5980 8.546 121.960 125.804 1.00 0.00 H ATOM 33599 H2 WAT 5980 7.551 121.256 126.703 1.00 0.00 H TER 33601 WAT 5980 ATOM 33601 O WAT 5981 60.136 30.293 80.618 1.00 0.00 O ATOM 33602 H1 WAT 5981 61.034 30.264 80.948 1.00 0.00 H ATOM 33603 H2 WAT 5981 60.225 30.199 79.670 1.00 0.00 H TER 33605 WAT 5981 ATOM 33605 O WAT 5982 69.286 131.948 94.041 1.00 0.00 O ATOM 33606 H1 WAT 5982 69.847 132.417 94.659 1.00 0.00 H ATOM 33607 H2 WAT 5982 68.396 132.107 94.355 1.00 0.00 H TER 33609 WAT 5982 ATOM 33609 O WAT 5983 80.432 41.650 100.347 1.00 0.00 O ATOM 33610 H1 WAT 5983 81.064 40.951 100.183 1.00 0.00 H ATOM 33611 H2 WAT 5983 80.700 42.358 99.760 1.00 0.00 H TER 33613 WAT 5983 ATOM 33613 O WAT 5984 124.907 32.060 144.633 1.00 0.00 O ATOM 33614 H1 WAT 5984 124.072 32.449 144.374 1.00 0.00 H ATOM 33615 H2 WAT 5984 124.944 31.232 144.153 1.00 0.00 H TER 33617 WAT 5984 ATOM 33617 O WAT 5985 111.974 133.266 8.250 1.00 0.00 O ATOM 33618 H1 WAT 5985 111.916 133.896 7.532 1.00 0.00 H ATOM 33619 H2 WAT 5985 112.362 132.487 7.854 1.00 0.00 H TER 33621 WAT 5985 ATOM 33621 O WAT 5986 6.680 108.326 73.757 1.00 0.00 O ATOM 33622 H1 WAT 5986 6.800 108.205 72.815 1.00 0.00 H ATOM 33623 H2 WAT 5986 7.293 107.711 74.158 1.00 0.00 H TER 33625 WAT 5986 ATOM 33625 O WAT 5987 38.913 99.691 116.161 1.00 0.00 O ATOM 33626 H1 WAT 5987 39.583 100.356 116.321 1.00 0.00 H ATOM 33627 H2 WAT 5987 39.407 98.896 115.962 1.00 0.00 H TER 33629 WAT 5987 ATOM 33629 O WAT 5988 126.649 102.923 114.363 1.00 0.00 O ATOM 33630 H1 WAT 5988 126.317 103.260 115.195 1.00 0.00 H ATOM 33631 H2 WAT 5988 126.723 101.978 114.500 1.00 0.00 H TER 33633 WAT 5988 ATOM 33633 O WAT 5989 48.665 57.290 128.708 1.00 0.00 O ATOM 33634 H1 WAT 5989 49.445 57.464 129.235 1.00 0.00 H ATOM 33635 H2 WAT 5989 48.166 58.106 128.741 1.00 0.00 H TER 33637 WAT 5989 ATOM 33637 O WAT 5990 134.388 101.326 22.568 1.00 0.00 O ATOM 33638 H1 WAT 5990 133.702 101.463 23.222 1.00 0.00 H ATOM 33639 H2 WAT 5990 135.197 101.274 23.077 1.00 0.00 H TER 33641 WAT 5990 ATOM 33641 O WAT 5991 135.866 11.931 3.549 1.00 0.00 O ATOM 33642 H1 WAT 5991 135.444 12.143 2.716 1.00 0.00 H ATOM 33643 H2 WAT 5991 135.536 12.591 4.159 1.00 0.00 H TER 33645 WAT 5991 ATOM 33645 O WAT 5992 0.403 23.272 135.854 1.00 0.00 O ATOM 33646 H1 WAT 5992 1.049 23.038 135.187 1.00 0.00 H ATOM 33647 H2 WAT 5992 0.445 22.558 136.490 1.00 0.00 H TER 33649 WAT 5992 ATOM 33649 O WAT 5993 9.128 69.220 5.958 1.00 0.00 O ATOM 33650 H1 WAT 5993 9.281 68.275 5.990 1.00 0.00 H ATOM 33651 H2 WAT 5993 8.666 69.360 5.131 1.00 0.00 H TER 33653 WAT 5993 ATOM 33653 O WAT 5994 10.826 72.603 115.478 1.00 0.00 O ATOM 33654 H1 WAT 5994 11.634 72.702 115.981 1.00 0.00 H ATOM 33655 H2 WAT 5994 11.049 71.984 114.784 1.00 0.00 H TER 33657 WAT 5994 ATOM 33657 O WAT 5995 23.715 32.204 131.560 1.00 0.00 O ATOM 33658 H1 WAT 5995 24.178 31.603 130.978 1.00 0.00 H ATOM 33659 H2 WAT 5995 23.163 31.638 132.099 1.00 0.00 H TER 33661 WAT 5995 ATOM 33661 O WAT 5996 30.424 82.424 17.355 1.00 0.00 O ATOM 33662 H1 WAT 5996 30.791 83.301 17.461 1.00 0.00 H ATOM 33663 H2 WAT 5996 29.542 82.573 17.014 1.00 0.00 H TER 33665 WAT 5996 ATOM 33665 O WAT 5997 120.416 89.562 116.848 1.00 0.00 O ATOM 33666 H1 WAT 5997 121.096 89.964 116.307 1.00 0.00 H ATOM 33667 H2 WAT 5997 119.759 90.249 116.958 1.00 0.00 H TER 33669 WAT 5997 ATOM 33669 O WAT 5998 23.900 35.073 119.335 1.00 0.00 O ATOM 33670 H1 WAT 5998 24.368 34.837 120.136 1.00 0.00 H ATOM 33671 H2 WAT 5998 24.198 35.961 119.135 1.00 0.00 H TER 33673 WAT 5998 ATOM 33673 O WAT 5999 122.216 45.895 67.573 1.00 0.00 O ATOM 33674 H1 WAT 5999 122.806 45.983 66.825 1.00 0.00 H ATOM 33675 H2 WAT 5999 122.782 45.994 68.339 1.00 0.00 H TER 33677 WAT 5999 ATOM 33677 O WAT 6000 69.865 44.747 137.898 1.00 0.00 O ATOM 33678 H1 WAT 6000 69.408 44.783 137.058 1.00 0.00 H ATOM 33679 H2 WAT 6000 70.776 44.944 137.685 1.00 0.00 H TER 33681 WAT 6000 ATOM 33681 O WAT 6001 120.352 17.094 120.344 1.00 0.00 O ATOM 33682 H1 WAT 6001 121.237 16.730 120.349 1.00 0.00 H ATOM 33683 H2 WAT 6001 120.140 17.197 119.416 1.00 0.00 H TER 33685 WAT 6001 ATOM 33685 O WAT 6002 93.885 3.703 140.408 1.00 0.00 O ATOM 33686 H1 WAT 6002 93.930 2.750 140.490 1.00 0.00 H ATOM 33687 H2 WAT 6002 94.166 3.880 139.510 1.00 0.00 H TER 33689 WAT 6002 ATOM 33689 O WAT 6003 85.367 122.177 143.193 1.00 0.00 O ATOM 33690 H1 WAT 6003 86.179 122.330 142.710 1.00 0.00 H ATOM 33691 H2 WAT 6003 84.723 121.963 142.518 1.00 0.00 H TER 33693 WAT 6003 ATOM 33693 O WAT 6004 41.390 40.488 113.981 1.00 0.00 O ATOM 33694 H1 WAT 6004 41.250 40.283 114.905 1.00 0.00 H ATOM 33695 H2 WAT 6004 42.012 41.216 113.989 1.00 0.00 H TER 33697 WAT 6004 ATOM 33697 O WAT 6005 127.503 0.644 145.406 1.00 0.00 O ATOM 33698 H1 WAT 6005 127.965 -0.166 145.190 1.00 0.00 H ATOM 33699 H2 WAT 6005 127.524 1.154 144.597 1.00 0.00 H TER 33701 WAT 6005 ATOM 33701 O WAT 6006 92.388 144.939 112.585 1.00 0.00 O ATOM 33702 H1 WAT 6006 92.551 145.061 113.521 1.00 0.00 H ATOM 33703 H2 WAT 6006 92.300 145.827 112.239 1.00 0.00 H TER 33705 WAT 6006 ATOM 33705 O WAT 6007 120.421 126.107 5.471 1.00 0.00 O ATOM 33706 H1 WAT 6007 120.355 125.809 4.564 1.00 0.00 H ATOM 33707 H2 WAT 6007 119.523 126.331 5.715 1.00 0.00 H TER 33709 WAT 6007 ATOM 33709 O WAT 6008 39.352 122.258 71.714 1.00 0.00 O ATOM 33710 H1 WAT 6008 39.050 122.036 72.595 1.00 0.00 H ATOM 33711 H2 WAT 6008 38.588 122.119 71.156 1.00 0.00 H TER 33713 WAT 6008 ATOM 33713 O WAT 6009 125.430 142.473 140.031 1.00 0.00 O ATOM 33714 H1 WAT 6009 124.751 141.800 139.993 1.00 0.00 H ATOM 33715 H2 WAT 6009 125.638 142.655 139.114 1.00 0.00 H TER 33717 WAT 6009 ATOM 33717 O WAT 6010 128.722 96.918 27.127 1.00 0.00 O ATOM 33718 H1 WAT 6010 128.258 96.082 27.145 1.00 0.00 H ATOM 33719 H2 WAT 6010 129.641 96.685 27.261 1.00 0.00 H TER 33721 WAT 6010 ATOM 33721 O WAT 6011 66.165 109.309 5.667 1.00 0.00 O ATOM 33722 H1 WAT 6011 66.773 109.936 5.275 1.00 0.00 H ATOM 33723 H2 WAT 6011 65.414 109.839 5.933 1.00 0.00 H TER 33725 WAT 6011 ATOM 33725 O WAT 6012 43.582 59.802 79.148 1.00 0.00 O ATOM 33726 H1 WAT 6012 43.763 60.679 78.809 1.00 0.00 H ATOM 33727 H2 WAT 6012 42.633 59.707 79.073 1.00 0.00 H TER 33729 WAT 6012 ATOM 33729 O WAT 6013 114.233 0.416 139.938 1.00 0.00 O ATOM 33730 H1 WAT 6013 113.339 0.136 140.135 1.00 0.00 H ATOM 33731 H2 WAT 6013 114.751 -0.388 139.983 1.00 0.00 H TER 33733 WAT 6013 ATOM 33733 O WAT 6014 51.760 30.489 74.619 1.00 0.00 O ATOM 33734 H1 WAT 6014 51.776 30.976 73.795 1.00 0.00 H ATOM 33735 H2 WAT 6014 52.579 29.994 74.620 1.00 0.00 H TER 33737 WAT 6014 ATOM 33737 O WAT 6015 14.435 138.167 80.261 1.00 0.00 O ATOM 33738 H1 WAT 6015 14.945 137.380 80.069 1.00 0.00 H ATOM 33739 H2 WAT 6015 15.001 138.685 80.834 1.00 0.00 H TER 33741 WAT 6015 ATOM 33741 O WAT 6016 50.887 90.055 18.455 1.00 0.00 O ATOM 33742 H1 WAT 6016 51.579 89.585 18.920 1.00 0.00 H ATOM 33743 H2 WAT 6016 50.075 89.651 18.762 1.00 0.00 H TER 33745 WAT 6016 ATOM 33745 O WAT 6017 34.567 49.222 10.742 1.00 0.00 O ATOM 33746 H1 WAT 6017 35.465 49.290 10.415 1.00 0.00 H ATOM 33747 H2 WAT 6017 34.507 49.896 11.419 1.00 0.00 H TER 33749 WAT 6017 ATOM 33749 O WAT 6018 22.407 96.172 82.946 1.00 0.00 O ATOM 33750 H1 WAT 6018 21.558 96.321 82.530 1.00 0.00 H ATOM 33751 H2 WAT 6018 23.031 96.642 82.392 1.00 0.00 H TER 33753 WAT 6018 ATOM 33753 O WAT 6019 25.969 58.791 75.816 1.00 0.00 O ATOM 33754 H1 WAT 6019 26.769 58.293 75.984 1.00 0.00 H ATOM 33755 H2 WAT 6019 25.533 58.836 76.667 1.00 0.00 H TER 33757 WAT 6019 ATOM 33757 O WAT 6020 32.883 44.630 100.414 1.00 0.00 O ATOM 33758 H1 WAT 6020 33.223 44.565 101.307 1.00 0.00 H ATOM 33759 H2 WAT 6020 33.499 45.209 99.965 1.00 0.00 H TER 33761 WAT 6020 ATOM 33761 O WAT 6021 60.445 25.470 157.886 1.00 0.00 O ATOM 33762 H1 WAT 6021 61.310 25.364 158.283 1.00 0.00 H ATOM 33763 H2 WAT 6021 60.121 26.300 158.237 1.00 0.00 H TER 33765 WAT 6021 ATOM 33765 O WAT 6022 42.232 127.988 104.193 1.00 0.00 O ATOM 33766 H1 WAT 6022 43.162 127.964 103.968 1.00 0.00 H ATOM 33767 H2 WAT 6022 41.964 128.887 104.003 1.00 0.00 H TER 33769 WAT 6022 ATOM 33769 O WAT 6023 90.453 45.402 146.910 1.00 0.00 O ATOM 33770 H1 WAT 6023 90.573 44.810 147.652 1.00 0.00 H ATOM 33771 H2 WAT 6023 89.941 46.129 147.265 1.00 0.00 H TER 33773 WAT 6023 ATOM 33773 O WAT 6024 98.987 126.037 155.494 1.00 0.00 O ATOM 33774 H1 WAT 6024 99.039 126.481 154.648 1.00 0.00 H ATOM 33775 H2 WAT 6024 99.088 125.108 155.284 1.00 0.00 H TER 33777 WAT 6024 ATOM 33777 O WAT 6025 86.716 118.725 17.630 1.00 0.00 O ATOM 33778 H1 WAT 6025 87.013 118.437 16.767 1.00 0.00 H ATOM 33779 H2 WAT 6025 86.186 117.998 17.957 1.00 0.00 H TER 33781 WAT 6025 ATOM 33781 O WAT 6026 107.365 17.527 146.556 1.00 0.00 O ATOM 33782 H1 WAT 6026 106.436 17.707 146.413 1.00 0.00 H ATOM 33783 H2 WAT 6026 107.748 18.384 146.745 1.00 0.00 H TER 33785 WAT 6026 ATOM 33785 O WAT 6027 61.353 109.411 90.278 1.00 0.00 O ATOM 33786 H1 WAT 6027 60.784 109.461 89.510 1.00 0.00 H ATOM 33787 H2 WAT 6027 60.763 109.189 90.999 1.00 0.00 H TER 33789 WAT 6027 ATOM 33789 O WAT 6028 41.003 103.805 75.855 1.00 0.00 O ATOM 33790 H1 WAT 6028 41.834 104.276 75.797 1.00 0.00 H ATOM 33791 H2 WAT 6028 41.089 103.090 75.224 1.00 0.00 H TER 33793 WAT 6028 ATOM 33793 O WAT 6029 31.573 135.306 129.081 1.00 0.00 O ATOM 33794 H1 WAT 6029 31.506 134.926 129.957 1.00 0.00 H ATOM 33795 H2 WAT 6029 32.002 136.151 129.218 1.00 0.00 H TER 33797 WAT 6029 ATOM 33797 O WAT 6030 21.882 62.674 60.770 1.00 0.00 O ATOM 33798 H1 WAT 6030 21.992 62.863 59.838 1.00 0.00 H ATOM 33799 H2 WAT 6030 21.751 61.727 60.808 1.00 0.00 H TER 33801 WAT 6030 ATOM 33801 O WAT 6031 129.021 46.780 73.222 1.00 0.00 O ATOM 33802 H1 WAT 6031 128.572 47.198 72.486 1.00 0.00 H ATOM 33803 H2 WAT 6031 128.317 46.531 73.821 1.00 0.00 H TER 33805 WAT 6031 ATOM 33805 O WAT 6032 135.532 3.157 155.268 1.00 0.00 O ATOM 33806 H1 WAT 6032 135.536 4.071 155.552 1.00 0.00 H ATOM 33807 H2 WAT 6032 136.426 2.853 155.421 1.00 0.00 H TER 33809 WAT 6032 ATOM 33809 O WAT 6033 114.828 62.275 124.215 1.00 0.00 O ATOM 33810 H1 WAT 6033 114.572 63.121 123.848 1.00 0.00 H ATOM 33811 H2 WAT 6033 115.753 62.183 123.983 1.00 0.00 H TER 33813 WAT 6033 ATOM 33813 O WAT 6034 16.329 48.800 117.189 1.00 0.00 O ATOM 33814 H1 WAT 6034 17.176 49.246 117.216 1.00 0.00 H ATOM 33815 H2 WAT 6034 16.111 48.755 116.259 1.00 0.00 H TER 33817 WAT 6034 ATOM 33817 O WAT 6035 111.605 52.450 117.672 1.00 0.00 O ATOM 33818 H1 WAT 6035 111.148 52.505 118.511 1.00 0.00 H ATOM 33819 H2 WAT 6035 111.400 53.275 117.232 1.00 0.00 H TER 33821 WAT 6035 ATOM 33821 O WAT 6036 38.458 101.983 72.797 1.00 0.00 O ATOM 33822 H1 WAT 6036 38.261 101.115 73.148 1.00 0.00 H ATOM 33823 H2 WAT 6036 38.417 102.564 73.556 1.00 0.00 H TER 33825 WAT 6036 ATOM 33825 O WAT 6037 83.646 23.702 72.893 1.00 0.00 O ATOM 33826 H1 WAT 6037 84.171 23.542 73.677 1.00 0.00 H ATOM 33827 H2 WAT 6037 83.869 22.982 72.304 1.00 0.00 H TER 33829 WAT 6037 ATOM 33829 O WAT 6038 19.403 102.108 20.768 1.00 0.00 O ATOM 33830 H1 WAT 6038 19.990 101.964 21.510 1.00 0.00 H ATOM 33831 H2 WAT 6038 19.134 101.229 20.501 1.00 0.00 H TER 33833 WAT 6038 ATOM 33833 O WAT 6039 67.502 79.186 93.366 1.00 0.00 O ATOM 33834 H1 WAT 6039 68.016 79.535 94.094 1.00 0.00 H ATOM 33835 H2 WAT 6039 67.267 78.300 93.642 1.00 0.00 H TER 33837 WAT 6039 ATOM 33837 O WAT 6040 127.205 112.814 144.063 1.00 0.00 O ATOM 33838 H1 WAT 6040 127.381 112.699 144.997 1.00 0.00 H ATOM 33839 H2 WAT 6040 126.735 112.020 143.809 1.00 0.00 H TER 33841 WAT 6040 ATOM 33841 O WAT 6041 136.564 145.019 100.090 1.00 0.00 O ATOM 33842 H1 WAT 6041 137.352 145.373 99.678 1.00 0.00 H ATOM 33843 H2 WAT 6041 136.515 145.465 100.936 1.00 0.00 H TER 33845 WAT 6041 ATOM 33845 O WAT 6042 67.023 117.804 131.854 1.00 0.00 O ATOM 33846 H1 WAT 6042 66.742 117.214 132.554 1.00 0.00 H ATOM 33847 H2 WAT 6042 66.307 118.434 131.770 1.00 0.00 H TER 33849 WAT 6042 ATOM 33849 O WAT 6043 32.729 125.354 92.211 1.00 0.00 O ATOM 33850 H1 WAT 6043 32.615 125.010 91.325 1.00 0.00 H ATOM 33851 H2 WAT 6043 33.673 125.485 92.297 1.00 0.00 H TER 33853 WAT 6043 ATOM 33853 O WAT 6044 5.795 124.028 11.167 1.00 0.00 O ATOM 33854 H1 WAT 6044 5.656 124.933 11.447 1.00 0.00 H ATOM 33855 H2 WAT 6044 5.631 124.042 10.224 1.00 0.00 H TER 33857 WAT 6044 ATOM 33857 O WAT 6045 37.673 82.726 65.401 1.00 0.00 O ATOM 33858 H1 WAT 6045 37.345 83.047 66.240 1.00 0.00 H ATOM 33859 H2 WAT 6045 37.078 83.101 64.752 1.00 0.00 H TER 33861 WAT 6045 ATOM 33861 O WAT 6046 2.830 96.784 155.194 1.00 0.00 O ATOM 33862 H1 WAT 6046 2.746 96.275 156.001 1.00 0.00 H ATOM 33863 H2 WAT 6046 1.951 97.128 155.035 1.00 0.00 H TER 33865 WAT 6046 ATOM 33865 O WAT 6047 27.179 53.623 11.724 1.00 0.00 O ATOM 33866 H1 WAT 6047 26.323 53.734 11.310 1.00 0.00 H ATOM 33867 H2 WAT 6047 27.787 53.523 10.991 1.00 0.00 H TER 33869 WAT 6047 ATOM 33869 O WAT 6048 60.866 47.608 127.708 1.00 0.00 O ATOM 33870 H1 WAT 6048 60.613 47.464 128.619 1.00 0.00 H ATOM 33871 H2 WAT 6048 61.345 48.436 127.720 1.00 0.00 H TER 33873 WAT 6048 ATOM 33873 O WAT 6049 137.473 77.767 87.578 1.00 0.00 O ATOM 33874 H1 WAT 6049 137.692 78.696 87.652 1.00 0.00 H ATOM 33875 H2 WAT 6049 137.852 77.368 88.361 1.00 0.00 H TER 33877 WAT 6049 ATOM 33877 O WAT 6050 107.441 87.227 83.948 1.00 0.00 O ATOM 33878 H1 WAT 6050 107.151 87.295 84.858 1.00 0.00 H ATOM 33879 H2 WAT 6050 107.562 86.289 83.805 1.00 0.00 H TER 33881 WAT 6050 ATOM 33881 O WAT 6051 144.820 47.340 64.714 1.00 0.00 O ATOM 33882 H1 WAT 6051 144.557 47.047 63.842 1.00 0.00 H ATOM 33883 H2 WAT 6051 144.417 46.710 65.311 1.00 0.00 H TER 33885 WAT 6051 ATOM 33885 O WAT 6052 142.492 78.034 153.519 1.00 0.00 O ATOM 33886 H1 WAT 6052 142.723 77.141 153.774 1.00 0.00 H ATOM 33887 H2 WAT 6052 142.150 77.948 152.629 1.00 0.00 H TER 33889 WAT 6052 ATOM 33889 O WAT 6053 76.360 21.241 156.570 1.00 0.00 O ATOM 33890 H1 WAT 6053 75.698 21.554 157.186 1.00 0.00 H ATOM 33891 H2 WAT 6053 75.897 21.172 155.735 1.00 0.00 H TER 33893 WAT 6053 ATOM 33893 O WAT 6054 14.930 69.467 154.064 1.00 0.00 O ATOM 33894 H1 WAT 6054 14.869 68.622 153.618 1.00 0.00 H ATOM 33895 H2 WAT 6054 15.794 69.802 153.825 1.00 0.00 H TER 33897 WAT 6054 ATOM 33897 O WAT 6055 24.197 66.822 2.329 1.00 0.00 O ATOM 33898 H1 WAT 6055 23.627 66.559 3.052 1.00 0.00 H ATOM 33899 H2 WAT 6055 24.715 66.040 2.136 1.00 0.00 H TER 33901 WAT 6055 ATOM 33901 O WAT 6056 7.924 134.268 120.647 1.00 0.00 O ATOM 33902 H1 WAT 6056 8.858 134.421 120.794 1.00 0.00 H ATOM 33903 H2 WAT 6056 7.648 134.992 120.085 1.00 0.00 H TER 33905 WAT 6056 ATOM 33905 O WAT 6057 52.046 46.410 152.536 1.00 0.00 O ATOM 33906 H1 WAT 6057 52.565 47.150 152.221 1.00 0.00 H ATOM 33907 H2 WAT 6057 52.431 46.190 153.384 1.00 0.00 H TER 33909 WAT 6057 ATOM 33909 O WAT 6058 80.667 75.391 12.523 1.00 0.00 O ATOM 33910 H1 WAT 6058 80.140 75.466 11.727 1.00 0.00 H ATOM 33911 H2 WAT 6058 81.462 74.939 12.241 1.00 0.00 H TER 33913 WAT 6058 ATOM 33913 O WAT 6059 56.890 106.654 87.161 1.00 0.00 O ATOM 33914 H1 WAT 6059 55.963 106.881 87.098 1.00 0.00 H ATOM 33915 H2 WAT 6059 56.914 105.914 87.767 1.00 0.00 H TER 33917 WAT 6059 ATOM 33917 O WAT 6060 60.932 22.748 135.085 1.00 0.00 O ATOM 33918 H1 WAT 6060 61.845 23.018 135.184 1.00 0.00 H ATOM 33919 H2 WAT 6060 60.806 22.670 134.139 1.00 0.00 H TER 33921 WAT 6060 ATOM 33921 O WAT 6061 77.200 45.224 29.621 1.00 0.00 O ATOM 33922 H1 WAT 6061 76.888 46.127 29.682 1.00 0.00 H ATOM 33923 H2 WAT 6061 78.107 45.263 29.925 1.00 0.00 H TER 33925 WAT 6061 ATOM 33925 O WAT 6062 111.686 99.630 24.296 1.00 0.00 O ATOM 33926 H1 WAT 6062 111.813 98.682 24.336 1.00 0.00 H ATOM 33927 H2 WAT 6062 112.531 99.996 24.556 1.00 0.00 H TER 33929 WAT 6062 ATOM 33929 O WAT 6063 39.572 1.358 131.903 1.00 0.00 O ATOM 33930 H1 WAT 6063 39.484 2.311 131.920 1.00 0.00 H ATOM 33931 H2 WAT 6063 39.900 1.133 132.774 1.00 0.00 H TER 33933 WAT 6063 ATOM 33933 O WAT 6064 111.122 52.324 148.631 1.00 0.00 O ATOM 33934 H1 WAT 6064 110.645 53.128 148.836 1.00 0.00 H ATOM 33935 H2 WAT 6064 110.438 51.672 148.480 1.00 0.00 H TER 33937 WAT 6064 ATOM 33937 O WAT 6065 121.336 69.418 151.471 1.00 0.00 O ATOM 33938 H1 WAT 6065 122.189 69.847 151.545 1.00 0.00 H ATOM 33939 H2 WAT 6065 120.730 70.126 151.255 1.00 0.00 H TER 33941 WAT 6065 ATOM 33941 O WAT 6066 65.702 100.273 88.251 1.00 0.00 O ATOM 33942 H1 WAT 6066 66.192 100.768 88.907 1.00 0.00 H ATOM 33943 H2 WAT 6066 64.975 99.885 88.737 1.00 0.00 H TER 33945 WAT 6066 ATOM 33945 O WAT 6067 43.955 96.300 125.517 1.00 0.00 O ATOM 33946 H1 WAT 6067 43.797 95.455 125.095 1.00 0.00 H ATOM 33947 H2 WAT 6067 43.082 96.617 125.752 1.00 0.00 H TER 33949 WAT 6067 ATOM 33949 O WAT 6068 89.843 26.425 128.735 1.00 0.00 O ATOM 33950 H1 WAT 6068 90.565 25.856 129.002 1.00 0.00 H ATOM 33951 H2 WAT 6068 89.411 25.948 128.027 1.00 0.00 H TER 33953 WAT 6068 ATOM 33953 O WAT 6069 70.828 29.387 119.796 1.00 0.00 O ATOM 33954 H1 WAT 6069 70.849 29.959 120.563 1.00 0.00 H ATOM 33955 H2 WAT 6069 69.898 29.219 119.648 1.00 0.00 H TER 33957 WAT 6069 ATOM 33957 O WAT 6070 134.678 100.155 81.994 1.00 0.00 O ATOM 33958 H1 WAT 6070 135.493 100.156 81.491 1.00 0.00 H ATOM 33959 H2 WAT 6070 134.947 100.382 82.885 1.00 0.00 H TER 33961 WAT 6070 ATOM 33961 O WAT 6071 124.251 104.268 119.830 1.00 0.00 O ATOM 33962 H1 WAT 6071 124.860 103.676 120.271 1.00 0.00 H ATOM 33963 H2 WAT 6071 124.365 105.107 120.277 1.00 0.00 H TER 33965 WAT 6071 ATOM 33965 O WAT 6072 3.687 122.162 136.066 1.00 0.00 O ATOM 33966 H1 WAT 6072 3.070 121.973 136.772 1.00 0.00 H ATOM 33967 H2 WAT 6072 3.186 122.691 135.445 1.00 0.00 H TER 33969 WAT 6072 ATOM 33969 O WAT 6073 27.709 28.547 123.230 1.00 0.00 O ATOM 33970 H1 WAT 6073 28.649 28.416 123.356 1.00 0.00 H ATOM 33971 H2 WAT 6073 27.630 28.865 122.330 1.00 0.00 H TER 33973 WAT 6073 ATOM 33973 O WAT 6074 4.159 84.422 80.390 1.00 0.00 O ATOM 33974 H1 WAT 6074 4.877 85.036 80.237 1.00 0.00 H ATOM 33975 H2 WAT 6074 4.513 83.571 80.133 1.00 0.00 H TER 33977 WAT 6074 ATOM 33977 O WAT 6075 51.476 140.371 128.483 1.00 0.00 O ATOM 33978 H1 WAT 6075 52.138 139.701 128.314 1.00 0.00 H ATOM 33979 H2 WAT 6075 50.644 139.899 128.447 1.00 0.00 H TER 33981 WAT 6075 ATOM 33981 O WAT 6076 96.359 39.831 151.130 1.00 0.00 O ATOM 33982 H1 WAT 6076 96.252 39.695 152.071 1.00 0.00 H ATOM 33983 H2 WAT 6076 96.793 39.036 150.821 1.00 0.00 H TER 33985 WAT 6076 ATOM 33985 O WAT 6077 85.619 38.795 19.007 1.00 0.00 O ATOM 33986 H1 WAT 6077 84.952 38.984 19.667 1.00 0.00 H ATOM 33987 H2 WAT 6077 86.360 38.452 19.507 1.00 0.00 H TER 33989 WAT 6077 ATOM 33989 O WAT 6078 101.009 12.618 129.827 1.00 0.00 O ATOM 33990 H1 WAT 6078 100.452 12.647 130.605 1.00 0.00 H ATOM 33991 H2 WAT 6078 101.803 13.087 130.084 1.00 0.00 H TER 33993 WAT 6078 ATOM 33993 O WAT 6079 53.530 80.608 100.565 1.00 0.00 O ATOM 33994 H1 WAT 6079 53.977 81.365 100.943 1.00 0.00 H ATOM 33995 H2 WAT 6079 54.188 79.913 100.574 1.00 0.00 H TER 33997 WAT 6079 ATOM 33997 O WAT 6080 79.891 5.900 120.461 1.00 0.00 O ATOM 33998 H1 WAT 6080 79.270 5.293 120.864 1.00 0.00 H ATOM 33999 H2 WAT 6080 80.363 6.284 121.199 1.00 0.00 H TER 34001 WAT 6080 ATOM 34001 O WAT 6081 134.799 119.910 108.946 1.00 0.00 O ATOM 34002 H1 WAT 6081 133.998 119.984 108.427 1.00 0.00 H ATOM 34003 H2 WAT 6081 134.894 118.971 109.107 1.00 0.00 H TER 34005 WAT 6081 ATOM 34005 O WAT 6082 37.211 24.599 57.378 1.00 0.00 O ATOM 34006 H1 WAT 6082 37.155 23.796 56.861 1.00 0.00 H ATOM 34007 H2 WAT 6082 36.949 25.293 56.773 1.00 0.00 H TER 34009 WAT 6082 ATOM 34009 O WAT 6083 145.652 75.794 108.734 1.00 0.00 O ATOM 34010 H1 WAT 6083 145.711 74.969 108.252 1.00 0.00 H ATOM 34011 H2 WAT 6083 144.723 75.880 108.949 1.00 0.00 H TER 34013 WAT 6083 ATOM 34013 O WAT 6084 120.974 92.360 153.317 1.00 0.00 O ATOM 34014 H1 WAT 6084 121.684 92.482 152.687 1.00 0.00 H ATOM 34015 H2 WAT 6084 121.267 92.826 154.101 1.00 0.00 H TER 34017 WAT 6084 ATOM 34017 O WAT 6085 45.353 140.874 1.842 1.00 0.00 O ATOM 34018 H1 WAT 6085 44.697 141.265 1.265 1.00 0.00 H ATOM 34019 H2 WAT 6085 44.972 140.038 2.108 1.00 0.00 H TER 34021 WAT 6085 ATOM 34021 O WAT 6086 119.576 85.934 10.936 1.00 0.00 O ATOM 34022 H1 WAT 6086 119.056 85.326 10.411 1.00 0.00 H ATOM 34023 H2 WAT 6086 118.930 86.424 11.445 1.00 0.00 H TER 34025 WAT 6086 ATOM 34025 O WAT 6087 46.439 44.245 15.298 1.00 0.00 O ATOM 34026 H1 WAT 6087 45.794 44.156 14.597 1.00 0.00 H ATOM 34027 H2 WAT 6087 47.264 44.416 14.845 1.00 0.00 H TER 34029 WAT 6087 ATOM 34029 O WAT 6088 62.146 93.940 67.611 1.00 0.00 O ATOM 34030 H1 WAT 6088 61.786 94.688 67.135 1.00 0.00 H ATOM 34031 H2 WAT 6088 61.883 94.086 68.520 1.00 0.00 H TER 34033 WAT 6088 ATOM 34033 O WAT 6089 36.292 26.567 158.061 1.00 0.00 O ATOM 34034 H1 WAT 6089 35.892 26.279 158.881 1.00 0.00 H ATOM 34035 H2 WAT 6089 36.189 25.821 157.470 1.00 0.00 H TER 34037 WAT 6089 ATOM 34037 O WAT 6090 29.866 71.049 14.927 1.00 0.00 O ATOM 34038 H1 WAT 6090 29.920 71.005 15.881 1.00 0.00 H ATOM 34039 H2 WAT 6090 29.058 71.533 14.754 1.00 0.00 H TER 34041 WAT 6090 ATOM 34041 O WAT 6091 44.791 70.252 68.807 1.00 0.00 O ATOM 34042 H1 WAT 6091 45.381 69.724 68.270 1.00 0.00 H ATOM 34043 H2 WAT 6091 45.328 70.987 69.102 1.00 0.00 H TER 34045 WAT 6091 ATOM 34045 O WAT 6092 18.081 28.484 156.589 1.00 0.00 O ATOM 34046 H1 WAT 6092 18.609 27.932 156.013 1.00 0.00 H ATOM 34047 H2 WAT 6092 18.678 28.733 157.295 1.00 0.00 H TER 34049 WAT 6092 ATOM 34049 O WAT 6093 113.832 125.451 107.379 1.00 0.00 O ATOM 34050 H1 WAT 6093 114.691 125.840 107.215 1.00 0.00 H ATOM 34051 H2 WAT 6093 113.259 126.199 107.546 1.00 0.00 H TER 34053 WAT 6093 ATOM 34053 O WAT 6094 93.557 9.661 96.086 1.00 0.00 O ATOM 34054 H1 WAT 6094 93.016 10.449 96.119 1.00 0.00 H ATOM 34055 H2 WAT 6094 93.954 9.606 96.955 1.00 0.00 H TER 34057 WAT 6094 ATOM 34057 O WAT 6095 57.286 12.438 117.779 1.00 0.00 O ATOM 34058 H1 WAT 6095 57.153 11.505 117.941 1.00 0.00 H ATOM 34059 H2 WAT 6095 56.465 12.733 117.385 1.00 0.00 H TER 34061 WAT 6095 ATOM 34061 O WAT 6096 82.942 86.281 102.627 1.00 0.00 O ATOM 34062 H1 WAT 6096 82.645 85.449 102.258 1.00 0.00 H ATOM 34063 H2 WAT 6096 83.098 86.839 101.865 1.00 0.00 H TER 34065 WAT 6096 ATOM 34065 O WAT 6097 42.179 21.409 139.487 1.00 0.00 O ATOM 34066 H1 WAT 6097 42.144 21.360 138.532 1.00 0.00 H ATOM 34067 H2 WAT 6097 43.088 21.637 139.682 1.00 0.00 H TER 34069 WAT 6097 ATOM 34069 O WAT 6098 120.797 116.118 130.584 1.00 0.00 O ATOM 34070 H1 WAT 6098 120.025 116.452 131.041 1.00 0.00 H ATOM 34071 H2 WAT 6098 120.942 115.250 130.962 1.00 0.00 H TER 34073 WAT 6098 ATOM 34073 O WAT 6099 78.872 129.597 109.473 1.00 0.00 O ATOM 34074 H1 WAT 6099 79.825 129.554 109.384 1.00 0.00 H ATOM 34075 H2 WAT 6099 78.628 128.750 109.846 1.00 0.00 H TER 34077 WAT 6099 ATOM 34077 O WAT 6100 83.935 59.315 19.123 1.00 0.00 O ATOM 34078 H1 WAT 6100 83.162 58.777 18.951 1.00 0.00 H ATOM 34079 H2 WAT 6100 83.969 59.928 18.388 1.00 0.00 H TER 34081 WAT 6100 ATOM 34081 O WAT 6101 24.326 18.324 75.245 1.00 0.00 O ATOM 34082 H1 WAT 6101 25.128 18.021 75.672 1.00 0.00 H ATOM 34083 H2 WAT 6101 23.762 17.551 75.219 1.00 0.00 H TER 34085 WAT 6101 ATOM 34085 O WAT 6102 123.123 142.533 115.485 1.00 0.00 O ATOM 34086 H1 WAT 6102 122.217 142.588 115.180 1.00 0.00 H ATOM 34087 H2 WAT 6102 123.090 142.846 116.389 1.00 0.00 H TER 34089 WAT 6102 ATOM 34089 O WAT 6103 121.291 111.221 110.810 1.00 0.00 O ATOM 34090 H1 WAT 6103 120.804 110.646 111.399 1.00 0.00 H ATOM 34091 H2 WAT 6103 120.959 112.098 111.003 1.00 0.00 H TER 34093 WAT 6103 ATOM 34093 O WAT 6104 122.344 136.958 8.896 1.00 0.00 O ATOM 34094 H1 WAT 6104 122.769 136.252 8.411 1.00 0.00 H ATOM 34095 H2 WAT 6104 121.436 136.671 8.991 1.00 0.00 H TER 34097 WAT 6104 ATOM 34097 O WAT 6105 111.759 124.351 102.697 1.00 0.00 O ATOM 34098 H1 WAT 6105 111.458 124.999 103.334 1.00 0.00 H ATOM 34099 H2 WAT 6105 112.554 124.734 102.325 1.00 0.00 H TER 34101 WAT 6105 ATOM 34101 O WAT 6106 102.793 122.192 97.196 1.00 0.00 O ATOM 34102 H1 WAT 6106 102.753 123.028 96.731 1.00 0.00 H ATOM 34103 H2 WAT 6106 103.713 122.098 97.441 1.00 0.00 H TER 34105 WAT 6106 ATOM 34105 O WAT 6107 111.085 111.773 127.716 1.00 0.00 O ATOM 34106 H1 WAT 6107 111.764 111.719 128.389 1.00 0.00 H ATOM 34107 H2 WAT 6107 110.290 111.469 128.153 1.00 0.00 H TER 34109 WAT 6107 ATOM 34109 O WAT 6108 20.767 50.826 100.125 1.00 0.00 O ATOM 34110 H1 WAT 6108 20.896 49.908 100.361 1.00 0.00 H ATOM 34111 H2 WAT 6108 19.917 51.053 100.501 1.00 0.00 H TER 34113 WAT 6108 ATOM 34113 O WAT 6109 48.169 64.912 143.646 1.00 0.00 O ATOM 34114 H1 WAT 6109 48.138 65.582 144.329 1.00 0.00 H ATOM 34115 H2 WAT 6109 48.992 64.448 143.803 1.00 0.00 H TER 34117 WAT 6109 ATOM 34117 O WAT 6110 125.967 18.471 6.128 1.00 0.00 O ATOM 34118 H1 WAT 6110 126.614 17.778 5.999 1.00 0.00 H ATOM 34119 H2 WAT 6110 126.431 19.142 6.628 1.00 0.00 H TER 34121 WAT 6110 ATOM 34121 O WAT 6111 78.198 44.324 74.289 1.00 0.00 O ATOM 34122 H1 WAT 6111 78.511 45.217 74.142 1.00 0.00 H ATOM 34123 H2 WAT 6111 78.785 43.973 74.959 1.00 0.00 H TER 34125 WAT 6111 ATOM 34125 O WAT 6112 18.611 139.645 98.353 1.00 0.00 O ATOM 34126 H1 WAT 6112 18.768 140.229 97.611 1.00 0.00 H ATOM 34127 H2 WAT 6112 18.886 140.150 99.118 1.00 0.00 H TER 34129 WAT 6112 ATOM 34129 O WAT 6113 117.998 144.234 25.169 1.00 0.00 O ATOM 34130 H1 WAT 6113 118.319 145.131 25.080 1.00 0.00 H ATOM 34131 H2 WAT 6113 117.052 144.328 25.283 1.00 0.00 H TER 34133 WAT 6113 ATOM 34133 O WAT 6114 141.858 21.891 67.365 1.00 0.00 O ATOM 34134 H1 WAT 6114 142.307 21.203 66.874 1.00 0.00 H ATOM 34135 H2 WAT 6114 142.492 22.164 68.028 1.00 0.00 H TER 34137 WAT 6114 ATOM 34137 O WAT 6115 65.879 73.633 148.584 1.00 0.00 O ATOM 34138 H1 WAT 6115 65.100 73.530 149.130 1.00 0.00 H ATOM 34139 H2 WAT 6115 66.473 74.167 149.112 1.00 0.00 H TER 34141 WAT 6115 ATOM 34141 O WAT 6116 14.751 119.979 59.154 1.00 0.00 O ATOM 34142 H1 WAT 6116 15.371 120.544 58.692 1.00 0.00 H ATOM 34143 H2 WAT 6116 15.229 119.161 59.291 1.00 0.00 H TER 34145 WAT 6116 ATOM 34145 O WAT 6117 98.370 81.695 150.840 1.00 0.00 O ATOM 34146 H1 WAT 6117 99.253 81.360 150.686 1.00 0.00 H ATOM 34147 H2 WAT 6117 97.839 81.298 150.150 1.00 0.00 H TER 34149 WAT 6117 ATOM 34149 O WAT 6118 128.030 47.578 95.405 1.00 0.00 O ATOM 34150 H1 WAT 6118 127.475 47.005 94.876 1.00 0.00 H ATOM 34151 H2 WAT 6118 127.473 47.838 96.140 1.00 0.00 H TER 34153 WAT 6118 ATOM 34153 O WAT 6119 135.506 62.659 74.447 1.00 0.00 O ATOM 34154 H1 WAT 6119 136.218 62.172 74.862 1.00 0.00 H ATOM 34155 H2 WAT 6119 134.762 62.058 74.467 1.00 0.00 H TER 34157 WAT 6119 ATOM 34157 O WAT 6120 107.910 77.218 63.972 1.00 0.00 O ATOM 34158 H1 WAT 6120 108.773 76.867 63.753 1.00 0.00 H ATOM 34159 H2 WAT 6120 107.638 77.691 63.186 1.00 0.00 H TER 34161 WAT 6120 ATOM 34161 O WAT 6121 19.840 142.408 152.296 1.00 0.00 O ATOM 34162 H1 WAT 6121 20.070 142.172 153.194 1.00 0.00 H ATOM 34163 H2 WAT 6121 19.899 143.363 152.277 1.00 0.00 H TER 34165 WAT 6121 ATOM 34165 O WAT 6122 83.678 84.333 16.587 1.00 0.00 O ATOM 34166 H1 WAT 6122 84.252 84.301 17.352 1.00 0.00 H ATOM 34167 H2 WAT 6122 82.891 83.860 16.858 1.00 0.00 H TER 34169 WAT 6122 ATOM 34169 O WAT 6123 106.925 8.679 66.832 1.00 0.00 O ATOM 34170 H1 WAT 6123 107.632 8.059 66.657 1.00 0.00 H ATOM 34171 H2 WAT 6123 107.031 9.358 66.165 1.00 0.00 H TER 34173 WAT 6123 ATOM 34173 O WAT 6124 104.185 101.669 81.666 1.00 0.00 O ATOM 34174 H1 WAT 6124 104.726 101.361 80.938 1.00 0.00 H ATOM 34175 H2 WAT 6124 103.698 100.894 81.946 1.00 0.00 H TER 34177 WAT 6124 ATOM 34177 O WAT 6125 30.433 25.460 21.535 1.00 0.00 O ATOM 34178 H1 WAT 6125 30.850 24.600 21.477 1.00 0.00 H ATOM 34179 H2 WAT 6125 30.485 25.812 20.646 1.00 0.00 H TER 34181 WAT 6125 ATOM 34181 O WAT 6126 24.207 39.266 3.184 1.00 0.00 O ATOM 34182 H1 WAT 6126 23.865 39.613 4.008 1.00 0.00 H ATOM 34183 H2 WAT 6126 23.530 38.662 2.879 1.00 0.00 H TER 34185 WAT 6126 ATOM 34185 O WAT 6127 49.511 79.798 154.192 1.00 0.00 O ATOM 34186 H1 WAT 6127 48.951 79.354 153.554 1.00 0.00 H ATOM 34187 H2 WAT 6127 49.357 80.730 154.038 1.00 0.00 H TER 34189 WAT 6127 ATOM 34189 O WAT 6128 103.896 139.951 2.572 1.00 0.00 O ATOM 34190 H1 WAT 6128 103.040 140.379 2.595 1.00 0.00 H ATOM 34191 H2 WAT 6128 103.974 139.620 1.677 1.00 0.00 H TER 34193 WAT 6128 ATOM 34193 O WAT 6129 97.438 61.205 73.526 1.00 0.00 O ATOM 34194 H1 WAT 6129 97.584 61.376 74.457 1.00 0.00 H ATOM 34195 H2 WAT 6129 97.977 60.437 73.337 1.00 0.00 H TER 34197 WAT 6129 ATOM 34197 O WAT 6130 46.565 13.489 91.158 1.00 0.00 O ATOM 34198 H1 WAT 6130 46.549 12.816 91.838 1.00 0.00 H ATOM 34199 H2 WAT 6130 46.745 13.009 90.349 1.00 0.00 H TER 34201 WAT 6130 ATOM 34201 O WAT 6131 16.637 26.306 76.224 1.00 0.00 O ATOM 34202 H1 WAT 6131 16.784 25.712 76.960 1.00 0.00 H ATOM 34203 H2 WAT 6131 16.690 25.747 75.450 1.00 0.00 H TER 34205 WAT 6131 ATOM 34205 O WAT 6132 84.689 137.772 15.455 1.00 0.00 O ATOM 34206 H1 WAT 6132 84.142 137.162 15.950 1.00 0.00 H ATOM 34207 H2 WAT 6132 84.879 137.313 14.636 1.00 0.00 H TER 34209 WAT 6132 ATOM 34209 O WAT 6133 123.517 38.637 93.484 1.00 0.00 O ATOM 34210 H1 WAT 6133 123.967 38.501 94.318 1.00 0.00 H ATOM 34211 H2 WAT 6133 122.880 39.328 93.665 1.00 0.00 H TER 34213 WAT 6133 ATOM 34213 O WAT 6134 37.573 114.513 121.431 1.00 0.00 O ATOM 34214 H1 WAT 6134 37.485 113.808 122.072 1.00 0.00 H ATOM 34215 H2 WAT 6134 38.493 114.774 121.488 1.00 0.00 H TER 34217 WAT 6134 ATOM 34217 O WAT 6135 35.103 37.233 0.365 1.00 0.00 O ATOM 34218 H1 WAT 6135 36.059 37.188 0.342 1.00 0.00 H ATOM 34219 H2 WAT 6135 34.814 36.418 -0.045 1.00 0.00 H TER 34221 WAT 6135 ATOM 34221 O WAT 6136 124.445 43.134 2.406 1.00 0.00 O ATOM 34222 H1 WAT 6136 124.265 43.546 3.251 1.00 0.00 H ATOM 34223 H2 WAT 6136 125.234 42.614 2.556 1.00 0.00 H TER 34225 WAT 6136 ATOM 34225 O WAT 6137 111.887 62.034 60.924 1.00 0.00 O ATOM 34226 H1 WAT 6137 111.031 62.018 61.352 1.00 0.00 H ATOM 34227 H2 WAT 6137 111.705 62.344 60.036 1.00 0.00 H TER 34229 WAT 6137 ATOM 34229 O WAT 6138 106.929 53.271 94.764 1.00 0.00 O ATOM 34230 H1 WAT 6138 106.871 53.292 93.809 1.00 0.00 H ATOM 34231 H2 WAT 6138 107.794 53.629 94.960 1.00 0.00 H TER 34233 WAT 6138 ATOM 34233 O WAT 6139 0.437 143.346 125.543 1.00 0.00 O ATOM 34234 H1 WAT 6139 1.105 143.578 126.190 1.00 0.00 H ATOM 34235 H2 WAT 6139 0.024 142.559 125.897 1.00 0.00 H TER 34237 WAT 6139 ATOM 34237 O WAT 6140 142.573 82.410 120.102 1.00 0.00 O ATOM 34238 H1 WAT 6140 141.744 82.245 119.652 1.00 0.00 H ATOM 34239 H2 WAT 6140 142.535 81.859 120.884 1.00 0.00 H TER 34241 WAT 6140 ATOM 34241 O WAT 6141 107.343 74.312 61.837 1.00 0.00 O ATOM 34242 H1 WAT 6141 106.475 73.937 61.690 1.00 0.00 H ATOM 34243 H2 WAT 6141 107.935 73.751 61.336 1.00 0.00 H TER 34245 WAT 6141 ATOM 34245 O WAT 6142 87.496 107.611 120.632 1.00 0.00 O ATOM 34246 H1 WAT 6142 86.886 107.031 121.088 1.00 0.00 H ATOM 34247 H2 WAT 6142 88.223 107.723 121.244 1.00 0.00 H TER 34249 WAT 6142 ATOM 34249 O WAT 6143 37.304 9.418 136.936 1.00 0.00 O ATOM 34250 H1 WAT 6143 36.948 10.154 137.434 1.00 0.00 H ATOM 34251 H2 WAT 6143 37.728 9.823 136.179 1.00 0.00 H TER 34253 WAT 6143 ATOM 34253 O WAT 6144 100.396 86.433 7.940 1.00 0.00 O ATOM 34254 H1 WAT 6144 99.986 85.677 7.520 1.00 0.00 H ATOM 34255 H2 WAT 6144 100.151 86.356 8.862 1.00 0.00 H TER 34257 WAT 6144 ATOM 34257 O WAT 6145 26.234 102.782 104.844 1.00 0.00 O ATOM 34258 H1 WAT 6145 26.627 102.017 104.423 1.00 0.00 H ATOM 34259 H2 WAT 6145 26.967 103.382 104.982 1.00 0.00 H TER 34261 WAT 6145 ATOM 34261 O WAT 6146 25.667 104.639 11.961 1.00 0.00 O ATOM 34262 H1 WAT 6146 25.953 103.824 12.373 1.00 0.00 H ATOM 34263 H2 WAT 6146 26.434 105.211 12.003 1.00 0.00 H TER 34265 WAT 6146 ATOM 34265 O WAT 6147 113.627 85.950 111.851 1.00 0.00 O ATOM 34266 H1 WAT 6147 113.015 86.687 111.840 1.00 0.00 H ATOM 34267 H2 WAT 6147 114.492 86.356 111.793 1.00 0.00 H TER 34269 WAT 6147 ATOM 34269 O WAT 6148 129.643 5.885 1.594 1.00 0.00 O ATOM 34270 H1 WAT 6148 129.124 6.617 1.261 1.00 0.00 H ATOM 34271 H2 WAT 6148 130.073 6.233 2.375 1.00 0.00 H TER 34273 WAT 6148 ATOM 34273 O WAT 6149 99.113 122.221 77.403 1.00 0.00 O ATOM 34274 H1 WAT 6149 99.462 121.932 78.246 1.00 0.00 H ATOM 34275 H2 WAT 6149 99.070 121.423 76.876 1.00 0.00 H TER 34277 WAT 6149 ATOM 34277 O WAT 6150 13.064 95.166 148.986 1.00 0.00 O ATOM 34278 H1 WAT 6150 12.783 94.896 149.860 1.00 0.00 H ATOM 34279 H2 WAT 6150 13.992 95.380 149.088 1.00 0.00 H TER 34281 WAT 6150 ATOM 34281 O WAT 6151 89.239 2.471 21.936 1.00 0.00 O ATOM 34282 H1 WAT 6151 90.011 2.848 21.513 1.00 0.00 H ATOM 34283 H2 WAT 6151 88.523 2.641 21.324 1.00 0.00 H TER 34285 WAT 6151 ATOM 34285 O WAT 6152 59.297 105.152 77.802 1.00 0.00 O ATOM 34286 H1 WAT 6152 58.918 105.916 78.237 1.00 0.00 H ATOM 34287 H2 WAT 6152 59.920 104.799 78.437 1.00 0.00 H TER 34289 WAT 6152 ATOM 34289 O WAT 6153 133.346 28.692 105.449 1.00 0.00 O ATOM 34290 H1 WAT 6153 132.888 27.858 105.553 1.00 0.00 H ATOM 34291 H2 WAT 6153 133.868 28.582 104.654 1.00 0.00 H TER 34293 WAT 6153 ATOM 34293 O WAT 6154 71.991 143.295 103.435 1.00 0.00 O ATOM 34294 H1 WAT 6154 72.899 143.597 103.468 1.00 0.00 H ATOM 34295 H2 WAT 6154 71.770 143.304 102.504 1.00 0.00 H TER 34297 WAT 6154 ATOM 34297 O WAT 6155 38.360 82.896 142.520 1.00 0.00 O ATOM 34298 H1 WAT 6155 37.474 83.216 142.352 1.00 0.00 H ATOM 34299 H2 WAT 6155 38.374 82.017 142.141 1.00 0.00 H TER 34301 WAT 6155 ATOM 34301 O WAT 6156 123.105 7.478 80.907 1.00 0.00 O ATOM 34302 H1 WAT 6156 122.207 7.681 81.169 1.00 0.00 H ATOM 34303 H2 WAT 6156 123.414 6.862 81.571 1.00 0.00 H TER 34305 WAT 6156 ATOM 34305 O WAT 6157 81.596 37.823 21.183 1.00 0.00 O ATOM 34306 H1 WAT 6157 82.086 38.630 21.027 1.00 0.00 H ATOM 34307 H2 WAT 6157 82.032 37.168 20.638 1.00 0.00 H TER 34309 WAT 6157 ATOM 34309 O WAT 6158 39.408 81.499 15.116 1.00 0.00 O ATOM 34310 H1 WAT 6158 38.532 81.880 15.179 1.00 0.00 H ATOM 34311 H2 WAT 6158 39.663 81.334 16.024 1.00 0.00 H TER 34313 WAT 6158 ATOM 34313 O WAT 6159 47.764 15.377 67.472 1.00 0.00 O ATOM 34314 H1 WAT 6159 47.369 16.000 66.862 1.00 0.00 H ATOM 34315 H2 WAT 6159 48.547 15.062 67.020 1.00 0.00 H TER 34317 WAT 6159 ATOM 34317 O WAT 6160 28.796 19.782 134.601 1.00 0.00 O ATOM 34318 H1 WAT 6160 29.752 19.736 134.626 1.00 0.00 H ATOM 34319 H2 WAT 6160 28.543 19.986 135.501 1.00 0.00 H TER 34321 WAT 6160 ATOM 34321 O WAT 6161 71.536 32.020 75.287 1.00 0.00 O ATOM 34322 H1 WAT 6161 71.171 31.322 74.744 1.00 0.00 H ATOM 34323 H2 WAT 6161 72.248 32.386 74.762 1.00 0.00 H TER 34325 WAT 6161 ATOM 34325 O WAT 6162 41.784 64.751 94.929 1.00 0.00 O ATOM 34326 H1 WAT 6162 42.458 64.940 94.277 1.00 0.00 H ATOM 34327 H2 WAT 6162 41.913 65.414 95.607 1.00 0.00 H TER 34329 WAT 6162 ATOM 34329 O WAT 6163 110.683 22.142 89.880 1.00 0.00 O ATOM 34330 H1 WAT 6163 111.343 21.635 90.352 1.00 0.00 H ATOM 34331 H2 WAT 6163 111.023 23.037 89.882 1.00 0.00 H TER 34333 WAT 6163 ATOM 34333 O WAT 6164 133.836 113.738 27.669 1.00 0.00 O ATOM 34334 H1 WAT 6164 133.350 112.943 27.888 1.00 0.00 H ATOM 34335 H2 WAT 6164 134.711 113.590 28.027 1.00 0.00 H TER 34337 WAT 6164 ATOM 34337 O WAT 6165 99.514 89.144 14.843 1.00 0.00 O ATOM 34338 H1 WAT 6165 99.124 88.420 14.354 1.00 0.00 H ATOM 34339 H2 WAT 6165 99.973 88.723 15.570 1.00 0.00 H TER 34341 WAT 6165 ATOM 34341 O WAT 6166 76.479 30.050 66.218 1.00 0.00 O ATOM 34342 H1 WAT 6166 76.820 30.942 66.159 1.00 0.00 H ATOM 34343 H2 WAT 6166 77.245 29.514 66.423 1.00 0.00 H TER 34345 WAT 6166 ATOM 34345 O WAT 6167 55.968 27.887 144.104 1.00 0.00 O ATOM 34346 H1 WAT 6167 56.483 28.630 144.416 1.00 0.00 H ATOM 34347 H2 WAT 6167 56.428 27.118 144.440 1.00 0.00 H TER 34349 WAT 6167 ATOM 34349 O WAT 6168 100.842 71.426 89.758 1.00 0.00 O ATOM 34350 H1 WAT 6168 100.902 70.751 89.082 1.00 0.00 H ATOM 34351 H2 WAT 6168 100.665 70.941 90.565 1.00 0.00 H TER 34353 WAT 6168 ATOM 34353 O WAT 6169 8.068 144.793 68.405 1.00 0.00 O ATOM 34354 H1 WAT 6169 8.792 144.817 69.031 1.00 0.00 H ATOM 34355 H2 WAT 6169 7.544 145.566 68.616 1.00 0.00 H TER 34357 WAT 6169 ATOM 34357 O WAT 6170 114.400 84.009 144.224 1.00 0.00 O ATOM 34358 H1 WAT 6170 114.807 83.946 145.088 1.00 0.00 H ATOM 34359 H2 WAT 6170 115.027 83.593 143.633 1.00 0.00 H TER 34361 WAT 6170 ATOM 34361 O WAT 6171 114.280 46.700 140.230 1.00 0.00 O ATOM 34362 H1 WAT 6171 115.105 46.609 140.707 1.00 0.00 H ATOM 34363 H2 WAT 6171 114.044 47.622 140.335 1.00 0.00 H TER 34365 WAT 6171 ATOM 34365 O WAT 6172 87.585 90.276 157.581 1.00 0.00 O ATOM 34366 H1 WAT 6172 87.583 90.294 158.538 1.00 0.00 H ATOM 34367 H2 WAT 6172 87.126 89.467 157.356 1.00 0.00 H TER 34369 WAT 6172 ATOM 34369 O WAT 6173 88.939 115.777 111.649 1.00 0.00 O ATOM 34370 H1 WAT 6173 89.414 116.389 112.211 1.00 0.00 H ATOM 34371 H2 WAT 6173 88.381 115.284 112.250 1.00 0.00 H TER 34373 WAT 6173 ATOM 34373 O WAT 6174 137.009 124.655 100.992 1.00 0.00 O ATOM 34374 H1 WAT 6174 136.103 124.527 100.709 1.00 0.00 H ATOM 34375 H2 WAT 6174 137.255 123.820 101.390 1.00 0.00 H TER 34377 WAT 6174 ATOM 34377 O WAT 6175 45.222 102.001 109.436 1.00 0.00 O ATOM 34378 H1 WAT 6175 44.339 101.886 109.083 1.00 0.00 H ATOM 34379 H2 WAT 6175 45.087 102.409 110.291 1.00 0.00 H TER 34381 WAT 6175 ATOM 34381 O WAT 6176 29.246 7.928 63.777 1.00 0.00 O ATOM 34382 H1 WAT 6176 29.153 8.818 63.437 1.00 0.00 H ATOM 34383 H2 WAT 6176 29.119 7.366 63.012 1.00 0.00 H TER 34385 WAT 6176 ATOM 34385 O WAT 6177 132.285 140.157 95.193 1.00 0.00 O ATOM 34386 H1 WAT 6177 133.183 139.996 94.906 1.00 0.00 H ATOM 34387 H2 WAT 6177 132.100 141.053 94.911 1.00 0.00 H TER 34389 WAT 6177 ATOM 34389 O WAT 6178 143.776 38.482 15.428 1.00 0.00 O ATOM 34390 H1 WAT 6178 143.055 38.500 14.799 1.00 0.00 H ATOM 34391 H2 WAT 6178 144.173 39.351 15.362 1.00 0.00 H TER 34393 WAT 6178 ATOM 34393 O WAT 6179 134.203 140.632 141.733 1.00 0.00 O ATOM 34394 H1 WAT 6179 134.493 140.623 142.645 1.00 0.00 H ATOM 34395 H2 WAT 6179 134.710 141.335 141.327 1.00 0.00 H TER 34397 WAT 6179 ATOM 34397 O WAT 6180 88.023 20.206 156.207 1.00 0.00 O ATOM 34398 H1 WAT 6180 88.463 20.443 157.024 1.00 0.00 H ATOM 34399 H2 WAT 6180 88.618 19.587 155.785 1.00 0.00 H TER 34401 WAT 6180 ATOM 34401 O WAT 6181 100.310 56.896 124.324 1.00 0.00 O ATOM 34402 H1 WAT 6181 100.056 57.176 123.444 1.00 0.00 H ATOM 34403 H2 WAT 6181 99.890 57.528 124.907 1.00 0.00 H TER 34405 WAT 6181 ATOM 34405 O WAT 6182 91.984 90.459 123.398 1.00 0.00 O ATOM 34406 H1 WAT 6182 91.103 90.831 123.434 1.00 0.00 H ATOM 34407 H2 WAT 6182 91.903 89.610 123.833 1.00 0.00 H TER 34409 WAT 6182 ATOM 34409 O WAT 6183 1.676 139.545 93.493 1.00 0.00 O ATOM 34410 H1 WAT 6183 1.745 138.880 92.808 1.00 0.00 H ATOM 34411 H2 WAT 6183 1.026 140.164 93.162 1.00 0.00 H TER 34413 WAT 6183 ATOM 34413 O WAT 6184 95.172 130.215 119.934 1.00 0.00 O ATOM 34414 H1 WAT 6184 94.554 130.817 119.518 1.00 0.00 H ATOM 34415 H2 WAT 6184 94.847 129.344 119.707 1.00 0.00 H TER 34417 WAT 6184 ATOM 34417 O WAT 6185 104.798 79.327 117.968 1.00 0.00 O ATOM 34418 H1 WAT 6185 104.639 78.517 117.482 1.00 0.00 H ATOM 34419 H2 WAT 6185 105.165 79.037 118.803 1.00 0.00 H TER 34421 WAT 6185 ATOM 34421 O WAT 6186 3.426 6.461 14.988 1.00 0.00 O ATOM 34422 H1 WAT 6186 2.483 6.433 14.829 1.00 0.00 H ATOM 34423 H2 WAT 6186 3.519 6.964 15.797 1.00 0.00 H TER 34425 WAT 6186 ATOM 34425 O WAT 6187 136.833 2.135 129.309 1.00 0.00 O ATOM 34426 H1 WAT 6187 136.507 3.020 129.146 1.00 0.00 H ATOM 34427 H2 WAT 6187 137.525 2.011 128.660 1.00 0.00 H TER 34429 WAT 6187 ATOM 34429 O WAT 6188 43.874 135.235 15.429 1.00 0.00 O ATOM 34430 H1 WAT 6188 44.565 135.891 15.347 1.00 0.00 H ATOM 34431 H2 WAT 6188 43.627 135.261 16.353 1.00 0.00 H TER 34433 WAT 6188 ATOM 34433 O WAT 6189 94.694 35.049 60.314 1.00 0.00 O ATOM 34434 H1 WAT 6189 95.161 35.022 59.479 1.00 0.00 H ATOM 34435 H2 WAT 6189 93.804 34.768 60.100 1.00 0.00 H TER 34437 WAT 6189 ATOM 34437 O WAT 6190 76.234 121.654 132.793 1.00 0.00 O ATOM 34438 H1 WAT 6190 76.815 122.379 133.023 1.00 0.00 H ATOM 34439 H2 WAT 6190 76.129 121.163 133.608 1.00 0.00 H TER 34441 WAT 6190 ATOM 34441 O WAT 6191 146.047 141.500 18.279 1.00 0.00 O ATOM 34442 H1 WAT 6191 145.534 141.215 17.524 1.00 0.00 H ATOM 34443 H2 WAT 6191 145.534 142.210 18.664 1.00 0.00 H TER 34445 WAT 6191 ATOM 34445 O WAT 6192 15.237 119.685 67.825 1.00 0.00 O ATOM 34446 H1 WAT 6192 15.890 119.008 67.647 1.00 0.00 H ATOM 34447 H2 WAT 6192 14.508 119.474 67.242 1.00 0.00 H TER 34449 WAT 6192 ATOM 34449 O WAT 6193 16.776 5.480 121.462 1.00 0.00 O ATOM 34450 H1 WAT 6193 16.416 6.324 121.732 1.00 0.00 H ATOM 34451 H2 WAT 6193 16.764 4.948 122.258 1.00 0.00 H TER 34453 WAT 6193 ATOM 34453 O WAT 6194 28.768 125.632 127.417 1.00 0.00 O ATOM 34454 H1 WAT 6194 28.946 126.400 127.960 1.00 0.00 H ATOM 34455 H2 WAT 6194 29.635 125.294 127.188 1.00 0.00 H TER 34457 WAT 6194 ATOM 34457 O WAT 6195 43.356 0.660 141.593 1.00 0.00 O ATOM 34458 H1 WAT 6195 42.527 0.575 142.064 1.00 0.00 H ATOM 34459 H2 WAT 6195 43.532 -0.219 141.258 1.00 0.00 H TER 34461 WAT 6195 ATOM 34461 O WAT 6196 13.390 73.830 11.787 1.00 0.00 O ATOM 34462 H1 WAT 6196 14.304 73.905 11.513 1.00 0.00 H ATOM 34463 H2 WAT 6196 13.056 74.726 11.758 1.00 0.00 H TER 34465 WAT 6196 ATOM 34465 O WAT 6197 76.371 18.542 59.186 1.00 0.00 O ATOM 34466 H1 WAT 6197 75.901 17.831 59.621 1.00 0.00 H ATOM 34467 H2 WAT 6197 76.769 18.132 58.418 1.00 0.00 H TER 34469 WAT 6197 ATOM 34469 O WAT 6198 134.966 114.466 101.525 1.00 0.00 O ATOM 34470 H1 WAT 6198 134.056 114.591 101.254 1.00 0.00 H ATOM 34471 H2 WAT 6198 135.442 114.325 100.707 1.00 0.00 H TER 34473 WAT 6198 ATOM 34473 O WAT 6199 106.528 91.598 71.448 1.00 0.00 O ATOM 34474 H1 WAT 6199 105.829 91.679 70.799 1.00 0.00 H ATOM 34475 H2 WAT 6199 107.335 91.689 70.942 1.00 0.00 H TER 34477 WAT 6199 ATOM 34477 O WAT 6200 113.198 92.122 103.712 1.00 0.00 O ATOM 34478 H1 WAT 6200 113.446 91.236 103.448 1.00 0.00 H ATOM 34479 H2 WAT 6200 113.941 92.666 103.452 1.00 0.00 H TER 34481 WAT 6200 ATOM 34481 O WAT 6201 95.037 119.184 149.989 1.00 0.00 O ATOM 34482 H1 WAT 6201 95.078 119.208 150.945 1.00 0.00 H ATOM 34483 H2 WAT 6201 94.580 119.990 149.749 1.00 0.00 H TER 34485 WAT 6201 ATOM 34485 O WAT 6202 58.107 142.052 135.750 1.00 0.00 O ATOM 34486 H1 WAT 6202 57.176 141.829 135.776 1.00 0.00 H ATOM 34487 H2 WAT 6202 58.244 142.406 134.872 1.00 0.00 H TER 34489 WAT 6202 ATOM 34489 O WAT 6203 30.692 46.158 70.241 1.00 0.00 O ATOM 34490 H1 WAT 6203 29.780 46.450 70.262 1.00 0.00 H ATOM 34491 H2 WAT 6203 30.642 45.208 70.350 1.00 0.00 H TER 34493 WAT 6203 ATOM 34493 O WAT 6204 51.734 143.568 146.923 1.00 0.00 O ATOM 34494 H1 WAT 6204 52.522 143.504 146.384 1.00 0.00 H ATOM 34495 H2 WAT 6204 51.893 142.970 147.653 1.00 0.00 H TER 34497 WAT 6204 ATOM 34497 O WAT 6205 27.522 83.982 19.513 1.00 0.00 O ATOM 34498 H1 WAT 6205 27.236 83.421 20.233 1.00 0.00 H ATOM 34499 H2 WAT 6205 28.319 84.401 19.838 1.00 0.00 H TER 34501 WAT 6205 ATOM 34501 O WAT 6206 136.832 104.644 140.969 1.00 0.00 O ATOM 34502 H1 WAT 6206 137.405 105.390 140.787 1.00 0.00 H ATOM 34503 H2 WAT 6206 136.471 104.406 140.115 1.00 0.00 H TER 34505 WAT 6206 ATOM 34505 O WAT 6207 60.716 6.681 66.012 1.00 0.00 O ATOM 34506 H1 WAT 6207 60.238 7.074 65.282 1.00 0.00 H ATOM 34507 H2 WAT 6207 60.864 7.407 66.619 1.00 0.00 H TER 34509 WAT 6207 ATOM 34509 O WAT 6208 39.140 127.353 8.734 1.00 0.00 O ATOM 34510 H1 WAT 6208 38.391 126.822 9.007 1.00 0.00 H ATOM 34511 H2 WAT 6208 39.150 127.279 7.780 1.00 0.00 H TER 34513 WAT 6208 ATOM 34513 O WAT 6209 32.994 132.803 68.584 1.00 0.00 O ATOM 34514 H1 WAT 6209 32.811 133.707 68.840 1.00 0.00 H ATOM 34515 H2 WAT 6209 33.210 132.856 67.653 1.00 0.00 H TER 34517 WAT 6209 ATOM 34517 O WAT 6210 61.928 1.895 93.652 1.00 0.00 O ATOM 34518 H1 WAT 6210 61.099 1.443 93.492 1.00 0.00 H ATOM 34519 H2 WAT 6210 62.414 1.305 94.229 1.00 0.00 H TER 34521 WAT 6210 ATOM 34521 O WAT 6211 102.996 90.383 88.971 1.00 0.00 O ATOM 34522 H1 WAT 6211 103.047 90.443 89.925 1.00 0.00 H ATOM 34523 H2 WAT 6211 102.167 89.934 88.803 1.00 0.00 H TER 34525 WAT 6211 ATOM 34525 O WAT 6212 111.249 111.205 134.890 1.00 0.00 O ATOM 34526 H1 WAT 6212 111.374 112.148 134.783 1.00 0.00 H ATOM 34527 H2 WAT 6212 111.233 111.072 135.837 1.00 0.00 H TER 34529 WAT 6212 ATOM 34529 O WAT 6213 100.752 43.840 137.462 1.00 0.00 O ATOM 34530 H1 WAT 6213 100.844 44.717 137.089 1.00 0.00 H ATOM 34531 H2 WAT 6213 99.829 43.779 137.707 1.00 0.00 H TER 34533 WAT 6213 ATOM 34533 O WAT 6214 83.351 74.986 146.244 1.00 0.00 O ATOM 34534 H1 WAT 6214 82.525 74.849 146.708 1.00 0.00 H ATOM 34535 H2 WAT 6214 83.682 75.817 146.585 1.00 0.00 H TER 34537 WAT 6214 ATOM 34537 O WAT 6215 98.953 67.323 2.853 1.00 0.00 O ATOM 34538 H1 WAT 6215 98.939 67.179 1.907 1.00 0.00 H ATOM 34539 H2 WAT 6215 99.773 67.791 3.012 1.00 0.00 H TER 34541 WAT 6215 ATOM 34541 O WAT 6216 76.287 110.874 130.229 1.00 0.00 O ATOM 34542 H1 WAT 6216 76.240 110.425 131.073 1.00 0.00 H ATOM 34543 H2 WAT 6216 77.162 111.261 130.213 1.00 0.00 H TER 34545 WAT 6216 ATOM 34545 O WAT 6217 71.787 7.583 105.760 1.00 0.00 O ATOM 34546 H1 WAT 6217 72.414 8.288 105.599 1.00 0.00 H ATOM 34547 H2 WAT 6217 71.293 7.511 104.943 1.00 0.00 H TER 34549 WAT 6217 ATOM 34549 O WAT 6218 115.466 137.634 83.270 1.00 0.00 O ATOM 34550 H1 WAT 6218 115.386 138.127 84.086 1.00 0.00 H ATOM 34551 H2 WAT 6218 116.403 137.453 83.190 1.00 0.00 H TER 34553 WAT 6218 ATOM 34553 O WAT 6219 16.774 64.936 110.127 1.00 0.00 O ATOM 34554 H1 WAT 6219 16.499 64.438 109.357 1.00 0.00 H ATOM 34555 H2 WAT 6219 16.599 64.351 110.865 1.00 0.00 H TER 34557 WAT 6219 ATOM 34557 O WAT 6220 48.092 73.591 7.081 1.00 0.00 O ATOM 34558 H1 WAT 6220 47.812 73.177 6.264 1.00 0.00 H ATOM 34559 H2 WAT 6220 48.115 74.526 6.880 1.00 0.00 H TER 34561 WAT 6220 ATOM 34561 O WAT 6221 35.874 65.353 61.774 1.00 0.00 O ATOM 34562 H1 WAT 6221 34.956 65.208 62.003 1.00 0.00 H ATOM 34563 H2 WAT 6221 36.309 64.531 62.000 1.00 0.00 H TER 34565 WAT 6221 ATOM 34565 O WAT 6222 82.761 41.694 4.436 1.00 0.00 O ATOM 34566 H1 WAT 6222 81.989 41.155 4.263 1.00 0.00 H ATOM 34567 H2 WAT 6222 83.491 41.074 4.435 1.00 0.00 H TER 34569 WAT 6222 ATOM 34569 O WAT 6223 120.383 51.625 94.944 1.00 0.00 O ATOM 34570 H1 WAT 6223 120.580 50.772 94.557 1.00 0.00 H ATOM 34571 H2 WAT 6223 121.037 51.731 95.635 1.00 0.00 H TER 34573 WAT 6223 ATOM 34573 O WAT 6224 52.663 111.849 114.933 1.00 0.00 O ATOM 34574 H1 WAT 6224 53.242 111.110 114.746 1.00 0.00 H ATOM 34575 H2 WAT 6224 53.254 112.594 115.046 1.00 0.00 H TER 34577 WAT 6224 ATOM 34577 O WAT 6225 49.081 9.332 87.306 1.00 0.00 O ATOM 34578 H1 WAT 6225 49.011 9.600 88.222 1.00 0.00 H ATOM 34579 H2 WAT 6225 49.153 8.378 87.340 1.00 0.00 H TER 34581 WAT 6225 ATOM 34581 O WAT 6226 130.913 129.651 92.827 1.00 0.00 O ATOM 34582 H1 WAT 6226 131.053 129.251 93.685 1.00 0.00 H ATOM 34583 H2 WAT 6226 131.681 130.207 92.693 1.00 0.00 H TER 34585 WAT 6226 ATOM 34585 O WAT 6227 5.278 117.662 86.564 1.00 0.00 O ATOM 34586 H1 WAT 6227 5.462 117.136 87.343 1.00 0.00 H ATOM 34587 H2 WAT 6227 4.502 118.172 86.798 1.00 0.00 H TER 34589 WAT 6227 ATOM 34589 O WAT 6228 76.037 121.287 100.436 1.00 0.00 O ATOM 34590 H1 WAT 6228 76.411 120.810 99.695 1.00 0.00 H ATOM 34591 H2 WAT 6228 76.135 120.689 101.178 1.00 0.00 H TER 34593 WAT 6228 ATOM 34593 O WAT 6229 130.776 113.012 111.736 1.00 0.00 O ATOM 34594 H1 WAT 6229 130.845 113.096 110.785 1.00 0.00 H ATOM 34595 H2 WAT 6229 130.841 112.071 111.899 1.00 0.00 H TER 34597 WAT 6229 ATOM 34597 O WAT 6230 76.038 53.540 5.238 1.00 0.00 O ATOM 34598 H1 WAT 6230 75.685 54.350 5.606 1.00 0.00 H ATOM 34599 H2 WAT 6230 76.190 53.743 4.315 1.00 0.00 H TER 34601 WAT 6230 ATOM 34601 O WAT 6231 45.251 92.897 140.883 1.00 0.00 O ATOM 34602 H1 WAT 6231 45.612 92.398 141.616 1.00 0.00 H ATOM 34603 H2 WAT 6231 44.819 92.240 140.336 1.00 0.00 H TER 34605 WAT 6231 ATOM 34605 O WAT 6232 41.972 63.974 5.756 1.00 0.00 O ATOM 34606 H1 WAT 6232 42.038 63.524 4.913 1.00 0.00 H ATOM 34607 H2 WAT 6232 42.731 63.667 6.252 1.00 0.00 H TER 34609 WAT 6232 ATOM 34609 O WAT 6233 52.776 58.603 69.334 1.00 0.00 O ATOM 34610 H1 WAT 6233 53.679 58.790 69.590 1.00 0.00 H ATOM 34611 H2 WAT 6233 52.620 57.710 69.640 1.00 0.00 H TER 34613 WAT 6233 ATOM 34613 O WAT 6234 10.117 132.663 109.312 1.00 0.00 O ATOM 34614 H1 WAT 6234 10.560 133.471 109.051 1.00 0.00 H ATOM 34615 H2 WAT 6234 9.923 132.219 108.487 1.00 0.00 H TER 34617 WAT 6234 ATOM 34617 O WAT 6235 3.773 38.130 72.278 1.00 0.00 O ATOM 34618 H1 WAT 6235 4.466 38.547 71.766 1.00 0.00 H ATOM 34619 H2 WAT 6235 3.911 37.192 72.147 1.00 0.00 H TER 34621 WAT 6235 ATOM 34621 O WAT 6236 111.269 6.350 79.826 1.00 0.00 O ATOM 34622 H1 WAT 6236 111.773 6.544 80.616 1.00 0.00 H ATOM 34623 H2 WAT 6236 111.877 6.515 79.106 1.00 0.00 H TER 34625 WAT 6236 ATOM 34625 O WAT 6237 57.340 45.960 131.870 1.00 0.00 O ATOM 34626 H1 WAT 6237 57.892 45.918 132.651 1.00 0.00 H ATOM 34627 H2 WAT 6237 56.670 46.608 132.085 1.00 0.00 H TER 34629 WAT 6237 ATOM 34629 O WAT 6238 116.231 20.607 103.680 1.00 0.00 O ATOM 34630 H1 WAT 6238 116.978 20.395 104.240 1.00 0.00 H ATOM 34631 H2 WAT 6238 116.582 20.572 102.790 1.00 0.00 H TER 34633 WAT 6238 ATOM 34633 O WAT 6239 20.821 48.393 62.817 1.00 0.00 O ATOM 34634 H1 WAT 6239 21.542 49.021 62.864 1.00 0.00 H ATOM 34635 H2 WAT 6239 20.994 47.888 62.023 1.00 0.00 H TER 34637 WAT 6239 ATOM 34637 O WAT 6240 16.588 32.619 148.847 1.00 0.00 O ATOM 34638 H1 WAT 6240 17.012 33.321 148.353 1.00 0.00 H ATOM 34639 H2 WAT 6240 16.531 32.956 149.741 1.00 0.00 H TER 34641 WAT 6240 ATOM 34641 O WAT 6241 1.387 94.041 5.401 1.00 0.00 O ATOM 34642 H1 WAT 6241 2.192 94.560 5.402 1.00 0.00 H ATOM 34643 H2 WAT 6241 0.802 94.510 4.807 1.00 0.00 H TER 34645 WAT 6241 ATOM 34645 O WAT 6242 67.160 34.725 145.882 1.00 0.00 O ATOM 34646 H1 WAT 6242 68.040 34.594 145.528 1.00 0.00 H ATOM 34647 H2 WAT 6242 67.303 35.157 146.724 1.00 0.00 H TER 34649 WAT 6242 ATOM 34649 O WAT 6243 133.664 113.661 104.357 1.00 0.00 O ATOM 34650 H1 WAT 6243 134.226 114.075 105.011 1.00 0.00 H ATOM 34651 H2 WAT 6243 134.209 113.608 103.571 1.00 0.00 H TER 34653 WAT 6243 ATOM 34653 O WAT 6244 99.689 95.578 72.746 1.00 0.00 O ATOM 34654 H1 WAT 6244 99.551 94.710 72.366 1.00 0.00 H ATOM 34655 H2 WAT 6244 99.293 96.181 72.117 1.00 0.00 H TER 34657 WAT 6244 ATOM 34657 O WAT 6245 121.016 85.367 73.564 1.00 0.00 O ATOM 34658 H1 WAT 6245 121.515 84.697 74.030 1.00 0.00 H ATOM 34659 H2 WAT 6245 120.842 84.982 72.705 1.00 0.00 H TER 34661 WAT 6245 ATOM 34661 O WAT 6246 40.211 127.449 81.533 1.00 0.00 O ATOM 34662 H1 WAT 6246 40.147 126.530 81.274 1.00 0.00 H ATOM 34663 H2 WAT 6246 41.151 127.624 81.563 1.00 0.00 H TER 34665 WAT 6246 ATOM 34665 O WAT 6247 129.474 9.824 141.794 1.00 0.00 O ATOM 34666 H1 WAT 6247 129.180 9.133 141.200 1.00 0.00 H ATOM 34667 H2 WAT 6247 129.960 9.362 142.478 1.00 0.00 H TER 34669 WAT 6247 ATOM 34669 O WAT 6248 122.760 69.779 28.130 1.00 0.00 O ATOM 34670 H1 WAT 6248 122.506 68.878 28.332 1.00 0.00 H ATOM 34671 H2 WAT 6248 123.258 70.065 28.896 1.00 0.00 H TER 34673 WAT 6248 ATOM 34673 O WAT 6249 24.353 142.886 107.364 1.00 0.00 O ATOM 34674 H1 WAT 6249 23.962 143.180 106.541 1.00 0.00 H ATOM 34675 H2 WAT 6249 24.286 143.643 107.945 1.00 0.00 H TER 34677 WAT 6249 ATOM 34677 O WAT 6250 79.663 123.346 85.541 1.00 0.00 O ATOM 34678 H1 WAT 6250 79.591 122.441 85.237 1.00 0.00 H ATOM 34679 H2 WAT 6250 79.764 123.272 86.490 1.00 0.00 H TER 34681 WAT 6250 ATOM 34681 O WAT 6251 12.991 35.736 148.349 1.00 0.00 O ATOM 34682 H1 WAT 6251 13.805 36.022 147.934 1.00 0.00 H ATOM 34683 H2 WAT 6251 13.164 34.834 148.618 1.00 0.00 H TER 34685 WAT 6251 ATOM 34685 O WAT 6252 91.453 5.474 140.573 1.00 0.00 O ATOM 34686 H1 WAT 6252 91.650 6.397 140.417 1.00 0.00 H ATOM 34687 H2 WAT 6252 92.259 5.013 140.340 1.00 0.00 H TER 34689 WAT 6252 ATOM 34689 O WAT 6253 126.759 48.865 14.460 1.00 0.00 O ATOM 34690 H1 WAT 6253 126.765 49.822 14.457 1.00 0.00 H ATOM 34691 H2 WAT 6253 127.684 48.620 14.463 1.00 0.00 H TER 34693 WAT 6253 ATOM 34693 O WAT 6254 137.212 73.541 10.591 1.00 0.00 O ATOM 34694 H1 WAT 6254 136.606 74.271 10.722 1.00 0.00 H ATOM 34695 H2 WAT 6254 136.862 72.838 11.139 1.00 0.00 H TER 34697 WAT 6254 ATOM 34697 O WAT 6255 20.503 125.917 6.824 1.00 0.00 O ATOM 34698 H1 WAT 6255 20.152 126.280 7.638 1.00 0.00 H ATOM 34699 H2 WAT 6255 20.850 125.061 7.074 1.00 0.00 H TER 34701 WAT 6255 ATOM 34701 O WAT 6256 64.722 143.984 91.471 1.00 0.00 O ATOM 34702 H1 WAT 6256 63.938 143.827 91.998 1.00 0.00 H ATOM 34703 H2 WAT 6256 65.357 144.347 92.089 1.00 0.00 H TER 34705 WAT 6256 ATOM 34705 O WAT 6257 25.085 121.891 90.087 1.00 0.00 O ATOM 34706 H1 WAT 6257 24.782 121.005 90.284 1.00 0.00 H ATOM 34707 H2 WAT 6257 25.692 122.100 90.797 1.00 0.00 H TER 34709 WAT 6257 ATOM 34709 O WAT 6258 26.599 95.945 154.123 1.00 0.00 O ATOM 34710 H1 WAT 6258 25.952 95.792 153.434 1.00 0.00 H ATOM 34711 H2 WAT 6258 26.734 95.084 154.520 1.00 0.00 H TER 34713 WAT 6258 ATOM 34713 O WAT 6259 83.104 86.265 121.381 1.00 0.00 O ATOM 34714 H1 WAT 6259 83.661 86.960 121.028 1.00 0.00 H ATOM 34715 H2 WAT 6259 82.708 86.650 122.163 1.00 0.00 H TER 34717 WAT 6259 ATOM 34717 O WAT 6260 58.856 38.327 5.034 1.00 0.00 O ATOM 34718 H1 WAT 6260 58.973 37.739 5.780 1.00 0.00 H ATOM 34719 H2 WAT 6260 58.988 39.203 5.397 1.00 0.00 H TER 34721 WAT 6260 ATOM 34721 O WAT 6261 115.866 120.362 86.156 1.00 0.00 O ATOM 34722 H1 WAT 6261 115.394 120.419 85.326 1.00 0.00 H ATOM 34723 H2 WAT 6261 115.229 120.642 86.814 1.00 0.00 H TER 34725 WAT 6261 ATOM 34725 O WAT 6262 105.054 40.417 120.525 1.00 0.00 O ATOM 34726 H1 WAT 6262 105.904 40.560 120.941 1.00 0.00 H ATOM 34727 H2 WAT 6262 104.640 39.736 121.055 1.00 0.00 H TER 34729 WAT 6262 ATOM 34729 O WAT 6263 124.036 84.450 123.643 1.00 0.00 O ATOM 34730 H1 WAT 6263 123.362 85.119 123.529 1.00 0.00 H ATOM 34731 H2 WAT 6263 123.766 83.736 123.066 1.00 0.00 H TER 34733 WAT 6263 ATOM 34733 O WAT 6264 63.757 119.247 135.816 1.00 0.00 O ATOM 34734 H1 WAT 6264 64.631 119.114 136.182 1.00 0.00 H ATOM 34735 H2 WAT 6264 63.900 119.800 135.048 1.00 0.00 H TER 34737 WAT 6264 ATOM 34737 O WAT 6265 76.905 124.641 62.040 1.00 0.00 O ATOM 34738 H1 WAT 6265 76.581 123.752 62.182 1.00 0.00 H ATOM 34739 H2 WAT 6265 76.433 124.948 61.266 1.00 0.00 H TER 34741 WAT 6265 ATOM 34741 O WAT 6266 4.834 137.825 119.576 1.00 0.00 O ATOM 34742 H1 WAT 6266 4.646 137.982 118.651 1.00 0.00 H ATOM 34743 H2 WAT 6266 4.806 138.693 119.977 1.00 0.00 H TER 34745 WAT 6266 ATOM 34745 O WAT 6267 26.096 81.057 5.985 1.00 0.00 O ATOM 34746 H1 WAT 6267 26.421 81.429 5.165 1.00 0.00 H ATOM 34747 H2 WAT 6267 26.706 81.375 6.651 1.00 0.00 H TER 34749 WAT 6267 ATOM 34749 O WAT 6268 119.643 21.486 16.904 1.00 0.00 O ATOM 34750 H1 WAT 6268 120.262 21.666 17.612 1.00 0.00 H ATOM 34751 H2 WAT 6268 119.636 22.288 16.382 1.00 0.00 H TER 34753 WAT 6268 ATOM 34753 O WAT 6269 47.967 61.564 52.467 1.00 0.00 O ATOM 34754 H1 WAT 6269 48.749 62.105 52.364 1.00 0.00 H ATOM 34755 H2 WAT 6269 48.139 60.790 51.930 1.00 0.00 H TER 34757 WAT 6269 ATOM 34757 O WAT 6270 74.407 13.740 23.591 1.00 0.00 O ATOM 34758 H1 WAT 6270 75.128 13.155 23.359 1.00 0.00 H ATOM 34759 H2 WAT 6270 74.523 14.501 23.023 1.00 0.00 H TER 34761 WAT 6270 ATOM 34761 O WAT 6271 54.327 73.477 12.460 1.00 0.00 O ATOM 34762 H1 WAT 6271 54.110 73.192 11.572 1.00 0.00 H ATOM 34763 H2 WAT 6271 53.741 72.972 13.024 1.00 0.00 H TER 34765 WAT 6271 ATOM 34765 O WAT 6272 123.676 31.039 88.337 1.00 0.00 O ATOM 34766 H1 WAT 6272 123.468 30.318 87.742 1.00 0.00 H ATOM 34767 H2 WAT 6272 123.021 30.973 89.032 1.00 0.00 H TER 34769 WAT 6272 ATOM 34769 O WAT 6273 48.488 132.333 61.934 1.00 0.00 O ATOM 34770 H1 WAT 6273 48.273 131.416 62.106 1.00 0.00 H ATOM 34771 H2 WAT 6273 49.400 132.421 62.209 1.00 0.00 H TER 34773 WAT 6273 ATOM 34773 O WAT 6274 62.218 88.567 77.164 1.00 0.00 O ATOM 34774 H1 WAT 6274 61.645 88.099 76.557 1.00 0.00 H ATOM 34775 H2 WAT 6274 63.088 88.204 77.001 1.00 0.00 H TER 34777 WAT 6274 ATOM 34777 O WAT 6275 40.333 56.431 16.545 1.00 0.00 O ATOM 34778 H1 WAT 6275 41.226 56.371 16.206 1.00 0.00 H ATOM 34779 H2 WAT 6275 39.783 56.493 15.764 1.00 0.00 H TER 34781 WAT 6275 ATOM 34781 O WAT 6276 129.324 24.009 82.599 1.00 0.00 O ATOM 34782 H1 WAT 6276 130.171 24.076 83.039 1.00 0.00 H ATOM 34783 H2 WAT 6276 128.694 23.886 83.309 1.00 0.00 H TER 34785 WAT 6276 ATOM 34785 O WAT 6277 8.148 35.461 128.957 1.00 0.00 O ATOM 34786 H1 WAT 6277 9.053 35.681 129.175 1.00 0.00 H ATOM 34787 H2 WAT 6277 7.837 34.954 129.707 1.00 0.00 H TER 34789 WAT 6277 ATOM 34789 O WAT 6278 90.738 130.440 128.252 1.00 0.00 O ATOM 34790 H1 WAT 6278 91.299 129.924 127.673 1.00 0.00 H ATOM 34791 H2 WAT 6278 90.524 131.222 127.743 1.00 0.00 H TER 34793 WAT 6278 ATOM 34793 O WAT 6279 94.610 84.548 128.537 1.00 0.00 O ATOM 34794 H1 WAT 6279 93.761 84.990 128.554 1.00 0.00 H ATOM 34795 H2 WAT 6279 94.866 84.557 127.614 1.00 0.00 H TER 34797 WAT 6279 ATOM 34797 O WAT 6280 131.991 21.771 74.153 1.00 0.00 O ATOM 34798 H1 WAT 6280 131.680 21.065 74.719 1.00 0.00 H ATOM 34799 H2 WAT 6280 131.194 22.218 73.868 1.00 0.00 H TER 34801 WAT 6280 ATOM 34801 O WAT 6281 64.278 133.635 57.433 1.00 0.00 O ATOM 34802 H1 WAT 6281 64.707 134.435 57.130 1.00 0.00 H ATOM 34803 H2 WAT 6281 64.794 133.358 58.190 1.00 0.00 H TER 34805 WAT 6281 ATOM 34805 O WAT 6282 49.585 50.922 156.778 1.00 0.00 O ATOM 34806 H1 WAT 6282 49.156 51.544 156.190 1.00 0.00 H ATOM 34807 H2 WAT 6282 50.517 51.128 156.707 1.00 0.00 H TER 34809 WAT 6282 ATOM 34809 O WAT 6283 57.945 31.154 93.027 1.00 0.00 O ATOM 34810 H1 WAT 6283 57.811 31.488 92.140 1.00 0.00 H ATOM 34811 H2 WAT 6283 57.872 31.926 93.587 1.00 0.00 H TER 34813 WAT 6283 ATOM 34813 O WAT 6284 65.503 138.842 127.728 1.00 0.00 O ATOM 34814 H1 WAT 6284 66.284 139.319 128.007 1.00 0.00 H ATOM 34815 H2 WAT 6284 65.468 138.081 128.308 1.00 0.00 H TER 34817 WAT 6284 ATOM 34817 O WAT 6285 39.911 48.900 88.583 1.00 0.00 O ATOM 34818 H1 WAT 6285 40.727 49.321 88.313 1.00 0.00 H ATOM 34819 H2 WAT 6285 40.165 48.004 88.804 1.00 0.00 H TER 34821 WAT 6285 ATOM 34821 O WAT 6286 40.556 14.630 9.416 1.00 0.00 O ATOM 34822 H1 WAT 6286 39.782 14.130 9.675 1.00 0.00 H ATOM 34823 H2 WAT 6286 40.980 14.088 8.751 1.00 0.00 H TER 34825 WAT 6286 ATOM 34825 O WAT 6287 94.669 124.514 125.845 1.00 0.00 O ATOM 34826 H1 WAT 6287 95.329 123.917 125.492 1.00 0.00 H ATOM 34827 H2 WAT 6287 95.120 124.981 126.548 1.00 0.00 H TER 34829 WAT 6287 ATOM 34829 O WAT 6288 84.057 7.701 134.590 1.00 0.00 O ATOM 34830 H1 WAT 6288 84.176 8.596 134.910 1.00 0.00 H ATOM 34831 H2 WAT 6288 84.943 7.393 134.404 1.00 0.00 H TER 34833 WAT 6288 ATOM 34833 O WAT 6289 1.374 36.959 87.842 1.00 0.00 O ATOM 34834 H1 WAT 6289 0.765 37.561 87.414 1.00 0.00 H ATOM 34835 H2 WAT 6289 1.043 36.880 88.737 1.00 0.00 H TER 34837 WAT 6289 ATOM 34837 O WAT 6290 2.007 74.443 101.633 1.00 0.00 O ATOM 34838 H1 WAT 6290 1.661 75.264 101.985 1.00 0.00 H ATOM 34839 H2 WAT 6290 2.957 74.527 101.721 1.00 0.00 H TER 34841 WAT 6290 ATOM 34841 O WAT 6291 46.299 127.878 150.682 1.00 0.00 O ATOM 34842 H1 WAT 6291 46.894 127.160 150.897 1.00 0.00 H ATOM 34843 H2 WAT 6291 46.429 128.025 149.745 1.00 0.00 H TER 34845 WAT 6291 ATOM 34845 O WAT 6292 140.775 49.407 142.929 1.00 0.00 O ATOM 34846 H1 WAT 6292 140.485 49.806 143.749 1.00 0.00 H ATOM 34847 H2 WAT 6292 141.077 48.534 143.181 1.00 0.00 H TER 34849 WAT 6292 ATOM 34849 O WAT 6293 31.163 125.092 108.591 1.00 0.00 O ATOM 34850 H1 WAT 6293 30.839 124.275 108.971 1.00 0.00 H ATOM 34851 H2 WAT 6293 31.597 125.538 109.318 1.00 0.00 H TER 34853 WAT 6293 ATOM 34853 O WAT 6294 82.620 12.760 135.571 1.00 0.00 O ATOM 34854 H1 WAT 6294 82.987 13.554 135.182 1.00 0.00 H ATOM 34855 H2 WAT 6294 82.263 13.049 136.411 1.00 0.00 H TER 34857 WAT 6294 ATOM 34857 O WAT 6295 122.712 45.486 114.719 1.00 0.00 O ATOM 34858 H1 WAT 6295 122.604 45.042 113.878 1.00 0.00 H ATOM 34859 H2 WAT 6295 123.622 45.319 114.964 1.00 0.00 H TER 34861 WAT 6295 ATOM 34861 O WAT 6296 122.854 58.391 93.347 1.00 0.00 O ATOM 34862 H1 WAT 6296 122.490 58.167 92.491 1.00 0.00 H ATOM 34863 H2 WAT 6296 122.230 58.028 93.976 1.00 0.00 H TER 34865 WAT 6296 ATOM 34865 O WAT 6297 103.010 8.559 71.587 1.00 0.00 O ATOM 34866 H1 WAT 6297 102.209 8.639 72.105 1.00 0.00 H ATOM 34867 H2 WAT 6297 103.093 7.621 71.418 1.00 0.00 H TER 34869 WAT 6297 ATOM 34869 O WAT 6298 47.727 114.599 99.471 1.00 0.00 O ATOM 34870 H1 WAT 6298 47.055 115.064 99.971 1.00 0.00 H ATOM 34871 H2 WAT 6298 48.126 114.003 100.105 1.00 0.00 H TER 34873 WAT 6298 ATOM 34873 O WAT 6299 66.418 118.690 103.226 1.00 0.00 O ATOM 34874 H1 WAT 6299 66.335 118.267 102.372 1.00 0.00 H ATOM 34875 H2 WAT 6299 66.139 119.593 103.075 1.00 0.00 H TER 34877 WAT 6299 ATOM 34877 O WAT 6300 99.067 47.961 106.385 1.00 0.00 O ATOM 34878 H1 WAT 6300 98.418 48.527 105.966 1.00 0.00 H ATOM 34879 H2 WAT 6300 99.909 48.365 106.174 1.00 0.00 H TER 34881 WAT 6300 ATOM 34881 O WAT 6301 93.754 71.523 130.485 1.00 0.00 O ATOM 34882 H1 WAT 6301 93.530 71.054 129.682 1.00 0.00 H ATOM 34883 H2 WAT 6301 94.639 71.227 130.697 1.00 0.00 H TER 34885 WAT 6301 ATOM 34885 O WAT 6302 133.172 17.918 136.737 1.00 0.00 O ATOM 34886 H1 WAT 6302 132.766 18.402 137.457 1.00 0.00 H ATOM 34887 H2 WAT 6302 133.846 17.384 137.158 1.00 0.00 H TER 34889 WAT 6302 ATOM 34889 O WAT 6303 22.384 85.854 55.311 1.00 0.00 O ATOM 34890 H1 WAT 6303 22.716 86.686 54.975 1.00 0.00 H ATOM 34891 H2 WAT 6303 23.164 85.309 55.414 1.00 0.00 H TER 34893 WAT 6303 ATOM 34893 O WAT 6304 145.113 25.490 113.998 1.00 0.00 O ATOM 34894 H1 WAT 6304 144.324 25.270 113.503 1.00 0.00 H ATOM 34895 H2 WAT 6304 145.020 26.422 114.196 1.00 0.00 H TER 34897 WAT 6304 ATOM 34897 O WAT 6305 67.898 70.091 100.701 1.00 0.00 O ATOM 34898 H1 WAT 6305 68.002 70.480 99.833 1.00 0.00 H ATOM 34899 H2 WAT 6305 67.243 70.640 101.133 1.00 0.00 H TER 34901 WAT 6305 ATOM 34901 O WAT 6306 46.691 32.380 64.962 1.00 0.00 O ATOM 34902 H1 WAT 6306 45.801 32.202 64.659 1.00 0.00 H ATOM 34903 H2 WAT 6306 46.795 33.326 64.861 1.00 0.00 H TER 34905 WAT 6306 ATOM 34905 O WAT 6307 8.613 100.112 126.010 1.00 0.00 O ATOM 34906 H1 WAT 6307 9.361 100.246 126.592 1.00 0.00 H ATOM 34907 H2 WAT 6307 8.587 100.901 125.469 1.00 0.00 H TER 34909 WAT 6307 ATOM 34909 O WAT 6308 78.373 119.798 151.420 1.00 0.00 O ATOM 34910 H1 WAT 6308 78.343 120.660 151.006 1.00 0.00 H ATOM 34911 H2 WAT 6308 79.090 119.861 152.052 1.00 0.00 H TER 34913 WAT 6308 ATOM 34913 O WAT 6309 92.076 58.799 84.478 1.00 0.00 O ATOM 34914 H1 WAT 6309 91.788 59.508 83.902 1.00 0.00 H ATOM 34915 H2 WAT 6309 91.435 58.102 84.338 1.00 0.00 H TER 34917 WAT 6309 ATOM 34917 O WAT 6310 121.048 131.664 76.116 1.00 0.00 O ATOM 34918 H1 WAT 6310 120.727 130.832 75.769 1.00 0.00 H ATOM 34919 H2 WAT 6310 121.981 131.669 75.900 1.00 0.00 H TER 34921 WAT 6310 ATOM 34921 O WAT 6311 47.082 20.454 82.485 1.00 0.00 O ATOM 34922 H1 WAT 6311 47.072 21.059 81.744 1.00 0.00 H ATOM 34923 H2 WAT 6311 47.857 20.705 82.988 1.00 0.00 H TER 34925 WAT 6311 ATOM 34925 O WAT 6312 101.970 99.400 146.799 1.00 0.00 O ATOM 34926 H1 WAT 6312 102.559 99.649 146.086 1.00 0.00 H ATOM 34927 H2 WAT 6312 101.664 98.525 146.563 1.00 0.00 H TER 34929 WAT 6312 ATOM 34929 O WAT 6313 137.729 48.581 4.632 1.00 0.00 O ATOM 34930 H1 WAT 6313 138.346 47.888 4.868 1.00 0.00 H ATOM 34931 H2 WAT 6313 138.251 49.383 4.650 1.00 0.00 H TER 34933 WAT 6313 ATOM 34933 O WAT 6314 134.635 43.261 131.135 1.00 0.00 O ATOM 34934 H1 WAT 6314 135.050 43.835 130.491 1.00 0.00 H ATOM 34935 H2 WAT 6314 133.977 42.777 130.637 1.00 0.00 H TER 34937 WAT 6314 ATOM 34937 O WAT 6315 97.189 108.712 142.271 1.00 0.00 O ATOM 34938 H1 WAT 6315 97.208 108.814 141.319 1.00 0.00 H ATOM 34939 H2 WAT 6315 96.387 108.218 142.442 1.00 0.00 H TER 34941 WAT 6315 ATOM 34941 O WAT 6316 65.859 124.632 74.904 1.00 0.00 O ATOM 34942 H1 WAT 6316 65.319 123.849 75.008 1.00 0.00 H ATOM 34943 H2 WAT 6316 66.361 124.472 74.104 1.00 0.00 H TER 34945 WAT 6316 ATOM 34945 O WAT 6317 24.403 124.962 24.210 1.00 0.00 O ATOM 34946 H1 WAT 6317 23.620 125.492 24.058 1.00 0.00 H ATOM 34947 H2 WAT 6317 24.364 124.280 23.540 1.00 0.00 H TER 34949 WAT 6317 ATOM 34949 O WAT 6318 34.058 117.230 78.121 1.00 0.00 O ATOM 34950 H1 WAT 6318 34.335 117.447 79.011 1.00 0.00 H ATOM 34951 H2 WAT 6318 33.405 117.896 77.904 1.00 0.00 H TER 34953 WAT 6318 ATOM 34953 O WAT 6319 130.569 103.002 7.658 1.00 0.00 O ATOM 34954 H1 WAT 6319 130.421 103.861 7.262 1.00 0.00 H ATOM 34955 H2 WAT 6319 130.829 102.443 6.925 1.00 0.00 H TER 34957 WAT 6319 ATOM 34957 O WAT 6320 72.358 44.408 23.235 1.00 0.00 O ATOM 34958 H1 WAT 6320 71.596 44.045 23.686 1.00 0.00 H ATOM 34959 H2 WAT 6320 73.024 43.723 23.301 1.00 0.00 H TER 34961 WAT 6320 ATOM 34961 O WAT 6321 6.933 103.029 63.596 1.00 0.00 O ATOM 34962 H1 WAT 6321 6.672 102.343 64.211 1.00 0.00 H ATOM 34963 H2 WAT 6321 6.940 103.830 64.120 1.00 0.00 H TER 34965 WAT 6321 ATOM 34965 O WAT 6322 104.553 84.785 155.335 1.00 0.00 O ATOM 34966 H1 WAT 6322 104.237 85.025 154.464 1.00 0.00 H ATOM 34967 H2 WAT 6322 103.799 84.918 155.909 1.00 0.00 H TER 34969 WAT 6322 ATOM 34969 O WAT 6323 102.897 0.285 117.035 1.00 0.00 O ATOM 34970 H1 WAT 6323 103.196 0.083 117.922 1.00 0.00 H ATOM 34971 H2 WAT 6323 103.672 0.635 116.596 1.00 0.00 H TER 34973 WAT 6323 ATOM 34973 O WAT 6324 67.437 57.893 12.447 1.00 0.00 O ATOM 34974 H1 WAT 6324 67.793 57.904 11.558 1.00 0.00 H ATOM 34975 H2 WAT 6324 66.596 57.444 12.362 1.00 0.00 H TER 34977 WAT 6324 ATOM 34977 O WAT 6325 13.043 139.305 71.044 1.00 0.00 O ATOM 34978 H1 WAT 6325 13.920 139.371 70.667 1.00 0.00 H ATOM 34979 H2 WAT 6325 13.149 139.601 71.948 1.00 0.00 H TER 34981 WAT 6325 ATOM 34981 O WAT 6326 20.512 82.785 113.345 1.00 0.00 O ATOM 34982 H1 WAT 6326 20.264 82.499 114.225 1.00 0.00 H ATOM 34983 H2 WAT 6326 19.710 82.697 112.830 1.00 0.00 H TER 34985 WAT 6326 ATOM 34985 O WAT 6327 131.455 143.562 68.211 1.00 0.00 O ATOM 34986 H1 WAT 6327 131.982 144.146 67.666 1.00 0.00 H ATOM 34987 H2 WAT 6327 131.978 143.435 69.003 1.00 0.00 H TER 34989 WAT 6327 ATOM 34989 O WAT 6328 138.029 52.857 103.257 1.00 0.00 O ATOM 34990 H1 WAT 6328 138.488 53.051 102.440 1.00 0.00 H ATOM 34991 H2 WAT 6328 138.713 52.876 103.926 1.00 0.00 H TER 34993 WAT 6328 ATOM 34993 O WAT 6329 53.523 34.864 111.830 1.00 0.00 O ATOM 34994 H1 WAT 6329 53.712 34.228 111.140 1.00 0.00 H ATOM 34995 H2 WAT 6329 52.618 35.132 111.667 1.00 0.00 H TER 34997 WAT 6329 ATOM 34997 O WAT 6330 100.854 114.199 114.057 1.00 0.00 O ATOM 34998 H1 WAT 6330 100.781 115.134 114.248 1.00 0.00 H ATOM 34999 H2 WAT 6330 100.848 113.777 114.916 1.00 0.00 H TER 35001 WAT 6330 ATOM 35001 O WAT 6331 129.955 83.143 11.428 1.00 0.00 O ATOM 35002 H1 WAT 6331 129.819 83.612 10.605 1.00 0.00 H ATOM 35003 H2 WAT 6331 130.823 82.749 11.339 1.00 0.00 H TER 35005 WAT 6331 ATOM 35005 O WAT 6332 112.028 126.240 22.082 1.00 0.00 O ATOM 35006 H1 WAT 6332 111.158 125.855 22.185 1.00 0.00 H ATOM 35007 H2 WAT 6332 111.926 126.879 21.376 1.00 0.00 H TER 35009 WAT 6332 ATOM 35009 O WAT 6333 92.911 131.219 129.980 1.00 0.00 O ATOM 35010 H1 WAT 6333 92.928 131.999 129.426 1.00 0.00 H ATOM 35011 H2 WAT 6333 92.098 130.773 129.741 1.00 0.00 H TER 35013 WAT 6333 ATOM 35013 O WAT 6334 97.300 1.071 140.494 1.00 0.00 O ATOM 35014 H1 WAT 6334 97.355 2.023 140.580 1.00 0.00 H ATOM 35015 H2 WAT 6334 97.632 0.735 141.327 1.00 0.00 H TER 35017 WAT 6334 ATOM 35017 O WAT 6335 137.580 1.744 6.690 1.00 0.00 O ATOM 35018 H1 WAT 6335 137.865 0.833 6.613 1.00 0.00 H ATOM 35019 H2 WAT 6335 137.885 2.159 5.884 1.00 0.00 H TER 35021 WAT 6335 ATOM 35021 O WAT 6336 48.977 73.430 90.503 1.00 0.00 O ATOM 35022 H1 WAT 6336 49.530 73.140 89.778 1.00 0.00 H ATOM 35023 H2 WAT 6336 49.587 73.823 91.127 1.00 0.00 H TER 35025 WAT 6336 ATOM 35025 O WAT 6337 100.938 122.406 58.181 1.00 0.00 O ATOM 35026 H1 WAT 6337 100.120 121.910 58.145 1.00 0.00 H ATOM 35027 H2 WAT 6337 101.415 122.137 57.396 1.00 0.00 H TER 35029 WAT 6337 ATOM 35029 O WAT 6338 38.388 44.999 58.441 1.00 0.00 O ATOM 35030 H1 WAT 6338 37.826 45.748 58.639 1.00 0.00 H ATOM 35031 H2 WAT 6338 37.865 44.456 57.851 1.00 0.00 H TER 35033 WAT 6338 ATOM 35033 O WAT 6339 10.791 99.945 76.405 1.00 0.00 O ATOM 35034 H1 WAT 6339 10.092 99.832 77.050 1.00 0.00 H ATOM 35035 H2 WAT 6339 10.884 100.894 76.317 1.00 0.00 H TER 35037 WAT 6339 ATOM 35037 O WAT 6340 120.932 27.120 75.141 1.00 0.00 O ATOM 35038 H1 WAT 6340 121.518 27.872 75.051 1.00 0.00 H ATOM 35039 H2 WAT 6340 121.465 26.369 74.877 1.00 0.00 H TER 35041 WAT 6340 ATOM 35041 O WAT 6341 25.700 129.292 125.475 1.00 0.00 O ATOM 35042 H1 WAT 6341 25.387 130.114 125.099 1.00 0.00 H ATOM 35043 H2 WAT 6341 26.083 129.543 126.316 1.00 0.00 H TER 35045 WAT 6341 ATOM 35045 O WAT 6342 43.426 84.120 135.125 1.00 0.00 O ATOM 35046 H1 WAT 6342 42.654 84.054 134.563 1.00 0.00 H ATOM 35047 H2 WAT 6342 43.908 84.873 134.783 1.00 0.00 H TER 35049 WAT 6342 ATOM 35049 O WAT 6343 56.027 122.773 111.776 1.00 0.00 O ATOM 35050 H1 WAT 6343 56.292 122.399 112.616 1.00 0.00 H ATOM 35051 H2 WAT 6343 56.785 122.645 111.206 1.00 0.00 H TER 35053 WAT 6343 ATOM 35053 O WAT 6344 97.478 52.975 135.148 1.00 0.00 O ATOM 35054 H1 WAT 6344 98.155 53.310 135.737 1.00 0.00 H ATOM 35055 H2 WAT 6344 97.829 53.125 134.270 1.00 0.00 H TER 35057 WAT 6344 ATOM 35057 O WAT 6345 23.822 95.400 142.602 1.00 0.00 O ATOM 35058 H1 WAT 6345 24.382 94.995 141.940 1.00 0.00 H ATOM 35059 H2 WAT 6345 24.261 96.223 142.816 1.00 0.00 H TER 35061 WAT 6345 ATOM 35061 O WAT 6346 132.195 30.059 154.010 1.00 0.00 O ATOM 35062 H1 WAT 6346 131.252 30.221 154.039 1.00 0.00 H ATOM 35063 H2 WAT 6346 132.457 29.997 154.928 1.00 0.00 H TER 35065 WAT 6346 ATOM 35065 O WAT 6347 67.168 19.883 58.115 1.00 0.00 O ATOM 35066 H1 WAT 6347 66.790 19.483 58.898 1.00 0.00 H ATOM 35067 H2 WAT 6347 67.714 19.195 57.735 1.00 0.00 H TER 35069 WAT 6347 ATOM 35069 O WAT 6348 83.593 120.319 2.397 1.00 0.00 O ATOM 35070 H1 WAT 6348 83.423 120.787 3.215 1.00 0.00 H ATOM 35071 H2 WAT 6348 84.415 120.688 2.076 1.00 0.00 H TER 35073 WAT 6348 ATOM 35073 O WAT 6349 22.748 77.761 9.629 1.00 0.00 O ATOM 35074 H1 WAT 6349 22.460 78.532 10.118 1.00 0.00 H ATOM 35075 H2 WAT 6349 21.937 77.352 9.326 1.00 0.00 H TER 35077 WAT 6349 ATOM 35077 O WAT 6350 129.857 2.674 1.782 1.00 0.00 O ATOM 35078 H1 WAT 6350 129.079 3.232 1.767 1.00 0.00 H ATOM 35079 H2 WAT 6350 130.503 3.151 1.260 1.00 0.00 H TER 35081 WAT 6350 ATOM 35081 O WAT 6351 23.353 43.514 111.075 1.00 0.00 O ATOM 35082 H1 WAT 6351 24.023 43.841 111.676 1.00 0.00 H ATOM 35083 H2 WAT 6351 23.600 42.603 110.915 1.00 0.00 H TER 35085 WAT 6351 ATOM 35085 O WAT 6352 124.908 29.686 149.313 1.00 0.00 O ATOM 35086 H1 WAT 6352 124.644 29.965 148.436 1.00 0.00 H ATOM 35087 H2 WAT 6352 124.697 30.431 149.876 1.00 0.00 H TER 35089 WAT 6352 ATOM 35089 O WAT 6353 68.263 94.762 78.758 1.00 0.00 O ATOM 35090 H1 WAT 6353 68.449 95.597 78.329 1.00 0.00 H ATOM 35091 H2 WAT 6353 67.319 94.642 78.650 1.00 0.00 H TER 35093 WAT 6353 ATOM 35093 O WAT 6354 57.258 39.300 115.800 1.00 0.00 O ATOM 35094 H1 WAT 6354 56.823 38.710 116.416 1.00 0.00 H ATOM 35095 H2 WAT 6354 57.833 39.835 116.347 1.00 0.00 H TER 35097 WAT 6354 ATOM 35097 O WAT 6355 88.507 -0.148 79.806 1.00 0.00 O ATOM 35098 H1 WAT 6355 89.185 -0.492 79.224 1.00 0.00 H ATOM 35099 H2 WAT 6355 88.503 0.795 79.637 1.00 0.00 H TER 35101 WAT 6355 ATOM 35101 O WAT 6356 44.026 139.697 125.382 1.00 0.00 O ATOM 35102 H1 WAT 6356 44.413 140.570 125.439 1.00 0.00 H ATOM 35103 H2 WAT 6356 43.430 139.650 126.129 1.00 0.00 H TER 35105 WAT 6356 ATOM 35105 O WAT 6357 11.535 89.298 -0.090 1.00 0.00 O ATOM 35106 H1 WAT 6357 12.079 89.170 0.687 1.00 0.00 H ATOM 35107 H2 WAT 6357 11.008 90.072 0.111 1.00 0.00 H TER 35109 WAT 6357 ATOM 35109 O WAT 6358 114.334 82.835 82.951 1.00 0.00 O ATOM 35110 H1 WAT 6358 113.548 82.918 82.412 1.00 0.00 H ATOM 35111 H2 WAT 6358 114.993 83.359 82.496 1.00 0.00 H TER 35113 WAT 6358 ATOM 35113 O WAT 6359 8.408 141.863 130.623 1.00 0.00 O ATOM 35114 H1 WAT 6359 8.135 141.496 129.782 1.00 0.00 H ATOM 35115 H2 WAT 6359 9.314 142.137 130.482 1.00 0.00 H TER 35117 WAT 6359 ATOM 35117 O WAT 6360 44.495 96.428 68.820 1.00 0.00 O ATOM 35118 H1 WAT 6360 45.394 96.297 68.517 1.00 0.00 H ATOM 35119 H2 WAT 6360 44.103 97.005 68.164 1.00 0.00 H TER 35121 WAT 6360 ATOM 35121 O WAT 6361 120.956 107.968 91.032 1.00 0.00 O ATOM 35122 H1 WAT 6361 120.337 107.714 90.347 1.00 0.00 H ATOM 35123 H2 WAT 6361 120.502 108.655 91.521 1.00 0.00 H TER 35125 WAT 6361 ATOM 35125 O WAT 6362 49.783 53.567 131.165 1.00 0.00 O ATOM 35126 H1 WAT 6362 50.193 53.093 131.888 1.00 0.00 H ATOM 35127 H2 WAT 6362 48.854 53.596 131.394 1.00 0.00 H TER 35129 WAT 6362 ATOM 35129 O WAT 6363 24.729 111.360 121.914 1.00 0.00 O ATOM 35130 H1 WAT 6363 24.711 110.532 121.435 1.00 0.00 H ATOM 35131 H2 WAT 6363 24.650 112.031 121.235 1.00 0.00 H TER 35133 WAT 6363 ATOM 35133 O WAT 6364 100.259 1.181 139.999 1.00 0.00 O ATOM 35134 H1 WAT 6364 99.438 0.955 139.564 1.00 0.00 H ATOM 35135 H2 WAT 6364 100.531 0.373 140.434 1.00 0.00 H TER 35137 WAT 6364 ATOM 35137 O WAT 6365 43.199 115.526 122.940 1.00 0.00 O ATOM 35138 H1 WAT 6365 43.718 116.313 123.099 1.00 0.00 H ATOM 35139 H2 WAT 6365 43.709 115.027 122.301 1.00 0.00 H TER 35141 WAT 6365 ATOM 35141 O WAT 6366 73.515 66.634 101.536 1.00 0.00 O ATOM 35142 H1 WAT 6366 72.791 67.153 101.886 1.00 0.00 H ATOM 35143 H2 WAT 6366 73.694 67.019 100.679 1.00 0.00 H TER 35145 WAT 6366 ATOM 35145 O WAT 6367 117.629 52.572 120.977 1.00 0.00 O ATOM 35146 H1 WAT 6367 118.571 52.665 120.839 1.00 0.00 H ATOM 35147 H2 WAT 6367 117.436 51.672 120.714 1.00 0.00 H TER 35149 WAT 6367 ATOM 35149 O WAT 6368 124.414 137.434 103.995 1.00 0.00 O ATOM 35150 H1 WAT 6368 124.247 137.598 103.067 1.00 0.00 H ATOM 35151 H2 WAT 6368 123.545 137.319 104.379 1.00 0.00 H TER 35153 WAT 6368 ATOM 35153 O WAT 6369 87.406 76.854 114.038 1.00 0.00 O ATOM 35154 H1 WAT 6369 86.748 76.159 114.049 1.00 0.00 H ATOM 35155 H2 WAT 6369 87.514 77.097 114.957 1.00 0.00 H TER 35157 WAT 6369 ATOM 35157 O WAT 6370 60.853 14.072 51.647 1.00 0.00 O ATOM 35158 H1 WAT 6370 60.692 13.420 52.329 1.00 0.00 H ATOM 35159 H2 WAT 6370 60.634 14.908 52.059 1.00 0.00 H TER 35161 WAT 6370 ATOM 35161 O WAT 6371 23.269 137.563 56.651 1.00 0.00 O ATOM 35162 H1 WAT 6371 23.751 136.821 57.015 1.00 0.00 H ATOM 35163 H2 WAT 6371 23.102 138.132 57.402 1.00 0.00 H TER 35165 WAT 6371 ATOM 35165 O WAT 6372 26.314 117.680 7.445 1.00 0.00 O ATOM 35166 H1 WAT 6372 25.436 117.700 7.064 1.00 0.00 H ATOM 35167 H2 WAT 6372 26.558 118.601 7.533 1.00 0.00 H TER 35169 WAT 6372 ATOM 35169 O WAT 6373 124.261 134.156 3.310 1.00 0.00 O ATOM 35170 H1 WAT 6373 125.155 134.447 3.492 1.00 0.00 H ATOM 35171 H2 WAT 6373 124.243 134.016 2.363 1.00 0.00 H TER 35173 WAT 6373 ATOM 35173 O WAT 6374 133.506 79.308 95.685 1.00 0.00 O ATOM 35174 H1 WAT 6374 134.198 79.613 95.098 1.00 0.00 H ATOM 35175 H2 WAT 6374 133.602 79.846 96.470 1.00 0.00 H TER 35177 WAT 6374 ATOM 35177 O WAT 6375 109.293 39.446 113.095 1.00 0.00 O ATOM 35178 H1 WAT 6375 109.882 38.753 112.796 1.00 0.00 H ATOM 35179 H2 WAT 6375 109.207 40.029 112.342 1.00 0.00 H TER 35181 WAT 6375 ATOM 35181 O WAT 6376 129.859 77.429 17.148 1.00 0.00 O ATOM 35182 H1 WAT 6376 130.450 77.792 17.808 1.00 0.00 H ATOM 35183 H2 WAT 6376 129.187 78.101 17.032 1.00 0.00 H TER 35185 WAT 6376 ATOM 35185 O WAT 6377 38.057 66.104 91.098 1.00 0.00 O ATOM 35186 H1 WAT 6377 37.567 66.452 91.843 1.00 0.00 H ATOM 35187 H2 WAT 6377 38.972 66.136 91.378 1.00 0.00 H TER 35189 WAT 6377 ATOM 35189 O WAT 6378 46.784 134.233 83.974 1.00 0.00 O ATOM 35190 H1 WAT 6378 46.797 134.154 83.020 1.00 0.00 H ATOM 35191 H2 WAT 6378 46.769 133.329 84.289 1.00 0.00 H TER 35193 WAT 6378 ATOM 35193 O WAT 6379 67.593 23.733 89.398 1.00 0.00 O ATOM 35194 H1 WAT 6379 68.421 23.380 89.724 1.00 0.00 H ATOM 35195 H2 WAT 6379 67.329 23.125 88.708 1.00 0.00 H TER 35197 WAT 6379 ATOM 35197 O WAT 6380 120.650 93.278 67.716 1.00 0.00 O ATOM 35198 H1 WAT 6380 119.900 93.333 67.124 1.00 0.00 H ATOM 35199 H2 WAT 6380 121.413 93.339 67.142 1.00 0.00 H TER 35201 WAT 6380 ATOM 35201 O WAT 6381 122.801 21.367 114.079 1.00 0.00 O ATOM 35202 H1 WAT 6381 122.420 20.496 114.194 1.00 0.00 H ATOM 35203 H2 WAT 6381 122.906 21.702 114.969 1.00 0.00 H TER 35205 WAT 6381 ATOM 35205 O WAT 6382 70.145 60.646 147.091 1.00 0.00 O ATOM 35206 H1 WAT 6382 69.537 59.907 147.105 1.00 0.00 H ATOM 35207 H2 WAT 6382 69.764 61.281 147.698 1.00 0.00 H TER 35209 WAT 6382 ATOM 35209 O WAT 6383 74.894 59.990 127.632 1.00 0.00 O ATOM 35210 H1 WAT 6383 74.767 59.257 127.030 1.00 0.00 H ATOM 35211 H2 WAT 6383 75.344 60.654 127.109 1.00 0.00 H TER 35213 WAT 6383 ATOM 35213 O WAT 6384 86.243 144.365 147.482 1.00 0.00 O ATOM 35214 H1 WAT 6384 86.041 144.897 146.712 1.00 0.00 H ATOM 35215 H2 WAT 6384 87.199 144.324 147.500 1.00 0.00 H TER 35217 WAT 6384 ATOM 35217 O WAT 6385 60.701 53.193 82.297 1.00 0.00 O ATOM 35218 H1 WAT 6385 59.795 53.068 82.011 1.00 0.00 H ATOM 35219 H2 WAT 6385 61.010 53.945 81.791 1.00 0.00 H TER 35221 WAT 6385 ATOM 35221 O WAT 6386 21.006 113.733 10.967 1.00 0.00 O ATOM 35222 H1 WAT 6386 20.108 113.909 10.685 1.00 0.00 H ATOM 35223 H2 WAT 6386 20.916 113.420 11.867 1.00 0.00 H TER 35225 WAT 6386 ATOM 35225 O WAT 6387 -0.005 103.506 2.800 1.00 0.00 O ATOM 35226 H1 WAT 6387 0.574 103.687 3.540 1.00 0.00 H ATOM 35227 H2 WAT 6387 0.425 102.792 2.329 1.00 0.00 H TER 35229 WAT 6387 ATOM 35229 O WAT 6388 120.184 129.323 7.405 1.00 0.00 O ATOM 35230 H1 WAT 6388 120.066 129.847 6.613 1.00 0.00 H ATOM 35231 H2 WAT 6388 119.473 128.684 7.378 1.00 0.00 H TER 35233 WAT 6388 ATOM 35233 O WAT 6389 60.858 135.566 157.810 1.00 0.00 O ATOM 35234 H1 WAT 6389 61.323 135.946 158.556 1.00 0.00 H ATOM 35235 H2 WAT 6389 59.998 135.332 158.157 1.00 0.00 H TER 35237 WAT 6389 ATOM 35237 O WAT 6390 37.409 79.775 97.242 1.00 0.00 O ATOM 35238 H1 WAT 6390 36.508 79.619 96.960 1.00 0.00 H ATOM 35239 H2 WAT 6390 37.928 79.690 96.442 1.00 0.00 H TER 35241 WAT 6390 ATOM 35241 O WAT 6391 121.693 12.113 131.406 1.00 0.00 O ATOM 35242 H1 WAT 6391 120.907 12.630 131.228 1.00 0.00 H ATOM 35243 H2 WAT 6391 122.385 12.551 130.911 1.00 0.00 H TER 35245 WAT 6391 ATOM 35245 O WAT 6392 57.005 25.680 1.264 1.00 0.00 O ATOM 35246 H1 WAT 6392 57.089 26.060 2.139 1.00 0.00 H ATOM 35247 H2 WAT 6392 57.668 24.990 1.238 1.00 0.00 H TER 35249 WAT 6392 ATOM 35249 O WAT 6393 31.807 93.609 13.973 1.00 0.00 O ATOM 35250 H1 WAT 6393 30.932 93.474 14.336 1.00 0.00 H ATOM 35251 H2 WAT 6393 31.672 94.203 13.235 1.00 0.00 H TER 35253 WAT 6393 ATOM 35253 O WAT 6394 92.325 117.330 135.220 1.00 0.00 O ATOM 35254 H1 WAT 6394 92.692 117.090 134.370 1.00 0.00 H ATOM 35255 H2 WAT 6394 91.457 116.926 135.230 1.00 0.00 H TER 35257 WAT 6394 ATOM 35257 O WAT 6395 132.876 132.809 104.982 1.00 0.00 O ATOM 35258 H1 WAT 6395 133.662 132.327 104.725 1.00 0.00 H ATOM 35259 H2 WAT 6395 132.159 132.351 104.542 1.00 0.00 H TER 35261 WAT 6395 ATOM 35261 O WAT 6396 130.556 106.450 84.998 1.00 0.00 O ATOM 35262 H1 WAT 6396 129.873 105.794 85.137 1.00 0.00 H ATOM 35263 H2 WAT 6396 130.096 107.196 84.613 1.00 0.00 H TER 35265 WAT 6396 ATOM 35265 O WAT 6397 103.145 49.975 103.086 1.00 0.00 O ATOM 35266 H1 WAT 6397 103.678 49.213 103.314 1.00 0.00 H ATOM 35267 H2 WAT 6397 103.754 50.572 102.652 1.00 0.00 H TER 35269 WAT 6397 ATOM 35269 O WAT 6398 14.085 116.392 156.970 1.00 0.00 O ATOM 35270 H1 WAT 6398 13.795 116.079 156.114 1.00 0.00 H ATOM 35271 H2 WAT 6398 14.701 115.724 157.273 1.00 0.00 H TER 35273 WAT 6398 ATOM 35273 O WAT 6399 139.495 118.415 148.903 1.00 0.00 O ATOM 35274 H1 WAT 6399 138.849 117.831 148.506 1.00 0.00 H ATOM 35275 H2 WAT 6399 138.975 119.043 149.403 1.00 0.00 H TER 35277 WAT 6399 ATOM 35277 O WAT 6400 118.987 92.166 63.725 1.00 0.00 O ATOM 35278 H1 WAT 6400 119.176 92.998 64.158 1.00 0.00 H ATOM 35279 H2 WAT 6400 118.998 92.374 62.790 1.00 0.00 H TER 35281 WAT 6400 ATOM 35281 O WAT 6401 48.898 112.554 155.885 1.00 0.00 O ATOM 35282 H1 WAT 6401 48.795 111.602 155.867 1.00 0.00 H ATOM 35283 H2 WAT 6401 48.037 112.883 156.141 1.00 0.00 H TER 35285 WAT 6401 ATOM 35285 O WAT 6402 19.791 89.371 146.700 1.00 0.00 O ATOM 35286 H1 WAT 6402 18.861 89.582 146.775 1.00 0.00 H ATOM 35287 H2 WAT 6402 20.103 89.340 147.605 1.00 0.00 H TER 35289 WAT 6402 ATOM 35289 O WAT 6403 99.705 140.370 154.620 1.00 0.00 O ATOM 35290 H1 WAT 6403 99.710 141.320 154.504 1.00 0.00 H ATOM 35291 H2 WAT 6403 99.665 140.021 153.730 1.00 0.00 H TER 35293 WAT 6403 ATOM 35293 O WAT 6404 26.837 49.511 67.743 1.00 0.00 O ATOM 35294 H1 WAT 6404 27.142 49.771 66.873 1.00 0.00 H ATOM 35295 H2 WAT 6404 26.736 50.336 68.218 1.00 0.00 H TER 35297 WAT 6404 ATOM 35297 O WAT 6405 38.368 90.833 89.131 1.00 0.00 O ATOM 35298 H1 WAT 6405 37.488 90.665 88.794 1.00 0.00 H ATOM 35299 H2 WAT 6405 38.307 90.637 90.066 1.00 0.00 H TER 35301 WAT 6405 ATOM 35301 O WAT 6406 108.738 5.004 147.425 1.00 0.00 O ATOM 35302 H1 WAT 6406 108.832 4.183 147.908 1.00 0.00 H ATOM 35303 H2 WAT 6406 109.535 5.066 146.900 1.00 0.00 H TER 35305 WAT 6406 ATOM 35305 O WAT 6407 98.953 142.871 19.791 1.00 0.00 O ATOM 35306 H1 WAT 6407 99.082 142.405 20.617 1.00 0.00 H ATOM 35307 H2 WAT 6407 98.002 142.933 19.697 1.00 0.00 H TER 35309 WAT 6407 ATOM 35309 O WAT 6408 49.504 36.608 150.557 1.00 0.00 O ATOM 35310 H1 WAT 6408 49.621 36.503 151.501 1.00 0.00 H ATOM 35311 H2 WAT 6408 48.570 36.791 150.450 1.00 0.00 H TER 35313 WAT 6408 ATOM 35313 O WAT 6409 11.614 99.311 23.317 1.00 0.00 O ATOM 35314 H1 WAT 6409 11.915 99.675 24.150 1.00 0.00 H ATOM 35315 H2 WAT 6409 12.325 98.734 23.037 1.00 0.00 H TER 35317 WAT 6409 ATOM 35317 O WAT 6410 38.852 94.559 144.638 1.00 0.00 O ATOM 35318 H1 WAT 6410 38.547 95.448 144.457 1.00 0.00 H ATOM 35319 H2 WAT 6410 39.108 94.215 143.782 1.00 0.00 H TER 35321 WAT 6410 ATOM 35321 O WAT 6411 15.608 86.390 139.656 1.00 0.00 O ATOM 35322 H1 WAT 6411 16.466 86.701 139.944 1.00 0.00 H ATOM 35323 H2 WAT 6411 15.708 86.246 138.715 1.00 0.00 H TER 35325 WAT 6411 ATOM 35325 O WAT 6412 5.310 9.261 123.417 1.00 0.00 O ATOM 35326 H1 WAT 6412 4.914 8.393 123.341 1.00 0.00 H ATOM 35327 H2 WAT 6412 4.697 9.844 122.970 1.00 0.00 H TER 35329 WAT 6412 ATOM 35329 O WAT 6413 83.167 70.561 86.114 1.00 0.00 O ATOM 35330 H1 WAT 6413 83.195 71.385 86.599 1.00 0.00 H ATOM 35331 H2 WAT 6413 83.583 70.762 85.275 1.00 0.00 H TER 35333 WAT 6413 ATOM 35333 O WAT 6414 98.034 142.945 5.874 1.00 0.00 O ATOM 35334 H1 WAT 6414 98.262 142.931 4.944 1.00 0.00 H ATOM 35335 H2 WAT 6414 97.127 142.642 5.903 1.00 0.00 H TER 35337 WAT 6414 ATOM 35337 O WAT 6415 41.830 74.545 102.782 1.00 0.00 O ATOM 35338 H1 WAT 6415 41.935 74.173 103.657 1.00 0.00 H ATOM 35339 H2 WAT 6415 41.095 75.152 102.867 1.00 0.00 H TER 35341 WAT 6415 ATOM 35341 O WAT 6416 120.802 23.228 5.210 1.00 0.00 O ATOM 35342 H1 WAT 6416 120.198 23.573 4.552 1.00 0.00 H ATOM 35343 H2 WAT 6416 121.456 23.918 5.319 1.00 0.00 H TER 35345 WAT 6416 ATOM 35345 O WAT 6417 143.824 134.478 129.169 1.00 0.00 O ATOM 35346 H1 WAT 6417 144.559 134.498 129.783 1.00 0.00 H ATOM 35347 H2 WAT 6417 143.318 135.264 129.375 1.00 0.00 H TER 35349 WAT 6417 ATOM 35349 O WAT 6418 8.085 84.294 22.781 1.00 0.00 O ATOM 35350 H1 WAT 6418 7.957 83.872 23.630 1.00 0.00 H ATOM 35351 H2 WAT 6418 9.036 84.341 22.678 1.00 0.00 H TER 35353 WAT 6418 ATOM 35353 O WAT 6419 139.987 42.330 4.809 1.00 0.00 O ATOM 35354 H1 WAT 6419 139.698 42.732 5.628 1.00 0.00 H ATOM 35355 H2 WAT 6419 140.270 41.451 5.061 1.00 0.00 H TER 35357 WAT 6419 ATOM 35357 O WAT 6420 140.191 114.067 11.038 1.00 0.00 O ATOM 35358 H1 WAT 6420 139.530 114.195 10.358 1.00 0.00 H ATOM 35359 H2 WAT 6420 140.985 114.462 10.678 1.00 0.00 H TER 35361 WAT 6420 ATOM 35361 O WAT 6421 82.435 84.189 154.929 1.00 0.00 O ATOM 35362 H1 WAT 6421 83.227 84.678 155.153 1.00 0.00 H ATOM 35363 H2 WAT 6421 82.628 83.795 154.079 1.00 0.00 H TER 35365 WAT 6421 ATOM 35365 O WAT 6422 6.505 56.458 68.302 1.00 0.00 O ATOM 35366 H1 WAT 6422 5.852 56.219 67.644 1.00 0.00 H ATOM 35367 H2 WAT 6422 7.184 56.919 67.809 1.00 0.00 H TER 35369 WAT 6422 ATOM 35369 O WAT 6423 135.941 115.250 13.950 1.00 0.00 O ATOM 35370 H1 WAT 6423 135.197 115.190 13.351 1.00 0.00 H ATOM 35371 H2 WAT 6423 136.486 114.494 13.732 1.00 0.00 H TER 35373 WAT 6423 ATOM 35373 O WAT 6424 40.639 37.525 100.348 1.00 0.00 O ATOM 35374 H1 WAT 6424 40.462 36.628 100.065 1.00 0.00 H ATOM 35375 H2 WAT 6424 40.201 38.073 99.696 1.00 0.00 H TER 35377 WAT 6424 ATOM 35377 O WAT 6425 16.321 120.341 3.402 1.00 0.00 O ATOM 35378 H1 WAT 6425 15.754 120.513 4.154 1.00 0.00 H ATOM 35379 H2 WAT 6425 16.650 121.202 3.147 1.00 0.00 H TER 35381 WAT 6425 ATOM 35381 O WAT 6426 13.050 65.445 98.239 1.00 0.00 O ATOM 35382 H1 WAT 6426 13.339 66.208 98.740 1.00 0.00 H ATOM 35383 H2 WAT 6426 13.844 65.124 97.812 1.00 0.00 H TER 35385 WAT 6426 ATOM 35385 O WAT 6427 145.068 144.236 91.316 1.00 0.00 O ATOM 35386 H1 WAT 6427 145.896 144.598 90.999 1.00 0.00 H ATOM 35387 H2 WAT 6427 144.552 144.087 90.523 1.00 0.00 H TER 35389 WAT 6427 ATOM 35389 O WAT 6428 78.997 20.626 145.093 1.00 0.00 O ATOM 35390 H1 WAT 6428 78.781 21.349 145.682 1.00 0.00 H ATOM 35391 H2 WAT 6428 78.301 19.985 145.237 1.00 0.00 H TER 35393 WAT 6428 ATOM 35393 O WAT 6429 92.432 105.679 0.447 1.00 0.00 O ATOM 35394 H1 WAT 6429 92.673 106.586 0.258 1.00 0.00 H ATOM 35395 H2 WAT 6429 92.110 105.338 -0.387 1.00 0.00 H TER 35397 WAT 6429 ATOM 35397 O WAT 6430 119.569 125.524 144.739 1.00 0.00 O ATOM 35398 H1 WAT 6430 118.813 125.273 145.270 1.00 0.00 H ATOM 35399 H2 WAT 6430 119.190 125.909 143.949 1.00 0.00 H TER 35401 WAT 6430 ATOM 35401 O WAT 6431 140.293 101.576 8.560 1.00 0.00 O ATOM 35402 H1 WAT 6431 141.159 101.523 8.964 1.00 0.00 H ATOM 35403 H2 WAT 6431 140.234 100.791 8.016 1.00 0.00 H TER 35405 WAT 6431 ATOM 35405 O WAT 6432 32.309 46.711 90.107 1.00 0.00 O ATOM 35406 H1 WAT 6432 33.065 46.223 90.435 1.00 0.00 H ATOM 35407 H2 WAT 6432 32.177 46.380 89.219 1.00 0.00 H TER 35409 WAT 6432 ATOM 35409 O WAT 6433 77.649 119.133 147.177 1.00 0.00 O ATOM 35410 H1 WAT 6433 77.317 118.637 146.429 1.00 0.00 H ATOM 35411 H2 WAT 6433 77.454 120.046 146.965 1.00 0.00 H TER 35413 WAT 6433 ATOM 35413 O WAT 6434 25.032 140.702 131.813 1.00 0.00 O ATOM 35414 H1 WAT 6434 25.477 141.154 132.530 1.00 0.00 H ATOM 35415 H2 WAT 6434 24.449 141.362 131.439 1.00 0.00 H TER 35417 WAT 6434 ATOM 35417 O WAT 6435 145.515 141.044 65.467 1.00 0.00 O ATOM 35418 H1 WAT 6435 145.324 141.640 64.743 1.00 0.00 H ATOM 35419 H2 WAT 6435 144.713 140.533 65.575 1.00 0.00 H TER 35421 WAT 6435 ATOM 35421 O WAT 6436 32.641 7.012 114.838 1.00 0.00 O ATOM 35422 H1 WAT 6436 33.403 7.522 115.114 1.00 0.00 H ATOM 35423 H2 WAT 6436 32.652 6.240 115.404 1.00 0.00 H TER 35425 WAT 6436 ATOM 35425 O WAT 6437 12.906 129.649 155.831 1.00 0.00 O ATOM 35426 H1 WAT 6437 13.639 129.239 156.290 1.00 0.00 H ATOM 35427 H2 WAT 6437 12.489 130.203 156.491 1.00 0.00 H TER 35429 WAT 6437 ATOM 35429 O WAT 6438 7.445 67.056 2.780 1.00 0.00 O ATOM 35430 H1 WAT 6438 7.292 66.785 1.875 1.00 0.00 H ATOM 35431 H2 WAT 6438 6.984 66.403 3.307 1.00 0.00 H TER 35433 WAT 6438 ATOM 35433 O WAT 6439 144.323 68.032 120.566 1.00 0.00 O ATOM 35434 H1 WAT 6439 144.529 67.099 120.513 1.00 0.00 H ATOM 35435 H2 WAT 6439 143.414 68.093 120.273 1.00 0.00 H TER 35437 WAT 6439 ATOM 35437 O WAT 6440 11.515 26.222 103.636 1.00 0.00 O ATOM 35438 H1 WAT 6440 11.799 25.360 103.333 1.00 0.00 H ATOM 35439 H2 WAT 6440 11.993 26.357 104.455 1.00 0.00 H TER 35441 WAT 6440 ATOM 35441 O WAT 6441 73.312 85.315 103.284 1.00 0.00 O ATOM 35442 H1 WAT 6441 73.765 85.996 103.781 1.00 0.00 H ATOM 35443 H2 WAT 6441 73.777 84.508 103.503 1.00 0.00 H TER 35445 WAT 6441 ATOM 35445 O WAT 6442 118.062 123.169 12.854 1.00 0.00 O ATOM 35446 H1 WAT 6442 118.306 122.762 13.686 1.00 0.00 H ATOM 35447 H2 WAT 6442 117.378 123.798 13.086 1.00 0.00 H TER 35449 WAT 6442 ATOM 35449 O WAT 6443 79.255 92.896 131.116 1.00 0.00 O ATOM 35450 H1 WAT 6443 78.621 93.613 131.138 1.00 0.00 H ATOM 35451 H2 WAT 6443 79.693 92.939 131.966 1.00 0.00 H TER 35453 WAT 6443 ATOM 35453 O WAT 6444 26.205 137.621 0.637 1.00 0.00 O ATOM 35454 H1 WAT 6444 26.143 137.818 1.572 1.00 0.00 H ATOM 35455 H2 WAT 6444 26.663 136.781 0.599 1.00 0.00 H TER 35457 WAT 6444 ATOM 35457 O WAT 6445 10.959 18.958 66.573 1.00 0.00 O ATOM 35458 H1 WAT 6445 11.668 19.387 67.052 1.00 0.00 H ATOM 35459 H2 WAT 6445 10.443 19.679 66.213 1.00 0.00 H TER 35461 WAT 6445 ATOM 35461 O WAT 6446 74.627 114.805 5.307 1.00 0.00 O ATOM 35462 H1 WAT 6446 75.092 114.623 6.124 1.00 0.00 H ATOM 35463 H2 WAT 6446 74.881 114.090 4.723 1.00 0.00 H TER 35465 WAT 6446 ATOM 35465 O WAT 6447 46.734 0.386 97.104 1.00 0.00 O ATOM 35466 H1 WAT 6447 47.583 -0.057 97.104 1.00 0.00 H ATOM 35467 H2 WAT 6447 46.096 -0.321 97.192 1.00 0.00 H TER 35469 WAT 6447 ATOM 35469 O WAT 6448 43.288 86.133 113.435 1.00 0.00 O ATOM 35470 H1 WAT 6448 42.575 86.005 112.809 1.00 0.00 H ATOM 35471 H2 WAT 6448 42.851 86.385 114.248 1.00 0.00 H TER 35473 WAT 6448 ATOM 35473 O WAT 6449 0.582 134.310 157.347 1.00 0.00 O ATOM 35474 H1 WAT 6449 0.658 135.109 156.826 1.00 0.00 H ATOM 35475 H2 WAT 6449 0.661 134.606 158.253 1.00 0.00 H TER 35477 WAT 6449 ATOM 35477 O WAT 6450 78.192 116.664 139.235 1.00 0.00 O ATOM 35478 H1 WAT 6450 78.247 116.405 140.155 1.00 0.00 H ATOM 35479 H2 WAT 6450 77.292 116.970 139.125 1.00 0.00 H TER 35481 WAT 6450 ATOM 35481 O WAT 6451 126.379 64.750 69.051 1.00 0.00 O ATOM 35482 H1 WAT 6451 126.087 64.387 68.215 1.00 0.00 H ATOM 35483 H2 WAT 6451 127.113 64.194 69.311 1.00 0.00 H TER 35485 WAT 6451 ATOM 35485 O WAT 6452 92.041 69.744 21.993 1.00 0.00 O ATOM 35486 H1 WAT 6452 92.846 70.132 22.335 1.00 0.00 H ATOM 35487 H2 WAT 6452 92.000 68.879 22.400 1.00 0.00 H TER 35489 WAT 6452 ATOM 35489 O WAT 6453 46.505 46.525 56.445 1.00 0.00 O ATOM 35490 H1 WAT 6453 46.618 46.675 55.506 1.00 0.00 H ATOM 35491 H2 WAT 6453 46.060 47.311 56.761 1.00 0.00 H TER 35493 WAT 6453 ATOM 35493 O WAT 6454 120.829 31.497 13.090 1.00 0.00 O ATOM 35494 H1 WAT 6454 121.631 31.949 12.825 1.00 0.00 H ATOM 35495 H2 WAT 6454 120.652 31.821 13.973 1.00 0.00 H TER 35497 WAT 6454 ATOM 35497 O WAT 6455 70.494 108.312 106.379 1.00 0.00 O ATOM 35498 H1 WAT 6455 70.366 107.365 106.431 1.00 0.00 H ATOM 35499 H2 WAT 6455 71.076 108.434 105.628 1.00 0.00 H TER 35501 WAT 6455 ATOM 35501 O WAT 6456 124.221 10.013 80.239 1.00 0.00 O ATOM 35502 H1 WAT 6456 125.014 9.746 79.773 1.00 0.00 H ATOM 35503 H2 WAT 6456 123.838 9.192 80.549 1.00 0.00 H TER 35505 WAT 6456 ATOM 35505 O WAT 6457 100.425 69.625 80.478 1.00 0.00 O ATOM 35506 H1 WAT 6457 99.732 70.185 80.128 1.00 0.00 H ATOM 35507 H2 WAT 6457 101.056 69.549 79.763 1.00 0.00 H TER 35509 WAT 6457 ATOM 35509 O WAT 6458 84.197 107.575 93.571 1.00 0.00 O ATOM 35510 H1 WAT 6458 83.615 106.821 93.475 1.00 0.00 H ATOM 35511 H2 WAT 6458 85.073 107.223 93.415 1.00 0.00 H TER 35513 WAT 6458 ATOM 35513 O WAT 6459 144.606 72.536 97.583 1.00 0.00 O ATOM 35514 H1 WAT 6459 144.997 73.357 97.884 1.00 0.00 H ATOM 35515 H2 WAT 6459 143.665 72.709 97.572 1.00 0.00 H TER 35517 WAT 6459 ATOM 35517 O WAT 6460 106.918 47.476 96.046 1.00 0.00 O ATOM 35518 H1 WAT 6460 107.668 47.352 96.626 1.00 0.00 H ATOM 35519 H2 WAT 6460 106.307 46.782 96.291 1.00 0.00 H TER 35521 WAT 6460 ATOM 35521 O WAT 6461 51.521 51.291 147.189 1.00 0.00 O ATOM 35522 H1 WAT 6461 50.886 51.980 147.388 1.00 0.00 H ATOM 35523 H2 WAT 6461 52.362 51.745 147.148 1.00 0.00 H TER 35525 WAT 6461 ATOM 35525 O WAT 6462 89.691 142.296 0.517 1.00 0.00 O ATOM 35526 H1 WAT 6462 90.551 141.918 0.701 1.00 0.00 H ATOM 35527 H2 WAT 6462 89.072 141.600 0.734 1.00 0.00 H TER 35529 WAT 6462 ATOM 35529 O WAT 6463 102.723 105.784 128.795 1.00 0.00 O ATOM 35530 H1 WAT 6463 103.114 106.452 128.231 1.00 0.00 H ATOM 35531 H2 WAT 6463 101.899 105.559 128.363 1.00 0.00 H TER 35533 WAT 6463 ATOM 35533 O WAT 6464 83.818 132.717 6.287 1.00 0.00 O ATOM 35534 H1 WAT 6464 84.041 133.632 6.116 1.00 0.00 H ATOM 35535 H2 WAT 6464 84.369 132.470 7.029 1.00 0.00 H TER 35537 WAT 6464 ATOM 35537 O WAT 6465 82.037 79.154 99.785 1.00 0.00 O ATOM 35538 H1 WAT 6465 82.642 78.445 99.568 1.00 0.00 H ATOM 35539 H2 WAT 6465 82.601 79.866 100.087 1.00 0.00 H TER 35541 WAT 6465 ATOM 35541 O WAT 6466 51.266 118.632 69.190 1.00 0.00 O ATOM 35542 H1 WAT 6466 50.702 119.400 69.094 1.00 0.00 H ATOM 35543 H2 WAT 6466 50.671 117.886 69.112 1.00 0.00 H TER 35545 WAT 6466 ATOM 35545 O WAT 6467 101.766 34.392 28.482 1.00 0.00 O ATOM 35546 H1 WAT 6467 101.689 33.672 27.855 1.00 0.00 H ATOM 35547 H2 WAT 6467 100.862 34.601 28.718 1.00 0.00 H TER 35549 WAT 6467 ATOM 35549 O WAT 6468 94.407 44.186 22.433 1.00 0.00 O ATOM 35550 H1 WAT 6468 93.983 43.532 21.877 1.00 0.00 H ATOM 35551 H2 WAT 6468 94.446 43.778 23.297 1.00 0.00 H TER 35553 WAT 6468 ATOM 35553 O WAT 6469 38.349 61.261 152.505 1.00 0.00 O ATOM 35554 H1 WAT 6469 37.424 61.054 152.640 1.00 0.00 H ATOM 35555 H2 WAT 6469 38.540 60.943 151.623 1.00 0.00 H TER 35557 WAT 6469 ATOM 35557 O WAT 6470 81.967 125.149 13.737 1.00 0.00 O ATOM 35558 H1 WAT 6470 82.077 124.209 13.594 1.00 0.00 H ATOM 35559 H2 WAT 6470 82.391 125.314 14.580 1.00 0.00 H TER 35561 WAT 6470 ATOM 35561 O WAT 6471 39.966 97.729 132.392 1.00 0.00 O ATOM 35562 H1 WAT 6471 39.278 97.949 133.020 1.00 0.00 H ATOM 35563 H2 WAT 6471 40.218 98.569 132.009 1.00 0.00 H TER 35565 WAT 6471 ATOM 35565 O WAT 6472 84.478 43.702 97.966 1.00 0.00 O ATOM 35566 H1 WAT 6472 84.429 44.185 97.141 1.00 0.00 H ATOM 35567 H2 WAT 6472 85.129 44.176 98.484 1.00 0.00 H TER 35569 WAT 6472 ATOM 35569 O WAT 6473 120.332 31.829 66.234 1.00 0.00 O ATOM 35570 H1 WAT 6473 120.745 30.976 66.369 1.00 0.00 H ATOM 35571 H2 WAT 6473 119.809 31.969 67.023 1.00 0.00 H TER 35573 WAT 6473 ATOM 35573 O WAT 6474 52.570 6.192 56.359 1.00 0.00 O ATOM 35574 H1 WAT 6474 51.661 6.450 56.512 1.00 0.00 H ATOM 35575 H2 WAT 6474 52.647 6.136 55.407 1.00 0.00 H TER 35577 WAT 6474 ATOM 35577 O WAT 6475 57.908 68.312 98.891 1.00 0.00 O ATOM 35578 H1 WAT 6475 57.519 67.525 99.272 1.00 0.00 H ATOM 35579 H2 WAT 6475 58.826 68.081 98.751 1.00 0.00 H TER 35581 WAT 6475 ATOM 35581 O WAT 6476 111.627 128.271 19.941 1.00 0.00 O ATOM 35582 H1 WAT 6476 111.555 129.042 20.504 1.00 0.00 H ATOM 35583 H2 WAT 6476 112.354 128.472 19.352 1.00 0.00 H TER 35585 WAT 6476 ATOM 35585 O WAT 6477 13.046 28.819 104.610 1.00 0.00 O ATOM 35586 H1 WAT 6477 13.574 28.140 104.191 1.00 0.00 H ATOM 35587 H2 WAT 6477 13.387 28.872 105.503 1.00 0.00 H TER 35589 WAT 6477 ATOM 35589 O WAT 6478 23.532 134.132 72.662 1.00 0.00 O ATOM 35590 H1 WAT 6478 23.010 133.611 73.272 1.00 0.00 H ATOM 35591 H2 WAT 6478 23.727 134.938 73.142 1.00 0.00 H TER 35593 WAT 6478 ATOM 35593 O WAT 6479 5.462 58.507 148.530 1.00 0.00 O ATOM 35594 H1 WAT 6479 5.937 57.693 148.360 1.00 0.00 H ATOM 35595 H2 WAT 6479 5.141 58.781 147.671 1.00 0.00 H TER 35597 WAT 6479 ATOM 35597 O WAT 6480 19.941 117.674 1.656 1.00 0.00 O ATOM 35598 H1 WAT 6480 20.703 117.250 1.263 1.00 0.00 H ATOM 35599 H2 WAT 6480 19.191 117.203 1.294 1.00 0.00 H TER 35601 WAT 6480 ATOM 35601 O WAT 6481 133.697 126.720 106.279 1.00 0.00 O ATOM 35602 H1 WAT 6481 133.687 126.782 105.324 1.00 0.00 H ATOM 35603 H2 WAT 6481 134.626 126.720 106.509 1.00 0.00 H TER 35605 WAT 6481 ATOM 35605 O WAT 6482 70.023 45.738 113.540 1.00 0.00 O ATOM 35606 H1 WAT 6482 69.595 45.771 112.685 1.00 0.00 H ATOM 35607 H2 WAT 6482 69.935 44.826 113.817 1.00 0.00 H TER 35609 WAT 6482 ATOM 35609 O WAT 6483 81.863 18.997 101.676 1.00 0.00 O ATOM 35610 H1 WAT 6483 82.721 18.688 101.388 1.00 0.00 H ATOM 35611 H2 WAT 6483 81.635 18.425 102.409 1.00 0.00 H TER 35613 WAT 6483 ATOM 35613 O WAT 6484 44.721 16.745 144.647 1.00 0.00 O ATOM 35614 H1 WAT 6484 44.892 15.815 144.797 1.00 0.00 H ATOM 35615 H2 WAT 6484 44.108 16.760 143.911 1.00 0.00 H TER 35617 WAT 6484 ATOM 35617 O WAT 6485 128.734 139.216 107.300 1.00 0.00 O ATOM 35618 H1 WAT 6485 129.530 139.536 106.875 1.00 0.00 H ATOM 35619 H2 WAT 6485 128.081 139.196 106.600 1.00 0.00 H TER 35621 WAT 6485 ATOM 35621 O WAT 6486 112.288 74.716 95.941 1.00 0.00 O ATOM 35622 H1 WAT 6486 112.585 75.518 96.369 1.00 0.00 H ATOM 35623 H2 WAT 6486 111.789 74.255 96.615 1.00 0.00 H TER 35625 WAT 6486 ATOM 35625 O WAT 6487 138.381 53.684 120.891 1.00 0.00 O ATOM 35626 H1 WAT 6487 138.030 52.794 120.897 1.00 0.00 H ATOM 35627 H2 WAT 6487 139.171 53.635 121.429 1.00 0.00 H TER 35629 WAT 6487 ATOM 35629 O WAT 6488 1.220 56.861 1.857 1.00 0.00 O ATOM 35630 H1 WAT 6488 0.431 57.400 1.916 1.00 0.00 H ATOM 35631 H2 WAT 6488 1.566 56.845 2.750 1.00 0.00 H TER 35633 WAT 6488 ATOM 35633 O WAT 6489 72.198 129.724 144.865 1.00 0.00 O ATOM 35634 H1 WAT 6489 71.727 129.524 144.057 1.00 0.00 H ATOM 35635 H2 WAT 6489 71.878 129.078 145.495 1.00 0.00 H TER 35637 WAT 6489 ATOM 35637 O WAT 6490 51.927 53.351 89.618 1.00 0.00 O ATOM 35638 H1 WAT 6490 52.594 52.944 90.171 1.00 0.00 H ATOM 35639 H2 WAT 6490 52.358 53.472 88.772 1.00 0.00 H TER 35641 WAT 6490 ATOM 35641 O WAT 6491 93.357 96.275 118.337 1.00 0.00 O ATOM 35642 H1 WAT 6491 92.414 96.149 118.232 1.00 0.00 H ATOM 35643 H2 WAT 6491 93.722 95.391 118.293 1.00 0.00 H TER 35645 WAT 6491 ATOM 35645 O WAT 6492 24.509 76.515 19.389 1.00 0.00 O ATOM 35646 H1 WAT 6492 24.014 76.350 18.586 1.00 0.00 H ATOM 35647 H2 WAT 6492 24.307 75.769 19.953 1.00 0.00 H TER 35649 WAT 6492 ATOM 35649 O WAT 6493 103.110 119.910 16.219 1.00 0.00 O ATOM 35650 H1 WAT 6493 103.163 119.875 15.264 1.00 0.00 H ATOM 35651 H2 WAT 6493 103.362 119.031 16.504 1.00 0.00 H TER 35653 WAT 6493 ATOM 35653 O WAT 6494 95.667 13.578 131.637 1.00 0.00 O ATOM 35654 H1 WAT 6494 96.239 13.982 132.290 1.00 0.00 H ATOM 35655 H2 WAT 6494 95.448 14.292 131.038 1.00 0.00 H TER 35657 WAT 6494 ATOM 35657 O WAT 6495 35.761 73.569 154.840 1.00 0.00 O ATOM 35658 H1 WAT 6495 36.443 74.198 154.606 1.00 0.00 H ATOM 35659 H2 WAT 6495 35.119 73.639 154.133 1.00 0.00 H TER 35661 WAT 6495 ATOM 35661 O WAT 6496 38.929 14.881 58.980 1.00 0.00 O ATOM 35662 H1 WAT 6496 38.235 14.225 59.042 1.00 0.00 H ATOM 35663 H2 WAT 6496 39.151 14.908 58.049 1.00 0.00 H TER 35665 WAT 6496 ATOM 35665 O WAT 6497 32.060 29.784 157.182 1.00 0.00 O ATOM 35666 H1 WAT 6497 32.747 30.443 157.086 1.00 0.00 H ATOM 35667 H2 WAT 6497 32.190 29.430 158.062 1.00 0.00 H TER 35669 WAT 6497 ATOM 35669 O WAT 6498 32.688 4.659 19.219 1.00 0.00 O ATOM 35670 H1 WAT 6498 33.242 4.604 18.441 1.00 0.00 H ATOM 35671 H2 WAT 6498 33.140 4.126 19.873 1.00 0.00 H TER 35673 WAT 6498 ATOM 35673 O WAT 6499 108.969 35.453 56.758 1.00 0.00 O ATOM 35674 H1 WAT 6499 108.082 35.723 56.519 1.00 0.00 H ATOM 35675 H2 WAT 6499 108.863 34.571 57.116 1.00 0.00 H TER 35677 WAT 6499 ATOM 35677 O WAT 6500 14.049 39.330 123.516 1.00 0.00 O ATOM 35678 H1 WAT 6500 14.816 39.599 123.010 1.00 0.00 H ATOM 35679 H2 WAT 6500 13.601 40.150 123.725 1.00 0.00 H TER 35681 WAT 6500 ATOM 35681 O WAT 6501 1.926 58.481 14.652 1.00 0.00 O ATOM 35682 H1 WAT 6501 2.096 57.937 13.883 1.00 0.00 H ATOM 35683 H2 WAT 6501 2.237 57.957 15.390 1.00 0.00 H TER 35685 WAT 6501 ATOM 35685 O WAT 6502 30.227 111.264 82.274 1.00 0.00 O ATOM 35686 H1 WAT 6502 31.034 111.444 81.793 1.00 0.00 H ATOM 35687 H2 WAT 6502 30.436 111.480 83.183 1.00 0.00 H TER 35689 WAT 6502 ATOM 35689 O WAT 6503 108.748 72.714 121.362 1.00 0.00 O ATOM 35690 H1 WAT 6503 108.394 73.539 121.029 1.00 0.00 H ATOM 35691 H2 WAT 6503 108.105 72.420 122.007 1.00 0.00 H TER 35693 WAT 6503 ATOM 35693 O WAT 6504 59.333 96.334 103.950 1.00 0.00 O ATOM 35694 H1 WAT 6504 60.051 96.380 103.319 1.00 0.00 H ATOM 35695 H2 WAT 6504 58.612 96.800 103.527 1.00 0.00 H TER 35697 WAT 6504 ATOM 35697 O WAT 6505 108.130 28.589 97.845 1.00 0.00 O ATOM 35698 H1 WAT 6505 108.358 28.526 98.773 1.00 0.00 H ATOM 35699 H2 WAT 6505 108.749 28.005 97.407 1.00 0.00 H TER 35701 WAT 6505 ATOM 35701 O WAT 6506 41.936 99.537 80.986 1.00 0.00 O ATOM 35702 H1 WAT 6506 42.872 99.672 80.841 1.00 0.00 H ATOM 35703 H2 WAT 6506 41.739 100.048 81.771 1.00 0.00 H TER 35705 WAT 6506 ATOM 35705 O WAT 6507 3.938 119.777 118.182 1.00 0.00 O ATOM 35706 H1 WAT 6507 3.081 120.083 117.883 1.00 0.00 H ATOM 35707 H2 WAT 6507 4.240 119.195 117.485 1.00 0.00 H TER 35709 WAT 6507 ATOM 35709 O WAT 6508 123.043 26.637 127.037 1.00 0.00 O ATOM 35710 H1 WAT 6508 122.954 25.890 127.628 1.00 0.00 H ATOM 35711 H2 WAT 6508 122.870 27.400 127.588 1.00 0.00 H TER 35713 WAT 6508 ATOM 35713 O WAT 6509 23.780 48.878 127.191 1.00 0.00 O ATOM 35714 H1 WAT 6509 24.366 48.312 126.689 1.00 0.00 H ATOM 35715 H2 WAT 6509 23.725 48.463 128.052 1.00 0.00 H TER 35717 WAT 6509 ATOM 35717 O WAT 6510 24.210 122.298 100.076 1.00 0.00 O ATOM 35718 H1 WAT 6510 24.513 123.127 100.445 1.00 0.00 H ATOM 35719 H2 WAT 6510 24.406 122.364 99.142 1.00 0.00 H TER 35721 WAT 6510 ATOM 35721 O WAT 6511 115.974 100.091 62.798 1.00 0.00 O ATOM 35722 H1 WAT 6511 116.402 99.252 62.966 1.00 0.00 H ATOM 35723 H2 WAT 6511 115.430 99.932 62.027 1.00 0.00 H TER 35725 WAT 6511 ATOM 35725 O WAT 6512 73.618 64.954 81.808 1.00 0.00 O ATOM 35726 H1 WAT 6512 74.195 64.730 81.078 1.00 0.00 H ATOM 35727 H2 WAT 6512 74.197 64.992 82.569 1.00 0.00 H TER 35729 WAT 6512 ATOM 35729 O WAT 6513 142.604 64.960 11.944 1.00 0.00 O ATOM 35730 H1 WAT 6513 142.601 64.041 11.676 1.00 0.00 H ATOM 35731 H2 WAT 6513 143.151 65.398 11.292 1.00 0.00 H TER 35733 WAT 6513 ATOM 35733 O WAT 6514 52.563 20.940 111.402 1.00 0.00 O ATOM 35734 H1 WAT 6514 52.880 20.226 110.850 1.00 0.00 H ATOM 35735 H2 WAT 6514 53.254 21.065 112.053 1.00 0.00 H TER 35737 WAT 6514 ATOM 35737 O WAT 6515 58.809 63.248 145.896 1.00 0.00 O ATOM 35738 H1 WAT 6515 57.923 63.017 146.174 1.00 0.00 H ATOM 35739 H2 WAT 6515 59.369 62.590 146.310 1.00 0.00 H TER 35741 WAT 6515 ATOM 35741 O WAT 6516 16.820 14.626 99.691 1.00 0.00 O ATOM 35742 H1 WAT 6516 16.921 13.977 98.994 1.00 0.00 H ATOM 35743 H2 WAT 6516 15.876 14.665 99.847 1.00 0.00 H TER 35745 WAT 6516 ATOM 35745 O WAT 6517 134.636 43.195 74.722 1.00 0.00 O ATOM 35746 H1 WAT 6517 134.654 43.215 73.765 1.00 0.00 H ATOM 35747 H2 WAT 6517 135.454 42.763 74.968 1.00 0.00 H TER 35749 WAT 6517 ATOM 35749 O WAT 6518 109.216 47.204 97.370 1.00 0.00 O ATOM 35750 H1 WAT 6518 109.532 47.832 96.720 1.00 0.00 H ATOM 35751 H2 WAT 6518 109.735 46.416 97.214 1.00 0.00 H TER 35753 WAT 6518 ATOM 35753 O WAT 6519 142.479 3.977 99.145 1.00 0.00 O ATOM 35754 H1 WAT 6519 143.302 3.518 99.316 1.00 0.00 H ATOM 35755 H2 WAT 6519 142.155 3.592 98.331 1.00 0.00 H TER 35757 WAT 6519 ATOM 35757 O WAT 6520 16.697 126.470 89.202 1.00 0.00 O ATOM 35758 H1 WAT 6520 17.546 126.774 89.521 1.00 0.00 H ATOM 35759 H2 WAT 6520 16.777 126.490 88.249 1.00 0.00 H TER 35761 WAT 6520 ATOM 35761 O WAT 6521 67.670 126.111 54.484 1.00 0.00 O ATOM 35762 H1 WAT 6521 67.237 125.776 55.269 1.00 0.00 H ATOM 35763 H2 WAT 6521 68.527 126.408 54.791 1.00 0.00 H TER 35765 WAT 6521 ATOM 35765 O WAT 6522 106.187 136.277 78.653 1.00 0.00 O ATOM 35766 H1 WAT 6522 106.366 135.956 79.537 1.00 0.00 H ATOM 35767 H2 WAT 6522 105.274 136.036 78.491 1.00 0.00 H TER 35769 WAT 6522 ATOM 35769 O WAT 6523 126.622 137.932 120.009 1.00 0.00 O ATOM 35770 H1 WAT 6523 125.694 137.830 119.800 1.00 0.00 H ATOM 35771 H2 WAT 6523 126.635 138.180 120.933 1.00 0.00 H TER 35773 WAT 6523 ATOM 35773 O WAT 6524 44.620 38.417 142.014 1.00 0.00 O ATOM 35774 H1 WAT 6524 43.845 38.210 142.537 1.00 0.00 H ATOM 35775 H2 WAT 6524 44.293 38.484 141.117 1.00 0.00 H TER 35777 WAT 6524 ATOM 35777 O WAT 6525 145.069 12.017 99.400 1.00 0.00 O ATOM 35778 H1 WAT 6525 145.483 11.393 98.804 1.00 0.00 H ATOM 35779 H2 WAT 6525 145.674 12.080 100.139 1.00 0.00 H TER 35781 WAT 6525 ATOM 35781 O WAT 6526 68.648 65.357 132.534 1.00 0.00 O ATOM 35782 H1 WAT 6526 69.461 65.333 132.030 1.00 0.00 H ATOM 35783 H2 WAT 6526 68.923 65.582 133.423 1.00 0.00 H TER 35785 WAT 6526 ATOM 35785 O WAT 6527 129.819 54.886 1.046 1.00 0.00 O ATOM 35786 H1 WAT 6527 129.139 54.369 1.479 1.00 0.00 H ATOM 35787 H2 WAT 6527 129.590 54.851 0.117 1.00 0.00 H TER 35789 WAT 6527 ATOM 35789 O WAT 6528 29.382 104.883 149.544 1.00 0.00 O ATOM 35790 H1 WAT 6528 28.536 105.208 149.236 1.00 0.00 H ATOM 35791 H2 WAT 6528 30.004 105.160 148.872 1.00 0.00 H TER 35793 WAT 6528 ATOM 35793 O WAT 6529 30.047 74.145 106.693 1.00 0.00 O ATOM 35794 H1 WAT 6529 29.118 74.041 106.486 1.00 0.00 H ATOM 35795 H2 WAT 6529 30.101 74.994 107.132 1.00 0.00 H TER 35797 WAT 6529 ATOM 35797 O WAT 6530 10.246 4.389 108.619 1.00 0.00 O ATOM 35798 H1 WAT 6530 10.864 5.071 108.884 1.00 0.00 H ATOM 35799 H2 WAT 6530 9.894 4.053 109.443 1.00 0.00 H TER 35801 WAT 6530 ATOM 35801 O WAT 6531 72.681 101.812 149.885 1.00 0.00 O ATOM 35802 H1 WAT 6531 71.747 101.912 150.069 1.00 0.00 H ATOM 35803 H2 WAT 6531 73.109 102.434 150.473 1.00 0.00 H TER 35805 WAT 6531 ATOM 35805 O WAT 6532 73.846 28.070 133.788 1.00 0.00 O ATOM 35806 H1 WAT 6532 74.587 28.077 133.182 1.00 0.00 H ATOM 35807 H2 WAT 6532 73.106 28.380 133.265 1.00 0.00 H TER 35809 WAT 6532 ATOM 35809 O WAT 6533 73.824 128.223 61.010 1.00 0.00 O ATOM 35810 H1 WAT 6533 74.034 127.344 60.693 1.00 0.00 H ATOM 35811 H2 WAT 6533 72.906 128.350 60.773 1.00 0.00 H TER 35813 WAT 6533 ATOM 35813 O WAT 6534 140.820 53.574 143.348 1.00 0.00 O ATOM 35814 H1 WAT 6534 140.301 53.776 142.569 1.00 0.00 H ATOM 35815 H2 WAT 6534 140.249 53.018 143.878 1.00 0.00 H TER 35817 WAT 6534 ATOM 35817 O WAT 6535 104.266 69.958 99.038 1.00 0.00 O ATOM 35818 H1 WAT 6535 104.736 70.277 98.267 1.00 0.00 H ATOM 35819 H2 WAT 6535 104.756 69.183 99.313 1.00 0.00 H TER 35821 WAT 6535 ATOM 35821 O WAT 6536 138.062 46.335 95.175 1.00 0.00 O ATOM 35822 H1 WAT 6536 138.863 45.817 95.255 1.00 0.00 H ATOM 35823 H2 WAT 6536 137.765 46.181 94.278 1.00 0.00 H TER 35825 WAT 6536 ATOM 35825 O WAT 6537 95.739 39.002 97.318 1.00 0.00 O ATOM 35826 H1 WAT 6537 96.466 38.945 97.938 1.00 0.00 H ATOM 35827 H2 WAT 6537 95.296 39.821 97.542 1.00 0.00 H TER 35829 WAT 6537 ATOM 35829 O WAT 6538 59.345 76.215 66.977 1.00 0.00 O ATOM 35830 H1 WAT 6538 58.970 75.632 67.637 1.00 0.00 H ATOM 35831 H2 WAT 6538 58.855 77.032 67.072 1.00 0.00 H TER 35833 WAT 6538 ATOM 35833 O WAT 6539 6.471 24.874 114.714 1.00 0.00 O ATOM 35834 H1 WAT 6539 5.578 24.863 115.058 1.00 0.00 H ATOM 35835 H2 WAT 6539 6.533 24.080 114.183 1.00 0.00 H TER 35837 WAT 6539 ATOM 35837 O WAT 6540 56.400 55.744 113.651 1.00 0.00 O ATOM 35838 H1 WAT 6540 57.314 55.758 113.366 1.00 0.00 H ATOM 35839 H2 WAT 6540 56.262 54.853 113.971 1.00 0.00 H TER 35841 WAT 6540 ATOM 35841 O WAT 6541 46.502 107.709 4.525 1.00 0.00 O ATOM 35842 H1 WAT 6541 46.443 108.644 4.719 1.00 0.00 H ATOM 35843 H2 WAT 6541 47.324 107.616 4.044 1.00 0.00 H TER 35845 WAT 6541 ATOM 35845 O WAT 6542 105.426 23.598 17.986 1.00 0.00 O ATOM 35846 H1 WAT 6542 106.304 23.220 18.014 1.00 0.00 H ATOM 35847 H2 WAT 6542 105.409 24.104 17.173 1.00 0.00 H TER 35849 WAT 6542 ATOM 35849 O WAT 6543 18.651 54.740 3.582 1.00 0.00 O ATOM 35850 H1 WAT 6543 17.755 54.890 3.883 1.00 0.00 H ATOM 35851 H2 WAT 6543 19.168 55.416 4.019 1.00 0.00 H TER 35853 WAT 6543 ATOM 35853 O WAT 6544 0.930 22.134 18.636 1.00 0.00 O ATOM 35854 H1 WAT 6544 1.445 21.995 19.431 1.00 0.00 H ATOM 35855 H2 WAT 6544 1.557 22.019 17.921 1.00 0.00 H TER 35857 WAT 6544 ATOM 35857 O WAT 6545 68.047 118.960 119.709 1.00 0.00 O ATOM 35858 H1 WAT 6545 68.683 119.556 119.313 1.00 0.00 H ATOM 35859 H2 WAT 6545 68.513 118.127 119.782 1.00 0.00 H TER 35861 WAT 6545 ATOM 35861 O WAT 6546 73.243 74.999 78.288 1.00 0.00 O ATOM 35862 H1 WAT 6546 74.064 74.515 78.198 1.00 0.00 H ATOM 35863 H2 WAT 6546 73.036 75.287 77.399 1.00 0.00 H TER 35865 WAT 6546 ATOM 35865 O WAT 6547 37.973 118.004 105.383 1.00 0.00 O ATOM 35866 H1 WAT 6547 37.925 117.468 106.175 1.00 0.00 H ATOM 35867 H2 WAT 6547 37.084 117.987 105.028 1.00 0.00 H TER 35869 WAT 6547 ATOM 35869 O WAT 6548 92.610 102.044 154.172 1.00 0.00 O ATOM 35870 H1 WAT 6548 92.776 101.946 155.110 1.00 0.00 H ATOM 35871 H2 WAT 6548 91.721 101.712 154.050 1.00 0.00 H TER 35873 WAT 6548 ATOM 35873 O WAT 6549 55.018 57.507 115.085 1.00 0.00 O ATOM 35874 H1 WAT 6549 55.641 56.899 114.687 1.00 0.00 H ATOM 35875 H2 WAT 6549 54.837 57.135 115.948 1.00 0.00 H TER 35877 WAT 6549 ATOM 35877 O WAT 6550 144.077 120.242 72.445 1.00 0.00 O ATOM 35878 H1 WAT 6550 144.678 120.437 73.164 1.00 0.00 H ATOM 35879 H2 WAT 6550 144.430 119.446 72.047 1.00 0.00 H TER 35881 WAT 6550 ATOM 35881 O WAT 6551 141.571 133.010 103.501 1.00 0.00 O ATOM 35882 H1 WAT 6551 141.495 132.098 103.782 1.00 0.00 H ATOM 35883 H2 WAT 6551 142.512 133.153 103.403 1.00 0.00 H TER 35885 WAT 6551 ATOM 35885 O WAT 6552 0.537 101.099 1.373 1.00 0.00 O ATOM 35886 H1 WAT 6552 1.135 100.589 1.920 1.00 0.00 H ATOM 35887 H2 WAT 6552 0.542 100.649 0.528 1.00 0.00 H TER 35889 WAT 6552 ATOM 35889 O WAT 6553 62.363 143.732 73.205 1.00 0.00 O ATOM 35890 H1 WAT 6553 61.871 144.321 73.777 1.00 0.00 H ATOM 35891 H2 WAT 6553 62.329 144.151 72.344 1.00 0.00 H TER 35893 WAT 6553 ATOM 35893 O WAT 6554 39.513 59.407 11.928 1.00 0.00 O ATOM 35894 H1 WAT 6554 40.282 58.837 11.949 1.00 0.00 H ATOM 35895 H2 WAT 6554 38.916 59.028 12.572 1.00 0.00 H TER 35897 WAT 6554 ATOM 35897 O WAT 6555 49.571 121.843 64.990 1.00 0.00 O ATOM 35898 H1 WAT 6555 49.475 122.329 64.172 1.00 0.00 H ATOM 35899 H2 WAT 6555 50.435 122.091 65.317 1.00 0.00 H TER 35901 WAT 6555 ATOM 35901 O WAT 6556 145.581 27.123 154.808 1.00 0.00 O ATOM 35902 H1 WAT 6556 145.322 26.237 154.558 1.00 0.00 H ATOM 35903 H2 WAT 6556 146.493 27.195 154.527 1.00 0.00 H TER 35905 WAT 6556 ATOM 35905 O WAT 6557 127.790 63.345 75.740 1.00 0.00 O ATOM 35906 H1 WAT 6557 127.645 64.280 75.598 1.00 0.00 H ATOM 35907 H2 WAT 6557 127.780 62.964 74.862 1.00 0.00 H TER 35909 WAT 6557 ATOM 35909 O WAT 6558 2.587 19.403 158.198 1.00 0.00 O ATOM 35910 H1 WAT 6558 3.058 19.035 157.451 1.00 0.00 H ATOM 35911 H2 WAT 6558 1.673 19.432 157.914 1.00 0.00 H TER 35913 WAT 6558 ATOM 35913 O WAT 6559 117.717 53.967 130.127 1.00 0.00 O ATOM 35914 H1 WAT 6559 118.454 54.553 129.953 1.00 0.00 H ATOM 35915 H2 WAT 6559 117.382 54.249 130.978 1.00 0.00 H TER 35917 WAT 6559 ATOM 35917 O WAT 6560 32.947 122.201 107.631 1.00 0.00 O ATOM 35918 H1 WAT 6560 32.281 122.315 106.952 1.00 0.00 H ATOM 35919 H2 WAT 6560 33.459 121.446 107.340 1.00 0.00 H TER 35921 WAT 6560 ATOM 35921 O WAT 6561 120.892 134.141 95.672 1.00 0.00 O ATOM 35922 H1 WAT 6561 120.028 134.099 96.082 1.00 0.00 H ATOM 35923 H2 WAT 6561 120.859 133.485 94.976 1.00 0.00 H TER 35925 WAT 6561 ATOM 35925 O WAT 6562 108.582 6.282 136.311 1.00 0.00 O ATOM 35926 H1 WAT 6562 108.974 7.147 136.428 1.00 0.00 H ATOM 35927 H2 WAT 6562 109.141 5.851 135.665 1.00 0.00 H TER 35929 WAT 6562 ATOM 35929 O WAT 6563 142.994 3.352 66.585 1.00 0.00 O ATOM 35930 H1 WAT 6563 142.814 3.305 67.524 1.00 0.00 H ATOM 35931 H2 WAT 6563 142.945 4.285 66.378 1.00 0.00 H TER 35933 WAT 6563 ATOM 35933 O WAT 6564 96.767 4.096 11.803 1.00 0.00 O ATOM 35934 H1 WAT 6564 96.649 4.589 10.991 1.00 0.00 H ATOM 35935 H2 WAT 6564 95.999 3.527 11.852 1.00 0.00 H TER 35937 WAT 6564 ATOM 35937 O WAT 6565 94.386 143.154 108.284 1.00 0.00 O ATOM 35938 H1 WAT 6565 94.335 143.117 109.240 1.00 0.00 H ATOM 35939 H2 WAT 6565 94.227 142.254 108.001 1.00 0.00 H TER 35941 WAT 6565 ATOM 35941 O WAT 6566 30.980 95.825 94.019 1.00 0.00 O ATOM 35942 H1 WAT 6566 30.528 95.577 93.213 1.00 0.00 H ATOM 35943 H2 WAT 6566 30.372 96.416 94.462 1.00 0.00 H TER 35945 WAT 6566 ATOM 35945 O WAT 6567 78.150 61.255 68.802 1.00 0.00 O ATOM 35946 H1 WAT 6567 78.429 60.662 69.500 1.00 0.00 H ATOM 35947 H2 WAT 6567 78.286 62.131 69.163 1.00 0.00 H TER 35949 WAT 6567 ATOM 35949 O WAT 6568 83.293 79.498 134.859 1.00 0.00 O ATOM 35950 H1 WAT 6568 83.283 79.898 135.729 1.00 0.00 H ATOM 35951 H2 WAT 6568 83.956 78.810 134.919 1.00 0.00 H TER 35953 WAT 6568 ATOM 35953 O WAT 6569 86.552 75.353 132.488 1.00 0.00 O ATOM 35954 H1 WAT 6569 85.743 75.632 132.059 1.00 0.00 H ATOM 35955 H2 WAT 6569 86.339 75.346 133.421 1.00 0.00 H TER 35957 WAT 6569 ATOM 35957 O WAT 6570 90.314 24.947 113.334 1.00 0.00 O ATOM 35958 H1 WAT 6570 90.146 25.166 112.417 1.00 0.00 H ATOM 35959 H2 WAT 6570 90.726 24.084 113.303 1.00 0.00 H TER 35961 WAT 6570 ATOM 35961 O WAT 6571 63.970 32.608 8.647 1.00 0.00 O ATOM 35962 H1 WAT 6571 63.349 33.267 8.337 1.00 0.00 H ATOM 35963 H2 WAT 6571 64.140 32.849 9.558 1.00 0.00 H TER 35965 WAT 6571 ATOM 35965 O WAT 6572 17.647 13.125 88.723 1.00 0.00 O ATOM 35966 H1 WAT 6572 18.117 12.407 89.147 1.00 0.00 H ATOM 35967 H2 WAT 6572 17.509 12.823 87.824 1.00 0.00 H TER 35969 WAT 6572 ATOM 35969 O WAT 6573 81.656 32.718 134.682 1.00 0.00 O ATOM 35970 H1 WAT 6573 82.221 32.674 133.911 1.00 0.00 H ATOM 35971 H2 WAT 6573 82.068 32.129 135.315 1.00 0.00 H TER 35973 WAT 6573 ATOM 35973 O WAT 6574 121.130 106.440 86.874 1.00 0.00 O ATOM 35974 H1 WAT 6574 120.629 106.117 87.623 1.00 0.00 H ATOM 35975 H2 WAT 6574 120.600 106.204 86.112 1.00 0.00 H TER 35977 WAT 6574 ATOM 35977 O WAT 6575 79.886 24.081 79.773 1.00 0.00 O ATOM 35978 H1 WAT 6575 79.854 23.782 80.682 1.00 0.00 H ATOM 35979 H2 WAT 6575 79.728 23.292 79.256 1.00 0.00 H TER 35981 WAT 6575 ATOM 35981 O WAT 6576 3.578 30.957 25.654 1.00 0.00 O ATOM 35982 H1 WAT 6576 3.549 31.912 25.590 1.00 0.00 H ATOM 35983 H2 WAT 6576 2.883 30.737 26.274 1.00 0.00 H TER 35985 WAT 6576 ATOM 35985 O WAT 6577 51.345 39.321 77.442 1.00 0.00 O ATOM 35986 H1 WAT 6577 50.930 40.052 76.984 1.00 0.00 H ATOM 35987 H2 WAT 6577 52.123 39.123 76.920 1.00 0.00 H TER 35989 WAT 6577 ATOM 35989 O WAT 6578 113.992 65.939 91.847 1.00 0.00 O ATOM 35990 H1 WAT 6578 113.068 66.184 91.804 1.00 0.00 H ATOM 35991 H2 WAT 6578 113.996 64.992 91.707 1.00 0.00 H TER 35993 WAT 6578 ATOM 35993 O WAT 6579 8.405 144.332 93.528 1.00 0.00 O ATOM 35994 H1 WAT 6579 7.559 144.386 93.973 1.00 0.00 H ATOM 35995 H2 WAT 6579 8.330 143.564 92.962 1.00 0.00 H TER 35997 WAT 6579 ATOM 35997 O WAT 6580 99.294 92.065 141.081 1.00 0.00 O ATOM 35998 H1 WAT 6580 98.544 92.277 140.525 1.00 0.00 H ATOM 35999 H2 WAT 6580 99.214 91.125 141.242 1.00 0.00 H TER 36001 WAT 6580 ATOM 36001 O WAT 6581 114.211 81.367 60.853 1.00 0.00 O ATOM 36002 H1 WAT 6581 114.109 80.822 60.073 1.00 0.00 H ATOM 36003 H2 WAT 6581 113.338 81.730 61.007 1.00 0.00 H TER 36005 WAT 6581 ATOM 36005 O WAT 6582 127.562 95.318 98.278 1.00 0.00 O ATOM 36006 H1 WAT 6582 126.655 95.489 98.529 1.00 0.00 H ATOM 36007 H2 WAT 6582 128.022 95.195 99.108 1.00 0.00 H TER 36009 WAT 6582 ATOM 36009 O WAT 6583 131.705 118.976 73.130 1.00 0.00 O ATOM 36010 H1 WAT 6583 132.276 118.410 72.611 1.00 0.00 H ATOM 36011 H2 WAT 6583 130.929 118.441 73.300 1.00 0.00 H TER 36013 WAT 6583 ATOM 36013 O WAT 6584 0.581 36.624 143.439 1.00 0.00 O ATOM 36014 H1 WAT 6584 1.367 37.122 143.664 1.00 0.00 H ATOM 36015 H2 WAT 6584 0.150 37.150 142.765 1.00 0.00 H TER 36017 WAT 6584 ATOM 36017 O WAT 6585 89.911 134.941 119.662 1.00 0.00 O ATOM 36018 H1 WAT 6585 90.225 134.289 120.287 1.00 0.00 H ATOM 36019 H2 WAT 6585 89.654 134.432 118.893 1.00 0.00 H TER 36021 WAT 6585 ATOM 36021 O WAT 6586 102.596 30.017 14.115 1.00 0.00 O ATOM 36022 H1 WAT 6586 102.409 29.408 14.830 1.00 0.00 H ATOM 36023 H2 WAT 6586 102.876 30.821 14.552 1.00 0.00 H TER 36025 WAT 6586 ATOM 36025 O WAT 6587 5.059 16.358 106.770 1.00 0.00 O ATOM 36026 H1 WAT 6587 5.905 16.728 106.518 1.00 0.00 H ATOM 36027 H2 WAT 6587 5.043 16.426 107.725 1.00 0.00 H TER 36029 WAT 6587 ATOM 36029 O WAT 6588 49.682 56.584 25.446 1.00 0.00 O ATOM 36030 H1 WAT 6588 49.325 56.787 26.311 1.00 0.00 H ATOM 36031 H2 WAT 6588 49.727 55.628 25.425 1.00 0.00 H TER 36033 WAT 6588 ATOM 36033 O WAT 6589 13.807 111.943 65.685 1.00 0.00 O ATOM 36034 H1 WAT 6589 12.902 111.696 65.497 1.00 0.00 H ATOM 36035 H2 WAT 6589 14.263 111.110 65.806 1.00 0.00 H TER 36037 WAT 6589 ATOM 36037 O WAT 6590 128.025 27.368 107.845 1.00 0.00 O ATOM 36038 H1 WAT 6590 128.840 27.868 107.798 1.00 0.00 H ATOM 36039 H2 WAT 6590 128.046 26.957 108.709 1.00 0.00 H TER 36041 WAT 6590 ATOM 36041 O WAT 6591 37.410 82.490 137.971 1.00 0.00 O ATOM 36042 H1 WAT 6591 37.892 83.260 138.272 1.00 0.00 H ATOM 36043 H2 WAT 6591 38.016 82.044 137.380 1.00 0.00 H TER 36045 WAT 6591 ATOM 36045 O WAT 6592 98.516 141.812 144.909 1.00 0.00 O ATOM 36046 H1 WAT 6592 98.627 140.930 144.553 1.00 0.00 H ATOM 36047 H2 WAT 6592 98.695 141.716 145.844 1.00 0.00 H TER 36049 WAT 6592 ATOM 36049 O WAT 6593 31.049 114.503 15.175 1.00 0.00 O ATOM 36050 H1 WAT 6593 30.783 115.416 15.276 1.00 0.00 H ATOM 36051 H2 WAT 6593 30.330 114.095 14.692 1.00 0.00 H TER 36053 WAT 6593 ATOM 36053 O WAT 6594 124.720 7.115 134.002 1.00 0.00 O ATOM 36054 H1 WAT 6594 124.655 6.329 134.545 1.00 0.00 H ATOM 36055 H2 WAT 6594 124.498 6.816 133.121 1.00 0.00 H TER 36057 WAT 6594 ATOM 36057 O WAT 6595 141.027 142.577 7.211 1.00 0.00 O ATOM 36058 H1 WAT 6595 140.898 143.421 7.644 1.00 0.00 H ATOM 36059 H2 WAT 6595 141.521 142.787 6.419 1.00 0.00 H TER 36061 WAT 6595 ATOM 36061 O WAT 6596 65.149 112.179 115.097 1.00 0.00 O ATOM 36062 H1 WAT 6596 65.744 111.677 114.540 1.00 0.00 H ATOM 36063 H2 WAT 6596 65.425 113.088 114.985 1.00 0.00 H TER 36065 WAT 6596 ATOM 36065 O WAT 6597 46.671 141.180 109.511 1.00 0.00 O ATOM 36066 H1 WAT 6597 47.039 140.335 109.768 1.00 0.00 H ATOM 36067 H2 WAT 6597 45.954 140.959 108.916 1.00 0.00 H TER 36069 WAT 6597 ATOM 36069 O WAT 6598 68.794 85.736 15.530 1.00 0.00 O ATOM 36070 H1 WAT 6598 67.899 85.975 15.288 1.00 0.00 H ATOM 36071 H2 WAT 6598 68.918 84.863 15.159 1.00 0.00 H TER 36073 WAT 6598 ATOM 36073 O WAT 6599 32.270 133.863 112.135 1.00 0.00 O ATOM 36074 H1 WAT 6599 32.591 133.938 113.034 1.00 0.00 H ATOM 36075 H2 WAT 6599 31.964 134.743 111.916 1.00 0.00 H TER 36077 WAT 6599 ATOM 36077 O WAT 6600 93.128 142.133 88.815 1.00 0.00 O ATOM 36078 H1 WAT 6600 92.325 142.575 89.091 1.00 0.00 H ATOM 36079 H2 WAT 6600 93.733 142.844 88.607 1.00 0.00 H TER 36081 WAT 6600 ATOM 36081 O WAT 6601 113.269 85.333 62.144 1.00 0.00 O ATOM 36082 H1 WAT 6601 114.012 84.805 62.436 1.00 0.00 H ATOM 36083 H2 WAT 6601 112.824 85.588 62.953 1.00 0.00 H TER 36085 WAT 6601 ATOM 36085 O WAT 6602 37.681 119.397 67.216 1.00 0.00 O ATOM 36086 H1 WAT 6602 37.778 120.147 67.803 1.00 0.00 H ATOM 36087 H2 WAT 6602 36.773 119.442 66.917 1.00 0.00 H TER 36089 WAT 6602 ATOM 36089 O WAT 6603 73.854 97.619 57.391 1.00 0.00 O ATOM 36090 H1 WAT 6603 73.231 97.258 58.020 1.00 0.00 H ATOM 36091 H2 WAT 6603 73.436 98.418 57.069 1.00 0.00 H TER 36093 WAT 6603 ATOM 36093 O WAT 6604 91.789 56.193 132.933 1.00 0.00 O ATOM 36094 H1 WAT 6604 92.384 56.912 133.147 1.00 0.00 H ATOM 36095 H2 WAT 6604 92.347 55.538 132.514 1.00 0.00 H TER 36097 WAT 6604 ATOM 36097 O WAT 6605 105.910 7.816 84.664 1.00 0.00 O ATOM 36098 H1 WAT 6605 105.902 8.046 83.735 1.00 0.00 H ATOM 36099 H2 WAT 6605 105.100 8.191 85.010 1.00 0.00 H TER 36101 WAT 6605 ATOM 36101 O WAT 6606 138.613 88.842 8.882 1.00 0.00 O ATOM 36102 H1 WAT 6606 138.880 87.978 9.196 1.00 0.00 H ATOM 36103 H2 WAT 6606 139.436 89.304 8.721 1.00 0.00 H TER 36105 WAT 6606 ATOM 36105 O WAT 6607 54.330 59.139 80.608 1.00 0.00 O ATOM 36106 H1 WAT 6607 54.389 58.530 81.344 1.00 0.00 H ATOM 36107 H2 WAT 6607 53.830 58.664 79.943 1.00 0.00 H TER 36109 WAT 6607 ATOM 36109 O WAT 6608 27.641 46.103 155.368 1.00 0.00 O ATOM 36110 H1 WAT 6608 26.883 45.968 155.937 1.00 0.00 H ATOM 36111 H2 WAT 6608 28.121 46.824 155.775 1.00 0.00 H TER 36113 WAT 6608 ATOM 36113 O WAT 6609 61.806 131.109 56.897 1.00 0.00 O ATOM 36114 H1 WAT 6609 61.505 130.314 56.455 1.00 0.00 H ATOM 36115 H2 WAT 6609 61.129 131.291 57.549 1.00 0.00 H TER 36117 WAT 6609 ATOM 36117 O WAT 6610 105.635 111.376 151.937 1.00 0.00 O ATOM 36118 H1 WAT 6610 105.668 111.663 151.024 1.00 0.00 H ATOM 36119 H2 WAT 6610 106.081 112.069 152.423 1.00 0.00 H TER 36121 WAT 6610 ATOM 36121 O WAT 6611 75.724 89.952 16.508 1.00 0.00 O ATOM 36122 H1 WAT 6611 74.818 90.130 16.758 1.00 0.00 H ATOM 36123 H2 WAT 6611 76.237 90.601 16.990 1.00 0.00 H TER 36125 WAT 6611 ATOM 36125 O WAT 6612 79.093 37.911 15.895 1.00 0.00 O ATOM 36126 H1 WAT 6612 79.108 37.226 16.563 1.00 0.00 H ATOM 36127 H2 WAT 6612 79.387 37.473 15.096 1.00 0.00 H TER 36129 WAT 6612 ATOM 36129 O WAT 6613 13.676 48.217 8.306 1.00 0.00 O ATOM 36130 H1 WAT 6613 13.966 49.109 8.115 1.00 0.00 H ATOM 36131 H2 WAT 6613 14.451 47.785 8.665 1.00 0.00 H TER 36133 WAT 6613 ATOM 36133 O WAT 6614 39.237 76.375 128.955 1.00 0.00 O ATOM 36134 H1 WAT 6614 39.410 75.500 129.301 1.00 0.00 H ATOM 36135 H2 WAT 6614 40.086 76.679 128.634 1.00 0.00 H TER 36137 WAT 6614 ATOM 36137 O WAT 6615 55.506 27.097 121.591 1.00 0.00 O ATOM 36138 H1 WAT 6615 55.806 26.194 121.697 1.00 0.00 H ATOM 36139 H2 WAT 6615 55.873 27.560 122.344 1.00 0.00 H TER 36141 WAT 6615 ATOM 36141 O WAT 6616 138.231 104.342 65.462 1.00 0.00 O ATOM 36142 H1 WAT 6616 137.439 104.816 65.209 1.00 0.00 H ATOM 36143 H2 WAT 6616 138.926 104.738 64.936 1.00 0.00 H TER 36145 WAT 6616 ATOM 36145 O WAT 6617 103.846 57.143 148.617 1.00 0.00 O ATOM 36146 H1 WAT 6617 104.692 57.180 148.169 1.00 0.00 H ATOM 36147 H2 WAT 6617 103.500 56.276 148.403 1.00 0.00 H TER 36149 WAT 6617 ATOM 36149 O WAT 6618 83.736 134.957 109.251 1.00 0.00 O ATOM 36150 H1 WAT 6618 84.124 134.177 109.647 1.00 0.00 H ATOM 36151 H2 WAT 6618 82.814 134.730 109.129 1.00 0.00 H TER 36153 WAT 6618 ATOM 36153 O WAT 6619 102.380 137.725 22.918 1.00 0.00 O ATOM 36154 H1 WAT 6619 102.455 136.788 23.103 1.00 0.00 H ATOM 36155 H2 WAT 6619 102.659 138.152 23.728 1.00 0.00 H TER 36157 WAT 6619 ATOM 36157 O WAT 6620 115.834 134.483 74.399 1.00 0.00 O ATOM 36158 H1 WAT 6620 116.375 133.697 74.325 1.00 0.00 H ATOM 36159 H2 WAT 6620 115.266 134.456 73.629 1.00 0.00 H TER 36161 WAT 6620 ATOM 36161 O WAT 6621 87.301 38.560 63.902 1.00 0.00 O ATOM 36162 H1 WAT 6621 87.317 39.148 64.657 1.00 0.00 H ATOM 36163 H2 WAT 6621 86.619 38.918 63.334 1.00 0.00 H TER 36165 WAT 6621 ATOM 36165 O WAT 6622 84.022 143.331 115.304 1.00 0.00 O ATOM 36166 H1 WAT 6622 84.501 142.513 115.433 1.00 0.00 H ATOM 36167 H2 WAT 6622 83.109 143.060 115.200 1.00 0.00 H TER 36169 WAT 6622 ATOM 36169 O WAT 6623 7.829 118.247 14.577 1.00 0.00 O ATOM 36170 H1 WAT 6623 8.536 117.633 14.771 1.00 0.00 H ATOM 36171 H2 WAT 6623 7.028 117.760 14.771 1.00 0.00 H TER 36173 WAT 6623 ATOM 36173 O WAT 6624 50.053 33.033 121.010 1.00 0.00 O ATOM 36174 H1 WAT 6624 50.795 32.894 121.599 1.00 0.00 H ATOM 36175 H2 WAT 6624 50.394 32.823 120.141 1.00 0.00 H TER 36177 WAT 6624 ATOM 36177 O WAT 6625 121.749 52.034 86.180 1.00 0.00 O ATOM 36178 H1 WAT 6625 121.849 52.171 85.238 1.00 0.00 H ATOM 36179 H2 WAT 6625 121.277 51.205 86.252 1.00 0.00 H TER 36181 WAT 6625 ATOM 36181 O WAT 6626 28.163 97.949 153.065 1.00 0.00 O ATOM 36182 H1 WAT 6626 28.396 97.765 152.155 1.00 0.00 H ATOM 36183 H2 WAT 6626 27.621 97.205 153.329 1.00 0.00 H TER 36185 WAT 6626 ATOM 36185 O WAT 6627 133.656 33.529 83.306 1.00 0.00 O ATOM 36186 H1 WAT 6627 133.691 33.948 82.446 1.00 0.00 H ATOM 36187 H2 WAT 6627 132.805 33.785 83.663 1.00 0.00 H TER 36189 WAT 6627 ATOM 36189 O WAT 6628 55.637 67.413 141.199 1.00 0.00 O ATOM 36190 H1 WAT 6628 56.403 67.852 140.830 1.00 0.00 H ATOM 36191 H2 WAT 6628 55.015 68.120 141.371 1.00 0.00 H TER 36193 WAT 6628 ATOM 36193 O WAT 6629 60.163 129.160 6.147 1.00 0.00 O ATOM 36194 H1 WAT 6629 60.475 128.303 6.439 1.00 0.00 H ATOM 36195 H2 WAT 6629 60.216 129.122 5.192 1.00 0.00 H TER 36197 WAT 6629 ATOM 36197 O WAT 6630 40.263 104.460 18.021 1.00 0.00 O ATOM 36198 H1 WAT 6630 39.595 104.087 17.445 1.00 0.00 H ATOM 36199 H2 WAT 6630 40.159 103.986 18.846 1.00 0.00 H TER 36201 WAT 6630 ATOM 36201 O WAT 6631 29.761 89.960 28.055 1.00 0.00 O ATOM 36202 H1 WAT 6631 29.857 89.796 27.117 1.00 0.00 H ATOM 36203 H2 WAT 6631 30.442 90.601 28.258 1.00 0.00 H TER 36205 WAT 6631 ATOM 36205 O WAT 6632 8.131 114.331 90.095 1.00 0.00 O ATOM 36206 H1 WAT 6632 9.039 114.493 90.348 1.00 0.00 H ATOM 36207 H2 WAT 6632 8.194 113.839 89.277 1.00 0.00 H TER 36209 WAT 6632 ATOM 36209 O WAT 6633 80.041 34.880 127.609 1.00 0.00 O ATOM 36210 H1 WAT 6633 79.721 35.637 128.098 1.00 0.00 H ATOM 36211 H2 WAT 6633 79.321 34.251 127.642 1.00 0.00 H TER 36213 WAT 6633 ATOM 36213 O WAT 6634 108.336 26.865 84.761 1.00 0.00 O ATOM 36214 H1 WAT 6634 107.835 26.784 83.949 1.00 0.00 H ATOM 36215 H2 WAT 6634 108.372 27.807 84.927 1.00 0.00 H TER 36217 WAT 6634 ATOM 36217 O WAT 6635 10.140 113.396 78.166 1.00 0.00 O ATOM 36218 H1 WAT 6635 10.976 113.853 78.076 1.00 0.00 H ATOM 36219 H2 WAT 6635 10.229 112.891 78.974 1.00 0.00 H TER 36221 WAT 6635 ATOM 36221 O WAT 6636 55.841 135.142 53.269 1.00 0.00 O ATOM 36222 H1 WAT 6636 55.196 135.629 53.782 1.00 0.00 H ATOM 36223 H2 WAT 6636 55.382 134.918 52.459 1.00 0.00 H TER 36225 WAT 6636 ATOM 36225 O WAT 6637 47.323 123.871 16.599 1.00 0.00 O ATOM 36226 H1 WAT 6637 46.658 123.325 16.180 1.00 0.00 H ATOM 36227 H2 WAT 6637 48.141 123.390 16.473 1.00 0.00 H TER 36229 WAT 6637 ATOM 36229 O WAT 6638 84.215 67.321 116.414 1.00 0.00 O ATOM 36230 H1 WAT 6638 85.158 67.468 116.343 1.00 0.00 H ATOM 36231 H2 WAT 6638 84.001 66.770 115.662 1.00 0.00 H TER 36233 WAT 6638 ATOM 36233 O WAT 6639 21.648 137.128 121.019 1.00 0.00 O ATOM 36234 H1 WAT 6639 21.126 136.763 120.305 1.00 0.00 H ATOM 36235 H2 WAT 6639 22.103 136.374 121.393 1.00 0.00 H TER 36237 WAT 6639 ATOM 36237 O WAT 6640 1.328 66.396 0.300 1.00 0.00 O ATOM 36238 H1 WAT 6640 1.336 66.190 -0.635 1.00 0.00 H ATOM 36239 H2 WAT 6640 1.625 67.305 0.347 1.00 0.00 H TER 36241 WAT 6640 ATOM 36241 O WAT 6641 44.204 89.353 101.301 1.00 0.00 O ATOM 36242 H1 WAT 6641 44.310 89.777 100.449 1.00 0.00 H ATOM 36243 H2 WAT 6641 43.365 88.897 101.238 1.00 0.00 H TER 36245 WAT 6641 ATOM 36245 O WAT 6642 5.385 63.274 107.973 1.00 0.00 O ATOM 36246 H1 WAT 6642 5.769 62.488 107.585 1.00 0.00 H ATOM 36247 H2 WAT 6642 6.131 63.850 108.137 1.00 0.00 H TER 36249 WAT 6642 ATOM 36249 O WAT 6643 139.529 135.587 110.792 1.00 0.00 O ATOM 36250 H1 WAT 6643 139.930 135.351 109.956 1.00 0.00 H ATOM 36251 H2 WAT 6643 139.052 134.801 111.059 1.00 0.00 H TER 36253 WAT 6643 ATOM 36253 O WAT 6644 120.834 46.097 87.765 1.00 0.00 O ATOM 36254 H1 WAT 6644 120.348 46.284 86.962 1.00 0.00 H ATOM 36255 H2 WAT 6644 121.751 46.081 87.492 1.00 0.00 H TER 36257 WAT 6644 ATOM 36257 O WAT 6645 18.275 95.318 119.265 1.00 0.00 O ATOM 36258 H1 WAT 6645 19.012 94.711 119.190 1.00 0.00 H ATOM 36259 H2 WAT 6645 18.010 95.486 118.361 1.00 0.00 H TER 36261 WAT 6645 ATOM 36261 O WAT 6646 60.396 115.113 120.469 1.00 0.00 O ATOM 36262 H1 WAT 6646 61.346 115.107 120.353 1.00 0.00 H ATOM 36263 H2 WAT 6646 60.127 114.212 120.288 1.00 0.00 H TER 36265 WAT 6646 ATOM 36265 O WAT 6647 58.507 142.697 105.639 1.00 0.00 O ATOM 36266 H1 WAT 6647 57.978 141.906 105.537 1.00 0.00 H ATOM 36267 H2 WAT 6647 57.875 143.380 105.866 1.00 0.00 H TER 36269 WAT 6647 ATOM 36269 O WAT 6648 132.090 58.453 5.092 1.00 0.00 O ATOM 36270 H1 WAT 6648 131.904 57.896 5.848 1.00 0.00 H ATOM 36271 H2 WAT 6648 132.365 57.842 4.407 1.00 0.00 H TER 36273 WAT 6648 ATOM 36273 O WAT 6649 114.785 131.607 8.085 1.00 0.00 O ATOM 36274 H1 WAT 6649 114.990 130.673 8.124 1.00 0.00 H ATOM 36275 H2 WAT 6649 114.496 131.826 8.970 1.00 0.00 H TER 36277 WAT 6649 ATOM 36277 O WAT 6650 110.044 89.116 76.254 1.00 0.00 O ATOM 36278 H1 WAT 6650 109.409 89.435 75.613 1.00 0.00 H ATOM 36279 H2 WAT 6650 109.524 88.600 76.870 1.00 0.00 H TER 36281 WAT 6650 ATOM 36281 O WAT 6651 48.185 3.703 73.302 1.00 0.00 O ATOM 36282 H1 WAT 6651 48.544 4.120 72.519 1.00 0.00 H ATOM 36283 H2 WAT 6651 48.650 4.116 74.029 1.00 0.00 H TER 36285 WAT 6651 ATOM 36285 O WAT 6652 138.109 39.950 119.325 1.00 0.00 O ATOM 36286 H1 WAT 6652 138.406 39.084 119.604 1.00 0.00 H ATOM 36287 H2 WAT 6652 137.178 39.968 119.548 1.00 0.00 H TER 36289 WAT 6652 ATOM 36289 O WAT 6653 97.662 36.371 68.544 1.00 0.00 O ATOM 36290 H1 WAT 6653 97.428 37.025 69.203 1.00 0.00 H ATOM 36291 H2 WAT 6653 96.854 35.880 68.398 1.00 0.00 H TER 36293 WAT 6653 ATOM 36293 O WAT 6654 22.058 106.882 149.710 1.00 0.00 O ATOM 36294 H1 WAT 6654 22.499 106.218 149.181 1.00 0.00 H ATOM 36295 H2 WAT 6654 21.597 106.383 150.385 1.00 0.00 H TER 36297 WAT 6654 ATOM 36297 O WAT 6655 16.153 69.564 129.643 1.00 0.00 O ATOM 36298 H1 WAT 6655 15.892 69.627 128.724 1.00 0.00 H ATOM 36299 H2 WAT 6655 16.708 68.785 129.681 1.00 0.00 H TER 36301 WAT 6655 ATOM 36301 O WAT 6656 140.947 5.506 88.413 1.00 0.00 O ATOM 36302 H1 WAT 6656 141.532 6.101 87.943 1.00 0.00 H ATOM 36303 H2 WAT 6656 141.306 5.469 89.299 1.00 0.00 H TER 36305 WAT 6656 ATOM 36305 O WAT 6657 89.674 101.974 127.550 1.00 0.00 O ATOM 36306 H1 WAT 6657 89.512 102.789 128.025 1.00 0.00 H ATOM 36307 H2 WAT 6657 90.010 102.255 126.699 1.00 0.00 H TER 36309 WAT 6657 ATOM 36309 O WAT 6658 51.857 41.175 105.073 1.00 0.00 O ATOM 36310 H1 WAT 6658 52.104 40.795 105.916 1.00 0.00 H ATOM 36311 H2 WAT 6658 52.520 41.845 104.909 1.00 0.00 H TER 36313 WAT 6658 ATOM 36313 O WAT 6659 56.348 22.590 113.287 1.00 0.00 O ATOM 36314 H1 WAT 6659 55.841 21.779 113.334 1.00 0.00 H ATOM 36315 H2 WAT 6659 56.248 22.985 114.153 1.00 0.00 H TER 36317 WAT 6659 ATOM 36317 O WAT 6660 97.141 91.328 123.009 1.00 0.00 O ATOM 36318 H1 WAT 6660 97.292 90.460 122.637 1.00 0.00 H ATOM 36319 H2 WAT 6660 96.203 91.479 122.891 1.00 0.00 H TER 36321 WAT 6660 ATOM 36321 O WAT 6661 9.351 117.118 78.532 1.00 0.00 O ATOM 36322 H1 WAT 6661 10.126 116.880 78.023 1.00 0.00 H ATOM 36323 H2 WAT 6661 9.588 117.941 78.960 1.00 0.00 H TER 36325 WAT 6661 ATOM 36325 O WAT 6662 11.863 45.017 155.725 1.00 0.00 O ATOM 36326 H1 WAT 6662 11.911 44.177 155.268 1.00 0.00 H ATOM 36327 H2 WAT 6662 12.692 45.449 155.520 1.00 0.00 H TER 36329 WAT 6662 ATOM 36329 O WAT 6663 122.084 18.665 139.106 1.00 0.00 O ATOM 36330 H1 WAT 6663 121.242 18.222 139.210 1.00 0.00 H ATOM 36331 H2 WAT 6663 122.229 18.685 138.160 1.00 0.00 H TER 36333 WAT 6663 ATOM 36333 O WAT 6664 14.974 49.982 77.013 1.00 0.00 O ATOM 36334 H1 WAT 6664 14.123 50.257 77.354 1.00 0.00 H ATOM 36335 H2 WAT 6664 14.768 49.286 76.389 1.00 0.00 H TER 36337 WAT 6664 ATOM 36337 O WAT 6665 100.945 54.188 153.952 1.00 0.00 O ATOM 36338 H1 WAT 6665 100.072 54.537 154.129 1.00 0.00 H ATOM 36339 H2 WAT 6665 101.490 54.534 154.659 1.00 0.00 H TER 36341 WAT 6665 ATOM 36341 O WAT 6666 122.405 136.051 109.324 1.00 0.00 O ATOM 36342 H1 WAT 6666 122.952 135.431 109.808 1.00 0.00 H ATOM 36343 H2 WAT 6666 122.607 136.902 109.713 1.00 0.00 H TER 36345 WAT 6666 ATOM 36345 O WAT 6667 71.156 7.450 14.468 1.00 0.00 O ATOM 36346 H1 WAT 6667 70.499 8.125 14.298 1.00 0.00 H ATOM 36347 H2 WAT 6667 71.185 7.380 15.422 1.00 0.00 H TER 36349 WAT 6667 ATOM 36349 O WAT 6668 130.015 143.055 137.399 1.00 0.00 O ATOM 36350 H1 WAT 6668 130.790 143.611 137.319 1.00 0.00 H ATOM 36351 H2 WAT 6668 130.168 142.544 138.193 1.00 0.00 H TER 36353 WAT 6668 ATOM 36353 O WAT 6669 126.678 49.836 85.283 1.00 0.00 O ATOM 36354 H1 WAT 6669 125.828 49.574 85.637 1.00 0.00 H ATOM 36355 H2 WAT 6669 126.526 50.705 84.912 1.00 0.00 H TER 36357 WAT 6669 ATOM 36357 O WAT 6670 113.008 24.760 143.328 1.00 0.00 O ATOM 36358 H1 WAT 6670 112.413 24.142 142.903 1.00 0.00 H ATOM 36359 H2 WAT 6670 113.605 24.208 143.834 1.00 0.00 H TER 36361 WAT 6670 ATOM 36361 O WAT 6671 6.891 88.748 76.515 1.00 0.00 O ATOM 36362 H1 WAT 6671 5.940 88.716 76.614 1.00 0.00 H ATOM 36363 H2 WAT 6671 7.223 88.171 77.203 1.00 0.00 H TER 36365 WAT 6671 ATOM 36365 O WAT 6672 104.905 90.781 2.129 1.00 0.00 O ATOM 36366 H1 WAT 6672 105.653 90.341 2.535 1.00 0.00 H ATOM 36367 H2 WAT 6672 104.804 90.348 1.282 1.00 0.00 H TER 36369 WAT 6672 ATOM 36369 O WAT 6673 56.150 59.236 110.895 1.00 0.00 O ATOM 36370 H1 WAT 6673 56.524 59.796 110.215 1.00 0.00 H ATOM 36371 H2 WAT 6673 56.145 58.360 110.509 1.00 0.00 H TER 36373 WAT 6673 ATOM 36373 O WAT 6674 98.462 108.409 29.809 1.00 0.00 O ATOM 36374 H1 WAT 6674 99.277 107.909 29.776 1.00 0.00 H ATOM 36375 H2 WAT 6674 98.324 108.702 28.908 1.00 0.00 H TER 36377 WAT 6674 ATOM 36377 O WAT 6675 118.695 26.307 154.827 1.00 0.00 O ATOM 36378 H1 WAT 6675 118.983 27.209 154.970 1.00 0.00 H ATOM 36379 H2 WAT 6675 118.229 26.075 155.630 1.00 0.00 H TER 36381 WAT 6675 ATOM 36381 O WAT 6676 143.132 28.513 118.722 1.00 0.00 O ATOM 36382 H1 WAT 6676 143.230 28.021 119.537 1.00 0.00 H ATOM 36383 H2 WAT 6676 142.226 28.823 118.737 1.00 0.00 H TER 36385 WAT 6676 ATOM 36385 O WAT 6677 25.752 82.400 115.802 1.00 0.00 O ATOM 36386 H1 WAT 6677 25.817 83.300 116.120 1.00 0.00 H ATOM 36387 H2 WAT 6677 24.826 82.290 115.584 1.00 0.00 H TER 36389 WAT 6677 ATOM 36389 O WAT 6678 45.278 53.635 71.846 1.00 0.00 O ATOM 36390 H1 WAT 6678 44.629 53.117 72.323 1.00 0.00 H ATOM 36391 H2 WAT 6678 45.998 53.749 72.467 1.00 0.00 H TER 36393 WAT 6678 ATOM 36393 O WAT 6679 83.803 118.832 91.597 1.00 0.00 O ATOM 36394 H1 WAT 6679 83.859 117.922 91.305 1.00 0.00 H ATOM 36395 H2 WAT 6679 84.357 118.868 92.377 1.00 0.00 H TER 36397 WAT 6679 ATOM 36397 O WAT 6680 96.688 47.667 77.669 1.00 0.00 O ATOM 36398 H1 WAT 6680 97.106 47.334 78.463 1.00 0.00 H ATOM 36399 H2 WAT 6680 97.382 47.657 77.011 1.00 0.00 H TER 36401 WAT 6680 ATOM 36401 O WAT 6681 130.780 45.018 151.949 1.00 0.00 O ATOM 36402 H1 WAT 6681 131.137 45.803 152.364 1.00 0.00 H ATOM 36403 H2 WAT 6681 130.794 45.215 151.012 1.00 0.00 H TER 36405 WAT 6681 ATOM 36405 O WAT 6682 8.021 130.440 121.416 1.00 0.00 O ATOM 36406 H1 WAT 6682 7.675 130.357 122.305 1.00 0.00 H ATOM 36407 H2 WAT 6682 8.811 130.970 121.515 1.00 0.00 H TER 36409 WAT 6682 ATOM 36409 O WAT 6683 105.370 2.670 10.720 1.00 0.00 O ATOM 36410 H1 WAT 6683 105.357 2.868 11.656 1.00 0.00 H ATOM 36411 H2 WAT 6683 105.785 1.809 10.662 1.00 0.00 H TER 36413 WAT 6683 ATOM 36413 O WAT 6684 21.480 5.188 63.421 1.00 0.00 O ATOM 36414 H1 WAT 6684 21.292 6.096 63.183 1.00 0.00 H ATOM 36415 H2 WAT 6684 20.765 4.940 64.007 1.00 0.00 H TER 36417 WAT 6684 ATOM 36417 O WAT 6685 128.049 12.989 85.313 1.00 0.00 O ATOM 36418 H1 WAT 6685 128.084 13.918 85.086 1.00 0.00 H ATOM 36419 H2 WAT 6685 128.054 12.536 84.469 1.00 0.00 H TER 36421 WAT 6685 ATOM 36421 O WAT 6686 75.414 140.324 13.280 1.00 0.00 O ATOM 36422 H1 WAT 6686 74.812 140.907 13.743 1.00 0.00 H ATOM 36423 H2 WAT 6686 76.265 140.485 13.686 1.00 0.00 H TER 36425 WAT 6686 ATOM 36425 O WAT 6687 62.574 97.228 113.029 1.00 0.00 O ATOM 36426 H1 WAT 6687 62.668 96.375 112.604 1.00 0.00 H ATOM 36427 H2 WAT 6687 63.145 97.177 113.796 1.00 0.00 H TER 36429 WAT 6687 ATOM 36429 O WAT 6688 21.283 4.481 96.085 1.00 0.00 O ATOM 36430 H1 WAT 6688 21.815 4.178 96.821 1.00 0.00 H ATOM 36431 H2 WAT 6688 21.215 3.719 95.509 1.00 0.00 H TER 36433 WAT 6688 ATOM 36433 O WAT 6689 97.541 138.305 62.185 1.00 0.00 O ATOM 36434 H1 WAT 6689 98.277 138.062 61.622 1.00 0.00 H ATOM 36435 H2 WAT 6689 96.928 138.748 61.598 1.00 0.00 H TER 36437 WAT 6689 ATOM 36437 O WAT 6690 30.358 78.884 62.020 1.00 0.00 O ATOM 36438 H1 WAT 6690 31.012 79.572 62.139 1.00 0.00 H ATOM 36439 H2 WAT 6690 29.579 79.345 61.709 1.00 0.00 H TER 36441 WAT 6690 ATOM 36441 O WAT 6691 80.841 136.097 89.541 1.00 0.00 O ATOM 36442 H1 WAT 6691 81.363 136.345 88.777 1.00 0.00 H ATOM 36443 H2 WAT 6691 81.471 136.058 90.260 1.00 0.00 H TER 36445 WAT 6691 ATOM 36445 O WAT 6692 141.483 91.038 99.677 1.00 0.00 O ATOM 36446 H1 WAT 6692 142.019 90.584 100.327 1.00 0.00 H ATOM 36447 H2 WAT 6692 141.828 91.931 99.665 1.00 0.00 H TER 36449 WAT 6692 ATOM 36449 O WAT 6693 76.724 51.351 59.649 1.00 0.00 O ATOM 36450 H1 WAT 6693 76.898 52.012 58.979 1.00 0.00 H ATOM 36451 H2 WAT 6693 77.076 50.540 59.283 1.00 0.00 H TER 36453 WAT 6693 ATOM 36453 O WAT 6694 70.444 27.601 140.724 1.00 0.00 O ATOM 36454 H1 WAT 6694 71.010 28.369 140.651 1.00 0.00 H ATOM 36455 H2 WAT 6694 69.557 27.947 140.624 1.00 0.00 H TER 36457 WAT 6694 ATOM 36457 O WAT 6695 51.519 4.364 125.972 1.00 0.00 O ATOM 36458 H1 WAT 6695 51.048 4.500 126.795 1.00 0.00 H ATOM 36459 H2 WAT 6695 50.886 3.924 125.404 1.00 0.00 H TER 36461 WAT 6695 ATOM 36461 O WAT 6696 143.566 73.197 20.845 1.00 0.00 O ATOM 36462 H1 WAT 6696 142.779 73.383 21.358 1.00 0.00 H ATOM 36463 H2 WAT 6696 143.293 72.522 20.224 1.00 0.00 H TER 36465 WAT 6696 ATOM 36465 O WAT 6697 17.459 71.397 112.089 1.00 0.00 O ATOM 36466 H1 WAT 6697 17.494 70.612 112.635 1.00 0.00 H ATOM 36467 H2 WAT 6697 18.212 71.316 111.504 1.00 0.00 H TER 36469 WAT 6697 ATOM 36469 O WAT 6698 124.839 22.488 126.516 1.00 0.00 O ATOM 36470 H1 WAT 6698 124.146 22.698 125.889 1.00 0.00 H ATOM 36471 H2 WAT 6698 124.388 22.038 127.230 1.00 0.00 H TER 36473 WAT 6698 ATOM 36473 O WAT 6699 114.238 30.456 72.030 1.00 0.00 O ATOM 36474 H1 WAT 6699 114.951 31.039 71.769 1.00 0.00 H ATOM 36475 H2 WAT 6699 113.792 30.923 72.737 1.00 0.00 H TER 36477 WAT 6699 ATOM 36477 O WAT 6700 140.453 37.325 134.189 1.00 0.00 O ATOM 36478 H1 WAT 6700 140.870 38.096 134.575 1.00 0.00 H ATOM 36479 H2 WAT 6700 140.888 36.582 134.608 1.00 0.00 H TER 36481 WAT 6700 ATOM 36481 O WAT 6701 35.985 64.732 115.600 1.00 0.00 O ATOM 36482 H1 WAT 6701 36.615 65.398 115.875 1.00 0.00 H ATOM 36483 H2 WAT 6701 36.449 63.902 115.714 1.00 0.00 H TER 36485 WAT 6701 ATOM 36485 O WAT 6702 6.359 37.355 87.187 1.00 0.00 O ATOM 36486 H1 WAT 6702 6.913 37.279 87.963 1.00 0.00 H ATOM 36487 H2 WAT 6702 6.335 36.471 86.821 1.00 0.00 H TER 36489 WAT 6702 ATOM 36489 O WAT 6703 23.608 112.791 156.844 1.00 0.00 O ATOM 36490 H1 WAT 6703 23.650 112.665 157.792 1.00 0.00 H ATOM 36491 H2 WAT 6703 23.511 113.737 156.732 1.00 0.00 H TER 36493 WAT 6703 ATOM 36493 O WAT 6704 117.670 19.459 139.735 1.00 0.00 O ATOM 36494 H1 WAT 6704 117.106 19.867 140.392 1.00 0.00 H ATOM 36495 H2 WAT 6704 117.418 19.877 138.911 1.00 0.00 H TER 36497 WAT 6704 ATOM 36497 O WAT 6705 93.642 0.376 3.519 1.00 0.00 O ATOM 36498 H1 WAT 6705 93.993 -0.302 2.941 1.00 0.00 H ATOM 36499 H2 WAT 6705 94.061 0.211 4.363 1.00 0.00 H TER 36501 WAT 6705 ATOM 36501 O WAT 6706 27.300 39.681 101.073 1.00 0.00 O ATOM 36502 H1 WAT 6706 26.546 40.247 101.235 1.00 0.00 H ATOM 36503 H2 WAT 6706 28.049 40.179 101.402 1.00 0.00 H TER 36505 WAT 6706 ATOM 36505 O WAT 6707 58.782 27.945 61.604 1.00 0.00 O ATOM 36506 H1 WAT 6707 58.309 27.157 61.336 1.00 0.00 H ATOM 36507 H2 WAT 6707 59.701 27.747 61.421 1.00 0.00 H TER 36509 WAT 6707 ATOM 36509 O WAT 6708 15.825 116.396 151.064 1.00 0.00 O ATOM 36510 H1 WAT 6708 15.867 116.366 152.019 1.00 0.00 H ATOM 36511 H2 WAT 6708 15.547 117.291 150.864 1.00 0.00 H TER 36513 WAT 6708 ATOM 36513 O WAT 6709 77.512 125.190 75.666 1.00 0.00 O ATOM 36514 H1 WAT 6709 77.144 124.797 76.457 1.00 0.00 H ATOM 36515 H2 WAT 6709 78.455 125.043 75.742 1.00 0.00 H TER 36517 WAT 6709 ATOM 36517 O WAT 6710 44.282 54.960 4.645 1.00 0.00 O ATOM 36518 H1 WAT 6710 43.551 54.641 5.173 1.00 0.00 H ATOM 36519 H2 WAT 6710 43.931 55.725 4.188 1.00 0.00 H TER 36521 WAT 6710 ATOM 36521 O WAT 6711 121.137 119.641 77.378 1.00 0.00 O ATOM 36522 H1 WAT 6711 120.614 118.921 77.730 1.00 0.00 H ATOM 36523 H2 WAT 6711 121.239 119.432 76.450 1.00 0.00 H TER 36525 WAT 6711 ATOM 36525 O WAT 6712 111.835 56.808 92.525 1.00 0.00 O ATOM 36526 H1 WAT 6712 111.156 56.450 91.953 1.00 0.00 H ATOM 36527 H2 WAT 6712 112.622 56.311 92.302 1.00 0.00 H TER 36529 WAT 6712 ATOM 36529 O WAT 6713 23.997 45.088 2.135 1.00 0.00 O ATOM 36530 H1 WAT 6713 23.831 44.762 3.020 1.00 0.00 H ATOM 36531 H2 WAT 6713 23.728 44.371 1.561 1.00 0.00 H TER 36533 WAT 6713 ATOM 36533 O WAT 6714 128.133 30.909 87.119 1.00 0.00 O ATOM 36534 H1 WAT 6714 128.399 31.299 86.287 1.00 0.00 H ATOM 36535 H2 WAT 6714 127.339 31.384 87.364 1.00 0.00 H TER 36537 WAT 6714 ATOM 36537 O WAT 6715 129.524 56.524 117.180 1.00 0.00 O ATOM 36538 H1 WAT 6715 129.949 57.271 117.600 1.00 0.00 H ATOM 36539 H2 WAT 6715 128.868 56.234 117.814 1.00 0.00 H TER 36541 WAT 6715 ATOM 36541 O WAT 6716 105.664 92.320 108.330 1.00 0.00 O ATOM 36542 H1 WAT 6716 105.904 91.739 109.052 1.00 0.00 H ATOM 36543 H2 WAT 6716 105.792 93.201 108.679 1.00 0.00 H TER 36545 WAT 6716 ATOM 36545 O WAT 6717 16.369 93.029 90.592 1.00 0.00 O ATOM 36546 H1 WAT 6717 16.208 92.131 90.301 1.00 0.00 H ATOM 36547 H2 WAT 6717 16.086 93.574 89.858 1.00 0.00 H TER 36549 WAT 6717 ATOM 36549 O WAT 6718 97.153 54.913 73.479 1.00 0.00 O ATOM 36550 H1 WAT 6718 96.957 55.408 72.683 1.00 0.00 H ATOM 36551 H2 WAT 6718 96.389 54.349 73.604 1.00 0.00 H TER 36553 WAT 6718 ATOM 36553 O WAT 6719 51.174 141.738 155.550 1.00 0.00 O ATOM 36554 H1 WAT 6719 50.936 142.143 154.716 1.00 0.00 H ATOM 36555 H2 WAT 6719 50.718 140.896 155.546 1.00 0.00 H TER 36557 WAT 6719 ATOM 36557 O WAT 6720 143.582 137.416 114.351 1.00 0.00 O ATOM 36558 H1 WAT 6720 142.972 137.133 113.669 1.00 0.00 H ATOM 36559 H2 WAT 6720 144.122 138.083 113.927 1.00 0.00 H TER 36561 WAT 6720 ATOM 36561 O WAT 6721 63.175 2.505 66.078 1.00 0.00 O ATOM 36562 H1 WAT 6721 63.915 2.448 65.473 1.00 0.00 H ATOM 36563 H2 WAT 6721 63.000 3.443 66.153 1.00 0.00 H TER 36565 WAT 6721 ATOM 36565 O WAT 6722 119.609 97.400 95.980 1.00 0.00 O ATOM 36566 H1 WAT 6722 119.819 98.315 96.170 1.00 0.00 H ATOM 36567 H2 WAT 6722 118.911 97.445 95.327 1.00 0.00 H TER 36569 WAT 6722 ATOM 36569 O WAT 6723 3.727 98.046 116.671 1.00 0.00 O ATOM 36570 H1 WAT 6723 4.091 98.643 116.017 1.00 0.00 H ATOM 36571 H2 WAT 6723 3.679 97.201 116.223 1.00 0.00 H TER 36573 WAT 6723 ATOM 36573 O WAT 6724 128.914 105.530 151.130 1.00 0.00 O ATOM 36574 H1 WAT 6724 128.625 104.838 150.536 1.00 0.00 H ATOM 36575 H2 WAT 6724 128.107 105.974 151.392 1.00 0.00 H TER 36577 WAT 6724 ATOM 36577 O WAT 6725 105.649 47.040 145.816 1.00 0.00 O ATOM 36578 H1 WAT 6725 105.855 47.965 145.948 1.00 0.00 H ATOM 36579 H2 WAT 6725 104.838 46.903 146.305 1.00 0.00 H TER 36581 WAT 6725 ATOM 36581 O WAT 6726 120.203 15.353 63.766 1.00 0.00 O ATOM 36582 H1 WAT 6726 120.471 14.490 64.081 1.00 0.00 H ATOM 36583 H2 WAT 6726 121.018 15.770 63.486 1.00 0.00 H TER 36585 WAT 6726 ATOM 36585 O WAT 6727 56.911 77.639 79.967 1.00 0.00 O ATOM 36586 H1 WAT 6727 56.204 77.547 80.606 1.00 0.00 H ATOM 36587 H2 WAT 6727 57.618 77.094 80.312 1.00 0.00 H TER 36589 WAT 6727 ATOM 36589 O WAT 6728 63.143 48.445 89.377 1.00 0.00 O ATOM 36590 H1 WAT 6728 62.679 47.688 89.018 1.00 0.00 H ATOM 36591 H2 WAT 6728 64.060 48.296 89.145 1.00 0.00 H TER 36593 WAT 6728 ATOM 36593 O WAT 6729 55.081 53.911 136.334 1.00 0.00 O ATOM 36594 H1 WAT 6729 54.950 54.843 136.508 1.00 0.00 H ATOM 36595 H2 WAT 6729 54.334 53.661 135.790 1.00 0.00 H TER 36597 WAT 6729 ATOM 36597 O WAT 6730 31.769 64.376 71.403 1.00 0.00 O ATOM 36598 H1 WAT 6730 32.259 64.983 70.847 1.00 0.00 H ATOM 36599 H2 WAT 6730 30.870 64.704 71.381 1.00 0.00 H TER 36601 WAT 6730 ATOM 36601 O WAT 6731 10.339 137.679 144.186 1.00 0.00 O ATOM 36602 H1 WAT 6731 9.888 137.705 143.341 1.00 0.00 H ATOM 36603 H2 WAT 6731 9.873 137.008 144.685 1.00 0.00 H TER 36605 WAT 6731 ATOM 36605 O WAT 6732 63.794 75.713 111.283 1.00 0.00 O ATOM 36606 H1 WAT 6732 64.640 75.430 111.628 1.00 0.00 H ATOM 36607 H2 WAT 6732 63.351 76.113 112.031 1.00 0.00 H TER 36609 WAT 6732 ATOM 36609 O WAT 6733 39.899 95.988 97.648 1.00 0.00 O ATOM 36610 H1 WAT 6733 40.419 95.184 97.656 1.00 0.00 H ATOM 36611 H2 WAT 6733 40.347 96.568 98.264 1.00 0.00 H TER 36613 WAT 6733 ATOM 36613 O WAT 6734 68.557 125.296 139.739 1.00 0.00 O ATOM 36614 H1 WAT 6734 68.799 124.859 140.556 1.00 0.00 H ATOM 36615 H2 WAT 6734 68.956 126.163 139.804 1.00 0.00 H TER 36617 WAT 6734 ATOM 36617 O WAT 6735 16.630 145.381 98.858 1.00 0.00 O ATOM 36618 H1 WAT 6735 15.830 144.856 98.824 1.00 0.00 H ATOM 36619 H2 WAT 6735 16.507 146.048 98.183 1.00 0.00 H TER 36621 WAT 6735 ATOM 36621 O WAT 6736 49.260 141.247 86.911 1.00 0.00 O ATOM 36622 H1 WAT 6736 48.859 142.076 86.653 1.00 0.00 H ATOM 36623 H2 WAT 6736 48.775 140.978 87.691 1.00 0.00 H TER 36625 WAT 6736 ATOM 36625 O WAT 6737 104.855 105.977 24.402 1.00 0.00 O ATOM 36626 H1 WAT 6737 103.964 105.644 24.503 1.00 0.00 H ATOM 36627 H2 WAT 6737 105.406 105.323 24.832 1.00 0.00 H TER 36629 WAT 6737 ATOM 36629 O WAT 6738 130.362 7.228 128.508 1.00 0.00 O ATOM 36630 H1 WAT 6738 130.992 6.640 128.091 1.00 0.00 H ATOM 36631 H2 WAT 6738 129.626 7.261 127.898 1.00 0.00 H TER 36633 WAT 6738 ATOM 36633 O WAT 6739 123.373 23.214 90.362 1.00 0.00 O ATOM 36634 H1 WAT 6739 123.139 23.475 89.471 1.00 0.00 H ATOM 36635 H2 WAT 6739 124.094 22.594 90.248 1.00 0.00 H TER 36637 WAT 6739 ATOM 36637 O WAT 6740 38.088 57.129 149.423 1.00 0.00 O ATOM 36638 H1 WAT 6740 37.922 56.708 148.579 1.00 0.00 H ATOM 36639 H2 WAT 6740 37.238 57.125 149.863 1.00 0.00 H TER 36641 WAT 6740 ATOM 36641 O WAT 6741 21.494 5.101 102.100 1.00 0.00 O ATOM 36642 H1 WAT 6741 20.829 5.308 102.756 1.00 0.00 H ATOM 36643 H2 WAT 6741 21.096 5.351 101.267 1.00 0.00 H TER 36645 WAT 6741 ATOM 36645 O WAT 6742 102.665 8.320 117.249 1.00 0.00 O ATOM 36646 H1 WAT 6742 101.804 8.737 117.242 1.00 0.00 H ATOM 36647 H2 WAT 6742 103.207 8.898 117.786 1.00 0.00 H TER 36649 WAT 6742 ATOM 36649 O WAT 6743 106.513 96.634 103.042 1.00 0.00 O ATOM 36650 H1 WAT 6743 107.199 97.228 103.345 1.00 0.00 H ATOM 36651 H2 WAT 6743 106.434 95.983 103.739 1.00 0.00 H TER 36653 WAT 6743 ATOM 36653 O WAT 6744 37.022 27.376 106.434 1.00 0.00 O ATOM 36654 H1 WAT 6744 37.820 27.883 106.583 1.00 0.00 H ATOM 36655 H2 WAT 6744 37.015 26.727 107.137 1.00 0.00 H TER 36657 WAT 6744 ATOM 36657 O WAT 6745 31.770 109.774 93.953 1.00 0.00 O ATOM 36658 H1 WAT 6745 31.244 110.550 94.145 1.00 0.00 H ATOM 36659 H2 WAT 6745 32.671 110.045 94.132 1.00 0.00 H TER 36661 WAT 6745 ATOM 36661 O WAT 6746 82.144 47.923 85.673 1.00 0.00 O ATOM 36662 H1 WAT 6746 81.422 47.528 85.184 1.00 0.00 H ATOM 36663 H2 WAT 6746 82.933 47.567 85.263 1.00 0.00 H TER 36665 WAT 6746 ATOM 36665 O WAT 6747 96.098 110.643 133.025 1.00 0.00 O ATOM 36666 H1 WAT 6747 97.020 110.845 133.181 1.00 0.00 H ATOM 36667 H2 WAT 6747 95.778 110.320 133.867 1.00 0.00 H TER 36669 WAT 6747 ATOM 36669 O WAT 6748 45.248 25.249 74.049 1.00 0.00 O ATOM 36670 H1 WAT 6748 45.023 24.496 73.502 1.00 0.00 H ATOM 36671 H2 WAT 6748 46.098 25.025 74.427 1.00 0.00 H TER 36673 WAT 6748 ATOM 36673 O WAT 6749 106.984 86.564 134.322 1.00 0.00 O ATOM 36674 H1 WAT 6749 106.814 87.501 134.225 1.00 0.00 H ATOM 36675 H2 WAT 6749 107.916 86.468 134.126 1.00 0.00 H TER 36677 WAT 6749 ATOM 36677 O WAT 6750 130.728 73.313 22.951 1.00 0.00 O ATOM 36678 H1 WAT 6750 130.821 72.810 23.760 1.00 0.00 H ATOM 36679 H2 WAT 6750 131.396 73.996 23.016 1.00 0.00 H TER 36681 WAT 6750 ATOM 36681 O WAT 6751 122.190 32.635 158.901 1.00 0.00 O ATOM 36682 H1 WAT 6751 122.433 32.218 158.074 1.00 0.00 H ATOM 36683 H2 WAT 6751 122.955 33.159 159.139 1.00 0.00 H TER 36685 WAT 6751 ATOM 36685 O WAT 6752 114.177 53.137 139.154 1.00 0.00 O ATOM 36686 H1 WAT 6752 113.814 53.314 140.021 1.00 0.00 H ATOM 36687 H2 WAT 6752 114.502 52.238 139.209 1.00 0.00 H TER 36689 WAT 6752 ATOM 36689 O WAT 6753 109.419 81.865 122.821 1.00 0.00 O ATOM 36690 H1 WAT 6753 108.732 82.509 122.992 1.00 0.00 H ATOM 36691 H2 WAT 6753 109.213 81.519 121.953 1.00 0.00 H TER 36693 WAT 6753 ATOM 36693 O WAT 6754 113.874 84.214 109.717 1.00 0.00 O ATOM 36694 H1 WAT 6754 113.173 83.568 109.802 1.00 0.00 H ATOM 36695 H2 WAT 6754 113.769 84.783 110.479 1.00 0.00 H TER 36697 WAT 6754 ATOM 36697 O WAT 6755 78.682 26.655 158.602 1.00 0.00 O ATOM 36698 H1 WAT 6755 79.457 26.532 158.053 1.00 0.00 H ATOM 36699 H2 WAT 6755 78.469 25.776 158.916 1.00 0.00 H TER 36701 WAT 6755 ATOM 36701 O WAT 6756 17.968 30.376 16.604 1.00 0.00 O ATOM 36702 H1 WAT 6756 17.883 29.453 16.364 1.00 0.00 H ATOM 36703 H2 WAT 6756 18.901 30.564 16.506 1.00 0.00 H TER 36705 WAT 6756 ATOM 36705 O WAT 6757 40.643 61.391 154.085 1.00 0.00 O ATOM 36706 H1 WAT 6757 40.589 60.437 154.141 1.00 0.00 H ATOM 36707 H2 WAT 6757 39.982 61.630 153.435 1.00 0.00 H TER 36709 WAT 6757 ATOM 36709 O WAT 6758 67.547 10.891 133.726 1.00 0.00 O ATOM 36710 H1 WAT 6758 68.459 11.165 133.825 1.00 0.00 H ATOM 36711 H2 WAT 6758 67.172 10.985 134.601 1.00 0.00 H TER 36713 WAT 6758 ATOM 36713 O WAT 6759 98.776 136.843 75.228 1.00 0.00 O ATOM 36714 H1 WAT 6759 98.508 136.908 74.312 1.00 0.00 H ATOM 36715 H2 WAT 6759 97.962 136.932 75.723 1.00 0.00 H TER 36717 WAT 6759 ATOM 36717 O WAT 6760 104.831 26.896 65.370 1.00 0.00 O ATOM 36718 H1 WAT 6760 104.764 27.370 64.541 1.00 0.00 H ATOM 36719 H2 WAT 6760 104.865 27.583 66.036 1.00 0.00 H TER 36721 WAT 6760 ATOM 36721 O WAT 6761 29.718 119.553 69.805 1.00 0.00 O ATOM 36722 H1 WAT 6761 30.524 119.062 69.646 1.00 0.00 H ATOM 36723 H2 WAT 6761 29.485 119.914 68.950 1.00 0.00 H TER 36725 WAT 6761 ATOM 36725 O WAT 6762 122.780 19.181 122.919 1.00 0.00 O ATOM 36726 H1 WAT 6762 122.325 19.653 122.221 1.00 0.00 H ATOM 36727 H2 WAT 6762 122.659 18.257 122.700 1.00 0.00 H TER 36729 WAT 6762 ATOM 36729 O WAT 6763 84.537 62.316 67.443 1.00 0.00 O ATOM 36730 H1 WAT 6763 84.161 62.890 68.111 1.00 0.00 H ATOM 36731 H2 WAT 6763 85.475 62.311 67.631 1.00 0.00 H TER 36733 WAT 6763 ATOM 36733 O WAT 6764 83.724 49.953 108.103 1.00 0.00 O ATOM 36734 H1 WAT 6764 82.839 50.313 108.148 1.00 0.00 H ATOM 36735 H2 WAT 6764 84.274 50.615 108.522 1.00 0.00 H TER 36737 WAT 6764 ATOM 36737 O WAT 6765 85.444 91.349 106.645 1.00 0.00 O ATOM 36738 H1 WAT 6765 85.735 92.131 107.113 1.00 0.00 H ATOM 36739 H2 WAT 6765 84.701 91.027 107.155 1.00 0.00 H TER 36741 WAT 6765 ATOM 36741 O WAT 6766 34.060 5.479 5.672 1.00 0.00 O ATOM 36742 H1 WAT 6766 34.620 6.087 5.188 1.00 0.00 H ATOM 36743 H2 WAT 6766 33.426 6.040 6.117 1.00 0.00 H TER 36745 WAT 6766 ATOM 36745 O WAT 6767 49.873 95.132 130.577 1.00 0.00 O ATOM 36746 H1 WAT 6767 49.307 94.583 131.120 1.00 0.00 H ATOM 36747 H2 WAT 6767 50.679 95.222 131.087 1.00 0.00 H TER 36749 WAT 6767 ATOM 36749 O WAT 6768 66.220 94.096 99.924 1.00 0.00 O ATOM 36750 H1 WAT 6768 65.587 94.504 100.514 1.00 0.00 H ATOM 36751 H2 WAT 6768 65.934 94.358 99.048 1.00 0.00 H TER 36753 WAT 6768 ATOM 36753 O WAT 6769 70.865 122.971 110.723 1.00 0.00 O ATOM 36754 H1 WAT 6769 71.160 123.425 109.933 1.00 0.00 H ATOM 36755 H2 WAT 6769 70.117 122.449 110.433 1.00 0.00 H TER 36757 WAT 6769 ATOM 36757 O WAT 6770 74.415 125.497 3.730 1.00 0.00 O ATOM 36758 H1 WAT 6770 73.649 125.176 4.206 1.00 0.00 H ATOM 36759 H2 WAT 6770 74.315 126.448 3.728 1.00 0.00 H TER 36761 WAT 6770 ATOM 36761 O WAT 6771 134.428 132.504 128.150 1.00 0.00 O ATOM 36762 H1 WAT 6771 134.748 132.585 129.049 1.00 0.00 H ATOM 36763 H2 WAT 6771 133.874 133.274 128.023 1.00 0.00 H TER 36765 WAT 6771 ATOM 36765 O WAT 6772 1.714 44.972 75.664 1.00 0.00 O ATOM 36766 H1 WAT 6772 2.166 44.578 76.410 1.00 0.00 H ATOM 36767 H2 WAT 6772 2.280 45.695 75.395 1.00 0.00 H TER 36769 WAT 6772 ATOM 36769 O WAT 6773 34.713 7.114 13.524 1.00 0.00 O ATOM 36770 H1 WAT 6773 33.969 6.732 13.988 1.00 0.00 H ATOM 36771 H2 WAT 6773 34.520 6.968 12.598 1.00 0.00 H TER 36773 WAT 6773 ATOM 36773 O WAT 6774 98.780 27.486 5.393 1.00 0.00 O ATOM 36774 H1 WAT 6774 97.893 27.791 5.198 1.00 0.00 H ATOM 36775 H2 WAT 6774 99.267 27.633 4.583 1.00 0.00 H TER 36777 WAT 6774 ATOM 36777 O WAT 6775 73.736 119.941 22.113 1.00 0.00 O ATOM 36778 H1 WAT 6775 74.652 120.180 21.970 1.00 0.00 H ATOM 36779 H2 WAT 6775 73.237 120.666 21.737 1.00 0.00 H TER 36781 WAT 6775 ATOM 36781 O WAT 6776 116.821 122.754 86.978 1.00 0.00 O ATOM 36782 H1 WAT 6776 116.503 121.925 86.621 1.00 0.00 H ATOM 36783 H2 WAT 6776 117.235 122.514 87.807 1.00 0.00 H TER 36785 WAT 6776 ATOM 36785 O WAT 6777 68.976 85.137 115.438 1.00 0.00 O ATOM 36786 H1 WAT 6777 68.708 85.193 114.521 1.00 0.00 H ATOM 36787 H2 WAT 6777 68.155 85.148 115.929 1.00 0.00 H TER 36789 WAT 6777 ATOM 36789 O WAT 6778 75.246 96.831 5.971 1.00 0.00 O ATOM 36790 H1 WAT 6778 74.957 97.654 6.364 1.00 0.00 H ATOM 36791 H2 WAT 6778 74.786 96.791 5.132 1.00 0.00 H TER 36793 WAT 6778 ATOM 36793 O WAT 6779 54.015 64.690 20.948 1.00 0.00 O ATOM 36794 H1 WAT 6779 54.925 64.545 21.205 1.00 0.00 H ATOM 36795 H2 WAT 6779 53.602 63.831 21.036 1.00 0.00 H TER 36797 WAT 6779 ATOM 36797 O WAT 6780 9.340 103.399 109.825 1.00 0.00 O ATOM 36798 H1 WAT 6780 8.440 103.701 109.704 1.00 0.00 H ATOM 36799 H2 WAT 6780 9.504 103.502 110.762 1.00 0.00 H TER 36801 WAT 6780 ATOM 36801 O WAT 6781 22.593 123.873 65.380 1.00 0.00 O ATOM 36802 H1 WAT 6781 21.675 124.018 65.608 1.00 0.00 H ATOM 36803 H2 WAT 6781 22.661 122.927 65.249 1.00 0.00 H TER 36805 WAT 6781 ATOM 36805 O WAT 6782 46.407 68.982 1.156 1.00 0.00 O ATOM 36806 H1 WAT 6782 46.755 69.339 0.339 1.00 0.00 H ATOM 36807 H2 WAT 6782 46.382 68.036 1.013 1.00 0.00 H TER 36809 WAT 6782 ATOM 36809 O WAT 6783 107.957 65.991 134.946 1.00 0.00 O ATOM 36810 H1 WAT 6783 107.416 65.213 135.083 1.00 0.00 H ATOM 36811 H2 WAT 6783 108.616 65.950 135.639 1.00 0.00 H TER 36813 WAT 6783 ATOM 36813 O WAT 6784 121.834 45.358 7.659 1.00 0.00 O ATOM 36814 H1 WAT 6784 121.799 44.589 7.090 1.00 0.00 H ATOM 36815 H2 WAT 6784 121.004 45.809 7.504 1.00 0.00 H TER 36817 WAT 6784 ATOM 36817 O WAT 6785 9.054 112.095 84.484 1.00 0.00 O ATOM 36818 H1 WAT 6785 9.357 111.271 84.103 1.00 0.00 H ATOM 36819 H2 WAT 6785 9.827 112.660 84.480 1.00 0.00 H TER 36821 WAT 6785 ATOM 36821 O WAT 6786 83.438 127.051 147.162 1.00 0.00 O ATOM 36822 H1 WAT 6786 82.611 127.084 146.681 1.00 0.00 H ATOM 36823 H2 WAT 6786 83.328 127.684 147.871 1.00 0.00 H TER 36825 WAT 6786 ATOM 36825 O WAT 6787 111.143 29.494 13.855 1.00 0.00 O ATOM 36826 H1 WAT 6787 111.885 29.741 14.407 1.00 0.00 H ATOM 36827 H2 WAT 6787 111.185 28.538 13.811 1.00 0.00 H TER 36829 WAT 6787 ATOM 36829 O WAT 6788 116.879 143.600 89.179 1.00 0.00 O ATOM 36830 H1 WAT 6788 116.658 142.679 89.035 1.00 0.00 H ATOM 36831 H2 WAT 6788 117.665 143.575 89.725 1.00 0.00 H TER 36833 WAT 6788 ATOM 36833 O WAT 6789 35.771 144.525 0.004 1.00 0.00 O ATOM 36834 H1 WAT 6789 36.153 144.964 0.764 1.00 0.00 H ATOM 36835 H2 WAT 6789 35.897 145.142 -0.717 1.00 0.00 H TER 36837 WAT 6789 ATOM 36837 O WAT 6790 79.387 0.871 63.417 1.00 0.00 O ATOM 36838 H1 WAT 6790 78.942 0.203 62.896 1.00 0.00 H ATOM 36839 H2 WAT 6790 80.319 0.712 63.266 1.00 0.00 H TER 36841 WAT 6790 ATOM 36841 O WAT 6791 15.172 127.402 102.058 1.00 0.00 O ATOM 36842 H1 WAT 6791 14.654 127.647 102.824 1.00 0.00 H ATOM 36843 H2 WAT 6791 15.362 126.472 102.183 1.00 0.00 H TER 36845 WAT 6791 ATOM 36845 O WAT 6792 119.581 11.089 20.507 1.00 0.00 O ATOM 36846 H1 WAT 6792 119.761 10.408 21.156 1.00 0.00 H ATOM 36847 H2 WAT 6792 119.804 11.907 20.951 1.00 0.00 H TER 36849 WAT 6792 ATOM 36849 O WAT 6793 139.904 55.877 0.379 1.00 0.00 O ATOM 36850 H1 WAT 6793 139.588 56.559 0.971 1.00 0.00 H ATOM 36851 H2 WAT 6793 139.112 55.533 -0.034 1.00 0.00 H TER 36853 WAT 6793 ATOM 36853 O WAT 6794 82.388 108.449 121.268 1.00 0.00 O ATOM 36854 H1 WAT 6794 83.077 108.076 121.818 1.00 0.00 H ATOM 36855 H2 WAT 6794 82.021 107.697 120.801 1.00 0.00 H TER 36857 WAT 6794 ATOM 36857 O WAT 6795 87.137 107.710 99.041 1.00 0.00 O ATOM 36858 H1 WAT 6795 87.717 107.643 98.283 1.00 0.00 H ATOM 36859 H2 WAT 6795 87.076 106.815 99.376 1.00 0.00 H TER 36861 WAT 6795 ATOM 36861 O WAT 6796 132.127 24.951 55.940 1.00 0.00 O ATOM 36862 H1 WAT 6796 131.469 24.308 55.674 1.00 0.00 H ATOM 36863 H2 WAT 6796 131.713 25.434 56.655 1.00 0.00 H TER 36865 WAT 6796 ATOM 36865 O WAT 6797 115.075 1.465 81.665 1.00 0.00 O ATOM 36866 H1 WAT 6797 115.406 0.738 81.138 1.00 0.00 H ATOM 36867 H2 WAT 6797 114.275 1.125 82.065 1.00 0.00 H TER 36869 WAT 6797 ATOM 36869 O WAT 6798 49.004 130.960 157.699 1.00 0.00 O ATOM 36870 H1 WAT 6798 49.710 131.606 157.657 1.00 0.00 H ATOM 36871 H2 WAT 6798 49.177 130.369 156.967 1.00 0.00 H TER 36873 WAT 6798 ATOM 36873 O WAT 6799 59.167 65.286 118.469 1.00 0.00 O ATOM 36874 H1 WAT 6799 59.210 66.242 118.444 1.00 0.00 H ATOM 36875 H2 WAT 6799 59.395 65.012 117.581 1.00 0.00 H TER 36877 WAT 6799 ATOM 36877 O WAT 6800 26.442 133.769 4.972 1.00 0.00 O ATOM 36878 H1 WAT 6800 26.269 132.955 5.446 1.00 0.00 H ATOM 36879 H2 WAT 6800 27.147 133.546 4.364 1.00 0.00 H TER 36881 WAT 6800 ATOM 36881 O WAT 6801 109.195 114.131 134.090 1.00 0.00 O ATOM 36882 H1 WAT 6801 109.249 113.514 133.361 1.00 0.00 H ATOM 36883 H2 WAT 6801 108.713 113.659 134.769 1.00 0.00 H TER 36885 WAT 6801 ATOM 36885 O WAT 6802 83.343 24.543 119.419 1.00 0.00 O ATOM 36886 H1 WAT 6802 84.080 23.938 119.334 1.00 0.00 H ATOM 36887 H2 WAT 6802 83.726 25.334 119.797 1.00 0.00 H TER 36889 WAT 6802 ATOM 36889 O WAT 6803 49.935 40.333 13.039 1.00 0.00 O ATOM 36890 H1 WAT 6803 50.823 40.580 12.781 1.00 0.00 H ATOM 36891 H2 WAT 6803 49.742 39.553 12.518 1.00 0.00 H TER 36893 WAT 6803 ATOM 36893 O WAT 6804 135.807 42.678 120.718 1.00 0.00 O ATOM 36894 H1 WAT 6804 135.780 41.727 120.609 1.00 0.00 H ATOM 36895 H2 WAT 6804 135.932 43.017 119.832 1.00 0.00 H TER 36897 WAT 6804 ATOM 36897 O WAT 6805 69.960 120.703 118.992 1.00 0.00 O ATOM 36898 H1 WAT 6805 69.724 121.383 118.360 1.00 0.00 H ATOM 36899 H2 WAT 6805 70.387 120.027 118.466 1.00 0.00 H TER 36901 WAT 6805 ATOM 36901 O WAT 6806 121.941 135.490 2.747 1.00 0.00 O ATOM 36902 H1 WAT 6806 122.814 135.366 3.121 1.00 0.00 H ATOM 36903 H2 WAT 6806 121.343 135.350 3.481 1.00 0.00 H TER 36905 WAT 6806 ATOM 36905 O WAT 6807 3.109 83.191 104.821 1.00 0.00 O ATOM 36906 H1 WAT 6807 3.229 83.128 103.873 1.00 0.00 H ATOM 36907 H2 WAT 6807 3.382 82.336 105.154 1.00 0.00 H TER 36909 WAT 6807 ATOM 36909 O WAT 6808 69.058 10.534 136.372 1.00 0.00 O ATOM 36910 H1 WAT 6808 68.760 11.423 136.563 1.00 0.00 H ATOM 36911 H2 WAT 6808 68.363 9.970 136.710 1.00 0.00 H TER 36913 WAT 6808 ATOM 36913 O WAT 6809 107.128 111.570 92.066 1.00 0.00 O ATOM 36914 H1 WAT 6809 106.505 111.758 91.364 1.00 0.00 H ATOM 36915 H2 WAT 6809 106.989 112.271 92.703 1.00 0.00 H TER 36917 WAT 6809 ATOM 36917 O WAT 6810 54.822 117.689 115.782 1.00 0.00 O ATOM 36918 H1 WAT 6810 54.933 118.598 115.505 1.00 0.00 H ATOM 36919 H2 WAT 6810 54.915 117.715 116.734 1.00 0.00 H TER 36921 WAT 6810 ATOM 36921 O WAT 6811 100.385 72.268 77.958 1.00 0.00 O ATOM 36922 H1 WAT 6811 99.670 71.935 78.501 1.00 0.00 H ATOM 36923 H2 WAT 6811 99.949 72.659 77.201 1.00 0.00 H TER 36925 WAT 6811 ATOM 36925 O WAT 6812 55.018 60.591 19.045 1.00 0.00 O ATOM 36926 H1 WAT 6812 55.891 60.856 18.757 1.00 0.00 H ATOM 36927 H2 WAT 6812 55.167 59.805 19.571 1.00 0.00 H TER 36929 WAT 6812 ATOM 36929 O WAT 6813 136.364 70.159 77.789 1.00 0.00 O ATOM 36930 H1 WAT 6813 135.569 69.966 77.292 1.00 0.00 H ATOM 36931 H2 WAT 6813 136.696 69.301 78.054 1.00 0.00 H TER 36933 WAT 6813 ATOM 36933 O WAT 6814 90.711 112.405 132.456 1.00 0.00 O ATOM 36934 H1 WAT 6814 90.713 112.941 133.249 1.00 0.00 H ATOM 36935 H2 WAT 6814 90.894 111.518 132.766 1.00 0.00 H TER 36937 WAT 6814 ATOM 36937 O WAT 6815 83.387 115.473 143.397 1.00 0.00 O ATOM 36938 H1 WAT 6815 83.230 115.637 144.327 1.00 0.00 H ATOM 36939 H2 WAT 6815 83.246 116.322 142.977 1.00 0.00 H TER 36941 WAT 6815 ATOM 36941 O WAT 6816 96.695 7.135 148.396 1.00 0.00 O ATOM 36942 H1 WAT 6816 96.787 6.921 149.325 1.00 0.00 H ATOM 36943 H2 WAT 6816 97.529 6.873 148.006 1.00 0.00 H TER 36945 WAT 6816 ATOM 36945 O WAT 6817 135.467 14.915 116.082 1.00 0.00 O ATOM 36946 H1 WAT 6817 136.358 14.872 116.430 1.00 0.00 H ATOM 36947 H2 WAT 6817 135.544 14.582 115.187 1.00 0.00 H TER 36949 WAT 6817 ATOM 36949 O WAT 6818 61.615 28.174 74.243 1.00 0.00 O ATOM 36950 H1 WAT 6818 61.955 28.600 75.030 1.00 0.00 H ATOM 36951 H2 WAT 6818 62.248 27.481 74.054 1.00 0.00 H TER 36953 WAT 6818 ATOM 36953 O WAT 6819 17.486 136.071 65.030 1.00 0.00 O ATOM 36954 H1 WAT 6819 17.415 135.981 64.080 1.00 0.00 H ATOM 36955 H2 WAT 6819 16.748 136.630 65.274 1.00 0.00 H TER 36957 WAT 6819 ATOM 36957 O WAT 6820 44.326 11.876 77.646 1.00 0.00 O ATOM 36958 H1 WAT 6820 43.586 11.424 78.052 1.00 0.00 H ATOM 36959 H2 WAT 6820 44.332 12.741 78.056 1.00 0.00 H TER 36961 WAT 6820 ATOM 36961 O WAT 6821 84.695 91.728 104.035 1.00 0.00 O ATOM 36962 H1 WAT 6821 83.852 92.179 104.099 1.00 0.00 H ATOM 36963 H2 WAT 6821 84.955 91.576 104.943 1.00 0.00 H TER 36965 WAT 6821 ATOM 36965 O WAT 6822 34.197 84.408 133.250 1.00 0.00 O ATOM 36966 H1 WAT 6822 35.057 84.418 133.671 1.00 0.00 H ATOM 36967 H2 WAT 6822 34.124 83.529 132.877 1.00 0.00 H TER 36969 WAT 6822 ATOM 36969 O WAT 6823 10.691 33.627 95.789 1.00 0.00 O ATOM 36970 H1 WAT 6823 11.206 33.546 96.592 1.00 0.00 H ATOM 36971 H2 WAT 6823 11.270 34.082 95.178 1.00 0.00 H TER 36973 WAT 6823 ATOM 36973 O WAT 6824 137.205 95.716 29.929 1.00 0.00 O ATOM 36974 H1 WAT 6824 137.476 96.575 29.605 1.00 0.00 H ATOM 36975 H2 WAT 6824 136.315 95.604 29.596 1.00 0.00 H TER 36977 WAT 6824 ATOM 36977 O WAT 6825 27.948 48.090 87.117 1.00 0.00 O ATOM 36978 H1 WAT 6825 27.468 48.913 87.017 1.00 0.00 H ATOM 36979 H2 WAT 6825 27.317 47.413 86.872 1.00 0.00 H TER 36981 WAT 6825 ATOM 36981 O WAT 6826 65.892 92.304 86.603 1.00 0.00 O ATOM 36982 H1 WAT 6826 66.407 93.057 86.894 1.00 0.00 H ATOM 36983 H2 WAT 6826 66.211 92.124 85.718 1.00 0.00 H TER 36985 WAT 6826 ATOM 36985 O WAT 6827 61.340 101.018 128.253 1.00 0.00 O ATOM 36986 H1 WAT 6827 61.885 101.730 127.918 1.00 0.00 H ATOM 36987 H2 WAT 6827 61.326 101.153 129.200 1.00 0.00 H TER 36989 WAT 6827 ATOM 36989 O WAT 6828 28.540 38.538 121.572 1.00 0.00 O ATOM 36990 H1 WAT 6828 28.065 38.927 122.307 1.00 0.00 H ATOM 36991 H2 WAT 6828 28.334 37.604 121.621 1.00 0.00 H TER 36993 WAT 6828 ATOM 36993 O WAT 6829 124.215 124.132 89.830 1.00 0.00 O ATOM 36994 H1 WAT 6829 124.726 123.764 90.551 1.00 0.00 H ATOM 36995 H2 WAT 6829 123.396 124.415 90.238 1.00 0.00 H TER 36997 WAT 6829 ATOM 36997 O WAT 6830 73.849 69.380 124.600 1.00 0.00 O ATOM 36998 H1 WAT 6830 72.912 69.263 124.443 1.00 0.00 H ATOM 36999 H2 WAT 6830 73.994 69.006 125.470 1.00 0.00 H TER 37001 WAT 6830 ATOM 37001 O WAT 6831 99.331 54.288 102.332 1.00 0.00 O ATOM 37002 H1 WAT 6831 98.781 54.573 101.601 1.00 0.00 H ATOM 37003 H2 WAT 6831 100.194 54.150 101.942 1.00 0.00 H TER 37005 WAT 6831 ATOM 37005 O WAT 6832 46.317 30.890 138.975 1.00 0.00 O ATOM 37006 H1 WAT 6832 45.421 31.013 139.287 1.00 0.00 H ATOM 37007 H2 WAT 6832 46.677 31.776 138.926 1.00 0.00 H TER 37009 WAT 6832 ATOM 37009 O WAT 6833 77.045 20.931 60.314 1.00 0.00 O ATOM 37010 H1 WAT 6833 76.561 21.349 59.602 1.00 0.00 H ATOM 37011 H2 WAT 6833 76.879 19.995 60.200 1.00 0.00 H TER 37013 WAT 6833 ATOM 37013 O WAT 6834 46.946 73.733 136.102 1.00 0.00 O ATOM 37014 H1 WAT 6834 46.323 73.455 135.431 1.00 0.00 H ATOM 37015 H2 WAT 6834 46.477 73.615 136.928 1.00 0.00 H TER 37017 WAT 6834 ATOM 37017 O WAT 6835 116.580 71.699 77.463 1.00 0.00 O ATOM 37018 H1 WAT 6835 116.330 71.771 78.384 1.00 0.00 H ATOM 37019 H2 WAT 6835 115.851 72.094 76.986 1.00 0.00 H TER 37021 WAT 6835 ATOM 37021 O WAT 6836 87.632 25.837 149.409 1.00 0.00 O ATOM 37022 H1 WAT 6836 88.273 26.537 149.288 1.00 0.00 H ATOM 37023 H2 WAT 6836 87.983 25.313 150.129 1.00 0.00 H TER 37025 WAT 6836 ATOM 37025 O WAT 6837 59.040 111.950 140.804 1.00 0.00 O ATOM 37026 H1 WAT 6837 59.137 111.954 141.757 1.00 0.00 H ATOM 37027 H2 WAT 6837 58.412 111.249 140.630 1.00 0.00 H TER 37029 WAT 6837 ATOM 37029 O WAT 6838 46.820 83.279 6.946 1.00 0.00 O ATOM 37030 H1 WAT 6838 47.204 82.769 6.232 1.00 0.00 H ATOM 37031 H2 WAT 6838 45.886 83.312 6.740 1.00 0.00 H TER 37033 WAT 6838 ATOM 37033 O WAT 6839 61.882 79.402 3.578 1.00 0.00 O ATOM 37034 H1 WAT 6839 62.332 79.995 4.180 1.00 0.00 H ATOM 37035 H2 WAT 6839 62.509 79.262 2.868 1.00 0.00 H TER 37037 WAT 6839 ATOM 37037 O WAT 6840 126.372 84.761 105.984 1.00 0.00 O ATOM 37038 H1 WAT 6840 126.743 85.295 105.282 1.00 0.00 H ATOM 37039 H2 WAT 6840 127.132 84.433 106.464 1.00 0.00 H TER 37041 WAT 6840 ATOM 37041 O WAT 6841 138.433 124.644 143.303 1.00 0.00 O ATOM 37042 H1 WAT 6841 137.779 124.888 143.959 1.00 0.00 H ATOM 37043 H2 WAT 6841 139.273 124.760 143.748 1.00 0.00 H TER 37045 WAT 6841 ATOM 37045 O WAT 6842 39.276 5.892 99.003 1.00 0.00 O ATOM 37046 H1 WAT 6842 38.472 5.828 98.488 1.00 0.00 H ATOM 37047 H2 WAT 6842 39.301 5.082 99.511 1.00 0.00 H TER 37049 WAT 6842 ATOM 37049 O WAT 6843 135.076 127.041 93.098 1.00 0.00 O ATOM 37050 H1 WAT 6843 135.107 126.196 92.649 1.00 0.00 H ATOM 37051 H2 WAT 6843 135.084 127.688 92.392 1.00 0.00 H TER 37053 WAT 6843 ATOM 37053 O WAT 6844 132.030 131.424 95.443 1.00 0.00 O ATOM 37054 H1 WAT 6844 132.010 130.547 95.828 1.00 0.00 H ATOM 37055 H2 WAT 6844 131.116 131.611 95.229 1.00 0.00 H TER 37057 WAT 6844 ATOM 37057 O WAT 6845 75.182 15.486 120.768 1.00 0.00 O ATOM 37058 H1 WAT 6845 75.885 16.088 120.524 1.00 0.00 H ATOM 37059 H2 WAT 6845 75.185 15.489 121.725 1.00 0.00 H TER 37061 WAT 6845 ATOM 37061 O WAT 6846 78.072 120.971 94.815 1.00 0.00 O ATOM 37062 H1 WAT 6846 78.264 120.398 94.073 1.00 0.00 H ATOM 37063 H2 WAT 6846 78.365 121.836 94.531 1.00 0.00 H TER 37065 WAT 6846 ATOM 37065 O WAT 6847 50.508 39.712 23.181 1.00 0.00 O ATOM 37066 H1 WAT 6847 50.051 40.553 23.185 1.00 0.00 H ATOM 37067 H2 WAT 6847 51.069 39.740 23.956 1.00 0.00 H TER 37069 WAT 6847 ATOM 37069 O WAT 6848 21.592 116.399 8.486 1.00 0.00 O ATOM 37070 H1 WAT 6848 21.971 116.371 9.365 1.00 0.00 H ATOM 37071 H2 WAT 6848 21.046 115.614 8.436 1.00 0.00 H TER 37073 WAT 6848 ATOM 37073 O WAT 6849 19.188 112.396 19.863 1.00 0.00 O ATOM 37074 H1 WAT 6849 18.654 112.804 20.545 1.00 0.00 H ATOM 37075 H2 WAT 6849 20.068 112.357 20.240 1.00 0.00 H TER 37077 WAT 6849 ATOM 37077 O WAT 6850 144.855 19.273 61.314 1.00 0.00 O ATOM 37078 H1 WAT 6850 145.157 18.604 60.700 1.00 0.00 H ATOM 37079 H2 WAT 6850 145.573 19.905 61.352 1.00 0.00 H TER 37081 WAT 6850 ATOM 37081 O WAT 6851 103.655 61.150 116.425 1.00 0.00 O ATOM 37082 H1 WAT 6851 103.388 60.254 116.629 1.00 0.00 H ATOM 37083 H2 WAT 6851 103.221 61.347 115.595 1.00 0.00 H TER 37085 WAT 6851 ATOM 37085 O WAT 6852 22.268 37.356 1.858 1.00 0.00 O ATOM 37086 H1 WAT 6852 21.695 37.632 2.573 1.00 0.00 H ATOM 37087 H2 WAT 6852 21.712 37.388 1.080 1.00 0.00 H TER 37089 WAT 6852 ATOM 37089 O WAT 6853 143.414 39.308 132.708 1.00 0.00 O ATOM 37090 H1 WAT 6853 143.374 38.353 132.771 1.00 0.00 H ATOM 37091 H2 WAT 6853 144.202 39.481 132.193 1.00 0.00 H TER 37093 WAT 6853 ATOM 37093 O WAT 6854 142.281 86.038 75.080 1.00 0.00 O ATOM 37094 H1 WAT 6854 142.939 85.356 75.216 1.00 0.00 H ATOM 37095 H2 WAT 6854 142.111 86.385 75.955 1.00 0.00 H TER 37097 WAT 6854 ATOM 37097 O WAT 6855 144.824 76.185 69.061 1.00 0.00 O ATOM 37098 H1 WAT 6855 145.095 77.095 68.941 1.00 0.00 H ATOM 37099 H2 WAT 6855 144.811 76.062 70.010 1.00 0.00 H TER 37101 WAT 6855 ATOM 37101 O WAT 6856 73.872 144.027 2.954 1.00 0.00 O ATOM 37102 H1 WAT 6856 73.009 144.306 2.648 1.00 0.00 H ATOM 37103 H2 WAT 6856 74.483 144.398 2.317 1.00 0.00 H TER 37105 WAT 6856 ATOM 37105 O WAT 6857 99.072 72.539 86.231 1.00 0.00 O ATOM 37106 H1 WAT 6857 98.487 72.809 86.939 1.00 0.00 H ATOM 37107 H2 WAT 6857 98.486 72.308 85.511 1.00 0.00 H TER 37109 WAT 6857 ATOM 37109 O WAT 6858 71.228 2.125 22.814 1.00 0.00 O ATOM 37110 H1 WAT 6858 70.659 2.431 23.520 1.00 0.00 H ATOM 37111 H2 WAT 6858 71.124 2.779 22.123 1.00 0.00 H TER 37113 WAT 6858 ATOM 37113 O WAT 6859 57.742 142.192 129.778 1.00 0.00 O ATOM 37114 H1 WAT 6859 57.701 141.797 128.907 1.00 0.00 H ATOM 37115 H2 WAT 6859 58.676 142.334 129.933 1.00 0.00 H TER 37117 WAT 6859 ATOM 37117 O WAT 6860 108.787 48.111 132.129 1.00 0.00 O ATOM 37118 H1 WAT 6860 108.948 47.663 131.298 1.00 0.00 H ATOM 37119 H2 WAT 6860 109.109 47.503 132.794 1.00 0.00 H TER 37121 WAT 6860 ATOM 37121 O WAT 6861 104.264 13.624 128.785 1.00 0.00 O ATOM 37122 H1 WAT 6861 104.157 12.678 128.886 1.00 0.00 H ATOM 37123 H2 WAT 6861 105.203 13.744 128.640 1.00 0.00 H TER 37125 WAT 6861 ATOM 37125 O WAT 6862 31.233 111.169 70.876 1.00 0.00 O ATOM 37126 H1 WAT 6862 30.663 111.528 70.196 1.00 0.00 H ATOM 37127 H2 WAT 6862 30.631 110.842 71.545 1.00 0.00 H TER 37129 WAT 6862 ATOM 37129 O WAT 6863 65.165 2.283 126.895 1.00 0.00 O ATOM 37130 H1 WAT 6863 64.467 2.938 126.921 1.00 0.00 H ATOM 37131 H2 WAT 6863 65.968 2.793 126.793 1.00 0.00 H TER 37133 WAT 6863 ATOM 37133 O WAT 6864 44.626 110.923 0.449 1.00 0.00 O ATOM 37134 H1 WAT 6864 44.485 111.369 -0.386 1.00 0.00 H ATOM 37135 H2 WAT 6864 44.715 111.631 1.087 1.00 0.00 H TER 37137 WAT 6864 ATOM 37137 O WAT 6865 122.603 118.919 116.063 1.00 0.00 O ATOM 37138 H1 WAT 6865 122.338 119.422 116.834 1.00 0.00 H ATOM 37139 H2 WAT 6865 123.349 118.399 116.361 1.00 0.00 H TER 37141 WAT 6865 ATOM 37141 O WAT 6866 128.936 118.667 126.922 1.00 0.00 O ATOM 37142 H1 WAT 6866 128.794 119.133 127.746 1.00 0.00 H ATOM 37143 H2 WAT 6866 129.022 119.359 126.267 1.00 0.00 H TER 37145 WAT 6866 ATOM 37145 O WAT 6867 90.521 70.915 117.360 1.00 0.00 O ATOM 37146 H1 WAT 6867 90.643 70.292 116.643 1.00 0.00 H ATOM 37147 H2 WAT 6867 90.956 71.713 117.060 1.00 0.00 H TER 37149 WAT 6867 ATOM 37149 O WAT 6868 127.189 78.330 124.395 1.00 0.00 O ATOM 37150 H1 WAT 6868 126.846 77.440 124.486 1.00 0.00 H ATOM 37151 H2 WAT 6868 126.738 78.830 125.075 1.00 0.00 H TER 37153 WAT 6868 ATOM 37153 O WAT 6869 14.993 139.805 104.369 1.00 0.00 O ATOM 37154 H1 WAT 6869 15.742 139.215 104.285 1.00 0.00 H ATOM 37155 H2 WAT 6869 14.635 139.866 103.483 1.00 0.00 H TER 37157 WAT 6869 ATOM 37157 O WAT 6870 25.839 90.525 111.799 1.00 0.00 O ATOM 37158 H1 WAT 6870 26.648 90.695 111.317 1.00 0.00 H ATOM 37159 H2 WAT 6870 25.245 90.153 111.146 1.00 0.00 H TER 37161 WAT 6870 ATOM 37161 O WAT 6871 81.127 66.817 125.192 1.00 0.00 O ATOM 37162 H1 WAT 6871 80.879 66.565 124.303 1.00 0.00 H ATOM 37163 H2 WAT 6871 81.840 66.220 125.420 1.00 0.00 H TER 37165 WAT 6871 ATOM 37165 O WAT 6872 47.114 75.592 90.166 1.00 0.00 O ATOM 37166 H1 WAT 6872 47.674 74.850 89.938 1.00 0.00 H ATOM 37167 H2 WAT 6872 46.261 75.372 89.792 1.00 0.00 H TER 37169 WAT 6872 ATOM 37169 O WAT 6873 123.999 89.871 24.192 1.00 0.00 O ATOM 37170 H1 WAT 6873 124.328 90.443 24.885 1.00 0.00 H ATOM 37171 H2 WAT 6873 124.357 89.009 24.402 1.00 0.00 H TER 37173 WAT 6873 ATOM 37173 O WAT 6874 17.336 48.951 149.585 1.00 0.00 O ATOM 37174 H1 WAT 6874 16.490 48.752 149.184 1.00 0.00 H ATOM 37175 H2 WAT 6874 17.746 49.573 148.984 1.00 0.00 H TER 37177 WAT 6874 ATOM 37177 O WAT 6875 143.002 79.010 139.378 1.00 0.00 O ATOM 37178 H1 WAT 6875 143.106 78.696 138.480 1.00 0.00 H ATOM 37179 H2 WAT 6875 142.876 79.955 139.289 1.00 0.00 H TER 37181 WAT 6875 ATOM 37181 O WAT 6876 44.746 124.110 82.466 1.00 0.00 O ATOM 37182 H1 WAT 6876 44.103 124.020 81.762 1.00 0.00 H ATOM 37183 H2 WAT 6876 44.280 124.580 83.157 1.00 0.00 H TER 37185 WAT 6876 ATOM 37185 O WAT 6877 130.539 44.704 130.821 1.00 0.00 O ATOM 37186 H1 WAT 6877 130.875 44.468 131.686 1.00 0.00 H ATOM 37187 H2 WAT 6877 129.652 44.344 130.802 1.00 0.00 H TER 37189 WAT 6877 ATOM 37189 O WAT 6878 137.037 83.582 119.599 1.00 0.00 O ATOM 37190 H1 WAT 6878 137.840 83.440 120.100 1.00 0.00 H ATOM 37191 H2 WAT 6878 137.243 84.317 119.021 1.00 0.00 H TER 37193 WAT 6878 ATOM 37193 O WAT 6879 77.166 127.999 76.881 1.00 0.00 O ATOM 37194 H1 WAT 6879 77.525 128.035 77.767 1.00 0.00 H ATOM 37195 H2 WAT 6879 77.248 127.080 76.626 1.00 0.00 H TER 37197 WAT 6879 ATOM 37197 O WAT 6880 81.556 12.986 67.492 1.00 0.00 O ATOM 37198 H1 WAT 6880 80.923 13.700 67.579 1.00 0.00 H ATOM 37199 H2 WAT 6880 81.022 12.192 67.487 1.00 0.00 H TER 37201 WAT 6880 ATOM 37201 O WAT 6881 12.022 122.996 88.842 1.00 0.00 O ATOM 37202 H1 WAT 6881 11.477 123.775 88.951 1.00 0.00 H ATOM 37203 H2 WAT 6881 12.674 123.060 89.539 1.00 0.00 H TER 37205 WAT 6881 ATOM 37205 O WAT 6882 118.040 18.019 2.652 1.00 0.00 O ATOM 37206 H1 WAT 6882 118.288 17.868 3.565 1.00 0.00 H ATOM 37207 H2 WAT 6882 117.234 18.532 2.705 1.00 0.00 H TER 37209 WAT 6882 ATOM 37209 O WAT 6883 33.147 140.602 48.180 1.00 0.00 O ATOM 37210 H1 WAT 6883 32.632 139.803 48.292 1.00 0.00 H ATOM 37211 H2 WAT 6883 32.578 141.301 48.502 1.00 0.00 H TER 37213 WAT 6883 ATOM 37213 O WAT 6884 144.360 23.882 107.633 1.00 0.00 O ATOM 37214 H1 WAT 6884 145.230 23.740 108.004 1.00 0.00 H ATOM 37215 H2 WAT 6884 144.321 24.823 107.466 1.00 0.00 H TER 37217 WAT 6884 ATOM 37217 O WAT 6885 62.467 124.726 68.746 1.00 0.00 O ATOM 37218 H1 WAT 6885 63.325 124.473 68.405 1.00 0.00 H ATOM 37219 H2 WAT 6885 62.169 125.418 68.155 1.00 0.00 H TER 37221 WAT 6885 ATOM 37221 O WAT 6886 3.855 106.412 87.781 1.00 0.00 O ATOM 37222 H1 WAT 6886 3.851 106.954 88.570 1.00 0.00 H ATOM 37223 H2 WAT 6886 4.496 106.831 87.207 1.00 0.00 H TER 37225 WAT 6886 ATOM 37225 O WAT 6887 87.160 140.669 155.683 1.00 0.00 O ATOM 37226 H1 WAT 6887 87.581 139.971 156.186 1.00 0.00 H ATOM 37227 H2 WAT 6887 87.376 141.471 156.160 1.00 0.00 H TER 37229 WAT 6887 ATOM 37229 O WAT 6888 111.425 137.016 115.926 1.00 0.00 O ATOM 37230 H1 WAT 6888 110.826 136.974 116.672 1.00 0.00 H ATOM 37231 H2 WAT 6888 111.414 137.935 115.661 1.00 0.00 H TER 37233 WAT 6888 ATOM 37233 O WAT 6889 27.179 103.862 16.161 1.00 0.00 O ATOM 37234 H1 WAT 6889 27.337 104.002 17.095 1.00 0.00 H ATOM 37235 H2 WAT 6889 27.976 104.173 15.733 1.00 0.00 H TER 37237 WAT 6889 ATOM 37237 O WAT 6890 4.782 143.469 71.067 1.00 0.00 O ATOM 37238 H1 WAT 6890 4.980 143.338 70.140 1.00 0.00 H ATOM 37239 H2 WAT 6890 4.520 144.388 71.128 1.00 0.00 H TER 37241 WAT 6890 ATOM 37241 O WAT 6891 90.432 96.068 11.207 1.00 0.00 O ATOM 37242 H1 WAT 6891 90.714 96.698 10.544 1.00 0.00 H ATOM 37243 H2 WAT 6891 90.279 96.597 11.990 1.00 0.00 H TER 37245 WAT 6891 ATOM 37245 O WAT 6892 137.201 76.848 111.816 1.00 0.00 O ATOM 37246 H1 WAT 6892 138.031 76.437 112.058 1.00 0.00 H ATOM 37247 H2 WAT 6892 137.421 77.418 111.079 1.00 0.00 H TER 37249 WAT 6892 ATOM 37249 O WAT 6893 65.393 0.213 121.359 1.00 0.00 O ATOM 37250 H1 WAT 6893 65.177 0.266 122.290 1.00 0.00 H ATOM 37251 H2 WAT 6893 65.503 1.124 121.086 1.00 0.00 H TER 37253 WAT 6893 ATOM 37253 O WAT 6894 56.242 31.382 78.808 1.00 0.00 O ATOM 37254 H1 WAT 6894 55.758 30.599 78.544 1.00 0.00 H ATOM 37255 H2 WAT 6894 56.006 32.041 78.154 1.00 0.00 H TER 37257 WAT 6894 ATOM 37257 O WAT 6895 95.191 49.592 141.053 1.00 0.00 O ATOM 37258 H1 WAT 6895 94.851 49.985 141.857 1.00 0.00 H ATOM 37259 H2 WAT 6895 94.450 49.103 140.694 1.00 0.00 H TER 37261 WAT 6895 ATOM 37261 O WAT 6896 77.915 103.304 9.366 1.00 0.00 O ATOM 37262 H1 WAT 6896 78.451 104.020 9.707 1.00 0.00 H ATOM 37263 H2 WAT 6896 77.017 103.632 9.418 1.00 0.00 H TER 37265 WAT 6896 ATOM 37265 O WAT 6897 62.315 112.646 63.339 1.00 0.00 O ATOM 37266 H1 WAT 6897 61.776 111.892 63.578 1.00 0.00 H ATOM 37267 H2 WAT 6897 62.576 112.478 62.434 1.00 0.00 H TER 37269 WAT 6897 ATOM 37269 O WAT 6898 30.662 130.289 95.719 1.00 0.00 O ATOM 37270 H1 WAT 6898 30.072 129.698 96.187 1.00 0.00 H ATOM 37271 H2 WAT 6898 31.397 130.417 96.319 1.00 0.00 H TER 37273 WAT 6898 ATOM 37273 O WAT 6899 125.950 51.228 139.123 1.00 0.00 O ATOM 37274 H1 WAT 6899 126.064 50.694 139.909 1.00 0.00 H ATOM 37275 H2 WAT 6899 125.053 51.555 139.183 1.00 0.00 H TER 37277 WAT 6899 ATOM 37277 O WAT 6900 86.857 39.569 141.339 1.00 0.00 O ATOM 37278 H1 WAT 6900 86.707 38.825 141.922 1.00 0.00 H ATOM 37279 H2 WAT 6900 86.039 39.659 140.850 1.00 0.00 H TER 37281 WAT 6900 ATOM 37281 O WAT 6901 90.591 108.521 7.793 1.00 0.00 O ATOM 37282 H1 WAT 6901 89.899 109.165 7.943 1.00 0.00 H ATOM 37283 H2 WAT 6901 90.540 107.934 8.547 1.00 0.00 H TER 37285 WAT 6901 ATOM 37285 O WAT 6902 55.356 89.067 75.844 1.00 0.00 O ATOM 37286 H1 WAT 6902 56.034 88.901 76.499 1.00 0.00 H ATOM 37287 H2 WAT 6902 55.243 90.018 75.851 1.00 0.00 H TER 37289 WAT 6902 ATOM 37289 O WAT 6903 54.187 69.098 145.856 1.00 0.00 O ATOM 37290 H1 WAT 6903 53.333 69.114 145.424 1.00 0.00 H ATOM 37291 H2 WAT 6903 54.167 68.308 146.396 1.00 0.00 H TER 37293 WAT 6903 ATOM 37293 O WAT 6904 21.537 35.592 146.624 1.00 0.00 O ATOM 37294 H1 WAT 6904 22.257 35.678 147.248 1.00 0.00 H ATOM 37295 H2 WAT 6904 21.786 36.156 145.892 1.00 0.00 H TER 37297 WAT 6904 ATOM 37297 O WAT 6905 116.937 127.975 110.094 1.00 0.00 O ATOM 37298 H1 WAT 6905 117.299 127.917 110.979 1.00 0.00 H ATOM 37299 H2 WAT 6905 116.071 128.364 110.215 1.00 0.00 H TER 37301 WAT 6905 ATOM 37301 O WAT 6906 82.581 92.171 141.247 1.00 0.00 O ATOM 37302 H1 WAT 6906 82.870 91.812 140.408 1.00 0.00 H ATOM 37303 H2 WAT 6906 83.331 92.674 141.564 1.00 0.00 H TER 37305 WAT 6906 ATOM 37305 O WAT 6907 43.701 14.906 114.053 1.00 0.00 O ATOM 37306 H1 WAT 6907 43.276 15.113 114.885 1.00 0.00 H ATOM 37307 H2 WAT 6907 43.967 13.991 114.141 1.00 0.00 H TER 37309 WAT 6907 ATOM 37309 O WAT 6908 15.331 88.143 15.319 1.00 0.00 O ATOM 37310 H1 WAT 6908 15.938 87.875 14.629 1.00 0.00 H ATOM 37311 H2 WAT 6908 14.572 87.570 15.206 1.00 0.00 H TER 37313 WAT 6908 ATOM 37313 O WAT 6909 132.213 70.640 65.910 1.00 0.00 O ATOM 37314 H1 WAT 6909 132.418 70.315 66.787 1.00 0.00 H ATOM 37315 H2 WAT 6909 133.035 71.017 65.596 1.00 0.00 H TER 37317 WAT 6909 ATOM 37317 O WAT 6910 99.988 15.534 88.299 1.00 0.00 O ATOM 37318 H1 WAT 6910 99.728 15.195 89.155 1.00 0.00 H ATOM 37319 H2 WAT 6910 99.778 16.467 88.337 1.00 0.00 H TER 37321 WAT 6910 ATOM 37321 O WAT 6911 132.776 81.491 114.136 1.00 0.00 O ATOM 37322 H1 WAT 6911 131.965 81.873 113.801 1.00 0.00 H ATOM 37323 H2 WAT 6911 132.501 80.968 114.889 1.00 0.00 H TER 37325 WAT 6911 ATOM 37325 O WAT 6912 65.511 48.021 75.169 1.00 0.00 O ATOM 37326 H1 WAT 6912 65.612 47.128 74.839 1.00 0.00 H ATOM 37327 H2 WAT 6912 66.280 48.486 74.840 1.00 0.00 H TER 37329 WAT 6912 ATOM 37329 O WAT 6913 108.185 104.703 132.124 1.00 0.00 O ATOM 37330 H1 WAT 6913 107.504 105.258 132.504 1.00 0.00 H ATOM 37331 H2 WAT 6913 107.863 103.810 132.247 1.00 0.00 H TER 37333 WAT 6913 ATOM 37333 O WAT 6914 80.999 46.817 99.319 1.00 0.00 O ATOM 37334 H1 WAT 6914 81.541 47.583 99.132 1.00 0.00 H ATOM 37335 H2 WAT 6914 80.308 47.148 99.893 1.00 0.00 H TER 37337 WAT 6914 ATOM 37337 O WAT 6915 25.257 98.173 99.056 1.00 0.00 O ATOM 37338 H1 WAT 6915 25.285 97.218 98.991 1.00 0.00 H ATOM 37339 H2 WAT 6915 26.109 98.460 98.728 1.00 0.00 H TER 37341 WAT 6915 ATOM 37341 O WAT 6916 28.813 60.369 65.008 1.00 0.00 O ATOM 37342 H1 WAT 6916 28.735 59.686 64.341 1.00 0.00 H ATOM 37343 H2 WAT 6916 29.178 61.120 64.540 1.00 0.00 H TER 37345 WAT 6916 ATOM 37345 O WAT 6917 31.263 6.861 12.503 1.00 0.00 O ATOM 37346 H1 WAT 6917 31.411 7.756 12.810 1.00 0.00 H ATOM 37347 H2 WAT 6917 31.733 6.312 13.130 1.00 0.00 H TER 37349 WAT 6917 ATOM 37349 O WAT 6918 86.546 35.492 10.530 1.00 0.00 O ATOM 37350 H1 WAT 6918 85.732 35.202 10.119 1.00 0.00 H ATOM 37351 H2 WAT 6918 86.979 36.019 9.859 1.00 0.00 H TER 37353 WAT 6918 ATOM 37353 O WAT 6919 92.581 45.720 16.581 1.00 0.00 O ATOM 37354 H1 WAT 6919 92.025 45.980 17.316 1.00 0.00 H ATOM 37355 H2 WAT 6919 92.580 44.763 16.607 1.00 0.00 H TER 37357 WAT 6919 ATOM 37357 O WAT 6920 118.359 102.440 71.790 1.00 0.00 O ATOM 37358 H1 WAT 6920 118.065 103.287 72.125 1.00 0.00 H ATOM 37359 H2 WAT 6920 117.758 101.806 72.181 1.00 0.00 H TER 37361 WAT 6920 ATOM 37361 O WAT 6921 112.203 122.393 90.031 1.00 0.00 O ATOM 37362 H1 WAT 6921 112.522 122.253 90.922 1.00 0.00 H ATOM 37363 H2 WAT 6921 111.253 122.458 90.125 1.00 0.00 H TER 37365 WAT 6921 ATOM 37365 O WAT 6922 82.558 102.150 142.772 1.00 0.00 O ATOM 37366 H1 WAT 6922 81.879 101.831 142.178 1.00 0.00 H ATOM 37367 H2 WAT 6922 83.218 102.537 142.196 1.00 0.00 H TER 37369 WAT 6922 ATOM 37369 O WAT 6923 5.895 40.079 113.368 1.00 0.00 O ATOM 37370 H1 WAT 6923 6.007 40.155 112.420 1.00 0.00 H ATOM 37371 H2 WAT 6923 5.964 40.977 113.690 1.00 0.00 H TER 37373 WAT 6923 ATOM 37373 O WAT 6924 56.218 54.954 14.472 1.00 0.00 O ATOM 37374 H1 WAT 6924 55.724 55.764 14.596 1.00 0.00 H ATOM 37375 H2 WAT 6924 57.135 55.229 14.479 1.00 0.00 H TER 37377 WAT 6924 ATOM 37377 O WAT 6925 7.119 5.652 67.129 1.00 0.00 O ATOM 37378 H1 WAT 6925 7.766 6.131 67.647 1.00 0.00 H ATOM 37379 H2 WAT 6925 7.453 5.691 66.233 1.00 0.00 H TER 37381 WAT 6925 ATOM 37381 O WAT 6926 110.723 89.340 26.841 1.00 0.00 O ATOM 37382 H1 WAT 6926 110.535 89.923 26.106 1.00 0.00 H ATOM 37383 H2 WAT 6926 110.938 88.502 26.432 1.00 0.00 H TER 37385 WAT 6926 ATOM 37385 O WAT 6927 44.540 124.387 146.493 1.00 0.00 O ATOM 37386 H1 WAT 6927 44.184 123.732 147.093 1.00 0.00 H ATOM 37387 H2 WAT 6927 45.483 124.376 146.658 1.00 0.00 H TER 37389 WAT 6927 ATOM 37389 O WAT 6928 27.108 128.805 13.744 1.00 0.00 O ATOM 37390 H1 WAT 6928 27.930 129.250 13.952 1.00 0.00 H ATOM 37391 H2 WAT 6928 27.222 128.502 12.843 1.00 0.00 H TER 37393 WAT 6928 ATOM 37393 O WAT 6929 142.875 42.867 74.741 1.00 0.00 O ATOM 37394 H1 WAT 6929 142.691 41.995 75.090 1.00 0.00 H ATOM 37395 H2 WAT 6929 143.680 43.138 75.183 1.00 0.00 H TER 37397 WAT 6929 ATOM 37397 O WAT 6930 11.464 17.156 103.830 1.00 0.00 O ATOM 37398 H1 WAT 6930 11.728 16.460 104.432 1.00 0.00 H ATOM 37399 H2 WAT 6930 10.513 17.209 103.926 1.00 0.00 H TER 37401 WAT 6930 ATOM 37401 O WAT 6931 87.902 35.901 120.531 1.00 0.00 O ATOM 37402 H1 WAT 6931 87.641 36.528 119.856 1.00 0.00 H ATOM 37403 H2 WAT 6931 87.081 35.502 120.819 1.00 0.00 H TER 37405 WAT 6931 ATOM 37405 O WAT 6932 137.481 25.977 114.111 1.00 0.00 O ATOM 37406 H1 WAT 6932 136.540 26.106 113.999 1.00 0.00 H ATOM 37407 H2 WAT 6932 137.805 25.793 113.229 1.00 0.00 H TER 37409 WAT 6932 ATOM 37409 O WAT 6933 58.843 100.874 103.422 1.00 0.00 O ATOM 37410 H1 WAT 6933 59.624 100.340 103.274 1.00 0.00 H ATOM 37411 H2 WAT 6933 58.547 100.627 104.298 1.00 0.00 H TER 37413 WAT 6933 ATOM 37413 O WAT 6934 15.158 20.968 158.475 1.00 0.00 O ATOM 37414 H1 WAT 6934 14.440 20.815 159.089 1.00 0.00 H ATOM 37415 H2 WAT 6934 15.255 20.138 158.008 1.00 0.00 H TER 37417 WAT 6934 ATOM 37417 O WAT 6935 84.275 49.053 148.427 1.00 0.00 O ATOM 37418 H1 WAT 6935 83.488 48.571 148.173 1.00 0.00 H ATOM 37419 H2 WAT 6935 84.999 48.489 148.154 1.00 0.00 H TER 37421 WAT 6935 ATOM 37421 O WAT 6936 119.899 41.229 55.065 1.00 0.00 O ATOM 37422 H1 WAT 6936 119.156 40.626 55.052 1.00 0.00 H ATOM 37423 H2 WAT 6936 119.506 42.089 55.213 1.00 0.00 H TER 37425 WAT 6936 ATOM 37425 O WAT 6937 58.030 60.731 68.980 1.00 0.00 O ATOM 37426 H1 WAT 6937 57.424 60.058 69.289 1.00 0.00 H ATOM 37427 H2 WAT 6937 57.741 60.922 68.088 1.00 0.00 H TER 37429 WAT 6937 ATOM 37429 O WAT 6938 120.034 116.107 139.164 1.00 0.00 O ATOM 37430 H1 WAT 6938 120.901 115.707 139.089 1.00 0.00 H ATOM 37431 H2 WAT 6938 120.141 116.787 139.830 1.00 0.00 H TER 37433 WAT 6938 ATOM 37433 O WAT 6939 98.440 28.037 76.376 1.00 0.00 O ATOM 37434 H1 WAT 6939 98.048 27.730 75.559 1.00 0.00 H ATOM 37435 H2 WAT 6939 98.576 27.242 76.891 1.00 0.00 H TER 37437 WAT 6939 ATOM 37437 O WAT 6940 24.302 24.988 136.986 1.00 0.00 O ATOM 37438 H1 WAT 6940 24.129 24.231 137.545 1.00 0.00 H ATOM 37439 H2 WAT 6940 23.517 25.530 137.066 1.00 0.00 H TER 37441 WAT 6940 ATOM 37441 O WAT 6941 17.986 10.174 9.572 1.00 0.00 O ATOM 37442 H1 WAT 6941 18.064 10.966 9.040 1.00 0.00 H ATOM 37443 H2 WAT 6941 18.194 10.461 10.461 1.00 0.00 H TER 37445 WAT 6941 ATOM 37445 O WAT 6942 40.023 31.121 132.778 1.00 0.00 O ATOM 37446 H1 WAT 6942 39.106 31.388 132.718 1.00 0.00 H ATOM 37447 H2 WAT 6942 40.022 30.405 133.413 1.00 0.00 H TER 37449 WAT 6942 ATOM 37449 O WAT 6943 74.760 7.400 97.318 1.00 0.00 O ATOM 37450 H1 WAT 6943 74.428 7.930 96.593 1.00 0.00 H ATOM 37451 H2 WAT 6943 74.800 8.005 98.059 1.00 0.00 H TER 37453 WAT 6943 ATOM 37453 O WAT 6944 52.270 127.548 21.584 1.00 0.00 O ATOM 37454 H1 WAT 6944 52.256 127.206 20.690 1.00 0.00 H ATOM 37455 H2 WAT 6944 52.937 128.235 21.567 1.00 0.00 H TER 37457 WAT 6944 ATOM 37457 O WAT 6945 42.360 42.445 78.786 1.00 0.00 O ATOM 37458 H1 WAT 6945 43.135 42.815 79.209 1.00 0.00 H ATOM 37459 H2 WAT 6945 41.648 42.612 79.403 1.00 0.00 H TER 37461 WAT 6945 ATOM 37461 O WAT 6946 7.540 78.549 151.766 1.00 0.00 O ATOM 37462 H1 WAT 6946 7.185 79.405 152.006 1.00 0.00 H ATOM 37463 H2 WAT 6946 8.133 78.731 151.037 1.00 0.00 H TER 37465 WAT 6946 ATOM 37465 O WAT 6947 39.197 41.829 86.294 1.00 0.00 O ATOM 37466 H1 WAT 6947 39.648 41.772 85.451 1.00 0.00 H ATOM 37467 H2 WAT 6947 38.452 41.235 86.207 1.00 0.00 H TER 37469 WAT 6947 ATOM 37469 O WAT 6948 136.661 86.847 23.821 1.00 0.00 O ATOM 37470 H1 WAT 6948 135.978 86.182 23.911 1.00 0.00 H ATOM 37471 H2 WAT 6948 137.375 86.534 24.376 1.00 0.00 H TER 37473 WAT 6948 ATOM 37473 O WAT 6949 111.334 36.323 125.649 1.00 0.00 O ATOM 37474 H1 WAT 6949 111.815 35.495 125.618 1.00 0.00 H ATOM 37475 H2 WAT 6949 110.483 36.091 126.021 1.00 0.00 H TER 37477 WAT 6949 ATOM 37477 O WAT 6950 57.076 140.170 105.488 1.00 0.00 O ATOM 37478 H1 WAT 6950 56.270 139.698 105.699 1.00 0.00 H ATOM 37479 H2 WAT 6950 57.769 139.518 105.592 1.00 0.00 H TER 37481 WAT 6950 ATOM 37481 O WAT 6951 104.650 108.804 111.686 1.00 0.00 O ATOM 37482 H1 WAT 6951 103.708 108.876 111.842 1.00 0.00 H ATOM 37483 H2 WAT 6951 104.858 109.554 111.129 1.00 0.00 H TER 37485 WAT 6951 ATOM 37485 O WAT 6952 88.320 17.459 121.899 1.00 0.00 O ATOM 37486 H1 WAT 6952 87.929 16.596 121.760 1.00 0.00 H ATOM 37487 H2 WAT 6952 88.498 17.492 122.839 1.00 0.00 H TER 37489 WAT 6952 ATOM 37489 O WAT 6953 12.965 31.130 140.525 1.00 0.00 O ATOM 37490 H1 WAT 6953 13.662 30.849 139.933 1.00 0.00 H ATOM 37491 H2 WAT 6953 12.160 31.014 140.020 1.00 0.00 H TER 37493 WAT 6953 ATOM 37493 O WAT 6954 93.002 89.145 16.410 1.00 0.00 O ATOM 37494 H1 WAT 6954 93.575 89.668 15.849 1.00 0.00 H ATOM 37495 H2 WAT 6954 92.162 89.135 15.952 1.00 0.00 H TER 37497 WAT 6954 ATOM 37497 O WAT 6955 58.398 74.417 152.862 1.00 0.00 O ATOM 37498 H1 WAT 6955 59.199 73.984 152.567 1.00 0.00 H ATOM 37499 H2 WAT 6955 57.691 73.921 152.448 1.00 0.00 H TER 37501 WAT 6955 ATOM 37501 O WAT 6956 129.558 52.958 151.149 1.00 0.00 O ATOM 37502 H1 WAT 6956 129.377 53.880 150.968 1.00 0.00 H ATOM 37503 H2 WAT 6956 128.704 52.585 151.368 1.00 0.00 H TER 37505 WAT 6956 ATOM 37505 O WAT 6957 76.811 120.105 157.151 1.00 0.00 O ATOM 37506 H1 WAT 6957 76.131 119.431 157.173 1.00 0.00 H ATOM 37507 H2 WAT 6957 77.351 119.925 157.921 1.00 0.00 H TER 37509 WAT 6957 ATOM 37509 O WAT 6958 53.079 24.391 120.602 1.00 0.00 O ATOM 37510 H1 WAT 6958 52.205 24.270 120.974 1.00 0.00 H ATOM 37511 H2 WAT 6958 52.931 24.906 119.808 1.00 0.00 H TER 37513 WAT 6958 ATOM 37513 O WAT 6959 4.187 13.099 154.723 1.00 0.00 O ATOM 37514 H1 WAT 6959 3.601 12.352 154.840 1.00 0.00 H ATOM 37515 H2 WAT 6959 3.983 13.429 153.849 1.00 0.00 H TER 37517 WAT 6959 ATOM 37517 O WAT 6960 46.594 6.404 99.697 1.00 0.00 O ATOM 37518 H1 WAT 6960 47.226 6.231 99.000 1.00 0.00 H ATOM 37519 H2 WAT 6960 46.540 7.359 99.741 1.00 0.00 H TER 37521 WAT 6960 ATOM 37521 O WAT 6961 134.092 101.703 142.768 1.00 0.00 O ATOM 37522 H1 WAT 6961 134.546 101.275 142.042 1.00 0.00 H ATOM 37523 H2 WAT 6961 134.223 102.638 142.616 1.00 0.00 H TER 37525 WAT 6961 ATOM 37525 O WAT 6962 14.183 12.627 102.459 1.00 0.00 O ATOM 37526 H1 WAT 6962 14.988 12.918 102.887 1.00 0.00 H ATOM 37527 H2 WAT 6962 14.385 11.746 102.143 1.00 0.00 H TER 37529 WAT 6962 ATOM 37529 O WAT 6963 54.410 88.541 11.050 1.00 0.00 O ATOM 37530 H1 WAT 6963 54.262 88.092 11.883 1.00 0.00 H ATOM 37531 H2 WAT 6963 53.684 89.160 10.979 1.00 0.00 H TER 37533 WAT 6963 ATOM 37533 O WAT 6964 128.665 76.560 137.270 1.00 0.00 O ATOM 37534 H1 WAT 6964 127.866 76.239 137.689 1.00 0.00 H ATOM 37535 H2 WAT 6964 128.377 76.872 136.412 1.00 0.00 H TER 37537 WAT 6964 ATOM 37537 O WAT 6965 47.915 47.933 97.813 1.00 0.00 O ATOM 37538 H1 WAT 6965 47.876 47.529 96.946 1.00 0.00 H ATOM 37539 H2 WAT 6965 47.446 48.762 97.712 1.00 0.00 H TER 37541 WAT 6965 ATOM 37541 O WAT 6966 136.972 29.400 121.107 1.00 0.00 O ATOM 37542 H1 WAT 6966 136.825 30.307 121.373 1.00 0.00 H ATOM 37543 H2 WAT 6966 137.426 29.002 121.849 1.00 0.00 H TER 37545 WAT 6966 ATOM 37545 O WAT 6967 118.835 12.710 78.152 1.00 0.00 O ATOM 37546 H1 WAT 6967 118.025 12.418 77.734 1.00 0.00 H ATOM 37547 H2 WAT 6967 119.255 11.902 78.449 1.00 0.00 H TER 37549 WAT 6967 ATOM 37549 O WAT 6968 102.682 144.932 93.481 1.00 0.00 O ATOM 37550 H1 WAT 6968 102.115 145.688 93.630 1.00 0.00 H ATOM 37551 H2 WAT 6968 102.343 144.533 92.679 1.00 0.00 H TER 37553 WAT 6968 ATOM 37553 O WAT 6969 49.185 84.078 149.719 1.00 0.00 O ATOM 37554 H1 WAT 6969 49.154 83.573 148.906 1.00 0.00 H ATOM 37555 H2 WAT 6969 49.763 83.574 150.292 1.00 0.00 H TER 37557 WAT 6969 ATOM 37557 O WAT 6970 52.606 7.999 98.208 1.00 0.00 O ATOM 37558 H1 WAT 6970 52.011 7.734 98.909 1.00 0.00 H ATOM 37559 H2 WAT 6970 52.284 7.538 97.433 1.00 0.00 H TER 37561 WAT 6970 ATOM 37561 O WAT 6971 66.324 34.930 1.124 1.00 0.00 O ATOM 37562 H1 WAT 6971 67.273 34.996 1.236 1.00 0.00 H ATOM 37563 H2 WAT 6971 66.194 34.098 0.668 1.00 0.00 H TER 37565 WAT 6971 ATOM 37565 O WAT 6972 102.273 3.395 61.706 1.00 0.00 O ATOM 37566 H1 WAT 6972 101.770 3.734 60.965 1.00 0.00 H ATOM 37567 H2 WAT 6972 102.984 2.896 61.305 1.00 0.00 H TER 37569 WAT 6972 ATOM 37569 O WAT 6973 124.327 44.944 73.354 1.00 0.00 O ATOM 37570 H1 WAT 6973 124.675 44.941 72.462 1.00 0.00 H ATOM 37571 H2 WAT 6973 125.034 44.582 73.888 1.00 0.00 H TER 37573 WAT 6973 ATOM 37573 O WAT 6974 9.903 12.509 100.854 1.00 0.00 O ATOM 37574 H1 WAT 6974 9.096 12.722 100.385 1.00 0.00 H ATOM 37575 H2 WAT 6974 9.896 13.088 101.616 1.00 0.00 H TER 37577 WAT 6974 ATOM 37577 O WAT 6975 113.125 108.226 26.203 1.00 0.00 O ATOM 37578 H1 WAT 6975 112.945 108.834 26.921 1.00 0.00 H ATOM 37579 H2 WAT 6975 112.531 108.499 25.504 1.00 0.00 H TER 37581 WAT 6975 ATOM 37581 O WAT 6976 41.404 103.206 62.619 1.00 0.00 O ATOM 37582 H1 WAT 6976 42.160 102.648 62.803 1.00 0.00 H ATOM 37583 H2 WAT 6976 41.774 103.975 62.185 1.00 0.00 H TER 37585 WAT 6976 ATOM 37585 O WAT 6977 48.202 102.427 120.841 1.00 0.00 O ATOM 37586 H1 WAT 6977 47.720 102.372 121.666 1.00 0.00 H ATOM 37587 H2 WAT 6977 48.846 101.720 120.892 1.00 0.00 H TER 37589 WAT 6977 ATOM 37589 O WAT 6978 67.707 18.681 76.809 1.00 0.00 O ATOM 37590 H1 WAT 6978 68.460 19.091 77.234 1.00 0.00 H ATOM 37591 H2 WAT 6978 67.466 19.288 76.110 1.00 0.00 H TER 37593 WAT 6978 ATOM 37593 O WAT 6979 55.266 36.116 123.968 1.00 0.00 O ATOM 37594 H1 WAT 6979 54.382 36.282 123.641 1.00 0.00 H ATOM 37595 H2 WAT 6979 55.263 36.470 124.857 1.00 0.00 H TER 37597 WAT 6979 ATOM 37597 O WAT 6980 90.652 51.494 58.241 1.00 0.00 O ATOM 37598 H1 WAT 6980 89.774 51.741 57.950 1.00 0.00 H ATOM 37599 H2 WAT 6980 91.230 52.135 57.827 1.00 0.00 H TER 37601 WAT 6980 ATOM 37601 O WAT 6981 85.674 37.042 92.782 1.00 0.00 O ATOM 37602 H1 WAT 6981 84.798 36.735 93.016 1.00 0.00 H ATOM 37603 H2 WAT 6981 85.531 37.636 92.045 1.00 0.00 H TER 37605 WAT 6981 ATOM 37605 O WAT 6982 117.792 94.848 141.787 1.00 0.00 O ATOM 37606 H1 WAT 6982 118.013 95.281 140.963 1.00 0.00 H ATOM 37607 H2 WAT 6982 118.605 94.421 142.058 1.00 0.00 H TER 37609 WAT 6982 ATOM 37609 O WAT 6983 41.817 143.235 156.592 1.00 0.00 O ATOM 37610 H1 WAT 6983 42.515 143.506 155.995 1.00 0.00 H ATOM 37611 H2 WAT 6983 41.554 144.042 157.035 1.00 0.00 H TER 37613 WAT 6983 ATOM 37613 O WAT 6984 101.288 2.063 137.466 1.00 0.00 O ATOM 37614 H1 WAT 6984 100.866 2.033 138.325 1.00 0.00 H ATOM 37615 H2 WAT 6984 101.368 1.145 137.207 1.00 0.00 H TER 37617 WAT 6984 ATOM 37617 O WAT 6985 12.069 137.702 141.295 1.00 0.00 O ATOM 37618 H1 WAT 6985 11.126 137.558 141.217 1.00 0.00 H ATOM 37619 H2 WAT 6985 12.443 137.255 140.535 1.00 0.00 H TER 37621 WAT 6985 ATOM 37621 O WAT 6986 5.712 89.013 119.625 1.00 0.00 O ATOM 37622 H1 WAT 6986 6.664 89.061 119.712 1.00 0.00 H ATOM 37623 H2 WAT 6986 5.378 89.521 120.364 1.00 0.00 H TER 37625 WAT 6986 ATOM 37625 O WAT 6987 91.759 124.801 90.710 1.00 0.00 O ATOM 37626 H1 WAT 6987 92.089 124.143 91.321 1.00 0.00 H ATOM 37627 H2 WAT 6987 91.040 125.224 91.178 1.00 0.00 H TER 37629 WAT 6987 ATOM 37629 O WAT 6988 68.683 49.860 69.078 1.00 0.00 O ATOM 37630 H1 WAT 6988 68.895 50.102 69.980 1.00 0.00 H ATOM 37631 H2 WAT 6988 68.062 50.529 68.791 1.00 0.00 H TER 37633 WAT 6988 ATOM 37633 O WAT 6989 78.674 94.485 10.781 1.00 0.00 O ATOM 37634 H1 WAT 6989 78.202 95.261 10.479 1.00 0.00 H ATOM 37635 H2 WAT 6989 77.996 93.922 11.153 1.00 0.00 H TER 37637 WAT 6989 ATOM 37637 O WAT 6990 67.130 3.023 135.939 1.00 0.00 O ATOM 37638 H1 WAT 6990 67.428 2.288 136.475 1.00 0.00 H ATOM 37639 H2 WAT 6990 67.771 3.715 136.104 1.00 0.00 H TER 37641 WAT 6990 ATOM 37641 O WAT 6991 77.087 89.085 7.674 1.00 0.00 O ATOM 37642 H1 WAT 6991 76.243 89.281 8.081 1.00 0.00 H ATOM 37643 H2 WAT 6991 76.874 88.899 6.759 1.00 0.00 H TER 37645 WAT 6991 ATOM 37645 O WAT 6992 116.644 69.849 131.832 1.00 0.00 O ATOM 37646 H1 WAT 6992 117.158 69.042 131.816 1.00 0.00 H ATOM 37647 H2 WAT 6992 116.345 69.960 130.929 1.00 0.00 H TER 37649 WAT 6992 ATOM 37649 O WAT 6993 112.666 80.933 75.592 1.00 0.00 O ATOM 37650 H1 WAT 6993 112.380 80.943 76.505 1.00 0.00 H ATOM 37651 H2 WAT 6993 112.825 80.008 75.401 1.00 0.00 H TER 37653 WAT 6993 ATOM 37653 O WAT 6994 93.142 90.608 101.933 1.00 0.00 O ATOM 37654 H1 WAT 6994 93.220 90.346 102.851 1.00 0.00 H ATOM 37655 H2 WAT 6994 94.027 90.876 101.685 1.00 0.00 H TER 37657 WAT 6994 ATOM 37657 O WAT 6995 70.432 66.115 116.770 1.00 0.00 O ATOM 37658 H1 WAT 6995 70.651 65.222 116.503 1.00 0.00 H ATOM 37659 H2 WAT 6995 69.982 66.487 116.012 1.00 0.00 H TER 37661 WAT 6995 ATOM 37661 O WAT 6996 51.833 81.451 98.466 1.00 0.00 O ATOM 37662 H1 WAT 6996 52.426 80.972 99.044 1.00 0.00 H ATOM 37663 H2 WAT 6996 51.100 80.852 98.325 1.00 0.00 H TER 37665 WAT 6996 ATOM 37665 O WAT 6997 124.275 12.410 125.899 1.00 0.00 O ATOM 37666 H1 WAT 6997 123.820 11.720 125.416 1.00 0.00 H ATOM 37667 H2 WAT 6997 124.376 12.057 126.783 1.00 0.00 H TER 37669 WAT 6997 ATOM 37669 O WAT 6998 94.994 79.397 97.813 1.00 0.00 O ATOM 37670 H1 WAT 6998 94.842 78.453 97.789 1.00 0.00 H ATOM 37671 H2 WAT 6998 94.971 79.667 96.895 1.00 0.00 H TER 37673 WAT 6998 ATOM 37673 O WAT 6999 23.707 70.582 72.158 1.00 0.00 O ATOM 37674 H1 WAT 6999 24.527 70.917 71.795 1.00 0.00 H ATOM 37675 H2 WAT 6999 23.980 69.987 72.857 1.00 0.00 H TER 37677 WAT 6999 ATOM 37677 O WAT 7000 86.494 51.685 95.296 1.00 0.00 O ATOM 37678 H1 WAT 7000 86.945 52.529 95.255 1.00 0.00 H ATOM 37679 H2 WAT 7000 86.470 51.382 94.388 1.00 0.00 H TER 37681 WAT 7000 ATOM 37681 O WAT 7001 79.469 49.081 104.987 1.00 0.00 O ATOM 37682 H1 WAT 7001 79.622 48.729 105.864 1.00 0.00 H ATOM 37683 H2 WAT 7001 79.085 49.944 105.138 1.00 0.00 H TER 37685 WAT 7001 ATOM 37685 O WAT 7002 52.534 3.149 6.405 1.00 0.00 O ATOM 37686 H1 WAT 7002 52.007 2.942 7.178 1.00 0.00 H ATOM 37687 H2 WAT 7002 51.923 3.579 5.807 1.00 0.00 H TER 37689 WAT 7002 ATOM 37689 O WAT 7003 44.700 106.132 99.013 1.00 0.00 O ATOM 37690 H1 WAT 7003 44.945 106.761 98.334 1.00 0.00 H ATOM 37691 H2 WAT 7003 45.228 106.381 99.772 1.00 0.00 H TER 37693 WAT 7003 ATOM 37693 O WAT 7004 145.119 56.767 123.923 1.00 0.00 O ATOM 37694 H1 WAT 7004 145.351 56.195 124.655 1.00 0.00 H ATOM 37695 H2 WAT 7004 145.393 56.282 123.145 1.00 0.00 H TER 37697 WAT 7004 ATOM 37697 O WAT 7005 22.980 92.160 84.718 1.00 0.00 O ATOM 37698 H1 WAT 7005 22.739 91.235 84.762 1.00 0.00 H ATOM 37699 H2 WAT 7005 23.831 92.206 85.153 1.00 0.00 H TER 37701 WAT 7005 ATOM 37701 O WAT 7006 68.168 145.517 11.389 1.00 0.00 O ATOM 37702 H1 WAT 7006 68.700 144.735 11.536 1.00 0.00 H ATOM 37703 H2 WAT 7006 68.435 145.829 10.525 1.00 0.00 H TER 37705 WAT 7006 ATOM 37705 O WAT 7007 29.602 119.811 85.164 1.00 0.00 O ATOM 37706 H1 WAT 7007 29.780 120.613 84.673 1.00 0.00 H ATOM 37707 H2 WAT 7007 30.022 119.952 86.013 1.00 0.00 H TER 37709 WAT 7007 ATOM 37709 O WAT 7008 109.581 113.421 157.970 1.00 0.00 O ATOM 37710 H1 WAT 7008 109.834 112.687 158.530 1.00 0.00 H ATOM 37711 H2 WAT 7008 110.051 113.270 157.150 1.00 0.00 H TER 37713 WAT 7008 ATOM 37713 O WAT 7009 54.133 8.915 116.518 1.00 0.00 O ATOM 37714 H1 WAT 7009 55.023 8.730 116.220 1.00 0.00 H ATOM 37715 H2 WAT 7009 53.747 9.435 115.813 1.00 0.00 H TER 37717 WAT 7009 ATOM 37717 O WAT 7010 64.715 137.752 89.471 1.00 0.00 O ATOM 37718 H1 WAT 7010 65.021 137.256 88.711 1.00 0.00 H ATOM 37719 H2 WAT 7010 64.470 137.083 90.110 1.00 0.00 H TER 37721 WAT 7010 ATOM 37721 O WAT 7011 142.926 114.527 99.647 1.00 0.00 O ATOM 37722 H1 WAT 7011 142.479 115.370 99.716 1.00 0.00 H ATOM 37723 H2 WAT 7011 143.033 114.237 100.553 1.00 0.00 H TER 37725 WAT 7011 ATOM 37725 O WAT 7012 50.454 122.124 85.328 1.00 0.00 O ATOM 37726 H1 WAT 7012 50.151 123.030 85.270 1.00 0.00 H ATOM 37727 H2 WAT 7012 50.139 121.714 84.522 1.00 0.00 H TER 37729 WAT 7012 ATOM 37729 O WAT 7013 24.878 112.948 70.274 1.00 0.00 O ATOM 37730 H1 WAT 7013 25.497 112.964 71.004 1.00 0.00 H ATOM 37731 H2 WAT 7013 24.317 112.194 70.453 1.00 0.00 H TER 37733 WAT 7013 ATOM 37733 O WAT 7014 5.297 126.041 138.896 1.00 0.00 O ATOM 37734 H1 WAT 7014 5.883 125.284 138.918 1.00 0.00 H ATOM 37735 H2 WAT 7014 5.246 126.277 137.970 1.00 0.00 H TER 37737 WAT 7014 ATOM 37737 O WAT 7015 21.886 1.144 156.200 1.00 0.00 O ATOM 37738 H1 WAT 7015 22.020 0.473 155.531 1.00 0.00 H ATOM 37739 H2 WAT 7015 22.566 0.973 156.851 1.00 0.00 H TER 37741 WAT 7015 ATOM 37741 O WAT 7016 75.193 23.111 122.516 1.00 0.00 O ATOM 37742 H1 WAT 7016 75.157 23.538 121.660 1.00 0.00 H ATOM 37743 H2 WAT 7016 75.891 22.462 122.431 1.00 0.00 H TER 37745 WAT 7016 ATOM 37745 O WAT 7017 141.669 86.105 144.426 1.00 0.00 O ATOM 37746 H1 WAT 7017 141.278 86.010 145.295 1.00 0.00 H ATOM 37747 H2 WAT 7017 140.923 86.093 143.826 1.00 0.00 H TER 37749 WAT 7017 ATOM 37749 O WAT 7018 19.299 96.267 128.042 1.00 0.00 O ATOM 37750 H1 WAT 7018 19.912 96.237 127.308 1.00 0.00 H ATOM 37751 H2 WAT 7018 19.707 96.862 128.671 1.00 0.00 H TER 37753 WAT 7018 ATOM 37753 O WAT 7019 125.095 38.640 54.140 1.00 0.00 O ATOM 37754 H1 WAT 7019 125.891 38.110 54.185 1.00 0.00 H ATOM 37755 H2 WAT 7019 124.902 38.859 55.051 1.00 0.00 H TER 37757 WAT 7019 ATOM 37757 O WAT 7020 45.124 86.682 134.681 1.00 0.00 O ATOM 37758 H1 WAT 7020 45.480 87.488 135.057 1.00 0.00 H ATOM 37759 H2 WAT 7020 45.895 86.151 134.481 1.00 0.00 H TER 37761 WAT 7020 ATOM 37761 O WAT 7021 8.071 105.888 6.317 1.00 0.00 O ATOM 37762 H1 WAT 7021 7.423 106.442 5.882 1.00 0.00 H ATOM 37763 H2 WAT 7021 8.621 105.559 5.606 1.00 0.00 H TER 37765 WAT 7021 ATOM 37765 O WAT 7022 77.746 121.270 58.944 1.00 0.00 O ATOM 37766 H1 WAT 7022 78.613 121.324 59.346 1.00 0.00 H ATOM 37767 H2 WAT 7022 77.556 122.166 58.665 1.00 0.00 H TER 37769 WAT 7022 ATOM 37769 O WAT 7023 32.856 23.757 6.556 1.00 0.00 O ATOM 37770 H1 WAT 7023 32.866 23.303 7.398 1.00 0.00 H ATOM 37771 H2 WAT 7023 32.378 23.168 5.972 1.00 0.00 H TER 37773 WAT 7023 ATOM 37773 O WAT 7024 69.938 23.535 114.192 1.00 0.00 O ATOM 37774 H1 WAT 7024 70.785 23.939 114.003 1.00 0.00 H ATOM 37775 H2 WAT 7024 69.305 24.244 114.080 1.00 0.00 H TER 37777 WAT 7024 ATOM 37777 O WAT 7025 93.340 38.904 141.453 1.00 0.00 O ATOM 37778 H1 WAT 7025 93.952 38.328 141.911 1.00 0.00 H ATOM 37779 H2 WAT 7025 92.540 38.386 141.369 1.00 0.00 H TER 37781 WAT 7025 ATOM 37781 O WAT 7026 79.483 118.518 149.134 1.00 0.00 O ATOM 37782 H1 WAT 7026 79.065 118.859 148.344 1.00 0.00 H ATOM 37783 H2 WAT 7026 78.966 118.881 149.854 1.00 0.00 H TER 37785 WAT 7026 ATOM 37785 O WAT 7027 122.238 77.494 135.552 1.00 0.00 O ATOM 37786 H1 WAT 7027 121.909 77.102 134.744 1.00 0.00 H ATOM 37787 H2 WAT 7027 121.603 78.179 135.762 1.00 0.00 H TER 37789 WAT 7027 ATOM 37789 O WAT 7028 0.423 119.748 12.051 1.00 0.00 O ATOM 37790 H1 WAT 7028 0.172 118.824 12.047 1.00 0.00 H ATOM 37791 H2 WAT 7028 0.229 120.052 11.165 1.00 0.00 H TER 37793 WAT 7028 ATOM 37793 O WAT 7029 98.452 120.876 8.697 1.00 0.00 O ATOM 37794 H1 WAT 7029 98.961 120.321 8.106 1.00 0.00 H ATOM 37795 H2 WAT 7029 98.786 120.667 9.569 1.00 0.00 H TER 37797 WAT 7029 ATOM 37797 O WAT 7030 53.685 70.445 22.649 1.00 0.00 O ATOM 37798 H1 WAT 7030 54.525 70.902 22.598 1.00 0.00 H ATOM 37799 H2 WAT 7030 53.540 70.313 23.586 1.00 0.00 H TER 37801 WAT 7030 ATOM 37801 O WAT 7031 29.650 43.899 103.143 1.00 0.00 O ATOM 37802 H1 WAT 7031 29.047 43.702 103.860 1.00 0.00 H ATOM 37803 H2 WAT 7031 29.799 44.843 103.208 1.00 0.00 H TER 37805 WAT 7031 ATOM 37805 O WAT 7032 82.937 38.983 151.015 1.00 0.00 O ATOM 37806 H1 WAT 7032 82.281 38.306 151.187 1.00 0.00 H ATOM 37807 H2 WAT 7032 82.621 39.749 151.493 1.00 0.00 H TER 37809 WAT 7032 ATOM 37809 O WAT 7033 102.063 109.186 68.353 1.00 0.00 O ATOM 37810 H1 WAT 7033 101.496 108.415 68.335 1.00 0.00 H ATOM 37811 H2 WAT 7033 102.865 108.905 67.912 1.00 0.00 H TER 37813 WAT 7033 ATOM 37813 O WAT 7034 93.148 97.991 97.298 1.00 0.00 O ATOM 37814 H1 WAT 7034 93.365 98.457 98.106 1.00 0.00 H ATOM 37815 H2 WAT 7034 93.889 97.403 97.154 1.00 0.00 H TER 37817 WAT 7034 ATOM 37817 O WAT 7035 35.178 49.010 137.795 1.00 0.00 O ATOM 37818 H1 WAT 7035 35.262 48.386 137.074 1.00 0.00 H ATOM 37819 H2 WAT 7035 34.521 49.638 137.494 1.00 0.00 H TER 37821 WAT 7035 ATOM 37821 O WAT 7036 112.413 96.943 116.582 1.00 0.00 O ATOM 37822 H1 WAT 7036 113.330 96.669 116.581 1.00 0.00 H ATOM 37823 H2 WAT 7036 112.388 97.697 117.171 1.00 0.00 H TER 37825 WAT 7036 ATOM 37825 O WAT 7037 132.502 118.561 79.604 1.00 0.00 O ATOM 37826 H1 WAT 7037 132.030 118.596 78.772 1.00 0.00 H ATOM 37827 H2 WAT 7037 132.008 117.935 80.134 1.00 0.00 H TER 37829 WAT 7037 ATOM 37829 O WAT 7038 96.163 16.882 112.025 1.00 0.00 O ATOM 37830 H1 WAT 7038 96.368 16.967 111.094 1.00 0.00 H ATOM 37831 H2 WAT 7038 95.448 16.245 112.055 1.00 0.00 H TER 37833 WAT 7038 ATOM 37833 O WAT 7039 115.961 132.590 142.252 1.00 0.00 O ATOM 37834 H1 WAT 7039 115.741 131.778 141.796 1.00 0.00 H ATOM 37835 H2 WAT 7039 116.742 132.374 142.761 1.00 0.00 H TER 37837 WAT 7039 ATOM 37837 O WAT 7040 28.858 69.361 76.900 1.00 0.00 O ATOM 37838 H1 WAT 7040 29.164 68.663 76.320 1.00 0.00 H ATOM 37839 H2 WAT 7040 29.579 69.493 77.516 1.00 0.00 H TER 37841 WAT 7040 ATOM 37841 O WAT 7041 29.646 23.967 88.564 1.00 0.00 O ATOM 37842 H1 WAT 7041 29.796 24.904 88.439 1.00 0.00 H ATOM 37843 H2 WAT 7041 30.197 23.734 89.312 1.00 0.00 H TER 37845 WAT 7041 ATOM 37845 O WAT 7042 38.450 121.745 150.382 1.00 0.00 O ATOM 37846 H1 WAT 7042 38.097 122.540 150.780 1.00 0.00 H ATOM 37847 H2 WAT 7042 39.249 121.564 150.877 1.00 0.00 H TER 37849 WAT 7042 ATOM 37849 O WAT 7043 88.825 8.512 8.432 1.00 0.00 O ATOM 37850 H1 WAT 7043 88.367 7.732 8.120 1.00 0.00 H ATOM 37851 H2 WAT 7043 88.168 9.207 8.392 1.00 0.00 H TER 37853 WAT 7043 ATOM 37853 O WAT 7044 3.685 96.626 138.097 1.00 0.00 O ATOM 37854 H1 WAT 7044 3.345 96.683 137.204 1.00 0.00 H ATOM 37855 H2 WAT 7044 3.212 97.305 138.578 1.00 0.00 H TER 37857 WAT 7044 ATOM 37857 O WAT 7045 56.269 113.501 17.313 1.00 0.00 O ATOM 37858 H1 WAT 7045 55.500 113.005 17.593 1.00 0.00 H ATOM 37859 H2 WAT 7045 56.804 113.581 18.103 1.00 0.00 H TER 37861 WAT 7045 ATOM 37861 O WAT 7046 102.351 89.436 126.903 1.00 0.00 O ATOM 37862 H1 WAT 7046 101.648 88.807 126.740 1.00 0.00 H ATOM 37863 H2 WAT 7046 102.252 89.672 127.825 1.00 0.00 H TER 37865 WAT 7046 ATOM 37865 O WAT 7047 9.398 8.402 87.789 1.00 0.00 O ATOM 37866 H1 WAT 7047 10.077 7.799 87.486 1.00 0.00 H ATOM 37867 H2 WAT 7047 8.594 8.083 87.381 1.00 0.00 H TER 37869 WAT 7047 ATOM 37869 O WAT 7048 79.608 35.499 78.050 1.00 0.00 O ATOM 37870 H1 WAT 7048 78.797 35.944 77.804 1.00 0.00 H ATOM 37871 H2 WAT 7048 79.337 34.843 78.691 1.00 0.00 H TER 37873 WAT 7048 ATOM 37873 O WAT 7049 41.398 10.911 89.362 1.00 0.00 O ATOM 37874 H1 WAT 7049 41.291 10.987 90.310 1.00 0.00 H ATOM 37875 H2 WAT 7049 42.337 11.026 89.218 1.00 0.00 H TER 37877 WAT 7049 ATOM 37877 O WAT 7050 86.782 91.708 25.199 1.00 0.00 O ATOM 37878 H1 WAT 7050 86.170 92.328 25.595 1.00 0.00 H ATOM 37879 H2 WAT 7050 86.350 90.858 25.286 1.00 0.00 H TER 37881 WAT 7050 ATOM 37881 O WAT 7051 100.570 134.820 74.423 1.00 0.00 O ATOM 37882 H1 WAT 7051 101.392 135.239 74.168 1.00 0.00 H ATOM 37883 H2 WAT 7051 100.060 135.520 74.831 1.00 0.00 H TER 37885 WAT 7051 ATOM 37885 O WAT 7052 84.703 107.522 66.522 1.00 0.00 O ATOM 37886 H1 WAT 7052 84.131 108.278 66.658 1.00 0.00 H ATOM 37887 H2 WAT 7052 85.539 107.782 66.908 1.00 0.00 H TER 37889 WAT 7052 ATOM 37889 O WAT 7053 52.562 17.019 77.291 1.00 0.00 O ATOM 37890 H1 WAT 7053 52.020 16.446 77.834 1.00 0.00 H ATOM 37891 H2 WAT 7053 53.168 17.430 77.908 1.00 0.00 H TER 37893 WAT 7053 ATOM 37893 O WAT 7054 108.381 19.266 5.149 1.00 0.00 O ATOM 37894 H1 WAT 7054 108.944 19.005 4.420 1.00 0.00 H ATOM 37895 H2 WAT 7054 108.936 19.828 5.690 1.00 0.00 H TER 37897 WAT 7054 ATOM 37897 O WAT 7055 129.038 35.378 15.273 1.00 0.00 O ATOM 37898 H1 WAT 7055 128.936 36.329 15.229 1.00 0.00 H ATOM 37899 H2 WAT 7055 128.348 35.037 14.704 1.00 0.00 H TER 37901 WAT 7055 ATOM 37901 O WAT 7056 87.784 78.933 25.099 1.00 0.00 O ATOM 37902 H1 WAT 7056 86.966 78.618 25.482 1.00 0.00 H ATOM 37903 H2 WAT 7056 88.029 78.256 24.468 1.00 0.00 H TER 37905 WAT 7056 ATOM 37905 O WAT 7057 67.926 59.728 67.497 1.00 0.00 O ATOM 37906 H1 WAT 7057 67.776 59.965 66.582 1.00 0.00 H ATOM 37907 H2 WAT 7057 67.659 60.502 67.992 1.00 0.00 H TER 37909 WAT 7057 ATOM 37909 O WAT 7058 30.344 107.675 157.385 1.00 0.00 O ATOM 37910 H1 WAT 7058 30.633 107.855 156.490 1.00 0.00 H ATOM 37911 H2 WAT 7058 29.819 108.439 157.625 1.00 0.00 H TER 37913 WAT 7058 ATOM 37913 O WAT 7059 16.867 45.955 152.554 1.00 0.00 O ATOM 37914 H1 WAT 7059 17.379 46.392 151.873 1.00 0.00 H ATOM 37915 H2 WAT 7059 17.396 46.047 153.347 1.00 0.00 H TER 37917 WAT 7059 ATOM 37917 O WAT 7060 89.546 39.419 83.742 1.00 0.00 O ATOM 37918 H1 WAT 7060 89.822 39.033 84.573 1.00 0.00 H ATOM 37919 H2 WAT 7060 88.609 39.581 83.852 1.00 0.00 H TER 37921 WAT 7060 ATOM 37921 O WAT 7061 139.336 1.293 102.062 1.00 0.00 O ATOM 37922 H1 WAT 7061 140.169 1.726 102.246 1.00 0.00 H ATOM 37923 H2 WAT 7061 139.482 0.379 102.307 1.00 0.00 H TER 37925 WAT 7061 ATOM 37925 O WAT 7062 8.083 120.430 140.931 1.00 0.00 O ATOM 37926 H1 WAT 7062 7.524 120.780 140.238 1.00 0.00 H ATOM 37927 H2 WAT 7062 7.565 120.530 141.730 1.00 0.00 H TER 37929 WAT 7062 ATOM 37929 O WAT 7063 90.665 105.496 8.287 1.00 0.00 O ATOM 37930 H1 WAT 7063 89.724 105.662 8.342 1.00 0.00 H ATOM 37931 H2 WAT 7063 91.004 105.759 9.143 1.00 0.00 H TER 37933 WAT 7063 ATOM 37933 O WAT 7064 92.869 72.707 151.443 1.00 0.00 O ATOM 37934 H1 WAT 7064 92.704 73.334 150.738 1.00 0.00 H ATOM 37935 H2 WAT 7064 93.481 72.076 151.064 1.00 0.00 H TER 37937 WAT 7064 ATOM 37937 O WAT 7065 29.572 128.166 16.708 1.00 0.00 O ATOM 37938 H1 WAT 7065 30.497 128.052 16.489 1.00 0.00 H ATOM 37939 H2 WAT 7065 29.547 128.139 17.664 1.00 0.00 H TER 37941 WAT 7065 ATOM 37941 O WAT 7066 13.666 136.768 64.830 1.00 0.00 O ATOM 37942 H1 WAT 7066 13.660 136.279 64.007 1.00 0.00 H ATOM 37943 H2 WAT 7066 13.258 136.177 65.463 1.00 0.00 H TER 37945 WAT 7066 ATOM 37945 O WAT 7067 88.690 50.723 103.952 1.00 0.00 O ATOM 37946 H1 WAT 7067 88.947 50.257 104.748 1.00 0.00 H ATOM 37947 H2 WAT 7067 89.311 51.448 103.888 1.00 0.00 H TER 37949 WAT 7067 ATOM 37949 O WAT 7068 21.155 29.240 93.748 1.00 0.00 O ATOM 37950 H1 WAT 7068 21.723 29.132 94.511 1.00 0.00 H ATOM 37951 H2 WAT 7068 20.884 28.350 93.523 1.00 0.00 H TER 37953 WAT 7068 ATOM 37953 O WAT 7069 22.768 19.474 151.249 1.00 0.00 O ATOM 37954 H1 WAT 7069 23.107 18.587 151.370 1.00 0.00 H ATOM 37955 H2 WAT 7069 22.031 19.533 151.857 1.00 0.00 H TER 37957 WAT 7069 ATOM 37957 O WAT 7070 84.407 35.800 152.873 1.00 0.00 O ATOM 37958 H1 WAT 7070 83.777 36.055 153.547 1.00 0.00 H ATOM 37959 H2 WAT 7070 84.692 36.628 152.486 1.00 0.00 H TER 37961 WAT 7070 ATOM 37961 O WAT 7071 115.834 127.749 146.050 1.00 0.00 O ATOM 37962 H1 WAT 7071 115.146 128.337 146.361 1.00 0.00 H ATOM 37963 H2 WAT 7071 116.271 127.449 146.848 1.00 0.00 H TER 37965 WAT 7071 ATOM 37965 O WAT 7072 125.642 119.247 139.448 1.00 0.00 O ATOM 37966 H1 WAT 7072 125.049 119.360 138.705 1.00 0.00 H ATOM 37967 H2 WAT 7072 126.376 119.831 139.259 1.00 0.00 H TER 37969 WAT 7072 ATOM 37969 O WAT 7073 70.089 92.885 82.732 1.00 0.00 O ATOM 37970 H1 WAT 7073 69.500 92.802 81.983 1.00 0.00 H ATOM 37971 H2 WAT 7073 69.618 93.447 83.347 1.00 0.00 H TER 37973 WAT 7073 ATOM 37973 O WAT 7074 131.271 19.912 87.136 1.00 0.00 O ATOM 37974 H1 WAT 7074 132.170 20.217 87.256 1.00 0.00 H ATOM 37975 H2 WAT 7074 130.996 19.627 88.008 1.00 0.00 H TER 37977 WAT 7074 ATOM 37977 O WAT 7075 16.297 73.783 87.194 1.00 0.00 O ATOM 37978 H1 WAT 7075 15.375 73.545 87.098 1.00 0.00 H ATOM 37979 H2 WAT 7075 16.321 74.723 87.015 1.00 0.00 H TER 37981 WAT 7075 ATOM 37981 O WAT 7076 60.595 84.512 145.726 1.00 0.00 O ATOM 37982 H1 WAT 7076 61.025 84.448 146.579 1.00 0.00 H ATOM 37983 H2 WAT 7076 59.660 84.533 145.929 1.00 0.00 H TER 37985 WAT 7076 ATOM 37985 O WAT 7077 131.165 143.712 142.504 1.00 0.00 O ATOM 37986 H1 WAT 7077 130.213 143.647 142.426 1.00 0.00 H ATOM 37987 H2 WAT 7077 131.315 143.953 143.418 1.00 0.00 H TER 37989 WAT 7077 ATOM 37989 O WAT 7078 120.314 65.493 103.061 1.00 0.00 O ATOM 37990 H1 WAT 7078 119.395 65.453 102.798 1.00 0.00 H ATOM 37991 H2 WAT 7078 120.791 65.643 102.245 1.00 0.00 H TER 37993 WAT 7078 ATOM 37993 O WAT 7079 57.517 122.457 14.343 1.00 0.00 O ATOM 37994 H1 WAT 7079 56.976 121.847 14.846 1.00 0.00 H ATOM 37995 H2 WAT 7079 57.997 121.902 13.729 1.00 0.00 H TER 37997 WAT 7079 ATOM 37997 O WAT 7080 61.875 85.564 5.601 1.00 0.00 O ATOM 37998 H1 WAT 7080 61.392 86.343 5.878 1.00 0.00 H ATOM 37999 H2 WAT 7080 62.702 85.611 6.080 1.00 0.00 H TER 38001 WAT 7080 ATOM 38001 O WAT 7081 33.510 37.341 84.324 1.00 0.00 O ATOM 38002 H1 WAT 7081 33.095 37.473 83.472 1.00 0.00 H ATOM 38003 H2 WAT 7081 32.790 37.098 84.907 1.00 0.00 H TER 38005 WAT 7081 ATOM 38005 O WAT 7082 87.307 8.866 153.981 1.00 0.00 O ATOM 38006 H1 WAT 7082 87.507 8.042 154.426 1.00 0.00 H ATOM 38007 H2 WAT 7082 87.026 8.603 153.105 1.00 0.00 H TER 38009 WAT 7082 ATOM 38009 O WAT 7083 49.304 58.573 114.224 1.00 0.00 O ATOM 38010 H1 WAT 7083 49.558 57.769 113.771 1.00 0.00 H ATOM 38011 H2 WAT 7083 50.041 58.764 114.805 1.00 0.00 H TER 38013 WAT 7083 ATOM 38013 O WAT 7084 109.942 54.571 109.535 1.00 0.00 O ATOM 38014 H1 WAT 7084 109.228 53.934 109.499 1.00 0.00 H ATOM 38015 H2 WAT 7084 110.452 54.316 110.304 1.00 0.00 H TER 38017 WAT 7084 ATOM 38017 O WAT 7085 63.640 2.388 89.307 1.00 0.00 O ATOM 38018 H1 WAT 7085 63.224 3.232 89.128 1.00 0.00 H ATOM 38019 H2 WAT 7085 63.808 2.015 88.442 1.00 0.00 H TER 38021 WAT 7085 ATOM 38021 O WAT 7086 78.074 144.800 4.101 1.00 0.00 O ATOM 38022 H1 WAT 7086 77.810 143.896 3.929 1.00 0.00 H ATOM 38023 H2 WAT 7086 77.738 144.985 4.978 1.00 0.00 H TER 38025 WAT 7086 ATOM 38025 O WAT 7087 58.952 7.656 7.498 1.00 0.00 O ATOM 38026 H1 WAT 7087 59.184 6.875 8.000 1.00 0.00 H ATOM 38027 H2 WAT 7087 58.027 7.802 7.694 1.00 0.00 H TER 38029 WAT 7087 ATOM 38029 O WAT 7088 117.123 144.990 71.569 1.00 0.00 O ATOM 38030 H1 WAT 7088 117.404 144.807 70.673 1.00 0.00 H ATOM 38031 H2 WAT 7088 116.268 144.567 71.644 1.00 0.00 H TER 38033 WAT 7088 ATOM 38033 O WAT 7089 82.487 124.903 108.195 1.00 0.00 O ATOM 38034 H1 WAT 7089 83.203 125.079 107.585 1.00 0.00 H ATOM 38035 H2 WAT 7089 82.731 124.081 108.621 1.00 0.00 H TER 38037 WAT 7089 ATOM 38037 O WAT 7090 61.426 65.220 16.511 1.00 0.00 O ATOM 38038 H1 WAT 7090 60.543 65.583 16.442 1.00 0.00 H ATOM 38039 H2 WAT 7090 61.612 65.218 17.450 1.00 0.00 H TER 38041 WAT 7090 ATOM 38041 O WAT 7091 121.828 61.181 135.892 1.00 0.00 O ATOM 38042 H1 WAT 7091 122.674 60.963 135.500 1.00 0.00 H ATOM 38043 H2 WAT 7091 121.207 61.128 135.166 1.00 0.00 H TER 38045 WAT 7091 ATOM 38045 O WAT 7092 121.161 107.476 156.652 1.00 0.00 O ATOM 38046 H1 WAT 7092 122.113 107.379 156.662 1.00 0.00 H ATOM 38047 H2 WAT 7092 121.016 108.422 156.684 1.00 0.00 H TER 38049 WAT 7092 ATOM 38049 O WAT 7093 48.778 78.043 3.482 1.00 0.00 O ATOM 38050 H1 WAT 7093 48.952 77.919 4.415 1.00 0.00 H ATOM 38051 H2 WAT 7093 47.828 77.957 3.401 1.00 0.00 H TER 38053 WAT 7093 ATOM 38053 O WAT 7094 46.560 53.463 105.995 1.00 0.00 O ATOM 38054 H1 WAT 7094 47.205 52.777 106.166 1.00 0.00 H ATOM 38055 H2 WAT 7094 45.921 53.374 106.702 1.00 0.00 H TER 38057 WAT 7094 ATOM 38057 O WAT 7095 33.029 18.311 133.502 1.00 0.00 O ATOM 38058 H1 WAT 7095 32.139 18.204 133.165 1.00 0.00 H ATOM 38059 H2 WAT 7095 33.537 18.608 132.747 1.00 0.00 H TER 38061 WAT 7095 ATOM 38061 O WAT 7096 39.305 132.818 11.576 1.00 0.00 O ATOM 38062 H1 WAT 7096 39.730 132.587 12.402 1.00 0.00 H ATOM 38063 H2 WAT 7096 39.722 133.639 11.314 1.00 0.00 H TER 38065 WAT 7096 ATOM 38065 O WAT 7097 138.758 65.415 133.525 1.00 0.00 O ATOM 38066 H1 WAT 7097 139.480 65.879 133.102 1.00 0.00 H ATOM 38067 H2 WAT 7097 138.695 65.812 134.394 1.00 0.00 H TER 38069 WAT 7097 ATOM 38069 O WAT 7098 9.680 8.101 132.352 1.00 0.00 O ATOM 38070 H1 WAT 7098 10.462 8.618 132.548 1.00 0.00 H ATOM 38071 H2 WAT 7098 9.135 8.683 131.822 1.00 0.00 H TER 38073 WAT 7098 ATOM 38073 O WAT 7099 145.562 89.504 152.590 1.00 0.00 O ATOM 38074 H1 WAT 7099 145.999 89.083 151.849 1.00 0.00 H ATOM 38075 H2 WAT 7099 144.750 89.853 152.222 1.00 0.00 H TER 38077 WAT 7099 ATOM 38077 O WAT 7100 37.317 66.725 93.803 1.00 0.00 O ATOM 38078 H1 WAT 7100 37.982 66.048 93.926 1.00 0.00 H ATOM 38079 H2 WAT 7100 37.782 67.548 93.954 1.00 0.00 H TER 38081 WAT 7100 ATOM 38081 O WAT 7101 67.372 35.037 119.574 1.00 0.00 O ATOM 38082 H1 WAT 7101 68.129 35.531 119.890 1.00 0.00 H ATOM 38083 H2 WAT 7101 67.048 35.546 118.830 1.00 0.00 H TER 38085 WAT 7101 ATOM 38085 O WAT 7102 80.654 107.573 67.736 1.00 0.00 O ATOM 38086 H1 WAT 7102 81.251 108.276 67.480 1.00 0.00 H ATOM 38087 H2 WAT 7102 81.114 106.769 67.495 1.00 0.00 H TER 38089 WAT 7102 ATOM 38089 O WAT 7103 122.355 55.282 138.090 1.00 0.00 O ATOM 38090 H1 WAT 7103 121.933 54.654 137.504 1.00 0.00 H ATOM 38091 H2 WAT 7103 122.415 54.825 138.929 1.00 0.00 H TER 38093 WAT 7103 ATOM 38093 O WAT 7104 132.538 19.322 117.911 1.00 0.00 O ATOM 38094 H1 WAT 7104 132.011 19.867 117.326 1.00 0.00 H ATOM 38095 H2 WAT 7104 132.429 18.434 117.572 1.00 0.00 H TER 38097 WAT 7104 ATOM 38097 O WAT 7105 122.949 10.975 75.406 1.00 0.00 O ATOM 38098 H1 WAT 7105 122.204 10.492 75.048 1.00 0.00 H ATOM 38099 H2 WAT 7105 123.027 10.663 76.307 1.00 0.00 H TER 38101 WAT 7105 ATOM 38101 O WAT 7106 63.566 121.292 115.477 1.00 0.00 O ATOM 38102 H1 WAT 7106 64.110 121.901 114.977 1.00 0.00 H ATOM 38103 H2 WAT 7106 63.284 120.641 114.834 1.00 0.00 H TER 38105 WAT 7106 ATOM 38105 O WAT 7107 28.423 111.049 122.419 1.00 0.00 O ATOM 38106 H1 WAT 7107 28.139 111.644 121.724 1.00 0.00 H ATOM 38107 H2 WAT 7107 27.623 110.849 122.904 1.00 0.00 H TER 38109 WAT 7107 ATOM 38109 O WAT 7108 99.122 135.967 14.884 1.00 0.00 O ATOM 38110 H1 WAT 7108 98.741 135.165 14.526 1.00 0.00 H ATOM 38111 H2 WAT 7108 99.113 135.834 15.832 1.00 0.00 H TER 38113 WAT 7108 ATOM 38113 O WAT 7109 144.386 19.492 141.847 1.00 0.00 O ATOM 38114 H1 WAT 7109 143.805 19.001 142.427 1.00 0.00 H ATOM 38115 H2 WAT 7109 145.251 19.410 142.249 1.00 0.00 H TER 38117 WAT 7109 ATOM 38117 O WAT 7110 109.553 67.756 77.616 1.00 0.00 O ATOM 38118 H1 WAT 7110 109.737 67.907 78.543 1.00 0.00 H ATOM 38119 H2 WAT 7110 109.467 66.806 77.541 1.00 0.00 H TER 38121 WAT 7110 ATOM 38121 O WAT 7111 45.046 139.960 65.327 1.00 0.00 O ATOM 38122 H1 WAT 7111 44.377 139.669 65.947 1.00 0.00 H ATOM 38123 H2 WAT 7111 45.681 139.244 65.307 1.00 0.00 H TER 38125 WAT 7111 ATOM 38125 O WAT 7112 6.299 133.556 112.752 1.00 0.00 O ATOM 38126 H1 WAT 7112 7.016 133.805 112.168 1.00 0.00 H ATOM 38127 H2 WAT 7112 6.724 133.071 113.459 1.00 0.00 H TER 38129 WAT 7112 ATOM 38129 O WAT 7113 16.422 16.729 4.695 1.00 0.00 O ATOM 38130 H1 WAT 7113 15.724 16.105 4.497 1.00 0.00 H ATOM 38131 H2 WAT 7113 17.101 16.203 5.116 1.00 0.00 H TER 38133 WAT 7113 ATOM 38133 O WAT 7114 139.578 142.949 66.780 1.00 0.00 O ATOM 38134 H1 WAT 7114 139.342 143.007 65.854 1.00 0.00 H ATOM 38135 H2 WAT 7114 140.424 143.393 66.840 1.00 0.00 H TER 38137 WAT 7114 ATOM 38137 O WAT 7115 94.850 111.238 135.784 1.00 0.00 O ATOM 38138 H1 WAT 7115 94.840 110.538 136.438 1.00 0.00 H ATOM 38139 H2 WAT 7115 93.976 111.213 135.394 1.00 0.00 H TER 38141 WAT 7115 ATOM 38141 O WAT 7116 23.439 129.108 129.281 1.00 0.00 O ATOM 38142 H1 WAT 7116 23.090 129.140 128.390 1.00 0.00 H ATOM 38143 H2 WAT 7116 24.070 128.388 129.265 1.00 0.00 H TER 38145 WAT 7116 ATOM 38145 O WAT 7117 51.120 113.104 118.778 1.00 0.00 O ATOM 38146 H1 WAT 7117 51.658 112.352 118.533 1.00 0.00 H ATOM 38147 H2 WAT 7117 51.495 113.837 118.291 1.00 0.00 H TER 38149 WAT 7117 ATOM 38149 O WAT 7118 88.132 117.715 148.029 1.00 0.00 O ATOM 38150 H1 WAT 7118 88.352 117.881 148.945 1.00 0.00 H ATOM 38151 H2 WAT 7118 88.916 117.970 147.544 1.00 0.00 H TER 38153 WAT 7118 ATOM 38153 O WAT 7119 43.780 41.197 123.133 1.00 0.00 O ATOM 38154 H1 WAT 7119 43.367 40.492 122.634 1.00 0.00 H ATOM 38155 H2 WAT 7119 43.676 41.973 122.582 1.00 0.00 H TER 38157 WAT 7119 ATOM 38157 O WAT 7120 74.270 131.596 6.179 1.00 0.00 O ATOM 38158 H1 WAT 7120 74.607 131.435 7.060 1.00 0.00 H ATOM 38159 H2 WAT 7120 75.021 131.941 5.695 1.00 0.00 H TER 38161 WAT 7120 ATOM 38161 O WAT 7121 66.024 0.231 141.484 1.00 0.00 O ATOM 38162 H1 WAT 7121 66.325 -0.170 142.300 1.00 0.00 H ATOM 38163 H2 WAT 7121 65.344 0.847 141.757 1.00 0.00 H TER 38165 WAT 7121 ATOM 38165 O WAT 7122 110.635 126.441 137.216 1.00 0.00 O ATOM 38166 H1 WAT 7122 110.543 125.828 136.487 1.00 0.00 H ATOM 38167 H2 WAT 7122 111.581 126.522 137.343 1.00 0.00 H TER 38169 WAT 7122 ATOM 38169 O WAT 7123 35.603 99.737 75.451 1.00 0.00 O ATOM 38170 H1 WAT 7123 36.506 100.031 75.329 1.00 0.00 H ATOM 38171 H2 WAT 7123 35.171 99.939 74.621 1.00 0.00 H TER 38173 WAT 7123 ATOM 38173 O WAT 7124 85.045 144.728 103.813 1.00 0.00 O ATOM 38174 H1 WAT 7124 85.888 144.642 103.367 1.00 0.00 H ATOM 38175 H2 WAT 7124 84.618 145.465 103.376 1.00 0.00 H TER 38177 WAT 7124 ATOM 38177 O WAT 7125 74.398 145.577 81.731 1.00 0.00 O ATOM 38178 H1 WAT 7125 73.509 145.236 81.833 1.00 0.00 H ATOM 38179 H2 WAT 7125 74.578 145.501 80.794 1.00 0.00 H TER 38181 WAT 7125 ATOM 38181 O WAT 7126 37.776 85.073 155.227 1.00 0.00 O ATOM 38182 H1 WAT 7126 38.490 84.800 154.651 1.00 0.00 H ATOM 38183 H2 WAT 7126 37.393 85.833 154.789 1.00 0.00 H TER 38185 WAT 7126 ATOM 38185 O WAT 7127 135.698 43.800 148.689 1.00 0.00 O ATOM 38186 H1 WAT 7127 135.655 43.076 148.064 1.00 0.00 H ATOM 38187 H2 WAT 7127 134.928 44.332 148.494 1.00 0.00 H TER 38189 WAT 7127 ATOM 38189 O WAT 7128 15.374 130.040 76.088 1.00 0.00 O ATOM 38190 H1 WAT 7128 15.137 129.657 76.933 1.00 0.00 H ATOM 38191 H2 WAT 7128 16.124 129.523 75.793 1.00 0.00 H TER 38193 WAT 7128 ATOM 38193 O WAT 7129 142.628 127.835 111.556 1.00 0.00 O ATOM 38194 H1 WAT 7129 142.594 127.103 112.171 1.00 0.00 H ATOM 38195 H2 WAT 7129 141.725 127.936 111.255 1.00 0.00 H TER 38197 WAT 7129 ATOM 38197 O WAT 7130 85.240 43.848 154.279 1.00 0.00 O ATOM 38198 H1 WAT 7130 85.008 43.456 153.438 1.00 0.00 H ATOM 38199 H2 WAT 7130 85.531 44.733 154.059 1.00 0.00 H TER 38201 WAT 7130 ATOM 38201 O WAT 7131 95.950 43.169 78.069 1.00 0.00 O ATOM 38202 H1 WAT 7131 96.849 43.168 77.740 1.00 0.00 H ATOM 38203 H2 WAT 7131 95.409 43.274 77.286 1.00 0.00 H TER 38205 WAT 7131 ATOM 38205 O WAT 7132 3.764 35.986 153.935 1.00 0.00 O ATOM 38206 H1 WAT 7132 4.125 36.805 154.274 1.00 0.00 H ATOM 38207 H2 WAT 7132 2.823 36.054 154.097 1.00 0.00 H TER 38209 WAT 7132 ATOM 38209 O WAT 7133 102.167 15.544 148.899 1.00 0.00 O ATOM 38210 H1 WAT 7133 102.678 15.635 148.095 1.00 0.00 H ATOM 38211 H2 WAT 7133 102.459 14.714 149.276 1.00 0.00 H TER 38213 WAT 7133 ATOM 38213 O WAT 7134 86.023 109.302 82.042 1.00 0.00 O ATOM 38214 H1 WAT 7134 86.058 109.805 82.855 1.00 0.00 H ATOM 38215 H2 WAT 7134 85.672 108.450 82.302 1.00 0.00 H TER 38217 WAT 7134 ATOM 38217 O WAT 7135 30.579 137.493 8.836 1.00 0.00 O ATOM 38218 H1 WAT 7135 29.809 138.023 9.039 1.00 0.00 H ATOM 38219 H2 WAT 7135 30.451 136.685 9.332 1.00 0.00 H TER 38221 WAT 7135 ATOM 38221 O WAT 7136 118.952 15.234 61.156 1.00 0.00 O ATOM 38222 H1 WAT 7136 119.301 15.509 62.003 1.00 0.00 H ATOM 38223 H2 WAT 7136 119.213 14.317 61.075 1.00 0.00 H TER 38225 WAT 7136 ATOM 38225 O WAT 7137 67.923 37.345 57.356 1.00 0.00 O ATOM 38226 H1 WAT 7137 67.230 37.090 57.964 1.00 0.00 H ATOM 38227 H2 WAT 7137 67.938 38.301 57.396 1.00 0.00 H TER 38229 WAT 7137 ATOM 38229 O WAT 7138 141.284 76.364 77.914 1.00 0.00 O ATOM 38230 H1 WAT 7138 140.707 75.644 78.165 1.00 0.00 H ATOM 38231 H2 WAT 7138 141.049 77.078 78.507 1.00 0.00 H TER 38233 WAT 7138 ATOM 38233 O WAT 7139 69.479 22.047 131.800 1.00 0.00 O ATOM 38234 H1 WAT 7139 70.098 21.654 132.414 1.00 0.00 H ATOM 38235 H2 WAT 7139 68.862 21.343 131.598 1.00 0.00 H TER 38237 WAT 7139 ATOM 38237 O WAT 7140 60.686 135.635 132.299 1.00 0.00 O ATOM 38238 H1 WAT 7140 59.939 135.747 132.888 1.00 0.00 H ATOM 38239 H2 WAT 7140 61.324 136.284 132.595 1.00 0.00 H TER 38241 WAT 7140 ATOM 38241 O WAT 7141 89.013 106.385 65.132 1.00 0.00 O ATOM 38242 H1 WAT 7141 88.211 106.303 64.616 1.00 0.00 H ATOM 38243 H2 WAT 7141 89.640 105.810 64.693 1.00 0.00 H TER 38245 WAT 7141 ATOM 38245 O WAT 7142 95.197 10.200 144.499 1.00 0.00 O ATOM 38246 H1 WAT 7142 95.983 9.697 144.711 1.00 0.00 H ATOM 38247 H2 WAT 7142 95.147 10.867 145.184 1.00 0.00 H TER 38249 WAT 7142 ATOM 38249 O WAT 7143 94.178 8.507 99.154 1.00 0.00 O ATOM 38250 H1 WAT 7143 93.304 8.223 99.422 1.00 0.00 H ATOM 38251 H2 WAT 7143 94.750 7.777 99.392 1.00 0.00 H TER 38253 WAT 7143 ATOM 38253 O WAT 7144 18.390 74.992 0.977 1.00 0.00 O ATOM 38254 H1 WAT 7144 18.145 75.219 0.080 1.00 0.00 H ATOM 38255 H2 WAT 7144 17.556 74.836 1.420 1.00 0.00 H TER 38257 WAT 7144 ATOM 38257 O WAT 7145 91.851 106.066 142.645 1.00 0.00 O ATOM 38258 H1 WAT 7145 92.311 106.906 142.655 1.00 0.00 H ATOM 38259 H2 WAT 7145 92.277 105.567 141.949 1.00 0.00 H TER 38261 WAT 7145 ATOM 38261 O WAT 7146 136.740 105.294 1.024 1.00 0.00 O ATOM 38262 H1 WAT 7146 136.808 104.680 1.756 1.00 0.00 H ATOM 38263 H2 WAT 7146 135.898 105.088 0.617 1.00 0.00 H TER 38265 WAT 7146 ATOM 38265 O WAT 7147 72.068 108.570 20.885 1.00 0.00 O ATOM 38266 H1 WAT 7147 72.419 109.185 20.241 1.00 0.00 H ATOM 38267 H2 WAT 7147 72.577 108.738 21.678 1.00 0.00 H TER 38269 WAT 7147 ATOM 38269 O WAT 7148 48.744 103.177 67.315 1.00 0.00 O ATOM 38270 H1 WAT 7148 48.641 104.047 66.930 1.00 0.00 H ATOM 38271 H2 WAT 7148 47.874 102.782 67.250 1.00 0.00 H TER 38273 WAT 7148 ATOM 38273 O WAT 7149 38.265 117.158 137.523 1.00 0.00 O ATOM 38274 H1 WAT 7149 39.160 117.131 137.182 1.00 0.00 H ATOM 38275 H2 WAT 7149 37.739 116.728 136.849 1.00 0.00 H TER 38277 WAT 7149 ATOM 38277 O WAT 7150 134.544 18.507 95.888 1.00 0.00 O ATOM 38278 H1 WAT 7150 133.604 18.587 96.049 1.00 0.00 H ATOM 38279 H2 WAT 7150 134.950 19.041 96.571 1.00 0.00 H TER 38281 WAT 7150 ATOM 38281 O WAT 7151 129.163 24.597 133.092 1.00 0.00 O ATOM 38282 H1 WAT 7151 129.889 24.003 133.285 1.00 0.00 H ATOM 38283 H2 WAT 7151 129.401 25.003 132.258 1.00 0.00 H TER 38285 WAT 7151 ATOM 38285 O WAT 7152 42.465 7.166 124.496 1.00 0.00 O ATOM 38286 H1 WAT 7152 42.453 7.561 125.368 1.00 0.00 H ATOM 38287 H2 WAT 7152 41.718 6.568 124.493 1.00 0.00 H TER 38289 WAT 7152 ATOM 38289 O WAT 7153 138.038 30.453 105.466 1.00 0.00 O ATOM 38290 H1 WAT 7153 137.323 30.461 104.829 1.00 0.00 H ATOM 38291 H2 WAT 7153 137.609 30.594 106.310 1.00 0.00 H TER 38293 WAT 7153 ATOM 38293 O WAT 7154 126.749 128.576 5.267 1.00 0.00 O ATOM 38294 H1 WAT 7154 126.705 129.368 5.802 1.00 0.00 H ATOM 38295 H2 WAT 7154 126.517 127.867 5.868 1.00 0.00 H TER 38297 WAT 7154 ATOM 38297 O WAT 7155 6.858 67.823 128.585 1.00 0.00 O ATOM 38298 H1 WAT 7155 7.640 67.460 129.000 1.00 0.00 H ATOM 38299 H2 WAT 7155 6.887 68.756 128.796 1.00 0.00 H TER 38301 WAT 7155 ATOM 38301 O WAT 7156 70.304 132.310 108.064 1.00 0.00 O ATOM 38302 H1 WAT 7156 69.711 131.712 108.518 1.00 0.00 H ATOM 38303 H2 WAT 7156 69.938 132.388 107.183 1.00 0.00 H TER 38305 WAT 7156 ATOM 38305 O WAT 7157 40.729 97.641 119.324 1.00 0.00 O ATOM 38306 H1 WAT 7157 40.766 96.852 119.864 1.00 0.00 H ATOM 38307 H2 WAT 7157 40.437 98.328 119.923 1.00 0.00 H TER 38309 WAT 7157 ATOM 38309 O WAT 7158 71.999 29.348 69.498 1.00 0.00 O ATOM 38310 H1 WAT 7158 72.052 30.240 69.841 1.00 0.00 H ATOM 38311 H2 WAT 7158 72.582 29.349 68.739 1.00 0.00 H TER 38313 WAT 7158 ATOM 38313 O WAT 7159 43.051 30.237 90.978 1.00 0.00 O ATOM 38314 H1 WAT 7159 42.526 29.482 90.711 1.00 0.00 H ATOM 38315 H2 WAT 7159 43.719 30.316 90.297 1.00 0.00 H TER 38317 WAT 7159 ATOM 38317 O WAT 7160 77.275 83.341 78.458 1.00 0.00 O ATOM 38318 H1 WAT 7160 76.587 82.706 78.660 1.00 0.00 H ATOM 38319 H2 WAT 7160 77.452 83.776 79.292 1.00 0.00 H TER 38321 WAT 7160 ATOM 38321 O WAT 7161 79.035 38.421 20.558 1.00 0.00 O ATOM 38322 H1 WAT 7161 78.473 37.688 20.809 1.00 0.00 H ATOM 38323 H2 WAT 7161 79.924 38.066 20.602 1.00 0.00 H TER 38325 WAT 7161 ATOM 38325 O WAT 7162 121.757 72.091 92.856 1.00 0.00 O ATOM 38326 H1 WAT 7162 122.347 72.775 92.539 1.00 0.00 H ATOM 38327 H2 WAT 7162 121.209 72.529 93.507 1.00 0.00 H TER 38329 WAT 7162 ATOM 38329 O WAT 7163 112.037 23.627 78.581 1.00 0.00 O ATOM 38330 H1 WAT 7163 111.526 23.446 79.370 1.00 0.00 H ATOM 38331 H2 WAT 7163 111.466 24.181 78.049 1.00 0.00 H TER 38333 WAT 7163 ATOM 38333 O WAT 7164 48.878 69.735 86.819 1.00 0.00 O ATOM 38334 H1 WAT 7164 49.627 69.156 86.675 1.00 0.00 H ATOM 38335 H2 WAT 7164 49.268 70.590 87.002 1.00 0.00 H TER 38337 WAT 7164 ATOM 38337 O WAT 7165 125.894 75.074 16.970 1.00 0.00 O ATOM 38338 H1 WAT 7165 126.822 74.891 17.117 1.00 0.00 H ATOM 38339 H2 WAT 7165 125.460 74.230 17.092 1.00 0.00 H TER 38341 WAT 7165 ATOM 38341 O WAT 7166 97.842 63.471 157.423 1.00 0.00 O ATOM 38342 H1 WAT 7166 98.743 63.542 157.737 1.00 0.00 H ATOM 38343 H2 WAT 7166 97.859 62.737 156.810 1.00 0.00 H TER 38345 WAT 7166 ATOM 38345 O WAT 7167 5.489 127.514 141.138 1.00 0.00 O ATOM 38346 H1 WAT 7167 4.841 127.180 141.758 1.00 0.00 H ATOM 38347 H2 WAT 7167 5.395 126.954 140.368 1.00 0.00 H TER 38349 WAT 7167 ATOM 38349 O WAT 7168 64.091 53.925 116.972 1.00 0.00 O ATOM 38350 H1 WAT 7168 63.769 54.273 117.804 1.00 0.00 H ATOM 38351 H2 WAT 7168 64.880 53.436 117.207 1.00 0.00 H TER 38353 WAT 7168 ATOM 38353 O WAT 7169 122.190 73.784 134.268 1.00 0.00 O ATOM 38354 H1 WAT 7169 121.946 73.255 133.509 1.00 0.00 H ATOM 38355 H2 WAT 7169 122.052 74.688 133.986 1.00 0.00 H TER 38357 WAT 7169 ATOM 38357 O WAT 7170 56.412 9.406 100.105 1.00 0.00 O ATOM 38358 H1 WAT 7170 56.861 10.133 99.674 1.00 0.00 H ATOM 38359 H2 WAT 7170 55.786 9.090 99.453 1.00 0.00 H TER 38361 WAT 7170 ATOM 38361 O WAT 7171 75.408 47.854 9.188 1.00 0.00 O ATOM 38362 H1 WAT 7171 76.123 48.480 9.305 1.00 0.00 H ATOM 38363 H2 WAT 7171 74.855 48.247 8.512 1.00 0.00 H TER 38365 WAT 7171 ATOM 38365 O WAT 7172 77.990 140.201 84.768 1.00 0.00 O ATOM 38366 H1 WAT 7172 77.559 139.419 85.112 1.00 0.00 H ATOM 38367 H2 WAT 7172 78.922 139.985 84.778 1.00 0.00 H TER 38369 WAT 7172 ATOM 38369 O WAT 7173 4.040 80.897 114.710 1.00 0.00 O ATOM 38370 H1 WAT 7173 3.907 81.570 114.043 1.00 0.00 H ATOM 38371 H2 WAT 7173 4.804 81.197 115.204 1.00 0.00 H TER 38373 WAT 7173 ATOM 38373 O WAT 7174 120.972 99.788 115.900 1.00 0.00 O ATOM 38374 H1 WAT 7174 120.108 100.106 116.160 1.00 0.00 H ATOM 38375 H2 WAT 7174 120.811 98.909 115.557 1.00 0.00 H TER 38377 WAT 7174 ATOM 38377 O WAT 7175 5.658 114.903 104.310 1.00 0.00 O ATOM 38378 H1 WAT 7175 5.014 115.529 103.978 1.00 0.00 H ATOM 38379 H2 WAT 7175 6.078 115.356 105.041 1.00 0.00 H TER 38381 WAT 7175 ATOM 38381 O WAT 7176 71.276 66.925 68.788 1.00 0.00 O ATOM 38382 H1 WAT 7176 70.736 66.785 68.010 1.00 0.00 H ATOM 38383 H2 WAT 7176 70.694 67.366 69.407 1.00 0.00 H TER 38385 WAT 7176 ATOM 38385 O WAT 7177 109.637 25.809 90.417 1.00 0.00 O ATOM 38386 H1 WAT 7177 109.346 26.698 90.212 1.00 0.00 H ATOM 38387 H2 WAT 7177 109.151 25.252 89.809 1.00 0.00 H TER 38389 WAT 7177 ATOM 38389 O WAT 7178 18.921 130.252 139.897 1.00 0.00 O ATOM 38390 H1 WAT 7178 18.335 129.531 139.669 1.00 0.00 H ATOM 38391 H2 WAT 7178 19.024 130.188 140.846 1.00 0.00 H TER 38393 WAT 7178 ATOM 38393 O WAT 7179 87.102 16.308 144.325 1.00 0.00 O ATOM 38394 H1 WAT 7179 86.983 16.298 143.375 1.00 0.00 H ATOM 38395 H2 WAT 7179 88.013 16.573 144.449 1.00 0.00 H TER 38397 WAT 7179 ATOM 38397 O WAT 7180 126.319 69.552 84.818 1.00 0.00 O ATOM 38398 H1 WAT 7180 126.486 70.254 84.189 1.00 0.00 H ATOM 38399 H2 WAT 7180 127.173 69.374 85.211 1.00 0.00 H TER 38401 WAT 7180 ATOM 38401 O WAT 7181 94.268 23.672 118.768 1.00 0.00 O ATOM 38402 H1 WAT 7181 93.842 23.434 119.591 1.00 0.00 H ATOM 38403 H2 WAT 7181 94.291 22.857 118.266 1.00 0.00 H TER 38405 WAT 7181 ATOM 38405 O WAT 7182 35.128 104.656 103.337 1.00 0.00 O ATOM 38406 H1 WAT 7182 35.476 104.633 102.445 1.00 0.00 H ATOM 38407 H2 WAT 7182 35.250 103.765 103.664 1.00 0.00 H TER 38409 WAT 7182 ATOM 38409 O WAT 7183 63.839 25.998 15.741 1.00 0.00 O ATOM 38410 H1 WAT 7183 63.081 26.290 16.247 1.00 0.00 H ATOM 38411 H2 WAT 7183 63.547 25.193 15.314 1.00 0.00 H TER 38413 WAT 7183 ATOM 38413 O WAT 7184 83.588 145.028 61.449 1.00 0.00 O ATOM 38414 H1 WAT 7184 82.843 145.174 60.866 1.00 0.00 H ATOM 38415 H2 WAT 7184 83.204 144.639 62.235 1.00 0.00 H TER 38417 WAT 7184 ATOM 38417 O WAT 7185 136.803 110.373 87.880 1.00 0.00 O ATOM 38418 H1 WAT 7185 136.714 110.602 88.805 1.00 0.00 H ATOM 38419 H2 WAT 7185 137.660 110.717 87.629 1.00 0.00 H TER 38421 WAT 7185 ATOM 38421 O WAT 7186 89.933 88.969 135.543 1.00 0.00 O ATOM 38422 H1 WAT 7186 90.519 88.236 135.357 1.00 0.00 H ATOM 38423 H2 WAT 7186 90.293 89.368 136.335 1.00 0.00 H TER 38425 WAT 7186 ATOM 38425 O WAT 7187 71.466 91.157 84.784 1.00 0.00 O ATOM 38426 H1 WAT 7187 70.989 91.695 84.153 1.00 0.00 H ATOM 38427 H2 WAT 7187 71.251 91.538 85.635 1.00 0.00 H TER 38429 WAT 7187 ATOM 38429 O WAT 7188 60.823 5.892 15.588 1.00 0.00 O ATOM 38430 H1 WAT 7188 60.393 6.572 16.106 1.00 0.00 H ATOM 38431 H2 WAT 7188 61.575 6.332 15.191 1.00 0.00 H TER 38433 WAT 7188 ATOM 38433 O WAT 7189 11.298 75.212 158.463 1.00 0.00 O ATOM 38434 H1 WAT 7189 11.914 75.507 157.792 1.00 0.00 H ATOM 38435 H2 WAT 7189 10.435 75.412 158.100 1.00 0.00 H TER 38437 WAT 7189 ATOM 38437 O WAT 7190 57.581 99.305 157.062 1.00 0.00 O ATOM 38438 H1 WAT 7190 57.957 98.438 156.908 1.00 0.00 H ATOM 38439 H2 WAT 7190 56.677 99.130 157.325 1.00 0.00 H TER 38441 WAT 7190 ATOM 38441 O WAT 7191 131.995 97.171 21.231 1.00 0.00 O ATOM 38442 H1 WAT 7191 132.436 96.916 22.041 1.00 0.00 H ATOM 38443 H2 WAT 7191 131.270 96.552 21.147 1.00 0.00 H TER 38445 WAT 7191 ATOM 38445 O WAT 7192 54.401 34.421 127.871 1.00 0.00 O ATOM 38446 H1 WAT 7192 53.559 33.984 127.748 1.00 0.00 H ATOM 38447 H2 WAT 7192 55.016 33.710 128.050 1.00 0.00 H TER 38449 WAT 7192 ATOM 38449 O WAT 7193 92.399 46.922 68.261 1.00 0.00 O ATOM 38450 H1 WAT 7193 92.965 46.214 67.953 1.00 0.00 H ATOM 38451 H2 WAT 7193 93.004 47.610 68.537 1.00 0.00 H TER 38453 WAT 7193 ATOM 38453 O WAT 7194 33.608 80.897 17.063 1.00 0.00 O ATOM 38454 H1 WAT 7194 32.730 81.241 17.228 1.00 0.00 H ATOM 38455 H2 WAT 7194 33.825 80.405 17.855 1.00 0.00 H TER 38457 WAT 7194 ATOM 38457 O WAT 7195 141.004 21.630 55.250 1.00 0.00 O ATOM 38458 H1 WAT 7195 141.177 21.836 54.331 1.00 0.00 H ATOM 38459 H2 WAT 7195 140.950 22.483 55.680 1.00 0.00 H TER 38461 WAT 7195 ATOM 38461 O WAT 7196 143.929 83.798 122.984 1.00 0.00 O ATOM 38462 H1 WAT 7196 143.468 84.139 122.218 1.00 0.00 H ATOM 38463 H2 WAT 7196 143.265 83.299 123.460 1.00 0.00 H TER 38465 WAT 7196 ATOM 38465 O WAT 7197 16.519 76.477 84.425 1.00 0.00 O ATOM 38466 H1 WAT 7197 15.664 76.856 84.630 1.00 0.00 H ATOM 38467 H2 WAT 7197 16.343 75.545 84.296 1.00 0.00 H TER 38469 WAT 7197 ATOM 38469 O WAT 7198 95.900 58.025 71.848 1.00 0.00 O ATOM 38470 H1 WAT 7198 95.160 58.624 71.748 1.00 0.00 H ATOM 38471 H2 WAT 7198 96.056 57.994 72.792 1.00 0.00 H TER 38473 WAT 7198 ATOM 38473 O WAT 7199 88.425 83.433 144.987 1.00 0.00 O ATOM 38474 H1 WAT 7199 88.926 82.943 145.639 1.00 0.00 H ATOM 38475 H2 WAT 7199 88.564 84.351 145.218 1.00 0.00 H TER 38477 WAT 7199 ATOM 38477 O WAT 7200 136.774 38.681 124.532 1.00 0.00 O ATOM 38478 H1 WAT 7200 136.784 37.724 124.502 1.00 0.00 H ATOM 38479 H2 WAT 7200 136.068 38.932 123.938 1.00 0.00 H TER 38481 WAT 7200 ATOM 38481 O WAT 7201 13.578 118.863 153.030 1.00 0.00 O ATOM 38482 H1 WAT 7201 13.385 118.095 152.493 1.00 0.00 H ATOM 38483 H2 WAT 7201 14.313 118.592 153.580 1.00 0.00 H TER 38485 WAT 7201 ATOM 38485 O WAT 7202 105.753 96.983 29.066 1.00 0.00 O ATOM 38486 H1 WAT 7202 106.250 96.612 28.337 1.00 0.00 H ATOM 38487 H2 WAT 7202 105.125 96.299 29.300 1.00 0.00 H TER 38489 WAT 7202 ATOM 38489 O WAT 7203 34.166 21.068 124.046 1.00 0.00 O ATOM 38490 H1 WAT 7203 34.313 20.165 123.765 1.00 0.00 H ATOM 38491 H2 WAT 7203 33.560 21.425 123.396 1.00 0.00 H TER 38493 WAT 7203 ATOM 38493 O WAT 7204 123.781 129.236 146.816 1.00 0.00 O ATOM 38494 H1 WAT 7204 123.032 129.705 147.186 1.00 0.00 H ATOM 38495 H2 WAT 7204 123.958 128.535 147.443 1.00 0.00 H TER 38497 WAT 7204 ATOM 38497 O WAT 7205 29.324 34.787 95.144 1.00 0.00 O ATOM 38498 H1 WAT 7205 28.419 34.483 95.217 1.00 0.00 H ATOM 38499 H2 WAT 7205 29.611 34.907 96.049 1.00 0.00 H TER 38501 WAT 7205 ATOM 38501 O WAT 7206 91.960 75.611 89.020 1.00 0.00 O ATOM 38502 H1 WAT 7206 91.630 75.716 88.128 1.00 0.00 H ATOM 38503 H2 WAT 7206 92.824 75.214 88.910 1.00 0.00 H TER 38505 WAT 7206 ATOM 38505 O WAT 7207 84.826 53.167 103.066 1.00 0.00 O ATOM 38506 H1 WAT 7207 84.080 52.662 102.743 1.00 0.00 H ATOM 38507 H2 WAT 7207 85.090 52.719 103.869 1.00 0.00 H TER 38509 WAT 7207 ATOM 38509 O WAT 7208 82.234 98.641 11.750 1.00 0.00 O ATOM 38510 H1 WAT 7208 82.360 98.854 12.675 1.00 0.00 H ATOM 38511 H2 WAT 7208 82.494 99.436 11.284 1.00 0.00 H TER 38513 WAT 7208 ATOM 38513 O WAT 7209 12.394 121.613 71.872 1.00 0.00 O ATOM 38514 H1 WAT 7209 12.853 121.674 71.035 1.00 0.00 H ATOM 38515 H2 WAT 7209 13.029 121.923 72.518 1.00 0.00 H TER 38517 WAT 7209 ATOM 38517 O WAT 7210 136.229 106.188 107.160 1.00 0.00 O ATOM 38518 H1 WAT 7210 137.003 105.628 107.221 1.00 0.00 H ATOM 38519 H2 WAT 7210 136.555 107.009 106.792 1.00 0.00 H TER 38521 WAT 7210 ATOM 38521 O WAT 7211 111.981 112.984 65.376 1.00 0.00 O ATOM 38522 H1 WAT 7211 112.712 112.518 65.782 1.00 0.00 H ATOM 38523 H2 WAT 7211 111.254 112.870 65.988 1.00 0.00 H TER 38525 WAT 7211 ATOM 38525 O WAT 7212 21.526 117.997 101.218 1.00 0.00 O ATOM 38526 H1 WAT 7212 21.710 118.933 101.295 1.00 0.00 H ATOM 38527 H2 WAT 7212 20.612 117.956 100.937 1.00 0.00 H TER 38529 WAT 7212 ATOM 38529 O WAT 7213 106.406 75.885 77.668 1.00 0.00 O ATOM 38530 H1 WAT 7213 106.544 76.747 78.061 1.00 0.00 H ATOM 38531 H2 WAT 7213 107.161 75.759 77.094 1.00 0.00 H TER 38533 WAT 7213 ATOM 38533 O WAT 7214 7.623 104.843 132.836 1.00 0.00 O ATOM 38534 H1 WAT 7214 8.500 104.469 132.757 1.00 0.00 H ATOM 38535 H2 WAT 7214 7.659 105.373 133.632 1.00 0.00 H TER 38537 WAT 7214 ATOM 38537 O WAT 7215 46.051 135.470 2.379 1.00 0.00 O ATOM 38538 H1 WAT 7215 46.944 135.321 2.070 1.00 0.00 H ATOM 38539 H2 WAT 7215 46.004 135.000 3.211 1.00 0.00 H TER 38541 WAT 7215 ATOM 38541 O WAT 7216 23.496 42.052 93.156 1.00 0.00 O ATOM 38542 H1 WAT 7216 22.728 41.691 93.599 1.00 0.00 H ATOM 38543 H2 WAT 7216 24.165 42.101 93.839 1.00 0.00 H TER 38545 WAT 7216 ATOM 38545 O WAT 7217 23.948 89.370 110.377 1.00 0.00 O ATOM 38546 H1 WAT 7217 23.946 90.178 109.863 1.00 0.00 H ATOM 38547 H2 WAT 7217 24.176 88.686 109.747 1.00 0.00 H TER 38549 WAT 7217 ATOM 38549 O WAT 7218 56.593 130.133 69.215 1.00 0.00 O ATOM 38550 H1 WAT 7218 55.695 130.143 69.548 1.00 0.00 H ATOM 38551 H2 WAT 7218 56.508 129.838 68.308 1.00 0.00 H TER 38553 WAT 7218 ATOM 38553 O WAT 7219 11.680 124.989 28.635 1.00 0.00 O ATOM 38554 H1 WAT 7219 12.231 125.151 29.401 1.00 0.00 H ATOM 38555 H2 WAT 7219 12.239 125.206 27.889 1.00 0.00 H TER 38557 WAT 7219 ATOM 38557 O WAT 7220 67.002 136.143 95.379 1.00 0.00 O ATOM 38558 H1 WAT 7220 67.189 136.857 95.989 1.00 0.00 H ATOM 38559 H2 WAT 7220 66.231 136.438 94.894 1.00 0.00 H TER 38561 WAT 7220 ATOM 38561 O WAT 7221 105.730 131.922 145.280 1.00 0.00 O ATOM 38562 H1 WAT 7221 106.486 131.345 145.391 1.00 0.00 H ATOM 38563 H2 WAT 7221 105.055 131.361 144.898 1.00 0.00 H TER 38565 WAT 7221 ATOM 38565 O WAT 7222 111.379 124.928 76.850 1.00 0.00 O ATOM 38566 H1 WAT 7222 111.408 125.053 75.902 1.00 0.00 H ATOM 38567 H2 WAT 7222 110.630 124.349 76.992 1.00 0.00 H TER 38569 WAT 7222 ATOM 38569 O WAT 7223 33.237 23.461 100.714 1.00 0.00 O ATOM 38570 H1 WAT 7223 32.830 23.964 100.009 1.00 0.00 H ATOM 38571 H2 WAT 7223 33.887 24.055 101.089 1.00 0.00 H TER 38573 WAT 7223 ATOM 38573 O WAT 7224 40.618 110.049 67.811 1.00 0.00 O ATOM 38574 H1 WAT 7224 40.253 110.121 66.930 1.00 0.00 H ATOM 38575 H2 WAT 7224 39.885 110.254 68.392 1.00 0.00 H TER 38577 WAT 7224 ATOM 38577 O WAT 7225 23.272 125.926 0.080 1.00 0.00 O ATOM 38578 H1 WAT 7225 23.420 125.563 0.953 1.00 0.00 H ATOM 38579 H2 WAT 7225 23.182 126.868 0.225 1.00 0.00 H TER 38581 WAT 7225 ATOM 38581 O WAT 7226 34.114 129.379 118.007 1.00 0.00 O ATOM 38582 H1 WAT 7226 35.048 129.454 118.201 1.00 0.00 H ATOM 38583 H2 WAT 7226 33.971 128.441 117.879 1.00 0.00 H TER 38585 WAT 7226 ATOM 38585 O WAT 7227 92.099 57.994 140.290 1.00 0.00 O ATOM 38586 H1 WAT 7227 92.480 58.403 141.067 1.00 0.00 H ATOM 38587 H2 WAT 7227 91.639 57.225 140.625 1.00 0.00 H TER 38589 WAT 7227 ATOM 38589 O WAT 7228 77.612 21.648 121.950 1.00 0.00 O ATOM 38590 H1 WAT 7228 77.641 21.041 122.689 1.00 0.00 H ATOM 38591 H2 WAT 7228 77.068 21.206 121.298 1.00 0.00 H TER 38593 WAT 7228 ATOM 38593 O WAT 7229 40.187 139.263 113.261 1.00 0.00 O ATOM 38594 H1 WAT 7229 40.101 139.371 114.208 1.00 0.00 H ATOM 38595 H2 WAT 7229 39.857 138.381 113.089 1.00 0.00 H TER 38597 WAT 7229 ATOM 38597 O WAT 7230 99.337 118.886 84.449 1.00 0.00 O ATOM 38598 H1 WAT 7230 99.176 119.385 85.250 1.00 0.00 H ATOM 38599 H2 WAT 7230 99.558 118.007 84.755 1.00 0.00 H TER 38601 WAT 7230 ATOM 38601 O WAT 7231 62.997 43.616 142.983 1.00 0.00 O ATOM 38602 H1 WAT 7231 63.611 44.212 142.554 1.00 0.00 H ATOM 38603 H2 WAT 7231 63.420 42.758 142.929 1.00 0.00 H TER 38605 WAT 7231 ATOM 38605 O WAT 7232 135.279 4.044 151.403 1.00 0.00 O ATOM 38606 H1 WAT 7232 135.080 4.979 151.352 1.00 0.00 H ATOM 38607 H2 WAT 7232 136.214 4.009 151.604 1.00 0.00 H TER 38609 WAT 7232 ATOM 38609 O WAT 7233 106.017 125.600 6.477 1.00 0.00 O ATOM 38610 H1 WAT 7233 105.591 126.453 6.395 1.00 0.00 H ATOM 38611 H2 WAT 7233 105.564 125.044 5.843 1.00 0.00 H TER 38613 WAT 7233 ATOM 38613 O WAT 7234 138.834 88.322 22.104 1.00 0.00 O ATOM 38614 H1 WAT 7234 139.640 87.813 22.024 1.00 0.00 H ATOM 38615 H2 WAT 7234 138.254 87.771 22.629 1.00 0.00 H TER 38617 WAT 7234 ATOM 38617 O WAT 7235 40.278 54.618 30.304 1.00 0.00 O ATOM 38618 H1 WAT 7235 40.283 54.124 29.484 1.00 0.00 H ATOM 38619 H2 WAT 7235 40.694 54.034 30.937 1.00 0.00 H TER 38621 WAT 7235 ATOM 38621 O WAT 7236 30.610 44.482 81.221 1.00 0.00 O ATOM 38622 H1 WAT 7236 30.690 44.177 80.317 1.00 0.00 H ATOM 38623 H2 WAT 7236 29.708 44.277 81.465 1.00 0.00 H TER 38625 WAT 7236 ATOM 38625 O WAT 7237 66.736 13.021 87.187 1.00 0.00 O ATOM 38626 H1 WAT 7237 66.115 12.374 87.522 1.00 0.00 H ATOM 38627 H2 WAT 7237 66.196 13.782 86.973 1.00 0.00 H TER 38629 WAT 7237 ATOM 38629 O WAT 7238 91.373 18.124 153.006 1.00 0.00 O ATOM 38630 H1 WAT 7238 90.588 18.241 153.541 1.00 0.00 H ATOM 38631 H2 WAT 7238 91.042 18.026 152.113 1.00 0.00 H TER 38633 WAT 7238 ATOM 38633 O WAT 7239 138.645 16.433 141.644 1.00 0.00 O ATOM 38634 H1 WAT 7239 139.469 16.636 141.201 1.00 0.00 H ATOM 38635 H2 WAT 7239 138.658 16.973 142.435 1.00 0.00 H TER 38637 WAT 7239 ATOM 38637 O WAT 7240 72.067 13.563 130.059 1.00 0.00 O ATOM 38638 H1 WAT 7240 72.980 13.448 130.320 1.00 0.00 H ATOM 38639 H2 WAT 7240 72.114 13.978 129.198 1.00 0.00 H TER 38641 WAT 7240 ATOM 38641 O WAT 7241 125.063 32.178 150.756 1.00 0.00 O ATOM 38642 H1 WAT 7241 125.763 32.828 150.830 1.00 0.00 H ATOM 38643 H2 WAT 7241 124.333 32.556 151.248 1.00 0.00 H TER 38645 WAT 7241 ATOM 38645 O WAT 7242 78.029 31.086 146.204 1.00 0.00 O ATOM 38646 H1 WAT 7242 77.753 30.297 146.671 1.00 0.00 H ATOM 38647 H2 WAT 7242 77.369 31.741 146.429 1.00 0.00 H TER 38649 WAT 7242 ATOM 38649 O WAT 7243 80.472 18.771 76.832 1.00 0.00 O ATOM 38650 H1 WAT 7243 80.461 17.860 76.538 1.00 0.00 H ATOM 38651 H2 WAT 7243 79.665 18.870 77.337 1.00 0.00 H TER 38653 WAT 7243 ATOM 38653 O WAT 7244 10.619 18.956 126.396 1.00 0.00 O ATOM 38654 H1 WAT 7244 9.709 19.229 126.513 1.00 0.00 H ATOM 38655 H2 WAT 7244 11.134 19.702 126.703 1.00 0.00 H TER 38657 WAT 7244 ATOM 38657 O WAT 7245 122.862 92.934 85.251 1.00 0.00 O ATOM 38658 H1 WAT 7245 122.944 92.284 84.552 1.00 0.00 H ATOM 38659 H2 WAT 7245 123.630 92.789 85.804 1.00 0.00 H TER 38661 WAT 7245 ATOM 38661 O WAT 7246 63.091 74.514 122.727 1.00 0.00 O ATOM 38662 H1 WAT 7246 62.298 74.845 123.149 1.00 0.00 H ATOM 38663 H2 WAT 7246 63.272 73.686 123.173 1.00 0.00 H TER 38665 WAT 7246 ATOM 38665 O WAT 7247 21.341 129.946 112.612 1.00 0.00 O ATOM 38666 H1 WAT 7247 22.289 129.914 112.746 1.00 0.00 H ATOM 38667 H2 WAT 7247 21.008 129.181 113.080 1.00 0.00 H TER 38669 WAT 7247 ATOM 38669 O WAT 7248 90.988 86.309 118.732 1.00 0.00 O ATOM 38670 H1 WAT 7248 91.904 86.106 118.542 1.00 0.00 H ATOM 38671 H2 WAT 7248 90.946 87.265 118.717 1.00 0.00 H TER 38673 WAT 7248 ATOM 38673 O WAT 7249 107.309 116.122 63.691 1.00 0.00 O ATOM 38674 H1 WAT 7249 106.486 115.876 64.114 1.00 0.00 H ATOM 38675 H2 WAT 7249 107.479 115.414 63.069 1.00 0.00 H TER 38677 WAT 7249 ATOM 38677 O WAT 7250 46.947 90.344 60.219 1.00 0.00 O ATOM 38678 H1 WAT 7250 46.742 91.251 60.444 1.00 0.00 H ATOM 38679 H2 WAT 7250 46.127 89.991 59.874 1.00 0.00 H TER 38681 WAT 7250 ATOM 38681 O WAT 7251 64.952 57.160 87.272 1.00 0.00 O ATOM 38682 H1 WAT 7251 64.904 57.264 88.222 1.00 0.00 H ATOM 38683 H2 WAT 7251 64.237 56.560 87.060 1.00 0.00 H TER 38685 WAT 7251 ATOM 38685 O WAT 7252 64.310 119.371 95.522 1.00 0.00 O ATOM 38686 H1 WAT 7252 64.906 119.192 94.796 1.00 0.00 H ATOM 38687 H2 WAT 7252 64.691 120.131 95.963 1.00 0.00 H TER 38689 WAT 7252 ATOM 38689 O WAT 7253 48.441 119.451 58.896 1.00 0.00 O ATOM 38690 H1 WAT 7253 47.522 119.209 58.777 1.00 0.00 H ATOM 38691 H2 WAT 7253 48.637 120.020 58.151 1.00 0.00 H TER 38693 WAT 7253 ATOM 38693 O WAT 7254 88.330 78.982 86.614 1.00 0.00 O ATOM 38694 H1 WAT 7254 88.698 78.521 87.368 1.00 0.00 H ATOM 38695 H2 WAT 7254 87.792 79.675 86.995 1.00 0.00 H TER 38697 WAT 7254 ATOM 38697 O WAT 7255 39.608 91.338 23.722 1.00 0.00 O ATOM 38698 H1 WAT 7255 38.984 91.980 24.059 1.00 0.00 H ATOM 38699 H2 WAT 7255 40.109 91.816 23.060 1.00 0.00 H TER 38701 WAT 7255 ATOM 38701 O WAT 7256 22.722 46.641 91.096 1.00 0.00 O ATOM 38702 H1 WAT 7256 23.251 46.393 90.338 1.00 0.00 H ATOM 38703 H2 WAT 7256 21.975 46.043 91.073 1.00 0.00 H TER 38705 WAT 7256 ATOM 38705 O WAT 7257 28.370 70.796 100.335 1.00 0.00 O ATOM 38706 H1 WAT 7257 28.166 70.359 101.162 1.00 0.00 H ATOM 38707 H2 WAT 7257 29.117 71.359 100.540 1.00 0.00 H TER 38709 WAT 7257 ATOM 38709 O WAT 7258 82.927 51.698 113.172 1.00 0.00 O ATOM 38710 H1 WAT 7258 83.871 51.854 113.190 1.00 0.00 H ATOM 38711 H2 WAT 7258 82.814 50.990 112.537 1.00 0.00 H TER 38713 WAT 7258 ATOM 38713 O WAT 7259 71.381 58.069 130.307 1.00 0.00 O ATOM 38714 H1 WAT 7259 70.862 58.496 129.625 1.00 0.00 H ATOM 38715 H2 WAT 7259 70.877 57.289 130.539 1.00 0.00 H TER 38717 WAT 7259 ATOM 38717 O WAT 7260 136.465 125.926 80.098 1.00 0.00 O ATOM 38718 H1 WAT 7260 137.188 126.335 79.622 1.00 0.00 H ATOM 38719 H2 WAT 7260 135.688 126.134 79.579 1.00 0.00 H TER 38721 WAT 7260 ATOM 38721 O WAT 7261 57.088 63.178 142.135 1.00 0.00 O ATOM 38722 H1 WAT 7261 57.254 62.340 141.702 1.00 0.00 H ATOM 38723 H2 WAT 7261 56.335 63.542 141.670 1.00 0.00 H TER 38725 WAT 7261 ATOM 38725 O WAT 7262 54.523 99.492 19.935 1.00 0.00 O ATOM 38726 H1 WAT 7262 54.054 100.177 20.412 1.00 0.00 H ATOM 38727 H2 WAT 7262 55.444 99.746 19.995 1.00 0.00 H TER 38729 WAT 7262 ATOM 38729 O WAT 7263 9.323 97.273 113.284 1.00 0.00 O ATOM 38730 H1 WAT 7263 9.315 97.389 112.333 1.00 0.00 H ATOM 38731 H2 WAT 7263 10.206 96.961 113.480 1.00 0.00 H TER 38733 WAT 7263 ATOM 38733 O WAT 7264 133.359 36.736 110.924 1.00 0.00 O ATOM 38734 H1 WAT 7264 132.941 37.368 110.340 1.00 0.00 H ATOM 38735 H2 WAT 7264 132.637 36.358 111.425 1.00 0.00 H TER 38737 WAT 7264 ATOM 38737 O WAT 7265 60.573 62.444 92.442 1.00 0.00 O ATOM 38738 H1 WAT 7265 60.024 62.955 91.847 1.00 0.00 H ATOM 38739 H2 WAT 7265 60.784 63.050 93.153 1.00 0.00 H TER 38741 WAT 7265 ATOM 38741 O WAT 7266 122.954 23.706 15.098 1.00 0.00 O ATOM 38742 H1 WAT 7266 123.860 23.504 15.330 1.00 0.00 H ATOM 38743 H2 WAT 7266 122.475 23.641 15.925 1.00 0.00 H TER 38745 WAT 7266 ATOM 38745 O WAT 7267 109.645 48.041 153.811 1.00 0.00 O ATOM 38746 H1 WAT 7267 108.874 47.635 154.206 1.00 0.00 H ATOM 38747 H2 WAT 7267 109.747 47.595 152.970 1.00 0.00 H TER 38749 WAT 7267 ATOM 38749 O WAT 7268 14.118 1.665 5.028 1.00 0.00 O ATOM 38750 H1 WAT 7268 13.594 0.977 4.618 1.00 0.00 H ATOM 38751 H2 WAT 7268 14.273 2.298 4.328 1.00 0.00 H TER 38753 WAT 7268 ATOM 38753 O WAT 7269 93.848 57.975 0.467 1.00 0.00 O ATOM 38754 H1 WAT 7269 94.157 57.877 1.367 1.00 0.00 H ATOM 38755 H2 WAT 7269 92.904 57.820 0.520 1.00 0.00 H TER 38757 WAT 7269 ATOM 38757 O WAT 7270 60.619 122.117 109.678 1.00 0.00 O ATOM 38758 H1 WAT 7270 61.471 121.985 109.262 1.00 0.00 H ATOM 38759 H2 WAT 7270 60.657 123.010 110.021 1.00 0.00 H TER 38761 WAT 7270 ATOM 38761 O WAT 7271 129.100 52.310 85.014 1.00 0.00 O ATOM 38762 H1 WAT 7271 129.247 53.160 85.430 1.00 0.00 H ATOM 38763 H2 WAT 7271 129.880 52.168 84.478 1.00 0.00 H TER 38765 WAT 7271 ATOM 38765 O WAT 7272 82.753 111.552 58.085 1.00 0.00 O ATOM 38766 H1 WAT 7272 82.675 111.908 57.200 1.00 0.00 H ATOM 38767 H2 WAT 7272 82.641 110.608 57.974 1.00 0.00 H TER 38769 WAT 7272 ATOM 38769 O WAT 7273 140.209 122.138 7.015 1.00 0.00 O ATOM 38770 H1 WAT 7273 140.126 123.075 6.839 1.00 0.00 H ATOM 38771 H2 WAT 7273 139.647 121.986 7.775 1.00 0.00 H TER 38773 WAT 7273 ATOM 38773 O WAT 7274 94.180 67.667 117.158 1.00 0.00 O ATOM 38774 H1 WAT 7274 93.901 68.334 117.786 1.00 0.00 H ATOM 38775 H2 WAT 7274 94.683 68.151 116.503 1.00 0.00 H TER 38777 WAT 7274 ATOM 38777 O WAT 7275 25.036 123.196 17.042 1.00 0.00 O ATOM 38778 H1 WAT 7275 25.824 123.549 16.630 1.00 0.00 H ATOM 38779 H2 WAT 7275 24.695 122.567 16.405 1.00 0.00 H TER 38781 WAT 7275 ATOM 38781 O WAT 7276 16.630 67.907 73.892 1.00 0.00 O ATOM 38782 H1 WAT 7276 16.137 68.078 73.089 1.00 0.00 H ATOM 38783 H2 WAT 7276 16.701 68.762 74.316 1.00 0.00 H TER 38785 WAT 7276 ATOM 38785 O WAT 7277 126.953 108.278 10.112 1.00 0.00 O ATOM 38786 H1 WAT 7277 127.542 108.192 9.363 1.00 0.00 H ATOM 38787 H2 WAT 7277 126.113 108.530 9.728 1.00 0.00 H TER 38789 WAT 7277 ATOM 38789 O WAT 7278 63.343 54.378 65.929 1.00 0.00 O ATOM 38790 H1 WAT 7278 64.085 54.983 65.918 1.00 0.00 H ATOM 38791 H2 WAT 7278 63.322 54.008 65.047 1.00 0.00 H TER 38793 WAT 7278 ATOM 38793 O WAT 7279 11.942 40.996 115.833 1.00 0.00 O ATOM 38794 H1 WAT 7279 11.872 41.146 116.775 1.00 0.00 H ATOM 38795 H2 WAT 7279 11.468 41.728 115.438 1.00 0.00 H TER 38797 WAT 7279 ATOM 38797 O WAT 7280 138.108 56.092 119.488 1.00 0.00 O ATOM 38798 H1 WAT 7280 138.309 55.482 120.198 1.00 0.00 H ATOM 38799 H2 WAT 7280 137.561 55.587 118.886 1.00 0.00 H TER 38801 WAT 7280 ATOM 38801 O WAT 7281 85.974 122.940 80.427 1.00 0.00 O ATOM 38802 H1 WAT 7281 86.856 123.265 80.247 1.00 0.00 H ATOM 38803 H2 WAT 7281 85.411 123.709 80.331 1.00 0.00 H TER 38805 WAT 7281 ATOM 38805 O WAT 7282 107.208 85.656 116.543 1.00 0.00 O ATOM 38806 H1 WAT 7282 107.551 85.238 117.333 1.00 0.00 H ATOM 38807 H2 WAT 7282 106.356 86.002 116.806 1.00 0.00 H TER 38809 WAT 7282 ATOM 38809 O WAT 7283 86.316 65.421 70.739 1.00 0.00 O ATOM 38810 H1 WAT 7283 85.685 65.955 71.222 1.00 0.00 H ATOM 38811 H2 WAT 7283 85.925 64.547 70.719 1.00 0.00 H TER 38813 WAT 7283 ATOM 38813 O WAT 7284 100.941 114.562 90.860 1.00 0.00 O ATOM 38814 H1 WAT 7284 101.236 113.827 91.398 1.00 0.00 H ATOM 38815 H2 WAT 7284 101.709 114.805 90.344 1.00 0.00 H TER 38817 WAT 7284 ATOM 38817 O WAT 7285 91.249 1.058 85.211 1.00 0.00 O ATOM 38818 H1 WAT 7285 91.188 1.870 84.708 1.00 0.00 H ATOM 38819 H2 WAT 7285 91.650 0.432 84.608 1.00 0.00 H TER 38821 WAT 7285 ATOM 38821 O WAT 7286 86.172 7.597 70.959 1.00 0.00 O ATOM 38822 H1 WAT 7286 86.915 7.658 71.558 1.00 0.00 H ATOM 38823 H2 WAT 7286 85.518 7.088 71.439 1.00 0.00 H TER 38825 WAT 7286 ATOM 38825 O WAT 7287 16.515 46.678 136.695 1.00 0.00 O ATOM 38826 H1 WAT 7287 17.242 46.060 136.609 1.00 0.00 H ATOM 38827 H2 WAT 7287 16.339 46.966 135.800 1.00 0.00 H TER 38829 WAT 7287 ATOM 38829 O WAT 7288 3.898 82.395 99.174 1.00 0.00 O ATOM 38830 H1 WAT 7288 4.623 82.298 99.791 1.00 0.00 H ATOM 38831 H2 WAT 7288 4.005 81.667 98.561 1.00 0.00 H TER 38833 WAT 7288 ATOM 38833 O WAT 7289 6.337 85.045 151.508 1.00 0.00 O ATOM 38834 H1 WAT 7289 6.721 85.060 152.384 1.00 0.00 H ATOM 38835 H2 WAT 7289 5.971 85.922 151.392 1.00 0.00 H TER 38837 WAT 7289 ATOM 38837 O WAT 7290 91.544 109.818 101.753 1.00 0.00 O ATOM 38838 H1 WAT 7290 90.720 109.817 101.266 1.00 0.00 H ATOM 38839 H2 WAT 7290 91.950 110.657 101.535 1.00 0.00 H TER 38841 WAT 7290 ATOM 38841 O WAT 7291 50.316 108.295 66.007 1.00 0.00 O ATOM 38842 H1 WAT 7291 49.599 108.819 66.364 1.00 0.00 H ATOM 38843 H2 WAT 7291 50.084 108.170 65.086 1.00 0.00 H TER 38845 WAT 7291 ATOM 38845 O WAT 7292 140.778 88.581 140.653 1.00 0.00 O ATOM 38846 H1 WAT 7292 140.126 87.933 140.389 1.00 0.00 H ATOM 38847 H2 WAT 7292 140.273 89.378 140.814 1.00 0.00 H TER 38849 WAT 7292 ATOM 38849 O WAT 7293 79.603 58.752 157.241 1.00 0.00 O ATOM 38850 H1 WAT 7293 79.965 58.608 158.115 1.00 0.00 H ATOM 38851 H2 WAT 7293 80.298 59.209 156.766 1.00 0.00 H TER 38853 WAT 7293 ATOM 38853 O WAT 7294 132.384 94.768 16.870 1.00 0.00 O ATOM 38854 H1 WAT 7294 133.296 94.941 17.105 1.00 0.00 H ATOM 38855 H2 WAT 7294 131.972 95.632 16.858 1.00 0.00 H TER 38857 WAT 7294 ATOM 38857 O WAT 7295 51.988 66.762 73.257 1.00 0.00 O ATOM 38858 H1 WAT 7295 51.304 66.225 72.857 1.00 0.00 H ATOM 38859 H2 WAT 7295 52.805 66.318 73.031 1.00 0.00 H TER 38861 WAT 7295 ATOM 38861 O WAT 7296 77.834 1.880 103.002 1.00 0.00 O ATOM 38862 H1 WAT 7296 77.301 2.574 103.393 1.00 0.00 H ATOM 38863 H2 WAT 7296 78.318 1.507 103.739 1.00 0.00 H TER 38865 WAT 7296 ATOM 38865 O WAT 7297 121.939 92.747 127.844 1.00 0.00 O ATOM 38866 H1 WAT 7297 121.776 91.819 128.015 1.00 0.00 H ATOM 38867 H2 WAT 7297 122.634 92.751 127.186 1.00 0.00 H TER 38869 WAT 7297 ATOM 38869 O WAT 7298 130.411 12.327 145.781 1.00 0.00 O ATOM 38870 H1 WAT 7298 130.215 13.111 145.268 1.00 0.00 H ATOM 38871 H2 WAT 7298 131.327 12.133 145.580 1.00 0.00 H TER 38873 WAT 7298 ATOM 38873 O WAT 7299 137.947 55.832 13.085 1.00 0.00 O ATOM 38874 H1 WAT 7299 137.137 56.339 13.031 1.00 0.00 H ATOM 38875 H2 WAT 7299 137.680 54.933 12.894 1.00 0.00 H TER 38877 WAT 7299 ATOM 38877 O WAT 7300 130.252 28.669 135.308 1.00 0.00 O ATOM 38878 H1 WAT 7300 129.858 27.805 135.428 1.00 0.00 H ATOM 38879 H2 WAT 7300 130.318 28.773 134.359 1.00 0.00 H TER 38881 WAT 7300 ATOM 38881 O WAT 7301 20.040 18.038 6.835 1.00 0.00 O ATOM 38882 H1 WAT 7301 20.346 17.184 6.530 1.00 0.00 H ATOM 38883 H2 WAT 7301 20.486 18.669 6.271 1.00 0.00 H TER 38885 WAT 7301 ATOM 38885 O WAT 7302 124.564 31.167 80.864 1.00 0.00 O ATOM 38886 H1 WAT 7302 123.974 31.908 80.997 1.00 0.00 H ATOM 38887 H2 WAT 7302 124.567 30.709 81.704 1.00 0.00 H TER 38889 WAT 7302 ATOM 38889 O WAT 7303 113.426 142.668 8.528 1.00 0.00 O ATOM 38890 H1 WAT 7303 113.719 142.768 9.433 1.00 0.00 H ATOM 38891 H2 WAT 7303 114.139 142.196 8.096 1.00 0.00 H TER 38893 WAT 7303 ATOM 38893 O WAT 7304 102.640 85.883 156.788 1.00 0.00 O ATOM 38894 H1 WAT 7304 102.181 85.578 157.571 1.00 0.00 H ATOM 38895 H2 WAT 7304 102.521 86.833 156.795 1.00 0.00 H TER 38897 WAT 7304 ATOM 38897 O WAT 7305 22.972 30.925 108.066 1.00 0.00 O ATOM 38898 H1 WAT 7305 23.170 29.994 108.173 1.00 0.00 H ATOM 38899 H2 WAT 7305 22.883 31.044 107.121 1.00 0.00 H TER 38901 WAT 7305 ATOM 38901 O WAT 7306 108.419 77.759 87.291 1.00 0.00 O ATOM 38902 H1 WAT 7306 107.847 78.032 86.575 1.00 0.00 H ATOM 38903 H2 WAT 7306 109.295 78.031 87.016 1.00 0.00 H TER 38905 WAT 7306 ATOM 38905 O WAT 7307 59.648 39.911 98.884 1.00 0.00 O ATOM 38906 H1 WAT 7307 59.681 40.373 99.722 1.00 0.00 H ATOM 38907 H2 WAT 7307 58.715 39.758 98.732 1.00 0.00 H TER 38909 WAT 7307 ATOM 38909 O WAT 7308 108.772 16.704 143.820 1.00 0.00 O ATOM 38910 H1 WAT 7308 109.200 15.850 143.876 1.00 0.00 H ATOM 38911 H2 WAT 7308 108.123 16.693 144.524 1.00 0.00 H TER 38913 WAT 7308 ATOM 38913 O WAT 7309 5.690 62.051 100.700 1.00 0.00 O ATOM 38914 H1 WAT 7309 5.688 62.666 99.967 1.00 0.00 H ATOM 38915 H2 WAT 7309 6.607 61.795 100.795 1.00 0.00 H TER 38917 WAT 7309 ATOM 38917 O WAT 7310 77.018 39.188 102.255 1.00 0.00 O ATOM 38918 H1 WAT 7310 77.446 39.683 102.954 1.00 0.00 H ATOM 38919 H2 WAT 7310 76.593 39.855 101.716 1.00 0.00 H TER 38921 WAT 7310 ATOM 38921 O WAT 7311 87.114 114.221 113.294 1.00 0.00 O ATOM 38922 H1 WAT 7311 86.534 114.338 112.542 1.00 0.00 H ATOM 38923 H2 WAT 7311 86.663 114.659 114.016 1.00 0.00 H TER 38925 WAT 7311 ATOM 38925 O WAT 7312 58.507 45.624 134.293 1.00 0.00 O ATOM 38926 H1 WAT 7312 59.100 44.875 134.363 1.00 0.00 H ATOM 38927 H2 WAT 7312 57.706 45.338 134.732 1.00 0.00 H TER 38929 WAT 7312 ATOM 38929 O WAT 7313 90.181 29.769 2.586 1.00 0.00 O ATOM 38930 H1 WAT 7313 89.901 29.519 1.705 1.00 0.00 H ATOM 38931 H2 WAT 7313 89.821 29.089 3.154 1.00 0.00 H TER 38933 WAT 7313 ATOM 38933 O WAT 7314 65.850 57.648 84.282 1.00 0.00 O ATOM 38934 H1 WAT 7314 66.315 57.562 85.114 1.00 0.00 H ATOM 38935 H2 WAT 7314 66.255 58.406 83.859 1.00 0.00 H TER 38937 WAT 7314 ATOM 38937 O WAT 7315 45.877 96.982 149.835 1.00 0.00 O ATOM 38938 H1 WAT 7315 45.295 96.227 149.747 1.00 0.00 H ATOM 38939 H2 WAT 7315 46.563 96.687 150.434 1.00 0.00 H TER 38941 WAT 7315 ATOM 38941 O WAT 7316 126.876 112.495 64.868 1.00 0.00 O ATOM 38942 H1 WAT 7316 126.201 112.439 65.544 1.00 0.00 H ATOM 38943 H2 WAT 7316 127.180 111.594 64.758 1.00 0.00 H TER 38945 WAT 7316 ATOM 38945 O WAT 7317 62.395 80.310 131.472 1.00 0.00 O ATOM 38946 H1 WAT 7317 62.774 81.089 131.881 1.00 0.00 H ATOM 38947 H2 WAT 7317 63.054 80.029 130.837 1.00 0.00 H TER 38949 WAT 7317 ATOM 38949 O WAT 7318 134.960 26.734 70.060 1.00 0.00 O ATOM 38950 H1 WAT 7318 135.313 26.023 70.594 1.00 0.00 H ATOM 38951 H2 WAT 7318 135.731 27.226 69.776 1.00 0.00 H TER 38953 WAT 7318 ATOM 38953 O WAT 7319 74.221 50.764 114.421 1.00 0.00 O ATOM 38954 H1 WAT 7319 74.110 51.505 113.826 1.00 0.00 H ATOM 38955 H2 WAT 7319 73.685 50.986 115.182 1.00 0.00 H TER 38957 WAT 7319 ATOM 38957 O WAT 7320 62.588 43.964 110.429 1.00 0.00 O ATOM 38958 H1 WAT 7320 61.750 44.422 110.366 1.00 0.00 H ATOM 38959 H2 WAT 7320 63.180 44.468 109.871 1.00 0.00 H TER 38961 WAT 7320 ATOM 38961 O WAT 7321 123.111 98.734 106.854 1.00 0.00 O ATOM 38962 H1 WAT 7321 123.219 99.647 107.119 1.00 0.00 H ATOM 38963 H2 WAT 7321 122.764 98.298 107.632 1.00 0.00 H TER 38965 WAT 7321 ATOM 38965 O WAT 7322 119.880 37.436 56.763 1.00 0.00 O ATOM 38966 H1 WAT 7322 120.444 37.814 56.089 1.00 0.00 H ATOM 38967 H2 WAT 7322 120.448 36.831 57.240 1.00 0.00 H TER 38969 WAT 7322 ATOM 38969 O WAT 7323 130.991 108.147 58.047 1.00 0.00 O ATOM 38970 H1 WAT 7323 130.257 108.748 58.170 1.00 0.00 H ATOM 38971 H2 WAT 7323 130.819 107.727 57.204 1.00 0.00 H TER 38973 WAT 7323 ATOM 38973 O WAT 7324 40.872 114.948 51.066 1.00 0.00 O ATOM 38974 H1 WAT 7324 41.346 114.560 50.330 1.00 0.00 H ATOM 38975 H2 WAT 7324 40.001 114.554 51.024 1.00 0.00 H TER 38977 WAT 7324 ATOM 38977 O WAT 7325 16.692 108.125 71.499 1.00 0.00 O ATOM 38978 H1 WAT 7325 15.760 108.061 71.289 1.00 0.00 H ATOM 38979 H2 WAT 7325 16.891 109.058 71.421 1.00 0.00 H TER 38981 WAT 7325 ATOM 38981 O WAT 7326 58.577 82.165 102.574 1.00 0.00 O ATOM 38982 H1 WAT 7326 58.023 82.135 101.794 1.00 0.00 H ATOM 38983 H2 WAT 7326 59.436 81.872 102.269 1.00 0.00 H TER 38985 WAT 7326 ATOM 38985 O WAT 7327 107.235 27.637 103.363 1.00 0.00 O ATOM 38986 H1 WAT 7327 106.339 27.375 103.153 1.00 0.00 H ATOM 38987 H2 WAT 7327 107.173 28.574 103.552 1.00 0.00 H TER 38989 WAT 7327 ATOM 38989 O WAT 7328 64.899 59.385 64.975 1.00 0.00 O ATOM 38990 H1 WAT 7328 64.344 59.964 65.497 1.00 0.00 H ATOM 38991 H2 WAT 7328 65.481 58.972 65.613 1.00 0.00 H TER 38993 WAT 7328 ATOM 38993 O WAT 7329 63.396 104.842 102.584 1.00 0.00 O ATOM 38994 H1 WAT 7329 64.245 104.567 102.238 1.00 0.00 H ATOM 38995 H2 WAT 7329 62.759 104.315 102.101 1.00 0.00 H TER 38997 WAT 7329 ATOM 38997 O WAT 7330 80.319 81.920 120.226 1.00 0.00 O ATOM 38998 H1 WAT 7330 80.362 82.542 119.500 1.00 0.00 H ATOM 38999 H2 WAT 7330 79.425 82.000 120.557 1.00 0.00 H TER 39001 WAT 7330 ATOM 39001 O WAT 7331 36.602 130.022 153.551 1.00 0.00 O ATOM 39002 H1 WAT 7331 36.718 129.986 154.500 1.00 0.00 H ATOM 39003 H2 WAT 7331 37.056 130.821 153.284 1.00 0.00 H TER 39005 WAT 7331 ATOM 39005 O WAT 7332 4.970 41.144 155.151 1.00 0.00 O ATOM 39006 H1 WAT 7332 5.668 41.798 155.121 1.00 0.00 H ATOM 39007 H2 WAT 7332 4.178 41.647 155.340 1.00 0.00 H TER 39009 WAT 7332 ATOM 39009 O WAT 7333 10.368 38.514 88.144 1.00 0.00 O ATOM 39010 H1 WAT 7333 10.100 37.915 87.447 1.00 0.00 H ATOM 39011 H2 WAT 7333 9.778 38.315 88.871 1.00 0.00 H TER 39013 WAT 7333 ATOM 39013 O WAT 7334 130.257 12.035 148.587 1.00 0.00 O ATOM 39014 H1 WAT 7334 130.152 12.099 147.638 1.00 0.00 H ATOM 39015 H2 WAT 7334 130.438 11.109 148.746 1.00 0.00 H TER 39017 WAT 7334 ATOM 39017 O WAT 7335 38.808 10.576 83.844 1.00 0.00 O ATOM 39018 H1 WAT 7335 38.587 9.857 84.436 1.00 0.00 H ATOM 39019 H2 WAT 7335 38.986 11.317 84.424 1.00 0.00 H TER 39021 WAT 7335 ATOM 39021 O WAT 7336 3.076 92.229 83.078 1.00 0.00 O ATOM 39022 H1 WAT 7336 3.443 91.846 82.281 1.00 0.00 H ATOM 39023 H2 WAT 7336 3.511 91.761 83.791 1.00 0.00 H TER 39025 WAT 7336 ATOM 39025 O WAT 7337 66.390 142.402 115.535 1.00 0.00 O ATOM 39026 H1 WAT 7337 66.113 143.150 116.064 1.00 0.00 H ATOM 39027 H2 WAT 7337 67.286 142.612 115.272 1.00 0.00 H TER 39029 WAT 7337 ATOM 39029 O WAT 7338 112.009 9.592 115.624 1.00 0.00 O ATOM 39030 H1 WAT 7338 111.191 10.042 115.833 1.00 0.00 H ATOM 39031 H2 WAT 7338 112.128 8.966 116.338 1.00 0.00 H TER 39033 WAT 7338 ATOM 39033 O WAT 7339 101.702 116.615 16.149 1.00 0.00 O ATOM 39034 H1 WAT 7339 101.156 117.396 16.054 1.00 0.00 H ATOM 39035 H2 WAT 7339 102.035 116.662 17.045 1.00 0.00 H TER 39037 WAT 7339 ATOM 39037 O WAT 7340 3.640 138.379 145.011 1.00 0.00 O ATOM 39038 H1 WAT 7340 3.225 137.633 145.443 1.00 0.00 H ATOM 39039 H2 WAT 7340 2.960 139.053 144.991 1.00 0.00 H TER 39041 WAT 7340 ATOM 39041 O WAT 7341 46.156 118.177 58.283 1.00 0.00 O ATOM 39042 H1 WAT 7341 45.665 118.350 57.480 1.00 0.00 H ATOM 39043 H2 WAT 7341 46.699 117.417 58.073 1.00 0.00 H TER 39045 WAT 7341 ATOM 39045 O WAT 7342 4.129 108.419 111.876 1.00 0.00 O ATOM 39046 H1 WAT 7342 5.046 108.610 111.678 1.00 0.00 H ATOM 39047 H2 WAT 7342 3.635 108.903 111.214 1.00 0.00 H TER 39049 WAT 7342 ATOM 39049 O WAT 7343 67.998 10.994 61.912 1.00 0.00 O ATOM 39050 H1 WAT 7343 68.893 11.329 61.867 1.00 0.00 H ATOM 39051 H2 WAT 7343 67.902 10.461 61.122 1.00 0.00 H TER 39053 WAT 7343 ATOM 39053 O WAT 7344 26.720 138.838 55.190 1.00 0.00 O ATOM 39054 H1 WAT 7344 27.439 139.231 54.695 1.00 0.00 H ATOM 39055 H2 WAT 7344 25.933 139.256 54.842 1.00 0.00 H TER 39057 WAT 7344 ATOM 39057 O WAT 7345 145.531 92.207 105.258 1.00 0.00 O ATOM 39058 H1 WAT 7345 144.897 91.656 104.798 1.00 0.00 H ATOM 39059 H2 WAT 7345 145.732 92.908 104.638 1.00 0.00 H TER 39061 WAT 7345 ATOM 39061 O WAT 7346 35.509 125.051 149.844 1.00 0.00 O ATOM 39062 H1 WAT 7346 34.731 125.609 149.836 1.00 0.00 H ATOM 39063 H2 WAT 7346 36.005 125.320 149.070 1.00 0.00 H TER 39065 WAT 7346 ATOM 39065 O WAT 7347 42.753 37.000 27.148 1.00 0.00 O ATOM 39066 H1 WAT 7347 42.037 37.621 27.286 1.00 0.00 H ATOM 39067 H2 WAT 7347 43.546 37.534 27.201 1.00 0.00 H TER 39069 WAT 7347 ATOM 39069 O WAT 7348 97.913 79.818 132.716 1.00 0.00 O ATOM 39070 H1 WAT 7348 97.336 79.613 133.452 1.00 0.00 H ATOM 39071 H2 WAT 7348 98.656 80.271 133.114 1.00 0.00 H TER 39073 WAT 7348 ATOM 39073 O WAT 7349 123.275 85.495 101.838 1.00 0.00 O ATOM 39074 H1 WAT 7349 124.016 85.209 101.304 1.00 0.00 H ATOM 39075 H2 WAT 7349 123.433 85.102 102.697 1.00 0.00 H TER 39077 WAT 7349 ATOM 39077 O WAT 7350 26.464 31.247 67.810 1.00 0.00 O ATOM 39078 H1 WAT 7350 26.442 31.452 68.745 1.00 0.00 H ATOM 39079 H2 WAT 7350 27.391 31.290 67.577 1.00 0.00 H TER 39081 WAT 7350 ATOM 39081 O WAT 7351 97.156 40.130 102.562 1.00 0.00 O ATOM 39082 H1 WAT 7351 97.132 40.287 101.618 1.00 0.00 H ATOM 39083 H2 WAT 7351 97.957 40.562 102.857 1.00 0.00 H TER 39085 WAT 7351 ATOM 39085 O WAT 7352 107.276 132.408 79.558 1.00 0.00 O ATOM 39086 H1 WAT 7352 107.864 132.818 78.923 1.00 0.00 H ATOM 39087 H2 WAT 7352 107.710 131.588 79.792 1.00 0.00 H TER 39089 WAT 7352 ATOM 39089 O WAT 7353 100.246 113.030 26.479 1.00 0.00 O ATOM 39090 H1 WAT 7353 99.602 113.381 25.864 1.00 0.00 H ATOM 39091 H2 WAT 7353 100.203 112.082 26.356 1.00 0.00 H TER 39093 WAT 7353 ATOM 39093 O WAT 7354 65.881 143.430 24.616 1.00 0.00 O ATOM 39094 H1 WAT 7354 65.273 143.652 23.911 1.00 0.00 H ATOM 39095 H2 WAT 7354 66.713 143.268 24.172 1.00 0.00 H TER 39097 WAT 7354 ATOM 39097 O WAT 7355 107.371 77.913 13.286 1.00 0.00 O ATOM 39098 H1 WAT 7355 107.434 77.703 14.218 1.00 0.00 H ATOM 39099 H2 WAT 7355 106.503 77.602 13.029 1.00 0.00 H TER 39101 WAT 7355 ATOM 39101 O WAT 7356 110.055 119.979 112.591 1.00 0.00 O ATOM 39102 H1 WAT 7356 109.982 120.850 112.202 1.00 0.00 H ATOM 39103 H2 WAT 7356 110.324 119.415 111.865 1.00 0.00 H TER 39105 WAT 7356 ATOM 39105 O WAT 7357 142.385 120.344 7.242 1.00 0.00 O ATOM 39106 H1 WAT 7357 142.176 120.058 8.131 1.00 0.00 H ATOM 39107 H2 WAT 7357 141.638 120.884 6.983 1.00 0.00 H TER 39109 WAT 7357 ATOM 39109 O WAT 7358 137.314 10.348 87.069 1.00 0.00 O ATOM 39110 H1 WAT 7358 138.266 10.245 87.069 1.00 0.00 H ATOM 39111 H2 WAT 7358 137.161 11.160 86.586 1.00 0.00 H TER 39113 WAT 7358 ATOM 39113 O WAT 7359 117.655 55.065 56.214 1.00 0.00 O ATOM 39114 H1 WAT 7359 118.377 54.465 56.030 1.00 0.00 H ATOM 39115 H2 WAT 7359 116.940 54.497 56.502 1.00 0.00 H TER 39117 WAT 7359 ATOM 39117 O WAT 7360 55.807 91.295 71.817 1.00 0.00 O ATOM 39118 H1 WAT 7360 55.030 90.745 71.722 1.00 0.00 H ATOM 39119 H2 WAT 7360 56.542 90.689 71.726 1.00 0.00 H TER 39121 WAT 7360 ATOM 39121 O WAT 7361 57.894 98.626 98.268 1.00 0.00 O ATOM 39122 H1 WAT 7361 57.358 98.545 99.056 1.00 0.00 H ATOM 39123 H2 WAT 7361 58.220 97.741 98.107 1.00 0.00 H TER 39125 WAT 7361 ATOM 39125 O WAT 7362 41.324 37.377 90.923 1.00 0.00 O ATOM 39126 H1 WAT 7362 41.520 37.170 91.837 1.00 0.00 H ATOM 39127 H2 WAT 7362 40.697 36.705 90.655 1.00 0.00 H TER 39129 WAT 7362 ATOM 39129 O WAT 7363 12.853 21.223 109.416 1.00 0.00 O ATOM 39130 H1 WAT 7363 13.105 21.829 108.719 1.00 0.00 H ATOM 39131 H2 WAT 7363 13.636 20.692 109.566 1.00 0.00 H TER 39133 WAT 7363 ATOM 39133 O WAT 7364 45.192 63.090 79.500 1.00 0.00 O ATOM 39134 H1 WAT 7364 44.330 62.912 79.123 1.00 0.00 H ATOM 39135 H2 WAT 7364 45.044 63.817 80.104 1.00 0.00 H TER 39137 WAT 7364 ATOM 39137 O WAT 7365 56.453 142.021 70.391 1.00 0.00 O ATOM 39138 H1 WAT 7365 55.740 141.528 69.986 1.00 0.00 H ATOM 39139 H2 WAT 7365 56.918 142.419 69.655 1.00 0.00 H TER 39141 WAT 7365 ATOM 39141 O WAT 7366 48.172 125.953 59.047 1.00 0.00 O ATOM 39142 H1 WAT 7366 49.051 125.688 58.774 1.00 0.00 H ATOM 39143 H2 WAT 7366 47.591 125.566 58.392 1.00 0.00 H TER 39145 WAT 7366 ATOM 39145 O WAT 7367 87.255 83.386 55.641 1.00 0.00 O ATOM 39146 H1 WAT 7367 87.384 82.494 55.965 1.00 0.00 H ATOM 39147 H2 WAT 7367 86.313 83.536 55.722 1.00 0.00 H TER 39149 WAT 7367 ATOM 39149 O WAT 7368 88.932 63.229 97.279 1.00 0.00 O ATOM 39150 H1 WAT 7368 89.652 62.883 96.752 1.00 0.00 H ATOM 39151 H2 WAT 7368 89.302 63.997 97.715 1.00 0.00 H TER 39153 WAT 7368 ATOM 39153 O WAT 7369 35.920 71.346 145.036 1.00 0.00 O ATOM 39154 H1 WAT 7369 35.655 70.636 145.620 1.00 0.00 H ATOM 39155 H2 WAT 7369 36.814 71.123 144.777 1.00 0.00 H TER 39157 WAT 7369 ATOM 39157 O WAT 7370 50.281 52.714 12.774 1.00 0.00 O ATOM 39158 H1 WAT 7370 50.986 52.098 12.574 1.00 0.00 H ATOM 39159 H2 WAT 7370 50.572 53.160 13.570 1.00 0.00 H TER 39161 WAT 7370 ATOM 39161 O WAT 7371 11.803 34.647 105.531 1.00 0.00 O ATOM 39162 H1 WAT 7371 12.693 34.993 105.593 1.00 0.00 H ATOM 39163 H2 WAT 7371 11.874 33.912 104.922 1.00 0.00 H TER 39165 WAT 7371 ATOM 39165 O WAT 7372 53.890 115.009 13.816 1.00 0.00 O ATOM 39166 H1 WAT 7372 54.603 115.279 14.395 1.00 0.00 H ATOM 39167 H2 WAT 7372 53.463 115.828 13.565 1.00 0.00 H TER 39169 WAT 7372 ATOM 39169 O WAT 7373 48.973 4.808 70.948 1.00 0.00 O ATOM 39170 H1 WAT 7373 48.455 5.543 70.620 1.00 0.00 H ATOM 39171 H2 WAT 7373 49.854 5.167 71.060 1.00 0.00 H TER 39173 WAT 7373 ATOM 39173 O WAT 7374 114.337 40.329 84.340 1.00 0.00 O ATOM 39174 H1 WAT 7374 114.556 41.223 84.604 1.00 0.00 H ATOM 39175 H2 WAT 7374 114.091 39.892 85.155 1.00 0.00 H TER 39177 WAT 7374 ATOM 39177 O WAT 7375 136.800 102.650 105.813 1.00 0.00 O ATOM 39178 H1 WAT 7375 135.863 102.838 105.864 1.00 0.00 H ATOM 39179 H2 WAT 7375 137.186 103.162 106.523 1.00 0.00 H TER 39181 WAT 7375 ATOM 39181 O WAT 7376 46.578 116.948 7.826 1.00 0.00 O ATOM 39182 H1 WAT 7376 47.102 117.736 7.682 1.00 0.00 H ATOM 39183 H2 WAT 7376 47.004 116.509 8.563 1.00 0.00 H TER 39185 WAT 7376 ATOM 39185 O WAT 7377 104.048 49.751 84.298 1.00 0.00 O ATOM 39186 H1 WAT 7377 104.623 50.029 83.585 1.00 0.00 H ATOM 39187 H2 WAT 7377 104.617 49.722 85.067 1.00 0.00 H TER 39189 WAT 7377 ATOM 39189 O WAT 7378 102.354 103.682 11.094 1.00 0.00 O ATOM 39190 H1 WAT 7378 103.045 103.534 11.740 1.00 0.00 H ATOM 39191 H2 WAT 7378 101.669 103.055 11.329 1.00 0.00 H TER 39193 WAT 7378 ATOM 39193 O WAT 7379 110.766 28.391 101.010 1.00 0.00 O ATOM 39194 H1 WAT 7379 109.815 28.445 101.101 1.00 0.00 H ATOM 39195 H2 WAT 7379 111.051 27.881 101.768 1.00 0.00 H TER 39197 WAT 7379 ATOM 39197 O WAT 7380 57.689 75.147 140.117 1.00 0.00 O ATOM 39198 H1 WAT 7380 58.085 76.010 139.995 1.00 0.00 H ATOM 39199 H2 WAT 7380 58.434 74.551 140.200 1.00 0.00 H TER 39201 WAT 7380 ATOM 39201 O WAT 7381 145.013 128.606 64.431 1.00 0.00 O ATOM 39202 H1 WAT 7381 144.131 128.911 64.645 1.00 0.00 H ATOM 39203 H2 WAT 7381 144.989 128.447 63.487 1.00 0.00 H TER 39205 WAT 7381 ATOM 39205 O WAT 7382 137.474 93.096 61.264 1.00 0.00 O ATOM 39206 H1 WAT 7382 138.144 93.373 60.639 1.00 0.00 H ATOM 39207 H2 WAT 7382 137.103 92.301 60.881 1.00 0.00 H TER 39209 WAT 7382 ATOM 39209 O WAT 7383 34.593 32.304 10.354 1.00 0.00 O ATOM 39210 H1 WAT 7383 34.410 32.174 11.285 1.00 0.00 H ATOM 39211 H2 WAT 7383 34.299 33.197 10.175 1.00 0.00 H TER 39213 WAT 7383 ATOM 39213 O WAT 7384 108.799 84.718 114.468 1.00 0.00 O ATOM 39214 H1 WAT 7384 107.976 84.727 114.956 1.00 0.00 H ATOM 39215 H2 WAT 7384 109.083 85.632 114.460 1.00 0.00 H TER 39217 WAT 7384 ATOM 39217 O WAT 7385 104.767 27.693 99.430 1.00 0.00 O ATOM 39218 H1 WAT 7385 104.664 27.926 100.353 1.00 0.00 H ATOM 39219 H2 WAT 7385 103.998 27.159 99.230 1.00 0.00 H TER 39221 WAT 7385 ATOM 39221 O WAT 7386 53.563 111.316 87.292 1.00 0.00 O ATOM 39222 H1 WAT 7386 53.139 110.910 86.536 1.00 0.00 H ATOM 39223 H2 WAT 7386 53.056 111.011 88.044 1.00 0.00 H TER 39225 WAT 7386 ATOM 39225 O WAT 7387 72.719 31.548 0.350 1.00 0.00 O ATOM 39226 H1 WAT 7387 72.417 32.396 0.676 1.00 0.00 H ATOM 39227 H2 WAT 7387 72.563 31.585 -0.593 1.00 0.00 H TER 39229 WAT 7387 ATOM 39229 O WAT 7388 41.883 79.440 19.284 1.00 0.00 O ATOM 39230 H1 WAT 7388 41.929 78.720 18.654 1.00 0.00 H ATOM 39231 H2 WAT 7388 42.797 79.679 19.440 1.00 0.00 H TER 39233 WAT 7388 ATOM 39233 O WAT 7389 43.309 68.965 115.430 1.00 0.00 O ATOM 39234 H1 WAT 7389 43.615 68.301 114.813 1.00 0.00 H ATOM 39235 H2 WAT 7389 43.519 68.607 116.292 1.00 0.00 H TER 39237 WAT 7389 ATOM 39237 O WAT 7390 119.732 67.601 123.524 1.00 0.00 O ATOM 39238 H1 WAT 7390 119.930 66.907 124.153 1.00 0.00 H ATOM 39239 H2 WAT 7390 120.000 67.241 122.679 1.00 0.00 H TER 39241 WAT 7390 ATOM 39241 O WAT 7391 114.957 126.928 120.231 1.00 0.00 O ATOM 39242 H1 WAT 7391 115.404 127.771 120.149 1.00 0.00 H ATOM 39243 H2 WAT 7391 114.832 126.634 119.329 1.00 0.00 H TER 39245 WAT 7391 ATOM 39245 O WAT 7392 49.339 57.731 106.355 1.00 0.00 O ATOM 39246 H1 WAT 7392 48.867 56.953 106.652 1.00 0.00 H ATOM 39247 H2 WAT 7392 49.034 57.867 105.458 1.00 0.00 H TER 39249 WAT 7392 ATOM 39249 O WAT 7393 9.234 102.075 83.042 1.00 0.00 O ATOM 39250 H1 WAT 7393 10.171 102.261 82.982 1.00 0.00 H ATOM 39251 H2 WAT 7393 9.168 101.129 82.909 1.00 0.00 H TER 39253 WAT 7393 ATOM 39253 O WAT 7394 115.258 48.683 64.352 1.00 0.00 O ATOM 39254 H1 WAT 7394 115.331 48.011 65.030 1.00 0.00 H ATOM 39255 H2 WAT 7394 115.544 48.245 63.550 1.00 0.00 H TER 39257 WAT 7394 ATOM 39257 O WAT 7395 131.520 79.193 86.652 1.00 0.00 O ATOM 39258 H1 WAT 7395 132.340 78.795 86.358 1.00 0.00 H ATOM 39259 H2 WAT 7395 131.213 78.619 87.353 1.00 0.00 H TER 39261 WAT 7395 ATOM 39261 O WAT 7396 77.626 12.131 86.979 1.00 0.00 O ATOM 39262 H1 WAT 7396 78.161 11.666 87.622 1.00 0.00 H ATOM 39263 H2 WAT 7396 76.784 11.676 86.994 1.00 0.00 H TER 39265 WAT 7396 ATOM 39265 O WAT 7397 45.501 55.287 9.790 1.00 0.00 O ATOM 39266 H1 WAT 7397 45.432 54.456 9.321 1.00 0.00 H ATOM 39267 H2 WAT 7397 45.086 55.925 9.208 1.00 0.00 H TER 39269 WAT 7397 ATOM 39269 O WAT 7398 18.885 27.930 104.338 1.00 0.00 O ATOM 39270 H1 WAT 7398 19.775 28.212 104.548 1.00 0.00 H ATOM 39271 H2 WAT 7398 18.326 28.635 104.666 1.00 0.00 H TER 39273 WAT 7398 ATOM 39273 O WAT 7399 52.694 52.802 103.190 1.00 0.00 O ATOM 39274 H1 WAT 7399 53.251 52.348 103.822 1.00 0.00 H ATOM 39275 H2 WAT 7399 53.286 53.035 102.474 1.00 0.00 H TER 39277 WAT 7399 ATOM 39277 O WAT 7400 104.274 116.244 108.678 1.00 0.00 O ATOM 39278 H1 WAT 7400 103.852 116.830 109.306 1.00 0.00 H ATOM 39279 H2 WAT 7400 103.931 115.376 108.891 1.00 0.00 H TER 39281 WAT 7400 ATOM 39281 O WAT 7401 131.230 116.184 135.391 1.00 0.00 O ATOM 39282 H1 WAT 7401 131.319 115.854 134.497 1.00 0.00 H ATOM 39283 H2 WAT 7401 130.388 115.840 135.690 1.00 0.00 H TER 39285 WAT 7401 ATOM 39285 O WAT 7402 6.594 29.064 80.623 1.00 0.00 O ATOM 39286 H1 WAT 7402 5.655 28.940 80.490 1.00 0.00 H ATOM 39287 H2 WAT 7402 6.722 28.934 81.563 1.00 0.00 H TER 39289 WAT 7402 ATOM 39289 O WAT 7403 88.813 65.407 137.716 1.00 0.00 O ATOM 39290 H1 WAT 7403 88.714 66.336 137.506 1.00 0.00 H ATOM 39291 H2 WAT 7403 89.311 65.047 136.981 1.00 0.00 H TER 39293 WAT 7403 ATOM 39293 O WAT 7404 99.321 72.404 72.997 1.00 0.00 O ATOM 39294 H1 WAT 7404 99.887 71.635 72.923 1.00 0.00 H ATOM 39295 H2 WAT 7404 98.540 72.176 72.493 1.00 0.00 H TER 39297 WAT 7404 ATOM 39297 O WAT 7405 23.376 133.906 118.787 1.00 0.00 O ATOM 39298 H1 WAT 7405 23.622 133.010 119.020 1.00 0.00 H ATOM 39299 H2 WAT 7405 24.026 134.454 119.226 1.00 0.00 H TER 39301 WAT 7405 ATOM 39301 O WAT 7406 45.351 126.510 65.240 1.00 0.00 O ATOM 39302 H1 WAT 7406 44.437 126.239 65.151 1.00 0.00 H ATOM 39303 H2 WAT 7406 45.855 125.754 64.939 1.00 0.00 H TER 39305 WAT 7406 ATOM 39305 O WAT 7407 71.652 3.276 14.352 1.00 0.00 O ATOM 39306 H1 WAT 7407 72.245 2.967 15.038 1.00 0.00 H ATOM 39307 H2 WAT 7407 70.963 2.613 14.315 1.00 0.00 H TER 39309 WAT 7407 ATOM 39309 O WAT 7408 112.029 60.421 87.627 1.00 0.00 O ATOM 39310 H1 WAT 7408 111.661 61.167 88.101 1.00 0.00 H ATOM 39311 H2 WAT 7408 111.492 60.349 86.838 1.00 0.00 H TER 39313 WAT 7408 ATOM 39313 O WAT 7409 46.570 123.526 86.005 1.00 0.00 O ATOM 39314 H1 WAT 7409 46.344 122.827 86.619 1.00 0.00 H ATOM 39315 H2 WAT 7409 46.347 123.171 85.145 1.00 0.00 H TER 39317 WAT 7409 ATOM 39317 O WAT 7410 62.996 68.497 143.812 1.00 0.00 O ATOM 39318 H1 WAT 7410 62.179 68.530 143.315 1.00 0.00 H ATOM 39319 H2 WAT 7410 63.170 67.562 143.925 1.00 0.00 H TER 39321 WAT 7410 ATOM 39321 O WAT 7411 48.730 6.156 4.667 1.00 0.00 O ATOM 39322 H1 WAT 7411 49.354 5.655 4.143 1.00 0.00 H ATOM 39323 H2 WAT 7411 47.912 5.665 4.600 1.00 0.00 H TER 39325 WAT 7411 ATOM 39325 O WAT 7412 118.707 143.553 146.134 1.00 0.00 O ATOM 39326 H1 WAT 7412 118.885 143.323 147.046 1.00 0.00 H ATOM 39327 H2 WAT 7412 119.232 142.935 145.625 1.00 0.00 H TER 39329 WAT 7412 ATOM 39329 O WAT 7413 14.724 144.215 131.902 1.00 0.00 O ATOM 39330 H1 WAT 7413 15.672 144.224 131.768 1.00 0.00 H ATOM 39331 H2 WAT 7413 14.554 144.970 132.465 1.00 0.00 H TER 39333 WAT 7413 ATOM 39333 O WAT 7414 107.705 9.083 69.611 1.00 0.00 O ATOM 39334 H1 WAT 7414 107.361 9.047 68.719 1.00 0.00 H ATOM 39335 H2 WAT 7414 106.946 9.298 70.153 1.00 0.00 H TER 39337 WAT 7414 ATOM 39337 O WAT 7415 41.045 67.127 63.118 1.00 0.00 O ATOM 39338 H1 WAT 7415 41.632 67.839 63.374 1.00 0.00 H ATOM 39339 H2 WAT 7415 40.798 67.334 62.216 1.00 0.00 H TER 39341 WAT 7415 ATOM 39341 O WAT 7416 99.840 108.973 4.146 1.00 0.00 O ATOM 39342 H1 WAT 7416 100.440 108.577 4.778 1.00 0.00 H ATOM 39343 H2 WAT 7416 99.578 109.800 4.550 1.00 0.00 H TER 39345 WAT 7416 ATOM 39345 O WAT 7417 120.776 36.698 154.056 1.00 0.00 O ATOM 39346 H1 WAT 7417 119.842 36.762 153.853 1.00 0.00 H ATOM 39347 H2 WAT 7417 121.096 37.599 153.998 1.00 0.00 H TER 39349 WAT 7417 ATOM 39349 O WAT 7418 118.594 128.700 132.575 1.00 0.00 O ATOM 39350 H1 WAT 7418 118.983 127.839 132.418 1.00 0.00 H ATOM 39351 H2 WAT 7418 119.257 129.320 132.270 1.00 0.00 H TER 39353 WAT 7418 ATOM 39353 O WAT 7419 111.199 127.596 77.987 1.00 0.00 O ATOM 39354 H1 WAT 7419 111.683 128.183 77.405 1.00 0.00 H ATOM 39355 H2 WAT 7419 111.151 126.769 77.507 1.00 0.00 H TER 39357 WAT 7419 ATOM 39357 O WAT 7420 138.165 1.741 155.365 1.00 0.00 O ATOM 39358 H1 WAT 7420 138.580 1.095 155.936 1.00 0.00 H ATOM 39359 H2 WAT 7420 138.762 2.489 155.375 1.00 0.00 H TER 39361 WAT 7420 ATOM 39361 O WAT 7421 45.818 76.789 85.808 1.00 0.00 O ATOM 39362 H1 WAT 7421 45.351 76.052 85.414 1.00 0.00 H ATOM 39363 H2 WAT 7421 45.506 77.555 85.327 1.00 0.00 H TER 39365 WAT 7421 ATOM 39365 O WAT 7422 56.985 21.698 142.011 1.00 0.00 O ATOM 39366 H1 WAT 7422 56.057 21.548 142.187 1.00 0.00 H ATOM 39367 H2 WAT 7422 57.127 22.617 142.239 1.00 0.00 H TER 39369 WAT 7422 ATOM 39369 O WAT 7423 111.102 15.455 89.732 1.00 0.00 O ATOM 39370 H1 WAT 7423 110.362 14.853 89.813 1.00 0.00 H ATOM 39371 H2 WAT 7423 110.710 16.278 89.440 1.00 0.00 H TER 39373 WAT 7423 ATOM 39373 O WAT 7424 8.905 41.781 17.040 1.00 0.00 O ATOM 39374 H1 WAT 7424 9.048 41.763 17.987 1.00 0.00 H ATOM 39375 H2 WAT 7424 7.953 41.759 16.941 1.00 0.00 H TER 39377 WAT 7424 ATOM 39377 O WAT 7425 145.096 101.318 154.466 1.00 0.00 O ATOM 39378 H1 WAT 7425 144.918 102.258 154.440 1.00 0.00 H ATOM 39379 H2 WAT 7425 145.610 101.150 153.676 1.00 0.00 H TER 39381 WAT 7425 ATOM 39381 O WAT 7426 92.108 37.457 55.147 1.00 0.00 O ATOM 39382 H1 WAT 7426 92.877 36.998 54.809 1.00 0.00 H ATOM 39383 H2 WAT 7426 92.332 38.385 55.073 1.00 0.00 H TER 39385 WAT 7426 ATOM 39385 O WAT 7427 116.816 4.593 100.239 1.00 0.00 O ATOM 39386 H1 WAT 7427 116.944 5.477 99.896 1.00 0.00 H ATOM 39387 H2 WAT 7427 117.681 4.333 100.558 1.00 0.00 H TER 39389 WAT 7427 ATOM 39389 O WAT 7428 84.860 77.255 134.764 1.00 0.00 O ATOM 39390 H1 WAT 7428 85.428 76.527 135.019 1.00 0.00 H ATOM 39391 H2 WAT 7428 84.063 76.835 134.442 1.00 0.00 H TER 39393 WAT 7428 ATOM 39393 O WAT 7429 42.946 38.004 151.240 1.00 0.00 O ATOM 39394 H1 WAT 7429 42.717 37.093 151.055 1.00 0.00 H ATOM 39395 H2 WAT 7429 43.763 37.949 151.737 1.00 0.00 H TER 39397 WAT 7429 ATOM 39397 O WAT 7430 113.246 4.978 127.232 1.00 0.00 O ATOM 39398 H1 WAT 7430 113.350 5.880 127.534 1.00 0.00 H ATOM 39399 H2 WAT 7430 112.323 4.912 126.987 1.00 0.00 H TER 39401 WAT 7430 ATOM 39401 O WAT 7431 1.622 77.760 144.386 1.00 0.00 O ATOM 39402 H1 WAT 7431 2.453 78.074 144.743 1.00 0.00 H ATOM 39403 H2 WAT 7431 1.315 78.476 143.830 1.00 0.00 H TER 39405 WAT 7431 ATOM 39405 O WAT 7432 135.390 29.896 60.716 1.00 0.00 O ATOM 39406 H1 WAT 7432 135.452 29.685 59.785 1.00 0.00 H ATOM 39407 H2 WAT 7432 134.861 30.694 60.747 1.00 0.00 H TER 39409 WAT 7432 ATOM 39409 O WAT 7433 55.257 117.002 11.279 1.00 0.00 O ATOM 39410 H1 WAT 7433 55.672 117.702 10.775 1.00 0.00 H ATOM 39411 H2 WAT 7433 55.974 116.405 11.494 1.00 0.00 H TER 39413 WAT 7433 ATOM 39413 O WAT 7434 40.470 63.813 86.700 1.00 0.00 O ATOM 39414 H1 WAT 7434 40.889 63.513 85.894 1.00 0.00 H ATOM 39415 H2 WAT 7434 41.173 63.815 87.350 1.00 0.00 H TER 39417 WAT 7434 ATOM 39417 O WAT 7435 105.587 17.993 157.969 1.00 0.00 O ATOM 39418 H1 WAT 7435 104.660 18.196 158.094 1.00 0.00 H ATOM 39419 H2 WAT 7435 105.623 17.037 157.958 1.00 0.00 H TER 39421 WAT 7435 ATOM 39421 O WAT 7436 123.541 64.536 143.265 1.00 0.00 O ATOM 39422 H1 WAT 7436 123.363 65.395 143.650 1.00 0.00 H ATOM 39423 H2 WAT 7436 123.121 63.915 143.859 1.00 0.00 H TER 39425 WAT 7436 ATOM 39425 O WAT 7437 137.200 128.592 95.115 1.00 0.00 O ATOM 39426 H1 WAT 7437 136.509 127.931 95.151 1.00 0.00 H ATOM 39427 H2 WAT 7437 136.929 129.182 94.411 1.00 0.00 H TER 39429 WAT 7437 ATOM 39429 O WAT 7438 53.189 75.329 108.423 1.00 0.00 O ATOM 39430 H1 WAT 7438 53.045 76.238 108.684 1.00 0.00 H ATOM 39431 H2 WAT 7438 53.673 74.944 109.155 1.00 0.00 H TER 39433 WAT 7438 ATOM 39433 O WAT 7439 130.891 8.375 131.107 1.00 0.00 O ATOM 39434 H1 WAT 7439 130.700 7.555 131.563 1.00 0.00 H ATOM 39435 H2 WAT 7439 130.566 8.235 130.218 1.00 0.00 H TER 39437 WAT 7439 ATOM 39437 O WAT 7440 99.321 111.513 127.135 1.00 0.00 O ATOM 39438 H1 WAT 7440 98.931 111.897 127.920 1.00 0.00 H ATOM 39439 H2 WAT 7440 100.254 111.719 127.205 1.00 0.00 H TER 39441 WAT 7440 ATOM 39441 O WAT 7441 145.587 24.270 61.554 1.00 0.00 O ATOM 39442 H1 WAT 7441 146.083 24.684 62.260 1.00 0.00 H ATOM 39443 H2 WAT 7441 144.700 24.183 61.904 1.00 0.00 H TER 39445 WAT 7441 ATOM 39445 O WAT 7442 47.848 67.643 4.472 1.00 0.00 O ATOM 39446 H1 WAT 7442 46.895 67.691 4.541 1.00 0.00 H ATOM 39447 H2 WAT 7442 48.011 66.863 3.942 1.00 0.00 H TER 39449 WAT 7442 ATOM 39449 O WAT 7443 20.015 8.331 1.631 1.00 0.00 O ATOM 39450 H1 WAT 7443 19.386 7.959 2.248 1.00 0.00 H ATOM 39451 H2 WAT 7443 20.380 7.572 1.174 1.00 0.00 H TER 39453 WAT 7443 ATOM 39453 O WAT 7444 83.953 53.324 91.974 1.00 0.00 O ATOM 39454 H1 WAT 7444 83.649 54.156 92.337 1.00 0.00 H ATOM 39455 H2 WAT 7444 83.301 52.685 92.263 1.00 0.00 H TER 39457 WAT 7444 ATOM 39457 O WAT 7445 117.163 25.045 149.286 1.00 0.00 O ATOM 39458 H1 WAT 7445 116.856 24.432 149.954 1.00 0.00 H ATOM 39459 H2 WAT 7445 117.814 24.550 148.788 1.00 0.00 H TER 39461 WAT 7445 ATOM 39461 O WAT 7446 3.090 53.997 142.970 1.00 0.00 O ATOM 39462 H1 WAT 7446 3.925 54.259 142.583 1.00 0.00 H ATOM 39463 H2 WAT 7446 3.325 53.332 143.617 1.00 0.00 H TER 39465 WAT 7446 ATOM 39465 O WAT 7447 34.462 88.805 116.955 1.00 0.00 O ATOM 39466 H1 WAT 7447 34.892 89.622 116.701 1.00 0.00 H ATOM 39467 H2 WAT 7447 34.800 88.619 117.831 1.00 0.00 H TER 39469 WAT 7447 ATOM 39469 O WAT 7448 38.453 144.698 6.280 1.00 0.00 O ATOM 39470 H1 WAT 7448 37.642 144.508 5.809 1.00 0.00 H ATOM 39471 H2 WAT 7448 38.596 143.929 6.831 1.00 0.00 H TER 39473 WAT 7448 ATOM 39473 O WAT 7449 71.695 33.988 152.351 1.00 0.00 O ATOM 39474 H1 WAT 7449 71.292 34.079 153.214 1.00 0.00 H ATOM 39475 H2 WAT 7449 72.608 34.242 152.485 1.00 0.00 H TER 39477 WAT 7449 ATOM 39477 O WAT 7450 63.868 112.413 60.810 1.00 0.00 O ATOM 39478 H1 WAT 7450 63.646 113.232 60.367 1.00 0.00 H ATOM 39479 H2 WAT 7450 64.731 112.573 61.192 1.00 0.00 H TER 39481 WAT 7450 ATOM 39481 O WAT 7451 88.904 112.971 128.951 1.00 0.00 O ATOM 39482 H1 WAT 7451 88.176 113.578 129.086 1.00 0.00 H ATOM 39483 H2 WAT 7451 89.268 113.218 128.101 1.00 0.00 H TER 39485 WAT 7451 ATOM 39485 O WAT 7452 108.603 49.205 99.520 1.00 0.00 O ATOM 39486 H1 WAT 7452 108.694 48.529 98.849 1.00 0.00 H ATOM 39487 H2 WAT 7452 109.380 49.103 100.070 1.00 0.00 H TER 39489 WAT 7452 ATOM 39489 O WAT 7453 70.524 89.285 139.815 1.00 0.00 O ATOM 39490 H1 WAT 7453 70.638 90.172 139.474 1.00 0.00 H ATOM 39491 H2 WAT 7453 70.928 89.307 140.682 1.00 0.00 H TER 39493 WAT 7453 ATOM 39493 O WAT 7454 95.090 27.861 151.492 1.00 0.00 O ATOM 39494 H1 WAT 7454 94.832 27.008 151.143 1.00 0.00 H ATOM 39495 H2 WAT 7454 94.961 28.467 150.763 1.00 0.00 H TER 39497 WAT 7454 ATOM 39497 O WAT 7455 2.526 109.100 60.972 1.00 0.00 O ATOM 39498 H1 WAT 7455 1.903 108.727 60.348 1.00 0.00 H ATOM 39499 H2 WAT 7455 2.687 108.396 61.600 1.00 0.00 H TER 39501 WAT 7455 ATOM 39501 O WAT 7456 132.599 69.151 2.014 1.00 0.00 O ATOM 39502 H1 WAT 7456 132.736 69.354 2.939 1.00 0.00 H ATOM 39503 H2 WAT 7456 133.088 68.341 1.872 1.00 0.00 H TER 39505 WAT 7456 ATOM 39505 O WAT 7457 0.604 139.732 62.943 1.00 0.00 O ATOM 39506 H1 WAT 7457 1.238 139.917 62.250 1.00 0.00 H ATOM 39507 H2 WAT 7457 -0.185 140.206 62.679 1.00 0.00 H TER 39509 WAT 7457 ATOM 39509 O WAT 7458 13.470 53.923 134.191 1.00 0.00 O ATOM 39510 H1 WAT 7458 13.956 53.282 133.672 1.00 0.00 H ATOM 39511 H2 WAT 7458 14.057 54.677 134.251 1.00 0.00 H TER 39513 WAT 7458 ATOM 39513 O WAT 7459 129.972 40.935 90.534 1.00 0.00 O ATOM 39514 H1 WAT 7459 130.689 40.644 89.971 1.00 0.00 H ATOM 39515 H2 WAT 7459 129.942 40.288 91.239 1.00 0.00 H TER 39517 WAT 7459 ATOM 39517 O WAT 7460 2.400 85.150 74.872 1.00 0.00 O ATOM 39518 H1 WAT 7460 1.991 84.382 74.471 1.00 0.00 H ATOM 39519 H2 WAT 7460 1.795 85.868 74.685 1.00 0.00 H TER 39521 WAT 7460 ATOM 39521 O WAT 7461 45.951 89.222 135.631 1.00 0.00 O ATOM 39522 H1 WAT 7461 46.083 89.685 134.804 1.00 0.00 H ATOM 39523 H2 WAT 7461 46.748 89.394 136.132 1.00 0.00 H TER 39525 WAT 7461 ATOM 39525 O WAT 7462 80.663 27.800 86.405 1.00 0.00 O ATOM 39526 H1 WAT 7462 81.251 27.125 86.746 1.00 0.00 H ATOM 39527 H2 WAT 7462 81.219 28.339 85.842 1.00 0.00 H TER 39529 WAT 7462 ATOM 39529 O WAT 7463 49.327 107.194 138.506 1.00 0.00 O ATOM 39530 H1 WAT 7463 50.210 107.561 138.540 1.00 0.00 H ATOM 39531 H2 WAT 7463 49.120 106.981 139.416 1.00 0.00 H TER 39533 WAT 7463 ATOM 39533 O WAT 7464 127.097 117.894 122.249 1.00 0.00 O ATOM 39534 H1 WAT 7464 126.325 118.188 122.732 1.00 0.00 H ATOM 39535 H2 WAT 7464 127.753 118.573 122.408 1.00 0.00 H TER 39537 WAT 7464 ATOM 39537 O WAT 7465 24.514 8.822 3.164 1.00 0.00 O ATOM 39538 H1 WAT 7465 23.559 8.872 3.124 1.00 0.00 H ATOM 39539 H2 WAT 7465 24.691 8.046 3.697 1.00 0.00 H TER 39541 WAT 7465 ATOM 39541 O WAT 7466 141.700 103.674 126.560 1.00 0.00 O ATOM 39542 H1 WAT 7466 142.331 102.966 126.693 1.00 0.00 H ATOM 39543 H2 WAT 7466 141.777 104.215 127.346 1.00 0.00 H TER 39545 WAT 7466 ATOM 39545 O WAT 7467 58.394 72.513 128.981 1.00 0.00 O ATOM 39546 H1 WAT 7467 58.862 71.786 128.569 1.00 0.00 H ATOM 39547 H2 WAT 7467 57.568 72.130 129.275 1.00 0.00 H TER 39549 WAT 7467 ATOM 39549 O WAT 7468 122.828 7.003 63.407 1.00 0.00 O ATOM 39550 H1 WAT 7468 123.129 6.174 63.780 1.00 0.00 H ATOM 39551 H2 WAT 7468 122.932 6.893 62.462 1.00 0.00 H TER 39553 WAT 7468 ATOM 39553 O WAT 7469 123.648 21.868 135.471 1.00 0.00 O ATOM 39554 H1 WAT 7469 124.245 21.665 134.751 1.00 0.00 H ATOM 39555 H2 WAT 7469 124.223 22.080 136.206 1.00 0.00 H TER 39557 WAT 7469 ATOM 39557 O WAT 7470 125.914 125.462 125.978 1.00 0.00 O ATOM 39558 H1 WAT 7470 125.439 125.191 126.764 1.00 0.00 H ATOM 39559 H2 WAT 7470 126.636 124.837 125.908 1.00 0.00 H TER 39561 WAT 7470 ATOM 39561 O WAT 7471 28.353 6.971 116.548 1.00 0.00 O ATOM 39562 H1 WAT 7471 29.192 7.398 116.377 1.00 0.00 H ATOM 39563 H2 WAT 7471 27.699 7.589 116.221 1.00 0.00 H TER 39565 WAT 7471 ATOM 39565 O WAT 7472 72.366 53.978 113.935 1.00 0.00 O ATOM 39566 H1 WAT 7472 71.747 53.372 113.529 1.00 0.00 H ATOM 39567 H2 WAT 7472 72.018 54.122 114.815 1.00 0.00 H TER 39569 WAT 7472 ATOM 39569 O WAT 7473 13.965 132.029 87.499 1.00 0.00 O ATOM 39570 H1 WAT 7473 14.915 132.003 87.616 1.00 0.00 H ATOM 39571 H2 WAT 7473 13.840 132.443 86.646 1.00 0.00 H TER 39573 WAT 7473 ATOM 39573 O WAT 7474 121.628 87.354 1.504 1.00 0.00 O ATOM 39574 H1 WAT 7474 122.510 87.684 1.334 1.00 0.00 H ATOM 39575 H2 WAT 7474 121.717 86.831 2.301 1.00 0.00 H TER 39577 WAT 7474 ATOM 39577 O WAT 7475 13.671 14.444 87.126 1.00 0.00 O ATOM 39578 H1 WAT 7475 13.691 15.076 87.844 1.00 0.00 H ATOM 39579 H2 WAT 7475 14.353 14.743 86.525 1.00 0.00 H TER 39581 WAT 7475 ATOM 39581 O WAT 7476 94.975 82.623 111.766 1.00 0.00 O ATOM 39582 H1 WAT 7476 95.432 83.460 111.684 1.00 0.00 H ATOM 39583 H2 WAT 7476 94.678 82.600 112.676 1.00 0.00 H TER 39585 WAT 7476 ATOM 39585 O WAT 7477 61.001 93.202 155.401 1.00 0.00 O ATOM 39586 H1 WAT 7477 61.548 93.972 155.242 1.00 0.00 H ATOM 39587 H2 WAT 7477 61.514 92.470 155.060 1.00 0.00 H TER 39589 WAT 7477 ATOM 39589 O WAT 7478 59.149 42.718 118.697 1.00 0.00 O ATOM 39590 H1 WAT 7478 59.174 43.198 119.525 1.00 0.00 H ATOM 39591 H2 WAT 7478 58.598 43.254 118.126 1.00 0.00 H TER 39593 WAT 7478 ATOM 39593 O WAT 7479 58.826 91.675 6.638 1.00 0.00 O ATOM 39594 H1 WAT 7479 58.994 90.847 7.087 1.00 0.00 H ATOM 39595 H2 WAT 7479 59.184 91.549 5.760 1.00 0.00 H TER 39597 WAT 7479 ATOM 39597 O WAT 7480 72.104 22.245 69.490 1.00 0.00 O ATOM 39598 H1 WAT 7480 72.020 21.684 68.719 1.00 0.00 H ATOM 39599 H2 WAT 7480 71.230 22.614 69.614 1.00 0.00 H TER 39601 WAT 7480 ATOM 39601 O WAT 7481 108.825 35.325 19.555 1.00 0.00 O ATOM 39602 H1 WAT 7481 108.593 35.985 20.208 1.00 0.00 H ATOM 39603 H2 WAT 7481 108.961 34.524 20.062 1.00 0.00 H TER 39605 WAT 7481 ATOM 39605 O WAT 7482 95.819 50.528 76.148 1.00 0.00 O ATOM 39606 H1 WAT 7482 96.494 50.155 76.716 1.00 0.00 H ATOM 39607 H2 WAT 7482 95.364 51.162 76.701 1.00 0.00 H TER 39609 WAT 7482 ATOM 39609 O WAT 7483 12.465 66.606 104.544 1.00 0.00 O ATOM 39610 H1 WAT 7483 11.560 66.344 104.379 1.00 0.00 H ATOM 39611 H2 WAT 7483 12.444 67.563 104.532 1.00 0.00 H TER 39613 WAT 7483 ATOM 39613 O WAT 7484 130.920 134.101 149.754 1.00 0.00 O ATOM 39614 H1 WAT 7484 131.686 134.515 150.150 1.00 0.00 H ATOM 39615 H2 WAT 7484 130.716 133.367 150.333 1.00 0.00 H TER 39617 WAT 7484 ATOM 39617 O WAT 7485 45.636 140.726 80.383 1.00 0.00 O ATOM 39618 H1 WAT 7485 45.688 139.892 80.849 1.00 0.00 H ATOM 39619 H2 WAT 7485 45.066 140.547 79.635 1.00 0.00 H TER 39621 WAT 7485 ATOM 39621 O WAT 7486 60.521 69.440 143.011 1.00 0.00 O ATOM 39622 H1 WAT 7486 59.697 69.562 143.483 1.00 0.00 H ATOM 39623 H2 WAT 7486 60.991 70.265 143.134 1.00 0.00 H TER 39625 WAT 7486 ATOM 39625 O WAT 7487 138.348 37.502 109.492 1.00 0.00 O ATOM 39626 H1 WAT 7487 137.559 37.398 108.960 1.00 0.00 H ATOM 39627 H2 WAT 7487 139.009 37.828 108.880 1.00 0.00 H TER 39629 WAT 7487 ATOM 39629 O WAT 7488 13.241 74.740 142.936 1.00 0.00 O ATOM 39630 H1 WAT 7488 13.924 74.902 143.587 1.00 0.00 H ATOM 39631 H2 WAT 7488 12.539 75.348 143.169 1.00 0.00 H TER 39633 WAT 7488 ATOM 39633 O WAT 7489 50.503 119.401 10.196 1.00 0.00 O ATOM 39634 H1 WAT 7489 50.814 120.289 10.019 1.00 0.00 H ATOM 39635 H2 WAT 7489 49.551 119.463 10.125 1.00 0.00 H TER 39637 WAT 7489 ATOM 39637 O WAT 7490 134.527 57.389 136.699 1.00 0.00 O ATOM 39638 H1 WAT 7490 134.191 58.050 136.093 1.00 0.00 H ATOM 39639 H2 WAT 7490 134.868 57.893 137.438 1.00 0.00 H TER 39641 WAT 7490 ATOM 39641 O WAT 7491 15.680 124.384 16.229 1.00 0.00 O ATOM 39642 H1 WAT 7491 16.176 123.780 16.782 1.00 0.00 H ATOM 39643 H2 WAT 7491 15.064 123.825 15.756 1.00 0.00 H TER 39645 WAT 7491 ATOM 39645 O WAT 7492 27.609 137.206 83.369 1.00 0.00 O ATOM 39646 H1 WAT 7492 26.850 137.093 83.941 1.00 0.00 H ATOM 39647 H2 WAT 7492 28.290 136.663 83.765 1.00 0.00 H TER 39649 WAT 7492 ATOM 39649 O WAT 7493 142.211 9.359 71.455 1.00 0.00 O ATOM 39650 H1 WAT 7493 141.839 10.191 71.749 1.00 0.00 H ATOM 39651 H2 WAT 7493 143.038 9.599 71.037 1.00 0.00 H TER 39653 WAT 7493 ATOM 39653 O WAT 7494 112.820 41.162 107.057 1.00 0.00 O ATOM 39654 H1 WAT 7494 112.970 41.808 107.748 1.00 0.00 H ATOM 39655 H2 WAT 7494 112.616 40.353 107.527 1.00 0.00 H TER 39657 WAT 7494 ATOM 39657 O WAT 7495 68.033 100.400 96.180 1.00 0.00 O ATOM 39658 H1 WAT 7495 68.785 100.021 96.636 1.00 0.00 H ATOM 39659 H2 WAT 7495 67.691 101.056 96.787 1.00 0.00 H TER 39661 WAT 7495 ATOM 39661 O WAT 7496 9.676 16.337 78.227 1.00 0.00 O ATOM 39662 H1 WAT 7496 9.728 17.197 78.645 1.00 0.00 H ATOM 39663 H2 WAT 7496 9.489 16.529 77.308 1.00 0.00 H TER 39665 WAT 7496 ATOM 39665 O WAT 7497 36.701 139.618 67.019 1.00 0.00 O ATOM 39666 H1 WAT 7497 36.209 139.495 66.207 1.00 0.00 H ATOM 39667 H2 WAT 7497 36.114 140.126 67.580 1.00 0.00 H TER 39669 WAT 7497 ATOM 39669 O WAT 7498 13.770 126.092 150.726 1.00 0.00 O ATOM 39670 H1 WAT 7498 13.672 125.140 150.715 1.00 0.00 H ATOM 39671 H2 WAT 7498 13.292 126.391 149.952 1.00 0.00 H TER 39673 WAT 7498 ATOM 39673 O WAT 7499 82.924 7.442 59.420 1.00 0.00 O ATOM 39674 H1 WAT 7499 83.815 7.650 59.703 1.00 0.00 H ATOM 39675 H2 WAT 7499 82.938 6.498 59.260 1.00 0.00 H TER 39677 WAT 7499 ATOM 39677 O WAT 7500 64.285 70.274 136.870 1.00 0.00 O ATOM 39678 H1 WAT 7500 65.108 69.786 136.894 1.00 0.00 H ATOM 39679 H2 WAT 7500 64.492 71.114 137.280 1.00 0.00 H TER 39681 WAT 7500 ATOM 39681 O WAT 7501 39.639 72.074 5.899 1.00 0.00 O ATOM 39682 H1 WAT 7501 40.528 72.315 6.160 1.00 0.00 H ATOM 39683 H2 WAT 7501 39.166 71.972 6.725 1.00 0.00 H TER 39685 WAT 7501 ATOM 39685 O WAT 7502 21.789 58.231 12.009 1.00 0.00 O ATOM 39686 H1 WAT 7502 22.649 58.179 12.426 1.00 0.00 H ATOM 39687 H2 WAT 7502 21.390 57.377 12.175 1.00 0.00 H TER 39689 WAT 7502 ATOM 39689 O WAT 7503 142.903 70.927 18.962 1.00 0.00 O ATOM 39690 H1 WAT 7503 141.972 70.769 18.801 1.00 0.00 H ATOM 39691 H2 WAT 7503 143.230 70.096 19.306 1.00 0.00 H TER 39693 WAT 7503 ATOM 39693 O WAT 7504 87.086 35.525 105.776 1.00 0.00 O ATOM 39694 H1 WAT 7504 87.074 36.310 105.228 1.00 0.00 H ATOM 39695 H2 WAT 7504 86.840 34.815 105.183 1.00 0.00 H TER 39697 WAT 7504 ATOM 39697 O WAT 7505 3.198 12.632 60.936 1.00 0.00 O ATOM 39698 H1 WAT 7505 3.538 13.189 60.235 1.00 0.00 H ATOM 39699 H2 WAT 7505 3.915 12.029 61.132 1.00 0.00 H TER 39701 WAT 7505 ATOM 39701 O WAT 7506 49.276 97.164 142.781 1.00 0.00 O ATOM 39702 H1 WAT 7506 49.447 98.018 142.384 1.00 0.00 H ATOM 39703 H2 WAT 7506 50.025 96.626 142.525 1.00 0.00 H TER 39705 WAT 7506 ATOM 39705 O WAT 7507 105.168 133.351 13.020 1.00 0.00 O ATOM 39706 H1 WAT 7507 105.720 132.912 12.373 1.00 0.00 H ATOM 39707 H2 WAT 7507 105.203 132.783 13.789 1.00 0.00 H TER 39709 WAT 7507 ATOM 39709 O WAT 7508 63.455 14.867 12.868 1.00 0.00 O ATOM 39710 H1 WAT 7508 63.966 14.594 12.106 1.00 0.00 H ATOM 39711 H2 WAT 7508 62.546 14.842 12.570 1.00 0.00 H TER 39713 WAT 7508 ATOM 39713 O WAT 7509 61.213 134.195 123.263 1.00 0.00 O ATOM 39714 H1 WAT 7509 60.995 134.344 124.183 1.00 0.00 H ATOM 39715 H2 WAT 7509 60.893 134.976 122.812 1.00 0.00 H TER 39717 WAT 7509 ATOM 39717 O WAT 7510 40.365 115.136 3.118 1.00 0.00 O ATOM 39718 H1 WAT 7510 40.607 115.686 3.863 1.00 0.00 H ATOM 39719 H2 WAT 7510 39.965 114.361 3.513 1.00 0.00 H TER 39721 WAT 7510 ATOM 39721 O WAT 7511 116.671 108.541 132.719 1.00 0.00 O ATOM 39722 H1 WAT 7511 116.773 107.590 132.709 1.00 0.00 H ATOM 39723 H2 WAT 7511 116.142 108.716 133.497 1.00 0.00 H TER 39725 WAT 7511 ATOM 39725 O WAT 7512 95.556 138.963 144.405 1.00 0.00 O ATOM 39726 H1 WAT 7512 95.644 139.868 144.705 1.00 0.00 H ATOM 39727 H2 WAT 7512 95.861 138.981 143.497 1.00 0.00 H TER 39729 WAT 7512 ATOM 39729 O WAT 7513 103.403 143.413 142.621 1.00 0.00 O ATOM 39730 H1 WAT 7513 104.054 142.714 142.560 1.00 0.00 H ATOM 39731 H2 WAT 7513 102.571 142.956 142.740 1.00 0.00 H TER 39733 WAT 7513 ATOM 39733 O WAT 7514 24.483 119.644 98.516 1.00 0.00 O ATOM 39734 H1 WAT 7514 24.101 118.767 98.509 1.00 0.00 H ATOM 39735 H2 WAT 7514 23.860 120.181 98.026 1.00 0.00 H TER 39737 WAT 7514 ATOM 39737 O WAT 7515 29.435 95.565 14.168 1.00 0.00 O ATOM 39738 H1 WAT 7515 29.532 95.671 13.221 1.00 0.00 H ATOM 39739 H2 WAT 7515 28.708 96.143 14.400 1.00 0.00 H TER 39741 WAT 7515 ATOM 39741 O WAT 7516 78.321 7.761 26.396 1.00 0.00 O ATOM 39742 H1 WAT 7516 77.792 8.018 25.640 1.00 0.00 H ATOM 39743 H2 WAT 7516 78.758 8.568 26.668 1.00 0.00 H TER 39745 WAT 7516 ATOM 39745 O WAT 7517 96.482 141.899 59.726 1.00 0.00 O ATOM 39746 H1 WAT 7517 97.311 141.886 59.247 1.00 0.00 H ATOM 39747 H2 WAT 7517 96.739 141.904 60.648 1.00 0.00 H TER 39749 WAT 7517 ATOM 39749 O WAT 7518 143.965 130.399 105.485 1.00 0.00 O ATOM 39750 H1 WAT 7518 143.057 130.308 105.198 1.00 0.00 H ATOM 39751 H2 WAT 7518 144.469 130.451 104.673 1.00 0.00 H TER 39753 WAT 7518 ATOM 39753 O WAT 7519 97.685 102.237 114.404 1.00 0.00 O ATOM 39754 H1 WAT 7519 96.857 101.758 114.372 1.00 0.00 H ATOM 39755 H2 WAT 7519 97.697 102.636 115.274 1.00 0.00 H TER 39757 WAT 7519 ATOM 39757 O WAT 7520 89.270 137.751 9.567 1.00 0.00 O ATOM 39758 H1 WAT 7520 89.052 137.996 10.466 1.00 0.00 H ATOM 39759 H2 WAT 7520 89.347 138.585 9.103 1.00 0.00 H TER 39761 WAT 7520 ATOM 39761 O WAT 7521 37.025 71.994 104.038 1.00 0.00 O ATOM 39762 H1 WAT 7521 36.526 71.809 103.242 1.00 0.00 H ATOM 39763 H2 WAT 7521 36.404 71.843 104.750 1.00 0.00 H TER 39765 WAT 7521 ATOM 39765 O WAT 7522 128.999 133.042 88.872 1.00 0.00 O ATOM 39766 H1 WAT 7522 129.124 133.357 87.977 1.00 0.00 H ATOM 39767 H2 WAT 7522 128.781 132.116 88.772 1.00 0.00 H TER 39769 WAT 7522 ATOM 39769 O WAT 7523 3.998 36.868 107.577 1.00 0.00 O ATOM 39770 H1 WAT 7523 4.586 36.304 108.080 1.00 0.00 H ATOM 39771 H2 WAT 7523 3.216 36.334 107.437 1.00 0.00 H TER 39773 WAT 7523 ATOM 39773 O WAT 7524 72.063 72.767 154.664 1.00 0.00 O ATOM 39774 H1 WAT 7524 71.607 72.024 154.268 1.00 0.00 H ATOM 39775 H2 WAT 7524 72.981 72.640 154.422 1.00 0.00 H TER 39777 WAT 7524 ATOM 39777 O WAT 7525 137.617 64.899 126.197 1.00 0.00 O ATOM 39778 H1 WAT 7525 137.736 65.661 126.763 1.00 0.00 H ATOM 39779 H2 WAT 7525 136.926 64.391 126.622 1.00 0.00 H TER 39781 WAT 7525 ATOM 39781 O WAT 7526 143.115 20.591 153.943 1.00 0.00 O ATOM 39782 H1 WAT 7526 143.076 20.878 153.031 1.00 0.00 H ATOM 39783 H2 WAT 7526 142.235 20.262 154.128 1.00 0.00 H TER 39785 WAT 7526 ATOM 39785 O WAT 7527 22.728 93.562 82.438 1.00 0.00 O ATOM 39786 H1 WAT 7527 22.767 94.486 82.683 1.00 0.00 H ATOM 39787 H2 WAT 7527 22.977 93.092 83.234 1.00 0.00 H TER 39789 WAT 7527 ATOM 39789 O WAT 7528 140.011 122.663 115.937 1.00 0.00 O ATOM 39790 H1 WAT 7528 140.829 122.165 115.950 1.00 0.00 H ATOM 39791 H2 WAT 7528 139.714 122.613 115.029 1.00 0.00 H TER 39793 WAT 7528 ATOM 39793 O WAT 7529 133.790 99.823 85.158 1.00 0.00 O ATOM 39794 H1 WAT 7529 132.874 99.655 84.934 1.00 0.00 H ATOM 39795 H2 WAT 7529 134.019 99.125 85.771 1.00 0.00 H TER 39797 WAT 7529 ATOM 39797 O WAT 7530 92.229 70.975 137.047 1.00 0.00 O ATOM 39798 H1 WAT 7530 93.093 71.220 136.716 1.00 0.00 H ATOM 39799 H2 WAT 7530 92.324 70.060 137.311 1.00 0.00 H TER 39801 WAT 7530 ATOM 39801 O WAT 7531 142.747 39.907 137.328 1.00 0.00 O ATOM 39802 H1 WAT 7531 142.066 40.264 137.899 1.00 0.00 H ATOM 39803 H2 WAT 7531 143.117 39.177 137.823 1.00 0.00 H TER 39805 WAT 7531 ATOM 39805 O WAT 7532 132.321 41.734 23.821 1.00 0.00 O ATOM 39806 H1 WAT 7532 133.036 41.952 23.223 1.00 0.00 H ATOM 39807 H2 WAT 7532 131.936 40.938 23.454 1.00 0.00 H TER 39809 WAT 7532 ATOM 39809 O WAT 7533 135.333 119.667 5.032 1.00 0.00 O ATOM 39810 H1 WAT 7533 135.016 120.201 5.761 1.00 0.00 H ATOM 39811 H2 WAT 7533 135.281 120.245 4.271 1.00 0.00 H TER 39813 WAT 7533 ATOM 39813 O WAT 7534 140.480 108.682 149.974 1.00 0.00 O ATOM 39814 H1 WAT 7534 140.302 108.999 150.859 1.00 0.00 H ATOM 39815 H2 WAT 7534 141.049 107.922 150.102 1.00 0.00 H TER 39817 WAT 7534 ATOM 39817 O WAT 7535 136.697 83.526 91.543 1.00 0.00 O ATOM 39818 H1 WAT 7535 137.214 82.866 91.082 1.00 0.00 H ATOM 39819 H2 WAT 7535 137.321 84.226 91.738 1.00 0.00 H TER 39821 WAT 7535 ATOM 39821 O WAT 7536 78.111 116.642 87.691 1.00 0.00 O ATOM 39822 H1 WAT 7536 78.684 117.379 87.902 1.00 0.00 H ATOM 39823 H2 WAT 7536 77.282 117.047 87.437 1.00 0.00 H TER 39825 WAT 7536 ATOM 39825 O WAT 7537 133.149 0.443 130.794 1.00 0.00 O ATOM 39826 H1 WAT 7537 132.662 1.242 130.996 1.00 0.00 H ATOM 39827 H2 WAT 7537 132.975 -0.137 131.535 1.00 0.00 H TER 39829 WAT 7537 ATOM 39829 O WAT 7538 142.993 128.669 115.001 1.00 0.00 O ATOM 39830 H1 WAT 7538 143.601 128.975 115.674 1.00 0.00 H ATOM 39831 H2 WAT 7538 143.143 129.254 114.258 1.00 0.00 H TER 39833 WAT 7538 ATOM 39833 O WAT 7539 145.278 117.718 136.781 1.00 0.00 O ATOM 39834 H1 WAT 7539 145.116 116.844 136.428 1.00 0.00 H ATOM 39835 H2 WAT 7539 144.448 117.971 137.186 1.00 0.00 H TER 39837 WAT 7539 ATOM 39837 O WAT 7540 57.794 127.265 137.580 1.00 0.00 O ATOM 39838 H1 WAT 7540 58.458 126.590 137.441 1.00 0.00 H ATOM 39839 H2 WAT 7540 57.693 127.682 136.724 1.00 0.00 H TER 39841 WAT 7540 ATOM 39841 O WAT 7541 107.935 124.097 61.715 1.00 0.00 O ATOM 39842 H1 WAT 7541 107.864 123.761 60.822 1.00 0.00 H ATOM 39843 H2 WAT 7541 107.784 125.038 61.630 1.00 0.00 H TER 39845 WAT 7541 ATOM 39845 O WAT 7542 21.408 66.613 72.956 1.00 0.00 O ATOM 39846 H1 WAT 7542 20.763 67.290 73.162 1.00 0.00 H ATOM 39847 H2 WAT 7542 21.002 65.798 73.251 1.00 0.00 H TER 39849 WAT 7542 ATOM 39849 O WAT 7543 109.733 92.765 54.212 1.00 0.00 O ATOM 39850 H1 WAT 7543 109.814 93.222 53.375 1.00 0.00 H ATOM 39851 H2 WAT 7543 109.085 92.080 54.050 1.00 0.00 H TER 39853 WAT 7543 ATOM 39853 O WAT 7544 56.950 61.019 108.915 1.00 0.00 O ATOM 39854 H1 WAT 7544 57.687 61.422 108.457 1.00 0.00 H ATOM 39855 H2 WAT 7544 56.279 61.701 108.934 1.00 0.00 H TER 39857 WAT 7544 ATOM 39857 O WAT 7545 136.381 45.883 19.665 1.00 0.00 O ATOM 39858 H1 WAT 7545 137.309 45.779 19.874 1.00 0.00 H ATOM 39859 H2 WAT 7545 136.044 44.988 19.618 1.00 0.00 H TER 39861 WAT 7545 ATOM 39861 O WAT 7546 9.808 90.808 135.695 1.00 0.00 O ATOM 39862 H1 WAT 7546 10.658 90.791 136.134 1.00 0.00 H ATOM 39863 H2 WAT 7546 9.426 91.649 135.945 1.00 0.00 H TER 39865 WAT 7546 ATOM 39865 O WAT 7547 60.851 22.648 132.239 1.00 0.00 O ATOM 39866 H1 WAT 7547 60.411 23.269 131.659 1.00 0.00 H ATOM 39867 H2 WAT 7547 61.426 22.146 131.660 1.00 0.00 H TER 39869 WAT 7547 ATOM 39869 O WAT 7548 49.280 58.577 152.691 1.00 0.00 O ATOM 39870 H1 WAT 7548 48.798 58.594 153.518 1.00 0.00 H ATOM 39871 H2 WAT 7548 48.603 58.484 152.021 1.00 0.00 H TER 39873 WAT 7548 ATOM 39873 O WAT 7549 54.029 3.322 111.342 1.00 0.00 O ATOM 39874 H1 WAT 7549 54.298 4.029 111.928 1.00 0.00 H ATOM 39875 H2 WAT 7549 53.080 3.267 111.454 1.00 0.00 H TER 39877 WAT 7549 ATOM 39877 O WAT 7550 52.999 143.891 80.961 1.00 0.00 O ATOM 39878 H1 WAT 7550 52.069 144.093 80.855 1.00 0.00 H ATOM 39879 H2 WAT 7550 53.132 143.100 80.439 1.00 0.00 H TER 39881 WAT 7550 ATOM 39881 O WAT 7551 17.804 112.837 54.964 1.00 0.00 O ATOM 39882 H1 WAT 7551 18.265 112.172 54.453 1.00 0.00 H ATOM 39883 H2 WAT 7551 16.933 112.880 54.570 1.00 0.00 H TER 39885 WAT 7551 ATOM 39885 O WAT 7552 71.209 127.953 146.575 1.00 0.00 O ATOM 39886 H1 WAT 7552 71.332 127.078 146.942 1.00 0.00 H ATOM 39887 H2 WAT 7552 70.273 128.002 146.382 1.00 0.00 H TER 39889 WAT 7552 ATOM 39889 O WAT 7553 45.787 35.591 128.533 1.00 0.00 O ATOM 39890 H1 WAT 7553 45.528 34.852 129.083 1.00 0.00 H ATOM 39891 H2 WAT 7553 46.526 35.260 128.021 1.00 0.00 H TER 39893 WAT 7553 ATOM 39893 O WAT 7554 25.646 95.286 83.287 1.00 0.00 O ATOM 39894 H1 WAT 7554 26.092 95.866 82.670 1.00 0.00 H ATOM 39895 H2 WAT 7554 25.679 94.424 82.871 1.00 0.00 H TER 39897 WAT 7554 ATOM 39897 O WAT 7555 9.392 104.469 4.287 1.00 0.00 O ATOM 39898 H1 WAT 7555 9.927 103.714 4.534 1.00 0.00 H ATOM 39899 H2 WAT 7555 9.831 104.832 3.518 1.00 0.00 H TER 39901 WAT 7555 ATOM 39901 O WAT 7556 94.550 137.582 128.881 1.00 0.00 O ATOM 39902 H1 WAT 7556 95.424 137.794 128.553 1.00 0.00 H ATOM 39903 H2 WAT 7556 93.994 137.586 128.101 1.00 0.00 H TER 39905 WAT 7556 ATOM 39905 O WAT 7557 20.581 75.173 141.550 1.00 0.00 O ATOM 39906 H1 WAT 7557 19.739 75.088 141.104 1.00 0.00 H ATOM 39907 H2 WAT 7557 21.009 75.911 141.115 1.00 0.00 H TER 39909 WAT 7557 ATOM 39909 O WAT 7558 79.317 135.385 15.300 1.00 0.00 O ATOM 39910 H1 WAT 7558 79.984 134.868 14.848 1.00 0.00 H ATOM 39911 H2 WAT 7558 79.277 136.206 14.809 1.00 0.00 H TER 39913 WAT 7558 ATOM 39913 O WAT 7559 103.933 29.902 71.568 1.00 0.00 O ATOM 39914 H1 WAT 7559 104.555 30.462 72.032 1.00 0.00 H ATOM 39915 H2 WAT 7559 103.077 30.286 71.757 1.00 0.00 H TER 39917 WAT 7559 ATOM 39917 O WAT 7560 120.837 78.871 6.828 1.00 0.00 O ATOM 39918 H1 WAT 7560 121.427 78.352 7.375 1.00 0.00 H ATOM 39919 H2 WAT 7560 120.883 78.457 5.966 1.00 0.00 H TER 39921 WAT 7560 ATOM 39921 O WAT 7561 36.579 134.757 123.245 1.00 0.00 O ATOM 39922 H1 WAT 7561 37.332 135.273 123.533 1.00 0.00 H ATOM 39923 H2 WAT 7561 36.868 134.345 122.431 1.00 0.00 H TER 39925 WAT 7561 ATOM 39925 O WAT 7562 41.475 1.116 136.862 1.00 0.00 O ATOM 39926 H1 WAT 7562 40.941 1.580 137.506 1.00 0.00 H ATOM 39927 H2 WAT 7562 42.225 1.692 136.712 1.00 0.00 H TER 39929 WAT 7562 ATOM 39929 O WAT 7563 68.072 11.700 13.303 1.00 0.00 O ATOM 39930 H1 WAT 7563 68.108 12.307 12.564 1.00 0.00 H ATOM 39931 H2 WAT 7563 67.271 11.195 13.160 1.00 0.00 H TER 39933 WAT 7563 ATOM 39933 O WAT 7564 122.135 74.017 131.352 1.00 0.00 O ATOM 39934 H1 WAT 7564 121.258 73.960 130.973 1.00 0.00 H ATOM 39935 H2 WAT 7564 122.050 74.663 132.054 1.00 0.00 H TER 39937 WAT 7564 ATOM 39937 O WAT 7565 75.120 143.504 121.769 1.00 0.00 O ATOM 39938 H1 WAT 7565 75.581 143.159 121.004 1.00 0.00 H ATOM 39939 H2 WAT 7565 74.591 144.224 121.426 1.00 0.00 H TER 39941 WAT 7565 ATOM 39941 O WAT 7566 105.688 120.542 1.311 1.00 0.00 O ATOM 39942 H1 WAT 7566 105.793 121.264 1.932 1.00 0.00 H ATOM 39943 H2 WAT 7566 106.278 120.760 0.589 1.00 0.00 H TER 39945 WAT 7566 ATOM 39945 O WAT 7567 82.382 73.001 87.853 1.00 0.00 O ATOM 39946 H1 WAT 7567 81.504 73.123 88.214 1.00 0.00 H ATOM 39947 H2 WAT 7567 82.362 73.460 87.013 1.00 0.00 H TER 39949 WAT 7567 ATOM 39949 O WAT 7568 24.185 91.884 88.572 1.00 0.00 O ATOM 39950 H1 WAT 7568 24.579 91.147 89.039 1.00 0.00 H ATOM 39951 H2 WAT 7568 23.512 91.486 88.020 1.00 0.00 H TER 39953 WAT 7568 ATOM 39953 O WAT 7569 65.789 28.146 102.426 1.00 0.00 O ATOM 39954 H1 WAT 7569 65.981 27.211 102.499 1.00 0.00 H ATOM 39955 H2 WAT 7569 64.856 28.215 102.631 1.00 0.00 H TER 39957 WAT 7569 ATOM 39957 O WAT 7570 21.988 90.170 65.244 1.00 0.00 O ATOM 39958 H1 WAT 7570 21.933 90.600 64.390 1.00 0.00 H ATOM 39959 H2 WAT 7570 21.375 90.655 65.796 1.00 0.00 H TER 39961 WAT 7570 ATOM 39961 O WAT 7571 99.587 20.707 108.458 1.00 0.00 O ATOM 39962 H1 WAT 7571 99.239 21.043 107.632 1.00 0.00 H ATOM 39963 H2 WAT 7571 99.224 21.290 109.125 1.00 0.00 H TER 39965 WAT 7571 ATOM 39965 O WAT 7572 98.641 89.131 76.882 1.00 0.00 O ATOM 39966 H1 WAT 7572 99.286 88.970 77.571 1.00 0.00 H ATOM 39967 H2 WAT 7572 97.815 89.251 77.351 1.00 0.00 H TER 39969 WAT 7572 ATOM 39969 O WAT 7573 142.544 49.982 96.562 1.00 0.00 O ATOM 39970 H1 WAT 7573 142.512 50.420 97.413 1.00 0.00 H ATOM 39971 H2 WAT 7573 143.478 49.888 96.377 1.00 0.00 H TER 39973 WAT 7573 ATOM 39973 O WAT 7574 24.834 80.356 17.081 1.00 0.00 O ATOM 39974 H1 WAT 7574 25.043 79.811 16.322 1.00 0.00 H ATOM 39975 H2 WAT 7574 23.879 80.329 17.139 1.00 0.00 H TER 39977 WAT 7574 ATOM 39977 O WAT 7575 54.265 11.472 152.011 1.00 0.00 O ATOM 39978 H1 WAT 7575 53.563 11.699 151.402 1.00 0.00 H ATOM 39979 H2 WAT 7575 54.016 11.895 152.833 1.00 0.00 H TER 39981 WAT 7575 ATOM 39981 O WAT 7576 102.413 138.078 110.684 1.00 0.00 O ATOM 39982 H1 WAT 7576 102.509 137.211 111.077 1.00 0.00 H ATOM 39983 H2 WAT 7576 102.052 137.909 109.814 1.00 0.00 H TER 39985 WAT 7576 ATOM 39985 O WAT 7577 66.701 104.781 134.372 1.00 0.00 O ATOM 39986 H1 WAT 7577 67.361 104.300 134.871 1.00 0.00 H ATOM 39987 H2 WAT 7577 66.675 105.646 134.782 1.00 0.00 H TER 39989 WAT 7577 ATOM 39989 O WAT 7578 108.174 102.072 87.139 1.00 0.00 O ATOM 39990 H1 WAT 7578 109.040 102.056 87.548 1.00 0.00 H ATOM 39991 H2 WAT 7578 107.798 102.910 87.408 1.00 0.00 H TER 39993 WAT 7578 ATOM 39993 O WAT 7579 44.593 19.964 127.868 1.00 0.00 O ATOM 39994 H1 WAT 7579 44.415 19.504 128.688 1.00 0.00 H ATOM 39995 H2 WAT 7579 44.763 20.868 128.133 1.00 0.00 H TER 39997 WAT 7579 ATOM 39997 O WAT 7580 136.732 119.910 9.260 1.00 0.00 O ATOM 39998 H1 WAT 7580 137.242 120.719 9.305 1.00 0.00 H ATOM 39999 H2 WAT 7580 137.012 119.495 8.444 1.00 0.00 H TER 40001 WAT 7580 ATOM 40001 O WAT 7581 81.491 36.638 150.736 1.00 0.00 O ATOM 40002 H1 WAT 7581 81.366 36.509 151.676 1.00 0.00 H ATOM 40003 H2 WAT 7581 80.631 36.910 150.415 1.00 0.00 H TER 40005 WAT 7581 ATOM 40005 O WAT 7582 91.081 58.392 152.128 1.00 0.00 O ATOM 40006 H1 WAT 7582 90.615 57.956 151.415 1.00 0.00 H ATOM 40007 H2 WAT 7582 91.765 58.900 151.691 1.00 0.00 H TER 40009 WAT 7582 ATOM 40009 O WAT 7583 84.711 70.854 125.282 1.00 0.00 O ATOM 40010 H1 WAT 7583 83.843 70.589 124.976 1.00 0.00 H ATOM 40011 H2 WAT 7583 85.142 71.205 124.503 1.00 0.00 H TER 40013 WAT 7583 ATOM 40013 O WAT 7584 108.140 102.804 129.731 1.00 0.00 O ATOM 40014 H1 WAT 7584 107.764 103.188 128.939 1.00 0.00 H ATOM 40015 H2 WAT 7584 107.383 102.598 130.279 1.00 0.00 H TER 40017 WAT 7584 ATOM 40017 O WAT 7585 55.865 72.323 4.442 1.00 0.00 O ATOM 40018 H1 WAT 7585 55.348 72.268 3.638 1.00 0.00 H ATOM 40019 H2 WAT 7585 55.730 73.218 4.753 1.00 0.00 H TER 40021 WAT 7585 ATOM 40021 O WAT 7586 91.467 60.618 123.498 1.00 0.00 O ATOM 40022 H1 WAT 7586 91.409 61.567 123.612 1.00 0.00 H ATOM 40023 H2 WAT 7586 90.668 60.385 123.026 1.00 0.00 H TER 40025 WAT 7586 ATOM 40025 O WAT 7587 74.585 134.619 96.969 1.00 0.00 O ATOM 40026 H1 WAT 7587 74.646 135.335 97.602 1.00 0.00 H ATOM 40027 H2 WAT 7587 75.349 134.072 97.152 1.00 0.00 H TER 40029 WAT 7587 ATOM 40029 O WAT 7588 25.933 6.276 124.903 1.00 0.00 O ATOM 40030 H1 WAT 7588 26.134 7.124 125.299 1.00 0.00 H ATOM 40031 H2 WAT 7588 25.141 6.433 124.389 1.00 0.00 H TER 40033 WAT 7588 ATOM 40033 O WAT 7589 91.520 80.059 69.032 1.00 0.00 O ATOM 40034 H1 WAT 7589 92.159 79.740 69.670 1.00 0.00 H ATOM 40035 H2 WAT 7589 92.049 80.474 68.351 1.00 0.00 H TER 40037 WAT 7589 ATOM 40037 O WAT 7590 112.765 140.847 23.605 1.00 0.00 O ATOM 40038 H1 WAT 7590 113.661 141.047 23.875 1.00 0.00 H ATOM 40039 H2 WAT 7590 112.818 140.747 22.654 1.00 0.00 H TER 40041 WAT 7590 ATOM 40041 O WAT 7591 41.141 26.735 76.486 1.00 0.00 O ATOM 40042 H1 WAT 7591 40.835 27.248 77.234 1.00 0.00 H ATOM 40043 H2 WAT 7591 40.673 27.103 75.737 1.00 0.00 H TER 40045 WAT 7591 ATOM 40045 O WAT 7592 54.893 5.741 76.615 1.00 0.00 O ATOM 40046 H1 WAT 7592 55.101 6.111 75.757 1.00 0.00 H ATOM 40047 H2 WAT 7592 55.405 4.933 76.657 1.00 0.00 H TER 40049 WAT 7592 ATOM 40049 O WAT 7593 145.734 40.525 4.274 1.00 0.00 O ATOM 40050 H1 WAT 7593 145.485 40.882 5.127 1.00 0.00 H ATOM 40051 H2 WAT 7593 146.506 39.989 4.456 1.00 0.00 H TER 40053 WAT 7593 ATOM 40053 O WAT 7594 80.932 114.101 24.703 1.00 0.00 O ATOM 40054 H1 WAT 7594 80.318 114.721 25.098 1.00 0.00 H ATOM 40055 H2 WAT 7594 81.591 113.952 25.381 1.00 0.00 H TER 40057 WAT 7594 ATOM 40057 O WAT 7595 145.185 34.219 61.837 1.00 0.00 O ATOM 40058 H1 WAT 7595 144.827 34.794 62.513 1.00 0.00 H ATOM 40059 H2 WAT 7595 145.273 34.781 61.067 1.00 0.00 H TER 40061 WAT 7595 ATOM 40061 O WAT 7596 43.283 48.425 79.440 1.00 0.00 O ATOM 40062 H1 WAT 7596 43.505 49.041 78.743 1.00 0.00 H ATOM 40063 H2 WAT 7596 42.544 47.926 79.093 1.00 0.00 H TER 40065 WAT 7596 ATOM 40065 O WAT 7597 138.200 57.131 150.552 1.00 0.00 O ATOM 40066 H1 WAT 7597 137.584 57.312 149.842 1.00 0.00 H ATOM 40067 H2 WAT 7597 139.057 57.115 150.127 1.00 0.00 H TER 40069 WAT 7597 ATOM 40069 O WAT 7598 37.810 103.840 115.190 1.00 0.00 O ATOM 40070 H1 WAT 7598 38.432 103.784 115.915 1.00 0.00 H ATOM 40071 H2 WAT 7598 38.107 104.591 114.677 1.00 0.00 H TER 40073 WAT 7598 ATOM 40073 O WAT 7599 131.063 85.641 14.996 1.00 0.00 O ATOM 40074 H1 WAT 7599 131.613 84.885 14.793 1.00 0.00 H ATOM 40075 H2 WAT 7599 130.314 85.274 15.465 1.00 0.00 H TER 40077 WAT 7599 ATOM 40077 O WAT 7600 125.154 68.797 21.093 1.00 0.00 O ATOM 40078 H1 WAT 7600 125.925 68.321 20.785 1.00 0.00 H ATOM 40079 H2 WAT 7600 124.593 68.122 21.476 1.00 0.00 H TER 40081 WAT 7600 ATOM 40081 O WAT 7601 38.118 39.597 96.421 1.00 0.00 O ATOM 40082 H1 WAT 7601 38.279 40.428 95.974 1.00 0.00 H ATOM 40083 H2 WAT 7601 37.165 39.507 96.421 1.00 0.00 H TER 40085 WAT 7601 ATOM 40085 O WAT 7602 76.260 2.240 127.675 1.00 0.00 O ATOM 40086 H1 WAT 7602 75.554 2.854 127.476 1.00 0.00 H ATOM 40087 H2 WAT 7602 75.832 1.385 127.709 1.00 0.00 H TER 40089 WAT 7602 ATOM 40089 O WAT 7603 83.378 102.039 0.363 1.00 0.00 O ATOM 40090 H1 WAT 7603 82.611 102.588 0.524 1.00 0.00 H ATOM 40091 H2 WAT 7603 83.118 101.169 0.666 1.00 0.00 H TER 40093 WAT 7603 ATOM 40093 O WAT 7604 84.454 1.736 62.000 1.00 0.00 O ATOM 40094 H1 WAT 7604 85.133 1.914 61.350 1.00 0.00 H ATOM 40095 H2 WAT 7604 84.324 0.789 61.959 1.00 0.00 H TER 40097 WAT 7604 ATOM 40097 O WAT 7605 13.088 88.162 18.496 1.00 0.00 O ATOM 40098 H1 WAT 7605 12.619 88.030 17.672 1.00 0.00 H ATOM 40099 H2 WAT 7605 12.708 88.960 18.862 1.00 0.00 H TER 40101 WAT 7605 ATOM 40101 O WAT 7606 139.337 65.615 147.610 1.00 0.00 O ATOM 40102 H1 WAT 7606 138.410 65.708 147.389 1.00 0.00 H ATOM 40103 H2 WAT 7606 139.408 65.964 148.498 1.00 0.00 H TER 40105 WAT 7606 ATOM 40105 O WAT 7607 40.961 91.167 2.752 1.00 0.00 O ATOM 40106 H1 WAT 7607 41.700 91.690 3.064 1.00 0.00 H ATOM 40107 H2 WAT 7607 41.036 91.191 1.798 1.00 0.00 H TER 40109 WAT 7607 ATOM 40109 O WAT 7608 105.964 59.025 87.327 1.00 0.00 O ATOM 40110 H1 WAT 7608 105.352 58.298 87.213 1.00 0.00 H ATOM 40111 H2 WAT 7608 106.698 58.813 86.751 1.00 0.00 H TER 40113 WAT 7608 ATOM 40113 O WAT 7609 16.029 85.768 136.842 1.00 0.00 O ATOM 40114 H1 WAT 7609 16.937 85.482 136.742 1.00 0.00 H ATOM 40115 H2 WAT 7609 15.913 86.437 136.167 1.00 0.00 H TER 40117 WAT 7609 ATOM 40117 O WAT 7610 98.978 14.994 123.306 1.00 0.00 O ATOM 40118 H1 WAT 7610 98.502 14.175 123.170 1.00 0.00 H ATOM 40119 H2 WAT 7610 99.445 14.865 124.132 1.00 0.00 H TER 40121 WAT 7610 ATOM 40121 O WAT 7611 55.026 134.554 77.246 1.00 0.00 O ATOM 40122 H1 WAT 7611 55.800 135.030 76.944 1.00 0.00 H ATOM 40123 H2 WAT 7611 54.617 134.229 76.444 1.00 0.00 H TER 40125 WAT 7611 ATOM 40125 O WAT 7612 16.558 25.533 110.086 1.00 0.00 O ATOM 40126 H1 WAT 7612 15.893 26.215 110.186 1.00 0.00 H ATOM 40127 H2 WAT 7612 16.416 25.188 109.204 1.00 0.00 H TER 40129 WAT 7612 ATOM 40129 O WAT 7613 10.051 73.926 74.296 1.00 0.00 O ATOM 40130 H1 WAT 7613 10.496 74.745 74.079 1.00 0.00 H ATOM 40131 H2 WAT 7613 10.733 73.258 74.228 1.00 0.00 H TER 40133 WAT 7613 ATOM 40133 O WAT 7614 46.684 134.346 103.471 1.00 0.00 O ATOM 40134 H1 WAT 7614 45.977 134.566 102.864 1.00 0.00 H ATOM 40135 H2 WAT 7614 47.396 134.040 102.909 1.00 0.00 H TER 40137 WAT 7614 ATOM 40137 O WAT 7615 143.006 90.570 22.602 1.00 0.00 O ATOM 40138 H1 WAT 7615 143.005 90.355 23.535 1.00 0.00 H ATOM 40139 H2 WAT 7615 142.085 90.724 22.391 1.00 0.00 H TER 40141 WAT 7615 ATOM 40141 O WAT 7616 117.848 137.884 107.274 1.00 0.00 O ATOM 40142 H1 WAT 7616 118.167 137.190 106.697 1.00 0.00 H ATOM 40143 H2 WAT 7616 117.675 138.621 106.688 1.00 0.00 H TER 40145 WAT 7616 ATOM 40145 O WAT 7617 83.591 95.199 119.546 1.00 0.00 O ATOM 40146 H1 WAT 7617 83.195 94.381 119.247 1.00 0.00 H ATOM 40147 H2 WAT 7617 83.439 95.208 120.491 1.00 0.00 H TER 40149 WAT 7617 ATOM 40149 O WAT 7618 5.109 66.526 155.977 1.00 0.00 O ATOM 40150 H1 WAT 7618 4.423 66.498 155.310 1.00 0.00 H ATOM 40151 H2 WAT 7618 5.451 67.419 155.933 1.00 0.00 H TER 40153 WAT 7618 ATOM 40153 O WAT 7619 66.623 40.088 78.081 1.00 0.00 O ATOM 40154 H1 WAT 7619 67.260 39.441 77.779 1.00 0.00 H ATOM 40155 H2 WAT 7619 66.082 39.615 78.713 1.00 0.00 H TER 40157 WAT 7619 ATOM 40157 O WAT 7620 7.201 99.348 13.298 1.00 0.00 O ATOM 40158 H1 WAT 7620 7.403 98.721 13.992 1.00 0.00 H ATOM 40159 H2 WAT 7620 7.245 98.835 12.491 1.00 0.00 H TER 40161 WAT 7620 ATOM 40161 O WAT 7621 116.221 67.500 155.045 1.00 0.00 O ATOM 40162 H1 WAT 7621 116.137 67.946 155.888 1.00 0.00 H ATOM 40163 H2 WAT 7621 115.411 67.712 154.580 1.00 0.00 H TER 40165 WAT 7621 ATOM 40165 O WAT 7622 40.403 34.528 88.355 1.00 0.00 O ATOM 40166 H1 WAT 7622 40.890 35.238 87.935 1.00 0.00 H ATOM 40167 H2 WAT 7622 41.078 33.973 88.746 1.00 0.00 H TER 40169 WAT 7622 ATOM 40169 O WAT 7623 133.624 58.751 65.349 1.00 0.00 O ATOM 40170 H1 WAT 7623 134.072 59.162 66.088 1.00 0.00 H ATOM 40171 H2 WAT 7623 134.330 58.433 64.787 1.00 0.00 H TER 40173 WAT 7623 ATOM 40173 O WAT 7624 46.651 113.399 96.981 1.00 0.00 O ATOM 40174 H1 WAT 7624 47.012 113.683 97.821 1.00 0.00 H ATOM 40175 H2 WAT 7624 45.737 113.188 97.171 1.00 0.00 H TER 40177 WAT 7624 ATOM 40177 O WAT 7625 105.195 47.036 65.543 1.00 0.00 O ATOM 40178 H1 WAT 7625 105.755 47.607 66.067 1.00 0.00 H ATOM 40179 H2 WAT 7625 105.049 47.522 64.731 1.00 0.00 H TER 40181 WAT 7625 ATOM 40181 O WAT 7626 107.540 94.255 112.231 1.00 0.00 O ATOM 40182 H1 WAT 7626 107.605 94.755 113.045 1.00 0.00 H ATOM 40183 H2 WAT 7626 108.447 94.135 111.951 1.00 0.00 H TER 40185 WAT 7626 ATOM 40185 O WAT 7627 130.794 122.678 115.878 1.00 0.00 O ATOM 40186 H1 WAT 7627 131.368 123.367 115.545 1.00 0.00 H ATOM 40187 H2 WAT 7627 131.004 122.619 116.809 1.00 0.00 H TER 40189 WAT 7627 ATOM 40189 O WAT 7628 17.979 33.841 16.053 1.00 0.00 O ATOM 40190 H1 WAT 7628 18.197 33.055 15.552 1.00 0.00 H ATOM 40191 H2 WAT 7628 17.910 34.533 15.395 1.00 0.00 H TER 40193 WAT 7628 ATOM 40193 O WAT 7629 25.700 128.991 102.753 1.00 0.00 O ATOM 40194 H1 WAT 7629 25.526 128.652 101.875 1.00 0.00 H ATOM 40195 H2 WAT 7629 25.918 128.216 103.271 1.00 0.00 H TER 40197 WAT 7629 ATOM 40197 O WAT 7630 139.466 45.830 3.767 1.00 0.00 O ATOM 40198 H1 WAT 7630 139.687 46.649 3.323 1.00 0.00 H ATOM 40199 H2 WAT 7630 140.313 45.427 3.962 1.00 0.00 H TER 40201 WAT 7630 ATOM 40201 O WAT 7631 47.925 118.587 10.433 1.00 0.00 O ATOM 40202 H1 WAT 7631 48.390 118.193 11.172 1.00 0.00 H ATOM 40203 H2 WAT 7631 47.066 118.163 10.438 1.00 0.00 H TER 40205 WAT 7631 ATOM 40205 O WAT 7632 64.049 94.405 133.909 1.00 0.00 O ATOM 40206 H1 WAT 7632 64.953 94.188 134.134 1.00 0.00 H ATOM 40207 H2 WAT 7632 63.565 93.591 134.046 1.00 0.00 H TER 40209 WAT 7632 ATOM 40209 O WAT 7633 23.097 109.035 147.034 1.00 0.00 O ATOM 40210 H1 WAT 7633 23.416 109.149 147.929 1.00 0.00 H ATOM 40211 H2 WAT 7633 23.463 109.777 146.553 1.00 0.00 H TER 40213 WAT 7633 ATOM 40213 O WAT 7634 109.871 41.295 91.885 1.00 0.00 O ATOM 40214 H1 WAT 7634 110.096 42.034 91.319 1.00 0.00 H ATOM 40215 H2 WAT 7634 110.671 41.120 92.379 1.00 0.00 H TER 40217 WAT 7634 ATOM 40217 O WAT 7635 25.411 43.989 18.670 1.00 0.00 O ATOM 40218 H1 WAT 7635 24.956 43.955 17.829 1.00 0.00 H ATOM 40219 H2 WAT 7635 24.806 44.448 19.252 1.00 0.00 H TER 40221 WAT 7635 ATOM 40221 O WAT 7636 139.310 31.861 111.052 1.00 0.00 O ATOM 40222 H1 WAT 7636 139.179 32.610 110.471 1.00 0.00 H ATOM 40223 H2 WAT 7636 139.831 32.208 111.776 1.00 0.00 H TER 40225 WAT 7636 ATOM 40225 O WAT 7637 57.978 75.174 130.712 1.00 0.00 O ATOM 40226 H1 WAT 7637 57.476 74.382 130.902 1.00 0.00 H ATOM 40227 H2 WAT 7637 57.608 75.502 129.892 1.00 0.00 H TER 40229 WAT 7637 ATOM 40229 O WAT 7638 101.171 52.356 26.046 1.00 0.00 O ATOM 40230 H1 WAT 7638 100.615 52.239 26.817 1.00 0.00 H ATOM 40231 H2 WAT 7638 100.639 52.040 25.316 1.00 0.00 H TER 40233 WAT 7638 ATOM 40233 O WAT 7639 93.221 120.071 102.216 1.00 0.00 O ATOM 40234 H1 WAT 7639 92.515 120.041 101.571 1.00 0.00 H ATOM 40235 H2 WAT 7639 92.787 119.907 103.054 1.00 0.00 H TER 40237 WAT 7639 ATOM 40237 O WAT 7640 140.902 77.926 101.941 1.00 0.00 O ATOM 40238 H1 WAT 7640 141.693 78.270 102.356 1.00 0.00 H ATOM 40239 H2 WAT 7640 140.627 77.207 102.509 1.00 0.00 H TER 40241 WAT 7640 ATOM 40241 O WAT 7641 44.912 49.664 114.725 1.00 0.00 O ATOM 40242 H1 WAT 7641 44.167 49.661 114.124 1.00 0.00 H ATOM 40243 H2 WAT 7641 45.118 48.739 114.855 1.00 0.00 H TER 40245 WAT 7641 ATOM 40245 O WAT 7642 93.175 74.137 2.965 1.00 0.00 O ATOM 40246 H1 WAT 7642 93.098 73.370 3.533 1.00 0.00 H ATOM 40247 H2 WAT 7642 92.530 73.988 2.274 1.00 0.00 H TER 40249 WAT 7642 ATOM 40249 O WAT 7643 43.359 29.405 153.007 1.00 0.00 O ATOM 40250 H1 WAT 7643 44.206 29.637 152.626 1.00 0.00 H ATOM 40251 H2 WAT 7643 42.983 30.241 153.281 1.00 0.00 H TER 40253 WAT 7643 ATOM 40253 O WAT 7644 142.072 53.689 92.923 1.00 0.00 O ATOM 40254 H1 WAT 7644 141.976 52.740 93.000 1.00 0.00 H ATOM 40255 H2 WAT 7644 141.178 54.026 92.982 1.00 0.00 H TER 40257 WAT 7644 ATOM 40257 O WAT 7645 93.734 90.801 78.279 1.00 0.00 O ATOM 40258 H1 WAT 7645 94.121 91.622 77.976 1.00 0.00 H ATOM 40259 H2 WAT 7645 93.047 90.610 77.640 1.00 0.00 H TER 40261 WAT 7645 ATOM 40261 O WAT 7646 106.472 97.071 75.041 1.00 0.00 O ATOM 40262 H1 WAT 7646 107.367 97.070 74.702 1.00 0.00 H ATOM 40263 H2 WAT 7646 105.981 97.607 74.419 1.00 0.00 H TER 40265 WAT 7646 ATOM 40265 O WAT 7647 80.058 15.170 105.186 1.00 0.00 O ATOM 40266 H1 WAT 7647 80.847 14.642 105.064 1.00 0.00 H ATOM 40267 H2 WAT 7647 80.018 15.327 106.130 1.00 0.00 H TER 40269 WAT 7647 ATOM 40269 O WAT 7648 124.727 15.919 108.804 1.00 0.00 O ATOM 40270 H1 WAT 7648 124.974 16.539 109.489 1.00 0.00 H ATOM 40271 H2 WAT 7648 123.879 16.233 108.490 1.00 0.00 H TER 40273 WAT 7648 ATOM 40273 O WAT 7649 19.951 28.802 98.054 1.00 0.00 O ATOM 40274 H1 WAT 7649 20.789 28.344 98.004 1.00 0.00 H ATOM 40275 H2 WAT 7649 19.468 28.344 98.742 1.00 0.00 H TER 40277 WAT 7649 ATOM 40277 O WAT 7650 92.853 104.693 153.553 1.00 0.00 O ATOM 40278 H1 WAT 7650 92.913 103.750 153.708 1.00 0.00 H ATOM 40279 H2 WAT 7650 91.955 104.830 153.253 1.00 0.00 H TER 40281 WAT 7650 ATOM 40281 O WAT 7651 63.322 73.589 65.260 1.00 0.00 O ATOM 40282 H1 WAT 7651 62.649 73.533 64.582 1.00 0.00 H ATOM 40283 H2 WAT 7651 64.067 73.109 64.898 1.00 0.00 H TER 40285 WAT 7651 ATOM 40285 O WAT 7652 144.252 116.110 156.020 1.00 0.00 O ATOM 40286 H1 WAT 7652 144.323 115.237 156.407 1.00 0.00 H ATOM 40287 H2 WAT 7652 145.021 116.579 156.344 1.00 0.00 H TER 40289 WAT 7652 ATOM 40289 O WAT 7653 6.025 91.824 148.924 1.00 0.00 O ATOM 40290 H1 WAT 7653 6.289 91.555 149.803 1.00 0.00 H ATOM 40291 H2 WAT 7653 5.069 91.779 148.936 1.00 0.00 H TER 40293 WAT 7653 ATOM 40293 O WAT 7654 81.036 145.073 137.754 1.00 0.00 O ATOM 40294 H1 WAT 7654 81.605 144.486 138.252 1.00 0.00 H ATOM 40295 H2 WAT 7654 81.583 145.836 137.567 1.00 0.00 H TER 40297 WAT 7654 ATOM 40297 O WAT 7655 72.048 93.628 148.882 1.00 0.00 O ATOM 40298 H1 WAT 7655 71.834 93.040 149.607 1.00 0.00 H ATOM 40299 H2 WAT 7655 72.473 93.065 148.234 1.00 0.00 H TER 40301 WAT 7655 ATOM 40301 O WAT 7656 127.766 87.891 108.624 1.00 0.00 O ATOM 40302 H1 WAT 7656 127.649 87.346 109.403 1.00 0.00 H ATOM 40303 H2 WAT 7656 126.882 88.000 108.274 1.00 0.00 H TER 40305 WAT 7656 ATOM 40305 O WAT 7657 44.601 48.048 133.252 1.00 0.00 O ATOM 40306 H1 WAT 7657 45.238 47.334 133.251 1.00 0.00 H ATOM 40307 H2 WAT 7657 43.793 47.648 132.930 1.00 0.00 H TER 40309 WAT 7657 ATOM 40309 O WAT 7658 83.938 107.810 112.928 1.00 0.00 O ATOM 40310 H1 WAT 7658 84.161 106.990 113.369 1.00 0.00 H ATOM 40311 H2 WAT 7658 83.340 108.252 113.530 1.00 0.00 H TER 40313 WAT 7658 ATOM 40313 O WAT 7659 61.418 7.336 75.076 1.00 0.00 O ATOM 40314 H1 WAT 7659 61.435 8.139 75.597 1.00 0.00 H ATOM 40315 H2 WAT 7659 60.663 6.851 75.408 1.00 0.00 H TER 40317 WAT 7659 ATOM 40317 O WAT 7660 3.789 88.110 3.402 1.00 0.00 O ATOM 40318 H1 WAT 7660 4.309 88.683 3.965 1.00 0.00 H ATOM 40319 H2 WAT 7660 3.414 87.463 4.000 1.00 0.00 H TER 40321 WAT 7660 ATOM 40321 O WAT 7661 16.961 131.333 96.939 1.00 0.00 O ATOM 40322 H1 WAT 7661 16.837 130.682 97.630 1.00 0.00 H ATOM 40323 H2 WAT 7661 17.709 131.853 97.232 1.00 0.00 H TER 40325 WAT 7661 ATOM 40325 O WAT 7662 81.556 46.609 118.906 1.00 0.00 O ATOM 40326 H1 WAT 7662 81.165 46.802 118.054 1.00 0.00 H ATOM 40327 H2 WAT 7662 81.572 47.452 119.359 1.00 0.00 H TER 40329 WAT 7662 ATOM 40329 O WAT 7663 64.079 38.341 130.240 1.00 0.00 O ATOM 40330 H1 WAT 7663 64.013 37.993 129.351 1.00 0.00 H ATOM 40331 H2 WAT 7663 64.508 39.191 130.133 1.00 0.00 H TER 40333 WAT 7663 ATOM 40333 O WAT 7664 22.545 59.447 136.135 1.00 0.00 O ATOM 40334 H1 WAT 7664 22.843 59.840 135.315 1.00 0.00 H ATOM 40335 H2 WAT 7664 22.665 60.136 136.789 1.00 0.00 H TER 40337 WAT 7664 ATOM 40337 O WAT 7665 142.939 140.715 126.050 1.00 0.00 O ATOM 40338 H1 WAT 7665 142.673 139.936 126.539 1.00 0.00 H ATOM 40339 H2 WAT 7665 143.824 140.902 126.361 1.00 0.00 H TER 40341 WAT 7665 ATOM 40341 O WAT 7666 53.327 95.233 96.379 1.00 0.00 O ATOM 40342 H1 WAT 7666 53.990 95.085 97.053 1.00 0.00 H ATOM 40343 H2 WAT 7666 52.497 95.245 96.857 1.00 0.00 H TER 40345 WAT 7666 ATOM 40345 O WAT 7667 7.729 78.370 133.849 1.00 0.00 O ATOM 40346 H1 WAT 7667 7.228 78.399 133.034 1.00 0.00 H ATOM 40347 H2 WAT 7667 7.227 78.910 134.459 1.00 0.00 H TER 40349 WAT 7667 ATOM 40349 O WAT 7668 104.873 141.361 60.005 1.00 0.00 O ATOM 40350 H1 WAT 7668 105.089 140.765 59.287 1.00 0.00 H ATOM 40351 H2 WAT 7668 104.357 140.828 60.611 1.00 0.00 H TER 40353 WAT 7668 ATOM 40353 O WAT 7669 30.612 118.347 135.460 1.00 0.00 O ATOM 40354 H1 WAT 7669 30.810 118.643 136.348 1.00 0.00 H ATOM 40355 H2 WAT 7669 29.675 118.517 135.354 1.00 0.00 H TER 40357 WAT 7669 ATOM 40357 O WAT 7670 74.826 93.589 16.810 1.00 0.00 O ATOM 40358 H1 WAT 7670 75.624 93.455 16.299 1.00 0.00 H ATOM 40359 H2 WAT 7670 74.412 94.355 16.411 1.00 0.00 H TER 40361 WAT 7670 ATOM 40361 O WAT 7671 104.926 40.835 117.313 1.00 0.00 O ATOM 40362 H1 WAT 7671 105.807 40.466 117.371 1.00 0.00 H ATOM 40363 H2 WAT 7671 105.043 41.663 116.846 1.00 0.00 H TER 40365 WAT 7671 ATOM 40365 O WAT 7672 23.239 98.480 118.461 1.00 0.00 O ATOM 40366 H1 WAT 7672 23.681 98.884 119.207 1.00 0.00 H ATOM 40367 H2 WAT 7672 23.914 97.945 118.043 1.00 0.00 H TER 40369 WAT 7672 ATOM 40369 O WAT 7673 140.448 140.866 1.436 1.00 0.00 O ATOM 40370 H1 WAT 7673 140.143 140.091 0.965 1.00 0.00 H ATOM 40371 H2 WAT 7673 140.207 140.703 2.348 1.00 0.00 H TER 40373 WAT 7673 ATOM 40373 O WAT 7674 139.513 30.461 150.506 1.00 0.00 O ATOM 40374 H1 WAT 7674 140.226 30.528 151.141 1.00 0.00 H ATOM 40375 H2 WAT 7674 139.727 31.111 149.836 1.00 0.00 H TER 40377 WAT 7674 ATOM 40377 O WAT 7675 127.248 64.182 79.255 1.00 0.00 O ATOM 40378 H1 WAT 7675 127.720 65.001 79.109 1.00 0.00 H ATOM 40379 H2 WAT 7675 126.516 64.213 78.639 1.00 0.00 H TER 40381 WAT 7675 ATOM 40381 O WAT 7676 87.403 142.979 7.561 1.00 0.00 O ATOM 40382 H1 WAT 7676 86.780 143.452 8.113 1.00 0.00 H ATOM 40383 H2 WAT 7676 86.872 142.632 6.845 1.00 0.00 H TER 40385 WAT 7676 ATOM 40385 O WAT 7677 22.338 115.333 87.731 1.00 0.00 O ATOM 40386 H1 WAT 7677 21.656 114.782 87.347 1.00 0.00 H ATOM 40387 H2 WAT 7677 22.077 116.227 87.509 1.00 0.00 H TER 40389 WAT 7677 ATOM 40389 O WAT 7678 31.745 116.934 74.432 1.00 0.00 O ATOM 40390 H1 WAT 7678 32.311 116.238 74.763 1.00 0.00 H ATOM 40391 H2 WAT 7678 30.857 116.599 74.552 1.00 0.00 H TER 40393 WAT 7678 ATOM 40393 O WAT 7679 121.895 32.987 147.899 1.00 0.00 O ATOM 40394 H1 WAT 7679 121.316 33.204 147.168 1.00 0.00 H ATOM 40395 H2 WAT 7679 122.257 33.829 148.174 1.00 0.00 H TER 40397 WAT 7679 ATOM 40397 O WAT 7680 28.537 93.156 15.244 1.00 0.00 O ATOM 40398 H1 WAT 7680 28.617 93.937 14.695 1.00 0.00 H ATOM 40399 H2 WAT 7680 29.138 93.312 15.972 1.00 0.00 H TER 40401 WAT 7680 ATOM 40401 O WAT 7681 29.531 119.614 104.648 1.00 0.00 O ATOM 40402 H1 WAT 7681 29.579 119.777 103.706 1.00 0.00 H ATOM 40403 H2 WAT 7681 29.631 118.665 104.732 1.00 0.00 H TER 40405 WAT 7681 ATOM 40405 O WAT 7682 71.844 73.478 80.454 1.00 0.00 O ATOM 40406 H1 WAT 7682 72.504 73.944 80.968 1.00 0.00 H ATOM 40407 H2 WAT 7682 72.159 73.533 79.552 1.00 0.00 H TER 40409 WAT 7682 ATOM 40409 O WAT 7683 143.882 126.746 78.974 1.00 0.00 O ATOM 40410 H1 WAT 7683 144.409 127.085 79.698 1.00 0.00 H ATOM 40411 H2 WAT 7683 144.117 125.820 78.920 1.00 0.00 H TER 40413 WAT 7683 ATOM 40413 O WAT 7684 81.624 19.659 58.764 1.00 0.00 O ATOM 40414 H1 WAT 7684 81.710 19.123 57.975 1.00 0.00 H ATOM 40415 H2 WAT 7684 80.705 19.925 58.773 1.00 0.00 H TER 40417 WAT 7684 ATOM 40417 O WAT 7685 19.397 67.659 127.988 1.00 0.00 O ATOM 40418 H1 WAT 7685 20.288 68.003 127.920 1.00 0.00 H ATOM 40419 H2 WAT 7685 18.921 68.085 127.275 1.00 0.00 H TER 40421 WAT 7685 ATOM 40421 O WAT 7686 60.739 104.413 1.938 1.00 0.00 O ATOM 40422 H1 WAT 7686 59.905 104.705 2.306 1.00 0.00 H ATOM 40423 H2 WAT 7686 60.493 103.817 1.231 1.00 0.00 H TER 40425 WAT 7686 ATOM 40425 O WAT 7687 20.357 89.301 7.529 1.00 0.00 O ATOM 40426 H1 WAT 7687 20.995 88.625 7.299 1.00 0.00 H ATOM 40427 H2 WAT 7687 19.694 89.248 6.840 1.00 0.00 H TER 40429 WAT 7687 ATOM 40429 O WAT 7688 81.736 64.277 116.649 1.00 0.00 O ATOM 40430 H1 WAT 7688 81.838 64.600 117.543 1.00 0.00 H ATOM 40431 H2 WAT 7688 82.440 64.701 116.158 1.00 0.00 H TER 40433 WAT 7688 ATOM 40433 O WAT 7689 57.411 139.340 131.649 1.00 0.00 O ATOM 40434 H1 WAT 7689 57.371 140.086 131.049 1.00 0.00 H ATOM 40435 H2 WAT 7689 58.344 139.133 131.710 1.00 0.00 H TER 40437 WAT 7689 ATOM 40437 O WAT 7690 142.089 10.910 122.251 1.00 0.00 O ATOM 40438 H1 WAT 7690 142.081 10.696 121.318 1.00 0.00 H ATOM 40439 H2 WAT 7690 141.166 10.904 122.506 1.00 0.00 H TER 40441 WAT 7690 ATOM 40441 O WAT 7691 145.337 11.207 93.982 1.00 0.00 O ATOM 40442 H1 WAT 7691 145.238 11.997 94.514 1.00 0.00 H ATOM 40443 H2 WAT 7691 144.512 11.136 93.502 1.00 0.00 H TER 40445 WAT 7691 ATOM 40445 O WAT 7692 55.425 90.935 16.285 1.00 0.00 O ATOM 40446 H1 WAT 7692 55.275 90.012 16.487 1.00 0.00 H ATOM 40447 H2 WAT 7692 55.644 90.943 15.353 1.00 0.00 H TER 40449 WAT 7692 ATOM 40449 O WAT 7693 4.892 79.999 153.797 1.00 0.00 O ATOM 40450 H1 WAT 7693 5.094 80.103 154.727 1.00 0.00 H ATOM 40451 H2 WAT 7693 5.622 80.420 153.344 1.00 0.00 H TER 40453 WAT 7693 ATOM 40453 O WAT 7694 19.216 63.397 61.715 1.00 0.00 O ATOM 40454 H1 WAT 7694 19.224 64.109 62.355 1.00 0.00 H ATOM 40455 H2 WAT 7694 20.136 63.278 61.477 1.00 0.00 H TER 40457 WAT 7694 ATOM 40457 O WAT 7695 78.731 76.393 87.031 1.00 0.00 O ATOM 40458 H1 WAT 7695 78.431 75.555 86.680 1.00 0.00 H ATOM 40459 H2 WAT 7695 78.741 76.980 86.275 1.00 0.00 H TER 40461 WAT 7695 ATOM 40461 O WAT 7696 42.793 31.840 126.685 1.00 0.00 O ATOM 40462 H1 WAT 7696 42.801 31.661 125.745 1.00 0.00 H ATOM 40463 H2 WAT 7696 42.494 32.747 126.753 1.00 0.00 H TER 40465 WAT 7696 ATOM 40465 O WAT 7697 139.549 88.833 97.952 1.00 0.00 O ATOM 40466 H1 WAT 7697 139.672 89.011 98.884 1.00 0.00 H ATOM 40467 H2 WAT 7697 138.643 88.533 97.883 1.00 0.00 H TER 40469 WAT 7697 ATOM 40469 O WAT 7698 34.826 57.347 1.377 1.00 0.00 O ATOM 40470 H1 WAT 7698 35.249 57.527 2.217 1.00 0.00 H ATOM 40471 H2 WAT 7698 34.537 56.437 1.445 1.00 0.00 H TER 40473 WAT 7698 ATOM 40473 O WAT 7699 24.852 28.433 77.725 1.00 0.00 O ATOM 40474 H1 WAT 7699 25.062 27.624 77.259 1.00 0.00 H ATOM 40475 H2 WAT 7699 23.984 28.677 77.404 1.00 0.00 H TER 40477 WAT 7699 ATOM 40477 O WAT 7700 132.194 55.691 26.527 1.00 0.00 O ATOM 40478 H1 WAT 7700 131.242 55.759 26.602 1.00 0.00 H ATOM 40479 H2 WAT 7700 132.354 55.593 25.588 1.00 0.00 H TER 40481 WAT 7700 ATOM 40481 O WAT 7701 27.637 55.757 61.129 1.00 0.00 O ATOM 40482 H1 WAT 7701 26.881 56.248 61.450 1.00 0.00 H ATOM 40483 H2 WAT 7701 27.655 55.933 60.188 1.00 0.00 H TER 40485 WAT 7701 ATOM 40485 O WAT 7702 17.766 25.660 99.486 1.00 0.00 O ATOM 40486 H1 WAT 7702 18.507 25.103 99.248 1.00 0.00 H ATOM 40487 H2 WAT 7702 17.187 25.626 98.724 1.00 0.00 H TER 40489 WAT 7702 ATOM 40489 O WAT 7703 94.720 116.152 14.633 1.00 0.00 O ATOM 40490 H1 WAT 7703 95.522 116.126 14.111 1.00 0.00 H ATOM 40491 H2 WAT 7703 94.843 116.895 15.224 1.00 0.00 H TER 40493 WAT 7703 ATOM 40493 O WAT 7704 18.096 114.345 97.443 1.00 0.00 O ATOM 40494 H1 WAT 7704 17.409 114.969 97.678 1.00 0.00 H ATOM 40495 H2 WAT 7704 18.857 114.623 97.952 1.00 0.00 H TER 40497 WAT 7704 ATOM 40497 O WAT 7705 68.944 134.890 141.753 1.00 0.00 O ATOM 40498 H1 WAT 7705 67.997 135.009 141.825 1.00 0.00 H ATOM 40499 H2 WAT 7705 69.083 134.633 140.841 1.00 0.00 H TER 40501 WAT 7705 ATOM 40501 O WAT 7706 16.645 33.470 151.400 1.00 0.00 O ATOM 40502 H1 WAT 7706 17.395 34.062 151.341 1.00 0.00 H ATOM 40503 H2 WAT 7706 15.977 33.975 151.863 1.00 0.00 H TER 40505 WAT 7706 ATOM 40505 O WAT 7707 87.441 138.211 69.318 1.00 0.00 O ATOM 40506 H1 WAT 7707 87.361 137.286 69.552 1.00 0.00 H ATOM 40507 H2 WAT 7707 87.275 138.680 70.136 1.00 0.00 H TER 40509 WAT 7707 ATOM 40509 O WAT 7708 83.627 108.124 53.599 1.00 0.00 O ATOM 40510 H1 WAT 7708 83.640 107.962 54.542 1.00 0.00 H ATOM 40511 H2 WAT 7708 82.795 107.756 53.304 1.00 0.00 H TER 40513 WAT 7708 ATOM 40513 O WAT 7709 41.442 64.914 99.565 1.00 0.00 O ATOM 40514 H1 WAT 7709 41.420 65.278 98.680 1.00 0.00 H ATOM 40515 H2 WAT 7709 40.842 65.466 100.066 1.00 0.00 H TER 40517 WAT 7709 ATOM 40517 O WAT 7710 128.704 4.810 73.324 1.00 0.00 O ATOM 40518 H1 WAT 7710 128.278 4.947 72.478 1.00 0.00 H ATOM 40519 H2 WAT 7710 128.635 5.656 73.767 1.00 0.00 H TER 40521 WAT 7710 ATOM 40521 O WAT 7711 24.231 45.315 66.709 1.00 0.00 O ATOM 40522 H1 WAT 7711 24.103 45.485 65.776 1.00 0.00 H ATOM 40523 H2 WAT 7711 23.963 44.404 66.826 1.00 0.00 H TER 40525 WAT 7711 ATOM 40525 O WAT 7712 110.460 25.541 140.778 1.00 0.00 O ATOM 40526 H1 WAT 7712 109.880 25.203 141.461 1.00 0.00 H ATOM 40527 H2 WAT 7712 110.022 25.313 139.958 1.00 0.00 H TER 40529 WAT 7712 ATOM 40529 O WAT 7713 40.091 139.409 153.597 1.00 0.00 O ATOM 40530 H1 WAT 7713 40.364 139.812 154.421 1.00 0.00 H ATOM 40531 H2 WAT 7713 40.909 139.247 153.127 1.00 0.00 H TER 40533 WAT 7713 ATOM 40533 O WAT 7714 83.075 21.618 92.027 1.00 0.00 O ATOM 40534 H1 WAT 7714 83.935 21.461 91.635 1.00 0.00 H ATOM 40535 H2 WAT 7714 83.136 22.500 92.394 1.00 0.00 H TER 40537 WAT 7714 ATOM 40537 O WAT 7715 34.075 79.329 70.717 1.00 0.00 O ATOM 40538 H1 WAT 7715 33.420 78.632 70.670 1.00 0.00 H ATOM 40539 H2 WAT 7715 34.906 78.889 70.534 1.00 0.00 H TER 40541 WAT 7715 ATOM 40541 O WAT 7716 76.667 79.142 122.644 1.00 0.00 O ATOM 40542 H1 WAT 7716 77.516 79.000 123.063 1.00 0.00 H ATOM 40543 H2 WAT 7716 76.551 78.382 122.074 1.00 0.00 H TER 40545 WAT 7716 ATOM 40545 O WAT 7717 126.907 29.732 94.863 1.00 0.00 O ATOM 40546 H1 WAT 7717 127.263 28.847 94.798 1.00 0.00 H ATOM 40547 H2 WAT 7717 127.430 30.247 94.249 1.00 0.00 H TER 40549 WAT 7717 ATOM 40549 O WAT 7718 46.050 90.321 3.977 1.00 0.00 O ATOM 40550 H1 WAT 7718 45.609 89.545 3.631 1.00 0.00 H ATOM 40551 H2 WAT 7718 46.661 90.577 3.285 1.00 0.00 H TER 40553 WAT 7718 ATOM 40553 O WAT 7719 67.133 84.111 132.135 1.00 0.00 O ATOM 40554 H1 WAT 7719 67.140 83.316 132.668 1.00 0.00 H ATOM 40555 H2 WAT 7719 67.482 84.790 132.712 1.00 0.00 H TER 40557 WAT 7719 ATOM 40557 O WAT 7720 29.583 121.862 130.103 1.00 0.00 O ATOM 40558 H1 WAT 7720 29.626 121.002 130.520 1.00 0.00 H ATOM 40559 H2 WAT 7720 30.357 121.896 129.541 1.00 0.00 H TER 40561 WAT 7720 ATOM 40561 O WAT 7721 62.576 131.387 102.037 1.00 0.00 O ATOM 40562 H1 WAT 7721 62.516 132.014 101.316 1.00 0.00 H ATOM 40563 H2 WAT 7721 62.304 130.554 101.652 1.00 0.00 H TER 40565 WAT 7721 ATOM 40565 O WAT 7722 124.004 69.998 19.057 1.00 0.00 O ATOM 40566 H1 WAT 7722 124.339 69.736 18.200 1.00 0.00 H ATOM 40567 H2 WAT 7722 124.503 69.471 19.681 1.00 0.00 H TER 40569 WAT 7722 ATOM 40569 O WAT 7723 133.708 32.782 112.984 1.00 0.00 O ATOM 40570 H1 WAT 7723 133.633 32.243 112.196 1.00 0.00 H ATOM 40571 H2 WAT 7723 133.979 32.170 113.668 1.00 0.00 H TER 40573 WAT 7723 ATOM 40573 O WAT 7724 142.333 57.965 123.087 1.00 0.00 O ATOM 40574 H1 WAT 7724 142.919 57.346 123.524 1.00 0.00 H ATOM 40575 H2 WAT 7724 141.456 57.612 123.239 1.00 0.00 H TER 40577 WAT 7724 ATOM 40577 O WAT 7725 27.241 32.898 17.224 1.00 0.00 O ATOM 40578 H1 WAT 7725 26.827 32.087 16.931 1.00 0.00 H ATOM 40579 H2 WAT 7725 28.164 32.670 17.335 1.00 0.00 H TER 40581 WAT 7725 ATOM 40581 O WAT 7726 3.147 66.188 16.262 1.00 0.00 O ATOM 40582 H1 WAT 7726 3.462 66.910 15.717 1.00 0.00 H ATOM 40583 H2 WAT 7726 2.895 66.603 17.087 1.00 0.00 H TER 40585 WAT 7726 ATOM 40585 O WAT 7727 35.863 98.822 140.634 1.00 0.00 O ATOM 40586 H1 WAT 7727 35.885 98.721 141.586 1.00 0.00 H ATOM 40587 H2 WAT 7727 36.728 98.533 140.343 1.00 0.00 H TER 40589 WAT 7727 ATOM 40589 O WAT 7728 70.876 82.490 58.637 1.00 0.00 O ATOM 40590 H1 WAT 7728 71.688 82.570 58.136 1.00 0.00 H ATOM 40591 H2 WAT 7728 70.466 83.352 58.569 1.00 0.00 H TER 40593 WAT 7728 ATOM 40593 O WAT 7729 73.542 10.545 153.442 1.00 0.00 O ATOM 40594 H1 WAT 7729 72.947 10.112 152.831 1.00 0.00 H ATOM 40595 H2 WAT 7729 73.006 10.716 154.217 1.00 0.00 H TER 40597 WAT 7729 ATOM 40597 O WAT 7730 48.929 139.244 128.256 1.00 0.00 O ATOM 40598 H1 WAT 7730 48.719 138.357 127.965 1.00 0.00 H ATOM 40599 H2 WAT 7730 48.915 139.768 127.454 1.00 0.00 H TER 40601 WAT 7730 ATOM 40601 O WAT 7731 110.788 2.730 57.664 1.00 0.00 O ATOM 40602 H1 WAT 7731 110.752 3.680 57.545 1.00 0.00 H ATOM 40603 H2 WAT 7731 111.713 2.545 57.829 1.00 0.00 H TER 40605 WAT 7731 ATOM 40605 O WAT 7732 94.370 79.009 118.978 1.00 0.00 O ATOM 40606 H1 WAT 7732 94.373 78.052 118.974 1.00 0.00 H ATOM 40607 H2 WAT 7732 95.086 79.248 119.567 1.00 0.00 H TER 40609 WAT 7732 ATOM 40609 O WAT 7733 42.910 94.077 10.218 1.00 0.00 O ATOM 40610 H1 WAT 7733 42.596 93.290 9.774 1.00 0.00 H ATOM 40611 H2 WAT 7733 42.437 94.088 11.050 1.00 0.00 H TER 40613 WAT 7733 ATOM 40613 O WAT 7734 0.888 120.404 150.514 1.00 0.00 O ATOM 40614 H1 WAT 7734 0.715 120.473 151.453 1.00 0.00 H ATOM 40615 H2 WAT 7734 0.873 119.463 150.337 1.00 0.00 H TER 40617 WAT 7734 ATOM 40617 O WAT 7735 31.164 92.138 130.679 1.00 0.00 O ATOM 40618 H1 WAT 7735 30.269 92.081 130.344 1.00 0.00 H ATOM 40619 H2 WAT 7735 31.192 91.505 131.396 1.00 0.00 H TER 40621 WAT 7735 ATOM 40621 O WAT 7736 59.564 72.003 111.291 1.00 0.00 O ATOM 40622 H1 WAT 7736 60.331 72.333 110.822 1.00 0.00 H ATOM 40623 H2 WAT 7736 59.416 71.132 110.923 1.00 0.00 H TER 40625 WAT 7736 ATOM 40625 O WAT 7737 119.911 37.166 131.332 1.00 0.00 O ATOM 40626 H1 WAT 7737 119.361 37.149 132.115 1.00 0.00 H ATOM 40627 H2 WAT 7737 119.338 36.856 130.630 1.00 0.00 H TER 40629 WAT 7737 ATOM 40629 O WAT 7738 43.623 54.064 96.558 1.00 0.00 O ATOM 40630 H1 WAT 7738 42.881 53.876 95.983 1.00 0.00 H ATOM 40631 H2 WAT 7738 44.295 54.417 95.975 1.00 0.00 H TER 40633 WAT 7738 ATOM 40633 O WAT 7739 49.261 105.555 66.025 1.00 0.00 O ATOM 40634 H1 WAT 7739 49.259 105.505 65.069 1.00 0.00 H ATOM 40635 H2 WAT 7739 49.830 106.298 66.224 1.00 0.00 H TER 40637 WAT 7739 ATOM 40637 O WAT 7740 94.886 97.981 23.811 1.00 0.00 O ATOM 40638 H1 WAT 7740 94.617 97.343 24.472 1.00 0.00 H ATOM 40639 H2 WAT 7740 94.583 98.822 24.152 1.00 0.00 H TER 40641 WAT 7740 ATOM 40641 O WAT 7741 23.662 66.368 71.316 1.00 0.00 O ATOM 40642 H1 WAT 7741 23.338 66.065 70.468 1.00 0.00 H ATOM 40643 H2 WAT 7741 22.878 66.659 71.782 1.00 0.00 H TER 40645 WAT 7741 ATOM 40645 O WAT 7742 44.380 93.717 154.493 1.00 0.00 O ATOM 40646 H1 WAT 7742 43.859 93.237 155.138 1.00 0.00 H ATOM 40647 H2 WAT 7742 44.418 93.134 153.735 1.00 0.00 H TER 40649 WAT 7742 ATOM 40649 O WAT 7743 73.282 78.771 6.275 1.00 0.00 O ATOM 40650 H1 WAT 7743 72.498 78.337 5.941 1.00 0.00 H ATOM 40651 H2 WAT 7743 73.015 79.131 7.121 1.00 0.00 H TER 40653 WAT 7743 ATOM 40653 O WAT 7744 13.195 38.223 105.904 1.00 0.00 O ATOM 40654 H1 WAT 7744 12.673 38.778 106.484 1.00 0.00 H ATOM 40655 H2 WAT 7744 12.625 38.059 105.153 1.00 0.00 H TER 40657 WAT 7744 ATOM 40657 O WAT 7745 122.838 88.915 148.738 1.00 0.00 O ATOM 40658 H1 WAT 7745 122.624 89.797 149.042 1.00 0.00 H ATOM 40659 H2 WAT 7745 123.092 88.443 149.532 1.00 0.00 H TER 40661 WAT 7745 ATOM 40661 O WAT 7746 115.454 137.832 131.267 1.00 0.00 O ATOM 40662 H1 WAT 7746 114.793 137.427 131.828 1.00 0.00 H ATOM 40663 H2 WAT 7746 115.968 138.379 131.861 1.00 0.00 H TER 40665 WAT 7746 ATOM 40665 O WAT 7747 96.113 45.908 107.887 1.00 0.00 O ATOM 40666 H1 WAT 7747 97.042 45.744 108.052 1.00 0.00 H ATOM 40667 H2 WAT 7747 96.104 46.481 107.121 1.00 0.00 H TER 40669 WAT 7747 ATOM 40669 O WAT 7748 38.465 143.695 107.765 1.00 0.00 O ATOM 40670 H1 WAT 7748 38.268 144.632 107.749 1.00 0.00 H ATOM 40671 H2 WAT 7748 38.174 143.404 108.629 1.00 0.00 H TER 40673 WAT 7748 ATOM 40673 O WAT 7749 96.306 18.849 144.296 1.00 0.00 O ATOM 40674 H1 WAT 7749 96.311 17.909 144.117 1.00 0.00 H ATOM 40675 H2 WAT 7749 97.205 19.048 144.558 1.00 0.00 H TER 40677 WAT 7749 ATOM 40677 O WAT 7750 12.019 89.363 65.497 1.00 0.00 O ATOM 40678 H1 WAT 7750 12.718 89.865 65.077 1.00 0.00 H ATOM 40679 H2 WAT 7750 11.306 89.366 64.859 1.00 0.00 H TER 40681 WAT 7750 ATOM 40681 O WAT 7751 111.718 107.023 93.724 1.00 0.00 O ATOM 40682 H1 WAT 7751 110.903 107.510 93.848 1.00 0.00 H ATOM 40683 H2 WAT 7751 111.583 106.534 92.913 1.00 0.00 H TER 40685 WAT 7751 ATOM 40685 O WAT 7752 6.874 19.089 94.651 1.00 0.00 O ATOM 40686 H1 WAT 7752 7.664 18.715 95.042 1.00 0.00 H ATOM 40687 H2 WAT 7752 6.385 18.332 94.329 1.00 0.00 H TER 40689 WAT 7752 ATOM 40689 O WAT 7753 62.308 12.814 127.234 1.00 0.00 O ATOM 40690 H1 WAT 7753 61.684 12.146 126.951 1.00 0.00 H ATOM 40691 H2 WAT 7753 62.768 12.414 127.972 1.00 0.00 H TER 40693 WAT 7753 ATOM 40693 O WAT 7754 143.812 84.063 20.286 1.00 0.00 O ATOM 40694 H1 WAT 7754 143.669 83.549 19.492 1.00 0.00 H ATOM 40695 H2 WAT 7754 143.811 84.972 19.986 1.00 0.00 H TER 40697 WAT 7754 ATOM 40697 O WAT 7755 134.703 97.291 79.438 1.00 0.00 O ATOM 40698 H1 WAT 7755 134.011 96.918 79.985 1.00 0.00 H ATOM 40699 H2 WAT 7755 135.370 96.606 79.395 1.00 0.00 H TER 40701 WAT 7755 ATOM 40701 O WAT 7756 34.718 20.732 86.123 1.00 0.00 O ATOM 40702 H1 WAT 7756 34.634 21.190 86.959 1.00 0.00 H ATOM 40703 H2 WAT 7756 35.368 21.239 85.636 1.00 0.00 H TER 40705 WAT 7756 ATOM 40705 O WAT 7757 1.132 119.064 83.169 1.00 0.00 O ATOM 40706 H1 WAT 7757 1.759 118.466 83.577 1.00 0.00 H ATOM 40707 H2 WAT 7757 0.474 119.220 83.847 1.00 0.00 H TER 40709 WAT 7757 ATOM 40709 O WAT 7758 70.519 53.011 27.064 1.00 0.00 O ATOM 40710 H1 WAT 7758 69.575 52.999 27.220 1.00 0.00 H ATOM 40711 H2 WAT 7758 70.824 53.807 27.500 1.00 0.00 H TER 40713 WAT 7758 ATOM 40713 O WAT 7759 58.813 21.719 104.801 1.00 0.00 O ATOM 40714 H1 WAT 7759 57.897 21.452 104.875 1.00 0.00 H ATOM 40715 H2 WAT 7759 58.928 21.926 103.874 1.00 0.00 H TER 40717 WAT 7759 ATOM 40717 O WAT 7760 70.362 109.054 0.755 1.00 0.00 O ATOM 40718 H1 WAT 7760 69.459 108.897 0.478 1.00 0.00 H ATOM 40719 H2 WAT 7760 70.871 109.016 -0.054 1.00 0.00 H TER 40721 WAT 7760 ATOM 40721 O WAT 7761 58.225 44.571 84.915 1.00 0.00 O ATOM 40722 H1 WAT 7761 58.582 44.710 85.792 1.00 0.00 H ATOM 40723 H2 WAT 7761 57.685 43.785 84.997 1.00 0.00 H TER 40725 WAT 7761 ATOM 40725 O WAT 7762 22.883 119.396 149.945 1.00 0.00 O ATOM 40726 H1 WAT 7762 22.498 118.553 150.183 1.00 0.00 H ATOM 40727 H2 WAT 7762 23.701 119.435 150.440 1.00 0.00 H TER 40729 WAT 7762 ATOM 40729 O WAT 7763 47.345 112.462 123.184 1.00 0.00 O ATOM 40730 H1 WAT 7763 47.735 112.849 123.967 1.00 0.00 H ATOM 40731 H2 WAT 7763 47.319 113.179 122.550 1.00 0.00 H TER 40733 WAT 7763 ATOM 40733 O WAT 7764 80.752 126.875 112.502 1.00 0.00 O ATOM 40734 H1 WAT 7764 81.398 126.793 111.800 1.00 0.00 H ATOM 40735 H2 WAT 7764 80.542 125.972 112.741 1.00 0.00 H TER 40737 WAT 7764 ATOM 40737 O WAT 7765 28.663 118.923 54.061 1.00 0.00 O ATOM 40738 H1 WAT 7765 28.140 119.466 54.650 1.00 0.00 H ATOM 40739 H2 WAT 7765 28.018 118.424 53.559 1.00 0.00 H TER 40741 WAT 7765 ATOM 40741 O WAT 7766 8.980 71.834 154.294 1.00 0.00 O ATOM 40742 H1 WAT 7766 9.176 72.388 155.049 1.00 0.00 H ATOM 40743 H2 WAT 7766 8.091 72.081 154.039 1.00 0.00 H TER 40745 WAT 7766 ATOM 40745 O WAT 7767 71.639 82.826 92.831 1.00 0.00 O ATOM 40746 H1 WAT 7767 72.524 82.463 92.875 1.00 0.00 H ATOM 40747 H2 WAT 7767 71.329 82.813 93.736 1.00 0.00 H TER 40749 WAT 7767 ATOM 40749 O WAT 7768 124.251 36.964 12.493 1.00 0.00 O ATOM 40750 H1 WAT 7768 124.648 36.919 11.623 1.00 0.00 H ATOM 40751 H2 WAT 7768 123.315 37.077 12.323 1.00 0.00 H TER 40753 WAT 7768 ATOM 40753 O WAT 7769 118.921 52.123 156.318 1.00 0.00 O ATOM 40754 H1 WAT 7769 119.770 52.407 156.656 1.00 0.00 H ATOM 40755 H2 WAT 7769 118.919 51.174 156.442 1.00 0.00 H TER 40757 WAT 7769 ATOM 40757 O WAT 7770 19.330 139.412 147.353 1.00 0.00 O ATOM 40758 H1 WAT 7770 18.620 139.802 147.863 1.00 0.00 H ATOM 40759 H2 WAT 7770 19.795 138.855 147.978 1.00 0.00 H TER 40761 WAT 7770 ATOM 40761 O WAT 7771 74.444 117.280 67.155 1.00 0.00 O ATOM 40762 H1 WAT 7771 73.984 116.498 66.849 1.00 0.00 H ATOM 40763 H2 WAT 7771 75.171 116.941 67.677 1.00 0.00 H TER 40765 WAT 7771 ATOM 40765 O WAT 7772 118.010 136.005 72.080 1.00 0.00 O ATOM 40766 H1 WAT 7772 118.103 135.579 72.932 1.00 0.00 H ATOM 40767 H2 WAT 7772 117.710 136.890 72.286 1.00 0.00 H TER 40769 WAT 7772 ATOM 40769 O WAT 7773 5.216 127.239 75.745 1.00 0.00 O ATOM 40770 H1 WAT 7773 5.176 126.868 74.863 1.00 0.00 H ATOM 40771 H2 WAT 7773 4.826 126.569 76.305 1.00 0.00 H TER 40773 WAT 7773 ATOM 40773 O WAT 7774 6.362 96.037 20.577 1.00 0.00 O ATOM 40774 H1 WAT 7774 6.887 96.107 21.374 1.00 0.00 H ATOM 40775 H2 WAT 7774 6.791 95.349 20.068 1.00 0.00 H TER 40777 WAT 7774 ATOM 40777 O WAT 7775 19.887 65.999 86.229 1.00 0.00 O ATOM 40778 H1 WAT 7775 19.145 65.460 86.503 1.00 0.00 H ATOM 40779 H2 WAT 7775 20.656 65.533 86.559 1.00 0.00 H TER 40781 WAT 7775 ATOM 40781 O WAT 7776 142.967 84.544 64.010 1.00 0.00 O ATOM 40782 H1 WAT 7776 142.222 84.757 63.448 1.00 0.00 H ATOM 40783 H2 WAT 7776 142.918 83.595 64.122 1.00 0.00 H TER 40785 WAT 7776 ATOM 40785 O WAT 7777 15.097 66.239 128.013 1.00 0.00 O ATOM 40786 H1 WAT 7777 15.843 66.352 128.602 1.00 0.00 H ATOM 40787 H2 WAT 7777 15.467 66.341 127.136 1.00 0.00 H TER 40789 WAT 7777 ATOM 40789 O WAT 7778 129.791 67.478 1.129 1.00 0.00 O ATOM 40790 H1 WAT 7778 130.628 67.879 1.361 1.00 0.00 H ATOM 40791 H2 WAT 7778 129.519 67.016 1.922 1.00 0.00 H TER 40793 WAT 7778 ATOM 40793 O WAT 7779 21.493 110.143 23.361 1.00 0.00 O ATOM 40794 H1 WAT 7779 20.696 110.647 23.521 1.00 0.00 H ATOM 40795 H2 WAT 7779 21.975 110.187 24.187 1.00 0.00 H TER 40797 WAT 7779 ATOM 40797 O WAT 7780 107.114 112.651 148.132 1.00 0.00 O ATOM 40798 H1 WAT 7780 107.327 111.730 147.978 1.00 0.00 H ATOM 40799 H2 WAT 7780 107.619 113.126 147.472 1.00 0.00 H TER 40801 WAT 7780 ATOM 40801 O WAT 7781 101.990 133.872 143.326 1.00 0.00 O ATOM 40802 H1 WAT 7781 101.651 134.444 144.015 1.00 0.00 H ATOM 40803 H2 WAT 7781 102.339 134.470 142.666 1.00 0.00 H TER 40805 WAT 7781 ATOM 40805 O WAT 7782 81.058 55.107 65.216 1.00 0.00 O ATOM 40806 H1 WAT 7782 80.640 54.498 64.608 1.00 0.00 H ATOM 40807 H2 WAT 7782 81.099 55.934 64.736 1.00 0.00 H TER 40809 WAT 7782 ATOM 40809 O WAT 7783 100.804 6.593 98.303 1.00 0.00 O ATOM 40810 H1 WAT 7783 101.097 7.504 98.316 1.00 0.00 H ATOM 40811 H2 WAT 7783 101.208 6.201 99.077 1.00 0.00 H TER 40813 WAT 7783 ATOM 40813 O WAT 7784 115.040 89.271 87.326 1.00 0.00 O ATOM 40814 H1 WAT 7784 114.106 89.090 87.433 1.00 0.00 H ATOM 40815 H2 WAT 7784 115.476 88.592 87.840 1.00 0.00 H TER 40817 WAT 7784 ATOM 40817 O WAT 7785 38.409 97.941 3.769 1.00 0.00 O ATOM 40818 H1 WAT 7785 37.991 98.794 3.888 1.00 0.00 H ATOM 40819 H2 WAT 7785 39.066 97.897 4.463 1.00 0.00 H TER 40821 WAT 7785 ATOM 40821 O WAT 7786 94.142 48.639 87.688 1.00 0.00 O ATOM 40822 H1 WAT 7786 94.889 48.480 87.111 1.00 0.00 H ATOM 40823 H2 WAT 7786 94.183 49.576 87.881 1.00 0.00 H TER 40825 WAT 7786 ATOM 40825 O WAT 7787 108.268 37.557 75.910 1.00 0.00 O ATOM 40826 H1 WAT 7787 107.469 38.068 75.777 1.00 0.00 H ATOM 40827 H2 WAT 7787 108.961 38.212 75.992 1.00 0.00 H TER 40829 WAT 7787 ATOM 40829 O WAT 7788 39.807 135.240 130.442 1.00 0.00 O ATOM 40830 H1 WAT 7788 40.709 135.142 130.747 1.00 0.00 H ATOM 40831 H2 WAT 7788 39.647 136.184 130.468 1.00 0.00 H TER 40833 WAT 7788 ATOM 40833 O WAT 7789 122.018 140.563 95.753 1.00 0.00 O ATOM 40834 H1 WAT 7789 122.016 139.978 94.995 1.00 0.00 H ATOM 40835 H2 WAT 7789 122.629 140.156 96.368 1.00 0.00 H TER 40837 WAT 7789 ATOM 40837 O WAT 7790 127.880 102.415 2.627 1.00 0.00 O ATOM 40838 H1 WAT 7790 128.793 102.701 2.630 1.00 0.00 H ATOM 40839 H2 WAT 7790 127.376 103.220 2.506 1.00 0.00 H TER 40841 WAT 7790 ATOM 40841 O WAT 7791 71.921 128.857 114.463 1.00 0.00 O ATOM 40842 H1 WAT 7791 72.806 128.937 114.821 1.00 0.00 H ATOM 40843 H2 WAT 7791 71.571 129.747 114.489 1.00 0.00 H TER 40845 WAT 7791 ATOM 40845 O WAT 7792 85.908 3.687 111.917 1.00 0.00 O ATOM 40846 H1 WAT 7792 86.248 4.579 111.989 1.00 0.00 H ATOM 40847 H2 WAT 7792 86.536 3.238 111.350 1.00 0.00 H TER 40849 WAT 7792 ATOM 40849 O WAT 7793 5.992 92.426 73.195 1.00 0.00 O ATOM 40850 H1 WAT 7793 6.852 92.101 72.927 1.00 0.00 H ATOM 40851 H2 WAT 7793 5.536 91.652 73.524 1.00 0.00 H TER 40853 WAT 7793 ATOM 40853 O WAT 7794 53.123 113.365 11.455 1.00 0.00 O ATOM 40854 H1 WAT 7794 53.480 114.243 11.588 1.00 0.00 H ATOM 40855 H2 WAT 7794 53.115 112.975 12.329 1.00 0.00 H TER 40857 WAT 7794 ATOM 40857 O WAT 7795 70.075 59.091 14.808 1.00 0.00 O ATOM 40858 H1 WAT 7795 69.498 58.376 14.540 1.00 0.00 H ATOM 40859 H2 WAT 7795 69.649 59.467 15.578 1.00 0.00 H TER 40861 WAT 7795 ATOM 40861 O WAT 7796 134.237 42.792 95.449 1.00 0.00 O ATOM 40862 H1 WAT 7796 134.154 42.016 96.004 1.00 0.00 H ATOM 40863 H2 WAT 7796 134.166 43.528 96.056 1.00 0.00 H TER 40865 WAT 7796 ATOM 40865 O WAT 7797 71.394 61.411 137.488 1.00 0.00 O ATOM 40866 H1 WAT 7797 71.329 60.827 136.732 1.00 0.00 H ATOM 40867 H2 WAT 7797 71.763 62.220 137.135 1.00 0.00 H TER 40869 WAT 7797 ATOM 40869 O WAT 7798 34.523 78.023 104.287 1.00 0.00 O ATOM 40870 H1 WAT 7798 33.860 77.403 104.591 1.00 0.00 H ATOM 40871 H2 WAT 7798 34.914 77.601 103.522 1.00 0.00 H TER 40873 WAT 7798 ATOM 40873 O WAT 7799 30.686 123.318 136.600 1.00 0.00 O ATOM 40874 H1 WAT 7799 30.729 122.812 135.789 1.00 0.00 H ATOM 40875 H2 WAT 7799 30.546 124.220 136.312 1.00 0.00 H TER 40877 WAT 7799 ATOM 40877 O WAT 7800 44.737 43.110 67.612 1.00 0.00 O ATOM 40878 H1 WAT 7800 44.668 43.573 66.777 1.00 0.00 H ATOM 40879 H2 WAT 7800 44.003 43.442 68.131 1.00 0.00 H TER 40881 WAT 7800 ATOM 40881 O WAT 7801 48.933 14.235 126.576 1.00 0.00 O ATOM 40882 H1 WAT 7801 48.894 13.414 126.087 1.00 0.00 H ATOM 40883 H2 WAT 7801 48.233 14.161 127.225 1.00 0.00 H TER 40885 WAT 7801 ATOM 40885 O WAT 7802 129.319 89.895 114.140 1.00 0.00 O ATOM 40886 H1 WAT 7802 129.518 90.174 113.247 1.00 0.00 H ATOM 40887 H2 WAT 7802 129.511 88.957 114.147 1.00 0.00 H TER 40889 WAT 7802 ATOM 40889 O WAT 7803 39.098 62.804 96.703 1.00 0.00 O ATOM 40890 H1 WAT 7803 38.685 61.940 96.726 1.00 0.00 H ATOM 40891 H2 WAT 7803 40.027 62.621 96.564 1.00 0.00 H TER 40893 WAT 7803 ATOM 40893 O WAT 7804 41.728 105.279 124.506 1.00 0.00 O ATOM 40894 H1 WAT 7804 41.078 104.599 124.680 1.00 0.00 H ATOM 40895 H2 WAT 7804 41.266 105.921 123.968 1.00 0.00 H TER 40897 WAT 7804 ATOM 40897 O WAT 7805 26.878 130.846 132.539 1.00 0.00 O ATOM 40898 H1 WAT 7805 27.254 131.146 131.712 1.00 0.00 H ATOM 40899 H2 WAT 7805 26.347 130.087 132.300 1.00 0.00 H TER 40901 WAT 7805 ATOM 40901 O WAT 7806 67.625 40.451 74.671 1.00 0.00 O ATOM 40902 H1 WAT 7806 68.469 40.412 75.120 1.00 0.00 H ATOM 40903 H2 WAT 7806 67.081 41.004 75.232 1.00 0.00 H TER 40905 WAT 7806 ATOM 40905 O WAT 7807 61.975 126.108 80.992 1.00 0.00 O ATOM 40906 H1 WAT 7807 62.291 125.257 81.294 1.00 0.00 H ATOM 40907 H2 WAT 7807 62.490 126.290 80.206 1.00 0.00 H TER 40909 WAT 7807 ATOM 40909 O WAT 7808 113.552 58.670 142.040 1.00 0.00 O ATOM 40910 H1 WAT 7808 112.774 59.189 142.242 1.00 0.00 H ATOM 40911 H2 WAT 7808 113.616 58.694 141.086 1.00 0.00 H TER 40913 WAT 7808 ATOM 40913 O WAT 7809 108.615 53.077 79.385 1.00 0.00 O ATOM 40914 H1 WAT 7809 107.660 53.019 79.372 1.00 0.00 H ATOM 40915 H2 WAT 7809 108.797 53.945 79.746 1.00 0.00 H TER 40917 WAT 7809 ATOM 40917 O WAT 7810 29.589 100.253 80.632 1.00 0.00 O ATOM 40918 H1 WAT 7810 30.304 100.644 80.129 1.00 0.00 H ATOM 40919 H2 WAT 7810 29.342 99.476 80.132 1.00 0.00 H TER 40921 WAT 7810 ATOM 40921 O WAT 7811 124.045 0.617 148.288 1.00 0.00 O ATOM 40922 H1 WAT 7811 124.674 -0.104 148.317 1.00 0.00 H ATOM 40923 H2 WAT 7811 124.576 1.403 148.418 1.00 0.00 H TER 40925 WAT 7811 ATOM 40925 O WAT 7812 140.120 37.552 4.409 1.00 0.00 O ATOM 40926 H1 WAT 7812 140.311 38.220 5.067 1.00 0.00 H ATOM 40927 H2 WAT 7812 140.979 37.283 4.084 1.00 0.00 H TER 40929 WAT 7812 ATOM 40929 O WAT 7813 55.182 59.192 3.267 1.00 0.00 O ATOM 40930 H1 WAT 7813 55.503 58.693 2.516 1.00 0.00 H ATOM 40931 H2 WAT 7813 55.905 59.777 3.493 1.00 0.00 H TER 40933 WAT 7813 ATOM 40933 O WAT 7814 31.603 48.660 129.418 1.00 0.00 O ATOM 40934 H1 WAT 7814 31.513 47.821 129.871 1.00 0.00 H ATOM 40935 H2 WAT 7814 31.253 49.303 130.035 1.00 0.00 H TER 40937 WAT 7814 ATOM 40937 O WAT 7815 124.973 21.041 104.041 1.00 0.00 O ATOM 40938 H1 WAT 7815 124.836 20.234 103.545 1.00 0.00 H ATOM 40939 H2 WAT 7815 124.442 20.931 104.830 1.00 0.00 H TER 40941 WAT 7815 ATOM 40941 O WAT 7816 31.041 102.825 27.553 1.00 0.00 O ATOM 40942 H1 WAT 7816 31.679 103.080 26.886 1.00 0.00 H ATOM 40943 H2 WAT 7816 30.415 103.549 27.575 1.00 0.00 H TER 40945 WAT 7816 ATOM 40945 O WAT 7817 55.584 85.270 1.612 1.00 0.00 O ATOM 40946 H1 WAT 7817 56.412 84.840 1.397 1.00 0.00 H ATOM 40947 H2 WAT 7817 55.722 85.633 2.487 1.00 0.00 H TER 40949 WAT 7817 ATOM 40949 O WAT 7818 96.402 71.677 14.803 1.00 0.00 O ATOM 40950 H1 WAT 7818 96.719 71.038 15.442 1.00 0.00 H ATOM 40951 H2 WAT 7818 96.968 71.554 14.041 1.00 0.00 H TER 40953 WAT 7818 ATOM 40953 O WAT 7819 104.944 48.947 119.172 1.00 0.00 O ATOM 40954 H1 WAT 7819 104.934 49.814 119.579 1.00 0.00 H ATOM 40955 H2 WAT 7819 105.441 49.069 118.362 1.00 0.00 H TER 40957 WAT 7819 ATOM 40957 O WAT 7820 95.755 31.469 98.043 1.00 0.00 O ATOM 40958 H1 WAT 7820 95.550 32.285 98.499 1.00 0.00 H ATOM 40959 H2 WAT 7820 96.598 31.634 97.622 1.00 0.00 H TER 40961 WAT 7820 ATOM 40961 O WAT 7821 54.278 107.565 87.388 1.00 0.00 O ATOM 40962 H1 WAT 7821 54.411 107.941 88.258 1.00 0.00 H ATOM 40963 H2 WAT 7821 53.420 107.144 87.439 1.00 0.00 H TER 40965 WAT 7821 ATOM 40965 O WAT 7822 15.316 76.301 23.547 1.00 0.00 O ATOM 40966 H1 WAT 7822 15.906 75.753 23.030 1.00 0.00 H ATOM 40967 H2 WAT 7822 15.810 76.500 24.343 1.00 0.00 H TER 40969 WAT 7822 ATOM 40969 O WAT 7823 63.057 7.637 14.934 1.00 0.00 O ATOM 40970 H1 WAT 7823 63.673 7.092 15.424 1.00 0.00 H ATOM 40971 H2 WAT 7823 62.849 8.358 15.528 1.00 0.00 H TER 40973 WAT 7823 ATOM 40973 O WAT 7824 90.208 10.062 89.222 1.00 0.00 O ATOM 40974 H1 WAT 7824 89.328 10.117 88.849 1.00 0.00 H ATOM 40975 H2 WAT 7824 90.083 10.229 90.156 1.00 0.00 H TER 40977 WAT 7824 ATOM 40977 O WAT 7825 71.676 53.507 120.048 1.00 0.00 O ATOM 40978 H1 WAT 7825 72.462 53.530 119.503 1.00 0.00 H ATOM 40979 H2 WAT 7825 71.167 52.774 119.703 1.00 0.00 H TER 40981 WAT 7825 ATOM 40981 O WAT 7826 35.979 93.285 127.182 1.00 0.00 O ATOM 40982 H1 WAT 7826 36.420 94.129 127.279 1.00 0.00 H ATOM 40983 H2 WAT 7826 36.651 92.637 127.395 1.00 0.00 H TER 40985 WAT 7826 ATOM 40985 O WAT 7827 55.831 70.241 94.192 1.00 0.00 O ATOM 40986 H1 WAT 7827 55.937 69.592 94.888 1.00 0.00 H ATOM 40987 H2 WAT 7827 55.631 71.056 94.653 1.00 0.00 H TER 40989 WAT 7827 ATOM 40989 O WAT 7828 120.622 24.006 120.241 1.00 0.00 O ATOM 40990 H1 WAT 7828 120.067 24.653 120.675 1.00 0.00 H ATOM 40991 H2 WAT 7828 120.038 23.268 120.066 1.00 0.00 H TER 40993 WAT 7828 ATOM 40993 O WAT 7829 136.085 62.049 0.496 1.00 0.00 O ATOM 40994 H1 WAT 7829 136.159 61.098 0.567 1.00 0.00 H ATOM 40995 H2 WAT 7829 136.093 62.359 1.401 1.00 0.00 H TER 40997 WAT 7829 ATOM 40997 O WAT 7830 33.256 5.736 137.686 1.00 0.00 O ATOM 40998 H1 WAT 7830 33.547 5.117 138.356 1.00 0.00 H ATOM 40999 H2 WAT 7830 33.886 6.454 137.733 1.00 0.00 H TER 41001 WAT 7830 ATOM 41001 O WAT 7831 118.269 103.205 155.804 1.00 0.00 O ATOM 41002 H1 WAT 7831 117.676 102.963 156.515 1.00 0.00 H ATOM 41003 H2 WAT 7831 117.697 103.569 155.128 1.00 0.00 H TER 41005 WAT 7831 ATOM 41005 O WAT 7832 91.169 143.782 60.957 1.00 0.00 O ATOM 41006 H1 WAT 7832 90.748 142.976 60.658 1.00 0.00 H ATOM 41007 H2 WAT 7832 91.088 144.383 60.217 1.00 0.00 H TER 41009 WAT 7832 ATOM 41009 O WAT 7833 77.799 126.034 151.350 1.00 0.00 O ATOM 41010 H1 WAT 7833 77.483 125.702 150.509 1.00 0.00 H ATOM 41011 H2 WAT 7833 77.236 126.784 151.538 1.00 0.00 H TER 41013 WAT 7833 ATOM 41013 O WAT 7834 119.691 81.527 88.791 1.00 0.00 O ATOM 41014 H1 WAT 7834 120.107 81.586 89.651 1.00 0.00 H ATOM 41015 H2 WAT 7834 119.312 82.394 88.648 1.00 0.00 H TER 41017 WAT 7834 ATOM 41017 O WAT 7835 9.822 85.545 8.878 1.00 0.00 O ATOM 41018 H1 WAT 7835 9.056 85.504 8.305 1.00 0.00 H ATOM 41019 H2 WAT 7835 10.469 86.042 8.377 1.00 0.00 H TER 41021 WAT 7835 ATOM 41021 O WAT 7836 9.867 107.877 123.791 1.00 0.00 O ATOM 41022 H1 WAT 7836 9.909 107.528 124.682 1.00 0.00 H ATOM 41023 H2 WAT 7836 9.407 107.202 123.291 1.00 0.00 H TER 41025 WAT 7836 ATOM 41025 O WAT 7837 136.108 114.162 154.556 1.00 0.00 O ATOM 41026 H1 WAT 7837 135.592 114.161 153.749 1.00 0.00 H ATOM 41027 H2 WAT 7837 136.807 114.796 154.393 1.00 0.00 H TER 41029 WAT 7837 ATOM 41029 O WAT 7838 121.064 132.550 121.220 1.00 0.00 O ATOM 41030 H1 WAT 7838 121.451 133.405 121.407 1.00 0.00 H ATOM 41031 H2 WAT 7838 121.370 132.336 120.339 1.00 0.00 H TER 41033 WAT 7838 ATOM 41033 O WAT 7839 64.974 5.035 119.733 1.00 0.00 O ATOM 41034 H1 WAT 7839 64.335 4.485 120.187 1.00 0.00 H ATOM 41035 H2 WAT 7839 64.831 4.852 118.804 1.00 0.00 H TER 41037 WAT 7839 ATOM 41037 O WAT 7840 18.909 105.217 147.509 1.00 0.00 O ATOM 41038 H1 WAT 7840 19.347 104.549 148.038 1.00 0.00 H ATOM 41039 H2 WAT 7840 19.438 106.005 147.633 1.00 0.00 H TER 41041 WAT 7840 ATOM 41041 O WAT 7841 91.909 144.150 125.762 1.00 0.00 O ATOM 41042 H1 WAT 7841 91.940 144.172 126.718 1.00 0.00 H ATOM 41043 H2 WAT 7841 91.862 145.071 125.503 1.00 0.00 H TER 41045 WAT 7841 ATOM 41045 O WAT 7842 72.612 66.629 105.495 1.00 0.00 O ATOM 41046 H1 WAT 7842 73.130 65.856 105.718 1.00 0.00 H ATOM 41047 H2 WAT 7842 72.119 66.825 106.291 1.00 0.00 H TER 41049 WAT 7842 ATOM 41049 O WAT 7843 91.610 78.282 0.384 1.00 0.00 O ATOM 41050 H1 WAT 7843 91.915 77.642 -0.260 1.00 0.00 H ATOM 41051 H2 WAT 7843 90.779 78.600 0.030 1.00 0.00 H TER 41053 WAT 7843 ATOM 41053 O WAT 7844 83.763 74.728 66.428 1.00 0.00 O ATOM 41054 H1 WAT 7844 82.832 74.519 66.346 1.00 0.00 H ATOM 41055 H2 WAT 7844 84.121 74.022 66.966 1.00 0.00 H TER 41057 WAT 7844 ATOM 41057 O WAT 7845 76.902 144.368 91.676 1.00 0.00 O ATOM 41058 H1 WAT 7845 77.302 143.549 91.968 1.00 0.00 H ATOM 41059 H2 WAT 7845 75.966 144.248 91.838 1.00 0.00 H TER 41061 WAT 7845 ATOM 41061 O WAT 7846 36.660 13.179 58.882 1.00 0.00 O ATOM 41062 H1 WAT 7846 36.208 13.196 58.038 1.00 0.00 H ATOM 41063 H2 WAT 7846 36.325 12.396 59.318 1.00 0.00 H TER 41065 WAT 7846 ATOM 41065 O WAT 7847 54.000 84.086 5.420 1.00 0.00 O ATOM 41066 H1 WAT 7847 53.968 83.536 4.638 1.00 0.00 H ATOM 41067 H2 WAT 7847 54.849 83.892 5.815 1.00 0.00 H TER 41069 WAT 7847 ATOM 41069 O WAT 7848 71.988 94.846 90.283 1.00 0.00 O ATOM 41070 H1 WAT 7848 72.727 94.515 89.772 1.00 0.00 H ATOM 41071 H2 WAT 7848 71.930 94.253 91.032 1.00 0.00 H TER 41073 WAT 7848 ATOM 41073 O WAT 7849 6.193 87.609 2.202 1.00 0.00 O ATOM 41074 H1 WAT 7849 5.293 87.744 2.499 1.00 0.00 H ATOM 41075 H2 WAT 7849 6.145 87.689 1.249 1.00 0.00 H TER 41077 WAT 7849 ATOM 41077 O WAT 7850 16.740 100.552 10.285 1.00 0.00 O ATOM 41078 H1 WAT 7850 16.894 100.462 11.225 1.00 0.00 H ATOM 41079 H2 WAT 7850 16.082 101.244 10.215 1.00 0.00 H TER 41081 WAT 7850 ATOM 41081 O WAT 7851 25.027 90.231 135.034 1.00 0.00 O ATOM 41082 H1 WAT 7851 25.574 89.517 135.361 1.00 0.00 H ATOM 41083 H2 WAT 7851 24.652 90.625 135.822 1.00 0.00 H TER 41085 WAT 7851 ATOM 41085 O WAT 7852 39.353 36.694 115.690 1.00 0.00 O ATOM 41086 H1 WAT 7852 39.902 37.340 116.133 1.00 0.00 H ATOM 41087 H2 WAT 7852 39.654 36.706 114.781 1.00 0.00 H TER 41089 WAT 7852 ATOM 41089 O WAT 7853 57.222 47.865 148.397 1.00 0.00 O ATOM 41090 H1 WAT 7853 57.471 48.747 148.121 1.00 0.00 H ATOM 41091 H2 WAT 7853 58.049 47.444 148.631 1.00 0.00 H TER 41093 WAT 7853 ATOM 41093 O WAT 7854 137.705 88.655 65.958 1.00 0.00 O ATOM 41094 H1 WAT 7854 137.080 89.309 66.271 1.00 0.00 H ATOM 41095 H2 WAT 7854 137.177 88.047 65.442 1.00 0.00 H TER 41097 WAT 7854 ATOM 41097 O WAT 7855 19.449 50.656 65.152 1.00 0.00 O ATOM 41098 H1 WAT 7855 19.065 51.483 65.443 1.00 0.00 H ATOM 41099 H2 WAT 7855 19.092 50.521 64.275 1.00 0.00 H TER 41101 WAT 7855 ATOM 41101 O WAT 7856 59.390 144.864 12.705 1.00 0.00 O ATOM 41102 H1 WAT 7856 59.387 145.726 12.291 1.00 0.00 H ATOM 41103 H2 WAT 7856 59.044 144.275 12.034 1.00 0.00 H TER 41105 WAT 7856 ATOM 41105 O WAT 7857 89.826 32.181 3.724 1.00 0.00 O ATOM 41106 H1 WAT 7857 90.419 32.739 3.220 1.00 0.00 H ATOM 41107 H2 WAT 7857 90.010 31.294 3.414 1.00 0.00 H TER 41109 WAT 7857 ATOM 41109 O WAT 7858 0.577 67.501 146.383 1.00 0.00 O ATOM 41110 H1 WAT 7858 0.535 68.446 146.530 1.00 0.00 H ATOM 41111 H2 WAT 7858 1.492 67.334 146.154 1.00 0.00 H TER 41113 WAT 7858 ATOM 41113 O WAT 7859 34.676 11.927 110.202 1.00 0.00 O ATOM 41114 H1 WAT 7859 35.521 11.853 109.760 1.00 0.00 H ATOM 41115 H2 WAT 7859 34.434 12.848 110.104 1.00 0.00 H TER 41117 WAT 7859 ATOM 41117 O WAT 7860 83.789 37.445 109.017 1.00 0.00 O ATOM 41118 H1 WAT 7860 82.964 36.972 109.130 1.00 0.00 H ATOM 41119 H2 WAT 7860 83.891 37.947 109.825 1.00 0.00 H TER 41121 WAT 7860 ATOM 41121 O WAT 7861 128.626 133.607 24.241 1.00 0.00 O ATOM 41122 H1 WAT 7861 128.368 133.240 23.395 1.00 0.00 H ATOM 41123 H2 WAT 7861 129.551 133.830 24.132 1.00 0.00 H TER 41125 WAT 7861 ATOM 41125 O WAT 7862 85.347 14.952 148.673 1.00 0.00 O ATOM 41126 H1 WAT 7862 85.525 15.889 148.594 1.00 0.00 H ATOM 41127 H2 WAT 7862 85.398 14.622 147.777 1.00 0.00 H TER 41129 WAT 7862 ATOM 41129 O WAT 7863 61.258 98.970 93.935 1.00 0.00 O ATOM 41130 H1 WAT 7863 60.545 98.583 93.427 1.00 0.00 H ATOM 41131 H2 WAT 7863 60.839 99.664 94.445 1.00 0.00 H TER 41133 WAT 7863 ATOM 41133 O WAT 7864 114.847 54.802 142.078 1.00 0.00 O ATOM 41134 H1 WAT 7864 115.697 55.234 141.987 1.00 0.00 H ATOM 41135 H2 WAT 7864 114.222 55.423 141.703 1.00 0.00 H TER 41137 WAT 7864 ATOM 41137 O WAT 7865 32.030 96.298 147.662 1.00 0.00 O ATOM 41138 H1 WAT 7865 32.128 96.285 146.710 1.00 0.00 H ATOM 41139 H2 WAT 7865 32.694 96.918 147.963 1.00 0.00 H TER 41141 WAT 7865 ATOM 41141 O WAT 7866 139.633 39.785 63.523 1.00 0.00 O ATOM 41142 H1 WAT 7866 140.445 39.328 63.302 1.00 0.00 H ATOM 41143 H2 WAT 7866 138.970 39.378 62.966 1.00 0.00 H TER 41145 WAT 7866 ATOM 41145 O WAT 7867 54.120 142.301 111.838 1.00 0.00 O ATOM 41146 H1 WAT 7867 54.417 143.211 111.813 1.00 0.00 H ATOM 41147 H2 WAT 7867 53.559 142.211 111.067 1.00 0.00 H TER 41149 WAT 7867 ATOM 41149 O WAT 7868 63.748 9.146 62.228 1.00 0.00 O ATOM 41150 H1 WAT 7868 64.220 9.428 61.444 1.00 0.00 H ATOM 41151 H2 WAT 7868 64.235 9.536 62.954 1.00 0.00 H TER 41153 WAT 7868 ATOM 41153 O WAT 7869 5.461 116.132 10.528 1.00 0.00 O ATOM 41154 H1 WAT 7869 5.895 116.900 10.900 1.00 0.00 H ATOM 41155 H2 WAT 7869 5.444 115.497 11.245 1.00 0.00 H TER 41157 WAT 7869 ATOM 41157 O WAT 7870 35.907 24.681 156.169 1.00 0.00 O ATOM 41158 H1 WAT 7870 36.227 23.796 155.994 1.00 0.00 H ATOM 41159 H2 WAT 7870 35.450 24.933 155.366 1.00 0.00 H TER 41161 WAT 7870 ATOM 41161 O WAT 7871 126.559 113.339 4.433 1.00 0.00 O ATOM 41162 H1 WAT 7871 126.726 114.231 4.129 1.00 0.00 H ATOM 41163 H2 WAT 7871 127.172 113.214 5.158 1.00 0.00 H TER 41165 WAT 7871 ATOM 41165 O WAT 7872 97.382 1.726 63.292 1.00 0.00 O ATOM 41166 H1 WAT 7872 98.274 2.041 63.146 1.00 0.00 H ATOM 41167 H2 WAT 7872 96.947 2.445 63.751 1.00 0.00 H TER 41169 WAT 7872 ATOM 41169 O WAT 7873 17.613 137.120 99.876 1.00 0.00 O ATOM 41170 H1 WAT 7873 17.631 136.622 100.693 1.00 0.00 H ATOM 41171 H2 WAT 7873 18.280 137.797 99.993 1.00 0.00 H TER 41173 WAT 7873 ATOM 41173 O WAT 7874 115.482 107.380 150.845 1.00 0.00 O ATOM 41174 H1 WAT 7874 115.130 107.611 149.985 1.00 0.00 H ATOM 41175 H2 WAT 7874 114.743 107.490 151.443 1.00 0.00 H TER 41177 WAT 7874 ATOM 41177 O WAT 7875 85.621 77.270 118.485 1.00 0.00 O ATOM 41178 H1 WAT 7875 85.236 76.396 118.429 1.00 0.00 H ATOM 41179 H2 WAT 7875 86.099 77.268 119.314 1.00 0.00 H TER 41181 WAT 7875 ATOM 41181 O WAT 7876 24.796 71.809 137.241 1.00 0.00 O ATOM 41182 H1 WAT 7876 24.600 71.443 138.103 1.00 0.00 H ATOM 41183 H2 WAT 7876 25.480 71.240 136.889 1.00 0.00 H TER 41185 WAT 7876 ATOM 41185 O WAT 7877 92.510 98.934 137.986 1.00 0.00 O ATOM 41186 H1 WAT 7877 91.694 99.432 138.024 1.00 0.00 H ATOM 41187 H2 WAT 7877 92.236 98.040 137.781 1.00 0.00 H TER 41189 WAT 7877 ATOM 41189 O WAT 7878 89.223 65.169 117.162 1.00 0.00 O ATOM 41190 H1 WAT 7878 89.222 65.796 116.439 1.00 0.00 H ATOM 41191 H2 WAT 7878 90.103 64.791 117.149 1.00 0.00 H TER 41193 WAT 7878 ATOM 41193 O WAT 7879 6.662 52.699 99.639 1.00 0.00 O ATOM 41194 H1 WAT 7879 7.064 51.837 99.529 1.00 0.00 H ATOM 41195 H2 WAT 7879 5.930 52.547 100.237 1.00 0.00 H TER 41197 WAT 7879 ATOM 41197 O WAT 7880 114.325 115.248 3.612 1.00 0.00 O ATOM 41198 H1 WAT 7880 113.855 116.015 3.941 1.00 0.00 H ATOM 41199 H2 WAT 7880 113.915 115.060 2.768 1.00 0.00 H TER 41201 WAT 7880 ATOM 41201 O WAT 7881 12.510 47.109 89.291 1.00 0.00 O ATOM 41202 H1 WAT 7881 12.441 46.503 90.029 1.00 0.00 H ATOM 41203 H2 WAT 7881 11.604 47.274 89.031 1.00 0.00 H TER 41205 WAT 7881 ATOM 41205 O WAT 7882 73.620 19.420 58.317 1.00 0.00 O ATOM 41206 H1 WAT 7882 73.603 20.015 59.066 1.00 0.00 H ATOM 41207 H2 WAT 7882 74.532 19.134 58.258 1.00 0.00 H TER 41209 WAT 7882 ATOM 41209 O WAT 7883 88.671 61.622 128.624 1.00 0.00 O ATOM 41210 H1 WAT 7883 89.411 61.017 128.672 1.00 0.00 H ATOM 41211 H2 WAT 7883 89.069 62.491 128.670 1.00 0.00 H TER 41213 WAT 7883 ATOM 41213 O WAT 7884 139.614 37.409 145.997 1.00 0.00 O ATOM 41214 H1 WAT 7884 140.357 37.505 145.401 1.00 0.00 H ATOM 41215 H2 WAT 7884 138.886 37.149 145.432 1.00 0.00 H TER 41217 WAT 7884 ATOM 41217 O WAT 7885 87.387 59.877 10.844 1.00 0.00 O ATOM 41218 H1 WAT 7885 86.999 60.741 10.982 1.00 0.00 H ATOM 41219 H2 WAT 7885 86.987 59.561 10.034 1.00 0.00 H TER 41221 WAT 7885 ATOM 41221 O WAT 7886 145.002 1.407 105.239 1.00 0.00 O ATOM 41222 H1 WAT 7886 145.245 2.119 105.831 1.00 0.00 H ATOM 41223 H2 WAT 7886 144.045 1.417 105.233 1.00 0.00 H TER 41225 WAT 7886 ATOM 41225 O WAT 7887 23.918 119.511 90.565 1.00 0.00 O ATOM 41226 H1 WAT 7887 23.205 119.190 91.116 1.00 0.00 H ATOM 41227 H2 WAT 7887 24.108 118.784 89.971 1.00 0.00 H TER 41229 WAT 7887 ATOM 41229 O WAT 7888 23.892 5.876 103.169 1.00 0.00 O ATOM 41230 H1 WAT 7888 24.551 5.358 102.707 1.00 0.00 H ATOM 41231 H2 WAT 7888 23.055 5.525 102.864 1.00 0.00 H TER 41233 WAT 7888 ATOM 41233 O WAT 7889 93.841 81.706 57.354 1.00 0.00 O ATOM 41234 H1 WAT 7889 92.969 82.044 57.560 1.00 0.00 H ATOM 41235 H2 WAT 7889 93.716 81.192 56.557 1.00 0.00 H TER 41237 WAT 7889 ATOM 41237 O WAT 7890 142.177 34.082 1.074 1.00 0.00 O ATOM 41238 H1 WAT 7890 141.413 34.348 0.562 1.00 0.00 H ATOM 41239 H2 WAT 7890 142.278 34.772 1.729 1.00 0.00 H TER 41241 WAT 7890 ATOM 41241 O WAT 7891 52.318 80.140 136.025 1.00 0.00 O ATOM 41242 H1 WAT 7891 53.074 79.977 136.589 1.00 0.00 H ATOM 41243 H2 WAT 7891 51.790 80.775 136.511 1.00 0.00 H TER 41245 WAT 7891 ATOM 41245 O WAT 7892 48.041 0.619 113.572 1.00 0.00 O ATOM 41246 H1 WAT 7892 48.992 0.506 113.584 1.00 0.00 H ATOM 41247 H2 WAT 7892 47.758 0.356 114.447 1.00 0.00 H TER 41249 WAT 7892 ATOM 41249 O WAT 7893 110.704 64.710 4.351 1.00 0.00 O ATOM 41250 H1 WAT 7893 111.079 65.499 3.960 1.00 0.00 H ATOM 41251 H2 WAT 7893 111.457 64.143 4.518 1.00 0.00 H TER 41253 WAT 7893 ATOM 41253 O WAT 7894 114.618 104.609 71.048 1.00 0.00 O ATOM 41254 H1 WAT 7894 114.002 105.340 71.007 1.00 0.00 H ATOM 41255 H2 WAT 7894 115.458 104.988 70.788 1.00 0.00 H TER 41257 WAT 7894 ATOM 41257 O WAT 7895 107.610 134.219 14.704 1.00 0.00 O ATOM 41258 H1 WAT 7895 108.089 134.745 14.063 1.00 0.00 H ATOM 41259 H2 WAT 7895 106.765 134.048 14.290 1.00 0.00 H TER 41261 WAT 7895 ATOM 41261 O WAT 7896 104.877 50.382 88.268 1.00 0.00 O ATOM 41262 H1 WAT 7896 105.112 50.096 89.151 1.00 0.00 H ATOM 41263 H2 WAT 7896 104.836 51.337 88.328 1.00 0.00 H TER 41265 WAT 7896 ATOM 41265 O WAT 7897 111.423 19.140 119.950 1.00 0.00 O ATOM 41266 H1 WAT 7897 111.806 18.956 120.808 1.00 0.00 H ATOM 41267 H2 WAT 7897 112.114 18.917 119.326 1.00 0.00 H TER 41269 WAT 7897 ATOM 41269 O WAT 7898 126.335 86.782 135.843 1.00 0.00 O ATOM 41270 H1 WAT 7898 126.571 87.577 135.366 1.00 0.00 H ATOM 41271 H2 WAT 7898 125.835 87.095 136.597 1.00 0.00 H TER 41273 WAT 7898 ATOM 41273 O WAT 7899 52.634 97.175 99.393 1.00 0.00 O ATOM 41274 H1 WAT 7899 52.145 96.389 99.149 1.00 0.00 H ATOM 41275 H2 WAT 7899 52.314 97.394 100.269 1.00 0.00 H TER 41277 WAT 7899 ATOM 41277 O WAT 7900 23.133 19.646 146.882 1.00 0.00 O ATOM 41278 H1 WAT 7900 23.244 20.228 146.131 1.00 0.00 H ATOM 41279 H2 WAT 7900 24.025 19.393 147.122 1.00 0.00 H TER 41281 WAT 7900 ATOM 41281 O WAT 7901 35.223 58.131 91.648 1.00 0.00 O ATOM 41282 H1 WAT 7901 35.124 58.857 91.032 1.00 0.00 H ATOM 41283 H2 WAT 7901 34.513 58.252 92.278 1.00 0.00 H TER 41285 WAT 7901 ATOM 41285 O WAT 7902 59.432 43.805 14.684 1.00 0.00 O ATOM 41286 H1 WAT 7902 60.219 43.262 14.661 1.00 0.00 H ATOM 41287 H2 WAT 7902 59.073 43.669 15.561 1.00 0.00 H TER 41289 WAT 7902 ATOM 41289 O WAT 7903 137.866 79.018 78.077 1.00 0.00 O ATOM 41290 H1 WAT 7903 138.385 79.466 78.745 1.00 0.00 H ATOM 41291 H2 WAT 7903 137.485 79.724 77.555 1.00 0.00 H TER 41293 WAT 7903 ATOM 41293 O WAT 7904 112.634 76.941 144.980 1.00 0.00 O ATOM 41294 H1 WAT 7904 112.294 76.571 145.795 1.00 0.00 H ATOM 41295 H2 WAT 7904 113.303 76.318 144.695 1.00 0.00 H TER 41297 WAT 7904 ATOM 41297 O WAT 7905 58.551 9.639 95.475 1.00 0.00 O ATOM 41298 H1 WAT 7905 58.871 9.301 96.311 1.00 0.00 H ATOM 41299 H2 WAT 7905 59.304 9.576 94.887 1.00 0.00 H TER 41301 WAT 7905 ATOM 41301 O WAT 7906 48.805 69.301 121.876 1.00 0.00 O ATOM 41302 H1 WAT 7906 48.692 70.242 121.738 1.00 0.00 H ATOM 41303 H2 WAT 7906 49.754 69.172 121.884 1.00 0.00 H TER 41305 WAT 7906 ATOM 41305 O WAT 7907 80.420 41.482 107.778 1.00 0.00 O ATOM 41306 H1 WAT 7907 80.618 40.562 107.956 1.00 0.00 H ATOM 41307 H2 WAT 7907 81.154 41.785 107.243 1.00 0.00 H TER 41309 WAT 7907 ATOM 41309 O WAT 7908 71.532 89.573 149.256 1.00 0.00 O ATOM 41310 H1 WAT 7908 72.338 89.246 148.855 1.00 0.00 H ATOM 41311 H2 WAT 7908 70.999 89.867 148.518 1.00 0.00 H TER 41313 WAT 7908 ATOM 41313 O WAT 7909 78.115 123.196 0.339 1.00 0.00 O ATOM 41314 H1 WAT 7909 78.319 123.766 1.081 1.00 0.00 H ATOM 41315 H2 WAT 7909 78.514 123.631 -0.414 1.00 0.00 H TER 41317 WAT 7909 ATOM 41317 O WAT 7910 69.195 15.824 20.020 1.00 0.00 O ATOM 41318 H1 WAT 7910 70.048 15.901 20.446 1.00 0.00 H ATOM 41319 H2 WAT 7910 68.562 15.938 20.729 1.00 0.00 H TER 41321 WAT 7910 ATOM 41321 O WAT 7911 138.981 43.181 25.521 1.00 0.00 O ATOM 41322 H1 WAT 7911 139.367 42.856 24.707 1.00 0.00 H ATOM 41323 H2 WAT 7911 138.981 44.133 25.422 1.00 0.00 H TER 41325 WAT 7911 ATOM 41325 O WAT 7912 64.717 77.772 15.397 1.00 0.00 O ATOM 41326 H1 WAT 7912 64.083 77.150 15.039 1.00 0.00 H ATOM 41327 H2 WAT 7912 65.191 77.274 16.063 1.00 0.00 H TER 41329 WAT 7912 ATOM 41329 O WAT 7913 102.566 32.910 88.373 1.00 0.00 O ATOM 41330 H1 WAT 7913 102.883 32.007 88.349 1.00 0.00 H ATOM 41331 H2 WAT 7913 101.898 32.949 87.689 1.00 0.00 H TER 41333 WAT 7913 ATOM 41333 O WAT 7914 111.408 139.684 134.091 1.00 0.00 O ATOM 41334 H1 WAT 7914 112.245 139.573 133.641 1.00 0.00 H ATOM 41335 H2 WAT 7914 111.629 140.154 134.895 1.00 0.00 H TER 41337 WAT 7914 ATOM 41337 O WAT 7915 128.973 29.328 69.836 1.00 0.00 O ATOM 41338 H1 WAT 7915 128.955 28.949 70.714 1.00 0.00 H ATOM 41339 H2 WAT 7915 129.806 29.036 69.466 1.00 0.00 H TER 41341 WAT 7915 ATOM 41341 O WAT 7916 100.739 24.087 86.850 1.00 0.00 O ATOM 41342 H1 WAT 7916 100.068 24.169 87.528 1.00 0.00 H ATOM 41343 H2 WAT 7916 100.599 24.845 86.282 1.00 0.00 H TER 41345 WAT 7916 ATOM 41345 O WAT 7917 56.455 22.612 158.967 1.00 0.00 O ATOM 41346 H1 WAT 7917 57.110 22.736 158.280 1.00 0.00 H ATOM 41347 H2 WAT 7917 55.803 22.031 158.574 1.00 0.00 H TER 41349 WAT 7917 ATOM 41349 O WAT 7918 4.043 46.631 62.559 1.00 0.00 O ATOM 41350 H1 WAT 7918 4.182 45.689 62.657 1.00 0.00 H ATOM 41351 H2 WAT 7918 3.414 46.854 63.245 1.00 0.00 H TER 41353 WAT 7918 ATOM 41353 O WAT 7919 31.140 8.609 16.648 1.00 0.00 O ATOM 41354 H1 WAT 7919 31.290 8.135 17.466 1.00 0.00 H ATOM 41355 H2 WAT 7919 30.389 9.173 16.832 1.00 0.00 H TER 41357 WAT 7919 ATOM 41357 O WAT 7920 41.575 113.799 98.349 1.00 0.00 O ATOM 41358 H1 WAT 7920 41.357 114.462 97.694 1.00 0.00 H ATOM 41359 H2 WAT 7920 40.833 113.195 98.335 1.00 0.00 H TER 41361 WAT 7920 ATOM 41361 O WAT 7921 135.352 140.880 92.207 1.00 0.00 O ATOM 41362 H1 WAT 7921 135.554 139.977 91.965 1.00 0.00 H ATOM 41363 H2 WAT 7921 134.503 141.053 91.800 1.00 0.00 H TER 41365 WAT 7921 ATOM 41365 O WAT 7922 144.793 44.189 137.534 1.00 0.00 O ATOM 41366 H1 WAT 7922 145.299 43.476 137.925 1.00 0.00 H ATOM 41367 H2 WAT 7922 145.318 44.973 137.698 1.00 0.00 H TER 41369 WAT 7922 ATOM 41369 O WAT 7923 92.378 113.351 140.724 1.00 0.00 O ATOM 41370 H1 WAT 7923 91.948 112.502 140.831 1.00 0.00 H ATOM 41371 H2 WAT 7923 93.069 113.190 140.081 1.00 0.00 H TER 41373 WAT 7923 ATOM 41373 O WAT 7924 125.776 0.224 9.651 1.00 0.00 O ATOM 41374 H1 WAT 7924 125.631 0.121 10.592 1.00 0.00 H ATOM 41375 H2 WAT 7924 125.674 1.163 9.496 1.00 0.00 H TER 41377 WAT 7924 ATOM 41377 O WAT 7925 115.984 27.946 22.426 1.00 0.00 O ATOM 41378 H1 WAT 7925 116.212 27.364 23.150 1.00 0.00 H ATOM 41379 H2 WAT 7925 116.551 28.709 22.543 1.00 0.00 H TER 41381 WAT 7925 ATOM 41381 O WAT 7926 99.900 95.899 121.310 1.00 0.00 O ATOM 41382 H1 WAT 7926 99.376 95.216 121.729 1.00 0.00 H ATOM 41383 H2 WAT 7926 99.255 96.506 120.947 1.00 0.00 H TER 41385 WAT 7926 ATOM 41385 O WAT 7927 63.913 67.887 16.419 1.00 0.00 O ATOM 41386 H1 WAT 7927 63.105 68.390 16.527 1.00 0.00 H ATOM 41387 H2 WAT 7927 64.578 68.543 16.212 1.00 0.00 H TER 41389 WAT 7927 ATOM 41389 O WAT 7928 44.151 39.338 83.768 1.00 0.00 O ATOM 41390 H1 WAT 7928 43.887 40.258 83.756 1.00 0.00 H ATOM 41391 H2 WAT 7928 43.330 38.854 83.853 1.00 0.00 H TER 41393 WAT 7928 ATOM 41393 O WAT 7929 50.030 73.046 150.047 1.00 0.00 O ATOM 41394 H1 WAT 7929 49.668 72.182 149.852 1.00 0.00 H ATOM 41395 H2 WAT 7929 50.873 73.060 149.595 1.00 0.00 H TER 41397 WAT 7929 ATOM 41397 O WAT 7930 132.138 74.843 101.244 1.00 0.00 O ATOM 41398 H1 WAT 7930 132.703 74.545 101.957 1.00 0.00 H ATOM 41399 H2 WAT 7930 132.723 74.917 100.490 1.00 0.00 H TER 41401 WAT 7930 ATOM 41401 O WAT 7931 131.061 124.748 25.997 1.00 0.00 O ATOM 41402 H1 WAT 7931 131.241 123.812 25.910 1.00 0.00 H ATOM 41403 H2 WAT 7931 130.127 124.832 25.805 1.00 0.00 H TER 41405 WAT 7931 ATOM 41405 O WAT 7932 143.479 55.101 7.575 1.00 0.00 O ATOM 41406 H1 WAT 7932 142.889 54.390 7.824 1.00 0.00 H ATOM 41407 H2 WAT 7932 144.227 54.661 7.172 1.00 0.00 H TER 41409 WAT 7932 ATOM 41409 O WAT 7933 73.993 73.825 74.008 1.00 0.00 O ATOM 41410 H1 WAT 7933 74.826 74.208 74.284 1.00 0.00 H ATOM 41411 H2 WAT 7933 73.992 73.915 73.055 1.00 0.00 H TER 41413 WAT 7933 ATOM 41413 O WAT 7934 116.894 89.603 92.285 1.00 0.00 O ATOM 41414 H1 WAT 7934 116.047 89.698 91.848 1.00 0.00 H ATOM 41415 H2 WAT 7934 117.504 90.092 91.733 1.00 0.00 H TER 41417 WAT 7934 ATOM 41417 O WAT 7935 84.856 57.816 132.161 1.00 0.00 O ATOM 41418 H1 WAT 7935 84.034 58.030 132.604 1.00 0.00 H ATOM 41419 H2 WAT 7935 84.842 58.344 131.363 1.00 0.00 H TER 41421 WAT 7935 ATOM 41421 O WAT 7936 115.946 89.832 82.758 1.00 0.00 O ATOM 41422 H1 WAT 7936 116.265 90.297 83.532 1.00 0.00 H ATOM 41423 H2 WAT 7936 115.322 89.194 83.103 1.00 0.00 H TER 41425 WAT 7936 ATOM 41425 O WAT 7937 72.529 98.634 86.517 1.00 0.00 O ATOM 41426 H1 WAT 7937 72.438 99.304 85.839 1.00 0.00 H ATOM 41427 H2 WAT 7937 72.125 97.853 86.137 1.00 0.00 H TER 41429 WAT 7937 ATOM 41429 O WAT 7938 41.484 81.264 88.760 1.00 0.00 O ATOM 41430 H1 WAT 7938 40.716 81.403 88.207 1.00 0.00 H ATOM 41431 H2 WAT 7938 41.418 80.350 89.037 1.00 0.00 H TER 41433 WAT 7938 ATOM 41433 O WAT 7939 47.410 73.018 140.518 1.00 0.00 O ATOM 41434 H1 WAT 7939 47.471 72.081 140.704 1.00 0.00 H ATOM 41435 H2 WAT 7939 47.598 73.442 141.355 1.00 0.00 H TER 41437 WAT 7939 ATOM 41437 O WAT 7940 11.389 35.381 89.657 1.00 0.00 O ATOM 41438 H1 WAT 7940 11.608 34.978 88.816 1.00 0.00 H ATOM 41439 H2 WAT 7940 12.007 34.992 90.276 1.00 0.00 H TER 41441 WAT 7940 ATOM 41441 O WAT 7941 8.765 59.351 131.429 1.00 0.00 O ATOM 41442 H1 WAT 7941 7.809 59.307 131.457 1.00 0.00 H ATOM 41443 H2 WAT 7941 8.959 59.832 130.624 1.00 0.00 H TER 41445 WAT 7941 ATOM 41445 O WAT 7942 7.272 92.001 155.307 1.00 0.00 O ATOM 41446 H1 WAT 7942 6.671 92.042 154.562 1.00 0.00 H ATOM 41447 H2 WAT 7942 7.755 92.826 155.270 1.00 0.00 H TER 41449 WAT 7942 ATOM 41449 O WAT 7943 95.784 142.004 112.402 1.00 0.00 O ATOM 41450 H1 WAT 7943 95.171 141.821 113.115 1.00 0.00 H ATOM 41451 H2 WAT 7943 95.301 142.586 111.815 1.00 0.00 H TER 41453 WAT 7943 ATOM 41453 O WAT 7944 114.845 70.637 139.602 1.00 0.00 O ATOM 41454 H1 WAT 7944 115.353 70.092 139.001 1.00 0.00 H ATOM 41455 H2 WAT 7944 114.284 70.020 140.071 1.00 0.00 H TER 41457 WAT 7944 ATOM 41457 O WAT 7945 38.561 100.847 154.318 1.00 0.00 O ATOM 41458 H1 WAT 7945 39.128 101.617 154.327 1.00 0.00 H ATOM 41459 H2 WAT 7945 38.723 100.439 153.468 1.00 0.00 H TER 41461 WAT 7945 ATOM 41461 O WAT 7946 118.795 122.287 68.282 1.00 0.00 O ATOM 41462 H1 WAT 7946 119.669 122.563 68.560 1.00 0.00 H ATOM 41463 H2 WAT 7946 118.219 122.998 68.563 1.00 0.00 H TER 41465 WAT 7946 ATOM 41465 O WAT 7947 54.375 92.177 151.993 1.00 0.00 O ATOM 41466 H1 WAT 7947 54.056 92.883 151.431 1.00 0.00 H ATOM 41467 H2 WAT 7947 53.586 91.699 152.248 1.00 0.00 H TER 41469 WAT 7947 ATOM 41469 O WAT 7948 65.176 139.507 93.480 1.00 0.00 O ATOM 41470 H1 WAT 7948 65.818 140.055 93.028 1.00 0.00 H ATOM 41471 H2 WAT 7948 64.344 139.713 93.055 1.00 0.00 H TER 41473 WAT 7948 ATOM 41473 O WAT 7949 21.741 75.943 146.505 1.00 0.00 O ATOM 41474 H1 WAT 7949 21.556 76.845 146.769 1.00 0.00 H ATOM 41475 H2 WAT 7949 22.667 75.818 146.713 1.00 0.00 H TER 41477 WAT 7949 ATOM 41477 O WAT 7950 32.414 90.466 65.903 1.00 0.00 O ATOM 41478 H1 WAT 7950 32.091 89.573 66.025 1.00 0.00 H ATOM 41479 H2 WAT 7950 31.766 90.880 65.334 1.00 0.00 H TER 41481 WAT 7950 ATOM 41481 O WAT 7951 99.265 144.198 122.866 1.00 0.00 O ATOM 41482 H1 WAT 7951 99.662 143.360 123.104 1.00 0.00 H ATOM 41483 H2 WAT 7951 98.755 144.007 122.079 1.00 0.00 H TER 41485 WAT 7951 ATOM 41485 O WAT 7952 51.347 62.550 127.125 1.00 0.00 O ATOM 41486 H1 WAT 7952 51.788 63.350 127.410 1.00 0.00 H ATOM 41487 H2 WAT 7952 50.617 62.856 126.587 1.00 0.00 H TER 41489 WAT 7952 ATOM 41489 O WAT 7953 26.421 143.561 20.029 1.00 0.00 O ATOM 41490 H1 WAT 7953 26.922 143.884 20.778 1.00 0.00 H ATOM 41491 H2 WAT 7953 25.679 143.099 20.419 1.00 0.00 H TER 41493 WAT 7953 ATOM 41493 O WAT 7954 105.867 55.472 16.429 1.00 0.00 O ATOM 41494 H1 WAT 7954 105.841 55.396 17.383 1.00 0.00 H ATOM 41495 H2 WAT 7954 105.775 56.409 16.260 1.00 0.00 H TER 41497 WAT 7954 ATOM 41497 O WAT 7955 83.569 55.688 93.396 1.00 0.00 O ATOM 41498 H1 WAT 7955 83.949 55.140 94.083 1.00 0.00 H ATOM 41499 H2 WAT 7955 83.226 56.451 93.861 1.00 0.00 H TER 41501 WAT 7955 ATOM 41501 O WAT 7956 91.943 62.534 145.441 1.00 0.00 O ATOM 41502 H1 WAT 7956 92.398 61.808 145.869 1.00 0.00 H ATOM 41503 H2 WAT 7956 92.561 62.848 144.781 1.00 0.00 H TER 41505 WAT 7956 ATOM 41505 O WAT 7957 62.506 92.744 140.317 1.00 0.00 O ATOM 41506 H1 WAT 7957 61.556 92.866 140.297 1.00 0.00 H ATOM 41507 H2 WAT 7957 62.626 91.843 140.616 1.00 0.00 H TER 41509 WAT 7957 ATOM 41509 O WAT 7958 98.184 84.720 122.063 1.00 0.00 O ATOM 41510 H1 WAT 7958 97.855 84.203 122.798 1.00 0.00 H ATOM 41511 H2 WAT 7958 97.685 85.536 122.101 1.00 0.00 H TER 41513 WAT 7958 ATOM 41513 O WAT 7959 139.875 13.972 120.838 1.00 0.00 O ATOM 41514 H1 WAT 7959 140.461 13.837 120.094 1.00 0.00 H ATOM 41515 H2 WAT 7959 139.407 14.781 120.631 1.00 0.00 H TER 41517 WAT 7959 ATOM 41517 O WAT 7960 87.039 15.086 130.608 1.00 0.00 O ATOM 41518 H1 WAT 7960 86.390 15.515 130.051 1.00 0.00 H ATOM 41519 H2 WAT 7960 86.611 15.012 131.461 1.00 0.00 H TER 41521 WAT 7960 ATOM 41521 O WAT 7961 39.425 105.192 94.818 1.00 0.00 O ATOM 41522 H1 WAT 7961 40.359 105.115 95.011 1.00 0.00 H ATOM 41523 H2 WAT 7961 39.192 106.074 95.110 1.00 0.00 H TER 41525 WAT 7961 ATOM 41525 O WAT 7962 50.501 3.845 108.355 1.00 0.00 O ATOM 41526 H1 WAT 7962 49.585 3.683 108.129 1.00 0.00 H ATOM 41527 H2 WAT 7962 50.890 2.973 108.419 1.00 0.00 H TER 41529 WAT 7962 ATOM 41529 O WAT 7963 100.096 31.243 94.019 1.00 0.00 O ATOM 41530 H1 WAT 7963 101.010 31.317 93.744 1.00 0.00 H ATOM 41531 H2 WAT 7963 99.605 31.180 93.200 1.00 0.00 H TER 41533 WAT 7963 ATOM 41533 O WAT 7964 118.222 103.415 18.865 1.00 0.00 O ATOM 41534 H1 WAT 7964 118.528 102.682 19.398 1.00 0.00 H ATOM 41535 H2 WAT 7964 118.663 104.181 19.234 1.00 0.00 H TER 41537 WAT 7964 ATOM 41537 O WAT 7965 76.663 61.056 129.453 1.00 0.00 O ATOM 41538 H1 WAT 7965 77.009 61.907 129.186 1.00 0.00 H ATOM 41539 H2 WAT 7965 75.915 60.908 128.875 1.00 0.00 H TER 41541 WAT 7965 ATOM 41541 O WAT 7966 114.368 87.321 120.842 1.00 0.00 O ATOM 41542 H1 WAT 7966 114.391 87.700 119.964 1.00 0.00 H ATOM 41543 H2 WAT 7966 113.710 87.837 121.308 1.00 0.00 H TER 41545 WAT 7966 ATOM 41545 O WAT 7967 74.910 99.650 73.058 1.00 0.00 O ATOM 41546 H1 WAT 7967 74.754 99.259 72.199 1.00 0.00 H ATOM 41547 H2 WAT 7967 74.502 99.043 73.675 1.00 0.00 H TER 41549 WAT 7967 ATOM 41549 O WAT 7968 56.011 6.571 65.764 1.00 0.00 O ATOM 41550 H1 WAT 7968 55.984 7.498 66.003 1.00 0.00 H ATOM 41551 H2 WAT 7968 55.113 6.265 65.893 1.00 0.00 H TER 41553 WAT 7968 ATOM 41553 O WAT 7969 9.601 7.507 67.333 1.00 0.00 O ATOM 41554 H1 WAT 7969 10.002 8.370 67.225 1.00 0.00 H ATOM 41555 H2 WAT 7969 9.301 7.271 66.455 1.00 0.00 H TER 41557 WAT 7969 ATOM 41557 O WAT 7970 139.614 114.120 82.636 1.00 0.00 O ATOM 41558 H1 WAT 7970 139.666 113.768 81.747 1.00 0.00 H ATOM 41559 H2 WAT 7970 138.837 114.678 82.628 1.00 0.00 H TER 41561 WAT 7970 ATOM 41561 O WAT 7971 85.986 106.178 101.439 1.00 0.00 O ATOM 41562 H1 WAT 7971 86.530 106.611 102.097 1.00 0.00 H ATOM 41563 H2 WAT 7971 85.088 106.346 101.724 1.00 0.00 H TER 41565 WAT 7971 ATOM 41565 O WAT 7972 22.900 55.920 69.520 1.00 0.00 O ATOM 41566 H1 WAT 7972 22.627 55.138 69.041 1.00 0.00 H ATOM 41567 H2 WAT 7972 23.162 56.539 68.838 1.00 0.00 H TER 41569 WAT 7972 ATOM 41569 O WAT 7973 79.252 17.123 98.303 1.00 0.00 O ATOM 41570 H1 WAT 7973 79.747 16.674 97.618 1.00 0.00 H ATOM 41571 H2 WAT 7973 79.856 17.785 98.639 1.00 0.00 H TER 41573 WAT 7973 ATOM 41573 O WAT 7974 81.550 144.380 144.050 1.00 0.00 O ATOM 41574 H1 WAT 7974 81.203 143.678 143.499 1.00 0.00 H ATOM 41575 H2 WAT 7974 81.047 144.318 144.862 1.00 0.00 H TER 41577 WAT 7974 ATOM 41577 O WAT 7975 54.801 106.327 145.246 1.00 0.00 O ATOM 41578 H1 WAT 7975 55.141 105.743 145.923 1.00 0.00 H ATOM 41579 H2 WAT 7975 54.121 105.815 144.807 1.00 0.00 H TER 41581 WAT 7975 ATOM 41581 O WAT 7976 125.043 46.408 62.519 1.00 0.00 O ATOM 41582 H1 WAT 7976 125.940 46.590 62.238 1.00 0.00 H ATOM 41583 H2 WAT 7976 124.498 46.732 61.803 1.00 0.00 H TER 41585 WAT 7976 ATOM 41585 O WAT 7977 8.325 5.073 18.603 1.00 0.00 O ATOM 41586 H1 WAT 7977 8.464 5.569 19.409 1.00 0.00 H ATOM 41587 H2 WAT 7977 7.471 5.366 18.285 1.00 0.00 H TER 41589 WAT 7977 ATOM 41589 O WAT 7978 125.184 46.005 146.238 1.00 0.00 O ATOM 41590 H1 WAT 7978 124.331 45.990 146.670 1.00 0.00 H ATOM 41591 H2 WAT 7978 125.666 45.279 146.632 1.00 0.00 H TER 41593 WAT 7978 ATOM 41593 O WAT 7979 43.604 70.929 101.495 1.00 0.00 O ATOM 41594 H1 WAT 7979 43.510 71.830 101.188 1.00 0.00 H ATOM 41595 H2 WAT 7979 44.474 70.664 101.198 1.00 0.00 H TER 41597 WAT 7979 ATOM 41597 O WAT 7980 83.810 100.799 152.771 1.00 0.00 O ATOM 41598 H1 WAT 7980 84.624 101.220 153.048 1.00 0.00 H ATOM 41599 H2 WAT 7980 83.138 101.469 152.900 1.00 0.00 H TER 41601 WAT 7980 ATOM 41601 O WAT 7981 132.585 110.101 148.030 1.00 0.00 O ATOM 41602 H1 WAT 7981 133.304 109.916 147.427 1.00 0.00 H ATOM 41603 H2 WAT 7981 131.976 110.636 147.521 1.00 0.00 H TER 41605 WAT 7981 ATOM 41605 O WAT 7982 135.567 63.974 71.994 1.00 0.00 O ATOM 41606 H1 WAT 7982 136.453 63.674 71.790 1.00 0.00 H ATOM 41607 H2 WAT 7982 135.342 63.520 72.806 1.00 0.00 H TER 41609 WAT 7982 ATOM 41609 O WAT 7983 64.436 27.856 108.529 1.00 0.00 O ATOM 41610 H1 WAT 7983 63.989 28.183 107.749 1.00 0.00 H ATOM 41611 H2 WAT 7983 63.825 27.224 108.908 1.00 0.00 H TER 41613 WAT 7983 ATOM 41613 O WAT 7984 29.928 4.156 99.845 1.00 0.00 O ATOM 41614 H1 WAT 7984 30.444 3.520 99.349 1.00 0.00 H ATOM 41615 H2 WAT 7984 29.091 4.199 99.381 1.00 0.00 H TER 41617 WAT 7984 ATOM 41617 O WAT 7985 57.232 44.081 148.239 1.00 0.00 O ATOM 41618 H1 WAT 7985 57.257 43.912 149.181 1.00 0.00 H ATOM 41619 H2 WAT 7985 57.476 43.247 147.839 1.00 0.00 H TER 41621 WAT 7985 ATOM 41621 O WAT 7986 131.680 26.384 105.388 1.00 0.00 O ATOM 41622 H1 WAT 7986 130.915 26.257 104.827 1.00 0.00 H ATOM 41623 H2 WAT 7986 131.517 25.825 106.147 1.00 0.00 H TER 41625 WAT 7986 ATOM 41625 O WAT 7987 94.235 119.753 84.786 1.00 0.00 O ATOM 41626 H1 WAT 7987 95.087 119.487 85.131 1.00 0.00 H ATOM 41627 H2 WAT 7987 94.013 119.076 84.147 1.00 0.00 H TER 41629 WAT 7987 ATOM 41629 O WAT 7988 74.945 2.378 151.880 1.00 0.00 O ATOM 41630 H1 WAT 7988 74.352 3.065 152.185 1.00 0.00 H ATOM 41631 H2 WAT 7988 75.457 2.143 152.654 1.00 0.00 H TER 41633 WAT 7988 ATOM 41633 O WAT 7989 138.568 11.261 5.845 1.00 0.00 O ATOM 41634 H1 WAT 7989 139.377 10.790 6.044 1.00 0.00 H ATOM 41635 H2 WAT 7989 138.169 11.424 6.700 1.00 0.00 H TER 41637 WAT 7989 ATOM 41637 O WAT 7990 45.579 133.430 76.632 1.00 0.00 O ATOM 41638 H1 WAT 7990 45.545 133.818 77.506 1.00 0.00 H ATOM 41639 H2 WAT 7990 45.941 132.555 76.772 1.00 0.00 H TER 41641 WAT 7990 ATOM 41641 O WAT 7991 105.868 139.323 129.402 1.00 0.00 O ATOM 41642 H1 WAT 7991 105.811 138.584 130.007 1.00 0.00 H ATOM 41643 H2 WAT 7991 106.805 139.504 129.332 1.00 0.00 H TER 41645 WAT 7991 ATOM 41645 O WAT 7992 71.053 27.898 129.764 1.00 0.00 O ATOM 41646 H1 WAT 7992 70.191 28.312 129.718 1.00 0.00 H ATOM 41647 H2 WAT 7992 71.136 27.428 128.934 1.00 0.00 H TER 41649 WAT 7992 ATOM 41649 O WAT 7993 80.781 50.016 144.859 1.00 0.00 O ATOM 41650 H1 WAT 7993 80.962 50.816 145.353 1.00 0.00 H ATOM 41651 H2 WAT 7993 81.218 49.324 145.355 1.00 0.00 H TER 41653 WAT 7993 ATOM 41653 O WAT 7994 65.576 43.952 72.028 1.00 0.00 O ATOM 41654 H1 WAT 7994 66.276 43.849 71.383 1.00 0.00 H ATOM 41655 H2 WAT 7994 65.204 43.075 72.119 1.00 0.00 H TER 41657 WAT 7994 ATOM 41657 O WAT 7995 127.200 76.664 111.513 1.00 0.00 O ATOM 41658 H1 WAT 7995 126.250 76.602 111.610 1.00 0.00 H ATOM 41659 H2 WAT 7995 127.366 77.597 111.375 1.00 0.00 H TER 41661 WAT 7995 ATOM 41661 O WAT 7996 28.100 33.782 119.389 1.00 0.00 O ATOM 41662 H1 WAT 7996 27.966 34.570 118.862 1.00 0.00 H ATOM 41663 H2 WAT 7996 27.855 33.061 118.807 1.00 0.00 H TER 41665 WAT 7996 ATOM 41665 O WAT 7997 10.550 52.362 56.608 1.00 0.00 O ATOM 41666 H1 WAT 7997 10.388 53.113 57.179 1.00 0.00 H ATOM 41667 H2 WAT 7997 11.481 52.421 56.394 1.00 0.00 H TER 41669 WAT 7997 ATOM 41669 O WAT 7998 51.360 43.472 68.906 1.00 0.00 O ATOM 41670 H1 WAT 7998 50.704 44.149 69.070 1.00 0.00 H ATOM 41671 H2 WAT 7998 50.997 42.683 69.309 1.00 0.00 H TER 41673 WAT 7998 ATOM 41673 O WAT 7999 131.464 145.276 112.818 1.00 0.00 O ATOM 41674 H1 WAT 7999 130.968 145.136 113.625 1.00 0.00 H ATOM 41675 H2 WAT 7999 131.648 144.394 112.494 1.00 0.00 H TER 41677 WAT 7999 ATOM 41677 O WAT 8000 138.951 41.985 69.346 1.00 0.00 O ATOM 41678 H1 WAT 8000 139.483 41.602 70.044 1.00 0.00 H ATOM 41679 H2 WAT 8000 139.571 42.489 68.820 1.00 0.00 H TER 41681 WAT 8000 ATOM 41681 O WAT 8001 106.394 124.253 81.328 1.00 0.00 O ATOM 41682 H1 WAT 8001 107.099 123.892 80.791 1.00 0.00 H ATOM 41683 H2 WAT 8001 105.842 123.499 81.536 1.00 0.00 H TER 41685 WAT 8001 ATOM 41685 O WAT 8002 136.573 102.789 120.496 1.00 0.00 O ATOM 41686 H1 WAT 8002 136.836 101.872 120.575 1.00 0.00 H ATOM 41687 H2 WAT 8002 136.207 103.007 121.353 1.00 0.00 H TER 41689 WAT 8002 ATOM 41689 O WAT 8003 73.174 106.839 147.744 1.00 0.00 O ATOM 41690 H1 WAT 8003 72.855 105.940 147.818 1.00 0.00 H ATOM 41691 H2 WAT 8003 74.001 106.762 147.267 1.00 0.00 H TER 41693 WAT 8003 ATOM 41693 O WAT 8004 35.852 123.354 97.382 1.00 0.00 O ATOM 41694 H1 WAT 8004 35.143 122.824 97.748 1.00 0.00 H ATOM 41695 H2 WAT 8004 35.826 123.173 96.443 1.00 0.00 H TER 41697 WAT 8004 ATOM 41697 O WAT 8005 102.894 130.190 114.555 1.00 0.00 O ATOM 41698 H1 WAT 8005 103.087 131.104 114.343 1.00 0.00 H ATOM 41699 H2 WAT 8005 103.512 129.686 114.027 1.00 0.00 H TER 41701 WAT 8005 ATOM 41701 O WAT 8006 140.865 73.514 135.628 1.00 0.00 O ATOM 41702 H1 WAT 8006 140.120 73.076 135.216 1.00 0.00 H ATOM 41703 H2 WAT 8006 140.605 74.434 135.676 1.00 0.00 H TER 41705 WAT 8006 ATOM 41705 O WAT 8007 69.007 28.457 96.268 1.00 0.00 O ATOM 41706 H1 WAT 8007 68.083 28.580 96.049 1.00 0.00 H ATOM 41707 H2 WAT 8007 69.086 28.788 97.163 1.00 0.00 H TER 41709 WAT 8007 ATOM 41709 O WAT 8008 21.991 102.023 95.670 1.00 0.00 O ATOM 41710 H1 WAT 8008 22.232 102.885 95.330 1.00 0.00 H ATOM 41711 H2 WAT 8008 22.825 101.619 95.910 1.00 0.00 H TER 41713 WAT 8008 ATOM 41713 O WAT 8009 121.932 14.715 139.380 1.00 0.00 O ATOM 41714 H1 WAT 8009 122.547 15.355 139.740 1.00 0.00 H ATOM 41715 H2 WAT 8009 122.314 14.463 138.539 1.00 0.00 H TER 41717 WAT 8009 ATOM 41717 O WAT 8010 62.418 96.284 140.144 1.00 0.00 O ATOM 41718 H1 WAT 8010 61.760 95.657 139.843 1.00 0.00 H ATOM 41719 H2 WAT 8010 62.333 97.026 139.546 1.00 0.00 H TER 41721 WAT 8010 ATOM 41721 O WAT 8011 144.833 102.974 12.815 1.00 0.00 O ATOM 41722 H1 WAT 8011 144.470 102.753 11.957 1.00 0.00 H ATOM 41723 H2 WAT 8011 144.253 103.657 13.152 1.00 0.00 H TER 41725 WAT 8011 ATOM 41725 O WAT 8012 32.579 9.111 104.583 1.00 0.00 O ATOM 41726 H1 WAT 8012 31.901 8.667 104.073 1.00 0.00 H ATOM 41727 H2 WAT 8012 32.977 8.417 105.108 1.00 0.00 H TER 41729 WAT 8012 ATOM 41729 O WAT 8013 12.890 45.632 146.411 1.00 0.00 O ATOM 41730 H1 WAT 8013 12.529 46.374 146.896 1.00 0.00 H ATOM 41731 H2 WAT 8013 13.536 45.250 147.005 1.00 0.00 H TER 41733 WAT 8013 ATOM 41733 O WAT 8014 20.552 6.900 151.563 1.00 0.00 O ATOM 41734 H1 WAT 8014 21.191 7.421 152.050 1.00 0.00 H ATOM 41735 H2 WAT 8014 20.261 7.477 150.858 1.00 0.00 H TER 41737 WAT 8014 ATOM 41737 O WAT 8015 83.837 3.405 81.033 1.00 0.00 O ATOM 41738 H1 WAT 8015 83.731 4.190 81.572 1.00 0.00 H ATOM 41739 H2 WAT 8015 83.978 2.699 81.664 1.00 0.00 H TER 41741 WAT 8015 ATOM 41741 O WAT 8016 129.614 65.109 154.664 1.00 0.00 O ATOM 41742 H1 WAT 8016 130.525 64.910 154.881 1.00 0.00 H ATOM 41743 H2 WAT 8016 129.255 64.278 154.352 1.00 0.00 H TER 41745 WAT 8016 ATOM 41745 O WAT 8017 123.272 110.588 89.262 1.00 0.00 O ATOM 41746 H1 WAT 8017 122.656 110.129 88.691 1.00 0.00 H ATOM 41747 H2 WAT 8017 122.762 110.797 90.045 1.00 0.00 H TER 41749 WAT 8017 ATOM 41749 O WAT 8018 87.552 74.116 99.949 1.00 0.00 O ATOM 41750 H1 WAT 8018 88.283 73.535 100.162 1.00 0.00 H ATOM 41751 H2 WAT 8018 87.207 74.387 100.799 1.00 0.00 H TER 41753 WAT 8018 ATOM 41753 O WAT 8019 50.599 7.037 99.826 1.00 0.00 O ATOM 41754 H1 WAT 8019 50.192 7.879 100.032 1.00 0.00 H ATOM 41755 H2 WAT 8019 51.170 6.859 100.573 1.00 0.00 H TER 41757 WAT 8019 ATOM 41757 O WAT 8020 111.547 48.482 78.499 1.00 0.00 O ATOM 41758 H1 WAT 8020 111.329 47.593 78.778 1.00 0.00 H ATOM 41759 H2 WAT 8020 112.401 48.655 78.897 1.00 0.00 H TER 41761 WAT 8020 ATOM 41761 O WAT 8021 143.952 85.684 151.150 1.00 0.00 O ATOM 41762 H1 WAT 8021 143.583 85.468 152.006 1.00 0.00 H ATOM 41763 H2 WAT 8021 144.588 84.989 150.981 1.00 0.00 H TER 41765 WAT 8021 ATOM 41765 O WAT 8022 56.344 79.208 22.564 1.00 0.00 O ATOM 41766 H1 WAT 8022 56.300 78.252 22.545 1.00 0.00 H ATOM 41767 H2 WAT 8022 55.435 79.492 22.469 1.00 0.00 H TER 41769 WAT 8022 ATOM 41769 O WAT 8023 102.590 113.093 71.571 1.00 0.00 O ATOM 41770 H1 WAT 8023 102.882 113.631 70.835 1.00 0.00 H ATOM 41771 H2 WAT 8023 101.753 112.729 71.283 1.00 0.00 H TER 41773 WAT 8023 ATOM 41773 O WAT 8024 102.620 26.341 147.039 1.00 0.00 O ATOM 41774 H1 WAT 8024 103.332 26.631 147.611 1.00 0.00 H ATOM 41775 H2 WAT 8024 102.912 26.573 146.158 1.00 0.00 H TER 41777 WAT 8024 ATOM 41777 O WAT 8025 106.276 39.309 62.427 1.00 0.00 O ATOM 41778 H1 WAT 8025 106.262 40.174 62.018 1.00 0.00 H ATOM 41779 H2 WAT 8025 106.091 38.702 61.710 1.00 0.00 H TER 41781 WAT 8025 ATOM 41781 O WAT 8026 142.774 116.589 133.247 1.00 0.00 O ATOM 41782 H1 WAT 8026 143.160 117.307 132.745 1.00 0.00 H ATOM 41783 H2 WAT 8026 141.831 116.684 133.116 1.00 0.00 H TER 41785 WAT 8026 ATOM 41785 O WAT 8027 137.857 91.683 120.075 1.00 0.00 O ATOM 41786 H1 WAT 8027 137.712 90.930 120.648 1.00 0.00 H ATOM 41787 H2 WAT 8027 138.381 91.337 119.353 1.00 0.00 H TER 41789 WAT 8027 ATOM 41789 O WAT 8028 61.193 29.110 113.463 1.00 0.00 O ATOM 41790 H1 WAT 8028 61.545 29.945 113.772 1.00 0.00 H ATOM 41791 H2 WAT 8028 61.654 28.945 112.641 1.00 0.00 H TER 41793 WAT 8028 ATOM 41793 O WAT 8029 65.389 35.207 143.424 1.00 0.00 O ATOM 41794 H1 WAT 8029 65.670 34.860 144.271 1.00 0.00 H ATOM 41795 H2 WAT 8029 65.085 36.094 143.617 1.00 0.00 H TER 41797 WAT 8029 ATOM 41797 O WAT 8030 32.027 142.727 90.993 1.00 0.00 O ATOM 41798 H1 WAT 8030 32.438 141.863 91.015 1.00 0.00 H ATOM 41799 H2 WAT 8030 32.258 143.124 91.833 1.00 0.00 H TER 41801 WAT 8030 ATOM 41801 O WAT 8031 49.414 36.638 153.543 1.00 0.00 O ATOM 41802 H1 WAT 8031 49.657 37.116 154.336 1.00 0.00 H ATOM 41803 H2 WAT 8031 49.551 35.718 153.766 1.00 0.00 H TER 41805 WAT 8031 ATOM 41805 O WAT 8032 68.443 58.833 2.345 1.00 0.00 O ATOM 41806 H1 WAT 8032 67.607 59.237 2.112 1.00 0.00 H ATOM 41807 H2 WAT 8032 68.871 58.665 1.506 1.00 0.00 H TER 41809 WAT 8032 ATOM 41809 O WAT 8033 108.428 56.591 155.931 1.00 0.00 O ATOM 41810 H1 WAT 8033 109.017 57.050 156.530 1.00 0.00 H ATOM 41811 H2 WAT 8033 108.374 55.702 156.282 1.00 0.00 H TER 41813 WAT 8033 ATOM 41813 O WAT 8034 10.511 79.374 140.580 1.00 0.00 O ATOM 41814 H1 WAT 8034 10.194 79.729 139.750 1.00 0.00 H ATOM 41815 H2 WAT 8034 10.069 79.898 141.249 1.00 0.00 H TER 41817 WAT 8034 ATOM 41817 O WAT 8035 115.529 45.907 94.211 1.00 0.00 O ATOM 41818 H1 WAT 8035 114.907 45.739 93.503 1.00 0.00 H ATOM 41819 H2 WAT 8035 115.609 46.861 94.238 1.00 0.00 H TER 41821 WAT 8035 ATOM 41821 O WAT 8036 30.872 24.833 29.231 1.00 0.00 O ATOM 41822 H1 WAT 8036 30.358 24.057 29.010 1.00 0.00 H ATOM 41823 H2 WAT 8036 30.981 24.786 30.181 1.00 0.00 H TER 41825 WAT 8036 ATOM 41825 O WAT 8037 89.782 104.331 115.544 1.00 0.00 O ATOM 41826 H1 WAT 8037 89.863 105.248 115.806 1.00 0.00 H ATOM 41827 H2 WAT 8037 88.846 104.209 115.386 1.00 0.00 H TER 41829 WAT 8037 ATOM 41829 O WAT 8038 17.805 31.460 28.771 1.00 0.00 O ATOM 41830 H1 WAT 8038 17.617 30.522 28.736 1.00 0.00 H ATOM 41831 H2 WAT 8038 17.516 31.729 29.643 1.00 0.00 H TER 41833 WAT 8038 ATOM 41833 O WAT 8039 42.454 12.427 144.922 1.00 0.00 O ATOM 41834 H1 WAT 8039 41.524 12.389 144.700 1.00 0.00 H ATOM 41835 H2 WAT 8039 42.522 11.953 145.751 1.00 0.00 H TER 41837 WAT 8039 ATOM 41837 O WAT 8040 36.786 5.198 88.597 1.00 0.00 O ATOM 41838 H1 WAT 8040 36.401 5.159 89.473 1.00 0.00 H ATOM 41839 H2 WAT 8040 36.379 5.963 88.191 1.00 0.00 H TER 41841 WAT 8040 ATOM 41841 O WAT 8041 84.167 128.737 149.468 1.00 0.00 O ATOM 41842 H1 WAT 8041 85.113 128.860 149.389 1.00 0.00 H ATOM 41843 H2 WAT 8041 84.072 127.994 150.064 1.00 0.00 H TER 41845 WAT 8041 ATOM 41845 O WAT 8042 58.629 73.006 3.385 1.00 0.00 O ATOM 41846 H1 WAT 8042 58.497 73.538 2.601 1.00 0.00 H ATOM 41847 H2 WAT 8042 57.762 72.649 3.581 1.00 0.00 H TER 41849 WAT 8042 ATOM 41849 O WAT 8043 98.628 126.838 5.454 1.00 0.00 O ATOM 41850 H1 WAT 8043 99.111 127.246 4.735 1.00 0.00 H ATOM 41851 H2 WAT 8043 99.298 126.382 5.964 1.00 0.00 H TER 41853 WAT 8043 ATOM 41853 O WAT 8044 46.671 108.599 74.481 1.00 0.00 O ATOM 41854 H1 WAT 8044 47.028 107.764 74.177 1.00 0.00 H ATOM 41855 H2 WAT 8044 47.441 109.142 74.649 1.00 0.00 H TER 41857 WAT 8044 ATOM 41857 O WAT 8045 48.691 119.335 141.841 1.00 0.00 O ATOM 41858 H1 WAT 8045 48.177 119.843 142.469 1.00 0.00 H ATOM 41859 H2 WAT 8045 48.199 118.521 141.733 1.00 0.00 H TER 41861 WAT 8045 ATOM 41861 O WAT 8046 25.770 102.555 150.241 1.00 0.00 O ATOM 41862 H1 WAT 8046 25.531 102.772 149.340 1.00 0.00 H ATOM 41863 H2 WAT 8046 26.587 102.063 150.161 1.00 0.00 H TER 41865 WAT 8046 ATOM 41865 O WAT 8047 11.436 20.398 102.295 1.00 0.00 O ATOM 41866 H1 WAT 8047 11.662 20.296 103.219 1.00 0.00 H ATOM 41867 H2 WAT 8047 12.223 20.769 101.895 1.00 0.00 H TER 41869 WAT 8047 ATOM 41869 O WAT 8048 36.855 96.866 79.638 1.00 0.00 O ATOM 41870 H1 WAT 8048 37.027 97.510 80.325 1.00 0.00 H ATOM 41871 H2 WAT 8048 36.468 97.373 78.925 1.00 0.00 H TER 41873 WAT 8048 ATOM 41873 O WAT 8049 11.539 113.421 129.433 1.00 0.00 O ATOM 41874 H1 WAT 8049 11.202 112.570 129.151 1.00 0.00 H ATOM 41875 H2 WAT 8049 10.799 114.018 129.329 1.00 0.00 H TER 41877 WAT 8049 ATOM 41877 O WAT 8050 16.797 13.216 96.970 1.00 0.00 O ATOM 41878 H1 WAT 8050 16.004 13.042 96.463 1.00 0.00 H ATOM 41879 H2 WAT 8050 17.017 14.125 96.766 1.00 0.00 H TER 41881 WAT 8050 ATOM 41881 O WAT 8051 32.215 26.517 97.267 1.00 0.00 O ATOM 41882 H1 WAT 8051 32.991 27.034 97.482 1.00 0.00 H ATOM 41883 H2 WAT 8051 32.496 25.608 97.370 1.00 0.00 H TER 41885 WAT 8051 ATOM 41885 O WAT 8052 133.969 102.824 124.549 1.00 0.00 O ATOM 41886 H1 WAT 8052 133.065 102.787 124.235 1.00 0.00 H ATOM 41887 H2 WAT 8052 133.906 103.230 125.413 1.00 0.00 H TER 41889 WAT 8052 ATOM 41889 O WAT 8053 31.743 28.205 149.793 1.00 0.00 O ATOM 41890 H1 WAT 8053 31.635 27.734 150.619 1.00 0.00 H ATOM 41891 H2 WAT 8053 32.670 28.101 149.578 1.00 0.00 H TER 41893 WAT 8053 ATOM 41893 O WAT 8054 53.695 95.320 117.234 1.00 0.00 O ATOM 41894 H1 WAT 8054 53.941 95.677 116.381 1.00 0.00 H ATOM 41895 H2 WAT 8054 54.032 94.424 117.225 1.00 0.00 H TER 41897 WAT 8054 ATOM 41897 O WAT 8055 77.895 108.854 21.691 1.00 0.00 O ATOM 41898 H1 WAT 8055 77.811 109.804 21.608 1.00 0.00 H ATOM 41899 H2 WAT 8055 77.007 108.550 21.876 1.00 0.00 H TER 41901 WAT 8055 ATOM 41901 O WAT 8056 36.643 36.953 127.512 1.00 0.00 O ATOM 41902 H1 WAT 8056 36.270 37.087 126.641 1.00 0.00 H ATOM 41903 H2 WAT 8056 35.886 36.940 128.097 1.00 0.00 H TER 41905 WAT 8056 ATOM 41905 O WAT 8057 144.718 126.993 97.528 1.00 0.00 O ATOM 41906 H1 WAT 8057 144.559 127.906 97.769 1.00 0.00 H ATOM 41907 H2 WAT 8057 144.708 126.994 96.571 1.00 0.00 H TER 41909 WAT 8057 ATOM 41909 O WAT 8058 19.938 126.420 103.567 1.00 0.00 O ATOM 41910 H1 WAT 8058 20.871 126.216 103.629 1.00 0.00 H ATOM 41911 H2 WAT 8058 19.671 126.060 102.721 1.00 0.00 H TER 41913 WAT 8058 ATOM 41913 O WAT 8059 88.671 11.407 59.744 1.00 0.00 O ATOM 41914 H1 WAT 8059 88.797 11.981 60.500 1.00 0.00 H ATOM 41915 H2 WAT 8059 87.946 11.803 59.261 1.00 0.00 H TER 41917 WAT 8059 ATOM 41917 O WAT 8060 75.149 101.285 102.213 1.00 0.00 O ATOM 41918 H1 WAT 8060 75.002 100.344 102.307 1.00 0.00 H ATOM 41919 H2 WAT 8060 75.631 101.532 103.002 1.00 0.00 H TER 41921 WAT 8060 ATOM 41921 O WAT 8061 31.631 137.397 90.299 1.00 0.00 O ATOM 41922 H1 WAT 8061 32.048 136.879 89.611 1.00 0.00 H ATOM 41923 H2 WAT 8061 30.748 137.035 90.370 1.00 0.00 H TER 41925 WAT 8061 ATOM 41925 O WAT 8062 120.342 12.342 12.756 1.00 0.00 O ATOM 41926 H1 WAT 8062 121.156 11.870 12.577 1.00 0.00 H ATOM 41927 H2 WAT 8062 120.524 13.242 12.489 1.00 0.00 H TER 41929 WAT 8062 ATOM 41929 O WAT 8063 138.177 137.398 89.496 1.00 0.00 O ATOM 41930 H1 WAT 8063 138.679 136.999 88.785 1.00 0.00 H ATOM 41931 H2 WAT 8063 137.871 138.231 89.135 1.00 0.00 H TER 41933 WAT 8063 ATOM 41933 O WAT 8064 83.144 43.381 73.487 1.00 0.00 O ATOM 41934 H1 WAT 8064 84.080 43.573 73.422 1.00 0.00 H ATOM 41935 H2 WAT 8064 82.979 43.309 74.427 1.00 0.00 H TER 41937 WAT 8064 ATOM 41937 O WAT 8065 33.246 88.630 10.793 1.00 0.00 O ATOM 41938 H1 WAT 8065 33.475 88.388 11.690 1.00 0.00 H ATOM 41939 H2 WAT 8065 32.438 88.150 10.614 1.00 0.00 H TER 41941 WAT 8065 ATOM 41941 O WAT 8066 81.478 4.846 152.577 1.00 0.00 O ATOM 41942 H1 WAT 8066 81.868 4.616 153.420 1.00 0.00 H ATOM 41943 H2 WAT 8066 81.258 4.004 152.177 1.00 0.00 H TER 41945 WAT 8066 ATOM 41945 O WAT 8067 88.644 91.241 77.389 1.00 0.00 O ATOM 41946 H1 WAT 8067 88.725 90.371 76.998 1.00 0.00 H ATOM 41947 H2 WAT 8067 89.370 91.293 78.011 1.00 0.00 H TER 41949 WAT 8067 ATOM 41949 O WAT 8068 110.667 66.353 115.005 1.00 0.00 O ATOM 41950 H1 WAT 8068 110.862 65.502 114.613 1.00 0.00 H ATOM 41951 H2 WAT 8068 111.384 66.919 114.717 1.00 0.00 H TER 41953 WAT 8068 ATOM 41953 O WAT 8069 109.011 90.927 62.389 1.00 0.00 O ATOM 41954 H1 WAT 8069 108.849 90.174 61.821 1.00 0.00 H ATOM 41955 H2 WAT 8069 109.350 90.546 63.200 1.00 0.00 H TER 41957 WAT 8069 ATOM 41957 O WAT 8070 18.021 77.975 94.491 1.00 0.00 O ATOM 41958 H1 WAT 8070 18.687 78.571 94.147 1.00 0.00 H ATOM 41959 H2 WAT 8070 17.535 78.501 95.126 1.00 0.00 H TER 41961 WAT 8070 ATOM 41961 O WAT 8071 117.092 2.872 116.086 1.00 0.00 O ATOM 41962 H1 WAT 8071 117.746 2.717 115.404 1.00 0.00 H ATOM 41963 H2 WAT 8071 117.060 3.824 116.176 1.00 0.00 H TER 41965 WAT 8071 ATOM 41965 O WAT 8072 106.671 3.417 129.899 1.00 0.00 O ATOM 41966 H1 WAT 8072 106.193 4.175 130.238 1.00 0.00 H ATOM 41967 H2 WAT 8072 107.292 3.196 130.592 1.00 0.00 H TER 41969 WAT 8072 ATOM 41969 O WAT 8073 44.843 126.835 137.934 1.00 0.00 O ATOM 41970 H1 WAT 8073 43.999 126.748 138.378 1.00 0.00 H ATOM 41971 H2 WAT 8073 45.192 125.944 137.908 1.00 0.00 H TER 41973 WAT 8073 ATOM 41973 O WAT 8074 110.332 140.614 2.947 1.00 0.00 O ATOM 41974 H1 WAT 8074 110.264 141.142 3.742 1.00 0.00 H ATOM 41975 H2 WAT 8074 109.545 140.070 2.952 1.00 0.00 H TER 41977 WAT 8074 ATOM 41977 O WAT 8075 130.541 99.008 123.617 1.00 0.00 O ATOM 41978 H1 WAT 8075 131.276 98.421 123.793 1.00 0.00 H ATOM 41979 H2 WAT 8075 130.947 99.863 123.472 1.00 0.00 H TER 41981 WAT 8075 ATOM 41981 O WAT 8076 18.034 63.688 100.391 1.00 0.00 O ATOM 41982 H1 WAT 8076 18.200 62.769 100.182 1.00 0.00 H ATOM 41983 H2 WAT 8076 18.786 64.156 100.027 1.00 0.00 H TER 41985 WAT 8076 ATOM 41985 O WAT 8077 73.805 138.321 67.985 1.00 0.00 O ATOM 41986 H1 WAT 8077 74.470 138.654 68.588 1.00 0.00 H ATOM 41987 H2 WAT 8077 73.939 138.821 67.180 1.00 0.00 H TER 41989 WAT 8077 ATOM 41989 O WAT 8078 76.336 22.026 55.776 1.00 0.00 O ATOM 41990 H1 WAT 8078 75.702 21.953 55.063 1.00 0.00 H ATOM 41991 H2 WAT 8078 76.853 21.222 55.719 1.00 0.00 H TER 41993 WAT 8078 ATOM 41993 O WAT 8079 17.621 33.067 104.935 1.00 0.00 O ATOM 41994 H1 WAT 8079 18.043 32.811 104.115 1.00 0.00 H ATOM 41995 H2 WAT 8079 17.866 32.381 105.556 1.00 0.00 H TER 41997 WAT 8079 ATOM 41997 O WAT 8080 69.412 122.477 98.338 1.00 0.00 O ATOM 41998 H1 WAT 8080 69.348 123.299 97.852 1.00 0.00 H ATOM 41999 H2 WAT 8080 68.608 122.442 98.856 1.00 0.00 H TER 42001 WAT 8080 ATOM 42001 O WAT 8081 109.734 98.445 18.085 1.00 0.00 O ATOM 42002 H1 WAT 8081 109.983 98.556 19.002 1.00 0.00 H ATOM 42003 H2 WAT 8081 108.936 97.916 18.116 1.00 0.00 H TER 42005 WAT 8081 ATOM 42005 O WAT 8082 60.760 98.141 108.377 1.00 0.00 O ATOM 42006 H1 WAT 8082 61.501 97.629 108.703 1.00 0.00 H ATOM 42007 H2 WAT 8082 60.289 97.541 107.800 1.00 0.00 H TER 42009 WAT 8082 ATOM 42009 O WAT 8083 2.708 133.748 62.710 1.00 0.00 O ATOM 42010 H1 WAT 8083 2.299 132.900 62.883 1.00 0.00 H ATOM 42011 H2 WAT 8083 3.552 133.531 62.314 1.00 0.00 H TER 42013 WAT 8083 ATOM 42013 O WAT 8084 26.629 64.172 129.184 1.00 0.00 O ATOM 42014 H1 WAT 8084 26.108 64.953 128.998 1.00 0.00 H ATOM 42015 H2 WAT 8084 26.361 63.910 130.065 1.00 0.00 H TER 42017 WAT 8084 ATOM 42017 O WAT 8085 141.992 125.052 127.877 1.00 0.00 O ATOM 42018 H1 WAT 8085 141.835 124.759 126.979 1.00 0.00 H ATOM 42019 H2 WAT 8085 142.289 124.268 128.337 1.00 0.00 H TER 42021 WAT 8085 ATOM 42021 O WAT 8086 3.598 111.338 1.745 1.00 0.00 O ATOM 42022 H1 WAT 8086 3.174 112.193 1.667 1.00 0.00 H ATOM 42023 H2 WAT 8086 3.644 111.178 2.688 1.00 0.00 H TER 42025 WAT 8086 ATOM 42025 O WAT 8087 144.307 76.935 156.170 1.00 0.00 O ATOM 42026 H1 WAT 8087 143.428 77.300 156.279 1.00 0.00 H ATOM 42027 H2 WAT 8087 144.316 76.161 156.732 1.00 0.00 H TER 42029 WAT 8087 ATOM 42029 O WAT 8088 108.741 36.286 127.336 1.00 0.00 O ATOM 42030 H1 WAT 8088 108.087 36.536 127.988 1.00 0.00 H ATOM 42031 H2 WAT 8088 108.450 35.430 127.022 1.00 0.00 H TER 42033 WAT 8088 ATOM 42033 O WAT 8089 95.590 13.578 66.518 1.00 0.00 O ATOM 42034 H1 WAT 8089 95.454 14.519 66.411 1.00 0.00 H ATOM 42035 H2 WAT 8089 96.239 13.352 65.852 1.00 0.00 H TER 42037 WAT 8089 ATOM 42037 O WAT 8090 115.998 61.948 6.655 1.00 0.00 O ATOM 42038 H1 WAT 8090 116.002 61.017 6.876 1.00 0.00 H ATOM 42039 H2 WAT 8090 115.083 62.142 6.451 1.00 0.00 H TER 42041 WAT 8090 ATOM 42041 O WAT 8091 86.124 45.041 146.148 1.00 0.00 O ATOM 42042 H1 WAT 8091 86.241 44.449 146.891 1.00 0.00 H ATOM 42043 H2 WAT 8091 87.003 45.146 145.784 1.00 0.00 H TER 42045 WAT 8091 ATOM 42045 O WAT 8092 21.997 72.271 63.417 1.00 0.00 O ATOM 42046 H1 WAT 8092 21.711 72.151 62.512 1.00 0.00 H ATOM 42047 H2 WAT 8092 22.092 73.219 63.514 1.00 0.00 H TER 42049 WAT 8092 ATOM 42049 O WAT 8093 45.301 126.683 154.589 1.00 0.00 O ATOM 42050 H1 WAT 8093 44.994 125.867 154.193 1.00 0.00 H ATOM 42051 H2 WAT 8093 45.330 126.497 155.528 1.00 0.00 H TER 42053 WAT 8093 ATOM 42053 O WAT 8094 112.850 129.921 117.838 1.00 0.00 O ATOM 42054 H1 WAT 8094 113.477 130.465 118.315 1.00 0.00 H ATOM 42055 H2 WAT 8094 112.201 129.672 118.496 1.00 0.00 H TER 42057 WAT 8094 ATOM 42057 O WAT 8095 42.323 135.496 101.134 1.00 0.00 O ATOM 42058 H1 WAT 8095 42.970 135.638 101.825 1.00 0.00 H ATOM 42059 H2 WAT 8095 42.710 135.899 100.357 1.00 0.00 H TER 42061 WAT 8095 ATOM 42061 O WAT 8096 119.709 30.308 133.332 1.00 0.00 O ATOM 42062 H1 WAT 8096 119.805 29.582 133.949 1.00 0.00 H ATOM 42063 H2 WAT 8096 118.802 30.596 133.441 1.00 0.00 H TER 42065 WAT 8096 ATOM 42065 O WAT 8097 113.022 126.945 140.294 1.00 0.00 O ATOM 42066 H1 WAT 8097 113.001 125.995 140.180 1.00 0.00 H ATOM 42067 H2 WAT 8097 113.304 127.283 139.443 1.00 0.00 H TER 42069 WAT 8097 ATOM 42069 O WAT 8098 80.548 0.281 118.390 1.00 0.00 O ATOM 42070 H1 WAT 8098 81.327 -0.275 118.342 1.00 0.00 H ATOM 42071 H2 WAT 8098 80.114 0.157 117.546 1.00 0.00 H TER 42073 WAT 8098 ATOM 42073 O WAT 8099 142.810 120.117 65.304 1.00 0.00 O ATOM 42074 H1 WAT 8099 142.399 119.934 64.459 1.00 0.00 H ATOM 42075 H2 WAT 8099 142.219 120.739 65.727 1.00 0.00 H TER 42077 WAT 8099 ATOM 42077 O WAT 8100 67.108 87.900 140.356 1.00 0.00 O ATOM 42078 H1 WAT 8100 67.583 88.621 139.943 1.00 0.00 H ATOM 42079 H2 WAT 8100 66.466 88.329 140.922 1.00 0.00 H TER 42081 WAT 8100 ATOM 42081 O WAT 8101 70.537 14.098 88.546 1.00 0.00 O ATOM 42082 H1 WAT 8101 71.001 14.877 88.240 1.00 0.00 H ATOM 42083 H2 WAT 8101 69.681 14.424 88.824 1.00 0.00 H TER 42085 WAT 8101 ATOM 42085 O WAT 8102 38.958 50.625 18.709 1.00 0.00 O ATOM 42086 H1 WAT 8102 38.044 50.814 18.923 1.00 0.00 H ATOM 42087 H2 WAT 8102 38.932 50.310 17.805 1.00 0.00 H TER 42089 WAT 8102 ATOM 42089 O WAT 8103 70.940 137.828 64.718 1.00 0.00 O ATOM 42090 H1 WAT 8103 70.644 138.399 65.428 1.00 0.00 H ATOM 42091 H2 WAT 8103 71.266 138.429 64.048 1.00 0.00 H TER 42093 WAT 8103 ATOM 42093 O WAT 8104 4.732 142.583 78.084 1.00 0.00 O ATOM 42094 H1 WAT 8104 4.897 141.994 77.347 1.00 0.00 H ATOM 42095 H2 WAT 8104 4.062 142.136 78.601 1.00 0.00 H TER 42097 WAT 8104 ATOM 42097 O WAT 8105 23.845 141.329 100.483 1.00 0.00 O ATOM 42098 H1 WAT 8105 24.455 140.624 100.266 1.00 0.00 H ATOM 42099 H2 WAT 8105 23.522 141.106 101.356 1.00 0.00 H TER 42101 WAT 8105 ATOM 42101 O WAT 8106 63.441 66.412 82.839 1.00 0.00 O ATOM 42102 H1 WAT 8106 64.307 66.600 83.201 1.00 0.00 H ATOM 42103 H2 WAT 8106 63.283 67.120 82.215 1.00 0.00 H TER 42105 WAT 8106 ATOM 42105 O WAT 8107 17.079 61.187 87.352 1.00 0.00 O ATOM 42106 H1 WAT 8107 17.026 61.483 88.261 1.00 0.00 H ATOM 42107 H2 WAT 8107 16.168 61.104 87.073 1.00 0.00 H TER 42109 WAT 8107 ATOM 42109 O WAT 8108 138.122 44.016 144.129 1.00 0.00 O ATOM 42110 H1 WAT 8108 139.019 44.350 144.160 1.00 0.00 H ATOM 42111 H2 WAT 8108 137.817 44.064 145.035 1.00 0.00 H TER 42113 WAT 8108 ATOM 42113 O WAT 8109 103.888 103.172 128.772 1.00 0.00 O ATOM 42114 H1 WAT 8109 103.639 104.096 128.756 1.00 0.00 H ATOM 42115 H2 WAT 8109 104.332 103.057 129.612 1.00 0.00 H TER 42117 WAT 8109 ATOM 42117 O WAT 8110 11.206 53.838 138.720 1.00 0.00 O ATOM 42118 H1 WAT 8110 11.373 54.281 139.552 1.00 0.00 H ATOM 42119 H2 WAT 8110 10.311 53.509 138.799 1.00 0.00 H TER 42121 WAT 8110 ATOM 42121 O WAT 8111 46.279 104.597 82.590 1.00 0.00 O ATOM 42122 H1 WAT 8111 46.668 105.468 82.506 1.00 0.00 H ATOM 42123 H2 WAT 8111 46.690 104.225 83.370 1.00 0.00 H TER 42125 WAT 8111 ATOM 42125 O WAT 8112 106.088 104.995 -0.028 1.00 0.00 O ATOM 42126 H1 WAT 8112 106.182 104.729 0.887 1.00 0.00 H ATOM 42127 H2 WAT 8112 105.603 105.819 0.011 1.00 0.00 H TER 42129 WAT 8112 ATOM 42129 O WAT 8113 77.437 70.280 147.586 1.00 0.00 O ATOM 42130 H1 WAT 8113 76.804 69.566 147.655 1.00 0.00 H ATOM 42131 H2 WAT 8113 77.252 70.684 146.738 1.00 0.00 H TER 42133 WAT 8113 ATOM 42133 O WAT 8114 134.331 42.209 125.477 1.00 0.00 O ATOM 42134 H1 WAT 8114 133.800 42.075 124.692 1.00 0.00 H ATOM 42135 H2 WAT 8114 134.105 43.091 125.772 1.00 0.00 H TER 42137 WAT 8114 ATOM 42137 O WAT 8115 59.118 92.435 140.001 1.00 0.00 O ATOM 42138 H1 WAT 8115 59.595 92.436 139.171 1.00 0.00 H ATOM 42139 H2 WAT 8115 58.828 91.530 140.110 1.00 0.00 H TER 42141 WAT 8115 ATOM 42141 O WAT 8116 134.803 94.791 14.086 1.00 0.00 O ATOM 42142 H1 WAT 8116 134.135 94.495 13.467 1.00 0.00 H ATOM 42143 H2 WAT 8116 134.322 95.325 14.719 1.00 0.00 H TER 42145 WAT 8116 ATOM 42145 O WAT 8117 77.579 114.065 56.126 1.00 0.00 O ATOM 42146 H1 WAT 8117 78.450 113.927 56.498 1.00 0.00 H ATOM 42147 H2 WAT 8117 77.203 113.187 56.066 1.00 0.00 H TER 42149 WAT 8117 ATOM 42149 O WAT 8118 90.799 59.659 129.337 1.00 0.00 O ATOM 42150 H1 WAT 8118 91.652 59.746 128.912 1.00 0.00 H ATOM 42151 H2 WAT 8118 90.834 60.268 130.074 1.00 0.00 H TER 42153 WAT 8118 ATOM 42153 O WAT 8119 83.614 140.848 108.787 1.00 0.00 O ATOM 42154 H1 WAT 8119 84.448 140.501 109.103 1.00 0.00 H ATOM 42155 H2 WAT 8119 83.196 140.106 108.350 1.00 0.00 H TER 42157 WAT 8119 ATOM 42157 O WAT 8120 121.243 120.851 127.025 1.00 0.00 O ATOM 42158 H1 WAT 8120 121.315 120.402 127.867 1.00 0.00 H ATOM 42159 H2 WAT 8120 122.062 121.340 126.944 1.00 0.00 H TER 42161 WAT 8120 ATOM 42161 O WAT 8121 77.591 94.875 142.950 1.00 0.00 O ATOM 42162 H1 WAT 8121 78.150 95.501 143.409 1.00 0.00 H ATOM 42163 H2 WAT 8121 78.174 94.147 142.733 1.00 0.00 H TER 42165 WAT 8121 ATOM 42165 O WAT 8122 59.231 123.484 3.348 1.00 0.00 O ATOM 42166 H1 WAT 8122 58.537 122.835 3.234 1.00 0.00 H ATOM 42167 H2 WAT 8122 59.657 123.533 2.492 1.00 0.00 H TER 42169 WAT 8122 ATOM 42169 O WAT 8123 104.550 93.957 12.626 1.00 0.00 O ATOM 42170 H1 WAT 8123 105.503 93.897 12.699 1.00 0.00 H ATOM 42171 H2 WAT 8123 104.263 93.056 12.482 1.00 0.00 H TER 42173 WAT 8123 ATOM 42173 O WAT 8124 43.417 28.031 18.694 1.00 0.00 O ATOM 42174 H1 WAT 8124 43.281 27.084 18.706 1.00 0.00 H ATOM 42175 H2 WAT 8124 42.698 28.370 18.160 1.00 0.00 H TER 42177 WAT 8124 ATOM 42177 O WAT 8125 79.445 127.073 65.867 1.00 0.00 O ATOM 42178 H1 WAT 8125 78.858 126.381 65.561 1.00 0.00 H ATOM 42179 H2 WAT 8125 79.062 127.881 65.524 1.00 0.00 H TER 42181 WAT 8125 ATOM 42181 O WAT 8126 125.679 41.581 97.412 1.00 0.00 O ATOM 42182 H1 WAT 8126 126.287 42.154 97.880 1.00 0.00 H ATOM 42183 H2 WAT 8126 125.466 42.061 96.612 1.00 0.00 H TER 42185 WAT 8126 ATOM 42185 O WAT 8127 78.031 114.571 73.219 1.00 0.00 O ATOM 42186 H1 WAT 8127 78.227 113.849 72.622 1.00 0.00 H ATOM 42187 H2 WAT 8127 78.807 114.638 73.777 1.00 0.00 H TER 42189 WAT 8127 ATOM 42189 O WAT 8128 85.358 37.255 130.732 1.00 0.00 O ATOM 42190 H1 WAT 8128 84.678 36.888 131.296 1.00 0.00 H ATOM 42191 H2 WAT 8128 86.067 36.612 130.762 1.00 0.00 H TER 42193 WAT 8128 ATOM 42193 O WAT 8129 117.754 18.467 156.843 1.00 0.00 O ATOM 42194 H1 WAT 8129 116.838 18.197 156.784 1.00 0.00 H ATOM 42195 H2 WAT 8129 118.252 17.670 156.660 1.00 0.00 H TER 42197 WAT 8129 ATOM 42197 O WAT 8130 39.434 139.439 69.734 1.00 0.00 O ATOM 42198 H1 WAT 8130 38.735 138.827 69.504 1.00 0.00 H ATOM 42199 H2 WAT 8130 40.094 138.898 70.166 1.00 0.00 H TER 42201 WAT 8130 ATOM 42201 O WAT 8131 114.606 112.136 66.343 1.00 0.00 O ATOM 42202 H1 WAT 8131 114.773 113.054 66.127 1.00 0.00 H ATOM 42203 H2 WAT 8131 115.112 111.643 65.697 1.00 0.00 H TER 42205 WAT 8131 ATOM 42205 O WAT 8132 138.235 83.749 7.184 1.00 0.00 O ATOM 42206 H1 WAT 8132 137.722 84.543 7.030 1.00 0.00 H ATOM 42207 H2 WAT 8132 138.047 83.193 6.429 1.00 0.00 H TER 42209 WAT 8132 ATOM 42209 O WAT 8133 72.959 55.190 4.591 1.00 0.00 O ATOM 42210 H1 WAT 8133 72.819 54.420 5.142 1.00 0.00 H ATOM 42211 H2 WAT 8133 72.686 54.911 3.717 1.00 0.00 H TER 42213 WAT 8133 ATOM 42213 O WAT 8134 7.023 99.053 88.551 1.00 0.00 O ATOM 42214 H1 WAT 8134 7.649 99.752 88.362 1.00 0.00 H ATOM 42215 H2 WAT 8134 7.433 98.262 88.202 1.00 0.00 H TER 42217 WAT 8134 ATOM 42217 O WAT 8135 93.049 12.080 112.575 1.00 0.00 O ATOM 42218 H1 WAT 8135 92.233 12.491 112.861 1.00 0.00 H ATOM 42219 H2 WAT 8135 93.738 12.621 112.961 1.00 0.00 H TER 42221 WAT 8135 ATOM 42221 O WAT 8136 73.283 48.229 152.417 1.00 0.00 O ATOM 42222 H1 WAT 8136 73.250 48.944 153.053 1.00 0.00 H ATOM 42223 H2 WAT 8136 72.886 48.594 151.627 1.00 0.00 H TER 42225 WAT 8136 ATOM 42225 O WAT 8137 106.661 127.394 144.226 1.00 0.00 O ATOM 42226 H1 WAT 8137 106.224 127.493 143.381 1.00 0.00 H ATOM 42227 H2 WAT 8137 106.148 127.935 144.826 1.00 0.00 H TER 42229 WAT 8137 ATOM 42229 O WAT 8138 54.534 68.142 149.938 1.00 0.00 O ATOM 42230 H1 WAT 8138 54.061 68.965 149.815 1.00 0.00 H ATOM 42231 H2 WAT 8138 53.977 67.631 150.525 1.00 0.00 H TER 42233 WAT 8138 ATOM 42233 O WAT 8139 124.610 29.827 137.540 1.00 0.00 O ATOM 42234 H1 WAT 8139 124.492 30.625 138.056 1.00 0.00 H ATOM 42235 H2 WAT 8139 124.786 30.140 136.652 1.00 0.00 H TER 42237 WAT 8139 ATOM 42237 O WAT 8140 127.545 4.330 15.235 1.00 0.00 O ATOM 42238 H1 WAT 8140 127.203 5.092 15.702 1.00 0.00 H ATOM 42239 H2 WAT 8140 127.813 3.725 15.927 1.00 0.00 H TER 42241 WAT 8140 ATOM 42241 O WAT 8141 2.897 8.914 158.425 1.00 0.00 O ATOM 42242 H1 WAT 8141 3.069 8.060 158.820 1.00 0.00 H ATOM 42243 H2 WAT 8141 3.763 9.251 158.196 1.00 0.00 H TER 42245 WAT 8141 ATOM 42245 O WAT 8142 105.476 11.379 149.049 1.00 0.00 O ATOM 42246 H1 WAT 8142 105.427 11.854 149.879 1.00 0.00 H ATOM 42247 H2 WAT 8142 106.404 11.166 148.949 1.00 0.00 H TER 42249 WAT 8142 ATOM 42249 O WAT 8143 94.594 31.671 115.764 1.00 0.00 O ATOM 42250 H1 WAT 8143 95.300 31.442 115.159 1.00 0.00 H ATOM 42251 H2 WAT 8143 94.127 30.848 115.909 1.00 0.00 H TER 42253 WAT 8143 ATOM 42253 O WAT 8144 74.035 138.660 120.392 1.00 0.00 O ATOM 42254 H1 WAT 8144 73.983 137.718 120.233 1.00 0.00 H ATOM 42255 H2 WAT 8144 74.428 138.735 121.262 1.00 0.00 H TER 42257 WAT 8144 ATOM 42257 O WAT 8145 77.402 111.683 153.132 1.00 0.00 O ATOM 42258 H1 WAT 8145 76.644 111.919 152.598 1.00 0.00 H ATOM 42259 H2 WAT 8145 77.108 110.932 153.647 1.00 0.00 H TER 42261 WAT 8145 ATOM 42261 O WAT 8146 17.630 128.491 154.927 1.00 0.00 O ATOM 42262 H1 WAT 8146 18.011 128.101 155.714 1.00 0.00 H ATOM 42263 H2 WAT 8146 18.286 128.346 154.246 1.00 0.00 H TER 42265 WAT 8146 ATOM 42265 O WAT 8147 134.850 70.141 7.078 1.00 0.00 O ATOM 42266 H1 WAT 8147 134.602 70.879 6.521 1.00 0.00 H ATOM 42267 H2 WAT 8147 134.242 70.183 7.816 1.00 0.00 H TER 42269 WAT 8147 ATOM 42269 O WAT 8148 124.312 74.692 122.394 1.00 0.00 O ATOM 42270 H1 WAT 8148 124.426 73.807 122.739 1.00 0.00 H ATOM 42271 H2 WAT 8148 123.457 74.674 121.964 1.00 0.00 H TER 42273 WAT 8148 ATOM 42273 O WAT 8149 63.649 20.072 135.234 1.00 0.00 O ATOM 42274 H1 WAT 8149 63.868 20.459 136.081 1.00 0.00 H ATOM 42275 H2 WAT 8149 63.120 19.304 135.450 1.00 0.00 H TER 42277 WAT 8149 ATOM 42277 O WAT 8150 21.015 77.305 82.881 1.00 0.00 O ATOM 42278 H1 WAT 8150 21.075 77.781 82.053 1.00 0.00 H ATOM 42279 H2 WAT 8150 20.951 76.385 82.624 1.00 0.00 H TER 42281 WAT 8150 ATOM 42281 O WAT 8151 35.192 40.540 19.919 1.00 0.00 O ATOM 42282 H1 WAT 8151 35.964 40.201 20.372 1.00 0.00 H ATOM 42283 H2 WAT 8151 34.957 41.330 20.405 1.00 0.00 H TER 42285 WAT 8151 ATOM 42285 O WAT 8152 5.311 108.804 147.779 1.00 0.00 O ATOM 42286 H1 WAT 8152 4.740 109.523 148.051 1.00 0.00 H ATOM 42287 H2 WAT 8152 6.156 109.003 148.182 1.00 0.00 H TER 42289 WAT 8152 ATOM 42289 O WAT 8153 44.755 100.704 105.582 1.00 0.00 O ATOM 42290 H1 WAT 8153 45.430 100.361 106.167 1.00 0.00 H ATOM 42291 H2 WAT 8153 44.003 100.128 105.720 1.00 0.00 H TER 42293 WAT 8153 ATOM 42293 O WAT 8154 104.297 140.635 16.037 1.00 0.00 O ATOM 42294 H1 WAT 8154 104.279 140.550 16.990 1.00 0.00 H ATOM 42295 H2 WAT 8154 104.517 139.759 15.722 1.00 0.00 H TER 42297 WAT 8154 ATOM 42297 O WAT 8155 41.338 136.717 149.392 1.00 0.00 O ATOM 42298 H1 WAT 8155 41.536 137.623 149.154 1.00 0.00 H ATOM 42299 H2 WAT 8155 40.690 136.436 148.747 1.00 0.00 H TER 42301 WAT 8155 ATOM 42301 O WAT 8156 33.130 87.338 122.266 1.00 0.00 O ATOM 42302 H1 WAT 8156 32.493 86.693 122.575 1.00 0.00 H ATOM 42303 H2 WAT 8156 32.868 87.519 121.363 1.00 0.00 H TER 42305 WAT 8156 ATOM 42305 O WAT 8157 110.465 103.559 18.489 1.00 0.00 O ATOM 42306 H1 WAT 8157 110.307 103.485 17.548 1.00 0.00 H ATOM 42307 H2 WAT 8157 110.209 104.456 18.704 1.00 0.00 H TER 42309 WAT 8157 ATOM 42309 O WAT 8158 0.936 20.958 10.820 1.00 0.00 O ATOM 42310 H1 WAT 8158 0.284 21.517 10.397 1.00 0.00 H ATOM 42311 H2 WAT 8158 0.876 21.181 11.749 1.00 0.00 H TER 42313 WAT 8158 ATOM 42313 O WAT 8159 70.860 0.662 153.050 1.00 0.00 O ATOM 42314 H1 WAT 8159 71.130 1.431 152.549 1.00 0.00 H ATOM 42315 H2 WAT 8159 70.359 1.018 153.784 1.00 0.00 H TER 42317 WAT 8159 ATOM 42317 O WAT 8160 24.185 139.679 117.610 1.00 0.00 O ATOM 42318 H1 WAT 8160 23.610 138.934 117.438 1.00 0.00 H ATOM 42319 H2 WAT 8160 23.707 140.208 118.249 1.00 0.00 H TER 42321 WAT 8160 ATOM 42321 O WAT 8161 23.732 36.769 83.798 1.00 0.00 O ATOM 42322 H1 WAT 8161 24.315 37.168 83.152 1.00 0.00 H ATOM 42323 H2 WAT 8161 24.218 36.010 84.122 1.00 0.00 H TER 42325 WAT 8161 ATOM 42325 O WAT 8162 74.450 35.120 157.256 1.00 0.00 O ATOM 42326 H1 WAT 8162 74.453 36.052 157.476 1.00 0.00 H ATOM 42327 H2 WAT 8162 75.146 34.745 157.794 1.00 0.00 H TER 42329 WAT 8162 ATOM 42329 O WAT 8163 112.854 88.924 156.645 1.00 0.00 O ATOM 42330 H1 WAT 8163 113.364 89.724 156.517 1.00 0.00 H ATOM 42331 H2 WAT 8163 112.525 88.990 157.542 1.00 0.00 H TER 42333 WAT 8163 ATOM 42333 O WAT 8164 43.814 61.932 83.145 1.00 0.00 O ATOM 42334 H1 WAT 8164 44.510 62.504 83.469 1.00 0.00 H ATOM 42335 H2 WAT 8164 43.505 62.360 82.347 1.00 0.00 H TER 42337 WAT 8164 ATOM 42337 O WAT 8165 11.540 122.435 144.982 1.00 0.00 O ATOM 42338 H1 WAT 8165 11.336 121.543 144.699 1.00 0.00 H ATOM 42339 H2 WAT 8165 12.247 122.328 145.618 1.00 0.00 H TER 42341 WAT 8165 ATOM 42341 O WAT 8166 73.530 111.124 112.789 1.00 0.00 O ATOM 42342 H1 WAT 8166 74.019 111.135 113.612 1.00 0.00 H ATOM 42343 H2 WAT 8166 73.463 112.045 112.538 1.00 0.00 H TER 42345 WAT 8166 ATOM 42345 O WAT 8167 122.155 132.995 115.764 1.00 0.00 O ATOM 42346 H1 WAT 8167 121.884 132.280 115.188 1.00 0.00 H ATOM 42347 H2 WAT 8167 123.111 132.946 115.772 1.00 0.00 H TER 42349 WAT 8167 ATOM 42349 O WAT 8168 2.136 27.651 60.062 1.00 0.00 O ATOM 42350 H1 WAT 8168 3.050 27.380 59.979 1.00 0.00 H ATOM 42351 H2 WAT 8168 2.096 28.498 59.618 1.00 0.00 H TER 42353 WAT 8168 ATOM 42353 O WAT 8169 130.596 39.224 70.296 1.00 0.00 O ATOM 42354 H1 WAT 8169 131.377 38.940 70.770 1.00 0.00 H ATOM 42355 H2 WAT 8169 129.923 38.588 70.539 1.00 0.00 H TER 42357 WAT 8169 ATOM 42357 O WAT 8170 131.522 112.492 141.470 1.00 0.00 O ATOM 42358 H1 WAT 8170 131.299 112.489 140.539 1.00 0.00 H ATOM 42359 H2 WAT 8170 132.250 111.875 141.544 1.00 0.00 H TER 42361 WAT 8170 ATOM 42361 O WAT 8171 102.130 107.015 93.492 1.00 0.00 O ATOM 42362 H1 WAT 8171 101.550 106.326 93.816 1.00 0.00 H ATOM 42363 H2 WAT 8171 103.012 106.666 93.618 1.00 0.00 H TER 42365 WAT 8171 ATOM 42365 O WAT 8172 61.597 123.505 61.424 1.00 0.00 O ATOM 42366 H1 WAT 8172 61.502 124.415 61.144 1.00 0.00 H ATOM 42367 H2 WAT 8172 60.719 123.248 61.706 1.00 0.00 H TER 42369 WAT 8172 ATOM 42369 O WAT 8173 141.090 55.827 140.143 1.00 0.00 O ATOM 42370 H1 WAT 8173 141.295 56.330 140.931 1.00 0.00 H ATOM 42371 H2 WAT 8173 140.231 55.444 140.319 1.00 0.00 H TER 42373 WAT 8173 ATOM 42373 O WAT 8174 11.725 42.380 62.671 1.00 0.00 O ATOM 42374 H1 WAT 8174 10.822 42.155 62.449 1.00 0.00 H ATOM 42375 H2 WAT 8174 12.244 42.032 61.947 1.00 0.00 H TER 42377 WAT 8174 ATOM 42377 O WAT 8175 71.426 110.203 96.725 1.00 0.00 O ATOM 42378 H1 WAT 8175 70.630 109.685 96.846 1.00 0.00 H ATOM 42379 H2 WAT 8175 71.725 110.392 97.614 1.00 0.00 H TER 42381 WAT 8175 ATOM 42381 O WAT 8176 116.755 24.352 89.099 1.00 0.00 O ATOM 42382 H1 WAT 8176 116.179 25.024 89.463 1.00 0.00 H ATOM 42383 H2 WAT 8176 117.090 23.884 89.864 1.00 0.00 H TER 42385 WAT 8176 ATOM 42385 O WAT 8177 12.244 57.504 128.018 1.00 0.00 O ATOM 42386 H1 WAT 8177 13.097 57.553 127.585 1.00 0.00 H ATOM 42387 H2 WAT 8177 11.997 56.581 127.957 1.00 0.00 H TER 42389 WAT 8177 ATOM 42389 O WAT 8178 17.795 0.870 60.030 1.00 0.00 O ATOM 42390 H1 WAT 8178 16.970 1.158 59.639 1.00 0.00 H ATOM 42391 H2 WAT 8178 18.251 0.418 59.320 1.00 0.00 H TER 42393 WAT 8178 ATOM 42393 O WAT 8179 87.149 122.066 3.913 1.00 0.00 O ATOM 42394 H1 WAT 8179 86.539 121.899 3.194 1.00 0.00 H ATOM 42395 H2 WAT 8179 86.840 122.882 4.305 1.00 0.00 H TER 42397 WAT 8179 ATOM 42397 O WAT 8180 109.719 137.875 143.497 1.00 0.00 O ATOM 42398 H1 WAT 8180 110.476 138.082 144.045 1.00 0.00 H ATOM 42399 H2 WAT 8180 109.697 138.575 142.844 1.00 0.00 H TER 42401 WAT 8180 ATOM 42401 O WAT 8181 19.735 56.855 157.624 1.00 0.00 O ATOM 42402 H1 WAT 8181 19.872 56.167 156.973 1.00 0.00 H ATOM 42403 H2 WAT 8181 19.985 57.663 157.174 1.00 0.00 H TER 42405 WAT 8181 ATOM 42405 O WAT 8182 114.303 11.287 102.865 1.00 0.00 O ATOM 42406 H1 WAT 8182 114.950 11.396 103.562 1.00 0.00 H ATOM 42407 H2 WAT 8182 113.549 11.799 103.157 1.00 0.00 H TER 42409 WAT 8182 ATOM 42409 O WAT 8183 75.777 141.441 0.254 1.00 0.00 O ATOM 42410 H1 WAT 8183 74.958 141.316 0.733 1.00 0.00 H ATOM 42411 H2 WAT 8183 76.176 140.571 0.230 1.00 0.00 H TER 42413 WAT 8183 ATOM 42413 O WAT 8184 44.372 66.175 128.026 1.00 0.00 O ATOM 42414 H1 WAT 8184 44.558 67.060 128.340 1.00 0.00 H ATOM 42415 H2 WAT 8184 43.666 66.290 127.390 1.00 0.00 H TER 42417 WAT 8184 ATOM 42417 O WAT 8185 114.409 111.621 115.095 1.00 0.00 O ATOM 42418 H1 WAT 8185 113.802 112.246 114.699 1.00 0.00 H ATOM 42419 H2 WAT 8185 115.049 112.165 115.553 1.00 0.00 H TER 42421 WAT 8185 ATOM 42421 O WAT 8186 112.195 41.673 7.056 1.00 0.00 O ATOM 42422 H1 WAT 8186 112.069 41.055 6.337 1.00 0.00 H ATOM 42423 H2 WAT 8186 112.133 41.137 7.847 1.00 0.00 H TER 42425 WAT 8186 ATOM 42425 O WAT 8187 23.990 39.946 157.330 1.00 0.00 O ATOM 42426 H1 WAT 8187 23.409 40.467 157.885 1.00 0.00 H ATOM 42427 H2 WAT 8187 24.532 39.454 157.947 1.00 0.00 H TER 42429 WAT 8187 ATOM 42429 O WAT 8188 17.867 82.735 133.062 1.00 0.00 O ATOM 42430 H1 WAT 8188 18.140 82.496 133.948 1.00 0.00 H ATOM 42431 H2 WAT 8188 16.916 82.832 133.123 1.00 0.00 H TER 42433 WAT 8188 ATOM 42433 O WAT 8189 89.570 38.376 16.313 1.00 0.00 O ATOM 42434 H1 WAT 8189 90.195 39.099 16.254 1.00 0.00 H ATOM 42435 H2 WAT 8189 89.619 38.091 17.226 1.00 0.00 H TER 42437 WAT 8189 ATOM 42437 O WAT 8190 2.115 124.401 74.038 1.00 0.00 O ATOM 42438 H1 WAT 8190 1.687 125.055 73.487 1.00 0.00 H ATOM 42439 H2 WAT 8190 1.902 124.664 74.933 1.00 0.00 H TER 42441 WAT 8190 ATOM 42441 O WAT 8191 143.886 41.422 17.591 1.00 0.00 O ATOM 42442 H1 WAT 8191 142.939 41.528 17.495 1.00 0.00 H ATOM 42443 H2 WAT 8191 143.997 40.518 17.887 1.00 0.00 H TER 42445 WAT 8191 ATOM 42445 O WAT 8192 117.565 57.155 144.168 1.00 0.00 O ATOM 42446 H1 WAT 8192 117.386 57.210 143.229 1.00 0.00 H ATOM 42447 H2 WAT 8192 118.520 57.163 144.230 1.00 0.00 H TER 42449 WAT 8192 ATOM 42449 O WAT 8193 52.560 84.261 94.939 1.00 0.00 O ATOM 42450 H1 WAT 8193 51.625 84.205 94.741 1.00 0.00 H ATOM 42451 H2 WAT 8193 52.595 84.573 95.843 1.00 0.00 H TER 42453 WAT 8193 ATOM 42453 O WAT 8194 58.080 80.268 4.762 1.00 0.00 O ATOM 42454 H1 WAT 8194 58.312 80.763 5.548 1.00 0.00 H ATOM 42455 H2 WAT 8194 57.425 80.810 4.322 1.00 0.00 H TER 42457 WAT 8194 ATOM 42457 O WAT 8195 101.538 24.867 18.115 1.00 0.00 O ATOM 42458 H1 WAT 8195 102.229 24.985 18.766 1.00 0.00 H ATOM 42459 H2 WAT 8195 101.107 25.720 18.065 1.00 0.00 H TER 42461 WAT 8195 ATOM 42461 O WAT 8196 28.012 58.737 91.887 1.00 0.00 O ATOM 42462 H1 WAT 8196 28.244 59.576 91.488 1.00 0.00 H ATOM 42463 H2 WAT 8196 28.138 58.876 92.826 1.00 0.00 H TER 42465 WAT 8196 ATOM 42465 O WAT 8197 2.663 86.428 5.371 1.00 0.00 O ATOM 42466 H1 WAT 8197 1.738 86.196 5.450 1.00 0.00 H ATOM 42467 H2 WAT 8197 2.985 86.437 6.273 1.00 0.00 H TER 42469 WAT 8197 ATOM 42469 O WAT 8198 14.809 72.319 108.575 1.00 0.00 O ATOM 42470 H1 WAT 8198 14.106 72.408 107.931 1.00 0.00 H ATOM 42471 H2 WAT 8198 15.569 72.725 108.157 1.00 0.00 H TER 42473 WAT 8198 ATOM 42473 O WAT 8199 48.131 109.824 156.104 1.00 0.00 O ATOM 42474 H1 WAT 8199 47.251 109.467 156.228 1.00 0.00 H ATOM 42475 H2 WAT 8199 48.703 109.056 156.104 1.00 0.00 H TER 42477 WAT 8199 ATOM 42477 O WAT 8200 36.808 131.112 75.640 1.00 0.00 O ATOM 42478 H1 WAT 8200 36.237 131.294 74.894 1.00 0.00 H ATOM 42479 H2 WAT 8200 36.255 131.261 76.407 1.00 0.00 H TER 42481 WAT 8200 ATOM 42481 O WAT 8201 5.232 77.055 71.406 1.00 0.00 O ATOM 42482 H1 WAT 8201 6.012 77.590 71.261 1.00 0.00 H ATOM 42483 H2 WAT 8201 5.336 76.717 72.295 1.00 0.00 H TER 42485 WAT 8201 ATOM 42485 O WAT 8202 40.412 40.555 6.439 1.00 0.00 O ATOM 42486 H1 WAT 8202 40.930 40.513 7.244 1.00 0.00 H ATOM 42487 H2 WAT 8202 40.199 41.483 6.340 1.00 0.00 H TER 42489 WAT 8202 ATOM 42489 O WAT 8203 105.037 105.508 17.809 1.00 0.00 O ATOM 42490 H1 WAT 8203 105.208 104.708 18.305 1.00 0.00 H ATOM 42491 H2 WAT 8203 105.882 105.736 17.421 1.00 0.00 H TER 42493 WAT 8203 ATOM 42493 O WAT 8204 8.153 42.418 0.129 1.00 0.00 O ATOM 42494 H1 WAT 8204 9.030 42.609 0.463 1.00 0.00 H ATOM 42495 H2 WAT 8204 8.109 41.462 0.103 1.00 0.00 H TER 42497 WAT 8204 ATOM 42497 O WAT 8205 128.851 12.076 66.325 1.00 0.00 O ATOM 42498 H1 WAT 8205 127.908 11.958 66.441 1.00 0.00 H ATOM 42499 H2 WAT 8205 129.000 13.005 66.500 1.00 0.00 H TER 42501 WAT 8205 ATOM 42501 O WAT 8206 67.348 57.663 141.304 1.00 0.00 O ATOM 42502 H1 WAT 8206 66.597 58.089 140.889 1.00 0.00 H ATOM 42503 H2 WAT 8206 68.039 57.700 140.642 1.00 0.00 H TER 42505 WAT 8206 ATOM 42505 O WAT 8207 107.298 71.407 76.298 1.00 0.00 O ATOM 42506 H1 WAT 8207 106.620 70.750 76.137 1.00 0.00 H ATOM 42507 H2 WAT 8207 107.359 71.894 75.476 1.00 0.00 H TER 42509 WAT 8207 ATOM 42509 O WAT 8208 102.386 76.764 95.942 1.00 0.00 O ATOM 42510 H1 WAT 8208 102.414 77.266 95.128 1.00 0.00 H ATOM 42511 H2 WAT 8208 102.584 77.405 96.625 1.00 0.00 H TER 42513 WAT 8208 ATOM 42513 O WAT 8209 0.048 61.460 134.969 1.00 0.00 O ATOM 42514 H1 WAT 8209 0.774 61.591 134.360 1.00 0.00 H ATOM 42515 H2 WAT 8209 -0.661 61.998 134.617 1.00 0.00 H TER 42517 WAT 8209 ATOM 42517 O WAT 8210 100.189 70.718 140.129 1.00 0.00 O ATOM 42518 H1 WAT 8210 99.305 70.570 140.466 1.00 0.00 H ATOM 42519 H2 WAT 8210 100.642 71.175 140.838 1.00 0.00 H TER 42521 WAT 8210 ATOM 42521 O WAT 8211 78.793 41.493 141.965 1.00 0.00 O ATOM 42522 H1 WAT 8211 78.169 42.116 141.593 1.00 0.00 H ATOM 42523 H2 WAT 8211 79.346 41.238 141.227 1.00 0.00 H TER 42525 WAT 8211 ATOM 42525 O WAT 8212 130.456 97.990 105.077 1.00 0.00 O ATOM 42526 H1 WAT 8212 130.594 98.930 105.193 1.00 0.00 H ATOM 42527 H2 WAT 8212 130.760 97.811 104.187 1.00 0.00 H TER 42529 WAT 8212 ATOM 42529 O WAT 8213 11.719 130.935 1.211 1.00 0.00 O ATOM 42530 H1 WAT 8213 11.609 131.055 0.268 1.00 0.00 H ATOM 42531 H2 WAT 8213 12.187 130.104 1.294 1.00 0.00 H TER 42533 WAT 8213 ATOM 42533 O WAT 8214 65.965 55.783 99.437 1.00 0.00 O ATOM 42534 H1 WAT 8214 65.937 56.263 100.265 1.00 0.00 H ATOM 42535 H2 WAT 8214 65.095 55.394 99.357 1.00 0.00 H TER 42537 WAT 8214 ATOM 42537 O WAT 8215 61.115 71.770 81.180 1.00 0.00 O ATOM 42538 H1 WAT 8215 61.318 71.353 80.343 1.00 0.00 H ATOM 42539 H2 WAT 8215 60.332 71.315 81.490 1.00 0.00 H TER 42541 WAT 8215 ATOM 42541 O WAT 8216 53.420 107.386 16.257 1.00 0.00 O ATOM 42542 H1 WAT 8216 52.964 107.177 17.072 1.00 0.00 H ATOM 42543 H2 WAT 8216 53.986 108.125 16.481 1.00 0.00 H TER 42545 WAT 8216 ATOM 42545 O WAT 8217 73.930 128.228 91.872 1.00 0.00 O ATOM 42546 H1 WAT 8217 73.090 128.437 91.463 1.00 0.00 H ATOM 42547 H2 WAT 8217 74.510 128.026 91.138 1.00 0.00 H TER 42549 WAT 8217 ATOM 42549 O WAT 8218 34.509 56.453 9.681 1.00 0.00 O ATOM 42550 H1 WAT 8218 34.226 55.996 10.473 1.00 0.00 H ATOM 42551 H2 WAT 8218 34.965 57.230 10.004 1.00 0.00 H TER 42553 WAT 8218 ATOM 42553 O WAT 8219 30.788 114.271 97.327 1.00 0.00 O ATOM 42554 H1 WAT 8219 31.411 114.797 97.829 1.00 0.00 H ATOM 42555 H2 WAT 8219 30.013 114.828 97.248 1.00 0.00 H TER 42557 WAT 8219 ATOM 42557 O WAT 8220 65.628 24.142 154.685 1.00 0.00 O ATOM 42558 H1 WAT 8220 66.072 24.218 153.840 1.00 0.00 H ATOM 42559 H2 WAT 8220 65.062 24.913 154.729 1.00 0.00 H TER 42561 WAT 8220 ATOM 42561 O WAT 8221 115.643 138.533 3.232 1.00 0.00 O ATOM 42562 H1 WAT 8221 116.593 138.411 3.218 1.00 0.00 H ATOM 42563 H2 WAT 8221 115.495 139.319 2.705 1.00 0.00 H TER 42565 WAT 8221 ATOM 42565 O WAT 8222 86.834 39.446 84.577 1.00 0.00 O ATOM 42566 H1 WAT 8222 86.173 39.146 83.953 1.00 0.00 H ATOM 42567 H2 WAT 8222 86.623 38.985 85.389 1.00 0.00 H TER 42569 WAT 8222 ATOM 42569 O WAT 8223 104.861 64.534 66.889 1.00 0.00 O ATOM 42570 H1 WAT 8223 105.048 64.743 65.974 1.00 0.00 H ATOM 42571 H2 WAT 8223 104.890 65.378 67.339 1.00 0.00 H TER 42573 WAT 8223 ATOM 42573 O WAT 8224 24.119 111.779 0.913 1.00 0.00 O ATOM 42574 H1 WAT 8224 25.040 111.533 0.826 1.00 0.00 H ATOM 42575 H2 WAT 8224 23.647 111.130 0.391 1.00 0.00 H TER 42577 WAT 8224 ATOM 42577 O WAT 8225 27.861 77.362 69.972 1.00 0.00 O ATOM 42578 H1 WAT 8225 27.946 77.635 70.886 1.00 0.00 H ATOM 42579 H2 WAT 8225 26.947 77.540 69.753 1.00 0.00 H TER 42581 WAT 8225 ATOM 42581 O WAT 8226 28.811 20.861 132.061 1.00 0.00 O ATOM 42582 H1 WAT 8226 28.637 21.015 132.990 1.00 0.00 H ATOM 42583 H2 WAT 8226 29.492 21.495 131.837 1.00 0.00 H TER 42585 WAT 8226 ATOM 42585 O WAT 8227 136.364 8.928 64.951 1.00 0.00 O ATOM 42586 H1 WAT 8227 136.765 9.550 65.558 1.00 0.00 H ATOM 42587 H2 WAT 8227 135.788 9.463 64.405 1.00 0.00 H TER 42589 WAT 8227 ATOM 42589 O WAT 8228 79.374 48.293 5.265 1.00 0.00 O ATOM 42590 H1 WAT 8228 79.725 49.183 5.278 1.00 0.00 H ATOM 42591 H2 WAT 8228 78.548 48.354 5.746 1.00 0.00 H TER 42593 WAT 8228 ATOM 42593 O WAT 8229 100.975 127.432 118.514 1.00 0.00 O ATOM 42594 H1 WAT 8229 101.433 126.826 119.097 1.00 0.00 H ATOM 42595 H2 WAT 8229 101.655 128.034 118.211 1.00 0.00 H TER 42597 WAT 8229 ATOM 42597 O WAT 8230 33.574 62.655 64.913 1.00 0.00 O ATOM 42598 H1 WAT 8230 34.448 62.785 65.281 1.00 0.00 H ATOM 42599 H2 WAT 8230 33.487 63.341 64.253 1.00 0.00 H TER 42601 WAT 8230 ATOM 42601 O WAT 8231 33.054 97.459 75.452 1.00 0.00 O ATOM 42602 H1 WAT 8231 33.046 97.911 74.609 1.00 0.00 H ATOM 42603 H2 WAT 8231 32.355 96.809 75.383 1.00 0.00 H TER 42605 WAT 8231 ATOM 42605 O WAT 8232 85.715 105.226 5.879 1.00 0.00 O ATOM 42606 H1 WAT 8232 86.224 104.496 5.527 1.00 0.00 H ATOM 42607 H2 WAT 8232 85.315 104.878 6.676 1.00 0.00 H TER 42609 WAT 8232 ATOM 42609 O WAT 8233 90.896 21.020 89.969 1.00 0.00 O ATOM 42610 H1 WAT 8233 91.554 20.351 90.159 1.00 0.00 H ATOM 42611 H2 WAT 8233 91.144 21.763 90.520 1.00 0.00 H TER 42613 WAT 8233 ATOM 42613 O WAT 8234 20.282 81.788 150.122 1.00 0.00 O ATOM 42614 H1 WAT 8234 19.395 82.037 150.382 1.00 0.00 H ATOM 42615 H2 WAT 8234 20.219 81.619 149.182 1.00 0.00 H TER 42617 WAT 8234 ATOM 42617 O WAT 8235 13.831 10.219 98.012 1.00 0.00 O ATOM 42618 H1 WAT 8235 14.187 10.841 97.379 1.00 0.00 H ATOM 42619 H2 WAT 8235 12.998 9.939 97.631 1.00 0.00 H TER 42621 WAT 8235 ATOM 42621 O WAT 8236 133.809 47.556 73.889 1.00 0.00 O ATOM 42622 H1 WAT 8236 134.067 47.000 73.154 1.00 0.00 H ATOM 42623 H2 WAT 8236 133.880 48.449 73.550 1.00 0.00 H TER 42625 WAT 8236 ATOM 42625 O WAT 8237 123.724 131.792 75.528 1.00 0.00 O ATOM 42626 H1 WAT 8237 123.863 132.620 75.987 1.00 0.00 H ATOM 42627 H2 WAT 8237 124.473 131.251 75.777 1.00 0.00 H TER 42629 WAT 8237 ATOM 42629 O WAT 8238 36.021 77.611 107.301 1.00 0.00 O ATOM 42630 H1 WAT 8238 36.442 77.401 106.467 1.00 0.00 H ATOM 42631 H2 WAT 8238 35.096 77.413 107.158 1.00 0.00 H TER 42633 WAT 8238 ATOM 42633 O WAT 8239 15.217 141.618 134.971 1.00 0.00 O ATOM 42634 H1 WAT 8239 14.302 141.895 135.007 1.00 0.00 H ATOM 42635 H2 WAT 8239 15.715 142.435 134.965 1.00 0.00 H TER 42637 WAT 8239 ATOM 42637 O WAT 8240 137.548 86.062 20.520 1.00 0.00 O ATOM 42638 H1 WAT 8240 138.000 86.781 20.962 1.00 0.00 H ATOM 42639 H2 WAT 8240 138.234 85.617 20.022 1.00 0.00 H TER 42641 WAT 8240 ATOM 42641 O WAT 8241 56.687 12.671 102.738 1.00 0.00 O ATOM 42642 H1 WAT 8241 55.993 12.012 102.726 1.00 0.00 H ATOM 42643 H2 WAT 8241 56.883 12.795 103.667 1.00 0.00 H TER 42645 WAT 8241 ATOM 42645 O WAT 8242 10.784 52.393 156.173 1.00 0.00 O ATOM 42646 H1 WAT 8242 10.736 51.437 156.199 1.00 0.00 H ATOM 42647 H2 WAT 8242 11.623 52.602 156.584 1.00 0.00 H TER 42649 WAT 8242 ATOM 42649 O WAT 8243 49.810 104.699 147.965 1.00 0.00 O ATOM 42650 H1 WAT 8243 49.140 104.389 147.356 1.00 0.00 H ATOM 42651 H2 WAT 8243 49.793 104.067 148.683 1.00 0.00 H TER 42653 WAT 8243 ATOM 42653 O WAT 8244 38.189 130.759 124.703 1.00 0.00 O ATOM 42654 H1 WAT 8244 37.466 131.351 124.912 1.00 0.00 H ATOM 42655 H2 WAT 8244 37.783 130.054 124.199 1.00 0.00 H TER 42657 WAT 8244 ATOM 42657 O WAT 8245 105.660 79.620 146.994 1.00 0.00 O ATOM 42658 H1 WAT 8245 105.682 78.814 146.478 1.00 0.00 H ATOM 42659 H2 WAT 8245 104.790 79.984 146.833 1.00 0.00 H TER 42661 WAT 8245 ATOM 42661 O WAT 8246 51.567 64.316 153.662 1.00 0.00 O ATOM 42662 H1 WAT 8246 50.799 64.172 153.110 1.00 0.00 H ATOM 42663 H2 WAT 8246 51.286 64.973 154.298 1.00 0.00 H TER 42665 WAT 8246 ATOM 42665 O WAT 8247 67.991 124.638 118.700 1.00 0.00 O ATOM 42666 H1 WAT 8247 67.549 124.218 117.963 1.00 0.00 H ATOM 42667 H2 WAT 8247 68.689 125.156 118.298 1.00 0.00 H TER 42669 WAT 8247 ATOM 42669 O WAT 8248 43.292 100.936 15.621 1.00 0.00 O ATOM 42670 H1 WAT 8248 44.176 101.150 15.917 1.00 0.00 H ATOM 42671 H2 WAT 8248 43.296 101.143 14.686 1.00 0.00 H TER 42673 WAT 8248 ATOM 42673 O WAT 8249 62.190 61.480 127.480 1.00 0.00 O ATOM 42674 H1 WAT 8249 62.801 61.884 126.863 1.00 0.00 H ATOM 42675 H2 WAT 8249 62.522 61.728 128.343 1.00 0.00 H TER 42677 WAT 8249 ATOM 42677 O WAT 8250 80.202 52.985 129.516 1.00 0.00 O ATOM 42678 H1 WAT 8250 80.041 52.479 130.312 1.00 0.00 H ATOM 42679 H2 WAT 8250 80.132 52.345 128.807 1.00 0.00 H TER 42681 WAT 8250 ATOM 42681 O WAT 8251 48.734 9.521 126.727 1.00 0.00 O ATOM 42682 H1 WAT 8251 49.309 9.986 126.120 1.00 0.00 H ATOM 42683 H2 WAT 8251 48.854 8.596 126.510 1.00 0.00 H TER 42685 WAT 8251 ATOM 42685 O WAT 8252 97.837 50.929 18.591 1.00 0.00 O ATOM 42686 H1 WAT 8252 97.684 50.042 18.919 1.00 0.00 H ATOM 42687 H2 WAT 8252 98.653 51.202 19.010 1.00 0.00 H TER 42689 WAT 8252 ATOM 42689 O WAT 8253 46.873 129.136 15.447 1.00 0.00 O ATOM 42690 H1 WAT 8253 46.360 128.530 14.914 1.00 0.00 H ATOM 42691 H2 WAT 8253 47.076 129.862 14.856 1.00 0.00 H TER 42693 WAT 8253 ATOM 42693 O WAT 8254 2.945 84.762 114.583 1.00 0.00 O ATOM 42694 H1 WAT 8254 2.515 84.138 115.167 1.00 0.00 H ATOM 42695 H2 WAT 8254 2.228 85.274 114.209 1.00 0.00 H TER 42697 WAT 8254 ATOM 42697 O WAT 8255 111.979 41.847 152.078 1.00 0.00 O ATOM 42698 H1 WAT 8255 112.566 41.647 152.807 1.00 0.00 H ATOM 42699 H2 WAT 8255 111.487 42.614 152.371 1.00 0.00 H TER 42701 WAT 8255 ATOM 42701 O WAT 8256 117.077 144.651 17.218 1.00 0.00 O ATOM 42702 H1 WAT 8256 117.569 144.897 18.002 1.00 0.00 H ATOM 42703 H2 WAT 8256 116.161 144.668 17.495 1.00 0.00 H TER 42705 WAT 8256 ATOM 42705 O WAT 8257 91.730 12.226 78.353 1.00 0.00 O ATOM 42706 H1 WAT 8257 91.992 13.126 78.548 1.00 0.00 H ATOM 42707 H2 WAT 8257 90.880 12.126 78.780 1.00 0.00 H TER 42709 WAT 8257 ATOM 42709 O WAT 8258 125.752 111.800 126.103 1.00 0.00 O ATOM 42710 H1 WAT 8258 126.520 111.995 126.640 1.00 0.00 H ATOM 42711 H2 WAT 8258 125.007 112.015 126.664 1.00 0.00 H TER 42713 WAT 8258 ATOM 42713 O WAT 8259 129.026 129.377 1.680 1.00 0.00 O ATOM 42714 H1 WAT 8259 128.497 128.601 1.867 1.00 0.00 H ATOM 42715 H2 WAT 8259 128.567 129.813 0.962 1.00 0.00 H TER 42717 WAT 8259 ATOM 42717 O WAT 8260 1.582 125.868 4.712 1.00 0.00 O ATOM 42718 H1 WAT 8260 1.900 126.666 5.133 1.00 0.00 H ATOM 42719 H2 WAT 8260 2.348 125.511 4.263 1.00 0.00 H TER 42721 WAT 8260 ATOM 42721 O WAT 8261 32.038 42.659 150.442 1.00 0.00 O ATOM 42722 H1 WAT 8261 31.203 43.039 150.718 1.00 0.00 H ATOM 42723 H2 WAT 8261 32.039 42.749 149.489 1.00 0.00 H TER 42725 WAT 8261 ATOM 42725 O WAT 8262 15.636 45.844 18.618 1.00 0.00 O ATOM 42726 H1 WAT 8262 14.789 45.709 18.192 1.00 0.00 H ATOM 42727 H2 WAT 8262 16.063 44.988 18.576 1.00 0.00 H TER 42729 WAT 8262 ATOM 42729 O WAT 8263 34.633 48.999 109.458 1.00 0.00 O ATOM 42730 H1 WAT 8263 34.168 49.805 109.235 1.00 0.00 H ATOM 42731 H2 WAT 8263 35.549 49.265 109.534 1.00 0.00 H TER 42733 WAT 8263 ATOM 42733 O WAT 8264 82.365 20.250 78.526 1.00 0.00 O ATOM 42734 H1 WAT 8264 81.917 19.720 77.867 1.00 0.00 H ATOM 42735 H2 WAT 8264 81.714 20.899 78.794 1.00 0.00 H TER 42737 WAT 8264 ATOM 42737 O WAT 8265 26.436 79.131 59.174 1.00 0.00 O ATOM 42738 H1 WAT 8265 26.130 79.957 58.801 1.00 0.00 H ATOM 42739 H2 WAT 8265 25.639 78.620 59.314 1.00 0.00 H TER 42741 WAT 8265 ATOM 42741 O WAT 8266 11.998 126.636 69.294 1.00 0.00 O ATOM 42742 H1 WAT 8266 12.019 126.083 70.075 1.00 0.00 H ATOM 42743 H2 WAT 8266 11.803 126.032 68.578 1.00 0.00 H TER 42745 WAT 8266 ATOM 42745 O WAT 8267 80.813 114.284 158.132 1.00 0.00 O ATOM 42746 H1 WAT 8267 80.327 114.882 158.700 1.00 0.00 H ATOM 42747 H2 WAT 8267 81.610 114.763 157.904 1.00 0.00 H TER 42749 WAT 8267 ATOM 42749 O WAT 8268 119.214 42.900 157.870 1.00 0.00 O ATOM 42750 H1 WAT 8268 118.917 42.911 156.960 1.00 0.00 H ATOM 42751 H2 WAT 8268 118.449 43.175 158.375 1.00 0.00 H TER 42753 WAT 8268 ATOM 42753 O WAT 8269 36.770 21.075 144.039 1.00 0.00 O ATOM 42754 H1 WAT 8269 36.585 21.885 143.563 1.00 0.00 H ATOM 42755 H2 WAT 8269 37.555 21.272 144.550 1.00 0.00 H TER 42757 WAT 8269 ATOM 42757 O WAT 8270 104.547 102.473 119.790 1.00 0.00 O ATOM 42758 H1 WAT 8270 104.274 102.384 118.877 1.00 0.00 H ATOM 42759 H2 WAT 8270 105.446 102.145 119.804 1.00 0.00 H TER 42761 WAT 8270 ATOM 42761 O WAT 8271 63.812 43.208 99.581 1.00 0.00 O ATOM 42762 H1 WAT 8271 63.744 42.311 99.906 1.00 0.00 H ATOM 42763 H2 WAT 8271 64.384 43.142 98.816 1.00 0.00 H TER 42765 WAT 8271 ATOM 42765 O WAT 8272 2.751 105.058 119.119 1.00 0.00 O ATOM 42766 H1 WAT 8272 2.045 104.626 118.639 1.00 0.00 H ATOM 42767 H2 WAT 8272 3.427 104.385 119.207 1.00 0.00 H TER 42769 WAT 8272 ATOM 42769 O WAT 8273 41.922 50.488 108.262 1.00 0.00 O ATOM 42770 H1 WAT 8273 41.154 49.989 107.983 1.00 0.00 H ATOM 42771 H2 WAT 8273 41.690 51.400 108.090 1.00 0.00 H TER 42773 WAT 8273 ATOM 42773 O WAT 8274 96.965 1.578 86.704 1.00 0.00 O ATOM 42774 H1 WAT 8274 96.283 2.216 86.492 1.00 0.00 H ATOM 42775 H2 WAT 8274 97.202 1.192 85.861 1.00 0.00 H TER 42777 WAT 8274 ATOM 42777 O WAT 8275 23.389 48.170 143.046 1.00 0.00 O ATOM 42778 H1 WAT 8275 23.575 48.098 142.109 1.00 0.00 H ATOM 42779 H2 WAT 8275 23.630 49.069 143.269 1.00 0.00 H TER 42781 WAT 8275 ATOM 42781 O WAT 8276 44.428 17.504 6.740 1.00 0.00 O ATOM 42782 H1 WAT 8276 44.185 18.349 7.118 1.00 0.00 H ATOM 42783 H2 WAT 8276 43.869 16.870 7.188 1.00 0.00 H TER 42785 WAT 8276 ATOM 42785 O WAT 8277 39.226 53.378 1.892 1.00 0.00 O ATOM 42786 H1 WAT 8277 39.781 53.162 2.641 1.00 0.00 H ATOM 42787 H2 WAT 8277 38.451 53.786 2.279 1.00 0.00 H TER 42789 WAT 8277 ATOM 42789 O WAT 8278 54.511 14.375 95.663 1.00 0.00 O ATOM 42790 H1 WAT 8278 55.065 15.153 95.735 1.00 0.00 H ATOM 42791 H2 WAT 8278 54.266 14.341 94.738 1.00 0.00 H TER 42793 WAT 8278 ATOM 42793 O WAT 8279 93.348 137.639 89.797 1.00 0.00 O ATOM 42794 H1 WAT 8279 93.946 137.509 89.061 1.00 0.00 H ATOM 42795 H2 WAT 8279 93.537 136.912 90.391 1.00 0.00 H TER 42797 WAT 8279 ATOM 42797 O WAT 8280 109.648 120.808 67.756 1.00 0.00 O ATOM 42798 H1 WAT 8280 108.865 120.320 67.501 1.00 0.00 H ATOM 42799 H2 WAT 8280 109.604 120.850 68.711 1.00 0.00 H TER 42801 WAT 8280 ATOM 42801 O WAT 8281 45.583 64.149 106.108 1.00 0.00 O ATOM 42802 H1 WAT 8281 45.134 64.332 105.283 1.00 0.00 H ATOM 42803 H2 WAT 8281 46.117 63.377 105.924 1.00 0.00 H TER 42805 WAT 8281 ATOM 42805 O WAT 8282 42.901 2.016 5.693 1.00 0.00 O ATOM 42806 H1 WAT 8282 42.321 1.487 5.145 1.00 0.00 H ATOM 42807 H2 WAT 8282 42.574 1.887 6.583 1.00 0.00 H TER 42809 WAT 8282 ATOM 42809 O WAT 8283 30.931 20.687 152.154 1.00 0.00 O ATOM 42810 H1 WAT 8283 30.367 20.132 151.616 1.00 0.00 H ATOM 42811 H2 WAT 8283 31.764 20.710 151.681 1.00 0.00 H TER 42813 WAT 8283 ATOM 42813 O WAT 8284 141.489 31.220 152.430 1.00 0.00 O ATOM 42814 H1 WAT 8284 142.144 31.917 152.382 1.00 0.00 H ATOM 42815 H2 WAT 8284 140.773 31.598 152.940 1.00 0.00 H TER 42817 WAT 8284 ATOM 42817 O WAT 8285 75.724 7.395 27.460 1.00 0.00 O ATOM 42818 H1 WAT 8285 76.667 7.469 27.312 1.00 0.00 H ATOM 42819 H2 WAT 8285 75.342 8.085 26.918 1.00 0.00 H TER 42821 WAT 8285 ATOM 42821 O WAT 8286 69.862 83.503 134.502 1.00 0.00 O ATOM 42822 H1 WAT 8286 68.925 83.328 134.409 1.00 0.00 H ATOM 42823 H2 WAT 8286 70.173 82.826 135.104 1.00 0.00 H TER 42825 WAT 8286 ATOM 42825 O WAT 8287 56.347 62.142 137.061 1.00 0.00 O ATOM 42826 H1 WAT 8287 55.816 61.494 137.525 1.00 0.00 H ATOM 42827 H2 WAT 8287 56.069 62.069 136.147 1.00 0.00 H TER 42829 WAT 8287 ATOM 42829 O WAT 8288 36.341 76.608 66.926 1.00 0.00 O ATOM 42830 H1 WAT 8288 36.442 76.782 67.862 1.00 0.00 H ATOM 42831 H2 WAT 8288 35.395 76.553 66.793 1.00 0.00 H TER 42833 WAT 8288 ATOM 42833 O WAT 8289 135.334 27.204 120.243 1.00 0.00 O ATOM 42834 H1 WAT 8289 134.803 27.102 121.034 1.00 0.00 H ATOM 42835 H2 WAT 8289 135.941 27.914 120.453 1.00 0.00 H TER 42837 WAT 8289 ATOM 42837 O WAT 8290 135.866 40.974 12.953 1.00 0.00 O ATOM 42838 H1 WAT 8290 136.273 41.554 12.309 1.00 0.00 H ATOM 42839 H2 WAT 8290 136.411 41.065 13.735 1.00 0.00 H TER 42841 WAT 8290 ATOM 42841 O WAT 8291 2.273 16.191 146.163 1.00 0.00 O ATOM 42842 H1 WAT 8291 1.976 15.697 145.399 1.00 0.00 H ATOM 42843 H2 WAT 8291 2.607 15.525 146.764 1.00 0.00 H TER 42845 WAT 8291 ATOM 42845 O WAT 8292 128.860 124.938 1.048 1.00 0.00 O ATOM 42846 H1 WAT 8292 128.157 125.433 0.628 1.00 0.00 H ATOM 42847 H2 WAT 8292 129.412 125.606 1.456 1.00 0.00 H TER 42849 WAT 8292 ATOM 42849 O WAT 8293 65.521 79.589 137.155 1.00 0.00 O ATOM 42850 H1 WAT 8293 64.597 79.635 136.908 1.00 0.00 H ATOM 42851 H2 WAT 8293 65.628 80.279 137.810 1.00 0.00 H TER 42853 WAT 8293 ATOM 42853 O WAT 8294 71.629 135.761 74.008 1.00 0.00 O ATOM 42854 H1 WAT 8294 72.194 135.634 74.770 1.00 0.00 H ATOM 42855 H2 WAT 8294 72.235 135.843 73.272 1.00 0.00 H TER 42857 WAT 8294 ATOM 42857 O WAT 8295 39.567 14.271 130.936 1.00 0.00 O ATOM 42858 H1 WAT 8295 38.660 14.471 131.167 1.00 0.00 H ATOM 42859 H2 WAT 8295 39.518 13.934 130.042 1.00 0.00 H TER 42861 WAT 8295 ATOM 42861 O WAT 8296 68.438 141.811 90.594 1.00 0.00 O ATOM 42862 H1 WAT 8296 68.850 142.638 90.845 1.00 0.00 H ATOM 42863 H2 WAT 8296 68.396 141.308 91.407 1.00 0.00 H TER 42865 WAT 8296 ATOM 42865 O WAT 8297 43.456 49.119 82.162 1.00 0.00 O ATOM 42866 H1 WAT 8297 42.744 48.628 82.572 1.00 0.00 H ATOM 42867 H2 WAT 8297 43.454 48.828 81.250 1.00 0.00 H TER 42869 WAT 8297 ATOM 42869 O WAT 8298 102.745 16.291 135.481 1.00 0.00 O ATOM 42870 H1 WAT 8298 102.527 15.894 134.638 1.00 0.00 H ATOM 42871 H2 WAT 8298 103.636 16.621 135.367 1.00 0.00 H TER 42873 WAT 8298 ATOM 42873 O WAT 8299 5.201 127.705 152.663 1.00 0.00 O ATOM 42874 H1 WAT 8299 4.462 128.179 153.044 1.00 0.00 H ATOM 42875 H2 WAT 8299 5.541 127.173 153.382 1.00 0.00 H TER 42877 WAT 8299 ATOM 42877 O WAT 8300 45.626 46.949 114.715 1.00 0.00 O ATOM 42878 H1 WAT 8300 46.426 46.933 114.190 1.00 0.00 H ATOM 42879 H2 WAT 8300 45.062 46.289 114.313 1.00 0.00 H TER 42881 WAT 8300 ATOM 42881 O WAT 8301 41.542 72.779 105.004 1.00 0.00 O ATOM 42882 H1 WAT 8301 41.625 71.944 104.544 1.00 0.00 H ATOM 42883 H2 WAT 8301 42.241 72.762 105.658 1.00 0.00 H TER 42885 WAT 8301 ATOM 42885 O WAT 8302 50.720 49.873 15.818 1.00 0.00 O ATOM 42886 H1 WAT 8302 50.112 50.359 15.261 1.00 0.00 H ATOM 42887 H2 WAT 8302 50.253 49.067 16.036 1.00 0.00 H TER 42889 WAT 8302 ATOM 42889 O WAT 8303 125.092 109.442 114.961 1.00 0.00 O ATOM 42890 H1 WAT 8303 124.298 109.655 114.470 1.00 0.00 H ATOM 42891 H2 WAT 8303 125.281 108.533 114.727 1.00 0.00 H TER 42893 WAT 8303 ATOM 42893 O WAT 8304 130.755 88.685 157.814 1.00 0.00 O ATOM 42894 H1 WAT 8304 130.146 88.684 157.075 1.00 0.00 H ATOM 42895 H2 WAT 8304 131.093 89.580 157.844 1.00 0.00 H TER 42897 WAT 8304 ATOM 42897 O WAT 8305 124.282 73.807 92.104 1.00 0.00 O ATOM 42898 H1 WAT 8305 124.263 73.603 91.169 1.00 0.00 H ATOM 42899 H2 WAT 8305 123.731 74.585 92.191 1.00 0.00 H TER 42901 WAT 8305 ATOM 42901 O WAT 8306 61.592 131.826 104.460 1.00 0.00 O ATOM 42902 H1 WAT 8306 61.215 132.698 104.577 1.00 0.00 H ATOM 42903 H2 WAT 8306 61.843 131.797 103.536 1.00 0.00 H TER 42905 WAT 8306 ATOM 42905 O WAT 8307 44.066 5.552 78.248 1.00 0.00 O ATOM 42906 H1 WAT 8307 44.448 5.754 77.393 1.00 0.00 H ATOM 42907 H2 WAT 8307 44.748 5.789 78.876 1.00 0.00 H TER 42909 WAT 8307 ATOM 42909 O WAT 8308 61.787 87.492 144.600 1.00 0.00 O ATOM 42910 H1 WAT 8308 61.283 87.081 145.302 1.00 0.00 H ATOM 42911 H2 WAT 8308 62.371 88.103 145.050 1.00 0.00 H TER 42913 WAT 8308 ATOM 42913 O WAT 8309 26.461 51.345 114.682 1.00 0.00 O ATOM 42914 H1 WAT 8309 26.726 52.211 114.374 1.00 0.00 H ATOM 42915 H2 WAT 8309 27.274 50.937 114.979 1.00 0.00 H TER 42917 WAT 8309 ATOM 42917 O WAT 8310 63.490 14.362 53.836 1.00 0.00 O ATOM 42918 H1 WAT 8310 63.305 13.450 54.060 1.00 0.00 H ATOM 42919 H2 WAT 8310 63.440 14.388 52.881 1.00 0.00 H TER 42921 WAT 8310 ATOM 42921 O WAT 8311 67.721 25.366 70.823 1.00 0.00 O ATOM 42922 H1 WAT 8311 67.561 24.839 70.040 1.00 0.00 H ATOM 42923 H2 WAT 8311 66.911 25.861 70.948 1.00 0.00 H TER 42925 WAT 8311 ATOM 42925 O WAT 8312 3.416 58.390 78.052 1.00 0.00 O ATOM 42926 H1 WAT 8312 2.979 57.695 77.561 1.00 0.00 H ATOM 42927 H2 WAT 8312 3.020 59.199 77.728 1.00 0.00 H TER 42929 WAT 8312 ATOM 42929 O WAT 8313 2.259 42.423 76.948 1.00 0.00 O ATOM 42930 H1 WAT 8313 1.759 42.471 77.763 1.00 0.00 H ATOM 42931 H2 WAT 8313 2.015 41.580 76.567 1.00 0.00 H TER 42933 WAT 8313 ATOM 42933 O WAT 8314 106.681 36.677 152.178 1.00 0.00 O ATOM 42934 H1 WAT 8314 106.332 35.850 152.510 1.00 0.00 H ATOM 42935 H2 WAT 8314 106.315 37.342 152.762 1.00 0.00 H TER 42937 WAT 8314 ATOM 42937 O WAT 8315 66.698 16.407 138.396 1.00 0.00 O ATOM 42938 H1 WAT 8315 66.464 15.755 137.736 1.00 0.00 H ATOM 42939 H2 WAT 8315 66.241 16.122 139.187 1.00 0.00 H TER 42941 WAT 8315 ATOM 42941 O WAT 8316 123.610 24.135 118.258 1.00 0.00 O ATOM 42942 H1 WAT 8316 123.703 23.727 117.396 1.00 0.00 H ATOM 42943 H2 WAT 8316 123.329 23.422 118.831 1.00 0.00 H TER 42945 WAT 8316 ATOM 42945 O WAT 8317 97.497 44.144 147.411 1.00 0.00 O ATOM 42946 H1 WAT 8317 96.667 44.072 147.883 1.00 0.00 H ATOM 42947 H2 WAT 8317 98.113 43.628 147.931 1.00 0.00 H TER 42949 WAT 8317 ATOM 42949 O WAT 8318 125.694 86.819 112.742 1.00 0.00 O ATOM 42950 H1 WAT 8318 126.309 86.799 113.475 1.00 0.00 H ATOM 42951 H2 WAT 8318 125.287 85.952 112.746 1.00 0.00 H TER 42953 WAT 8318 ATOM 42953 O WAT 8319 109.016 123.949 149.555 1.00 0.00 O ATOM 42954 H1 WAT 8319 109.911 123.687 149.341 1.00 0.00 H ATOM 42955 H2 WAT 8319 109.119 124.688 150.154 1.00 0.00 H TER 42957 WAT 8319 ATOM 42957 O WAT 8320 129.852 145.399 153.817 1.00 0.00 O ATOM 42958 H1 WAT 8320 130.680 145.873 153.889 1.00 0.00 H ATOM 42959 H2 WAT 8320 129.181 146.072 153.932 1.00 0.00 H TER 42961 WAT 8320 ATOM 42961 O WAT 8321 51.460 91.594 69.469 1.00 0.00 O ATOM 42962 H1 WAT 8321 50.846 91.940 68.821 1.00 0.00 H ATOM 42963 H2 WAT 8321 52.072 92.313 69.625 1.00 0.00 H TER 42965 WAT 8321 ATOM 42965 O WAT 8322 0.819 52.918 118.482 1.00 0.00 O ATOM 42966 H1 WAT 8322 1.387 52.529 119.148 1.00 0.00 H ATOM 42967 H2 WAT 8322 0.271 52.193 118.182 1.00 0.00 H TER 42969 WAT 8322 ATOM 42969 O WAT 8323 130.881 18.302 14.194 1.00 0.00 O ATOM 42970 H1 WAT 8323 130.742 17.554 14.776 1.00 0.00 H ATOM 42971 H2 WAT 8323 131.763 18.173 13.845 1.00 0.00 H TER 42973 WAT 8323 ATOM 42973 O WAT 8324 144.941 19.511 144.910 1.00 0.00 O ATOM 42974 H1 WAT 8324 144.368 18.764 145.088 1.00 0.00 H ATOM 42975 H2 WAT 8324 145.597 19.480 145.607 1.00 0.00 H TER 42977 WAT 8324 ATOM 42977 O WAT 8325 119.297 26.141 150.885 1.00 0.00 O ATOM 42978 H1 WAT 8325 118.594 25.646 150.465 1.00 0.00 H ATOM 42979 H2 WAT 8325 118.967 27.039 150.925 1.00 0.00 H TER 42981 WAT 8325 ATOM 42981 O WAT 8326 41.473 32.855 144.338 1.00 0.00 O ATOM 42982 H1 WAT 8326 41.322 33.296 143.502 1.00 0.00 H ATOM 42983 H2 WAT 8326 40.652 32.964 144.818 1.00 0.00 H TER 42985 WAT 8326 ATOM 42985 O WAT 8327 113.687 101.046 129.292 1.00 0.00 O ATOM 42986 H1 WAT 8327 113.038 101.720 129.495 1.00 0.00 H ATOM 42987 H2 WAT 8327 114.174 100.929 130.108 1.00 0.00 H TER 42989 WAT 8327 ATOM 42989 O WAT 8328 16.489 57.663 131.985 1.00 0.00 O ATOM 42990 H1 WAT 8328 16.255 58.298 132.661 1.00 0.00 H ATOM 42991 H2 WAT 8328 16.831 58.194 131.265 1.00 0.00 H TER 42993 WAT 8328 ATOM 42993 O WAT 8329 67.754 42.098 125.451 1.00 0.00 O ATOM 42994 H1 WAT 8329 68.294 42.876 125.310 1.00 0.00 H ATOM 42995 H2 WAT 8329 68.341 41.364 125.269 1.00 0.00 H TER 42997 WAT 8329 ATOM 42997 O WAT 8330 98.907 119.669 128.139 1.00 0.00 O ATOM 42998 H1 WAT 8330 99.527 119.414 127.456 1.00 0.00 H ATOM 42999 H2 WAT 8330 99.427 120.188 128.753 1.00 0.00 H TER 43001 WAT 8330 ATOM 43001 O WAT 8331 107.096 114.798 83.309 1.00 0.00 O ATOM 43002 H1 WAT 8331 107.982 115.035 83.586 1.00 0.00 H ATOM 43003 H2 WAT 8331 106.721 115.615 82.982 1.00 0.00 H TER 43005 WAT 8331 ATOM 43005 O WAT 8332 26.886 129.333 135.283 1.00 0.00 O ATOM 43006 H1 WAT 8332 27.298 129.802 134.558 1.00 0.00 H ATOM 43007 H2 WAT 8332 25.972 129.237 135.018 1.00 0.00 H TER 43009 WAT 8332 ATOM 43009 O WAT 8333 19.362 95.730 136.658 1.00 0.00 O ATOM 43010 H1 WAT 8333 19.687 94.839 136.529 1.00 0.00 H ATOM 43011 H2 WAT 8333 18.848 95.684 137.464 1.00 0.00 H TER 43013 WAT 8333 ATOM 43013 O WAT 8334 6.100 57.218 120.156 1.00 0.00 O ATOM 43014 H1 WAT 8334 5.506 57.504 120.850 1.00 0.00 H ATOM 43015 H2 WAT 8334 6.712 56.627 120.593 1.00 0.00 H TER 43017 WAT 8334 ATOM 43017 O WAT 8335 69.842 138.568 139.467 1.00 0.00 O ATOM 43018 H1 WAT 8335 69.334 139.266 139.054 1.00 0.00 H ATOM 43019 H2 WAT 8335 69.322 138.311 140.229 1.00 0.00 H TER 43021 WAT 8335 ATOM 43021 O WAT 8336 91.903 96.933 150.543 1.00 0.00 O ATOM 43022 H1 WAT 8336 92.799 96.596 150.512 1.00 0.00 H ATOM 43023 H2 WAT 8336 91.564 96.791 149.659 1.00 0.00 H TER 43025 WAT 8336 ATOM 43025 O WAT 8337 9.730 80.110 91.391 1.00 0.00 O ATOM 43026 H1 WAT 8337 9.287 80.074 90.543 1.00 0.00 H ATOM 43027 H2 WAT 8337 9.117 79.696 91.998 1.00 0.00 H TER 43029 WAT 8337 ATOM 43029 O WAT 8338 115.322 93.689 118.809 1.00 0.00 O ATOM 43030 H1 WAT 8338 116.223 93.461 119.038 1.00 0.00 H ATOM 43031 H2 WAT 8338 114.932 92.865 118.519 1.00 0.00 H TER 43033 WAT 8338 ATOM 43033 O WAT 8339 62.266 7.237 152.386 1.00 0.00 O ATOM 43034 H1 WAT 8339 61.966 7.325 151.481 1.00 0.00 H ATOM 43035 H2 WAT 8339 62.683 8.076 152.582 1.00 0.00 H TER 43037 WAT 8339 ATOM 43037 O WAT 8340 54.772 74.919 4.627 1.00 0.00 O ATOM 43038 H1 WAT 8340 54.284 75.281 3.887 1.00 0.00 H ATOM 43039 H2 WAT 8340 54.339 75.281 5.400 1.00 0.00 H TER 43041 WAT 8340 ATOM 43041 O WAT 8341 46.068 83.559 132.272 1.00 0.00 O ATOM 43042 H1 WAT 8341 46.584 84.285 132.623 1.00 0.00 H ATOM 43043 H2 WAT 8341 46.611 83.195 131.573 1.00 0.00 H TER 43045 WAT 8341 ATOM 43045 O WAT 8342 102.112 75.242 14.733 1.00 0.00 O ATOM 43046 H1 WAT 8342 102.951 75.499 15.117 1.00 0.00 H ATOM 43047 H2 WAT 8342 101.606 76.054 14.698 1.00 0.00 H TER 43049 WAT 8342 ATOM 43049 O WAT 8343 74.990 125.766 60.305 1.00 0.00 O ATOM 43050 H1 WAT 8343 74.735 125.294 59.513 1.00 0.00 H ATOM 43051 H2 WAT 8343 74.262 125.627 60.912 1.00 0.00 H TER 43053 WAT 8343 ATOM 43053 O WAT 8344 66.000 52.126 76.568 1.00 0.00 O ATOM 43054 H1 WAT 8344 66.770 51.592 76.762 1.00 0.00 H ATOM 43055 H2 WAT 8344 65.301 51.491 76.409 1.00 0.00 H TER 43057 WAT 8344 ATOM 43057 O WAT 8345 55.577 37.868 108.113 1.00 0.00 O ATOM 43058 H1 WAT 8345 55.486 38.417 107.333 1.00 0.00 H ATOM 43059 H2 WAT 8345 56.283 38.277 108.612 1.00 0.00 H TER 43061 WAT 8345 ATOM 43061 O WAT 8346 13.296 50.125 96.583 1.00 0.00 O ATOM 43062 H1 WAT 8346 14.021 49.619 96.218 1.00 0.00 H ATOM 43063 H2 WAT 8346 13.318 49.934 97.520 1.00 0.00 H TER 43065 WAT 8346 ATOM 43065 O WAT 8347 44.403 97.254 144.003 1.00 0.00 O ATOM 43066 H1 WAT 8347 44.918 96.665 143.452 1.00 0.00 H ATOM 43067 H2 WAT 8347 43.497 96.974 143.871 1.00 0.00 H TER 43069 WAT 8347 ATOM 43069 O WAT 8348 125.627 9.591 19.113 1.00 0.00 O ATOM 43070 H1 WAT 8348 124.851 9.100 19.384 1.00 0.00 H ATOM 43071 H2 WAT 8348 125.867 10.104 19.885 1.00 0.00 H TER 43073 WAT 8348 ATOM 43073 O WAT 8349 34.706 50.323 93.703 1.00 0.00 O ATOM 43074 H1 WAT 8349 34.538 51.020 93.068 1.00 0.00 H ATOM 43075 H2 WAT 8349 33.937 49.757 93.646 1.00 0.00 H TER 43077 WAT 8349 ATOM 43077 O WAT 8350 85.319 6.675 102.430 1.00 0.00 O ATOM 43078 H1 WAT 8350 84.921 5.830 102.221 1.00 0.00 H ATOM 43079 H2 WAT 8350 85.863 6.878 101.669 1.00 0.00 H TER 43081 WAT 8350 ATOM 43081 O WAT 8351 88.362 74.125 20.144 1.00 0.00 O ATOM 43082 H1 WAT 8351 87.749 74.858 20.086 1.00 0.00 H ATOM 43083 H2 WAT 8351 88.981 74.274 19.429 1.00 0.00 H TER 43085 WAT 8351 ATOM 43085 O WAT 8352 55.809 54.429 5.994 1.00 0.00 O ATOM 43086 H1 WAT 8352 56.327 53.741 6.411 1.00 0.00 H ATOM 43087 H2 WAT 8352 56.354 54.734 5.269 1.00 0.00 H TER 43089 WAT 8352 ATOM 43089 O WAT 8353 101.859 75.105 141.181 1.00 0.00 O ATOM 43090 H1 WAT 8353 101.485 75.721 140.551 1.00 0.00 H ATOM 43091 H2 WAT 8353 101.953 74.288 140.692 1.00 0.00 H TER 43093 WAT 8353 ATOM 43093 O WAT 8354 99.155 9.206 69.696 1.00 0.00 O ATOM 43094 H1 WAT 8354 98.598 9.765 69.154 1.00 0.00 H ATOM 43095 H2 WAT 8354 99.021 9.528 70.587 1.00 0.00 H TER 43097 WAT 8354 ATOM 43097 O WAT 8355 143.885 63.179 20.254 1.00 0.00 O ATOM 43098 H1 WAT 8355 143.313 62.506 20.622 1.00 0.00 H ATOM 43099 H2 WAT 8355 143.435 63.469 19.461 1.00 0.00 H TER 43101 WAT 8355 ATOM 43101 O WAT 8356 109.207 68.563 154.998 1.00 0.00 O ATOM 43102 H1 WAT 8356 109.836 68.751 154.302 1.00 0.00 H ATOM 43103 H2 WAT 8356 109.700 68.037 155.629 1.00 0.00 H TER 43105 WAT 8356 ATOM 43105 O WAT 8357 128.599 72.120 73.897 1.00 0.00 O ATOM 43106 H1 WAT 8357 128.920 71.964 73.009 1.00 0.00 H ATOM 43107 H2 WAT 8357 129.391 72.197 74.429 1.00 0.00 H TER 43109 WAT 8357 ATOM 43109 O WAT 8358 114.448 84.068 24.421 1.00 0.00 O ATOM 43110 H1 WAT 8358 113.561 84.422 24.357 1.00 0.00 H ATOM 43111 H2 WAT 8358 114.358 83.298 24.982 1.00 0.00 H TER 43113 WAT 8358 ATOM 43113 O WAT 8359 47.461 127.079 -0.053 1.00 0.00 O ATOM 43114 H1 WAT 8359 47.642 127.638 0.703 1.00 0.00 H ATOM 43115 H2 WAT 8359 48.320 126.921 -0.445 1.00 0.00 H TER 43117 WAT 8359 ATOM 43117 O WAT 8360 72.435 0.490 141.048 1.00 0.00 O ATOM 43118 H1 WAT 8360 72.301 1.312 141.520 1.00 0.00 H ATOM 43119 H2 WAT 8360 72.846 -0.090 141.689 1.00 0.00 H TER 43121 WAT 8360 ATOM 43121 O WAT 8361 140.616 42.870 125.838 1.00 0.00 O ATOM 43122 H1 WAT 8361 141.330 43.144 126.414 1.00 0.00 H ATOM 43123 H2 WAT 8361 139.876 42.723 126.428 1.00 0.00 H TER 43125 WAT 8361 ATOM 43125 O WAT 8362 16.780 55.696 120.623 1.00 0.00 O ATOM 43126 H1 WAT 8362 16.082 56.236 120.252 1.00 0.00 H ATOM 43127 H2 WAT 8362 16.339 55.149 121.273 1.00 0.00 H TER 43129 WAT 8362 ATOM 43129 O WAT 8363 63.913 34.625 116.872 1.00 0.00 O ATOM 43130 H1 WAT 8363 63.539 35.104 117.611 1.00 0.00 H ATOM 43131 H2 WAT 8363 64.853 34.793 116.928 1.00 0.00 H TER 43133 WAT 8363 ATOM 43133 O WAT 8364 39.309 52.870 83.917 1.00 0.00 O ATOM 43134 H1 WAT 8364 40.261 52.791 83.863 1.00 0.00 H ATOM 43135 H2 WAT 8364 38.983 51.995 83.704 1.00 0.00 H TER 43137 WAT 8364 ATOM 43137 O WAT 8365 117.421 119.898 136.312 1.00 0.00 O ATOM 43138 H1 WAT 8365 118.078 119.996 137.001 1.00 0.00 H ATOM 43139 H2 WAT 8365 116.608 119.710 136.781 1.00 0.00 H TER 43141 WAT 8365 ATOM 43141 O WAT 8366 123.045 48.338 101.154 1.00 0.00 O ATOM 43142 H1 WAT 8366 123.291 47.498 101.541 1.00 0.00 H ATOM 43143 H2 WAT 8366 122.930 48.923 101.903 1.00 0.00 H TER 43145 WAT 8366 ATOM 43145 O WAT 8367 42.068 18.121 54.400 1.00 0.00 O ATOM 43146 H1 WAT 8367 42.749 18.007 55.062 1.00 0.00 H ATOM 43147 H2 WAT 8367 42.408 17.673 53.626 1.00 0.00 H TER 43149 WAT 8367 ATOM 43149 O WAT 8368 118.112 51.172 69.465 1.00 0.00 O ATOM 43150 H1 WAT 8368 117.244 51.398 69.800 1.00 0.00 H ATOM 43151 H2 WAT 8368 118.357 50.383 69.949 1.00 0.00 H TER 43153 WAT 8368 ATOM 43153 O WAT 8369 85.461 81.290 133.467 1.00 0.00 O ATOM 43154 H1 WAT 8369 84.804 80.613 133.633 1.00 0.00 H ATOM 43155 H2 WAT 8369 85.091 81.814 132.756 1.00 0.00 H TER 43157 WAT 8369 ATOM 43157 O WAT 8370 117.097 103.898 87.935 1.00 0.00 O ATOM 43158 H1 WAT 8370 117.751 103.640 87.286 1.00 0.00 H ATOM 43159 H2 WAT 8370 117.496 103.682 88.777 1.00 0.00 H TER 43161 WAT 8370 ATOM 43161 O WAT 8371 10.149 137.129 4.400 1.00 0.00 O ATOM 43162 H1 WAT 8371 10.728 136.687 3.779 1.00 0.00 H ATOM 43163 H2 WAT 8371 10.725 137.400 5.114 1.00 0.00 H TER 43165 WAT 8371 ATOM 43165 O WAT 8372 140.111 56.575 14.826 1.00 0.00 O ATOM 43166 H1 WAT 8372 139.253 56.310 14.495 1.00 0.00 H ATOM 43167 H2 WAT 8372 139.963 56.761 15.753 1.00 0.00 H TER 43169 WAT 8372 ATOM 43169 O WAT 8373 8.070 15.629 100.177 1.00 0.00 O ATOM 43170 H1 WAT 8373 7.391 16.291 100.044 1.00 0.00 H ATOM 43171 H2 WAT 8373 8.805 15.929 99.643 1.00 0.00 H TER 43173 WAT 8373 ATOM 43173 O WAT 8374 129.551 131.774 99.368 1.00 0.00 O ATOM 43174 H1 WAT 8374 129.179 131.083 98.820 1.00 0.00 H ATOM 43175 H2 WAT 8374 130.447 131.486 99.541 1.00 0.00 H TER 43177 WAT 8374 ATOM 43177 O WAT 8375 19.343 123.705 81.276 1.00 0.00 O ATOM 43178 H1 WAT 8375 19.701 123.611 80.393 1.00 0.00 H ATOM 43179 H2 WAT 8375 20.023 124.172 81.761 1.00 0.00 H TER 43181 WAT 8375 ATOM 43181 O WAT 8376 81.839 68.320 59.597 1.00 0.00 O ATOM 43182 H1 WAT 8376 81.109 67.703 59.543 1.00 0.00 H ATOM 43183 H2 WAT 8376 82.525 67.927 59.058 1.00 0.00 H TER 43185 WAT 8376 ATOM 43185 O WAT 8377 33.631 129.966 144.570 1.00 0.00 O ATOM 43186 H1 WAT 8377 32.961 130.529 144.183 1.00 0.00 H ATOM 43187 H2 WAT 8377 33.436 129.970 145.507 1.00 0.00 H TER 43189 WAT 8377 ATOM 43189 O WAT 8378 38.888 89.809 99.718 1.00 0.00 O ATOM 43190 H1 WAT 8378 38.297 89.055 99.728 1.00 0.00 H ATOM 43191 H2 WAT 8378 38.401 90.501 100.163 1.00 0.00 H TER 43193 WAT 8378 ATOM 43193 O WAT 8379 110.042 78.321 132.292 1.00 0.00 O ATOM 43194 H1 WAT 8379 109.455 77.834 132.871 1.00 0.00 H ATOM 43195 H2 WAT 8379 109.575 79.136 132.107 1.00 0.00 H TER 43197 WAT 8379 ATOM 43197 O WAT 8380 93.294 22.495 64.576 1.00 0.00 O ATOM 43198 H1 WAT 8380 92.350 22.652 64.569 1.00 0.00 H ATOM 43199 H2 WAT 8380 93.478 22.177 65.459 1.00 0.00 H TER 43201 WAT 8380 ATOM 43201 O WAT 8381 105.192 86.192 25.586 1.00 0.00 O ATOM 43202 H1 WAT 8381 104.552 86.681 25.069 1.00 0.00 H ATOM 43203 H2 WAT 8381 105.104 85.288 25.283 1.00 0.00 H TER 43205 WAT 8381 ATOM 43205 O WAT 8382 60.019 0.977 89.779 1.00 0.00 O ATOM 43206 H1 WAT 8382 60.062 1.582 89.039 1.00 0.00 H ATOM 43207 H2 WAT 8382 60.910 0.962 90.129 1.00 0.00 H TER 43209 WAT 8382 ATOM 43209 O WAT 8383 79.544 136.784 150.632 1.00 0.00 O ATOM 43210 H1 WAT 8383 79.012 136.064 150.972 1.00 0.00 H ATOM 43211 H2 WAT 8383 79.000 137.562 150.754 1.00 0.00 H TER 43213 WAT 8383 ATOM 43213 O WAT 8384 31.485 101.956 9.326 1.00 0.00 O ATOM 43214 H1 WAT 8384 30.697 101.478 9.585 1.00 0.00 H ATOM 43215 H2 WAT 8384 31.356 102.838 9.674 1.00 0.00 H TER 43217 WAT 8384 ATOM 43217 O WAT 8385 65.078 92.240 56.402 1.00 0.00 O ATOM 43218 H1 WAT 8385 64.248 91.977 56.799 1.00 0.00 H ATOM 43219 H2 WAT 8385 65.677 91.521 56.603 1.00 0.00 H TER 43221 WAT 8385 ATOM 43221 O WAT 8386 128.480 99.101 25.345 1.00 0.00 O ATOM 43222 H1 WAT 8386 128.384 98.313 25.880 1.00 0.00 H ATOM 43223 H2 WAT 8386 129.293 99.502 25.652 1.00 0.00 H TER 43225 WAT 8386 ATOM 43225 O WAT 8387 126.095 82.973 136.408 1.00 0.00 O ATOM 43226 H1 WAT 8387 125.931 83.487 135.618 1.00 0.00 H ATOM 43227 H2 WAT 8387 125.688 83.479 137.111 1.00 0.00 H TER 43229 WAT 8387 ATOM 43229 O WAT 8388 19.885 51.498 79.672 1.00 0.00 O ATOM 43230 H1 WAT 8388 20.658 52.011 79.907 1.00 0.00 H ATOM 43231 H2 WAT 8388 19.845 50.807 80.333 1.00 0.00 H TER 43233 WAT 8388 ATOM 43233 O WAT 8389 137.972 123.324 106.343 1.00 0.00 O ATOM 43234 H1 WAT 8389 137.757 122.760 107.087 1.00 0.00 H ATOM 43235 H2 WAT 8389 138.563 122.797 105.806 1.00 0.00 H TER 43237 WAT 8389 ATOM 43237 O WAT 8390 20.398 67.599 7.138 1.00 0.00 O ATOM 43238 H1 WAT 8390 20.025 68.471 7.269 1.00 0.00 H ATOM 43239 H2 WAT 8390 19.962 67.052 7.791 1.00 0.00 H TER 43241 WAT 8390 ATOM 43241 O WAT 8391 21.698 112.047 133.676 1.00 0.00 O ATOM 43242 H1 WAT 8391 21.014 112.717 133.680 1.00 0.00 H ATOM 43243 H2 WAT 8391 21.647 111.658 132.803 1.00 0.00 H TER 43245 WAT 8391 ATOM 43245 O WAT 8392 129.566 21.523 80.982 1.00 0.00 O ATOM 43246 H1 WAT 8392 130.298 21.835 80.450 1.00 0.00 H ATOM 43247 H2 WAT 8392 129.318 22.279 81.515 1.00 0.00 H TER 43249 WAT 8392 ATOM 43249 O WAT 8393 64.595 70.911 146.678 1.00 0.00 O ATOM 43250 H1 WAT 8393 64.901 70.464 145.889 1.00 0.00 H ATOM 43251 H2 WAT 8393 64.944 71.799 146.601 1.00 0.00 H TER 43253 WAT 8393 ATOM 43253 O WAT 8394 14.560 99.984 105.260 1.00 0.00 O ATOM 43254 H1 WAT 8394 13.728 99.570 105.488 1.00 0.00 H ATOM 43255 H2 WAT 8394 14.313 100.742 104.731 1.00 0.00 H TER 43257 WAT 8394 ATOM 43257 O WAT 8395 15.373 98.156 15.575 1.00 0.00 O ATOM 43258 H1 WAT 8395 15.423 98.159 14.619 1.00 0.00 H ATOM 43259 H2 WAT 8395 15.194 99.066 15.809 1.00 0.00 H TER 43261 WAT 8395 ATOM 43261 O WAT 8396 66.630 121.020 95.862 1.00 0.00 O ATOM 43262 H1 WAT 8396 67.401 120.933 95.301 1.00 0.00 H ATOM 43263 H2 WAT 8396 66.881 120.595 96.682 1.00 0.00 H TER 43265 WAT 8396 ATOM 43265 O WAT 8397 22.148 135.782 64.121 1.00 0.00 O ATOM 43266 H1 WAT 8397 22.924 136.315 63.944 1.00 0.00 H ATOM 43267 H2 WAT 8397 21.668 135.776 63.292 1.00 0.00 H TER 43269 WAT 8397 ATOM 43269 O WAT 8398 74.637 80.750 137.716 1.00 0.00 O ATOM 43270 H1 WAT 8398 74.476 81.227 136.902 1.00 0.00 H ATOM 43271 H2 WAT 8398 74.621 81.424 138.396 1.00 0.00 H TER 43273 WAT 8398 ATOM 43273 O WAT 8399 111.246 52.955 98.458 1.00 0.00 O ATOM 43274 H1 WAT 8399 111.745 52.415 99.072 1.00 0.00 H ATOM 43275 H2 WAT 8399 110.493 53.260 98.965 1.00 0.00 H TER 43277 WAT 8399 ATOM 43277 O WAT 8400 36.349 3.452 109.860 1.00 0.00 O ATOM 43278 H1 WAT 8400 36.179 3.386 108.920 1.00 0.00 H ATOM 43279 H2 WAT 8400 35.831 2.745 110.247 1.00 0.00 H TER 43281 WAT 8400 ATOM 43281 O WAT 8401 132.350 6.624 110.886 1.00 0.00 O ATOM 43282 H1 WAT 8401 132.200 5.812 111.370 1.00 0.00 H ATOM 43283 H2 WAT 8401 132.400 7.300 111.561 1.00 0.00 H TER 43285 WAT 8401 ATOM 43285 O WAT 8402 136.586 81.275 136.488 1.00 0.00 O ATOM 43286 H1 WAT 8402 137.228 80.665 136.125 1.00 0.00 H ATOM 43287 H2 WAT 8402 136.680 82.066 135.957 1.00 0.00 H TER 43289 WAT 8402 ATOM 43289 O WAT 8403 72.693 0.361 124.470 1.00 0.00 O ATOM 43290 H1 WAT 8403 72.986 -0.535 124.634 1.00 0.00 H ATOM 43291 H2 WAT 8403 73.490 0.833 124.226 1.00 0.00 H TER 43293 WAT 8403 ATOM 43293 O WAT 8404 117.590 67.404 18.430 1.00 0.00 O ATOM 43294 H1 WAT 8404 117.821 66.839 17.693 1.00 0.00 H ATOM 43295 H2 WAT 8404 116.685 67.171 18.635 1.00 0.00 H TER 43297 WAT 8404 ATOM 43297 O WAT 8405 107.275 76.441 84.312 1.00 0.00 O ATOM 43298 H1 WAT 8405 106.816 75.609 84.201 1.00 0.00 H ATOM 43299 H2 WAT 8405 108.185 76.245 84.091 1.00 0.00 H TER 43301 WAT 8405 ATOM 43301 O WAT 8406 39.033 89.107 132.468 1.00 0.00 O ATOM 43302 H1 WAT 8406 38.277 88.748 132.002 1.00 0.00 H ATOM 43303 H2 WAT 8406 39.741 89.086 131.824 1.00 0.00 H TER 43305 WAT 8406 ATOM 43305 O WAT 8407 35.834 111.787 97.202 1.00 0.00 O ATOM 43306 H1 WAT 8407 36.200 112.668 97.116 1.00 0.00 H ATOM 43307 H2 WAT 8407 34.888 111.913 97.129 1.00 0.00 H TER 43309 WAT 8407 ATOM 43309 O WAT 8408 16.449 84.930 90.962 1.00 0.00 O ATOM 43310 H1 WAT 8408 16.661 85.347 90.127 1.00 0.00 H ATOM 43311 H2 WAT 8408 15.918 85.578 91.425 1.00 0.00 H TER 43313 WAT 8408 ATOM 43313 O WAT 8409 19.246 8.951 108.894 1.00 0.00 O ATOM 43314 H1 WAT 8409 19.565 9.331 109.712 1.00 0.00 H ATOM 43315 H2 WAT 8409 19.758 9.385 108.212 1.00 0.00 H TER 43317 WAT 8409 ATOM 43317 O WAT 8410 99.762 19.229 90.879 1.00 0.00 O ATOM 43318 H1 WAT 8410 100.520 18.859 91.332 1.00 0.00 H ATOM 43319 H2 WAT 8410 99.008 18.818 91.300 1.00 0.00 H TER 43321 WAT 8410 ATOM 43321 O WAT 8411 130.139 56.845 10.153 1.00 0.00 O ATOM 43322 H1 WAT 8411 130.162 55.977 9.749 1.00 0.00 H ATOM 43323 H2 WAT 8411 129.385 56.815 10.743 1.00 0.00 H TER 43325 WAT 8411 ATOM 43325 O WAT 8412 127.302 85.918 122.413 1.00 0.00 O ATOM 43326 H1 WAT 8412 128.181 86.250 122.228 1.00 0.00 H ATOM 43327 H2 WAT 8412 126.793 86.139 121.633 1.00 0.00 H TER 43329 WAT 8412 ATOM 43329 O WAT 8413 18.179 81.854 65.635 1.00 0.00 O ATOM 43330 H1 WAT 8413 18.845 82.313 66.147 1.00 0.00 H ATOM 43331 H2 WAT 8413 17.545 82.532 65.403 1.00 0.00 H TER 43333 WAT 8413 ATOM 43333 O WAT 8414 27.475 0.645 5.084 1.00 0.00 O ATOM 43334 H1 WAT 8414 27.551 0.970 5.981 1.00 0.00 H ATOM 43335 H2 WAT 8414 27.070 -0.217 5.175 1.00 0.00 H TER 43337 WAT 8414 ATOM 43337 O WAT 8415 64.085 90.426 122.002 1.00 0.00 O ATOM 43338 H1 WAT 8415 64.617 91.222 122.023 1.00 0.00 H ATOM 43339 H2 WAT 8415 64.710 89.717 122.158 1.00 0.00 H TER 43341 WAT 8415 ATOM 43341 O WAT 8416 145.037 57.412 98.283 1.00 0.00 O ATOM 43342 H1 WAT 8416 144.769 58.034 98.959 1.00 0.00 H ATOM 43343 H2 WAT 8416 144.683 56.572 98.576 1.00 0.00 H TER 43345 WAT 8416 ATOM 43345 O WAT 8417 79.138 140.287 77.323 1.00 0.00 O ATOM 43346 H1 WAT 8417 78.398 140.866 77.503 1.00 0.00 H ATOM 43347 H2 WAT 8417 78.738 139.442 77.117 1.00 0.00 H TER 43349 WAT 8417 ATOM 43349 O WAT 8418 54.405 126.507 6.575 1.00 0.00 O ATOM 43350 H1 WAT 8418 54.528 125.958 7.349 1.00 0.00 H ATOM 43351 H2 WAT 8418 55.206 126.386 6.065 1.00 0.00 H TER 43353 WAT 8418 ATOM 43353 O WAT 8419 108.617 137.485 96.552 1.00 0.00 O ATOM 43354 H1 WAT 8419 108.881 138.337 96.898 1.00 0.00 H ATOM 43355 H2 WAT 8419 107.695 137.403 96.796 1.00 0.00 H TER 43357 WAT 8419 ATOM 43357 O WAT 8420 96.677 21.067 136.912 1.00 0.00 O ATOM 43358 H1 WAT 8420 96.695 20.624 136.064 1.00 0.00 H ATOM 43359 H2 WAT 8420 96.512 20.368 137.544 1.00 0.00 H TER 43361 WAT 8420 ATOM 43361 O WAT 8421 48.346 12.769 11.749 1.00 0.00 O ATOM 43362 H1 WAT 8421 48.200 13.705 11.618 1.00 0.00 H ATOM 43363 H2 WAT 8421 48.556 12.687 12.679 1.00 0.00 H TER 43365 WAT 8421 ATOM 43365 O WAT 8422 9.415 77.216 87.586 1.00 0.00 O ATOM 43366 H1 WAT 8422 9.574 76.489 86.985 1.00 0.00 H ATOM 43367 H2 WAT 8422 8.774 77.765 87.134 1.00 0.00 H TER 43369 WAT 8422 ATOM 43369 O WAT 8423 108.738 59.656 125.495 1.00 0.00 O ATOM 43370 H1 WAT 8423 109.345 60.350 125.752 1.00 0.00 H ATOM 43371 H2 WAT 8423 108.320 59.388 126.313 1.00 0.00 H TER 43373 WAT 8423 ATOM 43373 O WAT 8424 126.360 20.978 0.174 1.00 0.00 O ATOM 43374 H1 WAT 8424 127.218 20.574 0.305 1.00 0.00 H ATOM 43375 H2 WAT 8424 125.737 20.327 0.497 1.00 0.00 H TER 43377 WAT 8424 ATOM 43377 O WAT 8425 13.600 138.024 155.369 1.00 0.00 O ATOM 43378 H1 WAT 8425 13.177 138.875 155.482 1.00 0.00 H ATOM 43379 H2 WAT 8425 14.483 138.233 155.065 1.00 0.00 H TER 43381 WAT 8425 ATOM 43381 O WAT 8426 78.642 109.945 80.470 1.00 0.00 O ATOM 43382 H1 WAT 8426 78.704 110.899 80.423 1.00 0.00 H ATOM 43383 H2 WAT 8426 79.138 109.710 81.254 1.00 0.00 H TER 43385 WAT 8426 ATOM 43385 O WAT 8427 67.417 8.864 157.982 1.00 0.00 O ATOM 43386 H1 WAT 8427 67.232 9.408 157.217 1.00 0.00 H ATOM 43387 H2 WAT 8427 66.820 9.188 158.656 1.00 0.00 H TER 43389 WAT 8427 ATOM 43389 O WAT 8428 14.570 80.122 65.782 1.00 0.00 O ATOM 43390 H1 WAT 8428 15.474 79.935 65.527 1.00 0.00 H ATOM 43391 H2 WAT 8428 14.117 79.284 65.691 1.00 0.00 H TER 43393 WAT 8428 ATOM 43393 O WAT 8429 113.667 13.889 49.160 1.00 0.00 O ATOM 43394 H1 WAT 8429 113.724 14.845 49.148 1.00 0.00 H ATOM 43395 H2 WAT 8429 114.369 13.615 49.751 1.00 0.00 H TER 43397 WAT 8429 ATOM 43397 O WAT 8430 97.846 70.847 97.745 1.00 0.00 O ATOM 43398 H1 WAT 8430 97.244 70.229 98.160 1.00 0.00 H ATOM 43399 H2 WAT 8430 98.099 71.444 98.449 1.00 0.00 H TER 43401 WAT 8430 ATOM 43401 O WAT 8431 113.933 106.205 131.733 1.00 0.00 O ATOM 43402 H1 WAT 8431 113.150 105.943 131.249 1.00 0.00 H ATOM 43403 H2 WAT 8431 113.697 106.087 132.653 1.00 0.00 H TER 43405 WAT 8431 ATOM 43405 O WAT 8432 73.149 134.102 106.081 1.00 0.00 O ATOM 43406 H1 WAT 8432 73.495 134.302 106.951 1.00 0.00 H ATOM 43407 H2 WAT 8432 72.241 134.402 106.109 1.00 0.00 H TER 43409 WAT 8432 ATOM 43409 O WAT 8433 23.483 122.940 71.605 1.00 0.00 O ATOM 43410 H1 WAT 8433 23.513 122.043 71.938 1.00 0.00 H ATOM 43411 H2 WAT 8433 23.541 122.845 70.654 1.00 0.00 H TER 43413 WAT 8433 ATOM 43413 O WAT 8434 60.930 69.332 13.990 1.00 0.00 O ATOM 43414 H1 WAT 8434 61.096 69.319 14.933 1.00 0.00 H ATOM 43415 H2 WAT 8434 61.520 68.668 13.634 1.00 0.00 H TER 43417 WAT 8434 ATOM 43417 O WAT 8435 133.879 29.733 7.888 1.00 0.00 O ATOM 43418 H1 WAT 8435 133.424 30.575 7.868 1.00 0.00 H ATOM 43419 H2 WAT 8435 134.476 29.765 7.140 1.00 0.00 H TER 43421 WAT 8435 ATOM 43421 O WAT 8436 114.429 112.791 15.604 1.00 0.00 O ATOM 43422 H1 WAT 8436 114.799 111.943 15.358 1.00 0.00 H ATOM 43423 H2 WAT 8436 115.172 113.284 15.952 1.00 0.00 H TER 43425 WAT 8436 ATOM 43425 O WAT 8437 24.345 33.402 124.946 1.00 0.00 O ATOM 43426 H1 WAT 8437 23.742 34.097 124.680 1.00 0.00 H ATOM 43427 H2 WAT 8437 25.185 33.655 124.564 1.00 0.00 H TER 43429 WAT 8437 ATOM 43429 O WAT 8438 134.449 49.688 142.950 1.00 0.00 O ATOM 43430 H1 WAT 8438 134.995 49.090 143.460 1.00 0.00 H ATOM 43431 H2 WAT 8438 133.669 49.176 142.735 1.00 0.00 H TER 43433 WAT 8438 ATOM 43433 O WAT 8439 18.868 97.375 132.427 1.00 0.00 O ATOM 43434 H1 WAT 8439 19.338 96.561 132.608 1.00 0.00 H ATOM 43435 H2 WAT 8439 17.949 97.113 132.370 1.00 0.00 H TER 43437 WAT 8439 ATOM 43437 O WAT 8440 73.924 108.211 158.539 1.00 0.00 O ATOM 43438 H1 WAT 8440 73.986 107.841 159.420 1.00 0.00 H ATOM 43439 H2 WAT 8440 73.009 108.081 158.289 1.00 0.00 H TER 43441 WAT 8440 ATOM 43441 O WAT 8441 133.790 27.676 62.469 1.00 0.00 O ATOM 43442 H1 WAT 8441 134.592 27.958 62.030 1.00 0.00 H ATOM 43443 H2 WAT 8441 133.514 28.439 62.976 1.00 0.00 H TER 43445 WAT 8441 ATOM 43445 O WAT 8442 7.610 144.943 124.322 1.00 0.00 O ATOM 43446 H1 WAT 8442 7.506 145.888 124.429 1.00 0.00 H ATOM 43447 H2 WAT 8442 7.173 144.746 123.494 1.00 0.00 H TER 43449 WAT 8442 ATOM 43449 O WAT 8443 121.602 16.022 76.545 1.00 0.00 O ATOM 43450 H1 WAT 8443 121.753 15.102 76.324 1.00 0.00 H ATOM 43451 H2 WAT 8443 121.947 16.508 75.796 1.00 0.00 H TER 43453 WAT 8443 ATOM 43453 O WAT 8444 131.081 91.982 73.215 1.00 0.00 O ATOM 43454 H1 WAT 8444 130.355 92.567 73.433 1.00 0.00 H ATOM 43455 H2 WAT 8444 130.831 91.139 73.594 1.00 0.00 H TER 43457 WAT 8444 ATOM 43457 O WAT 8445 20.535 96.965 85.537 1.00 0.00 O ATOM 43458 H1 WAT 8445 20.366 96.878 86.475 1.00 0.00 H ATOM 43459 H2 WAT 8445 20.789 96.086 85.257 1.00 0.00 H TER 43461 WAT 8445 ATOM 43461 O WAT 8446 25.718 132.498 15.170 1.00 0.00 O ATOM 43462 H1 WAT 8446 25.167 133.250 14.956 1.00 0.00 H ATOM 43463 H2 WAT 8446 26.394 132.495 14.492 1.00 0.00 H TER 43465 WAT 8446 ATOM 43465 O WAT 8447 138.517 143.000 109.502 1.00 0.00 O ATOM 43466 H1 WAT 8447 138.322 143.111 108.571 1.00 0.00 H ATOM 43467 H2 WAT 8447 138.404 142.062 109.660 1.00 0.00 H TER 43469 WAT 8447 ATOM 43469 O WAT 8448 77.760 25.811 79.335 1.00 0.00 O ATOM 43470 H1 WAT 8448 78.578 25.371 79.567 1.00 0.00 H ATOM 43471 H2 WAT 8448 77.971 26.309 78.545 1.00 0.00 H TER 43473 WAT 8448 ATOM 43473 O WAT 8449 142.539 92.683 26.469 1.00 0.00 O ATOM 43474 H1 WAT 8449 143.397 92.555 26.873 1.00 0.00 H ATOM 43475 H2 WAT 8449 142.431 91.928 25.891 1.00 0.00 H TER 43477 WAT 8449 ATOM 43477 O WAT 8450 127.351 86.177 23.038 1.00 0.00 O ATOM 43478 H1 WAT 8450 127.899 85.414 23.223 1.00 0.00 H ATOM 43479 H2 WAT 8450 126.558 85.812 22.644 1.00 0.00 H TER 43481 WAT 8450 ATOM 43481 O WAT 8451 96.075 145.102 9.629 1.00 0.00 O ATOM 43482 H1 WAT 8451 96.145 145.229 10.575 1.00 0.00 H ATOM 43483 H2 WAT 8451 95.138 144.991 9.470 1.00 0.00 H TER 43485 WAT 8451 ATOM 43485 O WAT 8452 34.818 136.776 83.419 1.00 0.00 O ATOM 43486 H1 WAT 8452 34.259 136.319 84.047 1.00 0.00 H ATOM 43487 H2 WAT 8452 34.320 137.556 83.177 1.00 0.00 H TER 43489 WAT 8452 ATOM 43489 O WAT 8453 57.012 77.453 63.622 1.00 0.00 O ATOM 43490 H1 WAT 8453 56.500 76.716 63.290 1.00 0.00 H ATOM 43491 H2 WAT 8453 57.918 77.232 63.407 1.00 0.00 H TER 43493 WAT 8453 ATOM 43493 O WAT 8454 58.857 71.972 61.389 1.00 0.00 O ATOM 43494 H1 WAT 8454 58.808 71.384 60.636 1.00 0.00 H ATOM 43495 H2 WAT 8454 59.407 71.508 62.020 1.00 0.00 H TER 43497 WAT 8454 ATOM 43497 O WAT 8455 69.599 90.036 92.960 1.00 0.00 O ATOM 43498 H1 WAT 8455 69.106 89.225 93.083 1.00 0.00 H ATOM 43499 H2 WAT 8455 68.961 90.652 92.598 1.00 0.00 H TER 43501 WAT 8455 ATOM 43501 O WAT 8456 4.340 132.602 99.076 1.00 0.00 O ATOM 43502 H1 WAT 8456 4.873 133.159 98.509 1.00 0.00 H ATOM 43503 H2 WAT 8456 4.222 131.795 98.575 1.00 0.00 H TER 43505 WAT 8456 ATOM 43505 O WAT 8457 97.242 79.051 147.211 1.00 0.00 O ATOM 43506 H1 WAT 8457 96.562 78.412 147.423 1.00 0.00 H ATOM 43507 H2 WAT 8457 97.159 79.723 147.887 1.00 0.00 H TER 43509 WAT 8457 ATOM 43509 O WAT 8458 53.175 14.278 8.012 1.00 0.00 O ATOM 43510 H1 WAT 8458 52.560 14.982 7.806 1.00 0.00 H ATOM 43511 H2 WAT 8458 53.926 14.724 8.404 1.00 0.00 H TER 43513 WAT 8458 ATOM 43513 O WAT 8459 38.385 118.511 12.616 1.00 0.00 O ATOM 43514 H1 WAT 8459 37.920 118.824 13.392 1.00 0.00 H ATOM 43515 H2 WAT 8459 38.671 119.309 12.171 1.00 0.00 H TER 43517 WAT 8459 ATOM 43517 O WAT 8460 101.724 108.089 125.350 1.00 0.00 O ATOM 43518 H1 WAT 8460 101.642 107.214 124.972 1.00 0.00 H ATOM 43519 H2 WAT 8460 101.033 108.599 124.927 1.00 0.00 H TER 43521 WAT 8460 ATOM 43521 O WAT 8461 111.028 96.976 60.958 1.00 0.00 O ATOM 43522 H1 WAT 8461 110.546 96.580 60.231 1.00 0.00 H ATOM 43523 H2 WAT 8461 111.237 96.242 61.535 1.00 0.00 H TER 43525 WAT 8461 ATOM 43525 O WAT 8462 136.490 28.090 13.343 1.00 0.00 O ATOM 43526 H1 WAT 8462 137.161 28.486 13.900 1.00 0.00 H ATOM 43527 H2 WAT 8462 136.910 28.006 12.487 1.00 0.00 H TER 43529 WAT 8462 ATOM 43529 O WAT 8463 71.455 45.058 97.206 1.00 0.00 O ATOM 43530 H1 WAT 8463 70.621 45.357 97.570 1.00 0.00 H ATOM 43531 H2 WAT 8463 72.066 45.104 97.941 1.00 0.00 H TER 43533 WAT 8463 ATOM 43533 O WAT 8464 79.305 115.350 3.836 1.00 0.00 O ATOM 43534 H1 WAT 8464 78.450 115.689 4.103 1.00 0.00 H ATOM 43535 H2 WAT 8464 79.101 114.634 3.234 1.00 0.00 H TER 43537 WAT 8464 ATOM 43537 O WAT 8465 8.443 79.717 123.186 1.00 0.00 O ATOM 43538 H1 WAT 8465 8.739 79.419 124.046 1.00 0.00 H ATOM 43539 H2 WAT 8465 7.498 79.563 123.191 1.00 0.00 H TER 43541 WAT 8465 ATOM 43541 O WAT 8466 50.260 18.552 102.138 1.00 0.00 O ATOM 43542 H1 WAT 8466 49.315 18.512 102.285 1.00 0.00 H ATOM 43543 H2 WAT 8466 50.515 19.418 102.456 1.00 0.00 H TER 43545 WAT 8466 ATOM 43545 O WAT 8467 26.921 108.260 155.221 1.00 0.00 O ATOM 43546 H1 WAT 8467 26.379 107.978 154.485 1.00 0.00 H ATOM 43547 H2 WAT 8467 26.814 109.211 155.247 1.00 0.00 H TER 43549 WAT 8467 ATOM 43549 O WAT 8468 72.120 132.637 118.151 1.00 0.00 O ATOM 43550 H1 WAT 8468 71.806 132.287 118.985 1.00 0.00 H ATOM 43551 H2 WAT 8468 72.563 133.452 118.385 1.00 0.00 H TER 43553 WAT 8468 ATOM 43553 O WAT 8469 86.725 137.429 84.454 1.00 0.00 O ATOM 43554 H1 WAT 8469 87.119 137.430 83.581 1.00 0.00 H ATOM 43555 H2 WAT 8469 87.394 137.043 85.018 1.00 0.00 H TER 43557 WAT 8469 ATOM 43557 O WAT 8470 22.312 66.758 4.459 1.00 0.00 O ATOM 43558 H1 WAT 8470 22.335 66.087 5.141 1.00 0.00 H ATOM 43559 H2 WAT 8470 22.179 67.578 4.935 1.00 0.00 H TER 43561 WAT 8470 ATOM 43561 O WAT 8471 127.544 22.980 111.971 1.00 0.00 O ATOM 43562 H1 WAT 8471 126.637 22.747 112.170 1.00 0.00 H ATOM 43563 H2 WAT 8471 127.719 22.560 111.128 1.00 0.00 H TER 43565 WAT 8471 ATOM 43565 O WAT 8472 58.578 86.251 11.207 1.00 0.00 O ATOM 43566 H1 WAT 8472 58.652 87.178 11.436 1.00 0.00 H ATOM 43567 H2 WAT 8472 59.202 86.131 10.491 1.00 0.00 H TER 43569 WAT 8472 ATOM 43569 O WAT 8473 80.124 92.529 146.600 1.00 0.00 O ATOM 43570 H1 WAT 8473 79.414 93.078 146.935 1.00 0.00 H ATOM 43571 H2 WAT 8473 80.487 92.107 147.378 1.00 0.00 H TER 43573 WAT 8473 ATOM 43573 O WAT 8474 37.055 102.572 93.610 1.00 0.00 O ATOM 43574 H1 WAT 8474 37.925 102.230 93.815 1.00 0.00 H ATOM 43575 H2 WAT 8474 37.090 102.771 92.674 1.00 0.00 H TER 43577 WAT 8474 ATOM 43577 O WAT 8475 85.943 106.086 147.157 1.00 0.00 O ATOM 43578 H1 WAT 8475 85.617 105.213 147.375 1.00 0.00 H ATOM 43579 H2 WAT 8475 86.474 105.954 146.371 1.00 0.00 H TER 43581 WAT 8475 ATOM 43581 O WAT 8476 141.239 4.581 72.118 1.00 0.00 O ATOM 43582 H1 WAT 8476 140.459 4.030 72.169 1.00 0.00 H ATOM 43583 H2 WAT 8476 141.859 4.071 71.596 1.00 0.00 H TER 43585 WAT 8476 ATOM 43585 O WAT 8477 23.462 111.911 93.705 1.00 0.00 O ATOM 43586 H1 WAT 8477 23.461 112.189 94.621 1.00 0.00 H ATOM 43587 H2 WAT 8477 23.478 112.728 93.206 1.00 0.00 H TER 43589 WAT 8477 ATOM 43589 O WAT 8478 85.798 58.036 87.689 1.00 0.00 O ATOM 43590 H1 WAT 8478 85.401 57.781 86.855 1.00 0.00 H ATOM 43591 H2 WAT 8478 86.603 57.520 87.738 1.00 0.00 H TER 43593 WAT 8478 ATOM 43593 O WAT 8479 72.466 99.542 148.459 1.00 0.00 O ATOM 43594 H1 WAT 8479 72.964 98.878 148.937 1.00 0.00 H ATOM 43595 H2 WAT 8479 72.619 100.352 148.945 1.00 0.00 H TER 43597 WAT 8479 ATOM 43597 O WAT 8480 20.390 110.746 108.995 1.00 0.00 O ATOM 43598 H1 WAT 8480 20.784 110.690 109.866 1.00 0.00 H ATOM 43599 H2 WAT 8480 19.460 110.897 109.162 1.00 0.00 H TER 43601 WAT 8480 ATOM 43601 O WAT 8481 93.232 75.746 107.136 1.00 0.00 O ATOM 43602 H1 WAT 8481 92.593 75.592 107.832 1.00 0.00 H ATOM 43603 H2 WAT 8481 92.716 75.727 106.330 1.00 0.00 H TER 43605 WAT 8481 ATOM 43605 O WAT 8482 101.703 35.786 82.404 1.00 0.00 O ATOM 43606 H1 WAT 8482 101.742 35.151 81.689 1.00 0.00 H ATOM 43607 H2 WAT 8482 102.222 36.528 82.094 1.00 0.00 H TER 43609 WAT 8482 ATOM 43609 O WAT 8483 15.559 16.068 10.208 1.00 0.00 O ATOM 43610 H1 WAT 8483 15.657 16.848 9.661 1.00 0.00 H ATOM 43611 H2 WAT 8483 14.635 16.064 10.457 1.00 0.00 H TER 43613 WAT 8483 ATOM 43613 O WAT 8484 99.142 3.849 2.233 1.00 0.00 O ATOM 43614 H1 WAT 8484 98.609 3.126 2.562 1.00 0.00 H ATOM 43615 H2 WAT 8484 99.840 3.425 1.734 1.00 0.00 H TER 43617 WAT 8484 ATOM 43617 O WAT 8485 124.658 56.371 102.762 1.00 0.00 O ATOM 43618 H1 WAT 8485 123.832 56.809 102.557 1.00 0.00 H ATOM 43619 H2 WAT 8485 125.027 56.882 103.482 1.00 0.00 H TER 43621 WAT 8485 ATOM 43621 O WAT 8486 16.317 121.136 14.034 1.00 0.00 O ATOM 43622 H1 WAT 8486 16.114 122.009 13.698 1.00 0.00 H ATOM 43623 H2 WAT 8486 17.168 121.236 14.463 1.00 0.00 H TER 43625 WAT 8486 ATOM 43625 O WAT 8487 126.434 30.551 18.935 1.00 0.00 O ATOM 43626 H1 WAT 8487 127.065 31.216 19.208 1.00 0.00 H ATOM 43627 H2 WAT 8487 126.758 29.739 19.325 1.00 0.00 H TER 43629 WAT 8487 ATOM 43629 O WAT 8488 42.741 135.479 121.090 1.00 0.00 O ATOM 43630 H1 WAT 8488 43.642 135.513 120.770 1.00 0.00 H ATOM 43631 H2 WAT 8488 42.455 134.583 120.909 1.00 0.00 H TER 43633 WAT 8488 ATOM 43633 O WAT 8489 13.632 101.356 110.661 1.00 0.00 O ATOM 43634 H1 WAT 8489 13.956 102.179 110.295 1.00 0.00 H ATOM 43635 H2 WAT 8489 14.423 100.862 110.876 1.00 0.00 H TER 43637 WAT 8489 ATOM 43637 O WAT 8490 2.409 143.923 83.026 1.00 0.00 O ATOM 43638 H1 WAT 8490 2.804 143.249 83.579 1.00 0.00 H ATOM 43639 H2 WAT 8490 2.091 144.582 83.642 1.00 0.00 H TER 43641 WAT 8490 ATOM 43641 O WAT 8491 25.014 31.381 104.779 1.00 0.00 O ATOM 43642 H1 WAT 8491 25.612 31.353 104.032 1.00 0.00 H ATOM 43643 H2 WAT 8491 25.130 32.258 105.146 1.00 0.00 H TER 43645 WAT 8491 ATOM 43645 O WAT 8492 8.470 63.443 15.615 1.00 0.00 O ATOM 43646 H1 WAT 8492 8.466 64.376 15.829 1.00 0.00 H ATOM 43647 H2 WAT 8492 9.342 63.143 15.872 1.00 0.00 H TER 43649 WAT 8492 ATOM 43649 O WAT 8493 46.912 34.172 156.492 1.00 0.00 O ATOM 43650 H1 WAT 8493 47.615 34.795 156.675 1.00 0.00 H ATOM 43651 H2 WAT 8493 47.332 33.314 156.542 1.00 0.00 H TER 43653 WAT 8493 ATOM 43653 O WAT 8494 38.780 135.291 96.781 1.00 0.00 O ATOM 43654 H1 WAT 8494 38.244 135.402 95.995 1.00 0.00 H ATOM 43655 H2 WAT 8494 38.468 134.475 97.171 1.00 0.00 H TER 43657 WAT 8494 ATOM 43657 O WAT 8495 75.031 125.976 15.228 1.00 0.00 O ATOM 43658 H1 WAT 8495 74.648 125.310 15.799 1.00 0.00 H ATOM 43659 H2 WAT 8495 75.576 126.506 15.811 1.00 0.00 H TER 43661 WAT 8495 ATOM 43661 O WAT 8496 27.168 121.825 10.334 1.00 0.00 O ATOM 43662 H1 WAT 8496 27.853 122.493 10.374 1.00 0.00 H ATOM 43663 H2 WAT 8496 27.494 121.114 10.886 1.00 0.00 H TER 43665 WAT 8496 ATOM 43665 O WAT 8497 119.269 46.345 2.623 1.00 0.00 O ATOM 43666 H1 WAT 8497 118.537 46.764 3.075 1.00 0.00 H ATOM 43667 H2 WAT 8497 118.903 46.063 1.785 1.00 0.00 H TER 43669 WAT 8497 ATOM 43669 O WAT 8498 93.600 23.548 112.844 1.00 0.00 O ATOM 43670 H1 WAT 8498 92.865 22.950 112.706 1.00 0.00 H ATOM 43671 H2 WAT 8498 93.489 23.860 113.742 1.00 0.00 H TER 43673 WAT 8498 ATOM 43673 O WAT 8499 62.107 106.924 1.609 1.00 0.00 O ATOM 43674 H1 WAT 8499 62.226 107.425 2.415 1.00 0.00 H ATOM 43675 H2 WAT 8499 61.569 106.176 1.869 1.00 0.00 H TER 43677 WAT 8499 ATOM 43677 O WAT 8500 108.610 14.671 5.322 1.00 0.00 O ATOM 43678 H1 WAT 8500 109.180 13.941 5.563 1.00 0.00 H ATOM 43679 H2 WAT 8500 107.732 14.291 5.297 1.00 0.00 H TER 43681 WAT 8500 ATOM 43681 O WAT 8501 17.949 56.843 67.254 1.00 0.00 O ATOM 43682 H1 WAT 8501 18.033 57.793 67.173 1.00 0.00 H ATOM 43683 H2 WAT 8501 18.276 56.648 68.132 1.00 0.00 H TER 43685 WAT 8501 ATOM 43685 O WAT 8502 50.174 96.382 126.267 1.00 0.00 O ATOM 43686 H1 WAT 8502 50.011 96.421 125.325 1.00 0.00 H ATOM 43687 H2 WAT 8502 49.316 96.201 126.651 1.00 0.00 H TER 43689 WAT 8502 ATOM 43689 O WAT 8503 1.752 140.789 120.682 1.00 0.00 O ATOM 43690 H1 WAT 8503 0.933 140.373 120.415 1.00 0.00 H ATOM 43691 H2 WAT 8503 1.741 141.642 120.248 1.00 0.00 H TER 43693 WAT 8503 ATOM 43693 O WAT 8504 23.164 95.030 146.093 1.00 0.00 O ATOM 43694 H1 WAT 8504 23.097 95.985 146.119 1.00 0.00 H ATOM 43695 H2 WAT 8504 22.355 94.745 145.669 1.00 0.00 H TER 43697 WAT 8504 ATOM 43697 O WAT 8505 78.634 121.261 106.945 1.00 0.00 O ATOM 43698 H1 WAT 8505 78.044 121.971 107.197 1.00 0.00 H ATOM 43699 H2 WAT 8505 78.126 120.736 106.327 1.00 0.00 H TER 43701 WAT 8505 ATOM 43701 O WAT 8506 121.803 54.287 4.907 1.00 0.00 O ATOM 43702 H1 WAT 8506 120.909 54.471 5.195 1.00 0.00 H ATOM 43703 H2 WAT 8506 121.831 53.335 4.805 1.00 0.00 H TER 43705 WAT 8506 ATOM 43705 O WAT 8507 17.635 31.291 129.741 1.00 0.00 O ATOM 43706 H1 WAT 8507 17.494 31.341 128.795 1.00 0.00 H ATOM 43707 H2 WAT 8507 17.367 30.402 129.976 1.00 0.00 H TER 43709 WAT 8507 ATOM 43709 O WAT 8508 78.543 56.126 151.570 1.00 0.00 O ATOM 43710 H1 WAT 8508 77.929 56.658 152.077 1.00 0.00 H ATOM 43711 H2 WAT 8508 78.978 56.750 150.989 1.00 0.00 H TER 43713 WAT 8508 ATOM 43713 O WAT 8509 10.191 58.137 123.966 1.00 0.00 O ATOM 43714 H1 WAT 8509 11.142 58.245 123.980 1.00 0.00 H ATOM 43715 H2 WAT 8509 9.897 58.695 123.246 1.00 0.00 H TER 43717 WAT 8509 ATOM 43717 O WAT 8510 96.994 65.860 90.655 1.00 0.00 O ATOM 43718 H1 WAT 8510 96.315 65.918 89.982 1.00 0.00 H ATOM 43719 H2 WAT 8510 97.586 66.586 90.460 1.00 0.00 H TER 43721 WAT 8510 ATOM 43721 O WAT 8511 31.180 39.202 73.234 1.00 0.00 O ATOM 43722 H1 WAT 8511 31.993 39.434 72.785 1.00 0.00 H ATOM 43723 H2 WAT 8511 30.915 38.372 72.838 1.00 0.00 H TER 43725 WAT 8511 ATOM 43725 O WAT 8512 78.998 37.554 86.635 1.00 0.00 O ATOM 43726 H1 WAT 8512 79.086 37.851 85.729 1.00 0.00 H ATOM 43727 H2 WAT 8512 79.297 38.296 87.160 1.00 0.00 H TER 43729 WAT 8512 ATOM 43729 O WAT 8513 115.989 142.870 146.260 1.00 0.00 O ATOM 43730 H1 WAT 8513 115.804 142.335 145.488 1.00 0.00 H ATOM 43731 H2 WAT 8513 116.892 143.161 146.139 1.00 0.00 H TER 43733 WAT 8513 ATOM 43733 O WAT 8514 52.903 51.991 18.038 1.00 0.00 O ATOM 43734 H1 WAT 8514 51.951 52.055 17.954 1.00 0.00 H ATOM 43735 H2 WAT 8514 53.136 52.689 18.650 1.00 0.00 H TER 43737 WAT 8514 ATOM 43737 O WAT 8515 100.219 115.680 76.715 1.00 0.00 O ATOM 43738 H1 WAT 8515 99.559 116.094 76.159 1.00 0.00 H ATOM 43739 H2 WAT 8515 100.538 114.940 76.198 1.00 0.00 H TER 43741 WAT 8515 ATOM 43741 O WAT 8516 81.683 16.385 59.265 1.00 0.00 O ATOM 43742 H1 WAT 8516 81.012 16.733 58.678 1.00 0.00 H ATOM 43743 H2 WAT 8516 82.504 16.503 58.787 1.00 0.00 H TER 43745 WAT 8516 ATOM 43745 O WAT 8517 58.906 7.559 99.118 1.00 0.00 O ATOM 43746 H1 WAT 8517 59.474 7.634 99.885 1.00 0.00 H ATOM 43747 H2 WAT 8517 58.247 8.242 99.241 1.00 0.00 H TER 43749 WAT 8517 ATOM 43749 O WAT 8518 56.633 2.225 112.943 1.00 0.00 O ATOM 43750 H1 WAT 8518 56.982 2.991 113.400 1.00 0.00 H ATOM 43751 H2 WAT 8518 56.856 2.373 112.023 1.00 0.00 H TER 43753 WAT 8518 ATOM 43753 O WAT 8519 60.237 35.310 148.787 1.00 0.00 O ATOM 43754 H1 WAT 8519 60.837 34.565 148.778 1.00 0.00 H ATOM 43755 H2 WAT 8519 60.691 35.977 149.302 1.00 0.00 H TER 43757 WAT 8519 ATOM 43757 O WAT 8520 41.854 45.180 65.446 1.00 0.00 O ATOM 43758 H1 WAT 8520 41.476 44.902 64.611 1.00 0.00 H ATOM 43759 H2 WAT 8520 42.797 45.056 65.334 1.00 0.00 H TER 43761 WAT 8520 ATOM 43761 O WAT 8521 22.291 123.289 109.983 1.00 0.00 O ATOM 43762 H1 WAT 8521 22.637 124.157 110.191 1.00 0.00 H ATOM 43763 H2 WAT 8521 22.812 122.997 109.235 1.00 0.00 H TER 43765 WAT 8521 ATOM 43765 O WAT 8522 117.609 2.860 81.054 1.00 0.00 O ATOM 43766 H1 WAT 8522 117.608 3.262 80.185 1.00 0.00 H ATOM 43767 H2 WAT 8522 116.764 2.414 81.112 1.00 0.00 H TER 43769 WAT 8522 ATOM 43769 O WAT 8523 80.472 80.638 155.448 1.00 0.00 O ATOM 43770 H1 WAT 8523 80.042 80.150 156.150 1.00 0.00 H ATOM 43771 H2 WAT 8523 79.809 80.704 154.761 1.00 0.00 H TER 43773 WAT 8523 ATOM 43773 O WAT 8524 88.365 5.822 130.441 1.00 0.00 O ATOM 43774 H1 WAT 8524 87.679 5.197 130.206 1.00 0.00 H ATOM 43775 H2 WAT 8524 89.161 5.462 130.049 1.00 0.00 H TER 43777 WAT 8524 ATOM 43777 O WAT 8525 113.136 24.177 14.766 1.00 0.00 O ATOM 43778 H1 WAT 8525 113.256 23.261 14.515 1.00 0.00 H ATOM 43779 H2 WAT 8525 113.116 24.162 15.723 1.00 0.00 H TER 43781 WAT 8525 ATOM 43781 O WAT 8526 123.235 59.398 158.434 1.00 0.00 O ATOM 43782 H1 WAT 8526 122.773 58.587 158.221 1.00 0.00 H ATOM 43783 H2 WAT 8526 123.631 59.671 157.606 1.00 0.00 H TER 43785 WAT 8526 ATOM 43785 O WAT 8527 39.675 92.648 106.896 1.00 0.00 O ATOM 43786 H1 WAT 8527 39.288 91.772 106.900 1.00 0.00 H ATOM 43787 H2 WAT 8527 40.533 92.528 106.489 1.00 0.00 H TER 43789 WAT 8527 ATOM 43789 O WAT 8528 123.580 76.007 90.153 1.00 0.00 O ATOM 43790 H1 WAT 8528 123.366 76.152 89.231 1.00 0.00 H ATOM 43791 H2 WAT 8528 124.408 76.468 90.282 1.00 0.00 H TER 43793 WAT 8528 ATOM 43793 O WAT 8529 99.051 77.545 150.396 1.00 0.00 O ATOM 43794 H1 WAT 8529 98.586 76.801 150.014 1.00 0.00 H ATOM 43795 H2 WAT 8529 99.619 77.157 151.061 1.00 0.00 H TER 43797 WAT 8529 ATOM 43797 O WAT 8530 134.798 118.728 82.416 1.00 0.00 O ATOM 43798 H1 WAT 8530 135.564 119.018 81.922 1.00 0.00 H ATOM 43799 H2 WAT 8530 134.248 119.508 82.485 1.00 0.00 H TER 43801 WAT 8530 ATOM 43801 O WAT 8531 143.269 65.433 79.948 1.00 0.00 O ATOM 43802 H1 WAT 8531 143.489 66.356 79.823 1.00 0.00 H ATOM 43803 H2 WAT 8531 143.422 65.032 79.093 1.00 0.00 H TER 43805 WAT 8531 ATOM 43805 O WAT 8532 12.607 6.720 117.939 1.00 0.00 O ATOM 43806 H1 WAT 8532 11.945 7.380 117.732 1.00 0.00 H ATOM 43807 H2 WAT 8532 12.922 6.420 117.086 1.00 0.00 H TER 43809 WAT 8532 ATOM 43809 O WAT 8533 65.863 59.881 2.055 1.00 0.00 O ATOM 43810 H1 WAT 8533 65.430 60.721 2.203 1.00 0.00 H ATOM 43811 H2 WAT 8533 65.804 59.744 1.109 1.00 0.00 H TER 43813 WAT 8533 ATOM 43813 O WAT 8534 55.215 121.023 143.045 1.00 0.00 O ATOM 43814 H1 WAT 8534 55.966 120.429 143.067 1.00 0.00 H ATOM 43815 H2 WAT 8534 55.514 121.768 142.523 1.00 0.00 H TER 43817 WAT 8534 ATOM 43817 O WAT 8535 126.513 96.128 8.168 1.00 0.00 O ATOM 43818 H1 WAT 8535 127.154 96.552 7.597 1.00 0.00 H ATOM 43819 H2 WAT 8535 127.024 95.827 8.919 1.00 0.00 H TER 43821 WAT 8535 ATOM 43821 O WAT 8536 113.675 111.151 139.052 1.00 0.00 O ATOM 43822 H1 WAT 8536 113.519 111.532 139.916 1.00 0.00 H ATOM 43823 H2 WAT 8536 114.610 110.945 139.046 1.00 0.00 H TER 43825 WAT 8536 ATOM 43825 O WAT 8537 82.238 84.839 90.122 1.00 0.00 O ATOM 43826 H1 WAT 8537 81.473 84.367 89.793 1.00 0.00 H ATOM 43827 H2 WAT 8537 81.872 85.579 90.607 1.00 0.00 H TER 43829 WAT 8537 ATOM 43829 O WAT 8538 55.953 62.128 134.292 1.00 0.00 O ATOM 43830 H1 WAT 8538 55.619 63.025 134.284 1.00 0.00 H ATOM 43831 H2 WAT 8538 56.810 62.188 133.870 1.00 0.00 H TER 43833 WAT 8538 ATOM 43833 O WAT 8539 40.887 115.085 139.995 1.00 0.00 O ATOM 43834 H1 WAT 8539 40.296 115.822 140.149 1.00 0.00 H ATOM 43835 H2 WAT 8539 41.232 115.234 139.115 1.00 0.00 H TER 43837 WAT 8539 ATOM 43837 O WAT 8540 137.401 49.709 71.371 1.00 0.00 O ATOM 43838 H1 WAT 8540 137.657 49.852 70.460 1.00 0.00 H ATOM 43839 H2 WAT 8540 137.256 50.588 71.720 1.00 0.00 H TER 43841 WAT 8540 ATOM 43841 O WAT 8541 115.529 1.113 74.309 1.00 0.00 O ATOM 43842 H1 WAT 8541 115.889 0.493 74.942 1.00 0.00 H ATOM 43843 H2 WAT 8541 116.296 1.468 73.859 1.00 0.00 H TER 43845 WAT 8541 ATOM 43845 O WAT 8542 22.138 64.839 18.271 1.00 0.00 O ATOM 43846 H1 WAT 8542 22.791 65.364 18.734 1.00 0.00 H ATOM 43847 H2 WAT 8542 22.046 64.048 18.803 1.00 0.00 H TER 43849 WAT 8542 ATOM 43849 O WAT 8543 142.848 83.297 136.066 1.00 0.00 O ATOM 43850 H1 WAT 8543 142.372 82.513 136.343 1.00 0.00 H ATOM 43851 H2 WAT 8543 143.766 83.095 136.246 1.00 0.00 H TER 43853 WAT 8543 ATOM 43853 O WAT 8544 135.495 135.276 102.838 1.00 0.00 O ATOM 43854 H1 WAT 8544 135.558 136.226 102.741 1.00 0.00 H ATOM 43855 H2 WAT 8544 134.593 135.070 102.595 1.00 0.00 H TER 43857 WAT 8544 ATOM 43857 O WAT 8545 111.789 137.897 145.192 1.00 0.00 O ATOM 43858 H1 WAT 8545 111.617 137.796 146.128 1.00 0.00 H ATOM 43859 H2 WAT 8545 112.548 137.338 145.026 1.00 0.00 H TER 43861 WAT 8545 ATOM 43861 O WAT 8546 89.052 31.733 15.113 1.00 0.00 O ATOM 43862 H1 WAT 8546 88.685 30.950 15.522 1.00 0.00 H ATOM 43863 H2 WAT 8546 88.445 31.940 14.403 1.00 0.00 H TER 43865 WAT 8546 ATOM 43865 O WAT 8547 140.707 140.200 93.031 1.00 0.00 O ATOM 43866 H1 WAT 8547 141.599 140.393 92.744 1.00 0.00 H ATOM 43867 H2 WAT 8547 140.156 140.456 92.291 1.00 0.00 H TER 43869 WAT 8547 ATOM 43869 O WAT 8548 41.837 129.248 135.113 1.00 0.00 O ATOM 43870 H1 WAT 8548 41.658 129.168 136.050 1.00 0.00 H ATOM 43871 H2 WAT 8548 42.680 128.811 134.992 1.00 0.00 H TER 43873 WAT 8548 ATOM 43873 O WAT 8549 100.026 88.955 82.497 1.00 0.00 O ATOM 43874 H1 WAT 8549 99.981 89.911 82.493 1.00 0.00 H ATOM 43875 H2 WAT 8549 100.939 88.759 82.712 1.00 0.00 H TER 43877 WAT 8549 ATOM 43877 O WAT 8550 105.727 1.459 96.487 1.00 0.00 O ATOM 43878 H1 WAT 8550 105.688 0.595 96.896 1.00 0.00 H ATOM 43879 H2 WAT 8550 105.950 1.282 95.573 1.00 0.00 H TER 43881 WAT 8550 ATOM 43881 O WAT 8551 59.014 36.761 16.040 1.00 0.00 O ATOM 43882 H1 WAT 8551 59.106 35.944 16.530 1.00 0.00 H ATOM 43883 H2 WAT 8551 58.850 36.483 15.139 1.00 0.00 H TER 43885 WAT 8551 ATOM 43885 O WAT 8552 14.019 17.243 65.886 1.00 0.00 O ATOM 43886 H1 WAT 8552 13.889 18.165 65.665 1.00 0.00 H ATOM 43887 H2 WAT 8552 14.376 16.853 65.088 1.00 0.00 H TER 43889 WAT 8552 ATOM 43889 O WAT 8553 108.052 106.242 9.749 1.00 0.00 O ATOM 43890 H1 WAT 8553 108.579 105.487 9.489 1.00 0.00 H ATOM 43891 H2 WAT 8553 108.665 106.977 9.740 1.00 0.00 H TER 43893 WAT 8553 ATOM 43893 O WAT 8554 21.199 70.751 138.089 1.00 0.00 O ATOM 43894 H1 WAT 8554 21.760 70.342 138.748 1.00 0.00 H ATOM 43895 H2 WAT 8554 21.423 71.681 138.127 1.00 0.00 H TER 43897 WAT 8554 ATOM 43897 O WAT 8555 13.248 45.684 102.277 1.00 0.00 O ATOM 43898 H1 WAT 8555 13.173 44.890 101.748 1.00 0.00 H ATOM 43899 H2 WAT 8555 12.535 46.244 101.971 1.00 0.00 H TER 43901 WAT 8555 ATOM 43901 O WAT 8556 109.944 17.770 89.062 1.00 0.00 O ATOM 43902 H1 WAT 8556 109.674 17.860 88.148 1.00 0.00 H ATOM 43903 H2 WAT 8556 110.762 18.264 89.121 1.00 0.00 H TER 43905 WAT 8556 ATOM 43905 O WAT 8557 48.173 132.653 93.113 1.00 0.00 O ATOM 43906 H1 WAT 8557 48.717 132.571 93.896 1.00 0.00 H ATOM 43907 H2 WAT 8557 48.585 132.074 92.473 1.00 0.00 H TER 43909 WAT 8557 ATOM 43909 O WAT 8558 13.945 67.506 115.405 1.00 0.00 O ATOM 43910 H1 WAT 8558 14.242 68.401 115.243 1.00 0.00 H ATOM 43911 H2 WAT 8558 13.472 67.262 114.609 1.00 0.00 H TER 43913 WAT 8558 ATOM 43913 O WAT 8559 106.139 43.836 89.036 1.00 0.00 O ATOM 43914 H1 WAT 8559 106.351 44.638 89.513 1.00 0.00 H ATOM 43915 H2 WAT 8559 105.907 44.134 88.157 1.00 0.00 H TER 43917 WAT 8559 ATOM 43917 O WAT 8560 143.348 61.093 118.354 1.00 0.00 O ATOM 43918 H1 WAT 8560 144.095 60.501 118.446 1.00 0.00 H ATOM 43919 H2 WAT 8560 142.769 60.864 119.080 1.00 0.00 H TER 43921 WAT 8560 ATOM 43921 O WAT 8561 105.705 63.954 150.332 1.00 0.00 O ATOM 43922 H1 WAT 8561 106.583 63.581 150.413 1.00 0.00 H ATOM 43923 H2 WAT 8561 105.147 63.207 150.114 1.00 0.00 H TER 43925 WAT 8561 ATOM 43925 O WAT 8562 60.113 118.837 88.786 1.00 0.00 O ATOM 43926 H1 WAT 8562 60.567 119.053 87.972 1.00 0.00 H ATOM 43927 H2 WAT 8562 60.523 118.024 89.080 1.00 0.00 H TER 43929 WAT 8562 ATOM 43929 O WAT 8563 27.008 89.308 102.597 1.00 0.00 O ATOM 43930 H1 WAT 8563 27.937 89.190 102.796 1.00 0.00 H ATOM 43931 H2 WAT 8563 26.772 88.533 102.088 1.00 0.00 H TER 43933 WAT 8563 ATOM 43933 O WAT 8564 64.710 65.549 22.788 1.00 0.00 O ATOM 43934 H1 WAT 8564 63.891 65.549 22.293 1.00 0.00 H ATOM 43935 H2 WAT 8564 64.438 65.478 23.702 1.00 0.00 H TER 43937 WAT 8564 ATOM 43937 O WAT 8565 58.543 80.648 116.175 1.00 0.00 O ATOM 43938 H1 WAT 8565 58.779 79.891 115.639 1.00 0.00 H ATOM 43939 H2 WAT 8565 57.925 80.302 116.819 1.00 0.00 H TER 43941 WAT 8565 ATOM 43941 O WAT 8566 21.551 137.310 14.256 1.00 0.00 O ATOM 43942 H1 WAT 8566 21.560 136.444 13.850 1.00 0.00 H ATOM 43943 H2 WAT 8566 21.873 137.161 15.145 1.00 0.00 H TER 43945 WAT 8566 ATOM 43945 O WAT 8567 56.282 77.216 3.939 1.00 0.00 O ATOM 43946 H1 WAT 8567 57.200 76.966 4.046 1.00 0.00 H ATOM 43947 H2 WAT 8567 55.789 76.442 4.212 1.00 0.00 H TER 43949 WAT 8567 ATOM 43949 O WAT 8568 137.311 140.314 6.203 1.00 0.00 O ATOM 43950 H1 WAT 8568 137.256 140.242 7.156 1.00 0.00 H ATOM 43951 H2 WAT 8568 137.586 139.444 5.913 1.00 0.00 H TER 43953 WAT 8568 ATOM 43953 O WAT 8569 8.427 24.242 69.769 1.00 0.00 O ATOM 43954 H1 WAT 8569 8.505 23.729 68.964 1.00 0.00 H ATOM 43955 H2 WAT 8569 9.127 23.912 70.332 1.00 0.00 H TER 43957 WAT 8569 ATOM 43957 O WAT 8570 115.557 66.929 124.620 1.00 0.00 O ATOM 43958 H1 WAT 8570 114.794 67.472 124.817 1.00 0.00 H ATOM 43959 H2 WAT 8570 115.959 67.348 123.860 1.00 0.00 H TER 43961 WAT 8570 ATOM 43961 O WAT 8571 0.816 77.510 9.284 1.00 0.00 O ATOM 43962 H1 WAT 8571 0.191 78.228 9.379 1.00 0.00 H ATOM 43963 H2 WAT 8571 1.355 77.759 8.533 1.00 0.00 H TER 43965 WAT 8571 ATOM 43965 O WAT 8572 60.389 14.620 7.685 1.00 0.00 O ATOM 43966 H1 WAT 8572 60.257 13.833 7.156 1.00 0.00 H ATOM 43967 H2 WAT 8572 59.550 15.079 7.644 1.00 0.00 H TER 43969 WAT 8572 ATOM 43969 O WAT 8573 52.256 44.599 104.547 1.00 0.00 O ATOM 43970 H1 WAT 8573 53.212 44.580 104.503 1.00 0.00 H ATOM 43971 H2 WAT 8573 51.986 44.992 103.717 1.00 0.00 H TER 43973 WAT 8573 ATOM 43973 O WAT 8574 41.443 16.726 105.382 1.00 0.00 O ATOM 43974 H1 WAT 8574 41.730 17.638 105.370 1.00 0.00 H ATOM 43975 H2 WAT 8574 41.343 16.493 104.459 1.00 0.00 H TER 43977 WAT 8574 ATOM 43977 O WAT 8575 35.693 99.174 62.309 1.00 0.00 O ATOM 43978 H1 WAT 8575 34.972 98.958 61.718 1.00 0.00 H ATOM 43979 H2 WAT 8575 35.672 100.129 62.375 1.00 0.00 H TER 43981 WAT 8575 ATOM 43981 O WAT 8576 64.360 73.808 9.982 1.00 0.00 O ATOM 43982 H1 WAT 8576 64.882 73.226 10.535 1.00 0.00 H ATOM 43983 H2 WAT 8576 63.823 74.306 10.598 1.00 0.00 H TER 43985 WAT 8576 ATOM 43985 O WAT 8577 4.393 44.782 110.761 1.00 0.00 O ATOM 43986 H1 WAT 8577 3.931 45.167 110.016 1.00 0.00 H ATOM 43987 H2 WAT 8577 4.066 43.883 110.806 1.00 0.00 H TER 43989 WAT 8577 ATOM 43989 O WAT 8578 132.004 50.479 129.161 1.00 0.00 O ATOM 43990 H1 WAT 8578 131.221 50.488 129.711 1.00 0.00 H ATOM 43991 H2 WAT 8578 131.867 49.746 128.561 1.00 0.00 H TER 43993 WAT 8578 ATOM 43993 O WAT 8579 10.712 51.445 93.816 1.00 0.00 O ATOM 43994 H1 WAT 8579 9.834 51.521 93.442 1.00 0.00 H ATOM 43995 H2 WAT 8579 10.960 50.534 93.660 1.00 0.00 H TER 43997 WAT 8579 ATOM 43997 O WAT 8580 66.670 9.131 105.788 1.00 0.00 O ATOM 43998 H1 WAT 8580 66.511 9.757 106.494 1.00 0.00 H ATOM 43999 H2 WAT 8580 66.094 9.418 105.079 1.00 0.00 H TER 44001 WAT 8580 ATOM 44001 O WAT 8581 84.026 6.790 1.619 1.00 0.00 O ATOM 44002 H1 WAT 8581 84.717 6.138 1.508 1.00 0.00 H ATOM 44003 H2 WAT 8581 84.415 7.607 1.304 1.00 0.00 H TER 44005 WAT 8581 ATOM 44005 O WAT 8582 119.948 62.693 110.782 1.00 0.00 O ATOM 44006 H1 WAT 8582 119.429 63.494 110.857 1.00 0.00 H ATOM 44007 H2 WAT 8582 119.324 62.030 110.489 1.00 0.00 H TER 44009 WAT 8582 ATOM 44009 O WAT 8583 101.599 96.909 24.528 1.00 0.00 O ATOM 44010 H1 WAT 8583 100.872 97.426 24.875 1.00 0.00 H ATOM 44011 H2 WAT 8583 101.869 96.354 25.260 1.00 0.00 H TER 44013 WAT 8583 ATOM 44013 O WAT 8584 69.757 116.296 101.794 1.00 0.00 O ATOM 44014 H1 WAT 8584 69.373 116.893 101.153 1.00 0.00 H ATOM 44015 H2 WAT 8584 70.108 115.575 101.271 1.00 0.00 H TER 44017 WAT 8584 ATOM 44017 O WAT 8585 9.780 3.287 153.133 1.00 0.00 O ATOM 44018 H1 WAT 8585 9.348 2.800 152.431 1.00 0.00 H ATOM 44019 H2 WAT 8585 9.954 2.631 153.808 1.00 0.00 H TER 44021 WAT 8585 ATOM 44021 O WAT 8586 120.737 59.805 73.321 1.00 0.00 O ATOM 44022 H1 WAT 8586 121.255 59.917 74.119 1.00 0.00 H ATOM 44023 H2 WAT 8586 121.345 59.412 72.695 1.00 0.00 H TER 44025 WAT 8586 ATOM 44025 O WAT 8587 50.926 116.020 106.646 1.00 0.00 O ATOM 44026 H1 WAT 8587 50.774 116.832 106.163 1.00 0.00 H ATOM 44027 H2 WAT 8587 51.827 116.093 106.960 1.00 0.00 H TER 44029 WAT 8587 ATOM 44029 O WAT 8588 123.557 5.483 141.333 1.00 0.00 O ATOM 44030 H1 WAT 8588 122.618 5.328 141.226 1.00 0.00 H ATOM 44031 H2 WAT 8588 123.646 5.800 142.232 1.00 0.00 H TER 44033 WAT 8588 ATOM 44033 O WAT 8589 70.720 46.242 0.058 1.00 0.00 O ATOM 44034 H1 WAT 8589 70.148 47.005 0.142 1.00 0.00 H ATOM 44035 H2 WAT 8589 70.123 45.494 0.056 1.00 0.00 H TER 44037 WAT 8589 ATOM 44037 O WAT 8590 113.142 35.504 149.446 1.00 0.00 O ATOM 44038 H1 WAT 8590 112.623 35.681 148.661 1.00 0.00 H ATOM 44039 H2 WAT 8590 113.148 34.550 149.519 1.00 0.00 H TER 44041 WAT 8590 ATOM 44041 O WAT 8591 102.861 136.564 57.192 1.00 0.00 O ATOM 44042 H1 WAT 8591 102.981 135.629 57.029 1.00 0.00 H ATOM 44043 H2 WAT 8591 103.740 136.886 57.394 1.00 0.00 H TER 44045 WAT 8591 ATOM 44045 O WAT 8592 92.664 7.737 103.001 1.00 0.00 O ATOM 44046 H1 WAT 8592 92.434 7.833 102.077 1.00 0.00 H ATOM 44047 H2 WAT 8592 93.187 8.514 103.199 1.00 0.00 H TER 44049 WAT 8592 ATOM 44049 O WAT 8593 66.790 17.569 148.122 1.00 0.00 O ATOM 44050 H1 WAT 8593 65.986 17.428 147.621 1.00 0.00 H ATOM 44051 H2 WAT 8593 66.491 17.930 148.956 1.00 0.00 H TER 44053 WAT 8593 ATOM 44053 O WAT 8594 81.366 95.483 66.153 1.00 0.00 O ATOM 44054 H1 WAT 8594 80.412 95.423 66.095 1.00 0.00 H ATOM 44055 H2 WAT 8594 81.585 95.044 66.975 1.00 0.00 H TER 44057 WAT 8594 ATOM 44057 O WAT 8595 124.656 145.981 66.301 1.00 0.00 O ATOM 44058 H1 WAT 8595 123.961 145.765 66.923 1.00 0.00 H ATOM 44059 H2 WAT 8595 124.351 145.621 65.468 1.00 0.00 H TER 44061 WAT 8595 ATOM 44061 O WAT 8596 69.036 144.687 111.625 1.00 0.00 O ATOM 44062 H1 WAT 8596 69.520 145.387 111.188 1.00 0.00 H ATOM 44063 H2 WAT 8596 68.994 143.984 110.976 1.00 0.00 H TER 44065 WAT 8596 ATOM 44065 O WAT 8597 81.464 104.941 157.347 1.00 0.00 O ATOM 44066 H1 WAT 8597 81.743 104.124 156.933 1.00 0.00 H ATOM 44067 H2 WAT 8597 82.150 105.131 157.987 1.00 0.00 H TER 44069 WAT 8597 ATOM 44069 O WAT 8598 24.034 26.066 145.811 1.00 0.00 O ATOM 44070 H1 WAT 8598 23.996 26.435 146.693 1.00 0.00 H ATOM 44071 H2 WAT 8598 23.156 25.716 145.659 1.00 0.00 H TER 44073 WAT 8598 ATOM 44073 O WAT 8599 57.068 61.542 105.532 1.00 0.00 O ATOM 44074 H1 WAT 8599 56.345 62.143 105.711 1.00 0.00 H ATOM 44075 H2 WAT 8599 57.780 61.851 106.091 1.00 0.00 H TER 44077 WAT 8599 ATOM 44077 O WAT 8600 12.882 61.265 104.585 1.00 0.00 O ATOM 44078 H1 WAT 8600 13.352 61.517 103.790 1.00 0.00 H ATOM 44079 H2 WAT 8600 12.133 61.860 104.620 1.00 0.00 H TER 44081 WAT 8600 ATOM 44081 O WAT 8601 141.295 5.387 120.817 1.00 0.00 O ATOM 44082 H1 WAT 8601 141.197 4.724 121.501 1.00 0.00 H ATOM 44083 H2 WAT 8601 140.435 5.804 120.762 1.00 0.00 H TER 44085 WAT 8601 ATOM 44085 O WAT 8602 1.727 142.582 143.659 1.00 0.00 O ATOM 44086 H1 WAT 8602 2.335 143.260 143.362 1.00 0.00 H ATOM 44087 H2 WAT 8602 0.859 142.962 143.522 1.00 0.00 H TER 44089 WAT 8602 ATOM 44089 O WAT 8603 44.465 74.016 92.946 1.00 0.00 O ATOM 44090 H1 WAT 8603 43.807 73.337 92.796 1.00 0.00 H ATOM 44091 H2 WAT 8603 44.139 74.777 92.465 1.00 0.00 H TER 44093 WAT 8603 ATOM 44093 O WAT 8604 14.093 1.872 63.441 1.00 0.00 O ATOM 44094 H1 WAT 8604 13.991 2.122 62.522 1.00 0.00 H ATOM 44095 H2 WAT 8604 14.222 2.700 63.902 1.00 0.00 H TER 44097 WAT 8604 ATOM 44097 O WAT 8605 128.756 82.647 136.348 1.00 0.00 O ATOM 44098 H1 WAT 8605 128.853 82.329 135.451 1.00 0.00 H ATOM 44099 H2 WAT 8605 127.833 82.891 136.417 1.00 0.00 H TER 44101 WAT 8605 ATOM 44101 O WAT 8606 119.772 31.154 86.741 1.00 0.00 O ATOM 44102 H1 WAT 8606 119.859 30.222 86.545 1.00 0.00 H ATOM 44103 H2 WAT 8606 120.668 31.490 86.711 1.00 0.00 H TER 44105 WAT 8606 ATOM 44105 O WAT 8607 92.120 66.888 150.527 1.00 0.00 O ATOM 44106 H1 WAT 8607 91.816 67.767 150.305 1.00 0.00 H ATOM 44107 H2 WAT 8607 92.786 66.691 149.868 1.00 0.00 H TER 44109 WAT 8607 ATOM 44109 O WAT 8608 145.770 60.689 151.519 1.00 0.00 O ATOM 44110 H1 WAT 8608 146.036 59.865 151.926 1.00 0.00 H ATOM 44111 H2 WAT 8608 145.358 61.184 152.227 1.00 0.00 H TER 44113 WAT 8608 ATOM 44113 O WAT 8609 67.306 0.547 109.639 1.00 0.00 O ATOM 44114 H1 WAT 8609 67.531 0.723 110.552 1.00 0.00 H ATOM 44115 H2 WAT 8609 66.715 -0.205 109.678 1.00 0.00 H TER 44117 WAT 8609 ATOM 44117 O WAT 8610 85.433 109.830 -0.112 1.00 0.00 O ATOM 44118 H1 WAT 8610 84.498 109.824 -0.318 1.00 0.00 H ATOM 44119 H2 WAT 8610 85.469 109.754 0.841 1.00 0.00 H TER 44121 WAT 8610 ATOM 44121 O WAT 8611 110.630 48.039 89.020 1.00 0.00 O ATOM 44122 H1 WAT 8611 110.846 47.411 89.709 1.00 0.00 H ATOM 44123 H2 WAT 8611 111.279 47.876 88.336 1.00 0.00 H TER 44125 WAT 8611 ATOM 44125 O WAT 8612 142.651 52.568 87.261 1.00 0.00 O ATOM 44126 H1 WAT 8612 142.407 53.335 86.742 1.00 0.00 H ATOM 44127 H2 WAT 8612 143.340 52.143 86.752 1.00 0.00 H TER 44129 WAT 8612 ATOM 44129 O WAT 8613 74.138 133.967 108.762 1.00 0.00 O ATOM 44130 H1 WAT 8613 73.936 133.585 109.616 1.00 0.00 H ATOM 44131 H2 WAT 8613 74.976 133.575 108.517 1.00 0.00 H TER 44133 WAT 8613 ATOM 44133 O WAT 8614 82.063 95.801 157.498 1.00 0.00 O ATOM 44134 H1 WAT 8614 81.220 96.110 157.166 1.00 0.00 H ATOM 44135 H2 WAT 8614 81.884 95.544 158.403 1.00 0.00 H TER 44137 WAT 8614 ATOM 44137 O WAT 8615 56.684 65.099 65.180 1.00 0.00 O ATOM 44138 H1 WAT 8615 56.385 65.905 64.759 1.00 0.00 H ATOM 44139 H2 WAT 8615 57.359 65.387 65.795 1.00 0.00 H TER 44141 WAT 8615 ATOM 44141 O WAT 8616 145.046 65.473 121.111 1.00 0.00 O ATOM 44142 H1 WAT 8616 145.770 65.113 121.623 1.00 0.00 H ATOM 44143 H2 WAT 8616 144.496 64.716 120.908 1.00 0.00 H TER 44145 WAT 8616 ATOM 44145 O WAT 8617 58.009 7.929 12.969 1.00 0.00 O ATOM 44146 H1 WAT 8617 58.393 8.351 13.738 1.00 0.00 H ATOM 44147 H2 WAT 8617 57.590 8.642 12.488 1.00 0.00 H TER 44149 WAT 8617 ATOM 44149 O WAT 8618 36.669 134.249 158.420 1.00 0.00 O ATOM 44150 H1 WAT 8618 36.806 133.338 158.680 1.00 0.00 H ATOM 44151 H2 WAT 8618 36.038 134.587 159.055 1.00 0.00 H TER 44153 WAT 8618 ATOM 44153 O WAT 8619 43.054 33.293 57.030 1.00 0.00 O ATOM 44154 H1 WAT 8619 42.492 33.910 57.497 1.00 0.00 H ATOM 44155 H2 WAT 8619 42.446 32.715 56.569 1.00 0.00 H TER 44157 WAT 8619 ATOM 44157 O WAT 8620 89.974 72.829 104.377 1.00 0.00 O ATOM 44158 H1 WAT 8620 89.156 72.356 104.220 1.00 0.00 H ATOM 44159 H2 WAT 8620 89.738 73.752 104.286 1.00 0.00 H TER 44161 WAT 8620 ATOM 44161 O WAT 8621 2.785 1.103 144.001 1.00 0.00 O ATOM 44162 H1 WAT 8621 3.141 1.858 143.534 1.00 0.00 H ATOM 44163 H2 WAT 8621 3.339 1.017 144.777 1.00 0.00 H TER 44165 WAT 8621 ATOM 44165 O WAT 8622 13.220 135.883 16.642 1.00 0.00 O ATOM 44166 H1 WAT 8622 12.581 136.482 17.028 1.00 0.00 H ATOM 44167 H2 WAT 8622 12.743 135.449 15.933 1.00 0.00 H TER 44169 WAT 8622 ATOM 44169 O WAT 8623 22.379 114.345 82.130 1.00 0.00 O ATOM 44170 H1 WAT 8623 22.069 113.744 81.453 1.00 0.00 H ATOM 44171 H2 WAT 8623 21.615 114.492 82.688 1.00 0.00 H TER 44173 WAT 8623 ATOM 44173 O WAT 8624 60.479 88.232 116.521 1.00 0.00 O ATOM 44174 H1 WAT 8624 61.384 87.921 116.543 1.00 0.00 H ATOM 44175 H2 WAT 8624 60.361 88.682 117.358 1.00 0.00 H TER 44177 WAT 8624 ATOM 44177 O WAT 8625 128.790 21.835 86.664 1.00 0.00 O ATOM 44178 H1 WAT 8625 129.726 21.964 86.506 1.00 0.00 H ATOM 44179 H2 WAT 8625 128.371 22.584 86.240 1.00 0.00 H TER 44181 WAT 8625 ATOM 44181 O WAT 8626 78.046 130.766 129.931 1.00 0.00 O ATOM 44182 H1 WAT 8626 77.297 130.436 129.435 1.00 0.00 H ATOM 44183 H2 WAT 8626 78.377 130.002 130.404 1.00 0.00 H TER 44185 WAT 8626 ATOM 44185 O WAT 8627 109.345 128.470 102.464 1.00 0.00 O ATOM 44186 H1 WAT 8627 109.650 128.209 101.595 1.00 0.00 H ATOM 44187 H2 WAT 8627 108.507 128.020 102.569 1.00 0.00 H TER 44189 WAT 8627 ATOM 44189 O WAT 8628 96.611 23.887 71.665 1.00 0.00 O ATOM 44190 H1 WAT 8628 95.983 24.602 71.566 1.00 0.00 H ATOM 44191 H2 WAT 8628 97.410 24.210 71.248 1.00 0.00 H TER 44193 WAT 8628 ATOM 44193 O WAT 8629 117.715 17.380 10.101 1.00 0.00 O ATOM 44194 H1 WAT 8629 117.282 18.212 10.292 1.00 0.00 H ATOM 44195 H2 WAT 8629 117.836 16.971 10.958 1.00 0.00 H TER 44197 WAT 8629 ATOM 44197 O WAT 8630 130.409 34.024 98.420 1.00 0.00 O ATOM 44198 H1 WAT 8630 130.778 33.334 98.971 1.00 0.00 H ATOM 44199 H2 WAT 8630 131.162 34.557 98.166 1.00 0.00 H TER 44201 WAT 8630 ATOM 44201 O WAT 8631 73.200 98.120 100.212 1.00 0.00 O ATOM 44202 H1 WAT 8631 73.079 98.657 99.429 1.00 0.00 H ATOM 44203 H2 WAT 8631 72.649 97.352 100.064 1.00 0.00 H TER 44205 WAT 8631 ATOM 44205 O WAT 8632 40.207 109.789 65.032 1.00 0.00 O ATOM 44206 H1 WAT 8632 39.774 108.974 64.778 1.00 0.00 H ATOM 44207 H2 WAT 8632 39.994 110.403 64.328 1.00 0.00 H TER 44209 WAT 8632 ATOM 44209 O WAT 8633 98.121 82.849 70.601 1.00 0.00 O ATOM 44210 H1 WAT 8633 99.040 82.597 70.509 1.00 0.00 H ATOM 44211 H2 WAT 8633 97.874 83.171 69.734 1.00 0.00 H TER 44213 WAT 8633 ATOM 44213 O WAT 8634 0.957 136.540 58.942 1.00 0.00 O ATOM 44214 H1 WAT 8634 1.078 135.779 58.374 1.00 0.00 H ATOM 44215 H2 WAT 8634 0.887 137.280 58.339 1.00 0.00 H TER 44217 WAT 8634 ATOM 44217 O WAT 8635 62.578 49.126 142.368 1.00 0.00 O ATOM 44218 H1 WAT 8635 63.216 48.437 142.182 1.00 0.00 H ATOM 44219 H2 WAT 8635 61.801 48.656 142.671 1.00 0.00 H TER 44221 WAT 8635 ATOM 44221 O WAT 8636 37.863 127.259 150.796 1.00 0.00 O ATOM 44222 H1 WAT 8636 36.958 127.020 150.995 1.00 0.00 H ATOM 44223 H2 WAT 8636 37.822 128.190 150.575 1.00 0.00 H TER 44225 WAT 8636 ATOM 44225 O WAT 8637 36.694 124.200 51.163 1.00 0.00 O ATOM 44226 H1 WAT 8637 36.437 124.578 52.003 1.00 0.00 H ATOM 44227 H2 WAT 8637 36.302 124.778 50.509 1.00 0.00 H TER 44229 WAT 8637 ATOM 44229 O WAT 8638 19.773 6.732 96.978 1.00 0.00 O ATOM 44230 H1 WAT 8638 18.921 6.480 96.620 1.00 0.00 H ATOM 44231 H2 WAT 8638 20.353 6.006 96.750 1.00 0.00 H TER 44233 WAT 8638 ATOM 44233 O WAT 8639 20.477 90.886 129.835 1.00 0.00 O ATOM 44234 H1 WAT 8639 20.534 90.187 130.486 1.00 0.00 H ATOM 44235 H2 WAT 8639 20.153 90.453 129.045 1.00 0.00 H TER 44237 WAT 8639 ATOM 44237 O WAT 8640 85.881 37.131 16.779 1.00 0.00 O ATOM 44238 H1 WAT 8640 85.790 37.741 17.512 1.00 0.00 H ATOM 44239 H2 WAT 8640 86.348 37.630 16.109 1.00 0.00 H TER 44241 WAT 8640 ATOM 44241 O WAT 8641 78.642 127.578 138.401 1.00 0.00 O ATOM 44242 H1 WAT 8641 78.179 128.182 138.981 1.00 0.00 H ATOM 44243 H2 WAT 8641 78.016 127.391 137.701 1.00 0.00 H TER 44245 WAT 8641 ATOM 44245 O WAT 8642 37.355 95.396 122.561 1.00 0.00 O ATOM 44246 H1 WAT 8642 37.728 94.524 122.689 1.00 0.00 H ATOM 44247 H2 WAT 8642 36.549 95.243 122.069 1.00 0.00 H TER 44249 WAT 8642 ATOM 44249 O WAT 8643 71.367 106.654 129.657 1.00 0.00 O ATOM 44250 H1 WAT 8643 72.062 107.144 130.097 1.00 0.00 H ATOM 44251 H2 WAT 8643 71.466 106.877 128.731 1.00 0.00 H TER 44253 WAT 8643 ATOM 44253 O WAT 8644 128.625 5.555 145.417 1.00 0.00 O ATOM 44254 H1 WAT 8644 128.236 6.425 145.328 1.00 0.00 H ATOM 44255 H2 WAT 8644 128.367 5.094 144.620 1.00 0.00 H TER 44257 WAT 8644 ATOM 44257 O WAT 8645 16.039 32.288 1.196 1.00 0.00 O ATOM 44258 H1 WAT 8645 16.776 31.803 0.826 1.00 0.00 H ATOM 44259 H2 WAT 8645 15.668 32.764 0.454 1.00 0.00 H TER 44261 WAT 8645 ATOM 44261 O WAT 8646 93.927 88.244 55.717 1.00 0.00 O ATOM 44262 H1 WAT 8646 94.170 87.323 55.818 1.00 0.00 H ATOM 44263 H2 WAT 8646 92.970 88.241 55.724 1.00 0.00 H TER 44265 WAT 8646 ATOM 44265 O WAT 8647 47.671 119.982 50.763 1.00 0.00 O ATOM 44266 H1 WAT 8647 47.786 119.797 51.695 1.00 0.00 H ATOM 44267 H2 WAT 8647 46.779 120.324 50.695 1.00 0.00 H TER 44269 WAT 8647 ATOM 44269 O WAT 8648 141.302 44.164 70.592 1.00 0.00 O ATOM 44270 H1 WAT 8648 142.017 43.667 70.990 1.00 0.00 H ATOM 44271 H2 WAT 8648 141.441 45.063 70.890 1.00 0.00 H TER 44273 WAT 8648 ATOM 44273 O WAT 8649 124.854 108.153 2.631 1.00 0.00 O ATOM 44274 H1 WAT 8649 125.247 109.024 2.689 1.00 0.00 H ATOM 44275 H2 WAT 8649 124.730 108.008 1.694 1.00 0.00 H TER 44277 WAT 8649 ATOM 44277 O WAT 8650 121.958 79.159 73.131 1.00 0.00 O ATOM 44278 H1 WAT 8650 121.479 79.902 72.764 1.00 0.00 H ATOM 44279 H2 WAT 8650 122.037 78.542 72.403 1.00 0.00 H TER 44281 WAT 8650 ATOM 44281 O WAT 8651 66.812 50.460 143.447 1.00 0.00 O ATOM 44282 H1 WAT 8651 66.317 49.875 142.873 1.00 0.00 H ATOM 44283 H2 WAT 8651 66.299 51.268 143.464 1.00 0.00 H TER 44285 WAT 8651 ATOM 44285 O WAT 8652 85.012 18.805 2.326 1.00 0.00 O ATOM 44286 H1 WAT 8652 85.757 18.287 2.019 1.00 0.00 H ATOM 44287 H2 WAT 8652 84.792 19.370 1.586 1.00 0.00 H TER 44289 WAT 8652 ATOM 44289 O WAT 8653 141.969 122.530 112.673 1.00 0.00 O ATOM 44290 H1 WAT 8653 142.124 121.598 112.521 1.00 0.00 H ATOM 44291 H2 WAT 8653 141.032 122.589 112.861 1.00 0.00 H TER 44293 WAT 8653 ATOM 44293 O WAT 8654 132.175 57.051 122.942 1.00 0.00 O ATOM 44294 H1 WAT 8654 131.295 57.286 123.236 1.00 0.00 H ATOM 44295 H2 WAT 8654 132.353 57.650 122.217 1.00 0.00 H TER 44297 WAT 8654 ATOM 44297 O WAT 8655 144.625 41.156 87.866 1.00 0.00 O ATOM 44298 H1 WAT 8655 145.253 41.874 87.783 1.00 0.00 H ATOM 44299 H2 WAT 8655 144.221 41.090 87.001 1.00 0.00 H TER 44301 WAT 8655 ATOM 44301 O WAT 8656 101.631 101.587 133.662 1.00 0.00 O ATOM 44302 H1 WAT 8656 101.014 101.402 134.371 1.00 0.00 H ATOM 44303 H2 WAT 8656 101.895 100.724 133.344 1.00 0.00 H TER 44305 WAT 8656 ATOM 44305 O WAT 8657 62.107 88.833 6.475 1.00 0.00 O ATOM 44306 H1 WAT 8657 61.307 88.575 6.019 1.00 0.00 H ATOM 44307 H2 WAT 8657 62.021 88.448 7.347 1.00 0.00 H TER 44309 WAT 8657 ATOM 44309 O WAT 8658 102.172 35.581 71.542 1.00 0.00 O ATOM 44310 H1 WAT 8658 101.896 35.290 70.673 1.00 0.00 H ATOM 44311 H2 WAT 8658 102.782 34.905 71.839 1.00 0.00 H TER 44313 WAT 8658 ATOM 44313 O WAT 8659 132.276 40.670 102.313 1.00 0.00 O ATOM 44314 H1 WAT 8659 133.087 41.070 102.626 1.00 0.00 H ATOM 44315 H2 WAT 8659 131.987 40.115 103.038 1.00 0.00 H TER 44317 WAT 8659 ATOM 44317 O WAT 8660 143.331 124.323 17.681 1.00 0.00 O ATOM 44318 H1 WAT 8660 143.231 124.816 18.495 1.00 0.00 H ATOM 44319 H2 WAT 8660 142.449 124.010 17.480 1.00 0.00 H TER 44321 WAT 8660 ATOM 44321 O WAT 8661 127.862 17.363 82.643 1.00 0.00 O ATOM 44322 H1 WAT 8661 127.176 16.822 82.253 1.00 0.00 H ATOM 44323 H2 WAT 8661 127.426 17.823 83.360 1.00 0.00 H TER 44325 WAT 8661 ATOM 44325 O WAT 8662 30.811 122.788 102.329 1.00 0.00 O ATOM 44326 H1 WAT 8662 31.475 122.660 103.007 1.00 0.00 H ATOM 44327 H2 WAT 8662 31.312 122.948 101.530 1.00 0.00 H TER 44329 WAT 8662 ATOM 44329 O WAT 8663 56.148 122.775 3.309 1.00 0.00 O ATOM 44330 H1 WAT 8663 55.927 122.464 4.187 1.00 0.00 H ATOM 44331 H2 WAT 8663 55.972 122.026 2.740 1.00 0.00 H TER 44333 WAT 8663 ATOM 44333 O WAT 8664 103.487 97.916 1.488 1.00 0.00 O ATOM 44334 H1 WAT 8664 103.215 98.628 0.909 1.00 0.00 H ATOM 44335 H2 WAT 8664 102.978 97.160 1.194 1.00 0.00 H TER 44337 WAT 8664 ATOM 44337 O WAT 8665 37.768 80.177 133.684 1.00 0.00 O ATOM 44338 H1 WAT 8665 37.313 80.471 132.895 1.00 0.00 H ATOM 44339 H2 WAT 8665 38.025 79.275 133.490 1.00 0.00 H TER 44341 WAT 8665 ATOM 44341 O WAT 8666 141.288 120.114 17.699 1.00 0.00 O ATOM 44342 H1 WAT 8666 140.494 120.601 17.919 1.00 0.00 H ATOM 44343 H2 WAT 8666 141.011 119.197 17.689 1.00 0.00 H TER 44345 WAT 8666 ATOM 44345 O WAT 8667 126.989 14.901 4.699 1.00 0.00 O ATOM 44346 H1 WAT 8667 126.751 14.101 5.167 1.00 0.00 H ATOM 44347 H2 WAT 8667 126.213 15.114 4.179 1.00 0.00 H TER 44349 WAT 8667 ATOM 44349 O WAT 8668 18.981 118.415 126.057 1.00 0.00 O ATOM 44350 H1 WAT 8668 19.038 118.973 125.281 1.00 0.00 H ATOM 44351 H2 WAT 8668 18.119 118.005 125.994 1.00 0.00 H TER 44353 WAT 8668 ATOM 44353 O WAT 8669 80.655 3.940 155.459 1.00 0.00 O ATOM 44354 H1 WAT 8669 79.832 3.826 154.984 1.00 0.00 H ATOM 44355 H2 WAT 8669 81.059 4.709 155.056 1.00 0.00 H TER 44357 WAT 8669 ATOM 44357 O WAT 8670 121.088 60.439 116.373 1.00 0.00 O ATOM 44358 H1 WAT 8670 121.397 60.345 115.472 1.00 0.00 H ATOM 44359 H2 WAT 8670 120.278 59.929 116.402 1.00 0.00 H TER 44361 WAT 8670 ATOM 44361 O WAT 8671 44.898 132.640 90.526 1.00 0.00 O ATOM 44362 H1 WAT 8671 44.147 132.801 89.956 1.00 0.00 H ATOM 44363 H2 WAT 8671 45.387 131.943 90.088 1.00 0.00 H TER 44365 WAT 8671 ATOM 44365 O WAT 8672 93.190 22.957 7.562 1.00 0.00 O ATOM 44366 H1 WAT 8672 94.001 23.251 7.976 1.00 0.00 H ATOM 44367 H2 WAT 8672 92.769 23.762 7.260 1.00 0.00 H TER 44369 WAT 8672 ATOM 44369 O WAT 8673 117.833 8.177 91.453 1.00 0.00 O ATOM 44370 H1 WAT 8673 117.727 9.116 91.302 1.00 0.00 H ATOM 44371 H2 WAT 8673 118.744 8.080 91.730 1.00 0.00 H TER 44373 WAT 8673 ATOM 44373 O WAT 8674 19.296 89.471 87.805 1.00 0.00 O ATOM 44374 H1 WAT 8674 19.380 88.535 87.987 1.00 0.00 H ATOM 44375 H2 WAT 8674 19.019 89.513 86.890 1.00 0.00 H TER 44377 WAT 8674 ATOM 44377 O WAT 8675 102.653 83.092 139.957 1.00 0.00 O ATOM 44378 H1 WAT 8675 102.085 82.376 140.243 1.00 0.00 H ATOM 44379 H2 WAT 8675 102.052 83.745 139.598 1.00 0.00 H TER 44381 WAT 8675 ATOM 44381 O WAT 8676 125.674 15.632 85.134 1.00 0.00 O ATOM 44382 H1 WAT 8676 125.892 14.937 84.512 1.00 0.00 H ATOM 44383 H2 WAT 8676 126.357 16.290 85.007 1.00 0.00 H TER 44385 WAT 8676 ATOM 44385 O WAT 8677 106.739 40.548 18.493 1.00 0.00 O ATOM 44386 H1 WAT 8677 107.570 40.990 18.665 1.00 0.00 H ATOM 44387 H2 WAT 8677 106.974 39.626 18.390 1.00 0.00 H TER 44389 WAT 8677 ATOM 44389 O WAT 8678 80.998 138.392 93.389 1.00 0.00 O ATOM 44390 H1 WAT 8678 81.542 138.746 94.092 1.00 0.00 H ATOM 44391 H2 WAT 8678 80.156 138.209 93.806 1.00 0.00 H TER 44393 WAT 8678 ATOM 44393 O WAT 8679 142.047 85.417 23.767 1.00 0.00 O ATOM 44394 H1 WAT 8679 141.798 85.228 24.671 1.00 0.00 H ATOM 44395 H2 WAT 8679 142.791 86.014 23.843 1.00 0.00 H TER 44397 WAT 8679 ATOM 44397 O WAT 8680 89.390 106.337 24.257 1.00 0.00 O ATOM 44398 H1 WAT 8680 89.487 105.430 23.970 1.00 0.00 H ATOM 44399 H2 WAT 8680 88.859 106.282 25.051 1.00 0.00 H TER 44401 WAT 8680 ATOM 44401 O WAT 8681 92.697 14.563 128.477 1.00 0.00 O ATOM 44402 H1 WAT 8681 92.638 13.611 128.553 1.00 0.00 H ATOM 44403 H2 WAT 8681 92.033 14.893 129.083 1.00 0.00 H TER 44405 WAT 8681 ATOM 44405 O WAT 8682 93.494 68.747 97.132 1.00 0.00 O ATOM 44406 H1 WAT 8682 93.873 69.149 96.350 1.00 0.00 H ATOM 44407 H2 WAT 8682 92.612 69.113 97.186 1.00 0.00 H TER 44409 WAT 8682 ATOM 44409 O WAT 8683 30.361 60.633 143.136 1.00 0.00 O ATOM 44410 H1 WAT 8683 30.093 61.482 143.489 1.00 0.00 H ATOM 44411 H2 WAT 8683 30.899 60.850 142.374 1.00 0.00 H TER 44413 WAT 8683 ATOM 44413 O WAT 8684 15.913 59.568 134.042 1.00 0.00 O ATOM 44414 H1 WAT 8684 16.770 59.880 133.752 1.00 0.00 H ATOM 44415 H2 WAT 8684 15.308 60.269 133.800 1.00 0.00 H TER 44417 WAT 8684 ATOM 44417 O WAT 8685 112.455 82.181 149.506 1.00 0.00 O ATOM 44418 H1 WAT 8685 113.078 82.546 150.135 1.00 0.00 H ATOM 44419 H2 WAT 8685 111.726 81.873 150.044 1.00 0.00 H TER 44421 WAT 8685 ATOM 44421 O WAT 8686 3.813 78.910 107.980 1.00 0.00 O ATOM 44422 H1 WAT 8686 3.487 78.015 107.889 1.00 0.00 H ATOM 44423 H2 WAT 8686 3.355 79.255 108.746 1.00 0.00 H TER 44425 WAT 8686 ATOM 44425 O WAT 8687 0.250 47.832 75.060 1.00 0.00 O ATOM 44426 H1 WAT 8687 -0.091 47.041 74.641 1.00 0.00 H ATOM 44427 H2 WAT 8687 -0.073 47.784 75.960 1.00 0.00 H TER 44429 WAT 8687 ATOM 44429 O WAT 8688 105.442 55.260 19.160 1.00 0.00 O ATOM 44430 H1 WAT 8688 105.804 55.050 20.021 1.00 0.00 H ATOM 44431 H2 WAT 8688 105.170 56.174 19.231 1.00 0.00 H TER 44433 WAT 8688 ATOM 44433 O WAT 8689 67.629 137.698 63.240 1.00 0.00 O ATOM 44434 H1 WAT 8689 67.759 137.128 63.998 1.00 0.00 H ATOM 44435 H2 WAT 8689 67.604 137.101 62.492 1.00 0.00 H TER 44437 WAT 8689 ATOM 44437 O WAT 8690 143.945 75.236 96.061 1.00 0.00 O ATOM 44438 H1 WAT 8690 144.273 75.146 96.956 1.00 0.00 H ATOM 44439 H2 WAT 8690 143.613 76.133 96.017 1.00 0.00 H TER 44441 WAT 8690 ATOM 44441 O WAT 8691 88.340 80.109 148.843 1.00 0.00 O ATOM 44442 H1 WAT 8691 87.474 80.315 149.194 1.00 0.00 H ATOM 44443 H2 WAT 8691 88.481 79.192 149.076 1.00 0.00 H TER 44445 WAT 8691 ATOM 44445 O WAT 8692 79.108 126.244 117.282 1.00 0.00 O ATOM 44446 H1 WAT 8692 79.507 125.518 117.760 1.00 0.00 H ATOM 44447 H2 WAT 8692 78.259 125.906 116.998 1.00 0.00 H TER 44449 WAT 8692 ATOM 44449 O WAT 8693 104.262 23.338 129.829 1.00 0.00 O ATOM 44450 H1 WAT 8693 104.189 24.204 129.427 1.00 0.00 H ATOM 44451 H2 WAT 8693 103.378 23.141 130.136 1.00 0.00 H TER 44453 WAT 8693 ATOM 44453 O WAT 8694 85.930 54.766 145.324 1.00 0.00 O ATOM 44454 H1 WAT 8694 85.052 54.998 145.625 1.00 0.00 H ATOM 44455 H2 WAT 8694 86.425 55.583 145.377 1.00 0.00 H TER 44457 WAT 8694 ATOM 44457 O WAT 8695 140.495 80.258 147.615 1.00 0.00 O ATOM 44458 H1 WAT 8695 140.492 79.310 147.480 1.00 0.00 H ATOM 44459 H2 WAT 8695 139.579 80.478 147.783 1.00 0.00 H TER 44461 WAT 8695 ATOM 44461 O WAT 8696 142.496 43.404 11.722 1.00 0.00 O ATOM 44462 H1 WAT 8696 143.115 42.683 11.837 1.00 0.00 H ATOM 44463 H2 WAT 8696 142.364 43.750 12.605 1.00 0.00 H TER 44465 WAT 8696 ATOM 44465 O WAT 8697 112.471 1.485 82.774 1.00 0.00 O ATOM 44466 H1 WAT 8697 111.897 1.889 82.123 1.00 0.00 H ATOM 44467 H2 WAT 8697 112.771 2.215 83.315 1.00 0.00 H TER 44469 WAT 8697 ATOM 44469 O WAT 8698 81.206 104.368 119.730 1.00 0.00 O ATOM 44470 H1 WAT 8698 81.733 103.962 120.418 1.00 0.00 H ATOM 44471 H2 WAT 8698 80.301 104.189 119.984 1.00 0.00 H TER 44473 WAT 8698 ATOM 44473 O WAT 8699 81.475 145.311 59.711 1.00 0.00 O ATOM 44474 H1 WAT 8699 82.061 145.194 58.963 1.00 0.00 H ATOM 44475 H2 WAT 8699 81.499 146.251 59.890 1.00 0.00 H TER 44477 WAT 8699 ATOM 44477 O WAT 8700 33.044 85.231 66.726 1.00 0.00 O ATOM 44478 H1 WAT 8700 33.267 85.924 67.347 1.00 0.00 H ATOM 44479 H2 WAT 8700 33.803 85.177 66.146 1.00 0.00 H TER 44481 WAT 8700 ATOM 44481 O WAT 8701 60.588 1.246 142.925 1.00 0.00 O ATOM 44482 H1 WAT 8701 60.119 0.939 142.149 1.00 0.00 H ATOM 44483 H2 WAT 8701 61.038 2.039 142.635 1.00 0.00 H TER 44485 WAT 8701 ATOM 44485 O WAT 8702 42.266 45.897 13.522 1.00 0.00 O ATOM 44486 H1 WAT 8702 43.002 45.285 13.535 1.00 0.00 H ATOM 44487 H2 WAT 8702 42.530 46.603 14.112 1.00 0.00 H TER 44489 WAT 8702 ATOM 44489 O WAT 8703 66.611 91.090 79.882 1.00 0.00 O ATOM 44490 H1 WAT 8703 66.933 90.532 79.175 1.00 0.00 H ATOM 44491 H2 WAT 8703 67.358 91.644 80.110 1.00 0.00 H TER 44493 WAT 8703 ATOM 44493 O WAT 8704 20.698 102.437 87.800 1.00 0.00 O ATOM 44494 H1 WAT 8704 21.468 101.874 87.725 1.00 0.00 H ATOM 44495 H2 WAT 8704 20.020 101.983 87.299 1.00 0.00 H TER 44497 WAT 8704 ATOM 44497 O WAT 8705 1.793 110.465 86.186 1.00 0.00 O ATOM 44498 H1 WAT 8705 1.043 110.867 85.746 1.00 0.00 H ATOM 44499 H2 WAT 8705 2.031 109.726 85.626 1.00 0.00 H TER 44501 WAT 8705 ATOM 44501 O WAT 8706 0.405 43.698 8.323 1.00 0.00 O ATOM 44502 H1 WAT 8706 -0.245 43.850 9.010 1.00 0.00 H ATOM 44503 H2 WAT 8706 1.247 43.853 8.751 1.00 0.00 H TER 44505 WAT 8706 ATOM 44505 O WAT 8707 4.656 6.103 80.062 1.00 0.00 O ATOM 44506 H1 WAT 8707 4.965 6.269 80.953 1.00 0.00 H ATOM 44507 H2 WAT 8707 5.453 5.924 79.562 1.00 0.00 H TER 44509 WAT 8707 ATOM 44509 O WAT 8708 42.072 144.865 12.834 1.00 0.00 O ATOM 44510 H1 WAT 8708 42.337 143.946 12.865 1.00 0.00 H ATOM 44511 H2 WAT 8708 42.803 145.311 12.405 1.00 0.00 H TER 44513 WAT 8708 ATOM 44513 O WAT 8709 108.175 123.282 153.843 1.00 0.00 O ATOM 44514 H1 WAT 8709 109.075 123.433 153.552 1.00 0.00 H ATOM 44515 H2 WAT 8709 108.075 123.842 154.613 1.00 0.00 H TER 44517 WAT 8709 ATOM 44517 O WAT 8710 119.206 135.337 68.123 1.00 0.00 O ATOM 44518 H1 WAT 8710 119.209 134.858 68.951 1.00 0.00 H ATOM 44519 H2 WAT 8710 118.380 135.821 68.129 1.00 0.00 H TER 44521 WAT 8710 ATOM 44521 O WAT 8711 50.540 64.085 115.862 1.00 0.00 O ATOM 44522 H1 WAT 8711 50.089 63.840 116.670 1.00 0.00 H ATOM 44523 H2 WAT 8711 50.008 63.702 115.165 1.00 0.00 H TER 44525 WAT 8711 ATOM 44525 O WAT 8712 49.712 123.803 115.169 1.00 0.00 O ATOM 44526 H1 WAT 8712 49.998 123.394 114.353 1.00 0.00 H ATOM 44527 H2 WAT 8712 50.410 123.605 115.794 1.00 0.00 H TER 44529 WAT 8712 ATOM 44529 O WAT 8713 73.191 18.902 5.086 1.00 0.00 O ATOM 44530 H1 WAT 8713 72.538 18.315 4.706 1.00 0.00 H ATOM 44531 H2 WAT 8713 72.874 19.070 5.974 1.00 0.00 H TER 44533 WAT 8713 ATOM 44533 O WAT 8714 33.751 101.029 130.269 1.00 0.00 O ATOM 44534 H1 WAT 8714 34.609 100.884 129.870 1.00 0.00 H ATOM 44535 H2 WAT 8714 33.186 100.370 129.866 1.00 0.00 H TER 44537 WAT 8714 ATOM 44537 O WAT 8715 83.417 43.977 64.505 1.00 0.00 O ATOM 44538 H1 WAT 8715 82.994 44.781 64.806 1.00 0.00 H ATOM 44539 H2 WAT 8715 82.691 43.380 64.323 1.00 0.00 H TER 44541 WAT 8715 ATOM 44541 O WAT 8716 3.360 96.338 131.479 1.00 0.00 O ATOM 44542 H1 WAT 8716 3.986 96.869 130.986 1.00 0.00 H ATOM 44543 H2 WAT 8716 2.613 96.241 130.889 1.00 0.00 H TER 44545 WAT 8716 ATOM 44545 O WAT 8717 123.584 70.117 126.064 1.00 0.00 O ATOM 44546 H1 WAT 8717 124.008 70.467 126.847 1.00 0.00 H ATOM 44547 H2 WAT 8717 123.961 69.244 125.956 1.00 0.00 H TER 44549 WAT 8717 ATOM 44549 O WAT 8718 91.289 9.821 114.731 1.00 0.00 O ATOM 44550 H1 WAT 8718 91.124 8.909 114.971 1.00 0.00 H ATOM 44551 H2 WAT 8718 92.243 9.904 114.748 1.00 0.00 H TER 44553 WAT 8718 ATOM 44553 O WAT 8719 122.024 144.715 22.849 1.00 0.00 O ATOM 44554 H1 WAT 8719 122.489 145.078 22.095 1.00 0.00 H ATOM 44555 H2 WAT 8719 122.570 143.983 23.138 1.00 0.00 H TER 44557 WAT 8719 ATOM 44557 O WAT 8720 39.966 44.176 119.481 1.00 0.00 O ATOM 44558 H1 WAT 8720 39.462 43.499 119.029 1.00 0.00 H ATOM 44559 H2 WAT 8720 39.342 44.575 120.087 1.00 0.00 H TER 44561 WAT 8720 ATOM 44561 O WAT 8721 21.071 131.679 64.491 1.00 0.00 O ATOM 44562 H1 WAT 8721 20.564 131.529 63.693 1.00 0.00 H ATOM 44563 H2 WAT 8721 21.696 132.364 64.253 1.00 0.00 H TER 44565 WAT 8721 ATOM 44565 O WAT 8722 28.353 21.581 127.365 1.00 0.00 O ATOM 44566 H1 WAT 8722 28.806 21.770 126.543 1.00 0.00 H ATOM 44567 H2 WAT 8722 28.093 20.663 127.290 1.00 0.00 H TER 44569 WAT 8722 ATOM 44569 O WAT 8723 105.014 5.525 18.818 1.00 0.00 O ATOM 44570 H1 WAT 8723 104.357 6.218 18.879 1.00 0.00 H ATOM 44571 H2 WAT 8723 105.807 5.972 18.523 1.00 0.00 H TER 44573 WAT 8723 ATOM 44573 O WAT 8724 27.657 124.969 141.326 1.00 0.00 O ATOM 44574 H1 WAT 8724 27.288 125.160 142.189 1.00 0.00 H ATOM 44575 H2 WAT 8724 28.568 125.256 141.387 1.00 0.00 H TER 44577 WAT 8724 ATOM 44577 O WAT 8725 96.141 23.703 102.345 1.00 0.00 O ATOM 44578 H1 WAT 8725 95.570 23.143 101.819 1.00 0.00 H ATOM 44579 H2 WAT 8725 96.825 23.986 101.738 1.00 0.00 H TER 44581 WAT 8725 ATOM 44581 O WAT 8726 74.704 110.687 110.201 1.00 0.00 O ATOM 44582 H1 WAT 8726 74.001 110.048 110.078 1.00 0.00 H ATOM 44583 H2 WAT 8726 74.798 110.760 111.151 1.00 0.00 H TER 44585 WAT 8726 ATOM 44585 O WAT 8727 3.773 35.572 158.472 1.00 0.00 O ATOM 44586 H1 WAT 8727 3.514 34.667 158.298 1.00 0.00 H ATOM 44587 H2 WAT 8727 2.967 36.077 158.360 1.00 0.00 H TER 44589 WAT 8727 ATOM 44589 O WAT 8728 68.029 88.812 83.902 1.00 0.00 O ATOM 44590 H1 WAT 8728 68.839 88.732 83.398 1.00 0.00 H ATOM 44591 H2 WAT 8728 67.364 89.041 83.253 1.00 0.00 H TER 44593 WAT 8728 ATOM 44593 O WAT 8729 145.368 80.612 107.588 1.00 0.00 O ATOM 44594 H1 WAT 8729 145.902 81.405 107.627 1.00 0.00 H ATOM 44595 H2 WAT 8729 144.759 80.698 108.321 1.00 0.00 H TER 44597 WAT 8729 ATOM 44597 O WAT 8730 43.273 105.776 62.264 1.00 0.00 O ATOM 44598 H1 WAT 8730 43.688 106.638 62.239 1.00 0.00 H ATOM 44599 H2 WAT 8730 42.806 105.711 61.431 1.00 0.00 H TER 44601 WAT 8730 ATOM 44601 O WAT 8731 66.293 101.152 149.129 1.00 0.00 O ATOM 44602 H1 WAT 8731 66.890 100.545 149.567 1.00 0.00 H ATOM 44603 H2 WAT 8731 65.840 100.615 148.479 1.00 0.00 H TER 44605 WAT 8731 ATOM 44605 O WAT 8732 118.788 136.110 131.965 1.00 0.00 O ATOM 44606 H1 WAT 8732 119.002 135.211 131.717 1.00 0.00 H ATOM 44607 H2 WAT 8732 119.637 136.546 132.039 1.00 0.00 H TER 44609 WAT 8732 ATOM 44609 O WAT 8733 53.280 26.194 143.608 1.00 0.00 O ATOM 44610 H1 WAT 8733 53.803 25.505 144.018 1.00 0.00 H ATOM 44611 H2 WAT 8733 53.864 26.953 143.581 1.00 0.00 H TER 44613 WAT 8733 ATOM 44613 O WAT 8734 22.903 111.385 128.826 1.00 0.00 O ATOM 44614 H1 WAT 8734 22.666 111.109 129.712 1.00 0.00 H ATOM 44615 H2 WAT 8734 22.797 112.336 128.836 1.00 0.00 H TER 44617 WAT 8734 ATOM 44617 O WAT 8735 101.190 29.301 131.924 1.00 0.00 O ATOM 44618 H1 WAT 8735 100.263 29.470 132.090 1.00 0.00 H ATOM 44619 H2 WAT 8735 101.651 29.828 132.576 1.00 0.00 H TER 44621 WAT 8735 ATOM 44621 O WAT 8736 120.256 51.836 79.355 1.00 0.00 O ATOM 44622 H1 WAT 8736 120.476 52.708 79.027 1.00 0.00 H ATOM 44623 H2 WAT 8736 121.063 51.522 79.762 1.00 0.00 H TER 44625 WAT 8736 ATOM 44625 O WAT 8737 83.551 104.293 76.016 1.00 0.00 O ATOM 44626 H1 WAT 8737 84.504 104.205 76.031 1.00 0.00 H ATOM 44627 H2 WAT 8737 83.390 105.204 76.263 1.00 0.00 H TER 44629 WAT 8737 ATOM 44629 O WAT 8738 102.566 124.575 117.958 1.00 0.00 O ATOM 44630 H1 WAT 8738 103.248 125.245 117.992 1.00 0.00 H ATOM 44631 H2 WAT 8738 102.067 124.699 118.766 1.00 0.00 H TER 44633 WAT 8738 ATOM 44633 O WAT 8739 57.853 54.952 100.621 1.00 0.00 O ATOM 44634 H1 WAT 8739 57.989 55.147 99.694 1.00 0.00 H ATOM 44635 H2 WAT 8739 58.627 54.449 100.876 1.00 0.00 H TER 44637 WAT 8739 ATOM 44637 O WAT 8740 6.084 22.883 10.551 1.00 0.00 O ATOM 44638 H1 WAT 8740 5.937 23.380 11.356 1.00 0.00 H ATOM 44639 H2 WAT 8740 5.236 22.485 10.357 1.00 0.00 H TER 44641 WAT 8740 ATOM 44641 O WAT 8741 66.965 109.662 99.714 1.00 0.00 O ATOM 44642 H1 WAT 8741 67.661 109.874 99.092 1.00 0.00 H ATOM 44643 H2 WAT 8741 67.414 109.218 100.433 1.00 0.00 H TER 44645 WAT 8741 ATOM 44645 O WAT 8742 0.337 103.505 141.697 1.00 0.00 O ATOM 44646 H1 WAT 8742 0.686 103.183 140.866 1.00 0.00 H ATOM 44647 H2 WAT 8742 -0.077 104.339 141.476 1.00 0.00 H TER 44649 WAT 8742 ATOM 44649 O WAT 8743 136.627 22.221 108.080 1.00 0.00 O ATOM 44650 H1 WAT 8743 137.561 22.015 108.051 1.00 0.00 H ATOM 44651 H2 WAT 8743 136.211 21.411 108.374 1.00 0.00 H TER 44653 WAT 8743 ATOM 44653 O WAT 8744 84.069 105.853 71.636 1.00 0.00 O ATOM 44654 H1 WAT 8744 83.535 105.879 72.431 1.00 0.00 H ATOM 44655 H2 WAT 8744 83.853 106.664 71.176 1.00 0.00 H TER 44657 WAT 8744 ATOM 44657 O WAT 8745 26.518 27.914 140.419 1.00 0.00 O ATOM 44658 H1 WAT 8745 26.550 27.526 141.294 1.00 0.00 H ATOM 44659 H2 WAT 8745 26.346 27.174 139.836 1.00 0.00 H TER 44661 WAT 8745 ATOM 44661 O WAT 8746 118.019 96.484 86.774 1.00 0.00 O ATOM 44662 H1 WAT 8746 118.678 96.162 86.158 1.00 0.00 H ATOM 44663 H2 WAT 8746 118.274 97.391 86.945 1.00 0.00 H TER 44665 WAT 8746 ATOM 44665 O WAT 8747 130.937 16.677 87.569 1.00 0.00 O ATOM 44666 H1 WAT 8747 131.517 16.653 86.807 1.00 0.00 H ATOM 44667 H2 WAT 8747 130.876 15.764 87.851 1.00 0.00 H TER 44669 WAT 8747 ATOM 44669 O WAT 8748 106.755 130.493 125.224 1.00 0.00 O ATOM 44670 H1 WAT 8748 107.322 130.034 125.844 1.00 0.00 H ATOM 44671 H2 WAT 8748 107.358 130.975 124.659 1.00 0.00 H TER 44673 WAT 8748 ATOM 44673 O WAT 8749 44.159 104.044 122.697 1.00 0.00 O ATOM 44674 H1 WAT 8749 44.589 104.782 122.266 1.00 0.00 H ATOM 44675 H2 WAT 8749 43.474 104.445 123.232 1.00 0.00 H TER 44677 WAT 8749 ATOM 44677 O WAT 8750 15.270 131.812 149.630 1.00 0.00 O ATOM 44678 H1 WAT 8750 14.982 131.217 150.322 1.00 0.00 H ATOM 44679 H2 WAT 8750 15.746 131.253 149.016 1.00 0.00 H TER 44681 WAT 8750 ATOM 44681 O WAT 8751 76.784 61.180 104.853 1.00 0.00 O ATOM 44682 H1 WAT 8751 77.411 60.543 105.196 1.00 0.00 H ATOM 44683 H2 WAT 8751 76.799 61.044 103.905 1.00 0.00 H TER 44685 WAT 8751 ATOM 44685 O WAT 8752 104.075 125.326 106.567 1.00 0.00 O ATOM 44686 H1 WAT 8752 104.758 125.399 105.901 1.00 0.00 H ATOM 44687 H2 WAT 8752 104.005 126.206 106.937 1.00 0.00 H TER 44689 WAT 8752 ATOM 44689 O WAT 8753 11.871 94.288 8.767 1.00 0.00 O ATOM 44690 H1 WAT 8753 11.307 93.517 8.824 1.00 0.00 H ATOM 44691 H2 WAT 8753 12.519 94.061 8.100 1.00 0.00 H TER 44693 WAT 8753 ATOM 44693 O WAT 8754 77.513 80.354 131.115 1.00 0.00 O ATOM 44694 H1 WAT 8754 77.893 81.102 130.653 1.00 0.00 H ATOM 44695 H2 WAT 8754 77.178 79.788 130.420 1.00 0.00 H TER 44697 WAT 8754 ATOM 44697 O WAT 8755 63.726 117.780 16.153 1.00 0.00 O ATOM 44698 H1 WAT 8755 63.008 117.884 15.528 1.00 0.00 H ATOM 44699 H2 WAT 8755 63.293 117.657 16.997 1.00 0.00 H TER 44701 WAT 8755 ATOM 44701 O WAT 8756 102.198 125.615 3.264 1.00 0.00 O ATOM 44702 H1 WAT 8756 102.453 126.440 2.851 1.00 0.00 H ATOM 44703 H2 WAT 8756 101.872 125.076 2.543 1.00 0.00 H TER 44705 WAT 8756 ATOM 44705 O WAT 8757 120.028 63.718 154.834 1.00 0.00 O ATOM 44706 H1 WAT 8757 120.755 64.226 155.193 1.00 0.00 H ATOM 44707 H2 WAT 8757 119.747 63.158 155.558 1.00 0.00 H TER 44709 WAT 8757 ATOM 44709 O WAT 8758 42.760 125.812 15.284 1.00 0.00 O ATOM 44710 H1 WAT 8758 43.281 125.509 16.027 1.00 0.00 H ATOM 44711 H2 WAT 8758 42.980 125.209 14.574 1.00 0.00 H TER 44713 WAT 8758 ATOM 44713 O WAT 8759 4.510 120.395 106.082 1.00 0.00 O ATOM 44714 H1 WAT 8759 4.701 121.057 106.746 1.00 0.00 H ATOM 44715 H2 WAT 8759 4.590 120.859 105.249 1.00 0.00 H TER 44717 WAT 8759 ATOM 44717 O WAT 8760 131.238 72.686 74.597 1.00 0.00 O ATOM 44718 H1 WAT 8760 131.776 72.000 74.199 1.00 0.00 H ATOM 44719 H2 WAT 8760 131.748 72.983 75.350 1.00 0.00 H TER 44721 WAT 8760 ATOM 44721 O WAT 8761 26.715 63.162 143.569 1.00 0.00 O ATOM 44722 H1 WAT 8761 25.810 63.295 143.852 1.00 0.00 H ATOM 44723 H2 WAT 8761 27.217 63.120 144.382 1.00 0.00 H TER 44725 WAT 8761 ATOM 44725 O WAT 8762 136.172 84.990 71.132 1.00 0.00 O ATOM 44726 H1 WAT 8762 135.580 84.241 71.068 1.00 0.00 H ATOM 44727 H2 WAT 8762 136.250 85.311 70.234 1.00 0.00 H TER 44729 WAT 8762 ATOM 44729 O WAT 8763 143.164 144.545 117.589 1.00 0.00 O ATOM 44730 H1 WAT 8763 143.191 144.316 118.518 1.00 0.00 H ATOM 44731 H2 WAT 8763 142.923 145.471 117.579 1.00 0.00 H TER 44733 WAT 8763 ATOM 44733 O WAT 8764 103.821 29.996 84.055 1.00 0.00 O ATOM 44734 H1 WAT 8764 104.495 29.401 84.385 1.00 0.00 H ATOM 44735 H2 WAT 8764 104.090 30.860 84.367 1.00 0.00 H TER 44737 WAT 8764 ATOM 44737 O WAT 8765 89.165 44.591 59.607 1.00 0.00 O ATOM 44738 H1 WAT 8765 89.358 44.226 60.471 1.00 0.00 H ATOM 44739 H2 WAT 8765 89.614 45.437 59.599 1.00 0.00 H TER 44741 WAT 8765 ATOM 44741 O WAT 8766 144.849 74.202 111.860 1.00 0.00 O ATOM 44742 H1 WAT 8766 144.426 74.184 112.719 1.00 0.00 H ATOM 44743 H2 WAT 8766 145.761 74.423 112.047 1.00 0.00 H TER 44745 WAT 8766 ATOM 44745 O WAT 8767 53.108 129.040 95.732 1.00 0.00 O ATOM 44746 H1 WAT 8767 52.529 129.565 96.284 1.00 0.00 H ATOM 44747 H2 WAT 8767 52.979 129.388 94.850 1.00 0.00 H TER 44749 WAT 8767 ATOM 44749 O WAT 8768 36.207 132.964 89.671 1.00 0.00 O ATOM 44750 H1 WAT 8768 35.753 133.665 90.139 1.00 0.00 H ATOM 44751 H2 WAT 8768 35.528 132.557 89.132 1.00 0.00 H TER 44753 WAT 8768 ATOM 44753 O WAT 8769 135.848 65.110 133.309 1.00 0.00 O ATOM 44754 H1 WAT 8769 135.490 65.992 133.207 1.00 0.00 H ATOM 44755 H2 WAT 8769 136.794 65.222 133.216 1.00 0.00 H TER 44757 WAT 8769 ATOM 44757 O WAT 8770 28.100 36.202 83.447 1.00 0.00 O ATOM 44758 H1 WAT 8770 27.223 36.363 83.101 1.00 0.00 H ATOM 44759 H2 WAT 8770 27.970 35.551 84.137 1.00 0.00 H TER 44761 WAT 8770 ATOM 44761 O WAT 8771 28.527 121.466 15.066 1.00 0.00 O ATOM 44762 H1 WAT 8771 28.514 120.539 15.303 1.00 0.00 H ATOM 44763 H2 WAT 8771 29.455 121.698 15.054 1.00 0.00 H TER 44765 WAT 8771 ATOM 44765 O WAT 8772 78.751 42.824 116.688 1.00 0.00 O ATOM 44766 H1 WAT 8772 79.082 42.790 117.586 1.00 0.00 H ATOM 44767 H2 WAT 8772 78.575 43.752 116.532 1.00 0.00 H TER 44769 WAT 8772 ATOM 44769 O WAT 8773 57.911 85.128 91.727 1.00 0.00 O ATOM 44770 H1 WAT 8773 58.284 84.482 91.127 1.00 0.00 H ATOM 44771 H2 WAT 8773 58.044 84.752 92.597 1.00 0.00 H TER 44773 WAT 8773 ATOM 44773 O WAT 8774 137.795 75.960 137.861 1.00 0.00 O ATOM 44774 H1 WAT 8774 138.691 76.061 137.541 1.00 0.00 H ATOM 44775 H2 WAT 8774 137.690 76.660 138.504 1.00 0.00 H TER 44777 WAT 8774 ATOM 44777 O WAT 8775 7.118 90.343 134.402 1.00 0.00 O ATOM 44778 H1 WAT 8775 7.354 90.641 133.523 1.00 0.00 H ATOM 44779 H2 WAT 8775 7.921 90.446 134.913 1.00 0.00 H TER 44781 WAT 8775 ATOM 44781 O WAT 8776 41.857 62.730 142.321 1.00 0.00 O ATOM 44782 H1 WAT 8776 41.830 63.086 143.209 1.00 0.00 H ATOM 44783 H2 WAT 8776 42.606 63.163 141.912 1.00 0.00 H TER 44785 WAT 8776 ATOM 44785 O WAT 8777 46.622 12.928 137.995 1.00 0.00 O ATOM 44786 H1 WAT 8777 46.322 12.181 138.513 1.00 0.00 H ATOM 44787 H2 WAT 8777 47.541 13.037 138.240 1.00 0.00 H TER 44789 WAT 8777 ATOM 44789 O WAT 8778 4.141 13.839 18.350 1.00 0.00 O ATOM 44790 H1 WAT 8778 3.637 13.648 19.141 1.00 0.00 H ATOM 44791 H2 WAT 8778 5.053 13.713 18.610 1.00 0.00 H TER 44793 WAT 8778 ATOM 44793 O WAT 8779 15.955 109.200 11.391 1.00 0.00 O ATOM 44794 H1 WAT 8779 15.881 109.087 10.443 1.00 0.00 H ATOM 44795 H2 WAT 8779 16.654 109.844 11.502 1.00 0.00 H TER 44797 WAT 8779 ATOM 44797 O WAT 8780 65.879 48.170 88.664 1.00 0.00 O ATOM 44798 H1 WAT 8780 66.744 47.764 88.593 1.00 0.00 H ATOM 44799 H2 WAT 8780 66.052 49.041 89.020 1.00 0.00 H TER 44801 WAT 8780 ATOM 44801 O WAT 8781 142.885 43.597 127.429 1.00 0.00 O ATOM 44802 H1 WAT 8781 143.646 43.017 127.454 1.00 0.00 H ATOM 44803 H2 WAT 8781 142.470 43.487 128.284 1.00 0.00 H TER 44805 WAT 8781 ATOM 44805 O WAT 8782 14.339 119.063 117.268 1.00 0.00 O ATOM 44806 H1 WAT 8782 14.558 118.296 116.739 1.00 0.00 H ATOM 44807 H2 WAT 8782 14.364 118.747 118.171 1.00 0.00 H TER 44809 WAT 8782 ATOM 44809 O WAT 8783 102.731 128.233 146.641 1.00 0.00 O ATOM 44810 H1 WAT 8783 101.865 128.402 146.270 1.00 0.00 H ATOM 44811 H2 WAT 8783 102.568 128.082 147.572 1.00 0.00 H TER 44813 WAT 8783 ATOM 44813 O WAT 8784 36.893 124.244 7.548 1.00 0.00 O ATOM 44814 H1 WAT 8784 37.710 124.053 8.010 1.00 0.00 H ATOM 44815 H2 WAT 8784 36.263 123.620 7.909 1.00 0.00 H TER 44817 WAT 8784 ATOM 44817 O WAT 8785 134.689 60.209 51.885 1.00 0.00 O ATOM 44818 H1 WAT 8785 134.488 59.308 52.139 1.00 0.00 H ATOM 44819 H2 WAT 8785 133.954 60.470 51.329 1.00 0.00 H TER 44821 WAT 8785 ATOM 44821 O WAT 8786 44.923 76.047 145.546 1.00 0.00 O ATOM 44822 H1 WAT 8786 44.394 75.388 145.096 1.00 0.00 H ATOM 44823 H2 WAT 8786 45.815 75.701 145.514 1.00 0.00 H TER 44825 WAT 8786 ATOM 44825 O WAT 8787 103.167 139.728 83.198 1.00 0.00 O ATOM 44826 H1 WAT 8787 102.487 139.827 83.865 1.00 0.00 H ATOM 44827 H2 WAT 8787 103.440 140.624 83.000 1.00 0.00 H TER 44829 WAT 8787 ATOM 44829 O WAT 8788 117.056 8.098 2.235 1.00 0.00 O ATOM 44830 H1 WAT 8788 118.009 8.184 2.252 1.00 0.00 H ATOM 44831 H2 WAT 8788 116.759 8.826 1.690 1.00 0.00 H TER 44833 WAT 8788 ATOM 44833 O WAT 8789 104.972 2.728 17.744 1.00 0.00 O ATOM 44834 H1 WAT 8789 104.672 2.041 18.339 1.00 0.00 H ATOM 44835 H2 WAT 8789 104.933 3.530 18.264 1.00 0.00 H TER 44837 WAT 8789 ATOM 44837 O WAT 8790 112.891 3.237 150.918 1.00 0.00 O ATOM 44838 H1 WAT 8790 113.319 2.463 151.282 1.00 0.00 H ATOM 44839 H2 WAT 8790 113.608 3.763 150.563 1.00 0.00 H TER 44841 WAT 8790 ATOM 44841 O WAT 8791 53.793 23.981 100.968 1.00 0.00 O ATOM 44842 H1 WAT 8791 54.456 23.568 101.523 1.00 0.00 H ATOM 44843 H2 WAT 8791 53.277 24.516 101.571 1.00 0.00 H TER 44845 WAT 8791 ATOM 44845 O WAT 8792 32.928 90.452 129.200 1.00 0.00 O ATOM 44846 H1 WAT 8792 32.212 91.075 129.327 1.00 0.00 H ATOM 44847 H2 WAT 8792 32.660 89.676 129.693 1.00 0.00 H TER 44849 WAT 8792 ATOM 44849 O WAT 8793 48.898 16.609 9.970 1.00 0.00 O ATOM 44850 H1 WAT 8793 48.690 15.968 9.290 1.00 0.00 H ATOM 44851 H2 WAT 8793 49.841 16.513 10.109 1.00 0.00 H TER 44853 WAT 8793 ATOM 44853 O WAT 8794 73.354 12.296 86.074 1.00 0.00 O ATOM 44854 H1 WAT 8794 73.397 12.994 86.727 1.00 0.00 H ATOM 44855 H2 WAT 8794 74.211 11.872 86.120 1.00 0.00 H TER 44857 WAT 8794 ATOM 44857 O WAT 8795 51.972 125.232 22.823 1.00 0.00 O ATOM 44858 H1 WAT 8795 52.034 126.048 22.326 1.00 0.00 H ATOM 44859 H2 WAT 8795 51.470 125.464 23.604 1.00 0.00 H TER 44861 WAT 8795 ATOM 44861 O WAT 8796 144.715 60.561 24.852 1.00 0.00 O ATOM 44862 H1 WAT 8796 143.841 60.878 25.082 1.00 0.00 H ATOM 44863 H2 WAT 8796 144.584 59.640 24.628 1.00 0.00 H TER 44865 WAT 8796 ATOM 44865 O WAT 8797 43.393 67.705 135.544 1.00 0.00 O ATOM 44866 H1 WAT 8797 43.580 68.628 135.373 1.00 0.00 H ATOM 44867 H2 WAT 8797 43.596 67.587 136.472 1.00 0.00 H TER 44869 WAT 8797 ATOM 44869 O WAT 8798 139.691 86.345 77.506 1.00 0.00 O ATOM 44870 H1 WAT 8798 140.138 85.518 77.331 1.00 0.00 H ATOM 44871 H2 WAT 8798 139.920 86.903 76.762 1.00 0.00 H TER 44873 WAT 8798 ATOM 44873 O WAT 8799 66.193 38.459 73.452 1.00 0.00 O ATOM 44874 H1 WAT 8799 66.089 38.785 72.558 1.00 0.00 H ATOM 44875 H2 WAT 8799 66.758 39.104 73.878 1.00 0.00 H TER 44877 WAT 8799 ATOM 44877 O WAT 8800 114.040 66.730 99.759 1.00 0.00 O ATOM 44878 H1 WAT 8800 113.594 67.384 99.221 1.00 0.00 H ATOM 44879 H2 WAT 8800 114.318 66.058 99.137 1.00 0.00 H TER 44881 WAT 8800 ATOM 44881 O WAT 8801 39.279 38.749 19.571 1.00 0.00 O ATOM 44882 H1 WAT 8801 39.699 38.952 18.736 1.00 0.00 H ATOM 44883 H2 WAT 8801 39.887 39.081 20.232 1.00 0.00 H TER 44885 WAT 8801 ATOM 44885 O WAT 8802 6.178 134.899 15.667 1.00 0.00 O ATOM 44886 H1 WAT 8802 5.909 134.445 14.868 1.00 0.00 H ATOM 44887 H2 WAT 8802 5.697 134.457 16.367 1.00 0.00 H TER 44889 WAT 8802 ATOM 44889 O WAT 8803 35.372 30.575 66.737 1.00 0.00 O ATOM 44890 H1 WAT 8803 36.130 30.059 67.009 1.00 0.00 H ATOM 44891 H2 WAT 8803 34.889 29.998 66.146 1.00 0.00 H TER 44893 WAT 8803 ATOM 44893 O WAT 8804 67.916 33.127 72.350 1.00 0.00 O ATOM 44894 H1 WAT 8804 67.584 32.920 73.224 1.00 0.00 H ATOM 44895 H2 WAT 8804 67.937 34.083 72.322 1.00 0.00 H TER 44897 WAT 8804 ATOM 44897 O WAT 8805 126.541 97.152 110.157 1.00 0.00 O ATOM 44898 H1 WAT 8805 127.478 97.207 109.971 1.00 0.00 H ATOM 44899 H2 WAT 8805 126.120 97.287 109.308 1.00 0.00 H TER 44901 WAT 8805 ATOM 44901 O WAT 8806 128.708 38.369 15.359 1.00 0.00 O ATOM 44902 H1 WAT 8806 128.218 38.783 14.648 1.00 0.00 H ATOM 44903 H2 WAT 8806 129.361 39.022 15.611 1.00 0.00 H TER 44905 WAT 8806 ATOM 44905 O WAT 8807 96.560 135.928 89.109 1.00 0.00 O ATOM 44906 H1 WAT 8807 96.530 135.838 90.062 1.00 0.00 H ATOM 44907 H2 WAT 8807 96.231 135.092 88.779 1.00 0.00 H TER 44909 WAT 8807 ATOM 44909 O WAT 8808 4.356 140.467 89.995 1.00 0.00 O ATOM 44910 H1 WAT 8808 4.497 140.694 89.076 1.00 0.00 H ATOM 44911 H2 WAT 8808 4.655 139.560 90.066 1.00 0.00 H TER 44913 WAT 8808 ATOM 44913 O WAT 8809 69.439 24.737 76.540 1.00 0.00 O ATOM 44914 H1 WAT 8809 69.211 24.772 77.469 1.00 0.00 H ATOM 44915 H2 WAT 8809 70.361 24.480 76.530 1.00 0.00 H TER 44917 WAT 8809 ATOM 44917 O WAT 8810 86.480 88.773 72.330 1.00 0.00 O ATOM 44918 H1 WAT 8810 86.900 89.566 71.997 1.00 0.00 H ATOM 44919 H2 WAT 8810 85.544 88.922 72.194 1.00 0.00 H TER 44921 WAT 8810 ATOM 44921 O WAT 8811 40.774 4.008 15.610 1.00 0.00 O ATOM 44922 H1 WAT 8811 40.549 3.150 15.250 1.00 0.00 H ATOM 44923 H2 WAT 8811 40.190 4.113 16.361 1.00 0.00 H TER 44925 WAT 8811 ATOM 44925 O WAT 8812 45.443 99.141 18.638 1.00 0.00 O ATOM 44926 H1 WAT 8812 45.105 98.280 18.881 1.00 0.00 H ATOM 44927 H2 WAT 8812 45.418 99.647 19.450 1.00 0.00 H TER 44929 WAT 8812 ATOM 44929 O WAT 8813 92.971 68.302 137.016 1.00 0.00 O ATOM 44930 H1 WAT 8813 92.446 67.596 137.392 1.00 0.00 H ATOM 44931 H2 WAT 8813 93.670 67.853 136.540 1.00 0.00 H TER 44933 WAT 8813 ATOM 44933 O WAT 8814 78.804 135.806 18.008 1.00 0.00 O ATOM 44934 H1 WAT 8814 79.745 135.872 18.170 1.00 0.00 H ATOM 44935 H2 WAT 8814 78.735 135.282 17.209 1.00 0.00 H TER 44937 WAT 8814 ATOM 44937 O WAT 8815 72.298 140.548 119.117 1.00 0.00 O ATOM 44938 H1 WAT 8815 72.752 139.867 119.613 1.00 0.00 H ATOM 44939 H2 WAT 8815 71.472 140.142 118.855 1.00 0.00 H TER 44941 WAT 8815 ATOM 44941 O WAT 8816 60.690 132.067 77.553 1.00 0.00 O ATOM 44942 H1 WAT 8816 61.203 132.197 76.755 1.00 0.00 H ATOM 44943 H2 WAT 8816 60.854 132.853 78.074 1.00 0.00 H TER 44945 WAT 8816 ATOM 44945 O WAT 8817 58.279 48.334 10.958 1.00 0.00 O ATOM 44946 H1 WAT 8817 58.150 49.124 10.432 1.00 0.00 H ATOM 44947 H2 WAT 8817 57.951 47.624 10.407 1.00 0.00 H TER 44949 WAT 8817 ATOM 44949 O WAT 8818 63.837 92.820 113.383 1.00 0.00 O ATOM 44950 H1 WAT 8818 64.080 92.255 112.649 1.00 0.00 H ATOM 44951 H2 WAT 8818 62.897 92.678 113.494 1.00 0.00 H TER 44953 WAT 8818 ATOM 44953 O WAT 8819 120.678 75.254 112.913 1.00 0.00 O ATOM 44954 H1 WAT 8819 121.502 75.358 113.387 1.00 0.00 H ATOM 44955 H2 WAT 8819 120.219 74.556 113.381 1.00 0.00 H TER 44957 WAT 8819 ATOM 44957 O WAT 8820 37.930 57.124 66.204 1.00 0.00 O ATOM 44958 H1 WAT 8820 37.955 56.258 65.798 1.00 0.00 H ATOM 44959 H2 WAT 8820 38.247 56.980 67.095 1.00 0.00 H TER 44961 WAT 8820 ATOM 44961 O WAT 8821 78.737 12.631 142.740 1.00 0.00 O ATOM 44962 H1 WAT 8821 78.364 11.760 142.873 1.00 0.00 H ATOM 44963 H2 WAT 8821 77.985 13.222 142.776 1.00 0.00 H TER 44965 WAT 8821 ATOM 44965 O WAT 8822 26.407 14.504 155.472 1.00 0.00 O ATOM 44966 H1 WAT 8822 26.639 15.252 154.922 1.00 0.00 H ATOM 44967 H2 WAT 8822 26.014 13.875 154.867 1.00 0.00 H TER 44969 WAT 8822 ATOM 44969 O WAT 8823 38.341 61.858 86.766 1.00 0.00 O ATOM 44970 H1 WAT 8823 38.137 61.302 87.518 1.00 0.00 H ATOM 44971 H2 WAT 8823 39.170 62.278 86.997 1.00 0.00 H TER 44973 WAT 8823 ATOM 44973 O WAT 8824 6.489 48.518 154.277 1.00 0.00 O ATOM 44974 H1 WAT 8824 7.379 48.182 154.175 1.00 0.00 H ATOM 44975 H2 WAT 8824 6.001 47.792 154.666 1.00 0.00 H TER 44977 WAT 8824 ATOM 44977 O WAT 8825 15.462 42.849 104.734 1.00 0.00 O ATOM 44978 H1 WAT 8825 15.769 43.674 105.110 1.00 0.00 H ATOM 44979 H2 WAT 8825 14.589 42.726 105.105 1.00 0.00 H TER 44981 WAT 8825 ATOM 44981 O WAT 8826 15.323 121.509 133.251 1.00 0.00 O ATOM 44982 H1 WAT 8826 14.725 120.891 132.831 1.00 0.00 H ATOM 44983 H2 WAT 8826 16.086 121.535 132.674 1.00 0.00 H TER 44985 WAT 8826 ATOM 44985 O WAT 8827 129.757 55.985 22.116 1.00 0.00 O ATOM 44986 H1 WAT 8827 128.883 56.252 21.832 1.00 0.00 H ATOM 44987 H2 WAT 8827 129.951 55.206 21.596 1.00 0.00 H TER 44989 WAT 8827 ATOM 44989 O WAT 8828 46.653 96.135 142.631 1.00 0.00 O ATOM 44990 H1 WAT 8828 47.389 96.565 143.067 1.00 0.00 H ATOM 44991 H2 WAT 8828 47.041 95.715 141.864 1.00 0.00 H TER 44993 WAT 8828 ATOM 44993 O WAT 8829 126.094 132.842 135.104 1.00 0.00 O ATOM 44994 H1 WAT 8829 125.799 132.198 135.748 1.00 0.00 H ATOM 44995 H2 WAT 8829 126.784 133.330 135.552 1.00 0.00 H TER 44997 WAT 8829 ATOM 44997 O WAT 8830 93.204 143.285 154.499 1.00 0.00 O ATOM 44998 H1 WAT 8830 93.719 142.616 154.049 1.00 0.00 H ATOM 44999 H2 WAT 8830 92.703 143.711 153.803 1.00 0.00 H TER 45001 WAT 8830 ATOM 45001 O WAT 8831 11.306 111.922 138.187 1.00 0.00 O ATOM 45002 H1 WAT 8831 10.525 111.567 137.762 1.00 0.00 H ATOM 45003 H2 WAT 8831 11.042 112.056 139.098 1.00 0.00 H TER 45005 WAT 8831 ATOM 45005 O WAT 8832 83.578 33.674 151.052 1.00 0.00 O ATOM 45006 H1 WAT 8832 84.052 33.985 150.281 1.00 0.00 H ATOM 45007 H2 WAT 8832 83.779 34.318 151.732 1.00 0.00 H TER 45009 WAT 8832 ATOM 45009 O WAT 8833 137.939 66.961 145.040 1.00 0.00 O ATOM 45010 H1 WAT 8833 137.401 67.500 144.461 1.00 0.00 H ATOM 45011 H2 WAT 8833 137.332 66.652 145.712 1.00 0.00 H TER 45013 WAT 8833 ATOM 45013 O WAT 8834 110.239 62.479 12.483 1.00 0.00 O ATOM 45014 H1 WAT 8834 109.285 62.477 12.555 1.00 0.00 H ATOM 45015 H2 WAT 8834 110.426 63.114 11.791 1.00 0.00 H TER 45017 WAT 8834 ATOM 45017 O WAT 8835 99.037 55.023 96.425 1.00 0.00 O ATOM 45018 H1 WAT 8835 99.483 55.846 96.624 1.00 0.00 H ATOM 45019 H2 WAT 8835 98.107 55.225 96.528 1.00 0.00 H TER 45021 WAT 8835 ATOM 45021 O WAT 8836 50.266 103.321 5.930 1.00 0.00 O ATOM 45022 H1 WAT 8836 49.312 103.249 5.893 1.00 0.00 H ATOM 45023 H2 WAT 8836 50.451 103.600 6.827 1.00 0.00 H TER 45025 WAT 8836 ATOM 45025 O WAT 8837 88.866 65.855 71.944 1.00 0.00 O ATOM 45026 H1 WAT 8837 88.089 65.624 71.436 1.00 0.00 H ATOM 45027 H2 WAT 8837 88.779 65.355 72.755 1.00 0.00 H TER 45029 WAT 8837 ATOM 45029 O WAT 8838 33.479 104.496 11.678 1.00 0.00 O ATOM 45030 H1 WAT 8838 33.637 105.125 12.382 1.00 0.00 H ATOM 45031 H2 WAT 8838 34.347 104.155 11.462 1.00 0.00 H TER 45033 WAT 8838 ATOM 45033 O WAT 8839 9.648 81.682 115.435 1.00 0.00 O ATOM 45034 H1 WAT 8839 9.756 81.105 116.191 1.00 0.00 H ATOM 45035 H2 WAT 8839 9.746 81.105 114.677 1.00 0.00 H TER 45037 WAT 8839 ATOM 45037 O WAT 8840 67.957 65.724 20.062 1.00 0.00 O ATOM 45038 H1 WAT 8840 67.276 65.122 20.362 1.00 0.00 H ATOM 45039 H2 WAT 8840 67.581 66.595 20.191 1.00 0.00 H TER 45041 WAT 8840 ATOM 45041 O WAT 8841 35.237 131.582 10.983 1.00 0.00 O ATOM 45042 H1 WAT 8841 35.633 132.397 11.291 1.00 0.00 H ATOM 45043 H2 WAT 8841 34.788 131.824 10.174 1.00 0.00 H TER 45045 WAT 8841 ATOM 45045 O WAT 8842 113.807 60.211 158.303 1.00 0.00 O ATOM 45046 H1 WAT 8842 112.926 60.292 157.938 1.00 0.00 H ATOM 45047 H2 WAT 8842 113.805 60.791 159.065 1.00 0.00 H TER 45049 WAT 8842 ATOM 45049 O WAT 8843 68.781 103.465 135.607 1.00 0.00 O ATOM 45050 H1 WAT 8843 69.204 104.173 136.094 1.00 0.00 H ATOM 45051 H2 WAT 8843 68.210 103.042 136.248 1.00 0.00 H TER 45053 WAT 8843 ATOM 45053 O WAT 8844 118.848 144.942 119.697 1.00 0.00 O ATOM 45054 H1 WAT 8844 118.519 145.829 119.555 1.00 0.00 H ATOM 45055 H2 WAT 8844 119.766 145.063 119.940 1.00 0.00 H TER 45057 WAT 8844 ATOM 45057 O WAT 8845 88.567 12.695 62.615 1.00 0.00 O ATOM 45058 H1 WAT 8845 87.744 13.039 62.961 1.00 0.00 H ATOM 45059 H2 WAT 8845 89.005 13.457 62.235 1.00 0.00 H TER 45061 WAT 8845 ATOM 45061 O WAT 8846 81.674 136.656 123.618 1.00 0.00 O ATOM 45062 H1 WAT 8846 82.526 136.228 123.700 1.00 0.00 H ATOM 45063 H2 WAT 8846 81.076 136.095 124.112 1.00 0.00 H TER 45065 WAT 8846 ATOM 45065 O WAT 8847 130.531 34.042 65.287 1.00 0.00 O ATOM 45066 H1 WAT 8847 130.878 34.807 65.747 1.00 0.00 H ATOM 45067 H2 WAT 8847 131.150 33.892 64.572 1.00 0.00 H TER 45069 WAT 8847 ATOM 45069 O WAT 8848 110.368 36.727 61.904 1.00 0.00 O ATOM 45070 H1 WAT 8848 111.154 36.324 61.535 1.00 0.00 H ATOM 45071 H2 WAT 8848 109.791 36.860 61.152 1.00 0.00 H TER 45073 WAT 8848 ATOM 45073 O WAT 8849 20.956 93.482 71.166 1.00 0.00 O ATOM 45074 H1 WAT 8849 21.380 92.976 70.473 1.00 0.00 H ATOM 45075 H2 WAT 8849 20.405 92.847 71.623 1.00 0.00 H TER 45077 WAT 8849 ATOM 45077 O WAT 8850 88.232 79.033 1.303 1.00 0.00 O ATOM 45078 H1 WAT 8850 87.360 78.980 0.910 1.00 0.00 H ATOM 45079 H2 WAT 8850 88.818 79.189 0.563 1.00 0.00 H TER 45081 WAT 8850 ATOM 45081 O WAT 8851 35.931 61.779 130.367 1.00 0.00 O ATOM 45082 H1 WAT 8851 36.645 62.365 130.119 1.00 0.00 H ATOM 45083 H2 WAT 8851 35.450 61.629 129.553 1.00 0.00 H TER 45085 WAT 8851 ATOM 45085 O WAT 8852 24.777 130.657 11.315 1.00 0.00 O ATOM 45086 H1 WAT 8852 25.021 130.594 12.238 1.00 0.00 H ATOM 45087 H2 WAT 8852 25.609 130.757 10.853 1.00 0.00 H TER 45089 WAT 8852 ATOM 45089 O WAT 8853 21.956 40.052 11.072 1.00 0.00 O ATOM 45090 H1 WAT 8853 22.512 40.619 11.606 1.00 0.00 H ATOM 45091 H2 WAT 8853 21.712 39.336 11.658 1.00 0.00 H TER 45093 WAT 8853 ATOM 45093 O WAT 8854 129.522 10.350 64.131 1.00 0.00 O ATOM 45094 H1 WAT 8854 129.415 10.984 63.422 1.00 0.00 H ATOM 45095 H2 WAT 8854 129.610 10.886 64.920 1.00 0.00 H TER 45097 WAT 8854 ATOM 45097 O WAT 8855 102.943 78.689 7.556 1.00 0.00 O ATOM 45098 H1 WAT 8855 102.697 77.835 7.913 1.00 0.00 H ATOM 45099 H2 WAT 8855 103.536 78.484 6.833 1.00 0.00 H TER 45101 WAT 8855 ATOM 45101 O WAT 8856 23.407 105.470 130.457 1.00 0.00 O ATOM 45102 H1 WAT 8856 23.006 105.277 131.304 1.00 0.00 H ATOM 45103 H2 WAT 8856 24.336 105.275 130.581 1.00 0.00 H TER 45105 WAT 8856 ATOM 45105 O WAT 8857 94.798 133.325 2.426 1.00 0.00 O ATOM 45106 H1 WAT 8857 94.084 133.825 2.031 1.00 0.00 H ATOM 45107 H2 WAT 8857 94.804 132.496 1.948 1.00 0.00 H TER 45109 WAT 8857 ATOM 45109 O WAT 8858 31.395 129.531 139.582 1.00 0.00 O ATOM 45110 H1 WAT 8858 32.209 129.065 139.772 1.00 0.00 H ATOM 45111 H2 WAT 8858 30.909 128.939 139.007 1.00 0.00 H TER 45113 WAT 8858 ATOM 45113 O WAT 8859 133.110 91.198 128.451 1.00 0.00 O ATOM 45114 H1 WAT 8859 132.477 91.905 128.325 1.00 0.00 H ATOM 45115 H2 WAT 8859 133.877 91.627 128.830 1.00 0.00 H TER 45117 WAT 8859 ATOM 45117 O WAT 8860 134.763 20.347 108.904 1.00 0.00 O ATOM 45118 H1 WAT 8860 134.156 20.708 108.258 1.00 0.00 H ATOM 45119 H2 WAT 8860 134.200 19.918 109.548 1.00 0.00 H TER 45121 WAT 8860 ATOM 45121 O WAT 8861 141.423 87.275 33.969 1.00 0.00 O ATOM 45122 H1 WAT 8861 140.897 87.394 33.178 1.00 0.00 H ATOM 45123 H2 WAT 8861 142.282 87.629 33.741 1.00 0.00 H TER 45125 WAT 8861 ATOM 45125 O WAT 8862 36.339 61.765 149.492 1.00 0.00 O ATOM 45126 H1 WAT 8862 36.812 61.032 149.885 1.00 0.00 H ATOM 45127 H2 WAT 8862 35.476 61.744 149.906 1.00 0.00 H TER 45129 WAT 8862 ATOM 45129 O WAT 8863 61.809 84.774 22.278 1.00 0.00 O ATOM 45130 H1 WAT 8863 62.605 85.090 21.850 1.00 0.00 H ATOM 45131 H2 WAT 8863 61.166 84.710 21.572 1.00 0.00 H TER 45133 WAT 8863 ATOM 45133 O WAT 8864 91.722 21.998 69.705 1.00 0.00 O ATOM 45134 H1 WAT 8864 92.102 22.381 68.915 1.00 0.00 H ATOM 45135 H2 WAT 8864 91.989 21.079 69.680 1.00 0.00 H TER 45137 WAT 8864 ATOM 45137 O WAT 8865 86.973 67.764 115.716 1.00 0.00 O ATOM 45138 H1 WAT 8865 86.934 68.635 116.109 1.00 0.00 H ATOM 45139 H2 WAT 8865 86.749 67.906 114.796 1.00 0.00 H TER 45141 WAT 8865 ATOM 45141 O WAT 8866 48.813 129.346 94.636 1.00 0.00 O ATOM 45142 H1 WAT 8866 49.618 128.830 94.593 1.00 0.00 H ATOM 45143 H2 WAT 8866 49.107 130.255 94.577 1.00 0.00 H TER 45145 WAT 8866 ATOM 45145 O WAT 8867 19.992 56.717 4.661 1.00 0.00 O ATOM 45146 H1 WAT 8867 20.828 56.385 4.334 1.00 0.00 H ATOM 45147 H2 WAT 8867 19.791 57.460 4.092 1.00 0.00 H TER 45149 WAT 8867 ATOM 45149 O WAT 8868 7.662 131.206 84.367 1.00 0.00 O ATOM 45150 H1 WAT 8868 7.492 132.082 84.711 1.00 0.00 H ATOM 45151 H2 WAT 8868 6.899 130.692 84.632 1.00 0.00 H TER 45153 WAT 8868 ATOM 45153 O WAT 8869 76.727 88.054 149.588 1.00 0.00 O ATOM 45154 H1 WAT 8869 77.465 88.524 149.976 1.00 0.00 H ATOM 45155 H2 WAT 8869 76.718 87.209 150.037 1.00 0.00 H TER 45157 WAT 8869 ATOM 45157 O WAT 8870 51.773 98.499 135.637 1.00 0.00 O ATOM 45158 H1 WAT 8870 52.338 99.261 135.511 1.00 0.00 H ATOM 45159 H2 WAT 8870 50.890 98.822 135.458 1.00 0.00 H TER 45161 WAT 8870 ATOM 45161 O WAT 8871 103.986 106.037 139.936 1.00 0.00 O ATOM 45162 H1 WAT 8871 103.194 105.626 139.590 1.00 0.00 H ATOM 45163 H2 WAT 8871 103.724 106.937 140.130 1.00 0.00 H TER 45165 WAT 8871 ATOM 45165 O WAT 8872 54.525 64.145 156.050 1.00 0.00 O ATOM 45166 H1 WAT 8872 55.064 64.078 155.262 1.00 0.00 H ATOM 45167 H2 WAT 8872 54.352 63.237 156.299 1.00 0.00 H TER 45169 WAT 8872 ATOM 45169 O WAT 8873 39.520 74.604 139.136 1.00 0.00 O ATOM 45170 H1 WAT 8873 39.921 75.379 139.531 1.00 0.00 H ATOM 45171 H2 WAT 8873 38.816 74.365 139.739 1.00 0.00 H TER 45173 WAT 8873 ATOM 45173 O WAT 8874 132.385 141.385 103.990 1.00 0.00 O ATOM 45174 H1 WAT 8874 131.623 141.849 103.644 1.00 0.00 H ATOM 45175 H2 WAT 8874 132.945 141.241 103.227 1.00 0.00 H TER 45177 WAT 8874 ATOM 45177 O WAT 8875 5.895 92.654 93.318 1.00 0.00 O ATOM 45178 H1 WAT 8875 6.028 93.518 92.927 1.00 0.00 H ATOM 45179 H2 WAT 8875 6.388 92.058 92.754 1.00 0.00 H TER 45181 WAT 8875 ATOM 45181 O WAT 8876 92.727 13.291 121.544 1.00 0.00 O ATOM 45182 H1 WAT 8876 92.342 12.457 121.274 1.00 0.00 H ATOM 45183 H2 WAT 8876 93.244 13.572 120.789 1.00 0.00 H TER 45185 WAT 8876 ATOM 45185 O WAT 8877 71.397 80.257 89.942 1.00 0.00 O ATOM 45186 H1 WAT 8877 72.226 80.582 90.293 1.00 0.00 H ATOM 45187 H2 WAT 8877 71.546 80.190 88.999 1.00 0.00 H TER 45189 WAT 8877 ATOM 45189 O WAT 8878 93.891 109.422 23.854 1.00 0.00 O ATOM 45190 H1 WAT 8878 94.239 110.214 23.443 1.00 0.00 H ATOM 45191 H2 WAT 8878 93.904 109.614 24.792 1.00 0.00 H TER 45193 WAT 8878 ATOM 45193 O WAT 8879 38.264 42.342 118.110 1.00 0.00 O ATOM 45194 H1 WAT 8879 38.222 41.557 118.657 1.00 0.00 H ATOM 45195 H2 WAT 8879 38.402 42.009 117.223 1.00 0.00 H TER 45197 WAT 8879 ATOM 45197 O WAT 8880 28.937 39.239 134.587 1.00 0.00 O ATOM 45198 H1 WAT 8880 28.209 39.858 134.524 1.00 0.00 H ATOM 45199 H2 WAT 8880 28.525 38.409 134.826 1.00 0.00 H TER 45201 WAT 8880 ATOM 45201 O WAT 8881 141.020 72.989 103.634 1.00 0.00 O ATOM 45202 H1 WAT 8881 140.759 72.138 103.282 1.00 0.00 H ATOM 45203 H2 WAT 8881 141.004 72.870 104.584 1.00 0.00 H TER 45205 WAT 8881 ATOM 45205 O WAT 8882 105.467 18.703 12.939 1.00 0.00 O ATOM 45206 H1 WAT 8882 105.460 19.565 13.357 1.00 0.00 H ATOM 45207 H2 WAT 8882 106.145 18.216 13.407 1.00 0.00 H TER 45209 WAT 8882 ATOM 45209 O WAT 8883 80.279 133.248 60.413 1.00 0.00 O ATOM 45210 H1 WAT 8883 80.637 133.600 59.598 1.00 0.00 H ATOM 45211 H2 WAT 8883 80.665 133.793 61.099 1.00 0.00 H TER 45213 WAT 8883 ATOM 45213 O WAT 8884 44.313 99.696 65.290 1.00 0.00 O ATOM 45214 H1 WAT 8884 43.807 100.273 64.719 1.00 0.00 H ATOM 45215 H2 WAT 8884 45.224 99.953 65.145 1.00 0.00 H TER 45217 WAT 8884 ATOM 45217 O WAT 8885 79.123 12.240 117.933 1.00 0.00 O ATOM 45218 H1 WAT 8885 78.299 12.724 117.981 1.00 0.00 H ATOM 45219 H2 WAT 8885 79.739 12.853 117.533 1.00 0.00 H TER 45221 WAT 8885 ATOM 45221 O WAT 8886 53.966 125.591 11.480 1.00 0.00 O ATOM 45222 H1 WAT 8886 53.939 126.517 11.719 1.00 0.00 H ATOM 45223 H2 WAT 8886 53.155 125.228 11.836 1.00 0.00 H TER 45225 WAT 8886 ATOM 45225 O WAT 8887 93.485 84.037 3.686 1.00 0.00 O ATOM 45226 H1 WAT 8887 93.727 84.246 4.589 1.00 0.00 H ATOM 45227 H2 WAT 8887 94.273 84.227 3.178 1.00 0.00 H TER 45229 WAT 8887 ATOM 45229 O WAT 8888 119.138 111.266 104.483 1.00 0.00 O ATOM 45230 H1 WAT 8888 119.217 110.849 105.341 1.00 0.00 H ATOM 45231 H2 WAT 8888 119.962 111.740 104.371 1.00 0.00 H TER 45233 WAT 8888 ATOM 45233 O WAT 8889 76.190 100.875 130.873 1.00 0.00 O ATOM 45234 H1 WAT 8889 75.394 100.448 131.188 1.00 0.00 H ATOM 45235 H2 WAT 8889 75.909 101.369 130.103 1.00 0.00 H TER 45237 WAT 8889 ATOM 45237 O WAT 8890 120.343 48.634 120.363 1.00 0.00 O ATOM 45238 H1 WAT 8890 120.901 49.380 120.140 1.00 0.00 H ATOM 45239 H2 WAT 8890 120.757 47.888 119.930 1.00 0.00 H TER 45241 WAT 8890 ATOM 45241 O WAT 8891 5.732 142.098 63.949 1.00 0.00 O ATOM 45242 H1 WAT 8891 5.643 142.953 64.371 1.00 0.00 H ATOM 45243 H2 WAT 8891 5.418 142.238 63.056 1.00 0.00 H TER 45245 WAT 8891 ATOM 45245 O WAT 8892 6.023 123.585 136.418 1.00 0.00 O ATOM 45246 H1 WAT 8892 5.840 124.507 136.235 1.00 0.00 H ATOM 45247 H2 WAT 8892 5.171 123.154 136.350 1.00 0.00 H TER 45249 WAT 8892 ATOM 45249 O WAT 8893 70.546 6.186 145.743 1.00 0.00 O ATOM 45250 H1 WAT 8893 70.586 7.122 145.937 1.00 0.00 H ATOM 45251 H2 WAT 8893 71.170 6.063 145.027 1.00 0.00 H TER 45253 WAT 8893 ATOM 45253 O WAT 8894 106.433 143.620 66.803 1.00 0.00 O ATOM 45254 H1 WAT 8894 106.279 143.581 65.859 1.00 0.00 H ATOM 45255 H2 WAT 8894 106.356 142.712 67.096 1.00 0.00 H TER 45257 WAT 8894 ATOM 45257 O WAT 8895 86.888 96.325 27.169 1.00 0.00 O ATOM 45258 H1 WAT 8895 87.496 96.169 27.892 1.00 0.00 H ATOM 45259 H2 WAT 8895 86.080 95.888 27.437 1.00 0.00 H TER 45261 WAT 8895 ATOM 45261 O WAT 8896 103.233 81.497 85.457 1.00 0.00 O ATOM 45262 H1 WAT 8896 103.347 80.947 86.232 1.00 0.00 H ATOM 45263 H2 WAT 8896 103.891 81.179 84.839 1.00 0.00 H TER 45265 WAT 8896 ATOM 45265 O WAT 8897 137.113 50.447 101.918 1.00 0.00 O ATOM 45266 H1 WAT 8897 137.875 50.374 101.344 1.00 0.00 H ATOM 45267 H2 WAT 8897 137.375 51.082 102.585 1.00 0.00 H TER 45269 WAT 8897 ATOM 45269 O WAT 8898 5.107 65.225 114.311 1.00 0.00 O ATOM 45270 H1 WAT 8898 5.525 65.498 115.128 1.00 0.00 H ATOM 45271 H2 WAT 8898 5.666 64.522 113.980 1.00 0.00 H TER 45273 WAT 8898 ATOM 45273 O WAT 8899 127.062 114.620 15.255 1.00 0.00 O ATOM 45274 H1 WAT 8899 126.822 114.903 14.373 1.00 0.00 H ATOM 45275 H2 WAT 8899 126.664 115.271 15.832 1.00 0.00 H TER 45277 WAT 8899 ATOM 45277 O WAT 8900 114.130 8.737 87.939 1.00 0.00 O ATOM 45278 H1 WAT 8900 115.053 8.577 87.746 1.00 0.00 H ATOM 45279 H2 WAT 8900 113.899 9.490 87.394 1.00 0.00 H TER 45281 WAT 8900 ATOM 45281 O WAT 8901 116.851 60.964 98.781 1.00 0.00 O ATOM 45282 H1 WAT 8901 116.842 60.765 97.845 1.00 0.00 H ATOM 45283 H2 WAT 8901 117.677 61.427 98.920 1.00 0.00 H TER 45285 WAT 8901 ATOM 45285 O WAT 8902 13.997 59.141 12.758 1.00 0.00 O ATOM 45286 H1 WAT 8902 13.996 58.257 13.127 1.00 0.00 H ATOM 45287 H2 WAT 8902 14.666 59.608 13.258 1.00 0.00 H TER 45289 WAT 8902 ATOM 45289 O WAT 8903 121.498 15.430 126.325 1.00 0.00 O ATOM 45290 H1 WAT 8903 121.788 15.480 125.414 1.00 0.00 H ATOM 45291 H2 WAT 8903 120.880 16.154 126.421 1.00 0.00 H TER 45293 WAT 8903 ATOM 45293 O WAT 8904 114.169 46.019 17.051 1.00 0.00 O ATOM 45294 H1 WAT 8904 114.548 45.392 17.667 1.00 0.00 H ATOM 45295 H2 WAT 8904 113.577 46.550 17.582 1.00 0.00 H TER 45297 WAT 8904 ATOM 45297 O WAT 8905 94.651 37.813 67.344 1.00 0.00 O ATOM 45298 H1 WAT 8905 94.718 38.765 67.280 1.00 0.00 H ATOM 45299 H2 WAT 8905 93.854 37.596 66.861 1.00 0.00 H TER 45301 WAT 8905 ATOM 45301 O WAT 8906 103.429 3.518 15.540 1.00 0.00 O ATOM 45302 H1 WAT 8906 102.552 3.261 15.825 1.00 0.00 H ATOM 45303 H2 WAT 8906 103.937 3.576 16.349 1.00 0.00 H TER 45305 WAT 8906 ATOM 45305 O WAT 8907 0.522 73.862 72.471 1.00 0.00 O ATOM 45306 H1 WAT 8907 0.471 72.998 72.881 1.00 0.00 H ATOM 45307 H2 WAT 8907 1.056 73.724 71.688 1.00 0.00 H TER 45309 WAT 8907 ATOM 45309 O WAT 8908 122.153 66.860 66.183 1.00 0.00 O ATOM 45310 H1 WAT 8908 122.707 66.726 65.414 1.00 0.00 H ATOM 45311 H2 WAT 8908 122.027 67.808 66.225 1.00 0.00 H TER 45313 WAT 8908 ATOM 45313 O WAT 8909 71.171 26.220 127.585 1.00 0.00 O ATOM 45314 H1 WAT 8909 71.468 25.320 127.716 1.00 0.00 H ATOM 45315 H2 WAT 8909 71.379 26.410 126.670 1.00 0.00 H TER 45317 WAT 8909 ATOM 45317 O WAT 8910 86.377 120.003 12.385 1.00 0.00 O ATOM 45318 H1 WAT 8910 85.640 119.400 12.291 1.00 0.00 H ATOM 45319 H2 WAT 8910 87.152 119.445 12.326 1.00 0.00 H TER 45321 WAT 8910 ATOM 45321 O WAT 8911 79.921 4.544 78.216 1.00 0.00 O ATOM 45322 H1 WAT 8911 80.661 3.939 78.164 1.00 0.00 H ATOM 45323 H2 WAT 8911 80.133 5.237 77.591 1.00 0.00 H TER 45325 WAT 8911 ATOM 45325 O WAT 8912 77.468 103.025 132.019 1.00 0.00 O ATOM 45326 H1 WAT 8912 76.775 102.437 131.722 1.00 0.00 H ATOM 45327 H2 WAT 8912 77.004 103.792 132.355 1.00 0.00 H TER 45329 WAT 8912 ATOM 45329 O WAT 8913 41.765 47.946 120.877 1.00 0.00 O ATOM 45330 H1 WAT 8913 41.605 48.168 119.959 1.00 0.00 H ATOM 45331 H2 WAT 8913 42.628 47.534 120.876 1.00 0.00 H TER 45333 WAT 8913 ATOM 45333 O WAT 8914 17.672 22.410 100.384 1.00 0.00 O ATOM 45334 H1 WAT 8914 17.007 21.942 100.889 1.00 0.00 H ATOM 45335 H2 WAT 8914 17.295 22.490 99.508 1.00 0.00 H TER 45337 WAT 8914 ATOM 45337 O WAT 8915 139.964 100.416 80.327 1.00 0.00 O ATOM 45338 H1 WAT 8915 140.668 100.630 79.714 1.00 0.00 H ATOM 45339 H2 WAT 8915 139.668 101.265 80.656 1.00 0.00 H TER 45341 WAT 8915 ATOM 45341 O WAT 8916 2.457 51.705 9.644 1.00 0.00 O ATOM 45342 H1 WAT 8916 2.102 52.569 9.855 1.00 0.00 H ATOM 45343 H2 WAT 8916 3.143 51.880 8.999 1.00 0.00 H TER 45345 WAT 8916 ATOM 45345 O WAT 8917 14.326 85.052 108.920 1.00 0.00 O ATOM 45346 H1 WAT 8917 14.264 85.914 108.508 1.00 0.00 H ATOM 45347 H2 WAT 8917 13.614 84.546 108.527 1.00 0.00 H TER 45349 WAT 8917 ATOM 45349 O WAT 8918 118.770 86.175 144.367 1.00 0.00 O ATOM 45350 H1 WAT 8918 118.973 86.301 143.440 1.00 0.00 H ATOM 45351 H2 WAT 8918 119.199 86.909 144.808 1.00 0.00 H TER 45353 WAT 8918 ATOM 45353 O WAT 8919 93.787 50.625 65.851 1.00 0.00 O ATOM 45354 H1 WAT 8919 93.083 49.993 65.708 1.00 0.00 H ATOM 45355 H2 WAT 8919 93.340 51.467 65.938 1.00 0.00 H TER 45357 WAT 8919 ATOM 45357 O WAT 8920 39.197 92.830 125.706 1.00 0.00 O ATOM 45358 H1 WAT 8920 38.845 92.645 124.836 1.00 0.00 H ATOM 45359 H2 WAT 8920 38.667 93.558 126.030 1.00 0.00 H TER 45361 WAT 8920 ATOM 45361 O WAT 8921 26.186 89.834 84.922 1.00 0.00 O ATOM 45362 H1 WAT 8921 26.244 90.657 85.407 1.00 0.00 H ATOM 45363 H2 WAT 8921 26.400 89.160 85.568 1.00 0.00 H TER 45365 WAT 8921 ATOM 45365 O WAT 8922 130.780 57.110 2.388 1.00 0.00 O ATOM 45366 H1 WAT 8922 130.488 56.350 1.884 1.00 0.00 H ATOM 45367 H2 WAT 8922 130.021 57.350 2.920 1.00 0.00 H TER 45369 WAT 8922 ATOM 45369 O WAT 8923 32.479 24.903 15.355 1.00 0.00 O ATOM 45370 H1 WAT 8923 31.572 24.716 15.601 1.00 0.00 H ATOM 45371 H2 WAT 8923 32.993 24.631 16.115 1.00 0.00 H TER 45373 WAT 8923 ATOM 45373 O WAT 8924 63.364 128.010 118.524 1.00 0.00 O ATOM 45374 H1 WAT 8924 63.866 127.237 118.266 1.00 0.00 H ATOM 45375 H2 WAT 8924 63.473 128.621 117.795 1.00 0.00 H TER 45377 WAT 8924 ATOM 45377 O WAT 8925 19.232 69.798 4.136 1.00 0.00 O ATOM 45378 H1 WAT 8925 19.900 69.411 3.569 1.00 0.00 H ATOM 45379 H2 WAT 8925 18.494 69.971 3.553 1.00 0.00 H TER 45381 WAT 8925 ATOM 45381 O WAT 8926 16.954 121.760 66.638 1.00 0.00 O ATOM 45382 H1 WAT 8926 16.382 120.994 66.587 1.00 0.00 H ATOM 45383 H2 WAT 8926 16.384 122.499 66.424 1.00 0.00 H TER 45385 WAT 8926 ATOM 45385 O WAT 8927 142.450 11.125 77.519 1.00 0.00 O ATOM 45386 H1 WAT 8927 142.189 11.946 77.937 1.00 0.00 H ATOM 45387 H2 WAT 8927 141.628 10.736 77.220 1.00 0.00 H TER 45389 WAT 8927 ATOM 45389 O WAT 8928 20.257 102.590 64.690 1.00 0.00 O ATOM 45390 H1 WAT 8928 20.447 102.607 63.752 1.00 0.00 H ATOM 45391 H2 WAT 8928 19.888 103.453 64.875 1.00 0.00 H TER 45393 WAT 8928 ATOM 45393 O WAT 8929 41.786 66.875 17.302 1.00 0.00 O ATOM 45394 H1 WAT 8929 41.094 66.304 17.637 1.00 0.00 H ATOM 45395 H2 WAT 8929 41.816 67.603 17.922 1.00 0.00 H TER 45397 WAT 8929 ATOM 45397 O WAT 8930 28.153 137.361 87.107 1.00 0.00 O ATOM 45398 H1 WAT 8930 29.024 137.207 86.742 1.00 0.00 H ATOM 45399 H2 WAT 8930 27.976 138.284 86.926 1.00 0.00 H TER 45401 WAT 8930 ATOM 45401 O WAT 8931 94.569 95.419 87.058 1.00 0.00 O ATOM 45402 H1 WAT 8931 94.059 95.714 86.303 1.00 0.00 H ATOM 45403 H2 WAT 8931 94.313 94.504 87.176 1.00 0.00 H TER 45405 WAT 8931 ATOM 45405 O WAT 8932 20.168 11.438 72.298 1.00 0.00 O ATOM 45406 H1 WAT 8932 19.551 11.814 71.670 1.00 0.00 H ATOM 45407 H2 WAT 8932 20.264 12.110 72.972 1.00 0.00 H TER 45409 WAT 8932 ATOM 45409 O WAT 8933 49.653 108.076 75.125 1.00 0.00 O ATOM 45410 H1 WAT 8933 49.368 107.917 74.225 1.00 0.00 H ATOM 45411 H2 WAT 8933 49.325 108.952 75.329 1.00 0.00 H TER 45413 WAT 8933 ATOM 45413 O WAT 8934 11.608 99.239 57.758 1.00 0.00 O ATOM 45414 H1 WAT 8934 10.859 99.005 58.306 1.00 0.00 H ATOM 45415 H2 WAT 8934 12.283 98.601 57.990 1.00 0.00 H TER 45417 WAT 8934 ATOM 45417 O WAT 8935 62.129 38.412 91.152 1.00 0.00 O ATOM 45418 H1 WAT 8935 61.290 38.239 91.578 1.00 0.00 H ATOM 45419 H2 WAT 8935 61.904 38.577 90.237 1.00 0.00 H TER 45421 WAT 8935 ATOM 45421 O WAT 8936 69.088 23.264 157.733 1.00 0.00 O ATOM 45422 H1 WAT 8936 68.135 23.294 157.660 1.00 0.00 H ATOM 45423 H2 WAT 8936 69.393 23.129 156.836 1.00 0.00 H TER 45425 WAT 8936 ATOM 45425 O WAT 8937 16.426 51.977 106.024 1.00 0.00 O ATOM 45426 H1 WAT 8937 15.532 52.252 105.819 1.00 0.00 H ATOM 45427 H2 WAT 8937 16.653 51.365 105.324 1.00 0.00 H TER 45429 WAT 8937 ATOM 45429 O WAT 8938 107.468 62.696 140.539 1.00 0.00 O ATOM 45430 H1 WAT 8938 107.867 61.833 140.428 1.00 0.00 H ATOM 45431 H2 WAT 8938 107.996 63.118 141.217 1.00 0.00 H TER 45433 WAT 8938 ATOM 45433 O WAT 8939 26.267 90.102 81.807 1.00 0.00 O ATOM 45434 H1 WAT 8939 26.970 89.929 82.433 1.00 0.00 H ATOM 45435 H2 WAT 8939 25.495 89.690 82.192 1.00 0.00 H TER 45437 WAT 8939 ATOM 45437 O WAT 8940 85.458 144.691 85.479 1.00 0.00 O ATOM 45438 H1 WAT 8940 85.745 144.301 86.304 1.00 0.00 H ATOM 45439 H2 WAT 8940 84.505 144.729 85.550 1.00 0.00 H TER 45441 WAT 8940 ATOM 45441 O WAT 8941 93.929 102.313 127.063 1.00 0.00 O ATOM 45442 H1 WAT 8941 93.562 102.367 127.945 1.00 0.00 H ATOM 45443 H2 WAT 8941 94.869 102.445 127.186 1.00 0.00 H TER 45445 WAT 8941 ATOM 45445 O WAT 8942 69.647 15.935 11.545 1.00 0.00 O ATOM 45446 H1 WAT 8942 70.508 15.618 11.273 1.00 0.00 H ATOM 45447 H2 WAT 8942 69.197 16.138 10.725 1.00 0.00 H TER 45449 WAT 8942 ATOM 45449 O WAT 8943 66.109 74.155 93.612 1.00 0.00 O ATOM 45450 H1 WAT 8943 65.827 73.633 94.363 1.00 0.00 H ATOM 45451 H2 WAT 8943 66.050 75.061 93.913 1.00 0.00 H TER 45453 WAT 8943 ATOM 45453 O WAT 8944 80.211 59.756 85.319 1.00 0.00 O ATOM 45454 H1 WAT 8944 80.323 59.424 86.210 1.00 0.00 H ATOM 45455 H2 WAT 8944 81.097 59.778 84.959 1.00 0.00 H TER 45457 WAT 8944 ATOM 45457 O WAT 8945 44.920 81.988 90.143 1.00 0.00 O ATOM 45458 H1 WAT 8945 45.524 81.661 89.476 1.00 0.00 H ATOM 45459 H2 WAT 8945 44.245 81.312 90.207 1.00 0.00 H TER 45461 WAT 8945 ATOM 45461 O WAT 8946 131.073 56.005 14.652 1.00 0.00 O ATOM 45462 H1 WAT 8946 132.002 56.160 14.823 1.00 0.00 H ATOM 45463 H2 WAT 8946 131.056 55.569 13.800 1.00 0.00 H TER 45465 WAT 8946 ATOM 45465 O WAT 8947 47.212 36.561 136.485 1.00 0.00 O ATOM 45466 H1 WAT 8947 46.944 36.195 137.328 1.00 0.00 H ATOM 45467 H2 WAT 8947 47.047 37.500 136.567 1.00 0.00 H TER 45469 WAT 8947 ATOM 45469 O WAT 8948 137.938 56.427 138.449 1.00 0.00 O ATOM 45470 H1 WAT 8948 138.179 55.545 138.166 1.00 0.00 H ATOM 45471 H2 WAT 8948 138.771 56.893 138.516 1.00 0.00 H TER 45473 WAT 8948 ATOM 45473 O WAT 8949 104.536 44.540 153.429 1.00 0.00 O ATOM 45474 H1 WAT 8949 103.679 44.159 153.619 1.00 0.00 H ATOM 45475 H2 WAT 8949 104.874 44.808 154.283 1.00 0.00 H TER 45477 WAT 8949 ATOM 45477 O WAT 8950 113.234 139.777 95.557 1.00 0.00 O ATOM 45478 H1 WAT 8950 113.776 139.334 94.904 1.00 0.00 H ATOM 45479 H2 WAT 8950 113.017 139.095 96.192 1.00 0.00 H TER 45481 WAT 8950 ATOM 45481 O WAT 8951 93.412 83.225 116.883 1.00 0.00 O ATOM 45482 H1 WAT 8951 92.458 83.310 116.896 1.00 0.00 H ATOM 45483 H2 WAT 8951 93.567 82.282 116.825 1.00 0.00 H TER 45485 WAT 8951 ATOM 45485 O WAT 8952 90.996 98.366 9.663 1.00 0.00 O ATOM 45486 H1 WAT 8952 90.190 98.843 9.464 1.00 0.00 H ATOM 45487 H2 WAT 8952 91.447 98.297 8.822 1.00 0.00 H TER 45489 WAT 8952 ATOM 45489 O WAT 8953 100.260 7.467 107.040 1.00 0.00 O ATOM 45490 H1 WAT 8953 100.449 7.133 107.917 1.00 0.00 H ATOM 45491 H2 WAT 8953 100.537 8.382 107.067 1.00 0.00 H TER 45493 WAT 8953 ATOM 45493 O WAT 8954 129.379 37.992 156.502 1.00 0.00 O ATOM 45494 H1 WAT 8954 129.259 37.646 155.618 1.00 0.00 H ATOM 45495 H2 WAT 8954 130.007 38.707 156.397 1.00 0.00 H TER 45497 WAT 8954 ATOM 45497 O WAT 8955 67.374 128.277 92.972 1.00 0.00 O ATOM 45498 H1 WAT 8955 66.566 128.703 93.258 1.00 0.00 H ATOM 45499 H2 WAT 8955 67.087 127.620 92.337 1.00 0.00 H TER 45501 WAT 8955 ATOM 45501 O WAT 8956 138.446 86.060 72.747 1.00 0.00 O ATOM 45502 H1 WAT 8956 138.681 85.595 73.550 1.00 0.00 H ATOM 45503 H2 WAT 8956 137.875 85.453 72.277 1.00 0.00 H TER 45505 WAT 8956 ATOM 45505 O WAT 8957 22.569 82.169 122.230 1.00 0.00 O ATOM 45506 H1 WAT 8957 23.140 81.967 122.971 1.00 0.00 H ATOM 45507 H2 WAT 8957 21.705 82.299 122.622 1.00 0.00 H TER 45509 WAT 8957 ATOM 45509 O WAT 8958 102.677 122.011 19.404 1.00 0.00 O ATOM 45510 H1 WAT 8958 102.890 122.810 19.887 1.00 0.00 H ATOM 45511 H2 WAT 8958 103.257 121.346 19.775 1.00 0.00 H TER 45513 WAT 8958 ATOM 45513 O WAT 8959 18.158 23.090 85.332 1.00 0.00 O ATOM 45514 H1 WAT 8959 18.207 23.587 86.149 1.00 0.00 H ATOM 45515 H2 WAT 8959 19.020 22.684 85.247 1.00 0.00 H TER 45517 WAT 8959 ATOM 45517 O WAT 8960 28.933 107.281 85.865 1.00 0.00 O ATOM 45518 H1 WAT 8960 29.552 107.631 86.505 1.00 0.00 H ATOM 45519 H2 WAT 8960 28.387 106.675 86.367 1.00 0.00 H TER 45521 WAT 8960 ATOM 45521 O WAT 8961 65.100 8.112 86.687 1.00 0.00 O ATOM 45522 H1 WAT 8961 65.883 7.602 86.479 1.00 0.00 H ATOM 45523 H2 WAT 8961 64.524 7.985 85.933 1.00 0.00 H TER 45525 WAT 8961 ATOM 45525 O WAT 8962 24.425 12.962 134.646 1.00 0.00 O ATOM 45526 H1 WAT 8962 25.225 12.440 134.591 1.00 0.00 H ATOM 45527 H2 WAT 8962 24.353 13.194 135.572 1.00 0.00 H TER 45529 WAT 8962 ATOM 45529 O WAT 8963 36.467 67.563 78.232 1.00 0.00 O ATOM 45530 H1 WAT 8963 37.180 67.211 77.700 1.00 0.00 H ATOM 45531 H2 WAT 8963 36.107 66.801 78.686 1.00 0.00 H TER 45533 WAT 8963 ATOM 45533 O WAT 8964 86.193 109.603 101.204 1.00 0.00 O ATOM 45534 H1 WAT 8964 86.741 109.231 100.513 1.00 0.00 H ATOM 45535 H2 WAT 8964 86.303 109.008 101.945 1.00 0.00 H TER 45537 WAT 8964 ATOM 45537 O WAT 8965 144.286 54.280 89.638 1.00 0.00 O ATOM 45538 H1 WAT 8965 144.692 54.620 88.841 1.00 0.00 H ATOM 45539 H2 WAT 8965 144.701 54.772 90.347 1.00 0.00 H TER 45541 WAT 8965 ATOM 45541 O WAT 8966 114.203 94.605 12.049 1.00 0.00 O ATOM 45542 H1 WAT 8966 114.959 94.290 12.545 1.00 0.00 H ATOM 45543 H2 WAT 8966 114.256 95.558 12.112 1.00 0.00 H TER 45545 WAT 8966 ATOM 45545 O WAT 8967 82.658 31.557 147.874 1.00 0.00 O ATOM 45546 H1 WAT 8967 82.409 32.374 148.306 1.00 0.00 H ATOM 45547 H2 WAT 8967 81.828 31.176 147.586 1.00 0.00 H TER 45549 WAT 8967 ATOM 45549 O WAT 8968 92.019 127.251 133.855 1.00 0.00 O ATOM 45550 H1 WAT 8968 92.660 127.172 133.148 1.00 0.00 H ATOM 45551 H2 WAT 8968 91.979 128.190 134.038 1.00 0.00 H TER 45553 WAT 8968 ATOM 45553 O WAT 8969 57.130 126.119 120.730 1.00 0.00 O ATOM 45554 H1 WAT 8969 56.417 126.169 121.367 1.00 0.00 H ATOM 45555 H2 WAT 8969 57.337 125.186 120.676 1.00 0.00 H TER 45557 WAT 8969 ATOM 45557 O WAT 8970 144.252 112.796 71.539 1.00 0.00 O ATOM 45558 H1 WAT 8970 143.790 112.295 70.866 1.00 0.00 H ATOM 45559 H2 WAT 8970 143.935 113.692 71.431 1.00 0.00 H TER 45561 WAT 8970 ATOM 45561 O WAT 8971 16.615 82.487 114.891 1.00 0.00 O ATOM 45562 H1 WAT 8971 17.407 82.339 114.374 1.00 0.00 H ATOM 45563 H2 WAT 8971 16.390 81.623 115.237 1.00 0.00 H TER 45565 WAT 8971 ATOM 45565 O WAT 8972 89.603 137.426 0.291 1.00 0.00 O ATOM 45566 H1 WAT 8972 89.288 137.801 -0.531 1.00 0.00 H ATOM 45567 H2 WAT 8972 90.302 138.017 0.571 1.00 0.00 H TER 45569 WAT 8972 ATOM 45569 O WAT 8973 26.054 115.251 8.823 1.00 0.00 O ATOM 45570 H1 WAT 8973 25.761 115.326 9.731 1.00 0.00 H ATOM 45571 H2 WAT 8973 26.244 116.151 8.557 1.00 0.00 H TER 45573 WAT 8973 ATOM 45573 O WAT 8974 27.186 92.406 150.256 1.00 0.00 O ATOM 45574 H1 WAT 8974 26.681 91.745 150.730 1.00 0.00 H ATOM 45575 H2 WAT 8974 27.436 91.976 149.439 1.00 0.00 H TER 45577 WAT 8974 ATOM 45577 O WAT 8975 32.714 94.869 83.087 1.00 0.00 O ATOM 45578 H1 WAT 8975 32.912 95.170 83.974 1.00 0.00 H ATOM 45579 H2 WAT 8975 33.148 95.504 82.517 1.00 0.00 H TER 45581 WAT 8975 ATOM 45581 O WAT 8976 66.834 108.628 82.012 1.00 0.00 O ATOM 45582 H1 WAT 8976 66.221 108.220 81.400 1.00 0.00 H ATOM 45583 H2 WAT 8976 66.917 107.996 82.725 1.00 0.00 H TER 45585 WAT 8976 ATOM 45585 O WAT 8977 71.014 52.087 123.441 1.00 0.00 O ATOM 45586 H1 WAT 8977 70.528 52.249 124.250 1.00 0.00 H ATOM 45587 H2 WAT 8977 71.912 52.348 123.644 1.00 0.00 H TER 45589 WAT 8977 ATOM 45589 O WAT 8978 48.267 122.624 92.232 1.00 0.00 O ATOM 45590 H1 WAT 8978 47.826 121.939 92.734 1.00 0.00 H ATOM 45591 H2 WAT 8978 48.284 123.379 92.821 1.00 0.00 H TER 45593 WAT 8978 ATOM 45593 O WAT 8979 117.965 70.221 128.977 1.00 0.00 O ATOM 45594 H1 WAT 8979 117.362 69.788 128.372 1.00 0.00 H ATOM 45595 H2 WAT 8979 117.860 71.154 128.793 1.00 0.00 H TER 45597 WAT 8979 ATOM 45597 O WAT 8980 10.902 77.243 64.606 1.00 0.00 O ATOM 45598 H1 WAT 8980 10.566 76.368 64.411 1.00 0.00 H ATOM 45599 H2 WAT 8980 10.902 77.693 63.761 1.00 0.00 H TER 45601 WAT 8980 ATOM 45601 O WAT 8981 103.789 97.751 9.288 1.00 0.00 O ATOM 45602 H1 WAT 8981 102.985 97.529 9.757 1.00 0.00 H ATOM 45603 H2 WAT 8981 103.572 97.619 8.365 1.00 0.00 H TER 45605 WAT 8981 ATOM 45605 O WAT 8982 128.189 78.018 22.961 1.00 0.00 O ATOM 45606 H1 WAT 8982 128.186 77.169 23.402 1.00 0.00 H ATOM 45607 H2 WAT 8982 127.979 77.815 22.049 1.00 0.00 H TER 45609 WAT 8982 ATOM 45609 O WAT 8983 45.294 72.432 116.719 1.00 0.00 O ATOM 45610 H1 WAT 8983 45.463 73.300 117.086 1.00 0.00 H ATOM 45611 H2 WAT 8983 46.149 72.131 116.413 1.00 0.00 H TER 45613 WAT 8983 ATOM 45613 O WAT 8984 23.657 16.847 98.523 1.00 0.00 O ATOM 45614 H1 WAT 8984 24.279 16.660 99.226 1.00 0.00 H ATOM 45615 H2 WAT 8984 22.941 17.313 98.954 1.00 0.00 H TER 45617 WAT 8984 ATOM 45617 O WAT 8985 114.257 138.984 78.976 1.00 0.00 O ATOM 45618 H1 WAT 8985 114.593 139.856 78.768 1.00 0.00 H ATOM 45619 H2 WAT 8985 114.095 139.008 79.919 1.00 0.00 H TER 45621 WAT 8985 ATOM 45621 O WAT 8986 70.474 133.568 100.079 1.00 0.00 O ATOM 45622 H1 WAT 8986 70.000 133.772 99.273 1.00 0.00 H ATOM 45623 H2 WAT 8986 71.340 133.287 99.783 1.00 0.00 H TER 45625 WAT 8986 ATOM 45625 O WAT 8987 109.511 18.059 99.410 1.00 0.00 O ATOM 45626 H1 WAT 8987 110.428 18.197 99.650 1.00 0.00 H ATOM 45627 H2 WAT 8987 109.356 17.130 99.582 1.00 0.00 H TER 45629 WAT 8987 ATOM 45629 O WAT 8988 113.548 60.772 149.325 1.00 0.00 O ATOM 45630 H1 WAT 8988 113.990 60.322 150.045 1.00 0.00 H ATOM 45631 H2 WAT 8988 112.669 60.394 149.309 1.00 0.00 H TER 45633 WAT 8988 ATOM 45633 O WAT 8989 17.209 44.443 140.560 1.00 0.00 O ATOM 45634 H1 WAT 8989 17.158 45.382 140.738 1.00 0.00 H ATOM 45635 H2 WAT 8989 18.145 44.271 140.453 1.00 0.00 H TER 45637 WAT 8989 ATOM 45637 O WAT 8990 87.033 41.230 126.237 1.00 0.00 O ATOM 45638 H1 WAT 8990 87.717 41.891 126.346 1.00 0.00 H ATOM 45639 H2 WAT 8990 86.245 41.639 126.594 1.00 0.00 H TER 45641 WAT 8990 ATOM 45641 O WAT 8991 43.654 71.675 114.433 1.00 0.00 O ATOM 45642 H1 WAT 8991 44.005 71.894 115.296 1.00 0.00 H ATOM 45643 H2 WAT 8991 43.405 70.753 114.503 1.00 0.00 H TER 45645 WAT 8991 ATOM 45645 O WAT 8992 81.501 88.004 15.318 1.00 0.00 O ATOM 45646 H1 WAT 8992 82.021 88.807 15.354 1.00 0.00 H ATOM 45647 H2 WAT 8992 81.765 87.512 16.095 1.00 0.00 H TER 45649 WAT 8992 ATOM 45649 O WAT 8993 142.209 131.951 10.273 1.00 0.00 O ATOM 45650 H1 WAT 8993 141.921 131.746 11.163 1.00 0.00 H ATOM 45651 H2 WAT 8993 142.269 132.906 10.254 1.00 0.00 H TER 45653 WAT 8993 ATOM 45653 O WAT 8994 52.647 99.114 147.271 1.00 0.00 O ATOM 45654 H1 WAT 8994 53.228 99.708 147.747 1.00 0.00 H ATOM 45655 H2 WAT 8994 52.899 98.241 147.571 1.00 0.00 H TER 45657 WAT 8994 ATOM 45657 O WAT 8995 132.865 121.271 9.877 1.00 0.00 O ATOM 45658 H1 WAT 8995 133.210 122.148 10.042 1.00 0.00 H ATOM 45659 H2 WAT 8995 131.924 121.401 9.760 1.00 0.00 H TER 45661 WAT 8995 ATOM 45661 O WAT 8996 42.913 11.164 125.125 1.00 0.00 O ATOM 45662 H1 WAT 8996 42.233 11.057 124.459 1.00 0.00 H ATOM 45663 H2 WAT 8996 43.216 12.065 125.016 1.00 0.00 H TER 45665 WAT 8996 ATOM 45665 O WAT 8997 108.662 97.494 152.064 1.00 0.00 O ATOM 45666 H1 WAT 8997 109.410 97.619 152.648 1.00 0.00 H ATOM 45667 H2 WAT 8997 109.049 97.206 151.237 1.00 0.00 H TER 45669 WAT 8997 ATOM 45669 O WAT 8998 32.448 83.985 100.270 1.00 0.00 O ATOM 45670 H1 WAT 8998 33.278 84.082 99.803 1.00 0.00 H ATOM 45671 H2 WAT 8998 32.649 84.241 101.170 1.00 0.00 H TER 45673 WAT 8998 ATOM 45673 O WAT 8999 25.456 53.348 53.740 1.00 0.00 O ATOM 45674 H1 WAT 8999 25.922 54.114 53.406 1.00 0.00 H ATOM 45675 H2 WAT 8999 25.770 52.622 53.200 1.00 0.00 H TER 45677 WAT 8999 ATOM 45677 O WAT 9000 66.864 16.040 112.455 1.00 0.00 O ATOM 45678 H1 WAT 9000 65.946 16.184 112.226 1.00 0.00 H ATOM 45679 H2 WAT 9000 66.880 16.071 113.412 1.00 0.00 H TER 45681 WAT 9000 ATOM 45681 O WAT 9001 24.827 66.195 144.191 1.00 0.00 O ATOM 45682 H1 WAT 9001 24.727 65.329 144.587 1.00 0.00 H ATOM 45683 H2 WAT 9001 25.466 66.641 144.747 1.00 0.00 H TER 45685 WAT 9001 ATOM 45685 O WAT 9002 64.250 93.740 25.840 1.00 0.00 O ATOM 45686 H1 WAT 9002 63.778 93.085 26.354 1.00 0.00 H ATOM 45687 H2 WAT 9002 63.562 94.269 25.436 1.00 0.00 H TER 45689 WAT 9002 ATOM 45689 O WAT 9003 84.280 111.341 80.927 1.00 0.00 O ATOM 45690 H1 WAT 9003 84.758 110.565 81.220 1.00 0.00 H ATOM 45691 H2 WAT 9003 83.361 111.077 80.942 1.00 0.00 H TER 45693 WAT 9003 ATOM 45693 O WAT 9004 134.919 145.597 142.026 1.00 0.00 O ATOM 45694 H1 WAT 9004 133.983 145.576 141.825 1.00 0.00 H ATOM 45695 H2 WAT 9004 135.039 144.908 142.679 1.00 0.00 H TER 45697 WAT 9004 ATOM 45697 O WAT 9005 90.134 15.089 104.094 1.00 0.00 O ATOM 45698 H1 WAT 9005 89.713 15.948 104.054 1.00 0.00 H ATOM 45699 H2 WAT 9005 90.832 15.135 103.441 1.00 0.00 H TER 45701 WAT 9005 ATOM 45701 O WAT 9006 82.472 16.759 148.837 1.00 0.00 O ATOM 45702 H1 WAT 9006 83.353 17.044 148.591 1.00 0.00 H ATOM 45703 H2 WAT 9006 82.410 15.863 148.508 1.00 0.00 H TER 45705 WAT 9006 ATOM 45705 O WAT 9007 68.394 101.057 26.215 1.00 0.00 O ATOM 45706 H1 WAT 9007 68.871 101.878 26.092 1.00 0.00 H ATOM 45707 H2 WAT 9007 67.681 101.097 25.577 1.00 0.00 H TER 45709 WAT 9007 ATOM 45709 O WAT 9008 91.318 127.569 115.358 1.00 0.00 O ATOM 45710 H1 WAT 9008 91.578 128.335 115.871 1.00 0.00 H ATOM 45711 H2 WAT 9008 91.209 126.874 116.007 1.00 0.00 H TER 45713 WAT 9008 ATOM 45713 O WAT 9009 101.151 127.223 126.279 1.00 0.00 O ATOM 45714 H1 WAT 9009 100.332 127.302 125.789 1.00 0.00 H ATOM 45715 H2 WAT 9009 100.946 127.574 127.146 1.00 0.00 H TER 45717 WAT 9009 ATOM 45717 O WAT 9010 29.284 91.484 155.258 1.00 0.00 O ATOM 45718 H1 WAT 9010 29.793 91.908 155.948 1.00 0.00 H ATOM 45719 H2 WAT 9010 28.440 91.935 155.270 1.00 0.00 H TER 45721 WAT 9010 ATOM 45721 O WAT 9011 37.015 139.517 120.264 1.00 0.00 O ATOM 45722 H1 WAT 9011 37.110 140.214 119.614 1.00 0.00 H ATOM 45723 H2 WAT 9011 37.864 139.074 120.264 1.00 0.00 H TER 45725 WAT 9011 ATOM 45725 O WAT 9012 98.853 84.574 6.036 1.00 0.00 O ATOM 45726 H1 WAT 9012 99.337 84.335 5.245 1.00 0.00 H ATOM 45727 H2 WAT 9012 98.669 83.738 6.465 1.00 0.00 H TER 45729 WAT 9012 ATOM 45729 O WAT 9013 0.574 86.126 98.941 1.00 0.00 O ATOM 45730 H1 WAT 9013 1.107 86.711 98.403 1.00 0.00 H ATOM 45731 H2 WAT 9013 -0.270 86.571 99.015 1.00 0.00 H TER 45733 WAT 9013 ATOM 45733 O WAT 9014 36.363 79.947 109.055 1.00 0.00 O ATOM 45734 H1 WAT 9014 36.115 80.841 108.820 1.00 0.00 H ATOM 45735 H2 WAT 9014 36.136 79.425 108.286 1.00 0.00 H TER 45737 WAT 9014 ATOM 45737 O WAT 9015 56.038 74.005 14.755 1.00 0.00 O ATOM 45738 H1 WAT 9015 55.562 73.618 14.020 1.00 0.00 H ATOM 45739 H2 WAT 9015 56.257 74.888 14.460 1.00 0.00 H TER 45741 WAT 9015 ATOM 45741 O WAT 9016 16.498 72.695 157.157 1.00 0.00 O ATOM 45742 H1 WAT 9016 16.939 72.436 156.348 1.00 0.00 H ATOM 45743 H2 WAT 9016 15.572 72.743 156.921 1.00 0.00 H TER 45745 WAT 9016 ATOM 45745 O WAT 9017 28.700 133.813 134.757 1.00 0.00 O ATOM 45746 H1 WAT 9017 29.063 132.969 135.026 1.00 0.00 H ATOM 45747 H2 WAT 9017 27.935 133.935 135.318 1.00 0.00 H TER 45749 WAT 9017 ATOM 45749 O WAT 9018 44.051 63.682 119.617 1.00 0.00 O ATOM 45750 H1 WAT 9018 44.636 63.068 119.173 1.00 0.00 H ATOM 45751 H2 WAT 9018 44.366 64.546 119.355 1.00 0.00 H TER 45753 WAT 9018 ATOM 45753 O WAT 9019 118.108 143.713 64.229 1.00 0.00 O ATOM 45754 H1 WAT 9019 118.861 144.280 64.390 1.00 0.00 H ATOM 45755 H2 WAT 9019 118.344 143.217 63.445 1.00 0.00 H TER 45757 WAT 9019 ATOM 45757 O WAT 9020 61.606 86.636 63.769 1.00 0.00 O ATOM 45758 H1 WAT 9020 61.940 87.523 63.633 1.00 0.00 H ATOM 45759 H2 WAT 9020 62.197 86.254 64.418 1.00 0.00 H TER 45761 WAT 9020 ATOM 45761 O WAT 9021 130.401 79.423 23.729 1.00 0.00 O ATOM 45762 H1 WAT 9021 130.959 78.872 24.278 1.00 0.00 H ATOM 45763 H2 WAT 9021 129.649 78.870 23.521 1.00 0.00 H TER 45765 WAT 9021 ATOM 45765 O WAT 9022 121.349 83.283 104.022 1.00 0.00 O ATOM 45766 H1 WAT 9022 120.834 83.439 104.814 1.00 0.00 H ATOM 45767 H2 WAT 9022 122.232 83.574 104.249 1.00 0.00 H TER 45769 WAT 9022 ATOM 45769 O WAT 9023 109.830 87.927 73.089 1.00 0.00 O ATOM 45770 H1 WAT 9023 110.391 87.352 72.569 1.00 0.00 H ATOM 45771 H2 WAT 9023 109.552 88.608 72.476 1.00 0.00 H TER 45773 WAT 9023 ATOM 45773 O WAT 9024 140.376 77.370 147.983 1.00 0.00 O ATOM 45774 H1 WAT 9024 140.967 76.699 147.641 1.00 0.00 H ATOM 45775 H2 WAT 9024 140.801 77.678 148.783 1.00 0.00 H TER 45777 WAT 9024 ATOM 45777 O WAT 9025 44.833 77.816 123.475 1.00 0.00 O ATOM 45778 H1 WAT 9025 44.380 78.324 122.802 1.00 0.00 H ATOM 45779 H2 WAT 9025 44.286 77.040 123.599 1.00 0.00 H TER 45781 WAT 9025 ATOM 45781 O WAT 9026 37.576 24.562 133.035 1.00 0.00 O ATOM 45782 H1 WAT 9026 36.819 24.156 132.612 1.00 0.00 H ATOM 45783 H2 WAT 9026 37.520 25.486 132.791 1.00 0.00 H TER 45785 WAT 9026 ATOM 45785 O WAT 9027 91.910 46.418 77.338 1.00 0.00 O ATOM 45786 H1 WAT 9027 91.651 45.507 77.199 1.00 0.00 H ATOM 45787 H2 WAT 9027 91.699 46.590 78.255 1.00 0.00 H TER 45789 WAT 9027 ATOM 45789 O WAT 9028 120.735 29.505 121.949 1.00 0.00 O ATOM 45790 H1 WAT 9028 121.106 30.379 122.075 1.00 0.00 H ATOM 45791 H2 WAT 9028 120.926 29.044 122.765 1.00 0.00 H TER 45793 WAT 9028 ATOM 45793 O WAT 9029 97.307 99.438 95.742 1.00 0.00 O ATOM 45794 H1 WAT 9029 97.430 99.532 96.687 1.00 0.00 H ATOM 45795 H2 WAT 9029 97.368 100.330 95.402 1.00 0.00 H TER 45797 WAT 9029 ATOM 45797 O WAT 9030 74.063 68.933 127.543 1.00 0.00 O ATOM 45798 H1 WAT 9030 74.417 68.052 127.658 1.00 0.00 H ATOM 45799 H2 WAT 9030 74.826 69.508 127.601 1.00 0.00 H TER 45801 WAT 9030 ATOM 45801 O WAT 9031 120.591 132.863 73.457 1.00 0.00 O ATOM 45802 H1 WAT 9031 120.312 132.902 74.371 1.00 0.00 H ATOM 45803 H2 WAT 9031 120.830 131.946 73.319 1.00 0.00 H TER 45805 WAT 9031 ATOM 45805 O WAT 9032 86.254 16.689 4.502 1.00 0.00 O ATOM 45806 H1 WAT 9032 85.578 16.348 3.917 1.00 0.00 H ATOM 45807 H2 WAT 9032 85.962 16.436 5.378 1.00 0.00 H TER 45809 WAT 9032 ATOM 45809 O WAT 9033 35.959 78.757 117.528 1.00 0.00 O ATOM 45810 H1 WAT 9033 35.701 78.102 118.176 1.00 0.00 H ATOM 45811 H2 WAT 9033 35.212 79.354 117.480 1.00 0.00 H TER 45813 WAT 9033 ATOM 45813 O WAT 9034 15.811 116.589 104.169 1.00 0.00 O ATOM 45814 H1 WAT 9034 14.899 116.321 104.277 1.00 0.00 H ATOM 45815 H2 WAT 9034 16.109 116.118 103.391 1.00 0.00 H TER 45817 WAT 9034 ATOM 45817 O WAT 9035 99.187 35.608 116.613 1.00 0.00 O ATOM 45818 H1 WAT 9035 99.172 36.529 116.353 1.00 0.00 H ATOM 45819 H2 WAT 9035 98.302 35.436 116.935 1.00 0.00 H TER 45821 WAT 9035 ATOM 45821 O WAT 9036 93.185 7.977 137.762 1.00 0.00 O ATOM 45822 H1 WAT 9036 94.039 8.059 138.187 1.00 0.00 H ATOM 45823 H2 WAT 9036 93.390 7.736 136.858 1.00 0.00 H TER 45825 WAT 9036 ATOM 45825 O WAT 9037 109.109 29.411 121.551 1.00 0.00 O ATOM 45826 H1 WAT 9037 108.675 30.094 121.039 1.00 0.00 H ATOM 45827 H2 WAT 9037 109.546 28.863 120.899 1.00 0.00 H TER 45829 WAT 9037 ATOM 45829 O WAT 9038 114.169 55.150 92.260 1.00 0.00 O ATOM 45830 H1 WAT 9038 114.394 55.039 93.184 1.00 0.00 H ATOM 45831 H2 WAT 9038 113.892 54.279 91.975 1.00 0.00 H TER 45833 WAT 9038 ATOM 45833 O WAT 9039 50.328 126.649 157.716 1.00 0.00 O ATOM 45834 H1 WAT 9039 50.488 127.267 157.003 1.00 0.00 H ATOM 45835 H2 WAT 9039 51.154 126.622 158.199 1.00 0.00 H TER 45837 WAT 9039 ATOM 45837 O WAT 9040 69.690 25.072 13.571 1.00 0.00 O ATOM 45838 H1 WAT 9040 69.330 25.025 14.456 1.00 0.00 H ATOM 45839 H2 WAT 9040 69.026 24.658 13.019 1.00 0.00 H TER 45841 WAT 9040 ATOM 45841 O WAT 9041 104.315 98.701 116.821 1.00 0.00 O ATOM 45842 H1 WAT 9041 103.483 98.898 116.390 1.00 0.00 H ATOM 45843 H2 WAT 9041 104.964 99.203 116.329 1.00 0.00 H TER 45845 WAT 9041 ATOM 45845 O WAT 9042 89.448 116.726 54.477 1.00 0.00 O ATOM 45846 H1 WAT 9042 89.445 117.434 53.832 1.00 0.00 H ATOM 45847 H2 WAT 9042 88.915 116.038 54.079 1.00 0.00 H TER 45849 WAT 9042 ATOM 45849 O WAT 9043 129.627 34.565 152.737 1.00 0.00 O ATOM 45850 H1 WAT 9043 129.873 33.952 153.430 1.00 0.00 H ATOM 45851 H2 WAT 9043 130.387 34.587 152.156 1.00 0.00 H TER 45853 WAT 9043 ATOM 45853 O WAT 9044 72.170 76.632 10.563 1.00 0.00 O ATOM 45854 H1 WAT 9044 72.205 75.762 10.961 1.00 0.00 H ATOM 45855 H2 WAT 9044 72.332 77.234 11.289 1.00 0.00 H TER 45857 WAT 9044 ATOM 45857 O WAT 9045 5.563 115.754 114.879 1.00 0.00 O ATOM 45858 H1 WAT 9045 4.886 115.816 114.205 1.00 0.00 H ATOM 45859 H2 WAT 9045 5.576 114.828 115.121 1.00 0.00 H TER 45861 WAT 9045 ATOM 45861 O WAT 9046 44.934 129.021 96.217 1.00 0.00 O ATOM 45862 H1 WAT 9046 44.390 129.782 96.011 1.00 0.00 H ATOM 45863 H2 WAT 9046 44.463 128.574 96.921 1.00 0.00 H TER 45865 WAT 9046 ATOM 45865 O WAT 9047 15.326 64.257 65.484 1.00 0.00 O ATOM 45866 H1 WAT 9047 14.378 64.240 65.616 1.00 0.00 H ATOM 45867 H2 WAT 9047 15.436 64.229 64.534 1.00 0.00 H TER 45869 WAT 9047 ATOM 45869 O WAT 9048 28.476 136.001 151.457 1.00 0.00 O ATOM 45870 H1 WAT 9048 28.190 136.912 151.381 1.00 0.00 H ATOM 45871 H2 WAT 9048 28.991 135.978 152.263 1.00 0.00 H TER 45873 WAT 9048 ATOM 45873 O WAT 9049 26.552 57.076 106.990 1.00 0.00 O ATOM 45874 H1 WAT 9049 26.536 57.740 107.680 1.00 0.00 H ATOM 45875 H2 WAT 9049 26.747 57.566 106.191 1.00 0.00 H TER 45877 WAT 9049 ATOM 45877 O WAT 9050 99.978 145.128 3.058 1.00 0.00 O ATOM 45878 H1 WAT 9050 100.284 144.625 3.813 1.00 0.00 H ATOM 45879 H2 WAT 9050 100.238 144.604 2.300 1.00 0.00 H TER 45881 WAT 9050 ATOM 45881 O WAT 9051 136.360 42.599 24.426 1.00 0.00 O ATOM 45882 H1 WAT 9051 137.221 42.430 24.809 1.00 0.00 H ATOM 45883 H2 WAT 9051 136.313 42.011 23.673 1.00 0.00 H TER 45885 WAT 9051 ATOM 45885 O WAT 9052 31.091 92.425 20.888 1.00 0.00 O ATOM 45886 H1 WAT 9052 31.589 93.205 20.643 1.00 0.00 H ATOM 45887 H2 WAT 9052 31.429 91.736 20.316 1.00 0.00 H TER 45889 WAT 9052 ATOM 45889 O WAT 9053 7.308 8.662 121.460 1.00 0.00 O ATOM 45890 H1 WAT 9053 6.570 8.852 122.040 1.00 0.00 H ATOM 45891 H2 WAT 9053 7.892 8.117 121.986 1.00 0.00 H TER 45893 WAT 9053 ATOM 45893 O WAT 9054 103.965 38.382 122.170 1.00 0.00 O ATOM 45894 H1 WAT 9054 104.054 38.702 123.068 1.00 0.00 H ATOM 45895 H2 WAT 9054 103.645 37.485 122.267 1.00 0.00 H TER 45897 WAT 9054 ATOM 45897 O WAT 9055 23.113 14.797 24.481 1.00 0.00 O ATOM 45898 H1 WAT 9055 22.352 15.001 23.937 1.00 0.00 H ATOM 45899 H2 WAT 9055 23.044 15.398 25.223 1.00 0.00 H TER 45901 WAT 9055 ATOM 45901 O WAT 9056 42.676 137.147 13.453 1.00 0.00 O ATOM 45902 H1 WAT 9056 43.371 137.746 13.179 1.00 0.00 H ATOM 45903 H2 WAT 9056 43.117 136.306 13.572 1.00 0.00 H TER 45905 WAT 9056 ATOM 45905 O WAT 9057 105.252 34.666 1.960 1.00 0.00 O ATOM 45906 H1 WAT 9057 105.719 34.081 1.363 1.00 0.00 H ATOM 45907 H2 WAT 9057 104.461 34.916 1.481 1.00 0.00 H TER 45909 WAT 9057 ATOM 45909 O WAT 9058 20.002 9.530 157.099 1.00 0.00 O ATOM 45910 H1 WAT 9058 19.666 10.329 156.694 1.00 0.00 H ATOM 45911 H2 WAT 9058 19.228 9.104 157.468 1.00 0.00 H TER 45913 WAT 9058 ATOM 45913 O WAT 9059 57.509 13.880 100.163 1.00 0.00 O ATOM 45914 H1 WAT 9059 56.611 13.999 99.854 1.00 0.00 H ATOM 45915 H2 WAT 9059 57.413 13.572 101.065 1.00 0.00 H TER 45917 WAT 9059 ATOM 45917 O WAT 9060 107.296 84.762 69.537 1.00 0.00 O ATOM 45918 H1 WAT 9060 108.170 84.818 69.151 1.00 0.00 H ATOM 45919 H2 WAT 9060 107.451 84.759 70.481 1.00 0.00 H TER 45921 WAT 9060 ATOM 45921 O WAT 9061 137.123 100.391 134.157 1.00 0.00 O ATOM 45922 H1 WAT 9061 137.688 100.451 134.927 1.00 0.00 H ATOM 45923 H2 WAT 9061 136.963 99.454 134.049 1.00 0.00 H TER 45925 WAT 9061 ATOM 45925 O WAT 9062 34.386 96.775 25.945 1.00 0.00 O ATOM 45926 H1 WAT 9062 33.449 96.933 26.059 1.00 0.00 H ATOM 45927 H2 WAT 9062 34.524 95.892 26.289 1.00 0.00 H TER 45929 WAT 9062 ATOM 45929 O WAT 9063 125.583 62.337 133.590 1.00 0.00 O ATOM 45930 H1 WAT 9063 126.525 62.427 133.732 1.00 0.00 H ATOM 45931 H2 WAT 9063 125.437 62.697 132.715 1.00 0.00 H TER 45933 WAT 9063 ATOM 45933 O WAT 9064 16.106 22.682 16.440 1.00 0.00 O ATOM 45934 H1 WAT 9064 15.529 22.918 17.166 1.00 0.00 H ATOM 45935 H2 WAT 9064 15.745 21.862 16.104 1.00 0.00 H TER 45937 WAT 9064 ATOM 45937 O WAT 9065 115.008 51.765 83.546 1.00 0.00 O ATOM 45938 H1 WAT 9065 114.858 52.151 82.683 1.00 0.00 H ATOM 45939 H2 WAT 9065 115.668 51.089 83.395 1.00 0.00 H TER 45941 WAT 9065 ATOM 45941 O WAT 9066 17.466 12.524 130.090 1.00 0.00 O ATOM 45942 H1 WAT 9066 18.160 11.950 130.413 1.00 0.00 H ATOM 45943 H2 WAT 9066 17.865 12.996 129.360 1.00 0.00 H TER 45945 WAT 9066 ATOM 45945 O WAT 9067 72.841 8.331 80.582 1.00 0.00 O ATOM 45946 H1 WAT 9067 72.033 7.864 80.794 1.00 0.00 H ATOM 45947 H2 WAT 9067 72.549 9.197 80.297 1.00 0.00 H TER 45949 WAT 9067 ATOM 45949 O WAT 9068 41.731 34.389 82.190 1.00 0.00 O ATOM 45950 H1 WAT 9068 42.686 34.452 82.191 1.00 0.00 H ATOM 45951 H2 WAT 9068 41.547 33.525 81.821 1.00 0.00 H TER 45953 WAT 9068 ATOM 45953 O WAT 9069 24.577 16.820 101.983 1.00 0.00 O ATOM 45954 H1 WAT 9069 25.424 16.767 101.539 1.00 0.00 H ATOM 45955 H2 WAT 9069 24.701 16.328 102.795 1.00 0.00 H TER 45957 WAT 9069 ATOM 45957 O WAT 9070 87.859 43.234 112.503 1.00 0.00 O ATOM 45958 H1 WAT 9070 88.738 42.978 112.784 1.00 0.00 H ATOM 45959 H2 WAT 9070 87.333 43.198 113.302 1.00 0.00 H TER 45961 WAT 9070 ATOM 45961 O WAT 9071 114.266 46.634 66.735 1.00 0.00 O ATOM 45962 H1 WAT 9071 113.922 47.433 67.135 1.00 0.00 H ATOM 45963 H2 WAT 9071 113.522 46.266 66.258 1.00 0.00 H TER 45965 WAT 9071 ATOM 45965 O WAT 9072 102.907 35.695 15.515 1.00 0.00 O ATOM 45966 H1 WAT 9072 103.439 35.018 15.932 1.00 0.00 H ATOM 45967 H2 WAT 9072 102.693 35.335 14.654 1.00 0.00 H TER 45969 WAT 9072 ATOM 45969 O WAT 9073 64.552 84.121 14.881 1.00 0.00 O ATOM 45970 H1 WAT 9073 63.841 84.698 14.599 1.00 0.00 H ATOM 45971 H2 WAT 9073 64.303 83.848 15.764 1.00 0.00 H TER 45973 WAT 9073 ATOM 45973 O WAT 9074 35.664 145.194 85.778 1.00 0.00 O ATOM 45974 H1 WAT 9074 36.396 144.588 85.888 1.00 0.00 H ATOM 45975 H2 WAT 9074 35.789 145.848 86.465 1.00 0.00 H TER 45977 WAT 9074 ATOM 45977 O WAT 9075 35.238 120.659 80.755 1.00 0.00 O ATOM 45978 H1 WAT 9075 34.337 120.926 80.937 1.00 0.00 H ATOM 45979 H2 WAT 9075 35.694 120.772 81.589 1.00 0.00 H TER 45981 WAT 9075 ATOM 45981 O WAT 9076 3.661 26.535 124.652 1.00 0.00 O ATOM 45982 H1 WAT 9076 2.750 26.823 124.719 1.00 0.00 H ATOM 45983 H2 WAT 9076 4.100 26.954 125.392 1.00 0.00 H TER 45985 WAT 9076 ATOM 45985 O WAT 9077 145.790 78.151 150.884 1.00 0.00 O ATOM 45986 H1 WAT 9077 145.286 78.813 150.411 1.00 0.00 H ATOM 45987 H2 WAT 9077 146.246 78.641 151.569 1.00 0.00 H TER 45989 WAT 9077 ATOM 45989 O WAT 9078 54.291 74.293 130.102 1.00 0.00 O ATOM 45990 H1 WAT 9078 54.981 73.887 130.626 1.00 0.00 H ATOM 45991 H2 WAT 9078 54.480 75.230 130.140 1.00 0.00 H TER 45993 WAT 9078 ATOM 45993 O WAT 9079 75.790 24.828 52.515 1.00 0.00 O ATOM 45994 H1 WAT 9079 76.738 24.937 52.579 1.00 0.00 H ATOM 45995 H2 WAT 9079 75.433 25.459 53.140 1.00 0.00 H TER 45997 WAT 9079 ATOM 45997 O WAT 9080 23.259 102.675 92.449 1.00 0.00 O ATOM 45998 H1 WAT 9080 22.362 102.349 92.383 1.00 0.00 H ATOM 45999 H2 WAT 9080 23.787 101.892 92.603 1.00 0.00 H TER 46001 WAT 9080 ATOM 46001 O WAT 9081 47.869 136.418 80.957 1.00 0.00 O ATOM 46002 H1 WAT 9081 47.278 136.086 80.282 1.00 0.00 H ATOM 46003 H2 WAT 9081 48.659 135.885 80.868 1.00 0.00 H TER 46005 WAT 9081 ATOM 46005 O WAT 9082 47.483 44.359 80.384 1.00 0.00 O ATOM 46006 H1 WAT 9082 48.369 44.118 80.656 1.00 0.00 H ATOM 46007 H2 WAT 9082 47.612 44.955 79.647 1.00 0.00 H TER 46009 WAT 9082 ATOM 46009 O WAT 9083 101.587 82.693 120.095 1.00 0.00 O ATOM 46010 H1 WAT 9083 100.920 82.999 119.481 1.00 0.00 H ATOM 46011 H2 WAT 9083 101.173 81.964 120.557 1.00 0.00 H TER 46013 WAT 9083 ATOM 46013 O WAT 9084 121.926 136.691 128.549 1.00 0.00 O ATOM 46014 H1 WAT 9084 122.785 137.097 128.661 1.00 0.00 H ATOM 46015 H2 WAT 9084 121.937 136.348 127.656 1.00 0.00 H TER 46017 WAT 9084 ATOM 46017 O WAT 9085 121.792 110.327 123.487 1.00 0.00 O ATOM 46018 H1 WAT 9085 121.895 109.521 123.994 1.00 0.00 H ATOM 46019 H2 WAT 9085 122.416 110.938 123.879 1.00 0.00 H TER 46021 WAT 9085 ATOM 46021 O WAT 9086 16.591 130.059 94.476 1.00 0.00 O ATOM 46022 H1 WAT 9086 17.213 129.342 94.354 1.00 0.00 H ATOM 46023 H2 WAT 9086 16.812 130.425 95.333 1.00 0.00 H TER 46025 WAT 9086 ATOM 46025 O WAT 9087 60.889 113.410 58.234 1.00 0.00 O ATOM 46026 H1 WAT 9087 60.307 112.907 58.805 1.00 0.00 H ATOM 46027 H2 WAT 9087 60.337 114.109 57.885 1.00 0.00 H TER 46029 WAT 9087 ATOM 46029 O WAT 9088 119.427 8.468 127.665 1.00 0.00 O ATOM 46030 H1 WAT 9088 119.162 9.362 127.449 1.00 0.00 H ATOM 46031 H2 WAT 9088 118.617 8.039 127.943 1.00 0.00 H TER 46033 WAT 9088 ATOM 46033 O WAT 9089 77.871 16.210 88.719 1.00 0.00 O ATOM 46034 H1 WAT 9089 77.485 15.612 89.359 1.00 0.00 H ATOM 46035 H2 WAT 9089 77.701 15.797 87.872 1.00 0.00 H TER 46037 WAT 9089 ATOM 46037 O WAT 9090 103.789 32.964 125.436 1.00 0.00 O ATOM 46038 H1 WAT 9090 104.200 32.636 126.236 1.00 0.00 H ATOM 46039 H2 WAT 9090 103.224 33.678 125.733 1.00 0.00 H TER 46041 WAT 9090 ATOM 46041 O WAT 9091 126.715 89.810 26.553 1.00 0.00 O ATOM 46042 H1 WAT 9091 127.000 89.704 27.460 1.00 0.00 H ATOM 46043 H2 WAT 9091 126.635 88.915 26.221 1.00 0.00 H TER 46045 WAT 9091 ATOM 46045 O WAT 9092 8.159 120.641 145.566 1.00 0.00 O ATOM 46046 H1 WAT 9092 7.750 120.112 146.251 1.00 0.00 H ATOM 46047 H2 WAT 9092 7.560 121.378 145.442 1.00 0.00 H TER 46049 WAT 9092 ATOM 46049 O WAT 9093 19.795 75.477 155.384 1.00 0.00 O ATOM 46050 H1 WAT 9093 20.348 76.257 155.354 1.00 0.00 H ATOM 46051 H2 WAT 9093 20.394 74.767 155.614 1.00 0.00 H TER 46053 WAT 9093 ATOM 46053 O WAT 9094 29.634 85.242 67.131 1.00 0.00 O ATOM 46054 H1 WAT 9094 30.416 85.120 66.593 1.00 0.00 H ATOM 46055 H2 WAT 9094 29.315 86.113 66.895 1.00 0.00 H TER 46057 WAT 9094 ATOM 46057 O WAT 9095 71.902 5.691 133.071 1.00 0.00 O ATOM 46058 H1 WAT 9095 72.136 6.234 133.824 1.00 0.00 H ATOM 46059 H2 WAT 9095 72.725 5.281 132.806 1.00 0.00 H TER 46061 WAT 9095 ATOM 46061 O WAT 9096 47.157 122.748 114.893 1.00 0.00 O ATOM 46062 H1 WAT 9096 47.979 123.224 115.018 1.00 0.00 H ATOM 46063 H2 WAT 9096 46.962 122.848 113.961 1.00 0.00 H TER 46065 WAT 9096 ATOM 46065 O WAT 9097 133.425 96.053 108.320 1.00 0.00 O ATOM 46066 H1 WAT 9097 133.554 96.942 108.651 1.00 0.00 H ATOM 46067 H2 WAT 9097 134.264 95.617 108.469 1.00 0.00 H TER 46069 WAT 9097 ATOM 46069 O WAT 9098 131.403 65.166 124.890 1.00 0.00 O ATOM 46070 H1 WAT 9098 130.876 65.519 124.172 1.00 0.00 H ATOM 46071 H2 WAT 9098 131.332 65.822 125.584 1.00 0.00 H TER 46073 WAT 9098 ATOM 46073 O WAT 9099 18.650 101.794 140.006 1.00 0.00 O ATOM 46074 H1 WAT 9099 17.797 101.891 140.429 1.00 0.00 H ATOM 46075 H2 WAT 9099 18.512 101.118 139.342 1.00 0.00 H TER 46077 WAT 9099 ATOM 46077 O WAT 9100 126.331 50.148 79.098 1.00 0.00 O ATOM 46078 H1 WAT 9100 127.033 50.276 79.736 1.00 0.00 H ATOM 46079 H2 WAT 9100 126.732 50.358 78.255 1.00 0.00 H TER 46081 WAT 9100 ATOM 46081 O WAT 9101 47.103 55.876 137.365 1.00 0.00 O ATOM 46082 H1 WAT 9101 46.186 55.798 137.631 1.00 0.00 H ATOM 46083 H2 WAT 9101 47.445 56.597 137.893 1.00 0.00 H TER 46085 WAT 9101 ATOM 46085 O WAT 9102 25.802 71.128 17.199 1.00 0.00 O ATOM 46086 H1 WAT 9102 25.006 70.718 16.859 1.00 0.00 H ATOM 46087 H2 WAT 9102 25.492 71.728 17.876 1.00 0.00 H TER 46089 WAT 9102 ATOM 46089 O WAT 9103 83.888 135.766 127.801 1.00 0.00 O ATOM 46090 H1 WAT 9103 83.452 135.019 128.213 1.00 0.00 H ATOM 46091 H2 WAT 9103 83.296 136.502 127.953 1.00 0.00 H TER 46093 WAT 9103 ATOM 46093 O WAT 9104 124.860 139.907 63.614 1.00 0.00 O ATOM 46094 H1 WAT 9104 124.154 139.399 64.013 1.00 0.00 H ATOM 46095 H2 WAT 9104 125.633 139.696 64.138 1.00 0.00 H TER 46097 WAT 9104 ATOM 46097 O WAT 9105 7.123 108.553 82.183 1.00 0.00 O ATOM 46098 H1 WAT 9105 7.414 107.710 82.529 1.00 0.00 H ATOM 46099 H2 WAT 9105 6.878 109.058 82.958 1.00 0.00 H TER 46101 WAT 9105 ATOM 46101 O WAT 9106 36.637 75.066 77.686 1.00 0.00 O ATOM 46102 H1 WAT 9106 35.784 75.243 78.082 1.00 0.00 H ATOM 46103 H2 WAT 9106 37.242 75.030 78.426 1.00 0.00 H TER 46105 WAT 9106 ATOM 46105 O WAT 9107 26.177 144.884 102.216 1.00 0.00 O ATOM 46106 H1 WAT 9107 26.317 144.379 103.017 1.00 0.00 H ATOM 46107 H2 WAT 9107 25.316 145.286 102.335 1.00 0.00 H TER 46109 WAT 9107 ATOM 46109 O WAT 9108 27.425 16.560 153.914 1.00 0.00 O ATOM 46110 H1 WAT 9108 28.078 16.916 154.516 1.00 0.00 H ATOM 46111 H2 WAT 9108 27.029 17.330 153.507 1.00 0.00 H TER 46113 WAT 9108 ATOM 46113 O WAT 9109 17.131 61.289 105.841 1.00 0.00 O ATOM 46114 H1 WAT 9109 17.985 61.506 106.214 1.00 0.00 H ATOM 46115 H2 WAT 9109 16.627 60.947 106.580 1.00 0.00 H TER 46117 WAT 9109 ATOM 46117 O WAT 9110 76.647 86.140 154.715 1.00 0.00 O ATOM 46118 H1 WAT 9110 76.357 87.024 154.489 1.00 0.00 H ATOM 46119 H2 WAT 9110 77.595 86.218 154.821 1.00 0.00 H TER 46121 WAT 9110 ATOM 46121 O WAT 9111 12.472 64.391 154.462 1.00 0.00 O ATOM 46122 H1 WAT 9111 12.858 63.795 155.104 1.00 0.00 H ATOM 46123 H2 WAT 9111 12.120 63.816 153.783 1.00 0.00 H TER 46125 WAT 9111 ATOM 46125 O WAT 9112 56.993 12.096 9.708 1.00 0.00 O ATOM 46126 H1 WAT 9112 56.931 11.436 10.398 1.00 0.00 H ATOM 46127 H2 WAT 9112 56.170 12.015 9.225 1.00 0.00 H TER 46129 WAT 9112 ATOM 46129 O WAT 9113 10.113 34.374 134.896 1.00 0.00 O ATOM 46130 H1 WAT 9113 9.860 33.561 135.334 1.00 0.00 H ATOM 46131 H2 WAT 9113 9.299 34.704 134.515 1.00 0.00 H TER 46133 WAT 9113 ATOM 46133 O WAT 9114 78.334 83.566 153.744 1.00 0.00 O ATOM 46134 H1 WAT 9114 78.329 82.764 154.266 1.00 0.00 H ATOM 46135 H2 WAT 9114 77.409 83.786 153.634 1.00 0.00 H TER 46137 WAT 9114 ATOM 46137 O WAT 9115 21.485 137.452 134.585 1.00 0.00 O ATOM 46138 H1 WAT 9115 21.778 137.844 133.762 1.00 0.00 H ATOM 46139 H2 WAT 9115 20.872 138.091 134.950 1.00 0.00 H TER 46141 WAT 9115 ATOM 46141 O WAT 9116 57.091 25.596 145.243 1.00 0.00 O ATOM 46142 H1 WAT 9116 57.913 25.424 145.702 1.00 0.00 H ATOM 46143 H2 WAT 9116 56.417 25.225 145.813 1.00 0.00 H TER 46145 WAT 9116 ATOM 46145 O WAT 9117 80.649 99.684 114.208 1.00 0.00 O ATOM 46146 H1 WAT 9117 80.866 100.594 114.006 1.00 0.00 H ATOM 46147 H2 WAT 9117 79.721 99.706 114.444 1.00 0.00 H TER 46149 WAT 9117 ATOM 46149 O WAT 9118 10.408 118.832 82.759 1.00 0.00 O ATOM 46150 H1 WAT 9118 10.087 119.033 81.880 1.00 0.00 H ATOM 46151 H2 WAT 9118 11.341 118.655 82.640 1.00 0.00 H TER 46153 WAT 9118 ATOM 46153 O WAT 9119 77.542 55.135 93.332 1.00 0.00 O ATOM 46154 H1 WAT 9119 78.465 54.985 93.126 1.00 0.00 H ATOM 46155 H2 WAT 9119 77.558 55.771 94.048 1.00 0.00 H TER 46157 WAT 9119 ATOM 46157 O WAT 9120 75.573 101.550 6.926 1.00 0.00 O ATOM 46158 H1 WAT 9120 76.378 102.059 7.018 1.00 0.00 H ATOM 46159 H2 WAT 9120 74.973 102.134 6.460 1.00 0.00 H TER 46161 WAT 9120 ATOM 46161 O WAT 9121 84.358 136.470 93.664 1.00 0.00 O ATOM 46162 H1 WAT 9121 84.830 137.143 93.172 1.00 0.00 H ATOM 46163 H2 WAT 9121 84.017 136.930 94.431 1.00 0.00 H TER 46165 WAT 9121 ATOM 46165 O WAT 9122 33.803 4.604 83.532 1.00 0.00 O ATOM 46166 H1 WAT 9122 32.859 4.679 83.393 1.00 0.00 H ATOM 46167 H2 WAT 9122 34.151 5.461 83.287 1.00 0.00 H TER 46169 WAT 9122 ATOM 46169 O WAT 9123 100.990 43.869 87.863 1.00 0.00 O ATOM 46170 H1 WAT 9123 101.723 43.857 88.479 1.00 0.00 H ATOM 46171 H2 WAT 9123 100.278 44.287 88.346 1.00 0.00 H TER 46173 WAT 9123 ATOM 46173 O WAT 9124 30.677 2.558 126.559 1.00 0.00 O ATOM 46174 H1 WAT 9124 29.799 2.276 126.816 1.00 0.00 H ATOM 46175 H2 WAT 9124 30.554 3.442 126.214 1.00 0.00 H TER 46177 WAT 9124 ATOM 46177 O WAT 9125 59.980 103.119 130.238 1.00 0.00 O ATOM 46178 H1 WAT 9125 59.181 102.685 129.939 1.00 0.00 H ATOM 46179 H2 WAT 9125 59.835 103.270 131.173 1.00 0.00 H TER 46181 WAT 9125 ATOM 46181 O WAT 9126 64.996 115.833 88.632 1.00 0.00 O ATOM 46182 H1 WAT 9126 64.759 116.691 88.986 1.00 0.00 H ATOM 46183 H2 WAT 9126 64.193 115.513 88.223 1.00 0.00 H TER 46185 WAT 9126 ATOM 46185 O WAT 9127 54.851 4.988 98.599 1.00 0.00 O ATOM 46186 H1 WAT 9127 54.054 4.930 99.126 1.00 0.00 H ATOM 46187 H2 WAT 9127 54.623 4.562 97.772 1.00 0.00 H TER 46189 WAT 9127 ATOM 46189 O WAT 9128 137.239 139.550 146.056 1.00 0.00 O ATOM 46190 H1 WAT 9128 136.999 140.029 146.849 1.00 0.00 H ATOM 46191 H2 WAT 9128 138.045 139.969 145.756 1.00 0.00 H TER 46193 WAT 9128 ATOM 46193 O WAT 9129 8.136 113.256 81.683 1.00 0.00 O ATOM 46194 H1 WAT 9129 8.110 114.121 81.275 1.00 0.00 H ATOM 46195 H2 WAT 9129 8.247 113.434 82.617 1.00 0.00 H TER 46197 WAT 9129 ATOM 46197 O WAT 9130 88.050 126.267 83.523 1.00 0.00 O ATOM 46198 H1 WAT 9130 87.135 126.308 83.246 1.00 0.00 H ATOM 46199 H2 WAT 9130 88.207 127.105 83.958 1.00 0.00 H TER 46201 WAT 9130 ATOM 46201 O WAT 9131 112.822 123.433 8.030 1.00 0.00 O ATOM 46202 H1 WAT 9131 113.695 123.526 8.412 1.00 0.00 H ATOM 46203 H2 WAT 9131 112.659 124.272 7.599 1.00 0.00 H TER 46205 WAT 9131 ATOM 46205 O WAT 9132 103.112 111.798 89.553 1.00 0.00 O ATOM 46206 H1 WAT 9132 102.852 111.142 90.199 1.00 0.00 H ATOM 46207 H2 WAT 9132 103.531 111.294 88.855 1.00 0.00 H TER 46209 WAT 9132 ATOM 46209 O WAT 9133 50.774 78.436 20.181 1.00 0.00 O ATOM 46210 H1 WAT 9133 50.608 77.557 19.840 1.00 0.00 H ATOM 46211 H2 WAT 9133 50.044 78.962 19.852 1.00 0.00 H TER 46213 WAT 9133 ATOM 46213 O WAT 9134 56.818 117.930 16.810 1.00 0.00 O ATOM 46214 H1 WAT 9134 57.741 117.758 16.623 1.00 0.00 H ATOM 46215 H2 WAT 9134 56.678 118.830 16.517 1.00 0.00 H TER 46217 WAT 9134 ATOM 46217 O WAT 9135 32.754 22.134 126.411 1.00 0.00 O ATOM 46218 H1 WAT 9135 33.207 22.975 126.472 1.00 0.00 H ATOM 46219 H2 WAT 9135 33.173 21.689 125.674 1.00 0.00 H TER 46221 WAT 9135 ATOM 46221 O WAT 9136 19.156 131.503 100.535 1.00 0.00 O ATOM 46222 H1 WAT 9136 18.236 131.717 100.378 1.00 0.00 H ATOM 46223 H2 WAT 9136 19.596 131.719 99.713 1.00 0.00 H TER 46225 WAT 9136 ATOM 46225 O WAT 9137 131.730 84.575 110.306 1.00 0.00 O ATOM 46226 H1 WAT 9137 132.169 85.074 109.617 1.00 0.00 H ATOM 46227 H2 WAT 9137 131.261 85.234 110.818 1.00 0.00 H TER 46229 WAT 9137 ATOM 46229 O WAT 9138 49.998 124.836 119.101 1.00 0.00 O ATOM 46230 H1 WAT 9138 50.351 124.037 118.711 1.00 0.00 H ATOM 46231 H2 WAT 9138 50.506 124.956 119.903 1.00 0.00 H TER 46233 WAT 9138 ATOM 46233 O WAT 9139 87.963 40.077 29.361 1.00 0.00 O ATOM 46234 H1 WAT 9139 88.613 40.107 28.660 1.00 0.00 H ATOM 46235 H2 WAT 9139 87.839 40.992 29.614 1.00 0.00 H TER 46237 WAT 9139 ATOM 46237 O WAT 9140 134.192 83.786 90.015 1.00 0.00 O ATOM 46238 H1 WAT 9140 133.624 83.065 90.287 1.00 0.00 H ATOM 46239 H2 WAT 9140 135.053 83.558 90.367 1.00 0.00 H TER 46241 WAT 9140 ATOM 46241 O WAT 9141 48.174 48.637 131.817 1.00 0.00 O ATOM 46242 H1 WAT 9141 48.329 47.744 131.510 1.00 0.00 H ATOM 46243 H2 WAT 9141 47.840 49.100 131.048 1.00 0.00 H TER 46245 WAT 9141 ATOM 46245 O WAT 9142 139.864 50.371 99.911 1.00 0.00 O ATOM 46246 H1 WAT 9142 139.461 51.135 99.499 1.00 0.00 H ATOM 46247 H2 WAT 9142 140.797 50.459 99.717 1.00 0.00 H TER 46249 WAT 9142 ATOM 46249 O WAT 9143 19.387 74.106 108.404 1.00 0.00 O ATOM 46250 H1 WAT 9143 18.430 74.147 108.407 1.00 0.00 H ATOM 46251 H2 WAT 9143 19.596 73.377 108.989 1.00 0.00 H TER 46253 WAT 9143 ATOM 46253 O WAT 9144 69.625 47.728 74.139 1.00 0.00 O ATOM 46254 H1 WAT 9144 68.817 47.563 74.624 1.00 0.00 H ATOM 46255 H2 WAT 9144 69.393 47.566 73.224 1.00 0.00 H TER 46257 WAT 9144 ATOM 46257 O WAT 9145 11.031 117.482 2.999 1.00 0.00 O ATOM 46258 H1 WAT 9145 11.285 116.916 3.728 1.00 0.00 H ATOM 46259 H2 WAT 9145 11.860 117.724 2.584 1.00 0.00 H TER 46261 WAT 9145 ATOM 46261 O WAT 9146 24.491 100.374 1.037 1.00 0.00 O ATOM 46262 H1 WAT 9146 24.683 99.501 0.696 1.00 0.00 H ATOM 46263 H2 WAT 9146 24.052 100.823 0.314 1.00 0.00 H TER 46265 WAT 9146 ATOM 46265 O WAT 9147 90.792 85.282 56.526 1.00 0.00 O ATOM 46266 H1 WAT 9147 90.872 86.192 56.241 1.00 0.00 H ATOM 46267 H2 WAT 9147 90.821 84.773 55.716 1.00 0.00 H TER 46269 WAT 9147 ATOM 46269 O WAT 9148 140.240 11.892 92.168 1.00 0.00 O ATOM 46270 H1 WAT 9148 140.046 12.582 92.803 1.00 0.00 H ATOM 46271 H2 WAT 9148 139.414 11.751 91.706 1.00 0.00 H TER 46273 WAT 9148 ATOM 46273 O WAT 9149 96.757 108.561 5.970 1.00 0.00 O ATOM 46274 H1 WAT 9149 97.277 107.949 6.490 1.00 0.00 H ATOM 46275 H2 WAT 9149 97.406 109.106 5.524 1.00 0.00 H TER 46277 WAT 9149 ATOM 46277 O WAT 9150 123.572 142.851 143.224 1.00 0.00 O ATOM 46278 H1 WAT 9150 123.980 142.315 143.904 1.00 0.00 H ATOM 46279 H2 WAT 9150 122.926 143.380 143.691 1.00 0.00 H TER 46281 WAT 9150 ATOM 46281 O WAT 9151 95.180 17.210 103.682 1.00 0.00 O ATOM 46282 H1 WAT 9151 94.568 17.706 104.225 1.00 0.00 H ATOM 46283 H2 WAT 9151 95.324 16.396 104.164 1.00 0.00 H TER 46285 WAT 9151 ATOM 46285 O WAT 9152 40.635 57.391 120.223 1.00 0.00 O ATOM 46286 H1 WAT 9152 40.257 56.893 120.948 1.00 0.00 H ATOM 46287 H2 WAT 9152 39.899 57.887 119.864 1.00 0.00 H TER 46289 WAT 9152 ATOM 46289 O WAT 9153 13.553 102.352 86.871 1.00 0.00 O ATOM 46290 H1 WAT 9153 12.803 102.016 87.362 1.00 0.00 H ATOM 46291 H2 WAT 9153 14.215 101.665 86.946 1.00 0.00 H TER 46293 WAT 9153 ATOM 46293 O WAT 9154 30.592 44.784 157.384 1.00 0.00 O ATOM 46294 H1 WAT 9154 31.390 44.387 157.734 1.00 0.00 H ATOM 46295 H2 WAT 9154 30.896 45.341 156.668 1.00 0.00 H TER 46297 WAT 9154 ATOM 46297 O WAT 9155 79.622 120.367 9.639 1.00 0.00 O ATOM 46298 H1 WAT 9155 80.474 120.318 9.206 1.00 0.00 H ATOM 46299 H2 WAT 9155 78.997 120.497 8.926 1.00 0.00 H TER 46301 WAT 9155 ATOM 46301 O WAT 9156 116.916 42.238 147.062 1.00 0.00 O ATOM 46302 H1 WAT 9156 116.312 42.415 146.341 1.00 0.00 H ATOM 46303 H2 WAT 9156 116.357 42.194 147.838 1.00 0.00 H TER 46305 WAT 9156 ATOM 46305 O WAT 9157 82.627 6.844 157.930 1.00 0.00 O ATOM 46306 H1 WAT 9157 82.848 7.772 157.852 1.00 0.00 H ATOM 46307 H2 WAT 9157 83.040 6.568 158.749 1.00 0.00 H TER 46309 WAT 9157 ATOM 46309 O WAT 9158 134.593 99.204 28.569 1.00 0.00 O ATOM 46310 H1 WAT 9158 134.669 98.327 28.192 1.00 0.00 H ATOM 46311 H2 WAT 9158 133.762 99.189 29.043 1.00 0.00 H TER 46313 WAT 9158 ATOM 46313 O WAT 9159 5.777 14.845 75.329 1.00 0.00 O ATOM 46314 H1 WAT 9159 5.475 14.463 76.154 1.00 0.00 H ATOM 46315 H2 WAT 9159 5.438 14.256 74.655 1.00 0.00 H TER 46317 WAT 9159 ATOM 46317 O WAT 9160 111.436 16.497 157.295 1.00 0.00 O ATOM 46318 H1 WAT 9160 111.471 16.812 158.198 1.00 0.00 H ATOM 46319 H2 WAT 9160 111.865 15.641 157.323 1.00 0.00 H TER 46321 WAT 9160 ATOM 46321 O WAT 9161 30.231 98.558 90.158 1.00 0.00 O ATOM 46322 H1 WAT 9161 30.974 97.979 89.989 1.00 0.00 H ATOM 46323 H2 WAT 9161 30.626 99.364 90.493 1.00 0.00 H TER 46325 WAT 9161 ATOM 46325 O WAT 9162 38.302 75.698 97.025 1.00 0.00 O ATOM 46326 H1 WAT 9162 37.456 75.288 97.205 1.00 0.00 H ATOM 46327 H2 WAT 9162 38.215 76.048 96.138 1.00 0.00 H TER 46329 WAT 9162 ATOM 46329 O WAT 9163 31.761 66.399 119.976 1.00 0.00 O ATOM 46330 H1 WAT 9163 32.581 66.893 119.973 1.00 0.00 H ATOM 46331 H2 WAT 9163 31.408 66.516 119.094 1.00 0.00 H TER 46333 WAT 9163 ATOM 46333 O WAT 9164 102.007 87.445 151.601 1.00 0.00 O ATOM 46334 H1 WAT 9164 102.785 88.000 151.554 1.00 0.00 H ATOM 46335 H2 WAT 9164 102.245 86.750 152.214 1.00 0.00 H TER 46337 WAT 9164 ATOM 46337 O WAT 9165 102.697 138.320 65.312 1.00 0.00 O ATOM 46338 H1 WAT 9165 102.442 137.742 66.031 1.00 0.00 H ATOM 46339 H2 WAT 9165 101.953 138.295 64.709 1.00 0.00 H TER 46341 WAT 9165 ATOM 46341 O WAT 9166 56.379 91.346 93.217 1.00 0.00 O ATOM 46342 H1 WAT 9166 57.103 91.963 93.325 1.00 0.00 H ATOM 46343 H2 WAT 9166 56.070 91.494 92.323 1.00 0.00 H TER 46345 WAT 9166 ATOM 46345 O WAT 9167 57.941 5.960 111.077 1.00 0.00 O ATOM 46346 H1 WAT 9167 57.813 5.918 112.025 1.00 0.00 H ATOM 46347 H2 WAT 9167 57.217 5.449 110.715 1.00 0.00 H TER 46349 WAT 9167 ATOM 46349 O WAT 9168 108.024 61.606 118.193 1.00 0.00 O ATOM 46350 H1 WAT 9168 108.675 62.276 118.400 1.00 0.00 H ATOM 46351 H2 WAT 9168 108.526 60.904 117.780 1.00 0.00 H TER 46353 WAT 9168 ATOM 46353 O WAT 9169 15.171 60.882 141.356 1.00 0.00 O ATOM 46354 H1 WAT 9169 14.332 61.329 141.467 1.00 0.00 H ATOM 46355 H2 WAT 9169 15.092 60.432 140.514 1.00 0.00 H TER 46357 WAT 9169 ATOM 46357 O WAT 9170 16.347 95.237 59.417 1.00 0.00 O ATOM 46358 H1 WAT 9170 16.811 94.734 58.748 1.00 0.00 H ATOM 46359 H2 WAT 9170 16.350 96.135 59.086 1.00 0.00 H TER 46361 WAT 9170 ATOM 46361 O WAT 9171 104.273 42.016 157.082 1.00 0.00 O ATOM 46362 H1 WAT 9171 104.175 41.615 157.946 1.00 0.00 H ATOM 46363 H2 WAT 9171 103.384 42.041 156.727 1.00 0.00 H TER 46365 WAT 9171 ATOM 46365 O WAT 9172 115.373 119.165 24.221 1.00 0.00 O ATOM 46366 H1 WAT 9172 114.590 118.705 23.917 1.00 0.00 H ATOM 46367 H2 WAT 9172 115.443 119.926 23.644 1.00 0.00 H TER 46369 WAT 9172 ATOM 46369 O WAT 9173 119.666 44.774 92.251 1.00 0.00 O ATOM 46370 H1 WAT 9173 120.542 44.933 91.897 1.00 0.00 H ATOM 46371 H2 WAT 9173 119.392 45.622 92.600 1.00 0.00 H TER 46373 WAT 9173 ATOM 46373 O WAT 9174 96.693 143.374 1.286 1.00 0.00 O ATOM 46374 H1 WAT 9174 96.798 144.265 0.952 1.00 0.00 H ATOM 46375 H2 WAT 9174 95.842 143.380 1.723 1.00 0.00 H TER 46377 WAT 9174 ATOM 46377 O WAT 9175 129.524 8.263 139.173 1.00 0.00 O ATOM 46378 H1 WAT 9175 129.268 7.420 139.546 1.00 0.00 H ATOM 46379 H2 WAT 9175 130.297 8.066 138.643 1.00 0.00 H TER 46381 WAT 9175 ATOM 46381 O WAT 9176 101.419 11.609 96.949 1.00 0.00 O ATOM 46382 H1 WAT 9176 102.366 11.672 96.827 1.00 0.00 H ATOM 46383 H2 WAT 9176 101.276 10.711 97.251 1.00 0.00 H TER 46385 WAT 9176 ATOM 46385 O WAT 9177 8.776 17.197 21.773 1.00 0.00 O ATOM 46386 H1 WAT 9177 9.572 17.351 22.282 1.00 0.00 H ATOM 46387 H2 WAT 9177 8.851 17.791 21.026 1.00 0.00 H TER 46389 WAT 9177 ATOM 46389 O WAT 9178 72.866 35.188 80.585 1.00 0.00 O ATOM 46390 H1 WAT 9178 73.211 36.054 80.805 1.00 0.00 H ATOM 46391 H2 WAT 9178 72.074 35.104 81.116 1.00 0.00 H TER 46393 WAT 9178 ATOM 46393 O WAT 9179 86.509 14.888 60.800 1.00 0.00 O ATOM 46394 H1 WAT 9179 86.495 15.839 60.697 1.00 0.00 H ATOM 46395 H2 WAT 9179 87.412 14.639 60.601 1.00 0.00 H TER 46397 WAT 9179 ATOM 46397 O WAT 9180 26.889 105.141 91.251 1.00 0.00 O ATOM 46398 H1 WAT 9180 27.209 104.248 91.121 1.00 0.00 H ATOM 46399 H2 WAT 9180 27.593 105.698 90.919 1.00 0.00 H TER 46401 WAT 9180 ATOM 46401 O WAT 9181 30.219 134.872 12.112 1.00 0.00 O ATOM 46402 H1 WAT 9181 30.935 135.303 11.645 1.00 0.00 H ATOM 46403 H2 WAT 9181 30.651 134.375 12.807 1.00 0.00 H TER 46405 WAT 9181 ATOM 46405 O WAT 9182 79.476 59.275 70.222 1.00 0.00 O ATOM 46406 H1 WAT 9182 79.377 58.433 70.666 1.00 0.00 H ATOM 46407 H2 WAT 9182 80.102 59.103 69.518 1.00 0.00 H TER 46409 WAT 9182 ATOM 46409 O WAT 9183 136.532 23.175 110.729 1.00 0.00 O ATOM 46410 H1 WAT 9183 136.509 22.367 111.242 1.00 0.00 H ATOM 46411 H2 WAT 9183 136.633 22.880 109.824 1.00 0.00 H TER 46413 WAT 9183 ATOM 46413 O WAT 9184 83.347 111.462 127.560 1.00 0.00 O ATOM 46414 H1 WAT 9184 82.645 112.022 127.230 1.00 0.00 H ATOM 46415 H2 WAT 9184 83.149 111.352 128.490 1.00 0.00 H TER 46417 WAT 9184 ATOM 46417 O WAT 9185 34.344 26.037 63.779 1.00 0.00 O ATOM 46418 H1 WAT 9185 34.095 26.229 62.875 1.00 0.00 H ATOM 46419 H2 WAT 9185 33.887 25.222 63.985 1.00 0.00 H TER 46421 WAT 9185 ATOM 46421 O WAT 9186 25.488 98.512 151.283 1.00 0.00 O ATOM 46422 H1 WAT 9186 24.803 99.163 151.433 1.00 0.00 H ATOM 46423 H2 WAT 9186 26.001 98.513 152.091 1.00 0.00 H TER 46425 WAT 9186 ATOM 46425 O WAT 9187 110.978 137.862 71.713 1.00 0.00 O ATOM 46426 H1 WAT 9187 111.831 138.293 71.661 1.00 0.00 H ATOM 46427 H2 WAT 9187 110.802 137.790 72.651 1.00 0.00 H TER 46429 WAT 9187 ATOM 46429 O WAT 9188 39.974 69.475 77.619 1.00 0.00 O ATOM 46430 H1 WAT 9188 40.411 69.346 76.776 1.00 0.00 H ATOM 46431 H2 WAT 9188 39.562 68.632 77.807 1.00 0.00 H TER 46433 WAT 9188 ATOM 46433 O WAT 9189 142.983 135.451 70.623 1.00 0.00 O ATOM 46434 H1 WAT 9189 142.813 135.771 69.737 1.00 0.00 H ATOM 46435 H2 WAT 9189 143.935 135.490 70.713 1.00 0.00 H TER 46437 WAT 9189 ATOM 46437 O WAT 9190 91.417 36.508 102.482 1.00 0.00 O ATOM 46438 H1 WAT 9190 90.621 36.071 102.179 1.00 0.00 H ATOM 46439 H2 WAT 9190 91.664 36.032 103.275 1.00 0.00 H TER 46441 WAT 9190 ATOM 46441 O WAT 9191 118.828 55.981 93.753 1.00 0.00 O ATOM 46442 H1 WAT 9191 119.418 56.500 94.300 1.00 0.00 H ATOM 46443 H2 WAT 9191 118.163 56.604 93.460 1.00 0.00 H TER 46445 WAT 9191 ATOM 46445 O WAT 9192 98.321 70.366 133.841 1.00 0.00 O ATOM 46446 H1 WAT 9192 98.980 69.889 134.346 1.00 0.00 H ATOM 46447 H2 WAT 9192 97.896 70.937 134.481 1.00 0.00 H TER 46449 WAT 9192 ATOM 46449 O WAT 9193 143.127 26.447 148.075 1.00 0.00 O ATOM 46450 H1 WAT 9193 143.373 25.546 148.284 1.00 0.00 H ATOM 46451 H2 WAT 9193 142.170 26.449 148.108 1.00 0.00 H TER 46453 WAT 9193 ATOM 46453 O WAT 9194 46.395 114.020 156.855 1.00 0.00 O ATOM 46454 H1 WAT 9194 45.761 113.304 156.811 1.00 0.00 H ATOM 46455 H2 WAT 9194 45.924 114.778 156.509 1.00 0.00 H TER 46457 WAT 9194 ATOM 46457 O WAT 9195 68.016 133.279 63.790 1.00 0.00 O ATOM 46458 H1 WAT 9195 68.236 132.434 63.398 1.00 0.00 H ATOM 46459 H2 WAT 9195 68.863 133.701 63.938 1.00 0.00 H TER 46461 WAT 9195 ATOM 46461 O WAT 9196 107.518 9.767 90.681 1.00 0.00 O ATOM 46462 H1 WAT 9196 106.810 9.775 90.037 1.00 0.00 H ATOM 46463 H2 WAT 9196 108.302 9.986 90.178 1.00 0.00 H TER 46465 WAT 9196 ATOM 46465 O WAT 9197 123.573 38.380 1.395 1.00 0.00 O ATOM 46466 H1 WAT 9197 122.872 37.739 1.283 1.00 0.00 H ATOM 46467 H2 WAT 9197 123.586 38.866 0.570 1.00 0.00 H TER 46469 WAT 9197 ATOM 46469 O WAT 9198 84.399 75.170 63.537 1.00 0.00 O ATOM 46470 H1 WAT 9198 84.833 74.474 63.045 1.00 0.00 H ATOM 46471 H2 WAT 9198 84.159 74.763 64.369 1.00 0.00 H TER 46473 WAT 9198 ATOM 46473 O WAT 9199 140.704 65.816 77.723 1.00 0.00 O ATOM 46474 H1 WAT 9199 140.675 66.767 77.824 1.00 0.00 H ATOM 46475 H2 WAT 9199 141.592 65.634 77.417 1.00 0.00 H TER 46477 WAT 9199 ATOM 46477 O WAT 9200 38.310 52.831 108.745 1.00 0.00 O ATOM 46478 H1 WAT 9200 38.049 51.918 108.868 1.00 0.00 H ATOM 46479 H2 WAT 9200 38.857 53.028 109.505 1.00 0.00 H TER 46481 WAT 9200 ATOM 46481 O WAT 9201 39.536 84.559 79.955 1.00 0.00 O ATOM 46482 H1 WAT 9201 38.853 84.318 80.580 1.00 0.00 H ATOM 46483 H2 WAT 9201 40.244 83.937 80.123 1.00 0.00 H TER 46485 WAT 9201 ATOM 46485 O WAT 9202 94.294 52.410 134.928 1.00 0.00 O ATOM 46486 H1 WAT 9202 94.588 52.083 135.778 1.00 0.00 H ATOM 46487 H2 WAT 9202 94.182 53.351 135.058 1.00 0.00 H TER 46489 WAT 9202 ATOM 46489 O WAT 9203 85.574 144.240 9.507 1.00 0.00 O ATOM 46490 H1 WAT 9203 84.967 143.702 10.015 1.00 0.00 H ATOM 46491 H2 WAT 9203 85.057 145.003 9.247 1.00 0.00 H TER 46493 WAT 9203 ATOM 46493 O WAT 9204 72.376 103.362 75.314 1.00 0.00 O ATOM 46494 H1 WAT 9204 72.922 104.059 74.949 1.00 0.00 H ATOM 46495 H2 WAT 9204 72.973 102.854 75.864 1.00 0.00 H TER 46497 WAT 9204 ATOM 46497 O WAT 9205 136.069 135.615 63.346 1.00 0.00 O ATOM 46498 H1 WAT 9205 136.145 135.121 64.162 1.00 0.00 H ATOM 46499 H2 WAT 9205 136.008 134.945 62.665 1.00 0.00 H TER 46501 WAT 9205 ATOM 46501 O WAT 9206 38.985 112.364 132.972 1.00 0.00 O ATOM 46502 H1 WAT 9206 38.446 111.573 132.984 1.00 0.00 H ATOM 46503 H2 WAT 9206 39.361 112.411 133.850 1.00 0.00 H TER 46505 WAT 9206 ATOM 46505 O WAT 9207 144.916 98.862 16.094 1.00 0.00 O ATOM 46506 H1 WAT 9207 145.491 98.207 15.697 1.00 0.00 H ATOM 46507 H2 WAT 9207 144.853 99.555 15.436 1.00 0.00 H TER 46509 WAT 9207 ATOM 46509 O WAT 9208 6.268 107.230 23.754 1.00 0.00 O ATOM 46510 H1 WAT 9208 6.371 107.417 24.688 1.00 0.00 H ATOM 46511 H2 WAT 9208 5.875 106.358 23.727 1.00 0.00 H TER 46513 WAT 9208 ATOM 46513 O WAT 9209 145.094 99.629 114.444 1.00 0.00 O ATOM 46514 H1 WAT 9209 145.014 98.917 115.078 1.00 0.00 H ATOM 46515 H2 WAT 9209 144.420 99.444 113.789 1.00 0.00 H TER 46517 WAT 9209 ATOM 46517 O WAT 9210 79.926 57.912 145.735 1.00 0.00 O ATOM 46518 H1 WAT 9210 80.746 57.891 145.242 1.00 0.00 H ATOM 46519 H2 WAT 9210 79.946 57.116 146.267 1.00 0.00 H TER 46521 WAT 9210 ATOM 46521 O WAT 9211 126.416 140.593 81.143 1.00 0.00 O ATOM 46522 H1 WAT 9211 127.298 140.221 81.139 1.00 0.00 H ATOM 46523 H2 WAT 9211 126.423 141.233 80.432 1.00 0.00 H TER 46525 WAT 9211 ATOM 46525 O WAT 9212 141.827 55.631 153.479 1.00 0.00 O ATOM 46526 H1 WAT 9212 141.891 54.704 153.249 1.00 0.00 H ATOM 46527 H2 WAT 9212 142.201 56.090 152.727 1.00 0.00 H TER 46529 WAT 9212 ATOM 46529 O WAT 9213 76.169 58.411 4.383 1.00 0.00 O ATOM 46530 H1 WAT 9213 76.152 59.071 5.076 1.00 0.00 H ATOM 46531 H2 WAT 9213 75.750 57.643 4.773 1.00 0.00 H TER 46533 WAT 9213 ATOM 46533 O WAT 9214 77.984 126.261 119.981 1.00 0.00 O ATOM 46534 H1 WAT 9214 78.138 126.217 119.038 1.00 0.00 H ATOM 46535 H2 WAT 9214 78.463 127.040 120.266 1.00 0.00 H TER 46537 WAT 9214 ATOM 46537 O WAT 9215 101.242 89.717 11.132 1.00 0.00 O ATOM 46538 H1 WAT 9215 102.191 89.670 11.013 1.00 0.00 H ATOM 46539 H2 WAT 9215 100.932 88.835 10.928 1.00 0.00 H TER 46541 WAT 9215 ATOM 46541 O WAT 9216 139.726 144.621 134.940 1.00 0.00 O ATOM 46542 H1 WAT 9216 140.025 143.718 134.836 1.00 0.00 H ATOM 46543 H2 WAT 9216 138.771 144.562 134.913 1.00 0.00 H TER 46545 WAT 9216 ATOM 46545 O WAT 9217 37.526 41.724 92.660 1.00 0.00 O ATOM 46546 H1 WAT 9217 37.772 41.902 93.568 1.00 0.00 H ATOM 46547 H2 WAT 9217 36.940 40.970 92.714 1.00 0.00 H TER 46549 WAT 9217 ATOM 46549 O WAT 9218 64.544 60.503 120.882 1.00 0.00 O ATOM 46550 H1 WAT 9218 63.802 60.803 121.407 1.00 0.00 H ATOM 46551 H2 WAT 9218 64.145 60.102 120.110 1.00 0.00 H TER 46553 WAT 9218 ATOM 46553 O WAT 9219 18.400 115.659 143.009 1.00 0.00 O ATOM 46554 H1 WAT 9219 17.561 116.037 143.272 1.00 0.00 H ATOM 46555 H2 WAT 9219 18.958 115.753 143.781 1.00 0.00 H TER 46557 WAT 9219 ATOM 46557 O WAT 9220 93.833 1.544 149.783 1.00 0.00 O ATOM 46558 H1 WAT 9220 93.798 2.047 150.596 1.00 0.00 H ATOM 46559 H2 WAT 9220 93.854 2.206 149.092 1.00 0.00 H TER 46561 WAT 9220 ATOM 46561 O WAT 9221 141.865 10.403 150.209 1.00 0.00 O ATOM 46562 H1 WAT 9221 142.410 11.095 150.582 1.00 0.00 H ATOM 46563 H2 WAT 9221 142.101 9.619 150.704 1.00 0.00 H TER 46565 WAT 9221 ATOM 46565 O WAT 9222 81.161 99.932 73.909 1.00 0.00 O ATOM 46566 H1 WAT 9222 81.010 100.807 74.266 1.00 0.00 H ATOM 46567 H2 WAT 9222 81.608 99.460 74.612 1.00 0.00 H TER 46569 WAT 9222 ATOM 46569 O WAT 9223 50.607 10.094 151.704 1.00 0.00 O ATOM 46570 H1 WAT 9223 51.231 10.334 152.389 1.00 0.00 H ATOM 46571 H2 WAT 9223 50.514 9.145 151.786 1.00 0.00 H TER 46573 WAT 9223 ATOM 46573 O WAT 9224 71.381 84.097 114.059 1.00 0.00 O ATOM 46574 H1 WAT 9224 70.512 84.303 114.403 1.00 0.00 H ATOM 46575 H2 WAT 9224 71.874 83.790 114.820 1.00 0.00 H TER 46577 WAT 9224 ATOM 46577 O WAT 9225 17.458 113.832 4.935 1.00 0.00 O ATOM 46578 H1 WAT 9225 17.014 114.678 4.883 1.00 0.00 H ATOM 46579 H2 WAT 9225 18.173 113.897 4.302 1.00 0.00 H TER 46581 WAT 9225 ATOM 46581 O WAT 9226 140.918 83.024 68.273 1.00 0.00 O ATOM 46582 H1 WAT 9226 141.251 83.525 69.017 1.00 0.00 H ATOM 46583 H2 WAT 9226 140.314 82.392 68.661 1.00 0.00 H TER 46585 WAT 9226 ATOM 46585 O WAT 9227 2.638 60.249 98.025 1.00 0.00 O ATOM 46586 H1 WAT 9227 2.409 60.517 97.135 1.00 0.00 H ATOM 46587 H2 WAT 9227 2.062 59.507 98.208 1.00 0.00 H TER 46589 WAT 9227 ATOM 46589 O WAT 9228 24.488 70.095 66.191 1.00 0.00 O ATOM 46590 H1 WAT 9228 24.888 70.891 65.841 1.00 0.00 H ATOM 46591 H2 WAT 9228 23.758 70.408 66.725 1.00 0.00 H TER 46593 WAT 9228 ATOM 46593 O WAT 9229 82.147 138.657 73.579 1.00 0.00 O ATOM 46594 H1 WAT 9229 82.450 138.341 72.727 1.00 0.00 H ATOM 46595 H2 WAT 9229 82.667 138.166 74.215 1.00 0.00 H TER 46597 WAT 9229 ATOM 46597 O WAT 9230 127.667 1.569 5.581 1.00 0.00 O ATOM 46598 H1 WAT 9230 128.234 0.956 5.114 1.00 0.00 H ATOM 46599 H2 WAT 9230 128.210 2.346 5.711 1.00 0.00 H TER 46601 WAT 9230 ATOM 46601 O WAT 9231 53.394 89.585 117.077 1.00 0.00 O ATOM 46602 H1 WAT 9231 53.016 89.201 117.868 1.00 0.00 H ATOM 46603 H2 WAT 9231 52.786 89.342 116.379 1.00 0.00 H TER 46605 WAT 9231 ATOM 46605 O WAT 9232 37.573 139.991 92.041 1.00 0.00 O ATOM 46606 H1 WAT 9232 38.271 139.427 91.706 1.00 0.00 H ATOM 46607 H2 WAT 9232 38.024 140.782 92.334 1.00 0.00 H TER 46609 WAT 9232 ATOM 46609 O WAT 9233 138.611 116.069 142.362 1.00 0.00 O ATOM 46610 H1 WAT 9233 139.224 116.799 142.448 1.00 0.00 H ATOM 46611 H2 WAT 9233 137.795 116.394 142.742 1.00 0.00 H TER 46613 WAT 9233 ATOM 46613 O WAT 9234 6.885 133.001 64.130 1.00 0.00 O ATOM 46614 H1 WAT 9234 7.584 133.656 64.129 1.00 0.00 H ATOM 46615 H2 WAT 9234 7.181 132.334 63.511 1.00 0.00 H TER 46617 WAT 9234 ATOM 46617 O WAT 9235 46.698 22.421 7.790 1.00 0.00 O ATOM 46618 H1 WAT 9235 47.212 21.720 7.390 1.00 0.00 H ATOM 46619 H2 WAT 9235 47.230 22.716 8.529 1.00 0.00 H TER 46621 WAT 9235 ATOM 46621 O WAT 9236 42.323 69.040 132.890 1.00 0.00 O ATOM 46622 H1 WAT 9236 42.427 68.127 132.620 1.00 0.00 H ATOM 46623 H2 WAT 9236 41.622 69.018 133.541 1.00 0.00 H TER 46625 WAT 9236 ATOM 46625 O WAT 9237 77.717 77.402 113.464 1.00 0.00 O ATOM 46626 H1 WAT 9237 78.483 76.829 113.419 1.00 0.00 H ATOM 46627 H2 WAT 9237 77.803 77.852 114.304 1.00 0.00 H TER 46629 WAT 9237 ATOM 46629 O WAT 9238 75.002 18.295 147.855 1.00 0.00 O ATOM 46630 H1 WAT 9238 74.802 18.053 148.760 1.00 0.00 H ATOM 46631 H2 WAT 9238 74.759 19.219 147.795 1.00 0.00 H TER 46633 WAT 9238 ATOM 46633 O WAT 9239 87.070 60.656 84.300 1.00 0.00 O ATOM 46634 H1 WAT 9239 86.678 61.502 84.516 1.00 0.00 H ATOM 46635 H2 WAT 9239 87.716 60.857 83.623 1.00 0.00 H TER 46637 WAT 9239 ATOM 46637 O WAT 9240 69.064 35.324 76.242 1.00 0.00 O ATOM 46638 H1 WAT 9240 69.810 35.018 76.757 1.00 0.00 H ATOM 46639 H2 WAT 9240 69.455 35.843 75.539 1.00 0.00 H TER 46641 WAT 9240 ATOM 46641 O WAT 9241 79.470 26.836 116.759 1.00 0.00 O ATOM 46642 H1 WAT 9241 79.915 26.018 116.538 1.00 0.00 H ATOM 46643 H2 WAT 9241 79.314 26.777 117.702 1.00 0.00 H TER 46645 WAT 9241 ATOM 46645 O WAT 9242 5.706 112.382 80.791 1.00 0.00 O ATOM 46646 H1 WAT 9242 5.299 112.962 81.435 1.00 0.00 H ATOM 46647 H2 WAT 9242 6.647 112.490 80.933 1.00 0.00 H TER 46649 WAT 9242 ATOM 46649 O WAT 9243 145.610 71.920 118.431 1.00 0.00 O ATOM 46650 H1 WAT 9243 144.689 72.113 118.258 1.00 0.00 H ATOM 46651 H2 WAT 9243 146.030 71.966 117.571 1.00 0.00 H TER 46653 WAT 9243 ATOM 46653 O WAT 9244 74.738 122.837 154.470 1.00 0.00 O ATOM 46654 H1 WAT 9244 74.979 122.878 155.395 1.00 0.00 H ATOM 46655 H2 WAT 9244 75.572 122.897 154.003 1.00 0.00 H TER 46657 WAT 9244 ATOM 46657 O WAT 9245 4.918 138.022 67.692 1.00 0.00 O ATOM 46658 H1 WAT 9245 4.899 137.755 66.773 1.00 0.00 H ATOM 46659 H2 WAT 9245 5.797 137.790 67.991 1.00 0.00 H TER 46661 WAT 9245 ATOM 46661 O WAT 9246 101.231 119.723 149.689 1.00 0.00 O ATOM 46662 H1 WAT 9246 101.714 119.219 150.344 1.00 0.00 H ATOM 46663 H2 WAT 9246 101.101 119.112 148.964 1.00 0.00 H TER 46665 WAT 9246 ATOM 46665 O WAT 9247 109.455 119.332 5.796 1.00 0.00 O ATOM 46666 H1 WAT 9247 110.256 118.921 6.120 1.00 0.00 H ATOM 46667 H2 WAT 9247 109.663 120.266 5.759 1.00 0.00 H TER 46669 WAT 9247 ATOM 46669 O WAT 9248 90.236 16.666 147.061 1.00 0.00 O ATOM 46670 H1 WAT 9248 89.869 15.784 147.128 1.00 0.00 H ATOM 46671 H2 WAT 9248 91.170 16.551 147.235 1.00 0.00 H TER 46673 WAT 9248 ATOM 46673 O WAT 9249 13.332 74.772 90.426 1.00 0.00 O ATOM 46674 H1 WAT 9249 13.971 74.399 91.033 1.00 0.00 H ATOM 46675 H2 WAT 9249 12.751 75.293 90.981 1.00 0.00 H TER 46677 WAT 9249 ATOM 46677 O WAT 9250 16.156 62.370 120.847 1.00 0.00 O ATOM 46678 H1 WAT 9250 15.214 62.531 120.791 1.00 0.00 H ATOM 46679 H2 WAT 9250 16.444 62.895 121.594 1.00 0.00 H TER 46681 WAT 9250 ATOM 46681 O WAT 9251 71.063 78.956 156.701 1.00 0.00 O ATOM 46682 H1 WAT 9251 70.530 78.468 157.329 1.00 0.00 H ATOM 46683 H2 WAT 9251 71.914 79.048 157.131 1.00 0.00 H TER 46685 WAT 9251 ATOM 46685 O WAT 9252 49.428 46.932 21.201 1.00 0.00 O ATOM 46686 H1 WAT 9252 50.383 46.935 21.132 1.00 0.00 H ATOM 46687 H2 WAT 9252 49.202 46.015 21.355 1.00 0.00 H TER 46689 WAT 9252 ATOM 46689 O WAT 9253 16.240 78.401 110.482 1.00 0.00 O ATOM 46690 H1 WAT 9253 15.677 77.859 109.929 1.00 0.00 H ATOM 46691 H2 WAT 9253 15.720 79.186 110.656 1.00 0.00 H TER 46693 WAT 9253 ATOM 46693 O WAT 9254 143.638 88.271 32.958 1.00 0.00 O ATOM 46694 H1 WAT 9254 144.057 88.942 32.418 1.00 0.00 H ATOM 46695 H2 WAT 9254 143.537 87.521 32.372 1.00 0.00 H TER 46697 WAT 9254 ATOM 46697 O WAT 9255 33.428 142.818 136.461 1.00 0.00 O ATOM 46698 H1 WAT 9255 32.804 143.125 137.119 1.00 0.00 H ATOM 46699 H2 WAT 9255 32.979 142.094 136.024 1.00 0.00 H TER 46701 WAT 9255 ATOM 46701 O WAT 9256 103.439 53.415 21.552 1.00 0.00 O ATOM 46702 H1 WAT 9256 103.720 52.895 20.799 1.00 0.00 H ATOM 46703 H2 WAT 9256 103.064 54.208 21.169 1.00 0.00 H TER 46705 WAT 9256 ATOM 46705 O WAT 9257 19.984 15.679 62.120 1.00 0.00 O ATOM 46706 H1 WAT 9257 19.108 16.020 62.303 1.00 0.00 H ATOM 46707 H2 WAT 9257 20.304 16.219 61.398 1.00 0.00 H TER 46709 WAT 9257 ATOM 46709 O WAT 9258 2.654 140.927 84.699 1.00 0.00 O ATOM 46710 H1 WAT 9258 1.958 141.112 85.330 1.00 0.00 H ATOM 46711 H2 WAT 9258 3.076 140.135 85.032 1.00 0.00 H TER 46713 WAT 9258 ATOM 46713 O WAT 9259 17.683 0.533 152.745 1.00 0.00 O ATOM 46714 H1 WAT 9259 17.652 0.748 153.677 1.00 0.00 H ATOM 46715 H2 WAT 9259 17.848 1.370 152.311 1.00 0.00 H TER 46717 WAT 9259 ATOM 46717 O WAT 9260 26.881 120.187 122.832 1.00 0.00 O ATOM 46718 H1 WAT 9260 26.231 120.853 123.054 1.00 0.00 H ATOM 46719 H2 WAT 9260 26.787 120.065 121.888 1.00 0.00 H TER 46721 WAT 9260 ATOM 46721 O WAT 9261 123.525 14.687 99.745 1.00 0.00 O ATOM 46722 H1 WAT 9261 122.615 14.914 99.555 1.00 0.00 H ATOM 46723 H2 WAT 9261 123.468 13.881 100.259 1.00 0.00 H TER 46725 WAT 9261 ATOM 46725 O WAT 9262 34.464 73.424 148.046 1.00 0.00 O ATOM 46726 H1 WAT 9262 34.172 74.148 148.600 1.00 0.00 H ATOM 46727 H2 WAT 9262 33.777 72.763 148.134 1.00 0.00 H TER 46729 WAT 9262 ATOM 46729 O WAT 9263 132.991 49.523 17.026 1.00 0.00 O ATOM 46730 H1 WAT 9263 132.361 50.113 17.442 1.00 0.00 H ATOM 46731 H2 WAT 9263 132.969 48.732 17.564 1.00 0.00 H TER 46733 WAT 9263 ATOM 46733 O WAT 9264 71.840 114.536 119.139 1.00 0.00 O ATOM 46734 H1 WAT 9264 71.266 115.197 119.527 1.00 0.00 H ATOM 46735 H2 WAT 9264 72.128 114.926 118.313 1.00 0.00 H TER 46737 WAT 9264 ATOM 46737 O WAT 9265 2.075 107.229 19.833 1.00 0.00 O ATOM 46738 H1 WAT 9265 1.441 106.849 20.441 1.00 0.00 H ATOM 46739 H2 WAT 9265 2.856 107.381 20.365 1.00 0.00 H TER 46741 WAT 9265 ATOM 46741 O WAT 9266 45.610 116.702 71.846 1.00 0.00 O ATOM 46742 H1 WAT 9266 45.970 116.152 72.541 1.00 0.00 H ATOM 46743 H2 WAT 9266 45.221 117.446 72.306 1.00 0.00 H TER 46745 WAT 9266 ATOM 46745 O WAT 9267 134.693 68.654 146.509 1.00 0.00 O ATOM 46746 H1 WAT 9267 135.266 69.158 145.932 1.00 0.00 H ATOM 46747 H2 WAT 9267 135.240 67.932 146.818 1.00 0.00 H TER 46749 WAT 9267 ATOM 46749 O WAT 9268 13.362 4.908 77.981 1.00 0.00 O ATOM 46750 H1 WAT 9268 13.814 5.531 77.412 1.00 0.00 H ATOM 46751 H2 WAT 9268 12.742 5.443 78.477 1.00 0.00 H TER 46753 WAT 9268 ATOM 46753 O WAT 9269 6.541 123.762 14.969 1.00 0.00 O ATOM 46754 H1 WAT 9269 7.310 124.165 14.564 1.00 0.00 H ATOM 46755 H2 WAT 9269 6.689 122.821 14.881 1.00 0.00 H TER 46757 WAT 9269 ATOM 46757 O WAT 9270 87.743 137.731 66.369 1.00 0.00 O ATOM 46758 H1 WAT 9270 87.670 137.936 67.302 1.00 0.00 H ATOM 46759 H2 WAT 9270 86.883 137.384 66.133 1.00 0.00 H TER 46761 WAT 9270 ATOM 46761 O WAT 9271 0.790 26.286 148.987 1.00 0.00 O ATOM 46762 H1 WAT 9271 0.880 26.960 149.661 1.00 0.00 H ATOM 46763 H2 WAT 9271 1.156 26.684 148.198 1.00 0.00 H TER 46765 WAT 9271 ATOM 46765 O WAT 9272 17.987 90.045 94.179 1.00 0.00 O ATOM 46766 H1 WAT 9272 18.274 90.869 93.784 1.00 0.00 H ATOM 46767 H2 WAT 9272 18.741 89.749 94.689 1.00 0.00 H TER 46769 WAT 9272 ATOM 46769 O WAT 9273 111.172 125.824 84.843 1.00 0.00 O ATOM 46770 H1 WAT 9273 110.785 125.147 85.397 1.00 0.00 H ATOM 46771 H2 WAT 9273 110.683 126.618 85.059 1.00 0.00 H TER 46773 WAT 9273 ATOM 46773 O WAT 9274 96.077 32.118 91.201 1.00 0.00 O ATOM 46774 H1 WAT 9274 95.960 33.068 91.185 1.00 0.00 H ATOM 46775 H2 WAT 9274 97.014 31.994 91.350 1.00 0.00 H TER 46777 WAT 9274 ATOM 46777 O WAT 9275 17.403 48.315 138.905 1.00 0.00 O ATOM 46778 H1 WAT 9275 17.340 47.696 138.178 1.00 0.00 H ATOM 46779 H2 WAT 9275 18.240 48.110 139.322 1.00 0.00 H TER 46781 WAT 9275 ATOM 46781 O WAT 9276 130.188 6.076 77.966 1.00 0.00 O ATOM 46782 H1 WAT 9276 130.685 6.050 77.149 1.00 0.00 H ATOM 46783 H2 WAT 9276 130.790 5.725 78.623 1.00 0.00 H TER 46785 WAT 9276 ATOM 46785 O WAT 9277 95.830 104.713 104.473 1.00 0.00 O ATOM 46786 H1 WAT 9277 95.684 104.634 105.416 1.00 0.00 H ATOM 46787 H2 WAT 9277 95.801 105.654 104.303 1.00 0.00 H TER 46789 WAT 9277 ATOM 46789 O WAT 9278 104.285 9.767 59.743 1.00 0.00 O ATOM 46790 H1 WAT 9278 104.060 10.587 59.303 1.00 0.00 H ATOM 46791 H2 WAT 9278 105.203 9.618 59.517 1.00 0.00 H TER 46793 WAT 9278 ATOM 46793 O WAT 9279 75.923 100.031 25.136 1.00 0.00 O ATOM 46794 H1 WAT 9279 75.487 99.758 25.943 1.00 0.00 H ATOM 46795 H2 WAT 9279 75.524 99.491 24.453 1.00 0.00 H TER 46797 WAT 9279 ATOM 46797 O WAT 9280 102.941 82.095 3.481 1.00 0.00 O ATOM 46798 H1 WAT 9280 102.159 81.556 3.359 1.00 0.00 H ATOM 46799 H2 WAT 9280 103.482 81.597 4.095 1.00 0.00 H TER 46801 WAT 9280 ATOM 46801 O WAT 9281 18.340 86.388 76.027 1.00 0.00 O ATOM 46802 H1 WAT 9281 18.696 85.922 76.784 1.00 0.00 H ATOM 46803 H2 WAT 9281 18.865 86.082 75.288 1.00 0.00 H TER 46805 WAT 9281 ATOM 46805 O WAT 9282 83.050 72.985 128.995 1.00 0.00 O ATOM 46806 H1 WAT 9282 82.417 73.700 129.059 1.00 0.00 H ATOM 46807 H2 WAT 9282 83.292 72.960 128.069 1.00 0.00 H TER 46809 WAT 9282 ATOM 46809 O WAT 9283 83.877 135.459 5.144 1.00 0.00 O ATOM 46810 H1 WAT 9283 84.591 136.070 4.963 1.00 0.00 H ATOM 46811 H2 WAT 9283 83.137 136.018 5.379 1.00 0.00 H TER 46813 WAT 9283 ATOM 46813 O WAT 9284 15.021 104.671 70.414 1.00 0.00 O ATOM 46814 H1 WAT 9284 15.946 104.832 70.599 1.00 0.00 H ATOM 46815 H2 WAT 9284 14.819 103.865 70.890 1.00 0.00 H TER 46817 WAT 9284 ATOM 46817 O WAT 9285 47.732 68.080 104.078 1.00 0.00 O ATOM 46818 H1 WAT 9285 48.149 68.356 103.262 1.00 0.00 H ATOM 46819 H2 WAT 9285 48.099 67.213 104.253 1.00 0.00 H TER 46821 WAT 9285 ATOM 46821 O WAT 9286 112.032 12.025 150.676 1.00 0.00 O ATOM 46822 H1 WAT 9286 112.657 12.589 151.132 1.00 0.00 H ATOM 46823 H2 WAT 9286 112.113 12.273 149.755 1.00 0.00 H TER 46825 WAT 9286 ATOM 46825 O WAT 9287 145.636 125.720 14.964 1.00 0.00 O ATOM 46826 H1 WAT 9287 145.290 126.004 14.118 1.00 0.00 H ATOM 46827 H2 WAT 9287 145.638 126.513 15.500 1.00 0.00 H TER 46829 WAT 9287 ATOM 46829 O WAT 9288 117.583 86.964 65.055 1.00 0.00 O ATOM 46830 H1 WAT 9288 117.235 86.073 65.092 1.00 0.00 H ATOM 46831 H2 WAT 9288 116.807 87.521 64.998 1.00 0.00 H TER 46833 WAT 9288 ATOM 46833 O WAT 9289 7.162 124.500 85.933 1.00 0.00 O ATOM 46834 H1 WAT 9289 6.970 123.980 85.153 1.00 0.00 H ATOM 46835 H2 WAT 9289 6.303 124.695 86.308 1.00 0.00 H TER 46837 WAT 9289 ATOM 46837 O WAT 9290 85.029 56.780 85.277 1.00 0.00 O ATOM 46838 H1 WAT 9290 84.209 56.954 84.814 1.00 0.00 H ATOM 46839 H2 WAT 9290 84.957 55.868 85.557 1.00 0.00 H TER 46841 WAT 9290 ATOM 46841 O WAT 9291 44.273 130.824 5.624 1.00 0.00 O ATOM 46842 H1 WAT 9291 43.425 131.228 5.436 1.00 0.00 H ATOM 46843 H2 WAT 9291 44.432 131.020 6.547 1.00 0.00 H TER 46845 WAT 9291 ATOM 46845 O WAT 9292 119.120 92.990 123.353 1.00 0.00 O ATOM 46846 H1 WAT 9292 119.350 93.801 122.898 1.00 0.00 H ATOM 46847 H2 WAT 9292 118.902 93.269 124.242 1.00 0.00 H TER 46849 WAT 9292 ATOM 46849 O WAT 9293 72.733 66.262 138.201 1.00 0.00 O ATOM 46850 H1 WAT 9293 73.232 65.572 137.765 1.00 0.00 H ATOM 46851 H2 WAT 9293 72.074 66.523 137.559 1.00 0.00 H TER 46853 WAT 9293 ATOM 46853 O WAT 9294 52.270 31.014 17.808 1.00 0.00 O ATOM 46854 H1 WAT 9294 52.591 30.250 18.288 1.00 0.00 H ATOM 46855 H2 WAT 9294 52.968 31.216 17.184 1.00 0.00 H TER 46857 WAT 9294 ATOM 46857 O WAT 9295 55.836 42.343 67.639 1.00 0.00 O ATOM 46858 H1 WAT 9295 54.980 42.263 68.060 1.00 0.00 H ATOM 46859 H2 WAT 9295 56.188 43.170 67.967 1.00 0.00 H TER 46861 WAT 9295 ATOM 46861 O WAT 9296 142.276 122.998 62.733 1.00 0.00 O ATOM 46862 H1 WAT 9296 142.686 123.563 62.079 1.00 0.00 H ATOM 46863 H2 WAT 9296 141.622 122.499 62.243 1.00 0.00 H TER 46865 WAT 9296 ATOM 46865 O WAT 9297 134.702 17.947 82.677 1.00 0.00 O ATOM 46866 H1 WAT 9297 133.931 17.835 82.122 1.00 0.00 H ATOM 46867 H2 WAT 9297 134.805 17.104 83.118 1.00 0.00 H TER 46869 WAT 9297 ATOM 46869 O WAT 9298 48.388 24.947 62.675 1.00 0.00 O ATOM 46870 H1 WAT 9298 47.989 25.600 63.249 1.00 0.00 H ATOM 46871 H2 WAT 9298 49.250 25.306 62.466 1.00 0.00 H TER 46873 WAT 9298 ATOM 46873 O WAT 9299 84.203 69.848 149.234 1.00 0.00 O ATOM 46874 H1 WAT 9299 84.541 69.439 150.031 1.00 0.00 H ATOM 46875 H2 WAT 9299 84.876 69.678 148.574 1.00 0.00 H TER 46877 WAT 9299 ATOM 46877 O WAT 9300 125.957 6.104 113.733 1.00 0.00 O ATOM 46878 H1 WAT 9300 125.390 6.625 114.302 1.00 0.00 H ATOM 46879 H2 WAT 9300 125.352 5.619 113.171 1.00 0.00 H TER 46881 WAT 9300 ATOM 46881 O WAT 9301 26.045 67.957 95.055 1.00 0.00 O ATOM 46882 H1 WAT 9301 25.954 68.852 95.384 1.00 0.00 H ATOM 46883 H2 WAT 9301 25.891 68.032 94.113 1.00 0.00 H TER 46885 WAT 9301 ATOM 46885 O WAT 9302 120.236 73.542 108.097 1.00 0.00 O ATOM 46886 H1 WAT 9302 119.444 73.331 108.591 1.00 0.00 H ATOM 46887 H2 WAT 9302 120.952 73.385 108.713 1.00 0.00 H TER 46889 WAT 9302 ATOM 46889 O WAT 9303 66.110 27.683 121.815 1.00 0.00 O ATOM 46890 H1 WAT 9303 66.425 27.463 122.691 1.00 0.00 H ATOM 46891 H2 WAT 9303 65.895 26.838 121.419 1.00 0.00 H TER 46893 WAT 9303 ATOM 46893 O WAT 9304 56.641 139.168 148.477 1.00 0.00 O ATOM 46894 H1 WAT 9304 57.125 139.920 148.136 1.00 0.00 H ATOM 46895 H2 WAT 9304 56.485 139.381 149.397 1.00 0.00 H TER 46897 WAT 9304 ATOM 46897 O WAT 9305 61.933 116.128 152.278 1.00 0.00 O ATOM 46898 H1 WAT 9305 61.071 116.442 152.003 1.00 0.00 H ATOM 46899 H2 WAT 9305 61.949 115.209 152.009 1.00 0.00 H TER 46901 WAT 9305 ATOM 46901 O WAT 9306 144.594 86.750 92.665 1.00 0.00 O ATOM 46902 H1 WAT 9306 145.492 87.081 92.644 1.00 0.00 H ATOM 46903 H2 WAT 9306 144.688 85.798 92.612 1.00 0.00 H TER 46905 WAT 9306 ATOM 46905 O WAT 9307 12.516 3.417 14.520 1.00 0.00 O ATOM 46906 H1 WAT 9307 12.632 3.859 13.678 1.00 0.00 H ATOM 46907 H2 WAT 9307 13.010 2.602 14.432 1.00 0.00 H TER 46909 WAT 9307 ATOM 46909 O WAT 9308 100.907 91.303 13.650 1.00 0.00 O ATOM 46910 H1 WAT 9308 100.703 90.512 14.147 1.00 0.00 H ATOM 46911 H2 WAT 9308 101.114 90.986 12.770 1.00 0.00 H TER 46913 WAT 9308 ATOM 46913 O WAT 9309 119.097 116.883 68.016 1.00 0.00 O ATOM 46914 H1 WAT 9309 119.452 116.966 67.131 1.00 0.00 H ATOM 46915 H2 WAT 9309 119.642 117.462 68.548 1.00 0.00 H TER 46917 WAT 9309 ATOM 46917 O WAT 9310 108.738 115.939 156.313 1.00 0.00 O ATOM 46918 H1 WAT 9310 108.964 115.141 156.790 1.00 0.00 H ATOM 46919 H2 WAT 9310 108.184 116.432 156.918 1.00 0.00 H TER 46921 WAT 9310 ATOM 46921 O WAT 9311 56.341 96.521 4.595 1.00 0.00 O ATOM 46922 H1 WAT 9311 55.745 95.941 5.069 1.00 0.00 H ATOM 46923 H2 WAT 9311 55.979 96.563 3.710 1.00 0.00 H TER 46925 WAT 9311 ATOM 46925 O WAT 9312 1.776 31.554 66.929 1.00 0.00 O ATOM 46926 H1 WAT 9312 1.301 32.103 66.306 1.00 0.00 H ATOM 46927 H2 WAT 9312 1.371 31.745 67.775 1.00 0.00 H TER 46929 WAT 9312 ATOM 46929 O WAT 9313 92.415 107.822 86.519 1.00 0.00 O ATOM 46930 H1 WAT 9313 91.684 107.548 87.073 1.00 0.00 H ATOM 46931 H2 WAT 9313 92.991 107.058 86.487 1.00 0.00 H TER 46933 WAT 9313 ATOM 46933 O WAT 9314 45.605 20.152 14.501 1.00 0.00 O ATOM 46934 H1 WAT 9314 44.917 20.663 14.075 1.00 0.00 H ATOM 46935 H2 WAT 9314 45.971 20.743 15.159 1.00 0.00 H TER 46937 WAT 9314 ATOM 46937 O WAT 9315 124.577 77.995 116.602 1.00 0.00 O ATOM 46938 H1 WAT 9315 124.556 78.785 116.063 1.00 0.00 H ATOM 46939 H2 WAT 9315 124.974 78.277 117.425 1.00 0.00 H TER 46941 WAT 9315 ATOM 46941 O WAT 9316 12.144 122.997 142.272 1.00 0.00 O ATOM 46942 H1 WAT 9316 12.112 122.997 143.229 1.00 0.00 H ATOM 46943 H2 WAT 9316 12.799 123.660 142.054 1.00 0.00 H TER 46945 WAT 9316 ATOM 46945 O WAT 9317 109.774 58.386 1.147 1.00 0.00 O ATOM 46946 H1 WAT 9317 110.569 57.975 1.485 1.00 0.00 H ATOM 46947 H2 WAT 9317 109.824 59.292 1.453 1.00 0.00 H TER 46949 WAT 9317 ATOM 46949 O WAT 9318 29.447 80.868 132.069 1.00 0.00 O ATOM 46950 H1 WAT 9318 30.402 80.803 132.105 1.00 0.00 H ATOM 46951 H2 WAT 9318 29.251 80.996 131.141 1.00 0.00 H TER 46953 WAT 9318 ATOM 46953 O WAT 9319 20.007 27.552 144.212 1.00 0.00 O ATOM 46954 H1 WAT 9319 20.515 26.984 144.791 1.00 0.00 H ATOM 46955 H2 WAT 9319 19.097 27.405 144.470 1.00 0.00 H TER 46957 WAT 9319 ATOM 46957 O WAT 9320 132.010 133.323 93.083 1.00 0.00 O ATOM 46958 H1 WAT 9320 131.584 133.940 93.679 1.00 0.00 H ATOM 46959 H2 WAT 9320 132.851 133.731 92.877 1.00 0.00 H TER 46961 WAT 9320 ATOM 46961 O WAT 9321 58.972 10.763 102.934 1.00 0.00 O ATOM 46962 H1 WAT 9321 59.338 10.938 103.802 1.00 0.00 H ATOM 46963 H2 WAT 9321 58.160 11.269 102.910 1.00 0.00 H TER 46965 WAT 9321 ATOM 46965 O WAT 9322 25.799 28.286 20.816 1.00 0.00 O ATOM 46966 H1 WAT 9322 26.607 28.367 21.322 1.00 0.00 H ATOM 46967 H2 WAT 9322 25.795 27.377 20.516 1.00 0.00 H TER 46969 WAT 9322 ATOM 46969 O WAT 9323 31.599 110.027 30.852 1.00 0.00 O ATOM 46970 H1 WAT 9323 31.605 109.181 31.300 1.00 0.00 H ATOM 46971 H2 WAT 9323 30.826 110.475 31.196 1.00 0.00 H TER 46973 WAT 9323 ATOM 46973 O WAT 9324 78.783 110.431 65.325 1.00 0.00 O ATOM 46974 H1 WAT 9324 79.582 110.420 64.797 1.00 0.00 H ATOM 46975 H2 WAT 9324 78.627 109.512 65.542 1.00 0.00 H TER 46977 WAT 9324 ATOM 46977 O WAT 9325 5.297 119.403 89.834 1.00 0.00 O ATOM 46978 H1 WAT 9325 5.642 119.928 89.112 1.00 0.00 H ATOM 46979 H2 WAT 9325 5.130 118.544 89.446 1.00 0.00 H TER 46981 WAT 9325 ATOM 46981 O WAT 9326 52.933 124.832 84.782 1.00 0.00 O ATOM 46982 H1 WAT 9326 52.120 125.319 84.912 1.00 0.00 H ATOM 46983 H2 WAT 9326 53.554 125.485 84.458 1.00 0.00 H TER 46985 WAT 9326 ATOM 46985 O WAT 9327 78.242 92.561 64.357 1.00 0.00 O ATOM 46986 H1 WAT 9327 78.948 92.682 63.722 1.00 0.00 H ATOM 46987 H2 WAT 9327 77.469 92.375 63.824 1.00 0.00 H TER 46989 WAT 9327 ATOM 46989 O WAT 9328 25.217 22.144 11.508 1.00 0.00 O ATOM 46990 H1 WAT 9328 26.026 22.633 11.660 1.00 0.00 H ATOM 46991 H2 WAT 9328 24.827 22.559 10.739 1.00 0.00 H TER 46993 WAT 9328 ATOM 46993 O WAT 9329 59.995 115.488 107.746 1.00 0.00 O ATOM 46994 H1 WAT 9329 59.404 116.111 107.321 1.00 0.00 H ATOM 46995 H2 WAT 9329 60.038 114.748 107.141 1.00 0.00 H TER 46997 WAT 9329 ATOM 46997 O WAT 9330 82.271 110.754 26.130 1.00 0.00 O ATOM 46998 H1 WAT 9330 81.315 110.741 26.108 1.00 0.00 H ATOM 46999 H2 WAT 9330 82.494 111.663 26.329 1.00 0.00 H TER 47001 WAT 9330 ATOM 47001 O WAT 9331 7.615 131.858 27.235 1.00 0.00 O ATOM 47002 H1 WAT 9331 8.546 131.902 27.452 1.00 0.00 H ATOM 47003 H2 WAT 9331 7.461 130.938 27.024 1.00 0.00 H TER 47005 WAT 9331 ATOM 47005 O WAT 9332 45.059 86.403 124.316 1.00 0.00 O ATOM 47006 H1 WAT 9332 44.229 86.537 124.773 1.00 0.00 H ATOM 47007 H2 WAT 9332 44.887 85.679 123.715 1.00 0.00 H TER 47009 WAT 9332 ATOM 47009 O WAT 9333 23.619 4.876 93.550 1.00 0.00 O ATOM 47010 H1 WAT 9333 23.271 4.568 92.713 1.00 0.00 H ATOM 47011 H2 WAT 9333 23.006 4.539 94.203 1.00 0.00 H TER 47013 WAT 9333 ATOM 47013 O WAT 9334 83.711 66.708 112.188 1.00 0.00 O ATOM 47014 H1 WAT 9334 82.962 66.374 111.695 1.00 0.00 H ATOM 47015 H2 WAT 9334 83.573 66.387 113.080 1.00 0.00 H TER 47017 WAT 9334 ATOM 47017 O WAT 9335 130.605 58.790 127.431 1.00 0.00 O ATOM 47018 H1 WAT 9335 130.306 58.574 126.547 1.00 0.00 H ATOM 47019 H2 WAT 9335 131.163 58.053 127.681 1.00 0.00 H TER 47021 WAT 9335 ATOM 47021 O WAT 9336 97.536 131.313 150.342 1.00 0.00 O ATOM 47022 H1 WAT 9336 96.929 130.681 149.956 1.00 0.00 H ATOM 47023 H2 WAT 9336 97.033 131.733 151.040 1.00 0.00 H TER 47025 WAT 9336 ATOM 47025 O WAT 9337 24.040 16.601 149.391 1.00 0.00 O ATOM 47026 H1 WAT 9337 23.650 16.610 150.266 1.00 0.00 H ATOM 47027 H2 WAT 9337 24.900 16.200 149.517 1.00 0.00 H TER 47029 WAT 9337 ATOM 47029 O WAT 9338 30.443 123.650 144.232 1.00 0.00 O ATOM 47030 H1 WAT 9338 30.106 122.896 143.748 1.00 0.00 H ATOM 47031 H2 WAT 9338 31.238 123.326 144.655 1.00 0.00 H TER 47033 WAT 9338 ATOM 47033 O WAT 9339 14.443 130.280 133.476 1.00 0.00 O ATOM 47034 H1 WAT 9339 15.366 130.281 133.731 1.00 0.00 H ATOM 47035 H2 WAT 9339 13.991 130.693 134.212 1.00 0.00 H TER 47037 WAT 9339 ATOM 47037 O WAT 9340 35.428 5.270 76.510 1.00 0.00 O ATOM 47038 H1 WAT 9340 36.234 5.531 76.064 1.00 0.00 H ATOM 47039 H2 WAT 9340 35.563 5.532 77.421 1.00 0.00 H TER 47041 WAT 9340 ATOM 47041 O WAT 9341 99.171 119.567 76.369 1.00 0.00 O ATOM 47042 H1 WAT 9341 99.139 119.463 75.418 1.00 0.00 H ATOM 47043 H2 WAT 9341 100.067 119.327 76.606 1.00 0.00 H TER 47045 WAT 9341 ATOM 47045 O WAT 9342 6.311 5.980 87.729 1.00 0.00 O ATOM 47046 H1 WAT 9342 6.151 5.237 87.148 1.00 0.00 H ATOM 47047 H2 WAT 9342 5.674 5.874 88.435 1.00 0.00 H TER 47049 WAT 9342 ATOM 47049 O WAT 9343 29.629 85.034 10.344 1.00 0.00 O ATOM 47050 H1 WAT 9343 29.846 85.165 9.421 1.00 0.00 H ATOM 47051 H2 WAT 9343 30.445 85.218 10.811 1.00 0.00 H TER 47053 WAT 9343 ATOM 47053 O WAT 9344 5.696 26.467 111.907 1.00 0.00 O ATOM 47054 H1 WAT 9344 5.631 25.515 111.989 1.00 0.00 H ATOM 47055 H2 WAT 9344 5.028 26.697 111.261 1.00 0.00 H TER 47057 WAT 9344 ATOM 47057 O WAT 9345 139.841 40.908 106.076 1.00 0.00 O ATOM 47058 H1 WAT 9345 139.057 40.684 105.574 1.00 0.00 H ATOM 47059 H2 WAT 9345 140.508 41.082 105.412 1.00 0.00 H TER 47061 WAT 9345 ATOM 47061 O WAT 9346 62.737 17.778 58.201 1.00 0.00 O ATOM 47062 H1 WAT 9346 63.087 17.081 57.646 1.00 0.00 H ATOM 47063 H2 WAT 9346 62.480 17.335 59.009 1.00 0.00 H TER 47065 WAT 9346 ATOM 47065 O WAT 9347 135.188 97.487 19.473 1.00 0.00 O ATOM 47066 H1 WAT 9347 135.724 98.270 19.599 1.00 0.00 H ATOM 47067 H2 WAT 9347 135.584 96.830 20.045 1.00 0.00 H TER 47069 WAT 9347 ATOM 47069 O WAT 9348 56.711 111.442 143.464 1.00 0.00 O ATOM 47070 H1 WAT 9348 56.254 111.415 144.304 1.00 0.00 H ATOM 47071 H2 WAT 9348 57.576 111.795 143.673 1.00 0.00 H TER 47073 WAT 9348 ATOM 47073 O WAT 9349 11.810 67.162 154.300 1.00 0.00 O ATOM 47074 H1 WAT 9349 11.873 66.256 154.601 1.00 0.00 H ATOM 47075 H2 WAT 9349 11.413 67.098 153.431 1.00 0.00 H TER 47077 WAT 9349 ATOM 47077 O WAT 9350 87.694 99.908 84.616 1.00 0.00 O ATOM 47078 H1 WAT 9350 88.426 99.502 84.151 1.00 0.00 H ATOM 47079 H2 WAT 9350 87.292 100.488 83.970 1.00 0.00 H TER 47081 WAT 9350 ATOM 47081 O WAT 9351 35.413 11.592 73.370 1.00 0.00 O ATOM 47082 H1 WAT 9351 34.875 11.016 72.828 1.00 0.00 H ATOM 47083 H2 WAT 9351 34.839 11.846 74.093 1.00 0.00 H TER 47085 WAT 9351 ATOM 47085 O WAT 9352 96.347 18.593 138.218 1.00 0.00 O ATOM 47086 H1 WAT 9352 95.493 18.454 137.808 1.00 0.00 H ATOM 47087 H2 WAT 9352 96.142 18.963 139.077 1.00 0.00 H TER 47089 WAT 9352 ATOM 47089 O WAT 9353 135.807 43.679 118.199 1.00 0.00 O ATOM 47090 H1 WAT 9353 135.533 43.023 117.558 1.00 0.00 H ATOM 47091 H2 WAT 9353 136.748 43.777 118.056 1.00 0.00 H TER 47093 WAT 9353 ATOM 47093 O WAT 9354 42.216 62.661 81.131 1.00 0.00 O ATOM 47094 H1 WAT 9354 41.566 61.972 81.269 1.00 0.00 H ATOM 47095 H2 WAT 9354 41.701 63.463 81.047 1.00 0.00 H TER 47097 WAT 9354 ATOM 47097 O WAT 9355 9.005 141.608 143.533 1.00 0.00 O ATOM 47098 H1 WAT 9355 9.023 142.225 142.801 1.00 0.00 H ATOM 47099 H2 WAT 9355 9.924 141.501 143.779 1.00 0.00 H TER 47101 WAT 9355 ATOM 47101 O WAT 9356 124.600 117.219 145.903 1.00 0.00 O ATOM 47102 H1 WAT 9356 124.561 117.155 146.858 1.00 0.00 H ATOM 47103 H2 WAT 9356 125.535 117.207 145.701 1.00 0.00 H TER 47105 WAT 9356 ATOM 47105 O WAT 9357 22.824 91.593 145.073 1.00 0.00 O ATOM 47106 H1 WAT 9357 22.266 92.254 144.664 1.00 0.00 H ATOM 47107 H2 WAT 9357 22.534 91.566 145.985 1.00 0.00 H TER 47109 WAT 9357 ATOM 47109 O WAT 9358 129.921 41.257 130.897 1.00 0.00 O ATOM 47110 H1 WAT 9358 130.780 41.490 130.545 1.00 0.00 H ATOM 47111 H2 WAT 9358 129.404 42.058 130.818 1.00 0.00 H TER 47113 WAT 9358 ATOM 47113 O WAT 9359 110.173 142.555 112.519 1.00 0.00 O ATOM 47114 H1 WAT 9359 110.781 141.816 112.525 1.00 0.00 H ATOM 47115 H2 WAT 9359 110.350 143.016 113.339 1.00 0.00 H TER 47117 WAT 9359 ATOM 47117 O WAT 9360 119.059 126.695 117.823 1.00 0.00 O ATOM 47118 H1 WAT 9360 118.648 127.554 117.724 1.00 0.00 H ATOM 47119 H2 WAT 9360 119.220 126.614 118.763 1.00 0.00 H TER 47121 WAT 9360 ATOM 47121 O WAT 9361 106.864 100.723 148.034 1.00 0.00 O ATOM 47122 H1 WAT 9361 107.753 100.449 147.807 1.00 0.00 H ATOM 47123 H2 WAT 9361 106.535 100.022 148.598 1.00 0.00 H TER 47125 WAT 9361 ATOM 47125 O WAT 9362 130.197 65.265 62.113 1.00 0.00 O ATOM 47126 H1 WAT 9362 130.100 65.912 61.414 1.00 0.00 H ATOM 47127 H2 WAT 9362 129.578 65.546 62.787 1.00 0.00 H TER 47129 WAT 9362 ATOM 47129 O WAT 9363 129.124 61.836 144.203 1.00 0.00 O ATOM 47130 H1 WAT 9363 128.421 61.366 143.755 1.00 0.00 H ATOM 47131 H2 WAT 9363 129.724 61.149 144.494 1.00 0.00 H TER 47133 WAT 9363 ATOM 47133 O WAT 9364 54.912 88.906 141.420 1.00 0.00 O ATOM 47134 H1 WAT 9364 55.293 88.356 140.735 1.00 0.00 H ATOM 47135 H2 WAT 9364 55.350 89.751 141.319 1.00 0.00 H TER 47137 WAT 9364 ATOM 47137 O WAT 9365 134.197 57.687 100.607 1.00 0.00 O ATOM 47138 H1 WAT 9365 134.283 57.959 99.693 1.00 0.00 H ATOM 47139 H2 WAT 9365 134.765 56.920 100.683 1.00 0.00 H TER 47141 WAT 9365 ATOM 47141 O WAT 9366 26.108 139.308 84.346 1.00 0.00 O ATOM 47142 H1 WAT 9366 26.579 139.484 85.160 1.00 0.00 H ATOM 47143 H2 WAT 9366 26.198 140.114 83.838 1.00 0.00 H TER 47145 WAT 9366 ATOM 47145 O WAT 9367 55.990 133.680 13.750 1.00 0.00 O ATOM 47146 H1 WAT 9367 56.437 133.267 14.489 1.00 0.00 H ATOM 47147 H2 WAT 9367 55.467 132.977 13.364 1.00 0.00 H TER 47149 WAT 9367 ATOM 47149 O WAT 9368 46.939 1.013 73.039 1.00 0.00 O ATOM 47150 H1 WAT 9368 47.090 0.714 72.142 1.00 0.00 H ATOM 47151 H2 WAT 9368 47.142 1.948 73.017 1.00 0.00 H TER 47153 WAT 9368 ATOM 47153 O WAT 9369 39.191 105.124 25.994 1.00 0.00 O ATOM 47154 H1 WAT 9369 39.397 105.818 26.620 1.00 0.00 H ATOM 47155 H2 WAT 9369 39.894 104.484 26.105 1.00 0.00 H TER 47157 WAT 9369 ATOM 47157 O WAT 9370 29.282 88.328 106.221 1.00 0.00 O ATOM 47158 H1 WAT 9370 29.514 89.220 105.961 1.00 0.00 H ATOM 47159 H2 WAT 9370 28.692 88.024 105.531 1.00 0.00 H TER 47161 WAT 9370 ATOM 47161 O WAT 9371 61.544 39.916 86.152 1.00 0.00 O ATOM 47162 H1 WAT 9371 61.722 40.814 86.433 1.00 0.00 H ATOM 47163 H2 WAT 9371 62.377 39.459 86.269 1.00 0.00 H TER 47165 WAT 9371 ATOM 47165 O WAT 9372 55.827 101.118 111.348 1.00 0.00 O ATOM 47166 H1 WAT 9372 56.406 101.765 110.946 1.00 0.00 H ATOM 47167 H2 WAT 9372 54.945 101.407 111.113 1.00 0.00 H TER 47169 WAT 9372 ATOM 47169 O WAT 9373 97.048 12.653 128.501 1.00 0.00 O ATOM 47170 H1 WAT 9373 96.468 12.892 127.779 1.00 0.00 H ATOM 47171 H2 WAT 9373 96.494 12.150 129.097 1.00 0.00 H TER 47173 WAT 9373 ATOM 47173 O WAT 9374 88.604 93.845 97.679 1.00 0.00 O ATOM 47174 H1 WAT 9374 88.032 94.518 98.048 1.00 0.00 H ATOM 47175 H2 WAT 9374 88.664 94.064 96.750 1.00 0.00 H TER 47177 WAT 9374 ATOM 47177 O WAT 9375 137.968 97.530 76.936 1.00 0.00 O ATOM 47178 H1 WAT 9375 138.116 98.284 77.507 1.00 0.00 H ATOM 47179 H2 WAT 9375 137.608 96.859 77.515 1.00 0.00 H TER 47181 WAT 9375 ATOM 47181 O WAT 9376 62.681 57.947 151.487 1.00 0.00 O ATOM 47182 H1 WAT 9376 62.772 57.678 152.401 1.00 0.00 H ATOM 47183 H2 WAT 9376 62.234 58.793 151.530 1.00 0.00 H TER 47185 WAT 9376 ATOM 47185 O WAT 9377 1.924 28.757 143.240 1.00 0.00 O ATOM 47186 H1 WAT 9377 1.517 29.520 143.650 1.00 0.00 H ATOM 47187 H2 WAT 9377 1.190 28.184 143.017 1.00 0.00 H TER 47189 WAT 9377 ATOM 47189 O WAT 9378 4.170 86.379 10.673 1.00 0.00 O ATOM 47190 H1 WAT 9378 3.516 86.066 11.298 1.00 0.00 H ATOM 47191 H2 WAT 9378 3.856 87.245 10.411 1.00 0.00 H TER 47193 WAT 9378 ATOM 47193 O WAT 9379 127.709 12.751 153.050 1.00 0.00 O ATOM 47194 H1 WAT 9379 128.489 13.102 152.620 1.00 0.00 H ATOM 47195 H2 WAT 9379 127.138 12.485 152.329 1.00 0.00 H TER 47197 WAT 9379 ATOM 47197 O WAT 9380 111.826 74.832 132.240 1.00 0.00 O ATOM 47198 H1 WAT 9380 110.951 74.500 132.443 1.00 0.00 H ATOM 47199 H2 WAT 9380 111.679 75.733 131.951 1.00 0.00 H TER 47201 WAT 9380 ATOM 47201 O WAT 9381 108.406 74.185 151.521 1.00 0.00 O ATOM 47202 H1 WAT 9381 107.883 74.554 150.808 1.00 0.00 H ATOM 47203 H2 WAT 9381 109.224 74.681 151.498 1.00 0.00 H TER 47205 WAT 9381 ATOM 47205 O WAT 9382 102.736 49.069 138.701 1.00 0.00 O ATOM 47206 H1 WAT 9382 101.936 48.548 138.777 1.00 0.00 H ATOM 47207 H2 WAT 9382 103.305 48.738 139.396 1.00 0.00 H TER 47209 WAT 9382 ATOM 47209 O WAT 9383 58.587 110.505 6.035 1.00 0.00 O ATOM 47210 H1 WAT 9383 58.445 109.769 5.440 1.00 0.00 H ATOM 47211 H2 WAT 9383 57.810 110.515 6.594 1.00 0.00 H TER 47213 WAT 9383 ATOM 47213 O WAT 9384 5.896 64.408 8.680 1.00 0.00 O ATOM 47214 H1 WAT 9384 6.489 64.373 9.431 1.00 0.00 H ATOM 47215 H2 WAT 9384 5.023 64.464 9.067 1.00 0.00 H TER 47217 WAT 9384 ATOM 47217 O WAT 9385 77.071 123.644 8.615 1.00 0.00 O ATOM 47218 H1 WAT 9385 77.953 123.941 8.391 1.00 0.00 H ATOM 47219 H2 WAT 9385 76.608 124.440 8.873 1.00 0.00 H TER 47221 WAT 9385 ATOM 47221 O WAT 9386 125.969 15.273 64.072 1.00 0.00 O ATOM 47222 H1 WAT 9386 126.516 14.494 64.173 1.00 0.00 H ATOM 47223 H2 WAT 9386 126.422 15.801 63.414 1.00 0.00 H TER 47225 WAT 9386 ATOM 47225 O WAT 9387 59.015 23.014 71.651 1.00 0.00 O ATOM 47226 H1 WAT 9387 59.943 23.177 71.817 1.00 0.00 H ATOM 47227 H2 WAT 9387 58.753 22.399 72.336 1.00 0.00 H TER 47229 WAT 9387 ATOM 47229 O WAT 9388 2.738 46.431 97.837 1.00 0.00 O ATOM 47230 H1 WAT 9388 2.384 45.675 97.368 1.00 0.00 H ATOM 47231 H2 WAT 9388 2.399 47.189 97.360 1.00 0.00 H TER 47233 WAT 9388 ATOM 47233 O WAT 9389 36.465 62.768 69.412 1.00 0.00 O ATOM 47234 H1 WAT 9389 35.695 62.221 69.568 1.00 0.00 H ATOM 47235 H2 WAT 9389 36.400 63.464 70.065 1.00 0.00 H TER 47237 WAT 9389 ATOM 47237 O WAT 9390 34.944 43.839 132.457 1.00 0.00 O ATOM 47238 H1 WAT 9390 35.790 43.750 132.018 1.00 0.00 H ATOM 47239 H2 WAT 9390 34.638 42.939 132.571 1.00 0.00 H TER 47241 WAT 9390 ATOM 47241 O WAT 9391 90.046 66.177 68.971 1.00 0.00 O ATOM 47242 H1 WAT 9391 90.039 67.063 69.331 1.00 0.00 H ATOM 47243 H2 WAT 9391 90.366 65.630 69.688 1.00 0.00 H TER 47245 WAT 9391 ATOM 47245 O WAT 9392 13.230 70.886 79.292 1.00 0.00 O ATOM 47246 H1 WAT 9392 13.898 71.565 79.200 1.00 0.00 H ATOM 47247 H2 WAT 9392 12.986 70.915 80.217 1.00 0.00 H TER 47249 WAT 9392 ATOM 47249 O WAT 9393 90.486 40.261 158.714 1.00 0.00 O ATOM 47250 H1 WAT 9393 91.116 40.738 159.255 1.00 0.00 H ATOM 47251 H2 WAT 9393 91.023 39.671 158.186 1.00 0.00 H TER 47253 WAT 9393 ATOM 47253 O WAT 9394 137.150 106.734 9.347 1.00 0.00 O ATOM 47254 H1 WAT 9394 138.099 106.625 9.409 1.00 0.00 H ATOM 47255 H2 WAT 9394 136.815 105.848 9.209 1.00 0.00 H TER 47257 WAT 9394 ATOM 47257 O WAT 9395 94.060 22.080 77.398 1.00 0.00 O ATOM 47258 H1 WAT 9395 94.976 22.230 77.634 1.00 0.00 H ATOM 47259 H2 WAT 9395 93.925 22.614 76.615 1.00 0.00 H TER 47261 WAT 9395 ATOM 47261 O WAT 9396 117.485 14.749 66.181 1.00 0.00 O ATOM 47262 H1 WAT 9396 116.686 14.964 66.662 1.00 0.00 H ATOM 47263 H2 WAT 9396 117.227 14.781 65.260 1.00 0.00 H TER 47265 WAT 9396 ATOM 47265 O WAT 9397 99.922 96.700 102.072 1.00 0.00 O ATOM 47266 H1 WAT 9397 100.400 97.382 101.599 1.00 0.00 H ATOM 47267 H2 WAT 9397 99.683 97.108 102.904 1.00 0.00 H TER 47269 WAT 9397 ATOM 47269 O WAT 9398 11.962 126.539 90.865 1.00 0.00 O ATOM 47270 H1 WAT 9398 11.113 126.178 90.611 1.00 0.00 H ATOM 47271 H2 WAT 9398 12.491 125.773 91.087 1.00 0.00 H TER 47273 WAT 9398 ATOM 47273 O WAT 9399 30.190 86.926 77.210 1.00 0.00 O ATOM 47274 H1 WAT 9399 29.763 86.442 77.917 1.00 0.00 H ATOM 47275 H2 WAT 9399 30.238 86.300 76.487 1.00 0.00 H TER 47277 WAT 9399 ATOM 47277 O WAT 9400 21.413 53.429 135.234 1.00 0.00 O ATOM 47278 H1 WAT 9400 20.621 53.299 135.756 1.00 0.00 H ATOM 47279 H2 WAT 9400 22.058 53.765 135.857 1.00 0.00 H TER 47281 WAT 9400 ATOM 47281 O WAT 9401 8.788 63.395 102.752 1.00 0.00 O ATOM 47282 H1 WAT 9401 9.301 64.126 102.407 1.00 0.00 H ATOM 47283 H2 WAT 9401 7.886 63.716 102.755 1.00 0.00 H TER 47285 WAT 9401 ATOM 47285 O WAT 9402 32.246 84.531 115.208 1.00 0.00 O ATOM 47286 H1 WAT 9402 32.604 83.710 114.871 1.00 0.00 H ATOM 47287 H2 WAT 9402 32.930 84.874 115.782 1.00 0.00 H TER 47289 WAT 9402 ATOM 47289 O WAT 9403 36.580 143.845 122.173 1.00 0.00 O ATOM 47290 H1 WAT 9403 36.624 144.308 123.009 1.00 0.00 H ATOM 47291 H2 WAT 9403 35.676 143.965 121.881 1.00 0.00 H TER 47293 WAT 9403 ATOM 47293 O WAT 9404 48.371 117.780 147.301 1.00 0.00 O ATOM 47294 H1 WAT 9404 48.594 118.630 146.920 1.00 0.00 H ATOM 47295 H2 WAT 9404 49.193 117.290 147.288 1.00 0.00 H TER 47297 WAT 9404 ATOM 47297 O WAT 9405 110.319 63.515 140.919 1.00 0.00 O ATOM 47298 H1 WAT 9405 110.586 62.991 140.164 1.00 0.00 H ATOM 47299 H2 WAT 9405 110.828 63.160 141.648 1.00 0.00 H TER 47301 WAT 9405 ATOM 47301 O WAT 9406 9.081 107.031 95.806 1.00 0.00 O ATOM 47302 H1 WAT 9406 9.118 107.929 96.134 1.00 0.00 H ATOM 47303 H2 WAT 9406 9.205 107.116 94.860 1.00 0.00 H TER 47305 WAT 9406 ATOM 47305 O WAT 9407 3.883 92.794 67.862 1.00 0.00 O ATOM 47306 H1 WAT 9407 3.736 91.891 68.140 1.00 0.00 H ATOM 47307 H2 WAT 9407 3.640 92.803 66.936 1.00 0.00 H TER 47309 WAT 9407 ATOM 47309 O WAT 9408 36.046 80.548 76.754 1.00 0.00 O ATOM 47310 H1 WAT 9408 36.913 80.594 76.351 1.00 0.00 H ATOM 47311 H2 WAT 9408 36.109 81.114 77.523 1.00 0.00 H TER 47313 WAT 9408 ATOM 47313 O WAT 9409 107.373 81.399 156.417 1.00 0.00 O ATOM 47314 H1 WAT 9409 108.117 81.960 156.635 1.00 0.00 H ATOM 47315 H2 WAT 9409 106.834 81.933 155.832 1.00 0.00 H TER 47317 WAT 9409 ATOM 47317 O WAT 9410 121.798 79.154 113.104 1.00 0.00 O ATOM 47318 H1 WAT 9410 121.548 78.449 112.507 1.00 0.00 H ATOM 47319 H2 WAT 9410 121.819 78.741 113.967 1.00 0.00 H TER 47321 WAT 9410 ATOM 47321 O WAT 9411 46.860 144.921 6.281 1.00 0.00 O ATOM 47322 H1 WAT 9411 47.044 145.411 7.082 1.00 0.00 H ATOM 47323 H2 WAT 9411 46.932 144.002 6.541 1.00 0.00 H TER 47325 WAT 9411 ATOM 47325 O WAT 9412 13.394 30.136 130.278 1.00 0.00 O ATOM 47326 H1 WAT 9412 12.479 29.895 130.129 1.00 0.00 H ATOM 47327 H2 WAT 9412 13.880 29.651 129.611 1.00 0.00 H TER 47329 WAT 9412 ATOM 47329 O WAT 9413 96.335 19.501 98.252 1.00 0.00 O ATOM 47330 H1 WAT 9413 95.687 19.179 97.625 1.00 0.00 H ATOM 47331 H2 WAT 9413 96.734 18.709 98.611 1.00 0.00 H TER 47333 WAT 9413 ATOM 47333 O WAT 9414 22.476 57.012 88.845 1.00 0.00 O ATOM 47334 H1 WAT 9414 21.687 57.453 88.529 1.00 0.00 H ATOM 47335 H2 WAT 9414 23.129 57.709 88.911 1.00 0.00 H TER 47337 WAT 9414 ATOM 47337 O WAT 9415 16.062 62.004 137.586 1.00 0.00 O ATOM 47338 H1 WAT 9415 16.476 61.904 136.729 1.00 0.00 H ATOM 47339 H2 WAT 9415 15.263 62.501 137.409 1.00 0.00 H TER 47341 WAT 9415 ATOM 47341 O WAT 9416 67.347 54.096 152.606 1.00 0.00 O ATOM 47342 H1 WAT 9416 66.819 54.740 152.134 1.00 0.00 H ATOM 47343 H2 WAT 9416 68.031 53.846 151.984 1.00 0.00 H TER 47345 WAT 9416 ATOM 47345 O WAT 9417 46.909 84.941 115.200 1.00 0.00 O ATOM 47346 H1 WAT 9417 46.351 85.386 115.837 1.00 0.00 H ATOM 47347 H2 WAT 9417 46.990 85.563 114.477 1.00 0.00 H TER 47349 WAT 9417 ATOM 47349 O WAT 9418 53.009 48.839 14.360 1.00 0.00 O ATOM 47350 H1 WAT 9418 52.726 48.124 13.789 1.00 0.00 H ATOM 47351 H2 WAT 9418 52.244 49.029 14.903 1.00 0.00 H TER 47353 WAT 9418 ATOM 47353 O WAT 9419 3.737 128.315 7.513 1.00 0.00 O ATOM 47354 H1 WAT 9419 2.914 128.804 7.495 1.00 0.00 H ATOM 47355 H2 WAT 9419 3.891 128.073 6.600 1.00 0.00 H TER 47357 WAT 9419 ATOM 47357 O WAT 9420 30.935 108.829 101.533 1.00 0.00 O ATOM 47358 H1 WAT 9420 30.831 107.877 101.533 1.00 0.00 H ATOM 47359 H2 WAT 9420 31.754 108.980 102.005 1.00 0.00 H TER 47361 WAT 9420 ATOM 47361 O WAT 9421 72.949 20.258 20.968 1.00 0.00 O ATOM 47362 H1 WAT 9421 72.097 20.417 21.375 1.00 0.00 H ATOM 47363 H2 WAT 9421 73.412 21.092 21.048 1.00 0.00 H TER 47365 WAT 9421 ATOM 47365 O WAT 9422 105.947 2.936 108.929 1.00 0.00 O ATOM 47366 H1 WAT 9422 105.944 3.705 108.360 1.00 0.00 H ATOM 47367 H2 WAT 9422 105.023 2.774 109.119 1.00 0.00 H TER 47369 WAT 9422 ATOM 47369 O WAT 9423 79.387 144.232 102.995 1.00 0.00 O ATOM 47370 H1 WAT 9423 79.411 143.618 102.261 1.00 0.00 H ATOM 47371 H2 WAT 9423 79.833 143.772 103.707 1.00 0.00 H TER 47373 WAT 9423 ATOM 47373 O WAT 9424 91.043 29.441 128.553 1.00 0.00 O ATOM 47374 H1 WAT 9424 91.553 30.215 128.316 1.00 0.00 H ATOM 47375 H2 WAT 9424 91.452 28.725 128.066 1.00 0.00 H TER 47377 WAT 9424 ATOM 47377 O WAT 9425 101.750 132.661 155.321 1.00 0.00 O ATOM 47378 H1 WAT 9425 102.437 132.280 154.774 1.00 0.00 H ATOM 47379 H2 WAT 9425 101.654 133.556 154.996 1.00 0.00 H TER 47381 WAT 9425 ATOM 47381 O WAT 9426 8.707 67.626 76.053 1.00 0.00 O ATOM 47382 H1 WAT 9426 9.425 67.312 76.603 1.00 0.00 H ATOM 47383 H2 WAT 9426 8.794 68.579 76.069 1.00 0.00 H TER 47385 WAT 9426 ATOM 47385 O WAT 9427 111.833 90.844 111.670 1.00 0.00 O ATOM 47386 H1 WAT 9427 111.003 90.429 111.436 1.00 0.00 H ATOM 47387 H2 WAT 9427 112.249 90.225 112.270 1.00 0.00 H TER 47389 WAT 9427 ATOM 47389 O WAT 9428 102.855 61.218 135.795 1.00 0.00 O ATOM 47390 H1 WAT 9428 103.019 60.826 136.653 1.00 0.00 H ATOM 47391 H2 WAT 9428 102.343 62.004 135.985 1.00 0.00 H TER 47393 WAT 9428 ATOM 47393 O WAT 9429 111.366 19.810 58.520 1.00 0.00 O ATOM 47394 H1 WAT 9429 111.290 20.602 59.052 1.00 0.00 H ATOM 47395 H2 WAT 9429 110.861 19.152 58.997 1.00 0.00 H TER 47397 WAT 9429 ATOM 47397 O WAT 9430 76.217 48.684 88.017 1.00 0.00 O ATOM 47398 H1 WAT 9430 76.708 47.864 87.947 1.00 0.00 H ATOM 47399 H2 WAT 9430 76.871 49.332 88.279 1.00 0.00 H TER 47401 WAT 9430 ATOM 47401 O WAT 9431 25.181 9.084 9.870 1.00 0.00 O ATOM 47402 H1 WAT 9431 25.372 9.148 8.935 1.00 0.00 H ATOM 47403 H2 WAT 9431 24.814 9.938 10.099 1.00 0.00 H TER 47405 WAT 9431 ATOM 47405 O WAT 9432 117.735 27.556 122.717 1.00 0.00 O ATOM 47406 H1 WAT 9432 118.020 28.178 123.386 1.00 0.00 H ATOM 47407 H2 WAT 9432 118.020 26.703 123.046 1.00 0.00 H TER 47409 WAT 9432 ATOM 47409 O WAT 9433 104.401 90.434 135.141 1.00 0.00 O ATOM 47410 H1 WAT 9433 104.325 91.367 135.339 1.00 0.00 H ATOM 47411 H2 WAT 9433 103.727 90.019 135.679 1.00 0.00 H TER 47413 WAT 9433 ATOM 47413 O WAT 9434 136.120 122.086 75.984 1.00 0.00 O ATOM 47414 H1 WAT 9434 135.538 122.044 75.225 1.00 0.00 H ATOM 47415 H2 WAT 9434 135.935 121.283 76.471 1.00 0.00 H TER 47417 WAT 9434 ATOM 47417 O WAT 9435 14.047 102.032 9.430 1.00 0.00 O ATOM 47418 H1 WAT 9435 13.802 102.808 8.925 1.00 0.00 H ATOM 47419 H2 WAT 9435 13.241 101.772 9.876 1.00 0.00 H TER 47421 WAT 9435 ATOM 47421 O WAT 9436 93.967 16.197 70.638 1.00 0.00 O ATOM 47422 H1 WAT 9436 93.085 15.984 70.942 1.00 0.00 H ATOM 47423 H2 WAT 9436 93.859 16.389 69.707 1.00 0.00 H TER 47425 WAT 9436 ATOM 47425 O WAT 9437 99.632 97.906 10.188 1.00 0.00 O ATOM 47426 H1 WAT 9437 100.393 97.553 10.648 1.00 0.00 H ATOM 47427 H2 WAT 9437 98.905 97.781 10.799 1.00 0.00 H TER 47429 WAT 9437 ATOM 47429 O WAT 9438 131.167 121.008 17.611 1.00 0.00 O ATOM 47430 H1 WAT 9438 130.325 121.433 17.449 1.00 0.00 H ATOM 47431 H2 WAT 9438 131.156 120.804 18.546 1.00 0.00 H TER 47433 WAT 9438 ATOM 47433 O WAT 9439 48.137 109.689 67.194 1.00 0.00 O ATOM 47434 H1 WAT 9439 48.334 110.624 67.140 1.00 0.00 H ATOM 47435 H2 WAT 9439 47.483 109.621 67.889 1.00 0.00 H TER 47437 WAT 9439 ATOM 47437 O WAT 9440 128.504 42.718 5.668 1.00 0.00 O ATOM 47438 H1 WAT 9440 129.246 42.566 6.253 1.00 0.00 H ATOM 47439 H2 WAT 9440 127.847 43.143 6.219 1.00 0.00 H TER 47441 WAT 9440 ATOM 47441 O WAT 9441 107.419 68.427 58.692 1.00 0.00 O ATOM 47442 H1 WAT 9441 106.822 68.305 57.954 1.00 0.00 H ATOM 47443 H2 WAT 9441 106.962 68.036 59.437 1.00 0.00 H TER 47445 WAT 9441 ATOM 47445 O WAT 9442 47.419 85.772 108.310 1.00 0.00 O ATOM 47446 H1 WAT 9442 48.173 86.305 108.057 1.00 0.00 H ATOM 47447 H2 WAT 9442 47.331 85.131 107.604 1.00 0.00 H TER 47449 WAT 9442 ATOM 47449 O WAT 9443 7.439 115.231 153.526 1.00 0.00 O ATOM 47450 H1 WAT 9443 7.063 116.091 153.716 1.00 0.00 H ATOM 47451 H2 WAT 9443 7.052 114.650 154.181 1.00 0.00 H TER 47453 WAT 9443 ATOM 47453 O WAT 9444 16.878 59.451 110.014 1.00 0.00 O ATOM 47454 H1 WAT 9444 16.009 59.614 109.645 1.00 0.00 H ATOM 47455 H2 WAT 9444 17.453 60.057 109.547 1.00 0.00 H TER 47457 WAT 9444 ATOM 47457 O WAT 9445 70.507 35.212 148.083 1.00 0.00 O ATOM 47458 H1 WAT 9445 71.262 35.456 148.618 1.00 0.00 H ATOM 47459 H2 WAT 9445 69.993 34.631 148.644 1.00 0.00 H TER 47461 WAT 9445 ATOM 47461 O WAT 9446 127.386 64.431 91.042 1.00 0.00 O ATOM 47462 H1 WAT 9446 126.987 65.164 90.574 1.00 0.00 H ATOM 47463 H2 WAT 9446 128.220 64.775 91.362 1.00 0.00 H TER 47465 WAT 9446 ATOM 47465 O WAT 9447 131.935 123.706 60.913 1.00 0.00 O ATOM 47466 H1 WAT 9447 132.380 124.279 61.537 1.00 0.00 H ATOM 47467 H2 WAT 9447 132.425 122.885 60.950 1.00 0.00 H TER 47469 WAT 9447 ATOM 47469 O WAT 9448 20.327 44.950 102.190 1.00 0.00 O ATOM 47470 H1 WAT 9448 20.572 44.074 102.486 1.00 0.00 H ATOM 47471 H2 WAT 9448 19.997 45.386 102.976 1.00 0.00 H TER 47473 WAT 9448 ATOM 47473 O WAT 9449 18.233 77.703 63.211 1.00 0.00 O ATOM 47474 H1 WAT 9449 17.654 78.444 63.390 1.00 0.00 H ATOM 47475 H2 WAT 9449 18.173 77.576 62.264 1.00 0.00 H TER 47477 WAT 9449 ATOM 47477 O WAT 9450 131.502 80.053 124.941 1.00 0.00 O ATOM 47478 H1 WAT 9450 130.954 80.114 125.723 1.00 0.00 H ATOM 47479 H2 WAT 9450 131.026 80.550 124.276 1.00 0.00 H TER 47481 WAT 9450 ATOM 47481 O WAT 9451 124.716 133.686 71.606 1.00 0.00 O ATOM 47482 H1 WAT 9451 123.956 134.043 72.066 1.00 0.00 H ATOM 47483 H2 WAT 9451 124.344 133.113 70.936 1.00 0.00 H TER 47485 WAT 9451 ATOM 47485 O WAT 9452 70.011 82.085 128.906 1.00 0.00 O ATOM 47486 H1 WAT 9452 70.076 81.273 128.403 1.00 0.00 H ATOM 47487 H2 WAT 9452 70.658 81.987 129.605 1.00 0.00 H TER 47489 WAT 9452 ATOM 47489 O WAT 9453 32.399 55.811 141.936 1.00 0.00 O ATOM 47490 H1 WAT 9453 31.802 55.936 141.199 1.00 0.00 H ATOM 47491 H2 WAT 9453 32.358 54.872 142.121 1.00 0.00 H TER 47493 WAT 9453 ATOM 47493 O WAT 9454 124.380 11.595 64.417 1.00 0.00 O ATOM 47494 H1 WAT 9454 123.818 10.859 64.661 1.00 0.00 H ATOM 47495 H2 WAT 9454 123.770 12.296 64.186 1.00 0.00 H TER 47497 WAT 9454 ATOM 47497 O WAT 9455 99.298 114.368 8.452 1.00 0.00 O ATOM 47498 H1 WAT 9455 99.418 115.316 8.488 1.00 0.00 H ATOM 47499 H2 WAT 9455 100.181 114.011 8.546 1.00 0.00 H TER 47501 WAT 9455 ATOM 47501 O WAT 9456 97.944 63.513 78.862 1.00 0.00 O ATOM 47502 H1 WAT 9456 97.676 62.983 78.111 1.00 0.00 H ATOM 47503 H2 WAT 9456 97.803 64.417 78.579 1.00 0.00 H TER 47505 WAT 9456 ATOM 47505 O WAT 9457 29.278 22.992 78.404 1.00 0.00 O ATOM 47506 H1 WAT 9457 28.512 22.783 78.938 1.00 0.00 H ATOM 47507 H2 WAT 9457 29.133 22.523 77.582 1.00 0.00 H TER 47509 WAT 9457 ATOM 47509 O WAT 9458 133.579 141.760 86.722 1.00 0.00 O ATOM 47510 H1 WAT 9458 134.090 141.921 85.929 1.00 0.00 H ATOM 47511 H2 WAT 9458 132.728 141.460 86.402 1.00 0.00 H TER 47513 WAT 9458 ATOM 47513 O WAT 9459 92.582 60.065 101.459 1.00 0.00 O ATOM 47514 H1 WAT 9459 92.645 61.014 101.349 1.00 0.00 H ATOM 47515 H2 WAT 9459 91.801 59.937 101.997 1.00 0.00 H TER 47517 WAT 9459 ATOM 47517 O WAT 9460 121.670 42.576 131.689 1.00 0.00 O ATOM 47518 H1 WAT 9460 120.862 43.008 131.966 1.00 0.00 H ATOM 47519 H2 WAT 9460 121.438 41.649 131.630 1.00 0.00 H TER 47521 WAT 9460 ATOM 47521 O WAT 9461 47.070 88.496 104.088 1.00 0.00 O ATOM 47522 H1 WAT 9461 46.567 87.852 103.589 1.00 0.00 H ATOM 47523 H2 WAT 9461 46.434 88.884 104.688 1.00 0.00 H TER 47525 WAT 9461 ATOM 47525 O WAT 9462 22.869 49.047 78.835 1.00 0.00 O ATOM 47526 H1 WAT 9462 22.398 49.371 78.068 1.00 0.00 H ATOM 47527 H2 WAT 9462 23.718 48.766 78.494 1.00 0.00 H TER 47529 WAT 9462 ATOM 47529 O WAT 9463 24.501 69.110 50.376 1.00 0.00 O ATOM 47530 H1 WAT 9463 24.436 69.974 50.781 1.00 0.00 H ATOM 47531 H2 WAT 9463 23.840 68.584 50.826 1.00 0.00 H TER 47533 WAT 9463 ATOM 47533 O WAT 9464 56.017 132.243 64.848 1.00 0.00 O ATOM 47534 H1 WAT 9464 56.943 132.419 65.013 1.00 0.00 H ATOM 47535 H2 WAT 9464 55.930 132.290 63.896 1.00 0.00 H TER 47537 WAT 9464 ATOM 47537 O WAT 9465 39.975 101.346 13.947 1.00 0.00 O ATOM 47538 H1 WAT 9465 40.862 101.608 13.702 1.00 0.00 H ATOM 47539 H2 WAT 9465 39.905 100.437 13.653 1.00 0.00 H TER 47541 WAT 9465 ATOM 47541 O WAT 9466 136.996 77.701 65.322 1.00 0.00 O ATOM 47542 H1 WAT 9466 136.380 78.332 64.948 1.00 0.00 H ATOM 47543 H2 WAT 9466 137.710 78.238 65.665 1.00 0.00 H TER 47545 WAT 9466 ATOM 47545 O WAT 9467 59.468 118.686 61.731 1.00 0.00 O ATOM 47546 H1 WAT 9467 60.141 118.300 61.171 1.00 0.00 H ATOM 47547 H2 WAT 9467 59.402 118.086 62.474 1.00 0.00 H TER 47549 WAT 9467 ATOM 47549 O WAT 9468 111.812 23.841 109.665 1.00 0.00 O ATOM 47550 H1 WAT 9468 111.023 23.990 109.143 1.00 0.00 H ATOM 47551 H2 WAT 9468 111.485 23.595 110.530 1.00 0.00 H TER 47553 WAT 9468 ATOM 47553 O WAT 9469 74.793 6.660 67.310 1.00 0.00 O ATOM 47554 H1 WAT 9469 75.272 7.248 66.726 1.00 0.00 H ATOM 47555 H2 WAT 9469 74.953 5.786 66.953 1.00 0.00 H TER 47557 WAT 9469 ATOM 47557 O WAT 9470 91.029 29.738 152.518 1.00 0.00 O ATOM 47558 H1 WAT 9470 90.540 30.408 152.995 1.00 0.00 H ATOM 47559 H2 WAT 9470 91.604 29.348 153.175 1.00 0.00 H TER 47561 WAT 9470 ATOM 47561 O WAT 9471 94.309 51.030 24.287 1.00 0.00 O ATOM 47562 H1 WAT 9471 93.696 50.410 23.892 1.00 0.00 H ATOM 47563 H2 WAT 9471 93.772 51.552 24.883 1.00 0.00 H TER 47565 WAT 9471 ATOM 47565 O WAT 9472 53.959 94.336 110.583 1.00 0.00 O ATOM 47566 H1 WAT 9472 54.209 95.072 111.142 1.00 0.00 H ATOM 47567 H2 WAT 9472 54.038 94.675 109.691 1.00 0.00 H TER 47569 WAT 9472 ATOM 47569 O WAT 9473 11.490 40.844 118.684 1.00 0.00 O ATOM 47570 H1 WAT 9473 10.637 40.578 118.340 1.00 0.00 H ATOM 47571 H2 WAT 9473 11.349 41.731 119.013 1.00 0.00 H TER 47573 WAT 9473 ATOM 47573 O WAT 9474 144.725 57.448 135.364 1.00 0.00 O ATOM 47574 H1 WAT 9474 144.119 58.187 135.316 1.00 0.00 H ATOM 47575 H2 WAT 9474 144.333 56.780 134.801 1.00 0.00 H TER 47577 WAT 9474 ATOM 47577 O WAT 9475 92.184 91.834 96.580 1.00 0.00 O ATOM 47578 H1 WAT 9475 91.473 91.683 97.203 1.00 0.00 H ATOM 47579 H2 WAT 9475 91.801 91.632 95.726 1.00 0.00 H TER 47581 WAT 9475 ATOM 47581 O WAT 9476 79.716 4.990 21.428 1.00 0.00 O ATOM 47582 H1 WAT 9476 79.542 4.219 21.968 1.00 0.00 H ATOM 47583 H2 WAT 9476 79.259 5.703 21.874 1.00 0.00 H TER 47585 WAT 9476 ATOM 47585 O WAT 9477 6.919 57.964 21.840 1.00 0.00 O ATOM 47586 H1 WAT 9477 7.873 58.043 21.811 1.00 0.00 H ATOM 47587 H2 WAT 9477 6.628 58.754 22.296 1.00 0.00 H TER 47589 WAT 9477 ATOM 47589 O WAT 9478 45.182 92.464 122.311 1.00 0.00 O ATOM 47590 H1 WAT 9478 46.040 92.155 122.020 1.00 0.00 H ATOM 47591 H2 WAT 9478 44.715 91.669 122.568 1.00 0.00 H TER 47593 WAT 9478 ATOM 47593 O WAT 9479 91.118 34.558 144.760 1.00 0.00 O ATOM 47594 H1 WAT 9479 90.215 34.583 145.077 1.00 0.00 H ATOM 47595 H2 WAT 9479 91.651 34.555 145.555 1.00 0.00 H TER 47597 WAT 9479 ATOM 47597 O WAT 9480 96.390 108.633 107.482 1.00 0.00 O ATOM 47598 H1 WAT 9480 95.600 108.355 107.946 1.00 0.00 H ATOM 47599 H2 WAT 9480 96.142 108.616 106.557 1.00 0.00 H TER 47601 WAT 9480 ATOM 47601 O WAT 9481 72.655 115.864 7.081 1.00 0.00 O ATOM 47602 H1 WAT 9481 73.136 115.447 6.366 1.00 0.00 H ATOM 47603 H2 WAT 9481 72.069 115.181 7.407 1.00 0.00 H TER 47605 WAT 9481 ATOM 47605 O WAT 9482 132.635 120.511 75.429 1.00 0.00 O ATOM 47606 H1 WAT 9482 133.203 121.046 74.875 1.00 0.00 H ATOM 47607 H2 WAT 9482 132.294 119.836 74.842 1.00 0.00 H TER 47609 WAT 9482 ATOM 47609 O WAT 9483 112.592 98.708 98.960 1.00 0.00 O ATOM 47610 H1 WAT 9483 113.232 99.399 99.131 1.00 0.00 H ATOM 47611 H2 WAT 9483 111.773 99.046 99.322 1.00 0.00 H TER 47613 WAT 9483 ATOM 47613 O WAT 9484 27.975 114.502 66.458 1.00 0.00 O ATOM 47614 H1 WAT 9484 27.912 113.692 66.965 1.00 0.00 H ATOM 47615 H2 WAT 9484 28.227 114.216 65.580 1.00 0.00 H TER 47617 WAT 9484 ATOM 47617 O WAT 9485 92.517 22.365 150.784 1.00 0.00 O ATOM 47618 H1 WAT 9485 93.098 22.070 150.082 1.00 0.00 H ATOM 47619 H2 WAT 9485 92.851 21.931 151.569 1.00 0.00 H TER 47621 WAT 9485 ATOM 47621 O WAT 9486 62.904 50.951 19.069 1.00 0.00 O ATOM 47622 H1 WAT 9486 63.070 51.111 18.140 1.00 0.00 H ATOM 47623 H2 WAT 9486 63.503 50.242 19.301 1.00 0.00 H TER 47625 WAT 9486 ATOM 47625 O WAT 9487 64.873 143.207 149.056 1.00 0.00 O ATOM 47626 H1 WAT 9487 65.311 142.585 149.637 1.00 0.00 H ATOM 47627 H2 WAT 9487 64.625 143.934 149.628 1.00 0.00 H TER 47629 WAT 9487 ATOM 47629 O WAT 9488 137.493 79.881 120.294 1.00 0.00 O ATOM 47630 H1 WAT 9488 136.554 79.786 120.455 1.00 0.00 H ATOM 47631 H2 WAT 9488 137.739 79.081 119.831 1.00 0.00 H TER 47633 WAT 9488 ATOM 47633 O WAT 9489 90.814 108.967 107.206 1.00 0.00 O ATOM 47634 H1 WAT 9489 90.282 109.718 107.466 1.00 0.00 H ATOM 47635 H2 WAT 9489 90.271 108.206 107.412 1.00 0.00 H TER 47637 WAT 9489 ATOM 47637 O WAT 9490 138.155 56.992 87.897 1.00 0.00 O ATOM 47638 H1 WAT 9490 138.584 56.270 87.437 1.00 0.00 H ATOM 47639 H2 WAT 9490 138.145 56.719 88.814 1.00 0.00 H TER 47641 WAT 9490 ATOM 47641 O WAT 9491 120.881 141.218 87.410 1.00 0.00 O ATOM 47642 H1 WAT 9491 120.431 140.564 87.945 1.00 0.00 H ATOM 47643 H2 WAT 9491 120.342 142.005 87.490 1.00 0.00 H TER 47645 WAT 9491 ATOM 47645 O WAT 9492 52.358 124.713 71.397 1.00 0.00 O ATOM 47646 H1 WAT 9492 53.163 125.185 71.610 1.00 0.00 H ATOM 47647 H2 WAT 9492 52.590 123.789 71.488 1.00 0.00 H TER 47649 WAT 9492 ATOM 47649 O WAT 9493 124.659 18.538 60.446 1.00 0.00 O ATOM 47650 H1 WAT 9493 124.214 18.355 59.618 1.00 0.00 H ATOM 47651 H2 WAT 9493 125.128 17.729 60.650 1.00 0.00 H TER 47653 WAT 9493 ATOM 47653 O WAT 9494 95.415 27.205 147.832 1.00 0.00 O ATOM 47654 H1 WAT 9494 95.158 27.209 146.910 1.00 0.00 H ATOM 47655 H2 WAT 9494 95.800 26.339 147.969 1.00 0.00 H TER 47657 WAT 9494 ATOM 47657 O WAT 9495 109.491 54.228 15.357 1.00 0.00 O ATOM 47658 H1 WAT 9495 109.949 53.476 15.732 1.00 0.00 H ATOM 47659 H2 WAT 9495 108.713 53.852 14.944 1.00 0.00 H TER 47661 WAT 9495 ATOM 47661 O WAT 9496 111.084 16.395 153.026 1.00 0.00 O ATOM 47662 H1 WAT 9496 111.027 16.182 152.095 1.00 0.00 H ATOM 47663 H2 WAT 9496 112.019 16.340 153.227 1.00 0.00 H TER 47665 WAT 9496 ATOM 47665 O WAT 9497 88.457 19.487 73.972 1.00 0.00 O ATOM 47666 H1 WAT 9497 88.158 19.673 73.082 1.00 0.00 H ATOM 47667 H2 WAT 9497 88.092 18.625 74.173 1.00 0.00 H TER 47669 WAT 9497 ATOM 47669 O WAT 9498 85.188 32.890 98.658 1.00 0.00 O ATOM 47670 H1 WAT 9498 85.614 32.339 99.314 1.00 0.00 H ATOM 47671 H2 WAT 9498 85.353 32.444 97.827 1.00 0.00 H TER 47673 WAT 9498 ATOM 47673 O WAT 9499 69.022 22.623 100.676 1.00 0.00 O ATOM 47674 H1 WAT 9499 68.139 22.376 100.950 1.00 0.00 H ATOM 47675 H2 WAT 9499 68.910 23.468 100.240 1.00 0.00 H TER 47677 WAT 9499 ATOM 47677 O WAT 9500 78.132 52.248 141.598 1.00 0.00 O ATOM 47678 H1 WAT 9500 78.279 52.916 142.268 1.00 0.00 H ATOM 47679 H2 WAT 9500 77.795 51.494 142.081 1.00 0.00 H TER 47681 WAT 9500 ATOM 47681 O WAT 9501 117.415 141.375 15.802 1.00 0.00 O ATOM 47682 H1 WAT 9501 116.623 141.677 15.357 1.00 0.00 H ATOM 47683 H2 WAT 9501 117.409 140.425 15.681 1.00 0.00 H TER 47685 WAT 9501 ATOM 47685 O WAT 9502 143.925 37.246 130.269 1.00 0.00 O ATOM 47686 H1 WAT 9502 144.496 37.957 130.560 1.00 0.00 H ATOM 47687 H2 WAT 9502 143.983 37.268 129.313 1.00 0.00 H TER 47689 WAT 9502 ATOM 47689 O WAT 9503 136.277 130.575 62.256 1.00 0.00 O ATOM 47690 H1 WAT 9503 135.331 130.471 62.354 1.00 0.00 H ATOM 47691 H2 WAT 9503 136.620 129.681 62.277 1.00 0.00 H TER 47693 WAT 9503 ATOM 47693 O WAT 9504 11.878 108.102 70.728 1.00 0.00 O ATOM 47694 H1 WAT 9504 11.444 108.781 70.213 1.00 0.00 H ATOM 47695 H2 WAT 9504 11.820 108.413 71.632 1.00 0.00 H TER 47697 WAT 9504 ATOM 47697 O WAT 9505 62.857 101.632 112.729 1.00 0.00 O ATOM 47698 H1 WAT 9505 63.691 101.310 112.386 1.00 0.00 H ATOM 47699 H2 WAT 9505 63.068 102.485 113.108 1.00 0.00 H TER 47701 WAT 9505 ATOM 47701 O WAT 9506 121.643 62.113 140.851 1.00 0.00 O ATOM 47702 H1 WAT 9506 121.798 61.204 141.110 1.00 0.00 H ATOM 47703 H2 WAT 9506 120.690 62.199 140.840 1.00 0.00 H TER 47705 WAT 9506 ATOM 47705 O WAT 9507 112.920 129.427 96.777 1.00 0.00 O ATOM 47706 H1 WAT 9507 113.418 130.226 96.604 1.00 0.00 H ATOM 47707 H2 WAT 9507 113.134 129.202 97.683 1.00 0.00 H TER 47709 WAT 9507 ATOM 47709 O WAT 9508 11.856 38.152 143.040 1.00 0.00 O ATOM 47710 H1 WAT 9508 12.527 37.613 143.459 1.00 0.00 H ATOM 47711 H2 WAT 9508 11.232 37.521 142.680 1.00 0.00 H TER 47713 WAT 9508 ATOM 47713 O WAT 9509 58.286 53.434 60.070 1.00 0.00 O ATOM 47714 H1 WAT 9509 59.065 53.242 59.547 1.00 0.00 H ATOM 47715 H2 WAT 9509 58.618 53.923 60.822 1.00 0.00 H TER 47717 WAT 9509 ATOM 47717 O WAT 9510 103.283 94.145 138.969 1.00 0.00 O ATOM 47718 H1 WAT 9510 102.541 93.541 138.977 1.00 0.00 H ATOM 47719 H2 WAT 9510 104.026 93.616 139.258 1.00 0.00 H TER 47721 WAT 9510 ATOM 47721 O WAT 9511 62.552 75.908 93.772 1.00 0.00 O ATOM 47722 H1 WAT 9511 63.004 75.726 94.595 1.00 0.00 H ATOM 47723 H2 WAT 9511 61.701 76.258 94.038 1.00 0.00 H TER 47725 WAT 9511 ATOM 47725 O WAT 9512 128.271 26.182 66.821 1.00 0.00 O ATOM 47726 H1 WAT 9512 127.516 26.057 66.246 1.00 0.00 H ATOM 47727 H2 WAT 9512 128.047 25.702 67.619 1.00 0.00 H TER 47729 WAT 9512 ATOM 47729 O WAT 9513 90.359 138.529 143.758 1.00 0.00 O ATOM 47730 H1 WAT 9513 90.469 139.408 143.396 1.00 0.00 H ATOM 47731 H2 WAT 9513 91.241 138.266 144.022 1.00 0.00 H TER 47733 WAT 9513 ATOM 47733 O WAT 9514 36.649 111.230 119.195 1.00 0.00 O ATOM 47734 H1 WAT 9514 36.113 110.497 119.497 1.00 0.00 H ATOM 47735 H2 WAT 9514 36.031 111.954 119.095 1.00 0.00 H TER 47737 WAT 9514 ATOM 47737 O WAT 9515 37.854 114.380 113.646 1.00 0.00 O ATOM 47738 H1 WAT 9515 37.720 114.604 112.725 1.00 0.00 H ATOM 47739 H2 WAT 9515 37.264 114.963 114.122 1.00 0.00 H TER 47741 WAT 9515 ATOM 47741 O WAT 9516 64.912 106.923 11.280 1.00 0.00 O ATOM 47742 H1 WAT 9516 65.467 106.809 12.052 1.00 0.00 H ATOM 47743 H2 WAT 9516 64.027 107.015 11.632 1.00 0.00 H TER 47745 WAT 9516 ATOM 47745 O WAT 9517 109.259 56.079 126.744 1.00 0.00 O ATOM 47746 H1 WAT 9517 108.741 55.434 127.226 1.00 0.00 H ATOM 47747 H2 WAT 9517 108.794 56.905 126.873 1.00 0.00 H TER 47749 WAT 9517 ATOM 47749 O WAT 9518 116.994 100.349 72.783 1.00 0.00 O ATOM 47750 H1 WAT 9518 116.205 100.872 72.640 1.00 0.00 H ATOM 47751 H2 WAT 9518 116.684 99.444 72.781 1.00 0.00 H TER 47753 WAT 9518 ATOM 47753 O WAT 9519 0.670 29.781 103.677 1.00 0.00 O ATOM 47754 H1 WAT 9519 1.458 30.255 103.410 1.00 0.00 H ATOM 47755 H2 WAT 9519 -0.048 30.384 103.489 1.00 0.00 H TER 47757 WAT 9519 ATOM 47757 O WAT 9520 9.774 4.582 80.727 1.00 0.00 O ATOM 47758 H1 WAT 9520 9.975 3.727 80.347 1.00 0.00 H ATOM 47759 H2 WAT 9520 10.208 5.209 80.149 1.00 0.00 H TER 47761 WAT 9520 ATOM 47761 O WAT 9521 45.075 26.442 10.712 1.00 0.00 O ATOM 47762 H1 WAT 9521 44.926 27.367 10.515 1.00 0.00 H ATOM 47763 H2 WAT 9521 44.798 25.981 9.921 1.00 0.00 H TER 47765 WAT 9521 ATOM 47765 O WAT 9522 47.302 100.069 69.831 1.00 0.00 O ATOM 47766 H1 WAT 9522 48.209 99.921 70.099 1.00 0.00 H ATOM 47767 H2 WAT 9522 47.271 99.775 68.920 1.00 0.00 H TER 47769 WAT 9522 ATOM 47769 O WAT 9523 19.461 96.845 95.625 1.00 0.00 O ATOM 47770 H1 WAT 9523 19.777 97.575 96.158 1.00 0.00 H ATOM 47771 H2 WAT 9523 18.510 96.861 95.737 1.00 0.00 H TER 47773 WAT 9523 ATOM 47773 O WAT 9524 1.062 74.859 145.118 1.00 0.00 O ATOM 47774 H1 WAT 9524 1.117 75.780 144.862 1.00 0.00 H ATOM 47775 H2 WAT 9524 1.959 74.535 145.036 1.00 0.00 H TER 47777 WAT 9524 ATOM 47777 O WAT 9525 118.206 89.628 64.259 1.00 0.00 O ATOM 47778 H1 WAT 9525 118.473 90.542 64.161 1.00 0.00 H ATOM 47779 H2 WAT 9525 118.534 89.374 65.121 1.00 0.00 H TER 47781 WAT 9525 ATOM 47781 O WAT 9526 119.995 84.818 16.665 1.00 0.00 O ATOM 47782 H1 WAT 9526 120.805 84.326 16.532 1.00 0.00 H ATOM 47783 H2 WAT 9526 119.665 84.980 15.781 1.00 0.00 H TER 47785 WAT 9526 ATOM 47785 O WAT 9527 10.018 97.202 116.971 1.00 0.00 O ATOM 47786 H1 WAT 9527 10.187 96.636 117.724 1.00 0.00 H ATOM 47787 H2 WAT 9527 10.728 97.007 116.360 1.00 0.00 H TER 47789 WAT 9527 ATOM 47789 O WAT 9528 29.924 10.795 122.031 1.00 0.00 O ATOM 47790 H1 WAT 9528 29.089 10.408 121.766 1.00 0.00 H ATOM 47791 H2 WAT 9528 30.014 10.560 122.954 1.00 0.00 H TER 47793 WAT 9528 ATOM 47793 O WAT 9529 52.872 77.028 101.189 1.00 0.00 O ATOM 47794 H1 WAT 9529 52.717 76.593 102.028 1.00 0.00 H ATOM 47795 H2 WAT 9529 53.784 77.315 101.233 1.00 0.00 H TER 47797 WAT 9529 ATOM 47797 O WAT 9530 15.720 32.499 81.399 1.00 0.00 O ATOM 47798 H1 WAT 9530 16.557 32.603 81.852 1.00 0.00 H ATOM 47799 H2 WAT 9530 15.960 32.284 80.498 1.00 0.00 H TER 47801 WAT 9530 ATOM 47801 O WAT 9531 9.613 58.116 21.450 1.00 0.00 O ATOM 47802 H1 WAT 9531 9.748 59.037 21.228 1.00 0.00 H ATOM 47803 H2 WAT 9531 10.134 57.636 20.807 1.00 0.00 H TER 47805 WAT 9531 ATOM 47805 O WAT 9532 80.012 114.983 101.783 1.00 0.00 O ATOM 47806 H1 WAT 9532 80.496 115.712 101.395 1.00 0.00 H ATOM 47807 H2 WAT 9532 79.107 115.293 101.826 1.00 0.00 H TER 47809 WAT 9532 ATOM 47809 O WAT 9533 81.663 35.595 109.659 1.00 0.00 O ATOM 47810 H1 WAT 9533 82.021 35.275 110.487 1.00 0.00 H ATOM 47811 H2 WAT 9533 80.744 35.782 109.852 1.00 0.00 H TER 47813 WAT 9533 ATOM 47813 O WAT 9534 77.329 15.110 147.209 1.00 0.00 O ATOM 47814 H1 WAT 9534 78.020 15.315 146.579 1.00 0.00 H ATOM 47815 H2 WAT 9534 76.672 14.636 146.698 1.00 0.00 H TER 47817 WAT 9534 ATOM 47817 O WAT 9535 10.420 28.412 21.562 1.00 0.00 O ATOM 47818 H1 WAT 9535 9.682 28.641 22.127 1.00 0.00 H ATOM 47819 H2 WAT 9535 10.992 29.179 21.592 1.00 0.00 H TER 47821 WAT 9535 ATOM 47821 O WAT 9536 48.608 90.439 108.192 1.00 0.00 O ATOM 47822 H1 WAT 9536 48.939 90.204 107.324 1.00 0.00 H ATOM 47823 H2 WAT 9536 49.356 90.313 108.775 1.00 0.00 H TER 47825 WAT 9536 ATOM 47825 O WAT 9537 106.823 64.743 115.308 1.00 0.00 O ATOM 47826 H1 WAT 9537 106.206 64.764 114.576 1.00 0.00 H ATOM 47827 H2 WAT 9537 107.261 63.896 115.228 1.00 0.00 H TER 47829 WAT 9537 ATOM 47829 O WAT 9538 76.198 18.585 13.227 1.00 0.00 O ATOM 47830 H1 WAT 9538 75.392 18.837 12.777 1.00 0.00 H ATOM 47831 H2 WAT 9538 76.622 19.416 13.441 1.00 0.00 H TER 47833 WAT 9538 ATOM 47833 O WAT 9539 0.083 3.368 131.331 1.00 0.00 O ATOM 47834 H1 WAT 9539 0.324 3.935 130.598 1.00 0.00 H ATOM 47835 H2 WAT 9539 -0.330 2.608 130.920 1.00 0.00 H TER 47837 WAT 9539 ATOM 47837 O WAT 9540 130.711 95.445 144.401 1.00 0.00 O ATOM 47838 H1 WAT 9540 130.845 95.469 145.348 1.00 0.00 H ATOM 47839 H2 WAT 9540 130.633 94.514 144.194 1.00 0.00 H TER 47841 WAT 9540 ATOM 47841 O WAT 9541 117.023 78.272 85.892 1.00 0.00 O ATOM 47842 H1 WAT 9541 117.822 78.422 86.397 1.00 0.00 H ATOM 47843 H2 WAT 9541 117.280 77.644 85.217 1.00 0.00 H TER 47845 WAT 9541 ATOM 47845 O WAT 9542 51.108 13.238 143.774 1.00 0.00 O ATOM 47846 H1 WAT 9542 50.468 12.814 144.345 1.00 0.00 H ATOM 47847 H2 WAT 9542 51.132 14.147 144.074 1.00 0.00 H TER 47849 WAT 9542 ATOM 47849 O WAT 9543 37.082 87.610 103.399 1.00 0.00 O ATOM 47850 H1 WAT 9543 36.716 87.179 102.627 1.00 0.00 H ATOM 47851 H2 WAT 9543 36.950 86.983 104.109 1.00 0.00 H TER 47853 WAT 9543 ATOM 47853 O WAT 9544 132.786 106.648 76.097 1.00 0.00 O ATOM 47854 H1 WAT 9544 131.913 106.287 76.255 1.00 0.00 H ATOM 47855 H2 WAT 9544 133.339 105.881 75.949 1.00 0.00 H TER 47857 WAT 9544 ATOM 47857 O WAT 9545 76.730 82.219 117.191 1.00 0.00 O ATOM 47858 H1 WAT 9545 76.443 82.220 116.277 1.00 0.00 H ATOM 47859 H2 WAT 9545 77.611 82.593 117.166 1.00 0.00 H TER 47861 WAT 9545 ATOM 47861 O WAT 9546 105.355 8.788 100.621 1.00 0.00 O ATOM 47862 H1 WAT 9546 104.555 9.251 100.376 1.00 0.00 H ATOM 47863 H2 WAT 9546 105.158 8.403 101.475 1.00 0.00 H TER 47865 WAT 9546 ATOM 47865 O WAT 9547 5.982 62.623 147.026 1.00 0.00 O ATOM 47866 H1 WAT 9547 5.107 62.393 146.713 1.00 0.00 H ATOM 47867 H2 WAT 9547 6.409 63.024 146.269 1.00 0.00 H TER 47869 WAT 9547 ATOM 47869 O WAT 9548 126.784 17.356 110.388 1.00 0.00 O ATOM 47870 H1 WAT 9548 126.999 16.485 110.722 1.00 0.00 H ATOM 47871 H2 WAT 9548 127.015 17.320 109.460 1.00 0.00 H TER 47873 WAT 9548 ATOM 47873 O WAT 9549 60.592 132.342 114.435 1.00 0.00 O ATOM 47874 H1 WAT 9549 59.747 131.975 114.175 1.00 0.00 H ATOM 47875 H2 WAT 9549 61.218 131.634 114.283 1.00 0.00 H TER 47877 WAT 9549 ATOM 47877 O WAT 9550 130.641 64.268 15.820 1.00 0.00 O ATOM 47878 H1 WAT 9550 130.615 64.783 16.627 1.00 0.00 H ATOM 47879 H2 WAT 9550 131.387 63.679 15.936 1.00 0.00 H TER 47881 WAT 9550 ATOM 47881 O WAT 9551 24.726 34.227 84.755 1.00 0.00 O ATOM 47882 H1 WAT 9551 24.235 33.498 84.376 1.00 0.00 H ATOM 47883 H2 WAT 9551 25.567 33.844 85.006 1.00 0.00 H TER 47885 WAT 9551 ATOM 47885 O WAT 9552 122.812 55.959 110.107 1.00 0.00 O ATOM 47886 H1 WAT 9552 121.934 56.279 109.900 1.00 0.00 H ATOM 47887 H2 WAT 9552 122.776 55.022 109.916 1.00 0.00 H TER 47889 WAT 9552 ATOM 47889 O WAT 9553 99.477 32.781 133.099 1.00 0.00 O ATOM 47890 H1 WAT 9553 99.624 32.792 132.153 1.00 0.00 H ATOM 47891 H2 WAT 9553 99.330 33.699 133.329 1.00 0.00 H TER 47893 WAT 9553 ATOM 47893 O WAT 9554 29.285 5.994 10.535 1.00 0.00 O ATOM 47894 H1 WAT 9554 28.487 6.280 10.980 1.00 0.00 H ATOM 47895 H2 WAT 9554 29.994 6.258 11.122 1.00 0.00 H TER 47897 WAT 9554 ATOM 47897 O WAT 9555 128.229 6.158 140.712 1.00 0.00 O ATOM 47898 H1 WAT 9555 128.304 5.455 140.066 1.00 0.00 H ATOM 47899 H2 WAT 9555 129.026 6.087 141.237 1.00 0.00 H TER 47901 WAT 9555 ATOM 47901 O WAT 9556 30.691 22.413 85.553 1.00 0.00 O ATOM 47902 H1 WAT 9556 31.199 21.762 86.037 1.00 0.00 H ATOM 47903 H2 WAT 9556 30.595 23.144 86.164 1.00 0.00 H TER 47905 WAT 9556 ATOM 47905 O WAT 9557 104.042 90.043 140.664 1.00 0.00 O ATOM 47906 H1 WAT 9557 104.921 89.672 140.737 1.00 0.00 H ATOM 47907 H2 WAT 9557 103.906 90.501 141.494 1.00 0.00 H TER 47909 WAT 9557 ATOM 47909 O WAT 9558 132.022 103.582 60.530 1.00 0.00 O ATOM 47910 H1 WAT 9558 132.522 102.832 60.209 1.00 0.00 H ATOM 47911 H2 WAT 9558 132.454 104.343 60.143 1.00 0.00 H TER 47913 WAT 9558 ATOM 47913 O WAT 9559 72.929 32.449 123.484 1.00 0.00 O ATOM 47914 H1 WAT 9559 72.673 32.048 124.315 1.00 0.00 H ATOM 47915 H2 WAT 9559 73.729 32.933 123.688 1.00 0.00 H TER 47917 WAT 9559 ATOM 47917 O WAT 9560 93.236 12.007 153.924 1.00 0.00 O ATOM 47918 H1 WAT 9560 92.842 11.361 153.339 1.00 0.00 H ATOM 47919 H2 WAT 9560 93.826 12.510 153.364 1.00 0.00 H TER 47921 WAT 9560 ATOM 47921 O WAT 9561 9.998 50.212 153.541 1.00 0.00 O ATOM 47922 H1 WAT 9561 9.710 49.349 153.244 1.00 0.00 H ATOM 47923 H2 WAT 9561 10.522 50.552 152.816 1.00 0.00 H TER 47925 WAT 9561 ATOM 47925 O WAT 9562 120.324 85.653 81.542 1.00 0.00 O ATOM 47926 H1 WAT 9562 120.011 86.407 81.042 1.00 0.00 H ATOM 47927 H2 WAT 9562 121.235 85.545 81.268 1.00 0.00 H TER 47929 WAT 9562 ATOM 47929 O WAT 9563 42.273 15.709 126.892 1.00 0.00 O ATOM 47930 H1 WAT 9563 42.662 15.092 127.512 1.00 0.00 H ATOM 47931 H2 WAT 9563 42.334 16.559 127.329 1.00 0.00 H TER 47933 WAT 9563 ATOM 47933 O WAT 9564 111.959 105.011 157.123 1.00 0.00 O ATOM 47934 H1 WAT 9564 111.844 105.932 157.358 1.00 0.00 H ATOM 47935 H2 WAT 9564 112.240 104.590 157.936 1.00 0.00 H TER 47937 WAT 9564 ATOM 47937 O WAT 9565 70.734 83.152 95.550 1.00 0.00 O ATOM 47938 H1 WAT 9565 70.245 83.857 95.974 1.00 0.00 H ATOM 47939 H2 WAT 9565 71.647 83.319 95.785 1.00 0.00 H TER 47941 WAT 9565 ATOM 47941 O WAT 9566 105.939 83.838 127.710 1.00 0.00 O ATOM 47942 H1 WAT 9566 106.620 84.334 128.165 1.00 0.00 H ATOM 47943 H2 WAT 9566 106.356 83.005 127.490 1.00 0.00 H TER 47945 WAT 9566 ATOM 47945 O WAT 9567 12.864 52.667 63.969 1.00 0.00 O ATOM 47946 H1 WAT 9567 13.656 52.130 63.991 1.00 0.00 H ATOM 47947 H2 WAT 9567 12.888 53.163 64.787 1.00 0.00 H TER 47949 WAT 9567 ATOM 47949 O WAT 9568 24.089 52.895 91.090 1.00 0.00 O ATOM 47950 H1 WAT 9568 23.751 53.790 91.111 1.00 0.00 H ATOM 47951 H2 WAT 9568 23.896 52.546 91.960 1.00 0.00 H TER 47953 WAT 9568 ATOM 47953 O WAT 9569 67.707 133.850 8.995 1.00 0.00 O ATOM 47954 H1 WAT 9569 68.235 134.633 8.841 1.00 0.00 H ATOM 47955 H2 WAT 9569 68.120 133.426 9.747 1.00 0.00 H TER 47957 WAT 9569 ATOM 47957 O WAT 9570 44.799 10.382 22.541 1.00 0.00 O ATOM 47958 H1 WAT 9570 44.031 10.036 22.087 1.00 0.00 H ATOM 47959 H2 WAT 9570 44.439 10.871 23.281 1.00 0.00 H TER 47961 WAT 9570 ATOM 47961 O WAT 9571 57.034 32.849 118.681 1.00 0.00 O ATOM 47962 H1 WAT 9571 56.866 32.834 119.623 1.00 0.00 H ATOM 47963 H2 WAT 9571 57.129 33.777 118.469 1.00 0.00 H TER 47965 WAT 9571 ATOM 47965 O WAT 9572 24.715 142.368 136.399 1.00 0.00 O ATOM 47966 H1 WAT 9572 25.169 141.668 136.869 1.00 0.00 H ATOM 47967 H2 WAT 9572 24.904 143.158 136.905 1.00 0.00 H TER 47969 WAT 9572 ATOM 47969 O WAT 9573 16.639 62.692 112.174 1.00 0.00 O ATOM 47970 H1 WAT 9573 17.190 63.020 112.884 1.00 0.00 H ATOM 47971 H2 WAT 9573 16.586 61.749 112.328 1.00 0.00 H TER 47973 WAT 9573 ATOM 47973 O WAT 9574 96.568 118.828 130.821 1.00 0.00 O ATOM 47974 H1 WAT 9574 97.119 118.471 131.518 1.00 0.00 H ATOM 47975 H2 WAT 9574 95.940 118.131 130.633 1.00 0.00 H TER 47977 WAT 9574 ATOM 47977 O WAT 9575 95.442 58.035 74.651 1.00 0.00 O ATOM 47978 H1 WAT 9575 94.668 57.481 74.549 1.00 0.00 H ATOM 47979 H2 WAT 9575 95.838 57.745 75.472 1.00 0.00 H TER 47981 WAT 9575 ATOM 47981 O WAT 9576 72.357 24.552 121.258 1.00 0.00 O ATOM 47982 H1 WAT 9576 72.510 23.740 120.776 1.00 0.00 H ATOM 47983 H2 WAT 9576 71.715 25.027 120.730 1.00 0.00 H TER 47985 WAT 9576 ATOM 47985 O WAT 9577 67.345 37.342 155.647 1.00 0.00 O ATOM 47986 H1 WAT 9577 67.428 36.418 155.412 1.00 0.00 H ATOM 47987 H2 WAT 9577 66.404 37.479 155.755 1.00 0.00 H TER 47989 WAT 9577 ATOM 47989 O WAT 9578 96.970 61.713 127.129 1.00 0.00 O ATOM 47990 H1 WAT 9578 96.968 60.762 127.017 1.00 0.00 H ATOM 47991 H2 WAT 9578 97.650 61.876 127.782 1.00 0.00 H TER 47993 WAT 9578 ATOM 47993 O WAT 9579 129.331 2.596 93.111 1.00 0.00 O ATOM 47994 H1 WAT 9579 128.793 1.834 93.325 1.00 0.00 H ATOM 47995 H2 WAT 9579 129.987 2.262 92.499 1.00 0.00 H TER 47997 WAT 9579 ATOM 47997 O WAT 9580 81.227 96.209 105.832 1.00 0.00 O ATOM 47998 H1 WAT 9580 81.621 96.130 104.963 1.00 0.00 H ATOM 47999 H2 WAT 9580 80.285 96.163 105.672 1.00 0.00 H TER 48001 WAT 9580 ATOM 48001 O WAT 9581 104.675 24.237 58.622 1.00 0.00 O ATOM 48002 H1 WAT 9581 104.099 23.495 58.442 1.00 0.00 H ATOM 48003 H2 WAT 9581 104.080 24.969 58.785 1.00 0.00 H TER 48005 WAT 9581 ATOM 48005 O WAT 9582 82.694 133.268 80.466 1.00 0.00 O ATOM 48006 H1 WAT 9582 82.791 134.116 80.900 1.00 0.00 H ATOM 48007 H2 WAT 9582 82.602 133.482 79.538 1.00 0.00 H TER 48009 WAT 9582 ATOM 48009 O WAT 9583 24.801 47.887 152.200 1.00 0.00 O ATOM 48010 H1 WAT 9583 23.992 47.569 152.600 1.00 0.00 H ATOM 48011 H2 WAT 9583 25.456 47.227 152.427 1.00 0.00 H TER 48013 WAT 9583 ATOM 48013 O WAT 9584 24.512 78.836 90.190 1.00 0.00 O ATOM 48014 H1 WAT 9584 25.137 79.560 90.149 1.00 0.00 H ATOM 48015 H2 WAT 9584 24.085 78.839 89.333 1.00 0.00 H TER 48017 WAT 9584 ATOM 48017 O WAT 9585 145.429 118.935 75.014 1.00 0.00 O ATOM 48018 H1 WAT 9585 144.731 119.388 75.488 1.00 0.00 H ATOM 48019 H2 WAT 9585 146.234 119.211 75.451 1.00 0.00 H TER 48021 WAT 9585 ATOM 48021 O WAT 9586 69.662 39.393 63.404 1.00 0.00 O ATOM 48022 H1 WAT 9586 69.353 39.887 62.645 1.00 0.00 H ATOM 48023 H2 WAT 9586 70.576 39.656 63.506 1.00 0.00 H TER 48025 WAT 9586 ATOM 48025 O WAT 9587 10.694 127.169 107.448 1.00 0.00 O ATOM 48026 H1 WAT 9587 11.564 126.905 107.749 1.00 0.00 H ATOM 48027 H2 WAT 9587 10.761 128.115 107.323 1.00 0.00 H TER 48029 WAT 9587 ATOM 48029 O WAT 9588 70.728 4.888 79.873 1.00 0.00 O ATOM 48030 H1 WAT 9588 70.366 5.769 79.969 1.00 0.00 H ATOM 48031 H2 WAT 9588 70.082 4.420 79.344 1.00 0.00 H TER 48033 WAT 9588 ATOM 48033 O WAT 9589 102.454 116.732 70.498 1.00 0.00 O ATOM 48034 H1 WAT 9589 102.426 116.697 71.454 1.00 0.00 H ATOM 48035 H2 WAT 9589 101.684 117.246 70.254 1.00 0.00 H TER 48037 WAT 9589 ATOM 48037 O WAT 9590 124.307 18.711 63.346 1.00 0.00 O ATOM 48038 H1 WAT 9590 125.018 18.652 63.984 1.00 0.00 H ATOM 48039 H2 WAT 9590 124.730 18.559 62.501 1.00 0.00 H TER 48041 WAT 9590 ATOM 48041 O WAT 9591 98.794 60.281 82.244 1.00 0.00 O ATOM 48042 H1 WAT 9591 98.153 60.294 81.533 1.00 0.00 H ATOM 48043 H2 WAT 9591 99.177 61.158 82.238 1.00 0.00 H TER 48045 WAT 9591 ATOM 48045 O WAT 9592 47.863 52.446 111.574 1.00 0.00 O ATOM 48046 H1 WAT 9592 47.817 51.981 112.409 1.00 0.00 H ATOM 48047 H2 WAT 9592 48.084 53.346 111.813 1.00 0.00 H TER 48049 WAT 9592 ATOM 48049 O WAT 9593 17.039 48.585 107.514 1.00 0.00 O ATOM 48050 H1 WAT 9593 17.954 48.825 107.364 1.00 0.00 H ATOM 48051 H2 WAT 9593 16.740 49.190 108.192 1.00 0.00 H TER 48053 WAT 9593 ATOM 48053 O WAT 9594 20.743 71.288 57.777 1.00 0.00 O ATOM 48054 H1 WAT 9594 20.858 70.339 57.722 1.00 0.00 H ATOM 48055 H2 WAT 9594 20.252 71.516 56.988 1.00 0.00 H TER 48057 WAT 9594 ATOM 48057 O WAT 9595 43.337 87.606 140.600 1.00 0.00 O ATOM 48058 H1 WAT 9595 42.872 86.769 140.608 1.00 0.00 H ATOM 48059 H2 WAT 9595 42.777 88.186 140.085 1.00 0.00 H TER 48061 WAT 9595 ATOM 48061 O WAT 9596 107.140 136.797 137.154 1.00 0.00 O ATOM 48062 H1 WAT 9596 107.259 137.267 137.980 1.00 0.00 H ATOM 48063 H2 WAT 9596 107.325 135.883 137.369 1.00 0.00 H TER 48065 WAT 9596 ATOM 48065 O WAT 9597 93.489 111.791 105.162 1.00 0.00 O ATOM 48066 H1 WAT 9597 93.348 110.948 105.592 1.00 0.00 H ATOM 48067 H2 WAT 9597 94.167 112.216 105.687 1.00 0.00 H TER 48069 WAT 9597 ATOM 48069 O WAT 9598 10.073 112.679 17.107 1.00 0.00 O ATOM 48070 H1 WAT 9598 9.562 113.206 16.493 1.00 0.00 H ATOM 48071 H2 WAT 9598 9.884 113.059 17.965 1.00 0.00 H TER 48073 WAT 9598 ATOM 48073 O WAT 9599 138.438 100.787 124.232 1.00 0.00 O ATOM 48074 H1 WAT 9599 139.280 100.528 124.604 1.00 0.00 H ATOM 48075 H2 WAT 9599 138.164 101.538 124.759 1.00 0.00 H TER 48077 WAT 9599 ATOM 48077 O WAT 9600 131.646 122.778 76.773 1.00 0.00 O ATOM 48078 H1 WAT 9600 132.233 123.530 76.691 1.00 0.00 H ATOM 48079 H2 WAT 9600 132.176 122.029 76.500 1.00 0.00 H TER 48081 WAT 9600 ATOM 48081 O WAT 9601 99.385 91.961 128.028 1.00 0.00 O ATOM 48082 H1 WAT 9601 99.617 91.723 127.130 1.00 0.00 H ATOM 48083 H2 WAT 9601 99.298 92.914 128.007 1.00 0.00 H TER 48085 WAT 9601 ATOM 48085 O WAT 9602 101.374 61.681 79.380 1.00 0.00 O ATOM 48086 H1 WAT 9602 100.677 62.178 78.951 1.00 0.00 H ATOM 48087 H2 WAT 9602 102.006 62.345 79.657 1.00 0.00 H TER 48089 WAT 9602 ATOM 48089 O WAT 9603 139.049 76.713 106.753 1.00 0.00 O ATOM 48090 H1 WAT 9603 138.430 77.431 106.890 1.00 0.00 H ATOM 48091 H2 WAT 9603 138.498 75.936 106.663 1.00 0.00 H TER 48093 WAT 9603 ATOM 48093 O WAT 9604 53.786 16.427 115.742 1.00 0.00 O ATOM 48094 H1 WAT 9604 54.466 16.255 116.393 1.00 0.00 H ATOM 48095 H2 WAT 9604 53.791 17.378 115.636 1.00 0.00 H TER 48097 WAT 9604 ATOM 48097 O WAT 9605 29.208 128.162 143.617 1.00 0.00 O ATOM 48098 H1 WAT 9605 29.558 127.364 143.221 1.00 0.00 H ATOM 48099 H2 WAT 9605 29.385 128.847 142.972 1.00 0.00 H TER 48101 WAT 9605 ATOM 48101 O WAT 9606 90.616 48.061 103.280 1.00 0.00 O ATOM 48102 H1 WAT 9606 90.882 47.565 102.506 1.00 0.00 H ATOM 48103 H2 WAT 9606 90.742 48.977 103.033 1.00 0.00 H TER 48105 WAT 9606 ATOM 48105 O WAT 9607 19.122 130.002 149.250 1.00 0.00 O ATOM 48106 H1 WAT 9607 19.242 129.341 148.568 1.00 0.00 H ATOM 48107 H2 WAT 9607 18.194 129.948 149.476 1.00 0.00 H TER 48109 WAT 9607 ATOM 48109 O WAT 9608 53.462 33.446 151.258 1.00 0.00 O ATOM 48110 H1 WAT 9608 53.358 33.835 150.389 1.00 0.00 H ATOM 48111 H2 WAT 9608 54.299 32.984 151.214 1.00 0.00 H TER 48113 WAT 9608 ATOM 48113 O WAT 9609 6.472 82.365 14.553 1.00 0.00 O ATOM 48114 H1 WAT 9609 5.843 81.809 15.011 1.00 0.00 H ATOM 48115 H2 WAT 9609 5.988 83.170 14.365 1.00 0.00 H TER 48117 WAT 9609 ATOM 48117 O WAT 9610 88.889 9.360 116.779 1.00 0.00 O ATOM 48118 H1 WAT 9610 89.741 8.954 116.619 1.00 0.00 H ATOM 48119 H2 WAT 9610 88.998 9.829 117.606 1.00 0.00 H TER 48121 WAT 9610 ATOM 48121 O WAT 9611 38.904 88.139 150.521 1.00 0.00 O ATOM 48122 H1 WAT 9611 38.908 87.426 149.882 1.00 0.00 H ATOM 48123 H2 WAT 9611 38.234 88.743 150.201 1.00 0.00 H TER 48125 WAT 9611 ATOM 48125 O WAT 9612 42.537 -0.259 95.167 1.00 0.00 O ATOM 48126 H1 WAT 9612 41.964 -0.040 95.901 1.00 0.00 H ATOM 48127 H2 WAT 9612 43.182 0.449 95.148 1.00 0.00 H TER 48129 WAT 9612 ATOM 48129 O WAT 9613 98.048 136.471 142.958 1.00 0.00 O ATOM 48130 H1 WAT 9613 98.256 136.201 143.852 1.00 0.00 H ATOM 48131 H2 WAT 9613 98.893 136.480 142.508 1.00 0.00 H TER 48133 WAT 9613 ATOM 48133 O WAT 9614 30.430 36.905 7.453 1.00 0.00 O ATOM 48134 H1 WAT 9614 29.566 37.271 7.264 1.00 0.00 H ATOM 48135 H2 WAT 9614 30.389 36.008 7.119 1.00 0.00 H TER 48137 WAT 9614 ATOM 48137 O WAT 9615 13.080 104.135 130.003 1.00 0.00 O ATOM 48138 H1 WAT 9615 14.016 104.028 129.836 1.00 0.00 H ATOM 48139 H2 WAT 9615 12.970 105.073 130.158 1.00 0.00 H TER 48141 WAT 9615 ATOM 48141 O WAT 9616 136.861 35.859 81.452 1.00 0.00 O ATOM 48142 H1 WAT 9616 137.562 36.228 81.989 1.00 0.00 H ATOM 48143 H2 WAT 9616 137.063 34.925 81.403 1.00 0.00 H TER 48145 WAT 9616 ATOM 48145 O WAT 9617 32.316 92.297 18.273 1.00 0.00 O ATOM 48146 H1 WAT 9617 32.974 92.635 18.881 1.00 0.00 H ATOM 48147 H2 WAT 9617 32.785 92.194 17.445 1.00 0.00 H TER 48149 WAT 9617 ATOM 48149 O WAT 9618 18.450 96.715 151.646 1.00 0.00 O ATOM 48150 H1 WAT 9618 18.534 95.902 152.146 1.00 0.00 H ATOM 48151 H2 WAT 9618 18.987 97.346 152.124 1.00 0.00 H TER 48153 WAT 9618 ATOM 48153 O WAT 9619 2.460 30.963 74.796 1.00 0.00 O ATOM 48154 H1 WAT 9619 3.193 30.985 75.412 1.00 0.00 H ATOM 48155 H2 WAT 9619 2.379 31.865 74.488 1.00 0.00 H TER 48157 WAT 9619 ATOM 48157 O WAT 9620 135.116 89.948 21.024 1.00 0.00 O ATOM 48158 H1 WAT 9620 134.423 90.543 20.738 1.00 0.00 H ATOM 48159 H2 WAT 9620 135.862 90.519 21.209 1.00 0.00 H TER 48161 WAT 9620 ATOM 48161 O WAT 9621 63.241 39.862 4.635 1.00 0.00 O ATOM 48162 H1 WAT 9621 63.070 39.649 5.552 1.00 0.00 H ATOM 48163 H2 WAT 9621 64.125 39.531 4.473 1.00 0.00 H TER 48165 WAT 9621 ATOM 48165 O WAT 9622 15.558 106.996 19.820 1.00 0.00 O ATOM 48166 H1 WAT 9622 15.388 106.848 20.750 1.00 0.00 H ATOM 48167 H2 WAT 9622 14.835 106.559 19.371 1.00 0.00 H TER 48169 WAT 9622 ATOM 48169 O WAT 9623 53.112 87.252 6.334 1.00 0.00 O ATOM 48170 H1 WAT 9623 52.469 86.565 6.510 1.00 0.00 H ATOM 48171 H2 WAT 9623 53.344 87.134 5.413 1.00 0.00 H TER 48173 WAT 9623 ATOM 48173 O WAT 9624 125.639 45.812 104.518 1.00 0.00 O ATOM 48174 H1 WAT 9624 125.770 46.744 104.693 1.00 0.00 H ATOM 48175 H2 WAT 9624 125.267 45.466 105.329 1.00 0.00 H TER 48177 WAT 9624 ATOM 48177 O WAT 9625 94.200 85.086 84.839 1.00 0.00 O ATOM 48178 H1 WAT 9625 94.895 84.901 85.471 1.00 0.00 H ATOM 48179 H2 WAT 9625 93.997 84.236 84.450 1.00 0.00 H TER 48181 WAT 9625 ATOM 48181 O WAT 9626 39.803 15.594 17.220 1.00 0.00 O ATOM 48182 H1 WAT 9626 39.186 15.348 16.530 1.00 0.00 H ATOM 48183 H2 WAT 9626 39.376 15.321 18.032 1.00 0.00 H TER 48185 WAT 9626 ATOM 48185 O WAT 9627 103.569 94.890 145.361 1.00 0.00 O ATOM 48186 H1 WAT 9627 103.830 94.786 144.446 1.00 0.00 H ATOM 48187 H2 WAT 9627 103.237 94.029 145.615 1.00 0.00 H TER 48189 WAT 9627 ATOM 48189 O WAT 9628 84.625 57.559 151.450 1.00 0.00 O ATOM 48190 H1 WAT 9628 84.040 56.856 151.731 1.00 0.00 H ATOM 48191 H2 WAT 9628 85.356 57.523 152.066 1.00 0.00 H TER 48193 WAT 9628 ATOM 48193 O WAT 9629 143.990 118.977 100.873 1.00 0.00 O ATOM 48194 H1 WAT 9629 144.315 118.400 101.564 1.00 0.00 H ATOM 48195 H2 WAT 9629 143.732 118.384 100.167 1.00 0.00 H TER 48197 WAT 9629 ATOM 48197 O WAT 9630 93.984 5.911 90.826 1.00 0.00 O ATOM 48198 H1 WAT 9630 94.390 6.192 91.646 1.00 0.00 H ATOM 48199 H2 WAT 9630 93.390 6.625 90.595 1.00 0.00 H TER 48201 WAT 9630 ATOM 48201 O WAT 9631 138.040 50.043 7.777 1.00 0.00 O ATOM 48202 H1 WAT 9631 138.914 49.663 7.696 1.00 0.00 H ATOM 48203 H2 WAT 9631 137.602 49.813 6.957 1.00 0.00 H TER 48205 WAT 9631 ATOM 48205 O WAT 9632 88.646 112.420 145.155 1.00 0.00 O ATOM 48206 H1 WAT 9632 89.024 113.299 145.155 1.00 0.00 H ATOM 48207 H2 WAT 9632 88.840 112.076 144.282 1.00 0.00 H TER 48209 WAT 9632 ATOM 48209 O WAT 9633 112.413 11.863 1.123 1.00 0.00 O ATOM 48210 H1 WAT 9633 113.136 11.598 1.691 1.00 0.00 H ATOM 48211 H2 WAT 9633 111.776 12.260 1.716 1.00 0.00 H TER 48213 WAT 9633 ATOM 48213 O WAT 9634 140.870 131.284 148.828 1.00 0.00 O ATOM 48214 H1 WAT 9634 141.176 130.957 149.674 1.00 0.00 H ATOM 48215 H2 WAT 9634 140.081 131.786 149.037 1.00 0.00 H TER 48217 WAT 9634 ATOM 48217 O WAT 9635 30.753 104.119 156.555 1.00 0.00 O ATOM 48218 H1 WAT 9635 30.057 104.748 156.748 1.00 0.00 H ATOM 48219 H2 WAT 9635 31.461 104.650 156.191 1.00 0.00 H TER 48221 WAT 9635 ATOM 48221 O WAT 9636 134.688 20.058 79.279 1.00 0.00 O ATOM 48222 H1 WAT 9636 135.559 20.009 79.672 1.00 0.00 H ATOM 48223 H2 WAT 9636 134.144 19.498 79.832 1.00 0.00 H TER 48225 WAT 9636 ATOM 48225 O WAT 9637 46.328 94.469 151.368 1.00 0.00 O ATOM 48226 H1 WAT 9637 47.158 94.350 150.908 1.00 0.00 H ATOM 48227 H2 WAT 9637 45.767 93.769 151.034 1.00 0.00 H TER 48229 WAT 9637 ATOM 48229 O WAT 9638 82.362 84.836 132.595 1.00 0.00 O ATOM 48230 H1 WAT 9638 81.712 84.167 132.377 1.00 0.00 H ATOM 48231 H2 WAT 9638 82.380 84.849 133.552 1.00 0.00 H TER 48233 WAT 9638 ATOM 48233 O WAT 9639 96.248 40.311 91.566 1.00 0.00 O ATOM 48234 H1 WAT 9639 97.008 40.725 91.156 1.00 0.00 H ATOM 48235 H2 WAT 9639 96.397 40.416 92.506 1.00 0.00 H TER 48237 WAT 9639 ATOM 48237 O WAT 9640 12.676 38.774 20.140 1.00 0.00 O ATOM 48238 H1 WAT 9640 13.187 39.473 19.731 1.00 0.00 H ATOM 48239 H2 WAT 9640 11.865 39.200 20.415 1.00 0.00 H TER 48241 WAT 9640 ATOM 48241 O WAT 9641 33.668 133.356 53.118 1.00 0.00 O ATOM 48242 H1 WAT 9641 33.099 134.064 53.419 1.00 0.00 H ATOM 48243 H2 WAT 9641 33.861 133.575 52.206 1.00 0.00 H TER 48245 WAT 9641 ATOM 48245 O WAT 9642 66.577 23.692 124.787 1.00 0.00 O ATOM 48246 H1 WAT 9642 66.400 23.462 123.875 1.00 0.00 H ATOM 48247 H2 WAT 9642 66.062 24.484 124.939 1.00 0.00 H TER 48249 WAT 9642 ATOM 48249 O WAT 9643 4.961 80.508 64.510 1.00 0.00 O ATOM 48250 H1 WAT 9643 5.355 79.687 64.217 1.00 0.00 H ATOM 48251 H2 WAT 9643 5.707 81.067 64.730 1.00 0.00 H TER 48253 WAT 9643 ATOM 48253 O WAT 9644 117.812 87.085 147.958 1.00 0.00 O ATOM 48254 H1 WAT 9644 116.960 87.243 147.552 1.00 0.00 H ATOM 48255 H2 WAT 9644 117.831 87.674 148.712 1.00 0.00 H TER 48257 WAT 9644 ATOM 48257 O WAT 9645 116.904 30.304 142.273 1.00 0.00 O ATOM 48258 H1 WAT 9645 117.783 30.521 141.962 1.00 0.00 H ATOM 48259 H2 WAT 9645 116.524 31.145 142.525 1.00 0.00 H TER 48261 WAT 9645 ATOM 48261 O WAT 9646 113.981 124.128 121.318 1.00 0.00 O ATOM 48262 H1 WAT 9646 114.538 124.656 121.890 1.00 0.00 H ATOM 48263 H2 WAT 9646 113.139 124.584 121.316 1.00 0.00 H TER 48265 WAT 9646 ATOM 48265 O WAT 9647 127.645 25.491 110.157 1.00 0.00 O ATOM 48266 H1 WAT 9647 127.611 24.663 110.636 1.00 0.00 H ATOM 48267 H2 WAT 9647 126.728 25.712 109.995 1.00 0.00 H TER 48269 WAT 9647 ATOM 48269 O WAT 9648 90.612 75.856 19.566 1.00 0.00 O ATOM 48270 H1 WAT 9648 89.989 76.346 19.029 1.00 0.00 H ATOM 48271 H2 WAT 9648 90.367 76.065 20.468 1.00 0.00 H TER 48273 WAT 9648 ATOM 48273 O WAT 9649 68.032 23.170 122.214 1.00 0.00 O ATOM 48274 H1 WAT 9649 68.464 23.676 122.902 1.00 0.00 H ATOM 48275 H2 WAT 9649 68.726 22.621 121.850 1.00 0.00 H TER 48277 WAT 9649 ATOM 48277 O WAT 9650 57.450 13.753 76.939 1.00 0.00 O ATOM 48278 H1 WAT 9650 57.215 12.981 76.424 1.00 0.00 H ATOM 48279 H2 WAT 9650 56.619 14.203 77.090 1.00 0.00 H TER 48281 WAT 9650 ATOM 48281 O WAT 9651 131.371 74.929 137.580 1.00 0.00 O ATOM 48282 H1 WAT 9651 130.715 75.623 137.646 1.00 0.00 H ATOM 48283 H2 WAT 9651 132.178 75.384 137.341 1.00 0.00 H TER 48285 WAT 9651 ATOM 48285 O WAT 9652 71.993 144.281 80.833 1.00 0.00 O ATOM 48286 H1 WAT 9652 71.910 143.790 81.651 1.00 0.00 H ATOM 48287 H2 WAT 9652 71.310 144.949 80.884 1.00 0.00 H TER 48289 WAT 9652 ATOM 48289 O WAT 9653 75.794 134.060 157.564 1.00 0.00 O ATOM 48290 H1 WAT 9653 76.152 134.343 156.723 1.00 0.00 H ATOM 48291 H2 WAT 9653 75.642 134.873 158.046 1.00 0.00 H TER 48293 WAT 9653 ATOM 48293 O WAT 9654 8.538 27.568 9.755 1.00 0.00 O ATOM 48294 H1 WAT 9654 8.928 28.406 10.006 1.00 0.00 H ATOM 48295 H2 WAT 9654 8.222 27.196 10.578 1.00 0.00 H TER 48297 WAT 9654 ATOM 48297 O WAT 9655 68.152 101.775 142.011 1.00 0.00 O ATOM 48298 H1 WAT 9655 68.818 101.410 141.429 1.00 0.00 H ATOM 48299 H2 WAT 9655 67.351 101.301 141.787 1.00 0.00 H TER 48301 WAT 9655 ATOM 48301 O WAT 9656 49.554 36.552 1.224 1.00 0.00 O ATOM 48302 H1 WAT 9656 49.654 37.465 1.493 1.00 0.00 H ATOM 48303 H2 WAT 9656 48.767 36.253 1.680 1.00 0.00 H TER 48305 WAT 9656 ATOM 48305 O WAT 9657 100.128 8.878 94.091 1.00 0.00 O ATOM 48306 H1 WAT 9657 99.194 8.950 94.289 1.00 0.00 H ATOM 48307 H2 WAT 9657 100.268 9.492 93.370 1.00 0.00 H TER 48309 WAT 9657 ATOM 48309 O WAT 9658 80.506 37.864 121.627 1.00 0.00 O ATOM 48310 H1 WAT 9658 79.930 38.402 121.085 1.00 0.00 H ATOM 48311 H2 WAT 9658 81.363 38.285 121.559 1.00 0.00 H TER 48313 WAT 9658 ATOM 48313 O WAT 9659 54.304 48.206 130.271 1.00 0.00 O ATOM 48314 H1 WAT 9659 54.932 48.030 130.972 1.00 0.00 H ATOM 48315 H2 WAT 9659 54.845 48.415 129.510 1.00 0.00 H TER 48317 WAT 9659 ATOM 48317 O WAT 9660 22.429 47.793 21.001 1.00 0.00 O ATOM 48318 H1 WAT 9660 23.043 47.898 20.275 1.00 0.00 H ATOM 48319 H2 WAT 9660 22.134 48.683 21.196 1.00 0.00 H TER 48321 WAT 9660 ATOM 48321 O WAT 9661 61.880 54.311 135.155 1.00 0.00 O ATOM 48322 H1 WAT 9661 62.510 55.003 134.955 1.00 0.00 H ATOM 48323 H2 WAT 9661 61.207 54.398 134.480 1.00 0.00 H TER 48325 WAT 9661 ATOM 48325 O WAT 9662 71.968 20.989 66.900 1.00 0.00 O ATOM 48326 H1 WAT 9662 72.803 21.077 66.442 1.00 0.00 H ATOM 48327 H2 WAT 9662 71.896 20.054 67.090 1.00 0.00 H TER 48329 WAT 9662 ATOM 48329 O WAT 9663 66.832 31.763 103.058 1.00 0.00 O ATOM 48330 H1 WAT 9663 67.163 32.655 102.950 1.00 0.00 H ATOM 48331 H2 WAT 9663 67.265 31.261 102.368 1.00 0.00 H TER 48333 WAT 9663 ATOM 48333 O WAT 9664 132.923 23.822 100.342 1.00 0.00 O ATOM 48334 H1 WAT 9664 132.865 23.126 99.687 1.00 0.00 H ATOM 48335 H2 WAT 9664 132.022 24.126 100.448 1.00 0.00 H TER 48337 WAT 9664 ATOM 48337 O WAT 9665 9.022 98.560 102.286 1.00 0.00 O ATOM 48338 H1 WAT 9665 8.902 98.022 101.504 1.00 0.00 H ATOM 48339 H2 WAT 9665 8.486 99.337 102.126 1.00 0.00 H TER 48341 WAT 9665 ATOM 48341 O WAT 9666 89.906 87.929 83.474 1.00 0.00 O ATOM 48342 H1 WAT 9666 89.073 87.457 83.453 1.00 0.00 H ATOM 48343 H2 WAT 9666 89.712 88.734 83.954 1.00 0.00 H TER 48345 WAT 9666 ATOM 48345 O WAT 9667 13.875 135.426 69.157 1.00 0.00 O ATOM 48346 H1 WAT 9667 13.281 135.720 69.848 1.00 0.00 H ATOM 48347 H2 WAT 9667 14.661 135.960 69.274 1.00 0.00 H TER 48349 WAT 9667 ATOM 48349 O WAT 9668 80.006 34.935 134.079 1.00 0.00 O ATOM 48350 H1 WAT 9668 80.489 34.166 134.382 1.00 0.00 H ATOM 48351 H2 WAT 9668 79.810 34.749 133.161 1.00 0.00 H TER 48353 WAT 9668 ATOM 48353 O WAT 9669 34.140 65.678 82.453 1.00 0.00 O ATOM 48354 H1 WAT 9669 33.508 65.065 82.078 1.00 0.00 H ATOM 48355 H2 WAT 9669 34.174 65.448 83.382 1.00 0.00 H TER 48357 WAT 9669 ATOM 48357 O WAT 9670 62.033 98.050 105.926 1.00 0.00 O ATOM 48358 H1 WAT 9670 62.329 97.140 105.950 1.00 0.00 H ATOM 48359 H2 WAT 9670 61.688 98.212 106.804 1.00 0.00 H TER 48361 WAT 9670 ATOM 48361 O WAT 9671 111.584 140.490 92.886 1.00 0.00 O ATOM 48362 H1 WAT 9671 111.994 139.687 92.564 1.00 0.00 H ATOM 48363 H2 WAT 9671 112.312 141.015 93.218 1.00 0.00 H TER 48365 WAT 9671 ATOM 48365 O WAT 9672 36.448 42.547 10.878 1.00 0.00 O ATOM 48366 H1 WAT 9672 37.051 43.111 11.362 1.00 0.00 H ATOM 48367 H2 WAT 9672 36.380 42.954 10.014 1.00 0.00 H TER 48369 WAT 9672 ATOM 48369 O WAT 9673 62.319 25.968 11.070 1.00 0.00 O ATOM 48370 H1 WAT 9673 62.298 25.382 11.826 1.00 0.00 H ATOM 48371 H2 WAT 9673 63.236 26.235 11.000 1.00 0.00 H TER 48373 WAT 9673 ATOM 48373 O WAT 9674 65.689 42.881 13.376 1.00 0.00 O ATOM 48374 H1 WAT 9674 64.998 43.361 12.919 1.00 0.00 H ATOM 48375 H2 WAT 9674 65.533 41.964 13.149 1.00 0.00 H TER 48377 WAT 9674 ATOM 48377 O WAT 9675 142.672 46.217 153.986 1.00 0.00 O ATOM 48378 H1 WAT 9675 142.858 46.918 154.611 1.00 0.00 H ATOM 48379 H2 WAT 9675 141.725 46.091 154.042 1.00 0.00 H TER 48381 WAT 9675 ATOM 48381 O WAT 9676 121.380 92.918 110.555 1.00 0.00 O ATOM 48382 H1 WAT 9676 122.232 93.009 110.982 1.00 0.00 H ATOM 48383 H2 WAT 9676 121.420 93.517 109.810 1.00 0.00 H TER 48385 WAT 9676 ATOM 48385 O WAT 9677 49.984 83.986 80.365 1.00 0.00 O ATOM 48386 H1 WAT 9677 49.872 83.272 79.737 1.00 0.00 H ATOM 48387 H2 WAT 9677 49.199 84.524 80.259 1.00 0.00 H TER 48389 WAT 9677 ATOM 48389 O WAT 9678 55.309 42.042 62.222 1.00 0.00 O ATOM 48390 H1 WAT 9678 55.018 42.403 63.059 1.00 0.00 H ATOM 48391 H2 WAT 9678 55.139 42.740 61.589 1.00 0.00 H TER 48393 WAT 9678 ATOM 48393 O WAT 9679 8.104 10.848 142.332 1.00 0.00 O ATOM 48394 H1 WAT 9679 7.407 10.334 141.923 1.00 0.00 H ATOM 48395 H2 WAT 9679 7.646 11.557 142.783 1.00 0.00 H TER 48397 WAT 9679 ATOM 48397 O WAT 9680 47.156 46.055 23.059 1.00 0.00 O ATOM 48398 H1 WAT 9680 47.558 45.353 22.547 1.00 0.00 H ATOM 48399 H2 WAT 9680 47.358 45.834 23.968 1.00 0.00 H TER 48401 WAT 9680 ATOM 48401 O WAT 9681 22.261 20.418 14.506 1.00 0.00 O ATOM 48402 H1 WAT 9681 22.668 19.588 14.753 1.00 0.00 H ATOM 48403 H2 WAT 9681 22.418 20.491 13.565 1.00 0.00 H TER 48405 WAT 9681 ATOM 48405 O WAT 9682 6.124 82.608 119.723 1.00 0.00 O ATOM 48406 H1 WAT 9682 5.558 82.148 120.343 1.00 0.00 H ATOM 48407 H2 WAT 9682 6.457 83.359 120.214 1.00 0.00 H TER 48409 WAT 9682 ATOM 48409 O WAT 9683 142.261 82.487 157.872 1.00 0.00 O ATOM 48410 H1 WAT 9683 142.962 82.139 157.321 1.00 0.00 H ATOM 48411 H2 WAT 9683 141.456 82.261 157.406 1.00 0.00 H TER 48413 WAT 9683 ATOM 48413 O WAT 9684 18.080 17.206 118.502 1.00 0.00 O ATOM 48414 H1 WAT 9684 17.821 18.085 118.228 1.00 0.00 H ATOM 48415 H2 WAT 9684 17.485 16.994 119.221 1.00 0.00 H TER 48417 WAT 9684 ATOM 48417 O WAT 9685 88.987 55.065 112.743 1.00 0.00 O ATOM 48418 H1 WAT 9685 88.840 55.985 112.962 1.00 0.00 H ATOM 48419 H2 WAT 9685 88.500 54.579 113.409 1.00 0.00 H TER 48421 WAT 9685 ATOM 48421 O WAT 9686 110.932 7.456 133.572 1.00 0.00 O ATOM 48422 H1 WAT 9686 111.450 7.536 134.373 1.00 0.00 H ATOM 48423 H2 WAT 9686 110.620 6.551 133.577 1.00 0.00 H TER 48425 WAT 9686 ATOM 48425 O WAT 9687 13.915 126.306 1.896 1.00 0.00 O ATOM 48426 H1 WAT 9687 14.767 126.232 1.466 1.00 0.00 H ATOM 48427 H2 WAT 9687 14.120 126.588 2.787 1.00 0.00 H TER 48429 WAT 9687 ATOM 48429 O WAT 9688 96.597 46.174 9.919 1.00 0.00 O ATOM 48430 H1 WAT 9688 96.321 46.520 9.070 1.00 0.00 H ATOM 48431 H2 WAT 9688 96.978 45.320 9.717 1.00 0.00 H TER 48433 WAT 9688 ATOM 48433 O WAT 9689 25.386 60.820 142.101 1.00 0.00 O ATOM 48434 H1 WAT 9689 25.991 61.556 142.190 1.00 0.00 H ATOM 48435 H2 WAT 9689 25.859 60.184 141.564 1.00 0.00 H TER 48437 WAT 9689 ATOM 48437 O WAT 9690 83.430 42.582 81.631 1.00 0.00 O ATOM 48438 H1 WAT 9690 83.060 42.829 82.478 1.00 0.00 H ATOM 48439 H2 WAT 9690 84.163 43.185 81.505 1.00 0.00 H TER 48441 WAT 9690 ATOM 48441 O WAT 9691 121.307 7.205 72.152 1.00 0.00 O ATOM 48442 H1 WAT 9691 122.207 7.479 71.979 1.00 0.00 H ATOM 48443 H2 WAT 9691 121.369 6.264 72.313 1.00 0.00 H TER 48445 WAT 9691 ATOM 48445 O WAT 9692 127.346 115.217 142.538 1.00 0.00 O ATOM 48446 H1 WAT 9692 128.301 115.269 142.564 1.00 0.00 H ATOM 48447 H2 WAT 9692 127.141 114.370 142.934 1.00 0.00 H TER 48449 WAT 9692 ATOM 48449 O WAT 9693 31.516 98.554 96.318 1.00 0.00 O ATOM 48450 H1 WAT 9693 31.947 99.408 96.363 1.00 0.00 H ATOM 48451 H2 WAT 9693 30.889 98.564 97.041 1.00 0.00 H TER 48453 WAT 9693 ATOM 48453 O WAT 9694 78.481 104.848 89.788 1.00 0.00 O ATOM 48454 H1 WAT 9694 79.105 105.298 90.358 1.00 0.00 H ATOM 48455 H2 WAT 9694 79.020 104.478 89.089 1.00 0.00 H TER 48457 WAT 9694 ATOM 48457 O WAT 9695 89.616 11.735 93.898 1.00 0.00 O ATOM 48458 H1 WAT 9695 90.432 11.977 94.337 1.00 0.00 H ATOM 48459 H2 WAT 9695 89.432 12.470 93.313 1.00 0.00 H TER 48461 WAT 9695 ATOM 48461 O WAT 9696 78.618 34.359 154.681 1.00 0.00 O ATOM 48462 H1 WAT 9696 79.407 34.649 155.137 1.00 0.00 H ATOM 48463 H2 WAT 9696 78.529 33.436 154.920 1.00 0.00 H TER 48465 WAT 9696 ATOM 48465 O WAT 9697 108.702 139.371 100.398 1.00 0.00 O ATOM 48466 H1 WAT 9697 108.283 139.977 99.788 1.00 0.00 H ATOM 48467 H2 WAT 9697 108.174 138.574 100.345 1.00 0.00 H TER 48469 WAT 9697 ATOM 48469 O WAT 9698 4.049 7.174 154.661 1.00 0.00 O ATOM 48470 H1 WAT 9698 3.563 7.724 155.275 1.00 0.00 H ATOM 48471 H2 WAT 9698 4.059 7.675 153.846 1.00 0.00 H TER 48473 WAT 9698 ATOM 48473 O WAT 9699 85.592 4.893 141.357 1.00 0.00 O ATOM 48474 H1 WAT 9699 86.199 5.319 141.962 1.00 0.00 H ATOM 48475 H2 WAT 9699 86.155 4.399 140.761 1.00 0.00 H TER 48477 WAT 9699 ATOM 48477 O WAT 9700 48.041 23.117 56.953 1.00 0.00 O ATOM 48478 H1 WAT 9700 48.583 22.368 57.204 1.00 0.00 H ATOM 48479 H2 WAT 9700 47.169 22.903 57.284 1.00 0.00 H TER 48481 WAT 9700 ATOM 48481 O WAT 9701 74.865 130.688 92.737 1.00 0.00 O ATOM 48482 H1 WAT 9701 74.418 131.286 92.137 1.00 0.00 H ATOM 48483 H2 WAT 9701 74.464 129.835 92.568 1.00 0.00 H TER 48485 WAT 9701 ATOM 48485 O WAT 9702 66.592 118.882 135.515 1.00 0.00 O ATOM 48486 H1 WAT 9702 66.858 119.508 134.842 1.00 0.00 H ATOM 48487 H2 WAT 9702 66.649 118.028 135.086 1.00 0.00 H TER 48489 WAT 9702 ATOM 48489 O WAT 9703 3.395 49.883 100.140 1.00 0.00 O ATOM 48490 H1 WAT 9703 3.844 50.584 100.612 1.00 0.00 H ATOM 48491 H2 WAT 9703 4.075 49.491 99.591 1.00 0.00 H TER 48493 WAT 9703 ATOM 48493 O WAT 9704 25.696 127.272 87.089 1.00 0.00 O ATOM 48494 H1 WAT 9704 25.234 126.512 87.445 1.00 0.00 H ATOM 48495 H2 WAT 9704 25.181 128.024 87.382 1.00 0.00 H TER 48497 WAT 9704 ATOM 48497 O WAT 9705 103.029 63.000 96.844 1.00 0.00 O ATOM 48498 H1 WAT 9705 102.417 62.425 96.385 1.00 0.00 H ATOM 48499 H2 WAT 9705 102.954 62.745 97.764 1.00 0.00 H TER 48501 WAT 9705 ATOM 48501 O WAT 9706 109.035 87.590 57.101 1.00 0.00 O ATOM 48502 H1 WAT 9706 109.175 86.957 57.806 1.00 0.00 H ATOM 48503 H2 WAT 9706 108.698 88.369 57.543 1.00 0.00 H TER 48505 WAT 9706 ATOM 48505 O WAT 9707 23.026 23.660 70.302 1.00 0.00 O ATOM 48506 H1 WAT 9707 23.883 23.236 70.324 1.00 0.00 H ATOM 48507 H2 WAT 9707 22.419 22.962 70.054 1.00 0.00 H TER 48509 WAT 9707 ATOM 48509 O WAT 9708 37.619 27.177 20.552 1.00 0.00 O ATOM 48510 H1 WAT 9708 37.940 26.880 21.404 1.00 0.00 H ATOM 48511 H2 WAT 9708 38.381 27.121 19.976 1.00 0.00 H TER 48513 WAT 9708 ATOM 48513 O WAT 9709 104.466 94.558 78.258 1.00 0.00 O ATOM 48514 H1 WAT 9709 104.722 94.589 77.337 1.00 0.00 H ATOM 48515 H2 WAT 9709 104.495 95.470 78.547 1.00 0.00 H TER 48517 WAT 9709 ATOM 48517 O WAT 9710 125.787 109.064 117.560 1.00 0.00 O ATOM 48518 H1 WAT 9710 125.425 109.058 116.674 1.00 0.00 H ATOM 48519 H2 WAT 9710 125.124 108.624 118.092 1.00 0.00 H TER 48521 WAT 9710 ATOM 48521 O WAT 9711 8.360 19.764 129.883 1.00 0.00 O ATOM 48522 H1 WAT 9711 8.360 18.872 129.535 1.00 0.00 H ATOM 48523 H2 WAT 9711 7.497 19.865 130.284 1.00 0.00 H TER 48525 WAT 9711 ATOM 48525 O WAT 9712 114.986 14.329 143.292 1.00 0.00 O ATOM 48526 H1 WAT 9712 115.710 14.527 142.697 1.00 0.00 H ATOM 48527 H2 WAT 9712 114.385 15.067 143.191 1.00 0.00 H TER 48529 WAT 9712 ATOM 48529 O WAT 9713 102.880 35.619 1.016 1.00 0.00 O ATOM 48530 H1 WAT 9713 103.013 36.566 1.056 1.00 0.00 H ATOM 48531 H2 WAT 9713 102.004 35.484 1.377 1.00 0.00 H TER 48533 WAT 9713 ATOM 48533 O WAT 9714 17.543 38.818 1.193 1.00 0.00 O ATOM 48534 H1 WAT 9714 17.780 38.771 2.119 1.00 0.00 H ATOM 48535 H2 WAT 9714 17.494 37.904 0.911 1.00 0.00 H TER 48537 WAT 9714 ATOM 48537 O WAT 9715 140.386 141.883 134.852 1.00 0.00 O ATOM 48538 H1 WAT 9715 139.669 141.336 134.532 1.00 0.00 H ATOM 48539 H2 WAT 9715 141.028 141.875 134.142 1.00 0.00 H TER 48541 WAT 9715 ATOM 48541 O WAT 9716 12.111 85.874 20.004 1.00 0.00 O ATOM 48542 H1 WAT 9716 12.346 86.756 19.717 1.00 0.00 H ATOM 48543 H2 WAT 9716 11.175 85.925 20.197 1.00 0.00 H TER 48545 WAT 9716 ATOM 48545 O WAT 9717 144.432 126.371 114.435 1.00 0.00 O ATOM 48546 H1 WAT 9717 144.014 127.200 114.668 1.00 0.00 H ATOM 48547 H2 WAT 9717 144.293 125.810 115.198 1.00 0.00 H TER 48549 WAT 9717 ATOM 48549 O WAT 9718 121.009 1.252 78.786 1.00 0.00 O ATOM 48550 H1 WAT 9718 121.356 0.711 78.077 1.00 0.00 H ATOM 48551 H2 WAT 9718 120.779 2.080 78.365 1.00 0.00 H TER 48553 WAT 9718 ATOM 48553 O WAT 9719 71.353 125.997 143.373 1.00 0.00 O ATOM 48554 H1 WAT 9719 71.974 126.672 143.099 1.00 0.00 H ATOM 48555 H2 WAT 9719 70.493 126.377 143.194 1.00 0.00 H TER 48557 WAT 9719 ATOM 48557 O WAT 9720 132.534 68.563 87.563 1.00 0.00 O ATOM 48558 H1 WAT 9720 133.125 68.011 88.075 1.00 0.00 H ATOM 48559 H2 WAT 9720 132.316 68.034 86.795 1.00 0.00 H TER 48561 WAT 9720 ATOM 48561 O WAT 9721 127.332 68.475 116.847 1.00 0.00 O ATOM 48562 H1 WAT 9721 126.742 69.214 116.992 1.00 0.00 H ATOM 48563 H2 WAT 9721 128.175 68.879 116.641 1.00 0.00 H TER 48565 WAT 9721 ATOM 48565 O WAT 9722 66.233 60.402 102.470 1.00 0.00 O ATOM 48566 H1 WAT 9722 65.405 60.399 101.991 1.00 0.00 H ATOM 48567 H2 WAT 9722 66.052 59.902 103.266 1.00 0.00 H TER 48569 WAT 9722 ATOM 48569 O WAT 9723 84.715 49.951 82.478 1.00 0.00 O ATOM 48570 H1 WAT 9723 85.481 49.528 82.867 1.00 0.00 H ATOM 48571 H2 WAT 9723 84.153 50.160 83.223 1.00 0.00 H TER 48573 WAT 9723 ATOM 48573 O WAT 9724 110.156 124.161 63.423 1.00 0.00 O ATOM 48574 H1 WAT 9724 109.498 124.303 62.744 1.00 0.00 H ATOM 48575 H2 WAT 9724 110.711 123.462 63.077 1.00 0.00 H TER 48577 WAT 9724 ATOM 48577 O WAT 9725 23.659 58.957 99.693 1.00 0.00 O ATOM 48578 H1 WAT 9725 24.191 58.287 99.264 1.00 0.00 H ATOM 48579 H2 WAT 9725 23.913 59.774 99.265 1.00 0.00 H TER 48581 WAT 9725 ATOM 48581 O WAT 9726 94.407 70.092 73.647 1.00 0.00 O ATOM 48582 H1 WAT 9726 94.947 69.375 73.979 1.00 0.00 H ATOM 48583 H2 WAT 9726 93.857 69.687 72.976 1.00 0.00 H TER 48585 WAT 9726 ATOM 48585 O WAT 9727 51.046 57.223 94.429 1.00 0.00 O ATOM 48586 H1 WAT 9727 50.600 58.012 94.739 1.00 0.00 H ATOM 48587 H2 WAT 9727 50.356 56.561 94.384 1.00 0.00 H TER 48589 WAT 9727 ATOM 48589 O WAT 9728 73.372 141.408 1.796 1.00 0.00 O ATOM 48590 H1 WAT 9728 73.578 142.205 2.283 1.00 0.00 H ATOM 48591 H2 WAT 9728 73.825 140.712 2.272 1.00 0.00 H TER 48593 WAT 9728 ATOM 48593 O WAT 9729 125.906 12.119 2.765 1.00 0.00 O ATOM 48594 H1 WAT 9729 125.548 12.995 2.908 1.00 0.00 H ATOM 48595 H2 WAT 9729 126.541 12.002 3.472 1.00 0.00 H TER 48597 WAT 9729 ATOM 48597 O WAT 9730 24.657 10.945 4.900 1.00 0.00 O ATOM 48598 H1 WAT 9730 24.103 11.606 4.484 1.00 0.00 H ATOM 48599 H2 WAT 9730 24.799 10.289 4.218 1.00 0.00 H TER 48601 WAT 9730 ATOM 48601 O WAT 9731 69.721 96.378 15.158 1.00 0.00 O ATOM 48602 H1 WAT 9731 69.558 95.969 16.008 1.00 0.00 H ATOM 48603 H2 WAT 9731 68.910 96.844 14.957 1.00 0.00 H TER 48605 WAT 9731 ATOM 48605 O WAT 9732 125.011 106.974 136.477 1.00 0.00 O ATOM 48606 H1 WAT 9732 124.566 106.384 135.869 1.00 0.00 H ATOM 48607 H2 WAT 9732 125.835 107.192 136.041 1.00 0.00 H TER 48609 WAT 9732 ATOM 48609 O WAT 9733 26.662 117.314 150.750 1.00 0.00 O ATOM 48610 H1 WAT 9733 25.947 116.809 150.363 1.00 0.00 H ATOM 48611 H2 WAT 9733 27.050 117.783 150.011 1.00 0.00 H TER 48613 WAT 9733 ATOM 48613 O WAT 9734 92.645 63.695 153.264 1.00 0.00 O ATOM 48614 H1 WAT 9734 92.910 63.394 152.395 1.00 0.00 H ATOM 48615 H2 WAT 9734 91.815 63.249 153.429 1.00 0.00 H TER 48617 WAT 9734 ATOM 48617 O WAT 9735 7.251 13.583 152.210 1.00 0.00 O ATOM 48618 H1 WAT 9735 7.412 12.703 152.551 1.00 0.00 H ATOM 48619 H2 WAT 9735 6.334 13.569 151.936 1.00 0.00 H TER 48621 WAT 9735 ATOM 48621 O WAT 9736 83.137 35.989 64.587 1.00 0.00 O ATOM 48622 H1 WAT 9736 82.924 36.920 64.642 1.00 0.00 H ATOM 48623 H2 WAT 9736 83.919 35.889 65.129 1.00 0.00 H TER 48625 WAT 9736 ATOM 48625 O WAT 9737 92.376 36.323 10.585 1.00 0.00 O ATOM 48626 H1 WAT 9737 92.314 35.676 9.882 1.00 0.00 H ATOM 48627 H2 WAT 9737 92.697 37.115 10.153 1.00 0.00 H TER 48629 WAT 9737 ATOM 48629 O WAT 9738 115.398 96.275 70.352 1.00 0.00 O ATOM 48630 H1 WAT 9738 115.927 96.993 70.005 1.00 0.00 H ATOM 48631 H2 WAT 9738 115.893 95.486 70.135 1.00 0.00 H TER 48633 WAT 9738 ATOM 48633 O WAT 9739 129.638 59.289 119.197 1.00 0.00 O ATOM 48634 H1 WAT 9739 130.269 59.209 118.482 1.00 0.00 H ATOM 48635 H2 WAT 9739 128.796 59.417 118.760 1.00 0.00 H TER 48637 WAT 9739 ATOM 48637 O WAT 9740 125.581 3.083 4.366 1.00 0.00 O ATOM 48638 H1 WAT 9740 126.293 2.588 4.772 1.00 0.00 H ATOM 48639 H2 WAT 9740 126.004 3.581 3.667 1.00 0.00 H TER 48641 WAT 9740 ATOM 48641 O WAT 9741 102.603 141.724 125.668 1.00 0.00 O ATOM 48642 H1 WAT 9741 103.076 141.274 124.968 1.00 0.00 H ATOM 48643 H2 WAT 9741 102.584 141.094 126.388 1.00 0.00 H TER 48645 WAT 9741 ATOM 48645 O WAT 9742 65.391 124.585 79.808 1.00 0.00 O ATOM 48646 H1 WAT 9742 64.764 125.036 79.243 1.00 0.00 H ATOM 48647 H2 WAT 9742 65.222 124.936 80.682 1.00 0.00 H TER 48649 WAT 9742 ATOM 48649 O WAT 9743 48.932 6.839 126.000 1.00 0.00 O ATOM 48650 H1 WAT 9743 48.517 7.259 125.246 1.00 0.00 H ATOM 48651 H2 WAT 9743 48.207 6.644 126.594 1.00 0.00 H TER 48653 WAT 9743 ATOM 48653 O WAT 9744 96.074 10.566 8.182 1.00 0.00 O ATOM 48654 H1 WAT 9744 95.436 10.265 7.534 1.00 0.00 H ATOM 48655 H2 WAT 9744 96.350 9.768 8.633 1.00 0.00 H TER 48657 WAT 9744 ATOM 48657 O WAT 9745 13.090 56.319 57.497 1.00 0.00 O ATOM 48658 H1 WAT 9745 13.844 56.034 56.981 1.00 0.00 H ATOM 48659 H2 WAT 9745 12.569 55.525 57.617 1.00 0.00 H TER 48661 WAT 9745 ATOM 48661 O WAT 9746 74.162 138.319 95.015 1.00 0.00 O ATOM 48662 H1 WAT 9746 75.062 138.262 95.335 1.00 0.00 H ATOM 48663 H2 WAT 9746 73.622 138.137 95.785 1.00 0.00 H TER 48665 WAT 9746 ATOM 48665 O WAT 9747 10.242 49.805 137.783 1.00 0.00 O ATOM 48666 H1 WAT 9747 10.690 48.993 138.021 1.00 0.00 H ATOM 48667 H2 WAT 9747 10.833 50.499 138.076 1.00 0.00 H TER 48669 WAT 9747 ATOM 48669 O WAT 9748 85.667 65.869 110.218 1.00 0.00 O ATOM 48670 H1 WAT 9748 84.918 66.046 110.787 1.00 0.00 H ATOM 48671 H2 WAT 9748 85.514 64.984 109.889 1.00 0.00 H TER 48673 WAT 9748 ATOM 48673 O WAT 9749 53.187 48.958 146.092 1.00 0.00 O ATOM 48674 H1 WAT 9749 52.658 48.309 145.629 1.00 0.00 H ATOM 48675 H2 WAT 9749 54.028 48.524 146.234 1.00 0.00 H TER 48677 WAT 9749 ATOM 48677 O WAT 9750 38.410 12.924 126.270 1.00 0.00 O ATOM 48678 H1 WAT 9750 38.012 12.064 126.407 1.00 0.00 H ATOM 48679 H2 WAT 9750 38.146 13.170 125.383 1.00 0.00 H TER 48681 WAT 9750 ATOM 48681 O WAT 9751 3.988 138.550 8.580 1.00 0.00 O ATOM 48682 H1 WAT 9751 4.457 138.653 9.408 1.00 0.00 H ATOM 48683 H2 WAT 9751 3.649 139.423 8.386 1.00 0.00 H TER 48685 WAT 9751 ATOM 48685 O WAT 9752 86.309 30.516 80.821 1.00 0.00 O ATOM 48686 H1 WAT 9752 86.191 30.723 79.894 1.00 0.00 H ATOM 48687 H2 WAT 9752 86.805 29.697 80.822 1.00 0.00 H TER 48689 WAT 9752 ATOM 48689 O WAT 9753 128.958 103.837 88.880 1.00 0.00 O ATOM 48690 H1 WAT 9753 128.386 103.437 88.225 1.00 0.00 H ATOM 48691 H2 WAT 9753 129.836 103.767 88.506 1.00 0.00 H TER 48693 WAT 9753 ATOM 48693 O WAT 9754 106.076 65.413 77.841 1.00 0.00 O ATOM 48694 H1 WAT 9754 105.882 66.345 77.942 1.00 0.00 H ATOM 48695 H2 WAT 9754 106.139 65.282 76.895 1.00 0.00 H TER 48697 WAT 9754 ATOM 48697 O WAT 9755 4.995 144.445 112.909 1.00 0.00 O ATOM 48698 H1 WAT 9755 5.846 144.878 112.983 1.00 0.00 H ATOM 48699 H2 WAT 9755 5.008 143.774 113.591 1.00 0.00 H TER 48701 WAT 9755 ATOM 48701 O WAT 9756 42.855 120.914 139.373 1.00 0.00 O ATOM 48702 H1 WAT 9756 43.392 121.234 138.648 1.00 0.00 H ATOM 48703 H2 WAT 9756 42.418 121.696 139.711 1.00 0.00 H TER 48705 WAT 9756 ATOM 48705 O WAT 9757 39.250 24.687 146.539 1.00 0.00 O ATOM 48706 H1 WAT 9757 39.102 25.416 145.936 1.00 0.00 H ATOM 48707 H2 WAT 9757 40.189 24.714 146.721 1.00 0.00 H TER 48709 WAT 9757 ATOM 48709 O WAT 9758 136.666 74.552 110.313 1.00 0.00 O ATOM 48710 H1 WAT 9758 136.652 75.175 111.040 1.00 0.00 H ATOM 48711 H2 WAT 9758 135.830 74.090 110.379 1.00 0.00 H TER 48713 WAT 9758 ATOM 48713 O WAT 9759 137.498 25.235 102.935 1.00 0.00 O ATOM 48714 H1 WAT 9759 138.400 24.990 102.731 1.00 0.00 H ATOM 48715 H2 WAT 9759 137.533 25.547 103.840 1.00 0.00 H TER 48717 WAT 9759 ATOM 48717 O WAT 9760 62.794 144.580 115.638 1.00 0.00 O ATOM 48718 H1 WAT 9760 62.261 144.627 114.844 1.00 0.00 H ATOM 48719 H2 WAT 9760 63.239 145.426 115.678 1.00 0.00 H TER 48721 WAT 9760 ATOM 48721 O WAT 9761 66.877 79.029 3.165 1.00 0.00 O ATOM 48722 H1 WAT 9761 65.951 79.142 2.948 1.00 0.00 H ATOM 48723 H2 WAT 9761 66.997 78.080 3.213 1.00 0.00 H TER 48725 WAT 9761 ATOM 48725 O WAT 9762 135.061 91.376 109.779 1.00 0.00 O ATOM 48726 H1 WAT 9762 134.114 91.443 109.657 1.00 0.00 H ATOM 48727 H2 WAT 9762 135.232 91.848 110.594 1.00 0.00 H TER 48729 WAT 9762 ATOM 48729 O WAT 9763 118.344 51.973 143.186 1.00 0.00 O ATOM 48730 H1 WAT 9763 119.095 51.461 143.487 1.00 0.00 H ATOM 48731 H2 WAT 9763 118.243 52.660 143.846 1.00 0.00 H TER 48733 WAT 9763 ATOM 48733 O WAT 9764 53.392 8.808 17.339 1.00 0.00 O ATOM 48734 H1 WAT 9764 53.574 8.443 18.206 1.00 0.00 H ATOM 48735 H2 WAT 9764 53.637 8.112 16.730 1.00 0.00 H TER 48737 WAT 9764 ATOM 48737 O WAT 9765 96.282 30.811 109.165 1.00 0.00 O ATOM 48738 H1 WAT 9765 96.948 30.658 108.494 1.00 0.00 H ATOM 48739 H2 WAT 9765 95.656 31.403 108.749 1.00 0.00 H TER 48741 WAT 9765 ATOM 48741 O WAT 9766 115.298 119.646 67.680 1.00 0.00 O ATOM 48742 H1 WAT 9766 115.794 119.185 68.356 1.00 0.00 H ATOM 48743 H2 WAT 9766 115.588 120.556 67.749 1.00 0.00 H TER 48745 WAT 9766 ATOM 48745 O WAT 9767 25.218 85.557 70.007 1.00 0.00 O ATOM 48746 H1 WAT 9767 24.321 85.696 70.310 1.00 0.00 H ATOM 48747 H2 WAT 9767 25.744 85.557 70.806 1.00 0.00 H TER 48749 WAT 9767 ATOM 48749 O WAT 9768 130.699 90.650 8.933 1.00 0.00 O ATOM 48750 H1 WAT 9768 131.099 89.848 8.597 1.00 0.00 H ATOM 48751 H2 WAT 9768 130.437 91.133 8.149 1.00 0.00 H TER 48753 WAT 9768 ATOM 48753 O WAT 9769 115.963 64.305 110.002 1.00 0.00 O ATOM 48754 H1 WAT 9769 115.817 63.522 109.471 1.00 0.00 H ATOM 48755 H2 WAT 9769 115.277 64.913 109.724 1.00 0.00 H TER 48757 WAT 9769 ATOM 48757 O WAT 9770 35.860 62.653 17.915 1.00 0.00 O ATOM 48758 H1 WAT 9770 35.882 61.822 17.442 1.00 0.00 H ATOM 48759 H2 WAT 9770 35.004 63.026 17.706 1.00 0.00 H TER 48761 WAT 9770 ATOM 48761 O WAT 9771 118.727 133.129 66.471 1.00 0.00 O ATOM 48762 H1 WAT 9771 118.245 133.545 65.756 1.00 0.00 H ATOM 48763 H2 WAT 9771 118.796 133.808 67.141 1.00 0.00 H TER 48765 WAT 9771 ATOM 48765 O WAT 9772 104.551 102.751 137.889 1.00 0.00 O ATOM 48766 H1 WAT 9772 105.194 103.448 137.759 1.00 0.00 H ATOM 48767 H2 WAT 9772 104.012 102.772 137.098 1.00 0.00 H TER 48769 WAT 9772 ATOM 48769 O WAT 9773 82.920 38.435 117.364 1.00 0.00 O ATOM 48770 H1 WAT 9773 83.370 37.781 117.898 1.00 0.00 H ATOM 48771 H2 WAT 9773 83.624 38.910 116.923 1.00 0.00 H TER 48773 WAT 9773 ATOM 48773 O WAT 9774 44.522 106.852 90.468 1.00 0.00 O ATOM 48774 H1 WAT 9774 44.185 106.322 91.190 1.00 0.00 H ATOM 48775 H2 WAT 9774 43.865 107.538 90.348 1.00 0.00 H TER 48777 WAT 9774 ATOM 48777 O WAT 9775 14.845 34.369 95.454 1.00 0.00 O ATOM 48778 H1 WAT 9775 15.010 35.215 95.872 1.00 0.00 H ATOM 48779 H2 WAT 9775 14.566 33.799 96.170 1.00 0.00 H TER 48781 WAT 9775 ATOM 48781 O WAT 9776 108.606 92.849 1.340 1.00 0.00 O ATOM 48782 H1 WAT 9776 108.907 93.332 2.110 1.00 0.00 H ATOM 48783 H2 WAT 9776 109.246 93.057 0.660 1.00 0.00 H TER 48785 WAT 9776 ATOM 48785 O WAT 9777 124.773 48.062 19.898 1.00 0.00 O ATOM 48786 H1 WAT 9777 124.174 47.615 19.300 1.00 0.00 H ATOM 48787 H2 WAT 9777 124.200 48.521 20.512 1.00 0.00 H TER 48789 WAT 9777 ATOM 48789 O WAT 9778 3.266 59.466 127.639 1.00 0.00 O ATOM 48790 H1 WAT 9778 3.392 59.832 126.763 1.00 0.00 H ATOM 48791 H2 WAT 9778 4.002 59.804 128.148 1.00 0.00 H TER 48793 WAT 9778 ATOM 48793 O WAT 9779 74.174 59.961 110.629 1.00 0.00 O ATOM 48794 H1 WAT 9779 74.627 59.283 111.129 1.00 0.00 H ATOM 48795 H2 WAT 9779 74.327 59.726 109.714 1.00 0.00 H TER 48797 WAT 9779 ATOM 48797 O WAT 9780 75.375 117.213 139.042 1.00 0.00 O ATOM 48798 H1 WAT 9780 75.155 117.095 138.118 1.00 0.00 H ATOM 48799 H2 WAT 9780 74.980 118.053 139.277 1.00 0.00 H TER 48801 WAT 9780 ATOM 48801 O WAT 9781 25.736 69.100 2.178 1.00 0.00 O ATOM 48802 H1 WAT 9781 25.084 68.428 1.979 1.00 0.00 H ATOM 48803 H2 WAT 9781 25.293 69.927 1.989 1.00 0.00 H TER 48805 WAT 9781 ATOM 48805 O WAT 9782 30.366 52.843 155.543 1.00 0.00 O ATOM 48806 H1 WAT 9782 31.050 53.513 155.562 1.00 0.00 H ATOM 48807 H2 WAT 9782 29.757 53.141 154.867 1.00 0.00 H TER 48809 WAT 9782 ATOM 48809 O WAT 9783 31.082 91.524 98.959 1.00 0.00 O ATOM 48810 H1 WAT 9783 31.216 91.941 99.810 1.00 0.00 H ATOM 48811 H2 WAT 9783 30.131 91.467 98.866 1.00 0.00 H TER 48813 WAT 9783 ATOM 48813 O WAT 9784 20.261 94.095 108.722 1.00 0.00 O ATOM 48814 H1 WAT 9784 20.301 93.175 108.463 1.00 0.00 H ATOM 48815 H2 WAT 9784 20.039 94.074 109.653 1.00 0.00 H TER 48817 WAT 9784 ATOM 48817 O WAT 9785 11.477 45.972 60.757 1.00 0.00 O ATOM 48818 H1 WAT 9785 11.301 46.558 60.021 1.00 0.00 H ATOM 48819 H2 WAT 9785 11.058 45.147 60.513 1.00 0.00 H TER 48821 WAT 9785 ATOM 48821 O WAT 9786 141.767 47.647 131.637 1.00 0.00 O ATOM 48822 H1 WAT 9786 142.522 47.254 132.075 1.00 0.00 H ATOM 48823 H2 WAT 9786 141.525 48.387 132.194 1.00 0.00 H TER 48825 WAT 9786 ATOM 48825 O WAT 9787 145.218 61.020 125.757 1.00 0.00 O ATOM 48826 H1 WAT 9787 144.434 61.320 125.297 1.00 0.00 H ATOM 48827 H2 WAT 9787 145.588 60.347 125.185 1.00 0.00 H TER 48829 WAT 9787 ATOM 48829 O WAT 9788 122.811 127.496 5.473 1.00 0.00 O ATOM 48830 H1 WAT 9788 121.882 127.271 5.442 1.00 0.00 H ATOM 48831 H2 WAT 9788 122.828 128.451 5.422 1.00 0.00 H TER 48833 WAT 9788 ATOM 48833 O WAT 9789 39.939 36.795 144.109 1.00 0.00 O ATOM 48834 H1 WAT 9789 39.229 36.891 144.744 1.00 0.00 H ATOM 48835 H2 WAT 9789 40.738 36.853 144.633 1.00 0.00 H TER 48837 WAT 9789 ATOM 48837 O WAT 9790 94.308 82.324 150.303 1.00 0.00 O ATOM 48838 H1 WAT 9790 93.532 82.143 150.833 1.00 0.00 H ATOM 48839 H2 WAT 9790 93.981 82.845 149.570 1.00 0.00 H TER 48841 WAT 9790 ATOM 48841 O WAT 9791 80.415 47.726 79.537 1.00 0.00 O ATOM 48842 H1 WAT 9791 79.939 48.539 79.705 1.00 0.00 H ATOM 48843 H2 WAT 9791 80.906 47.565 80.343 1.00 0.00 H TER 48845 WAT 9791 ATOM 48845 O WAT 9792 138.685 106.872 72.492 1.00 0.00 O ATOM 48846 H1 WAT 9792 138.759 106.484 73.364 1.00 0.00 H ATOM 48847 H2 WAT 9792 138.120 107.635 72.616 1.00 0.00 H TER 48849 WAT 9792 ATOM 48849 O WAT 9793 93.780 143.427 4.767 1.00 0.00 O ATOM 48850 H1 WAT 9793 93.137 144.132 4.698 1.00 0.00 H ATOM 48851 H2 WAT 9793 93.263 142.652 4.989 1.00 0.00 H TER 48853 WAT 9793 ATOM 48853 O WAT 9794 117.577 16.695 86.588 1.00 0.00 O ATOM 48854 H1 WAT 9794 117.797 16.971 85.698 1.00 0.00 H ATOM 48855 H2 WAT 9794 118.393 16.798 87.078 1.00 0.00 H TER 48857 WAT 9794 ATOM 48857 O WAT 9795 70.221 29.918 73.913 1.00 0.00 O ATOM 48858 H1 WAT 9795 69.321 29.654 73.724 1.00 0.00 H ATOM 48859 H2 WAT 9795 70.658 29.108 74.177 1.00 0.00 H TER 48861 WAT 9795 ATOM 48861 O WAT 9796 107.385 143.571 134.517 1.00 0.00 O ATOM 48862 H1 WAT 9796 107.944 142.963 135.000 1.00 0.00 H ATOM 48863 H2 WAT 9796 107.466 143.296 133.603 1.00 0.00 H TER 48865 WAT 9796 ATOM 48865 O WAT 9797 121.190 22.904 110.501 1.00 0.00 O ATOM 48866 H1 WAT 9797 120.775 22.496 111.262 1.00 0.00 H ATOM 48867 H2 WAT 9797 120.552 23.552 110.200 1.00 0.00 H TER 48869 WAT 9797 ATOM 48869 O WAT 9798 1.230 81.996 100.135 1.00 0.00 O ATOM 48870 H1 WAT 9798 0.944 82.724 100.687 1.00 0.00 H ATOM 48871 H2 WAT 9798 2.149 82.184 99.946 1.00 0.00 H TER 48873 WAT 9798 ATOM 48873 O WAT 9799 105.483 6.899 102.690 1.00 0.00 O ATOM 48874 H1 WAT 9799 105.959 7.334 103.398 1.00 0.00 H ATOM 48875 H2 WAT 9799 106.153 6.704 102.035 1.00 0.00 H TER 48877 WAT 9799 ATOM 48877 O WAT 9800 67.478 10.030 127.913 1.00 0.00 O ATOM 48878 H1 WAT 9800 67.547 10.965 128.105 1.00 0.00 H ATOM 48879 H2 WAT 9800 67.720 9.957 126.990 1.00 0.00 H TER 48881 WAT 9800 ATOM 48881 O WAT 9801 100.637 26.202 81.876 1.00 0.00 O ATOM 48882 H1 WAT 9801 99.729 25.925 81.759 1.00 0.00 H ATOM 48883 H2 WAT 9801 100.953 26.373 80.989 1.00 0.00 H TER 48885 WAT 9801 ATOM 48885 O WAT 9802 95.001 91.468 2.362 1.00 0.00 O ATOM 48886 H1 WAT 9802 94.130 91.646 2.007 1.00 0.00 H ATOM 48887 H2 WAT 9802 94.985 91.850 3.239 1.00 0.00 H TER 48889 WAT 9802 ATOM 48889 O WAT 9803 145.013 97.101 132.884 1.00 0.00 O ATOM 48890 H1 WAT 9803 145.022 96.484 132.152 1.00 0.00 H ATOM 48891 H2 WAT 9803 144.963 97.963 132.470 1.00 0.00 H TER 48893 WAT 9803 ATOM 48893 O WAT 9804 88.794 5.134 92.161 1.00 0.00 O ATOM 48894 H1 WAT 9804 87.921 5.350 91.833 1.00 0.00 H ATOM 48895 H2 WAT 9804 88.881 5.645 92.966 1.00 0.00 H TER 48897 WAT 9804 ATOM 48897 O WAT 9805 31.740 87.958 125.515 1.00 0.00 O ATOM 48898 H1 WAT 9805 32.530 87.585 125.904 1.00 0.00 H ATOM 48899 H2 WAT 9805 32.042 88.367 124.704 1.00 0.00 H TER 48901 WAT 9805 ATOM 48901 O WAT 9806 15.585 21.521 85.667 1.00 0.00 O ATOM 48902 H1 WAT 9806 16.498 21.702 85.444 1.00 0.00 H ATOM 48903 H2 WAT 9806 15.201 22.383 85.822 1.00 0.00 H TER 48905 WAT 9806 ATOM 48905 O WAT 9807 61.771 131.462 6.538 1.00 0.00 O ATOM 48906 H1 WAT 9807 61.302 132.021 5.919 1.00 0.00 H ATOM 48907 H2 WAT 9807 61.280 130.641 6.539 1.00 0.00 H TER 48909 WAT 9807 ATOM 48909 O WAT 9808 19.680 124.918 56.639 1.00 0.00 O ATOM 48910 H1 WAT 9808 18.877 124.402 56.713 1.00 0.00 H ATOM 48911 H2 WAT 9808 20.289 124.502 57.249 1.00 0.00 H TER 48913 WAT 9808 ATOM 48913 O WAT 9809 115.663 26.478 110.822 1.00 0.00 O ATOM 48914 H1 WAT 9809 114.951 26.894 111.308 1.00 0.00 H ATOM 48915 H2 WAT 9809 116.353 27.141 110.794 1.00 0.00 H TER 48917 WAT 9809 ATOM 48917 O WAT 9810 98.454 10.706 127.083 1.00 0.00 O ATOM 48918 H1 WAT 9810 99.364 10.813 127.363 1.00 0.00 H ATOM 48919 H2 WAT 9810 97.964 11.331 127.618 1.00 0.00 H TER 48921 WAT 9810 ATOM 48921 O WAT 9811 53.948 10.370 118.939 1.00 0.00 O ATOM 48922 H1 WAT 9811 54.238 11.281 118.992 1.00 0.00 H ATOM 48923 H2 WAT 9811 53.933 10.178 118.001 1.00 0.00 H TER 48925 WAT 9811 ATOM 48925 O WAT 9812 90.578 0.531 71.348 1.00 0.00 O ATOM 48926 H1 WAT 9812 90.734 0.769 70.434 1.00 0.00 H ATOM 48927 H2 WAT 9812 89.675 0.802 71.515 1.00 0.00 H TER 48929 WAT 9812 ATOM 48929 O WAT 9813 143.598 22.419 93.090 1.00 0.00 O ATOM 48930 H1 WAT 9813 142.799 22.739 93.508 1.00 0.00 H ATOM 48931 H2 WAT 9813 143.339 22.235 92.187 1.00 0.00 H TER 48933 WAT 9813 ATOM 48933 O WAT 9814 116.602 79.662 103.131 1.00 0.00 O ATOM 48934 H1 WAT 9814 116.024 79.925 102.415 1.00 0.00 H ATOM 48935 H2 WAT 9814 116.962 80.484 103.463 1.00 0.00 H TER 48937 WAT 9814 ATOM 48937 O WAT 9815 22.901 12.735 63.703 1.00 0.00 O ATOM 48938 H1 WAT 9815 23.333 11.950 64.039 1.00 0.00 H ATOM 48939 H2 WAT 9815 22.693 13.247 64.485 1.00 0.00 H TER 48941 WAT 9815 ATOM 48941 O WAT 9816 114.835 65.810 135.042 1.00 0.00 O ATOM 48942 H1 WAT 9816 114.391 65.978 134.212 1.00 0.00 H ATOM 48943 H2 WAT 9816 114.805 66.647 135.504 1.00 0.00 H TER 48945 WAT 9816 ATOM 48945 O WAT 9817 2.677 61.236 72.561 1.00 0.00 O ATOM 48946 H1 WAT 9817 1.895 61.737 72.330 1.00 0.00 H ATOM 48947 H2 WAT 9817 3.240 61.302 71.790 1.00 0.00 H TER 48949 WAT 9817 ATOM 48949 O WAT 9818 96.207 122.721 107.399 1.00 0.00 O ATOM 48950 H1 WAT 9818 96.496 123.625 107.524 1.00 0.00 H ATOM 48951 H2 WAT 9818 95.317 122.703 107.752 1.00 0.00 H TER 48953 WAT 9818 ATOM 48953 O WAT 9819 25.726 19.723 92.867 1.00 0.00 O ATOM 48954 H1 WAT 9819 25.470 19.830 93.784 1.00 0.00 H ATOM 48955 H2 WAT 9819 24.909 19.821 92.378 1.00 0.00 H TER 48957 WAT 9819 ATOM 48957 O WAT 9820 84.517 14.757 9.894 1.00 0.00 O ATOM 48958 H1 WAT 9820 84.234 15.485 9.342 1.00 0.00 H ATOM 48959 H2 WAT 9820 83.773 14.591 10.473 1.00 0.00 H TER 48961 WAT 9820 ATOM 48961 O WAT 9821 128.789 72.688 90.170 1.00 0.00 O ATOM 48962 H1 WAT 9821 129.726 72.784 90.342 1.00 0.00 H ATOM 48963 H2 WAT 9821 128.431 72.333 90.983 1.00 0.00 H TER 48965 WAT 9821 ATOM 48965 O WAT 9822 107.457 3.462 157.885 1.00 0.00 O ATOM 48966 H1 WAT 9822 107.138 2.998 157.110 1.00 0.00 H ATOM 48967 H2 WAT 9822 106.819 3.255 158.568 1.00 0.00 H TER 48969 WAT 9822 ATOM 48969 O WAT 9823 145.563 1.684 120.221 1.00 0.00 O ATOM 48970 H1 WAT 9823 145.825 2.550 119.909 1.00 0.00 H ATOM 48971 H2 WAT 9823 145.816 1.089 119.516 1.00 0.00 H TER 48973 WAT 9823 ATOM 48973 O WAT 9824 11.577 82.591 72.214 1.00 0.00 O ATOM 48974 H1 WAT 9824 11.518 83.546 72.235 1.00 0.00 H ATOM 48975 H2 WAT 9824 12.514 82.410 72.141 1.00 0.00 H TER 48977 WAT 9824 ATOM 48977 O WAT 9825 44.570 79.429 139.005 1.00 0.00 O ATOM 48978 H1 WAT 9825 44.270 80.323 138.846 1.00 0.00 H ATOM 48979 H2 WAT 9825 45.254 79.285 138.350 1.00 0.00 H TER 48981 WAT 9825 ATOM 48981 O WAT 9826 78.646 49.345 21.036 1.00 0.00 O ATOM 48982 H1 WAT 9826 78.726 50.144 21.557 1.00 0.00 H ATOM 48983 H2 WAT 9826 78.201 48.726 21.614 1.00 0.00 H TER 48985 WAT 9826 ATOM 48985 O WAT 9827 61.217 109.970 101.926 1.00 0.00 O ATOM 48986 H1 WAT 9827 61.573 109.173 102.319 1.00 0.00 H ATOM 48987 H2 WAT 9827 60.965 109.709 101.041 1.00 0.00 H TER 48989 WAT 9827 ATOM 48989 O WAT 9828 18.725 91.997 72.362 1.00 0.00 O ATOM 48990 H1 WAT 9828 18.620 91.293 73.002 1.00 0.00 H ATOM 48991 H2 WAT 9828 18.224 91.704 71.600 1.00 0.00 H TER 48993 WAT 9828 ATOM 48993 O WAT 9829 81.931 38.832 111.091 1.00 0.00 O ATOM 48994 H1 WAT 9829 82.647 38.387 111.544 1.00 0.00 H ATOM 48995 H2 WAT 9829 81.173 38.263 111.221 1.00 0.00 H TER 48997 WAT 9829 ATOM 48997 O WAT 9830 135.152 99.747 61.006 1.00 0.00 O ATOM 48998 H1 WAT 9830 135.195 99.157 61.758 1.00 0.00 H ATOM 48999 H2 WAT 9830 135.699 100.492 61.255 1.00 0.00 H TER 49001 WAT 9830 ATOM 49001 O WAT 9831 94.111 139.980 77.193 1.00 0.00 O ATOM 49002 H1 WAT 9831 94.398 139.215 76.695 1.00 0.00 H ATOM 49003 H2 WAT 9831 93.160 139.885 77.250 1.00 0.00 H TER 49005 WAT 9831 ATOM 49005 O WAT 9832 20.125 11.653 95.880 1.00 0.00 O ATOM 49006 H1 WAT 9832 19.926 10.935 96.480 1.00 0.00 H ATOM 49007 H2 WAT 9832 19.853 11.330 95.021 1.00 0.00 H TER 49009 WAT 9832 ATOM 49009 O WAT 9833 130.594 15.045 157.799 1.00 0.00 O ATOM 49010 H1 WAT 9833 131.270 15.428 157.240 1.00 0.00 H ATOM 49011 H2 WAT 9833 130.503 14.146 157.483 1.00 0.00 H TER 49013 WAT 9833 ATOM 49013 O WAT 9834 119.062 106.665 148.013 1.00 0.00 O ATOM 49014 H1 WAT 9834 119.648 107.074 148.649 1.00 0.00 H ATOM 49015 H2 WAT 9834 118.392 107.328 147.845 1.00 0.00 H TER 49017 WAT 9834 ATOM 49017 O WAT 9835 142.530 129.607 65.361 1.00 0.00 O ATOM 49018 H1 WAT 9835 141.674 129.573 65.787 1.00 0.00 H ATOM 49019 H2 WAT 9835 142.662 130.535 65.165 1.00 0.00 H TER 49021 WAT 9835 ATOM 49021 O WAT 9836 43.451 14.647 25.991 1.00 0.00 O ATOM 49022 H1 WAT 9836 44.154 15.270 26.175 1.00 0.00 H ATOM 49023 H2 WAT 9836 42.646 15.134 26.169 1.00 0.00 H TER 49025 WAT 9836 ATOM 49025 O WAT 9837 38.863 20.666 92.050 1.00 0.00 O ATOM 49026 H1 WAT 9837 39.796 20.458 92.096 1.00 0.00 H ATOM 49027 H2 WAT 9837 38.452 20.060 92.666 1.00 0.00 H TER 49029 WAT 9837 ATOM 49029 O WAT 9838 117.595 19.779 143.647 1.00 0.00 O ATOM 49030 H1 WAT 9838 118.305 19.476 143.081 1.00 0.00 H ATOM 49031 H2 WAT 9838 117.887 20.635 143.960 1.00 0.00 H TER 49033 WAT 9838 ATOM 49033 O WAT 9839 29.243 61.383 116.315 1.00 0.00 O ATOM 49034 H1 WAT 9839 29.183 62.050 115.631 1.00 0.00 H ATOM 49035 H2 WAT 9839 29.024 60.564 115.871 1.00 0.00 H TER 49037 WAT 9839 ATOM 49037 O WAT 9840 43.701 64.312 141.056 1.00 0.00 O ATOM 49038 H1 WAT 9840 44.214 64.030 140.298 1.00 0.00 H ATOM 49039 H2 WAT 9840 44.355 64.536 141.718 1.00 0.00 H TER 49041 WAT 9840 ATOM 49041 O WAT 9841 120.605 145.206 92.194 1.00 0.00 O ATOM 49042 H1 WAT 9841 120.065 145.981 92.039 1.00 0.00 H ATOM 49043 H2 WAT 9841 120.283 144.852 93.023 1.00 0.00 H TER 49045 WAT 9841 ATOM 49045 O WAT 9842 94.774 36.158 115.100 1.00 0.00 O ATOM 49046 H1 WAT 9842 95.411 35.735 115.677 1.00 0.00 H ATOM 49047 H2 WAT 9842 95.240 36.914 114.743 1.00 0.00 H TER 49049 WAT 9842 ATOM 49049 O WAT 9843 3.551 142.775 132.284 1.00 0.00 O ATOM 49050 H1 WAT 9843 3.559 141.819 132.317 1.00 0.00 H ATOM 49051 H2 WAT 9843 3.632 143.047 133.199 1.00 0.00 H TER 49053 WAT 9843 ATOM 49053 O WAT 9844 137.543 13.957 131.773 1.00 0.00 O ATOM 49054 H1 WAT 9844 137.394 14.649 131.129 1.00 0.00 H ATOM 49055 H2 WAT 9844 138.391 13.585 131.532 1.00 0.00 H TER 49057 WAT 9844 ATOM 49057 O WAT 9845 128.976 67.960 89.651 1.00 0.00 O ATOM 49058 H1 WAT 9845 129.566 67.236 89.439 1.00 0.00 H ATOM 49059 H2 WAT 9845 129.554 68.715 89.763 1.00 0.00 H TER 49061 WAT 9845 ATOM 49061 O WAT 9846 28.656 104.617 146.139 1.00 0.00 O ATOM 49062 H1 WAT 9846 28.303 105.448 146.457 1.00 0.00 H ATOM 49063 H2 WAT 9846 28.828 104.771 145.209 1.00 0.00 H TER 49065 WAT 9846 ATOM 49065 O WAT 9847 26.147 16.081 135.175 1.00 0.00 O ATOM 49066 H1 WAT 9847 26.337 15.957 136.105 1.00 0.00 H ATOM 49067 H2 WAT 9847 25.200 15.957 135.106 1.00 0.00 H TER 49069 WAT 9847 ATOM 49069 O WAT 9848 136.525 29.253 137.823 1.00 0.00 O ATOM 49070 H1 WAT 9848 136.468 28.433 137.332 1.00 0.00 H ATOM 49071 H2 WAT 9848 137.464 29.430 137.885 1.00 0.00 H TER 49073 WAT 9848 ATOM 49073 O WAT 9849 83.223 63.022 143.991 1.00 0.00 O ATOM 49074 H1 WAT 9849 83.681 62.187 144.088 1.00 0.00 H ATOM 49075 H2 WAT 9849 82.392 62.895 144.450 1.00 0.00 H TER 49077 WAT 9849 ATOM 49077 O WAT 9850 95.913 145.570 130.697 1.00 0.00 O ATOM 49078 H1 WAT 9850 95.139 145.296 130.205 1.00 0.00 H ATOM 49079 H2 WAT 9850 96.608 145.624 130.041 1.00 0.00 H TER 49081 WAT 9850 ATOM 49081 O WAT 9851 119.998 33.643 139.513 1.00 0.00 O ATOM 49082 H1 WAT 9851 119.854 34.047 138.658 1.00 0.00 H ATOM 49083 H2 WAT 9851 119.132 33.628 139.920 1.00 0.00 H TER 49085 WAT 9851 ATOM 49085 O WAT 9852 81.893 92.312 104.148 1.00 0.00 O ATOM 49086 H1 WAT 9852 81.268 92.961 103.824 1.00 0.00 H ATOM 49087 H2 WAT 9852 81.736 92.278 105.091 1.00 0.00 H TER 49089 WAT 9852 ATOM 49089 O WAT 9853 143.096 140.408 3.792 1.00 0.00 O ATOM 49090 H1 WAT 9853 143.388 140.566 2.894 1.00 0.00 H ATOM 49091 H2 WAT 9853 143.862 140.041 4.232 1.00 0.00 H TER 49093 WAT 9853 ATOM 49093 O WAT 9854 71.433 144.295 148.548 1.00 0.00 O ATOM 49094 H1 WAT 9854 71.594 143.419 148.196 1.00 0.00 H ATOM 49095 H2 WAT 9854 71.036 144.140 149.405 1.00 0.00 H TER 49097 WAT 9854 ATOM 49097 O WAT 9855 9.889 123.341 16.448 1.00 0.00 O ATOM 49098 H1 WAT 9855 10.833 123.450 16.563 1.00 0.00 H ATOM 49099 H2 WAT 9855 9.779 122.415 16.234 1.00 0.00 H TER 49101 WAT 9855 ATOM 49101 O WAT 9856 97.909 69.916 141.518 1.00 0.00 O ATOM 49102 H1 WAT 9856 98.481 69.599 142.218 1.00 0.00 H ATOM 49103 H2 WAT 9856 97.388 69.152 141.270 1.00 0.00 H TER 49105 WAT 9856 ATOM 49105 O WAT 9857 116.146 125.218 13.102 1.00 0.00 O ATOM 49106 H1 WAT 9857 116.302 126.020 12.604 1.00 0.00 H ATOM 49107 H2 WAT 9857 115.684 125.511 13.888 1.00 0.00 H TER 49109 WAT 9857 ATOM 49109 O WAT 9858 134.056 119.773 18.724 1.00 0.00 O ATOM 49110 H1 WAT 9858 133.244 119.827 19.227 1.00 0.00 H ATOM 49111 H2 WAT 9858 133.884 119.104 18.062 1.00 0.00 H TER 49113 WAT 9858 ATOM 49113 O WAT 9859 31.277 15.189 3.795 1.00 0.00 O ATOM 49114 H1 WAT 9859 31.167 14.801 2.927 1.00 0.00 H ATOM 49115 H2 WAT 9859 30.924 14.533 4.396 1.00 0.00 H TER 49117 WAT 9859 ATOM 49117 O WAT 9860 19.590 86.736 91.319 1.00 0.00 O ATOM 49118 H1 WAT 9860 19.222 85.934 91.690 1.00 0.00 H ATOM 49119 H2 WAT 9860 18.868 87.365 91.343 1.00 0.00 H TER 49121 WAT 9860 ATOM 49121 O WAT 9861 40.401 78.669 108.489 1.00 0.00 O ATOM 49122 H1 WAT 9861 41.314 78.667 108.200 1.00 0.00 H ATOM 49123 H2 WAT 9861 40.225 77.759 108.729 1.00 0.00 H TER 49125 WAT 9861 ATOM 49125 O WAT 9862 53.340 4.336 130.748 1.00 0.00 O ATOM 49126 H1 WAT 9862 53.691 5.040 130.203 1.00 0.00 H ATOM 49127 H2 WAT 9862 53.366 3.562 130.186 1.00 0.00 H TER 49129 WAT 9862 ATOM 49129 O WAT 9863 6.265 40.114 86.094 1.00 0.00 O ATOM 49130 H1 WAT 9863 6.168 39.207 86.384 1.00 0.00 H ATOM 49131 H2 WAT 9863 5.400 40.501 86.227 1.00 0.00 H TER 49133 WAT 9863 ATOM 49133 O WAT 9864 43.696 18.979 109.238 1.00 0.00 O ATOM 49134 H1 WAT 9864 43.537 18.039 109.153 1.00 0.00 H ATOM 49135 H2 WAT 9864 44.378 19.046 109.907 1.00 0.00 H TER 49137 WAT 9864 ATOM 49137 O WAT 9865 128.112 67.941 140.316 1.00 0.00 O ATOM 49138 H1 WAT 9865 127.189 67.708 140.420 1.00 0.00 H ATOM 49139 H2 WAT 9865 128.181 68.819 140.692 1.00 0.00 H TER 49141 WAT 9865 ATOM 49141 O WAT 9866 72.236 57.267 93.744 1.00 0.00 O ATOM 49142 H1 WAT 9866 73.070 56.911 94.051 1.00 0.00 H ATOM 49143 H2 WAT 9866 72.152 58.106 94.197 1.00 0.00 H TER 49145 WAT 9866 ATOM 49145 O WAT 9867 130.642 21.306 116.960 1.00 0.00 O ATOM 49146 H1 WAT 9867 130.139 22.085 116.724 1.00 0.00 H ATOM 49147 H2 WAT 9867 130.210 20.969 117.744 1.00 0.00 H TER 49149 WAT 9867 ATOM 49149 O WAT 9868 7.572 113.087 99.771 1.00 0.00 O ATOM 49150 H1 WAT 9868 7.141 113.758 100.301 1.00 0.00 H ATOM 49151 H2 WAT 9868 7.746 112.373 100.384 1.00 0.00 H TER 49153 WAT 9868 ATOM 49153 O WAT 9869 67.743 50.602 97.646 1.00 0.00 O ATOM 49154 H1 WAT 9869 68.092 49.716 97.743 1.00 0.00 H ATOM 49155 H2 WAT 9869 67.043 50.656 98.296 1.00 0.00 H TER 49157 WAT 9869 ATOM 49157 O WAT 9870 125.501 95.210 123.768 1.00 0.00 O ATOM 49158 H1 WAT 9870 126.002 96.013 123.625 1.00 0.00 H ATOM 49159 H2 WAT 9870 126.159 94.555 124.002 1.00 0.00 H TER 49161 WAT 9870 ATOM 49161 O WAT 9871 3.638 136.657 18.215 1.00 0.00 O ATOM 49162 H1 WAT 9871 3.070 137.374 17.934 1.00 0.00 H ATOM 49163 H2 WAT 9871 3.629 136.704 19.171 1.00 0.00 H TER 49165 WAT 9871 ATOM 49165 O WAT 9872 53.670 27.042 105.092 1.00 0.00 O ATOM 49166 H1 WAT 9872 53.834 27.038 106.034 1.00 0.00 H ATOM 49167 H2 WAT 9872 52.866 27.553 104.991 1.00 0.00 H TER 49169 WAT 9872 ATOM 49169 O WAT 9873 7.134 71.520 150.877 1.00 0.00 O ATOM 49170 H1 WAT 9873 7.898 72.089 150.970 1.00 0.00 H ATOM 49171 H2 WAT 9873 6.724 71.527 151.742 1.00 0.00 H TER 49173 WAT 9873 ATOM 49173 O WAT 9874 47.743 9.293 64.847 1.00 0.00 O ATOM 49174 H1 WAT 9874 48.265 10.073 64.656 1.00 0.00 H ATOM 49175 H2 WAT 9874 47.980 8.672 64.158 1.00 0.00 H TER 49177 WAT 9874 ATOM 49177 O WAT 9875 115.402 115.923 18.807 1.00 0.00 O ATOM 49178 H1 WAT 9875 115.482 116.044 19.753 1.00 0.00 H ATOM 49179 H2 WAT 9875 114.711 116.532 18.546 1.00 0.00 H TER 49181 WAT 9875 ATOM 49181 O WAT 9876 85.165 51.606 105.588 1.00 0.00 O ATOM 49182 H1 WAT 9876 85.150 50.701 105.277 1.00 0.00 H ATOM 49183 H2 WAT 9876 84.336 51.714 106.054 1.00 0.00 H TER 49185 WAT 9876 ATOM 49185 O WAT 9877 1.794 39.525 119.152 1.00 0.00 O ATOM 49186 H1 WAT 9877 2.442 39.748 118.483 1.00 0.00 H ATOM 49187 H2 WAT 9877 2.171 39.851 119.969 1.00 0.00 H TER 49189 WAT 9877 ATOM 49189 O WAT 9878 145.803 45.893 145.219 1.00 0.00 O ATOM 49190 H1 WAT 9878 146.017 45.241 145.886 1.00 0.00 H ATOM 49191 H2 WAT 9878 144.970 46.266 145.509 1.00 0.00 H TER 49193 WAT 9878 ATOM 49193 O WAT 9879 67.274 140.456 131.268 1.00 0.00 O ATOM 49194 H1 WAT 9879 67.682 139.877 130.625 1.00 0.00 H ATOM 49195 H2 WAT 9879 67.708 141.299 131.140 1.00 0.00 H TER 49197 WAT 9879 ATOM 49197 O WAT 9880 23.272 77.782 158.094 1.00 0.00 O ATOM 49198 H1 WAT 9880 23.335 78.319 157.304 1.00 0.00 H ATOM 49199 H2 WAT 9880 22.798 76.999 157.814 1.00 0.00 H TER 49201 WAT 9880 ATOM 49201 O WAT 9881 111.916 92.097 99.791 1.00 0.00 O ATOM 49202 H1 WAT 9881 111.681 91.721 98.943 1.00 0.00 H ATOM 49203 H2 WAT 9881 112.682 92.642 99.607 1.00 0.00 H TER 49205 WAT 9881 ATOM 49205 O WAT 9882 77.768 143.604 144.849 1.00 0.00 O ATOM 49206 H1 WAT 9882 78.041 144.432 144.456 1.00 0.00 H ATOM 49207 H2 WAT 9882 78.355 142.952 144.466 1.00 0.00 H TER 49209 WAT 9882 ATOM 49209 O WAT 9883 124.922 112.292 66.695 1.00 0.00 O ATOM 49210 H1 WAT 9883 124.051 112.631 66.486 1.00 0.00 H ATOM 49211 H2 WAT 9883 124.870 111.358 66.494 1.00 0.00 H TER 49213 WAT 9883 ATOM 49213 O WAT 9884 25.276 100.856 93.410 1.00 0.00 O ATOM 49214 H1 WAT 9884 26.140 101.255 93.512 1.00 0.00 H ATOM 49215 H2 WAT 9884 25.443 100.042 92.934 1.00 0.00 H TER 49217 WAT 9884 ATOM 49217 O WAT 9885 7.009 22.259 89.345 1.00 0.00 O ATOM 49218 H1 WAT 9885 7.287 23.128 89.632 1.00 0.00 H ATOM 49219 H2 WAT 9885 6.106 22.182 89.655 1.00 0.00 H TER 49221 WAT 9885 ATOM 49221 O WAT 9886 40.736 24.635 135.390 1.00 0.00 O ATOM 49222 H1 WAT 9886 40.506 25.243 136.094 1.00 0.00 H ATOM 49223 H2 WAT 9886 40.963 25.200 134.651 1.00 0.00 H TER 49225 WAT 9886 ATOM 49225 O WAT 9887 72.046 71.282 85.216 1.00 0.00 O ATOM 49226 H1 WAT 9887 71.944 71.505 86.142 1.00 0.00 H ATOM 49227 H2 WAT 9887 72.990 71.191 85.094 1.00 0.00 H TER 49229 WAT 9887 ATOM 49229 O WAT 9888 126.558 120.427 15.818 1.00 0.00 O ATOM 49230 H1 WAT 9888 125.954 120.992 15.335 1.00 0.00 H ATOM 49231 H2 WAT 9888 126.116 120.261 16.651 1.00 0.00 H TER 49233 WAT 9888 ATOM 49233 O WAT 9889 74.666 142.267 15.207 1.00 0.00 O ATOM 49234 H1 WAT 9889 75.137 141.656 15.774 1.00 0.00 H ATOM 49235 H2 WAT 9889 73.795 142.332 15.597 1.00 0.00 H TER 49237 WAT 9889 ATOM 49237 O WAT 9890 28.218 10.125 151.800 1.00 0.00 O ATOM 49238 H1 WAT 9890 28.747 10.923 151.789 1.00 0.00 H ATOM 49239 H2 WAT 9890 27.413 10.379 152.253 1.00 0.00 H TER 49241 WAT 9890 ATOM 49241 O WAT 9891 145.729 17.428 59.366 1.00 0.00 O ATOM 49242 H1 WAT 9891 145.222 17.165 58.598 1.00 0.00 H ATOM 49243 H2 WAT 9891 146.455 16.805 59.399 1.00 0.00 H TER 49245 WAT 9891 ATOM 49245 O WAT 9892 144.665 122.681 67.469 1.00 0.00 O ATOM 49246 H1 WAT 9892 144.439 122.639 66.540 1.00 0.00 H ATOM 49247 H2 WAT 9892 144.395 121.832 67.820 1.00 0.00 H TER 49249 WAT 9892 ATOM 49249 O WAT 9893 11.659 24.611 100.625 1.00 0.00 O ATOM 49250 H1 WAT 9893 11.537 24.008 99.892 1.00 0.00 H ATOM 49251 H2 WAT 9893 11.333 25.451 100.303 1.00 0.00 H TER 49253 WAT 9893 ATOM 49253 O WAT 9894 116.943 114.913 143.772 1.00 0.00 O ATOM 49254 H1 WAT 9894 116.281 114.927 143.080 1.00 0.00 H ATOM 49255 H2 WAT 9894 116.447 114.746 144.574 1.00 0.00 H TER 49257 WAT 9894 ATOM 49257 O WAT 9895 105.771 121.960 4.042 1.00 0.00 O ATOM 49258 H1 WAT 9895 105.111 121.444 4.505 1.00 0.00 H ATOM 49259 H2 WAT 9895 105.420 122.850 4.039 1.00 0.00 H TER 49261 WAT 9895 ATOM 49261 O WAT 9896 14.406 110.713 90.672 1.00 0.00 O ATOM 49262 H1 WAT 9896 14.848 110.789 91.518 1.00 0.00 H ATOM 49263 H2 WAT 9896 14.717 109.883 90.312 1.00 0.00 H TER 49265 WAT 9896 ATOM 49265 O WAT 9897 47.644 33.254 6.400 1.00 0.00 O ATOM 49266 H1 WAT 9897 46.714 33.146 6.599 1.00 0.00 H ATOM 49267 H2 WAT 9897 47.713 34.144 6.055 1.00 0.00 H TER 49269 WAT 9897 ATOM 49269 O WAT 9898 73.319 132.190 83.137 1.00 0.00 O ATOM 49270 H1 WAT 9898 73.300 132.739 83.921 1.00 0.00 H ATOM 49271 H2 WAT 9898 73.363 132.811 82.410 1.00 0.00 H TER 49273 WAT 9898 ATOM 49273 O WAT 9899 133.329 94.170 61.101 1.00 0.00 O ATOM 49274 H1 WAT 9899 132.968 94.957 60.693 1.00 0.00 H ATOM 49275 H2 WAT 9899 133.223 93.487 60.439 1.00 0.00 H TER 49277 WAT 9899 ATOM 49277 O WAT 9900 81.203 38.140 11.656 1.00 0.00 O ATOM 49278 H1 WAT 9900 81.046 37.713 10.813 1.00 0.00 H ATOM 49279 H2 WAT 9900 82.151 38.087 11.777 1.00 0.00 H TER 49281 WAT 9900 ATOM 49281 O WAT 9901 145.690 24.429 123.769 1.00 0.00 O ATOM 49282 H1 WAT 9901 144.779 24.141 123.830 1.00 0.00 H ATOM 49283 H2 WAT 9901 145.809 25.010 124.520 1.00 0.00 H TER 49285 WAT 9901 ATOM 49285 O WAT 9902 79.458 137.950 86.120 1.00 0.00 O ATOM 49286 H1 WAT 9902 79.011 137.681 86.923 1.00 0.00 H ATOM 49287 H2 WAT 9902 80.382 137.763 86.287 1.00 0.00 H TER 49289 WAT 9902 ATOM 49289 O WAT 9903 57.629 121.908 97.688 1.00 0.00 O ATOM 49290 H1 WAT 9903 57.608 121.413 96.869 1.00 0.00 H ATOM 49291 H2 WAT 9903 58.498 122.309 97.703 1.00 0.00 H TER 49293 WAT 9903 ATOM 49293 O WAT 9904 144.307 43.815 101.585 1.00 0.00 O ATOM 49294 H1 WAT 9904 145.111 44.279 101.816 1.00 0.00 H ATOM 49295 H2 WAT 9904 144.381 42.971 102.032 1.00 0.00 H TER 49297 WAT 9904 ATOM 49297 O WAT 9905 20.163 35.572 6.300 1.00 0.00 O ATOM 49298 H1 WAT 9905 20.052 34.803 6.859 1.00 0.00 H ATOM 49299 H2 WAT 9905 19.685 35.356 5.499 1.00 0.00 H TER 49301 WAT 9905 ATOM 49301 O WAT 9906 145.259 94.676 148.482 1.00 0.00 O ATOM 49302 H1 WAT 9906 144.471 94.486 147.973 1.00 0.00 H ATOM 49303 H2 WAT 9906 145.423 95.607 148.331 1.00 0.00 H TER 49305 WAT 9906 ATOM 49305 O WAT 9907 68.614 69.169 120.613 1.00 0.00 O ATOM 49306 H1 WAT 9907 68.880 68.544 119.938 1.00 0.00 H ATOM 49307 H2 WAT 9907 69.248 69.882 120.541 1.00 0.00 H TER 49309 WAT 9907 ATOM 49309 O WAT 9908 39.009 71.454 3.058 1.00 0.00 O ATOM 49310 H1 WAT 9908 38.208 71.347 3.571 1.00 0.00 H ATOM 49311 H2 WAT 9908 38.823 71.013 2.229 1.00 0.00 H TER 49313 WAT 9908 ATOM 49313 O WAT 9909 103.888 140.186 145.238 1.00 0.00 O ATOM 49314 H1 WAT 9909 104.549 139.725 144.722 1.00 0.00 H ATOM 49315 H2 WAT 9909 104.344 140.956 145.579 1.00 0.00 H TER 49317 WAT 9909 ATOM 49317 O WAT 9910 115.566 33.248 122.450 1.00 0.00 O ATOM 49318 H1 WAT 9910 116.438 33.068 122.803 1.00 0.00 H ATOM 49319 H2 WAT 9910 115.708 33.361 121.510 1.00 0.00 H TER 49321 WAT 9910 ATOM 49321 O WAT 9911 70.921 90.736 4.959 1.00 0.00 O ATOM 49322 H1 WAT 9911 70.074 90.889 4.541 1.00 0.00 H ATOM 49323 H2 WAT 9911 71.356 90.096 4.395 1.00 0.00 H TER 49325 WAT 9911 ATOM 49325 O WAT 9912 112.668 107.946 135.396 1.00 0.00 O ATOM 49326 H1 WAT 9912 112.077 108.162 134.675 1.00 0.00 H ATOM 49327 H2 WAT 9912 113.510 108.318 135.135 1.00 0.00 H TER 49329 WAT 9912 ATOM 49329 O WAT 9913 91.865 136.802 9.828 1.00 0.00 O ATOM 49330 H1 WAT 9913 92.301 137.629 10.031 1.00 0.00 H ATOM 49331 H2 WAT 9913 90.950 137.042 9.682 1.00 0.00 H TER 49333 WAT 9913 ATOM 49333 O WAT 9914 127.721 36.738 94.879 1.00 0.00 O ATOM 49334 H1 WAT 9914 127.754 37.171 95.732 1.00 0.00 H ATOM 49335 H2 WAT 9914 128.528 36.223 94.841 1.00 0.00 H TER 49337 WAT 9914 ATOM 49337 O WAT 9915 50.496 105.016 24.625 1.00 0.00 O ATOM 49338 H1 WAT 9915 50.416 104.068 24.722 1.00 0.00 H ATOM 49339 H2 WAT 9915 49.841 105.246 23.966 1.00 0.00 H TER 49341 WAT 9915 ATOM 49341 O WAT 9916 58.518 20.413 144.163 1.00 0.00 O ATOM 49342 H1 WAT 9916 58.671 19.504 143.904 1.00 0.00 H ATOM 49343 H2 WAT 9916 57.904 20.748 143.509 1.00 0.00 H TER 49345 WAT 9916 ATOM 49345 O WAT 9917 138.295 14.343 134.652 1.00 0.00 O ATOM 49346 H1 WAT 9917 138.233 14.310 133.697 1.00 0.00 H ATOM 49347 H2 WAT 9917 137.429 14.075 134.958 1.00 0.00 H TER 49349 WAT 9917 ATOM 49349 O WAT 9918 48.209 34.767 127.596 1.00 0.00 O ATOM 49350 H1 WAT 9918 48.373 34.939 128.523 1.00 0.00 H ATOM 49351 H2 WAT 9918 48.258 35.628 127.181 1.00 0.00 H TER 49353 WAT 9918 ATOM 49353 O WAT 9919 21.147 49.201 59.827 1.00 0.00 O ATOM 49354 H1 WAT 9919 20.224 49.328 59.608 1.00 0.00 H ATOM 49355 H2 WAT 9919 21.557 50.044 59.634 1.00 0.00 H TER 49357 WAT 9919 ATOM 49357 O WAT 9920 11.833 34.062 145.179 1.00 0.00 O ATOM 49358 H1 WAT 9920 12.054 33.378 145.811 1.00 0.00 H ATOM 49359 H2 WAT 9920 11.826 33.612 144.334 1.00 0.00 H TER 49361 WAT 9920 ATOM 49361 O WAT 9921 85.088 47.078 122.091 1.00 0.00 O ATOM 49362 H1 WAT 9921 86.003 47.089 121.808 1.00 0.00 H ATOM 49363 H2 WAT 9921 84.948 46.187 122.411 1.00 0.00 H TER 49365 WAT 9921 ATOM 49365 O WAT 9922 68.741 115.778 64.764 1.00 0.00 O ATOM 49366 H1 WAT 9922 68.636 115.565 63.836 1.00 0.00 H ATOM 49367 H2 WAT 9922 69.499 116.361 64.792 1.00 0.00 H TER 49369 WAT 9922 ATOM 49369 O WAT 9923 8.235 125.945 149.074 1.00 0.00 O ATOM 49370 H1 WAT 9923 9.077 125.593 149.363 1.00 0.00 H ATOM 49371 H2 WAT 9923 7.979 126.554 149.767 1.00 0.00 H TER 49373 WAT 9923 ATOM 49373 O WAT 9924 94.295 137.640 93.247 1.00 0.00 O ATOM 49374 H1 WAT 9924 94.783 136.955 92.789 1.00 0.00 H ATOM 49375 H2 WAT 9924 93.442 137.246 93.428 1.00 0.00 H TER 49377 WAT 9924 ATOM 49377 O WAT 9925 8.984 42.009 20.013 1.00 0.00 O ATOM 49378 H1 WAT 9925 8.082 42.308 20.128 1.00 0.00 H ATOM 49379 H2 WAT 9925 9.503 42.813 19.992 1.00 0.00 H TER 49381 WAT 9925 ATOM 49381 O WAT 9926 31.799 17.515 92.899 1.00 0.00 O ATOM 49382 H1 WAT 9926 30.928 17.165 92.709 1.00 0.00 H ATOM 49383 H2 WAT 9926 32.364 16.743 92.938 1.00 0.00 H TER 49385 WAT 9926 ATOM 49385 O WAT 9927 37.574 63.330 145.275 1.00 0.00 O ATOM 49386 H1 WAT 9927 37.718 62.687 145.969 1.00 0.00 H ATOM 49387 H2 WAT 9927 37.782 62.861 144.467 1.00 0.00 H TER 49389 WAT 9927 ATOM 49389 O WAT 9928 95.410 26.475 95.723 1.00 0.00 O ATOM 49390 H1 WAT 9928 95.543 26.844 94.849 1.00 0.00 H ATOM 49391 H2 WAT 9928 96.048 25.764 95.781 1.00 0.00 H TER 49393 WAT 9928 ATOM 49393 O WAT 9929 127.027 99.096 77.772 1.00 0.00 O ATOM 49394 H1 WAT 9929 126.419 98.365 77.663 1.00 0.00 H ATOM 49395 H2 WAT 9929 126.670 99.596 78.506 1.00 0.00 H TER 49397 WAT 9929 ATOM 49397 O WAT 9930 128.463 117.835 17.264 1.00 0.00 O ATOM 49398 H1 WAT 9930 129.022 117.691 16.501 1.00 0.00 H ATOM 49399 H2 WAT 9930 128.582 118.760 17.478 1.00 0.00 H TER 49401 WAT 9930 ATOM 49401 O WAT 9931 1.628 123.618 112.050 1.00 0.00 O ATOM 49402 H1 WAT 9931 2.495 123.222 112.140 1.00 0.00 H ATOM 49403 H2 WAT 9931 1.801 124.505 111.735 1.00 0.00 H TER 49405 WAT 9931 ATOM 49405 O WAT 9932 144.536 17.569 109.187 1.00 0.00 O ATOM 49406 H1 WAT 9932 144.790 17.359 108.289 1.00 0.00 H ATOM 49407 H2 WAT 9932 144.962 18.408 109.366 1.00 0.00 H TER 49409 WAT 9932 ATOM 49409 O WAT 9933 71.002 87.618 25.761 1.00 0.00 O ATOM 49410 H1 WAT 9933 70.191 87.125 25.882 1.00 0.00 H ATOM 49411 H2 WAT 9933 70.783 88.286 25.112 1.00 0.00 H TER 49413 WAT 9933 ATOM 49413 O WAT 9934 90.112 100.598 104.271 1.00 0.00 O ATOM 49414 H1 WAT 9934 89.903 100.254 105.140 1.00 0.00 H ATOM 49415 H2 WAT 9934 90.810 100.028 103.949 1.00 0.00 H TER 49417 WAT 9934 ATOM 49417 O WAT 9935 3.373 40.056 101.280 1.00 0.00 O ATOM 49418 H1 WAT 9935 2.831 39.942 100.499 1.00 0.00 H ATOM 49419 H2 WAT 9935 3.692 39.176 101.481 1.00 0.00 H TER 49421 WAT 9935 ATOM 49421 O WAT 9936 142.907 88.353 20.944 1.00 0.00 O ATOM 49422 H1 WAT 9936 143.812 88.047 21.011 1.00 0.00 H ATOM 49423 H2 WAT 9936 142.853 89.076 21.568 1.00 0.00 H TER 49425 WAT 9936 ATOM 49425 O WAT 9937 86.227 117.309 9.094 1.00 0.00 O ATOM 49426 H1 WAT 9937 85.274 117.393 9.065 1.00 0.00 H ATOM 49427 H2 WAT 9937 86.398 116.789 9.880 1.00 0.00 H TER 49429 WAT 9937 ATOM 49429 O WAT 9938 91.171 138.057 141.157 1.00 0.00 O ATOM 49430 H1 WAT 9938 90.375 138.083 140.625 1.00 0.00 H ATOM 49431 H2 WAT 9938 90.881 138.305 142.034 1.00 0.00 H TER 49433 WAT 9938 ATOM 49433 O WAT 9939 52.054 135.592 131.391 1.00 0.00 O ATOM 49434 H1 WAT 9939 52.410 135.749 130.517 1.00 0.00 H ATOM 49435 H2 WAT 9939 51.130 135.392 131.242 1.00 0.00 H TER 49437 WAT 9939 ATOM 49437 O WAT 9940 23.587 5.336 146.408 1.00 0.00 O ATOM 49438 H1 WAT 9940 23.625 4.389 146.544 1.00 0.00 H ATOM 49439 H2 WAT 9940 23.821 5.455 145.488 1.00 0.00 H TER 49441 WAT 9940 ATOM 49441 O WAT 9941 102.545 2.886 117.743 1.00 0.00 O ATOM 49442 H1 WAT 9941 102.588 2.013 117.352 1.00 0.00 H ATOM 49443 H2 WAT 9941 101.819 3.316 117.291 1.00 0.00 H TER 49445 WAT 9941 ATOM 49445 O WAT 9942 21.745 59.014 7.666 1.00 0.00 O ATOM 49446 H1 WAT 9942 21.957 59.639 6.972 1.00 0.00 H ATOM 49447 H2 WAT 9942 20.788 59.007 7.696 1.00 0.00 H TER 49449 WAT 9942 ATOM 49449 O WAT 9943 81.960 11.754 8.281 1.00 0.00 O ATOM 49450 H1 WAT 9943 81.343 11.235 7.765 1.00 0.00 H ATOM 49451 H2 WAT 9943 81.504 11.917 9.107 1.00 0.00 H TER 49453 WAT 9943 ATOM 49453 O WAT 9944 37.682 125.854 69.875 1.00 0.00 O ATOM 49454 H1 WAT 9944 37.028 125.334 70.342 1.00 0.00 H ATOM 49455 H2 WAT 9944 38.017 126.463 70.533 1.00 0.00 H TER 49457 WAT 9944 ATOM 49457 O WAT 9945 31.052 48.629 96.392 1.00 0.00 O ATOM 49458 H1 WAT 9945 30.203 48.508 95.968 1.00 0.00 H ATOM 49459 H2 WAT 9945 31.166 49.578 96.435 1.00 0.00 H TER 49461 WAT 9945 ATOM 49461 O WAT 9946 105.380 95.477 68.459 1.00 0.00 O ATOM 49462 H1 WAT 9946 104.705 95.107 67.891 1.00 0.00 H ATOM 49463 H2 WAT 9946 105.880 96.061 67.888 1.00 0.00 H TER 49465 WAT 9946 ATOM 49465 O WAT 9947 95.973 71.457 124.427 1.00 0.00 O ATOM 49466 H1 WAT 9947 95.955 71.522 125.382 1.00 0.00 H ATOM 49467 H2 WAT 9947 95.470 70.666 124.232 1.00 0.00 H TER 49469 WAT 9947 ATOM 49469 O WAT 9948 132.924 73.311 76.911 1.00 0.00 O ATOM 49470 H1 WAT 9948 133.632 72.842 77.353 1.00 0.00 H ATOM 49471 H2 WAT 9948 133.131 74.236 77.042 1.00 0.00 H TER 49473 WAT 9948 ATOM 49473 O WAT 9949 16.403 93.567 105.603 1.00 0.00 O ATOM 49474 H1 WAT 9949 16.015 94.071 104.887 1.00 0.00 H ATOM 49475 H2 WAT 9949 17.333 93.793 105.578 1.00 0.00 H TER 49477 WAT 9949 ATOM 49477 O WAT 9950 66.081 41.277 116.473 1.00 0.00 O ATOM 49478 H1 WAT 9950 66.887 41.658 116.822 1.00 0.00 H ATOM 49479 H2 WAT 9950 65.575 41.035 117.249 1.00 0.00 H TER 49481 WAT 9950 ATOM 49481 O WAT 9951 12.126 104.622 104.103 1.00 0.00 O ATOM 49482 H1 WAT 9951 11.904 105.072 103.287 1.00 0.00 H ATOM 49483 H2 WAT 9951 12.547 105.293 104.640 1.00 0.00 H TER 49485 WAT 9951 ATOM 49485 O WAT 9952 50.409 42.225 149.009 1.00 0.00 O ATOM 49486 H1 WAT 9952 50.856 42.115 148.169 1.00 0.00 H ATOM 49487 H2 WAT 9952 50.595 43.130 149.261 1.00 0.00 H TER 49489 WAT 9952 ATOM 49489 O WAT 9953 123.665 4.898 65.138 1.00 0.00 O ATOM 49490 H1 WAT 9953 123.533 4.702 66.066 1.00 0.00 H ATOM 49491 H2 WAT 9953 123.964 4.072 64.759 1.00 0.00 H TER 49493 WAT 9953 ATOM 49493 O WAT 9954 16.139 77.187 4.303 1.00 0.00 O ATOM 49494 H1 WAT 9954 16.666 77.978 4.186 1.00 0.00 H ATOM 49495 H2 WAT 9954 15.730 77.043 3.449 1.00 0.00 H TER 49497 WAT 9954 ATOM 49497 O WAT 9955 37.140 114.083 13.058 1.00 0.00 O ATOM 49498 H1 WAT 9955 36.604 114.320 12.301 1.00 0.00 H ATOM 49499 H2 WAT 9955 36.636 113.403 13.505 1.00 0.00 H TER 49501 WAT 9955 ATOM 49501 O WAT 9956 14.998 65.812 102.219 1.00 0.00 O ATOM 49502 H1 WAT 9956 14.496 66.470 102.699 1.00 0.00 H ATOM 49503 H2 WAT 9956 15.909 66.087 102.317 1.00 0.00 H TER 49505 WAT 9956 ATOM 49505 O WAT 9957 59.405 144.053 92.248 1.00 0.00 O ATOM 49506 H1 WAT 9957 58.605 143.673 91.885 1.00 0.00 H ATOM 49507 H2 WAT 9957 60.047 143.980 91.542 1.00 0.00 H TER 49509 WAT 9957 ATOM 49509 O WAT 9958 40.626 131.262 63.923 1.00 0.00 O ATOM 49510 H1 WAT 9958 39.930 130.665 64.200 1.00 0.00 H ATOM 49511 H2 WAT 9958 41.281 130.693 63.518 1.00 0.00 H TER 49513 WAT 9958 ATOM 49513 O WAT 9959 27.137 144.724 61.901 1.00 0.00 O ATOM 49514 H1 WAT 9959 27.071 145.607 61.536 1.00 0.00 H ATOM 49515 H2 WAT 9959 27.223 144.155 61.136 1.00 0.00 H TER 49517 WAT 9959 ATOM 49517 O WAT 9960 117.738 142.694 80.620 1.00 0.00 O ATOM 49518 H1 WAT 9960 116.866 142.800 81.000 1.00 0.00 H ATOM 49519 H2 WAT 9960 117.926 141.760 80.708 1.00 0.00 H TER 49521 WAT 9960 ATOM 49521 O WAT 9961 29.324 113.068 72.538 1.00 0.00 O ATOM 49522 H1 WAT 9961 29.626 113.546 73.310 1.00 0.00 H ATOM 49523 H2 WAT 9961 29.476 112.147 72.753 1.00 0.00 H TER 49525 WAT 9961 ATOM 49525 O WAT 9962 123.794 55.646 121.030 1.00 0.00 O ATOM 49526 H1 WAT 9962 123.199 55.447 120.306 1.00 0.00 H ATOM 49527 H2 WAT 9962 123.349 56.336 121.522 1.00 0.00 H TER 49529 WAT 9962 ATOM 49529 O WAT 9963 17.764 119.596 157.074 1.00 0.00 O ATOM 49530 H1 WAT 9963 17.198 120.326 157.325 1.00 0.00 H ATOM 49531 H2 WAT 9963 18.322 119.453 157.838 1.00 0.00 H TER 49533 WAT 9963 ATOM 49533 O WAT 9964 2.250 61.067 154.436 1.00 0.00 O ATOM 49534 H1 WAT 9964 2.686 61.421 153.661 1.00 0.00 H ATOM 49535 H2 WAT 9964 1.680 61.776 154.734 1.00 0.00 H TER 49537 WAT 9964 ATOM 49537 O WAT 9965 101.051 119.795 154.492 1.00 0.00 O ATOM 49538 H1 WAT 9965 101.522 118.965 154.577 1.00 0.00 H ATOM 49539 H2 WAT 9965 100.389 119.627 153.821 1.00 0.00 H TER 49541 WAT 9965 ATOM 49541 O WAT 9966 51.878 116.887 119.693 1.00 0.00 O ATOM 49542 H1 WAT 9966 51.586 117.691 120.123 1.00 0.00 H ATOM 49543 H2 WAT 9966 51.111 116.582 119.208 1.00 0.00 H TER 49545 WAT 9966 ATOM 49545 O WAT 9967 53.684 15.379 106.673 1.00 0.00 O ATOM 49546 H1 WAT 9967 53.166 15.389 105.868 1.00 0.00 H ATOM 49547 H2 WAT 9967 54.288 14.645 106.561 1.00 0.00 H TER 49549 WAT 9967 ATOM 49549 O WAT 9968 57.256 12.288 0.468 1.00 0.00 O ATOM 49550 H1 WAT 9968 58.152 12.079 0.205 1.00 0.00 H ATOM 49551 H2 WAT 9968 56.714 11.969 -0.255 1.00 0.00 H TER 49553 WAT 9968 ATOM 49553 O WAT 9969 68.099 79.669 130.069 1.00 0.00 O ATOM 49554 H1 WAT 9969 68.647 80.324 130.500 1.00 0.00 H ATOM 49555 H2 WAT 9969 67.516 80.177 129.506 1.00 0.00 H TER 49557 WAT 9969 ATOM 49557 O WAT 9970 59.800 26.363 13.271 1.00 0.00 O ATOM 49558 H1 WAT 9970 59.676 25.942 14.122 1.00 0.00 H ATOM 49559 H2 WAT 9970 60.066 27.258 13.483 1.00 0.00 H TER 49561 WAT 9970 ATOM 49561 O WAT 9971 44.147 92.223 75.931 1.00 0.00 O ATOM 49562 H1 WAT 9971 43.384 92.215 76.510 1.00 0.00 H ATOM 49563 H2 WAT 9971 44.669 92.966 76.233 1.00 0.00 H TER 49565 WAT 9971 ATOM 49565 O WAT 9972 124.506 46.311 22.853 1.00 0.00 O ATOM 49566 H1 WAT 9972 125.028 45.721 23.397 1.00 0.00 H ATOM 49567 H2 WAT 9972 123.621 45.949 22.888 1.00 0.00 H TER 49569 WAT 9972 ATOM 49569 O WAT 9973 23.469 44.270 114.755 1.00 0.00 O ATOM 49570 H1 WAT 9973 23.253 43.405 114.408 1.00 0.00 H ATOM 49571 H2 WAT 9973 22.989 44.323 115.581 1.00 0.00 H TER 49573 WAT 9973 ATOM 49573 O WAT 9974 44.187 2.249 95.426 1.00 0.00 O ATOM 49574 H1 WAT 9974 44.884 2.891 95.560 1.00 0.00 H ATOM 49575 H2 WAT 9974 43.575 2.407 96.146 1.00 0.00 H TER 49577 WAT 9974 ATOM 49577 O WAT 9975 24.302 29.943 58.722 1.00 0.00 O ATOM 49578 H1 WAT 9975 23.476 30.111 59.175 1.00 0.00 H ATOM 49579 H2 WAT 9975 24.285 29.005 58.532 1.00 0.00 H TER 49581 WAT 9975 ATOM 49581 O WAT 9976 98.062 27.251 103.275 1.00 0.00 O ATOM 49582 H1 WAT 9976 97.305 26.849 102.848 1.00 0.00 H ATOM 49583 H2 WAT 9976 97.924 27.090 104.208 1.00 0.00 H TER 49585 WAT 9976 ATOM 49585 O WAT 9977 71.434 27.712 148.401 1.00 0.00 O ATOM 49586 H1 WAT 9977 72.335 27.528 148.667 1.00 0.00 H ATOM 49587 H2 WAT 9977 71.268 27.100 147.683 1.00 0.00 H TER 49589 WAT 9977 ATOM 49589 O WAT 9978 40.058 98.309 17.981 1.00 0.00 O ATOM 49590 H1 WAT 9978 40.377 98.489 17.096 1.00 0.00 H ATOM 49591 H2 WAT 9978 40.602 98.856 18.547 1.00 0.00 H TER 49593 WAT 9978 ATOM 49593 O WAT 9979 138.609 10.719 61.173 1.00 0.00 O ATOM 49594 H1 WAT 9979 137.860 10.720 60.579 1.00 0.00 H ATOM 49595 H2 WAT 9979 138.466 9.959 61.738 1.00 0.00 H TER 49597 WAT 9979 ATOM 49597 O WAT 9980 5.483 139.513 80.488 1.00 0.00 O ATOM 49598 H1 WAT 9980 4.861 139.434 79.765 1.00 0.00 H ATOM 49599 H2 WAT 9980 6.188 140.059 80.140 1.00 0.00 H TER 49601 WAT 9980 ATOM 49601 O WAT 9981 131.822 131.458 84.870 1.00 0.00 O ATOM 49602 H1 WAT 9981 131.477 130.835 84.231 1.00 0.00 H ATOM 49603 H2 WAT 9981 132.772 131.350 84.821 1.00 0.00 H TER 49605 WAT 9981 ATOM 49605 O WAT 9982 104.486 94.775 64.143 1.00 0.00 O ATOM 49606 H1 WAT 9982 104.075 95.446 63.597 1.00 0.00 H ATOM 49607 H2 WAT 9982 104.529 94.002 63.581 1.00 0.00 H TER 49609 WAT 9982 ATOM 49609 O WAT 9983 23.209 114.819 122.785 1.00 0.00 O ATOM 49610 H1 WAT 9983 23.959 115.014 123.348 1.00 0.00 H ATOM 49611 H2 WAT 9983 23.054 113.882 122.909 1.00 0.00 H TER 49613 WAT 9983 ATOM 49613 O WAT 9984 144.862 2.808 81.653 1.00 0.00 O ATOM 49614 H1 WAT 9984 144.771 2.285 80.857 1.00 0.00 H ATOM 49615 H2 WAT 9984 144.199 3.493 81.568 1.00 0.00 H TER 49617 WAT 9984 ATOM 49617 O WAT 9985 116.856 65.228 74.299 1.00 0.00 O ATOM 49618 H1 WAT 9985 117.763 65.530 74.250 1.00 0.00 H ATOM 49619 H2 WAT 9985 116.338 66.032 74.344 1.00 0.00 H TER 49621 WAT 9985 ATOM 49621 O WAT 9986 47.936 11.516 96.573 1.00 0.00 O ATOM 49622 H1 WAT 9986 48.548 10.791 96.695 1.00 0.00 H ATOM 49623 H2 WAT 9986 47.739 11.509 95.636 1.00 0.00 H TER 49625 WAT 9986 ATOM 49625 O WAT 9987 84.101 27.795 129.149 1.00 0.00 O ATOM 49626 H1 WAT 9987 83.566 28.579 129.270 1.00 0.00 H ATOM 49627 H2 WAT 9987 84.968 28.045 129.466 1.00 0.00 H TER 49629 WAT 9987 ATOM 49629 O WAT 9988 120.703 32.840 118.190 1.00 0.00 O ATOM 49630 H1 WAT 9988 119.864 33.122 118.556 1.00 0.00 H ATOM 49631 H2 WAT 9988 120.477 32.451 117.345 1.00 0.00 H TER 49633 WAT 9988 ATOM 49633 O WAT 9989 37.771 98.901 12.976 1.00 0.00 O ATOM 49634 H1 WAT 9989 36.965 99.388 13.149 1.00 0.00 H ATOM 49635 H2 WAT 9989 37.916 98.388 13.771 1.00 0.00 H TER 49637 WAT 9989 ATOM 49637 O WAT 9990 110.159 22.011 148.782 1.00 0.00 O ATOM 49638 H1 WAT 9990 110.864 21.574 149.260 1.00 0.00 H ATOM 49639 H2 WAT 9990 110.287 22.942 148.966 1.00 0.00 H TER 49641 WAT 9990 ATOM 49641 O WAT 9991 126.767 63.648 88.177 1.00 0.00 O ATOM 49642 H1 WAT 9991 127.089 63.477 89.062 1.00 0.00 H ATOM 49643 H2 WAT 9991 127.067 64.535 87.980 1.00 0.00 H TER 49645 WAT 9991 ATOM 49645 O WAT 9992 67.218 65.984 140.431 1.00 0.00 O ATOM 49646 H1 WAT 9992 66.573 65.454 140.899 1.00 0.00 H ATOM 49647 H2 WAT 9992 67.732 66.401 141.122 1.00 0.00 H TER 49649 WAT 9992 ATOM 49649 O WAT 9993 140.091 41.985 133.244 1.00 0.00 O ATOM 49650 H1 WAT 9993 139.948 41.262 132.633 1.00 0.00 H ATOM 49651 H2 WAT 9993 140.578 41.593 133.969 1.00 0.00 H TER 49653 WAT 9993 ATOM 49653 O WAT 9994 96.217 129.940 100.182 1.00 0.00 O ATOM 49654 H1 WAT 9994 95.929 129.537 99.363 1.00 0.00 H ATOM 49655 H2 WAT 9994 96.109 129.252 100.838 1.00 0.00 H TER 49657 WAT 9994 ATOM 49657 O WAT 9995 19.278 119.643 73.022 1.00 0.00 O ATOM 49658 H1 WAT 9995 19.292 120.515 72.629 1.00 0.00 H ATOM 49659 H2 WAT 9995 18.917 119.780 73.897 1.00 0.00 H TER 49661 WAT 9995 ATOM 49661 O WAT 9996 115.129 34.164 126.735 1.00 0.00 O ATOM 49662 H1 WAT 9996 114.625 34.433 127.503 1.00 0.00 H ATOM 49663 H2 WAT 9996 115.648 33.419 127.038 1.00 0.00 H TER 49665 WAT 9996 ATOM 49665 O WAT 9997 93.748 12.028 90.008 1.00 0.00 O ATOM 49666 H1 WAT 9997 94.196 11.182 90.014 1.00 0.00 H ATOM 49667 H2 WAT 9997 93.132 11.969 89.278 1.00 0.00 H TER 49669 WAT 9997 ATOM 49669 O WAT 9998 69.942 18.408 96.253 1.00 0.00 O ATOM 49670 H1 WAT 9998 68.989 18.435 96.160 1.00 0.00 H ATOM 49671 H2 WAT 9998 70.086 18.060 97.133 1.00 0.00 H TER 49673 WAT 9998 ATOM 49673 O WAT 9999 30.458 42.200 6.384 1.00 0.00 O ATOM 49674 H1 WAT 9999 30.180 42.657 5.590 1.00 0.00 H ATOM 49675 H2 WAT 9999 30.494 41.278 6.129 1.00 0.00 H TER 49677 WAT 9999 ATOM 49677 O WAT 0 106.471 33.497 8.932 1.00 0.00 O ATOM 49678 H1 WAT 0 106.333 34.392 9.241 1.00 0.00 H ATOM 49679 H2 WAT 0 106.184 32.945 9.660 1.00 0.00 H TER 49681 WAT 0 ATOM 49681 O WAT 1 15.634 81.875 137.529 1.00 0.00 O ATOM 49682 H1 WAT 1 16.425 82.101 137.039 1.00 0.00 H ATOM 49683 H2 WAT 1 15.592 82.526 138.230 1.00 0.00 H TER 49685 WAT 1 ATOM 49685 O WAT 2 24.172 104.355 100.271 1.00 0.00 O ATOM 49686 H1 WAT 2 24.232 103.840 101.076 1.00 0.00 H ATOM 49687 H2 WAT 2 23.559 105.059 100.482 1.00 0.00 H TER 49689 WAT 2 ATOM 49689 O WAT 3 93.790 46.623 115.008 1.00 0.00 O ATOM 49690 H1 WAT 3 92.895 46.319 114.852 1.00 0.00 H ATOM 49691 H2 WAT 3 94.309 46.200 114.325 1.00 0.00 H TER 49693 WAT 3 ATOM 49693 O WAT 4 33.907 42.413 115.966 1.00 0.00 O ATOM 49694 H1 WAT 4 33.404 41.884 115.346 1.00 0.00 H ATOM 49695 H2 WAT 4 34.465 41.782 116.421 1.00 0.00 H TER 49697 WAT 4 ATOM 49697 O WAT 5 84.002 96.732 14.535 1.00 0.00 O ATOM 49698 H1 WAT 5 83.882 97.561 15.000 1.00 0.00 H ATOM 49699 H2 WAT 5 83.176 96.596 14.072 1.00 0.00 H TER 49701 WAT 5 ATOM 49701 O WAT 6 84.241 143.703 15.654 1.00 0.00 O ATOM 49702 H1 WAT 6 84.536 143.794 16.560 1.00 0.00 H ATOM 49703 H2 WAT 6 83.565 144.372 15.553 1.00 0.00 H TER 49705 WAT 6 ATOM 49705 O WAT 7 69.776 10.165 121.352 1.00 0.00 O ATOM 49706 H1 WAT 7 69.830 10.490 120.453 1.00 0.00 H ATOM 49707 H2 WAT 7 70.616 10.405 121.744 1.00 0.00 H TER 49709 WAT 7 ATOM 49709 O WAT 8 63.185 139.266 68.264 1.00 0.00 O ATOM 49710 H1 WAT 8 63.587 138.397 68.283 1.00 0.00 H ATOM 49711 H2 WAT 8 63.926 139.872 68.275 1.00 0.00 H TER 49713 WAT 8 ATOM 49713 O WAT 9 133.287 30.209 73.845 1.00 0.00 O ATOM 49714 H1 WAT 9 133.366 30.256 74.798 1.00 0.00 H ATOM 49715 H2 WAT 9 132.551 29.616 73.695 1.00 0.00 H TER 49717 WAT 9 ATOM 49717 O WAT 10 40.462 98.736 67.477 1.00 0.00 O ATOM 49718 H1 WAT 10 41.267 99.147 67.793 1.00 0.00 H ATOM 49719 H2 WAT 10 40.539 98.762 66.523 1.00 0.00 H TER 49721 WAT 10 ATOM 49721 O WAT 11 135.264 89.381 12.980 1.00 0.00 O ATOM 49722 H1 WAT 11 134.762 89.154 13.762 1.00 0.00 H ATOM 49723 H2 WAT 11 134.639 89.297 12.261 1.00 0.00 H TER 49725 WAT 11 ATOM 49725 O WAT 12 127.571 106.259 6.738 1.00 0.00 O ATOM 49726 H1 WAT 12 127.876 107.138 6.964 1.00 0.00 H ATOM 49727 H2 WAT 12 127.254 105.896 7.565 1.00 0.00 H TER 49729 WAT 12 ATOM 49729 O WAT 13 40.203 54.906 105.354 1.00 0.00 O ATOM 49730 H1 WAT 13 39.641 54.673 104.615 1.00 0.00 H ATOM 49731 H2 WAT 13 39.739 55.620 105.791 1.00 0.00 H TER 49733 WAT 13 ATOM 49733 O WAT 14 138.482 101.316 145.102 1.00 0.00 O ATOM 49734 H1 WAT 14 139.341 100.899 145.028 1.00 0.00 H ATOM 49735 H2 WAT 14 138.309 101.664 144.228 1.00 0.00 H TER 49737 WAT 14 ATOM 49737 O WAT 15 18.463 85.098 111.374 1.00 0.00 O ATOM 49738 H1 WAT 15 17.508 85.137 111.425 1.00 0.00 H ATOM 49739 H2 WAT 15 18.650 84.214 111.056 1.00 0.00 H TER 49741 WAT 15 ATOM 49741 O WAT 16 84.088 124.286 102.179 1.00 0.00 O ATOM 49742 H1 WAT 16 83.938 124.769 102.992 1.00 0.00 H ATOM 49743 H2 WAT 16 85.029 124.110 102.176 1.00 0.00 H TER 49745 WAT 16 ATOM 49745 O WAT 17 16.865 17.677 83.803 1.00 0.00 O ATOM 49746 H1 WAT 17 16.038 18.139 83.670 1.00 0.00 H ATOM 49747 H2 WAT 17 17.105 17.359 82.933 1.00 0.00 H TER 49749 WAT 17 ATOM 49749 O WAT 18 96.865 5.459 63.167 1.00 0.00 O ATOM 49750 H1 WAT 18 96.181 5.838 62.615 1.00 0.00 H ATOM 49751 H2 WAT 18 97.318 4.839 62.595 1.00 0.00 H TER 49753 WAT 18 ATOM 49753 O WAT 19 108.964 131.882 129.965 1.00 0.00 O ATOM 49754 H1 WAT 19 108.751 132.133 129.066 1.00 0.00 H ATOM 49755 H2 WAT 19 108.492 131.060 130.101 1.00 0.00 H TER 49757 WAT 19 ATOM 49757 O WAT 20 10.591 69.167 73.706 1.00 0.00 O ATOM 49758 H1 WAT 20 10.364 68.266 73.936 1.00 0.00 H ATOM 49759 H2 WAT 20 10.776 69.136 72.767 1.00 0.00 H TER 49761 WAT 20 ATOM 49761 O WAT 21 102.516 61.066 89.580 1.00 0.00 O ATOM 49762 H1 WAT 21 102.467 61.526 90.417 1.00 0.00 H ATOM 49763 H2 WAT 21 102.337 61.740 88.925 1.00 0.00 H TER 49765 WAT 21 ATOM 49765 O WAT 22 77.362 18.059 96.441 1.00 0.00 O ATOM 49766 H1 WAT 22 77.881 17.596 97.098 1.00 0.00 H ATOM 49767 H2 WAT 22 78.002 18.571 95.947 1.00 0.00 H TER 49769 WAT 22 ATOM 49769 O WAT 23 32.852 132.436 62.004 1.00 0.00 O ATOM 49770 H1 WAT 23 33.461 132.679 61.307 1.00 0.00 H ATOM 49771 H2 WAT 23 33.412 132.266 62.762 1.00 0.00 H TER 49773 WAT 23 ATOM 49773 O WAT 24 124.169 91.082 90.713 1.00 0.00 O ATOM 49774 H1 WAT 24 123.773 91.953 90.712 1.00 0.00 H ATOM 49775 H2 WAT 24 123.810 90.657 91.493 1.00 0.00 H TER 49777 WAT 24 ATOM 49777 O WAT 25 81.936 82.762 12.074 1.00 0.00 O ATOM 49778 H1 WAT 25 81.049 82.405 12.022 1.00 0.00 H ATOM 49779 H2 WAT 25 81.811 83.683 12.302 1.00 0.00 H TER 49781 WAT 25 ATOM 49781 O WAT 26 136.450 48.853 25.978 1.00 0.00 O ATOM 49782 H1 WAT 26 135.661 48.399 26.272 1.00 0.00 H ATOM 49783 H2 WAT 26 136.264 49.093 25.070 1.00 0.00 H TER 49785 WAT 26 ATOM 49785 O WAT 27 34.198 123.353 11.317 1.00 0.00 O ATOM 49786 H1 WAT 27 33.979 123.032 10.442 1.00 0.00 H ATOM 49787 H2 WAT 27 34.565 124.225 11.168 1.00 0.00 H TER 49789 WAT 27 ATOM 49789 O WAT 28 72.683 106.053 90.133 1.00 0.00 O ATOM 49790 H1 WAT 28 73.258 106.500 89.512 1.00 0.00 H ATOM 49791 H2 WAT 28 72.087 105.543 89.584 1.00 0.00 H TER 49793 WAT 28 ATOM 49793 O WAT 29 120.290 51.755 100.326 1.00 0.00 O ATOM 49794 H1 WAT 29 121.073 51.204 100.300 1.00 0.00 H ATOM 49795 H2 WAT 29 120.531 52.486 100.895 1.00 0.00 H TER 49797 WAT 29 ATOM 49797 O WAT 30 122.224 103.828 117.877 1.00 0.00 O ATOM 49798 H1 WAT 30 121.923 104.736 117.880 1.00 0.00 H ATOM 49799 H2 WAT 30 122.939 103.811 118.514 1.00 0.00 H TER 49801 WAT 30 ATOM 49801 O WAT 31 15.344 22.952 21.771 1.00 0.00 O ATOM 49802 H1 WAT 31 15.983 23.657 21.876 1.00 0.00 H ATOM 49803 H2 WAT 31 14.556 23.275 22.207 1.00 0.00 H TER 49805 WAT 31 ATOM 49805 O WAT 32 136.416 10.874 109.615 1.00 0.00 O ATOM 49806 H1 WAT 32 136.027 10.105 109.197 1.00 0.00 H ATOM 49807 H2 WAT 32 135.724 11.535 109.591 1.00 0.00 H TER 49809 WAT 32 ATOM 49809 O WAT 33 72.015 129.623 149.456 1.00 0.00 O ATOM 49810 H1 WAT 33 72.862 130.012 149.238 1.00 0.00 H ATOM 49811 H2 WAT 33 71.554 130.309 149.939 1.00 0.00 H TER 49813 WAT 33 ATOM 49813 O WAT 34 0.049 68.865 85.186 1.00 0.00 O ATOM 49814 H1 WAT 34 -0.516 68.170 84.848 1.00 0.00 H ATOM 49815 H2 WAT 34 0.607 68.428 85.829 1.00 0.00 H TER 49817 WAT 34 ATOM 49817 O WAT 35 122.747 127.806 123.313 1.00 0.00 O ATOM 49818 H1 WAT 35 122.584 128.237 122.474 1.00 0.00 H ATOM 49819 H2 WAT 35 123.298 128.422 123.795 1.00 0.00 H TER 49821 WAT 35 ATOM 49821 O WAT 36 135.364 14.106 102.066 1.00 0.00 O ATOM 49822 H1 WAT 36 135.285 13.330 102.621 1.00 0.00 H ATOM 49823 H2 WAT 36 136.249 14.431 102.234 1.00 0.00 H TER 49825 WAT 36 ATOM 49825 O WAT 37 102.768 49.400 69.601 1.00 0.00 O ATOM 49826 H1 WAT 37 102.059 49.822 69.116 1.00 0.00 H ATOM 49827 H2 WAT 37 103.531 49.480 69.028 1.00 0.00 H TER 49829 WAT 37 ATOM 49829 O WAT 38 52.002 120.301 135.882 1.00 0.00 O ATOM 49830 H1 WAT 38 51.248 120.455 135.313 1.00 0.00 H ATOM 49831 H2 WAT 38 51.624 119.971 136.697 1.00 0.00 H TER 49833 WAT 38 ATOM 49833 O WAT 39 136.887 22.841 130.340 1.00 0.00 O ATOM 49834 H1 WAT 39 136.494 23.684 130.566 1.00 0.00 H ATOM 49835 H2 WAT 39 136.405 22.203 130.867 1.00 0.00 H TER 49837 WAT 39 ATOM 49837 O WAT 40 39.348 69.149 95.759 1.00 0.00 O ATOM 49838 H1 WAT 40 40.119 69.236 96.319 1.00 0.00 H ATOM 49839 H2 WAT 40 38.941 68.328 96.035 1.00 0.00 H TER 49841 WAT 40 ATOM 49841 O WAT 41 45.085 140.451 149.371 1.00 0.00 O ATOM 49842 H1 WAT 41 45.182 140.468 150.323 1.00 0.00 H ATOM 49843 H2 WAT 41 45.888 140.855 149.042 1.00 0.00 H TER 49845 WAT 41 ATOM 49845 O WAT 42 112.871 136.213 16.079 1.00 0.00 O ATOM 49846 H1 WAT 42 113.587 135.768 16.533 1.00 0.00 H ATOM 49847 H2 WAT 42 112.491 135.540 15.514 1.00 0.00 H TER 49849 WAT 42 ATOM 49849 O WAT 43 125.840 51.850 142.418 1.00 0.00 O ATOM 49850 H1 WAT 43 126.591 52.201 141.941 1.00 0.00 H ATOM 49851 H2 WAT 43 126.221 51.247 143.056 1.00 0.00 H TER 49853 WAT 43 ATOM 49853 O WAT 44 112.709 6.115 1.401 1.00 0.00 O ATOM 49854 H1 WAT 44 112.969 6.357 2.290 1.00 0.00 H ATOM 49855 H2 WAT 44 112.013 6.733 1.179 1.00 0.00 H TER 49857 WAT 44 ATOM 49857 O WAT 45 78.824 61.935 20.252 1.00 0.00 O ATOM 49858 H1 WAT 45 79.480 61.276 20.479 1.00 0.00 H ATOM 49859 H2 WAT 45 79.115 62.728 20.702 1.00 0.00 H TER 49861 WAT 45 ATOM 49861 O WAT 46 59.467 41.595 156.545 1.00 0.00 O ATOM 49862 H1 WAT 46 60.219 41.010 156.459 1.00 0.00 H ATOM 49863 H2 WAT 46 58.846 41.284 155.886 1.00 0.00 H TER 49865 WAT 46 ATOM 49865 O WAT 47 47.562 134.208 139.306 1.00 0.00 O ATOM 49866 H1 WAT 47 46.837 134.416 139.895 1.00 0.00 H ATOM 49867 H2 WAT 47 47.142 134.023 138.466 1.00 0.00 H TER 49869 WAT 47 ATOM 49869 O WAT 48 119.003 35.198 18.205 1.00 0.00 O ATOM 49870 H1 WAT 48 118.446 34.957 17.465 1.00 0.00 H ATOM 49871 H2 WAT 48 118.393 35.510 18.873 1.00 0.00 H TER 49873 WAT 48 ATOM 49873 O WAT 49 117.660 43.695 59.177 1.00 0.00 O ATOM 49874 H1 WAT 49 117.606 43.417 58.262 1.00 0.00 H ATOM 49875 H2 WAT 49 117.066 44.443 59.235 1.00 0.00 H TER 49877 WAT 49 ATOM 49877 O WAT 50 99.396 2.857 117.607 1.00 0.00 O ATOM 49878 H1 WAT 50 98.520 3.139 117.346 1.00 0.00 H ATOM 49879 H2 WAT 50 99.426 1.927 117.382 1.00 0.00 H TER 49881 WAT 50 ATOM 49881 O WAT 51 42.113 65.799 133.259 1.00 0.00 O ATOM 49882 H1 WAT 51 42.132 66.050 134.182 1.00 0.00 H ATOM 49883 H2 WAT 51 41.389 65.176 133.195 1.00 0.00 H TER 49885 WAT 51 ATOM 49885 O WAT 52 91.818 40.974 140.580 1.00 0.00 O ATOM 49886 H1 WAT 52 91.563 41.700 141.151 1.00 0.00 H ATOM 49887 H2 WAT 52 92.407 40.444 141.117 1.00 0.00 H TER 49889 WAT 52 ATOM 49889 O WAT 53 63.490 23.665 140.421 1.00 0.00 O ATOM 49890 H1 WAT 53 64.364 23.354 140.656 1.00 0.00 H ATOM 49891 H2 WAT 53 63.556 23.889 139.493 1.00 0.00 H TER 49893 WAT 53 ATOM 49893 O WAT 54 1.283 4.237 129.147 1.00 0.00 O ATOM 49894 H1 WAT 54 0.932 3.852 128.344 1.00 0.00 H ATOM 49895 H2 WAT 54 1.522 5.131 128.900 1.00 0.00 H TER 49897 WAT 54 ATOM 49897 O WAT 55 32.059 12.261 93.781 1.00 0.00 O ATOM 49898 H1 WAT 55 32.499 11.777 93.082 1.00 0.00 H ATOM 49899 H2 WAT 55 32.391 13.155 93.700 1.00 0.00 H TER 49901 WAT 55 ATOM 49901 O WAT 56 102.555 86.671 4.008 1.00 0.00 O ATOM 49902 H1 WAT 56 103.075 87.191 4.621 1.00 0.00 H ATOM 49903 H2 WAT 56 102.965 86.824 3.157 1.00 0.00 H TER 49905 WAT 56 ATOM 49905 O WAT 57 136.037 4.999 8.333 1.00 0.00 O ATOM 49906 H1 WAT 57 136.379 4.479 9.061 1.00 0.00 H ATOM 49907 H2 WAT 57 136.396 5.875 8.475 1.00 0.00 H TER 49909 WAT 57 ATOM 49909 O WAT 58 146.076 10.893 110.843 1.00 0.00 O ATOM 49910 H1 WAT 58 145.458 10.327 111.306 1.00 0.00 H ATOM 49911 H2 WAT 58 145.619 11.730 110.760 1.00 0.00 H TER 49913 WAT 58 ATOM 49913 O WAT 59 43.285 83.577 3.825 1.00 0.00 O ATOM 49914 H1 WAT 59 42.848 82.773 3.546 1.00 0.00 H ATOM 49915 H2 WAT 59 44.167 83.510 3.459 1.00 0.00 H TER 49917 WAT 59 ATOM 49917 O WAT 60 136.383 135.549 9.119 1.00 0.00 O ATOM 49918 H1 WAT 60 135.940 136.246 8.635 1.00 0.00 H ATOM 49919 H2 WAT 60 135.706 134.887 9.258 1.00 0.00 H TER 49921 WAT 60 ATOM 49921 O WAT 61 103.731 8.507 22.400 1.00 0.00 O ATOM 49922 H1 WAT 61 104.495 8.933 22.790 1.00 0.00 H ATOM 49923 H2 WAT 61 103.610 7.712 22.918 1.00 0.00 H TER 49925 WAT 61 ATOM 49925 O WAT 62 125.203 106.702 64.741 1.00 0.00 O ATOM 49926 H1 WAT 62 125.722 106.904 65.519 1.00 0.00 H ATOM 49927 H2 WAT 62 125.445 105.804 64.517 1.00 0.00 H TER 49929 WAT 62 ATOM 49929 O WAT 63 47.936 23.371 117.803 1.00 0.00 O ATOM 49930 H1 WAT 63 47.525 22.517 117.937 1.00 0.00 H ATOM 49931 H2 WAT 63 48.698 23.186 117.254 1.00 0.00 H TER 49933 WAT 63 ATOM 49933 O WAT 64 127.976 133.430 64.954 1.00 0.00 O ATOM 49934 H1 WAT 64 128.687 133.731 65.520 1.00 0.00 H ATOM 49935 H2 WAT 64 128.419 133.018 64.212 1.00 0.00 H TER 49937 WAT 64 ATOM 49937 O WAT 65 71.214 16.564 158.881 1.00 0.00 O ATOM 49938 H1 WAT 65 71.640 16.741 158.042 1.00 0.00 H ATOM 49939 H2 WAT 65 70.943 15.648 158.822 1.00 0.00 H TER 49941 WAT 65 ATOM 49941 O WAT 66 140.396 127.175 81.360 1.00 0.00 O ATOM 49942 H1 WAT 66 141.240 127.435 81.728 1.00 0.00 H ATOM 49943 H2 WAT 66 139.792 127.205 82.102 1.00 0.00 H TER 49945 WAT 66 ATOM 49945 O WAT 67 67.606 1.779 83.991 1.00 0.00 O ATOM 49946 H1 WAT 67 68.119 2.519 83.667 1.00 0.00 H ATOM 49947 H2 WAT 67 66.838 1.751 83.420 1.00 0.00 H TER 49949 WAT 67 ATOM 49949 O WAT 68 128.611 37.546 124.033 1.00 0.00 O ATOM 49950 H1 WAT 68 128.071 37.510 124.822 1.00 0.00 H ATOM 49951 H2 WAT 68 128.236 38.260 123.518 1.00 0.00 H TER 49953 WAT 68 ATOM 49953 O WAT 69 114.429 28.493 1.841 1.00 0.00 O ATOM 49954 H1 WAT 69 114.054 28.141 1.034 1.00 0.00 H ATOM 49955 H2 WAT 69 115.361 28.284 1.783 1.00 0.00 H TER 49957 WAT 69 ATOM 49957 O WAT 70 12.556 100.104 25.930 1.00 0.00 O ATOM 49958 H1 WAT 70 12.243 100.715 26.597 1.00 0.00 H ATOM 49959 H2 WAT 70 13.414 99.822 26.248 1.00 0.00 H TER 49961 WAT 70 ATOM 49961 O WAT 71 78.599 95.413 57.817 1.00 0.00 O ATOM 49962 H1 WAT 71 78.607 94.885 57.019 1.00 0.00 H ATOM 49963 H2 WAT 71 77.753 95.860 57.800 1.00 0.00 H TER 49965 WAT 71 ATOM 49965 O WAT 72 120.081 25.685 112.870 1.00 0.00 O ATOM 49966 H1 WAT 72 120.615 25.957 113.617 1.00 0.00 H ATOM 49967 H2 WAT 72 119.866 24.770 113.049 1.00 0.00 H TER 49969 WAT 72 ATOM 49969 O WAT 73 53.212 31.480 70.438 1.00 0.00 O ATOM 49970 H1 WAT 73 53.992 31.367 70.981 1.00 0.00 H ATOM 49971 H2 WAT 73 53.522 31.346 69.543 1.00 0.00 H TER 49973 WAT 73 ATOM 49973 O WAT 74 69.812 57.132 89.882 1.00 0.00 O ATOM 49974 H1 WAT 74 69.072 56.923 89.311 1.00 0.00 H ATOM 49975 H2 WAT 74 70.280 56.302 89.981 1.00 0.00 H TER 49977 WAT 74 ATOM 49977 O WAT 75 98.384 79.837 123.180 1.00 0.00 O ATOM 49978 H1 WAT 75 98.657 79.696 124.086 1.00 0.00 H ATOM 49979 H2 WAT 75 98.009 79.000 122.909 1.00 0.00 H TER 49981 WAT 75 ATOM 49981 O WAT 76 11.382 85.875 121.298 1.00 0.00 O ATOM 49982 H1 WAT 76 11.865 86.443 121.899 1.00 0.00 H ATOM 49983 H2 WAT 76 11.716 86.105 120.431 1.00 0.00 H TER 49985 WAT 76 ATOM 49985 O WAT 77 10.393 101.361 17.432 1.00 0.00 O ATOM 49986 H1 WAT 77 10.804 101.923 16.775 1.00 0.00 H ATOM 49987 H2 WAT 77 10.690 100.479 17.212 1.00 0.00 H TER 49989 WAT 77 ATOM 49989 O WAT 78 2.497 11.040 155.362 1.00 0.00 O ATOM 49990 H1 WAT 78 1.903 10.291 155.325 1.00 0.00 H ATOM 49991 H2 WAT 78 1.998 11.720 155.814 1.00 0.00 H TER 49993 WAT 78 ATOM 49993 O WAT 79 131.686 35.792 143.506 1.00 0.00 O ATOM 49994 H1 WAT 79 131.689 35.967 144.447 1.00 0.00 H ATOM 49995 H2 WAT 79 130.763 35.662 143.290 1.00 0.00 H TER 49997 WAT 79 ATOM 49997 O WAT 80 39.571 119.927 57.875 1.00 0.00 O ATOM 49998 H1 WAT 80 39.422 119.192 57.281 1.00 0.00 H ATOM 49999 H2 WAT 80 39.983 120.597 57.329 1.00 0.00 H TER 50001 WAT 80 ATOM 50001 O WAT 81 53.748 35.383 70.328 1.00 0.00 O ATOM 50002 H1 WAT 81 54.265 36.113 69.987 1.00 0.00 H ATOM 50003 H2 WAT 81 52.858 35.731 70.395 1.00 0.00 H TER 50005 WAT 81 ATOM 50005 O WAT 82 121.874 51.118 120.072 1.00 0.00 O ATOM 50006 H1 WAT 82 122.513 50.833 120.726 1.00 0.00 H ATOM 50007 H2 WAT 82 122.395 51.569 119.408 1.00 0.00 H TER 50009 WAT 82 ATOM 50009 O WAT 83 89.862 69.357 17.434 1.00 0.00 O ATOM 50010 H1 WAT 83 90.257 70.217 17.576 1.00 0.00 H ATOM 50011 H2 WAT 83 90.057 69.152 16.519 1.00 0.00 H TER 50013 WAT 83 ATOM 50013 O WAT 84 25.419 65.224 61.143 1.00 0.00 O ATOM 50014 H1 WAT 84 25.164 65.098 60.229 1.00 0.00 H ATOM 50015 H2 WAT 84 24.965 66.023 61.411 1.00 0.00 H TER 50017 WAT 84 ATOM 50017 O WAT 85 83.313 83.730 145.627 1.00 0.00 O ATOM 50018 H1 WAT 85 82.988 83.856 146.519 1.00 0.00 H ATOM 50019 H2 WAT 85 82.732 83.068 145.252 1.00 0.00 H TER 50021 WAT 85 ATOM 50021 O WAT 86 27.612 118.212 106.831 1.00 0.00 O ATOM 50022 H1 WAT 86 28.411 117.945 107.286 1.00 0.00 H ATOM 50023 H2 WAT 86 26.931 118.180 107.503 1.00 0.00 H TER 50025 WAT 86 ATOM 50025 O WAT 87 22.553 131.597 109.098 1.00 0.00 O ATOM 50026 H1 WAT 87 21.906 132.301 109.139 1.00 0.00 H ATOM 50027 H2 WAT 87 23.185 131.891 108.441 1.00 0.00 H TER 50029 WAT 87 ATOM 50029 O WAT 88 65.182 127.834 101.550 1.00 0.00 O ATOM 50030 H1 WAT 88 65.353 128.760 101.723 1.00 0.00 H ATOM 50031 H2 WAT 88 65.914 127.375 101.963 1.00 0.00 H TER 50033 WAT 88 ATOM 50033 O WAT 89 61.774 128.206 95.515 1.00 0.00 O ATOM 50034 H1 WAT 89 61.035 128.022 94.936 1.00 0.00 H ATOM 50035 H2 WAT 89 61.995 129.120 95.338 1.00 0.00 H TER 50037 WAT 89 ATOM 50037 O WAT 90 105.821 66.263 2.126 1.00 0.00 O ATOM 50038 H1 WAT 90 105.276 66.315 1.341 1.00 0.00 H ATOM 50039 H2 WAT 90 106.440 65.556 1.943 1.00 0.00 H TER 50041 WAT 90 ATOM 50041 O WAT 91 126.097 41.858 64.834 1.00 0.00 O ATOM 50042 H1 WAT 91 126.394 41.334 65.578 1.00 0.00 H ATOM 50043 H2 WAT 91 125.405 41.332 64.432 1.00 0.00 H TER 50045 WAT 91 ATOM 50045 O WAT 92 33.338 46.551 11.543 1.00 0.00 O ATOM 50046 H1 WAT 92 33.416 47.497 11.664 1.00 0.00 H ATOM 50047 H2 WAT 92 33.945 46.350 10.830 1.00 0.00 H TER 50049 WAT 92 ATOM 50049 O WAT 93 94.267 54.452 117.288 1.00 0.00 O ATOM 50050 H1 WAT 93 94.102 55.296 116.867 1.00 0.00 H ATOM 50051 H2 WAT 93 93.541 53.897 117.004 1.00 0.00 H TER 50053 WAT 93 ATOM 50053 O WAT 94 77.612 124.958 144.007 1.00 0.00 O ATOM 50054 H1 WAT 94 76.782 124.529 143.800 1.00 0.00 H ATOM 50055 H2 WAT 94 78.255 124.514 143.454 1.00 0.00 H TER 50057 WAT 94 ATOM 50057 O WAT 95 107.337 60.701 121.522 1.00 0.00 O ATOM 50058 H1 WAT 95 106.888 60.486 120.705 1.00 0.00 H ATOM 50059 H2 WAT 95 107.037 60.036 122.143 1.00 0.00 H TER 50061 WAT 95 ATOM 50061 O WAT 96 95.679 143.200 73.218 1.00 0.00 O ATOM 50062 H1 WAT 96 95.245 142.655 72.561 1.00 0.00 H ATOM 50063 H2 WAT 96 95.001 143.808 73.510 1.00 0.00 H TER 50065 WAT 96 ATOM 50065 O WAT 97 109.602 38.807 120.916 1.00 0.00 O ATOM 50066 H1 WAT 97 108.737 39.162 121.117 1.00 0.00 H ATOM 50067 H2 WAT 97 110.063 38.808 121.755 1.00 0.00 H TER 50069 WAT 97 ATOM 50069 O WAT 98 0.286 44.548 158.251 1.00 0.00 O ATOM 50070 H1 WAT 98 0.573 44.181 159.087 1.00 0.00 H ATOM 50071 H2 WAT 98 0.471 43.860 157.611 1.00 0.00 H TER 50073 WAT 98 ATOM 50073 O WAT 99 76.331 113.695 86.891 1.00 0.00 O ATOM 50074 H1 WAT 99 75.692 113.291 86.304 1.00 0.00 H ATOM 50075 H2 WAT 99 75.808 114.035 87.616 1.00 0.00 H TER 50077 WAT 99 ATOM 50077 O WAT 100 133.596 45.190 63.614 1.00 0.00 O ATOM 50078 H1 WAT 100 133.693 44.368 64.094 1.00 0.00 H ATOM 50079 H2 WAT 100 133.321 44.924 62.736 1.00 0.00 H TER 50081 WAT 100 ATOM 50081 O WAT 101 56.184 128.853 155.846 1.00 0.00 O ATOM 50082 H1 WAT 101 56.686 129.530 156.299 1.00 0.00 H ATOM 50083 H2 WAT 101 55.307 128.910 156.226 1.00 0.00 H TER 50085 WAT 101 ATOM 50085 O WAT 102 131.146 79.132 156.575 1.00 0.00 O ATOM 50086 H1 WAT 102 131.134 79.700 155.805 1.00 0.00 H ATOM 50087 H2 WAT 102 131.892 79.440 157.089 1.00 0.00 H TER 50089 WAT 102 ATOM 50089 O WAT 103 134.530 31.432 142.670 1.00 0.00 O ATOM 50090 H1 WAT 103 135.055 30.772 143.123 1.00 0.00 H ATOM 50091 H2 WAT 103 135.142 31.849 142.064 1.00 0.00 H TER 50093 WAT 103 ATOM 50093 O WAT 104 100.047 28.943 101.704 1.00 0.00 O ATOM 50094 H1 WAT 104 99.221 28.537 101.965 1.00 0.00 H ATOM 50095 H2 WAT 104 99.998 28.994 100.749 1.00 0.00 H TER 50097 WAT 104 ATOM 50097 O WAT 105 31.301 96.757 7.745 1.00 0.00 O ATOM 50098 H1 WAT 105 31.460 97.677 7.959 1.00 0.00 H ATOM 50099 H2 WAT 105 32.175 96.369 7.694 1.00 0.00 H TER 50101 WAT 105 ATOM 50101 O WAT 106 60.792 22.216 10.946 1.00 0.00 O ATOM 50102 H1 WAT 106 60.510 21.378 11.312 1.00 0.00 H ATOM 50103 H2 WAT 106 61.673 22.047 10.613 1.00 0.00 H TER 50105 WAT 106 ATOM 50105 O WAT 107 58.266 43.782 124.818 1.00 0.00 O ATOM 50106 H1 WAT 107 59.198 43.574 124.886 1.00 0.00 H ATOM 50107 H2 WAT 107 57.913 43.112 124.231 1.00 0.00 H TER 50109 WAT 107 ATOM 50109 O WAT 108 64.079 125.119 17.048 1.00 0.00 O ATOM 50110 H1 WAT 108 64.520 124.752 16.282 1.00 0.00 H ATOM 50111 H2 WAT 108 63.275 124.606 17.130 1.00 0.00 H TER 50113 WAT 108 ATOM 50113 O WAT 109 15.951 83.549 73.361 1.00 0.00 O ATOM 50114 H1 WAT 109 16.219 83.505 74.279 1.00 0.00 H ATOM 50115 H2 WAT 109 15.856 84.484 73.183 1.00 0.00 H TER 50117 WAT 109 ATOM 50117 O WAT 110 44.274 64.210 132.573 1.00 0.00 O ATOM 50118 H1 WAT 110 43.944 63.479 132.051 1.00 0.00 H ATOM 50119 H2 WAT 110 43.493 64.715 132.800 1.00 0.00 H TER 50121 WAT 110 ATOM 50121 O WAT 111 38.582 105.176 79.620 1.00 0.00 O ATOM 50122 H1 WAT 111 37.793 105.640 79.899 1.00 0.00 H ATOM 50123 H2 WAT 111 39.285 105.817 79.722 1.00 0.00 H TER 50125 WAT 111 ATOM 50125 O WAT 112 56.448 112.122 90.321 1.00 0.00 O ATOM 50126 H1 WAT 112 55.770 111.760 90.892 1.00 0.00 H ATOM 50127 H2 WAT 112 57.152 111.474 90.345 1.00 0.00 H TER 50129 WAT 112 ATOM 50129 O WAT 113 1.424 21.271 81.065 1.00 0.00 O ATOM 50130 H1 WAT 113 1.780 21.731 80.305 1.00 0.00 H ATOM 50131 H2 WAT 113 2.036 21.469 81.773 1.00 0.00 H TER 50133 WAT 113 ATOM 50133 O WAT 114 19.600 7.917 85.402 1.00 0.00 O ATOM 50134 H1 WAT 114 18.937 7.386 85.843 1.00 0.00 H ATOM 50135 H2 WAT 114 19.316 7.943 84.488 1.00 0.00 H TER 50137 WAT 114 ATOM 50137 O WAT 115 91.908 53.310 4.948 1.00 0.00 O ATOM 50138 H1 WAT 115 92.206 52.730 4.248 1.00 0.00 H ATOM 50139 H2 WAT 115 91.313 52.771 5.469 1.00 0.00 H TER 50141 WAT 115 ATOM 50141 O WAT 116 116.285 122.202 60.647 1.00 0.00 O ATOM 50142 H1 WAT 116 116.627 123.095 60.593 1.00 0.00 H ATOM 50143 H2 WAT 116 116.756 121.724 59.964 1.00 0.00 H TER 50145 WAT 116 ATOM 50145 O WAT 117 72.005 15.443 132.111 1.00 0.00 O ATOM 50146 H1 WAT 117 72.266 14.763 131.490 1.00 0.00 H ATOM 50147 H2 WAT 117 71.664 16.149 131.564 1.00 0.00 H TER 50149 WAT 117 ATOM 50149 O WAT 118 93.923 143.646 69.933 1.00 0.00 O ATOM 50150 H1 WAT 118 92.986 143.793 70.066 1.00 0.00 H ATOM 50151 H2 WAT 118 94.071 143.866 69.013 1.00 0.00 H TER 50153 WAT 118 ATOM 50153 O WAT 119 12.390 86.937 138.275 1.00 0.00 O ATOM 50154 H1 WAT 119 11.716 86.754 138.930 1.00 0.00 H ATOM 50155 H2 WAT 119 12.892 87.664 138.645 1.00 0.00 H TER 50157 WAT 119 ATOM 50157 O WAT 120 115.265 129.756 85.243 1.00 0.00 O ATOM 50158 H1 WAT 120 115.677 130.607 85.094 1.00 0.00 H ATOM 50159 H2 WAT 120 114.326 129.937 85.221 1.00 0.00 H TER 50161 WAT 120 ATOM 50161 O WAT 121 6.183 120.965 14.710 1.00 0.00 O ATOM 50162 H1 WAT 121 5.459 120.587 15.211 1.00 0.00 H ATOM 50163 H2 WAT 121 6.201 120.460 13.897 1.00 0.00 H TER 50165 WAT 121 ATOM 50165 O WAT 122 15.843 30.117 91.888 1.00 0.00 O ATOM 50166 H1 WAT 122 16.225 30.994 91.855 1.00 0.00 H ATOM 50167 H2 WAT 122 14.988 30.244 92.301 1.00 0.00 H TER 50169 WAT 122 ATOM 50169 O WAT 123 115.932 0.694 120.300 1.00 0.00 O ATOM 50170 H1 WAT 123 115.281 1.394 120.345 1.00 0.00 H ATOM 50171 H2 WAT 123 116.439 0.888 119.512 1.00 0.00 H TER 50173 WAT 123 ATOM 50173 O WAT 124 59.142 50.644 91.001 1.00 0.00 O ATOM 50174 H1 WAT 124 59.302 50.433 90.081 1.00 0.00 H ATOM 50175 H2 WAT 124 58.225 50.918 91.028 1.00 0.00 H TER 50177 WAT 124 ATOM 50177 O WAT 125 26.821 6.999 121.728 1.00 0.00 O ATOM 50178 H1 WAT 125 26.781 7.946 121.600 1.00 0.00 H ATOM 50179 H2 WAT 125 26.465 6.633 120.918 1.00 0.00 H TER 50181 WAT 125 ATOM 50181 O WAT 126 127.784 87.002 27.549 1.00 0.00 O ATOM 50182 H1 WAT 126 128.223 87.464 26.835 1.00 0.00 H ATOM 50183 H2 WAT 126 127.089 86.503 27.121 1.00 0.00 H TER 50185 WAT 126 ATOM 50185 O WAT 127 115.110 7.716 158.365 1.00 0.00 O ATOM 50186 H1 WAT 127 114.812 6.821 158.204 1.00 0.00 H ATOM 50187 H2 WAT 127 114.356 8.153 158.761 1.00 0.00 H TER 50189 WAT 127 ATOM 50189 O WAT 128 60.404 37.884 77.626 1.00 0.00 O ATOM 50190 H1 WAT 128 60.688 36.980 77.488 1.00 0.00 H ATOM 50191 H2 WAT 128 60.395 37.989 78.577 1.00 0.00 H TER 50193 WAT 128 ATOM 50193 O WAT 129 112.361 77.298 134.023 1.00 0.00 O ATOM 50194 H1 WAT 129 111.746 77.872 133.564 1.00 0.00 H ATOM 50195 H2 WAT 129 113.083 77.179 133.405 1.00 0.00 H TER 50197 WAT 129 ATOM 50197 O WAT 130 33.110 120.564 91.790 1.00 0.00 O ATOM 50198 H1 WAT 130 33.233 119.652 92.051 1.00 0.00 H ATOM 50199 H2 WAT 130 32.768 120.994 92.574 1.00 0.00 H TER 50201 WAT 130 ATOM 50201 O WAT 131 80.024 86.935 23.662 1.00 0.00 O ATOM 50202 H1 WAT 131 80.557 86.152 23.799 1.00 0.00 H ATOM 50203 H2 WAT 131 80.056 87.396 24.500 1.00 0.00 H TER 50205 WAT 131 ATOM 50205 O WAT 132 34.531 64.238 84.983 1.00 0.00 O ATOM 50206 H1 WAT 132 35.483 64.152 84.941 1.00 0.00 H ATOM 50207 H2 WAT 132 34.383 65.015 85.522 1.00 0.00 H TER 50209 WAT 132 ATOM 50209 O WAT 133 97.223 25.585 57.846 1.00 0.00 O ATOM 50210 H1 WAT 133 96.572 25.312 57.199 1.00 0.00 H ATOM 50211 H2 WAT 133 97.759 24.805 57.990 1.00 0.00 H TER 50213 WAT 133 ATOM 50213 O WAT 134 6.173 23.295 120.274 1.00 0.00 O ATOM 50214 H1 WAT 134 6.606 23.959 120.810 1.00 0.00 H ATOM 50215 H2 WAT 134 6.507 22.463 120.607 1.00 0.00 H TER 50217 WAT 134 ATOM 50217 O WAT 135 91.212 34.594 83.709 1.00 0.00 O ATOM 50218 H1 WAT 135 90.628 35.148 83.191 1.00 0.00 H ATOM 50219 H2 WAT 135 92.018 34.549 83.195 1.00 0.00 H TER 50221 WAT 135 ATOM 50221 O WAT 136 87.074 41.901 121.317 1.00 0.00 O ATOM 50222 H1 WAT 136 86.806 41.147 120.792 1.00 0.00 H ATOM 50223 H2 WAT 136 87.576 41.524 122.040 1.00 0.00 H TER 50225 WAT 136 ATOM 50225 O WAT 137 80.035 139.507 98.829 1.00 0.00 O ATOM 50226 H1 WAT 137 79.565 139.947 98.120 1.00 0.00 H ATOM 50227 H2 WAT 137 80.722 140.124 99.080 1.00 0.00 H TER 50229 WAT 137 ATOM 50229 O WAT 138 54.538 117.069 153.336 1.00 0.00 O ATOM 50230 H1 WAT 138 55.376 116.696 153.609 1.00 0.00 H ATOM 50231 H2 WAT 138 54.666 118.015 153.397 1.00 0.00 H TER 50233 WAT 138 ATOM 50233 O WAT 139 65.401 127.916 89.309 1.00 0.00 O ATOM 50234 H1 WAT 139 66.191 127.492 89.642 1.00 0.00 H ATOM 50235 H2 WAT 139 65.697 128.779 89.019 1.00 0.00 H TER 50237 WAT 139 ATOM 50237 O WAT 140 49.565 88.274 150.920 1.00 0.00 O ATOM 50238 H1 WAT 140 50.491 88.514 150.929 1.00 0.00 H ATOM 50239 H2 WAT 140 49.288 88.417 150.015 1.00 0.00 H TER 50241 WAT 140 ATOM 50241 O WAT 141 64.750 28.586 114.028 1.00 0.00 O ATOM 50242 H1 WAT 141 64.314 29.211 113.450 1.00 0.00 H ATOM 50243 H2 WAT 141 64.607 27.735 113.612 1.00 0.00 H TER 50245 WAT 141 ATOM 50245 O WAT 142 34.288 68.613 127.426 1.00 0.00 O ATOM 50246 H1 WAT 142 33.387 68.823 127.183 1.00 0.00 H ATOM 50247 H2 WAT 142 34.205 67.888 128.047 1.00 0.00 H TER 50249 WAT 142 ATOM 50249 O WAT 143 126.224 11.626 54.761 1.00 0.00 O ATOM 50250 H1 WAT 143 126.379 12.327 55.393 1.00 0.00 H ATOM 50251 H2 WAT 143 127.064 11.514 54.316 1.00 0.00 H TER 50253 WAT 143 ATOM 50253 O WAT 144 94.874 68.562 122.812 1.00 0.00 O ATOM 50254 H1 WAT 144 95.100 68.325 121.912 1.00 0.00 H ATOM 50255 H2 WAT 144 94.157 67.971 123.042 1.00 0.00 H TER 50257 WAT 144 ATOM 50257 O WAT 145 20.920 115.021 16.596 1.00 0.00 O ATOM 50258 H1 WAT 145 20.106 115.149 17.084 1.00 0.00 H ATOM 50259 H2 WAT 145 21.200 115.905 16.362 1.00 0.00 H TER 50261 WAT 145 ATOM 50261 O WAT 146 33.379 74.874 108.034 1.00 0.00 O ATOM 50262 H1 WAT 146 33.040 75.718 107.736 1.00 0.00 H ATOM 50263 H2 WAT 146 34.259 75.070 108.356 1.00 0.00 H TER 50265 WAT 146 ATOM 50265 O WAT 147 14.612 52.709 114.603 1.00 0.00 O ATOM 50266 H1 WAT 147 14.199 53.349 115.184 1.00 0.00 H ATOM 50267 H2 WAT 147 15.549 52.803 114.771 1.00 0.00 H TER 50269 WAT 147 ATOM 50269 O WAT 148 83.934 92.704 67.179 1.00 0.00 O ATOM 50270 H1 WAT 148 84.017 92.986 66.268 1.00 0.00 H ATOM 50271 H2 WAT 148 83.967 91.749 67.139 1.00 0.00 H TER 50273 WAT 148 ATOM 50273 O WAT 149 16.138 142.282 91.920 1.00 0.00 O ATOM 50274 H1 WAT 149 16.551 141.787 92.627 1.00 0.00 H ATOM 50275 H2 WAT 149 16.450 141.862 91.119 1.00 0.00 H TER 50277 WAT 149 ATOM 50277 O WAT 150 118.886 55.692 68.755 1.00 0.00 O ATOM 50278 H1 WAT 150 118.007 55.321 68.681 1.00 0.00 H ATOM 50279 H2 WAT 150 119.470 54.933 68.720 1.00 0.00 H TER 50281 WAT 150 ATOM 50281 O WAT 151 2.378 126.363 108.462 1.00 0.00 O ATOM 50282 H1 WAT 151 1.617 126.653 107.959 1.00 0.00 H ATOM 50283 H2 WAT 151 2.424 125.420 108.304 1.00 0.00 H TER 50285 WAT 151 ATOM 50285 O WAT 152 48.981 12.023 21.658 1.00 0.00 O ATOM 50286 H1 WAT 152 49.817 12.489 21.694 1.00 0.00 H ATOM 50287 H2 WAT 152 49.161 11.176 22.066 1.00 0.00 H TER 50289 WAT 152 ATOM 50289 O WAT 153 61.317 141.408 150.687 1.00 0.00 O ATOM 50290 H1 WAT 153 61.827 140.773 150.184 1.00 0.00 H ATOM 50291 H2 WAT 153 61.268 142.179 150.121 1.00 0.00 H TER 50293 WAT 153 ATOM 50293 O WAT 154 43.235 59.306 83.770 1.00 0.00 O ATOM 50294 H1 WAT 154 43.577 58.801 83.032 1.00 0.00 H ATOM 50295 H2 WAT 154 43.724 60.129 83.744 1.00 0.00 H TER 50297 WAT 154 ATOM 50297 O WAT 155 37.982 139.490 105.266 1.00 0.00 O ATOM 50298 H1 WAT 155 37.939 139.217 104.349 1.00 0.00 H ATOM 50299 H2 WAT 155 38.114 138.676 105.753 1.00 0.00 H TER 50301 WAT 155 ATOM 50301 O WAT 156 144.152 16.794 57.272 1.00 0.00 O ATOM 50302 H1 WAT 156 143.524 16.090 57.432 1.00 0.00 H ATOM 50303 H2 WAT 156 144.219 16.843 56.318 1.00 0.00 H TER 50305 WAT 156 ATOM 50305 O WAT 157 79.902 83.855 151.321 1.00 0.00 O ATOM 50306 H1 WAT 157 79.410 83.621 152.108 1.00 0.00 H ATOM 50307 H2 WAT 157 80.154 84.768 151.459 1.00 0.00 H TER 50309 WAT 157 ATOM 50309 O WAT 158 117.221 97.143 5.418 1.00 0.00 O ATOM 50310 H1 WAT 158 117.179 96.727 6.278 1.00 0.00 H ATOM 50311 H2 WAT 158 118.089 96.917 5.084 1.00 0.00 H TER 50313 WAT 158 ATOM 50313 O WAT 159 71.019 47.314 130.672 1.00 0.00 O ATOM 50314 H1 WAT 159 70.721 47.404 131.577 1.00 0.00 H ATOM 50315 H2 WAT 159 71.448 46.459 130.645 1.00 0.00 H TER 50317 WAT 159 ATOM 50317 O WAT 160 81.640 95.482 135.389 1.00 0.00 O ATOM 50318 H1 WAT 160 81.455 96.205 135.988 1.00 0.00 H ATOM 50319 H2 WAT 160 82.560 95.268 135.548 1.00 0.00 H TER 50321 WAT 160 ATOM 50321 O WAT 161 29.274 144.888 19.884 1.00 0.00 O ATOM 50322 H1 WAT 161 29.722 145.041 20.716 1.00 0.00 H ATOM 50323 H2 WAT 161 28.815 145.709 19.705 1.00 0.00 H TER 50325 WAT 161 ATOM 50325 O WAT 162 4.975 16.538 72.666 1.00 0.00 O ATOM 50326 H1 WAT 162 4.847 17.367 72.205 1.00 0.00 H ATOM 50327 H2 WAT 162 4.233 16.481 73.268 1.00 0.00 H TER 50329 WAT 162 ATOM 50329 O WAT 163 36.791 7.165 57.141 1.00 0.00 O ATOM 50330 H1 WAT 163 37.628 6.718 57.268 1.00 0.00 H ATOM 50331 H2 WAT 163 37.007 8.096 57.193 1.00 0.00 H TER 50333 WAT 163 ATOM 50333 O WAT 164 41.965 120.174 110.138 1.00 0.00 O ATOM 50334 H1 WAT 164 42.789 119.950 109.706 1.00 0.00 H ATOM 50335 H2 WAT 164 41.369 119.465 109.898 1.00 0.00 H TER 50337 WAT 164 ATOM 50337 O WAT 165 83.434 64.263 129.372 1.00 0.00 O ATOM 50338 H1 WAT 165 83.516 64.439 130.310 1.00 0.00 H ATOM 50339 H2 WAT 165 83.393 63.309 129.310 1.00 0.00 H TER 50341 WAT 165 ATOM 50341 O WAT 166 92.034 30.989 110.158 1.00 0.00 O ATOM 50342 H1 WAT 166 92.430 31.854 110.051 1.00 0.00 H ATOM 50343 H2 WAT 166 91.570 31.040 110.993 1.00 0.00 H TER 50345 WAT 166 ATOM 50345 O WAT 167 125.712 98.846 123.910 1.00 0.00 O ATOM 50346 H1 WAT 167 126.088 99.721 124.004 1.00 0.00 H ATOM 50347 H2 WAT 167 126.303 98.277 124.404 1.00 0.00 H TER 50349 WAT 167 ATOM 50349 O WAT 168 25.921 81.792 158.451 1.00 0.00 O ATOM 50350 H1 WAT 168 24.986 81.994 158.416 1.00 0.00 H ATOM 50351 H2 WAT 168 26.296 82.488 158.992 1.00 0.00 H TER 50353 WAT 168 ATOM 50353 O WAT 169 62.066 100.149 4.882 1.00 0.00 O ATOM 50354 H1 WAT 169 61.719 100.639 4.137 1.00 0.00 H ATOM 50355 H2 WAT 169 62.977 99.971 4.649 1.00 0.00 H TER 50357 WAT 169 ATOM 50357 O WAT 170 6.680 80.750 7.581 1.00 0.00 O ATOM 50358 H1 WAT 170 5.739 80.914 7.516 1.00 0.00 H ATOM 50359 H2 WAT 170 6.778 79.825 7.353 1.00 0.00 H TER 50361 WAT 170 ATOM 50361 O WAT 171 72.202 64.189 100.365 1.00 0.00 O ATOM 50362 H1 WAT 171 71.321 64.463 100.621 1.00 0.00 H ATOM 50363 H2 WAT 171 72.735 64.978 100.462 1.00 0.00 H TER 50365 WAT 171 ATOM 50365 O WAT 172 37.515 101.907 6.965 1.00 0.00 O ATOM 50366 H1 WAT 172 36.905 102.055 6.242 1.00 0.00 H ATOM 50367 H2 WAT 172 38.186 101.331 6.599 1.00 0.00 H TER 50369 WAT 172 ATOM 50369 O WAT 173 41.613 89.464 143.626 1.00 0.00 O ATOM 50370 H1 WAT 173 42.241 89.479 144.348 1.00 0.00 H ATOM 50371 H2 WAT 173 42.023 89.993 142.941 1.00 0.00 H TER 50373 WAT 173 ATOM 50373 O WAT 174 109.150 131.607 146.282 1.00 0.00 O ATOM 50374 H1 WAT 174 109.342 132.502 146.561 1.00 0.00 H ATOM 50375 H2 WAT 174 108.891 131.156 147.085 1.00 0.00 H TER 50377 WAT 174 ATOM 50377 O WAT 175 126.507 20.349 115.527 1.00 0.00 O ATOM 50378 H1 WAT 175 125.737 20.366 116.094 1.00 0.00 H ATOM 50379 H2 WAT 175 126.286 19.718 114.842 1.00 0.00 H TER 50381 WAT 175 ATOM 50381 O WAT 176 68.652 0.381 5.680 1.00 0.00 O ATOM 50382 H1 WAT 176 69.405 0.932 5.468 1.00 0.00 H ATOM 50383 H2 WAT 176 67.897 0.872 5.354 1.00 0.00 H TER 50385 WAT 176 ATOM 50385 O WAT 177 87.818 64.536 101.708 1.00 0.00 O ATOM 50386 H1 WAT 177 88.037 64.952 100.874 1.00 0.00 H ATOM 50387 H2 WAT 177 86.957 64.143 101.560 1.00 0.00 H TER 50389 WAT 177 ATOM 50389 O WAT 178 83.863 62.590 14.323 1.00 0.00 O ATOM 50390 H1 WAT 178 83.581 62.169 13.510 1.00 0.00 H ATOM 50391 H2 WAT 178 83.732 63.525 14.167 1.00 0.00 H TER 50393 WAT 178 ATOM 50393 O WAT 179 92.504 79.083 85.927 1.00 0.00 O ATOM 50394 H1 WAT 179 91.619 78.935 86.259 1.00 0.00 H ATOM 50395 H2 WAT 179 92.425 79.860 85.373 1.00 0.00 H TER 50397 WAT 179 ATOM 50397 O WAT 180 16.165 45.692 130.875 1.00 0.00 O ATOM 50398 H1 WAT 180 16.723 46.388 130.529 1.00 0.00 H ATOM 50399 H2 WAT 180 16.765 45.118 131.351 1.00 0.00 H TER 50401 WAT 180 ATOM 50401 O WAT 181 117.343 137.613 120.819 1.00 0.00 O ATOM 50402 H1 WAT 181 117.939 138.204 120.358 1.00 0.00 H ATOM 50403 H2 WAT 181 116.774 138.193 121.325 1.00 0.00 H TER 50405 WAT 181 ATOM 50405 O WAT 182 15.290 19.939 16.105 1.00 0.00 O ATOM 50406 H1 WAT 182 14.584 19.595 15.558 1.00 0.00 H ATOM 50407 H2 WAT 182 16.092 19.624 15.688 1.00 0.00 H TER 50409 WAT 182 ATOM 50409 O WAT 183 115.813 23.697 19.900 1.00 0.00 O ATOM 50410 H1 WAT 183 115.098 24.047 20.431 1.00 0.00 H ATOM 50411 H2 WAT 183 116.560 24.259 20.104 1.00 0.00 H TER 50413 WAT 183 ATOM 50413 O WAT 184 26.016 53.381 117.390 1.00 0.00 O ATOM 50414 H1 WAT 184 26.607 52.806 117.876 1.00 0.00 H ATOM 50415 H2 WAT 184 25.400 52.785 116.962 1.00 0.00 H TER 50417 WAT 184 ATOM 50417 O WAT 185 25.742 22.288 147.741 1.00 0.00 O ATOM 50418 H1 WAT 185 25.046 22.020 148.342 1.00 0.00 H ATOM 50419 H2 WAT 185 25.894 23.210 147.948 1.00 0.00 H TER 50421 WAT 185 ATOM 50421 O WAT 186 122.687 122.759 88.029 1.00 0.00 O ATOM 50422 H1 WAT 186 123.285 123.276 88.568 1.00 0.00 H ATOM 50423 H2 WAT 186 122.690 121.891 88.433 1.00 0.00 H TER 50425 WAT 186 ATOM 50425 O WAT 187 35.691 101.343 119.969 1.00 0.00 O ATOM 50426 H1 WAT 187 35.864 101.846 120.765 1.00 0.00 H ATOM 50427 H2 WAT 187 34.942 100.790 120.193 1.00 0.00 H TER 50429 WAT 187 ATOM 50429 O WAT 188 51.060 117.100 2.475 1.00 0.00 O ATOM 50430 H1 WAT 188 51.894 117.523 2.678 1.00 0.00 H ATOM 50431 H2 WAT 188 50.989 116.391 3.114 1.00 0.00 H TER 50433 WAT 188 ATOM 50433 O WAT 189 52.360 43.886 109.074 1.00 0.00 O ATOM 50434 H1 WAT 189 51.787 43.991 108.314 1.00 0.00 H ATOM 50435 H2 WAT 189 53.080 44.497 108.918 1.00 0.00 H TER 50437 WAT 189 ATOM 50437 O WAT 190 126.188 98.931 68.940 1.00 0.00 O ATOM 50438 H1 WAT 190 125.383 99.450 68.965 1.00 0.00 H ATOM 50439 H2 WAT 190 125.886 98.025 68.873 1.00 0.00 H TER 50441 WAT 190 ATOM 50441 O WAT 191 84.366 102.362 125.495 1.00 0.00 O ATOM 50442 H1 WAT 191 85.243 102.030 125.686 1.00 0.00 H ATOM 50443 H2 WAT 191 84.438 103.309 125.614 1.00 0.00 H TER 50445 WAT 191 ATOM 50445 O WAT 192 78.628 43.773 2.266 1.00 0.00 O ATOM 50446 H1 WAT 192 79.133 44.579 2.369 1.00 0.00 H ATOM 50447 H2 WAT 192 79.009 43.347 1.498 1.00 0.00 H TER 50449 WAT 192 ATOM 50449 O WAT 193 117.081 51.482 153.326 1.00 0.00 O ATOM 50450 H1 WAT 193 117.708 51.092 152.717 1.00 0.00 H ATOM 50451 H2 WAT 193 116.793 52.285 152.891 1.00 0.00 H TER 50453 WAT 193 ATOM 50453 O WAT 194 53.679 137.667 69.436 1.00 0.00 O ATOM 50454 H1 WAT 194 53.761 136.946 70.060 1.00 0.00 H ATOM 50455 H2 WAT 194 53.810 137.259 68.580 1.00 0.00 H TER 50457 WAT 194 ATOM 50457 O WAT 195 79.960 10.217 7.057 1.00 0.00 O ATOM 50458 H1 WAT 195 79.362 9.628 7.517 1.00 0.00 H ATOM 50459 H2 WAT 195 79.392 10.887 6.678 1.00 0.00 H TER 50461 WAT 195 ATOM 50461 O WAT 196 41.636 18.581 85.411 1.00 0.00 O ATOM 50462 H1 WAT 196 41.794 18.061 84.624 1.00 0.00 H ATOM 50463 H2 WAT 196 42.362 19.204 85.437 1.00 0.00 H TER 50465 WAT 196 ATOM 50465 O WAT 197 81.601 74.845 109.221 1.00 0.00 O ATOM 50466 H1 WAT 197 82.089 74.050 109.006 1.00 0.00 H ATOM 50467 H2 WAT 197 80.695 74.551 109.316 1.00 0.00 H TER 50469 WAT 197 ATOM 50469 O WAT 198 42.885 96.271 87.720 1.00 0.00 O ATOM 50470 H1 WAT 198 43.232 96.759 88.467 1.00 0.00 H ATOM 50471 H2 WAT 198 43.174 96.768 86.955 1.00 0.00 H TER 50473 WAT 198 ATOM 50473 O WAT 199 48.788 27.228 145.318 1.00 0.00 O ATOM 50474 H1 WAT 199 48.396 26.591 144.720 1.00 0.00 H ATOM 50475 H2 WAT 199 49.728 27.051 145.273 1.00 0.00 H TER 50477 WAT 199 ATOM 50477 O WAT 200 54.074 105.159 139.299 1.00 0.00 O ATOM 50478 H1 WAT 200 54.977 105.085 139.607 1.00 0.00 H ATOM 50479 H2 WAT 200 53.917 106.102 139.242 1.00 0.00 H TER 50481 WAT 200 ATOM 50481 O WAT 201 79.379 34.930 85.260 1.00 0.00 O ATOM 50482 H1 WAT 201 78.959 34.306 85.852 1.00 0.00 H ATOM 50483 H2 WAT 201 79.234 35.783 85.669 1.00 0.00 H TER 50485 WAT 201 ATOM 50485 O WAT 202 20.774 79.651 142.349 1.00 0.00 O ATOM 50486 H1 WAT 202 20.054 80.084 141.891 1.00 0.00 H ATOM 50487 H2 WAT 202 21.109 80.314 142.952 1.00 0.00 H TER 50489 WAT 202 ATOM 50489 O WAT 203 89.611 6.594 147.095 1.00 0.00 O ATOM 50490 H1 WAT 203 90.088 6.017 146.499 1.00 0.00 H ATOM 50491 H2 WAT 203 90.281 6.933 147.688 1.00 0.00 H TER 50493 WAT 203 ATOM 50493 O WAT 204 131.110 10.905 114.512 1.00 0.00 O ATOM 50494 H1 WAT 204 130.241 10.695 114.854 1.00 0.00 H ATOM 50495 H2 WAT 204 131.715 10.446 115.095 1.00 0.00 H TER 50497 WAT 204 ATOM 50497 O WAT 205 88.046 127.216 146.194 1.00 0.00 O ATOM 50498 H1 WAT 205 87.201 127.554 145.896 1.00 0.00 H ATOM 50499 H2 WAT 205 88.693 127.723 145.704 1.00 0.00 H TER 50501 WAT 205 ATOM 50501 O WAT 206 65.279 117.428 72.535 1.00 0.00 O ATOM 50502 H1 WAT 206 66.165 117.618 72.844 1.00 0.00 H ATOM 50503 H2 WAT 206 64.796 117.187 73.325 1.00 0.00 H TER 50505 WAT 206 ATOM 50505 O WAT 207 106.597 87.554 128.133 1.00 0.00 O ATOM 50506 H1 WAT 207 106.119 88.013 127.442 1.00 0.00 H ATOM 50507 H2 WAT 207 106.905 88.251 128.713 1.00 0.00 H TER 50509 WAT 207 ATOM 50509 O WAT 208 118.372 142.984 11.231 1.00 0.00 O ATOM 50510 H1 WAT 208 118.488 142.521 10.402 1.00 0.00 H ATOM 50511 H2 WAT 208 117.684 143.625 11.053 1.00 0.00 H TER 50513 WAT 208 ATOM 50513 O WAT 209 134.834 42.471 67.816 1.00 0.00 O ATOM 50514 H1 WAT 209 134.830 43.428 67.831 1.00 0.00 H ATOM 50515 H2 WAT 209 133.927 42.231 67.627 1.00 0.00 H TER 50517 WAT 209 ATOM 50517 O WAT 210 92.944 89.335 65.169 1.00 0.00 O ATOM 50518 H1 WAT 210 93.256 89.674 66.008 1.00 0.00 H ATOM 50519 H2 WAT 210 93.256 89.969 64.523 1.00 0.00 H TER 50521 WAT 210 ATOM 50521 O WAT 211 135.972 123.710 81.367 1.00 0.00 O ATOM 50522 H1 WAT 211 136.301 124.566 81.094 1.00 0.00 H ATOM 50523 H2 WAT 211 136.621 123.088 81.037 1.00 0.00 H TER 50525 WAT 211 ATOM 50525 O WAT 212 108.875 140.354 77.911 1.00 0.00 O ATOM 50526 H1 WAT 212 108.874 141.234 78.288 1.00 0.00 H ATOM 50527 H2 WAT 212 109.690 139.961 78.223 1.00 0.00 H TER 50529 WAT 212 ATOM 50529 O WAT 213 83.066 31.291 88.558 1.00 0.00 O ATOM 50530 H1 WAT 213 82.308 31.715 88.961 1.00 0.00 H ATOM 50531 H2 WAT 213 83.333 31.891 87.862 1.00 0.00 H TER 50533 WAT 213 ATOM 50533 O WAT 214 62.562 64.220 118.251 1.00 0.00 O ATOM 50534 H1 WAT 214 63.058 64.016 119.043 1.00 0.00 H ATOM 50535 H2 WAT 214 61.809 63.629 118.280 1.00 0.00 H TER 50537 WAT 214 ATOM 50537 O WAT 215 39.826 13.359 88.572 1.00 0.00 O ATOM 50538 H1 WAT 215 40.348 12.695 89.023 1.00 0.00 H ATOM 50539 H2 WAT 215 40.155 14.192 88.910 1.00 0.00 H TER 50541 WAT 215 ATOM 50541 O WAT 216 67.302 79.000 78.277 1.00 0.00 O ATOM 50542 H1 WAT 216 67.391 78.513 77.458 1.00 0.00 H ATOM 50543 H2 WAT 216 66.368 78.959 78.480 1.00 0.00 H TER 50545 WAT 216 ATOM 50545 O WAT 217 92.338 45.400 9.155 1.00 0.00 O ATOM 50546 H1 WAT 217 92.368 44.456 8.995 1.00 0.00 H ATOM 50547 H2 WAT 217 91.494 45.543 9.582 1.00 0.00 H TER 50549 WAT 217 ATOM 50549 O WAT 218 48.463 28.669 132.738 1.00 0.00 O ATOM 50550 H1 WAT 218 47.722 28.063 132.725 1.00 0.00 H ATOM 50551 H2 WAT 218 48.250 29.324 132.074 1.00 0.00 H TER 50553 WAT 218 ATOM 50553 O WAT 219 17.621 101.744 148.276 1.00 0.00 O ATOM 50554 H1 WAT 219 17.406 102.575 147.853 1.00 0.00 H ATOM 50555 H2 WAT 219 17.990 101.207 147.574 1.00 0.00 H TER 50557 WAT 219 ATOM 50557 O WAT 220 76.058 4.317 66.441 1.00 0.00 O ATOM 50558 H1 WAT 220 76.936 4.695 66.391 1.00 0.00 H ATOM 50559 H2 WAT 220 76.171 3.517 66.954 1.00 0.00 H TER 50561 WAT 220 ATOM 50561 O WAT 221 71.074 1.530 132.269 1.00 0.00 O ATOM 50562 H1 WAT 221 71.763 1.973 131.773 1.00 0.00 H ATOM 50563 H2 WAT 221 70.887 2.120 132.999 1.00 0.00 H TER 50565 WAT 221 ATOM 50565 O WAT 222 80.517 145.436 5.352 1.00 0.00 O ATOM 50566 H1 WAT 222 79.790 145.229 4.765 1.00 0.00 H ATOM 50567 H2 WAT 222 80.322 144.952 6.154 1.00 0.00 H TER 50569 WAT 222 ATOM 50569 O WAT 223 65.391 104.468 65.292 1.00 0.00 O ATOM 50570 H1 WAT 223 66.130 104.853 65.764 1.00 0.00 H ATOM 50571 H2 WAT 223 65.604 104.599 64.368 1.00 0.00 H TER 50573 WAT 223 ATOM 50573 O WAT 224 118.058 49.662 151.297 1.00 0.00 O ATOM 50574 H1 WAT 224 117.137 49.731 151.045 1.00 0.00 H ATOM 50575 H2 WAT 224 118.530 49.602 150.467 1.00 0.00 H TER 50577 WAT 224 ATOM 50577 O WAT 225 71.515 127.600 78.732 1.00 0.00 O ATOM 50578 H1 WAT 225 71.415 127.440 79.671 1.00 0.00 H ATOM 50579 H2 WAT 225 72.458 127.710 78.608 1.00 0.00 H TER 50581 WAT 225 ATOM 50581 O WAT 226 49.159 6.438 103.810 1.00 0.00 O ATOM 50582 H1 WAT 226 49.825 5.759 103.918 1.00 0.00 H ATOM 50583 H2 WAT 226 48.655 6.411 104.623 1.00 0.00 H TER 50585 WAT 226 ATOM 50585 O WAT 227 63.104 73.404 91.775 1.00 0.00 O ATOM 50586 H1 WAT 227 63.022 73.961 92.549 1.00 0.00 H ATOM 50587 H2 WAT 227 62.611 72.614 91.995 1.00 0.00 H TER 50589 WAT 227 ATOM 50589 O WAT 228 23.708 70.844 125.287 1.00 0.00 O ATOM 50590 H1 WAT 228 23.804 71.777 125.096 1.00 0.00 H ATOM 50591 H2 WAT 228 23.523 70.443 124.438 1.00 0.00 H TER 50593 WAT 228 ATOM 50593 O WAT 229 43.400 57.475 135.305 1.00 0.00 O ATOM 50594 H1 WAT 229 43.500 57.709 134.382 1.00 0.00 H ATOM 50595 H2 WAT 229 43.020 58.254 135.710 1.00 0.00 H TER 50597 WAT 229 ATOM 50597 O WAT 230 64.481 59.482 24.173 1.00 0.00 O ATOM 50598 H1 WAT 230 63.604 59.719 23.868 1.00 0.00 H ATOM 50599 H2 WAT 230 64.678 58.662 23.719 1.00 0.00 H TER 50601 WAT 230 ATOM 50601 O WAT 231 10.580 104.524 9.633 1.00 0.00 O ATOM 50602 H1 WAT 231 9.651 104.296 9.664 1.00 0.00 H ATOM 50603 H2 WAT 231 10.858 104.521 10.548 1.00 0.00 H TER 50605 WAT 231 ATOM 50605 O WAT 232 17.443 39.790 60.553 1.00 0.00 O ATOM 50606 H1 WAT 232 17.264 39.471 59.668 1.00 0.00 H ATOM 50607 H2 WAT 232 16.595 40.098 60.873 1.00 0.00 H TER 50609 WAT 232 ATOM 50609 O WAT 233 92.968 69.979 140.599 1.00 0.00 O ATOM 50610 H1 WAT 233 93.402 69.324 141.146 1.00 0.00 H ATOM 50611 H2 WAT 233 93.550 70.739 140.628 1.00 0.00 H TER 50613 WAT 233 ATOM 50613 O WAT 234 73.669 31.715 103.467 1.00 0.00 O ATOM 50614 H1 WAT 234 73.945 31.493 102.578 1.00 0.00 H ATOM 50615 H2 WAT 234 72.985 31.078 103.673 1.00 0.00 H TER 50617 WAT 234 ATOM 50617 O WAT 235 41.211 4.055 22.017 1.00 0.00 O ATOM 50618 H1 WAT 235 40.773 3.638 22.760 1.00 0.00 H ATOM 50619 H2 WAT 235 41.742 3.358 21.631 1.00 0.00 H TER 50621 WAT 235 ATOM 50621 O WAT 236 131.809 0.351 122.736 1.00 0.00 O ATOM 50622 H1 WAT 236 132.035 0.333 121.806 1.00 0.00 H ATOM 50623 H2 WAT 236 130.865 0.509 122.749 1.00 0.00 H TER 50625 WAT 236 ATOM 50625 O WAT 237 138.918 14.205 67.161 1.00 0.00 O ATOM 50626 H1 WAT 237 138.147 14.246 67.727 1.00 0.00 H ATOM 50627 H2 WAT 237 138.565 14.249 66.273 1.00 0.00 H TER 50629 WAT 237 ATOM 50629 O WAT 238 127.285 21.781 71.855 1.00 0.00 O ATOM 50630 H1 WAT 238 127.071 22.291 72.636 1.00 0.00 H ATOM 50631 H2 WAT 238 126.741 20.996 71.925 1.00 0.00 H TER 50633 WAT 238 ATOM 50633 O WAT 239 51.458 68.639 133.070 1.00 0.00 O ATOM 50634 H1 WAT 239 51.076 68.232 133.847 1.00 0.00 H ATOM 50635 H2 WAT 239 50.784 69.245 132.761 1.00 0.00 H TER 50637 WAT 239 ATOM 50637 O WAT 240 88.467 114.210 70.035 1.00 0.00 O ATOM 50638 H1 WAT 240 88.902 113.911 70.833 1.00 0.00 H ATOM 50639 H2 WAT 240 88.711 113.564 69.372 1.00 0.00 H TER 50641 WAT 240 ATOM 50641 O WAT 241 108.647 145.321 136.218 1.00 0.00 O ATOM 50642 H1 WAT 241 109.326 145.720 135.674 1.00 0.00 H ATOM 50643 H2 WAT 241 108.067 144.884 135.594 1.00 0.00 H TER 50645 WAT 241 ATOM 50645 O WAT 242 77.619 84.550 29.461 1.00 0.00 O ATOM 50646 H1 WAT 242 78.262 85.179 29.133 1.00 0.00 H ATOM 50647 H2 WAT 242 76.775 84.899 29.176 1.00 0.00 H TER 50649 WAT 242 ATOM 50649 O WAT 243 73.253 16.046 63.800 1.00 0.00 O ATOM 50650 H1 WAT 243 72.764 16.845 63.994 1.00 0.00 H ATOM 50651 H2 WAT 243 74.172 16.311 63.838 1.00 0.00 H TER 50653 WAT 243 ATOM 50653 O WAT 244 124.517 125.593 8.229 1.00 0.00 O ATOM 50654 H1 WAT 244 124.699 124.673 8.420 1.00 0.00 H ATOM 50655 H2 WAT 244 124.218 125.594 7.320 1.00 0.00 H TER 50657 WAT 244 ATOM 50657 O WAT 245 80.382 0.955 112.752 1.00 0.00 O ATOM 50658 H1 WAT 245 79.434 0.951 112.885 1.00 0.00 H ATOM 50659 H2 WAT 245 80.663 1.816 113.062 1.00 0.00 H TER 50661 WAT 245 ATOM 50661 O WAT 246 142.106 49.912 115.091 1.00 0.00 O ATOM 50662 H1 WAT 246 142.634 49.428 114.456 1.00 0.00 H ATOM 50663 H2 WAT 246 141.296 49.407 115.162 1.00 0.00 H TER 50665 WAT 246 ATOM 50665 O WAT 247 93.236 138.608 58.209 1.00 0.00 O ATOM 50666 H1 WAT 247 94.028 138.365 57.730 1.00 0.00 H ATOM 50667 H2 WAT 247 93.316 138.156 59.049 1.00 0.00 H TER 50669 WAT 247 ATOM 50669 O WAT 248 23.325 15.497 131.342 1.00 0.00 O ATOM 50670 H1 WAT 248 24.166 15.727 130.947 1.00 0.00 H ATOM 50671 H2 WAT 248 22.713 16.150 131.001 1.00 0.00 H TER 50673 WAT 248 ATOM 50673 O WAT 249 66.876 21.874 129.861 1.00 0.00 O ATOM 50674 H1 WAT 249 66.356 22.493 130.373 1.00 0.00 H ATOM 50675 H2 WAT 249 66.413 21.041 129.951 1.00 0.00 H TER 50677 WAT 249 ATOM 50677 O WAT 250 82.619 112.033 0.859 1.00 0.00 O ATOM 50678 H1 WAT 250 82.018 112.739 0.625 1.00 0.00 H ATOM 50679 H2 WAT 250 82.359 111.781 1.745 1.00 0.00 H TER 50681 WAT 250 ATOM 50681 O WAT 251 79.572 124.478 121.969 1.00 0.00 O ATOM 50682 H1 WAT 251 80.157 123.864 121.525 1.00 0.00 H ATOM 50683 H2 WAT 251 79.173 124.984 121.260 1.00 0.00 H TER 50685 WAT 251 ATOM 50685 O WAT 252 94.379 83.023 114.421 1.00 0.00 O ATOM 50686 H1 WAT 252 95.189 82.551 114.615 1.00 0.00 H ATOM 50687 H2 WAT 252 94.104 83.384 115.264 1.00 0.00 H TER 50689 WAT 252 ATOM 50689 O WAT 253 52.888 25.651 15.568 1.00 0.00 O ATOM 50690 H1 WAT 253 53.252 26.157 14.841 1.00 0.00 H ATOM 50691 H2 WAT 253 51.971 25.517 15.331 1.00 0.00 H TER 50693 WAT 253 ATOM 50693 O WAT 254 53.610 55.985 127.847 1.00 0.00 O ATOM 50694 H1 WAT 254 53.861 56.408 128.668 1.00 0.00 H ATOM 50695 H2 WAT 254 53.128 56.659 127.367 1.00 0.00 H TER 50697 WAT 254 ATOM 50697 O WAT 255 16.087 107.039 111.731 1.00 0.00 O ATOM 50698 H1 WAT 255 15.826 106.122 111.648 1.00 0.00 H ATOM 50699 H2 WAT 255 16.877 107.015 112.271 1.00 0.00 H TER 50701 WAT 255 ATOM 50701 O WAT 256 141.976 133.106 116.246 1.00 0.00 O ATOM 50702 H1 WAT 256 141.220 133.689 116.165 1.00 0.00 H ATOM 50703 H2 WAT 256 142.352 133.079 115.366 1.00 0.00 H TER 50705 WAT 256 ATOM 50705 O WAT 257 124.293 112.130 0.621 1.00 0.00 O ATOM 50706 H1 WAT 257 124.016 112.902 1.115 1.00 0.00 H ATOM 50707 H2 WAT 257 124.531 112.471 -0.241 1.00 0.00 H TER 50709 WAT 257 ATOM 50709 O WAT 258 57.884 102.332 139.392 1.00 0.00 O ATOM 50710 H1 WAT 258 57.790 102.599 138.477 1.00 0.00 H ATOM 50711 H2 WAT 258 58.380 103.043 139.799 1.00 0.00 H TER 50713 WAT 258 ATOM 50713 O WAT 259 140.488 79.327 68.856 1.00 0.00 O ATOM 50714 H1 WAT 259 140.249 78.412 69.006 1.00 0.00 H ATOM 50715 H2 WAT 259 140.464 79.428 67.905 1.00 0.00 H TER 50717 WAT 259 ATOM 50717 O WAT 260 73.467 36.809 105.560 1.00 0.00 O ATOM 50718 H1 WAT 260 73.630 36.103 104.934 1.00 0.00 H ATOM 50719 H2 WAT 260 73.971 37.549 105.223 1.00 0.00 H TER 50721 WAT 260 ATOM 50721 O WAT 261 122.798 114.545 136.526 1.00 0.00 O ATOM 50722 H1 WAT 261 122.839 114.949 135.659 1.00 0.00 H ATOM 50723 H2 WAT 261 123.644 114.109 136.626 1.00 0.00 H TER 50725 WAT 261 ATOM 50725 O WAT 262 82.423 36.804 102.800 1.00 0.00 O ATOM 50726 H1 WAT 262 82.661 37.371 103.533 1.00 0.00 H ATOM 50727 H2 WAT 262 81.839 37.339 102.262 1.00 0.00 H TER 50729 WAT 262 ATOM 50729 O WAT 263 28.720 52.722 157.800 1.00 0.00 O ATOM 50730 H1 WAT 263 29.335 52.940 157.099 1.00 0.00 H ATOM 50731 H2 WAT 263 28.851 51.785 157.950 1.00 0.00 H TER 50733 WAT 263 ATOM 50733 O WAT 264 16.978 79.522 156.580 1.00 0.00 O ATOM 50734 H1 WAT 264 16.094 79.854 156.732 1.00 0.00 H ATOM 50735 H2 WAT 264 16.848 78.701 156.106 1.00 0.00 H TER 50737 WAT 264 ATOM 50737 O WAT 265 62.462 95.189 24.422 1.00 0.00 O ATOM 50738 H1 WAT 265 61.979 94.428 24.099 1.00 0.00 H ATOM 50739 H2 WAT 265 61.878 95.588 25.067 1.00 0.00 H TER 50741 WAT 265 ATOM 50741 O WAT 266 60.194 139.870 132.109 1.00 0.00 O ATOM 50742 H1 WAT 266 60.534 140.747 132.286 1.00 0.00 H ATOM 50743 H2 WAT 266 60.375 139.725 131.181 1.00 0.00 H TER 50745 WAT 266 ATOM 50745 O WAT 267 26.960 12.472 86.931 1.00 0.00 O ATOM 50746 H1 WAT 267 27.777 12.256 86.482 1.00 0.00 H ATOM 50747 H2 WAT 267 27.081 13.375 87.226 1.00 0.00 H TER 50749 WAT 267 ATOM 50749 O WAT 268 118.323 110.952 6.869 1.00 0.00 O ATOM 50750 H1 WAT 268 117.658 110.681 6.236 1.00 0.00 H ATOM 50751 H2 WAT 268 118.042 110.556 7.694 1.00 0.00 H TER 50753 WAT 268 ATOM 50753 O WAT 269 110.636 8.908 22.746 1.00 0.00 O ATOM 50754 H1 WAT 269 109.725 8.633 22.648 1.00 0.00 H ATOM 50755 H2 WAT 269 111.124 8.336 22.152 1.00 0.00 H TER 50757 WAT 269 ATOM 50757 O WAT 270 4.133 113.890 149.557 1.00 0.00 O ATOM 50758 H1 WAT 270 3.973 113.889 150.501 1.00 0.00 H ATOM 50759 H2 WAT 270 3.259 113.917 149.167 1.00 0.00 H TER 50761 WAT 270 ATOM 50761 O WAT 271 30.524 11.638 0.921 1.00 0.00 O ATOM 50762 H1 WAT 271 30.448 12.590 0.988 1.00 0.00 H ATOM 50763 H2 WAT 271 30.407 11.325 1.818 1.00 0.00 H TER 50765 WAT 271 ATOM 50765 O WAT 272 101.120 37.464 18.431 1.00 0.00 O ATOM 50766 H1 WAT 272 100.747 37.374 19.308 1.00 0.00 H ATOM 50767 H2 WAT 272 102.066 37.405 18.565 1.00 0.00 H TER 50769 WAT 272 ATOM 50769 O WAT 273 90.347 59.029 96.561 1.00 0.00 O ATOM 50770 H1 WAT 273 91.253 59.320 96.668 1.00 0.00 H ATOM 50771 H2 WAT 273 90.307 58.195 97.029 1.00 0.00 H TER 50773 WAT 273 ATOM 50773 O WAT 274 124.406 141.131 12.006 1.00 0.00 O ATOM 50774 H1 WAT 274 123.967 141.885 12.400 1.00 0.00 H ATOM 50775 H2 WAT 274 124.471 140.494 12.717 1.00 0.00 H TER 50777 WAT 274 ATOM 50777 O WAT 275 13.802 120.697 129.616 1.00 0.00 O ATOM 50778 H1 WAT 275 14.169 121.553 129.835 1.00 0.00 H ATOM 50779 H2 WAT 275 13.814 120.213 130.441 1.00 0.00 H TER 50781 WAT 275 ATOM 50781 O WAT 276 93.009 17.151 100.311 1.00 0.00 O ATOM 50782 H1 WAT 276 92.311 17.736 100.604 1.00 0.00 H ATOM 50783 H2 WAT 276 93.818 17.598 100.562 1.00 0.00 H TER 50785 WAT 276 ATOM 50785 O WAT 277 105.052 108.074 -0.180 1.00 0.00 O ATOM 50786 H1 WAT 277 104.179 107.832 0.131 1.00 0.00 H ATOM 50787 H2 WAT 277 105.600 108.051 0.604 1.00 0.00 H TER 50789 WAT 277 ATOM 50789 O WAT 278 39.221 87.036 115.180 1.00 0.00 O ATOM 50790 H1 WAT 278 38.642 87.546 115.747 1.00 0.00 H ATOM 50791 H2 WAT 278 39.264 87.540 114.367 1.00 0.00 H TER 50793 WAT 278 ATOM 50793 O WAT 279 23.453 5.492 130.247 1.00 0.00 O ATOM 50794 H1 WAT 279 23.012 6.033 130.902 1.00 0.00 H ATOM 50795 H2 WAT 279 23.427 4.607 130.611 1.00 0.00 H TER 50797 WAT 279 ATOM 50797 O WAT 280 69.936 129.259 7.245 1.00 0.00 O ATOM 50798 H1 WAT 280 69.535 128.678 7.891 1.00 0.00 H ATOM 50799 H2 WAT 280 69.479 130.093 7.357 1.00 0.00 H TER 50801 WAT 280 ATOM 50801 O WAT 281 138.243 121.416 117.861 1.00 0.00 O ATOM 50802 H1 WAT 281 138.802 122.102 117.496 1.00 0.00 H ATOM 50803 H2 WAT 281 138.532 120.614 117.427 1.00 0.00 H TER 50805 WAT 281 ATOM 50805 O WAT 282 100.173 3.063 106.202 1.00 0.00 O ATOM 50806 H1 WAT 282 100.793 2.333 106.211 1.00 0.00 H ATOM 50807 H2 WAT 282 99.794 3.044 105.323 1.00 0.00 H TER 50809 WAT 282 ATOM 50809 O WAT 283 33.450 119.058 122.525 1.00 0.00 O ATOM 50810 H1 WAT 283 34.030 118.471 122.040 1.00 0.00 H ATOM 50811 H2 WAT 283 32.572 118.708 122.372 1.00 0.00 H TER 50813 WAT 283 ATOM 50813 O WAT 284 88.958 72.824 115.212 1.00 0.00 O ATOM 50814 H1 WAT 284 89.301 72.119 114.663 1.00 0.00 H ATOM 50815 H2 WAT 284 88.173 73.125 114.753 1.00 0.00 H TER 50817 WAT 284 ATOM 50817 O WAT 285 5.215 43.325 15.042 1.00 0.00 O ATOM 50818 H1 WAT 285 5.896 43.430 14.378 1.00 0.00 H ATOM 50819 H2 WAT 285 5.669 42.937 15.790 1.00 0.00 H TER 50821 WAT 285 ATOM 50821 O WAT 286 128.191 21.597 68.533 1.00 0.00 O ATOM 50822 H1 WAT 286 128.381 20.682 68.738 1.00 0.00 H ATOM 50823 H2 WAT 286 129.007 21.934 68.162 1.00 0.00 H TER 50825 WAT 286 ATOM 50825 O WAT 287 36.157 68.644 89.691 1.00 0.00 O ATOM 50826 H1 WAT 287 35.667 67.936 90.109 1.00 0.00 H ATOM 50827 H2 WAT 287 37.014 68.261 89.498 1.00 0.00 H TER 50829 WAT 287 ATOM 50829 O WAT 288 14.320 131.290 99.669 1.00 0.00 O ATOM 50830 H1 WAT 288 15.110 130.752 99.614 1.00 0.00 H ATOM 50831 H2 WAT 288 13.840 131.094 98.864 1.00 0.00 H TER 50833 WAT 288 ATOM 50833 O WAT 289 87.149 7.251 151.432 1.00 0.00 O ATOM 50834 H1 WAT 289 86.948 7.758 150.645 1.00 0.00 H ATOM 50835 H2 WAT 289 87.969 6.802 151.225 1.00 0.00 H TER 50837 WAT 289 ATOM 50837 O WAT 290 127.084 18.004 124.483 1.00 0.00 O ATOM 50838 H1 WAT 290 127.629 17.543 125.121 1.00 0.00 H ATOM 50839 H2 WAT 290 127.021 18.897 124.823 1.00 0.00 H TER 50841 WAT 290 ATOM 50841 O WAT 291 138.669 106.960 148.706 1.00 0.00 O ATOM 50842 H1 WAT 291 138.712 106.205 149.294 1.00 0.00 H ATOM 50843 H2 WAT 291 139.354 107.549 149.023 1.00 0.00 H TER 50845 WAT 291 ATOM 50845 O WAT 292 116.057 64.831 151.511 1.00 0.00 O ATOM 50846 H1 WAT 292 116.963 64.670 151.776 1.00 0.00 H ATOM 50847 H2 WAT 292 115.974 65.784 151.508 1.00 0.00 H TER 50849 WAT 292 ATOM 50849 O WAT 293 86.521 108.267 13.071 1.00 0.00 O ATOM 50850 H1 WAT 293 86.269 107.750 12.306 1.00 0.00 H ATOM 50851 H2 WAT 293 86.891 109.071 12.706 1.00 0.00 H TER 50853 WAT 293 ATOM 50853 O WAT 294 88.817 133.514 122.555 1.00 0.00 O ATOM 50854 H1 WAT 294 89.667 133.599 122.988 1.00 0.00 H ATOM 50855 H2 WAT 294 88.550 132.611 122.728 1.00 0.00 H TER 50857 WAT 294 ATOM 50857 O WAT 295 24.348 8.497 149.534 1.00 0.00 O ATOM 50858 H1 WAT 295 23.682 7.885 149.223 1.00 0.00 H ATOM 50859 H2 WAT 295 24.131 9.325 149.105 1.00 0.00 H TER 50861 WAT 295 ATOM 50861 O WAT 296 97.770 64.405 82.913 1.00 0.00 O ATOM 50862 H1 WAT 296 97.015 64.141 82.387 1.00 0.00 H ATOM 50863 H2 WAT 296 97.589 64.053 83.785 1.00 0.00 H TER 50865 WAT 296 ATOM 50865 O WAT 297 50.927 101.759 157.786 1.00 0.00 O ATOM 50866 H1 WAT 297 50.802 101.061 158.429 1.00 0.00 H ATOM 50867 H2 WAT 297 50.405 101.486 157.031 1.00 0.00 H TER 50869 WAT 297 ATOM 50869 O WAT 298 137.333 9.749 93.367 1.00 0.00 O ATOM 50870 H1 WAT 298 137.530 8.874 93.031 1.00 0.00 H ATOM 50871 H2 WAT 298 136.397 9.864 93.202 1.00 0.00 H TER 50873 WAT 298 ATOM 50873 O WAT 299 92.220 117.438 151.729 1.00 0.00 O ATOM 50874 H1 WAT 299 92.378 116.689 152.303 1.00 0.00 H ATOM 50875 H2 WAT 299 91.864 118.113 152.307 1.00 0.00 H TER 50877 WAT 299 ATOM 50877 O WAT 300 141.298 50.782 92.500 1.00 0.00 O ATOM 50878 H1 WAT 300 141.036 51.158 91.660 1.00 0.00 H ATOM 50879 H2 WAT 300 140.552 50.943 93.078 1.00 0.00 H TER 50881 WAT 300 ATOM 50881 O WAT 301 123.966 37.861 81.480 1.00 0.00 O ATOM 50882 H1 WAT 301 123.314 37.758 80.787 1.00 0.00 H ATOM 50883 H2 WAT 301 123.683 37.258 82.167 1.00 0.00 H TER 50885 WAT 301 ATOM 50885 O WAT 302 9.377 24.512 105.875 1.00 0.00 O ATOM 50886 H1 WAT 302 9.534 24.103 106.726 1.00 0.00 H ATOM 50887 H2 WAT 302 9.440 23.791 105.248 1.00 0.00 H TER 50889 WAT 302 ATOM 50889 O WAT 303 89.698 59.578 121.801 1.00 0.00 O ATOM 50890 H1 WAT 303 90.419 59.070 121.429 1.00 0.00 H ATOM 50891 H2 WAT 303 89.382 60.113 121.072 1.00 0.00 H TER 50893 WAT 303 ATOM 50893 O WAT 304 39.031 17.299 7.593 1.00 0.00 O ATOM 50894 H1 WAT 304 39.114 16.413 7.241 1.00 0.00 H ATOM 50895 H2 WAT 304 39.763 17.384 8.203 1.00 0.00 H TER 50897 WAT 304 ATOM 50897 O WAT 305 121.779 142.289 81.309 1.00 0.00 O ATOM 50898 H1 WAT 305 121.077 142.925 81.169 1.00 0.00 H ATOM 50899 H2 WAT 305 122.554 142.822 81.485 1.00 0.00 H TER 50901 WAT 305 ATOM 50901 O WAT 306 140.697 71.248 6.810 1.00 0.00 O ATOM 50902 H1 WAT 306 141.470 71.701 7.145 1.00 0.00 H ATOM 50903 H2 WAT 306 139.980 71.554 7.367 1.00 0.00 H TER 50905 WAT 306 ATOM 50905 O WAT 307 79.795 121.409 5.936 1.00 0.00 O ATOM 50906 H1 WAT 307 80.429 121.937 6.422 1.00 0.00 H ATOM 50907 H2 WAT 307 79.054 121.316 6.534 1.00 0.00 H TER 50909 WAT 307 ATOM 50909 O WAT 308 42.830 2.972 54.917 1.00 0.00 O ATOM 50910 H1 WAT 308 43.399 2.260 54.626 1.00 0.00 H ATOM 50911 H2 WAT 308 43.142 3.184 55.797 1.00 0.00 H TER 50913 WAT 308 ATOM 50913 O WAT 309 53.677 53.916 92.479 1.00 0.00 O ATOM 50914 H1 WAT 309 52.930 54.472 92.258 1.00 0.00 H ATOM 50915 H2 WAT 309 54.324 54.518 92.847 1.00 0.00 H TER 50917 WAT 309 ATOM 50917 O WAT 310 59.335 119.679 122.634 1.00 0.00 O ATOM 50918 H1 WAT 310 59.217 120.216 121.851 1.00 0.00 H ATOM 50919 H2 WAT 310 58.769 118.921 122.492 1.00 0.00 H TER 50921 WAT 310 ATOM 50921 O WAT 311 4.427 37.480 101.617 1.00 0.00 O ATOM 50922 H1 WAT 311 3.860 36.949 102.176 1.00 0.00 H ATOM 50923 H2 WAT 311 5.132 37.770 102.197 1.00 0.00 H TER 50925 WAT 311 ATOM 50925 O WAT 312 138.995 118.366 60.693 1.00 0.00 O ATOM 50926 H1 WAT 312 138.486 117.573 60.527 1.00 0.00 H ATOM 50927 H2 WAT 312 139.794 118.250 60.178 1.00 0.00 H TER 50929 WAT 312 ATOM 50929 O WAT 313 108.514 96.784 147.934 1.00 0.00 O ATOM 50930 H1 WAT 313 109.217 96.479 148.507 1.00 0.00 H ATOM 50931 H2 WAT 313 108.750 96.453 147.067 1.00 0.00 H TER 50933 WAT 313 ATOM 50933 O WAT 314 135.962 122.958 69.973 1.00 0.00 O ATOM 50934 H1 WAT 314 135.619 123.591 69.341 1.00 0.00 H ATOM 50935 H2 WAT 314 135.242 122.342 70.109 1.00 0.00 H TER 50937 WAT 314 ATOM 50937 O WAT 315 142.727 2.640 124.529 1.00 0.00 O ATOM 50938 H1 WAT 315 142.500 1.736 124.745 1.00 0.00 H ATOM 50939 H2 WAT 315 143.678 2.629 124.420 1.00 0.00 H TER 50941 WAT 315 ATOM 50941 O WAT 316 85.626 53.809 81.151 1.00 0.00 O ATOM 50942 H1 WAT 316 85.372 54.659 81.511 1.00 0.00 H ATOM 50943 H2 WAT 316 86.381 54.001 80.595 1.00 0.00 H TER 50945 WAT 316 ATOM 50945 O WAT 317 1.478 90.779 113.927 1.00 0.00 O ATOM 50946 H1 WAT 317 1.090 90.270 113.215 1.00 0.00 H ATOM 50947 H2 WAT 317 2.044 90.157 114.385 1.00 0.00 H TER 50949 WAT 317 ATOM 50949 O WAT 318 39.180 103.021 96.628 1.00 0.00 O ATOM 50950 H1 WAT 318 39.165 102.230 96.089 1.00 0.00 H ATOM 50951 H2 WAT 318 38.893 103.718 96.039 1.00 0.00 H TER 50953 WAT 318 ATOM 50953 O WAT 319 127.061 139.820 117.003 1.00 0.00 O ATOM 50954 H1 WAT 319 126.418 140.032 117.680 1.00 0.00 H ATOM 50955 H2 WAT 319 126.685 140.174 116.197 1.00 0.00 H TER 50957 WAT 319 ATOM 50957 O WAT 320 78.709 51.545 113.039 1.00 0.00 O ATOM 50958 H1 WAT 320 78.041 51.737 113.696 1.00 0.00 H ATOM 50959 H2 WAT 320 78.576 52.208 112.361 1.00 0.00 H TER 50961 WAT 320 ATOM 50961 O WAT 321 95.059 115.671 93.000 1.00 0.00 O ATOM 50962 H1 WAT 321 94.812 116.271 93.703 1.00 0.00 H ATOM 50963 H2 WAT 321 95.991 115.503 93.144 1.00 0.00 H TER 50965 WAT 321 ATOM 50965 O WAT 322 15.882 83.350 139.899 1.00 0.00 O ATOM 50966 H1 WAT 322 15.406 84.155 139.698 1.00 0.00 H ATOM 50967 H2 WAT 322 15.509 83.052 140.729 1.00 0.00 H TER 50969 WAT 322 ATOM 50969 O WAT 323 108.741 55.300 136.089 1.00 0.00 O ATOM 50970 H1 WAT 323 108.879 54.676 136.802 1.00 0.00 H ATOM 50971 H2 WAT 323 108.700 54.759 135.301 1.00 0.00 H TER 50973 WAT 323 ATOM 50973 O WAT 324 77.706 16.076 3.241 1.00 0.00 O ATOM 50974 H1 WAT 324 77.930 16.625 2.490 1.00 0.00 H ATOM 50975 H2 WAT 324 77.570 16.695 3.958 1.00 0.00 H TER 50977 WAT 324 ATOM 50977 O WAT 325 137.454 119.647 139.591 1.00 0.00 O ATOM 50978 H1 WAT 325 137.352 119.470 140.526 1.00 0.00 H ATOM 50979 H2 WAT 325 136.995 120.475 139.452 1.00 0.00 H TER 50981 WAT 325 ATOM 50981 O WAT 326 88.350 8.995 109.450 1.00 0.00 O ATOM 50982 H1 WAT 326 88.557 9.309 110.330 1.00 0.00 H ATOM 50983 H2 WAT 326 87.492 9.373 109.257 1.00 0.00 H TER 50985 WAT 326 ATOM 50985 O WAT 327 128.596 16.787 126.500 1.00 0.00 O ATOM 50986 H1 WAT 327 129.445 16.663 126.076 1.00 0.00 H ATOM 50987 H2 WAT 327 128.136 15.959 126.359 1.00 0.00 H TER 50989 WAT 327 ATOM 50989 O WAT 328 29.211 140.198 59.404 1.00 0.00 O ATOM 50990 H1 WAT 328 28.775 139.616 58.782 1.00 0.00 H ATOM 50991 H2 WAT 328 30.137 139.967 59.341 1.00 0.00 H TER 50993 WAT 328 ATOM 50993 O WAT 329 89.365 47.272 68.349 1.00 0.00 O ATOM 50994 H1 WAT 329 90.310 47.287 68.199 1.00 0.00 H ATOM 50995 H2 WAT 329 88.983 47.346 67.474 1.00 0.00 H TER 50997 WAT 329 ATOM 50997 O WAT 330 126.220 44.902 13.028 1.00 0.00 O ATOM 50998 H1 WAT 330 126.923 44.543 13.570 1.00 0.00 H ATOM 50999 H2 WAT 330 126.674 45.325 12.299 1.00 0.00 H TER 51001 WAT 330 ATOM 51001 O WAT 331 128.836 34.109 83.322 1.00 0.00 O ATOM 51002 H1 WAT 331 129.148 33.758 82.488 1.00 0.00 H ATOM 51003 H2 WAT 331 129.632 34.384 83.778 1.00 0.00 H TER 51005 WAT 331 ATOM 51005 O WAT 332 94.058 64.789 6.590 1.00 0.00 O ATOM 51006 H1 WAT 332 94.822 64.220 6.680 1.00 0.00 H ATOM 51007 H2 WAT 332 94.211 65.269 5.776 1.00 0.00 H TER 51009 WAT 332 ATOM 51009 O WAT 333 84.346 28.192 112.526 1.00 0.00 O ATOM 51010 H1 WAT 333 83.718 27.471 112.573 1.00 0.00 H ATOM 51011 H2 WAT 333 83.993 28.855 113.120 1.00 0.00 H TER 51013 WAT 333 ATOM 51013 O WAT 334 17.584 137.045 23.121 1.00 0.00 O ATOM 51014 H1 WAT 334 17.215 136.219 23.434 1.00 0.00 H ATOM 51015 H2 WAT 334 17.358 137.681 23.800 1.00 0.00 H TER 51017 WAT 334 ATOM 51017 O WAT 335 14.347 10.372 151.209 1.00 0.00 O ATOM 51018 H1 WAT 335 14.608 11.293 151.235 1.00 0.00 H ATOM 51019 H2 WAT 335 14.107 10.217 150.296 1.00 0.00 H TER 51021 WAT 335 ATOM 51021 O WAT 336 103.254 54.617 104.479 1.00 0.00 O ATOM 51022 H1 WAT 336 103.690 54.316 105.277 1.00 0.00 H ATOM 51023 H2 WAT 336 103.755 55.386 104.208 1.00 0.00 H TER 51025 WAT 336 ATOM 51025 O WAT 337 5.804 90.498 87.975 1.00 0.00 O ATOM 51026 H1 WAT 337 6.613 91.009 87.955 1.00 0.00 H ATOM 51027 H2 WAT 337 5.863 89.926 87.210 1.00 0.00 H TER 51029 WAT 337 ATOM 51029 O WAT 338 130.885 139.574 0.415 1.00 0.00 O ATOM 51030 H1 WAT 338 130.973 139.101 1.243 1.00 0.00 H ATOM 51031 H2 WAT 338 131.704 140.063 0.331 1.00 0.00 H TER 51033 WAT 338 ATOM 51033 O WAT 339 139.674 71.991 125.594 1.00 0.00 O ATOM 51034 H1 WAT 339 139.741 72.945 125.639 1.00 0.00 H ATOM 51035 H2 WAT 339 139.872 71.779 124.682 1.00 0.00 H TER 51037 WAT 339 ATOM 51037 O WAT 340 14.722 20.827 72.122 1.00 0.00 O ATOM 51038 H1 WAT 340 14.647 21.742 71.853 1.00 0.00 H ATOM 51039 H2 WAT 340 14.673 20.332 71.304 1.00 0.00 H TER 51041 WAT 340 ATOM 51041 O WAT 341 56.309 85.165 134.704 1.00 0.00 O ATOM 51042 H1 WAT 341 56.869 84.668 134.108 1.00 0.00 H ATOM 51043 H2 WAT 341 55.675 85.597 134.132 1.00 0.00 H TER 51045 WAT 341 ATOM 51045 O WAT 342 41.002 97.151 99.855 1.00 0.00 O ATOM 51046 H1 WAT 342 41.735 96.641 100.200 1.00 0.00 H ATOM 51047 H2 WAT 342 41.411 97.927 99.471 1.00 0.00 H TER 51049 WAT 342 ATOM 51049 O WAT 343 77.721 123.831 57.931 1.00 0.00 O ATOM 51050 H1 WAT 343 78.186 123.358 57.240 1.00 0.00 H ATOM 51051 H2 WAT 343 78.407 124.302 58.403 1.00 0.00 H TER 51053 WAT 343 ATOM 51053 O WAT 344 57.851 33.815 19.834 1.00 0.00 O ATOM 51054 H1 WAT 344 57.123 33.900 19.219 1.00 0.00 H ATOM 51055 H2 WAT 344 57.493 33.304 20.560 1.00 0.00 H TER 51057 WAT 344 ATOM 51057 O WAT 345 38.581 79.298 72.681 1.00 0.00 O ATOM 51058 H1 WAT 345 37.982 78.935 72.029 1.00 0.00 H ATOM 51059 H2 WAT 345 38.801 78.556 73.244 1.00 0.00 H TER 51061 WAT 345 ATOM 51061 O WAT 346 99.615 71.136 2.315 1.00 0.00 O ATOM 51062 H1 WAT 346 100.511 71.352 2.573 1.00 0.00 H ATOM 51063 H2 WAT 346 99.686 70.872 1.398 1.00 0.00 H TER 51065 WAT 346 ATOM 51065 O WAT 347 2.939 56.001 149.895 1.00 0.00 O ATOM 51066 H1 WAT 347 3.006 56.899 149.568 1.00 0.00 H ATOM 51067 H2 WAT 347 3.815 55.636 149.773 1.00 0.00 H TER 51069 WAT 347 ATOM 51069 O WAT 348 52.037 22.526 95.381 1.00 0.00 O ATOM 51070 H1 WAT 348 52.477 22.110 94.640 1.00 0.00 H ATOM 51071 H2 WAT 348 51.440 23.158 94.981 1.00 0.00 H TER 51073 WAT 348 ATOM 51073 O WAT 349 49.043 79.640 67.014 1.00 0.00 O ATOM 51074 H1 WAT 349 49.211 79.576 66.074 1.00 0.00 H ATOM 51075 H2 WAT 349 48.204 79.196 67.138 1.00 0.00 H TER 51077 WAT 349 ATOM 51077 O WAT 350 3.893 103.916 78.016 1.00 0.00 O ATOM 51078 H1 WAT 350 3.608 104.805 77.807 1.00 0.00 H ATOM 51079 H2 WAT 350 3.276 103.617 78.684 1.00 0.00 H TER 51081 WAT 350 ATOM 51081 O WAT 351 126.229 123.775 155.312 1.00 0.00 O ATOM 51082 H1 WAT 351 127.083 124.111 155.038 1.00 0.00 H ATOM 51083 H2 WAT 351 126.402 122.874 155.583 1.00 0.00 H TER 51085 WAT 351 ATOM 51085 O WAT 352 76.301 140.095 131.727 1.00 0.00 O ATOM 51086 H1 WAT 352 77.179 140.061 131.349 1.00 0.00 H ATOM 51087 H2 WAT 352 75.714 139.972 130.981 1.00 0.00 H TER 51089 WAT 352 ATOM 51089 O WAT 353 77.073 32.059 128.188 1.00 0.00 O ATOM 51090 H1 WAT 353 77.275 32.676 128.891 1.00 0.00 H ATOM 51091 H2 WAT 353 77.926 31.826 127.821 1.00 0.00 H TER 51093 WAT 353 ATOM 51093 O WAT 354 17.870 122.084 148.708 1.00 0.00 O ATOM 51094 H1 WAT 354 18.643 121.763 149.173 1.00 0.00 H ATOM 51095 H2 WAT 354 17.840 123.019 148.911 1.00 0.00 H TER 51097 WAT 354 ATOM 51097 O WAT 355 40.830 142.361 88.712 1.00 0.00 O ATOM 51098 H1 WAT 355 40.348 141.538 88.629 1.00 0.00 H ATOM 51099 H2 WAT 355 41.592 142.251 88.144 1.00 0.00 H TER 51101 WAT 355 ATOM 51101 O WAT 356 1.679 29.961 58.785 1.00 0.00 O ATOM 51102 H1 WAT 356 1.974 30.644 58.183 1.00 0.00 H ATOM 51103 H2 WAT 356 0.764 30.178 58.963 1.00 0.00 H TER 51105 WAT 356 ATOM 51105 O WAT 357 1.211 117.984 114.504 1.00 0.00 O ATOM 51106 H1 WAT 357 1.269 117.792 115.440 1.00 0.00 H ATOM 51107 H2 WAT 357 0.911 117.164 114.110 1.00 0.00 H TER 51109 WAT 357 ATOM 51109 O WAT 358 143.049 61.048 16.254 1.00 0.00 O ATOM 51110 H1 WAT 358 143.719 60.482 16.636 1.00 0.00 H ATOM 51111 H2 WAT 358 142.328 60.455 16.040 1.00 0.00 H TER 51113 WAT 358 ATOM 51113 O WAT 359 32.344 103.699 58.629 1.00 0.00 O ATOM 51114 H1 WAT 359 32.870 103.920 57.860 1.00 0.00 H ATOM 51115 H2 WAT 359 32.850 103.022 59.078 1.00 0.00 H TER 51117 WAT 359 ATOM 51117 O WAT 360 19.040 112.849 76.563 1.00 0.00 O ATOM 51118 H1 WAT 360 18.837 113.663 76.101 1.00 0.00 H ATOM 51119 H2 WAT 360 18.798 113.023 77.473 1.00 0.00 H TER 51121 WAT 360 ATOM 51121 O WAT 361 89.701 124.944 95.140 1.00 0.00 O ATOM 51122 H1 WAT 361 88.996 124.439 94.735 1.00 0.00 H ATOM 51123 H2 WAT 361 90.247 124.288 95.574 1.00 0.00 H TER 51125 WAT 361 ATOM 51125 O WAT 362 131.155 111.008 150.902 1.00 0.00 O ATOM 51126 H1 WAT 362 131.856 110.376 150.741 1.00 0.00 H ATOM 51127 H2 WAT 362 130.377 110.470 151.047 1.00 0.00 H TER 51129 WAT 362 ATOM 51129 O WAT 363 26.434 2.023 91.186 1.00 0.00 O ATOM 51130 H1 WAT 363 26.162 2.518 91.958 1.00 0.00 H ATOM 51131 H2 WAT 363 27.172 1.493 91.487 1.00 0.00 H TER 51133 WAT 363 ATOM 51133 O WAT 364 0.838 66.731 105.207 1.00 0.00 O ATOM 51134 H1 WAT 364 0.756 65.919 105.707 1.00 0.00 H ATOM 51135 H2 WAT 364 1.500 66.538 104.543 1.00 0.00 H TER 51137 WAT 364 ATOM 51137 O WAT 365 30.407 34.102 6.719 1.00 0.00 O ATOM 51138 H1 WAT 365 30.180 34.255 7.637 1.00 0.00 H ATOM 51139 H2 WAT 365 29.570 33.917 6.293 1.00 0.00 H TER 51141 WAT 365 ATOM 51141 O WAT 366 24.167 121.809 7.130 1.00 0.00 O ATOM 51142 H1 WAT 366 24.247 120.910 7.448 1.00 0.00 H ATOM 51143 H2 WAT 366 24.943 121.940 6.586 1.00 0.00 H TER 51145 WAT 366 ATOM 51145 O WAT 367 72.536 62.231 17.498 1.00 0.00 O ATOM 51146 H1 WAT 367 73.152 62.221 18.230 1.00 0.00 H ATOM 51147 H2 WAT 367 72.171 63.116 17.504 1.00 0.00 H TER 51149 WAT 367 ATOM 51149 O WAT 368 55.456 111.835 145.934 1.00 0.00 O ATOM 51150 H1 WAT 368 54.594 112.240 146.028 1.00 0.00 H ATOM 51151 H2 WAT 368 56.052 112.571 145.792 1.00 0.00 H TER 51153 WAT 368 ATOM 51153 O WAT 369 21.596 110.424 85.822 1.00 0.00 O ATOM 51154 H1 WAT 369 22.461 110.812 85.694 1.00 0.00 H ATOM 51155 H2 WAT 369 21.031 111.166 86.038 1.00 0.00 H TER 51157 WAT 369 ATOM 51157 O WAT 370 11.451 93.610 19.654 1.00 0.00 O ATOM 51158 H1 WAT 370 12.075 93.988 20.273 1.00 0.00 H ATOM 51159 H2 WAT 370 11.717 92.694 19.576 1.00 0.00 H TER 51161 WAT 370 ATOM 51161 O WAT 371 32.574 24.952 114.776 1.00 0.00 O ATOM 51162 H1 WAT 371 33.027 25.659 114.317 1.00 0.00 H ATOM 51163 H2 WAT 371 32.098 25.390 115.482 1.00 0.00 H TER 51165 WAT 371 ATOM 51165 O WAT 372 70.084 39.982 92.954 1.00 0.00 O ATOM 51166 H1 WAT 372 70.448 39.809 93.823 1.00 0.00 H ATOM 51167 H2 WAT 372 70.843 40.215 92.419 1.00 0.00 H TER 51169 WAT 372 ATOM 51169 O WAT 373 137.225 143.522 127.600 1.00 0.00 O ATOM 51170 H1 WAT 373 136.746 143.099 128.312 1.00 0.00 H ATOM 51171 H2 WAT 373 137.802 142.839 127.259 1.00 0.00 H TER 51173 WAT 373 ATOM 51173 O WAT 374 48.691 22.517 143.302 1.00 0.00 O ATOM 51174 H1 WAT 374 49.302 22.521 144.038 1.00 0.00 H ATOM 51175 H2 WAT 374 47.952 21.990 143.607 1.00 0.00 H TER 51177 WAT 374 ATOM 51177 O WAT 375 45.106 92.565 82.099 1.00 0.00 O ATOM 51178 H1 WAT 375 45.845 93.111 81.833 1.00 0.00 H ATOM 51179 H2 WAT 375 44.333 93.086 81.882 1.00 0.00 H TER 51181 WAT 375 ATOM 51181 O WAT 376 130.728 4.441 118.033 1.00 0.00 O ATOM 51182 H1 WAT 376 130.946 4.997 117.285 1.00 0.00 H ATOM 51183 H2 WAT 376 130.143 3.774 117.673 1.00 0.00 H TER 51185 WAT 376 ATOM 51185 O WAT 377 122.638 51.893 115.039 1.00 0.00 O ATOM 51186 H1 WAT 377 121.732 51.605 114.925 1.00 0.00 H ATOM 51187 H2 WAT 377 123.134 51.378 114.402 1.00 0.00 H TER 51189 WAT 377 ATOM 51189 O WAT 378 95.486 138.498 134.702 1.00 0.00 O ATOM 51190 H1 WAT 378 96.061 138.547 133.939 1.00 0.00 H ATOM 51191 H2 WAT 378 95.016 139.332 134.703 1.00 0.00 H TER 51193 WAT 378 ATOM 51193 O WAT 379 113.974 90.424 26.388 1.00 0.00 O ATOM 51194 H1 WAT 379 114.074 91.139 27.016 1.00 0.00 H ATOM 51195 H2 WAT 379 113.068 90.136 26.496 1.00 0.00 H TER 51197 WAT 379 ATOM 51197 O WAT 380 87.823 31.907 109.721 1.00 0.00 O ATOM 51198 H1 WAT 380 87.255 31.772 108.963 1.00 0.00 H ATOM 51199 H2 WAT 380 88.692 31.645 109.419 1.00 0.00 H TER 51201 WAT 380 ATOM 51201 O WAT 381 118.778 60.758 23.748 1.00 0.00 O ATOM 51202 H1 WAT 381 118.395 60.404 24.551 1.00 0.00 H ATOM 51203 H2 WAT 381 118.887 61.692 23.926 1.00 0.00 H TER 51205 WAT 381 ATOM 51205 O WAT 382 74.997 53.844 79.052 1.00 0.00 O ATOM 51206 H1 WAT 382 75.844 54.060 78.661 1.00 0.00 H ATOM 51207 H2 WAT 382 74.438 54.592 78.840 1.00 0.00 H TER 51209 WAT 382 ATOM 51209 O WAT 383 145.402 115.210 135.509 1.00 0.00 O ATOM 51210 H1 WAT 383 144.592 114.737 135.319 1.00 0.00 H ATOM 51211 H2 WAT 383 145.706 115.518 134.655 1.00 0.00 H TER 51213 WAT 383 ATOM 51213 O WAT 384 127.049 88.162 147.563 1.00 0.00 O ATOM 51214 H1 WAT 384 126.668 87.291 147.454 1.00 0.00 H ATOM 51215 H2 WAT 384 127.825 88.018 148.104 1.00 0.00 H TER 51217 WAT 384 ATOM 51217 O WAT 385 53.520 59.172 17.057 1.00 0.00 O ATOM 51218 H1 WAT 385 52.712 58.783 17.394 1.00 0.00 H ATOM 51219 H2 WAT 385 53.929 59.575 17.823 1.00 0.00 H TER 51221 WAT 385 ATOM 51221 O WAT 386 140.889 85.236 66.084 1.00 0.00 O ATOM 51222 H1 WAT 386 140.811 84.385 66.515 1.00 0.00 H ATOM 51223 H2 WAT 386 141.594 85.118 65.448 1.00 0.00 H TER 51225 WAT 386 ATOM 51225 O WAT 387 36.167 61.121 91.553 1.00 0.00 O ATOM 51226 H1 WAT 387 35.975 61.311 92.471 1.00 0.00 H ATOM 51227 H2 WAT 387 36.612 61.906 91.234 1.00 0.00 H TER 51229 WAT 387 ATOM 51229 O WAT 388 43.239 138.776 4.924 1.00 0.00 O ATOM 51230 H1 WAT 388 43.633 139.139 5.717 1.00 0.00 H ATOM 51231 H2 WAT 388 42.485 139.340 4.751 1.00 0.00 H TER 51233 WAT 388 ATOM 51233 O WAT 389 37.124 142.507 88.790 1.00 0.00 O ATOM 51234 H1 WAT 389 37.418 142.781 87.921 1.00 0.00 H ATOM 51235 H2 WAT 389 37.579 143.094 89.393 1.00 0.00 H TER 51237 WAT 389 ATOM 51237 O WAT 390 48.592 88.345 148.378 1.00 0.00 O ATOM 51238 H1 WAT 390 49.216 88.699 147.745 1.00 0.00 H ATOM 51239 H2 WAT 390 48.483 87.429 148.120 1.00 0.00 H TER 51241 WAT 390 ATOM 51241 O WAT 391 53.098 115.858 9.831 1.00 0.00 O ATOM 51242 H1 WAT 391 53.967 115.951 10.220 1.00 0.00 H ATOM 51243 H2 WAT 391 53.091 114.972 9.469 1.00 0.00 H TER 51245 WAT 391 ATOM 51245 O WAT 392 85.739 122.292 77.559 1.00 0.00 O ATOM 51246 H1 WAT 392 85.236 123.071 77.324 1.00 0.00 H ATOM 51247 H2 WAT 392 85.927 122.401 78.492 1.00 0.00 H TER 51249 WAT 392 ATOM 51249 O WAT 393 91.039 94.819 86.165 1.00 0.00 O ATOM 51250 H1 WAT 393 90.681 95.401 86.835 1.00 0.00 H ATOM 51251 H2 WAT 393 91.725 94.327 86.617 1.00 0.00 H TER 51253 WAT 393 ATOM 51253 O WAT 394 15.968 59.859 94.954 1.00 0.00 O ATOM 51254 H1 WAT 394 16.801 59.524 95.284 1.00 0.00 H ATOM 51255 H2 WAT 394 16.214 60.472 94.261 1.00 0.00 H TER 51257 WAT 394 ATOM 51257 O WAT 395 18.729 97.476 83.161 1.00 0.00 O ATOM 51258 H1 WAT 395 19.324 97.142 83.832 1.00 0.00 H ATOM 51259 H2 WAT 395 17.879 97.527 83.599 1.00 0.00 H TER 51261 WAT 395 ATOM 51261 O WAT 396 103.731 135.574 77.822 1.00 0.00 O ATOM 51262 H1 WAT 396 103.089 135.002 78.243 1.00 0.00 H ATOM 51263 H2 WAT 396 103.422 136.460 78.013 1.00 0.00 H TER 51265 WAT 396 ATOM 51265 O WAT 397 102.179 72.153 141.481 1.00 0.00 O ATOM 51266 H1 WAT 397 102.507 72.512 142.306 1.00 0.00 H ATOM 51267 H2 WAT 397 102.850 71.526 141.209 1.00 0.00 H TER 51269 WAT 397 ATOM 51269 O WAT 398 105.222 44.191 61.240 1.00 0.00 O ATOM 51270 H1 WAT 398 105.817 44.107 61.985 1.00 0.00 H ATOM 51271 H2 WAT 398 105.046 45.130 61.178 1.00 0.00 H TER 51273 WAT 398 ATOM 51273 O WAT 399 28.640 106.967 83.233 1.00 0.00 O ATOM 51274 H1 WAT 399 28.676 107.158 84.170 1.00 0.00 H ATOM 51275 H2 WAT 399 28.599 107.827 82.814 1.00 0.00 H TER 51277 WAT 399 ATOM 51277 O WAT 400 60.376 27.520 115.432 1.00 0.00 O ATOM 51278 H1 WAT 400 59.558 27.976 115.630 1.00 0.00 H ATOM 51279 H2 WAT 400 60.830 28.098 114.818 1.00 0.00 H TER 51281 WAT 400 ATOM 51281 O WAT 401 48.666 37.705 64.894 1.00 0.00 O ATOM 51282 H1 WAT 401 49.388 37.983 65.457 1.00 0.00 H ATOM 51283 H2 WAT 401 48.830 38.146 64.060 1.00 0.00 H TER 51285 WAT 401 ATOM 51285 O WAT 402 57.612 9.189 144.663 1.00 0.00 O ATOM 51286 H1 WAT 402 58.340 8.767 144.207 1.00 0.00 H ATOM 51287 H2 WAT 402 57.503 10.028 144.215 1.00 0.00 H TER 51289 WAT 402 ATOM 51289 O WAT 403 0.573 13.351 5.389 1.00 0.00 O ATOM 51290 H1 WAT 403 1.300 12.809 5.083 1.00 0.00 H ATOM 51291 H2 WAT 403 0.505 13.154 6.323 1.00 0.00 H TER 51293 WAT 403 ATOM 51293 O WAT 404 69.828 37.484 66.017 1.00 0.00 O ATOM 51294 H1 WAT 404 69.562 37.863 65.179 1.00 0.00 H ATOM 51295 H2 WAT 404 70.042 38.239 66.564 1.00 0.00 H TER 51297 WAT 404 ATOM 51297 O WAT 405 58.990 48.642 7.585 1.00 0.00 O ATOM 51298 H1 WAT 405 59.413 47.897 8.011 1.00 0.00 H ATOM 51299 H2 WAT 405 59.473 48.755 6.766 1.00 0.00 H TER 51301 WAT 405 ATOM 51301 O WAT 406 104.860 83.327 133.155 1.00 0.00 O ATOM 51302 H1 WAT 406 105.796 83.398 133.344 1.00 0.00 H ATOM 51303 H2 WAT 406 104.499 84.175 133.414 1.00 0.00 H TER 51305 WAT 406 ATOM 51305 O WAT 407 93.232 42.010 19.047 1.00 0.00 O ATOM 51306 H1 WAT 407 92.302 42.206 18.935 1.00 0.00 H ATOM 51307 H2 WAT 407 93.314 41.755 19.966 1.00 0.00 H TER 51309 WAT 407 ATOM 51309 O WAT 408 54.255 125.427 106.182 1.00 0.00 O ATOM 51310 H1 WAT 408 53.653 125.683 106.881 1.00 0.00 H ATOM 51311 H2 WAT 408 54.990 126.034 106.265 1.00 0.00 H TER 51313 WAT 408 ATOM 51313 O WAT 409 35.062 102.494 123.940 1.00 0.00 O ATOM 51314 H1 WAT 409 35.703 102.826 123.312 1.00 0.00 H ATOM 51315 H2 WAT 409 34.231 102.505 123.464 1.00 0.00 H TER 51317 WAT 409 ATOM 51317 O WAT 410 26.056 145.705 106.984 1.00 0.00 O ATOM 51318 H1 WAT 410 26.458 146.570 106.906 1.00 0.00 H ATOM 51319 H2 WAT 410 26.152 145.479 107.909 1.00 0.00 H TER 51321 WAT 410 ATOM 51321 O WAT 411 92.062 140.935 5.071 1.00 0.00 O ATOM 51322 H1 WAT 411 92.634 140.566 4.398 1.00 0.00 H ATOM 51323 H2 WAT 411 91.286 141.227 4.593 1.00 0.00 H TER 51325 WAT 411 ATOM 51325 O WAT 412 70.571 22.135 53.187 1.00 0.00 O ATOM 51326 H1 WAT 412 70.838 21.318 52.766 1.00 0.00 H ATOM 51327 H2 WAT 412 70.350 22.718 52.461 1.00 0.00 H TER 51329 WAT 412 ATOM 51329 O WAT 413 2.345 110.003 15.987 1.00 0.00 O ATOM 51330 H1 WAT 413 2.315 109.835 16.929 1.00 0.00 H ATOM 51331 H2 WAT 413 3.012 110.682 15.885 1.00 0.00 H TER 51333 WAT 413 ATOM 51333 O WAT 414 100.399 56.418 146.575 1.00 0.00 O ATOM 51334 H1 WAT 414 99.687 56.718 147.141 1.00 0.00 H ATOM 51335 H2 WAT 414 100.887 57.213 146.362 1.00 0.00 H TER 51337 WAT 414 ATOM 51337 O WAT 415 60.553 122.112 97.579 1.00 0.00 O ATOM 51338 H1 WAT 415 60.381 121.232 97.246 1.00 0.00 H ATOM 51339 H2 WAT 415 60.669 121.993 98.522 1.00 0.00 H TER 51341 WAT 415 ATOM 51341 O WAT 416 58.769 113.294 147.138 1.00 0.00 O ATOM 51342 H1 WAT 416 58.933 112.357 147.034 1.00 0.00 H ATOM 51343 H2 WAT 416 58.138 113.504 146.450 1.00 0.00 H TER 51345 WAT 416 ATOM 51345 O WAT 417 47.111 95.376 27.518 1.00 0.00 O ATOM 51346 H1 WAT 417 46.649 94.722 28.042 1.00 0.00 H ATOM 51347 H2 WAT 417 48.008 95.360 27.853 1.00 0.00 H TER 51349 WAT 417 ATOM 51349 O WAT 418 57.538 85.442 66.327 1.00 0.00 O ATOM 51350 H1 WAT 418 57.965 84.913 67.001 1.00 0.00 H ATOM 51351 H2 WAT 418 58.202 86.082 66.069 1.00 0.00 H TER 51353 WAT 418 ATOM 51353 O WAT 419 8.999 135.777 127.334 1.00 0.00 O ATOM 51354 H1 WAT 419 9.339 135.622 128.215 1.00 0.00 H ATOM 51355 H2 WAT 419 8.415 135.037 127.168 1.00 0.00 H TER 51357 WAT 419 ATOM 51357 O WAT 420 100.879 40.669 79.861 1.00 0.00 O ATOM 51358 H1 WAT 420 100.848 40.352 80.764 1.00 0.00 H ATOM 51359 H2 WAT 420 100.672 39.901 79.330 1.00 0.00 H TER 51361 WAT 420 ATOM 51361 O WAT 421 65.488 92.538 131.777 1.00 0.00 O ATOM 51362 H1 WAT 421 65.809 92.217 130.934 1.00 0.00 H ATOM 51363 H2 WAT 421 65.704 91.841 132.396 1.00 0.00 H TER 51365 WAT 421 ATOM 51365 O WAT 422 40.417 79.336 103.584 1.00 0.00 O ATOM 51366 H1 WAT 422 41.099 78.942 104.128 1.00 0.00 H ATOM 51367 H2 WAT 422 40.048 80.032 104.128 1.00 0.00 H TER 51369 WAT 422 ATOM 51369 O WAT 423 61.573 98.303 100.757 1.00 0.00 O ATOM 51370 H1 WAT 423 61.434 98.759 101.588 1.00 0.00 H ATOM 51371 H2 WAT 423 62.316 98.756 100.358 1.00 0.00 H TER 51373 WAT 423 ATOM 51373 O WAT 424 81.218 84.060 8.930 1.00 0.00 O ATOM 51374 H1 WAT 424 81.040 84.352 8.036 1.00 0.00 H ATOM 51375 H2 WAT 424 81.875 83.371 8.830 1.00 0.00 H TER 51377 WAT 424 ATOM 51377 O WAT 425 112.203 14.358 133.767 1.00 0.00 O ATOM 51378 H1 WAT 425 112.737 14.852 134.389 1.00 0.00 H ATOM 51379 H2 WAT 425 111.651 13.801 134.316 1.00 0.00 H TER 51381 WAT 425 ATOM 51381 O WAT 426 30.499 138.804 130.863 1.00 0.00 O ATOM 51382 H1 WAT 426 30.938 138.387 131.604 1.00 0.00 H ATOM 51383 H2 WAT 426 29.580 138.554 130.958 1.00 0.00 H TER 51385 WAT 426 ATOM 51385 O WAT 427 69.021 124.576 96.400 1.00 0.00 O ATOM 51386 H1 WAT 427 69.780 124.206 95.950 1.00 0.00 H ATOM 51387 H2 WAT 427 69.272 125.480 96.589 1.00 0.00 H TER 51389 WAT 427 ATOM 51389 O WAT 428 141.573 51.565 72.691 1.00 0.00 O ATOM 51390 H1 WAT 428 142.417 51.271 73.036 1.00 0.00 H ATOM 51391 H2 WAT 428 141.545 51.218 71.800 1.00 0.00 H TER 51393 WAT 428 ATOM 51393 O WAT 429 14.070 53.514 137.705 1.00 0.00 O ATOM 51394 H1 WAT 429 13.175 53.440 137.374 1.00 0.00 H ATOM 51395 H2 WAT 429 14.046 54.266 138.296 1.00 0.00 H TER 51397 WAT 429 ATOM 51397 O WAT 430 109.540 139.306 118.499 1.00 0.00 O ATOM 51398 H1 WAT 430 109.767 138.380 118.574 1.00 0.00 H ATOM 51399 H2 WAT 430 108.882 139.336 117.804 1.00 0.00 H TER 51401 WAT 430 ATOM 51401 O WAT 431 0.495 88.916 120.402 1.00 0.00 O ATOM 51402 H1 WAT 431 -0.398 89.234 120.271 1.00 0.00 H ATOM 51403 H2 WAT 431 0.982 89.251 119.649 1.00 0.00 H TER 51405 WAT 431 ATOM 51405 O WAT 432 71.630 120.502 55.729 1.00 0.00 O ATOM 51406 H1 WAT 432 71.200 119.690 55.998 1.00 0.00 H ATOM 51407 H2 WAT 432 72.206 120.241 55.011 1.00 0.00 H TER 51409 WAT 432 ATOM 51409 O WAT 433 94.023 102.956 72.423 1.00 0.00 O ATOM 51410 H1 WAT 433 93.153 103.181 72.752 1.00 0.00 H ATOM 51411 H2 WAT 433 94.627 103.405 73.015 1.00 0.00 H TER 51413 WAT 433 ATOM 51413 O WAT 434 76.899 80.621 55.315 1.00 0.00 O ATOM 51414 H1 WAT 434 75.946 80.612 55.409 1.00 0.00 H ATOM 51415 H2 WAT 434 77.168 79.726 55.521 1.00 0.00 H TER 51417 WAT 434 ATOM 51417 O WAT 435 64.058 120.415 150.598 1.00 0.00 O ATOM 51418 H1 WAT 435 63.157 120.659 150.809 1.00 0.00 H ATOM 51419 H2 WAT 435 64.435 120.144 151.435 1.00 0.00 H TER 51421 WAT 435 ATOM 51421 O WAT 436 140.723 101.423 150.869 1.00 0.00 O ATOM 51422 H1 WAT 436 140.574 101.411 151.815 1.00 0.00 H ATOM 51423 H2 WAT 436 140.589 100.516 150.594 1.00 0.00 H TER 51425 WAT 436 ATOM 51425 O WAT 437 19.212 121.858 71.523 1.00 0.00 O ATOM 51426 H1 WAT 437 18.542 121.610 70.885 1.00 0.00 H ATOM 51427 H2 WAT 437 19.995 122.020 70.997 1.00 0.00 H TER 51429 WAT 437 ATOM 51429 O WAT 438 93.749 38.766 20.226 1.00 0.00 O ATOM 51430 H1 WAT 438 93.946 39.468 20.845 1.00 0.00 H ATOM 51431 H2 WAT 438 94.607 38.442 19.950 1.00 0.00 H TER 51433 WAT 438 ATOM 51433 O WAT 439 8.277 38.275 83.609 1.00 0.00 O ATOM 51434 H1 WAT 439 7.605 38.940 83.763 1.00 0.00 H ATOM 51435 H2 WAT 439 7.786 37.464 83.480 1.00 0.00 H TER 51437 WAT 439 ATOM 51437 O WAT 440 117.238 42.117 134.462 1.00 0.00 O ATOM 51438 H1 WAT 440 118.046 41.610 134.385 1.00 0.00 H ATOM 51439 H2 WAT 440 117.085 42.182 135.404 1.00 0.00 H TER 51441 WAT 440 ATOM 51441 O WAT 441 80.081 115.862 77.926 1.00 0.00 O ATOM 51442 H1 WAT 441 80.544 116.634 78.252 1.00 0.00 H ATOM 51443 H2 WAT 441 80.519 115.123 78.348 1.00 0.00 H TER 51445 WAT 441 ATOM 51445 O WAT 442 26.286 145.319 145.143 1.00 0.00 O ATOM 51446 H1 WAT 442 25.343 145.342 144.979 1.00 0.00 H ATOM 51447 H2 WAT 442 26.478 146.164 145.551 1.00 0.00 H TER 51449 WAT 442 ATOM 51449 O WAT 443 67.480 36.385 63.433 1.00 0.00 O ATOM 51450 H1 WAT 443 66.914 37.006 63.892 1.00 0.00 H ATOM 51451 H2 WAT 443 67.811 36.875 62.680 1.00 0.00 H TER 51453 WAT 443 ATOM 51453 O WAT 444 139.016 143.185 121.923 1.00 0.00 O ATOM 51454 H1 WAT 444 138.493 142.426 122.180 1.00 0.00 H ATOM 51455 H2 WAT 444 139.671 143.271 122.616 1.00 0.00 H TER 51457 WAT 444 ATOM 51457 O WAT 445 105.810 120.251 154.954 1.00 0.00 O ATOM 51458 H1 WAT 445 105.902 121.173 154.714 1.00 0.00 H ATOM 51459 H2 WAT 445 104.989 120.212 155.445 1.00 0.00 H TER 51461 WAT 445 ATOM 51461 O WAT 446 33.875 79.033 83.731 1.00 0.00 O ATOM 51462 H1 WAT 446 34.766 79.384 83.723 1.00 0.00 H ATOM 51463 H2 WAT 446 33.731 78.767 84.639 1.00 0.00 H TER 51465 WAT 446 ATOM 51465 O WAT 447 34.790 113.268 118.506 1.00 0.00 O ATOM 51466 H1 WAT 447 34.736 112.940 117.609 1.00 0.00 H ATOM 51467 H2 WAT 447 34.932 114.209 118.409 1.00 0.00 H TER 51469 WAT 447 ATOM 51469 O WAT 448 61.254 91.172 76.710 1.00 0.00 O ATOM 51470 H1 WAT 448 62.007 91.761 76.653 1.00 0.00 H ATOM 51471 H2 WAT 448 61.531 90.487 77.318 1.00 0.00 H TER 51473 WAT 448 ATOM 51473 O WAT 449 94.664 92.020 5.208 1.00 0.00 O ATOM 51474 H1 WAT 449 95.112 92.171 6.040 1.00 0.00 H ATOM 51475 H2 WAT 449 94.216 91.182 5.326 1.00 0.00 H TER 51477 WAT 449 ATOM 51477 O WAT 450 128.799 75.664 81.307 1.00 0.00 O ATOM 51478 H1 WAT 450 129.396 75.821 80.575 1.00 0.00 H ATOM 51479 H2 WAT 450 128.035 75.248 80.908 1.00 0.00 H TER 51481 WAT 450 ATOM 51481 O WAT 451 13.899 56.305 142.943 1.00 0.00 O ATOM 51482 H1 WAT 451 14.433 57.098 142.884 1.00 0.00 H ATOM 51483 H2 WAT 451 13.588 56.293 143.848 1.00 0.00 H TER 51485 WAT 451 ATOM 51485 O WAT 452 137.207 96.962 82.175 1.00 0.00 O ATOM 51486 H1 WAT 452 136.322 96.597 82.146 1.00 0.00 H ATOM 51487 H2 WAT 452 137.167 97.731 81.606 1.00 0.00 H TER 51489 WAT 452 ATOM 51489 O WAT 453 126.644 83.369 146.636 1.00 0.00 O ATOM 51490 H1 WAT 453 127.184 83.050 145.913 1.00 0.00 H ATOM 51491 H2 WAT 453 126.547 82.613 147.215 1.00 0.00 H TER 51493 WAT 453 ATOM 51493 O WAT 454 91.082 51.771 157.526 1.00 0.00 O ATOM 51494 H1 WAT 454 91.380 52.632 157.820 1.00 0.00 H ATOM 51495 H2 WAT 454 90.581 51.950 156.730 1.00 0.00 H TER 51497 WAT 454 ATOM 51497 O WAT 455 1.633 132.605 138.855 1.00 0.00 O ATOM 51498 H1 WAT 455 2.486 132.949 139.120 1.00 0.00 H ATOM 51499 H2 WAT 455 1.566 131.762 139.303 1.00 0.00 H TER 51501 WAT 455 ATOM 51501 O WAT 456 76.132 8.016 87.673 1.00 0.00 O ATOM 51502 H1 WAT 456 76.015 7.456 86.906 1.00 0.00 H ATOM 51503 H2 WAT 456 77.058 8.257 87.655 1.00 0.00 H TER 51505 WAT 456 ATOM 51505 O WAT 457 30.566 73.521 156.225 1.00 0.00 O ATOM 51506 H1 WAT 457 31.339 73.242 156.717 1.00 0.00 H ATOM 51507 H2 WAT 457 30.884 74.225 155.660 1.00 0.00 H TER 51509 WAT 457 ATOM 51509 O WAT 458 27.338 113.247 156.632 1.00 0.00 O ATOM 51510 H1 WAT 458 26.686 113.803 156.207 1.00 0.00 H ATOM 51511 H2 WAT 458 28.111 113.806 156.718 1.00 0.00 H TER 51513 WAT 458 ATOM 51513 O WAT 459 1.209 87.254 96.420 1.00 0.00 O ATOM 51514 H1 WAT 459 0.653 87.580 95.711 1.00 0.00 H ATOM 51515 H2 WAT 459 1.546 86.419 96.095 1.00 0.00 H TER 51517 WAT 459 ATOM 51517 O WAT 460 2.918 82.753 0.683 1.00 0.00 O ATOM 51518 H1 WAT 460 2.015 82.723 0.998 1.00 0.00 H ATOM 51519 H2 WAT 460 3.218 83.636 0.898 1.00 0.00 H TER 51521 WAT 460 ATOM 51521 O WAT 461 23.932 97.787 16.277 1.00 0.00 O ATOM 51522 H1 WAT 461 24.200 98.109 15.416 1.00 0.00 H ATOM 51523 H2 WAT 461 23.527 96.938 16.100 1.00 0.00 H TER 51525 WAT 461 ATOM 51525 O WAT 462 78.933 143.144 140.297 1.00 0.00 O ATOM 51526 H1 WAT 462 79.144 144.078 140.313 1.00 0.00 H ATOM 51527 H2 WAT 462 78.742 142.957 139.378 1.00 0.00 H TER 51529 WAT 462 ATOM 51529 O WAT 463 3.354 41.719 72.592 1.00 0.00 O ATOM 51530 H1 WAT 463 2.716 42.193 73.125 1.00 0.00 H ATOM 51531 H2 WAT 463 3.779 41.118 73.204 1.00 0.00 H TER 51533 WAT 463 ATOM 51533 O WAT 464 15.192 130.273 90.431 1.00 0.00 O ATOM 51534 H1 WAT 464 15.951 130.609 90.907 1.00 0.00 H ATOM 51535 H2 WAT 464 14.485 130.881 90.649 1.00 0.00 H TER 51537 WAT 464 ATOM 51537 O WAT 465 131.543 19.851 144.771 1.00 0.00 O ATOM 51538 H1 WAT 465 131.627 20.481 145.487 1.00 0.00 H ATOM 51539 H2 WAT 465 131.719 19.002 145.177 1.00 0.00 H TER 51541 WAT 465 ATOM 51541 O WAT 466 136.638 31.384 132.416 1.00 0.00 O ATOM 51542 H1 WAT 466 136.615 30.445 132.602 1.00 0.00 H ATOM 51543 H2 WAT 466 136.848 31.438 131.484 1.00 0.00 H TER 51545 WAT 466 ATOM 51545 O WAT 467 85.985 127.352 80.529 1.00 0.00 O ATOM 51546 H1 WAT 467 85.207 127.615 80.037 1.00 0.00 H ATOM 51547 H2 WAT 467 86.420 128.176 80.747 1.00 0.00 H TER 51549 WAT 467 ATOM 51549 O WAT 468 86.376 14.252 63.350 1.00 0.00 O ATOM 51550 H1 WAT 468 86.122 14.535 62.471 1.00 0.00 H ATOM 51551 H2 WAT 468 87.092 14.840 63.592 1.00 0.00 H TER 51553 WAT 468 ATOM 51553 O WAT 469 17.437 38.485 137.518 1.00 0.00 O ATOM 51554 H1 WAT 469 16.583 38.058 137.585 1.00 0.00 H ATOM 51555 H2 WAT 469 17.741 38.276 136.634 1.00 0.00 H TER 51557 WAT 469 ATOM 51557 O WAT 470 120.003 19.803 157.452 1.00 0.00 O ATOM 51558 H1 WAT 470 119.208 19.344 157.180 1.00 0.00 H ATOM 51559 H2 WAT 470 120.008 19.728 158.407 1.00 0.00 H TER 51561 WAT 470 ATOM 51561 O WAT 471 82.819 62.737 19.466 1.00 0.00 O ATOM 51562 H1 WAT 471 83.774 62.793 19.424 1.00 0.00 H ATOM 51563 H2 WAT 471 82.638 62.396 20.342 1.00 0.00 H TER 51565 WAT 471 ATOM 51565 O WAT 472 0.819 69.347 9.206 1.00 0.00 O ATOM 51566 H1 WAT 472 0.697 68.446 8.905 1.00 0.00 H ATOM 51567 H2 WAT 472 1.637 69.627 8.795 1.00 0.00 H TER 51569 WAT 472 ATOM 51569 O WAT 473 113.358 44.281 116.957 1.00 0.00 O ATOM 51570 H1 WAT 473 113.878 44.983 117.349 1.00 0.00 H ATOM 51571 H2 WAT 473 112.647 44.735 116.505 1.00 0.00 H TER 51573 WAT 473 ATOM 51573 O WAT 474 24.257 77.229 137.679 1.00 0.00 O ATOM 51574 H1 WAT 474 25.018 77.549 137.194 1.00 0.00 H ATOM 51575 H2 WAT 474 24.473 76.322 137.895 1.00 0.00 H TER 51577 WAT 474 ATOM 51577 O WAT 475 27.772 0.351 71.869 1.00 0.00 O ATOM 51578 H1 WAT 475 27.213 -0.188 71.309 1.00 0.00 H ATOM 51579 H2 WAT 475 28.664 0.128 71.603 1.00 0.00 H TER 51581 WAT 475 ATOM 51581 O WAT 476 135.483 141.816 60.322 1.00 0.00 O ATOM 51582 H1 WAT 476 135.275 140.889 60.437 1.00 0.00 H ATOM 51583 H2 WAT 476 134.667 142.206 60.009 1.00 0.00 H TER 51585 WAT 476 ATOM 51585 O WAT 477 121.719 109.415 154.181 1.00 0.00 O ATOM 51586 H1 WAT 477 120.944 109.571 154.720 1.00 0.00 H ATOM 51587 H2 WAT 477 122.218 108.756 154.665 1.00 0.00 H TER 51589 WAT 477 ATOM 51589 O WAT 478 50.591 78.948 144.189 1.00 0.00 O ATOM 51590 H1 WAT 478 50.443 79.455 143.391 1.00 0.00 H ATOM 51591 H2 WAT 478 50.427 79.568 144.900 1.00 0.00 H TER 51593 WAT 478 ATOM 51593 O WAT 479 28.339 128.994 71.791 1.00 0.00 O ATOM 51594 H1 WAT 479 27.580 129.203 72.335 1.00 0.00 H ATOM 51595 H2 WAT 479 28.865 128.404 72.331 1.00 0.00 H TER 51597 WAT 479 ATOM 51597 O WAT 480 71.303 17.048 152.592 1.00 0.00 O ATOM 51598 H1 WAT 480 70.966 17.598 151.885 1.00 0.00 H ATOM 51599 H2 WAT 480 71.947 16.480 152.169 1.00 0.00 H TER 51601 WAT 480 ATOM 51601 O WAT 481 57.811 71.642 103.917 1.00 0.00 O ATOM 51602 H1 WAT 481 58.150 71.129 103.184 1.00 0.00 H ATOM 51603 H2 WAT 481 57.447 70.991 104.517 1.00 0.00 H TER 51605 WAT 481 ATOM 51605 O WAT 482 128.274 47.046 157.546 1.00 0.00 O ATOM 51606 H1 WAT 482 127.676 47.527 156.973 1.00 0.00 H ATOM 51607 H2 WAT 482 128.118 46.126 157.337 1.00 0.00 H TER 51609 WAT 482 ATOM 51609 O WAT 483 37.129 115.351 18.334 1.00 0.00 O ATOM 51610 H1 WAT 483 36.540 114.614 18.170 1.00 0.00 H ATOM 51611 H2 WAT 483 37.026 115.915 17.568 1.00 0.00 H TER 51613 WAT 483 ATOM 51613 O WAT 484 141.123 86.391 96.636 1.00 0.00 O ATOM 51614 H1 WAT 484 140.285 86.554 96.203 1.00 0.00 H ATOM 51615 H2 WAT 484 141.076 86.896 97.448 1.00 0.00 H TER 51617 WAT 484 ATOM 51617 O WAT 485 33.879 34.997 107.298 1.00 0.00 O ATOM 51618 H1 WAT 485 34.427 35.780 107.246 1.00 0.00 H ATOM 51619 H2 WAT 485 33.750 34.735 106.387 1.00 0.00 H TER 51621 WAT 485 ATOM 51621 O WAT 486 59.761 124.938 75.187 1.00 0.00 O ATOM 51622 H1 WAT 486 59.355 124.144 74.840 1.00 0.00 H ATOM 51623 H2 WAT 486 60.114 124.674 76.037 1.00 0.00 H TER 51625 WAT 486 ATOM 51625 O WAT 487 64.518 76.525 127.171 1.00 0.00 O ATOM 51626 H1 WAT 487 65.325 76.806 127.601 1.00 0.00 H ATOM 51627 H2 WAT 487 64.032 76.060 127.852 1.00 0.00 H TER 51629 WAT 487 ATOM 51629 O WAT 488 59.992 60.157 10.284 1.00 0.00 O ATOM 51630 H1 WAT 488 59.806 59.233 10.445 1.00 0.00 H ATOM 51631 H2 WAT 488 59.210 60.486 9.840 1.00 0.00 H TER 51633 WAT 488 ATOM 51633 O WAT 489 16.351 22.773 67.393 1.00 0.00 O ATOM 51634 H1 WAT 489 15.948 23.466 66.870 1.00 0.00 H ATOM 51635 H2 WAT 489 16.917 22.307 66.778 1.00 0.00 H TER 51637 WAT 489 ATOM 51637 O WAT 490 22.422 1.550 114.895 1.00 0.00 O ATOM 51638 H1 WAT 490 22.640 0.656 114.631 1.00 0.00 H ATOM 51639 H2 WAT 490 22.546 1.557 115.844 1.00 0.00 H TER 51641 WAT 490 ATOM 51641 O WAT 491 116.297 91.200 125.172 1.00 0.00 O ATOM 51642 H1 WAT 491 116.508 90.323 124.853 1.00 0.00 H ATOM 51643 H2 WAT 491 116.212 91.097 126.120 1.00 0.00 H TER 51645 WAT 491 ATOM 51645 O WAT 492 136.637 94.729 58.220 1.00 0.00 O ATOM 51646 H1 WAT 492 136.103 95.242 58.828 1.00 0.00 H ATOM 51647 H2 WAT 492 136.199 93.879 58.176 1.00 0.00 H TER 51649 WAT 492 ATOM 51649 O WAT 493 6.790 98.376 94.345 1.00 0.00 O ATOM 51650 H1 WAT 493 6.888 98.378 93.393 1.00 0.00 H ATOM 51651 H2 WAT 493 7.019 97.484 94.608 1.00 0.00 H TER 51653 WAT 493 ATOM 51653 O WAT 494 52.402 111.965 93.438 1.00 0.00 O ATOM 51654 H1 WAT 494 51.509 111.620 93.434 1.00 0.00 H ATOM 51655 H2 WAT 494 52.308 112.876 93.159 1.00 0.00 H TER 51657 WAT 494 ATOM 51657 O WAT 495 68.906 38.910 110.579 1.00 0.00 O ATOM 51658 H1 WAT 495 69.250 38.441 109.819 1.00 0.00 H ATOM 51659 H2 WAT 495 68.855 39.823 110.295 1.00 0.00 H TER 51661 WAT 495 ATOM 51661 O WAT 496 99.261 141.545 83.844 1.00 0.00 O ATOM 51662 H1 WAT 496 98.618 141.717 84.532 1.00 0.00 H ATOM 51663 H2 WAT 496 98.790 141.010 83.205 1.00 0.00 H TER 51665 WAT 496 ATOM 51665 O WAT 497 101.102 37.970 115.919 1.00 0.00 O ATOM 51666 H1 WAT 497 101.982 38.294 116.112 1.00 0.00 H ATOM 51667 H2 WAT 497 101.175 37.587 115.045 1.00 0.00 H TER 51669 WAT 497 ATOM 51669 O WAT 498 1.522 36.435 64.015 1.00 0.00 O ATOM 51670 H1 WAT 498 1.573 37.338 63.703 1.00 0.00 H ATOM 51671 H2 WAT 498 2.408 36.091 63.900 1.00 0.00 H TER 51673 WAT 498 ATOM 51673 O WAT 499 24.469 104.985 23.807 1.00 0.00 O ATOM 51674 H1 WAT 499 24.433 104.493 24.627 1.00 0.00 H ATOM 51675 H2 WAT 499 24.054 104.410 23.164 1.00 0.00 H TER 51677 WAT 499 ATOM 51677 O WAT 500 0.882 72.986 156.292 1.00 0.00 O ATOM 51678 H1 WAT 500 0.317 72.528 155.669 1.00 0.00 H ATOM 51679 H2 WAT 500 0.348 73.714 156.609 1.00 0.00 H TER 51681 WAT 500 ATOM 51681 O WAT 501 64.160 85.106 151.361 1.00 0.00 O ATOM 51682 H1 WAT 501 64.062 85.407 152.264 1.00 0.00 H ATOM 51683 H2 WAT 501 63.493 85.589 150.873 1.00 0.00 H TER 51685 WAT 501 ATOM 51685 O WAT 502 26.785 1.027 64.362 1.00 0.00 O ATOM 51686 H1 WAT 502 25.930 1.036 63.931 1.00 0.00 H ATOM 51687 H2 WAT 502 26.581 1.020 65.297 1.00 0.00 H TER 51689 WAT 502 ATOM 51689 O WAT 503 73.694 82.643 95.349 1.00 0.00 O ATOM 51690 H1 WAT 503 74.312 83.107 94.784 1.00 0.00 H ATOM 51691 H2 WAT 503 73.854 81.716 95.168 1.00 0.00 H TER 51693 WAT 503 ATOM 51693 O WAT 504 12.148 105.221 139.812 1.00 0.00 O ATOM 51694 H1 WAT 504 12.044 104.985 140.733 1.00 0.00 H ATOM 51695 H2 WAT 504 12.057 104.393 139.341 1.00 0.00 H TER 51697 WAT 504 ATOM 51697 O WAT 505 20.367 4.786 112.807 1.00 0.00 O ATOM 51698 H1 WAT 505 20.093 4.372 111.989 1.00 0.00 H ATOM 51699 H2 WAT 505 20.230 5.722 112.660 1.00 0.00 H TER 51701 WAT 505 ATOM 51701 O WAT 506 65.090 13.808 93.797 1.00 0.00 O ATOM 51702 H1 WAT 506 65.865 13.361 94.137 1.00 0.00 H ATOM 51703 H2 WAT 506 64.685 14.205 94.568 1.00 0.00 H TER 51705 WAT 506 ATOM 51705 O WAT 507 80.386 21.717 94.334 1.00 0.00 O ATOM 51706 H1 WAT 507 81.004 21.543 95.044 1.00 0.00 H ATOM 51707 H2 WAT 507 80.268 22.667 94.346 1.00 0.00 H TER 51709 WAT 507 ATOM 51709 O WAT 508 120.179 34.342 69.229 1.00 0.00 O ATOM 51710 H1 WAT 508 120.542 35.195 68.993 1.00 0.00 H ATOM 51711 H2 WAT 508 119.699 34.503 70.042 1.00 0.00 H TER 51713 WAT 508 ATOM 51713 O WAT 509 114.349 22.754 135.700 1.00 0.00 O ATOM 51714 H1 WAT 509 113.635 22.687 136.334 1.00 0.00 H ATOM 51715 H2 WAT 509 113.921 22.670 134.848 1.00 0.00 H TER 51717 WAT 509 ATOM 51717 O WAT 510 145.129 72.883 59.344 1.00 0.00 O ATOM 51718 H1 WAT 510 145.908 72.924 58.790 1.00 0.00 H ATOM 51719 H2 WAT 510 144.416 73.174 58.776 1.00 0.00 H TER 51721 WAT 510 ATOM 51721 O WAT 511 69.660 50.566 81.311 1.00 0.00 O ATOM 51722 H1 WAT 511 70.375 51.066 80.916 1.00 0.00 H ATOM 51723 H2 WAT 511 69.876 49.652 81.125 1.00 0.00 H TER 51725 WAT 511 ATOM 51725 O WAT 512 122.734 57.729 130.157 1.00 0.00 O ATOM 51726 H1 WAT 512 122.344 58.096 129.364 1.00 0.00 H ATOM 51727 H2 WAT 512 123.593 58.148 130.218 1.00 0.00 H TER 51729 WAT 512 ATOM 51729 O WAT 513 78.654 127.302 110.849 1.00 0.00 O ATOM 51730 H1 WAT 513 78.700 126.527 110.289 1.00 0.00 H ATOM 51731 H2 WAT 513 79.337 127.165 111.505 1.00 0.00 H TER 51733 WAT 513 ATOM 51733 O WAT 514 6.472 9.263 78.371 1.00 0.00 O ATOM 51734 H1 WAT 514 6.491 10.207 78.212 1.00 0.00 H ATOM 51735 H2 WAT 514 6.429 8.874 77.497 1.00 0.00 H TER 51737 WAT 514 ATOM 51737 O WAT 515 25.840 24.632 132.296 1.00 0.00 O ATOM 51738 H1 WAT 515 25.577 23.721 132.430 1.00 0.00 H ATOM 51739 H2 WAT 515 26.660 24.718 132.783 1.00 0.00 H TER 51741 WAT 515 ATOM 51741 O WAT 516 136.184 6.113 24.264 1.00 0.00 O ATOM 51742 H1 WAT 516 136.259 5.206 23.968 1.00 0.00 H ATOM 51743 H2 WAT 516 137.068 6.469 24.171 1.00 0.00 H TER 51745 WAT 516 ATOM 51745 O WAT 517 39.639 130.368 155.601 1.00 0.00 O ATOM 51746 H1 WAT 517 39.378 129.698 154.969 1.00 0.00 H ATOM 51747 H2 WAT 517 40.532 130.601 155.349 1.00 0.00 H TER 51749 WAT 517 ATOM 51749 O WAT 518 50.281 56.258 16.204 1.00 0.00 O ATOM 51750 H1 WAT 518 50.236 56.509 17.127 1.00 0.00 H ATOM 51751 H2 WAT 518 50.785 56.958 15.790 1.00 0.00 H TER 51753 WAT 518 ATOM 51753 O WAT 519 41.012 67.566 9.539 1.00 0.00 O ATOM 51754 H1 WAT 519 41.327 67.152 8.736 1.00 0.00 H ATOM 51755 H2 WAT 519 41.501 67.133 10.239 1.00 0.00 H TER 51757 WAT 519 ATOM 51757 O WAT 520 46.116 86.055 90.648 1.00 0.00 O ATOM 51758 H1 WAT 520 46.553 85.797 89.836 1.00 0.00 H ATOM 51759 H2 WAT 520 46.474 86.919 90.848 1.00 0.00 H TER 51761 WAT 520 ATOM 51761 O WAT 521 107.176 108.705 130.126 1.00 0.00 O ATOM 51762 H1 WAT 521 106.229 108.645 130.253 1.00 0.00 H ATOM 51763 H2 WAT 521 107.538 108.691 131.012 1.00 0.00 H TER 51765 WAT 521 ATOM 51765 O WAT 522 58.533 53.344 152.189 1.00 0.00 O ATOM 51766 H1 WAT 522 58.711 54.151 152.673 1.00 0.00 H ATOM 51767 H2 WAT 522 58.593 52.652 152.848 1.00 0.00 H TER 51769 WAT 522 ATOM 51769 O WAT 523 45.513 72.987 138.346 1.00 0.00 O ATOM 51770 H1 WAT 523 45.111 73.854 138.293 1.00 0.00 H ATOM 51771 H2 WAT 523 45.882 72.948 139.228 1.00 0.00 H TER 51773 WAT 523 ATOM 51773 O WAT 524 73.033 47.997 149.517 1.00 0.00 O ATOM 51774 H1 WAT 524 73.551 47.197 149.598 1.00 0.00 H ATOM 51775 H2 WAT 524 73.563 48.571 148.965 1.00 0.00 H TER 51777 WAT 524 ATOM 51777 O WAT 525 41.373 136.488 4.889 1.00 0.00 O ATOM 51778 H1 WAT 525 41.704 135.717 5.350 1.00 0.00 H ATOM 51779 H2 WAT 525 42.054 137.150 5.010 1.00 0.00 H TER 51781 WAT 525 ATOM 51781 O WAT 526 123.717 63.131 10.334 1.00 0.00 O ATOM 51782 H1 WAT 526 123.814 63.559 9.483 1.00 0.00 H ATOM 51783 H2 WAT 526 124.358 62.421 10.319 1.00 0.00 H TER 51785 WAT 526 ATOM 51785 O WAT 527 96.037 51.067 124.710 1.00 0.00 O ATOM 51786 H1 WAT 527 95.313 51.528 124.286 1.00 0.00 H ATOM 51787 H2 WAT 527 96.606 51.765 125.036 1.00 0.00 H TER 51789 WAT 527 ATOM 51789 O WAT 528 145.123 22.426 6.913 1.00 0.00 O ATOM 51790 H1 WAT 528 144.618 21.617 6.992 1.00 0.00 H ATOM 51791 H2 WAT 528 145.756 22.246 6.218 1.00 0.00 H TER 51793 WAT 528 ATOM 51793 O WAT 529 95.191 35.145 68.511 1.00 0.00 O ATOM 51794 H1 WAT 529 95.021 35.096 69.452 1.00 0.00 H ATOM 51795 H2 WAT 529 94.819 35.985 68.244 1.00 0.00 H TER 51797 WAT 529 ATOM 51797 O WAT 530 57.742 40.623 146.660 1.00 0.00 O ATOM 51798 H1 WAT 530 58.361 41.013 146.043 1.00 0.00 H ATOM 51799 H2 WAT 530 56.961 40.447 146.135 1.00 0.00 H TER 51801 WAT 530 ATOM 51801 O WAT 531 88.037 38.844 4.730 1.00 0.00 O ATOM 51802 H1 WAT 531 87.797 39.409 5.464 1.00 0.00 H ATOM 51803 H2 WAT 531 87.484 39.144 4.007 1.00 0.00 H TER 51805 WAT 531 ATOM 51805 O WAT 532 35.862 40.978 99.044 1.00 0.00 O ATOM 51806 H1 WAT 532 35.854 40.792 98.105 1.00 0.00 H ATOM 51807 H2 WAT 532 34.967 41.256 99.241 1.00 0.00 H TER 51809 WAT 532 ATOM 51809 O WAT 533 9.492 85.492 132.183 1.00 0.00 O ATOM 51810 H1 WAT 533 9.773 84.731 132.691 1.00 0.00 H ATOM 51811 H2 WAT 533 9.665 86.239 132.757 1.00 0.00 H TER 51813 WAT 533 ATOM 51813 O WAT 534 9.767 39.580 130.595 1.00 0.00 O ATOM 51814 H1 WAT 534 9.296 39.236 129.836 1.00 0.00 H ATOM 51815 H2 WAT 534 9.275 40.360 130.850 1.00 0.00 H TER 51817 WAT 534 ATOM 51817 O WAT 535 133.552 73.879 133.579 1.00 0.00 O ATOM 51818 H1 WAT 535 134.319 74.004 134.137 1.00 0.00 H ATOM 51819 H2 WAT 535 133.870 74.050 132.692 1.00 0.00 H TER 51821 WAT 535 ATOM 51821 O WAT 536 128.068 0.946 71.922 1.00 0.00 O ATOM 51822 H1 WAT 536 129.019 1.051 71.891 1.00 0.00 H ATOM 51823 H2 WAT 536 127.930 0.166 72.460 1.00 0.00 H TER 51825 WAT 536 ATOM 51825 O WAT 537 21.024 93.399 60.000 1.00 0.00 O ATOM 51826 H1 WAT 537 20.252 92.837 59.924 1.00 0.00 H ATOM 51827 H2 WAT 537 21.360 93.466 59.106 1.00 0.00 H TER 51829 WAT 537 ATOM 51829 O WAT 538 21.882 28.791 122.391 1.00 0.00 O ATOM 51830 H1 WAT 538 22.735 29.105 122.091 1.00 0.00 H ATOM 51831 H2 WAT 538 21.261 29.449 122.077 1.00 0.00 H TER 51833 WAT 538 ATOM 51833 O WAT 539 9.567 120.625 15.343 1.00 0.00 O ATOM 51834 H1 WAT 539 8.824 120.040 15.193 1.00 0.00 H ATOM 51835 H2 WAT 539 10.330 120.048 15.342 1.00 0.00 H TER 51837 WAT 539 ATOM 51837 O WAT 540 18.498 94.566 153.330 1.00 0.00 O ATOM 51838 H1 WAT 540 19.347 94.548 153.772 1.00 0.00 H ATOM 51839 H2 WAT 540 18.259 93.644 153.235 1.00 0.00 H TER 51841 WAT 540 ATOM 51841 O WAT 541 73.119 141.972 90.968 1.00 0.00 O ATOM 51842 H1 WAT 541 73.798 141.313 91.116 1.00 0.00 H ATOM 51843 H2 WAT 541 73.259 142.263 90.067 1.00 0.00 H TER 51845 WAT 541 ATOM 51845 O WAT 542 55.977 35.460 7.259 1.00 0.00 O ATOM 51846 H1 WAT 542 55.887 35.847 8.130 1.00 0.00 H ATOM 51847 H2 WAT 542 55.893 34.518 7.405 1.00 0.00 H TER 51849 WAT 542 ATOM 51849 O WAT 543 135.782 33.490 153.094 1.00 0.00 O ATOM 51850 H1 WAT 543 134.897 33.189 153.300 1.00 0.00 H ATOM 51851 H2 WAT 543 135.859 34.332 153.542 1.00 0.00 H TER 51853 WAT 543 ATOM 51853 O WAT 544 4.198 30.891 118.700 1.00 0.00 O ATOM 51854 H1 WAT 544 3.435 31.458 118.585 1.00 0.00 H ATOM 51855 H2 WAT 544 3.828 30.022 118.857 1.00 0.00 H TER 51857 WAT 544 ATOM 51857 O WAT 545 122.097 24.542 77.219 1.00 0.00 O ATOM 51858 H1 WAT 545 121.547 24.721 77.981 1.00 0.00 H ATOM 51859 H2 WAT 545 122.282 23.604 77.273 1.00 0.00 H TER 51861 WAT 545 ATOM 51861 O WAT 546 10.559 9.918 69.582 1.00 0.00 O ATOM 51862 H1 WAT 546 11.392 9.686 69.172 1.00 0.00 H ATOM 51863 H2 WAT 546 10.181 10.578 69.001 1.00 0.00 H TER 51865 WAT 546 ATOM 51865 O WAT 547 68.631 20.693 103.486 1.00 0.00 O ATOM 51866 H1 WAT 547 69.025 21.555 103.625 1.00 0.00 H ATOM 51867 H2 WAT 547 68.209 20.485 104.320 1.00 0.00 H TER 51869 WAT 547 ATOM 51869 O WAT 548 39.367 121.388 133.214 1.00 0.00 O ATOM 51870 H1 WAT 548 39.235 120.606 132.679 1.00 0.00 H ATOM 51871 H2 WAT 548 38.520 121.538 133.633 1.00 0.00 H TER 51873 WAT 548 ATOM 51873 O WAT 549 9.327 56.298 101.387 1.00 0.00 O ATOM 51874 H1 WAT 549 9.504 55.962 102.266 1.00 0.00 H ATOM 51875 H2 WAT 549 9.483 57.240 101.455 1.00 0.00 H TER 51877 WAT 549 ATOM 51877 O WAT 550 112.528 35.420 122.615 1.00 0.00 O ATOM 51878 H1 WAT 550 112.771 35.131 123.495 1.00 0.00 H ATOM 51879 H2 WAT 550 111.654 35.795 122.719 1.00 0.00 H TER 51881 WAT 550 ATOM 51881 O WAT 551 76.074 46.628 82.068 1.00 0.00 O ATOM 51882 H1 WAT 551 76.722 47.168 82.521 1.00 0.00 H ATOM 51883 H2 WAT 551 75.745 47.189 81.365 1.00 0.00 H TER 51885 WAT 551 ATOM 51885 O WAT 552 59.035 105.468 152.075 1.00 0.00 O ATOM 51886 H1 WAT 552 59.569 104.980 152.702 1.00 0.00 H ATOM 51887 H2 WAT 552 59.174 105.019 151.242 1.00 0.00 H TER 51889 WAT 552 ATOM 51889 O WAT 553 40.735 55.561 145.164 1.00 0.00 O ATOM 51890 H1 WAT 553 41.637 55.874 145.220 1.00 0.00 H ATOM 51891 H2 WAT 553 40.569 55.154 146.015 1.00 0.00 H TER 51893 WAT 553 ATOM 51893 O WAT 554 40.034 85.412 89.510 1.00 0.00 O ATOM 51894 H1 WAT 554 40.574 85.686 88.768 1.00 0.00 H ATOM 51895 H2 WAT 554 39.460 84.735 89.151 1.00 0.00 H TER 51897 WAT 554 ATOM 51897 O WAT 555 40.218 18.503 152.572 1.00 0.00 O ATOM 51898 H1 WAT 555 40.563 18.015 151.823 1.00 0.00 H ATOM 51899 H2 WAT 555 40.433 17.960 153.330 1.00 0.00 H TER 51901 WAT 555 ATOM 51901 O WAT 556 56.406 126.190 134.619 1.00 0.00 O ATOM 51902 H1 WAT 556 56.448 125.234 134.579 1.00 0.00 H ATOM 51903 H2 WAT 556 57.056 126.484 133.981 1.00 0.00 H TER 51905 WAT 556 ATOM 51905 O WAT 557 51.819 73.211 59.139 1.00 0.00 O ATOM 51906 H1 WAT 557 51.089 73.483 59.695 1.00 0.00 H ATOM 51907 H2 WAT 557 52.215 72.475 59.605 1.00 0.00 H TER 51909 WAT 557 ATOM 51909 O WAT 558 91.573 10.857 135.229 1.00 0.00 O ATOM 51910 H1 WAT 558 90.947 10.421 135.808 1.00 0.00 H ATOM 51911 H2 WAT 558 91.583 11.766 135.529 1.00 0.00 H TER 51913 WAT 558 ATOM 51913 O WAT 559 45.531 64.935 24.248 1.00 0.00 O ATOM 51914 H1 WAT 559 45.626 65.708 23.691 1.00 0.00 H ATOM 51915 H2 WAT 559 46.363 64.471 24.158 1.00 0.00 H TER 51917 WAT 559 ATOM 51917 O WAT 560 74.570 25.032 116.597 1.00 0.00 O ATOM 51918 H1 WAT 560 74.574 25.687 117.295 1.00 0.00 H ATOM 51919 H2 WAT 560 74.071 24.300 116.959 1.00 0.00 H TER 51921 WAT 560 ATOM 51921 O WAT 561 48.710 107.735 57.933 1.00 0.00 O ATOM 51922 H1 WAT 561 49.604 107.570 58.231 1.00 0.00 H ATOM 51923 H2 WAT 561 48.354 108.351 58.573 1.00 0.00 H TER 51925 WAT 561 ATOM 51925 O WAT 562 66.561 143.147 153.849 1.00 0.00 O ATOM 51926 H1 WAT 562 67.374 143.507 154.203 1.00 0.00 H ATOM 51927 H2 WAT 562 65.962 143.128 154.595 1.00 0.00 H TER 51929 WAT 562 ATOM 51929 O WAT 563 136.706 36.638 7.007 1.00 0.00 O ATOM 51930 H1 WAT 563 136.282 36.436 7.841 1.00 0.00 H ATOM 51931 H2 WAT 563 136.059 36.396 6.344 1.00 0.00 H TER 51933 WAT 563 ATOM 51933 O WAT 564 2.715 137.019 107.900 1.00 0.00 O ATOM 51934 H1 WAT 564 3.328 137.391 107.266 1.00 0.00 H ATOM 51935 H2 WAT 564 3.179 136.266 108.267 1.00 0.00 H TER 51937 WAT 564 ATOM 51937 O WAT 565 53.627 101.794 64.007 1.00 0.00 O ATOM 51938 H1 WAT 565 53.894 102.548 64.533 1.00 0.00 H ATOM 51939 H2 WAT 565 54.386 101.608 63.453 1.00 0.00 H TER 51941 WAT 565 ATOM 51941 O WAT 566 93.427 140.346 62.904 1.00 0.00 O ATOM 51942 H1 WAT 566 92.581 140.784 63.002 1.00 0.00 H ATOM 51943 H2 WAT 566 93.988 140.759 63.561 1.00 0.00 H TER 51945 WAT 566 ATOM 51945 O WAT 567 121.713 58.467 70.906 1.00 0.00 O ATOM 51946 H1 WAT 567 122.383 58.974 70.449 1.00 0.00 H ATOM 51947 H2 WAT 567 122.153 57.653 71.151 1.00 0.00 H TER 51949 WAT 567 ATOM 51949 O WAT 568 37.966 17.221 61.031 1.00 0.00 O ATOM 51950 H1 WAT 568 38.285 16.695 60.298 1.00 0.00 H ATOM 51951 H2 WAT 568 37.425 17.897 60.622 1.00 0.00 H TER 51953 WAT 568 ATOM 51953 O WAT 569 84.264 48.410 112.832 1.00 0.00 O ATOM 51954 H1 WAT 569 83.664 48.986 112.358 1.00 0.00 H ATOM 51955 H2 WAT 569 83.902 47.533 112.707 1.00 0.00 H TER 51957 WAT 569 ATOM 51957 O WAT 570 93.359 84.532 132.388 1.00 0.00 O ATOM 51958 H1 WAT 570 93.542 85.471 132.362 1.00 0.00 H ATOM 51959 H2 WAT 570 94.110 84.130 131.951 1.00 0.00 H TER 51961 WAT 570 ATOM 51961 O WAT 571 139.034 54.206 141.269 1.00 0.00 O ATOM 51962 H1 WAT 571 138.384 54.445 141.930 1.00 0.00 H ATOM 51963 H2 WAT 571 138.665 53.434 140.840 1.00 0.00 H TER 51965 WAT 571 ATOM 51965 O WAT 572 81.537 111.020 102.833 1.00 0.00 O ATOM 51966 H1 WAT 572 81.567 111.727 103.478 1.00 0.00 H ATOM 51967 H2 WAT 572 80.649 110.670 102.903 1.00 0.00 H TER 51969 WAT 572 ATOM 51969 O WAT 573 112.272 27.277 154.065 1.00 0.00 O ATOM 51970 H1 WAT 573 111.612 27.910 153.780 1.00 0.00 H ATOM 51971 H2 WAT 573 111.791 26.665 154.623 1.00 0.00 H TER 51973 WAT 573 ATOM 51973 O WAT 574 122.296 90.234 7.743 1.00 0.00 O ATOM 51974 H1 WAT 574 122.056 89.529 8.344 1.00 0.00 H ATOM 51975 H2 WAT 574 122.333 89.814 6.884 1.00 0.00 H TER 51977 WAT 574 ATOM 51977 O WAT 575 25.168 32.543 4.862 1.00 0.00 O ATOM 51978 H1 WAT 575 25.088 33.408 4.459 1.00 0.00 H ATOM 51979 H2 WAT 575 24.832 31.938 4.201 1.00 0.00 H TER 51981 WAT 575 ATOM 51981 O WAT 576 37.111 109.196 97.235 1.00 0.00 O ATOM 51982 H1 WAT 576 37.023 109.978 96.690 1.00 0.00 H ATOM 51983 H2 WAT 576 37.749 109.442 97.905 1.00 0.00 H TER 51985 WAT 576 ATOM 51985 O WAT 577 5.753 23.782 123.846 1.00 0.00 O ATOM 51986 H1 WAT 577 5.989 24.210 123.023 1.00 0.00 H ATOM 51987 H2 WAT 577 4.855 24.067 124.016 1.00 0.00 H TER 51989 WAT 577 ATOM 51989 O WAT 578 89.326 5.152 71.584 1.00 0.00 O ATOM 51990 H1 WAT 578 90.253 5.176 71.345 1.00 0.00 H ATOM 51991 H2 WAT 578 89.154 6.014 71.962 1.00 0.00 H TER 51993 WAT 578 ATOM 51993 O WAT 579 13.492 40.024 137.512 1.00 0.00 O ATOM 51994 H1 WAT 579 14.374 40.230 137.821 1.00 0.00 H ATOM 51995 H2 WAT 579 13.607 39.257 136.951 1.00 0.00 H TER 51997 WAT 579 ATOM 51997 O WAT 580 95.594 97.208 4.937 1.00 0.00 O ATOM 51998 H1 WAT 580 95.168 96.441 5.320 1.00 0.00 H ATOM 51999 H2 WAT 580 95.697 97.815 5.669 1.00 0.00 H TER 52001 WAT 580 ATOM 52001 O WAT 581 86.453 47.032 16.610 1.00 0.00 O ATOM 52002 H1 WAT 581 86.712 46.594 17.421 1.00 0.00 H ATOM 52003 H2 WAT 581 86.298 47.941 16.867 1.00 0.00 H TER 52005 WAT 581 ATOM 52005 O WAT 582 124.417 79.913 5.904 1.00 0.00 O ATOM 52006 H1 WAT 582 124.466 78.957 5.942 1.00 0.00 H ATOM 52007 H2 WAT 582 124.152 80.103 5.004 1.00 0.00 H TER 52009 WAT 582 ATOM 52009 O WAT 583 129.944 97.775 100.423 1.00 0.00 O ATOM 52010 H1 WAT 583 130.518 97.800 101.189 1.00 0.00 H ATOM 52011 H2 WAT 583 129.771 96.844 100.284 1.00 0.00 H TER 52013 WAT 583 ATOM 52013 O WAT 584 99.488 121.414 16.164 1.00 0.00 O ATOM 52014 H1 WAT 584 98.841 120.792 16.498 1.00 0.00 H ATOM 52015 H2 WAT 584 99.070 121.808 15.399 1.00 0.00 H TER 52017 WAT 584 ATOM 52017 O WAT 585 13.702 79.302 2.810 1.00 0.00 O ATOM 52018 H1 WAT 585 14.549 79.560 2.445 1.00 0.00 H ATOM 52019 H2 WAT 585 13.073 79.896 2.399 1.00 0.00 H TER 52021 WAT 585 ATOM 52021 O WAT 586 41.728 60.726 88.198 1.00 0.00 O ATOM 52022 H1 WAT 586 41.694 60.275 87.355 1.00 0.00 H ATOM 52023 H2 WAT 586 41.895 60.031 88.835 1.00 0.00 H TER 52025 WAT 586 ATOM 52025 O WAT 587 61.084 81.952 154.929 1.00 0.00 O ATOM 52026 H1 WAT 587 60.302 81.969 155.481 1.00 0.00 H ATOM 52027 H2 WAT 587 60.799 82.332 154.098 1.00 0.00 H TER 52029 WAT 587 ATOM 52029 O WAT 588 116.436 69.871 97.183 1.00 0.00 O ATOM 52030 H1 WAT 588 116.665 70.055 98.094 1.00 0.00 H ATOM 52031 H2 WAT 588 115.952 70.646 96.897 1.00 0.00 H TER 52033 WAT 588 ATOM 52033 O WAT 589 13.380 16.071 68.557 1.00 0.00 O ATOM 52034 H1 WAT 589 13.532 16.300 67.640 1.00 0.00 H ATOM 52035 H2 WAT 589 12.439 15.905 68.609 1.00 0.00 H TER 52037 WAT 589 ATOM 52037 O WAT 590 88.410 74.753 62.790 1.00 0.00 O ATOM 52038 H1 WAT 590 87.584 74.281 62.689 1.00 0.00 H ATOM 52039 H2 WAT 590 88.597 74.709 63.728 1.00 0.00 H TER 52041 WAT 590 ATOM 52041 O WAT 591 76.274 14.237 97.374 1.00 0.00 O ATOM 52042 H1 WAT 591 76.609 15.095 97.636 1.00 0.00 H ATOM 52043 H2 WAT 591 75.481 14.432 96.874 1.00 0.00 H TER 52045 WAT 591 ATOM 52045 O WAT 592 100.165 32.709 127.084 1.00 0.00 O ATOM 52046 H1 WAT 592 100.183 33.666 127.059 1.00 0.00 H ATOM 52047 H2 WAT 592 101.000 32.464 127.482 1.00 0.00 H TER 52049 WAT 592 ATOM 52049 O WAT 593 0.153 60.478 2.951 1.00 0.00 O ATOM 52050 H1 WAT 593 0.575 60.854 2.178 1.00 0.00 H ATOM 52051 H2 WAT 593 -0.161 59.622 2.659 1.00 0.00 H TER 52053 WAT 593 ATOM 52053 O WAT 594 48.454 88.934 70.854 1.00 0.00 O ATOM 52054 H1 WAT 594 48.424 88.238 70.197 1.00 0.00 H ATOM 52055 H2 WAT 594 47.928 88.601 71.581 1.00 0.00 H TER 52057 WAT 594 ATOM 52057 O WAT 595 104.133 67.053 145.176 1.00 0.00 O ATOM 52058 H1 WAT 595 104.601 66.428 145.729 1.00 0.00 H ATOM 52059 H2 WAT 595 104.747 67.256 144.471 1.00 0.00 H TER 52061 WAT 595 ATOM 52061 O WAT 596 94.326 33.363 57.430 1.00 0.00 O ATOM 52062 H1 WAT 596 93.381 33.510 57.410 1.00 0.00 H ATOM 52063 H2 WAT 596 94.438 32.598 57.994 1.00 0.00 H TER 52065 WAT 596 ATOM 52065 O WAT 597 50.068 82.579 110.159 1.00 0.00 O ATOM 52066 H1 WAT 597 49.393 83.151 110.525 1.00 0.00 H ATOM 52067 H2 WAT 597 50.384 83.046 109.385 1.00 0.00 H TER 52069 WAT 597 ATOM 52069 O WAT 598 65.076 57.268 15.553 1.00 0.00 O ATOM 52070 H1 WAT 598 65.950 57.552 15.819 1.00 0.00 H ATOM 52071 H2 WAT 598 65.148 56.317 15.468 1.00 0.00 H TER 52073 WAT 598 ATOM 52073 O WAT 599 50.671 76.573 70.337 1.00 0.00 O ATOM 52074 H1 WAT 599 50.153 76.674 71.136 1.00 0.00 H ATOM 52075 H2 WAT 599 51.121 75.735 70.448 1.00 0.00 H TER 52077 WAT 599 ATOM 52077 O WAT 600 73.639 76.358 120.281 1.00 0.00 O ATOM 52078 H1 WAT 600 73.684 75.524 119.814 1.00 0.00 H ATOM 52079 H2 WAT 600 72.939 76.236 120.922 1.00 0.00 H TER 52081 WAT 600 ATOM 52081 O WAT 601 20.132 86.863 112.780 1.00 0.00 O ATOM 52082 H1 WAT 601 20.178 87.627 112.206 1.00 0.00 H ATOM 52083 H2 WAT 601 19.434 86.325 112.408 1.00 0.00 H TER 52085 WAT 601 ATOM 52085 O WAT 602 32.424 41.368 1.724 1.00 0.00 O ATOM 52086 H1 WAT 602 32.208 40.637 2.304 1.00 0.00 H ATOM 52087 H2 WAT 602 33.070 41.878 2.213 1.00 0.00 H TER 52089 WAT 602 ATOM 52089 O WAT 603 115.350 10.257 146.529 1.00 0.00 O ATOM 52090 H1 WAT 603 115.083 9.367 146.301 1.00 0.00 H ATOM 52091 H2 WAT 603 114.842 10.466 147.313 1.00 0.00 H TER 52093 WAT 603 ATOM 52093 O WAT 604 87.925 13.583 20.957 1.00 0.00 O ATOM 52094 H1 WAT 604 88.631 13.042 20.603 1.00 0.00 H ATOM 52095 H2 WAT 604 88.134 14.471 20.666 1.00 0.00 H TER 52097 WAT 604 ATOM 52097 O WAT 605 50.885 82.254 82.583 1.00 0.00 O ATOM 52098 H1 WAT 605 50.659 81.420 82.172 1.00 0.00 H ATOM 52099 H2 WAT 605 50.550 82.918 81.980 1.00 0.00 H TER 52101 WAT 605 ATOM 52101 O WAT 606 66.216 54.899 94.183 1.00 0.00 O ATOM 52102 H1 WAT 606 65.854 55.771 94.341 1.00 0.00 H ATOM 52103 H2 WAT 606 67.010 55.059 93.673 1.00 0.00 H TER 52105 WAT 606 ATOM 52105 O WAT 607 81.563 21.713 102.299 1.00 0.00 O ATOM 52106 H1 WAT 607 81.847 20.832 102.055 1.00 0.00 H ATOM 52107 H2 WAT 607 81.707 21.758 103.244 1.00 0.00 H TER 52109 WAT 607 ATOM 52109 O WAT 608 122.481 108.317 125.562 1.00 0.00 O ATOM 52110 H1 WAT 608 121.931 107.852 126.193 1.00 0.00 H ATOM 52111 H2 WAT 608 123.277 107.788 125.505 1.00 0.00 H TER 52113 WAT 608 ATOM 52113 O WAT 609 29.854 9.773 81.400 1.00 0.00 O ATOM 52114 H1 WAT 609 30.159 10.122 80.562 1.00 0.00 H ATOM 52115 H2 WAT 609 30.653 9.647 81.912 1.00 0.00 H TER 52117 WAT 609 ATOM 52117 O WAT 610 3.916 61.621 61.010 1.00 0.00 O ATOM 52118 H1 WAT 610 4.730 61.189 61.267 1.00 0.00 H ATOM 52119 H2 WAT 610 3.950 61.646 60.054 1.00 0.00 H TER 52121 WAT 610 ATOM 52121 O WAT 611 74.627 85.744 115.058 1.00 0.00 O ATOM 52122 H1 WAT 611 74.863 85.246 114.276 1.00 0.00 H ATOM 52123 H2 WAT 611 74.765 85.133 115.782 1.00 0.00 H TER 52125 WAT 611 ATOM 52125 O WAT 612 62.127 87.042 83.641 1.00 0.00 O ATOM 52126 H1 WAT 612 61.518 87.759 83.817 1.00 0.00 H ATOM 52127 H2 WAT 612 62.278 86.640 84.496 1.00 0.00 H TER 52129 WAT 612 ATOM 52129 O WAT 613 47.466 25.282 149.935 1.00 0.00 O ATOM 52130 H1 WAT 613 46.843 24.640 150.275 1.00 0.00 H ATOM 52131 H2 WAT 613 48.155 24.755 149.529 1.00 0.00 H TER 52133 WAT 613 ATOM 52133 O WAT 614 57.793 68.455 23.424 1.00 0.00 O ATOM 52134 H1 WAT 614 58.423 69.099 23.101 1.00 0.00 H ATOM 52135 H2 WAT 614 58.291 67.924 24.046 1.00 0.00 H TER 52137 WAT 614 ATOM 52137 O WAT 615 114.534 0.815 68.481 1.00 0.00 O ATOM 52138 H1 WAT 615 114.344 -0.123 68.458 1.00 0.00 H ATOM 52139 H2 WAT 615 114.817 0.981 69.380 1.00 0.00 H TER 52141 WAT 615 ATOM 52141 O WAT 616 94.455 24.411 155.081 1.00 0.00 O ATOM 52142 H1 WAT 616 93.722 25.026 155.052 1.00 0.00 H ATOM 52143 H2 WAT 616 94.784 24.473 155.978 1.00 0.00 H TER 52145 WAT 616 ATOM 52145 O WAT 617 12.786 14.872 75.441 1.00 0.00 O ATOM 52146 H1 WAT 617 13.038 15.683 75.882 1.00 0.00 H ATOM 52147 H2 WAT 617 11.902 14.690 75.761 1.00 0.00 H TER 52149 WAT 617 ATOM 52149 O WAT 618 42.466 126.513 76.359 1.00 0.00 O ATOM 52150 H1 WAT 618 41.628 126.817 76.707 1.00 0.00 H ATOM 52151 H2 WAT 618 42.235 126.033 75.564 1.00 0.00 H TER 52153 WAT 618 ATOM 52153 O WAT 619 51.980 46.719 18.618 1.00 0.00 O ATOM 52154 H1 WAT 619 52.380 47.581 18.737 1.00 0.00 H ATOM 52155 H2 WAT 619 52.144 46.263 19.443 1.00 0.00 H TER 52157 WAT 619 ATOM 52157 O WAT 620 123.222 113.732 94.104 1.00 0.00 O ATOM 52158 H1 WAT 620 123.079 113.525 93.181 1.00 0.00 H ATOM 52159 H2 WAT 620 123.574 114.622 94.099 1.00 0.00 H TER 52161 WAT 620 ATOM 52161 O WAT 621 30.477 114.031 79.102 1.00 0.00 O ATOM 52162 H1 WAT 621 31.339 114.446 79.093 1.00 0.00 H ATOM 52163 H2 WAT 621 29.876 114.722 78.824 1.00 0.00 H TER 52165 WAT 621 ATOM 52165 O WAT 622 70.643 35.361 112.681 1.00 0.00 O ATOM 52166 H1 WAT 622 70.711 35.362 111.726 1.00 0.00 H ATOM 52167 H2 WAT 622 71.318 35.975 112.970 1.00 0.00 H TER 52169 WAT 622 ATOM 52169 O WAT 623 3.742 1.987 77.566 1.00 0.00 O ATOM 52170 H1 WAT 623 3.285 2.803 77.771 1.00 0.00 H ATOM 52171 H2 WAT 623 3.046 1.376 77.325 1.00 0.00 H TER 52173 WAT 623 ATOM 52173 O WAT 624 90.488 1.747 52.329 1.00 0.00 O ATOM 52174 H1 WAT 624 90.848 2.489 51.843 1.00 0.00 H ATOM 52175 H2 WAT 624 89.891 2.144 52.963 1.00 0.00 H TER 52177 WAT 624 ATOM 52177 O WAT 625 36.046 9.756 101.375 1.00 0.00 O ATOM 52178 H1 WAT 625 36.239 9.859 102.307 1.00 0.00 H ATOM 52179 H2 WAT 625 36.387 8.890 101.153 1.00 0.00 H TER 52181 WAT 625 ATOM 52181 O WAT 626 64.444 16.907 6.874 1.00 0.00 O ATOM 52182 H1 WAT 626 63.883 16.540 6.191 1.00 0.00 H ATOM 52183 H2 WAT 626 65.257 17.133 6.421 1.00 0.00 H TER 52185 WAT 626 ATOM 52185 O WAT 627 45.813 71.916 87.291 1.00 0.00 O ATOM 52186 H1 WAT 627 46.511 72.343 86.795 1.00 0.00 H ATOM 52187 H2 WAT 627 46.255 71.538 88.051 1.00 0.00 H TER 52189 WAT 627 ATOM 52189 O WAT 628 23.596 12.504 79.011 1.00 0.00 O ATOM 52190 H1 WAT 628 23.851 11.660 78.638 1.00 0.00 H ATOM 52191 H2 WAT 628 24.181 12.621 79.759 1.00 0.00 H TER 52193 WAT 628 ATOM 52193 O WAT 629 8.560 78.724 104.957 1.00 0.00 O ATOM 52194 H1 WAT 629 8.886 77.824 104.958 1.00 0.00 H ATOM 52195 H2 WAT 629 8.139 78.828 105.810 1.00 0.00 H TER 52197 WAT 629 ATOM 52197 O WAT 630 57.249 8.825 105.910 1.00 0.00 O ATOM 52198 H1 WAT 630 58.126 8.460 106.023 1.00 0.00 H ATOM 52199 H2 WAT 630 56.829 8.248 105.272 1.00 0.00 H TER 52201 WAT 630 ATOM 52201 O WAT 631 125.418 9.860 71.052 1.00 0.00 O ATOM 52202 H1 WAT 631 125.453 9.854 70.095 1.00 0.00 H ATOM 52203 H2 WAT 631 126.318 10.040 71.323 1.00 0.00 H TER 52205 WAT 631 ATOM 52205 O WAT 632 19.236 2.356 92.002 1.00 0.00 O ATOM 52206 H1 WAT 632 18.779 2.478 92.834 1.00 0.00 H ATOM 52207 H2 WAT 632 19.305 1.407 91.903 1.00 0.00 H TER 52209 WAT 632 ATOM 52209 O WAT 633 100.794 69.559 13.732 1.00 0.00 O ATOM 52210 H1 WAT 633 100.821 68.937 14.458 1.00 0.00 H ATOM 52211 H2 WAT 633 100.806 70.419 14.152 1.00 0.00 H TER 52213 WAT 633 ATOM 52213 O WAT 634 59.815 136.528 15.157 1.00 0.00 O ATOM 52214 H1 WAT 634 60.257 137.010 15.857 1.00 0.00 H ATOM 52215 H2 WAT 634 59.714 135.642 15.503 1.00 0.00 H TER 52217 WAT 634 ATOM 52217 O WAT 635 129.446 23.796 116.246 1.00 0.00 O ATOM 52218 H1 WAT 635 129.915 24.278 115.565 1.00 0.00 H ATOM 52219 H2 WAT 635 128.726 23.367 115.783 1.00 0.00 H TER 52221 WAT 635 ATOM 52221 O WAT 636 25.223 86.503 61.991 1.00 0.00 O ATOM 52222 H1 WAT 636 25.648 85.655 61.868 1.00 0.00 H ATOM 52223 H2 WAT 636 25.242 86.909 61.124 1.00 0.00 H TER 52225 WAT 636 ATOM 52225 O WAT 637 103.317 62.340 104.714 1.00 0.00 O ATOM 52226 H1 WAT 637 103.350 63.146 104.199 1.00 0.00 H ATOM 52227 H2 WAT 637 104.209 61.995 104.676 1.00 0.00 H TER 52229 WAT 637 ATOM 52229 O WAT 638 79.137 47.812 100.925 1.00 0.00 O ATOM 52230 H1 WAT 638 78.747 48.684 100.991 1.00 0.00 H ATOM 52231 H2 WAT 638 78.414 47.212 101.107 1.00 0.00 H TER 52233 WAT 638 ATOM 52233 O WAT 639 120.590 107.171 109.278 1.00 0.00 O ATOM 52234 H1 WAT 639 119.718 107.500 109.498 1.00 0.00 H ATOM 52235 H2 WAT 639 121.021 107.052 110.124 1.00 0.00 H TER 52237 WAT 639 ATOM 52237 O WAT 640 87.424 91.267 112.103 1.00 0.00 O ATOM 52238 H1 WAT 640 87.184 91.789 112.869 1.00 0.00 H ATOM 52239 H2 WAT 640 88.127 91.765 111.684 1.00 0.00 H TER 52241 WAT 640 ATOM 52241 O WAT 641 12.682 102.076 77.841 1.00 0.00 O ATOM 52242 H1 WAT 641 12.717 102.040 76.885 1.00 0.00 H ATOM 52243 H2 WAT 641 12.994 101.217 78.125 1.00 0.00 H TER 52245 WAT 641 ATOM 52245 O WAT 642 79.374 12.190 136.455 1.00 0.00 O ATOM 52246 H1 WAT 642 79.309 11.356 136.919 1.00 0.00 H ATOM 52247 H2 WAT 642 80.033 12.037 135.778 1.00 0.00 H TER 52249 WAT 642 ATOM 52249 O WAT 643 140.997 36.205 12.259 1.00 0.00 O ATOM 52250 H1 WAT 643 140.713 36.323 13.166 1.00 0.00 H ATOM 52251 H2 WAT 643 140.701 36.997 11.811 1.00 0.00 H TER 52253 WAT 643 ATOM 52253 O WAT 644 22.477 116.640 147.497 1.00 0.00 O ATOM 52254 H1 WAT 644 21.764 116.112 147.140 1.00 0.00 H ATOM 52255 H2 WAT 644 22.135 117.534 147.499 1.00 0.00 H TER 52257 WAT 644 ATOM 52257 O WAT 645 115.112 50.447 74.606 1.00 0.00 O ATOM 52258 H1 WAT 645 114.759 50.123 73.778 1.00 0.00 H ATOM 52259 H2 WAT 645 114.408 50.304 75.239 1.00 0.00 H TER 52261 WAT 645 ATOM 52261 O WAT 646 69.220 129.216 3.307 1.00 0.00 O ATOM 52262 H1 WAT 646 69.033 128.612 4.026 1.00 0.00 H ATOM 52263 H2 WAT 646 68.639 128.934 2.601 1.00 0.00 H TER 52265 WAT 646 ATOM 52265 O WAT 647 120.416 103.591 150.080 1.00 0.00 O ATOM 52266 H1 WAT 647 121.341 103.693 149.856 1.00 0.00 H ATOM 52267 H2 WAT 647 119.950 103.765 149.261 1.00 0.00 H TER 52269 WAT 647 ATOM 52269 O WAT 648 18.379 18.000 110.224 1.00 0.00 O ATOM 52270 H1 WAT 648 19.027 17.438 110.650 1.00 0.00 H ATOM 52271 H2 WAT 648 18.447 18.836 110.686 1.00 0.00 H TER 52273 WAT 648 ATOM 52273 O WAT 649 12.166 2.417 76.712 1.00 0.00 O ATOM 52274 H1 WAT 649 11.528 2.772 76.093 1.00 0.00 H ATOM 52275 H2 WAT 649 12.456 3.175 77.219 1.00 0.00 H TER 52277 WAT 649 ATOM 52277 O WAT 650 67.546 33.951 100.831 1.00 0.00 O ATOM 52278 H1 WAT 650 67.094 33.479 100.131 1.00 0.00 H ATOM 52279 H2 WAT 650 68.442 33.614 100.807 1.00 0.00 H TER 52281 WAT 650 ATOM 52281 O WAT 651 96.736 56.393 126.924 1.00 0.00 O ATOM 52282 H1 WAT 651 97.009 55.982 126.104 1.00 0.00 H ATOM 52283 H2 WAT 651 95.918 55.951 127.152 1.00 0.00 H TER 52285 WAT 651 ATOM 52285 O WAT 652 100.093 116.405 130.958 1.00 0.00 O ATOM 52286 H1 WAT 652 99.367 116.588 131.554 1.00 0.00 H ATOM 52287 H2 WAT 652 99.870 116.876 130.156 1.00 0.00 H TER 52289 WAT 652 ATOM 52289 O WAT 653 4.402 104.991 97.400 1.00 0.00 O ATOM 52290 H1 WAT 653 4.050 104.391 98.057 1.00 0.00 H ATOM 52291 H2 WAT 653 5.324 105.090 97.637 1.00 0.00 H TER 52293 WAT 653 ATOM 52293 O WAT 654 10.340 64.883 138.152 1.00 0.00 O ATOM 52294 H1 WAT 654 10.099 65.061 137.242 1.00 0.00 H ATOM 52295 H2 WAT 654 9.519 64.626 138.571 1.00 0.00 H TER 52297 WAT 654 ATOM 52297 O WAT 655 106.842 23.782 132.080 1.00 0.00 O ATOM 52298 H1 WAT 655 107.006 23.190 132.814 1.00 0.00 H ATOM 52299 H2 WAT 655 106.026 24.228 132.309 1.00 0.00 H TER 52301 WAT 655 ATOM 52301 O WAT 656 88.906 119.688 58.035 1.00 0.00 O ATOM 52302 H1 WAT 656 88.126 119.196 58.292 1.00 0.00 H ATOM 52303 H2 WAT 656 89.365 119.855 58.858 1.00 0.00 H TER 52305 WAT 656 ATOM 52305 O WAT 657 34.734 50.788 75.071 1.00 0.00 O ATOM 52306 H1 WAT 657 34.286 50.565 74.255 1.00 0.00 H ATOM 52307 H2 WAT 657 35.250 50.010 75.281 1.00 0.00 H TER 52309 WAT 657 ATOM 52309 O WAT 658 123.575 121.423 8.219 1.00 0.00 O ATOM 52310 H1 WAT 658 123.012 122.107 7.856 1.00 0.00 H ATOM 52311 H2 WAT 658 124.382 121.878 8.457 1.00 0.00 H TER 52313 WAT 658 ATOM 52313 O WAT 659 62.056 16.615 97.549 1.00 0.00 O ATOM 52314 H1 WAT 659 62.309 17.323 98.142 1.00 0.00 H ATOM 52315 H2 WAT 659 61.293 16.215 97.965 1.00 0.00 H TER 52317 WAT 659 ATOM 52317 O WAT 660 90.215 90.175 65.267 1.00 0.00 O ATOM 52318 H1 WAT 660 91.125 90.080 64.985 1.00 0.00 H ATOM 52319 H2 WAT 660 90.269 90.666 66.087 1.00 0.00 H TER 52321 WAT 660 ATOM 52321 O WAT 661 92.347 142.905 106.149 1.00 0.00 O ATOM 52322 H1 WAT 661 92.818 143.559 106.664 1.00 0.00 H ATOM 52323 H2 WAT 661 91.641 142.609 106.723 1.00 0.00 H TER 52325 WAT 661 ATOM 52325 O WAT 662 5.694 50.417 9.771 1.00 0.00 O ATOM 52326 H1 WAT 662 5.514 51.236 9.309 1.00 0.00 H ATOM 52327 H2 WAT 662 5.624 50.646 10.698 1.00 0.00 H TER 52329 WAT 662 ATOM 52329 O WAT 663 90.654 59.226 138.274 1.00 0.00 O ATOM 52330 H1 WAT 663 91.019 58.784 139.041 1.00 0.00 H ATOM 52331 H2 WAT 663 89.709 59.229 138.427 1.00 0.00 H TER 52333 WAT 663 ATOM 52333 O WAT 664 102.917 33.079 57.408 1.00 0.00 O ATOM 52334 H1 WAT 664 103.687 33.637 57.514 1.00 0.00 H ATOM 52335 H2 WAT 664 102.365 33.547 56.781 1.00 0.00 H TER 52337 WAT 664 ATOM 52337 O WAT 665 55.318 60.407 9.234 1.00 0.00 O ATOM 52338 H1 WAT 665 56.166 60.797 9.446 1.00 0.00 H ATOM 52339 H2 WAT 665 54.723 61.153 9.159 1.00 0.00 H TER 52341 WAT 665 ATOM 52341 O WAT 666 61.434 103.202 126.269 1.00 0.00 O ATOM 52342 H1 WAT 666 62.189 103.776 126.399 1.00 0.00 H ATOM 52343 H2 WAT 666 60.680 103.740 126.510 1.00 0.00 H TER 52345 WAT 666 ATOM 52345 O WAT 667 40.159 108.843 120.432 1.00 0.00 O ATOM 52346 H1 WAT 667 39.546 108.128 120.264 1.00 0.00 H ATOM 52347 H2 WAT 667 39.603 109.612 120.555 1.00 0.00 H TER 52349 WAT 667 ATOM 52349 O WAT 668 93.363 17.107 140.967 1.00 0.00 O ATOM 52350 H1 WAT 668 93.954 17.838 141.147 1.00 0.00 H ATOM 52351 H2 WAT 668 92.872 16.990 141.780 1.00 0.00 H TER 52353 WAT 668 ATOM 52353 O WAT 669 22.948 21.974 67.621 1.00 0.00 O ATOM 52354 H1 WAT 669 23.539 22.505 68.155 1.00 0.00 H ATOM 52355 H2 WAT 669 23.097 22.277 66.725 1.00 0.00 H TER 52357 WAT 669 ATOM 52357 O WAT 670 84.366 93.928 0.495 1.00 0.00 O ATOM 52358 H1 WAT 670 83.664 93.760 -0.133 1.00 0.00 H ATOM 52359 H2 WAT 670 85.091 93.378 0.197 1.00 0.00 H TER 52361 WAT 670 ATOM 52361 O WAT 671 38.940 51.972 137.507 1.00 0.00 O ATOM 52362 H1 WAT 671 38.395 52.684 137.173 1.00 0.00 H ATOM 52363 H2 WAT 671 39.065 51.393 136.755 1.00 0.00 H TER 52365 WAT 671 ATOM 52365 O WAT 672 30.151 79.034 25.092 1.00 0.00 O ATOM 52366 H1 WAT 672 29.809 78.886 25.973 1.00 0.00 H ATOM 52367 H2 WAT 672 29.517 78.609 24.515 1.00 0.00 H TER 52369 WAT 672 ATOM 52369 O WAT 673 139.184 53.213 100.554 1.00 0.00 O ATOM 52370 H1 WAT 673 139.346 54.133 100.344 1.00 0.00 H ATOM 52371 H2 WAT 673 139.985 52.922 100.989 1.00 0.00 H TER 52373 WAT 673 ATOM 52373 O WAT 674 38.148 36.119 18.696 1.00 0.00 O ATOM 52374 H1 WAT 674 37.309 36.308 19.117 1.00 0.00 H ATOM 52375 H2 WAT 674 38.683 36.894 18.869 1.00 0.00 H TER 52377 WAT 674 ATOM 52377 O WAT 675 54.977 25.358 65.808 1.00 0.00 O ATOM 52378 H1 WAT 675 54.720 24.813 65.064 1.00 0.00 H ATOM 52379 H2 WAT 675 55.889 25.590 65.630 1.00 0.00 H TER 52381 WAT 675 ATOM 52381 O WAT 676 139.678 16.351 147.830 1.00 0.00 O ATOM 52382 H1 WAT 676 140.554 16.635 148.089 1.00 0.00 H ATOM 52383 H2 WAT 676 139.664 15.413 148.022 1.00 0.00 H TER 52385 WAT 676 ATOM 52385 O WAT 677 83.083 44.137 55.994 1.00 0.00 O ATOM 52386 H1 WAT 677 82.831 43.483 56.645 1.00 0.00 H ATOM 52387 H2 WAT 677 83.961 43.875 55.718 1.00 0.00 H TER 52389 WAT 677 ATOM 52389 O WAT 678 27.756 18.721 130.178 1.00 0.00 O ATOM 52390 H1 WAT 678 27.915 19.441 130.788 1.00 0.00 H ATOM 52391 H2 WAT 678 28.470 18.782 129.544 1.00 0.00 H TER 52393 WAT 678 ATOM 52393 O WAT 679 5.775 78.809 75.302 1.00 0.00 O ATOM 52394 H1 WAT 679 6.594 78.743 74.812 1.00 0.00 H ATOM 52395 H2 WAT 679 5.290 78.018 75.066 1.00 0.00 H TER 52397 WAT 679 ATOM 52397 O WAT 680 138.310 110.655 118.719 1.00 0.00 O ATOM 52398 H1 WAT 680 137.984 111.104 119.499 1.00 0.00 H ATOM 52399 H2 WAT 680 138.404 109.742 118.990 1.00 0.00 H TER 52401 WAT 680 ATOM 52401 O WAT 681 129.842 50.542 3.949 1.00 0.00 O ATOM 52402 H1 WAT 681 129.518 50.390 3.061 1.00 0.00 H ATOM 52403 H2 WAT 681 129.919 49.667 4.329 1.00 0.00 H TER 52405 WAT 681 ATOM 52405 O WAT 682 43.096 101.187 76.142 1.00 0.00 O ATOM 52406 H1 WAT 682 42.450 100.489 76.251 1.00 0.00 H ATOM 52407 H2 WAT 682 43.646 100.894 75.416 1.00 0.00 H TER 52409 WAT 682 ATOM 52409 O WAT 683 22.381 98.513 132.768 1.00 0.00 O ATOM 52410 H1 WAT 683 23.031 97.810 132.780 1.00 0.00 H ATOM 52411 H2 WAT 683 22.714 99.135 132.121 1.00 0.00 H TER 52413 WAT 683 ATOM 52413 O WAT 684 73.636 38.622 137.479 1.00 0.00 O ATOM 52414 H1 WAT 684 73.562 39.197 136.717 1.00 0.00 H ATOM 52415 H2 WAT 684 73.895 37.775 137.116 1.00 0.00 H TER 52417 WAT 684 ATOM 52417 O WAT 685 27.465 22.720 113.515 1.00 0.00 O ATOM 52418 H1 WAT 685 27.955 23.504 113.765 1.00 0.00 H ATOM 52419 H2 WAT 685 28.127 22.129 113.157 1.00 0.00 H TER 52421 WAT 685 ATOM 52421 O WAT 686 32.806 90.506 6.696 1.00 0.00 O ATOM 52422 H1 WAT 686 32.634 90.309 7.616 1.00 0.00 H ATOM 52423 H2 WAT 686 33.743 90.697 6.662 1.00 0.00 H TER 52425 WAT 686 ATOM 52425 O WAT 687 47.061 128.483 136.849 1.00 0.00 O ATOM 52426 H1 WAT 687 46.386 127.976 137.302 1.00 0.00 H ATOM 52427 H2 WAT 687 46.763 129.390 136.915 1.00 0.00 H TER 52429 WAT 687 ATOM 52429 O WAT 688 30.773 11.663 76.134 1.00 0.00 O ATOM 52430 H1 WAT 688 30.970 11.552 77.064 1.00 0.00 H ATOM 52431 H2 WAT 688 30.345 10.845 75.880 1.00 0.00 H TER 52433 WAT 688 ATOM 52433 O WAT 689 140.709 118.321 96.952 1.00 0.00 O ATOM 52434 H1 WAT 689 141.084 119.201 96.986 1.00 0.00 H ATOM 52435 H2 WAT 689 140.722 118.090 96.023 1.00 0.00 H TER 52437 WAT 689 ATOM 52437 O WAT 690 102.163 62.886 91.864 1.00 0.00 O ATOM 52438 H1 WAT 690 102.895 62.438 92.288 1.00 0.00 H ATOM 52439 H2 WAT 690 101.442 62.813 92.490 1.00 0.00 H TER 52441 WAT 690 ATOM 52441 O WAT 691 27.346 106.110 134.362 1.00 0.00 O ATOM 52442 H1 WAT 691 27.179 107.053 134.366 1.00 0.00 H ATOM 52443 H2 WAT 691 26.546 105.724 134.719 1.00 0.00 H TER 52445 WAT 691 ATOM 52445 O WAT 692 70.279 55.660 131.246 1.00 0.00 O ATOM 52446 H1 WAT 692 70.156 54.788 130.872 1.00 0.00 H ATOM 52447 H2 WAT 692 69.439 55.865 131.657 1.00 0.00 H TER 52449 WAT 692 ATOM 52449 O WAT 693 13.589 3.055 2.463 1.00 0.00 O ATOM 52450 H1 WAT 693 12.721 2.789 2.159 1.00 0.00 H ATOM 52451 H2 WAT 693 13.659 3.976 2.213 1.00 0.00 H TER 52453 WAT 693 ATOM 52453 O WAT 694 141.591 70.656 79.086 1.00 0.00 O ATOM 52454 H1 WAT 694 142.149 70.740 78.313 1.00 0.00 H ATOM 52455 H2 WAT 694 140.800 71.148 78.864 1.00 0.00 H TER 52457 WAT 694 ATOM 52457 O WAT 695 101.087 21.137 147.611 1.00 0.00 O ATOM 52458 H1 WAT 695 100.488 20.981 148.340 1.00 0.00 H ATOM 52459 H2 WAT 695 100.586 20.893 146.832 1.00 0.00 H TER 52461 WAT 695 ATOM 52461 O WAT 696 45.585 5.924 87.958 1.00 0.00 O ATOM 52462 H1 WAT 696 44.864 5.368 87.662 1.00 0.00 H ATOM 52463 H2 WAT 696 45.833 6.427 87.183 1.00 0.00 H TER 52465 WAT 696 ATOM 52465 O WAT 697 97.195 114.738 13.493 1.00 0.00 O ATOM 52466 H1 WAT 697 97.447 115.576 13.881 1.00 0.00 H ATOM 52467 H2 WAT 697 97.415 114.827 12.566 1.00 0.00 H TER 52469 WAT 697 ATOM 52469 O WAT 698 104.426 144.029 88.841 1.00 0.00 O ATOM 52470 H1 WAT 698 103.724 143.387 88.734 1.00 0.00 H ATOM 52471 H2 WAT 698 105.126 143.547 89.280 1.00 0.00 H TER 52473 WAT 698 ATOM 52473 O WAT 699 68.250 144.827 95.801 1.00 0.00 O ATOM 52474 H1 WAT 699 67.503 145.213 96.259 1.00 0.00 H ATOM 52475 H2 WAT 699 68.971 144.886 96.427 1.00 0.00 H TER 52477 WAT 699 ATOM 52477 O WAT 700 130.749 36.901 72.959 1.00 0.00 O ATOM 52478 H1 WAT 700 130.811 36.028 72.571 1.00 0.00 H ATOM 52479 H2 WAT 700 131.653 37.132 73.172 1.00 0.00 H TER 52481 WAT 700 ATOM 52481 O WAT 701 25.980 23.748 106.116 1.00 0.00 O ATOM 52482 H1 WAT 701 25.782 22.888 106.488 1.00 0.00 H ATOM 52483 H2 WAT 701 26.893 23.907 106.354 1.00 0.00 H TER 52485 WAT 701 ATOM 52485 O WAT 702 79.843 130.926 19.700 1.00 0.00 O ATOM 52486 H1 WAT 702 80.373 131.695 19.488 1.00 0.00 H ATOM 52487 H2 WAT 702 80.445 130.338 20.156 1.00 0.00 H TER 52489 WAT 702 ATOM 52489 O WAT 703 53.694 70.069 86.059 1.00 0.00 O ATOM 52490 H1 WAT 703 53.879 70.090 86.998 1.00 0.00 H ATOM 52491 H2 WAT 703 53.310 70.925 85.872 1.00 0.00 H TER 52493 WAT 703 ATOM 52493 O WAT 704 105.256 7.708 142.682 1.00 0.00 O ATOM 52494 H1 WAT 704 104.387 7.523 143.038 1.00 0.00 H ATOM 52495 H2 WAT 704 105.097 8.329 141.972 1.00 0.00 H TER 52497 WAT 704 ATOM 52497 O WAT 705 118.316 88.199 129.846 1.00 0.00 O ATOM 52498 H1 WAT 705 118.038 88.206 130.762 1.00 0.00 H ATOM 52499 H2 WAT 705 117.615 87.739 129.386 1.00 0.00 H TER 52501 WAT 705 ATOM 52501 O WAT 706 51.231 93.066 113.902 1.00 0.00 O ATOM 52502 H1 WAT 706 51.813 93.825 113.942 1.00 0.00 H ATOM 52503 H2 WAT 706 50.797 93.051 114.755 1.00 0.00 H TER 52505 WAT 706 ATOM 52505 O WAT 707 21.813 138.828 128.765 1.00 0.00 O ATOM 52506 H1 WAT 707 21.118 138.778 129.422 1.00 0.00 H ATOM 52507 H2 WAT 707 21.665 139.664 128.324 1.00 0.00 H TER 52509 WAT 707 ATOM 52509 O WAT 708 68.007 45.172 25.539 1.00 0.00 O ATOM 52510 H1 WAT 708 68.061 45.714 24.752 1.00 0.00 H ATOM 52511 H2 WAT 708 67.793 44.297 25.212 1.00 0.00 H TER 52513 WAT 708 ATOM 52513 O WAT 709 9.213 55.790 141.849 1.00 0.00 O ATOM 52514 H1 WAT 709 10.087 55.404 141.790 1.00 0.00 H ATOM 52515 H2 WAT 709 8.622 55.087 141.578 1.00 0.00 H TER 52517 WAT 709 ATOM 52517 O WAT 710 6.744 86.177 113.461 1.00 0.00 O ATOM 52518 H1 WAT 710 7.589 85.729 113.495 1.00 0.00 H ATOM 52519 H2 WAT 710 6.132 85.512 113.146 1.00 0.00 H TER 52521 WAT 710 ATOM 52521 O WAT 711 28.837 102.678 128.125 1.00 0.00 O ATOM 52522 H1 WAT 711 27.905 102.493 128.242 1.00 0.00 H ATOM 52523 H2 WAT 711 29.026 103.367 128.762 1.00 0.00 H TER 52525 WAT 711 ATOM 52525 O WAT 712 4.702 101.413 86.989 1.00 0.00 O ATOM 52526 H1 WAT 712 4.954 101.070 87.846 1.00 0.00 H ATOM 52527 H2 WAT 712 5.210 100.895 86.365 1.00 0.00 H TER 52529 WAT 712 ATOM 52529 O WAT 713 63.187 31.073 122.286 1.00 0.00 O ATOM 52530 H1 WAT 713 62.545 31.782 122.249 1.00 0.00 H ATOM 52531 H2 WAT 713 62.787 30.362 121.787 1.00 0.00 H TER 52533 WAT 713 ATOM 52533 O WAT 714 81.144 22.778 119.702 1.00 0.00 O ATOM 52534 H1 WAT 714 80.456 23.307 120.106 1.00 0.00 H ATOM 52535 H2 WAT 714 81.904 23.359 119.669 1.00 0.00 H TER 52537 WAT 714 ATOM 52537 O WAT 715 14.814 82.042 11.915 1.00 0.00 O ATOM 52538 H1 WAT 715 14.777 82.629 12.670 1.00 0.00 H ATOM 52539 H2 WAT 715 15.604 81.519 12.057 1.00 0.00 H TER 52541 WAT 715 ATOM 52541 O WAT 716 81.448 129.018 140.518 1.00 0.00 O ATOM 52542 H1 WAT 716 82.294 129.435 140.680 1.00 0.00 H ATOM 52543 H2 WAT 716 81.384 128.967 139.564 1.00 0.00 H TER 52545 WAT 716 ATOM 52545 O WAT 717 97.136 38.254 140.023 1.00 0.00 O ATOM 52546 H1 WAT 717 97.378 39.179 140.068 1.00 0.00 H ATOM 52547 H2 WAT 717 96.547 38.124 140.766 1.00 0.00 H TER 52549 WAT 717 ATOM 52549 O WAT 718 104.591 40.227 133.961 1.00 0.00 O ATOM 52550 H1 WAT 718 104.665 39.377 134.395 1.00 0.00 H ATOM 52551 H2 WAT 718 103.807 40.623 134.342 1.00 0.00 H TER 52553 WAT 718 ATOM 52553 O WAT 719 130.260 112.469 121.905 1.00 0.00 O ATOM 52554 H1 WAT 719 129.523 112.531 121.297 1.00 0.00 H ATOM 52555 H2 WAT 719 130.539 113.376 122.037 1.00 0.00 H TER 52557 WAT 719 ATOM 52557 O WAT 720 50.240 95.313 157.494 1.00 0.00 O ATOM 52558 H1 WAT 720 49.791 94.561 157.106 1.00 0.00 H ATOM 52559 H2 WAT 720 51.170 95.101 157.419 1.00 0.00 H TER 52561 WAT 720 ATOM 52561 O WAT 721 110.558 33.485 126.310 1.00 0.00 O ATOM 52562 H1 WAT 721 109.975 32.970 125.751 1.00 0.00 H ATOM 52563 H2 WAT 721 111.412 33.429 125.881 1.00 0.00 H TER 52565 WAT 721 ATOM 52565 O WAT 722 11.083 128.872 20.538 1.00 0.00 O ATOM 52566 H1 WAT 722 10.418 128.896 21.226 1.00 0.00 H ATOM 52567 H2 WAT 722 11.397 129.774 20.477 1.00 0.00 H TER 52569 WAT 722 ATOM 52569 O WAT 723 68.514 33.718 123.740 1.00 0.00 O ATOM 52570 H1 WAT 723 68.906 34.002 122.914 1.00 0.00 H ATOM 52571 H2 WAT 723 67.571 33.735 123.576 1.00 0.00 H TER 52573 WAT 723 ATOM 52573 O WAT 724 51.308 34.459 2.150 1.00 0.00 O ATOM 52574 H1 WAT 724 50.522 34.889 1.813 1.00 0.00 H ATOM 52575 H2 WAT 724 52.033 34.983 1.807 1.00 0.00 H TER 52577 WAT 724 ATOM 52577 O WAT 725 72.906 127.864 1.832 1.00 0.00 O ATOM 52578 H1 WAT 725 72.465 128.711 1.772 1.00 0.00 H ATOM 52579 H2 WAT 725 72.223 127.257 2.119 1.00 0.00 H TER 52581 WAT 725 ATOM 52581 O WAT 726 56.251 102.084 118.421 1.00 0.00 O ATOM 52582 H1 WAT 726 57.140 102.350 118.188 1.00 0.00 H ATOM 52583 H2 WAT 726 56.242 101.136 118.290 1.00 0.00 H TER 52585 WAT 726 ATOM 52585 O WAT 727 32.638 35.628 131.252 1.00 0.00 O ATOM 52586 H1 WAT 727 33.059 35.431 132.089 1.00 0.00 H ATOM 52587 H2 WAT 727 32.309 34.783 130.945 1.00 0.00 H TER 52589 WAT 727 ATOM 52589 O WAT 728 69.335 49.518 106.021 1.00 0.00 O ATOM 52590 H1 WAT 728 70.015 49.607 105.354 1.00 0.00 H ATOM 52591 H2 WAT 728 69.648 50.048 106.755 1.00 0.00 H TER 52593 WAT 728 ATOM 52593 O WAT 729 31.469 110.290 14.663 1.00 0.00 O ATOM 52594 H1 WAT 729 31.879 110.514 15.499 1.00 0.00 H ATOM 52595 H2 WAT 729 30.529 110.325 14.840 1.00 0.00 H TER 52597 WAT 729 ATOM 52597 O WAT 730 130.424 29.699 98.036 1.00 0.00 O ATOM 52598 H1 WAT 730 129.696 30.126 97.586 1.00 0.00 H ATOM 52599 H2 WAT 730 130.113 28.809 98.205 1.00 0.00 H TER 52601 WAT 730 ATOM 52601 O WAT 731 93.449 96.737 76.907 1.00 0.00 O ATOM 52602 H1 WAT 731 94.394 96.812 76.779 1.00 0.00 H ATOM 52603 H2 WAT 731 93.262 95.807 76.778 1.00 0.00 H TER 52605 WAT 731 ATOM 52605 O WAT 732 97.319 20.881 70.981 1.00 0.00 O ATOM 52606 H1 WAT 732 96.642 21.470 71.313 1.00 0.00 H ATOM 52607 H2 WAT 732 97.451 20.247 71.686 1.00 0.00 H TER 52609 WAT 732 ATOM 52609 O WAT 733 98.935 51.263 108.972 1.00 0.00 O ATOM 52610 H1 WAT 733 98.236 51.916 108.990 1.00 0.00 H ATOM 52611 H2 WAT 733 99.739 51.774 108.882 1.00 0.00 H TER 52613 WAT 733 ATOM 52613 O WAT 734 43.145 79.546 146.686 1.00 0.00 O ATOM 52614 H1 WAT 734 42.913 80.229 146.057 1.00 0.00 H ATOM 52615 H2 WAT 734 44.021 79.265 146.422 1.00 0.00 H TER 52617 WAT 734 ATOM 52617 O WAT 735 112.059 92.759 51.067 1.00 0.00 O ATOM 52618 H1 WAT 735 111.738 92.468 50.213 1.00 0.00 H ATOM 52619 H2 WAT 735 111.874 92.025 51.653 1.00 0.00 H TER 52621 WAT 735 ATOM 52621 O WAT 736 132.791 63.605 107.110 1.00 0.00 O ATOM 52622 H1 WAT 736 133.398 63.710 106.377 1.00 0.00 H ATOM 52623 H2 WAT 736 133.208 62.953 107.674 1.00 0.00 H TER 52625 WAT 736 ATOM 52625 O WAT 737 78.942 129.614 96.685 1.00 0.00 O ATOM 52626 H1 WAT 737 79.842 129.516 96.372 1.00 0.00 H ATOM 52627 H2 WAT 737 78.513 128.794 96.441 1.00 0.00 H TER 52629 WAT 737 ATOM 52629 O WAT 738 30.584 39.788 139.484 1.00 0.00 O ATOM 52630 H1 WAT 738 30.749 40.212 140.326 1.00 0.00 H ATOM 52631 H2 WAT 738 31.366 39.976 138.964 1.00 0.00 H TER 52633 WAT 738 ATOM 52633 O WAT 739 110.444 22.638 3.092 1.00 0.00 O ATOM 52634 H1 WAT 739 109.983 23.077 3.807 1.00 0.00 H ATOM 52635 H2 WAT 739 110.315 23.211 2.336 1.00 0.00 H TER 52637 WAT 739 ATOM 52637 O WAT 740 82.812 26.153 95.887 1.00 0.00 O ATOM 52638 H1 WAT 740 82.494 25.684 96.659 1.00 0.00 H ATOM 52639 H2 WAT 740 82.187 25.932 95.198 1.00 0.00 H TER 52641 WAT 740 ATOM 52641 O WAT 741 23.016 87.821 123.445 1.00 0.00 O ATOM 52642 H1 WAT 741 22.209 88.071 123.896 1.00 0.00 H ATOM 52643 H2 WAT 741 22.954 88.249 122.591 1.00 0.00 H TER 52645 WAT 741 ATOM 52645 O WAT 742 41.541 123.455 140.310 1.00 0.00 O ATOM 52646 H1 WAT 742 41.291 123.304 141.221 1.00 0.00 H ATOM 52647 H2 WAT 742 41.814 124.372 140.285 1.00 0.00 H TER 52649 WAT 742 ATOM 52649 O WAT 743 143.074 24.676 83.602 1.00 0.00 O ATOM 52650 H1 WAT 743 142.174 24.842 83.322 1.00 0.00 H ATOM 52651 H2 WAT 743 143.253 23.780 83.317 1.00 0.00 H TER 52653 WAT 743 ATOM 52653 O WAT 744 73.102 54.606 87.411 1.00 0.00 O ATOM 52654 H1 WAT 744 73.301 55.521 87.212 1.00 0.00 H ATOM 52655 H2 WAT 744 73.862 54.120 87.090 1.00 0.00 H TER 52657 WAT 744 ATOM 52657 O WAT 745 83.063 81.747 5.242 1.00 0.00 O ATOM 52658 H1 WAT 745 83.924 81.328 5.241 1.00 0.00 H ATOM 52659 H2 WAT 745 83.251 82.683 5.299 1.00 0.00 H TER 52661 WAT 745 ATOM 52661 O WAT 746 9.374 115.733 61.191 1.00 0.00 O ATOM 52662 H1 WAT 746 9.093 114.823 61.281 1.00 0.00 H ATOM 52663 H2 WAT 746 8.609 116.186 60.837 1.00 0.00 H TER 52665 WAT 746 ATOM 52665 O WAT 747 86.492 126.551 70.720 1.00 0.00 O ATOM 52666 H1 WAT 747 86.287 126.971 71.555 1.00 0.00 H ATOM 52667 H2 WAT 747 87.003 125.778 70.958 1.00 0.00 H TER 52669 WAT 747 ATOM 52669 O WAT 748 79.880 87.894 130.103 1.00 0.00 O ATOM 52670 H1 WAT 748 79.520 87.335 130.791 1.00 0.00 H ATOM 52671 H2 WAT 748 79.529 88.764 130.292 1.00 0.00 H TER 52673 WAT 748 ATOM 52673 O WAT 749 11.481 49.442 87.149 1.00 0.00 O ATOM 52674 H1 WAT 749 12.383 49.124 87.134 1.00 0.00 H ATOM 52675 H2 WAT 749 11.130 49.209 86.289 1.00 0.00 H TER 52677 WAT 749 ATOM 52677 O WAT 750 115.093 143.436 72.640 1.00 0.00 O ATOM 52678 H1 WAT 750 114.318 143.319 72.091 1.00 0.00 H ATOM 52679 H2 WAT 750 114.744 143.615 73.513 1.00 0.00 H TER 52681 WAT 750 ATOM 52681 O WAT 751 66.602 49.964 156.902 1.00 0.00 O ATOM 52682 H1 WAT 751 65.800 50.225 156.449 1.00 0.00 H ATOM 52683 H2 WAT 751 67.158 49.600 156.214 1.00 0.00 H TER 52685 WAT 751 ATOM 52685 O WAT 752 99.703 90.027 110.972 1.00 0.00 O ATOM 52686 H1 WAT 752 100.266 89.711 111.679 1.00 0.00 H ATOM 52687 H2 WAT 752 99.266 89.242 110.643 1.00 0.00 H TER 52689 WAT 752 ATOM 52689 O WAT 753 12.398 51.676 143.494 1.00 0.00 O ATOM 52690 H1 WAT 753 13.199 52.173 143.660 1.00 0.00 H ATOM 52691 H2 WAT 753 12.609 51.125 142.741 1.00 0.00 H TER 52693 WAT 753 ATOM 52693 O WAT 754 142.945 3.293 127.026 1.00 0.00 O ATOM 52694 H1 WAT 754 143.004 3.022 126.110 1.00 0.00 H ATOM 52695 H2 WAT 754 142.009 3.262 127.225 1.00 0.00 H TER 52697 WAT 754 ATOM 52697 O WAT 755 10.252 33.346 141.707 1.00 0.00 O ATOM 52698 H1 WAT 755 10.046 34.281 141.682 1.00 0.00 H ATOM 52699 H2 WAT 755 11.198 33.313 141.845 1.00 0.00 H TER 52701 WAT 755 ATOM 52701 O WAT 756 20.120 139.878 10.109 1.00 0.00 O ATOM 52702 H1 WAT 756 19.622 139.294 9.536 1.00 0.00 H ATOM 52703 H2 WAT 756 19.458 140.296 10.659 1.00 0.00 H TER 52705 WAT 756 ATOM 52705 O WAT 757 49.104 123.636 62.604 1.00 0.00 O ATOM 52706 H1 WAT 757 49.798 124.111 62.148 1.00 0.00 H ATOM 52707 H2 WAT 757 48.923 122.881 62.045 1.00 0.00 H TER 52709 WAT 757 ATOM 52709 O WAT 758 134.242 124.062 100.476 1.00 0.00 O ATOM 52710 H1 WAT 758 134.501 123.900 99.569 1.00 0.00 H ATOM 52711 H2 WAT 758 133.554 123.419 100.647 1.00 0.00 H TER 52713 WAT 758 ATOM 52713 O WAT 759 23.483 7.468 93.068 1.00 0.00 O ATOM 52714 H1 WAT 759 23.374 6.547 93.306 1.00 0.00 H ATOM 52715 H2 WAT 759 22.694 7.896 93.398 1.00 0.00 H TER 52717 WAT 759 ATOM 52717 O WAT 760 8.291 87.670 74.511 1.00 0.00 O ATOM 52718 H1 WAT 760 7.832 88.161 75.193 1.00 0.00 H ATOM 52719 H2 WAT 760 8.340 86.777 74.850 1.00 0.00 H TER 52721 WAT 760 ATOM 52721 O WAT 761 61.543 127.100 13.095 1.00 0.00 O ATOM 52722 H1 WAT 761 61.764 127.142 12.165 1.00 0.00 H ATOM 52723 H2 WAT 761 61.599 126.170 13.314 1.00 0.00 H TER 52725 WAT 761 ATOM 52725 O WAT 762 50.981 116.499 101.845 1.00 0.00 O ATOM 52726 H1 WAT 762 51.075 116.760 102.761 1.00 0.00 H ATOM 52727 H2 WAT 762 50.733 115.576 101.883 1.00 0.00 H TER 52729 WAT 762 ATOM 52729 O WAT 763 142.544 30.128 54.256 1.00 0.00 O ATOM 52730 H1 WAT 763 142.423 30.971 54.692 1.00 0.00 H ATOM 52731 H2 WAT 763 141.892 30.124 53.555 1.00 0.00 H TER 52733 WAT 763 ATOM 52733 O WAT 764 48.182 40.360 20.328 1.00 0.00 O ATOM 52734 H1 WAT 764 47.641 40.886 19.739 1.00 0.00 H ATOM 52735 H2 WAT 764 48.434 40.965 21.026 1.00 0.00 H TER 52737 WAT 764 ATOM 52737 O WAT 765 135.000 15.204 12.479 1.00 0.00 O ATOM 52738 H1 WAT 765 134.754 14.919 11.600 1.00 0.00 H ATOM 52739 H2 WAT 765 134.668 14.517 13.056 1.00 0.00 H TER 52741 WAT 765 ATOM 52741 O WAT 766 61.995 25.315 119.988 1.00 0.00 O ATOM 52742 H1 WAT 766 61.752 26.063 119.442 1.00 0.00 H ATOM 52743 H2 WAT 766 62.837 25.026 119.637 1.00 0.00 H TER 52745 WAT 766 ATOM 52745 O WAT 767 16.604 140.498 22.406 1.00 0.00 O ATOM 52746 H1 WAT 767 17.450 140.577 22.848 1.00 0.00 H ATOM 52747 H2 WAT 767 15.966 140.793 23.055 1.00 0.00 H TER 52749 WAT 767 ATOM 52749 O WAT 768 49.584 59.379 95.402 1.00 0.00 O ATOM 52750 H1 WAT 768 49.944 60.253 95.250 1.00 0.00 H ATOM 52751 H2 WAT 768 49.443 59.339 96.348 1.00 0.00 H TER 52753 WAT 768 ATOM 52753 O WAT 769 136.831 122.006 103.065 1.00 0.00 O ATOM 52754 H1 WAT 769 135.942 122.348 103.158 1.00 0.00 H ATOM 52755 H2 WAT 769 137.048 121.665 103.933 1.00 0.00 H TER 52757 WAT 769 ATOM 52757 O WAT 770 80.023 123.814 134.333 1.00 0.00 O ATOM 52758 H1 WAT 770 80.926 123.499 134.340 1.00 0.00 H ATOM 52759 H2 WAT 770 80.083 124.720 134.636 1.00 0.00 H TER 52761 WAT 770 ATOM 52761 O WAT 771 32.232 44.941 5.464 1.00 0.00 O ATOM 52762 H1 WAT 771 31.294 44.989 5.278 1.00 0.00 H ATOM 52763 H2 WAT 771 32.555 44.244 4.894 1.00 0.00 H TER 52765 WAT 771 ATOM 52765 O WAT 772 96.553 93.081 130.333 1.00 0.00 O ATOM 52766 H1 WAT 772 96.391 93.475 129.476 1.00 0.00 H ATOM 52767 H2 WAT 772 97.506 93.007 130.386 1.00 0.00 H TER 52769 WAT 772 ATOM 52769 O WAT 773 16.684 107.304 2.650 1.00 0.00 O ATOM 52770 H1 WAT 773 16.429 107.026 3.529 1.00 0.00 H ATOM 52771 H2 WAT 773 16.636 106.507 2.123 1.00 0.00 H TER 52773 WAT 773 ATOM 52773 O WAT 774 140.621 109.294 86.234 1.00 0.00 O ATOM 52774 H1 WAT 774 140.045 108.546 86.391 1.00 0.00 H ATOM 52775 H2 WAT 774 140.264 109.711 85.450 1.00 0.00 H TER 52777 WAT 774 ATOM 52777 O WAT 775 32.277 55.852 7.986 1.00 0.00 O ATOM 52778 H1 WAT 775 31.443 56.245 8.243 1.00 0.00 H ATOM 52779 H2 WAT 775 32.902 56.167 8.639 1.00 0.00 H TER 52781 WAT 775 ATOM 52781 O WAT 776 29.727 78.789 8.215 1.00 0.00 O ATOM 52782 H1 WAT 776 29.768 79.166 7.337 1.00 0.00 H ATOM 52783 H2 WAT 776 28.804 78.852 8.460 1.00 0.00 H TER 52785 WAT 776 ATOM 52785 O WAT 777 83.750 106.755 20.581 1.00 0.00 O ATOM 52786 H1 WAT 777 84.236 105.931 20.543 1.00 0.00 H ATOM 52787 H2 WAT 777 83.026 106.635 19.966 1.00 0.00 H TER 52789 WAT 777 ATOM 52789 O WAT 778 44.509 35.838 135.709 1.00 0.00 O ATOM 52790 H1 WAT 778 43.735 35.960 135.160 1.00 0.00 H ATOM 52791 H2 WAT 778 45.166 36.421 135.330 1.00 0.00 H TER 52793 WAT 778 ATOM 52793 O WAT 779 129.315 60.852 98.946 1.00 0.00 O ATOM 52794 H1 WAT 779 128.730 61.383 99.488 1.00 0.00 H ATOM 52795 H2 WAT 779 130.082 60.702 99.498 1.00 0.00 H TER 52797 WAT 779 ATOM 52797 O WAT 780 93.189 44.117 103.758 1.00 0.00 O ATOM 52798 H1 WAT 780 93.896 43.790 104.314 1.00 0.00 H ATOM 52799 H2 WAT 780 93.626 44.399 102.955 1.00 0.00 H TER 52801 WAT 780 ATOM 52801 O WAT 781 75.475 22.965 50.113 1.00 0.00 O ATOM 52802 H1 WAT 781 75.798 23.574 50.778 1.00 0.00 H ATOM 52803 H2 WAT 781 74.680 23.378 49.777 1.00 0.00 H TER 52805 WAT 781 ATOM 52805 O WAT 782 140.448 111.446 89.921 1.00 0.00 O ATOM 52806 H1 WAT 782 140.418 112.390 90.077 1.00 0.00 H ATOM 52807 H2 WAT 782 141.167 111.328 89.300 1.00 0.00 H TER 52809 WAT 782 ATOM 52809 O WAT 783 76.000 98.033 146.225 1.00 0.00 O ATOM 52810 H1 WAT 783 75.169 97.767 145.831 1.00 0.00 H ATOM 52811 H2 WAT 783 75.748 98.507 147.018 1.00 0.00 H TER 52813 WAT 783 ATOM 52813 O WAT 784 80.205 20.743 136.361 1.00 0.00 O ATOM 52814 H1 WAT 784 80.237 20.051 135.701 1.00 0.00 H ATOM 52815 H2 WAT 784 79.430 20.539 136.885 1.00 0.00 H TER 52817 WAT 784 ATOM 52817 O WAT 785 91.347 114.291 124.402 1.00 0.00 O ATOM 52818 H1 WAT 785 91.683 113.608 123.822 1.00 0.00 H ATOM 52819 H2 WAT 785 91.963 115.016 124.300 1.00 0.00 H TER 52821 WAT 785 ATOM 52821 O WAT 786 58.822 60.080 28.609 1.00 0.00 O ATOM 52822 H1 WAT 786 58.668 61.018 28.714 1.00 0.00 H ATOM 52823 H2 WAT 786 59.595 59.902 29.145 1.00 0.00 H TER 52825 WAT 786 ATOM 52825 O WAT 787 36.553 138.562 143.629 1.00 0.00 O ATOM 52826 H1 WAT 787 36.793 138.655 142.707 1.00 0.00 H ATOM 52827 H2 WAT 787 36.183 137.682 143.692 1.00 0.00 H TER 52829 WAT 787 ATOM 52829 O WAT 788 74.158 143.961 129.933 1.00 0.00 O ATOM 52830 H1 WAT 788 73.247 143.961 129.639 1.00 0.00 H ATOM 52831 H2 WAT 788 74.237 143.170 130.466 1.00 0.00 H TER 52833 WAT 788 ATOM 52833 O WAT 789 87.632 86.709 15.206 1.00 0.00 O ATOM 52834 H1 WAT 789 88.019 85.890 15.513 1.00 0.00 H ATOM 52835 H2 WAT 789 88.299 87.372 15.386 1.00 0.00 H TER 52837 WAT 789 ATOM 52837 O WAT 790 -0.061 20.149 23.097 1.00 0.00 O ATOM 52838 H1 WAT 790 0.757 20.515 23.433 1.00 0.00 H ATOM 52839 H2 WAT 790 0.008 19.210 23.269 1.00 0.00 H TER 52841 WAT 790 ATOM 52841 O WAT 791 26.589 135.221 64.700 1.00 0.00 O ATOM 52842 H1 WAT 791 26.666 135.922 65.347 1.00 0.00 H ATOM 52843 H2 WAT 791 26.845 134.429 65.172 1.00 0.00 H TER 52845 WAT 791 ATOM 52845 O WAT 792 94.590 141.129 71.727 1.00 0.00 O ATOM 52846 H1 WAT 792 93.974 141.793 71.416 1.00 0.00 H ATOM 52847 H2 WAT 792 94.086 140.611 72.354 1.00 0.00 H TER 52849 WAT 792 ATOM 52849 O WAT 793 48.052 52.841 119.342 1.00 0.00 O ATOM 52850 H1 WAT 793 47.239 53.314 119.522 1.00 0.00 H ATOM 52851 H2 WAT 793 48.597 53.002 120.112 1.00 0.00 H TER 52853 WAT 793 ATOM 52853 O WAT 794 123.418 59.180 97.791 1.00 0.00 O ATOM 52854 H1 WAT 794 124.033 59.329 97.072 1.00 0.00 H ATOM 52855 H2 WAT 794 123.566 58.270 98.047 1.00 0.00 H TER 52857 WAT 794 ATOM 52857 O WAT 795 110.238 140.298 66.830 1.00 0.00 O ATOM 52858 H1 WAT 795 110.039 141.144 66.428 1.00 0.00 H ATOM 52859 H2 WAT 795 109.489 139.745 66.606 1.00 0.00 H TER 52861 WAT 795 ATOM 52861 O WAT 796 5.941 121.607 148.332 1.00 0.00 O ATOM 52862 H1 WAT 796 5.225 121.601 147.696 1.00 0.00 H ATOM 52863 H2 WAT 796 6.081 122.534 148.525 1.00 0.00 H TER 52865 WAT 796 ATOM 52865 O WAT 797 4.298 126.644 100.614 1.00 0.00 O ATOM 52866 H1 WAT 797 4.345 127.307 101.303 1.00 0.00 H ATOM 52867 H2 WAT 797 3.654 126.988 99.995 1.00 0.00 H TER 52869 WAT 797 ATOM 52869 O WAT 798 99.496 143.250 116.270 1.00 0.00 O ATOM 52870 H1 WAT 798 100.417 143.071 116.081 1.00 0.00 H ATOM 52871 H2 WAT 798 99.057 143.163 115.425 1.00 0.00 H TER 52873 WAT 798 ATOM 52873 O WAT 799 56.555 127.206 105.782 1.00 0.00 O ATOM 52874 H1 WAT 799 57.339 127.649 106.107 1.00 0.00 H ATOM 52875 H2 WAT 799 56.891 126.509 105.217 1.00 0.00 H TER 52877 WAT 799 ATOM 52877 O WAT 800 34.127 43.280 58.742 1.00 0.00 O ATOM 52878 H1 WAT 800 33.530 43.296 57.994 1.00 0.00 H ATOM 52879 H2 WAT 800 34.185 42.356 58.983 1.00 0.00 H TER 52881 WAT 800 ATOM 52881 O WAT 801 140.553 7.644 97.603 1.00 0.00 O ATOM 52882 H1 WAT 801 141.489 7.448 97.574 1.00 0.00 H ATOM 52883 H2 WAT 801 140.451 8.411 97.040 1.00 0.00 H TER 52885 WAT 801 ATOM 52885 O WAT 802 20.356 102.906 111.599 1.00 0.00 O ATOM 52886 H1 WAT 802 19.715 103.589 111.404 1.00 0.00 H ATOM 52887 H2 WAT 802 20.290 102.777 112.545 1.00 0.00 H TER 52889 WAT 802 ATOM 52889 O WAT 803 30.264 98.744 61.607 1.00 0.00 O ATOM 52890 H1 WAT 803 30.762 99.189 60.921 1.00 0.00 H ATOM 52891 H2 WAT 803 29.753 99.439 62.022 1.00 0.00 H TER 52893 WAT 803 ATOM 52893 O WAT 804 62.625 97.935 133.891 1.00 0.00 O ATOM 52894 H1 WAT 804 63.414 98.324 134.268 1.00 0.00 H ATOM 52895 H2 WAT 804 62.107 98.683 133.595 1.00 0.00 H TER 52897 WAT 804 ATOM 52897 O WAT 805 115.296 51.536 69.936 1.00 0.00 O ATOM 52898 H1 WAT 805 114.432 51.740 69.576 1.00 0.00 H ATOM 52899 H2 WAT 805 115.113 51.150 70.792 1.00 0.00 H TER 52901 WAT 805 ATOM 52901 O WAT 806 87.474 144.164 131.645 1.00 0.00 O ATOM 52902 H1 WAT 806 86.807 144.851 131.647 1.00 0.00 H ATOM 52903 H2 WAT 806 87.776 144.122 132.553 1.00 0.00 H TER 52905 WAT 806 ATOM 52905 O WAT 807 31.577 96.506 22.480 1.00 0.00 O ATOM 52906 H1 WAT 807 31.137 96.560 23.329 1.00 0.00 H ATOM 52907 H2 WAT 807 32.433 96.907 22.629 1.00 0.00 H TER 52909 WAT 807 ATOM 52909 O WAT 808 77.701 105.551 106.599 1.00 0.00 O ATOM 52910 H1 WAT 808 77.208 106.197 107.106 1.00 0.00 H ATOM 52911 H2 WAT 808 77.415 105.686 105.696 1.00 0.00 H TER 52913 WAT 808 ATOM 52913 O WAT 809 131.436 138.625 136.652 1.00 0.00 O ATOM 52914 H1 WAT 809 132.005 138.061 136.130 1.00 0.00 H ATOM 52915 H2 WAT 809 131.853 138.656 137.513 1.00 0.00 H TER 52917 WAT 809 ATOM 52917 O WAT 810 103.633 142.772 82.155 1.00 0.00 O ATOM 52918 H1 WAT 810 104.027 143.536 81.734 1.00 0.00 H ATOM 52919 H2 WAT 810 102.818 143.103 82.536 1.00 0.00 H TER 52921 WAT 810 ATOM 52921 O WAT 811 30.005 118.706 7.521 1.00 0.00 O ATOM 52922 H1 WAT 811 29.082 118.854 7.314 1.00 0.00 H ATOM 52923 H2 WAT 811 29.989 118.168 8.313 1.00 0.00 H TER 52925 WAT 811 ATOM 52925 O WAT 812 7.031 23.763 72.152 1.00 0.00 O ATOM 52926 H1 WAT 812 7.141 23.747 71.201 1.00 0.00 H ATOM 52927 H2 WAT 812 6.139 24.085 72.284 1.00 0.00 H TER 52929 WAT 812 ATOM 52929 O WAT 813 18.976 127.429 89.914 1.00 0.00 O ATOM 52930 H1 WAT 813 19.788 127.240 90.385 1.00 0.00 H ATOM 52931 H2 WAT 813 19.247 127.525 89.001 1.00 0.00 H TER 52933 WAT 813 ATOM 52933 O WAT 814 2.032 22.747 133.338 1.00 0.00 O ATOM 52934 H1 WAT 814 1.381 22.047 133.285 1.00 0.00 H ATOM 52935 H2 WAT 814 2.826 22.314 133.651 1.00 0.00 H TER 52937 WAT 814 ATOM 52937 O WAT 815 68.890 85.887 7.302 1.00 0.00 O ATOM 52938 H1 WAT 815 69.514 86.227 6.660 1.00 0.00 H ATOM 52939 H2 WAT 815 68.851 84.948 7.124 1.00 0.00 H TER 52941 WAT 815 ATOM 52941 O WAT 816 83.021 42.937 11.130 1.00 0.00 O ATOM 52942 H1 WAT 816 83.394 43.722 11.532 1.00 0.00 H ATOM 52943 H2 WAT 816 83.510 42.830 10.314 1.00 0.00 H TER 52945 WAT 816 ATOM 52945 O WAT 817 16.885 122.408 10.397 1.00 0.00 O ATOM 52946 H1 WAT 817 17.244 121.677 10.901 1.00 0.00 H ATOM 52947 H2 WAT 817 17.233 122.284 9.514 1.00 0.00 H TER 52949 WAT 817 ATOM 52949 O WAT 818 25.835 9.164 76.186 1.00 0.00 O ATOM 52950 H1 WAT 818 25.470 8.400 76.631 1.00 0.00 H ATOM 52951 H2 WAT 818 25.139 9.451 75.594 1.00 0.00 H TER 52953 WAT 818 ATOM 52953 O WAT 819 88.770 140.661 8.929 1.00 0.00 O ATOM 52954 H1 WAT 819 87.986 141.126 9.223 1.00 0.00 H ATOM 52955 H2 WAT 819 88.831 140.860 7.995 1.00 0.00 H TER 52957 WAT 819 ATOM 52957 O WAT 820 68.151 68.687 141.842 1.00 0.00 O ATOM 52958 H1 WAT 820 67.385 69.261 141.855 1.00 0.00 H ATOM 52959 H2 WAT 820 68.800 69.164 141.325 1.00 0.00 H TER 52961 WAT 820 ATOM 52961 O WAT 821 108.760 77.260 100.745 1.00 0.00 O ATOM 52962 H1 WAT 821 108.266 78.018 101.056 1.00 0.00 H ATOM 52963 H2 WAT 821 109.321 77.020 101.483 1.00 0.00 H TER 52965 WAT 821 ATOM 52965 O WAT 822 17.049 106.528 88.945 1.00 0.00 O ATOM 52966 H1 WAT 822 17.859 106.935 88.638 1.00 0.00 H ATOM 52967 H2 WAT 822 16.889 105.817 88.325 1.00 0.00 H TER 52969 WAT 822 ATOM 52969 O WAT 823 93.552 80.558 110.354 1.00 0.00 O ATOM 52970 H1 WAT 823 94.148 81.147 110.817 1.00 0.00 H ATOM 52971 H2 WAT 823 93.005 80.180 111.042 1.00 0.00 H TER 52973 WAT 823 ATOM 52973 O WAT 824 67.165 46.979 131.456 1.00 0.00 O ATOM 52974 H1 WAT 824 67.368 47.816 131.874 1.00 0.00 H ATOM 52975 H2 WAT 824 67.909 46.815 130.876 1.00 0.00 H TER 52977 WAT 824 ATOM 52977 O WAT 825 31.272 43.136 141.007 1.00 0.00 O ATOM 52978 H1 WAT 825 30.774 43.833 141.434 1.00 0.00 H ATOM 52979 H2 WAT 825 31.091 42.357 141.533 1.00 0.00 H TER 52981 WAT 825 ATOM 52981 O WAT 826 129.132 47.789 89.522 1.00 0.00 O ATOM 52982 H1 WAT 826 129.278 47.036 90.094 1.00 0.00 H ATOM 52983 H2 WAT 826 128.181 47.896 89.506 1.00 0.00 H TER 52985 WAT 826 ATOM 52985 O WAT 827 144.516 34.429 137.551 1.00 0.00 O ATOM 52986 H1 WAT 827 144.908 34.508 138.421 1.00 0.00 H ATOM 52987 H2 WAT 827 145.187 33.991 137.026 1.00 0.00 H TER 52989 WAT 827 ATOM 52989 O WAT 828 91.787 16.016 60.097 1.00 0.00 O ATOM 52990 H1 WAT 828 91.650 16.298 59.192 1.00 0.00 H ATOM 52991 H2 WAT 828 91.715 16.819 60.612 1.00 0.00 H TER 52993 WAT 828 ATOM 52993 O WAT 829 102.820 19.196 4.837 1.00 0.00 O ATOM 52994 H1 WAT 829 102.477 18.602 4.169 1.00 0.00 H ATOM 52995 H2 WAT 829 103.747 19.291 4.620 1.00 0.00 H TER 52997 WAT 829 ATOM 52997 O WAT 830 92.017 145.335 108.177 1.00 0.00 O ATOM 52998 H1 WAT 830 91.924 144.650 108.840 1.00 0.00 H ATOM 52999 H2 WAT 830 91.370 145.996 108.424 1.00 0.00 H TER 53001 WAT 830 ATOM 53001 O WAT 831 103.959 92.960 59.416 1.00 0.00 O ATOM 53002 H1 WAT 831 104.595 92.255 59.301 1.00 0.00 H ATOM 53003 H2 WAT 831 104.295 93.677 58.879 1.00 0.00 H TER 53005 WAT 831 ATOM 53005 O WAT 832 100.338 49.837 91.641 1.00 0.00 O ATOM 53006 H1 WAT 832 99.834 50.651 91.637 1.00 0.00 H ATOM 53007 H2 WAT 832 99.842 49.246 91.075 1.00 0.00 H TER 53009 WAT 832 ATOM 53009 O WAT 833 115.882 97.552 139.310 1.00 0.00 O ATOM 53010 H1 WAT 833 116.222 97.859 140.151 1.00 0.00 H ATOM 53011 H2 WAT 833 115.050 97.132 139.527 1.00 0.00 H TER 53013 WAT 833 ATOM 53013 O WAT 834 29.862 138.067 61.454 1.00 0.00 O ATOM 53014 H1 WAT 834 30.031 137.247 60.990 1.00 0.00 H ATOM 53015 H2 WAT 834 29.413 138.617 60.813 1.00 0.00 H TER 53017 WAT 834 ATOM 53017 O WAT 835 140.221 140.301 149.253 1.00 0.00 O ATOM 53018 H1 WAT 835 140.697 140.572 148.468 1.00 0.00 H ATOM 53019 H2 WAT 835 140.742 139.585 149.615 1.00 0.00 H TER 53021 WAT 835 ATOM 53021 O WAT 836 124.340 94.586 148.582 1.00 0.00 O ATOM 53022 H1 WAT 836 124.115 94.965 149.431 1.00 0.00 H ATOM 53023 H2 WAT 836 124.680 93.716 148.790 1.00 0.00 H TER 53025 WAT 836 ATOM 53025 O WAT 837 115.530 28.607 68.763 1.00 0.00 O ATOM 53026 H1 WAT 837 115.105 29.464 68.771 1.00 0.00 H ATOM 53027 H2 WAT 837 116.449 28.794 68.952 1.00 0.00 H TER 53029 WAT 837 ATOM 53029 O WAT 838 136.281 138.165 102.063 1.00 0.00 O ATOM 53030 H1 WAT 838 136.814 138.527 101.355 1.00 0.00 H ATOM 53031 H2 WAT 838 136.624 138.579 102.856 1.00 0.00 H TER 53033 WAT 838 ATOM 53033 O WAT 839 15.092 142.077 16.741 1.00 0.00 O ATOM 53034 H1 WAT 839 14.474 141.434 17.090 1.00 0.00 H ATOM 53035 H2 WAT 839 15.071 142.796 17.372 1.00 0.00 H TER 53037 WAT 839 ATOM 53037 O WAT 840 113.098 5.747 142.027 1.00 0.00 O ATOM 53038 H1 WAT 840 112.182 6.013 141.949 1.00 0.00 H ATOM 53039 H2 WAT 840 113.541 6.515 142.387 1.00 0.00 H TER 53041 WAT 840 ATOM 53041 O WAT 841 73.640 5.719 94.334 1.00 0.00 O ATOM 53042 H1 WAT 841 72.977 6.024 93.715 1.00 0.00 H ATOM 53043 H2 WAT 841 74.090 6.516 94.615 1.00 0.00 H TER 53045 WAT 841 ATOM 53045 O WAT 842 127.703 92.767 63.609 1.00 0.00 O ATOM 53046 H1 WAT 842 127.626 91.842 63.376 1.00 0.00 H ATOM 53047 H2 WAT 842 128.616 92.986 63.424 1.00 0.00 H TER 53049 WAT 842 ATOM 53049 O WAT 843 66.849 80.773 85.097 1.00 0.00 O ATOM 53050 H1 WAT 843 67.291 80.005 84.735 1.00 0.00 H ATOM 53051 H2 WAT 843 66.385 81.156 84.353 1.00 0.00 H TER 53053 WAT 843 ATOM 53053 O WAT 844 42.413 138.626 139.635 1.00 0.00 O ATOM 53054 H1 WAT 844 43.293 138.275 139.501 1.00 0.00 H ATOM 53055 H2 WAT 844 41.861 138.123 139.036 1.00 0.00 H TER 53057 WAT 844 ATOM 53057 O WAT 845 52.840 10.235 22.820 1.00 0.00 O ATOM 53058 H1 WAT 845 53.376 9.788 23.475 1.00 0.00 H ATOM 53059 H2 WAT 845 53.197 11.122 22.783 1.00 0.00 H TER 53061 WAT 845 ATOM 53061 O WAT 846 2.811 10.759 85.813 1.00 0.00 O ATOM 53062 H1 WAT 846 3.618 10.750 86.329 1.00 0.00 H ATOM 53063 H2 WAT 846 2.142 10.421 86.409 1.00 0.00 H TER 53065 WAT 846 ATOM 53065 O WAT 847 60.181 5.289 8.161 1.00 0.00 O ATOM 53066 H1 WAT 847 60.482 5.707 8.968 1.00 0.00 H ATOM 53067 H2 WAT 847 60.645 5.752 7.464 1.00 0.00 H TER 53069 WAT 847 ATOM 53069 O WAT 848 29.122 6.593 113.084 1.00 0.00 O ATOM 53070 H1 WAT 848 29.570 7.220 112.516 1.00 0.00 H ATOM 53071 H2 WAT 848 28.758 7.128 113.790 1.00 0.00 H TER 53073 WAT 848 ATOM 53073 O WAT 849 79.959 1.339 129.039 1.00 0.00 O ATOM 53074 H1 WAT 849 79.372 1.865 128.496 1.00 0.00 H ATOM 53075 H2 WAT 849 80.832 1.682 128.850 1.00 0.00 H TER 53077 WAT 849 ATOM 53077 O WAT 850 17.747 23.517 89.707 1.00 0.00 O ATOM 53078 H1 WAT 850 16.947 23.241 89.259 1.00 0.00 H ATOM 53079 H2 WAT 850 18.320 23.826 89.005 1.00 0.00 H TER 53081 WAT 850 ATOM 53081 O WAT 851 50.932 36.124 111.681 1.00 0.00 O ATOM 53082 H1 WAT 851 51.013 36.997 112.066 1.00 0.00 H ATOM 53083 H2 WAT 851 49.989 35.994 111.582 1.00 0.00 H TER 53085 WAT 851 ATOM 53085 O WAT 852 39.570 50.254 153.089 1.00 0.00 O ATOM 53086 H1 WAT 852 38.765 50.305 152.574 1.00 0.00 H ATOM 53087 H2 WAT 852 39.284 49.958 153.953 1.00 0.00 H TER 53089 WAT 852 ATOM 53089 O WAT 853 4.877 45.713 94.438 1.00 0.00 O ATOM 53090 H1 WAT 853 4.599 46.603 94.655 1.00 0.00 H ATOM 53091 H2 WAT 853 5.556 45.510 95.082 1.00 0.00 H TER 53093 WAT 853 ATOM 53093 O WAT 854 1.384 101.315 8.329 1.00 0.00 O ATOM 53094 H1 WAT 854 0.763 101.676 7.695 1.00 0.00 H ATOM 53095 H2 WAT 854 0.875 100.672 8.823 1.00 0.00 H TER 53097 WAT 854 ATOM 53097 O WAT 855 136.675 134.075 65.899 1.00 0.00 O ATOM 53098 H1 WAT 855 135.982 133.416 65.860 1.00 0.00 H ATOM 53099 H2 WAT 855 137.480 133.585 65.732 1.00 0.00 H TER 53101 WAT 855 ATOM 53101 O WAT 856 116.770 104.039 101.082 1.00 0.00 O ATOM 53102 H1 WAT 856 117.241 103.656 101.823 1.00 0.00 H ATOM 53103 H2 WAT 856 116.791 103.360 100.408 1.00 0.00 H TER 53105 WAT 856 ATOM 53105 O WAT 857 143.282 34.838 7.529 1.00 0.00 O ATOM 53106 H1 WAT 857 143.511 34.928 6.604 1.00 0.00 H ATOM 53107 H2 WAT 857 143.988 35.286 7.995 1.00 0.00 H TER 53109 WAT 857 ATOM 53109 O WAT 858 39.919 45.401 25.540 1.00 0.00 O ATOM 53110 H1 WAT 858 39.774 46.329 25.726 1.00 0.00 H ATOM 53111 H2 WAT 858 39.053 45.002 25.624 1.00 0.00 H TER 53113 WAT 858 ATOM 53113 O WAT 859 54.933 42.734 120.108 1.00 0.00 O ATOM 53114 H1 WAT 859 55.135 42.149 119.378 1.00 0.00 H ATOM 53115 H2 WAT 859 54.401 43.428 119.719 1.00 0.00 H TER 53117 WAT 859 ATOM 53117 O WAT 860 11.894 25.609 94.127 1.00 0.00 O ATOM 53118 H1 WAT 860 12.542 25.461 93.438 1.00 0.00 H ATOM 53119 H2 WAT 860 11.052 25.435 93.706 1.00 0.00 H TER 53121 WAT 860 ATOM 53121 O WAT 861 8.577 70.501 76.562 1.00 0.00 O ATOM 53122 H1 WAT 861 7.961 71.222 76.696 1.00 0.00 H ATOM 53123 H2 WAT 861 9.438 70.890 76.715 1.00 0.00 H TER 53125 WAT 861 ATOM 53125 O WAT 862 3.778 39.852 117.007 1.00 0.00 O ATOM 53126 H1 WAT 862 4.197 40.448 117.628 1.00 0.00 H ATOM 53127 H2 WAT 862 3.156 40.402 116.530 1.00 0.00 H TER 53129 WAT 862 ATOM 53129 O WAT 863 95.043 6.274 76.106 1.00 0.00 O ATOM 53130 H1 WAT 863 95.809 5.832 75.740 1.00 0.00 H ATOM 53131 H2 WAT 863 95.017 5.992 77.020 1.00 0.00 H TER 53133 WAT 863 ATOM 53133 O WAT 864 54.228 18.634 63.348 1.00 0.00 O ATOM 53134 H1 WAT 864 55.155 18.869 63.310 1.00 0.00 H ATOM 53135 H2 WAT 864 53.765 19.459 63.202 1.00 0.00 H TER 53137 WAT 864 ATOM 53137 O WAT 865 17.746 10.619 27.466 1.00 0.00 O ATOM 53138 H1 WAT 865 18.118 10.967 26.656 1.00 0.00 H ATOM 53139 H2 WAT 865 16.857 10.973 27.493 1.00 0.00 H TER 53141 WAT 865 ATOM 53141 O WAT 866 74.663 64.694 134.828 1.00 0.00 O ATOM 53142 H1 WAT 866 75.348 64.048 134.999 1.00 0.00 H ATOM 53143 H2 WAT 866 74.863 65.418 135.422 1.00 0.00 H TER 53145 WAT 866 ATOM 53145 O WAT 867 51.183 18.992 108.041 1.00 0.00 O ATOM 53146 H1 WAT 867 52.060 19.096 108.408 1.00 0.00 H ATOM 53147 H2 WAT 867 50.631 18.783 108.795 1.00 0.00 H TER 53149 WAT 867 ATOM 53149 O WAT 868 92.096 136.654 81.641 1.00 0.00 O ATOM 53150 H1 WAT 868 92.746 136.958 81.007 1.00 0.00 H ATOM 53151 H2 WAT 868 91.282 136.599 81.141 1.00 0.00 H TER 53153 WAT 868 ATOM 53153 O WAT 869 136.175 110.952 60.154 1.00 0.00 O ATOM 53154 H1 WAT 869 135.678 111.073 59.345 1.00 0.00 H ATOM 53155 H2 WAT 869 136.036 110.034 60.386 1.00 0.00 H TER 53157 WAT 869 ATOM 53157 O WAT 870 98.471 7.583 64.774 1.00 0.00 O ATOM 53158 H1 WAT 870 97.923 6.991 64.258 1.00 0.00 H ATOM 53159 H2 WAT 870 99.051 7.992 64.132 1.00 0.00 H TER 53161 WAT 870 ATOM 53161 O WAT 871 80.277 125.059 76.256 1.00 0.00 O ATOM 53162 H1 WAT 871 80.610 125.841 75.816 1.00 0.00 H ATOM 53163 H2 WAT 871 80.366 124.362 75.605 1.00 0.00 H TER 53165 WAT 871 ATOM 53165 O WAT 872 123.616 20.333 106.386 1.00 0.00 O ATOM 53166 H1 WAT 872 123.752 20.235 107.329 1.00 0.00 H ATOM 53167 H2 WAT 872 123.060 21.107 106.304 1.00 0.00 H TER 53169 WAT 872 ATOM 53169 O WAT 873 141.585 26.186 78.871 1.00 0.00 O ATOM 53170 H1 WAT 873 141.497 26.706 78.072 1.00 0.00 H ATOM 53171 H2 WAT 873 141.634 26.834 79.574 1.00 0.00 H TER 53173 WAT 873 ATOM 53173 O WAT 874 55.520 22.220 98.491 1.00 0.00 O ATOM 53174 H1 WAT 874 56.392 22.579 98.329 1.00 0.00 H ATOM 53175 H2 WAT 874 55.364 21.628 97.755 1.00 0.00 H TER 53177 WAT 874 ATOM 53177 O WAT 875 34.096 111.097 94.105 1.00 0.00 O ATOM 53178 H1 WAT 875 34.337 111.919 94.531 1.00 0.00 H ATOM 53179 H2 WAT 875 33.738 111.362 93.257 1.00 0.00 H TER 53181 WAT 875 ATOM 53181 O WAT 876 35.771 35.215 112.625 1.00 0.00 O ATOM 53182 H1 WAT 876 35.910 35.480 111.716 1.00 0.00 H ATOM 53183 H2 WAT 876 35.164 35.867 112.975 1.00 0.00 H TER 53185 WAT 876 ATOM 53185 O WAT 877 93.216 107.432 128.723 1.00 0.00 O ATOM 53186 H1 WAT 877 92.990 107.647 127.818 1.00 0.00 H ATOM 53187 H2 WAT 877 92.583 107.919 129.250 1.00 0.00 H TER 53189 WAT 877 ATOM 53189 O WAT 878 57.838 121.865 79.400 1.00 0.00 O ATOM 53190 H1 WAT 878 58.038 122.630 79.939 1.00 0.00 H ATOM 53191 H2 WAT 878 56.914 121.969 79.171 1.00 0.00 H TER 53193 WAT 878 ATOM 53193 O WAT 879 37.067 109.115 122.959 1.00 0.00 O ATOM 53194 H1 WAT 879 36.459 108.998 122.228 1.00 0.00 H ATOM 53195 H2 WAT 879 36.563 109.595 123.616 1.00 0.00 H TER 53197 WAT 879 ATOM 53197 O WAT 880 128.434 136.020 95.880 1.00 0.00 O ATOM 53198 H1 WAT 880 127.783 135.626 95.300 1.00 0.00 H ATOM 53199 H2 WAT 880 128.369 135.517 96.691 1.00 0.00 H TER 53201 WAT 880 ATOM 53201 O WAT 881 89.784 47.209 59.893 1.00 0.00 O ATOM 53202 H1 WAT 881 90.328 47.668 59.253 1.00 0.00 H ATOM 53203 H2 WAT 881 90.306 47.208 60.695 1.00 0.00 H TER 53205 WAT 881 ATOM 53205 O WAT 882 128.219 53.954 64.808 1.00 0.00 O ATOM 53206 H1 WAT 882 128.035 54.487 65.582 1.00 0.00 H ATOM 53207 H2 WAT 882 127.650 54.315 64.128 1.00 0.00 H TER 53209 WAT 882 ATOM 53209 O WAT 883 49.481 87.481 155.698 1.00 0.00 O ATOM 53210 H1 WAT 883 50.206 86.911 155.953 1.00 0.00 H ATOM 53211 H2 WAT 883 49.380 87.335 154.758 1.00 0.00 H TER 53213 WAT 883 ATOM 53213 O WAT 884 57.451 135.156 75.655 1.00 0.00 O ATOM 53214 H1 WAT 884 56.973 135.749 75.075 1.00 0.00 H ATOM 53215 H2 WAT 884 57.640 135.681 76.432 1.00 0.00 H TER 53217 WAT 884 ATOM 53217 O WAT 885 122.317 120.543 132.050 1.00 0.00 O ATOM 53218 H1 WAT 885 122.358 119.599 132.201 1.00 0.00 H ATOM 53219 H2 WAT 885 121.410 120.777 132.247 1.00 0.00 H TER 53221 WAT 885 ATOM 53221 O WAT 886 142.607 132.498 63.716 1.00 0.00 O ATOM 53222 H1 WAT 886 143.458 132.316 64.115 1.00 0.00 H ATOM 53223 H2 WAT 886 142.608 131.987 62.907 1.00 0.00 H TER 53225 WAT 886 ATOM 53225 O WAT 887 29.143 98.466 16.750 1.00 0.00 O ATOM 53226 H1 WAT 887 28.903 99.239 17.261 1.00 0.00 H ATOM 53227 H2 WAT 887 28.586 97.768 17.095 1.00 0.00 H TER 53229 WAT 887 ATOM 53229 O WAT 888 82.834 94.566 107.460 1.00 0.00 O ATOM 53230 H1 WAT 888 82.683 95.056 106.652 1.00 0.00 H ATOM 53231 H2 WAT 888 82.374 95.067 108.134 1.00 0.00 H TER 53233 WAT 888 ATOM 53233 O WAT 889 59.247 71.608 16.607 1.00 0.00 O ATOM 53234 H1 WAT 889 58.362 71.858 16.871 1.00 0.00 H ATOM 53235 H2 WAT 889 59.820 72.196 17.100 1.00 0.00 H TER 53237 WAT 889 ATOM 53237 O WAT 890 49.178 63.552 157.354 1.00 0.00 O ATOM 53238 H1 WAT 890 48.734 63.150 158.100 1.00 0.00 H ATOM 53239 H2 WAT 890 49.837 64.125 157.747 1.00 0.00 H TER 53241 WAT 890 ATOM 53241 O WAT 891 7.383 102.776 139.978 1.00 0.00 O ATOM 53242 H1 WAT 891 7.714 102.732 139.081 1.00 0.00 H ATOM 53243 H2 WAT 891 8.167 102.739 140.525 1.00 0.00 H TER 53245 WAT 891 ATOM 53245 O WAT 892 30.783 33.879 118.628 1.00 0.00 O ATOM 53246 H1 WAT 892 31.290 34.442 119.213 1.00 0.00 H ATOM 53247 H2 WAT 892 29.878 33.982 118.922 1.00 0.00 H TER 53249 WAT 892 ATOM 53249 O WAT 893 0.923 121.816 73.658 1.00 0.00 O ATOM 53250 H1 WAT 893 1.206 122.723 73.774 1.00 0.00 H ATOM 53251 H2 WAT 893 1.730 121.305 73.709 1.00 0.00 H TER 53253 WAT 893 ATOM 53253 O WAT 894 3.986 56.197 90.551 1.00 0.00 O ATOM 53254 H1 WAT 894 4.439 55.560 91.104 1.00 0.00 H ATOM 53255 H2 WAT 894 3.056 56.015 90.689 1.00 0.00 H TER 53257 WAT 894 ATOM 53257 O WAT 895 23.929 51.159 143.573 1.00 0.00 O ATOM 53258 H1 WAT 895 23.510 50.895 144.392 1.00 0.00 H ATOM 53259 H2 WAT 895 23.200 51.362 142.986 1.00 0.00 H TER 53261 WAT 895 ATOM 53261 O WAT 896 27.653 2.538 132.225 1.00 0.00 O ATOM 53262 H1 WAT 896 27.455 3.460 132.390 1.00 0.00 H ATOM 53263 H2 WAT 896 28.600 2.470 132.353 1.00 0.00 H TER 53265 WAT 896 ATOM 53265 O WAT 897 124.526 85.239 70.290 1.00 0.00 O ATOM 53266 H1 WAT 897 125.225 85.808 70.613 1.00 0.00 H ATOM 53267 H2 WAT 897 124.869 84.352 70.402 1.00 0.00 H TER 53269 WAT 897 ATOM 53269 O WAT 898 124.763 127.130 106.851 1.00 0.00 O ATOM 53270 H1 WAT 898 124.756 126.439 106.189 1.00 0.00 H ATOM 53271 H2 WAT 898 125.620 127.051 107.270 1.00 0.00 H TER 53273 WAT 898 ATOM 53273 O WAT 899 28.601 119.889 11.786 1.00 0.00 O ATOM 53274 H1 WAT 899 29.362 120.340 12.153 1.00 0.00 H ATOM 53275 H2 WAT 899 28.480 119.125 12.350 1.00 0.00 H TER 53277 WAT 899 ATOM 53277 O WAT 900 106.335 3.921 20.853 1.00 0.00 O ATOM 53278 H1 WAT 900 105.898 4.600 20.339 1.00 0.00 H ATOM 53279 H2 WAT 900 105.816 3.854 21.654 1.00 0.00 H TER 53281 WAT 900 ATOM 53281 O WAT 901 39.510 29.149 105.663 1.00 0.00 O ATOM 53282 H1 WAT 901 39.865 28.677 106.416 1.00 0.00 H ATOM 53283 H2 WAT 901 39.451 30.058 105.956 1.00 0.00 H TER 53285 WAT 901 ATOM 53285 O WAT 902 29.180 137.183 20.732 1.00 0.00 O ATOM 53286 H1 WAT 902 28.360 136.693 20.791 1.00 0.00 H ATOM 53287 H2 WAT 902 29.601 137.049 21.582 1.00 0.00 H TER 53289 WAT 902 ATOM 53289 O WAT 903 27.107 33.842 123.545 1.00 0.00 O ATOM 53290 H1 WAT 903 27.579 33.043 123.780 1.00 0.00 H ATOM 53291 H2 WAT 903 26.786 33.679 122.658 1.00 0.00 H TER 53293 WAT 903 ATOM 53293 O WAT 904 60.957 108.408 119.927 1.00 0.00 O ATOM 53294 H1 WAT 904 60.294 108.887 119.429 1.00 0.00 H ATOM 53295 H2 WAT 904 60.503 108.127 120.721 1.00 0.00 H TER 53297 WAT 904 ATOM 53297 O WAT 905 57.324 36.342 82.844 1.00 0.00 O ATOM 53298 H1 WAT 905 57.409 36.225 81.898 1.00 0.00 H ATOM 53299 H2 WAT 905 56.545 35.837 83.079 1.00 0.00 H TER 53301 WAT 905 ATOM 53301 O WAT 906 82.750 122.243 149.159 1.00 0.00 O ATOM 53302 H1 WAT 906 82.943 121.688 149.915 1.00 0.00 H ATOM 53303 H2 WAT 906 82.725 123.131 149.515 1.00 0.00 H TER 53305 WAT 906 ATOM 53305 O WAT 907 46.274 53.148 138.712 1.00 0.00 O ATOM 53306 H1 WAT 907 46.961 52.491 138.592 1.00 0.00 H ATOM 53307 H2 WAT 907 46.710 53.983 138.543 1.00 0.00 H TER 53309 WAT 907 ATOM 53309 O WAT 908 9.190 138.362 61.526 1.00 0.00 O ATOM 53310 H1 WAT 908 8.717 138.702 62.285 1.00 0.00 H ATOM 53311 H2 WAT 908 8.620 137.677 61.176 1.00 0.00 H TER 53313 WAT 908 ATOM 53313 O WAT 909 75.411 33.313 138.902 1.00 0.00 O ATOM 53314 H1 WAT 909 76.159 32.720 138.832 1.00 0.00 H ATOM 53315 H2 WAT 909 75.792 34.188 138.837 1.00 0.00 H TER 53317 WAT 909 ATOM 53317 O WAT 910 109.742 113.741 20.016 1.00 0.00 O ATOM 53318 H1 WAT 910 110.397 114.255 19.545 1.00 0.00 H ATOM 53319 H2 WAT 910 110.031 113.763 20.928 1.00 0.00 H TER 53321 WAT 910 ATOM 53321 O WAT 911 8.027 98.271 10.761 1.00 0.00 O ATOM 53322 H1 WAT 911 7.801 97.384 10.479 1.00 0.00 H ATOM 53323 H2 WAT 911 7.861 98.816 9.993 1.00 0.00 H TER 53325 WAT 911 ATOM 53325 O WAT 912 46.068 116.599 106.181 1.00 0.00 O ATOM 53326 H1 WAT 912 46.806 116.095 106.524 1.00 0.00 H ATOM 53327 H2 WAT 912 46.178 117.471 106.559 1.00 0.00 H TER 53329 WAT 912 ATOM 53329 O WAT 913 97.443 84.488 115.132 1.00 0.00 O ATOM 53330 H1 WAT 913 98.125 84.071 114.606 1.00 0.00 H ATOM 53331 H2 WAT 913 96.907 83.761 115.449 1.00 0.00 H TER 53333 WAT 913 ATOM 53333 O WAT 914 129.355 83.191 101.710 1.00 0.00 O ATOM 53334 H1 WAT 914 129.215 82.452 101.118 1.00 0.00 H ATOM 53335 H2 WAT 914 130.225 83.041 102.080 1.00 0.00 H TER 53337 WAT 914 ATOM 53337 O WAT 915 47.585 88.686 119.515 1.00 0.00 O ATOM 53338 H1 WAT 915 47.111 87.960 119.109 1.00 0.00 H ATOM 53339 H2 WAT 915 47.643 88.447 120.440 1.00 0.00 H TER 53341 WAT 915 ATOM 53341 O WAT 916 141.734 56.044 70.809 1.00 0.00 O ATOM 53342 H1 WAT 916 141.082 55.485 71.231 1.00 0.00 H ATOM 53343 H2 WAT 916 141.868 56.764 71.425 1.00 0.00 H TER 53345 WAT 916 ATOM 53345 O WAT 917 84.238 54.073 86.135 1.00 0.00 O ATOM 53346 H1 WAT 917 83.347 53.813 85.901 1.00 0.00 H ATOM 53347 H2 WAT 917 84.798 53.439 85.687 1.00 0.00 H TER 53349 WAT 917 ATOM 53349 O WAT 918 79.388 26.763 127.380 1.00 0.00 O ATOM 53350 H1 WAT 918 79.278 26.065 128.025 1.00 0.00 H ATOM 53351 H2 WAT 918 80.225 26.569 126.957 1.00 0.00 H TER 53353 WAT 918 ATOM 53353 O WAT 919 44.399 83.501 108.872 1.00 0.00 O ATOM 53354 H1 WAT 919 44.758 84.112 109.515 1.00 0.00 H ATOM 53355 H2 WAT 919 43.479 83.753 108.791 1.00 0.00 H TER 53357 WAT 919 ATOM 53357 O WAT 920 4.640 103.894 152.900 1.00 0.00 O ATOM 53358 H1 WAT 920 5.526 104.040 153.232 1.00 0.00 H ATOM 53359 H2 WAT 920 4.203 104.739 153.006 1.00 0.00 H TER 53361 WAT 920 ATOM 53361 O WAT 921 74.500 91.680 20.451 1.00 0.00 O ATOM 53362 H1 WAT 921 74.356 90.826 20.045 1.00 0.00 H ATOM 53363 H2 WAT 921 75.202 91.529 21.084 1.00 0.00 H TER 53365 WAT 921 ATOM 53365 O WAT 922 60.745 82.705 0.439 1.00 0.00 O ATOM 53366 H1 WAT 922 61.505 83.282 0.365 1.00 0.00 H ATOM 53367 H2 WAT 922 60.491 82.761 1.361 1.00 0.00 H TER 53369 WAT 922 ATOM 53369 O WAT 923 69.019 80.722 153.529 1.00 0.00 O ATOM 53370 H1 WAT 923 69.480 81.128 152.795 1.00 0.00 H ATOM 53371 H2 WAT 923 69.654 80.733 154.246 1.00 0.00 H TER 53373 WAT 923 ATOM 53373 O WAT 924 72.967 61.256 121.337 1.00 0.00 O ATOM 53374 H1 WAT 924 72.847 62.174 121.095 1.00 0.00 H ATOM 53375 H2 WAT 924 72.575 61.185 122.208 1.00 0.00 H TER 53377 WAT 924 ATOM 53377 O WAT 925 49.573 70.754 24.955 1.00 0.00 O ATOM 53378 H1 WAT 925 50.188 70.078 25.240 1.00 0.00 H ATOM 53379 H2 WAT 925 49.705 71.473 25.573 1.00 0.00 H TER 53381 WAT 925 ATOM 53381 O WAT 926 140.749 21.525 0.162 1.00 0.00 O ATOM 53382 H1 WAT 926 140.437 22.055 0.896 1.00 0.00 H ATOM 53383 H2 WAT 926 141.703 21.558 0.232 1.00 0.00 H TER 53385 WAT 926 ATOM 53385 O WAT 927 142.296 15.473 75.024 1.00 0.00 O ATOM 53386 H1 WAT 927 141.809 16.297 75.054 1.00 0.00 H ATOM 53387 H2 WAT 927 141.629 14.796 75.143 1.00 0.00 H TER 53389 WAT 927 ATOM 53389 O WAT 928 31.557 43.877 144.988 1.00 0.00 O ATOM 53390 H1 WAT 928 32.240 44.344 144.507 1.00 0.00 H ATOM 53391 H2 WAT 928 30.893 43.677 144.329 1.00 0.00 H TER 53393 WAT 928 ATOM 53393 O WAT 929 120.107 27.304 89.814 1.00 0.00 O ATOM 53394 H1 WAT 929 120.926 27.693 89.508 1.00 0.00 H ATOM 53395 H2 WAT 929 120.066 27.531 90.743 1.00 0.00 H TER 53397 WAT 929 ATOM 53397 O WAT 930 93.413 8.297 15.925 1.00 0.00 O ATOM 53398 H1 WAT 930 94.121 7.719 15.638 1.00 0.00 H ATOM 53399 H2 WAT 930 93.469 8.289 16.880 1.00 0.00 H TER 53401 WAT 930 ATOM 53401 O WAT 931 106.891 127.437 102.685 1.00 0.00 O ATOM 53402 H1 WAT 931 106.385 128.250 102.676 1.00 0.00 H ATOM 53403 H2 WAT 931 106.995 127.210 101.761 1.00 0.00 H TER 53405 WAT 931 ATOM 53405 O WAT 932 120.066 1.594 14.058 1.00 0.00 O ATOM 53406 H1 WAT 932 119.584 1.264 13.300 1.00 0.00 H ATOM 53407 H2 WAT 932 119.585 1.255 14.814 1.00 0.00 H TER 53409 WAT 932 ATOM 53409 O WAT 933 65.902 101.398 119.705 1.00 0.00 O ATOM 53410 H1 WAT 933 66.658 101.715 119.210 1.00 0.00 H ATOM 53411 H2 WAT 933 65.306 102.146 119.737 1.00 0.00 H TER 53413 WAT 933 ATOM 53413 O WAT 934 83.415 64.991 125.741 1.00 0.00 O ATOM 53414 H1 WAT 934 83.837 64.710 124.929 1.00 0.00 H ATOM 53415 H2 WAT 934 82.777 64.303 125.929 1.00 0.00 H TER 53417 WAT 934 ATOM 53417 O WAT 935 109.023 70.013 107.662 1.00 0.00 O ATOM 53418 H1 WAT 935 109.490 69.185 107.551 1.00 0.00 H ATOM 53419 H2 WAT 935 109.037 70.172 108.606 1.00 0.00 H TER 53421 WAT 935 ATOM 53421 O WAT 936 90.888 13.003 117.764 1.00 0.00 O ATOM 53422 H1 WAT 936 90.204 13.277 117.153 1.00 0.00 H ATOM 53423 H2 WAT 936 90.508 13.150 118.630 1.00 0.00 H TER 53425 WAT 936 ATOM 53425 O WAT 937 43.634 92.729 131.590 1.00 0.00 O ATOM 53426 H1 WAT 937 44.492 92.934 131.218 1.00 0.00 H ATOM 53427 H2 WAT 937 43.141 93.547 131.518 1.00 0.00 H TER 53429 WAT 937 ATOM 53429 O WAT 938 64.087 40.386 90.886 1.00 0.00 O ATOM 53430 H1 WAT 938 63.433 39.781 91.237 1.00 0.00 H ATOM 53431 H2 WAT 938 63.895 40.429 89.949 1.00 0.00 H TER 53433 WAT 938 ATOM 53433 O WAT 939 26.627 1.710 116.319 1.00 0.00 O ATOM 53434 H1 WAT 939 26.493 2.491 115.781 1.00 0.00 H ATOM 53435 H2 WAT 939 26.930 1.044 115.703 1.00 0.00 H TER 53437 WAT 939 ATOM 53437 O WAT 940 85.736 130.301 72.114 1.00 0.00 O ATOM 53438 H1 WAT 940 85.877 131.037 72.708 1.00 0.00 H ATOM 53439 H2 WAT 940 86.425 130.389 71.455 1.00 0.00 H TER 53441 WAT 940 ATOM 53441 O WAT 941 7.041 81.092 152.181 1.00 0.00 O ATOM 53442 H1 WAT 941 7.615 81.797 152.480 1.00 0.00 H ATOM 53443 H2 WAT 941 6.808 81.338 151.285 1.00 0.00 H TER 53445 WAT 941 ATOM 53445 O WAT 942 99.714 57.877 11.695 1.00 0.00 O ATOM 53446 H1 WAT 942 98.957 58.199 11.205 1.00 0.00 H ATOM 53447 H2 WAT 942 100.420 58.482 11.470 1.00 0.00 H TER 53449 WAT 942 ATOM 53449 O WAT 943 15.888 4.869 81.571 1.00 0.00 O ATOM 53450 H1 WAT 943 16.172 4.733 82.475 1.00 0.00 H ATOM 53451 H2 WAT 943 15.828 5.820 81.480 1.00 0.00 H TER 53453 WAT 943 ATOM 53453 O WAT 944 1.635 18.331 80.655 1.00 0.00 O ATOM 53454 H1 WAT 944 2.543 18.043 80.743 1.00 0.00 H ATOM 53455 H2 WAT 944 1.685 19.287 80.664 1.00 0.00 H TER 53457 WAT 944 ATOM 53457 O WAT 945 104.666 136.340 85.908 1.00 0.00 O ATOM 53458 H1 WAT 945 105.035 136.839 86.637 1.00 0.00 H ATOM 53459 H2 WAT 945 104.030 135.754 86.316 1.00 0.00 H TER 53461 WAT 945 ATOM 53461 O WAT 946 49.639 24.398 94.040 1.00 0.00 O ATOM 53462 H1 WAT 946 49.245 23.605 93.678 1.00 0.00 H ATOM 53463 H2 WAT 946 48.895 24.920 94.339 1.00 0.00 H TER 53465 WAT 946 ATOM 53465 O WAT 947 67.920 76.660 79.495 1.00 0.00 O ATOM 53466 H1 WAT 947 67.169 76.208 79.108 1.00 0.00 H ATOM 53467 H2 WAT 947 67.927 77.518 79.070 1.00 0.00 H TER 53469 WAT 947 ATOM 53469 O WAT 948 68.440 91.468 121.293 1.00 0.00 O ATOM 53470 H1 WAT 948 68.647 92.287 120.843 1.00 0.00 H ATOM 53471 H2 WAT 948 69.247 91.235 121.751 1.00 0.00 H TER 53473 WAT 948 ATOM 53473 O WAT 949 125.070 123.815 64.213 1.00 0.00 O ATOM 53474 H1 WAT 949 124.615 123.745 65.052 1.00 0.00 H ATOM 53475 H2 WAT 949 125.365 122.924 64.026 1.00 0.00 H TER 53477 WAT 949 ATOM 53477 O WAT 950 23.271 42.244 137.997 1.00 0.00 O ATOM 53478 H1 WAT 950 23.052 42.665 137.166 1.00 0.00 H ATOM 53479 H2 WAT 950 22.424 42.032 138.389 1.00 0.00 H TER 53481 WAT 950 ATOM 53481 O WAT 951 99.892 76.184 4.092 1.00 0.00 O ATOM 53482 H1 WAT 951 99.679 76.122 5.023 1.00 0.00 H ATOM 53483 H2 WAT 951 99.126 75.823 3.646 1.00 0.00 H TER 53485 WAT 951 ATOM 53485 O WAT 952 44.779 106.349 121.380 1.00 0.00 O ATOM 53486 H1 WAT 952 44.112 106.480 120.706 1.00 0.00 H ATOM 53487 H2 WAT 952 45.496 106.929 121.123 1.00 0.00 H TER 53489 WAT 952 ATOM 53489 O WAT 953 131.169 107.753 144.050 1.00 0.00 O ATOM 53490 H1 WAT 953 132.020 108.192 144.068 1.00 0.00 H ATOM 53491 H2 WAT 953 130.621 108.316 143.504 1.00 0.00 H TER 53493 WAT 953 ATOM 53493 O WAT 954 29.367 79.645 15.036 1.00 0.00 O ATOM 53494 H1 WAT 954 29.152 80.562 15.206 1.00 0.00 H ATOM 53495 H2 WAT 954 30.112 79.681 14.437 1.00 0.00 H TER 53497 WAT 954 ATOM 53497 O WAT 955 81.015 33.998 60.393 1.00 0.00 O ATOM 53498 H1 WAT 955 81.815 34.520 60.325 1.00 0.00 H ATOM 53499 H2 WAT 955 80.569 34.344 61.166 1.00 0.00 H TER 53501 WAT 955 ATOM 53501 O WAT 956 34.474 40.428 76.485 1.00 0.00 O ATOM 53502 H1 WAT 956 34.588 40.536 75.541 1.00 0.00 H ATOM 53503 H2 WAT 956 33.699 39.873 76.571 1.00 0.00 H TER 53505 WAT 956 ATOM 53505 O WAT 957 141.621 1.531 90.304 1.00 0.00 O ATOM 53506 H1 WAT 957 140.792 1.988 90.166 1.00 0.00 H ATOM 53507 H2 WAT 957 141.713 1.483 91.256 1.00 0.00 H TER 53509 WAT 957 ATOM 53509 O WAT 958 5.405 116.092 14.831 1.00 0.00 O ATOM 53510 H1 WAT 958 5.082 115.601 15.587 1.00 0.00 H ATOM 53511 H2 WAT 958 4.794 116.824 14.743 1.00 0.00 H TER 53513 WAT 958 ATOM 53513 O WAT 959 94.847 134.769 20.975 1.00 0.00 O ATOM 53514 H1 WAT 959 94.036 135.239 20.780 1.00 0.00 H ATOM 53515 H2 WAT 959 94.606 134.155 21.669 1.00 0.00 H TER 53517 WAT 959 ATOM 53517 O WAT 960 91.470 21.878 78.811 1.00 0.00 O ATOM 53518 H1 WAT 960 92.220 21.597 78.288 1.00 0.00 H ATOM 53519 H2 WAT 960 91.284 21.134 79.383 1.00 0.00 H TER 53521 WAT 960 ATOM 53521 O WAT 961 90.347 55.653 72.833 1.00 0.00 O ATOM 53522 H1 WAT 961 90.247 56.122 72.004 1.00 0.00 H ATOM 53523 H2 WAT 961 89.678 56.031 73.403 1.00 0.00 H TER 53525 WAT 961 ATOM 53525 O WAT 962 130.146 93.697 67.089 1.00 0.00 O ATOM 53526 H1 WAT 962 129.928 92.783 66.908 1.00 0.00 H ATOM 53527 H2 WAT 962 130.843 93.651 67.743 1.00 0.00 H TER 53529 WAT 962 ATOM 53529 O WAT 963 42.218 138.954 133.484 1.00 0.00 O ATOM 53530 H1 WAT 963 42.862 138.663 132.839 1.00 0.00 H ATOM 53531 H2 WAT 963 41.841 139.748 133.105 1.00 0.00 H TER 53533 WAT 963 ATOM 53533 O WAT 964 10.729 91.836 111.420 1.00 0.00 O ATOM 53534 H1 WAT 964 11.064 90.948 111.292 1.00 0.00 H ATOM 53535 H2 WAT 964 10.610 92.177 110.534 1.00 0.00 H TER 53537 WAT 964 ATOM 53537 O WAT 965 94.609 119.682 105.989 1.00 0.00 O ATOM 53538 H1 WAT 965 95.412 120.006 105.581 1.00 0.00 H ATOM 53539 H2 WAT 965 93.938 119.788 105.316 1.00 0.00 H TER 53541 WAT 965 ATOM 53541 O WAT 966 16.240 94.796 102.484 1.00 0.00 O ATOM 53542 H1 WAT 966 16.794 95.383 102.999 1.00 0.00 H ATOM 53543 H2 WAT 966 15.711 95.380 101.941 1.00 0.00 H TER 53545 WAT 966 ATOM 53545 O WAT 967 37.020 114.657 73.785 1.00 0.00 O ATOM 53546 H1 WAT 967 36.851 114.107 73.020 1.00 0.00 H ATOM 53547 H2 WAT 967 37.789 115.173 73.543 1.00 0.00 H TER 53549 WAT 967 ATOM 53549 O WAT 968 18.777 20.984 6.496 1.00 0.00 O ATOM 53550 H1 WAT 968 19.656 20.784 6.818 1.00 0.00 H ATOM 53551 H2 WAT 968 18.271 20.191 6.674 1.00 0.00 H TER 53553 WAT 968 ATOM 53553 O WAT 969 115.291 125.039 60.309 1.00 0.00 O ATOM 53554 H1 WAT 969 115.985 125.393 59.754 1.00 0.00 H ATOM 53555 H2 WAT 969 114.790 124.465 59.730 1.00 0.00 H TER 53557 WAT 969 ATOM 53557 O WAT 970 12.211 53.575 12.066 1.00 0.00 O ATOM 53558 H1 WAT 970 12.812 53.781 12.782 1.00 0.00 H ATOM 53559 H2 WAT 970 12.240 54.346 11.499 1.00 0.00 H TER 53561 WAT 970 ATOM 53561 O WAT 971 40.986 100.387 135.225 1.00 0.00 O ATOM 53562 H1 WAT 971 40.367 100.900 134.706 1.00 0.00 H ATOM 53563 H2 WAT 971 41.771 100.334 134.679 1.00 0.00 H TER 53565 WAT 971 ATOM 53565 O WAT 972 126.731 15.819 145.575 1.00 0.00 O ATOM 53566 H1 WAT 972 127.357 16.073 146.253 1.00 0.00 H ATOM 53567 H2 WAT 972 127.170 16.034 144.752 1.00 0.00 H TER 53569 WAT 972 ATOM 53569 O WAT 973 89.330 92.435 6.869 1.00 0.00 O ATOM 53570 H1 WAT 973 89.293 92.413 7.825 1.00 0.00 H ATOM 53571 H2 WAT 973 90.258 92.323 6.663 1.00 0.00 H TER 53573 WAT 973 ATOM 53573 O WAT 974 48.474 20.650 71.878 1.00 0.00 O ATOM 53574 H1 WAT 974 48.837 21.095 71.113 1.00 0.00 H ATOM 53575 H2 WAT 974 47.598 20.379 71.604 1.00 0.00 H TER 53577 WAT 974 ATOM 53577 O WAT 975 58.025 129.793 17.009 1.00 0.00 O ATOM 53578 H1 WAT 975 58.110 130.611 16.518 1.00 0.00 H ATOM 53579 H2 WAT 975 57.088 129.718 17.189 1.00 0.00 H TER 53581 WAT 975 ATOM 53581 O WAT 976 105.549 72.782 105.690 1.00 0.00 O ATOM 53582 H1 WAT 976 105.944 73.066 104.866 1.00 0.00 H ATOM 53583 H2 WAT 976 105.919 71.913 105.846 1.00 0.00 H TER 53585 WAT 976 ATOM 53585 O WAT 977 123.509 123.236 150.466 1.00 0.00 O ATOM 53586 H1 WAT 977 123.569 123.844 151.203 1.00 0.00 H ATOM 53587 H2 WAT 977 124.269 123.444 149.922 1.00 0.00 H TER 53589 WAT 977 ATOM 53589 O WAT 978 84.142 98.885 66.958 1.00 0.00 O ATOM 53590 H1 WAT 978 84.016 99.810 66.747 1.00 0.00 H ATOM 53591 H2 WAT 978 83.322 98.466 66.697 1.00 0.00 H TER 53593 WAT 978 ATOM 53593 O WAT 979 101.724 113.168 8.952 1.00 0.00 O ATOM 53594 H1 WAT 979 102.437 113.805 8.895 1.00 0.00 H ATOM 53595 H2 WAT 979 101.710 112.906 9.872 1.00 0.00 H TER 53597 WAT 979 ATOM 53597 O WAT 980 51.475 46.672 140.644 1.00 0.00 O ATOM 53598 H1 WAT 980 50.794 46.845 141.295 1.00 0.00 H ATOM 53599 H2 WAT 980 51.244 47.231 139.902 1.00 0.00 H TER 53601 WAT 980 ATOM 53601 O WAT 981 30.765 19.562 4.654 1.00 0.00 O ATOM 53602 H1 WAT 981 30.195 18.798 4.566 1.00 0.00 H ATOM 53603 H2 WAT 981 31.645 19.225 4.488 1.00 0.00 H TER 53605 WAT 981 ATOM 53605 O WAT 982 84.061 104.745 85.935 1.00 0.00 O ATOM 53606 H1 WAT 982 83.420 105.445 85.806 1.00 0.00 H ATOM 53607 H2 WAT 982 83.735 104.258 86.691 1.00 0.00 H TER 53609 WAT 982 ATOM 53609 O WAT 983 26.111 35.532 130.391 1.00 0.00 O ATOM 53610 H1 WAT 983 25.286 35.627 130.866 1.00 0.00 H ATOM 53611 H2 WAT 983 26.786 35.708 131.046 1.00 0.00 H TER 53613 WAT 983 ATOM 53613 O WAT 984 7.285 139.231 89.378 1.00 0.00 O ATOM 53614 H1 WAT 984 7.133 138.946 88.477 1.00 0.00 H ATOM 53615 H2 WAT 984 7.039 140.156 89.380 1.00 0.00 H TER 53617 WAT 984 ATOM 53617 O WAT 985 97.802 132.953 94.629 1.00 0.00 O ATOM 53618 H1 WAT 985 97.617 133.870 94.832 1.00 0.00 H ATOM 53619 H2 WAT 985 97.040 132.477 94.956 1.00 0.00 H TER 53621 WAT 985 ATOM 53621 O WAT 986 4.441 88.033 131.340 1.00 0.00 O ATOM 53622 H1 WAT 986 4.580 88.978 131.271 1.00 0.00 H ATOM 53623 H2 WAT 986 4.940 87.663 130.612 1.00 0.00 H TER 53625 WAT 986 ATOM 53625 O WAT 987 17.264 115.383 71.387 1.00 0.00 O ATOM 53626 H1 WAT 987 16.804 115.470 70.552 1.00 0.00 H ATOM 53627 H2 WAT 987 17.089 116.206 71.843 1.00 0.00 H TER 53629 WAT 987 ATOM 53629 O WAT 988 72.328 24.726 17.112 1.00 0.00 O ATOM 53630 H1 WAT 988 73.082 24.137 17.083 1.00 0.00 H ATOM 53631 H2 WAT 988 71.874 24.494 17.922 1.00 0.00 H TER 53633 WAT 988 ATOM 53633 O WAT 989 58.040 44.542 139.672 1.00 0.00 O ATOM 53634 H1 WAT 989 57.597 44.137 138.927 1.00 0.00 H ATOM 53635 H2 WAT 989 58.668 43.881 139.966 1.00 0.00 H TER 53637 WAT 989 ATOM 53637 O WAT 990 57.643 25.195 60.417 1.00 0.00 O ATOM 53638 H1 WAT 990 57.534 24.574 61.137 1.00 0.00 H ATOM 53639 H2 WAT 990 56.767 25.552 60.273 1.00 0.00 H TER 53641 WAT 990 ATOM 53641 O WAT 991 136.138 0.993 90.273 1.00 0.00 O ATOM 53642 H1 WAT 991 136.404 0.525 91.064 1.00 0.00 H ATOM 53643 H2 WAT 991 136.293 0.371 89.562 1.00 0.00 H TER 53645 WAT 991 ATOM 53645 O WAT 992 48.276 88.913 62.252 1.00 0.00 O ATOM 53646 H1 WAT 992 47.890 89.538 61.638 1.00 0.00 H ATOM 53647 H2 WAT 992 49.133 89.283 62.464 1.00 0.00 H TER 53649 WAT 992 ATOM 53649 O WAT 993 129.387 106.821 19.613 1.00 0.00 O ATOM 53650 H1 WAT 993 129.006 106.716 18.741 1.00 0.00 H ATOM 53651 H2 WAT 993 128.687 106.565 20.213 1.00 0.00 H TER 53653 WAT 993 ATOM 53653 O WAT 994 89.844 101.619 133.959 1.00 0.00 O ATOM 53654 H1 WAT 994 90.388 102.238 134.447 1.00 0.00 H ATOM 53655 H2 WAT 994 90.161 100.757 134.229 1.00 0.00 H TER 53657 WAT 994 ATOM 53657 O WAT 995 7.768 100.699 101.414 1.00 0.00 O ATOM 53658 H1 WAT 995 8.254 101.479 101.681 1.00 0.00 H ATOM 53659 H2 WAT 995 6.979 100.711 101.957 1.00 0.00 H TER 53661 WAT 995 ATOM 53661 O WAT 996 96.712 46.883 131.728 1.00 0.00 O ATOM 53662 H1 WAT 996 96.432 47.723 132.092 1.00 0.00 H ATOM 53663 H2 WAT 996 96.043 46.669 131.077 1.00 0.00 H TER 53665 WAT 996 ATOM 53665 O WAT 997 135.971 53.049 1.005 1.00 0.00 O ATOM 53666 H1 WAT 997 135.908 52.198 0.572 1.00 0.00 H ATOM 53667 H2 WAT 997 135.899 52.849 1.938 1.00 0.00 H TER 53669 WAT 997 ATOM 53669 O WAT 998 53.668 109.771 148.597 1.00 0.00 O ATOM 53670 H1 WAT 998 53.897 108.906 148.937 1.00 0.00 H ATOM 53671 H2 WAT 998 53.823 109.706 147.655 1.00 0.00 H TER 53673 WAT 998 ATOM 53673 O WAT 999 21.180 34.159 153.498 1.00 0.00 O ATOM 53674 H1 WAT 999 21.799 34.025 154.216 1.00 0.00 H ATOM 53675 H2 WAT 999 20.627 34.884 153.792 1.00 0.00 H TER 53677 WAT 999 ATOM 53677 O WAT 1000 31.005 96.903 136.417 1.00 0.00 O ATOM 53678 H1 WAT 1000 31.288 97.348 135.618 1.00 0.00 H ATOM 53679 H2 WAT 1000 30.962 95.979 136.173 1.00 0.00 H TER 53681 WAT 1000 ATOM 53681 O WAT 1001 60.638 36.876 9.397 1.00 0.00 O ATOM 53682 H1 WAT 1001 60.147 36.845 8.576 1.00 0.00 H ATOM 53683 H2 WAT 1001 61.553 36.773 9.133 1.00 0.00 H TER 53685 WAT 1001 ATOM 53685 O WAT 1002 124.360 12.395 52.885 1.00 0.00 O ATOM 53686 H1 WAT 1002 123.604 11.826 52.742 1.00 0.00 H ATOM 53687 H2 WAT 1002 124.839 11.981 53.602 1.00 0.00 H TER 53689 WAT 1002 ATOM 53689 O WAT 1003 60.864 81.871 117.364 1.00 0.00 O ATOM 53690 H1 WAT 1003 60.222 81.357 116.875 1.00 0.00 H ATOM 53691 H2 WAT 1003 60.488 81.953 118.241 1.00 0.00 H TER 53693 WAT 1003 ATOM 53693 O WAT 1004 43.496 98.128 62.565 1.00 0.00 O ATOM 53694 H1 WAT 1004 44.439 98.017 62.441 1.00 0.00 H ATOM 53695 H2 WAT 1004 43.338 97.844 63.465 1.00 0.00 H TER 53697 WAT 1004 ATOM 53697 O WAT 1005 44.751 98.189 120.956 1.00 0.00 O ATOM 53698 H1 WAT 1005 45.220 98.048 120.134 1.00 0.00 H ATOM 53699 H2 WAT 1005 44.612 97.309 121.307 1.00 0.00 H TER 53701 WAT 1005 ATOM 53701 O WAT 1006 25.268 123.240 121.013 1.00 0.00 O ATOM 53702 H1 WAT 1006 26.074 123.718 121.211 1.00 0.00 H ATOM 53703 H2 WAT 1006 24.676 123.906 120.662 1.00 0.00 H TER 53705 WAT 1006 ATOM 53705 O WAT 1007 93.323 85.892 19.126 1.00 0.00 O ATOM 53706 H1 WAT 1007 93.880 85.923 19.904 1.00 0.00 H ATOM 53707 H2 WAT 1007 92.923 85.023 19.152 1.00 0.00 H TER 53709 WAT 1007 ATOM 53709 O WAT 1008 106.190 50.163 16.827 1.00 0.00 O ATOM 53710 H1 WAT 1008 106.687 50.856 17.262 1.00 0.00 H ATOM 53711 H2 WAT 1008 106.858 49.586 16.457 1.00 0.00 H TER 53713 WAT 1008 ATOM 53713 O WAT 1009 116.860 49.671 158.864 1.00 0.00 O ATOM 53714 H1 WAT 1009 116.431 48.847 158.632 1.00 0.00 H ATOM 53715 H2 WAT 1009 116.246 50.349 158.581 1.00 0.00 H TER 53717 WAT 1009 ATOM 53717 O WAT 1010 103.772 27.580 154.232 1.00 0.00 O ATOM 53718 H1 WAT 1010 104.648 27.844 153.950 1.00 0.00 H ATOM 53719 H2 WAT 1010 103.758 27.762 155.171 1.00 0.00 H TER 53721 WAT 1010 ATOM 53721 O WAT 1011 127.650 115.647 22.451 1.00 0.00 O ATOM 53722 H1 WAT 1011 127.555 114.819 22.922 1.00 0.00 H ATOM 53723 H2 WAT 1011 126.861 115.709 21.913 1.00 0.00 H TER 53725 WAT 1011 ATOM 53725 O WAT 1012 135.821 54.918 63.916 1.00 0.00 O ATOM 53726 H1 WAT 1012 134.926 55.096 63.627 1.00 0.00 H ATOM 53727 H2 WAT 1012 136.294 55.732 63.743 1.00 0.00 H TER 53729 WAT 1012 ATOM 53729 O WAT 1013 83.393 140.200 131.894 1.00 0.00 O ATOM 53730 H1 WAT 1013 83.160 140.641 131.077 1.00 0.00 H ATOM 53731 H2 WAT 1013 84.186 140.647 132.190 1.00 0.00 H TER 53733 WAT 1013 ATOM 53733 O WAT 1014 12.411 22.815 2.881 1.00 0.00 O ATOM 53734 H1 WAT 1014 12.920 23.100 2.123 1.00 0.00 H ATOM 53735 H2 WAT 1014 11.520 22.709 2.546 1.00 0.00 H TER 53737 WAT 1014 ATOM 53737 O WAT 1015 2.268 41.692 108.564 1.00 0.00 O ATOM 53738 H1 WAT 1015 2.689 41.676 109.423 1.00 0.00 H ATOM 53739 H2 WAT 1015 2.372 42.595 108.263 1.00 0.00 H TER 53741 WAT 1015 ATOM 53741 O WAT 1016 127.523 136.584 82.284 1.00 0.00 O ATOM 53742 H1 WAT 1016 128.430 136.688 82.000 1.00 0.00 H ATOM 53743 H2 WAT 1016 127.371 137.320 82.877 1.00 0.00 H TER 53745 WAT 1016 ATOM 53745 O WAT 1017 21.118 16.302 66.927 1.00 0.00 O ATOM 53746 H1 WAT 1017 20.457 15.859 66.395 1.00 0.00 H ATOM 53747 H2 WAT 1017 21.812 15.651 67.037 1.00 0.00 H TER 53749 WAT 1017 ATOM 53749 O WAT 1018 18.236 15.248 121.861 1.00 0.00 O ATOM 53750 H1 WAT 1018 18.228 14.816 121.007 1.00 0.00 H ATOM 53751 H2 WAT 1018 17.479 14.884 122.320 1.00 0.00 H TER 53753 WAT 1018 ATOM 53753 O WAT 1019 60.299 106.527 134.825 1.00 0.00 O ATOM 53754 H1 WAT 1019 60.201 107.183 134.135 1.00 0.00 H ATOM 53755 H2 WAT 1019 61.114 106.073 134.610 1.00 0.00 H TER 53757 WAT 1019 ATOM 53757 O WAT 1020 83.161 53.715 111.247 1.00 0.00 O ATOM 53758 H1 WAT 1020 83.469 53.407 110.395 1.00 0.00 H ATOM 53759 H2 WAT 1020 83.154 52.931 111.797 1.00 0.00 H TER 53761 WAT 1020 ATOM 53761 O WAT 1021 21.957 86.882 78.079 1.00 0.00 O ATOM 53762 H1 WAT 1021 22.032 86.295 77.327 1.00 0.00 H ATOM 53763 H2 WAT 1021 22.745 87.423 78.041 1.00 0.00 H TER 53765 WAT 1021 ATOM 53765 O WAT 1022 25.437 28.476 105.626 1.00 0.00 O ATOM 53766 H1 WAT 1022 25.464 29.396 105.361 1.00 0.00 H ATOM 53767 H2 WAT 1022 26.351 28.249 105.796 1.00 0.00 H TER 53769 WAT 1022 ATOM 53769 O WAT 1023 58.498 127.457 83.195 1.00 0.00 O ATOM 53770 H1 WAT 1023 58.992 126.642 83.280 1.00 0.00 H ATOM 53771 H2 WAT 1023 58.564 127.868 84.058 1.00 0.00 H TER 53773 WAT 1023 ATOM 53773 O WAT 1024 108.100 136.551 141.631 1.00 0.00 O ATOM 53774 H1 WAT 1024 107.546 135.798 141.837 1.00 0.00 H ATOM 53775 H2 WAT 1024 108.474 136.811 142.472 1.00 0.00 H TER 53777 WAT 1024 ATOM 53777 O WAT 1025 92.722 69.614 118.615 1.00 0.00 O ATOM 53778 H1 WAT 1025 92.788 70.014 119.482 1.00 0.00 H ATOM 53779 H2 WAT 1025 91.861 69.882 118.293 1.00 0.00 H TER 53781 WAT 1025 ATOM 53781 O WAT 1026 13.967 2.653 107.497 1.00 0.00 O ATOM 53782 H1 WAT 1026 13.752 2.349 108.379 1.00 0.00 H ATOM 53783 H2 WAT 1026 14.241 1.863 107.031 1.00 0.00 H TER 53785 WAT 1026 ATOM 53785 O WAT 1027 119.580 80.879 76.935 1.00 0.00 O ATOM 53786 H1 WAT 1027 119.794 80.145 77.512 1.00 0.00 H ATOM 53787 H2 WAT 1027 118.881 80.545 76.373 1.00 0.00 H TER 53789 WAT 1027 ATOM 53789 O WAT 1028 67.724 87.972 93.592 1.00 0.00 O ATOM 53790 H1 WAT 1028 68.004 88.027 94.506 1.00 0.00 H ATOM 53791 H2 WAT 1028 66.875 88.414 93.575 1.00 0.00 H TER 53793 WAT 1028 ATOM 53793 O WAT 1029 31.493 86.473 96.437 1.00 0.00 O ATOM 53794 H1 WAT 1029 32.384 86.280 96.145 1.00 0.00 H ATOM 53795 H2 WAT 1029 31.080 85.614 96.530 1.00 0.00 H TER 53797 WAT 1029 ATOM 53797 O WAT 1030 19.984 126.190 110.304 1.00 0.00 O ATOM 53798 H1 WAT 1030 19.063 126.077 110.539 1.00 0.00 H ATOM 53799 H2 WAT 1030 20.092 125.675 109.505 1.00 0.00 H TER 53801 WAT 1030 ATOM 53801 O WAT 1031 140.261 110.109 69.496 1.00 0.00 O ATOM 53802 H1 WAT 1031 139.962 110.821 68.930 1.00 0.00 H ATOM 53803 H2 WAT 1031 139.941 110.345 70.367 1.00 0.00 H TER 53805 WAT 1031 ATOM 53805 O WAT 1032 50.253 60.718 66.271 1.00 0.00 O ATOM 53806 H1 WAT 1032 49.604 61.210 65.767 1.00 0.00 H ATOM 53807 H2 WAT 1032 49.754 60.328 66.988 1.00 0.00 H TER 53809 WAT 1032 ATOM 53809 O WAT 1033 7.347 131.431 16.306 1.00 0.00 O ATOM 53810 H1 WAT 1033 8.136 131.504 15.769 1.00 0.00 H ATOM 53811 H2 WAT 1033 7.675 131.294 17.195 1.00 0.00 H TER 53813 WAT 1033 ATOM 53813 O WAT 1034 97.714 55.195 100.288 1.00 0.00 O ATOM 53814 H1 WAT 1034 97.159 55.795 100.786 1.00 0.00 H ATOM 53815 H2 WAT 1034 97.266 54.351 100.343 1.00 0.00 H TER 53817 WAT 1034 ATOM 53817 O WAT 1035 132.322 117.358 21.256 1.00 0.00 O ATOM 53818 H1 WAT 1035 132.625 117.430 22.161 1.00 0.00 H ATOM 53819 H2 WAT 1035 133.016 116.873 20.809 1.00 0.00 H TER 53821 WAT 1035 ATOM 53821 O WAT 1036 16.584 90.786 5.720 1.00 0.00 O ATOM 53822 H1 WAT 1036 16.096 90.739 6.541 1.00 0.00 H ATOM 53823 H2 WAT 1036 15.974 91.187 5.101 1.00 0.00 H TER 53825 WAT 1036 ATOM 53825 O WAT 1037 95.847 0.758 67.581 1.00 0.00 O ATOM 53826 H1 WAT 1037 95.561 -0.141 67.743 1.00 0.00 H ATOM 53827 H2 WAT 1037 95.803 1.181 68.439 1.00 0.00 H TER 53829 WAT 1037 ATOM 53829 O WAT 1038 20.749 72.045 113.015 1.00 0.00 O ATOM 53830 H1 WAT 1038 21.666 71.845 112.827 1.00 0.00 H ATOM 53831 H2 WAT 1038 20.440 71.296 113.525 1.00 0.00 H TER 53833 WAT 1038 ATOM 53833 O WAT 1039 134.060 123.617 113.511 1.00 0.00 O ATOM 53834 H1 WAT 1039 134.337 124.498 113.761 1.00 0.00 H ATOM 53835 H2 WAT 1039 133.196 123.740 113.118 1.00 0.00 H TER 53837 WAT 1039 ATOM 53837 O WAT 1040 111.532 97.791 123.014 1.00 0.00 O ATOM 53838 H1 WAT 1040 111.348 97.311 123.822 1.00 0.00 H ATOM 53839 H2 WAT 1040 112.450 97.596 122.823 1.00 0.00 H TER 53841 WAT 1040 ATOM 53841 O WAT 1041 22.401 59.516 152.970 1.00 0.00 O ATOM 53842 H1 WAT 1041 22.874 60.338 153.096 1.00 0.00 H ATOM 53843 H2 WAT 1041 22.540 59.298 152.048 1.00 0.00 H TER 53845 WAT 1041 ATOM 53845 O WAT 1042 40.419 94.367 134.842 1.00 0.00 O ATOM 53846 H1 WAT 1042 40.721 93.492 135.087 1.00 0.00 H ATOM 53847 H2 WAT 1042 39.527 94.232 134.523 1.00 0.00 H TER 53849 WAT 1042 ATOM 53849 O WAT 1043 69.901 25.581 7.427 1.00 0.00 O ATOM 53850 H1 WAT 1043 70.338 26.320 7.851 1.00 0.00 H ATOM 53851 H2 WAT 1043 69.029 25.912 7.210 1.00 0.00 H TER 53853 WAT 1043 ATOM 53853 O WAT 1044 101.137 97.545 20.321 1.00 0.00 O ATOM 53854 H1 WAT 1044 101.977 97.988 20.200 1.00 0.00 H ATOM 53855 H2 WAT 1044 101.264 96.680 19.931 1.00 0.00 H TER 53857 WAT 1044 ATOM 53857 O WAT 1045 13.931 5.860 135.435 1.00 0.00 O ATOM 53858 H1 WAT 1045 13.192 5.853 134.827 1.00 0.00 H ATOM 53859 H2 WAT 1045 13.995 4.956 135.745 1.00 0.00 H TER 53861 WAT 1045 ATOM 53861 O WAT 1046 108.830 118.807 133.510 1.00 0.00 O ATOM 53862 H1 WAT 1046 108.035 119.140 133.092 1.00 0.00 H ATOM 53863 H2 WAT 1046 108.604 118.744 134.438 1.00 0.00 H TER 53865 WAT 1046 ATOM 53865 O WAT 1047 1.245 73.199 10.566 1.00 0.00 O ATOM 53866 H1 WAT 1047 1.246 73.461 11.486 1.00 0.00 H ATOM 53867 H2 WAT 1047 2.037 72.670 10.466 1.00 0.00 H TER 53869 WAT 1047 ATOM 53869 O WAT 1048 75.007 29.364 126.057 1.00 0.00 O ATOM 53870 H1 WAT 1048 74.633 28.626 125.576 1.00 0.00 H ATOM 53871 H2 WAT 1048 75.240 29.000 126.911 1.00 0.00 H TER 53873 WAT 1048 ATOM 53873 O WAT 1049 95.082 70.189 70.046 1.00 0.00 O ATOM 53874 H1 WAT 1049 95.769 70.503 69.458 1.00 0.00 H ATOM 53875 H2 WAT 1049 95.246 69.249 70.126 1.00 0.00 H TER 53877 WAT 1049 ATOM 53877 O WAT 1050 34.054 1.851 15.511 1.00 0.00 O ATOM 53878 H1 WAT 1050 33.901 1.031 15.041 1.00 0.00 H ATOM 53879 H2 WAT 1050 33.989 2.529 14.839 1.00 0.00 H TER 53881 WAT 1050 ATOM 53881 O WAT 1051 102.302 117.510 18.759 1.00 0.00 O ATOM 53882 H1 WAT 1051 101.552 117.102 19.193 1.00 0.00 H ATOM 53883 H2 WAT 1051 102.964 117.584 19.445 1.00 0.00 H TER 53885 WAT 1051 ATOM 53885 O WAT 1052 127.867 10.456 91.743 1.00 0.00 O ATOM 53886 H1 WAT 1052 127.624 10.536 92.666 1.00 0.00 H ATOM 53887 H2 WAT 1052 127.121 10.014 91.337 1.00 0.00 H TER 53889 WAT 1052 ATOM 53889 O WAT 1053 41.524 138.298 146.534 1.00 0.00 O ATOM 53890 H1 WAT 1053 40.780 138.654 146.047 1.00 0.00 H ATOM 53891 H2 WAT 1053 41.550 137.374 146.289 1.00 0.00 H TER 53893 WAT 1053 ATOM 53893 O WAT 1054 88.843 11.376 122.596 1.00 0.00 O ATOM 53894 H1 WAT 1054 88.517 12.142 123.068 1.00 0.00 H ATOM 53895 H2 WAT 1054 88.772 10.659 123.225 1.00 0.00 H TER 53897 WAT 1054 ATOM 53897 O WAT 1055 17.275 43.728 158.098 1.00 0.00 O ATOM 53898 H1 WAT 1055 18.213 43.906 158.025 1.00 0.00 H ATOM 53899 H2 WAT 1055 17.222 42.923 158.612 1.00 0.00 H TER 53901 WAT 1055 ATOM 53901 O WAT 1056 58.839 94.706 123.714 1.00 0.00 O ATOM 53902 H1 WAT 1056 59.130 94.994 124.580 1.00 0.00 H ATOM 53903 H2 WAT 1056 59.559 94.942 123.129 1.00 0.00 H TER 53905 WAT 1056 ATOM 53905 O WAT 1057 63.673 119.481 83.638 1.00 0.00 O ATOM 53906 H1 WAT 1057 64.459 119.892 83.996 1.00 0.00 H ATOM 53907 H2 WAT 1057 64.003 118.773 83.085 1.00 0.00 H TER 53909 WAT 1057 ATOM 53909 O WAT 1058 115.348 21.605 124.585 1.00 0.00 O ATOM 53910 H1 WAT 1058 114.497 21.650 125.020 1.00 0.00 H ATOM 53911 H2 WAT 1058 115.443 22.455 124.154 1.00 0.00 H TER 53913 WAT 1058 ATOM 53913 O WAT 1059 45.410 6.154 134.346 1.00 0.00 O ATOM 53914 H1 WAT 1059 45.341 6.883 133.730 1.00 0.00 H ATOM 53915 H2 WAT 1059 45.094 5.395 133.855 1.00 0.00 H TER 53917 WAT 1059 ATOM 53917 O WAT 1060 100.081 22.648 104.262 1.00 0.00 O ATOM 53918 H1 WAT 1060 100.070 23.356 103.618 1.00 0.00 H ATOM 53919 H2 WAT 1060 99.915 21.856 103.749 1.00 0.00 H TER 53921 WAT 1060 ATOM 53921 O WAT 1061 3.750 88.804 106.121 1.00 0.00 O ATOM 53922 H1 WAT 1061 4.184 88.581 105.298 1.00 0.00 H ATOM 53923 H2 WAT 1061 4.289 89.501 106.495 1.00 0.00 H TER 53925 WAT 1061 ATOM 53925 O WAT 1062 70.706 54.417 85.848 1.00 0.00 O ATOM 53926 H1 WAT 1062 71.471 54.397 86.422 1.00 0.00 H ATOM 53927 H2 WAT 1062 70.994 54.912 85.082 1.00 0.00 H TER 53929 WAT 1062 ATOM 53929 O WAT 1063 77.872 106.099 96.211 1.00 0.00 O ATOM 53930 H1 WAT 1063 76.928 106.021 96.348 1.00 0.00 H ATOM 53931 H2 WAT 1063 77.969 106.861 95.639 1.00 0.00 H TER 53933 WAT 1063 ATOM 53933 O WAT 1064 4.550 109.696 145.286 1.00 0.00 O ATOM 53934 H1 WAT 1064 4.896 109.446 146.143 1.00 0.00 H ATOM 53935 H2 WAT 1064 3.618 109.853 145.441 1.00 0.00 H TER 53937 WAT 1064 ATOM 53937 O WAT 1065 53.869 81.403 11.299 1.00 0.00 O ATOM 53938 H1 WAT 1065 53.153 81.233 11.911 1.00 0.00 H ATOM 53939 H2 WAT 1065 54.608 81.645 11.858 1.00 0.00 H TER 53941 WAT 1065 ATOM 53941 O WAT 1066 18.452 131.752 131.245 1.00 0.00 O ATOM 53942 H1 WAT 1066 19.128 131.116 131.013 1.00 0.00 H ATOM 53943 H2 WAT 1066 18.938 132.516 131.555 1.00 0.00 H TER 53945 WAT 1066 ATOM 53945 O WAT 1067 100.836 82.094 70.130 1.00 0.00 O ATOM 53946 H1 WAT 1067 101.584 82.604 69.818 1.00 0.00 H ATOM 53947 H2 WAT 1067 101.152 81.669 70.927 1.00 0.00 H TER 53949 WAT 1067 ATOM 53949 O WAT 1068 89.415 51.517 79.606 1.00 0.00 O ATOM 53950 H1 WAT 1068 88.868 52.299 79.682 1.00 0.00 H ATOM 53951 H2 WAT 1068 89.150 50.967 80.343 1.00 0.00 H TER 53953 WAT 1068 ATOM 53953 O WAT 1069 93.748 69.167 0.554 1.00 0.00 O ATOM 53954 H1 WAT 1069 92.828 69.363 0.374 1.00 0.00 H ATOM 53955 H2 WAT 1069 93.745 68.258 0.851 1.00 0.00 H TER 53957 WAT 1069 ATOM 53957 O WAT 1070 51.221 67.794 17.120 1.00 0.00 O ATOM 53958 H1 WAT 1070 51.879 68.482 17.227 1.00 0.00 H ATOM 53959 H2 WAT 1070 50.903 67.904 16.224 1.00 0.00 H TER 53961 WAT 1070 ATOM 53961 O WAT 1071 133.662 81.150 103.216 1.00 0.00 O ATOM 53962 H1 WAT 1071 134.550 81.415 103.457 1.00 0.00 H ATOM 53963 H2 WAT 1071 133.186 81.124 104.045 1.00 0.00 H TER 53965 WAT 1071 ATOM 53965 O WAT 1072 45.456 75.116 105.815 1.00 0.00 O ATOM 53966 H1 WAT 1072 46.222 75.484 106.255 1.00 0.00 H ATOM 53967 H2 WAT 1072 45.054 75.863 105.370 1.00 0.00 H TER 53969 WAT 1072 ATOM 53969 O WAT 1073 120.154 103.359 105.767 1.00 0.00 O ATOM 53970 H1 WAT 1073 119.739 102.514 105.595 1.00 0.00 H ATOM 53971 H2 WAT 1073 119.934 103.553 106.678 1.00 0.00 H TER 53973 WAT 1073 ATOM 53973 O WAT 1074 9.020 138.003 1.547 1.00 0.00 O ATOM 53974 H1 WAT 1074 8.225 138.229 1.063 1.00 0.00 H ATOM 53975 H2 WAT 1074 9.195 138.771 2.091 1.00 0.00 H TER 53977 WAT 1074 ATOM 53977 O WAT 1075 133.132 41.123 97.314 1.00 0.00 O ATOM 53978 H1 WAT 1075 132.490 41.754 96.988 1.00 0.00 H ATOM 53979 H2 WAT 1075 132.720 40.270 97.177 1.00 0.00 H TER 53981 WAT 1075 ATOM 53981 O WAT 1076 79.490 142.929 100.411 1.00 0.00 O ATOM 53982 H1 WAT 1076 79.148 143.584 99.802 1.00 0.00 H ATOM 53983 H2 WAT 1076 78.768 142.312 100.528 1.00 0.00 H TER 53985 WAT 1076 ATOM 53985 O WAT 1077 84.698 112.486 121.033 1.00 0.00 O ATOM 53986 H1 WAT 1077 84.170 112.920 120.363 1.00 0.00 H ATOM 53987 H2 WAT 1077 85.549 112.921 120.986 1.00 0.00 H TER 53989 WAT 1077 ATOM 53989 O WAT 1078 123.642 72.590 154.423 1.00 0.00 O ATOM 53990 H1 WAT 1078 124.556 72.874 154.391 1.00 0.00 H ATOM 53991 H2 WAT 1078 123.137 73.402 154.371 1.00 0.00 H TER 53993 WAT 1078 ATOM 53993 O WAT 1079 121.180 38.746 76.618 1.00 0.00 O ATOM 53994 H1 WAT 1079 121.556 39.563 76.944 1.00 0.00 H ATOM 53995 H2 WAT 1079 120.451 38.564 77.212 1.00 0.00 H TER 53997 WAT 1079 ATOM 53997 O WAT 1080 0.800 71.785 144.309 1.00 0.00 O ATOM 53998 H1 WAT 1080 0.471 70.947 143.984 1.00 0.00 H ATOM 53999 H2 WAT 1080 0.031 72.356 144.321 1.00 0.00 H TER 54001 WAT 1080 ATOM 54001 O WAT 1081 34.383 94.245 66.296 1.00 0.00 O ATOM 54002 H1 WAT 1081 34.851 93.414 66.216 1.00 0.00 H ATOM 54003 H2 WAT 1081 35.074 94.905 66.352 1.00 0.00 H TER 54005 WAT 1081 ATOM 54005 O WAT 1082 44.984 106.923 80.709 1.00 0.00 O ATOM 54006 H1 WAT 1082 45.496 107.050 81.507 1.00 0.00 H ATOM 54007 H2 WAT 1082 44.756 107.809 80.426 1.00 0.00 H TER 54009 WAT 1082 ATOM 54009 O WAT 1083 3.659 13.203 70.002 1.00 0.00 O ATOM 54010 H1 WAT 1083 4.081 13.963 69.601 1.00 0.00 H ATOM 54011 H2 WAT 1083 4.243 12.471 69.800 1.00 0.00 H TER 54013 WAT 1083 ATOM 54013 O WAT 1084 30.209 43.714 71.309 1.00 0.00 O ATOM 54014 H1 WAT 1084 30.890 43.072 71.107 1.00 0.00 H ATOM 54015 H2 WAT 1084 30.394 43.984 72.209 1.00 0.00 H TER 54017 WAT 1084 ATOM 54017 O WAT 1085 116.483 111.450 11.793 1.00 0.00 O ATOM 54018 H1 WAT 1085 115.596 111.103 11.702 1.00 0.00 H ATOM 54019 H2 WAT 1085 116.389 112.390 11.641 1.00 0.00 H TER 54021 WAT 1085 ATOM 54021 O WAT 1086 134.133 113.349 64.124 1.00 0.00 O ATOM 54022 H1 WAT 1086 133.214 113.158 63.935 1.00 0.00 H ATOM 54023 H2 WAT 1086 134.593 113.133 63.313 1.00 0.00 H TER 54025 WAT 1086 ATOM 54025 O WAT 1087 138.817 35.188 147.672 1.00 0.00 O ATOM 54026 H1 WAT 1087 139.337 35.564 146.962 1.00 0.00 H ATOM 54027 H2 WAT 1087 138.310 35.925 148.013 1.00 0.00 H TER 54029 WAT 1087 ATOM 54029 O WAT 1088 25.794 101.384 24.076 1.00 0.00 O ATOM 54030 H1 WAT 1088 26.739 101.416 24.225 1.00 0.00 H ATOM 54031 H2 WAT 1088 25.427 101.969 24.740 1.00 0.00 H TER 54033 WAT 1088 ATOM 54033 O WAT 1089 124.570 106.993 80.268 1.00 0.00 O ATOM 54034 H1 WAT 1089 123.811 106.975 79.685 1.00 0.00 H ATOM 54035 H2 WAT 1089 124.557 106.141 80.704 1.00 0.00 H TER 54037 WAT 1089 ATOM 54037 O WAT 1090 79.737 99.617 29.743 1.00 0.00 O ATOM 54038 H1 WAT 1090 80.187 100.303 30.236 1.00 0.00 H ATOM 54039 H2 WAT 1090 80.271 99.496 28.958 1.00 0.00 H TER 54041 WAT 1090 ATOM 54041 O WAT 1091 136.465 106.273 152.490 1.00 0.00 O ATOM 54042 H1 WAT 1091 135.733 105.669 152.362 1.00 0.00 H ATOM 54043 H2 WAT 1091 136.453 106.831 151.712 1.00 0.00 H TER 54045 WAT 1091 ATOM 54045 O WAT 1092 5.510 2.411 12.184 1.00 0.00 O ATOM 54046 H1 WAT 1092 6.312 1.978 12.475 1.00 0.00 H ATOM 54047 H2 WAT 1092 5.242 2.947 12.930 1.00 0.00 H TER 54049 WAT 1092 ATOM 54049 O WAT 1093 3.957 89.163 15.781 1.00 0.00 O ATOM 54050 H1 WAT 1093 3.109 88.735 15.666 1.00 0.00 H ATOM 54051 H2 WAT 1093 4.402 88.638 16.446 1.00 0.00 H TER 54053 WAT 1093 ATOM 54053 O WAT 1094 48.846 126.717 151.707 1.00 0.00 O ATOM 54054 H1 WAT 1094 48.688 126.631 152.647 1.00 0.00 H ATOM 54055 H2 WAT 1094 49.541 127.371 151.639 1.00 0.00 H TER 54057 WAT 1094 ATOM 54057 O WAT 1095 62.195 53.829 2.077 1.00 0.00 O ATOM 54058 H1 WAT 1095 61.956 52.913 2.223 1.00 0.00 H ATOM 54059 H2 WAT 1095 61.572 54.326 2.608 1.00 0.00 H TER 54061 WAT 1095 ATOM 54061 O WAT 1096 24.521 26.505 115.953 1.00 0.00 O ATOM 54062 H1 WAT 1096 23.913 27.040 115.443 1.00 0.00 H ATOM 54063 H2 WAT 1096 24.543 26.923 116.814 1.00 0.00 H TER 54065 WAT 1096 ATOM 54065 O WAT 1097 10.664 37.020 147.658 1.00 0.00 O ATOM 54066 H1 WAT 1097 11.572 36.719 147.621 1.00 0.00 H ATOM 54067 H2 WAT 1097 10.680 37.755 148.271 1.00 0.00 H TER 54069 WAT 1097 ATOM 54069 O WAT 1098 120.100 2.965 98.967 1.00 0.00 O ATOM 54070 H1 WAT 1098 119.770 2.092 99.181 1.00 0.00 H ATOM 54071 H2 WAT 1098 119.854 3.505 99.717 1.00 0.00 H TER 54073 WAT 1098 ATOM 54073 O WAT 1099 132.956 60.910 5.991 1.00 0.00 O ATOM 54074 H1 WAT 1099 132.876 60.792 6.938 1.00 0.00 H ATOM 54075 H2 WAT 1099 132.715 60.059 5.623 1.00 0.00 H TER 54077 WAT 1099 ATOM 54077 O WAT 1100 126.601 113.549 117.848 1.00 0.00 O ATOM 54078 H1 WAT 1100 126.850 113.609 116.926 1.00 0.00 H ATOM 54079 H2 WAT 1100 125.840 112.968 117.853 1.00 0.00 H TER 54081 WAT 1100 ATOM 54081 O WAT 1101 98.033 67.062 129.684 1.00 0.00 O ATOM 54082 H1 WAT 1101 97.638 67.094 128.813 1.00 0.00 H ATOM 54083 H2 WAT 1101 97.305 66.855 130.270 1.00 0.00 H TER 54085 WAT 1101 ATOM 54085 O WAT 1102 124.274 54.106 76.781 1.00 0.00 O ATOM 54086 H1 WAT 1102 123.464 54.577 76.585 1.00 0.00 H ATOM 54087 H2 WAT 1102 124.738 54.068 75.945 1.00 0.00 H TER 54089 WAT 1102 ATOM 54089 O WAT 1103 22.715 133.989 15.725 1.00 0.00 O ATOM 54090 H1 WAT 1103 22.397 134.188 14.844 1.00 0.00 H ATOM 54091 H2 WAT 1103 22.815 134.844 16.142 1.00 0.00 H TER 54093 WAT 1103 ATOM 54093 O WAT 1104 9.529 80.285 26.558 1.00 0.00 O ATOM 54094 H1 WAT 1104 8.785 79.725 26.337 1.00 0.00 H ATOM 54095 H2 WAT 1104 10.046 80.326 25.754 1.00 0.00 H TER 54097 WAT 1104 ATOM 54097 O WAT 1105 126.065 103.042 99.174 1.00 0.00 O ATOM 54098 H1 WAT 1105 125.650 103.341 98.365 1.00 0.00 H ATOM 54099 H2 WAT 1105 126.166 102.097 99.057 1.00 0.00 H TER 54101 WAT 1105 ATOM 54101 O WAT 1106 81.241 91.379 157.823 1.00 0.00 O ATOM 54102 H1 WAT 1106 80.870 91.567 158.685 1.00 0.00 H ATOM 54103 H2 WAT 1106 80.801 90.576 157.543 1.00 0.00 H TER 54105 WAT 1106 ATOM 54105 O WAT 1107 78.297 92.050 74.432 1.00 0.00 O ATOM 54106 H1 WAT 1107 78.389 92.880 74.900 1.00 0.00 H ATOM 54107 H2 WAT 1107 78.619 92.236 73.550 1.00 0.00 H TER 54109 WAT 1107 ATOM 54109 O WAT 1108 4.966 100.166 98.345 1.00 0.00 O ATOM 54110 H1 WAT 1108 4.589 100.556 99.133 1.00 0.00 H ATOM 54111 H2 WAT 1108 5.557 99.488 98.673 1.00 0.00 H TER 54113 WAT 1108 ATOM 54113 O WAT 1109 126.604 92.531 112.001 1.00 0.00 O ATOM 54114 H1 WAT 1109 126.874 91.777 111.477 1.00 0.00 H ATOM 54115 H2 WAT 1109 126.216 93.136 111.369 1.00 0.00 H TER 54117 WAT 1109 ATOM 54117 O WAT 1110 19.551 18.685 124.183 1.00 0.00 O ATOM 54118 H1 WAT 1110 19.105 18.203 124.880 1.00 0.00 H ATOM 54119 H2 WAT 1110 20.223 18.081 123.866 1.00 0.00 H TER 54121 WAT 1110 ATOM 54121 O WAT 1111 26.047 69.975 147.966 1.00 0.00 O ATOM 54122 H1 WAT 1111 25.187 70.114 148.363 1.00 0.00 H ATOM 54123 H2 WAT 1111 25.906 69.277 147.327 1.00 0.00 H TER 54125 WAT 1111 ATOM 54125 O WAT 1112 15.427 4.276 104.997 1.00 0.00 O ATOM 54126 H1 WAT 1112 16.044 3.556 104.859 1.00 0.00 H ATOM 54127 H2 WAT 1112 14.593 3.944 104.666 1.00 0.00 H TER 54129 WAT 1112 ATOM 54129 O WAT 1113 53.481 73.449 143.698 1.00 0.00 O ATOM 54130 H1 WAT 1113 53.708 73.424 144.628 1.00 0.00 H ATOM 54131 H2 WAT 1113 54.324 73.426 143.245 1.00 0.00 H TER 54133 WAT 1113 ATOM 54133 O WAT 1114 54.106 63.574 88.944 1.00 0.00 O ATOM 54134 H1 WAT 1114 54.104 64.151 88.180 1.00 0.00 H ATOM 54135 H2 WAT 1114 53.340 63.843 89.450 1.00 0.00 H TER 54137 WAT 1114 ATOM 54137 O WAT 1115 53.453 99.215 121.304 1.00 0.00 O ATOM 54138 H1 WAT 1115 53.240 98.566 121.974 1.00 0.00 H ATOM 54139 H2 WAT 1115 54.410 99.226 121.277 1.00 0.00 H TER 54141 WAT 1115 ATOM 54141 O WAT 1116 111.435 64.437 122.077 1.00 0.00 O ATOM 54142 H1 WAT 1116 112.347 64.397 122.363 1.00 0.00 H ATOM 54143 H2 WAT 1116 111.418 65.139 121.426 1.00 0.00 H TER 54145 WAT 1116 ATOM 54145 O WAT 1117 132.360 66.318 54.918 1.00 0.00 O ATOM 54146 H1 WAT 1117 132.967 66.616 55.595 1.00 0.00 H ATOM 54147 H2 WAT 1117 131.586 66.870 55.029 1.00 0.00 H TER 54149 WAT 1117 ATOM 54149 O WAT 1118 59.572 98.196 73.455 1.00 0.00 O ATOM 54150 H1 WAT 1118 59.032 98.022 74.226 1.00 0.00 H ATOM 54151 H2 WAT 1118 59.287 99.058 73.153 1.00 0.00 H TER 54153 WAT 1118 ATOM 54153 O WAT 1119 18.626 116.752 135.973 1.00 0.00 O ATOM 54154 H1 WAT 1119 17.945 116.680 135.303 1.00 0.00 H ATOM 54155 H2 WAT 1119 18.326 117.458 136.545 1.00 0.00 H TER 54157 WAT 1119 ATOM 54157 O WAT 1120 50.881 30.630 117.101 1.00 0.00 O ATOM 54158 H1 WAT 1120 50.578 30.560 116.195 1.00 0.00 H ATOM 54159 H2 WAT 1120 50.109 30.422 117.628 1.00 0.00 H TER 54161 WAT 1120 ATOM 54161 O WAT 1121 138.686 92.618 109.698 1.00 0.00 O ATOM 54162 H1 WAT 1121 138.649 93.354 109.087 1.00 0.00 H ATOM 54163 H2 WAT 1121 137.998 92.802 110.337 1.00 0.00 H TER 54165 WAT 1121 ATOM 54165 O WAT 1122 25.195 41.238 65.801 1.00 0.00 O ATOM 54166 H1 WAT 1122 24.358 41.508 66.181 1.00 0.00 H ATOM 54167 H2 WAT 1122 25.093 40.300 65.640 1.00 0.00 H TER 54169 WAT 1122 ATOM 54169 O WAT 1123 29.291 16.018 93.186 1.00 0.00 O ATOM 54170 H1 WAT 1123 29.035 16.464 92.379 1.00 0.00 H ATOM 54171 H2 WAT 1123 29.105 15.094 93.019 1.00 0.00 H TER 54173 WAT 1123 ATOM 54173 O WAT 1124 72.843 92.841 103.006 1.00 0.00 O ATOM 54174 H1 WAT 1124 73.184 93.732 103.074 1.00 0.00 H ATOM 54175 H2 WAT 1124 73.475 92.384 102.451 1.00 0.00 H TER 54177 WAT 1124 ATOM 54177 O WAT 1125 72.503 80.124 18.521 1.00 0.00 O ATOM 54178 H1 WAT 1125 73.158 79.743 17.935 1.00 0.00 H ATOM 54179 H2 WAT 1125 72.139 79.375 18.992 1.00 0.00 H TER 54181 WAT 1125 ATOM 54181 O WAT 1126 120.380 69.234 118.567 1.00 0.00 O ATOM 54182 H1 WAT 1126 120.708 69.814 119.254 1.00 0.00 H ATOM 54183 H2 WAT 1126 119.948 69.820 117.945 1.00 0.00 H TER 54185 WAT 1126 ATOM 54185 O WAT 1127 27.660 15.535 144.918 1.00 0.00 O ATOM 54186 H1 WAT 1127 28.561 15.363 144.642 1.00 0.00 H ATOM 54187 H2 WAT 1127 27.153 15.512 144.106 1.00 0.00 H TER 54189 WAT 1127 ATOM 54189 O WAT 1128 71.698 101.998 78.931 1.00 0.00 O ATOM 54190 H1 WAT 1128 70.818 102.027 78.555 1.00 0.00 H ATOM 54191 H2 WAT 1128 71.778 102.819 79.415 1.00 0.00 H TER 54193 WAT 1128 ATOM 54193 O WAT 1129 68.078 45.907 7.862 1.00 0.00 O ATOM 54194 H1 WAT 1129 68.141 45.207 7.212 1.00 0.00 H ATOM 54195 H2 WAT 1129 68.675 45.640 8.560 1.00 0.00 H TER 54197 WAT 1129 ATOM 54197 O WAT 1130 140.386 34.798 155.965 1.00 0.00 O ATOM 54198 H1 WAT 1130 140.195 34.086 155.355 1.00 0.00 H ATOM 54199 H2 WAT 1130 139.748 34.688 156.669 1.00 0.00 H TER 54201 WAT 1130 ATOM 54201 O WAT 1131 42.489 23.016 123.080 1.00 0.00 O ATOM 54202 H1 WAT 1131 42.367 22.880 124.020 1.00 0.00 H ATOM 54203 H2 WAT 1131 42.068 22.260 122.672 1.00 0.00 H TER 54205 WAT 1131 ATOM 54205 O WAT 1132 9.291 50.081 57.767 1.00 0.00 O ATOM 54206 H1 WAT 1132 9.988 50.721 57.630 1.00 0.00 H ATOM 54207 H2 WAT 1132 8.652 50.272 57.080 1.00 0.00 H TER 54209 WAT 1132 ATOM 54209 O WAT 1133 140.806 60.498 19.100 1.00 0.00 O ATOM 54210 H1 WAT 1133 140.787 59.677 18.609 1.00 0.00 H ATOM 54211 H2 WAT 1133 140.880 61.177 18.429 1.00 0.00 H TER 54213 WAT 1133 ATOM 54213 O WAT 1134 119.251 101.317 77.291 1.00 0.00 O ATOM 54214 H1 WAT 1134 119.048 100.865 78.110 1.00 0.00 H ATOM 54215 H2 WAT 1134 118.848 100.774 76.613 1.00 0.00 H TER 54217 WAT 1134 ATOM 54217 O WAT 1135 21.185 89.606 137.731 1.00 0.00 O ATOM 54218 H1 WAT 1135 20.794 90.341 138.204 1.00 0.00 H ATOM 54219 H2 WAT 1135 20.438 89.086 137.436 1.00 0.00 H TER 54221 WAT 1135 ATOM 54221 O WAT 1136 93.881 119.892 24.495 1.00 0.00 O ATOM 54222 H1 WAT 1136 93.261 119.591 25.159 1.00 0.00 H ATOM 54223 H2 WAT 1136 94.367 120.596 24.924 1.00 0.00 H TER 54225 WAT 1136 ATOM 54225 O WAT 1137 92.282 82.573 75.491 1.00 0.00 O ATOM 54226 H1 WAT 1137 92.485 82.069 76.279 1.00 0.00 H ATOM 54227 H2 WAT 1137 92.773 83.388 75.595 1.00 0.00 H TER 54229 WAT 1137 ATOM 54229 O WAT 1138 30.559 108.762 26.114 1.00 0.00 O ATOM 54230 H1 WAT 1138 30.903 108.352 26.908 1.00 0.00 H ATOM 54231 H2 WAT 1138 31.338 108.999 25.611 1.00 0.00 H TER 54233 WAT 1138 ATOM 54233 O WAT 1139 94.194 21.130 133.923 1.00 0.00 O ATOM 54234 H1 WAT 1139 94.878 20.477 134.073 1.00 0.00 H ATOM 54235 H2 WAT 1139 94.121 21.596 134.756 1.00 0.00 H TER 54237 WAT 1139 ATOM 54237 O WAT 1140 14.203 39.076 113.157 1.00 0.00 O ATOM 54238 H1 WAT 1140 14.667 39.496 113.882 1.00 0.00 H ATOM 54239 H2 WAT 1140 14.887 38.876 112.518 1.00 0.00 H TER 54241 WAT 1140 ATOM 54241 O WAT 1141 33.001 137.013 67.545 1.00 0.00 O ATOM 54242 H1 WAT 1141 32.683 137.873 67.821 1.00 0.00 H ATOM 54243 H2 WAT 1141 32.649 136.407 68.197 1.00 0.00 H TER 54245 WAT 1141 ATOM 54245 O WAT 1142 82.189 92.699 115.122 1.00 0.00 O ATOM 54246 H1 WAT 1142 83.030 92.565 115.559 1.00 0.00 H ATOM 54247 H2 WAT 1142 82.130 91.982 114.490 1.00 0.00 H TER 54249 WAT 1142 ATOM 54249 O WAT 1143 102.378 5.976 156.438 1.00 0.00 O ATOM 54250 H1 WAT 1143 101.543 5.535 156.593 1.00 0.00 H ATOM 54251 H2 WAT 1143 102.198 6.587 155.723 1.00 0.00 H TER 54253 WAT 1143 ATOM 54253 O WAT 1144 145.342 13.536 70.214 1.00 0.00 O ATOM 54254 H1 WAT 1144 145.649 13.890 69.379 1.00 0.00 H ATOM 54255 H2 WAT 1144 145.051 14.303 70.707 1.00 0.00 H TER 54257 WAT 1144 ATOM 54257 O WAT 1145 47.395 112.688 14.238 1.00 0.00 O ATOM 54258 H1 WAT 1145 46.912 112.900 15.036 1.00 0.00 H ATOM 54259 H2 WAT 1145 48.182 112.238 14.546 1.00 0.00 H TER 54261 WAT 1145 ATOM 54261 O WAT 1146 24.685 116.098 117.862 1.00 0.00 O ATOM 54262 H1 WAT 1146 25.216 115.367 117.547 1.00 0.00 H ATOM 54263 H2 WAT 1146 24.680 115.997 118.814 1.00 0.00 H TER 54265 WAT 1146 ATOM 54265 O WAT 1147 125.332 69.960 63.980 1.00 0.00 O ATOM 54266 H1 WAT 1147 124.678 70.651 64.082 1.00 0.00 H ATOM 54267 H2 WAT 1147 125.988 70.335 63.393 1.00 0.00 H TER 54269 WAT 1147 ATOM 54269 O WAT 1148 66.755 8.670 29.125 1.00 0.00 O ATOM 54270 H1 WAT 1148 67.076 8.883 30.002 1.00 0.00 H ATOM 54271 H2 WAT 1148 66.451 7.765 29.195 1.00 0.00 H TER 54273 WAT 1148 ATOM 54273 O WAT 1149 82.973 18.109 142.738 1.00 0.00 O ATOM 54274 H1 WAT 1149 82.151 17.671 142.513 1.00 0.00 H ATOM 54275 H2 WAT 1149 83.581 17.845 142.048 1.00 0.00 H TER 54277 WAT 1149 ATOM 54277 O WAT 1150 112.683 105.906 107.334 1.00 0.00 O ATOM 54278 H1 WAT 1150 112.757 106.591 106.670 1.00 0.00 H ATOM 54279 H2 WAT 1150 112.309 106.350 108.096 1.00 0.00 H TER 54281 WAT 1150 ATOM 54281 O WAT 1151 108.606 134.799 112.427 1.00 0.00 O ATOM 54282 H1 WAT 1151 107.953 135.385 112.045 1.00 0.00 H ATOM 54283 H2 WAT 1151 108.376 133.932 112.090 1.00 0.00 H TER 54285 WAT 1151 ATOM 54285 O WAT 1152 11.881 105.376 81.010 1.00 0.00 O ATOM 54286 H1 WAT 1152 12.086 105.443 80.077 1.00 0.00 H ATOM 54287 H2 WAT 1152 11.025 105.794 81.098 1.00 0.00 H TER 54289 WAT 1152 ATOM 54289 O WAT 1153 110.378 28.927 158.099 1.00 0.00 O ATOM 54290 H1 WAT 1153 110.041 28.594 158.931 1.00 0.00 H ATOM 54291 H2 WAT 1153 110.827 29.740 158.332 1.00 0.00 H TER 54293 WAT 1153 ATOM 54293 O WAT 1154 119.088 21.004 117.978 1.00 0.00 O ATOM 54294 H1 WAT 1154 119.141 21.393 118.851 1.00 0.00 H ATOM 54295 H2 WAT 1154 119.176 21.746 117.380 1.00 0.00 H TER 54297 WAT 1154 ATOM 54297 O WAT 1155 117.908 94.860 9.490 1.00 0.00 O ATOM 54298 H1 WAT 1155 117.709 95.241 10.346 1.00 0.00 H ATOM 54299 H2 WAT 1155 117.106 94.983 8.981 1.00 0.00 H TER 54301 WAT 1155 ATOM 54301 O WAT 1156 142.379 14.966 101.621 1.00 0.00 O ATOM 54302 H1 WAT 1156 141.922 14.493 100.925 1.00 0.00 H ATOM 54303 H2 WAT 1156 141.703 15.139 102.277 1.00 0.00 H TER 54305 WAT 1156 ATOM 54305 O WAT 1157 65.925 123.342 149.773 1.00 0.00 O ATOM 54306 H1 WAT 1157 66.420 122.549 149.979 1.00 0.00 H ATOM 54307 H2 WAT 1157 66.590 123.978 149.509 1.00 0.00 H TER 54309 WAT 1157 ATOM 54309 O WAT 1158 60.836 2.624 69.132 1.00 0.00 O ATOM 54310 H1 WAT 1158 60.556 2.035 68.432 1.00 0.00 H ATOM 54311 H2 WAT 1158 60.319 2.356 69.892 1.00 0.00 H TER 54313 WAT 1158 ATOM 54313 O WAT 1159 73.886 62.852 103.518 1.00 0.00 O ATOM 54314 H1 WAT 1159 73.129 63.374 103.782 1.00 0.00 H ATOM 54315 H2 WAT 1159 73.930 62.149 104.167 1.00 0.00 H TER 54317 WAT 1159 ATOM 54317 O WAT 1160 25.377 85.450 10.911 1.00 0.00 O ATOM 54318 H1 WAT 1160 24.531 85.088 11.172 1.00 0.00 H ATOM 54319 H2 WAT 1160 25.589 84.998 10.094 1.00 0.00 H TER 54321 WAT 1160 ATOM 54321 O WAT 1161 114.338 114.905 123.298 1.00 0.00 O ATOM 54322 H1 WAT 1161 113.478 114.576 123.560 1.00 0.00 H ATOM 54323 H2 WAT 1161 114.412 114.670 122.373 1.00 0.00 H TER 54325 WAT 1161 ATOM 54325 O WAT 1162 42.802 11.497 111.194 1.00 0.00 O ATOM 54326 H1 WAT 1162 42.826 11.682 110.255 1.00 0.00 H ATOM 54327 H2 WAT 1162 42.933 10.551 111.255 1.00 0.00 H TER 54329 WAT 1162 ATOM 54329 O WAT 1163 81.669 124.420 157.356 1.00 0.00 O ATOM 54330 H1 WAT 1163 80.884 124.727 156.902 1.00 0.00 H ATOM 54331 H2 WAT 1163 82.378 124.955 156.999 1.00 0.00 H TER 54333 WAT 1163 ATOM 54333 O WAT 1164 126.007 79.058 138.537 1.00 0.00 O ATOM 54334 H1 WAT 1164 126.688 78.715 139.116 1.00 0.00 H ATOM 54335 H2 WAT 1164 125.267 78.464 138.658 1.00 0.00 H TER 54337 WAT 1164 ATOM 54337 O WAT 1165 7.854 75.522 132.724 1.00 0.00 O ATOM 54338 H1 WAT 1165 7.090 74.997 132.961 1.00 0.00 H ATOM 54339 H2 WAT 1165 7.585 76.425 132.892 1.00 0.00 H TER 54341 WAT 1165 ATOM 54341 O WAT 1166 59.355 125.961 130.005 1.00 0.00 O ATOM 54342 H1 WAT 1166 58.614 126.230 129.462 1.00 0.00 H ATOM 54343 H2 WAT 1166 59.866 125.381 129.441 1.00 0.00 H TER 54345 WAT 1166 ATOM 54345 O WAT 1167 98.933 134.383 155.735 1.00 0.00 O ATOM 54346 H1 WAT 1167 98.508 133.564 155.991 1.00 0.00 H ATOM 54347 H2 WAT 1167 99.848 134.268 155.994 1.00 0.00 H TER 54349 WAT 1167 ATOM 54349 O WAT 1168 20.055 4.611 76.956 1.00 0.00 O ATOM 54350 H1 WAT 1168 20.017 4.504 77.907 1.00 0.00 H ATOM 54351 H2 WAT 1168 19.139 4.654 76.683 1.00 0.00 H TER 54353 WAT 1168 ATOM 54353 O WAT 1169 83.920 104.022 64.816 1.00 0.00 O ATOM 54354 H1 WAT 1169 84.057 104.450 63.971 1.00 0.00 H ATOM 54355 H2 WAT 1169 84.572 104.418 65.394 1.00 0.00 H TER 54357 WAT 1169 ATOM 54357 O WAT 1170 143.540 130.066 112.723 1.00 0.00 O ATOM 54358 H1 WAT 1170 144.487 130.185 112.650 1.00 0.00 H ATOM 54359 H2 WAT 1170 143.356 129.283 112.204 1.00 0.00 H TER 54361 WAT 1170 ATOM 54361 O WAT 1171 45.150 122.505 158.445 1.00 0.00 O ATOM 54362 H1 WAT 1171 44.512 122.388 157.741 1.00 0.00 H ATOM 54363 H2 WAT 1171 44.838 121.933 159.147 1.00 0.00 H TER 54365 WAT 1171 ATOM 54365 O WAT 1172 35.367 75.359 63.998 1.00 0.00 O ATOM 54366 H1 WAT 1172 36.041 76.032 63.903 1.00 0.00 H ATOM 54367 H2 WAT 1172 34.821 75.667 64.722 1.00 0.00 H TER 54369 WAT 1172 ATOM 54369 O WAT 1173 10.557 49.601 84.145 1.00 0.00 O ATOM 54370 H1 WAT 1173 9.918 48.905 83.997 1.00 0.00 H ATOM 54371 H2 WAT 1173 10.643 50.034 83.295 1.00 0.00 H TER 54373 WAT 1173 ATOM 54373 O WAT 1174 17.924 82.420 135.851 1.00 0.00 O ATOM 54374 H1 WAT 1174 18.567 81.762 136.116 1.00 0.00 H ATOM 54375 H2 WAT 1174 18.361 83.258 136.006 1.00 0.00 H TER 54377 WAT 1174 ATOM 54377 O WAT 1175 135.126 90.322 28.977 1.00 0.00 O ATOM 54378 H1 WAT 1175 134.438 89.913 28.452 1.00 0.00 H ATOM 54379 H2 WAT 1175 135.794 89.643 29.067 1.00 0.00 H TER 54381 WAT 1175 ATOM 54381 O WAT 1176 48.165 143.962 13.263 1.00 0.00 O ATOM 54382 H1 WAT 1176 47.829 143.517 14.041 1.00 0.00 H ATOM 54383 H2 WAT 1176 49.086 143.703 13.218 1.00 0.00 H TER 54385 WAT 1176 ATOM 54385 O WAT 1177 16.709 27.865 66.905 1.00 0.00 O ATOM 54386 H1 WAT 1177 17.293 28.195 66.222 1.00 0.00 H ATOM 54387 H2 WAT 1177 16.321 28.652 67.288 1.00 0.00 H TER 54389 WAT 1177 ATOM 54389 O WAT 1178 10.960 73.169 5.424 1.00 0.00 O ATOM 54390 H1 WAT 1178 11.434 72.345 5.533 1.00 0.00 H ATOM 54391 H2 WAT 1178 11.633 73.845 5.501 1.00 0.00 H TER 54393 WAT 1178 ATOM 54393 O WAT 1179 127.706 63.007 94.597 1.00 0.00 O ATOM 54394 H1 WAT 1179 126.865 62.795 95.003 1.00 0.00 H ATOM 54395 H2 WAT 1179 128.304 63.127 95.335 1.00 0.00 H TER 54397 WAT 1179 ATOM 54397 O WAT 1180 102.524 59.974 132.042 1.00 0.00 O ATOM 54398 H1 WAT 1180 103.023 59.185 132.252 1.00 0.00 H ATOM 54399 H2 WAT 1180 103.181 60.669 132.003 1.00 0.00 H TER 54401 WAT 1180 ATOM 54401 O WAT 1181 28.953 10.374 109.206 1.00 0.00 O ATOM 54402 H1 WAT 1181 28.579 9.598 108.788 1.00 0.00 H ATOM 54403 H2 WAT 1181 28.552 11.110 108.745 1.00 0.00 H TER 54405 WAT 1181 ATOM 54405 O WAT 1182 62.076 3.144 54.474 1.00 0.00 O ATOM 54406 H1 WAT 1182 61.135 3.000 54.376 1.00 0.00 H ATOM 54407 H2 WAT 1182 62.448 2.883 53.632 1.00 0.00 H TER 54409 WAT 1182 ATOM 54409 O WAT 1183 42.437 67.035 113.744 1.00 0.00 O ATOM 54410 H1 WAT 1183 43.190 66.443 113.722 1.00 0.00 H ATOM 54411 H2 WAT 1183 42.181 67.131 112.827 1.00 0.00 H TER 54413 WAT 1183 ATOM 54413 O WAT 1184 80.533 59.138 88.304 1.00 0.00 O ATOM 54414 H1 WAT 1184 79.799 58.557 88.505 1.00 0.00 H ATOM 54415 H2 WAT 1184 81.312 58.614 88.492 1.00 0.00 H TER 54417 WAT 1184 ATOM 54417 O WAT 1185 117.633 35.270 138.531 1.00 0.00 O ATOM 54418 H1 WAT 1185 117.237 34.602 139.091 1.00 0.00 H ATOM 54419 H2 WAT 1185 116.965 35.454 137.870 1.00 0.00 H TER 54421 WAT 1185 ATOM 54421 O WAT 1186 50.285 69.357 77.955 1.00 0.00 O ATOM 54422 H1 WAT 1186 49.731 70.071 77.639 1.00 0.00 H ATOM 54423 H2 WAT 1186 50.028 68.602 77.426 1.00 0.00 H TER 54425 WAT 1186 ATOM 54425 O WAT 1187 72.261 4.050 72.033 1.00 0.00 O ATOM 54426 H1 WAT 1187 72.644 3.187 71.875 1.00 0.00 H ATOM 54427 H2 WAT 1187 72.387 4.200 72.969 1.00 0.00 H TER 54429 WAT 1187 ATOM 54429 O WAT 1188 51.135 91.266 8.192 1.00 0.00 O ATOM 54430 H1 WAT 1188 50.475 90.617 7.947 1.00 0.00 H ATOM 54431 H2 WAT 1188 51.953 90.772 8.233 1.00 0.00 H TER 54433 WAT 1188 ATOM 54433 O WAT 1189 84.509 6.470 138.928 1.00 0.00 O ATOM 54434 H1 WAT 1189 84.721 6.013 139.742 1.00 0.00 H ATOM 54435 H2 WAT 1189 85.276 7.014 138.752 1.00 0.00 H TER 54437 WAT 1189 ATOM 54437 O WAT 1190 144.607 29.536 142.472 1.00 0.00 O ATOM 54438 H1 WAT 1190 144.842 28.620 142.618 1.00 0.00 H ATOM 54439 H2 WAT 1190 143.788 29.497 141.977 1.00 0.00 H TER 54441 WAT 1190 ATOM 54441 O WAT 1191 9.240 62.366 6.785 1.00 0.00 O ATOM 54442 H1 WAT 1191 10.131 62.407 7.131 1.00 0.00 H ATOM 54443 H2 WAT 1191 9.042 61.430 6.743 1.00 0.00 H TER 54445 WAT 1191 ATOM 54445 O WAT 1192 56.663 125.051 154.328 1.00 0.00 O ATOM 54446 H1 WAT 1192 56.384 124.161 154.542 1.00 0.00 H ATOM 54447 H2 WAT 1192 55.883 125.464 153.959 1.00 0.00 H TER 54449 WAT 1192 ATOM 54449 O WAT 1193 45.514 26.995 90.028 1.00 0.00 O ATOM 54450 H1 WAT 1193 46.392 27.367 90.116 1.00 0.00 H ATOM 54451 H2 WAT 1193 45.079 27.556 89.386 1.00 0.00 H TER 54453 WAT 1193 ATOM 54453 O WAT 1194 45.079 39.215 70.209 1.00 0.00 O ATOM 54454 H1 WAT 1194 45.103 39.472 69.287 1.00 0.00 H ATOM 54455 H2 WAT 1194 45.285 40.018 70.688 1.00 0.00 H TER 54457 WAT 1194 ATOM 54457 O WAT 1195 109.094 125.064 74.921 1.00 0.00 O ATOM 54458 H1 WAT 1195 108.463 124.364 74.755 1.00 0.00 H ATOM 54459 H2 WAT 1195 108.640 125.659 75.518 1.00 0.00 H TER 54461 WAT 1195 ATOM 54461 O WAT 1196 57.983 87.115 0.232 1.00 0.00 O ATOM 54462 H1 WAT 1196 58.770 87.597 -0.024 1.00 0.00 H ATOM 54463 H2 WAT 1196 58.243 86.195 0.194 1.00 0.00 H TER 54465 WAT 1196 ATOM 54465 O WAT 1197 99.216 16.668 143.742 1.00 0.00 O ATOM 54466 H1 WAT 1197 98.369 16.236 143.630 1.00 0.00 H ATOM 54467 H2 WAT 1197 99.775 16.277 143.071 1.00 0.00 H TER 54469 WAT 1197 ATOM 54469 O WAT 1198 89.838 59.150 6.823 1.00 0.00 O ATOM 54470 H1 WAT 1198 89.817 59.168 7.780 1.00 0.00 H ATOM 54471 H2 WAT 1198 89.816 60.072 6.567 1.00 0.00 H TER 54473 WAT 1198 ATOM 54473 O WAT 1199 9.468 131.349 77.482 1.00 0.00 O ATOM 54474 H1 WAT 1199 9.268 130.707 78.163 1.00 0.00 H ATOM 54475 H2 WAT 1199 10.044 130.882 76.876 1.00 0.00 H TER 54477 WAT 1199 ATOM 54477 O WAT 1200 122.832 93.447 65.771 1.00 0.00 O ATOM 54478 H1 WAT 1200 122.591 92.707 65.214 1.00 0.00 H ATOM 54479 H2 WAT 1200 123.549 93.116 66.312 1.00 0.00 H TER 54481 WAT 1200 ATOM 54481 O WAT 1201 67.137 143.298 135.379 1.00 0.00 O ATOM 54482 H1 WAT 1201 66.389 143.775 135.019 1.00 0.00 H ATOM 54483 H2 WAT 1201 67.727 143.180 134.635 1.00 0.00 H TER 54485 WAT 1201 ATOM 54485 O WAT 1202 106.556 144.829 83.249 1.00 0.00 O ATOM 54486 H1 WAT 1202 105.967 145.203 82.593 1.00 0.00 H ATOM 54487 H2 WAT 1202 106.851 145.580 83.763 1.00 0.00 H TER 54489 WAT 1202 ATOM 54489 O WAT 1203 47.526 4.049 150.363 1.00 0.00 O ATOM 54490 H1 WAT 1203 47.913 3.454 149.720 1.00 0.00 H ATOM 54491 H2 WAT 1203 46.692 3.640 150.594 1.00 0.00 H TER 54493 WAT 1203 ATOM 54493 O WAT 1204 52.602 79.227 73.526 1.00 0.00 O ATOM 54494 H1 WAT 1204 53.403 79.309 74.044 1.00 0.00 H ATOM 54495 H2 WAT 1204 51.912 79.079 74.174 1.00 0.00 H TER 54497 WAT 1204 ATOM 54497 O WAT 1205 133.608 8.628 95.421 1.00 0.00 O ATOM 54498 H1 WAT 1205 133.491 7.678 95.423 1.00 0.00 H ATOM 54499 H2 WAT 1205 134.540 8.755 95.597 1.00 0.00 H TER 54501 WAT 1205 ATOM 54501 O WAT 1206 90.626 97.829 113.734 1.00 0.00 O ATOM 54502 H1 WAT 1206 90.032 97.155 113.404 1.00 0.00 H ATOM 54503 H2 WAT 1206 90.157 98.651 113.592 1.00 0.00 H TER 54505 WAT 1206 ATOM 54505 O WAT 1207 17.795 28.811 114.146 1.00 0.00 O ATOM 54506 H1 WAT 1207 17.746 29.765 114.196 1.00 0.00 H ATOM 54507 H2 WAT 1207 18.492 28.640 113.511 1.00 0.00 H TER 54509 WAT 1207 ATOM 54509 O WAT 1208 12.135 39.376 83.174 1.00 0.00 O ATOM 54510 H1 WAT 1208 11.264 39.616 82.859 1.00 0.00 H ATOM 54511 H2 WAT 1208 12.391 40.098 83.747 1.00 0.00 H TER 54513 WAT 1208 ATOM 54513 O WAT 1209 44.981 58.671 81.360 1.00 0.00 O ATOM 54514 H1 WAT 1209 45.458 59.444 81.662 1.00 0.00 H ATOM 54515 H2 WAT 1209 44.481 58.977 80.604 1.00 0.00 H TER 54517 WAT 1209 ATOM 54517 O WAT 1210 19.475 113.433 134.177 1.00 0.00 O ATOM 54518 H1 WAT 1210 18.898 113.072 134.850 1.00 0.00 H ATOM 54519 H2 WAT 1210 18.880 113.785 133.515 1.00 0.00 H TER 54521 WAT 1210 ATOM 54521 O WAT 1211 79.351 63.329 90.574 1.00 0.00 O ATOM 54522 H1 WAT 1211 78.747 62.766 91.058 1.00 0.00 H ATOM 54523 H2 WAT 1211 79.318 62.999 89.676 1.00 0.00 H TER 54525 WAT 1211 ATOM 54525 O WAT 1212 107.709 65.425 145.017 1.00 0.00 O ATOM 54526 H1 WAT 1212 107.963 65.933 145.788 1.00 0.00 H ATOM 54527 H2 WAT 1212 106.869 65.033 145.255 1.00 0.00 H TER 54529 WAT 1212 ATOM 54529 O WAT 1213 20.310 82.022 73.099 1.00 0.00 O ATOM 54530 H1 WAT 1213 20.490 82.623 72.375 1.00 0.00 H ATOM 54531 H2 WAT 1213 19.362 81.896 73.075 1.00 0.00 H TER 54533 WAT 1213 ATOM 54533 O WAT 1214 109.286 95.117 132.498 1.00 0.00 O ATOM 54534 H1 WAT 1214 108.350 95.260 132.359 1.00 0.00 H ATOM 54535 H2 WAT 1214 109.327 94.442 133.176 1.00 0.00 H TER 54537 WAT 1214 ATOM 54537 O WAT 1215 32.559 57.507 101.593 1.00 0.00 O ATOM 54538 H1 WAT 1215 32.921 56.791 101.070 1.00 0.00 H ATOM 54539 H2 WAT 1215 32.633 57.203 102.498 1.00 0.00 H TER 54541 WAT 1215 ATOM 54541 O WAT 1216 144.399 10.001 105.468 1.00 0.00 O ATOM 54542 H1 WAT 1216 145.138 10.300 105.998 1.00 0.00 H ATOM 54543 H2 WAT 1216 144.604 10.299 104.582 1.00 0.00 H TER 54545 WAT 1216 ATOM 54545 O WAT 1217 133.104 127.935 2.978 1.00 0.00 O ATOM 54546 H1 WAT 1217 133.891 128.413 3.239 1.00 0.00 H ATOM 54547 H2 WAT 1217 132.835 128.346 2.156 1.00 0.00 H TER 54549 WAT 1217 ATOM 54549 O WAT 1218 35.155 91.586 93.995 1.00 0.00 O ATOM 54550 H1 WAT 1218 35.567 92.372 93.638 1.00 0.00 H ATOM 54551 H2 WAT 1218 34.216 91.769 93.957 1.00 0.00 H TER 54553 WAT 1218 ATOM 54553 O WAT 1219 29.243 6.387 61.394 1.00 0.00 O ATOM 54554 H1 WAT 1219 29.673 7.152 61.013 1.00 0.00 H ATOM 54555 H2 WAT 1219 28.911 5.899 60.641 1.00 0.00 H TER 54557 WAT 1219 ATOM 54557 O WAT 1220 106.512 14.313 122.274 1.00 0.00 O ATOM 54558 H1 WAT 1220 105.736 14.318 121.712 1.00 0.00 H ATOM 54559 H2 WAT 1220 107.167 13.829 121.772 1.00 0.00 H TER 54561 WAT 1220 ATOM 54561 O WAT 1221 86.174 64.314 5.186 1.00 0.00 O ATOM 54562 H1 WAT 1221 86.087 64.227 4.237 1.00 0.00 H ATOM 54563 H2 WAT 1221 87.042 64.697 5.313 1.00 0.00 H TER 54565 WAT 1221 ATOM 54565 O WAT 1222 18.686 132.252 123.513 1.00 0.00 O ATOM 54566 H1 WAT 1222 19.186 133.005 123.829 1.00 0.00 H ATOM 54567 H2 WAT 1222 18.037 132.092 124.198 1.00 0.00 H TER 54569 WAT 1222 ATOM 54569 O WAT 1223 103.538 17.792 14.900 1.00 0.00 O ATOM 54570 H1 WAT 1223 104.192 18.175 14.315 1.00 0.00 H ATOM 54571 H2 WAT 1223 102.705 17.928 14.450 1.00 0.00 H TER 54573 WAT 1223 ATOM 54573 O WAT 1224 15.590 22.931 8.896 1.00 0.00 O ATOM 54574 H1 WAT 1224 16.274 22.843 8.232 1.00 0.00 H ATOM 54575 H2 WAT 1224 14.896 22.341 8.603 1.00 0.00 H TER 54577 WAT 1224 ATOM 54577 O WAT 1225 121.389 119.937 129.489 1.00 0.00 O ATOM 54578 H1 WAT 1225 122.139 119.366 129.325 1.00 0.00 H ATOM 54579 H2 WAT 1225 121.531 120.271 130.375 1.00 0.00 H TER 54581 WAT 1225 ATOM 54581 O WAT 1226 115.420 145.492 87.747 1.00 0.00 O ATOM 54582 H1 WAT 1226 115.803 144.880 88.376 1.00 0.00 H ATOM 54583 H2 WAT 1226 114.479 145.323 87.792 1.00 0.00 H TER 54585 WAT 1226 ATOM 54585 O WAT 1227 133.179 108.652 102.244 1.00 0.00 O ATOM 54586 H1 WAT 1227 132.745 107.937 102.710 1.00 0.00 H ATOM 54587 H2 WAT 1227 132.769 108.658 101.379 1.00 0.00 H TER 54589 WAT 1227 ATOM 54589 O WAT 1228 52.648 71.230 67.186 1.00 0.00 O ATOM 54590 H1 WAT 1228 52.669 70.566 66.497 1.00 0.00 H ATOM 54591 H2 WAT 1228 52.145 71.952 66.808 1.00 0.00 H TER 54593 WAT 1228 ATOM 54593 O WAT 1229 113.246 21.335 95.408 1.00 0.00 O ATOM 54594 H1 WAT 1229 112.495 21.926 95.459 1.00 0.00 H ATOM 54595 H2 WAT 1229 113.934 21.779 95.903 1.00 0.00 H TER 54597 WAT 1229 ATOM 54597 O WAT 1230 4.318 125.221 77.653 1.00 0.00 O ATOM 54598 H1 WAT 1230 4.553 125.843 78.342 1.00 0.00 H ATOM 54599 H2 WAT 1230 4.796 124.422 77.878 1.00 0.00 H TER 54601 WAT 1230 ATOM 54601 O WAT 1231 126.353 96.365 116.808 1.00 0.00 O ATOM 54602 H1 WAT 1231 126.164 96.182 117.729 1.00 0.00 H ATOM 54603 H2 WAT 1231 125.650 96.953 116.532 1.00 0.00 H TER 54605 WAT 1231 ATOM 54605 O WAT 1232 137.866 65.440 123.514 1.00 0.00 O ATOM 54606 H1 WAT 1232 137.669 65.299 124.440 1.00 0.00 H ATOM 54607 H2 WAT 1232 137.023 65.669 123.121 1.00 0.00 H TER 54609 WAT 1232 ATOM 54609 O WAT 1233 12.069 61.850 68.126 1.00 0.00 O ATOM 54610 H1 WAT 1233 11.218 61.412 68.131 1.00 0.00 H ATOM 54611 H2 WAT 1233 12.467 61.590 67.295 1.00 0.00 H TER 54613 WAT 1233 ATOM 54613 O WAT 1234 60.759 2.645 122.824 1.00 0.00 O ATOM 54614 H1 WAT 1234 60.227 2.565 123.617 1.00 0.00 H ATOM 54615 H2 WAT 1234 61.656 2.729 123.146 1.00 0.00 H TER 54617 WAT 1234 ATOM 54617 O WAT 1235 68.108 48.654 85.972 1.00 0.00 O ATOM 54618 H1 WAT 1235 67.945 49.596 85.994 1.00 0.00 H ATOM 54619 H2 WAT 1235 68.186 48.403 86.892 1.00 0.00 H TER 54621 WAT 1235 ATOM 54621 O WAT 1236 128.331 2.750 149.888 1.00 0.00 O ATOM 54622 H1 WAT 1236 128.107 1.852 150.134 1.00 0.00 H ATOM 54623 H2 WAT 1236 128.722 3.123 150.678 1.00 0.00 H TER 54625 WAT 1236 ATOM 54625 O WAT 1237 52.914 122.464 107.007 1.00 0.00 O ATOM 54626 H1 WAT 1237 53.471 121.689 106.934 1.00 0.00 H ATOM 54627 H2 WAT 1237 52.324 122.268 107.735 1.00 0.00 H TER 54629 WAT 1237 ATOM 54629 O WAT 1238 104.996 65.549 147.645 1.00 0.00 O ATOM 54630 H1 WAT 1238 105.766 66.035 147.938 1.00 0.00 H ATOM 54631 H2 WAT 1238 105.350 64.741 147.273 1.00 0.00 H TER 54633 WAT 1238 ATOM 54633 O WAT 1239 61.689 113.786 144.111 1.00 0.00 O ATOM 54634 H1 WAT 1239 61.835 113.446 144.993 1.00 0.00 H ATOM 54635 H2 WAT 1239 61.638 114.735 144.226 1.00 0.00 H TER 54637 WAT 1239 ATOM 54637 O WAT 1240 45.387 48.654 12.959 1.00 0.00 O ATOM 54638 H1 WAT 1240 45.251 49.502 12.535 1.00 0.00 H ATOM 54639 H2 WAT 1240 46.334 48.600 13.087 1.00 0.00 H TER 54641 WAT 1240 ATOM 54641 O WAT 1241 40.605 117.497 115.922 1.00 0.00 O ATOM 54642 H1 WAT 1241 40.480 116.958 115.141 1.00 0.00 H ATOM 54643 H2 WAT 1241 39.762 117.933 116.049 1.00 0.00 H TER 54645 WAT 1241 ATOM 54645 O WAT 1242 5.205 140.026 15.140 1.00 0.00 O ATOM 54646 H1 WAT 1242 4.494 140.535 15.531 1.00 0.00 H ATOM 54647 H2 WAT 1242 5.445 140.515 14.353 1.00 0.00 H TER 54649 WAT 1242 ATOM 54649 O WAT 1243 93.591 26.640 109.651 1.00 0.00 O ATOM 54650 H1 WAT 1243 93.892 27.422 110.112 1.00 0.00 H ATOM 54651 H2 WAT 1243 94.104 25.926 110.030 1.00 0.00 H TER 54653 WAT 1243 ATOM 54653 O WAT 1244 89.394 22.875 4.018 1.00 0.00 O ATOM 54654 H1 WAT 1244 90.167 22.670 4.545 1.00 0.00 H ATOM 54655 H2 WAT 1244 88.860 23.433 4.584 1.00 0.00 H TER 54657 WAT 1244 ATOM 54657 O WAT 1245 137.232 55.957 10.248 1.00 0.00 O ATOM 54658 H1 WAT 1245 136.590 56.557 10.629 1.00 0.00 H ATOM 54659 H2 WAT 1245 137.788 55.702 10.985 1.00 0.00 H TER 54661 WAT 1245 ATOM 54661 O WAT 1246 131.673 94.595 99.194 1.00 0.00 O ATOM 54662 H1 WAT 1246 131.801 93.988 98.464 1.00 0.00 H ATOM 54663 H2 WAT 1246 131.720 95.463 98.794 1.00 0.00 H TER 54665 WAT 1246 ATOM 54665 O WAT 1247 112.431 55.783 73.781 1.00 0.00 O ATOM 54666 H1 WAT 1247 112.662 56.666 73.494 1.00 0.00 H ATOM 54667 H2 WAT 1247 111.478 55.802 73.871 1.00 0.00 H TER 54669 WAT 1247 ATOM 54669 O WAT 1248 41.861 32.311 89.196 1.00 0.00 O ATOM 54670 H1 WAT 1248 42.223 31.936 89.999 1.00 0.00 H ATOM 54671 H2 WAT 1248 40.990 31.922 89.122 1.00 0.00 H TER 54673 WAT 1248 ATOM 54673 O WAT 1249 89.583 138.585 150.655 1.00 0.00 O ATOM 54674 H1 WAT 1249 89.011 139.062 151.257 1.00 0.00 H ATOM 54675 H2 WAT 1249 90.109 138.020 151.220 1.00 0.00 H TER 54677 WAT 1249 ATOM 54677 O WAT 1250 27.756 4.802 67.588 1.00 0.00 O ATOM 54678 H1 WAT 1250 27.012 4.257 67.332 1.00 0.00 H ATOM 54679 H2 WAT 1250 27.835 4.671 68.533 1.00 0.00 H TER 54681 WAT 1250 ATOM 54681 O WAT 1251 5.220 143.753 130.267 1.00 0.00 O ATOM 54682 H1 WAT 1251 4.733 143.576 131.072 1.00 0.00 H ATOM 54683 H2 WAT 1251 5.973 144.271 130.551 1.00 0.00 H TER 54685 WAT 1251 ATOM 54685 O WAT 1252 20.466 125.383 -0.088 1.00 0.00 O ATOM 54686 H1 WAT 1252 20.239 125.109 0.800 1.00 0.00 H ATOM 54687 H2 WAT 1252 21.410 125.534 -0.059 1.00 0.00 H TER 54689 WAT 1252 ATOM 54689 O WAT 1253 105.879 57.709 113.138 1.00 0.00 O ATOM 54690 H1 WAT 1253 105.667 58.638 113.231 1.00 0.00 H ATOM 54691 H2 WAT 1253 106.777 57.635 113.463 1.00 0.00 H TER 54693 WAT 1253 ATOM 54693 O WAT 1254 93.978 118.651 117.725 1.00 0.00 O ATOM 54694 H1 WAT 1254 94.808 119.084 117.925 1.00 0.00 H ATOM 54695 H2 WAT 1254 94.213 117.952 117.114 1.00 0.00 H TER 54697 WAT 1254 ATOM 54697 O WAT 1255 19.392 1.090 141.358 1.00 0.00 O ATOM 54698 H1 WAT 1255 19.313 2.044 141.340 1.00 0.00 H ATOM 54699 H2 WAT 1255 19.542 0.879 142.279 1.00 0.00 H TER 54701 WAT 1255 ATOM 54701 O WAT 1256 17.759 105.812 61.323 1.00 0.00 O ATOM 54702 H1 WAT 1256 18.709 105.854 61.431 1.00 0.00 H ATOM 54703 H2 WAT 1256 17.412 105.911 62.210 1.00 0.00 H TER 54705 WAT 1256 ATOM 54705 O WAT 1257 5.148 16.514 94.476 1.00 0.00 O ATOM 54706 H1 WAT 1257 5.875 15.892 94.462 1.00 0.00 H ATOM 54707 H2 WAT 1257 4.707 16.386 93.636 1.00 0.00 H TER 54709 WAT 1257 ATOM 54709 O WAT 1258 81.115 45.417 104.675 1.00 0.00 O ATOM 54710 H1 WAT 1258 81.723 44.724 104.420 1.00 0.00 H ATOM 54711 H2 WAT 1258 81.216 46.086 103.998 1.00 0.00 H TER 54713 WAT 1258 ATOM 54713 O WAT 1259 12.201 20.810 84.578 1.00 0.00 O ATOM 54714 H1 WAT 1259 11.919 20.742 85.490 1.00 0.00 H ATOM 54715 H2 WAT 1259 13.029 20.332 84.547 1.00 0.00 H TER 54717 WAT 1259 ATOM 54717 O WAT 1260 137.550 11.299 91.112 1.00 0.00 O ATOM 54718 H1 WAT 1260 137.266 10.810 90.339 1.00 0.00 H ATOM 54719 H2 WAT 1260 137.335 10.727 91.849 1.00 0.00 H TER 54721 WAT 1260 ATOM 54721 O WAT 1261 24.442 114.016 152.756 1.00 0.00 O ATOM 54722 H1 WAT 1261 23.540 114.294 152.601 1.00 0.00 H ATOM 54723 H2 WAT 1261 24.361 113.148 153.151 1.00 0.00 H TER 54725 WAT 1261 ATOM 54725 O WAT 1262 90.012 23.957 59.227 1.00 0.00 O ATOM 54726 H1 WAT 1262 90.839 23.494 59.091 1.00 0.00 H ATOM 54727 H2 WAT 1262 89.528 23.827 58.412 1.00 0.00 H TER 54729 WAT 1262 ATOM 54729 O WAT 1263 98.727 86.981 13.175 1.00 0.00 O ATOM 54730 H1 WAT 1263 97.818 86.919 12.880 1.00 0.00 H ATOM 54731 H2 WAT 1263 99.005 86.072 13.285 1.00 0.00 H TER 54733 WAT 1263 ATOM 54733 O WAT 1264 140.434 1.381 80.451 1.00 0.00 O ATOM 54734 H1 WAT 1264 141.030 0.900 79.876 1.00 0.00 H ATOM 54735 H2 WAT 1264 140.754 1.198 81.334 1.00 0.00 H TER 54737 WAT 1264 ATOM 54737 O WAT 1265 29.734 134.876 81.634 1.00 0.00 O ATOM 54738 H1 WAT 1265 29.204 134.185 82.029 1.00 0.00 H ATOM 54739 H2 WAT 1265 29.098 135.459 81.219 1.00 0.00 H TER 54741 WAT 1265 ATOM 54741 O WAT 1266 141.745 13.894 65.238 1.00 0.00 O ATOM 54742 H1 WAT 1266 142.636 13.656 65.494 1.00 0.00 H ATOM 54743 H2 WAT 1266 141.693 14.836 65.398 1.00 0.00 H TER 54745 WAT 1266 ATOM 54745 O WAT 1267 17.578 96.225 8.411 1.00 0.00 O ATOM 54746 H1 WAT 1267 18.225 96.790 8.835 1.00 0.00 H ATOM 54747 H2 WAT 1267 18.041 95.852 7.661 1.00 0.00 H TER 54749 WAT 1267 ATOM 54749 O WAT 1268 100.247 41.569 5.543 1.00 0.00 O ATOM 54750 H1 WAT 1268 99.904 40.699 5.744 1.00 0.00 H ATOM 54751 H2 WAT 1268 100.558 41.502 4.640 1.00 0.00 H TER 54753 WAT 1268 ATOM 54753 O WAT 1269 56.302 59.181 135.998 1.00 0.00 O ATOM 54754 H1 WAT 1269 56.967 59.596 136.546 1.00 0.00 H ATOM 54755 H2 WAT 1269 55.750 59.905 135.702 1.00 0.00 H TER 54757 WAT 1269 ATOM 54757 O WAT 1270 33.091 114.733 8.343 1.00 0.00 O ATOM 54758 H1 WAT 1270 32.479 114.021 8.531 1.00 0.00 H ATOM 54759 H2 WAT 1270 33.407 114.550 7.458 1.00 0.00 H TER 54761 WAT 1270 ATOM 54761 O WAT 1271 132.872 95.702 91.353 1.00 0.00 O ATOM 54762 H1 WAT 1271 133.545 96.295 91.689 1.00 0.00 H ATOM 54763 H2 WAT 1271 133.284 94.838 91.370 1.00 0.00 H TER 54765 WAT 1271 ATOM 54765 O WAT 1272 69.747 99.586 147.860 1.00 0.00 O ATOM 54766 H1 WAT 1272 70.654 99.620 148.164 1.00 0.00 H ATOM 54767 H2 WAT 1272 69.411 100.470 148.009 1.00 0.00 H TER 54769 WAT 1272 ATOM 54769 O WAT 1273 49.369 77.586 138.474 1.00 0.00 O ATOM 54770 H1 WAT 1273 50.190 77.975 138.777 1.00 0.00 H ATOM 54771 H2 WAT 1273 49.280 76.784 138.988 1.00 0.00 H TER 54773 WAT 1273 ATOM 54773 O WAT 1274 74.359 119.962 139.366 1.00 0.00 O ATOM 54774 H1 WAT 1274 73.599 120.420 139.008 1.00 0.00 H ATOM 54775 H2 WAT 1274 74.274 120.061 140.314 1.00 0.00 H TER 54777 WAT 1274 ATOM 54777 O WAT 1275 52.536 59.714 2.562 1.00 0.00 O ATOM 54778 H1 WAT 1275 53.458 59.779 2.811 1.00 0.00 H ATOM 54779 H2 WAT 1275 52.424 58.801 2.297 1.00 0.00 H TER 54781 WAT 1275 ATOM 54781 O WAT 1276 40.601 26.321 11.372 1.00 0.00 O ATOM 54782 H1 WAT 1276 39.719 26.167 11.709 1.00 0.00 H ATOM 54783 H2 WAT 1276 41.170 25.807 11.945 1.00 0.00 H TER 54785 WAT 1276 ATOM 54785 O WAT 1277 65.597 106.382 100.187 1.00 0.00 O ATOM 54786 H1 WAT 1277 65.079 105.846 99.587 1.00 0.00 H ATOM 54787 H2 WAT 1277 65.040 107.137 100.376 1.00 0.00 H TER 54789 WAT 1277 ATOM 54789 O WAT 1278 137.905 18.543 147.231 1.00 0.00 O ATOM 54790 H1 WAT 1278 138.408 17.730 147.260 1.00 0.00 H ATOM 54791 H2 WAT 1278 137.890 18.848 148.138 1.00 0.00 H TER 54793 WAT 1278 ATOM 54793 O WAT 1279 23.020 24.660 25.754 1.00 0.00 O ATOM 54794 H1 WAT 1279 23.600 24.436 25.027 1.00 0.00 H ATOM 54795 H2 WAT 1279 23.255 25.560 25.979 1.00 0.00 H TER 54797 WAT 1279 ATOM 54797 O WAT 1280 87.254 60.474 87.835 1.00 0.00 O ATOM 54798 H1 WAT 1280 86.730 59.674 87.881 1.00 0.00 H ATOM 54799 H2 WAT 1280 87.690 60.426 86.984 1.00 0.00 H TER 54801 WAT 1280 ATOM 54801 O WAT 1281 143.243 74.531 85.603 1.00 0.00 O ATOM 54802 H1 WAT 1281 142.697 73.779 85.374 1.00 0.00 H ATOM 54803 H2 WAT 1281 142.675 75.290 85.470 1.00 0.00 H TER 54805 WAT 1281 ATOM 54805 O WAT 1282 37.405 71.001 97.063 1.00 0.00 O ATOM 54806 H1 WAT 1282 37.759 70.422 97.738 1.00 0.00 H ATOM 54807 H2 WAT 1282 37.667 70.595 96.237 1.00 0.00 H TER 54809 WAT 1282 ATOM 54809 O WAT 1283 59.238 15.297 137.874 1.00 0.00 O ATOM 54810 H1 WAT 1283 59.626 15.147 137.012 1.00 0.00 H ATOM 54811 H2 WAT 1283 59.738 16.027 138.238 1.00 0.00 H TER 54813 WAT 1283 ATOM 54813 O WAT 1284 115.106 98.979 21.831 1.00 0.00 O ATOM 54814 H1 WAT 1284 115.833 98.359 21.777 1.00 0.00 H ATOM 54815 H2 WAT 1284 115.086 99.245 22.750 1.00 0.00 H TER 54817 WAT 1284 ATOM 54817 O WAT 1285 68.396 81.922 5.015 1.00 0.00 O ATOM 54818 H1 WAT 1285 68.170 82.536 4.317 1.00 0.00 H ATOM 54819 H2 WAT 1285 69.031 81.328 4.616 1.00 0.00 H TER 54821 WAT 1285 ATOM 54821 O WAT 1286 13.403 73.544 14.608 1.00 0.00 O ATOM 54822 H1 WAT 1286 13.459 73.652 13.658 1.00 0.00 H ATOM 54823 H2 WAT 1286 13.418 72.596 14.742 1.00 0.00 H TER 54825 WAT 1286 ATOM 54825 O WAT 1287 70.900 75.882 130.767 1.00 0.00 O ATOM 54826 H1 WAT 1287 71.758 75.520 130.546 1.00 0.00 H ATOM 54827 H2 WAT 1287 70.374 75.750 129.978 1.00 0.00 H TER 54829 WAT 1287 ATOM 54829 O WAT 1288 10.636 69.475 3.363 1.00 0.00 O ATOM 54830 H1 WAT 1288 11.533 69.791 3.470 1.00 0.00 H ATOM 54831 H2 WAT 1288 10.148 70.240 3.057 1.00 0.00 H TER 54833 WAT 1288 ATOM 54833 O WAT 1289 60.162 111.177 113.696 1.00 0.00 O ATOM 54834 H1 WAT 1289 59.594 111.622 114.326 1.00 0.00 H ATOM 54835 H2 WAT 1289 60.991 111.654 113.742 1.00 0.00 H TER 54837 WAT 1289 ATOM 54837 O WAT 1290 106.834 14.242 94.010 1.00 0.00 O ATOM 54838 H1 WAT 1290 107.022 13.321 93.830 1.00 0.00 H ATOM 54839 H2 WAT 1290 107.695 14.654 94.076 1.00 0.00 H TER 54841 WAT 1290 ATOM 54841 O WAT 1291 76.587 34.415 118.095 1.00 0.00 O ATOM 54842 H1 WAT 1291 77.376 34.948 118.186 1.00 0.00 H ATOM 54843 H2 WAT 1291 75.928 35.018 117.751 1.00 0.00 H TER 54845 WAT 1291 ATOM 54845 O WAT 1292 77.582 109.103 127.406 1.00 0.00 O ATOM 54846 H1 WAT 1292 78.059 108.675 126.696 1.00 0.00 H ATOM 54847 H2 WAT 1292 77.950 109.986 127.445 1.00 0.00 H TER 54849 WAT 1292 ATOM 54849 O WAT 1293 139.020 5.841 13.341 1.00 0.00 O ATOM 54850 H1 WAT 1293 139.259 6.141 12.464 1.00 0.00 H ATOM 54851 H2 WAT 1293 139.194 6.594 13.906 1.00 0.00 H TER 54853 WAT 1293 ATOM 54853 O WAT 1294 60.246 26.229 145.831 1.00 0.00 O ATOM 54854 H1 WAT 1294 60.748 25.900 145.085 1.00 0.00 H ATOM 54855 H2 WAT 1294 60.759 25.973 146.597 1.00 0.00 H TER 54857 WAT 1294 ATOM 54857 O WAT 1295 136.656 72.354 60.065 1.00 0.00 O ATOM 54858 H1 WAT 1295 136.023 71.658 60.241 1.00 0.00 H ATOM 54859 H2 WAT 1295 137.475 71.893 59.885 1.00 0.00 H TER 54861 WAT 1295 ATOM 54861 O WAT 1296 97.217 46.432 79.959 1.00 0.00 O ATOM 54862 H1 WAT 1296 96.474 45.897 80.240 1.00 0.00 H ATOM 54863 H2 WAT 1296 97.781 46.482 80.730 1.00 0.00 H TER 54865 WAT 1296 ATOM 54865 O WAT 1297 46.113 79.688 125.089 1.00 0.00 O ATOM 54866 H1 WAT 1297 45.598 79.169 124.472 1.00 0.00 H ATOM 54867 H2 WAT 1297 45.911 79.313 125.946 1.00 0.00 H TER 54869 WAT 1297 ATOM 54869 O WAT 1298 79.291 82.112 143.901 1.00 0.00 O ATOM 54870 H1 WAT 1298 79.769 81.616 143.236 1.00 0.00 H ATOM 54871 H2 WAT 1298 79.788 81.971 144.707 1.00 0.00 H TER 54873 WAT 1298 ATOM 54873 O WAT 1299 55.222 137.943 90.099 1.00 0.00 O ATOM 54874 H1 WAT 1299 55.068 137.288 89.418 1.00 0.00 H ATOM 54875 H2 WAT 1299 54.927 137.523 90.906 1.00 0.00 H TER 54877 WAT 1299 ATOM 54877 O WAT 1300 133.234 123.612 122.382 1.00 0.00 O ATOM 54878 H1 WAT 1300 133.341 123.332 123.291 1.00 0.00 H ATOM 54879 H2 WAT 1300 132.554 124.285 122.416 1.00 0.00 H TER 54881 WAT 1300 ATOM 54881 O WAT 1301 141.030 91.523 112.337 1.00 0.00 O ATOM 54882 H1 WAT 1301 140.834 91.163 111.472 1.00 0.00 H ATOM 54883 H2 WAT 1301 141.489 92.343 112.158 1.00 0.00 H TER 54885 WAT 1301 ATOM 54885 O WAT 1302 141.369 76.331 9.335 1.00 0.00 O ATOM 54886 H1 WAT 1302 141.012 77.212 9.221 1.00 0.00 H ATOM 54887 H2 WAT 1302 142.108 76.447 9.932 1.00 0.00 H TER 54889 WAT 1302 ATOM 54889 O WAT 1303 20.609 144.970 16.329 1.00 0.00 O ATOM 54890 H1 WAT 1303 20.433 144.056 16.553 1.00 0.00 H ATOM 54891 H2 WAT 1303 20.281 145.064 15.434 1.00 0.00 H TER 54893 WAT 1303 ATOM 54893 O WAT 1304 94.325 123.273 11.302 1.00 0.00 O ATOM 54894 H1 WAT 1304 94.047 124.126 10.968 1.00 0.00 H ATOM 54895 H2 WAT 1304 95.270 123.254 11.150 1.00 0.00 H TER 54897 WAT 1304 ATOM 54897 O WAT 1305 86.011 43.349 68.808 1.00 0.00 O ATOM 54898 H1 WAT 1305 86.606 43.949 68.359 1.00 0.00 H ATOM 54899 H2 WAT 1305 86.416 43.206 69.664 1.00 0.00 H TER 54901 WAT 1305 ATOM 54901 O WAT 1306 89.657 52.523 142.158 1.00 0.00 O ATOM 54902 H1 WAT 1306 89.902 52.392 141.242 1.00 0.00 H ATOM 54903 H2 WAT 1306 89.657 51.643 142.534 1.00 0.00 H TER 54905 WAT 1306 ATOM 54905 O WAT 1307 82.500 81.054 8.381 1.00 0.00 O ATOM 54906 H1 WAT 1307 82.998 80.947 7.571 1.00 0.00 H ATOM 54907 H2 WAT 1307 82.885 80.417 8.984 1.00 0.00 H TER 54909 WAT 1307 ATOM 54909 O WAT 1308 144.362 95.101 81.038 1.00 0.00 O ATOM 54910 H1 WAT 1308 144.601 95.450 80.180 1.00 0.00 H ATOM 54911 H2 WAT 1308 143.924 95.829 81.479 1.00 0.00 H TER 54913 WAT 1308 ATOM 54913 O WAT 1309 54.828 0.643 154.562 1.00 0.00 O ATOM 54914 H1 WAT 1309 55.001 1.201 153.803 1.00 0.00 H ATOM 54915 H2 WAT 1309 53.952 0.290 154.404 1.00 0.00 H TER 54917 WAT 1309 ATOM 54917 O WAT 1310 124.965 16.306 57.027 1.00 0.00 O ATOM 54918 H1 WAT 1310 124.240 16.882 57.268 1.00 0.00 H ATOM 54919 H2 WAT 1310 125.169 15.827 57.831 1.00 0.00 H TER 54921 WAT 1310 ATOM 54921 O WAT 1311 114.029 88.303 128.962 1.00 0.00 O ATOM 54922 H1 WAT 1311 113.858 87.571 128.369 1.00 0.00 H ATOM 54923 H2 WAT 1311 113.930 87.929 129.838 1.00 0.00 H TER 54925 WAT 1311 ATOM 54925 O WAT 1312 11.220 81.147 79.253 1.00 0.00 O ATOM 54926 H1 WAT 1312 11.529 81.158 80.159 1.00 0.00 H ATOM 54927 H2 WAT 1312 10.272 81.036 79.324 1.00 0.00 H TER 54929 WAT 1312 ATOM 54929 O WAT 1313 134.694 39.489 123.142 1.00 0.00 O ATOM 54930 H1 WAT 1313 134.300 38.673 122.833 1.00 0.00 H ATOM 54931 H2 WAT 1313 133.949 40.068 123.305 1.00 0.00 H TER 54933 WAT 1313 ATOM 54933 O WAT 1314 63.576 124.525 90.945 1.00 0.00 O ATOM 54934 H1 WAT 1314 63.184 125.314 90.573 1.00 0.00 H ATOM 54935 H2 WAT 1314 62.832 124.016 91.267 1.00 0.00 H TER 54937 WAT 1314 ATOM 54937 O WAT 1315 63.246 13.327 2.390 1.00 0.00 O ATOM 54938 H1 WAT 1315 63.188 13.943 3.120 1.00 0.00 H ATOM 54939 H2 WAT 1315 62.469 12.775 2.480 1.00 0.00 H TER 54941 WAT 1315 ATOM 54941 O WAT 1316 102.349 7.754 128.792 1.00 0.00 O ATOM 54942 H1 WAT 1316 101.399 7.793 128.903 1.00 0.00 H ATOM 54943 H2 WAT 1316 102.577 8.587 128.380 1.00 0.00 H TER 54945 WAT 1316 ATOM 54945 O WAT 1317 105.650 32.317 108.832 1.00 0.00 O ATOM 54946 H1 WAT 1317 106.083 32.657 108.049 1.00 0.00 H ATOM 54947 H2 WAT 1317 104.716 32.366 108.629 1.00 0.00 H TER 54949 WAT 1317 ATOM 54949 O WAT 1318 35.632 68.307 71.166 1.00 0.00 O ATOM 54950 H1 WAT 1318 35.957 68.871 71.868 1.00 0.00 H ATOM 54951 H2 WAT 1318 35.155 68.899 70.584 1.00 0.00 H TER 54953 WAT 1318 ATOM 54953 O WAT 1319 86.742 107.393 70.607 1.00 0.00 O ATOM 54954 H1 WAT 1319 87.187 107.079 69.820 1.00 0.00 H ATOM 54955 H2 WAT 1319 86.239 106.639 70.915 1.00 0.00 H TER 54957 WAT 1319 ATOM 54957 O WAT 1320 75.618 145.238 87.997 1.00 0.00 O ATOM 54958 H1 WAT 1320 75.019 145.293 87.252 1.00 0.00 H ATOM 54959 H2 WAT 1320 75.060 145.373 88.763 1.00 0.00 H TER 54961 WAT 1320 ATOM 54961 O WAT 1321 10.246 61.469 74.814 1.00 0.00 O ATOM 54962 H1 WAT 1321 9.798 60.701 75.168 1.00 0.00 H ATOM 54963 H2 WAT 1321 10.432 62.012 75.580 1.00 0.00 H TER 54965 WAT 1321 ATOM 54965 O WAT 1322 108.322 112.602 115.495 1.00 0.00 O ATOM 54966 H1 WAT 1322 108.726 112.250 116.288 1.00 0.00 H ATOM 54967 H2 WAT 1322 108.753 113.446 115.361 1.00 0.00 H TER 54969 WAT 1322 ATOM 54969 O WAT 1323 32.672 88.168 83.974 1.00 0.00 O ATOM 54970 H1 WAT 1323 32.869 89.074 83.733 1.00 0.00 H ATOM 54971 H2 WAT 1323 32.789 87.674 83.164 1.00 0.00 H TER 54973 WAT 1323 ATOM 54973 O WAT 1324 85.364 120.497 9.331 1.00 0.00 O ATOM 54974 H1 WAT 1324 85.623 119.632 9.647 1.00 0.00 H ATOM 54975 H2 WAT 1324 86.041 120.734 8.698 1.00 0.00 H TER 54977 WAT 1324 ATOM 54977 O WAT 1325 102.674 21.974 77.556 1.00 0.00 O ATOM 54978 H1 WAT 1325 102.410 22.782 77.116 1.00 0.00 H ATOM 54979 H2 WAT 1325 101.870 21.649 77.962 1.00 0.00 H TER 54981 WAT 1325 ATOM 54981 O WAT 1326 84.222 110.054 119.325 1.00 0.00 O ATOM 54982 H1 WAT 1326 83.645 109.623 119.957 1.00 0.00 H ATOM 54983 H2 WAT 1326 84.464 110.879 119.745 1.00 0.00 H TER 54985 WAT 1326 ATOM 54985 O WAT 1327 88.808 60.451 149.251 1.00 0.00 O ATOM 54986 H1 WAT 1327 88.174 60.780 149.888 1.00 0.00 H ATOM 54987 H2 WAT 1327 88.275 60.025 148.580 1.00 0.00 H TER 54989 WAT 1327 ATOM 54989 O WAT 1328 4.761 37.528 142.505 1.00 0.00 O ATOM 54990 H1 WAT 1328 5.064 38.307 142.038 1.00 0.00 H ATOM 54991 H2 WAT 1328 4.258 37.039 141.854 1.00 0.00 H TER 54993 WAT 1328 ATOM 54993 O WAT 1329 36.734 66.809 87.065 1.00 0.00 O ATOM 54994 H1 WAT 1329 36.568 66.038 87.608 1.00 0.00 H ATOM 54995 H2 WAT 1329 37.525 66.589 86.573 1.00 0.00 H TER 54997 WAT 1329 ATOM 54997 O WAT 1330 144.169 80.179 100.924 1.00 0.00 O ATOM 54998 H1 WAT 1330 144.986 79.789 101.236 1.00 0.00 H ATOM 54999 H2 WAT 1330 144.117 79.920 100.004 1.00 0.00 H TER 55001 WAT 1330 ATOM 55001 O WAT 1331 115.253 47.273 71.845 1.00 0.00 O ATOM 55002 H1 WAT 1331 116.200 47.137 71.828 1.00 0.00 H ATOM 55003 H2 WAT 1331 114.928 46.796 71.081 1.00 0.00 H TER 55005 WAT 1331 ATOM 55005 O WAT 1332 86.136 56.179 105.982 1.00 0.00 O ATOM 55006 H1 WAT 1332 86.505 57.058 106.068 1.00 0.00 H ATOM 55007 H2 WAT 1332 86.569 55.813 105.210 1.00 0.00 H TER 55009 WAT 1332 ATOM 55009 O WAT 1333 145.096 61.307 69.161 1.00 0.00 O ATOM 55010 H1 WAT 1333 144.886 61.439 68.236 1.00 0.00 H ATOM 55011 H2 WAT 1333 145.905 61.801 69.295 1.00 0.00 H TER 55013 WAT 1333 ATOM 55013 O WAT 1334 61.954 8.875 121.132 1.00 0.00 O ATOM 55014 H1 WAT 1334 61.418 8.112 120.918 1.00 0.00 H ATOM 55015 H2 WAT 1334 62.318 8.677 121.995 1.00 0.00 H TER 55017 WAT 1334 ATOM 55017 O WAT 1335 64.257 134.581 18.409 1.00 0.00 O ATOM 55018 H1 WAT 1335 63.944 135.436 18.111 1.00 0.00 H ATOM 55019 H2 WAT 1335 64.273 134.043 17.617 1.00 0.00 H TER 55021 WAT 1335 ATOM 55021 O WAT 1336 47.277 43.702 109.567 1.00 0.00 O ATOM 55022 H1 WAT 1336 47.710 43.322 110.331 1.00 0.00 H ATOM 55023 H2 WAT 1336 47.742 44.525 109.413 1.00 0.00 H TER 55025 WAT 1336 ATOM 55025 O WAT 1337 103.399 127.694 1.775 1.00 0.00 O ATOM 55026 H1 WAT 1337 104.342 127.542 1.708 1.00 0.00 H ATOM 55027 H2 WAT 1337 103.148 128.025 0.912 1.00 0.00 H TER 55029 WAT 1337 ATOM 55029 O WAT 1338 61.275 18.004 103.277 1.00 0.00 O ATOM 55030 H1 WAT 1338 60.860 18.430 104.027 1.00 0.00 H ATOM 55031 H2 WAT 1338 62.182 17.867 103.552 1.00 0.00 H TER 55033 WAT 1338 ATOM 55033 O WAT 1339 14.169 144.865 145.455 1.00 0.00 O ATOM 55034 H1 WAT 1339 13.355 145.005 144.972 1.00 0.00 H ATOM 55035 H2 WAT 1339 14.116 145.468 146.197 1.00 0.00 H TER 55037 WAT 1339 ATOM 55037 O WAT 1340 144.922 24.229 116.455 1.00 0.00 O ATOM 55038 H1 WAT 1340 144.700 24.919 117.080 1.00 0.00 H ATOM 55039 H2 WAT 1340 144.939 24.671 115.606 1.00 0.00 H TER 55041 WAT 1340 ATOM 55041 O WAT 1341 66.300 133.268 150.958 1.00 0.00 O ATOM 55042 H1 WAT 1341 66.880 133.892 150.520 1.00 0.00 H ATOM 55043 H2 WAT 1341 65.531 133.218 150.391 1.00 0.00 H TER 55045 WAT 1341 ATOM 55045 O WAT 1342 84.741 142.038 136.661 1.00 0.00 O ATOM 55046 H1 WAT 1342 85.619 142.360 136.457 1.00 0.00 H ATOM 55047 H2 WAT 1342 84.684 142.088 137.616 1.00 0.00 H TER 55049 WAT 1342 ATOM 55049 O WAT 1343 119.370 78.306 21.784 1.00 0.00 O ATOM 55050 H1 WAT 1343 118.659 78.558 21.194 1.00 0.00 H ATOM 55051 H2 WAT 1343 120.168 78.475 21.284 1.00 0.00 H TER 55053 WAT 1343 ATOM 55053 O WAT 1344 120.887 32.110 73.209 1.00 0.00 O ATOM 55054 H1 WAT 1344 121.221 31.240 72.990 1.00 0.00 H ATOM 55055 H2 WAT 1344 120.899 32.138 74.166 1.00 0.00 H TER 55057 WAT 1344 ATOM 55057 O WAT 1345 75.588 81.807 114.530 1.00 0.00 O ATOM 55058 H1 WAT 1345 75.726 82.666 114.131 1.00 0.00 H ATOM 55059 H2 WAT 1345 75.950 81.188 113.895 1.00 0.00 H TER 55061 WAT 1345 ATOM 55061 O WAT 1346 6.366 13.816 109.956 1.00 0.00 O ATOM 55062 H1 WAT 1346 5.465 14.041 109.726 1.00 0.00 H ATOM 55063 H2 WAT 1346 6.314 12.917 110.281 1.00 0.00 H TER 55065 WAT 1346 ATOM 55065 O WAT 1347 74.952 92.213 85.881 1.00 0.00 O ATOM 55066 H1 WAT 1347 74.525 91.729 85.174 1.00 0.00 H ATOM 55067 H2 WAT 1347 74.697 93.124 85.737 1.00 0.00 H TER 55069 WAT 1347 ATOM 55069 O WAT 1348 142.110 69.295 100.917 1.00 0.00 O ATOM 55070 H1 WAT 1348 142.516 68.428 100.946 1.00 0.00 H ATOM 55071 H2 WAT 1348 142.846 69.905 100.970 1.00 0.00 H TER 55073 WAT 1348 ATOM 55073 O WAT 1349 127.944 120.373 94.181 1.00 0.00 O ATOM 55074 H1 WAT 1349 128.132 121.131 93.628 1.00 0.00 H ATOM 55075 H2 WAT 1349 127.989 119.625 93.585 1.00 0.00 H TER 55077 WAT 1349 ATOM 55077 O WAT 1350 109.132 67.690 140.877 1.00 0.00 O ATOM 55078 H1 WAT 1350 109.072 68.250 141.651 1.00 0.00 H ATOM 55079 H2 WAT 1350 109.910 67.154 141.028 1.00 0.00 H TER 55081 WAT 1350 ATOM 55081 O WAT 1351 0.332 10.928 11.662 1.00 0.00 O ATOM 55082 H1 WAT 1351 0.127 10.973 10.728 1.00 0.00 H ATOM 55083 H2 WAT 1351 -0.325 10.332 12.023 1.00 0.00 H TER 55085 WAT 1351 ATOM 55085 O WAT 1352 142.054 35.179 117.683 1.00 0.00 O ATOM 55086 H1 WAT 1352 143.004 35.270 117.765 1.00 0.00 H ATOM 55087 H2 WAT 1352 141.870 34.298 118.008 1.00 0.00 H TER 55089 WAT 1352 ATOM 55089 O WAT 1353 44.163 49.005 144.969 1.00 0.00 O ATOM 55090 H1 WAT 1353 43.368 49.252 144.497 1.00 0.00 H ATOM 55091 H2 WAT 1353 44.660 49.820 145.044 1.00 0.00 H TER 55093 WAT 1353 ATOM 55093 O WAT 1354 60.922 25.786 155.100 1.00 0.00 O ATOM 55094 H1 WAT 1354 60.599 26.657 154.867 1.00 0.00 H ATOM 55095 H2 WAT 1354 60.588 25.636 155.984 1.00 0.00 H TER 55097 WAT 1354 ATOM 55097 O WAT 1355 116.053 61.952 90.735 1.00 0.00 O ATOM 55098 H1 WAT 1355 116.540 61.714 89.946 1.00 0.00 H ATOM 55099 H2 WAT 1355 116.402 62.808 90.982 1.00 0.00 H TER 55101 WAT 1355 ATOM 55101 O WAT 1356 71.800 17.308 139.723 1.00 0.00 O ATOM 55102 H1 WAT 1356 72.078 16.494 140.141 1.00 0.00 H ATOM 55103 H2 WAT 1356 70.857 17.201 139.596 1.00 0.00 H TER 55105 WAT 1356 ATOM 55105 O WAT 1357 103.065 1.267 8.178 1.00 0.00 O ATOM 55106 H1 WAT 1357 102.479 0.536 8.373 1.00 0.00 H ATOM 55107 H2 WAT 1357 103.900 0.853 7.962 1.00 0.00 H TER 55109 WAT 1357 ATOM 55109 O WAT 1358 123.377 110.134 127.613 1.00 0.00 O ATOM 55110 H1 WAT 1358 122.499 110.333 127.936 1.00 0.00 H ATOM 55111 H2 WAT 1358 123.230 109.660 126.795 1.00 0.00 H TER 55113 WAT 1358 ATOM 55113 O WAT 1359 111.976 61.994 93.022 1.00 0.00 O ATOM 55114 H1 WAT 1359 112.854 62.125 93.381 1.00 0.00 H ATOM 55115 H2 WAT 1359 111.847 62.733 92.427 1.00 0.00 H TER 55117 WAT 1359 ATOM 55117 O WAT 1360 121.361 64.785 152.472 1.00 0.00 O ATOM 55118 H1 WAT 1360 120.805 65.528 152.238 1.00 0.00 H ATOM 55119 H2 WAT 1360 121.535 64.900 153.406 1.00 0.00 H TER 55121 WAT 1360 ATOM 55121 O WAT 1361 45.351 118.618 153.762 1.00 0.00 O ATOM 55122 H1 WAT 1361 46.232 118.832 153.454 1.00 0.00 H ATOM 55123 H2 WAT 1361 45.365 117.670 153.889 1.00 0.00 H TER 55125 WAT 1361 ATOM 55125 O WAT 1362 125.003 127.662 154.432 1.00 0.00 O ATOM 55126 H1 WAT 1362 124.072 127.444 154.378 1.00 0.00 H ATOM 55127 H2 WAT 1362 125.019 128.609 154.570 1.00 0.00 H TER 55129 WAT 1362 ATOM 55129 O WAT 1363 4.847 67.786 149.889 1.00 0.00 O ATOM 55130 H1 WAT 1363 4.483 68.242 149.129 1.00 0.00 H ATOM 55131 H2 WAT 1363 5.222 66.983 149.528 1.00 0.00 H TER 55133 WAT 1363 ATOM 55133 O WAT 1364 66.973 135.350 147.255 1.00 0.00 O ATOM 55134 H1 WAT 1364 67.333 135.110 148.109 1.00 0.00 H ATOM 55135 H2 WAT 1364 67.025 136.306 147.233 1.00 0.00 H TER 55137 WAT 1364 ATOM 55137 O WAT 1365 14.165 98.055 130.952 1.00 0.00 O ATOM 55138 H1 WAT 1365 14.143 97.637 130.091 1.00 0.00 H ATOM 55139 H2 WAT 1365 13.264 98.339 131.104 1.00 0.00 H TER 55141 WAT 1365 ATOM 55141 O WAT 1366 33.184 43.156 68.031 1.00 0.00 O ATOM 55142 H1 WAT 1366 32.939 42.778 67.186 1.00 0.00 H ATOM 55143 H2 WAT 1366 32.777 44.023 68.032 1.00 0.00 H TER 55145 WAT 1366 ATOM 55145 O WAT 1367 17.311 27.427 87.901 1.00 0.00 O ATOM 55146 H1 WAT 1367 16.734 27.638 88.635 1.00 0.00 H ATOM 55147 H2 WAT 1367 17.927 28.159 87.862 1.00 0.00 H TER 55149 WAT 1367 ATOM 55149 O WAT 1368 101.145 11.226 78.774 1.00 0.00 O ATOM 55150 H1 WAT 1368 100.602 11.940 78.440 1.00 0.00 H ATOM 55151 H2 WAT 1368 100.529 10.648 79.225 1.00 0.00 H TER 55153 WAT 1368 ATOM 55153 O WAT 1369 18.151 1.310 108.913 1.00 0.00 O ATOM 55154 H1 WAT 1369 18.911 1.840 108.672 1.00 0.00 H ATOM 55155 H2 WAT 1369 18.470 0.740 109.614 1.00 0.00 H TER 55157 WAT 1369 ATOM 55157 O WAT 1370 142.384 114.676 82.992 1.00 0.00 O ATOM 55158 H1 WAT 1370 142.678 114.321 82.153 1.00 0.00 H ATOM 55159 H2 WAT 1370 141.471 114.398 83.063 1.00 0.00 H TER 55161 WAT 1370 ATOM 55161 O WAT 1371 44.791 0.948 144.050 1.00 0.00 O ATOM 55162 H1 WAT 1371 44.384 1.005 143.185 1.00 0.00 H ATOM 55163 H2 WAT 1371 44.334 0.226 144.482 1.00 0.00 H TER 55165 WAT 1371 ATOM 55165 O WAT 1372 102.598 15.239 88.390 1.00 0.00 O ATOM 55166 H1 WAT 1372 101.679 15.477 88.266 1.00 0.00 H ATOM 55167 H2 WAT 1372 102.607 14.734 89.203 1.00 0.00 H TER 55169 WAT 1372 ATOM 55169 O WAT 1373 14.151 67.599 99.727 1.00 0.00 O ATOM 55170 H1 WAT 1373 13.864 68.038 100.529 1.00 0.00 H ATOM 55171 H2 WAT 1373 14.865 67.028 100.010 1.00 0.00 H TER 55173 WAT 1373 ATOM 55173 O WAT 1374 103.261 125.102 15.442 1.00 0.00 O ATOM 55174 H1 WAT 1374 103.461 125.664 14.693 1.00 0.00 H ATOM 55175 H2 WAT 1374 102.459 125.472 15.812 1.00 0.00 H TER 55177 WAT 1374 ATOM 55177 O WAT 1375 138.756 136.320 97.273 1.00 0.00 O ATOM 55178 H1 WAT 1375 138.400 135.495 97.603 1.00 0.00 H ATOM 55179 H2 WAT 1375 139.648 136.351 97.621 1.00 0.00 H TER 55181 WAT 1375 ATOM 55181 O WAT 1376 21.485 19.669 96.161 1.00 0.00 O ATOM 55182 H1 WAT 1376 20.934 19.330 96.867 1.00 0.00 H ATOM 55183 H2 WAT 1376 21.065 19.358 95.359 1.00 0.00 H TER 55185 WAT 1376 ATOM 55185 O WAT 1377 67.562 65.179 69.358 1.00 0.00 O ATOM 55186 H1 WAT 1377 68.166 65.574 68.729 1.00 0.00 H ATOM 55187 H2 WAT 1377 66.704 65.244 68.938 1.00 0.00 H TER 55189 WAT 1377 ATOM 55189 O WAT 1378 91.368 68.313 116.025 1.00 0.00 O ATOM 55190 H1 WAT 1378 91.037 67.502 115.639 1.00 0.00 H ATOM 55191 H2 WAT 1378 92.254 68.097 116.316 1.00 0.00 H TER 55193 WAT 1378 ATOM 55193 O WAT 1379 52.571 6.701 101.987 1.00 0.00 O ATOM 55194 H1 WAT 1379 52.537 7.657 101.985 1.00 0.00 H ATOM 55195 H2 WAT 1379 52.053 6.445 102.750 1.00 0.00 H TER 55197 WAT 1379 ATOM 55197 O WAT 1380 63.978 134.341 126.188 1.00 0.00 O ATOM 55198 H1 WAT 1380 64.921 134.223 126.305 1.00 0.00 H ATOM 55199 H2 WAT 1380 63.598 133.500 126.446 1.00 0.00 H TER 55201 WAT 1380 ATOM 55201 O WAT 1381 36.097 137.987 78.666 1.00 0.00 O ATOM 55202 H1 WAT 1381 36.416 138.739 79.165 1.00 0.00 H ATOM 55203 H2 WAT 1381 35.630 137.454 79.309 1.00 0.00 H TER 55205 WAT 1381 ATOM 55205 O WAT 1382 79.139 132.212 154.943 1.00 0.00 O ATOM 55206 H1 WAT 1382 79.867 131.591 154.974 1.00 0.00 H ATOM 55207 H2 WAT 1382 78.382 131.682 154.696 1.00 0.00 H TER 55209 WAT 1382 ATOM 55209 O WAT 1383 95.615 61.925 141.840 1.00 0.00 O ATOM 55210 H1 WAT 1383 95.065 61.702 141.089 1.00 0.00 H ATOM 55211 H2 WAT 1383 96.228 61.193 141.913 1.00 0.00 H TER 55213 WAT 1383 ATOM 55213 O WAT 1384 17.502 138.428 103.856 1.00 0.00 O ATOM 55214 H1 WAT 1384 18.368 138.509 104.257 1.00 0.00 H ATOM 55215 H2 WAT 1384 17.519 139.045 103.124 1.00 0.00 H TER 55217 WAT 1384 ATOM 55217 O WAT 1385 20.103 88.330 79.647 1.00 0.00 O ATOM 55218 H1 WAT 1385 20.518 87.779 78.984 1.00 0.00 H ATOM 55219 H2 WAT 1385 20.322 89.225 79.387 1.00 0.00 H TER 55221 WAT 1385 ATOM 55221 O WAT 1386 114.687 11.927 118.793 1.00 0.00 O ATOM 55222 H1 WAT 1386 115.224 12.342 118.118 1.00 0.00 H ATOM 55223 H2 WAT 1386 114.693 10.997 118.566 1.00 0.00 H TER 55225 WAT 1386 ATOM 55225 O WAT 1387 7.996 109.007 145.666 1.00 0.00 O ATOM 55226 H1 WAT 1387 7.457 108.380 145.183 1.00 0.00 H ATOM 55227 H2 WAT 1387 7.495 109.822 145.642 1.00 0.00 H TER 55229 WAT 1387 ATOM 55229 O WAT 1388 137.197 46.381 76.201 1.00 0.00 O ATOM 55230 H1 WAT 1388 137.177 46.075 75.295 1.00 0.00 H ATOM 55231 H2 WAT 1388 137.402 45.599 76.714 1.00 0.00 H TER 55233 WAT 1388 ATOM 55233 O WAT 1389 114.081 81.187 67.762 1.00 0.00 O ATOM 55234 H1 WAT 1389 114.125 80.906 68.676 1.00 0.00 H ATOM 55235 H2 WAT 1389 113.549 80.518 67.331 1.00 0.00 H TER 55237 WAT 1389 ATOM 55237 O WAT 1390 72.732 34.463 128.819 1.00 0.00 O ATOM 55238 H1 WAT 1390 72.157 35.228 128.811 1.00 0.00 H ATOM 55239 H2 WAT 1390 72.536 34.025 129.648 1.00 0.00 H TER 55241 WAT 1390 ATOM 55241 O WAT 1391 47.153 66.052 10.436 1.00 0.00 O ATOM 55242 H1 WAT 1391 46.533 66.618 9.977 1.00 0.00 H ATOM 55243 H2 WAT 1391 46.936 65.168 10.139 1.00 0.00 H TER 55245 WAT 1391 ATOM 55245 O WAT 1392 128.706 115.283 136.086 1.00 0.00 O ATOM 55246 H1 WAT 1392 128.393 114.837 135.299 1.00 0.00 H ATOM 55247 H2 WAT 1392 127.948 115.776 136.399 1.00 0.00 H TER 55249 WAT 1392 ATOM 55249 O WAT 1393 85.237 128.242 120.680 1.00 0.00 O ATOM 55250 H1 WAT 1393 84.313 128.176 120.438 1.00 0.00 H ATOM 55251 H2 WAT 1393 85.231 128.681 121.531 1.00 0.00 H TER 55253 WAT 1393 ATOM 55253 O WAT 1394 13.093 80.584 139.989 1.00 0.00 O ATOM 55254 H1 WAT 1394 12.315 80.053 140.160 1.00 0.00 H ATOM 55255 H2 WAT 1394 13.825 79.974 140.085 1.00 0.00 H TER 55257 WAT 1394 ATOM 55257 O WAT 1395 123.568 109.083 112.543 1.00 0.00 O ATOM 55258 H1 WAT 1395 123.157 109.876 112.199 1.00 0.00 H ATOM 55259 H2 WAT 1395 123.055 108.366 112.171 1.00 0.00 H TER 55261 WAT 1395 ATOM 55261 O WAT 1396 36.721 96.586 66.980 1.00 0.00 O ATOM 55262 H1 WAT 1396 36.985 95.972 67.665 1.00 0.00 H ATOM 55263 H2 WAT 1396 37.453 96.584 66.362 1.00 0.00 H TER 55265 WAT 1396 ATOM 55265 O WAT 1397 136.660 46.369 152.629 1.00 0.00 O ATOM 55266 H1 WAT 1397 136.053 45.860 153.167 1.00 0.00 H ATOM 55267 H2 WAT 1397 137.312 46.695 153.249 1.00 0.00 H TER 55269 WAT 1397 ATOM 55269 O WAT 1398 145.273 47.689 153.430 1.00 0.00 O ATOM 55270 H1 WAT 1398 144.368 48.001 153.455 1.00 0.00 H ATOM 55271 H2 WAT 1398 145.794 48.447 153.694 1.00 0.00 H TER 55273 WAT 1398 ATOM 55273 O WAT 1399 60.557 48.385 54.261 1.00 0.00 O ATOM 55274 H1 WAT 1399 61.026 48.660 55.049 1.00 0.00 H ATOM 55275 H2 WAT 1399 60.748 47.451 54.183 1.00 0.00 H TER 55277 WAT 1399 ATOM 55277 O WAT 1400 43.550 70.570 134.762 1.00 0.00 O ATOM 55278 H1 WAT 1400 42.869 71.209 134.974 1.00 0.00 H ATOM 55279 H2 WAT 1400 43.231 70.133 133.973 1.00 0.00 H TER 55281 WAT 1400 ATOM 55281 O WAT 1401 77.221 136.372 101.250 1.00 0.00 O ATOM 55282 H1 WAT 1401 77.985 135.807 101.141 1.00 0.00 H ATOM 55283 H2 WAT 1401 76.795 136.369 100.392 1.00 0.00 H TER 55285 WAT 1401 ATOM 55285 O WAT 1402 131.095 61.810 129.464 1.00 0.00 O ATOM 55286 H1 WAT 1402 130.323 62.170 129.027 1.00 0.00 H ATOM 55287 H2 WAT 1402 131.833 62.270 129.064 1.00 0.00 H TER 55289 WAT 1402 ATOM 55289 O WAT 1403 77.071 144.493 7.095 1.00 0.00 O ATOM 55290 H1 WAT 1403 76.316 144.056 6.703 1.00 0.00 H ATOM 55291 H2 WAT 1403 76.899 145.427 6.970 1.00 0.00 H TER 55293 WAT 1403 ATOM 55293 O WAT 1404 133.820 125.435 117.660 1.00 0.00 O ATOM 55294 H1 WAT 1404 133.337 124.831 118.225 1.00 0.00 H ATOM 55295 H2 WAT 1404 133.275 125.516 116.877 1.00 0.00 H TER 55297 WAT 1404 ATOM 55297 O WAT 1405 38.672 132.024 52.882 1.00 0.00 O ATOM 55298 H1 WAT 1405 38.966 131.137 52.674 1.00 0.00 H ATOM 55299 H2 WAT 1405 38.320 132.359 52.058 1.00 0.00 H TER 55301 WAT 1405 ATOM 55301 O WAT 1406 28.308 121.792 154.427 1.00 0.00 O ATOM 55302 H1 WAT 1406 28.484 120.862 154.283 1.00 0.00 H ATOM 55303 H2 WAT 1406 28.909 122.044 155.128 1.00 0.00 H TER 55305 WAT 1406 ATOM 55305 O WAT 1407 22.799 106.603 65.872 1.00 0.00 O ATOM 55306 H1 WAT 1407 22.322 106.996 65.141 1.00 0.00 H ATOM 55307 H2 WAT 1407 22.836 105.670 65.660 1.00 0.00 H TER 55309 WAT 1407 ATOM 55309 O WAT 1408 131.275 92.011 97.075 1.00 0.00 O ATOM 55310 H1 WAT 1408 130.593 92.668 96.937 1.00 0.00 H ATOM 55311 H2 WAT 1408 130.797 91.189 97.180 1.00 0.00 H TER 55313 WAT 1408 ATOM 55313 O WAT 1409 24.415 50.042 122.345 1.00 0.00 O ATOM 55314 H1 WAT 1409 25.099 50.229 122.988 1.00 0.00 H ATOM 55315 H2 WAT 1409 23.792 49.486 122.813 1.00 0.00 H TER 55317 WAT 1409 ATOM 55317 O WAT 1410 12.671 138.708 151.429 1.00 0.00 O ATOM 55318 H1 WAT 1410 12.873 139.545 151.011 1.00 0.00 H ATOM 55319 H2 WAT 1410 13.179 138.065 150.935 1.00 0.00 H TER 55321 WAT 1410 ATOM 55321 O WAT 1411 68.207 73.130 142.933 1.00 0.00 O ATOM 55322 H1 WAT 1411 67.355 73.514 143.140 1.00 0.00 H ATOM 55323 H2 WAT 1411 68.672 73.820 142.460 1.00 0.00 H TER 55325 WAT 1411 ATOM 55325 O WAT 1412 97.500 30.626 149.575 1.00 0.00 O ATOM 55326 H1 WAT 1412 97.773 29.882 150.112 1.00 0.00 H ATOM 55327 H2 WAT 1412 97.060 31.216 150.187 1.00 0.00 H TER 55329 WAT 1412 ATOM 55329 O WAT 1413 26.188 134.454 81.828 1.00 0.00 O ATOM 55330 H1 WAT 1413 26.299 134.518 80.879 1.00 0.00 H ATOM 55331 H2 WAT 1413 26.278 135.354 82.141 1.00 0.00 H TER 55333 WAT 1413 ATOM 55333 O WAT 1414 104.675 73.809 132.719 1.00 0.00 O ATOM 55334 H1 WAT 1414 104.081 73.232 132.238 1.00 0.00 H ATOM 55335 H2 WAT 1414 104.586 73.537 133.632 1.00 0.00 H TER 55337 WAT 1414 ATOM 55337 O WAT 1415 63.037 91.566 107.707 1.00 0.00 O ATOM 55338 H1 WAT 1415 63.700 92.192 107.997 1.00 0.00 H ATOM 55339 H2 WAT 1415 62.738 91.144 108.512 1.00 0.00 H TER 55341 WAT 1415 ATOM 55341 O WAT 1416 96.419 46.997 148.979 1.00 0.00 O ATOM 55342 H1 WAT 1416 97.105 47.557 148.616 1.00 0.00 H ATOM 55343 H2 WAT 1416 96.893 46.326 149.471 1.00 0.00 H TER 55345 WAT 1416 ATOM 55345 O WAT 1417 75.227 1.677 157.166 1.00 0.00 O ATOM 55346 H1 WAT 1417 75.889 2.167 157.653 1.00 0.00 H ATOM 55347 H2 WAT 1417 75.611 0.807 157.050 1.00 0.00 H TER 55349 WAT 1417 ATOM 55349 O WAT 1418 78.737 98.636 154.084 1.00 0.00 O ATOM 55350 H1 WAT 1418 79.490 98.409 153.538 1.00 0.00 H ATOM 55351 H2 WAT 1418 78.639 99.582 153.976 1.00 0.00 H TER 55353 WAT 1418 ATOM 55353 O WAT 1419 30.153 80.279 81.147 1.00 0.00 O ATOM 55354 H1 WAT 1419 29.246 80.475 81.381 1.00 0.00 H ATOM 55355 H2 WAT 1419 30.676 80.782 81.771 1.00 0.00 H TER 55357 WAT 1419 ATOM 55357 O WAT 1420 24.730 41.202 18.502 1.00 0.00 O ATOM 55358 H1 WAT 1420 25.392 40.514 18.447 1.00 0.00 H ATOM 55359 H2 WAT 1420 25.231 42.018 18.489 1.00 0.00 H TER 55361 WAT 1420 ATOM 55361 O WAT 1421 126.109 93.264 4.329 1.00 0.00 O ATOM 55362 H1 WAT 1421 125.292 93.459 4.788 1.00 0.00 H ATOM 55363 H2 WAT 1421 126.731 93.912 4.660 1.00 0.00 H TER 55365 WAT 1421 ATOM 55365 O WAT 1422 113.965 60.852 2.255 1.00 0.00 O ATOM 55366 H1 WAT 1422 114.165 59.917 2.210 1.00 0.00 H ATOM 55367 H2 WAT 1422 113.361 60.932 2.993 1.00 0.00 H TER 55369 WAT 1422 ATOM 55369 O WAT 1423 75.496 138.030 102.801 1.00 0.00 O ATOM 55370 H1 WAT 1423 75.124 137.402 103.421 1.00 0.00 H ATOM 55371 H2 WAT 1423 76.198 137.548 102.365 1.00 0.00 H TER 55373 WAT 1423 ATOM 55373 O WAT 1424 44.141 53.461 80.952 1.00 0.00 O ATOM 55374 H1 WAT 1424 43.945 54.326 80.593 1.00 0.00 H ATOM 55375 H2 WAT 1424 44.805 53.624 81.622 1.00 0.00 H TER 55377 WAT 1424 ATOM 55377 O WAT 1425 29.457 73.006 151.713 1.00 0.00 O ATOM 55378 H1 WAT 1425 29.200 73.651 152.371 1.00 0.00 H ATOM 55379 H2 WAT 1425 28.935 72.231 151.920 1.00 0.00 H TER 55381 WAT 1425 ATOM 55381 O WAT 1426 139.433 15.502 90.789 1.00 0.00 O ATOM 55382 H1 WAT 1426 139.786 15.102 91.583 1.00 0.00 H ATOM 55383 H2 WAT 1426 138.519 15.219 90.763 1.00 0.00 H TER 55385 WAT 1426 ATOM 55385 O WAT 1427 94.939 13.853 152.520 1.00 0.00 O ATOM 55386 H1 WAT 1427 94.451 14.676 152.525 1.00 0.00 H ATOM 55387 H2 WAT 1427 95.820 14.095 152.805 1.00 0.00 H TER 55389 WAT 1427 ATOM 55389 O WAT 1428 101.488 9.799 107.269 1.00 0.00 O ATOM 55390 H1 WAT 1428 101.643 10.277 108.084 1.00 0.00 H ATOM 55391 H2 WAT 1428 102.339 9.787 106.832 1.00 0.00 H TER 55393 WAT 1428 ATOM 55393 O WAT 1429 56.352 31.961 121.598 1.00 0.00 O ATOM 55394 H1 WAT 1429 56.519 31.026 121.710 1.00 0.00 H ATOM 55395 H2 WAT 1429 55.615 32.144 122.181 1.00 0.00 H TER 55397 WAT 1429 ATOM 55397 O WAT 1430 116.215 110.042 20.620 1.00 0.00 O ATOM 55398 H1 WAT 1430 117.085 110.110 21.012 1.00 0.00 H ATOM 55399 H2 WAT 1430 116.362 109.599 19.784 1.00 0.00 H TER 55401 WAT 1430 ATOM 55401 O WAT 1431 122.988 66.868 63.249 1.00 0.00 O ATOM 55402 H1 WAT 1431 123.887 66.541 63.242 1.00 0.00 H ATOM 55403 H2 WAT 1431 123.012 67.647 62.693 1.00 0.00 H TER 55405 WAT 1431 ATOM 55405 O WAT 1432 50.107 127.785 61.849 1.00 0.00 O ATOM 55406 H1 WAT 1432 49.332 128.300 62.074 1.00 0.00 H ATOM 55407 H2 WAT 1432 50.329 127.321 62.656 1.00 0.00 H TER 55409 WAT 1432 ATOM 55409 O WAT 1433 135.615 34.601 133.603 1.00 0.00 O ATOM 55410 H1 WAT 1433 136.506 34.353 133.849 1.00 0.00 H ATOM 55411 H2 WAT 1433 135.427 35.376 134.133 1.00 0.00 H TER 55413 WAT 1433 ATOM 55413 O WAT 1434 141.708 13.973 144.211 1.00 0.00 O ATOM 55414 H1 WAT 1434 142.553 14.397 144.360 1.00 0.00 H ATOM 55415 H2 WAT 1434 141.062 14.659 144.382 1.00 0.00 H TER 55417 WAT 1434 ATOM 55417 O WAT 1435 45.299 9.772 124.846 1.00 0.00 O ATOM 55418 H1 WAT 1435 45.854 10.552 124.862 1.00 0.00 H ATOM 55419 H2 WAT 1435 44.414 10.110 124.713 1.00 0.00 H TER 55421 WAT 1435 ATOM 55421 O WAT 1436 46.647 8.521 67.606 1.00 0.00 O ATOM 55422 H1 WAT 1436 46.625 9.435 67.889 1.00 0.00 H ATOM 55423 H2 WAT 1436 46.899 8.562 66.683 1.00 0.00 H TER 55425 WAT 1436 ATOM 55425 O WAT 1437 104.719 9.148 140.455 1.00 0.00 O ATOM 55426 H1 WAT 1437 104.497 9.992 140.846 1.00 0.00 H ATOM 55427 H2 WAT 1437 105.606 9.268 140.114 1.00 0.00 H TER 55429 WAT 1437 ATOM 55429 O WAT 1438 35.185 76.643 113.399 1.00 0.00 O ATOM 55430 H1 WAT 1438 35.929 76.936 113.925 1.00 0.00 H ATOM 55431 H2 WAT 1438 35.571 76.070 112.736 1.00 0.00 H TER 55433 WAT 1438 ATOM 55433 O WAT 1439 39.806 26.622 141.258 1.00 0.00 O ATOM 55434 H1 WAT 1439 39.145 27.219 140.908 1.00 0.00 H ATOM 55435 H2 WAT 1439 39.611 25.780 140.846 1.00 0.00 H TER 55437 WAT 1439 ATOM 55437 O WAT 1440 138.541 15.834 61.465 1.00 0.00 O ATOM 55438 H1 WAT 1440 139.097 16.179 60.766 1.00 0.00 H ATOM 55439 H2 WAT 1440 137.682 15.724 61.056 1.00 0.00 H TER 55441 WAT 1440 ATOM 55441 O WAT 1441 86.851 46.181 71.225 1.00 0.00 O ATOM 55442 H1 WAT 1441 87.217 47.066 71.222 1.00 0.00 H ATOM 55443 H2 WAT 1441 85.958 46.290 70.900 1.00 0.00 H TER 55445 WAT 1441 ATOM 55445 O WAT 1442 29.543 46.045 113.165 1.00 0.00 O ATOM 55446 H1 WAT 1442 28.801 46.415 112.687 1.00 0.00 H ATOM 55447 H2 WAT 1442 30.069 46.805 113.415 1.00 0.00 H TER 55449 WAT 1442 ATOM 55449 O WAT 1443 11.732 94.989 125.223 1.00 0.00 O ATOM 55450 H1 WAT 1443 11.486 95.101 124.304 1.00 0.00 H ATOM 55451 H2 WAT 1443 11.022 95.405 125.713 1.00 0.00 H TER 55453 WAT 1443 ATOM 55453 O WAT 1444 141.158 13.529 62.406 1.00 0.00 O ATOM 55454 H1 WAT 1444 140.230 13.420 62.611 1.00 0.00 H ATOM 55455 H2 WAT 1444 141.604 13.407 63.244 1.00 0.00 H TER 55457 WAT 1444 ATOM 55457 O WAT 1445 11.217 60.655 53.348 1.00 0.00 O ATOM 55458 H1 WAT 1445 10.376 60.198 53.372 1.00 0.00 H ATOM 55459 H2 WAT 1445 11.860 59.986 53.580 1.00 0.00 H TER 55461 WAT 1445 ATOM 55461 O WAT 1446 41.010 76.870 95.059 1.00 0.00 O ATOM 55462 H1 WAT 1446 40.315 76.809 94.404 1.00 0.00 H ATOM 55463 H2 WAT 1446 40.737 77.588 95.631 1.00 0.00 H TER 55465 WAT 1446 ATOM 55465 O WAT 1447 26.842 2.455 110.989 1.00 0.00 O ATOM 55466 H1 WAT 1447 27.232 2.493 110.116 1.00 0.00 H ATOM 55467 H2 WAT 1447 27.521 2.798 111.570 1.00 0.00 H TER 55469 WAT 1447 ATOM 55469 O WAT 1448 41.507 59.159 85.905 1.00 0.00 O ATOM 55470 H1 WAT 1448 42.101 59.248 85.160 1.00 0.00 H ATOM 55471 H2 WAT 1448 40.632 59.241 85.525 1.00 0.00 H TER 55473 WAT 1448 ATOM 55473 O WAT 1449 29.928 84.431 149.235 1.00 0.00 O ATOM 55474 H1 WAT 1449 29.967 85.327 148.901 1.00 0.00 H ATOM 55475 H2 WAT 1449 30.344 83.903 148.554 1.00 0.00 H TER 55477 WAT 1449 ATOM 55477 O WAT 1450 80.856 28.864 109.410 1.00 0.00 O ATOM 55478 H1 WAT 1450 80.857 27.959 109.098 1.00 0.00 H ATOM 55479 H2 WAT 1450 81.318 28.829 110.247 1.00 0.00 H TER 55481 WAT 1450 ATOM 55481 O WAT 1451 59.174 60.445 74.313 1.00 0.00 O ATOM 55482 H1 WAT 1451 59.890 60.306 74.932 1.00 0.00 H ATOM 55483 H2 WAT 1451 59.443 59.973 73.524 1.00 0.00 H TER 55485 WAT 1451 ATOM 55485 O WAT 1452 83.561 116.643 97.801 1.00 0.00 O ATOM 55486 H1 WAT 1452 83.250 115.750 97.948 1.00 0.00 H ATOM 55487 H2 WAT 1452 82.914 117.027 97.209 1.00 0.00 H TER 55489 WAT 1452 ATOM 55489 O WAT 1453 102.058 123.378 7.377 1.00 0.00 O ATOM 55490 H1 WAT 1453 101.122 123.431 7.571 1.00 0.00 H ATOM 55491 H2 WAT 1453 102.413 122.812 8.062 1.00 0.00 H TER 55493 WAT 1453 ATOM 55493 O WAT 1454 19.593 56.080 83.027 1.00 0.00 O ATOM 55494 H1 WAT 1454 19.250 55.427 83.637 1.00 0.00 H ATOM 55495 H2 WAT 1454 18.836 56.335 82.500 1.00 0.00 H TER 55497 WAT 1454 ATOM 55497 O WAT 1455 104.402 104.511 77.890 1.00 0.00 O ATOM 55498 H1 WAT 1455 104.051 104.867 78.706 1.00 0.00 H ATOM 55499 H2 WAT 1455 105.303 104.268 78.103 1.00 0.00 H TER 55501 WAT 1455 ATOM 55501 O WAT 1456 39.709 142.808 128.365 1.00 0.00 O ATOM 55502 H1 WAT 1456 38.926 143.138 127.925 1.00 0.00 H ATOM 55503 H2 WAT 1456 40.059 143.567 128.832 1.00 0.00 H TER 55505 WAT 1456 ATOM 55505 O WAT 1457 104.446 18.625 72.340 1.00 0.00 O ATOM 55506 H1 WAT 1457 103.778 19.019 71.779 1.00 0.00 H ATOM 55507 H2 WAT 1457 104.054 17.805 72.640 1.00 0.00 H TER 55509 WAT 1457 ATOM 55509 O WAT 1458 54.176 60.918 100.495 1.00 0.00 O ATOM 55510 H1 WAT 1458 54.943 61.285 100.055 1.00 0.00 H ATOM 55511 H2 WAT 1458 54.140 61.376 101.335 1.00 0.00 H TER 55513 WAT 1458 ATOM 55513 O WAT 1459 60.418 71.763 75.131 1.00 0.00 O ATOM 55514 H1 WAT 1459 59.908 71.757 75.941 1.00 0.00 H ATOM 55515 H2 WAT 1459 61.312 71.958 75.412 1.00 0.00 H TER 55517 WAT 1459 ATOM 55517 O WAT 1460 33.454 109.608 102.674 1.00 0.00 O ATOM 55518 H1 WAT 1460 33.950 110.369 102.371 1.00 0.00 H ATOM 55519 H2 WAT 1460 33.374 109.736 103.620 1.00 0.00 H TER 55521 WAT 1460 ATOM 55521 O WAT 1461 50.809 82.067 125.407 1.00 0.00 O ATOM 55522 H1 WAT 1461 50.820 82.834 124.834 1.00 0.00 H ATOM 55523 H2 WAT 1461 50.126 81.505 125.042 1.00 0.00 H TER 55525 WAT 1461 ATOM 55525 O WAT 1462 69.186 31.333 90.794 1.00 0.00 O ATOM 55526 H1 WAT 1462 69.798 30.651 91.072 1.00 0.00 H ATOM 55527 H2 WAT 1462 68.583 30.886 90.200 1.00 0.00 H TER 55529 WAT 1462 ATOM 55529 O WAT 1463 5.555 32.522 110.243 1.00 0.00 O ATOM 55530 H1 WAT 1463 5.807 33.362 110.626 1.00 0.00 H ATOM 55531 H2 WAT 1463 5.676 32.642 109.302 1.00 0.00 H TER 55533 WAT 1463 ATOM 55533 O WAT 1464 85.068 47.304 109.140 1.00 0.00 O ATOM 55534 H1 WAT 1464 85.454 47.466 110.001 1.00 0.00 H ATOM 55535 H2 WAT 1464 84.800 48.170 108.831 1.00 0.00 H TER 55537 WAT 1464 ATOM 55537 O WAT 1465 14.194 20.666 141.016 1.00 0.00 O ATOM 55538 H1 WAT 1465 14.097 21.306 141.721 1.00 0.00 H ATOM 55539 H2 WAT 1465 13.439 20.086 141.113 1.00 0.00 H TER 55541 WAT 1465 ATOM 55541 O WAT 1466 132.132 130.399 68.666 1.00 0.00 O ATOM 55542 H1 WAT 1466 131.974 130.074 67.780 1.00 0.00 H ATOM 55543 H2 WAT 1466 131.634 129.809 69.231 1.00 0.00 H TER 55545 WAT 1466 ATOM 55545 O WAT 1467 31.766 37.569 4.884 1.00 0.00 O ATOM 55546 H1 WAT 1467 31.485 38.366 5.332 1.00 0.00 H ATOM 55547 H2 WAT 1467 30.955 37.087 4.720 1.00 0.00 H TER 55549 WAT 1467 ATOM 55549 O WAT 1468 53.088 52.335 121.990 1.00 0.00 O ATOM 55550 H1 WAT 1468 52.765 52.133 122.867 1.00 0.00 H ATOM 55551 H2 WAT 1468 53.878 52.855 122.139 1.00 0.00 H TER 55553 WAT 1468 ATOM 55553 O WAT 1469 6.833 103.516 54.972 1.00 0.00 O ATOM 55554 H1 WAT 1469 7.296 104.090 55.581 1.00 0.00 H ATOM 55555 H2 WAT 1469 6.819 102.664 55.408 1.00 0.00 H TER 55557 WAT 1469 ATOM 55557 O WAT 1470 61.673 54.134 118.950 1.00 0.00 O ATOM 55558 H1 WAT 1470 61.603 53.245 119.298 1.00 0.00 H ATOM 55559 H2 WAT 1470 61.941 54.664 119.701 1.00 0.00 H TER 55561 WAT 1470 ATOM 55561 O WAT 1471 100.366 90.102 65.602 1.00 0.00 O ATOM 55562 H1 WAT 1471 99.809 90.861 65.428 1.00 0.00 H ATOM 55563 H2 WAT 1471 100.136 89.476 64.915 1.00 0.00 H TER 55565 WAT 1471 ATOM 55565 O WAT 1472 71.865 37.326 78.449 1.00 0.00 O ATOM 55566 H1 WAT 1472 71.655 37.612 77.560 1.00 0.00 H ATOM 55567 H2 WAT 1472 71.333 36.541 78.580 1.00 0.00 H TER 55569 WAT 1472 ATOM 55569 O WAT 1473 125.355 9.746 96.317 1.00 0.00 O ATOM 55570 H1 WAT 1473 125.153 10.656 96.537 1.00 0.00 H ATOM 55571 H2 WAT 1473 124.679 9.497 95.687 1.00 0.00 H TER 55573 WAT 1473 ATOM 55573 O WAT 1474 136.294 110.238 75.935 1.00 0.00 O ATOM 55574 H1 WAT 1474 136.401 109.292 75.839 1.00 0.00 H ATOM 55575 H2 WAT 1474 135.670 110.480 75.250 1.00 0.00 H TER 55577 WAT 1474 ATOM 55577 O WAT 1475 20.614 127.811 67.095 1.00 0.00 O ATOM 55578 H1 WAT 1475 19.997 128.517 67.288 1.00 0.00 H ATOM 55579 H2 WAT 1475 21.337 127.951 67.707 1.00 0.00 H TER 55581 WAT 1475 ATOM 55581 O WAT 1476 62.798 142.271 20.458 1.00 0.00 O ATOM 55582 H1 WAT 1476 63.376 142.097 21.201 1.00 0.00 H ATOM 55583 H2 WAT 1476 63.393 142.435 19.726 1.00 0.00 H TER 55585 WAT 1476 ATOM 55585 O WAT 1477 88.351 121.197 107.486 1.00 0.00 O ATOM 55586 H1 WAT 1477 88.371 120.346 107.924 1.00 0.00 H ATOM 55587 H2 WAT 1477 87.494 121.560 107.706 1.00 0.00 H TER 55589 WAT 1477 ATOM 55589 O WAT 1478 75.676 102.854 13.132 1.00 0.00 O ATOM 55590 H1 WAT 1478 75.241 103.263 12.384 1.00 0.00 H ATOM 55591 H2 WAT 1478 76.352 103.481 13.389 1.00 0.00 H TER 55593 WAT 1478 ATOM 55593 O WAT 1479 9.875 91.566 158.786 1.00 0.00 O ATOM 55594 H1 WAT 1479 9.923 92.023 157.946 1.00 0.00 H ATOM 55595 H2 WAT 1479 10.359 92.127 159.392 1.00 0.00 H TER 55597 WAT 1479 ATOM 55597 O WAT 1480 31.609 133.251 8.656 1.00 0.00 O ATOM 55598 H1 WAT 1480 31.934 133.956 9.217 1.00 0.00 H ATOM 55599 H2 WAT 1480 31.737 132.456 9.172 1.00 0.00 H TER 55601 WAT 1480 ATOM 55601 O WAT 1481 85.609 49.672 93.094 1.00 0.00 O ATOM 55602 H1 WAT 1481 86.555 49.647 93.244 1.00 0.00 H ATOM 55603 H2 WAT 1481 85.513 50.102 92.245 1.00 0.00 H TER 55605 WAT 1481 ATOM 55605 O WAT 1482 144.248 77.044 103.452 1.00 0.00 O ATOM 55606 H1 WAT 1482 143.872 76.515 104.156 1.00 0.00 H ATOM 55607 H2 WAT 1482 143.925 77.929 103.619 1.00 0.00 H TER 55609 WAT 1482 ATOM 55609 O WAT 1483 64.895 135.934 81.045 1.00 0.00 O ATOM 55610 H1 WAT 1483 64.544 135.155 81.475 1.00 0.00 H ATOM 55611 H2 WAT 1483 65.602 135.604 80.490 1.00 0.00 H TER 55613 WAT 1483 ATOM 55613 O WAT 1484 121.083 24.238 98.677 1.00 0.00 O ATOM 55614 H1 WAT 1484 120.441 24.932 98.531 1.00 0.00 H ATOM 55615 H2 WAT 1484 120.695 23.463 98.271 1.00 0.00 H TER 55617 WAT 1484 ATOM 55617 O WAT 1485 140.861 5.402 8.925 1.00 0.00 O ATOM 55618 H1 WAT 1485 141.468 4.695 9.144 1.00 0.00 H ATOM 55619 H2 WAT 1485 140.163 4.974 8.430 1.00 0.00 H TER 55621 WAT 1485 ATOM 55621 O WAT 1486 81.344 12.108 154.467 1.00 0.00 O ATOM 55622 H1 WAT 1486 82.095 12.621 154.765 1.00 0.00 H ATOM 55623 H2 WAT 1486 81.636 11.198 154.533 1.00 0.00 H TER 55625 WAT 1486 ATOM 55625 O WAT 1487 110.278 103.997 73.139 1.00 0.00 O ATOM 55626 H1 WAT 1487 109.347 103.983 73.361 1.00 0.00 H ATOM 55627 H2 WAT 1487 110.399 104.820 72.666 1.00 0.00 H TER 55629 WAT 1487 ATOM 55629 O WAT 1488 109.114 97.483 114.462 1.00 0.00 O ATOM 55630 H1 WAT 1488 108.734 97.875 113.676 1.00 0.00 H ATOM 55631 H2 WAT 1488 109.964 97.148 114.176 1.00 0.00 H TER 55633 WAT 1488 ATOM 55633 O WAT 1489 118.895 1.115 24.781 1.00 0.00 O ATOM 55634 H1 WAT 1489 119.804 0.876 24.959 1.00 0.00 H ATOM 55635 H2 WAT 1489 118.796 1.985 25.167 1.00 0.00 H TER 55637 WAT 1489 ATOM 55637 O WAT 1490 24.562 125.448 112.808 1.00 0.00 O ATOM 55638 H1 WAT 1490 25.307 125.216 112.254 1.00 0.00 H ATOM 55639 H2 WAT 1490 23.834 125.560 112.197 1.00 0.00 H TER 55641 WAT 1490 ATOM 55641 O WAT 1491 93.741 66.334 148.485 1.00 0.00 O ATOM 55642 H1 WAT 1491 93.445 66.984 147.848 1.00 0.00 H ATOM 55643 H2 WAT 1491 93.906 65.547 147.965 1.00 0.00 H TER 55645 WAT 1491 ATOM 55645 O WAT 1492 54.944 18.002 10.222 1.00 0.00 O ATOM 55646 H1 WAT 1492 54.836 18.250 9.304 1.00 0.00 H ATOM 55647 H2 WAT 1492 54.295 18.526 10.690 1.00 0.00 H TER 55649 WAT 1492 ATOM 55649 O WAT 1493 129.908 138.695 67.467 1.00 0.00 O ATOM 55650 H1 WAT 1493 130.211 138.227 66.688 1.00 0.00 H ATOM 55651 H2 WAT 1493 130.416 139.506 67.472 1.00 0.00 H TER 55653 WAT 1493 ATOM 55653 O WAT 1494 50.090 80.578 3.214 1.00 0.00 O ATOM 55654 H1 WAT 1494 49.599 79.757 3.204 1.00 0.00 H ATOM 55655 H2 WAT 1494 50.431 80.664 2.323 1.00 0.00 H TER 55657 WAT 1494 ATOM 55657 O WAT 1495 89.246 17.881 0.980 1.00 0.00 O ATOM 55658 H1 WAT 1495 89.291 18.722 0.526 1.00 0.00 H ATOM 55659 H2 WAT 1495 88.441 17.477 0.655 1.00 0.00 H TER 55661 WAT 1495 ATOM 55661 O WAT 1496 113.615 68.615 18.285 1.00 0.00 O ATOM 55662 H1 WAT 1496 114.121 68.927 19.035 1.00 0.00 H ATOM 55663 H2 WAT 1496 112.748 68.425 18.643 1.00 0.00 H TER 55665 WAT 1496 ATOM 55665 O WAT 1497 7.573 7.137 157.518 1.00 0.00 O ATOM 55666 H1 WAT 1497 7.718 7.708 158.272 1.00 0.00 H ATOM 55667 H2 WAT 1497 8.253 6.467 157.591 1.00 0.00 H TER 55669 WAT 1497 ATOM 55669 O WAT 1498 100.816 98.996 119.120 1.00 0.00 O ATOM 55670 H1 WAT 1498 100.548 98.956 118.202 1.00 0.00 H ATOM 55671 H2 WAT 1498 101.773 98.972 119.092 1.00 0.00 H TER 55673 WAT 1498 ATOM 55673 O WAT 1499 118.444 141.395 103.744 1.00 0.00 O ATOM 55674 H1 WAT 1499 118.903 142.091 104.215 1.00 0.00 H ATOM 55675 H2 WAT 1499 118.731 141.491 102.836 1.00 0.00 H TER 55677 WAT 1499 ATOM 55677 O WAT 1500 139.097 79.381 66.105 1.00 0.00 O ATOM 55678 H1 WAT 1500 138.506 80.132 66.054 1.00 0.00 H ATOM 55679 H2 WAT 1500 139.666 79.470 65.341 1.00 0.00 H TER 55681 WAT 1500 ATOM 55681 O WAT 1501 20.983 56.255 13.926 1.00 0.00 O ATOM 55682 H1 WAT 1501 21.224 55.487 13.409 1.00 0.00 H ATOM 55683 H2 WAT 1501 20.954 55.937 14.828 1.00 0.00 H TER 55685 WAT 1501 ATOM 55685 O WAT 1502 71.174 93.378 118.981 1.00 0.00 O ATOM 55686 H1 WAT 1502 71.635 92.740 119.526 1.00 0.00 H ATOM 55687 H2 WAT 1502 71.871 93.874 118.551 1.00 0.00 H TER 55689 WAT 1502 ATOM 55689 O WAT 1503 69.459 122.942 90.039 1.00 0.00 O ATOM 55690 H1 WAT 1503 69.803 123.835 90.068 1.00 0.00 H ATOM 55691 H2 WAT 1503 70.213 122.388 90.244 1.00 0.00 H TER 55693 WAT 1503 ATOM 55693 O WAT 1504 136.746 9.459 133.051 1.00 0.00 O ATOM 55694 H1 WAT 1504 135.940 9.225 133.511 1.00 0.00 H ATOM 55695 H2 WAT 1504 137.034 10.270 133.469 1.00 0.00 H TER 55697 WAT 1504 ATOM 55697 O WAT 1505 22.742 51.316 7.192 1.00 0.00 O ATOM 55698 H1 WAT 1505 22.767 52.204 6.835 1.00 0.00 H ATOM 55699 H2 WAT 1505 22.793 51.439 8.140 1.00 0.00 H TER 55701 WAT 1505 ATOM 55701 O WAT 1506 7.839 99.038 142.792 1.00 0.00 O ATOM 55702 H1 WAT 1506 8.580 98.881 142.206 1.00 0.00 H ATOM 55703 H2 WAT 1506 8.060 99.852 143.245 1.00 0.00 H TER 55705 WAT 1506 ATOM 55705 O WAT 1507 19.512 12.279 106.494 1.00 0.00 O ATOM 55706 H1 WAT 1507 18.638 11.964 106.725 1.00 0.00 H ATOM 55707 H2 WAT 1507 20.046 11.486 106.440 1.00 0.00 H TER 55709 WAT 1507 ATOM 55709 O WAT 1508 83.201 55.072 126.581 1.00 0.00 O ATOM 55710 H1 WAT 1508 82.502 54.542 126.197 1.00 0.00 H ATOM 55711 H2 WAT 1508 83.169 55.897 126.098 1.00 0.00 H TER 55713 WAT 1508 ATOM 55713 O WAT 1509 131.968 16.397 84.887 1.00 0.00 O ATOM 55714 H1 WAT 1509 132.824 16.396 85.315 1.00 0.00 H ATOM 55715 H2 WAT 1509 132.106 15.911 84.074 1.00 0.00 H TER 55717 WAT 1509 ATOM 55717 O WAT 1510 48.347 112.934 66.716 1.00 0.00 O ATOM 55718 H1 WAT 1510 48.665 113.120 65.832 1.00 0.00 H ATOM 55719 H2 WAT 1510 49.037 113.263 67.292 1.00 0.00 H TER 55721 WAT 1510 ATOM 55721 O WAT 1511 99.510 35.183 17.634 1.00 0.00 O ATOM 55722 H1 WAT 1511 98.669 35.205 18.091 1.00 0.00 H ATOM 55723 H2 WAT 1511 99.948 35.992 17.897 1.00 0.00 H TER 55725 WAT 1511 ATOM 55725 O WAT 1512 115.865 38.086 82.516 1.00 0.00 O ATOM 55726 H1 WAT 1512 115.407 37.795 83.305 1.00 0.00 H ATOM 55727 H2 WAT 1512 116.058 39.010 82.679 1.00 0.00 H TER 55729 WAT 1512 ATOM 55729 O WAT 1513 45.287 140.050 84.570 1.00 0.00 O ATOM 55730 H1 WAT 1513 45.291 139.962 85.523 1.00 0.00 H ATOM 55731 H2 WAT 1513 44.719 139.342 84.266 1.00 0.00 H TER 55733 WAT 1513 ATOM 55733 O WAT 1514 79.000 44.263 84.484 1.00 0.00 O ATOM 55734 H1 WAT 1514 79.069 45.195 84.278 1.00 0.00 H ATOM 55735 H2 WAT 1514 78.495 43.894 83.759 1.00 0.00 H TER 55737 WAT 1514 ATOM 55737 O WAT 1515 38.096 26.293 12.685 1.00 0.00 O ATOM 55738 H1 WAT 1515 37.366 26.783 13.064 1.00 0.00 H ATOM 55739 H2 WAT 1515 38.770 26.305 13.365 1.00 0.00 H TER 55741 WAT 1515 ATOM 55741 O WAT 1516 16.384 45.468 5.009 1.00 0.00 O ATOM 55742 H1 WAT 1516 16.147 45.401 4.084 1.00 0.00 H ATOM 55743 H2 WAT 1516 15.969 46.279 5.304 1.00 0.00 H TER 55745 WAT 1516 ATOM 55745 O WAT 1517 22.991 82.576 136.528 1.00 0.00 O ATOM 55746 H1 WAT 1517 23.574 83.335 136.559 1.00 0.00 H ATOM 55747 H2 WAT 1517 23.441 81.952 135.958 1.00 0.00 H TER 55749 WAT 1517 ATOM 55749 O WAT 1518 40.389 68.627 134.752 1.00 0.00 O ATOM 55750 H1 WAT 1518 39.591 69.021 135.105 1.00 0.00 H ATOM 55751 H2 WAT 1518 40.310 67.697 134.963 1.00 0.00 H TER 55753 WAT 1518 ATOM 55753 O WAT 1519 23.183 115.706 114.182 1.00 0.00 O ATOM 55754 H1 WAT 1519 24.136 115.751 114.255 1.00 0.00 H ATOM 55755 H2 WAT 1519 23.015 115.713 113.239 1.00 0.00 H TER 55757 WAT 1519 ATOM 55757 O WAT 1520 107.542 98.669 104.858 1.00 0.00 O ATOM 55758 H1 WAT 1520 108.049 98.865 104.070 1.00 0.00 H ATOM 55759 H2 WAT 1520 108.040 97.980 105.298 1.00 0.00 H TER 55761 WAT 1520 ATOM 55761 O WAT 1521 78.378 131.796 16.917 1.00 0.00 O ATOM 55762 H1 WAT 1521 77.692 131.133 16.831 1.00 0.00 H ATOM 55763 H2 WAT 1521 79.179 131.293 17.065 1.00 0.00 H TER 55765 WAT 1521 ATOM 55765 O WAT 1522 18.325 92.411 85.750 1.00 0.00 O ATOM 55766 H1 WAT 1522 17.661 92.007 86.309 1.00 0.00 H ATOM 55767 H2 WAT 1522 17.836 92.740 84.996 1.00 0.00 H TER 55769 WAT 1522 ATOM 55769 O WAT 1523 61.587 135.855 97.792 1.00 0.00 O ATOM 55770 H1 WAT 1523 61.289 136.649 98.234 1.00 0.00 H ATOM 55771 H2 WAT 1523 61.146 135.143 98.255 1.00 0.00 H TER 55773 WAT 1523 ATOM 55773 O WAT 1524 43.114 117.209 156.082 1.00 0.00 O ATOM 55774 H1 WAT 1524 43.893 117.008 155.563 1.00 0.00 H ATOM 55775 H2 WAT 1524 43.345 118.003 156.563 1.00 0.00 H TER 55777 WAT 1524 ATOM 55777 O WAT 1525 115.782 24.819 23.127 1.00 0.00 O ATOM 55778 H1 WAT 1525 115.315 25.054 22.326 1.00 0.00 H ATOM 55779 H2 WAT 1525 115.529 23.911 23.295 1.00 0.00 H TER 55781 WAT 1525 ATOM 55781 O WAT 1526 94.632 93.778 80.412 1.00 0.00 O ATOM 55782 H1 WAT 1526 94.364 94.674 80.209 1.00 0.00 H ATOM 55783 H2 WAT 1526 93.889 93.407 80.887 1.00 0.00 H TER 55785 WAT 1526 ATOM 55785 O WAT 1527 57.179 19.796 9.991 1.00 0.00 O ATOM 55786 H1 WAT 1527 57.076 20.179 10.862 1.00 0.00 H ATOM 55787 H2 WAT 1527 56.590 19.041 9.990 1.00 0.00 H TER 55789 WAT 1527 ATOM 55789 O WAT 1528 85.875 94.383 67.527 1.00 0.00 O ATOM 55790 H1 WAT 1528 86.311 94.197 66.696 1.00 0.00 H ATOM 55791 H2 WAT 1528 85.184 93.723 67.588 1.00 0.00 H TER 55793 WAT 1528 ATOM 55793 O WAT 1529 22.903 108.329 87.567 1.00 0.00 O ATOM 55794 H1 WAT 1529 22.969 107.668 86.878 1.00 0.00 H ATOM 55795 H2 WAT 1529 22.411 109.045 87.166 1.00 0.00 H TER 55797 WAT 1529 ATOM 55797 O WAT 1530 117.304 23.374 132.513 1.00 0.00 O ATOM 55798 H1 WAT 1530 117.414 23.495 131.570 1.00 0.00 H ATOM 55799 H2 WAT 1530 116.971 24.216 132.825 1.00 0.00 H TER 55801 WAT 1530 ATOM 55801 O WAT 1531 141.094 130.034 157.228 1.00 0.00 O ATOM 55802 H1 WAT 1531 140.213 129.884 156.885 1.00 0.00 H ATOM 55803 H2 WAT 1531 141.321 129.216 157.670 1.00 0.00 H TER 55805 WAT 1531 ATOM 55805 O WAT 1532 11.385 16.789 127.890 1.00 0.00 O ATOM 55806 H1 WAT 1532 10.963 17.413 127.300 1.00 0.00 H ATOM 55807 H2 WAT 1532 12.263 17.146 128.027 1.00 0.00 H TER 55809 WAT 1532 ATOM 55809 O WAT 1533 18.753 95.615 75.555 1.00 0.00 O ATOM 55810 H1 WAT 1533 19.443 95.280 74.983 1.00 0.00 H ATOM 55811 H2 WAT 1533 18.949 96.547 75.646 1.00 0.00 H TER 55813 WAT 1533 ATOM 55813 O WAT 1534 135.148 77.550 78.597 1.00 0.00 O ATOM 55814 H1 WAT 1534 134.465 77.129 78.076 1.00 0.00 H ATOM 55815 H2 WAT 1534 135.861 77.706 77.977 1.00 0.00 H TER 55817 WAT 1534 ATOM 55817 O WAT 1535 4.167 137.414 15.244 1.00 0.00 O ATOM 55818 H1 WAT 1535 4.508 138.287 15.437 1.00 0.00 H ATOM 55819 H2 WAT 1535 4.616 136.839 15.864 1.00 0.00 H TER 55821 WAT 1535 ATOM 55821 O WAT 1536 76.164 81.650 102.398 1.00 0.00 O ATOM 55822 H1 WAT 1536 75.489 81.813 103.057 1.00 0.00 H ATOM 55823 H2 WAT 1536 75.755 81.040 101.783 1.00 0.00 H TER 55825 WAT 1536 ATOM 55825 O WAT 1537 41.260 31.967 108.512 1.00 0.00 O ATOM 55826 H1 WAT 1537 41.805 32.277 107.788 1.00 0.00 H ATOM 55827 H2 WAT 1537 41.878 31.566 109.123 1.00 0.00 H TER 55829 WAT 1537 ATOM 55829 O WAT 1538 134.980 6.995 59.724 1.00 0.00 O ATOM 55830 H1 WAT 1538 135.291 7.530 60.454 1.00 0.00 H ATOM 55831 H2 WAT 1538 134.320 6.421 60.112 1.00 0.00 H TER 55833 WAT 1538 ATOM 55833 O WAT 1539 144.137 109.107 75.615 1.00 0.00 O ATOM 55834 H1 WAT 1539 143.331 109.429 75.210 1.00 0.00 H ATOM 55835 H2 WAT 1539 143.837 108.557 76.339 1.00 0.00 H TER 55837 WAT 1539 ATOM 55837 O WAT 1540 54.170 1.023 117.409 1.00 0.00 O ATOM 55838 H1 WAT 1540 53.300 1.249 117.738 1.00 0.00 H ATOM 55839 H2 WAT 1540 54.492 0.358 118.017 1.00 0.00 H TER 55841 WAT 1540 ATOM 55841 O WAT 1541 89.962 144.162 92.567 1.00 0.00 O ATOM 55842 H1 WAT 1541 90.627 144.322 91.898 1.00 0.00 H ATOM 55843 H2 WAT 1541 89.155 144.016 92.073 1.00 0.00 H TER 55845 WAT 1541 ATOM 55845 O WAT 1542 68.148 83.999 126.617 1.00 0.00 O ATOM 55846 H1 WAT 1542 69.066 84.011 126.346 1.00 0.00 H ATOM 55847 H2 WAT 1542 68.178 83.795 127.552 1.00 0.00 H TER 55849 WAT 1542 ATOM 55849 O WAT 1543 61.661 11.012 57.625 1.00 0.00 O ATOM 55850 H1 WAT 1543 61.008 10.476 57.176 1.00 0.00 H ATOM 55851 H2 WAT 1543 61.484 10.877 58.556 1.00 0.00 H TER 55853 WAT 1543 ATOM 55853 O WAT 1544 135.802 75.932 58.511 1.00 0.00 O ATOM 55854 H1 WAT 1544 135.168 75.502 59.085 1.00 0.00 H ATOM 55855 H2 WAT 1544 136.426 75.242 58.284 1.00 0.00 H TER 55857 WAT 1544 ATOM 55857 O WAT 1545 99.337 45.678 93.294 1.00 0.00 O ATOM 55858 H1 WAT 1545 100.222 45.532 93.628 1.00 0.00 H ATOM 55859 H2 WAT 1545 99.228 46.629 93.310 1.00 0.00 H TER 55861 WAT 1545 ATOM 55861 O WAT 1546 77.631 114.556 118.144 1.00 0.00 O ATOM 55862 H1 WAT 1546 78.376 114.783 117.588 1.00 0.00 H ATOM 55863 H2 WAT 1546 78.002 113.995 118.825 1.00 0.00 H TER 55865 WAT 1546 ATOM 55865 O WAT 1547 106.153 107.748 155.872 1.00 0.00 O ATOM 55866 H1 WAT 1547 107.087 107.936 155.783 1.00 0.00 H ATOM 55867 H2 WAT 1547 105.960 107.924 156.793 1.00 0.00 H TER 55869 WAT 1547 ATOM 55869 O WAT 1548 15.943 44.936 121.304 1.00 0.00 O ATOM 55870 H1 WAT 1548 16.153 45.868 121.252 1.00 0.00 H ATOM 55871 H2 WAT 1548 16.792 44.503 121.395 1.00 0.00 H TER 55873 WAT 1548 ATOM 55873 O WAT 1549 126.812 100.065 119.361 1.00 0.00 O ATOM 55874 H1 WAT 1549 126.284 99.474 119.896 1.00 0.00 H ATOM 55875 H2 WAT 1549 126.172 100.567 118.856 1.00 0.00 H TER 55877 WAT 1549 ATOM 55877 O WAT 1550 129.486 131.107 3.885 1.00 0.00 O ATOM 55878 H1 WAT 1550 129.317 130.628 4.697 1.00 0.00 H ATOM 55879 H2 WAT 1550 129.494 130.432 3.206 1.00 0.00 H TER 55881 WAT 1550 ATOM 55881 O WAT 1551 20.564 43.053 61.128 1.00 0.00 O ATOM 55882 H1 WAT 1551 20.036 42.495 60.558 1.00 0.00 H ATOM 55883 H2 WAT 1551 19.924 43.537 61.650 1.00 0.00 H TER 55885 WAT 1551 ATOM 55885 O WAT 1552 138.990 37.326 94.556 1.00 0.00 O ATOM 55886 H1 WAT 1552 139.040 38.195 94.157 1.00 0.00 H ATOM 55887 H2 WAT 1552 138.079 37.059 94.434 1.00 0.00 H TER 55889 WAT 1552 ATOM 55889 O WAT 1553 141.938 43.556 111.887 1.00 0.00 O ATOM 55890 H1 WAT 1553 142.416 43.952 111.159 1.00 0.00 H ATOM 55891 H2 WAT 1553 141.129 43.230 111.494 1.00 0.00 H TER 55893 WAT 1553 ATOM 55893 O WAT 1554 91.976 47.824 126.790 1.00 0.00 O ATOM 55894 H1 WAT 1554 92.011 46.987 127.253 1.00 0.00 H ATOM 55895 H2 WAT 1554 92.071 47.590 125.866 1.00 0.00 H TER 55897 WAT 1554 ATOM 55897 O WAT 1555 63.858 27.911 149.544 1.00 0.00 O ATOM 55898 H1 WAT 1555 63.967 28.031 148.601 1.00 0.00 H ATOM 55899 H2 WAT 1555 63.343 27.108 149.624 1.00 0.00 H TER 55901 WAT 1555 ATOM 55901 O WAT 1556 19.412 87.101 153.391 1.00 0.00 O ATOM 55902 H1 WAT 1556 20.358 86.994 153.491 1.00 0.00 H ATOM 55903 H2 WAT 1556 19.117 86.274 153.010 1.00 0.00 H TER 55905 WAT 1556 ATOM 55905 O WAT 1557 132.220 125.678 71.820 1.00 0.00 O ATOM 55906 H1 WAT 1557 131.315 125.990 71.840 1.00 0.00 H ATOM 55907 H2 WAT 1557 132.742 126.466 71.664 1.00 0.00 H TER 55909 WAT 1557 ATOM 55909 O WAT 1558 88.542 89.673 114.828 1.00 0.00 O ATOM 55910 H1 WAT 1558 88.246 89.926 113.954 1.00 0.00 H ATOM 55911 H2 WAT 1558 87.748 89.379 115.274 1.00 0.00 H TER 55913 WAT 1558 ATOM 55913 O WAT 1559 60.441 35.467 3.986 1.00 0.00 O ATOM 55914 H1 WAT 1559 60.704 34.993 3.197 1.00 0.00 H ATOM 55915 H2 WAT 1559 59.881 36.174 3.665 1.00 0.00 H TER 55917 WAT 1559 ATOM 55917 O WAT 1560 140.077 50.666 0.832 1.00 0.00 O ATOM 55918 H1 WAT 1560 140.831 51.196 0.571 1.00 0.00 H ATOM 55919 H2 WAT 1560 139.619 51.203 1.478 1.00 0.00 H TER 55921 WAT 1560 ATOM 55921 O WAT 1561 92.232 77.759 64.906 1.00 0.00 O ATOM 55922 H1 WAT 1561 91.961 77.599 65.810 1.00 0.00 H ATOM 55923 H2 WAT 1561 91.602 78.401 64.578 1.00 0.00 H TER 55925 WAT 1561 ATOM 55925 O WAT 1562 83.679 24.342 58.261 1.00 0.00 O ATOM 55926 H1 WAT 1562 83.973 25.194 58.586 1.00 0.00 H ATOM 55927 H2 WAT 1562 83.701 24.429 57.308 1.00 0.00 H TER 55929 WAT 1562 ATOM 55929 O WAT 1563 116.118 52.516 7.859 1.00 0.00 O ATOM 55930 H1 WAT 1563 116.118 52.358 8.803 1.00 0.00 H ATOM 55931 H2 WAT 1563 115.425 51.950 7.521 1.00 0.00 H TER 55933 WAT 1563 ATOM 55933 O WAT 1564 85.050 143.489 126.355 1.00 0.00 O ATOM 55934 H1 WAT 1564 85.015 142.619 126.752 1.00 0.00 H ATOM 55935 H2 WAT 1564 85.224 144.080 127.088 1.00 0.00 H TER 55937 WAT 1564 ATOM 55937 O WAT 1565 109.452 20.502 118.766 1.00 0.00 O ATOM 55938 H1 WAT 1565 110.113 19.990 119.232 1.00 0.00 H ATOM 55939 H2 WAT 1565 108.618 20.121 119.038 1.00 0.00 H TER 55941 WAT 1565 ATOM 55941 O WAT 1566 46.506 18.702 157.470 1.00 0.00 O ATOM 55942 H1 WAT 1566 45.720 18.998 157.928 1.00 0.00 H ATOM 55943 H2 WAT 1566 46.265 18.720 156.544 1.00 0.00 H TER 55945 WAT 1566 ATOM 55945 O WAT 1567 131.545 47.731 15.219 1.00 0.00 O ATOM 55946 H1 WAT 1567 130.791 47.999 14.694 1.00 0.00 H ATOM 55947 H2 WAT 1567 131.559 48.349 15.950 1.00 0.00 H TER 55949 WAT 1567 ATOM 55949 O WAT 1568 128.040 17.725 121.917 1.00 0.00 O ATOM 55950 H1 WAT 1568 127.615 16.953 121.544 1.00 0.00 H ATOM 55951 H2 WAT 1568 127.806 17.701 122.845 1.00 0.00 H TER 55953 WAT 1568 ATOM 55953 O WAT 1569 132.509 140.192 124.764 1.00 0.00 O ATOM 55954 H1 WAT 1569 133.342 140.644 124.895 1.00 0.00 H ATOM 55955 H2 WAT 1569 131.846 140.828 125.032 1.00 0.00 H TER 55957 WAT 1569 ATOM 55957 O WAT 1570 42.096 20.567 112.452 1.00 0.00 O ATOM 55958 H1 WAT 1570 41.944 19.815 113.024 1.00 0.00 H ATOM 55959 H2 WAT 1570 41.906 21.328 113.001 1.00 0.00 H TER 55961 WAT 1570 ATOM 55961 O WAT 1571 125.987 82.420 66.004 1.00 0.00 O ATOM 55962 H1 WAT 1571 126.881 82.696 65.803 1.00 0.00 H ATOM 55963 H2 WAT 1571 125.617 83.151 66.499 1.00 0.00 H TER 55965 WAT 1571 ATOM 55965 O WAT 1572 75.594 50.328 124.373 1.00 0.00 O ATOM 55966 H1 WAT 1572 75.369 49.623 124.980 1.00 0.00 H ATOM 55967 H2 WAT 1572 74.982 50.221 123.645 1.00 0.00 H TER 55969 WAT 1572 ATOM 55969 O WAT 1573 91.799 119.597 126.286 1.00 0.00 O ATOM 55970 H1 WAT 1573 92.339 119.403 125.520 1.00 0.00 H ATOM 55971 H2 WAT 1573 92.278 120.283 126.750 1.00 0.00 H TER 55973 WAT 1573 ATOM 55973 O WAT 1574 25.990 13.189 76.059 1.00 0.00 O ATOM 55974 H1 WAT 1574 25.627 14.000 76.415 1.00 0.00 H ATOM 55975 H2 WAT 1574 26.927 13.363 75.975 1.00 0.00 H TER 55977 WAT 1574 ATOM 55977 O WAT 1575 52.932 134.223 118.811 1.00 0.00 O ATOM 55978 H1 WAT 1575 52.784 134.422 117.887 1.00 0.00 H ATOM 55979 H2 WAT 1575 53.540 133.484 118.804 1.00 0.00 H TER 55981 WAT 1575 ATOM 55981 O WAT 1576 119.227 29.202 118.164 1.00 0.00 O ATOM 55982 H1 WAT 1576 120.177 29.279 118.075 1.00 0.00 H ATOM 55983 H2 WAT 1576 119.090 28.991 119.088 1.00 0.00 H TER 55985 WAT 1576 ATOM 55985 O WAT 1577 52.726 135.652 128.587 1.00 0.00 O ATOM 55986 H1 WAT 1577 53.015 136.547 128.406 1.00 0.00 H ATOM 55987 H2 WAT 1577 51.880 135.580 128.146 1.00 0.00 H TER 55989 WAT 1577 ATOM 55989 O WAT 1578 128.797 30.179 11.036 1.00 0.00 O ATOM 55990 H1 WAT 1578 129.161 29.402 10.612 1.00 0.00 H ATOM 55991 H2 WAT 1578 129.557 30.628 11.407 1.00 0.00 H TER 55993 WAT 1578 ATOM 55993 O WAT 1579 49.180 92.942 6.564 1.00 0.00 O ATOM 55994 H1 WAT 1579 50.030 92.596 6.838 1.00 0.00 H ATOM 55995 H2 WAT 1579 48.879 93.457 7.313 1.00 0.00 H TER 55997 WAT 1579 ATOM 55997 O WAT 1580 111.910 19.322 83.449 1.00 0.00 O ATOM 55998 H1 WAT 1580 112.355 18.910 82.709 1.00 0.00 H ATOM 55999 H2 WAT 1580 112.390 19.014 84.218 1.00 0.00 H TER 56001 WAT 1580 ATOM 56001 O WAT 1581 129.104 97.060 129.824 1.00 0.00 O ATOM 56002 H1 WAT 1581 129.372 96.877 130.725 1.00 0.00 H ATOM 56003 H2 WAT 1581 129.818 97.585 129.464 1.00 0.00 H TER 56005 WAT 1581 ATOM 56005 O WAT 1582 115.027 57.648 95.274 1.00 0.00 O ATOM 56006 H1 WAT 1582 114.287 57.587 95.878 1.00 0.00 H ATOM 56007 H2 WAT 1582 115.800 57.559 95.832 1.00 0.00 H TER 56009 WAT 1582 ATOM 56009 O WAT 1583 46.446 112.907 70.887 1.00 0.00 O ATOM 56010 H1 WAT 1583 45.719 113.517 70.758 1.00 0.00 H ATOM 56011 H2 WAT 1583 47.193 113.467 71.099 1.00 0.00 H TER 56013 WAT 1583 ATOM 56013 O WAT 1584 110.659 133.980 108.083 1.00 0.00 O ATOM 56014 H1 WAT 1584 110.764 133.210 108.642 1.00 0.00 H ATOM 56015 H2 WAT 1584 110.500 134.699 108.693 1.00 0.00 H TER 56017 WAT 1584 ATOM 56017 O WAT 1585 136.656 117.697 86.990 1.00 0.00 O ATOM 56018 H1 WAT 1585 136.133 118.422 86.647 1.00 0.00 H ATOM 56019 H2 WAT 1585 137.143 118.077 87.721 1.00 0.00 H TER 56021 WAT 1585 ATOM 56021 O WAT 1586 117.641 22.565 126.568 1.00 0.00 O ATOM 56022 H1 WAT 1586 116.735 22.500 126.870 1.00 0.00 H ATOM 56023 H2 WAT 1586 117.719 23.460 126.237 1.00 0.00 H TER 56025 WAT 1586 ATOM 56025 O WAT 1587 127.842 55.468 153.545 1.00 0.00 O ATOM 56026 H1 WAT 1587 128.395 55.313 152.779 1.00 0.00 H ATOM 56027 H2 WAT 1587 127.417 54.626 153.708 1.00 0.00 H TER 56029 WAT 1587 ATOM 56029 O WAT 1588 38.431 61.603 143.206 1.00 0.00 O ATOM 56030 H1 WAT 1588 39.303 61.223 143.312 1.00 0.00 H ATOM 56031 H2 WAT 1588 38.455 62.021 142.346 1.00 0.00 H TER 56033 WAT 1588 ATOM 56033 O WAT 1589 127.073 0.270 85.325 1.00 0.00 O ATOM 56034 H1 WAT 1589 127.452 1.149 85.322 1.00 0.00 H ATOM 56035 H2 WAT 1589 126.796 0.132 86.231 1.00 0.00 H TER 56037 WAT 1589 ATOM 56037 O WAT 1590 134.389 19.903 2.745 1.00 0.00 O ATOM 56038 H1 WAT 1590 133.509 19.645 3.016 1.00 0.00 H ATOM 56039 H2 WAT 1590 134.972 19.432 3.341 1.00 0.00 H TER 56041 WAT 1590 ATOM 56041 O WAT 1591 17.964 3.816 -0.245 1.00 0.00 O ATOM 56042 H1 WAT 1591 17.051 3.549 -0.138 1.00 0.00 H ATOM 56043 H2 WAT 1591 18.386 3.558 0.575 1.00 0.00 H TER 56045 WAT 1591 ATOM 56045 O WAT 1592 136.861 9.700 80.979 1.00 0.00 O ATOM 56046 H1 WAT 1592 137.786 9.599 81.203 1.00 0.00 H ATOM 56047 H2 WAT 1592 136.459 10.052 81.773 1.00 0.00 H TER 56049 WAT 1592 ATOM 56049 O WAT 1593 135.137 11.881 69.194 1.00 0.00 O ATOM 56050 H1 WAT 1593 135.236 11.024 69.608 1.00 0.00 H ATOM 56051 H2 WAT 1593 134.330 11.809 68.684 1.00 0.00 H TER 56053 WAT 1593 ATOM 56053 O WAT 1594 79.258 96.948 143.800 1.00 0.00 O ATOM 56054 H1 WAT 1594 80.082 97.432 143.852 1.00 0.00 H ATOM 56055 H2 WAT 1594 78.600 97.616 143.606 1.00 0.00 H TER 56057 WAT 1594 ATOM 56057 O WAT 1595 106.673 69.801 125.115 1.00 0.00 O ATOM 56058 H1 WAT 1595 106.695 68.996 124.597 1.00 0.00 H ATOM 56059 H2 WAT 1595 106.559 69.503 126.017 1.00 0.00 H TER 56061 WAT 1595 ATOM 56061 O WAT 1596 68.222 137.543 151.097 1.00 0.00 O ATOM 56062 H1 WAT 1596 67.707 137.418 151.894 1.00 0.00 H ATOM 56063 H2 WAT 1596 68.615 138.409 151.199 1.00 0.00 H TER 56065 WAT 1596 ATOM 56065 O WAT 1597 80.948 51.271 108.728 1.00 0.00 O ATOM 56066 H1 WAT 1597 80.510 52.064 108.419 1.00 0.00 H ATOM 56067 H2 WAT 1597 81.553 51.579 109.403 1.00 0.00 H TER 56069 WAT 1597 ATOM 56069 O WAT 1598 61.787 139.518 84.018 1.00 0.00 O ATOM 56070 H1 WAT 1598 61.628 139.451 83.077 1.00 0.00 H ATOM 56071 H2 WAT 1598 62.651 139.923 84.088 1.00 0.00 H TER 56073 WAT 1598 ATOM 56073 O WAT 1599 113.612 93.561 9.375 1.00 0.00 O ATOM 56074 H1 WAT 1599 114.489 93.305 9.092 1.00 0.00 H ATOM 56075 H2 WAT 1599 113.647 93.520 10.331 1.00 0.00 H TER 56077 WAT 1599 ATOM 56077 O WAT 1600 47.112 139.059 77.925 1.00 0.00 O ATOM 56078 H1 WAT 1600 46.307 139.548 78.097 1.00 0.00 H ATOM 56079 H2 WAT 1600 47.138 138.969 76.972 1.00 0.00 H TER 56081 WAT 1600 ATOM 56081 O WAT 1601 135.106 101.858 156.723 1.00 0.00 O ATOM 56082 H1 WAT 1601 134.277 102.057 156.288 1.00 0.00 H ATOM 56083 H2 WAT 1601 135.336 100.982 156.412 1.00 0.00 H TER 56085 WAT 1601 ATOM 56085 O WAT 1602 122.808 114.635 111.352 1.00 0.00 O ATOM 56086 H1 WAT 1602 121.919 114.724 111.695 1.00 0.00 H ATOM 56087 H2 WAT 1602 122.687 114.438 110.423 1.00 0.00 H TER 56089 WAT 1602 ATOM 56089 O WAT 1603 76.852 96.615 17.977 1.00 0.00 O ATOM 56090 H1 WAT 1603 75.943 96.868 17.813 1.00 0.00 H ATOM 56091 H2 WAT 1603 77.370 97.333 17.613 1.00 0.00 H TER 56093 WAT 1603 ATOM 56093 O WAT 1604 15.614 55.675 64.209 1.00 0.00 O ATOM 56094 H1 WAT 1604 15.968 56.538 63.990 1.00 0.00 H ATOM 56095 H2 WAT 1604 14.808 55.610 63.697 1.00 0.00 H TER 56097 WAT 1604 ATOM 56097 O WAT 1605 108.109 50.427 59.580 1.00 0.00 O ATOM 56098 H1 WAT 1605 107.906 49.805 60.279 1.00 0.00 H ATOM 56099 H2 WAT 1605 107.257 50.769 59.310 1.00 0.00 H TER 56101 WAT 1605 ATOM 56101 O WAT 1606 64.270 103.444 130.053 1.00 0.00 O ATOM 56102 H1 WAT 1606 63.727 102.727 130.381 1.00 0.00 H ATOM 56103 H2 WAT 1606 64.514 103.175 129.167 1.00 0.00 H TER 56105 WAT 1606 ATOM 56105 O WAT 1607 12.435 135.144 66.703 1.00 0.00 O ATOM 56106 H1 WAT 1607 12.977 135.348 67.465 1.00 0.00 H ATOM 56107 H2 WAT 1607 11.538 135.296 66.999 1.00 0.00 H TER 56109 WAT 1607 ATOM 56109 O WAT 1608 116.435 87.837 1.404 1.00 0.00 O ATOM 56110 H1 WAT 1608 115.996 88.658 1.182 1.00 0.00 H ATOM 56111 H2 WAT 1608 117.302 87.914 1.005 1.00 0.00 H TER 56113 WAT 1608 ATOM 56113 O WAT 1609 110.540 67.679 70.010 1.00 0.00 O ATOM 56114 H1 WAT 1609 110.759 67.532 69.090 1.00 0.00 H ATOM 56115 H2 WAT 1609 110.392 66.803 70.365 1.00 0.00 H TER 56117 WAT 1609 ATOM 56117 O WAT 1610 21.683 141.720 76.229 1.00 0.00 O ATOM 56118 H1 WAT 1610 21.830 141.681 75.284 1.00 0.00 H ATOM 56119 H2 WAT 1610 20.795 142.064 76.319 1.00 0.00 H TER 56121 WAT 1610 ATOM 56121 O WAT 1611 107.089 41.896 10.090 1.00 0.00 O ATOM 56122 H1 WAT 1611 106.428 41.665 9.438 1.00 0.00 H ATOM 56123 H2 WAT 1611 107.640 42.546 9.653 1.00 0.00 H TER 56125 WAT 1611 ATOM 56125 O WAT 1612 15.696 81.711 144.171 1.00 0.00 O ATOM 56126 H1 WAT 1612 15.212 81.041 144.653 1.00 0.00 H ATOM 56127 H2 WAT 1612 15.888 81.306 143.325 1.00 0.00 H TER 56129 WAT 1612 ATOM 56129 O WAT 1613 100.042 30.591 19.456 1.00 0.00 O ATOM 56130 H1 WAT 1613 99.580 30.596 20.294 1.00 0.00 H ATOM 56131 H2 WAT 1613 100.165 29.663 19.256 1.00 0.00 H TER 56133 WAT 1613 ATOM 56133 O WAT 1614 75.024 59.944 119.915 1.00 0.00 O ATOM 56134 H1 WAT 1614 74.448 60.424 120.510 1.00 0.00 H ATOM 56135 H2 WAT 1614 74.467 59.725 119.168 1.00 0.00 H TER 56137 WAT 1614 ATOM 56137 O WAT 1615 39.312 102.621 88.497 1.00 0.00 O ATOM 56138 H1 WAT 1615 39.397 102.989 87.618 1.00 0.00 H ATOM 56139 H2 WAT 1615 39.936 101.895 88.514 1.00 0.00 H TER 56141 WAT 1615 ATOM 56141 O WAT 1616 32.454 82.705 123.605 1.00 0.00 O ATOM 56142 H1 WAT 1616 32.568 82.760 124.554 1.00 0.00 H ATOM 56143 H2 WAT 1616 33.308 82.424 123.277 1.00 0.00 H TER 56145 WAT 1616 ATOM 56145 O WAT 1617 112.456 6.967 13.179 1.00 0.00 O ATOM 56146 H1 WAT 1617 112.167 6.964 12.266 1.00 0.00 H ATOM 56147 H2 WAT 1617 111.983 6.239 13.583 1.00 0.00 H TER 56149 WAT 1617 ATOM 56149 O WAT 1618 127.440 34.669 58.720 1.00 0.00 O ATOM 56150 H1 WAT 1618 128.387 34.752 58.605 1.00 0.00 H ATOM 56151 H2 WAT 1618 127.312 33.764 59.004 1.00 0.00 H TER 56153 WAT 1618 ATOM 56153 O WAT 1619 26.373 20.618 89.662 1.00 0.00 O ATOM 56154 H1 WAT 1619 25.888 21.386 89.966 1.00 0.00 H ATOM 56155 H2 WAT 1619 27.239 20.710 90.059 1.00 0.00 H TER 56157 WAT 1619 ATOM 56157 O WAT 1620 132.093 71.924 127.335 1.00 0.00 O ATOM 56158 H1 WAT 1620 132.149 72.662 127.943 1.00 0.00 H ATOM 56159 H2 WAT 1620 131.617 72.271 126.580 1.00 0.00 H TER 56161 WAT 1620 ATOM 56161 O WAT 1621 47.737 85.883 6.894 1.00 0.00 O ATOM 56162 H1 WAT 1621 47.541 84.946 6.914 1.00 0.00 H ATOM 56163 H2 WAT 1621 48.056 86.042 6.005 1.00 0.00 H TER 56165 WAT 1621 ATOM 56165 O WAT 1622 136.960 58.679 13.796 1.00 0.00 O ATOM 56166 H1 WAT 1622 136.595 59.562 13.733 1.00 0.00 H ATOM 56167 H2 WAT 1622 137.907 58.815 13.836 1.00 0.00 H TER 56169 WAT 1622 ATOM 56169 O WAT 1623 141.083 33.201 82.896 1.00 0.00 O ATOM 56170 H1 WAT 1623 141.209 34.129 82.696 1.00 0.00 H ATOM 56171 H2 WAT 1623 141.903 32.786 82.629 1.00 0.00 H TER 56173 WAT 1623 ATOM 56173 O WAT 1624 9.576 143.002 134.929 1.00 0.00 O ATOM 56174 H1 WAT 1624 9.171 142.145 135.066 1.00 0.00 H ATOM 56175 H2 WAT 1624 9.137 143.353 134.154 1.00 0.00 H TER 56177 WAT 1624 ATOM 56177 O WAT 1625 37.083 64.234 132.788 1.00 0.00 O ATOM 56178 H1 WAT 1625 36.502 64.946 133.057 1.00 0.00 H ATOM 56179 H2 WAT 1625 37.360 64.472 131.904 1.00 0.00 H TER 56181 WAT 1625 ATOM 56181 O WAT 1626 64.083 28.136 80.442 1.00 0.00 O ATOM 56182 H1 WAT 1626 63.599 28.621 81.110 1.00 0.00 H ATOM 56183 H2 WAT 1626 64.709 27.607 80.937 1.00 0.00 H TER 56185 WAT 1626 ATOM 56185 O WAT 1627 91.208 101.755 3.442 1.00 0.00 O ATOM 56186 H1 WAT 1627 91.285 102.542 2.902 1.00 0.00 H ATOM 56187 H2 WAT 1627 90.564 101.214 2.985 1.00 0.00 H TER 56189 WAT 1627 ATOM 56189 O WAT 1628 61.273 27.112 60.909 1.00 0.00 O ATOM 56190 H1 WAT 1628 61.073 26.864 60.006 1.00 0.00 H ATOM 56191 H2 WAT 1628 61.550 26.296 61.326 1.00 0.00 H TER 56193 WAT 1628 ATOM 56193 O WAT 1629 129.658 35.017 123.238 1.00 0.00 O ATOM 56194 H1 WAT 1629 129.331 35.870 123.525 1.00 0.00 H ATOM 56195 H2 WAT 1629 130.040 34.629 124.026 1.00 0.00 H TER 56197 WAT 1629 ATOM 56197 O WAT 1630 23.657 66.080 101.128 1.00 0.00 O ATOM 56198 H1 WAT 1630 24.053 66.683 101.758 1.00 0.00 H ATOM 56199 H2 WAT 1630 24.026 65.226 101.351 1.00 0.00 H TER 56201 WAT 1630 ATOM 56201 O WAT 1631 62.178 122.170 125.687 1.00 0.00 O ATOM 56202 H1 WAT 1631 61.721 121.787 126.437 1.00 0.00 H ATOM 56203 H2 WAT 1631 61.936 123.096 125.707 1.00 0.00 H TER 56205 WAT 1631 ATOM 56205 O WAT 1632 86.412 105.845 64.292 1.00 0.00 O ATOM 56206 H1 WAT 1632 85.650 106.091 63.767 1.00 0.00 H ATOM 56207 H2 WAT 1632 86.516 104.906 64.135 1.00 0.00 H TER 56209 WAT 1632 ATOM 56209 O WAT 1633 19.107 88.335 136.316 1.00 0.00 O ATOM 56210 H1 WAT 1633 18.927 88.737 135.466 1.00 0.00 H ATOM 56211 H2 WAT 1633 18.808 87.430 136.220 1.00 0.00 H TER 56213 WAT 1633 ATOM 56213 O WAT 1634 28.625 7.803 21.861 1.00 0.00 O ATOM 56214 H1 WAT 1634 28.181 7.888 21.017 1.00 0.00 H ATOM 56215 H2 WAT 1634 29.128 8.612 21.950 1.00 0.00 H TER 56217 WAT 1634 ATOM 56217 O WAT 1635 52.797 66.388 151.473 1.00 0.00 O ATOM 56218 H1 WAT 1635 51.933 66.493 151.872 1.00 0.00 H ATOM 56219 H2 WAT 1635 52.658 65.762 150.762 1.00 0.00 H TER 56221 WAT 1635 ATOM 56221 O WAT 1636 122.381 107.698 107.057 1.00 0.00 O ATOM 56222 H1 WAT 1636 121.951 107.105 106.441 1.00 0.00 H ATOM 56223 H2 WAT 1636 121.785 107.739 107.805 1.00 0.00 H TER 56225 WAT 1636 ATOM 56225 O WAT 1637 68.581 86.428 26.024 1.00 0.00 O ATOM 56226 H1 WAT 1637 68.117 85.857 26.637 1.00 0.00 H ATOM 56227 H2 WAT 1637 68.142 86.287 25.186 1.00 0.00 H TER 56229 WAT 1637 ATOM 56229 O WAT 1638 2.930 130.341 3.428 1.00 0.00 O ATOM 56230 H1 WAT 1638 2.453 131.171 3.409 1.00 0.00 H ATOM 56231 H2 WAT 1638 3.838 130.582 3.247 1.00 0.00 H TER 56233 WAT 1638 ATOM 56233 O WAT 1639 33.891 52.217 91.824 1.00 0.00 O ATOM 56234 H1 WAT 1639 34.769 52.341 91.464 1.00 0.00 H ATOM 56235 H2 WAT 1639 33.416 51.746 91.139 1.00 0.00 H TER 56237 WAT 1639 ATOM 56237 O WAT 1640 136.839 82.480 144.721 1.00 0.00 O ATOM 56238 H1 WAT 1640 136.287 81.705 144.619 1.00 0.00 H ATOM 56239 H2 WAT 1640 137.217 82.391 145.596 1.00 0.00 H TER 56241 WAT 1640 ATOM 56241 O WAT 1641 17.629 27.980 91.439 1.00 0.00 O ATOM 56242 H1 WAT 1641 17.153 28.745 91.762 1.00 0.00 H ATOM 56243 H2 WAT 1641 18.445 28.336 91.087 1.00 0.00 H TER 56245 WAT 1641 ATOM 56245 O WAT 1642 139.547 51.751 135.168 1.00 0.00 O ATOM 56246 H1 WAT 1642 138.730 51.649 135.656 1.00 0.00 H ATOM 56247 H2 WAT 1642 139.651 52.698 135.071 1.00 0.00 H TER 56249 WAT 1642 ATOM 56249 O WAT 1643 25.240 42.967 118.591 1.00 0.00 O ATOM 56250 H1 WAT 1643 25.650 43.099 117.736 1.00 0.00 H ATOM 56251 H2 WAT 1643 24.588 42.283 118.440 1.00 0.00 H TER 56253 WAT 1643 ATOM 56253 O WAT 1644 130.672 66.238 151.908 1.00 0.00 O ATOM 56254 H1 WAT 1644 130.054 65.866 152.537 1.00 0.00 H ATOM 56255 H2 WAT 1644 130.152 66.865 151.404 1.00 0.00 H TER 56257 WAT 1644 ATOM 56257 O WAT 1645 92.054 103.480 85.180 1.00 0.00 O ATOM 56258 H1 WAT 1645 92.317 103.250 86.071 1.00 0.00 H ATOM 56259 H2 WAT 1645 92.673 103.013 84.619 1.00 0.00 H TER 56261 WAT 1645 ATOM 56261 O WAT 1646 59.471 107.910 64.795 1.00 0.00 O ATOM 56262 H1 WAT 1646 59.250 107.724 63.882 1.00 0.00 H ATOM 56263 H2 WAT 1646 58.732 108.424 65.120 1.00 0.00 H TER 56265 WAT 1646 ATOM 56265 O WAT 1647 111.401 142.372 101.724 1.00 0.00 O ATOM 56266 H1 WAT 1647 110.986 142.781 102.483 1.00 0.00 H ATOM 56267 H2 WAT 1647 111.917 143.073 101.326 1.00 0.00 H TER 56269 WAT 1647 ATOM 56269 O WAT 1648 103.759 133.641 9.573 1.00 0.00 O ATOM 56270 H1 WAT 1648 104.686 133.813 9.409 1.00 0.00 H ATOM 56271 H2 WAT 1648 103.696 132.687 9.620 1.00 0.00 H TER 56273 WAT 1648 ATOM 56273 O WAT 1649 109.220 2.343 148.189 1.00 0.00 O ATOM 56274 H1 WAT 1649 108.595 1.639 148.016 1.00 0.00 H ATOM 56275 H2 WAT 1649 109.860 1.955 148.785 1.00 0.00 H TER 56277 WAT 1649 ATOM 56277 O WAT 1650 113.196 106.429 127.318 1.00 0.00 O ATOM 56278 H1 WAT 1650 112.984 106.251 128.235 1.00 0.00 H ATOM 56279 H2 WAT 1650 112.356 106.648 126.916 1.00 0.00 H TER 56281 WAT 1650 ATOM 56281 O WAT 1651 26.909 138.384 111.885 1.00 0.00 O ATOM 56282 H1 WAT 1651 27.510 138.962 112.355 1.00 0.00 H ATOM 56283 H2 WAT 1651 26.873 137.591 112.419 1.00 0.00 H TER 56285 WAT 1651 ATOM 56285 O WAT 1652 126.524 90.598 22.318 1.00 0.00 O ATOM 56286 H1 WAT 1652 126.680 89.742 21.920 1.00 0.00 H ATOM 56287 H2 WAT 1652 125.801 90.450 22.928 1.00 0.00 H TER 56289 WAT 1652 ATOM 56289 O WAT 1653 19.302 143.475 144.403 1.00 0.00 O ATOM 56290 H1 WAT 1653 19.007 143.027 143.609 1.00 0.00 H ATOM 56291 H2 WAT 1653 19.682 142.782 144.942 1.00 0.00 H TER 56293 WAT 1653 ATOM 56293 O WAT 1654 126.304 124.698 13.425 1.00 0.00 O ATOM 56294 H1 WAT 1654 127.147 124.435 13.795 1.00 0.00 H ATOM 56295 H2 WAT 1654 126.237 125.632 13.620 1.00 0.00 H TER 56297 WAT 1654 ATOM 56297 O WAT 1655 49.857 36.931 17.375 1.00 0.00 O ATOM 56298 H1 WAT 1655 50.476 36.210 17.493 1.00 0.00 H ATOM 56299 H2 WAT 1655 50.028 37.516 18.113 1.00 0.00 H TER 56301 WAT 1655 ATOM 56301 O WAT 1656 92.602 79.089 147.254 1.00 0.00 O ATOM 56302 H1 WAT 1656 92.899 79.954 146.972 1.00 0.00 H ATOM 56303 H2 WAT 1656 92.245 79.233 148.130 1.00 0.00 H TER 56305 WAT 1656 ATOM 56305 O WAT 1657 79.842 101.187 21.984 1.00 0.00 O ATOM 56306 H1 WAT 1657 80.410 100.884 22.692 1.00 0.00 H ATOM 56307 H2 WAT 1657 80.439 101.365 21.257 1.00 0.00 H TER 56309 WAT 1657 ATOM 56309 O WAT 1658 79.297 9.725 23.998 1.00 0.00 O ATOM 56310 H1 WAT 1658 79.092 10.540 24.456 1.00 0.00 H ATOM 56311 H2 WAT 1658 78.545 9.159 24.169 1.00 0.00 H TER 56313 WAT 1658 ATOM 56313 O WAT 1659 75.480 74.865 90.424 1.00 0.00 O ATOM 56314 H1 WAT 1659 76.193 74.532 90.970 1.00 0.00 H ATOM 56315 H2 WAT 1659 75.410 75.790 90.659 1.00 0.00 H TER 56317 WAT 1659 ATOM 56317 O WAT 1660 85.848 79.338 105.554 1.00 0.00 O ATOM 56318 H1 WAT 1660 85.704 80.169 105.102 1.00 0.00 H ATOM 56319 H2 WAT 1660 85.049 78.836 105.392 1.00 0.00 H TER 56321 WAT 1660 ATOM 56321 O WAT 1661 16.520 102.043 141.957 1.00 0.00 O ATOM 56322 H1 WAT 1661 16.357 101.435 142.679 1.00 0.00 H ATOM 56323 H2 WAT 1661 15.697 102.058 141.467 1.00 0.00 H TER 56325 WAT 1661 ATOM 56325 O WAT 1662 129.853 12.161 137.437 1.00 0.00 O ATOM 56326 H1 WAT 1662 129.177 11.783 138.000 1.00 0.00 H ATOM 56327 H2 WAT 1662 129.922 11.551 136.703 1.00 0.00 H TER 56329 WAT 1662 ATOM 56329 O WAT 1663 68.908 54.793 82.572 1.00 0.00 O ATOM 56330 H1 WAT 1663 68.937 55.191 81.702 1.00 0.00 H ATOM 56331 H2 WAT 1663 69.827 54.703 82.825 1.00 0.00 H TER 56333 WAT 1663 ATOM 56333 O WAT 1664 82.761 144.027 85.387 1.00 0.00 O ATOM 56334 H1 WAT 1664 83.177 143.310 84.908 1.00 0.00 H ATOM 56335 H2 WAT 1664 82.262 143.595 86.080 1.00 0.00 H TER 56337 WAT 1664 ATOM 56337 O WAT 1665 67.978 98.262 85.119 1.00 0.00 O ATOM 56338 H1 WAT 1665 68.351 99.062 85.490 1.00 0.00 H ATOM 56339 H2 WAT 1665 68.161 98.325 84.182 1.00 0.00 H TER 56341 WAT 1665 ATOM 56341 O WAT 1666 43.188 48.311 62.060 1.00 0.00 O ATOM 56342 H1 WAT 1666 43.983 47.782 62.130 1.00 0.00 H ATOM 56343 H2 WAT 1666 43.133 48.538 61.132 1.00 0.00 H TER 56345 WAT 1666 ATOM 56345 O WAT 1667 16.957 137.303 88.232 1.00 0.00 O ATOM 56346 H1 WAT 1667 16.392 137.516 88.974 1.00 0.00 H ATOM 56347 H2 WAT 1667 16.744 137.962 87.571 1.00 0.00 H TER 56349 WAT 1667 ATOM 56349 O WAT 1668 138.190 109.868 127.150 1.00 0.00 O ATOM 56350 H1 WAT 1668 138.501 110.637 127.627 1.00 0.00 H ATOM 56351 H2 WAT 1668 138.978 109.497 126.754 1.00 0.00 H TER 56353 WAT 1668 ATOM 56353 O WAT 1669 103.061 110.591 152.748 1.00 0.00 O ATOM 56354 H1 WAT 1669 102.582 111.322 153.139 1.00 0.00 H ATOM 56355 H2 WAT 1669 103.824 110.997 152.337 1.00 0.00 H TER 56357 WAT 1669 ATOM 56357 O WAT 1670 48.429 123.403 128.222 1.00 0.00 O ATOM 56358 H1 WAT 1670 48.405 124.355 128.117 1.00 0.00 H ATOM 56359 H2 WAT 1670 48.702 123.075 127.365 1.00 0.00 H TER 56361 WAT 1670 ATOM 56361 O WAT 1671 48.664 11.435 157.296 1.00 0.00 O ATOM 56362 H1 WAT 1671 49.202 11.648 158.059 1.00 0.00 H ATOM 56363 H2 WAT 1671 47.996 12.121 157.276 1.00 0.00 H TER 56365 WAT 1671 ATOM 56365 O WAT 1672 141.374 83.436 83.880 1.00 0.00 O ATOM 56366 H1 WAT 1672 142.213 83.034 84.105 1.00 0.00 H ATOM 56367 H2 WAT 1672 140.983 82.835 83.245 1.00 0.00 H TER 56369 WAT 1672 ATOM 56369 O WAT 1673 137.117 122.217 122.292 1.00 0.00 O ATOM 56370 H1 WAT 1673 137.375 122.108 123.207 1.00 0.00 H ATOM 56371 H2 WAT 1673 137.870 121.904 121.791 1.00 0.00 H TER 56373 WAT 1673 ATOM 56373 O WAT 1674 80.014 128.720 120.003 1.00 0.00 O ATOM 56374 H1 WAT 1674 80.919 128.652 119.700 1.00 0.00 H ATOM 56375 H2 WAT 1674 79.574 129.238 119.329 1.00 0.00 H TER 56377 WAT 1674 ATOM 56377 O WAT 1675 6.313 86.752 117.675 1.00 0.00 O ATOM 56378 H1 WAT 1675 6.923 86.022 117.779 1.00 0.00 H ATOM 56379 H2 WAT 1675 6.493 87.323 118.421 1.00 0.00 H TER 56381 WAT 1675 ATOM 56381 O WAT 1676 80.381 7.585 90.908 1.00 0.00 O ATOM 56382 H1 WAT 1676 80.100 8.143 91.633 1.00 0.00 H ATOM 56383 H2 WAT 1676 80.450 8.179 90.161 1.00 0.00 H TER 56385 WAT 1676 ATOM 56385 O WAT 1677 41.746 144.858 123.718 1.00 0.00 O ATOM 56386 H1 WAT 1677 40.977 144.324 123.520 1.00 0.00 H ATOM 56387 H2 WAT 1677 42.369 144.649 123.021 1.00 0.00 H TER 56389 WAT 1677 ATOM 56389 O WAT 1678 84.202 76.427 131.148 1.00 0.00 O ATOM 56390 H1 WAT 1678 83.392 76.356 131.655 1.00 0.00 H ATOM 56391 H2 WAT 1678 83.945 76.204 130.254 1.00 0.00 H TER 56393 WAT 1678 ATOM 56393 O WAT 1679 43.719 144.503 128.171 1.00 0.00 O ATOM 56394 H1 WAT 1679 43.353 144.046 128.928 1.00 0.00 H ATOM 56395 H2 WAT 1679 44.088 145.309 128.532 1.00 0.00 H TER 56397 WAT 1679 ATOM 56397 O WAT 1680 72.196 19.161 108.197 1.00 0.00 O ATOM 56398 H1 WAT 1680 72.692 19.698 107.578 1.00 0.00 H ATOM 56399 H2 WAT 1680 71.859 18.437 107.669 1.00 0.00 H TER 56401 WAT 1680 ATOM 56401 O WAT 1681 122.000 64.171 79.384 1.00 0.00 O ATOM 56402 H1 WAT 1681 122.402 63.750 80.145 1.00 0.00 H ATOM 56403 H2 WAT 1681 122.524 64.959 79.243 1.00 0.00 H TER 56405 WAT 1681 ATOM 56405 O WAT 1682 44.276 124.254 7.757 1.00 0.00 O ATOM 56406 H1 WAT 1682 45.092 123.820 7.508 1.00 0.00 H ATOM 56407 H2 WAT 1682 43.607 123.574 7.670 1.00 0.00 H TER 56409 WAT 1682 ATOM 56409 O WAT 1683 105.337 110.690 109.817 1.00 0.00 O ATOM 56410 H1 WAT 1683 104.965 110.848 108.949 1.00 0.00 H ATOM 56411 H2 WAT 1683 105.917 109.938 109.696 1.00 0.00 H TER 56413 WAT 1683 ATOM 56413 O WAT 1684 75.522 135.664 94.376 1.00 0.00 O ATOM 56414 H1 WAT 1684 74.881 135.368 95.022 1.00 0.00 H ATOM 56415 H2 WAT 1684 75.413 135.064 93.638 1.00 0.00 H TER 56417 WAT 1684 ATOM 56417 O WAT 1685 119.031 38.224 136.131 1.00 0.00 O ATOM 56418 H1 WAT 1685 118.219 38.646 136.413 1.00 0.00 H ATOM 56419 H2 WAT 1685 118.780 37.709 135.364 1.00 0.00 H TER 56421 WAT 1685 ATOM 56421 O WAT 1686 29.085 29.089 61.711 1.00 0.00 O ATOM 56422 H1 WAT 1686 29.362 29.950 61.398 1.00 0.00 H ATOM 56423 H2 WAT 1686 29.844 28.525 61.561 1.00 0.00 H TER 56425 WAT 1686 ATOM 56425 O WAT 1687 141.471 94.714 59.714 1.00 0.00 O ATOM 56426 H1 WAT 1687 140.673 94.290 59.400 1.00 0.00 H ATOM 56427 H2 WAT 1687 141.384 94.714 60.668 1.00 0.00 H TER 56429 WAT 1687 ATOM 56429 O WAT 1688 122.139 79.825 152.706 1.00 0.00 O ATOM 56430 H1 WAT 1688 122.718 79.071 152.597 1.00 0.00 H ATOM 56431 H2 WAT 1688 121.481 79.533 153.338 1.00 0.00 H TER 56433 WAT 1688 ATOM 56433 O WAT 1689 136.130 17.935 111.388 1.00 0.00 O ATOM 56434 H1 WAT 1689 136.636 17.242 110.965 1.00 0.00 H ATOM 56435 H2 WAT 1689 135.406 17.477 111.814 1.00 0.00 H TER 56437 WAT 1689 ATOM 56437 O WAT 1690 53.058 78.429 145.384 1.00 0.00 O ATOM 56438 H1 WAT 1690 52.178 78.597 145.047 1.00 0.00 H ATOM 56439 H2 WAT 1690 52.968 78.498 146.334 1.00 0.00 H TER 56441 WAT 1690 ATOM 56441 O WAT 1691 121.492 22.368 92.440 1.00 0.00 O ATOM 56442 H1 WAT 1691 122.121 22.590 91.752 1.00 0.00 H ATOM 56443 H2 WAT 1691 120.848 21.810 92.004 1.00 0.00 H TER 56445 WAT 1691 ATOM 56445 O WAT 1692 97.236 102.308 148.014 1.00 0.00 O ATOM 56446 H1 WAT 1692 96.688 103.057 147.780 1.00 0.00 H ATOM 56447 H2 WAT 1692 96.861 101.983 148.833 1.00 0.00 H TER 56449 WAT 1692 ATOM 56449 O WAT 1693 96.909 65.173 0.683 1.00 0.00 O ATOM 56450 H1 WAT 1693 97.244 64.643 -0.040 1.00 0.00 H ATOM 56451 H2 WAT 1693 97.369 66.008 0.600 1.00 0.00 H TER 56453 WAT 1693 ATOM 56453 O WAT 1694 67.344 50.141 122.240 1.00 0.00 O ATOM 56454 H1 WAT 1694 66.503 49.745 122.467 1.00 0.00 H ATOM 56455 H2 WAT 1694 67.213 50.494 121.360 1.00 0.00 H TER 56457 WAT 1694 ATOM 56457 O WAT 1695 21.674 55.492 95.922 1.00 0.00 O ATOM 56458 H1 WAT 1695 22.057 54.616 95.967 1.00 0.00 H ATOM 56459 H2 WAT 1695 21.441 55.698 96.827 1.00 0.00 H TER 56461 WAT 1695 ATOM 56461 O WAT 1696 134.503 82.712 70.685 1.00 0.00 O ATOM 56462 H1 WAT 1696 134.208 83.358 70.044 1.00 0.00 H ATOM 56463 H2 WAT 1696 133.816 82.046 70.687 1.00 0.00 H TER 56465 WAT 1696 ATOM 56465 O WAT 1697 5.461 31.190 94.402 1.00 0.00 O ATOM 56466 H1 WAT 1697 5.338 31.106 95.348 1.00 0.00 H ATOM 56467 H2 WAT 1697 6.322 31.599 94.308 1.00 0.00 H TER 56469 WAT 1697 ATOM 56469 O WAT 1698 104.798 65.684 110.034 1.00 0.00 O ATOM 56470 H1 WAT 1698 104.312 65.228 109.347 1.00 0.00 H ATOM 56471 H2 WAT 1698 105.522 66.109 109.574 1.00 0.00 H TER 56473 WAT 1698 ATOM 56473 O WAT 1699 16.630 73.086 64.773 1.00 0.00 O ATOM 56474 H1 WAT 1699 17.055 72.913 65.613 1.00 0.00 H ATOM 56475 H2 WAT 1699 17.236 73.669 64.314 1.00 0.00 H TER 56477 WAT 1699 ATOM 56477 O WAT 1700 122.501 120.042 103.642 1.00 0.00 O ATOM 56478 H1 WAT 1700 122.731 120.167 104.562 1.00 0.00 H ATOM 56479 H2 WAT 1700 122.154 119.151 103.600 1.00 0.00 H TER 56481 WAT 1700 ATOM 56481 O WAT 1701 99.205 92.441 64.514 1.00 0.00 O ATOM 56482 H1 WAT 1701 99.775 93.175 64.286 1.00 0.00 H ATOM 56483 H2 WAT 1701 98.784 92.710 65.331 1.00 0.00 H TER 56485 WAT 1701 ATOM 56485 O WAT 1702 64.310 81.877 21.218 1.00 0.00 O ATOM 56486 H1 WAT 1702 64.910 81.739 20.486 1.00 0.00 H ATOM 56487 H2 WAT 1702 64.689 82.610 21.704 1.00 0.00 H TER 56489 WAT 1702 ATOM 56489 O WAT 1703 132.549 122.569 4.960 1.00 0.00 O ATOM 56490 H1 WAT 1703 132.371 121.893 5.613 1.00 0.00 H ATOM 56491 H2 WAT 1703 131.768 122.581 4.408 1.00 0.00 H TER 56493 WAT 1703 ATOM 56493 O WAT 1704 28.288 92.812 105.199 1.00 0.00 O ATOM 56494 H1 WAT 1704 28.880 93.559 105.281 1.00 0.00 H ATOM 56495 H2 WAT 1704 27.423 93.168 105.403 1.00 0.00 H TER 56497 WAT 1704 ATOM 56497 O WAT 1705 8.956 12.889 62.942 1.00 0.00 O ATOM 56498 H1 WAT 1705 8.066 12.603 62.736 1.00 0.00 H ATOM 56499 H2 WAT 1705 9.518 12.205 62.577 1.00 0.00 H TER 56501 WAT 1705 ATOM 56501 O WAT 1706 116.860 60.294 64.789 1.00 0.00 O ATOM 56502 H1 WAT 1706 117.003 59.981 65.682 1.00 0.00 H ATOM 56503 H2 WAT 1706 116.438 61.146 64.898 1.00 0.00 H TER 56505 WAT 1706 ATOM 56505 O WAT 1707 11.037 73.514 18.505 1.00 0.00 O ATOM 56506 H1 WAT 1707 10.434 73.432 19.244 1.00 0.00 H ATOM 56507 H2 WAT 1707 11.872 73.188 18.840 1.00 0.00 H TER 56509 WAT 1707 ATOM 56509 O WAT 1708 67.465 26.569 6.412 1.00 0.00 O ATOM 56510 H1 WAT 1708 67.064 25.792 6.023 1.00 0.00 H ATOM 56511 H2 WAT 1708 66.752 26.992 6.891 1.00 0.00 H TER 56513 WAT 1708 ATOM 56513 O WAT 1709 54.322 111.680 55.685 1.00 0.00 O ATOM 56514 H1 WAT 1709 54.390 112.633 55.753 1.00 0.00 H ATOM 56515 H2 WAT 1709 53.496 111.468 56.119 1.00 0.00 H TER 56517 WAT 1709 ATOM 56517 O WAT 1710 104.771 113.708 149.018 1.00 0.00 O ATOM 56518 H1 WAT 1710 105.575 113.341 148.648 1.00 0.00 H ATOM 56519 H2 WAT 1710 104.172 112.963 149.074 1.00 0.00 H TER 56521 WAT 1710 ATOM 56521 O WAT 1711 15.840 98.207 63.146 1.00 0.00 O ATOM 56522 H1 WAT 1711 14.915 98.082 62.932 1.00 0.00 H ATOM 56523 H2 WAT 1711 15.834 98.813 63.886 1.00 0.00 H TER 56525 WAT 1711 ATOM 56525 O WAT 1712 67.563 125.915 80.938 1.00 0.00 O ATOM 56526 H1 WAT 1712 66.890 125.543 80.367 1.00 0.00 H ATOM 56527 H2 WAT 1712 67.505 126.859 80.792 1.00 0.00 H TER 56529 WAT 1712 ATOM 56529 O WAT 1713 105.009 29.130 53.117 1.00 0.00 O ATOM 56530 H1 WAT 1713 104.173 28.691 52.959 1.00 0.00 H ATOM 56531 H2 WAT 1713 104.853 30.039 52.864 1.00 0.00 H TER 56533 WAT 1713 ATOM 56533 O WAT 1714 5.080 133.697 8.048 1.00 0.00 O ATOM 56534 H1 WAT 1714 4.643 133.110 7.432 1.00 0.00 H ATOM 56535 H2 WAT 1714 4.848 134.576 7.747 1.00 0.00 H TER 56537 WAT 1714 ATOM 56537 O WAT 1715 47.080 38.014 110.214 1.00 0.00 O ATOM 56538 H1 WAT 1715 46.819 38.045 109.294 1.00 0.00 H ATOM 56539 H2 WAT 1715 46.614 38.745 110.620 1.00 0.00 H TER 56541 WAT 1715 ATOM 56541 O WAT 1716 143.966 109.069 126.494 1.00 0.00 O ATOM 56542 H1 WAT 1716 143.512 109.285 125.680 1.00 0.00 H ATOM 56543 H2 WAT 1716 143.926 108.114 126.545 1.00 0.00 H TER 56545 WAT 1716 ATOM 56545 O WAT 1717 17.384 22.806 154.826 1.00 0.00 O ATOM 56546 H1 WAT 1717 17.137 23.492 154.207 1.00 0.00 H ATOM 56547 H2 WAT 1717 18.030 23.220 155.399 1.00 0.00 H TER 56549 WAT 1717 ATOM 56549 O WAT 1718 101.390 23.872 148.408 1.00 0.00 O ATOM 56550 H1 WAT 1718 101.379 22.969 148.090 1.00 0.00 H ATOM 56551 H2 WAT 1718 102.277 24.181 148.221 1.00 0.00 H TER 56553 WAT 1718 ATOM 56553 O WAT 1719 111.718 127.722 129.870 1.00 0.00 O ATOM 56554 H1 WAT 1719 111.661 127.357 130.754 1.00 0.00 H ATOM 56555 H2 WAT 1719 112.636 127.610 129.624 1.00 0.00 H TER 56557 WAT 1719 ATOM 56557 O WAT 1720 81.356 100.087 7.637 1.00 0.00 O ATOM 56558 H1 WAT 1720 81.650 99.227 7.338 1.00 0.00 H ATOM 56559 H2 WAT 1720 81.256 100.599 6.835 1.00 0.00 H TER 56561 WAT 1720 ATOM 56561 O WAT 1721 32.159 113.955 75.256 1.00 0.00 O ATOM 56562 H1 WAT 1721 31.233 113.868 75.480 1.00 0.00 H ATOM 56563 H2 WAT 1721 32.255 113.465 74.440 1.00 0.00 H TER 56565 WAT 1721 ATOM 56565 O WAT 1722 102.704 121.987 114.629 1.00 0.00 O ATOM 56566 H1 WAT 1722 102.587 121.936 113.681 1.00 0.00 H ATOM 56567 H2 WAT 1722 101.894 121.627 114.990 1.00 0.00 H TER 56569 WAT 1722 ATOM 56569 O WAT 1723 136.202 80.650 155.092 1.00 0.00 O ATOM 56570 H1 WAT 1723 136.321 81.599 155.073 1.00 0.00 H ATOM 56571 H2 WAT 1723 136.012 80.450 156.008 1.00 0.00 H TER 56573 WAT 1723 ATOM 56573 O WAT 1724 38.634 55.038 82.418 1.00 0.00 O ATOM 56574 H1 WAT 1724 37.964 55.432 82.978 1.00 0.00 H ATOM 56575 H2 WAT 1724 39.015 54.343 82.954 1.00 0.00 H TER 56577 WAT 1724 ATOM 56577 O WAT 1725 143.667 101.930 112.138 1.00 0.00 O ATOM 56578 H1 WAT 1725 143.667 102.345 113.001 1.00 0.00 H ATOM 56579 H2 WAT 1725 142.853 101.427 112.115 1.00 0.00 H TER 56581 WAT 1725 ATOM 56581 O WAT 1726 139.505 123.750 77.869 1.00 0.00 O ATOM 56582 H1 WAT 1726 139.850 123.160 77.199 1.00 0.00 H ATOM 56583 H2 WAT 1726 140.282 124.144 78.265 1.00 0.00 H TER 56585 WAT 1726 ATOM 56585 O WAT 1727 142.538 101.369 140.637 1.00 0.00 O ATOM 56586 H1 WAT 1727 142.906 101.596 141.491 1.00 0.00 H ATOM 56587 H2 WAT 1727 143.027 101.907 140.014 1.00 0.00 H TER 56589 WAT 1727 ATOM 56589 O WAT 1728 74.695 131.428 113.675 1.00 0.00 O ATOM 56590 H1 WAT 1728 75.403 132.069 113.738 1.00 0.00 H ATOM 56591 H2 WAT 1728 74.279 131.446 114.537 1.00 0.00 H TER 56593 WAT 1728 ATOM 56593 O WAT 1729 86.563 120.218 96.506 1.00 0.00 O ATOM 56594 H1 WAT 1729 86.227 120.560 95.677 1.00 0.00 H ATOM 56595 H2 WAT 1729 86.924 119.361 96.282 1.00 0.00 H TER 56597 WAT 1729 ATOM 56597 O WAT 1730 115.175 144.436 97.148 1.00 0.00 O ATOM 56598 H1 WAT 1730 114.783 143.746 96.614 1.00 0.00 H ATOM 56599 H2 WAT 1730 114.429 144.877 97.555 1.00 0.00 H TER 56601 WAT 1730 ATOM 56601 O WAT 1731 129.552 77.368 30.832 1.00 0.00 O ATOM 56602 H1 WAT 1731 130.478 77.520 30.648 1.00 0.00 H ATOM 56603 H2 WAT 1731 129.513 76.460 31.131 1.00 0.00 H TER 56605 WAT 1731 ATOM 56605 O WAT 1732 90.149 140.787 132.637 1.00 0.00 O ATOM 56606 H1 WAT 1732 89.400 141.229 132.239 1.00 0.00 H ATOM 56607 H2 WAT 1732 90.227 139.965 132.153 1.00 0.00 H TER 56609 WAT 1732 ATOM 56609 O WAT 1733 7.419 78.568 82.132 1.00 0.00 O ATOM 56610 H1 WAT 1733 7.578 79.463 82.431 1.00 0.00 H ATOM 56611 H2 WAT 1733 6.917 78.671 81.323 1.00 0.00 H TER 56613 WAT 1733 ATOM 56613 O WAT 1734 71.703 31.376 18.053 1.00 0.00 O ATOM 56614 H1 WAT 1734 71.293 31.405 17.188 1.00 0.00 H ATOM 56615 H2 WAT 1734 71.845 30.444 18.220 1.00 0.00 H TER 56617 WAT 1734 ATOM 56617 O WAT 1735 107.509 137.547 9.037 1.00 0.00 O ATOM 56618 H1 WAT 1735 106.898 137.176 9.674 1.00 0.00 H ATOM 56619 H2 WAT 1735 106.963 138.093 8.472 1.00 0.00 H TER 56621 WAT 1735 ATOM 56621 O WAT 1736 135.040 114.865 111.210 1.00 0.00 O ATOM 56622 H1 WAT 1736 135.114 114.019 110.769 1.00 0.00 H ATOM 56623 H2 WAT 1736 135.793 114.895 111.800 1.00 0.00 H TER 56625 WAT 1736 ATOM 56625 O WAT 1737 25.807 68.256 145.958 1.00 0.00 O ATOM 56626 H1 WAT 1737 25.099 68.817 145.643 1.00 0.00 H ATOM 56627 H2 WAT 1737 26.471 68.297 145.270 1.00 0.00 H TER 56629 WAT 1737 ATOM 56629 O WAT 1738 116.239 49.799 77.887 1.00 0.00 O ATOM 56630 H1 WAT 1738 116.297 49.848 76.933 1.00 0.00 H ATOM 56631 H2 WAT 1738 117.118 49.545 78.167 1.00 0.00 H TER 56633 WAT 1738 ATOM 56633 O WAT 1739 71.405 28.179 114.983 1.00 0.00 O ATOM 56634 H1 WAT 1739 71.163 28.970 115.464 1.00 0.00 H ATOM 56635 H2 WAT 1739 71.648 28.492 114.112 1.00 0.00 H TER 56637 WAT 1739 ATOM 56637 O WAT 1740 112.044 11.679 94.684 1.00 0.00 O ATOM 56638 H1 WAT 1740 112.778 11.747 94.073 1.00 0.00 H ATOM 56639 H2 WAT 1740 112.129 12.449 95.246 1.00 0.00 H TER 56641 WAT 1740 ATOM 56641 O WAT 1741 138.787 103.276 23.840 1.00 0.00 O ATOM 56642 H1 WAT 1741 139.429 103.251 24.550 1.00 0.00 H ATOM 56643 H2 WAT 1741 137.986 103.599 24.253 1.00 0.00 H TER 56645 WAT 1741 ATOM 56645 O WAT 1742 21.946 101.269 153.014 1.00 0.00 O ATOM 56646 H1 WAT 1742 21.314 101.925 152.719 1.00 0.00 H ATOM 56647 H2 WAT 1742 22.298 101.627 153.829 1.00 0.00 H TER 56649 WAT 1742 ATOM 56649 O WAT 1743 131.544 23.434 86.858 1.00 0.00 O ATOM 56650 H1 WAT 1743 132.460 23.398 86.583 1.00 0.00 H ATOM 56651 H2 WAT 1743 131.508 24.165 87.475 1.00 0.00 H TER 56653 WAT 1743 ATOM 56653 O WAT 1744 58.812 58.838 64.999 1.00 0.00 O ATOM 56654 H1 WAT 1744 58.088 58.859 64.373 1.00 0.00 H ATOM 56655 H2 WAT 1744 59.496 58.335 64.556 1.00 0.00 H TER 56657 WAT 1744 ATOM 56657 O WAT 1745 90.416 0.874 126.370 1.00 0.00 O ATOM 56658 H1 WAT 1745 90.560 1.613 126.961 1.00 0.00 H ATOM 56659 H2 WAT 1745 90.223 1.278 125.524 1.00 0.00 H TER 56661 WAT 1745 ATOM 56661 O WAT 1746 77.890 2.660 139.595 1.00 0.00 O ATOM 56662 H1 WAT 1746 78.741 2.315 139.324 1.00 0.00 H ATOM 56663 H2 WAT 1746 77.688 2.191 140.405 1.00 0.00 H TER 56665 WAT 1746 ATOM 56665 O WAT 1747 51.647 84.670 115.799 1.00 0.00 O ATOM 56666 H1 WAT 1747 51.592 84.811 114.854 1.00 0.00 H ATOM 56667 H2 WAT 1747 50.738 84.687 116.098 1.00 0.00 H TER 56669 WAT 1747 ATOM 56669 O WAT 1748 19.333 9.329 143.997 1.00 0.00 O ATOM 56670 H1 WAT 1748 19.260 8.969 144.881 1.00 0.00 H ATOM 56671 H2 WAT 1748 18.752 8.783 143.467 1.00 0.00 H TER 56673 WAT 1748 ATOM 56673 O WAT 1749 122.420 135.026 121.549 1.00 0.00 O ATOM 56674 H1 WAT 1749 123.329 135.269 121.725 1.00 0.00 H ATOM 56675 H2 WAT 1749 122.257 135.338 120.659 1.00 0.00 H TER 56677 WAT 1749 ATOM 56677 O WAT 1750 69.542 41.497 107.001 1.00 0.00 O ATOM 56678 H1 WAT 1750 68.659 41.129 106.976 1.00 0.00 H ATOM 56679 H2 WAT 1750 70.078 40.867 106.518 1.00 0.00 H TER 56681 WAT 1750 ATOM 56681 O WAT 1751 85.913 81.215 118.342 1.00 0.00 O ATOM 56682 H1 WAT 1751 85.108 80.762 118.090 1.00 0.00 H ATOM 56683 H2 WAT 1751 85.646 82.124 118.474 1.00 0.00 H TER 56685 WAT 1751 ATOM 56685 O WAT 1752 37.039 11.081 158.408 1.00 0.00 O ATOM 56686 H1 WAT 1752 36.993 10.623 157.568 1.00 0.00 H ATOM 56687 H2 WAT 1752 37.010 12.009 158.176 1.00 0.00 H TER 56689 WAT 1752 ATOM 56689 O WAT 1753 83.765 21.162 128.505 1.00 0.00 O ATOM 56690 H1 WAT 1753 83.593 21.618 129.329 1.00 0.00 H ATOM 56691 H2 WAT 1753 84.396 20.481 128.735 1.00 0.00 H TER 56693 WAT 1753 ATOM 56693 O WAT 1754 127.551 78.299 101.984 1.00 0.00 O ATOM 56694 H1 WAT 1754 128.450 78.564 101.787 1.00 0.00 H ATOM 56695 H2 WAT 1754 127.414 78.576 102.890 1.00 0.00 H TER 56697 WAT 1754 ATOM 56697 O WAT 1755 11.920 64.855 121.305 1.00 0.00 O ATOM 56698 H1 WAT 1755 12.085 65.796 121.245 1.00 0.00 H ATOM 56699 H2 WAT 1755 12.640 64.454 120.817 1.00 0.00 H TER 56701 WAT 1755 ATOM 56701 O WAT 1756 140.587 94.735 121.034 1.00 0.00 O ATOM 56702 H1 WAT 1756 141.401 95.207 120.858 1.00 0.00 H ATOM 56703 H2 WAT 1756 140.424 94.877 121.966 1.00 0.00 H TER 56705 WAT 1756 ATOM 56705 O WAT 1757 16.333 74.534 104.495 1.00 0.00 O ATOM 56706 H1 WAT 1757 15.435 74.281 104.278 1.00 0.00 H ATOM 56707 H2 WAT 1757 16.829 74.367 103.693 1.00 0.00 H TER 56709 WAT 1757 ATOM 56709 O WAT 1758 49.157 63.222 98.870 1.00 0.00 O ATOM 56710 H1 WAT 1758 49.356 63.067 99.793 1.00 0.00 H ATOM 56711 H2 WAT 1758 49.397 62.405 98.433 1.00 0.00 H TER 56713 WAT 1758 ATOM 56713 O WAT 1759 126.098 51.508 60.150 1.00 0.00 O ATOM 56714 H1 WAT 1759 126.915 51.489 60.649 1.00 0.00 H ATOM 56715 H2 WAT 1759 125.747 52.386 60.298 1.00 0.00 H TER 56717 WAT 1759 ATOM 56717 O WAT 1760 8.008 136.559 109.144 1.00 0.00 O ATOM 56718 H1 WAT 1760 8.846 136.960 109.374 1.00 0.00 H ATOM 56719 H2 WAT 1760 8.020 136.513 108.187 1.00 0.00 H TER 56721 WAT 1760 ATOM 56721 O WAT 1761 113.338 3.260 15.409 1.00 0.00 O ATOM 56722 H1 WAT 1761 113.306 2.779 16.236 1.00 0.00 H ATOM 56723 H2 WAT 1761 113.145 2.601 14.741 1.00 0.00 H TER 56725 WAT 1761 ATOM 56725 O WAT 1762 23.057 24.909 58.009 1.00 0.00 O ATOM 56726 H1 WAT 1762 22.539 24.843 58.812 1.00 0.00 H ATOM 56727 H2 WAT 1762 22.447 24.671 57.311 1.00 0.00 H TER 56729 WAT 1762 ATOM 56729 O WAT 1763 94.637 145.765 6.415 1.00 0.00 O ATOM 56730 H1 WAT 1763 94.955 144.910 6.706 1.00 0.00 H ATOM 56731 H2 WAT 1763 95.417 146.214 6.091 1.00 0.00 H TER 56733 WAT 1763 ATOM 56733 O WAT 1764 75.804 34.509 105.650 1.00 0.00 O ATOM 56734 H1 WAT 1764 75.491 34.304 104.769 1.00 0.00 H ATOM 56735 H2 WAT 1764 76.694 34.158 105.676 1.00 0.00 H TER 56737 WAT 1764 ATOM 56737 O WAT 1765 60.046 86.799 90.917 1.00 0.00 O ATOM 56738 H1 WAT 1765 59.271 86.272 91.107 1.00 0.00 H ATOM 56739 H2 WAT 1765 59.788 87.694 91.140 1.00 0.00 H TER 56741 WAT 1765 ATOM 56741 O WAT 1766 66.211 15.828 27.349 1.00 0.00 O ATOM 56742 H1 WAT 1766 67.121 16.045 27.147 1.00 0.00 H ATOM 56743 H2 WAT 1766 66.228 14.892 27.553 1.00 0.00 H TER 56745 WAT 1766 ATOM 56745 O WAT 1767 72.685 7.456 135.154 1.00 0.00 O ATOM 56746 H1 WAT 1767 73.326 7.641 135.840 1.00 0.00 H ATOM 56747 H2 WAT 1767 71.838 7.516 135.595 1.00 0.00 H TER 56749 WAT 1767 ATOM 56749 O WAT 1768 71.209 107.056 68.137 1.00 0.00 O ATOM 56750 H1 WAT 1768 70.467 107.652 68.241 1.00 0.00 H ATOM 56751 H2 WAT 1768 70.816 106.183 68.134 1.00 0.00 H TER 56753 WAT 1768 ATOM 56753 O WAT 1769 118.306 48.043 78.878 1.00 0.00 O ATOM 56754 H1 WAT 1769 119.169 47.823 78.525 1.00 0.00 H ATOM 56755 H2 WAT 1769 117.795 47.240 78.777 1.00 0.00 H TER 56757 WAT 1769 ATOM 56757 O WAT 1770 127.390 47.459 21.392 1.00 0.00 O ATOM 56758 H1 WAT 1770 127.615 48.369 21.196 1.00 0.00 H ATOM 56759 H2 WAT 1770 126.507 47.350 21.038 1.00 0.00 H TER 56761 WAT 1770 ATOM 56761 O WAT 1771 101.862 73.365 145.571 1.00 0.00 O ATOM 56762 H1 WAT 1771 102.535 73.081 144.953 1.00 0.00 H ATOM 56763 H2 WAT 1771 101.212 73.812 145.029 1.00 0.00 H TER 56765 WAT 1771 ATOM 56765 O WAT 1772 78.714 68.769 71.720 1.00 0.00 O ATOM 56766 H1 WAT 1772 78.133 68.674 70.964 1.00 0.00 H ATOM 56767 H2 WAT 1772 79.405 68.124 71.574 1.00 0.00 H TER 56769 WAT 1772 ATOM 56769 O WAT 1773 138.099 75.134 80.515 1.00 0.00 O ATOM 56770 H1 WAT 1773 137.283 74.798 80.886 1.00 0.00 H ATOM 56771 H2 WAT 1773 138.218 75.988 80.932 1.00 0.00 H TER 56773 WAT 1773 ATOM 56773 O WAT 1774 41.570 53.839 130.027 1.00 0.00 O ATOM 56774 H1 WAT 1774 40.861 54.349 130.417 1.00 0.00 H ATOM 56775 H2 WAT 1774 41.132 53.251 129.412 1.00 0.00 H TER 56777 WAT 1774 ATOM 56777 O WAT 1775 36.392 12.087 80.623 1.00 0.00 O ATOM 56778 H1 WAT 1775 37.092 11.765 80.056 1.00 0.00 H ATOM 56779 H2 WAT 1775 36.436 11.527 81.399 1.00 0.00 H TER 56781 WAT 1775 ATOM 56781 O WAT 1776 88.037 117.369 103.340 1.00 0.00 O ATOM 56782 H1 WAT 1776 87.636 116.940 104.095 1.00 0.00 H ATOM 56783 H2 WAT 1776 87.475 117.132 102.603 1.00 0.00 H TER 56785 WAT 1776 ATOM 56785 O WAT 1777 81.208 113.543 132.589 1.00 0.00 O ATOM 56786 H1 WAT 1777 81.585 114.368 132.281 1.00 0.00 H ATOM 56787 H2 WAT 1777 80.568 113.805 133.251 1.00 0.00 H TER 56789 WAT 1777 ATOM 56789 O WAT 1778 43.525 86.437 65.543 1.00 0.00 O ATOM 56790 H1 WAT 1778 42.668 86.857 65.613 1.00 0.00 H ATOM 56791 H2 WAT 1778 43.432 85.620 66.034 1.00 0.00 H TER 56793 WAT 1778 ATOM 56793 O WAT 1779 5.378 95.629 13.017 1.00 0.00 O ATOM 56794 H1 WAT 1779 4.713 94.944 12.948 1.00 0.00 H ATOM 56795 H2 WAT 1779 5.019 96.249 13.652 1.00 0.00 H TER 56797 WAT 1779 ATOM 56797 O WAT 1780 4.871 117.679 116.715 1.00 0.00 O ATOM 56798 H1 WAT 1780 5.238 117.238 115.949 1.00 0.00 H ATOM 56799 H2 WAT 1780 3.925 117.554 116.632 1.00 0.00 H TER 56801 WAT 1780 ATOM 56801 O WAT 1781 11.984 144.101 140.513 1.00 0.00 O ATOM 56802 H1 WAT 1781 12.366 143.224 140.481 1.00 0.00 H ATOM 56803 H2 WAT 1781 11.172 143.991 141.007 1.00 0.00 H TER 56805 WAT 1781 ATOM 56805 O WAT 1782 137.706 120.804 72.406 1.00 0.00 O ATOM 56806 H1 WAT 1782 136.988 121.395 72.181 1.00 0.00 H ATOM 56807 H2 WAT 1782 137.453 120.428 73.248 1.00 0.00 H TER 56809 WAT 1782 ATOM 56809 O WAT 1783 40.193 144.748 130.900 1.00 0.00 O ATOM 56810 H1 WAT 1783 39.823 145.484 131.388 1.00 0.00 H ATOM 56811 H2 WAT 1783 41.083 144.657 131.242 1.00 0.00 H TER 56813 WAT 1783 ATOM 56813 O WAT 1784 29.810 82.627 151.518 1.00 0.00 O ATOM 56814 H1 WAT 1784 29.053 82.053 151.630 1.00 0.00 H ATOM 56815 H2 WAT 1784 29.650 83.075 150.687 1.00 0.00 H TER 56817 WAT 1784 ATOM 56817 O WAT 1785 120.145 97.782 91.511 1.00 0.00 O ATOM 56818 H1 WAT 1785 119.254 98.116 91.414 1.00 0.00 H ATOM 56819 H2 WAT 1785 120.073 97.095 92.174 1.00 0.00 H TER 56821 WAT 1785 ATOM 56821 O WAT 1786 67.563 43.030 28.170 1.00 0.00 O ATOM 56822 H1 WAT 1786 67.797 42.265 27.644 1.00 0.00 H ATOM 56823 H2 WAT 1786 66.976 43.536 27.608 1.00 0.00 H TER 56825 WAT 1786 ATOM 56825 O WAT 1787 31.824 33.826 157.263 1.00 0.00 O ATOM 56826 H1 WAT 1787 31.929 32.875 157.238 1.00 0.00 H ATOM 56827 H2 WAT 1787 31.472 34.051 156.402 1.00 0.00 H TER 56829 WAT 1787 ATOM 56829 O WAT 1788 14.736 26.951 113.153 1.00 0.00 O ATOM 56830 H1 WAT 1788 14.540 26.024 113.012 1.00 0.00 H ATOM 56831 H2 WAT 1788 15.141 27.237 112.334 1.00 0.00 H TER 56833 WAT 1788 ATOM 56833 O WAT 1789 130.497 18.552 84.803 1.00 0.00 O ATOM 56834 H1 WAT 1789 131.070 17.785 84.767 1.00 0.00 H ATOM 56835 H2 WAT 1789 130.833 19.067 85.536 1.00 0.00 H TER 56837 WAT 1789 ATOM 56837 O WAT 1790 140.497 117.900 14.417 1.00 0.00 O ATOM 56838 H1 WAT 1790 141.293 118.090 13.921 1.00 0.00 H ATOM 56839 H2 WAT 1790 140.812 117.623 15.278 1.00 0.00 H TER 56841 WAT 1790 ATOM 56841 O WAT 1791 93.215 48.075 9.380 1.00 0.00 O ATOM 56842 H1 WAT 1791 93.012 47.140 9.382 1.00 0.00 H ATOM 56843 H2 WAT 1791 93.689 48.219 10.199 1.00 0.00 H TER 56845 WAT 1791 ATOM 56845 O WAT 1792 120.069 80.210 127.741 1.00 0.00 O ATOM 56846 H1 WAT 1792 119.379 79.575 127.548 1.00 0.00 H ATOM 56847 H2 WAT 1792 120.751 79.697 128.175 1.00 0.00 H TER 56849 WAT 1792 ATOM 56849 O WAT 1793 50.263 26.818 4.894 1.00 0.00 O ATOM 56850 H1 WAT 1793 50.877 26.374 4.308 1.00 0.00 H ATOM 56851 H2 WAT 1793 50.372 27.748 4.695 1.00 0.00 H TER 56853 WAT 1793 ATOM 56853 O WAT 1794 117.197 111.864 147.753 1.00 0.00 O ATOM 56854 H1 WAT 1794 117.660 112.019 148.576 1.00 0.00 H ATOM 56855 H2 WAT 1794 117.889 111.824 147.093 1.00 0.00 H TER 56857 WAT 1794 ATOM 56857 O WAT 1795 97.237 138.751 109.759 1.00 0.00 O ATOM 56858 H1 WAT 1795 96.419 138.254 109.729 1.00 0.00 H ATOM 56859 H2 WAT 1795 97.884 138.172 109.357 1.00 0.00 H TER 56861 WAT 1795 ATOM 56861 O WAT 1796 100.001 6.636 102.972 1.00 0.00 O ATOM 56862 H1 WAT 1796 99.070 6.442 102.865 1.00 0.00 H ATOM 56863 H2 WAT 1796 100.350 5.882 103.446 1.00 0.00 H TER 56865 WAT 1796 ATOM 56865 O WAT 1797 66.945 33.335 7.727 1.00 0.00 O ATOM 56866 H1 WAT 1797 66.602 33.836 6.987 1.00 0.00 H ATOM 56867 H2 WAT 1797 66.251 33.376 8.385 1.00 0.00 H TER 56869 WAT 1797 ATOM 56869 O WAT 1798 116.951 42.649 123.181 1.00 0.00 O ATOM 56870 H1 WAT 1798 116.776 41.895 122.618 1.00 0.00 H ATOM 56871 H2 WAT 1798 117.691 42.376 123.723 1.00 0.00 H TER 56873 WAT 1798 ATOM 56873 O WAT 1799 96.582 123.415 77.433 1.00 0.00 O ATOM 56874 H1 WAT 1799 96.725 124.249 77.881 1.00 0.00 H ATOM 56875 H2 WAT 1799 97.460 123.115 77.200 1.00 0.00 H TER 56877 WAT 1799 ATOM 56877 O WAT 1800 70.888 52.082 152.638 1.00 0.00 O ATOM 56878 H1 WAT 1800 71.551 52.396 153.253 1.00 0.00 H ATOM 56879 H2 WAT 1800 70.284 51.571 153.178 1.00 0.00 H TER 56881 WAT 1800 ATOM 56881 O WAT 1801 23.173 44.501 86.138 1.00 0.00 O ATOM 56882 H1 WAT 1801 22.836 44.717 85.268 1.00 0.00 H ATOM 56883 H2 WAT 1801 22.602 43.798 86.448 1.00 0.00 H TER 56885 WAT 1801 ATOM 56885 O WAT 1802 116.421 104.384 110.311 1.00 0.00 O ATOM 56886 H1 WAT 1802 116.977 105.155 110.424 1.00 0.00 H ATOM 56887 H2 WAT 1802 115.922 104.326 111.126 1.00 0.00 H TER 56889 WAT 1802 ATOM 56889 O WAT 1803 46.244 25.908 100.352 1.00 0.00 O ATOM 56890 H1 WAT 1803 46.334 26.414 99.545 1.00 0.00 H ATOM 56891 H2 WAT 1803 47.142 25.782 100.657 1.00 0.00 H TER 56893 WAT 1803 ATOM 56893 O WAT 1804 138.896 3.182 98.706 1.00 0.00 O ATOM 56894 H1 WAT 1804 138.412 3.585 99.428 1.00 0.00 H ATOM 56895 H2 WAT 1804 138.805 2.240 98.854 1.00 0.00 H TER 56897 WAT 1804 ATOM 56897 O WAT 1805 63.797 36.850 26.964 1.00 0.00 O ATOM 56898 H1 WAT 1805 64.498 37.014 26.334 1.00 0.00 H ATOM 56899 H2 WAT 1805 63.726 35.896 27.000 1.00 0.00 H TER 56901 WAT 1805 ATOM 56901 O WAT 1806 53.438 120.954 131.384 1.00 0.00 O ATOM 56902 H1 WAT 1806 54.271 121.412 131.494 1.00 0.00 H ATOM 56903 H2 WAT 1806 52.852 121.364 132.020 1.00 0.00 H TER 56905 WAT 1806 ATOM 56905 O WAT 1807 95.395 63.348 20.705 1.00 0.00 O ATOM 56906 H1 WAT 1807 96.351 63.356 20.651 1.00 0.00 H ATOM 56907 H2 WAT 1807 95.134 62.576 20.203 1.00 0.00 H TER 56909 WAT 1807 ATOM 56909 O WAT 1808 139.465 82.940 30.607 1.00 0.00 O ATOM 56910 H1 WAT 1808 139.932 83.037 31.438 1.00 0.00 H ATOM 56911 H2 WAT 1808 139.479 83.816 30.222 1.00 0.00 H TER 56913 WAT 1808 ATOM 56913 O WAT 1809 121.309 127.839 129.939 1.00 0.00 O ATOM 56914 H1 WAT 1809 121.233 127.031 130.445 1.00 0.00 H ATOM 56915 H2 WAT 1809 122.209 128.130 130.084 1.00 0.00 H TER 56917 WAT 1809 ATOM 56917 O WAT 1810 60.196 94.986 77.163 1.00 0.00 O ATOM 56918 H1 WAT 1810 59.516 95.499 76.725 1.00 0.00 H ATOM 56919 H2 WAT 1810 61.016 95.303 76.784 1.00 0.00 H TER 56921 WAT 1810 ATOM 56921 O WAT 1811 24.238 138.167 22.978 1.00 0.00 O ATOM 56922 H1 WAT 1811 24.951 138.799 22.887 1.00 0.00 H ATOM 56923 H2 WAT 1811 24.415 137.509 22.305 1.00 0.00 H TER 56925 WAT 1811 ATOM 56925 O WAT 1812 53.251 13.173 154.397 1.00 0.00 O ATOM 56926 H1 WAT 1812 53.116 14.042 154.021 1.00 0.00 H ATOM 56927 H2 WAT 1812 52.795 13.202 155.238 1.00 0.00 H TER 56929 WAT 1812 ATOM 56929 O WAT 1813 73.652 23.598 124.830 1.00 0.00 O ATOM 56930 H1 WAT 1813 74.248 23.367 124.118 1.00 0.00 H ATOM 56931 H2 WAT 1813 72.795 23.673 124.411 1.00 0.00 H TER 56933 WAT 1813 ATOM 56933 O WAT 1814 111.979 39.532 156.501 1.00 0.00 O ATOM 56934 H1 WAT 1814 112.878 39.320 156.752 1.00 0.00 H ATOM 56935 H2 WAT 1814 111.863 40.443 156.772 1.00 0.00 H TER 56937 WAT 1814 ATOM 56937 O WAT 1815 85.616 139.478 139.997 1.00 0.00 O ATOM 56938 H1 WAT 1815 85.073 140.231 139.766 1.00 0.00 H ATOM 56939 H2 WAT 1815 85.018 138.881 140.448 1.00 0.00 H TER 56941 WAT 1815 ATOM 56941 O WAT 1816 121.100 91.385 86.813 1.00 0.00 O ATOM 56942 H1 WAT 1816 120.350 90.997 86.363 1.00 0.00 H ATOM 56943 H2 WAT 1816 121.552 91.889 86.137 1.00 0.00 H TER 56945 WAT 1816 ATOM 56945 O WAT 1817 133.411 26.191 131.109 1.00 0.00 O ATOM 56946 H1 WAT 1817 132.904 26.556 131.835 1.00 0.00 H ATOM 56947 H2 WAT 1817 133.156 25.269 131.079 1.00 0.00 H TER 56949 WAT 1817 ATOM 56949 O WAT 1818 137.764 45.886 99.212 1.00 0.00 O ATOM 56950 H1 WAT 1818 138.161 46.606 99.703 1.00 0.00 H ATOM 56951 H2 WAT 1818 137.306 46.314 98.489 1.00 0.00 H TER 56953 WAT 1818 ATOM 56953 O WAT 1819 11.543 118.069 157.186 1.00 0.00 O ATOM 56954 H1 WAT 1819 11.185 118.261 156.320 1.00 0.00 H ATOM 56955 H2 WAT 1819 12.283 117.487 157.016 1.00 0.00 H TER 56957 WAT 1819 ATOM 56957 O WAT 1820 46.941 63.792 75.458 1.00 0.00 O ATOM 56958 H1 WAT 1820 47.391 63.244 74.815 1.00 0.00 H ATOM 56959 H2 WAT 1820 46.797 63.212 76.206 1.00 0.00 H TER 56961 WAT 1820 ATOM 56961 O WAT 1821 105.174 89.322 79.111 1.00 0.00 O ATOM 56962 H1 WAT 1821 105.636 89.769 78.402 1.00 0.00 H ATOM 56963 H2 WAT 1821 105.778 89.361 79.853 1.00 0.00 H TER 56965 WAT 1821 ATOM 56965 O WAT 1822 22.461 106.889 153.860 1.00 0.00 O ATOM 56966 H1 WAT 1822 22.493 107.018 154.808 1.00 0.00 H ATOM 56967 H2 WAT 1822 23.377 106.799 153.599 1.00 0.00 H TER 56969 WAT 1822 ATOM 56969 O WAT 1823 135.156 113.527 4.613 1.00 0.00 O ATOM 56970 H1 WAT 1823 134.963 112.705 5.064 1.00 0.00 H ATOM 56971 H2 WAT 1823 135.933 113.335 4.087 1.00 0.00 H TER 56973 WAT 1823 ATOM 56973 O WAT 1824 132.413 66.224 97.659 1.00 0.00 O ATOM 56974 H1 WAT 1824 132.635 66.796 96.924 1.00 0.00 H ATOM 56975 H2 WAT 1824 132.474 65.339 97.302 1.00 0.00 H TER 56977 WAT 1824 ATOM 56977 O WAT 1825 112.430 82.135 141.343 1.00 0.00 O ATOM 56978 H1 WAT 1825 112.522 81.290 140.903 1.00 0.00 H ATOM 56979 H2 WAT 1825 112.222 81.911 142.250 1.00 0.00 H TER 56981 WAT 1825 ATOM 56981 O WAT 1826 61.847 15.554 124.543 1.00 0.00 O ATOM 56982 H1 WAT 1826 62.201 15.525 125.432 1.00 0.00 H ATOM 56983 H2 WAT 1826 61.273 14.789 124.490 1.00 0.00 H TER 56985 WAT 1826 ATOM 56985 O WAT 1827 108.245 93.003 118.709 1.00 0.00 O ATOM 56986 H1 WAT 1827 107.652 93.519 118.163 1.00 0.00 H ATOM 56987 H2 WAT 1827 108.484 93.592 119.425 1.00 0.00 H TER 56989 WAT 1827 ATOM 56989 O WAT 1828 97.558 52.868 79.877 1.00 0.00 O ATOM 56990 H1 WAT 1828 98.224 52.544 80.483 1.00 0.00 H ATOM 56991 H2 WAT 1828 97.823 52.525 79.023 1.00 0.00 H TER 56993 WAT 1828 ATOM 56993 O WAT 1829 130.366 25.540 80.459 1.00 0.00 O ATOM 56994 H1 WAT 1829 131.303 25.421 80.616 1.00 0.00 H ATOM 56995 H2 WAT 1829 129.941 25.045 81.159 1.00 0.00 H TER 56997 WAT 1829 ATOM 56997 O WAT 1830 62.251 98.525 138.361 1.00 0.00 O ATOM 56998 H1 WAT 1830 61.737 98.071 137.693 1.00 0.00 H ATOM 56999 H2 WAT 1830 63.149 98.499 138.031 1.00 0.00 H TER 57001 WAT 1830 ATOM 57001 O WAT 1831 63.066 100.473 14.867 1.00 0.00 O ATOM 57002 H1 WAT 1831 63.486 100.532 15.725 1.00 0.00 H ATOM 57003 H2 WAT 1831 63.703 100.853 14.262 1.00 0.00 H TER 57005 WAT 1831 ATOM 57005 O WAT 1832 83.116 115.380 139.663 1.00 0.00 O ATOM 57006 H1 WAT 1832 82.839 116.231 139.324 1.00 0.00 H ATOM 57007 H2 WAT 1832 84.054 115.481 139.826 1.00 0.00 H TER 57009 WAT 1832 ATOM 57009 O WAT 1833 88.933 34.764 21.868 1.00 0.00 O ATOM 57010 H1 WAT 1833 89.736 35.159 22.208 1.00 0.00 H ATOM 57011 H2 WAT 1833 89.054 33.823 22.002 1.00 0.00 H TER 57013 WAT 1833 ATOM 57013 O WAT 1834 8.847 126.993 144.870 1.00 0.00 O ATOM 57014 H1 WAT 1834 8.717 127.366 143.997 1.00 0.00 H ATOM 57015 H2 WAT 1834 7.985 127.044 145.283 1.00 0.00 H TER 57017 WAT 1834 ATOM 57017 O WAT 1835 100.670 65.142 101.640 1.00 0.00 O ATOM 57018 H1 WAT 1835 99.788 65.099 102.007 1.00 0.00 H ATOM 57019 H2 WAT 1835 100.736 66.026 101.278 1.00 0.00 H TER 57021 WAT 1835 ATOM 57021 O WAT 1836 7.288 76.965 156.536 1.00 0.00 O ATOM 57022 H1 WAT 1836 7.459 76.653 157.425 1.00 0.00 H ATOM 57023 H2 WAT 1836 6.347 76.837 156.415 1.00 0.00 H TER 57025 WAT 1836 ATOM 57025 O WAT 1837 127.568 52.082 106.761 1.00 0.00 O ATOM 57026 H1 WAT 1837 127.568 52.960 107.144 1.00 0.00 H ATOM 57027 H2 WAT 1837 126.657 51.931 106.509 1.00 0.00 H TER 57029 WAT 1837 ATOM 57029 O WAT 1838 25.039 122.763 12.101 1.00 0.00 O ATOM 57030 H1 WAT 1838 25.077 122.578 11.162 1.00 0.00 H ATOM 57031 H2 WAT 1838 25.775 123.354 12.258 1.00 0.00 H TER 57033 WAT 1838 ATOM 57033 O WAT 1839 142.851 124.081 85.142 1.00 0.00 O ATOM 57034 H1 WAT 1839 142.137 124.680 84.927 1.00 0.00 H ATOM 57035 H2 WAT 1839 142.581 123.242 84.771 1.00 0.00 H TER 57037 WAT 1839 ATOM 57037 O WAT 1840 108.344 5.758 141.059 1.00 0.00 O ATOM 57038 H1 WAT 1840 108.893 4.995 140.875 1.00 0.00 H ATOM 57039 H2 WAT 1840 108.963 6.440 141.321 1.00 0.00 H TER 57041 WAT 1840 ATOM 57041 O WAT 1841 1.958 111.896 80.858 1.00 0.00 O ATOM 57042 H1 WAT 1841 2.719 111.316 80.835 1.00 0.00 H ATOM 57043 H2 WAT 1841 2.025 112.347 81.700 1.00 0.00 H TER 57045 WAT 1841 ATOM 57045 O WAT 1842 96.671 41.407 115.217 1.00 0.00 O ATOM 57046 H1 WAT 1842 97.386 42.034 115.114 1.00 0.00 H ATOM 57047 H2 WAT 1842 97.011 40.592 114.848 1.00 0.00 H TER 57049 WAT 1842 ATOM 57049 O WAT 1843 21.100 106.590 110.026 1.00 0.00 O ATOM 57050 H1 WAT 1843 20.313 106.919 109.592 1.00 0.00 H ATOM 57051 H2 WAT 1843 21.266 105.743 109.612 1.00 0.00 H TER 57053 WAT 1843 ATOM 57053 O WAT 1844 138.783 59.418 86.799 1.00 0.00 O ATOM 57054 H1 WAT 1844 138.931 58.495 87.007 1.00 0.00 H ATOM 57055 H2 WAT 1844 138.654 59.432 85.851 1.00 0.00 H TER 57057 WAT 1844 ATOM 57057 O WAT 1845 129.602 68.636 151.176 1.00 0.00 O ATOM 57058 H1 WAT 1845 128.863 68.904 151.723 1.00 0.00 H ATOM 57059 H2 WAT 1845 130.240 69.343 151.274 1.00 0.00 H TER 57061 WAT 1845 ATOM 57061 O WAT 1846 131.284 38.484 123.577 1.00 0.00 O ATOM 57062 H1 WAT 1846 130.358 38.250 123.646 1.00 0.00 H ATOM 57063 H2 WAT 1846 131.497 38.348 122.654 1.00 0.00 H TER 57065 WAT 1846 ATOM 57065 O WAT 1847 96.770 77.137 73.502 1.00 0.00 O ATOM 57066 H1 WAT 1847 96.711 77.772 72.789 1.00 0.00 H ATOM 57067 H2 WAT 1847 95.946 76.652 73.460 1.00 0.00 H TER 57069 WAT 1847 ATOM 57069 O WAT 1848 77.607 78.720 101.397 1.00 0.00 O ATOM 57070 H1 WAT 1848 77.077 77.935 101.534 1.00 0.00 H ATOM 57071 H2 WAT 1848 77.688 78.792 100.446 1.00 0.00 H TER 57073 WAT 1848 ATOM 57073 O WAT 1849 27.174 51.466 75.103 1.00 0.00 O ATOM 57074 H1 WAT 1849 27.743 51.694 74.369 1.00 0.00 H ATOM 57075 H2 WAT 1849 27.721 51.591 75.879 1.00 0.00 H TER 57077 WAT 1849 ATOM 57077 O WAT 1850 87.188 145.790 5.728 1.00 0.00 O ATOM 57078 H1 WAT 1850 86.284 146.061 5.568 1.00 0.00 H ATOM 57079 H2 WAT 1850 87.130 145.187 6.469 1.00 0.00 H TER 57081 WAT 1850 ATOM 57081 O WAT 1851 134.752 1.104 99.162 1.00 0.00 O ATOM 57082 H1 WAT 1851 134.507 1.639 99.917 1.00 0.00 H ATOM 57083 H2 WAT 1851 135.346 0.444 99.519 1.00 0.00 H TER 57085 WAT 1851 ATOM 57085 O WAT 1852 5.119 75.747 120.219 1.00 0.00 O ATOM 57086 H1 WAT 1852 4.660 76.578 120.341 1.00 0.00 H ATOM 57087 H2 WAT 1852 5.988 75.897 120.592 1.00 0.00 H TER 57089 WAT 1852 ATOM 57089 O WAT 1853 3.267 27.752 105.040 1.00 0.00 O ATOM 57090 H1 WAT 1853 3.533 27.257 104.265 1.00 0.00 H ATOM 57091 H2 WAT 1853 2.434 28.155 104.794 1.00 0.00 H TER 57093 WAT 1853 ATOM 57093 O WAT 1854 125.757 73.307 1.185 1.00 0.00 O ATOM 57094 H1 WAT 1854 125.358 73.206 2.049 1.00 0.00 H ATOM 57095 H2 WAT 1854 125.077 73.027 0.573 1.00 0.00 H TER 57097 WAT 1854 ATOM 57097 O WAT 1855 23.406 69.179 10.611 1.00 0.00 O ATOM 57098 H1 WAT 1855 23.166 68.293 10.881 1.00 0.00 H ATOM 57099 H2 WAT 1855 22.573 69.596 10.389 1.00 0.00 H TER 57101 WAT 1855 ATOM 57101 O WAT 1856 0.035 133.089 84.753 1.00 0.00 O ATOM 57102 H1 WAT 1856 -0.055 132.136 84.774 1.00 0.00 H ATOM 57103 H2 WAT 1856 0.888 133.240 84.344 1.00 0.00 H TER 57105 WAT 1856 ATOM 57105 O WAT 1857 112.279 52.495 15.512 1.00 0.00 O ATOM 57106 H1 WAT 1857 111.517 51.941 15.343 1.00 0.00 H ATOM 57107 H2 WAT 1857 113.011 51.881 15.580 1.00 0.00 H TER 57109 WAT 1857 ATOM 57109 O WAT 1858 74.102 78.166 75.887 1.00 0.00 O ATOM 57110 H1 WAT 1858 73.471 77.485 75.655 1.00 0.00 H ATOM 57111 H2 WAT 1858 73.564 78.927 76.106 1.00 0.00 H TER 57113 WAT 1858 ATOM 57113 O WAT 1859 113.626 46.262 84.665 1.00 0.00 O ATOM 57114 H1 WAT 1859 114.539 46.317 84.384 1.00 0.00 H ATOM 57115 H2 WAT 1859 113.124 46.251 83.850 1.00 0.00 H TER 57117 WAT 1859 ATOM 57117 O WAT 1860 45.602 46.775 16.359 1.00 0.00 O ATOM 57118 H1 WAT 1860 44.813 47.070 15.904 1.00 0.00 H ATOM 57119 H2 WAT 1860 45.828 45.948 15.934 1.00 0.00 H TER 57121 WAT 1860 ATOM 57121 O WAT 1861 0.233 136.074 76.782 1.00 0.00 O ATOM 57122 H1 WAT 1861 0.096 136.100 75.835 1.00 0.00 H ATOM 57123 H2 WAT 1861 0.970 136.665 76.934 1.00 0.00 H TER 57125 WAT 1861 ATOM 57125 O WAT 1862 15.584 49.386 155.126 1.00 0.00 O ATOM 57126 H1 WAT 1862 15.358 50.162 154.613 1.00 0.00 H ATOM 57127 H2 WAT 1862 14.753 48.925 155.240 1.00 0.00 H TER 57129 WAT 1862 ATOM 57129 O WAT 1863 6.017 104.027 67.287 1.00 0.00 O ATOM 57130 H1 WAT 1863 6.449 103.197 67.491 1.00 0.00 H ATOM 57131 H2 WAT 1863 6.581 104.436 66.630 1.00 0.00 H TER 57133 WAT 1863 ATOM 57133 O WAT 1864 119.546 42.474 69.786 1.00 0.00 O ATOM 57134 H1 WAT 1864 119.851 42.737 68.917 1.00 0.00 H ATOM 57135 H2 WAT 1864 118.941 43.168 70.048 1.00 0.00 H TER 57137 WAT 1864 ATOM 57137 O WAT 1865 24.869 128.159 116.605 1.00 0.00 O ATOM 57138 H1 WAT 1865 24.289 128.901 116.775 1.00 0.00 H ATOM 57139 H2 WAT 1865 24.369 127.395 116.894 1.00 0.00 H TER 57141 WAT 1865 ATOM 57141 O WAT 1866 117.566 40.545 156.221 1.00 0.00 O ATOM 57142 H1 WAT 1866 118.231 41.105 155.821 1.00 0.00 H ATOM 57143 H2 WAT 1866 117.642 39.712 155.754 1.00 0.00 H TER 57145 WAT 1866 ATOM 57145 O WAT 1867 23.364 39.843 125.167 1.00 0.00 O ATOM 57146 H1 WAT 1867 23.808 40.675 125.001 1.00 0.00 H ATOM 57147 H2 WAT 1867 22.878 39.667 124.361 1.00 0.00 H TER 57149 WAT 1867 ATOM 57149 O WAT 1868 56.403 14.263 89.423 1.00 0.00 O ATOM 57150 H1 WAT 1868 56.493 14.075 88.489 1.00 0.00 H ATOM 57151 H2 WAT 1868 57.212 13.931 89.813 1.00 0.00 H TER 57153 WAT 1868 ATOM 57153 O WAT 1869 13.552 23.133 94.553 1.00 0.00 O ATOM 57154 H1 WAT 1869 13.166 24.009 94.576 1.00 0.00 H ATOM 57155 H2 WAT 1869 12.974 22.632 93.977 1.00 0.00 H TER 57157 WAT 1869 ATOM 57157 O WAT 1870 14.605 85.989 142.449 1.00 0.00 O ATOM 57158 H1 WAT 1870 15.242 85.518 142.986 1.00 0.00 H ATOM 57159 H2 WAT 1870 14.890 85.834 141.548 1.00 0.00 H TER 57161 WAT 1870 ATOM 57161 O WAT 1871 136.821 3.748 100.673 1.00 0.00 O ATOM 57162 H1 WAT 1871 136.833 3.864 101.623 1.00 0.00 H ATOM 57163 H2 WAT 1871 135.952 4.046 100.405 1.00 0.00 H TER 57165 WAT 1871 ATOM 57165 O WAT 1872 86.950 92.451 17.441 1.00 0.00 O ATOM 57166 H1 WAT 1872 86.368 92.912 18.045 1.00 0.00 H ATOM 57167 H2 WAT 1872 87.829 92.616 17.783 1.00 0.00 H TER 57169 WAT 1872 ATOM 57169 O WAT 1873 127.979 44.192 157.689 1.00 0.00 O ATOM 57170 H1 WAT 1873 128.932 44.260 157.623 1.00 0.00 H ATOM 57171 H2 WAT 1873 127.805 44.161 158.629 1.00 0.00 H TER 57173 WAT 1873 ATOM 57173 O WAT 1874 95.473 21.780 5.683 1.00 0.00 O ATOM 57174 H1 WAT 1874 95.445 21.069 6.323 1.00 0.00 H ATOM 57175 H2 WAT 1874 94.562 21.896 5.414 1.00 0.00 H TER 57177 WAT 1874 ATOM 57177 O WAT 1875 128.833 27.877 116.568 1.00 0.00 O ATOM 57178 H1 WAT 1875 128.529 28.332 117.353 1.00 0.00 H ATOM 57179 H2 WAT 1875 129.765 28.091 116.513 1.00 0.00 H TER 57181 WAT 1875 ATOM 57181 O WAT 1876 83.303 103.626 121.579 1.00 0.00 O ATOM 57182 H1 WAT 1876 83.971 104.248 121.292 1.00 0.00 H ATOM 57183 H2 WAT 1876 83.743 102.776 121.560 1.00 0.00 H TER 57185 WAT 1876 ATOM 57185 O WAT 1877 84.598 95.188 71.382 1.00 0.00 O ATOM 57186 H1 WAT 1877 84.551 96.047 70.961 1.00 0.00 H ATOM 57187 H2 WAT 1877 84.592 95.381 72.319 1.00 0.00 H TER 57189 WAT 1877 ATOM 57189 O WAT 1878 41.405 75.723 64.990 1.00 0.00 O ATOM 57190 H1 WAT 1878 40.469 75.919 64.948 1.00 0.00 H ATOM 57191 H2 WAT 1878 41.459 74.780 64.837 1.00 0.00 H TER 57193 WAT 1878 ATOM 57193 O WAT 1879 30.113 103.086 120.239 1.00 0.00 O ATOM 57194 H1 WAT 1879 30.125 102.411 120.917 1.00 0.00 H ATOM 57195 H2 WAT 1879 30.156 103.911 120.722 1.00 0.00 H TER 57197 WAT 1879 ATOM 57197 O WAT 1880 82.903 9.665 81.453 1.00 0.00 O ATOM 57198 H1 WAT 1880 82.494 9.721 82.316 1.00 0.00 H ATOM 57199 H2 WAT 1880 82.317 10.159 80.878 1.00 0.00 H TER 57201 WAT 1880 ATOM 57201 O WAT 1881 116.655 20.882 152.682 1.00 0.00 O ATOM 57202 H1 WAT 1881 116.065 21.610 152.487 1.00 0.00 H ATOM 57203 H2 WAT 1881 117.522 21.203 152.434 1.00 0.00 H TER 57205 WAT 1881 ATOM 57205 O WAT 1882 24.010 79.525 114.825 1.00 0.00 O ATOM 57206 H1 WAT 1882 24.940 79.562 115.047 1.00 0.00 H ATOM 57207 H2 WAT 1882 23.798 80.410 114.528 1.00 0.00 H TER 57209 WAT 1882 ATOM 57209 O WAT 1883 135.242 53.311 149.786 1.00 0.00 O ATOM 57210 H1 WAT 1883 134.783 53.442 150.616 1.00 0.00 H ATOM 57211 H2 WAT 1883 135.525 52.397 149.810 1.00 0.00 H TER 57213 WAT 1883 ATOM 57213 O WAT 1884 9.186 135.361 66.948 1.00 0.00 O ATOM 57214 H1 WAT 1884 8.974 135.705 67.815 1.00 0.00 H ATOM 57215 H2 WAT 1884 9.320 134.423 67.088 1.00 0.00 H TER 57217 WAT 1884 ATOM 57217 O WAT 1885 95.240 42.293 130.519 1.00 0.00 O ATOM 57218 H1 WAT 1885 95.383 42.538 131.433 1.00 0.00 H ATOM 57219 H2 WAT 1885 96.068 42.496 130.084 1.00 0.00 H TER 57221 WAT 1885 ATOM 57221 O WAT 1886 112.569 89.638 73.280 1.00 0.00 O ATOM 57222 H1 WAT 1886 113.155 88.902 73.104 1.00 0.00 H ATOM 57223 H2 WAT 1886 111.693 89.252 73.281 1.00 0.00 H TER 57225 WAT 1886 ATOM 57225 O WAT 1887 100.278 85.797 69.826 1.00 0.00 O ATOM 57226 H1 WAT 1887 101.046 85.745 70.394 1.00 0.00 H ATOM 57227 H2 WAT 1887 100.635 85.982 68.957 1.00 0.00 H TER 57229 WAT 1887 ATOM 57229 O WAT 1888 49.557 139.103 107.352 1.00 0.00 O ATOM 57230 H1 WAT 1888 48.943 139.161 108.085 1.00 0.00 H ATOM 57231 H2 WAT 1888 49.656 138.164 107.197 1.00 0.00 H TER 57233 WAT 1888 ATOM 57233 O WAT 1889 84.617 86.297 136.608 1.00 0.00 O ATOM 57234 H1 WAT 1889 84.083 86.778 135.975 1.00 0.00 H ATOM 57235 H2 WAT 1889 84.807 85.464 136.178 1.00 0.00 H TER 57237 WAT 1889 ATOM 57237 O WAT 1890 38.251 103.044 109.560 1.00 0.00 O ATOM 57238 H1 WAT 1890 37.936 102.962 110.460 1.00 0.00 H ATOM 57239 H2 WAT 1890 37.519 103.438 109.085 1.00 0.00 H TER 57241 WAT 1890 ATOM 57241 O WAT 1891 78.926 97.126 135.274 1.00 0.00 O ATOM 57242 H1 WAT 1891 79.510 97.533 134.634 1.00 0.00 H ATOM 57243 H2 WAT 1891 79.128 97.569 136.098 1.00 0.00 H TER 57245 WAT 1891 ATOM 57245 O WAT 1892 145.912 11.159 61.616 1.00 0.00 O ATOM 57246 H1 WAT 1892 146.036 10.257 61.912 1.00 0.00 H ATOM 57247 H2 WAT 1892 145.163 11.476 62.121 1.00 0.00 H TER 57249 WAT 1892 ATOM 57249 O WAT 1893 109.029 60.808 72.605 1.00 0.00 O ATOM 57250 H1 WAT 1893 109.734 61.222 72.107 1.00 0.00 H ATOM 57251 H2 WAT 1893 108.957 59.929 72.232 1.00 0.00 H TER 57253 WAT 1893 ATOM 57253 O WAT 1894 141.072 104.240 110.405 1.00 0.00 O ATOM 57254 H1 WAT 1894 140.950 104.662 109.555 1.00 0.00 H ATOM 57255 H2 WAT 1894 141.203 104.965 111.016 1.00 0.00 H TER 57257 WAT 1894 ATOM 57257 O WAT 1895 144.068 119.973 2.381 1.00 0.00 O ATOM 57258 H1 WAT 1895 143.514 119.597 1.698 1.00 0.00 H ATOM 57259 H2 WAT 1895 144.486 120.726 1.964 1.00 0.00 H TER 57261 WAT 1895 ATOM 57261 O WAT 1896 122.484 96.623 115.642 1.00 0.00 O ATOM 57262 H1 WAT 1896 122.896 96.505 116.498 1.00 0.00 H ATOM 57263 H2 WAT 1896 123.183 96.445 115.013 1.00 0.00 H TER 57265 WAT 1896 ATOM 57265 O WAT 1897 95.681 5.697 128.584 1.00 0.00 O ATOM 57266 H1 WAT 1897 96.135 4.857 128.513 1.00 0.00 H ATOM 57267 H2 WAT 1897 95.154 5.753 127.787 1.00 0.00 H TER 57269 WAT 1897 ATOM 57269 O WAT 1898 89.314 56.443 102.729 1.00 0.00 O ATOM 57270 H1 WAT 1898 89.026 56.821 101.898 1.00 0.00 H ATOM 57271 H2 WAT 1898 89.666 55.585 102.493 1.00 0.00 H TER 57273 WAT 1898 ATOM 57273 O WAT 1899 101.417 133.809 96.786 1.00 0.00 O ATOM 57274 H1 WAT 1899 100.555 134.012 97.149 1.00 0.00 H ATOM 57275 H2 WAT 1899 101.991 134.490 97.138 1.00 0.00 H TER 57277 WAT 1899 ATOM 57277 O WAT 1900 120.943 108.603 62.332 1.00 0.00 O ATOM 57278 H1 WAT 1900 121.652 108.253 61.791 1.00 0.00 H ATOM 57279 H2 WAT 1900 121.373 109.234 62.909 1.00 0.00 H TER 57281 WAT 1900 ATOM 57281 O WAT 1901 10.940 119.777 145.076 1.00 0.00 O ATOM 57282 H1 WAT 1901 11.053 119.909 146.017 1.00 0.00 H ATOM 57283 H2 WAT 1901 9.999 119.875 144.931 1.00 0.00 H TER 57285 WAT 1901 ATOM 57285 O WAT 1902 103.482 80.927 95.004 1.00 0.00 O ATOM 57286 H1 WAT 1902 103.823 81.163 95.867 1.00 0.00 H ATOM 57287 H2 WAT 1902 104.109 80.288 94.665 1.00 0.00 H TER 57289 WAT 1902 ATOM 57289 O WAT 1903 104.983 95.501 153.805 1.00 0.00 O ATOM 57290 H1 WAT 1903 104.062 95.656 153.596 1.00 0.00 H ATOM 57291 H2 WAT 1903 105.462 96.111 153.244 1.00 0.00 H TER 57293 WAT 1903 ATOM 57293 O WAT 1904 79.154 85.722 123.697 1.00 0.00 O ATOM 57294 H1 WAT 1904 79.487 86.604 123.859 1.00 0.00 H ATOM 57295 H2 WAT 1904 79.264 85.592 122.755 1.00 0.00 H TER 57297 WAT 1904 ATOM 57297 O WAT 1905 59.137 110.713 132.965 1.00 0.00 O ATOM 57298 H1 WAT 1905 59.318 111.133 132.124 1.00 0.00 H ATOM 57299 H2 WAT 1905 59.329 111.388 133.616 1.00 0.00 H TER 57301 WAT 1905 ATOM 57301 O WAT 1906 21.615 23.492 127.106 1.00 0.00 O ATOM 57302 H1 WAT 1906 22.053 23.352 126.266 1.00 0.00 H ATOM 57303 H2 WAT 1906 20.879 22.879 127.097 1.00 0.00 H TER 57305 WAT 1906 ATOM 57305 O WAT 1907 77.713 95.650 4.729 1.00 0.00 O ATOM 57306 H1 WAT 1907 77.341 94.792 4.932 1.00 0.00 H ATOM 57307 H2 WAT 1907 77.116 96.273 5.144 1.00 0.00 H TER 57309 WAT 1907 ATOM 57309 O WAT 1908 144.301 75.470 118.448 1.00 0.00 O ATOM 57310 H1 WAT 1908 144.169 76.215 119.034 1.00 0.00 H ATOM 57311 H2 WAT 1908 143.481 74.980 118.495 1.00 0.00 H TER 57313 WAT 1908 ATOM 57313 O WAT 1909 48.374 17.971 150.793 1.00 0.00 O ATOM 57314 H1 WAT 1909 48.482 18.568 150.052 1.00 0.00 H ATOM 57315 H2 WAT 1909 48.745 18.444 151.538 1.00 0.00 H TER 57317 WAT 1909 ATOM 57317 O WAT 1910 2.754 82.043 145.993 1.00 0.00 O ATOM 57318 H1 WAT 1910 3.133 82.890 146.224 1.00 0.00 H ATOM 57319 H2 WAT 1910 3.352 81.684 145.336 1.00 0.00 H TER 57321 WAT 1910 ATOM 57321 O WAT 1911 74.877 8.552 145.330 1.00 0.00 O ATOM 57322 H1 WAT 1911 74.635 8.603 146.255 1.00 0.00 H ATOM 57323 H2 WAT 1911 74.150 8.970 144.868 1.00 0.00 H TER 57325 WAT 1911 ATOM 57325 O WAT 1912 99.265 88.302 156.760 1.00 0.00 O ATOM 57326 H1 WAT 1912 99.729 89.132 156.867 1.00 0.00 H ATOM 57327 H2 WAT 1912 98.343 88.551 156.688 1.00 0.00 H TER 57329 WAT 1912 ATOM 57329 O WAT 1913 125.134 50.847 12.153 1.00 0.00 O ATOM 57330 H1 WAT 1913 124.776 50.799 11.267 1.00 0.00 H ATOM 57331 H2 WAT 1913 125.224 49.934 12.426 1.00 0.00 H TER 57333 WAT 1913 ATOM 57333 O WAT 1914 139.037 141.111 140.155 1.00 0.00 O ATOM 57334 H1 WAT 1914 138.101 141.267 140.031 1.00 0.00 H ATOM 57335 H2 WAT 1914 139.275 140.507 139.452 1.00 0.00 H TER 57337 WAT 1914 ATOM 57337 O WAT 1915 136.912 101.769 26.310 1.00 0.00 O ATOM 57338 H1 WAT 1915 136.711 102.624 25.928 1.00 0.00 H ATOM 57339 H2 WAT 1915 136.284 101.172 25.904 1.00 0.00 H TER 57341 WAT 1915 ATOM 57341 O WAT 1916 80.914 105.979 91.197 1.00 0.00 O ATOM 57342 H1 WAT 1916 81.224 106.617 91.840 1.00 0.00 H ATOM 57343 H2 WAT 1916 81.022 106.417 90.353 1.00 0.00 H TER 57345 WAT 1916 ATOM 57345 O WAT 1917 131.121 15.820 137.395 1.00 0.00 O ATOM 57346 H1 WAT 1917 131.851 16.346 137.068 1.00 0.00 H ATOM 57347 H2 WAT 1917 131.355 15.623 138.302 1.00 0.00 H TER 57349 WAT 1917 ATOM 57349 O WAT 1918 56.885 86.304 137.255 1.00 0.00 O ATOM 57350 H1 WAT 1918 56.563 85.987 136.411 1.00 0.00 H ATOM 57351 H2 WAT 1918 57.434 85.593 137.584 1.00 0.00 H TER 57353 WAT 1918 ATOM 57353 O WAT 1919 40.926 53.672 158.409 1.00 0.00 O ATOM 57354 H1 WAT 1919 41.326 52.851 158.125 1.00 0.00 H ATOM 57355 H2 WAT 1919 40.437 53.440 159.198 1.00 0.00 H TER 57357 WAT 1919 ATOM 57357 O WAT 1920 7.624 95.232 116.786 1.00 0.00 O ATOM 57358 H1 WAT 1920 8.429 95.750 116.778 1.00 0.00 H ATOM 57359 H2 WAT 1920 7.162 95.494 115.990 1.00 0.00 H TER 57361 WAT 1920 ATOM 57361 O WAT 1921 120.383 10.609 110.657 1.00 0.00 O ATOM 57362 H1 WAT 1921 119.569 10.250 111.009 1.00 0.00 H ATOM 57363 H2 WAT 1921 120.859 10.924 111.426 1.00 0.00 H TER 57365 WAT 1921 ATOM 57365 O WAT 1922 19.370 65.984 9.115 1.00 0.00 O ATOM 57366 H1 WAT 1922 19.415 66.724 9.721 1.00 0.00 H ATOM 57367 H2 WAT 1922 19.507 65.214 9.666 1.00 0.00 H TER 57369 WAT 1922 ATOM 57369 O WAT 1923 60.652 114.065 90.952 1.00 0.00 O ATOM 57370 H1 WAT 1923 61.503 113.655 90.797 1.00 0.00 H ATOM 57371 H2 WAT 1923 60.248 113.528 91.633 1.00 0.00 H TER 57373 WAT 1923 ATOM 57373 O WAT 1924 115.227 143.624 24.530 1.00 0.00 O ATOM 57374 H1 WAT 1924 114.302 143.737 24.312 1.00 0.00 H ATOM 57375 H2 WAT 1924 115.318 142.689 24.715 1.00 0.00 H TER 57377 WAT 1924 ATOM 57377 O WAT 1925 59.270 17.715 143.601 1.00 0.00 O ATOM 57378 H1 WAT 1925 59.574 17.941 142.722 1.00 0.00 H ATOM 57379 H2 WAT 1925 59.546 16.806 143.723 1.00 0.00 H TER 57381 WAT 1925 ATOM 57381 O WAT 1926 101.698 105.517 20.430 1.00 0.00 O ATOM 57382 H1 WAT 1926 101.506 104.654 20.796 1.00 0.00 H ATOM 57383 H2 WAT 1926 102.654 105.569 20.426 1.00 0.00 H TER 57385 WAT 1926 ATOM 57385 O WAT 1927 117.055 137.653 150.144 1.00 0.00 O ATOM 57386 H1 WAT 1927 117.640 138.107 150.750 1.00 0.00 H ATOM 57387 H2 WAT 1927 117.597 136.967 149.755 1.00 0.00 H TER 57389 WAT 1927 ATOM 57389 O WAT 1928 94.311 60.698 4.389 1.00 0.00 O ATOM 57390 H1 WAT 1928 94.028 61.603 4.258 1.00 0.00 H ATOM 57391 H2 WAT 1928 93.657 60.325 4.981 1.00 0.00 H TER 57393 WAT 1928 ATOM 57393 O WAT 1929 120.467 77.472 14.164 1.00 0.00 O ATOM 57394 H1 WAT 1929 121.152 77.964 14.616 1.00 0.00 H ATOM 57395 H2 WAT 1929 120.638 76.559 14.393 1.00 0.00 H TER 57397 WAT 1929 ATOM 57397 O WAT 1930 138.103 51.070 27.163 1.00 0.00 O ATOM 57398 H1 WAT 1930 137.206 51.377 27.291 1.00 0.00 H ATOM 57399 H2 WAT 1930 138.021 50.122 27.068 1.00 0.00 H TER 57401 WAT 1930 ATOM 57401 O WAT 1931 107.402 102.344 23.932 1.00 0.00 O ATOM 57402 H1 WAT 1931 108.088 102.026 23.345 1.00 0.00 H ATOM 57403 H2 WAT 1931 107.702 103.212 24.204 1.00 0.00 H TER 57405 WAT 1931 ATOM 57405 O WAT 1932 97.168 92.590 139.533 1.00 0.00 O ATOM 57406 H1 WAT 1932 96.819 93.416 139.866 1.00 0.00 H ATOM 57407 H2 WAT 1932 96.403 92.126 139.193 1.00 0.00 H TER 57409 WAT 1932 ATOM 57409 O WAT 1933 60.423 109.104 154.456 1.00 0.00 O ATOM 57410 H1 WAT 1933 61.085 108.667 154.993 1.00 0.00 H ATOM 57411 H2 WAT 1933 59.638 108.566 154.560 1.00 0.00 H TER 57413 WAT 1933 ATOM 57413 O WAT 1934 102.188 45.735 111.288 1.00 0.00 O ATOM 57414 H1 WAT 1934 102.075 45.668 110.340 1.00 0.00 H ATOM 57415 H2 WAT 1934 101.974 44.862 111.617 1.00 0.00 H TER 57417 WAT 1934 ATOM 57417 O WAT 1935 79.406 68.314 140.016 1.00 0.00 O ATOM 57418 H1 WAT 1935 80.043 68.404 139.307 1.00 0.00 H ATOM 57419 H2 WAT 1935 79.927 68.043 140.772 1.00 0.00 H TER 57421 WAT 1935 ATOM 57421 O WAT 1936 44.862 91.236 158.060 1.00 0.00 O ATOM 57422 H1 WAT 1936 44.248 91.464 157.363 1.00 0.00 H ATOM 57423 H2 WAT 1936 44.323 91.199 158.851 1.00 0.00 H TER 57425 WAT 1936 ATOM 57425 O WAT 1937 76.253 21.346 72.150 1.00 0.00 O ATOM 57426 H1 WAT 1937 76.232 21.539 73.088 1.00 0.00 H ATOM 57427 H2 WAT 1937 75.625 21.958 71.766 1.00 0.00 H TER 57429 WAT 1937 ATOM 57429 O WAT 1938 63.029 7.273 98.761 1.00 0.00 O ATOM 57430 H1 WAT 1938 62.683 7.120 97.882 1.00 0.00 H ATOM 57431 H2 WAT 1938 62.464 7.956 99.125 1.00 0.00 H TER 57433 WAT 1938 ATOM 57433 O WAT 1939 89.533 73.866 135.292 1.00 0.00 O ATOM 57434 H1 WAT 1939 89.456 73.010 135.714 1.00 0.00 H ATOM 57435 H2 WAT 1939 89.301 73.705 134.378 1.00 0.00 H TER 57437 WAT 1939 ATOM 57437 O WAT 1940 93.639 21.373 148.140 1.00 0.00 O ATOM 57438 H1 WAT 1940 93.692 20.439 147.936 1.00 0.00 H ATOM 57439 H2 WAT 1940 94.213 21.792 147.499 1.00 0.00 H TER 57441 WAT 1940 ATOM 57441 O WAT 1941 116.306 115.893 129.825 1.00 0.00 O ATOM 57442 H1 WAT 1941 116.163 116.642 129.248 1.00 0.00 H ATOM 57443 H2 WAT 1941 116.878 115.311 129.324 1.00 0.00 H TER 57445 WAT 1941 ATOM 57445 O WAT 1942 18.803 69.463 70.154 1.00 0.00 O ATOM 57446 H1 WAT 1942 19.731 69.336 70.350 1.00 0.00 H ATOM 57447 H2 WAT 1942 18.352 68.822 70.705 1.00 0.00 H TER 57449 WAT 1942 ATOM 57449 O WAT 1943 47.281 6.113 15.683 1.00 0.00 O ATOM 57450 H1 WAT 1943 46.741 6.654 16.259 1.00 0.00 H ATOM 57451 H2 WAT 1943 48.133 6.076 16.118 1.00 0.00 H TER 57453 WAT 1943 ATOM 57453 O WAT 1944 129.100 30.792 66.186 1.00 0.00 O ATOM 57454 H1 WAT 1944 128.428 30.302 66.661 1.00 0.00 H ATOM 57455 H2 WAT 1944 128.818 30.759 65.271 1.00 0.00 H TER 57457 WAT 1944 ATOM 57457 O WAT 1945 116.030 54.018 67.728 1.00 0.00 O ATOM 57458 H1 WAT 1945 115.603 54.538 67.047 1.00 0.00 H ATOM 57459 H2 WAT 1945 116.373 53.253 67.266 1.00 0.00 H TER 57461 WAT 1945 ATOM 57461 O WAT 1946 3.365 109.323 132.476 1.00 0.00 O ATOM 57462 H1 WAT 1946 3.969 109.660 131.814 1.00 0.00 H ATOM 57463 H2 WAT 1946 3.023 108.513 132.098 1.00 0.00 H TER 57465 WAT 1946 ATOM 57465 O WAT 1947 31.948 4.973 116.639 1.00 0.00 O ATOM 57466 H1 WAT 1947 31.183 4.507 116.301 1.00 0.00 H ATOM 57467 H2 WAT 1947 31.630 5.414 117.428 1.00 0.00 H TER 57469 WAT 1947 ATOM 57469 O WAT 1948 84.174 65.803 6.244 1.00 0.00 O ATOM 57470 H1 WAT 1948 84.891 65.250 5.935 1.00 0.00 H ATOM 57471 H2 WAT 1948 84.369 66.669 5.887 1.00 0.00 H TER 57473 WAT 1948 ATOM 57473 O WAT 1949 101.637 144.905 9.057 1.00 0.00 O ATOM 57474 H1 WAT 1949 102.460 144.762 9.525 1.00 0.00 H ATOM 57475 H2 WAT 1949 101.447 144.062 8.645 1.00 0.00 H TER 57477 WAT 1949 ATOM 57477 O WAT 1950 98.618 113.866 137.103 1.00 0.00 O ATOM 57478 H1 WAT 1950 98.156 114.167 136.321 1.00 0.00 H ATOM 57479 H2 WAT 1950 97.991 113.295 137.547 1.00 0.00 H TER 57481 WAT 1950 ATOM 57481 O WAT 1951 50.995 21.058 60.976 1.00 0.00 O ATOM 57482 H1 WAT 1951 51.259 20.962 60.061 1.00 0.00 H ATOM 57483 H2 WAT 1951 51.812 20.988 61.469 1.00 0.00 H TER 57485 WAT 1951 ATOM 57485 O WAT 1952 138.678 112.261 24.650 1.00 0.00 O ATOM 57486 H1 WAT 1952 137.937 111.945 25.166 1.00 0.00 H ATOM 57487 H2 WAT 1952 138.570 113.212 24.634 1.00 0.00 H TER 57489 WAT 1952 ATOM 57489 O WAT 1953 73.225 31.445 156.312 1.00 0.00 O ATOM 57490 H1 WAT 1953 73.848 31.885 155.734 1.00 0.00 H ATOM 57491 H2 WAT 1953 73.619 30.589 156.482 1.00 0.00 H TER 57493 WAT 1953 ATOM 57493 O WAT 1954 66.442 99.165 77.587 1.00 0.00 O ATOM 57494 H1 WAT 1954 65.932 99.743 77.020 1.00 0.00 H ATOM 57495 H2 WAT 1954 67.018 99.754 78.074 1.00 0.00 H TER 57497 WAT 1954 ATOM 57497 O WAT 1955 29.853 102.413 99.244 1.00 0.00 O ATOM 57498 H1 WAT 1955 29.804 101.461 99.154 1.00 0.00 H ATOM 57499 H2 WAT 1955 30.330 102.703 98.466 1.00 0.00 H TER 57501 WAT 1955 ATOM 57501 O WAT 1956 22.929 61.216 111.484 1.00 0.00 O ATOM 57502 H1 WAT 1956 22.665 61.447 110.593 1.00 0.00 H ATOM 57503 H2 WAT 1956 22.291 61.656 112.045 1.00 0.00 H TER 57505 WAT 1956 ATOM 57505 O WAT 1957 1.805 34.251 70.984 1.00 0.00 O ATOM 57506 H1 WAT 1957 1.294 35.054 70.882 1.00 0.00 H ATOM 57507 H2 WAT 1957 1.630 33.753 70.185 1.00 0.00 H TER 57509 WAT 1957 ATOM 57509 O WAT 1958 117.876 4.743 78.953 1.00 0.00 O ATOM 57510 H1 WAT 1958 117.044 4.359 78.674 1.00 0.00 H ATOM 57511 H2 WAT 1958 118.533 4.315 78.404 1.00 0.00 H TER 57513 WAT 1958 ATOM 57513 O WAT 1959 91.140 110.706 75.305 1.00 0.00 O ATOM 57514 H1 WAT 1959 90.637 110.247 75.977 1.00 0.00 H ATOM 57515 H2 WAT 1959 91.847 111.136 75.787 1.00 0.00 H TER 57517 WAT 1959 ATOM 57517 O WAT 1960 41.490 43.611 87.536 1.00 0.00 O ATOM 57518 H1 WAT 1960 41.269 43.991 86.685 1.00 0.00 H ATOM 57519 H2 WAT 1960 42.445 43.650 87.575 1.00 0.00 H TER 57521 WAT 1960 ATOM 57521 O WAT 1961 64.358 18.819 139.791 1.00 0.00 O ATOM 57522 H1 WAT 1961 64.147 17.960 139.426 1.00 0.00 H ATOM 57523 H2 WAT 1961 65.261 18.734 140.098 1.00 0.00 H TER 57525 WAT 1961 ATOM 57525 O WAT 1962 99.852 108.269 115.681 1.00 0.00 O ATOM 57526 H1 WAT 1962 99.396 107.467 115.425 1.00 0.00 H ATOM 57527 H2 WAT 1962 100.138 108.656 114.854 1.00 0.00 H TER 57529 WAT 1962 ATOM 57529 O WAT 1963 84.255 18.846 21.665 1.00 0.00 O ATOM 57530 H1 WAT 1963 84.107 19.556 22.289 1.00 0.00 H ATOM 57531 H2 WAT 1963 84.465 19.290 20.843 1.00 0.00 H TER 57533 WAT 1963 ATOM 57533 O WAT 1964 113.011 109.895 6.411 1.00 0.00 O ATOM 57534 H1 WAT 1964 112.073 110.068 6.492 1.00 0.00 H ATOM 57535 H2 WAT 1964 113.196 110.007 5.478 1.00 0.00 H TER 57537 WAT 1964 ATOM 57537 O WAT 1965 8.714 50.157 88.772 1.00 0.00 O ATOM 57538 H1 WAT 1965 8.031 50.434 89.384 1.00 0.00 H ATOM 57539 H2 WAT 1965 9.528 50.474 89.163 1.00 0.00 H TER 57541 WAT 1965 ATOM 57541 O WAT 1966 42.232 122.714 105.069 1.00 0.00 O ATOM 57542 H1 WAT 1966 42.318 123.667 105.067 1.00 0.00 H ATOM 57543 H2 WAT 1966 42.845 122.416 104.398 1.00 0.00 H TER 57545 WAT 1966 ATOM 57545 O WAT 1967 134.987 74.753 24.117 1.00 0.00 O ATOM 57546 H1 WAT 1967 134.441 74.562 24.880 1.00 0.00 H ATOM 57547 H2 WAT 1967 135.861 74.454 24.366 1.00 0.00 H TER 57549 WAT 1967 ATOM 57549 O WAT 1968 30.462 75.660 2.849 1.00 0.00 O ATOM 57550 H1 WAT 1968 29.573 75.306 2.812 1.00 0.00 H ATOM 57551 H2 WAT 1968 31.019 74.938 2.557 1.00 0.00 H TER 57553 WAT 1968 ATOM 57553 O WAT 1969 69.833 71.657 14.975 1.00 0.00 O ATOM 57554 H1 WAT 1969 69.976 70.782 15.336 1.00 0.00 H ATOM 57555 H2 WAT 1969 69.021 71.579 14.474 1.00 0.00 H TER 57557 WAT 1969 ATOM 57557 O WAT 1970 23.269 142.779 91.263 1.00 0.00 O ATOM 57558 H1 WAT 1970 24.081 143.062 90.842 1.00 0.00 H ATOM 57559 H2 WAT 1970 23.230 141.837 91.098 1.00 0.00 H TER 57561 WAT 1970 ATOM 57561 O WAT 1971 109.271 104.788 144.865 1.00 0.00 O ATOM 57562 H1 WAT 1971 110.123 105.203 145.001 1.00 0.00 H ATOM 57563 H2 WAT 1971 108.843 105.331 144.202 1.00 0.00 H TER 57565 WAT 1971 ATOM 57565 O WAT 1972 133.615 122.541 140.999 1.00 0.00 O ATOM 57566 H1 WAT 1972 133.205 123.130 141.632 1.00 0.00 H ATOM 57567 H2 WAT 1972 133.537 122.998 140.161 1.00 0.00 H TER 57569 WAT 1972 ATOM 57569 O WAT 1973 112.626 121.978 112.436 1.00 0.00 O ATOM 57570 H1 WAT 1973 111.978 121.907 111.736 1.00 0.00 H ATOM 57571 H2 WAT 1973 113.470 121.929 111.987 1.00 0.00 H TER 57573 WAT 1973 ATOM 57573 O WAT 1974 132.784 44.718 18.589 1.00 0.00 O ATOM 57574 H1 WAT 1974 132.529 44.384 19.449 1.00 0.00 H ATOM 57575 H2 WAT 1974 132.936 45.653 18.732 1.00 0.00 H TER 57577 WAT 1974 ATOM 57577 O WAT 1975 68.151 71.001 107.455 1.00 0.00 O ATOM 57578 H1 WAT 1975 67.590 71.231 108.196 1.00 0.00 H ATOM 57579 H2 WAT 1975 68.456 71.842 107.115 1.00 0.00 H TER 57581 WAT 1975 ATOM 57581 O WAT 1976 145.202 14.223 97.957 1.00 0.00 O ATOM 57582 H1 WAT 1976 145.140 13.883 97.065 1.00 0.00 H ATOM 57583 H2 WAT 1976 145.270 13.443 98.507 1.00 0.00 H TER 57585 WAT 1976 ATOM 57585 O WAT 1977 43.760 79.225 90.492 1.00 0.00 O ATOM 57586 H1 WAT 1977 44.181 78.768 89.764 1.00 0.00 H ATOM 57587 H2 WAT 1977 43.369 78.528 91.018 1.00 0.00 H TER 57589 WAT 1977 ATOM 57589 O WAT 1978 124.630 17.768 9.580 1.00 0.00 O ATOM 57590 H1 WAT 1978 123.921 17.423 10.122 1.00 0.00 H ATOM 57591 H2 WAT 1978 124.186 18.215 8.860 1.00 0.00 H TER 57593 WAT 1978 ATOM 57593 O WAT 1979 27.941 33.958 143.225 1.00 0.00 O ATOM 57594 H1 WAT 1979 27.132 33.527 143.500 1.00 0.00 H ATOM 57595 H2 WAT 1979 27.988 33.800 142.282 1.00 0.00 H TER 57597 WAT 1979 ATOM 57597 O WAT 1980 133.727 115.641 19.565 1.00 0.00 O ATOM 57598 H1 WAT 1980 133.010 115.192 19.116 1.00 0.00 H ATOM 57599 H2 WAT 1980 134.352 114.946 19.773 1.00 0.00 H TER 57601 WAT 1980 ATOM 57601 O WAT 1981 11.415 58.144 68.938 1.00 0.00 O ATOM 57602 H1 WAT 1981 12.021 58.794 69.293 1.00 0.00 H ATOM 57603 H2 WAT 1981 10.636 58.218 69.490 1.00 0.00 H TER 57605 WAT 1981 ATOM 57605 O WAT 1982 74.980 58.837 151.134 1.00 0.00 O ATOM 57606 H1 WAT 1982 74.483 58.158 151.590 1.00 0.00 H ATOM 57607 H2 WAT 1982 75.564 58.355 150.548 1.00 0.00 H TER 57609 WAT 1982 ATOM 57609 O WAT 1983 5.753 25.221 99.507 1.00 0.00 O ATOM 57610 H1 WAT 1983 6.018 24.338 99.248 1.00 0.00 H ATOM 57611 H2 WAT 1983 4.851 25.119 99.811 1.00 0.00 H TER 57613 WAT 1983 ATOM 57613 O WAT 1984 144.523 96.190 127.052 1.00 0.00 O ATOM 57614 H1 WAT 1984 144.552 95.274 126.775 1.00 0.00 H ATOM 57615 H2 WAT 1984 144.092 96.168 127.906 1.00 0.00 H TER 57617 WAT 1984 ATOM 57617 O WAT 1985 135.282 70.856 134.245 1.00 0.00 O ATOM 57618 H1 WAT 1985 134.360 70.835 134.501 1.00 0.00 H ATOM 57619 H2 WAT 1985 135.566 69.944 134.302 1.00 0.00 H TER 57621 WAT 1985 ATOM 57621 O WAT 1986 33.419 97.648 114.794 1.00 0.00 O ATOM 57622 H1 WAT 1986 33.180 98.357 115.391 1.00 0.00 H ATOM 57623 H2 WAT 1986 32.654 97.073 114.787 1.00 0.00 H TER 57625 WAT 1986 ATOM 57625 O WAT 1987 120.017 70.707 112.752 1.00 0.00 O ATOM 57626 H1 WAT 1987 120.420 71.422 112.259 1.00 0.00 H ATOM 57627 H2 WAT 1987 119.104 70.703 112.466 1.00 0.00 H TER 57629 WAT 1987 ATOM 57629 O WAT 1988 57.528 40.257 88.554 1.00 0.00 O ATOM 57630 H1 WAT 1988 58.110 40.109 87.808 1.00 0.00 H ATOM 57631 H2 WAT 1988 57.720 41.153 88.833 1.00 0.00 H TER 57633 WAT 1988 ATOM 57633 O WAT 1989 105.593 35.541 155.166 1.00 0.00 O ATOM 57634 H1 WAT 1989 105.607 36.261 155.796 1.00 0.00 H ATOM 57635 H2 WAT 1989 104.785 35.673 154.670 1.00 0.00 H TER 57637 WAT 1989 ATOM 57637 O WAT 1990 51.235 72.575 11.998 1.00 0.00 O ATOM 57638 H1 WAT 1990 51.067 73.254 12.652 1.00 0.00 H ATOM 57639 H2 WAT 1990 51.469 73.059 11.206 1.00 0.00 H TER 57641 WAT 1990 ATOM 57641 O WAT 1991 55.141 88.700 131.555 1.00 0.00 O ATOM 57642 H1 WAT 1991 56.066 88.500 131.698 1.00 0.00 H ATOM 57643 H2 WAT 1991 54.676 87.927 131.876 1.00 0.00 H TER 57645 WAT 1991 ATOM 57645 O WAT 1992 116.971 31.767 8.317 1.00 0.00 O ATOM 57646 H1 WAT 1992 116.261 32.238 7.881 1.00 0.00 H ATOM 57647 H2 WAT 1992 116.574 30.944 8.600 1.00 0.00 H TER 57649 WAT 1992 ATOM 57649 O WAT 1993 120.995 90.007 12.308 1.00 0.00 O ATOM 57650 H1 WAT 1993 121.349 90.817 12.674 1.00 0.00 H ATOM 57651 H2 WAT 1993 120.922 89.417 13.058 1.00 0.00 H TER 57653 WAT 1993 ATOM 57653 O WAT 1994 39.929 2.254 156.779 1.00 0.00 O ATOM 57654 H1 WAT 1994 39.938 1.384 157.179 1.00 0.00 H ATOM 57655 H2 WAT 1994 40.157 2.849 157.493 1.00 0.00 H TER 57657 WAT 1994 ATOM 57657 O WAT 1995 130.838 82.742 21.293 1.00 0.00 O ATOM 57658 H1 WAT 1995 130.430 81.878 21.255 1.00 0.00 H ATOM 57659 H2 WAT 1995 131.767 82.575 21.134 1.00 0.00 H TER 57661 WAT 1995 ATOM 57661 O WAT 1996 4.991 132.161 124.850 1.00 0.00 O ATOM 57662 H1 WAT 1996 5.683 131.563 124.569 1.00 0.00 H ATOM 57663 H2 WAT 1996 5.147 132.961 124.346 1.00 0.00 H TER 57665 WAT 1996 ATOM 57665 O WAT 1997 29.802 17.441 70.994 1.00 0.00 O ATOM 57666 H1 WAT 1997 29.825 17.824 71.871 1.00 0.00 H ATOM 57667 H2 WAT 1997 29.883 16.499 71.141 1.00 0.00 H TER 57669 WAT 1997 ATOM 57669 O WAT 1998 131.436 67.582 64.225 1.00 0.00 O ATOM 57670 H1 WAT 1998 130.894 68.135 64.787 1.00 0.00 H ATOM 57671 H2 WAT 1998 131.025 67.640 63.363 1.00 0.00 H TER 57673 WAT 1998 ATOM 57673 O WAT 1999 8.824 30.938 103.401 1.00 0.00 O ATOM 57674 H1 WAT 1999 8.402 31.777 103.212 1.00 0.00 H ATOM 57675 H2 WAT 1999 8.308 30.566 104.116 1.00 0.00 H TER 57677 WAT 1999 ATOM 57677 O WAT 2000 15.652 99.807 147.241 1.00 0.00 O ATOM 57678 H1 WAT 2000 14.716 99.605 147.252 1.00 0.00 H ATOM 57679 H2 WAT 2000 16.046 99.091 146.744 1.00 0.00 H TER 57681 WAT 2000 ATOM 57681 O WAT 2001 138.385 122.109 80.023 1.00 0.00 O ATOM 57682 H1 WAT 2001 138.895 122.329 80.802 1.00 0.00 H ATOM 57683 H2 WAT 2001 138.643 122.765 79.375 1.00 0.00 H TER 57685 WAT 2001 ATOM 57685 O WAT 2002 63.953 2.944 75.021 1.00 0.00 O ATOM 57686 H1 WAT 2002 63.245 3.528 74.751 1.00 0.00 H ATOM 57687 H2 WAT 2002 64.039 2.321 74.300 1.00 0.00 H TER 57689 WAT 2002 ATOM 57689 O WAT 2003 80.954 52.659 103.881 1.00 0.00 O ATOM 57690 H1 WAT 2003 81.277 53.541 103.695 1.00 0.00 H ATOM 57691 H2 WAT 2003 80.094 52.797 104.278 1.00 0.00 H TER 57693 WAT 2003 ATOM 57693 O WAT 2004 144.980 145.022 106.839 1.00 0.00 O ATOM 57694 H1 WAT 2004 145.141 145.792 106.294 1.00 0.00 H ATOM 57695 H2 WAT 2004 145.621 145.091 107.547 1.00 0.00 H TER 57697 WAT 2004 ATOM 57697 O WAT 2005 93.372 116.482 108.970 1.00 0.00 O ATOM 57698 H1 WAT 2005 94.178 116.284 108.493 1.00 0.00 H ATOM 57699 H2 WAT 2005 92.690 116.480 108.298 1.00 0.00 H TER 57701 WAT 2005 ATOM 57701 O WAT 2006 3.816 98.011 80.196 1.00 0.00 O ATOM 57702 H1 WAT 2006 3.406 98.834 80.463 1.00 0.00 H ATOM 57703 H2 WAT 2006 3.146 97.347 80.358 1.00 0.00 H TER 57705 WAT 2006 ATOM 57705 O WAT 2007 35.969 107.274 108.722 1.00 0.00 O ATOM 57706 H1 WAT 2007 35.813 107.677 107.868 1.00 0.00 H ATOM 57707 H2 WAT 2007 35.252 107.590 109.271 1.00 0.00 H TER 57709 WAT 2007 ATOM 57709 O WAT 2008 144.686 111.580 76.166 1.00 0.00 O ATOM 57710 H1 WAT 2008 144.178 111.837 75.396 1.00 0.00 H ATOM 57711 H2 WAT 2008 144.729 110.625 76.116 1.00 0.00 H TER 57713 WAT 2008 ATOM 57713 O WAT 2009 51.686 33.291 85.352 1.00 0.00 O ATOM 57714 H1 WAT 2009 51.817 33.856 84.591 1.00 0.00 H ATOM 57715 H2 WAT 2009 51.422 32.448 84.981 1.00 0.00 H TER 57717 WAT 2009 ATOM 57717 O WAT 2010 36.207 114.483 96.416 1.00 0.00 O ATOM 57718 H1 WAT 2010 37.134 114.494 96.656 1.00 0.00 H ATOM 57719 H2 WAT 2010 35.856 115.295 96.782 1.00 0.00 H TER 57721 WAT 2010 ATOM 57721 O WAT 2011 44.987 138.181 115.804 1.00 0.00 O ATOM 57722 H1 WAT 2011 44.853 138.951 116.357 1.00 0.00 H ATOM 57723 H2 WAT 2011 45.866 138.295 115.443 1.00 0.00 H TER 57725 WAT 2011 ATOM 57725 O WAT 2012 5.956 32.808 152.974 1.00 0.00 O ATOM 57726 H1 WAT 2012 5.583 33.394 153.633 1.00 0.00 H ATOM 57727 H2 WAT 2012 5.979 33.332 152.173 1.00 0.00 H TER 57729 WAT 2012 ATOM 57729 O WAT 2013 30.389 92.977 89.271 1.00 0.00 O ATOM 57730 H1 WAT 2013 30.456 93.381 90.136 1.00 0.00 H ATOM 57731 H2 WAT 2013 29.463 92.749 89.184 1.00 0.00 H TER 57733 WAT 2013 ATOM 57733 O WAT 2014 136.998 2.280 78.628 1.00 0.00 O ATOM 57734 H1 WAT 2014 136.648 3.072 78.219 1.00 0.00 H ATOM 57735 H2 WAT 2014 136.595 1.561 78.142 1.00 0.00 H TER 57737 WAT 2014 ATOM 57737 O WAT 2015 32.858 11.327 91.429 1.00 0.00 O ATOM 57738 H1 WAT 2015 33.628 11.894 91.380 1.00 0.00 H ATOM 57739 H2 WAT 2015 32.186 11.791 90.930 1.00 0.00 H TER 57741 WAT 2015 ATOM 57741 O WAT 2016 113.630 17.938 138.159 1.00 0.00 O ATOM 57742 H1 WAT 2016 113.988 17.936 137.271 1.00 0.00 H ATOM 57743 H2 WAT 2016 112.681 17.932 138.035 1.00 0.00 H TER 57745 WAT 2016 ATOM 57745 O WAT 2017 87.932 79.109 130.594 1.00 0.00 O ATOM 57746 H1 WAT 2017 88.203 79.929 130.182 1.00 0.00 H ATOM 57747 H2 WAT 2017 88.498 78.445 130.201 1.00 0.00 H TER 57749 WAT 2017 ATOM 57749 O WAT 2018 73.878 32.409 109.997 1.00 0.00 O ATOM 57750 H1 WAT 2018 74.622 32.986 109.828 1.00 0.00 H ATOM 57751 H2 WAT 2018 74.208 31.531 109.807 1.00 0.00 H TER 57753 WAT 2018 ATOM 57753 O WAT 2019 74.704 135.806 137.270 1.00 0.00 O ATOM 57754 H1 WAT 2019 74.057 136.431 137.596 1.00 0.00 H ATOM 57755 H2 WAT 2019 75.375 136.350 136.858 1.00 0.00 H TER 57757 WAT 2019 ATOM 57757 O WAT 2020 33.809 69.296 92.890 1.00 0.00 O ATOM 57758 H1 WAT 2020 33.525 69.986 92.290 1.00 0.00 H ATOM 57759 H2 WAT 2020 33.914 68.523 92.334 1.00 0.00 H TER 57761 WAT 2020 ATOM 57761 O WAT 2021 17.258 133.434 79.973 1.00 0.00 O ATOM 57762 H1 WAT 2021 18.066 133.885 79.729 1.00 0.00 H ATOM 57763 H2 WAT 2021 16.991 132.973 79.178 1.00 0.00 H TER 57765 WAT 2021 ATOM 57765 O WAT 2022 113.328 63.301 145.732 1.00 0.00 O ATOM 57766 H1 WAT 2022 113.462 62.406 146.042 1.00 0.00 H ATOM 57767 H2 WAT 2022 114.028 63.805 146.147 1.00 0.00 H TER 57769 WAT 2022 ATOM 57769 O WAT 2023 51.546 67.098 95.077 1.00 0.00 O ATOM 57770 H1 WAT 2023 51.131 67.913 95.361 1.00 0.00 H ATOM 57771 H2 WAT 2023 52.336 67.380 94.617 1.00 0.00 H TER 57773 WAT 2023 ATOM 57773 O WAT 2024 22.772 72.349 86.126 1.00 0.00 O ATOM 57774 H1 WAT 2024 23.242 73.036 85.654 1.00 0.00 H ATOM 57775 H2 WAT 2024 22.688 72.685 87.018 1.00 0.00 H TER 57777 WAT 2024 ATOM 57777 O WAT 2025 103.196 5.741 71.491 1.00 0.00 O ATOM 57778 H1 WAT 2025 102.730 5.875 70.666 1.00 0.00 H ATOM 57779 H2 WAT 2025 104.095 5.541 71.229 1.00 0.00 H TER 57781 WAT 2025 ATOM 57781 O WAT 2026 15.056 33.770 71.278 1.00 0.00 O ATOM 57782 H1 WAT 2026 14.501 33.866 72.052 1.00 0.00 H ATOM 57783 H2 WAT 2026 14.783 34.482 70.699 1.00 0.00 H TER 57785 WAT 2026 ATOM 57785 O WAT 2027 8.206 73.576 121.326 1.00 0.00 O ATOM 57786 H1 WAT 2027 8.121 74.529 121.298 1.00 0.00 H ATOM 57787 H2 WAT 2027 9.043 73.398 120.897 1.00 0.00 H TER 57789 WAT 2027 ATOM 57789 O WAT 2028 4.058 61.047 132.788 1.00 0.00 O ATOM 57790 H1 WAT 2028 3.183 61.434 132.814 1.00 0.00 H ATOM 57791 H2 WAT 2028 4.388 61.141 133.682 1.00 0.00 H TER 57793 WAT 2028 ATOM 57793 O WAT 2029 97.125 29.953 129.935 1.00 0.00 O ATOM 57794 H1 WAT 2029 97.320 30.581 129.239 1.00 0.00 H ATOM 57795 H2 WAT 2029 96.579 30.440 130.552 1.00 0.00 H TER 57797 WAT 2029 ATOM 57797 O WAT 2030 102.450 112.927 101.228 1.00 0.00 O ATOM 57798 H1 WAT 2030 102.942 113.583 101.722 1.00 0.00 H ATOM 57799 H2 WAT 2030 101.611 112.863 101.684 1.00 0.00 H TER 57801 WAT 2030 ATOM 57801 O WAT 2031 20.895 28.693 18.175 1.00 0.00 O ATOM 57802 H1 WAT 2031 20.269 28.027 18.461 1.00 0.00 H ATOM 57803 H2 WAT 2031 21.366 28.937 18.971 1.00 0.00 H TER 57805 WAT 2031 ATOM 57805 O WAT 2032 32.238 72.492 119.240 1.00 0.00 O ATOM 57806 H1 WAT 2032 31.923 72.305 120.125 1.00 0.00 H ATOM 57807 H2 WAT 2032 32.837 71.773 119.042 1.00 0.00 H TER 57809 WAT 2032 ATOM 57809 O WAT 2033 145.289 125.808 145.268 1.00 0.00 O ATOM 57810 H1 WAT 2033 144.568 125.196 145.119 1.00 0.00 H ATOM 57811 H2 WAT 2033 144.966 126.395 145.952 1.00 0.00 H TER 57813 WAT 2033 ATOM 57813 O WAT 2034 129.661 78.222 12.812 1.00 0.00 O ATOM 57814 H1 WAT 2034 129.667 78.460 11.885 1.00 0.00 H ATOM 57815 H2 WAT 2034 129.509 79.049 13.270 1.00 0.00 H TER 57817 WAT 2034 ATOM 57817 O WAT 2035 36.624 80.894 0.868 1.00 0.00 O ATOM 57818 H1 WAT 2035 35.734 80.588 0.689 1.00 0.00 H ATOM 57819 H2 WAT 2035 36.559 81.335 1.716 1.00 0.00 H TER 57821 WAT 2035 ATOM 57821 O WAT 2036 75.977 52.599 89.346 1.00 0.00 O ATOM 57822 H1 WAT 2036 75.541 53.078 90.050 1.00 0.00 H ATOM 57823 H2 WAT 2036 76.695 53.171 89.075 1.00 0.00 H TER 57825 WAT 2036 ATOM 57825 O WAT 2037 84.435 53.444 5.531 1.00 0.00 O ATOM 57826 H1 WAT 2037 84.918 54.179 5.154 1.00 0.00 H ATOM 57827 H2 WAT 2037 85.012 53.105 6.216 1.00 0.00 H TER 57829 WAT 2037 ATOM 57829 O WAT 2038 24.816 136.979 108.211 1.00 0.00 O ATOM 57830 H1 WAT 2038 25.462 136.319 108.467 1.00 0.00 H ATOM 57831 H2 WAT 2038 24.102 136.476 107.820 1.00 0.00 H TER 57833 WAT 2038 ATOM 57833 O WAT 2039 31.678 143.421 12.395 1.00 0.00 O ATOM 57834 H1 WAT 2039 31.248 142.841 11.767 1.00 0.00 H ATOM 57835 H2 WAT 2039 32.261 143.962 11.862 1.00 0.00 H TER 57837 WAT 2039 ATOM 57837 O WAT 2040 127.113 118.329 1.758 1.00 0.00 O ATOM 57838 H1 WAT 2040 126.860 119.095 2.272 1.00 0.00 H ATOM 57839 H2 WAT 2040 127.065 117.599 2.376 1.00 0.00 H TER 57841 WAT 2040 ATOM 57841 O WAT 2041 30.449 77.514 112.604 1.00 0.00 O ATOM 57842 H1 WAT 2041 29.572 77.140 112.685 1.00 0.00 H ATOM 57843 H2 WAT 2041 30.657 77.439 111.673 1.00 0.00 H TER 57845 WAT 2041 ATOM 57845 O WAT 2042 116.684 138.674 140.781 1.00 0.00 O ATOM 57846 H1 WAT 2042 117.560 138.345 140.983 1.00 0.00 H ATOM 57847 H2 WAT 2042 116.196 137.899 140.503 1.00 0.00 H TER 57849 WAT 2042 ATOM 57849 O WAT 2043 4.183 132.111 105.095 1.00 0.00 O ATOM 57850 H1 WAT 2043 4.638 132.924 105.314 1.00 0.00 H ATOM 57851 H2 WAT 2043 4.645 131.777 104.326 1.00 0.00 H TER 57853 WAT 2043 ATOM 57853 O WAT 2044 123.363 63.127 137.126 1.00 0.00 O ATOM 57854 H1 WAT 2044 122.839 62.511 136.613 1.00 0.00 H ATOM 57855 H2 WAT 2044 123.661 62.618 137.880 1.00 0.00 H TER 57857 WAT 2044 ATOM 57857 O WAT 2045 118.132 92.076 133.697 1.00 0.00 O ATOM 57858 H1 WAT 2045 118.227 91.965 132.751 1.00 0.00 H ATOM 57859 H2 WAT 2045 118.835 92.678 133.939 1.00 0.00 H TER 57861 WAT 2045 ATOM 57861 O WAT 2046 47.365 71.608 125.786 1.00 0.00 O ATOM 57862 H1 WAT 2046 47.965 71.563 126.530 1.00 0.00 H ATOM 57863 H2 WAT 2046 46.873 70.788 125.826 1.00 0.00 H TER 57865 WAT 2046 ATOM 57865 O WAT 2047 0.458 137.163 124.846 1.00 0.00 O ATOM 57866 H1 WAT 2047 1.122 136.477 124.785 1.00 0.00 H ATOM 57867 H2 WAT 2047 -0.028 136.956 125.644 1.00 0.00 H TER 57869 WAT 2047 ATOM 57869 O WAT 2048 26.589 122.228 144.555 1.00 0.00 O ATOM 57870 H1 WAT 2048 26.370 121.646 143.827 1.00 0.00 H ATOM 57871 H2 WAT 2048 25.746 122.583 144.839 1.00 0.00 H TER 57873 WAT 2048 ATOM 57873 O WAT 2049 27.874 37.109 57.116 1.00 0.00 O ATOM 57874 H1 WAT 2049 27.756 36.171 56.965 1.00 0.00 H ATOM 57875 H2 WAT 2049 28.107 37.462 56.257 1.00 0.00 H TER 57877 WAT 2049 ATOM 57877 O WAT 2050 60.975 0.257 98.260 1.00 0.00 O ATOM 57878 H1 WAT 2050 61.335 -0.109 99.068 1.00 0.00 H ATOM 57879 H2 WAT 2050 60.170 -0.239 98.110 1.00 0.00 H TER 57881 WAT 2050 ATOM 57881 O WAT 2051 85.279 77.118 111.169 1.00 0.00 O ATOM 57882 H1 WAT 2051 85.624 77.871 110.689 1.00 0.00 H ATOM 57883 H2 WAT 2051 85.156 77.439 112.062 1.00 0.00 H TER 57885 WAT 2051 ATOM 57885 O WAT 2052 4.725 50.645 62.904 1.00 0.00 O ATOM 57886 H1 WAT 2052 4.101 51.284 63.247 1.00 0.00 H ATOM 57887 H2 WAT 2052 5.571 50.922 63.257 1.00 0.00 H TER 57889 WAT 2052 ATOM 57889 O WAT 2053 100.514 3.686 120.542 1.00 0.00 O ATOM 57890 H1 WAT 2053 100.952 3.084 121.144 1.00 0.00 H ATOM 57891 H2 WAT 2053 100.559 3.250 119.692 1.00 0.00 H TER 57893 WAT 2053 ATOM 57893 O WAT 2054 2.945 64.800 119.088 1.00 0.00 O ATOM 57894 H1 WAT 2054 2.478 65.369 118.476 1.00 0.00 H ATOM 57895 H2 WAT 2054 3.147 64.015 118.579 1.00 0.00 H TER 57897 WAT 2054 ATOM 57897 O WAT 2055 73.178 133.456 99.109 1.00 0.00 O ATOM 57898 H1 WAT 2055 73.459 133.584 98.203 1.00 0.00 H ATOM 57899 H2 WAT 2055 73.431 132.555 99.312 1.00 0.00 H TER 57901 WAT 2055 ATOM 57901 O WAT 2056 85.061 118.200 157.073 1.00 0.00 O ATOM 57902 H1 WAT 2056 85.753 118.813 157.321 1.00 0.00 H ATOM 57903 H2 WAT 2056 84.264 118.730 157.065 1.00 0.00 H TER 57905 WAT 2056 ATOM 57905 O WAT 2057 -0.077 142.929 156.560 1.00 0.00 O ATOM 57906 H1 WAT 2057 -0.148 143.021 157.510 1.00 0.00 H ATOM 57907 H2 WAT 2057 0.388 143.717 156.278 1.00 0.00 H TER 57909 WAT 2057 ATOM 57909 O WAT 2058 76.143 78.790 126.710 1.00 0.00 O ATOM 57910 H1 WAT 2058 76.096 79.304 127.516 1.00 0.00 H ATOM 57911 H2 WAT 2058 75.843 77.918 126.964 1.00 0.00 H TER 57913 WAT 2058 ATOM 57913 O WAT 2059 93.997 55.691 127.148 1.00 0.00 O ATOM 57914 H1 WAT 2059 93.738 56.507 126.719 1.00 0.00 H ATOM 57915 H2 WAT 2059 93.723 55.802 128.058 1.00 0.00 H TER 57917 WAT 2059 ATOM 57917 O WAT 2060 33.250 69.523 77.413 1.00 0.00 O ATOM 57918 H1 WAT 2060 33.593 70.090 76.722 1.00 0.00 H ATOM 57919 H2 WAT 2060 32.577 70.050 77.844 1.00 0.00 H TER 57921 WAT 2060 ATOM 57921 O WAT 2061 10.477 90.854 147.794 1.00 0.00 O ATOM 57922 H1 WAT 2061 10.063 91.621 148.189 1.00 0.00 H ATOM 57923 H2 WAT 2061 11.355 91.151 147.555 1.00 0.00 H TER 57925 WAT 2061 ATOM 57925 O WAT 2062 74.025 67.425 71.934 1.00 0.00 O ATOM 57926 H1 WAT 2062 74.080 67.224 71.000 1.00 0.00 H ATOM 57927 H2 WAT 2062 74.888 67.198 72.280 1.00 0.00 H TER 57929 WAT 2062 ATOM 57929 O WAT 2063 96.771 32.419 103.471 1.00 0.00 O ATOM 57930 H1 WAT 2063 97.554 32.902 103.206 1.00 0.00 H ATOM 57931 H2 WAT 2063 96.787 31.624 102.938 1.00 0.00 H TER 57933 WAT 2063 ATOM 57933 O WAT 2064 118.365 135.112 138.166 1.00 0.00 O ATOM 57934 H1 WAT 2064 117.895 135.439 137.399 1.00 0.00 H ATOM 57935 H2 WAT 2064 117.720 135.138 138.872 1.00 0.00 H TER 57937 WAT 2064 ATOM 57937 O WAT 2065 39.304 126.757 109.213 1.00 0.00 O ATOM 57938 H1 WAT 2065 38.867 126.070 109.717 1.00 0.00 H ATOM 57939 H2 WAT 2065 38.737 126.895 108.454 1.00 0.00 H TER 57941 WAT 2065 ATOM 57941 O WAT 2066 116.678 74.109 115.229 1.00 0.00 O ATOM 57942 H1 WAT 2066 116.354 73.332 114.775 1.00 0.00 H ATOM 57943 H2 WAT 2066 116.364 74.844 114.702 1.00 0.00 H TER 57945 WAT 2066 ATOM 57945 O WAT 2067 74.341 124.560 127.463 1.00 0.00 O ATOM 57946 H1 WAT 2067 74.809 124.463 126.634 1.00 0.00 H ATOM 57947 H2 WAT 2067 74.234 123.665 127.785 1.00 0.00 H TER 57949 WAT 2067 ATOM 57949 O WAT 2068 36.590 91.380 142.111 1.00 0.00 O ATOM 57950 H1 WAT 2068 36.628 90.452 141.880 1.00 0.00 H ATOM 57951 H2 WAT 2068 36.587 91.837 141.270 1.00 0.00 H TER 57953 WAT 2068 ATOM 57953 O WAT 2069 134.598 104.993 131.280 1.00 0.00 O ATOM 57954 H1 WAT 2069 134.147 104.177 131.500 1.00 0.00 H ATOM 57955 H2 WAT 2069 134.067 105.380 130.584 1.00 0.00 H TER 57957 WAT 2069 ATOM 57957 O WAT 2070 106.630 141.055 95.878 1.00 0.00 O ATOM 57958 H1 WAT 2070 107.377 141.013 95.281 1.00 0.00 H ATOM 57959 H2 WAT 2070 106.041 140.365 95.573 1.00 0.00 H TER 57961 WAT 2070 ATOM 57961 O WAT 2071 120.360 23.897 58.518 1.00 0.00 O ATOM 57962 H1 WAT 2071 119.697 24.560 58.712 1.00 0.00 H ATOM 57963 H2 WAT 2071 119.936 23.311 57.891 1.00 0.00 H TER 57965 WAT 2071 ATOM 57965 O WAT 2072 100.412 86.546 99.944 1.00 0.00 O ATOM 57966 H1 WAT 2072 100.698 85.632 99.918 1.00 0.00 H ATOM 57967 H2 WAT 2072 100.841 86.909 100.718 1.00 0.00 H TER 57969 WAT 2072 ATOM 57969 O WAT 2073 121.621 114.625 149.425 1.00 0.00 O ATOM 57970 H1 WAT 2073 122.238 114.985 148.787 1.00 0.00 H ATOM 57971 H2 WAT 2073 121.590 113.690 149.226 1.00 0.00 H TER 57973 WAT 2073 ATOM 57973 O WAT 2074 108.720 49.834 140.185 1.00 0.00 O ATOM 57974 H1 WAT 2074 108.862 49.960 139.247 1.00 0.00 H ATOM 57975 H2 WAT 2074 107.805 50.079 140.324 1.00 0.00 H TER 57977 WAT 2074 ATOM 57977 O WAT 2075 32.348 29.171 79.121 1.00 0.00 O ATOM 57978 H1 WAT 2075 31.983 29.768 79.774 1.00 0.00 H ATOM 57979 H2 WAT 2075 33.246 29.015 79.414 1.00 0.00 H TER 57981 WAT 2075 ATOM 57981 O WAT 2076 94.499 93.590 105.275 1.00 0.00 O ATOM 57982 H1 WAT 2076 94.287 92.778 105.735 1.00 0.00 H ATOM 57983 H2 WAT 2076 93.811 93.678 104.615 1.00 0.00 H TER 57985 WAT 2076 ATOM 57985 O WAT 2077 64.324 48.075 134.888 1.00 0.00 O ATOM 57986 H1 WAT 2077 64.090 48.502 134.064 1.00 0.00 H ATOM 57987 H2 WAT 2077 65.109 48.536 135.183 1.00 0.00 H TER 57989 WAT 2077 ATOM 57989 O WAT 2078 27.202 11.007 21.796 1.00 0.00 O ATOM 57990 H1 WAT 2078 28.026 10.536 21.673 1.00 0.00 H ATOM 57991 H2 WAT 2078 27.394 11.650 22.480 1.00 0.00 H TER 57993 WAT 2078 ATOM 57993 O WAT 2079 107.431 121.436 130.887 1.00 0.00 O ATOM 57994 H1 WAT 2079 107.011 120.633 131.196 1.00 0.00 H ATOM 57995 H2 WAT 2079 108.086 121.636 131.556 1.00 0.00 H TER 57997 WAT 2079 ATOM 57997 O WAT 2080 16.264 92.107 101.472 1.00 0.00 O ATOM 57998 H1 WAT 2080 16.760 92.414 100.713 1.00 0.00 H ATOM 57999 H2 WAT 2080 16.180 92.879 102.032 1.00 0.00 H TER 58001 WAT 2080 ATOM 58001 O WAT 2081 98.618 77.050 142.792 1.00 0.00 O ATOM 58002 H1 WAT 2081 98.358 77.822 143.294 1.00 0.00 H ATOM 58003 H2 WAT 2081 99.233 77.385 142.139 1.00 0.00 H TER 58005 WAT 2081 ATOM 58005 O WAT 2082 93.465 90.133 150.129 1.00 0.00 O ATOM 58006 H1 WAT 2082 93.256 89.220 150.324 1.00 0.00 H ATOM 58007 H2 WAT 2082 94.001 90.093 149.337 1.00 0.00 H TER 58009 WAT 2082 ATOM 58009 O WAT 2083 16.469 106.183 91.699 1.00 0.00 O ATOM 58010 H1 WAT 2083 16.095 105.368 91.363 1.00 0.00 H ATOM 58011 H2 WAT 2083 16.718 106.673 90.915 1.00 0.00 H TER 58013 WAT 2083 ATOM 58013 O WAT 2084 68.568 126.481 111.732 1.00 0.00 O ATOM 58014 H1 WAT 2084 67.839 126.072 112.198 1.00 0.00 H ATOM 58015 H2 WAT 2084 69.260 126.557 112.389 1.00 0.00 H TER 58017 WAT 2084 ATOM 58017 O WAT 2085 85.033 97.858 105.223 1.00 0.00 O ATOM 58018 H1 WAT 2085 85.508 97.290 105.830 1.00 0.00 H ATOM 58019 H2 WAT 2085 84.953 97.339 104.423 1.00 0.00 H TER 58021 WAT 2085 ATOM 58021 O WAT 2086 9.599 15.713 63.872 1.00 0.00 O ATOM 58022 H1 WAT 2086 9.343 14.829 63.610 1.00 0.00 H ATOM 58023 H2 WAT 2086 8.803 16.234 63.766 1.00 0.00 H TER 58025 WAT 2086 ATOM 58025 O WAT 2087 69.992 23.686 141.030 1.00 0.00 O ATOM 58026 H1 WAT 2087 69.381 24.177 141.580 1.00 0.00 H ATOM 58027 H2 WAT 2087 70.339 24.335 140.419 1.00 0.00 H TER 58029 WAT 2087 ATOM 58029 O WAT 2088 86.592 111.402 84.022 1.00 0.00 O ATOM 58030 H1 WAT 2088 86.726 111.745 83.139 1.00 0.00 H ATOM 58031 H2 WAT 2088 85.655 111.512 84.182 1.00 0.00 H TER 58033 WAT 2088 ATOM 58033 O WAT 2089 57.847 111.172 61.888 1.00 0.00 O ATOM 58034 H1 WAT 2089 56.893 111.250 61.900 1.00 0.00 H ATOM 58035 H2 WAT 2089 58.143 111.928 61.381 1.00 0.00 H TER 58037 WAT 2089 ATOM 58037 O WAT 2090 86.638 71.165 22.048 1.00 0.00 O ATOM 58038 H1 WAT 2090 86.325 71.759 21.366 1.00 0.00 H ATOM 58039 H2 WAT 2090 87.020 70.429 21.570 1.00 0.00 H TER 58041 WAT 2090 ATOM 58041 O WAT 2091 35.727 23.360 123.329 1.00 0.00 O ATOM 58042 H1 WAT 2091 36.145 23.674 124.131 1.00 0.00 H ATOM 58043 H2 WAT 2091 35.053 22.752 123.633 1.00 0.00 H TER 58045 WAT 2091 ATOM 58045 O WAT 2092 121.943 61.725 23.786 1.00 0.00 O ATOM 58046 H1 WAT 2092 120.991 61.632 23.792 1.00 0.00 H ATOM 58047 H2 WAT 2092 122.103 62.588 24.167 1.00 0.00 H TER 58049 WAT 2092 ATOM 58049 O WAT 2093 54.088 27.830 102.401 1.00 0.00 O ATOM 58050 H1 WAT 2093 53.685 27.820 103.270 1.00 0.00 H ATOM 58051 H2 WAT 2093 53.657 28.553 101.946 1.00 0.00 H TER 58053 WAT 2093 ATOM 58053 O WAT 2094 18.522 80.665 19.148 1.00 0.00 O ATOM 58054 H1 WAT 2094 18.866 81.104 19.926 1.00 0.00 H ATOM 58055 H2 WAT 2094 18.943 79.805 19.153 1.00 0.00 H TER 58057 WAT 2094 ATOM 58057 O WAT 2095 126.429 106.598 152.175 1.00 0.00 O ATOM 58058 H1 WAT 2095 126.013 105.955 152.749 1.00 0.00 H ATOM 58059 H2 WAT 2095 125.756 106.815 151.530 1.00 0.00 H TER 58061 WAT 2095 ATOM 58061 O WAT 2096 140.633 35.411 130.168 1.00 0.00 O ATOM 58062 H1 WAT 2096 140.324 35.935 129.429 1.00 0.00 H ATOM 58063 H2 WAT 2096 140.996 34.621 129.768 1.00 0.00 H TER 58065 WAT 2096 ATOM 58065 O WAT 2097 75.923 39.241 18.076 1.00 0.00 O ATOM 58066 H1 WAT 2097 75.656 39.929 18.685 1.00 0.00 H ATOM 58067 H2 WAT 2097 76.497 38.674 18.591 1.00 0.00 H TER 58069 WAT 2097 ATOM 58069 O WAT 2098 46.108 118.162 16.089 1.00 0.00 O ATOM 58070 H1 WAT 2098 46.390 118.773 15.408 1.00 0.00 H ATOM 58071 H2 WAT 2098 46.486 118.512 16.896 1.00 0.00 H TER 58073 WAT 2098 ATOM 58073 O WAT 2099 63.104 143.594 58.396 1.00 0.00 O ATOM 58074 H1 WAT 2099 62.301 143.394 57.916 1.00 0.00 H ATOM 58075 H2 WAT 2099 62.815 144.132 59.133 1.00 0.00 H TER 58077 WAT 2099 ATOM 58077 O WAT 2100 116.272 12.666 88.494 1.00 0.00 O ATOM 58078 H1 WAT 2100 116.463 13.080 87.652 1.00 0.00 H ATOM 58079 H2 WAT 2100 115.491 12.139 88.330 1.00 0.00 H TER 58081 WAT 2100 ATOM 58081 O WAT 2101 91.677 12.631 0.504 1.00 0.00 O ATOM 58082 H1 WAT 2101 90.973 12.061 0.194 1.00 0.00 H ATOM 58083 H2 WAT 2101 91.341 13.518 0.374 1.00 0.00 H TER 58085 WAT 2101 ATOM 58085 O WAT 2102 134.506 14.023 76.182 1.00 0.00 O ATOM 58086 H1 WAT 2102 134.601 13.089 76.368 1.00 0.00 H ATOM 58087 H2 WAT 2102 135.371 14.295 75.875 1.00 0.00 H TER 58089 WAT 2102 ATOM 58089 O WAT 2103 112.057 84.654 8.672 1.00 0.00 O ATOM 58090 H1 WAT 2103 112.525 85.465 8.867 1.00 0.00 H ATOM 58091 H2 WAT 2103 111.253 84.711 9.188 1.00 0.00 H TER 58093 WAT 2103 ATOM 58093 O WAT 2104 97.215 16.895 128.562 1.00 0.00 O ATOM 58094 H1 WAT 2104 97.576 16.208 129.122 1.00 0.00 H ATOM 58095 H2 WAT 2104 97.951 17.485 128.400 1.00 0.00 H TER 58097 WAT 2104 ATOM 58097 O WAT 2105 50.925 43.151 77.227 1.00 0.00 O ATOM 58098 H1 WAT 2105 50.349 42.426 76.982 1.00 0.00 H ATOM 58099 H2 WAT 2105 51.788 42.891 76.904 1.00 0.00 H TER 58101 WAT 2105 ATOM 58101 O WAT 2106 79.019 78.262 134.100 1.00 0.00 O ATOM 58102 H1 WAT 2106 78.958 77.615 133.397 1.00 0.00 H ATOM 58103 H2 WAT 2106 78.193 78.743 134.055 1.00 0.00 H TER 58105 WAT 2106 ATOM 58105 O WAT 2107 132.523 111.164 129.380 1.00 0.00 O ATOM 58106 H1 WAT 2107 132.116 110.722 130.125 1.00 0.00 H ATOM 58107 H2 WAT 2107 131.839 111.743 129.043 1.00 0.00 H TER 58109 WAT 2107 ATOM 58109 O WAT 2108 63.807 28.121 136.575 1.00 0.00 O ATOM 58110 H1 WAT 2108 63.833 27.192 136.348 1.00 0.00 H ATOM 58111 H2 WAT 2108 63.034 28.457 136.122 1.00 0.00 H TER 58113 WAT 2108 ATOM 58113 O WAT 2109 143.144 94.501 71.596 1.00 0.00 O ATOM 58114 H1 WAT 2109 142.320 94.737 72.022 1.00 0.00 H ATOM 58115 H2 WAT 2109 143.408 93.685 72.022 1.00 0.00 H TER 58117 WAT 2109 ATOM 58117 O WAT 2110 48.251 26.323 110.665 1.00 0.00 O ATOM 58118 H1 WAT 2110 48.223 25.438 111.030 1.00 0.00 H ATOM 58119 H2 WAT 2110 47.397 26.698 110.881 1.00 0.00 H TER 58121 WAT 2110 ATOM 58121 O WAT 2111 105.903 135.770 122.704 1.00 0.00 O ATOM 58122 H1 WAT 2111 105.171 135.285 123.085 1.00 0.00 H ATOM 58123 H2 WAT 2111 105.701 136.689 122.883 1.00 0.00 H TER 58125 WAT 2111 ATOM 58125 O WAT 2112 55.366 80.409 123.929 1.00 0.00 O ATOM 58126 H1 WAT 2112 55.316 80.378 124.884 1.00 0.00 H ATOM 58127 H2 WAT 2112 56.265 80.152 123.727 1.00 0.00 H TER 58129 WAT 2112 ATOM 58129 O WAT 2113 104.723 88.077 126.216 1.00 0.00 O ATOM 58130 H1 WAT 2113 103.906 88.505 126.471 1.00 0.00 H ATOM 58131 H2 WAT 2113 104.967 88.497 125.392 1.00 0.00 H TER 58133 WAT 2113 ATOM 58133 O WAT 2114 2.063 17.825 89.817 1.00 0.00 O ATOM 58134 H1 WAT 2114 2.464 18.530 89.308 1.00 0.00 H ATOM 58135 H2 WAT 2114 2.737 17.571 90.447 1.00 0.00 H TER 58137 WAT 2114 ATOM 58137 O WAT 2115 96.384 57.362 79.821 1.00 0.00 O ATOM 58138 H1 WAT 2115 97.065 56.800 80.191 1.00 0.00 H ATOM 58139 H2 WAT 2115 96.322 57.092 78.905 1.00 0.00 H TER 58141 WAT 2115 ATOM 58141 O WAT 2116 105.599 25.453 20.281 1.00 0.00 O ATOM 58142 H1 WAT 2116 104.685 25.600 20.524 1.00 0.00 H ATOM 58143 H2 WAT 2116 105.559 24.811 19.572 1.00 0.00 H TER 58145 WAT 2116 ATOM 58145 O WAT 2117 94.145 23.878 11.523 1.00 0.00 O ATOM 58146 H1 WAT 2117 95.006 23.515 11.729 1.00 0.00 H ATOM 58147 H2 WAT 2117 93.555 23.125 11.548 1.00 0.00 H TER 58149 WAT 2117 ATOM 58149 O WAT 2118 127.388 77.364 134.313 1.00 0.00 O ATOM 58150 H1 WAT 2118 126.441 77.322 134.448 1.00 0.00 H ATOM 58151 H2 WAT 2118 127.490 77.479 133.369 1.00 0.00 H TER 58153 WAT 2118 ATOM 58153 O WAT 2119 53.934 106.445 91.314 1.00 0.00 O ATOM 58154 H1 WAT 2119 53.874 107.294 90.878 1.00 0.00 H ATOM 58155 H2 WAT 2119 54.873 106.301 91.431 1.00 0.00 H TER 58157 WAT 2119 ATOM 58157 O WAT 2120 89.520 36.291 10.459 1.00 0.00 O ATOM 58158 H1 WAT 2120 89.436 36.441 9.517 1.00 0.00 H ATOM 58159 H2 WAT 2120 90.464 36.230 10.608 1.00 0.00 H TER 58161 WAT 2120 ATOM 58161 O WAT 2121 139.242 17.765 63.314 1.00 0.00 O ATOM 58162 H1 WAT 2121 139.806 17.201 63.843 1.00 0.00 H ATOM 58163 H2 WAT 2121 138.971 17.212 62.580 1.00 0.00 H TER 58165 WAT 2121 ATOM 58165 O WAT 2122 25.494 6.602 133.382 1.00 0.00 O ATOM 58166 H1 WAT 2122 25.829 6.220 132.571 1.00 0.00 H ATOM 58167 H2 WAT 2122 26.273 6.922 133.837 1.00 0.00 H TER 58169 WAT 2122 ATOM 58169 O WAT 2123 62.510 25.823 151.066 1.00 0.00 O ATOM 58170 H1 WAT 2123 63.365 25.719 151.484 1.00 0.00 H ATOM 58171 H2 WAT 2123 62.106 24.957 151.129 1.00 0.00 H TER 58173 WAT 2123 ATOM 58173 O WAT 2124 29.392 106.508 62.031 1.00 0.00 O ATOM 58174 H1 WAT 2124 28.641 105.930 61.898 1.00 0.00 H ATOM 58175 H2 WAT 2124 29.323 107.155 61.329 1.00 0.00 H TER 58177 WAT 2124 ATOM 58177 O WAT 2125 35.802 13.148 89.428 1.00 0.00 O ATOM 58178 H1 WAT 2125 36.538 12.721 89.868 1.00 0.00 H ATOM 58179 H2 WAT 2125 35.148 12.456 89.331 1.00 0.00 H TER 58181 WAT 2125 ATOM 58181 O WAT 2126 42.248 125.420 105.302 1.00 0.00 O ATOM 58182 H1 WAT 2126 42.231 125.884 106.138 1.00 0.00 H ATOM 58183 H2 WAT 2126 42.143 126.107 104.644 1.00 0.00 H TER 58185 WAT 2126 ATOM 58185 O WAT 2127 90.085 53.639 116.400 1.00 0.00 O ATOM 58186 H1 WAT 2127 90.769 53.217 116.921 1.00 0.00 H ATOM 58187 H2 WAT 2127 90.560 54.090 115.702 1.00 0.00 H TER 58189 WAT 2127 ATOM 58189 O WAT 2128 9.437 71.232 61.235 1.00 0.00 O ATOM 58190 H1 WAT 2128 9.904 70.663 60.623 1.00 0.00 H ATOM 58191 H2 WAT 2128 9.044 70.632 61.868 1.00 0.00 H TER 58193 WAT 2128 ATOM 58193 O WAT 2129 1.728 33.145 138.817 1.00 0.00 O ATOM 58194 H1 WAT 2129 2.680 33.120 138.914 1.00 0.00 H ATOM 58195 H2 WAT 2129 1.394 32.776 139.635 1.00 0.00 H TER 58197 WAT 2129 ATOM 58197 O WAT 2130 32.320 12.567 142.918 1.00 0.00 O ATOM 58198 H1 WAT 2130 32.953 12.447 142.210 1.00 0.00 H ATOM 58199 H2 WAT 2130 31.685 11.862 142.793 1.00 0.00 H TER 58201 WAT 2130 ATOM 58201 O WAT 2131 106.511 102.663 104.287 1.00 0.00 O ATOM 58202 H1 WAT 2131 105.737 102.201 103.964 1.00 0.00 H ATOM 58203 H2 WAT 2131 107.242 102.264 103.816 1.00 0.00 H TER 58205 WAT 2131 ATOM 58205 O WAT 2132 23.891 48.126 85.637 1.00 0.00 O ATOM 58206 H1 WAT 2132 23.310 47.923 84.903 1.00 0.00 H ATOM 58207 H2 WAT 2132 24.119 49.047 85.514 1.00 0.00 H TER 58209 WAT 2132 ATOM 58209 O WAT 2133 61.151 39.596 128.434 1.00 0.00 O ATOM 58210 H1 WAT 2133 61.826 38.977 128.153 1.00 0.00 H ATOM 58211 H2 WAT 2133 61.076 39.457 129.378 1.00 0.00 H TER 58213 WAT 2133 ATOM 58213 O WAT 2134 59.826 42.592 140.837 1.00 0.00 O ATOM 58214 H1 WAT 2134 60.694 42.718 140.452 1.00 0.00 H ATOM 58215 H2 WAT 2134 59.360 42.046 140.204 1.00 0.00 H TER 58217 WAT 2134 ATOM 58217 O WAT 2135 3.782 48.906 126.733 1.00 0.00 O ATOM 58218 H1 WAT 2135 4.516 48.937 127.348 1.00 0.00 H ATOM 58219 H2 WAT 2135 3.444 49.801 126.719 1.00 0.00 H TER 58221 WAT 2135 ATOM 58221 O WAT 2136 143.231 38.744 69.742 1.00 0.00 O ATOM 58222 H1 WAT 2136 143.937 38.496 69.147 1.00 0.00 H ATOM 58223 H2 WAT 2136 142.429 38.532 69.265 1.00 0.00 H TER 58225 WAT 2136 ATOM 58225 O WAT 2137 89.247 49.746 77.434 1.00 0.00 O ATOM 58226 H1 WAT 2137 88.298 49.616 77.438 1.00 0.00 H ATOM 58227 H2 WAT 2137 89.412 50.325 78.178 1.00 0.00 H TER 58229 WAT 2137 ATOM 58229 O WAT 2138 135.243 89.716 78.628 1.00 0.00 O ATOM 58230 H1 WAT 2138 134.309 89.814 78.444 1.00 0.00 H ATOM 58231 H2 WAT 2138 135.341 88.799 78.886 1.00 0.00 H TER 58233 WAT 2138 ATOM 58233 O WAT 2139 117.474 46.022 113.921 1.00 0.00 O ATOM 58234 H1 WAT 2139 116.882 46.612 113.455 1.00 0.00 H ATOM 58235 H2 WAT 2139 118.309 46.109 113.462 1.00 0.00 H TER 58237 WAT 2139 ATOM 58237 O WAT 2140 75.483 110.941 66.329 1.00 0.00 O ATOM 58238 H1 WAT 2140 75.730 110.044 66.556 1.00 0.00 H ATOM 58239 H2 WAT 2140 75.427 110.940 65.374 1.00 0.00 H TER 58241 WAT 2140 ATOM 58241 O WAT 2141 23.204 73.105 118.072 1.00 0.00 O ATOM 58242 H1 WAT 2141 24.046 73.313 117.667 1.00 0.00 H ATOM 58243 H2 WAT 2141 22.670 72.764 117.355 1.00 0.00 H TER 58245 WAT 2141 ATOM 58245 O WAT 2142 26.724 122.867 6.218 1.00 0.00 O ATOM 58246 H1 WAT 2142 27.141 123.567 6.722 1.00 0.00 H ATOM 58247 H2 WAT 2142 26.724 123.188 5.316 1.00 0.00 H TER 58249 WAT 2142 ATOM 58249 O WAT 2143 13.232 52.023 9.901 1.00 0.00 O ATOM 58250 H1 WAT 2143 13.815 51.503 10.455 1.00 0.00 H ATOM 58251 H2 WAT 2143 12.875 52.689 10.489 1.00 0.00 H TER 58253 WAT 2143 ATOM 58253 O WAT 2144 135.084 70.943 157.066 1.00 0.00 O ATOM 58254 H1 WAT 2144 134.292 70.415 156.968 1.00 0.00 H ATOM 58255 H2 WAT 2144 135.408 70.729 157.941 1.00 0.00 H TER 58257 WAT 2144 ATOM 58257 O WAT 2145 7.480 77.685 137.633 1.00 0.00 O ATOM 58258 H1 WAT 2145 6.938 77.841 138.407 1.00 0.00 H ATOM 58259 H2 WAT 2145 7.223 78.372 137.018 1.00 0.00 H TER 58261 WAT 2145 ATOM 58261 O WAT 2146 74.557 68.002 99.171 1.00 0.00 O ATOM 58262 H1 WAT 2146 74.070 68.739 99.543 1.00 0.00 H ATOM 58263 H2 WAT 2146 73.904 67.512 98.671 1.00 0.00 H TER 58265 WAT 2146 ATOM 58265 O WAT 2147 0.971 32.469 141.278 1.00 0.00 O ATOM 58266 H1 WAT 2147 0.929 33.031 142.051 1.00 0.00 H ATOM 58267 H2 WAT 2147 0.577 31.643 141.560 1.00 0.00 H TER 58269 WAT 2147 ATOM 58269 O WAT 2148 25.708 35.857 1.478 1.00 0.00 O ATOM 58270 H1 WAT 2148 26.121 35.012 1.301 1.00 0.00 H ATOM 58271 H2 WAT 2148 25.308 35.752 2.342 1.00 0.00 H TER 58273 WAT 2148 ATOM 58273 O WAT 2149 84.222 91.658 132.090 1.00 0.00 O ATOM 58274 H1 WAT 2149 84.964 91.205 131.689 1.00 0.00 H ATOM 58275 H2 WAT 2149 83.638 91.855 131.358 1.00 0.00 H TER 58277 WAT 2149 ATOM 58277 O WAT 2150 86.628 103.812 76.325 1.00 0.00 O ATOM 58278 H1 WAT 2150 87.025 104.628 76.629 1.00 0.00 H ATOM 58279 H2 WAT 2150 86.890 103.746 75.407 1.00 0.00 H TER 58281 WAT 2150 ATOM 58281 O WAT 2151 134.942 91.849 11.709 1.00 0.00 O ATOM 58282 H1 WAT 2151 135.721 92.382 11.864 1.00 0.00 H ATOM 58283 H2 WAT 2151 135.051 91.090 12.282 1.00 0.00 H TER 58285 WAT 2151 ATOM 58285 O WAT 2152 102.119 139.259 95.529 1.00 0.00 O ATOM 58286 H1 WAT 2152 102.502 139.577 96.347 1.00 0.00 H ATOM 58287 H2 WAT 2152 102.194 139.999 94.926 1.00 0.00 H TER 58289 WAT 2152 ATOM 58289 O WAT 2153 6.642 37.398 139.287 1.00 0.00 O ATOM 58290 H1 WAT 2153 7.465 37.394 138.798 1.00 0.00 H ATOM 58291 H2 WAT 2153 6.879 37.730 140.153 1.00 0.00 H TER 58293 WAT 2153 ATOM 58293 O WAT 2154 140.339 127.291 134.989 1.00 0.00 O ATOM 58294 H1 WAT 2154 140.994 127.339 135.686 1.00 0.00 H ATOM 58295 H2 WAT 2154 139.902 128.142 135.013 1.00 0.00 H TER 58297 WAT 2154 ATOM 58297 O WAT 2155 96.558 129.571 14.531 1.00 0.00 O ATOM 58298 H1 WAT 2155 95.684 129.610 14.142 1.00 0.00 H ATOM 58299 H2 WAT 2155 96.647 128.665 14.828 1.00 0.00 H TER 58301 WAT 2155 ATOM 58301 O WAT 2156 37.164 141.712 71.340 1.00 0.00 O ATOM 58302 H1 WAT 2156 37.337 140.831 71.671 1.00 0.00 H ATOM 58303 H2 WAT 2156 37.841 141.857 70.678 1.00 0.00 H TER 58305 WAT 2156 ATOM 58305 O WAT 2157 126.060 55.268 12.965 1.00 0.00 O ATOM 58306 H1 WAT 2157 125.318 55.094 12.385 1.00 0.00 H ATOM 58307 H2 WAT 2157 126.522 54.432 13.021 1.00 0.00 H TER 58309 WAT 2157 ATOM 58309 O WAT 2158 76.770 45.363 137.109 1.00 0.00 O ATOM 58310 H1 WAT 2158 76.441 46.000 136.475 1.00 0.00 H ATOM 58311 H2 WAT 2158 76.487 45.702 137.958 1.00 0.00 H TER 58313 WAT 2158 ATOM 58313 O WAT 2159 22.907 45.194 117.317 1.00 0.00 O ATOM 58314 H1 WAT 2159 22.418 44.395 117.515 1.00 0.00 H ATOM 58315 H2 WAT 2159 22.247 45.887 117.327 1.00 0.00 H TER 58317 WAT 2159 ATOM 58317 O WAT 2160 39.330 27.040 74.425 1.00 0.00 O ATOM 58318 H1 WAT 2160 38.925 27.828 74.061 1.00 0.00 H ATOM 58319 H2 WAT 2160 38.600 26.437 74.562 1.00 0.00 H TER 58321 WAT 2160 ATOM 58321 O WAT 2161 111.729 2.422 116.515 1.00 0.00 O ATOM 58322 H1 WAT 2161 111.260 2.744 117.285 1.00 0.00 H ATOM 58323 H2 WAT 2161 111.160 2.644 115.778 1.00 0.00 H TER 58325 WAT 2161 ATOM 58325 O WAT 2162 115.991 57.201 9.536 1.00 0.00 O ATOM 58326 H1 WAT 2162 116.024 56.684 8.731 1.00 0.00 H ATOM 58327 H2 WAT 2162 116.720 56.871 10.062 1.00 0.00 H TER 58329 WAT 2162 ATOM 58329 O WAT 2163 26.693 31.162 74.756 1.00 0.00 O ATOM 58330 H1 WAT 2163 27.391 31.774 74.524 1.00 0.00 H ATOM 58331 H2 WAT 2163 26.676 31.170 75.713 1.00 0.00 H TER 58333 WAT 2163 ATOM 58333 O WAT 2164 115.728 52.086 10.640 1.00 0.00 O ATOM 58334 H1 WAT 2164 116.167 52.412 11.426 1.00 0.00 H ATOM 58335 H2 WAT 2164 115.000 51.562 10.973 1.00 0.00 H TER 58337 WAT 2164 ATOM 58337 O WAT 2165 44.435 34.357 82.701 1.00 0.00 O ATOM 58338 H1 WAT 2165 44.569 35.276 82.470 1.00 0.00 H ATOM 58339 H2 WAT 2165 44.721 33.872 81.927 1.00 0.00 H TER 58341 WAT 2165 ATOM 58341 O WAT 2166 105.567 18.234 108.641 1.00 0.00 O ATOM 58342 H1 WAT 2166 105.800 19.143 108.829 1.00 0.00 H ATOM 58343 H2 WAT 2166 105.367 17.856 109.497 1.00 0.00 H TER 58345 WAT 2166 ATOM 58345 O WAT 2167 93.226 95.095 107.377 1.00 0.00 O ATOM 58346 H1 WAT 2167 93.494 94.709 108.211 1.00 0.00 H ATOM 58347 H2 WAT 2167 93.863 94.765 106.744 1.00 0.00 H TER 58349 WAT 2167 ATOM 58349 O WAT 2168 52.282 140.245 0.005 1.00 0.00 O ATOM 58350 H1 WAT 2168 52.040 140.976 0.574 1.00 0.00 H ATOM 58351 H2 WAT 2168 52.962 139.779 0.491 1.00 0.00 H TER 58353 WAT 2168 ATOM 58353 O WAT 2169 34.220 132.323 8.527 1.00 0.00 O ATOM 58354 H1 WAT 2169 33.327 132.666 8.477 1.00 0.00 H ATOM 58355 H2 WAT 2169 34.778 133.085 8.375 1.00 0.00 H TER 58357 WAT 2169 ATOM 58357 O WAT 2170 97.851 68.129 85.696 1.00 0.00 O ATOM 58358 H1 WAT 2170 98.076 69.058 85.751 1.00 0.00 H ATOM 58359 H2 WAT 2170 96.986 68.068 86.103 1.00 0.00 H TER 58361 WAT 2170 ATOM 58361 O WAT 2171 81.735 91.892 74.335 1.00 0.00 O ATOM 58362 H1 WAT 2171 81.431 92.800 74.352 1.00 0.00 H ATOM 58363 H2 WAT 2171 82.608 91.925 74.726 1.00 0.00 H TER 58365 WAT 2171 ATOM 58365 O WAT 2172 13.055 101.917 5.564 1.00 0.00 O ATOM 58366 H1 WAT 2172 13.284 102.383 6.368 1.00 0.00 H ATOM 58367 H2 WAT 2172 13.455 101.054 5.665 1.00 0.00 H TER 58369 WAT 2172 ATOM 58369 O WAT 2173 58.165 10.483 125.060 1.00 0.00 O ATOM 58370 H1 WAT 2173 57.693 11.064 124.464 1.00 0.00 H ATOM 58371 H2 WAT 2173 58.509 9.790 124.497 1.00 0.00 H TER 58373 WAT 2173 ATOM 58373 O WAT 2174 82.824 73.653 57.173 1.00 0.00 O ATOM 58374 H1 WAT 2174 83.278 73.906 56.368 1.00 0.00 H ATOM 58375 H2 WAT 2174 83.363 72.953 57.542 1.00 0.00 H TER 58377 WAT 2174 ATOM 58377 O WAT 2175 73.248 71.184 135.670 1.00 0.00 O ATOM 58378 H1 WAT 2175 73.036 71.918 135.094 1.00 0.00 H ATOM 58379 H2 WAT 2175 73.025 71.495 136.547 1.00 0.00 H TER 58381 WAT 2175 ATOM 58381 O WAT 2176 120.537 76.019 83.636 1.00 0.00 O ATOM 58382 H1 WAT 2176 121.355 76.200 83.172 1.00 0.00 H ATOM 58383 H2 WAT 2176 120.487 75.064 83.669 1.00 0.00 H TER 58385 WAT 2176 ATOM 58385 O WAT 2177 132.119 9.591 88.867 1.00 0.00 O ATOM 58386 H1 WAT 2177 132.065 9.768 87.928 1.00 0.00 H ATOM 58387 H2 WAT 2177 131.290 9.914 89.219 1.00 0.00 H TER 58389 WAT 2177 ATOM 58389 O WAT 2178 36.352 43.224 126.079 1.00 0.00 O ATOM 58390 H1 WAT 2178 35.838 43.156 126.884 1.00 0.00 H ATOM 58391 H2 WAT 2178 35.878 42.686 125.446 1.00 0.00 H TER 58393 WAT 2178 ATOM 58393 O WAT 2179 140.795 1.257 132.932 1.00 0.00 O ATOM 58394 H1 WAT 2179 140.187 0.868 133.561 1.00 0.00 H ATOM 58395 H2 WAT 2179 140.824 2.184 133.169 1.00 0.00 H TER 58397 WAT 2179 ATOM 58397 O WAT 2180 71.979 38.166 19.166 1.00 0.00 O ATOM 58398 H1 WAT 2180 71.069 38.436 19.295 1.00 0.00 H ATOM 58399 H2 WAT 2180 72.406 38.357 20.001 1.00 0.00 H TER 58401 WAT 2180 ATOM 58401 O WAT 2181 40.444 91.361 138.602 1.00 0.00 O ATOM 58402 H1 WAT 2181 40.635 90.677 139.243 1.00 0.00 H ATOM 58403 H2 WAT 2181 41.283 91.802 138.465 1.00 0.00 H TER 58405 WAT 2181 ATOM 58405 O WAT 2182 114.668 128.732 19.220 1.00 0.00 O ATOM 58406 H1 WAT 2182 115.085 129.200 19.943 1.00 0.00 H ATOM 58407 H2 WAT 2182 115.284 128.034 18.998 1.00 0.00 H TER 58409 WAT 2182 ATOM 58409 O WAT 2183 43.365 138.121 88.463 1.00 0.00 O ATOM 58410 H1 WAT 2183 43.839 137.308 88.286 1.00 0.00 H ATOM 58411 H2 WAT 2183 42.981 137.990 89.330 1.00 0.00 H TER 58413 WAT 2183 ATOM 58413 O WAT 2184 96.123 59.160 145.258 1.00 0.00 O ATOM 58414 H1 WAT 2184 96.032 59.435 146.170 1.00 0.00 H ATOM 58415 H2 WAT 2184 95.633 59.815 144.760 1.00 0.00 H TER 58417 WAT 2184 ATOM 58417 O WAT 2185 42.674 0.519 106.502 1.00 0.00 O ATOM 58418 H1 WAT 2185 42.645 -0.279 105.973 1.00 0.00 H ATOM 58419 H2 WAT 2185 43.162 0.269 107.286 1.00 0.00 H TER 58421 WAT 2185 ATOM 58421 O WAT 2186 42.444 143.886 104.967 1.00 0.00 O ATOM 58422 H1 WAT 2186 41.504 144.059 105.030 1.00 0.00 H ATOM 58423 H2 WAT 2186 42.611 143.225 105.639 1.00 0.00 H TER 58425 WAT 2186 ATOM 58425 O WAT 2187 69.498 58.970 92.198 1.00 0.00 O ATOM 58426 H1 WAT 2187 70.074 58.226 92.373 1.00 0.00 H ATOM 58427 H2 WAT 2187 69.003 58.712 91.420 1.00 0.00 H TER 58429 WAT 2187 ATOM 58429 O WAT 2188 46.218 98.452 73.351 1.00 0.00 O ATOM 58430 H1 WAT 2188 46.645 97.642 73.628 1.00 0.00 H ATOM 58431 H2 WAT 2188 45.837 98.243 72.498 1.00 0.00 H TER 58433 WAT 2188 ATOM 58433 O WAT 2189 132.891 21.798 143.155 1.00 0.00 O ATOM 58434 H1 WAT 2189 132.786 20.984 143.648 1.00 0.00 H ATOM 58435 H2 WAT 2189 133.478 22.330 143.692 1.00 0.00 H TER 58437 WAT 2189 ATOM 58437 O WAT 2190 65.465 24.370 17.488 1.00 0.00 O ATOM 58438 H1 WAT 2190 64.702 23.838 17.715 1.00 0.00 H ATOM 58439 H2 WAT 2190 65.115 25.069 16.936 1.00 0.00 H TER 58441 WAT 2190 ATOM 58441 O WAT 2191 28.265 31.458 124.504 1.00 0.00 O ATOM 58442 H1 WAT 2191 28.305 31.598 125.450 1.00 0.00 H ATOM 58443 H2 WAT 2191 27.769 30.645 124.402 1.00 0.00 H TER 58445 WAT 2191 ATOM 58445 O WAT 2192 116.215 144.704 76.010 1.00 0.00 O ATOM 58446 H1 WAT 2192 115.317 144.419 76.178 1.00 0.00 H ATOM 58447 H2 WAT 2192 116.691 143.896 75.821 1.00 0.00 H TER 58449 WAT 2192 ATOM 58449 O WAT 2193 35.137 105.497 5.530 1.00 0.00 O ATOM 58450 H1 WAT 2193 34.603 105.353 6.312 1.00 0.00 H ATOM 58451 H2 WAT 2193 36.039 105.391 5.834 1.00 0.00 H TER 58453 WAT 2193 ATOM 58453 O WAT 2194 117.193 76.214 73.073 1.00 0.00 O ATOM 58454 H1 WAT 2194 117.508 77.014 72.651 1.00 0.00 H ATOM 58455 H2 WAT 2194 116.883 76.503 73.931 1.00 0.00 H TER 58457 WAT 2194 ATOM 58457 O WAT 2195 50.973 35.616 87.586 1.00 0.00 O ATOM 58458 H1 WAT 2195 51.643 36.135 87.140 1.00 0.00 H ATOM 58459 H2 WAT 2195 50.450 36.261 88.062 1.00 0.00 H TER 58461 WAT 2195 ATOM 58461 O WAT 2196 82.639 16.768 79.923 1.00 0.00 O ATOM 58462 H1 WAT 2196 82.886 17.605 80.315 1.00 0.00 H ATOM 58463 H2 WAT 2196 83.240 16.663 79.184 1.00 0.00 H TER 58465 WAT 2196 ATOM 58465 O WAT 2197 34.243 115.264 152.104 1.00 0.00 O ATOM 58466 H1 WAT 2197 34.654 114.439 151.847 1.00 0.00 H ATOM 58467 H2 WAT 2197 33.890 115.094 152.977 1.00 0.00 H TER 58469 WAT 2197 ATOM 58469 O WAT 2198 25.503 52.426 152.274 1.00 0.00 O ATOM 58470 H1 WAT 2198 25.099 51.584 152.065 1.00 0.00 H ATOM 58471 H2 WAT 2198 25.719 52.363 153.205 1.00 0.00 H TER 58473 WAT 2198 ATOM 58473 O WAT 2199 55.214 105.837 106.284 1.00 0.00 O ATOM 58474 H1 WAT 2199 54.815 105.341 107.000 1.00 0.00 H ATOM 58475 H2 WAT 2199 55.498 105.170 105.660 1.00 0.00 H TER 58477 WAT 2199 ATOM 58477 O WAT 2200 112.189 89.288 56.166 1.00 0.00 O ATOM 58478 H1 WAT 2200 111.708 89.062 56.962 1.00 0.00 H ATOM 58479 H2 WAT 2200 111.747 90.069 55.832 1.00 0.00 H TER 58481 WAT 2200 ATOM 58481 O WAT 2201 120.706 14.870 99.013 1.00 0.00 O ATOM 58482 H1 WAT 2201 120.582 14.134 98.414 1.00 0.00 H ATOM 58483 H2 WAT 2201 119.873 14.942 99.479 1.00 0.00 H TER 58485 WAT 2201 ATOM 58485 O WAT 2202 124.966 26.141 135.168 1.00 0.00 O ATOM 58486 H1 WAT 2202 125.121 27.063 134.961 1.00 0.00 H ATOM 58487 H2 WAT 2202 124.985 26.104 136.124 1.00 0.00 H TER 58489 WAT 2202 ATOM 58489 O WAT 2203 134.794 119.841 92.512 1.00 0.00 O ATOM 58490 H1 WAT 2203 133.962 119.754 92.976 1.00 0.00 H ATOM 58491 H2 WAT 2203 135.235 119.003 92.652 1.00 0.00 H TER 58493 WAT 2203 ATOM 58493 O WAT 2204 145.377 75.216 98.384 1.00 0.00 O ATOM 58494 H1 WAT 2204 144.965 75.394 99.230 1.00 0.00 H ATOM 58495 H2 WAT 2204 146.315 75.302 98.552 1.00 0.00 H TER 58497 WAT 2204 ATOM 58497 O WAT 2205 3.547 29.283 72.771 1.00 0.00 O ATOM 58498 H1 WAT 2205 3.507 28.457 73.253 1.00 0.00 H ATOM 58499 H2 WAT 2205 3.270 29.944 73.406 1.00 0.00 H TER 58501 WAT 2205 ATOM 58501 O WAT 2206 57.143 118.705 103.821 1.00 0.00 O ATOM 58502 H1 WAT 2206 56.285 119.127 103.876 1.00 0.00 H ATOM 58503 H2 WAT 2206 57.758 119.371 104.128 1.00 0.00 H TER 58505 WAT 2206 ATOM 58505 O WAT 2207 29.960 57.652 95.678 1.00 0.00 O ATOM 58506 H1 WAT 2207 30.503 58.196 96.249 1.00 0.00 H ATOM 58507 H2 WAT 2207 30.247 57.874 94.792 1.00 0.00 H TER 58509 WAT 2207 ATOM 58509 O WAT 2208 37.048 75.239 111.849 1.00 0.00 O ATOM 58510 H1 WAT 2208 37.281 74.327 112.018 1.00 0.00 H ATOM 58511 H2 WAT 2208 36.657 75.229 110.976 1.00 0.00 H TER 58513 WAT 2208 ATOM 58513 O WAT 2209 95.946 65.096 141.383 1.00 0.00 O ATOM 58514 H1 WAT 2209 96.821 65.136 140.997 1.00 0.00 H ATOM 58515 H2 WAT 2209 95.944 65.790 142.042 1.00 0.00 H TER 58517 WAT 2209 ATOM 58517 O WAT 2210 28.086 32.208 8.326 1.00 0.00 O ATOM 58518 H1 WAT 2210 28.293 33.048 8.735 1.00 0.00 H ATOM 58519 H2 WAT 2210 27.164 32.282 8.079 1.00 0.00 H TER 58521 WAT 2210 ATOM 58521 O WAT 2211 55.400 78.336 106.684 1.00 0.00 O ATOM 58522 H1 WAT 2211 54.578 78.293 107.173 1.00 0.00 H ATOM 58523 H2 WAT 2211 55.544 77.441 106.379 1.00 0.00 H TER 58525 WAT 2211 ATOM 58525 O WAT 2212 29.613 114.148 89.134 1.00 0.00 O ATOM 58526 H1 WAT 2212 28.804 113.981 88.651 1.00 0.00 H ATOM 58527 H2 WAT 2212 30.307 113.837 88.552 1.00 0.00 H TER 58529 WAT 2212 ATOM 58529 O WAT 2213 93.505 129.867 67.423 1.00 0.00 O ATOM 58530 H1 WAT 2213 93.119 129.864 68.299 1.00 0.00 H ATOM 58531 H2 WAT 2213 94.159 130.565 67.452 1.00 0.00 H TER 58533 WAT 2213 ATOM 58533 O WAT 2214 52.048 99.723 92.839 1.00 0.00 O ATOM 58534 H1 WAT 2214 51.623 99.401 92.045 1.00 0.00 H ATOM 58535 H2 WAT 2214 52.975 99.783 92.608 1.00 0.00 H TER 58537 WAT 2214 ATOM 58537 O WAT 2215 108.859 68.351 133.722 1.00 0.00 O ATOM 58538 H1 WAT 2215 108.826 69.181 134.198 1.00 0.00 H ATOM 58539 H2 WAT 2215 108.627 67.691 134.375 1.00 0.00 H TER 58541 WAT 2215 ATOM 58541 O WAT 2216 37.862 76.857 18.796 1.00 0.00 O ATOM 58542 H1 WAT 2216 37.728 77.469 18.072 1.00 0.00 H ATOM 58543 H2 WAT 2216 37.116 76.260 18.746 1.00 0.00 H TER 58545 WAT 2216 ATOM 58545 O WAT 2217 99.237 45.127 105.754 1.00 0.00 O ATOM 58546 H1 WAT 2217 98.407 44.932 105.319 1.00 0.00 H ATOM 58547 H2 WAT 2217 99.062 45.919 106.262 1.00 0.00 H TER 58549 WAT 2217 ATOM 58549 O WAT 2218 0.618 93.639 117.631 1.00 0.00 O ATOM 58550 H1 WAT 2218 0.652 93.953 116.728 1.00 0.00 H ATOM 58551 H2 WAT 2218 1.438 93.158 117.749 1.00 0.00 H TER 58553 WAT 2218 ATOM 58553 O WAT 2219 129.887 126.514 67.491 1.00 0.00 O ATOM 58554 H1 WAT 2219 129.574 127.414 67.579 1.00 0.00 H ATOM 58555 H2 WAT 2219 129.151 125.976 67.782 1.00 0.00 H TER 58557 WAT 2219 ATOM 58557 O WAT 2220 71.213 55.144 100.030 1.00 0.00 O ATOM 58558 H1 WAT 2220 70.347 55.004 99.647 1.00 0.00 H ATOM 58559 H2 WAT 2220 71.122 54.857 100.939 1.00 0.00 H TER 58561 WAT 2220 ATOM 58561 O WAT 2221 61.751 5.413 100.300 1.00 0.00 O ATOM 58562 H1 WAT 2221 62.464 5.795 99.789 1.00 0.00 H ATOM 58563 H2 WAT 2221 61.342 6.161 100.735 1.00 0.00 H TER 58565 WAT 2221 ATOM 58565 O WAT 2222 44.666 109.252 142.871 1.00 0.00 O ATOM 58566 H1 WAT 2222 44.321 109.491 142.011 1.00 0.00 H ATOM 58567 H2 WAT 2222 44.097 108.541 143.168 1.00 0.00 H TER 58569 WAT 2222 ATOM 58569 O WAT 2223 139.743 95.993 102.626 1.00 0.00 O ATOM 58570 H1 WAT 2223 139.961 96.388 103.470 1.00 0.00 H ATOM 58571 H2 WAT 2223 139.224 96.659 102.176 1.00 0.00 H TER 58573 WAT 2223 ATOM 58573 O WAT 2224 33.350 110.053 122.413 1.00 0.00 O ATOM 58574 H1 WAT 2224 32.451 109.763 122.255 1.00 0.00 H ATOM 58575 H2 WAT 2224 33.448 110.835 121.871 1.00 0.00 H TER 58577 WAT 2224 ATOM 58577 O WAT 2225 37.123 114.767 153.601 1.00 0.00 O ATOM 58578 H1 WAT 2225 36.956 114.782 152.659 1.00 0.00 H ATOM 58579 H2 WAT 2225 37.704 114.017 153.729 1.00 0.00 H TER 58581 WAT 2225 ATOM 58581 O WAT 2226 53.756 26.020 151.870 1.00 0.00 O ATOM 58582 H1 WAT 2226 54.037 26.184 150.970 1.00 0.00 H ATOM 58583 H2 WAT 2226 54.568 26.004 152.376 1.00 0.00 H TER 58585 WAT 2226 ATOM 58585 O WAT 2227 113.803 66.577 22.077 1.00 0.00 O ATOM 58586 H1 WAT 2227 114.503 66.745 21.445 1.00 0.00 H ATOM 58587 H2 WAT 2227 113.900 65.652 22.301 1.00 0.00 H TER 58589 WAT 2227 ATOM 58589 O WAT 2228 52.798 42.967 133.386 1.00 0.00 O ATOM 58590 H1 WAT 2228 53.147 42.322 132.771 1.00 0.00 H ATOM 58591 H2 WAT 2228 52.027 42.544 133.764 1.00 0.00 H TER 58593 WAT 2228 ATOM 58593 O WAT 2229 70.113 23.856 116.915 1.00 0.00 O ATOM 58594 H1 WAT 2229 69.894 24.786 116.966 1.00 0.00 H ATOM 58595 H2 WAT 2229 70.102 23.658 115.978 1.00 0.00 H TER 58597 WAT 2229 ATOM 58597 O WAT 2230 26.186 73.845 86.833 1.00 0.00 O ATOM 58598 H1 WAT 2230 25.452 73.874 86.220 1.00 0.00 H ATOM 58599 H2 WAT 2230 26.596 72.994 86.676 1.00 0.00 H TER 58601 WAT 2230 ATOM 58601 O WAT 2231 145.312 46.712 6.507 1.00 0.00 O ATOM 58602 H1 WAT 2231 145.942 47.251 6.986 1.00 0.00 H ATOM 58603 H2 WAT 2231 145.729 45.852 6.447 1.00 0.00 H TER 58605 WAT 2231 ATOM 58605 O WAT 2232 17.098 54.645 14.774 1.00 0.00 O ATOM 58606 H1 WAT 2232 17.129 55.050 15.641 1.00 0.00 H ATOM 58607 H2 WAT 2232 17.575 53.822 14.877 1.00 0.00 H TER 58609 WAT 2232 ATOM 58609 O WAT 2233 37.491 89.240 57.609 1.00 0.00 O ATOM 58610 H1 WAT 2233 38.379 89.066 57.297 1.00 0.00 H ATOM 58611 H2 WAT 2233 36.980 88.490 57.307 1.00 0.00 H TER 58613 WAT 2233 ATOM 58613 O WAT 2234 121.712 15.771 115.396 1.00 0.00 O ATOM 58614 H1 WAT 2234 121.377 15.468 116.240 1.00 0.00 H ATOM 58615 H2 WAT 2234 122.412 15.155 115.180 1.00 0.00 H TER 58617 WAT 2234 ATOM 58617 O WAT 2235 130.058 136.371 146.222 1.00 0.00 O ATOM 58618 H1 WAT 2235 130.990 136.418 146.432 1.00 0.00 H ATOM 58619 H2 WAT 2235 129.780 135.517 146.555 1.00 0.00 H TER 58621 WAT 2235 ATOM 58621 O WAT 2236 78.737 4.579 116.695 1.00 0.00 O ATOM 58622 H1 WAT 2236 78.150 4.618 115.939 1.00 0.00 H ATOM 58623 H2 WAT 2236 78.258 4.063 117.343 1.00 0.00 H TER 58625 WAT 2236 ATOM 58625 O WAT 2237 31.926 61.121 51.366 1.00 0.00 O ATOM 58626 H1 WAT 2237 32.296 61.494 52.166 1.00 0.00 H ATOM 58627 H2 WAT 2237 32.389 60.290 51.253 1.00 0.00 H TER 58629 WAT 2237 ATOM 58629 O WAT 2238 31.990 34.762 72.018 1.00 0.00 O ATOM 58630 H1 WAT 2238 32.805 34.730 72.520 1.00 0.00 H ATOM 58631 H2 WAT 2238 31.701 35.671 72.090 1.00 0.00 H TER 58633 WAT 2238 ATOM 58633 O WAT 2239 95.454 36.381 64.887 1.00 0.00 O ATOM 58634 H1 WAT 2239 95.407 36.910 65.684 1.00 0.00 H ATOM 58635 H2 WAT 2239 95.757 36.990 64.213 1.00 0.00 H TER 58637 WAT 2239 ATOM 58637 O WAT 2240 53.123 79.645 79.431 1.00 0.00 O ATOM 58638 H1 WAT 2240 52.766 78.985 78.838 1.00 0.00 H ATOM 58639 H2 WAT 2240 53.594 79.141 80.095 1.00 0.00 H TER 58641 WAT 2240 ATOM 58641 O WAT 2241 109.864 4.537 84.686 1.00 0.00 O ATOM 58642 H1 WAT 2241 108.923 4.698 84.753 1.00 0.00 H ATOM 58643 H2 WAT 2241 109.951 3.588 84.767 1.00 0.00 H TER 58645 WAT 2241 ATOM 58645 O WAT 2242 88.424 100.832 102.167 1.00 0.00 O ATOM 58646 H1 WAT 2242 89.012 100.634 102.896 1.00 0.00 H ATOM 58647 H2 WAT 2242 88.743 100.289 101.447 1.00 0.00 H TER 58649 WAT 2242 ATOM 58649 O WAT 2243 16.748 88.160 151.235 1.00 0.00 O ATOM 58650 H1 WAT 2243 17.534 88.705 151.193 1.00 0.00 H ATOM 58651 H2 WAT 2243 16.676 87.915 152.157 1.00 0.00 H TER 58653 WAT 2243 ATOM 58653 O WAT 2244 65.957 72.916 1.497 1.00 0.00 O ATOM 58654 H1 WAT 2244 65.508 73.331 2.233 1.00 0.00 H ATOM 58655 H2 WAT 2244 66.395 73.637 1.045 1.00 0.00 H TER 58657 WAT 2244 ATOM 58657 O WAT 2245 100.416 6.249 4.056 1.00 0.00 O ATOM 58658 H1 WAT 2245 99.867 5.486 3.871 1.00 0.00 H ATOM 58659 H2 WAT 2245 100.546 6.663 3.203 1.00 0.00 H TER 58661 WAT 2245 ATOM 58661 O WAT 2246 10.911 20.549 158.802 1.00 0.00 O ATOM 58662 H1 WAT 2246 11.472 20.237 158.092 1.00 0.00 H ATOM 58663 H2 WAT 2246 10.100 20.815 158.367 1.00 0.00 H TER 58665 WAT 2246 ATOM 58665 O WAT 2247 87.472 109.484 62.941 1.00 0.00 O ATOM 58666 H1 WAT 2247 86.683 109.020 63.222 1.00 0.00 H ATOM 58667 H2 WAT 2247 87.190 110.393 62.838 1.00 0.00 H TER 58669 WAT 2247 ATOM 58669 O WAT 2248 87.419 111.462 113.706 1.00 0.00 O ATOM 58670 H1 WAT 2248 87.186 112.384 113.600 1.00 0.00 H ATOM 58671 H2 WAT 2248 87.097 111.232 114.577 1.00 0.00 H TER 58673 WAT 2248 ATOM 58673 O WAT 2249 94.238 63.025 23.123 1.00 0.00 O ATOM 58674 H1 WAT 2249 94.796 62.921 22.352 1.00 0.00 H ATOM 58675 H2 WAT 2249 94.848 63.032 23.861 1.00 0.00 H TER 58677 WAT 2249 ATOM 58677 O WAT 2250 21.419 19.872 139.502 1.00 0.00 O ATOM 58678 H1 WAT 2250 22.194 19.373 139.242 1.00 0.00 H ATOM 58679 H2 WAT 2250 20.911 19.263 140.038 1.00 0.00 H TER 58681 WAT 2250 ATOM 58681 O WAT 2251 88.338 73.959 54.637 1.00 0.00 O ATOM 58682 H1 WAT 2251 87.538 74.005 54.113 1.00 0.00 H ATOM 58683 H2 WAT 2251 88.266 74.692 55.248 1.00 0.00 H TER 58685 WAT 2251 ATOM 58685 O WAT 2252 44.572 7.308 131.442 1.00 0.00 O ATOM 58686 H1 WAT 2252 44.371 6.394 131.244 1.00 0.00 H ATOM 58687 H2 WAT 2252 44.927 7.658 130.625 1.00 0.00 H TER 58689 WAT 2252 ATOM 58689 O WAT 2253 6.941 35.497 145.790 1.00 0.00 O ATOM 58690 H1 WAT 2253 7.724 35.092 146.162 1.00 0.00 H ATOM 58691 H2 WAT 2253 6.220 35.156 146.319 1.00 0.00 H TER 58693 WAT 2253 ATOM 58693 O WAT 2254 67.495 58.563 98.817 1.00 0.00 O ATOM 58694 H1 WAT 2254 67.659 57.911 99.499 1.00 0.00 H ATOM 58695 H2 WAT 2254 68.238 59.164 98.878 1.00 0.00 H TER 58697 WAT 2254 ATOM 58697 O WAT 2255 66.131 128.790 127.633 1.00 0.00 O ATOM 58698 H1 WAT 2255 65.844 129.703 127.666 1.00 0.00 H ATOM 58699 H2 WAT 2255 66.935 128.772 128.153 1.00 0.00 H TER 58701 WAT 2255 ATOM 58701 O WAT 2256 14.608 60.668 154.182 1.00 0.00 O ATOM 58702 H1 WAT 2256 14.783 61.587 154.385 1.00 0.00 H ATOM 58703 H2 WAT 2256 13.745 60.499 154.561 1.00 0.00 H TER 58705 WAT 2256 ATOM 58705 O WAT 2257 9.639 92.223 143.972 1.00 0.00 O ATOM 58706 H1 WAT 2257 8.955 91.652 143.621 1.00 0.00 H ATOM 58707 H2 WAT 2257 9.165 92.875 144.488 1.00 0.00 H TER 58709 WAT 2257 ATOM 58709 O WAT 2258 20.609 84.409 152.109 1.00 0.00 O ATOM 58710 H1 WAT 2258 21.181 84.915 151.532 1.00 0.00 H ATOM 58711 H2 WAT 2258 20.573 83.540 151.708 1.00 0.00 H TER 58713 WAT 2258 ATOM 58713 O WAT 2259 127.252 131.332 113.824 1.00 0.00 O ATOM 58714 H1 WAT 2259 127.791 132.085 113.581 1.00 0.00 H ATOM 58715 H2 WAT 2259 127.882 130.636 114.009 1.00 0.00 H TER 58717 WAT 2259 ATOM 58717 O WAT 2260 48.434 15.736 76.092 1.00 0.00 O ATOM 58718 H1 WAT 2260 47.987 16.555 76.303 1.00 0.00 H ATOM 58719 H2 WAT 2260 49.041 15.600 76.820 1.00 0.00 H TER 58721 WAT 2260 ATOM 58721 O WAT 2261 115.479 116.739 21.781 1.00 0.00 O ATOM 58722 H1 WAT 2261 115.571 117.584 21.342 1.00 0.00 H ATOM 58723 H2 WAT 2261 114.541 116.553 21.750 1.00 0.00 H TER 58725 WAT 2261 ATOM 58725 O WAT 2262 14.016 37.168 86.259 1.00 0.00 O ATOM 58726 H1 WAT 2262 13.188 37.052 85.794 1.00 0.00 H ATOM 58727 H2 WAT 2262 14.257 36.286 86.543 1.00 0.00 H TER 58729 WAT 2262 ATOM 58729 O WAT 2263 87.417 118.213 3.712 1.00 0.00 O ATOM 58730 H1 WAT 2263 86.827 118.679 4.305 1.00 0.00 H ATOM 58731 H2 WAT 2263 86.870 117.986 2.959 1.00 0.00 H TER 58733 WAT 2263 ATOM 58733 O WAT 2264 104.269 30.018 55.556 1.00 0.00 O ATOM 58734 H1 WAT 2264 104.764 30.767 55.888 1.00 0.00 H ATOM 58735 H2 WAT 2264 104.679 29.813 54.716 1.00 0.00 H TER 58737 WAT 2264 ATOM 58737 O WAT 2265 0.456 90.661 158.075 1.00 0.00 O ATOM 58738 H1 WAT 2265 -0.114 89.898 158.168 1.00 0.00 H ATOM 58739 H2 WAT 2265 0.674 90.685 157.143 1.00 0.00 H TER 58741 WAT 2265 ATOM 58741 O WAT 2266 117.479 144.747 106.712 1.00 0.00 O ATOM 58742 H1 WAT 2266 117.486 145.447 107.365 1.00 0.00 H ATOM 58743 H2 WAT 2266 117.496 143.939 107.226 1.00 0.00 H TER 58745 WAT 2266 ATOM 58745 O WAT 2267 88.226 44.519 77.217 1.00 0.00 O ATOM 58746 H1 WAT 2267 89.159 44.308 77.239 1.00 0.00 H ATOM 58747 H2 WAT 2267 87.992 44.669 78.132 1.00 0.00 H TER 58749 WAT 2267 ATOM 58749 O WAT 2268 66.916 44.682 133.094 1.00 0.00 O ATOM 58750 H1 WAT 2268 66.536 44.066 132.467 1.00 0.00 H ATOM 58751 H2 WAT 2268 66.895 45.526 132.644 1.00 0.00 H TER 58753 WAT 2268 ATOM 58753 O WAT 2269 79.935 71.180 13.671 1.00 0.00 O ATOM 58754 H1 WAT 2269 79.751 72.092 13.894 1.00 0.00 H ATOM 58755 H2 WAT 2269 79.101 70.729 13.801 1.00 0.00 H TER 58757 WAT 2269 ATOM 58757 O WAT 2270 92.807 47.258 83.933 1.00 0.00 O ATOM 58758 H1 WAT 2270 92.606 47.795 84.699 1.00 0.00 H ATOM 58759 H2 WAT 2270 93.747 47.378 83.796 1.00 0.00 H TER 58761 WAT 2270 ATOM 58761 O WAT 2271 127.133 70.755 114.276 1.00 0.00 O ATOM 58762 H1 WAT 2271 126.981 70.611 113.342 1.00 0.00 H ATOM 58763 H2 WAT 2271 126.692 71.584 114.465 1.00 0.00 H TER 58765 WAT 2271 ATOM 58765 O WAT 2272 96.510 132.741 101.627 1.00 0.00 O ATOM 58766 H1 WAT 2272 96.546 132.027 102.264 1.00 0.00 H ATOM 58767 H2 WAT 2272 96.780 132.339 100.801 1.00 0.00 H TER 58769 WAT 2272 ATOM 58769 O WAT 2273 118.154 108.586 137.222 1.00 0.00 O ATOM 58770 H1 WAT 2273 118.533 107.721 137.064 1.00 0.00 H ATOM 58771 H2 WAT 2273 118.814 109.045 137.742 1.00 0.00 H TER 58773 WAT 2273 ATOM 58773 O WAT 2274 76.755 86.546 65.333 1.00 0.00 O ATOM 58774 H1 WAT 2274 76.687 86.193 64.446 1.00 0.00 H ATOM 58775 H2 WAT 2274 76.426 87.442 65.261 1.00 0.00 H TER 58777 WAT 2274 ATOM 58777 O WAT 2275 62.933 78.716 22.165 1.00 0.00 O ATOM 58778 H1 WAT 2275 62.684 77.911 22.620 1.00 0.00 H ATOM 58779 H2 WAT 2275 63.485 78.421 21.441 1.00 0.00 H TER 58781 WAT 2275 ATOM 58781 O WAT 2276 68.680 119.874 93.412 1.00 0.00 O ATOM 58782 H1 WAT 2276 69.554 119.798 93.793 1.00 0.00 H ATOM 58783 H2 WAT 2276 68.681 120.727 92.978 1.00 0.00 H TER 58785 WAT 2276 ATOM 58785 O WAT 2277 76.807 18.242 139.849 1.00 0.00 O ATOM 58786 H1 WAT 2277 75.987 18.674 140.089 1.00 0.00 H ATOM 58787 H2 WAT 2277 77.379 18.955 139.565 1.00 0.00 H TER 58789 WAT 2277 ATOM 58789 O WAT 2278 134.771 71.499 131.565 1.00 0.00 O ATOM 58790 H1 WAT 2278 135.056 71.347 132.466 1.00 0.00 H ATOM 58791 H2 WAT 2278 134.974 72.420 131.402 1.00 0.00 H TER 58793 WAT 2278 ATOM 58793 O WAT 2279 118.773 46.598 94.280 1.00 0.00 O ATOM 58794 H1 WAT 2279 119.371 47.189 94.738 1.00 0.00 H ATOM 58795 H2 WAT 2279 118.392 46.058 94.973 1.00 0.00 H TER 58797 WAT 2279 ATOM 58797 O WAT 2280 3.049 134.126 117.614 1.00 0.00 O ATOM 58798 H1 WAT 2280 2.168 133.768 117.723 1.00 0.00 H ATOM 58799 H2 WAT 2280 3.028 134.558 116.760 1.00 0.00 H TER 58801 WAT 2280 ATOM 58801 O WAT 2281 45.292 38.907 86.097 1.00 0.00 O ATOM 58802 H1 WAT 2281 45.047 38.884 85.172 1.00 0.00 H ATOM 58803 H2 WAT 2281 45.623 38.027 86.279 1.00 0.00 H TER 58805 WAT 2281 ATOM 58805 O WAT 2282 89.905 93.170 17.722 1.00 0.00 O ATOM 58806 H1 WAT 2282 90.070 93.972 18.217 1.00 0.00 H ATOM 58807 H2 WAT 2282 90.260 92.472 18.273 1.00 0.00 H TER 58809 WAT 2282 ATOM 58809 O WAT 2283 145.622 34.952 81.584 1.00 0.00 O ATOM 58810 H1 WAT 2283 144.827 35.114 82.092 1.00 0.00 H ATOM 58811 H2 WAT 2283 145.950 35.826 81.369 1.00 0.00 H TER 58813 WAT 2283 ATOM 58813 O WAT 2284 97.491 99.397 143.668 1.00 0.00 O ATOM 58814 H1 WAT 2284 97.505 98.458 143.852 1.00 0.00 H ATOM 58815 H2 WAT 2284 97.983 99.790 144.389 1.00 0.00 H TER 58817 WAT 2284 ATOM 58817 O WAT 2285 100.442 3.503 141.628 1.00 0.00 O ATOM 58818 H1 WAT 2285 101.285 3.923 141.461 1.00 0.00 H ATOM 58819 H2 WAT 2285 100.519 2.640 141.223 1.00 0.00 H TER 58821 WAT 2285 ATOM 58821 O WAT 2286 0.553 108.039 117.577 1.00 0.00 O ATOM 58822 H1 WAT 2286 0.949 107.256 117.196 1.00 0.00 H ATOM 58823 H2 WAT 2286 0.149 107.732 118.389 1.00 0.00 H TER 58825 WAT 2286 ATOM 58825 O WAT 2287 58.033 0.949 117.288 1.00 0.00 O ATOM 58826 H1 WAT 2287 57.990 1.539 116.536 1.00 0.00 H ATOM 58827 H2 WAT 2287 58.904 0.556 117.236 1.00 0.00 H TER 58829 WAT 2287 ATOM 58829 O WAT 2288 115.162 4.560 102.413 1.00 0.00 O ATOM 58830 H1 WAT 2288 115.817 4.589 101.715 1.00 0.00 H ATOM 58831 H2 WAT 2288 115.252 3.685 102.789 1.00 0.00 H TER 58833 WAT 2288 ATOM 58833 O WAT 2289 95.129 123.271 139.690 1.00 0.00 O ATOM 58834 H1 WAT 2289 94.847 122.709 138.968 1.00 0.00 H ATOM 58835 H2 WAT 2289 94.318 123.647 140.031 1.00 0.00 H TER 58837 WAT 2289 ATOM 58837 O WAT 2290 137.177 23.835 60.065 1.00 0.00 O ATOM 58838 H1 WAT 2290 136.748 24.687 59.985 1.00 0.00 H ATOM 58839 H2 WAT 2290 137.943 23.899 59.495 1.00 0.00 H TER 58841 WAT 2290 ATOM 58841 O WAT 2291 31.769 41.734 70.327 1.00 0.00 O ATOM 58842 H1 WAT 2291 32.158 40.907 70.613 1.00 0.00 H ATOM 58843 H2 WAT 2291 32.346 42.040 69.627 1.00 0.00 H TER 58845 WAT 2291 ATOM 58845 O WAT 2292 10.704 121.235 107.839 1.00 0.00 O ATOM 58846 H1 WAT 2292 11.466 121.540 108.332 1.00 0.00 H ATOM 58847 H2 WAT 2292 10.732 120.282 107.921 1.00 0.00 H TER 58849 WAT 2292 ATOM 58849 O WAT 2293 41.632 11.351 78.871 1.00 0.00 O ATOM 58850 H1 WAT 2293 41.123 12.161 78.916 1.00 0.00 H ATOM 58851 H2 WAT 2293 41.236 10.859 78.152 1.00 0.00 H TER 58853 WAT 2293 ATOM 58853 O WAT 2294 107.669 54.744 152.264 1.00 0.00 O ATOM 58854 H1 WAT 2294 107.164 54.791 153.076 1.00 0.00 H ATOM 58855 H2 WAT 2294 107.019 54.866 151.571 1.00 0.00 H TER 58857 WAT 2294 ATOM 58857 O WAT 2295 74.056 11.945 104.515 1.00 0.00 O ATOM 58858 H1 WAT 2295 73.334 12.395 104.077 1.00 0.00 H ATOM 58859 H2 WAT 2295 74.799 12.050 103.920 1.00 0.00 H TER 58861 WAT 2295 ATOM 58861 O WAT 2296 73.065 103.476 122.289 1.00 0.00 O ATOM 58862 H1 WAT 2296 73.845 104.031 122.297 1.00 0.00 H ATOM 58863 H2 WAT 2296 73.296 102.729 122.841 1.00 0.00 H TER 58865 WAT 2296 ATOM 58865 O WAT 2297 4.010 140.571 69.444 1.00 0.00 O ATOM 58866 H1 WAT 2297 3.515 139.755 69.517 1.00 0.00 H ATOM 58867 H2 WAT 2297 4.878 140.355 69.784 1.00 0.00 H TER 58869 WAT 2297 ATOM 58869 O WAT 2298 54.059 105.416 62.032 1.00 0.00 O ATOM 58870 H1 WAT 2298 53.878 104.713 61.408 1.00 0.00 H ATOM 58871 H2 WAT 2298 53.424 105.283 62.735 1.00 0.00 H TER 58873 WAT 2298 ATOM 58873 O WAT 2299 86.855 137.065 102.213 1.00 0.00 O ATOM 58874 H1 WAT 2299 86.600 137.912 101.848 1.00 0.00 H ATOM 58875 H2 WAT 2299 87.567 136.765 101.648 1.00 0.00 H TER 58877 WAT 2299 ATOM 58877 O WAT 2300 16.072 23.766 4.540 1.00 0.00 O ATOM 58878 H1 WAT 2300 15.938 22.824 4.646 1.00 0.00 H ATOM 58879 H2 WAT 2300 16.185 23.887 3.597 1.00 0.00 H TER 58881 WAT 2300 ATOM 58881 O WAT 2301 121.407 68.133 77.000 1.00 0.00 O ATOM 58882 H1 WAT 2301 121.986 67.763 77.667 1.00 0.00 H ATOM 58883 H2 WAT 2301 120.609 67.608 77.059 1.00 0.00 H TER 58885 WAT 2301 ATOM 58885 O WAT 2302 87.806 10.973 119.765 1.00 0.00 O ATOM 58886 H1 WAT 2302 88.226 10.845 120.615 1.00 0.00 H ATOM 58887 H2 WAT 2302 87.240 10.208 119.660 1.00 0.00 H TER 58889 WAT 2302 ATOM 58889 O WAT 2303 8.080 127.247 141.938 1.00 0.00 O ATOM 58890 H1 WAT 2303 7.192 127.514 141.702 1.00 0.00 H ATOM 58891 H2 WAT 2303 7.989 126.339 142.225 1.00 0.00 H TER 58893 WAT 2303 ATOM 58893 O WAT 2304 120.395 28.559 135.626 1.00 0.00 O ATOM 58894 H1 WAT 2304 119.458 28.570 135.823 1.00 0.00 H ATOM 58895 H2 WAT 2304 120.789 29.104 136.307 1.00 0.00 H TER 58897 WAT 2304 ATOM 58897 O WAT 2305 128.287 123.641 113.341 1.00 0.00 O ATOM 58898 H1 WAT 2305 128.061 123.456 114.253 1.00 0.00 H ATOM 58899 H2 WAT 2305 128.603 124.544 113.350 1.00 0.00 H TER 58901 WAT 2305 ATOM 58901 O WAT 2306 30.802 113.872 121.543 1.00 0.00 O ATOM 58902 H1 WAT 2306 30.779 113.632 122.469 1.00 0.00 H ATOM 58903 H2 WAT 2306 31.695 113.671 121.266 1.00 0.00 H TER 58905 WAT 2306 ATOM 58905 O WAT 2307 78.633 25.721 67.071 1.00 0.00 O ATOM 58906 H1 WAT 2307 78.514 25.184 66.287 1.00 0.00 H ATOM 58907 H2 WAT 2307 79.246 25.224 67.612 1.00 0.00 H TER 58909 WAT 2307 ATOM 58909 O WAT 2308 117.895 41.758 131.061 1.00 0.00 O ATOM 58910 H1 WAT 2308 117.039 42.115 130.828 1.00 0.00 H ATOM 58911 H2 WAT 2308 117.775 40.809 131.034 1.00 0.00 H TER 58913 WAT 2308 ATOM 58913 O WAT 2309 59.576 123.076 133.071 1.00 0.00 O ATOM 58914 H1 WAT 2309 59.454 123.307 133.992 1.00 0.00 H ATOM 58915 H2 WAT 2309 60.212 123.713 132.746 1.00 0.00 H TER 58917 WAT 2309 ATOM 58917 O WAT 2310 60.882 104.325 10.343 1.00 0.00 O ATOM 58918 H1 WAT 2310 61.746 104.023 10.064 1.00 0.00 H ATOM 58919 H2 WAT 2310 60.983 105.271 10.455 1.00 0.00 H TER 58921 WAT 2310 ATOM 58921 O WAT 2311 8.467 130.383 24.015 1.00 0.00 O ATOM 58922 H1 WAT 2311 7.994 129.966 24.736 1.00 0.00 H ATOM 58923 H2 WAT 2311 8.606 129.679 23.381 1.00 0.00 H TER 58925 WAT 2311 ATOM 58925 O WAT 2312 6.523 3.925 58.490 1.00 0.00 O ATOM 58926 H1 WAT 2312 6.318 4.804 58.809 1.00 0.00 H ATOM 58927 H2 WAT 2312 7.351 4.027 58.021 1.00 0.00 H TER 58929 WAT 2312 ATOM 58929 O WAT 2313 69.190 132.388 105.250 1.00 0.00 O ATOM 58930 H1 WAT 2313 68.392 132.903 105.133 1.00 0.00 H ATOM 58931 H2 WAT 2313 69.649 132.464 104.413 1.00 0.00 H TER 58933 WAT 2313 ATOM 58933 O WAT 2314 144.532 33.720 75.362 1.00 0.00 O ATOM 58934 H1 WAT 2314 144.499 34.337 76.094 1.00 0.00 H ATOM 58935 H2 WAT 2314 145.039 32.980 75.696 1.00 0.00 H TER 58937 WAT 2314 ATOM 58937 O WAT 2315 108.339 38.711 136.725 1.00 0.00 O ATOM 58938 H1 WAT 2315 108.347 38.369 137.619 1.00 0.00 H ATOM 58939 H2 WAT 2315 107.839 38.065 136.226 1.00 0.00 H TER 58941 WAT 2315 ATOM 58941 O WAT 2316 41.878 18.587 114.427 1.00 0.00 O ATOM 58942 H1 WAT 2316 41.498 17.828 113.986 1.00 0.00 H ATOM 58943 H2 WAT 2316 41.182 18.904 115.002 1.00 0.00 H TER 58945 WAT 2316 ATOM 58945 O WAT 2317 98.470 73.134 99.362 1.00 0.00 O ATOM 58946 H1 WAT 2317 99.265 73.282 99.873 1.00 0.00 H ATOM 58947 H2 WAT 2317 97.756 73.359 99.959 1.00 0.00 H TER 58949 WAT 2317 ATOM 58949 O WAT 2318 5.180 40.551 11.526 1.00 0.00 O ATOM 58950 H1 WAT 2318 5.901 40.633 12.151 1.00 0.00 H ATOM 58951 H2 WAT 2318 5.604 40.573 10.668 1.00 0.00 H TER 58953 WAT 2318 ATOM 58953 O WAT 2319 84.371 63.932 157.780 1.00 0.00 O ATOM 58954 H1 WAT 2319 84.310 63.025 158.081 1.00 0.00 H ATOM 58955 H2 WAT 2319 83.998 64.447 158.495 1.00 0.00 H TER 58957 WAT 2319 ATOM 58957 O WAT 2320 135.294 70.057 113.943 1.00 0.00 O ATOM 58958 H1 WAT 2320 135.580 70.039 114.856 1.00 0.00 H ATOM 58959 H2 WAT 2320 135.018 70.962 113.796 1.00 0.00 H TER 58961 WAT 2320 ATOM 58961 O WAT 2321 39.417 31.236 154.419 1.00 0.00 O ATOM 58962 H1 WAT 2321 40.206 31.226 154.961 1.00 0.00 H ATOM 58963 H2 WAT 2321 38.696 31.271 155.047 1.00 0.00 H TER 58965 WAT 2321 ATOM 58965 O WAT 2322 89.325 105.224 112.315 1.00 0.00 O ATOM 58966 H1 WAT 2322 89.912 104.592 112.733 1.00 0.00 H ATOM 58967 H2 WAT 2322 88.814 105.590 113.037 1.00 0.00 H TER 58969 WAT 2322 ATOM 58969 O WAT 2323 22.728 39.201 8.359 1.00 0.00 O ATOM 58970 H1 WAT 2323 23.303 38.446 8.488 1.00 0.00 H ATOM 58971 H2 WAT 2323 22.658 39.600 9.226 1.00 0.00 H TER 58973 WAT 2323 ATOM 58973 O WAT 2324 66.000 92.019 156.362 1.00 0.00 O ATOM 58974 H1 WAT 2324 65.204 91.503 156.489 1.00 0.00 H ATOM 58975 H2 WAT 2324 66.698 91.477 156.729 1.00 0.00 H TER 58977 WAT 2324 ATOM 58977 O WAT 2325 87.746 107.671 56.302 1.00 0.00 O ATOM 58978 H1 WAT 2325 87.141 108.306 56.688 1.00 0.00 H ATOM 58979 H2 WAT 2325 87.350 107.446 55.460 1.00 0.00 H TER 58981 WAT 2325 ATOM 58981 O WAT 2326 62.897 130.294 17.007 1.00 0.00 O ATOM 58982 H1 WAT 2326 63.173 131.207 16.923 1.00 0.00 H ATOM 58983 H2 WAT 2326 63.685 129.787 16.810 1.00 0.00 H TER 58985 WAT 2326 ATOM 58985 O WAT 2327 44.010 112.593 97.636 1.00 0.00 O ATOM 58986 H1 WAT 2327 44.344 112.452 98.522 1.00 0.00 H ATOM 58987 H2 WAT 2327 43.131 112.951 97.765 1.00 0.00 H TER 58989 WAT 2327 ATOM 58989 O WAT 2328 47.824 120.967 81.611 1.00 0.00 O ATOM 58990 H1 WAT 2328 47.429 120.133 81.357 1.00 0.00 H ATOM 58991 H2 WAT 2328 47.972 121.424 80.784 1.00 0.00 H TER 58993 WAT 2328 ATOM 58993 O WAT 2329 76.156 24.263 64.503 1.00 0.00 O ATOM 58994 H1 WAT 2329 77.110 24.190 64.495 1.00 0.00 H ATOM 58995 H2 WAT 2329 75.914 24.359 63.582 1.00 0.00 H TER 58997 WAT 2329 ATOM 58997 O WAT 2330 34.364 101.592 93.818 1.00 0.00 O ATOM 58998 H1 WAT 2330 35.273 101.885 93.884 1.00 0.00 H ATOM 58999 H2 WAT 2330 34.039 101.999 93.014 1.00 0.00 H TER 59001 WAT 2330 ATOM 59001 O WAT 2331 74.607 17.970 103.251 1.00 0.00 O ATOM 59002 H1 WAT 2331 74.621 18.309 102.356 1.00 0.00 H ATOM 59003 H2 WAT 2331 75.475 17.587 103.376 1.00 0.00 H TER 59005 WAT 2331 ATOM 59005 O WAT 2332 90.892 123.794 129.914 1.00 0.00 O ATOM 59006 H1 WAT 2332 91.468 123.602 130.654 1.00 0.00 H ATOM 59007 H2 WAT 2332 91.488 123.989 129.190 1.00 0.00 H TER 59009 WAT 2332 ATOM 59009 O WAT 2333 48.292 109.027 129.392 1.00 0.00 O ATOM 59010 H1 WAT 2333 48.604 108.863 130.282 1.00 0.00 H ATOM 59011 H2 WAT 2333 49.038 109.430 128.947 1.00 0.00 H TER 59013 WAT 2333 ATOM 59013 O WAT 2334 37.699 121.271 69.133 1.00 0.00 O ATOM 59014 H1 WAT 2334 37.643 122.143 68.742 1.00 0.00 H ATOM 59015 H2 WAT 2334 36.872 121.165 69.603 1.00 0.00 H TER 59017 WAT 2334 ATOM 59017 O WAT 2335 124.653 81.000 89.034 1.00 0.00 O ATOM 59018 H1 WAT 2335 125.291 81.714 89.017 1.00 0.00 H ATOM 59019 H2 WAT 2335 125.180 80.206 88.938 1.00 0.00 H TER 59021 WAT 2335 ATOM 59021 O WAT 2336 142.966 40.155 75.872 1.00 0.00 O ATOM 59022 H1 WAT 2336 143.518 39.373 75.888 1.00 0.00 H ATOM 59023 H2 WAT 2336 142.513 40.146 76.715 1.00 0.00 H TER 59025 WAT 2336 ATOM 59025 O WAT 2337 132.919 8.282 113.130 1.00 0.00 O ATOM 59026 H1 WAT 2337 133.178 9.058 112.634 1.00 0.00 H ATOM 59027 H2 WAT 2337 133.589 8.196 113.808 1.00 0.00 H TER 59029 WAT 2337 ATOM 59029 O WAT 2338 134.723 36.342 62.956 1.00 0.00 O ATOM 59030 H1 WAT 2338 134.363 36.095 63.808 1.00 0.00 H ATOM 59031 H2 WAT 2338 135.024 37.243 63.075 1.00 0.00 H TER 59033 WAT 2338 ATOM 59033 O WAT 2339 75.386 134.934 21.255 1.00 0.00 O ATOM 59034 H1 WAT 2339 75.576 133.998 21.316 1.00 0.00 H ATOM 59035 H2 WAT 2339 74.443 134.978 21.095 1.00 0.00 H TER 59037 WAT 2339 ATOM 59037 O WAT 2340 103.957 101.742 88.279 1.00 0.00 O ATOM 59038 H1 WAT 2340 104.589 101.080 88.561 1.00 0.00 H ATOM 59039 H2 WAT 2340 103.112 101.292 88.305 1.00 0.00 H TER 59041 WAT 2340 ATOM 59041 O WAT 2341 104.964 72.772 17.097 1.00 0.00 O ATOM 59042 H1 WAT 2341 105.412 72.016 16.719 1.00 0.00 H ATOM 59043 H2 WAT 2341 105.436 73.529 16.749 1.00 0.00 H TER 59045 WAT 2341 ATOM 59045 O WAT 2342 53.575 101.440 156.668 1.00 0.00 O ATOM 59046 H1 WAT 2342 52.689 101.771 156.819 1.00 0.00 H ATOM 59047 H2 WAT 2342 53.679 101.460 155.717 1.00 0.00 H TER 59049 WAT 2342 ATOM 59049 O WAT 2343 53.580 117.635 7.343 1.00 0.00 O ATOM 59050 H1 WAT 2343 53.252 117.005 7.985 1.00 0.00 H ATOM 59051 H2 WAT 2343 53.879 117.096 6.610 1.00 0.00 H TER 59053 WAT 2343 ATOM 59053 O WAT 2344 61.180 4.238 139.313 1.00 0.00 O ATOM 59054 H1 WAT 2344 60.365 4.181 138.814 1.00 0.00 H ATOM 59055 H2 WAT 2344 61.508 5.119 139.135 1.00 0.00 H TER 59057 WAT 2344 ATOM 59057 O WAT 2345 44.318 106.261 152.486 1.00 0.00 O ATOM 59058 H1 WAT 2345 43.406 106.036 152.304 1.00 0.00 H ATOM 59059 H2 WAT 2345 44.368 107.204 152.333 1.00 0.00 H TER 59061 WAT 2345 ATOM 59061 O WAT 2346 46.934 130.663 83.877 1.00 0.00 O ATOM 59062 H1 WAT 2346 46.676 130.067 83.173 1.00 0.00 H ATOM 59063 H2 WAT 2346 46.210 130.621 84.503 1.00 0.00 H TER 59065 WAT 2346 ATOM 59065 O WAT 2347 76.697 84.278 144.703 1.00 0.00 O ATOM 59066 H1 WAT 2347 76.024 83.606 144.593 1.00 0.00 H ATOM 59067 H2 WAT 2347 77.055 84.120 145.576 1.00 0.00 H TER 59069 WAT 2347 ATOM 59069 O WAT 2348 2.629 47.665 155.524 1.00 0.00 O ATOM 59070 H1 WAT 2348 3.281 48.230 155.940 1.00 0.00 H ATOM 59071 H2 WAT 2348 1.799 47.921 155.925 1.00 0.00 H TER 59073 WAT 2348 ATOM 59073 O WAT 2349 47.775 28.334 85.235 1.00 0.00 O ATOM 59074 H1 WAT 2349 48.135 27.836 85.970 1.00 0.00 H ATOM 59075 H2 WAT 2349 48.470 28.325 84.577 1.00 0.00 H TER 59077 WAT 2349 ATOM 59077 O WAT 2350 65.040 97.446 107.171 1.00 0.00 O ATOM 59078 H1 WAT 2350 65.535 97.259 106.373 1.00 0.00 H ATOM 59079 H2 WAT 2350 65.059 98.400 107.245 1.00 0.00 H TER 59081 WAT 2350 ATOM 59081 O WAT 2351 15.793 128.878 108.854 1.00 0.00 O ATOM 59082 H1 WAT 2351 14.864 129.000 109.050 1.00 0.00 H ATOM 59083 H2 WAT 2351 16.227 129.616 109.282 1.00 0.00 H TER 59085 WAT 2351 ATOM 59085 O WAT 2352 112.213 39.309 70.042 1.00 0.00 O ATOM 59086 H1 WAT 2352 112.013 39.455 70.967 1.00 0.00 H ATOM 59087 H2 WAT 2352 112.092 40.165 69.632 1.00 0.00 H TER 59089 WAT 2352 ATOM 59089 O WAT 2353 26.698 77.711 131.421 1.00 0.00 O ATOM 59090 H1 WAT 2353 26.691 78.337 130.697 1.00 0.00 H ATOM 59091 H2 WAT 2353 27.177 78.157 132.120 1.00 0.00 H TER 59093 WAT 2353 ATOM 59093 O WAT 2354 16.783 94.103 147.759 1.00 0.00 O ATOM 59094 H1 WAT 2354 17.406 94.225 148.476 1.00 0.00 H ATOM 59095 H2 WAT 2354 17.282 94.314 146.970 1.00 0.00 H TER 59097 WAT 2354 ATOM 59097 O WAT 2355 140.897 83.064 60.017 1.00 0.00 O ATOM 59098 H1 WAT 2355 141.014 83.675 59.289 1.00 0.00 H ATOM 59099 H2 WAT 2355 140.238 82.444 59.707 1.00 0.00 H TER 59101 WAT 2355 ATOM 59101 O WAT 2356 88.401 118.678 154.994 1.00 0.00 O ATOM 59102 H1 WAT 2356 88.301 118.280 155.859 1.00 0.00 H ATOM 59103 H2 WAT 2356 87.855 119.463 155.027 1.00 0.00 H TER 59105 WAT 2356 ATOM 59105 O WAT 2357 98.617 79.047 130.008 1.00 0.00 O ATOM 59106 H1 WAT 2357 97.713 78.786 129.829 1.00 0.00 H ATOM 59107 H2 WAT 2357 98.653 79.147 130.959 1.00 0.00 H TER 59109 WAT 2357 ATOM 59109 O WAT 2358 99.683 20.611 58.801 1.00 0.00 O ATOM 59110 H1 WAT 2358 100.309 19.958 58.490 1.00 0.00 H ATOM 59111 H2 WAT 2358 100.154 21.087 59.486 1.00 0.00 H TER 59113 WAT 2358 ATOM 59113 O WAT 2359 36.891 92.618 13.228 1.00 0.00 O ATOM 59114 H1 WAT 2359 37.378 93.004 12.499 1.00 0.00 H ATOM 59115 H2 WAT 2359 37.466 91.929 13.560 1.00 0.00 H TER 59117 WAT 2359 ATOM 59117 O WAT 2360 11.600 108.720 61.412 1.00 0.00 O ATOM 59118 H1 WAT 2360 11.393 108.253 60.603 1.00 0.00 H ATOM 59119 H2 WAT 2360 12.361 109.256 61.190 1.00 0.00 H TER 59121 WAT 2360 ATOM 59121 O WAT 2361 20.797 82.071 17.607 1.00 0.00 O ATOM 59122 H1 WAT 2361 20.168 81.640 18.186 1.00 0.00 H ATOM 59123 H2 WAT 2361 20.519 82.987 17.592 1.00 0.00 H TER 59125 WAT 2361 ATOM 59125 O WAT 2362 14.638 39.375 156.362 1.00 0.00 O ATOM 59126 H1 WAT 2362 15.539 39.205 156.085 1.00 0.00 H ATOM 59127 H2 WAT 2362 14.643 40.290 156.645 1.00 0.00 H TER 59129 WAT 2362 ATOM 59129 O WAT 2363 133.835 141.002 151.405 1.00 0.00 O ATOM 59130 H1 WAT 2363 133.675 141.804 150.908 1.00 0.00 H ATOM 59131 H2 WAT 2363 134.282 140.422 150.788 1.00 0.00 H TER 59133 WAT 2363 ATOM 59133 O WAT 2364 33.227 42.318 15.909 1.00 0.00 O ATOM 59134 H1 WAT 2364 33.613 43.187 15.799 1.00 0.00 H ATOM 59135 H2 WAT 2364 33.222 42.177 16.856 1.00 0.00 H TER 59137 WAT 2364 ATOM 59137 O WAT 2365 49.081 114.017 79.252 1.00 0.00 O ATOM 59138 H1 WAT 2365 48.682 113.267 78.811 1.00 0.00 H ATOM 59139 H2 WAT 2365 49.532 113.638 80.007 1.00 0.00 H TER 59141 WAT 2365 ATOM 59141 O WAT 2366 30.987 93.406 5.341 1.00 0.00 O ATOM 59142 H1 WAT 2366 31.792 93.894 5.166 1.00 0.00 H ATOM 59143 H2 WAT 2366 31.066 93.135 6.255 1.00 0.00 H TER 59145 WAT 2366 ATOM 59145 O WAT 2367 49.353 100.980 116.587 1.00 0.00 O ATOM 59146 H1 WAT 2367 48.884 100.475 117.251 1.00 0.00 H ATOM 59147 H2 WAT 2367 48.846 101.788 116.499 1.00 0.00 H TER 59149 WAT 2367 ATOM 59149 O WAT 2368 104.997 29.411 112.573 1.00 0.00 O ATOM 59150 H1 WAT 2368 104.826 30.311 112.850 1.00 0.00 H ATOM 59151 H2 WAT 2368 105.793 29.470 112.045 1.00 0.00 H TER 59153 WAT 2368 ATOM 59153 O WAT 2369 48.473 78.446 83.992 1.00 0.00 O ATOM 59154 H1 WAT 2369 47.641 78.205 83.585 1.00 0.00 H ATOM 59155 H2 WAT 2369 48.564 79.382 83.816 1.00 0.00 H TER 59157 WAT 2369 ATOM 59157 O WAT 2370 131.238 82.869 74.844 1.00 0.00 O ATOM 59158 H1 WAT 2370 132.019 82.406 75.148 1.00 0.00 H ATOM 59159 H2 WAT 2370 131.411 83.788 75.044 1.00 0.00 H TER 59161 WAT 2370 ATOM 59161 O WAT 2371 124.229 106.113 9.475 1.00 0.00 O ATOM 59162 H1 WAT 2371 124.550 106.971 9.751 1.00 0.00 H ATOM 59163 H2 WAT 2371 124.020 105.662 10.293 1.00 0.00 H TER 59165 WAT 2371 ATOM 59165 O WAT 2372 132.343 70.021 123.962 1.00 0.00 O ATOM 59166 H1 WAT 2372 132.112 70.563 123.207 1.00 0.00 H ATOM 59167 H2 WAT 2372 131.563 69.491 124.124 1.00 0.00 H TER 59169 WAT 2372 ATOM 59169 O WAT 2373 31.520 132.957 157.835 1.00 0.00 O ATOM 59170 H1 WAT 2373 30.837 132.735 157.202 1.00 0.00 H ATOM 59171 H2 WAT 2373 31.896 133.773 157.507 1.00 0.00 H TER 59173 WAT 2373 ATOM 59173 O WAT 2374 131.191 122.955 20.077 1.00 0.00 O ATOM 59174 H1 WAT 2374 131.363 122.042 20.307 1.00 0.00 H ATOM 59175 H2 WAT 2374 130.341 122.936 19.637 1.00 0.00 H TER 59177 WAT 2374 ATOM 59177 O WAT 2375 145.297 99.507 130.992 1.00 0.00 O ATOM 59178 H1 WAT 2375 144.906 100.347 131.232 1.00 0.00 H ATOM 59179 H2 WAT 2375 146.104 99.742 130.533 1.00 0.00 H TER 59181 WAT 2375 ATOM 59181 O WAT 2376 63.776 41.466 107.674 1.00 0.00 O ATOM 59182 H1 WAT 2376 63.931 40.828 106.978 1.00 0.00 H ATOM 59183 H2 WAT 2376 63.559 40.936 108.441 1.00 0.00 H TER 59185 WAT 2376 ATOM 59185 O WAT 2377 139.736 144.884 117.040 1.00 0.00 O ATOM 59186 H1 WAT 2377 140.582 144.768 116.608 1.00 0.00 H ATOM 59187 H2 WAT 2377 139.954 145.009 117.964 1.00 0.00 H TER 59189 WAT 2377 ATOM 59189 O WAT 2378 41.426 110.294 99.132 1.00 0.00 O ATOM 59190 H1 WAT 2378 41.059 110.102 99.995 1.00 0.00 H ATOM 59191 H2 WAT 2378 42.218 110.801 99.316 1.00 0.00 H TER 59193 WAT 2378 ATOM 59193 O WAT 2379 15.280 136.250 145.286 1.00 0.00 O ATOM 59194 H1 WAT 2379 14.563 136.584 145.825 1.00 0.00 H ATOM 59195 H2 WAT 2379 16.074 136.543 145.735 1.00 0.00 H TER 59197 WAT 2379 ATOM 59197 O WAT 2380 0.924 55.333 95.238 1.00 0.00 O ATOM 59198 H1 WAT 2380 1.361 55.335 96.090 1.00 0.00 H ATOM 59199 H2 WAT 2380 0.139 54.802 95.373 1.00 0.00 H TER 59201 WAT 2380 ATOM 59201 O WAT 2381 60.406 120.236 138.974 1.00 0.00 O ATOM 59202 H1 WAT 2381 60.988 120.124 139.726 1.00 0.00 H ATOM 59203 H2 WAT 2381 59.704 120.801 139.296 1.00 0.00 H TER 59205 WAT 2381 ATOM 59205 O WAT 2382 121.141 39.603 118.901 1.00 0.00 O ATOM 59206 H1 WAT 2382 120.327 39.232 118.562 1.00 0.00 H ATOM 59207 H2 WAT 2382 121.826 39.024 118.567 1.00 0.00 H TER 59209 WAT 2382 ATOM 59209 O WAT 2383 103.088 101.940 153.732 1.00 0.00 O ATOM 59210 H1 WAT 2383 103.840 102.212 154.258 1.00 0.00 H ATOM 59211 H2 WAT 2383 103.468 101.426 153.019 1.00 0.00 H TER 59213 WAT 2383 ATOM 59213 O WAT 2384 92.169 82.235 133.208 1.00 0.00 O ATOM 59214 H1 WAT 2384 92.386 83.142 132.990 1.00 0.00 H ATOM 59215 H2 WAT 2384 92.953 81.738 132.973 1.00 0.00 H TER 59217 WAT 2384 ATOM 59217 O WAT 2385 47.676 50.741 140.350 1.00 0.00 O ATOM 59218 H1 WAT 2385 48.222 50.578 141.119 1.00 0.00 H ATOM 59219 H2 WAT 2385 48.301 50.899 139.642 1.00 0.00 H TER 59221 WAT 2385 ATOM 59221 O WAT 2386 23.282 38.398 110.295 1.00 0.00 O ATOM 59222 H1 WAT 2386 22.840 37.739 110.831 1.00 0.00 H ATOM 59223 H2 WAT 2386 23.321 38.010 109.421 1.00 0.00 H TER 59225 WAT 2386 ATOM 59225 O WAT 2387 10.787 69.217 140.435 1.00 0.00 O ATOM 59226 H1 WAT 2387 11.296 68.604 140.965 1.00 0.00 H ATOM 59227 H2 WAT 2387 10.649 68.759 139.606 1.00 0.00 H TER 59229 WAT 2387 ATOM 59229 O WAT 2388 144.160 94.202 156.706 1.00 0.00 O ATOM 59230 H1 WAT 2388 143.571 93.447 156.704 1.00 0.00 H ATOM 59231 H2 WAT 2388 144.554 94.200 155.833 1.00 0.00 H TER 59233 WAT 2388 ATOM 59233 O WAT 2389 49.754 13.829 72.726 1.00 0.00 O ATOM 59234 H1 WAT 2389 49.091 14.456 73.016 1.00 0.00 H ATOM 59235 H2 WAT 2389 49.491 13.598 71.835 1.00 0.00 H TER 59237 WAT 2389 ATOM 59237 O WAT 2390 6.487 75.923 5.697 1.00 0.00 O ATOM 59238 H1 WAT 2390 7.313 75.778 5.236 1.00 0.00 H ATOM 59239 H2 WAT 2390 6.735 76.405 6.486 1.00 0.00 H TER 59241 WAT 2390 ATOM 59241 O WAT 2391 121.639 15.993 151.242 1.00 0.00 O ATOM 59242 H1 WAT 2391 122.538 15.678 151.150 1.00 0.00 H ATOM 59243 H2 WAT 2391 121.731 16.887 151.571 1.00 0.00 H TER 59245 WAT 2391 ATOM 59245 O WAT 2392 10.402 51.852 76.424 1.00 0.00 O ATOM 59246 H1 WAT 2392 10.572 51.861 75.482 1.00 0.00 H ATOM 59247 H2 WAT 2392 10.926 52.576 76.768 1.00 0.00 H TER 59249 WAT 2392 ATOM 59249 O WAT 2393 120.755 121.517 135.626 1.00 0.00 O ATOM 59250 H1 WAT 2393 120.050 121.675 134.997 1.00 0.00 H ATOM 59251 H2 WAT 2393 121.266 120.806 135.239 1.00 0.00 H TER 59253 WAT 2393 ATOM 59253 O WAT 2394 20.745 75.764 135.068 1.00 0.00 O ATOM 59254 H1 WAT 2394 21.536 76.083 134.632 1.00 0.00 H ATOM 59255 H2 WAT 2394 20.028 76.044 134.498 1.00 0.00 H TER 59257 WAT 2394 ATOM 59257 O WAT 2395 108.331 38.273 94.595 1.00 0.00 O ATOM 59258 H1 WAT 2395 109.244 38.262 94.883 1.00 0.00 H ATOM 59259 H2 WAT 2395 108.146 39.195 94.418 1.00 0.00 H TER 59261 WAT 2395 ATOM 59261 O WAT 2396 120.953 19.386 64.200 1.00 0.00 O ATOM 59262 H1 WAT 2396 120.966 18.501 63.836 1.00 0.00 H ATOM 59263 H2 WAT 2396 120.263 19.362 64.863 1.00 0.00 H TER 59265 WAT 2396 ATOM 59265 O WAT 2397 50.280 38.582 115.455 1.00 0.00 O ATOM 59266 H1 WAT 2397 49.421 38.252 115.719 1.00 0.00 H ATOM 59267 H2 WAT 2397 50.299 39.484 115.773 1.00 0.00 H TER 59269 WAT 2397 ATOM 59269 O WAT 2398 32.050 139.086 125.009 1.00 0.00 O ATOM 59270 H1 WAT 2398 31.645 139.484 124.239 1.00 0.00 H ATOM 59271 H2 WAT 2398 31.332 138.988 125.634 1.00 0.00 H TER 59273 WAT 2398 ATOM 59273 O WAT 2399 110.165 81.253 129.068 1.00 0.00 O ATOM 59274 H1 WAT 2399 110.274 81.642 128.201 1.00 0.00 H ATOM 59275 H2 WAT 2399 109.590 80.501 128.924 1.00 0.00 H TER 59277 WAT 2399 ATOM 59277 O WAT 2400 72.180 15.113 16.931 1.00 0.00 O ATOM 59278 H1 WAT 2400 72.755 15.488 17.598 1.00 0.00 H ATOM 59279 H2 WAT 2400 71.955 15.853 16.366 1.00 0.00 H TER 59281 WAT 2400 ATOM 59281 O WAT 2401 72.225 55.060 9.260 1.00 0.00 O ATOM 59282 H1 WAT 2401 73.102 54.867 8.929 1.00 0.00 H ATOM 59283 H2 WAT 2401 72.330 55.089 10.211 1.00 0.00 H TER 59285 WAT 2401 ATOM 59285 O WAT 2402 94.657 27.448 107.070 1.00 0.00 O ATOM 59286 H1 WAT 2402 94.265 27.145 107.889 1.00 0.00 H ATOM 59287 H2 WAT 2402 95.601 27.380 107.218 1.00 0.00 H TER 59289 WAT 2402 ATOM 59289 O WAT 2403 16.313 85.108 11.824 1.00 0.00 O ATOM 59290 H1 WAT 2403 17.099 84.579 11.963 1.00 0.00 H ATOM 59291 H2 WAT 2403 15.597 84.565 12.155 1.00 0.00 H TER 59293 WAT 2403 ATOM 59293 O WAT 2404 15.047 138.020 17.250 1.00 0.00 O ATOM 59294 H1 WAT 2404 14.567 137.275 16.886 1.00 0.00 H ATOM 59295 H2 WAT 2404 15.372 138.492 16.483 1.00 0.00 H TER 59297 WAT 2404 ATOM 59297 O WAT 2405 65.612 104.195 58.274 1.00 0.00 O ATOM 59298 H1 WAT 2405 65.205 103.334 58.365 1.00 0.00 H ATOM 59299 H2 WAT 2405 65.233 104.556 57.472 1.00 0.00 H TER 59301 WAT 2405 ATOM 59301 O WAT 2406 30.845 55.226 92.792 1.00 0.00 O ATOM 59302 H1 WAT 2406 30.481 55.137 93.672 1.00 0.00 H ATOM 59303 H2 WAT 2406 30.224 54.764 92.228 1.00 0.00 H TER 59305 WAT 2406 ATOM 59305 O WAT 2407 15.650 80.053 83.078 1.00 0.00 O ATOM 59306 H1 WAT 2407 15.457 80.827 82.548 1.00 0.00 H ATOM 59307 H2 WAT 2407 16.456 80.276 83.543 1.00 0.00 H TER 59309 WAT 2407 ATOM 59309 O WAT 2408 87.968 64.712 59.009 1.00 0.00 O ATOM 59310 H1 WAT 2408 87.671 64.101 58.335 1.00 0.00 H ATOM 59311 H2 WAT 2408 88.460 64.168 59.624 1.00 0.00 H TER 59313 WAT 2408 ATOM 59313 O WAT 2409 30.522 71.884 6.565 1.00 0.00 O ATOM 59314 H1 WAT 2409 30.902 71.006 6.600 1.00 0.00 H ATOM 59315 H2 WAT 2409 29.769 71.795 5.980 1.00 0.00 H TER 59317 WAT 2409 ATOM 59317 O WAT 2410 140.129 128.369 110.363 1.00 0.00 O ATOM 59318 H1 WAT 2410 139.513 127.665 110.159 1.00 0.00 H ATOM 59319 H2 WAT 2410 140.739 128.374 109.625 1.00 0.00 H TER 59321 WAT 2410 ATOM 59321 O WAT 2411 97.052 105.941 30.169 1.00 0.00 O ATOM 59322 H1 WAT 2411 97.714 105.286 30.390 1.00 0.00 H ATOM 59323 H2 WAT 2411 97.446 106.775 30.423 1.00 0.00 H TER 59325 WAT 2411 ATOM 59325 O WAT 2412 57.134 87.144 94.787 1.00 0.00 O ATOM 59326 H1 WAT 2412 56.652 87.174 93.960 1.00 0.00 H ATOM 59327 H2 WAT 2412 56.458 87.218 95.460 1.00 0.00 H TER 59329 WAT 2412 ATOM 59329 O WAT 2413 58.566 112.154 155.150 1.00 0.00 O ATOM 59330 H1 WAT 2413 58.096 111.366 155.421 1.00 0.00 H ATOM 59331 H2 WAT 2413 58.739 112.022 154.218 1.00 0.00 H TER 59333 WAT 2413 ATOM 59333 O WAT 2414 30.447 7.693 103.250 1.00 0.00 O ATOM 59334 H1 WAT 2414 30.249 7.489 102.336 1.00 0.00 H ATOM 59335 H2 WAT 2414 29.714 8.237 103.538 1.00 0.00 H TER 59337 WAT 2414 ATOM 59337 O WAT 2415 85.967 36.091 85.288 1.00 0.00 O ATOM 59338 H1 WAT 2415 86.841 35.747 85.472 1.00 0.00 H ATOM 59339 H2 WAT 2415 85.459 35.886 86.073 1.00 0.00 H TER 59341 WAT 2415 ATOM 59341 O WAT 2416 95.204 55.930 16.732 1.00 0.00 O ATOM 59342 H1 WAT 2416 94.351 56.095 16.331 1.00 0.00 H ATOM 59343 H2 WAT 2416 95.078 55.130 17.241 1.00 0.00 H TER 59345 WAT 2416 ATOM 59345 O WAT 2417 137.901 11.680 134.203 1.00 0.00 O ATOM 59346 H1 WAT 2417 138.635 11.276 134.668 1.00 0.00 H ATOM 59347 H2 WAT 2417 138.151 12.599 134.115 1.00 0.00 H TER 59349 WAT 2417 ATOM 59349 O WAT 2418 120.645 66.868 137.390 1.00 0.00 O ATOM 59350 H1 WAT 2418 119.701 66.975 137.269 1.00 0.00 H ATOM 59351 H2 WAT 2418 121.024 67.117 136.547 1.00 0.00 H TER 59353 WAT 2418 ATOM 59353 O WAT 2419 19.080 110.356 53.883 1.00 0.00 O ATOM 59354 H1 WAT 2419 19.976 110.692 53.884 1.00 0.00 H ATOM 59355 H2 WAT 2419 19.117 109.572 54.431 1.00 0.00 H TER 59357 WAT 2419 ATOM 59357 O WAT 2420 63.181 140.859 114.949 1.00 0.00 O ATOM 59358 H1 WAT 2420 63.156 141.548 115.612 1.00 0.00 H ATOM 59359 H2 WAT 2420 62.523 140.225 115.237 1.00 0.00 H TER 59361 WAT 2420 ATOM 59361 O WAT 2421 139.890 86.804 3.663 1.00 0.00 O ATOM 59362 H1 WAT 2421 138.935 86.859 3.623 1.00 0.00 H ATOM 59363 H2 WAT 2421 140.138 86.358 2.853 1.00 0.00 H TER 59365 WAT 2421 ATOM 59365 O WAT 2422 64.093 15.828 63.043 1.00 0.00 O ATOM 59366 H1 WAT 2422 64.171 15.325 63.854 1.00 0.00 H ATOM 59367 H2 WAT 2422 64.631 16.606 63.190 1.00 0.00 H TER 59369 WAT 2422 ATOM 59369 O WAT 2423 122.220 67.020 127.663 1.00 0.00 O ATOM 59370 H1 WAT 2423 122.906 66.987 126.997 1.00 0.00 H ATOM 59371 H2 WAT 2423 121.817 67.881 127.549 1.00 0.00 H TER 59373 WAT 2423 ATOM 59373 O WAT 2424 105.262 49.343 137.327 1.00 0.00 O ATOM 59374 H1 WAT 2424 104.425 48.987 137.624 1.00 0.00 H ATOM 59375 H2 WAT 2424 105.193 49.353 136.372 1.00 0.00 H TER 59377 WAT 2424 ATOM 59377 O WAT 2425 98.915 85.057 75.166 1.00 0.00 O ATOM 59378 H1 WAT 2425 99.817 85.318 74.979 1.00 0.00 H ATOM 59379 H2 WAT 2425 98.502 84.987 74.305 1.00 0.00 H TER 59381 WAT 2425 ATOM 59381 O WAT 2426 101.360 64.098 72.459 1.00 0.00 O ATOM 59382 H1 WAT 2426 101.051 64.702 73.134 1.00 0.00 H ATOM 59383 H2 WAT 2426 101.166 63.228 72.809 1.00 0.00 H TER 59385 WAT 2426 ATOM 59385 O WAT 2427 56.997 135.550 123.701 1.00 0.00 O ATOM 59386 H1 WAT 2427 56.349 136.236 123.863 1.00 0.00 H ATOM 59387 H2 WAT 2427 57.841 135.983 123.835 1.00 0.00 H TER 59389 WAT 2427 ATOM 59389 O WAT 2428 76.640 129.917 12.934 1.00 0.00 O ATOM 59390 H1 WAT 2428 75.959 129.431 12.470 1.00 0.00 H ATOM 59391 H2 WAT 2428 77.339 129.278 13.073 1.00 0.00 H TER 59393 WAT 2428 ATOM 59393 O WAT 2429 90.694 127.373 107.179 1.00 0.00 O ATOM 59394 H1 WAT 2429 90.677 126.472 107.502 1.00 0.00 H ATOM 59395 H2 WAT 2429 89.966 127.802 107.630 1.00 0.00 H TER 59397 WAT 2429 ATOM 59397 O WAT 2430 125.266 21.217 94.980 1.00 0.00 O ATOM 59398 H1 WAT 2430 124.905 21.920 95.519 1.00 0.00 H ATOM 59399 H2 WAT 2430 125.501 20.532 95.605 1.00 0.00 H TER 59401 WAT 2430 ATOM 59401 O WAT 2431 37.097 135.787 94.540 1.00 0.00 O ATOM 59402 H1 WAT 2431 37.515 135.808 93.679 1.00 0.00 H ATOM 59403 H2 WAT 2431 36.171 135.948 94.360 1.00 0.00 H TER 59405 WAT 2431 ATOM 59405 O WAT 2432 79.869 7.067 125.318 1.00 0.00 O ATOM 59406 H1 WAT 2432 80.374 7.675 125.857 1.00 0.00 H ATOM 59407 H2 WAT 2432 79.982 6.218 125.745 1.00 0.00 H TER 59409 WAT 2432 ATOM 59409 O WAT 2433 126.629 5.409 126.298 1.00 0.00 O ATOM 59410 H1 WAT 2433 126.678 4.717 125.638 1.00 0.00 H ATOM 59411 H2 WAT 2433 127.111 5.059 127.048 1.00 0.00 H TER 59413 WAT 2433 ATOM 59413 O WAT 2434 138.635 104.872 106.746 1.00 0.00 O ATOM 59414 H1 WAT 2434 139.072 104.289 106.124 1.00 0.00 H ATOM 59415 H2 WAT 2434 139.265 104.978 107.458 1.00 0.00 H TER 59417 WAT 2434 ATOM 59417 O WAT 2435 43.910 131.368 141.215 1.00 0.00 O ATOM 59418 H1 WAT 2435 44.632 130.844 140.867 1.00 0.00 H ATOM 59419 H2 WAT 2435 43.193 130.744 141.327 1.00 0.00 H TER 59421 WAT 2435 ATOM 59421 O WAT 2436 130.872 4.669 114.896 1.00 0.00 O ATOM 59422 H1 WAT 2436 130.670 5.571 114.648 1.00 0.00 H ATOM 59423 H2 WAT 2436 130.017 4.254 115.009 1.00 0.00 H TER 59425 WAT 2436 ATOM 59425 O WAT 2437 54.366 49.251 9.545 1.00 0.00 O ATOM 59426 H1 WAT 2437 55.110 49.299 8.945 1.00 0.00 H ATOM 59427 H2 WAT 2437 53.960 50.117 9.492 1.00 0.00 H TER 59429 WAT 2437 ATOM 59429 O WAT 2438 64.669 141.092 5.364 1.00 0.00 O ATOM 59430 H1 WAT 2438 64.724 141.699 6.102 1.00 0.00 H ATOM 59431 H2 WAT 2438 64.923 140.246 5.731 1.00 0.00 H TER 59433 WAT 2438 ATOM 59433 O WAT 2439 12.109 6.310 108.853 1.00 0.00 O ATOM 59434 H1 WAT 2439 12.806 6.024 108.263 1.00 0.00 H ATOM 59435 H2 WAT 2439 12.431 6.093 109.728 1.00 0.00 H TER 59437 WAT 2439 ATOM 59437 O WAT 2440 49.183 16.510 124.918 1.00 0.00 O ATOM 59438 H1 WAT 2440 49.467 15.807 125.502 1.00 0.00 H ATOM 59439 H2 WAT 2440 48.268 16.662 125.153 1.00 0.00 H TER 59441 WAT 2440 ATOM 59441 O WAT 2441 95.632 40.498 104.786 1.00 0.00 O ATOM 59442 H1 WAT 2441 96.229 40.201 104.100 1.00 0.00 H ATOM 59443 H2 WAT 2441 95.784 39.896 105.513 1.00 0.00 H TER 59445 WAT 2441 ATOM 59445 O WAT 2442 23.049 120.106 59.232 1.00 0.00 O ATOM 59446 H1 WAT 2442 23.514 120.572 58.537 1.00 0.00 H ATOM 59447 H2 WAT 2442 22.493 119.479 58.769 1.00 0.00 H TER 59449 WAT 2442 ATOM 59449 O WAT 2443 114.827 59.239 116.049 1.00 0.00 O ATOM 59450 H1 WAT 2443 114.412 59.146 115.192 1.00 0.00 H ATOM 59451 H2 WAT 2443 114.143 59.606 116.608 1.00 0.00 H TER 59453 WAT 2443 ATOM 59453 O WAT 2444 97.365 118.654 110.390 1.00 0.00 O ATOM 59454 H1 WAT 2444 97.676 119.264 111.059 1.00 0.00 H ATOM 59455 H2 WAT 2444 97.161 119.208 109.637 1.00 0.00 H TER 59457 WAT 2444 ATOM 59457 O WAT 2445 88.942 12.226 104.819 1.00 0.00 O ATOM 59458 H1 WAT 2445 89.156 12.803 104.085 1.00 0.00 H ATOM 59459 H2 WAT 2445 88.642 12.817 105.509 1.00 0.00 H TER 59461 WAT 2445 ATOM 59461 O WAT 2446 1.257 125.416 8.926 1.00 0.00 O ATOM 59462 H1 WAT 2446 2.032 125.971 9.008 1.00 0.00 H ATOM 59463 H2 WAT 2446 1.156 125.016 9.790 1.00 0.00 H TER 59465 WAT 2446 ATOM 59465 O WAT 2447 74.721 96.067 78.857 1.00 0.00 O ATOM 59466 H1 WAT 2447 74.359 95.185 78.938 1.00 0.00 H ATOM 59467 H2 WAT 2447 74.987 96.133 77.940 1.00 0.00 H TER 59469 WAT 2447 ATOM 59469 O WAT 2448 14.002 73.814 140.273 1.00 0.00 O ATOM 59470 H1 WAT 2448 14.111 74.282 141.101 1.00 0.00 H ATOM 59471 H2 WAT 2448 13.355 73.135 140.465 1.00 0.00 H TER 59473 WAT 2448 ATOM 59473 O WAT 2449 103.154 120.055 103.123 1.00 0.00 O ATOM 59474 H1 WAT 2449 103.124 119.099 103.164 1.00 0.00 H ATOM 59475 H2 WAT 2449 104.087 120.266 103.151 1.00 0.00 H TER 59477 WAT 2449 ATOM 59477 O WAT 2450 71.998 97.991 95.732 1.00 0.00 O ATOM 59478 H1 WAT 2450 72.770 97.677 96.203 1.00 0.00 H ATOM 59479 H2 WAT 2450 71.850 97.336 95.051 1.00 0.00 H TER 59481 WAT 2450 ATOM 59481 O WAT 2451 58.548 136.446 12.395 1.00 0.00 O ATOM 59482 H1 WAT 2451 58.959 136.295 13.245 1.00 0.00 H ATOM 59483 H2 WAT 2451 58.625 135.608 11.939 1.00 0.00 H TER 59485 WAT 2451 ATOM 59485 O WAT 2452 30.163 106.180 101.278 1.00 0.00 O ATOM 59486 H1 WAT 2452 29.995 105.324 101.673 1.00 0.00 H ATOM 59487 H2 WAT 2452 29.929 106.069 100.357 1.00 0.00 H TER 59489 WAT 2452 ATOM 59489 O WAT 2453 108.715 29.414 155.747 1.00 0.00 O ATOM 59490 H1 WAT 2453 108.865 28.535 155.401 1.00 0.00 H ATOM 59491 H2 WAT 2453 109.227 29.445 156.555 1.00 0.00 H TER 59493 WAT 2453 ATOM 59493 O WAT 2454 15.660 14.954 77.131 1.00 0.00 O ATOM 59494 H1 WAT 2454 15.069 14.604 77.797 1.00 0.00 H ATOM 59495 H2 WAT 2454 15.234 15.756 76.830 1.00 0.00 H TER 59497 WAT 2454 ATOM 59497 O WAT 2455 17.494 28.772 28.750 1.00 0.00 O ATOM 59498 H1 WAT 2455 17.773 27.938 29.129 1.00 0.00 H ATOM 59499 H2 WAT 2455 17.682 28.684 27.815 1.00 0.00 H TER 59501 WAT 2455 ATOM 59501 O WAT 2456 34.341 21.841 72.397 1.00 0.00 O ATOM 59502 H1 WAT 2456 34.928 22.018 71.662 1.00 0.00 H ATOM 59503 H2 WAT 2456 33.804 22.631 72.470 1.00 0.00 H TER 59505 WAT 2456 ATOM 59505 O WAT 2457 142.411 96.509 96.538 1.00 0.00 O ATOM 59506 H1 WAT 2457 143.342 96.308 96.629 1.00 0.00 H ATOM 59507 H2 WAT 2457 142.241 97.169 97.210 1.00 0.00 H TER 59509 WAT 2457 ATOM 59509 O WAT 2458 37.628 116.534 5.163 1.00 0.00 O ATOM 59510 H1 WAT 2458 38.574 116.608 5.288 1.00 0.00 H ATOM 59511 H2 WAT 2458 37.518 115.756 4.617 1.00 0.00 H TER 59513 WAT 2458 ATOM 59513 O WAT 2459 123.046 133.574 131.311 1.00 0.00 O ATOM 59514 H1 WAT 2459 123.034 132.652 131.054 1.00 0.00 H ATOM 59515 H2 WAT 2459 123.542 134.010 130.618 1.00 0.00 H TER 59517 WAT 2459 ATOM 59517 O WAT 2460 15.449 80.026 68.506 1.00 0.00 O ATOM 59518 H1 WAT 2460 14.708 79.642 68.974 1.00 0.00 H ATOM 59519 H2 WAT 2460 15.213 79.953 67.581 1.00 0.00 H TER 59521 WAT 2460 ATOM 59521 O WAT 2461 71.215 81.506 142.818 1.00 0.00 O ATOM 59522 H1 WAT 2461 71.432 80.576 142.754 1.00 0.00 H ATOM 59523 H2 WAT 2461 72.055 81.955 142.725 1.00 0.00 H TER 59525 WAT 2461 ATOM 59525 O WAT 2462 73.421 6.800 154.635 1.00 0.00 O ATOM 59526 H1 WAT 2462 73.269 6.201 153.905 1.00 0.00 H ATOM 59527 H2 WAT 2462 72.555 6.931 155.022 1.00 0.00 H TER 59529 WAT 2462 ATOM 59529 O WAT 2463 34.970 54.557 156.455 1.00 0.00 O ATOM 59530 H1 WAT 2463 34.629 53.948 157.110 1.00 0.00 H ATOM 59531 H2 WAT 2463 35.368 55.262 156.967 1.00 0.00 H TER 59533 WAT 2463 ATOM 59533 O WAT 2464 78.837 33.404 148.663 1.00 0.00 O ATOM 59534 H1 WAT 2464 79.745 33.357 148.960 1.00 0.00 H ATOM 59535 H2 WAT 2464 78.684 34.336 148.506 1.00 0.00 H TER 59537 WAT 2464 ATOM 59537 O WAT 2465 33.923 116.200 3.961 1.00 0.00 O ATOM 59538 H1 WAT 2465 33.812 115.359 4.404 1.00 0.00 H ATOM 59539 H2 WAT 2465 34.680 116.072 3.390 1.00 0.00 H TER 59541 WAT 2465 ATOM 59541 O WAT 2466 114.292 79.566 78.508 1.00 0.00 O ATOM 59542 H1 WAT 2466 113.772 78.766 78.581 1.00 0.00 H ATOM 59543 H2 WAT 2466 113.948 80.138 79.194 1.00 0.00 H TER 59545 WAT 2466 ATOM 59545 O WAT 2467 22.168 19.697 103.848 1.00 0.00 O ATOM 59546 H1 WAT 2467 22.826 19.718 103.153 1.00 0.00 H ATOM 59547 H2 WAT 2467 22.506 19.062 104.479 1.00 0.00 H TER 59549 WAT 2467 ATOM 59549 O WAT 2468 56.436 24.823 156.469 1.00 0.00 O ATOM 59550 H1 WAT 2468 55.867 24.542 157.185 1.00 0.00 H ATOM 59551 H2 WAT 2468 57.169 24.207 156.490 1.00 0.00 H TER 59553 WAT 2468 ATOM 59553 O WAT 2469 84.147 63.245 73.999 1.00 0.00 O ATOM 59554 H1 WAT 2469 85.077 63.107 74.178 1.00 0.00 H ATOM 59555 H2 WAT 2469 83.944 64.082 74.416 1.00 0.00 H TER 59557 WAT 2469 ATOM 59557 O WAT 2470 56.803 0.803 135.549 1.00 0.00 O ATOM 59558 H1 WAT 2470 56.540 1.679 135.267 1.00 0.00 H ATOM 59559 H2 WAT 2470 56.512 0.747 136.459 1.00 0.00 H TER 59561 WAT 2470 ATOM 59561 O WAT 2471 145.314 68.131 15.606 1.00 0.00 O ATOM 59562 H1 WAT 2471 145.684 67.462 15.030 1.00 0.00 H ATOM 59563 H2 WAT 2471 145.528 67.831 16.490 1.00 0.00 H TER 59565 WAT 2471 ATOM 59565 O WAT 2472 145.600 25.624 3.264 1.00 0.00 O ATOM 59566 H1 WAT 2472 145.198 24.766 3.129 1.00 0.00 H ATOM 59567 H2 WAT 2472 146.347 25.635 2.665 1.00 0.00 H TER 59569 WAT 2472 ATOM 59569 O WAT 2473 141.970 105.271 140.785 1.00 0.00 O ATOM 59570 H1 WAT 2473 141.691 104.600 141.408 1.00 0.00 H ATOM 59571 H2 WAT 2473 141.332 105.217 140.073 1.00 0.00 H TER 59573 WAT 2473 ATOM 59573 O WAT 2474 23.906 65.517 139.443 1.00 0.00 O ATOM 59574 H1 WAT 2474 24.460 64.790 139.159 1.00 0.00 H ATOM 59575 H2 WAT 2474 23.215 65.104 139.961 1.00 0.00 H TER 59577 WAT 2474 ATOM 59577 O WAT 2475 66.300 56.421 24.230 1.00 0.00 O ATOM 59578 H1 WAT 2475 65.733 56.455 23.459 1.00 0.00 H ATOM 59579 H2 WAT 2475 65.769 55.988 24.898 1.00 0.00 H TER 59581 WAT 2475 ATOM 59581 O WAT 2476 143.320 116.259 117.490 1.00 0.00 O ATOM 59582 H1 WAT 2476 143.899 115.880 116.829 1.00 0.00 H ATOM 59583 H2 WAT 2476 142.439 116.130 117.140 1.00 0.00 H TER 59585 WAT 2476 ATOM 59585 O WAT 2477 54.337 74.814 59.029 1.00 0.00 O ATOM 59586 H1 WAT 2477 54.385 75.502 58.365 1.00 0.00 H ATOM 59587 H2 WAT 2477 53.549 74.320 58.804 1.00 0.00 H TER 59589 WAT 2477 ATOM 59589 O WAT 2478 44.651 121.025 141.424 1.00 0.00 O ATOM 59590 H1 WAT 2478 44.016 120.852 140.729 1.00 0.00 H ATOM 59591 H2 WAT 2478 45.495 120.785 141.041 1.00 0.00 H TER 59593 WAT 2478 ATOM 59593 O WAT 2479 116.417 67.112 7.156 1.00 0.00 O ATOM 59594 H1 WAT 2479 116.169 66.442 7.794 1.00 0.00 H ATOM 59595 H2 WAT 2479 116.363 67.936 7.641 1.00 0.00 H TER 59597 WAT 2479 ATOM 59597 O WAT 2480 58.780 66.178 2.840 1.00 0.00 O ATOM 59598 H1 WAT 2480 59.112 66.586 3.640 1.00 0.00 H ATOM 59599 H2 WAT 2480 58.005 66.692 2.614 1.00 0.00 H TER 59601 WAT 2480 ATOM 59601 O WAT 2481 104.900 57.975 20.177 1.00 0.00 O ATOM 59602 H1 WAT 2481 104.105 57.517 20.451 1.00 0.00 H ATOM 59603 H2 WAT 2481 105.459 57.970 20.954 1.00 0.00 H TER 59605 WAT 2481 ATOM 59605 O WAT 2482 74.564 91.364 14.232 1.00 0.00 O ATOM 59606 H1 WAT 2482 74.972 90.882 14.951 1.00 0.00 H ATOM 59607 H2 WAT 2482 74.990 92.222 14.248 1.00 0.00 H TER 59609 WAT 2482 ATOM 59609 O WAT 2483 7.711 108.938 89.642 1.00 0.00 O ATOM 59610 H1 WAT 2483 6.825 109.003 89.286 1.00 0.00 H ATOM 59611 H2 WAT 2483 7.774 108.038 89.963 1.00 0.00 H TER 59613 WAT 2483 ATOM 59613 O WAT 2484 82.601 125.199 125.445 1.00 0.00 O ATOM 59614 H1 WAT 2484 82.744 124.698 124.641 1.00 0.00 H ATOM 59615 H2 WAT 2484 82.538 124.535 126.132 1.00 0.00 H TER 59617 WAT 2484 ATOM 59617 O WAT 2485 132.493 134.811 127.698 1.00 0.00 O ATOM 59618 H1 WAT 2485 131.623 134.588 127.367 1.00 0.00 H ATOM 59619 H2 WAT 2485 132.855 135.405 127.040 1.00 0.00 H TER 59621 WAT 2485 ATOM 59621 O WAT 2486 125.597 95.485 24.787 1.00 0.00 O ATOM 59622 H1 WAT 2486 126.348 94.917 24.615 1.00 0.00 H ATOM 59623 H2 WAT 2486 124.927 95.189 24.171 1.00 0.00 H TER 59625 WAT 2486 ATOM 59625 O WAT 2487 42.402 130.679 150.797 1.00 0.00 O ATOM 59626 H1 WAT 2487 43.066 131.360 150.906 1.00 0.00 H ATOM 59627 H2 WAT 2487 42.652 130.228 149.991 1.00 0.00 H TER 59629 WAT 2487 ATOM 59629 O WAT 2488 85.527 138.393 121.092 1.00 0.00 O ATOM 59630 H1 WAT 2488 84.852 137.741 120.902 1.00 0.00 H ATOM 59631 H2 WAT 2488 85.938 138.085 121.899 1.00 0.00 H TER 59633 WAT 2488 ATOM 59633 O WAT 2489 19.671 130.936 3.416 1.00 0.00 O ATOM 59634 H1 WAT 2489 18.763 130.729 3.195 1.00 0.00 H ATOM 59635 H2 WAT 2489 19.671 131.882 3.566 1.00 0.00 H TER 59637 WAT 2489 ATOM 59637 O WAT 2490 94.304 71.694 135.192 1.00 0.00 O ATOM 59638 H1 WAT 2490 95.052 72.261 135.379 1.00 0.00 H ATOM 59639 H2 WAT 2490 94.688 70.912 134.796 1.00 0.00 H TER 59641 WAT 2490 ATOM 59641 O WAT 2491 121.640 41.615 101.925 1.00 0.00 O ATOM 59642 H1 WAT 2491 121.073 40.846 101.870 1.00 0.00 H ATOM 59643 H2 WAT 2491 122.518 41.278 101.746 1.00 0.00 H TER 59645 WAT 2491 ATOM 59645 O WAT 2492 122.426 83.640 92.067 1.00 0.00 O ATOM 59646 H1 WAT 2492 122.544 84.232 91.324 1.00 0.00 H ATOM 59647 H2 WAT 2492 122.512 82.764 91.691 1.00 0.00 H TER 59649 WAT 2492 ATOM 59649 O WAT 2493 59.154 20.697 78.056 1.00 0.00 O ATOM 59650 H1 WAT 2493 58.275 21.062 77.954 1.00 0.00 H ATOM 59651 H2 WAT 2493 59.275 20.625 79.003 1.00 0.00 H TER 59653 WAT 2493 ATOM 59653 O WAT 2494 88.447 54.411 97.740 1.00 0.00 O ATOM 59654 H1 WAT 2494 88.771 53.651 98.225 1.00 0.00 H ATOM 59655 H2 WAT 2494 87.636 54.653 98.187 1.00 0.00 H TER 59657 WAT 2494 ATOM 59657 O WAT 2495 69.199 120.716 114.354 1.00 0.00 O ATOM 59658 H1 WAT 2495 69.962 120.361 113.898 1.00 0.00 H ATOM 59659 H2 WAT 2495 68.834 121.359 113.746 1.00 0.00 H TER 59661 WAT 2495 ATOM 59661 O WAT 2496 86.425 62.448 75.164 1.00 0.00 O ATOM 59662 H1 WAT 2496 86.162 61.607 74.791 1.00 0.00 H ATOM 59663 H2 WAT 2496 85.843 62.570 75.914 1.00 0.00 H TER 59665 WAT 2496 ATOM 59665 O WAT 2497 60.019 131.961 13.566 1.00 0.00 O ATOM 59666 H1 WAT 2497 60.573 132.668 13.898 1.00 0.00 H ATOM 59667 H2 WAT 2497 60.334 131.179 14.019 1.00 0.00 H TER 59669 WAT 2497 ATOM 59669 O WAT 2498 63.246 34.906 119.927 1.00 0.00 O ATOM 59670 H1 WAT 2498 63.697 35.685 120.253 1.00 0.00 H ATOM 59671 H2 WAT 2498 63.852 34.187 120.104 1.00 0.00 H TER 59673 WAT 2498 ATOM 59673 O WAT 2499 0.790 51.955 132.558 1.00 0.00 O ATOM 59674 H1 WAT 2499 0.537 51.519 133.372 1.00 0.00 H ATOM 59675 H2 WAT 2499 1.685 51.657 132.395 1.00 0.00 H TER 59677 WAT 2499 ATOM 59677 O WAT 2500 25.648 54.779 142.074 1.00 0.00 O ATOM 59678 H1 WAT 2500 25.972 53.878 142.091 1.00 0.00 H ATOM 59679 H2 WAT 2500 26.437 55.318 142.120 1.00 0.00 H TER 59681 WAT 2500 ATOM 59681 O WAT 2501 125.170 108.779 82.320 1.00 0.00 O ATOM 59682 H1 WAT 2501 125.238 108.139 81.612 1.00 0.00 H ATOM 59683 H2 WAT 2501 125.149 109.627 81.876 1.00 0.00 H TER 59685 WAT 2501 ATOM 59685 O WAT 2502 39.808 67.111 72.242 1.00 0.00 O ATOM 59686 H1 WAT 2502 40.020 66.301 72.706 1.00 0.00 H ATOM 59687 H2 WAT 2502 39.683 66.840 71.332 1.00 0.00 H TER 59689 WAT 2502 ATOM 59689 O WAT 2503 8.731 131.013 1.764 1.00 0.00 O ATOM 59690 H1 WAT 2503 9.684 131.082 1.809 1.00 0.00 H ATOM 59691 H2 WAT 2503 8.441 131.107 2.671 1.00 0.00 H TER 59693 WAT 2503 ATOM 59693 O WAT 2504 102.296 89.291 122.924 1.00 0.00 O ATOM 59694 H1 WAT 2504 103.176 89.132 123.266 1.00 0.00 H ATOM 59695 H2 WAT 2504 102.331 90.181 122.575 1.00 0.00 H TER 59697 WAT 2504 ATOM 59697 O WAT 2505 43.062 141.925 84.312 1.00 0.00 O ATOM 59698 H1 WAT 2505 42.609 142.255 83.536 1.00 0.00 H ATOM 59699 H2 WAT 2505 43.941 141.708 84.002 1.00 0.00 H TER 59701 WAT 2505 ATOM 59701 O WAT 2506 131.939 138.943 149.174 1.00 0.00 O ATOM 59702 H1 WAT 2506 132.579 138.530 149.754 1.00 0.00 H ATOM 59703 H2 WAT 2506 132.221 139.856 149.117 1.00 0.00 H TER 59705 WAT 2506 ATOM 59705 O WAT 2507 87.920 56.762 93.980 1.00 0.00 O ATOM 59706 H1 WAT 2507 87.299 56.970 94.678 1.00 0.00 H ATOM 59707 H2 WAT 2507 87.378 56.405 93.277 1.00 0.00 H TER 59709 WAT 2507 ATOM 59709 O WAT 2508 93.209 19.409 154.484 1.00 0.00 O ATOM 59710 H1 WAT 2508 93.053 19.060 155.361 1.00 0.00 H ATOM 59711 H2 WAT 2508 92.553 18.980 153.935 1.00 0.00 H TER 59713 WAT 2508 ATOM 59713 O WAT 2509 46.144 123.686 124.876 1.00 0.00 O ATOM 59714 H1 WAT 2509 45.466 123.184 124.424 1.00 0.00 H ATOM 59715 H2 WAT 2509 45.925 123.603 125.804 1.00 0.00 H TER 59717 WAT 2509 ATOM 59717 O WAT 2510 103.671 27.007 17.733 1.00 0.00 O ATOM 59718 H1 WAT 2510 103.806 27.951 17.661 1.00 0.00 H ATOM 59719 H2 WAT 2510 103.505 26.859 18.664 1.00 0.00 H TER 59721 WAT 2510 ATOM 59721 O WAT 2511 95.928 5.988 73.145 1.00 0.00 O ATOM 59722 H1 WAT 2511 96.730 6.495 73.015 1.00 0.00 H ATOM 59723 H2 WAT 2511 96.223 5.079 73.189 1.00 0.00 H TER 59725 WAT 2511 ATOM 59725 O WAT 2512 88.608 94.780 143.577 1.00 0.00 O ATOM 59726 H1 WAT 2512 89.057 95.359 142.960 1.00 0.00 H ATOM 59727 H2 WAT 2512 89.314 94.312 144.023 1.00 0.00 H TER 59729 WAT 2512 ATOM 59729 O WAT 2513 58.286 119.456 128.913 1.00 0.00 O ATOM 59730 H1 WAT 2513 58.834 119.252 129.671 1.00 0.00 H ATOM 59731 H2 WAT 2513 57.545 118.855 128.985 1.00 0.00 H TER 59733 WAT 2513 ATOM 59733 O WAT 2514 69.702 108.741 80.683 1.00 0.00 O ATOM 59734 H1 WAT 2514 68.905 108.586 81.190 1.00 0.00 H ATOM 59735 H2 WAT 2514 69.715 109.687 80.539 1.00 0.00 H TER 59737 WAT 2514 ATOM 59737 O WAT 2515 127.780 130.557 97.371 1.00 0.00 O ATOM 59738 H1 WAT 2515 128.229 129.728 97.209 1.00 0.00 H ATOM 59739 H2 WAT 2515 126.870 130.310 97.531 1.00 0.00 H TER 59741 WAT 2515 ATOM 59741 O WAT 2516 55.313 125.971 91.043 1.00 0.00 O ATOM 59742 H1 WAT 2516 54.386 125.753 91.145 1.00 0.00 H ATOM 59743 H2 WAT 2516 55.776 125.260 91.485 1.00 0.00 H TER 59745 WAT 2516 ATOM 59745 O WAT 2517 38.014 126.327 113.119 1.00 0.00 O ATOM 59746 H1 WAT 2517 38.005 127.217 113.470 1.00 0.00 H ATOM 59747 H2 WAT 2517 38.942 126.126 112.997 1.00 0.00 H TER 59749 WAT 2517 ATOM 59749 O WAT 2518 55.020 6.264 152.200 1.00 0.00 O ATOM 59750 H1 WAT 2518 55.000 7.119 151.770 1.00 0.00 H ATOM 59751 H2 WAT 2518 54.302 6.297 152.833 1.00 0.00 H TER 59753 WAT 2518 ATOM 59753 O WAT 2519 144.217 111.245 64.948 1.00 0.00 O ATOM 59754 H1 WAT 2519 144.932 111.182 64.315 1.00 0.00 H ATOM 59755 H2 WAT 2519 144.125 112.183 65.114 1.00 0.00 H TER 59757 WAT 2519 ATOM 59757 O WAT 2520 36.062 123.918 80.903 1.00 0.00 O ATOM 59758 H1 WAT 2520 36.456 123.198 81.394 1.00 0.00 H ATOM 59759 H2 WAT 2520 36.121 124.670 81.493 1.00 0.00 H TER 59761 WAT 2520 ATOM 59761 O WAT 2521 107.757 6.688 158.762 1.00 0.00 O ATOM 59762 H1 WAT 2521 107.362 6.025 158.196 1.00 0.00 H ATOM 59763 H2 WAT 2521 107.863 7.453 158.196 1.00 0.00 H TER 59765 WAT 2521 ATOM 59765 O WAT 2522 106.016 115.947 104.594 1.00 0.00 O ATOM 59766 H1 WAT 2522 106.221 115.829 103.667 1.00 0.00 H ATOM 59767 H2 WAT 2522 106.615 115.354 105.049 1.00 0.00 H TER 59769 WAT 2522 ATOM 59769 O WAT 2523 129.055 2.197 147.161 1.00 0.00 O ATOM 59770 H1 WAT 2523 128.561 2.535 147.908 1.00 0.00 H ATOM 59771 H2 WAT 2523 128.431 1.642 146.693 1.00 0.00 H TER 59773 WAT 2523 ATOM 59773 O WAT 2524 136.551 47.199 117.943 1.00 0.00 O ATOM 59774 H1 WAT 2524 136.255 46.840 118.779 1.00 0.00 H ATOM 59775 H2 WAT 2524 135.922 46.865 117.303 1.00 0.00 H TER 59777 WAT 2524 ATOM 59777 O WAT 2525 6.264 107.592 144.037 1.00 0.00 O ATOM 59778 H1 WAT 2525 5.801 106.827 144.380 1.00 0.00 H ATOM 59779 H2 WAT 2525 5.642 108.313 144.139 1.00 0.00 H TER 59781 WAT 2525 ATOM 59781 O WAT 2526 38.987 34.578 150.231 1.00 0.00 O ATOM 59782 H1 WAT 2526 38.210 34.042 150.076 1.00 0.00 H ATOM 59783 H2 WAT 2526 38.710 35.220 150.883 1.00 0.00 H TER 59785 WAT 2526 ATOM 59785 O WAT 2527 119.335 56.025 126.223 1.00 0.00 O ATOM 59786 H1 WAT 2527 120.013 55.369 126.386 1.00 0.00 H ATOM 59787 H2 WAT 2527 118.547 55.661 126.625 1.00 0.00 H TER 59789 WAT 2527 ATOM 59789 O WAT 2528 83.858 118.419 122.065 1.00 0.00 O ATOM 59790 H1 WAT 2528 83.477 119.031 121.436 1.00 0.00 H ATOM 59791 H2 WAT 2528 84.626 118.062 121.619 1.00 0.00 H TER 59793 WAT 2528 ATOM 59793 O WAT 2529 130.889 107.408 115.519 1.00 0.00 O ATOM 59794 H1 WAT 2529 131.598 107.679 116.101 1.00 0.00 H ATOM 59795 H2 WAT 2529 130.173 107.171 116.108 1.00 0.00 H TER 59797 WAT 2529 ATOM 59797 O WAT 2530 2.598 90.191 1.029 1.00 0.00 O ATOM 59798 H1 WAT 2530 1.815 90.147 0.481 1.00 0.00 H ATOM 59799 H2 WAT 2530 3.219 90.711 0.518 1.00 0.00 H TER 59801 WAT 2530 ATOM 59801 O WAT 2531 8.443 119.710 150.005 1.00 0.00 O ATOM 59802 H1 WAT 2531 8.053 120.080 150.797 1.00 0.00 H ATOM 59803 H2 WAT 2531 8.786 120.467 149.530 1.00 0.00 H TER 59805 WAT 2531 ATOM 59805 O WAT 2532 107.371 10.936 78.215 1.00 0.00 O ATOM 59806 H1 WAT 2532 107.559 11.492 77.458 1.00 0.00 H ATOM 59807 H2 WAT 2532 107.912 10.158 78.080 1.00 0.00 H TER 59809 WAT 2532 ATOM 59809 O WAT 2533 53.224 116.043 21.689 1.00 0.00 O ATOM 59810 H1 WAT 2533 54.032 115.530 21.687 1.00 0.00 H ATOM 59811 H2 WAT 2533 52.571 115.460 22.077 1.00 0.00 H TER 59813 WAT 2533 ATOM 59813 O WAT 2534 49.599 50.692 124.625 1.00 0.00 O ATOM 59814 H1 WAT 2534 49.153 50.004 124.131 1.00 0.00 H ATOM 59815 H2 WAT 2534 49.384 50.507 125.540 1.00 0.00 H TER 59817 WAT 2534 ATOM 59817 O WAT 2535 73.120 63.873 128.476 1.00 0.00 O ATOM 59818 H1 WAT 2535 73.482 63.231 129.087 1.00 0.00 H ATOM 59819 H2 WAT 2535 72.894 63.363 127.699 1.00 0.00 H TER 59821 WAT 2535 ATOM 59821 O WAT 2536 27.883 41.104 126.998 1.00 0.00 O ATOM 59822 H1 WAT 2536 28.743 41.237 126.600 1.00 0.00 H ATOM 59823 H2 WAT 2536 27.949 40.254 127.433 1.00 0.00 H TER 59825 WAT 2536 ATOM 59825 O WAT 2537 52.676 81.657 147.236 1.00 0.00 O ATOM 59826 H1 WAT 2537 52.873 82.044 146.383 1.00 0.00 H ATOM 59827 H2 WAT 2537 53.525 81.597 147.674 1.00 0.00 H TER 59829 WAT 2537 ATOM 59829 O WAT 2538 120.828 93.986 99.414 1.00 0.00 O ATOM 59830 H1 WAT 2538 120.672 93.066 99.202 1.00 0.00 H ATOM 59831 H2 WAT 2538 120.122 94.458 98.973 1.00 0.00 H TER 59833 WAT 2538 ATOM 59833 O WAT 2539 128.847 90.250 136.569 1.00 0.00 O ATOM 59834 H1 WAT 2539 128.573 89.749 135.801 1.00 0.00 H ATOM 59835 H2 WAT 2539 129.567 90.796 136.256 1.00 0.00 H TER 59837 WAT 2539 ATOM 59837 O WAT 2540 21.972 3.953 85.715 1.00 0.00 O ATOM 59838 H1 WAT 2540 21.500 3.473 85.034 1.00 0.00 H ATOM 59839 H2 WAT 2540 21.292 4.228 86.329 1.00 0.00 H TER 59841 WAT 2540 ATOM 59841 O WAT 2541 50.381 8.316 110.222 1.00 0.00 O ATOM 59842 H1 WAT 2541 51.020 7.604 110.263 1.00 0.00 H ATOM 59843 H2 WAT 2541 49.906 8.260 111.051 1.00 0.00 H TER 59845 WAT 2541 ATOM 59845 O WAT 2542 134.417 50.956 137.592 1.00 0.00 O ATOM 59846 H1 WAT 2542 134.031 50.304 137.007 1.00 0.00 H ATOM 59847 H2 WAT 2542 134.744 50.448 138.334 1.00 0.00 H TER 59849 WAT 2542 ATOM 59849 O WAT 2543 75.633 27.944 70.277 1.00 0.00 O ATOM 59850 H1 WAT 2543 74.706 27.867 70.502 1.00 0.00 H ATOM 59851 H2 WAT 2543 75.777 27.266 69.617 1.00 0.00 H TER 59853 WAT 2543 ATOM 59853 O WAT 2544 115.672 134.706 122.656 1.00 0.00 O ATOM 59854 H1 WAT 2544 116.128 133.890 122.864 1.00 0.00 H ATOM 59855 H2 WAT 2544 116.303 135.209 122.142 1.00 0.00 H TER 59857 WAT 2544 ATOM 59857 O WAT 2545 12.748 29.983 150.169 1.00 0.00 O ATOM 59858 H1 WAT 2545 13.047 30.771 149.714 1.00 0.00 H ATOM 59859 H2 WAT 2545 13.335 29.904 150.921 1.00 0.00 H TER 59861 WAT 2545 ATOM 59861 O WAT 2546 17.549 124.190 127.688 1.00 0.00 O ATOM 59862 H1 WAT 2546 16.662 123.934 127.942 1.00 0.00 H ATOM 59863 H2 WAT 2546 17.525 125.146 127.664 1.00 0.00 H TER 59865 WAT 2546 ATOM 59865 O WAT 2547 48.319 91.108 79.975 1.00 0.00 O ATOM 59866 H1 WAT 2547 48.726 91.012 79.114 1.00 0.00 H ATOM 59867 H2 WAT 2547 47.418 90.812 79.849 1.00 0.00 H TER 59869 WAT 2547 ATOM 59869 O WAT 2548 27.157 118.359 86.075 1.00 0.00 O ATOM 59870 H1 WAT 2548 26.854 117.761 85.392 1.00 0.00 H ATOM 59871 H2 WAT 2548 27.840 118.879 85.653 1.00 0.00 H TER 59873 WAT 2548 ATOM 59873 O WAT 2549 141.320 26.442 128.555 1.00 0.00 O ATOM 59874 H1 WAT 2549 140.599 26.894 128.118 1.00 0.00 H ATOM 59875 H2 WAT 2549 141.005 26.295 129.447 1.00 0.00 H TER 59877 WAT 2549 ATOM 59877 O WAT 2550 130.848 96.136 135.096 1.00 0.00 O ATOM 59878 H1 WAT 2550 130.404 95.442 135.583 1.00 0.00 H ATOM 59879 H2 WAT 2550 130.476 96.947 135.442 1.00 0.00 H TER 59881 WAT 2550 ATOM 59881 O WAT 2551 53.061 70.362 149.594 1.00 0.00 O ATOM 59882 H1 WAT 2551 53.627 70.956 149.102 1.00 0.00 H ATOM 59883 H2 WAT 2551 52.980 70.767 150.457 1.00 0.00 H TER 59885 WAT 2551 ATOM 59885 O WAT 2552 113.816 98.650 75.535 1.00 0.00 O ATOM 59886 H1 WAT 2552 114.537 98.671 76.164 1.00 0.00 H ATOM 59887 H2 WAT 2552 113.440 99.530 75.573 1.00 0.00 H TER 59889 WAT 2552 ATOM 59889 O WAT 2553 4.842 34.482 129.741 1.00 0.00 O ATOM 59890 H1 WAT 2553 4.093 33.902 129.880 1.00 0.00 H ATOM 59891 H2 WAT 2553 4.846 34.646 128.798 1.00 0.00 H TER 59893 WAT 2553 ATOM 59893 O WAT 2554 42.828 4.057 91.227 1.00 0.00 O ATOM 59894 H1 WAT 2554 42.260 4.285 90.492 1.00 0.00 H ATOM 59895 H2 WAT 2554 43.703 4.324 90.946 1.00 0.00 H TER 59897 WAT 2554 ATOM 59897 O WAT 2555 144.352 24.687 12.289 1.00 0.00 O ATOM 59898 H1 WAT 2555 143.860 25.486 12.477 1.00 0.00 H ATOM 59899 H2 WAT 2555 144.538 24.312 13.150 1.00 0.00 H TER 59901 WAT 2555 ATOM 59901 O WAT 2556 74.253 95.456 138.203 1.00 0.00 O ATOM 59902 H1 WAT 2556 74.579 95.068 137.391 1.00 0.00 H ATOM 59903 H2 WAT 2556 73.361 95.735 137.994 1.00 0.00 H TER 59905 WAT 2556 ATOM 59905 O WAT 2557 3.797 130.302 156.096 1.00 0.00 O ATOM 59906 H1 WAT 2557 3.254 129.668 155.627 1.00 0.00 H ATOM 59907 H2 WAT 2557 4.663 129.897 156.129 1.00 0.00 H TER 59909 WAT 2557 ATOM 59909 O WAT 2558 80.450 133.430 151.742 1.00 0.00 O ATOM 59910 H1 WAT 2558 80.439 133.834 150.874 1.00 0.00 H ATOM 59911 H2 WAT 2558 80.422 134.169 152.350 1.00 0.00 H TER 59913 WAT 2558 ATOM 59913 O WAT 2559 68.784 143.997 55.234 1.00 0.00 O ATOM 59914 H1 WAT 2559 68.419 144.737 55.719 1.00 0.00 H ATOM 59915 H2 WAT 2559 69.440 143.624 55.824 1.00 0.00 H TER 59917 WAT 2559 ATOM 59917 O WAT 2560 57.188 11.991 105.806 1.00 0.00 O ATOM 59918 H1 WAT 2560 58.129 11.815 105.805 1.00 0.00 H ATOM 59919 H2 WAT 2560 56.793 11.187 105.467 1.00 0.00 H TER 59921 WAT 2560 ATOM 59921 O WAT 2561 28.012 94.815 145.436 1.00 0.00 O ATOM 59922 H1 WAT 2561 28.060 95.753 145.254 1.00 0.00 H ATOM 59923 H2 WAT 2561 27.231 94.519 144.968 1.00 0.00 H TER 59925 WAT 2561 ATOM 59925 O WAT 2562 15.269 123.175 129.319 1.00 0.00 O ATOM 59926 H1 WAT 2562 15.192 124.113 129.494 1.00 0.00 H ATOM 59927 H2 WAT 2562 14.965 123.074 128.417 1.00 0.00 H TER 59929 WAT 2562 ATOM 59929 O WAT 2563 133.923 63.341 149.942 1.00 0.00 O ATOM 59930 H1 WAT 2563 133.357 63.539 150.688 1.00 0.00 H ATOM 59931 H2 WAT 2563 134.563 62.718 150.285 1.00 0.00 H TER 59933 WAT 2563 ATOM 59933 O WAT 2564 119.694 6.477 105.305 1.00 0.00 O ATOM 59934 H1 WAT 2564 118.761 6.283 105.399 1.00 0.00 H ATOM 59935 H2 WAT 2564 120.131 5.814 105.839 1.00 0.00 H TER 59937 WAT 2564 ATOM 59937 O WAT 2565 102.369 144.478 96.304 1.00 0.00 O ATOM 59938 H1 WAT 2565 103.180 143.988 96.438 1.00 0.00 H ATOM 59939 H2 WAT 2565 102.287 144.551 95.353 1.00 0.00 H TER 59941 WAT 2565 ATOM 59941 O WAT 2566 119.584 16.508 105.727 1.00 0.00 O ATOM 59942 H1 WAT 2566 119.762 15.697 106.203 1.00 0.00 H ATOM 59943 H2 WAT 2566 118.788 16.323 105.228 1.00 0.00 H TER 59945 WAT 2566 ATOM 59945 O WAT 2567 114.110 1.771 109.183 1.00 0.00 O ATOM 59946 H1 WAT 2567 113.643 2.365 109.771 1.00 0.00 H ATOM 59947 H2 WAT 2567 114.102 2.216 108.336 1.00 0.00 H TER 59949 WAT 2567 ATOM 59949 O WAT 2568 47.776 71.238 89.441 1.00 0.00 O ATOM 59950 H1 WAT 2568 48.057 71.852 90.120 1.00 0.00 H ATOM 59951 H2 WAT 2568 48.118 70.391 89.728 1.00 0.00 H TER 59953 WAT 2568 ATOM 59953 O WAT 2569 50.386 112.462 113.232 1.00 0.00 O ATOM 59954 H1 WAT 2569 49.673 112.067 113.733 1.00 0.00 H ATOM 59955 H2 WAT 2569 51.073 112.624 113.878 1.00 0.00 H TER 59957 WAT 2569 ATOM 59957 O WAT 2570 74.439 24.541 157.404 1.00 0.00 O ATOM 59958 H1 WAT 2570 73.789 24.750 156.734 1.00 0.00 H ATOM 59959 H2 WAT 2570 74.174 23.684 157.736 1.00 0.00 H TER 59961 WAT 2570 ATOM 59961 O WAT 2571 2.936 12.971 129.717 1.00 0.00 O ATOM 59962 H1 WAT 2571 2.180 13.265 130.224 1.00 0.00 H ATOM 59963 H2 WAT 2571 2.567 12.681 128.882 1.00 0.00 H TER 59965 WAT 2571 ATOM 59965 O WAT 2572 53.665 14.322 89.274 1.00 0.00 O ATOM 59966 H1 WAT 2572 54.559 14.332 89.613 1.00 0.00 H ATOM 59967 H2 WAT 2572 53.511 13.410 89.029 1.00 0.00 H TER 59969 WAT 2572 ATOM 59969 O WAT 2573 104.179 138.706 121.936 1.00 0.00 O ATOM 59970 H1 WAT 2573 103.642 139.493 122.033 1.00 0.00 H ATOM 59971 H2 WAT 2573 104.824 138.937 121.267 1.00 0.00 H TER 59973 WAT 2573 ATOM 59973 O WAT 2574 72.726 59.327 79.257 1.00 0.00 O ATOM 59974 H1 WAT 2574 71.998 59.234 78.643 1.00 0.00 H ATOM 59975 H2 WAT 2574 73.470 59.577 78.710 1.00 0.00 H TER 59977 WAT 2574 ATOM 59977 O WAT 2575 24.187 48.941 93.891 1.00 0.00 O ATOM 59978 H1 WAT 2575 24.506 48.094 93.580 1.00 0.00 H ATOM 59979 H2 WAT 2575 23.270 48.784 94.116 1.00 0.00 H TER 59981 WAT 2575 ATOM 59981 O WAT 2576 10.607 143.217 10.419 1.00 0.00 O ATOM 59982 H1 WAT 2576 10.099 143.586 11.142 1.00 0.00 H ATOM 59983 H2 WAT 2576 10.970 143.979 9.968 1.00 0.00 H TER 59985 WAT 2576 ATOM 59985 O WAT 2577 28.841 100.466 7.311 1.00 0.00 O ATOM 59986 H1 WAT 2577 28.133 101.110 7.320 1.00 0.00 H ATOM 59987 H2 WAT 2577 28.761 100.012 8.150 1.00 0.00 H TER 59989 WAT 2577 ATOM 59989 O WAT 2578 25.484 54.695 93.978 1.00 0.00 O ATOM 59990 H1 WAT 2578 24.944 53.955 94.256 1.00 0.00 H ATOM 59991 H2 WAT 2578 26.383 54.369 94.031 1.00 0.00 H TER 59993 WAT 2578 ATOM 59993 O WAT 2579 16.450 2.990 75.310 1.00 0.00 O ATOM 59994 H1 WAT 2579 16.656 3.685 75.935 1.00 0.00 H ATOM 59995 H2 WAT 2579 16.776 2.191 75.724 1.00 0.00 H TER 59997 WAT 2579 ATOM 59997 O WAT 2580 120.165 12.599 7.500 1.00 0.00 O ATOM 59998 H1 WAT 2580 120.208 13.064 8.335 1.00 0.00 H ATOM 59999 H2 WAT 2580 119.382 12.054 7.569 1.00 0.00 H TER 60001 WAT 2580 ATOM 60001 O WAT 2581 19.049 117.103 130.700 1.00 0.00 O ATOM 60002 H1 WAT 2581 18.948 116.402 130.056 1.00 0.00 H ATOM 60003 H2 WAT 2581 19.553 116.705 131.409 1.00 0.00 H TER 60005 WAT 2581 ATOM 60005 O WAT 2582 117.149 81.745 74.149 1.00 0.00 O ATOM 60006 H1 WAT 2582 117.493 82.573 73.811 1.00 0.00 H ATOM 60007 H2 WAT 2582 116.422 82.002 74.716 1.00 0.00 H TER 60009 WAT 2582 ATOM 60009 O WAT 2583 23.694 61.592 21.651 1.00 0.00 O ATOM 60010 H1 WAT 2583 24.050 62.409 22.002 1.00 0.00 H ATOM 60011 H2 WAT 2583 24.264 60.911 22.007 1.00 0.00 H TER 60013 WAT 2583 ATOM 60013 O WAT 2584 39.373 129.243 126.723 1.00 0.00 O ATOM 60014 H1 WAT 2584 38.871 129.530 127.486 1.00 0.00 H ATOM 60015 H2 WAT 2584 39.249 129.939 126.078 1.00 0.00 H TER 60017 WAT 2584 ATOM 60017 O WAT 2585 56.634 8.239 57.004 1.00 0.00 O ATOM 60018 H1 WAT 2585 55.761 8.104 57.372 1.00 0.00 H ATOM 60019 H2 WAT 2585 56.778 7.476 56.443 1.00 0.00 H TER 60021 WAT 2585 ATOM 60021 O WAT 2586 111.608 70.149 15.943 1.00 0.00 O ATOM 60022 H1 WAT 2586 111.324 70.325 15.045 1.00 0.00 H ATOM 60023 H2 WAT 2586 112.363 70.723 16.071 1.00 0.00 H TER 60025 WAT 2586 ATOM 60025 O WAT 2587 47.687 105.853 132.308 1.00 0.00 O ATOM 60026 H1 WAT 2587 47.745 104.987 132.710 1.00 0.00 H ATOM 60027 H2 WAT 2587 46.748 106.021 132.234 1.00 0.00 H TER 60029 WAT 2587 ATOM 60029 O WAT 2588 59.876 19.944 101.600 1.00 0.00 O ATOM 60030 H1 WAT 2588 60.469 19.241 101.864 1.00 0.00 H ATOM 60031 H2 WAT 2588 59.961 19.984 100.647 1.00 0.00 H TER 60033 WAT 2588 ATOM 60033 O WAT 2589 59.625 0.325 67.525 1.00 0.00 O ATOM 60034 H1 WAT 2589 58.816 0.807 67.352 1.00 0.00 H ATOM 60035 H2 WAT 2589 59.913 0.022 66.664 1.00 0.00 H TER 60037 WAT 2589 ATOM 60037 O WAT 2590 66.100 104.405 62.560 1.00 0.00 O ATOM 60038 H1 WAT 2590 66.607 104.937 61.947 1.00 0.00 H ATOM 60039 H2 WAT 2590 65.288 104.209 62.093 1.00 0.00 H TER 60041 WAT 2590 ATOM 60041 O WAT 2591 57.166 143.906 88.082 1.00 0.00 O ATOM 60042 H1 WAT 2591 56.940 143.545 88.939 1.00 0.00 H ATOM 60043 H2 WAT 2591 56.415 144.449 87.844 1.00 0.00 H TER 60045 WAT 2591 ATOM 60045 O WAT 2592 55.502 48.505 17.357 1.00 0.00 O ATOM 60046 H1 WAT 2592 55.727 47.627 17.047 1.00 0.00 H ATOM 60047 H2 WAT 2592 55.481 49.040 16.564 1.00 0.00 H TER 60049 WAT 2592 ATOM 60049 O WAT 2593 125.643 29.097 140.313 1.00 0.00 O ATOM 60050 H1 WAT 2593 125.411 29.592 139.527 1.00 0.00 H ATOM 60051 H2 WAT 2593 124.803 28.809 140.671 1.00 0.00 H TER 60053 WAT 2593 ATOM 60053 O WAT 2594 118.127 21.649 98.039 1.00 0.00 O ATOM 60054 H1 WAT 2594 119.079 21.574 97.975 1.00 0.00 H ATOM 60055 H2 WAT 2594 117.842 21.843 97.146 1.00 0.00 H TER 60057 WAT 2594 ATOM 60057 O WAT 2595 138.175 69.877 141.245 1.00 0.00 O ATOM 60058 H1 WAT 2595 138.193 70.660 141.794 1.00 0.00 H ATOM 60059 H2 WAT 2595 137.571 69.284 141.694 1.00 0.00 H TER 60061 WAT 2595 ATOM 60061 O WAT 2596 86.898 53.699 122.280 1.00 0.00 O ATOM 60062 H1 WAT 2596 87.800 53.552 122.565 1.00 0.00 H ATOM 60063 H2 WAT 2596 86.427 53.921 123.082 1.00 0.00 H TER 60065 WAT 2596 ATOM 60065 O WAT 2597 120.051 13.058 150.694 1.00 0.00 O ATOM 60066 H1 WAT 2597 119.633 13.781 151.162 1.00 0.00 H ATOM 60067 H2 WAT 2597 120.866 12.902 151.172 1.00 0.00 H TER 60069 WAT 2597 ATOM 60069 O WAT 2598 46.907 37.295 154.445 1.00 0.00 O ATOM 60070 H1 WAT 2598 46.475 36.454 154.298 1.00 0.00 H ATOM 60071 H2 WAT 2598 47.764 37.201 154.031 1.00 0.00 H TER 60073 WAT 2598 ATOM 60073 O WAT 2599 116.298 3.058 112.274 1.00 0.00 O ATOM 60074 H1 WAT 2599 115.388 2.767 112.213 1.00 0.00 H ATOM 60075 H2 WAT 2599 116.333 3.849 111.736 1.00 0.00 H TER 60077 WAT 2599 ATOM 60077 O WAT 2600 124.447 109.522 65.906 1.00 0.00 O ATOM 60078 H1 WAT 2600 124.208 109.051 65.107 1.00 0.00 H ATOM 60079 H2 WAT 2600 123.775 109.273 66.540 1.00 0.00 H TER 60081 WAT 2600 ATOM 60081 O WAT 2601 143.774 45.318 10.246 1.00 0.00 O ATOM 60082 H1 WAT 2601 144.678 45.492 10.509 1.00 0.00 H ATOM 60083 H2 WAT 2601 143.507 44.572 10.784 1.00 0.00 H TER 60085 WAT 2601 ATOM 60085 O WAT 2602 122.260 72.566 97.004 1.00 0.00 O ATOM 60086 H1 WAT 2602 122.312 71.619 97.133 1.00 0.00 H ATOM 60087 H2 WAT 2602 121.466 72.693 96.483 1.00 0.00 H TER 60089 WAT 2602 ATOM 60089 O WAT 2603 3.062 10.844 75.754 1.00 0.00 O ATOM 60090 H1 WAT 2603 2.235 10.402 75.948 1.00 0.00 H ATOM 60091 H2 WAT 2603 2.838 11.490 75.085 1.00 0.00 H TER 60093 WAT 2603 ATOM 60093 O WAT 2604 87.474 53.829 75.640 1.00 0.00 O ATOM 60094 H1 WAT 2604 87.642 54.720 75.335 1.00 0.00 H ATOM 60095 H2 WAT 2604 86.830 53.934 76.341 1.00 0.00 H TER 60097 WAT 2604 ATOM 60097 O WAT 2605 136.604 142.145 8.886 1.00 0.00 O ATOM 60098 H1 WAT 2605 136.479 141.880 9.798 1.00 0.00 H ATOM 60099 H2 WAT 2605 136.988 143.020 8.941 1.00 0.00 H TER 60101 WAT 2605 ATOM 60101 O WAT 2606 96.508 42.518 68.864 1.00 0.00 O ATOM 60102 H1 WAT 2606 96.807 42.920 68.048 1.00 0.00 H ATOM 60103 H2 WAT 2606 95.873 41.858 68.586 1.00 0.00 H TER 60105 WAT 2606 ATOM 60105 O WAT 2607 28.147 16.957 16.316 1.00 0.00 O ATOM 60106 H1 WAT 2607 28.270 17.574 15.594 1.00 0.00 H ATOM 60107 H2 WAT 2607 29.017 16.872 16.707 1.00 0.00 H TER 60109 WAT 2607 ATOM 60109 O WAT 2608 43.922 122.906 73.628 1.00 0.00 O ATOM 60110 H1 WAT 2608 43.810 121.994 73.897 1.00 0.00 H ATOM 60111 H2 WAT 2608 44.822 123.119 73.874 1.00 0.00 H TER 60113 WAT 2608 ATOM 60113 O WAT 2609 139.357 74.013 69.331 1.00 0.00 O ATOM 60114 H1 WAT 2609 139.242 74.071 68.382 1.00 0.00 H ATOM 60115 H2 WAT 2609 138.720 73.354 69.609 1.00 0.00 H TER 60117 WAT 2609 ATOM 60117 O WAT 2610 61.260 9.398 18.961 1.00 0.00 O ATOM 60118 H1 WAT 2610 61.410 9.417 19.906 1.00 0.00 H ATOM 60119 H2 WAT 2610 62.110 9.166 18.588 1.00 0.00 H TER 60121 WAT 2610 ATOM 60121 O WAT 2611 76.945 108.601 135.947 1.00 0.00 O ATOM 60122 H1 WAT 2611 77.674 107.986 135.870 1.00 0.00 H ATOM 60123 H2 WAT 2611 76.666 108.756 135.044 1.00 0.00 H TER 60125 WAT 2611 ATOM 60125 O WAT 2612 14.774 68.196 71.638 1.00 0.00 O ATOM 60126 H1 WAT 2612 15.426 67.886 71.010 1.00 0.00 H ATOM 60127 H2 WAT 2612 14.019 67.624 71.502 1.00 0.00 H TER 60129 WAT 2612 ATOM 60129 O WAT 2613 62.144 26.628 134.048 1.00 0.00 O ATOM 60130 H1 WAT 2613 63.054 26.365 134.192 1.00 0.00 H ATOM 60131 H2 WAT 2613 62.067 26.714 133.098 1.00 0.00 H TER 60133 WAT 2613 ATOM 60133 O WAT 2614 34.801 89.936 145.096 1.00 0.00 O ATOM 60134 H1 WAT 2614 34.223 89.698 145.821 1.00 0.00 H ATOM 60135 H2 WAT 2614 35.557 90.345 145.518 1.00 0.00 H TER 60137 WAT 2614 ATOM 60137 O WAT 2615 95.834 74.854 61.545 1.00 0.00 O ATOM 60138 H1 WAT 2615 95.379 75.694 61.473 1.00 0.00 H ATOM 60139 H2 WAT 2615 96.691 75.012 61.149 1.00 0.00 H TER 60141 WAT 2615 ATOM 60141 O WAT 2616 38.580 68.728 149.195 1.00 0.00 O ATOM 60142 H1 WAT 2616 38.799 68.239 148.401 1.00 0.00 H ATOM 60143 H2 WAT 2616 39.427 69.001 149.549 1.00 0.00 H TER 60145 WAT 2616 ATOM 60145 O WAT 2617 21.049 136.449 6.637 1.00 0.00 O ATOM 60146 H1 WAT 2617 20.536 136.875 5.950 1.00 0.00 H ATOM 60147 H2 WAT 2617 21.883 136.918 6.638 1.00 0.00 H TER 60149 WAT 2617 ATOM 60149 O WAT 2618 24.390 95.674 74.845 1.00 0.00 O ATOM 60150 H1 WAT 2618 24.332 94.905 75.413 1.00 0.00 H ATOM 60151 H2 WAT 2618 24.518 95.315 73.967 1.00 0.00 H TER 60153 WAT 2618 ATOM 60153 O WAT 2619 128.680 62.701 148.385 1.00 0.00 O ATOM 60154 H1 WAT 2619 129.428 63.256 148.162 1.00 0.00 H ATOM 60155 H2 WAT 2619 129.072 61.880 148.683 1.00 0.00 H TER 60157 WAT 2619 ATOM 60157 O WAT 2620 23.729 8.649 115.060 1.00 0.00 O ATOM 60158 H1 WAT 2620 23.023 8.265 115.580 1.00 0.00 H ATOM 60159 H2 WAT 2620 23.450 8.530 114.152 1.00 0.00 H TER 60161 WAT 2620 ATOM 60161 O WAT 2621 38.136 95.305 119.394 1.00 0.00 O ATOM 60162 H1 WAT 2621 37.195 95.477 119.369 1.00 0.00 H ATOM 60163 H2 WAT 2621 38.203 94.352 119.454 1.00 0.00 H TER 60165 WAT 2621 ATOM 60165 O WAT 2622 36.214 119.043 125.429 1.00 0.00 O ATOM 60166 H1 WAT 2622 36.783 119.790 125.239 1.00 0.00 H ATOM 60167 H2 WAT 2622 36.685 118.547 126.098 1.00 0.00 H TER 60169 WAT 2622 ATOM 60169 O WAT 2623 18.571 70.004 7.100 1.00 0.00 O ATOM 60170 H1 WAT 2623 18.580 69.889 6.150 1.00 0.00 H ATOM 60171 H2 WAT 2623 17.643 70.031 7.330 1.00 0.00 H TER 60173 WAT 2623 ATOM 60173 O WAT 2624 40.834 51.653 123.908 1.00 0.00 O ATOM 60174 H1 WAT 2624 40.170 51.003 123.678 1.00 0.00 H ATOM 60175 H2 WAT 2624 41.233 51.313 124.709 1.00 0.00 H TER 60177 WAT 2624 ATOM 60177 O WAT 2625 80.481 94.920 13.398 1.00 0.00 O ATOM 60178 H1 WAT 2625 80.774 94.950 14.309 1.00 0.00 H ATOM 60179 H2 WAT 2625 79.900 95.676 13.309 1.00 0.00 H TER 60181 WAT 2625 ATOM 60181 O WAT 2626 137.855 134.597 4.343 1.00 0.00 O ATOM 60182 H1 WAT 2626 138.399 133.829 4.170 1.00 0.00 H ATOM 60183 H2 WAT 2626 137.490 134.441 5.214 1.00 0.00 H TER 60185 WAT 2626 ATOM 60185 O WAT 2627 114.760 141.563 69.279 1.00 0.00 O ATOM 60186 H1 WAT 2627 114.418 140.743 68.923 1.00 0.00 H ATOM 60187 H2 WAT 2627 115.683 141.567 69.026 1.00 0.00 H TER 60189 WAT 2627 ATOM 60189 O WAT 2628 70.104 96.229 88.509 1.00 0.00 O ATOM 60190 H1 WAT 2628 69.947 97.095 88.885 1.00 0.00 H ATOM 60191 H2 WAT 2628 70.845 95.883 89.006 1.00 0.00 H TER 60193 WAT 2628 ATOM 60193 O WAT 2629 46.300 12.644 86.572 1.00 0.00 O ATOM 60194 H1 WAT 2629 47.021 12.900 85.998 1.00 0.00 H ATOM 60195 H2 WAT 2629 45.578 13.221 86.323 1.00 0.00 H TER 60197 WAT 2629 ATOM 60197 O WAT 2630 96.001 9.887 60.601 1.00 0.00 O ATOM 60198 H1 WAT 2630 95.914 10.006 59.655 1.00 0.00 H ATOM 60199 H2 WAT 2630 96.880 9.527 60.717 1.00 0.00 H TER 60201 WAT 2630 ATOM 60201 O WAT 2631 30.098 80.738 157.220 1.00 0.00 O ATOM 60202 H1 WAT 2631 29.851 81.662 157.244 1.00 0.00 H ATOM 60203 H2 WAT 2631 30.632 80.612 158.004 1.00 0.00 H TER 60205 WAT 2631 ATOM 60205 O WAT 2632 46.268 82.925 118.401 1.00 0.00 O ATOM 60206 H1 WAT 2632 45.516 82.613 117.897 1.00 0.00 H ATOM 60207 H2 WAT 2632 47.029 82.579 117.935 1.00 0.00 H TER 60209 WAT 2632 ATOM 60209 O WAT 2633 46.402 61.687 77.536 1.00 0.00 O ATOM 60210 H1 WAT 2633 47.269 61.453 77.866 1.00 0.00 H ATOM 60211 H2 WAT 2633 46.023 62.233 78.225 1.00 0.00 H TER 60213 WAT 2633 ATOM 60213 O WAT 2634 112.227 123.975 139.273 1.00 0.00 O ATOM 60214 H1 WAT 2634 111.766 124.443 138.577 1.00 0.00 H ATOM 60215 H2 WAT 2634 112.293 123.075 138.954 1.00 0.00 H TER 60217 WAT 2634 ATOM 60217 O WAT 2635 117.130 142.569 74.761 1.00 0.00 O ATOM 60218 H1 WAT 2635 117.997 142.170 74.689 1.00 0.00 H ATOM 60219 H2 WAT 2635 117.027 143.065 73.949 1.00 0.00 H TER 60221 WAT 2635 ATOM 60221 O WAT 2636 17.689 89.597 79.576 1.00 0.00 O ATOM 60222 H1 WAT 2636 18.026 90.116 80.305 1.00 0.00 H ATOM 60223 H2 WAT 2636 18.356 88.925 79.431 1.00 0.00 H TER 60225 WAT 2636 ATOM 60225 O WAT 2637 4.306 55.718 154.359 1.00 0.00 O ATOM 60226 H1 WAT 2637 3.800 56.243 153.739 1.00 0.00 H ATOM 60227 H2 WAT 2637 5.157 56.153 154.404 1.00 0.00 H TER 60229 WAT 2637 ATOM 60229 O WAT 2638 50.363 63.229 86.593 1.00 0.00 O ATOM 60230 H1 WAT 2638 51.080 62.828 86.102 1.00 0.00 H ATOM 60231 H2 WAT 2638 50.548 63.012 87.507 1.00 0.00 H TER 60233 WAT 2638 ATOM 60233 O WAT 2639 73.542 92.220 112.019 1.00 0.00 O ATOM 60234 H1 WAT 2639 74.323 91.688 111.862 1.00 0.00 H ATOM 60235 H2 WAT 2639 73.670 92.582 112.895 1.00 0.00 H TER 60237 WAT 2639 ATOM 60237 O WAT 2640 103.089 124.123 21.149 1.00 0.00 O ATOM 60238 H1 WAT 2640 102.528 124.762 20.709 1.00 0.00 H ATOM 60239 H2 WAT 2640 102.981 124.309 22.081 1.00 0.00 H TER 60241 WAT 2640 ATOM 60241 O WAT 2641 105.456 8.422 133.083 1.00 0.00 O ATOM 60242 H1 WAT 2641 106.351 8.423 132.743 1.00 0.00 H ATOM 60243 H2 WAT 2641 105.415 7.647 133.644 1.00 0.00 H TER 60245 WAT 2641 ATOM 60245 O WAT 2642 36.330 82.257 93.772 1.00 0.00 O ATOM 60246 H1 WAT 2642 36.622 82.995 94.309 1.00 0.00 H ATOM 60247 H2 WAT 2642 35.853 82.662 93.048 1.00 0.00 H TER 60249 WAT 2642 ATOM 60249 O WAT 2643 111.074 56.491 95.337 1.00 0.00 O ATOM 60250 H1 WAT 2643 111.564 55.669 95.342 1.00 0.00 H ATOM 60251 H2 WAT 2643 111.233 56.859 94.468 1.00 0.00 H TER 60253 WAT 2643 ATOM 60253 O WAT 2644 17.384 116.325 14.751 1.00 0.00 O ATOM 60254 H1 WAT 2644 16.684 116.610 15.339 1.00 0.00 H ATOM 60255 H2 WAT 2644 17.922 117.107 14.624 1.00 0.00 H TER 60257 WAT 2644 ATOM 60257 O WAT 2645 82.219 51.903 146.553 1.00 0.00 O ATOM 60258 H1 WAT 2645 81.945 51.497 147.375 1.00 0.00 H ATOM 60259 H2 WAT 2645 83.056 51.488 146.348 1.00 0.00 H TER 60261 WAT 2645 ATOM 60261 O WAT 2646 133.444 40.824 148.067 1.00 0.00 O ATOM 60262 H1 WAT 2646 133.107 41.630 147.678 1.00 0.00 H ATOM 60263 H2 WAT 2646 133.349 40.954 149.011 1.00 0.00 H TER 60265 WAT 2646 ATOM 60265 O WAT 2647 83.455 2.871 108.929 1.00 0.00 O ATOM 60266 H1 WAT 2647 83.608 2.526 109.808 1.00 0.00 H ATOM 60267 H2 WAT 2647 84.044 2.367 108.368 1.00 0.00 H TER 60269 WAT 2647 ATOM 60269 O WAT 2648 63.127 42.454 9.203 1.00 0.00 O ATOM 60270 H1 WAT 2648 62.652 42.540 10.029 1.00 0.00 H ATOM 60271 H2 WAT 2648 63.816 43.116 9.252 1.00 0.00 H TER 60273 WAT 2648 ATOM 60273 O WAT 2649 111.374 103.019 149.642 1.00 0.00 O ATOM 60274 H1 WAT 2649 110.612 103.226 150.183 1.00 0.00 H ATOM 60275 H2 WAT 2649 112.123 103.149 150.225 1.00 0.00 H TER 60277 WAT 2649 ATOM 60277 O WAT 2650 35.875 141.780 133.316 1.00 0.00 O ATOM 60278 H1 WAT 2650 35.257 142.199 132.718 1.00 0.00 H ATOM 60279 H2 WAT 2650 36.735 142.071 133.014 1.00 0.00 H TER 60281 WAT 2650 ATOM 60281 O WAT 2651 17.902 93.647 113.359 1.00 0.00 O ATOM 60282 H1 WAT 2651 17.253 93.178 113.884 1.00 0.00 H ATOM 60283 H2 WAT 2651 17.404 94.002 112.623 1.00 0.00 H TER 60285 WAT 2651 ATOM 60285 O WAT 2652 29.802 89.018 80.155 1.00 0.00 O ATOM 60286 H1 WAT 2652 29.617 88.084 80.063 1.00 0.00 H ATOM 60287 H2 WAT 2652 29.938 89.144 81.094 1.00 0.00 H TER 60289 WAT 2652 ATOM 60289 O WAT 2653 125.287 140.114 104.140 1.00 0.00 O ATOM 60290 H1 WAT 2653 125.061 139.199 103.975 1.00 0.00 H ATOM 60291 H2 WAT 2653 124.948 140.585 103.379 1.00 0.00 H TER 60293 WAT 2653 ATOM 60293 O WAT 2654 145.323 38.807 86.572 1.00 0.00 O ATOM 60294 H1 WAT 2654 145.014 39.499 87.157 1.00 0.00 H ATOM 60295 H2 WAT 2654 144.767 38.055 86.777 1.00 0.00 H TER 60297 WAT 2654 ATOM 60297 O WAT 2655 4.510 21.238 91.686 1.00 0.00 O ATOM 60298 H1 WAT 2655 4.034 20.445 91.439 1.00 0.00 H ATOM 60299 H2 WAT 2655 4.210 21.430 92.574 1.00 0.00 H TER 60301 WAT 2655 ATOM 60301 O WAT 2656 48.644 16.999 130.352 1.00 0.00 O ATOM 60302 H1 WAT 2656 48.130 16.193 130.298 1.00 0.00 H ATOM 60303 H2 WAT 2656 48.062 17.677 130.006 1.00 0.00 H TER 60305 WAT 2656 ATOM 60305 O WAT 2657 121.395 104.443 126.825 1.00 0.00 O ATOM 60306 H1 WAT 2657 121.877 104.322 126.007 1.00 0.00 H ATOM 60307 H2 WAT 2657 121.929 104.002 127.485 1.00 0.00 H TER 60309 WAT 2657 ATOM 60309 O WAT 2658 50.396 21.789 113.082 1.00 0.00 O ATOM 60310 H1 WAT 2658 49.602 22.103 112.648 1.00 0.00 H ATOM 60311 H2 WAT 2658 50.941 21.453 112.371 1.00 0.00 H TER 60313 WAT 2658 ATOM 60313 O WAT 2659 24.875 102.022 144.239 1.00 0.00 O ATOM 60314 H1 WAT 2659 24.121 101.835 143.680 1.00 0.00 H ATOM 60315 H2 WAT 2659 24.756 101.453 145.000 1.00 0.00 H TER 60317 WAT 2659 ATOM 60317 O WAT 2660 58.474 120.786 12.416 1.00 0.00 O ATOM 60318 H1 WAT 2660 59.076 120.063 12.592 1.00 0.00 H ATOM 60319 H2 WAT 2660 57.730 120.376 11.974 1.00 0.00 H TER 60321 WAT 2660 ATOM 60321 O WAT 2661 7.971 20.860 11.452 1.00 0.00 O ATOM 60322 H1 WAT 2661 7.466 21.547 11.017 1.00 0.00 H ATOM 60323 H2 WAT 2661 7.363 20.480 12.085 1.00 0.00 H TER 60325 WAT 2661 ATOM 60325 O WAT 2662 55.731 33.923 18.068 1.00 0.00 O ATOM 60326 H1 WAT 2662 55.232 33.951 17.252 1.00 0.00 H ATOM 60327 H2 WAT 2662 55.116 33.576 18.714 1.00 0.00 H TER 60329 WAT 2662 ATOM 60329 O WAT 2663 131.432 110.471 145.279 1.00 0.00 O ATOM 60330 H1 WAT 2663 130.843 111.082 144.835 1.00 0.00 H ATOM 60331 H2 WAT 2663 130.882 109.716 145.487 1.00 0.00 H TER 60333 WAT 2663 ATOM 60333 O WAT 2664 45.864 85.429 9.586 1.00 0.00 O ATOM 60334 H1 WAT 2664 45.486 85.997 10.258 1.00 0.00 H ATOM 60335 H2 WAT 2664 45.978 86.000 8.827 1.00 0.00 H TER 60337 WAT 2664 ATOM 60337 O WAT 2665 101.019 45.741 100.801 1.00 0.00 O ATOM 60338 H1 WAT 2665 100.453 46.392 100.387 1.00 0.00 H ATOM 60339 H2 WAT 2665 101.026 45.984 101.727 1.00 0.00 H TER 60341 WAT 2665 ATOM 60341 O WAT 2666 97.475 124.441 134.628 1.00 0.00 O ATOM 60342 H1 WAT 2666 96.993 125.265 134.560 1.00 0.00 H ATOM 60343 H2 WAT 2666 97.743 124.396 135.546 1.00 0.00 H TER 60345 WAT 2666 ATOM 60345 O WAT 2667 32.686 82.330 104.577 1.00 0.00 O ATOM 60346 H1 WAT 2667 32.764 81.543 104.038 1.00 0.00 H ATOM 60347 H2 WAT 2667 32.444 83.020 103.960 1.00 0.00 H TER 60349 WAT 2667 ATOM 60349 O WAT 2668 145.097 41.171 7.195 1.00 0.00 O ATOM 60350 H1 WAT 2668 144.148 41.231 7.304 1.00 0.00 H ATOM 60351 H2 WAT 2668 145.414 42.056 7.374 1.00 0.00 H TER 60353 WAT 2668 ATOM 60353 O WAT 2669 35.215 130.023 57.560 1.00 0.00 O ATOM 60354 H1 WAT 2669 35.597 129.300 58.056 1.00 0.00 H ATOM 60355 H2 WAT 2669 35.433 129.831 56.648 1.00 0.00 H TER 60357 WAT 2669 ATOM 60357 O WAT 2670 57.798 18.826 57.670 1.00 0.00 O ATOM 60358 H1 WAT 2670 58.229 18.003 57.903 1.00 0.00 H ATOM 60359 H2 WAT 2670 58.134 19.033 56.798 1.00 0.00 H TER 60361 WAT 2670 ATOM 60361 O WAT 2671 138.275 78.793 103.208 1.00 0.00 O ATOM 60362 H1 WAT 2671 138.316 77.876 102.935 1.00 0.00 H ATOM 60363 H2 WAT 2671 139.144 78.975 103.566 1.00 0.00 H TER 60365 WAT 2671 ATOM 60365 O WAT 2672 86.592 81.986 122.803 1.00 0.00 O ATOM 60366 H1 WAT 2672 87.471 81.863 122.444 1.00 0.00 H ATOM 60367 H2 WAT 2672 86.468 82.935 122.813 1.00 0.00 H TER 60369 WAT 2672 ATOM 60369 O WAT 2673 -0.145 106.596 110.887 1.00 0.00 O ATOM 60370 H1 WAT 2673 0.782 106.442 111.069 1.00 0.00 H ATOM 60371 H2 WAT 2673 -0.442 105.793 110.458 1.00 0.00 H TER 60373 WAT 2673 ATOM 60373 O WAT 2674 42.649 94.357 68.605 1.00 0.00 O ATOM 60374 H1 WAT 2674 41.886 94.865 68.329 1.00 0.00 H ATOM 60375 H2 WAT 2674 43.326 95.013 68.771 1.00 0.00 H TER 60377 WAT 2674 ATOM 60377 O WAT 2675 49.787 99.085 152.160 1.00 0.00 O ATOM 60378 H1 WAT 2675 49.398 98.460 151.548 1.00 0.00 H ATOM 60379 H2 WAT 2675 50.725 99.051 151.973 1.00 0.00 H TER 60381 WAT 2675 ATOM 60381 O WAT 2676 7.387 77.199 55.016 1.00 0.00 O ATOM 60382 H1 WAT 2676 6.650 76.593 55.092 1.00 0.00 H ATOM 60383 H2 WAT 2676 8.064 76.698 54.562 1.00 0.00 H TER 60385 WAT 2676 ATOM 60385 O WAT 2677 58.588 144.541 114.309 1.00 0.00 O ATOM 60386 H1 WAT 2677 58.796 143.702 114.721 1.00 0.00 H ATOM 60387 H2 WAT 2677 59.437 144.971 114.201 1.00 0.00 H TER 60389 WAT 2677 ATOM 60389 O WAT 2678 5.740 72.135 94.364 1.00 0.00 O ATOM 60390 H1 WAT 2678 5.331 72.626 95.077 1.00 0.00 H ATOM 60391 H2 WAT 2678 5.730 71.226 94.662 1.00 0.00 H TER 60393 WAT 2678 ATOM 60393 O WAT 2679 131.721 29.043 68.693 1.00 0.00 O ATOM 60394 H1 WAT 2679 131.689 28.798 67.768 1.00 0.00 H ATOM 60395 H2 WAT 2679 131.725 30.000 68.687 1.00 0.00 H TER 60397 WAT 2679 ATOM 60397 O WAT 2680 140.518 37.167 90.226 1.00 0.00 O ATOM 60398 H1 WAT 2680 140.279 36.678 91.014 1.00 0.00 H ATOM 60399 H2 WAT 2680 140.854 38.001 90.554 1.00 0.00 H TER 60401 WAT 2680 ATOM 60401 O WAT 2681 55.152 66.722 152.779 1.00 0.00 O ATOM 60402 H1 WAT 2681 54.336 66.361 152.431 1.00 0.00 H ATOM 60403 H2 WAT 2681 55.558 65.991 153.244 1.00 0.00 H TER 60405 WAT 2681 ATOM 60405 O WAT 2682 56.853 114.630 12.226 1.00 0.00 O ATOM 60406 H1 WAT 2682 57.526 115.296 12.366 1.00 0.00 H ATOM 60407 H2 WAT 2682 57.029 113.968 12.895 1.00 0.00 H TER 60409 WAT 2682 ATOM 60409 O WAT 2683 91.436 52.857 130.059 1.00 0.00 O ATOM 60410 H1 WAT 2683 90.972 53.400 129.423 1.00 0.00 H ATOM 60411 H2 WAT 2683 90.820 52.156 130.270 1.00 0.00 H TER 60413 WAT 2683 ATOM 60413 O WAT 2684 135.832 51.739 133.271 1.00 0.00 O ATOM 60414 H1 WAT 2684 136.367 50.945 133.259 1.00 0.00 H ATOM 60415 H2 WAT 2684 135.084 51.532 132.711 1.00 0.00 H TER 60417 WAT 2684 ATOM 60417 O WAT 2685 87.868 141.919 14.882 1.00 0.00 O ATOM 60418 H1 WAT 2685 87.388 142.699 14.605 1.00 0.00 H ATOM 60419 H2 WAT 2685 87.207 141.368 15.302 1.00 0.00 H TER 60421 WAT 2685 ATOM 60421 O WAT 2686 99.306 17.093 65.807 1.00 0.00 O ATOM 60422 H1 WAT 2686 98.848 17.927 65.913 1.00 0.00 H ATOM 60423 H2 WAT 2686 99.018 16.566 66.552 1.00 0.00 H TER 60425 WAT 2686 ATOM 60425 O WAT 2687 91.740 26.906 122.199 1.00 0.00 O ATOM 60426 H1 WAT 2687 92.617 26.545 122.331 1.00 0.00 H ATOM 60427 H2 WAT 2687 91.686 27.064 121.257 1.00 0.00 H TER 60429 WAT 2687 ATOM 60429 O WAT 2688 101.951 43.423 153.416 1.00 0.00 O ATOM 60430 H1 WAT 2688 101.529 42.832 154.040 1.00 0.00 H ATOM 60431 H2 WAT 2688 101.354 44.169 153.352 1.00 0.00 H TER 60433 WAT 2688 ATOM 60433 O WAT 2689 96.330 73.274 -0.173 1.00 0.00 O ATOM 60434 H1 WAT 2689 95.605 72.657 -0.272 1.00 0.00 H ATOM 60435 H2 WAT 2689 96.796 72.974 0.608 1.00 0.00 H TER 60437 WAT 2689 ATOM 60437 O WAT 2690 22.694 75.318 58.179 1.00 0.00 O ATOM 60438 H1 WAT 2690 23.194 75.756 57.490 1.00 0.00 H ATOM 60439 H2 WAT 2690 22.033 75.959 58.440 1.00 0.00 H TER 60441 WAT 2690 ATOM 60441 O WAT 2691 46.909 99.414 122.761 1.00 0.00 O ATOM 60442 H1 WAT 2691 46.118 99.080 122.339 1.00 0.00 H ATOM 60443 H2 WAT 2691 46.693 100.317 122.996 1.00 0.00 H TER 60445 WAT 2691 ATOM 60445 O WAT 2692 64.985 64.785 136.018 1.00 0.00 O ATOM 60446 H1 WAT 2692 65.588 64.742 135.276 1.00 0.00 H ATOM 60447 H2 WAT 2692 64.419 64.021 135.912 1.00 0.00 H TER 60449 WAT 2692 ATOM 60449 O WAT 2693 84.152 29.821 108.767 1.00 0.00 O ATOM 60450 H1 WAT 2693 83.977 30.006 109.690 1.00 0.00 H ATOM 60451 H2 WAT 2693 83.286 29.802 108.359 1.00 0.00 H TER 60453 WAT 2693 ATOM 60453 O WAT 2694 135.453 35.674 85.440 1.00 0.00 O ATOM 60454 H1 WAT 2694 135.420 34.812 85.025 1.00 0.00 H ATOM 60455 H2 WAT 2694 136.229 35.641 85.999 1.00 0.00 H TER 60457 WAT 2694 ATOM 60457 O WAT 2695 103.052 106.507 145.711 1.00 0.00 O ATOM 60458 H1 WAT 2695 102.105 106.368 145.710 1.00 0.00 H ATOM 60459 H2 WAT 2695 103.228 106.963 144.888 1.00 0.00 H TER 60461 WAT 2695 ATOM 60461 O WAT 2696 112.091 23.896 12.019 1.00 0.00 O ATOM 60462 H1 WAT 2696 112.070 24.729 11.548 1.00 0.00 H ATOM 60463 H2 WAT 2696 112.437 24.118 12.883 1.00 0.00 H TER 60465 WAT 2696 ATOM 60465 O WAT 2697 128.270 47.142 6.501 1.00 0.00 O ATOM 60466 H1 WAT 2697 129.046 47.659 6.285 1.00 0.00 H ATOM 60467 H2 WAT 2697 127.616 47.789 6.763 1.00 0.00 H TER 60469 WAT 2697 ATOM 60469 O WAT 2698 90.604 8.913 68.954 1.00 0.00 O ATOM 60470 H1 WAT 2698 91.026 9.631 69.424 1.00 0.00 H ATOM 60471 H2 WAT 2698 89.736 9.249 68.730 1.00 0.00 H TER 60473 WAT 2698 ATOM 60473 O WAT 2699 78.527 130.699 10.814 1.00 0.00 O ATOM 60474 H1 WAT 2699 77.788 130.368 11.324 1.00 0.00 H ATOM 60475 H2 WAT 2699 78.275 130.551 9.902 1.00 0.00 H TER 60477 WAT 2699 ATOM 60477 O WAT 2700 53.463 134.523 133.613 1.00 0.00 O ATOM 60478 H1 WAT 2700 52.954 134.787 132.846 1.00 0.00 H ATOM 60479 H2 WAT 2700 54.096 133.890 133.274 1.00 0.00 H TER 60481 WAT 2700 ATOM 60481 O WAT 2701 87.735 46.054 112.467 1.00 0.00 O ATOM 60482 H1 WAT 2701 88.042 45.153 112.367 1.00 0.00 H ATOM 60483 H2 WAT 2701 86.991 45.989 113.067 1.00 0.00 H TER 60485 WAT 2701 ATOM 60485 O WAT 2702 101.485 48.860 132.605 1.00 0.00 O ATOM 60486 H1 WAT 2702 101.176 48.867 133.511 1.00 0.00 H ATOM 60487 H2 WAT 2702 102.073 48.106 132.558 1.00 0.00 H TER 60489 WAT 2702 ATOM 60489 O WAT 2703 23.099 87.844 7.382 1.00 0.00 O ATOM 60490 H1 WAT 2703 23.873 88.255 7.769 1.00 0.00 H ATOM 60491 H2 WAT 2703 23.128 86.939 7.692 1.00 0.00 H TER 60493 WAT 2703 ATOM 60493 O WAT 2704 102.461 27.861 87.393 1.00 0.00 O ATOM 60494 H1 WAT 2704 102.732 27.858 86.475 1.00 0.00 H ATOM 60495 H2 WAT 2704 103.219 27.519 87.867 1.00 0.00 H TER 60497 WAT 2704 ATOM 60497 O WAT 2705 58.302 16.216 118.733 1.00 0.00 O ATOM 60498 H1 WAT 2705 58.615 15.428 118.288 1.00 0.00 H ATOM 60499 H2 WAT 2705 58.679 16.161 119.611 1.00 0.00 H TER 60501 WAT 2705 ATOM 60501 O WAT 2706 77.307 14.965 79.127 1.00 0.00 O ATOM 60502 H1 WAT 2706 76.642 14.880 79.811 1.00 0.00 H ATOM 60503 H2 WAT 2706 76.892 15.509 78.456 1.00 0.00 H TER 60505 WAT 2706 ATOM 60505 O WAT 2707 117.282 107.910 106.866 1.00 0.00 O ATOM 60506 H1 WAT 2707 116.943 107.818 105.976 1.00 0.00 H ATOM 60507 H2 WAT 2707 116.690 107.385 107.404 1.00 0.00 H TER 60509 WAT 2707 ATOM 60509 O WAT 2708 41.316 66.505 6.818 1.00 0.00 O ATOM 60510 H1 WAT 2708 40.359 66.518 6.799 1.00 0.00 H ATOM 60511 H2 WAT 2708 41.556 65.731 6.309 1.00 0.00 H TER 60513 WAT 2708 ATOM 60513 O WAT 2709 21.786 22.375 140.864 1.00 0.00 O ATOM 60514 H1 WAT 2709 22.020 21.601 140.351 1.00 0.00 H ATOM 60515 H2 WAT 2709 22.593 22.889 140.903 1.00 0.00 H TER 60517 WAT 2709 ATOM 60517 O WAT 2710 105.566 98.872 15.085 1.00 0.00 O ATOM 60518 H1 WAT 2710 105.125 98.183 14.587 1.00 0.00 H ATOM 60519 H2 WAT 2710 104.864 99.299 15.576 1.00 0.00 H TER 60521 WAT 2710 ATOM 60521 O WAT 2711 145.182 51.396 23.592 1.00 0.00 O ATOM 60522 H1 WAT 2711 144.745 50.547 23.652 1.00 0.00 H ATOM 60523 H2 WAT 2711 144.487 52.006 23.345 1.00 0.00 H TER 60525 WAT 2711 ATOM 60525 O WAT 2712 88.485 94.865 148.763 1.00 0.00 O ATOM 60526 H1 WAT 2712 88.508 93.942 149.015 1.00 0.00 H ATOM 60527 H2 WAT 2712 89.365 95.045 148.433 1.00 0.00 H TER 60529 WAT 2712 ATOM 60529 O WAT 2713 71.532 81.988 69.630 1.00 0.00 O ATOM 60530 H1 WAT 2713 71.296 81.343 70.296 1.00 0.00 H ATOM 60531 H2 WAT 2713 70.870 81.881 68.947 1.00 0.00 H TER 60533 WAT 2713 ATOM 60533 O WAT 2714 22.819 144.540 109.397 1.00 0.00 O ATOM 60534 H1 WAT 2714 22.348 145.113 110.002 1.00 0.00 H ATOM 60535 H2 WAT 2714 22.815 143.684 109.826 1.00 0.00 H TER 60537 WAT 2714 ATOM 60537 O WAT 2715 49.681 115.075 75.184 1.00 0.00 O ATOM 60538 H1 WAT 2715 50.126 115.110 74.337 1.00 0.00 H ATOM 60539 H2 WAT 2715 50.379 115.204 75.826 1.00 0.00 H TER 60541 WAT 2715 ATOM 60541 O WAT 2716 17.224 131.166 10.604 1.00 0.00 O ATOM 60542 H1 WAT 2716 16.767 130.673 11.285 1.00 0.00 H ATOM 60543 H2 WAT 2716 16.771 130.932 9.794 1.00 0.00 H TER 60545 WAT 2716 ATOM 60545 O WAT 2717 55.207 20.936 90.304 1.00 0.00 O ATOM 60546 H1 WAT 2717 54.870 20.041 90.252 1.00 0.00 H ATOM 60547 H2 WAT 2717 55.300 21.210 89.392 1.00 0.00 H TER 60549 WAT 2717 ATOM 60549 O WAT 2718 56.759 109.130 92.583 1.00 0.00 O ATOM 60550 H1 WAT 2718 56.072 109.760 92.800 1.00 0.00 H ATOM 60551 H2 WAT 2718 56.416 108.289 92.884 1.00 0.00 H TER 60553 WAT 2718 ATOM 60553 O WAT 2719 28.988 90.961 119.633 1.00 0.00 O ATOM 60554 H1 WAT 2719 28.129 91.273 119.348 1.00 0.00 H ATOM 60555 H2 WAT 2719 28.835 90.605 120.509 1.00 0.00 H TER 60557 WAT 2719 ATOM 60557 O WAT 2720 88.694 84.753 1.822 1.00 0.00 O ATOM 60558 H1 WAT 2720 88.583 84.353 2.684 1.00 0.00 H ATOM 60559 H2 WAT 2720 88.947 84.028 1.251 1.00 0.00 H TER 60561 WAT 2720 ATOM 60561 O WAT 2721 28.656 109.796 93.183 1.00 0.00 O ATOM 60562 H1 WAT 2721 27.860 110.318 93.076 1.00 0.00 H ATOM 60563 H2 WAT 2721 28.384 108.901 92.978 1.00 0.00 H TER 60565 WAT 2721 ATOM 60565 O WAT 2722 87.935 1.486 2.760 1.00 0.00 O ATOM 60566 H1 WAT 2722 87.000 1.285 2.805 1.00 0.00 H ATOM 60567 H2 WAT 2722 87.983 2.432 2.898 1.00 0.00 H TER 60569 WAT 2722 ATOM 60569 O WAT 2723 141.122 138.922 6.998 1.00 0.00 O ATOM 60570 H1 WAT 2723 140.563 139.620 7.341 1.00 0.00 H ATOM 60571 H2 WAT 2723 140.946 138.172 7.566 1.00 0.00 H TER 60573 WAT 2723 ATOM 60573 O WAT 2724 11.203 49.119 61.895 1.00 0.00 O ATOM 60574 H1 WAT 2724 11.224 48.967 60.950 1.00 0.00 H ATOM 60575 H2 WAT 2724 11.093 50.065 61.983 1.00 0.00 H TER 60577 WAT 2724 ATOM 60577 O WAT 2725 78.537 28.478 66.797 1.00 0.00 O ATOM 60578 H1 WAT 2725 78.752 28.755 67.688 1.00 0.00 H ATOM 60579 H2 WAT 2725 78.692 27.533 66.796 1.00 0.00 H TER 60581 WAT 2725 ATOM 60581 O WAT 2726 141.692 114.992 72.002 1.00 0.00 O ATOM 60582 H1 WAT 2726 141.646 115.033 71.047 1.00 0.00 H ATOM 60583 H2 WAT 2726 142.134 115.802 72.255 1.00 0.00 H TER 60585 WAT 2726 ATOM 60585 O WAT 2727 74.735 72.652 15.799 1.00 0.00 O ATOM 60586 H1 WAT 2727 75.314 73.393 15.618 1.00 0.00 H ATOM 60587 H2 WAT 2727 73.908 72.886 15.377 1.00 0.00 H TER 60589 WAT 2727 ATOM 60589 O WAT 2728 138.515 92.096 132.086 1.00 0.00 O ATOM 60590 H1 WAT 2728 138.901 92.462 131.290 1.00 0.00 H ATOM 60591 H2 WAT 2728 137.595 92.361 132.050 1.00 0.00 H TER 60593 WAT 2728 ATOM 60593 O WAT 2729 0.429 93.295 57.690 1.00 0.00 O ATOM 60594 H1 WAT 2729 0.502 92.469 58.169 1.00 0.00 H ATOM 60595 H2 WAT 2729 -0.387 93.683 58.007 1.00 0.00 H TER 60597 WAT 2729 ATOM 60597 O WAT 2730 123.651 19.087 98.846 1.00 0.00 O ATOM 60598 H1 WAT 2730 124.239 18.332 98.829 1.00 0.00 H ATOM 60599 H2 WAT 2730 123.134 19.006 98.044 1.00 0.00 H TER 60601 WAT 2730 ATOM 60601 O WAT 2731 6.459 50.945 96.286 1.00 0.00 O ATOM 60602 H1 WAT 2731 5.858 51.057 95.550 1.00 0.00 H ATOM 60603 H2 WAT 2731 7.007 51.730 96.270 1.00 0.00 H TER 60605 WAT 2731 ATOM 60605 O WAT 2732 52.062 1.246 146.031 1.00 0.00 O ATOM 60606 H1 WAT 2732 52.391 2.142 146.099 1.00 0.00 H ATOM 60607 H2 WAT 2732 51.819 1.012 146.926 1.00 0.00 H TER 60609 WAT 2732 ATOM 60609 O WAT 2733 16.361 105.152 75.357 1.00 0.00 O ATOM 60610 H1 WAT 2733 16.920 105.720 74.828 1.00 0.00 H ATOM 60611 H2 WAT 2733 16.957 104.494 75.714 1.00 0.00 H TER 60613 WAT 2733 ATOM 60613 O WAT 2734 92.208 122.514 102.783 1.00 0.00 O ATOM 60614 H1 WAT 2734 92.802 121.852 102.432 1.00 0.00 H ATOM 60615 H2 WAT 2734 92.777 123.249 103.012 1.00 0.00 H TER 60617 WAT 2734 ATOM 60617 O WAT 2735 18.989 77.948 137.506 1.00 0.00 O ATOM 60618 H1 WAT 2735 18.758 78.054 136.583 1.00 0.00 H ATOM 60619 H2 WAT 2735 18.792 78.798 137.901 1.00 0.00 H TER 60621 WAT 2735 ATOM 60621 O WAT 2736 145.469 15.965 64.199 1.00 0.00 O ATOM 60622 H1 WAT 2736 144.542 15.956 63.960 1.00 0.00 H ATOM 60623 H2 WAT 2736 145.580 16.774 64.699 1.00 0.00 H TER 60625 WAT 2736 ATOM 60625 O WAT 2737 79.719 90.733 3.649 1.00 0.00 O ATOM 60626 H1 WAT 2737 79.513 89.799 3.685 1.00 0.00 H ATOM 60627 H2 WAT 2737 79.241 91.113 4.387 1.00 0.00 H TER 60629 WAT 2737 ATOM 60629 O WAT 2738 98.538 10.221 75.517 1.00 0.00 O ATOM 60630 H1 WAT 2738 97.982 9.709 76.105 1.00 0.00 H ATOM 60631 H2 WAT 2738 97.974 10.426 74.772 1.00 0.00 H TER 60633 WAT 2738 ATOM 60633 O WAT 2739 109.832 43.205 21.346 1.00 0.00 O ATOM 60634 H1 WAT 2739 110.057 43.161 20.417 1.00 0.00 H ATOM 60635 H2 WAT 2739 110.012 42.326 21.679 1.00 0.00 H TER 60637 WAT 2739 ATOM 60637 O WAT 2740 79.482 104.968 153.600 1.00 0.00 O ATOM 60638 H1 WAT 2740 78.845 104.512 154.149 1.00 0.00 H ATOM 60639 H2 WAT 2740 79.570 104.414 152.825 1.00 0.00 H TER 60641 WAT 2740 ATOM 60641 O WAT 2741 87.142 60.822 5.042 1.00 0.00 O ATOM 60642 H1 WAT 2741 87.090 61.120 4.134 1.00 0.00 H ATOM 60643 H2 WAT 2741 87.618 61.518 5.495 1.00 0.00 H TER 60645 WAT 2741 ATOM 60645 O WAT 2742 5.546 65.792 13.972 1.00 0.00 O ATOM 60646 H1 WAT 2742 5.034 65.436 14.698 1.00 0.00 H ATOM 60647 H2 WAT 2742 6.435 65.865 14.320 1.00 0.00 H TER 60649 WAT 2742 ATOM 60649 O WAT 2743 56.127 137.458 116.916 1.00 0.00 O ATOM 60650 H1 WAT 2743 56.808 138.094 116.697 1.00 0.00 H ATOM 60651 H2 WAT 2743 56.439 136.635 116.540 1.00 0.00 H TER 60653 WAT 2743 ATOM 60653 O WAT 2744 110.807 16.512 83.666 1.00 0.00 O ATOM 60654 H1 WAT 2744 111.470 17.191 83.798 1.00 0.00 H ATOM 60655 H2 WAT 2744 110.147 16.927 83.110 1.00 0.00 H TER 60657 WAT 2744 ATOM 60657 O WAT 2745 125.918 120.115 96.199 1.00 0.00 O ATOM 60658 H1 WAT 2745 126.605 120.173 95.536 1.00 0.00 H ATOM 60659 H2 WAT 2745 125.173 120.575 95.812 1.00 0.00 H TER 60661 WAT 2745 ATOM 60661 O WAT 2746 25.373 31.700 139.671 1.00 0.00 O ATOM 60662 H1 WAT 2746 24.443 31.502 139.563 1.00 0.00 H ATOM 60663 H2 WAT 2746 25.614 31.278 140.496 1.00 0.00 H TER 60665 WAT 2746 ATOM 60665 O WAT 2747 89.177 80.025 61.050 1.00 0.00 O ATOM 60666 H1 WAT 2747 88.975 79.127 61.311 1.00 0.00 H ATOM 60667 H2 WAT 2747 89.918 79.940 60.450 1.00 0.00 H TER 60669 WAT 2747 ATOM 60669 O WAT 2748 30.997 93.969 1.796 1.00 0.00 O ATOM 60670 H1 WAT 2748 31.937 93.795 1.770 1.00 0.00 H ATOM 60671 H2 WAT 2748 30.904 94.693 2.415 1.00 0.00 H TER 60673 WAT 2748 ATOM 60673 O WAT 2749 89.045 139.759 65.263 1.00 0.00 O ATOM 60674 H1 WAT 2749 88.907 140.452 65.909 1.00 0.00 H ATOM 60675 H2 WAT 2749 88.414 139.080 65.501 1.00 0.00 H TER 60677 WAT 2749 ATOM 60677 O WAT 2750 44.745 144.077 89.224 1.00 0.00 O ATOM 60678 H1 WAT 2750 44.372 143.454 88.600 1.00 0.00 H ATOM 60679 H2 WAT 2750 45.123 144.766 88.678 1.00 0.00 H TER 60681 WAT 2750 ATOM 60681 O WAT 2751 92.427 113.315 8.299 1.00 0.00 O ATOM 60682 H1 WAT 2751 93.162 113.738 8.741 1.00 0.00 H ATOM 60683 H2 WAT 2751 91.712 113.949 8.363 1.00 0.00 H TER 60685 WAT 2751 ATOM 60685 O WAT 2752 52.456 111.947 122.872 1.00 0.00 O ATOM 60686 H1 WAT 2752 53.129 112.250 122.264 1.00 0.00 H ATOM 60687 H2 WAT 2752 51.630 112.112 122.418 1.00 0.00 H TER 60689 WAT 2752 ATOM 60689 O WAT 2753 91.216 50.626 102.151 1.00 0.00 O ATOM 60690 H1 WAT 2753 91.225 51.269 102.860 1.00 0.00 H ATOM 60691 H2 WAT 2753 90.439 50.846 101.637 1.00 0.00 H TER 60693 WAT 2753 ATOM 60693 O WAT 2754 8.907 3.688 57.320 1.00 0.00 O ATOM 60694 H1 WAT 2754 9.364 2.856 57.439 1.00 0.00 H ATOM 60695 H2 WAT 2754 9.585 4.353 57.444 1.00 0.00 H TER 60697 WAT 2754 ATOM 60697 O WAT 2755 65.594 75.016 108.751 1.00 0.00 O ATOM 60698 H1 WAT 2755 65.457 75.365 109.632 1.00 0.00 H ATOM 60699 H2 WAT 2755 65.827 75.781 108.224 1.00 0.00 H TER 60701 WAT 2755 ATOM 60701 O WAT 2756 131.182 120.993 150.582 1.00 0.00 O ATOM 60702 H1 WAT 2756 131.497 121.869 150.358 1.00 0.00 H ATOM 60703 H2 WAT 2756 131.884 120.407 150.299 1.00 0.00 H TER 60705 WAT 2756 ATOM 60705 O WAT 2757 22.522 97.795 77.433 1.00 0.00 O ATOM 60706 H1 WAT 2757 22.532 98.112 76.530 1.00 0.00 H ATOM 60707 H2 WAT 2757 22.245 96.881 77.363 1.00 0.00 H TER 60709 WAT 2757 ATOM 60709 O WAT 2758 2.906 112.912 83.701 1.00 0.00 O ATOM 60710 H1 WAT 2758 3.565 113.562 83.455 1.00 0.00 H ATOM 60711 H2 WAT 2758 2.069 113.330 83.496 1.00 0.00 H TER 60713 WAT 2758 ATOM 60713 O WAT 2759 19.509 61.458 9.982 1.00 0.00 O ATOM 60714 H1 WAT 2759 19.092 61.039 10.734 1.00 0.00 H ATOM 60715 H2 WAT 2759 20.157 60.821 9.681 1.00 0.00 H TER 60717 WAT 2759 ATOM 60717 O WAT 2760 124.568 108.929 14.560 1.00 0.00 O ATOM 60718 H1 WAT 2760 124.701 109.440 13.762 1.00 0.00 H ATOM 60719 H2 WAT 2760 124.069 109.509 15.136 1.00 0.00 H TER 60721 WAT 2760 ATOM 60721 O WAT 2761 96.617 86.480 136.887 1.00 0.00 O ATOM 60722 H1 WAT 2761 96.842 87.363 136.595 1.00 0.00 H ATOM 60723 H2 WAT 2761 95.838 86.251 136.379 1.00 0.00 H TER 60725 WAT 2761 ATOM 60725 O WAT 2762 49.750 21.215 120.042 1.00 0.00 O ATOM 60726 H1 WAT 2762 50.512 20.970 120.566 1.00 0.00 H ATOM 60727 H2 WAT 2762 50.117 21.675 119.287 1.00 0.00 H TER 60729 WAT 2762 ATOM 60729 O WAT 2763 72.547 12.561 4.832 1.00 0.00 O ATOM 60730 H1 WAT 2763 71.956 12.576 5.584 1.00 0.00 H ATOM 60731 H2 WAT 2763 73.386 12.862 5.180 1.00 0.00 H TER 60733 WAT 2763 ATOM 60733 O WAT 2764 60.128 10.802 81.197 1.00 0.00 O ATOM 60734 H1 WAT 2764 59.993 9.958 80.765 1.00 0.00 H ATOM 60735 H2 WAT 2764 59.911 11.451 80.528 1.00 0.00 H TER 60737 WAT 2764 ATOM 60737 O WAT 2765 110.953 114.279 73.575 1.00 0.00 O ATOM 60738 H1 WAT 2765 111.892 114.464 73.577 1.00 0.00 H ATOM 60739 H2 WAT 2765 110.558 115.053 73.173 1.00 0.00 H TER 60741 WAT 2765 ATOM 60741 O WAT 2766 49.382 145.238 96.298 1.00 0.00 O ATOM 60742 H1 WAT 2766 49.867 145.623 97.028 1.00 0.00 H ATOM 60743 H2 WAT 2766 49.923 144.502 96.012 1.00 0.00 H TER 60745 WAT 2766 ATOM 60745 O WAT 2767 88.102 133.967 110.464 1.00 0.00 O ATOM 60746 H1 WAT 2767 88.605 133.451 111.094 1.00 0.00 H ATOM 60747 H2 WAT 2767 87.645 133.315 109.932 1.00 0.00 H TER 60749 WAT 2767 ATOM 60749 O WAT 2768 113.019 119.838 98.198 1.00 0.00 O ATOM 60750 H1 WAT 2768 112.138 119.677 97.860 1.00 0.00 H ATOM 60751 H2 WAT 2768 113.204 119.081 98.755 1.00 0.00 H TER 60753 WAT 2768 ATOM 60753 O WAT 2769 100.373 45.700 85.415 1.00 0.00 O ATOM 60754 H1 WAT 2769 100.302 44.774 85.646 1.00 0.00 H ATOM 60755 H2 WAT 2769 99.750 46.139 85.994 1.00 0.00 H TER 60757 WAT 2769 ATOM 60757 O WAT 2770 54.916 57.460 5.516 1.00 0.00 O ATOM 60758 H1 WAT 2770 55.077 57.934 4.700 1.00 0.00 H ATOM 60759 H2 WAT 2770 54.230 57.964 5.955 1.00 0.00 H TER 60761 WAT 2770 ATOM 60761 O WAT 2771 135.936 93.431 132.765 1.00 0.00 O ATOM 60762 H1 WAT 2771 135.397 92.810 133.255 1.00 0.00 H ATOM 60763 H2 WAT 2771 135.456 94.257 132.817 1.00 0.00 H TER 60765 WAT 2771 ATOM 60765 O WAT 2772 90.906 54.671 105.860 1.00 0.00 O ATOM 60766 H1 WAT 2772 90.412 54.590 106.676 1.00 0.00 H ATOM 60767 H2 WAT 2772 90.735 55.565 105.564 1.00 0.00 H TER 60769 WAT 2772 ATOM 60769 O WAT 2773 15.300 124.776 56.628 1.00 0.00 O ATOM 60770 H1 WAT 2773 16.078 124.271 56.865 1.00 0.00 H ATOM 60771 H2 WAT 2773 14.568 124.184 56.799 1.00 0.00 H TER 60773 WAT 2773 ATOM 60773 O WAT 2774 55.981 86.640 3.944 1.00 0.00 O ATOM 60774 H1 WAT 2774 56.670 86.042 4.232 1.00 0.00 H ATOM 60775 H2 WAT 2774 56.449 87.358 3.518 1.00 0.00 H TER 60777 WAT 2774 ATOM 60777 O WAT 2775 109.490 122.326 138.046 1.00 0.00 O ATOM 60778 H1 WAT 2775 109.455 123.200 138.433 1.00 0.00 H ATOM 60779 H2 WAT 2775 108.908 121.798 138.593 1.00 0.00 H TER 60781 WAT 2775 ATOM 60781 O WAT 2776 141.051 67.727 121.826 1.00 0.00 O ATOM 60782 H1 WAT 2776 140.898 68.468 121.241 1.00 0.00 H ATOM 60783 H2 WAT 2776 140.306 67.737 122.426 1.00 0.00 H TER 60785 WAT 2776 ATOM 60785 O WAT 2777 29.180 11.931 93.585 1.00 0.00 O ATOM 60786 H1 WAT 2777 30.052 12.267 93.790 1.00 0.00 H ATOM 60787 H2 WAT 2777 28.828 11.647 94.429 1.00 0.00 H TER 60789 WAT 2777 ATOM 60789 O WAT 2778 130.355 14.317 6.100 1.00 0.00 O ATOM 60790 H1 WAT 2778 130.985 13.602 6.015 1.00 0.00 H ATOM 60791 H2 WAT 2778 130.727 14.885 6.774 1.00 0.00 H TER 60793 WAT 2778 ATOM 60793 O WAT 2779 96.235 5.886 105.955 1.00 0.00 O ATOM 60794 H1 WAT 2779 95.807 5.176 105.476 1.00 0.00 H ATOM 60795 H2 WAT 2779 96.904 5.449 106.482 1.00 0.00 H TER 60797 WAT 2779 ATOM 60797 O WAT 2780 110.259 70.718 24.575 1.00 0.00 O ATOM 60798 H1 WAT 2780 109.750 70.988 25.340 1.00 0.00 H ATOM 60799 H2 WAT 2780 110.321 71.508 24.038 1.00 0.00 H TER 60801 WAT 2780 ATOM 60801 O WAT 2781 144.182 140.121 121.699 1.00 0.00 O ATOM 60802 H1 WAT 2781 144.242 139.349 122.263 1.00 0.00 H ATOM 60803 H2 WAT 2781 143.973 139.769 120.834 1.00 0.00 H TER 60805 WAT 2781 ATOM 60805 O WAT 2782 22.664 37.698 113.300 1.00 0.00 O ATOM 60806 H1 WAT 2782 21.849 37.531 113.773 1.00 0.00 H ATOM 60807 H2 WAT 2782 23.061 38.437 113.761 1.00 0.00 H TER 60809 WAT 2782 ATOM 60809 O WAT 2783 53.708 122.079 51.895 1.00 0.00 O ATOM 60810 H1 WAT 2783 53.073 122.131 51.180 1.00 0.00 H ATOM 60811 H2 WAT 2783 53.202 122.286 52.680 1.00 0.00 H TER 60813 WAT 2783 ATOM 60813 O WAT 2784 72.285 70.999 18.070 1.00 0.00 O ATOM 60814 H1 WAT 2784 72.702 70.300 17.566 1.00 0.00 H ATOM 60815 H2 WAT 2784 72.691 70.946 18.935 1.00 0.00 H TER 60817 WAT 2784 ATOM 60817 O WAT 2785 136.998 38.648 57.103 1.00 0.00 O ATOM 60818 H1 WAT 2785 136.390 38.189 56.523 1.00 0.00 H ATOM 60819 H2 WAT 2785 136.569 38.635 57.958 1.00 0.00 H TER 60821 WAT 2785 ATOM 60821 O WAT 2786 69.210 46.181 101.763 1.00 0.00 O ATOM 60822 H1 WAT 2786 68.675 46.951 101.575 1.00 0.00 H ATOM 60823 H2 WAT 2786 69.545 46.332 102.647 1.00 0.00 H TER 60825 WAT 2786 ATOM 60825 O WAT 2787 130.535 47.347 145.002 1.00 0.00 O ATOM 60826 H1 WAT 2787 130.409 46.989 144.123 1.00 0.00 H ATOM 60827 H2 WAT 2787 129.663 47.328 145.395 1.00 0.00 H TER 60829 WAT 2787 ATOM 60829 O WAT 2788 17.812 65.900 139.440 1.00 0.00 O ATOM 60830 H1 WAT 2788 16.955 66.115 139.073 1.00 0.00 H ATOM 60831 H2 WAT 2788 17.851 64.944 139.415 1.00 0.00 H TER 60833 WAT 2788 ATOM 60833 O WAT 2789 139.769 115.691 101.746 1.00 0.00 O ATOM 60834 H1 WAT 2789 139.705 115.711 100.791 1.00 0.00 H ATOM 60835 H2 WAT 2789 139.423 114.833 101.991 1.00 0.00 H TER 60837 WAT 2789 ATOM 60837 O WAT 2790 72.995 86.421 131.981 1.00 0.00 O ATOM 60838 H1 WAT 2790 73.138 85.499 131.767 1.00 0.00 H ATOM 60839 H2 WAT 2790 72.605 86.407 132.855 1.00 0.00 H TER 60841 WAT 2790 ATOM 60841 O WAT 2791 64.483 89.117 126.428 1.00 0.00 O ATOM 60842 H1 WAT 2791 63.979 89.204 125.619 1.00 0.00 H ATOM 60843 H2 WAT 2791 64.023 88.442 126.926 1.00 0.00 H TER 60845 WAT 2791 ATOM 60845 O WAT 2792 13.605 130.596 69.474 1.00 0.00 O ATOM 60846 H1 WAT 2792 14.503 130.839 69.248 1.00 0.00 H ATOM 60847 H2 WAT 2792 13.060 131.194 68.963 1.00 0.00 H TER 60849 WAT 2792 ATOM 60849 O WAT 2793 33.293 6.887 70.299 1.00 0.00 O ATOM 60850 H1 WAT 2793 33.968 6.726 69.640 1.00 0.00 H ATOM 60851 H2 WAT 2793 32.500 7.059 69.791 1.00 0.00 H TER 60853 WAT 2793 ATOM 60853 O WAT 2794 40.329 38.105 5.101 1.00 0.00 O ATOM 60854 H1 WAT 2794 40.081 38.886 5.596 1.00 0.00 H ATOM 60855 H2 WAT 2794 39.551 37.892 4.585 1.00 0.00 H TER 60857 WAT 2794 ATOM 60857 O WAT 2795 106.011 61.752 104.082 1.00 0.00 O ATOM 60858 H1 WAT 2795 105.932 61.637 103.135 1.00 0.00 H ATOM 60859 H2 WAT 2795 106.176 62.688 104.197 1.00 0.00 H TER 60861 WAT 2795 ATOM 60861 O WAT 2796 115.029 119.034 65.186 1.00 0.00 O ATOM 60862 H1 WAT 2796 115.169 119.373 66.071 1.00 0.00 H ATOM 60863 H2 WAT 2796 115.645 118.305 65.109 1.00 0.00 H TER 60865 WAT 2796 ATOM 60865 O WAT 2797 47.440 124.383 150.568 1.00 0.00 O ATOM 60866 H1 WAT 2797 47.868 124.703 151.362 1.00 0.00 H ATOM 60867 H2 WAT 2797 47.242 123.466 150.756 1.00 0.00 H TER 60869 WAT 2797 ATOM 60869 O WAT 2798 66.113 40.321 129.469 1.00 0.00 O ATOM 60870 H1 WAT 2798 66.999 40.587 129.717 1.00 0.00 H ATOM 60871 H2 WAT 2798 65.772 41.064 128.970 1.00 0.00 H TER 60873 WAT 2798 ATOM 60873 O WAT 2799 -0.201 17.385 82.367 1.00 0.00 O ATOM 60874 H1 WAT 2799 0.506 17.732 81.823 1.00 0.00 H ATOM 60875 H2 WAT 2799 0.057 17.604 83.263 1.00 0.00 H TER 60877 WAT 2799 ATOM 60877 O WAT 2800 63.955 15.698 105.076 1.00 0.00 O ATOM 60878 H1 WAT 2800 64.719 15.169 105.304 1.00 0.00 H ATOM 60879 H2 WAT 2800 63.802 15.511 104.150 1.00 0.00 H TER 60881 WAT 2800 ATOM 60881 O WAT 2801 33.712 92.408 15.781 1.00 0.00 O ATOM 60882 H1 WAT 2801 34.540 92.885 15.835 1.00 0.00 H ATOM 60883 H2 WAT 2801 33.170 92.937 15.195 1.00 0.00 H TER 60885 WAT 2801 ATOM 60885 O WAT 2802 102.498 49.055 117.799 1.00 0.00 O ATOM 60886 H1 WAT 2802 103.189 48.971 118.456 1.00 0.00 H ATOM 60887 H2 WAT 2802 101.865 48.375 118.030 1.00 0.00 H TER 60889 WAT 2802 ATOM 60889 O WAT 2803 36.744 101.526 65.327 1.00 0.00 O ATOM 60890 H1 WAT 2803 36.303 101.577 64.479 1.00 0.00 H ATOM 60891 H2 WAT 2803 36.106 101.106 65.904 1.00 0.00 H TER 60893 WAT 2803 ATOM 60893 O WAT 2804 6.339 12.433 158.251 1.00 0.00 O ATOM 60894 H1 WAT 2804 6.590 11.523 158.407 1.00 0.00 H ATOM 60895 H2 WAT 2804 6.188 12.482 157.307 1.00 0.00 H TER 60897 WAT 2804 ATOM 60897 O WAT 2805 10.426 131.754 122.419 1.00 0.00 O ATOM 60898 H1 WAT 2805 10.509 131.214 123.205 1.00 0.00 H ATOM 60899 H2 WAT 2805 10.724 132.622 122.692 1.00 0.00 H TER 60901 WAT 2805 ATOM 60901 O WAT 2806 51.421 7.199 151.203 1.00 0.00 O ATOM 60902 H1 WAT 2806 51.257 7.796 150.473 1.00 0.00 H ATOM 60903 H2 WAT 2806 50.573 6.789 151.372 1.00 0.00 H TER 60905 WAT 2806 ATOM 60905 O WAT 2807 136.995 127.450 111.853 1.00 0.00 O ATOM 60906 H1 WAT 2807 136.670 126.760 111.275 1.00 0.00 H ATOM 60907 H2 WAT 2807 137.869 127.154 112.110 1.00 0.00 H TER 60909 WAT 2807 ATOM 60909 O WAT 2808 99.123 49.466 79.488 1.00 0.00 O ATOM 60910 H1 WAT 2808 99.989 49.680 79.837 1.00 0.00 H ATOM 60911 H2 WAT 2808 98.929 50.177 78.877 1.00 0.00 H TER 60913 WAT 2808 ATOM 60913 O WAT 2809 137.604 86.789 123.969 1.00 0.00 O ATOM 60914 H1 WAT 2809 137.350 85.960 124.374 1.00 0.00 H ATOM 60915 H2 WAT 2809 137.896 86.547 123.090 1.00 0.00 H TER 60917 WAT 2809 ATOM 60917 O WAT 2810 88.132 104.137 66.731 1.00 0.00 O ATOM 60918 H1 WAT 2810 87.908 103.478 66.073 1.00 0.00 H ATOM 60919 H2 WAT 2810 88.626 104.800 66.247 1.00 0.00 H TER 60921 WAT 2810 ATOM 60921 O WAT 2811 104.844 14.914 131.536 1.00 0.00 O ATOM 60922 H1 WAT 2811 104.365 15.018 130.714 1.00 0.00 H ATOM 60923 H2 WAT 2811 105.107 13.994 131.546 1.00 0.00 H TER 60925 WAT 2811 ATOM 60925 O WAT 2812 117.222 1.300 108.118 1.00 0.00 O ATOM 60926 H1 WAT 2812 116.304 1.231 108.380 1.00 0.00 H ATOM 60927 H2 WAT 2812 117.640 1.781 108.832 1.00 0.00 H TER 60929 WAT 2812 ATOM 60929 O WAT 2813 5.256 97.787 86.190 1.00 0.00 O ATOM 60930 H1 WAT 2813 5.805 98.277 86.802 1.00 0.00 H ATOM 60931 H2 WAT 2813 4.406 97.725 86.627 1.00 0.00 H TER 60933 WAT 2813 ATOM 60933 O WAT 2814 117.778 135.142 80.006 1.00 0.00 O ATOM 60934 H1 WAT 2814 118.108 134.527 79.351 1.00 0.00 H ATOM 60935 H2 WAT 2814 117.010 135.539 79.596 1.00 0.00 H TER 60937 WAT 2814 ATOM 60937 O WAT 2815 105.838 142.448 86.348 1.00 0.00 O ATOM 60938 H1 WAT 2815 104.944 142.767 86.469 1.00 0.00 H ATOM 60939 H2 WAT 2815 105.916 142.308 85.404 1.00 0.00 H TER 60941 WAT 2815 ATOM 60941 O WAT 2816 82.260 69.643 124.733 1.00 0.00 O ATOM 60942 H1 WAT 2816 81.414 69.968 124.427 1.00 0.00 H ATOM 60943 H2 WAT 2816 82.089 68.739 124.996 1.00 0.00 H TER 60945 WAT 2816 ATOM 60945 O WAT 2817 131.960 18.869 101.603 1.00 0.00 O ATOM 60946 H1 WAT 2817 131.269 19.453 101.290 1.00 0.00 H ATOM 60947 H2 WAT 2817 132.742 19.147 101.125 1.00 0.00 H TER 60949 WAT 2817 ATOM 60949 O WAT 2818 39.020 48.432 98.096 1.00 0.00 O ATOM 60950 H1 WAT 2818 38.083 48.320 97.935 1.00 0.00 H ATOM 60951 H2 WAT 2818 39.171 48.006 98.940 1.00 0.00 H TER 60953 WAT 2818 ATOM 60953 O WAT 2819 79.758 137.821 121.997 1.00 0.00 O ATOM 60954 H1 WAT 2819 79.566 137.240 121.261 1.00 0.00 H ATOM 60955 H2 WAT 2819 80.435 137.362 122.495 1.00 0.00 H TER 60957 WAT 2819 ATOM 60957 O WAT 2820 90.353 68.638 86.174 1.00 0.00 O ATOM 60958 H1 WAT 2820 90.081 69.455 85.756 1.00 0.00 H ATOM 60959 H2 WAT 2820 89.856 68.611 86.992 1.00 0.00 H TER 60961 WAT 2820 ATOM 60961 O WAT 2821 73.311 36.077 148.914 1.00 0.00 O ATOM 60962 H1 WAT 2821 73.378 36.187 147.965 1.00 0.00 H ATOM 60963 H2 WAT 2821 73.696 35.218 149.084 1.00 0.00 H TER 60965 WAT 2821 ATOM 60965 O WAT 2822 56.589 122.256 128.563 1.00 0.00 O ATOM 60966 H1 WAT 2822 57.078 122.574 129.322 1.00 0.00 H ATOM 60967 H2 WAT 2822 56.738 121.310 128.563 1.00 0.00 H TER 60969 WAT 2822 ATOM 60969 O WAT 2823 77.646 112.110 100.625 1.00 0.00 O ATOM 60970 H1 WAT 2823 78.266 112.760 100.294 1.00 0.00 H ATOM 60971 H2 WAT 2823 77.731 112.162 101.577 1.00 0.00 H TER 60973 WAT 2823 ATOM 60973 O WAT 2824 59.430 132.342 148.633 1.00 0.00 O ATOM 60974 H1 WAT 2824 58.775 131.645 148.596 1.00 0.00 H ATOM 60975 H2 WAT 2824 60.248 131.892 148.842 1.00 0.00 H TER 60977 WAT 2824 ATOM 60977 O WAT 2825 131.648 18.009 89.909 1.00 0.00 O ATOM 60978 H1 WAT 2825 131.602 17.614 89.039 1.00 0.00 H ATOM 60979 H2 WAT 2825 131.685 17.264 90.509 1.00 0.00 H TER 60981 WAT 2825 ATOM 60981 O WAT 2826 130.522 132.424 17.607 1.00 0.00 O ATOM 60982 H1 WAT 2826 129.966 132.247 18.366 1.00 0.00 H ATOM 60983 H2 WAT 2826 130.748 133.351 17.686 1.00 0.00 H TER 60985 WAT 2826 ATOM 60985 O WAT 2827 54.168 70.769 124.939 1.00 0.00 O ATOM 60986 H1 WAT 2827 53.293 71.148 125.017 1.00 0.00 H ATOM 60987 H2 WAT 2827 54.649 71.387 124.389 1.00 0.00 H TER 60989 WAT 2827 ATOM 60989 O WAT 2828 65.223 48.503 99.881 1.00 0.00 O ATOM 60990 H1 WAT 2828 65.253 49.458 99.824 1.00 0.00 H ATOM 60991 H2 WAT 2828 64.758 48.326 100.699 1.00 0.00 H TER 60993 WAT 2828 ATOM 60993 O WAT 2829 77.524 39.908 147.132 1.00 0.00 O ATOM 60994 H1 WAT 2829 76.624 40.229 147.188 1.00 0.00 H ATOM 60995 H2 WAT 2829 77.688 39.816 146.194 1.00 0.00 H TER 60997 WAT 2829 ATOM 60997 O WAT 2830 41.858 96.691 53.582 1.00 0.00 O ATOM 60998 H1 WAT 2830 40.902 96.735 53.602 1.00 0.00 H ATOM 60999 H2 WAT 2830 42.143 97.426 54.124 1.00 0.00 H TER 61001 WAT 2830 ATOM 61001 O WAT 2831 11.364 9.986 101.566 1.00 0.00 O ATOM 61002 H1 WAT 2831 12.275 9.969 101.273 1.00 0.00 H ATOM 61003 H2 WAT 2831 11.071 10.878 101.384 1.00 0.00 H TER 61005 WAT 2831 ATOM 61005 O WAT 2832 117.027 30.782 139.008 1.00 0.00 O ATOM 61006 H1 WAT 2832 117.976 30.874 139.093 1.00 0.00 H ATOM 61007 H2 WAT 2832 116.764 31.519 138.455 1.00 0.00 H TER 61009 WAT 2832 ATOM 61009 O WAT 2833 55.965 109.777 87.027 1.00 0.00 O ATOM 61010 H1 WAT 2833 55.334 110.451 87.279 1.00 0.00 H ATOM 61011 H2 WAT 2833 55.439 108.985 86.916 1.00 0.00 H TER 61013 WAT 2833 ATOM 61013 O WAT 2834 82.945 140.359 88.380 1.00 0.00 O ATOM 61014 H1 WAT 2834 82.093 140.342 87.944 1.00 0.00 H ATOM 61015 H2 WAT 2834 83.556 140.022 87.725 1.00 0.00 H TER 61017 WAT 2834 ATOM 61017 O WAT 2835 137.638 54.568 143.566 1.00 0.00 O ATOM 61018 H1 WAT 2835 137.443 54.732 144.489 1.00 0.00 H ATOM 61019 H2 WAT 2835 137.001 53.904 143.301 1.00 0.00 H TER 61021 WAT 2835 ATOM 61021 O WAT 2836 113.239 47.738 9.856 1.00 0.00 O ATOM 61022 H1 WAT 2836 112.753 47.720 9.033 1.00 0.00 H ATOM 61023 H2 WAT 2836 114.159 47.730 9.591 1.00 0.00 H TER 61025 WAT 2836 ATOM 61025 O WAT 2837 42.990 95.764 27.771 1.00 0.00 O ATOM 61026 H1 WAT 2837 43.159 95.768 26.828 1.00 0.00 H ATOM 61027 H2 WAT 2837 42.795 96.676 27.983 1.00 0.00 H TER 61029 WAT 2837 ATOM 61029 O WAT 2838 109.038 0.232 115.410 1.00 0.00 O ATOM 61030 H1 WAT 2838 108.200 -0.203 115.254 1.00 0.00 H ATOM 61031 H2 WAT 2838 109.241 0.040 116.325 1.00 0.00 H TER 61033 WAT 2838 ATOM 61033 O WAT 2839 133.523 9.476 76.005 1.00 0.00 O ATOM 61034 H1 WAT 2839 132.571 9.384 76.033 1.00 0.00 H ATOM 61035 H2 WAT 2839 133.751 9.334 75.086 1.00 0.00 H TER 61037 WAT 2839 ATOM 61037 O WAT 2840 33.641 134.910 115.500 1.00 0.00 O ATOM 61038 H1 WAT 2840 32.688 134.872 115.584 1.00 0.00 H ATOM 61039 H2 WAT 2840 33.806 135.709 114.999 1.00 0.00 H TER 61041 WAT 2840 ATOM 61041 O WAT 2841 116.646 7.953 87.152 1.00 0.00 O ATOM 61042 H1 WAT 2841 117.382 8.513 87.397 1.00 0.00 H ATOM 61043 H2 WAT 2841 116.793 7.139 87.634 1.00 0.00 H TER 61045 WAT 2841 ATOM 61045 O WAT 2842 138.311 16.944 154.999 1.00 0.00 O ATOM 61046 H1 WAT 2842 138.279 17.780 154.533 1.00 0.00 H ATOM 61047 H2 WAT 2842 139.080 16.500 154.642 1.00 0.00 H TER 61049 WAT 2842 ATOM 61049 O WAT 2843 116.327 70.814 147.178 1.00 0.00 O ATOM 61050 H1 WAT 2843 115.908 69.999 146.902 1.00 0.00 H ATOM 61051 H2 WAT 2843 116.132 71.434 146.475 1.00 0.00 H TER 61053 WAT 2843 ATOM 61053 O WAT 2844 82.573 118.699 0.179 1.00 0.00 O ATOM 61054 H1 WAT 2844 81.718 118.529 0.574 1.00 0.00 H ATOM 61055 H2 WAT 2844 83.009 119.287 0.795 1.00 0.00 H TER 61057 WAT 2844 ATOM 61057 O WAT 2845 40.322 18.601 74.197 1.00 0.00 O ATOM 61058 H1 WAT 2845 40.661 18.016 73.519 1.00 0.00 H ATOM 61059 H2 WAT 2845 41.096 19.057 74.528 1.00 0.00 H TER 61061 WAT 2845 ATOM 61061 O WAT 2846 14.992 92.820 61.698 1.00 0.00 O ATOM 61062 H1 WAT 2846 15.936 92.662 61.663 1.00 0.00 H ATOM 61063 H2 WAT 2846 14.616 92.152 61.126 1.00 0.00 H TER 61065 WAT 2846 ATOM 61065 O WAT 2847 133.112 39.256 91.496 1.00 0.00 O ATOM 61066 H1 WAT 2847 133.337 40.133 91.185 1.00 0.00 H ATOM 61067 H2 WAT 2847 132.615 39.408 92.300 1.00 0.00 H TER 61069 WAT 2847 ATOM 61069 O WAT 2848 125.809 33.996 138.544 1.00 0.00 O ATOM 61070 H1 WAT 2848 126.023 34.735 139.114 1.00 0.00 H ATOM 61071 H2 WAT 2848 125.297 34.382 137.833 1.00 0.00 H TER 61073 WAT 2848 ATOM 61073 O WAT 2849 26.677 49.433 147.950 1.00 0.00 O ATOM 61074 H1 WAT 2849 27.509 48.960 147.923 1.00 0.00 H ATOM 61075 H2 WAT 2849 26.687 49.980 147.165 1.00 0.00 H TER 61077 WAT 2849 ATOM 61077 O WAT 2850 82.450 8.603 147.739 1.00 0.00 O ATOM 61078 H1 WAT 2850 81.782 8.539 148.421 1.00 0.00 H ATOM 61079 H2 WAT 2850 82.009 8.304 146.943 1.00 0.00 H TER 61081 WAT 2850 ATOM 61081 O WAT 2851 114.342 77.212 126.186 1.00 0.00 O ATOM 61082 H1 WAT 2851 113.612 76.604 126.298 1.00 0.00 H ATOM 61083 H2 WAT 2851 114.579 77.469 127.077 1.00 0.00 H TER 61085 WAT 2851 ATOM 61085 O WAT 2852 4.709 64.632 151.475 1.00 0.00 O ATOM 61086 H1 WAT 2852 5.120 64.793 150.625 1.00 0.00 H ATOM 61087 H2 WAT 2852 4.888 63.709 151.656 1.00 0.00 H TER 61089 WAT 2852 ATOM 61089 O WAT 2853 65.849 14.247 118.850 1.00 0.00 O ATOM 61090 H1 WAT 2853 65.905 15.170 119.099 1.00 0.00 H ATOM 61091 H2 WAT 2853 64.925 14.112 118.640 1.00 0.00 H TER 61093 WAT 2853 ATOM 61093 O WAT 2854 126.551 103.103 24.388 1.00 0.00 O ATOM 61094 H1 WAT 2854 126.977 103.575 23.672 1.00 0.00 H ATOM 61095 H2 WAT 2854 125.617 103.279 24.269 1.00 0.00 H TER 61097 WAT 2854 ATOM 61097 O WAT 2855 83.455 103.549 88.248 1.00 0.00 O ATOM 61098 H1 WAT 2855 83.519 103.957 89.112 1.00 0.00 H ATOM 61099 H2 WAT 2855 84.073 102.819 88.282 1.00 0.00 H TER 61101 WAT 2855 ATOM 61101 O WAT 2856 71.668 83.865 18.174 1.00 0.00 O ATOM 61102 H1 WAT 2856 70.731 83.800 17.987 1.00 0.00 H ATOM 61103 H2 WAT 2856 72.092 83.495 17.400 1.00 0.00 H TER 61105 WAT 2856 ATOM 61105 O WAT 2857 64.659 19.557 73.503 1.00 0.00 O ATOM 61106 H1 WAT 2857 64.257 18.751 73.179 1.00 0.00 H ATOM 61107 H2 WAT 2857 64.246 19.705 74.354 1.00 0.00 H TER 61109 WAT 2857 ATOM 61109 O WAT 2858 66.766 25.572 0.740 1.00 0.00 O ATOM 61110 H1 WAT 2858 66.534 24.838 0.171 1.00 0.00 H ATOM 61111 H2 WAT 2858 66.375 26.336 0.316 1.00 0.00 H TER 61113 WAT 2858 ATOM 61113 O WAT 2859 106.376 118.823 135.924 1.00 0.00 O ATOM 61114 H1 WAT 2859 106.072 119.177 136.759 1.00 0.00 H ATOM 61115 H2 WAT 2859 105.603 118.403 135.546 1.00 0.00 H TER 61117 WAT 2859 ATOM 61117 O WAT 2860 112.618 121.975 83.945 1.00 0.00 O ATOM 61118 H1 WAT 2860 113.158 122.635 84.381 1.00 0.00 H ATOM 61119 H2 WAT 2860 111.878 121.842 84.537 1.00 0.00 H TER 61121 WAT 2860 ATOM 61121 O WAT 2861 140.293 62.748 142.356 1.00 0.00 O ATOM 61122 H1 WAT 2861 141.240 62.654 142.467 1.00 0.00 H ATOM 61123 H2 WAT 2861 140.129 63.683 142.481 1.00 0.00 H TER 61125 WAT 2861 ATOM 61125 O WAT 2862 65.497 17.471 128.137 1.00 0.00 O ATOM 61126 H1 WAT 2862 65.082 17.403 127.277 1.00 0.00 H ATOM 61127 H2 WAT 2862 66.399 17.727 127.948 1.00 0.00 H TER 61129 WAT 2862 ATOM 61129 O WAT 2863 93.509 127.196 131.636 1.00 0.00 O ATOM 61130 H1 WAT 2863 93.362 127.152 130.691 1.00 0.00 H ATOM 61131 H2 WAT 2863 94.172 127.878 131.744 1.00 0.00 H TER 61133 WAT 2863 ATOM 61133 O WAT 2864 81.975 143.040 150.752 1.00 0.00 O ATOM 61134 H1 WAT 2864 82.320 143.755 151.288 1.00 0.00 H ATOM 61135 H2 WAT 2864 82.526 143.038 149.970 1.00 0.00 H TER 61137 WAT 2864 ATOM 61137 O WAT 2865 94.389 17.553 10.974 1.00 0.00 O ATOM 61138 H1 WAT 2865 93.809 18.220 10.605 1.00 0.00 H ATOM 61139 H2 WAT 2865 94.497 16.914 10.270 1.00 0.00 H TER 61141 WAT 2865 ATOM 61141 O WAT 2866 34.330 134.157 65.620 1.00 0.00 O ATOM 61142 H1 WAT 2866 34.539 133.700 64.806 1.00 0.00 H ATOM 61143 H2 WAT 2866 34.265 135.078 65.369 1.00 0.00 H TER 61145 WAT 2866 ATOM 61145 O WAT 2867 100.953 122.966 108.991 1.00 0.00 O ATOM 61146 H1 WAT 2867 100.793 122.697 108.086 1.00 0.00 H ATOM 61147 H2 WAT 2867 100.081 123.027 109.381 1.00 0.00 H TER 61149 WAT 2867 ATOM 61149 O WAT 2868 130.223 133.171 132.683 1.00 0.00 O ATOM 61150 H1 WAT 2868 129.557 133.850 132.794 1.00 0.00 H ATOM 61151 H2 WAT 2868 130.179 132.659 133.490 1.00 0.00 H TER 61153 WAT 2868 ATOM 61153 O WAT 2869 0.276 80.799 90.468 1.00 0.00 O ATOM 61154 H1 WAT 2869 1.031 80.415 90.023 1.00 0.00 H ATOM 61155 H2 WAT 2869 -0.481 80.365 90.074 1.00 0.00 H TER 61157 WAT 2869 ATOM 61157 O WAT 2870 143.064 54.643 67.985 1.00 0.00 O ATOM 61158 H1 WAT 2870 142.425 54.486 67.289 1.00 0.00 H ATOM 61159 H2 WAT 2870 143.372 55.535 67.830 1.00 0.00 H TER 61161 WAT 2870 ATOM 61161 O WAT 2871 50.503 31.069 90.561 1.00 0.00 O ATOM 61162 H1 WAT 2871 49.784 30.690 90.055 1.00 0.00 H ATOM 61163 H2 WAT 2871 50.895 31.715 89.973 1.00 0.00 H TER 61165 WAT 2871 ATOM 61165 O WAT 2872 30.631 16.908 17.444 1.00 0.00 O ATOM 61166 H1 WAT 2872 31.209 17.110 16.709 1.00 0.00 H ATOM 61167 H2 WAT 2872 30.825 17.584 18.094 1.00 0.00 H TER 61169 WAT 2872 ATOM 61169 O WAT 2873 71.460 16.958 106.097 1.00 0.00 O ATOM 61170 H1 WAT 2873 70.875 16.214 106.240 1.00 0.00 H ATOM 61171 H2 WAT 2873 70.990 17.517 105.478 1.00 0.00 H TER 61173 WAT 2873 ATOM 61173 O WAT 2874 114.481 31.656 28.074 1.00 0.00 O ATOM 61174 H1 WAT 2874 114.449 32.608 28.171 1.00 0.00 H ATOM 61175 H2 WAT 2874 115.330 31.486 27.667 1.00 0.00 H TER 61177 WAT 2874 ATOM 61177 O WAT 2875 139.712 64.609 153.300 1.00 0.00 O ATOM 61178 H1 WAT 2875 139.504 64.842 154.205 1.00 0.00 H ATOM 61179 H2 WAT 2875 140.639 64.370 153.322 1.00 0.00 H TER 61181 WAT 2875 ATOM 61181 O WAT 2876 102.139 61.814 16.051 1.00 0.00 O ATOM 61182 H1 WAT 2876 101.374 61.372 16.420 1.00 0.00 H ATOM 61183 H2 WAT 2876 101.951 61.876 15.114 1.00 0.00 H TER 61185 WAT 2876 ATOM 61185 O WAT 2877 73.598 20.057 116.701 1.00 0.00 O ATOM 61186 H1 WAT 2877 74.397 19.807 117.165 1.00 0.00 H ATOM 61187 H2 WAT 2877 73.907 20.468 115.894 1.00 0.00 H TER 61189 WAT 2877 ATOM 61189 O WAT 2878 111.922 62.577 153.371 1.00 0.00 O ATOM 61190 H1 WAT 2878 111.031 62.573 153.720 1.00 0.00 H ATOM 61191 H2 WAT 2878 111.972 61.790 152.829 1.00 0.00 H TER 61193 WAT 2878 ATOM 61193 O WAT 2879 124.769 109.952 109.029 1.00 0.00 O ATOM 61194 H1 WAT 2879 125.397 110.107 108.324 1.00 0.00 H ATOM 61195 H2 WAT 2879 123.914 109.995 108.601 1.00 0.00 H TER 61197 WAT 2879 ATOM 61197 O WAT 2880 9.113 126.676 102.691 1.00 0.00 O ATOM 61198 H1 WAT 2880 8.392 127.254 102.441 1.00 0.00 H ATOM 61199 H2 WAT 2880 9.810 127.270 102.969 1.00 0.00 H TER 61201 WAT 2880 ATOM 61201 O WAT 2881 80.887 89.017 135.983 1.00 0.00 O ATOM 61202 H1 WAT 2881 80.908 88.707 135.078 1.00 0.00 H ATOM 61203 H2 WAT 2881 81.066 88.237 136.508 1.00 0.00 H TER 61205 WAT 2881 ATOM 61205 O WAT 2882 118.585 27.073 82.622 1.00 0.00 O ATOM 61206 H1 WAT 2882 118.887 27.331 81.751 1.00 0.00 H ATOM 61207 H2 WAT 2882 117.703 27.441 82.688 1.00 0.00 H TER 61209 WAT 2882 ATOM 61209 O WAT 2883 102.466 85.632 111.853 1.00 0.00 O ATOM 61210 H1 WAT 2883 102.574 85.532 110.908 1.00 0.00 H ATOM 61211 H2 WAT 2883 103.360 85.674 112.194 1.00 0.00 H TER 61213 WAT 2883 ATOM 61213 O WAT 2884 28.616 74.847 153.554 1.00 0.00 O ATOM 61214 H1 WAT 2884 27.837 74.779 153.001 1.00 0.00 H ATOM 61215 H2 WAT 2884 28.615 74.040 154.068 1.00 0.00 H TER 61217 WAT 2884 ATOM 61217 O WAT 2885 41.872 68.190 57.651 1.00 0.00 O ATOM 61218 H1 WAT 2885 42.673 68.369 58.143 1.00 0.00 H ATOM 61219 H2 WAT 2885 41.230 68.804 58.007 1.00 0.00 H TER 61221 WAT 2885 ATOM 61221 O WAT 2886 56.869 62.005 94.397 1.00 0.00 O ATOM 61222 H1 WAT 2886 57.125 62.484 95.186 1.00 0.00 H ATOM 61223 H2 WAT 2886 57.667 61.551 94.124 1.00 0.00 H TER 61225 WAT 2886 ATOM 61225 O WAT 2887 99.686 130.388 72.904 1.00 0.00 O ATOM 61226 H1 WAT 2887 99.963 129.531 73.227 1.00 0.00 H ATOM 61227 H2 WAT 2887 100.356 130.993 73.222 1.00 0.00 H TER 61229 WAT 2887 ATOM 61229 O WAT 2888 120.327 5.293 15.508 1.00 0.00 O ATOM 61230 H1 WAT 2888 121.168 5.704 15.708 1.00 0.00 H ATOM 61231 H2 WAT 2888 120.088 4.833 16.313 1.00 0.00 H TER 61233 WAT 2888 ATOM 61233 O WAT 2889 33.426 6.658 105.899 1.00 0.00 O ATOM 61234 H1 WAT 2889 33.213 6.776 106.824 1.00 0.00 H ATOM 61235 H2 WAT 2889 32.812 5.990 105.595 1.00 0.00 H TER 61237 WAT 2889 ATOM 61237 O WAT 2890 19.882 8.760 16.518 1.00 0.00 O ATOM 61238 H1 WAT 2890 19.674 7.840 16.355 1.00 0.00 H ATOM 61239 H2 WAT 2890 20.159 9.098 15.666 1.00 0.00 H TER 61241 WAT 2890 ATOM 61241 O WAT 2891 64.217 103.759 90.854 1.00 0.00 O ATOM 61242 H1 WAT 2891 63.735 104.466 91.282 1.00 0.00 H ATOM 61243 H2 WAT 2891 64.047 103.883 89.920 1.00 0.00 H TER 61245 WAT 2891 ATOM 61245 O WAT 2892 60.644 75.601 131.687 1.00 0.00 O ATOM 61246 H1 WAT 2892 60.802 75.601 132.631 1.00 0.00 H ATOM 61247 H2 WAT 2892 59.691 75.633 131.603 1.00 0.00 H TER 61249 WAT 2892 ATOM 61249 O WAT 2893 56.668 73.818 85.621 1.00 0.00 O ATOM 61250 H1 WAT 2893 56.404 73.618 86.519 1.00 0.00 H ATOM 61251 H2 WAT 2893 56.012 74.444 85.313 1.00 0.00 H TER 61253 WAT 2893 ATOM 61253 O WAT 2894 19.739 85.894 105.629 1.00 0.00 O ATOM 61254 H1 WAT 2894 19.931 86.808 105.838 1.00 0.00 H ATOM 61255 H2 WAT 2894 18.888 85.728 106.035 1.00 0.00 H TER 61257 WAT 2894 ATOM 61257 O WAT 2895 144.542 59.239 70.989 1.00 0.00 O ATOM 61258 H1 WAT 2895 144.607 59.690 71.831 1.00 0.00 H ATOM 61259 H2 WAT 2895 144.715 59.919 70.339 1.00 0.00 H TER 61261 WAT 2895 ATOM 61261 O WAT 2896 6.859 138.177 113.321 1.00 0.00 O ATOM 61262 H1 WAT 2896 6.612 138.026 114.234 1.00 0.00 H ATOM 61263 H2 WAT 2896 6.409 138.988 113.083 1.00 0.00 H TER 61265 WAT 2896 ATOM 61265 O WAT 2897 69.998 74.904 101.822 1.00 0.00 O ATOM 61266 H1 WAT 2897 70.761 74.459 101.452 1.00 0.00 H ATOM 61267 H2 WAT 2897 70.026 74.690 102.755 1.00 0.00 H TER 61269 WAT 2897 ATOM 61269 O WAT 2898 101.973 111.266 65.625 1.00 0.00 O ATOM 61270 H1 WAT 2898 101.497 110.505 65.293 1.00 0.00 H ATOM 61271 H2 WAT 2898 102.888 110.987 65.644 1.00 0.00 H TER 61273 WAT 2898 ATOM 61273 O WAT 2899 45.083 87.733 77.179 1.00 0.00 O ATOM 61274 H1 WAT 2899 45.632 88.456 76.876 1.00 0.00 H ATOM 61275 H2 WAT 2899 45.180 87.059 76.505 1.00 0.00 H TER 61277 WAT 2899 ATOM 61277 O WAT 2900 20.196 7.381 65.946 1.00 0.00 O ATOM 61278 H1 WAT 2900 20.929 7.754 66.436 1.00 0.00 H ATOM 61279 H2 WAT 2900 19.606 8.121 65.799 1.00 0.00 H TER 61281 WAT 2900 ATOM 61281 O WAT 2901 79.681 106.633 135.912 1.00 0.00 O ATOM 61282 H1 WAT 2901 79.403 105.735 135.733 1.00 0.00 H ATOM 61283 H2 WAT 2901 79.952 106.974 135.060 1.00 0.00 H TER 61285 WAT 2901 ATOM 61285 O WAT 2902 93.125 144.025 57.650 1.00 0.00 O ATOM 61286 H1 WAT 2902 93.164 144.982 57.656 1.00 0.00 H ATOM 61287 H2 WAT 2902 92.251 143.823 57.317 1.00 0.00 H TER 61289 WAT 2902 ATOM 61289 O WAT 2903 79.940 18.469 124.235 1.00 0.00 O ATOM 61290 H1 WAT 2903 80.059 18.173 125.137 1.00 0.00 H ATOM 61291 H2 WAT 2903 80.291 17.757 123.701 1.00 0.00 H TER 61293 WAT 2903 ATOM 61293 O WAT 2904 6.108 13.842 102.506 1.00 0.00 O ATOM 61294 H1 WAT 2904 6.111 13.442 101.636 1.00 0.00 H ATOM 61295 H2 WAT 2904 6.045 13.101 103.110 1.00 0.00 H TER 61297 WAT 2904 ATOM 61297 O WAT 2905 137.992 77.560 3.048 1.00 0.00 O ATOM 61298 H1 WAT 2905 138.851 77.909 3.287 1.00 0.00 H ATOM 61299 H2 WAT 2905 137.968 76.690 3.448 1.00 0.00 H TER 61301 WAT 2905 ATOM 61301 O WAT 2906 57.596 119.431 157.988 1.00 0.00 O ATOM 61302 H1 WAT 2906 57.032 119.852 158.637 1.00 0.00 H ATOM 61303 H2 WAT 2906 57.919 118.644 158.426 1.00 0.00 H TER 61305 WAT 2906 ATOM 61305 O WAT 2907 139.555 63.215 158.655 1.00 0.00 O ATOM 61306 H1 WAT 2907 139.550 62.612 157.911 1.00 0.00 H ATOM 61307 H2 WAT 2907 138.923 63.894 158.417 1.00 0.00 H TER 61309 WAT 2907 ATOM 61309 O WAT 2908 12.404 140.858 107.841 1.00 0.00 O ATOM 61310 H1 WAT 2908 13.271 140.463 107.749 1.00 0.00 H ATOM 61311 H2 WAT 2908 12.531 141.573 108.464 1.00 0.00 H TER 61313 WAT 2908 ATOM 61313 O WAT 2909 91.111 20.313 82.508 1.00 0.00 O ATOM 61314 H1 WAT 2909 91.557 20.717 83.252 1.00 0.00 H ATOM 61315 H2 WAT 2909 90.364 19.856 82.895 1.00 0.00 H TER 61317 WAT 2909 ATOM 61317 O WAT 2910 118.091 78.380 93.733 1.00 0.00 O ATOM 61318 H1 WAT 2910 117.910 78.736 92.864 1.00 0.00 H ATOM 61319 H2 WAT 2910 119.019 78.565 93.880 1.00 0.00 H TER 61321 WAT 2910 ATOM 61321 O WAT 2911 25.290 45.021 145.373 1.00 0.00 O ATOM 61322 H1 WAT 2911 25.407 45.671 144.680 1.00 0.00 H ATOM 61323 H2 WAT 2911 24.341 44.931 145.458 1.00 0.00 H TER 61325 WAT 2911 ATOM 61325 O WAT 2912 108.800 111.579 4.468 1.00 0.00 O ATOM 61326 H1 WAT 2912 109.056 110.848 3.905 1.00 0.00 H ATOM 61327 H2 WAT 2912 107.845 111.532 4.502 1.00 0.00 H TER 61329 WAT 2912 ATOM 61329 O WAT 2913 139.921 120.416 140.812 1.00 0.00 O ATOM 61330 H1 WAT 2913 139.187 119.984 140.376 1.00 0.00 H ATOM 61331 H2 WAT 2913 139.560 121.245 141.125 1.00 0.00 H TER 61333 WAT 2913 ATOM 61333 O WAT 2914 62.023 101.210 115.438 1.00 0.00 O ATOM 61334 H1 WAT 2914 62.450 101.122 114.586 1.00 0.00 H ATOM 61335 H2 WAT 2914 61.434 101.957 115.334 1.00 0.00 H TER 61337 WAT 2914 ATOM 61337 O WAT 2915 118.448 110.658 83.014 1.00 0.00 O ATOM 61338 H1 WAT 2915 119.397 110.780 83.010 1.00 0.00 H ATOM 61339 H2 WAT 2915 118.095 111.513 82.766 1.00 0.00 H TER 61341 WAT 2915 ATOM 61341 O WAT 2916 96.371 14.656 91.183 1.00 0.00 O ATOM 61342 H1 WAT 2916 96.194 14.112 90.416 1.00 0.00 H ATOM 61343 H2 WAT 2916 95.678 15.316 91.174 1.00 0.00 H TER 61345 WAT 2916 ATOM 61345 O WAT 2917 97.659 119.708 63.126 1.00 0.00 O ATOM 61346 H1 WAT 2917 96.766 119.368 63.189 1.00 0.00 H ATOM 61347 H2 WAT 2917 98.117 119.319 63.871 1.00 0.00 H TER 61349 WAT 2917 ATOM 61349 O WAT 2918 78.657 89.902 64.445 1.00 0.00 O ATOM 61350 H1 WAT 2918 78.454 90.837 64.449 1.00 0.00 H ATOM 61351 H2 WAT 2918 79.015 89.738 63.572 1.00 0.00 H TER 61353 WAT 2918 ATOM 61353 O WAT 2919 124.807 29.829 116.546 1.00 0.00 O ATOM 61354 H1 WAT 2919 125.534 30.354 116.214 1.00 0.00 H ATOM 61355 H2 WAT 2919 124.840 29.022 116.033 1.00 0.00 H TER 61357 WAT 2919 ATOM 61357 O WAT 2920 33.469 134.510 57.784 1.00 0.00 O ATOM 61358 H1 WAT 2920 34.227 134.875 57.326 1.00 0.00 H ATOM 61359 H2 WAT 2920 32.744 134.615 57.168 1.00 0.00 H TER 61361 WAT 2920 ATOM 61361 O WAT 2921 93.020 48.106 129.560 1.00 0.00 O ATOM 61362 H1 WAT 2921 93.299 48.509 128.738 1.00 0.00 H ATOM 61363 H2 WAT 2921 92.075 47.995 129.464 1.00 0.00 H TER 61365 WAT 2921 ATOM 61365 O WAT 2922 43.793 111.597 146.816 1.00 0.00 O ATOM 61366 H1 WAT 2922 42.847 111.453 146.825 1.00 0.00 H ATOM 61367 H2 WAT 2922 43.941 112.263 147.488 1.00 0.00 H TER 61369 WAT 2922 ATOM 61369 O WAT 2923 113.795 49.514 99.630 1.00 0.00 O ATOM 61370 H1 WAT 2923 113.765 48.654 99.210 1.00 0.00 H ATOM 61371 H2 WAT 2923 114.306 49.373 100.427 1.00 0.00 H TER 61373 WAT 2923 ATOM 61373 O WAT 2924 58.717 129.760 63.159 1.00 0.00 O ATOM 61374 H1 WAT 2924 58.765 128.986 62.597 1.00 0.00 H ATOM 61375 H2 WAT 2924 58.686 130.497 62.549 1.00 0.00 H TER 61377 WAT 2924 ATOM 61377 O WAT 2925 69.725 12.877 9.891 1.00 0.00 O ATOM 61378 H1 WAT 2925 69.212 13.234 10.616 1.00 0.00 H ATOM 61379 H2 WAT 2925 69.156 12.213 9.501 1.00 0.00 H TER 61381 WAT 2925 ATOM 61381 O WAT 2926 109.668 68.598 126.528 1.00 0.00 O ATOM 61382 H1 WAT 2926 109.088 67.868 126.311 1.00 0.00 H ATOM 61383 H2 WAT 2926 109.560 69.213 125.802 1.00 0.00 H TER 61385 WAT 2926 ATOM 61385 O WAT 2927 8.226 38.065 146.319 1.00 0.00 O ATOM 61386 H1 WAT 2927 9.077 37.722 146.592 1.00 0.00 H ATOM 61387 H2 WAT 2927 7.637 37.312 146.368 1.00 0.00 H TER 61389 WAT 2927 ATOM 61389 O WAT 2928 84.703 123.942 0.919 1.00 0.00 O ATOM 61390 H1 WAT 2928 83.813 123.756 1.220 1.00 0.00 H ATOM 61391 H2 WAT 2928 84.968 124.713 1.420 1.00 0.00 H TER 61393 WAT 2928 ATOM 61393 O WAT 2929 110.626 44.207 133.977 1.00 0.00 O ATOM 61394 H1 WAT 2929 110.900 44.232 134.894 1.00 0.00 H ATOM 61395 H2 WAT 2929 109.793 44.678 133.963 1.00 0.00 H TER 61397 WAT 2929 ATOM 61397 O WAT 2930 29.506 59.696 6.022 1.00 0.00 O ATOM 61398 H1 WAT 2930 30.376 59.412 5.744 1.00 0.00 H ATOM 61399 H2 WAT 2930 29.577 59.791 6.972 1.00 0.00 H TER 61401 WAT 2930 ATOM 61401 O WAT 2931 90.272 11.643 7.854 1.00 0.00 O ATOM 61402 H1 WAT 2931 90.692 12.376 7.404 1.00 0.00 H ATOM 61403 H2 WAT 2931 90.739 10.870 7.538 1.00 0.00 H TER 61405 WAT 2931 ATOM 61405 O WAT 2932 106.508 91.330 77.746 1.00 0.00 O ATOM 61406 H1 WAT 2932 107.019 92.045 77.366 1.00 0.00 H ATOM 61407 H2 WAT 2932 106.627 91.427 78.691 1.00 0.00 H TER 61409 WAT 2932 ATOM 61409 O WAT 2933 18.434 96.543 113.974 1.00 0.00 O ATOM 61410 H1 WAT 2933 17.591 96.964 113.801 1.00 0.00 H ATOM 61411 H2 WAT 2933 18.327 95.650 113.646 1.00 0.00 H TER 61413 WAT 2933 ATOM 61413 O WAT 2934 141.106 134.942 62.035 1.00 0.00 O ATOM 61414 H1 WAT 2934 141.368 134.068 62.327 1.00 0.00 H ATOM 61415 H2 WAT 2934 140.456 134.781 61.352 1.00 0.00 H TER 61417 WAT 2934 ATOM 61417 O WAT 2935 14.656 36.264 17.146 1.00 0.00 O ATOM 61418 H1 WAT 2935 15.420 36.663 16.729 1.00 0.00 H ATOM 61419 H2 WAT 2935 14.684 36.581 18.049 1.00 0.00 H TER 61421 WAT 2935 ATOM 61421 O WAT 2936 11.355 41.963 95.085 1.00 0.00 O ATOM 61422 H1 WAT 2936 10.819 41.574 94.395 1.00 0.00 H ATOM 61423 H2 WAT 2936 12.246 41.946 94.735 1.00 0.00 H TER 61425 WAT 2936 ATOM 61425 O WAT 2937 116.734 83.000 119.757 1.00 0.00 O ATOM 61426 H1 WAT 2937 116.554 82.546 118.934 1.00 0.00 H ATOM 61427 H2 WAT 2937 115.965 83.553 119.898 1.00 0.00 H TER 61429 WAT 2937 ATOM 61429 O WAT 2938 73.775 126.544 94.163 1.00 0.00 O ATOM 61430 H1 WAT 2938 73.108 126.848 94.778 1.00 0.00 H ATOM 61431 H2 WAT 2938 73.683 127.121 93.405 1.00 0.00 H TER 61433 WAT 2938 ATOM 61433 O WAT 2939 86.521 137.506 116.999 1.00 0.00 O ATOM 61434 H1 WAT 2939 85.639 137.750 117.279 1.00 0.00 H ATOM 61435 H2 WAT 2939 86.418 137.245 116.084 1.00 0.00 H TER 61437 WAT 2939 ATOM 61437 O WAT 2940 95.363 135.726 126.121 1.00 0.00 O ATOM 61438 H1 WAT 2940 94.594 135.193 125.919 1.00 0.00 H ATOM 61439 H2 WAT 2940 95.562 135.523 127.035 1.00 0.00 H TER 61441 WAT 2940 ATOM 61441 O WAT 2941 3.547 119.601 110.871 1.00 0.00 O ATOM 61442 H1 WAT 2941 4.322 119.380 110.355 1.00 0.00 H ATOM 61443 H2 WAT 2941 2.878 118.984 110.574 1.00 0.00 H TER 61445 WAT 2941 ATOM 61445 O WAT 2942 8.059 3.931 131.975 1.00 0.00 O ATOM 61446 H1 WAT 2942 7.710 3.267 131.380 1.00 0.00 H ATOM 61447 H2 WAT 2942 7.291 4.424 132.261 1.00 0.00 H TER 61449 WAT 2942 ATOM 61449 O WAT 2943 106.915 39.435 105.041 1.00 0.00 O ATOM 61450 H1 WAT 2943 106.524 38.764 104.482 1.00 0.00 H ATOM 61451 H2 WAT 2943 107.835 39.460 104.777 1.00 0.00 H TER 61453 WAT 2943 ATOM 61453 O WAT 2944 52.978 37.381 115.693 1.00 0.00 O ATOM 61454 H1 WAT 2944 52.023 37.429 115.669 1.00 0.00 H ATOM 61455 H2 WAT 2944 53.173 36.854 116.468 1.00 0.00 H TER 61457 WAT 2944 ATOM 61457 O WAT 2945 136.992 107.539 76.196 1.00 0.00 O ATOM 61458 H1 WAT 2945 137.288 107.530 77.106 1.00 0.00 H ATOM 61459 H2 WAT 2945 137.595 106.949 75.743 1.00 0.00 H TER 61461 WAT 2945 ATOM 61461 O WAT 2946 120.366 105.128 12.202 1.00 0.00 O ATOM 61462 H1 WAT 2946 121.071 105.411 12.785 1.00 0.00 H ATOM 61463 H2 WAT 2946 119.705 104.758 12.788 1.00 0.00 H TER 61465 WAT 2946 ATOM 61465 O WAT 2947 77.816 132.998 131.416 1.00 0.00 O ATOM 61466 H1 WAT 2947 76.949 133.093 131.812 1.00 0.00 H ATOM 61467 H2 WAT 2947 77.747 132.212 130.875 1.00 0.00 H TER 61469 WAT 2947 ATOM 61469 O WAT 2948 97.879 6.565 120.865 1.00 0.00 O ATOM 61470 H1 WAT 2948 97.519 7.451 120.852 1.00 0.00 H ATOM 61471 H2 WAT 2948 98.341 6.506 121.702 1.00 0.00 H TER 61473 WAT 2948 ATOM 61473 O WAT 2949 71.009 121.321 135.885 1.00 0.00 O ATOM 61474 H1 WAT 2949 70.443 120.551 135.937 1.00 0.00 H ATOM 61475 H2 WAT 2949 70.969 121.707 136.760 1.00 0.00 H TER 61477 WAT 2949 ATOM 61477 O WAT 2950 128.674 68.281 82.729 1.00 0.00 O ATOM 61478 H1 WAT 2950 128.696 68.614 83.626 1.00 0.00 H ATOM 61479 H2 WAT 2950 128.384 67.373 82.817 1.00 0.00 H TER 61481 WAT 2950 ATOM 61481 O WAT 2951 19.938 38.954 84.817 1.00 0.00 O ATOM 61482 H1 WAT 2951 20.805 39.308 85.015 1.00 0.00 H ATOM 61483 H2 WAT 2951 19.652 38.550 85.637 1.00 0.00 H TER 61485 WAT 2951 ATOM 61485 O WAT 2952 65.518 127.587 122.136 1.00 0.00 O ATOM 61486 H1 WAT 2952 65.923 127.473 121.276 1.00 0.00 H ATOM 61487 H2 WAT 2952 65.807 126.827 122.640 1.00 0.00 H TER 61489 WAT 2952 ATOM 61489 O WAT 2953 113.320 25.632 73.231 1.00 0.00 O ATOM 61490 H1 WAT 2953 113.019 26.101 74.010 1.00 0.00 H ATOM 61491 H2 WAT 2953 113.898 26.252 72.786 1.00 0.00 H TER 61493 WAT 2953 ATOM 61493 O WAT 2954 120.256 52.425 17.132 1.00 0.00 O ATOM 61494 H1 WAT 2954 119.906 52.397 18.022 1.00 0.00 H ATOM 61495 H2 WAT 2954 120.791 53.219 17.110 1.00 0.00 H TER 61497 WAT 2954 ATOM 61497 O WAT 2955 34.713 48.985 55.173 1.00 0.00 O ATOM 61498 H1 WAT 2955 33.815 49.216 55.411 1.00 0.00 H ATOM 61499 H2 WAT 2955 35.177 48.937 56.009 1.00 0.00 H TER 61501 WAT 2955 ATOM 61501 O WAT 2956 112.226 126.029 7.629 1.00 0.00 O ATOM 61502 H1 WAT 2956 111.933 126.389 6.791 1.00 0.00 H ATOM 61503 H2 WAT 2956 111.604 126.375 8.269 1.00 0.00 H TER 61505 WAT 2956 ATOM 61505 O WAT 2957 97.875 63.581 85.735 1.00 0.00 O ATOM 61506 H1 WAT 2957 98.404 62.787 85.649 1.00 0.00 H ATOM 61507 H2 WAT 2957 97.203 63.353 86.378 1.00 0.00 H TER 61509 WAT 2957 ATOM 61509 O WAT 2958 142.197 92.523 129.630 1.00 0.00 O ATOM 61510 H1 WAT 2958 141.575 92.013 129.112 1.00 0.00 H ATOM 61511 H2 WAT 2958 143.053 92.159 129.403 1.00 0.00 H TER 61513 WAT 2958 ATOM 61513 O WAT 2959 42.100 0.993 78.855 1.00 0.00 O ATOM 61514 H1 WAT 2959 41.674 0.735 78.037 1.00 0.00 H ATOM 61515 H2 WAT 2959 41.684 1.822 79.091 1.00 0.00 H TER 61517 WAT 2959 ATOM 61517 O WAT 2960 19.725 132.758 20.913 1.00 0.00 O ATOM 61518 H1 WAT 2960 20.141 133.152 20.147 1.00 0.00 H ATOM 61519 H2 WAT 2960 19.865 131.818 20.805 1.00 0.00 H TER 61521 WAT 2960 ATOM 61521 O WAT 2961 84.175 5.341 57.761 1.00 0.00 O ATOM 61522 H1 WAT 2961 84.554 5.684 56.952 1.00 0.00 H ATOM 61523 H2 WAT 2961 84.907 4.915 58.206 1.00 0.00 H TER 61525 WAT 2961 ATOM 61525 O WAT 2962 51.403 64.863 65.431 1.00 0.00 O ATOM 61526 H1 WAT 2962 52.274 65.223 65.595 1.00 0.00 H ATOM 61527 H2 WAT 2962 50.967 64.892 66.282 1.00 0.00 H TER 61529 WAT 2962 ATOM 61529 O WAT 2963 75.274 79.295 105.339 1.00 0.00 O ATOM 61530 H1 WAT 2963 74.682 79.327 104.587 1.00 0.00 H ATOM 61531 H2 WAT 2963 76.149 79.258 104.953 1.00 0.00 H TER 61533 WAT 2963 ATOM 61533 O WAT 2964 56.286 78.682 15.915 1.00 0.00 O ATOM 61534 H1 WAT 2964 55.354 78.469 15.951 1.00 0.00 H ATOM 61535 H2 WAT 2964 56.395 79.139 15.081 1.00 0.00 H TER 61537 WAT 2964 ATOM 61537 O WAT 2965 61.619 48.019 24.689 1.00 0.00 O ATOM 61538 H1 WAT 2965 60.990 47.735 24.026 1.00 0.00 H ATOM 61539 H2 WAT 2965 61.399 48.936 24.851 1.00 0.00 H TER 61541 WAT 2965 ATOM 61541 O WAT 2966 38.620 70.001 14.058 1.00 0.00 O ATOM 61542 H1 WAT 2966 38.262 70.854 14.305 1.00 0.00 H ATOM 61543 H2 WAT 2966 39.115 69.717 14.825 1.00 0.00 H TER 61545 WAT 2966 ATOM 61545 O WAT 2967 20.264 141.650 93.641 1.00 0.00 O ATOM 61546 H1 WAT 2967 20.459 140.970 92.997 1.00 0.00 H ATOM 61547 H2 WAT 2967 20.768 141.399 94.415 1.00 0.00 H TER 61549 WAT 2967 ATOM 61549 O WAT 2968 115.680 14.866 68.334 1.00 0.00 O ATOM 61550 H1 WAT 2968 116.153 14.034 68.338 1.00 0.00 H ATOM 61551 H2 WAT 2968 115.208 14.878 69.166 1.00 0.00 H TER 61553 WAT 2968 ATOM 61553 O WAT 2969 131.655 114.195 145.450 1.00 0.00 O ATOM 61554 H1 WAT 2969 131.088 114.888 145.110 1.00 0.00 H ATOM 61555 H2 WAT 2969 131.790 113.609 144.706 1.00 0.00 H TER 61557 WAT 2969 ATOM 61557 O WAT 2970 109.897 24.995 93.121 1.00 0.00 O ATOM 61558 H1 WAT 2970 109.602 25.056 92.212 1.00 0.00 H ATOM 61559 H2 WAT 2970 110.838 24.828 93.056 1.00 0.00 H TER 61561 WAT 2970 ATOM 61561 O WAT 2971 71.719 20.008 149.554 1.00 0.00 O ATOM 61562 H1 WAT 2971 72.553 19.845 149.994 1.00 0.00 H ATOM 61563 H2 WAT 2971 71.965 20.369 148.702 1.00 0.00 H TER 61565 WAT 2971 ATOM 61565 O WAT 2972 63.895 51.967 121.609 1.00 0.00 O ATOM 61566 H1 WAT 2972 64.824 51.935 121.380 1.00 0.00 H ATOM 61567 H2 WAT 2972 63.886 52.134 122.552 1.00 0.00 H TER 61569 WAT 2972 ATOM 61569 O WAT 2973 100.718 120.923 0.433 1.00 0.00 O ATOM 61570 H1 WAT 2973 100.558 120.131 -0.081 1.00 0.00 H ATOM 61571 H2 WAT 2973 100.776 121.623 -0.218 1.00 0.00 H TER 61573 WAT 2973 ATOM 61573 O WAT 2974 30.796 6.283 58.693 1.00 0.00 O ATOM 61574 H1 WAT 2974 31.111 7.114 58.338 1.00 0.00 H ATOM 61575 H2 WAT 2974 31.582 5.855 59.035 1.00 0.00 H TER 61577 WAT 2974 ATOM 61577 O WAT 2975 141.922 134.652 79.156 1.00 0.00 O ATOM 61578 H1 WAT 2975 141.359 134.532 78.392 1.00 0.00 H ATOM 61579 H2 WAT 2975 142.388 133.821 79.243 1.00 0.00 H TER 61581 WAT 2975 ATOM 61581 O WAT 2976 11.740 102.863 127.887 1.00 0.00 O ATOM 61582 H1 WAT 2976 12.298 103.196 128.589 1.00 0.00 H ATOM 61583 H2 WAT 2976 12.351 102.609 127.195 1.00 0.00 H TER 61585 WAT 2976 ATOM 61585 O WAT 2977 15.455 68.172 145.553 1.00 0.00 O ATOM 61586 H1 WAT 2977 15.167 69.071 145.714 1.00 0.00 H ATOM 61587 H2 WAT 2977 16.065 67.985 146.266 1.00 0.00 H TER 61589 WAT 2977 ATOM 61589 O WAT 2978 99.598 3.538 126.136 1.00 0.00 O ATOM 61590 H1 WAT 2978 100.189 2.831 126.394 1.00 0.00 H ATOM 61591 H2 WAT 2978 98.917 3.539 126.808 1.00 0.00 H TER 61593 WAT 2978 ATOM 61593 O WAT 2979 30.817 87.285 17.064 1.00 0.00 O ATOM 61594 H1 WAT 2979 29.947 87.108 17.420 1.00 0.00 H ATOM 61595 H2 WAT 2979 31.320 86.494 17.258 1.00 0.00 H TER 61597 WAT 2979 ATOM 61597 O WAT 2980 129.542 100.941 149.221 1.00 0.00 O ATOM 61598 H1 WAT 2980 129.852 101.016 148.319 1.00 0.00 H ATOM 61599 H2 WAT 2980 129.268 100.027 149.304 1.00 0.00 H TER 61601 WAT 2980 ATOM 61601 O WAT 2981 121.020 80.704 8.900 1.00 0.00 O ATOM 61602 H1 WAT 2981 121.060 80.038 8.213 1.00 0.00 H ATOM 61603 H2 WAT 2981 121.876 81.133 8.868 1.00 0.00 H TER 61605 WAT 2981 ATOM 61605 O WAT 2982 74.691 144.183 24.359 1.00 0.00 O ATOM 61606 H1 WAT 2982 74.132 143.522 23.952 1.00 0.00 H ATOM 61607 H2 WAT 2982 75.577 143.955 24.076 1.00 0.00 H TER 61609 WAT 2982 ATOM 61609 O WAT 2983 135.849 63.753 10.563 1.00 0.00 O ATOM 61610 H1 WAT 2983 135.323 64.128 11.269 1.00 0.00 H ATOM 61611 H2 WAT 2983 136.753 63.963 10.801 1.00 0.00 H TER 61613 WAT 2983 ATOM 61613 O WAT 2984 68.208 132.364 11.523 1.00 0.00 O ATOM 61614 H1 WAT 2984 68.942 131.856 11.177 1.00 0.00 H ATOM 61615 H2 WAT 2984 68.550 132.764 12.323 1.00 0.00 H TER 61617 WAT 2984 ATOM 61617 O WAT 2985 34.194 0.955 54.474 1.00 0.00 O ATOM 61618 H1 WAT 2985 33.724 1.055 55.301 1.00 0.00 H ATOM 61619 H2 WAT 2985 35.118 0.937 54.724 1.00 0.00 H TER 61621 WAT 2985 ATOM 61621 O WAT 2986 19.437 64.975 156.925 1.00 0.00 O ATOM 61622 H1 WAT 2986 20.224 65.497 157.085 1.00 0.00 H ATOM 61623 H2 WAT 2986 19.556 64.191 157.460 1.00 0.00 H TER 61625 WAT 2986 ATOM 61625 O WAT 2987 77.083 67.981 134.586 1.00 0.00 O ATOM 61626 H1 WAT 2987 76.636 67.884 133.745 1.00 0.00 H ATOM 61627 H2 WAT 2987 76.675 68.750 134.986 1.00 0.00 H TER 61629 WAT 2987 ATOM 61629 O WAT 2988 68.002 129.764 104.499 1.00 0.00 O ATOM 61630 H1 WAT 2988 67.049 129.803 104.587 1.00 0.00 H ATOM 61631 H2 WAT 2988 68.294 130.660 104.669 1.00 0.00 H TER 61633 WAT 2988 ATOM 61633 O WAT 2989 49.523 140.697 104.964 1.00 0.00 O ATOM 61634 H1 WAT 2989 49.364 140.211 105.773 1.00 0.00 H ATOM 61635 H2 WAT 2989 49.663 140.020 104.301 1.00 0.00 H TER 61637 WAT 2989 ATOM 61637 O WAT 2990 32.468 23.752 72.657 1.00 0.00 O ATOM 61638 H1 WAT 2990 32.341 23.861 71.715 1.00 0.00 H ATOM 61639 H2 WAT 2990 31.588 23.604 73.002 1.00 0.00 H TER 61641 WAT 2990 ATOM 61641 O WAT 2991 46.102 85.710 153.433 1.00 0.00 O ATOM 61642 H1 WAT 2991 45.870 86.080 152.581 1.00 0.00 H ATOM 61643 H2 WAT 2991 47.047 85.842 153.502 1.00 0.00 H TER 61645 WAT 2991 ATOM 61645 O WAT 2992 71.343 109.170 64.490 1.00 0.00 O ATOM 61646 H1 WAT 2992 71.644 109.586 65.298 1.00 0.00 H ATOM 61647 H2 WAT 2992 71.481 108.234 64.637 1.00 0.00 H TER 61649 WAT 2992 ATOM 61649 O WAT 2993 47.451 41.653 68.843 1.00 0.00 O ATOM 61650 H1 WAT 2993 46.806 41.926 69.496 1.00 0.00 H ATOM 61651 H2 WAT 2993 47.734 40.786 69.134 1.00 0.00 H TER 61653 WAT 2993 ATOM 61653 O WAT 2994 142.844 39.780 125.595 1.00 0.00 O ATOM 61654 H1 WAT 2994 143.428 40.243 124.994 1.00 0.00 H ATOM 61655 H2 WAT 2994 142.244 40.455 125.914 1.00 0.00 H TER 61657 WAT 2994 ATOM 61657 O WAT 2995 137.655 90.961 135.938 1.00 0.00 O ATOM 61658 H1 WAT 2995 138.316 90.556 135.375 1.00 0.00 H ATOM 61659 H2 WAT 2995 136.825 90.788 135.495 1.00 0.00 H TER 61661 WAT 2995 ATOM 61661 O WAT 2996 76.643 112.397 141.057 1.00 0.00 O ATOM 61662 H1 WAT 2996 75.980 111.774 141.354 1.00 0.00 H ATOM 61663 H2 WAT 2996 77.085 112.676 141.859 1.00 0.00 H TER 61665 WAT 2996 ATOM 61665 O WAT 2997 4.222 88.848 92.886 1.00 0.00 O ATOM 61666 H1 WAT 2997 4.475 89.368 93.649 1.00 0.00 H ATOM 61667 H2 WAT 2997 4.477 89.384 92.136 1.00 0.00 H TER 61669 WAT 2997 ATOM 61669 O WAT 2998 26.110 41.123 152.608 1.00 0.00 O ATOM 61670 H1 WAT 2998 26.011 42.075 152.581 1.00 0.00 H ATOM 61671 H2 WAT 2998 26.151 40.860 151.689 1.00 0.00 H TER 61673 WAT 2998 ATOM 61673 O WAT 2999 86.769 119.146 71.804 1.00 0.00 O ATOM 61674 H1 WAT 2999 87.001 118.269 72.107 1.00 0.00 H ATOM 61675 H2 WAT 2999 87.521 119.426 71.282 1.00 0.00 H TER 61677 WAT 2999 ATOM 61677 O WAT 3000 32.024 56.438 104.280 1.00 0.00 O ATOM 61678 H1 WAT 3000 31.994 57.128 104.943 1.00 0.00 H ATOM 61679 H2 WAT 3000 31.274 55.879 104.482 1.00 0.00 H TER 61681 WAT 3000 ATOM 61681 O WAT 3001 7.441 88.360 90.090 1.00 0.00 O ATOM 61682 H1 WAT 3001 7.023 87.762 90.709 1.00 0.00 H ATOM 61683 H2 WAT 3001 7.163 89.231 90.373 1.00 0.00 H TER 61685 WAT 3001 ATOM 61685 O WAT 3002 122.265 124.381 69.347 1.00 0.00 O ATOM 61686 H1 WAT 3002 122.638 123.730 69.941 1.00 0.00 H ATOM 61687 H2 WAT 3002 121.649 124.875 69.889 1.00 0.00 H TER 61689 WAT 3002 ATOM 61689 O WAT 3003 36.175 30.243 4.585 1.00 0.00 O ATOM 61690 H1 WAT 3003 37.019 29.981 4.219 1.00 0.00 H ATOM 61691 H2 WAT 3003 35.530 29.925 3.954 1.00 0.00 H TER 61693 WAT 3003 ATOM 61693 O WAT 3004 94.178 68.048 59.450 1.00 0.00 O ATOM 61694 H1 WAT 3004 93.472 68.565 59.838 1.00 0.00 H ATOM 61695 H2 WAT 3004 94.609 67.633 60.198 1.00 0.00 H TER 61697 WAT 3004 ATOM 61697 O WAT 3005 11.914 16.071 120.251 1.00 0.00 O ATOM 61698 H1 WAT 3005 11.122 16.148 120.782 1.00 0.00 H ATOM 61699 H2 WAT 3005 12.617 16.380 120.823 1.00 0.00 H TER 61701 WAT 3005 ATOM 61701 O WAT 3006 123.495 107.937 6.415 1.00 0.00 O ATOM 61702 H1 WAT 3006 123.489 108.031 7.368 1.00 0.00 H ATOM 61703 H2 WAT 3006 123.242 108.801 6.088 1.00 0.00 H TER 61705 WAT 3006 ATOM 61705 O WAT 3007 126.707 140.710 152.522 1.00 0.00 O ATOM 61706 H1 WAT 3007 126.292 141.293 151.886 1.00 0.00 H ATOM 61707 H2 WAT 3007 127.560 141.108 152.692 1.00 0.00 H TER 61709 WAT 3007 ATOM 61709 O WAT 3008 59.146 141.496 127.371 1.00 0.00 O ATOM 61710 H1 WAT 3008 59.362 142.073 126.639 1.00 0.00 H ATOM 61711 H2 WAT 3008 58.669 140.769 126.970 1.00 0.00 H TER 61713 WAT 3008 ATOM 61713 O WAT 3009 72.693 112.462 25.289 1.00 0.00 O ATOM 61714 H1 WAT 3009 72.998 113.356 25.442 1.00 0.00 H ATOM 61715 H2 WAT 3009 73.137 112.191 24.486 1.00 0.00 H TER 61717 WAT 3009 ATOM 61717 O WAT 3010 7.158 20.971 121.436 1.00 0.00 O ATOM 61718 H1 WAT 3010 7.673 20.475 120.799 1.00 0.00 H ATOM 61719 H2 WAT 3010 7.797 21.266 122.084 1.00 0.00 H TER 61721 WAT 3010 ATOM 61721 O WAT 3011 71.706 90.176 59.776 1.00 0.00 O ATOM 61722 H1 WAT 3011 71.994 89.695 59.000 1.00 0.00 H ATOM 61723 H2 WAT 3011 70.941 89.692 60.088 1.00 0.00 H TER 61725 WAT 3011 ATOM 61725 O WAT 3012 136.631 143.193 16.904 1.00 0.00 O ATOM 61726 H1 WAT 3012 137.069 142.436 16.516 1.00 0.00 H ATOM 61727 H2 WAT 3012 135.942 142.816 17.452 1.00 0.00 H TER 61729 WAT 3012 ATOM 61729 O WAT 3013 133.747 133.492 14.874 1.00 0.00 O ATOM 61730 H1 WAT 3013 133.655 133.761 15.789 1.00 0.00 H ATOM 61731 H2 WAT 3013 134.618 133.097 14.827 1.00 0.00 H TER 61733 WAT 3013 ATOM 61733 O WAT 3014 107.626 3.655 115.742 1.00 0.00 O ATOM 61734 H1 WAT 3014 107.720 3.307 116.628 1.00 0.00 H ATOM 61735 H2 WAT 3014 106.794 4.128 115.757 1.00 0.00 H TER 61737 WAT 3014 ATOM 61737 O WAT 3015 29.161 96.541 103.289 1.00 0.00 O ATOM 61738 H1 WAT 3015 28.395 96.135 103.694 1.00 0.00 H ATOM 61739 H2 WAT 3015 29.233 97.395 103.714 1.00 0.00 H TER 61741 WAT 3015 ATOM 61741 O WAT 3016 101.454 68.737 60.249 1.00 0.00 O ATOM 61742 H1 WAT 3016 101.478 67.955 59.698 1.00 0.00 H ATOM 61743 H2 WAT 3016 101.244 69.449 59.644 1.00 0.00 H TER 61745 WAT 3016 ATOM 61745 O WAT 3017 1.715 28.118 67.064 1.00 0.00 O ATOM 61746 H1 WAT 3017 2.509 28.641 67.174 1.00 0.00 H ATOM 61747 H2 WAT 3017 1.890 27.575 66.296 1.00 0.00 H TER 61749 WAT 3017 ATOM 61749 O WAT 3018 60.330 120.175 92.311 1.00 0.00 O ATOM 61750 H1 WAT 3018 60.216 121.086 92.583 1.00 0.00 H ATOM 61751 H2 WAT 3018 60.960 120.218 91.591 1.00 0.00 H TER 61753 WAT 3018 ATOM 61753 O WAT 3019 51.443 60.847 99.207 1.00 0.00 O ATOM 61754 H1 WAT 3019 52.327 60.638 99.509 1.00 0.00 H ATOM 61755 H2 WAT 3019 51.536 60.972 98.262 1.00 0.00 H TER 61757 WAT 3019 ATOM 61757 O WAT 3020 0.903 117.231 128.371 1.00 0.00 O ATOM 61758 H1 WAT 3020 0.797 117.522 127.465 1.00 0.00 H ATOM 61759 H2 WAT 3020 0.254 117.736 128.861 1.00 0.00 H TER 61761 WAT 3020 ATOM 61761 O WAT 3021 16.537 5.437 100.715 1.00 0.00 O ATOM 61762 H1 WAT 3021 17.202 6.092 100.930 1.00 0.00 H ATOM 61763 H2 WAT 3021 15.711 5.837 100.986 1.00 0.00 H TER 61765 WAT 3021 ATOM 61765 O WAT 3022 18.084 81.074 74.770 1.00 0.00 O ATOM 61766 H1 WAT 3022 17.301 80.880 75.284 1.00 0.00 H ATOM 61767 H2 WAT 3022 18.646 81.567 75.367 1.00 0.00 H TER 61769 WAT 3022 ATOM 61769 O WAT 3023 7.326 51.443 70.741 1.00 0.00 O ATOM 61770 H1 WAT 3023 7.651 51.705 71.603 1.00 0.00 H ATOM 61771 H2 WAT 3023 6.594 50.857 70.929 1.00 0.00 H TER 61773 WAT 3023 ATOM 61773 O WAT 3024 51.584 49.034 21.073 1.00 0.00 O ATOM 61774 H1 WAT 3024 52.042 49.219 20.253 1.00 0.00 H ATOM 61775 H2 WAT 3024 52.221 49.243 21.755 1.00 0.00 H TER 61777 WAT 3024 ATOM 61777 O WAT 3025 43.644 20.113 7.537 1.00 0.00 O ATOM 61778 H1 WAT 3025 44.127 20.624 6.887 1.00 0.00 H ATOM 61779 H2 WAT 3025 43.968 20.429 8.380 1.00 0.00 H TER 61781 WAT 3025 ATOM 61781 O WAT 3026 67.756 26.449 147.675 1.00 0.00 O ATOM 61782 H1 WAT 3026 68.065 25.544 147.636 1.00 0.00 H ATOM 61783 H2 WAT 3026 67.746 26.739 146.763 1.00 0.00 H TER 61785 WAT 3026 ATOM 61785 O WAT 3027 137.143 90.384 2.654 1.00 0.00 O ATOM 61786 H1 WAT 3027 137.467 90.503 1.761 1.00 0.00 H ATOM 61787 H2 WAT 3027 136.218 90.626 2.607 1.00 0.00 H TER 61789 WAT 3027 ATOM 61789 O WAT 3028 0.720 35.475 85.143 1.00 0.00 O ATOM 61790 H1 WAT 3028 1.042 35.967 85.898 1.00 0.00 H ATOM 61791 H2 WAT 3028 1.508 35.103 84.746 1.00 0.00 H TER 61793 WAT 3028 ATOM 61793 O WAT 3029 135.764 35.965 154.357 1.00 0.00 O ATOM 61794 H1 WAT 3029 134.836 36.186 154.281 1.00 0.00 H ATOM 61795 H2 WAT 3029 135.863 35.651 155.255 1.00 0.00 H TER 61797 WAT 3029 ATOM 61797 O WAT 3030 63.788 30.817 149.344 1.00 0.00 O ATOM 61798 H1 WAT 3030 64.741 30.857 149.425 1.00 0.00 H ATOM 61799 H2 WAT 3030 63.550 29.978 149.737 1.00 0.00 H TER 61801 WAT 3030 ATOM 61801 O WAT 3031 27.943 60.237 14.841 1.00 0.00 O ATOM 61802 H1 WAT 3031 27.734 59.375 15.200 1.00 0.00 H ATOM 61803 H2 WAT 3031 28.868 60.367 15.052 1.00 0.00 H TER 61805 WAT 3031 ATOM 61805 O WAT 3032 50.103 26.301 124.123 1.00 0.00 O ATOM 61806 H1 WAT 3032 50.878 26.823 123.915 1.00 0.00 H ATOM 61807 H2 WAT 3032 50.074 25.633 123.438 1.00 0.00 H TER 61809 WAT 3032 ATOM 61809 O WAT 3033 55.753 64.159 114.751 1.00 0.00 O ATOM 61810 H1 WAT 3033 56.492 63.875 114.212 1.00 0.00 H ATOM 61811 H2 WAT 3033 55.325 64.840 114.232 1.00 0.00 H TER 61813 WAT 3033 ATOM 61813 O WAT 3034 86.718 41.219 94.987 1.00 0.00 O ATOM 61814 H1 WAT 3034 86.310 41.140 94.124 1.00 0.00 H ATOM 61815 H2 WAT 3034 87.586 41.580 94.809 1.00 0.00 H TER 61817 WAT 3034 ATOM 61817 O WAT 3035 97.400 134.227 1.298 1.00 0.00 O ATOM 61818 H1 WAT 3035 98.065 133.680 1.716 1.00 0.00 H ATOM 61819 H2 WAT 3035 96.575 133.941 1.689 1.00 0.00 H TER 61821 WAT 3035 ATOM 61821 O WAT 3036 88.766 127.589 24.918 1.00 0.00 O ATOM 61822 H1 WAT 3036 88.720 127.231 25.805 1.00 0.00 H ATOM 61823 H2 WAT 3036 87.979 128.127 24.836 1.00 0.00 H TER 61825 WAT 3036 ATOM 61825 O WAT 3037 57.252 81.781 85.503 1.00 0.00 O ATOM 61826 H1 WAT 3037 57.438 81.854 84.567 1.00 0.00 H ATOM 61827 H2 WAT 3037 58.053 82.083 85.931 1.00 0.00 H TER 61829 WAT 3037 ATOM 61829 O WAT 3038 53.306 7.941 138.908 1.00 0.00 O ATOM 61830 H1 WAT 3038 53.097 8.800 139.273 1.00 0.00 H ATOM 61831 H2 WAT 3038 53.565 7.415 139.665 1.00 0.00 H TER 61833 WAT 3038 ATOM 61833 O WAT 3039 108.743 59.706 91.159 1.00 0.00 O ATOM 61834 H1 WAT 3039 108.208 60.498 91.209 1.00 0.00 H ATOM 61835 H2 WAT 3039 109.631 60.005 91.354 1.00 0.00 H TER 61837 WAT 3039 ATOM 61837 O WAT 3040 101.599 19.544 75.697 1.00 0.00 O ATOM 61838 H1 WAT 3040 101.929 18.839 76.253 1.00 0.00 H ATOM 61839 H2 WAT 3040 102.384 19.924 75.301 1.00 0.00 H TER 61841 WAT 3040 ATOM 61841 O WAT 3041 132.278 144.573 137.848 1.00 0.00 O ATOM 61842 H1 WAT 3041 132.285 144.955 138.725 1.00 0.00 H ATOM 61843 H2 WAT 3041 132.776 145.192 137.313 1.00 0.00 H TER 61845 WAT 3041 ATOM 61845 O WAT 3042 87.972 126.578 65.125 1.00 0.00 O ATOM 61846 H1 WAT 3042 88.509 126.225 65.834 1.00 0.00 H ATOM 61847 H2 WAT 3042 88.318 127.459 64.979 1.00 0.00 H TER 61849 WAT 3042 ATOM 61849 O WAT 3043 26.288 33.118 12.328 1.00 0.00 O ATOM 61850 H1 WAT 3043 27.030 32.954 12.911 1.00 0.00 H ATOM 61851 H2 WAT 3043 26.156 32.288 11.869 1.00 0.00 H TER 61853 WAT 3043 ATOM 61853 O WAT 3044 11.642 86.866 148.817 1.00 0.00 O ATOM 61854 H1 WAT 3044 10.993 87.560 148.930 1.00 0.00 H ATOM 61855 H2 WAT 3044 11.563 86.333 149.608 1.00 0.00 H TER 61857 WAT 3044 ATOM 61857 O WAT 3045 41.884 50.002 143.640 1.00 0.00 O ATOM 61858 H1 WAT 3045 41.554 49.702 142.794 1.00 0.00 H ATOM 61859 H2 WAT 3045 41.681 50.937 143.659 1.00 0.00 H TER 61861 WAT 3045 ATOM 61861 O WAT 3046 113.104 89.743 79.417 1.00 0.00 O ATOM 61862 H1 WAT 3046 112.510 89.980 78.705 1.00 0.00 H ATOM 61863 H2 WAT 3046 113.011 90.452 80.053 1.00 0.00 H TER 61865 WAT 3046 ATOM 61865 O WAT 3047 23.276 10.022 129.778 1.00 0.00 O ATOM 61866 H1 WAT 3047 24.098 9.711 130.157 1.00 0.00 H ATOM 61867 H2 WAT 3047 23.384 9.896 128.835 1.00 0.00 H TER 61869 WAT 3047 ATOM 61869 O WAT 3048 131.706 63.170 23.144 1.00 0.00 O ATOM 61870 H1 WAT 3048 132.608 63.483 23.208 1.00 0.00 H ATOM 61871 H2 WAT 3048 131.790 62.230 22.982 1.00 0.00 H TER 61873 WAT 3048 ATOM 61873 O WAT 3049 140.448 34.070 112.863 1.00 0.00 O ATOM 61874 H1 WAT 3049 140.516 34.883 112.362 1.00 0.00 H ATOM 61875 H2 WAT 3049 141.158 34.124 113.503 1.00 0.00 H TER 61877 WAT 3049 ATOM 61877 O WAT 3050 32.032 7.657 133.223 1.00 0.00 O ATOM 61878 H1 WAT 3050 32.710 7.079 133.571 1.00 0.00 H ATOM 61879 H2 WAT 3050 31.615 8.031 133.999 1.00 0.00 H TER 61881 WAT 3050 ATOM 61881 O WAT 3051 142.741 58.928 22.468 1.00 0.00 O ATOM 61882 H1 WAT 3051 142.002 58.345 22.294 1.00 0.00 H ATOM 61883 H2 WAT 3051 143.361 58.390 22.960 1.00 0.00 H TER 61885 WAT 3051 ATOM 61885 O WAT 3052 112.900 10.347 152.867 1.00 0.00 O ATOM 61886 H1 WAT 3052 112.768 10.207 151.930 1.00 0.00 H ATOM 61887 H2 WAT 3052 112.015 10.394 153.229 1.00 0.00 H TER 61889 WAT 3052 ATOM 61889 O WAT 3053 144.457 131.856 91.217 1.00 0.00 O ATOM 61890 H1 WAT 3053 144.296 131.659 92.140 1.00 0.00 H ATOM 61891 H2 WAT 3053 143.764 132.473 90.980 1.00 0.00 H TER 61893 WAT 3053 ATOM 61893 O WAT 3054 75.432 65.502 83.914 1.00 0.00 O ATOM 61894 H1 WAT 3054 75.244 65.062 84.743 1.00 0.00 H ATOM 61895 H2 WAT 3054 76.331 65.247 83.706 1.00 0.00 H TER 61897 WAT 3054 ATOM 61897 O WAT 3055 29.485 41.180 102.245 1.00 0.00 O ATOM 61898 H1 WAT 3055 29.546 42.118 102.428 1.00 0.00 H ATOM 61899 H2 WAT 3055 29.923 40.763 102.987 1.00 0.00 H TER 61901 WAT 3055 ATOM 61901 O WAT 3056 13.324 121.354 84.992 1.00 0.00 O ATOM 61902 H1 WAT 3056 13.084 122.162 85.444 1.00 0.00 H ATOM 61903 H2 WAT 3056 13.151 121.534 84.068 1.00 0.00 H TER 61905 WAT 3056 ATOM 61905 O WAT 3057 13.101 79.167 73.516 1.00 0.00 O ATOM 61906 H1 WAT 3057 13.329 78.586 74.242 1.00 0.00 H ATOM 61907 H2 WAT 3057 13.844 79.103 72.915 1.00 0.00 H TER 61909 WAT 3057 ATOM 61909 O WAT 3058 115.363 70.218 4.515 1.00 0.00 O ATOM 61910 H1 WAT 3058 114.816 69.522 4.149 1.00 0.00 H ATOM 61911 H2 WAT 3058 116.147 70.219 3.966 1.00 0.00 H TER 61913 WAT 3058 ATOM 61913 O WAT 3059 47.744 138.197 75.355 1.00 0.00 O ATOM 61914 H1 WAT 3059 47.755 138.649 74.511 1.00 0.00 H ATOM 61915 H2 WAT 3059 48.169 137.357 75.181 1.00 0.00 H TER 61917 WAT 3059 ATOM 61917 O WAT 3060 6.584 131.803 100.846 1.00 0.00 O ATOM 61918 H1 WAT 3060 7.282 132.447 100.725 1.00 0.00 H ATOM 61919 H2 WAT 3060 5.912 132.058 100.214 1.00 0.00 H TER 61921 WAT 3060 ATOM 61921 O WAT 3061 26.828 73.105 156.922 1.00 0.00 O ATOM 61922 H1 WAT 3061 26.277 73.855 156.697 1.00 0.00 H ATOM 61923 H2 WAT 3061 27.195 72.818 156.086 1.00 0.00 H TER 61925 WAT 3061 ATOM 61925 O WAT 3062 95.427 135.081 79.452 1.00 0.00 O ATOM 61926 H1 WAT 3062 96.057 134.373 79.314 1.00 0.00 H ATOM 61927 H2 WAT 3062 95.872 135.864 79.126 1.00 0.00 H TER 61929 WAT 3062 ATOM 61929 O WAT 3063 76.107 115.815 68.956 1.00 0.00 O ATOM 61930 H1 WAT 3063 75.519 116.165 69.625 1.00 0.00 H ATOM 61931 H2 WAT 3063 75.943 114.872 68.962 1.00 0.00 H TER 61933 WAT 3063 ATOM 61933 O WAT 3064 61.575 85.708 97.429 1.00 0.00 O ATOM 61934 H1 WAT 3064 62.037 85.643 98.265 1.00 0.00 H ATOM 61935 H2 WAT 3064 61.910 86.512 97.032 1.00 0.00 H TER 61937 WAT 3064 ATOM 61937 O WAT 3065 130.832 111.057 100.655 1.00 0.00 O ATOM 61938 H1 WAT 3065 130.908 111.843 101.197 1.00 0.00 H ATOM 61939 H2 WAT 3065 130.101 110.572 101.038 1.00 0.00 H TER 61941 WAT 3065 ATOM 61941 O WAT 3066 47.323 62.554 25.278 1.00 0.00 O ATOM 61942 H1 WAT 3066 46.802 62.879 26.012 1.00 0.00 H ATOM 61943 H2 WAT 3066 47.914 61.911 25.669 1.00 0.00 H TER 61945 WAT 3066 ATOM 61945 O WAT 3067 72.516 137.107 92.904 1.00 0.00 O ATOM 61946 H1 WAT 3067 71.810 137.746 92.806 1.00 0.00 H ATOM 61947 H2 WAT 3067 73.063 137.461 93.606 1.00 0.00 H TER 61949 WAT 3067 ATOM 61949 O WAT 3068 97.825 27.059 66.062 1.00 0.00 O ATOM 61950 H1 WAT 3068 98.523 27.510 66.537 1.00 0.00 H ATOM 61951 H2 WAT 3068 97.032 27.254 66.561 1.00 0.00 H TER 61953 WAT 3068 ATOM 61953 O WAT 3069 121.194 97.559 135.361 1.00 0.00 O ATOM 61954 H1 WAT 3069 121.282 97.746 134.426 1.00 0.00 H ATOM 61955 H2 WAT 3069 120.386 98.002 135.618 1.00 0.00 H TER 61957 WAT 3069 ATOM 61957 O WAT 3070 125.122 75.474 136.586 1.00 0.00 O ATOM 61958 H1 WAT 3070 125.106 76.407 136.372 1.00 0.00 H ATOM 61959 H2 WAT 3070 124.217 75.185 136.464 1.00 0.00 H TER 61961 WAT 3070 ATOM 61961 O WAT 3071 38.385 116.837 107.807 1.00 0.00 O ATOM 61962 H1 WAT 3071 39.134 117.093 108.345 1.00 0.00 H ATOM 61963 H2 WAT 3071 38.617 115.972 107.471 1.00 0.00 H TER 61965 WAT 3071 ATOM 61965 O WAT 3072 18.093 4.444 138.410 1.00 0.00 O ATOM 61966 H1 WAT 3072 18.535 3.715 137.975 1.00 0.00 H ATOM 61967 H2 WAT 3072 18.402 5.222 137.946 1.00 0.00 H TER 61969 WAT 3072 ATOM 61969 O WAT 3073 93.484 70.320 7.801 1.00 0.00 O ATOM 61970 H1 WAT 3073 94.101 70.441 8.522 1.00 0.00 H ATOM 61971 H2 WAT 3073 93.364 71.197 7.438 1.00 0.00 H TER 61973 WAT 3073 ATOM 61973 O WAT 3074 33.434 81.989 12.426 1.00 0.00 O ATOM 61974 H1 WAT 3074 33.101 81.097 12.518 1.00 0.00 H ATOM 61975 H2 WAT 3074 32.650 82.538 12.420 1.00 0.00 H TER 61977 WAT 3074 ATOM 61977 O WAT 3075 35.617 6.127 79.040 1.00 0.00 O ATOM 61978 H1 WAT 3075 35.702 7.065 78.867 1.00 0.00 H ATOM 61979 H2 WAT 3075 36.439 5.887 79.468 1.00 0.00 H TER 61981 WAT 3075 ATOM 61981 O WAT 3076 69.136 54.272 110.361 1.00 0.00 O ATOM 61982 H1 WAT 3076 69.944 53.832 110.624 1.00 0.00 H ATOM 61983 H2 WAT 3076 69.290 54.531 109.452 1.00 0.00 H TER 61985 WAT 3076 ATOM 61985 O WAT 3077 77.049 87.917 60.475 1.00 0.00 O ATOM 61986 H1 WAT 3077 77.203 87.288 59.770 1.00 0.00 H ATOM 61987 H2 WAT 3077 76.838 88.735 60.025 1.00 0.00 H TER 61989 WAT 3077 ATOM 61989 O WAT 3078 66.675 130.016 145.132 1.00 0.00 O ATOM 61990 H1 WAT 3078 67.164 130.329 145.893 1.00 0.00 H ATOM 61991 H2 WAT 3078 66.479 129.101 145.334 1.00 0.00 H TER 61993 WAT 3078 ATOM 61993 O WAT 3079 117.271 132.553 123.303 1.00 0.00 O ATOM 61994 H1 WAT 3079 117.640 132.047 122.580 1.00 0.00 H ATOM 61995 H2 WAT 3079 116.629 131.966 123.703 1.00 0.00 H TER 61997 WAT 3079 ATOM 61997 O WAT 3080 77.405 59.457 148.930 1.00 0.00 O ATOM 61998 H1 WAT 3080 77.010 58.586 148.959 1.00 0.00 H ATOM 61999 H2 WAT 3080 76.661 60.057 148.881 1.00 0.00 H TER 62001 WAT 3080 ATOM 62001 O WAT 3081 7.158 116.998 126.428 1.00 0.00 O ATOM 62002 H1 WAT 3081 6.419 116.405 126.561 1.00 0.00 H ATOM 62003 H2 WAT 3081 7.615 117.003 127.270 1.00 0.00 H TER 62005 WAT 3081 ATOM 62005 O WAT 3082 18.576 71.465 149.927 1.00 0.00 O ATOM 62006 H1 WAT 3082 17.955 71.072 150.540 1.00 0.00 H ATOM 62007 H2 WAT 3082 18.027 71.884 149.265 1.00 0.00 H TER 62009 WAT 3082 ATOM 62009 O WAT 3083 100.372 116.952 79.501 1.00 0.00 O ATOM 62010 H1 WAT 3083 100.163 116.620 78.628 1.00 0.00 H ATOM 62011 H2 WAT 3083 99.719 117.633 79.661 1.00 0.00 H TER 62013 WAT 3083 ATOM 62013 O WAT 3084 79.511 32.575 87.405 1.00 0.00 O ATOM 62014 H1 WAT 3084 79.535 31.757 86.909 1.00 0.00 H ATOM 62015 H2 WAT 3084 80.015 32.389 88.197 1.00 0.00 H TER 62017 WAT 3084 ATOM 62017 O WAT 3085 124.565 98.052 128.918 1.00 0.00 O ATOM 62018 H1 WAT 3085 124.815 98.739 128.300 1.00 0.00 H ATOM 62019 H2 WAT 3085 123.722 97.734 128.595 1.00 0.00 H TER 62021 WAT 3085 ATOM 62021 O WAT 3086 64.381 73.300 129.436 1.00 0.00 O ATOM 62022 H1 WAT 3086 63.940 74.133 129.269 1.00 0.00 H ATOM 62023 H2 WAT 3086 64.902 73.143 128.649 1.00 0.00 H TER 62025 WAT 3086 ATOM 62025 O WAT 3087 10.977 145.308 67.514 1.00 0.00 O ATOM 62026 H1 WAT 3087 11.095 145.168 66.574 1.00 0.00 H ATOM 62027 H2 WAT 3087 10.512 144.528 67.816 1.00 0.00 H TER 62029 WAT 3087 ATOM 62029 O WAT 3088 51.730 111.023 150.202 1.00 0.00 O ATOM 62030 H1 WAT 3088 52.292 110.452 149.679 1.00 0.00 H ATOM 62031 H2 WAT 3088 52.323 111.689 150.550 1.00 0.00 H TER 62033 WAT 3088 ATOM 62033 O WAT 3089 61.880 87.131 12.064 1.00 0.00 O ATOM 62034 H1 WAT 3089 62.072 86.286 11.658 1.00 0.00 H ATOM 62035 H2 WAT 3089 62.631 87.301 12.631 1.00 0.00 H TER 62037 WAT 3089 ATOM 62037 O WAT 3090 59.232 90.715 150.161 1.00 0.00 O ATOM 62038 H1 WAT 3090 58.674 91.384 149.764 1.00 0.00 H ATOM 62039 H2 WAT 3090 58.638 90.202 150.710 1.00 0.00 H TER 62041 WAT 3090 ATOM 62041 O WAT 3091 86.359 16.554 11.265 1.00 0.00 O ATOM 62042 H1 WAT 3091 85.760 15.969 10.801 1.00 0.00 H ATOM 62043 H2 WAT 3091 86.874 15.974 11.825 1.00 0.00 H TER 62045 WAT 3091 ATOM 62045 O WAT 3092 81.928 50.220 127.420 1.00 0.00 O ATOM 62046 H1 WAT 3092 81.976 49.957 126.501 1.00 0.00 H ATOM 62047 H2 WAT 3092 81.050 50.589 127.518 1.00 0.00 H TER 62049 WAT 3092 ATOM 62049 O WAT 3093 91.442 128.443 147.937 1.00 0.00 O ATOM 62050 H1 WAT 3093 91.409 129.265 147.448 1.00 0.00 H ATOM 62051 H2 WAT 3093 90.657 128.458 148.484 1.00 0.00 H TER 62053 WAT 3093 ATOM 62053 O WAT 3094 88.522 27.747 9.681 1.00 0.00 O ATOM 62054 H1 WAT 3094 88.082 28.256 10.361 1.00 0.00 H ATOM 62055 H2 WAT 3094 89.241 28.307 9.389 1.00 0.00 H TER 62057 WAT 3094 ATOM 62057 O WAT 3095 96.425 80.884 149.044 1.00 0.00 O ATOM 62058 H1 WAT 3095 95.874 80.198 149.421 1.00 0.00 H ATOM 62059 H2 WAT 3095 95.983 81.700 149.277 1.00 0.00 H TER 62061 WAT 3095 ATOM 62061 O WAT 3096 66.836 107.339 74.413 1.00 0.00 O ATOM 62062 H1 WAT 3096 67.618 107.564 73.910 1.00 0.00 H ATOM 62063 H2 WAT 3096 67.173 106.924 75.207 1.00 0.00 H TER 62065 WAT 3096 ATOM 62065 O WAT 3097 77.090 123.724 112.806 1.00 0.00 O ATOM 62066 H1 WAT 3097 76.310 123.532 112.285 1.00 0.00 H ATOM 62067 H2 WAT 3097 77.119 124.680 112.851 1.00 0.00 H TER 62069 WAT 3097 ATOM 62069 O WAT 3098 19.335 23.554 66.224 1.00 0.00 O ATOM 62070 H1 WAT 3098 18.888 24.241 65.729 1.00 0.00 H ATOM 62071 H2 WAT 3098 19.520 22.875 65.576 1.00 0.00 H TER 62073 WAT 3098 ATOM 62073 O WAT 3099 63.317 23.379 14.892 1.00 0.00 O ATOM 62074 H1 WAT 3099 62.815 23.594 14.105 1.00 0.00 H ATOM 62075 H2 WAT 3099 62.666 23.040 15.506 1.00 0.00 H TER 62077 WAT 3099 ATOM 62077 O WAT 3100 63.346 31.377 154.547 1.00 0.00 O ATOM 62078 H1 WAT 3100 62.590 31.659 155.062 1.00 0.00 H ATOM 62079 H2 WAT 3100 63.510 32.104 153.946 1.00 0.00 H TER 62081 WAT 3100 ATOM 62081 O WAT 3101 111.691 39.663 119.435 1.00 0.00 O ATOM 62082 H1 WAT 3101 110.848 39.698 119.888 1.00 0.00 H ATOM 62083 H2 WAT 3101 111.777 40.522 119.023 1.00 0.00 H TER 62085 WAT 3101 ATOM 62085 O WAT 3102 143.625 114.106 80.425 1.00 0.00 O ATOM 62086 H1 WAT 3102 143.558 113.253 79.997 1.00 0.00 H ATOM 62087 H2 WAT 3102 142.840 114.577 80.145 1.00 0.00 H TER 62089 WAT 3102 ATOM 62089 O WAT 3103 75.064 14.424 137.717 1.00 0.00 O ATOM 62090 H1 WAT 3103 75.661 14.285 136.982 1.00 0.00 H ATOM 62091 H2 WAT 3103 74.381 13.765 137.598 1.00 0.00 H TER 62093 WAT 3103 ATOM 62093 O WAT 3104 69.766 84.132 87.252 1.00 0.00 O ATOM 62094 H1 WAT 3104 69.333 84.915 86.911 1.00 0.00 H ATOM 62095 H2 WAT 3104 70.661 84.415 87.439 1.00 0.00 H TER 62097 WAT 3104 ATOM 62097 O WAT 3105 53.696 57.788 93.706 1.00 0.00 O ATOM 62098 H1 WAT 3105 53.556 57.393 92.845 1.00 0.00 H ATOM 62099 H2 WAT 3105 52.840 57.739 94.133 1.00 0.00 H TER 62101 WAT 3105 ATOM 62101 O WAT 3106 129.161 30.816 151.287 1.00 0.00 O ATOM 62102 H1 WAT 3106 129.379 31.624 150.822 1.00 0.00 H ATOM 62103 H2 WAT 3106 129.471 30.117 150.710 1.00 0.00 H TER 62105 WAT 3106 ATOM 62105 O WAT 3107 74.207 57.871 91.767 1.00 0.00 O ATOM 62106 H1 WAT 3107 73.975 58.546 91.130 1.00 0.00 H ATOM 62107 H2 WAT 3107 73.391 57.692 92.234 1.00 0.00 H TER 62109 WAT 3107 ATOM 62109 O WAT 3108 39.274 92.841 54.348 1.00 0.00 O ATOM 62110 H1 WAT 3108 38.599 93.272 53.824 1.00 0.00 H ATOM 62111 H2 WAT 3108 38.786 92.369 55.024 1.00 0.00 H TER 62113 WAT 3108 ATOM 62113 O WAT 3109 31.236 79.495 106.633 1.00 0.00 O ATOM 62114 H1 WAT 3109 32.148 79.782 106.661 1.00 0.00 H ATOM 62115 H2 WAT 3109 30.960 79.484 107.549 1.00 0.00 H TER 62117 WAT 3109 ATOM 62117 O WAT 3110 30.024 39.455 145.194 1.00 0.00 O ATOM 62118 H1 WAT 3110 30.150 38.510 145.104 1.00 0.00 H ATOM 62119 H2 WAT 3110 29.270 39.541 145.777 1.00 0.00 H TER 62121 WAT 3110 ATOM 62121 O WAT 3111 54.286 26.584 87.462 1.00 0.00 O ATOM 62122 H1 WAT 3111 55.064 26.572 88.019 1.00 0.00 H ATOM 62123 H2 WAT 3111 53.889 27.439 87.624 1.00 0.00 H TER 62125 WAT 3111 ATOM 62125 O WAT 3112 133.061 85.887 107.897 1.00 0.00 O ATOM 62126 H1 WAT 3112 133.958 85.582 107.757 1.00 0.00 H ATOM 62127 H2 WAT 3112 133.155 86.665 108.447 1.00 0.00 H TER 62129 WAT 3112 ATOM 62129 O WAT 3113 126.945 98.906 96.890 1.00 0.00 O ATOM 62130 H1 WAT 3113 126.684 99.445 96.144 1.00 0.00 H ATOM 62131 H2 WAT 3113 126.754 98.009 96.616 1.00 0.00 H TER 62133 WAT 3113 ATOM 62133 O WAT 3114 6.527 140.225 23.016 1.00 0.00 O ATOM 62134 H1 WAT 3114 6.840 139.833 23.831 1.00 0.00 H ATOM 62135 H2 WAT 3114 7.211 140.849 22.772 1.00 0.00 H TER 62137 WAT 3114 ATOM 62137 O WAT 3115 83.253 112.716 75.780 1.00 0.00 O ATOM 62138 H1 WAT 3115 82.860 113.568 75.588 1.00 0.00 H ATOM 62139 H2 WAT 3115 83.152 112.613 76.726 1.00 0.00 H TER 62141 WAT 3115 ATOM 62141 O WAT 3116 71.816 46.785 24.731 1.00 0.00 O ATOM 62142 H1 WAT 3116 72.098 46.082 24.145 1.00 0.00 H ATOM 62143 H2 WAT 3116 71.469 46.332 25.499 1.00 0.00 H TER 62145 WAT 3116 ATOM 62145 O WAT 3117 117.604 144.404 123.818 1.00 0.00 O ATOM 62146 H1 WAT 3117 117.176 143.571 123.620 1.00 0.00 H ATOM 62147 H2 WAT 3117 118.507 144.164 124.030 1.00 0.00 H TER 62149 WAT 3117 ATOM 62149 O WAT 3118 103.266 18.598 153.816 1.00 0.00 O ATOM 62150 H1 WAT 3118 102.734 17.895 153.441 1.00 0.00 H ATOM 62151 H2 WAT 3118 102.725 18.957 154.520 1.00 0.00 H TER 62153 WAT 3118 ATOM 62153 O WAT 3119 79.752 77.299 136.549 1.00 0.00 O ATOM 62154 H1 WAT 3119 79.501 78.005 137.144 1.00 0.00 H ATOM 62155 H2 WAT 3119 79.548 77.636 135.677 1.00 0.00 H TER 62157 WAT 3119 ATOM 62157 O WAT 3120 -0.263 124.456 78.782 1.00 0.00 O ATOM 62158 H1 WAT 3120 0.004 125.251 79.244 1.00 0.00 H ATOM 62159 H2 WAT 3120 0.518 124.186 78.299 1.00 0.00 H TER 62161 WAT 3120 ATOM 62161 O WAT 3121 4.607 70.836 4.688 1.00 0.00 O ATOM 62162 H1 WAT 3121 4.993 70.303 5.383 1.00 0.00 H ATOM 62163 H2 WAT 3121 5.269 71.503 4.502 1.00 0.00 H TER 62165 WAT 3121 ATOM 62165 O WAT 3122 145.528 30.980 75.842 1.00 0.00 O ATOM 62166 H1 WAT 3122 146.457 30.923 75.618 1.00 0.00 H ATOM 62167 H2 WAT 3122 145.429 30.407 76.602 1.00 0.00 H TER 62169 WAT 3122 ATOM 62169 O WAT 3123 137.318 8.506 15.613 1.00 0.00 O ATOM 62170 H1 WAT 3123 138.273 8.457 15.635 1.00 0.00 H ATOM 62171 H2 WAT 3123 137.100 9.208 16.226 1.00 0.00 H TER 62173 WAT 3123 ATOM 62173 O WAT 3124 95.633 28.986 155.871 1.00 0.00 O ATOM 62174 H1 WAT 3124 96.267 28.372 155.500 1.00 0.00 H ATOM 62175 H2 WAT 3124 95.816 29.815 155.429 1.00 0.00 H TER 62177 WAT 3124 ATOM 62177 O WAT 3125 125.569 50.847 3.416 1.00 0.00 O ATOM 62178 H1 WAT 3125 125.212 49.994 3.664 1.00 0.00 H ATOM 62179 H2 WAT 3125 124.988 51.157 2.722 1.00 0.00 H TER 62181 WAT 3125 ATOM 62181 O WAT 3126 51.224 119.158 97.417 1.00 0.00 O ATOM 62182 H1 WAT 3126 50.606 119.848 97.173 1.00 0.00 H ATOM 62183 H2 WAT 3126 50.671 118.410 97.642 1.00 0.00 H TER 62185 WAT 3126 ATOM 62185 O WAT 3127 13.102 59.183 123.144 1.00 0.00 O ATOM 62186 H1 WAT 3127 13.514 58.384 123.471 1.00 0.00 H ATOM 62187 H2 WAT 3127 13.823 59.807 123.058 1.00 0.00 H TER 62189 WAT 3127 ATOM 62189 O WAT 3128 98.050 39.507 86.823 1.00 0.00 O ATOM 62190 H1 WAT 3128 98.214 39.253 87.731 1.00 0.00 H ATOM 62191 H2 WAT 3128 98.027 40.464 86.842 1.00 0.00 H TER 62193 WAT 3128 ATOM 62193 O WAT 3129 141.227 12.900 129.469 1.00 0.00 O ATOM 62194 H1 WAT 3129 140.452 12.365 129.299 1.00 0.00 H ATOM 62195 H2 WAT 3129 141.958 12.371 129.149 1.00 0.00 H TER 62197 WAT 3129 ATOM 62197 O WAT 3130 51.015 118.079 72.056 1.00 0.00 O ATOM 62198 H1 WAT 3130 50.815 118.232 71.133 1.00 0.00 H ATOM 62199 H2 WAT 3130 51.697 118.718 72.262 1.00 0.00 H TER 62201 WAT 3130 ATOM 62201 O WAT 3131 105.355 68.972 120.359 1.00 0.00 O ATOM 62202 H1 WAT 3131 104.795 68.886 121.131 1.00 0.00 H ATOM 62203 H2 WAT 3131 105.080 68.258 119.784 1.00 0.00 H TER 62205 WAT 3131 ATOM 62205 O WAT 3132 87.288 70.655 116.115 1.00 0.00 O ATOM 62206 H1 WAT 3132 87.895 71.304 115.760 1.00 0.00 H ATOM 62207 H2 WAT 3132 86.540 71.168 116.421 1.00 0.00 H TER 62209 WAT 3132 ATOM 62209 O WAT 3133 64.701 64.698 141.022 1.00 0.00 O ATOM 62210 H1 WAT 3133 64.047 65.136 140.477 1.00 0.00 H ATOM 62211 H2 WAT 3133 64.545 65.040 141.903 1.00 0.00 H TER 62213 WAT 3133 ATOM 62213 O WAT 3134 3.166 36.006 74.897 1.00 0.00 O ATOM 62214 H1 WAT 3134 4.122 36.046 74.864 1.00 0.00 H ATOM 62215 H2 WAT 3134 2.941 35.223 74.395 1.00 0.00 H TER 62217 WAT 3134 ATOM 62217 O WAT 3135 2.529 45.738 85.969 1.00 0.00 O ATOM 62218 H1 WAT 3135 1.755 46.133 85.566 1.00 0.00 H ATOM 62219 H2 WAT 3135 3.082 46.483 86.206 1.00 0.00 H TER 62221 WAT 3135 ATOM 62221 O WAT 3136 136.903 138.176 108.525 1.00 0.00 O ATOM 62222 H1 WAT 3136 137.105 139.008 108.953 1.00 0.00 H ATOM 62223 H2 WAT 3136 136.385 138.421 107.759 1.00 0.00 H TER 62225 WAT 3136 ATOM 62225 O WAT 3137 98.453 14.460 109.257 1.00 0.00 O ATOM 62226 H1 WAT 3137 99.365 14.620 109.499 1.00 0.00 H ATOM 62227 H2 WAT 3137 98.491 13.714 108.658 1.00 0.00 H TER 62229 WAT 3137 ATOM 62229 O WAT 3138 0.377 65.657 113.509 1.00 0.00 O ATOM 62230 H1 WAT 3138 1.153 65.942 113.992 1.00 0.00 H ATOM 62231 H2 WAT 3138 0.708 65.421 112.643 1.00 0.00 H TER 62233 WAT 3138 ATOM 62233 O WAT 3139 1.453 139.152 130.237 1.00 0.00 O ATOM 62234 H1 WAT 3139 2.113 139.083 129.547 1.00 0.00 H ATOM 62235 H2 WAT 3139 0.946 139.931 130.006 1.00 0.00 H TER 62237 WAT 3139 ATOM 62237 O WAT 3140 46.812 95.329 92.966 1.00 0.00 O ATOM 62238 H1 WAT 3140 47.279 94.648 93.450 1.00 0.00 H ATOM 62239 H2 WAT 3140 45.892 95.201 93.201 1.00 0.00 H TER 62241 WAT 3140 ATOM 62241 O WAT 3141 102.182 72.729 148.526 1.00 0.00 O ATOM 62242 H1 WAT 3141 101.800 71.856 148.619 1.00 0.00 H ATOM 62243 H2 WAT 3141 101.998 72.975 147.619 1.00 0.00 H TER 62245 WAT 3141 ATOM 62245 O WAT 3142 77.301 137.633 129.111 1.00 0.00 O ATOM 62246 H1 WAT 3142 77.241 136.688 128.970 1.00 0.00 H ATOM 62247 H2 WAT 3142 77.665 137.721 129.992 1.00 0.00 H TER 62249 WAT 3142 ATOM 62249 O WAT 3143 28.322 70.785 24.659 1.00 0.00 O ATOM 62250 H1 WAT 3143 29.204 70.420 24.734 1.00 0.00 H ATOM 62251 H2 WAT 3143 27.815 70.326 25.329 1.00 0.00 H TER 62253 WAT 3143 ATOM 62253 O WAT 3144 86.153 124.880 139.129 1.00 0.00 O ATOM 62254 H1 WAT 3144 86.022 125.423 138.351 1.00 0.00 H ATOM 62255 H2 WAT 3144 85.899 125.444 139.860 1.00 0.00 H TER 62257 WAT 3144 ATOM 62257 O WAT 3145 108.632 31.128 0.998 1.00 0.00 O ATOM 62258 H1 WAT 3145 109.199 31.800 1.377 1.00 0.00 H ATOM 62259 H2 WAT 3145 107.767 31.537 0.965 1.00 0.00 H TER 62261 WAT 3145 ATOM 62261 O WAT 3146 32.421 40.633 79.328 1.00 0.00 O ATOM 62262 H1 WAT 3146 33.105 40.032 79.620 1.00 0.00 H ATOM 62263 H2 WAT 3146 31.738 40.065 78.972 1.00 0.00 H TER 62265 WAT 3146 ATOM 62265 O WAT 3147 33.849 107.040 54.892 1.00 0.00 O ATOM 62266 H1 WAT 3147 34.619 107.605 54.945 1.00 0.00 H ATOM 62267 H2 WAT 3147 34.009 106.487 54.127 1.00 0.00 H TER 62269 WAT 3147 ATOM 62269 O WAT 3148 104.675 31.875 10.620 1.00 0.00 O ATOM 62270 H1 WAT 3148 104.980 31.755 11.520 1.00 0.00 H ATOM 62271 H2 WAT 3148 103.828 32.311 10.711 1.00 0.00 H TER 62273 WAT 3148 ATOM 62273 O WAT 3149 2.210 48.835 10.449 1.00 0.00 O ATOM 62274 H1 WAT 3149 2.678 49.632 10.197 1.00 0.00 H ATOM 62275 H2 WAT 3149 2.660 48.533 11.238 1.00 0.00 H TER 62277 WAT 3149 ATOM 62277 O WAT 3150 127.506 87.711 68.892 1.00 0.00 O ATOM 62278 H1 WAT 3150 126.717 87.958 68.408 1.00 0.00 H ATOM 62279 H2 WAT 3150 127.773 86.877 68.505 1.00 0.00 H TER 62281 WAT 3150 ATOM 62281 O WAT 3151 31.696 47.014 137.335 1.00 0.00 O ATOM 62282 H1 WAT 3151 32.049 46.318 136.780 1.00 0.00 H ATOM 62283 H2 WAT 3151 31.748 47.802 136.793 1.00 0.00 H TER 62285 WAT 3151 ATOM 62285 O WAT 3152 38.552 64.244 65.509 1.00 0.00 O ATOM 62286 H1 WAT 3152 39.365 63.938 65.912 1.00 0.00 H ATOM 62287 H2 WAT 3152 38.809 64.519 64.629 1.00 0.00 H TER 62289 WAT 3152 ATOM 62289 O WAT 3153 106.131 95.475 8.825 1.00 0.00 O ATOM 62290 H1 WAT 3153 105.530 96.139 8.489 1.00 0.00 H ATOM 62291 H2 WAT 3153 106.517 95.874 9.605 1.00 0.00 H TER 62293 WAT 3153 ATOM 62293 O WAT 3154 14.183 27.161 2.728 1.00 0.00 O ATOM 62294 H1 WAT 3154 14.042 26.859 1.831 1.00 0.00 H ATOM 62295 H2 WAT 3154 13.627 26.594 3.262 1.00 0.00 H TER 62297 WAT 3154 ATOM 62297 O WAT 3155 106.285 48.721 19.261 1.00 0.00 O ATOM 62298 H1 WAT 3155 105.996 49.112 18.436 1.00 0.00 H ATOM 62299 H2 WAT 3155 105.777 47.914 19.335 1.00 0.00 H TER 62301 WAT 3155 ATOM 62301 O WAT 3156 90.188 41.312 111.481 1.00 0.00 O ATOM 62302 H1 WAT 3156 90.220 40.819 110.661 1.00 0.00 H ATOM 62303 H2 WAT 3156 89.451 40.933 111.959 1.00 0.00 H TER 62305 WAT 3156 ATOM 62305 O WAT 3157 58.808 37.489 133.578 1.00 0.00 O ATOM 62306 H1 WAT 3157 58.275 37.105 134.274 1.00 0.00 H ATOM 62307 H2 WAT 3157 59.208 38.260 133.980 1.00 0.00 H TER 62309 WAT 3157 ATOM 62309 O WAT 3158 100.417 64.013 158.466 1.00 0.00 O ATOM 62310 H1 WAT 3158 101.030 64.108 159.195 1.00 0.00 H ATOM 62311 H2 WAT 3158 100.662 64.707 157.855 1.00 0.00 H TER 62313 WAT 3158 ATOM 62313 O WAT 3159 27.955 50.807 8.245 1.00 0.00 O ATOM 62314 H1 WAT 3159 28.128 51.728 8.054 1.00 0.00 H ATOM 62315 H2 WAT 3159 28.449 50.327 7.580 1.00 0.00 H TER 62317 WAT 3159 ATOM 62317 O WAT 3160 119.432 144.149 76.116 1.00 0.00 O ATOM 62318 H1 WAT 3160 118.901 143.774 76.818 1.00 0.00 H ATOM 62319 H2 WAT 3160 120.307 144.236 76.496 1.00 0.00 H TER 62321 WAT 3160 ATOM 62321 O WAT 3161 50.077 33.198 99.783 1.00 0.00 O ATOM 62322 H1 WAT 3161 50.934 33.085 99.372 1.00 0.00 H ATOM 62323 H2 WAT 3161 49.458 32.843 99.145 1.00 0.00 H TER 62325 WAT 3161 ATOM 62325 O WAT 3162 90.864 108.784 79.737 1.00 0.00 O ATOM 62326 H1 WAT 3162 91.327 108.143 79.197 1.00 0.00 H ATOM 62327 H2 WAT 3162 90.513 108.273 80.466 1.00 0.00 H TER 62329 WAT 3162 ATOM 62329 O WAT 3163 51.549 3.005 137.726 1.00 0.00 O ATOM 62330 H1 WAT 3163 51.903 3.738 137.221 1.00 0.00 H ATOM 62331 H2 WAT 3163 50.599 3.103 137.655 1.00 0.00 H TER 62333 WAT 3163 ATOM 62333 O WAT 3164 14.571 91.645 66.402 1.00 0.00 O ATOM 62334 H1 WAT 3164 15.011 92.494 66.439 1.00 0.00 H ATOM 62335 H2 WAT 3164 14.360 91.525 65.476 1.00 0.00 H TER 62337 WAT 3164 ATOM 62337 O WAT 3165 136.683 17.144 80.884 1.00 0.00 O ATOM 62338 H1 WAT 3165 135.971 17.302 81.503 1.00 0.00 H ATOM 62339 H2 WAT 3165 136.285 16.619 80.190 1.00 0.00 H TER 62341 WAT 3165 ATOM 62341 O WAT 3166 54.306 71.401 140.975 1.00 0.00 O ATOM 62342 H1 WAT 3166 53.685 71.359 140.248 1.00 0.00 H ATOM 62343 H2 WAT 3166 54.082 70.649 141.524 1.00 0.00 H TER 62345 WAT 3166 ATOM 62345 O WAT 3167 16.043 47.643 1.299 1.00 0.00 O ATOM 62346 H1 WAT 3167 16.400 47.356 0.458 1.00 0.00 H ATOM 62347 H2 WAT 3167 15.843 48.570 1.170 1.00 0.00 H TER 62349 WAT 3167 ATOM 62349 O WAT 3168 34.634 59.993 89.527 1.00 0.00 O ATOM 62350 H1 WAT 3168 35.393 59.695 89.026 1.00 0.00 H ATOM 62351 H2 WAT 3168 34.986 60.649 90.129 1.00 0.00 H TER 62353 WAT 3168 ATOM 62353 O WAT 3169 11.489 140.601 149.149 1.00 0.00 O ATOM 62354 H1 WAT 3169 12.161 140.303 148.535 1.00 0.00 H ATOM 62355 H2 WAT 3169 10.768 140.894 148.591 1.00 0.00 H TER 62357 WAT 3169 ATOM 62357 O WAT 3170 68.968 16.504 121.591 1.00 0.00 O ATOM 62358 H1 WAT 3170 68.473 15.692 121.700 1.00 0.00 H ATOM 62359 H2 WAT 3170 69.862 16.216 121.408 1.00 0.00 H TER 62361 WAT 3170 ATOM 62361 O WAT 3171 102.242 15.510 127.727 1.00 0.00 O ATOM 62362 H1 WAT 3171 102.070 15.808 128.620 1.00 0.00 H ATOM 62363 H2 WAT 3171 102.879 14.803 127.829 1.00 0.00 H TER 62365 WAT 3171 ATOM 62365 O WAT 3172 97.888 73.514 139.607 1.00 0.00 O ATOM 62366 H1 WAT 3172 97.282 74.218 139.375 1.00 0.00 H ATOM 62367 H2 WAT 3172 98.751 73.929 139.601 1.00 0.00 H TER 62369 WAT 3172 ATOM 62369 O WAT 3173 113.611 20.693 116.655 1.00 0.00 O ATOM 62370 H1 WAT 3173 114.362 20.757 117.245 1.00 0.00 H ATOM 62371 H2 WAT 3173 113.203 19.856 116.878 1.00 0.00 H TER 62373 WAT 3173 ATOM 62373 O WAT 3174 26.694 94.826 58.989 1.00 0.00 O ATOM 62374 H1 WAT 3174 25.754 94.953 58.863 1.00 0.00 H ATOM 62375 H2 WAT 3174 26.941 94.186 58.321 1.00 0.00 H TER 62377 WAT 3174 ATOM 62377 O WAT 3175 99.373 140.930 8.989 1.00 0.00 O ATOM 62378 H1 WAT 3175 98.888 141.746 8.870 1.00 0.00 H ATOM 62379 H2 WAT 3175 99.647 140.945 9.905 1.00 0.00 H TER 62381 WAT 3175 ATOM 62381 O WAT 3176 18.685 24.973 95.385 1.00 0.00 O ATOM 62382 H1 WAT 3176 18.724 24.075 95.056 1.00 0.00 H ATOM 62383 H2 WAT 3176 17.763 25.220 95.300 1.00 0.00 H TER 62385 WAT 3176 ATOM 62385 O WAT 3177 71.915 73.351 15.576 1.00 0.00 O ATOM 62386 H1 WAT 3177 72.059 73.534 16.505 1.00 0.00 H ATOM 62387 H2 WAT 3177 71.137 72.793 15.560 1.00 0.00 H TER 62389 WAT 3177 ATOM 62389 O WAT 3178 139.918 46.279 15.492 1.00 0.00 O ATOM 62390 H1 WAT 3178 140.642 45.979 16.042 1.00 0.00 H ATOM 62391 H2 WAT 3178 140.017 47.231 15.463 1.00 0.00 H TER 62393 WAT 3178 ATOM 62393 O WAT 3179 141.207 36.409 74.522 1.00 0.00 O ATOM 62394 H1 WAT 3179 141.138 35.528 74.153 1.00 0.00 H ATOM 62395 H2 WAT 3179 141.963 36.796 74.080 1.00 0.00 H TER 62397 WAT 3179 ATOM 62397 O WAT 3180 13.331 31.601 86.390 1.00 0.00 O ATOM 62398 H1 WAT 3180 13.821 31.384 85.597 1.00 0.00 H ATOM 62399 H2 WAT 3180 13.312 30.786 86.891 1.00 0.00 H TER 62401 WAT 3180 ATOM 62401 O WAT 3181 64.922 2.888 11.163 1.00 0.00 O ATOM 62402 H1 WAT 3181 64.490 2.054 11.347 1.00 0.00 H ATOM 62403 H2 WAT 3181 65.321 3.140 11.996 1.00 0.00 H TER 62405 WAT 3181 ATOM 62405 O WAT 3182 131.818 30.655 90.374 1.00 0.00 O ATOM 62406 H1 WAT 3182 131.534 31.502 90.029 1.00 0.00 H ATOM 62407 H2 WAT 3182 132.260 30.233 89.637 1.00 0.00 H TER 62409 WAT 3182 ATOM 62409 O WAT 3183 73.291 66.648 118.757 1.00 0.00 O ATOM 62410 H1 WAT 3183 73.397 66.542 117.811 1.00 0.00 H ATOM 62411 H2 WAT 3183 73.328 67.594 118.898 1.00 0.00 H TER 62413 WAT 3183 ATOM 62413 O WAT 3184 19.953 68.399 116.971 1.00 0.00 O ATOM 62414 H1 WAT 3184 19.418 68.309 117.759 1.00 0.00 H ATOM 62415 H2 WAT 3184 20.755 68.825 117.273 1.00 0.00 H TER 62417 WAT 3184 ATOM 62417 O WAT 3185 123.285 123.432 11.083 1.00 0.00 O ATOM 62418 H1 WAT 3185 123.468 124.146 11.693 1.00 0.00 H ATOM 62419 H2 WAT 3185 124.143 123.184 10.740 1.00 0.00 H TER 62421 WAT 3185 ATOM 62421 O WAT 3186 108.568 78.522 118.068 1.00 0.00 O ATOM 62422 H1 WAT 3186 108.703 79.185 118.746 1.00 0.00 H ATOM 62423 H2 WAT 3186 109.352 78.576 117.522 1.00 0.00 H TER 62425 WAT 3186 ATOM 62425 O WAT 3187 39.256 16.344 90.829 1.00 0.00 O ATOM 62426 H1 WAT 3187 39.215 15.544 91.352 1.00 0.00 H ATOM 62427 H2 WAT 3187 40.040 16.239 90.290 1.00 0.00 H TER 62429 WAT 3187 ATOM 62429 O WAT 3188 92.475 18.383 61.412 1.00 0.00 O ATOM 62430 H1 WAT 3188 93.288 18.212 60.936 1.00 0.00 H ATOM 62431 H2 WAT 3188 92.578 19.271 61.752 1.00 0.00 H TER 62433 WAT 3188 ATOM 62433 O WAT 3189 131.795 69.198 143.119 1.00 0.00 O ATOM 62434 H1 WAT 3189 131.093 69.842 143.038 1.00 0.00 H ATOM 62435 H2 WAT 3189 131.638 68.580 142.405 1.00 0.00 H TER 62437 WAT 3189 ATOM 62437 O WAT 3190 23.961 63.008 75.995 1.00 0.00 O ATOM 62438 H1 WAT 3190 23.505 63.401 76.739 1.00 0.00 H ATOM 62439 H2 WAT 3190 24.453 63.732 75.606 1.00 0.00 H TER 62441 WAT 3190 ATOM 62441 O WAT 3191 95.463 74.363 127.066 1.00 0.00 O ATOM 62442 H1 WAT 3191 95.705 74.488 127.984 1.00 0.00 H ATOM 62443 H2 WAT 3191 95.669 75.199 126.648 1.00 0.00 H TER 62445 WAT 3191 ATOM 62445 O WAT 3192 0.198 7.452 69.322 1.00 0.00 O ATOM 62446 H1 WAT 3192 0.653 7.029 68.593 1.00 0.00 H ATOM 62447 H2 WAT 3192 0.887 7.917 69.796 1.00 0.00 H TER 62449 WAT 3192 ATOM 62449 O WAT 3193 58.513 75.464 101.554 1.00 0.00 O ATOM 62450 H1 WAT 3193 58.540 76.415 101.447 1.00 0.00 H ATOM 62451 H2 WAT 3193 58.305 75.131 100.681 1.00 0.00 H TER 62453 WAT 3193 ATOM 62453 O WAT 3194 51.528 126.200 117.019 1.00 0.00 O ATOM 62454 H1 WAT 3194 50.835 125.632 117.356 1.00 0.00 H ATOM 62455 H2 WAT 3194 51.252 127.084 117.261 1.00 0.00 H TER 62457 WAT 3194 ATOM 62457 O WAT 3195 92.768 112.024 11.388 1.00 0.00 O ATOM 62458 H1 WAT 3195 93.495 111.550 11.793 1.00 0.00 H ATOM 62459 H2 WAT 3195 92.492 111.464 10.662 1.00 0.00 H TER 62461 WAT 3195 ATOM 62461 O WAT 3196 0.856 123.868 64.221 1.00 0.00 O ATOM 62462 H1 WAT 3196 1.529 123.351 64.664 1.00 0.00 H ATOM 62463 H2 WAT 3196 1.307 124.668 63.952 1.00 0.00 H TER 62465 WAT 3196 ATOM 62465 O WAT 3197 80.167 104.130 71.290 1.00 0.00 O ATOM 62466 H1 WAT 3197 80.980 104.626 71.386 1.00 0.00 H ATOM 62467 H2 WAT 3197 79.844 104.025 72.185 1.00 0.00 H TER 62469 WAT 3197 ATOM 62469 O WAT 3198 69.429 119.633 102.263 1.00 0.00 O ATOM 62470 H1 WAT 3198 70.202 120.077 102.612 1.00 0.00 H ATOM 62471 H2 WAT 3198 69.141 119.060 102.974 1.00 0.00 H TER 62473 WAT 3198 ATOM 62473 O WAT 3199 44.973 19.029 74.920 1.00 0.00 O ATOM 62474 H1 WAT 3199 44.137 19.391 74.626 1.00 0.00 H ATOM 62475 H2 WAT 3199 45.614 19.707 74.708 1.00 0.00 H TER 62477 WAT 3199 ATOM 62477 O WAT 3200 105.343 41.547 83.145 1.00 0.00 O ATOM 62478 H1 WAT 3200 105.577 42.392 83.529 1.00 0.00 H ATOM 62479 H2 WAT 3200 105.643 40.902 83.785 1.00 0.00 H TER 62481 WAT 3200 ATOM 62481 O WAT 3201 126.017 115.348 70.301 1.00 0.00 O ATOM 62482 H1 WAT 3201 126.102 114.404 70.166 1.00 0.00 H ATOM 62483 H2 WAT 3201 126.879 115.624 70.612 1.00 0.00 H TER 62485 WAT 3201 ATOM 62485 O WAT 3202 6.938 90.022 79.485 1.00 0.00 O ATOM 62486 H1 WAT 3202 7.751 89.716 79.082 1.00 0.00 H ATOM 62487 H2 WAT 3202 6.473 90.466 78.776 1.00 0.00 H TER 62489 WAT 3202 ATOM 62489 O WAT 3203 134.145 41.350 77.230 1.00 0.00 O ATOM 62490 H1 WAT 3203 133.623 40.637 76.863 1.00 0.00 H ATOM 62491 H2 WAT 3203 134.847 41.487 76.594 1.00 0.00 H TER 62493 WAT 3203 ATOM 62493 O WAT 3204 0.550 143.550 60.975 1.00 0.00 O ATOM 62494 H1 WAT 3204 -0.378 143.594 60.746 1.00 0.00 H ATOM 62495 H2 WAT 3204 0.836 144.463 60.995 1.00 0.00 H TER 62497 WAT 3204 ATOM 62497 O WAT 3205 44.229 127.364 126.326 1.00 0.00 O ATOM 62498 H1 WAT 3205 44.914 127.206 125.676 1.00 0.00 H ATOM 62499 H2 WAT 3205 43.911 128.245 126.128 1.00 0.00 H TER 62501 WAT 3205 ATOM 62501 O WAT 3206 35.389 125.707 92.619 1.00 0.00 O ATOM 62502 H1 WAT 3206 35.663 126.107 93.445 1.00 0.00 H ATOM 62503 H2 WAT 3206 35.970 124.954 92.514 1.00 0.00 H TER 62505 WAT 3206 ATOM 62505 O WAT 3207 49.009 43.303 145.137 1.00 0.00 O ATOM 62506 H1 WAT 3207 48.390 43.270 144.408 1.00 0.00 H ATOM 62507 H2 WAT 3207 48.466 43.184 145.917 1.00 0.00 H TER 62509 WAT 3207 ATOM 62509 O WAT 3208 105.436 81.564 139.694 1.00 0.00 O ATOM 62510 H1 WAT 3208 104.739 82.048 139.252 1.00 0.00 H ATOM 62511 H2 WAT 3208 105.008 80.774 140.024 1.00 0.00 H TER 62513 WAT 3208 ATOM 62513 O WAT 3209 83.553 28.929 147.822 1.00 0.00 O ATOM 62514 H1 WAT 3209 82.884 28.396 148.251 1.00 0.00 H ATOM 62515 H2 WAT 3209 83.269 29.832 147.964 1.00 0.00 H TER 62517 WAT 3209 ATOM 62517 O WAT 3210 15.524 6.244 117.335 1.00 0.00 O ATOM 62518 H1 WAT 3210 15.127 6.903 117.904 1.00 0.00 H ATOM 62519 H2 WAT 3210 15.940 6.750 116.637 1.00 0.00 H TER 62521 WAT 3210 ATOM 62521 O WAT 3211 12.252 63.734 139.777 1.00 0.00 O ATOM 62522 H1 WAT 3211 11.618 63.994 139.109 1.00 0.00 H ATOM 62523 H2 WAT 3211 12.735 63.010 139.380 1.00 0.00 H TER 62525 WAT 3211 ATOM 62525 O WAT 3212 54.618 99.493 91.959 1.00 0.00 O ATOM 62526 H1 WAT 3212 54.527 99.205 91.051 1.00 0.00 H ATOM 62527 H2 WAT 3212 54.706 100.444 91.902 1.00 0.00 H TER 62529 WAT 3212 ATOM 62529 O WAT 3213 130.051 79.286 56.916 1.00 0.00 O ATOM 62530 H1 WAT 3213 129.162 79.606 57.066 1.00 0.00 H ATOM 62531 H2 WAT 3213 130.014 78.872 56.054 1.00 0.00 H TER 62533 WAT 3213 ATOM 62533 O WAT 3214 122.045 128.772 120.839 1.00 0.00 O ATOM 62534 H1 WAT 3214 121.179 128.385 120.707 1.00 0.00 H ATOM 62535 H2 WAT 3214 122.070 129.514 120.234 1.00 0.00 H TER 62537 WAT 3214 ATOM 62537 O WAT 3215 70.096 9.010 20.433 1.00 0.00 O ATOM 62538 H1 WAT 3215 69.295 9.296 20.872 1.00 0.00 H ATOM 62539 H2 WAT 3215 69.902 9.095 19.500 1.00 0.00 H TER 62541 WAT 3215 ATOM 62541 O WAT 3216 42.592 134.037 56.342 1.00 0.00 O ATOM 62542 H1 WAT 3216 42.945 133.236 55.956 1.00 0.00 H ATOM 62543 H2 WAT 3216 43.278 134.338 56.938 1.00 0.00 H TER 62545 WAT 3216 ATOM 62545 O WAT 3217 2.655 16.992 3.983 1.00 0.00 O ATOM 62546 H1 WAT 3217 1.758 16.716 3.792 1.00 0.00 H ATOM 62547 H2 WAT 3217 3.005 17.268 3.136 1.00 0.00 H TER 62549 WAT 3217 ATOM 62549 O WAT 3218 30.045 43.231 78.527 1.00 0.00 O ATOM 62550 H1 WAT 3218 30.575 42.729 77.908 1.00 0.00 H ATOM 62551 H2 WAT 3218 29.421 42.596 78.879 1.00 0.00 H TER 62553 WAT 3218 ATOM 62553 O WAT 3219 40.917 134.931 151.621 1.00 0.00 O ATOM 62554 H1 WAT 3219 41.167 135.454 150.859 1.00 0.00 H ATOM 62555 H2 WAT 3219 41.652 135.025 152.227 1.00 0.00 H TER 62557 WAT 3219 ATOM 62557 O WAT 3220 21.799 13.612 105.114 1.00 0.00 O ATOM 62558 H1 WAT 3220 22.188 14.484 105.048 1.00 0.00 H ATOM 62559 H2 WAT 3220 21.735 13.449 106.055 1.00 0.00 H TER 62561 WAT 3220 ATOM 62561 O WAT 3221 115.586 101.583 131.293 1.00 0.00 O ATOM 62562 H1 WAT 3221 115.641 102.492 130.997 1.00 0.00 H ATOM 62563 H2 WAT 3221 115.300 101.645 132.204 1.00 0.00 H TER 62565 WAT 3221 ATOM 62565 O WAT 3222 10.688 139.955 140.119 1.00 0.00 O ATOM 62566 H1 WAT 3222 11.080 139.276 140.668 1.00 0.00 H ATOM 62567 H2 WAT 3222 10.034 139.492 139.596 1.00 0.00 H TER 62569 WAT 3222 ATOM 62569 O WAT 3223 39.631 103.546 144.040 1.00 0.00 O ATOM 62570 H1 WAT 3223 39.429 103.008 143.274 1.00 0.00 H ATOM 62571 H2 WAT 3223 39.854 104.404 143.677 1.00 0.00 H TER 62573 WAT 3223 ATOM 62573 O WAT 3224 18.276 128.308 84.173 1.00 0.00 O ATOM 62574 H1 WAT 3224 17.562 128.248 83.539 1.00 0.00 H ATOM 62575 H2 WAT 3224 17.840 128.449 85.013 1.00 0.00 H TER 62577 WAT 3224 ATOM 62577 O WAT 3225 62.367 17.699 119.283 1.00 0.00 O ATOM 62578 H1 WAT 3225 62.154 16.797 119.523 1.00 0.00 H ATOM 62579 H2 WAT 3225 61.931 17.832 118.441 1.00 0.00 H TER 62581 WAT 3225 ATOM 62581 O WAT 3226 63.684 131.511 90.040 1.00 0.00 O ATOM 62582 H1 WAT 3226 63.614 130.730 90.588 1.00 0.00 H ATOM 62583 H2 WAT 3226 64.224 131.237 89.299 1.00 0.00 H TER 62585 WAT 3226 ATOM 62585 O WAT 3227 55.579 137.284 130.437 1.00 0.00 O ATOM 62586 H1 WAT 3227 56.265 137.888 130.721 1.00 0.00 H ATOM 62587 H2 WAT 3227 54.809 137.540 130.945 1.00 0.00 H TER 62589 WAT 3227 ATOM 62589 O WAT 3228 42.055 77.294 67.396 1.00 0.00 O ATOM 62590 H1 WAT 3228 41.198 77.684 67.569 1.00 0.00 H ATOM 62591 H2 WAT 3228 41.947 76.840 66.561 1.00 0.00 H TER 62593 WAT 3228 ATOM 62593 O WAT 3229 17.506 56.603 86.119 1.00 0.00 O ATOM 62594 H1 WAT 3229 17.932 55.812 85.791 1.00 0.00 H ATOM 62595 H2 WAT 3229 17.615 57.244 85.417 1.00 0.00 H TER 62597 WAT 3229 ATOM 62597 O WAT 3230 100.245 109.353 155.918 1.00 0.00 O ATOM 62598 H1 WAT 3230 99.871 108.483 156.060 1.00 0.00 H ATOM 62599 H2 WAT 3230 100.492 109.653 156.793 1.00 0.00 H TER 62601 WAT 3230 ATOM 62601 O WAT 3231 70.099 9.242 114.711 1.00 0.00 O ATOM 62602 H1 WAT 3231 70.798 8.666 115.023 1.00 0.00 H ATOM 62603 H2 WAT 3231 70.521 9.796 114.054 1.00 0.00 H TER 62605 WAT 3231 ATOM 62605 O WAT 3232 68.139 91.527 97.287 1.00 0.00 O ATOM 62606 H1 WAT 3232 67.914 92.404 97.600 1.00 0.00 H ATOM 62607 H2 WAT 3232 68.597 91.121 98.023 1.00 0.00 H TER 62609 WAT 3232 ATOM 62609 O WAT 3233 41.693 1.016 129.569 1.00 0.00 O ATOM 62610 H1 WAT 3233 40.951 0.425 129.442 1.00 0.00 H ATOM 62611 H2 WAT 3233 42.227 0.590 130.239 1.00 0.00 H TER 62613 WAT 3233 ATOM 62613 O WAT 3234 144.090 18.587 91.234 1.00 0.00 O ATOM 62614 H1 WAT 3234 144.167 17.923 91.919 1.00 0.00 H ATOM 62615 H2 WAT 3234 144.488 18.183 90.463 1.00 0.00 H TER 62617 WAT 3234 ATOM 62617 O WAT 3235 109.268 76.814 67.242 1.00 0.00 O ATOM 62618 H1 WAT 3235 109.297 76.830 68.199 1.00 0.00 H ATOM 62619 H2 WAT 3235 110.154 76.565 66.980 1.00 0.00 H TER 62621 WAT 3235 ATOM 62621 O WAT 3236 35.961 129.073 104.311 1.00 0.00 O ATOM 62622 H1 WAT 3236 36.344 129.517 105.067 1.00 0.00 H ATOM 62623 H2 WAT 3236 36.713 128.804 103.784 1.00 0.00 H TER 62625 WAT 3236 ATOM 62625 O WAT 3237 5.537 90.546 117.405 1.00 0.00 O ATOM 62626 H1 WAT 3237 5.386 89.762 116.877 1.00 0.00 H ATOM 62627 H2 WAT 3237 5.565 90.226 118.307 1.00 0.00 H TER 62629 WAT 3237 ATOM 62629 O WAT 3238 74.870 51.874 61.652 1.00 0.00 O ATOM 62630 H1 WAT 3238 74.117 51.728 61.079 1.00 0.00 H ATOM 62631 H2 WAT 3238 75.629 51.667 61.108 1.00 0.00 H TER 62633 WAT 3238 ATOM 62633 O WAT 3239 0.033 43.576 65.858 1.00 0.00 O ATOM 62634 H1 WAT 3239 -0.514 43.805 65.107 1.00 0.00 H ATOM 62635 H2 WAT 3239 0.881 43.349 65.477 1.00 0.00 H TER 62637 WAT 3239 ATOM 62637 O WAT 3240 39.713 69.657 58.823 1.00 0.00 O ATOM 62638 H1 WAT 3240 38.972 69.230 58.393 1.00 0.00 H ATOM 62639 H2 WAT 3240 39.358 70.485 59.145 1.00 0.00 H TER 62641 WAT 3240 ATOM 62641 O WAT 3241 70.458 131.298 60.855 1.00 0.00 O ATOM 62642 H1 WAT 3241 71.242 131.537 61.349 1.00 0.00 H ATOM 62643 H2 WAT 3241 69.846 130.978 61.518 1.00 0.00 H TER 62645 WAT 3241 ATOM 62645 O WAT 3242 125.860 45.203 114.517 1.00 0.00 O ATOM 62646 H1 WAT 3242 126.569 45.497 115.089 1.00 0.00 H ATOM 62647 H2 WAT 3242 126.095 44.304 114.287 1.00 0.00 H TER 62649 WAT 3242 ATOM 62649 O WAT 3243 85.995 50.366 14.989 1.00 0.00 O ATOM 62650 H1 WAT 3243 85.464 51.062 14.601 1.00 0.00 H ATOM 62651 H2 WAT 3243 85.766 49.583 14.489 1.00 0.00 H TER 62653 WAT 3243 ATOM 62653 O WAT 3244 31.904 90.016 19.633 1.00 0.00 O ATOM 62654 H1 WAT 3244 32.192 90.461 18.835 1.00 0.00 H ATOM 62655 H2 WAT 3244 32.697 89.940 20.164 1.00 0.00 H TER 62657 WAT 3244 ATOM 62657 O WAT 3245 134.634 124.295 97.630 1.00 0.00 O ATOM 62658 H1 WAT 3245 135.367 123.794 97.273 1.00 0.00 H ATOM 62659 H2 WAT 3245 134.742 125.172 97.263 1.00 0.00 H TER 62661 WAT 3245 ATOM 62661 O WAT 3246 96.857 73.551 112.918 1.00 0.00 O ATOM 62662 H1 WAT 3246 97.254 73.019 112.229 1.00 0.00 H ATOM 62663 H2 WAT 3246 97.357 73.335 113.705 1.00 0.00 H TER 62665 WAT 3246 ATOM 62665 O WAT 3247 89.717 144.472 104.250 1.00 0.00 O ATOM 62666 H1 WAT 3247 90.445 144.891 104.709 1.00 0.00 H ATOM 62667 H2 WAT 3247 90.051 143.608 104.009 1.00 0.00 H TER 62669 WAT 3247 ATOM 62669 O WAT 3248 23.894 15.100 145.437 1.00 0.00 O ATOM 62670 H1 WAT 3248 23.404 15.380 146.210 1.00 0.00 H ATOM 62671 H2 WAT 3248 24.306 15.899 145.112 1.00 0.00 H TER 62673 WAT 3248 ATOM 62673 O WAT 3249 27.809 113.736 85.057 1.00 0.00 O ATOM 62674 H1 WAT 3249 27.490 114.638 85.087 1.00 0.00 H ATOM 62675 H2 WAT 3249 28.698 113.785 85.407 1.00 0.00 H TER 62677 WAT 3249 ATOM 62677 O WAT 3250 70.781 29.198 124.531 1.00 0.00 O ATOM 62678 H1 WAT 3250 71.601 29.549 124.878 1.00 0.00 H ATOM 62679 H2 WAT 3250 70.910 28.250 124.523 1.00 0.00 H TER 62681 WAT 3250 ATOM 62681 O WAT 3251 92.375 8.486 13.312 1.00 0.00 O ATOM 62682 H1 WAT 3251 91.547 8.965 13.351 1.00 0.00 H ATOM 62683 H2 WAT 3251 92.559 8.253 14.222 1.00 0.00 H TER 62685 WAT 3251 ATOM 62685 O WAT 3252 120.763 39.921 80.343 1.00 0.00 O ATOM 62686 H1 WAT 3252 121.558 39.396 80.261 1.00 0.00 H ATOM 62687 H2 WAT 3252 120.053 39.279 80.372 1.00 0.00 H TER 62689 WAT 3252 ATOM 62689 O WAT 3253 82.619 67.568 128.381 1.00 0.00 O ATOM 62690 H1 WAT 3253 82.515 68.518 128.429 1.00 0.00 H ATOM 62691 H2 WAT 3253 83.442 67.441 127.908 1.00 0.00 H TER 62693 WAT 3253 ATOM 62693 O WAT 3254 1.744 5.142 155.497 1.00 0.00 O ATOM 62694 H1 WAT 3254 2.104 6.009 155.686 1.00 0.00 H ATOM 62695 H2 WAT 3254 1.869 4.650 156.308 1.00 0.00 H TER 62697 WAT 3254 ATOM 62697 O WAT 3255 79.758 84.242 94.845 1.00 0.00 O ATOM 62698 H1 WAT 3255 79.907 85.186 94.910 1.00 0.00 H ATOM 62699 H2 WAT 3255 79.024 84.157 94.237 1.00 0.00 H TER 62701 WAT 3255 ATOM 62701 O WAT 3256 129.125 78.867 98.273 1.00 0.00 O ATOM 62702 H1 WAT 3256 130.051 78.725 98.471 1.00 0.00 H ATOM 62703 H2 WAT 3256 129.093 78.939 97.319 1.00 0.00 H TER 62705 WAT 3256 ATOM 62705 O WAT 3257 73.723 73.635 110.199 1.00 0.00 O ATOM 62706 H1 WAT 3257 73.494 73.606 111.128 1.00 0.00 H ATOM 62707 H2 WAT 3257 73.434 72.790 109.855 1.00 0.00 H TER 62709 WAT 3257 ATOM 62709 O WAT 3258 4.700 23.905 13.543 1.00 0.00 O ATOM 62710 H1 WAT 3258 4.838 23.162 14.130 1.00 0.00 H ATOM 62711 H2 WAT 3258 3.749 23.981 13.470 1.00 0.00 H TER 62713 WAT 3258 ATOM 62713 O WAT 3259 1.645 140.222 144.914 1.00 0.00 O ATOM 62714 H1 WAT 3259 1.768 141.001 144.371 1.00 0.00 H ATOM 62715 H2 WAT 3259 0.842 139.821 144.579 1.00 0.00 H TER 62717 WAT 3259 ATOM 62717 O WAT 3260 133.238 118.132 87.625 1.00 0.00 O ATOM 62718 H1 WAT 3260 133.669 117.777 88.402 1.00 0.00 H ATOM 62719 H2 WAT 3260 132.306 118.129 87.845 1.00 0.00 H TER 62721 WAT 3260 ATOM 62721 O WAT 3261 3.530 98.009 150.972 1.00 0.00 O ATOM 62722 H1 WAT 3261 4.292 97.792 150.434 1.00 0.00 H ATOM 62723 H2 WAT 3261 3.485 98.965 150.947 1.00 0.00 H TER 62725 WAT 3261 ATOM 62725 O WAT 3262 35.211 12.561 105.087 1.00 0.00 O ATOM 62726 H1 WAT 3262 35.300 13.296 105.694 1.00 0.00 H ATOM 62727 H2 WAT 3262 34.461 12.066 105.419 1.00 0.00 H TER 62729 WAT 3262 ATOM 62729 O WAT 3263 68.380 35.859 125.620 1.00 0.00 O ATOM 62730 H1 WAT 3263 69.292 35.875 125.910 1.00 0.00 H ATOM 62731 H2 WAT 3263 68.360 35.201 124.926 1.00 0.00 H TER 62733 WAT 3263 ATOM 62733 O WAT 3264 92.922 44.751 145.466 1.00 0.00 O ATOM 62734 H1 WAT 3264 93.341 45.158 146.225 1.00 0.00 H ATOM 62735 H2 WAT 3264 91.993 44.959 145.565 1.00 0.00 H TER 62737 WAT 3264 ATOM 62737 O WAT 3265 99.516 111.481 108.683 1.00 0.00 O ATOM 62738 H1 WAT 3265 98.788 111.273 109.268 1.00 0.00 H ATOM 62739 H2 WAT 3265 99.226 112.260 108.208 1.00 0.00 H TER 62741 WAT 3265 ATOM 62741 O WAT 3266 95.312 68.630 120.120 1.00 0.00 O ATOM 62742 H1 WAT 3266 94.889 69.364 119.673 1.00 0.00 H ATOM 62743 H2 WAT 3266 96.064 68.415 119.567 1.00 0.00 H TER 62745 WAT 3266 ATOM 62745 O WAT 3267 50.918 39.425 80.329 1.00 0.00 O ATOM 62746 H1 WAT 3267 50.931 40.376 80.434 1.00 0.00 H ATOM 62747 H2 WAT 3267 51.023 39.285 79.388 1.00 0.00 H TER 62749 WAT 3267 ATOM 62749 O WAT 3268 70.977 39.635 105.485 1.00 0.00 O ATOM 62750 H1 WAT 3268 71.015 38.679 105.530 1.00 0.00 H ATOM 62751 H2 WAT 3268 71.738 39.880 104.958 1.00 0.00 H TER 62753 WAT 3268 ATOM 62753 O WAT 3269 38.128 1.011 114.663 1.00 0.00 O ATOM 62754 H1 WAT 3269 38.156 1.858 114.217 1.00 0.00 H ATOM 62755 H2 WAT 3269 38.247 0.368 113.965 1.00 0.00 H TER 62757 WAT 3269 ATOM 62757 O WAT 3270 110.644 34.566 74.427 1.00 0.00 O ATOM 62758 H1 WAT 3270 109.770 34.845 74.153 1.00 0.00 H ATOM 62759 H2 WAT 3270 110.557 34.395 75.365 1.00 0.00 H TER 62761 WAT 3270 ATOM 62761 O WAT 3271 41.198 134.101 143.633 1.00 0.00 O ATOM 62762 H1 WAT 3271 40.816 133.337 144.064 1.00 0.00 H ATOM 62763 H2 WAT 3271 42.142 133.943 143.658 1.00 0.00 H TER 62765 WAT 3271 ATOM 62765 O WAT 3272 131.742 38.218 131.086 1.00 0.00 O ATOM 62766 H1 WAT 3272 131.970 38.366 132.004 1.00 0.00 H ATOM 62767 H2 WAT 3272 132.559 37.933 130.678 1.00 0.00 H TER 62769 WAT 3272 ATOM 62769 O WAT 3273 33.544 15.907 0.323 1.00 0.00 O ATOM 62770 H1 WAT 3273 32.866 16.522 0.603 1.00 0.00 H ATOM 62771 H2 WAT 3273 33.560 15.986 -0.631 1.00 0.00 H TER 62773 WAT 3273 ATOM 62773 O WAT 3274 126.629 90.403 110.198 1.00 0.00 O ATOM 62774 H1 WAT 3274 125.891 89.862 110.476 1.00 0.00 H ATOM 62775 H2 WAT 3274 127.376 89.804 110.190 1.00 0.00 H TER 62777 WAT 3274 ATOM 62777 O WAT 3275 75.185 120.428 112.759 1.00 0.00 O ATOM 62778 H1 WAT 3275 75.273 119.480 112.861 1.00 0.00 H ATOM 62779 H2 WAT 3275 75.447 120.597 111.855 1.00 0.00 H TER 62781 WAT 3275 ATOM 62781 O WAT 3276 13.874 29.961 3.565 1.00 0.00 O ATOM 62782 H1 WAT 3276 14.208 29.191 3.105 1.00 0.00 H ATOM 62783 H2 WAT 3276 13.602 30.557 2.867 1.00 0.00 H TER 62785 WAT 3276 ATOM 62785 O WAT 3277 107.011 91.614 131.783 1.00 0.00 O ATOM 62786 H1 WAT 3277 106.177 92.013 131.535 1.00 0.00 H ATOM 62787 H2 WAT 3277 106.784 91.001 132.483 1.00 0.00 H TER 62789 WAT 3277 ATOM 62789 O WAT 3278 139.420 77.585 16.202 1.00 0.00 O ATOM 62790 H1 WAT 3278 138.466 77.538 16.142 1.00 0.00 H ATOM 62791 H2 WAT 3278 139.697 76.677 16.324 1.00 0.00 H TER 62793 WAT 3278 ATOM 62793 O WAT 3279 70.285 96.459 93.380 1.00 0.00 O ATOM 62794 H1 WAT 3279 70.775 95.882 93.966 1.00 0.00 H ATOM 62795 H2 WAT 3279 70.950 96.838 92.806 1.00 0.00 H TER 62797 WAT 3279 ATOM 62797 O WAT 3280 59.242 112.847 143.602 1.00 0.00 O ATOM 62798 H1 WAT 3280 58.985 113.638 143.127 1.00 0.00 H ATOM 62799 H2 WAT 3280 60.068 113.081 144.027 1.00 0.00 H TER 62801 WAT 3280 ATOM 62801 O WAT 3281 31.497 17.736 1.225 1.00 0.00 O ATOM 62802 H1 WAT 3281 30.934 17.606 1.988 1.00 0.00 H ATOM 62803 H2 WAT 3281 31.481 18.681 1.074 1.00 0.00 H TER 62805 WAT 3281 ATOM 62805 O WAT 3282 42.205 9.482 21.289 1.00 0.00 O ATOM 62806 H1 WAT 3282 42.571 8.662 20.960 1.00 0.00 H ATOM 62807 H2 WAT 3282 41.378 9.228 21.700 1.00 0.00 H TER 62809 WAT 3282 ATOM 62809 O WAT 3283 7.414 83.552 98.757 1.00 0.00 O ATOM 62810 H1 WAT 3283 6.920 84.343 98.973 1.00 0.00 H ATOM 62811 H2 WAT 3283 6.809 83.027 98.233 1.00 0.00 H TER 62813 WAT 3283 ATOM 62813 O WAT 3284 106.641 76.294 148.811 1.00 0.00 O ATOM 62814 H1 WAT 3284 106.920 77.154 148.496 1.00 0.00 H ATOM 62815 H2 WAT 3284 105.748 76.195 148.481 1.00 0.00 H TER 62817 WAT 3284 ATOM 62817 O WAT 3285 44.584 24.182 82.707 1.00 0.00 O ATOM 62818 H1 WAT 3285 45.411 24.420 83.126 1.00 0.00 H ATOM 62819 H2 WAT 3285 44.843 23.677 81.936 1.00 0.00 H TER 62821 WAT 3285 ATOM 62821 O WAT 3286 11.626 83.934 3.968 1.00 0.00 O ATOM 62822 H1 WAT 3286 10.694 83.880 4.180 1.00 0.00 H ATOM 62823 H2 WAT 3286 11.779 83.201 3.371 1.00 0.00 H TER 62825 WAT 3286 ATOM 62825 O WAT 3287 4.542 83.271 10.649 1.00 0.00 O ATOM 62826 H1 WAT 3287 5.250 83.884 10.449 1.00 0.00 H ATOM 62827 H2 WAT 3287 4.990 82.473 10.932 1.00 0.00 H TER 62829 WAT 3287 ATOM 62829 O WAT 3288 43.321 82.071 86.904 1.00 0.00 O ATOM 62830 H1 WAT 3288 43.487 82.951 87.242 1.00 0.00 H ATOM 62831 H2 WAT 3288 42.702 81.688 87.526 1.00 0.00 H TER 62833 WAT 3288 ATOM 62833 O WAT 3289 120.950 50.828 66.405 1.00 0.00 O ATOM 62834 H1 WAT 3289 120.038 50.550 66.319 1.00 0.00 H ATOM 62835 H2 WAT 3289 120.915 51.587 66.987 1.00 0.00 H TER 62837 WAT 3289 ATOM 62837 O WAT 3290 128.306 104.605 104.074 1.00 0.00 O ATOM 62838 H1 WAT 3290 127.628 103.995 103.784 1.00 0.00 H ATOM 62839 H2 WAT 3290 129.129 104.143 103.912 1.00 0.00 H TER 62841 WAT 3290 ATOM 62841 O WAT 3291 138.285 8.146 116.879 1.00 0.00 O ATOM 62842 H1 WAT 3291 138.571 7.236 116.961 1.00 0.00 H ATOM 62843 H2 WAT 3291 137.331 8.103 116.947 1.00 0.00 H TER 62845 WAT 3291 ATOM 62845 O WAT 3292 55.131 23.446 103.533 1.00 0.00 O ATOM 62846 H1 WAT 3292 54.573 23.492 104.309 1.00 0.00 H ATOM 62847 H2 WAT 3292 55.671 22.668 103.673 1.00 0.00 H TER 62849 WAT 3292 ATOM 62849 O WAT 3293 53.031 71.268 152.325 1.00 0.00 O ATOM 62850 H1 WAT 3293 52.378 71.322 153.023 1.00 0.00 H ATOM 62851 H2 WAT 3293 53.381 72.156 152.255 1.00 0.00 H TER 62853 WAT 3293 ATOM 62853 O WAT 3294 42.708 31.195 112.196 1.00 0.00 O ATOM 62854 H1 WAT 3294 43.653 31.192 112.348 1.00 0.00 H ATOM 62855 H2 WAT 3294 42.590 30.663 111.409 1.00 0.00 H TER 62857 WAT 3294 ATOM 62857 O WAT 3295 119.165 139.765 151.411 1.00 0.00 O ATOM 62858 H1 WAT 3295 120.098 139.968 151.343 1.00 0.00 H ATOM 62859 H2 WAT 3295 118.809 140.459 151.965 1.00 0.00 H TER 62861 WAT 3295 ATOM 62861 O WAT 3296 36.677 125.816 5.294 1.00 0.00 O ATOM 62862 H1 WAT 3296 37.070 125.453 4.500 1.00 0.00 H ATOM 62863 H2 WAT 3296 36.760 125.118 5.943 1.00 0.00 H TER 62865 WAT 3296 ATOM 62865 O WAT 3297 142.181 129.296 154.857 1.00 0.00 O ATOM 62866 H1 WAT 3297 141.739 129.547 155.669 1.00 0.00 H ATOM 62867 H2 WAT 3297 142.859 128.681 155.135 1.00 0.00 H TER 62869 WAT 3297 ATOM 62869 O WAT 3298 53.614 4.021 145.748 1.00 0.00 O ATOM 62870 H1 WAT 3298 54.406 3.697 146.178 1.00 0.00 H ATOM 62871 H2 WAT 3298 53.933 4.457 144.958 1.00 0.00 H TER 62873 WAT 3298 ATOM 62873 O WAT 3299 16.131 44.516 63.850 1.00 0.00 O ATOM 62874 H1 WAT 3299 16.331 45.121 64.564 1.00 0.00 H ATOM 62875 H2 WAT 3299 16.005 45.079 63.087 1.00 0.00 H TER 62877 WAT 3299 ATOM 62877 O WAT 3300 42.995 53.198 114.458 1.00 0.00 O ATOM 62878 H1 WAT 3300 43.109 54.145 114.389 1.00 0.00 H ATOM 62879 H2 WAT 3300 42.275 53.088 115.079 1.00 0.00 H TER 62881 WAT 3300 ATOM 62881 O WAT 3301 79.069 12.104 132.404 1.00 0.00 O ATOM 62882 H1 WAT 3301 79.308 12.961 132.756 1.00 0.00 H ATOM 62883 H2 WAT 3301 79.818 11.544 132.607 1.00 0.00 H TER 62885 WAT 3301 ATOM 62885 O WAT 3302 59.771 102.982 5.526 1.00 0.00 O ATOM 62886 H1 WAT 3302 59.874 102.862 6.470 1.00 0.00 H ATOM 62887 H2 WAT 3302 58.887 103.333 5.424 1.00 0.00 H TER 62889 WAT 3302 ATOM 62889 O WAT 3303 53.260 41.123 131.080 1.00 0.00 O ATOM 62890 H1 WAT 3303 53.788 40.326 131.132 1.00 0.00 H ATOM 62891 H2 WAT 3303 52.363 40.827 131.235 1.00 0.00 H TER 62893 WAT 3303 ATOM 62893 O WAT 3304 135.831 22.980 124.693 1.00 0.00 O ATOM 62894 H1 WAT 3304 135.698 22.407 125.447 1.00 0.00 H ATOM 62895 H2 WAT 3304 135.001 22.946 124.216 1.00 0.00 H TER 62897 WAT 3304 ATOM 62897 O WAT 3305 64.801 32.509 79.420 1.00 0.00 O ATOM 62898 H1 WAT 3305 65.251 33.338 79.585 1.00 0.00 H ATOM 62899 H2 WAT 3305 65.290 31.866 79.933 1.00 0.00 H TER 62901 WAT 3305 ATOM 62901 O WAT 3306 79.793 75.037 134.797 1.00 0.00 O ATOM 62902 H1 WAT 3306 79.476 75.682 135.428 1.00 0.00 H ATOM 62903 H2 WAT 3306 80.611 74.713 135.176 1.00 0.00 H TER 62905 WAT 3306 ATOM 62905 O WAT 3307 49.109 63.164 118.071 1.00 0.00 O ATOM 62906 H1 WAT 3307 49.428 63.783 118.728 1.00 0.00 H ATOM 62907 H2 WAT 3307 49.587 62.355 118.252 1.00 0.00 H TER 62909 WAT 3307 ATOM 62909 O WAT 3308 93.355 99.990 99.386 1.00 0.00 O ATOM 62910 H1 WAT 3308 94.191 100.405 99.598 1.00 0.00 H ATOM 62911 H2 WAT 3308 92.696 100.579 99.753 1.00 0.00 H TER 62913 WAT 3308 ATOM 62913 O WAT 3309 54.756 24.374 2.427 1.00 0.00 O ATOM 62914 H1 WAT 3309 54.370 23.575 2.069 1.00 0.00 H ATOM 62915 H2 WAT 3309 55.507 24.551 1.861 1.00 0.00 H TER 62917 WAT 3309 ATOM 62917 O WAT 3310 137.173 2.774 85.304 1.00 0.00 O ATOM 62918 H1 WAT 3310 137.656 3.107 84.547 1.00 0.00 H ATOM 62919 H2 WAT 3310 137.165 1.825 85.184 1.00 0.00 H TER 62921 WAT 3310 ATOM 62921 O WAT 3311 57.653 48.432 92.244 1.00 0.00 O ATOM 62922 H1 WAT 3311 57.839 49.333 91.978 1.00 0.00 H ATOM 62923 H2 WAT 3311 57.579 48.474 93.198 1.00 0.00 H TER 62925 WAT 3311 ATOM 62925 O WAT 3312 140.735 47.543 -0.120 1.00 0.00 O ATOM 62926 H1 WAT 3312 140.847 46.804 0.477 1.00 0.00 H ATOM 62927 H2 WAT 3312 141.428 48.156 0.123 1.00 0.00 H TER 62929 WAT 3312 ATOM 62929 O WAT 3313 50.926 91.357 93.524 1.00 0.00 O ATOM 62930 H1 WAT 3313 50.386 91.686 92.806 1.00 0.00 H ATOM 62931 H2 WAT 3313 50.929 92.067 94.166 1.00 0.00 H TER 62933 WAT 3313 ATOM 62933 O WAT 3314 134.824 86.555 90.606 1.00 0.00 O ATOM 62934 H1 WAT 3314 134.383 85.725 90.788 1.00 0.00 H ATOM 62935 H2 WAT 3314 134.849 87.003 91.452 1.00 0.00 H TER 62937 WAT 3314 ATOM 62937 O WAT 3315 18.350 102.349 116.533 1.00 0.00 O ATOM 62938 H1 WAT 3315 18.092 102.526 115.629 1.00 0.00 H ATOM 62939 H2 WAT 3315 18.504 101.405 116.557 1.00 0.00 H TER 62941 WAT 3315 ATOM 62941 O WAT 3316 38.478 136.825 4.867 1.00 0.00 O ATOM 62942 H1 WAT 3316 39.435 136.795 4.859 1.00 0.00 H ATOM 62943 H2 WAT 3316 38.239 136.594 5.765 1.00 0.00 H TER 62945 WAT 3316 ATOM 62945 O WAT 3317 37.053 20.409 62.529 1.00 0.00 O ATOM 62946 H1 WAT 3317 36.814 20.016 61.689 1.00 0.00 H ATOM 62947 H2 WAT 3317 36.877 21.343 62.416 1.00 0.00 H TER 62949 WAT 3317 ATOM 62949 O WAT 3318 106.507 61.548 6.004 1.00 0.00 O ATOM 62950 H1 WAT 3318 105.672 61.869 5.665 1.00 0.00 H ATOM 62951 H2 WAT 3318 106.313 61.279 6.902 1.00 0.00 H TER 62953 WAT 3318 ATOM 62953 O WAT 3319 130.735 29.361 156.977 1.00 0.00 O ATOM 62954 H1 WAT 3319 130.883 28.890 157.798 1.00 0.00 H ATOM 62955 H2 WAT 3319 130.204 28.763 156.451 1.00 0.00 H TER 62957 WAT 3319 ATOM 62957 O WAT 3320 139.581 3.529 7.275 1.00 0.00 O ATOM 62958 H1 WAT 3320 138.774 3.042 7.443 1.00 0.00 H ATOM 62959 H2 WAT 3320 139.672 3.519 6.322 1.00 0.00 H TER 62961 WAT 3320 ATOM 62961 O WAT 3321 124.509 142.236 132.090 1.00 0.00 O ATOM 62962 H1 WAT 3321 125.032 141.498 132.405 1.00 0.00 H ATOM 62963 H2 WAT 3321 125.150 142.921 131.903 1.00 0.00 H TER 62965 WAT 3321 ATOM 62965 O WAT 3322 48.090 115.088 109.761 1.00 0.00 O ATOM 62966 H1 WAT 3322 48.890 115.519 110.060 1.00 0.00 H ATOM 62967 H2 WAT 3322 48.125 115.152 108.807 1.00 0.00 H TER 62969 WAT 3322 ATOM 62969 O WAT 3323 44.960 122.340 53.004 1.00 0.00 O ATOM 62970 H1 WAT 3323 45.030 121.596 52.407 1.00 0.00 H ATOM 62971 H2 WAT 3323 45.621 122.959 52.694 1.00 0.00 H TER 62973 WAT 3323 ATOM 62973 O WAT 3324 134.955 15.455 89.705 1.00 0.00 O ATOM 62974 H1 WAT 3324 135.625 15.015 90.228 1.00 0.00 H ATOM 62975 H2 WAT 3324 134.888 16.330 90.088 1.00 0.00 H TER 62977 WAT 3324 ATOM 62977 O WAT 3325 77.640 119.405 1.007 1.00 0.00 O ATOM 62978 H1 WAT 3325 78.577 119.401 1.201 1.00 0.00 H ATOM 62979 H2 WAT 3325 77.271 120.045 1.615 1.00 0.00 H TER 62981 WAT 3325 ATOM 62981 O WAT 3326 18.834 143.937 98.279 1.00 0.00 O ATOM 62982 H1 WAT 3326 18.556 143.241 97.684 1.00 0.00 H ATOM 62983 H2 WAT 3326 18.041 144.449 98.436 1.00 0.00 H TER 62985 WAT 3326 ATOM 62985 O WAT 3327 51.227 77.282 120.635 1.00 0.00 O ATOM 62986 H1 WAT 3327 51.269 77.360 121.588 1.00 0.00 H ATOM 62987 H2 WAT 3327 52.064 77.634 120.329 1.00 0.00 H TER 62989 WAT 3327 ATOM 62989 O WAT 3328 1.750 69.297 2.009 1.00 0.00 O ATOM 62990 H1 WAT 3328 1.186 69.583 2.727 1.00 0.00 H ATOM 62991 H2 WAT 3328 2.049 70.110 1.602 1.00 0.00 H TER 62993 WAT 3328 ATOM 62993 O WAT 3329 67.497 64.428 126.524 1.00 0.00 O ATOM 62994 H1 WAT 3329 68.408 64.666 126.693 1.00 0.00 H ATOM 62995 H2 WAT 3329 67.413 63.539 126.869 1.00 0.00 H TER 62997 WAT 3329 ATOM 62997 O WAT 3330 41.764 9.348 95.346 1.00 0.00 O ATOM 62998 H1 WAT 3330 42.599 9.613 94.962 1.00 0.00 H ATOM 62999 H2 WAT 3330 42.006 8.775 96.074 1.00 0.00 H TER 63001 WAT 3330 ATOM 63001 O WAT 3331 139.434 13.292 126.718 1.00 0.00 O ATOM 63002 H1 WAT 3331 139.863 13.833 127.382 1.00 0.00 H ATOM 63003 H2 WAT 3331 140.027 13.321 125.967 1.00 0.00 H TER 63005 WAT 3331 ATOM 63005 O WAT 3332 125.626 79.219 118.870 1.00 0.00 O ATOM 63006 H1 WAT 3332 125.756 78.314 119.152 1.00 0.00 H ATOM 63007 H2 WAT 3332 125.466 79.702 119.680 1.00 0.00 H TER 63009 WAT 3332 ATOM 63009 O WAT 3333 55.540 82.952 68.339 1.00 0.00 O ATOM 63010 H1 WAT 3333 55.497 83.485 67.545 1.00 0.00 H ATOM 63011 H2 WAT 3333 56.025 83.492 68.963 1.00 0.00 H TER 63013 WAT 3333 ATOM 63013 O WAT 3334 27.146 18.901 114.751 1.00 0.00 O ATOM 63014 H1 WAT 3334 26.360 18.753 114.225 1.00 0.00 H ATOM 63015 H2 WAT 3334 27.828 18.396 114.310 1.00 0.00 H TER 63017 WAT 3334 ATOM 63017 O WAT 3335 20.449 73.360 137.869 1.00 0.00 O ATOM 63018 H1 WAT 3335 21.004 74.135 137.790 1.00 0.00 H ATOM 63019 H2 WAT 3335 19.670 73.569 137.353 1.00 0.00 H TER 63021 WAT 3335 ATOM 63021 O WAT 3336 121.729 49.216 9.499 1.00 0.00 O ATOM 63022 H1 WAT 3336 122.288 48.759 8.871 1.00 0.00 H ATOM 63023 H2 WAT 3336 122.044 50.120 9.486 1.00 0.00 H TER 63025 WAT 3336 ATOM 63025 O WAT 3337 120.019 43.820 81.782 1.00 0.00 O ATOM 63026 H1 WAT 3337 120.474 44.644 81.610 1.00 0.00 H ATOM 63027 H2 WAT 3337 120.647 43.299 82.282 1.00 0.00 H TER 63029 WAT 3337 ATOM 63029 O WAT 3338 118.018 59.089 21.773 1.00 0.00 O ATOM 63030 H1 WAT 3338 118.335 59.603 22.516 1.00 0.00 H ATOM 63031 H2 WAT 3338 118.039 58.183 22.083 1.00 0.00 H TER 63033 WAT 3338 ATOM 63033 O WAT 3339 41.619 73.249 96.729 1.00 0.00 O ATOM 63034 H1 WAT 3339 40.918 73.027 97.342 1.00 0.00 H ATOM 63035 H2 WAT 3339 41.179 73.716 96.019 1.00 0.00 H TER 63037 WAT 3339 ATOM 63037 O WAT 3340 100.707 9.756 114.194 1.00 0.00 O ATOM 63038 H1 WAT 3340 101.123 9.459 115.003 1.00 0.00 H ATOM 63039 H2 WAT 3340 100.217 10.537 114.450 1.00 0.00 H TER 63041 WAT 3340 ATOM 63041 O WAT 3341 5.012 87.279 152.902 1.00 0.00 O ATOM 63042 H1 WAT 3341 4.290 86.691 153.127 1.00 0.00 H ATOM 63043 H2 WAT 3341 4.695 88.150 153.141 1.00 0.00 H TER 63045 WAT 3341 ATOM 63045 O WAT 3342 11.648 73.174 134.269 1.00 0.00 O ATOM 63046 H1 WAT 3342 11.278 74.056 134.312 1.00 0.00 H ATOM 63047 H2 WAT 3342 11.802 72.934 135.183 1.00 0.00 H TER 63049 WAT 3342 ATOM 63049 O WAT 3343 123.232 121.225 139.398 1.00 0.00 O ATOM 63050 H1 WAT 3343 122.691 121.714 140.018 1.00 0.00 H ATOM 63051 H2 WAT 3343 124.005 120.972 139.902 1.00 0.00 H TER 63053 WAT 3343 ATOM 63053 O WAT 3344 110.967 52.439 83.285 1.00 0.00 O ATOM 63054 H1 WAT 3344 110.496 52.284 82.466 1.00 0.00 H ATOM 63055 H2 WAT 3344 111.544 51.682 83.377 1.00 0.00 H TER 63057 WAT 3344 ATOM 63057 O WAT 3345 138.134 119.485 96.886 1.00 0.00 O ATOM 63058 H1 WAT 3345 137.291 119.188 97.227 1.00 0.00 H ATOM 63059 H2 WAT 3345 138.730 118.754 97.050 1.00 0.00 H TER 63061 WAT 3345 ATOM 63061 O WAT 3346 26.209 41.542 61.289 1.00 0.00 O ATOM 63062 H1 WAT 3346 26.701 40.723 61.226 1.00 0.00 H ATOM 63063 H2 WAT 3346 26.844 42.221 61.061 1.00 0.00 H TER 63065 WAT 3346 ATOM 63065 O WAT 3347 51.326 145.866 129.699 1.00 0.00 O ATOM 63066 H1 WAT 3347 52.083 145.305 129.868 1.00 0.00 H ATOM 63067 H2 WAT 3347 50.739 145.324 129.172 1.00 0.00 H TER 63069 WAT 3347 ATOM 63069 O WAT 3348 10.593 133.951 132.698 1.00 0.00 O ATOM 63070 H1 WAT 3348 11.068 133.438 132.045 1.00 0.00 H ATOM 63071 H2 WAT 3348 10.249 133.301 133.310 1.00 0.00 H TER 63073 WAT 3348 ATOM 63073 O WAT 3349 106.781 38.123 4.140 1.00 0.00 O ATOM 63074 H1 WAT 3349 106.763 37.206 4.415 1.00 0.00 H ATOM 63075 H2 WAT 3349 107.485 38.515 4.655 1.00 0.00 H TER 63077 WAT 3349 ATOM 63077 O WAT 3350 10.455 0.537 13.606 1.00 0.00 O ATOM 63078 H1 WAT 3350 10.582 -0.339 13.971 1.00 0.00 H ATOM 63079 H2 WAT 3350 10.569 1.126 14.351 1.00 0.00 H TER 63081 WAT 3350 ATOM 63081 O WAT 3351 60.746 30.683 77.669 1.00 0.00 O ATOM 63082 H1 WAT 3351 61.377 30.104 77.242 1.00 0.00 H ATOM 63083 H2 WAT 3351 60.492 31.305 76.987 1.00 0.00 H TER 63085 WAT 3351 ATOM 63085 O WAT 3352 15.878 4.404 22.331 1.00 0.00 O ATOM 63086 H1 WAT 3352 15.213 4.907 22.801 1.00 0.00 H ATOM 63087 H2 WAT 3352 16.687 4.565 22.816 1.00 0.00 H TER 63089 WAT 3352 ATOM 63089 O WAT 3353 62.947 13.050 26.866 1.00 0.00 O ATOM 63090 H1 WAT 3353 62.023 12.879 26.686 1.00 0.00 H ATOM 63091 H2 WAT 3353 63.081 13.957 26.592 1.00 0.00 H TER 63093 WAT 3353 ATOM 63093 O WAT 3354 23.248 140.670 14.570 1.00 0.00 O ATOM 63094 H1 WAT 3354 23.054 141.180 13.783 1.00 0.00 H ATOM 63095 H2 WAT 3354 22.389 140.448 14.929 1.00 0.00 H TER 63097 WAT 3354 ATOM 63097 O WAT 3355 97.696 38.390 77.184 1.00 0.00 O ATOM 63098 H1 WAT 3355 98.036 37.736 76.574 1.00 0.00 H ATOM 63099 H2 WAT 3355 97.767 39.219 76.711 1.00 0.00 H TER 63101 WAT 3355 ATOM 63101 O WAT 3356 73.297 33.082 99.432 1.00 0.00 O ATOM 63102 H1 WAT 3356 72.828 33.088 100.266 1.00 0.00 H ATOM 63103 H2 WAT 3356 73.888 33.833 99.483 1.00 0.00 H TER 63105 WAT 3356 ATOM 63105 O WAT 3357 94.184 140.420 3.237 1.00 0.00 O ATOM 63106 H1 WAT 3357 94.773 140.560 3.978 1.00 0.00 H ATOM 63107 H2 WAT 3357 94.567 139.683 2.762 1.00 0.00 H TER 63109 WAT 3357 ATOM 63109 O WAT 3358 89.466 24.177 97.010 1.00 0.00 O ATOM 63110 H1 WAT 3358 88.759 24.488 96.444 1.00 0.00 H ATOM 63111 H2 WAT 3358 89.159 24.362 97.898 1.00 0.00 H TER 63113 WAT 3358 ATOM 63113 O WAT 3359 122.911 115.783 77.602 1.00 0.00 O ATOM 63114 H1 WAT 3359 123.396 116.603 77.505 1.00 0.00 H ATOM 63115 H2 WAT 3359 123.495 115.116 77.242 1.00 0.00 H TER 63117 WAT 3359 ATOM 63117 O WAT 3360 68.617 54.615 78.147 1.00 0.00 O ATOM 63118 H1 WAT 3360 69.375 54.181 77.755 1.00 0.00 H ATOM 63119 H2 WAT 3360 67.935 53.943 78.157 1.00 0.00 H TER 63121 WAT 3360 ATOM 63121 O WAT 3361 68.251 97.002 107.552 1.00 0.00 O ATOM 63122 H1 WAT 3361 67.796 97.377 108.306 1.00 0.00 H ATOM 63123 H2 WAT 3361 69.168 97.245 107.680 1.00 0.00 H TER 63125 WAT 3361 ATOM 63125 O WAT 3362 80.361 50.772 5.914 1.00 0.00 O ATOM 63126 H1 WAT 3362 81.230 50.897 5.532 1.00 0.00 H ATOM 63127 H2 WAT 3362 79.836 51.485 5.552 1.00 0.00 H TER 63129 WAT 3362 ATOM 63129 O WAT 3363 133.674 9.644 147.024 1.00 0.00 O ATOM 63130 H1 WAT 3363 134.565 9.679 147.373 1.00 0.00 H ATOM 63131 H2 WAT 3363 133.693 8.927 146.390 1.00 0.00 H TER 63133 WAT 3363 ATOM 63133 O WAT 3364 78.669 19.906 104.578 1.00 0.00 O ATOM 63134 H1 WAT 3364 78.434 20.208 103.701 1.00 0.00 H ATOM 63135 H2 WAT 3364 79.384 19.287 104.435 1.00 0.00 H TER 63137 WAT 3364 ATOM 63137 O WAT 3365 127.925 75.588 84.298 1.00 0.00 O ATOM 63138 H1 WAT 3365 128.578 76.025 84.844 1.00 0.00 H ATOM 63139 H2 WAT 3365 128.103 75.904 83.412 1.00 0.00 H TER 63141 WAT 3365 ATOM 63141 O WAT 3366 112.894 41.825 68.840 1.00 0.00 O ATOM 63142 H1 WAT 3366 113.029 42.298 68.019 1.00 0.00 H ATOM 63143 H2 WAT 3366 112.461 42.458 69.412 1.00 0.00 H TER 63145 WAT 3366 ATOM 63145 O WAT 3367 128.860 85.346 91.333 1.00 0.00 O ATOM 63146 H1 WAT 3367 128.455 84.484 91.241 1.00 0.00 H ATOM 63147 H2 WAT 3367 128.266 85.830 91.906 1.00 0.00 H TER 63149 WAT 3367 ATOM 63149 O WAT 3368 32.676 142.919 152.512 1.00 0.00 O ATOM 63150 H1 WAT 3368 31.943 143.311 152.986 1.00 0.00 H ATOM 63151 H2 WAT 3368 33.001 142.234 153.097 1.00 0.00 H TER 63153 WAT 3368 ATOM 63153 O WAT 3369 86.880 125.793 7.140 1.00 0.00 O ATOM 63154 H1 WAT 3369 87.712 125.791 7.612 1.00 0.00 H ATOM 63155 H2 WAT 3369 86.420 125.017 7.460 1.00 0.00 H TER 63157 WAT 3369 ATOM 63157 O WAT 3370 144.601 36.922 158.667 1.00 0.00 O ATOM 63158 H1 WAT 3370 143.867 36.941 158.052 1.00 0.00 H ATOM 63159 H2 WAT 3370 144.323 37.485 159.389 1.00 0.00 H TER 63161 WAT 3370 ATOM 63161 O WAT 3371 77.744 28.933 5.097 1.00 0.00 O ATOM 63162 H1 WAT 3371 77.395 28.206 5.612 1.00 0.00 H ATOM 63163 H2 WAT 3371 78.396 28.530 4.524 1.00 0.00 H TER 63165 WAT 3371 ATOM 63165 O WAT 3372 142.237 90.906 81.729 1.00 0.00 O ATOM 63166 H1 WAT 3372 141.407 91.135 82.147 1.00 0.00 H ATOM 63167 H2 WAT 3372 142.495 91.700 81.259 1.00 0.00 H TER 63169 WAT 3372 ATOM 63169 O WAT 3373 26.854 129.479 78.066 1.00 0.00 O ATOM 63170 H1 WAT 3373 26.610 129.341 78.981 1.00 0.00 H ATOM 63171 H2 WAT 3373 27.348 130.298 78.070 1.00 0.00 H TER 63173 WAT 3373 ATOM 63173 O WAT 3374 42.932 143.025 96.049 1.00 0.00 O ATOM 63174 H1 WAT 3374 42.783 143.886 95.659 1.00 0.00 H ATOM 63175 H2 WAT 3374 43.691 142.677 95.580 1.00 0.00 H TER 63177 WAT 3374 ATOM 63177 O WAT 3375 111.864 104.140 4.746 1.00 0.00 O ATOM 63178 H1 WAT 3375 112.003 104.906 4.189 1.00 0.00 H ATOM 63179 H2 WAT 3375 111.230 104.432 5.402 1.00 0.00 H TER 63181 WAT 3375 ATOM 63181 O WAT 3376 127.633 119.952 157.398 1.00 0.00 O ATOM 63182 H1 WAT 3376 127.536 119.058 157.070 1.00 0.00 H ATOM 63183 H2 WAT 3376 127.090 119.978 158.186 1.00 0.00 H TER 63185 WAT 3376 ATOM 63185 O WAT 3377 136.033 55.393 53.559 1.00 0.00 O ATOM 63186 H1 WAT 3377 136.956 55.642 53.605 1.00 0.00 H ATOM 63187 H2 WAT 3377 136.038 54.439 53.647 1.00 0.00 H TER 63189 WAT 3377 ATOM 63189 O WAT 3378 23.726 28.858 6.610 1.00 0.00 O ATOM 63190 H1 WAT 3378 23.929 28.199 7.273 1.00 0.00 H ATOM 63191 H2 WAT 3378 24.580 29.189 6.332 1.00 0.00 H TER 63193 WAT 3378 ATOM 63193 O WAT 3379 82.282 45.949 91.732 1.00 0.00 O ATOM 63194 H1 WAT 3379 81.385 45.646 91.590 1.00 0.00 H ATOM 63195 H2 WAT 3379 82.726 45.782 90.900 1.00 0.00 H TER 63197 WAT 3379 ATOM 63197 O WAT 3380 116.387 4.353 144.115 1.00 0.00 O ATOM 63198 H1 WAT 3380 116.700 3.721 144.761 1.00 0.00 H ATOM 63199 H2 WAT 3380 115.441 4.389 144.254 1.00 0.00 H TER 63201 WAT 3380 ATOM 63201 O WAT 3381 107.310 117.328 158.259 1.00 0.00 O ATOM 63202 H1 WAT 3381 107.437 116.899 159.105 1.00 0.00 H ATOM 63203 H2 WAT 3381 107.558 118.239 158.412 1.00 0.00 H TER 63205 WAT 3381 ATOM 63205 O WAT 3382 107.387 93.625 11.914 1.00 0.00 O ATOM 63206 H1 WAT 3382 107.859 94.427 11.691 1.00 0.00 H ATOM 63207 H2 WAT 3382 108.073 93.000 12.148 1.00 0.00 H TER 63209 WAT 3382 ATOM 63209 O WAT 3383 100.742 46.070 25.774 1.00 0.00 O ATOM 63210 H1 WAT 3383 100.470 46.535 24.982 1.00 0.00 H ATOM 63211 H2 WAT 3383 101.477 45.526 25.492 1.00 0.00 H TER 63213 WAT 3383 ATOM 63213 O WAT 3384 30.097 84.010 81.106 1.00 0.00 O ATOM 63214 H1 WAT 3384 29.228 84.045 81.506 1.00 0.00 H ATOM 63215 H2 WAT 3384 30.030 83.322 80.445 1.00 0.00 H TER 63217 WAT 3384 ATOM 63217 O WAT 3385 120.856 56.837 104.394 1.00 0.00 O ATOM 63218 H1 WAT 3385 120.273 57.590 104.488 1.00 0.00 H ATOM 63219 H2 WAT 3385 121.323 56.996 103.575 1.00 0.00 H TER 63221 WAT 3385 ATOM 63221 O WAT 3386 2.895 140.991 66.728 1.00 0.00 O ATOM 63222 H1 WAT 3386 3.171 141.896 66.583 1.00 0.00 H ATOM 63223 H2 WAT 3386 3.651 140.572 67.139 1.00 0.00 H TER 63225 WAT 3386 ATOM 63225 O WAT 3387 60.674 41.673 56.673 1.00 0.00 O ATOM 63226 H1 WAT 3387 60.595 40.867 56.164 1.00 0.00 H ATOM 63227 H2 WAT 3387 60.322 42.354 56.099 1.00 0.00 H TER 63229 WAT 3387 ATOM 63229 O WAT 3388 6.287 9.642 151.456 1.00 0.00 O ATOM 63230 H1 WAT 3388 6.979 8.983 151.505 1.00 0.00 H ATOM 63231 H2 WAT 3388 5.480 9.155 151.622 1.00 0.00 H TER 63233 WAT 3388 ATOM 63233 O WAT 3389 1.918 99.784 104.141 1.00 0.00 O ATOM 63234 H1 WAT 3389 1.326 99.326 104.737 1.00 0.00 H ATOM 63235 H2 WAT 3389 1.392 99.947 103.358 1.00 0.00 H TER 63237 WAT 3389 ATOM 63237 O WAT 3390 65.733 90.435 103.200 1.00 0.00 O ATOM 63238 H1 WAT 3390 66.553 89.942 103.174 1.00 0.00 H ATOM 63239 H2 WAT 3390 66.004 91.342 103.343 1.00 0.00 H TER 63241 WAT 3390 ATOM 63241 O WAT 3391 91.240 55.198 137.692 1.00 0.00 O ATOM 63242 H1 WAT 3391 91.693 55.339 138.524 1.00 0.00 H ATOM 63243 H2 WAT 3391 90.748 56.006 137.547 1.00 0.00 H TER 63245 WAT 3391 ATOM 63245 O WAT 3392 109.312 1.433 125.175 1.00 0.00 O ATOM 63246 H1 WAT 3392 109.829 1.370 125.978 1.00 0.00 H ATOM 63247 H2 WAT 3392 109.945 1.684 124.502 1.00 0.00 H TER 63249 WAT 3392 ATOM 63249 O WAT 3393 142.225 83.802 95.449 1.00 0.00 O ATOM 63250 H1 WAT 3393 141.824 84.669 95.514 1.00 0.00 H ATOM 63251 H2 WAT 3393 142.551 83.622 96.332 1.00 0.00 H TER 63253 WAT 3393 ATOM 63253 O WAT 3394 54.160 81.265 109.689 1.00 0.00 O ATOM 63254 H1 WAT 3394 54.783 80.580 109.447 1.00 0.00 H ATOM 63255 H2 WAT 3394 54.702 82.040 109.837 1.00 0.00 H TER 63257 WAT 3394 ATOM 63257 O WAT 3395 136.497 116.283 64.515 1.00 0.00 O ATOM 63258 H1 WAT 3395 137.132 116.917 64.183 1.00 0.00 H ATOM 63259 H2 WAT 3395 136.556 116.362 65.467 1.00 0.00 H TER 63261 WAT 3395 ATOM 63261 O WAT 3396 65.540 45.053 149.602 1.00 0.00 O ATOM 63262 H1 WAT 3396 66.441 45.296 149.389 1.00 0.00 H ATOM 63263 H2 WAT 3396 65.113 44.947 148.752 1.00 0.00 H TER 63265 WAT 3396 ATOM 63265 O WAT 3397 50.325 38.205 141.657 1.00 0.00 O ATOM 63266 H1 WAT 3397 50.323 38.706 142.473 1.00 0.00 H ATOM 63267 H2 WAT 3397 49.427 37.883 141.572 1.00 0.00 H TER 63269 WAT 3397 ATOM 63269 O WAT 3398 21.622 46.026 106.510 1.00 0.00 O ATOM 63270 H1 WAT 3398 21.566 45.071 106.475 1.00 0.00 H ATOM 63271 H2 WAT 3398 21.926 46.280 105.638 1.00 0.00 H TER 63273 WAT 3398 ATOM 63273 O WAT 3399 64.291 138.844 151.167 1.00 0.00 O ATOM 63274 H1 WAT 3399 64.071 139.033 152.079 1.00 0.00 H ATOM 63275 H2 WAT 3399 64.492 137.908 151.158 1.00 0.00 H TER 63277 WAT 3399 ATOM 63277 O WAT 3400 37.168 84.962 71.866 1.00 0.00 O ATOM 63278 H1 WAT 3400 36.670 84.220 72.208 1.00 0.00 H ATOM 63279 H2 WAT 3400 37.926 85.031 72.447 1.00 0.00 H TER 63281 WAT 3400 ATOM 63281 O WAT 3401 18.027 107.472 76.881 1.00 0.00 O ATOM 63282 H1 WAT 3401 17.916 106.618 77.298 1.00 0.00 H ATOM 63283 H2 WAT 3401 18.918 107.454 76.531 1.00 0.00 H TER 63285 WAT 3401 ATOM 63285 O WAT 3402 73.178 87.790 9.066 1.00 0.00 O ATOM 63286 H1 WAT 3402 72.870 88.235 8.276 1.00 0.00 H ATOM 63287 H2 WAT 3402 73.557 86.971 8.746 1.00 0.00 H TER 63289 WAT 3402 ATOM 63289 O WAT 3403 132.172 56.070 132.375 1.00 0.00 O ATOM 63290 H1 WAT 3403 131.554 56.528 132.945 1.00 0.00 H ATOM 63291 H2 WAT 3403 131.695 55.295 132.079 1.00 0.00 H TER 63293 WAT 3403 ATOM 63293 O WAT 3404 8.769 121.878 21.448 1.00 0.00 O ATOM 63294 H1 WAT 3404 8.172 122.332 22.042 1.00 0.00 H ATOM 63295 H2 WAT 3404 8.485 120.964 21.473 1.00 0.00 H TER 63297 WAT 3404 ATOM 63297 O WAT 3405 23.078 45.011 19.783 1.00 0.00 O ATOM 63298 H1 WAT 3405 22.668 44.332 20.319 1.00 0.00 H ATOM 63299 H2 WAT 3405 23.337 45.687 20.410 1.00 0.00 H TER 63301 WAT 3405 ATOM 63301 O WAT 3406 99.081 94.705 127.923 1.00 0.00 O ATOM 63302 H1 WAT 3406 98.536 94.883 127.157 1.00 0.00 H ATOM 63303 H2 WAT 3406 99.933 95.083 127.703 1.00 0.00 H TER 63305 WAT 3406 ATOM 63305 O WAT 3407 64.307 111.679 74.932 1.00 0.00 O ATOM 63306 H1 WAT 3407 64.188 110.731 74.870 1.00 0.00 H ATOM 63307 H2 WAT 3407 63.935 112.021 74.120 1.00 0.00 H TER 63309 WAT 3407 ATOM 63309 O WAT 3408 5.093 120.473 84.949 1.00 0.00 O ATOM 63310 H1 WAT 3408 4.159 120.602 84.785 1.00 0.00 H ATOM 63311 H2 WAT 3408 5.228 120.803 85.838 1.00 0.00 H TER 63313 WAT 3408 ATOM 63313 O WAT 3409 78.552 61.796 118.583 1.00 0.00 O ATOM 63314 H1 WAT 3409 77.989 62.013 117.840 1.00 0.00 H ATOM 63315 H2 WAT 3409 78.188 62.297 119.313 1.00 0.00 H TER 63317 WAT 3409 ATOM 63317 O WAT 3410 38.276 48.748 135.670 1.00 0.00 O ATOM 63318 H1 WAT 3410 39.221 48.677 135.535 1.00 0.00 H ATOM 63319 H2 WAT 3410 38.096 48.166 136.409 1.00 0.00 H TER 63321 WAT 3410 ATOM 63321 O WAT 3411 3.173 2.933 131.163 1.00 0.00 O ATOM 63322 H1 WAT 3411 2.216 2.919 131.186 1.00 0.00 H ATOM 63323 H2 WAT 3411 3.404 3.844 131.347 1.00 0.00 H TER 63325 WAT 3411 ATOM 63325 O WAT 3412 20.157 4.331 126.715 1.00 0.00 O ATOM 63326 H1 WAT 3412 19.704 5.137 126.963 1.00 0.00 H ATOM 63327 H2 WAT 3412 21.079 4.508 126.900 1.00 0.00 H TER 63329 WAT 3412 ATOM 63329 O WAT 3413 20.659 48.483 114.571 1.00 0.00 O ATOM 63330 H1 WAT 3413 19.789 48.398 114.182 1.00 0.00 H ATOM 63331 H2 WAT 3413 21.209 47.890 114.059 1.00 0.00 H TER 63333 WAT 3413 ATOM 63333 O WAT 3414 100.267 1.625 80.700 1.00 0.00 O ATOM 63334 H1 WAT 3414 100.382 1.836 81.627 1.00 0.00 H ATOM 63335 H2 WAT 3414 100.687 2.349 80.235 1.00 0.00 H TER 63337 WAT 3414 ATOM 63337 O WAT 3415 8.026 50.884 5.655 1.00 0.00 O ATOM 63338 H1 WAT 3415 8.929 50.588 5.774 1.00 0.00 H ATOM 63339 H2 WAT 3415 7.501 50.256 6.152 1.00 0.00 H TER 63341 WAT 3415 ATOM 63341 O WAT 3416 104.656 63.976 153.093 1.00 0.00 O ATOM 63342 H1 WAT 3416 103.736 63.801 152.895 1.00 0.00 H ATOM 63343 H2 WAT 3416 105.040 64.216 152.250 1.00 0.00 H TER 63345 WAT 3416 ATOM 63345 O WAT 3417 73.601 47.321 88.731 1.00 0.00 O ATOM 63346 H1 WAT 3417 73.032 47.351 87.962 1.00 0.00 H ATOM 63347 H2 WAT 3417 74.329 47.904 88.513 1.00 0.00 H TER 63349 WAT 3417 ATOM 63349 O WAT 3418 126.423 78.337 83.575 1.00 0.00 O ATOM 63350 H1 WAT 3418 126.836 78.714 84.352 1.00 0.00 H ATOM 63351 H2 WAT 3418 127.110 78.348 82.909 1.00 0.00 H TER 63353 WAT 3418 ATOM 63353 O WAT 3419 118.322 19.032 121.357 1.00 0.00 O ATOM 63354 H1 WAT 3419 118.786 18.198 121.425 1.00 0.00 H ATOM 63355 H2 WAT 3419 117.674 18.890 120.668 1.00 0.00 H TER 63357 WAT 3419 ATOM 63357 O WAT 3420 122.046 75.007 98.443 1.00 0.00 O ATOM 63358 H1 WAT 3420 122.279 74.172 98.037 1.00 0.00 H ATOM 63359 H2 WAT 3420 122.744 75.606 98.178 1.00 0.00 H TER 63361 WAT 3420 ATOM 63361 O WAT 3421 74.428 29.817 152.783 1.00 0.00 O ATOM 63362 H1 WAT 3421 74.813 29.870 151.908 1.00 0.00 H ATOM 63363 H2 WAT 3421 74.684 30.636 153.206 1.00 0.00 H TER 63365 WAT 3421 ATOM 63365 O WAT 3422 74.168 126.632 123.757 1.00 0.00 O ATOM 63366 H1 WAT 3422 74.614 127.295 124.285 1.00 0.00 H ATOM 63367 H2 WAT 3422 74.818 126.367 123.107 1.00 0.00 H TER 63369 WAT 3422 ATOM 63369 O WAT 3423 5.493 124.971 1.016 1.00 0.00 O ATOM 63370 H1 WAT 3423 5.397 125.732 1.589 1.00 0.00 H ATOM 63371 H2 WAT 3423 6.186 124.451 1.423 1.00 0.00 H TER 63373 WAT 3423 ATOM 63373 O WAT 3424 68.735 47.100 11.059 1.00 0.00 O ATOM 63374 H1 WAT 3424 68.161 46.345 11.188 1.00 0.00 H ATOM 63375 H2 WAT 3424 68.184 47.857 11.262 1.00 0.00 H TER 63377 WAT 3424 ATOM 63377 O WAT 3425 145.230 129.575 123.547 1.00 0.00 O ATOM 63378 H1 WAT 3425 144.923 129.806 124.424 1.00 0.00 H ATOM 63379 H2 WAT 3425 145.797 128.816 123.684 1.00 0.00 H TER 63381 WAT 3425 ATOM 63381 O WAT 3426 85.413 94.019 136.452 1.00 0.00 O ATOM 63382 H1 WAT 3426 85.084 94.914 136.364 1.00 0.00 H ATOM 63383 H2 WAT 3426 86.144 94.091 137.065 1.00 0.00 H TER 63385 WAT 3426 ATOM 63385 O WAT 3427 136.799 100.379 96.232 1.00 0.00 O ATOM 63386 H1 WAT 3427 137.003 101.250 96.574 1.00 0.00 H ATOM 63387 H2 WAT 3427 137.645 99.933 96.194 1.00 0.00 H TER 63389 WAT 3427 ATOM 63389 O WAT 3428 79.484 100.507 151.040 1.00 0.00 O ATOM 63390 H1 WAT 3428 80.024 100.655 150.263 1.00 0.00 H ATOM 63391 H2 WAT 3428 80.069 100.068 151.657 1.00 0.00 H TER 63393 WAT 3428 ATOM 63393 O WAT 3429 143.128 90.178 25.300 1.00 0.00 O ATOM 63394 H1 WAT 3429 142.990 89.365 25.787 1.00 0.00 H ATOM 63395 H2 WAT 3429 144.022 90.439 25.520 1.00 0.00 H TER 63397 WAT 3429 ATOM 63397 O WAT 3430 17.634 13.914 132.633 1.00 0.00 O ATOM 63398 H1 WAT 3430 18.376 14.480 132.845 1.00 0.00 H ATOM 63399 H2 WAT 3430 17.800 13.627 131.735 1.00 0.00 H TER 63401 WAT 3430 ATOM 63401 O WAT 3431 96.259 114.477 102.757 1.00 0.00 O ATOM 63402 H1 WAT 3431 97.028 114.508 102.188 1.00 0.00 H ATOM 63403 H2 WAT 3431 96.587 114.741 103.617 1.00 0.00 H TER 63405 WAT 3431 ATOM 63405 O WAT 3432 39.972 13.885 79.355 1.00 0.00 O ATOM 63406 H1 WAT 3432 39.131 14.307 79.179 1.00 0.00 H ATOM 63407 H2 WAT 3432 40.172 14.119 80.261 1.00 0.00 H TER 63409 WAT 3432 ATOM 63409 O WAT 3433 40.942 105.244 10.053 1.00 0.00 O ATOM 63410 H1 WAT 3433 41.773 105.408 9.607 1.00 0.00 H ATOM 63411 H2 WAT 3433 40.902 105.912 10.737 1.00 0.00 H TER 63413 WAT 3433 ATOM 63413 O WAT 3434 24.542 136.983 63.607 1.00 0.00 O ATOM 63414 H1 WAT 3434 24.833 137.759 63.128 1.00 0.00 H ATOM 63415 H2 WAT 3434 25.342 136.625 63.993 1.00 0.00 H TER 63417 WAT 3434 ATOM 63417 O WAT 3435 121.229 60.815 19.210 1.00 0.00 O ATOM 63418 H1 WAT 3435 121.800 61.187 19.882 1.00 0.00 H ATOM 63419 H2 WAT 3435 120.896 60.006 19.600 1.00 0.00 H TER 63421 WAT 3435 ATOM 63421 O WAT 3436 48.829 97.234 110.907 1.00 0.00 O ATOM 63422 H1 WAT 3436 49.703 97.447 110.580 1.00 0.00 H ATOM 63423 H2 WAT 3436 48.495 98.060 111.254 1.00 0.00 H TER 63425 WAT 3436 ATOM 63425 O WAT 3437 108.565 142.387 127.681 1.00 0.00 O ATOM 63426 H1 WAT 3437 109.373 142.439 127.170 1.00 0.00 H ATOM 63427 H2 WAT 3437 108.723 142.953 128.437 1.00 0.00 H TER 63429 WAT 3437 ATOM 63429 O WAT 3438 118.624 113.662 10.512 1.00 0.00 O ATOM 63430 H1 WAT 3438 119.305 113.074 10.185 1.00 0.00 H ATOM 63431 H2 WAT 3438 118.952 113.961 11.360 1.00 0.00 H TER 63433 WAT 3438 ATOM 63433 O WAT 3439 65.087 21.509 78.340 1.00 0.00 O ATOM 63434 H1 WAT 3439 64.302 21.004 78.551 1.00 0.00 H ATOM 63435 H2 WAT 3439 65.806 21.009 78.727 1.00 0.00 H TER 63437 WAT 3439 ATOM 63437 O WAT 3440 115.993 19.331 123.087 1.00 0.00 O ATOM 63438 H1 WAT 3440 116.035 20.186 123.515 1.00 0.00 H ATOM 63439 H2 WAT 3440 116.843 19.236 122.657 1.00 0.00 H TER 63441 WAT 3440 ATOM 63441 O WAT 3441 8.232 27.106 148.555 1.00 0.00 O ATOM 63442 H1 WAT 3441 8.415 26.198 148.314 1.00 0.00 H ATOM 63443 H2 WAT 3441 8.271 27.586 147.728 1.00 0.00 H TER 63445 WAT 3441 ATOM 63445 O WAT 3442 102.159 9.834 66.391 1.00 0.00 O ATOM 63446 H1 WAT 3442 102.063 9.456 67.265 1.00 0.00 H ATOM 63447 H2 WAT 3442 102.189 9.078 65.805 1.00 0.00 H TER 63449 WAT 3442 ATOM 63449 O WAT 3443 102.567 61.549 147.723 1.00 0.00 O ATOM 63450 H1 WAT 3443 102.669 62.178 147.009 1.00 0.00 H ATOM 63451 H2 WAT 3443 101.620 61.433 147.806 1.00 0.00 H TER 63453 WAT 3443 ATOM 63453 O WAT 3444 116.632 66.573 79.764 1.00 0.00 O ATOM 63454 H1 WAT 3444 116.995 65.990 79.098 1.00 0.00 H ATOM 63455 H2 WAT 3444 116.462 66.002 80.514 1.00 0.00 H TER 63457 WAT 3444 ATOM 63457 O WAT 3445 101.626 8.157 101.183 1.00 0.00 O ATOM 63458 H1 WAT 3445 102.172 8.606 101.829 1.00 0.00 H ATOM 63459 H2 WAT 3445 101.064 7.582 101.701 1.00 0.00 H TER 63461 WAT 3445 ATOM 63461 O WAT 3446 9.704 94.365 155.246 1.00 0.00 O ATOM 63462 H1 WAT 3446 10.004 94.195 154.353 1.00 0.00 H ATOM 63463 H2 WAT 3446 9.868 95.298 155.380 1.00 0.00 H TER 63465 WAT 3446 ATOM 63465 O WAT 3447 54.995 82.525 148.872 1.00 0.00 O ATOM 63466 H1 WAT 3447 55.782 82.488 149.416 1.00 0.00 H ATOM 63467 H2 WAT 3447 55.292 82.910 148.048 1.00 0.00 H TER 63469 WAT 3447 ATOM 63469 O WAT 3448 0.940 78.654 98.058 1.00 0.00 O ATOM 63470 H1 WAT 3448 1.552 78.643 98.795 1.00 0.00 H ATOM 63471 H2 WAT 3448 0.806 79.583 97.872 1.00 0.00 H TER 63473 WAT 3448 ATOM 63473 O WAT 3449 82.365 84.238 85.640 1.00 0.00 O ATOM 63474 H1 WAT 3449 81.526 83.777 85.669 1.00 0.00 H ATOM 63475 H2 WAT 3449 82.982 83.591 85.297 1.00 0.00 H TER 63477 WAT 3449 ATOM 63477 O WAT 3450 13.360 69.413 19.245 1.00 0.00 O ATOM 63478 H1 WAT 3450 13.872 68.841 19.818 1.00 0.00 H ATOM 63479 H2 WAT 3450 12.551 69.575 19.729 1.00 0.00 H TER 63481 WAT 3450 ATOM 63481 O WAT 3451 41.324 50.268 64.608 1.00 0.00 O ATOM 63482 H1 WAT 3451 41.247 49.316 64.659 1.00 0.00 H ATOM 63483 H2 WAT 3451 40.888 50.500 63.788 1.00 0.00 H TER 63485 WAT 3451 ATOM 63485 O WAT 3452 30.327 128.052 4.809 1.00 0.00 O ATOM 63486 H1 WAT 3452 29.658 128.138 4.130 1.00 0.00 H ATOM 63487 H2 WAT 3452 30.758 128.906 4.831 1.00 0.00 H TER 63489 WAT 3452 ATOM 63489 O WAT 3453 118.172 29.996 127.255 1.00 0.00 O ATOM 63490 H1 WAT 3453 118.166 30.924 127.487 1.00 0.00 H ATOM 63491 H2 WAT 3453 117.419 29.628 127.717 1.00 0.00 H TER 63493 WAT 3453 ATOM 63493 O WAT 3454 1.482 44.438 96.190 1.00 0.00 O ATOM 63494 H1 WAT 3454 1.810 43.964 95.425 1.00 0.00 H ATOM 63495 H2 WAT 3454 1.188 45.279 95.841 1.00 0.00 H TER 63497 WAT 3454 ATOM 63497 O WAT 3455 109.684 111.550 152.919 1.00 0.00 O ATOM 63498 H1 WAT 3455 109.699 111.498 151.963 1.00 0.00 H ATOM 63499 H2 WAT 3455 110.492 111.119 153.196 1.00 0.00 H TER 63501 WAT 3455 ATOM 63501 O WAT 3456 128.050 78.827 146.719 1.00 0.00 O ATOM 63502 H1 WAT 3456 128.381 78.557 145.862 1.00 0.00 H ATOM 63503 H2 WAT 3456 127.627 78.043 147.070 1.00 0.00 H TER 63505 WAT 3456 ATOM 63505 O WAT 3457 32.450 7.298 7.019 1.00 0.00 O ATOM 63506 H1 WAT 3457 32.269 7.979 6.371 1.00 0.00 H ATOM 63507 H2 WAT 3457 31.631 7.210 7.507 1.00 0.00 H TER 63509 WAT 3457 ATOM 63509 O WAT 3458 4.141 1.574 133.631 1.00 0.00 O ATOM 63510 H1 WAT 3458 3.294 1.259 133.946 1.00 0.00 H ATOM 63511 H2 WAT 3458 3.933 2.066 132.836 1.00 0.00 H TER 63513 WAT 3458 ATOM 63513 O WAT 3459 102.469 118.254 80.706 1.00 0.00 O ATOM 63514 H1 WAT 3459 101.884 117.846 80.068 1.00 0.00 H ATOM 63515 H2 WAT 3459 101.921 118.897 81.157 1.00 0.00 H TER 63517 WAT 3459 ATOM 63517 O WAT 3460 73.101 119.708 142.221 1.00 0.00 O ATOM 63518 H1 WAT 3460 72.982 118.963 142.811 1.00 0.00 H ATOM 63519 H2 WAT 3460 72.295 120.216 142.311 1.00 0.00 H TER 63521 WAT 3460 ATOM 63521 O WAT 3461 87.744 73.445 72.649 1.00 0.00 O ATOM 63522 H1 WAT 3461 87.100 73.829 72.053 1.00 0.00 H ATOM 63523 H2 WAT 3461 87.752 74.032 73.404 1.00 0.00 H TER 63525 WAT 3461 ATOM 63525 O WAT 3462 104.622 67.638 135.147 1.00 0.00 O ATOM 63526 H1 WAT 3462 103.679 67.804 135.128 1.00 0.00 H ATOM 63527 H2 WAT 3462 104.964 68.112 134.389 1.00 0.00 H TER 63529 WAT 3462 ATOM 63529 O WAT 3463 93.421 39.054 127.923 1.00 0.00 O ATOM 63530 H1 WAT 3463 94.166 39.387 127.422 1.00 0.00 H ATOM 63531 H2 WAT 3463 93.600 39.320 128.825 1.00 0.00 H TER 63533 WAT 3463 ATOM 63533 O WAT 3464 65.234 33.287 18.552 1.00 0.00 O ATOM 63534 H1 WAT 3464 64.476 33.545 19.078 1.00 0.00 H ATOM 63535 H2 WAT 3464 65.047 32.386 18.289 1.00 0.00 H TER 63537 WAT 3464 ATOM 63537 O WAT 3465 145.199 109.987 121.977 1.00 0.00 O ATOM 63538 H1 WAT 3465 144.373 110.317 121.623 1.00 0.00 H ATOM 63539 H2 WAT 3465 145.643 110.766 122.313 1.00 0.00 H TER 63541 WAT 3465 ATOM 63541 O WAT 3466 29.621 116.795 3.439 1.00 0.00 O ATOM 63542 H1 WAT 3466 30.274 116.148 3.171 1.00 0.00 H ATOM 63543 H2 WAT 3466 29.918 117.613 3.040 1.00 0.00 H TER 63545 WAT 3466 ATOM 63545 O WAT 3467 47.880 31.552 4.067 1.00 0.00 O ATOM 63546 H1 WAT 3467 48.497 32.121 3.606 1.00 0.00 H ATOM 63547 H2 WAT 3467 47.758 31.970 4.919 1.00 0.00 H TER 63549 WAT 3467 ATOM 63549 O WAT 3468 80.324 127.490 86.893 1.00 0.00 O ATOM 63550 H1 WAT 3468 80.769 127.323 87.725 1.00 0.00 H ATOM 63551 H2 WAT 3468 79.431 127.727 87.142 1.00 0.00 H TER 63553 WAT 3468 ATOM 63553 O WAT 3469 18.714 64.492 58.976 1.00 0.00 O ATOM 63554 H1 WAT 3469 18.604 64.397 59.922 1.00 0.00 H ATOM 63555 H2 WAT 3469 18.198 65.266 58.751 1.00 0.00 H TER 63557 WAT 3469 ATOM 63557 O WAT 3470 17.373 141.289 117.735 1.00 0.00 O ATOM 63558 H1 WAT 3470 17.975 141.949 117.391 1.00 0.00 H ATOM 63559 H2 WAT 3470 17.621 141.197 118.655 1.00 0.00 H TER 63561 WAT 3470 ATOM 63561 O WAT 3471 14.780 141.036 63.798 1.00 0.00 O ATOM 63562 H1 WAT 3471 13.937 140.627 63.995 1.00 0.00 H ATOM 63563 H2 WAT 3471 14.598 141.975 63.804 1.00 0.00 H TER 63565 WAT 3471 ATOM 63565 O WAT 3472 79.800 65.429 151.344 1.00 0.00 O ATOM 63566 H1 WAT 3472 79.538 64.767 150.705 1.00 0.00 H ATOM 63567 H2 WAT 3472 79.151 66.126 151.246 1.00 0.00 H TER 63569 WAT 3472 ATOM 63569 O WAT 3473 48.528 118.272 132.542 1.00 0.00 O ATOM 63570 H1 WAT 3473 48.774 118.599 131.677 1.00 0.00 H ATOM 63571 H2 WAT 3473 47.575 118.192 132.505 1.00 0.00 H TER 63573 WAT 3473 ATOM 63573 O WAT 3474 5.155 102.484 104.398 1.00 0.00 O ATOM 63574 H1 WAT 3474 6.035 102.476 104.775 1.00 0.00 H ATOM 63575 H2 WAT 3474 5.086 103.337 103.968 1.00 0.00 H TER 63577 WAT 3474 ATOM 63577 O WAT 3475 143.945 97.006 124.622 1.00 0.00 O ATOM 63578 H1 WAT 3475 144.010 96.157 124.184 1.00 0.00 H ATOM 63579 H2 WAT 3475 144.072 96.808 125.549 1.00 0.00 H TER 63581 WAT 3475 ATOM 63581 O WAT 3476 115.600 99.105 1.942 1.00 0.00 O ATOM 63582 H1 WAT 3476 116.179 99.729 2.380 1.00 0.00 H ATOM 63583 H2 WAT 3476 115.882 98.249 2.263 1.00 0.00 H TER 63585 WAT 3476 ATOM 63585 O WAT 3477 16.901 6.633 104.296 1.00 0.00 O ATOM 63586 H1 WAT 3477 16.164 7.237 104.206 1.00 0.00 H ATOM 63587 H2 WAT 3477 16.495 5.784 104.474 1.00 0.00 H TER 63589 WAT 3477 ATOM 63589 O WAT 3478 114.204 12.654 107.848 1.00 0.00 O ATOM 63590 H1 WAT 3478 113.339 13.043 107.720 1.00 0.00 H ATOM 63591 H2 WAT 3478 114.167 11.825 107.371 1.00 0.00 H TER 63593 WAT 3478 ATOM 63593 O WAT 3479 78.021 67.213 129.737 1.00 0.00 O ATOM 63594 H1 WAT 3479 77.271 66.625 129.818 1.00 0.00 H ATOM 63595 H2 WAT 3479 77.687 68.067 130.011 1.00 0.00 H TER 63597 WAT 3479 ATOM 63597 O WAT 3480 85.877 101.620 100.194 1.00 0.00 O ATOM 63598 H1 WAT 3480 85.756 102.290 99.522 1.00 0.00 H ATOM 63599 H2 WAT 3480 85.568 100.811 99.785 1.00 0.00 H TER 63601 WAT 3480 ATOM 63601 O WAT 3481 105.749 113.224 143.944 1.00 0.00 O ATOM 63602 H1 WAT 3481 105.702 114.174 143.832 1.00 0.00 H ATOM 63603 H2 WAT 3481 105.351 113.064 144.799 1.00 0.00 H TER 63605 WAT 3481 ATOM 63605 O WAT 3482 112.801 94.205 122.837 1.00 0.00 O ATOM 63606 H1 WAT 3482 113.584 94.394 123.354 1.00 0.00 H ATOM 63607 H2 WAT 3482 112.981 94.591 121.980 1.00 0.00 H TER 63609 WAT 3482 ATOM 63609 O WAT 3483 15.765 2.307 16.231 1.00 0.00 O ATOM 63610 H1 WAT 3483 15.692 2.225 17.182 1.00 0.00 H ATOM 63611 H2 WAT 3483 15.170 1.641 15.887 1.00 0.00 H TER 63613 WAT 3483 ATOM 63613 O WAT 3484 109.724 37.885 106.109 1.00 0.00 O ATOM 63614 H1 WAT 3484 109.572 38.668 105.580 1.00 0.00 H ATOM 63615 H2 WAT 3484 110.442 37.433 105.667 1.00 0.00 H TER 63617 WAT 3484 ATOM 63617 O WAT 3485 132.301 135.273 61.722 1.00 0.00 O ATOM 63618 H1 WAT 3485 132.711 135.551 60.903 1.00 0.00 H ATOM 63619 H2 WAT 3485 132.979 134.766 62.168 1.00 0.00 H TER 63621 WAT 3485 ATOM 63621 O WAT 3486 136.524 136.082 122.787 1.00 0.00 O ATOM 63622 H1 WAT 3486 137.221 136.659 122.474 1.00 0.00 H ATOM 63623 H2 WAT 3486 136.761 135.217 122.451 1.00 0.00 H TER 63625 WAT 3486 ATOM 63625 O WAT 3487 107.599 108.877 92.283 1.00 0.00 O ATOM 63626 H1 WAT 3487 108.342 108.562 91.768 1.00 0.00 H ATOM 63627 H2 WAT 3487 107.649 109.831 92.215 1.00 0.00 H TER 63629 WAT 3487 ATOM 63629 O WAT 3488 62.823 101.531 103.444 1.00 0.00 O ATOM 63630 H1 WAT 3488 62.127 102.187 103.487 1.00 0.00 H ATOM 63631 H2 WAT 3488 63.185 101.508 104.329 1.00 0.00 H TER 63633 WAT 3488 ATOM 63633 O WAT 3489 95.060 65.171 92.564 1.00 0.00 O ATOM 63634 H1 WAT 3489 95.069 66.003 93.038 1.00 0.00 H ATOM 63635 H2 WAT 3489 95.716 65.281 91.876 1.00 0.00 H TER 63637 WAT 3489 ATOM 63637 O WAT 3490 40.671 22.383 75.375 1.00 0.00 O ATOM 63638 H1 WAT 3490 40.390 22.969 76.077 1.00 0.00 H ATOM 63639 H2 WAT 3490 39.867 22.174 74.900 1.00 0.00 H TER 63641 WAT 3490 ATOM 63641 O WAT 3491 91.999 85.249 129.482 1.00 0.00 O ATOM 63642 H1 WAT 3491 92.055 85.400 130.425 1.00 0.00 H ATOM 63643 H2 WAT 3491 91.168 84.789 129.362 1.00 0.00 H TER 63645 WAT 3491 ATOM 63645 O WAT 3492 17.337 36.155 139.682 1.00 0.00 O ATOM 63646 H1 WAT 3492 18.037 36.805 139.636 1.00 0.00 H ATOM 63647 H2 WAT 3492 16.775 36.354 138.933 1.00 0.00 H TER 63649 WAT 3492 ATOM 63649 O WAT 3493 87.249 27.225 54.139 1.00 0.00 O ATOM 63650 H1 WAT 3493 86.468 26.749 53.858 1.00 0.00 H ATOM 63651 H2 WAT 3493 86.917 28.065 54.456 1.00 0.00 H TER 63653 WAT 3493 ATOM 63653 O WAT 3494 68.676 133.328 112.216 1.00 0.00 O ATOM 63654 H1 WAT 3494 68.098 132.569 112.133 1.00 0.00 H ATOM 63655 H2 WAT 3494 68.760 133.463 113.160 1.00 0.00 H TER 63657 WAT 3494 ATOM 63657 O WAT 3495 97.871 118.259 125.201 1.00 0.00 O ATOM 63658 H1 WAT 3495 97.590 117.924 126.053 1.00 0.00 H ATOM 63659 H2 WAT 3495 97.749 117.522 124.602 1.00 0.00 H TER 63661 WAT 3495 ATOM 63661 O WAT 3496 105.480 125.737 150.276 1.00 0.00 O ATOM 63662 H1 WAT 3496 105.412 124.966 149.713 1.00 0.00 H ATOM 63663 H2 WAT 3496 106.248 125.567 150.822 1.00 0.00 H TER 63665 WAT 3496 ATOM 63665 O WAT 3497 39.049 35.715 126.492 1.00 0.00 O ATOM 63666 H1 WAT 3497 38.240 36.018 126.904 1.00 0.00 H ATOM 63667 H2 WAT 3497 38.781 35.430 125.618 1.00 0.00 H TER 63669 WAT 3497 ATOM 63669 O WAT 3498 60.609 36.989 113.351 1.00 0.00 O ATOM 63670 H1 WAT 3498 60.132 36.361 112.810 1.00 0.00 H ATOM 63671 H2 WAT 3498 61.253 36.460 113.823 1.00 0.00 H TER 63673 WAT 3498 ATOM 63673 O WAT 3499 34.433 2.440 85.471 1.00 0.00 O ATOM 63674 H1 WAT 3499 33.922 1.637 85.574 1.00 0.00 H ATOM 63675 H2 WAT 3499 35.252 2.263 85.933 1.00 0.00 H TER 63677 WAT 3499 ATOM 63677 O WAT 3500 50.017 82.083 74.329 1.00 0.00 O ATOM 63678 H1 WAT 3500 50.612 82.078 73.580 1.00 0.00 H ATOM 63679 H2 WAT 3500 49.513 81.274 74.241 1.00 0.00 H TER 63681 WAT 3500 ATOM 63681 O WAT 3501 29.796 3.039 83.728 1.00 0.00 O ATOM 63682 H1 WAT 3501 29.840 2.928 84.678 1.00 0.00 H ATOM 63683 H2 WAT 3501 28.908 2.764 83.497 1.00 0.00 H TER 63685 WAT 3501 ATOM 63685 O WAT 3502 106.892 83.948 6.778 1.00 0.00 O ATOM 63686 H1 WAT 3502 107.309 84.802 6.894 1.00 0.00 H ATOM 63687 H2 WAT 3502 106.449 84.011 5.932 1.00 0.00 H TER 63689 WAT 3502 ATOM 63689 O WAT 3503 41.102 68.273 3.407 1.00 0.00 O ATOM 63690 H1 WAT 3503 40.582 68.400 2.614 1.00 0.00 H ATOM 63691 H2 WAT 3503 41.845 67.741 3.123 1.00 0.00 H TER 63693 WAT 3503 ATOM 63693 O WAT 3504 117.317 29.327 90.985 1.00 0.00 O ATOM 63694 H1 WAT 3504 116.381 29.148 90.894 1.00 0.00 H ATOM 63695 H2 WAT 3504 117.729 28.803 90.297 1.00 0.00 H TER 63697 WAT 3504 ATOM 63697 O WAT 3505 71.791 106.565 65.407 1.00 0.00 O ATOM 63698 H1 WAT 3505 71.785 106.705 66.354 1.00 0.00 H ATOM 63699 H2 WAT 3505 71.581 105.637 65.302 1.00 0.00 H TER 63701 WAT 3505 ATOM 63701 O WAT 3506 42.045 136.768 9.894 1.00 0.00 O ATOM 63702 H1 WAT 3506 42.792 137.250 9.539 1.00 0.00 H ATOM 63703 H2 WAT 3506 41.464 137.446 10.239 1.00 0.00 H TER 63705 WAT 3506 ATOM 63705 O WAT 3507 130.752 103.529 103.355 1.00 0.00 O ATOM 63706 H1 WAT 3507 130.417 103.186 102.527 1.00 0.00 H ATOM 63707 H2 WAT 3507 131.541 104.013 103.112 1.00 0.00 H TER 63709 WAT 3507 ATOM 63709 O WAT 3508 116.384 120.578 157.053 1.00 0.00 O ATOM 63710 H1 WAT 3508 115.548 120.457 156.602 1.00 0.00 H ATOM 63711 H2 WAT 3508 116.522 119.757 157.525 1.00 0.00 H TER 63713 WAT 3508 ATOM 63713 O WAT 3509 39.707 143.027 153.850 1.00 0.00 O ATOM 63714 H1 WAT 3509 40.578 142.632 153.879 1.00 0.00 H ATOM 63715 H2 WAT 3509 39.202 142.543 154.503 1.00 0.00 H TER 63717 WAT 3509 ATOM 63717 O WAT 3510 26.849 84.230 99.923 1.00 0.00 O ATOM 63718 H1 WAT 3510 26.681 83.364 100.295 1.00 0.00 H ATOM 63719 H2 WAT 3510 26.482 84.187 99.040 1.00 0.00 H TER 63721 WAT 3510 ATOM 63721 O WAT 3511 133.385 51.275 65.938 1.00 0.00 O ATOM 63722 H1 WAT 3511 133.839 51.533 65.136 1.00 0.00 H ATOM 63723 H2 WAT 3511 134.082 50.972 66.520 1.00 0.00 H TER 63725 WAT 3511 ATOM 63725 O WAT 3512 142.795 125.153 112.446 1.00 0.00 O ATOM 63726 H1 WAT 3512 142.459 124.287 112.676 1.00 0.00 H ATOM 63727 H2 WAT 3512 143.440 125.348 113.126 1.00 0.00 H TER 63729 WAT 3512 ATOM 63729 O WAT 3513 86.235 96.598 102.944 1.00 0.00 O ATOM 63730 H1 WAT 3513 87.080 96.754 103.365 1.00 0.00 H ATOM 63731 H2 WAT 3513 86.456 96.221 102.093 1.00 0.00 H TER 63733 WAT 3513 ATOM 63733 O WAT 3514 130.700 18.698 140.358 1.00 0.00 O ATOM 63734 H1 WAT 3514 130.303 19.245 141.036 1.00 0.00 H ATOM 63735 H2 WAT 3514 130.562 19.185 139.546 1.00 0.00 H TER 63737 WAT 3514 ATOM 63737 O WAT 3515 26.642 142.175 57.153 1.00 0.00 O ATOM 63738 H1 WAT 3515 27.157 142.551 56.440 1.00 0.00 H ATOM 63739 H2 WAT 3515 25.907 141.743 56.717 1.00 0.00 H TER 63741 WAT 3515 ATOM 63741 O WAT 3516 123.883 110.383 16.743 1.00 0.00 O ATOM 63742 H1 WAT 3516 124.557 111.063 16.744 1.00 0.00 H ATOM 63743 H2 WAT 3516 124.258 109.673 17.264 1.00 0.00 H TER 63745 WAT 3516 ATOM 63745 O WAT 3517 124.542 13.813 121.753 1.00 0.00 O ATOM 63746 H1 WAT 3517 124.607 12.858 121.772 1.00 0.00 H ATOM 63747 H2 WAT 3517 123.998 14.031 122.510 1.00 0.00 H TER 63749 WAT 3517 ATOM 63749 O WAT 3518 129.145 76.347 64.327 1.00 0.00 O ATOM 63750 H1 WAT 3518 129.741 77.095 64.344 1.00 0.00 H ATOM 63751 H2 WAT 3518 128.521 76.553 63.631 1.00 0.00 H TER 63753 WAT 3518 ATOM 63753 O WAT 3519 39.195 59.827 70.929 1.00 0.00 O ATOM 63754 H1 WAT 3519 40.121 59.688 70.732 1.00 0.00 H ATOM 63755 H2 WAT 3519 39.121 60.770 71.078 1.00 0.00 H TER 63757 WAT 3519 ATOM 63757 O WAT 3520 114.687 99.770 24.477 1.00 0.00 O ATOM 63758 H1 WAT 3520 114.734 98.923 24.920 1.00 0.00 H ATOM 63759 H2 WAT 3520 115.117 100.379 25.078 1.00 0.00 H TER 63761 WAT 3520 ATOM 63761 O WAT 3521 5.872 138.545 128.606 1.00 0.00 O ATOM 63762 H1 WAT 3521 5.093 138.768 128.097 1.00 0.00 H ATOM 63763 H2 WAT 3521 6.458 139.293 128.487 1.00 0.00 H TER 63765 WAT 3521 ATOM 63765 O WAT 3522 103.465 71.472 131.314 1.00 0.00 O ATOM 63766 H1 WAT 3522 102.777 70.989 130.857 1.00 0.00 H ATOM 63767 H2 WAT 3522 104.011 70.793 131.711 1.00 0.00 H TER 63769 WAT 3522 ATOM 63769 O WAT 3523 21.000 34.393 135.207 1.00 0.00 O ATOM 63770 H1 WAT 3523 20.589 35.257 135.189 1.00 0.00 H ATOM 63771 H2 WAT 3523 20.807 34.017 134.349 1.00 0.00 H TER 63773 WAT 3523 ATOM 63773 O WAT 3524 120.988 62.772 77.058 1.00 0.00 O ATOM 63774 H1 WAT 3524 121.250 63.311 77.804 1.00 0.00 H ATOM 63775 H2 WAT 3524 121.410 63.184 76.305 1.00 0.00 H TER 63777 WAT 3524 ATOM 63777 O WAT 3525 47.015 48.635 94.598 1.00 0.00 O ATOM 63778 H1 WAT 3525 47.303 47.725 94.671 1.00 0.00 H ATOM 63779 H2 WAT 3525 46.967 48.796 93.656 1.00 0.00 H TER 63781 WAT 3525 ATOM 63781 O WAT 3526 123.713 76.308 18.269 1.00 0.00 O ATOM 63782 H1 WAT 3526 123.258 75.478 18.408 1.00 0.00 H ATOM 63783 H2 WAT 3526 124.491 76.074 17.764 1.00 0.00 H TER 63785 WAT 3526 ATOM 63785 O WAT 3527 14.892 128.552 130.132 1.00 0.00 O ATOM 63786 H1 WAT 3527 14.223 128.333 130.782 1.00 0.00 H ATOM 63787 H2 WAT 3527 15.677 128.735 130.648 1.00 0.00 H TER 63789 WAT 3527 ATOM 63789 O WAT 3528 133.686 133.936 0.187 1.00 0.00 O ATOM 63790 H1 WAT 3528 133.940 134.721 0.671 1.00 0.00 H ATOM 63791 H2 WAT 3528 133.971 134.105 -0.711 1.00 0.00 H TER 63793 WAT 3528 ATOM 63793 O WAT 3529 54.084 112.134 67.316 1.00 0.00 O ATOM 63794 H1 WAT 3529 53.871 111.232 67.079 1.00 0.00 H ATOM 63795 H2 WAT 3529 54.908 112.067 67.798 1.00 0.00 H TER 63797 WAT 3529 ATOM 63797 O WAT 3530 14.346 93.081 22.369 1.00 0.00 O ATOM 63798 H1 WAT 3530 14.080 93.912 21.976 1.00 0.00 H ATOM 63799 H2 WAT 3530 13.663 92.891 23.013 1.00 0.00 H TER 63801 WAT 3530 ATOM 63801 O WAT 3531 130.667 128.290 154.060 1.00 0.00 O ATOM 63802 H1 WAT 3531 130.692 127.334 154.057 1.00 0.00 H ATOM 63803 H2 WAT 3531 131.586 128.555 154.088 1.00 0.00 H TER 63805 WAT 3531 ATOM 63805 O WAT 3532 95.284 66.682 61.493 1.00 0.00 O ATOM 63806 H1 WAT 3532 96.144 66.262 61.521 1.00 0.00 H ATOM 63807 H2 WAT 3532 94.696 66.050 61.908 1.00 0.00 H TER 63809 WAT 3532 ATOM 63809 O WAT 3533 46.378 144.893 132.488 1.00 0.00 O ATOM 63810 H1 WAT 3533 46.754 145.518 133.108 1.00 0.00 H ATOM 63811 H2 WAT 3533 46.033 144.189 133.038 1.00 0.00 H TER 63813 WAT 3533 ATOM 63813 O WAT 3534 52.420 134.808 62.548 1.00 0.00 O ATOM 63814 H1 WAT 3534 52.250 134.808 63.490 1.00 0.00 H ATOM 63815 H2 WAT 3534 52.244 133.909 62.273 1.00 0.00 H TER 63817 WAT 3534 ATOM 63817 O WAT 3535 79.030 124.022 17.659 1.00 0.00 O ATOM 63818 H1 WAT 3535 79.858 123.697 18.013 1.00 0.00 H ATOM 63819 H2 WAT 3535 78.391 123.856 18.352 1.00 0.00 H TER 63821 WAT 3535 ATOM 63821 O WAT 3536 132.756 79.669 100.811 1.00 0.00 O ATOM 63822 H1 WAT 3536 133.181 79.867 101.645 1.00 0.00 H ATOM 63823 H2 WAT 3536 132.681 80.517 100.373 1.00 0.00 H TER 63825 WAT 3536 ATOM 63825 O WAT 3537 30.554 63.959 78.925 1.00 0.00 O ATOM 63826 H1 WAT 3537 30.296 64.787 78.520 1.00 0.00 H ATOM 63827 H2 WAT 3537 30.109 63.958 79.772 1.00 0.00 H TER 63829 WAT 3537 ATOM 63829 O WAT 3538 63.376 4.873 136.449 1.00 0.00 O ATOM 63830 H1 WAT 3538 63.856 4.055 136.317 1.00 0.00 H ATOM 63831 H2 WAT 3538 62.592 4.781 135.908 1.00 0.00 H TER 63833 WAT 3538 ATOM 63833 O WAT 3539 138.280 133.269 80.231 1.00 0.00 O ATOM 63834 H1 WAT 3539 137.471 133.152 79.733 1.00 0.00 H ATOM 63835 H2 WAT 3539 138.224 134.160 80.575 1.00 0.00 H TER 63837 WAT 3539 ATOM 63837 O WAT 3540 86.017 92.261 114.202 1.00 0.00 O ATOM 63838 H1 WAT 3540 85.529 92.795 113.576 1.00 0.00 H ATOM 63839 H2 WAT 3540 85.500 91.460 114.289 1.00 0.00 H TER 63841 WAT 3540 ATOM 63841 O WAT 3541 143.516 25.829 141.043 1.00 0.00 O ATOM 63842 H1 WAT 3541 143.403 26.048 141.968 1.00 0.00 H ATOM 63843 H2 WAT 3541 143.038 25.007 140.932 1.00 0.00 H TER 63845 WAT 3541 ATOM 63845 O WAT 3542 136.551 18.557 19.200 1.00 0.00 O ATOM 63846 H1 WAT 3542 136.381 19.458 19.475 1.00 0.00 H ATOM 63847 H2 WAT 3542 137.450 18.572 18.872 1.00 0.00 H TER 63849 WAT 3542 ATOM 63849 O WAT 3543 104.087 107.393 67.083 1.00 0.00 O ATOM 63850 H1 WAT 3543 104.029 106.650 67.683 1.00 0.00 H ATOM 63851 H2 WAT 3543 105.027 107.529 66.960 1.00 0.00 H TER 63853 WAT 3543 ATOM 63853 O WAT 3544 135.753 123.956 153.321 1.00 0.00 O ATOM 63854 H1 WAT 3544 134.955 123.454 153.160 1.00 0.00 H ATOM 63855 H2 WAT 3544 135.641 124.755 152.806 1.00 0.00 H TER 63857 WAT 3544 ATOM 63857 O WAT 3545 96.229 24.706 64.730 1.00 0.00 O ATOM 63858 H1 WAT 3545 95.511 24.969 64.154 1.00 0.00 H ATOM 63859 H2 WAT 3545 96.096 25.218 65.527 1.00 0.00 H TER 63861 WAT 3545 ATOM 63861 O WAT 3546 139.832 67.562 131.152 1.00 0.00 O ATOM 63862 H1 WAT 3546 139.980 68.213 131.838 1.00 0.00 H ATOM 63863 H2 WAT 3546 140.263 67.925 130.379 1.00 0.00 H TER 63865 WAT 3546 ATOM 63865 O WAT 3547 39.268 96.431 71.919 1.00 0.00 O ATOM 63866 H1 WAT 3547 39.535 96.512 72.834 1.00 0.00 H ATOM 63867 H2 WAT 3547 40.019 96.026 71.485 1.00 0.00 H TER 63869 WAT 3547 ATOM 63869 O WAT 3548 117.389 142.969 6.781 1.00 0.00 O ATOM 63870 H1 WAT 3548 118.086 142.755 7.400 1.00 0.00 H ATOM 63871 H2 WAT 3548 116.630 142.478 7.094 1.00 0.00 H TER 63873 WAT 3548 ATOM 63873 O WAT 3549 47.625 78.540 114.853 1.00 0.00 O ATOM 63874 H1 WAT 3549 46.803 78.464 114.370 1.00 0.00 H ATOM 63875 H2 WAT 3549 47.483 78.029 115.650 1.00 0.00 H TER 63877 WAT 3549 ATOM 63877 O WAT 3550 40.026 46.575 67.408 1.00 0.00 O ATOM 63878 H1 WAT 3550 40.120 47.173 68.148 1.00 0.00 H ATOM 63879 H2 WAT 3550 40.923 46.404 67.122 1.00 0.00 H TER 63881 WAT 3550 ATOM 63881 O WAT 3551 72.617 123.098 121.372 1.00 0.00 O ATOM 63882 H1 WAT 3551 71.680 123.172 121.194 1.00 0.00 H ATOM 63883 H2 WAT 3551 72.880 122.286 120.938 1.00 0.00 H TER 63885 WAT 3551 ATOM 63885 O WAT 3552 41.599 39.765 79.118 1.00 0.00 O ATOM 63886 H1 WAT 3552 42.026 40.607 78.963 1.00 0.00 H ATOM 63887 H2 WAT 3552 42.322 39.145 79.220 1.00 0.00 H TER 63889 WAT 3552 ATOM 63889 O WAT 3553 25.181 136.079 84.527 1.00 0.00 O ATOM 63890 H1 WAT 3553 24.944 135.152 84.555 1.00 0.00 H ATOM 63891 H2 WAT 3553 24.740 136.462 85.285 1.00 0.00 H TER 63893 WAT 3553 ATOM 63893 O WAT 3554 7.432 5.775 117.445 1.00 0.00 O ATOM 63894 H1 WAT 3554 6.835 6.435 117.800 1.00 0.00 H ATOM 63895 H2 WAT 3554 8.297 6.046 117.750 1.00 0.00 H TER 63897 WAT 3554 ATOM 63897 O WAT 3555 135.565 115.286 59.462 1.00 0.00 O ATOM 63898 H1 WAT 3555 135.337 114.744 60.217 1.00 0.00 H ATOM 63899 H2 WAT 3555 136.500 115.463 59.567 1.00 0.00 H TER 63901 WAT 3555 ATOM 63901 O WAT 3556 96.735 89.903 148.906 1.00 0.00 O ATOM 63902 H1 WAT 3556 96.688 89.060 149.356 1.00 0.00 H ATOM 63903 H2 WAT 3556 96.313 90.519 149.505 1.00 0.00 H TER 63905 WAT 3556 ATOM 63905 O WAT 3557 57.246 128.598 55.030 1.00 0.00 O ATOM 63906 H1 WAT 3557 57.956 128.112 54.611 1.00 0.00 H ATOM 63907 H2 WAT 3557 56.595 128.714 54.338 1.00 0.00 H TER 63909 WAT 3557 ATOM 63909 O WAT 3558 93.027 55.424 61.085 1.00 0.00 O ATOM 63910 H1 WAT 3558 92.311 55.911 61.492 1.00 0.00 H ATOM 63911 H2 WAT 3558 92.818 55.428 60.151 1.00 0.00 H TER 63913 WAT 3558 ATOM 63913 O WAT 3559 116.111 104.693 12.011 1.00 0.00 O ATOM 63914 H1 WAT 3559 115.383 104.231 11.595 1.00 0.00 H ATOM 63915 H2 WAT 3559 115.730 105.081 12.799 1.00 0.00 H TER 63917 WAT 3559 ATOM 63917 O WAT 3560 90.785 14.178 132.592 1.00 0.00 O ATOM 63918 H1 WAT 3560 90.213 14.656 133.193 1.00 0.00 H ATOM 63919 H2 WAT 3560 91.657 14.257 132.979 1.00 0.00 H TER 63921 WAT 3560 ATOM 63921 O WAT 3561 75.309 81.214 75.351 1.00 0.00 O ATOM 63922 H1 WAT 3561 75.957 81.145 74.649 1.00 0.00 H ATOM 63923 H2 WAT 3561 75.516 82.041 75.787 1.00 0.00 H TER 63925 WAT 3561 ATOM 63925 O WAT 3562 69.300 25.470 62.857 1.00 0.00 O ATOM 63926 H1 WAT 3562 70.158 25.384 63.273 1.00 0.00 H ATOM 63927 H2 WAT 3562 69.164 24.633 62.412 1.00 0.00 H TER 63929 WAT 3562 ATOM 63929 O WAT 3563 103.341 3.938 137.780 1.00 0.00 O ATOM 63930 H1 WAT 3563 102.796 3.168 137.618 1.00 0.00 H ATOM 63931 H2 WAT 3563 102.869 4.428 138.454 1.00 0.00 H TER 63933 WAT 3563 ATOM 63933 O WAT 3564 94.298 74.312 13.123 1.00 0.00 O ATOM 63934 H1 WAT 3564 93.507 73.867 13.428 1.00 0.00 H ATOM 63935 H2 WAT 3564 94.284 75.158 13.571 1.00 0.00 H TER 63937 WAT 3564 ATOM 63937 O WAT 3565 27.879 68.828 150.226 1.00 0.00 O ATOM 63938 H1 WAT 3565 27.380 68.035 150.422 1.00 0.00 H ATOM 63939 H2 WAT 3565 27.317 69.323 149.631 1.00 0.00 H TER 63941 WAT 3565 ATOM 63941 O WAT 3566 54.582 18.473 7.552 1.00 0.00 O ATOM 63942 H1 WAT 3566 54.676 17.650 7.073 1.00 0.00 H ATOM 63943 H2 WAT 3566 53.927 18.966 7.058 1.00 0.00 H TER 63945 WAT 3566 ATOM 63945 O WAT 3567 93.225 99.869 111.396 1.00 0.00 O ATOM 63946 H1 WAT 3567 93.745 99.151 111.034 1.00 0.00 H ATOM 63947 H2 WAT 3567 93.047 99.604 112.299 1.00 0.00 H TER 63949 WAT 3567 ATOM 63949 O WAT 3568 81.094 140.271 150.849 1.00 0.00 O ATOM 63950 H1 WAT 3568 80.931 140.175 151.787 1.00 0.00 H ATOM 63951 H2 WAT 3568 81.411 141.168 150.751 1.00 0.00 H TER 63953 WAT 3568 ATOM 63953 O WAT 3569 77.885 45.581 116.793 1.00 0.00 O ATOM 63954 H1 WAT 3569 78.272 46.411 116.516 1.00 0.00 H ATOM 63955 H2 WAT 3569 77.135 45.460 116.210 1.00 0.00 H TER 63957 WAT 3569 ATOM 63957 O WAT 3570 52.551 132.993 72.119 1.00 0.00 O ATOM 63958 H1 WAT 3570 52.588 133.120 73.067 1.00 0.00 H ATOM 63959 H2 WAT 3570 51.726 132.531 71.971 1.00 0.00 H TER 63961 WAT 3570 ATOM 63961 O WAT 3571 102.005 84.308 127.484 1.00 0.00 O ATOM 63962 H1 WAT 3571 102.083 84.864 126.708 1.00 0.00 H ATOM 63963 H2 WAT 3571 101.355 84.750 128.030 1.00 0.00 H TER 63965 WAT 3571 ATOM 63965 O WAT 3572 81.839 141.171 57.450 1.00 0.00 O ATOM 63966 H1 WAT 3572 82.739 141.337 57.728 1.00 0.00 H ATOM 63967 H2 WAT 3572 81.927 140.650 56.652 1.00 0.00 H TER 63969 WAT 3572 ATOM 63969 O WAT 3573 139.112 23.915 81.485 1.00 0.00 O ATOM 63970 H1 WAT 3573 139.589 24.677 81.813 1.00 0.00 H ATOM 63971 H2 WAT 3573 139.141 24.006 80.532 1.00 0.00 H TER 63973 WAT 3573 ATOM 63973 O WAT 3574 142.494 76.882 5.457 1.00 0.00 O ATOM 63974 H1 WAT 3574 142.409 77.388 4.648 1.00 0.00 H ATOM 63975 H2 WAT 3574 141.595 76.643 5.684 1.00 0.00 H TER 63977 WAT 3574 ATOM 63977 O WAT 3575 14.930 119.716 22.266 1.00 0.00 O ATOM 63978 H1 WAT 3575 15.799 119.323 22.345 1.00 0.00 H ATOM 63979 H2 WAT 3575 14.447 119.384 23.022 1.00 0.00 H TER 63981 WAT 3575 ATOM 63981 O WAT 3576 20.457 17.907 93.582 1.00 0.00 O ATOM 63982 H1 WAT 3576 20.313 18.493 92.838 1.00 0.00 H ATOM 63983 H2 WAT 3576 20.855 17.126 93.198 1.00 0.00 H TER 63985 WAT 3576 ATOM 63985 O WAT 3577 18.247 15.733 78.800 1.00 0.00 O ATOM 63986 H1 WAT 3577 18.025 16.600 78.459 1.00 0.00 H ATOM 63987 H2 WAT 3577 17.562 15.159 78.458 1.00 0.00 H TER 63989 WAT 3577 ATOM 63989 O WAT 3578 7.162 135.690 6.166 1.00 0.00 O ATOM 63990 H1 WAT 3578 6.262 135.789 6.477 1.00 0.00 H ATOM 63991 H2 WAT 3578 7.453 136.584 5.987 1.00 0.00 H TER 63993 WAT 3578 ATOM 63993 O WAT 3579 4.274 122.463 92.721 1.00 0.00 O ATOM 63994 H1 WAT 3579 3.779 121.652 92.604 1.00 0.00 H ATOM 63995 H2 WAT 3579 5.191 122.193 92.673 1.00 0.00 H TER 63997 WAT 3579 ATOM 63997 O WAT 3580 33.043 39.447 120.594 1.00 0.00 O ATOM 63998 H1 WAT 3580 32.254 39.566 120.065 1.00 0.00 H ATOM 63999 H2 WAT 3580 33.268 38.523 120.483 1.00 0.00 H TER 64001 WAT 3580 ATOM 64001 O WAT 3581 75.163 110.886 105.182 1.00 0.00 O ATOM 64002 H1 WAT 3581 75.338 111.827 105.170 1.00 0.00 H ATOM 64003 H2 WAT 3581 75.683 110.555 105.914 1.00 0.00 H TER 64005 WAT 3581 ATOM 64005 O WAT 3582 131.018 133.410 3.166 1.00 0.00 O ATOM 64006 H1 WAT 3582 130.603 132.600 3.461 1.00 0.00 H ATOM 64007 H2 WAT 3582 130.935 134.007 3.910 1.00 0.00 H TER 64009 WAT 3582 ATOM 64009 O WAT 3583 103.650 22.151 141.248 1.00 0.00 O ATOM 64010 H1 WAT 3583 104.369 21.636 140.882 1.00 0.00 H ATOM 64011 H2 WAT 3583 103.029 21.499 141.573 1.00 0.00 H TER 64013 WAT 3583 ATOM 64013 O WAT 3584 79.872 139.153 70.183 1.00 0.00 O ATOM 64014 H1 WAT 3584 80.118 140.039 70.447 1.00 0.00 H ATOM 64015 H2 WAT 3584 80.015 139.137 69.237 1.00 0.00 H TER 64017 WAT 3584 ATOM 64017 O WAT 3585 33.580 108.025 11.200 1.00 0.00 O ATOM 64018 H1 WAT 3585 33.179 107.883 10.343 1.00 0.00 H ATOM 64019 H2 WAT 3585 34.519 108.074 11.020 1.00 0.00 H TER 64021 WAT 3585 ATOM 64021 O WAT 3586 9.145 31.328 69.244 1.00 0.00 O ATOM 64022 H1 WAT 3586 9.138 30.387 69.068 1.00 0.00 H ATOM 64023 H2 WAT 3586 8.276 31.627 68.976 1.00 0.00 H TER 64025 WAT 3586 ATOM 64025 O WAT 3587 19.549 84.726 138.900 1.00 0.00 O ATOM 64026 H1 WAT 3587 19.155 84.273 139.645 1.00 0.00 H ATOM 64027 H2 WAT 3587 20.473 84.816 139.135 1.00 0.00 H TER 64029 WAT 3587 ATOM 64029 O WAT 3588 142.273 136.182 81.508 1.00 0.00 O ATOM 64030 H1 WAT 3588 142.144 135.868 80.613 1.00 0.00 H ATOM 64031 H2 WAT 3588 142.174 137.132 81.445 1.00 0.00 H TER 64033 WAT 3588 ATOM 64033 O WAT 3589 115.614 60.128 151.088 1.00 0.00 O ATOM 64034 H1 WAT 3589 116.101 60.874 151.439 1.00 0.00 H ATOM 64035 H2 WAT 3589 116.215 59.723 150.463 1.00 0.00 H TER 64037 WAT 3589 ATOM 64037 O WAT 3590 68.488 145.372 116.591 1.00 0.00 O ATOM 64038 H1 WAT 3590 68.796 146.115 117.109 1.00 0.00 H ATOM 64039 H2 WAT 3590 69.260 145.081 116.107 1.00 0.00 H TER 64041 WAT 3590 ATOM 64041 O WAT 3591 111.777 133.729 3.791 1.00 0.00 O ATOM 64042 H1 WAT 3591 112.115 134.620 3.697 1.00 0.00 H ATOM 64043 H2 WAT 3591 112.559 133.186 3.892 1.00 0.00 H TER 64045 WAT 3591 ATOM 64045 O WAT 3592 38.818 42.289 78.782 1.00 0.00 O ATOM 64046 H1 WAT 3592 37.897 42.153 78.561 1.00 0.00 H ATOM 64047 H2 WAT 3592 39.041 41.549 79.346 1.00 0.00 H TER 64049 WAT 3592 ATOM 64049 O WAT 3593 41.325 40.137 21.115 1.00 0.00 O ATOM 64050 H1 WAT 3593 41.381 40.485 22.005 1.00 0.00 H ATOM 64051 H2 WAT 3593 42.173 39.720 20.967 1.00 0.00 H TER 64053 WAT 3593 ATOM 64053 O WAT 3594 99.686 104.133 124.379 1.00 0.00 O ATOM 64054 H1 WAT 3594 99.754 103.644 123.559 1.00 0.00 H ATOM 64055 H2 WAT 3594 98.807 104.512 124.360 1.00 0.00 H TER 64057 WAT 3594 ATOM 64057 O WAT 3595 59.358 54.908 7.256 1.00 0.00 O ATOM 64058 H1 WAT 3595 58.823 55.698 7.338 1.00 0.00 H ATOM 64059 H2 WAT 3595 58.722 54.194 7.209 1.00 0.00 H TER 64061 WAT 3595 ATOM 64061 O WAT 3596 129.664 107.398 1.997 1.00 0.00 O ATOM 64062 H1 WAT 3596 130.526 106.982 1.994 1.00 0.00 H ATOM 64063 H2 WAT 3596 129.669 107.968 1.228 1.00 0.00 H TER 64065 WAT 3596 ATOM 64065 O WAT 3597 47.208 135.048 91.988 1.00 0.00 O ATOM 64066 H1 WAT 3597 46.691 135.476 91.306 1.00 0.00 H ATOM 64067 H2 WAT 3597 47.134 134.114 91.795 1.00 0.00 H TER 64069 WAT 3597 ATOM 64069 O WAT 3598 10.780 52.210 85.242 1.00 0.00 O ATOM 64070 H1 WAT 3598 10.419 52.683 84.492 1.00 0.00 H ATOM 64071 H2 WAT 3598 10.842 51.302 84.945 1.00 0.00 H TER 64073 WAT 3598 ATOM 64073 O WAT 3599 142.895 96.110 102.899 1.00 0.00 O ATOM 64074 H1 WAT 3599 142.537 95.233 103.038 1.00 0.00 H ATOM 64075 H2 WAT 3599 142.707 96.578 103.713 1.00 0.00 H TER 64077 WAT 3599 ATOM 64077 O WAT 3600 69.698 65.349 142.724 1.00 0.00 O ATOM 64078 H1 WAT 3600 69.900 64.575 142.199 1.00 0.00 H ATOM 64079 H2 WAT 3600 68.775 65.247 142.956 1.00 0.00 H TER 64081 WAT 3600 ATOM 64081 O WAT 3601 83.597 35.554 5.543 1.00 0.00 O ATOM 64082 H1 WAT 3601 83.548 36.465 5.833 1.00 0.00 H ATOM 64083 H2 WAT 3601 83.457 35.041 6.340 1.00 0.00 H TER 64085 WAT 3601 ATOM 64085 O WAT 3602 42.395 100.639 137.569 1.00 0.00 O ATOM 64086 H1 WAT 3602 42.450 99.684 137.586 1.00 0.00 H ATOM 64087 H2 WAT 3602 41.837 100.834 136.816 1.00 0.00 H TER 64089 WAT 3602 ATOM 64089 O WAT 3603 67.138 125.811 128.318 1.00 0.00 O ATOM 64090 H1 WAT 3603 66.309 125.740 127.844 1.00 0.00 H ATOM 64091 H2 WAT 3603 67.809 125.715 127.642 1.00 0.00 H TER 64093 WAT 3603 ATOM 64093 O WAT 3604 140.574 125.571 97.444 1.00 0.00 O ATOM 64094 H1 WAT 3604 140.993 126.127 98.101 1.00 0.00 H ATOM 64095 H2 WAT 3604 139.648 125.570 97.686 1.00 0.00 H TER 64097 WAT 3604 ATOM 64097 O WAT 3605 15.258 119.119 150.461 1.00 0.00 O ATOM 64098 H1 WAT 3605 14.523 119.242 151.062 1.00 0.00 H ATOM 64099 H2 WAT 3605 15.185 119.844 149.841 1.00 0.00 H TER 64101 WAT 3605 ATOM 64101 O WAT 3606 3.784 47.261 89.937 1.00 0.00 O ATOM 64102 H1 WAT 3606 3.551 46.437 90.364 1.00 0.00 H ATOM 64103 H2 WAT 3606 4.305 46.999 89.178 1.00 0.00 H TER 64105 WAT 3606 ATOM 64105 O WAT 3607 26.108 110.097 124.117 1.00 0.00 O ATOM 64106 H1 WAT 3607 26.465 110.707 124.762 1.00 0.00 H ATOM 64107 H2 WAT 3607 25.606 110.649 123.518 1.00 0.00 H TER 64109 WAT 3607 ATOM 64109 O WAT 3608 87.297 55.052 63.861 1.00 0.00 O ATOM 64110 H1 WAT 3608 87.135 54.141 64.109 1.00 0.00 H ATOM 64111 H2 WAT 3608 87.906 54.995 63.125 1.00 0.00 H TER 64113 WAT 3608 ATOM 64113 O WAT 3609 74.629 137.773 107.247 1.00 0.00 O ATOM 64114 H1 WAT 3609 74.215 137.378 108.015 1.00 0.00 H ATOM 64115 H2 WAT 3609 74.029 138.472 106.985 1.00 0.00 H TER 64117 WAT 3609 ATOM 64117 O WAT 3610 58.486 7.264 70.433 1.00 0.00 O ATOM 64118 H1 WAT 3610 58.436 6.333 70.650 1.00 0.00 H ATOM 64119 H2 WAT 3610 59.423 7.443 70.359 1.00 0.00 H TER 64121 WAT 3610 ATOM 64121 O WAT 3611 68.176 63.632 107.660 1.00 0.00 O ATOM 64122 H1 WAT 3611 68.775 63.694 108.404 1.00 0.00 H ATOM 64123 H2 WAT 3611 67.381 64.077 107.954 1.00 0.00 H TER 64125 WAT 3611 ATOM 64125 O WAT 3612 26.336 123.279 71.681 1.00 0.00 O ATOM 64126 H1 WAT 3612 26.688 123.019 72.532 1.00 0.00 H ATOM 64127 H2 WAT 3612 25.476 122.860 71.639 1.00 0.00 H TER 64129 WAT 3612 ATOM 64129 O WAT 3613 3.418 98.950 84.140 1.00 0.00 O ATOM 64130 H1 WAT 3613 3.885 98.702 84.938 1.00 0.00 H ATOM 64131 H2 WAT 3613 2.880 98.187 83.931 1.00 0.00 H TER 64133 WAT 3613 ATOM 64133 O WAT 3614 43.858 13.936 124.823 1.00 0.00 O ATOM 64134 H1 WAT 3614 44.715 13.851 124.403 1.00 0.00 H ATOM 64135 H2 WAT 3614 43.802 14.860 125.067 1.00 0.00 H TER 64137 WAT 3614 ATOM 64137 O WAT 3615 63.633 137.203 54.168 1.00 0.00 O ATOM 64138 H1 WAT 3615 64.157 137.384 53.387 1.00 0.00 H ATOM 64139 H2 WAT 3615 63.280 136.325 54.022 1.00 0.00 H TER 64141 WAT 3615 ATOM 64141 O WAT 3616 124.374 135.211 135.154 1.00 0.00 O ATOM 64142 H1 WAT 3616 124.375 135.942 134.536 1.00 0.00 H ATOM 64143 H2 WAT 3616 125.114 134.668 134.883 1.00 0.00 H TER 64145 WAT 3616 ATOM 64145 O WAT 3617 87.724 14.414 12.626 1.00 0.00 O ATOM 64146 H1 WAT 3617 88.483 14.695 12.115 1.00 0.00 H ATOM 64147 H2 WAT 3617 87.593 15.115 13.265 1.00 0.00 H TER 64149 WAT 3617 ATOM 64149 O WAT 3618 40.571 92.545 82.077 1.00 0.00 O ATOM 64150 H1 WAT 3618 39.763 92.387 81.589 1.00 0.00 H ATOM 64151 H2 WAT 3618 40.903 91.671 82.281 1.00 0.00 H TER 64153 WAT 3618 ATOM 64153 O WAT 3619 92.189 113.931 68.287 1.00 0.00 O ATOM 64154 H1 WAT 3619 92.666 114.433 68.948 1.00 0.00 H ATOM 64155 H2 WAT 3619 92.858 113.386 67.872 1.00 0.00 H TER 64157 WAT 3619 ATOM 64157 O WAT 3620 52.973 28.967 83.409 1.00 0.00 O ATOM 64158 H1 WAT 3620 53.340 28.291 82.839 1.00 0.00 H ATOM 64159 H2 WAT 3620 53.659 29.134 84.055 1.00 0.00 H TER 64161 WAT 3620 ATOM 64161 O WAT 3621 139.737 7.161 155.911 1.00 0.00 O ATOM 64162 H1 WAT 3621 138.807 7.158 155.688 1.00 0.00 H ATOM 64163 H2 WAT 3621 139.860 6.370 156.436 1.00 0.00 H TER 64165 WAT 3621 ATOM 64165 O WAT 3622 74.483 15.662 117.311 1.00 0.00 O ATOM 64166 H1 WAT 3622 75.350 15.807 117.691 1.00 0.00 H ATOM 64167 H2 WAT 3622 74.503 16.138 116.481 1.00 0.00 H TER 64169 WAT 3622 ATOM 64169 O WAT 3623 117.819 117.087 112.581 1.00 0.00 O ATOM 64170 H1 WAT 3623 117.406 117.599 113.277 1.00 0.00 H ATOM 64171 H2 WAT 3623 117.101 116.588 112.193 1.00 0.00 H TER 64173 WAT 3623 ATOM 64173 O WAT 3624 28.064 78.217 79.250 1.00 0.00 O ATOM 64174 H1 WAT 3624 27.818 77.380 78.857 1.00 0.00 H ATOM 64175 H2 WAT 3624 27.243 78.705 79.308 1.00 0.00 H TER 64177 WAT 3624 ATOM 64177 O WAT 3625 91.007 38.622 126.549 1.00 0.00 O ATOM 64178 H1 WAT 3625 91.845 38.423 126.967 1.00 0.00 H ATOM 64179 H2 WAT 3625 90.376 38.631 127.269 1.00 0.00 H TER 64181 WAT 3625 ATOM 64181 O WAT 3626 71.889 65.541 14.516 1.00 0.00 O ATOM 64182 H1 WAT 3626 71.248 65.008 14.046 1.00 0.00 H ATOM 64183 H2 WAT 3626 72.374 65.995 13.827 1.00 0.00 H TER 64185 WAT 3626 ATOM 64185 O WAT 3627 62.385 114.801 154.952 1.00 0.00 O ATOM 64186 H1 WAT 3627 62.288 115.380 154.196 1.00 0.00 H ATOM 64187 H2 WAT 3627 63.266 114.438 154.864 1.00 0.00 H TER 64189 WAT 3627 ATOM 64189 O WAT 3628 21.860 43.184 8.138 1.00 0.00 O ATOM 64190 H1 WAT 3628 21.210 43.024 8.823 1.00 0.00 H ATOM 64191 H2 WAT 3628 21.356 43.540 7.407 1.00 0.00 H TER 64193 WAT 3628 ATOM 64193 O WAT 3629 67.873 106.583 77.735 1.00 0.00 O ATOM 64194 H1 WAT 3629 68.817 106.734 77.703 1.00 0.00 H ATOM 64195 H2 WAT 3629 67.576 107.077 78.499 1.00 0.00 H TER 64197 WAT 3629 ATOM 64197 O WAT 3630 14.723 29.817 6.166 1.00 0.00 O ATOM 64198 H1 WAT 3630 14.450 29.665 5.261 1.00 0.00 H ATOM 64199 H2 WAT 3630 15.448 29.208 6.303 1.00 0.00 H TER 64201 WAT 3630 ATOM 64201 O WAT 3631 43.955 52.627 56.989 1.00 0.00 O ATOM 64202 H1 WAT 3631 43.570 52.125 57.708 1.00 0.00 H ATOM 64203 H2 WAT 3631 43.294 52.601 56.297 1.00 0.00 H TER 64205 WAT 3631 ATOM 64205 O WAT 3632 52.840 83.130 122.914 1.00 0.00 O ATOM 64206 H1 WAT 3632 53.045 83.343 122.004 1.00 0.00 H ATOM 64207 H2 WAT 3632 53.623 83.384 123.402 1.00 0.00 H TER 64209 WAT 3632 ATOM 64209 O WAT 3633 118.935 133.858 99.686 1.00 0.00 O ATOM 64210 H1 WAT 3633 118.579 133.971 98.805 1.00 0.00 H ATOM 64211 H2 WAT 3633 119.449 134.650 99.841 1.00 0.00 H TER 64213 WAT 3633 ATOM 64213 O WAT 3634 89.452 42.547 102.568 1.00 0.00 O ATOM 64214 H1 WAT 3634 89.888 42.468 101.719 1.00 0.00 H ATOM 64215 H2 WAT 3634 90.148 42.401 103.209 1.00 0.00 H TER 64217 WAT 3634 ATOM 64217 O WAT 3635 66.628 91.813 126.211 1.00 0.00 O ATOM 64218 H1 WAT 3635 65.730 91.762 126.537 1.00 0.00 H ATOM 64219 H2 WAT 3635 66.670 91.151 125.521 1.00 0.00 H TER 64221 WAT 3635 ATOM 64221 O WAT 3636 6.370 105.641 118.763 1.00 0.00 O ATOM 64222 H1 WAT 3636 7.271 105.628 118.439 1.00 0.00 H ATOM 64223 H2 WAT 3636 6.440 105.999 119.648 1.00 0.00 H TER 64225 WAT 3636 ATOM 64225 O WAT 3637 80.213 137.863 2.057 1.00 0.00 O ATOM 64226 H1 WAT 3637 79.644 137.102 1.943 1.00 0.00 H ATOM 64227 H2 WAT 3637 80.042 138.407 1.288 1.00 0.00 H TER 64229 WAT 3637 ATOM 64229 O WAT 3638 74.135 85.817 69.120 1.00 0.00 O ATOM 64230 H1 WAT 3638 74.825 86.300 69.575 1.00 0.00 H ATOM 64231 H2 WAT 3638 73.414 86.442 69.046 1.00 0.00 H TER 64233 WAT 3638 ATOM 64233 O WAT 3639 92.303 117.389 127.713 1.00 0.00 O ATOM 64234 H1 WAT 3639 92.246 118.141 127.123 1.00 0.00 H ATOM 64235 H2 WAT 3639 91.562 117.496 128.309 1.00 0.00 H TER 64237 WAT 3639 ATOM 64237 O WAT 3640 94.499 15.444 88.339 1.00 0.00 O ATOM 64238 H1 WAT 3640 95.074 14.682 88.404 1.00 0.00 H ATOM 64239 H2 WAT 3640 94.885 15.976 87.643 1.00 0.00 H TER 64241 WAT 3640 ATOM 64241 O WAT 3641 83.733 46.939 82.245 1.00 0.00 O ATOM 64242 H1 WAT 3641 84.669 47.018 82.431 1.00 0.00 H ATOM 64243 H2 WAT 3641 83.687 46.335 81.503 1.00 0.00 H TER 64245 WAT 3641 ATOM 64245 O WAT 3642 127.663 70.535 78.084 1.00 0.00 O ATOM 64246 H1 WAT 3642 127.844 71.475 78.098 1.00 0.00 H ATOM 64247 H2 WAT 3642 128.128 70.190 78.846 1.00 0.00 H TER 64249 WAT 3642 ATOM 64249 O WAT 3643 43.965 4.981 123.965 1.00 0.00 O ATOM 64250 H1 WAT 3643 43.496 4.195 123.687 1.00 0.00 H ATOM 64251 H2 WAT 3643 43.327 5.688 123.867 1.00 0.00 H TER 64253 WAT 3643 ATOM 64253 O WAT 3644 29.210 48.729 80.643 1.00 0.00 O ATOM 64254 H1 WAT 3644 29.258 49.663 80.848 1.00 0.00 H ATOM 64255 H2 WAT 3644 29.895 48.592 79.988 1.00 0.00 H TER 64257 WAT 3644 ATOM 64257 O WAT 3645 43.640 83.299 105.467 1.00 0.00 O ATOM 64258 H1 WAT 3645 44.088 84.128 105.296 1.00 0.00 H ATOM 64259 H2 WAT 3645 44.307 82.746 105.874 1.00 0.00 H TER 64261 WAT 3645 ATOM 64261 O WAT 3646 122.781 22.521 130.394 1.00 0.00 O ATOM 64262 H1 WAT 3646 123.072 23.378 130.706 1.00 0.00 H ATOM 64263 H2 WAT 3646 121.974 22.351 130.880 1.00 0.00 H TER 64265 WAT 3646 ATOM 64265 O WAT 3647 47.028 75.282 128.297 1.00 0.00 O ATOM 64266 H1 WAT 3647 46.250 75.301 128.854 1.00 0.00 H ATOM 64267 H2 WAT 3647 47.294 74.362 128.288 1.00 0.00 H TER 64269 WAT 3647 ATOM 64269 O WAT 3648 124.376 46.052 126.106 1.00 0.00 O ATOM 64270 H1 WAT 3648 124.386 46.935 126.476 1.00 0.00 H ATOM 64271 H2 WAT 3648 123.452 45.880 125.923 1.00 0.00 H TER 64273 WAT 3648 ATOM 64273 O WAT 3649 100.058 139.173 132.786 1.00 0.00 O ATOM 64274 H1 WAT 3649 100.037 139.841 133.471 1.00 0.00 H ATOM 64275 H2 WAT 3649 100.929 139.255 132.399 1.00 0.00 H TER 64277 WAT 3649 ATOM 64277 O WAT 3650 115.369 41.855 100.710 1.00 0.00 O ATOM 64278 H1 WAT 3650 115.431 42.212 99.824 1.00 0.00 H ATOM 64279 H2 WAT 3650 115.678 40.953 100.626 1.00 0.00 H TER 64281 WAT 3650 ATOM 64281 O WAT 3651 15.070 110.806 121.612 1.00 0.00 O ATOM 64282 H1 WAT 3651 15.279 111.702 121.350 1.00 0.00 H ATOM 64283 H2 WAT 3651 14.275 110.889 122.139 1.00 0.00 H TER 64285 WAT 3651 ATOM 64285 O WAT 3652 22.023 114.064 129.223 1.00 0.00 O ATOM 64286 H1 WAT 3652 22.295 114.888 129.627 1.00 0.00 H ATOM 64287 H2 WAT 3652 21.069 114.120 129.183 1.00 0.00 H TER 64289 WAT 3652 ATOM 64289 O WAT 3653 7.364 65.511 74.635 1.00 0.00 O ATOM 64290 H1 WAT 3653 7.473 64.782 75.246 1.00 0.00 H ATOM 64291 H2 WAT 3653 7.650 66.281 75.127 1.00 0.00 H TER 64293 WAT 3653 ATOM 64293 O WAT 3654 55.670 24.843 71.412 1.00 0.00 O ATOM 64294 H1 WAT 3654 55.959 24.124 71.974 1.00 0.00 H ATOM 64295 H2 WAT 3654 55.652 24.467 70.532 1.00 0.00 H TER 64297 WAT 3654 ATOM 64297 O WAT 3655 23.157 33.584 70.496 1.00 0.00 O ATOM 64298 H1 WAT 3655 23.847 34.009 69.987 1.00 0.00 H ATOM 64299 H2 WAT 3655 22.934 32.802 69.992 1.00 0.00 H TER 64301 WAT 3655 ATOM 64301 O WAT 3656 70.483 63.483 117.438 1.00 0.00 O ATOM 64302 H1 WAT 3656 70.068 63.681 118.278 1.00 0.00 H ATOM 64303 H2 WAT 3656 71.371 63.210 117.668 1.00 0.00 H TER 64305 WAT 3656 ATOM 64305 O WAT 3657 134.808 129.386 112.387 1.00 0.00 O ATOM 64306 H1 WAT 3657 134.932 130.311 112.602 1.00 0.00 H ATOM 64307 H2 WAT 3657 135.674 128.995 112.503 1.00 0.00 H TER 64309 WAT 3657 ATOM 64309 O WAT 3658 89.377 40.640 20.614 1.00 0.00 O ATOM 64310 H1 WAT 3658 89.466 41.266 21.333 1.00 0.00 H ATOM 64311 H2 WAT 3658 88.483 40.767 20.296 1.00 0.00 H TER 64313 WAT 3658 ATOM 64313 O WAT 3659 62.971 115.230 86.833 1.00 0.00 O ATOM 64314 H1 WAT 3659 62.102 115.550 87.075 1.00 0.00 H ATOM 64315 H2 WAT 3659 62.800 114.445 86.312 1.00 0.00 H TER 64317 WAT 3659 ATOM 64317 O WAT 3660 88.707 93.607 106.764 1.00 0.00 O ATOM 64318 H1 WAT 3660 88.000 94.182 106.468 1.00 0.00 H ATOM 64319 H2 WAT 3660 89.231 94.155 107.348 1.00 0.00 H TER 64321 WAT 3660 ATOM 64321 O WAT 3661 138.849 30.380 91.540 1.00 0.00 O ATOM 64322 H1 WAT 3661 139.173 29.497 91.720 1.00 0.00 H ATOM 64323 H2 WAT 3661 137.898 30.307 91.624 1.00 0.00 H TER 64325 WAT 3661 ATOM 64325 O WAT 3662 86.790 67.525 85.433 1.00 0.00 O ATOM 64326 H1 WAT 3662 86.451 67.362 84.553 1.00 0.00 H ATOM 64327 H2 WAT 3662 86.017 67.757 85.948 1.00 0.00 H TER 64329 WAT 3662 ATOM 64329 O WAT 3663 51.021 138.935 10.823 1.00 0.00 O ATOM 64330 H1 WAT 3663 51.037 139.764 11.302 1.00 0.00 H ATOM 64331 H2 WAT 3663 50.648 139.158 9.970 1.00 0.00 H TER 64333 WAT 3663 ATOM 64333 O WAT 3664 87.489 58.124 135.394 1.00 0.00 O ATOM 64334 H1 WAT 3664 88.265 57.680 135.052 1.00 0.00 H ATOM 64335 H2 WAT 3664 87.670 58.237 136.327 1.00 0.00 H TER 64337 WAT 3664 ATOM 64337 O WAT 3665 41.210 128.704 86.070 1.00 0.00 O ATOM 64338 H1 WAT 3665 41.864 129.222 86.540 1.00 0.00 H ATOM 64339 H2 WAT 3665 41.587 127.825 86.027 1.00 0.00 H TER 64341 WAT 3665 ATOM 64341 O WAT 3666 137.564 138.724 13.739 1.00 0.00 O ATOM 64342 H1 WAT 3666 136.764 139.246 13.673 1.00 0.00 H ATOM 64343 H2 WAT 3666 138.213 139.214 13.235 1.00 0.00 H TER 64345 WAT 3666 ATOM 64345 O WAT 3667 67.186 39.401 97.065 1.00 0.00 O ATOM 64346 H1 WAT 3667 66.925 39.800 96.235 1.00 0.00 H ATOM 64347 H2 WAT 3667 67.629 38.591 96.813 1.00 0.00 H TER 64349 WAT 3667 ATOM 64349 O WAT 3668 42.362 76.978 130.357 1.00 0.00 O ATOM 64350 H1 WAT 3668 42.836 77.759 130.642 1.00 0.00 H ATOM 64351 H2 WAT 3668 42.284 77.078 129.409 1.00 0.00 H TER 64353 WAT 3668 ATOM 64353 O WAT 3669 47.131 19.136 129.666 1.00 0.00 O ATOM 64354 H1 WAT 3669 46.968 19.191 128.724 1.00 0.00 H ATOM 64355 H2 WAT 3669 46.344 18.723 130.021 1.00 0.00 H TER 64357 WAT 3669 ATOM 64357 O WAT 3670 7.832 48.638 13.135 1.00 0.00 O ATOM 64358 H1 WAT 3670 7.641 48.058 13.872 1.00 0.00 H ATOM 64359 H2 WAT 3670 7.280 48.313 12.425 1.00 0.00 H TER 64361 WAT 3670 ATOM 64361 O WAT 3671 15.046 36.858 109.114 1.00 0.00 O ATOM 64362 H1 WAT 3671 15.210 36.509 109.990 1.00 0.00 H ATOM 64363 H2 WAT 3671 14.141 37.168 109.145 1.00 0.00 H TER 64365 WAT 3671 ATOM 64365 O WAT 3672 27.759 86.083 12.040 1.00 0.00 O ATOM 64366 H1 WAT 3672 28.465 86.175 11.400 1.00 0.00 H ATOM 64367 H2 WAT 3672 27.032 85.709 11.542 1.00 0.00 H TER 64369 WAT 3672 ATOM 64369 O WAT 3673 115.992 74.488 9.006 1.00 0.00 O ATOM 64370 H1 WAT 3673 115.697 73.778 8.436 1.00 0.00 H ATOM 64371 H2 WAT 3673 116.624 74.973 8.475 1.00 0.00 H TER 64373 WAT 3673 ATOM 64373 O WAT 3674 93.464 67.643 129.980 1.00 0.00 O ATOM 64374 H1 WAT 3674 92.935 66.944 129.595 1.00 0.00 H ATOM 64375 H2 WAT 3674 94.069 67.191 130.567 1.00 0.00 H TER 64377 WAT 3674 ATOM 64377 O WAT 3675 73.588 118.802 6.490 1.00 0.00 O ATOM 64378 H1 WAT 3675 73.197 117.942 6.643 1.00 0.00 H ATOM 64379 H2 WAT 3675 72.844 119.403 6.465 1.00 0.00 H TER 64381 WAT 3675 ATOM 64381 O WAT 3676 24.237 75.596 61.960 1.00 0.00 O ATOM 64382 H1 WAT 3676 23.303 75.606 61.752 1.00 0.00 H ATOM 64383 H2 WAT 3676 24.308 76.105 62.767 1.00 0.00 H TER 64385 WAT 3676 ATOM 64385 O WAT 3677 78.889 67.025 26.341 1.00 0.00 O ATOM 64386 H1 WAT 3677 78.928 66.375 27.042 1.00 0.00 H ATOM 64387 H2 WAT 3677 77.954 67.183 26.212 1.00 0.00 H TER 64389 WAT 3677 ATOM 64389 O WAT 3678 1.170 46.921 71.003 1.00 0.00 O ATOM 64390 H1 WAT 3678 1.931 47.135 71.543 1.00 0.00 H ATOM 64391 H2 WAT 3678 1.434 47.158 70.113 1.00 0.00 H TER 64393 WAT 3678 ATOM 64393 O WAT 3679 80.026 103.481 17.998 1.00 0.00 O ATOM 64394 H1 WAT 3679 79.389 104.195 18.002 1.00 0.00 H ATOM 64395 H2 WAT 3679 79.528 102.717 17.708 1.00 0.00 H TER 64397 WAT 3679 ATOM 64397 O WAT 3680 54.517 10.584 14.171 1.00 0.00 O ATOM 64398 H1 WAT 3680 53.997 9.790 14.295 1.00 0.00 H ATOM 64399 H2 WAT 3680 55.087 10.619 14.939 1.00 0.00 H TER 64401 WAT 3680 ATOM 64401 O WAT 3681 51.522 115.592 157.777 1.00 0.00 O ATOM 64402 H1 WAT 3681 51.303 115.482 156.852 1.00 0.00 H ATOM 64403 H2 WAT 3681 50.676 115.707 158.211 1.00 0.00 H TER 64405 WAT 3681 ATOM 64405 O WAT 3682 128.666 102.088 126.904 1.00 0.00 O ATOM 64406 H1 WAT 3682 128.919 101.229 126.565 1.00 0.00 H ATOM 64407 H2 WAT 3682 128.566 101.953 127.846 1.00 0.00 H TER 64409 WAT 3682 ATOM 64409 O WAT 3683 47.664 87.847 122.466 1.00 0.00 O ATOM 64410 H1 WAT 3683 48.330 88.083 123.111 1.00 0.00 H ATOM 64411 H2 WAT 3683 46.862 88.259 122.787 1.00 0.00 H TER 64413 WAT 3683 ATOM 64413 O WAT 3684 48.292 16.971 120.581 1.00 0.00 O ATOM 64414 H1 WAT 3684 47.984 17.071 119.680 1.00 0.00 H ATOM 64415 H2 WAT 3684 47.519 16.684 121.067 1.00 0.00 H TER 64417 WAT 3684 ATOM 64417 O WAT 3685 130.853 12.044 15.046 1.00 0.00 O ATOM 64418 H1 WAT 3685 130.859 12.898 14.614 1.00 0.00 H ATOM 64419 H2 WAT 3685 130.264 12.158 15.792 1.00 0.00 H TER 64421 WAT 3685 ATOM 64421 O WAT 3686 21.382 117.037 134.893 1.00 0.00 O ATOM 64422 H1 WAT 3686 20.723 116.557 135.395 1.00 0.00 H ATOM 64423 H2 WAT 3686 21.191 116.822 133.980 1.00 0.00 H TER 64425 WAT 3686 ATOM 64425 O WAT 3687 81.457 112.104 112.336 1.00 0.00 O ATOM 64426 H1 WAT 3687 81.818 112.000 113.217 1.00 0.00 H ATOM 64427 H2 WAT 3687 81.096 111.244 112.122 1.00 0.00 H TER 64429 WAT 3687 ATOM 64429 O WAT 3688 125.084 117.148 131.543 1.00 0.00 O ATOM 64430 H1 WAT 3688 124.846 117.355 130.639 1.00 0.00 H ATOM 64431 H2 WAT 3688 125.837 117.711 131.727 1.00 0.00 H TER 64433 WAT 3688 ATOM 64433 O WAT 3689 38.414 31.463 21.643 1.00 0.00 O ATOM 64434 H1 WAT 3689 39.044 32.182 21.685 1.00 0.00 H ATOM 64435 H2 WAT 3689 38.243 31.241 22.559 1.00 0.00 H TER 64437 WAT 3689 ATOM 64437 O WAT 3690 61.789 60.575 151.270 1.00 0.00 O ATOM 64438 H1 WAT 3690 60.861 60.659 151.488 1.00 0.00 H ATOM 64439 H2 WAT 3690 62.236 61.132 151.908 1.00 0.00 H TER 64441 WAT 3690 ATOM 64441 O WAT 3691 116.326 125.239 113.964 1.00 0.00 O ATOM 64442 H1 WAT 3691 116.530 126.114 114.292 1.00 0.00 H ATOM 64443 H2 WAT 3691 117.046 125.033 113.367 1.00 0.00 H TER 64445 WAT 3691 ATOM 64445 O WAT 3692 42.813 100.628 5.384 1.00 0.00 O ATOM 64446 H1 WAT 3692 42.200 100.455 4.669 1.00 0.00 H ATOM 64447 H2 WAT 3692 43.064 99.760 5.699 1.00 0.00 H TER 64449 WAT 3692 ATOM 64449 O WAT 3693 74.871 37.655 115.338 1.00 0.00 O ATOM 64450 H1 WAT 3693 75.739 37.582 114.941 1.00 0.00 H ATOM 64451 H2 WAT 3693 75.019 37.495 116.270 1.00 0.00 H TER 64453 WAT 3693 ATOM 64453 O WAT 3694 125.043 67.042 57.472 1.00 0.00 O ATOM 64454 H1 WAT 3694 125.828 66.496 57.441 1.00 0.00 H ATOM 64455 H2 WAT 3694 124.358 66.459 57.800 1.00 0.00 H TER 64457 WAT 3694 ATOM 64457 O WAT 3695 95.166 20.985 68.961 1.00 0.00 O ATOM 64458 H1 WAT 3695 95.028 20.876 69.902 1.00 0.00 H ATOM 64459 H2 WAT 3695 96.059 20.673 68.813 1.00 0.00 H TER 64461 WAT 3695 ATOM 64461 O WAT 3696 141.659 38.831 10.503 1.00 0.00 O ATOM 64462 H1 WAT 3696 141.561 38.412 9.648 1.00 0.00 H ATOM 64463 H2 WAT 3696 142.604 38.932 10.613 1.00 0.00 H TER 64465 WAT 3696 ATOM 64465 O WAT 3697 59.949 94.344 97.367 1.00 0.00 O ATOM 64466 H1 WAT 3697 59.980 95.209 97.777 1.00 0.00 H ATOM 64467 H2 WAT 3697 60.302 94.483 96.488 1.00 0.00 H TER 64469 WAT 3697 ATOM 64469 O WAT 3698 138.527 108.025 78.522 1.00 0.00 O ATOM 64470 H1 WAT 3698 139.315 108.318 78.064 1.00 0.00 H ATOM 64471 H2 WAT 3698 138.302 108.754 79.100 1.00 0.00 H TER 64473 WAT 3698 ATOM 64473 O WAT 3699 54.964 99.076 58.657 1.00 0.00 O ATOM 64474 H1 WAT 3699 55.881 99.256 58.860 1.00 0.00 H ATOM 64475 H2 WAT 3699 54.988 98.281 58.123 1.00 0.00 H TER 64477 WAT 3699 ATOM 64477 O WAT 3700 130.278 28.366 13.294 1.00 0.00 O ATOM 64478 H1 WAT 3700 130.670 28.432 14.165 1.00 0.00 H ATOM 64479 H2 WAT 3700 130.886 28.832 12.721 1.00 0.00 H TER 64481 WAT 3700 ATOM 64481 O WAT 3701 97.440 9.369 57.006 1.00 0.00 O ATOM 64482 H1 WAT 3701 97.533 9.670 56.102 1.00 0.00 H ATOM 64483 H2 WAT 3701 98.320 9.084 57.255 1.00 0.00 H TER 64485 WAT 3701 ATOM 64485 O WAT 3702 6.653 5.087 21.588 1.00 0.00 O ATOM 64486 H1 WAT 3702 7.422 5.473 21.170 1.00 0.00 H ATOM 64487 H2 WAT 3702 6.249 5.812 22.064 1.00 0.00 H TER 64489 WAT 3702 ATOM 64489 O WAT 3703 63.867 29.084 152.855 1.00 0.00 O ATOM 64490 H1 WAT 3703 64.667 29.334 152.392 1.00 0.00 H ATOM 64491 H2 WAT 3703 63.551 29.899 153.245 1.00 0.00 H TER 64493 WAT 3703 ATOM 64493 O WAT 3704 72.458 137.671 116.495 1.00 0.00 O ATOM 64494 H1 WAT 3704 72.410 138.586 116.215 1.00 0.00 H ATOM 64495 H2 WAT 3704 73.363 137.415 116.318 1.00 0.00 H TER 64497 WAT 3704 ATOM 64497 O WAT 3705 26.584 127.703 61.585 1.00 0.00 O ATOM 64498 H1 WAT 3705 26.495 126.842 61.177 1.00 0.00 H ATOM 64499 H2 WAT 3705 26.915 127.519 62.463 1.00 0.00 H TER 64501 WAT 3705 ATOM 64501 O WAT 3706 31.336 35.197 115.019 1.00 0.00 O ATOM 64502 H1 WAT 3706 31.882 35.585 115.703 1.00 0.00 H ATOM 64503 H2 WAT 3706 30.442 35.282 115.350 1.00 0.00 H TER 64505 WAT 3706 ATOM 64505 O WAT 3707 75.698 44.792 15.077 1.00 0.00 O ATOM 64506 H1 WAT 3707 75.890 44.206 15.809 1.00 0.00 H ATOM 64507 H2 WAT 3707 74.744 44.777 15.002 1.00 0.00 H TER 64509 WAT 3707 ATOM 64509 O WAT 3708 134.561 6.465 123.607 1.00 0.00 O ATOM 64510 H1 WAT 3708 134.922 7.067 122.956 1.00 0.00 H ATOM 64511 H2 WAT 3708 133.626 6.672 123.631 1.00 0.00 H TER 64513 WAT 3708 ATOM 64513 O WAT 3709 62.802 32.470 93.023 1.00 0.00 O ATOM 64514 H1 WAT 3709 62.320 32.946 92.347 1.00 0.00 H ATOM 64515 H2 WAT 3709 63.486 32.002 92.544 1.00 0.00 H TER 64517 WAT 3709 ATOM 64517 O WAT 3710 95.784 56.452 146.298 1.00 0.00 O ATOM 64518 H1 WAT 3710 96.081 57.227 145.821 1.00 0.00 H ATOM 64519 H2 WAT 3710 95.849 55.740 145.662 1.00 0.00 H TER 64521 WAT 3710 ATOM 64521 O WAT 3711 102.629 74.606 158.193 1.00 0.00 O ATOM 64522 H1 WAT 3711 103.080 73.872 158.611 1.00 0.00 H ATOM 64523 H2 WAT 3711 103.294 75.009 157.635 1.00 0.00 H TER 64525 WAT 3711 ATOM 64525 O WAT 3712 57.337 4.303 105.774 1.00 0.00 O ATOM 64526 H1 WAT 3712 57.588 3.834 104.979 1.00 0.00 H ATOM 64527 H2 WAT 3712 56.723 4.973 105.473 1.00 0.00 H TER 64529 WAT 3712 ATOM 64529 O WAT 3713 5.064 141.001 124.745 1.00 0.00 O ATOM 64530 H1 WAT 3713 4.795 140.132 125.043 1.00 0.00 H ATOM 64531 H2 WAT 3713 5.767 140.832 124.118 1.00 0.00 H TER 64533 WAT 3713 ATOM 64533 O WAT 3714 14.866 121.408 90.689 1.00 0.00 O ATOM 64534 H1 WAT 3714 15.615 121.285 91.273 1.00 0.00 H ATOM 64535 H2 WAT 3714 15.050 122.229 90.233 1.00 0.00 H TER 64537 WAT 3714 ATOM 64537 O WAT 3715 75.725 119.102 84.108 1.00 0.00 O ATOM 64538 H1 WAT 3715 75.030 119.715 84.347 1.00 0.00 H ATOM 64539 H2 WAT 3715 75.320 118.238 84.188 1.00 0.00 H TER 64541 WAT 3715 ATOM 64541 O WAT 3716 120.107 38.474 99.281 1.00 0.00 O ATOM 64542 H1 WAT 3716 120.605 39.177 98.865 1.00 0.00 H ATOM 64543 H2 WAT 3716 120.087 37.775 98.627 1.00 0.00 H TER 64545 WAT 3716 ATOM 64545 O WAT 3717 115.594 42.728 88.822 1.00 0.00 O ATOM 64546 H1 WAT 3717 115.708 43.315 88.075 1.00 0.00 H ATOM 64547 H2 WAT 3717 116.166 43.089 89.500 1.00 0.00 H TER 64549 WAT 3717 ATOM 64549 O WAT 3718 105.858 109.517 145.802 1.00 0.00 O ATOM 64550 H1 WAT 3718 106.576 109.961 146.252 1.00 0.00 H ATOM 64551 H2 WAT 3718 105.139 110.149 145.816 1.00 0.00 H TER 64553 WAT 3718 ATOM 64553 O WAT 3719 108.974 108.495 87.946 1.00 0.00 O ATOM 64554 H1 WAT 3719 109.539 107.773 87.670 1.00 0.00 H ATOM 64555 H2 WAT 3719 109.100 109.167 87.276 1.00 0.00 H TER 64557 WAT 3719 ATOM 64557 O WAT 3720 0.052 0.474 102.307 1.00 0.00 O ATOM 64558 H1 WAT 3720 0.025 0.233 103.233 1.00 0.00 H ATOM 64559 H2 WAT 3720 0.328 -0.326 101.860 1.00 0.00 H TER 64561 WAT 3720 ATOM 64561 O WAT 3721 114.895 123.237 136.625 1.00 0.00 O ATOM 64562 H1 WAT 3721 115.800 123.192 136.934 1.00 0.00 H ATOM 64563 H2 WAT 3721 114.538 122.367 136.801 1.00 0.00 H TER 64565 WAT 3721 ATOM 64565 O WAT 3722 63.870 49.357 132.398 1.00 0.00 O ATOM 64566 H1 WAT 3722 63.853 48.593 131.821 1.00 0.00 H ATOM 64567 H2 WAT 3722 64.669 49.824 132.152 1.00 0.00 H TER 64569 WAT 3722 ATOM 64569 O WAT 3723 62.843 18.615 152.593 1.00 0.00 O ATOM 64570 H1 WAT 3723 63.097 18.303 153.461 1.00 0.00 H ATOM 64571 H2 WAT 3723 61.887 18.569 152.591 1.00 0.00 H TER 64573 WAT 3723 ATOM 64573 O WAT 3724 79.994 71.458 76.867 1.00 0.00 O ATOM 64574 H1 WAT 3724 79.096 71.131 76.912 1.00 0.00 H ATOM 64575 H2 WAT 3724 80.442 70.850 76.279 1.00 0.00 H TER 64577 WAT 3724 ATOM 64577 O WAT 3725 36.817 2.887 83.825 1.00 0.00 O ATOM 64578 H1 WAT 3725 37.217 3.595 84.331 1.00 0.00 H ATOM 64579 H2 WAT 3725 37.548 2.311 83.601 1.00 0.00 H TER 64581 WAT 3725 ATOM 64581 O WAT 3726 20.704 104.766 10.823 1.00 0.00 O ATOM 64582 H1 WAT 3726 20.182 105.369 10.293 1.00 0.00 H ATOM 64583 H2 WAT 3726 20.500 103.900 10.470 1.00 0.00 H TER 64585 WAT 3726 ATOM 64585 O WAT 3727 109.501 139.336 89.098 1.00 0.00 O ATOM 64586 H1 WAT 3727 108.978 140.066 88.767 1.00 0.00 H ATOM 64587 H2 WAT 3727 109.489 139.444 90.049 1.00 0.00 H TER 64589 WAT 3727 ATOM 64589 O WAT 3728 1.847 43.223 119.351 1.00 0.00 O ATOM 64590 H1 WAT 3728 1.878 43.764 118.563 1.00 0.00 H ATOM 64591 H2 WAT 3728 1.333 43.737 119.975 1.00 0.00 H TER 64593 WAT 3728 ATOM 64593 O WAT 3729 135.198 45.873 132.795 1.00 0.00 O ATOM 64594 H1 WAT 3729 136.147 45.761 132.744 1.00 0.00 H ATOM 64595 H2 WAT 3729 134.847 45.232 132.176 1.00 0.00 H TER 64597 WAT 3729 ATOM 64597 O WAT 3730 88.389 85.224 6.732 1.00 0.00 O ATOM 64598 H1 WAT 3730 89.139 84.686 6.479 1.00 0.00 H ATOM 64599 H2 WAT 3730 88.655 86.120 6.521 1.00 0.00 H TER 64601 WAT 3730 ATOM 64601 O WAT 3731 97.864 10.842 67.914 1.00 0.00 O ATOM 64602 H1 WAT 3731 96.952 11.105 68.041 1.00 0.00 H ATOM 64603 H2 WAT 3731 97.869 10.399 67.065 1.00 0.00 H TER 64605 WAT 3731 ATOM 64605 O WAT 3732 25.826 131.828 139.821 1.00 0.00 O ATOM 64606 H1 WAT 3732 25.023 132.082 139.365 1.00 0.00 H ATOM 64607 H2 WAT 3732 25.539 131.193 140.476 1.00 0.00 H TER 64609 WAT 3732 ATOM 64609 O WAT 3733 84.762 22.821 151.373 1.00 0.00 O ATOM 64610 H1 WAT 3733 85.306 23.120 152.102 1.00 0.00 H ATOM 64611 H2 WAT 3733 85.062 23.336 150.624 1.00 0.00 H TER 64613 WAT 3733 ATOM 64613 O WAT 3734 1.505 141.504 90.878 1.00 0.00 O ATOM 64614 H1 WAT 3734 2.398 141.233 90.665 1.00 0.00 H ATOM 64615 H2 WAT 3734 1.195 141.947 90.088 1.00 0.00 H TER 64617 WAT 3734 ATOM 64617 O WAT 3735 65.796 44.934 127.592 1.00 0.00 O ATOM 64618 H1 WAT 3735 65.978 45.436 126.797 1.00 0.00 H ATOM 64619 H2 WAT 3735 66.645 44.574 127.848 1.00 0.00 H TER 64621 WAT 3735 ATOM 64621 O WAT 3736 133.233 42.853 61.571 1.00 0.00 O ATOM 64622 H1 WAT 3736 133.948 43.271 61.091 1.00 0.00 H ATOM 64623 H2 WAT 3736 132.439 43.172 61.142 1.00 0.00 H TER 64625 WAT 3736 ATOM 64625 O WAT 3737 59.831 46.267 68.672 1.00 0.00 O ATOM 64626 H1 WAT 3737 59.086 46.587 68.164 1.00 0.00 H ATOM 64627 H2 WAT 3737 59.598 46.454 69.581 1.00 0.00 H TER 64629 WAT 3737 ATOM 64629 O WAT 3738 8.427 34.379 158.035 1.00 0.00 O ATOM 64630 H1 WAT 3738 9.086 34.684 158.658 1.00 0.00 H ATOM 64631 H2 WAT 3738 8.933 33.994 157.320 1.00 0.00 H TER 64633 WAT 3738 ATOM 64633 O WAT 3739 8.943 38.899 111.187 1.00 0.00 O ATOM 64634 H1 WAT 3739 9.002 39.142 112.111 1.00 0.00 H ATOM 64635 H2 WAT 3739 8.221 38.271 111.150 1.00 0.00 H TER 64637 WAT 3739 ATOM 64637 O WAT 3740 14.901 72.944 99.524 1.00 0.00 O ATOM 64638 H1 WAT 3740 14.386 72.161 99.717 1.00 0.00 H ATOM 64639 H2 WAT 3740 15.123 72.861 98.596 1.00 0.00 H TER 64641 WAT 3740 ATOM 64641 O WAT 3741 97.972 48.784 147.481 1.00 0.00 O ATOM 64642 H1 WAT 3741 98.603 49.213 146.904 1.00 0.00 H ATOM 64643 H2 WAT 3741 97.332 48.392 146.887 1.00 0.00 H TER 64645 WAT 3741 ATOM 64645 O WAT 3742 80.865 122.028 116.360 1.00 0.00 O ATOM 64646 H1 WAT 3742 81.263 122.469 115.609 1.00 0.00 H ATOM 64647 H2 WAT 3742 79.962 121.862 116.089 1.00 0.00 H TER 64649 WAT 3742 ATOM 64649 O WAT 3743 133.669 112.675 7.999 1.00 0.00 O ATOM 64650 H1 WAT 3743 133.946 112.496 8.898 1.00 0.00 H ATOM 64651 H2 WAT 3743 133.761 113.623 7.904 1.00 0.00 H TER 64653 WAT 3743 ATOM 64653 O WAT 3744 44.572 0.269 130.832 1.00 0.00 O ATOM 64654 H1 WAT 3744 44.918 1.138 130.629 1.00 0.00 H ATOM 64655 H2 WAT 3744 45.293 -0.178 131.275 1.00 0.00 H TER 64657 WAT 3744 ATOM 64657 O WAT 3745 136.905 21.650 135.595 1.00 0.00 O ATOM 64658 H1 WAT 3745 136.446 20.819 135.714 1.00 0.00 H ATOM 64659 H2 WAT 3745 136.684 21.920 134.703 1.00 0.00 H TER 64661 WAT 3745 ATOM 64661 O WAT 3746 113.000 60.518 101.091 1.00 0.00 O ATOM 64662 H1 WAT 3746 112.077 60.276 101.168 1.00 0.00 H ATOM 64663 H2 WAT 3746 113.124 60.694 100.158 1.00 0.00 H TER 64665 WAT 3746 ATOM 64665 O WAT 3747 127.507 71.590 100.065 1.00 0.00 O ATOM 64666 H1 WAT 3747 127.656 72.358 100.618 1.00 0.00 H ATOM 64667 H2 WAT 3747 128.264 71.028 100.227 1.00 0.00 H TER 64669 WAT 3747 ATOM 64669 O WAT 3748 32.848 132.428 48.638 1.00 0.00 O ATOM 64670 H1 WAT 3748 32.352 131.749 49.095 1.00 0.00 H ATOM 64671 H2 WAT 3748 33.765 132.189 48.778 1.00 0.00 H TER 64673 WAT 3748 ATOM 64673 O WAT 3749 37.033 14.436 81.670 1.00 0.00 O ATOM 64674 H1 WAT 3749 36.939 14.994 80.898 1.00 0.00 H ATOM 64675 H2 WAT 3749 36.600 13.617 81.428 1.00 0.00 H TER 64677 WAT 3749 ATOM 64677 O WAT 3750 124.487 111.669 117.884 1.00 0.00 O ATOM 64678 H1 WAT 3750 125.031 110.890 117.766 1.00 0.00 H ATOM 64679 H2 WAT 3750 123.826 111.606 117.194 1.00 0.00 H TER 64681 WAT 3750 ATOM 64681 O WAT 3751 21.539 118.536 18.737 1.00 0.00 O ATOM 64682 H1 WAT 3751 20.820 118.847 19.289 1.00 0.00 H ATOM 64683 H2 WAT 3751 22.078 118.005 19.323 1.00 0.00 H TER 64685 WAT 3751 ATOM 64685 O WAT 3752 2.862 116.688 85.048 1.00 0.00 O ATOM 64686 H1 WAT 3752 3.092 116.905 84.145 1.00 0.00 H ATOM 64687 H2 WAT 3752 3.622 116.961 85.561 1.00 0.00 H TER 64689 WAT 3752 ATOM 64689 O WAT 3753 64.519 136.505 122.373 1.00 0.00 O ATOM 64690 H1 WAT 3753 63.795 136.543 122.997 1.00 0.00 H ATOM 64691 H2 WAT 3753 64.734 137.422 122.200 1.00 0.00 H TER 64693 WAT 3753 ATOM 64693 O WAT 3754 4.762 46.905 101.108 1.00 0.00 O ATOM 64694 H1 WAT 3754 5.098 46.178 100.583 1.00 0.00 H ATOM 64695 H2 WAT 3754 4.349 47.489 100.471 1.00 0.00 H TER 64697 WAT 3754 ATOM 64697 O WAT 3755 74.032 145.449 85.799 1.00 0.00 O ATOM 64698 H1 WAT 3755 73.664 144.780 85.222 1.00 0.00 H ATOM 64699 H2 WAT 3755 74.218 146.188 85.219 1.00 0.00 H TER 64701 WAT 3755 ATOM 64701 O WAT 3756 133.060 60.514 147.268 1.00 0.00 O ATOM 64702 H1 WAT 3756 132.940 61.362 147.696 1.00 0.00 H ATOM 64703 H2 WAT 3756 133.821 60.638 146.701 1.00 0.00 H TER 64705 WAT 3756 ATOM 64705 O WAT 3757 71.929 32.463 20.752 1.00 0.00 O ATOM 64706 H1 WAT 3757 71.006 32.474 21.006 1.00 0.00 H ATOM 64707 H2 WAT 3757 71.931 32.086 19.872 1.00 0.00 H TER 64709 WAT 3757 ATOM 64709 O WAT 3758 125.202 70.617 79.735 1.00 0.00 O ATOM 64710 H1 WAT 3758 124.452 71.161 79.494 1.00 0.00 H ATOM 64711 H2 WAT 3758 125.804 70.698 78.995 1.00 0.00 H TER 64713 WAT 3758 ATOM 64713 O WAT 3759 8.557 20.748 6.447 1.00 0.00 O ATOM 64714 H1 WAT 3759 8.994 21.588 6.586 1.00 0.00 H ATOM 64715 H2 WAT 3759 7.794 20.960 5.910 1.00 0.00 H TER 64717 WAT 3759 ATOM 64717 O WAT 3760 48.653 108.294 86.229 1.00 0.00 O ATOM 64718 H1 WAT 3760 47.735 108.104 86.421 1.00 0.00 H ATOM 64719 H2 WAT 3760 48.786 109.184 86.556 1.00 0.00 H TER 64721 WAT 3760 ATOM 64721 O WAT 3761 92.539 108.933 5.695 1.00 0.00 O ATOM 64722 H1 WAT 3761 91.797 108.841 6.293 1.00 0.00 H ATOM 64723 H2 WAT 3761 93.067 108.149 5.846 1.00 0.00 H TER 64725 WAT 3761 ATOM 64725 O WAT 3762 70.714 6.612 118.350 1.00 0.00 O ATOM 64726 H1 WAT 3762 70.345 6.536 119.230 1.00 0.00 H ATOM 64727 H2 WAT 3762 71.542 6.135 118.396 1.00 0.00 H TER 64729 WAT 3762 ATOM 64729 O WAT 3763 45.224 14.020 109.700 1.00 0.00 O ATOM 64730 H1 WAT 3763 45.962 13.792 110.265 1.00 0.00 H ATOM 64731 H2 WAT 3763 44.997 13.201 109.261 1.00 0.00 H TER 64733 WAT 3763 ATOM 64733 O WAT 3764 133.098 88.851 72.211 1.00 0.00 O ATOM 64734 H1 WAT 3764 133.495 88.016 72.460 1.00 0.00 H ATOM 64735 H2 WAT 3764 133.696 89.216 71.559 1.00 0.00 H TER 64737 WAT 3764 ATOM 64737 O WAT 3765 68.633 60.058 17.120 1.00 0.00 O ATOM 64738 H1 WAT 3765 68.643 61.015 17.083 1.00 0.00 H ATOM 64739 H2 WAT 3765 69.074 59.846 17.942 1.00 0.00 H TER 64741 WAT 3765 ATOM 64741 O WAT 3766 107.248 143.352 10.460 1.00 0.00 O ATOM 64742 H1 WAT 3766 108.189 143.524 10.462 1.00 0.00 H ATOM 64743 H2 WAT 3766 107.117 142.727 11.173 1.00 0.00 H TER 64745 WAT 3766 ATOM 64745 O WAT 3767 111.981 49.229 137.423 1.00 0.00 O ATOM 64746 H1 WAT 3767 111.982 48.383 136.975 1.00 0.00 H ATOM 64747 H2 WAT 3767 112.812 49.633 137.175 1.00 0.00 H TER 64749 WAT 3767 ATOM 64749 O WAT 3768 35.657 17.171 130.352 1.00 0.00 O ATOM 64750 H1 WAT 3768 36.126 16.862 129.576 1.00 0.00 H ATOM 64751 H2 WAT 3768 34.983 17.756 130.007 1.00 0.00 H TER 64753 WAT 3768 ATOM 64753 O WAT 3769 118.980 107.244 68.758 1.00 0.00 O ATOM 64754 H1 WAT 3769 118.360 107.938 68.533 1.00 0.00 H ATOM 64755 H2 WAT 3769 119.444 107.064 67.940 1.00 0.00 H TER 64757 WAT 3769 ATOM 64757 O WAT 3770 70.135 138.053 148.106 1.00 0.00 O ATOM 64758 H1 WAT 3770 70.377 138.000 147.181 1.00 0.00 H ATOM 64759 H2 WAT 3770 70.971 138.085 148.571 1.00 0.00 H TER 64761 WAT 3770 ATOM 64761 O WAT 3771 68.462 101.962 144.733 1.00 0.00 O ATOM 64762 H1 WAT 3771 68.360 101.755 143.805 1.00 0.00 H ATOM 64763 H2 WAT 3771 69.382 101.775 144.921 1.00 0.00 H TER 64765 WAT 3771 ATOM 64765 O WAT 3772 9.258 60.472 122.399 1.00 0.00 O ATOM 64766 H1 WAT 3772 8.602 60.882 121.836 1.00 0.00 H ATOM 64767 H2 WAT 3772 10.062 60.962 122.227 1.00 0.00 H TER 64769 WAT 3772 ATOM 64769 O WAT 3773 56.439 101.605 18.146 1.00 0.00 O ATOM 64770 H1 WAT 3773 56.679 101.157 18.957 1.00 0.00 H ATOM 64771 H2 WAT 3773 57.223 102.096 17.902 1.00 0.00 H TER 64773 WAT 3773 ATOM 64773 O WAT 3774 29.881 65.404 6.368 1.00 0.00 O ATOM 64774 H1 WAT 3774 29.928 64.461 6.208 1.00 0.00 H ATOM 64775 H2 WAT 3774 30.474 65.786 5.721 1.00 0.00 H TER 64777 WAT 3774 ATOM 64777 O WAT 3775 80.948 40.674 10.581 1.00 0.00 O ATOM 64778 H1 WAT 3775 80.933 40.007 11.267 1.00 0.00 H ATOM 64779 H2 WAT 3775 81.578 41.324 10.892 1.00 0.00 H TER 64781 WAT 3775 ATOM 64781 O WAT 3776 135.229 16.859 65.687 1.00 0.00 O ATOM 64782 H1 WAT 3776 134.801 16.043 65.427 1.00 0.00 H ATOM 64783 H2 WAT 3776 134.690 17.547 65.297 1.00 0.00 H TER 64785 WAT 3776 ATOM 64785 O WAT 3777 89.583 99.676 70.568 1.00 0.00 O ATOM 64786 H1 WAT 3777 88.897 99.048 70.795 1.00 0.00 H ATOM 64787 H2 WAT 3777 89.420 99.887 69.649 1.00 0.00 H TER 64789 WAT 3777 ATOM 64789 O WAT 3778 13.412 132.524 105.337 1.00 0.00 O ATOM 64790 H1 WAT 3778 12.608 132.496 104.819 1.00 0.00 H ATOM 64791 H2 WAT 3778 13.551 133.455 105.513 1.00 0.00 H TER 64793 WAT 3778 ATOM 64793 O WAT 3779 81.469 7.769 129.665 1.00 0.00 O ATOM 64794 H1 WAT 3779 81.914 7.812 130.511 1.00 0.00 H ATOM 64795 H2 WAT 3779 81.082 6.893 129.642 1.00 0.00 H TER 64797 WAT 3779 ATOM 64797 O WAT 3780 53.938 45.569 118.810 1.00 0.00 O ATOM 64798 H1 WAT 3780 54.819 45.940 118.863 1.00 0.00 H ATOM 64799 H2 WAT 3780 53.381 46.213 119.248 1.00 0.00 H TER 64801 WAT 3780 ATOM 64801 O WAT 3781 144.792 30.813 70.546 1.00 0.00 O ATOM 64802 H1 WAT 3781 145.471 30.158 70.384 1.00 0.00 H ATOM 64803 H2 WAT 3781 144.544 30.679 71.461 1.00 0.00 H TER 64805 WAT 3781 ATOM 64805 O WAT 3782 113.915 128.237 82.169 1.00 0.00 O ATOM 64806 H1 WAT 3782 113.264 128.778 82.618 1.00 0.00 H ATOM 64807 H2 WAT 3782 114.233 127.637 82.843 1.00 0.00 H TER 64809 WAT 3782 ATOM 64809 O WAT 3783 33.882 107.827 110.337 1.00 0.00 O ATOM 64810 H1 WAT 3783 34.107 108.618 110.826 1.00 0.00 H ATOM 64811 H2 WAT 3783 33.256 108.124 109.676 1.00 0.00 H TER 64813 WAT 3783 ATOM 64813 O WAT 3784 144.932 37.270 62.731 1.00 0.00 O ATOM 64814 H1 WAT 3784 145.413 37.036 63.525 1.00 0.00 H ATOM 64815 H2 WAT 3784 144.091 37.599 63.049 1.00 0.00 H TER 64817 WAT 3784 ATOM 64817 O WAT 3785 63.316 137.541 64.875 1.00 0.00 O ATOM 64818 H1 WAT 3785 63.647 136.648 64.966 1.00 0.00 H ATOM 64819 H2 WAT 3785 63.920 138.074 65.392 1.00 0.00 H TER 64821 WAT 3785 ATOM 64821 O WAT 3786 121.694 37.181 68.135 1.00 0.00 O ATOM 64822 H1 WAT 3786 121.638 36.770 67.272 1.00 0.00 H ATOM 64823 H2 WAT 3786 122.604 37.470 68.203 1.00 0.00 H TER 64825 WAT 3786 ATOM 64825 O WAT 3787 109.338 58.238 71.396 1.00 0.00 O ATOM 64826 H1 WAT 3787 108.551 58.640 71.027 1.00 0.00 H ATOM 64827 H2 WAT 3787 110.018 58.398 70.741 1.00 0.00 H TER 64829 WAT 3787 ATOM 64829 O WAT 3788 84.493 145.308 117.939 1.00 0.00 O ATOM 64830 H1 WAT 3788 84.152 145.930 117.296 1.00 0.00 H ATOM 64831 H2 WAT 3788 83.928 144.540 117.851 1.00 0.00 H TER 64833 WAT 3788 ATOM 64833 O WAT 3789 108.374 2.331 74.299 1.00 0.00 O ATOM 64834 H1 WAT 3789 108.936 3.104 74.243 1.00 0.00 H ATOM 64835 H2 WAT 3789 107.833 2.371 73.510 1.00 0.00 H TER 64837 WAT 3789 ATOM 64837 O WAT 3790 77.946 91.618 122.050 1.00 0.00 O ATOM 64838 H1 WAT 3790 77.268 91.808 122.699 1.00 0.00 H ATOM 64839 H2 WAT 3790 78.761 91.900 122.466 1.00 0.00 H TER 64841 WAT 3790 ATOM 64841 O WAT 3791 127.258 77.578 26.109 1.00 0.00 O ATOM 64842 H1 WAT 3791 126.585 77.848 26.734 1.00 0.00 H ATOM 64843 H2 WAT 3791 126.850 76.871 25.608 1.00 0.00 H TER 64845 WAT 3791 ATOM 64845 O WAT 3792 106.772 96.421 64.622 1.00 0.00 O ATOM 64846 H1 WAT 3792 106.137 95.723 64.464 1.00 0.00 H ATOM 64847 H2 WAT 3792 106.246 97.158 64.932 1.00 0.00 H TER 64849 WAT 3792 ATOM 64849 O WAT 3793 81.410 143.578 80.251 1.00 0.00 O ATOM 64850 H1 WAT 3793 81.702 144.433 79.935 1.00 0.00 H ATOM 64851 H2 WAT 3793 81.306 143.053 79.457 1.00 0.00 H TER 64853 WAT 3793 ATOM 64853 O WAT 3794 44.494 89.725 8.549 1.00 0.00 O ATOM 64854 H1 WAT 3794 43.995 90.042 7.797 1.00 0.00 H ATOM 64855 H2 WAT 3794 45.053 89.034 8.192 1.00 0.00 H TER 64857 WAT 3794 ATOM 64857 O WAT 3795 47.957 126.201 121.283 1.00 0.00 O ATOM 64858 H1 WAT 3795 47.997 125.919 120.369 1.00 0.00 H ATOM 64859 H2 WAT 3795 48.452 127.020 121.302 1.00 0.00 H TER 64861 WAT 3795 ATOM 64861 O WAT 3796 67.531 134.099 59.582 1.00 0.00 O ATOM 64862 H1 WAT 3796 67.852 134.965 59.833 1.00 0.00 H ATOM 64863 H2 WAT 3796 68.138 133.806 58.903 1.00 0.00 H TER 64865 WAT 3796 ATOM 64865 O WAT 3797 98.747 59.239 13.964 1.00 0.00 O ATOM 64866 H1 WAT 3797 97.876 58.846 13.901 1.00 0.00 H ATOM 64867 H2 WAT 3797 99.195 58.958 13.166 1.00 0.00 H TER 64869 WAT 3797 ATOM 64869 O WAT 3798 143.305 20.821 158.655 1.00 0.00 O ATOM 64870 H1 WAT 3798 143.280 21.561 158.047 1.00 0.00 H ATOM 64871 H2 WAT 3798 142.745 20.159 158.249 1.00 0.00 H TER 64873 WAT 3798 ATOM 64873 O WAT 3799 67.533 48.624 7.211 1.00 0.00 O ATOM 64874 H1 WAT 3799 67.873 47.733 7.291 1.00 0.00 H ATOM 64875 H2 WAT 3799 66.600 48.543 7.410 1.00 0.00 H TER 64877 WAT 3799 ATOM 64877 O WAT 3800 69.685 48.511 83.656 1.00 0.00 O ATOM 64878 H1 WAT 3800 68.943 48.367 83.068 1.00 0.00 H ATOM 64879 H2 WAT 3800 69.298 48.532 84.531 1.00 0.00 H TER 64881 WAT 3800 ATOM 64881 O WAT 3801 144.860 94.559 21.053 1.00 0.00 O ATOM 64882 H1 WAT 3801 144.484 93.679 21.058 1.00 0.00 H ATOM 64883 H2 WAT 3801 145.803 94.415 20.974 1.00 0.00 H TER 64885 WAT 3801 ATOM 64885 O WAT 3802 111.596 55.327 83.018 1.00 0.00 O ATOM 64886 H1 WAT 3802 112.546 55.382 83.120 1.00 0.00 H ATOM 64887 H2 WAT 3802 111.376 54.441 83.306 1.00 0.00 H TER 64889 WAT 3802 ATOM 64889 O WAT 3803 102.570 92.691 146.472 1.00 0.00 O ATOM 64890 H1 WAT 3803 103.125 91.920 146.351 1.00 0.00 H ATOM 64891 H2 WAT 3803 102.939 93.133 147.237 1.00 0.00 H TER 64893 WAT 3803 ATOM 64893 O WAT 3804 20.782 140.882 119.963 1.00 0.00 O ATOM 64894 H1 WAT 3804 21.358 140.150 120.182 1.00 0.00 H ATOM 64895 H2 WAT 3804 20.642 140.803 119.019 1.00 0.00 H TER 64897 WAT 3804 ATOM 64897 O WAT 3805 8.330 86.480 3.891 1.00 0.00 O ATOM 64898 H1 WAT 3805 9.062 87.095 3.846 1.00 0.00 H ATOM 64899 H2 WAT 3805 7.629 86.905 3.397 1.00 0.00 H TER 64901 WAT 3805 ATOM 64901 O WAT 3806 42.735 143.618 148.738 1.00 0.00 O ATOM 64902 H1 WAT 3806 41.778 143.623 148.769 1.00 0.00 H ATOM 64903 H2 WAT 3806 43.002 143.379 149.625 1.00 0.00 H TER 64905 WAT 3806 ATOM 64905 O WAT 3807 64.805 49.867 66.498 1.00 0.00 O ATOM 64906 H1 WAT 3807 64.275 49.526 65.778 1.00 0.00 H ATOM 64907 H2 WAT 3807 64.271 49.720 67.279 1.00 0.00 H TER 64909 WAT 3807 ATOM 64909 O WAT 3808 13.585 26.144 127.753 1.00 0.00 O ATOM 64910 H1 WAT 3808 12.794 26.336 127.249 1.00 0.00 H ATOM 64911 H2 WAT 3808 14.043 26.983 127.809 1.00 0.00 H TER 64913 WAT 3808 ATOM 64913 O WAT 3809 65.020 82.407 107.694 1.00 0.00 O ATOM 64914 H1 WAT 3809 65.856 82.872 107.729 1.00 0.00 H ATOM 64915 H2 WAT 3809 64.561 82.681 108.488 1.00 0.00 H TER 64917 WAT 3809 ATOM 64917 O WAT 3810 101.395 113.524 136.979 1.00 0.00 O ATOM 64918 H1 WAT 3810 101.594 112.801 137.574 1.00 0.00 H ATOM 64919 H2 WAT 3810 100.449 113.646 137.058 1.00 0.00 H TER 64921 WAT 3810 ATOM 64921 O WAT 3811 40.357 88.969 57.130 1.00 0.00 O ATOM 64922 H1 WAT 3811 40.405 88.844 56.183 1.00 0.00 H ATOM 64923 H2 WAT 3811 41.265 88.907 57.427 1.00 0.00 H TER 64925 WAT 3811 ATOM 64925 O WAT 3812 107.766 22.201 137.345 1.00 0.00 O ATOM 64926 H1 WAT 3812 107.571 22.888 136.707 1.00 0.00 H ATOM 64927 H2 WAT 3812 108.138 22.668 138.093 1.00 0.00 H TER 64929 WAT 3812 ATOM 64929 O WAT 3813 130.815 39.414 100.218 1.00 0.00 O ATOM 64930 H1 WAT 3813 130.109 39.988 99.920 1.00 0.00 H ATOM 64931 H2 WAT 3813 131.225 39.892 100.938 1.00 0.00 H TER 64933 WAT 3813 ATOM 64933 O WAT 3814 134.813 85.320 13.685 1.00 0.00 O ATOM 64934 H1 WAT 3814 134.191 84.849 14.240 1.00 0.00 H ATOM 64935 H2 WAT 3814 134.303 85.572 12.915 1.00 0.00 H TER 64937 WAT 3814 ATOM 64937 O WAT 3815 132.885 47.499 113.138 1.00 0.00 O ATOM 64938 H1 WAT 3815 132.605 46.584 113.137 1.00 0.00 H ATOM 64939 H2 WAT 3815 132.076 47.997 113.260 1.00 0.00 H TER 64941 WAT 3815 ATOM 64941 O WAT 3816 31.902 41.491 91.413 1.00 0.00 O ATOM 64942 H1 WAT 3816 32.479 41.742 90.692 1.00 0.00 H ATOM 64943 H2 WAT 3816 31.815 40.541 91.330 1.00 0.00 H TER 64945 WAT 3816 ATOM 64945 O WAT 3817 17.247 27.283 144.524 1.00 0.00 O ATOM 64946 H1 WAT 3817 17.132 28.233 144.544 1.00 0.00 H ATOM 64947 H2 WAT 3817 16.643 26.983 143.844 1.00 0.00 H TER 64949 WAT 3817 ATOM 64949 O WAT 3818 102.341 139.286 71.790 1.00 0.00 O ATOM 64950 H1 WAT 3818 101.412 139.081 71.690 1.00 0.00 H ATOM 64951 H2 WAT 3818 102.784 138.700 71.176 1.00 0.00 H TER 64953 WAT 3818 ATOM 64953 O WAT 3819 142.929 25.683 125.868 1.00 0.00 O ATOM 64954 H1 WAT 3819 143.025 26.069 126.739 1.00 0.00 H ATOM 64955 H2 WAT 3819 143.022 24.742 126.011 1.00 0.00 H TER 64957 WAT 3819 ATOM 64957 O WAT 3820 28.612 103.341 56.778 1.00 0.00 O ATOM 64958 H1 WAT 3820 28.106 102.541 56.633 1.00 0.00 H ATOM 64959 H2 WAT 3820 27.954 104.033 56.836 1.00 0.00 H TER 64961 WAT 3820 ATOM 64961 O WAT 3821 4.457 127.676 113.982 1.00 0.00 O ATOM 64962 H1 WAT 3821 5.135 128.343 113.872 1.00 0.00 H ATOM 64963 H2 WAT 3821 3.707 128.153 114.336 1.00 0.00 H TER 64965 WAT 3821 ATOM 64965 O WAT 3822 88.529 132.471 17.996 1.00 0.00 O ATOM 64966 H1 WAT 3822 88.995 132.337 18.821 1.00 0.00 H ATOM 64967 H2 WAT 3822 88.099 131.633 17.825 1.00 0.00 H TER 64969 WAT 3822 ATOM 64969 O WAT 3823 77.820 107.533 117.174 1.00 0.00 O ATOM 64970 H1 WAT 3823 77.088 107.763 116.602 1.00 0.00 H ATOM 64971 H2 WAT 3823 77.691 108.070 117.956 1.00 0.00 H TER 64973 WAT 3823 ATOM 64973 O WAT 3824 36.697 52.011 143.335 1.00 0.00 O ATOM 64974 H1 WAT 3824 36.104 51.483 142.801 1.00 0.00 H ATOM 64975 H2 WAT 3824 37.571 51.696 143.105 1.00 0.00 H TER 64977 WAT 3824 ATOM 64977 O WAT 3825 75.312 10.707 87.043 1.00 0.00 O ATOM 64978 H1 WAT 3825 74.700 10.805 87.772 1.00 0.00 H ATOM 64979 H2 WAT 3825 75.632 9.807 87.118 1.00 0.00 H TER 64981 WAT 3825 ATOM 64981 O WAT 3826 123.598 51.303 127.314 1.00 0.00 O ATOM 64982 H1 WAT 3826 123.636 51.384 128.267 1.00 0.00 H ATOM 64983 H2 WAT 3826 122.946 50.621 127.156 1.00 0.00 H TER 64985 WAT 3826 ATOM 64985 O WAT 3827 85.187 45.280 21.047 1.00 0.00 O ATOM 64986 H1 WAT 3827 85.478 45.684 21.865 1.00 0.00 H ATOM 64987 H2 WAT 3827 85.476 44.370 21.113 1.00 0.00 H TER 64989 WAT 3827 ATOM 64989 O WAT 3828 103.966 96.515 107.274 1.00 0.00 O ATOM 64990 H1 WAT 3828 104.589 96.110 106.670 1.00 0.00 H ATOM 64991 H2 WAT 3828 103.280 95.857 107.388 1.00 0.00 H TER 64993 WAT 3828 ATOM 64993 O WAT 3829 18.052 36.068 112.705 1.00 0.00 O ATOM 64994 H1 WAT 3829 18.323 36.967 112.519 1.00 0.00 H ATOM 64995 H2 WAT 3829 18.726 35.525 112.294 1.00 0.00 H TER 64997 WAT 3829 ATOM 64997 O WAT 3830 0.523 27.685 16.324 1.00 0.00 O ATOM 64998 H1 WAT 3830 1.259 28.055 15.837 1.00 0.00 H ATOM 64999 H2 WAT 3830 0.130 28.435 16.771 1.00 0.00 H TER 65001 WAT 3830 ATOM 65001 O WAT 3831 10.357 63.716 142.286 1.00 0.00 O ATOM 65002 H1 WAT 3831 9.620 63.187 142.593 1.00 0.00 H ATOM 65003 H2 WAT 3831 11.124 63.162 142.431 1.00 0.00 H TER 65005 WAT 3831 ATOM 65005 O WAT 3832 112.653 127.675 108.333 1.00 0.00 O ATOM 65006 H1 WAT 3832 112.693 128.147 107.501 1.00 0.00 H ATOM 65007 H2 WAT 3832 111.753 127.795 108.634 1.00 0.00 H TER 65009 WAT 3832 ATOM 65009 O WAT 3833 115.095 5.073 92.116 1.00 0.00 O ATOM 65010 H1 WAT 3833 114.951 4.129 92.045 1.00 0.00 H ATOM 65011 H2 WAT 3833 115.392 5.203 93.017 1.00 0.00 H TER 65013 WAT 3833 ATOM 65013 O WAT 3834 49.241 42.345 71.048 1.00 0.00 O ATOM 65014 H1 WAT 3834 48.692 42.913 71.588 1.00 0.00 H ATOM 65015 H2 WAT 3834 48.723 42.193 70.257 1.00 0.00 H TER 65017 WAT 3834 ATOM 65017 O WAT 3835 101.838 84.093 24.987 1.00 0.00 O ATOM 65018 H1 WAT 3835 102.328 84.424 24.234 1.00 0.00 H ATOM 65019 H2 WAT 3835 102.477 84.074 25.699 1.00 0.00 H TER 65021 WAT 3835 ATOM 65021 O WAT 3836 24.208 51.908 127.198 1.00 0.00 O ATOM 65022 H1 WAT 3836 24.456 50.995 127.345 1.00 0.00 H ATOM 65023 H2 WAT 3836 23.408 51.857 126.675 1.00 0.00 H TER 65025 WAT 3836 ATOM 65025 O WAT 3837 28.570 5.448 133.541 1.00 0.00 O ATOM 65026 H1 WAT 3837 29.475 5.195 133.727 1.00 0.00 H ATOM 65027 H2 WAT 3837 28.645 6.287 133.085 1.00 0.00 H TER 65029 WAT 3837 ATOM 65029 O WAT 3838 108.581 50.345 116.752 1.00 0.00 O ATOM 65030 H1 WAT 3838 108.285 51.096 117.267 1.00 0.00 H ATOM 65031 H2 WAT 3838 109.259 49.937 117.291 1.00 0.00 H TER 65033 WAT 3838 ATOM 65033 O WAT 3839 9.910 82.145 93.466 1.00 0.00 O ATOM 65034 H1 WAT 3839 9.643 81.580 92.740 1.00 0.00 H ATOM 65035 H2 WAT 3839 9.848 83.033 93.113 1.00 0.00 H TER 65037 WAT 3839 ATOM 65037 O WAT 3840 45.568 107.243 139.526 1.00 0.00 O ATOM 65038 H1 WAT 3840 45.067 106.680 140.116 1.00 0.00 H ATOM 65039 H2 WAT 3840 45.050 108.045 139.461 1.00 0.00 H TER 65041 WAT 3840 ATOM 65041 O WAT 3841 97.028 138.126 113.315 1.00 0.00 O ATOM 65042 H1 WAT 3841 96.836 138.282 114.240 1.00 0.00 H ATOM 65043 H2 WAT 3841 96.193 138.272 112.869 1.00 0.00 H TER 65045 WAT 3841 ATOM 65045 O WAT 3842 122.739 116.569 100.453 1.00 0.00 O ATOM 65046 H1 WAT 3842 123.582 116.377 100.044 1.00 0.00 H ATOM 65047 H2 WAT 3842 122.956 116.777 101.362 1.00 0.00 H TER 65049 WAT 3842 ATOM 65049 O WAT 3843 138.770 101.060 68.572 1.00 0.00 O ATOM 65050 H1 WAT 3843 138.102 101.355 67.954 1.00 0.00 H ATOM 65051 H2 WAT 3843 139.312 100.453 68.068 1.00 0.00 H TER 65053 WAT 3843 ATOM 65053 O WAT 3844 145.119 52.009 151.656 1.00 0.00 O ATOM 65054 H1 WAT 3844 144.984 51.750 152.568 1.00 0.00 H ATOM 65055 H2 WAT 3844 145.871 51.491 151.369 1.00 0.00 H TER 65057 WAT 3844 ATOM 65057 O WAT 3845 126.712 92.043 89.427 1.00 0.00 O ATOM 65058 H1 WAT 3845 126.001 92.683 89.387 1.00 0.00 H ATOM 65059 H2 WAT 3845 126.283 91.223 89.672 1.00 0.00 H TER 65061 WAT 3845 ATOM 65061 O WAT 3846 125.563 82.703 70.784 1.00 0.00 O ATOM 65062 H1 WAT 3846 125.786 81.843 71.142 1.00 0.00 H ATOM 65063 H2 WAT 3846 126.143 82.805 70.029 1.00 0.00 H TER 65065 WAT 3846 ATOM 65065 O WAT 3847 136.845 108.226 11.702 1.00 0.00 O ATOM 65066 H1 WAT 3847 137.059 107.768 10.889 1.00 0.00 H ATOM 65067 H2 WAT 3847 135.929 108.485 11.597 1.00 0.00 H TER 65069 WAT 3847 ATOM 65069 O WAT 3848 59.169 30.701 64.613 1.00 0.00 O ATOM 65070 H1 WAT 3848 58.560 29.963 64.578 1.00 0.00 H ATOM 65071 H2 WAT 3848 59.365 30.805 65.544 1.00 0.00 H TER 65073 WAT 3848 ATOM 65073 O WAT 3849 109.747 111.325 90.749 1.00 0.00 O ATOM 65074 H1 WAT 3849 108.903 111.515 91.159 1.00 0.00 H ATOM 65075 H2 WAT 3849 109.568 111.351 89.809 1.00 0.00 H TER 65077 WAT 3849 ATOM 65077 O WAT 3850 22.614 60.589 141.137 1.00 0.00 O ATOM 65078 H1 WAT 3850 23.523 60.553 141.434 1.00 0.00 H ATOM 65079 H2 WAT 3850 22.194 59.842 141.563 1.00 0.00 H TER 65081 WAT 3850 ATOM 65081 O WAT 3851 88.362 121.992 9.921 1.00 0.00 O ATOM 65082 H1 WAT 3851 87.896 122.810 10.094 1.00 0.00 H ATOM 65083 H2 WAT 3851 88.695 121.721 10.776 1.00 0.00 H TER 65085 WAT 3851 ATOM 65085 O WAT 3852 58.443 128.302 57.953 1.00 0.00 O ATOM 65086 H1 WAT 3852 58.603 128.675 57.087 1.00 0.00 H ATOM 65087 H2 WAT 3852 58.879 127.450 57.932 1.00 0.00 H TER 65089 WAT 3852 ATOM 65089 O WAT 3853 66.685 72.312 109.450 1.00 0.00 O ATOM 65090 H1 WAT 3853 66.286 73.165 109.279 1.00 0.00 H ATOM 65091 H2 WAT 3853 66.035 71.843 109.973 1.00 0.00 H TER 65093 WAT 3853 ATOM 65093 O WAT 3854 10.650 43.681 146.401 1.00 0.00 O ATOM 65094 H1 WAT 3854 11.317 44.329 146.173 1.00 0.00 H ATOM 65095 H2 WAT 3854 10.460 43.848 147.324 1.00 0.00 H TER 65097 WAT 3854 ATOM 65097 O WAT 3855 34.976 102.611 148.605 1.00 0.00 O ATOM 65098 H1 WAT 3855 35.599 103.272 148.301 1.00 0.00 H ATOM 65099 H2 WAT 3855 35.505 102.006 149.126 1.00 0.00 H TER 65101 WAT 3855 ATOM 65101 O WAT 3856 42.475 37.355 97.418 1.00 0.00 O ATOM 65102 H1 WAT 3856 41.593 37.209 97.076 1.00 0.00 H ATOM 65103 H2 WAT 3856 42.495 36.869 98.243 1.00 0.00 H TER 65105 WAT 3856 ATOM 65105 O WAT 3857 108.573 135.507 84.907 1.00 0.00 O ATOM 65106 H1 WAT 3857 108.228 136.400 84.927 1.00 0.00 H ATOM 65107 H2 WAT 3857 109.514 135.611 85.048 1.00 0.00 H TER 65109 WAT 3857 ATOM 65109 O WAT 3858 123.687 38.989 72.358 1.00 0.00 O ATOM 65110 H1 WAT 3858 123.457 39.910 72.486 1.00 0.00 H ATOM 65111 H2 WAT 3858 123.444 38.565 73.181 1.00 0.00 H TER 65113 WAT 3858 ATOM 65113 O WAT 3859 12.246 91.741 145.203 1.00 0.00 O ATOM 65114 H1 WAT 3859 12.348 92.189 146.043 1.00 0.00 H ATOM 65115 H2 WAT 3859 11.303 91.752 145.039 1.00 0.00 H TER 65117 WAT 3859 ATOM 65117 O WAT 3860 84.830 26.308 106.373 1.00 0.00 O ATOM 65118 H1 WAT 3860 85.250 26.458 107.220 1.00 0.00 H ATOM 65119 H2 WAT 3860 84.233 25.576 106.528 1.00 0.00 H TER 65121 WAT 3860 ATOM 65121 O WAT 3861 91.160 99.734 21.522 1.00 0.00 O ATOM 65122 H1 WAT 3861 91.776 100.242 20.993 1.00 0.00 H ATOM 65123 H2 WAT 3861 91.273 100.072 22.411 1.00 0.00 H TER 65125 WAT 3861 ATOM 65125 O WAT 3862 99.080 105.051 63.710 1.00 0.00 O ATOM 65126 H1 WAT 3862 98.779 105.851 64.141 1.00 0.00 H ATOM 65127 H2 WAT 3862 99.614 104.609 64.370 1.00 0.00 H TER 65129 WAT 3862 ATOM 65129 O WAT 3863 9.167 143.351 148.191 1.00 0.00 O ATOM 65130 H1 WAT 3863 9.517 144.113 148.653 1.00 0.00 H ATOM 65131 H2 WAT 3863 9.453 143.468 147.285 1.00 0.00 H TER 65133 WAT 3863 ATOM 65133 O WAT 3864 72.024 133.013 10.008 1.00 0.00 O ATOM 65134 H1 WAT 3864 71.634 132.221 10.378 1.00 0.00 H ATOM 65135 H2 WAT 3864 72.133 133.599 10.758 1.00 0.00 H TER 65137 WAT 3864 ATOM 65137 O WAT 3865 87.290 62.735 146.646 1.00 0.00 O ATOM 65138 H1 WAT 3865 87.495 63.033 147.532 1.00 0.00 H ATOM 65139 H2 WAT 3865 86.941 63.510 146.207 1.00 0.00 H TER 65141 WAT 3865 ATOM 65141 O WAT 3866 38.998 49.017 85.975 1.00 0.00 O ATOM 65142 H1 WAT 3866 39.240 49.255 86.870 1.00 0.00 H ATOM 65143 H2 WAT 3866 38.927 48.063 85.992 1.00 0.00 H TER 65145 WAT 3866 ATOM 65145 O WAT 3867 66.861 97.006 88.323 1.00 0.00 O ATOM 65146 H1 WAT 3867 67.396 97.510 88.936 1.00 0.00 H ATOM 65147 H2 WAT 3867 66.191 96.597 88.870 1.00 0.00 H TER 65149 WAT 3867 ATOM 65149 O WAT 3868 130.216 63.673 106.330 1.00 0.00 O ATOM 65150 H1 WAT 3868 131.136 63.674 106.596 1.00 0.00 H ATOM 65151 H2 WAT 3868 130.152 62.957 105.697 1.00 0.00 H TER 65153 WAT 3868 ATOM 65153 O WAT 3869 52.654 86.897 75.241 1.00 0.00 O ATOM 65154 H1 WAT 3869 52.924 87.703 75.680 1.00 0.00 H ATOM 65155 H2 WAT 3869 52.636 87.124 74.312 1.00 0.00 H TER 65157 WAT 3869 ATOM 65157 O WAT 3870 122.121 50.428 13.058 1.00 0.00 O ATOM 65158 H1 WAT 3870 122.162 49.515 13.343 1.00 0.00 H ATOM 65159 H2 WAT 3870 121.226 50.701 13.259 1.00 0.00 H TER 65161 WAT 3870 ATOM 65161 O WAT 3871 47.572 114.534 94.580 1.00 0.00 O ATOM 65162 H1 WAT 3871 48.521 114.406 94.593 1.00 0.00 H ATOM 65163 H2 WAT 3871 47.266 114.143 95.398 1.00 0.00 H TER 65165 WAT 3871 ATOM 65165 O WAT 3872 105.450 33.454 16.105 1.00 0.00 O ATOM 65166 H1 WAT 3872 106.405 33.504 16.047 1.00 0.00 H ATOM 65167 H2 WAT 3872 105.271 33.377 17.042 1.00 0.00 H TER 65169 WAT 3872 ATOM 65169 O WAT 3873 114.492 20.071 93.341 1.00 0.00 O ATOM 65170 H1 WAT 3873 114.083 20.298 94.177 1.00 0.00 H ATOM 65171 H2 WAT 3873 114.354 19.128 93.255 1.00 0.00 H TER 65173 WAT 3873 ATOM 65173 O WAT 3874 58.559 93.675 104.225 1.00 0.00 O ATOM 65174 H1 WAT 3874 59.074 94.481 104.191 1.00 0.00 H ATOM 65175 H2 WAT 3874 57.654 93.973 104.312 1.00 0.00 H TER 65177 WAT 3874 ATOM 65177 O WAT 3875 138.394 87.796 68.450 1.00 0.00 O ATOM 65178 H1 WAT 3875 139.335 87.631 68.514 1.00 0.00 H ATOM 65179 H2 WAT 3875 138.281 88.205 67.592 1.00 0.00 H TER 65181 WAT 3875 ATOM 65181 O WAT 3876 139.977 142.955 14.318 1.00 0.00 O ATOM 65182 H1 WAT 3876 139.413 142.290 14.713 1.00 0.00 H ATOM 65183 H2 WAT 3876 140.012 142.719 13.391 1.00 0.00 H TER 65185 WAT 3876 ATOM 65185 O WAT 3877 43.390 104.813 134.644 1.00 0.00 O ATOM 65186 H1 WAT 3877 43.874 104.878 135.467 1.00 0.00 H ATOM 65187 H2 WAT 3877 43.741 105.521 134.103 1.00 0.00 H TER 65189 WAT 3877 ATOM 65189 O WAT 3878 70.353 13.963 116.076 1.00 0.00 O ATOM 65190 H1 WAT 3878 70.190 14.905 116.036 1.00 0.00 H ATOM 65191 H2 WAT 3878 69.481 13.569 116.076 1.00 0.00 H TER 65193 WAT 3878 ATOM 65193 O WAT 3879 77.667 34.503 14.377 1.00 0.00 O ATOM 65194 H1 WAT 3879 77.147 33.842 13.921 1.00 0.00 H ATOM 65195 H2 WAT 3879 77.949 35.104 13.688 1.00 0.00 H TER 65197 WAT 3879 ATOM 65197 O WAT 3880 92.357 90.641 8.155 1.00 0.00 O ATOM 65198 H1 WAT 3880 92.650 90.426 7.270 1.00 0.00 H ATOM 65199 H2 WAT 3880 92.361 91.598 8.183 1.00 0.00 H TER 65201 WAT 3880 ATOM 65201 O WAT 3881 47.010 60.134 111.189 1.00 0.00 O ATOM 65202 H1 WAT 3881 46.219 59.620 111.350 1.00 0.00 H ATOM 65203 H2 WAT 3881 46.687 60.977 110.870 1.00 0.00 H TER 65205 WAT 3881 ATOM 65205 O WAT 3882 125.335 7.808 59.861 1.00 0.00 O ATOM 65206 H1 WAT 3882 125.653 6.909 59.949 1.00 0.00 H ATOM 65207 H2 WAT 3882 125.780 8.143 59.082 1.00 0.00 H TER 65209 WAT 3882 ATOM 65209 O WAT 3883 140.129 33.470 145.342 1.00 0.00 O ATOM 65210 H1 WAT 3883 139.862 33.193 146.219 1.00 0.00 H ATOM 65211 H2 WAT 3883 140.005 32.693 144.797 1.00 0.00 H TER 65213 WAT 3883 ATOM 65213 O WAT 3884 32.449 137.208 51.545 1.00 0.00 O ATOM 65214 H1 WAT 3884 32.132 136.329 51.338 1.00 0.00 H ATOM 65215 H2 WAT 3884 32.217 137.733 50.779 1.00 0.00 H TER 65217 WAT 3884 ATOM 65217 O WAT 3885 99.922 44.293 72.941 1.00 0.00 O ATOM 65218 H1 WAT 3885 98.984 44.107 72.994 1.00 0.00 H ATOM 65219 H2 WAT 3885 100.049 44.637 72.057 1.00 0.00 H TER 65221 WAT 3885 ATOM 65221 O WAT 3886 83.313 16.186 98.029 1.00 0.00 O ATOM 65222 H1 WAT 3886 83.094 15.518 97.379 1.00 0.00 H ATOM 65223 H2 WAT 3886 83.557 15.689 98.810 1.00 0.00 H TER 65225 WAT 3886 ATOM 65225 O WAT 3887 134.962 7.198 90.062 1.00 0.00 O ATOM 65226 H1 WAT 3887 135.148 6.605 89.335 1.00 0.00 H ATOM 65227 H2 WAT 3887 135.367 8.026 89.807 1.00 0.00 H TER 65229 WAT 3887 ATOM 65229 O WAT 3888 52.496 70.265 5.029 1.00 0.00 O ATOM 65230 H1 WAT 3888 52.132 70.783 4.311 1.00 0.00 H ATOM 65231 H2 WAT 3888 51.736 69.840 5.427 1.00 0.00 H TER 65233 WAT 3888 ATOM 65233 O WAT 3889 64.739 47.633 7.905 1.00 0.00 O ATOM 65234 H1 WAT 3889 65.175 47.873 8.723 1.00 0.00 H ATOM 65235 H2 WAT 3889 64.264 48.422 7.647 1.00 0.00 H TER 65237 WAT 3889 ATOM 65237 O WAT 3890 95.774 131.905 112.982 1.00 0.00 O ATOM 65238 H1 WAT 3890 95.219 132.683 112.932 1.00 0.00 H ATOM 65239 H2 WAT 3890 95.291 131.235 112.497 1.00 0.00 H TER 65241 WAT 3890 ATOM 65241 O WAT 3891 36.328 23.583 118.311 1.00 0.00 O ATOM 65242 H1 WAT 3891 37.241 23.476 118.579 1.00 0.00 H ATOM 65243 H2 WAT 3891 36.358 23.585 117.354 1.00 0.00 H TER 65245 WAT 3891 ATOM 65245 O WAT 3892 108.663 75.071 107.704 1.00 0.00 O ATOM 65246 H1 WAT 3892 109.134 75.575 107.040 1.00 0.00 H ATOM 65247 H2 WAT 3892 107.740 75.170 107.469 1.00 0.00 H TER 65249 WAT 3892 ATOM 65249 O WAT 3893 22.972 113.937 137.549 1.00 0.00 O ATOM 65250 H1 WAT 3893 22.239 114.059 136.945 1.00 0.00 H ATOM 65251 H2 WAT 3893 23.531 113.291 137.119 1.00 0.00 H TER 65253 WAT 3893 ATOM 65253 O WAT 3894 142.554 91.900 122.917 1.00 0.00 O ATOM 65254 H1 WAT 3894 141.864 91.315 122.604 1.00 0.00 H ATOM 65255 H2 WAT 3894 142.752 92.461 122.167 1.00 0.00 H TER 65257 WAT 3894 ATOM 65257 O WAT 3895 16.780 38.012 81.710 1.00 0.00 O ATOM 65258 H1 WAT 3895 16.575 38.078 82.643 1.00 0.00 H ATOM 65259 H2 WAT 3895 16.470 37.143 81.458 1.00 0.00 H TER 65261 WAT 3895 ATOM 65261 O WAT 3896 17.101 124.866 96.368 1.00 0.00 O ATOM 65262 H1 WAT 3896 16.560 125.203 97.082 1.00 0.00 H ATOM 65263 H2 WAT 3896 16.493 124.371 95.820 1.00 0.00 H TER 65265 WAT 3896 ATOM 65265 O WAT 3897 108.191 72.256 142.392 1.00 0.00 O ATOM 65266 H1 WAT 3897 108.989 72.778 142.306 1.00 0.00 H ATOM 65267 H2 WAT 3897 108.485 71.433 142.782 1.00 0.00 H TER 65269 WAT 3897 ATOM 65269 O WAT 3898 72.636 49.046 118.222 1.00 0.00 O ATOM 65270 H1 WAT 3898 72.805 48.492 117.460 1.00 0.00 H ATOM 65271 H2 WAT 3898 73.371 48.876 118.810 1.00 0.00 H TER 65273 WAT 3898 ATOM 65273 O WAT 3899 74.193 76.992 93.699 1.00 0.00 O ATOM 65274 H1 WAT 3899 73.480 77.624 93.791 1.00 0.00 H ATOM 65275 H2 WAT 3899 74.978 77.478 93.954 1.00 0.00 H TER 65277 WAT 3899 ATOM 65277 O WAT 3900 117.717 39.851 12.271 1.00 0.00 O ATOM 65278 H1 WAT 3900 116.785 39.666 12.153 1.00 0.00 H ATOM 65279 H2 WAT 3900 117.906 40.542 11.637 1.00 0.00 H TER 65281 WAT 3900 ATOM 65281 O WAT 3901 50.458 28.774 94.578 1.00 0.00 O ATOM 65282 H1 WAT 3901 50.404 28.647 93.631 1.00 0.00 H ATOM 65283 H2 WAT 3901 51.066 28.098 94.877 1.00 0.00 H TER 65285 WAT 3901 ATOM 65285 O WAT 3902 72.776 139.602 78.117 1.00 0.00 O ATOM 65286 H1 WAT 3902 72.528 140.460 78.461 1.00 0.00 H ATOM 65287 H2 WAT 3902 72.346 139.553 77.263 1.00 0.00 H TER 65289 WAT 3902 ATOM 65289 O WAT 3903 4.866 8.437 2.226 1.00 0.00 O ATOM 65290 H1 WAT 3903 4.085 8.757 2.679 1.00 0.00 H ATOM 65291 H2 WAT 3903 5.491 8.253 2.927 1.00 0.00 H TER 65293 WAT 3903 ATOM 65293 O WAT 3904 124.275 108.228 101.170 1.00 0.00 O ATOM 65294 H1 WAT 3904 124.203 107.769 100.333 1.00 0.00 H ATOM 65295 H2 WAT 3904 123.387 108.536 101.351 1.00 0.00 H TER 65297 WAT 3904 ATOM 65297 O WAT 3905 141.905 136.390 130.127 1.00 0.00 O ATOM 65298 H1 WAT 3905 142.304 137.237 129.925 1.00 0.00 H ATOM 65299 H2 WAT 3905 142.079 136.260 131.060 1.00 0.00 H TER 65301 WAT 3905 ATOM 65301 O WAT 3906 93.565 80.387 116.766 1.00 0.00 O ATOM 65302 H1 WAT 3906 93.835 79.787 117.461 1.00 0.00 H ATOM 65303 H2 WAT 3906 92.620 80.485 116.888 1.00 0.00 H TER 65305 WAT 3906 ATOM 65305 O WAT 3907 33.046 119.802 77.839 1.00 0.00 O ATOM 65306 H1 WAT 3907 33.898 120.146 78.109 1.00 0.00 H ATOM 65307 H2 WAT 3907 32.421 120.478 78.099 1.00 0.00 H TER 65309 WAT 3907 ATOM 65309 O WAT 3908 144.177 86.959 11.647 1.00 0.00 O ATOM 65310 H1 WAT 3908 143.836 86.093 11.420 1.00 0.00 H ATOM 65311 H2 WAT 3908 143.833 87.537 10.966 1.00 0.00 H TER 65313 WAT 3908 ATOM 65313 O WAT 3909 2.969 19.097 6.235 1.00 0.00 O ATOM 65314 H1 WAT 3909 2.330 18.606 6.752 1.00 0.00 H ATOM 65315 H2 WAT 3909 3.188 18.513 5.508 1.00 0.00 H TER 65317 WAT 3909 ATOM 65317 O WAT 3910 92.204 41.449 23.934 1.00 0.00 O ATOM 65318 H1 WAT 3910 92.859 40.883 24.344 1.00 0.00 H ATOM 65319 H2 WAT 3910 92.396 42.323 24.275 1.00 0.00 H TER 65321 WAT 3910 ATOM 65321 O WAT 3911 124.459 100.420 83.390 1.00 0.00 O ATOM 65322 H1 WAT 3911 124.154 99.753 82.775 1.00 0.00 H ATOM 65323 H2 WAT 3911 124.910 99.927 84.075 1.00 0.00 H TER 65325 WAT 3911 ATOM 65325 O WAT 3912 74.714 102.417 73.075 1.00 0.00 O ATOM 65326 H1 WAT 3912 74.877 101.504 73.311 1.00 0.00 H ATOM 65327 H2 WAT 3912 74.580 102.399 72.127 1.00 0.00 H TER 65329 WAT 3912 ATOM 65329 O WAT 3913 52.392 71.220 77.663 1.00 0.00 O ATOM 65330 H1 WAT 3913 52.027 71.790 76.986 1.00 0.00 H ATOM 65331 H2 WAT 3913 51.717 70.558 77.808 1.00 0.00 H TER 65333 WAT 3913 ATOM 65333 O WAT 3914 136.516 17.462 121.413 1.00 0.00 O ATOM 65334 H1 WAT 3914 136.534 17.510 120.457 1.00 0.00 H ATOM 65335 H2 WAT 3914 137.436 17.387 121.666 1.00 0.00 H TER 65337 WAT 3914 ATOM 65337 O WAT 3915 125.332 101.642 134.232 1.00 0.00 O ATOM 65338 H1 WAT 3915 125.798 102.447 134.007 1.00 0.00 H ATOM 65339 H2 WAT 3915 125.846 100.946 133.823 1.00 0.00 H TER 65341 WAT 3915 ATOM 65341 O WAT 3916 65.124 16.404 156.907 1.00 0.00 O ATOM 65342 H1 WAT 3916 64.611 15.615 157.082 1.00 0.00 H ATOM 65343 H2 WAT 3916 65.518 16.626 157.751 1.00 0.00 H TER 65345 WAT 3916 ATOM 65345 O WAT 3917 107.659 126.929 85.586 1.00 0.00 O ATOM 65346 H1 WAT 3917 108.219 126.871 84.812 1.00 0.00 H ATOM 65347 H2 WAT 3917 106.837 126.517 85.319 1.00 0.00 H TER 65349 WAT 3917 ATOM 65349 O WAT 3918 106.683 100.518 157.934 1.00 0.00 O ATOM 65350 H1 WAT 3918 106.517 99.592 158.109 1.00 0.00 H ATOM 65351 H2 WAT 3918 105.844 100.948 158.098 1.00 0.00 H TER 65353 WAT 3918 ATOM 65353 O WAT 3919 129.520 48.423 105.791 1.00 0.00 O ATOM 65354 H1 WAT 3919 129.204 47.905 105.051 1.00 0.00 H ATOM 65355 H2 WAT 3919 130.237 47.905 106.157 1.00 0.00 H TER 65357 WAT 3919 ATOM 65357 O WAT 3920 116.387 65.894 15.399 1.00 0.00 O ATOM 65358 H1 WAT 3920 115.849 66.357 14.757 1.00 0.00 H ATOM 65359 H2 WAT 3920 117.277 66.209 15.237 1.00 0.00 H TER 65361 WAT 3920 ATOM 65361 O WAT 3921 140.990 98.409 5.885 1.00 0.00 O ATOM 65362 H1 WAT 3921 141.132 97.463 5.919 1.00 0.00 H ATOM 65363 H2 WAT 3921 140.228 98.557 6.444 1.00 0.00 H TER 65365 WAT 3921 ATOM 65365 O WAT 3922 20.302 29.921 26.327 1.00 0.00 O ATOM 65366 H1 WAT 3922 19.460 29.466 26.334 1.00 0.00 H ATOM 65367 H2 WAT 3922 20.278 30.481 27.104 1.00 0.00 H TER 65369 WAT 3922 ATOM 65369 O WAT 3923 114.415 121.819 78.154 1.00 0.00 O ATOM 65370 H1 WAT 3923 114.561 122.745 78.348 1.00 0.00 H ATOM 65371 H2 WAT 3923 113.496 121.771 77.892 1.00 0.00 H TER 65373 WAT 3923 ATOM 65373 O WAT 3924 14.887 14.924 93.998 1.00 0.00 O ATOM 65374 H1 WAT 3924 14.549 15.220 94.843 1.00 0.00 H ATOM 65375 H2 WAT 3924 14.162 15.061 93.389 1.00 0.00 H TER 65377 WAT 3924 ATOM 65377 O WAT 3925 0.555 32.617 69.209 1.00 0.00 O ATOM 65378 H1 WAT 3925 -0.001 33.343 68.926 1.00 0.00 H ATOM 65379 H2 WAT 3925 -0.043 32.017 69.655 1.00 0.00 H TER 65381 WAT 3925 ATOM 65381 O WAT 3926 118.903 24.156 69.360 1.00 0.00 O ATOM 65382 H1 WAT 3926 118.461 23.979 68.529 1.00 0.00 H ATOM 65383 H2 WAT 3926 118.252 23.939 70.028 1.00 0.00 H TER 65385 WAT 3926 ATOM 65385 O WAT 3927 10.279 6.038 90.413 1.00 0.00 O ATOM 65386 H1 WAT 3927 10.237 5.258 90.967 1.00 0.00 H ATOM 65387 H2 WAT 3927 9.404 6.108 90.031 1.00 0.00 H TER 65389 WAT 3927 ATOM 65389 O WAT 3928 43.906 38.972 126.428 1.00 0.00 O ATOM 65390 H1 WAT 3928 44.062 39.566 127.162 1.00 0.00 H ATOM 65391 H2 WAT 3928 44.782 38.738 126.119 1.00 0.00 H TER 65393 WAT 3928 ATOM 65393 O WAT 3929 65.556 24.196 59.457 1.00 0.00 O ATOM 65394 H1 WAT 3929 65.248 25.101 59.419 1.00 0.00 H ATOM 65395 H2 WAT 3929 65.937 24.036 58.594 1.00 0.00 H TER 65397 WAT 3929 ATOM 65397 O WAT 3930 141.524 96.727 65.720 1.00 0.00 O ATOM 65398 H1 WAT 3930 142.416 96.504 65.986 1.00 0.00 H ATOM 65399 H2 WAT 3930 141.629 97.164 64.874 1.00 0.00 H TER 65401 WAT 3930 ATOM 65401 O WAT 3931 39.938 31.343 71.891 1.00 0.00 O ATOM 65402 H1 WAT 3931 40.792 31.187 71.488 1.00 0.00 H ATOM 65403 H2 WAT 3931 39.777 32.277 71.756 1.00 0.00 H TER 65405 WAT 3931 ATOM 65405 O WAT 3932 68.385 37.468 60.786 1.00 0.00 O ATOM 65406 H1 WAT 3932 67.917 36.837 60.238 1.00 0.00 H ATOM 65407 H2 WAT 3932 69.103 37.777 60.235 1.00 0.00 H TER 65409 WAT 3932 ATOM 65409 O WAT 3933 51.522 86.839 103.416 1.00 0.00 O ATOM 65410 H1 WAT 3933 52.441 87.037 103.232 1.00 0.00 H ATOM 65411 H2 WAT 3933 51.048 87.622 103.136 1.00 0.00 H TER 65413 WAT 3933 ATOM 65413 O WAT 3934 137.036 67.707 16.915 1.00 0.00 O ATOM 65414 H1 WAT 3934 137.038 67.372 17.812 1.00 0.00 H ATOM 65415 H2 WAT 3934 136.595 68.554 16.977 1.00 0.00 H TER 65417 WAT 3934 ATOM 65417 O WAT 3935 118.778 19.503 104.788 1.00 0.00 O ATOM 65418 H1 WAT 3935 118.547 18.671 104.374 1.00 0.00 H ATOM 65419 H2 WAT 3935 119.354 19.933 104.156 1.00 0.00 H TER 65421 WAT 3935 ATOM 65421 O WAT 3936 25.556 99.599 137.683 1.00 0.00 O ATOM 65422 H1 WAT 3936 25.067 100.208 137.130 1.00 0.00 H ATOM 65423 H2 WAT 3936 26.143 99.144 137.078 1.00 0.00 H TER 65425 WAT 3936 ATOM 65425 O WAT 3937 140.965 95.027 158.836 1.00 0.00 O ATOM 65426 H1 WAT 3937 140.133 95.316 159.210 1.00 0.00 H ATOM 65427 H2 WAT 3937 140.930 95.313 157.923 1.00 0.00 H TER 65429 WAT 3937 ATOM 65429 O WAT 3938 8.250 11.720 107.828 1.00 0.00 O ATOM 65430 H1 WAT 3938 7.707 11.131 108.353 1.00 0.00 H ATOM 65431 H2 WAT 3938 8.682 11.146 107.195 1.00 0.00 H TER 65433 WAT 3938 ATOM 65433 O WAT 3939 46.090 102.050 127.498 1.00 0.00 O ATOM 65434 H1 WAT 3939 47.002 102.264 127.694 1.00 0.00 H ATOM 65435 H2 WAT 3939 46.125 101.174 127.115 1.00 0.00 H TER 65437 WAT 3939 ATOM 65437 O WAT 3940 104.508 127.888 87.691 1.00 0.00 O ATOM 65438 H1 WAT 3940 104.361 127.894 88.637 1.00 0.00 H ATOM 65439 H2 WAT 3940 105.116 128.611 87.538 1.00 0.00 H TER 65441 WAT 3940 ATOM 65441 O WAT 3941 89.947 105.515 97.728 1.00 0.00 O ATOM 65442 H1 WAT 3941 89.244 105.059 98.190 1.00 0.00 H ATOM 65443 H2 WAT 3941 90.597 105.700 98.405 1.00 0.00 H TER 65445 WAT 3941 ATOM 65445 O WAT 3942 117.389 15.052 75.246 1.00 0.00 O ATOM 65446 H1 WAT 3942 117.596 15.397 74.378 1.00 0.00 H ATOM 65447 H2 WAT 3942 117.788 14.182 75.260 1.00 0.00 H TER 65449 WAT 3942 ATOM 65449 O WAT 3943 70.771 68.090 147.869 1.00 0.00 O ATOM 65450 H1 WAT 3943 71.327 68.094 147.090 1.00 0.00 H ATOM 65451 H2 WAT 3943 70.383 68.965 147.891 1.00 0.00 H TER 65453 WAT 3943 ATOM 65453 O WAT 3944 137.833 80.374 31.531 1.00 0.00 O ATOM 65454 H1 WAT 3944 138.560 79.790 31.751 1.00 0.00 H ATOM 65455 H2 WAT 3944 137.283 79.859 30.941 1.00 0.00 H TER 65457 WAT 3944 ATOM 65457 O WAT 3945 72.536 142.692 87.958 1.00 0.00 O ATOM 65458 H1 WAT 3945 72.077 141.928 87.608 1.00 0.00 H ATOM 65459 H2 WAT 3945 71.946 143.425 87.787 1.00 0.00 H TER 65461 WAT 3945 ATOM 65461 O WAT 3946 81.081 95.072 1.429 1.00 0.00 O ATOM 65462 H1 WAT 3946 80.609 95.901 1.507 1.00 0.00 H ATOM 65463 H2 WAT 3946 81.734 95.101 2.127 1.00 0.00 H TER 65465 WAT 3946 ATOM 65465 O WAT 3947 37.221 19.131 122.640 1.00 0.00 O ATOM 65466 H1 WAT 3947 36.497 18.813 122.100 1.00 0.00 H ATOM 65467 H2 WAT 3947 37.287 20.062 122.426 1.00 0.00 H TER 65469 WAT 3947 ATOM 65469 O WAT 3948 117.965 95.624 107.813 1.00 0.00 O ATOM 65470 H1 WAT 3948 117.551 94.903 108.287 1.00 0.00 H ATOM 65471 H2 WAT 3948 118.148 96.279 108.485 1.00 0.00 H TER 65473 WAT 3948 ATOM 65473 O WAT 3949 141.702 77.939 150.323 1.00 0.00 O ATOM 65474 H1 WAT 3949 141.287 78.802 150.319 1.00 0.00 H ATOM 65475 H2 WAT 3949 142.603 78.104 150.045 1.00 0.00 H TER 65477 WAT 3949 ATOM 65477 O WAT 3950 66.366 42.151 109.044 1.00 0.00 O ATOM 65478 H1 WAT 3950 66.003 41.643 108.318 1.00 0.00 H ATOM 65479 H2 WAT 3950 65.719 42.065 109.744 1.00 0.00 H TER 65481 WAT 3950 ATOM 65481 O WAT 3951 35.011 34.891 148.514 1.00 0.00 O ATOM 65482 H1 WAT 3951 34.198 34.398 148.399 1.00 0.00 H ATOM 65483 H2 WAT 3951 35.655 34.233 148.778 1.00 0.00 H TER 65485 WAT 3951 ATOM 65485 O WAT 3952 1.058 66.007 14.207 1.00 0.00 O ATOM 65486 H1 WAT 3952 1.755 66.244 14.819 1.00 0.00 H ATOM 65487 H2 WAT 3952 1.215 66.560 13.441 1.00 0.00 H TER 65489 WAT 3952 ATOM 65489 O WAT 3953 85.155 111.795 99.115 1.00 0.00 O ATOM 65490 H1 WAT 3953 86.022 111.930 98.734 1.00 0.00 H ATOM 65491 H2 WAT 3953 85.073 112.486 99.773 1.00 0.00 H TER 65493 WAT 3953 ATOM 65493 O WAT 3954 34.857 129.954 121.694 1.00 0.00 O ATOM 65494 H1 WAT 3954 34.393 130.764 121.906 1.00 0.00 H ATOM 65495 H2 WAT 3954 34.183 129.381 121.328 1.00 0.00 H TER 65497 WAT 3954 ATOM 65497 O WAT 3955 4.402 61.636 141.551 1.00 0.00 O ATOM 65498 H1 WAT 3955 4.280 61.295 140.665 1.00 0.00 H ATOM 65499 H2 WAT 3955 5.280 62.016 141.543 1.00 0.00 H TER 65501 WAT 3955 ATOM 65501 O WAT 3956 127.514 121.532 105.633 1.00 0.00 O ATOM 65502 H1 WAT 3956 127.921 122.368 105.859 1.00 0.00 H ATOM 65503 H2 WAT 3956 126.835 121.409 106.296 1.00 0.00 H TER 65505 WAT 3956 ATOM 65505 O WAT 3957 109.026 1.386 142.365 1.00 0.00 O ATOM 65506 H1 WAT 3957 108.809 0.961 141.536 1.00 0.00 H ATOM 65507 H2 WAT 3957 108.201 1.398 142.851 1.00 0.00 H TER 65509 WAT 3957 ATOM 65509 O WAT 3958 136.874 87.074 12.307 1.00 0.00 O ATOM 65510 H1 WAT 3958 136.320 87.808 12.575 1.00 0.00 H ATOM 65511 H2 WAT 3958 137.118 86.646 13.128 1.00 0.00 H TER 65513 WAT 3958 ATOM 65513 O WAT 3959 26.841 30.482 108.229 1.00 0.00 O ATOM 65514 H1 WAT 3959 26.969 31.057 107.474 1.00 0.00 H ATOM 65515 H2 WAT 3959 26.915 31.061 108.987 1.00 0.00 H TER 65517 WAT 3959 ATOM 65517 O WAT 3960 56.824 43.489 137.458 1.00 0.00 O ATOM 65518 H1 WAT 3960 56.363 42.654 137.535 1.00 0.00 H ATOM 65519 H2 WAT 3960 57.002 43.579 136.521 1.00 0.00 H TER 65521 WAT 3960 ATOM 65521 O WAT 3961 50.671 113.046 145.806 1.00 0.00 O ATOM 65522 H1 WAT 3961 49.730 113.206 145.881 1.00 0.00 H ATOM 65523 H2 WAT 3961 50.841 113.052 144.865 1.00 0.00 H TER 65525 WAT 3961 ATOM 65525 O WAT 3962 20.300 85.894 86.053 1.00 0.00 O ATOM 65526 H1 WAT 3962 20.424 85.018 86.418 1.00 0.00 H ATOM 65527 H2 WAT 3962 19.908 86.397 86.767 1.00 0.00 H TER 65529 WAT 3962 ATOM 65529 O WAT 3963 117.630 1.520 3.450 1.00 0.00 O ATOM 65530 H1 WAT 3963 118.319 1.745 4.074 1.00 0.00 H ATOM 65531 H2 WAT 3963 117.937 0.714 3.035 1.00 0.00 H TER 65533 WAT 3963 ATOM 65533 O WAT 3964 106.931 133.850 65.759 1.00 0.00 O ATOM 65534 H1 WAT 3964 107.745 134.298 65.529 1.00 0.00 H ATOM 65535 H2 WAT 3964 106.247 134.353 65.317 1.00 0.00 H TER 65537 WAT 3964 ATOM 65537 O WAT 3965 69.327 43.542 130.655 1.00 0.00 O ATOM 65538 H1 WAT 3965 69.963 43.786 129.982 1.00 0.00 H ATOM 65539 H2 WAT 3965 69.526 44.119 131.392 1.00 0.00 H TER 65541 WAT 3965 ATOM 65541 O WAT 3966 8.675 136.664 53.761 1.00 0.00 O ATOM 65542 H1 WAT 3966 7.785 136.993 53.635 1.00 0.00 H ATOM 65543 H2 WAT 3966 8.587 135.983 54.428 1.00 0.00 H TER 65545 WAT 3966 ATOM 65545 O WAT 3967 25.413 115.538 66.383 1.00 0.00 O ATOM 65546 H1 WAT 3967 26.245 115.070 66.457 1.00 0.00 H ATOM 65547 H2 WAT 3967 24.945 115.086 65.681 1.00 0.00 H TER 65549 WAT 3967 ATOM 65549 O WAT 3968 39.382 52.353 70.645 1.00 0.00 O ATOM 65550 H1 WAT 3968 39.479 53.149 71.166 1.00 0.00 H ATOM 65551 H2 WAT 3968 38.772 51.811 71.146 1.00 0.00 H TER 65553 WAT 3968 ATOM 65553 O WAT 3969 43.392 144.007 151.846 1.00 0.00 O ATOM 65554 H1 WAT 3969 42.840 144.766 151.659 1.00 0.00 H ATOM 65555 H2 WAT 3969 44.279 144.300 151.638 1.00 0.00 H TER 65557 WAT 3969 ATOM 65557 O WAT 3970 103.323 63.189 99.708 1.00 0.00 O ATOM 65558 H1 WAT 3970 102.409 62.962 99.883 1.00 0.00 H ATOM 65559 H2 WAT 3970 103.428 64.063 100.083 1.00 0.00 H TER 65561 WAT 3970 ATOM 65561 O WAT 3971 74.202 145.571 139.142 1.00 0.00 O ATOM 65562 H1 WAT 3971 73.387 145.854 139.557 1.00 0.00 H ATOM 65563 H2 WAT 3971 74.821 145.481 139.867 1.00 0.00 H TER 65565 WAT 3971 ATOM 65565 O WAT 3972 74.714 7.964 69.803 1.00 0.00 O ATOM 65566 H1 WAT 3972 74.721 7.399 69.031 1.00 0.00 H ATOM 65567 H2 WAT 3972 74.799 8.851 69.451 1.00 0.00 H TER 65569 WAT 3972 ATOM 65569 O WAT 3973 10.535 3.158 105.867 1.00 0.00 O ATOM 65570 H1 WAT 3973 10.383 3.452 106.765 1.00 0.00 H ATOM 65571 H2 WAT 3973 9.758 3.445 105.386 1.00 0.00 H TER 65573 WAT 3973 ATOM 65573 O WAT 3974 119.299 143.265 90.547 1.00 0.00 O ATOM 65574 H1 WAT 3974 119.767 143.953 91.021 1.00 0.00 H ATOM 65575 H2 WAT 3974 119.023 142.651 91.227 1.00 0.00 H TER 65577 WAT 3974 ATOM 65577 O WAT 3975 11.088 129.111 144.416 1.00 0.00 O ATOM 65578 H1 WAT 3975 10.280 129.487 144.067 1.00 0.00 H ATOM 65579 H2 WAT 3975 10.826 128.707 145.243 1.00 0.00 H TER 65581 WAT 3975 ATOM 65581 O WAT 3976 142.207 81.054 80.165 1.00 0.00 O ATOM 65582 H1 WAT 3976 142.690 80.534 80.807 1.00 0.00 H ATOM 65583 H2 WAT 3976 142.820 81.741 79.904 1.00 0.00 H TER 65585 WAT 3976 ATOM 65585 O WAT 3977 121.273 51.407 5.828 1.00 0.00 O ATOM 65586 H1 WAT 3977 121.149 50.566 5.390 1.00 0.00 H ATOM 65587 H2 WAT 3977 120.668 51.383 6.569 1.00 0.00 H TER 65589 WAT 3977 ATOM 65589 O WAT 3978 20.506 118.566 97.215 1.00 0.00 O ATOM 65590 H1 WAT 3978 21.030 117.766 97.257 1.00 0.00 H ATOM 65591 H2 WAT 3978 19.940 118.522 97.986 1.00 0.00 H TER 65593 WAT 3978 ATOM 65593 O WAT 3979 105.258 71.345 128.791 1.00 0.00 O ATOM 65594 H1 WAT 3979 104.727 71.479 128.006 1.00 0.00 H ATOM 65595 H2 WAT 3979 104.703 71.647 129.510 1.00 0.00 H TER 65597 WAT 3979 ATOM 65597 O WAT 3980 46.192 25.967 77.618 1.00 0.00 O ATOM 65598 H1 WAT 3980 45.452 25.819 77.030 1.00 0.00 H ATOM 65599 H2 WAT 3980 46.187 26.910 77.778 1.00 0.00 H TER 65601 WAT 3980 ATOM 65601 O WAT 3981 136.434 87.455 113.159 1.00 0.00 O ATOM 65602 H1 WAT 3981 136.393 88.244 112.618 1.00 0.00 H ATOM 65603 H2 WAT 3981 135.518 87.238 113.335 1.00 0.00 H TER 65605 WAT 3981 ATOM 65605 O WAT 3982 86.605 48.322 111.334 1.00 0.00 O ATOM 65606 H1 WAT 3982 85.825 48.346 111.890 1.00 0.00 H ATOM 65607 H2 WAT 3982 87.087 47.550 111.630 1.00 0.00 H TER 65609 WAT 3982 ATOM 65609 O WAT 3983 51.655 130.245 64.462 1.00 0.00 O ATOM 65610 H1 WAT 3983 51.132 129.563 64.883 1.00 0.00 H ATOM 65611 H2 WAT 3983 52.130 129.788 63.768 1.00 0.00 H TER 65613 WAT 3983 ATOM 65613 O WAT 3984 24.961 42.310 95.578 1.00 0.00 O ATOM 65614 H1 WAT 3984 24.525 43.137 95.783 1.00 0.00 H ATOM 65615 H2 WAT 3984 24.670 41.709 96.265 1.00 0.00 H TER 65617 WAT 3984 ATOM 65617 O WAT 3985 118.667 131.653 61.945 1.00 0.00 O ATOM 65618 H1 WAT 3985 117.909 131.909 61.420 1.00 0.00 H ATOM 65619 H2 WAT 3985 118.922 130.799 61.597 1.00 0.00 H TER 65621 WAT 3985 ATOM 65621 O WAT 3986 126.610 118.141 75.007 1.00 0.00 O ATOM 65622 H1 WAT 3986 126.186 118.140 74.149 1.00 0.00 H ATOM 65623 H2 WAT 3986 126.980 117.262 75.092 1.00 0.00 H TER 65625 WAT 3986 ATOM 65625 O WAT 3987 9.457 13.290 110.239 1.00 0.00 O ATOM 65626 H1 WAT 3987 8.610 13.511 109.850 1.00 0.00 H ATOM 65627 H2 WAT 3987 9.702 12.463 109.824 1.00 0.00 H TER 65629 WAT 3987 ATOM 65629 O WAT 3988 27.352 103.833 27.688 1.00 0.00 O ATOM 65630 H1 WAT 3988 27.046 103.827 28.595 1.00 0.00 H ATOM 65631 H2 WAT 3988 28.193 104.287 27.721 1.00 0.00 H TER 65633 WAT 3988 ATOM 65633 O WAT 3989 114.582 2.158 91.416 1.00 0.00 O ATOM 65634 H1 WAT 3989 114.626 1.360 91.942 1.00 0.00 H ATOM 65635 H2 WAT 3989 115.153 1.985 90.668 1.00 0.00 H TER 65637 WAT 3989 ATOM 65637 O WAT 3990 7.009 118.163 71.574 1.00 0.00 O ATOM 65638 H1 WAT 3990 7.594 117.810 70.904 1.00 0.00 H ATOM 65639 H2 WAT 3990 6.276 117.548 71.600 1.00 0.00 H TER 65641 WAT 3990 ATOM 65641 O WAT 3991 39.968 0.380 134.585 1.00 0.00 O ATOM 65642 H1 WAT 3991 39.071 0.350 134.918 1.00 0.00 H ATOM 65643 H2 WAT 3991 40.487 0.700 135.323 1.00 0.00 H TER 65645 WAT 3991 ATOM 65645 O WAT 3992 75.559 80.640 70.388 1.00 0.00 O ATOM 65646 H1 WAT 3992 75.019 81.305 69.963 1.00 0.00 H ATOM 65647 H2 WAT 3992 75.582 80.902 71.309 1.00 0.00 H TER 65649 WAT 3992 ATOM 65649 O WAT 3993 100.838 79.636 154.548 1.00 0.00 O ATOM 65650 H1 WAT 3993 100.011 80.019 154.255 1.00 0.00 H ATOM 65651 H2 WAT 3993 101.303 79.424 153.739 1.00 0.00 H TER 65653 WAT 3993 ATOM 65653 O WAT 3994 101.975 108.106 5.994 1.00 0.00 O ATOM 65654 H1 WAT 3994 101.990 108.844 6.603 1.00 0.00 H ATOM 65655 H2 WAT 3994 102.116 107.337 6.547 1.00 0.00 H TER 65657 WAT 3994 ATOM 65657 O WAT 3995 106.099 33.994 152.308 1.00 0.00 O ATOM 65658 H1 WAT 3995 106.260 33.113 152.644 1.00 0.00 H ATOM 65659 H2 WAT 3995 105.219 33.949 151.933 1.00 0.00 H TER 65661 WAT 3995 ATOM 65661 O WAT 3996 138.261 39.776 111.023 1.00 0.00 O ATOM 65662 H1 WAT 3996 138.688 39.480 111.826 1.00 0.00 H ATOM 65663 H2 WAT 3996 138.093 38.973 110.531 1.00 0.00 H TER 65665 WAT 3996 ATOM 65665 O WAT 3997 33.845 129.770 158.653 1.00 0.00 O ATOM 65666 H1 WAT 3997 33.989 130.317 157.881 1.00 0.00 H ATOM 65667 H2 WAT 3997 33.277 129.064 158.343 1.00 0.00 H TER 65669 WAT 3997 ATOM 65669 O WAT 3998 22.873 89.794 75.473 1.00 0.00 O ATOM 65670 H1 WAT 3998 23.815 89.914 75.600 1.00 0.00 H ATOM 65671 H2 WAT 3998 22.788 88.901 75.139 1.00 0.00 H TER 65673 WAT 3998 ATOM 65673 O WAT 3999 87.072 72.839 92.167 1.00 0.00 O ATOM 65674 H1 WAT 3999 86.116 72.871 92.213 1.00 0.00 H ATOM 65675 H2 WAT 3999 87.307 72.040 92.639 1.00 0.00 H TER 65677 WAT 3999 ATOM 65677 O WAT 4000 119.460 31.530 63.580 1.00 0.00 O ATOM 65678 H1 WAT 4000 119.607 31.786 64.491 1.00 0.00 H ATOM 65679 H2 WAT 4000 118.653 31.981 63.332 1.00 0.00 H TER 65681 WAT 4000 ATOM 65681 O WAT 4001 74.881 24.423 111.375 1.00 0.00 O ATOM 65682 H1 WAT 4001 75.614 23.990 110.937 1.00 0.00 H ATOM 65683 H2 WAT 4001 75.069 25.358 111.288 1.00 0.00 H TER 65685 WAT 4001 ATOM 65685 O WAT 4002 68.873 19.812 5.689 1.00 0.00 O ATOM 65686 H1 WAT 4002 67.971 19.746 5.376 1.00 0.00 H ATOM 65687 H2 WAT 4002 68.955 20.715 5.996 1.00 0.00 H TER 65689 WAT 4002 ATOM 65689 O WAT 4003 89.624 29.181 87.116 1.00 0.00 O ATOM 65690 H1 WAT 4003 90.457 29.594 87.344 1.00 0.00 H ATOM 65691 H2 WAT 4003 89.705 28.980 86.184 1.00 0.00 H TER 65693 WAT 4003 ATOM 65693 O WAT 4004 22.474 81.613 66.879 1.00 0.00 O ATOM 65694 H1 WAT 4004 22.571 80.795 66.392 1.00 0.00 H ATOM 65695 H2 WAT 4004 23.349 81.788 67.227 1.00 0.00 H TER 65697 WAT 4004 ATOM 65697 O WAT 4005 107.216 2.912 61.327 1.00 0.00 O ATOM 65698 H1 WAT 4005 107.532 3.409 60.572 1.00 0.00 H ATOM 65699 H2 WAT 4005 107.622 2.051 61.234 1.00 0.00 H TER 65701 WAT 4005 ATOM 65701 O WAT 4006 107.118 105.579 104.701 1.00 0.00 O ATOM 65702 H1 WAT 4006 108.019 105.727 104.990 1.00 0.00 H ATOM 65703 H2 WAT 4006 107.093 104.652 104.464 1.00 0.00 H TER 65705 WAT 4006 ATOM 65705 O WAT 4007 22.983 21.796 135.496 1.00 0.00 O ATOM 65706 H1 WAT 4007 22.062 21.602 135.318 1.00 0.00 H ATOM 65707 H2 WAT 4007 23.138 22.635 135.062 1.00 0.00 H TER 65709 WAT 4007 ATOM 65709 O WAT 4008 124.107 87.734 153.351 1.00 0.00 O ATOM 65710 H1 WAT 4008 123.436 87.107 153.621 1.00 0.00 H ATOM 65711 H2 WAT 4008 124.902 87.209 153.257 1.00 0.00 H TER 65713 WAT 4008 ATOM 65713 O WAT 4009 55.225 7.884 97.878 1.00 0.00 O ATOM 65714 H1 WAT 4009 55.315 7.033 98.307 1.00 0.00 H ATOM 65715 H2 WAT 4009 54.280 8.013 97.797 1.00 0.00 H TER 65717 WAT 4009 ATOM 65717 O WAT 4010 63.054 75.963 14.277 1.00 0.00 O ATOM 65718 H1 WAT 4010 62.458 75.738 14.991 1.00 0.00 H ATOM 65719 H2 WAT 4010 63.647 75.214 14.215 1.00 0.00 H TER 65721 WAT 4010 ATOM 65721 O WAT 4011 58.169 35.220 98.734 1.00 0.00 O ATOM 65722 H1 WAT 4011 59.003 35.287 99.199 1.00 0.00 H ATOM 65723 H2 WAT 4011 58.407 34.918 97.858 1.00 0.00 H TER 65725 WAT 4011 ATOM 65725 O WAT 4012 128.164 86.913 93.592 1.00 0.00 O ATOM 65726 H1 WAT 4012 127.483 86.758 94.246 1.00 0.00 H ATOM 65727 H2 WAT 4012 128.035 87.822 93.322 1.00 0.00 H TER 65729 WAT 4012 ATOM 65729 O WAT 4013 52.681 78.832 70.626 1.00 0.00 O ATOM 65730 H1 WAT 4013 52.891 79.191 71.488 1.00 0.00 H ATOM 65731 H2 WAT 4013 52.036 78.148 70.801 1.00 0.00 H TER 65733 WAT 4013 ATOM 65733 O WAT 4014 9.373 120.930 9.731 1.00 0.00 O ATOM 65734 H1 WAT 4014 8.572 121.093 10.231 1.00 0.00 H ATOM 65735 H2 WAT 4014 9.141 121.151 8.829 1.00 0.00 H TER 65737 WAT 4014 ATOM 65737 O WAT 4015 47.611 37.175 68.226 1.00 0.00 O ATOM 65738 H1 WAT 4015 48.107 36.436 67.874 1.00 0.00 H ATOM 65739 H2 WAT 4015 47.011 36.781 68.859 1.00 0.00 H TER 65741 WAT 4015 ATOM 65741 O WAT 4016 0.865 94.729 11.612 1.00 0.00 O ATOM 65742 H1 WAT 4016 1.606 94.253 11.987 1.00 0.00 H ATOM 65743 H2 WAT 4016 0.272 94.044 11.303 1.00 0.00 H TER 65745 WAT 4016 ATOM 65745 O WAT 4017 77.961 111.084 15.191 1.00 0.00 O ATOM 65746 H1 WAT 4017 78.720 110.640 14.814 1.00 0.00 H ATOM 65747 H2 WAT 4017 78.177 111.182 16.119 1.00 0.00 H TER 65749 WAT 4017 ATOM 65749 O WAT 4018 82.546 114.406 81.489 1.00 0.00 O ATOM 65750 H1 WAT 4018 82.319 115.279 81.168 1.00 0.00 H ATOM 65751 H2 WAT 4018 83.390 114.523 81.924 1.00 0.00 H TER 65753 WAT 4018 ATOM 65753 O WAT 4019 98.322 119.992 92.479 1.00 0.00 O ATOM 65754 H1 WAT 4019 98.113 120.854 92.119 1.00 0.00 H ATOM 65755 H2 WAT 4019 98.572 119.469 91.717 1.00 0.00 H TER 65757 WAT 4019 ATOM 65757 O WAT 4020 42.461 81.738 144.250 1.00 0.00 O ATOM 65758 H1 WAT 4020 42.301 82.501 144.805 1.00 0.00 H ATOM 65759 H2 WAT 4020 41.612 81.300 144.193 1.00 0.00 H TER 65761 WAT 4020 ATOM 65761 O WAT 4021 13.281 91.070 60.075 1.00 0.00 O ATOM 65762 H1 WAT 4021 12.905 90.613 59.322 1.00 0.00 H ATOM 65763 H2 WAT 4021 12.571 91.624 60.398 1.00 0.00 H TER 65765 WAT 4021 ATOM 65765 O WAT 4022 45.550 108.512 156.044 1.00 0.00 O ATOM 65766 H1 WAT 4022 45.030 107.900 156.566 1.00 0.00 H ATOM 65767 H2 WAT 4022 44.907 109.117 155.674 1.00 0.00 H TER 65769 WAT 4022 ATOM 65769 O WAT 4023 20.474 45.808 70.060 1.00 0.00 O ATOM 65770 H1 WAT 4023 20.628 46.611 69.562 1.00 0.00 H ATOM 65771 H2 WAT 4023 19.956 46.091 70.815 1.00 0.00 H TER 65773 WAT 4023 ATOM 65773 O WAT 4024 66.975 136.788 0.951 1.00 0.00 O ATOM 65774 H1 WAT 4024 66.310 136.205 1.317 1.00 0.00 H ATOM 65775 H2 WAT 4024 67.798 136.311 1.059 1.00 0.00 H TER 65777 WAT 4024 ATOM 65777 O WAT 4025 82.720 52.447 106.317 1.00 0.00 O ATOM 65778 H1 WAT 4025 82.062 52.359 105.627 1.00 0.00 H ATOM 65779 H2 WAT 4025 82.707 53.377 106.542 1.00 0.00 H TER 65781 WAT 4025 ATOM 65781 O WAT 4026 124.647 40.839 101.715 1.00 0.00 O ATOM 65782 H1 WAT 4026 124.817 41.717 101.374 1.00 0.00 H ATOM 65783 H2 WAT 4026 124.769 40.261 100.961 1.00 0.00 H TER 65785 WAT 4026 ATOM 65785 O WAT 4027 63.727 1.088 144.114 1.00 0.00 O ATOM 65786 H1 WAT 4027 63.662 1.795 144.756 1.00 0.00 H ATOM 65787 H2 WAT 4027 63.809 1.536 143.272 1.00 0.00 H TER 65789 WAT 4027 ATOM 65789 O WAT 4028 71.972 14.317 98.131 1.00 0.00 O ATOM 65790 H1 WAT 4028 72.621 14.573 97.475 1.00 0.00 H ATOM 65791 H2 WAT 4028 71.621 13.486 97.809 1.00 0.00 H TER 65793 WAT 4028 ATOM 65793 O WAT 4029 73.133 125.633 116.743 1.00 0.00 O ATOM 65794 H1 WAT 4029 72.946 124.777 116.357 1.00 0.00 H ATOM 65795 H2 WAT 4029 73.026 125.499 117.685 1.00 0.00 H TER 65797 WAT 4029 ATOM 65797 O WAT 4030 43.399 67.553 156.353 1.00 0.00 O ATOM 65798 H1 WAT 4030 43.046 67.375 155.482 1.00 0.00 H ATOM 65799 H2 WAT 4030 42.870 68.280 156.682 1.00 0.00 H TER 65801 WAT 4030 ATOM 65801 O WAT 4031 27.087 127.929 107.585 1.00 0.00 O ATOM 65802 H1 WAT 4031 26.806 128.764 107.209 1.00 0.00 H ATOM 65803 H2 WAT 4031 27.513 127.471 106.861 1.00 0.00 H TER 65805 WAT 4031 ATOM 65805 O WAT 4032 107.129 5.799 112.259 1.00 0.00 O ATOM 65806 H1 WAT 4032 107.569 6.532 111.830 1.00 0.00 H ATOM 65807 H2 WAT 4032 107.442 5.025 111.792 1.00 0.00 H TER 65809 WAT 4032 ATOM 65809 O WAT 4033 29.119 143.968 115.403 1.00 0.00 O ATOM 65810 H1 WAT 4033 28.892 144.564 116.117 1.00 0.00 H ATOM 65811 H2 WAT 4033 28.561 144.243 114.675 1.00 0.00 H TER 65813 WAT 4033 ATOM 65813 O WAT 4034 90.611 110.242 89.440 1.00 0.00 O ATOM 65814 H1 WAT 4034 91.521 110.434 89.665 1.00 0.00 H ATOM 65815 H2 WAT 4034 90.362 110.941 88.834 1.00 0.00 H TER 65817 WAT 4034 ATOM 65817 O WAT 4035 85.186 99.346 23.612 1.00 0.00 O ATOM 65818 H1 WAT 4035 84.797 100.220 23.580 1.00 0.00 H ATOM 65819 H2 WAT 4035 85.193 99.121 24.542 1.00 0.00 H TER 65821 WAT 4035 ATOM 65821 O WAT 4036 46.087 113.868 19.626 1.00 0.00 O ATOM 65822 H1 WAT 4036 45.315 113.399 19.943 1.00 0.00 H ATOM 65823 H2 WAT 4036 46.093 113.709 18.683 1.00 0.00 H TER 65825 WAT 4036 ATOM 65825 O WAT 4037 26.014 20.952 120.343 1.00 0.00 O ATOM 65826 H1 WAT 4037 26.602 21.171 119.620 1.00 0.00 H ATOM 65827 H2 WAT 4037 25.258 20.544 119.922 1.00 0.00 H TER 65829 WAT 4037 ATOM 65829 O WAT 4038 47.279 12.855 106.258 1.00 0.00 O ATOM 65830 H1 WAT 4038 46.392 12.956 105.912 1.00 0.00 H ATOM 65831 H2 WAT 4038 47.672 13.722 106.164 1.00 0.00 H TER 65833 WAT 4038 ATOM 65833 O WAT 4039 17.189 58.061 11.101 1.00 0.00 O ATOM 65834 H1 WAT 4039 16.947 57.619 10.287 1.00 0.00 H ATOM 65835 H2 WAT 4039 16.678 57.615 11.777 1.00 0.00 H TER 65837 WAT 4039 ATOM 65837 O WAT 4040 123.680 140.941 61.367 1.00 0.00 O ATOM 65838 H1 WAT 4040 123.203 140.248 60.911 1.00 0.00 H ATOM 65839 H2 WAT 4040 124.119 140.494 62.091 1.00 0.00 H TER 65841 WAT 4040 ATOM 65841 O WAT 4041 66.001 5.511 99.872 1.00 0.00 O ATOM 65842 H1 WAT 4041 65.658 5.130 100.680 1.00 0.00 H ATOM 65843 H2 WAT 4041 65.772 6.439 99.929 1.00 0.00 H TER 65845 WAT 4041 ATOM 65845 O WAT 4042 35.059 5.478 68.725 1.00 0.00 O ATOM 65846 H1 WAT 4042 34.695 4.659 69.060 1.00 0.00 H ATOM 65847 H2 WAT 4042 34.580 5.640 67.912 1.00 0.00 H TER 65849 WAT 4042 ATOM 65849 O WAT 4043 69.262 127.378 105.083 1.00 0.00 O ATOM 65850 H1 WAT 4043 68.799 128.208 104.972 1.00 0.00 H ATOM 65851 H2 WAT 4043 69.965 127.577 105.702 1.00 0.00 H TER 65853 WAT 4043 ATOM 65853 O WAT 4044 51.467 90.175 23.170 1.00 0.00 O ATOM 65854 H1 WAT 4044 51.442 89.546 23.892 1.00 0.00 H ATOM 65855 H2 WAT 4044 52.307 90.623 23.272 1.00 0.00 H TER 65857 WAT 4044 ATOM 65857 O WAT 4045 9.912 135.152 112.929 1.00 0.00 O ATOM 65858 H1 WAT 4045 9.308 134.837 112.257 1.00 0.00 H ATOM 65859 H2 WAT 4045 10.355 135.897 112.523 1.00 0.00 H TER 65861 WAT 4045 ATOM 65861 O WAT 4046 31.370 136.750 100.657 1.00 0.00 O ATOM 65862 H1 WAT 4046 30.724 137.455 100.609 1.00 0.00 H ATOM 65863 H2 WAT 4046 32.016 136.972 99.986 1.00 0.00 H TER 65865 WAT 4046 ATOM 65865 O WAT 4047 59.483 34.680 83.046 1.00 0.00 O ATOM 65866 H1 WAT 4047 59.199 33.916 82.544 1.00 0.00 H ATOM 65867 H2 WAT 4047 58.714 35.250 83.070 1.00 0.00 H TER 65869 WAT 4047 ATOM 65869 O WAT 4048 14.327 61.507 89.508 1.00 0.00 O ATOM 65870 H1 WAT 4048 14.991 61.536 90.196 1.00 0.00 H ATOM 65871 H2 WAT 4048 13.526 61.240 89.959 1.00 0.00 H TER 65873 WAT 4048 ATOM 65873 O WAT 4049 113.201 114.456 1.033 1.00 0.00 O ATOM 65874 H1 WAT 4049 112.470 114.142 1.564 1.00 0.00 H ATOM 65875 H2 WAT 4049 113.581 113.663 0.654 1.00 0.00 H TER 65877 WAT 4049 ATOM 65877 O WAT 4050 33.734 58.794 121.379 1.00 0.00 O ATOM 65878 H1 WAT 4050 32.819 59.062 121.466 1.00 0.00 H ATOM 65879 H2 WAT 4050 34.018 59.176 120.549 1.00 0.00 H TER 65881 WAT 4050 ATOM 65881 O WAT 4051 138.902 85.479 101.053 1.00 0.00 O ATOM 65882 H1 WAT 4051 139.197 85.125 100.214 1.00 0.00 H ATOM 65883 H2 WAT 4051 138.443 84.750 101.471 1.00 0.00 H TER 65885 WAT 4051 ATOM 65885 O WAT 4052 115.973 25.734 132.865 1.00 0.00 O ATOM 65886 H1 WAT 4052 115.272 26.336 132.616 1.00 0.00 H ATOM 65887 H2 WAT 4052 116.143 25.932 133.785 1.00 0.00 H TER 65889 WAT 4052 ATOM 65889 O WAT 4053 84.744 21.301 71.639 1.00 0.00 O ATOM 65890 H1 WAT 4053 84.336 21.613 70.831 1.00 0.00 H ATOM 65891 H2 WAT 4053 84.102 20.696 72.012 1.00 0.00 H TER 65893 WAT 4053 ATOM 65893 O WAT 4054 21.460 136.838 113.606 1.00 0.00 O ATOM 65894 H1 WAT 4054 21.794 136.197 112.979 1.00 0.00 H ATOM 65895 H2 WAT 4054 20.891 136.332 114.186 1.00 0.00 H TER 65897 WAT 4054 ATOM 65897 O WAT 4055 84.719 33.104 78.968 1.00 0.00 O ATOM 65898 H1 WAT 4055 84.892 32.368 78.381 1.00 0.00 H ATOM 65899 H2 WAT 4055 83.869 33.442 78.685 1.00 0.00 H TER 65901 WAT 4055 ATOM 65901 O WAT 4056 67.058 116.279 69.351 1.00 0.00 O ATOM 65902 H1 WAT 4056 66.784 116.364 68.438 1.00 0.00 H ATOM 65903 H2 WAT 4056 67.972 116.000 69.302 1.00 0.00 H TER 65905 WAT 4056 ATOM 65905 O WAT 4057 106.980 26.979 14.798 1.00 0.00 O ATOM 65906 H1 WAT 4057 107.819 26.638 15.108 1.00 0.00 H ATOM 65907 H2 WAT 4057 106.325 26.434 15.233 1.00 0.00 H TER 65909 WAT 4057 ATOM 65909 O WAT 4058 121.200 32.298 150.653 1.00 0.00 O ATOM 65910 H1 WAT 4058 121.098 32.173 149.710 1.00 0.00 H ATOM 65911 H2 WAT 4058 121.051 31.430 151.027 1.00 0.00 H TER 65913 WAT 4058 ATOM 65913 O WAT 4059 100.814 17.887 95.932 1.00 0.00 O ATOM 65914 H1 WAT 4059 101.540 18.511 95.907 1.00 0.00 H ATOM 65915 H2 WAT 4059 101.236 17.030 95.991 1.00 0.00 H TER 65917 WAT 4059 ATOM 65917 O WAT 4060 107.802 139.794 5.339 1.00 0.00 O ATOM 65918 H1 WAT 4060 108.614 139.886 5.837 1.00 0.00 H ATOM 65919 H2 WAT 4060 107.173 139.441 5.967 1.00 0.00 H TER 65921 WAT 4060 ATOM 65921 O WAT 4061 104.548 107.366 121.552 1.00 0.00 O ATOM 65922 H1 WAT 4061 105.402 107.522 121.147 1.00 0.00 H ATOM 65923 H2 WAT 4061 103.953 107.237 120.813 1.00 0.00 H TER 65925 WAT 4061 ATOM 65925 O WAT 4062 115.974 97.623 128.299 1.00 0.00 O ATOM 65926 H1 WAT 4062 116.723 97.339 128.822 1.00 0.00 H ATOM 65927 H2 WAT 4062 115.293 96.977 128.486 1.00 0.00 H TER 65929 WAT 4062 ATOM 65929 O WAT 4063 21.893 99.917 144.414 1.00 0.00 O ATOM 65930 H1 WAT 4063 21.474 100.635 144.888 1.00 0.00 H ATOM 65931 H2 WAT 4063 22.393 100.348 143.721 1.00 0.00 H TER 65933 WAT 4063 ATOM 65933 O WAT 4064 133.183 52.926 128.071 1.00 0.00 O ATOM 65934 H1 WAT 4064 132.755 53.046 127.223 1.00 0.00 H ATOM 65935 H2 WAT 4064 132.962 52.031 128.326 1.00 0.00 H TER 65937 WAT 4064 ATOM 65937 O WAT 4065 37.122 73.285 99.127 1.00 0.00 O ATOM 65938 H1 WAT 4065 38.037 73.388 98.864 1.00 0.00 H ATOM 65939 H2 WAT 4065 36.621 73.486 98.336 1.00 0.00 H TER 65941 WAT 4065 ATOM 65941 O WAT 4066 59.870 23.658 153.712 1.00 0.00 O ATOM 65942 H1 WAT 4066 60.519 24.321 153.949 1.00 0.00 H ATOM 65943 H2 WAT 4066 60.101 23.405 152.819 1.00 0.00 H TER 65945 WAT 4066 ATOM 65945 O WAT 4067 143.986 112.966 123.303 1.00 0.00 O ATOM 65946 H1 WAT 4067 144.139 113.205 122.389 1.00 0.00 H ATOM 65947 H2 WAT 4067 144.851 113.014 123.711 1.00 0.00 H TER 65949 WAT 4067 ATOM 65949 O WAT 4068 0.304 71.220 61.311 1.00 0.00 O ATOM 65950 H1 WAT 4068 -0.261 71.490 60.587 1.00 0.00 H ATOM 65951 H2 WAT 4068 0.656 70.373 61.037 1.00 0.00 H TER 65953 WAT 4068 ATOM 65953 O WAT 4069 41.663 130.840 103.721 1.00 0.00 O ATOM 65954 H1 WAT 4069 42.424 131.124 104.227 1.00 0.00 H ATOM 65955 H2 WAT 4069 40.926 131.305 104.117 1.00 0.00 H TER 65957 WAT 4069 ATOM 65957 O WAT 4070 95.340 111.566 118.651 1.00 0.00 O ATOM 65958 H1 WAT 4070 95.726 112.196 119.260 1.00 0.00 H ATOM 65959 H2 WAT 4070 94.412 111.799 118.622 1.00 0.00 H TER 65961 WAT 4070 ATOM 65961 O WAT 4071 140.286 71.933 13.886 1.00 0.00 O ATOM 65962 H1 WAT 4071 140.907 71.510 13.292 1.00 0.00 H ATOM 65963 H2 WAT 4071 140.825 72.241 14.615 1.00 0.00 H TER 65965 WAT 4071 ATOM 65965 O WAT 4072 51.760 43.968 74.238 1.00 0.00 O ATOM 65966 H1 WAT 4072 52.269 44.453 73.588 1.00 0.00 H ATOM 65967 H2 WAT 4072 51.404 44.643 74.816 1.00 0.00 H TER 65969 WAT 4072 ATOM 65969 O WAT 4073 93.449 124.901 119.369 1.00 0.00 O ATOM 65970 H1 WAT 4073 93.964 125.198 118.619 1.00 0.00 H ATOM 65971 H2 WAT 4073 92.703 124.444 118.980 1.00 0.00 H TER 65973 WAT 4073 ATOM 65973 O WAT 4074 66.941 94.044 67.290 1.00 0.00 O ATOM 65974 H1 WAT 4074 66.698 94.573 68.050 1.00 0.00 H ATOM 65975 H2 WAT 4074 67.676 93.511 67.595 1.00 0.00 H TER 65977 WAT 4074 ATOM 65977 O WAT 4075 103.135 91.205 8.005 1.00 0.00 O ATOM 65978 H1 WAT 4075 103.658 91.858 7.539 1.00 0.00 H ATOM 65979 H2 WAT 4075 102.960 90.528 7.351 1.00 0.00 H TER 65981 WAT 4075 ATOM 65981 O WAT 4076 36.030 34.855 92.596 1.00 0.00 O ATOM 65982 H1 WAT 4076 35.405 34.233 92.967 1.00 0.00 H ATOM 65983 H2 WAT 4076 36.733 34.309 92.246 1.00 0.00 H TER 65985 WAT 4076 ATOM 65985 O WAT 4077 110.625 32.537 94.580 1.00 0.00 O ATOM 65986 H1 WAT 4077 110.867 31.679 94.930 1.00 0.00 H ATOM 65987 H2 WAT 4077 111.382 33.094 94.767 1.00 0.00 H TER 65989 WAT 4077 ATOM 65989 O WAT 4078 42.442 25.893 55.432 1.00 0.00 O ATOM 65990 H1 WAT 4078 43.067 26.428 55.922 1.00 0.00 H ATOM 65991 H2 WAT 4078 41.998 26.514 54.854 1.00 0.00 H TER 65993 WAT 4078 ATOM 65993 O WAT 4079 14.968 62.044 61.598 1.00 0.00 O ATOM 65994 H1 WAT 4079 15.263 62.850 62.021 1.00 0.00 H ATOM 65995 H2 WAT 4079 14.267 62.326 61.009 1.00 0.00 H TER 65997 WAT 4079 ATOM 65997 O WAT 4080 0.384 102.363 81.992 1.00 0.00 O ATOM 65998 H1 WAT 4080 0.590 103.083 82.588 1.00 0.00 H ATOM 65999 H2 WAT 4080 -0.494 102.562 81.669 1.00 0.00 H TER 66001 WAT 4080 ATOM 66001 O WAT 4081 56.941 94.194 119.717 1.00 0.00 O ATOM 66002 H1 WAT 4081 56.428 94.968 119.485 1.00 0.00 H ATOM 66003 H2 WAT 4081 56.352 93.670 120.259 1.00 0.00 H TER 66005 WAT 4081 ATOM 66005 O WAT 4082 22.469 60.171 157.619 1.00 0.00 O ATOM 66006 H1 WAT 4082 21.551 59.926 157.509 1.00 0.00 H ATOM 66007 H2 WAT 4082 22.662 59.974 158.536 1.00 0.00 H TER 66009 WAT 4082 ATOM 66009 O WAT 4083 3.956 63.823 93.877 1.00 0.00 O ATOM 66010 H1 WAT 4083 3.097 64.206 94.056 1.00 0.00 H ATOM 66011 H2 WAT 4083 3.763 62.993 93.441 1.00 0.00 H TER 66013 WAT 4083 ATOM 66013 O WAT 4084 79.989 2.367 81.817 1.00 0.00 O ATOM 66014 H1 WAT 4084 79.048 2.401 81.645 1.00 0.00 H ATOM 66015 H2 WAT 4084 80.228 1.452 81.667 1.00 0.00 H TER 66017 WAT 4084 ATOM 66017 O WAT 4085 91.113 69.401 108.096 1.00 0.00 O ATOM 66018 H1 WAT 4085 90.374 69.680 107.555 1.00 0.00 H ATOM 66019 H2 WAT 4085 91.018 68.450 108.159 1.00 0.00 H TER 66021 WAT 4085 ATOM 66021 O WAT 4086 36.735 28.370 111.806 1.00 0.00 O ATOM 66022 H1 WAT 4086 36.732 27.512 112.230 1.00 0.00 H ATOM 66023 H2 WAT 4086 37.581 28.751 112.042 1.00 0.00 H TER 66025 WAT 4086 ATOM 66025 O WAT 4087 92.619 73.966 18.665 1.00 0.00 O ATOM 66026 H1 WAT 4087 91.884 74.530 18.906 1.00 0.00 H ATOM 66027 H2 WAT 4087 92.219 73.117 18.478 1.00 0.00 H TER 66029 WAT 4087 ATOM 66029 O WAT 4088 72.323 138.389 130.130 1.00 0.00 O ATOM 66030 H1 WAT 4088 72.650 138.669 130.985 1.00 0.00 H ATOM 66031 H2 WAT 4088 72.780 137.566 129.957 1.00 0.00 H TER 66033 WAT 4088 ATOM 66033 O WAT 4089 46.673 57.335 96.911 1.00 0.00 O ATOM 66034 H1 WAT 4089 46.241 58.145 96.638 1.00 0.00 H ATOM 66035 H2 WAT 4089 46.603 56.758 96.151 1.00 0.00 H TER 66037 WAT 4089 ATOM 66037 O WAT 4090 75.994 9.359 106.757 1.00 0.00 O ATOM 66038 H1 WAT 4090 76.524 10.140 106.601 1.00 0.00 H ATOM 66039 H2 WAT 4090 76.632 8.657 106.882 1.00 0.00 H TER 66041 WAT 4090 ATOM 66041 O WAT 4091 51.645 103.455 126.184 1.00 0.00 O ATOM 66042 H1 WAT 4091 51.235 103.306 125.332 1.00 0.00 H ATOM 66043 H2 WAT 4091 52.037 102.612 126.411 1.00 0.00 H TER 66045 WAT 4091 ATOM 66045 O WAT 4092 39.064 21.951 145.342 1.00 0.00 O ATOM 66046 H1 WAT 4092 39.073 22.805 145.775 1.00 0.00 H ATOM 66047 H2 WAT 4092 39.969 21.814 145.062 1.00 0.00 H TER 66049 WAT 4092 ATOM 66049 O WAT 4093 65.631 136.477 87.130 1.00 0.00 O ATOM 66050 H1 WAT 4093 65.861 135.722 87.671 1.00 0.00 H ATOM 66051 H2 WAT 4093 64.800 136.235 86.722 1.00 0.00 H TER 66053 WAT 4093 ATOM 66053 O WAT 4094 128.422 25.722 4.406 1.00 0.00 O ATOM 66054 H1 WAT 4094 128.049 25.661 5.285 1.00 0.00 H ATOM 66055 H2 WAT 4094 129.158 26.327 4.499 1.00 0.00 H TER 66057 WAT 4094 ATOM 66057 O WAT 4095 140.873 81.995 33.271 1.00 0.00 O ATOM 66058 H1 WAT 4095 140.706 81.054 33.326 1.00 0.00 H ATOM 66059 H2 WAT 4095 140.367 82.371 33.991 1.00 0.00 H TER 66061 WAT 4095 ATOM 66061 O WAT 4096 103.188 51.402 96.839 1.00 0.00 O ATOM 66062 H1 WAT 4096 102.308 51.449 96.464 1.00 0.00 H ATOM 66063 H2 WAT 4096 103.761 51.257 96.087 1.00 0.00 H TER 66065 WAT 4096 ATOM 66065 O WAT 4097 120.980 117.756 20.624 1.00 0.00 O ATOM 66066 H1 WAT 4097 121.277 117.311 19.830 1.00 0.00 H ATOM 66067 H2 WAT 4097 120.135 117.353 20.822 1.00 0.00 H TER 66069 WAT 4097 ATOM 66069 O WAT 4098 136.185 10.690 105.998 1.00 0.00 O ATOM 66070 H1 WAT 4098 136.789 10.906 105.288 1.00 0.00 H ATOM 66071 H2 WAT 4098 135.334 11.005 105.693 1.00 0.00 H TER 66073 WAT 4098 ATOM 66073 O WAT 4099 130.546 68.693 157.513 1.00 0.00 O ATOM 66074 H1 WAT 4099 130.108 68.317 156.750 1.00 0.00 H ATOM 66075 H2 WAT 4099 130.284 68.131 158.242 1.00 0.00 H TER 66077 WAT 4099 ATOM 66077 O WAT 4100 23.274 115.207 72.522 1.00 0.00 O ATOM 66078 H1 WAT 4100 23.713 114.766 73.249 1.00 0.00 H ATOM 66079 H2 WAT 4100 23.900 115.157 71.799 1.00 0.00 H TER 66081 WAT 4100 ATOM 66081 O WAT 4101 84.741 13.769 5.923 1.00 0.00 O ATOM 66082 H1 WAT 4101 85.319 13.337 5.295 1.00 0.00 H ATOM 66083 H2 WAT 4101 84.693 13.162 6.662 1.00 0.00 H TER 66085 WAT 4101 ATOM 66085 O WAT 4102 94.848 110.821 5.976 1.00 0.00 O ATOM 66086 H1 WAT 4102 94.069 110.448 5.563 1.00 0.00 H ATOM 66087 H2 WAT 4102 95.431 110.074 6.107 1.00 0.00 H TER 66089 WAT 4102 ATOM 66089 O WAT 4103 119.796 111.375 158.047 1.00 0.00 O ATOM 66090 H1 WAT 4103 119.751 112.315 157.873 1.00 0.00 H ATOM 66091 H2 WAT 4103 120.601 111.264 158.553 1.00 0.00 H TER 66093 WAT 4103 ATOM 66093 O WAT 4104 85.173 120.646 138.616 1.00 0.00 O ATOM 66094 H1 WAT 4104 85.322 121.012 137.744 1.00 0.00 H ATOM 66095 H2 WAT 4104 85.679 119.833 138.624 1.00 0.00 H TER 66097 WAT 4104 ATOM 66097 O WAT 4105 129.001 63.137 158.758 1.00 0.00 O ATOM 66098 H1 WAT 4105 128.941 62.182 158.759 1.00 0.00 H ATOM 66099 H2 WAT 4105 128.592 63.402 157.934 1.00 0.00 H TER 66101 WAT 4105 ATOM 66101 O WAT 4106 17.706 28.282 96.390 1.00 0.00 O ATOM 66102 H1 WAT 4106 18.639 28.253 96.603 1.00 0.00 H ATOM 66103 H2 WAT 4106 17.661 28.789 95.580 1.00 0.00 H TER 66105 WAT 4106 ATOM 66105 O WAT 4107 59.886 75.070 128.170 1.00 0.00 O ATOM 66106 H1 WAT 4107 59.422 74.445 128.727 1.00 0.00 H ATOM 66107 H2 WAT 4107 59.251 75.770 128.016 1.00 0.00 H TER 66109 WAT 4107 ATOM 66109 O WAT 4108 83.869 74.986 118.477 1.00 0.00 O ATOM 66110 H1 WAT 4108 84.088 74.055 118.508 1.00 0.00 H ATOM 66111 H2 WAT 4108 83.527 75.182 119.349 1.00 0.00 H TER 66113 WAT 4108 ATOM 66113 O WAT 4109 38.146 30.719 24.161 1.00 0.00 O ATOM 66114 H1 WAT 4109 37.904 30.768 25.085 1.00 0.00 H ATOM 66115 H2 WAT 4109 37.529 30.091 23.785 1.00 0.00 H TER 66117 WAT 4109 ATOM 66117 O WAT 4110 24.350 54.649 126.031 1.00 0.00 O ATOM 66118 H1 WAT 4110 24.069 54.538 125.123 1.00 0.00 H ATOM 66119 H2 WAT 4110 24.570 53.765 126.323 1.00 0.00 H TER 66121 WAT 4110 ATOM 66121 O WAT 4111 81.310 14.818 120.124 1.00 0.00 O ATOM 66122 H1 WAT 4111 82.237 14.766 120.357 1.00 0.00 H ATOM 66123 H2 WAT 4111 81.089 13.937 119.822 1.00 0.00 H TER 66125 WAT 4111 ATOM 66125 O WAT 4112 100.059 14.660 125.830 1.00 0.00 O ATOM 66126 H1 WAT 4112 100.716 14.630 126.526 1.00 0.00 H ATOM 66127 H2 WAT 4112 99.229 14.791 126.289 1.00 0.00 H TER 66129 WAT 4112 ATOM 66129 O WAT 4113 66.117 40.236 6.431 1.00 0.00 O ATOM 66130 H1 WAT 4113 66.382 40.054 7.333 1.00 0.00 H ATOM 66131 H2 WAT 4113 66.203 41.185 6.343 1.00 0.00 H TER 66133 WAT 4113 ATOM 66133 O WAT 4114 60.068 62.104 20.145 1.00 0.00 O ATOM 66134 H1 WAT 4114 60.379 61.441 19.529 1.00 0.00 H ATOM 66135 H2 WAT 4114 60.408 61.821 20.994 1.00 0.00 H TER 66137 WAT 4114 ATOM 66137 O WAT 4115 129.635 11.180 108.038 1.00 0.00 O ATOM 66138 H1 WAT 4115 129.810 11.492 107.151 1.00 0.00 H ATOM 66139 H2 WAT 4115 128.807 10.704 107.966 1.00 0.00 H TER 66141 WAT 4115 ATOM 66141 O WAT 4116 53.989 53.164 15.294 1.00 0.00 O ATOM 66142 H1 WAT 4116 54.207 52.289 15.616 1.00 0.00 H ATOM 66143 H2 WAT 4116 54.835 53.561 15.087 1.00 0.00 H TER 66145 WAT 4116 ATOM 66145 O WAT 4117 17.470 5.419 134.745 1.00 0.00 O ATOM 66146 H1 WAT 4117 17.322 6.157 134.154 1.00 0.00 H ATOM 66147 H2 WAT 4117 16.667 4.902 134.688 1.00 0.00 H TER 66149 WAT 4117 ATOM 66149 O WAT 4118 5.452 55.991 144.841 1.00 0.00 O ATOM 66150 H1 WAT 4118 5.628 56.925 144.954 1.00 0.00 H ATOM 66151 H2 WAT 4118 6.278 55.628 144.521 1.00 0.00 H TER 66153 WAT 4118 ATOM 66153 O WAT 4119 138.292 71.822 151.696 1.00 0.00 O ATOM 66154 H1 WAT 4119 137.485 71.848 152.210 1.00 0.00 H ATOM 66155 H2 WAT 4119 138.858 71.212 152.168 1.00 0.00 H TER 66157 WAT 4119 ATOM 66157 O WAT 4120 59.821 102.917 12.557 1.00 0.00 O ATOM 66158 H1 WAT 4120 60.328 103.281 11.831 1.00 0.00 H ATOM 66159 H2 WAT 4120 59.828 101.972 12.402 1.00 0.00 H TER 66161 WAT 4120 ATOM 66161 O WAT 4121 20.287 130.522 133.684 1.00 0.00 O ATOM 66162 H1 WAT 4121 21.002 131.132 133.865 1.00 0.00 H ATOM 66163 H2 WAT 4121 19.654 130.680 134.385 1.00 0.00 H TER 66165 WAT 4121 ATOM 66165 O WAT 4122 50.639 122.316 157.169 1.00 0.00 O ATOM 66166 H1 WAT 4122 50.642 121.444 157.563 1.00 0.00 H ATOM 66167 H2 WAT 4122 49.757 122.650 157.331 1.00 0.00 H TER 66169 WAT 4122 ATOM 66169 O WAT 4123 65.598 114.186 79.183 1.00 0.00 O ATOM 66170 H1 WAT 4123 65.687 113.411 79.738 1.00 0.00 H ATOM 66171 H2 WAT 4123 65.567 113.840 78.291 1.00 0.00 H TER 66173 WAT 4123 ATOM 66173 O WAT 4124 137.076 73.889 149.801 1.00 0.00 O ATOM 66174 H1 WAT 4124 137.554 74.701 149.966 1.00 0.00 H ATOM 66175 H2 WAT 4124 137.514 73.237 150.348 1.00 0.00 H TER 66177 WAT 4124 ATOM 66177 O WAT 4125 63.684 6.579 112.184 1.00 0.00 O ATOM 66178 H1 WAT 4125 63.384 7.290 111.618 1.00 0.00 H ATOM 66179 H2 WAT 4125 64.216 6.025 111.612 1.00 0.00 H TER 66181 WAT 4125 ATOM 66181 O WAT 4126 72.577 52.786 6.701 1.00 0.00 O ATOM 66182 H1 WAT 4126 72.598 51.909 6.318 1.00 0.00 H ATOM 66183 H2 WAT 4126 73.429 52.881 7.128 1.00 0.00 H TER 66185 WAT 4126 ATOM 66185 O WAT 4127 104.599 94.049 83.918 1.00 0.00 O ATOM 66186 H1 WAT 4127 104.467 93.154 84.231 1.00 0.00 H ATOM 66187 H2 WAT 4127 105.549 94.139 83.845 1.00 0.00 H TER 66189 WAT 4127 ATOM 66189 O WAT 4128 133.607 53.696 106.798 1.00 0.00 O ATOM 66190 H1 WAT 4128 134.310 53.047 106.785 1.00 0.00 H ATOM 66191 H2 WAT 4128 132.925 53.301 107.341 1.00 0.00 H TER 66193 WAT 4128 ATOM 66193 O WAT 4129 114.099 58.044 133.216 1.00 0.00 O ATOM 66194 H1 WAT 4129 113.296 57.675 132.848 1.00 0.00 H ATOM 66195 H2 WAT 4129 114.249 57.540 134.017 1.00 0.00 H TER 66197 WAT 4129 ATOM 66197 O WAT 4130 118.448 36.055 14.248 1.00 0.00 O ATOM 66198 H1 WAT 4130 118.772 36.639 14.935 1.00 0.00 H ATOM 66199 H2 WAT 4130 119.220 35.564 13.968 1.00 0.00 H TER 66201 WAT 4130 ATOM 66201 O WAT 4131 53.706 39.490 94.762 1.00 0.00 O ATOM 66202 H1 WAT 4131 54.104 40.361 94.777 1.00 0.00 H ATOM 66203 H2 WAT 4131 54.311 38.960 94.243 1.00 0.00 H TER 66205 WAT 4131 ATOM 66205 O WAT 4132 110.227 123.211 119.447 1.00 0.00 O ATOM 66206 H1 WAT 4132 109.510 122.619 119.676 1.00 0.00 H ATOM 66207 H2 WAT 4132 111.020 122.706 119.627 1.00 0.00 H TER 66209 WAT 4132 ATOM 66209 O WAT 4133 11.499 1.290 142.676 1.00 0.00 O ATOM 66210 H1 WAT 4133 12.277 1.328 142.121 1.00 0.00 H ATOM 66211 H2 WAT 4133 11.838 1.346 143.569 1.00 0.00 H TER 66213 WAT 4133 ATOM 66213 O WAT 4134 131.879 4.709 0.795 1.00 0.00 O ATOM 66214 H1 WAT 4134 132.394 5.284 0.228 1.00 0.00 H ATOM 66215 H2 WAT 4134 131.093 5.215 0.999 1.00 0.00 H TER 66217 WAT 4134 ATOM 66217 O WAT 4135 11.241 127.396 114.859 1.00 0.00 O ATOM 66218 H1 WAT 4135 10.458 127.554 114.333 1.00 0.00 H ATOM 66219 H2 WAT 4135 11.562 126.545 114.561 1.00 0.00 H TER 66221 WAT 4135 ATOM 66221 O WAT 4136 82.878 81.173 63.637 1.00 0.00 O ATOM 66222 H1 WAT 4136 82.849 81.976 63.116 1.00 0.00 H ATOM 66223 H2 WAT 4136 83.789 80.885 63.583 1.00 0.00 H TER 66225 WAT 4136 ATOM 66225 O WAT 4137 2.965 136.269 1.557 1.00 0.00 O ATOM 66226 H1 WAT 4137 3.728 135.736 1.334 1.00 0.00 H ATOM 66227 H2 WAT 4137 2.949 136.275 2.514 1.00 0.00 H TER 66229 WAT 4137 ATOM 66229 O WAT 4138 144.525 118.750 116.900 1.00 0.00 O ATOM 66230 H1 WAT 4138 143.961 119.433 116.538 1.00 0.00 H ATOM 66231 H2 WAT 4138 143.935 118.016 117.070 1.00 0.00 H TER 66233 WAT 4138 ATOM 66233 O WAT 4139 18.745 43.081 69.022 1.00 0.00 O ATOM 66234 H1 WAT 4139 18.113 42.778 69.673 1.00 0.00 H ATOM 66235 H2 WAT 4139 19.583 43.082 69.484 1.00 0.00 H TER 66237 WAT 4139 ATOM 66237 O WAT 4140 102.092 18.571 144.699 1.00 0.00 O ATOM 66238 H1 WAT 4140 102.123 19.334 144.121 1.00 0.00 H ATOM 66239 H2 WAT 4140 101.160 18.445 144.878 1.00 0.00 H TER 66241 WAT 4140 ATOM 66241 O WAT 4141 106.302 28.395 153.108 1.00 0.00 O ATOM 66242 H1 WAT 4141 107.062 28.023 152.661 1.00 0.00 H ATOM 66243 H2 WAT 4141 106.327 29.326 152.888 1.00 0.00 H TER 66245 WAT 4141 ATOM 66245 O WAT 4142 102.260 48.429 77.792 1.00 0.00 O ATOM 66246 H1 WAT 4142 101.651 47.742 78.064 1.00 0.00 H ATOM 66247 H2 WAT 4142 103.072 48.227 78.257 1.00 0.00 H TER 66249 WAT 4142 ATOM 66249 O WAT 4143 119.054 133.314 91.666 1.00 0.00 O ATOM 66250 H1 WAT 4143 119.186 132.625 91.015 1.00 0.00 H ATOM 66251 H2 WAT 4143 118.155 133.187 91.970 1.00 0.00 H TER 66253 WAT 4143 ATOM 66253 O WAT 4144 7.931 77.815 10.180 1.00 0.00 O ATOM 66254 H1 WAT 4144 8.510 77.746 10.940 1.00 0.00 H ATOM 66255 H2 WAT 4144 7.116 78.173 10.532 1.00 0.00 H TER 66257 WAT 4144 ATOM 66257 O WAT 4145 32.871 108.066 8.646 1.00 0.00 O ATOM 66258 H1 WAT 4145 33.255 108.921 8.450 1.00 0.00 H ATOM 66259 H2 WAT 4145 32.346 107.856 7.874 1.00 0.00 H TER 66261 WAT 4145 ATOM 66261 O WAT 4146 107.926 101.569 18.255 1.00 0.00 O ATOM 66262 H1 WAT 4146 108.830 101.324 18.060 1.00 0.00 H ATOM 66263 H2 WAT 4146 107.495 100.743 18.472 1.00 0.00 H TER 66265 WAT 4146 ATOM 66265 O WAT 4147 98.796 4.202 130.682 1.00 0.00 O ATOM 66266 H1 WAT 4147 98.630 5.024 131.142 1.00 0.00 H ATOM 66267 H2 WAT 4147 98.324 3.543 131.191 1.00 0.00 H TER 66269 WAT 4147 ATOM 66269 O WAT 4148 76.265 49.408 23.329 1.00 0.00 O ATOM 66270 H1 WAT 4148 75.811 49.321 24.167 1.00 0.00 H ATOM 66271 H2 WAT 4148 76.257 50.348 23.148 1.00 0.00 H TER 66273 WAT 4148 ATOM 66273 O WAT 4149 6.390 4.536 140.023 1.00 0.00 O ATOM 66274 H1 WAT 4149 5.514 4.769 139.716 1.00 0.00 H ATOM 66275 H2 WAT 4149 6.896 5.345 139.939 1.00 0.00 H TER 66277 WAT 4149 ATOM 66277 O WAT 4150 12.147 38.255 115.852 1.00 0.00 O ATOM 66278 H1 WAT 4150 13.014 37.960 115.572 1.00 0.00 H ATOM 66279 H2 WAT 4150 12.183 39.208 115.778 1.00 0.00 H TER 66281 WAT 4150 ATOM 66281 O WAT 4151 35.266 133.605 120.569 1.00 0.00 O ATOM 66282 H1 WAT 4151 35.242 133.119 119.744 1.00 0.00 H ATOM 66283 H2 WAT 4151 35.898 134.308 120.415 1.00 0.00 H TER 66285 WAT 4151 ATOM 66285 O WAT 4152 95.808 81.431 8.491 1.00 0.00 O ATOM 66286 H1 WAT 4152 95.675 81.916 9.306 1.00 0.00 H ATOM 66287 H2 WAT 4152 95.555 80.532 8.704 1.00 0.00 H TER 66289 WAT 4152 ATOM 66289 O WAT 4153 18.206 109.611 119.835 1.00 0.00 O ATOM 66290 H1 WAT 4153 17.622 109.457 119.092 1.00 0.00 H ATOM 66291 H2 WAT 4153 17.786 109.161 120.568 1.00 0.00 H TER 66293 WAT 4153 ATOM 66293 O WAT 4154 136.007 136.249 93.603 1.00 0.00 O ATOM 66294 H1 WAT 4154 135.548 136.900 94.133 1.00 0.00 H ATOM 66295 H2 WAT 4154 136.180 136.695 92.774 1.00 0.00 H TER 66297 WAT 4154 ATOM 66297 O WAT 4155 109.491 52.814 76.830 1.00 0.00 O ATOM 66298 H1 WAT 4155 108.765 52.426 76.341 1.00 0.00 H ATOM 66299 H2 WAT 4155 109.259 52.679 77.749 1.00 0.00 H TER 66301 WAT 4155 ATOM 66301 O WAT 4156 106.333 112.601 125.505 1.00 0.00 O ATOM 66302 H1 WAT 4156 106.470 111.736 125.892 1.00 0.00 H ATOM 66303 H2 WAT 4156 106.284 113.193 126.256 1.00 0.00 H TER 66305 WAT 4156 ATOM 66305 O WAT 4157 16.941 46.609 110.820 1.00 0.00 O ATOM 66306 H1 WAT 4157 16.188 47.067 110.446 1.00 0.00 H ATOM 66307 H2 WAT 4157 17.328 46.139 110.081 1.00 0.00 H TER 66309 WAT 4157 ATOM 66309 O WAT 4158 120.744 70.730 11.595 1.00 0.00 O ATOM 66310 H1 WAT 4158 120.386 71.618 11.558 1.00 0.00 H ATOM 66311 H2 WAT 4158 121.672 70.854 11.792 1.00 0.00 H TER 66313 WAT 4158 ATOM 66313 O WAT 4159 74.343 21.629 65.477 1.00 0.00 O ATOM 66314 H1 WAT 4159 74.585 20.843 65.966 1.00 0.00 H ATOM 66315 H2 WAT 4159 74.312 22.322 66.137 1.00 0.00 H TER 66317 WAT 4159 ATOM 66317 O WAT 4160 38.379 9.314 54.541 1.00 0.00 O ATOM 66318 H1 WAT 4160 38.324 9.079 55.467 1.00 0.00 H ATOM 66319 H2 WAT 4160 37.943 8.594 54.085 1.00 0.00 H TER 66321 WAT 4160 ATOM 66321 O WAT 4161 137.661 133.962 26.091 1.00 0.00 O ATOM 66322 H1 WAT 4161 137.569 134.717 26.672 1.00 0.00 H ATOM 66323 H2 WAT 4161 138.566 134.005 25.783 1.00 0.00 H TER 66325 WAT 4161 ATOM 66325 O WAT 4162 85.519 84.886 82.925 1.00 0.00 O ATOM 66326 H1 WAT 4162 85.767 84.079 82.473 1.00 0.00 H ATOM 66327 H2 WAT 4162 86.338 85.216 83.293 1.00 0.00 H TER 66329 WAT 4162 ATOM 66329 O WAT 4163 81.412 73.416 91.580 1.00 0.00 O ATOM 66330 H1 WAT 4163 81.967 74.078 91.166 1.00 0.00 H ATOM 66331 H2 WAT 4163 81.119 73.824 92.394 1.00 0.00 H TER 66333 WAT 4163 ATOM 66333 O WAT 4164 132.262 102.839 107.842 1.00 0.00 O ATOM 66334 H1 WAT 4164 131.411 103.276 107.880 1.00 0.00 H ATOM 66335 H2 WAT 4164 132.501 102.860 106.916 1.00 0.00 H TER 66337 WAT 4164 ATOM 66337 O WAT 4165 92.676 133.740 18.809 1.00 0.00 O ATOM 66338 H1 WAT 4165 92.419 134.264 19.568 1.00 0.00 H ATOM 66339 H2 WAT 4165 92.493 132.837 19.068 1.00 0.00 H TER 66341 WAT 4165 ATOM 66341 O WAT 4166 24.360 12.220 145.578 1.00 0.00 O ATOM 66342 H1 WAT 4166 25.027 11.958 144.942 1.00 0.00 H ATOM 66343 H2 WAT 4166 24.413 13.176 145.598 1.00 0.00 H TER 66345 WAT 4166 ATOM 66345 O WAT 4167 30.122 98.752 113.569 1.00 0.00 O ATOM 66346 H1 WAT 4167 30.610 98.272 112.900 1.00 0.00 H ATOM 66347 H2 WAT 4167 30.511 98.470 114.397 1.00 0.00 H TER 66349 WAT 4167 ATOM 66349 O WAT 4168 103.116 93.449 15.046 1.00 0.00 O ATOM 66350 H1 WAT 4168 102.387 92.931 14.706 1.00 0.00 H ATOM 66351 H2 WAT 4168 103.588 93.740 14.266 1.00 0.00 H TER 66353 WAT 4168 ATOM 66353 O WAT 4169 21.056 31.554 149.271 1.00 0.00 O ATOM 66354 H1 WAT 4169 21.297 31.327 148.373 1.00 0.00 H ATOM 66355 H2 WAT 4169 20.115 31.385 149.316 1.00 0.00 H TER 66357 WAT 4169 ATOM 66357 O WAT 4170 65.943 119.558 92.910 1.00 0.00 O ATOM 66358 H1 WAT 4170 66.797 119.643 93.334 1.00 0.00 H ATOM 66359 H2 WAT 4170 65.572 120.440 92.939 1.00 0.00 H TER 66361 WAT 4170 ATOM 66361 O WAT 4171 109.732 45.858 69.234 1.00 0.00 O ATOM 66362 H1 WAT 4171 108.874 45.544 68.947 1.00 0.00 H ATOM 66363 H2 WAT 4171 109.584 46.773 69.473 1.00 0.00 H TER 66365 WAT 4171 ATOM 66365 O WAT 4172 114.277 57.841 20.061 1.00 0.00 O ATOM 66366 H1 WAT 4172 114.505 57.000 20.457 1.00 0.00 H ATOM 66367 H2 WAT 4172 113.507 57.652 19.525 1.00 0.00 H TER 66369 WAT 4172 ATOM 66369 O WAT 4173 102.822 61.410 24.671 1.00 0.00 O ATOM 66370 H1 WAT 4173 103.335 60.807 24.132 1.00 0.00 H ATOM 66371 H2 WAT 4173 103.175 62.275 24.463 1.00 0.00 H TER 66373 WAT 4173 ATOM 66373 O WAT 4174 88.420 83.685 12.626 1.00 0.00 O ATOM 66374 H1 WAT 4174 89.364 83.604 12.763 1.00 0.00 H ATOM 66375 H2 WAT 4174 88.270 83.298 11.763 1.00 0.00 H TER 66377 WAT 4174 ATOM 66377 O WAT 4175 67.603 116.571 112.739 1.00 0.00 O ATOM 66378 H1 WAT 4175 68.374 116.206 112.303 1.00 0.00 H ATOM 66379 H2 WAT 4175 67.943 116.947 113.551 1.00 0.00 H TER 66381 WAT 4175 ATOM 66381 O WAT 4176 52.870 57.241 100.796 1.00 0.00 O ATOM 66382 H1 WAT 4176 53.017 57.631 99.934 1.00 0.00 H ATOM 66383 H2 WAT 4176 53.642 56.695 100.947 1.00 0.00 H TER 66385 WAT 4176 ATOM 66385 O WAT 4177 80.883 3.340 138.996 1.00 0.00 O ATOM 66386 H1 WAT 4177 81.545 3.244 138.311 1.00 0.00 H ATOM 66387 H2 WAT 4177 80.944 4.258 139.260 1.00 0.00 H TER 66389 WAT 4177 ATOM 66389 O WAT 4178 128.681 104.610 120.974 1.00 0.00 O ATOM 66390 H1 WAT 4178 129.054 105.491 120.954 1.00 0.00 H ATOM 66391 H2 WAT 4178 129.441 104.029 121.018 1.00 0.00 H TER 66393 WAT 4178 ATOM 66393 O WAT 4179 39.446 14.222 92.577 1.00 0.00 O ATOM 66394 H1 WAT 4179 39.472 14.290 93.531 1.00 0.00 H ATOM 66395 H2 WAT 4179 40.045 13.504 92.372 1.00 0.00 H TER 66397 WAT 4179 ATOM 66397 O WAT 4180 5.853 122.803 123.885 1.00 0.00 O ATOM 66398 H1 WAT 4180 6.021 123.269 123.065 1.00 0.00 H ATOM 66399 H2 WAT 4180 6.103 121.897 123.700 1.00 0.00 H TER 66401 WAT 4180 ATOM 66401 O WAT 4181 105.395 124.927 120.322 1.00 0.00 O ATOM 66402 H1 WAT 4181 105.514 124.736 121.252 1.00 0.00 H ATOM 66403 H2 WAT 4181 104.533 125.341 120.271 1.00 0.00 H TER 66405 WAT 4181 ATOM 66405 O WAT 4182 58.037 57.065 8.367 1.00 0.00 O ATOM 66406 H1 WAT 4182 58.743 57.288 8.974 1.00 0.00 H ATOM 66407 H2 WAT 4182 57.311 56.801 8.931 1.00 0.00 H TER 66409 WAT 4182 ATOM 66409 O WAT 4183 110.064 95.972 150.082 1.00 0.00 O ATOM 66410 H1 WAT 4183 110.951 96.328 150.135 1.00 0.00 H ATOM 66411 H2 WAT 4183 110.171 95.036 150.250 1.00 0.00 H TER 66413 WAT 4183 ATOM 66413 O WAT 4184 17.709 79.445 3.890 1.00 0.00 O ATOM 66414 H1 WAT 4184 18.423 80.031 3.639 1.00 0.00 H ATOM 66415 H2 WAT 4184 17.271 79.897 4.611 1.00 0.00 H TER 66417 WAT 4184 ATOM 66417 O WAT 4185 91.461 19.456 15.110 1.00 0.00 O ATOM 66418 H1 WAT 4185 91.207 18.671 14.625 1.00 0.00 H ATOM 66419 H2 WAT 4185 90.685 20.017 15.080 1.00 0.00 H TER 66421 WAT 4185 ATOM 66421 O WAT 4186 124.541 133.577 58.958 1.00 0.00 O ATOM 66422 H1 WAT 4186 125.332 133.043 58.880 1.00 0.00 H ATOM 66423 H2 WAT 4186 124.559 133.903 59.857 1.00 0.00 H TER 66425 WAT 4186 ATOM 66425 O WAT 4187 88.288 95.946 15.384 1.00 0.00 O ATOM 66426 H1 WAT 4187 87.755 96.060 14.597 1.00 0.00 H ATOM 66427 H2 WAT 4187 88.679 95.078 15.285 1.00 0.00 H TER 66429 WAT 4187 ATOM 66429 O WAT 4188 93.444 65.101 136.235 1.00 0.00 O ATOM 66430 H1 WAT 4188 93.783 65.037 137.128 1.00 0.00 H ATOM 66431 H2 WAT 4188 92.497 65.182 136.344 1.00 0.00 H TER 66433 WAT 4188 ATOM 66433 O WAT 4189 47.079 21.732 16.489 1.00 0.00 O ATOM 66434 H1 WAT 4189 47.531 20.980 16.871 1.00 0.00 H ATOM 66435 H2 WAT 4189 46.300 21.846 17.034 1.00 0.00 H TER 66437 WAT 4189 ATOM 66437 O WAT 4190 71.432 130.192 2.128 1.00 0.00 O ATOM 66438 H1 WAT 4190 70.638 129.897 2.575 1.00 0.00 H ATOM 66439 H2 WAT 4190 71.138 130.424 1.247 1.00 0.00 H TER 66441 WAT 4190 ATOM 66441 O WAT 4191 16.212 58.195 91.724 1.00 0.00 O ATOM 66442 H1 WAT 4191 15.396 58.690 91.800 1.00 0.00 H ATOM 66443 H2 WAT 4191 15.965 57.293 91.928 1.00 0.00 H TER 66445 WAT 4191 ATOM 66445 O WAT 4192 97.248 122.074 141.016 1.00 0.00 O ATOM 66446 H1 WAT 4192 96.423 122.443 140.703 1.00 0.00 H ATOM 66447 H2 WAT 4192 97.923 122.552 140.534 1.00 0.00 H TER 66449 WAT 4192 ATOM 66449 O WAT 4193 38.482 112.265 16.496 1.00 0.00 O ATOM 66450 H1 WAT 4193 38.313 112.163 17.433 1.00 0.00 H ATOM 66451 H2 WAT 4193 37.626 112.472 16.120 1.00 0.00 H TER 66453 WAT 4193 ATOM 66453 O WAT 4194 63.428 82.827 63.005 1.00 0.00 O ATOM 66454 H1 WAT 4194 63.480 82.895 63.959 1.00 0.00 H ATOM 66455 H2 WAT 4194 63.680 81.923 62.816 1.00 0.00 H TER 66457 WAT 4194 ATOM 66457 O WAT 4195 17.377 16.932 115.106 1.00 0.00 O ATOM 66458 H1 WAT 4195 17.319 16.289 115.813 1.00 0.00 H ATOM 66459 H2 WAT 4195 17.618 16.420 114.335 1.00 0.00 H TER 66461 WAT 4195 ATOM 66461 O WAT 4196 84.975 142.034 13.354 1.00 0.00 O ATOM 66462 H1 WAT 4196 84.632 142.368 12.525 1.00 0.00 H ATOM 66463 H2 WAT 4196 84.867 142.760 13.968 1.00 0.00 H TER 66465 WAT 4196 ATOM 66465 O WAT 4197 65.690 95.421 123.505 1.00 0.00 O ATOM 66466 H1 WAT 4197 66.248 96.028 123.019 1.00 0.00 H ATOM 66467 H2 WAT 4197 65.596 94.666 122.924 1.00 0.00 H TER 66469 WAT 4197 ATOM 66469 O WAT 4198 94.359 24.225 92.962 1.00 0.00 O ATOM 66470 H1 WAT 4198 95.313 24.296 92.991 1.00 0.00 H ATOM 66471 H2 WAT 4198 94.116 24.607 92.118 1.00 0.00 H TER 66473 WAT 4198 ATOM 66473 O WAT 4199 19.329 122.398 20.481 1.00 0.00 O ATOM 66474 H1 WAT 4199 20.254 122.621 20.376 1.00 0.00 H ATOM 66475 H2 WAT 4199 19.044 122.905 21.241 1.00 0.00 H TER 66477 WAT 4199 ATOM 66477 O WAT 4200 46.687 71.177 79.091 1.00 0.00 O ATOM 66478 H1 WAT 4200 45.950 70.714 78.692 1.00 0.00 H ATOM 66479 H2 WAT 4200 47.363 71.180 78.414 1.00 0.00 H TER 66481 WAT 4200 ATOM 66481 O WAT 4201 59.757 75.290 105.368 1.00 0.00 O ATOM 66482 H1 WAT 4201 59.176 74.881 104.728 1.00 0.00 H ATOM 66483 H2 WAT 4201 60.588 75.396 104.905 1.00 0.00 H TER 66485 WAT 4201 ATOM 66485 O WAT 4202 55.390 118.819 109.237 1.00 0.00 O ATOM 66486 H1 WAT 4202 55.353 118.295 108.436 1.00 0.00 H ATOM 66487 H2 WAT 4202 55.675 119.684 108.944 1.00 0.00 H TER 66489 WAT 4202 ATOM 66489 O WAT 4203 133.049 40.909 19.232 1.00 0.00 O ATOM 66490 H1 WAT 4203 133.369 41.392 18.470 1.00 0.00 H ATOM 66491 H2 WAT 4203 132.206 41.315 19.436 1.00 0.00 H TER 66493 WAT 4203 ATOM 66493 O WAT 4204 111.586 5.096 22.540 1.00 0.00 O ATOM 66494 H1 WAT 4204 111.947 4.229 22.725 1.00 0.00 H ATOM 66495 H2 WAT 4204 111.874 5.638 23.274 1.00 0.00 H TER 66497 WAT 4204 ATOM 66497 O WAT 4205 136.470 79.606 152.071 1.00 0.00 O ATOM 66498 H1 WAT 4205 135.774 79.425 151.440 1.00 0.00 H ATOM 66499 H2 WAT 4205 136.161 80.371 152.557 1.00 0.00 H TER 66501 WAT 4205 ATOM 66501 O WAT 4206 45.608 67.457 84.577 1.00 0.00 O ATOM 66502 H1 WAT 4206 45.443 67.958 83.778 1.00 0.00 H ATOM 66503 H2 WAT 4206 46.455 67.038 84.427 1.00 0.00 H TER 66505 WAT 4206 ATOM 66505 O WAT 4207 44.374 19.987 79.245 1.00 0.00 O ATOM 66506 H1 WAT 4207 44.852 19.209 78.960 1.00 0.00 H ATOM 66507 H2 WAT 4207 45.050 20.570 79.592 1.00 0.00 H TER 66509 WAT 4207 ATOM 66509 O WAT 4208 119.563 112.451 97.554 1.00 0.00 O ATOM 66510 H1 WAT 4208 120.418 112.619 97.158 1.00 0.00 H ATOM 66511 H2 WAT 4208 119.762 112.214 98.460 1.00 0.00 H TER 66513 WAT 4208 ATOM 66513 O WAT 4209 95.782 74.572 8.243 1.00 0.00 O ATOM 66514 H1 WAT 4209 96.076 74.316 9.116 1.00 0.00 H ATOM 66515 H2 WAT 4209 96.330 75.323 8.016 1.00 0.00 H TER 66517 WAT 4209 ATOM 66517 O WAT 4210 24.785 13.465 83.228 1.00 0.00 O ATOM 66518 H1 WAT 4210 25.070 13.003 82.439 1.00 0.00 H ATOM 66519 H2 WAT 4210 25.543 13.988 83.487 1.00 0.00 H TER 66521 WAT 4210 ATOM 66521 O WAT 4211 59.707 59.260 20.907 1.00 0.00 O ATOM 66522 H1 WAT 4211 59.758 59.414 19.963 1.00 0.00 H ATOM 66523 H2 WAT 4211 60.571 58.919 21.140 1.00 0.00 H TER 66525 WAT 4211 ATOM 66525 O WAT 4212 145.116 132.252 11.095 1.00 0.00 O ATOM 66526 H1 WAT 4212 144.527 132.968 10.858 1.00 0.00 H ATOM 66527 H2 WAT 4212 144.960 132.112 12.029 1.00 0.00 H TER 66529 WAT 4212 ATOM 66529 O WAT 4213 67.518 8.034 57.401 1.00 0.00 O ATOM 66530 H1 WAT 4213 68.133 8.704 57.103 1.00 0.00 H ATOM 66531 H2 WAT 4213 66.746 8.155 56.849 1.00 0.00 H TER 66533 WAT 4213 ATOM 66533 O WAT 4214 119.140 3.426 119.534 1.00 0.00 O ATOM 66534 H1 WAT 4214 118.613 4.103 119.957 1.00 0.00 H ATOM 66535 H2 WAT 4214 119.641 3.032 120.248 1.00 0.00 H TER 66537 WAT 4214 ATOM 66537 O WAT 4215 109.625 80.124 68.839 1.00 0.00 O ATOM 66538 H1 WAT 4215 110.090 79.297 68.963 1.00 0.00 H ATOM 66539 H2 WAT 4215 109.137 80.004 68.024 1.00 0.00 H TER 66541 WAT 4215 ATOM 66541 O WAT 4216 2.321 3.284 157.654 1.00 0.00 O ATOM 66542 H1 WAT 4216 2.209 3.766 158.474 1.00 0.00 H ATOM 66543 H2 WAT 4216 1.749 2.522 157.744 1.00 0.00 H TER 66545 WAT 4216 ATOM 66545 O WAT 4217 121.732 50.790 105.904 1.00 0.00 O ATOM 66546 H1 WAT 4217 121.912 50.030 106.457 1.00 0.00 H ATOM 66547 H2 WAT 4217 122.210 50.615 105.094 1.00 0.00 H TER 66549 WAT 4217 ATOM 66549 O WAT 4218 102.097 11.934 147.451 1.00 0.00 O ATOM 66550 H1 WAT 4218 102.796 11.292 147.569 1.00 0.00 H ATOM 66551 H2 WAT 4218 102.130 12.472 148.242 1.00 0.00 H TER 66553 WAT 4218 ATOM 66553 O WAT 4219 98.509 132.643 92.109 1.00 0.00 O ATOM 66554 H1 WAT 4219 98.850 133.492 91.829 1.00 0.00 H ATOM 66555 H2 WAT 4219 98.295 132.763 93.034 1.00 0.00 H TER 66557 WAT 4219 ATOM 66557 O WAT 4220 146.080 85.620 123.729 1.00 0.00 O ATOM 66558 H1 WAT 4220 145.961 86.559 123.874 1.00 0.00 H ATOM 66559 H2 WAT 4220 145.190 85.273 123.664 1.00 0.00 H TER 66561 WAT 4220 ATOM 66561 O WAT 4221 69.703 126.111 120.992 1.00 0.00 O ATOM 66562 H1 WAT 4221 70.453 125.607 120.674 1.00 0.00 H ATOM 66563 H2 WAT 4221 69.095 125.450 121.325 1.00 0.00 H TER 66565 WAT 4221 ATOM 66565 O WAT 4222 136.539 32.668 77.231 1.00 0.00 O ATOM 66566 H1 WAT 4222 136.907 33.527 77.434 1.00 0.00 H ATOM 66567 H2 WAT 4222 135.957 32.477 77.966 1.00 0.00 H TER 66569 WAT 4222 ATOM 66569 O WAT 4223 108.247 17.494 75.332 1.00 0.00 O ATOM 66570 H1 WAT 4223 108.020 17.513 74.402 1.00 0.00 H ATOM 66571 H2 WAT 4223 108.610 16.619 75.472 1.00 0.00 H TER 66573 WAT 4223 ATOM 66573 O WAT 4224 1.673 0.163 76.729 1.00 0.00 O ATOM 66574 H1 WAT 4224 1.159 0.656 76.090 1.00 0.00 H ATOM 66575 H2 WAT 4224 2.165 -0.468 76.205 1.00 0.00 H TER 66577 WAT 4224 ATOM 66577 O WAT 4225 34.340 40.061 9.804 1.00 0.00 O ATOM 66578 H1 WAT 4225 35.186 39.902 9.387 1.00 0.00 H ATOM 66579 H2 WAT 4225 34.043 40.893 9.434 1.00 0.00 H TER 66581 WAT 4225 ATOM 66581 O WAT 4226 59.256 79.460 99.414 1.00 0.00 O ATOM 66582 H1 WAT 4226 59.575 78.949 100.158 1.00 0.00 H ATOM 66583 H2 WAT 4226 59.026 78.805 98.755 1.00 0.00 H TER 66585 WAT 4226 ATOM 66585 O WAT 4227 15.562 8.962 83.471 1.00 0.00 O ATOM 66586 H1 WAT 4227 15.096 8.696 84.263 1.00 0.00 H ATOM 66587 H2 WAT 4227 15.207 8.399 82.783 1.00 0.00 H TER 66589 WAT 4227 ATOM 66589 O WAT 4228 57.195 44.705 1.210 1.00 0.00 O ATOM 66590 H1 WAT 4228 57.925 44.727 1.828 1.00 0.00 H ATOM 66591 H2 WAT 4228 57.231 45.552 0.767 1.00 0.00 H TER 66593 WAT 4228 ATOM 66593 O WAT 4229 35.287 16.671 125.952 1.00 0.00 O ATOM 66594 H1 WAT 4229 34.529 17.207 125.717 1.00 0.00 H ATOM 66595 H2 WAT 4229 36.035 17.138 125.579 1.00 0.00 H TER 66597 WAT 4229 ATOM 66597 O WAT 4230 125.061 76.533 78.812 1.00 0.00 O ATOM 66598 H1 WAT 4230 124.415 77.239 78.807 1.00 0.00 H ATOM 66599 H2 WAT 4230 125.203 76.332 77.887 1.00 0.00 H TER 66601 WAT 4230 ATOM 66601 O WAT 4231 117.673 60.112 111.867 1.00 0.00 O ATOM 66602 H1 WAT 4231 118.264 60.406 112.560 1.00 0.00 H ATOM 66603 H2 WAT 4231 116.827 60.497 112.093 1.00 0.00 H TER 66605 WAT 4231 ATOM 66605 O WAT 4232 15.156 60.135 -0.255 1.00 0.00 O ATOM 66606 H1 WAT 4232 14.501 60.638 0.229 1.00 0.00 H ATOM 66607 H2 WAT 4232 15.752 59.808 0.418 1.00 0.00 H TER 66609 WAT 4232 ATOM 66609 O WAT 4233 96.414 108.261 148.361 1.00 0.00 O ATOM 66610 H1 WAT 4233 96.725 107.570 148.946 1.00 0.00 H ATOM 66611 H2 WAT 4233 96.566 107.916 147.481 1.00 0.00 H TER 66613 WAT 4233 ATOM 66613 O WAT 4234 22.743 8.067 6.373 1.00 0.00 O ATOM 66614 H1 WAT 4234 22.583 8.335 5.468 1.00 0.00 H ATOM 66615 H2 WAT 4234 23.533 8.544 6.628 1.00 0.00 H TER 66617 WAT 4234 ATOM 66617 O WAT 4235 79.335 101.665 96.431 1.00 0.00 O ATOM 66618 H1 WAT 4235 78.782 102.061 95.758 1.00 0.00 H ATOM 66619 H2 WAT 4235 79.772 100.939 95.986 1.00 0.00 H TER 66621 WAT 4235 ATOM 66621 O WAT 4236 93.147 24.848 115.215 1.00 0.00 O ATOM 66622 H1 WAT 4236 93.531 25.719 115.316 1.00 0.00 H ATOM 66623 H2 WAT 4236 93.338 24.405 116.042 1.00 0.00 H TER 66625 WAT 4236 ATOM 66625 O WAT 4237 74.310 140.349 135.740 1.00 0.00 O ATOM 66626 H1 WAT 4237 74.959 140.997 135.467 1.00 0.00 H ATOM 66627 H2 WAT 4237 73.469 140.794 135.636 1.00 0.00 H TER 66629 WAT 4237 ATOM 66629 O WAT 4238 98.291 42.291 86.448 1.00 0.00 O ATOM 66630 H1 WAT 4238 97.675 42.650 85.809 1.00 0.00 H ATOM 66631 H2 WAT 4238 99.145 42.356 86.021 1.00 0.00 H TER 66633 WAT 4238 ATOM 66633 O WAT 4239 4.553 95.594 112.867 1.00 0.00 O ATOM 66634 H1 WAT 4239 5.132 95.684 112.111 1.00 0.00 H ATOM 66635 H2 WAT 4239 3.777 96.104 112.636 1.00 0.00 H TER 66637 WAT 4239 ATOM 66637 O WAT 4240 78.988 41.695 95.772 1.00 0.00 O ATOM 66638 H1 WAT 4240 78.488 41.134 96.365 1.00 0.00 H ATOM 66639 H2 WAT 4240 79.554 42.209 96.348 1.00 0.00 H TER 66641 WAT 4240 ATOM 66641 O WAT 4241 44.332 10.429 106.444 1.00 0.00 O ATOM 66642 H1 WAT 4241 44.616 9.820 105.762 1.00 0.00 H ATOM 66643 H2 WAT 4241 44.560 11.294 106.104 1.00 0.00 H TER 66645 WAT 4241 ATOM 66645 O WAT 4242 36.165 120.924 10.829 1.00 0.00 O ATOM 66646 H1 WAT 4242 36.814 120.487 10.278 1.00 0.00 H ATOM 66647 H2 WAT 4242 35.369 120.403 10.720 1.00 0.00 H TER 66649 WAT 4242 ATOM 66649 O WAT 4243 30.408 129.133 84.494 1.00 0.00 O ATOM 66650 H1 WAT 4243 29.478 129.357 84.532 1.00 0.00 H ATOM 66651 H2 WAT 4243 30.705 129.189 85.403 1.00 0.00 H TER 66653 WAT 4243 ATOM 66653 O WAT 4244 87.521 38.620 123.339 1.00 0.00 O ATOM 66654 H1 WAT 4244 88.287 38.096 123.575 1.00 0.00 H ATOM 66655 H2 WAT 4244 87.797 39.525 123.486 1.00 0.00 H TER 66657 WAT 4244 ATOM 66657 O WAT 4245 2.830 38.638 58.419 1.00 0.00 O ATOM 66658 H1 WAT 4245 3.049 37.765 58.746 1.00 0.00 H ATOM 66659 H2 WAT 4245 2.397 38.477 57.580 1.00 0.00 H TER 66661 WAT 4245 ATOM 66661 O WAT 4246 1.366 120.053 134.023 1.00 0.00 O ATOM 66662 H1 WAT 4246 2.146 120.529 133.740 1.00 0.00 H ATOM 66663 H2 WAT 4246 1.705 119.321 134.538 1.00 0.00 H TER 66665 WAT 4246 ATOM 66665 O WAT 4247 134.878 107.823 85.014 1.00 0.00 O ATOM 66666 H1 WAT 4247 134.835 108.621 84.488 1.00 0.00 H ATOM 66667 H2 WAT 4247 134.746 107.114 84.384 1.00 0.00 H TER 66669 WAT 4247 ATOM 66669 O WAT 4248 30.876 14.299 12.274 1.00 0.00 O ATOM 66670 H1 WAT 4248 30.816 13.828 11.443 1.00 0.00 H ATOM 66671 H2 WAT 4248 30.903 15.222 12.024 1.00 0.00 H TER 66673 WAT 4248 ATOM 66673 O WAT 4249 83.574 52.936 99.967 1.00 0.00 O ATOM 66674 H1 WAT 4249 83.293 52.526 100.784 1.00 0.00 H ATOM 66675 H2 WAT 4249 83.587 53.874 100.162 1.00 0.00 H TER 66677 WAT 4249 ATOM 66677 O WAT 4250 103.597 66.917 90.695 1.00 0.00 O ATOM 66678 H1 WAT 4250 103.138 67.562 91.234 1.00 0.00 H ATOM 66679 H2 WAT 4250 103.997 67.432 89.994 1.00 0.00 H TER 66681 WAT 4250 ATOM 66681 O WAT 4251 86.330 126.978 136.301 1.00 0.00 O ATOM 66682 H1 WAT 4251 87.201 126.582 136.308 1.00 0.00 H ATOM 66683 H2 WAT 4251 85.873 126.539 135.583 1.00 0.00 H TER 66685 WAT 4251 ATOM 66685 O WAT 4252 25.807 92.145 141.976 1.00 0.00 O ATOM 66686 H1 WAT 4252 25.786 92.650 142.789 1.00 0.00 H ATOM 66687 H2 WAT 4252 26.367 91.394 142.174 1.00 0.00 H TER 66689 WAT 4252 ATOM 66689 O WAT 4253 40.168 93.531 114.419 1.00 0.00 O ATOM 66690 H1 WAT 4253 39.696 93.069 113.726 1.00 0.00 H ATOM 66691 H2 WAT 4253 39.681 94.346 114.539 1.00 0.00 H TER 66693 WAT 4253 ATOM 66693 O WAT 4254 2.351 49.775 74.207 1.00 0.00 O ATOM 66694 H1 WAT 4254 1.865 49.215 74.813 1.00 0.00 H ATOM 66695 H2 WAT 4254 2.423 50.614 74.662 1.00 0.00 H TER 66697 WAT 4254 ATOM 66697 O WAT 4255 78.642 19.395 90.084 1.00 0.00 O ATOM 66698 H1 WAT 4255 79.356 19.268 89.459 1.00 0.00 H ATOM 66699 H2 WAT 4255 78.875 18.841 90.830 1.00 0.00 H TER 66701 WAT 4255 ATOM 66701 O WAT 4256 49.920 5.319 143.955 1.00 0.00 O ATOM 66702 H1 WAT 4256 49.405 4.882 143.276 1.00 0.00 H ATOM 66703 H2 WAT 4256 50.823 5.057 143.776 1.00 0.00 H TER 66705 WAT 4256 ATOM 66705 O WAT 4257 84.118 15.912 111.769 1.00 0.00 O ATOM 66706 H1 WAT 4257 83.957 16.786 112.125 1.00 0.00 H ATOM 66707 H2 WAT 4257 83.509 15.837 111.034 1.00 0.00 H TER 66709 WAT 4257 ATOM 66709 O WAT 4258 10.121 31.138 56.645 1.00 0.00 O ATOM 66710 H1 WAT 4258 9.532 31.508 55.988 1.00 0.00 H ATOM 66711 H2 WAT 4258 9.803 30.245 56.777 1.00 0.00 H TER 66713 WAT 4258 ATOM 66713 O WAT 4259 110.329 22.741 152.617 1.00 0.00 O ATOM 66714 H1 WAT 4259 109.969 22.763 153.504 1.00 0.00 H ATOM 66715 H2 WAT 4259 110.743 21.881 152.547 1.00 0.00 H TER 66717 WAT 4259 ATOM 66717 O WAT 4260 115.887 109.825 153.495 1.00 0.00 O ATOM 66718 H1 WAT 4260 115.197 110.230 154.021 1.00 0.00 H ATOM 66719 H2 WAT 4260 116.156 110.512 152.885 1.00 0.00 H TER 66721 WAT 4260 ATOM 66721 O WAT 4261 30.395 81.327 85.415 1.00 0.00 O ATOM 66722 H1 WAT 4261 30.382 80.371 85.453 1.00 0.00 H ATOM 66723 H2 WAT 4261 31.112 81.580 85.997 1.00 0.00 H TER 66725 WAT 4261 ATOM 66725 O WAT 4262 4.019 124.844 119.191 1.00 0.00 O ATOM 66726 H1 WAT 4262 3.836 124.600 120.098 1.00 0.00 H ATOM 66727 H2 WAT 4262 4.974 124.876 119.139 1.00 0.00 H TER 66729 WAT 4262 ATOM 66729 O WAT 4263 64.231 80.603 58.058 1.00 0.00 O ATOM 66730 H1 WAT 4263 64.692 80.391 57.246 1.00 0.00 H ATOM 66731 H2 WAT 4263 64.177 81.558 58.060 1.00 0.00 H TER 66733 WAT 4263 ATOM 66733 O WAT 4264 66.619 39.270 9.281 1.00 0.00 O ATOM 66734 H1 WAT 4264 66.105 38.900 9.998 1.00 0.00 H ATOM 66735 H2 WAT 4264 66.885 40.133 9.597 1.00 0.00 H TER 66737 WAT 4264 ATOM 66737 O WAT 4265 22.493 140.100 110.443 1.00 0.00 O ATOM 66738 H1 WAT 4265 22.723 140.989 110.712 1.00 0.00 H ATOM 66739 H2 WAT 4265 23.334 139.652 110.351 1.00 0.00 H TER 66741 WAT 4265 ATOM 66741 O WAT 4266 135.960 137.748 154.314 1.00 0.00 O ATOM 66742 H1 WAT 4266 135.160 138.258 154.187 1.00 0.00 H ATOM 66743 H2 WAT 4266 136.424 138.200 155.018 1.00 0.00 H TER 66745 WAT 4266 ATOM 66745 O WAT 4267 50.334 101.373 109.132 1.00 0.00 O ATOM 66746 H1 WAT 4267 49.425 101.088 109.223 1.00 0.00 H ATOM 66747 H2 WAT 4267 50.455 101.489 108.189 1.00 0.00 H TER 66749 WAT 4267 ATOM 66749 O WAT 4268 31.520 13.504 118.018 1.00 0.00 O ATOM 66750 H1 WAT 4268 31.937 12.832 117.479 1.00 0.00 H ATOM 66751 H2 WAT 4268 31.604 13.180 118.914 1.00 0.00 H TER 66753 WAT 4268 ATOM 66753 O WAT 4269 9.224 15.219 96.173 1.00 0.00 O ATOM 66754 H1 WAT 4269 9.754 15.665 96.834 1.00 0.00 H ATOM 66755 H2 WAT 4269 8.350 15.172 96.560 1.00 0.00 H TER 66757 WAT 4269 ATOM 66757 O WAT 4270 140.772 34.815 14.996 1.00 0.00 O ATOM 66758 H1 WAT 4270 140.599 35.444 15.696 1.00 0.00 H ATOM 66759 H2 WAT 4270 141.386 34.191 15.381 1.00 0.00 H TER 66761 WAT 4270 ATOM 66761 O WAT 4271 45.326 98.928 94.223 1.00 0.00 O ATOM 66762 H1 WAT 4271 44.435 98.576 94.216 1.00 0.00 H ATOM 66763 H2 WAT 4271 45.348 99.537 93.486 1.00 0.00 H TER 66765 WAT 4271 ATOM 66765 O WAT 4272 119.886 137.363 110.814 1.00 0.00 O ATOM 66766 H1 WAT 4272 119.596 137.411 111.725 1.00 0.00 H ATOM 66767 H2 WAT 4272 119.244 136.795 110.388 1.00 0.00 H TER 66769 WAT 4272 ATOM 66769 O WAT 4273 110.513 10.702 154.319 1.00 0.00 O ATOM 66770 H1 WAT 4273 110.556 11.555 153.887 1.00 0.00 H ATOM 66771 H2 WAT 4273 111.094 10.787 155.075 1.00 0.00 H TER 66773 WAT 4273 ATOM 66773 O WAT 4274 78.101 116.518 125.690 1.00 0.00 O ATOM 66774 H1 WAT 4274 77.653 115.997 125.023 1.00 0.00 H ATOM 66775 H2 WAT 4274 77.469 117.194 125.931 1.00 0.00 H TER 66777 WAT 4274 ATOM 66777 O WAT 4275 87.922 122.055 88.690 1.00 0.00 O ATOM 66778 H1 WAT 4275 88.725 122.519 88.454 1.00 0.00 H ATOM 66779 H2 WAT 4275 87.494 121.876 87.852 1.00 0.00 H TER 66781 WAT 4275 ATOM 66781 O WAT 4276 101.591 144.733 135.788 1.00 0.00 O ATOM 66782 H1 WAT 4276 101.372 144.400 134.918 1.00 0.00 H ATOM 66783 H2 WAT 4276 100.743 144.887 136.206 1.00 0.00 H TER 66785 WAT 4276 ATOM 66785 O WAT 4277 59.872 133.075 5.211 1.00 0.00 O ATOM 66786 H1 WAT 4277 60.041 133.364 6.107 1.00 0.00 H ATOM 66787 H2 WAT 4277 59.972 133.865 4.681 1.00 0.00 H TER 66789 WAT 4277 ATOM 66789 O WAT 4278 114.100 39.236 87.115 1.00 0.00 O ATOM 66790 H1 WAT 4278 113.936 39.400 88.043 1.00 0.00 H ATOM 66791 H2 WAT 4278 114.258 38.293 87.062 1.00 0.00 H TER 66793 WAT 4278 ATOM 66793 O WAT 4279 60.276 134.169 99.330 1.00 0.00 O ATOM 66794 H1 WAT 4279 59.951 133.335 99.671 1.00 0.00 H ATOM 66795 H2 WAT 4279 59.591 134.800 99.550 1.00 0.00 H TER 66797 WAT 4279 ATOM 66797 O WAT 4280 109.248 108.074 5.882 1.00 0.00 O ATOM 66798 H1 WAT 4280 109.696 107.294 6.209 1.00 0.00 H ATOM 66799 H2 WAT 4280 109.727 108.806 6.272 1.00 0.00 H TER 66801 WAT 4280 ATOM 66801 O WAT 4281 103.362 117.226 75.263 1.00 0.00 O ATOM 66802 H1 WAT 4281 104.115 117.634 74.834 1.00 0.00 H ATOM 66803 H2 WAT 4281 102.864 116.832 74.547 1.00 0.00 H TER 66805 WAT 4281 ATOM 66805 O WAT 4282 105.491 145.987 7.385 1.00 0.00 O ATOM 66806 H1 WAT 4282 106.332 146.294 7.047 1.00 0.00 H ATOM 66807 H2 WAT 4282 105.660 145.088 7.666 1.00 0.00 H TER 66809 WAT 4282 ATOM 66809 O WAT 4283 47.550 84.744 105.405 1.00 0.00 O ATOM 66810 H1 WAT 4283 46.729 85.232 105.343 1.00 0.00 H ATOM 66811 H2 WAT 4283 47.709 84.429 104.515 1.00 0.00 H TER 66813 WAT 4283 ATOM 66813 O WAT 4284 121.588 64.647 138.899 1.00 0.00 O ATOM 66814 H1 WAT 4284 122.139 64.175 138.275 1.00 0.00 H ATOM 66815 H2 WAT 4284 121.370 65.467 138.455 1.00 0.00 H TER 66817 WAT 4284 ATOM 66817 O WAT 4285 86.915 125.451 76.204 1.00 0.00 O ATOM 66818 H1 WAT 4285 87.372 126.132 76.698 1.00 0.00 H ATOM 66819 H2 WAT 4285 87.584 124.788 76.034 1.00 0.00 H TER 66821 WAT 4285 ATOM 66821 O WAT 4286 123.379 71.080 12.206 1.00 0.00 O ATOM 66822 H1 WAT 4286 123.411 72.026 12.059 1.00 0.00 H ATOM 66823 H2 WAT 4286 123.129 70.989 13.125 1.00 0.00 H TER 66825 WAT 4286 ATOM 66825 O WAT 4287 54.351 72.567 103.213 1.00 0.00 O ATOM 66826 H1 WAT 4287 53.675 71.931 103.446 1.00 0.00 H ATOM 66827 H2 WAT 4287 55.002 72.491 103.910 1.00 0.00 H TER 66829 WAT 4287 ATOM 66829 O WAT 4288 94.020 106.029 76.339 1.00 0.00 O ATOM 66830 H1 WAT 4288 93.281 105.973 76.944 1.00 0.00 H ATOM 66831 H2 WAT 4288 94.678 106.539 76.811 1.00 0.00 H TER 66833 WAT 4288 ATOM 66833 O WAT 4289 138.015 15.981 110.904 1.00 0.00 O ATOM 66834 H1 WAT 4289 137.780 15.073 111.099 1.00 0.00 H ATOM 66835 H2 WAT 4289 138.854 15.918 110.447 1.00 0.00 H TER 66837 WAT 4289 ATOM 66837 O WAT 4290 12.136 7.981 124.305 1.00 0.00 O ATOM 66838 H1 WAT 4290 11.225 8.269 124.249 1.00 0.00 H ATOM 66839 H2 WAT 4290 12.418 7.902 123.393 1.00 0.00 H TER 66841 WAT 4290 ATOM 66841 O WAT 4291 49.716 119.752 129.692 1.00 0.00 O ATOM 66842 H1 WAT 4291 49.768 120.706 129.745 1.00 0.00 H ATOM 66843 H2 WAT 4291 50.608 119.476 129.480 1.00 0.00 H TER 66845 WAT 4291 ATOM 66845 O WAT 4292 90.690 119.352 131.964 1.00 0.00 O ATOM 66846 H1 WAT 4292 90.529 119.926 132.712 1.00 0.00 H ATOM 66847 H2 WAT 4292 90.311 118.511 132.221 1.00 0.00 H TER 66849 WAT 4292 ATOM 66849 O WAT 4293 60.707 94.701 92.307 1.00 0.00 O ATOM 66850 H1 WAT 4293 60.633 95.300 91.564 1.00 0.00 H ATOM 66851 H2 WAT 4293 61.394 94.085 92.051 1.00 0.00 H TER 66853 WAT 4293 ATOM 66853 O WAT 4294 47.638 47.909 76.541 1.00 0.00 O ATOM 66854 H1 WAT 4294 48.413 48.345 76.896 1.00 0.00 H ATOM 66855 H2 WAT 4294 47.126 48.616 76.146 1.00 0.00 H TER 66857 WAT 4294 ATOM 66857 O WAT 4295 64.004 16.940 75.400 1.00 0.00 O ATOM 66858 H1 WAT 4295 64.382 17.634 74.861 1.00 0.00 H ATOM 66859 H2 WAT 4295 63.081 17.178 75.485 1.00 0.00 H TER 66861 WAT 4295 ATOM 66861 O WAT 4296 17.052 141.120 12.455 1.00 0.00 O ATOM 66862 H1 WAT 4296 16.383 141.477 13.039 1.00 0.00 H ATOM 66863 H2 WAT 4296 17.803 141.703 12.568 1.00 0.00 H TER 66865 WAT 4296 ATOM 66865 O WAT 4297 127.304 4.636 136.344 1.00 0.00 O ATOM 66866 H1 WAT 4297 127.442 5.498 135.951 1.00 0.00 H ATOM 66867 H2 WAT 4297 126.387 4.432 136.159 1.00 0.00 H TER 66869 WAT 4297 ATOM 66869 O WAT 4298 61.698 51.431 4.409 1.00 0.00 O ATOM 66870 H1 WAT 4298 61.080 52.150 4.276 1.00 0.00 H ATOM 66871 H2 WAT 4298 62.546 51.861 4.518 1.00 0.00 H TER 66873 WAT 4298 ATOM 66873 O WAT 4299 60.198 48.501 85.989 1.00 0.00 O ATOM 66874 H1 WAT 4299 60.205 47.543 85.983 1.00 0.00 H ATOM 66875 H2 WAT 4299 61.019 48.749 85.564 1.00 0.00 H TER 66877 WAT 4299 ATOM 66877 O WAT 4300 79.274 51.894 21.910 1.00 0.00 O ATOM 66878 H1 WAT 4300 79.643 52.409 22.628 1.00 0.00 H ATOM 66879 H2 WAT 4300 78.328 51.923 22.056 1.00 0.00 H TER 66881 WAT 4300 ATOM 66881 O WAT 4301 2.230 81.916 96.074 1.00 0.00 O ATOM 66882 H1 WAT 4301 2.173 82.838 95.823 1.00 0.00 H ATOM 66883 H2 WAT 4301 1.473 81.775 96.642 1.00 0.00 H TER 66885 WAT 4301 ATOM 66885 O WAT 4302 107.826 97.148 88.074 1.00 0.00 O ATOM 66886 H1 WAT 4302 108.503 96.623 87.647 1.00 0.00 H ATOM 66887 H2 WAT 4302 107.300 97.493 87.353 1.00 0.00 H TER 66889 WAT 4302 ATOM 66889 O WAT 4303 139.573 43.825 7.055 1.00 0.00 O ATOM 66890 H1 WAT 4303 139.890 43.777 7.956 1.00 0.00 H ATOM 66891 H2 WAT 4303 139.376 44.752 6.919 1.00 0.00 H TER 66893 WAT 4303 ATOM 66893 O WAT 4304 52.710 49.056 0.849 1.00 0.00 O ATOM 66894 H1 WAT 4304 52.092 49.472 1.450 1.00 0.00 H ATOM 66895 H2 WAT 4304 52.445 48.137 0.831 1.00 0.00 H TER 66897 WAT 4304 ATOM 66897 O WAT 4305 58.189 139.783 71.150 1.00 0.00 O ATOM 66898 H1 WAT 4305 58.565 140.255 71.893 1.00 0.00 H ATOM 66899 H2 WAT 4305 57.511 140.369 70.812 1.00 0.00 H TER 66901 WAT 4305 ATOM 66901 O WAT 4306 77.598 94.017 147.097 1.00 0.00 O ATOM 66902 H1 WAT 4306 77.793 94.876 146.724 1.00 0.00 H ATOM 66903 H2 WAT 4306 77.245 93.511 146.365 1.00 0.00 H TER 66905 WAT 4306 ATOM 66905 O WAT 4307 83.406 25.389 99.308 1.00 0.00 O ATOM 66906 H1 WAT 4307 83.585 24.806 100.047 1.00 0.00 H ATOM 66907 H2 WAT 4307 83.615 26.263 99.637 1.00 0.00 H TER 66909 WAT 4307 ATOM 66909 O WAT 4308 97.889 8.386 52.557 1.00 0.00 O ATOM 66910 H1 WAT 4308 98.632 8.458 51.958 1.00 0.00 H ATOM 66911 H2 WAT 4308 98.142 8.911 53.317 1.00 0.00 H TER 66913 WAT 4308 ATOM 66913 O WAT 4309 66.637 108.754 8.414 1.00 0.00 O ATOM 66914 H1 WAT 4309 65.854 108.244 8.624 1.00 0.00 H ATOM 66915 H2 WAT 4309 66.575 108.910 7.471 1.00 0.00 H TER 66917 WAT 4309 ATOM 66917 O WAT 4310 120.182 64.026 25.990 1.00 0.00 O ATOM 66918 H1 WAT 4310 120.221 63.213 26.494 1.00 0.00 H ATOM 66919 H2 WAT 4310 119.440 63.904 25.397 1.00 0.00 H TER 66921 WAT 4310 ATOM 66921 O WAT 4311 145.502 138.453 151.336 1.00 0.00 O ATOM 66922 H1 WAT 4311 145.285 138.813 150.476 1.00 0.00 H ATOM 66923 H2 WAT 4311 146.406 138.727 151.489 1.00 0.00 H TER 66925 WAT 4311 ATOM 66925 O WAT 4312 48.647 142.405 59.278 1.00 0.00 O ATOM 66926 H1 WAT 4312 48.399 142.039 58.429 1.00 0.00 H ATOM 66927 H2 WAT 4312 48.471 143.342 59.196 1.00 0.00 H TER 66929 WAT 4312 ATOM 66929 O WAT 4313 80.971 90.826 93.947 1.00 0.00 O ATOM 66930 H1 WAT 4313 80.411 91.262 94.590 1.00 0.00 H ATOM 66931 H2 WAT 4313 81.823 91.252 94.044 1.00 0.00 H TER 66933 WAT 4313 ATOM 66933 O WAT 4314 135.511 142.444 129.470 1.00 0.00 O ATOM 66934 H1 WAT 4314 134.786 142.689 128.895 1.00 0.00 H ATOM 66935 H2 WAT 4314 135.490 141.487 129.488 1.00 0.00 H TER 66937 WAT 4314 ATOM 66937 O WAT 4315 92.742 37.922 100.475 1.00 0.00 O ATOM 66938 H1 WAT 4315 92.305 37.246 99.956 1.00 0.00 H ATOM 66939 H2 WAT 4315 92.567 37.676 101.383 1.00 0.00 H TER 66941 WAT 4315 ATOM 66941 O WAT 4316 116.938 30.219 19.315 1.00 0.00 O ATOM 66942 H1 WAT 4316 117.853 30.025 19.519 1.00 0.00 H ATOM 66943 H2 WAT 4316 116.802 31.106 19.647 1.00 0.00 H TER 66945 WAT 4316 ATOM 66945 O WAT 4317 118.571 108.604 144.509 1.00 0.00 O ATOM 66946 H1 WAT 4317 119.264 108.078 144.110 1.00 0.00 H ATOM 66947 H2 WAT 4317 118.514 109.384 143.958 1.00 0.00 H TER 66949 WAT 4317 ATOM 66949 O WAT 4318 103.365 6.331 61.042 1.00 0.00 O ATOM 66950 H1 WAT 4318 102.987 7.027 61.580 1.00 0.00 H ATOM 66951 H2 WAT 4318 102.615 5.942 60.592 1.00 0.00 H TER 66953 WAT 4318 ATOM 66953 O WAT 4319 13.933 132.214 79.645 1.00 0.00 O ATOM 66954 H1 WAT 4319 14.194 131.424 80.118 1.00 0.00 H ATOM 66955 H2 WAT 4319 13.198 132.564 80.148 1.00 0.00 H TER 66957 WAT 4319 ATOM 66957 O WAT 4320 95.927 44.347 102.186 1.00 0.00 O ATOM 66958 H1 WAT 4320 96.688 43.855 101.877 1.00 0.00 H ATOM 66959 H2 WAT 4320 95.849 45.078 101.572 1.00 0.00 H TER 66961 WAT 4320 ATOM 66961 O WAT 4321 96.514 142.105 157.359 1.00 0.00 O ATOM 66962 H1 WAT 4321 96.714 142.444 158.231 1.00 0.00 H ATOM 66963 H2 WAT 4321 95.623 142.407 157.183 1.00 0.00 H TER 66965 WAT 4321 ATOM 66965 O WAT 4322 85.800 26.251 81.847 1.00 0.00 O ATOM 66966 H1 WAT 4322 85.066 26.124 82.448 1.00 0.00 H ATOM 66967 H2 WAT 4322 85.981 25.377 81.501 1.00 0.00 H TER 66969 WAT 4322 ATOM 66969 O WAT 4323 73.779 144.314 17.006 1.00 0.00 O ATOM 66970 H1 WAT 4323 74.350 143.925 17.668 1.00 0.00 H ATOM 66971 H2 WAT 4323 74.378 144.615 16.321 1.00 0.00 H TER 66973 WAT 4323 ATOM 66973 O WAT 4324 122.930 15.927 71.296 1.00 0.00 O ATOM 66974 H1 WAT 4324 122.706 16.843 71.129 1.00 0.00 H ATOM 66975 H2 WAT 4324 122.286 15.637 71.942 1.00 0.00 H TER 66977 WAT 4324 ATOM 66977 O WAT 4325 75.100 141.049 103.218 1.00 0.00 O ATOM 66978 H1 WAT 4325 75.127 140.168 102.845 1.00 0.00 H ATOM 66979 H2 WAT 4325 74.756 140.924 104.102 1.00 0.00 H TER 66981 WAT 4325 ATOM 66981 O WAT 4326 14.557 74.963 18.569 1.00 0.00 O ATOM 66982 H1 WAT 4326 15.289 75.065 19.178 1.00 0.00 H ATOM 66983 H2 WAT 4326 14.319 74.038 18.634 1.00 0.00 H TER 66985 WAT 4326 ATOM 66985 O WAT 4327 135.061 50.234 68.059 1.00 0.00 O ATOM 66986 H1 WAT 4327 135.689 50.942 68.200 1.00 0.00 H ATOM 66987 H2 WAT 4327 134.958 49.831 68.921 1.00 0.00 H TER 66989 WAT 4327 ATOM 66989 O WAT 4328 145.691 80.322 127.239 1.00 0.00 O ATOM 66990 H1 WAT 4328 146.265 79.865 127.854 1.00 0.00 H ATOM 66991 H2 WAT 4328 144.806 80.125 127.545 1.00 0.00 H TER 66993 WAT 4328 ATOM 66993 O WAT 4329 117.558 40.443 117.016 1.00 0.00 O ATOM 66994 H1 WAT 4329 117.038 40.336 116.220 1.00 0.00 H ATOM 66995 H2 WAT 4329 117.043 41.040 117.560 1.00 0.00 H TER 66997 WAT 4329 ATOM 66997 O WAT 4330 58.547 76.221 133.808 1.00 0.00 O ATOM 66998 H1 WAT 4330 59.204 76.521 134.436 1.00 0.00 H ATOM 66999 H2 WAT 4330 57.874 75.805 134.347 1.00 0.00 H TER 67001 WAT 4330 ATOM 67001 O WAT 4331 11.236 124.481 125.936 1.00 0.00 O ATOM 67002 H1 WAT 4331 10.970 125.177 125.336 1.00 0.00 H ATOM 67003 H2 WAT 4331 11.898 124.888 126.496 1.00 0.00 H TER 67005 WAT 4331 ATOM 67005 O WAT 4332 61.775 32.512 71.193 1.00 0.00 O ATOM 67006 H1 WAT 4332 61.849 33.324 70.691 1.00 0.00 H ATOM 67007 H2 WAT 4332 62.198 31.852 70.645 1.00 0.00 H TER 67009 WAT 4332 ATOM 67009 O WAT 4333 117.892 81.747 104.543 1.00 0.00 O ATOM 67010 H1 WAT 4333 118.117 82.595 104.161 1.00 0.00 H ATOM 67011 H2 WAT 4333 117.208 81.946 105.182 1.00 0.00 H TER 67013 WAT 4333 ATOM 67013 O WAT 4334 39.356 4.139 132.204 1.00 0.00 O ATOM 67014 H1 WAT 4334 38.404 4.167 132.110 1.00 0.00 H ATOM 67015 H2 WAT 4334 39.579 4.967 132.630 1.00 0.00 H TER 67017 WAT 4334 ATOM 67017 O WAT 4335 9.610 110.888 90.124 1.00 0.00 O ATOM 67018 H1 WAT 4335 9.574 111.503 89.392 1.00 0.00 H ATOM 67019 H2 WAT 4335 8.877 110.291 89.972 1.00 0.00 H TER 67021 WAT 4335 ATOM 67021 O WAT 4336 101.368 144.267 132.476 1.00 0.00 O ATOM 67022 H1 WAT 4336 101.114 145.166 132.683 1.00 0.00 H ATOM 67023 H2 WAT 4336 101.713 144.314 131.584 1.00 0.00 H TER 67025 WAT 4336 ATOM 67025 O WAT 4337 114.274 83.332 126.184 1.00 0.00 O ATOM 67026 H1 WAT 4337 115.189 83.347 126.462 1.00 0.00 H ATOM 67027 H2 WAT 4337 113.780 83.185 126.991 1.00 0.00 H TER 67029 WAT 4337 ATOM 67029 O WAT 4338 47.869 45.825 65.812 1.00 0.00 O ATOM 67030 H1 WAT 4338 48.505 46.417 65.410 1.00 0.00 H ATOM 67031 H2 WAT 4338 48.394 45.255 66.374 1.00 0.00 H TER 67033 WAT 4338 ATOM 67033 O WAT 4339 121.224 134.641 113.438 1.00 0.00 O ATOM 67034 H1 WAT 4339 121.330 134.076 114.203 1.00 0.00 H ATOM 67035 H2 WAT 4339 121.986 135.221 113.462 1.00 0.00 H TER 67037 WAT 4339 ATOM 67037 O WAT 4340 17.055 3.657 123.644 1.00 0.00 O ATOM 67038 H1 WAT 4340 16.721 2.763 123.719 1.00 0.00 H ATOM 67039 H2 WAT 4340 17.999 3.571 123.774 1.00 0.00 H TER 67041 WAT 4340 ATOM 67041 O WAT 4341 84.441 66.074 101.281 1.00 0.00 O ATOM 67042 H1 WAT 4341 84.933 66.833 101.594 1.00 0.00 H ATOM 67043 H2 WAT 4341 83.702 66.001 101.886 1.00 0.00 H TER 67045 WAT 4341 ATOM 67045 O WAT 4342 48.093 108.642 112.958 1.00 0.00 O ATOM 67046 H1 WAT 4342 48.218 109.390 113.542 1.00 0.00 H ATOM 67047 H2 WAT 4342 48.331 107.882 113.489 1.00 0.00 H TER 67049 WAT 4342 ATOM 67049 O WAT 4343 17.912 144.718 65.392 1.00 0.00 O ATOM 67050 H1 WAT 4343 18.564 145.328 65.737 1.00 0.00 H ATOM 67051 H2 WAT 4343 17.091 144.988 65.803 1.00 0.00 H TER 67053 WAT 4343 ATOM 67053 O WAT 4344 77.292 33.198 97.345 1.00 0.00 O ATOM 67054 H1 WAT 4344 76.748 33.970 97.502 1.00 0.00 H ATOM 67055 H2 WAT 4344 77.960 33.498 96.729 1.00 0.00 H TER 67057 WAT 4344 ATOM 67057 O WAT 4345 125.664 141.545 92.085 1.00 0.00 O ATOM 67058 H1 WAT 4345 125.555 141.833 91.178 1.00 0.00 H ATOM 67059 H2 WAT 4345 126.573 141.250 92.136 1.00 0.00 H TER 67061 WAT 4345 ATOM 67061 O WAT 4346 45.213 135.855 87.909 1.00 0.00 O ATOM 67062 H1 WAT 4346 44.848 134.975 88.005 1.00 0.00 H ATOM 67063 H2 WAT 4346 45.380 136.144 88.806 1.00 0.00 H TER 67065 WAT 4346 ATOM 67065 O WAT 4347 43.036 29.884 137.884 1.00 0.00 O ATOM 67066 H1 WAT 4347 42.897 30.545 138.562 1.00 0.00 H ATOM 67067 H2 WAT 4347 42.153 29.617 137.626 1.00 0.00 H TER 67069 WAT 4347 ATOM 67069 O WAT 4348 20.253 132.957 84.087 1.00 0.00 O ATOM 67070 H1 WAT 4348 20.265 132.041 84.365 1.00 0.00 H ATOM 67071 H2 WAT 4348 19.324 133.163 83.979 1.00 0.00 H TER 67073 WAT 4348 ATOM 67073 O WAT 4349 119.704 18.403 142.432 1.00 0.00 O ATOM 67074 H1 WAT 4349 120.631 18.578 142.597 1.00 0.00 H ATOM 67075 H2 WAT 4349 119.688 17.994 141.567 1.00 0.00 H TER 67077 WAT 4349 ATOM 67077 O WAT 4350 34.773 45.925 128.470 1.00 0.00 O ATOM 67078 H1 WAT 4350 34.258 45.797 127.673 1.00 0.00 H ATOM 67079 H2 WAT 4350 34.159 46.318 129.091 1.00 0.00 H TER 67081 WAT 4350 ATOM 67081 O WAT 4351 34.558 50.772 96.701 1.00 0.00 O ATOM 67082 H1 WAT 4351 33.704 51.169 96.869 1.00 0.00 H ATOM 67083 H2 WAT 4351 34.592 50.670 95.750 1.00 0.00 H TER 67085 WAT 4351 ATOM 67085 O WAT 4352 111.533 73.192 89.664 1.00 0.00 O ATOM 67086 H1 WAT 4352 111.200 72.350 89.972 1.00 0.00 H ATOM 67087 H2 WAT 4352 110.949 73.840 90.058 1.00 0.00 H TER 67089 WAT 4352 ATOM 67089 O WAT 4353 46.671 112.335 126.276 1.00 0.00 O ATOM 67090 H1 WAT 4353 45.756 112.223 126.019 1.00 0.00 H ATOM 67091 H2 WAT 4353 47.087 111.504 126.049 1.00 0.00 H TER 67093 WAT 4353 ATOM 67093 O WAT 4354 28.871 127.899 129.385 1.00 0.00 O ATOM 67094 H1 WAT 4354 28.786 127.545 130.271 1.00 0.00 H ATOM 67095 H2 WAT 4354 29.804 128.092 129.294 1.00 0.00 H TER 67097 WAT 4354 ATOM 67097 O WAT 4355 119.927 45.990 107.750 1.00 0.00 O ATOM 67098 H1 WAT 4355 119.899 45.142 108.192 1.00 0.00 H ATOM 67099 H2 WAT 4355 119.739 46.626 108.440 1.00 0.00 H TER 67101 WAT 4355 ATOM 67101 O WAT 4356 80.014 96.551 8.402 1.00 0.00 O ATOM 67102 H1 WAT 4356 80.460 96.491 9.247 1.00 0.00 H ATOM 67103 H2 WAT 4356 80.391 95.843 7.881 1.00 0.00 H TER 67105 WAT 4356 ATOM 67105 O WAT 4357 15.886 7.783 23.541 1.00 0.00 O ATOM 67106 H1 WAT 4357 16.441 7.455 24.248 1.00 0.00 H ATOM 67107 H2 WAT 4357 16.434 8.419 23.081 1.00 0.00 H TER 67109 WAT 4357 ATOM 67109 O WAT 4358 116.734 112.934 82.327 1.00 0.00 O ATOM 67110 H1 WAT 4358 116.821 113.728 81.799 1.00 0.00 H ATOM 67111 H2 WAT 4358 115.797 112.874 82.516 1.00 0.00 H TER 67113 WAT 4358 ATOM 67113 O WAT 4359 5.132 78.987 119.433 1.00 0.00 O ATOM 67114 H1 WAT 4359 4.180 79.067 119.487 1.00 0.00 H ATOM 67115 H2 WAT 4359 5.443 79.229 120.305 1.00 0.00 H TER 67117 WAT 4359 ATOM 67117 O WAT 4360 43.368 81.442 69.263 1.00 0.00 O ATOM 67118 H1 WAT 4360 43.971 82.134 68.991 1.00 0.00 H ATOM 67119 H2 WAT 4360 43.361 80.829 68.527 1.00 0.00 H TER 67121 WAT 4360 ATOM 67121 O WAT 4361 44.122 117.640 150.254 1.00 0.00 O ATOM 67122 H1 WAT 4361 43.697 117.652 149.396 1.00 0.00 H ATOM 67123 H2 WAT 4361 45.058 117.596 150.057 1.00 0.00 H TER 67125 WAT 4361 ATOM 67125 O WAT 4362 63.158 33.274 95.683 1.00 0.00 O ATOM 67126 H1 WAT 4362 63.000 32.983 94.785 1.00 0.00 H ATOM 67127 H2 WAT 4362 64.018 33.692 95.652 1.00 0.00 H TER 67129 WAT 4362 ATOM 67129 O WAT 4363 134.854 59.282 85.732 1.00 0.00 O ATOM 67130 H1 WAT 4363 133.922 59.134 85.572 1.00 0.00 H ATOM 67131 H2 WAT 4363 135.026 58.848 86.568 1.00 0.00 H TER 67133 WAT 4363 ATOM 67133 O WAT 4364 124.738 92.113 26.190 1.00 0.00 O ATOM 67134 H1 WAT 4364 125.486 91.610 26.513 1.00 0.00 H ATOM 67135 H2 WAT 4364 124.661 92.846 26.802 1.00 0.00 H TER 67137 WAT 4364 ATOM 67137 O WAT 4365 119.222 96.760 70.051 1.00 0.00 O ATOM 67138 H1 WAT 4365 119.958 97.114 69.551 1.00 0.00 H ATOM 67139 H2 WAT 4365 119.613 96.458 70.870 1.00 0.00 H TER 67141 WAT 4365 ATOM 67141 O WAT 4366 138.502 40.635 146.587 1.00 0.00 O ATOM 67142 H1 WAT 4366 137.582 40.843 146.427 1.00 0.00 H ATOM 67143 H2 WAT 4366 138.497 40.145 147.409 1.00 0.00 H TER 67145 WAT 4366 ATOM 67145 O WAT 4367 114.245 78.076 90.269 1.00 0.00 O ATOM 67146 H1 WAT 4367 114.166 77.354 90.892 1.00 0.00 H ATOM 67147 H2 WAT 4367 113.830 77.749 89.470 1.00 0.00 H TER 67149 WAT 4367 ATOM 67149 O WAT 4368 3.366 46.448 146.029 1.00 0.00 O ATOM 67150 H1 WAT 4368 3.301 47.398 145.934 1.00 0.00 H ATOM 67151 H2 WAT 4368 4.276 46.246 145.812 1.00 0.00 H TER 67153 WAT 4368 ATOM 67153 O WAT 4369 142.994 3.654 9.318 1.00 0.00 O ATOM 67154 H1 WAT 4369 143.017 2.963 9.980 1.00 0.00 H ATOM 67155 H2 WAT 4369 143.879 4.018 9.322 1.00 0.00 H TER 67157 WAT 4369 ATOM 67157 O WAT 4370 102.760 135.502 141.163 1.00 0.00 O ATOM 67158 H1 WAT 4370 101.859 135.824 141.153 1.00 0.00 H ATOM 67159 H2 WAT 4370 103.178 135.985 141.876 1.00 0.00 H TER 67161 WAT 4370 ATOM 67161 O WAT 4371 123.542 71.694 85.408 1.00 0.00 O ATOM 67162 H1 WAT 4371 123.587 70.843 84.970 1.00 0.00 H ATOM 67163 H2 WAT 4371 124.405 71.803 85.807 1.00 0.00 H TER 67165 WAT 4371 ATOM 67165 O WAT 4372 92.353 44.253 99.667 1.00 0.00 O ATOM 67166 H1 WAT 4372 93.054 43.722 100.044 1.00 0.00 H ATOM 67167 H2 WAT 4372 91.595 43.668 99.646 1.00 0.00 H TER 67169 WAT 4372 ATOM 67169 O WAT 4373 110.722 62.964 133.533 1.00 0.00 O ATOM 67170 H1 WAT 4373 111.267 63.411 134.181 1.00 0.00 H ATOM 67171 H2 WAT 4373 110.230 62.318 134.039 1.00 0.00 H TER 67173 WAT 4373 ATOM 67173 O WAT 4374 19.931 105.293 69.042 1.00 0.00 O ATOM 67174 H1 WAT 4374 19.099 105.583 69.415 1.00 0.00 H ATOM 67175 H2 WAT 4374 19.729 104.453 68.630 1.00 0.00 H TER 67177 WAT 4374 ATOM 67177 O WAT 4375 132.858 13.426 106.187 1.00 0.00 O ATOM 67178 H1 WAT 4375 132.824 13.294 107.134 1.00 0.00 H ATOM 67179 H2 WAT 4375 133.611 14.001 106.052 1.00 0.00 H TER 67181 WAT 4375 ATOM 67181 O WAT 4376 9.028 137.719 141.737 1.00 0.00 O ATOM 67182 H1 WAT 4376 8.631 137.030 141.204 1.00 0.00 H ATOM 67183 H2 WAT 4376 8.370 138.414 141.758 1.00 0.00 H TER 67185 WAT 4376 ATOM 67185 O WAT 4377 99.280 129.260 122.291 1.00 0.00 O ATOM 67186 H1 WAT 4377 98.753 129.520 123.046 1.00 0.00 H ATOM 67187 H2 WAT 4377 99.010 128.360 122.108 1.00 0.00 H TER 67189 WAT 4377 ATOM 67189 O WAT 4378 36.802 15.046 99.851 1.00 0.00 O ATOM 67190 H1 WAT 4378 36.724 14.511 99.061 1.00 0.00 H ATOM 67191 H2 WAT 4378 37.352 14.528 100.438 1.00 0.00 H TER 67193 WAT 4378 ATOM 67193 O WAT 4379 130.378 58.610 21.105 1.00 0.00 O ATOM 67194 H1 WAT 4379 130.084 59.211 21.790 1.00 0.00 H ATOM 67195 H2 WAT 4379 130.164 57.740 21.443 1.00 0.00 H TER 67197 WAT 4379 ATOM 67197 O WAT 4380 90.567 49.898 66.947 1.00 0.00 O ATOM 67198 H1 WAT 4380 90.540 49.253 66.240 1.00 0.00 H ATOM 67199 H2 WAT 4380 89.784 49.717 67.466 1.00 0.00 H TER 67201 WAT 4380 ATOM 67201 O WAT 4381 45.785 117.048 76.176 1.00 0.00 O ATOM 67202 H1 WAT 4381 44.991 117.051 75.641 1.00 0.00 H ATOM 67203 H2 WAT 4381 45.562 117.579 76.940 1.00 0.00 H TER 67205 WAT 4381 ATOM 67205 O WAT 4382 137.970 5.088 86.570 1.00 0.00 O ATOM 67206 H1 WAT 4382 137.889 4.230 86.154 1.00 0.00 H ATOM 67207 H2 WAT 4382 138.744 5.012 87.128 1.00 0.00 H TER 67209 WAT 4382 ATOM 67209 O WAT 4383 109.363 80.664 110.520 1.00 0.00 O ATOM 67210 H1 WAT 4383 109.709 80.132 109.803 1.00 0.00 H ATOM 67211 H2 WAT 4383 109.594 80.179 111.312 1.00 0.00 H TER 67213 WAT 4383 ATOM 67213 O WAT 4384 126.706 45.839 4.080 1.00 0.00 O ATOM 67214 H1 WAT 4384 127.454 46.159 4.583 1.00 0.00 H ATOM 67215 H2 WAT 4384 126.334 46.625 3.679 1.00 0.00 H TER 67217 WAT 4384 ATOM 67217 O WAT 4385 104.145 125.143 155.662 1.00 0.00 O ATOM 67218 H1 WAT 4385 103.910 125.305 154.748 1.00 0.00 H ATOM 67219 H2 WAT 4385 104.860 125.754 155.837 1.00 0.00 H TER 67221 WAT 4385 ATOM 67221 O WAT 4386 14.782 8.523 104.182 1.00 0.00 O ATOM 67222 H1 WAT 4386 15.283 9.220 103.759 1.00 0.00 H ATOM 67223 H2 WAT 4386 14.339 8.955 104.912 1.00 0.00 H TER 67225 WAT 4386 ATOM 67225 O WAT 4387 50.116 41.266 116.285 1.00 0.00 O ATOM 67226 H1 WAT 4387 50.417 42.121 115.977 1.00 0.00 H ATOM 67227 H2 WAT 4387 50.519 41.165 117.147 1.00 0.00 H TER 67229 WAT 4387 ATOM 67229 O WAT 4388 30.149 135.396 73.404 1.00 0.00 O ATOM 67230 H1 WAT 4388 29.848 134.916 74.175 1.00 0.00 H ATOM 67231 H2 WAT 4388 31.037 135.072 73.252 1.00 0.00 H TER 67233 WAT 4388 ATOM 67233 O WAT 4389 48.950 119.155 78.170 1.00 0.00 O ATOM 67234 H1 WAT 4389 49.879 119.133 77.941 1.00 0.00 H ATOM 67235 H2 WAT 4389 48.495 119.008 77.340 1.00 0.00 H TER 67237 WAT 4389 ATOM 67237 O WAT 4390 0.036 42.646 97.626 1.00 0.00 O ATOM 67238 H1 WAT 4390 -0.403 42.123 96.955 1.00 0.00 H ATOM 67239 H2 WAT 4390 0.405 43.388 97.149 1.00 0.00 H TER 67241 WAT 4390 ATOM 67241 O WAT 4391 99.089 42.319 141.560 1.00 0.00 O ATOM 67242 H1 WAT 4391 99.335 41.977 142.420 1.00 0.00 H ATOM 67243 H2 WAT 4391 99.825 42.876 141.305 1.00 0.00 H TER 67245 WAT 4391 ATOM 67245 O WAT 4392 30.883 47.825 78.855 1.00 0.00 O ATOM 67246 H1 WAT 4392 31.577 47.511 79.436 1.00 0.00 H ATOM 67247 H2 WAT 4392 30.757 47.114 78.227 1.00 0.00 H TER 67249 WAT 4392 ATOM 67249 O WAT 4393 25.690 20.011 111.141 1.00 0.00 O ATOM 67250 H1 WAT 4393 24.895 19.652 110.748 1.00 0.00 H ATOM 67251 H2 WAT 4393 26.376 19.836 110.497 1.00 0.00 H TER 67253 WAT 4393 ATOM 67253 O WAT 4394 129.628 13.558 122.995 1.00 0.00 O ATOM 67254 H1 WAT 4394 130.021 12.897 123.565 1.00 0.00 H ATOM 67255 H2 WAT 4394 130.300 14.235 122.914 1.00 0.00 H TER 67257 WAT 4394 ATOM 67257 O WAT 4395 96.142 96.383 72.823 1.00 0.00 O ATOM 67258 H1 WAT 4395 95.743 95.780 73.450 1.00 0.00 H ATOM 67259 H2 WAT 4395 95.892 97.253 73.135 1.00 0.00 H TER 67261 WAT 4395 ATOM 67261 O WAT 4396 89.402 10.758 84.238 1.00 0.00 O ATOM 67262 H1 WAT 4396 90.046 10.407 84.852 1.00 0.00 H ATOM 67263 H2 WAT 4396 89.906 10.954 83.448 1.00 0.00 H TER 67265 WAT 4396 ATOM 67265 O WAT 4397 132.172 21.246 63.329 1.00 0.00 O ATOM 67266 H1 WAT 4397 132.579 21.195 62.464 1.00 0.00 H ATOM 67267 H2 WAT 4397 132.427 22.106 63.663 1.00 0.00 H TER 67269 WAT 4397 ATOM 67269 O WAT 4398 99.188 15.968 102.182 1.00 0.00 O ATOM 67270 H1 WAT 4398 98.783 16.526 101.518 1.00 0.00 H ATOM 67271 H2 WAT 4398 98.928 15.080 101.941 1.00 0.00 H TER 67273 WAT 4398 ATOM 67273 O WAT 4399 65.328 120.026 146.033 1.00 0.00 O ATOM 67274 H1 WAT 4399 64.631 119.383 146.164 1.00 0.00 H ATOM 67275 H2 WAT 4399 64.867 120.853 145.892 1.00 0.00 H TER 67277 WAT 4399 ATOM 67277 O WAT 4400 97.143 108.828 139.536 1.00 0.00 O ATOM 67278 H1 WAT 4400 96.466 108.930 138.866 1.00 0.00 H ATOM 67279 H2 WAT 4400 97.868 109.371 139.228 1.00 0.00 H TER 67281 WAT 4400 ATOM 67281 O WAT 4401 82.349 109.625 23.197 1.00 0.00 O ATOM 67282 H1 WAT 4401 82.427 110.105 24.021 1.00 0.00 H ATOM 67283 H2 WAT 4401 82.473 108.708 23.441 1.00 0.00 H TER 67285 WAT 4401 ATOM 67285 O WAT 4402 15.929 138.283 119.287 1.00 0.00 O ATOM 67286 H1 WAT 4402 16.011 139.181 119.608 1.00 0.00 H ATOM 67287 H2 WAT 4402 16.760 138.110 118.843 1.00 0.00 H TER 67289 WAT 4402 ATOM 67289 O WAT 4403 45.546 133.010 108.646 1.00 0.00 O ATOM 67290 H1 WAT 4403 45.492 133.208 107.711 1.00 0.00 H ATOM 67291 H2 WAT 4403 44.854 133.538 109.043 1.00 0.00 H TER 67293 WAT 4403 ATOM 67293 O WAT 4404 140.731 81.014 128.140 1.00 0.00 O ATOM 67294 H1 WAT 4404 140.507 80.988 129.071 1.00 0.00 H ATOM 67295 H2 WAT 4404 141.042 81.908 127.994 1.00 0.00 H TER 67297 WAT 4404 ATOM 67297 O WAT 4405 41.409 50.655 105.097 1.00 0.00 O ATOM 67298 H1 WAT 4405 42.209 51.148 105.280 1.00 0.00 H ATOM 67299 H2 WAT 4405 40.718 51.148 105.539 1.00 0.00 H TER 67301 WAT 4405 ATOM 67301 O WAT 4406 45.601 38.548 152.339 1.00 0.00 O ATOM 67302 H1 WAT 4406 46.272 39.152 152.021 1.00 0.00 H ATOM 67303 H2 WAT 4406 45.951 38.216 153.166 1.00 0.00 H TER 67305 WAT 4406 ATOM 67305 O WAT 4407 132.818 57.992 114.962 1.00 0.00 O ATOM 67306 H1 WAT 4407 133.074 57.194 115.424 1.00 0.00 H ATOM 67307 H2 WAT 4407 132.166 57.702 114.324 1.00 0.00 H TER 67309 WAT 4407 ATOM 67309 O WAT 4408 20.415 47.728 130.397 1.00 0.00 O ATOM 67310 H1 WAT 4408 20.754 46.836 130.473 1.00 0.00 H ATOM 67311 H2 WAT 4408 19.465 47.629 130.457 1.00 0.00 H TER 67313 WAT 4408 ATOM 67313 O WAT 4409 105.080 64.341 87.405 1.00 0.00 O ATOM 67314 H1 WAT 4409 105.280 64.459 88.334 1.00 0.00 H ATOM 67315 H2 WAT 4409 104.779 65.202 87.114 1.00 0.00 H TER 67317 WAT 4409 ATOM 67317 O WAT 4410 67.854 54.435 23.477 1.00 0.00 O ATOM 67318 H1 WAT 4410 67.501 53.789 24.088 1.00 0.00 H ATOM 67319 H2 WAT 4410 67.516 55.273 23.793 1.00 0.00 H TER 67321 WAT 4410 ATOM 67321 O WAT 4411 104.635 36.648 6.688 1.00 0.00 O ATOM 67322 H1 WAT 4411 104.877 36.256 5.849 1.00 0.00 H ATOM 67323 H2 WAT 4411 104.505 37.576 6.491 1.00 0.00 H TER 67325 WAT 4411 ATOM 67325 O WAT 4412 10.851 109.317 68.157 1.00 0.00 O ATOM 67326 H1 WAT 4412 11.103 108.502 67.723 1.00 0.00 H ATOM 67327 H2 WAT 4412 9.902 109.250 68.259 1.00 0.00 H TER 67329 WAT 4412 ATOM 67329 O WAT 4413 35.542 90.241 7.061 1.00 0.00 O ATOM 67330 H1 WAT 4413 35.751 90.301 7.993 1.00 0.00 H ATOM 67331 H2 WAT 4413 36.366 90.440 6.617 1.00 0.00 H TER 67333 WAT 4413 ATOM 67333 O WAT 4414 8.908 30.906 4.703 1.00 0.00 O ATOM 67334 H1 WAT 4414 9.750 30.451 4.688 1.00 0.00 H ATOM 67335 H2 WAT 4414 9.108 31.769 5.065 1.00 0.00 H TER 67337 WAT 4414 ATOM 67337 O WAT 4415 132.208 130.423 21.275 1.00 0.00 O ATOM 67338 H1 WAT 4415 132.190 130.732 22.180 1.00 0.00 H ATOM 67339 H2 WAT 4415 132.132 129.471 21.345 1.00 0.00 H TER 67341 WAT 4415 ATOM 67341 O WAT 4416 126.159 42.920 91.676 1.00 0.00 O ATOM 67342 H1 WAT 4416 125.784 42.081 91.409 1.00 0.00 H ATOM 67343 H2 WAT 4416 126.958 43.002 91.155 1.00 0.00 H TER 67345 WAT 4416 ATOM 67345 O WAT 4417 6.752 109.222 110.926 1.00 0.00 O ATOM 67346 H1 WAT 4417 6.772 110.140 111.196 1.00 0.00 H ATOM 67347 H2 WAT 4417 7.398 108.793 111.488 1.00 0.00 H TER 67349 WAT 4417 ATOM 67349 O WAT 4418 8.119 140.352 118.809 1.00 0.00 O ATOM 67350 H1 WAT 4418 8.987 140.620 118.506 1.00 0.00 H ATOM 67351 H2 WAT 4418 8.287 139.611 119.391 1.00 0.00 H TER 67353 WAT 4418 ATOM 67353 O WAT 4419 89.845 139.801 72.790 1.00 0.00 O ATOM 67354 H1 WAT 4419 89.131 140.009 72.187 1.00 0.00 H ATOM 67355 H2 WAT 4419 90.563 139.521 72.223 1.00 0.00 H TER 67357 WAT 4419 ATOM 67357 O WAT 4420 21.750 122.307 134.158 1.00 0.00 O ATOM 67358 H1 WAT 4420 22.097 121.465 134.453 1.00 0.00 H ATOM 67359 H2 WAT 4420 21.409 122.717 134.954 1.00 0.00 H TER 67361 WAT 4420 ATOM 67361 O WAT 4421 3.347 42.722 79.788 1.00 0.00 O ATOM 67362 H1 WAT 4421 3.726 43.226 80.509 1.00 0.00 H ATOM 67363 H2 WAT 4421 4.052 42.139 79.508 1.00 0.00 H TER 67365 WAT 4421 ATOM 67365 O WAT 4422 54.618 11.596 73.512 1.00 0.00 O ATOM 67366 H1 WAT 4422 53.991 10.875 73.567 1.00 0.00 H ATOM 67367 H2 WAT 4422 54.354 12.197 74.208 1.00 0.00 H TER 67369 WAT 4422 ATOM 67369 O WAT 4423 92.988 105.340 148.281 1.00 0.00 O ATOM 67370 H1 WAT 4423 92.042 105.197 148.278 1.00 0.00 H ATOM 67371 H2 WAT 4423 93.327 104.687 148.893 1.00 0.00 H TER 67373 WAT 4423 ATOM 67373 O WAT 4424 9.897 116.401 153.041 1.00 0.00 O ATOM 67374 H1 WAT 4424 9.065 115.982 153.263 1.00 0.00 H ATOM 67375 H2 WAT 4424 9.804 116.646 152.121 1.00 0.00 H TER 67377 WAT 4424 ATOM 67377 O WAT 4425 51.388 110.516 85.707 1.00 0.00 O ATOM 67378 H1 WAT 4425 50.558 110.598 86.176 1.00 0.00 H ATOM 67379 H2 WAT 4425 51.370 111.224 85.063 1.00 0.00 H TER 67381 WAT 4425 ATOM 67381 O WAT 4426 136.730 64.351 106.214 1.00 0.00 O ATOM 67382 H1 WAT 4426 136.421 65.121 106.692 1.00 0.00 H ATOM 67383 H2 WAT 4426 137.390 63.962 106.787 1.00 0.00 H TER 67385 WAT 4426 ATOM 67385 O WAT 4427 17.653 98.757 91.132 1.00 0.00 O ATOM 67386 H1 WAT 4427 17.438 99.376 90.434 1.00 0.00 H ATOM 67387 H2 WAT 4427 17.773 97.921 90.682 1.00 0.00 H TER 67389 WAT 4427 ATOM 67389 O WAT 4428 78.977 129.641 125.901 1.00 0.00 O ATOM 67390 H1 WAT 4428 79.777 129.121 125.988 1.00 0.00 H ATOM 67391 H2 WAT 4428 78.474 129.440 126.690 1.00 0.00 H TER 67393 WAT 4428 ATOM 67393 O WAT 4429 76.902 125.999 155.293 1.00 0.00 O ATOM 67394 H1 WAT 4429 76.844 126.889 154.944 1.00 0.00 H ATOM 67395 H2 WAT 4429 76.372 126.019 156.089 1.00 0.00 H TER 67397 WAT 4429 ATOM 67397 O WAT 4430 119.126 16.318 135.310 1.00 0.00 O ATOM 67398 H1 WAT 4430 119.310 16.038 134.413 1.00 0.00 H ATOM 67399 H2 WAT 4430 119.985 16.353 135.730 1.00 0.00 H TER 67401 WAT 4430 ATOM 67401 O WAT 4431 22.609 91.216 102.911 1.00 0.00 O ATOM 67402 H1 WAT 4431 22.046 91.966 103.102 1.00 0.00 H ATOM 67403 H2 WAT 4431 23.406 91.380 103.414 1.00 0.00 H TER 67405 WAT 4431 ATOM 67405 O WAT 4432 0.899 105.417 16.287 1.00 0.00 O ATOM 67406 H1 WAT 4432 0.048 105.648 16.660 1.00 0.00 H ATOM 67407 H2 WAT 4432 1.228 106.236 15.916 1.00 0.00 H TER 67409 WAT 4432 ATOM 67409 O WAT 4433 111.465 46.132 111.217 1.00 0.00 O ATOM 67410 H1 WAT 4433 111.408 46.990 110.797 1.00 0.00 H ATOM 67411 H2 WAT 4433 112.389 45.892 111.145 1.00 0.00 H TER 67413 WAT 4433 ATOM 67413 O WAT 4434 11.742 111.462 70.905 1.00 0.00 O ATOM 67414 H1 WAT 4434 12.123 111.515 70.029 1.00 0.00 H ATOM 67415 H2 WAT 4434 12.496 111.449 71.494 1.00 0.00 H TER 67417 WAT 4434 ATOM 67417 O WAT 4435 111.432 58.737 69.559 1.00 0.00 O ATOM 67418 H1 WAT 4435 112.312 58.910 69.893 1.00 0.00 H ATOM 67419 H2 WAT 4435 111.499 57.878 69.142 1.00 0.00 H TER 67421 WAT 4435 ATOM 67421 O WAT 4436 111.710 106.869 137.657 1.00 0.00 O ATOM 67422 H1 WAT 4436 112.092 107.042 136.797 1.00 0.00 H ATOM 67423 H2 WAT 4436 110.969 107.472 137.716 1.00 0.00 H TER 67425 WAT 4436 ATOM 67425 O WAT 4437 47.557 110.044 119.697 1.00 0.00 O ATOM 67426 H1 WAT 4437 47.059 110.713 119.227 1.00 0.00 H ATOM 67427 H2 WAT 4437 47.308 110.160 120.614 1.00 0.00 H TER 67429 WAT 4437 ATOM 67429 O WAT 4438 7.699 88.448 69.402 1.00 0.00 O ATOM 67430 H1 WAT 4438 7.785 89.261 68.903 1.00 0.00 H ATOM 67431 H2 WAT 4438 7.917 88.694 70.301 1.00 0.00 H TER 67433 WAT 4438 ATOM 67433 O WAT 4439 126.501 135.447 14.884 1.00 0.00 O ATOM 67434 H1 WAT 4439 127.106 135.160 15.568 1.00 0.00 H ATOM 67435 H2 WAT 4439 126.852 135.064 14.079 1.00 0.00 H TER 67437 WAT 4439 ATOM 67437 O WAT 4440 104.386 20.122 75.178 1.00 0.00 O ATOM 67438 H1 WAT 4440 104.113 20.070 74.262 1.00 0.00 H ATOM 67439 H2 WAT 4440 104.806 19.279 75.350 1.00 0.00 H TER 67441 WAT 4440 ATOM 67441 O WAT 4441 69.243 30.843 4.780 1.00 0.00 O ATOM 67442 H1 WAT 4441 68.697 31.071 5.533 1.00 0.00 H ATOM 67443 H2 WAT 4441 68.994 29.943 4.568 1.00 0.00 H TER 67445 WAT 4441 ATOM 67445 O WAT 4442 26.973 79.765 109.306 1.00 0.00 O ATOM 67446 H1 WAT 4442 27.384 79.687 108.445 1.00 0.00 H ATOM 67447 H2 WAT 4442 26.676 80.674 109.348 1.00 0.00 H TER 67449 WAT 4442 ATOM 67449 O WAT 4443 44.521 73.466 147.567 1.00 0.00 O ATOM 67450 H1 WAT 4443 44.147 74.327 147.758 1.00 0.00 H ATOM 67451 H2 WAT 4443 44.286 72.929 148.323 1.00 0.00 H TER 67453 WAT 4443 ATOM 67453 O WAT 4444 53.078 40.475 66.807 1.00 0.00 O ATOM 67454 H1 WAT 4444 52.385 39.917 66.456 1.00 0.00 H ATOM 67455 H2 WAT 4444 53.888 40.094 66.468 1.00 0.00 H TER 67457 WAT 4444 ATOM 67457 O WAT 4445 59.393 46.014 157.198 1.00 0.00 O ATOM 67458 H1 WAT 4445 58.694 45.412 156.941 1.00 0.00 H ATOM 67459 H2 WAT 4445 58.985 46.592 157.843 1.00 0.00 H TER 67461 WAT 4445 ATOM 67461 O WAT 4446 57.872 142.100 158.486 1.00 0.00 O ATOM 67462 H1 WAT 4446 58.502 142.418 157.840 1.00 0.00 H ATOM 67463 H2 WAT 4446 58.412 141.771 159.205 1.00 0.00 H TER 67465 WAT 4446 ATOM 67465 O WAT 4447 4.218 106.128 134.128 1.00 0.00 O ATOM 67466 H1 WAT 4447 3.438 105.885 133.629 1.00 0.00 H ATOM 67467 H2 WAT 4447 3.884 106.660 134.850 1.00 0.00 H TER 67469 WAT 4447 ATOM 67469 O WAT 4448 109.246 45.932 10.236 1.00 0.00 O ATOM 67470 H1 WAT 4448 108.430 45.925 10.736 1.00 0.00 H ATOM 67471 H2 WAT 4448 109.429 46.860 10.088 1.00 0.00 H TER 67473 WAT 4448 ATOM 67473 O WAT 4449 134.721 90.949 120.776 1.00 0.00 O ATOM 67474 H1 WAT 4449 135.354 90.379 121.213 1.00 0.00 H ATOM 67475 H2 WAT 4449 134.890 91.818 121.140 1.00 0.00 H TER 67477 WAT 4449 ATOM 67477 O WAT 4450 35.836 46.675 115.095 1.00 0.00 O ATOM 67478 H1 WAT 4450 35.581 45.781 114.867 1.00 0.00 H ATOM 67479 H2 WAT 4450 36.066 47.079 114.258 1.00 0.00 H TER 67481 WAT 4450 ATOM 67481 O WAT 4451 4.378 106.657 116.962 1.00 0.00 O ATOM 67482 H1 WAT 4451 4.884 106.183 117.622 1.00 0.00 H ATOM 67483 H2 WAT 4451 3.819 107.246 117.468 1.00 0.00 H TER 67485 WAT 4451 ATOM 67485 O WAT 4452 33.456 40.452 94.717 1.00 0.00 O ATOM 67486 H1 WAT 4452 33.268 39.688 94.172 1.00 0.00 H ATOM 67487 H2 WAT 4452 32.779 40.437 95.393 1.00 0.00 H TER 67489 WAT 4452 ATOM 67489 O WAT 4453 64.272 21.621 127.079 1.00 0.00 O ATOM 67490 H1 WAT 4453 64.975 21.470 127.711 1.00 0.00 H ATOM 67491 H2 WAT 4453 64.659 21.400 126.232 1.00 0.00 H TER 67493 WAT 4453 ATOM 67493 O WAT 4454 107.801 42.559 57.276 1.00 0.00 O ATOM 67494 H1 WAT 4454 107.055 42.092 57.653 1.00 0.00 H ATOM 67495 H2 WAT 4454 107.715 42.426 56.332 1.00 0.00 H TER 67497 WAT 4454 ATOM 67497 O WAT 4455 8.873 131.786 125.873 1.00 0.00 O ATOM 67498 H1 WAT 4455 9.781 132.067 125.755 1.00 0.00 H ATOM 67499 H2 WAT 4455 8.877 131.304 126.699 1.00 0.00 H TER 67501 WAT 4455 ATOM 67501 O WAT 4456 103.343 94.751 2.635 1.00 0.00 O ATOM 67502 H1 WAT 4456 103.020 93.867 2.460 1.00 0.00 H ATOM 67503 H2 WAT 4456 103.497 94.768 3.579 1.00 0.00 H TER 67505 WAT 4456 ATOM 67505 O WAT 4457 87.248 76.610 20.398 1.00 0.00 O ATOM 67506 H1 WAT 4457 87.633 77.154 19.711 1.00 0.00 H ATOM 67507 H2 WAT 4457 87.760 76.815 21.180 1.00 0.00 H TER 67509 WAT 4457 ATOM 67509 O WAT 4458 40.407 61.534 13.930 1.00 0.00 O ATOM 67510 H1 WAT 4458 40.052 61.004 13.216 1.00 0.00 H ATOM 67511 H2 WAT 4458 41.355 61.504 13.802 1.00 0.00 H TER 67513 WAT 4458 ATOM 67513 O WAT 4459 96.251 47.315 12.504 1.00 0.00 O ATOM 67514 H1 WAT 4459 96.409 47.079 11.590 1.00 0.00 H ATOM 67515 H2 WAT 4459 95.462 47.857 12.479 1.00 0.00 H TER 67517 WAT 4459 ATOM 67517 O WAT 4460 43.522 142.470 107.128 1.00 0.00 O ATOM 67518 H1 WAT 4460 43.756 141.556 107.290 1.00 0.00 H ATOM 67519 H2 WAT 4460 42.845 142.663 107.777 1.00 0.00 H TER 67521 WAT 4460 ATOM 67521 O WAT 4461 33.193 103.619 129.122 1.00 0.00 O ATOM 67522 H1 WAT 4461 33.890 104.231 129.358 1.00 0.00 H ATOM 67523 H2 WAT 4461 33.489 102.775 129.463 1.00 0.00 H TER 67525 WAT 4461 ATOM 67525 O WAT 4462 134.441 61.030 153.527 1.00 0.00 O ATOM 67526 H1 WAT 4462 134.248 60.555 152.718 1.00 0.00 H ATOM 67527 H2 WAT 4462 134.160 60.438 154.225 1.00 0.00 H TER 67529 WAT 4462 ATOM 67529 O WAT 4463 7.587 109.976 148.801 1.00 0.00 O ATOM 67530 H1 WAT 4463 8.032 109.585 149.552 1.00 0.00 H ATOM 67531 H2 WAT 4463 7.130 110.736 149.161 1.00 0.00 H TER 67533 WAT 4463 ATOM 67533 O WAT 4464 58.087 77.358 97.425 1.00 0.00 O ATOM 67534 H1 WAT 4464 57.688 76.488 97.415 1.00 0.00 H ATOM 67535 H2 WAT 4464 57.622 77.842 96.742 1.00 0.00 H TER 67537 WAT 4464 ATOM 67537 O WAT 4465 32.330 59.294 72.630 1.00 0.00 O ATOM 67538 H1 WAT 4465 32.283 60.139 72.182 1.00 0.00 H ATOM 67539 H2 WAT 4465 31.724 59.380 73.366 1.00 0.00 H TER 67541 WAT 4465 ATOM 67541 O WAT 4466 107.869 7.829 107.529 1.00 0.00 O ATOM 67542 H1 WAT 4466 108.746 8.046 107.212 1.00 0.00 H ATOM 67543 H2 WAT 4466 107.559 8.633 107.944 1.00 0.00 H TER 67545 WAT 4466 ATOM 67545 O WAT 4467 64.509 19.912 16.315 1.00 0.00 O ATOM 67546 H1 WAT 4467 65.128 19.195 16.453 1.00 0.00 H ATOM 67547 H2 WAT 4467 64.066 20.011 17.158 1.00 0.00 H TER 67549 WAT 4467 ATOM 67549 O WAT 4468 84.843 25.201 149.327 1.00 0.00 O ATOM 67550 H1 WAT 4468 84.640 24.889 148.445 1.00 0.00 H ATOM 67551 H2 WAT 4468 85.799 25.197 149.368 1.00 0.00 H TER 67553 WAT 4468 ATOM 67553 O WAT 4469 73.556 71.415 145.234 1.00 0.00 O ATOM 67554 H1 WAT 4469 73.875 71.115 144.383 1.00 0.00 H ATOM 67555 H2 WAT 4469 73.507 72.367 145.150 1.00 0.00 H TER 67557 WAT 4469 ATOM 67557 O WAT 4470 95.292 20.033 1.981 1.00 0.00 O ATOM 67558 H1 WAT 4470 96.063 20.126 2.540 1.00 0.00 H ATOM 67559 H2 WAT 4470 95.041 19.114 2.069 1.00 0.00 H TER 67561 WAT 4470 ATOM 67561 O WAT 4471 18.017 48.507 17.419 1.00 0.00 O ATOM 67562 H1 WAT 4471 18.782 48.668 17.971 1.00 0.00 H ATOM 67563 H2 WAT 4471 17.728 47.627 17.661 1.00 0.00 H TER 67565 WAT 4471 ATOM 67565 O WAT 4472 19.458 15.364 105.766 1.00 0.00 O ATOM 67566 H1 WAT 4472 19.787 14.542 105.401 1.00 0.00 H ATOM 67567 H2 WAT 4472 18.825 15.676 105.118 1.00 0.00 H TER 67569 WAT 4472 ATOM 67569 O WAT 4473 128.895 111.653 67.438 1.00 0.00 O ATOM 67570 H1 WAT 4473 128.399 112.428 67.173 1.00 0.00 H ATOM 67571 H2 WAT 4473 129.527 111.521 66.732 1.00 0.00 H TER 67573 WAT 4473 ATOM 67573 O WAT 4474 98.772 52.061 156.468 1.00 0.00 O ATOM 67574 H1 WAT 4474 99.271 51.978 155.656 1.00 0.00 H ATOM 67575 H2 WAT 4474 97.868 52.193 156.181 1.00 0.00 H TER 67577 WAT 4474 ATOM 67577 O WAT 4475 42.834 91.850 112.352 1.00 0.00 O ATOM 67578 H1 WAT 4475 42.772 92.732 112.717 1.00 0.00 H ATOM 67579 H2 WAT 4475 42.303 91.882 111.556 1.00 0.00 H TER 67581 WAT 4475 ATOM 67581 O WAT 4476 125.168 64.865 12.220 1.00 0.00 O ATOM 67582 H1 WAT 4476 125.552 65.501 11.617 1.00 0.00 H ATOM 67583 H2 WAT 4476 124.590 64.334 11.671 1.00 0.00 H TER 67585 WAT 4476 ATOM 67585 O WAT 4477 125.207 6.257 94.175 1.00 0.00 O ATOM 67586 H1 WAT 4477 125.783 6.670 93.533 1.00 0.00 H ATOM 67587 H2 WAT 4477 125.449 6.660 95.009 1.00 0.00 H TER 67589 WAT 4477 ATOM 67589 O WAT 4478 91.109 22.373 113.164 1.00 0.00 O ATOM 67590 H1 WAT 4478 90.647 22.363 112.325 1.00 0.00 H ATOM 67591 H2 WAT 4478 90.818 21.575 113.607 1.00 0.00 H TER 67593 WAT 4478 ATOM 67593 O WAT 4479 57.823 121.477 139.654 1.00 0.00 O ATOM 67594 H1 WAT 4479 57.505 120.584 139.782 1.00 0.00 H ATOM 67595 H2 WAT 4479 57.257 121.836 138.970 1.00 0.00 H TER 67597 WAT 4479 ATOM 67597 O WAT 4480 4.961 12.961 73.294 1.00 0.00 O ATOM 67598 H1 WAT 4480 5.653 12.322 73.121 1.00 0.00 H ATOM 67599 H2 WAT 4480 4.458 12.995 72.481 1.00 0.00 H TER 67601 WAT 4480 ATOM 67601 O WAT 4481 60.188 141.553 100.861 1.00 0.00 O ATOM 67602 H1 WAT 4481 61.035 141.354 101.260 1.00 0.00 H ATOM 67603 H2 WAT 4481 59.579 140.943 101.276 1.00 0.00 H TER 67605 WAT 4481 ATOM 67605 O WAT 4482 118.449 71.408 95.612 1.00 0.00 O ATOM 67606 H1 WAT 4482 119.084 70.771 95.937 1.00 0.00 H ATOM 67607 H2 WAT 4482 117.656 71.237 96.120 1.00 0.00 H TER 67609 WAT 4482 ATOM 67609 O WAT 4483 20.263 109.958 89.264 1.00 0.00 O ATOM 67610 H1 WAT 4483 19.636 110.033 89.984 1.00 0.00 H ATOM 67611 H2 WAT 4483 20.356 109.016 89.125 1.00 0.00 H TER 67613 WAT 4483 ATOM 67613 O WAT 4484 4.735 126.948 106.938 1.00 0.00 O ATOM 67614 H1 WAT 4484 4.785 126.831 105.990 1.00 0.00 H ATOM 67615 H2 WAT 4484 3.889 126.573 107.181 1.00 0.00 H TER 67617 WAT 4484 ATOM 67617 O WAT 4485 56.263 2.011 129.181 1.00 0.00 O ATOM 67618 H1 WAT 4485 56.111 2.429 130.028 1.00 0.00 H ATOM 67619 H2 WAT 4485 57.215 1.952 129.109 1.00 0.00 H TER 67621 WAT 4485 ATOM 67621 O WAT 4486 103.747 136.001 132.862 1.00 0.00 O ATOM 67622 H1 WAT 4486 103.230 135.812 133.645 1.00 0.00 H ATOM 67623 H2 WAT 4486 103.880 135.148 132.451 1.00 0.00 H TER 67625 WAT 4486 ATOM 67625 O WAT 4487 92.581 123.631 149.334 1.00 0.00 O ATOM 67626 H1 WAT 4487 92.435 124.351 148.719 1.00 0.00 H ATOM 67627 H2 WAT 4487 91.703 123.371 149.611 1.00 0.00 H TER 67629 WAT 4487 ATOM 67629 O WAT 4488 3.525 125.888 68.238 1.00 0.00 O ATOM 67630 H1 WAT 4488 3.539 126.771 67.867 1.00 0.00 H ATOM 67631 H2 WAT 4488 2.692 125.519 67.945 1.00 0.00 H TER 67633 WAT 4488 ATOM 67633 O WAT 4489 124.135 79.823 71.780 1.00 0.00 O ATOM 67634 H1 WAT 4489 123.919 80.183 70.920 1.00 0.00 H ATOM 67635 H2 WAT 4489 123.287 79.693 72.205 1.00 0.00 H TER 67637 WAT 4489 ATOM 67637 O WAT 4490 85.960 115.704 140.046 1.00 0.00 O ATOM 67638 H1 WAT 4490 86.403 115.567 140.884 1.00 0.00 H ATOM 67639 H2 WAT 4490 86.247 116.572 139.763 1.00 0.00 H TER 67641 WAT 4490 ATOM 67641 O WAT 4491 18.970 16.977 18.090 1.00 0.00 O ATOM 67642 H1 WAT 4491 19.458 16.750 18.881 1.00 0.00 H ATOM 67643 H2 WAT 4491 19.547 16.721 17.370 1.00 0.00 H TER 67645 WAT 4491 ATOM 67645 O WAT 4492 40.017 123.235 65.034 1.00 0.00 O ATOM 67646 H1 WAT 4492 39.613 124.089 65.187 1.00 0.00 H ATOM 67647 H2 WAT 4492 40.732 123.414 64.423 1.00 0.00 H TER 67649 WAT 4492 ATOM 67649 O WAT 4493 23.989 8.437 100.655 1.00 0.00 O ATOM 67650 H1 WAT 4493 24.818 8.895 100.516 1.00 0.00 H ATOM 67651 H2 WAT 4493 23.877 8.428 101.606 1.00 0.00 H TER 67653 WAT 4493 ATOM 67653 O WAT 4494 67.207 143.180 123.430 1.00 0.00 O ATOM 67654 H1 WAT 4494 67.524 142.278 123.399 1.00 0.00 H ATOM 67655 H2 WAT 4494 66.500 143.208 122.786 1.00 0.00 H TER 67657 WAT 4494 ATOM 67657 O WAT 4495 96.688 14.740 7.759 1.00 0.00 O ATOM 67658 H1 WAT 4495 97.248 15.446 7.436 1.00 0.00 H ATOM 67659 H2 WAT 4495 95.975 15.189 8.213 1.00 0.00 H TER 67661 WAT 4495 ATOM 67661 O WAT 4496 128.794 90.537 104.622 1.00 0.00 O ATOM 67662 H1 WAT 4496 129.266 90.066 105.309 1.00 0.00 H ATOM 67663 H2 WAT 4496 129.040 91.453 104.748 1.00 0.00 H TER 67665 WAT 4496 ATOM 67665 O WAT 4497 42.447 97.364 78.785 1.00 0.00 O ATOM 67666 H1 WAT 4497 41.715 97.511 78.185 1.00 0.00 H ATOM 67667 H2 WAT 4497 42.219 97.865 79.568 1.00 0.00 H TER 67669 WAT 4497 ATOM 67669 O WAT 4498 110.179 132.685 82.939 1.00 0.00 O ATOM 67670 H1 WAT 4498 110.997 132.859 83.406 1.00 0.00 H ATOM 67671 H2 WAT 4498 109.826 133.553 82.744 1.00 0.00 H TER 67673 WAT 4498 ATOM 67673 O WAT 4499 10.619 40.580 124.819 1.00 0.00 O ATOM 67674 H1 WAT 4499 9.774 40.906 125.128 1.00 0.00 H ATOM 67675 H2 WAT 4499 10.678 39.693 125.174 1.00 0.00 H TER 67677 WAT 4499 ATOM 67677 O WAT 4500 14.058 21.495 138.155 1.00 0.00 O ATOM 67678 H1 WAT 4500 14.336 21.129 138.995 1.00 0.00 H ATOM 67679 H2 WAT 4500 13.132 21.259 138.086 1.00 0.00 H TER 67681 WAT 4500 ATOM 67681 O WAT 4501 136.516 9.448 11.979 1.00 0.00 O ATOM 67682 H1 WAT 4501 135.965 10.225 11.895 1.00 0.00 H ATOM 67683 H2 WAT 4501 136.186 9.003 12.760 1.00 0.00 H TER 67685 WAT 4501 ATOM 67685 O WAT 4502 140.167 129.322 127.612 1.00 0.00 O ATOM 67686 H1 WAT 4502 140.568 129.280 126.744 1.00 0.00 H ATOM 67687 H2 WAT 4502 139.295 129.686 127.456 1.00 0.00 H TER 67689 WAT 4502 ATOM 67689 O WAT 4503 139.600 129.232 147.316 1.00 0.00 O ATOM 67690 H1 WAT 4503 139.986 129.937 147.837 1.00 0.00 H ATOM 67691 H2 WAT 4503 139.947 129.368 146.435 1.00 0.00 H TER 67693 WAT 4503 ATOM 67693 O WAT 4504 140.058 49.623 133.194 1.00 0.00 O ATOM 67694 H1 WAT 4504 139.992 50.478 133.620 1.00 0.00 H ATOM 67695 H2 WAT 4504 139.692 49.762 132.320 1.00 0.00 H TER 67697 WAT 4504 ATOM 67697 O WAT 4505 114.702 58.148 2.045 1.00 0.00 O ATOM 67698 H1 WAT 4505 113.990 57.508 2.046 1.00 0.00 H ATOM 67699 H2 WAT 4505 115.345 57.793 2.659 1.00 0.00 H TER 67701 WAT 4505 ATOM 67701 O WAT 4506 121.229 70.486 78.519 1.00 0.00 O ATOM 67702 H1 WAT 4506 120.958 70.527 79.436 1.00 0.00 H ATOM 67703 H2 WAT 4506 120.764 69.727 78.166 1.00 0.00 H TER 67705 WAT 4506 ATOM 67705 O WAT 4507 103.540 140.631 56.031 1.00 0.00 O ATOM 67706 H1 WAT 4507 104.126 140.210 56.661 1.00 0.00 H ATOM 67707 H2 WAT 4507 102.709 140.169 56.132 1.00 0.00 H TER 67709 WAT 4507 ATOM 67709 O WAT 4508 92.729 21.564 127.716 1.00 0.00 O ATOM 67710 H1 WAT 4508 92.989 22.096 126.964 1.00 0.00 H ATOM 67711 H2 WAT 4508 93.167 21.974 128.462 1.00 0.00 H TER 67713 WAT 4508 ATOM 67713 O WAT 4509 77.247 143.325 65.744 1.00 0.00 O ATOM 67714 H1 WAT 4509 77.505 144.216 65.982 1.00 0.00 H ATOM 67715 H2 WAT 4509 78.058 142.819 65.797 1.00 0.00 H TER 67717 WAT 4509 ATOM 67717 O WAT 4510 59.067 115.167 96.094 1.00 0.00 O ATOM 67718 H1 WAT 4510 58.138 115.163 95.860 1.00 0.00 H ATOM 67719 H2 WAT 4510 59.460 115.806 95.500 1.00 0.00 H TER 67721 WAT 4510 ATOM 67721 O WAT 4511 45.325 58.523 4.337 1.00 0.00 O ATOM 67722 H1 WAT 4511 45.397 59.239 4.968 1.00 0.00 H ATOM 67723 H2 WAT 4511 46.207 58.153 4.293 1.00 0.00 H TER 67725 WAT 4511 ATOM 67725 O WAT 4512 118.699 107.067 89.088 1.00 0.00 O ATOM 67726 H1 WAT 4512 118.903 106.431 88.402 1.00 0.00 H ATOM 67727 H2 WAT 4512 118.450 106.533 89.842 1.00 0.00 H TER 67729 WAT 4512 ATOM 67729 O WAT 4513 60.330 3.484 77.312 1.00 0.00 O ATOM 67730 H1 WAT 4513 59.409 3.226 77.278 1.00 0.00 H ATOM 67731 H2 WAT 4513 60.757 2.935 76.655 1.00 0.00 H TER 67733 WAT 4513 ATOM 67733 O WAT 4514 9.908 32.868 80.027 1.00 0.00 O ATOM 67734 H1 WAT 4514 10.284 33.072 80.883 1.00 0.00 H ATOM 67735 H2 WAT 4514 9.143 32.327 80.224 1.00 0.00 H TER 67737 WAT 4514 ATOM 67737 O WAT 4515 2.070 22.578 65.176 1.00 0.00 O ATOM 67738 H1 WAT 4515 1.148 22.834 65.170 1.00 0.00 H ATOM 67739 H2 WAT 4515 2.195 22.115 64.348 1.00 0.00 H TER 67741 WAT 4515 ATOM 67741 O WAT 4516 46.353 13.634 26.498 1.00 0.00 O ATOM 67742 H1 WAT 4516 45.976 14.500 26.650 1.00 0.00 H ATOM 67743 H2 WAT 4516 46.882 13.463 27.278 1.00 0.00 H TER 67745 WAT 4516 ATOM 67745 O WAT 4517 80.486 62.059 144.363 1.00 0.00 O ATOM 67746 H1 WAT 4517 80.586 61.526 145.152 1.00 0.00 H ATOM 67747 H2 WAT 4517 79.573 62.345 144.381 1.00 0.00 H TER 67749 WAT 4517 ATOM 67749 O WAT 4518 56.634 75.852 125.777 1.00 0.00 O ATOM 67750 H1 WAT 4518 55.910 76.400 125.474 1.00 0.00 H ATOM 67751 H2 WAT 4518 56.211 75.132 126.244 1.00 0.00 H TER 67753 WAT 4518 ATOM 67753 O WAT 4519 3.981 142.085 128.357 1.00 0.00 O ATOM 67754 H1 WAT 4519 4.853 141.933 127.994 1.00 0.00 H ATOM 67755 H2 WAT 4519 4.143 142.426 129.236 1.00 0.00 H TER 67757 WAT 4519 ATOM 67757 O WAT 4520 94.265 6.793 147.220 1.00 0.00 O ATOM 67758 H1 WAT 4520 94.326 6.637 146.277 1.00 0.00 H ATOM 67759 H2 WAT 4520 95.172 6.915 147.501 1.00 0.00 H TER 67761 WAT 4520 ATOM 67761 O WAT 4521 137.456 0.711 69.097 1.00 0.00 O ATOM 67762 H1 WAT 4521 137.688 -0.201 68.919 1.00 0.00 H ATOM 67763 H2 WAT 4521 138.297 1.164 69.161 1.00 0.00 H TER 67765 WAT 4521 ATOM 67765 O WAT 4522 109.973 79.758 17.005 1.00 0.00 O ATOM 67766 H1 WAT 4522 109.891 80.365 17.740 1.00 0.00 H ATOM 67767 H2 WAT 4522 109.124 79.317 16.963 1.00 0.00 H TER 67769 WAT 4522 ATOM 67769 O WAT 4523 1.643 142.697 15.525 1.00 0.00 O ATOM 67770 H1 WAT 4523 1.717 141.798 15.844 1.00 0.00 H ATOM 67771 H2 WAT 4523 0.710 142.901 15.596 1.00 0.00 H TER 67773 WAT 4523 ATOM 67773 O WAT 4524 17.784 22.294 80.444 1.00 0.00 O ATOM 67774 H1 WAT 4524 18.710 22.178 80.233 1.00 0.00 H ATOM 67775 H2 WAT 4524 17.785 22.731 81.296 1.00 0.00 H TER 67777 WAT 4524 ATOM 67777 O WAT 4525 36.724 16.414 150.861 1.00 0.00 O ATOM 67778 H1 WAT 4525 36.505 16.636 149.956 1.00 0.00 H ATOM 67779 H2 WAT 4525 36.791 17.259 151.306 1.00 0.00 H TER 67781 WAT 4525 ATOM 67781 O WAT 4526 35.282 69.906 13.391 1.00 0.00 O ATOM 67782 H1 WAT 4526 35.460 69.572 12.512 1.00 0.00 H ATOM 67783 H2 WAT 4526 35.149 70.846 13.268 1.00 0.00 H TER 67785 WAT 4526 ATOM 67785 O WAT 4527 39.333 39.085 69.735 1.00 0.00 O ATOM 67786 H1 WAT 4527 39.970 38.371 69.747 1.00 0.00 H ATOM 67787 H2 WAT 4527 38.680 38.835 70.389 1.00 0.00 H TER 67789 WAT 4527 ATOM 67789 O WAT 4528 137.566 118.351 7.056 1.00 0.00 O ATOM 67790 H1 WAT 4528 138.342 117.959 7.456 1.00 0.00 H ATOM 67791 H2 WAT 4528 137.908 118.875 6.332 1.00 0.00 H TER 67793 WAT 4528 ATOM 67793 O WAT 4529 69.034 37.450 144.840 1.00 0.00 O ATOM 67794 H1 WAT 4529 68.571 37.799 145.602 1.00 0.00 H ATOM 67795 H2 WAT 4529 69.279 38.224 144.333 1.00 0.00 H TER 67797 WAT 4529 ATOM 67797 O WAT 4530 24.825 87.381 108.654 1.00 0.00 O ATOM 67798 H1 WAT 4530 24.189 86.690 108.842 1.00 0.00 H ATOM 67799 H2 WAT 4530 24.792 87.486 107.704 1.00 0.00 H TER 67801 WAT 4530 ATOM 67801 O WAT 4531 57.239 58.949 6.250 1.00 0.00 O ATOM 67802 H1 WAT 4531 57.544 58.439 7.000 1.00 0.00 H ATOM 67803 H2 WAT 4531 56.313 58.722 6.166 1.00 0.00 H TER 67805 WAT 4531 ATOM 67805 O WAT 4532 128.840 50.108 9.475 1.00 0.00 O ATOM 67806 H1 WAT 4532 128.229 49.391 9.648 1.00 0.00 H ATOM 67807 H2 WAT 4532 129.609 49.681 9.099 1.00 0.00 H TER 67809 WAT 4532 ATOM 67809 O WAT 4533 113.770 141.662 130.305 1.00 0.00 O ATOM 67810 H1 WAT 4533 114.431 142.354 130.317 1.00 0.00 H ATOM 67811 H2 WAT 4533 113.735 141.348 131.209 1.00 0.00 H TER 67813 WAT 4533 ATOM 67813 O WAT 4534 97.320 94.866 11.843 1.00 0.00 O ATOM 67814 H1 WAT 4534 97.184 95.807 11.951 1.00 0.00 H ATOM 67815 H2 WAT 4534 98.053 94.799 11.232 1.00 0.00 H TER 67817 WAT 4534 ATOM 67817 O WAT 4535 62.154 65.908 126.837 1.00 0.00 O ATOM 67818 H1 WAT 4535 61.731 65.922 127.696 1.00 0.00 H ATOM 67819 H2 WAT 4535 62.537 66.780 126.745 1.00 0.00 H TER 67821 WAT 4535 ATOM 67821 O WAT 4536 46.593 76.361 73.205 1.00 0.00 O ATOM 67822 H1 WAT 4536 47.426 76.391 72.735 1.00 0.00 H ATOM 67823 H2 WAT 4536 46.692 77.001 73.910 1.00 0.00 H TER 67825 WAT 4536 ATOM 67825 O WAT 4537 41.869 58.310 98.315 1.00 0.00 O ATOM 67826 H1 WAT 4537 41.327 58.669 99.018 1.00 0.00 H ATOM 67827 H2 WAT 4537 41.958 57.382 98.532 1.00 0.00 H TER 67829 WAT 4537 ATOM 67829 O WAT 4538 118.165 56.334 79.220 1.00 0.00 O ATOM 67830 H1 WAT 4538 118.184 57.286 79.316 1.00 0.00 H ATOM 67831 H2 WAT 4538 117.357 56.066 79.658 1.00 0.00 H TER 67833 WAT 4538 ATOM 67833 O WAT 4539 91.681 72.397 88.414 1.00 0.00 O ATOM 67834 H1 WAT 4539 91.896 71.573 88.851 1.00 0.00 H ATOM 67835 H2 WAT 4539 91.074 72.834 89.011 1.00 0.00 H TER 67837 WAT 4539 ATOM 67837 O WAT 4540 89.358 138.714 79.897 1.00 0.00 O ATOM 67838 H1 WAT 4540 88.522 139.081 79.611 1.00 0.00 H ATOM 67839 H2 WAT 4540 89.450 137.905 79.393 1.00 0.00 H TER 67841 WAT 4540 ATOM 67841 O WAT 4541 49.382 5.543 51.974 1.00 0.00 O ATOM 67842 H1 WAT 4541 49.310 5.738 51.040 1.00 0.00 H ATOM 67843 H2 WAT 4541 48.522 5.198 52.214 1.00 0.00 H TER 67845 WAT 4541 ATOM 67845 O WAT 4542 25.801 1.479 61.048 1.00 0.00 O ATOM 67846 H1 WAT 4542 24.851 1.404 61.135 1.00 0.00 H ATOM 67847 H2 WAT 4542 25.971 1.310 60.121 1.00 0.00 H TER 67849 WAT 4542 ATOM 67849 O WAT 4543 137.010 121.721 108.441 1.00 0.00 O ATOM 67850 H1 WAT 4543 137.645 121.479 109.115 1.00 0.00 H ATOM 67851 H2 WAT 4543 136.264 121.142 108.596 1.00 0.00 H TER 67853 WAT 4543 ATOM 67853 O WAT 4544 112.796 33.956 96.188 1.00 0.00 O ATOM 67854 H1 WAT 4544 112.680 33.703 97.104 1.00 0.00 H ATOM 67855 H2 WAT 4544 113.412 34.688 96.217 1.00 0.00 H TER 67857 WAT 4544 ATOM 67857 O WAT 4545 58.321 139.877 140.504 1.00 0.00 O ATOM 67858 H1 WAT 4545 57.667 139.812 141.199 1.00 0.00 H ATOM 67859 H2 WAT 4545 58.732 139.013 140.480 1.00 0.00 H TER 67861 WAT 4545 ATOM 67861 O WAT 4546 13.094 84.851 24.608 1.00 0.00 O ATOM 67862 H1 WAT 4546 14.035 84.949 24.751 1.00 0.00 H ATOM 67863 H2 WAT 4546 12.971 83.915 24.452 1.00 0.00 H TER 67865 WAT 4546 ATOM 67865 O WAT 4547 46.960 117.669 69.528 1.00 0.00 O ATOM 67866 H1 WAT 4547 46.949 118.497 70.008 1.00 0.00 H ATOM 67867 H2 WAT 4547 46.350 117.107 70.006 1.00 0.00 H TER 67869 WAT 4547 ATOM 67869 O WAT 4548 15.979 62.236 58.625 1.00 0.00 O ATOM 67870 H1 WAT 4548 15.941 63.073 58.162 1.00 0.00 H ATOM 67871 H2 WAT 4548 15.837 62.464 59.544 1.00 0.00 H TER 67873 WAT 4548 ATOM 67873 O WAT 4549 64.330 123.823 111.823 1.00 0.00 O ATOM 67874 H1 WAT 4549 64.371 123.166 111.128 1.00 0.00 H ATOM 67875 H2 WAT 4549 63.403 123.867 112.056 1.00 0.00 H TER 67877 WAT 4549 ATOM 67877 O WAT 4550 85.016 124.997 119.793 1.00 0.00 O ATOM 67878 H1 WAT 4550 85.204 125.346 120.664 1.00 0.00 H ATOM 67879 H2 WAT 4550 84.067 124.870 119.785 1.00 0.00 H TER 67881 WAT 4550 ATOM 67881 O WAT 4551 11.969 34.120 87.400 1.00 0.00 O ATOM 67882 H1 WAT 4551 12.449 33.337 87.129 1.00 0.00 H ATOM 67883 H2 WAT 4551 11.121 34.044 86.963 1.00 0.00 H TER 67885 WAT 4551 ATOM 67885 O WAT 4552 127.399 48.575 115.603 1.00 0.00 O ATOM 67886 H1 WAT 4552 126.509 48.274 115.789 1.00 0.00 H ATOM 67887 H2 WAT 4552 127.954 48.057 116.185 1.00 0.00 H TER 67889 WAT 4552 ATOM 67889 O WAT 4553 96.861 77.669 158.793 1.00 0.00 O ATOM 67890 H1 WAT 4553 97.149 78.574 158.676 1.00 0.00 H ATOM 67891 H2 WAT 4553 96.235 77.523 158.083 1.00 0.00 H TER 67893 WAT 4553 ATOM 67893 O WAT 4554 39.842 9.979 17.587 1.00 0.00 O ATOM 67894 H1 WAT 4554 39.931 10.717 16.984 1.00 0.00 H ATOM 67895 H2 WAT 4554 40.156 9.223 17.089 1.00 0.00 H TER 67897 WAT 4554 ATOM 67897 O WAT 4555 45.527 87.520 28.789 1.00 0.00 O ATOM 67898 H1 WAT 4555 44.616 87.246 28.681 1.00 0.00 H ATOM 67899 H2 WAT 4555 45.660 88.181 28.110 1.00 0.00 H TER 67901 WAT 4555 ATOM 67901 O WAT 4556 141.561 71.760 140.847 1.00 0.00 O ATOM 67902 H1 WAT 4556 140.766 72.159 141.202 1.00 0.00 H ATOM 67903 H2 WAT 4556 141.456 71.820 139.898 1.00 0.00 H TER 67905 WAT 4556 ATOM 67905 O WAT 4557 36.328 91.287 121.657 1.00 0.00 O ATOM 67906 H1 WAT 4557 35.472 91.502 121.288 1.00 0.00 H ATOM 67907 H2 WAT 4557 36.318 90.333 121.744 1.00 0.00 H TER 67909 WAT 4557 ATOM 67909 O WAT 4558 137.911 80.120 148.719 1.00 0.00 O ATOM 67910 H1 WAT 4558 137.434 80.936 148.868 1.00 0.00 H ATOM 67911 H2 WAT 4558 137.325 79.436 149.043 1.00 0.00 H TER 67913 WAT 4558 ATOM 67913 O WAT 4559 17.391 125.418 111.565 1.00 0.00 O ATOM 67914 H1 WAT 4559 17.554 126.067 112.249 1.00 0.00 H ATOM 67915 H2 WAT 4559 17.561 124.576 111.988 1.00 0.00 H TER 67917 WAT 4559 ATOM 67917 O WAT 4560 67.908 143.940 80.897 1.00 0.00 O ATOM 67918 H1 WAT 4560 67.149 143.400 80.676 1.00 0.00 H ATOM 67919 H2 WAT 4560 67.915 144.628 80.232 1.00 0.00 H TER 67921 WAT 4560 ATOM 67921 O WAT 4561 81.146 5.182 135.323 1.00 0.00 O ATOM 67922 H1 WAT 4561 81.515 5.836 135.916 1.00 0.00 H ATOM 67923 H2 WAT 4561 80.284 4.985 135.689 1.00 0.00 H TER 67925 WAT 4561 ATOM 67925 O WAT 4562 112.460 63.876 79.320 1.00 0.00 O ATOM 67926 H1 WAT 4562 112.179 62.993 79.082 1.00 0.00 H ATOM 67927 H2 WAT 4562 112.369 63.908 80.272 1.00 0.00 H TER 67929 WAT 4562 ATOM 67929 O WAT 4563 60.822 98.643 6.981 1.00 0.00 O ATOM 67930 H1 WAT 4563 60.398 98.070 6.341 1.00 0.00 H ATOM 67931 H2 WAT 4563 61.425 99.175 6.463 1.00 0.00 H TER 67933 WAT 4563 ATOM 67933 O WAT 4564 42.129 115.045 89.430 1.00 0.00 O ATOM 67934 H1 WAT 4564 41.802 115.912 89.192 1.00 0.00 H ATOM 67935 H2 WAT 4564 41.986 114.512 88.648 1.00 0.00 H TER 67937 WAT 4564 ATOM 67937 O WAT 4565 68.121 86.726 100.969 1.00 0.00 O ATOM 67938 H1 WAT 4565 68.107 87.609 101.339 1.00 0.00 H ATOM 67939 H2 WAT 4565 68.081 86.147 101.730 1.00 0.00 H TER 67941 WAT 4565 ATOM 67941 O WAT 4566 46.184 89.443 26.777 1.00 0.00 O ATOM 67942 H1 WAT 4566 46.795 90.174 26.693 1.00 0.00 H ATOM 67943 H2 WAT 4566 45.320 89.837 26.658 1.00 0.00 H TER 67945 WAT 4566 ATOM 67945 O WAT 4567 57.501 85.416 87.291 1.00 0.00 O ATOM 67946 H1 WAT 4567 57.544 86.369 87.218 1.00 0.00 H ATOM 67947 H2 WAT 4567 56.738 85.170 86.768 1.00 0.00 H TER 67949 WAT 4567 ATOM 67949 O WAT 4568 31.217 72.973 136.745 1.00 0.00 O ATOM 67950 H1 WAT 4568 31.484 73.265 137.617 1.00 0.00 H ATOM 67951 H2 WAT 4568 30.261 72.949 136.783 1.00 0.00 H TER 67953 WAT 4568 ATOM 67953 O WAT 4569 18.818 113.199 0.673 1.00 0.00 O ATOM 67954 H1 WAT 4569 17.898 113.364 0.464 1.00 0.00 H ATOM 67955 H2 WAT 4569 18.935 112.262 0.516 1.00 0.00 H TER 67957 WAT 4569 ATOM 67957 O WAT 4570 97.641 97.560 79.070 1.00 0.00 O ATOM 67958 H1 WAT 4570 97.891 96.926 79.742 1.00 0.00 H ATOM 67959 H2 WAT 4570 98.344 98.209 79.079 1.00 0.00 H TER 67961 WAT 4570 ATOM 67961 O WAT 4571 35.042 59.646 63.947 1.00 0.00 O ATOM 67962 H1 WAT 4571 35.334 60.319 64.562 1.00 0.00 H ATOM 67963 H2 WAT 4571 34.132 59.874 63.757 1.00 0.00 H TER 67965 WAT 4571 ATOM 67965 O WAT 4572 40.329 102.031 58.881 1.00 0.00 O ATOM 67966 H1 WAT 4572 40.360 102.981 58.768 1.00 0.00 H ATOM 67967 H2 WAT 4572 39.791 101.720 58.153 1.00 0.00 H TER 67969 WAT 4572 ATOM 67969 O WAT 4573 83.129 136.975 105.359 1.00 0.00 O ATOM 67970 H1 WAT 4573 82.891 136.194 104.860 1.00 0.00 H ATOM 67971 H2 WAT 4573 84.069 137.077 105.212 1.00 0.00 H TER 67973 WAT 4573 ATOM 67973 O WAT 4574 11.050 30.005 101.972 1.00 0.00 O ATOM 67974 H1 WAT 4574 10.315 30.076 102.581 1.00 0.00 H ATOM 67975 H2 WAT 4574 10.644 30.014 101.105 1.00 0.00 H TER 67977 WAT 4574 ATOM 67977 O WAT 4575 7.075 31.225 139.777 1.00 0.00 O ATOM 67978 H1 WAT 4575 7.368 32.135 139.737 1.00 0.00 H ATOM 67979 H2 WAT 4575 7.474 30.879 140.575 1.00 0.00 H TER 67981 WAT 4575 ATOM 67981 O WAT 4576 23.721 134.477 88.063 1.00 0.00 O ATOM 67982 H1 WAT 4576 24.602 134.671 87.744 1.00 0.00 H ATOM 67983 H2 WAT 4576 23.756 134.676 88.999 1.00 0.00 H TER 67985 WAT 4576 ATOM 67985 O WAT 4577 63.628 109.830 16.724 1.00 0.00 O ATOM 67986 H1 WAT 4577 62.798 110.292 16.602 1.00 0.00 H ATOM 67987 H2 WAT 4577 64.259 110.521 16.925 1.00 0.00 H TER 67989 WAT 4577 ATOM 67989 O WAT 4578 82.037 60.628 110.280 1.00 0.00 O ATOM 67990 H1 WAT 4578 81.330 61.241 110.483 1.00 0.00 H ATOM 67991 H2 WAT 4578 82.619 60.674 111.039 1.00 0.00 H TER 67993 WAT 4578 ATOM 67993 O WAT 4579 93.290 6.103 11.493 1.00 0.00 O ATOM 67994 H1 WAT 4579 93.866 6.302 12.231 1.00 0.00 H ATOM 67995 H2 WAT 4579 93.004 6.959 11.174 1.00 0.00 H TER 67997 WAT 4579 ATOM 67997 O WAT 4580 118.865 5.254 95.054 1.00 0.00 O ATOM 67998 H1 WAT 4580 119.371 6.047 95.229 1.00 0.00 H ATOM 67999 H2 WAT 4580 119.345 4.560 95.506 1.00 0.00 H TER 68001 WAT 4580 ATOM 68001 O WAT 4581 111.070 62.660 88.760 1.00 0.00 O ATOM 68002 H1 WAT 4581 110.318 63.143 88.417 1.00 0.00 H ATOM 68003 H2 WAT 4581 111.831 63.115 88.399 1.00 0.00 H TER 68005 WAT 4581 ATOM 68005 O WAT 4582 21.215 33.010 128.259 1.00 0.00 O ATOM 68006 H1 WAT 4582 20.611 33.710 128.010 1.00 0.00 H ATOM 68007 H2 WAT 4582 21.494 32.628 127.428 1.00 0.00 H TER 68009 WAT 4582 ATOM 68009 O WAT 4583 122.579 137.973 89.447 1.00 0.00 O ATOM 68010 H1 WAT 4583 122.247 138.655 90.030 1.00 0.00 H ATOM 68011 H2 WAT 4583 123.016 137.352 90.029 1.00 0.00 H TER 68013 WAT 4583 ATOM 68013 O WAT 4584 119.507 53.410 64.899 1.00 0.00 O ATOM 68014 H1 WAT 4584 119.518 53.081 65.798 1.00 0.00 H ATOM 68015 H2 WAT 4584 119.457 52.623 64.357 1.00 0.00 H TER 68017 WAT 4584 ATOM 68017 O WAT 4585 7.182 2.057 138.905 1.00 0.00 O ATOM 68018 H1 WAT 4585 6.994 2.942 139.218 1.00 0.00 H ATOM 68019 H2 WAT 4585 8.120 2.064 138.714 1.00 0.00 H TER 68021 WAT 4585 ATOM 68021 O WAT 4586 58.247 20.046 23.150 1.00 0.00 O ATOM 68022 H1 WAT 4586 57.898 20.723 22.570 1.00 0.00 H ATOM 68023 H2 WAT 4586 58.988 19.678 22.668 1.00 0.00 H TER 68025 WAT 4586 ATOM 68025 O WAT 4587 127.959 33.248 113.509 1.00 0.00 O ATOM 68026 H1 WAT 4587 128.515 34.008 113.339 1.00 0.00 H ATOM 68027 H2 WAT 4587 128.415 32.768 114.200 1.00 0.00 H TER 68029 WAT 4587 ATOM 68029 O WAT 4588 21.821 145.624 129.509 1.00 0.00 O ATOM 68030 H1 WAT 4588 20.874 145.521 129.423 1.00 0.00 H ATOM 68031 H2 WAT 4588 22.000 145.434 130.429 1.00 0.00 H TER 68033 WAT 4588 ATOM 68033 O WAT 4589 92.992 49.054 122.505 1.00 0.00 O ATOM 68034 H1 WAT 4589 92.297 49.031 121.847 1.00 0.00 H ATOM 68035 H2 WAT 4589 92.673 49.664 123.170 1.00 0.00 H TER 68037 WAT 4589 ATOM 68037 O WAT 4590 78.642 132.721 127.605 1.00 0.00 O ATOM 68038 H1 WAT 4590 78.155 132.361 126.863 1.00 0.00 H ATOM 68039 H2 WAT 4590 78.532 132.072 128.300 1.00 0.00 H TER 68041 WAT 4590 ATOM 68041 O WAT 4591 110.589 78.772 65.023 1.00 0.00 O ATOM 68042 H1 WAT 4591 110.930 79.343 64.335 1.00 0.00 H ATOM 68043 H2 WAT 4591 110.542 77.907 64.615 1.00 0.00 H TER 68045 WAT 4591 ATOM 68045 O WAT 4592 87.816 27.392 60.182 1.00 0.00 O ATOM 68046 H1 WAT 4592 88.040 26.463 60.237 1.00 0.00 H ATOM 68047 H2 WAT 4592 86.991 27.411 59.698 1.00 0.00 H TER 68049 WAT 4592 ATOM 68049 O WAT 4593 9.765 85.376 137.074 1.00 0.00 O ATOM 68050 H1 WAT 4593 10.652 85.686 136.888 1.00 0.00 H ATOM 68051 H2 WAT 4593 9.889 84.492 137.421 1.00 0.00 H TER 68053 WAT 4593 ATOM 68053 O WAT 4594 15.959 1.610 126.198 1.00 0.00 O ATOM 68054 H1 WAT 4594 16.736 1.378 125.689 1.00 0.00 H ATOM 68055 H2 WAT 4594 15.238 1.166 125.752 1.00 0.00 H TER 68057 WAT 4594 ATOM 68057 O WAT 4595 109.229 71.558 88.871 1.00 0.00 O ATOM 68058 H1 WAT 4595 109.595 72.351 88.480 1.00 0.00 H ATOM 68059 H2 WAT 4595 108.732 71.148 88.162 1.00 0.00 H TER 68061 WAT 4595 ATOM 68061 O WAT 4596 67.143 111.437 135.581 1.00 0.00 O ATOM 68062 H1 WAT 4596 67.273 110.649 135.053 1.00 0.00 H ATOM 68063 H2 WAT 4596 66.688 111.128 136.365 1.00 0.00 H TER 68065 WAT 4596 ATOM 68065 O WAT 4597 43.958 115.309 146.648 1.00 0.00 O ATOM 68066 H1 WAT 4597 44.189 114.674 147.325 1.00 0.00 H ATOM 68067 H2 WAT 4597 44.333 114.949 145.844 1.00 0.00 H TER 68069 WAT 4597 ATOM 68069 O WAT 4598 72.996 118.807 88.334 1.00 0.00 O ATOM 68070 H1 WAT 4598 72.983 118.160 89.040 1.00 0.00 H ATOM 68071 H2 WAT 4598 72.085 118.863 88.044 1.00 0.00 H TER 68073 WAT 4598 ATOM 68073 O WAT 4599 104.020 19.884 139.250 1.00 0.00 O ATOM 68074 H1 WAT 4599 104.913 20.151 139.467 1.00 0.00 H ATOM 68075 H2 WAT 4599 103.855 19.124 139.808 1.00 0.00 H TER 68077 WAT 4599 ATOM 68077 O WAT 4600 33.481 10.361 101.898 1.00 0.00 O ATOM 68078 H1 WAT 4600 34.387 10.252 101.608 1.00 0.00 H ATOM 68079 H2 WAT 4600 33.476 10.033 102.797 1.00 0.00 H TER 68081 WAT 4600 ATOM 68081 O WAT 4601 128.964 32.794 17.421 1.00 0.00 O ATOM 68082 H1 WAT 4601 129.477 32.093 17.019 1.00 0.00 H ATOM 68083 H2 WAT 4601 128.880 32.534 18.338 1.00 0.00 H TER 68085 WAT 4601 ATOM 68085 O WAT 4602 6.639 79.745 21.422 1.00 0.00 O ATOM 68086 H1 WAT 4602 7.404 80.263 21.671 1.00 0.00 H ATOM 68087 H2 WAT 4602 5.923 80.379 21.383 1.00 0.00 H TER 68089 WAT 4602 ATOM 68089 O WAT 4603 110.971 115.844 151.850 1.00 0.00 O ATOM 68090 H1 WAT 4603 110.928 115.144 152.501 1.00 0.00 H ATOM 68091 H2 WAT 4603 110.229 116.411 152.058 1.00 0.00 H TER 68093 WAT 4603 ATOM 68093 O WAT 4604 145.121 132.227 26.334 1.00 0.00 O ATOM 68094 H1 WAT 4604 145.475 132.552 27.161 1.00 0.00 H ATOM 68095 H2 WAT 4604 144.839 133.014 25.868 1.00 0.00 H TER 68097 WAT 4604 ATOM 68097 O WAT 4605 14.582 78.992 143.827 1.00 0.00 O ATOM 68098 H1 WAT 4605 13.974 78.443 143.332 1.00 0.00 H ATOM 68099 H2 WAT 4605 14.027 79.465 144.446 1.00 0.00 H TER 68101 WAT 4605 ATOM 68101 O WAT 4606 57.931 134.831 64.040 1.00 0.00 O ATOM 68102 H1 WAT 4606 57.115 135.144 63.650 1.00 0.00 H ATOM 68103 H2 WAT 4606 57.708 134.657 64.955 1.00 0.00 H TER 68105 WAT 4606 ATOM 68105 O WAT 4607 100.492 65.075 146.609 1.00 0.00 O ATOM 68106 H1 WAT 4607 100.906 64.342 146.152 1.00 0.00 H ATOM 68107 H2 WAT 4607 101.202 65.476 147.110 1.00 0.00 H TER 68109 WAT 4607 ATOM 68109 O WAT 4608 69.738 82.479 76.037 1.00 0.00 O ATOM 68110 H1 WAT 4608 69.770 81.818 75.345 1.00 0.00 H ATOM 68111 H2 WAT 4608 69.963 82.001 76.835 1.00 0.00 H TER 68113 WAT 4608 ATOM 68113 O WAT 4609 0.887 131.236 118.075 1.00 0.00 O ATOM 68114 H1 WAT 4609 1.293 130.956 117.254 1.00 0.00 H ATOM 68115 H2 WAT 4609 0.023 131.557 117.818 1.00 0.00 H TER 68117 WAT 4609 ATOM 68117 O WAT 4610 138.367 98.126 101.468 1.00 0.00 O ATOM 68118 H1 WAT 4610 138.800 98.737 102.064 1.00 0.00 H ATOM 68119 H2 WAT 4610 138.324 98.594 100.634 1.00 0.00 H TER 68121 WAT 4610 ATOM 68121 O WAT 4611 27.577 107.102 74.525 1.00 0.00 O ATOM 68122 H1 WAT 4611 27.962 106.908 75.379 1.00 0.00 H ATOM 68123 H2 WAT 4611 26.632 107.041 74.669 1.00 0.00 H TER 68125 WAT 4611 ATOM 68125 O WAT 4612 30.629 79.049 75.777 1.00 0.00 O ATOM 68126 H1 WAT 4612 30.477 79.288 76.692 1.00 0.00 H ATOM 68127 H2 WAT 4612 31.226 79.723 75.451 1.00 0.00 H TER 68129 WAT 4612 ATOM 68129 O WAT 4613 53.157 16.993 91.766 1.00 0.00 O ATOM 68130 H1 WAT 4613 52.324 17.320 91.427 1.00 0.00 H ATOM 68131 H2 WAT 4613 53.822 17.485 91.284 1.00 0.00 H TER 68133 WAT 4613 ATOM 68133 O WAT 4614 106.986 7.149 129.219 1.00 0.00 O ATOM 68134 H1 WAT 4614 106.300 7.163 129.886 1.00 0.00 H ATOM 68135 H2 WAT 4614 106.517 7.240 128.390 1.00 0.00 H TER 68137 WAT 4614 ATOM 68137 O WAT 4615 101.424 142.433 65.285 1.00 0.00 O ATOM 68138 H1 WAT 4615 101.715 141.751 65.890 1.00 0.00 H ATOM 68139 H2 WAT 4615 101.852 143.230 65.599 1.00 0.00 H TER 68141 WAT 4615 ATOM 68141 O WAT 4616 16.433 6.578 147.128 1.00 0.00 O ATOM 68142 H1 WAT 4616 15.860 6.833 146.404 1.00 0.00 H ATOM 68143 H2 WAT 4616 15.902 6.711 147.913 1.00 0.00 H TER 68145 WAT 4616 ATOM 68145 O WAT 4617 58.054 11.688 59.365 1.00 0.00 O ATOM 68146 H1 WAT 4617 58.102 11.290 60.235 1.00 0.00 H ATOM 68147 H2 WAT 4617 57.117 11.798 59.203 1.00 0.00 H TER 68149 WAT 4617 ATOM 68149 O WAT 4618 83.305 135.828 64.159 1.00 0.00 O ATOM 68150 H1 WAT 4618 83.402 136.607 63.611 1.00 0.00 H ATOM 68151 H2 WAT 4618 83.868 135.174 63.746 1.00 0.00 H TER 68153 WAT 4618 ATOM 68153 O WAT 4619 111.912 116.985 97.104 1.00 0.00 O ATOM 68154 H1 WAT 4619 112.195 116.843 98.007 1.00 0.00 H ATOM 68155 H2 WAT 4619 111.949 116.117 96.702 1.00 0.00 H TER 68157 WAT 4619 ATOM 68157 O WAT 4620 39.063 124.172 9.174 1.00 0.00 O ATOM 68158 H1 WAT 4620 38.758 124.604 9.972 1.00 0.00 H ATOM 68159 H2 WAT 4620 39.869 123.727 9.436 1.00 0.00 H TER 68161 WAT 4620 ATOM 68161 O WAT 4621 115.293 51.892 158.054 1.00 0.00 O ATOM 68162 H1 WAT 4621 114.363 51.787 158.254 1.00 0.00 H ATOM 68163 H2 WAT 4621 115.456 52.830 158.154 1.00 0.00 H TER 68165 WAT 4621 ATOM 68165 O WAT 4622 19.959 144.210 85.704 1.00 0.00 O ATOM 68166 H1 WAT 4622 19.841 145.039 86.168 1.00 0.00 H ATOM 68167 H2 WAT 4622 19.736 144.411 84.795 1.00 0.00 H TER 68169 WAT 4622 ATOM 68169 O WAT 4623 80.992 28.034 100.039 1.00 0.00 O ATOM 68170 H1 WAT 4623 80.782 27.312 100.632 1.00 0.00 H ATOM 68171 H2 WAT 4623 81.264 28.747 100.618 1.00 0.00 H TER 68173 WAT 4623 ATOM 68173 O WAT 4624 92.457 133.782 110.486 1.00 0.00 O ATOM 68174 H1 WAT 4624 93.197 133.289 110.132 1.00 0.00 H ATOM 68175 H2 WAT 4624 91.758 133.658 109.843 1.00 0.00 H TER 68177 WAT 4624 ATOM 68177 O WAT 4625 19.468 134.988 107.799 1.00 0.00 O ATOM 68178 H1 WAT 4625 19.688 134.266 107.209 1.00 0.00 H ATOM 68179 H2 WAT 4625 18.511 135.006 107.808 1.00 0.00 H TER 68181 WAT 4625 ATOM 68181 O WAT 4626 91.221 13.227 155.437 1.00 0.00 O ATOM 68182 H1 WAT 4626 91.947 12.879 154.919 1.00 0.00 H ATOM 68183 H2 WAT 4626 91.242 12.721 156.249 1.00 0.00 H TER 68185 WAT 4626 ATOM 68185 O WAT 4627 119.727 14.952 141.364 1.00 0.00 O ATOM 68186 H1 WAT 4627 120.373 15.249 140.723 1.00 0.00 H ATOM 68187 H2 WAT 4627 120.240 14.753 142.147 1.00 0.00 H TER 68189 WAT 4627 ATOM 68189 O WAT 4628 20.034 127.277 106.867 1.00 0.00 O ATOM 68190 H1 WAT 4628 20.351 126.494 107.316 1.00 0.00 H ATOM 68191 H2 WAT 4628 19.102 127.316 107.083 1.00 0.00 H TER 68193 WAT 4628 ATOM 68193 O WAT 4629 37.862 28.721 96.381 1.00 0.00 O ATOM 68194 H1 WAT 4629 37.086 29.260 96.533 1.00 0.00 H ATOM 68195 H2 WAT 4629 37.549 27.999 95.836 1.00 0.00 H TER 68197 WAT 4629 ATOM 68197 O WAT 4630 137.830 68.095 72.162 1.00 0.00 O ATOM 68198 H1 WAT 4630 137.163 67.460 72.422 1.00 0.00 H ATOM 68199 H2 WAT 4630 137.626 68.879 72.671 1.00 0.00 H TER 68201 WAT 4630 ATOM 68201 O WAT 4631 108.838 119.158 86.897 1.00 0.00 O ATOM 68202 H1 WAT 4631 109.400 118.939 86.154 1.00 0.00 H ATOM 68203 H2 WAT 4631 108.038 119.502 86.499 1.00 0.00 H TER 68205 WAT 4631 ATOM 68205 O WAT 4632 118.811 1.953 20.482 1.00 0.00 O ATOM 68206 H1 WAT 4632 119.723 2.217 20.360 1.00 0.00 H ATOM 68207 H2 WAT 4632 118.425 2.658 21.001 1.00 0.00 H TER 68209 WAT 4632 ATOM 68209 O WAT 4633 68.380 115.206 95.511 1.00 0.00 O ATOM 68210 H1 WAT 4633 68.266 114.561 94.813 1.00 0.00 H ATOM 68211 H2 WAT 4633 68.718 114.700 96.251 1.00 0.00 H TER 68213 WAT 4633 ATOM 68213 O WAT 4634 77.879 43.306 71.589 1.00 0.00 O ATOM 68214 H1 WAT 4634 77.651 42.384 71.704 1.00 0.00 H ATOM 68215 H2 WAT 4634 78.221 43.576 72.441 1.00 0.00 H TER 68217 WAT 4634 ATOM 68217 O WAT 4635 16.846 88.643 138.025 1.00 0.00 O ATOM 68218 H1 WAT 4635 17.416 88.969 137.329 1.00 0.00 H ATOM 68219 H2 WAT 4635 17.411 88.079 138.553 1.00 0.00 H TER 68221 WAT 4635 ATOM 68221 O WAT 4636 117.040 4.750 125.715 1.00 0.00 O ATOM 68222 H1 WAT 4636 117.110 4.505 126.637 1.00 0.00 H ATOM 68223 H2 WAT 4636 116.178 4.430 125.447 1.00 0.00 H TER 68225 WAT 4636 ATOM 68225 O WAT 4637 137.725 51.049 153.378 1.00 0.00 O ATOM 68226 H1 WAT 4637 137.012 51.469 153.858 1.00 0.00 H ATOM 68227 H2 WAT 4637 137.286 50.463 152.762 1.00 0.00 H TER 68229 WAT 4637 ATOM 68229 O WAT 4638 43.795 105.222 92.588 1.00 0.00 O ATOM 68230 H1 WAT 4638 44.000 104.396 93.027 1.00 0.00 H ATOM 68231 H2 WAT 4638 42.852 105.179 92.426 1.00 0.00 H TER 68233 WAT 4638 ATOM 68233 O WAT 4639 93.899 99.994 19.001 1.00 0.00 O ATOM 68234 H1 WAT 4639 94.019 100.228 19.922 1.00 0.00 H ATOM 68235 H2 WAT 4639 93.560 99.099 19.025 1.00 0.00 H TER 68237 WAT 4639 ATOM 68237 O WAT 4640 107.945 116.182 142.177 1.00 0.00 O ATOM 68238 H1 WAT 4640 108.360 115.350 142.404 1.00 0.00 H ATOM 68239 H2 WAT 4640 108.645 116.830 142.262 1.00 0.00 H TER 68241 WAT 4640 ATOM 68241 O WAT 4641 96.017 76.522 82.702 1.00 0.00 O ATOM 68242 H1 WAT 4641 95.349 76.295 82.054 1.00 0.00 H ATOM 68243 H2 WAT 4641 96.653 75.809 82.650 1.00 0.00 H TER 68245 WAT 4641 ATOM 68245 O WAT 4642 60.901 15.552 12.675 1.00 0.00 O ATOM 68246 H1 WAT 4642 60.661 14.745 13.131 1.00 0.00 H ATOM 68247 H2 WAT 4642 60.968 16.207 13.369 1.00 0.00 H TER 68249 WAT 4642 ATOM 68249 O WAT 4643 27.663 82.932 16.880 1.00 0.00 O ATOM 68250 H1 WAT 4643 27.579 83.334 17.745 1.00 0.00 H ATOM 68251 H2 WAT 4643 27.245 83.554 16.285 1.00 0.00 H TER 68253 WAT 4643 ATOM 68253 O WAT 4644 75.298 89.745 106.020 1.00 0.00 O ATOM 68254 H1 WAT 4644 74.595 89.610 106.656 1.00 0.00 H ATOM 68255 H2 WAT 4644 75.545 88.862 105.746 1.00 0.00 H TER 68257 WAT 4644 ATOM 68257 O WAT 4645 95.101 28.591 126.097 1.00 0.00 O ATOM 68258 H1 WAT 4645 94.850 28.753 125.188 1.00 0.00 H ATOM 68259 H2 WAT 4645 96.031 28.370 126.054 1.00 0.00 H TER 68261 WAT 4645 ATOM 68261 O WAT 4646 12.348 30.278 24.311 1.00 0.00 O ATOM 68262 H1 WAT 4646 12.430 29.324 24.343 1.00 0.00 H ATOM 68263 H2 WAT 4646 13.178 30.577 23.938 1.00 0.00 H TER 68265 WAT 4646 ATOM 68265 O WAT 4647 29.058 55.726 83.168 1.00 0.00 O ATOM 68266 H1 WAT 4647 28.897 56.065 82.287 1.00 0.00 H ATOM 68267 H2 WAT 4647 28.907 54.784 83.093 1.00 0.00 H TER 68269 WAT 4647 ATOM 68269 O WAT 4648 101.267 143.420 4.605 1.00 0.00 O ATOM 68270 H1 WAT 4648 102.213 143.551 4.679 1.00 0.00 H ATOM 68271 H2 WAT 4648 100.994 143.145 5.480 1.00 0.00 H TER 68273 WAT 4648 ATOM 68273 O WAT 4649 107.400 108.388 74.529 1.00 0.00 O ATOM 68274 H1 WAT 4649 108.192 108.895 74.705 1.00 0.00 H ATOM 68275 H2 WAT 4649 107.635 107.489 74.759 1.00 0.00 H TER 68277 WAT 4649 ATOM 68277 O WAT 4650 87.263 20.842 144.882 1.00 0.00 O ATOM 68278 H1 WAT 4650 88.137 20.910 144.499 1.00 0.00 H ATOM 68279 H2 WAT 4650 87.191 19.928 145.156 1.00 0.00 H TER 68281 WAT 4650 ATOM 68281 O WAT 4651 134.250 86.211 64.761 1.00 0.00 O ATOM 68282 H1 WAT 4651 133.931 85.786 63.965 1.00 0.00 H ATOM 68283 H2 WAT 4651 133.708 86.995 64.849 1.00 0.00 H TER 68285 WAT 4651 ATOM 68285 O WAT 4652 108.969 141.910 58.260 1.00 0.00 O ATOM 68286 H1 WAT 4652 109.597 141.590 58.907 1.00 0.00 H ATOM 68287 H2 WAT 4652 109.452 142.568 57.761 1.00 0.00 H TER 68289 WAT 4652 ATOM 68289 O WAT 4653 133.372 43.346 155.903 1.00 0.00 O ATOM 68290 H1 WAT 4653 132.895 43.959 156.462 1.00 0.00 H ATOM 68291 H2 WAT 4653 133.546 42.592 156.467 1.00 0.00 H TER 68293 WAT 4653 ATOM 68293 O WAT 4654 102.513 39.519 98.863 1.00 0.00 O ATOM 68294 H1 WAT 4654 103.120 40.245 98.719 1.00 0.00 H ATOM 68295 H2 WAT 4654 102.046 39.752 99.665 1.00 0.00 H TER 68297 WAT 4654 ATOM 68297 O WAT 4655 16.338 25.412 125.459 1.00 0.00 O ATOM 68298 H1 WAT 4655 17.068 24.793 125.457 1.00 0.00 H ATOM 68299 H2 WAT 4655 15.834 25.191 124.677 1.00 0.00 H TER 68301 WAT 4655 ATOM 68301 O WAT 4656 82.100 33.679 7.375 1.00 0.00 O ATOM 68302 H1 WAT 4656 81.248 33.686 6.938 1.00 0.00 H ATOM 68303 H2 WAT 4656 82.466 32.818 7.174 1.00 0.00 H TER 68305 WAT 4656 ATOM 68305 O WAT 4657 116.266 93.281 108.828 1.00 0.00 O ATOM 68306 H1 WAT 4657 115.362 93.303 109.141 1.00 0.00 H ATOM 68307 H2 WAT 4657 116.242 92.702 108.066 1.00 0.00 H TER 68309 WAT 4657 ATOM 68309 O WAT 4658 38.146 108.791 89.507 1.00 0.00 O ATOM 68310 H1 WAT 4658 38.796 109.449 89.261 1.00 0.00 H ATOM 68311 H2 WAT 4658 38.139 108.807 90.464 1.00 0.00 H TER 68313 WAT 4658 ATOM 68313 O WAT 4659 7.465 13.900 22.850 1.00 0.00 O ATOM 68314 H1 WAT 4659 7.731 13.016 23.107 1.00 0.00 H ATOM 68315 H2 WAT 4659 6.556 13.804 22.568 1.00 0.00 H TER 68317 WAT 4659 ATOM 68317 O WAT 4660 116.807 130.802 20.150 1.00 0.00 O ATOM 68318 H1 WAT 4660 117.677 130.438 20.316 1.00 0.00 H ATOM 68319 H2 WAT 4660 116.683 130.704 19.206 1.00 0.00 H TER 68321 WAT 4660 ATOM 68321 O WAT 4661 84.747 125.793 87.911 1.00 0.00 O ATOM 68322 H1 WAT 4661 83.958 126.248 88.203 1.00 0.00 H ATOM 68323 H2 WAT 4661 85.261 125.668 88.709 1.00 0.00 H TER 68325 WAT 4661 ATOM 68325 O WAT 4662 56.137 132.445 74.427 1.00 0.00 O ATOM 68326 H1 WAT 4662 55.321 132.942 74.494 1.00 0.00 H ATOM 68327 H2 WAT 4662 56.746 132.906 75.003 1.00 0.00 H TER 68329 WAT 4662 ATOM 68329 O WAT 4663 13.040 142.790 146.901 1.00 0.00 O ATOM 68330 H1 WAT 4663 13.014 142.883 147.853 1.00 0.00 H ATOM 68331 H2 WAT 4663 13.701 143.421 146.617 1.00 0.00 H TER 68333 WAT 4663 ATOM 68333 O WAT 4664 70.489 72.136 90.303 1.00 0.00 O ATOM 68334 H1 WAT 4664 71.129 72.126 89.592 1.00 0.00 H ATOM 68335 H2 WAT 4664 69.965 72.921 90.144 1.00 0.00 H TER 68337 WAT 4664 ATOM 68337 O WAT 4665 73.466 50.257 136.842 1.00 0.00 O ATOM 68338 H1 WAT 4665 73.730 51.175 136.893 1.00 0.00 H ATOM 68339 H2 WAT 4665 73.064 50.171 135.977 1.00 0.00 H TER 68341 WAT 4665 ATOM 68341 O WAT 4666 80.499 41.285 128.853 1.00 0.00 O ATOM 68342 H1 WAT 4666 81.310 40.830 128.625 1.00 0.00 H ATOM 68343 H2 WAT 4666 80.439 41.999 128.218 1.00 0.00 H TER 68345 WAT 4666 ATOM 68345 O WAT 4667 102.762 142.042 133.988 1.00 0.00 O ATOM 68346 H1 WAT 4667 102.281 142.715 133.506 1.00 0.00 H ATOM 68347 H2 WAT 4667 103.366 142.533 134.546 1.00 0.00 H TER 68349 WAT 4667 ATOM 68349 O WAT 4668 121.759 23.366 62.933 1.00 0.00 O ATOM 68350 H1 WAT 4668 121.324 23.878 62.251 1.00 0.00 H ATOM 68351 H2 WAT 4668 121.457 23.754 63.754 1.00 0.00 H TER 68353 WAT 4668 ATOM 68353 O WAT 4669 110.479 84.026 19.614 1.00 0.00 O ATOM 68354 H1 WAT 4669 111.082 84.698 19.932 1.00 0.00 H ATOM 68355 H2 WAT 4669 110.188 84.349 18.762 1.00 0.00 H TER 68357 WAT 4669 ATOM 68357 O WAT 4670 143.324 80.704 5.356 1.00 0.00 O ATOM 68358 H1 WAT 4670 142.910 79.944 5.764 1.00 0.00 H ATOM 68359 H2 WAT 4670 142.881 81.457 5.749 1.00 0.00 H TER 68361 WAT 4670 ATOM 68361 O WAT 4671 102.880 136.917 145.613 1.00 0.00 O ATOM 68362 H1 WAT 4671 102.841 135.996 145.871 1.00 0.00 H ATOM 68363 H2 WAT 4671 102.839 137.400 146.438 1.00 0.00 H TER 68365 WAT 4671 ATOM 68365 O WAT 4672 30.424 1.893 86.507 1.00 0.00 O ATOM 68366 H1 WAT 4672 31.099 2.145 87.136 1.00 0.00 H ATOM 68367 H2 WAT 4672 29.647 2.382 86.779 1.00 0.00 H TER 68369 WAT 4672 ATOM 68369 O WAT 4673 36.089 116.969 109.283 1.00 0.00 O ATOM 68370 H1 WAT 4673 36.851 116.791 108.732 1.00 0.00 H ATOM 68371 H2 WAT 4673 35.349 116.615 108.790 1.00 0.00 H TER 68373 WAT 4673 ATOM 68373 O WAT 4674 102.065 31.121 133.876 1.00 0.00 O ATOM 68374 H1 WAT 4674 101.643 31.930 133.587 1.00 0.00 H ATOM 68375 H2 WAT 4674 102.758 31.411 134.469 1.00 0.00 H TER 68377 WAT 4674 ATOM 68377 O WAT 4675 97.997 93.517 99.131 1.00 0.00 O ATOM 68378 H1 WAT 4675 98.668 93.472 99.812 1.00 0.00 H ATOM 68379 H2 WAT 4675 98.473 93.365 98.314 1.00 0.00 H TER 68381 WAT 4675 ATOM 68381 O WAT 4676 103.110 84.488 99.754 1.00 0.00 O ATOM 68382 H1 WAT 4676 103.093 84.695 100.688 1.00 0.00 H ATOM 68383 H2 WAT 4676 103.282 83.547 99.719 1.00 0.00 H TER 68385 WAT 4676 ATOM 68385 O WAT 4677 19.661 86.888 119.932 1.00 0.00 O ATOM 68386 H1 WAT 4677 20.069 87.439 120.600 1.00 0.00 H ATOM 68387 H2 WAT 4677 18.913 87.400 119.624 1.00 0.00 H TER 68389 WAT 4677 ATOM 68389 O WAT 4678 50.516 77.586 11.507 1.00 0.00 O ATOM 68390 H1 WAT 4678 51.465 77.586 11.633 1.00 0.00 H ATOM 68391 H2 WAT 4678 50.372 78.177 10.769 1.00 0.00 H TER 68393 WAT 4678 ATOM 68393 O WAT 4679 92.685 66.110 96.483 1.00 0.00 O ATOM 68394 H1 WAT 4679 92.795 67.021 96.756 1.00 0.00 H ATOM 68395 H2 WAT 4679 91.975 66.135 95.842 1.00 0.00 H TER 68397 WAT 4679 ATOM 68397 O WAT 4680 58.424 51.407 154.274 1.00 0.00 O ATOM 68398 H1 WAT 4680 58.315 50.457 154.270 1.00 0.00 H ATOM 68399 H2 WAT 4680 59.003 51.579 155.017 1.00 0.00 H TER 68401 WAT 4680 ATOM 68401 O WAT 4681 137.141 52.531 64.365 1.00 0.00 O ATOM 68402 H1 WAT 4681 136.495 51.877 64.098 1.00 0.00 H ATOM 68403 H2 WAT 4681 136.792 53.359 64.035 1.00 0.00 H TER 68405 WAT 4681 ATOM 68405 O WAT 4682 123.140 71.993 67.807 1.00 0.00 O ATOM 68406 H1 WAT 4682 124.003 72.381 67.948 1.00 0.00 H ATOM 68407 H2 WAT 4682 122.931 71.565 68.638 1.00 0.00 H TER 68409 WAT 4682 ATOM 68409 O WAT 4683 96.336 71.667 67.891 1.00 0.00 O ATOM 68410 H1 WAT 4683 96.829 71.517 67.084 1.00 0.00 H ATOM 68411 H2 WAT 4683 95.989 72.554 67.798 1.00 0.00 H TER 68413 WAT 4683 ATOM 68413 O WAT 4684 96.575 99.191 22.035 1.00 0.00 O ATOM 68414 H1 WAT 4684 97.354 99.289 22.584 1.00 0.00 H ATOM 68415 H2 WAT 4684 95.930 98.776 22.608 1.00 0.00 H TER 68417 WAT 4684 ATOM 68417 O WAT 4685 59.490 49.364 70.974 1.00 0.00 O ATOM 68418 H1 WAT 4685 58.971 49.969 70.445 1.00 0.00 H ATOM 68419 H2 WAT 4685 59.050 49.350 71.824 1.00 0.00 H TER 68421 WAT 4685 ATOM 68421 O WAT 4686 135.493 116.525 84.060 1.00 0.00 O ATOM 68422 H1 WAT 4686 135.948 116.908 84.810 1.00 0.00 H ATOM 68423 H2 WAT 4686 135.250 117.276 83.518 1.00 0.00 H TER 68425 WAT 4686 ATOM 68425 O WAT 4687 103.600 25.633 82.755 1.00 0.00 O ATOM 68426 H1 WAT 4687 103.406 25.842 81.841 1.00 0.00 H ATOM 68427 H2 WAT 4687 104.556 25.629 82.802 1.00 0.00 H TER 68429 WAT 4687 ATOM 68429 O WAT 4688 101.860 95.433 60.890 1.00 0.00 O ATOM 68430 H1 WAT 4688 101.495 96.031 60.239 1.00 0.00 H ATOM 68431 H2 WAT 4688 102.435 95.981 61.424 1.00 0.00 H TER 68433 WAT 4688 ATOM 68433 O WAT 4689 49.418 95.614 17.109 1.00 0.00 O ATOM 68434 H1 WAT 4689 48.829 96.181 16.611 1.00 0.00 H ATOM 68435 H2 WAT 4689 50.295 95.877 16.831 1.00 0.00 H TER 68437 WAT 4689 ATOM 68437 O WAT 4690 61.201 29.053 109.039 1.00 0.00 O ATOM 68438 H1 WAT 4690 61.250 28.353 108.388 1.00 0.00 H ATOM 68439 H2 WAT 4690 61.676 29.783 108.642 1.00 0.00 H TER 68441 WAT 4690 ATOM 68441 O WAT 4691 51.361 118.644 52.143 1.00 0.00 O ATOM 68442 H1 WAT 4691 51.894 119.040 52.832 1.00 0.00 H ATOM 68443 H2 WAT 4691 51.935 117.991 51.743 1.00 0.00 H TER 68445 WAT 4691 ATOM 68445 O WAT 4692 29.317 25.490 132.562 1.00 0.00 O ATOM 68446 H1 WAT 4692 30.095 26.048 132.535 1.00 0.00 H ATOM 68447 H2 WAT 4692 29.143 25.278 131.645 1.00 0.00 H TER 68449 WAT 4692 ATOM 68449 O WAT 4693 26.961 46.985 64.455 1.00 0.00 O ATOM 68450 H1 WAT 4693 27.695 47.147 65.047 1.00 0.00 H ATOM 68451 H2 WAT 4693 26.202 47.352 64.908 1.00 0.00 H TER 68453 WAT 4693 ATOM 68453 O WAT 4694 142.115 114.684 113.277 1.00 0.00 O ATOM 68454 H1 WAT 4694 141.504 114.863 112.563 1.00 0.00 H ATOM 68455 H2 WAT 4694 142.597 115.503 113.392 1.00 0.00 H TER 68457 WAT 4694 ATOM 68457 O WAT 4695 4.840 99.338 74.087 1.00 0.00 O ATOM 68458 H1 WAT 4695 5.159 98.688 73.461 1.00 0.00 H ATOM 68459 H2 WAT 4695 4.127 99.782 73.628 1.00 0.00 H TER 68461 WAT 4695 ATOM 68461 O WAT 4696 138.205 73.491 156.946 1.00 0.00 O ATOM 68462 H1 WAT 4696 137.450 73.603 156.369 1.00 0.00 H ATOM 68463 H2 WAT 4696 138.876 73.098 156.388 1.00 0.00 H TER 68465 WAT 4696 ATOM 68465 O WAT 4697 97.742 130.158 74.993 1.00 0.00 O ATOM 68466 H1 WAT 4697 97.062 129.540 74.725 1.00 0.00 H ATOM 68467 H2 WAT 4697 98.180 130.399 74.177 1.00 0.00 H TER 68469 WAT 4697 ATOM 68469 O WAT 4698 49.723 59.137 13.874 1.00 0.00 O ATOM 68470 H1 WAT 4698 49.964 58.750 13.032 1.00 0.00 H ATOM 68471 H2 WAT 4698 50.400 58.835 14.479 1.00 0.00 H TER 68473 WAT 4698 ATOM 68473 O WAT 4699 29.400 143.649 119.378 1.00 0.00 O ATOM 68474 H1 WAT 4699 30.156 143.379 118.856 1.00 0.00 H ATOM 68475 H2 WAT 4699 29.077 144.438 118.943 1.00 0.00 H TER 68477 WAT 4699 ATOM 68477 O WAT 4700 117.449 39.236 146.769 1.00 0.00 O ATOM 68478 H1 WAT 4700 117.570 39.344 145.825 1.00 0.00 H ATOM 68479 H2 WAT 4700 116.520 39.416 146.913 1.00 0.00 H TER 68481 WAT 4700 ATOM 68481 O WAT 4701 73.363 43.832 120.001 1.00 0.00 O ATOM 68482 H1 WAT 4701 72.628 44.446 119.972 1.00 0.00 H ATOM 68483 H2 WAT 4701 73.926 44.099 119.275 1.00 0.00 H TER 68485 WAT 4701 ATOM 68485 O WAT 4702 108.024 53.547 11.399 1.00 0.00 O ATOM 68486 H1 WAT 4702 107.927 52.992 10.625 1.00 0.00 H ATOM 68487 H2 WAT 4702 107.291 54.160 11.347 1.00 0.00 H TER 68489 WAT 4702 ATOM 68489 O WAT 4703 134.042 58.928 90.230 1.00 0.00 O ATOM 68490 H1 WAT 4703 133.941 59.875 90.134 1.00 0.00 H ATOM 68491 H2 WAT 4703 134.305 58.807 91.142 1.00 0.00 H TER 68493 WAT 4703 ATOM 68493 O WAT 4704 65.625 45.141 103.316 1.00 0.00 O ATOM 68494 H1 WAT 4704 65.892 45.161 102.397 1.00 0.00 H ATOM 68495 H2 WAT 4704 66.190 45.786 103.743 1.00 0.00 H TER 68497 WAT 4704 ATOM 68497 O WAT 4705 141.132 6.759 2.780 1.00 0.00 O ATOM 68498 H1 WAT 4705 141.565 6.652 3.627 1.00 0.00 H ATOM 68499 H2 WAT 4705 141.513 7.558 2.416 1.00 0.00 H TER 68501 WAT 4705 ATOM 68501 O WAT 4706 12.036 135.153 3.482 1.00 0.00 O ATOM 68502 H1 WAT 4706 11.774 134.244 3.628 1.00 0.00 H ATOM 68503 H2 WAT 4706 12.275 135.476 4.351 1.00 0.00 H TER 68505 WAT 4706 ATOM 68505 O WAT 4707 48.105 64.426 78.581 1.00 0.00 O ATOM 68506 H1 WAT 4707 47.983 64.609 79.513 1.00 0.00 H ATOM 68507 H2 WAT 4707 47.309 64.759 78.166 1.00 0.00 H TER 68509 WAT 4707 ATOM 68509 O WAT 4708 85.250 104.068 81.992 1.00 0.00 O ATOM 68510 H1 WAT 4708 85.308 103.120 82.111 1.00 0.00 H ATOM 68511 H2 WAT 4708 85.569 104.433 82.817 1.00 0.00 H TER 68513 WAT 4708 ATOM 68513 O WAT 4709 137.034 26.806 100.716 1.00 0.00 O ATOM 68514 H1 WAT 4709 137.283 26.184 101.399 1.00 0.00 H ATOM 68515 H2 WAT 4709 136.419 26.322 100.163 1.00 0.00 H TER 68517 WAT 4709 ATOM 68517 O WAT 4710 71.654 106.326 54.642 1.00 0.00 O ATOM 68518 H1 WAT 4710 71.318 107.214 54.769 1.00 0.00 H ATOM 68519 H2 WAT 4710 70.917 105.844 54.267 1.00 0.00 H TER 68521 WAT 4710 ATOM 68521 O WAT 4711 106.477 113.998 8.095 1.00 0.00 O ATOM 68522 H1 WAT 4711 106.725 113.109 8.351 1.00 0.00 H ATOM 68523 H2 WAT 4711 105.747 114.219 8.674 1.00 0.00 H TER 68525 WAT 4711 ATOM 68525 O WAT 4712 28.753 90.387 14.653 1.00 0.00 O ATOM 68526 H1 WAT 4712 28.733 91.343 14.684 1.00 0.00 H ATOM 68527 H2 WAT 4712 29.080 90.126 15.514 1.00 0.00 H TER 68529 WAT 4712 ATOM 68529 O WAT 4713 112.244 128.842 105.741 1.00 0.00 O ATOM 68530 H1 WAT 4713 112.011 128.149 105.124 1.00 0.00 H ATOM 68531 H2 WAT 4713 111.778 129.615 105.420 1.00 0.00 H TER 68533 WAT 4713 ATOM 68533 O WAT 4714 99.510 54.878 111.767 1.00 0.00 O ATOM 68534 H1 WAT 4714 99.548 53.980 112.099 1.00 0.00 H ATOM 68535 H2 WAT 4714 99.820 55.416 112.495 1.00 0.00 H TER 68537 WAT 4714 ATOM 68537 O WAT 4715 121.197 30.758 21.090 1.00 0.00 O ATOM 68538 H1 WAT 4715 120.713 30.082 20.617 1.00 0.00 H ATOM 68539 H2 WAT 4715 121.952 30.300 21.458 1.00 0.00 H TER 68541 WAT 4715 ATOM 68541 O WAT 4716 72.035 42.047 126.465 1.00 0.00 O ATOM 68542 H1 WAT 4716 71.595 42.747 126.946 1.00 0.00 H ATOM 68543 H2 WAT 4716 71.350 41.397 126.309 1.00 0.00 H TER 68545 WAT 4716 ATOM 68545 O WAT 4717 1.847 102.993 136.738 1.00 0.00 O ATOM 68546 H1 WAT 4717 2.536 102.339 136.619 1.00 0.00 H ATOM 68547 H2 WAT 4717 2.162 103.761 136.261 1.00 0.00 H TER 68549 WAT 4717 ATOM 68549 O WAT 4718 65.838 107.072 84.119 1.00 0.00 O ATOM 68550 H1 WAT 4718 65.755 106.476 83.375 1.00 0.00 H ATOM 68551 H2 WAT 4718 66.597 106.747 84.603 1.00 0.00 H TER 68553 WAT 4718 ATOM 68553 O WAT 4719 29.303 144.175 147.266 1.00 0.00 O ATOM 68554 H1 WAT 4719 30.196 144.251 147.602 1.00 0.00 H ATOM 68555 H2 WAT 4719 28.859 144.960 147.588 1.00 0.00 H TER 68557 WAT 4719 ATOM 68557 O WAT 4720 64.738 96.861 4.754 1.00 0.00 O ATOM 68558 H1 WAT 4720 64.041 96.266 4.477 1.00 0.00 H ATOM 68559 H2 WAT 4720 65.325 96.315 5.276 1.00 0.00 H TER 68561 WAT 4720 ATOM 68561 O WAT 4721 122.640 2.222 124.219 1.00 0.00 O ATOM 68562 H1 WAT 4721 123.559 2.018 124.393 1.00 0.00 H ATOM 68563 H2 WAT 4721 122.348 2.695 124.998 1.00 0.00 H TER 68565 WAT 4721 ATOM 68565 O WAT 4722 5.137 118.877 63.269 1.00 0.00 O ATOM 68566 H1 WAT 4722 5.720 118.410 62.670 1.00 0.00 H ATOM 68567 H2 WAT 4722 5.693 119.541 63.676 1.00 0.00 H TER 68569 WAT 4722 ATOM 68569 O WAT 4723 2.809 6.890 58.599 1.00 0.00 O ATOM 68570 H1 WAT 4723 3.411 7.415 59.127 1.00 0.00 H ATOM 68571 H2 WAT 4723 3.372 6.447 57.964 1.00 0.00 H TER 68573 WAT 4723 ATOM 68573 O WAT 4724 66.349 24.181 108.180 1.00 0.00 O ATOM 68574 H1 WAT 4724 65.763 23.687 108.753 1.00 0.00 H ATOM 68575 H2 WAT 4724 65.782 24.503 107.479 1.00 0.00 H TER 68577 WAT 4724 ATOM 68577 O WAT 4725 125.298 47.756 77.957 1.00 0.00 O ATOM 68578 H1 WAT 4725 125.554 47.149 78.651 1.00 0.00 H ATOM 68579 H2 WAT 4725 125.636 48.605 78.244 1.00 0.00 H TER 68581 WAT 4725 ATOM 68581 O WAT 4726 98.886 46.273 108.746 1.00 0.00 O ATOM 68582 H1 WAT 4726 99.015 46.623 109.627 1.00 0.00 H ATOM 68583 H2 WAT 4726 98.961 47.035 108.172 1.00 0.00 H TER 68585 WAT 4726 ATOM 68585 O WAT 4727 63.637 31.827 141.007 1.00 0.00 O ATOM 68586 H1 WAT 4727 63.604 31.428 140.138 1.00 0.00 H ATOM 68587 H2 WAT 4727 62.730 32.069 141.194 1.00 0.00 H TER 68589 WAT 4727 ATOM 68589 O WAT 4728 69.207 145.689 105.631 1.00 0.00 O ATOM 68590 H1 WAT 4728 70.049 145.779 105.184 1.00 0.00 H ATOM 68591 H2 WAT 4728 69.414 145.805 106.558 1.00 0.00 H TER 68593 WAT 4728 ATOM 68593 O WAT 4729 77.443 114.646 147.961 1.00 0.00 O ATOM 68594 H1 WAT 4729 77.666 114.545 148.886 1.00 0.00 H ATOM 68595 H2 WAT 4729 76.666 115.205 147.962 1.00 0.00 H TER 68597 WAT 4729 ATOM 68597 O WAT 4730 13.647 44.252 136.388 1.00 0.00 O ATOM 68598 H1 WAT 4730 13.292 43.394 136.155 1.00 0.00 H ATOM 68599 H2 WAT 4730 13.988 44.138 137.274 1.00 0.00 H TER 68601 WAT 4730 ATOM 68601 O WAT 4731 124.480 69.128 55.731 1.00 0.00 O ATOM 68602 H1 WAT 4731 124.519 68.356 56.296 1.00 0.00 H ATOM 68603 H2 WAT 4731 125.219 69.024 55.131 1.00 0.00 H TER 68605 WAT 4731 ATOM 68605 O WAT 4732 111.650 79.034 99.321 1.00 0.00 O ATOM 68606 H1 WAT 4732 112.240 79.364 98.644 1.00 0.00 H ATOM 68607 H2 WAT 4732 110.847 79.543 99.208 1.00 0.00 H TER 68609 WAT 4732 ATOM 68609 O WAT 4733 140.286 13.752 131.980 1.00 0.00 O ATOM 68610 H1 WAT 4733 140.774 13.528 131.188 1.00 0.00 H ATOM 68611 H2 WAT 4733 140.867 13.500 132.698 1.00 0.00 H TER 68613 WAT 4733 ATOM 68613 O WAT 4734 76.305 138.032 85.196 1.00 0.00 O ATOM 68614 H1 WAT 4734 75.665 138.364 84.565 1.00 0.00 H ATOM 68615 H2 WAT 4734 76.256 137.080 85.109 1.00 0.00 H TER 68617 WAT 4734 ATOM 68617 O WAT 4735 114.431 57.604 136.073 1.00 0.00 O ATOM 68618 H1 WAT 4735 114.349 56.921 136.739 1.00 0.00 H ATOM 68619 H2 WAT 4735 113.614 58.099 136.137 1.00 0.00 H TER 68621 WAT 4735 ATOM 68621 O WAT 4736 115.062 17.505 125.097 1.00 0.00 O ATOM 68622 H1 WAT 4736 114.290 17.053 124.758 1.00 0.00 H ATOM 68623 H2 WAT 4736 115.363 18.046 124.367 1.00 0.00 H TER 68625 WAT 4736 ATOM 68625 O WAT 4737 96.028 131.997 122.032 1.00 0.00 O ATOM 68626 H1 WAT 4737 95.787 131.336 121.383 1.00 0.00 H ATOM 68627 H2 WAT 4737 96.985 132.015 122.012 1.00 0.00 H TER 68629 WAT 4737 ATOM 68629 O WAT 4738 37.134 0.099 10.254 1.00 0.00 O ATOM 68630 H1 WAT 4738 36.425 -0.100 10.865 1.00 0.00 H ATOM 68631 H2 WAT 4738 37.916 0.153 10.804 1.00 0.00 H TER 68633 WAT 4738 ATOM 68633 O WAT 4739 103.223 83.642 104.441 1.00 0.00 O ATOM 68634 H1 WAT 4739 102.834 83.712 105.312 1.00 0.00 H ATOM 68635 H2 WAT 4739 102.474 83.619 103.845 1.00 0.00 H TER 68637 WAT 4739 ATOM 68637 O WAT 4740 2.136 85.524 107.986 1.00 0.00 O ATOM 68638 H1 WAT 4740 2.032 85.944 107.132 1.00 0.00 H ATOM 68639 H2 WAT 4740 2.445 86.223 108.562 1.00 0.00 H TER 68641 WAT 4740 ATOM 68641 O WAT 4741 42.487 94.381 113.259 1.00 0.00 O ATOM 68642 H1 WAT 4741 41.761 93.995 113.750 1.00 0.00 H ATOM 68643 H2 WAT 4741 42.115 94.582 112.400 1.00 0.00 H TER 68645 WAT 4741 ATOM 68645 O WAT 4742 144.336 122.573 11.368 1.00 0.00 O ATOM 68646 H1 WAT 4742 144.833 122.050 10.739 1.00 0.00 H ATOM 68647 H2 WAT 4742 144.713 122.347 12.219 1.00 0.00 H TER 68649 WAT 4742 ATOM 68649 O WAT 4743 5.605 69.830 111.913 1.00 0.00 O ATOM 68650 H1 WAT 4743 5.761 68.910 111.699 1.00 0.00 H ATOM 68651 H2 WAT 4743 5.576 70.272 111.065 1.00 0.00 H TER 68653 WAT 4743 ATOM 68653 O WAT 4744 143.875 54.449 105.363 1.00 0.00 O ATOM 68654 H1 WAT 4744 142.941 54.588 105.208 1.00 0.00 H ATOM 68655 H2 WAT 4744 143.916 53.638 105.870 1.00 0.00 H TER 68657 WAT 4744 ATOM 68657 O WAT 4745 90.323 50.534 93.260 1.00 0.00 O ATOM 68658 H1 WAT 4745 90.851 50.112 93.938 1.00 0.00 H ATOM 68659 H2 WAT 4745 90.333 51.463 93.492 1.00 0.00 H TER 68661 WAT 4745 ATOM 68661 O WAT 4746 118.090 90.658 101.563 1.00 0.00 O ATOM 68662 H1 WAT 4746 117.375 90.598 100.930 1.00 0.00 H ATOM 68663 H2 WAT 4746 118.728 90.008 101.266 1.00 0.00 H TER 68665 WAT 4746 ATOM 68665 O WAT 4747 2.460 75.584 73.327 1.00 0.00 O ATOM 68666 H1 WAT 4747 1.686 75.907 73.789 1.00 0.00 H ATOM 68667 H2 WAT 4747 2.176 74.761 72.930 1.00 0.00 H TER 68669 WAT 4747 ATOM 68669 O WAT 4748 59.621 38.820 119.622 1.00 0.00 O ATOM 68670 H1 WAT 4748 58.997 39.330 120.140 1.00 0.00 H ATOM 68671 H2 WAT 4748 60.275 38.526 120.257 1.00 0.00 H TER 68673 WAT 4748 ATOM 68673 O WAT 4749 95.298 18.480 101.130 1.00 0.00 O ATOM 68674 H1 WAT 4749 95.130 18.127 102.004 1.00 0.00 H ATOM 68675 H2 WAT 4749 96.179 18.175 100.913 1.00 0.00 H TER 68677 WAT 4749 ATOM 68677 O WAT 4750 101.690 66.023 67.218 1.00 0.00 O ATOM 68678 H1 WAT 4750 102.009 66.783 66.732 1.00 0.00 H ATOM 68679 H2 WAT 4750 102.483 65.545 67.461 1.00 0.00 H TER 68681 WAT 4750 ATOM 68681 O WAT 4751 94.140 131.640 72.448 1.00 0.00 O ATOM 68682 H1 WAT 4751 93.820 132.534 72.326 1.00 0.00 H ATOM 68683 H2 WAT 4751 93.481 131.224 73.005 1.00 0.00 H TER 68685 WAT 4751 ATOM 68685 O WAT 4752 105.514 109.994 139.558 1.00 0.00 O ATOM 68686 H1 WAT 4752 105.688 110.527 138.782 1.00 0.00 H ATOM 68687 H2 WAT 4752 105.432 110.627 140.271 1.00 0.00 H TER 68689 WAT 4752 ATOM 68689 O WAT 4753 83.890 22.554 77.869 1.00 0.00 O ATOM 68690 H1 WAT 4753 84.244 22.468 76.984 1.00 0.00 H ATOM 68691 H2 WAT 4753 83.450 21.720 78.034 1.00 0.00 H TER 68693 WAT 4753 ATOM 68693 O WAT 4754 46.772 114.864 74.188 1.00 0.00 O ATOM 68694 H1 WAT 4754 47.567 115.359 74.386 1.00 0.00 H ATOM 68695 H2 WAT 4754 46.317 114.796 75.027 1.00 0.00 H TER 68697 WAT 4754 ATOM 68697 O WAT 4755 31.520 80.000 112.930 1.00 0.00 O ATOM 68698 H1 WAT 4755 31.951 80.123 113.776 1.00 0.00 H ATOM 68699 H2 WAT 4755 31.124 79.131 112.987 1.00 0.00 H TER 68701 WAT 4755 ATOM 68701 O WAT 4756 103.483 11.514 144.074 1.00 0.00 O ATOM 68702 H1 WAT 4756 103.950 11.569 143.241 1.00 0.00 H ATOM 68703 H2 WAT 4756 103.121 12.391 144.204 1.00 0.00 H TER 68705 WAT 4756 ATOM 68705 O WAT 4757 28.237 77.240 119.964 1.00 0.00 O ATOM 68706 H1 WAT 4757 27.964 77.086 120.869 1.00 0.00 H ATOM 68707 H2 WAT 4757 27.777 76.571 119.458 1.00 0.00 H TER 68709 WAT 4757 ATOM 68709 O WAT 4758 71.178 51.217 147.078 1.00 0.00 O ATOM 68710 H1 WAT 4758 71.736 51.915 146.736 1.00 0.00 H ATOM 68711 H2 WAT 4758 70.288 51.496 146.862 1.00 0.00 H TER 68713 WAT 4758 ATOM 68713 O WAT 4759 81.954 49.436 111.477 1.00 0.00 O ATOM 68714 H1 WAT 4759 81.752 49.114 110.598 1.00 0.00 H ATOM 68715 H2 WAT 4759 81.224 49.132 112.016 1.00 0.00 H TER 68717 WAT 4759 ATOM 68717 O WAT 4760 72.972 80.006 14.761 1.00 0.00 O ATOM 68718 H1 WAT 4760 72.358 79.286 14.906 1.00 0.00 H ATOM 68719 H2 WAT 4760 72.422 80.734 14.470 1.00 0.00 H TER 68721 WAT 4760 ATOM 68721 O WAT 4761 74.599 51.254 78.130 1.00 0.00 O ATOM 68722 H1 WAT 4761 74.649 52.163 78.427 1.00 0.00 H ATOM 68723 H2 WAT 4761 75.463 50.890 78.325 1.00 0.00 H TER 68725 WAT 4761 ATOM 68725 O WAT 4762 5.169 126.478 157.519 1.00 0.00 O ATOM 68726 H1 WAT 4762 4.224 126.421 157.377 1.00 0.00 H ATOM 68727 H2 WAT 4762 5.315 126.017 158.345 1.00 0.00 H TER 68729 WAT 4762 ATOM 68729 O WAT 4763 141.710 122.582 13.187 1.00 0.00 O ATOM 68730 H1 WAT 4763 141.662 123.477 13.522 1.00 0.00 H ATOM 68731 H2 WAT 4763 142.647 122.417 13.076 1.00 0.00 H TER 68733 WAT 4763 ATOM 68733 O WAT 4764 54.344 14.363 156.837 1.00 0.00 O ATOM 68734 H1 WAT 4764 54.862 13.561 156.903 1.00 0.00 H ATOM 68735 H2 WAT 4764 54.767 14.864 156.140 1.00 0.00 H TER 68737 WAT 4764 ATOM 68737 O WAT 4765 58.477 37.300 146.458 1.00 0.00 O ATOM 68738 H1 WAT 4765 59.020 36.955 147.167 1.00 0.00 H ATOM 68739 H2 WAT 4765 58.904 38.119 146.206 1.00 0.00 H TER 68741 WAT 4765 ATOM 68741 O WAT 4766 133.842 112.177 132.773 1.00 0.00 O ATOM 68742 H1 WAT 4766 133.888 113.084 133.077 1.00 0.00 H ATOM 68743 H2 WAT 4766 134.246 112.194 131.906 1.00 0.00 H TER 68745 WAT 4766 ATOM 68745 O WAT 4767 140.277 95.648 75.527 1.00 0.00 O ATOM 68746 H1 WAT 4767 140.503 96.283 76.206 1.00 0.00 H ATOM 68747 H2 WAT 4767 140.268 94.805 75.982 1.00 0.00 H TER 68749 WAT 4767 ATOM 68749 O WAT 4768 74.558 52.109 143.589 1.00 0.00 O ATOM 68750 H1 WAT 4768 74.939 52.883 143.174 1.00 0.00 H ATOM 68751 H2 WAT 4768 73.902 51.801 142.964 1.00 0.00 H TER 68753 WAT 4768 ATOM 68753 O WAT 4769 9.147 54.866 18.697 1.00 0.00 O ATOM 68754 H1 WAT 4769 9.732 55.537 19.049 1.00 0.00 H ATOM 68755 H2 WAT 4769 8.514 55.353 18.170 1.00 0.00 H TER 68757 WAT 4769 ATOM 68757 O WAT 4770 25.128 91.484 9.756 1.00 0.00 O ATOM 68758 H1 WAT 4770 25.224 92.410 9.531 1.00 0.00 H ATOM 68759 H2 WAT 4770 25.633 91.380 10.563 1.00 0.00 H TER 68761 WAT 4770 ATOM 68761 O WAT 4771 145.441 72.953 63.344 1.00 0.00 O ATOM 68762 H1 WAT 4771 145.392 73.869 63.073 1.00 0.00 H ATOM 68763 H2 WAT 4771 145.704 72.482 62.552 1.00 0.00 H TER 68765 WAT 4771 ATOM 68765 O WAT 4772 21.911 16.700 154.739 1.00 0.00 O ATOM 68766 H1 WAT 4772 21.770 17.414 155.361 1.00 0.00 H ATOM 68767 H2 WAT 4772 22.544 16.128 155.171 1.00 0.00 H TER 68769 WAT 4772 ATOM 68769 O WAT 4773 106.001 10.994 126.939 1.00 0.00 O ATOM 68770 H1 WAT 4773 105.830 11.313 126.053 1.00 0.00 H ATOM 68771 H2 WAT 4773 106.952 11.053 127.035 1.00 0.00 H TER 68773 WAT 4773 ATOM 68773 O WAT 4774 143.090 47.159 135.991 1.00 0.00 O ATOM 68774 H1 WAT 4774 143.735 47.425 136.647 1.00 0.00 H ATOM 68775 H2 WAT 4774 143.079 47.880 135.361 1.00 0.00 H TER 68777 WAT 4774 ATOM 68777 O WAT 4775 61.558 85.501 2.542 1.00 0.00 O ATOM 68778 H1 WAT 4775 61.791 85.628 3.461 1.00 0.00 H ATOM 68779 H2 WAT 4775 60.734 85.015 2.568 1.00 0.00 H TER 68781 WAT 4775 ATOM 68781 O WAT 4776 84.054 107.015 76.798 1.00 0.00 O ATOM 68782 H1 WAT 4776 83.329 107.511 76.417 1.00 0.00 H ATOM 68783 H2 WAT 4776 84.706 106.968 76.099 1.00 0.00 H TER 68785 WAT 4776 ATOM 68785 O WAT 4777 55.758 76.762 88.324 1.00 0.00 O ATOM 68786 H1 WAT 4777 56.312 76.038 88.614 1.00 0.00 H ATOM 68787 H2 WAT 4777 55.373 77.107 89.130 1.00 0.00 H TER 68789 WAT 4777 ATOM 68789 O WAT 4778 102.070 7.716 132.060 1.00 0.00 O ATOM 68790 H1 WAT 4778 101.318 7.818 131.476 1.00 0.00 H ATOM 68791 H2 WAT 4778 102.831 7.765 131.482 1.00 0.00 H TER 68793 WAT 4778 ATOM 68793 O WAT 4779 25.287 2.944 150.121 1.00 0.00 O ATOM 68794 H1 WAT 4779 25.958 2.921 150.804 1.00 0.00 H ATOM 68795 H2 WAT 4779 25.613 3.583 149.487 1.00 0.00 H TER 68797 WAT 4779 ATOM 68797 O WAT 4780 98.343 68.431 13.120 1.00 0.00 O ATOM 68798 H1 WAT 4780 98.622 67.539 12.914 1.00 0.00 H ATOM 68799 H2 WAT 4780 99.153 68.942 13.117 1.00 0.00 H TER 68801 WAT 4780 ATOM 68801 O WAT 4781 77.359 112.949 51.936 1.00 0.00 O ATOM 68802 H1 WAT 4781 76.835 113.374 51.256 1.00 0.00 H ATOM 68803 H2 WAT 4781 77.536 112.075 51.590 1.00 0.00 H TER 68805 WAT 4781 ATOM 68805 O WAT 4782 131.646 60.467 13.626 1.00 0.00 O ATOM 68806 H1 WAT 4782 131.107 60.489 14.416 1.00 0.00 H ATOM 68807 H2 WAT 4782 131.115 60.905 12.961 1.00 0.00 H TER 68809 WAT 4782 ATOM 68809 O WAT 4783 144.293 145.646 6.611 1.00 0.00 O ATOM 68810 H1 WAT 4783 143.506 146.128 6.863 1.00 0.00 H ATOM 68811 H2 WAT 4783 144.497 145.104 7.373 1.00 0.00 H TER 68813 WAT 4783 ATOM 68813 O WAT 4784 132.707 9.131 61.252 1.00 0.00 O ATOM 68814 H1 WAT 4784 132.370 8.750 62.063 1.00 0.00 H ATOM 68815 H2 WAT 4784 133.649 8.964 61.282 1.00 0.00 H TER 68817 WAT 4784 ATOM 68817 O WAT 4785 49.808 138.927 115.852 1.00 0.00 O ATOM 68818 H1 WAT 4785 50.440 138.371 115.396 1.00 0.00 H ATOM 68819 H2 WAT 4785 49.960 139.803 115.497 1.00 0.00 H TER 68821 WAT 4785 ATOM 68821 O WAT 4786 128.669 127.761 104.330 1.00 0.00 O ATOM 68822 H1 WAT 4786 128.440 128.364 103.623 1.00 0.00 H ATOM 68823 H2 WAT 4786 129.413 127.264 103.990 1.00 0.00 H TER 68825 WAT 4786 ATOM 68825 O WAT 4787 145.569 72.955 120.937 1.00 0.00 O ATOM 68826 H1 WAT 4787 146.317 72.676 121.465 1.00 0.00 H ATOM 68827 H2 WAT 4787 145.801 72.706 120.042 1.00 0.00 H TER 68829 WAT 4787 ATOM 68829 O WAT 4788 126.676 105.028 8.965 1.00 0.00 O ATOM 68830 H1 WAT 4788 126.382 104.125 8.843 1.00 0.00 H ATOM 68831 H2 WAT 4788 125.875 105.516 9.155 1.00 0.00 H TER 68833 WAT 4788 ATOM 68833 O WAT 4789 30.641 105.647 154.178 1.00 0.00 O ATOM 68834 H1 WAT 4789 31.540 105.926 154.004 1.00 0.00 H ATOM 68835 H2 WAT 4789 30.578 104.779 153.780 1.00 0.00 H TER 68837 WAT 4789 ATOM 68837 O WAT 4790 2.879 28.290 14.359 1.00 0.00 O ATOM 68838 H1 WAT 4790 2.326 27.996 13.634 1.00 0.00 H ATOM 68839 H2 WAT 4790 3.350 29.047 14.009 1.00 0.00 H TER 68841 WAT 4790 ATOM 68841 O WAT 4791 88.146 133.082 116.627 1.00 0.00 O ATOM 68842 H1 WAT 4791 87.850 132.704 115.799 1.00 0.00 H ATOM 68843 H2 WAT 4791 88.456 133.957 116.393 1.00 0.00 H TER 68845 WAT 4791 ATOM 68845 O WAT 4792 6.033 145.089 136.032 1.00 0.00 O ATOM 68846 H1 WAT 4792 6.092 145.796 136.675 1.00 0.00 H ATOM 68847 H2 WAT 4792 6.338 145.482 135.215 1.00 0.00 H TER 68849 WAT 4792 ATOM 68849 O WAT 4793 101.492 30.631 6.321 1.00 0.00 O ATOM 68850 H1 WAT 4793 102.404 30.364 6.206 1.00 0.00 H ATOM 68851 H2 WAT 4793 101.103 29.936 6.851 1.00 0.00 H TER 68853 WAT 4793 ATOM 68853 O WAT 4794 127.227 11.273 114.707 1.00 0.00 O ATOM 68854 H1 WAT 4794 127.544 10.666 114.037 1.00 0.00 H ATOM 68855 H2 WAT 4794 126.399 10.894 115.002 1.00 0.00 H TER 68857 WAT 4794 ATOM 68857 O WAT 4795 74.043 1.808 62.840 1.00 0.00 O ATOM 68858 H1 WAT 4795 74.809 2.276 63.171 1.00 0.00 H ATOM 68859 H2 WAT 4795 74.334 1.433 62.008 1.00 0.00 H TER 68861 WAT 4795 ATOM 68861 O WAT 4796 58.478 36.750 2.334 1.00 0.00 O ATOM 68862 H1 WAT 4796 57.632 36.631 2.765 1.00 0.00 H ATOM 68863 H2 WAT 4796 58.419 37.614 1.925 1.00 0.00 H TER 68865 WAT 4796 ATOM 68865 O WAT 4797 17.927 57.058 54.175 1.00 0.00 O ATOM 68866 H1 WAT 4797 17.036 57.353 54.362 1.00 0.00 H ATOM 68867 H2 WAT 4797 18.096 57.355 53.281 1.00 0.00 H TER 68869 WAT 4797 ATOM 68869 O WAT 4798 38.367 97.652 140.105 1.00 0.00 O ATOM 68870 H1 WAT 4798 38.251 97.639 139.155 1.00 0.00 H ATOM 68871 H2 WAT 4798 39.315 97.681 140.229 1.00 0.00 H TER 68873 WAT 4798 ATOM 68873 O WAT 4799 67.155 9.599 70.201 1.00 0.00 O ATOM 68874 H1 WAT 4799 67.036 10.284 70.859 1.00 0.00 H ATOM 68875 H2 WAT 4799 68.086 9.634 69.984 1.00 0.00 H TER 68877 WAT 4799 ATOM 68877 O WAT 4800 120.226 145.190 64.971 1.00 0.00 O ATOM 68878 H1 WAT 4800 120.284 145.389 64.037 1.00 0.00 H ATOM 68879 H2 WAT 4800 120.863 144.488 65.107 1.00 0.00 H TER 68881 WAT 4800 ATOM 68881 O WAT 4801 92.460 46.520 88.311 1.00 0.00 O ATOM 68882 H1 WAT 4801 93.047 47.242 88.086 1.00 0.00 H ATOM 68883 H2 WAT 4801 93.044 45.783 88.490 1.00 0.00 H TER 68885 WAT 4801 ATOM 68885 O WAT 4802 135.239 100.515 117.696 1.00 0.00 O ATOM 68886 H1 WAT 4802 136.165 100.301 117.804 1.00 0.00 H ATOM 68887 H2 WAT 4802 134.775 99.788 118.112 1.00 0.00 H TER 68889 WAT 4802 ATOM 68889 O WAT 4803 116.838 138.140 158.448 1.00 0.00 O ATOM 68890 H1 WAT 4803 116.191 138.607 158.976 1.00 0.00 H ATOM 68891 H2 WAT 4803 117.093 138.767 157.772 1.00 0.00 H TER 68893 WAT 4803 ATOM 68893 O WAT 4804 104.385 119.338 83.828 1.00 0.00 O ATOM 68894 H1 WAT 4804 104.627 120.084 83.279 1.00 0.00 H ATOM 68895 H2 WAT 4804 103.433 119.280 83.746 1.00 0.00 H TER 68897 WAT 4804 ATOM 68897 O WAT 4805 125.348 48.392 156.217 1.00 0.00 O ATOM 68898 H1 WAT 4805 125.009 48.074 157.053 1.00 0.00 H ATOM 68899 H2 WAT 4805 125.654 47.604 155.767 1.00 0.00 H TER 68901 WAT 4805 ATOM 68901 O WAT 4806 43.000 83.691 115.940 1.00 0.00 O ATOM 68902 H1 WAT 4806 42.978 84.460 116.510 1.00 0.00 H ATOM 68903 H2 WAT 4806 43.086 84.050 115.057 1.00 0.00 H TER 68905 WAT 4806 ATOM 68905 O WAT 4807 2.390 59.405 68.403 1.00 0.00 O ATOM 68906 H1 WAT 4807 1.685 58.924 68.836 1.00 0.00 H ATOM 68907 H2 WAT 4807 1.955 59.885 67.698 1.00 0.00 H TER 68909 WAT 4807 ATOM 68909 O WAT 4808 104.868 61.260 66.313 1.00 0.00 O ATOM 68910 H1 WAT 4808 105.086 61.361 65.386 1.00 0.00 H ATOM 68911 H2 WAT 4808 104.871 62.153 66.658 1.00 0.00 H TER 68913 WAT 4808 ATOM 68913 O WAT 4809 59.434 62.543 80.283 1.00 0.00 O ATOM 68914 H1 WAT 4809 59.962 62.440 79.491 1.00 0.00 H ATOM 68915 H2 WAT 4809 60.047 62.879 80.937 1.00 0.00 H TER 68917 WAT 4809 ATOM 68917 O WAT 4810 86.810 134.793 11.706 1.00 0.00 O ATOM 68918 H1 WAT 4810 86.031 134.258 11.861 1.00 0.00 H ATOM 68919 H2 WAT 4810 87.469 134.171 11.397 1.00 0.00 H TER 68921 WAT 4810 ATOM 68921 O WAT 4811 118.857 1.842 61.105 1.00 0.00 O ATOM 68922 H1 WAT 4811 119.351 2.557 60.705 1.00 0.00 H ATOM 68923 H2 WAT 4811 118.357 1.462 60.382 1.00 0.00 H TER 68925 WAT 4811 ATOM 68925 O WAT 4812 130.733 119.973 115.091 1.00 0.00 O ATOM 68926 H1 WAT 4812 130.929 120.902 115.213 1.00 0.00 H ATOM 68927 H2 WAT 4812 131.318 119.696 114.386 1.00 0.00 H TER 68929 WAT 4812 ATOM 68929 O WAT 4813 27.106 66.232 102.542 1.00 0.00 O ATOM 68930 H1 WAT 4813 26.241 66.597 102.729 1.00 0.00 H ATOM 68931 H2 WAT 4813 27.272 65.628 103.266 1.00 0.00 H TER 68933 WAT 4813 ATOM 68933 O WAT 4814 45.615 36.245 23.702 1.00 0.00 O ATOM 68934 H1 WAT 4814 44.713 36.538 23.827 1.00 0.00 H ATOM 68935 H2 WAT 4814 46.094 37.039 23.464 1.00 0.00 H TER 68937 WAT 4814 ATOM 68937 O WAT 4815 137.801 118.371 63.217 1.00 0.00 O ATOM 68938 H1 WAT 4815 138.283 119.048 63.690 1.00 0.00 H ATOM 68939 H2 WAT 4815 138.218 118.336 62.356 1.00 0.00 H TER 68941 WAT 4815 ATOM 68941 O WAT 4816 47.228 53.766 13.852 1.00 0.00 O ATOM 68942 H1 WAT 4816 47.823 54.345 13.376 1.00 0.00 H ATOM 68943 H2 WAT 4816 47.173 54.146 14.728 1.00 0.00 H TER 68945 WAT 4816 ATOM 68945 O WAT 4817 50.477 135.532 150.940 1.00 0.00 O ATOM 68946 H1 WAT 4817 50.968 136.347 151.043 1.00 0.00 H ATOM 68947 H2 WAT 4817 50.573 135.310 150.014 1.00 0.00 H TER 68949 WAT 4817 ATOM 68949 O WAT 4818 58.585 69.155 8.199 1.00 0.00 O ATOM 68950 H1 WAT 4818 58.456 69.822 7.525 1.00 0.00 H ATOM 68951 H2 WAT 4818 59.214 69.546 8.805 1.00 0.00 H TER 68953 WAT 4818 ATOM 68953 O WAT 4819 6.332 50.725 90.423 1.00 0.00 O ATOM 68954 H1 WAT 4819 5.634 51.027 89.843 1.00 0.00 H ATOM 68955 H2 WAT 4819 5.966 49.954 90.858 1.00 0.00 H TER 68957 WAT 4819 ATOM 68957 O WAT 4820 18.538 138.633 107.713 1.00 0.00 O ATOM 68958 H1 WAT 4820 17.959 139.217 107.221 1.00 0.00 H ATOM 68959 H2 WAT 4820 18.830 137.988 107.069 1.00 0.00 H TER 68961 WAT 4820 ATOM 68961 O WAT 4821 126.962 144.433 157.198 1.00 0.00 O ATOM 68962 H1 WAT 4821 127.035 144.040 158.068 1.00 0.00 H ATOM 68963 H2 WAT 4821 126.027 144.395 156.996 1.00 0.00 H TER 68965 WAT 4821 ATOM 68965 O WAT 4822 69.034 131.593 136.338 1.00 0.00 O ATOM 68966 H1 WAT 4822 69.445 132.456 136.403 1.00 0.00 H ATOM 68967 H2 WAT 4822 69.611 131.015 136.837 1.00 0.00 H TER 68969 WAT 4822 ATOM 68969 O WAT 4823 4.485 49.236 116.689 1.00 0.00 O ATOM 68970 H1 WAT 4823 4.672 48.298 116.728 1.00 0.00 H ATOM 68971 H2 WAT 4823 4.700 49.486 115.790 1.00 0.00 H TER 68973 WAT 4823 ATOM 68973 O WAT 4824 17.116 1.900 119.008 1.00 0.00 O ATOM 68974 H1 WAT 4824 16.428 2.563 119.068 1.00 0.00 H ATOM 68975 H2 WAT 4824 16.688 1.147 118.601 1.00 0.00 H TER 68977 WAT 4824 ATOM 68977 O WAT 4825 50.638 66.348 123.521 1.00 0.00 O ATOM 68978 H1 WAT 4825 50.723 66.729 124.395 1.00 0.00 H ATOM 68979 H2 WAT 4825 50.874 67.059 122.926 1.00 0.00 H TER 68981 WAT 4825 ATOM 68981 O WAT 4826 135.601 5.031 87.935 1.00 0.00 O ATOM 68982 H1 WAT 4826 135.154 5.388 87.168 1.00 0.00 H ATOM 68983 H2 WAT 4826 136.529 5.201 87.772 1.00 0.00 H TER 68985 WAT 4826 ATOM 68985 O WAT 4827 35.250 78.214 21.578 1.00 0.00 O ATOM 68986 H1 WAT 4827 35.530 77.300 21.531 1.00 0.00 H ATOM 68987 H2 WAT 4827 34.499 78.204 22.173 1.00 0.00 H TER 68989 WAT 4827 ATOM 68989 O WAT 4828 51.061 58.731 130.022 1.00 0.00 O ATOM 68990 H1 WAT 4828 50.999 59.303 129.258 1.00 0.00 H ATOM 68991 H2 WAT 4828 51.115 59.330 130.767 1.00 0.00 H TER 68993 WAT 4828 ATOM 68993 O WAT 4829 41.113 15.912 102.802 1.00 0.00 O ATOM 68994 H1 WAT 4829 41.096 15.122 102.261 1.00 0.00 H ATOM 68995 H2 WAT 4829 40.259 16.320 102.657 1.00 0.00 H TER 68997 WAT 4829 ATOM 68997 O WAT 4830 74.185 88.592 148.743 1.00 0.00 O ATOM 68998 H1 WAT 4830 73.853 87.704 148.609 1.00 0.00 H ATOM 68999 H2 WAT 4830 75.093 88.469 149.020 1.00 0.00 H TER 69001 WAT 4830 ATOM 69001 O WAT 4831 56.533 135.366 85.356 1.00 0.00 O ATOM 69002 H1 WAT 4831 55.838 135.747 84.819 1.00 0.00 H ATOM 69003 H2 WAT 4831 56.071 134.837 86.006 1.00 0.00 H TER 69005 WAT 4831 ATOM 69005 O WAT 4832 5.622 97.282 16.922 1.00 0.00 O ATOM 69006 H1 WAT 4832 5.125 97.030 17.700 1.00 0.00 H ATOM 69007 H2 WAT 4832 4.991 97.221 16.204 1.00 0.00 H TER 69009 WAT 4832 ATOM 69009 O WAT 4833 108.780 79.945 142.619 1.00 0.00 O ATOM 69010 H1 WAT 4833 108.211 80.642 142.946 1.00 0.00 H ATOM 69011 H2 WAT 4833 108.280 79.141 142.760 1.00 0.00 H TER 69013 WAT 4833 ATOM 69013 O WAT 4834 33.364 66.449 155.049 1.00 0.00 O ATOM 69014 H1 WAT 4834 32.659 66.934 155.478 1.00 0.00 H ATOM 69015 H2 WAT 4834 34.072 67.086 154.958 1.00 0.00 H TER 69017 WAT 4834 ATOM 69017 O WAT 4835 3.734 52.645 82.784 1.00 0.00 O ATOM 69018 H1 WAT 4835 3.946 52.845 81.872 1.00 0.00 H ATOM 69019 H2 WAT 4835 4.571 52.706 83.243 1.00 0.00 H TER 69021 WAT 4835 ATOM 69021 O WAT 4836 43.776 112.972 56.196 1.00 0.00 O ATOM 69022 H1 WAT 4836 44.221 112.212 56.572 1.00 0.00 H ATOM 69023 H2 WAT 4836 44.369 113.704 56.365 1.00 0.00 H TER 69025 WAT 4836 ATOM 69025 O WAT 4837 143.874 55.878 21.610 1.00 0.00 O ATOM 69026 H1 WAT 4837 143.187 56.172 21.012 1.00 0.00 H ATOM 69027 H2 WAT 4837 143.573 55.023 21.918 1.00 0.00 H TER 69029 WAT 4837 ATOM 69029 O WAT 4838 32.105 68.757 151.988 1.00 0.00 O ATOM 69030 H1 WAT 4838 31.508 68.998 152.697 1.00 0.00 H ATOM 69031 H2 WAT 4838 31.883 69.355 151.275 1.00 0.00 H TER 69033 WAT 4838 ATOM 69033 O WAT 4839 75.119 136.017 63.926 1.00 0.00 O ATOM 69034 H1 WAT 4839 75.406 135.870 64.828 1.00 0.00 H ATOM 69035 H2 WAT 4839 75.653 135.417 63.404 1.00 0.00 H TER 69037 WAT 4839 ATOM 69037 O WAT 4840 67.310 111.233 120.596 1.00 0.00 O ATOM 69038 H1 WAT 4840 67.818 111.186 121.406 1.00 0.00 H ATOM 69039 H2 WAT 4840 67.068 110.326 120.412 1.00 0.00 H TER 69041 WAT 4840 ATOM 69041 O WAT 4841 59.156 144.346 19.424 1.00 0.00 O ATOM 69042 H1 WAT 4841 59.403 145.109 19.947 1.00 0.00 H ATOM 69043 H2 WAT 4841 59.283 143.601 20.012 1.00 0.00 H TER 69045 WAT 4841 ATOM 69045 O WAT 4842 76.495 28.908 21.690 1.00 0.00 O ATOM 69046 H1 WAT 4842 76.258 28.057 21.322 1.00 0.00 H ATOM 69047 H2 WAT 4842 75.739 29.158 22.221 1.00 0.00 H TER 69049 WAT 4842 ATOM 69049 O WAT 4843 34.374 83.491 8.904 1.00 0.00 O ATOM 69050 H1 WAT 4843 35.091 83.785 8.342 1.00 0.00 H ATOM 69051 H2 WAT 4843 33.808 82.983 8.323 1.00 0.00 H TER 69053 WAT 4843 ATOM 69053 O WAT 4844 105.852 136.535 96.948 1.00 0.00 O ATOM 69054 H1 WAT 4844 104.957 136.552 97.288 1.00 0.00 H ATOM 69055 H2 WAT 4844 105.775 136.114 96.092 1.00 0.00 H TER 69057 WAT 4844 ATOM 69057 O WAT 4845 45.338 33.263 12.036 1.00 0.00 O ATOM 69058 H1 WAT 4845 44.854 34.083 12.137 1.00 0.00 H ATOM 69059 H2 WAT 4845 45.709 33.311 11.155 1.00 0.00 H TER 69061 WAT 4845 ATOM 69061 O WAT 4846 68.539 72.277 79.571 1.00 0.00 O ATOM 69062 H1 WAT 4846 68.692 72.869 80.307 1.00 0.00 H ATOM 69063 H2 WAT 4846 69.229 72.493 78.943 1.00 0.00 H TER 69065 WAT 4846 ATOM 69065 O WAT 4847 105.500 54.721 158.153 1.00 0.00 O ATOM 69066 H1 WAT 4847 105.252 53.811 158.319 1.00 0.00 H ATOM 69067 H2 WAT 4847 106.003 54.976 158.927 1.00 0.00 H TER 69069 WAT 4847 ATOM 69069 O WAT 4848 97.879 4.732 78.641 1.00 0.00 O ATOM 69070 H1 WAT 4848 97.640 4.260 77.844 1.00 0.00 H ATOM 69071 H2 WAT 4848 98.804 4.526 78.773 1.00 0.00 H TER 69073 WAT 4848 ATOM 69073 O WAT 4849 86.981 135.884 113.819 1.00 0.00 O ATOM 69074 H1 WAT 4849 86.376 135.197 113.540 1.00 0.00 H ATOM 69075 H2 WAT 4849 87.130 136.407 113.031 1.00 0.00 H TER 69077 WAT 4849 ATOM 69077 O WAT 4850 83.408 113.878 136.897 1.00 0.00 O ATOM 69078 H1 WAT 4850 84.196 114.021 137.422 1.00 0.00 H ATOM 69079 H2 WAT 4850 83.694 113.305 136.186 1.00 0.00 H TER 69081 WAT 4850 ATOM 69081 O WAT 4851 86.429 21.711 83.616 1.00 0.00 O ATOM 69082 H1 WAT 4851 87.040 21.316 84.238 1.00 0.00 H ATOM 69083 H2 WAT 4851 85.584 21.691 84.066 1.00 0.00 H TER 69085 WAT 4851 ATOM 69085 O WAT 4852 124.471 118.091 128.909 1.00 0.00 O ATOM 69086 H1 WAT 4852 125.236 118.028 128.338 1.00 0.00 H ATOM 69087 H2 WAT 4852 123.747 117.758 128.379 1.00 0.00 H TER 69089 WAT 4852 ATOM 69089 O WAT 4853 112.380 56.467 2.016 1.00 0.00 O ATOM 69090 H1 WAT 4853 111.914 56.295 2.834 1.00 0.00 H ATOM 69091 H2 WAT 4853 112.451 55.611 1.595 1.00 0.00 H TER 69093 WAT 4853 ATOM 69093 O WAT 4854 40.094 15.739 147.744 1.00 0.00 O ATOM 69094 H1 WAT 4854 40.875 15.191 147.665 1.00 0.00 H ATOM 69095 H2 WAT 4854 39.853 15.680 148.669 1.00 0.00 H TER 69097 WAT 4854 ATOM 69097 O WAT 4855 137.537 81.998 66.513 1.00 0.00 O ATOM 69098 H1 WAT 4855 136.619 81.851 66.284 1.00 0.00 H ATOM 69099 H2 WAT 4855 137.635 82.950 66.512 1.00 0.00 H TER 69101 WAT 4855 ATOM 69101 O WAT 4856 34.036 48.885 2.453 1.00 0.00 O ATOM 69102 H1 WAT 4856 34.342 49.785 2.340 1.00 0.00 H ATOM 69103 H2 WAT 4856 34.638 48.506 3.094 1.00 0.00 H TER 69105 WAT 4856 ATOM 69105 O WAT 4857 28.035 126.293 70.161 1.00 0.00 O ATOM 69106 H1 WAT 4857 28.575 126.503 70.923 1.00 0.00 H ATOM 69107 H2 WAT 4857 27.153 126.570 70.409 1.00 0.00 H TER 69109 WAT 4857 ATOM 69109 O WAT 4858 5.096 141.378 87.441 1.00 0.00 O ATOM 69110 H1 WAT 4858 4.428 141.305 86.759 1.00 0.00 H ATOM 69111 H2 WAT 4858 5.921 141.457 86.962 1.00 0.00 H TER 69113 WAT 4858 ATOM 69113 O WAT 4859 102.189 126.254 112.676 1.00 0.00 O ATOM 69114 H1 WAT 4859 102.654 125.542 113.116 1.00 0.00 H ATOM 69115 H2 WAT 4859 102.821 126.973 112.650 1.00 0.00 H TER 69117 WAT 4859 ATOM 69117 O WAT 4860 76.444 72.121 57.220 1.00 0.00 O ATOM 69118 H1 WAT 4860 76.613 73.006 56.897 1.00 0.00 H ATOM 69119 H2 WAT 4860 75.518 71.969 57.032 1.00 0.00 H TER 69121 WAT 4860 ATOM 69121 O WAT 4861 62.779 136.226 0.901 1.00 0.00 O ATOM 69122 H1 WAT 4861 63.073 136.991 1.395 1.00 0.00 H ATOM 69123 H2 WAT 4861 63.448 135.562 1.068 1.00 0.00 H TER 69125 WAT 4861 ATOM 69125 O WAT 4862 129.854 16.131 15.798 1.00 0.00 O ATOM 69126 H1 WAT 4862 128.923 16.242 15.604 1.00 0.00 H ATOM 69127 H2 WAT 4862 129.923 16.286 16.740 1.00 0.00 H TER 69129 WAT 4862 ATOM 69129 O WAT 4863 145.683 99.286 67.964 1.00 0.00 O ATOM 69130 H1 WAT 4863 145.638 98.343 67.806 1.00 0.00 H ATOM 69131 H2 WAT 4863 144.793 99.599 67.803 1.00 0.00 H TER 69133 WAT 4863 ATOM 69133 O WAT 4864 41.417 91.635 18.418 1.00 0.00 O ATOM 69134 H1 WAT 4864 41.237 91.993 19.287 1.00 0.00 H ATOM 69135 H2 WAT 4864 41.847 92.350 17.949 1.00 0.00 H TER 69137 WAT 4864 ATOM 69137 O WAT 4865 144.551 41.992 55.298 1.00 0.00 O ATOM 69138 H1 WAT 4865 144.934 42.516 56.002 1.00 0.00 H ATOM 69139 H2 WAT 4865 143.650 41.836 55.579 1.00 0.00 H TER 69141 WAT 4865 ATOM 69141 O WAT 4866 113.096 80.562 139.002 1.00 0.00 O ATOM 69142 H1 WAT 4866 113.396 81.427 138.720 1.00 0.00 H ATOM 69143 H2 WAT 4866 112.593 80.229 138.259 1.00 0.00 H TER 69145 WAT 4866 ATOM 69145 O WAT 4867 83.895 16.024 138.657 1.00 0.00 O ATOM 69146 H1 WAT 4867 84.593 15.483 138.287 1.00 0.00 H ATOM 69147 H2 WAT 4867 83.097 15.514 138.516 1.00 0.00 H TER 69149 WAT 4867 ATOM 69149 O WAT 4868 11.024 143.568 14.550 1.00 0.00 O ATOM 69150 H1 WAT 4868 10.243 143.031 14.678 1.00 0.00 H ATOM 69151 H2 WAT 4868 11.697 142.949 14.266 1.00 0.00 H TER 69153 WAT 4868 ATOM 69153 O WAT 4869 97.714 140.763 71.126 1.00 0.00 O ATOM 69154 H1 WAT 4869 98.299 141.305 70.597 1.00 0.00 H ATOM 69155 H2 WAT 4869 98.107 140.768 71.999 1.00 0.00 H TER 69157 WAT 4869 ATOM 69157 O WAT 4870 30.579 89.615 89.624 1.00 0.00 O ATOM 69158 H1 WAT 4870 29.890 90.233 89.869 1.00 0.00 H ATOM 69159 H2 WAT 4870 30.544 89.583 88.668 1.00 0.00 H TER 69161 WAT 4870 ATOM 69161 O WAT 4871 26.097 73.011 0.896 1.00 0.00 O ATOM 69162 H1 WAT 4871 25.289 73.523 0.925 1.00 0.00 H ATOM 69163 H2 WAT 4871 26.192 72.765 -0.025 1.00 0.00 H TER 69165 WAT 4871 ATOM 69165 O WAT 4872 84.588 64.851 135.975 1.00 0.00 O ATOM 69166 H1 WAT 4872 84.330 64.080 136.479 1.00 0.00 H ATOM 69167 H2 WAT 4872 85.022 65.420 136.612 1.00 0.00 H TER 69169 WAT 4872 ATOM 69169 O WAT 4873 139.041 41.046 116.882 1.00 0.00 O ATOM 69170 H1 WAT 4873 139.119 40.328 116.255 1.00 0.00 H ATOM 69171 H2 WAT 4873 138.549 40.673 117.614 1.00 0.00 H TER 69173 WAT 4873 ATOM 69173 O WAT 4874 57.583 141.991 8.478 1.00 0.00 O ATOM 69174 H1 WAT 4874 58.068 142.318 9.236 1.00 0.00 H ATOM 69175 H2 WAT 4874 56.688 142.300 8.615 1.00 0.00 H TER 69177 WAT 4874 ATOM 69177 O WAT 4875 68.087 71.284 9.239 1.00 0.00 O ATOM 69178 H1 WAT 4875 68.909 70.798 9.168 1.00 0.00 H ATOM 69179 H2 WAT 4875 67.415 70.655 8.975 1.00 0.00 H TER 69181 WAT 4875 ATOM 69181 O WAT 4876 103.862 113.473 108.716 1.00 0.00 O ATOM 69182 H1 WAT 4876 103.936 113.122 109.604 1.00 0.00 H ATOM 69183 H2 WAT 4876 103.237 112.893 108.280 1.00 0.00 H TER 69185 WAT 4876 ATOM 69185 O WAT 4877 40.865 114.644 75.193 1.00 0.00 O ATOM 69186 H1 WAT 4877 41.638 114.086 75.269 1.00 0.00 H ATOM 69187 H2 WAT 4877 41.052 115.393 75.759 1.00 0.00 H TER 69189 WAT 4877 ATOM 69189 O WAT 4878 116.846 44.578 53.375 1.00 0.00 O ATOM 69190 H1 WAT 4878 116.080 44.114 53.712 1.00 0.00 H ATOM 69191 H2 WAT 4878 117.219 43.983 52.724 1.00 0.00 H TER 69193 WAT 4878 ATOM 69193 O WAT 4879 95.245 71.111 103.167 1.00 0.00 O ATOM 69194 H1 WAT 4879 94.347 71.432 103.245 1.00 0.00 H ATOM 69195 H2 WAT 4879 95.782 71.808 103.543 1.00 0.00 H TER 69197 WAT 4879 ATOM 69197 O WAT 4880 21.777 4.510 135.260 1.00 0.00 O ATOM 69198 H1 WAT 4880 21.418 5.304 134.863 1.00 0.00 H ATOM 69199 H2 WAT 4880 22.593 4.353 134.786 1.00 0.00 H TER 69201 WAT 4880 ATOM 69201 O WAT 4881 75.189 58.211 65.978 1.00 0.00 O ATOM 69202 H1 WAT 4881 75.793 57.914 66.659 1.00 0.00 H ATOM 69203 H2 WAT 4881 75.389 57.658 65.223 1.00 0.00 H TER 69205 WAT 4881 ATOM 69205 O WAT 4882 51.259 68.412 148.213 1.00 0.00 O ATOM 69206 H1 WAT 4882 51.565 69.214 148.636 1.00 0.00 H ATOM 69207 H2 WAT 4882 52.039 67.860 148.152 1.00 0.00 H TER 69209 WAT 4882 ATOM 69209 O WAT 4883 60.627 117.763 53.253 1.00 0.00 O ATOM 69210 H1 WAT 4883 60.114 118.322 52.670 1.00 0.00 H ATOM 69211 H2 WAT 4883 60.940 118.354 53.938 1.00 0.00 H TER 69213 WAT 4883 ATOM 69213 O WAT 4884 26.679 71.401 85.630 1.00 0.00 O ATOM 69214 H1 WAT 4884 27.124 71.540 84.794 1.00 0.00 H ATOM 69215 H2 WAT 4884 25.875 70.935 85.399 1.00 0.00 H TER 69217 WAT 4884 ATOM 69217 O WAT 4885 105.767 60.211 114.715 1.00 0.00 O ATOM 69218 H1 WAT 4885 106.412 59.735 115.237 1.00 0.00 H ATOM 69219 H2 WAT 4885 105.093 60.469 115.343 1.00 0.00 H TER 69221 WAT 4885 ATOM 69221 O WAT 4886 129.338 102.666 60.366 1.00 0.00 O ATOM 69222 H1 WAT 4886 130.208 103.052 60.260 1.00 0.00 H ATOM 69223 H2 WAT 4886 129.508 101.766 60.644 1.00 0.00 H TER 69225 WAT 4886 ATOM 69225 O WAT 4887 128.304 145.533 125.425 1.00 0.00 O ATOM 69226 H1 WAT 4887 128.510 146.458 125.286 1.00 0.00 H ATOM 69227 H2 WAT 4887 128.044 145.213 124.561 1.00 0.00 H TER 69229 WAT 4887 ATOM 69229 O WAT 4888 77.738 71.455 137.739 1.00 0.00 O ATOM 69230 H1 WAT 4888 77.656 72.296 137.290 1.00 0.00 H ATOM 69231 H2 WAT 4888 76.843 71.119 137.785 1.00 0.00 H TER 69233 WAT 4888 ATOM 69233 O WAT 4889 1.611 103.754 132.145 1.00 0.00 O ATOM 69234 H1 WAT 4889 1.748 104.701 132.137 1.00 0.00 H ATOM 69235 H2 WAT 4889 1.285 103.551 131.268 1.00 0.00 H TER 69237 WAT 4889 ATOM 69237 O WAT 4890 134.068 67.622 70.538 1.00 0.00 O ATOM 69238 H1 WAT 4890 134.490 67.818 69.702 1.00 0.00 H ATOM 69239 H2 WAT 4890 134.793 67.449 71.138 1.00 0.00 H TER 69241 WAT 4890 ATOM 69241 O WAT 4891 51.347 139.085 120.555 1.00 0.00 O ATOM 69242 H1 WAT 4891 50.593 138.554 120.813 1.00 0.00 H ATOM 69243 H2 WAT 4891 51.259 139.890 121.066 1.00 0.00 H TER 69245 WAT 4891 ATOM 69245 O WAT 4892 69.040 113.912 113.282 1.00 0.00 O ATOM 69246 H1 WAT 4892 69.886 113.570 113.573 1.00 0.00 H ATOM 69247 H2 WAT 4892 68.556 114.073 114.092 1.00 0.00 H TER 69249 WAT 4892 ATOM 69249 O WAT 4893 71.026 45.924 83.713 1.00 0.00 O ATOM 69250 H1 WAT 4893 70.147 45.622 83.487 1.00 0.00 H ATOM 69251 H2 WAT 4893 70.962 46.879 83.700 1.00 0.00 H TER 69253 WAT 4893 ATOM 69253 O WAT 4894 121.196 102.180 144.288 1.00 0.00 O ATOM 69254 H1 WAT 4894 121.212 102.351 145.230 1.00 0.00 H ATOM 69255 H2 WAT 4894 120.498 102.744 143.954 1.00 0.00 H TER 69257 WAT 4894 ATOM 69257 O WAT 4895 98.912 16.028 153.462 1.00 0.00 O ATOM 69258 H1 WAT 4895 98.883 16.559 154.258 1.00 0.00 H ATOM 69259 H2 WAT 4895 98.372 15.264 153.664 1.00 0.00 H TER 69261 WAT 4895 ATOM 69261 O WAT 4896 70.734 69.064 5.556 1.00 0.00 O ATOM 69262 H1 WAT 4896 70.440 69.854 5.103 1.00 0.00 H ATOM 69263 H2 WAT 4896 71.629 69.265 5.831 1.00 0.00 H TER 69265 WAT 4896 ATOM 69265 O WAT 4897 70.848 34.925 82.917 1.00 0.00 O ATOM 69266 H1 WAT 4897 69.987 35.341 82.958 1.00 0.00 H ATOM 69267 H2 WAT 4897 71.270 35.167 83.741 1.00 0.00 H TER 69269 WAT 4897 ATOM 69269 O WAT 4898 138.563 33.336 106.050 1.00 0.00 O ATOM 69270 H1 WAT 4898 139.341 33.231 106.598 1.00 0.00 H ATOM 69271 H2 WAT 4898 138.463 32.491 105.611 1.00 0.00 H TER 69273 WAT 4898 ATOM 69273 O WAT 4899 1.151 76.737 102.849 1.00 0.00 O ATOM 69274 H1 WAT 4899 0.198 76.808 102.895 1.00 0.00 H ATOM 69275 H2 WAT 4899 1.457 77.067 103.694 1.00 0.00 H TER 69277 WAT 4899 ATOM 69277 O WAT 4900 127.351 70.790 147.817 1.00 0.00 O ATOM 69278 H1 WAT 4900 127.366 70.401 146.943 1.00 0.00 H ATOM 69279 H2 WAT 4900 128.154 71.308 147.863 1.00 0.00 H TER 69281 WAT 4900 ATOM 69281 O WAT 4901 88.314 48.748 92.801 1.00 0.00 O ATOM 69282 H1 WAT 4901 88.282 48.529 91.869 1.00 0.00 H ATOM 69283 H2 WAT 4901 89.105 49.279 92.895 1.00 0.00 H TER 69285 WAT 4901 ATOM 69285 O WAT 4902 74.715 60.806 75.302 1.00 0.00 O ATOM 69286 H1 WAT 4902 73.848 61.018 75.648 1.00 0.00 H ATOM 69287 H2 WAT 4902 75.080 61.651 75.039 1.00 0.00 H TER 69289 WAT 4902 ATOM 69289 O WAT 4903 98.974 21.306 138.518 1.00 0.00 O ATOM 69290 H1 WAT 4903 98.339 20.923 137.913 1.00 0.00 H ATOM 69291 H2 WAT 4903 98.784 22.244 138.504 1.00 0.00 H TER 69293 WAT 4903 ATOM 69293 O WAT 4904 7.653 124.162 138.908 1.00 0.00 O ATOM 69294 H1 WAT 4904 8.188 124.449 138.168 1.00 0.00 H ATOM 69295 H2 WAT 4904 8.272 124.072 139.632 1.00 0.00 H TER 69297 WAT 4904 ATOM 69297 O WAT 4905 109.192 19.162 13.752 1.00 0.00 O ATOM 69298 H1 WAT 4905 109.069 19.631 12.926 1.00 0.00 H ATOM 69299 H2 WAT 4905 108.494 18.507 13.761 1.00 0.00 H TER 69301 WAT 4905 ATOM 69301 O WAT 4906 106.259 112.897 99.783 1.00 0.00 O ATOM 69302 H1 WAT 4906 106.274 113.409 100.591 1.00 0.00 H ATOM 69303 H2 WAT 4906 105.630 113.352 99.222 1.00 0.00 H TER 69305 WAT 4906 ATOM 69305 O WAT 4907 106.226 25.448 100.278 1.00 0.00 O ATOM 69306 H1 WAT 4907 106.313 25.012 99.431 1.00 0.00 H ATOM 69307 H2 WAT 4907 105.801 26.281 100.077 1.00 0.00 H TER 69309 WAT 4907 ATOM 69309 O WAT 4908 94.844 112.447 13.586 1.00 0.00 O ATOM 69310 H1 WAT 4908 94.398 112.722 14.387 1.00 0.00 H ATOM 69311 H2 WAT 4908 94.939 111.499 13.678 1.00 0.00 H TER 69313 WAT 4908 ATOM 69313 O WAT 4909 143.298 112.614 74.165 1.00 0.00 O ATOM 69314 H1 WAT 4909 143.718 112.749 73.316 1.00 0.00 H ATOM 69315 H2 WAT 4909 142.791 111.810 74.056 1.00 0.00 H TER 69317 WAT 4909 ATOM 69317 O WAT 4910 69.081 54.450 118.303 1.00 0.00 O ATOM 69318 H1 WAT 4910 69.643 54.639 119.055 1.00 0.00 H ATOM 69319 H2 WAT 4910 68.978 55.294 117.863 1.00 0.00 H TER 69321 WAT 4910 ATOM 69321 O WAT 4911 129.038 137.682 154.352 1.00 0.00 O ATOM 69322 H1 WAT 4911 129.297 137.799 155.266 1.00 0.00 H ATOM 69323 H2 WAT 4911 129.832 137.371 153.916 1.00 0.00 H TER 69325 WAT 4911 ATOM 69325 O WAT 4912 110.429 55.343 143.628 1.00 0.00 O ATOM 69326 H1 WAT 4912 110.718 54.961 144.456 1.00 0.00 H ATOM 69327 H2 WAT 4912 109.836 56.050 143.885 1.00 0.00 H TER 69329 WAT 4912 ATOM 69329 O WAT 4913 12.154 72.303 131.540 1.00 0.00 O ATOM 69330 H1 WAT 4913 11.260 72.034 131.331 1.00 0.00 H ATOM 69331 H2 WAT 4913 12.097 72.653 132.429 1.00 0.00 H TER 69333 WAT 4913 ATOM 69333 O WAT 4914 29.011 123.480 119.809 1.00 0.00 O ATOM 69334 H1 WAT 4914 28.319 122.937 119.433 1.00 0.00 H ATOM 69335 H2 WAT 4914 29.477 123.833 119.051 1.00 0.00 H TER 69337 WAT 4914 ATOM 69337 O WAT 4915 67.920 39.997 58.051 1.00 0.00 O ATOM 69338 H1 WAT 4915 67.297 40.716 57.945 1.00 0.00 H ATOM 69339 H2 WAT 4915 68.734 40.422 58.321 1.00 0.00 H TER 69341 WAT 4915 ATOM 69341 O WAT 4916 68.856 47.711 88.376 1.00 0.00 O ATOM 69342 H1 WAT 4916 69.119 46.800 88.249 1.00 0.00 H ATOM 69343 H2 WAT 4916 69.258 47.963 89.208 1.00 0.00 H TER 69345 WAT 4916 ATOM 69345 O WAT 4917 18.954 41.815 56.412 1.00 0.00 O ATOM 69346 H1 WAT 4917 18.276 41.186 56.164 1.00 0.00 H ATOM 69347 H2 WAT 4917 19.744 41.285 56.520 1.00 0.00 H TER 69349 WAT 4917 ATOM 69349 O WAT 4918 2.204 126.515 13.555 1.00 0.00 O ATOM 69350 H1 WAT 4918 3.031 126.168 13.890 1.00 0.00 H ATOM 69351 H2 WAT 4918 1.539 126.166 14.149 1.00 0.00 H TER 69353 WAT 4918 ATOM 69353 O WAT 4919 103.465 124.205 61.619 1.00 0.00 O ATOM 69354 H1 WAT 4919 103.982 124.798 62.164 1.00 0.00 H ATOM 69355 H2 WAT 4919 102.754 124.749 61.280 1.00 0.00 H TER 69357 WAT 4919 ATOM 69357 O WAT 4920 135.569 30.526 127.104 1.00 0.00 O ATOM 69358 H1 WAT 4920 135.877 30.734 126.222 1.00 0.00 H ATOM 69359 H2 WAT 4920 135.259 29.623 127.043 1.00 0.00 H TER 69361 WAT 4920 ATOM 69361 O WAT 4921 73.255 18.576 88.859 1.00 0.00 O ATOM 69362 H1 WAT 4921 73.268 19.140 88.086 1.00 0.00 H ATOM 69363 H2 WAT 4921 73.226 17.686 88.507 1.00 0.00 H TER 69365 WAT 4921 ATOM 69365 O WAT 4922 60.678 19.311 17.287 1.00 0.00 O ATOM 69366 H1 WAT 4922 60.010 19.049 17.920 1.00 0.00 H ATOM 69367 H2 WAT 4922 61.466 19.450 17.813 1.00 0.00 H TER 69369 WAT 4922 ATOM 69369 O WAT 4923 87.474 78.610 80.535 1.00 0.00 O ATOM 69370 H1 WAT 4923 87.920 78.955 81.309 1.00 0.00 H ATOM 69371 H2 WAT 4923 87.770 77.703 80.471 1.00 0.00 H TER 69373 WAT 4923 ATOM 69373 O WAT 4924 14.674 37.884 88.863 1.00 0.00 O ATOM 69374 H1 WAT 4924 15.612 38.038 88.754 1.00 0.00 H ATOM 69375 H2 WAT 4924 14.420 37.390 88.084 1.00 0.00 H TER 69377 WAT 4924 ATOM 69377 O WAT 4925 116.187 81.861 111.740 1.00 0.00 O ATOM 69378 H1 WAT 4925 115.563 82.236 111.117 1.00 0.00 H ATOM 69379 H2 WAT 4925 116.936 81.603 111.202 1.00 0.00 H TER 69381 WAT 4925 ATOM 69381 O WAT 4926 29.708 9.914 114.708 1.00 0.00 O ATOM 69382 H1 WAT 4926 30.285 10.182 113.993 1.00 0.00 H ATOM 69383 H2 WAT 4926 29.113 10.655 114.826 1.00 0.00 H TER 69385 WAT 4926 ATOM 69385 O WAT 4927 46.761 17.582 19.204 1.00 0.00 O ATOM 69386 H1 WAT 4927 47.019 18.359 19.701 1.00 0.00 H ATOM 69387 H2 WAT 4927 47.513 17.399 18.640 1.00 0.00 H TER 69389 WAT 4927 ATOM 69389 O WAT 4928 109.422 54.955 130.930 1.00 0.00 O ATOM 69390 H1 WAT 4928 110.054 55.664 130.810 1.00 0.00 H ATOM 69391 H2 WAT 4928 109.545 54.392 130.165 1.00 0.00 H TER 69393 WAT 4928 ATOM 69393 O WAT 4929 10.424 49.165 3.869 1.00 0.00 O ATOM 69394 H1 WAT 4929 10.274 48.673 4.676 1.00 0.00 H ATOM 69395 H2 WAT 4929 10.891 49.951 4.150 1.00 0.00 H TER 69397 WAT 4929 ATOM 69397 O WAT 4930 128.110 82.189 143.999 1.00 0.00 O ATOM 69398 H1 WAT 4930 127.995 82.680 143.185 1.00 0.00 H ATOM 69399 H2 WAT 4930 127.695 81.344 143.829 1.00 0.00 H TER 69401 WAT 4930 ATOM 69401 O WAT 4931 84.200 103.481 140.845 1.00 0.00 O ATOM 69402 H1 WAT 4931 84.618 102.846 140.264 1.00 0.00 H ATOM 69403 H2 WAT 4931 83.828 104.137 140.256 1.00 0.00 H TER 69405 WAT 4931 ATOM 69405 O WAT 4932 84.009 132.983 65.330 1.00 0.00 O ATOM 69406 H1 WAT 4932 84.200 132.076 65.567 1.00 0.00 H ATOM 69407 H2 WAT 4932 83.631 132.927 64.452 1.00 0.00 H TER 69409 WAT 4932 ATOM 69409 O WAT 4933 112.994 63.222 106.268 1.00 0.00 O ATOM 69410 H1 WAT 4933 112.922 62.272 106.184 1.00 0.00 H ATOM 69411 H2 WAT 4933 113.536 63.488 105.525 1.00 0.00 H TER 69413 WAT 4933 ATOM 69413 O WAT 4934 70.995 0.139 72.749 1.00 0.00 O ATOM 69414 H1 WAT 4934 70.284 0.719 72.478 1.00 0.00 H ATOM 69415 H2 WAT 4934 70.663 -0.743 72.578 1.00 0.00 H TER 69417 WAT 4934 ATOM 69417 O WAT 4935 90.512 47.173 137.164 1.00 0.00 O ATOM 69418 H1 WAT 4935 90.636 48.101 137.363 1.00 0.00 H ATOM 69419 H2 WAT 4935 90.389 47.145 136.215 1.00 0.00 H TER 69421 WAT 4935 ATOM 69421 O WAT 4936 27.802 22.430 9.173 1.00 0.00 O ATOM 69422 H1 WAT 4936 27.581 23.051 8.478 1.00 0.00 H ATOM 69423 H2 WAT 4936 27.968 22.978 9.940 1.00 0.00 H TER 69425 WAT 4936 ATOM 69425 O WAT 4937 92.871 62.942 0.446 1.00 0.00 O ATOM 69426 H1 WAT 4937 92.013 63.089 0.046 1.00 0.00 H ATOM 69427 H2 WAT 4937 93.144 62.085 0.119 1.00 0.00 H TER 69429 WAT 4937 ATOM 69429 O WAT 4938 145.499 70.736 7.116 1.00 0.00 O ATOM 69430 H1 WAT 4938 145.898 70.382 7.912 1.00 0.00 H ATOM 69431 H2 WAT 4938 144.810 71.319 7.433 1.00 0.00 H TER 69433 WAT 4938 ATOM 69433 O WAT 4939 25.018 41.162 88.209 1.00 0.00 O ATOM 69434 H1 WAT 4939 25.061 40.343 88.704 1.00 0.00 H ATOM 69435 H2 WAT 4939 24.880 41.837 88.874 1.00 0.00 H TER 69437 WAT 4939 ATOM 69437 O WAT 4940 11.053 10.136 88.917 1.00 0.00 O ATOM 69438 H1 WAT 4940 11.778 10.348 88.328 1.00 0.00 H ATOM 69439 H2 WAT 4940 10.463 9.601 88.387 1.00 0.00 H TER 69441 WAT 4940 ATOM 69441 O WAT 4941 112.420 139.571 150.189 1.00 0.00 O ATOM 69442 H1 WAT 4941 112.071 139.051 150.913 1.00 0.00 H ATOM 69443 H2 WAT 4941 111.909 140.381 150.208 1.00 0.00 H TER 69445 WAT 4941 ATOM 69445 O WAT 4942 20.858 73.572 2.185 1.00 0.00 O ATOM 69446 H1 WAT 4942 20.708 73.077 2.991 1.00 0.00 H ATOM 69447 H2 WAT 4942 19.990 73.884 1.931 1.00 0.00 H TER 69449 WAT 4942 ATOM 69449 O WAT 4943 26.071 94.088 110.283 1.00 0.00 O ATOM 69450 H1 WAT 4943 26.010 94.807 109.653 1.00 0.00 H ATOM 69451 H2 WAT 4943 25.652 94.428 111.074 1.00 0.00 H TER 69453 WAT 4943 ATOM 69453 O WAT 4944 53.583 69.444 113.540 1.00 0.00 O ATOM 69454 H1 WAT 4944 53.129 70.278 113.661 1.00 0.00 H ATOM 69455 H2 WAT 4944 53.475 69.245 112.610 1.00 0.00 H TER 69457 WAT 4944 ATOM 69457 O WAT 4945 126.208 53.137 119.158 1.00 0.00 O ATOM 69458 H1 WAT 4945 125.977 53.014 120.079 1.00 0.00 H ATOM 69459 H2 WAT 4945 125.437 52.838 118.676 1.00 0.00 H TER 69461 WAT 4945 ATOM 69461 O WAT 4946 80.446 112.428 95.967 1.00 0.00 O ATOM 69462 H1 WAT 4946 81.352 112.700 96.116 1.00 0.00 H ATOM 69463 H2 WAT 4946 80.413 112.205 95.037 1.00 0.00 H TER 69465 WAT 4946 ATOM 69465 O WAT 4947 65.228 111.350 10.830 1.00 0.00 O ATOM 69466 H1 WAT 4947 65.984 111.185 10.267 1.00 0.00 H ATOM 69467 H2 WAT 4947 64.471 111.227 10.256 1.00 0.00 H TER 69469 WAT 4947 ATOM 69469 O WAT 4948 14.145 34.513 102.197 1.00 0.00 O ATOM 69470 H1 WAT 4948 14.869 33.939 101.947 1.00 0.00 H ATOM 69471 H2 WAT 4948 14.273 34.665 103.133 1.00 0.00 H TER 69473 WAT 4948 ATOM 69473 O WAT 4949 142.965 57.156 16.582 1.00 0.00 O ATOM 69474 H1 WAT 4949 143.676 57.308 15.959 1.00 0.00 H ATOM 69475 H2 WAT 4949 143.298 56.471 17.162 1.00 0.00 H TER 69477 WAT 4949 ATOM 69477 O WAT 4950 92.238 139.983 90.648 1.00 0.00 O ATOM 69478 H1 WAT 4950 92.111 140.435 89.814 1.00 0.00 H ATOM 69479 H2 WAT 4950 92.444 139.081 90.403 1.00 0.00 H TER 69481 WAT 4950 ATOM 69481 O WAT 4951 89.025 41.729 144.920 1.00 0.00 O ATOM 69482 H1 WAT 4951 88.541 41.686 145.745 1.00 0.00 H ATOM 69483 H2 WAT 4951 88.347 41.731 144.245 1.00 0.00 H TER 69485 WAT 4951 ATOM 69485 O WAT 4952 11.601 71.041 11.602 1.00 0.00 O ATOM 69486 H1 WAT 4952 11.393 71.957 11.419 1.00 0.00 H ATOM 69487 H2 WAT 4952 11.720 70.645 10.739 1.00 0.00 H TER 69489 WAT 4952 ATOM 69489 O WAT 4953 23.093 116.042 54.343 1.00 0.00 O ATOM 69490 H1 WAT 4953 22.524 115.443 54.826 1.00 0.00 H ATOM 69491 H2 WAT 4953 23.514 116.572 55.020 1.00 0.00 H TER 69493 WAT 4953 ATOM 69493 O WAT 4954 62.316 37.848 25.011 1.00 0.00 O ATOM 69494 H1 WAT 4954 62.686 37.415 25.781 1.00 0.00 H ATOM 69495 H2 WAT 4954 63.022 37.833 24.365 1.00 0.00 H TER 69497 WAT 4954 ATOM 69497 O WAT 4955 54.459 126.360 153.581 1.00 0.00 O ATOM 69498 H1 WAT 4955 54.012 126.653 154.375 1.00 0.00 H ATOM 69499 H2 WAT 4955 54.227 127.012 152.920 1.00 0.00 H TER 69501 WAT 4955 ATOM 69501 O WAT 4956 45.298 21.203 154.784 1.00 0.00 O ATOM 69502 H1 WAT 4956 44.667 21.153 155.502 1.00 0.00 H ATOM 69503 H2 WAT 4956 44.841 20.818 154.036 1.00 0.00 H TER 69505 WAT 4956 ATOM 69505 O WAT 4957 122.277 78.611 99.298 1.00 0.00 O ATOM 69506 H1 WAT 4957 121.540 78.597 98.688 1.00 0.00 H ATOM 69507 H2 WAT 4957 122.850 77.905 98.999 1.00 0.00 H TER 69509 WAT 4957 ATOM 69509 O WAT 4958 78.298 145.756 142.967 1.00 0.00 O ATOM 69510 H1 WAT 4958 77.466 145.920 142.524 1.00 0.00 H ATOM 69511 H2 WAT 4958 78.964 145.976 142.316 1.00 0.00 H TER 69513 WAT 4958 ATOM 69513 O WAT 4959 9.982 122.329 65.162 1.00 0.00 O ATOM 69514 H1 WAT 4959 9.949 121.580 65.757 1.00 0.00 H ATOM 69515 H2 WAT 4959 9.615 122.000 64.341 1.00 0.00 H TER 69517 WAT 4959 ATOM 69517 O WAT 4960 70.619 106.613 144.136 1.00 0.00 O ATOM 69518 H1 WAT 4960 70.962 107.020 144.931 1.00 0.00 H ATOM 69519 H2 WAT 4960 71.293 106.771 143.476 1.00 0.00 H TER 69521 WAT 4960 ATOM 69521 O WAT 4961 49.949 80.365 105.466 1.00 0.00 O ATOM 69522 H1 WAT 4961 50.847 80.158 105.206 1.00 0.00 H ATOM 69523 H2 WAT 4961 49.436 80.257 104.666 1.00 0.00 H TER 69525 WAT 4961 ATOM 69525 O WAT 4962 75.345 53.384 94.296 1.00 0.00 O ATOM 69526 H1 WAT 4962 76.287 53.510 94.181 1.00 0.00 H ATOM 69527 H2 WAT 4962 75.274 52.643 94.897 1.00 0.00 H TER 69529 WAT 4962 ATOM 69529 O WAT 4963 134.614 131.523 23.182 1.00 0.00 O ATOM 69530 H1 WAT 4963 133.793 131.376 23.652 1.00 0.00 H ATOM 69531 H2 WAT 4963 134.409 132.217 22.555 1.00 0.00 H TER 69533 WAT 4963 ATOM 69533 O WAT 4964 82.704 59.711 80.701 1.00 0.00 O ATOM 69534 H1 WAT 4964 83.324 59.819 81.422 1.00 0.00 H ATOM 69535 H2 WAT 4964 82.095 59.039 81.008 1.00 0.00 H TER 69537 WAT 4964 ATOM 69537 O WAT 4965 0.401 13.450 117.751 1.00 0.00 O ATOM 69538 H1 WAT 4965 0.180 13.002 118.567 1.00 0.00 H ATOM 69539 H2 WAT 4965 0.791 12.770 117.202 1.00 0.00 H TER 69541 WAT 4965 ATOM 69541 O WAT 4966 61.825 76.985 9.431 1.00 0.00 O ATOM 69542 H1 WAT 4966 62.170 77.767 9.000 1.00 0.00 H ATOM 69543 H2 WAT 4966 61.618 76.387 8.714 1.00 0.00 H TER 69545 WAT 4966 ATOM 69545 O WAT 4967 113.977 105.504 73.988 1.00 0.00 O ATOM 69546 H1 WAT 4967 114.730 105.394 74.570 1.00 0.00 H ATOM 69547 H2 WAT 4967 113.606 104.625 73.907 1.00 0.00 H TER 69549 WAT 4967 ATOM 69549 O WAT 4968 131.794 124.317 152.346 1.00 0.00 O ATOM 69550 H1 WAT 4968 132.102 124.980 151.727 1.00 0.00 H ATOM 69551 H2 WAT 4968 131.134 124.769 152.872 1.00 0.00 H TER 69553 WAT 4968 ATOM 69553 O WAT 4969 119.401 66.449 7.508 1.00 0.00 O ATOM 69554 H1 WAT 4969 118.492 66.670 7.305 1.00 0.00 H ATOM 69555 H2 WAT 4969 119.918 67.092 7.023 1.00 0.00 H TER 69557 WAT 4969 ATOM 69557 O WAT 4970 79.591 24.425 121.307 1.00 0.00 O ATOM 69558 H1 WAT 4970 79.487 25.301 120.935 1.00 0.00 H ATOM 69559 H2 WAT 4970 78.913 24.369 121.981 1.00 0.00 H TER 69561 WAT 4970 ATOM 69561 O WAT 4971 66.226 50.077 62.612 1.00 0.00 O ATOM 69562 H1 WAT 4971 66.818 50.015 63.362 1.00 0.00 H ATOM 69563 H2 WAT 4971 66.308 49.231 62.172 1.00 0.00 H TER 69565 WAT 4971 ATOM 69565 O WAT 4972 91.869 96.215 137.305 1.00 0.00 O ATOM 69566 H1 WAT 4972 91.469 95.502 137.802 1.00 0.00 H ATOM 69567 H2 WAT 4972 91.909 95.887 136.406 1.00 0.00 H TER 69569 WAT 4972 ATOM 69569 O WAT 4973 132.280 140.856 130.736 1.00 0.00 O ATOM 69570 H1 WAT 4973 132.517 141.188 129.870 1.00 0.00 H ATOM 69571 H2 WAT 4973 131.531 140.282 130.575 1.00 0.00 H TER 69573 WAT 4973 ATOM 69573 O WAT 4974 139.475 58.021 62.513 1.00 0.00 O ATOM 69574 H1 WAT 4974 138.673 58.484 62.754 1.00 0.00 H ATOM 69575 H2 WAT 4974 139.951 58.637 61.956 1.00 0.00 H TER 69577 WAT 4974 ATOM 69577 O WAT 4975 108.553 97.748 99.487 1.00 0.00 O ATOM 69578 H1 WAT 4975 107.800 97.802 98.897 1.00 0.00 H ATOM 69579 H2 WAT 4975 109.291 97.537 98.915 1.00 0.00 H TER 69581 WAT 4975 ATOM 69581 O WAT 4976 35.702 95.065 105.848 1.00 0.00 O ATOM 69582 H1 WAT 4976 35.502 94.539 106.622 1.00 0.00 H ATOM 69583 H2 WAT 4976 36.626 94.888 105.670 1.00 0.00 H TER 69585 WAT 4976 ATOM 69585 O WAT 4977 74.337 52.589 75.783 1.00 0.00 O ATOM 69586 H1 WAT 4977 74.295 52.113 76.612 1.00 0.00 H ATOM 69587 H2 WAT 4977 73.458 52.505 75.414 1.00 0.00 H TER 69589 WAT 4977 ATOM 69589 O WAT 4978 31.897 34.584 90.600 1.00 0.00 O ATOM 69590 H1 WAT 4978 32.623 35.072 90.987 1.00 0.00 H ATOM 69591 H2 WAT 4978 31.320 34.386 91.338 1.00 0.00 H TER 69593 WAT 4978 ATOM 69593 O WAT 4979 42.999 72.205 90.295 1.00 0.00 O ATOM 69594 H1 WAT 4979 43.754 71.623 90.206 1.00 0.00 H ATOM 69595 H2 WAT 4979 42.326 71.811 89.741 1.00 0.00 H TER 69597 WAT 4979 ATOM 69597 O WAT 4980 18.287 16.410 87.975 1.00 0.00 O ATOM 69598 H1 WAT 4980 18.105 17.235 87.525 1.00 0.00 H ATOM 69599 H2 WAT 4980 18.870 15.936 87.381 1.00 0.00 H TER 69601 WAT 4980 ATOM 69601 O WAT 4981 32.608 57.676 153.497 1.00 0.00 O ATOM 69602 H1 WAT 4981 33.386 57.140 153.343 1.00 0.00 H ATOM 69603 H2 WAT 4981 32.878 58.305 154.166 1.00 0.00 H TER 69605 WAT 4981 ATOM 69605 O WAT 4982 1.220 112.280 70.799 1.00 0.00 O ATOM 69606 H1 WAT 4982 0.580 111.614 70.548 1.00 0.00 H ATOM 69607 H2 WAT 4982 0.692 113.013 71.115 1.00 0.00 H TER 69609 WAT 4982 ATOM 69609 O WAT 4983 108.739 42.917 88.308 1.00 0.00 O ATOM 69610 H1 WAT 4983 107.930 43.245 88.701 1.00 0.00 H ATOM 69611 H2 WAT 4983 109.368 42.901 89.029 1.00 0.00 H TER 69613 WAT 4983 ATOM 69613 O WAT 4984 92.737 32.662 89.925 1.00 0.00 O ATOM 69614 H1 WAT 4984 92.270 32.686 90.760 1.00 0.00 H ATOM 69615 H2 WAT 4984 93.041 33.560 89.794 1.00 0.00 H TER 69617 WAT 4984 ATOM 69617 O WAT 4985 142.479 79.000 130.796 1.00 0.00 O ATOM 69618 H1 WAT 4985 142.782 78.219 131.258 1.00 0.00 H ATOM 69619 H2 WAT 4985 143.096 79.685 131.053 1.00 0.00 H TER 69621 WAT 4985 ATOM 69621 O WAT 4986 61.110 31.058 105.017 1.00 0.00 O ATOM 69622 H1 WAT 4986 60.653 31.147 104.181 1.00 0.00 H ATOM 69623 H2 WAT 4986 62.036 31.150 104.795 1.00 0.00 H TER 69625 WAT 4986 ATOM 69625 O WAT 4987 75.833 61.820 125.682 1.00 0.00 O ATOM 69626 H1 WAT 4987 75.499 61.732 124.789 1.00 0.00 H ATOM 69627 H2 WAT 4987 75.949 62.762 125.803 1.00 0.00 H TER 69629 WAT 4987 ATOM 69629 O WAT 4988 87.917 132.085 73.071 1.00 0.00 O ATOM 69630 H1 WAT 4988 88.617 131.739 72.517 1.00 0.00 H ATOM 69631 H2 WAT 4988 87.764 132.970 72.738 1.00 0.00 H TER 69633 WAT 4988 ATOM 69633 O WAT 4989 100.863 7.566 78.344 1.00 0.00 O ATOM 69634 H1 WAT 4989 100.008 7.912 78.602 1.00 0.00 H ATOM 69635 H2 WAT 4989 101.228 8.236 77.767 1.00 0.00 H TER 69637 WAT 4989 ATOM 69637 O WAT 4990 18.414 79.883 123.806 1.00 0.00 O ATOM 69638 H1 WAT 4990 18.074 80.721 124.118 1.00 0.00 H ATOM 69639 H2 WAT 4990 17.696 79.508 123.295 1.00 0.00 H TER 69641 WAT 4990 ATOM 69641 O WAT 4991 15.482 54.061 154.031 1.00 0.00 O ATOM 69642 H1 WAT 4991 14.765 54.687 153.931 1.00 0.00 H ATOM 69643 H2 WAT 4991 16.139 54.531 154.545 1.00 0.00 H TER 69645 WAT 4991 ATOM 69645 O WAT 4992 133.239 88.488 85.314 1.00 0.00 O ATOM 69646 H1 WAT 4992 132.446 87.953 85.279 1.00 0.00 H ATOM 69647 H2 WAT 4992 133.713 88.164 86.080 1.00 0.00 H TER 69649 WAT 4992 ATOM 69649 O WAT 4993 90.714 11.641 107.491 1.00 0.00 O ATOM 69650 H1 WAT 4993 91.137 12.212 108.133 1.00 0.00 H ATOM 69651 H2 WAT 4993 90.786 10.764 107.868 1.00 0.00 H TER 69653 WAT 4993 ATOM 69653 O WAT 4994 24.675 47.548 140.257 1.00 0.00 O ATOM 69654 H1 WAT 4994 24.160 47.600 139.452 1.00 0.00 H ATOM 69655 H2 WAT 4994 25.157 48.375 140.286 1.00 0.00 H TER 69657 WAT 4994 ATOM 69657 O WAT 4995 139.146 86.294 88.116 1.00 0.00 O ATOM 69658 H1 WAT 4995 139.269 86.370 89.062 1.00 0.00 H ATOM 69659 H2 WAT 4995 139.673 87.004 87.748 1.00 0.00 H TER 69661 WAT 4995 ATOM 69661 O WAT 4996 8.775 19.106 111.745 1.00 0.00 O ATOM 69662 H1 WAT 4996 8.328 18.260 111.725 1.00 0.00 H ATOM 69663 H2 WAT 4996 9.315 19.073 112.535 1.00 0.00 H TER 69665 WAT 4996 ATOM 69665 O WAT 4997 33.668 137.245 141.832 1.00 0.00 O ATOM 69666 H1 WAT 4997 34.085 138.066 142.093 1.00 0.00 H ATOM 69667 H2 WAT 4997 33.596 136.744 142.644 1.00 0.00 H TER 69669 WAT 4997 ATOM 69669 O WAT 4998 144.097 48.774 113.522 1.00 0.00 O ATOM 69670 H1 WAT 4998 144.988 49.063 113.325 1.00 0.00 H ATOM 69671 H2 WAT 4998 144.206 48.100 114.193 1.00 0.00 H TER 69673 WAT 4998 ATOM 69673 O WAT 4999 48.159 103.103 125.248 1.00 0.00 O ATOM 69674 H1 WAT 4999 48.672 103.078 124.440 1.00 0.00 H ATOM 69675 H2 WAT 4999 48.736 102.724 125.910 1.00 0.00 H TER 69677 WAT 4999 ATOM 69677 O WAT 5000 129.434 72.426 11.299 1.00 0.00 O ATOM 69678 H1 WAT 5000 129.331 72.505 10.351 1.00 0.00 H ATOM 69679 H2 WAT 5000 128.896 71.670 11.536 1.00 0.00 H TER 69681 WAT 5000 ATOM 69681 O WAT 5001 5.327 22.516 69.163 1.00 0.00 O ATOM 69682 H1 WAT 5001 4.744 21.912 69.622 1.00 0.00 H ATOM 69683 H2 WAT 5001 4.752 23.218 68.857 1.00 0.00 H TER 69685 WAT 5001 ATOM 69685 O WAT 5002 120.918 87.985 9.385 1.00 0.00 O ATOM 69686 H1 WAT 5002 120.459 87.285 9.850 1.00 0.00 H ATOM 69687 H2 WAT 5002 121.532 88.338 10.030 1.00 0.00 H TER 69689 WAT 5002 ATOM 69689 O WAT 5003 12.379 110.537 147.641 1.00 0.00 O ATOM 69690 H1 WAT 5003 12.936 111.146 148.126 1.00 0.00 H ATOM 69691 H2 WAT 5003 11.536 110.985 147.574 1.00 0.00 H TER 69693 WAT 5003 ATOM 69693 O WAT 5004 2.883 111.649 142.316 1.00 0.00 O ATOM 69694 H1 WAT 5004 2.136 112.126 141.955 1.00 0.00 H ATOM 69695 H2 WAT 5004 3.536 111.661 141.617 1.00 0.00 H TER 69697 WAT 5004 ATOM 69697 O WAT 5005 140.525 138.819 84.495 1.00 0.00 O ATOM 69698 H1 WAT 5005 139.949 138.628 83.755 1.00 0.00 H ATOM 69699 H2 WAT 5005 141.130 139.481 84.163 1.00 0.00 H TER 69701 WAT 5005 ATOM 69701 O WAT 5006 16.631 75.960 20.313 1.00 0.00 O ATOM 69702 H1 WAT 5006 17.574 75.895 20.161 1.00 0.00 H ATOM 69703 H2 WAT 5006 16.451 75.303 20.986 1.00 0.00 H TER 69705 WAT 5006 ATOM 69705 O WAT 5007 35.855 38.712 83.924 1.00 0.00 O ATOM 69706 H1 WAT 5007 36.194 39.164 84.697 1.00 0.00 H ATOM 69707 H2 WAT 5007 35.077 38.251 84.238 1.00 0.00 H TER 69709 WAT 5007 ATOM 69709 O WAT 5008 121.800 19.556 132.836 1.00 0.00 O ATOM 69710 H1 WAT 5008 121.708 18.653 132.532 1.00 0.00 H ATOM 69711 H2 WAT 5008 121.305 19.584 133.655 1.00 0.00 H TER 69713 WAT 5008 ATOM 69713 O WAT 5009 42.571 116.804 152.297 1.00 0.00 O ATOM 69714 H1 WAT 5009 41.850 117.415 152.446 1.00 0.00 H ATOM 69715 H2 WAT 5009 43.155 117.264 151.695 1.00 0.00 H TER 69717 WAT 5009 ATOM 69717 O WAT 5010 127.808 124.925 68.289 1.00 0.00 O ATOM 69718 H1 WAT 5010 126.879 125.040 68.091 1.00 0.00 H ATOM 69719 H2 WAT 5010 128.026 124.065 67.930 1.00 0.00 H TER 69721 WAT 5010 ATOM 69721 O WAT 5011 2.854 23.521 6.605 1.00 0.00 O ATOM 69722 H1 WAT 5011 3.397 22.744 6.738 1.00 0.00 H ATOM 69723 H2 WAT 5011 2.170 23.453 7.271 1.00 0.00 H TER 69725 WAT 5011 ATOM 69725 O WAT 5012 45.059 118.230 62.585 1.00 0.00 O ATOM 69726 H1 WAT 5012 44.557 117.416 62.633 1.00 0.00 H ATOM 69727 H2 WAT 5012 44.639 118.729 61.884 1.00 0.00 H TER 69729 WAT 5012 ATOM 69729 O WAT 5013 63.095 9.362 129.213 1.00 0.00 O ATOM 69730 H1 WAT 5013 63.862 8.956 129.616 1.00 0.00 H ATOM 69731 H2 WAT 5013 63.432 9.772 128.417 1.00 0.00 H TER 69733 WAT 5013 ATOM 69733 O WAT 5014 133.712 108.122 122.396 1.00 0.00 O ATOM 69734 H1 WAT 5014 134.415 108.535 121.894 1.00 0.00 H ATOM 69735 H2 WAT 5014 134.038 108.105 123.296 1.00 0.00 H TER 69737 WAT 5014 ATOM 69737 O WAT 5015 118.109 94.273 125.823 1.00 0.00 O ATOM 69738 H1 WAT 5015 117.255 94.451 125.429 1.00 0.00 H ATOM 69739 H2 WAT 5015 118.010 94.534 126.739 1.00 0.00 H TER 69741 WAT 5015 ATOM 69741 O WAT 5016 24.649 47.988 18.958 1.00 0.00 O ATOM 69742 H1 WAT 5016 24.313 47.314 18.368 1.00 0.00 H ATOM 69743 H2 WAT 5016 24.944 48.690 18.378 1.00 0.00 H TER 69745 WAT 5016 ATOM 69745 O WAT 5017 104.759 94.631 75.537 1.00 0.00 O ATOM 69746 H1 WAT 5017 104.673 93.860 74.977 1.00 0.00 H ATOM 69747 H2 WAT 5017 105.368 95.201 75.067 1.00 0.00 H TER 69749 WAT 5017 ATOM 69749 O WAT 5018 9.388 75.892 95.597 1.00 0.00 O ATOM 69750 H1 WAT 5018 10.105 75.277 95.753 1.00 0.00 H ATOM 69751 H2 WAT 5018 8.698 75.360 95.200 1.00 0.00 H TER 69753 WAT 5018 ATOM 69753 O WAT 5019 80.891 63.169 103.985 1.00 0.00 O ATOM 69754 H1 WAT 5019 80.054 63.605 103.827 1.00 0.00 H ATOM 69755 H2 WAT 5019 81.540 63.741 103.574 1.00 0.00 H TER 69757 WAT 5019 ATOM 69757 O WAT 5020 52.665 90.611 11.734 1.00 0.00 O ATOM 69758 H1 WAT 5020 52.731 91.562 11.813 1.00 0.00 H ATOM 69759 H2 WAT 5020 51.729 90.428 11.811 1.00 0.00 H TER 69761 WAT 5020 ATOM 69761 O WAT 5021 70.788 4.453 85.732 1.00 0.00 O ATOM 69762 H1 WAT 5021 71.646 4.155 85.430 1.00 0.00 H ATOM 69763 H2 WAT 5021 70.691 4.065 86.601 1.00 0.00 H TER 69765 WAT 5021 ATOM 69765 O WAT 5022 143.167 49.091 133.833 1.00 0.00 O ATOM 69766 H1 WAT 5022 142.947 49.905 134.286 1.00 0.00 H ATOM 69767 H2 WAT 5022 143.773 49.359 133.142 1.00 0.00 H TER 69769 WAT 5022 ATOM 69769 O WAT 5023 9.842 39.494 21.264 1.00 0.00 O ATOM 69770 H1 WAT 5023 9.534 40.170 20.660 1.00 0.00 H ATOM 69771 H2 WAT 5023 9.290 39.597 22.040 1.00 0.00 H TER 69773 WAT 5023 ATOM 69773 O WAT 5024 144.922 142.392 134.104 1.00 0.00 O ATOM 69774 H1 WAT 5024 145.520 141.814 134.577 1.00 0.00 H ATOM 69775 H2 WAT 5024 144.126 141.872 133.991 1.00 0.00 H TER 69777 WAT 5024 ATOM 69777 O WAT 5025 86.119 95.727 97.485 1.00 0.00 O ATOM 69778 H1 WAT 5025 86.563 96.573 97.428 1.00 0.00 H ATOM 69779 H2 WAT 5025 85.456 95.849 98.165 1.00 0.00 H TER 69781 WAT 5025 ATOM 69781 O WAT 5026 19.308 133.110 71.179 1.00 0.00 O ATOM 69782 H1 WAT 5026 18.848 133.895 70.881 1.00 0.00 H ATOM 69783 H2 WAT 5026 20.175 133.175 70.777 1.00 0.00 H TER 69785 WAT 5026 ATOM 69785 O WAT 5027 100.294 86.068 155.341 1.00 0.00 O ATOM 69786 H1 WAT 5027 101.143 85.906 155.754 1.00 0.00 H ATOM 69787 H2 WAT 5027 100.032 86.930 155.664 1.00 0.00 H TER 69789 WAT 5027 ATOM 69789 O WAT 5028 73.436 116.985 152.668 1.00 0.00 O ATOM 69790 H1 WAT 5028 74.085 117.678 152.546 1.00 0.00 H ATOM 69791 H2 WAT 5028 72.765 117.166 152.010 1.00 0.00 H TER 69793 WAT 5028 ATOM 69793 O WAT 5029 4.066 21.257 7.544 1.00 0.00 O ATOM 69794 H1 WAT 5029 3.619 20.504 7.157 1.00 0.00 H ATOM 69795 H2 WAT 5029 4.944 20.935 7.748 1.00 0.00 H TER 69797 WAT 5029 ATOM 69797 O WAT 5030 31.144 97.759 139.333 1.00 0.00 O ATOM 69798 H1 WAT 5030 30.776 97.294 138.581 1.00 0.00 H ATOM 69799 H2 WAT 5030 32.091 97.693 139.216 1.00 0.00 H TER 69801 WAT 5030 ATOM 69801 O WAT 5031 88.467 12.875 149.843 1.00 0.00 O ATOM 69802 H1 WAT 5031 89.035 12.610 150.566 1.00 0.00 H ATOM 69803 H2 WAT 5031 87.606 12.992 150.244 1.00 0.00 H TER 69805 WAT 5031 ATOM 69805 O WAT 5032 74.918 19.782 143.038 1.00 0.00 O ATOM 69806 H1 WAT 5032 75.857 19.799 143.223 1.00 0.00 H ATOM 69807 H2 WAT 5032 74.505 19.745 143.901 1.00 0.00 H TER 69809 WAT 5032 ATOM 69809 O WAT 5033 91.850 62.729 100.510 1.00 0.00 O ATOM 69810 H1 WAT 5033 91.515 62.311 99.717 1.00 0.00 H ATOM 69811 H2 WAT 5033 91.121 62.689 101.129 1.00 0.00 H TER 69813 WAT 5033 ATOM 69813 O WAT 5034 79.102 26.966 91.554 1.00 0.00 O ATOM 69814 H1 WAT 5034 79.414 27.023 90.651 1.00 0.00 H ATOM 69815 H2 WAT 5034 78.727 27.828 91.733 1.00 0.00 H TER 69817 WAT 5034 ATOM 69817 O WAT 5035 68.408 44.379 118.814 1.00 0.00 O ATOM 69818 H1 WAT 5035 68.277 45.166 118.285 1.00 0.00 H ATOM 69819 H2 WAT 5035 68.999 43.836 118.294 1.00 0.00 H TER 69821 WAT 5035 ATOM 69821 O WAT 5036 5.175 5.840 92.312 1.00 0.00 O ATOM 69822 H1 WAT 5036 5.544 5.323 93.028 1.00 0.00 H ATOM 69823 H2 WAT 5036 5.819 6.532 92.160 1.00 0.00 H TER 69825 WAT 5036 ATOM 69825 O WAT 5037 100.465 59.566 16.765 1.00 0.00 O ATOM 69826 H1 WAT 5037 99.974 59.776 17.560 1.00 0.00 H ATOM 69827 H2 WAT 5037 99.792 59.353 16.118 1.00 0.00 H TER 69829 WAT 5037 ATOM 69829 O WAT 5038 11.057 144.980 94.283 1.00 0.00 O ATOM 69830 H1 WAT 5038 10.128 144.848 94.092 1.00 0.00 H ATOM 69831 H2 WAT 5038 11.066 145.455 95.114 1.00 0.00 H TER 69833 WAT 5038 ATOM 69833 O WAT 5039 3.889 127.000 122.474 1.00 0.00 O ATOM 69834 H1 WAT 5039 3.965 127.671 121.796 1.00 0.00 H ATOM 69835 H2 WAT 5039 4.275 127.402 123.253 1.00 0.00 H TER 69837 WAT 5039 ATOM 69837 O WAT 5040 16.577 133.445 105.899 1.00 0.00 O ATOM 69838 H1 WAT 5040 17.051 132.678 106.220 1.00 0.00 H ATOM 69839 H2 WAT 5040 17.109 133.767 105.171 1.00 0.00 H TER 69841 WAT 5040 ATOM 69841 O WAT 5041 9.206 36.254 69.412 1.00 0.00 O ATOM 69842 H1 WAT 5041 10.138 36.121 69.585 1.00 0.00 H ATOM 69843 H2 WAT 5041 9.033 35.735 68.627 1.00 0.00 H TER 69845 WAT 5041 ATOM 69845 O WAT 5042 52.214 57.643 14.598 1.00 0.00 O ATOM 69846 H1 WAT 5042 52.432 57.060 13.871 1.00 0.00 H ATOM 69847 H2 WAT 5042 53.035 57.740 15.081 1.00 0.00 H TER 69849 WAT 5042 ATOM 69849 O WAT 5043 66.907 137.476 139.525 1.00 0.00 O ATOM 69850 H1 WAT 5043 67.367 137.187 138.737 1.00 0.00 H ATOM 69851 H2 WAT 5043 66.151 136.892 139.590 1.00 0.00 H TER 69853 WAT 5043 ATOM 69853 O WAT 5044 121.175 74.047 68.313 1.00 0.00 O ATOM 69854 H1 WAT 5044 121.014 74.544 67.511 1.00 0.00 H ATOM 69855 H2 WAT 5044 121.835 73.399 68.065 1.00 0.00 H TER 69857 WAT 5044 ATOM 69857 O WAT 5045 143.185 75.774 63.691 1.00 0.00 O ATOM 69858 H1 WAT 5045 143.750 75.523 64.422 1.00 0.00 H ATOM 69859 H2 WAT 5045 142.367 75.302 63.847 1.00 0.00 H TER 69861 WAT 5045 ATOM 69861 O WAT 5046 41.953 49.940 87.072 1.00 0.00 O ATOM 69862 H1 WAT 5046 41.574 50.798 86.884 1.00 0.00 H ATOM 69863 H2 WAT 5046 42.871 50.122 87.276 1.00 0.00 H TER 69865 WAT 5046 ATOM 69865 O WAT 5047 29.082 86.000 79.472 1.00 0.00 O ATOM 69866 H1 WAT 5047 28.166 85.759 79.333 1.00 0.00 H ATOM 69867 H2 WAT 5047 29.440 85.287 80.000 1.00 0.00 H TER 69869 WAT 5047 ATOM 69869 O WAT 5048 110.711 141.934 60.674 1.00 0.00 O ATOM 69870 H1 WAT 5048 110.530 142.705 61.213 1.00 0.00 H ATOM 69871 H2 WAT 5048 111.619 142.046 60.395 1.00 0.00 H TER 69873 WAT 5048 ATOM 69873 O WAT 5049 33.755 137.191 155.462 1.00 0.00 O ATOM 69874 H1 WAT 5049 33.818 136.473 154.832 1.00 0.00 H ATOM 69875 H2 WAT 5049 33.020 137.720 155.149 1.00 0.00 H TER 69877 WAT 5049 ATOM 69877 O WAT 5050 106.174 20.254 136.371 1.00 0.00 O ATOM 69878 H1 WAT 5050 106.692 20.750 137.004 1.00 0.00 H ATOM 69879 H2 WAT 5050 105.292 20.619 136.445 1.00 0.00 H TER 69881 WAT 5050 ATOM 69881 O WAT 5051 50.468 139.766 152.788 1.00 0.00 O ATOM 69882 H1 WAT 5051 50.449 139.282 153.614 1.00 0.00 H ATOM 69883 H2 WAT 5051 51.061 139.263 152.230 1.00 0.00 H TER 69885 WAT 5051 ATOM 69885 O WAT 5052 96.853 145.702 123.264 1.00 0.00 O ATOM 69886 H1 WAT 5052 97.627 145.156 123.126 1.00 0.00 H ATOM 69887 H2 WAT 5052 97.060 146.219 124.042 1.00 0.00 H TER 69889 WAT 5052 ATOM 69889 O WAT 5053 10.734 121.325 58.483 1.00 0.00 O ATOM 69890 H1 WAT 5053 10.760 122.174 58.925 1.00 0.00 H ATOM 69891 H2 WAT 5053 10.441 120.713 59.157 1.00 0.00 H TER 69893 WAT 5053 ATOM 69893 O WAT 5054 44.426 50.420 77.703 1.00 0.00 O ATOM 69894 H1 WAT 5054 45.014 50.761 78.377 1.00 0.00 H ATOM 69895 H2 WAT 5054 43.773 51.110 77.584 1.00 0.00 H TER 69897 WAT 5054 ATOM 69897 O WAT 5055 75.689 100.943 16.884 1.00 0.00 O ATOM 69898 H1 WAT 5055 75.687 100.568 17.764 1.00 0.00 H ATOM 69899 H2 WAT 5055 74.955 101.557 16.883 1.00 0.00 H TER 69901 WAT 5055 ATOM 69901 O WAT 5056 116.117 7.488 145.305 1.00 0.00 O ATOM 69902 H1 WAT 5056 116.101 6.764 145.930 1.00 0.00 H ATOM 69903 H2 WAT 5056 117.046 7.691 145.196 1.00 0.00 H TER 69905 WAT 5056 ATOM 69905 O WAT 5057 115.638 116.431 118.337 1.00 0.00 O ATOM 69906 H1 WAT 5057 116.521 116.131 118.124 1.00 0.00 H ATOM 69907 H2 WAT 5057 115.627 117.351 118.073 1.00 0.00 H TER 69909 WAT 5057 ATOM 69909 O WAT 5058 79.517 22.168 130.170 1.00 0.00 O ATOM 69910 H1 WAT 5058 80.159 21.622 129.716 1.00 0.00 H ATOM 69911 H2 WAT 5058 78.673 21.895 129.809 1.00 0.00 H TER 69913 WAT 5058 ATOM 69913 O WAT 5059 61.007 109.671 141.509 1.00 0.00 O ATOM 69914 H1 WAT 5059 61.117 110.524 141.088 1.00 0.00 H ATOM 69915 H2 WAT 5059 60.265 109.273 141.053 1.00 0.00 H TER 69917 WAT 5059 ATOM 69917 O WAT 5060 55.868 106.937 81.229 1.00 0.00 O ATOM 69918 H1 WAT 5060 55.390 106.670 82.015 1.00 0.00 H ATOM 69919 H2 WAT 5060 55.281 107.551 80.789 1.00 0.00 H TER 69921 WAT 5060 ATOM 69921 O WAT 5061 41.666 56.982 108.286 1.00 0.00 O ATOM 69922 H1 WAT 5061 40.795 56.803 107.930 1.00 0.00 H ATOM 69923 H2 WAT 5061 41.627 56.658 109.186 1.00 0.00 H TER 69925 WAT 5061 ATOM 69925 O WAT 5062 111.488 138.935 75.552 1.00 0.00 O ATOM 69926 H1 WAT 5062 111.284 139.556 74.853 1.00 0.00 H ATOM 69927 H2 WAT 5062 112.307 138.524 75.275 1.00 0.00 H TER 69929 WAT 5062 ATOM 69929 O WAT 5063 14.601 98.206 3.085 1.00 0.00 O ATOM 69930 H1 WAT 5063 13.918 98.396 2.442 1.00 0.00 H ATOM 69931 H2 WAT 5063 15.384 98.041 2.560 1.00 0.00 H TER 69933 WAT 5063 ATOM 69933 O WAT 5064 142.885 124.729 155.768 1.00 0.00 O ATOM 69934 H1 WAT 5064 142.672 124.712 156.701 1.00 0.00 H ATOM 69935 H2 WAT 5064 142.087 124.428 155.334 1.00 0.00 H TER 69937 WAT 5064 ATOM 69937 O WAT 5065 93.338 116.270 124.047 1.00 0.00 O ATOM 69938 H1 WAT 5065 93.479 117.216 124.089 1.00 0.00 H ATOM 69939 H2 WAT 5065 93.959 115.907 124.679 1.00 0.00 H TER 69941 WAT 5065 ATOM 69941 O WAT 5066 47.505 20.607 100.875 1.00 0.00 O ATOM 69942 H1 WAT 5066 47.022 19.915 101.327 1.00 0.00 H ATOM 69943 H2 WAT 5066 46.845 21.272 100.679 1.00 0.00 H TER 69945 WAT 5066 ATOM 69945 O WAT 5067 34.436 4.362 17.085 1.00 0.00 O ATOM 69946 H1 WAT 5067 34.090 3.476 16.985 1.00 0.00 H ATOM 69947 H2 WAT 5067 35.380 4.267 16.954 1.00 0.00 H TER 69949 WAT 5067 ATOM 69949 O WAT 5068 129.314 89.056 141.890 1.00 0.00 O ATOM 69950 H1 WAT 5068 130.032 88.458 141.680 1.00 0.00 H ATOM 69951 H2 WAT 5068 128.523 88.527 141.787 1.00 0.00 H TER 69953 WAT 5068 ATOM 69953 O WAT 5069 88.208 64.955 120.035 1.00 0.00 O ATOM 69954 H1 WAT 5069 88.272 64.953 119.080 1.00 0.00 H ATOM 69955 H2 WAT 5069 88.433 64.061 120.293 1.00 0.00 H TER 69957 WAT 5069 ATOM 69957 O WAT 5070 132.946 123.500 14.311 1.00 0.00 O ATOM 69958 H1 WAT 5070 132.727 123.191 13.432 1.00 0.00 H ATOM 69959 H2 WAT 5070 132.238 124.104 14.536 1.00 0.00 H TER 69961 WAT 5070 ATOM 69961 O WAT 5071 87.561 10.739 135.605 1.00 0.00 O ATOM 69962 H1 WAT 5071 88.147 10.247 136.180 1.00 0.00 H ATOM 69963 H2 WAT 5071 87.766 10.422 134.725 1.00 0.00 H TER 69965 WAT 5071 ATOM 69965 O WAT 5072 86.496 85.536 4.504 1.00 0.00 O ATOM 69966 H1 WAT 5072 85.669 85.316 4.932 1.00 0.00 H ATOM 69967 H2 WAT 5072 87.090 85.747 5.224 1.00 0.00 H TER 69969 WAT 5072 ATOM 69969 O WAT 5073 90.545 125.250 123.999 1.00 0.00 O ATOM 69970 H1 WAT 5073 91.155 125.254 123.262 1.00 0.00 H ATOM 69971 H2 WAT 5073 90.646 124.382 124.389 1.00 0.00 H TER 69973 WAT 5073 ATOM 69973 O WAT 5074 85.600 4.098 137.494 1.00 0.00 O ATOM 69974 H1 WAT 5074 85.479 4.986 137.830 1.00 0.00 H ATOM 69975 H2 WAT 5074 85.811 4.219 136.568 1.00 0.00 H TER 69977 WAT 5074 ATOM 69977 O WAT 5075 114.349 139.709 5.294 1.00 0.00 O ATOM 69978 H1 WAT 5075 114.913 139.318 4.627 1.00 0.00 H ATOM 69979 H2 WAT 5075 113.995 138.961 5.777 1.00 0.00 H TER 69981 WAT 5075 ATOM 69981 O WAT 5076 17.051 129.893 3.047 1.00 0.00 O ATOM 69982 H1 WAT 5076 17.043 129.077 2.547 1.00 0.00 H ATOM 69983 H2 WAT 5076 16.387 130.439 2.626 1.00 0.00 H TER 69985 WAT 5076 ATOM 69985 O WAT 5077 126.900 14.334 106.927 1.00 0.00 O ATOM 69986 H1 WAT 5077 126.818 15.244 107.214 1.00 0.00 H ATOM 69987 H2 WAT 5077 126.015 13.978 107.007 1.00 0.00 H TER 69989 WAT 5077 ATOM 69989 O WAT 5078 87.589 139.873 82.882 1.00 0.00 O ATOM 69990 H1 WAT 5078 88.311 139.297 83.131 1.00 0.00 H ATOM 69991 H2 WAT 5078 87.345 140.315 83.696 1.00 0.00 H TER 69993 WAT 5078 ATOM 69993 O WAT 5079 126.668 103.658 94.611 1.00 0.00 O ATOM 69994 H1 WAT 5079 126.188 103.250 93.890 1.00 0.00 H ATOM 69995 H2 WAT 5079 127.418 103.082 94.755 1.00 0.00 H TER 69997 WAT 5079 ATOM 69997 O WAT 5080 105.244 101.480 29.568 1.00 0.00 O ATOM 69998 H1 WAT 5080 105.833 102.168 29.878 1.00 0.00 H ATOM 69999 H2 WAT 5080 105.648 100.665 29.868 1.00 0.00 H TER 70001 WAT 5080 ATOM 70001 O WAT 5081 64.443 2.320 141.630 1.00 0.00 O ATOM 70002 H1 WAT 5081 64.350 3.225 141.926 1.00 0.00 H ATOM 70003 H2 WAT 5081 64.000 2.298 140.782 1.00 0.00 H TER 70005 WAT 5081 ATOM 70005 O WAT 5082 56.926 39.813 6.833 1.00 0.00 O ATOM 70006 H1 WAT 5082 57.568 40.439 6.497 1.00 0.00 H ATOM 70007 H2 WAT 5082 56.372 39.611 6.079 1.00 0.00 H TER 70009 WAT 5082 ATOM 70009 O WAT 5083 84.777 81.300 129.261 1.00 0.00 O ATOM 70010 H1 WAT 5083 84.891 80.360 129.402 1.00 0.00 H ATOM 70011 H2 WAT 5083 83.829 81.431 129.269 1.00 0.00 H TER 70013 WAT 5083 ATOM 70013 O WAT 5084 63.607 62.448 154.618 1.00 0.00 O ATOM 70014 H1 WAT 5084 63.569 63.015 153.848 1.00 0.00 H ATOM 70015 H2 WAT 5084 62.692 62.318 154.866 1.00 0.00 H TER 70017 WAT 5084 ATOM 70017 O WAT 5085 22.724 52.610 118.119 1.00 0.00 O ATOM 70018 H1 WAT 5085 23.138 53.472 118.171 1.00 0.00 H ATOM 70019 H2 WAT 5085 23.364 52.064 117.664 1.00 0.00 H TER 70021 WAT 5085 ATOM 70021 O WAT 5086 131.231 76.155 70.294 1.00 0.00 O ATOM 70022 H1 WAT 5086 130.583 75.585 69.881 1.00 0.00 H ATOM 70023 H2 WAT 5086 132.009 75.605 70.388 1.00 0.00 H TER 70025 WAT 5086 ATOM 70025 O WAT 5087 51.656 52.207 94.220 1.00 0.00 O ATOM 70026 H1 WAT 5087 51.596 52.662 95.060 1.00 0.00 H ATOM 70027 H2 WAT 5087 52.047 52.848 93.627 1.00 0.00 H TER 70029 WAT 5087 ATOM 70029 O WAT 5088 59.723 47.673 135.965 1.00 0.00 O ATOM 70030 H1 WAT 5088 59.472 47.436 136.857 1.00 0.00 H ATOM 70031 H2 WAT 5088 59.455 46.923 135.433 1.00 0.00 H TER 70033 WAT 5088 ATOM 70033 O WAT 5089 98.377 134.497 137.676 1.00 0.00 O ATOM 70034 H1 WAT 5089 99.247 134.139 137.498 1.00 0.00 H ATOM 70035 H2 WAT 5089 98.275 134.418 138.625 1.00 0.00 H TER 70037 WAT 5089 ATOM 70037 O WAT 5090 44.255 27.239 108.944 1.00 0.00 O ATOM 70038 H1 WAT 5090 43.498 27.017 109.486 1.00 0.00 H ATOM 70039 H2 WAT 5090 44.298 26.540 108.292 1.00 0.00 H TER 70041 WAT 5090 ATOM 70041 O WAT 5091 79.111 0.454 148.542 1.00 0.00 O ATOM 70042 H1 WAT 5091 78.312 0.538 148.021 1.00 0.00 H ATOM 70043 H2 WAT 5091 78.899 -0.208 149.199 1.00 0.00 H TER 70045 WAT 5091 ATOM 70045 O WAT 5092 103.410 145.195 13.759 1.00 0.00 O ATOM 70046 H1 WAT 5092 104.160 145.597 14.197 1.00 0.00 H ATOM 70047 H2 WAT 5092 103.570 145.341 12.827 1.00 0.00 H TER 70049 WAT 5092 ATOM 70049 O WAT 5093 9.282 56.329 61.620 1.00 0.00 O ATOM 70050 H1 WAT 5093 10.114 56.107 62.037 1.00 0.00 H ATOM 70051 H2 WAT 5093 9.451 56.234 60.683 1.00 0.00 H TER 70053 WAT 5093 ATOM 70053 O WAT 5094 10.625 18.850 74.147 1.00 0.00 O ATOM 70054 H1 WAT 5094 9.999 19.556 73.985 1.00 0.00 H ATOM 70055 H2 WAT 5094 11.046 18.705 73.299 1.00 0.00 H TER 70057 WAT 5094 ATOM 70057 O WAT 5095 31.974 129.714 78.864 1.00 0.00 O ATOM 70058 H1 WAT 5095 32.039 130.292 78.104 1.00 0.00 H ATOM 70059 H2 WAT 5095 32.838 129.307 78.930 1.00 0.00 H TER 70061 WAT 5095 ATOM 70061 O WAT 5096 96.407 93.632 151.114 1.00 0.00 O ATOM 70062 H1 WAT 5096 96.142 92.729 151.289 1.00 0.00 H ATOM 70063 H2 WAT 5096 96.101 94.123 151.877 1.00 0.00 H TER 70065 WAT 5096 ATOM 70065 O WAT 5097 62.725 50.652 151.863 1.00 0.00 O ATOM 70066 H1 WAT 5097 62.962 49.815 152.262 1.00 0.00 H ATOM 70067 H2 WAT 5097 63.235 50.684 151.053 1.00 0.00 H TER 70069 WAT 5097 ATOM 70069 O WAT 5098 94.314 141.341 135.150 1.00 0.00 O ATOM 70070 H1 WAT 5098 93.720 141.185 135.885 1.00 0.00 H ATOM 70071 H2 WAT 5098 93.735 141.483 134.401 1.00 0.00 H TER 70073 WAT 5098 ATOM 70073 O WAT 5099 64.153 80.539 82.188 1.00 0.00 O ATOM 70074 H1 WAT 5099 63.488 80.723 81.525 1.00 0.00 H ATOM 70075 H2 WAT 5099 63.663 80.478 83.008 1.00 0.00 H TER 70077 WAT 5099 ATOM 70077 O WAT 5100 47.883 106.599 73.133 1.00 0.00 O ATOM 70078 H1 WAT 5100 48.017 106.608 72.185 1.00 0.00 H ATOM 70079 H2 WAT 5100 47.934 105.674 73.373 1.00 0.00 H TER 70081 WAT 5100 ATOM 70081 O WAT 5101 75.627 49.564 102.426 1.00 0.00 O ATOM 70082 H1 WAT 5101 75.165 50.386 102.589 1.00 0.00 H ATOM 70083 H2 WAT 5101 76.395 49.818 101.914 1.00 0.00 H TER 70085 WAT 5101 ATOM 70085 O WAT 5102 56.924 20.257 12.927 1.00 0.00 O ATOM 70086 H1 WAT 5102 57.262 21.137 12.761 1.00 0.00 H ATOM 70087 H2 WAT 5102 56.237 20.384 13.581 1.00 0.00 H TER 70089 WAT 5102 ATOM 70089 O WAT 5103 23.922 101.976 123.873 1.00 0.00 O ATOM 70090 H1 WAT 5103 24.644 102.439 123.447 1.00 0.00 H ATOM 70091 H2 WAT 5103 23.211 101.999 123.232 1.00 0.00 H TER 70093 WAT 5103 ATOM 70093 O WAT 5104 66.716 116.648 49.092 1.00 0.00 O ATOM 70094 H1 WAT 5104 67.283 115.884 49.198 1.00 0.00 H ATOM 70095 H2 WAT 5104 66.938 117.216 49.829 1.00 0.00 H TER 70097 WAT 5104 ATOM 70097 O WAT 5105 132.375 43.584 140.506 1.00 0.00 O ATOM 70098 H1 WAT 5105 131.763 44.037 139.926 1.00 0.00 H ATOM 70099 H2 WAT 5105 132.122 42.662 140.446 1.00 0.00 H TER 70101 WAT 5105 ATOM 70101 O WAT 5106 55.957 121.111 145.629 1.00 0.00 O ATOM 70102 H1 WAT 5106 55.601 121.122 144.740 1.00 0.00 H ATOM 70103 H2 WAT 5106 56.222 122.016 145.792 1.00 0.00 H TER 70105 WAT 5106 ATOM 70105 O WAT 5107 142.645 24.628 86.330 1.00 0.00 O ATOM 70106 H1 WAT 5107 142.714 24.791 85.389 1.00 0.00 H ATOM 70107 H2 WAT 5107 143.174 25.318 86.731 1.00 0.00 H TER 70109 WAT 5107 ATOM 70109 O WAT 5108 15.526 105.279 1.297 1.00 0.00 O ATOM 70110 H1 WAT 5108 16.188 105.239 0.607 1.00 0.00 H ATOM 70111 H2 WAT 5108 14.882 105.910 0.975 1.00 0.00 H TER 70113 WAT 5108 ATOM 70113 O WAT 5109 84.143 109.659 16.617 1.00 0.00 O ATOM 70114 H1 WAT 5109 84.694 110.184 17.198 1.00 0.00 H ATOM 70115 H2 WAT 5109 83.429 109.353 17.176 1.00 0.00 H TER 70117 WAT 5109 ATOM 70117 O WAT 5110 91.981 91.748 146.683 1.00 0.00 O ATOM 70118 H1 WAT 5110 92.794 91.850 147.178 1.00 0.00 H ATOM 70119 H2 WAT 5110 92.250 91.332 145.864 1.00 0.00 H TER 70121 WAT 5110 ATOM 70121 O WAT 5111 -0.075 100.353 124.803 1.00 0.00 O ATOM 70122 H1 WAT 5111 0.610 99.686 124.775 1.00 0.00 H ATOM 70123 H2 WAT 5111 0.324 101.087 125.269 1.00 0.00 H TER 70125 WAT 5111 ATOM 70125 O WAT 5112 143.604 15.540 72.361 1.00 0.00 O ATOM 70126 H1 WAT 5112 143.613 15.842 73.269 1.00 0.00 H ATOM 70127 H2 WAT 5112 142.688 15.322 72.190 1.00 0.00 H TER 70129 WAT 5112 ATOM 70129 O WAT 5113 122.840 62.545 67.242 1.00 0.00 O ATOM 70130 H1 WAT 5113 122.257 61.887 66.863 1.00 0.00 H ATOM 70131 H2 WAT 5113 123.071 63.112 66.507 1.00 0.00 H TER 70133 WAT 5113 ATOM 70133 O WAT 5114 81.158 130.115 4.662 1.00 0.00 O ATOM 70134 H1 WAT 5114 80.871 129.246 4.943 1.00 0.00 H ATOM 70135 H2 WAT 5114 82.005 129.963 4.242 1.00 0.00 H TER 70137 WAT 5114 ATOM 70137 O WAT 5115 52.045 134.659 17.821 1.00 0.00 O ATOM 70138 H1 WAT 5115 52.635 133.906 17.775 1.00 0.00 H ATOM 70139 H2 WAT 5115 51.168 134.279 17.775 1.00 0.00 H TER 70141 WAT 5115 ATOM 70141 O WAT 5116 24.889 83.383 121.614 1.00 0.00 O ATOM 70142 H1 WAT 5116 23.969 83.173 121.773 1.00 0.00 H ATOM 70143 H2 WAT 5116 24.953 84.323 121.783 1.00 0.00 H TER 70145 WAT 5116 ATOM 70145 O WAT 5117 111.028 102.282 113.275 1.00 0.00 O ATOM 70146 H1 WAT 5117 111.448 103.055 112.898 1.00 0.00 H ATOM 70147 H2 WAT 5117 110.369 102.028 112.629 1.00 0.00 H TER 70149 WAT 5117 ATOM 70149 O WAT 5118 67.043 31.749 145.109 1.00 0.00 O ATOM 70150 H1 WAT 5118 67.679 31.349 145.702 1.00 0.00 H ATOM 70151 H2 WAT 5118 67.118 32.689 145.276 1.00 0.00 H TER 70153 WAT 5118 ATOM 70153 O WAT 5119 49.891 82.739 141.048 1.00 0.00 O ATOM 70154 H1 WAT 5119 49.180 82.850 141.679 1.00 0.00 H ATOM 70155 H2 WAT 5119 49.460 82.773 140.194 1.00 0.00 H TER 70157 WAT 5119 ATOM 70157 O WAT 5120 110.616 50.255 103.076 1.00 0.00 O ATOM 70158 H1 WAT 5120 110.819 49.906 102.207 1.00 0.00 H ATOM 70159 H2 WAT 5120 109.724 50.592 102.997 1.00 0.00 H TER 70161 WAT 5120 ATOM 70161 O WAT 5121 26.894 46.576 19.103 1.00 0.00 O ATOM 70162 H1 WAT 5121 26.825 46.513 18.150 1.00 0.00 H ATOM 70163 H2 WAT 5121 26.141 47.107 19.363 1.00 0.00 H TER 70165 WAT 5121 ATOM 70165 O WAT 5122 122.958 89.792 151.842 1.00 0.00 O ATOM 70166 H1 WAT 5122 123.298 89.023 152.299 1.00 0.00 H ATOM 70167 H2 WAT 5122 123.590 89.951 151.140 1.00 0.00 H TER 70169 WAT 5122 ATOM 70169 O WAT 5123 83.268 129.545 86.168 1.00 0.00 O ATOM 70170 H1 WAT 5123 82.814 129.434 87.003 1.00 0.00 H ATOM 70171 H2 WAT 5123 82.778 128.998 85.554 1.00 0.00 H TER 70173 WAT 5123 ATOM 70173 O WAT 5124 82.040 130.424 150.415 1.00 0.00 O ATOM 70174 H1 WAT 5124 81.173 130.071 150.612 1.00 0.00 H ATOM 70175 H2 WAT 5124 82.562 129.658 150.176 1.00 0.00 H TER 70177 WAT 5124 ATOM 70177 O WAT 5125 105.454 97.296 59.213 1.00 0.00 O ATOM 70178 H1 WAT 5125 105.042 97.697 59.978 1.00 0.00 H ATOM 70179 H2 WAT 5125 105.624 98.029 58.621 1.00 0.00 H TER 70181 WAT 5125 ATOM 70181 O WAT 5126 87.619 103.978 124.003 1.00 0.00 O ATOM 70182 H1 WAT 5126 88.562 104.001 124.166 1.00 0.00 H ATOM 70183 H2 WAT 5126 87.535 103.587 123.134 1.00 0.00 H TER 70185 WAT 5126 ATOM 70185 O WAT 5127 47.794 97.937 93.335 1.00 0.00 O ATOM 70186 H1 WAT 5127 47.565 97.077 92.984 1.00 0.00 H ATOM 70187 H2 WAT 5127 46.953 98.337 93.557 1.00 0.00 H TER 70189 WAT 5127 ATOM 70189 O WAT 5128 89.255 107.956 122.795 1.00 0.00 O ATOM 70190 H1 WAT 5128 89.541 107.044 122.730 1.00 0.00 H ATOM 70191 H2 WAT 5128 90.059 108.466 122.695 1.00 0.00 H TER 70193 WAT 5128 ATOM 70193 O WAT 5129 27.807 60.455 55.238 1.00 0.00 O ATOM 70194 H1 WAT 5129 28.550 59.883 55.048 1.00 0.00 H ATOM 70195 H2 WAT 5129 27.252 59.941 55.825 1.00 0.00 H TER 70197 WAT 5129 ATOM 70197 O WAT 5130 44.739 123.502 70.871 1.00 0.00 O ATOM 70198 H1 WAT 5130 45.630 123.827 70.996 1.00 0.00 H ATOM 70199 H2 WAT 5130 44.546 123.016 71.673 1.00 0.00 H TER 70201 WAT 5130 ATOM 70201 O WAT 5131 32.422 60.250 63.046 1.00 0.00 O ATOM 70202 H1 WAT 5131 31.688 60.851 63.178 1.00 0.00 H ATOM 70203 H2 WAT 5131 32.279 59.885 62.173 1.00 0.00 H TER 70205 WAT 5131 ATOM 70205 O WAT 5132 48.249 131.403 127.874 1.00 0.00 O ATOM 70206 H1 WAT 5132 48.325 131.613 126.943 1.00 0.00 H ATOM 70207 H2 WAT 5132 48.664 130.545 127.961 1.00 0.00 H TER 70209 WAT 5132 ATOM 70209 O WAT 5133 74.790 97.169 12.553 1.00 0.00 O ATOM 70210 H1 WAT 5133 73.945 97.065 12.990 1.00 0.00 H ATOM 70211 H2 WAT 5133 75.418 97.276 13.267 1.00 0.00 H TER 70213 WAT 5133 ATOM 70213 O WAT 5134 62.732 49.938 126.994 1.00 0.00 O ATOM 70214 H1 WAT 5134 62.844 49.865 126.046 1.00 0.00 H ATOM 70215 H2 WAT 5134 62.229 50.743 127.115 1.00 0.00 H TER 70217 WAT 5134 ATOM 70217 O WAT 5135 75.944 67.047 26.619 1.00 0.00 O ATOM 70218 H1 WAT 5135 75.601 67.940 26.590 1.00 0.00 H ATOM 70219 H2 WAT 5135 75.615 66.637 25.819 1.00 0.00 H TER 70221 WAT 5135 ATOM 70221 O WAT 5136 101.907 10.110 133.621 1.00 0.00 O ATOM 70222 H1 WAT 5136 101.934 9.415 132.963 1.00 0.00 H ATOM 70223 H2 WAT 5136 101.437 9.723 134.359 1.00 0.00 H TER 70225 WAT 5136 ATOM 70225 O WAT 5137 48.954 23.216 135.778 1.00 0.00 O ATOM 70226 H1 WAT 5137 49.489 22.678 135.194 1.00 0.00 H ATOM 70227 H2 WAT 5137 48.696 22.621 136.482 1.00 0.00 H TER 70229 WAT 5137 ATOM 70229 O WAT 5138 60.597 83.328 136.872 1.00 0.00 O ATOM 70230 H1 WAT 5138 60.388 83.364 135.938 1.00 0.00 H ATOM 70231 H2 WAT 5138 61.076 82.506 136.978 1.00 0.00 H TER 70233 WAT 5138 ATOM 70233 O WAT 5139 134.581 39.537 111.790 1.00 0.00 O ATOM 70234 H1 WAT 5139 134.579 39.412 110.841 1.00 0.00 H ATOM 70235 H2 WAT 5139 134.359 38.677 112.146 1.00 0.00 H TER 70237 WAT 5139 ATOM 70237 O WAT 5140 93.856 55.124 12.109 1.00 0.00 O ATOM 70238 H1 WAT 5140 94.051 54.209 12.309 1.00 0.00 H ATOM 70239 H2 WAT 5140 93.649 55.516 12.958 1.00 0.00 H TER 70241 WAT 5140 ATOM 70241 O WAT 5141 32.941 7.692 150.899 1.00 0.00 O ATOM 70242 H1 WAT 5141 33.358 6.949 150.463 1.00 0.00 H ATOM 70243 H2 WAT 5141 32.482 8.155 150.199 1.00 0.00 H TER 70245 WAT 5141 ATOM 70245 O WAT 5142 30.313 125.996 142.440 1.00 0.00 O ATOM 70246 H1 WAT 5142 31.187 126.179 142.093 1.00 0.00 H ATOM 70247 H2 WAT 5142 30.422 125.195 142.952 1.00 0.00 H TER 70249 WAT 5142 ATOM 70249 O WAT 5143 98.479 116.336 67.578 1.00 0.00 O ATOM 70250 H1 WAT 5143 97.729 116.419 66.989 1.00 0.00 H ATOM 70251 H2 WAT 5143 98.586 115.393 67.698 1.00 0.00 H TER 70253 WAT 5143 ATOM 70253 O WAT 5144 126.879 93.036 125.231 1.00 0.00 O ATOM 70254 H1 WAT 5144 127.760 92.901 125.580 1.00 0.00 H ATOM 70255 H2 WAT 5144 126.374 92.293 125.561 1.00 0.00 H TER 70257 WAT 5144 ATOM 70257 O WAT 5145 110.371 73.850 142.715 1.00 0.00 O ATOM 70258 H1 WAT 5145 110.240 73.809 143.662 1.00 0.00 H ATOM 70259 H2 WAT 5145 111.306 73.683 142.594 1.00 0.00 H TER 70261 WAT 5145 ATOM 70261 O WAT 5146 33.236 4.124 79.518 1.00 0.00 O ATOM 70262 H1 WAT 5146 32.907 3.692 78.729 1.00 0.00 H ATOM 70263 H2 WAT 5146 33.985 4.636 79.215 1.00 0.00 H TER 70265 WAT 5146 ATOM 70265 O WAT 5147 34.948 124.041 69.539 1.00 0.00 O ATOM 70266 H1 WAT 5147 35.577 123.868 68.839 1.00 0.00 H ATOM 70267 H2 WAT 5147 34.411 124.760 69.206 1.00 0.00 H TER 70269 WAT 5147 ATOM 70269 O WAT 5148 69.016 66.486 110.388 1.00 0.00 O ATOM 70270 H1 WAT 5148 68.154 66.378 110.789 1.00 0.00 H ATOM 70271 H2 WAT 5148 68.833 66.841 109.518 1.00 0.00 H TER 70273 WAT 5148 ATOM 70273 O WAT 5149 64.086 116.163 123.885 1.00 0.00 O ATOM 70274 H1 WAT 5149 63.157 116.338 124.036 1.00 0.00 H ATOM 70275 H2 WAT 5149 64.381 116.890 123.338 1.00 0.00 H TER 70277 WAT 5149 ATOM 70277 O WAT 5150 12.666 140.722 155.737 1.00 0.00 O ATOM 70278 H1 WAT 5150 12.643 141.147 154.880 1.00 0.00 H ATOM 70279 H2 WAT 5150 13.530 140.937 156.087 1.00 0.00 H TER 70281 WAT 5150 ATOM 70281 O WAT 5151 59.591 69.325 10.978 1.00 0.00 O ATOM 70282 H1 WAT 5151 59.228 68.496 11.289 1.00 0.00 H ATOM 70283 H2 WAT 5151 60.511 69.132 10.798 1.00 0.00 H TER 70285 WAT 5151 ATOM 70285 O WAT 5152 117.175 54.547 136.062 1.00 0.00 O ATOM 70286 H1 WAT 5152 117.320 53.697 136.479 1.00 0.00 H ATOM 70287 H2 WAT 5152 117.154 55.170 136.789 1.00 0.00 H TER 70289 WAT 5152 ATOM 70289 O WAT 5153 130.873 73.088 78.878 1.00 0.00 O ATOM 70290 H1 WAT 5153 131.162 72.461 79.540 1.00 0.00 H ATOM 70291 H2 WAT 5153 131.550 73.052 78.202 1.00 0.00 H TER 70293 WAT 5153 ATOM 70293 O WAT 5154 30.517 60.833 91.799 1.00 0.00 O ATOM 70294 H1 WAT 5154 30.415 60.712 90.856 1.00 0.00 H ATOM 70295 H2 WAT 5154 31.276 61.410 91.886 1.00 0.00 H TER 70297 WAT 5154 ATOM 70297 O WAT 5155 38.571 46.935 2.280 1.00 0.00 O ATOM 70298 H1 WAT 5155 38.340 47.814 1.979 1.00 0.00 H ATOM 70299 H2 WAT 5155 39.235 46.636 1.659 1.00 0.00 H TER 70301 WAT 5155 ATOM 70301 O WAT 5156 11.382 39.903 106.901 1.00 0.00 O ATOM 70302 H1 WAT 5156 10.767 39.197 107.100 1.00 0.00 H ATOM 70303 H2 WAT 5156 10.899 40.484 106.314 1.00 0.00 H TER 70305 WAT 5156 ATOM 70305 O WAT 5157 131.430 44.057 128.187 1.00 0.00 O ATOM 70306 H1 WAT 5157 131.149 44.479 128.999 1.00 0.00 H ATOM 70307 H2 WAT 5157 130.626 43.701 127.810 1.00 0.00 H TER 70309 WAT 5157 ATOM 70309 O WAT 5158 8.761 86.783 121.118 1.00 0.00 O ATOM 70310 H1 WAT 5158 9.641 86.406 121.089 1.00 0.00 H ATOM 70311 H2 WAT 5158 8.852 87.638 120.698 1.00 0.00 H TER 70313 WAT 5158 ATOM 70313 O WAT 5159 22.836 77.139 102.766 1.00 0.00 O ATOM 70314 H1 WAT 5159 22.655 76.781 103.636 1.00 0.00 H ATOM 70315 H2 WAT 5159 23.191 76.400 102.272 1.00 0.00 H TER 70317 WAT 5159 ATOM 70317 O WAT 5160 81.748 87.350 155.567 1.00 0.00 O ATOM 70318 H1 WAT 5160 81.221 86.627 155.227 1.00 0.00 H ATOM 70319 H2 WAT 5160 82.153 86.999 156.360 1.00 0.00 H TER 70321 WAT 5160 ATOM 70321 O WAT 5161 64.499 110.840 144.382 1.00 0.00 O ATOM 70322 H1 WAT 5161 64.436 111.383 143.596 1.00 0.00 H ATOM 70323 H2 WAT 5161 63.686 110.336 144.391 1.00 0.00 H TER 70325 WAT 5161 ATOM 70325 O WAT 5162 56.710 117.501 83.243 1.00 0.00 O ATOM 70326 H1 WAT 5162 56.219 116.933 82.650 1.00 0.00 H ATOM 70327 H2 WAT 5162 57.399 116.939 83.598 1.00 0.00 H TER 70329 WAT 5162 ATOM 70329 O WAT 5163 25.862 105.818 18.500 1.00 0.00 O ATOM 70330 H1 WAT 5163 25.421 106.265 17.778 1.00 0.00 H ATOM 70331 H2 WAT 5163 25.206 105.784 19.197 1.00 0.00 H TER 70333 WAT 5163 ATOM 70333 O WAT 5164 39.075 141.827 146.363 1.00 0.00 O ATOM 70334 H1 WAT 5164 39.857 142.308 146.094 1.00 0.00 H ATOM 70335 H2 WAT 5164 39.327 140.906 146.302 1.00 0.00 H TER 70337 WAT 5164 ATOM 70337 O WAT 5165 106.372 18.171 112.501 1.00 0.00 O ATOM 70338 H1 WAT 5165 107.260 17.882 112.292 1.00 0.00 H ATOM 70339 H2 WAT 5165 106.489 18.838 113.177 1.00 0.00 H TER 70341 WAT 5165 ATOM 70341 O WAT 5166 116.996 125.045 120.945 1.00 0.00 O ATOM 70342 H1 WAT 5166 117.620 125.542 121.474 1.00 0.00 H ATOM 70343 H2 WAT 5166 116.348 125.693 120.666 1.00 0.00 H TER 70345 WAT 5166 ATOM 70345 O WAT 5167 46.577 36.208 77.003 1.00 0.00 O ATOM 70346 H1 WAT 5167 46.805 36.710 76.221 1.00 0.00 H ATOM 70347 H2 WAT 5167 47.401 35.806 77.278 1.00 0.00 H TER 70349 WAT 5167 ATOM 70349 O WAT 5168 102.134 62.661 128.319 1.00 0.00 O ATOM 70350 H1 WAT 5168 101.322 62.831 127.841 1.00 0.00 H ATOM 70351 H2 WAT 5168 102.766 63.275 127.945 1.00 0.00 H TER 70353 WAT 5168 ATOM 70353 O WAT 5169 126.493 81.737 100.918 1.00 0.00 O ATOM 70354 H1 WAT 5169 125.725 81.292 100.561 1.00 0.00 H ATOM 70355 H2 WAT 5169 126.443 82.625 100.562 1.00 0.00 H TER 70357 WAT 5169 ATOM 70357 O WAT 5170 48.159 145.495 99.927 1.00 0.00 O ATOM 70358 H1 WAT 5170 47.284 145.863 99.805 1.00 0.00 H ATOM 70359 H2 WAT 5170 48.295 145.507 100.874 1.00 0.00 H TER 70361 WAT 5170 ATOM 70361 O WAT 5171 78.266 98.585 83.422 1.00 0.00 O ATOM 70362 H1 WAT 5171 77.717 97.815 83.274 1.00 0.00 H ATOM 70363 H2 WAT 5171 79.163 98.252 83.379 1.00 0.00 H TER 70365 WAT 5171 ATOM 70365 O WAT 5172 135.487 52.890 123.620 1.00 0.00 O ATOM 70366 H1 WAT 5172 134.686 52.762 124.129 1.00 0.00 H ATOM 70367 H2 WAT 5172 135.983 52.082 123.746 1.00 0.00 H TER 70369 WAT 5172 ATOM 70369 O WAT 5173 90.192 107.513 88.058 1.00 0.00 O ATOM 70370 H1 WAT 5173 90.196 108.370 88.485 1.00 0.00 H ATOM 70371 H2 WAT 5173 90.396 106.894 88.759 1.00 0.00 H TER 70373 WAT 5173 ATOM 70373 O WAT 5174 9.131 75.813 139.359 1.00 0.00 O ATOM 70374 H1 WAT 5174 8.659 76.585 139.048 1.00 0.00 H ATOM 70375 H2 WAT 5174 8.621 75.505 140.108 1.00 0.00 H TER 70377 WAT 5174 ATOM 70377 O WAT 5175 97.883 59.324 101.128 1.00 0.00 O ATOM 70378 H1 WAT 5175 98.495 59.762 101.719 1.00 0.00 H ATOM 70379 H2 WAT 5175 97.020 59.635 101.403 1.00 0.00 H TER 70381 WAT 5175 ATOM 70381 O WAT 5176 124.598 105.658 154.526 1.00 0.00 O ATOM 70382 H1 WAT 5176 125.010 104.803 154.647 1.00 0.00 H ATOM 70383 H2 WAT 5176 125.091 106.245 155.099 1.00 0.00 H TER 70385 WAT 5176 ATOM 70385 O WAT 5177 43.444 129.106 75.061 1.00 0.00 O ATOM 70386 H1 WAT 5177 43.184 128.187 75.130 1.00 0.00 H ATOM 70387 H2 WAT 5177 44.304 129.081 74.642 1.00 0.00 H TER 70389 WAT 5177 ATOM 70389 O WAT 5178 65.763 105.682 71.014 1.00 0.00 O ATOM 70390 H1 WAT 5178 65.348 105.166 70.322 1.00 0.00 H ATOM 70391 H2 WAT 5178 66.607 105.253 71.158 1.00 0.00 H TER 70393 WAT 5178 ATOM 70393 O WAT 5179 66.629 83.566 140.721 1.00 0.00 O ATOM 70394 H1 WAT 5179 65.912 84.157 140.489 1.00 0.00 H ATOM 70395 H2 WAT 5179 66.561 82.849 140.091 1.00 0.00 H TER 70397 WAT 5179 ATOM 70397 O WAT 5180 27.090 89.597 142.405 1.00 0.00 O ATOM 70398 H1 WAT 5180 26.549 89.566 141.617 1.00 0.00 H ATOM 70399 H2 WAT 5180 27.913 89.992 142.116 1.00 0.00 H TER 70401 WAT 5180 ATOM 70401 O WAT 5181 119.521 28.838 6.173 1.00 0.00 O ATOM 70402 H1 WAT 5181 118.697 28.924 5.694 1.00 0.00 H ATOM 70403 H2 WAT 5181 119.303 29.087 7.071 1.00 0.00 H TER 70405 WAT 5181 ATOM 70405 O WAT 5182 28.563 47.381 72.591 1.00 0.00 O ATOM 70406 H1 WAT 5182 28.959 47.648 73.420 1.00 0.00 H ATOM 70407 H2 WAT 5182 28.310 48.202 72.170 1.00 0.00 H TER 70409 WAT 5182 ATOM 70409 O WAT 5183 56.414 50.245 125.247 1.00 0.00 O ATOM 70410 H1 WAT 5183 57.253 49.940 125.594 1.00 0.00 H ATOM 70411 H2 WAT 5183 55.978 50.649 125.997 1.00 0.00 H TER 70413 WAT 5183 ATOM 70413 O WAT 5184 4.781 125.071 146.223 1.00 0.00 O ATOM 70414 H1 WAT 5184 3.883 124.810 146.426 1.00 0.00 H ATOM 70415 H2 WAT 5184 5.283 124.821 146.999 1.00 0.00 H TER 70417 WAT 5184 ATOM 70417 O WAT 5185 98.469 23.343 58.549 1.00 0.00 O ATOM 70418 H1 WAT 5185 99.297 23.821 58.610 1.00 0.00 H ATOM 70419 H2 WAT 5185 98.223 23.174 59.458 1.00 0.00 H TER 70421 WAT 5185 ATOM 70421 O WAT 5186 125.557 102.720 151.807 1.00 0.00 O ATOM 70422 H1 WAT 5186 124.982 101.960 151.711 1.00 0.00 H ATOM 70423 H2 WAT 5186 126.373 102.458 151.381 1.00 0.00 H TER 70425 WAT 5186 ATOM 70425 O WAT 5187 7.707 19.427 89.885 1.00 0.00 O ATOM 70426 H1 WAT 5187 7.641 20.380 89.823 1.00 0.00 H ATOM 70427 H2 WAT 5187 6.902 19.160 90.329 1.00 0.00 H TER 70429 WAT 5187 ATOM 70429 O WAT 5188 81.208 29.218 66.587 1.00 0.00 O ATOM 70430 H1 WAT 5188 80.354 28.787 66.593 1.00 0.00 H ATOM 70431 H2 WAT 5188 81.617 28.953 67.411 1.00 0.00 H TER 70433 WAT 5188 ATOM 70433 O WAT 5189 31.942 31.935 135.783 1.00 0.00 O ATOM 70434 H1 WAT 5189 31.624 32.531 136.462 1.00 0.00 H ATOM 70435 H2 WAT 5189 31.604 31.077 136.041 1.00 0.00 H TER 70437 WAT 5189 ATOM 70437 O WAT 5190 69.221 31.695 84.564 1.00 0.00 O ATOM 70438 H1 WAT 5190 69.515 32.076 85.392 1.00 0.00 H ATOM 70439 H2 WAT 5190 69.014 30.786 84.780 1.00 0.00 H TER 70441 WAT 5190 ATOM 70441 O WAT 5191 52.287 30.375 7.516 1.00 0.00 O ATOM 70442 H1 WAT 5191 51.916 29.492 7.527 1.00 0.00 H ATOM 70443 H2 WAT 5191 51.540 30.945 7.332 1.00 0.00 H TER 70445 WAT 5191 ATOM 70445 O WAT 5192 33.680 6.259 143.617 1.00 0.00 O ATOM 70446 H1 WAT 5192 33.660 7.110 144.055 1.00 0.00 H ATOM 70447 H2 WAT 5192 32.763 6.076 143.410 1.00 0.00 H TER 70449 WAT 5192 ATOM 70449 O WAT 5193 132.731 136.840 146.992 1.00 0.00 O ATOM 70450 H1 WAT 5193 133.544 136.346 147.094 1.00 0.00 H ATOM 70451 H2 WAT 5193 132.670 137.367 147.788 1.00 0.00 H TER 70453 WAT 5193 ATOM 70453 O WAT 5194 83.615 6.106 71.423 1.00 0.00 O ATOM 70454 H1 WAT 5194 83.463 6.012 70.482 1.00 0.00 H ATOM 70455 H2 WAT 5194 82.878 5.652 71.831 1.00 0.00 H TER 70457 WAT 5194 ATOM 70457 O WAT 5195 19.682 91.800 66.183 1.00 0.00 O ATOM 70458 H1 WAT 5195 19.026 92.233 65.636 1.00 0.00 H ATOM 70459 H2 WAT 5195 19.228 91.626 67.007 1.00 0.00 H TER 70461 WAT 5195 ATOM 70461 O WAT 5196 15.528 29.471 0.299 1.00 0.00 O ATOM 70462 H1 WAT 5196 15.466 29.628 -0.643 1.00 0.00 H ATOM 70463 H2 WAT 5196 15.492 30.343 0.691 1.00 0.00 H TER 70465 WAT 5196 ATOM 70465 O WAT 5197 135.220 61.136 130.347 1.00 0.00 O ATOM 70466 H1 WAT 5197 135.806 60.916 131.070 1.00 0.00 H ATOM 70467 H2 WAT 5197 135.274 62.089 130.276 1.00 0.00 H TER 70469 WAT 5197 ATOM 70469 O WAT 5198 89.318 107.027 71.947 1.00 0.00 O ATOM 70470 H1 WAT 5198 89.804 107.832 72.123 1.00 0.00 H ATOM 70471 H2 WAT 5198 88.784 107.232 71.180 1.00 0.00 H TER 70473 WAT 5198 ATOM 70473 O WAT 5199 133.564 106.114 106.085 1.00 0.00 O ATOM 70474 H1 WAT 5199 132.973 106.571 106.684 1.00 0.00 H ATOM 70475 H2 WAT 5199 134.384 106.036 106.572 1.00 0.00 H TER 70477 WAT 5199 ATOM 70477 O WAT 5200 47.259 104.006 1.052 1.00 0.00 O ATOM 70478 H1 WAT 5200 48.081 103.524 0.957 1.00 0.00 H ATOM 70479 H2 WAT 5200 46.612 103.337 1.273 1.00 0.00 H TER 70481 WAT 5200 ATOM 70481 O WAT 5201 15.466 27.622 136.183 1.00 0.00 O ATOM 70482 H1 WAT 5201 16.112 27.401 136.854 1.00 0.00 H ATOM 70483 H2 WAT 5201 15.660 27.028 135.458 1.00 0.00 H TER 70485 WAT 5201 ATOM 70485 O WAT 5202 18.157 127.157 11.248 1.00 0.00 O ATOM 70486 H1 WAT 5202 18.468 127.484 10.404 1.00 0.00 H ATOM 70487 H2 WAT 5202 18.877 127.334 11.853 1.00 0.00 H TER 70489 WAT 5202 ATOM 70489 O WAT 5203 132.713 24.502 0.799 1.00 0.00 O ATOM 70490 H1 WAT 5203 132.377 23.606 0.778 1.00 0.00 H ATOM 70491 H2 WAT 5203 131.937 25.046 0.935 1.00 0.00 H TER 70493 WAT 5203 ATOM 70493 O WAT 5204 68.149 1.098 124.441 1.00 0.00 O ATOM 70494 H1 WAT 5204 67.974 1.991 124.738 1.00 0.00 H ATOM 70495 H2 WAT 5204 67.822 1.077 123.541 1.00 0.00 H TER 70497 WAT 5204 ATOM 70497 O WAT 5205 139.990 132.578 154.882 1.00 0.00 O ATOM 70498 H1 WAT 5205 139.233 132.537 154.298 1.00 0.00 H ATOM 70499 H2 WAT 5205 140.289 133.485 154.824 1.00 0.00 H TER 70501 WAT 5205 ATOM 70501 O WAT 5206 63.110 17.441 19.609 1.00 0.00 O ATOM 70502 H1 WAT 5206 62.435 17.075 19.036 1.00 0.00 H ATOM 70503 H2 WAT 5206 62.714 17.433 20.481 1.00 0.00 H TER 70505 WAT 5206 ATOM 70505 O WAT 5207 11.682 137.855 6.454 1.00 0.00 O ATOM 70506 H1 WAT 5207 12.408 137.246 6.316 1.00 0.00 H ATOM 70507 H2 WAT 5207 11.976 138.672 6.051 1.00 0.00 H TER 70509 WAT 5207 ATOM 70509 O WAT 5208 18.339 129.675 119.484 1.00 0.00 O ATOM 70510 H1 WAT 5208 18.142 129.774 118.553 1.00 0.00 H ATOM 70511 H2 WAT 5208 18.080 130.510 119.874 1.00 0.00 H TER 70513 WAT 5208 ATOM 70513 O WAT 5209 73.037 47.806 109.564 1.00 0.00 O ATOM 70514 H1 WAT 5209 73.752 48.133 110.110 1.00 0.00 H ATOM 70515 H2 WAT 5209 73.079 48.339 108.770 1.00 0.00 H TER 70517 WAT 5209 ATOM 70517 O WAT 5210 74.666 100.780 115.274 1.00 0.00 O ATOM 70518 H1 WAT 5210 74.848 100.997 116.189 1.00 0.00 H ATOM 70519 H2 WAT 5210 73.833 101.212 115.086 1.00 0.00 H TER 70521 WAT 5210 ATOM 70521 O WAT 5211 73.717 36.404 68.117 1.00 0.00 O ATOM 70522 H1 WAT 5211 74.265 35.624 68.030 1.00 0.00 H ATOM 70523 H2 WAT 5211 74.317 37.086 68.419 1.00 0.00 H TER 70525 WAT 5211 ATOM 70525 O WAT 5212 1.087 52.059 17.720 1.00 0.00 O ATOM 70526 H1 WAT 5212 1.390 51.469 18.411 1.00 0.00 H ATOM 70527 H2 WAT 5212 1.384 52.925 17.997 1.00 0.00 H TER 70529 WAT 5212 ATOM 70529 O WAT 5213 135.173 143.201 72.848 1.00 0.00 O ATOM 70530 H1 WAT 5213 135.975 142.997 72.367 1.00 0.00 H ATOM 70531 H2 WAT 5213 135.014 144.127 72.665 1.00 0.00 H TER 70533 WAT 5213 ATOM 70533 O WAT 5214 143.184 99.043 129.087 1.00 0.00 O ATOM 70534 H1 WAT 5214 143.782 99.169 129.824 1.00 0.00 H ATOM 70535 H2 WAT 5214 143.730 99.173 128.312 1.00 0.00 H TER 70537 WAT 5214 ATOM 70537 O WAT 5215 141.584 89.972 135.155 1.00 0.00 O ATOM 70538 H1 WAT 5215 141.943 90.726 135.622 1.00 0.00 H ATOM 70539 H2 WAT 5215 141.516 89.287 135.820 1.00 0.00 H TER 70541 WAT 5215 ATOM 70541 O WAT 5216 62.474 107.494 73.736 1.00 0.00 O ATOM 70542 H1 WAT 5216 63.148 106.850 73.520 1.00 0.00 H ATOM 70543 H2 WAT 5216 61.851 107.014 74.282 1.00 0.00 H TER 70545 WAT 5216 ATOM 70545 O WAT 5217 145.587 10.543 74.235 1.00 0.00 O ATOM 70546 H1 WAT 5217 146.037 11.352 73.993 1.00 0.00 H ATOM 70547 H2 WAT 5217 144.700 10.821 74.460 1.00 0.00 H TER 70549 WAT 5217 ATOM 70549 O WAT 5218 68.392 84.640 123.527 1.00 0.00 O ATOM 70550 H1 WAT 5218 68.556 83.893 122.952 1.00 0.00 H ATOM 70551 H2 WAT 5218 67.636 84.377 124.052 1.00 0.00 H TER 70553 WAT 5218 ATOM 70553 O WAT 5219 98.633 56.703 114.763 1.00 0.00 O ATOM 70554 H1 WAT 5219 99.570 56.711 114.961 1.00 0.00 H ATOM 70555 H2 WAT 5219 98.416 55.775 114.673 1.00 0.00 H TER 70557 WAT 5219 ATOM 70557 O WAT 5220 53.562 88.381 154.467 1.00 0.00 O ATOM 70558 H1 WAT 5220 53.509 89.159 155.021 1.00 0.00 H ATOM 70559 H2 WAT 5220 54.329 87.908 154.791 1.00 0.00 H TER 70561 WAT 5220 ATOM 70561 O WAT 5221 21.132 57.436 1.421 1.00 0.00 O ATOM 70562 H1 WAT 5221 20.468 58.104 1.596 1.00 0.00 H ATOM 70563 H2 WAT 5221 21.056 57.264 0.482 1.00 0.00 H TER 70565 WAT 5221 ATOM 70565 O WAT 5222 92.236 40.086 96.865 1.00 0.00 O ATOM 70566 H1 WAT 5222 92.950 39.639 96.410 1.00 0.00 H ATOM 70567 H2 WAT 5222 92.607 40.932 97.118 1.00 0.00 H TER 70569 WAT 5222 ATOM 70569 O WAT 5223 108.219 109.054 17.154 1.00 0.00 O ATOM 70570 H1 WAT 5223 109.032 109.405 16.789 1.00 0.00 H ATOM 70571 H2 WAT 5223 107.542 109.324 16.535 1.00 0.00 H TER 70573 WAT 5223 ATOM 70573 O WAT 5224 116.607 109.161 103.115 1.00 0.00 O ATOM 70574 H1 WAT 5224 117.031 109.551 103.879 1.00 0.00 H ATOM 70575 H2 WAT 5224 116.792 108.225 103.190 1.00 0.00 H TER 70577 WAT 5224 ATOM 70577 O WAT 5225 7.681 104.201 152.688 1.00 0.00 O ATOM 70578 H1 WAT 5225 8.195 103.521 152.253 1.00 0.00 H ATOM 70579 H2 WAT 5225 8.149 105.014 152.500 1.00 0.00 H TER 70581 WAT 5225 ATOM 70581 O WAT 5226 6.063 131.473 152.266 1.00 0.00 O ATOM 70582 H1 WAT 5226 5.155 131.342 151.994 1.00 0.00 H ATOM 70583 H2 WAT 5226 6.304 130.653 152.697 1.00 0.00 H TER 70585 WAT 5226 ATOM 70585 O WAT 5227 80.000 139.454 21.351 1.00 0.00 O ATOM 70586 H1 WAT 5227 79.303 139.229 21.967 1.00 0.00 H ATOM 70587 H2 WAT 5227 80.385 138.613 21.106 1.00 0.00 H TER 70589 WAT 5227 ATOM 70589 O WAT 5228 134.851 117.010 106.120 1.00 0.00 O ATOM 70590 H1 WAT 5228 135.579 117.441 106.568 1.00 0.00 H ATOM 70591 H2 WAT 5228 134.857 116.115 106.460 1.00 0.00 H TER 70593 WAT 5228 ATOM 70593 O WAT 5229 70.909 17.662 84.741 1.00 0.00 O ATOM 70594 H1 WAT 5229 71.635 17.041 84.805 1.00 0.00 H ATOM 70595 H2 WAT 5229 71.109 18.185 83.965 1.00 0.00 H TER 70597 WAT 5229 ATOM 70597 O WAT 5230 111.850 114.980 18.485 1.00 0.00 O ATOM 70598 H1 WAT 5230 112.272 115.508 19.162 1.00 0.00 H ATOM 70599 H2 WAT 5230 111.334 115.607 17.979 1.00 0.00 H TER 70601 WAT 5230 ATOM 70601 O WAT 5231 23.410 137.091 82.719 1.00 0.00 O ATOM 70602 H1 WAT 5231 22.738 136.409 82.706 1.00 0.00 H ATOM 70603 H2 WAT 5231 24.026 136.808 83.394 1.00 0.00 H TER 70605 WAT 5231 ATOM 70605 O WAT 5232 97.443 132.831 6.306 1.00 0.00 O ATOM 70606 H1 WAT 5232 97.851 132.033 5.970 1.00 0.00 H ATOM 70607 H2 WAT 5232 96.652 132.937 5.778 1.00 0.00 H TER 70609 WAT 5232 ATOM 70609 O WAT 5233 119.710 27.770 127.958 1.00 0.00 O ATOM 70610 H1 WAT 5233 120.490 28.145 128.367 1.00 0.00 H ATOM 70611 H2 WAT 5233 119.132 28.518 127.810 1.00 0.00 H TER 70613 WAT 5233 ATOM 70613 O WAT 5234 64.039 51.177 0.215 1.00 0.00 O ATOM 70614 H1 WAT 5234 63.191 51.341 0.629 1.00 0.00 H ATOM 70615 H2 WAT 5234 64.661 51.163 0.942 1.00 0.00 H TER 70617 WAT 5234 ATOM 70617 O WAT 5235 124.606 107.599 69.195 1.00 0.00 O ATOM 70618 H1 WAT 5235 124.955 106.969 69.825 1.00 0.00 H ATOM 70619 H2 WAT 5235 125.233 108.322 69.206 1.00 0.00 H TER 70621 WAT 5235 ATOM 70621 O WAT 5236 37.045 18.815 152.211 1.00 0.00 O ATOM 70622 H1 WAT 5236 36.710 19.562 151.715 1.00 0.00 H ATOM 70623 H2 WAT 5236 37.988 18.823 152.048 1.00 0.00 H TER 70625 WAT 5236 ATOM 70625 O WAT 5237 125.007 66.778 135.128 1.00 0.00 O ATOM 70626 H1 WAT 5237 125.455 65.932 135.114 1.00 0.00 H ATOM 70627 H2 WAT 5237 125.226 67.151 135.982 1.00 0.00 H TER 70629 WAT 5237 ATOM 70629 O WAT 5238 42.109 8.090 79.045 1.00 0.00 O ATOM 70630 H1 WAT 5238 42.534 7.331 78.646 1.00 0.00 H ATOM 70631 H2 WAT 5238 42.831 8.672 79.282 1.00 0.00 H TER 70633 WAT 5238 ATOM 70633 O WAT 5239 108.691 14.365 56.784 1.00 0.00 O ATOM 70634 H1 WAT 5239 108.156 15.064 56.407 1.00 0.00 H ATOM 70635 H2 WAT 5239 108.894 13.793 56.044 1.00 0.00 H TER 70637 WAT 5239 ATOM 70637 O WAT 5240 70.821 50.770 137.492 1.00 0.00 O ATOM 70638 H1 WAT 5240 70.280 50.050 137.817 1.00 0.00 H ATOM 70639 H2 WAT 5240 71.721 50.469 137.620 1.00 0.00 H TER 70641 WAT 5240 ATOM 70641 O WAT 5241 50.204 2.371 84.476 1.00 0.00 O ATOM 70642 H1 WAT 5241 51.051 2.659 84.815 1.00 0.00 H ATOM 70643 H2 WAT 5241 50.206 1.422 84.599 1.00 0.00 H TER 70645 WAT 5241 ATOM 70645 O WAT 5242 133.889 112.343 78.513 1.00 0.00 O ATOM 70646 H1 WAT 5242 133.155 112.042 77.978 1.00 0.00 H ATOM 70647 H2 WAT 5242 134.488 111.597 78.540 1.00 0.00 H TER 70649 WAT 5242 ATOM 70649 O WAT 5243 41.470 43.853 97.710 1.00 0.00 O ATOM 70650 H1 WAT 5243 42.351 43.496 97.824 1.00 0.00 H ATOM 70651 H2 WAT 5243 40.914 43.297 98.257 1.00 0.00 H TER 70653 WAT 5243 ATOM 70653 O WAT 5244 9.312 65.424 86.256 1.00 0.00 O ATOM 70654 H1 WAT 5244 8.397 65.470 86.533 1.00 0.00 H ATOM 70655 H2 WAT 5244 9.635 66.321 86.347 1.00 0.00 H TER 70657 WAT 5244 ATOM 70657 O WAT 5245 36.827 58.592 117.696 1.00 0.00 O ATOM 70658 H1 WAT 5245 36.906 59.026 116.846 1.00 0.00 H ATOM 70659 H2 WAT 5245 36.242 57.852 117.533 1.00 0.00 H TER 70661 WAT 5245 ATOM 70661 O WAT 5246 114.342 17.630 89.751 1.00 0.00 O ATOM 70662 H1 WAT 5246 114.212 16.712 89.513 1.00 0.00 H ATOM 70663 H2 WAT 5246 113.621 18.093 89.325 1.00 0.00 H TER 70665 WAT 5246 ATOM 70665 O WAT 5247 20.881 3.816 152.046 1.00 0.00 O ATOM 70666 H1 WAT 5247 21.724 4.244 152.194 1.00 0.00 H ATOM 70667 H2 WAT 5247 21.108 2.952 151.702 1.00 0.00 H TER 70669 WAT 5247 ATOM 70669 O WAT 5248 61.222 80.740 137.769 1.00 0.00 O ATOM 70670 H1 WAT 5248 61.873 80.673 138.467 1.00 0.00 H ATOM 70671 H2 WAT 5248 60.418 80.396 138.157 1.00 0.00 H TER 70673 WAT 5248 ATOM 70673 O WAT 5249 19.868 79.325 69.334 1.00 0.00 O ATOM 70674 H1 WAT 5249 18.980 79.462 69.664 1.00 0.00 H ATOM 70675 H2 WAT 5249 20.194 78.574 69.829 1.00 0.00 H TER 70677 WAT 5249 ATOM 70677 O WAT 5250 63.325 121.906 82.250 1.00 0.00 O ATOM 70678 H1 WAT 5250 63.445 121.030 82.618 1.00 0.00 H ATOM 70679 H2 WAT 5250 62.915 121.755 81.399 1.00 0.00 H TER 70681 WAT 5250 ATOM 70681 O WAT 5251 118.738 16.722 12.693 1.00 0.00 O ATOM 70682 H1 WAT 5251 118.375 16.507 13.553 1.00 0.00 H ATOM 70683 H2 WAT 5251 119.114 17.595 12.804 1.00 0.00 H TER 70685 WAT 5251 ATOM 70685 O WAT 5252 27.703 112.969 120.345 1.00 0.00 O ATOM 70686 H1 WAT 5252 26.818 112.729 120.070 1.00 0.00 H ATOM 70687 H2 WAT 5252 28.244 112.822 119.570 1.00 0.00 H TER 70689 WAT 5252 ATOM 70689 O WAT 5253 113.601 119.210 101.462 1.00 0.00 O ATOM 70690 H1 WAT 5253 114.398 119.679 101.711 1.00 0.00 H ATOM 70691 H2 WAT 5253 112.918 119.881 101.464 1.00 0.00 H TER 70693 WAT 5253 ATOM 70693 O WAT 5254 97.904 126.473 86.306 1.00 0.00 O ATOM 70694 H1 WAT 5254 98.784 126.560 85.938 1.00 0.00 H ATOM 70695 H2 WAT 5254 98.029 125.964 87.107 1.00 0.00 H TER 70697 WAT 5254 ATOM 70697 O WAT 5255 132.611 66.668 0.341 1.00 0.00 O ATOM 70698 H1 WAT 5255 133.503 66.841 0.038 1.00 0.00 H ATOM 70699 H2 WAT 5255 132.523 65.716 0.294 1.00 0.00 H TER 70701 WAT 5255 ATOM 70701 O WAT 5256 84.122 91.101 20.662 1.00 0.00 O ATOM 70702 H1 WAT 5256 83.174 91.000 20.750 1.00 0.00 H ATOM 70703 H2 WAT 5256 84.481 90.270 20.976 1.00 0.00 H TER 70705 WAT 5256 ATOM 70705 O WAT 5257 5.038 83.425 149.814 1.00 0.00 O ATOM 70706 H1 WAT 5257 4.241 83.255 150.316 1.00 0.00 H ATOM 70707 H2 WAT 5257 5.541 84.030 150.360 1.00 0.00 H TER 70709 WAT 5257 ATOM 70709 O WAT 5258 133.285 112.861 92.767 1.00 0.00 O ATOM 70710 H1 WAT 5258 133.534 112.573 93.645 1.00 0.00 H ATOM 70711 H2 WAT 5258 133.902 112.418 92.185 1.00 0.00 H TER 70713 WAT 5258 ATOM 70713 O WAT 5259 141.879 4.983 77.024 1.00 0.00 O ATOM 70714 H1 WAT 5259 141.430 4.578 77.765 1.00 0.00 H ATOM 70715 H2 WAT 5259 141.348 4.748 76.263 1.00 0.00 H TER 70717 WAT 5259 ATOM 70717 O WAT 5260 96.056 116.576 66.318 1.00 0.00 O ATOM 70718 H1 WAT 5260 95.140 116.711 66.563 1.00 0.00 H ATOM 70719 H2 WAT 5260 96.043 116.529 65.362 1.00 0.00 H TER 70721 WAT 5260 ATOM 70721 O WAT 5261 100.088 53.539 91.216 1.00 0.00 O ATOM 70722 H1 WAT 5261 100.210 53.338 92.144 1.00 0.00 H ATOM 70723 H2 WAT 5261 99.210 53.215 91.014 1.00 0.00 H TER 70725 WAT 5261 ATOM 70725 O WAT 5262 136.329 24.946 145.480 1.00 0.00 O ATOM 70726 H1 WAT 5262 136.306 25.065 146.429 1.00 0.00 H ATOM 70727 H2 WAT 5262 136.034 24.046 145.344 1.00 0.00 H TER 70729 WAT 5262 ATOM 70729 O WAT 5263 115.375 5.178 113.715 1.00 0.00 O ATOM 70730 H1 WAT 5263 114.561 5.166 114.218 1.00 0.00 H ATOM 70731 H2 WAT 5263 115.602 4.255 113.604 1.00 0.00 H TER 70733 WAT 5263 ATOM 70733 O WAT 5264 85.100 104.424 20.589 1.00 0.00 O ATOM 70734 H1 WAT 5264 84.469 103.733 20.791 1.00 0.00 H ATOM 70735 H2 WAT 5264 85.844 104.243 21.163 1.00 0.00 H TER 70737 WAT 5264 ATOM 70737 O WAT 5265 125.270 2.437 83.399 1.00 0.00 O ATOM 70738 H1 WAT 5265 125.695 3.294 83.405 1.00 0.00 H ATOM 70739 H2 WAT 5265 124.449 2.579 82.927 1.00 0.00 H TER 70741 WAT 5265 ATOM 70741 O WAT 5266 52.610 43.724 112.931 1.00 0.00 O ATOM 70742 H1 WAT 5266 51.844 44.027 112.443 1.00 0.00 H ATOM 70743 H2 WAT 5266 52.253 43.380 113.749 1.00 0.00 H TER 70745 WAT 5266 ATOM 70745 O WAT 5267 95.327 120.566 133.041 1.00 0.00 O ATOM 70746 H1 WAT 5267 94.776 120.280 132.312 1.00 0.00 H ATOM 70747 H2 WAT 5267 94.805 121.231 133.489 1.00 0.00 H TER 70749 WAT 5267 ATOM 70749 O WAT 5268 66.251 18.541 150.611 1.00 0.00 O ATOM 70750 H1 WAT 5268 67.129 18.912 150.516 1.00 0.00 H ATOM 70751 H2 WAT 5268 66.068 18.597 151.549 1.00 0.00 H TER 70753 WAT 5268 ATOM 70753 O WAT 5269 75.137 42.090 72.323 1.00 0.00 O ATOM 70754 H1 WAT 5269 75.720 41.711 72.981 1.00 0.00 H ATOM 70755 H2 WAT 5269 75.209 41.501 71.572 1.00 0.00 H TER 70757 WAT 5269 ATOM 70757 O WAT 5270 102.592 53.424 99.148 1.00 0.00 O ATOM 70758 H1 WAT 5270 103.007 52.703 98.674 1.00 0.00 H ATOM 70759 H2 WAT 5270 102.411 53.067 100.017 1.00 0.00 H TER 70761 WAT 5270 ATOM 70761 O WAT 5271 130.105 94.995 103.144 1.00 0.00 O ATOM 70762 H1 WAT 5271 129.242 95.256 103.467 1.00 0.00 H ATOM 70763 H2 WAT 5271 130.453 94.422 103.827 1.00 0.00 H TER 70765 WAT 5271 ATOM 70765 O WAT 5272 9.462 69.257 12.202 1.00 0.00 O ATOM 70766 H1 WAT 5272 10.157 69.890 12.017 1.00 0.00 H ATOM 70767 H2 WAT 5272 8.728 69.790 12.506 1.00 0.00 H TER 70769 WAT 5272 ATOM 70769 O WAT 5273 16.707 64.821 4.234 1.00 0.00 O ATOM 70770 H1 WAT 5273 17.310 65.560 4.315 1.00 0.00 H ATOM 70771 H2 WAT 5273 16.502 64.578 5.137 1.00 0.00 H TER 70773 WAT 5273 ATOM 70773 O WAT 5274 119.721 11.915 144.135 1.00 0.00 O ATOM 70774 H1 WAT 5274 118.918 11.644 143.691 1.00 0.00 H ATOM 70775 H2 WAT 5274 120.105 11.099 144.455 1.00 0.00 H TER 70777 WAT 5274 ATOM 70777 O WAT 5275 109.459 55.489 76.328 1.00 0.00 O ATOM 70778 H1 WAT 5275 110.252 55.916 76.653 1.00 0.00 H ATOM 70779 H2 WAT 5275 109.494 54.607 76.698 1.00 0.00 H TER 70781 WAT 5275 ATOM 70781 O WAT 5276 125.527 139.961 132.913 1.00 0.00 O ATOM 70782 H1 WAT 5276 126.157 140.356 133.515 1.00 0.00 H ATOM 70783 H2 WAT 5276 124.797 139.693 133.472 1.00 0.00 H TER 70785 WAT 5276 ATOM 70785 O WAT 5277 137.024 4.837 103.380 1.00 0.00 O ATOM 70786 H1 WAT 5277 136.519 4.852 104.194 1.00 0.00 H ATOM 70787 H2 WAT 5277 137.357 5.730 103.288 1.00 0.00 H TER 70789 WAT 5277 ATOM 70789 O WAT 5278 132.162 23.833 141.147 1.00 0.00 O ATOM 70790 H1 WAT 5278 132.444 23.367 141.934 1.00 0.00 H ATOM 70791 H2 WAT 5278 132.145 24.754 141.407 1.00 0.00 H TER 70793 WAT 5278 ATOM 70793 O WAT 5279 45.238 63.642 151.236 1.00 0.00 O ATOM 70794 H1 WAT 5279 44.886 63.618 152.126 1.00 0.00 H ATOM 70795 H2 WAT 5279 44.466 63.723 150.676 1.00 0.00 H TER 70797 WAT 5279 ATOM 70797 O WAT 5280 52.351 92.183 132.873 1.00 0.00 O ATOM 70798 H1 WAT 5280 52.288 93.096 132.593 1.00 0.00 H ATOM 70799 H2 WAT 5280 51.485 91.816 132.693 1.00 0.00 H TER 70801 WAT 5280 ATOM 70801 O WAT 5281 140.426 108.338 20.201 1.00 0.00 O ATOM 70802 H1 WAT 5281 141.157 108.405 20.816 1.00 0.00 H ATOM 70803 H2 WAT 5281 140.455 109.156 19.705 1.00 0.00 H TER 70805 WAT 5281 ATOM 70805 O WAT 5282 80.393 118.803 80.609 1.00 0.00 O ATOM 70806 H1 WAT 5282 81.060 118.147 80.811 1.00 0.00 H ATOM 70807 H2 WAT 5282 80.427 119.414 81.345 1.00 0.00 H TER 70809 WAT 5282 ATOM 70809 O WAT 5283 142.380 43.012 139.367 1.00 0.00 O ATOM 70810 H1 WAT 5283 142.470 43.655 140.070 1.00 0.00 H ATOM 70811 H2 WAT 5283 142.898 43.371 138.647 1.00 0.00 H TER 70813 WAT 5283 ATOM 70813 O WAT 5284 44.940 88.150 121.338 1.00 0.00 O ATOM 70814 H1 WAT 5284 44.524 87.351 121.015 1.00 0.00 H ATOM 70815 H2 WAT 5284 44.799 88.792 120.642 1.00 0.00 H TER 70817 WAT 5284 ATOM 70817 O WAT 5285 107.610 5.944 12.616 1.00 0.00 O ATOM 70818 H1 WAT 5285 108.061 6.463 13.281 1.00 0.00 H ATOM 70819 H2 WAT 5285 107.657 5.045 12.941 1.00 0.00 H TER 70821 WAT 5285 ATOM 70821 O WAT 5286 126.396 135.404 94.399 1.00 0.00 O ATOM 70822 H1 WAT 5286 125.728 135.510 95.077 1.00 0.00 H ATOM 70823 H2 WAT 5286 126.340 136.206 93.880 1.00 0.00 H TER 70825 WAT 5286 ATOM 70825 O WAT 5287 26.722 79.711 115.938 1.00 0.00 O ATOM 70826 H1 WAT 5287 26.458 79.630 116.854 1.00 0.00 H ATOM 70827 H2 WAT 5287 26.510 80.616 115.706 1.00 0.00 H TER 70829 WAT 5287 ATOM 70829 O WAT 5288 114.877 130.536 22.106 1.00 0.00 O ATOM 70830 H1 WAT 5288 115.052 130.886 22.979 1.00 0.00 H ATOM 70831 H2 WAT 5288 115.578 130.891 21.560 1.00 0.00 H TER 70833 WAT 5288 ATOM 70833 O WAT 5289 7.945 124.241 113.001 1.00 0.00 O ATOM 70834 H1 WAT 5289 8.129 124.683 113.830 1.00 0.00 H ATOM 70835 H2 WAT 5289 7.523 124.909 112.461 1.00 0.00 H TER 70837 WAT 5289 ATOM 70837 O WAT 5290 57.634 28.455 116.037 1.00 0.00 O ATOM 70838 H1 WAT 5290 56.819 28.870 115.754 1.00 0.00 H ATOM 70839 H2 WAT 5290 57.379 27.911 116.781 1.00 0.00 H TER 70841 WAT 5290 ATOM 70841 O WAT 5291 116.300 139.098 19.072 1.00 0.00 O ATOM 70842 H1 WAT 5291 116.397 140.050 19.055 1.00 0.00 H ATOM 70843 H2 WAT 5291 115.360 138.954 19.175 1.00 0.00 H TER 70845 WAT 5291 ATOM 70845 O WAT 5292 131.627 48.392 132.466 1.00 0.00 O ATOM 70846 H1 WAT 5292 131.925 49.281 132.658 1.00 0.00 H ATOM 70847 H2 WAT 5292 130.760 48.508 132.078 1.00 0.00 H TER 70849 WAT 5292 ATOM 70849 O WAT 5293 111.504 76.874 130.438 1.00 0.00 O ATOM 70850 H1 WAT 5293 111.664 77.458 129.697 1.00 0.00 H ATOM 70851 H2 WAT 5293 110.972 77.393 131.041 1.00 0.00 H TER 70853 WAT 5293 ATOM 70853 O WAT 5294 88.777 46.764 23.845 1.00 0.00 O ATOM 70854 H1 WAT 5294 89.598 47.244 23.742 1.00 0.00 H ATOM 70855 H2 WAT 5294 89.046 45.867 24.045 1.00 0.00 H TER 70857 WAT 5294 ATOM 70857 O WAT 5295 127.408 21.172 63.474 1.00 0.00 O ATOM 70858 H1 WAT 5295 127.457 21.887 64.109 1.00 0.00 H ATOM 70859 H2 WAT 5295 127.290 20.386 64.007 1.00 0.00 H TER 70861 WAT 5295 ATOM 70861 O WAT 5296 103.188 26.224 6.434 1.00 0.00 O ATOM 70862 H1 WAT 5296 103.078 25.275 6.380 1.00 0.00 H ATOM 70863 H2 WAT 5296 103.773 26.356 7.181 1.00 0.00 H TER 70865 WAT 5296 ATOM 70865 O WAT 5297 131.306 47.349 75.104 1.00 0.00 O ATOM 70866 H1 WAT 5297 130.635 47.260 74.428 1.00 0.00 H ATOM 70867 H2 WAT 5297 132.129 47.404 74.619 1.00 0.00 H TER 70869 WAT 5297 ATOM 70869 O WAT 5298 77.808 31.023 104.324 1.00 0.00 O ATOM 70870 H1 WAT 5298 77.238 30.272 104.161 1.00 0.00 H ATOM 70871 H2 WAT 5298 77.337 31.767 103.948 1.00 0.00 H TER 70873 WAT 5298 ATOM 70873 O WAT 5299 136.052 101.136 84.508 1.00 0.00 O ATOM 70874 H1 WAT 5299 136.629 101.160 85.272 1.00 0.00 H ATOM 70875 H2 WAT 5299 135.276 100.665 84.809 1.00 0.00 H TER 70877 WAT 5299 ATOM 70877 O WAT 5300 10.157 23.985 57.637 1.00 0.00 O ATOM 70878 H1 WAT 5300 10.519 23.193 58.034 1.00 0.00 H ATOM 70879 H2 WAT 5300 9.823 23.696 56.787 1.00 0.00 H TER 70881 WAT 5300 ATOM 70881 O WAT 5301 31.368 124.902 126.282 1.00 0.00 O ATOM 70882 H1 WAT 5301 32.179 125.140 125.834 1.00 0.00 H ATOM 70883 H2 WAT 5301 31.295 123.955 126.160 1.00 0.00 H TER 70885 WAT 5301 ATOM 70885 O WAT 5302 62.705 14.029 61.053 1.00 0.00 O ATOM 70886 H1 WAT 5302 62.508 14.113 60.120 1.00 0.00 H ATOM 70887 H2 WAT 5302 61.849 13.928 61.470 1.00 0.00 H TER 70889 WAT 5302 ATOM 70889 O WAT 5303 123.914 40.314 24.435 1.00 0.00 O ATOM 70890 H1 WAT 5303 123.632 41.226 24.376 1.00 0.00 H ATOM 70891 H2 WAT 5303 124.105 40.063 23.531 1.00 0.00 H TER 70893 WAT 5303 ATOM 70893 O WAT 5304 109.272 122.901 77.599 1.00 0.00 O ATOM 70894 H1 WAT 5304 108.567 122.737 76.973 1.00 0.00 H ATOM 70895 H2 WAT 5304 108.956 122.525 78.420 1.00 0.00 H TER 70897 WAT 5304 ATOM 70897 O WAT 5305 31.252 12.193 71.707 1.00 0.00 O ATOM 70898 H1 WAT 5305 31.389 11.282 71.447 1.00 0.00 H ATOM 70899 H2 WAT 5305 31.263 12.682 70.884 1.00 0.00 H TER 70901 WAT 5305 ATOM 70901 O WAT 5306 79.219 35.440 137.135 1.00 0.00 O ATOM 70902 H1 WAT 5306 78.565 35.634 137.806 1.00 0.00 H ATOM 70903 H2 WAT 5306 78.720 35.040 136.423 1.00 0.00 H TER 70905 WAT 5306 ATOM 70905 O WAT 5307 71.649 79.116 2.189 1.00 0.00 O ATOM 70906 H1 WAT 5307 71.734 79.526 3.049 1.00 0.00 H ATOM 70907 H2 WAT 5307 72.505 78.720 2.026 1.00 0.00 H TER 70909 WAT 5307 ATOM 70909 O WAT 5308 4.167 67.331 60.201 1.00 0.00 O ATOM 70910 H1 WAT 5308 4.430 68.214 59.942 1.00 0.00 H ATOM 70911 H2 WAT 5308 3.542 67.060 59.529 1.00 0.00 H TER 70913 WAT 5308 ATOM 70913 O WAT 5309 44.884 53.378 76.760 1.00 0.00 O ATOM 70914 H1 WAT 5309 45.307 53.684 77.563 1.00 0.00 H ATOM 70915 H2 WAT 5309 44.687 54.178 76.273 1.00 0.00 H TER 70917 WAT 5309 ATOM 70917 O WAT 5310 96.910 42.883 20.605 1.00 0.00 O ATOM 70918 H1 WAT 5310 96.634 43.190 19.742 1.00 0.00 H ATOM 70919 H2 WAT 5310 97.110 41.955 20.477 1.00 0.00 H TER 70921 WAT 5310 ATOM 70921 O WAT 5311 4.486 41.962 118.899 1.00 0.00 O ATOM 70922 H1 WAT 5311 4.996 42.753 118.725 1.00 0.00 H ATOM 70923 H2 WAT 5311 3.581 42.267 118.954 1.00 0.00 H TER 70925 WAT 5311 ATOM 70925 O WAT 5312 128.358 84.475 119.150 1.00 0.00 O ATOM 70926 H1 WAT 5312 127.801 85.209 119.409 1.00 0.00 H ATOM 70927 H2 WAT 5312 129.235 84.852 119.082 1.00 0.00 H TER 70929 WAT 5312 ATOM 70929 O WAT 5313 53.207 83.753 143.980 1.00 0.00 O ATOM 70930 H1 WAT 5313 53.557 84.610 143.738 1.00 0.00 H ATOM 70931 H2 WAT 5313 52.321 83.936 144.294 1.00 0.00 H TER 70933 WAT 5313 ATOM 70933 O WAT 5314 86.672 98.088 138.062 1.00 0.00 O ATOM 70934 H1 WAT 5314 87.434 98.199 137.493 1.00 0.00 H ATOM 70935 H2 WAT 5314 86.774 97.209 138.429 1.00 0.00 H TER 70937 WAT 5314 ATOM 70937 O WAT 5315 96.917 124.934 4.946 1.00 0.00 O ATOM 70938 H1 WAT 5315 97.122 124.640 4.058 1.00 0.00 H ATOM 70939 H2 WAT 5315 97.481 125.695 5.083 1.00 0.00 H TER 70941 WAT 5315 ATOM 70941 O WAT 5316 38.152 99.376 73.598 1.00 0.00 O ATOM 70942 H1 WAT 5316 39.093 99.229 73.505 1.00 0.00 H ATOM 70943 H2 WAT 5316 37.766 98.955 72.829 1.00 0.00 H TER 70945 WAT 5316 ATOM 70945 O WAT 5317 113.059 9.076 0.995 1.00 0.00 O ATOM 70946 H1 WAT 5317 113.460 8.694 1.776 1.00 0.00 H ATOM 70947 H2 WAT 5317 112.395 9.675 1.335 1.00 0.00 H TER 70949 WAT 5317 ATOM 70949 O WAT 5318 49.279 44.706 126.794 1.00 0.00 O ATOM 70950 H1 WAT 5318 48.435 44.555 127.220 1.00 0.00 H ATOM 70951 H2 WAT 5318 49.517 43.856 126.425 1.00 0.00 H TER 70953 WAT 5318 ATOM 70953 O WAT 5319 71.886 104.207 136.206 1.00 0.00 O ATOM 70954 H1 WAT 5319 71.615 104.237 135.289 1.00 0.00 H ATOM 70955 H2 WAT 5319 72.719 104.677 136.226 1.00 0.00 H TER 70957 WAT 5319 ATOM 70957 O WAT 5320 38.055 75.213 154.146 1.00 0.00 O ATOM 70958 H1 WAT 5320 38.559 75.537 153.399 1.00 0.00 H ATOM 70959 H2 WAT 5320 37.620 75.989 154.497 1.00 0.00 H TER 70961 WAT 5320 ATOM 70961 O WAT 5321 88.781 137.057 89.930 1.00 0.00 O ATOM 70962 H1 WAT 5321 88.386 136.209 90.130 1.00 0.00 H ATOM 70963 H2 WAT 5321 88.972 137.440 90.786 1.00 0.00 H TER 70965 WAT 5321 ATOM 70965 O WAT 5322 29.035 69.877 142.538 1.00 0.00 O ATOM 70966 H1 WAT 5322 29.824 70.033 143.057 1.00 0.00 H ATOM 70967 H2 WAT 5322 28.428 70.564 142.813 1.00 0.00 H TER 70969 WAT 5322 ATOM 70969 O WAT 5323 47.077 54.558 54.502 1.00 0.00 O ATOM 70970 H1 WAT 5323 47.629 54.110 53.862 1.00 0.00 H ATOM 70971 H2 WAT 5323 46.736 53.857 55.057 1.00 0.00 H TER 70973 WAT 5323 ATOM 70973 O WAT 5324 1.338 131.587 120.851 1.00 0.00 O ATOM 70974 H1 WAT 5324 1.222 131.658 119.904 1.00 0.00 H ATOM 70975 H2 WAT 5324 1.623 130.684 120.990 1.00 0.00 H TER 70977 WAT 5324 ATOM 70977 O WAT 5325 64.954 116.905 152.163 1.00 0.00 O ATOM 70978 H1 WAT 5325 65.048 117.845 152.317 1.00 0.00 H ATOM 70979 H2 WAT 5325 64.045 116.797 151.885 1.00 0.00 H TER 70981 WAT 5325 ATOM 70981 O WAT 5326 6.732 18.196 75.048 1.00 0.00 O ATOM 70982 H1 WAT 5326 6.453 17.816 74.215 1.00 0.00 H ATOM 70983 H2 WAT 5326 7.575 17.781 75.231 1.00 0.00 H TER 70985 WAT 5326 ATOM 70985 O WAT 5327 67.222 61.025 120.420 1.00 0.00 O ATOM 70986 H1 WAT 5327 66.301 61.078 120.675 1.00 0.00 H ATOM 70987 H2 WAT 5327 67.623 60.463 121.083 1.00 0.00 H TER 70989 WAT 5327 ATOM 70989 O WAT 5328 12.868 22.419 91.388 1.00 0.00 O ATOM 70990 H1 WAT 5328 12.726 22.733 90.495 1.00 0.00 H ATOM 70991 H2 WAT 5328 12.086 21.903 91.587 1.00 0.00 H TER 70993 WAT 5328 ATOM 70993 O WAT 5329 45.241 4.042 120.036 1.00 0.00 O ATOM 70994 H1 WAT 5329 44.481 4.512 119.694 1.00 0.00 H ATOM 70995 H2 WAT 5329 45.896 4.109 119.342 1.00 0.00 H TER 70997 WAT 5329 ATOM 70997 O WAT 5330 25.466 6.185 115.999 1.00 0.00 O ATOM 70998 H1 WAT 5330 25.891 5.627 115.348 1.00 0.00 H ATOM 70999 H2 WAT 5330 25.200 6.963 115.509 1.00 0.00 H TER 71001 WAT 5330 ATOM 71001 O WAT 5331 52.492 1.798 102.101 1.00 0.00 O ATOM 71002 H1 WAT 5331 53.314 2.208 102.368 1.00 0.00 H ATOM 71003 H2 WAT 5331 52.705 1.340 101.288 1.00 0.00 H TER 71005 WAT 5331 ATOM 71005 O WAT 5332 99.034 44.240 112.172 1.00 0.00 O ATOM 71006 H1 WAT 5332 99.287 45.109 111.862 1.00 0.00 H ATOM 71007 H2 WAT 5332 98.112 44.330 112.411 1.00 0.00 H TER 71009 WAT 5332 ATOM 71009 O WAT 5333 27.734 46.704 120.035 1.00 0.00 O ATOM 71010 H1 WAT 5333 26.885 46.865 120.448 1.00 0.00 H ATOM 71011 H2 WAT 5333 27.594 45.926 119.495 1.00 0.00 H TER 71013 WAT 5333 ATOM 71013 O WAT 5334 117.040 42.523 1.063 1.00 0.00 O ATOM 71014 H1 WAT 5334 116.437 41.970 0.566 1.00 0.00 H ATOM 71015 H2 WAT 5334 116.625 42.620 1.920 1.00 0.00 H TER 71017 WAT 5334 ATOM 71017 O WAT 5335 88.845 124.466 139.611 1.00 0.00 O ATOM 71018 H1 WAT 5335 87.908 124.419 139.424 1.00 0.00 H ATOM 71019 H2 WAT 5335 88.975 125.346 139.965 1.00 0.00 H TER 71021 WAT 5335 ATOM 71021 O WAT 5336 126.120 37.443 133.094 1.00 0.00 O ATOM 71022 H1 WAT 5336 126.929 37.813 133.448 1.00 0.00 H ATOM 71023 H2 WAT 5336 126.218 36.498 133.210 1.00 0.00 H TER 71025 WAT 5336 ATOM 71025 O WAT 5337 78.077 103.907 26.726 1.00 0.00 O ATOM 71026 H1 WAT 5337 78.386 104.537 27.377 1.00 0.00 H ATOM 71027 H2 WAT 5337 77.456 104.400 26.190 1.00 0.00 H TER 71029 WAT 5337 ATOM 71029 O WAT 5338 89.666 69.592 110.432 1.00 0.00 O ATOM 71030 H1 WAT 5338 90.157 68.842 110.767 1.00 0.00 H ATOM 71031 H2 WAT 5338 90.041 69.756 109.567 1.00 0.00 H TER 71033 WAT 5338 ATOM 71033 O WAT 5339 47.788 8.758 76.692 1.00 0.00 O ATOM 71034 H1 WAT 5339 47.374 9.614 76.798 1.00 0.00 H ATOM 71035 H2 WAT 5339 47.172 8.258 76.155 1.00 0.00 H TER 71037 WAT 5339 ATOM 71037 O WAT 5340 97.188 96.246 98.566 1.00 0.00 O ATOM 71038 H1 WAT 5340 96.451 96.174 97.959 1.00 0.00 H ATOM 71039 H2 WAT 5340 97.271 95.371 98.946 1.00 0.00 H TER 71041 WAT 5340 ATOM 71041 O WAT 5341 2.407 56.772 4.260 1.00 0.00 O ATOM 71042 H1 WAT 5341 2.756 57.217 5.032 1.00 0.00 H ATOM 71043 H2 WAT 5341 3.036 56.073 4.081 1.00 0.00 H TER 71045 WAT 5341 ATOM 71045 O WAT 5342 141.676 30.354 8.011 1.00 0.00 O ATOM 71046 H1 WAT 5342 142.429 30.944 7.973 1.00 0.00 H ATOM 71047 H2 WAT 5342 141.903 29.638 7.418 1.00 0.00 H TER 71049 WAT 5342 ATOM 71049 O WAT 5343 128.141 123.125 98.941 1.00 0.00 O ATOM 71050 H1 WAT 5343 128.235 123.297 99.878 1.00 0.00 H ATOM 71051 H2 WAT 5343 127.195 123.112 98.794 1.00 0.00 H TER 71053 WAT 5343 ATOM 71053 O WAT 5344 96.924 137.505 66.453 1.00 0.00 O ATOM 71054 H1 WAT 5344 97.222 138.371 66.175 1.00 0.00 H ATOM 71055 H2 WAT 5344 96.159 137.328 65.905 1.00 0.00 H TER 71057 WAT 5344 ATOM 71057 O WAT 5345 72.443 12.753 148.642 1.00 0.00 O ATOM 71058 H1 WAT 5345 72.439 13.697 148.484 1.00 0.00 H ATOM 71059 H2 WAT 5345 72.587 12.669 149.585 1.00 0.00 H TER 71061 WAT 5345 ATOM 71061 O WAT 5346 86.243 117.728 92.991 1.00 0.00 O ATOM 71062 H1 WAT 5346 86.870 117.975 92.312 1.00 0.00 H ATOM 71063 H2 WAT 5346 86.130 118.522 93.513 1.00 0.00 H TER 71065 WAT 5346 ATOM 71065 O WAT 5347 101.346 46.994 3.555 1.00 0.00 O ATOM 71066 H1 WAT 5347 101.170 46.199 4.059 1.00 0.00 H ATOM 71067 H2 WAT 5347 100.860 47.680 4.013 1.00 0.00 H TER 71069 WAT 5347 ATOM 71069 O WAT 5348 106.617 43.703 129.154 1.00 0.00 O ATOM 71070 H1 WAT 5348 106.135 42.993 128.730 1.00 0.00 H ATOM 71071 H2 WAT 5348 106.951 43.315 129.963 1.00 0.00 H TER 71073 WAT 5348 ATOM 71073 O WAT 5349 94.230 125.607 1.825 1.00 0.00 O ATOM 71074 H1 WAT 5349 93.672 125.668 2.601 1.00 0.00 H ATOM 71075 H2 WAT 5349 94.500 124.690 1.795 1.00 0.00 H TER 71077 WAT 5349 ATOM 71077 O WAT 5350 104.998 145.458 148.701 1.00 0.00 O ATOM 71078 H1 WAT 5350 104.803 144.656 149.187 1.00 0.00 H ATOM 71079 H2 WAT 5350 105.204 146.103 149.377 1.00 0.00 H TER 71081 WAT 5350 ATOM 71081 O WAT 5351 103.009 128.932 117.069 1.00 0.00 O ATOM 71082 H1 WAT 5351 102.990 129.476 116.281 1.00 0.00 H ATOM 71083 H2 WAT 5351 103.438 129.479 117.727 1.00 0.00 H TER 71085 WAT 5351 ATOM 71085 O WAT 5352 57.929 19.036 94.214 1.00 0.00 O ATOM 71086 H1 WAT 5352 57.983 18.868 95.155 1.00 0.00 H ATOM 71087 H2 WAT 5352 57.725 18.183 93.831 1.00 0.00 H TER 71089 WAT 5352 ATOM 71089 O WAT 5353 57.208 60.020 13.834 1.00 0.00 O ATOM 71090 H1 WAT 5353 56.561 60.524 14.327 1.00 0.00 H ATOM 71091 H2 WAT 5353 57.675 60.674 13.315 1.00 0.00 H TER 71093 WAT 5353 ATOM 71093 O WAT 5354 56.164 104.179 141.175 1.00 0.00 O ATOM 71094 H1 WAT 5354 56.576 103.958 142.010 1.00 0.00 H ATOM 71095 H2 WAT 5354 56.046 103.337 140.735 1.00 0.00 H TER 71097 WAT 5354 ATOM 71097 O WAT 5355 74.718 92.303 114.881 1.00 0.00 O ATOM 71098 H1 WAT 5355 73.826 92.031 115.097 1.00 0.00 H ATOM 71099 H2 WAT 5355 74.761 93.220 115.151 1.00 0.00 H TER 71101 WAT 5355 ATOM 71101 O WAT 5356 67.667 47.205 14.374 1.00 0.00 O ATOM 71102 H1 WAT 5356 67.663 46.259 14.522 1.00 0.00 H ATOM 71103 H2 WAT 5356 68.466 47.511 14.805 1.00 0.00 H TER 71105 WAT 5356 ATOM 71105 O WAT 5357 38.994 58.599 140.123 1.00 0.00 O ATOM 71106 H1 WAT 5357 38.874 57.762 139.675 1.00 0.00 H ATOM 71107 H2 WAT 5357 38.578 58.476 140.976 1.00 0.00 H TER 71109 WAT 5357 ATOM 71109 O WAT 5358 68.304 94.281 65.020 1.00 0.00 O ATOM 71110 H1 WAT 5358 67.708 94.218 65.767 1.00 0.00 H ATOM 71111 H2 WAT 5358 68.809 93.469 65.048 1.00 0.00 H TER 71113 WAT 5358 ATOM 71113 O WAT 5359 42.719 26.915 79.183 1.00 0.00 O ATOM 71114 H1 WAT 5359 43.631 26.830 79.461 1.00 0.00 H ATOM 71115 H2 WAT 5359 42.234 27.062 79.996 1.00 0.00 H TER 71117 WAT 5359 ATOM 71117 O WAT 5360 43.526 91.066 145.359 1.00 0.00 O ATOM 71118 H1 WAT 5360 42.881 91.760 145.221 1.00 0.00 H ATOM 71119 H2 WAT 5360 44.209 91.242 144.712 1.00 0.00 H TER 71121 WAT 5360 ATOM 71121 O WAT 5361 79.025 60.863 95.841 1.00 0.00 O ATOM 71122 H1 WAT 5361 79.074 61.118 96.763 1.00 0.00 H ATOM 71123 H2 WAT 5361 78.126 61.067 95.584 1.00 0.00 H TER 71125 WAT 5361 ATOM 71125 O WAT 5362 106.032 108.386 84.535 1.00 0.00 O ATOM 71126 H1 WAT 5362 105.542 107.898 85.197 1.00 0.00 H ATOM 71127 H2 WAT 5362 106.082 109.277 84.881 1.00 0.00 H TER 71129 WAT 5362 ATOM 71129 O WAT 5363 52.831 73.382 117.907 1.00 0.00 O ATOM 71130 H1 WAT 5363 52.963 72.592 118.430 1.00 0.00 H ATOM 71131 H2 WAT 5363 52.290 73.948 118.459 1.00 0.00 H TER 71133 WAT 5363 ATOM 71133 O WAT 5364 4.510 9.687 104.812 1.00 0.00 O ATOM 71134 H1 WAT 5364 4.255 8.973 105.397 1.00 0.00 H ATOM 71135 H2 WAT 5364 4.990 10.297 105.372 1.00 0.00 H TER 71137 WAT 5364 ATOM 71137 O WAT 5365 101.687 70.141 106.113 1.00 0.00 O ATOM 71138 H1 WAT 5365 101.844 69.804 106.995 1.00 0.00 H ATOM 71139 H2 WAT 5365 101.151 70.923 106.247 1.00 0.00 H TER 71141 WAT 5365 ATOM 71141 O WAT 5366 116.868 19.597 114.985 1.00 0.00 O ATOM 71142 H1 WAT 5366 117.005 18.651 115.022 1.00 0.00 H ATOM 71143 H2 WAT 5366 115.971 19.698 114.667 1.00 0.00 H TER 71145 WAT 5366 ATOM 71145 O WAT 5367 127.686 88.942 13.724 1.00 0.00 O ATOM 71146 H1 WAT 5367 127.407 89.753 14.149 1.00 0.00 H ATOM 71147 H2 WAT 5367 128.563 88.780 14.071 1.00 0.00 H TER 71149 WAT 5367 ATOM 71149 O WAT 5368 82.715 109.776 140.698 1.00 0.00 O ATOM 71150 H1 WAT 5368 82.585 110.595 141.177 1.00 0.00 H ATOM 71151 H2 WAT 5368 81.914 109.277 140.856 1.00 0.00 H TER 71153 WAT 5368 ATOM 71153 O WAT 5369 121.862 29.182 58.492 1.00 0.00 O ATOM 71154 H1 WAT 5369 121.757 30.011 58.958 1.00 0.00 H ATOM 71155 H2 WAT 5369 121.446 28.533 59.060 1.00 0.00 H TER 71157 WAT 5369 ATOM 71157 O WAT 5370 105.039 32.183 127.758 1.00 0.00 O ATOM 71158 H1 WAT 5370 104.284 32.580 128.192 1.00 0.00 H ATOM 71159 H2 WAT 5370 105.035 31.273 128.055 1.00 0.00 H TER 71161 WAT 5370 ATOM 71161 O WAT 5371 88.583 113.510 1.482 1.00 0.00 O ATOM 71162 H1 WAT 5371 89.290 114.121 1.693 1.00 0.00 H ATOM 71163 H2 WAT 5371 88.997 112.647 1.507 1.00 0.00 H TER 71165 WAT 5371 ATOM 71165 O WAT 5372 118.596 69.579 148.134 1.00 0.00 O ATOM 71166 H1 WAT 5372 117.984 70.118 147.633 1.00 0.00 H ATOM 71167 H2 WAT 5372 119.399 69.582 147.614 1.00 0.00 H TER 71169 WAT 5372 ATOM 71169 O WAT 5373 126.781 49.101 97.498 1.00 0.00 O ATOM 71170 H1 WAT 5373 127.716 49.165 97.693 1.00 0.00 H ATOM 71171 H2 WAT 5373 126.348 49.319 98.324 1.00 0.00 H TER 71173 WAT 5373 ATOM 71173 O WAT 5374 70.036 51.360 119.308 1.00 0.00 O ATOM 71174 H1 WAT 5374 70.287 50.882 120.098 1.00 0.00 H ATOM 71175 H2 WAT 5374 69.681 50.689 118.725 1.00 0.00 H TER 71177 WAT 5374 ATOM 71177 O WAT 5375 12.621 115.794 142.462 1.00 0.00 O ATOM 71178 H1 WAT 5375 12.321 115.254 143.193 1.00 0.00 H ATOM 71179 H2 WAT 5375 12.599 116.689 142.801 1.00 0.00 H TER 71181 WAT 5375 ATOM 71181 O WAT 5376 23.599 7.270 11.204 1.00 0.00 O ATOM 71182 H1 WAT 5376 23.465 7.590 12.096 1.00 0.00 H ATOM 71183 H2 WAT 5376 24.172 7.922 10.800 1.00 0.00 H TER 71185 WAT 5376 ATOM 71185 O WAT 5377 133.087 59.389 155.852 1.00 0.00 O ATOM 71186 H1 WAT 5377 132.890 59.857 156.664 1.00 0.00 H ATOM 71187 H2 WAT 5377 132.559 58.592 155.900 1.00 0.00 H TER 71189 WAT 5377 ATOM 71189 O WAT 5378 75.504 46.785 17.168 1.00 0.00 O ATOM 71190 H1 WAT 5378 76.249 47.304 17.469 1.00 0.00 H ATOM 71191 H2 WAT 5378 75.784 46.430 16.324 1.00 0.00 H TER 71193 WAT 5378 ATOM 71193 O WAT 5379 109.665 81.351 19.493 1.00 0.00 O ATOM 71194 H1 WAT 5379 110.100 82.203 19.517 1.00 0.00 H ATOM 71195 H2 WAT 5379 109.671 81.054 20.404 1.00 0.00 H TER 71197 WAT 5379 ATOM 71197 O WAT 5380 46.087 67.634 155.789 1.00 0.00 O ATOM 71198 H1 WAT 5380 45.156 67.639 156.013 1.00 0.00 H ATOM 71199 H2 WAT 5380 46.106 67.767 154.841 1.00 0.00 H TER 71201 WAT 5380 ATOM 71201 O WAT 5381 91.374 28.393 137.040 1.00 0.00 O ATOM 71202 H1 WAT 5381 91.503 28.576 136.110 1.00 0.00 H ATOM 71203 H2 WAT 5381 90.600 28.903 137.279 1.00 0.00 H TER 71205 WAT 5381 ATOM 71205 O WAT 5382 125.502 87.458 24.630 1.00 0.00 O ATOM 71206 H1 WAT 5382 126.154 87.079 24.040 1.00 0.00 H ATOM 71207 H2 WAT 5382 124.973 86.712 24.913 1.00 0.00 H TER 71209 WAT 5382 ATOM 71209 O WAT 5383 44.205 29.331 144.222 1.00 0.00 O ATOM 71210 H1 WAT 5383 43.473 29.659 144.744 1.00 0.00 H ATOM 71211 H2 WAT 5383 43.794 28.944 143.449 1.00 0.00 H TER 71213 WAT 5383 ATOM 71213 O WAT 5384 16.323 23.679 115.842 1.00 0.00 O ATOM 71214 H1 WAT 5384 15.859 23.796 116.671 1.00 0.00 H ATOM 71215 H2 WAT 5384 16.571 22.754 115.835 1.00 0.00 H TER 71217 WAT 5384 ATOM 71217 O WAT 5385 94.593 35.950 145.333 1.00 0.00 O ATOM 71218 H1 WAT 5385 94.809 36.882 145.330 1.00 0.00 H ATOM 71219 H2 WAT 5385 95.068 35.597 146.086 1.00 0.00 H TER 71221 WAT 5385 ATOM 71221 O WAT 5386 52.817 102.043 87.242 1.00 0.00 O ATOM 71222 H1 WAT 5386 53.360 102.764 86.923 1.00 0.00 H ATOM 71223 H2 WAT 5386 52.435 102.373 88.055 1.00 0.00 H TER 71225 WAT 5386 ATOM 71225 O WAT 5387 20.363 91.315 108.360 1.00 0.00 O ATOM 71226 H1 WAT 5387 20.500 91.412 109.303 1.00 0.00 H ATOM 71227 H2 WAT 5387 19.456 91.022 108.279 1.00 0.00 H TER 71229 WAT 5387 ATOM 71229 O WAT 5388 75.457 115.319 110.363 1.00 0.00 O ATOM 71230 H1 WAT 5388 75.200 116.155 109.975 1.00 0.00 H ATOM 71231 H2 WAT 5388 76.323 115.485 110.736 1.00 0.00 H TER 71233 WAT 5388 ATOM 71233 O WAT 5389 64.442 112.716 103.420 1.00 0.00 O ATOM 71234 H1 WAT 5389 64.947 113.267 104.018 1.00 0.00 H ATOM 71235 H2 WAT 5389 64.301 113.265 102.649 1.00 0.00 H TER 71237 WAT 5389 ATOM 71237 O WAT 5390 1.032 74.566 13.027 1.00 0.00 O ATOM 71238 H1 WAT 5390 0.858 75.480 12.801 1.00 0.00 H ATOM 71239 H2 WAT 5390 1.947 74.560 13.310 1.00 0.00 H TER 71241 WAT 5390 ATOM 71241 O WAT 5391 48.593 25.497 143.065 1.00 0.00 O ATOM 71242 H1 WAT 5391 48.297 24.625 143.327 1.00 0.00 H ATOM 71243 H2 WAT 5391 47.835 25.886 142.628 1.00 0.00 H TER 71245 WAT 5391 ATOM 71245 O WAT 5392 140.976 51.421 112.713 1.00 0.00 O ATOM 71246 H1 WAT 5392 141.299 52.318 112.804 1.00 0.00 H ATOM 71247 H2 WAT 5392 141.302 50.969 113.490 1.00 0.00 H TER 71249 WAT 5392 ATOM 71249 O WAT 5393 15.761 78.763 123.600 1.00 0.00 O ATOM 71250 H1 WAT 5393 15.697 78.578 124.537 1.00 0.00 H ATOM 71251 H2 WAT 5393 16.093 77.951 123.217 1.00 0.00 H TER 71253 WAT 5393 ATOM 71253 O WAT 5394 3.152 12.366 3.802 1.00 0.00 O ATOM 71254 H1 WAT 5394 3.844 12.570 4.430 1.00 0.00 H ATOM 71255 H2 WAT 5394 3.583 12.407 2.948 1.00 0.00 H TER 71257 WAT 5394 ATOM 71257 O WAT 5395 105.261 28.710 121.043 1.00 0.00 O ATOM 71258 H1 WAT 5395 105.177 28.454 120.125 1.00 0.00 H ATOM 71259 H2 WAT 5395 104.409 28.504 121.428 1.00 0.00 H TER 71261 WAT 5395 ATOM 71261 O WAT 5396 3.817 11.814 143.199 1.00 0.00 O ATOM 71262 H1 WAT 5396 4.408 11.179 143.603 1.00 0.00 H ATOM 71263 H2 WAT 5396 3.630 12.444 143.895 1.00 0.00 H TER 71265 WAT 5396 ATOM 71265 O WAT 5397 50.119 119.211 137.875 1.00 0.00 O ATOM 71266 H1 WAT 5397 50.527 119.378 138.725 1.00 0.00 H ATOM 71267 H2 WAT 5397 49.233 118.919 138.088 1.00 0.00 H TER 71269 WAT 5397 ATOM 71269 O WAT 5398 16.153 87.606 99.864 1.00 0.00 O ATOM 71270 H1 WAT 5398 16.379 88.360 99.320 1.00 0.00 H ATOM 71271 H2 WAT 5398 15.199 87.640 99.936 1.00 0.00 H TER 71273 WAT 5398 ATOM 71273 O WAT 5399 46.251 18.939 84.974 1.00 0.00 O ATOM 71274 H1 WAT 5399 46.314 19.358 84.115 1.00 0.00 H ATOM 71275 H2 WAT 5399 45.425 19.258 85.336 1.00 0.00 H TER 71277 WAT 5399 ATOM 71277 O WAT 5400 67.200 120.927 150.771 1.00 0.00 O ATOM 71278 H1 WAT 5400 68.000 121.289 150.392 1.00 0.00 H ATOM 71279 H2 WAT 5400 66.935 120.239 150.159 1.00 0.00 H TER 71281 WAT 5400 ATOM 71281 O WAT 5401 27.193 113.584 148.120 1.00 0.00 O ATOM 71282 H1 WAT 5401 27.254 112.671 147.839 1.00 0.00 H ATOM 71283 H2 WAT 5401 27.066 113.535 149.067 1.00 0.00 H TER 71285 WAT 5401 ATOM 71285 O WAT 5402 51.400 74.824 123.198 1.00 0.00 O ATOM 71286 H1 WAT 5402 50.979 75.430 123.809 1.00 0.00 H ATOM 71287 H2 WAT 5402 52.337 74.949 123.344 1.00 0.00 H TER 71289 WAT 5402 ATOM 71289 O WAT 5403 48.729 67.030 98.741 1.00 0.00 O ATOM 71290 H1 WAT 5403 48.995 66.459 98.020 1.00 0.00 H ATOM 71291 H2 WAT 5403 48.024 66.553 99.178 1.00 0.00 H TER 71293 WAT 5403 ATOM 71293 O WAT 5404 13.604 0.823 89.381 1.00 0.00 O ATOM 71294 H1 WAT 5404 14.385 0.880 89.933 1.00 0.00 H ATOM 71295 H2 WAT 5404 13.150 0.038 89.690 1.00 0.00 H TER 71297 WAT 5404 ATOM 71297 O WAT 5405 20.893 90.411 77.838 1.00 0.00 O ATOM 71298 H1 WAT 5405 21.357 89.750 77.324 1.00 0.00 H ATOM 71299 H2 WAT 5405 19.967 90.225 77.686 1.00 0.00 H TER 71301 WAT 5405 ATOM 71301 O WAT 5406 74.086 27.936 148.938 1.00 0.00 O ATOM 71302 H1 WAT 5406 74.416 28.319 148.125 1.00 0.00 H ATOM 71303 H2 WAT 5406 74.575 28.382 149.629 1.00 0.00 H TER 71305 WAT 5406 ATOM 71305 O WAT 5407 53.534 137.308 136.168 1.00 0.00 O ATOM 71306 H1 WAT 5407 53.979 137.260 135.322 1.00 0.00 H ATOM 71307 H2 WAT 5407 53.810 136.516 136.629 1.00 0.00 H TER 71309 WAT 5407 ATOM 71309 O WAT 5408 144.111 123.095 64.821 1.00 0.00 O ATOM 71310 H1 WAT 5408 143.660 122.962 63.987 1.00 0.00 H ATOM 71311 H2 WAT 5408 145.034 123.181 64.582 1.00 0.00 H TER 71313 WAT 5408 ATOM 71313 O WAT 5409 22.692 23.290 113.592 1.00 0.00 O ATOM 71314 H1 WAT 5409 23.551 23.257 113.172 1.00 0.00 H ATOM 71315 H2 WAT 5409 22.071 23.329 112.865 1.00 0.00 H TER 71317 WAT 5409 ATOM 71317 O WAT 5410 3.297 80.426 157.876 1.00 0.00 O ATOM 71318 H1 WAT 5410 2.412 80.111 157.692 1.00 0.00 H ATOM 71319 H2 WAT 5410 3.166 81.213 158.405 1.00 0.00 H TER 71321 WAT 5410 ATOM 71321 O WAT 5411 81.589 8.540 25.009 1.00 0.00 O ATOM 71322 H1 WAT 5411 80.877 8.907 24.484 1.00 0.00 H ATOM 71323 H2 WAT 5411 82.283 8.357 24.376 1.00 0.00 H TER 71325 WAT 5411 ATOM 71325 O WAT 5412 121.115 2.829 135.214 1.00 0.00 O ATOM 71326 H1 WAT 5412 120.906 3.645 135.670 1.00 0.00 H ATOM 71327 H2 WAT 5412 121.876 3.044 134.675 1.00 0.00 H TER 71329 WAT 5412 ATOM 71329 O WAT 5413 122.717 1.537 1.890 1.00 0.00 O ATOM 71330 H1 WAT 5413 123.046 0.656 2.071 1.00 0.00 H ATOM 71331 H2 WAT 5413 122.720 1.973 2.742 1.00 0.00 H TER 71333 WAT 5413 ATOM 71333 O WAT 5414 140.539 82.508 132.470 1.00 0.00 O ATOM 71334 H1 WAT 5414 140.042 82.036 133.138 1.00 0.00 H ATOM 71335 H2 WAT 5414 141.437 82.520 132.803 1.00 0.00 H TER 71337 WAT 5414 ATOM 71337 O WAT 5415 66.222 73.398 120.043 1.00 0.00 O ATOM 71338 H1 WAT 5415 66.069 74.241 119.614 1.00 0.00 H ATOM 71339 H2 WAT 5415 65.522 72.833 119.715 1.00 0.00 H TER 71341 WAT 5415 ATOM 71341 O WAT 5416 99.611 11.903 88.554 1.00 0.00 O ATOM 71342 H1 WAT 5416 100.244 11.293 88.175 1.00 0.00 H ATOM 71343 H2 WAT 5416 98.864 11.876 87.955 1.00 0.00 H TER 71345 WAT 5416 ATOM 71345 O WAT 5417 137.458 13.897 157.807 1.00 0.00 O ATOM 71346 H1 WAT 5417 137.321 14.266 158.680 1.00 0.00 H ATOM 71347 H2 WAT 5417 137.611 14.657 157.247 1.00 0.00 H TER 71349 WAT 5417 ATOM 71349 O WAT 5418 112.723 3.693 84.295 1.00 0.00 O ATOM 71350 H1 WAT 5418 113.016 3.122 85.004 1.00 0.00 H ATOM 71351 H2 WAT 5418 111.938 4.120 84.639 1.00 0.00 H TER 71353 WAT 5418 ATOM 71353 O WAT 5419 84.949 96.860 136.396 1.00 0.00 O ATOM 71354 H1 WAT 5419 85.537 97.470 136.841 1.00 0.00 H ATOM 71355 H2 WAT 5419 84.518 97.389 135.725 1.00 0.00 H TER 71357 WAT 5419 ATOM 71357 O WAT 5420 83.087 11.211 146.534 1.00 0.00 O ATOM 71358 H1 WAT 5420 82.894 11.886 147.184 1.00 0.00 H ATOM 71359 H2 WAT 5420 82.901 10.386 146.983 1.00 0.00 H TER 71361 WAT 5420 ATOM 71361 O WAT 5421 79.626 58.888 9.579 1.00 0.00 O ATOM 71362 H1 WAT 5421 79.159 58.216 10.075 1.00 0.00 H ATOM 71363 H2 WAT 5421 80.023 59.446 10.248 1.00 0.00 H TER 71365 WAT 5421 ATOM 71365 O WAT 5422 29.868 93.713 24.845 1.00 0.00 O ATOM 71366 H1 WAT 5422 29.952 94.665 24.886 1.00 0.00 H ATOM 71367 H2 WAT 5422 29.643 93.531 23.933 1.00 0.00 H TER 71369 WAT 5422 ATOM 71369 O WAT 5423 56.900 66.168 127.162 1.00 0.00 O ATOM 71370 H1 WAT 5423 57.792 66.111 126.818 1.00 0.00 H ATOM 71371 H2 WAT 5423 56.358 65.747 126.495 1.00 0.00 H TER 71373 WAT 5423 ATOM 71373 O WAT 5424 37.910 111.449 63.624 1.00 0.00 O ATOM 71374 H1 WAT 5424 38.143 111.557 62.702 1.00 0.00 H ATOM 71375 H2 WAT 5424 37.999 112.326 63.998 1.00 0.00 H TER 71377 WAT 5424 ATOM 71377 O WAT 5425 59.955 11.482 105.323 1.00 0.00 O ATOM 71378 H1 WAT 5425 60.279 12.342 105.588 1.00 0.00 H ATOM 71379 H2 WAT 5425 60.018 10.948 106.115 1.00 0.00 H TER 71381 WAT 5425 ATOM 71381 O WAT 5426 84.859 3.229 152.925 1.00 0.00 O ATOM 71382 H1 WAT 5426 84.734 2.937 152.023 1.00 0.00 H ATOM 71383 H2 WAT 5426 84.823 4.185 152.875 1.00 0.00 H TER 71385 WAT 5426 ATOM 71385 O WAT 5427 113.218 54.731 127.821 1.00 0.00 O ATOM 71386 H1 WAT 5427 113.302 53.836 127.492 1.00 0.00 H ATOM 71387 H2 WAT 5427 112.833 55.219 127.092 1.00 0.00 H TER 71389 WAT 5427 ATOM 71389 O WAT 5428 109.665 13.655 95.492 1.00 0.00 O ATOM 71390 H1 WAT 5428 110.098 14.366 95.018 1.00 0.00 H ATOM 71391 H2 WAT 5428 109.910 12.864 95.012 1.00 0.00 H TER 71393 WAT 5428 ATOM 71393 O WAT 5429 49.805 120.238 134.078 1.00 0.00 O ATOM 71394 H1 WAT 5429 49.214 119.737 133.515 1.00 0.00 H ATOM 71395 H2 WAT 5429 49.230 120.649 134.724 1.00 0.00 H TER 71397 WAT 5429 ATOM 71397 O WAT 5430 112.640 114.470 101.805 1.00 0.00 O ATOM 71398 H1 WAT 5430 112.757 113.643 102.272 1.00 0.00 H ATOM 71399 H2 WAT 5430 113.342 115.031 102.132 1.00 0.00 H TER 71401 WAT 5430 ATOM 71401 O WAT 5431 15.458 72.496 79.583 1.00 0.00 O ATOM 71402 H1 WAT 5431 14.929 73.069 80.139 1.00 0.00 H ATOM 71403 H2 WAT 5431 16.265 72.359 80.080 1.00 0.00 H TER 71405 WAT 5431 ATOM 71405 O WAT 5432 35.576 57.310 6.624 1.00 0.00 O ATOM 71406 H1 WAT 5432 35.202 56.556 7.081 1.00 0.00 H ATOM 71407 H2 WAT 5432 35.070 58.058 6.942 1.00 0.00 H TER 71409 WAT 5432 ATOM 71409 O WAT 5433 35.259 110.686 124.508 1.00 0.00 O ATOM 71410 H1 WAT 5433 34.437 110.495 124.055 1.00 0.00 H ATOM 71411 H2 WAT 5433 35.740 111.250 123.902 1.00 0.00 H TER 71413 WAT 5433 ATOM 71413 O WAT 5434 27.339 45.521 89.813 1.00 0.00 O ATOM 71414 H1 WAT 5434 26.470 45.767 89.496 1.00 0.00 H ATOM 71415 H2 WAT 5434 27.763 46.353 90.021 1.00 0.00 H TER 71417 WAT 5434 ATOM 71417 O WAT 5435 12.540 55.756 72.750 1.00 0.00 O ATOM 71418 H1 WAT 5435 12.089 54.916 72.671 1.00 0.00 H ATOM 71419 H2 WAT 5435 12.107 56.192 73.485 1.00 0.00 H TER 71421 WAT 5435 ATOM 71421 O WAT 5436 114.686 44.587 152.095 1.00 0.00 O ATOM 71422 H1 WAT 5436 113.851 45.051 152.027 1.00 0.00 H ATOM 71423 H2 WAT 5436 115.296 45.240 152.438 1.00 0.00 H TER 71425 WAT 5436 ATOM 71425 O WAT 5437 40.154 34.292 138.809 1.00 0.00 O ATOM 71426 H1 WAT 5437 39.213 34.158 138.700 1.00 0.00 H ATOM 71427 H2 WAT 5437 40.227 35.152 139.222 1.00 0.00 H TER 71429 WAT 5437 ATOM 71429 O WAT 5438 73.034 127.385 71.378 1.00 0.00 O ATOM 71430 H1 WAT 5438 73.792 127.949 71.535 1.00 0.00 H ATOM 71431 H2 WAT 5438 72.560 127.814 70.666 1.00 0.00 H TER 71433 WAT 5438 ATOM 71433 O WAT 5439 29.786 30.575 130.564 1.00 0.00 O ATOM 71434 H1 WAT 5439 29.255 31.307 130.251 1.00 0.00 H ATOM 71435 H2 WAT 5439 29.307 30.238 131.321 1.00 0.00 H TER 71437 WAT 5439 ATOM 71437 O WAT 5440 54.647 131.609 70.986 1.00 0.00 O ATOM 71438 H1 WAT 5440 55.446 131.890 71.432 1.00 0.00 H ATOM 71439 H2 WAT 5440 53.979 132.227 71.281 1.00 0.00 H TER 71441 WAT 5440 ATOM 71441 O WAT 5441 113.978 30.374 11.686 1.00 0.00 O ATOM 71442 H1 WAT 5441 113.435 31.062 11.301 1.00 0.00 H ATOM 71443 H2 WAT 5441 114.003 30.584 12.620 1.00 0.00 H TER 71445 WAT 5441 ATOM 71445 O WAT 5442 64.512 47.045 62.524 1.00 0.00 O ATOM 71446 H1 WAT 5442 65.366 47.232 62.914 1.00 0.00 H ATOM 71447 H2 WAT 5442 64.511 47.537 61.703 1.00 0.00 H TER 71449 WAT 5442 ATOM 71449 O WAT 5443 82.566 94.848 68.612 1.00 0.00 O ATOM 71450 H1 WAT 5443 82.962 95.603 69.047 1.00 0.00 H ATOM 71451 H2 WAT 5443 83.286 94.227 68.506 1.00 0.00 H TER 71453 WAT 5443 ATOM 71453 O WAT 5444 144.757 5.815 117.195 1.00 0.00 O ATOM 71454 H1 WAT 5444 144.106 5.755 116.496 1.00 0.00 H ATOM 71455 H2 WAT 5444 144.622 6.684 117.574 1.00 0.00 H TER 71457 WAT 5444 ATOM 71457 O WAT 5445 60.928 64.033 82.033 1.00 0.00 O ATOM 71458 H1 WAT 5445 61.145 64.747 81.434 1.00 0.00 H ATOM 71459 H2 WAT 5445 61.588 64.091 82.724 1.00 0.00 H TER 71461 WAT 5445 ATOM 71461 O WAT 5446 15.985 10.047 131.952 1.00 0.00 O ATOM 71462 H1 WAT 5446 15.029 10.018 131.919 1.00 0.00 H ATOM 71463 H2 WAT 5446 16.185 10.855 132.425 1.00 0.00 H TER 71465 WAT 5446 ATOM 71465 O WAT 5447 93.269 47.865 2.371 1.00 0.00 O ATOM 71466 H1 WAT 5447 93.530 48.550 1.754 1.00 0.00 H ATOM 71467 H2 WAT 5447 93.658 48.133 3.204 1.00 0.00 H TER 71469 WAT 5447 ATOM 71469 O WAT 5448 42.761 60.785 117.961 1.00 0.00 O ATOM 71470 H1 WAT 5448 42.603 61.200 118.809 1.00 0.00 H ATOM 71471 H2 WAT 5448 43.707 60.856 117.833 1.00 0.00 H TER 71473 WAT 5448 ATOM 71473 O WAT 5449 38.266 10.093 132.163 1.00 0.00 O ATOM 71474 H1 WAT 5449 37.938 10.987 132.064 1.00 0.00 H ATOM 71475 H2 WAT 5449 37.477 9.557 132.251 1.00 0.00 H TER 71477 WAT 5449 ATOM 71477 O WAT 5450 93.400 111.302 89.838 1.00 0.00 O ATOM 71478 H1 WAT 5450 93.773 111.353 90.718 1.00 0.00 H ATOM 71479 H2 WAT 5450 93.767 110.499 89.468 1.00 0.00 H TER 71481 WAT 5450 ATOM 71481 O WAT 5451 83.637 126.584 94.239 1.00 0.00 O ATOM 71482 H1 WAT 5451 82.881 126.269 94.735 1.00 0.00 H ATOM 71483 H2 WAT 5451 83.329 127.385 93.817 1.00 0.00 H TER 71485 WAT 5451 ATOM 71485 O WAT 5452 116.902 33.215 112.013 1.00 0.00 O ATOM 71486 H1 WAT 5452 116.740 33.613 111.158 1.00 0.00 H ATOM 71487 H2 WAT 5452 116.581 32.317 111.924 1.00 0.00 H TER 71489 WAT 5452 ATOM 71489 O WAT 5453 19.725 67.062 1.740 1.00 0.00 O ATOM 71490 H1 WAT 5453 19.712 66.210 2.177 1.00 0.00 H ATOM 71491 H2 WAT 5453 18.923 67.074 1.217 1.00 0.00 H TER 71493 WAT 5453 ATOM 71493 O WAT 5454 35.463 114.859 21.118 1.00 0.00 O ATOM 71494 H1 WAT 5454 35.963 115.321 20.445 1.00 0.00 H ATOM 71495 H2 WAT 5454 36.103 114.283 21.538 1.00 0.00 H TER 71497 WAT 5454 ATOM 71497 O WAT 5455 31.289 90.653 109.920 1.00 0.00 O ATOM 71498 H1 WAT 5455 30.341 90.604 110.039 1.00 0.00 H ATOM 71499 H2 WAT 5455 31.644 90.056 110.579 1.00 0.00 H TER 71501 WAT 5455 ATOM 71501 O WAT 5456 0.773 79.925 152.906 1.00 0.00 O ATOM 71502 H1 WAT 5456 1.064 80.801 153.157 1.00 0.00 H ATOM 71503 H2 WAT 5456 1.145 79.349 153.574 1.00 0.00 H TER 71505 WAT 5456 ATOM 71505 O WAT 5457 17.704 111.528 156.098 1.00 0.00 O ATOM 71506 H1 WAT 5457 18.548 111.196 155.793 1.00 0.00 H ATOM 71507 H2 WAT 5457 17.316 110.794 156.575 1.00 0.00 H TER 71509 WAT 5457 ATOM 71509 O WAT 5458 129.515 135.529 111.168 1.00 0.00 O ATOM 71510 H1 WAT 5458 129.163 135.205 110.339 1.00 0.00 H ATOM 71511 H2 WAT 5458 129.663 136.463 111.017 1.00 0.00 H TER 71513 WAT 5458 ATOM 71513 O WAT 5459 8.547 13.503 149.740 1.00 0.00 O ATOM 71514 H1 WAT 5459 8.958 12.639 149.770 1.00 0.00 H ATOM 71515 H2 WAT 5459 8.198 13.633 150.622 1.00 0.00 H TER 71517 WAT 5459 ATOM 71517 O WAT 5460 86.536 85.598 147.374 1.00 0.00 O ATOM 71518 H1 WAT 5460 85.788 85.948 147.857 1.00 0.00 H ATOM 71519 H2 WAT 5460 86.824 84.846 147.891 1.00 0.00 H TER 71521 WAT 5460 ATOM 71521 O WAT 5461 86.667 110.170 71.151 1.00 0.00 O ATOM 71522 H1 WAT 5461 86.622 109.215 71.116 1.00 0.00 H ATOM 71523 H2 WAT 5461 86.531 110.450 70.246 1.00 0.00 H TER 71525 WAT 5461 ATOM 71525 O WAT 5462 10.532 143.334 137.957 1.00 0.00 O ATOM 71526 H1 WAT 5462 11.121 143.570 138.673 1.00 0.00 H ATOM 71527 H2 WAT 5462 10.865 142.495 137.639 1.00 0.00 H TER 71529 WAT 5462 ATOM 71529 O WAT 5463 16.753 0.760 63.002 1.00 0.00 O ATOM 71530 H1 WAT 5463 16.915 0.682 62.062 1.00 0.00 H ATOM 71531 H2 WAT 5463 16.030 1.385 63.069 1.00 0.00 H TER 71533 WAT 5463 ATOM 71533 O WAT 5464 131.293 101.526 143.340 1.00 0.00 O ATOM 71534 H1 WAT 5464 131.392 101.884 144.222 1.00 0.00 H ATOM 71535 H2 WAT 5464 132.138 101.687 142.920 1.00 0.00 H TER 71537 WAT 5464 ATOM 71537 O WAT 5465 5.404 47.375 87.682 1.00 0.00 O ATOM 71538 H1 WAT 5465 6.023 47.951 87.235 1.00 0.00 H ATOM 71539 H2 WAT 5465 5.558 46.512 87.296 1.00 0.00 H TER 71541 WAT 5465 ATOM 71541 O WAT 5466 99.796 104.853 143.917 1.00 0.00 O ATOM 71542 H1 WAT 5466 100.655 104.434 143.963 1.00 0.00 H ATOM 71543 H2 WAT 5466 99.187 104.189 144.240 1.00 0.00 H TER 71545 WAT 5466 ATOM 71545 O WAT 5467 59.608 33.191 7.163 1.00 0.00 O ATOM 71546 H1 WAT 5467 59.091 33.293 6.364 1.00 0.00 H ATOM 71547 H2 WAT 5467 58.958 33.162 7.866 1.00 0.00 H TER 71549 WAT 5467 ATOM 71549 O WAT 5468 42.484 82.314 8.572 1.00 0.00 O ATOM 71550 H1 WAT 5468 43.161 82.580 9.194 1.00 0.00 H ATOM 71551 H2 WAT 5468 42.844 81.539 8.142 1.00 0.00 H TER 71553 WAT 5468 ATOM 71553 O WAT 5469 63.539 26.516 21.650 1.00 0.00 O ATOM 71554 H1 WAT 5469 63.403 27.171 22.335 1.00 0.00 H ATOM 71555 H2 WAT 5469 64.239 26.878 21.107 1.00 0.00 H TER 71557 WAT 5469 ATOM 71557 O WAT 5470 63.183 133.519 107.921 1.00 0.00 O ATOM 71558 H1 WAT 5470 62.793 134.179 107.348 1.00 0.00 H ATOM 71559 H2 WAT 5470 62.844 133.727 108.792 1.00 0.00 H TER 71561 WAT 5470 ATOM 71561 O WAT 5471 56.931 9.694 24.259 1.00 0.00 O ATOM 71562 H1 WAT 5471 57.090 8.960 23.665 1.00 0.00 H ATOM 71563 H2 WAT 5471 56.006 9.618 24.492 1.00 0.00 H TER 71565 WAT 5471 ATOM 71565 O WAT 5472 47.842 56.975 4.386 1.00 0.00 O ATOM 71566 H1 WAT 5472 47.900 56.605 3.505 1.00 0.00 H ATOM 71567 H2 WAT 5472 48.732 56.910 4.732 1.00 0.00 H TER 71569 WAT 5472 ATOM 71569 O WAT 5473 106.970 3.561 77.587 1.00 0.00 O ATOM 71570 H1 WAT 5473 107.696 3.976 77.121 1.00 0.00 H ATOM 71571 H2 WAT 5473 106.986 2.650 77.292 1.00 0.00 H TER 71573 WAT 5473 ATOM 71573 O WAT 5474 21.296 86.314 145.722 1.00 0.00 O ATOM 71574 H1 WAT 5474 20.379 86.553 145.858 1.00 0.00 H ATOM 71575 H2 WAT 5474 21.753 87.151 145.643 1.00 0.00 H TER 71577 WAT 5474 ATOM 71577 O WAT 5475 26.644 28.545 82.481 1.00 0.00 O ATOM 71578 H1 WAT 5475 25.972 28.447 81.807 1.00 0.00 H ATOM 71579 H2 WAT 5475 26.529 29.438 82.805 1.00 0.00 H TER 71581 WAT 5475 ATOM 71581 O WAT 5476 63.105 98.912 145.569 1.00 0.00 O ATOM 71582 H1 WAT 5476 63.248 98.548 144.695 1.00 0.00 H ATOM 71583 H2 WAT 5476 62.646 98.220 146.045 1.00 0.00 H TER 71585 WAT 5476 ATOM 71585 O WAT 5477 65.795 74.026 90.623 1.00 0.00 O ATOM 71586 H1 WAT 5477 65.029 73.587 90.994 1.00 0.00 H ATOM 71587 H2 WAT 5477 65.517 74.934 90.504 1.00 0.00 H TER 71589 WAT 5477 ATOM 71589 O WAT 5478 106.304 55.987 97.420 1.00 0.00 O ATOM 71590 H1 WAT 5478 107.174 56.318 97.643 1.00 0.00 H ATOM 71591 H2 WAT 5478 106.296 55.091 97.758 1.00 0.00 H TER 71593 WAT 5478 ATOM 71593 O WAT 5479 55.254 124.476 51.695 1.00 0.00 O ATOM 71594 H1 WAT 5479 54.749 123.685 51.886 1.00 0.00 H ATOM 71595 H2 WAT 5479 55.228 124.979 52.508 1.00 0.00 H TER 71597 WAT 5479 ATOM 71597 O WAT 5480 132.865 125.325 86.743 1.00 0.00 O ATOM 71598 H1 WAT 5480 132.383 125.509 85.936 1.00 0.00 H ATOM 71599 H2 WAT 5480 132.583 126.007 87.352 1.00 0.00 H TER 71601 WAT 5480 ATOM 71601 O WAT 5481 79.728 114.635 116.309 1.00 0.00 O ATOM 71602 H1 WAT 5481 79.236 113.869 116.014 1.00 0.00 H ATOM 71603 H2 WAT 5481 80.081 115.016 115.504 1.00 0.00 H TER 71605 WAT 5481 ATOM 71605 O WAT 5482 12.425 27.744 74.417 1.00 0.00 O ATOM 71606 H1 WAT 5482 12.152 27.924 73.518 1.00 0.00 H ATOM 71607 H2 WAT 5482 13.191 28.301 74.552 1.00 0.00 H TER 71609 WAT 5482 ATOM 71609 O WAT 5483 61.661 140.773 58.999 1.00 0.00 O ATOM 71610 H1 WAT 5483 60.901 140.857 58.423 1.00 0.00 H ATOM 71611 H2 WAT 5483 62.414 140.918 58.425 1.00 0.00 H TER 71613 WAT 5483 ATOM 71613 O WAT 5484 54.303 137.133 151.147 1.00 0.00 O ATOM 71614 H1 WAT 5484 54.226 136.895 152.071 1.00 0.00 H ATOM 71615 H2 WAT 5484 54.654 138.023 151.156 1.00 0.00 H TER 71617 WAT 5484 ATOM 71617 O WAT 5485 57.956 39.453 149.135 1.00 0.00 O ATOM 71618 H1 WAT 5485 57.932 39.994 148.346 1.00 0.00 H ATOM 71619 H2 WAT 5485 57.254 38.815 149.010 1.00 0.00 H TER 71621 WAT 5485 ATOM 71621 O WAT 5486 74.648 11.446 20.854 1.00 0.00 O ATOM 71622 H1 WAT 5486 75.234 12.198 20.770 1.00 0.00 H ATOM 71623 H2 WAT 5486 74.900 11.038 21.683 1.00 0.00 H TER 71625 WAT 5486 ATOM 71625 O WAT 5487 83.656 4.753 130.822 1.00 0.00 O ATOM 71626 H1 WAT 5487 84.599 4.824 130.674 1.00 0.00 H ATOM 71627 H2 WAT 5487 83.432 5.536 131.325 1.00 0.00 H TER 71629 WAT 5487 ATOM 71629 O WAT 5488 18.660 87.600 8.995 1.00 0.00 O ATOM 71630 H1 WAT 5488 18.866 87.354 9.897 1.00 0.00 H ATOM 71631 H2 WAT 5488 19.235 88.342 8.812 1.00 0.00 H TER 71633 WAT 5488 ATOM 71633 O WAT 5489 32.978 67.720 158.281 1.00 0.00 O ATOM 71634 H1 WAT 5489 33.275 68.608 158.077 1.00 0.00 H ATOM 71635 H2 WAT 5489 33.698 67.156 157.996 1.00 0.00 H TER 71637 WAT 5489 ATOM 71637 O WAT 5490 111.901 92.247 118.427 1.00 0.00 O ATOM 71638 H1 WAT 5490 111.450 92.976 118.002 1.00 0.00 H ATOM 71639 H2 WAT 5490 111.218 91.590 118.565 1.00 0.00 H TER 71641 WAT 5490 ATOM 71641 O WAT 5491 118.446 70.088 17.638 1.00 0.00 O ATOM 71642 H1 WAT 5491 117.801 70.615 18.109 1.00 0.00 H ATOM 71643 H2 WAT 5491 118.194 69.183 17.820 1.00 0.00 H TER 71645 WAT 5491 ATOM 71645 O WAT 5492 115.177 111.005 89.927 1.00 0.00 O ATOM 71646 H1 WAT 5492 114.824 111.490 89.180 1.00 0.00 H ATOM 71647 H2 WAT 5492 115.975 110.597 89.592 1.00 0.00 H TER 71649 WAT 5492 ATOM 71649 O WAT 5493 131.048 130.887 157.479 1.00 0.00 O ATOM 71650 H1 WAT 5493 131.624 131.116 156.749 1.00 0.00 H ATOM 71651 H2 WAT 5493 130.943 131.703 157.967 1.00 0.00 H TER 71653 WAT 5493 ATOM 71653 O WAT 5494 113.688 63.440 90.836 1.00 0.00 O ATOM 71654 H1 WAT 5494 113.607 63.592 89.895 1.00 0.00 H ATOM 71655 H2 WAT 5494 114.417 62.825 90.917 1.00 0.00 H TER 71657 WAT 5494 ATOM 71657 O WAT 5495 54.663 92.591 117.355 1.00 0.00 O ATOM 71658 H1 WAT 5495 55.594 92.579 117.576 1.00 0.00 H ATOM 71659 H2 WAT 5495 54.383 91.681 117.451 1.00 0.00 H TER 71661 WAT 5495 ATOM 71661 O WAT 5496 65.123 116.516 63.516 1.00 0.00 O ATOM 71662 H1 WAT 5496 65.857 117.130 63.556 1.00 0.00 H ATOM 71663 H2 WAT 5496 64.762 116.631 62.637 1.00 0.00 H TER 71665 WAT 5496 ATOM 71665 O WAT 5497 104.353 116.351 113.043 1.00 0.00 O ATOM 71666 H1 WAT 5497 104.858 115.561 112.852 1.00 0.00 H ATOM 71667 H2 WAT 5497 104.497 116.507 113.976 1.00 0.00 H TER 71669 WAT 5497 ATOM 71669 O WAT 5498 44.107 2.858 139.904 1.00 0.00 O ATOM 71670 H1 WAT 5498 43.668 3.708 139.872 1.00 0.00 H ATOM 71671 H2 WAT 5498 43.587 2.344 140.522 1.00 0.00 H TER 71673 WAT 5498 ATOM 71673 O WAT 5499 26.034 51.678 62.197 1.00 0.00 O ATOM 71674 H1 WAT 5499 26.036 51.460 61.265 1.00 0.00 H ATOM 71675 H2 WAT 5499 26.958 51.793 62.418 1.00 0.00 H TER 71677 WAT 5499 ATOM 71677 O WAT 5500 9.446 13.258 7.725 1.00 0.00 O ATOM 71678 H1 WAT 5500 9.618 13.293 8.666 1.00 0.00 H ATOM 71679 H2 WAT 5500 10.081 12.626 7.389 1.00 0.00 H TER 71681 WAT 5500 ATOM 71681 O WAT 5501 44.720 59.370 141.138 1.00 0.00 O ATOM 71682 H1 WAT 5501 44.817 58.419 141.186 1.00 0.00 H ATOM 71683 H2 WAT 5501 45.168 59.616 140.328 1.00 0.00 H TER 71685 WAT 5501 ATOM 71685 O WAT 5502 17.605 24.759 142.578 1.00 0.00 O ATOM 71686 H1 WAT 5502 17.545 24.301 141.739 1.00 0.00 H ATOM 71687 H2 WAT 5502 17.972 24.110 143.179 1.00 0.00 H TER 71689 WAT 5502 ATOM 71689 O WAT 5503 125.157 26.756 20.092 1.00 0.00 O ATOM 71690 H1 WAT 5503 125.238 26.189 19.325 1.00 0.00 H ATOM 71691 H2 WAT 5503 125.966 27.267 20.099 1.00 0.00 H TER 71693 WAT 5503 ATOM 71693 O WAT 5504 82.747 115.374 75.003 1.00 0.00 O ATOM 71694 H1 WAT 5504 81.820 115.610 75.030 1.00 0.00 H ATOM 71695 H2 WAT 5504 83.199 116.199 74.828 1.00 0.00 H TER 71697 WAT 5504 ATOM 71697 O WAT 5505 102.041 101.438 109.676 1.00 0.00 O ATOM 71698 H1 WAT 5505 102.983 101.372 109.518 1.00 0.00 H ATOM 71699 H2 WAT 5505 101.869 102.378 109.715 1.00 0.00 H TER 71701 WAT 5505 ATOM 71701 O WAT 5506 104.431 128.676 121.224 1.00 0.00 O ATOM 71702 H1 WAT 5506 103.651 129.085 121.599 1.00 0.00 H ATOM 71703 H2 WAT 5506 105.050 128.629 121.953 1.00 0.00 H TER 71705 WAT 5506 ATOM 71705 O WAT 5507 141.405 135.253 4.655 1.00 0.00 O ATOM 71706 H1 WAT 5507 141.149 136.140 4.404 1.00 0.00 H ATOM 71707 H2 WAT 5507 140.582 134.766 4.686 1.00 0.00 H TER 71709 WAT 5507 ATOM 71709 O WAT 5508 25.395 38.862 106.521 1.00 0.00 O ATOM 71710 H1 WAT 5508 25.733 38.283 107.204 1.00 0.00 H ATOM 71711 H2 WAT 5508 26.132 39.432 106.303 1.00 0.00 H TER 71713 WAT 5508 ATOM 71713 O WAT 5509 47.223 85.112 121.665 1.00 0.00 O ATOM 71714 H1 WAT 5509 47.487 84.548 122.392 1.00 0.00 H ATOM 71715 H2 WAT 5509 47.024 85.954 122.076 1.00 0.00 H TER 71717 WAT 5509 ATOM 71717 O WAT 5510 34.070 144.035 73.865 1.00 0.00 O ATOM 71718 H1 WAT 5510 34.727 143.940 74.555 1.00 0.00 H ATOM 71719 H2 WAT 5510 34.136 143.226 73.358 1.00 0.00 H TER 71721 WAT 5510 ATOM 71721 O WAT 5511 76.404 107.630 108.020 1.00 0.00 O ATOM 71722 H1 WAT 5511 75.559 107.507 107.588 1.00 0.00 H ATOM 71723 H2 WAT 5511 76.629 108.545 107.851 1.00 0.00 H TER 71725 WAT 5511 ATOM 71725 O WAT 5512 27.968 61.909 109.518 1.00 0.00 O ATOM 71726 H1 WAT 5512 28.264 62.625 108.957 1.00 0.00 H ATOM 71727 H2 WAT 5512 27.237 62.278 110.012 1.00 0.00 H TER 71729 WAT 5512 ATOM 71729 O WAT 5513 11.598 1.480 131.482 1.00 0.00 O ATOM 71730 H1 WAT 5513 12.529 1.423 131.269 1.00 0.00 H ATOM 71731 H2 WAT 5513 11.441 2.414 131.620 1.00 0.00 H TER 71733 WAT 5513 ATOM 71733 O WAT 5514 48.989 116.701 68.025 1.00 0.00 O ATOM 71734 H1 WAT 5514 48.328 116.895 68.689 1.00 0.00 H ATOM 71735 H2 WAT 5514 48.719 117.212 67.261 1.00 0.00 H TER 71737 WAT 5514 ATOM 71737 O WAT 5515 46.633 56.728 156.411 1.00 0.00 O ATOM 71738 H1 WAT 5515 47.395 56.148 156.424 1.00 0.00 H ATOM 71739 H2 WAT 5515 46.929 57.501 155.930 1.00 0.00 H TER 71741 WAT 5515 ATOM 71741 O WAT 5516 10.282 119.598 104.753 1.00 0.00 O ATOM 71742 H1 WAT 5516 10.974 119.063 104.365 1.00 0.00 H ATOM 71743 H2 WAT 5516 10.743 120.335 105.151 1.00 0.00 H TER 71745 WAT 5516 ATOM 71745 O WAT 5517 52.830 112.395 71.231 1.00 0.00 O ATOM 71746 H1 WAT 5517 53.307 113.149 70.882 1.00 0.00 H ATOM 71747 H2 WAT 5517 52.970 112.440 72.176 1.00 0.00 H TER 71749 WAT 5517 ATOM 71749 O WAT 5518 33.929 71.951 65.067 1.00 0.00 O ATOM 71750 H1 WAT 5518 33.832 71.009 64.927 1.00 0.00 H ATOM 71751 H2 WAT 5518 34.226 72.028 65.974 1.00 0.00 H TER 71753 WAT 5518 ATOM 71753 O WAT 5519 138.561 62.821 140.039 1.00 0.00 O ATOM 71754 H1 WAT 5519 137.914 62.162 140.289 1.00 0.00 H ATOM 71755 H2 WAT 5519 139.286 62.688 140.649 1.00 0.00 H TER 71757 WAT 5519 ATOM 71757 O WAT 5520 55.586 87.477 122.089 1.00 0.00 O ATOM 71758 H1 WAT 5520 55.796 87.540 121.157 1.00 0.00 H ATOM 71759 H2 WAT 5520 55.038 88.243 122.263 1.00 0.00 H TER 71761 WAT 5520 ATOM 71761 O WAT 5521 58.043 3.249 64.841 1.00 0.00 O ATOM 71762 H1 WAT 5521 57.174 3.183 64.445 1.00 0.00 H ATOM 71763 H2 WAT 5521 58.005 4.046 65.370 1.00 0.00 H TER 71765 WAT 5521 ATOM 71765 O WAT 5522 21.918 72.175 13.100 1.00 0.00 O ATOM 71766 H1 WAT 5522 22.816 72.437 12.897 1.00 0.00 H ATOM 71767 H2 WAT 5522 21.695 71.538 12.422 1.00 0.00 H TER 71769 WAT 5522 ATOM 71769 O WAT 5523 41.462 11.231 138.160 1.00 0.00 O ATOM 71770 H1 WAT 5523 41.072 10.453 137.761 1.00 0.00 H ATOM 71771 H2 WAT 5523 42.061 11.567 137.494 1.00 0.00 H TER 71773 WAT 5523 ATOM 71773 O WAT 5524 75.276 29.770 90.707 1.00 0.00 O ATOM 71774 H1 WAT 5524 75.147 30.569 90.195 1.00 0.00 H ATOM 71775 H2 WAT 5524 75.603 29.131 90.074 1.00 0.00 H TER 71777 WAT 5524 ATOM 71777 O WAT 5525 104.124 144.905 84.653 1.00 0.00 O ATOM 71778 H1 WAT 5525 104.324 145.337 85.483 1.00 0.00 H ATOM 71779 H2 WAT 5525 104.975 144.785 84.234 1.00 0.00 H TER 71781 WAT 5525 ATOM 71781 O WAT 5526 26.154 7.084 68.317 1.00 0.00 O ATOM 71782 H1 WAT 5526 26.552 6.395 67.785 1.00 0.00 H ATOM 71783 H2 WAT 5526 26.275 7.883 67.804 1.00 0.00 H TER 71785 WAT 5526 ATOM 71785 O WAT 5527 67.500 71.242 13.723 1.00 0.00 O ATOM 71786 H1 WAT 5527 67.012 71.229 14.546 1.00 0.00 H ATOM 71787 H2 WAT 5527 67.389 70.361 13.365 1.00 0.00 H TER 71789 WAT 5527 ATOM 71789 O WAT 5528 77.257 137.612 108.270 1.00 0.00 O ATOM 71790 H1 WAT 5528 76.422 138.064 108.148 1.00 0.00 H ATOM 71791 H2 WAT 5528 77.466 137.259 107.405 1.00 0.00 H TER 71793 WAT 5528 ATOM 71793 O WAT 5529 6.288 13.936 94.275 1.00 0.00 O ATOM 71794 H1 WAT 5529 5.451 13.788 93.834 1.00 0.00 H ATOM 71795 H2 WAT 5529 6.946 13.797 93.594 1.00 0.00 H TER 71797 WAT 5529 ATOM 71797 O WAT 5530 136.037 131.509 156.263 1.00 0.00 O ATOM 71798 H1 WAT 5530 136.150 130.674 155.808 1.00 0.00 H ATOM 71799 H2 WAT 5530 136.026 131.276 157.191 1.00 0.00 H TER 71801 WAT 5530 ATOM 71801 O WAT 5531 110.771 108.827 142.448 1.00 0.00 O ATOM 71802 H1 WAT 5531 111.015 108.743 143.370 1.00 0.00 H ATOM 71803 H2 WAT 5531 111.556 108.563 141.968 1.00 0.00 H TER 71805 WAT 5531 ATOM 71805 O WAT 5532 59.210 25.523 15.950 1.00 0.00 O ATOM 71806 H1 WAT 5532 58.724 24.843 16.416 1.00 0.00 H ATOM 71807 H2 WAT 5532 58.951 26.339 16.379 1.00 0.00 H TER 71809 WAT 5532 ATOM 71809 O WAT 5533 109.900 52.794 72.403 1.00 0.00 O ATOM 71810 H1 WAT 5533 110.840 52.860 72.233 1.00 0.00 H ATOM 71811 H2 WAT 5533 109.700 53.556 72.946 1.00 0.00 H TER 71813 WAT 5533 ATOM 71813 O WAT 5534 56.154 61.476 79.161 1.00 0.00 O ATOM 71814 H1 WAT 5534 56.965 61.157 78.766 1.00 0.00 H ATOM 71815 H2 WAT 5534 55.762 60.701 79.563 1.00 0.00 H TER 71817 WAT 5534 ATOM 71817 O WAT 5535 140.409 80.380 150.829 1.00 0.00 O ATOM 71818 H1 WAT 5535 139.886 80.835 150.169 1.00 0.00 H ATOM 71819 H2 WAT 5535 140.376 80.952 151.597 1.00 0.00 H TER 71821 WAT 5535 ATOM 71821 O WAT 5536 24.389 95.527 68.227 1.00 0.00 O ATOM 71822 H1 WAT 5536 25.234 95.557 68.677 1.00 0.00 H ATOM 71823 H2 WAT 5536 24.576 95.091 67.395 1.00 0.00 H TER 71825 WAT 5536 ATOM 71825 O WAT 5537 101.967 36.705 76.351 1.00 0.00 O ATOM 71826 H1 WAT 5537 101.607 37.266 77.038 1.00 0.00 H ATOM 71827 H2 WAT 5537 101.200 36.306 75.941 1.00 0.00 H TER 71829 WAT 5537 ATOM 71829 O WAT 5538 7.352 113.342 77.542 1.00 0.00 O ATOM 71830 H1 WAT 5538 6.935 113.865 78.226 1.00 0.00 H ATOM 71831 H2 WAT 5538 8.290 113.475 77.676 1.00 0.00 H TER 71833 WAT 5538 ATOM 71833 O WAT 5539 3.114 18.448 85.521 1.00 0.00 O ATOM 71834 H1 WAT 5539 3.651 18.688 84.766 1.00 0.00 H ATOM 71835 H2 WAT 5539 2.847 17.545 85.348 1.00 0.00 H TER 71837 WAT 5539 ATOM 71837 O WAT 5540 81.197 43.417 83.276 1.00 0.00 O ATOM 71838 H1 WAT 5540 81.115 43.733 82.376 1.00 0.00 H ATOM 71839 H2 WAT 5540 80.395 43.713 83.707 1.00 0.00 H TER 71841 WAT 5540 ATOM 71841 O WAT 5541 134.650 87.142 133.486 1.00 0.00 O ATOM 71842 H1 WAT 5541 134.924 87.639 134.257 1.00 0.00 H ATOM 71843 H2 WAT 5541 133.699 87.069 133.573 1.00 0.00 H TER 71845 WAT 5541 ATOM 71845 O WAT 5542 2.151 65.142 95.415 1.00 0.00 O ATOM 71846 H1 WAT 5542 1.724 65.980 95.592 1.00 0.00 H ATOM 71847 H2 WAT 5542 2.455 64.843 96.272 1.00 0.00 H TER 71849 WAT 5542 ATOM 71849 O WAT 5543 78.807 39.624 75.663 1.00 0.00 O ATOM 71850 H1 WAT 5543 79.257 38.988 75.107 1.00 0.00 H ATOM 71851 H2 WAT 5543 79.511 40.089 76.115 1.00 0.00 H TER 71853 WAT 5543 ATOM 71853 O WAT 5544 106.137 13.760 113.834 1.00 0.00 O ATOM 71854 H1 WAT 5544 105.884 13.944 112.929 1.00 0.00 H ATOM 71855 H2 WAT 5544 105.317 13.799 114.325 1.00 0.00 H TER 71857 WAT 5544 ATOM 71857 O WAT 5545 4.339 16.748 18.722 1.00 0.00 O ATOM 71858 H1 WAT 5545 5.270 16.966 18.767 1.00 0.00 H ATOM 71859 H2 WAT 5545 4.315 15.884 18.311 1.00 0.00 H TER 71861 WAT 5545 ATOM 71861 O WAT 5546 114.590 43.128 22.714 1.00 0.00 O ATOM 71862 H1 WAT 5546 114.754 42.185 22.715 1.00 0.00 H ATOM 71863 H2 WAT 5546 115.437 43.519 22.499 1.00 0.00 H TER 71865 WAT 5546 ATOM 71865 O WAT 5547 88.201 90.027 128.623 1.00 0.00 O ATOM 71866 H1 WAT 5547 88.495 90.555 129.366 1.00 0.00 H ATOM 71867 H2 WAT 5547 87.315 90.340 128.443 1.00 0.00 H TER 71869 WAT 5547 ATOM 71869 O WAT 5548 137.506 27.507 69.522 1.00 0.00 O ATOM 71870 H1 WAT 5548 137.968 28.309 69.277 1.00 0.00 H ATOM 71871 H2 WAT 5548 138.192 26.923 69.844 1.00 0.00 H TER 71873 WAT 5548 ATOM 71873 O WAT 5549 20.994 63.753 66.973 1.00 0.00 O ATOM 71874 H1 WAT 5549 21.609 64.093 67.623 1.00 0.00 H ATOM 71875 H2 WAT 5549 20.367 64.464 66.841 1.00 0.00 H TER 71877 WAT 5549 ATOM 71877 O WAT 5550 89.053 81.673 121.467 1.00 0.00 O ATOM 71878 H1 WAT 5550 89.929 81.362 121.237 1.00 0.00 H ATOM 71879 H2 WAT 5550 89.017 82.565 121.123 1.00 0.00 H TER 71881 WAT 5550 ATOM 71881 O WAT 5551 64.114 125.563 108.817 1.00 0.00 O ATOM 71882 H1 WAT 5551 63.326 125.296 109.290 1.00 0.00 H ATOM 71883 H2 WAT 5551 63.811 126.237 108.208 1.00 0.00 H TER 71885 WAT 5551 ATOM 71885 O WAT 5552 88.849 93.352 2.578 1.00 0.00 O ATOM 71886 H1 WAT 5552 88.173 93.279 3.252 1.00 0.00 H ATOM 71887 H2 WAT 5552 89.283 92.499 2.582 1.00 0.00 H TER 71889 WAT 5552 ATOM 71889 O WAT 5553 100.004 122.949 13.459 1.00 0.00 O ATOM 71890 H1 WAT 5553 100.476 123.485 12.822 1.00 0.00 H ATOM 71891 H2 WAT 5553 100.644 122.777 14.150 1.00 0.00 H TER 71893 WAT 5553 ATOM 71893 O WAT 5554 106.688 23.463 67.976 1.00 0.00 O ATOM 71894 H1 WAT 5554 105.822 23.140 68.224 1.00 0.00 H ATOM 71895 H2 WAT 5554 106.723 23.347 67.026 1.00 0.00 H TER 71897 WAT 5554 ATOM 71897 O WAT 5555 97.127 72.405 2.636 1.00 0.00 O ATOM 71898 H1 WAT 5555 97.987 72.005 2.506 1.00 0.00 H ATOM 71899 H2 WAT 5555 97.186 72.821 3.496 1.00 0.00 H TER 71901 WAT 5555 ATOM 71901 O WAT 5556 91.233 46.210 143.390 1.00 0.00 O ATOM 71902 H1 WAT 5556 91.332 45.271 143.235 1.00 0.00 H ATOM 71903 H2 WAT 5556 92.077 46.585 143.137 1.00 0.00 H TER 71905 WAT 5556 ATOM 71905 O WAT 5557 32.716 84.407 60.316 1.00 0.00 O ATOM 71906 H1 WAT 5557 32.179 85.018 59.811 1.00 0.00 H ATOM 71907 H2 WAT 5557 33.613 84.712 60.184 1.00 0.00 H TER 71909 WAT 5557 ATOM 71909 O WAT 5558 125.899 17.674 54.621 1.00 0.00 O ATOM 71910 H1 WAT 5558 126.456 18.165 55.226 1.00 0.00 H ATOM 71911 H2 WAT 5558 126.336 17.756 53.773 1.00 0.00 H TER 71913 WAT 5558 ATOM 71913 O WAT 5559 21.545 131.722 0.984 1.00 0.00 O ATOM 71914 H1 WAT 5559 21.348 132.650 1.112 1.00 0.00 H ATOM 71915 H2 WAT 5559 22.296 131.717 0.390 1.00 0.00 H TER 71917 WAT 5559 ATOM 71917 O WAT 5560 47.597 82.409 130.354 1.00 0.00 O ATOM 71918 H1 WAT 5560 48.419 82.899 130.365 1.00 0.00 H ATOM 71919 H2 WAT 5560 47.465 82.185 129.432 1.00 0.00 H TER 71921 WAT 5560 ATOM 71921 O WAT 5561 107.513 134.591 20.812 1.00 0.00 O ATOM 71922 H1 WAT 5561 107.505 133.883 20.167 1.00 0.00 H ATOM 71923 H2 WAT 5561 106.915 134.296 21.499 1.00 0.00 H TER 71925 WAT 5561 ATOM 71925 O WAT 5562 102.488 8.663 13.681 1.00 0.00 O ATOM 71926 H1 WAT 5562 102.487 9.259 12.932 1.00 0.00 H ATOM 71927 H2 WAT 5562 102.677 9.224 14.434 1.00 0.00 H TER 71929 WAT 5562 ATOM 71929 O WAT 5563 122.283 116.578 144.176 1.00 0.00 O ATOM 71930 H1 WAT 5563 121.825 117.230 143.645 1.00 0.00 H ATOM 71931 H2 WAT 5563 123.151 116.955 144.321 1.00 0.00 H TER 71933 WAT 5563 ATOM 71933 O WAT 5564 133.452 98.421 119.009 1.00 0.00 O ATOM 71934 H1 WAT 5564 133.331 97.964 119.841 1.00 0.00 H ATOM 71935 H2 WAT 5564 133.482 97.723 118.354 1.00 0.00 H TER 71937 WAT 5564 ATOM 71937 O WAT 5565 89.715 109.251 104.084 1.00 0.00 O ATOM 71938 H1 WAT 5565 90.247 108.880 104.788 1.00 0.00 H ATOM 71939 H2 WAT 5565 90.336 109.406 103.372 1.00 0.00 H TER 71941 WAT 5565 ATOM 71941 O WAT 5566 73.417 5.600 122.038 1.00 0.00 O ATOM 71942 H1 WAT 5566 72.613 5.572 122.558 1.00 0.00 H ATOM 71943 H2 WAT 5566 74.095 5.271 122.628 1.00 0.00 H TER 71945 WAT 5566 ATOM 71945 O WAT 5567 47.374 45.373 5.947 1.00 0.00 O ATOM 71946 H1 WAT 5567 47.330 44.765 6.686 1.00 0.00 H ATOM 71947 H2 WAT 5567 47.617 46.211 6.341 1.00 0.00 H TER 71949 WAT 5567 ATOM 71949 O WAT 5568 96.907 140.967 103.870 1.00 0.00 O ATOM 71950 H1 WAT 5568 96.718 141.901 103.785 1.00 0.00 H ATOM 71951 H2 WAT 5568 96.829 140.791 104.807 1.00 0.00 H TER 71953 WAT 5568 ATOM 71953 O WAT 5569 19.783 112.727 73.494 1.00 0.00 O ATOM 71954 H1 WAT 5569 20.104 113.618 73.636 1.00 0.00 H ATOM 71955 H2 WAT 5569 19.996 112.264 74.304 1.00 0.00 H TER 71957 WAT 5569 ATOM 71957 O WAT 5570 93.370 26.518 12.547 1.00 0.00 O ATOM 71958 H1 WAT 5570 93.552 25.645 12.199 1.00 0.00 H ATOM 71959 H2 WAT 5570 92.415 26.575 12.561 1.00 0.00 H TER 71961 WAT 5570 ATOM 71961 O WAT 5571 74.725 120.639 8.479 1.00 0.00 O ATOM 71962 H1 WAT 5571 75.422 120.315 9.049 1.00 0.00 H ATOM 71963 H2 WAT 5571 74.385 119.856 8.047 1.00 0.00 H TER 71965 WAT 5571 ATOM 71965 O WAT 5572 116.458 90.208 120.854 1.00 0.00 O ATOM 71966 H1 WAT 5572 116.350 91.122 121.114 1.00 0.00 H ATOM 71967 H2 WAT 5572 115.711 89.756 121.245 1.00 0.00 H TER 71969 WAT 5572 ATOM 71969 O WAT 5573 15.719 112.851 9.408 1.00 0.00 O ATOM 71970 H1 WAT 5573 14.971 112.401 9.015 1.00 0.00 H ATOM 71971 H2 WAT 5573 15.667 112.634 10.339 1.00 0.00 H TER 71973 WAT 5573 ATOM 71973 O WAT 5574 64.807 106.965 87.927 1.00 0.00 O ATOM 71974 H1 WAT 5574 64.518 106.055 88.007 1.00 0.00 H ATOM 71975 H2 WAT 5574 65.696 106.966 88.281 1.00 0.00 H TER 71977 WAT 5574 ATOM 71977 O WAT 5575 137.309 125.323 73.018 1.00 0.00 O ATOM 71978 H1 WAT 5575 136.953 125.814 72.278 1.00 0.00 H ATOM 71979 H2 WAT 5575 138.039 124.827 72.648 1.00 0.00 H TER 71981 WAT 5575 ATOM 71981 O WAT 5576 5.642 116.567 89.066 1.00 0.00 O ATOM 71982 H1 WAT 5576 5.487 115.697 88.698 1.00 0.00 H ATOM 71983 H2 WAT 5576 6.595 116.637 89.122 1.00 0.00 H TER 71985 WAT 5576 ATOM 71985 O WAT 5577 1.511 40.818 99.297 1.00 0.00 O ATOM 71986 H1 WAT 5577 0.958 40.037 99.290 1.00 0.00 H ATOM 71987 H2 WAT 5577 0.983 41.490 98.866 1.00 0.00 H TER 71989 WAT 5577 ATOM 71989 O WAT 5578 49.349 2.201 26.145 1.00 0.00 O ATOM 71990 H1 WAT 5578 48.953 1.329 26.172 1.00 0.00 H ATOM 71991 H2 WAT 5578 48.627 2.797 26.346 1.00 0.00 H TER 71993 WAT 5578 ATOM 71993 O WAT 5579 105.854 93.687 156.798 1.00 0.00 O ATOM 71994 H1 WAT 5579 105.215 94.399 156.846 1.00 0.00 H ATOM 71995 H2 WAT 5579 105.956 93.396 157.705 1.00 0.00 H TER 71997 WAT 5579 ATOM 71997 O WAT 5580 9.930 70.294 148.831 1.00 0.00 O ATOM 71998 H1 WAT 5580 10.269 70.889 148.162 1.00 0.00 H ATOM 71999 H2 WAT 5580 9.554 69.566 148.335 1.00 0.00 H TER 72001 WAT 5580 ATOM 72001 O WAT 5581 5.331 24.596 20.450 1.00 0.00 O ATOM 72002 H1 WAT 5581 4.495 24.162 20.619 1.00 0.00 H ATOM 72003 H2 WAT 5581 5.705 24.741 21.319 1.00 0.00 H TER 72005 WAT 5581 ATOM 72005 O WAT 5582 85.207 34.588 90.766 1.00 0.00 O ATOM 72006 H1 WAT 5582 85.312 34.616 89.815 1.00 0.00 H ATOM 72007 H2 WAT 5582 86.097 34.676 91.107 1.00 0.00 H TER 72009 WAT 5582 ATOM 72009 O WAT 5583 127.452 83.185 72.964 1.00 0.00 O ATOM 72010 H1 WAT 5583 127.990 82.527 73.403 1.00 0.00 H ATOM 72011 H2 WAT 5583 127.382 82.873 72.061 1.00 0.00 H TER 72013 WAT 5583 ATOM 72013 O WAT 5584 116.564 42.909 153.755 1.00 0.00 O ATOM 72014 H1 WAT 5584 115.830 43.442 153.449 1.00 0.00 H ATOM 72015 H2 WAT 5584 116.468 42.079 153.289 1.00 0.00 H TER 72017 WAT 5584 ATOM 72017 O WAT 5585 8.119 116.244 113.588 1.00 0.00 O ATOM 72018 H1 WAT 5585 8.782 115.571 113.434 1.00 0.00 H ATOM 72019 H2 WAT 5585 7.396 115.778 114.006 1.00 0.00 H TER 72021 WAT 5585 ATOM 72021 O WAT 5586 93.785 40.923 89.473 1.00 0.00 O ATOM 72022 H1 WAT 5586 93.954 40.166 90.035 1.00 0.00 H ATOM 72023 H2 WAT 5586 94.621 41.088 89.037 1.00 0.00 H TER 72025 WAT 5586 ATOM 72025 O WAT 5587 90.119 79.731 127.249 1.00 0.00 O ATOM 72026 H1 WAT 5587 90.990 80.042 127.002 1.00 0.00 H ATOM 72027 H2 WAT 5587 89.759 80.433 127.790 1.00 0.00 H TER 72029 WAT 5587 ATOM 72029 O WAT 5588 78.490 110.846 117.615 1.00 0.00 O ATOM 72030 H1 WAT 5588 78.826 110.374 118.377 1.00 0.00 H ATOM 72031 H2 WAT 5588 77.612 111.125 117.875 1.00 0.00 H TER 72033 WAT 5588 ATOM 72033 O WAT 5589 138.289 131.646 87.693 1.00 0.00 O ATOM 72034 H1 WAT 5589 138.817 130.848 87.714 1.00 0.00 H ATOM 72035 H2 WAT 5589 138.356 131.953 86.789 1.00 0.00 H TER 72037 WAT 5589 ATOM 72037 O WAT 5590 80.117 137.480 137.457 1.00 0.00 O ATOM 72038 H1 WAT 5590 80.113 138.437 137.475 1.00 0.00 H ATOM 72039 H2 WAT 5590 80.375 137.258 136.563 1.00 0.00 H TER 72041 WAT 5590 ATOM 72041 O WAT 5591 133.773 44.504 83.032 1.00 0.00 O ATOM 72042 H1 WAT 5591 134.211 44.646 82.192 1.00 0.00 H ATOM 72043 H2 WAT 5591 133.043 43.920 82.825 1.00 0.00 H TER 72045 WAT 5591 ATOM 72045 O WAT 5592 96.494 21.493 95.964 1.00 0.00 O ATOM 72046 H1 WAT 5592 96.051 21.600 95.122 1.00 0.00 H ATOM 72047 H2 WAT 5592 97.067 22.256 96.031 1.00 0.00 H TER 72049 WAT 5592 ATOM 72049 O WAT 5593 121.474 102.022 119.752 1.00 0.00 O ATOM 72050 H1 WAT 5593 120.615 101.614 119.865 1.00 0.00 H ATOM 72051 H2 WAT 5593 121.377 102.572 118.975 1.00 0.00 H TER 72053 WAT 5593 ATOM 72053 O WAT 5594 104.010 21.183 17.380 1.00 0.00 O ATOM 72054 H1 WAT 5594 104.418 20.800 16.603 1.00 0.00 H ATOM 72055 H2 WAT 5594 104.497 21.993 17.532 1.00 0.00 H TER 72057 WAT 5594 ATOM 72057 O WAT 5595 58.171 105.846 158.422 1.00 0.00 O ATOM 72058 H1 WAT 5595 58.114 105.354 159.241 1.00 0.00 H ATOM 72059 H2 WAT 5595 57.263 105.935 158.132 1.00 0.00 H TER 72061 WAT 5595 ATOM 72061 O WAT 5596 88.478 79.637 14.253 1.00 0.00 O ATOM 72062 H1 WAT 5596 87.674 80.149 14.342 1.00 0.00 H ATOM 72063 H2 WAT 5596 88.327 79.084 13.487 1.00 0.00 H TER 72065 WAT 5596 ATOM 72065 O WAT 5597 20.510 99.150 118.237 1.00 0.00 O ATOM 72066 H1 WAT 5597 20.145 99.027 117.360 1.00 0.00 H ATOM 72067 H2 WAT 5597 21.362 98.717 118.205 1.00 0.00 H TER 72069 WAT 5597 ATOM 72069 O WAT 5598 88.085 83.347 59.436 1.00 0.00 O ATOM 72070 H1 WAT 5598 87.961 82.566 58.897 1.00 0.00 H ATOM 72071 H2 WAT 5598 87.936 84.078 58.835 1.00 0.00 H TER 72073 WAT 5598 ATOM 72073 O WAT 5599 81.391 7.568 16.350 1.00 0.00 O ATOM 72074 H1 WAT 5599 80.532 7.594 16.773 1.00 0.00 H ATOM 72075 H2 WAT 5599 82.015 7.678 17.067 1.00 0.00 H TER 72077 WAT 5599 ATOM 72077 O WAT 5600 79.449 104.904 127.509 1.00 0.00 O ATOM 72078 H1 WAT 5600 79.837 105.022 128.376 1.00 0.00 H ATOM 72079 H2 WAT 5600 78.910 104.117 127.593 1.00 0.00 H TER 72081 WAT 5600 ATOM 72081 O WAT 5601 107.540 102.826 96.321 1.00 0.00 O ATOM 72082 H1 WAT 5601 108.089 102.496 97.032 1.00 0.00 H ATOM 72083 H2 WAT 5601 107.961 103.643 96.053 1.00 0.00 H TER 72085 WAT 5601 ATOM 72085 O WAT 5602 35.641 122.705 85.031 1.00 0.00 O ATOM 72086 H1 WAT 5602 35.283 123.555 84.776 1.00 0.00 H ATOM 72087 H2 WAT 5602 34.978 122.332 85.613 1.00 0.00 H TER 72089 WAT 5602 ATOM 72089 O WAT 5603 70.887 7.590 57.413 1.00 0.00 O ATOM 72090 H1 WAT 5603 71.573 6.947 57.231 1.00 0.00 H ATOM 72091 H2 WAT 5603 70.570 7.853 56.549 1.00 0.00 H TER 72093 WAT 5603 ATOM 72093 O WAT 5604 138.564 132.015 118.174 1.00 0.00 O ATOM 72094 H1 WAT 5604 139.014 131.172 118.125 1.00 0.00 H ATOM 72095 H2 WAT 5604 139.102 132.540 118.767 1.00 0.00 H TER 72097 WAT 5604 ATOM 72097 O WAT 5605 49.035 37.101 24.098 1.00 0.00 O ATOM 72098 H1 WAT 5605 49.754 37.732 24.124 1.00 0.00 H ATOM 72099 H2 WAT 5605 49.217 36.500 24.821 1.00 0.00 H TER 72101 WAT 5605 ATOM 72101 O WAT 5606 4.349 24.476 94.714 1.00 0.00 O ATOM 72102 H1 WAT 5606 4.565 24.929 95.529 1.00 0.00 H ATOM 72103 H2 WAT 5606 3.951 25.151 94.163 1.00 0.00 H TER 72105 WAT 5606 ATOM 72105 O WAT 5607 55.815 133.546 129.783 1.00 0.00 O ATOM 72106 H1 WAT 5607 54.875 133.400 129.679 1.00 0.00 H ATOM 72107 H2 WAT 5607 56.022 134.231 129.148 1.00 0.00 H TER 72109 WAT 5607 ATOM 72109 O WAT 5608 53.187 139.784 118.484 1.00 0.00 O ATOM 72110 H1 WAT 5608 52.948 138.979 118.942 1.00 0.00 H ATOM 72111 H2 WAT 5608 53.973 140.092 118.934 1.00 0.00 H TER 72113 WAT 5608 ATOM 72113 O WAT 5609 127.488 38.331 100.418 1.00 0.00 O ATOM 72114 H1 WAT 5609 128.316 37.879 100.580 1.00 0.00 H ATOM 72115 H2 WAT 5609 127.177 38.582 101.288 1.00 0.00 H TER 72117 WAT 5609 ATOM 72117 O WAT 5610 65.721 78.706 96.158 1.00 0.00 O ATOM 72118 H1 WAT 5610 65.489 79.492 95.664 1.00 0.00 H ATOM 72119 H2 WAT 5610 65.265 78.805 96.994 1.00 0.00 H TER 72121 WAT 5610 ATOM 72121 O WAT 5611 85.481 18.582 76.262 1.00 0.00 O ATOM 72122 H1 WAT 5611 86.022 19.117 76.843 1.00 0.00 H ATOM 72123 H2 WAT 5611 86.103 18.002 75.822 1.00 0.00 H TER 72125 WAT 5611 ATOM 72125 O WAT 5612 115.131 51.533 129.327 1.00 0.00 O ATOM 72126 H1 WAT 5612 114.861 50.730 129.772 1.00 0.00 H ATOM 72127 H2 WAT 5612 114.988 52.224 129.974 1.00 0.00 H TER 72129 WAT 5612 ATOM 72129 O WAT 5613 138.988 21.940 2.435 1.00 0.00 O ATOM 72130 H1 WAT 5613 139.068 21.324 3.163 1.00 0.00 H ATOM 72131 H2 WAT 5613 138.483 21.466 1.775 1.00 0.00 H TER 72133 WAT 5613 ATOM 72133 O WAT 5614 63.620 108.876 152.534 1.00 0.00 O ATOM 72134 H1 WAT 5614 64.183 108.565 151.825 1.00 0.00 H ATOM 72135 H2 WAT 5614 63.064 109.539 152.124 1.00 0.00 H TER 72137 WAT 5614 ATOM 72137 O WAT 5615 132.123 61.960 64.375 1.00 0.00 O ATOM 72138 H1 WAT 5615 131.660 62.798 64.397 1.00 0.00 H ATOM 72139 H2 WAT 5615 132.677 62.013 63.596 1.00 0.00 H TER 72141 WAT 5615 ATOM 72141 O WAT 5616 111.615 72.328 84.539 1.00 0.00 O ATOM 72142 H1 WAT 5616 110.902 72.741 85.028 1.00 0.00 H ATOM 72143 H2 WAT 5616 111.412 71.393 84.564 1.00 0.00 H TER 72145 WAT 5616 ATOM 72145 O WAT 5617 60.718 17.591 56.190 1.00 0.00 O ATOM 72146 H1 WAT 5617 61.304 18.061 56.784 1.00 0.00 H ATOM 72147 H2 WAT 5617 60.200 18.279 55.772 1.00 0.00 H TER 72149 WAT 5617 ATOM 72149 O WAT 5618 50.271 30.698 149.877 1.00 0.00 O ATOM 72150 H1 WAT 5618 49.378 30.359 149.949 1.00 0.00 H ATOM 72151 H2 WAT 5618 50.168 31.649 149.907 1.00 0.00 H TER 72153 WAT 5618 ATOM 72153 O WAT 5619 112.256 44.273 99.777 1.00 0.00 O ATOM 72154 H1 WAT 5619 111.904 44.102 98.904 1.00 0.00 H ATOM 72155 H2 WAT 5619 112.348 43.407 100.173 1.00 0.00 H TER 72157 WAT 5619 ATOM 72157 O WAT 5620 9.614 98.100 124.015 1.00 0.00 O ATOM 72158 H1 WAT 5620 9.261 98.531 124.793 1.00 0.00 H ATOM 72159 H2 WAT 5620 9.415 98.701 123.297 1.00 0.00 H TER 72161 WAT 5620 ATOM 72161 O WAT 5621 71.983 79.829 134.567 1.00 0.00 O ATOM 72162 H1 WAT 5621 71.424 80.166 133.866 1.00 0.00 H ATOM 72163 H2 WAT 5621 71.573 79.003 134.824 1.00 0.00 H TER 72165 WAT 5621 ATOM 72165 O WAT 5622 41.836 87.291 115.530 1.00 0.00 O ATOM 72166 H1 WAT 5622 41.901 88.162 115.921 1.00 0.00 H ATOM 72167 H2 WAT 5622 40.897 87.155 115.401 1.00 0.00 H TER 72169 WAT 5622 ATOM 72169 O WAT 5623 119.831 76.038 70.156 1.00 0.00 O ATOM 72170 H1 WAT 5623 120.404 75.513 69.598 1.00 0.00 H ATOM 72171 H2 WAT 5623 119.768 75.539 70.971 1.00 0.00 H TER 72173 WAT 5623 ATOM 72173 O WAT 5624 55.707 143.965 22.788 1.00 0.00 O ATOM 72174 H1 WAT 5624 54.869 143.517 22.675 1.00 0.00 H ATOM 72175 H2 WAT 5624 55.842 144.433 21.964 1.00 0.00 H TER 72177 WAT 5624 ATOM 72177 O WAT 5625 79.074 41.366 121.816 1.00 0.00 O ATOM 72178 H1 WAT 5625 79.881 41.788 122.109 1.00 0.00 H ATOM 72179 H2 WAT 5625 78.492 41.406 122.575 1.00 0.00 H TER 72181 WAT 5625 ATOM 72181 O WAT 5626 33.314 41.164 133.295 1.00 0.00 O ATOM 72182 H1 WAT 5626 32.868 41.921 133.674 1.00 0.00 H ATOM 72183 H2 WAT 5626 33.763 40.755 134.035 1.00 0.00 H TER 72185 WAT 5626 ATOM 72185 O WAT 5627 82.655 126.311 138.207 1.00 0.00 O ATOM 72186 H1 WAT 5627 82.032 125.656 138.521 1.00 0.00 H ATOM 72187 H2 WAT 5627 82.220 127.150 138.362 1.00 0.00 H TER 72189 WAT 5627 ATOM 72189 O WAT 5628 34.685 104.452 80.636 1.00 0.00 O ATOM 72190 H1 WAT 5628 35.095 104.255 81.478 1.00 0.00 H ATOM 72191 H2 WAT 5628 34.910 103.707 80.079 1.00 0.00 H TER 72193 WAT 5628 ATOM 72193 O WAT 5629 127.832 50.816 123.453 1.00 0.00 O ATOM 72194 H1 WAT 5629 128.564 50.362 123.872 1.00 0.00 H ATOM 72195 H2 WAT 5629 127.057 50.495 123.914 1.00 0.00 H TER 72197 WAT 5629 ATOM 72197 O WAT 5630 79.147 140.971 144.434 1.00 0.00 O ATOM 72198 H1 WAT 5630 79.683 140.893 145.224 1.00 0.00 H ATOM 72199 H2 WAT 5630 78.558 140.217 144.469 1.00 0.00 H TER 72201 WAT 5630 ATOM 72201 O WAT 5631 122.458 142.552 133.741 1.00 0.00 O ATOM 72202 H1 WAT 5631 122.019 141.701 133.756 1.00 0.00 H ATOM 72203 H2 WAT 5631 123.247 142.405 133.219 1.00 0.00 H TER 72205 WAT 5631 ATOM 72205 O WAT 5632 6.763 91.366 146.349 1.00 0.00 O ATOM 72206 H1 WAT 5632 6.509 91.595 147.243 1.00 0.00 H ATOM 72207 H2 WAT 5632 7.717 91.446 146.343 1.00 0.00 H TER 72209 WAT 5632 ATOM 72209 O WAT 5633 89.059 66.093 61.402 1.00 0.00 O ATOM 72210 H1 WAT 5633 89.094 65.141 61.302 1.00 0.00 H ATOM 72211 H2 WAT 5633 88.150 66.322 61.207 1.00 0.00 H TER 72213 WAT 5633 ATOM 72213 O WAT 5634 22.353 134.623 122.676 1.00 0.00 O ATOM 72214 H1 WAT 5634 22.433 133.760 122.270 1.00 0.00 H ATOM 72215 H2 WAT 5634 21.645 134.524 123.312 1.00 0.00 H TER 72217 WAT 5634 ATOM 72217 O WAT 5635 89.900 46.678 86.586 1.00 0.00 O ATOM 72218 H1 WAT 5635 90.742 46.477 86.995 1.00 0.00 H ATOM 72219 H2 WAT 5635 89.819 47.628 86.659 1.00 0.00 H TER 72221 WAT 5635 ATOM 72221 O WAT 5636 46.337 56.193 21.750 1.00 0.00 O ATOM 72222 H1 WAT 5636 46.341 56.107 20.796 1.00 0.00 H ATOM 72223 H2 WAT 5636 47.262 56.189 21.994 1.00 0.00 H TER 72225 WAT 5636 ATOM 72225 O WAT 5637 55.789 98.960 116.999 1.00 0.00 O ATOM 72226 H1 WAT 5637 56.102 98.236 116.455 1.00 0.00 H ATOM 72227 H2 WAT 5637 54.839 98.956 116.879 1.00 0.00 H TER 72229 WAT 5637 ATOM 72229 O WAT 5638 110.361 136.378 137.199 1.00 0.00 O ATOM 72230 H1 WAT 5638 110.689 137.093 137.744 1.00 0.00 H ATOM 72231 H2 WAT 5638 109.409 136.478 137.220 1.00 0.00 H TER 72233 WAT 5638 ATOM 72233 O WAT 5639 125.516 115.861 140.303 1.00 0.00 O ATOM 72234 H1 WAT 5639 125.500 116.816 140.372 1.00 0.00 H ATOM 72235 H2 WAT 5639 126.240 115.592 140.868 1.00 0.00 H TER 72237 WAT 5639 ATOM 72237 O WAT 5640 7.217 35.801 123.962 1.00 0.00 O ATOM 72238 H1 WAT 5640 7.575 35.999 123.096 1.00 0.00 H ATOM 72239 H2 WAT 5640 7.945 35.955 124.563 1.00 0.00 H TER 72241 WAT 5640 ATOM 72241 O WAT 5641 120.906 41.228 90.972 1.00 0.00 O ATOM 72242 H1 WAT 5641 121.628 41.493 90.403 1.00 0.00 H ATOM 72243 H2 WAT 5641 120.117 41.430 90.470 1.00 0.00 H TER 72245 WAT 5641 ATOM 72245 O WAT 5642 82.139 143.566 155.787 1.00 0.00 O ATOM 72246 H1 WAT 5642 82.112 143.512 156.742 1.00 0.00 H ATOM 72247 H2 WAT 5642 82.875 143.009 155.535 1.00 0.00 H TER 72249 WAT 5642 ATOM 72249 O WAT 5643 70.711 74.517 66.117 1.00 0.00 O ATOM 72250 H1 WAT 5643 71.225 74.473 65.311 1.00 0.00 H ATOM 72251 H2 WAT 5643 70.593 75.453 66.275 1.00 0.00 H TER 72253 WAT 5643 ATOM 72253 O WAT 5644 106.115 109.438 28.898 1.00 0.00 O ATOM 72254 H1 WAT 5644 105.658 108.800 28.350 1.00 0.00 H ATOM 72255 H2 WAT 5644 105.769 109.288 29.778 1.00 0.00 H TER 72257 WAT 5644 ATOM 72257 O WAT 5645 78.925 61.657 156.567 1.00 0.00 O ATOM 72258 H1 WAT 5645 78.563 61.758 155.687 1.00 0.00 H ATOM 72259 H2 WAT 5645 78.351 61.019 156.991 1.00 0.00 H TER 72261 WAT 5645 ATOM 72261 O WAT 5646 134.437 15.301 71.704 1.00 0.00 O ATOM 72262 H1 WAT 5646 134.970 15.971 71.277 1.00 0.00 H ATOM 72263 H2 WAT 5646 134.048 14.808 70.982 1.00 0.00 H TER 72265 WAT 5646 ATOM 72265 O WAT 5647 114.910 16.210 127.961 1.00 0.00 O ATOM 72266 H1 WAT 5647 115.720 16.370 127.477 1.00 0.00 H ATOM 72267 H2 WAT 5647 114.344 15.756 127.338 1.00 0.00 H TER 72269 WAT 5647 ATOM 72269 O WAT 5648 21.384 48.372 83.818 1.00 0.00 O ATOM 72270 H1 WAT 5648 21.210 48.717 84.694 1.00 0.00 H ATOM 72271 H2 WAT 5648 21.406 47.422 83.935 1.00 0.00 H TER 72273 WAT 5648 ATOM 72273 O WAT 5649 124.816 15.507 11.736 1.00 0.00 O ATOM 72274 H1 WAT 5649 125.749 15.430 11.535 1.00 0.00 H ATOM 72275 H2 WAT 5649 124.714 15.061 12.577 1.00 0.00 H TER 72277 WAT 5649 ATOM 72277 O WAT 5650 143.588 42.363 82.300 1.00 0.00 O ATOM 72278 H1 WAT 5650 143.733 41.597 82.856 1.00 0.00 H ATOM 72279 H2 WAT 5650 144.165 43.035 82.663 1.00 0.00 H TER 72281 WAT 5650 ATOM 72281 O WAT 5651 24.288 43.607 105.973 1.00 0.00 O ATOM 72282 H1 WAT 5651 24.869 44.252 106.375 1.00 0.00 H ATOM 72283 H2 WAT 5651 24.651 42.761 106.237 1.00 0.00 H TER 72285 WAT 5651 ATOM 72285 O WAT 5652 72.745 63.519 114.374 1.00 0.00 O ATOM 72286 H1 WAT 5652 73.565 64.009 114.319 1.00 0.00 H ATOM 72287 H2 WAT 5652 72.884 62.897 115.088 1.00 0.00 H TER 72289 WAT 5652 ATOM 72289 O WAT 5653 13.924 99.664 154.573 1.00 0.00 O ATOM 72290 H1 WAT 5653 13.695 99.655 155.502 1.00 0.00 H ATOM 72291 H2 WAT 5653 13.294 99.071 154.165 1.00 0.00 H TER 72293 WAT 5653 ATOM 72293 O WAT 5654 31.366 114.813 20.701 1.00 0.00 O ATOM 72294 H1 WAT 5654 30.675 115.100 20.105 1.00 0.00 H ATOM 72295 H2 WAT 5654 30.915 114.268 21.347 1.00 0.00 H TER 72297 WAT 5654 ATOM 72297 O WAT 5655 61.310 126.069 4.371 1.00 0.00 O ATOM 72298 H1 WAT 5655 60.355 126.038 4.308 1.00 0.00 H ATOM 72299 H2 WAT 5655 61.575 126.688 3.690 1.00 0.00 H TER 72301 WAT 5655 ATOM 72301 O WAT 5656 40.572 51.690 139.514 1.00 0.00 O ATOM 72302 H1 WAT 5656 39.965 51.719 138.775 1.00 0.00 H ATOM 72303 H2 WAT 5656 41.412 51.446 139.124 1.00 0.00 H TER 72305 WAT 5656 ATOM 72305 O WAT 5657 92.973 41.734 1.274 1.00 0.00 O ATOM 72306 H1 WAT 5657 93.161 41.948 0.360 1.00 0.00 H ATOM 72307 H2 WAT 5657 92.288 42.352 1.529 1.00 0.00 H TER 72309 WAT 5657 ATOM 72309 O WAT 5658 13.751 107.969 113.162 1.00 0.00 O ATOM 72310 H1 WAT 5658 14.032 108.874 113.303 1.00 0.00 H ATOM 72311 H2 WAT 5658 14.506 107.546 112.754 1.00 0.00 H TER 72313 WAT 5658 ATOM 72313 O WAT 5659 66.877 77.259 13.562 1.00 0.00 O ATOM 72314 H1 WAT 5659 67.021 76.368 13.881 1.00 0.00 H ATOM 72315 H2 WAT 5659 66.220 77.623 14.155 1.00 0.00 H TER 72317 WAT 5659 ATOM 72317 O WAT 5660 122.737 91.725 97.038 1.00 0.00 O ATOM 72318 H1 WAT 5660 123.170 91.062 96.501 1.00 0.00 H ATOM 72319 H2 WAT 5660 122.048 92.077 96.475 1.00 0.00 H TER 72321 WAT 5660 ATOM 72321 O WAT 5661 135.757 138.941 82.891 1.00 0.00 O ATOM 72322 H1 WAT 5661 135.396 139.824 82.811 1.00 0.00 H ATOM 72323 H2 WAT 5661 135.455 138.635 83.746 1.00 0.00 H TER 72325 WAT 5661 ATOM 72325 O WAT 5662 123.044 97.951 131.876 1.00 0.00 O ATOM 72326 H1 WAT 5662 123.676 97.436 132.378 1.00 0.00 H ATOM 72327 H2 WAT 5662 123.389 97.949 130.983 1.00 0.00 H TER 72329 WAT 5662 ATOM 72329 O WAT 5663 8.570 21.468 114.679 1.00 0.00 O ATOM 72330 H1 WAT 5663 9.350 20.935 114.834 1.00 0.00 H ATOM 72331 H2 WAT 5663 8.168 21.560 115.543 1.00 0.00 H TER 72333 WAT 5663 ATOM 72333 O WAT 5664 16.193 21.544 74.385 1.00 0.00 O ATOM 72334 H1 WAT 5664 15.815 21.261 73.553 1.00 0.00 H ATOM 72335 H2 WAT 5664 15.573 22.190 74.723 1.00 0.00 H TER 72337 WAT 5664 ATOM 72337 O WAT 5665 50.647 140.348 69.386 1.00 0.00 O ATOM 72338 H1 WAT 5665 50.219 141.166 69.640 1.00 0.00 H ATOM 72339 H2 WAT 5665 50.830 140.454 68.452 1.00 0.00 H TER 72341 WAT 5665 ATOM 72341 O WAT 5666 111.992 25.613 125.478 1.00 0.00 O ATOM 72342 H1 WAT 5666 112.360 25.266 126.290 1.00 0.00 H ATOM 72343 H2 WAT 5666 111.077 25.332 125.490 1.00 0.00 H TER 72345 WAT 5666 ATOM 72345 O WAT 5667 50.829 79.703 108.445 1.00 0.00 O ATOM 72346 H1 WAT 5667 50.458 79.948 107.597 1.00 0.00 H ATOM 72347 H2 WAT 5667 50.290 80.168 109.086 1.00 0.00 H TER 72349 WAT 5667 ATOM 72349 O WAT 5668 144.825 78.674 78.515 1.00 0.00 O ATOM 72350 H1 WAT 5668 145.023 77.900 77.986 1.00 0.00 H ATOM 72351 H2 WAT 5668 144.385 79.271 77.910 1.00 0.00 H TER 72353 WAT 5668 ATOM 72353 O WAT 5669 20.214 79.858 126.323 1.00 0.00 O ATOM 72354 H1 WAT 5669 20.416 80.601 125.754 1.00 0.00 H ATOM 72355 H2 WAT 5669 19.502 79.400 125.876 1.00 0.00 H TER 72357 WAT 5669 ATOM 72357 O WAT 5670 103.588 127.277 77.579 1.00 0.00 O ATOM 72358 H1 WAT 5670 104.033 126.950 78.361 1.00 0.00 H ATOM 72359 H2 WAT 5670 104.234 127.842 77.155 1.00 0.00 H TER 72361 WAT 5670 ATOM 72361 O WAT 5671 21.909 128.194 15.117 1.00 0.00 O ATOM 72362 H1 WAT 5671 22.721 127.749 14.875 1.00 0.00 H ATOM 72363 H2 WAT 5671 21.248 127.823 14.533 1.00 0.00 H TER 72365 WAT 5671 ATOM 72365 O WAT 5672 14.315 111.790 95.995 1.00 0.00 O ATOM 72366 H1 WAT 5672 14.901 111.695 96.746 1.00 0.00 H ATOM 72367 H2 WAT 5672 14.753 112.424 95.428 1.00 0.00 H TER 72369 WAT 5672 ATOM 72369 O WAT 5673 70.415 130.742 10.732 1.00 0.00 O ATOM 72370 H1 WAT 5673 69.858 130.000 10.969 1.00 0.00 H ATOM 72371 H2 WAT 5673 70.906 130.438 9.969 1.00 0.00 H TER 72373 WAT 5673 ATOM 72373 O WAT 5674 124.925 32.166 98.404 1.00 0.00 O ATOM 72374 H1 WAT 5674 125.082 32.183 99.348 1.00 0.00 H ATOM 72375 H2 WAT 5674 125.433 32.902 98.063 1.00 0.00 H TER 72377 WAT 5674 ATOM 72377 O WAT 5675 77.264 98.760 143.583 1.00 0.00 O ATOM 72378 H1 WAT 5675 77.589 99.649 143.445 1.00 0.00 H ATOM 72379 H2 WAT 5675 76.681 98.833 144.339 1.00 0.00 H TER 72381 WAT 5675 ATOM 72381 O WAT 5676 70.588 14.594 58.833 1.00 0.00 O ATOM 72382 H1 WAT 5676 70.968 14.085 58.117 1.00 0.00 H ATOM 72383 H2 WAT 5676 70.588 13.993 59.579 1.00 0.00 H TER 72385 WAT 5676 ATOM 72385 O WAT 5677 62.202 96.855 85.814 1.00 0.00 O ATOM 72386 H1 WAT 5677 62.161 97.811 85.790 1.00 0.00 H ATOM 72387 H2 WAT 5677 63.136 96.654 85.751 1.00 0.00 H TER 72389 WAT 5677 ATOM 72389 O WAT 5678 48.418 54.123 156.703 1.00 0.00 O ATOM 72390 H1 WAT 5678 48.843 53.751 155.931 1.00 0.00 H ATOM 72391 H2 WAT 5678 47.603 53.628 156.789 1.00 0.00 H TER 72393 WAT 5678 ATOM 72393 O WAT 5679 140.333 59.813 118.372 1.00 0.00 O ATOM 72394 H1 WAT 5679 140.764 59.015 118.067 1.00 0.00 H ATOM 72395 H2 WAT 5679 139.407 59.678 118.168 1.00 0.00 H TER 72397 WAT 5679 ATOM 72397 O WAT 5680 100.214 58.699 106.557 1.00 0.00 O ATOM 72398 H1 WAT 5680 100.243 59.649 106.666 1.00 0.00 H ATOM 72399 H2 WAT 5680 100.264 58.564 105.611 1.00 0.00 H TER 72401 WAT 5680 ATOM 72401 O WAT 5681 123.259 72.190 78.794 1.00 0.00 O ATOM 72402 H1 WAT 5681 122.546 71.561 78.682 1.00 0.00 H ATOM 72403 H2 WAT 5681 123.092 72.592 79.647 1.00 0.00 H TER 72405 WAT 5681 ATOM 72405 O WAT 5682 82.772 13.746 113.744 1.00 0.00 O ATOM 72406 H1 WAT 5682 83.075 14.089 114.585 1.00 0.00 H ATOM 72407 H2 WAT 5682 82.827 14.492 113.147 1.00 0.00 H TER 72409 WAT 5682 ATOM 72409 O WAT 5683 126.940 85.464 101.595 1.00 0.00 O ATOM 72410 H1 WAT 5683 126.537 85.228 100.760 1.00 0.00 H ATOM 72411 H2 WAT 5683 127.733 84.931 101.638 1.00 0.00 H TER 72413 WAT 5683 ATOM 72413 O WAT 5684 20.850 115.449 156.227 1.00 0.00 O ATOM 72414 H1 WAT 5684 21.166 115.160 157.083 1.00 0.00 H ATOM 72415 H2 WAT 5684 21.026 114.710 155.645 1.00 0.00 H TER 72417 WAT 5684 ATOM 72417 O WAT 5685 50.370 100.737 132.788 1.00 0.00 O ATOM 72418 H1 WAT 5685 50.709 99.858 132.620 1.00 0.00 H ATOM 72419 H2 WAT 5685 51.152 101.280 132.890 1.00 0.00 H TER 72421 WAT 5685 ATOM 72421 O WAT 5686 144.896 99.887 98.735 1.00 0.00 O ATOM 72422 H1 WAT 5686 145.737 100.333 98.629 1.00 0.00 H ATOM 72423 H2 WAT 5686 144.359 100.504 99.232 1.00 0.00 H TER 72425 WAT 5686 ATOM 72425 O WAT 5687 126.999 53.048 1.900 1.00 0.00 O ATOM 72426 H1 WAT 5687 127.216 53.158 2.825 1.00 0.00 H ATOM 72427 H2 WAT 5687 127.549 52.320 1.609 1.00 0.00 H TER 72429 WAT 5687 ATOM 72429 O WAT 5688 80.395 59.590 115.629 1.00 0.00 O ATOM 72430 H1 WAT 5688 80.557 60.280 116.273 1.00 0.00 H ATOM 72431 H2 WAT 5688 79.903 60.023 114.932 1.00 0.00 H TER 72433 WAT 5688 ATOM 72433 O WAT 5689 112.862 25.269 3.986 1.00 0.00 O ATOM 72434 H1 WAT 5689 112.913 26.194 4.227 1.00 0.00 H ATOM 72435 H2 WAT 5689 111.929 25.061 4.031 1.00 0.00 H TER 72437 WAT 5689 ATOM 72437 O WAT 5690 144.920 60.317 90.074 1.00 0.00 O ATOM 72438 H1 WAT 5690 145.158 61.243 90.134 1.00 0.00 H ATOM 72439 H2 WAT 5690 143.974 60.322 89.931 1.00 0.00 H TER 72441 WAT 5690 ATOM 72441 O WAT 5691 81.378 90.719 21.256 1.00 0.00 O ATOM 72442 H1 WAT 5691 80.871 91.529 21.317 1.00 0.00 H ATOM 72443 H2 WAT 5691 81.635 90.529 22.159 1.00 0.00 H TER 72445 WAT 5691 ATOM 72445 O WAT 5692 1.963 73.971 78.462 1.00 0.00 O ATOM 72446 H1 WAT 5692 2.475 73.696 77.701 1.00 0.00 H ATOM 72447 H2 WAT 5692 2.265 74.861 78.645 1.00 0.00 H TER 72449 WAT 5692 ATOM 72449 O WAT 5693 142.730 84.189 33.482 1.00 0.00 O ATOM 72450 H1 WAT 5693 142.305 83.355 33.280 1.00 0.00 H ATOM 72451 H2 WAT 5693 142.149 84.606 34.118 1.00 0.00 H TER 72453 WAT 5693 ATOM 72453 O WAT 5694 45.792 59.262 16.272 1.00 0.00 O ATOM 72454 H1 WAT 5694 45.634 59.093 17.200 1.00 0.00 H ATOM 72455 H2 WAT 5694 46.568 59.823 16.258 1.00 0.00 H TER 72457 WAT 5694 ATOM 72457 O WAT 5695 115.619 38.198 136.539 1.00 0.00 O ATOM 72458 H1 WAT 5695 115.425 37.291 136.304 1.00 0.00 H ATOM 72459 H2 WAT 5695 115.132 38.720 135.902 1.00 0.00 H TER 72461 WAT 5695 ATOM 72461 O WAT 5696 128.866 26.523 112.391 1.00 0.00 O ATOM 72462 H1 WAT 5696 129.675 26.755 111.935 1.00 0.00 H ATOM 72463 H2 WAT 5696 128.241 26.337 111.691 1.00 0.00 H TER 72465 WAT 5696 ATOM 72465 O WAT 5697 114.578 98.522 142.913 1.00 0.00 O ATOM 72466 H1 WAT 5697 113.814 98.871 142.454 1.00 0.00 H ATOM 72467 H2 WAT 5697 115.195 99.254 142.942 1.00 0.00 H TER 72469 WAT 5697 ATOM 72469 O WAT 5698 13.020 16.354 101.630 1.00 0.00 O ATOM 72470 H1 WAT 5698 12.594 16.940 101.003 1.00 0.00 H ATOM 72471 H2 WAT 5698 12.423 16.328 102.378 1.00 0.00 H TER 72473 WAT 5698 ATOM 72473 O WAT 5699 76.221 66.365 136.872 1.00 0.00 O ATOM 72474 H1 WAT 5699 76.801 66.447 137.630 1.00 0.00 H ATOM 72475 H2 WAT 5699 76.619 66.924 136.205 1.00 0.00 H TER 72477 WAT 5699 ATOM 72477 O WAT 5700 135.577 105.965 71.660 1.00 0.00 O ATOM 72478 H1 WAT 5700 135.206 106.364 70.874 1.00 0.00 H ATOM 72479 H2 WAT 5700 136.142 106.643 72.029 1.00 0.00 H TER 72481 WAT 5700 ATOM 72481 O WAT 5701 85.516 140.556 15.630 1.00 0.00 O ATOM 72482 H1 WAT 5701 85.365 141.009 14.801 1.00 0.00 H ATOM 72483 H2 WAT 5701 85.345 139.635 15.435 1.00 0.00 H TER 72485 WAT 5701 ATOM 72485 O WAT 5702 41.727 90.070 68.471 1.00 0.00 O ATOM 72486 H1 WAT 5702 40.877 89.643 68.580 1.00 0.00 H ATOM 72487 H2 WAT 5702 42.364 89.362 68.562 1.00 0.00 H TER 72489 WAT 5702 ATOM 72489 O WAT 5703 74.241 40.701 119.905 1.00 0.00 O ATOM 72490 H1 WAT 5703 74.691 41.427 120.337 1.00 0.00 H ATOM 72491 H2 WAT 5703 74.914 40.293 119.360 1.00 0.00 H TER 72493 WAT 5703 ATOM 72493 O WAT 5704 43.048 23.815 4.820 1.00 0.00 O ATOM 72494 H1 WAT 5704 43.828 23.261 4.809 1.00 0.00 H ATOM 72495 H2 WAT 5704 42.524 23.506 4.081 1.00 0.00 H TER 72497 WAT 5704 ATOM 72497 O WAT 5705 75.649 52.919 71.322 1.00 0.00 O ATOM 72498 H1 WAT 5705 75.338 52.438 70.555 1.00 0.00 H ATOM 72499 H2 WAT 5705 76.422 52.433 71.612 1.00 0.00 H TER 72501 WAT 5705 ATOM 72501 O WAT 5706 112.752 117.912 11.992 1.00 0.00 O ATOM 72502 H1 WAT 5706 112.446 117.092 11.605 1.00 0.00 H ATOM 72503 H2 WAT 5706 113.539 117.668 12.480 1.00 0.00 H TER 72505 WAT 5706 ATOM 72505 O WAT 5707 103.372 38.197 158.649 1.00 0.00 O ATOM 72506 H1 WAT 5707 104.043 37.813 158.086 1.00 0.00 H ATOM 72507 H2 WAT 5707 103.646 39.108 158.761 1.00 0.00 H TER 72509 WAT 5707 ATOM 72509 O WAT 5708 53.071 140.083 89.185 1.00 0.00 O ATOM 72510 H1 WAT 5708 53.616 139.332 89.421 1.00 0.00 H ATOM 72511 H2 WAT 5708 52.363 139.710 88.661 1.00 0.00 H TER 72513 WAT 5708 ATOM 72513 O WAT 5709 21.812 84.367 147.817 1.00 0.00 O ATOM 72514 H1 WAT 5709 21.692 85.113 147.228 1.00 0.00 H ATOM 72515 H2 WAT 5709 22.629 83.962 147.526 1.00 0.00 H TER 72517 WAT 5709 ATOM 72517 O WAT 5710 98.424 11.749 82.459 1.00 0.00 O ATOM 72518 H1 WAT 5710 99.345 11.877 82.234 1.00 0.00 H ATOM 72519 H2 WAT 5710 97.979 11.674 81.614 1.00 0.00 H TER 72521 WAT 5710 ATOM 72521 O WAT 5711 54.746 119.807 127.143 1.00 0.00 O ATOM 72522 H1 WAT 5711 53.955 119.654 127.661 1.00 0.00 H ATOM 72523 H2 WAT 5711 55.372 119.159 127.467 1.00 0.00 H TER 72525 WAT 5711 ATOM 72525 O WAT 5712 31.606 15.710 21.363 1.00 0.00 O ATOM 72526 H1 WAT 5712 31.244 16.566 21.591 1.00 0.00 H ATOM 72527 H2 WAT 5712 31.259 15.528 20.490 1.00 0.00 H TER 72529 WAT 5712 ATOM 72529 O WAT 5713 131.585 87.145 90.043 1.00 0.00 O ATOM 72530 H1 WAT 5713 131.468 86.770 90.916 1.00 0.00 H ATOM 72531 H2 WAT 5713 131.983 86.440 89.532 1.00 0.00 H TER 72533 WAT 5713 ATOM 72533 O WAT 5714 84.911 73.309 144.633 1.00 0.00 O ATOM 72534 H1 WAT 5714 84.775 72.496 145.118 1.00 0.00 H ATOM 72535 H2 WAT 5714 84.323 73.939 145.051 1.00 0.00 H TER 72537 WAT 5714 ATOM 72537 O WAT 5715 95.297 71.093 154.881 1.00 0.00 O ATOM 72538 H1 WAT 5715 94.854 71.679 155.493 1.00 0.00 H ATOM 72539 H2 WAT 5715 95.176 70.220 155.254 1.00 0.00 H TER 72541 WAT 5715 ATOM 72541 O WAT 5716 73.871 53.049 124.424 1.00 0.00 O ATOM 72542 H1 WAT 5716 74.526 52.424 124.735 1.00 0.00 H ATOM 72543 H2 WAT 5716 74.314 53.534 123.727 1.00 0.00 H TER 72545 WAT 5716 ATOM 72545 O WAT 5717 20.978 5.080 27.928 1.00 0.00 O ATOM 72546 H1 WAT 5717 20.570 5.150 28.791 1.00 0.00 H ATOM 72547 H2 WAT 5717 21.168 5.984 27.679 1.00 0.00 H TER 72549 WAT 5717 ATOM 72549 O WAT 5718 16.595 100.450 89.059 1.00 0.00 O ATOM 72550 H1 WAT 5718 15.734 100.679 89.410 1.00 0.00 H ATOM 72551 H2 WAT 5718 16.405 99.968 88.254 1.00 0.00 H TER 72553 WAT 5718 ATOM 72553 O WAT 5719 20.244 72.872 23.403 1.00 0.00 O ATOM 72554 H1 WAT 5719 20.692 73.231 24.169 1.00 0.00 H ATOM 72555 H2 WAT 5719 19.556 72.315 23.767 1.00 0.00 H TER 72557 WAT 5719 ATOM 72557 O WAT 5720 121.693 32.231 83.502 1.00 0.00 O ATOM 72558 H1 WAT 5720 122.305 32.300 84.235 1.00 0.00 H ATOM 72559 H2 WAT 5720 122.103 32.736 82.800 1.00 0.00 H TER 72561 WAT 5720 ATOM 72561 O WAT 5721 70.345 139.846 112.652 1.00 0.00 O ATOM 72562 H1 WAT 5721 70.584 140.043 111.747 1.00 0.00 H ATOM 72563 H2 WAT 5721 69.832 139.039 112.594 1.00 0.00 H TER 72565 WAT 5721 ATOM 72565 O WAT 5722 118.605 11.222 128.025 1.00 0.00 O ATOM 72566 H1 WAT 5722 119.465 11.642 128.026 1.00 0.00 H ATOM 72567 H2 WAT 5722 118.488 10.913 128.924 1.00 0.00 H TER 72569 WAT 5722 ATOM 72569 O WAT 5723 141.268 97.409 124.961 1.00 0.00 O ATOM 72570 H1 WAT 5723 142.108 97.398 124.502 1.00 0.00 H ATOM 72571 H2 WAT 5723 140.654 97.006 124.347 1.00 0.00 H TER 72573 WAT 5723 ATOM 72573 O WAT 5724 81.621 73.596 143.091 1.00 0.00 O ATOM 72574 H1 WAT 5724 80.677 73.472 142.996 1.00 0.00 H ATOM 72575 H2 WAT 5724 81.861 73.049 143.838 1.00 0.00 H TER 72577 WAT 5724 ATOM 72577 O WAT 5725 61.881 109.897 61.473 1.00 0.00 O ATOM 72578 H1 WAT 5725 62.400 110.630 61.143 1.00 0.00 H ATOM 72579 H2 WAT 5725 62.528 109.231 61.706 1.00 0.00 H TER 72581 WAT 5725 ATOM 72581 O WAT 5726 82.490 135.051 11.481 1.00 0.00 O ATOM 72582 H1 WAT 5726 81.554 135.226 11.379 1.00 0.00 H ATOM 72583 H2 WAT 5726 82.816 134.960 10.586 1.00 0.00 H TER 72585 WAT 5726 ATOM 72585 O WAT 5727 27.724 53.717 7.115 1.00 0.00 O ATOM 72586 H1 WAT 5727 27.196 54.250 6.519 1.00 0.00 H ATOM 72587 H2 WAT 5727 27.924 54.302 7.845 1.00 0.00 H TER 72589 WAT 5727 ATOM 72589 O WAT 5728 11.308 145.880 111.516 1.00 0.00 O ATOM 72590 H1 WAT 5728 11.769 145.218 112.032 1.00 0.00 H ATOM 72591 H2 WAT 5728 10.466 145.477 111.306 1.00 0.00 H TER 72593 WAT 5728 ATOM 72593 O WAT 5729 143.014 61.434 80.259 1.00 0.00 O ATOM 72594 H1 WAT 5729 143.072 62.064 80.977 1.00 0.00 H ATOM 72595 H2 WAT 5729 143.605 61.779 79.590 1.00 0.00 H TER 72597 WAT 5729 ATOM 72597 O WAT 5730 95.589 119.783 93.132 1.00 0.00 O ATOM 72598 H1 WAT 5730 95.408 120.723 93.101 1.00 0.00 H ATOM 72599 H2 WAT 5730 96.363 119.670 92.581 1.00 0.00 H TER 72601 WAT 5730 ATOM 72601 O WAT 5731 42.993 43.739 101.607 1.00 0.00 O ATOM 72602 H1 WAT 5731 42.101 43.605 101.928 1.00 0.00 H ATOM 72603 H2 WAT 5731 43.239 42.896 101.225 1.00 0.00 H TER 72605 WAT 5731 ATOM 72605 O WAT 5732 109.428 90.511 71.994 1.00 0.00 O ATOM 72606 H1 WAT 5732 109.900 91.298 72.265 1.00 0.00 H ATOM 72607 H2 WAT 5732 109.746 90.333 71.109 1.00 0.00 H TER 72609 WAT 5732 ATOM 72609 O WAT 5733 94.647 28.791 123.404 1.00 0.00 O ATOM 72610 H1 WAT 5733 94.683 27.904 123.047 1.00 0.00 H ATOM 72611 H2 WAT 5733 94.301 29.324 122.687 1.00 0.00 H TER 72613 WAT 5733 ATOM 72613 O WAT 5734 98.206 127.231 118.959 1.00 0.00 O ATOM 72614 H1 WAT 5734 99.128 127.429 118.793 1.00 0.00 H ATOM 72615 H2 WAT 5734 97.726 127.835 118.393 1.00 0.00 H TER 72617 WAT 5734 ATOM 72617 O WAT 5735 74.981 5.219 81.765 1.00 0.00 O ATOM 72618 H1 WAT 5735 75.178 6.060 81.353 1.00 0.00 H ATOM 72619 H2 WAT 5735 75.747 5.033 82.309 1.00 0.00 H TER 72621 WAT 5735 ATOM 72621 O WAT 5736 51.042 82.878 134.664 1.00 0.00 O ATOM 72622 H1 WAT 5736 50.421 82.267 134.266 1.00 0.00 H ATOM 72623 H2 WAT 5736 51.414 83.358 133.924 1.00 0.00 H TER 72625 WAT 5736 ATOM 72625 O WAT 5737 84.974 10.318 150.992 1.00 0.00 O ATOM 72626 H1 WAT 5737 84.221 10.607 150.477 1.00 0.00 H ATOM 72627 H2 WAT 5737 85.457 11.122 151.183 1.00 0.00 H TER 72629 WAT 5737 ATOM 72629 O WAT 5738 133.571 62.786 84.043 1.00 0.00 O ATOM 72630 H1 WAT 5738 133.185 63.618 83.770 1.00 0.00 H ATOM 72631 H2 WAT 5738 133.216 62.143 83.429 1.00 0.00 H TER 72633 WAT 5738 ATOM 72633 O WAT 5739 66.006 4.456 95.092 1.00 0.00 O ATOM 72634 H1 WAT 5739 65.066 4.607 94.997 1.00 0.00 H ATOM 72635 H2 WAT 5739 66.269 5.027 95.814 1.00 0.00 H TER 72637 WAT 5739 ATOM 72637 O WAT 5740 101.285 81.930 21.443 1.00 0.00 O ATOM 72638 H1 WAT 5740 100.697 82.682 21.516 1.00 0.00 H ATOM 72639 H2 WAT 5740 101.481 81.691 22.349 1.00 0.00 H TER 72641 WAT 5740 ATOM 72641 O WAT 5741 12.916 4.767 141.144 1.00 0.00 O ATOM 72642 H1 WAT 5741 13.030 5.249 140.325 1.00 0.00 H ATOM 72643 H2 WAT 5741 11.985 4.546 141.165 1.00 0.00 H TER 72645 WAT 5741 ATOM 72645 O WAT 5742 63.311 72.835 75.145 1.00 0.00 O ATOM 72646 H1 WAT 5742 63.749 72.182 75.690 1.00 0.00 H ATOM 72647 H2 WAT 5742 63.279 73.620 75.691 1.00 0.00 H TER 72649 WAT 5742 ATOM 72649 O WAT 5743 8.152 51.679 92.311 1.00 0.00 O ATOM 72650 H1 WAT 5743 7.508 51.555 91.614 1.00 0.00 H ATOM 72651 H2 WAT 5743 7.899 52.502 92.728 1.00 0.00 H TER 72653 WAT 5743 ATOM 72653 O WAT 5744 97.541 95.363 112.459 1.00 0.00 O ATOM 72654 H1 WAT 5744 97.326 95.547 111.545 1.00 0.00 H ATOM 72655 H2 WAT 5744 98.172 94.644 112.417 1.00 0.00 H TER 72657 WAT 5744 ATOM 72657 O WAT 5745 74.608 76.837 87.602 1.00 0.00 O ATOM 72658 H1 WAT 5745 74.662 75.901 87.406 1.00 0.00 H ATOM 72659 H2 WAT 5745 73.847 76.917 88.178 1.00 0.00 H TER 72661 WAT 5745 ATOM 72661 O WAT 5746 26.194 52.085 68.544 1.00 0.00 O ATOM 72662 H1 WAT 5746 26.625 52.877 68.866 1.00 0.00 H ATOM 72663 H2 WAT 5746 25.711 52.374 67.769 1.00 0.00 H TER 72665 WAT 5746 ATOM 72665 O WAT 5747 82.282 66.937 17.746 1.00 0.00 O ATOM 72666 H1 WAT 5747 83.047 67.466 17.973 1.00 0.00 H ATOM 72667 H2 WAT 5747 82.283 66.227 18.388 1.00 0.00 H TER 72669 WAT 5747 ATOM 72669 O WAT 5748 132.142 112.072 71.212 1.00 0.00 O ATOM 72670 H1 WAT 5748 131.903 111.359 70.620 1.00 0.00 H ATOM 72671 H2 WAT 5748 132.012 112.867 70.695 1.00 0.00 H TER 72673 WAT 5748 ATOM 72673 O WAT 5749 138.763 39.642 143.856 1.00 0.00 O ATOM 72674 H1 WAT 5749 138.788 39.615 144.812 1.00 0.00 H ATOM 72675 H2 WAT 5749 138.431 38.781 143.600 1.00 0.00 H TER 72677 WAT 5749 ATOM 72677 O WAT 5750 109.932 102.393 141.050 1.00 0.00 O ATOM 72678 H1 WAT 5750 110.570 101.877 141.542 1.00 0.00 H ATOM 72679 H2 WAT 5750 109.202 101.792 140.901 1.00 0.00 H TER 72681 WAT 5750 ATOM 72681 O WAT 5751 124.449 105.961 111.341 1.00 0.00 O ATOM 72682 H1 WAT 5751 125.178 106.398 110.901 1.00 0.00 H ATOM 72683 H2 WAT 5751 124.455 105.071 110.987 1.00 0.00 H TER 72685 WAT 5751 ATOM 72685 O WAT 5752 23.261 36.158 80.280 1.00 0.00 O ATOM 72686 H1 WAT 5752 22.511 36.185 80.874 1.00 0.00 H ATOM 72687 H2 WAT 5752 22.978 36.659 79.515 1.00 0.00 H TER 72689 WAT 5752 ATOM 72689 O WAT 5753 133.217 93.799 66.446 1.00 0.00 O ATOM 72690 H1 WAT 5753 133.601 94.522 66.942 1.00 0.00 H ATOM 72691 H2 WAT 5753 133.718 93.775 65.631 1.00 0.00 H TER 72693 WAT 5753 ATOM 72693 O WAT 5754 141.681 112.426 13.049 1.00 0.00 O ATOM 72694 H1 WAT 5754 142.201 111.849 12.489 1.00 0.00 H ATOM 72695 H2 WAT 5754 141.030 112.808 12.460 1.00 0.00 H TER 72697 WAT 5754 ATOM 72697 O WAT 5755 20.937 87.652 129.160 1.00 0.00 O ATOM 72698 H1 WAT 5755 21.116 88.116 129.978 1.00 0.00 H ATOM 72699 H2 WAT 5755 19.989 87.722 129.046 1.00 0.00 H TER 72701 WAT 5755 ATOM 72701 O WAT 5756 133.765 20.148 68.697 1.00 0.00 O ATOM 72702 H1 WAT 5756 133.518 20.882 68.133 1.00 0.00 H ATOM 72703 H2 WAT 5756 134.716 20.217 68.776 1.00 0.00 H TER 72705 WAT 5756 ATOM 72705 O WAT 5757 20.462 117.915 11.611 1.00 0.00 O ATOM 72706 H1 WAT 5757 21.183 117.289 11.676 1.00 0.00 H ATOM 72707 H2 WAT 5757 19.843 117.506 11.006 1.00 0.00 H TER 72709 WAT 5757 ATOM 72709 O WAT 5758 59.619 35.413 127.559 1.00 0.00 O ATOM 72710 H1 WAT 5758 59.813 35.202 128.472 1.00 0.00 H ATOM 72711 H2 WAT 5758 58.923 36.068 127.607 1.00 0.00 H TER 72713 WAT 5758 ATOM 72713 O WAT 5759 30.224 88.945 82.775 1.00 0.00 O ATOM 72714 H1 WAT 5759 30.993 88.733 83.305 1.00 0.00 H ATOM 72715 H2 WAT 5759 29.848 89.717 83.196 1.00 0.00 H TER 72717 WAT 5759 ATOM 72717 O WAT 5760 19.405 89.911 154.001 1.00 0.00 O ATOM 72718 H1 WAT 5760 18.742 90.328 153.450 1.00 0.00 H ATOM 72719 H2 WAT 5760 19.194 88.978 153.965 1.00 0.00 H TER 72721 WAT 5760 ATOM 72721 O WAT 5761 30.936 138.737 106.903 1.00 0.00 O ATOM 72722 H1 WAT 5761 31.848 138.453 106.970 1.00 0.00 H ATOM 72723 H2 WAT 5761 30.477 138.227 107.571 1.00 0.00 H TER 72725 WAT 5761 ATOM 72725 O WAT 5762 29.263 43.354 74.981 1.00 0.00 O ATOM 72726 H1 WAT 5762 29.559 44.087 74.441 1.00 0.00 H ATOM 72727 H2 WAT 5762 30.044 43.081 75.463 1.00 0.00 H TER 72729 WAT 5762 ATOM 72729 O WAT 5763 41.953 40.314 8.936 1.00 0.00 O ATOM 72730 H1 WAT 5763 42.779 40.763 9.116 1.00 0.00 H ATOM 72731 H2 WAT 5763 42.211 39.420 8.712 1.00 0.00 H TER 72733 WAT 5763 ATOM 72733 O WAT 5764 38.204 82.339 118.420 1.00 0.00 O ATOM 72734 H1 WAT 5764 38.400 81.409 118.306 1.00 0.00 H ATOM 72735 H2 WAT 5764 38.190 82.691 117.530 1.00 0.00 H TER 72737 WAT 5764 ATOM 72737 O WAT 5765 98.911 112.105 153.847 1.00 0.00 O ATOM 72738 H1 WAT 5765 98.506 111.501 154.469 1.00 0.00 H ATOM 72739 H2 WAT 5765 98.223 112.739 153.645 1.00 0.00 H TER 72741 WAT 5765 ATOM 72741 O WAT 5766 38.967 81.163 105.004 1.00 0.00 O ATOM 72742 H1 WAT 5766 38.141 80.880 104.612 1.00 0.00 H ATOM 72743 H2 WAT 5766 38.839 81.040 105.945 1.00 0.00 H TER 72745 WAT 5766 ATOM 72745 O WAT 5767 93.023 108.959 142.288 1.00 0.00 O ATOM 72746 H1 WAT 5767 92.782 109.583 142.972 1.00 0.00 H ATOM 72747 H2 WAT 5767 92.635 109.316 141.489 1.00 0.00 H TER 72749 WAT 5767 ATOM 72749 O WAT 5768 137.758 99.722 118.108 1.00 0.00 O ATOM 72750 H1 WAT 5768 138.683 99.537 117.943 1.00 0.00 H ATOM 72751 H2 WAT 5768 137.361 98.860 118.232 1.00 0.00 H TER 72753 WAT 5768 ATOM 72753 O WAT 5769 58.766 139.969 21.724 1.00 0.00 O ATOM 72754 H1 WAT 5769 58.836 139.038 21.513 1.00 0.00 H ATOM 72755 H2 WAT 5769 58.305 139.990 22.563 1.00 0.00 H TER 72757 WAT 5769 ATOM 72757 O WAT 5770 112.196 119.275 9.395 1.00 0.00 O ATOM 72758 H1 WAT 5770 112.064 120.219 9.487 1.00 0.00 H ATOM 72759 H2 WAT 5770 112.190 118.944 10.293 1.00 0.00 H TER 72761 WAT 5770 ATOM 72761 O WAT 5771 87.838 34.895 70.349 1.00 0.00 O ATOM 72762 H1 WAT 5771 87.358 35.451 70.964 1.00 0.00 H ATOM 72763 H2 WAT 5771 87.910 35.423 69.554 1.00 0.00 H TER 72765 WAT 5771 ATOM 72765 O WAT 5772 0.276 99.853 137.172 1.00 0.00 O ATOM 72766 H1 WAT 5772 -0.105 99.110 136.703 1.00 0.00 H ATOM 72767 H2 WAT 5772 0.840 100.280 136.527 1.00 0.00 H TER 72769 WAT 5772 ATOM 72769 O WAT 5773 78.642 53.165 104.965 1.00 0.00 O ATOM 72770 H1 WAT 5773 78.288 52.449 105.494 1.00 0.00 H ATOM 72771 H2 WAT 5773 78.136 53.136 104.153 1.00 0.00 H TER 72773 WAT 5773 ATOM 72773 O WAT 5774 70.427 60.947 82.109 1.00 0.00 O ATOM 72774 H1 WAT 5774 69.573 61.379 82.086 1.00 0.00 H ATOM 72775 H2 WAT 5774 71.055 61.662 82.208 1.00 0.00 H TER 72777 WAT 5774 ATOM 72777 O WAT 5775 8.247 11.682 68.866 1.00 0.00 O ATOM 72778 H1 WAT 5775 7.777 12.312 68.319 1.00 0.00 H ATOM 72779 H2 WAT 5775 7.593 11.017 69.082 1.00 0.00 H TER 72781 WAT 5775 ATOM 72781 O WAT 5776 60.401 39.138 14.904 1.00 0.00 O ATOM 72782 H1 WAT 5776 60.138 38.375 15.418 1.00 0.00 H ATOM 72783 H2 WAT 5776 59.797 39.830 15.174 1.00 0.00 H TER 72785 WAT 5776 ATOM 72785 O WAT 5777 110.047 34.992 63.978 1.00 0.00 O ATOM 72786 H1 WAT 5777 110.652 35.129 64.707 1.00 0.00 H ATOM 72787 H2 WAT 5777 110.388 35.546 63.277 1.00 0.00 H TER 72789 WAT 5777 ATOM 72789 O WAT 5778 35.398 88.920 93.600 1.00 0.00 O ATOM 72790 H1 WAT 5778 35.437 89.876 93.613 1.00 0.00 H ATOM 72791 H2 WAT 5778 35.026 88.684 94.450 1.00 0.00 H TER 72793 WAT 5778 ATOM 72793 O WAT 5779 63.369 109.839 105.426 1.00 0.00 O ATOM 72794 H1 WAT 5779 63.431 109.780 104.472 1.00 0.00 H ATOM 72795 H2 WAT 5779 63.505 108.941 105.730 1.00 0.00 H TER 72797 WAT 5779 ATOM 72797 O WAT 5780 7.222 31.220 89.841 1.00 0.00 O ATOM 72798 H1 WAT 5780 6.609 30.487 89.893 1.00 0.00 H ATOM 72799 H2 WAT 5780 7.625 31.258 90.708 1.00 0.00 H TER 72801 WAT 5780 ATOM 72801 O WAT 5781 113.040 116.816 143.712 1.00 0.00 O ATOM 72802 H1 WAT 5781 113.622 116.330 143.127 1.00 0.00 H ATOM 72803 H2 WAT 5781 113.553 116.942 144.510 1.00 0.00 H TER 72805 WAT 5781 ATOM 72805 O WAT 5782 134.200 69.624 127.629 1.00 0.00 O ATOM 72806 H1 WAT 5782 134.423 68.871 127.083 1.00 0.00 H ATOM 72807 H2 WAT 5782 133.328 69.884 127.332 1.00 0.00 H TER 72809 WAT 5782 ATOM 72809 O WAT 5783 130.504 28.197 83.959 1.00 0.00 O ATOM 72810 H1 WAT 5783 131.066 28.029 84.715 1.00 0.00 H ATOM 72811 H2 WAT 5783 131.074 28.064 83.202 1.00 0.00 H TER 72813 WAT 5783 ATOM 72813 O WAT 5784 54.061 132.090 12.586 1.00 0.00 O ATOM 72814 H1 WAT 5784 54.262 131.570 11.808 1.00 0.00 H ATOM 72815 H2 WAT 5784 53.709 131.457 13.212 1.00 0.00 H TER 72817 WAT 5784 ATOM 72817 O WAT 5785 102.594 25.153 0.828 1.00 0.00 O ATOM 72818 H1 WAT 5785 103.205 24.591 1.305 1.00 0.00 H ATOM 72819 H2 WAT 5785 101.888 25.323 1.452 1.00 0.00 H TER 72821 WAT 5785 ATOM 72821 O WAT 5786 56.536 6.910 88.894 1.00 0.00 O ATOM 72822 H1 WAT 5786 56.497 6.934 89.850 1.00 0.00 H ATOM 72823 H2 WAT 5786 56.779 7.801 88.642 1.00 0.00 H TER 72825 WAT 5786 ATOM 72825 O WAT 5787 94.767 124.307 82.633 1.00 0.00 O ATOM 72826 H1 WAT 5787 95.393 123.596 82.494 1.00 0.00 H ATOM 72827 H2 WAT 5787 95.136 125.048 82.153 1.00 0.00 H TER 72829 WAT 5787 ATOM 72829 O WAT 5788 112.131 141.531 1.412 1.00 0.00 O ATOM 72830 H1 WAT 5788 112.827 141.881 1.968 1.00 0.00 H ATOM 72831 H2 WAT 5788 111.504 141.149 2.026 1.00 0.00 H TER 72833 WAT 5788 ATOM 72833 O WAT 5789 20.329 142.899 136.720 1.00 0.00 O ATOM 72834 H1 WAT 5789 19.435 142.791 137.043 1.00 0.00 H ATOM 72835 H2 WAT 5789 20.568 143.792 136.968 1.00 0.00 H TER 72837 WAT 5789 ATOM 72837 O WAT 5790 110.552 68.641 99.966 1.00 0.00 O ATOM 72838 H1 WAT 5790 110.452 67.691 100.019 1.00 0.00 H ATOM 72839 H2 WAT 5790 110.452 68.944 100.868 1.00 0.00 H TER 72841 WAT 5790 ATOM 72841 O WAT 5791 56.483 127.872 140.177 1.00 0.00 O ATOM 72842 H1 WAT 5791 56.654 128.015 139.247 1.00 0.00 H ATOM 72843 H2 WAT 5791 57.347 127.721 140.559 1.00 0.00 H TER 72845 WAT 5791 ATOM 72845 O WAT 5792 98.959 78.502 2.894 1.00 0.00 O ATOM 72846 H1 WAT 5792 99.230 77.704 3.347 1.00 0.00 H ATOM 72847 H2 WAT 5792 99.211 78.358 1.982 1.00 0.00 H TER 72849 WAT 5792 ATOM 72849 O WAT 5793 110.169 60.265 107.208 1.00 0.00 O ATOM 72850 H1 WAT 5793 109.831 60.124 108.092 1.00 0.00 H ATOM 72851 H2 WAT 5793 109.580 60.917 106.828 1.00 0.00 H TER 72853 WAT 5793 ATOM 72853 O WAT 5794 103.156 64.394 138.777 1.00 0.00 O ATOM 72854 H1 WAT 5794 103.917 64.485 139.350 1.00 0.00 H ATOM 72855 H2 WAT 5794 103.454 64.719 137.928 1.00 0.00 H TER 72857 WAT 5794 ATOM 72857 O WAT 5795 88.980 10.745 147.762 1.00 0.00 O ATOM 72858 H1 WAT 5795 88.029 10.798 147.660 1.00 0.00 H ATOM 72859 H2 WAT 5795 89.168 11.280 148.533 1.00 0.00 H TER 72861 WAT 5795 ATOM 72861 O WAT 5796 66.918 135.839 11.834 1.00 0.00 O ATOM 72862 H1 WAT 5796 67.776 136.081 11.487 1.00 0.00 H ATOM 72863 H2 WAT 5796 66.341 136.554 11.568 1.00 0.00 H TER 72865 WAT 5796 ATOM 72865 O WAT 5797 95.842 88.945 68.490 1.00 0.00 O ATOM 72866 H1 WAT 5797 95.952 88.235 67.857 1.00 0.00 H ATOM 72867 H2 WAT 5797 95.325 88.558 69.196 1.00 0.00 H TER 72869 WAT 5797 ATOM 72869 O WAT 5798 100.511 4.990 14.048 1.00 0.00 O ATOM 72870 H1 WAT 5798 100.404 4.095 13.725 1.00 0.00 H ATOM 72871 H2 WAT 5798 101.369 5.262 13.723 1.00 0.00 H TER 72873 WAT 5798 ATOM 72873 O WAT 5799 114.986 62.913 81.982 1.00 0.00 O ATOM 72874 H1 WAT 5799 115.386 63.779 82.061 1.00 0.00 H ATOM 72875 H2 WAT 5799 115.046 62.706 81.049 1.00 0.00 H TER 72877 WAT 5799 ATOM 72877 O WAT 5800 96.019 37.480 134.930 1.00 0.00 O ATOM 72878 H1 WAT 5800 96.623 36.807 135.244 1.00 0.00 H ATOM 72879 H2 WAT 5800 95.149 37.127 135.116 1.00 0.00 H TER 72881 WAT 5800 ATOM 72881 O WAT 5801 145.545 123.162 16.150 1.00 0.00 O ATOM 72882 H1 WAT 5801 144.888 123.318 16.830 1.00 0.00 H ATOM 72883 H2 WAT 5801 145.639 124.007 15.710 1.00 0.00 H TER 72885 WAT 5801 ATOM 72885 O WAT 5802 132.514 42.949 99.429 1.00 0.00 O ATOM 72886 H1 WAT 5802 132.518 42.054 99.088 1.00 0.00 H ATOM 72887 H2 WAT 5802 133.122 42.927 100.167 1.00 0.00 H TER 72889 WAT 5802 ATOM 72889 O WAT 5803 10.194 19.341 10.853 1.00 0.00 O ATOM 72890 H1 WAT 5803 9.456 19.938 10.738 1.00 0.00 H ATOM 72891 H2 WAT 5803 9.798 18.470 10.869 1.00 0.00 H TER 72893 WAT 5803 ATOM 72893 O WAT 5804 72.054 91.992 114.675 1.00 0.00 O ATOM 72894 H1 WAT 5804 71.858 92.928 114.641 1.00 0.00 H ATOM 72895 H2 WAT 5804 71.675 91.698 115.504 1.00 0.00 H TER 72897 WAT 5804 ATOM 72897 O WAT 5805 142.394 33.367 129.409 1.00 0.00 O ATOM 72898 H1 WAT 5805 143.011 33.394 130.141 1.00 0.00 H ATOM 72899 H2 WAT 5805 141.983 32.505 129.475 1.00 0.00 H TER 72901 WAT 5805 ATOM 72901 O WAT 5806 98.202 9.296 1.075 1.00 0.00 O ATOM 72902 H1 WAT 5806 97.876 8.789 0.331 1.00 0.00 H ATOM 72903 H2 WAT 5806 99.155 9.238 1.005 1.00 0.00 H TER 72905 WAT 5806 ATOM 72905 O WAT 5807 58.334 82.092 99.704 1.00 0.00 O ATOM 72906 H1 WAT 5807 57.619 82.068 99.068 1.00 0.00 H ATOM 72907 H2 WAT 5807 58.767 81.244 99.609 1.00 0.00 H TER 72909 WAT 5807 ATOM 72909 O WAT 5808 105.592 17.687 76.300 1.00 0.00 O ATOM 72910 H1 WAT 5808 105.623 17.889 77.235 1.00 0.00 H ATOM 72911 H2 WAT 5808 106.510 17.615 76.040 1.00 0.00 H TER 72913 WAT 5808 ATOM 72913 O WAT 5809 53.013 4.657 92.999 1.00 0.00 O ATOM 72914 H1 WAT 5809 53.107 3.810 93.434 1.00 0.00 H ATOM 72915 H2 WAT 5809 53.265 5.297 93.665 1.00 0.00 H TER 72917 WAT 5809 ATOM 72917 O WAT 5810 33.552 119.878 126.274 1.00 0.00 O ATOM 72918 H1 WAT 5810 33.191 120.678 125.892 1.00 0.00 H ATOM 72919 H2 WAT 5810 34.454 119.846 125.957 1.00 0.00 H TER 72921 WAT 5810 ATOM 72921 O WAT 5811 119.130 80.088 23.967 1.00 0.00 O ATOM 72922 H1 WAT 5811 118.282 80.429 24.250 1.00 0.00 H ATOM 72923 H2 WAT 5811 118.981 79.789 23.071 1.00 0.00 H TER 72925 WAT 5811 ATOM 72925 O WAT 5812 66.034 39.462 70.825 1.00 0.00 O ATOM 72926 H1 WAT 5812 65.293 40.015 70.580 1.00 0.00 H ATOM 72927 H2 WAT 5812 66.220 38.948 70.038 1.00 0.00 H TER 72929 WAT 5812 ATOM 72929 O WAT 5813 137.044 119.063 14.167 1.00 0.00 O ATOM 72930 H1 WAT 5813 137.026 119.968 14.476 1.00 0.00 H ATOM 72931 H2 WAT 5813 136.952 118.537 14.961 1.00 0.00 H TER 72933 WAT 5813 ATOM 72933 O WAT 5814 126.252 122.642 158.759 1.00 0.00 O ATOM 72934 H1 WAT 5814 125.684 123.349 158.453 1.00 0.00 H ATOM 72935 H2 WAT 5814 125.723 121.851 158.661 1.00 0.00 H TER 72937 WAT 5814 ATOM 72937 O WAT 5815 65.700 57.992 72.656 1.00 0.00 O ATOM 72938 H1 WAT 5815 65.485 58.399 73.496 1.00 0.00 H ATOM 72939 H2 WAT 5815 66.656 58.022 72.614 1.00 0.00 H TER 72941 WAT 5815 ATOM 72941 O WAT 5816 115.568 106.028 108.014 1.00 0.00 O ATOM 72942 H1 WAT 5816 115.767 105.328 108.636 1.00 0.00 H ATOM 72943 H2 WAT 5816 114.649 105.891 107.785 1.00 0.00 H TER 72945 WAT 5816 ATOM 72945 O WAT 5817 89.417 30.144 68.896 1.00 0.00 O ATOM 72946 H1 WAT 5817 89.724 30.327 68.008 1.00 0.00 H ATOM 72947 H2 WAT 5817 89.597 30.948 69.383 1.00 0.00 H TER 72949 WAT 5817 ATOM 72949 O WAT 5818 135.668 57.532 81.077 1.00 0.00 O ATOM 72950 H1 WAT 5818 136.151 57.875 80.326 1.00 0.00 H ATOM 72951 H2 WAT 5818 135.537 56.605 80.875 1.00 0.00 H TER 72953 WAT 5818 ATOM 72953 O WAT 5819 137.730 103.268 136.973 1.00 0.00 O ATOM 72954 H1 WAT 5819 136.946 103.256 137.521 1.00 0.00 H ATOM 72955 H2 WAT 5819 138.366 103.776 137.475 1.00 0.00 H TER 72957 WAT 5819 ATOM 72957 O WAT 5820 86.682 48.848 77.742 1.00 0.00 O ATOM 72958 H1 WAT 5820 85.917 49.130 78.243 1.00 0.00 H ATOM 72959 H2 WAT 5820 86.470 49.071 76.836 1.00 0.00 H TER 72961 WAT 5820 ATOM 72961 O WAT 5821 113.388 4.708 19.535 1.00 0.00 O ATOM 72962 H1 WAT 5821 113.214 5.197 18.731 1.00 0.00 H ATOM 72963 H2 WAT 5821 112.621 4.868 20.084 1.00 0.00 H TER 72965 WAT 5821 ATOM 72965 O WAT 5822 26.183 44.214 25.697 1.00 0.00 O ATOM 72966 H1 WAT 5822 25.820 44.804 26.358 1.00 0.00 H ATOM 72967 H2 WAT 5822 25.798 44.512 24.873 1.00 0.00 H TER 72969 WAT 5822 ATOM 72969 O WAT 5823 52.138 81.932 112.133 1.00 0.00 O ATOM 72970 H1 WAT 5823 52.685 81.528 111.459 1.00 0.00 H ATOM 72971 H2 WAT 5823 51.254 81.915 111.767 1.00 0.00 H TER 72973 WAT 5823 ATOM 72973 O WAT 5824 124.979 32.005 70.796 1.00 0.00 O ATOM 72974 H1 WAT 5824 125.446 32.839 70.762 1.00 0.00 H ATOM 72975 H2 WAT 5824 124.140 32.182 70.371 1.00 0.00 H TER 72977 WAT 5824 ATOM 72977 O WAT 5825 31.593 23.438 90.416 1.00 0.00 O ATOM 72978 H1 WAT 5825 31.836 22.538 90.631 1.00 0.00 H ATOM 72979 H2 WAT 5825 32.395 23.827 90.069 1.00 0.00 H TER 72981 WAT 5825 ATOM 72981 O WAT 5826 100.459 16.719 105.969 1.00 0.00 O ATOM 72982 H1 WAT 5826 101.186 16.909 106.562 1.00 0.00 H ATOM 72983 H2 WAT 5826 100.850 16.188 105.274 1.00 0.00 H TER 72985 WAT 5826 ATOM 72985 O WAT 5827 111.859 79.926 62.661 1.00 0.00 O ATOM 72986 H1 WAT 5827 111.188 79.404 62.223 1.00 0.00 H ATOM 72987 H2 WAT 5827 112.290 80.406 61.954 1.00 0.00 H TER 72989 WAT 5827 ATOM 72989 O WAT 5828 124.298 18.004 128.839 1.00 0.00 O ATOM 72990 H1 WAT 5828 125.214 18.271 128.909 1.00 0.00 H ATOM 72991 H2 WAT 5828 124.215 17.661 127.950 1.00 0.00 H TER 72993 WAT 5828 ATOM 72993 O WAT 5829 36.110 47.879 4.192 1.00 0.00 O ATOM 72994 H1 WAT 5829 36.899 48.233 3.782 1.00 0.00 H ATOM 72995 H2 WAT 5829 36.232 48.043 5.127 1.00 0.00 H TER 72997 WAT 5829 ATOM 72997 O WAT 5830 7.331 5.094 79.318 1.00 0.00 O ATOM 72998 H1 WAT 5830 7.427 6.034 79.168 1.00 0.00 H ATOM 72999 H2 WAT 5830 8.005 4.884 79.965 1.00 0.00 H TER 73001 WAT 5830 ATOM 73001 O WAT 5831 123.287 134.333 66.696 1.00 0.00 O ATOM 73002 H1 WAT 5831 123.185 133.388 66.811 1.00 0.00 H ATOM 73003 H2 WAT 5831 124.004 134.422 66.069 1.00 0.00 H TER 73005 WAT 5831 ATOM 73005 O WAT 5832 63.076 23.633 137.667 1.00 0.00 O ATOM 73006 H1 WAT 5832 62.144 23.536 137.858 1.00 0.00 H ATOM 73007 H2 WAT 5832 63.411 22.736 137.647 1.00 0.00 H TER 73009 WAT 5832 ATOM 73009 O WAT 5833 94.404 103.364 75.679 1.00 0.00 O ATOM 73010 H1 WAT 5833 93.575 102.888 75.721 1.00 0.00 H ATOM 73011 H2 WAT 5833 94.153 104.286 75.732 1.00 0.00 H TER 73013 WAT 5833 ATOM 73013 O WAT 5834 128.543 119.860 76.112 1.00 0.00 O ATOM 73014 H1 WAT 5834 127.707 119.483 75.837 1.00 0.00 H ATOM 73015 H2 WAT 5834 128.663 120.619 75.542 1.00 0.00 H TER 73017 WAT 5834 ATOM 73017 O WAT 5835 84.867 11.787 121.297 1.00 0.00 O ATOM 73018 H1 WAT 5835 85.204 11.195 121.969 1.00 0.00 H ATOM 73019 H2 WAT 5835 85.637 12.025 120.780 1.00 0.00 H TER 73021 WAT 5835 ATOM 73021 O WAT 5836 144.774 97.312 147.917 1.00 0.00 O ATOM 73022 H1 WAT 5836 144.509 97.607 147.046 1.00 0.00 H ATOM 73023 H2 WAT 5836 144.455 97.993 148.508 1.00 0.00 H TER 73025 WAT 5836 ATOM 73025 O WAT 5837 90.023 66.637 142.862 1.00 0.00 O ATOM 73026 H1 WAT 5837 90.044 65.833 143.381 1.00 0.00 H ATOM 73027 H2 WAT 5837 89.565 66.391 142.058 1.00 0.00 H TER 73029 WAT 5837 ATOM 73029 O WAT 5838 110.641 139.059 85.798 1.00 0.00 O ATOM 73030 H1 WAT 5838 111.024 139.423 85.000 1.00 0.00 H ATOM 73031 H2 WAT 5838 109.701 139.025 85.620 1.00 0.00 H TER 73033 WAT 5838 ATOM 73033 O WAT 5839 56.295 17.927 84.286 1.00 0.00 O ATOM 73034 H1 WAT 5839 55.898 18.623 83.763 1.00 0.00 H ATOM 73035 H2 WAT 5839 56.751 18.386 84.991 1.00 0.00 H TER 73037 WAT 5839 ATOM 73037 O WAT 5840 13.366 109.488 76.968 1.00 0.00 O ATOM 73038 H1 WAT 5840 13.557 109.095 76.116 1.00 0.00 H ATOM 73039 H2 WAT 5840 12.413 109.584 76.980 1.00 0.00 H TER 73041 WAT 5840 ATOM 73041 O WAT 5841 128.704 117.124 106.656 1.00 0.00 O ATOM 73042 H1 WAT 5841 128.537 116.243 106.321 1.00 0.00 H ATOM 73043 H2 WAT 5841 129.657 117.213 106.630 1.00 0.00 H TER 73045 WAT 5841 ATOM 73045 O WAT 5842 6.032 81.847 96.700 1.00 0.00 O ATOM 73046 H1 WAT 5842 6.889 81.423 96.674 1.00 0.00 H ATOM 73047 H2 WAT 5842 5.447 81.184 97.066 1.00 0.00 H TER 73049 WAT 5842 ATOM 73049 O WAT 5843 123.214 124.218 21.810 1.00 0.00 O ATOM 73050 H1 WAT 5843 123.247 123.505 21.172 1.00 0.00 H ATOM 73051 H2 WAT 5843 124.131 124.451 21.957 1.00 0.00 H TER 73053 WAT 5843 ATOM 73053 O WAT 5844 64.702 48.275 72.424 1.00 0.00 O ATOM 73054 H1 WAT 5844 64.740 48.375 73.376 1.00 0.00 H ATOM 73055 H2 WAT 5844 63.771 48.348 72.213 1.00 0.00 H TER 73057 WAT 5844 ATOM 73057 O WAT 5845 50.572 8.945 69.097 1.00 0.00 O ATOM 73058 H1 WAT 5845 51.494 8.688 69.070 1.00 0.00 H ATOM 73059 H2 WAT 5845 50.224 8.679 68.246 1.00 0.00 H TER 73061 WAT 5845 ATOM 73061 O WAT 5846 103.233 105.689 136.481 1.00 0.00 O ATOM 73062 H1 WAT 5846 103.840 105.236 135.896 1.00 0.00 H ATOM 73063 H2 WAT 5846 102.472 105.883 135.933 1.00 0.00 H TER 73065 WAT 5846 ATOM 73065 O WAT 5847 3.324 55.099 112.332 1.00 0.00 O ATOM 73066 H1 WAT 5847 3.469 56.044 112.290 1.00 0.00 H ATOM 73067 H2 WAT 5847 2.958 54.874 111.477 1.00 0.00 H TER 73069 WAT 5847 ATOM 73069 O WAT 5848 69.811 11.690 156.434 1.00 0.00 O ATOM 73070 H1 WAT 5848 69.493 10.846 156.112 1.00 0.00 H ATOM 73071 H2 WAT 5848 69.706 12.284 155.691 1.00 0.00 H TER 73073 WAT 5848 ATOM 73073 O WAT 5849 95.582 122.733 149.949 1.00 0.00 O ATOM 73074 H1 WAT 5849 95.021 123.407 150.332 1.00 0.00 H ATOM 73075 H2 WAT 5849 95.971 123.152 149.182 1.00 0.00 H TER 73077 WAT 5849 ATOM 73077 O WAT 5850 3.908 31.404 5.115 1.00 0.00 O ATOM 73078 H1 WAT 5850 4.712 31.036 4.749 1.00 0.00 H ATOM 73079 H2 WAT 5850 4.129 32.315 5.310 1.00 0.00 H TER 73081 WAT 5850 ATOM 73081 O WAT 5851 110.912 29.504 152.546 1.00 0.00 O ATOM 73082 H1 WAT 5851 111.428 29.757 151.781 1.00 0.00 H ATOM 73083 H2 WAT 5851 110.249 30.191 152.625 1.00 0.00 H TER 73085 WAT 5851 ATOM 73085 O WAT 5852 94.862 100.116 76.745 1.00 0.00 O ATOM 73086 H1 WAT 5852 95.547 100.779 76.829 1.00 0.00 H ATOM 73087 H2 WAT 5852 95.305 99.361 76.359 1.00 0.00 H TER 73089 WAT 5852 ATOM 73089 O WAT 5853 110.467 46.136 116.271 1.00 0.00 O ATOM 73090 H1 WAT 5853 109.664 45.723 116.586 1.00 0.00 H ATOM 73091 H2 WAT 5853 110.347 46.204 115.324 1.00 0.00 H TER 73093 WAT 5853 ATOM 73093 O WAT 5854 131.002 142.115 18.437 1.00 0.00 O ATOM 73094 H1 WAT 5854 131.542 142.814 18.067 1.00 0.00 H ATOM 73095 H2 WAT 5854 131.187 141.353 17.888 1.00 0.00 H TER 73097 WAT 5854 ATOM 73097 O WAT 5855 111.624 82.768 97.077 1.00 0.00 O ATOM 73098 H1 WAT 5855 111.487 82.678 96.134 1.00 0.00 H ATOM 73099 H2 WAT 5855 112.415 83.302 97.154 1.00 0.00 H TER 73101 WAT 5855 ATOM 73101 O WAT 5856 90.989 56.440 125.028 1.00 0.00 O ATOM 73102 H1 WAT 5856 91.858 56.059 125.156 1.00 0.00 H ATOM 73103 H2 WAT 5856 90.680 56.060 124.205 1.00 0.00 H TER 73105 WAT 5856 ATOM 73105 O WAT 5857 100.579 55.572 104.460 1.00 0.00 O ATOM 73106 H1 WAT 5857 101.464 55.208 104.439 1.00 0.00 H ATOM 73107 H2 WAT 5857 100.115 55.116 103.759 1.00 0.00 H TER 73109 WAT 5857 ATOM 73109 O WAT 5858 6.338 72.965 4.247 1.00 0.00 O ATOM 73110 H1 WAT 5858 6.018 73.862 4.349 1.00 0.00 H ATOM 73111 H2 WAT 5858 7.291 73.045 4.289 1.00 0.00 H TER 73113 WAT 5858 ATOM 73113 O WAT 5859 64.827 86.178 136.579 1.00 0.00 O ATOM 73114 H1 WAT 5859 64.195 85.528 136.273 1.00 0.00 H ATOM 73115 H2 WAT 5859 65.343 86.395 135.802 1.00 0.00 H TER 73117 WAT 5859 ATOM 73117 O WAT 5860 121.092 96.406 88.221 1.00 0.00 O ATOM 73118 H1 WAT 5860 121.796 96.371 88.870 1.00 0.00 H ATOM 73119 H2 WAT 5860 121.309 97.161 87.674 1.00 0.00 H TER 73121 WAT 5860 ATOM 73121 O WAT 5861 50.747 103.935 115.870 1.00 0.00 O ATOM 73122 H1 WAT 5861 49.805 104.033 116.010 1.00 0.00 H ATOM 73123 H2 WAT 5861 50.827 103.169 115.302 1.00 0.00 H TER 73125 WAT 5861 ATOM 73125 O WAT 5862 20.913 7.668 10.534 1.00 0.00 O ATOM 73126 H1 WAT 5862 21.854 7.801 10.646 1.00 0.00 H ATOM 73127 H2 WAT 5862 20.762 7.800 9.598 1.00 0.00 H TER 73129 WAT 5862 ATOM 73129 O WAT 5863 28.861 28.390 116.865 1.00 0.00 O ATOM 73130 H1 WAT 5863 28.339 28.128 117.624 1.00 0.00 H ATOM 73131 H2 WAT 5863 28.340 28.115 116.110 1.00 0.00 H TER 73133 WAT 5863 ATOM 73133 O WAT 5864 139.367 106.865 89.893 1.00 0.00 O ATOM 73134 H1 WAT 5864 139.363 106.345 89.090 1.00 0.00 H ATOM 73135 H2 WAT 5864 140.263 106.792 90.222 1.00 0.00 H TER 73137 WAT 5864 ATOM 73137 O WAT 5865 122.307 40.165 141.486 1.00 0.00 O ATOM 73138 H1 WAT 5865 122.792 39.344 141.564 1.00 0.00 H ATOM 73139 H2 WAT 5865 122.365 40.391 140.558 1.00 0.00 H TER 73141 WAT 5865 ATOM 73141 O WAT 5866 137.788 105.549 126.360 1.00 0.00 O ATOM 73142 H1 WAT 5866 137.056 105.427 126.965 1.00 0.00 H ATOM 73143 H2 WAT 5866 138.489 105.909 126.902 1.00 0.00 H TER 73145 WAT 5866 ATOM 73145 O WAT 5867 1.343 143.089 149.587 1.00 0.00 O ATOM 73146 H1 WAT 5867 0.671 143.216 150.256 1.00 0.00 H ATOM 73147 H2 WAT 5867 1.851 142.339 149.897 1.00 0.00 H TER 73149 WAT 5867 ATOM 73149 O WAT 5868 90.204 32.440 124.684 1.00 0.00 O ATOM 73150 H1 WAT 5868 89.682 31.757 124.262 1.00 0.00 H ATOM 73151 H2 WAT 5868 91.036 32.432 124.210 1.00 0.00 H TER 73153 WAT 5868 ATOM 73153 O WAT 5869 43.377 136.143 98.514 1.00 0.00 O ATOM 73154 H1 WAT 5869 43.061 136.609 97.740 1.00 0.00 H ATOM 73155 H2 WAT 5869 44.172 136.613 98.768 1.00 0.00 H TER 73157 WAT 5869 ATOM 73157 O WAT 5870 138.046 18.360 1.119 1.00 0.00 O ATOM 73158 H1 WAT 5870 137.569 17.530 1.130 1.00 0.00 H ATOM 73159 H2 WAT 5870 137.367 19.027 1.223 1.00 0.00 H TER 73161 WAT 5870 ATOM 73161 O WAT 5871 125.403 121.110 76.238 1.00 0.00 O ATOM 73162 H1 WAT 5871 125.952 121.886 76.121 1.00 0.00 H ATOM 73163 H2 WAT 5871 124.879 121.303 77.015 1.00 0.00 H TER 73165 WAT 5871 ATOM 73165 O WAT 5872 25.836 100.141 16.716 1.00 0.00 O ATOM 73166 H1 WAT 5872 26.183 100.205 17.606 1.00 0.00 H ATOM 73167 H2 WAT 5872 25.117 99.513 16.785 1.00 0.00 H TER 73169 WAT 5872 ATOM 73169 O WAT 5873 7.511 87.956 150.547 1.00 0.00 O ATOM 73170 H1 WAT 5873 8.163 87.477 151.060 1.00 0.00 H ATOM 73171 H2 WAT 5873 7.891 88.011 149.670 1.00 0.00 H TER 73173 WAT 5873 ATOM 73173 O WAT 5874 47.694 83.527 142.670 1.00 0.00 O ATOM 73174 H1 WAT 5874 47.462 84.092 141.932 1.00 0.00 H ATOM 73175 H2 WAT 5874 47.346 82.668 142.432 1.00 0.00 H TER 73177 WAT 5874 ATOM 73177 O WAT 5875 53.706 83.266 29.046 1.00 0.00 O ATOM 73178 H1 WAT 5875 52.900 83.322 29.558 1.00 0.00 H ATOM 73179 H2 WAT 5875 53.445 82.831 28.234 1.00 0.00 H TER 73181 WAT 5875 ATOM 73181 O WAT 5876 4.509 119.309 135.681 1.00 0.00 O ATOM 73182 H1 WAT 5876 4.003 120.107 135.832 1.00 0.00 H ATOM 73183 H2 WAT 5876 4.602 118.917 136.550 1.00 0.00 H TER 73185 WAT 5876 ATOM 73185 O WAT 5877 70.326 120.862 14.869 1.00 0.00 O ATOM 73186 H1 WAT 5877 69.911 121.270 14.110 1.00 0.00 H ATOM 73187 H2 WAT 5877 70.542 119.976 14.577 1.00 0.00 H TER 73189 WAT 5877 ATOM 73189 O WAT 5878 9.677 73.201 7.992 1.00 0.00 O ATOM 73190 H1 WAT 5878 10.423 73.308 8.582 1.00 0.00 H ATOM 73191 H2 WAT 5878 10.070 73.090 7.126 1.00 0.00 H TER 73193 WAT 5878 ATOM 73193 O WAT 5879 133.935 74.459 141.562 1.00 0.00 O ATOM 73194 H1 WAT 5879 133.273 74.901 141.031 1.00 0.00 H ATOM 73195 H2 WAT 5879 133.610 74.531 142.459 1.00 0.00 H TER 73197 WAT 5879 ATOM 73197 O WAT 5880 72.907 110.953 19.367 1.00 0.00 O ATOM 73198 H1 WAT 5880 72.611 111.710 19.873 1.00 0.00 H ATOM 73199 H2 WAT 5880 73.461 111.325 18.681 1.00 0.00 H TER 73201 WAT 5880 ATOM 73201 O WAT 5881 131.871 25.368 62.081 1.00 0.00 O ATOM 73202 H1 WAT 5881 132.369 26.101 62.444 1.00 0.00 H ATOM 73203 H2 WAT 5881 132.473 24.951 61.466 1.00 0.00 H TER 73205 WAT 5881 ATOM 73205 O WAT 5882 112.553 50.687 146.793 1.00 0.00 O ATOM 73206 H1 WAT 5882 112.046 51.268 147.360 1.00 0.00 H ATOM 73207 H2 WAT 5882 112.025 50.607 145.999 1.00 0.00 H TER 73209 WAT 5882 ATOM 73209 O WAT 5883 91.726 49.679 5.093 1.00 0.00 O ATOM 73210 H1 WAT 5883 91.408 50.306 5.742 1.00 0.00 H ATOM 73211 H2 WAT 5883 92.537 50.065 4.763 1.00 0.00 H TER 73213 WAT 5883 ATOM 73213 O WAT 5884 79.999 104.041 100.184 1.00 0.00 O ATOM 73214 H1 WAT 5884 79.944 104.657 99.454 1.00 0.00 H ATOM 73215 H2 WAT 5884 79.684 103.212 99.823 1.00 0.00 H TER 73217 WAT 5884 ATOM 73217 O WAT 5885 8.968 29.162 65.742 1.00 0.00 O ATOM 73218 H1 WAT 5885 9.398 29.620 66.465 1.00 0.00 H ATOM 73219 H2 WAT 5885 8.848 28.268 66.063 1.00 0.00 H TER 73221 WAT 5885 ATOM 73221 O WAT 5886 114.594 61.294 86.153 1.00 0.00 O ATOM 73222 H1 WAT 5886 114.955 62.166 86.313 1.00 0.00 H ATOM 73223 H2 WAT 5886 113.845 61.233 86.745 1.00 0.00 H TER 73225 WAT 5886 ATOM 73225 O WAT 5887 12.278 33.918 63.281 1.00 0.00 O ATOM 73226 H1 WAT 5887 12.417 32.971 63.267 1.00 0.00 H ATOM 73227 H2 WAT 5887 12.066 34.142 62.375 1.00 0.00 H TER 73229 WAT 5887 ATOM 73229 O WAT 5888 118.691 20.931 77.309 1.00 0.00 O ATOM 73230 H1 WAT 5888 118.721 21.828 76.977 1.00 0.00 H ATOM 73231 H2 WAT 5888 118.062 20.963 78.029 1.00 0.00 H TER 73233 WAT 5888 ATOM 73233 O WAT 5889 18.943 68.339 157.949 1.00 0.00 O ATOM 73234 H1 WAT 5889 18.683 69.155 158.377 1.00 0.00 H ATOM 73235 H2 WAT 5889 18.942 68.548 157.015 1.00 0.00 H TER 73237 WAT 5889 ATOM 73237 O WAT 5890 51.723 105.064 72.534 1.00 0.00 O ATOM 73238 H1 WAT 5890 52.447 104.462 72.704 1.00 0.00 H ATOM 73239 H2 WAT 5890 52.144 105.914 72.404 1.00 0.00 H TER 73241 WAT 5890 ATOM 73241 O WAT 5891 143.139 8.919 64.132 1.00 0.00 O ATOM 73242 H1 WAT 5891 143.343 7.993 64.000 1.00 0.00 H ATOM 73243 H2 WAT 5891 142.513 8.925 64.857 1.00 0.00 H TER 73245 WAT 5891 ATOM 73245 O WAT 5892 13.444 76.667 154.276 1.00 0.00 O ATOM 73246 H1 WAT 5892 12.884 76.435 153.535 1.00 0.00 H ATOM 73247 H2 WAT 5892 14.321 76.395 154.007 1.00 0.00 H TER 73249 WAT 5892 ATOM 73249 O WAT 5893 7.397 34.258 70.895 1.00 0.00 O ATOM 73250 H1 WAT 5893 7.252 33.668 70.155 1.00 0.00 H ATOM 73251 H2 WAT 5893 7.877 34.997 70.522 1.00 0.00 H TER 73253 WAT 5893 ATOM 73253 O WAT 5894 25.167 53.215 8.250 1.00 0.00 O ATOM 73254 H1 WAT 5894 25.980 53.052 7.772 1.00 0.00 H ATOM 73255 H2 WAT 5894 24.573 53.581 7.595 1.00 0.00 H TER 73257 WAT 5894 ATOM 73257 O WAT 5895 85.359 122.224 91.435 1.00 0.00 O ATOM 73258 H1 WAT 5895 84.535 121.964 91.847 1.00 0.00 H ATOM 73259 H2 WAT 5895 85.422 123.165 91.597 1.00 0.00 H TER 73261 WAT 5895 ATOM 73261 O WAT 5896 29.641 66.650 78.003 1.00 0.00 O ATOM 73262 H1 WAT 5896 28.862 66.406 77.502 1.00 0.00 H ATOM 73263 H2 WAT 5896 29.333 67.318 78.615 1.00 0.00 H TER 73265 WAT 5896 ATOM 73265 O WAT 5897 143.020 7.145 103.287 1.00 0.00 O ATOM 73266 H1 WAT 5897 142.391 7.666 103.786 1.00 0.00 H ATOM 73267 H2 WAT 5897 142.736 7.233 102.377 1.00 0.00 H TER 73269 WAT 5897 ATOM 73269 O WAT 5898 94.332 144.562 64.943 1.00 0.00 O ATOM 73270 H1 WAT 5898 93.480 144.413 64.533 1.00 0.00 H ATOM 73271 H2 WAT 5898 94.577 145.447 64.672 1.00 0.00 H TER 73273 WAT 5898 ATOM 73273 O WAT 5899 28.680 46.980 151.254 1.00 0.00 O ATOM 73274 H1 WAT 5899 28.051 46.657 151.898 1.00 0.00 H ATOM 73275 H2 WAT 5899 29.386 47.360 151.777 1.00 0.00 H TER 73277 WAT 5899 ATOM 73277 O WAT 5900 63.683 107.625 81.403 1.00 0.00 O ATOM 73278 H1 WAT 5900 62.873 107.664 80.896 1.00 0.00 H ATOM 73279 H2 WAT 5900 63.637 106.788 81.864 1.00 0.00 H TER 73281 WAT 5900 ATOM 73281 O WAT 5901 70.140 60.274 128.434 1.00 0.00 O ATOM 73282 H1 WAT 5901 69.790 60.967 128.993 1.00 0.00 H ATOM 73283 H2 WAT 5901 69.472 60.150 127.760 1.00 0.00 H TER 73285 WAT 5901 ATOM 73285 O WAT 5902 133.497 142.669 156.727 1.00 0.00 O ATOM 73286 H1 WAT 5902 134.153 142.987 156.107 1.00 0.00 H ATOM 73287 H2 WAT 5902 133.965 142.030 157.265 1.00 0.00 H TER 73289 WAT 5902 ATOM 73289 O WAT 5903 97.730 110.633 100.067 1.00 0.00 O ATOM 73290 H1 WAT 5903 96.879 110.826 100.462 1.00 0.00 H ATOM 73291 H2 WAT 5903 98.355 111.140 100.586 1.00 0.00 H TER 73293 WAT 5903 ATOM 73293 O WAT 5904 88.140 28.013 62.921 1.00 0.00 O ATOM 73294 H1 WAT 5904 87.406 27.627 63.400 1.00 0.00 H ATOM 73295 H2 WAT 5904 88.037 27.693 62.025 1.00 0.00 H TER 73297 WAT 5904 ATOM 73297 O WAT 5905 27.810 68.089 9.189 1.00 0.00 O ATOM 73298 H1 WAT 5905 28.152 68.851 9.656 1.00 0.00 H ATOM 73299 H2 WAT 5905 26.967 68.379 8.840 1.00 0.00 H TER 73301 WAT 5905 ATOM 73301 O WAT 5906 97.772 11.427 10.845 1.00 0.00 O ATOM 73302 H1 WAT 5906 98.059 11.568 9.943 1.00 0.00 H ATOM 73303 H2 WAT 5906 97.382 12.261 11.106 1.00 0.00 H TER 73305 WAT 5906 ATOM 73305 O WAT 5907 111.864 82.084 109.158 1.00 0.00 O ATOM 73306 H1 WAT 5907 111.234 81.754 109.798 1.00 0.00 H ATOM 73307 H2 WAT 5907 112.434 81.338 108.975 1.00 0.00 H TER 73309 WAT 5907 ATOM 73309 O WAT 5908 105.946 120.417 18.205 1.00 0.00 O ATOM 73310 H1 WAT 5908 105.623 120.535 19.099 1.00 0.00 H ATOM 73311 H2 WAT 5908 105.337 120.917 17.662 1.00 0.00 H TER 73313 WAT 5908 ATOM 73313 O WAT 5909 136.003 81.504 105.090 1.00 0.00 O ATOM 73314 H1 WAT 5909 136.876 81.777 104.808 1.00 0.00 H ATOM 73315 H2 WAT 5909 135.893 80.629 104.718 1.00 0.00 H TER 73317 WAT 5909 ATOM 73317 O WAT 5910 40.078 39.382 105.094 1.00 0.00 O ATOM 73318 H1 WAT 5910 41.027 39.505 105.071 1.00 0.00 H ATOM 73319 H2 WAT 5910 39.919 38.893 105.902 1.00 0.00 H TER 73321 WAT 5910 ATOM 73321 O WAT 5911 62.349 2.168 151.433 1.00 0.00 O ATOM 73322 H1 WAT 5911 62.180 3.102 151.553 1.00 0.00 H ATOM 73323 H2 WAT 5911 63.174 2.012 151.893 1.00 0.00 H TER 73325 WAT 5911 ATOM 73325 O WAT 5912 98.704 74.690 10.016 1.00 0.00 O ATOM 73326 H1 WAT 5912 98.848 73.910 9.480 1.00 0.00 H ATOM 73327 H2 WAT 5912 97.908 74.497 10.511 1.00 0.00 H TER 73329 WAT 5912 ATOM 73329 O WAT 5913 78.655 138.896 140.795 1.00 0.00 O ATOM 73330 H1 WAT 5913 79.521 139.049 140.418 1.00 0.00 H ATOM 73331 H2 WAT 5913 78.086 139.528 140.354 1.00 0.00 H TER 73333 WAT 5913 ATOM 73333 O WAT 5914 68.788 141.345 149.362 1.00 0.00 O ATOM 73334 H1 WAT 5914 69.278 140.985 150.101 1.00 0.00 H ATOM 73335 H2 WAT 5914 67.929 140.926 149.417 1.00 0.00 H TER 73337 WAT 5914 ATOM 73337 O WAT 5915 16.328 102.257 109.624 1.00 0.00 O ATOM 73338 H1 WAT 5915 17.228 102.357 109.312 1.00 0.00 H ATOM 73339 H2 WAT 5915 15.788 102.602 108.913 1.00 0.00 H TER 73341 WAT 5915 ATOM 73341 O WAT 5916 43.833 120.715 119.001 1.00 0.00 O ATOM 73342 H1 WAT 5916 43.453 121.345 119.613 1.00 0.00 H ATOM 73343 H2 WAT 5916 43.497 119.867 119.291 1.00 0.00 H TER 73345 WAT 5916 ATOM 73345 O WAT 5917 135.713 109.895 94.153 1.00 0.00 O ATOM 73346 H1 WAT 5917 135.081 109.674 93.469 1.00 0.00 H ATOM 73347 H2 WAT 5917 136.563 109.858 93.715 1.00 0.00 H TER 73349 WAT 5917 ATOM 73349 O WAT 5918 116.283 25.086 67.019 1.00 0.00 O ATOM 73350 H1 WAT 5918 116.059 24.610 67.818 1.00 0.00 H ATOM 73351 H2 WAT 5918 115.650 25.803 66.981 1.00 0.00 H TER 73353 WAT 5918 ATOM 73353 O WAT 5919 126.314 28.183 157.033 1.00 0.00 O ATOM 73354 H1 WAT 5919 126.728 28.186 157.896 1.00 0.00 H ATOM 73355 H2 WAT 5919 125.409 28.447 157.201 1.00 0.00 H TER 73357 WAT 5919 ATOM 73357 O WAT 5920 70.114 98.312 123.436 1.00 0.00 O ATOM 73358 H1 WAT 5920 69.395 97.877 122.977 1.00 0.00 H ATOM 73359 H2 WAT 5920 69.794 99.200 123.595 1.00 0.00 H TER 73361 WAT 5920 ATOM 73361 O WAT 5921 103.598 46.511 115.916 1.00 0.00 O ATOM 73362 H1 WAT 5921 104.302 46.166 116.466 1.00 0.00 H ATOM 73363 H2 WAT 5921 103.904 46.371 115.020 1.00 0.00 H TER 73365 WAT 5921 ATOM 73365 O WAT 5922 141.768 53.618 138.566 1.00 0.00 O ATOM 73366 H1 WAT 5922 141.743 54.394 139.126 1.00 0.00 H ATOM 73367 H2 WAT 5922 142.510 53.110 138.895 1.00 0.00 H TER 73369 WAT 5922 ATOM 73369 O WAT 5923 126.525 57.832 143.830 1.00 0.00 O ATOM 73370 H1 WAT 5923 127.409 57.484 143.712 1.00 0.00 H ATOM 73371 H2 WAT 5923 125.981 57.308 143.242 1.00 0.00 H TER 73373 WAT 5923 ATOM 73373 O WAT 5924 41.621 131.221 97.444 1.00 0.00 O ATOM 73374 H1 WAT 5924 41.510 131.690 96.616 1.00 0.00 H ATOM 73375 H2 WAT 5924 41.311 130.334 97.260 1.00 0.00 H TER 73377 WAT 5924 ATOM 73377 O WAT 5925 80.575 90.009 103.540 1.00 0.00 O ATOM 73378 H1 WAT 5925 81.222 89.309 103.456 1.00 0.00 H ATOM 73379 H2 WAT 5925 81.092 90.788 103.749 1.00 0.00 H TER 73381 WAT 5925 ATOM 73381 O WAT 5926 69.002 14.326 126.050 1.00 0.00 O ATOM 73382 H1 WAT 5926 69.175 13.696 125.351 1.00 0.00 H ATOM 73383 H2 WAT 5926 69.207 15.177 125.661 1.00 0.00 H TER 73385 WAT 5926 ATOM 73385 O WAT 5927 130.354 110.769 5.530 1.00 0.00 O ATOM 73386 H1 WAT 5927 130.610 111.684 5.411 1.00 0.00 H ATOM 73387 H2 WAT 5927 130.727 110.316 4.775 1.00 0.00 H TER 73389 WAT 5927 ATOM 73389 O WAT 5928 78.501 71.165 106.240 1.00 0.00 O ATOM 73390 H1 WAT 5928 78.274 71.751 106.962 1.00 0.00 H ATOM 73391 H2 WAT 5928 78.271 70.292 106.557 1.00 0.00 H TER 73393 WAT 5928 ATOM 73393 O WAT 5929 131.684 68.414 68.077 1.00 0.00 O ATOM 73394 H1 WAT 5929 130.942 68.557 67.489 1.00 0.00 H ATOM 73395 H2 WAT 5929 132.231 67.775 67.621 1.00 0.00 H TER 73397 WAT 5929 ATOM 73397 O WAT 5930 82.494 23.850 127.927 1.00 0.00 O ATOM 73398 H1 WAT 5930 82.851 22.964 127.867 1.00 0.00 H ATOM 73399 H2 WAT 5930 83.016 24.273 128.610 1.00 0.00 H TER 73401 WAT 5930 ATOM 73401 O WAT 5931 7.674 98.493 73.713 1.00 0.00 O ATOM 73402 H1 WAT 5931 7.337 98.554 72.820 1.00 0.00 H ATOM 73403 H2 WAT 5931 8.158 99.309 73.843 1.00 0.00 H TER 73405 WAT 5931 ATOM 73405 O WAT 5932 41.995 127.623 131.189 1.00 0.00 O ATOM 73406 H1 WAT 5932 42.693 128.172 131.548 1.00 0.00 H ATOM 73407 H2 WAT 5932 41.249 127.773 131.770 1.00 0.00 H TER 73409 WAT 5932 ATOM 73409 O WAT 5933 24.531 102.751 98.227 1.00 0.00 O ATOM 73410 H1 WAT 5933 24.314 103.361 98.932 1.00 0.00 H ATOM 73411 H2 WAT 5933 25.431 102.973 97.988 1.00 0.00 H TER 73413 WAT 5933 ATOM 73413 O WAT 5934 84.693 34.324 146.144 1.00 0.00 O ATOM 73414 H1 WAT 5934 84.058 34.377 145.430 1.00 0.00 H ATOM 73415 H2 WAT 5934 85.189 35.140 146.085 1.00 0.00 H TER 73417 WAT 5934 ATOM 73417 O WAT 5935 140.903 27.078 85.658 1.00 0.00 O ATOM 73418 H1 WAT 5935 141.623 27.585 85.285 1.00 0.00 H ATOM 73419 H2 WAT 5935 141.332 26.366 86.134 1.00 0.00 H TER 73421 WAT 5935 ATOM 73421 O WAT 5936 25.156 9.033 86.619 1.00 0.00 O ATOM 73422 H1 WAT 5936 25.378 8.646 85.773 1.00 0.00 H ATOM 73423 H2 WAT 5936 25.568 9.897 86.603 1.00 0.00 H TER 73425 WAT 5936 ATOM 73425 O WAT 5937 18.813 3.361 55.253 1.00 0.00 O ATOM 73426 H1 WAT 5937 18.560 3.766 56.083 1.00 0.00 H ATOM 73427 H2 WAT 5937 19.211 2.527 55.505 1.00 0.00 H TER 73429 WAT 5937 ATOM 73429 O WAT 5938 33.133 4.868 8.920 1.00 0.00 O ATOM 73430 H1 WAT 5938 32.916 4.350 9.696 1.00 0.00 H ATOM 73431 H2 WAT 5938 33.852 4.391 8.507 1.00 0.00 H TER 73433 WAT 5938 ATOM 73433 O WAT 5939 114.015 21.967 71.516 1.00 0.00 O ATOM 73434 H1 WAT 5939 114.542 22.199 70.752 1.00 0.00 H ATOM 73435 H2 WAT 5939 113.350 22.653 71.566 1.00 0.00 H TER 73437 WAT 5939 ATOM 73437 O WAT 5940 5.939 139.547 71.279 1.00 0.00 O ATOM 73438 H1 WAT 5940 6.492 139.336 72.032 1.00 0.00 H ATOM 73439 H2 WAT 5940 5.126 139.875 71.663 1.00 0.00 H TER 73441 WAT 5940 ATOM 73441 O WAT 5941 137.189 29.007 7.077 1.00 0.00 O ATOM 73442 H1 WAT 5941 137.814 28.567 7.654 1.00 0.00 H ATOM 73443 H2 WAT 5941 137.431 29.932 7.124 1.00 0.00 H TER 73445 WAT 5941 ATOM 73445 O WAT 5942 125.156 85.392 86.996 1.00 0.00 O ATOM 73446 H1 WAT 5942 125.704 85.044 86.292 1.00 0.00 H ATOM 73447 H2 WAT 5942 124.262 85.325 86.660 1.00 0.00 H TER 73449 WAT 5942 ATOM 73449 O WAT 5943 6.892 103.709 7.310 1.00 0.00 O ATOM 73450 H1 WAT 5943 7.697 103.206 7.433 1.00 0.00 H ATOM 73451 H2 WAT 5943 7.186 104.551 6.964 1.00 0.00 H TER 73453 WAT 5943 ATOM 73453 O WAT 5944 9.731 127.064 97.201 1.00 0.00 O ATOM 73454 H1 WAT 5944 8.974 126.586 97.538 1.00 0.00 H ATOM 73455 H2 WAT 5944 10.102 126.485 96.534 1.00 0.00 H TER 73457 WAT 5944 ATOM 73457 O WAT 5945 14.164 35.773 154.065 1.00 0.00 O ATOM 73458 H1 WAT 5945 14.720 35.916 153.299 1.00 0.00 H ATOM 73459 H2 WAT 5945 13.624 36.561 154.120 1.00 0.00 H TER 73461 WAT 5945 ATOM 73461 O WAT 5946 67.166 120.749 5.279 1.00 0.00 O ATOM 73462 H1 WAT 5946 67.169 120.283 6.115 1.00 0.00 H ATOM 73463 H2 WAT 5946 66.241 120.807 5.040 1.00 0.00 H TER 73465 WAT 5946 ATOM 73465 O WAT 5947 143.309 47.641 156.317 1.00 0.00 O ATOM 73466 H1 WAT 5947 143.273 46.883 156.901 1.00 0.00 H ATOM 73467 H2 WAT 5947 144.091 48.118 156.592 1.00 0.00 H TER 73469 WAT 5947 ATOM 73469 O WAT 5948 45.392 88.324 154.058 1.00 0.00 O ATOM 73470 H1 WAT 5948 44.602 88.383 154.596 1.00 0.00 H ATOM 73471 H2 WAT 5948 45.653 87.405 154.118 1.00 0.00 H TER 73473 WAT 5948 ATOM 73473 O WAT 5949 113.398 51.533 88.174 1.00 0.00 O ATOM 73474 H1 WAT 5949 113.984 52.285 88.086 1.00 0.00 H ATOM 73475 H2 WAT 5949 112.654 51.867 88.676 1.00 0.00 H TER 73477 WAT 5949 ATOM 73477 O WAT 5950 59.108 128.458 106.459 1.00 0.00 O ATOM 73478 H1 WAT 5950 59.963 128.814 106.700 1.00 0.00 H ATOM 73479 H2 WAT 5950 58.916 128.853 105.609 1.00 0.00 H TER 73481 WAT 5950 ATOM 73481 O WAT 5951 89.272 29.291 158.787 1.00 0.00 O ATOM 73482 H1 WAT 5951 88.324 29.213 158.677 1.00 0.00 H ATOM 73483 H2 WAT 5951 89.500 30.102 158.332 1.00 0.00 H TER 73485 WAT 5951 ATOM 73485 O WAT 5952 58.870 117.878 153.683 1.00 0.00 O ATOM 73486 H1 WAT 5952 58.684 118.110 152.774 1.00 0.00 H ATOM 73487 H2 WAT 5952 58.528 118.612 154.193 1.00 0.00 H TER 73489 WAT 5952 ATOM 73489 O WAT 5953 9.815 3.375 91.730 1.00 0.00 O ATOM 73490 H1 WAT 5953 10.496 2.731 91.926 1.00 0.00 H ATOM 73491 H2 WAT 5953 9.240 3.356 92.495 1.00 0.00 H TER 73493 WAT 5953 ATOM 73493 O WAT 5954 91.251 60.478 82.356 1.00 0.00 O ATOM 73494 H1 WAT 5954 91.761 61.281 82.465 1.00 0.00 H ATOM 73495 H2 WAT 5954 91.524 60.135 81.506 1.00 0.00 H TER 73497 WAT 5954 ATOM 73497 O WAT 5955 118.003 56.879 115.039 1.00 0.00 O ATOM 73498 H1 WAT 5955 117.581 56.140 115.478 1.00 0.00 H ATOM 73499 H2 WAT 5955 118.935 56.767 115.226 1.00 0.00 H TER 73501 WAT 5955 ATOM 73501 O WAT 5956 32.061 52.556 78.520 1.00 0.00 O ATOM 73502 H1 WAT 5956 32.026 53.399 78.971 1.00 0.00 H ATOM 73503 H2 WAT 5956 31.223 52.494 78.062 1.00 0.00 H TER 73505 WAT 5956 ATOM 73505 O WAT 5957 11.142 46.163 120.065 1.00 0.00 O ATOM 73506 H1 WAT 5957 10.506 46.686 119.577 1.00 0.00 H ATOM 73507 H2 WAT 5957 11.830 45.967 119.429 1.00 0.00 H TER 73509 WAT 5957 ATOM 73509 O WAT 5958 98.036 95.006 142.295 1.00 0.00 O ATOM 73510 H1 WAT 5958 97.158 94.964 141.914 1.00 0.00 H ATOM 73511 H2 WAT 5958 98.525 95.580 141.705 1.00 0.00 H TER 73513 WAT 5958 ATOM 73513 O WAT 5959 66.439 87.013 125.242 1.00 0.00 O ATOM 73514 H1 WAT 5959 66.765 87.404 124.431 1.00 0.00 H ATOM 73515 H2 WAT 5959 65.864 87.681 125.615 1.00 0.00 H TER 73517 WAT 5959 ATOM 73517 O WAT 5960 113.986 88.946 96.491 1.00 0.00 O ATOM 73518 H1 WAT 5960 113.370 89.603 96.814 1.00 0.00 H ATOM 73519 H2 WAT 5960 114.045 88.304 97.198 1.00 0.00 H TER 73521 WAT 5960 ATOM 73521 O WAT 5961 103.137 111.159 155.810 1.00 0.00 O ATOM 73522 H1 WAT 5961 102.401 111.706 155.536 1.00 0.00 H ATOM 73523 H2 WAT 5961 103.073 110.378 155.260 1.00 0.00 H TER 73525 WAT 5961 ATOM 73525 O WAT 5962 73.142 90.395 126.021 1.00 0.00 O ATOM 73526 H1 WAT 5962 73.692 91.123 126.309 1.00 0.00 H ATOM 73527 H2 WAT 5962 73.761 89.696 125.812 1.00 0.00 H TER 73529 WAT 5962 ATOM 73529 O WAT 5963 20.517 26.468 62.522 1.00 0.00 O ATOM 73530 H1 WAT 5963 19.625 26.176 62.333 1.00 0.00 H ATOM 73531 H2 WAT 5963 20.579 27.330 62.110 1.00 0.00 H TER 73533 WAT 5963 ATOM 73533 O WAT 5964 26.091 46.890 61.659 1.00 0.00 O ATOM 73534 H1 WAT 5964 26.799 47.077 61.042 1.00 0.00 H ATOM 73535 H2 WAT 5964 26.426 47.188 62.504 1.00 0.00 H TER 73537 WAT 5964 ATOM 73537 O WAT 5965 135.283 11.340 77.368 1.00 0.00 O ATOM 73538 H1 WAT 5965 134.555 10.955 76.880 1.00 0.00 H ATOM 73539 H2 WAT 5965 134.929 11.496 78.243 1.00 0.00 H TER 73541 WAT 5965 ATOM 73541 O WAT 5966 30.098 68.372 140.528 1.00 0.00 O ATOM 73542 H1 WAT 5966 29.629 68.862 141.203 1.00 0.00 H ATOM 73543 H2 WAT 5966 29.449 68.234 139.838 1.00 0.00 H TER 73545 WAT 5966 ATOM 73545 O WAT 5967 114.003 38.499 158.311 1.00 0.00 O ATOM 73546 H1 WAT 5967 114.323 37.835 157.701 1.00 0.00 H ATOM 73547 H2 WAT 5967 113.240 38.096 158.725 1.00 0.00 H TER 73549 WAT 5967 ATOM 73549 O WAT 5968 64.669 35.242 82.141 1.00 0.00 O ATOM 73550 H1 WAT 5968 63.805 35.627 81.996 1.00 0.00 H ATOM 73551 H2 WAT 5968 65.142 35.900 82.649 1.00 0.00 H TER 73553 WAT 5968 ATOM 73553 O WAT 5969 40.295 44.772 151.009 1.00 0.00 O ATOM 73554 H1 WAT 5969 40.918 44.101 150.727 1.00 0.00 H ATOM 73555 H2 WAT 5969 40.841 45.523 151.241 1.00 0.00 H TER 73557 WAT 5969 ATOM 73557 O WAT 5970 129.281 79.111 110.899 1.00 0.00 O ATOM 73558 H1 WAT 5970 130.027 79.711 110.891 1.00 0.00 H ATOM 73559 H2 WAT 5970 128.934 79.172 111.789 1.00 0.00 H TER 73561 WAT 5970 ATOM 73561 O WAT 5971 9.276 58.456 70.577 1.00 0.00 O ATOM 73562 H1 WAT 5971 8.608 58.438 71.262 1.00 0.00 H ATOM 73563 H2 WAT 5971 8.977 59.133 69.970 1.00 0.00 H TER 73565 WAT 5971 ATOM 73565 O WAT 5972 19.956 63.844 120.234 1.00 0.00 O ATOM 73566 H1 WAT 5972 20.767 63.421 119.951 1.00 0.00 H ATOM 73567 H2 WAT 5972 20.028 63.886 121.187 1.00 0.00 H TER 73569 WAT 5972 ATOM 73569 O WAT 5973 19.207 89.816 150.979 1.00 0.00 O ATOM 73570 H1 WAT 5973 19.344 90.393 150.228 1.00 0.00 H ATOM 73571 H2 WAT 5973 20.085 89.516 151.214 1.00 0.00 H TER 73573 WAT 5973 ATOM 73573 O WAT 5974 142.559 62.202 5.248 1.00 0.00 O ATOM 73574 H1 WAT 5974 142.580 61.693 6.059 1.00 0.00 H ATOM 73575 H2 WAT 5974 141.674 62.565 5.217 1.00 0.00 H TER 73577 WAT 5974 ATOM 73577 O WAT 5975 68.461 74.865 150.150 1.00 0.00 O ATOM 73578 H1 WAT 5975 68.425 75.549 149.481 1.00 0.00 H ATOM 73579 H2 WAT 5975 69.387 74.806 150.383 1.00 0.00 H TER 73581 WAT 5975 ATOM 73581 O WAT 5976 67.802 60.189 64.628 1.00 0.00 O ATOM 73582 H1 WAT 5976 68.698 60.491 64.776 1.00 0.00 H ATOM 73583 H2 WAT 5976 67.902 59.305 64.273 1.00 0.00 H TER 73585 WAT 5976 ATOM 73585 O WAT 5977 16.111 117.293 3.687 1.00 0.00 O ATOM 73586 H1 WAT 5977 17.047 117.156 3.831 1.00 0.00 H ATOM 73587 H2 WAT 5977 16.062 117.756 2.851 1.00 0.00 H TER 73589 WAT 5977 ATOM 73589 O WAT 5978 33.194 85.847 119.045 1.00 0.00 O ATOM 73590 H1 WAT 5978 33.481 85.433 119.859 1.00 0.00 H ATOM 73591 H2 WAT 5978 33.532 85.277 118.354 1.00 0.00 H TER 73593 WAT 5978 ATOM 73593 O WAT 5979 140.818 57.779 66.348 1.00 0.00 O ATOM 73594 H1 WAT 5979 141.133 57.894 65.452 1.00 0.00 H ATOM 73595 H2 WAT 5979 140.857 56.834 66.496 1.00 0.00 H TER 73597 WAT 5979 ATOM 73597 O WAT 5980 108.533 47.443 64.528 1.00 0.00 O ATOM 73598 H1 WAT 5980 109.488 47.397 64.573 1.00 0.00 H ATOM 73599 H2 WAT 5980 108.236 46.592 64.851 1.00 0.00 H TER 73601 WAT 5980 ATOM 73601 O WAT 5981 10.202 23.623 0.812 1.00 0.00 O ATOM 73602 H1 WAT 5981 9.471 23.575 1.427 1.00 0.00 H ATOM 73603 H2 WAT 5981 10.311 22.725 0.498 1.00 0.00 H TER 73605 WAT 5981 ATOM 73605 O WAT 5982 110.637 35.593 92.073 1.00 0.00 O ATOM 73606 H1 WAT 5982 109.765 35.987 92.041 1.00 0.00 H ATOM 73607 H2 WAT 5982 110.472 34.650 92.103 1.00 0.00 H TER 73609 WAT 5982 ATOM 73609 O WAT 5983 123.219 120.714 142.696 1.00 0.00 O ATOM 73610 H1 WAT 5983 122.954 120.722 143.616 1.00 0.00 H ATOM 73611 H2 WAT 5983 122.524 121.191 142.243 1.00 0.00 H TER 73613 WAT 5983 ATOM 73613 O WAT 5984 72.422 66.399 157.868 1.00 0.00 O ATOM 73614 H1 WAT 5984 72.275 65.751 158.558 1.00 0.00 H ATOM 73615 H2 WAT 5984 71.623 66.927 157.862 1.00 0.00 H TER 73617 WAT 5984 ATOM 73617 O WAT 5985 132.365 14.109 142.214 1.00 0.00 O ATOM 73618 H1 WAT 5985 131.654 13.659 141.757 1.00 0.00 H ATOM 73619 H2 WAT 5985 133.152 13.621 141.974 1.00 0.00 H TER 73621 WAT 5985 ATOM 73621 O WAT 5986 10.038 79.724 113.207 1.00 0.00 O ATOM 73622 H1 WAT 5986 10.657 79.330 112.593 1.00 0.00 H ATOM 73623 H2 WAT 5986 9.567 78.980 113.582 1.00 0.00 H TER 73625 WAT 5986 ATOM 73625 O WAT 5987 76.058 88.427 74.066 1.00 0.00 O ATOM 73626 H1 WAT 5987 75.862 87.718 73.453 1.00 0.00 H ATOM 73627 H2 WAT 5987 76.847 88.137 74.522 1.00 0.00 H TER 73629 WAT 5987 ATOM 73629 O WAT 5988 8.959 47.203 84.252 1.00 0.00 O ATOM 73630 H1 WAT 5988 8.592 47.064 85.125 1.00 0.00 H ATOM 73631 H2 WAT 5988 9.421 46.388 84.054 1.00 0.00 H TER 73633 WAT 5988 ATOM 73633 O WAT 5989 34.941 37.444 74.078 1.00 0.00 O ATOM 73634 H1 WAT 5989 35.241 37.694 73.204 1.00 0.00 H ATOM 73635 H2 WAT 5989 35.735 37.162 74.532 1.00 0.00 H TER 73637 WAT 5989 ATOM 73637 O WAT 5990 28.332 47.659 69.518 1.00 0.00 O ATOM 73638 H1 WAT 5990 28.795 48.334 70.014 1.00 0.00 H ATOM 73639 H2 WAT 5990 27.880 48.139 68.824 1.00 0.00 H TER 73641 WAT 5990 ATOM 73641 O WAT 5991 78.363 130.036 104.582 1.00 0.00 O ATOM 73642 H1 WAT 5991 77.505 130.055 105.007 1.00 0.00 H ATOM 73643 H2 WAT 5991 78.224 129.524 103.785 1.00 0.00 H TER 73645 WAT 5991 ATOM 73645 O WAT 5992 51.840 43.181 154.143 1.00 0.00 O ATOM 73646 H1 WAT 5992 51.155 43.391 154.778 1.00 0.00 H ATOM 73647 H2 WAT 5992 51.750 42.239 153.997 1.00 0.00 H TER 73649 WAT 5992 ATOM 73649 O WAT 5993 17.366 23.978 82.903 1.00 0.00 O ATOM 73650 H1 WAT 5993 17.635 23.570 83.726 1.00 0.00 H ATOM 73651 H2 WAT 5993 16.457 23.701 82.785 1.00 0.00 H TER 73653 WAT 5993 ATOM 73653 O WAT 5994 112.831 87.381 16.882 1.00 0.00 O ATOM 73654 H1 WAT 5994 112.110 87.993 16.729 1.00 0.00 H ATOM 73655 H2 WAT 5994 113.341 87.784 17.585 1.00 0.00 H TER 73657 WAT 5994 ATOM 73657 O WAT 5995 46.807 0.213 149.483 1.00 0.00 O ATOM 73658 H1 WAT 5995 47.570 0.379 150.037 1.00 0.00 H ATOM 73659 H2 WAT 5995 46.501 1.084 149.230 1.00 0.00 H TER 73661 WAT 5995 ATOM 73661 O WAT 5996 59.571 59.473 2.840 1.00 0.00 O ATOM 73662 H1 WAT 5996 58.690 59.517 3.211 1.00 0.00 H ATOM 73663 H2 WAT 5996 60.148 59.719 3.563 1.00 0.00 H TER 73665 WAT 5996 ATOM 73665 O WAT 5997 55.550 109.503 2.905 1.00 0.00 O ATOM 73666 H1 WAT 5997 55.257 110.311 2.483 1.00 0.00 H ATOM 73667 H2 WAT 5997 55.226 109.571 3.803 1.00 0.00 H TER 73669 WAT 5997 ATOM 73669 O WAT 5998 92.951 50.827 92.062 1.00 0.00 O ATOM 73670 H1 WAT 5998 93.152 51.329 92.852 1.00 0.00 H ATOM 73671 H2 WAT 5998 92.761 49.945 92.380 1.00 0.00 H TER 73673 WAT 5998 ATOM 73673 O WAT 5999 9.091 115.245 0.710 1.00 0.00 O ATOM 73674 H1 WAT 5999 9.332 115.681 -0.108 1.00 0.00 H ATOM 73675 H2 WAT 5999 8.188 115.521 0.871 1.00 0.00 H TER 73677 WAT 5999 ATOM 73677 O WAT 6000 68.482 44.051 100.348 1.00 0.00 O ATOM 73678 H1 WAT 6000 68.508 43.187 100.758 1.00 0.00 H ATOM 73679 H2 WAT 6000 68.755 44.653 101.040 1.00 0.00 H TER 73681 WAT 6000 ATOM 73681 O WAT 6001 75.596 5.262 107.134 1.00 0.00 O ATOM 73682 H1 WAT 6001 75.672 4.666 107.879 1.00 0.00 H ATOM 73683 H2 WAT 6001 76.089 6.039 107.397 1.00 0.00 H TER 73685 WAT 6001 ATOM 73685 O WAT 6002 22.017 62.099 7.042 1.00 0.00 O ATOM 73686 H1 WAT 6002 22.720 61.629 6.593 1.00 0.00 H ATOM 73687 H2 WAT 6002 22.314 62.163 7.950 1.00 0.00 H TER 73689 WAT 6002 ATOM 73689 O WAT 6003 40.841 124.166 143.458 1.00 0.00 O ATOM 73690 H1 WAT 6003 41.772 124.387 143.478 1.00 0.00 H ATOM 73691 H2 WAT 6003 40.661 123.807 144.326 1.00 0.00 H TER 73693 WAT 6003 ATOM 73693 O WAT 6004 101.046 106.785 15.044 1.00 0.00 O ATOM 73694 H1 WAT 6004 101.609 106.659 15.809 1.00 0.00 H ATOM 73695 H2 WAT 6004 100.943 105.907 14.677 1.00 0.00 H TER 73697 WAT 6004 ATOM 73697 O WAT 6005 44.793 45.206 99.969 1.00 0.00 O ATOM 73698 H1 WAT 6005 45.747 45.144 100.018 1.00 0.00 H ATOM 73699 H2 WAT 6005 44.483 44.770 100.763 1.00 0.00 H TER 73701 WAT 6005 ATOM 73701 O WAT 6006 125.519 52.836 134.803 1.00 0.00 O ATOM 73702 H1 WAT 6006 124.739 53.334 134.560 1.00 0.00 H ATOM 73703 H2 WAT 6006 125.937 52.622 133.969 1.00 0.00 H TER 73705 WAT 6006 ATOM 73705 O WAT 6007 67.237 50.976 150.199 1.00 0.00 O ATOM 73706 H1 WAT 6007 67.877 51.683 150.276 1.00 0.00 H ATOM 73707 H2 WAT 6007 66.710 51.212 149.436 1.00 0.00 H TER 73709 WAT 6007 ATOM 73709 O WAT 6008 23.369 128.887 73.309 1.00 0.00 O ATOM 73710 H1 WAT 6008 22.797 128.149 73.099 1.00 0.00 H ATOM 73711 H2 WAT 6008 22.770 129.613 73.481 1.00 0.00 H TER 73713 WAT 6008 ATOM 73713 O WAT 6009 61.346 23.255 106.078 1.00 0.00 O ATOM 73714 H1 WAT 6009 60.909 23.469 106.902 1.00 0.00 H ATOM 73715 H2 WAT 6009 60.715 22.711 105.607 1.00 0.00 H TER 73717 WAT 6009 ATOM 73717 O WAT 6010 66.436 10.120 90.023 1.00 0.00 O ATOM 73718 H1 WAT 6010 66.948 10.839 90.392 1.00 0.00 H ATOM 73719 H2 WAT 6010 66.984 9.345 90.151 1.00 0.00 H TER 73721 WAT 6010 ATOM 73721 O WAT 6011 23.070 17.572 8.595 1.00 0.00 O ATOM 73722 H1 WAT 6011 22.264 17.057 8.628 1.00 0.00 H ATOM 73723 H2 WAT 6011 23.349 17.520 7.681 1.00 0.00 H TER 73725 WAT 6011 ATOM 73725 O WAT 6012 27.053 107.300 11.751 1.00 0.00 O ATOM 73726 H1 WAT 6012 27.845 107.354 11.216 1.00 0.00 H ATOM 73727 H2 WAT 6012 26.379 107.730 11.225 1.00 0.00 H TER 73729 WAT 6012 ATOM 73729 O WAT 6013 124.615 44.352 158.369 1.00 0.00 O ATOM 73730 H1 WAT 6013 124.833 43.990 159.228 1.00 0.00 H ATOM 73731 H2 WAT 6013 124.683 45.300 158.485 1.00 0.00 H TER 73733 WAT 6013 ATOM 73733 O WAT 6014 20.393 127.450 113.887 1.00 0.00 O ATOM 73734 H1 WAT 6014 20.507 126.610 113.443 1.00 0.00 H ATOM 73735 H2 WAT 6014 20.794 127.324 114.747 1.00 0.00 H TER 73737 WAT 6014 ATOM 73737 O WAT 6015 0.443 20.242 133.577 1.00 0.00 O ATOM 73738 H1 WAT 6015 1.126 19.574 133.639 1.00 0.00 H ATOM 73739 H2 WAT 6015 0.008 20.221 134.429 1.00 0.00 H TER 73741 WAT 6015 ATOM 73741 O WAT 6016 101.042 8.982 146.707 1.00 0.00 O ATOM 73742 H1 WAT 6016 101.908 9.270 146.996 1.00 0.00 H ATOM 73743 H2 WAT 6016 100.971 9.303 145.808 1.00 0.00 H TER 73745 WAT 6016 ATOM 73745 O WAT 6017 62.629 28.318 139.030 1.00 0.00 O ATOM 73746 H1 WAT 6017 61.728 28.604 138.881 1.00 0.00 H ATOM 73747 H2 WAT 6017 63.043 28.372 138.169 1.00 0.00 H TER 73749 WAT 6017 ATOM 73749 O WAT 6018 17.336 91.773 2.752 1.00 0.00 O ATOM 73750 H1 WAT 6018 16.534 91.351 2.444 1.00 0.00 H ATOM 73751 H2 WAT 6018 17.952 91.051 2.879 1.00 0.00 H TER 73753 WAT 6018 ATOM 73753 O WAT 6019 44.348 44.499 117.921 1.00 0.00 O ATOM 73754 H1 WAT 6019 45.107 44.965 117.569 1.00 0.00 H ATOM 73755 H2 WAT 6019 43.699 45.184 118.078 1.00 0.00 H TER 73757 WAT 6019 ATOM 73757 O WAT 6020 62.983 3.529 120.629 1.00 0.00 O ATOM 73758 H1 WAT 6020 62.380 2.829 120.379 1.00 0.00 H ATOM 73759 H2 WAT 6020 63.026 3.479 121.584 1.00 0.00 H TER 73761 WAT 6020 ATOM 73761 O WAT 6021 98.657 109.967 119.047 1.00 0.00 O ATOM 73762 H1 WAT 6021 98.199 109.688 118.255 1.00 0.00 H ATOM 73763 H2 WAT 6021 98.042 109.784 119.757 1.00 0.00 H TER 73765 WAT 6021 ATOM 73765 O WAT 6022 140.619 95.977 98.948 1.00 0.00 O ATOM 73766 H1 WAT 6022 141.111 96.797 98.914 1.00 0.00 H ATOM 73767 H2 WAT 6022 140.948 95.469 98.207 1.00 0.00 H TER 73769 WAT 6022 ATOM 73769 O WAT 6023 131.914 80.057 68.148 1.00 0.00 O ATOM 73770 H1 WAT 6023 131.328 80.353 67.451 1.00 0.00 H ATOM 73771 H2 WAT 6023 132.150 79.163 67.898 1.00 0.00 H TER 73773 WAT 6023 ATOM 73773 O WAT 6024 14.547 129.278 116.852 1.00 0.00 O ATOM 73774 H1 WAT 6024 14.464 129.974 117.504 1.00 0.00 H ATOM 73775 H2 WAT 6024 14.429 128.469 117.349 1.00 0.00 H TER 73777 WAT 6024 ATOM 73777 O WAT 6025 140.729 141.114 68.390 1.00 0.00 O ATOM 73778 H1 WAT 6025 141.289 141.662 68.939 1.00 0.00 H ATOM 73779 H2 WAT 6025 140.207 141.736 67.884 1.00 0.00 H TER 73781 WAT 6025 ATOM 73781 O WAT 6026 123.236 10.158 151.210 1.00 0.00 O ATOM 73782 H1 WAT 6026 122.608 9.727 150.630 1.00 0.00 H ATOM 73783 H2 WAT 6026 123.665 9.440 151.675 1.00 0.00 H TER 73785 WAT 6026 ATOM 73785 O WAT 6027 62.810 71.389 72.529 1.00 0.00 O ATOM 73786 H1 WAT 6027 62.876 71.777 73.401 1.00 0.00 H ATOM 73787 H2 WAT 6027 62.186 70.670 72.633 1.00 0.00 H TER 73789 WAT 6027 ATOM 73789 O WAT 6028 53.924 46.561 141.646 1.00 0.00 O ATOM 73790 H1 WAT 6028 53.066 46.527 141.223 1.00 0.00 H ATOM 73791 H2 WAT 6028 53.754 46.304 142.552 1.00 0.00 H TER 73793 WAT 6028 ATOM 73793 O WAT 6029 107.076 136.201 73.202 1.00 0.00 O ATOM 73794 H1 WAT 6029 106.728 136.153 74.092 1.00 0.00 H ATOM 73795 H2 WAT 6029 107.136 137.139 73.018 1.00 0.00 H TER 73797 WAT 6029 ATOM 73797 O WAT 6030 65.212 19.744 116.798 1.00 0.00 O ATOM 73798 H1 WAT 6030 65.090 19.238 117.602 1.00 0.00 H ATOM 73799 H2 WAT 6030 65.015 19.126 116.094 1.00 0.00 H TER 73801 WAT 6030 ATOM 73801 O WAT 6031 41.953 60.186 141.599 1.00 0.00 O ATOM 73802 H1 WAT 6031 42.027 61.102 141.868 1.00 0.00 H ATOM 73803 H2 WAT 6031 42.858 59.875 141.555 1.00 0.00 H TER 73805 WAT 6031 ATOM 73805 O WAT 6032 59.765 17.971 139.507 1.00 0.00 O ATOM 73806 H1 WAT 6032 59.887 18.338 140.383 1.00 0.00 H ATOM 73807 H2 WAT 6032 60.504 18.309 139.001 1.00 0.00 H TER 73809 WAT 6032 ATOM 73809 O WAT 6033 121.586 40.679 3.180 1.00 0.00 O ATOM 73810 H1 WAT 6033 122.197 41.076 3.802 1.00 0.00 H ATOM 73811 H2 WAT 6033 121.653 41.226 2.397 1.00 0.00 H TER 73813 WAT 6033 ATOM 73813 O WAT 6034 41.003 77.342 134.446 1.00 0.00 O ATOM 73814 H1 WAT 6034 41.418 78.203 134.393 1.00 0.00 H ATOM 73815 H2 WAT 6034 41.151 77.060 135.348 1.00 0.00 H TER 73817 WAT 6034 ATOM 73817 O WAT 6035 28.874 126.611 149.412 1.00 0.00 O ATOM 73818 H1 WAT 6035 29.478 126.986 148.771 1.00 0.00 H ATOM 73819 H2 WAT 6035 29.437 126.323 150.131 1.00 0.00 H TER 73821 WAT 6035 ATOM 73821 O WAT 6036 121.036 14.337 143.660 1.00 0.00 O ATOM 73822 H1 WAT 6036 120.464 13.656 144.013 1.00 0.00 H ATOM 73823 H2 WAT 6036 120.807 15.123 144.156 1.00 0.00 H TER 73825 WAT 6036 ATOM 73825 O WAT 6037 82.632 98.776 88.711 1.00 0.00 O ATOM 73826 H1 WAT 6037 82.692 98.440 87.816 1.00 0.00 H ATOM 73827 H2 WAT 6037 82.745 99.722 88.619 1.00 0.00 H TER 73829 WAT 6037 ATOM 73829 O WAT 6038 74.297 129.995 96.357 1.00 0.00 O ATOM 73830 H1 WAT 6038 74.087 129.620 95.501 1.00 0.00 H ATOM 73831 H2 WAT 6038 74.684 129.270 96.848 1.00 0.00 H TER 73833 WAT 6038 ATOM 73833 O WAT 6039 49.450 98.294 157.699 1.00 0.00 O ATOM 73834 H1 WAT 6039 50.049 97.659 157.305 1.00 0.00 H ATOM 73835 H2 WAT 6039 49.214 97.909 158.543 1.00 0.00 H TER 73837 WAT 6039 ATOM 73837 O WAT 6040 58.009 131.133 81.881 1.00 0.00 O ATOM 73838 H1 WAT 6040 58.223 131.050 82.810 1.00 0.00 H ATOM 73839 H2 WAT 6040 58.432 131.948 81.609 1.00 0.00 H TER 73841 WAT 6040 ATOM 73841 O WAT 6041 102.767 7.706 139.173 1.00 0.00 O ATOM 73842 H1 WAT 6041 103.435 8.287 139.538 1.00 0.00 H ATOM 73843 H2 WAT 6041 102.900 6.874 139.626 1.00 0.00 H TER 73845 WAT 6041 ATOM 73845 O WAT 6042 144.865 8.122 156.351 1.00 0.00 O ATOM 73846 H1 WAT 6042 144.786 7.451 157.029 1.00 0.00 H ATOM 73847 H2 WAT 6042 144.034 8.597 156.385 1.00 0.00 H TER 73849 WAT 6042 ATOM 73849 O WAT 6043 114.276 16.381 95.701 1.00 0.00 O ATOM 73850 H1 WAT 6043 115.228 16.450 95.635 1.00 0.00 H ATOM 73851 H2 WAT 6043 114.088 15.464 95.502 1.00 0.00 H TER 73853 WAT 6043 ATOM 73853 O WAT 6044 16.142 93.480 94.967 1.00 0.00 O ATOM 73854 H1 WAT 6044 15.278 93.289 94.603 1.00 0.00 H ATOM 73855 H2 WAT 6044 16.201 94.435 94.958 1.00 0.00 H TER 73857 WAT 6044 ATOM 73857 O WAT 6045 39.288 122.690 155.578 1.00 0.00 O ATOM 73858 H1 WAT 6045 39.453 123.135 154.746 1.00 0.00 H ATOM 73859 H2 WAT 6045 39.522 123.335 156.245 1.00 0.00 H TER 73861 WAT 6045 ATOM 73861 O WAT 6046 76.432 80.155 11.801 1.00 0.00 O ATOM 73862 H1 WAT 6046 75.968 80.981 11.940 1.00 0.00 H ATOM 73863 H2 WAT 6046 76.043 79.793 11.005 1.00 0.00 H TER 73865 WAT 6046 ATOM 73865 O WAT 6047 0.146 12.231 77.564 1.00 0.00 O ATOM 73866 H1 WAT 6047 0.967 12.718 77.642 1.00 0.00 H ATOM 73867 H2 WAT 6047 -0.489 12.880 77.262 1.00 0.00 H TER 73869 WAT 6047 ATOM 73869 O WAT 6048 42.861 75.209 110.276 1.00 0.00 O ATOM 73870 H1 WAT 6048 43.087 75.256 111.205 1.00 0.00 H ATOM 73871 H2 WAT 6048 42.079 74.658 110.247 1.00 0.00 H TER 73873 WAT 6048 ATOM 73873 O WAT 6049 27.313 25.746 17.353 1.00 0.00 O ATOM 73874 H1 WAT 6049 27.837 26.539 17.238 1.00 0.00 H ATOM 73875 H2 WAT 6049 26.521 26.046 17.800 1.00 0.00 H TER 73877 WAT 6049 ATOM 73877 O WAT 6050 16.759 141.810 28.203 1.00 0.00 O ATOM 73878 H1 WAT 6050 16.865 141.934 27.260 1.00 0.00 H ATOM 73879 H2 WAT 6050 17.247 141.009 28.395 1.00 0.00 H TER 73881 WAT 6050 ATOM 73881 O WAT 6051 113.057 70.257 130.162 1.00 0.00 O ATOM 73882 H1 WAT 6051 112.539 69.906 130.887 1.00 0.00 H ATOM 73883 H2 WAT 6051 113.741 69.603 130.017 1.00 0.00 H TER 73885 WAT 6051 ATOM 73885 O WAT 6052 132.387 95.564 85.173 1.00 0.00 O ATOM 73886 H1 WAT 6052 132.911 95.522 85.973 1.00 0.00 H ATOM 73887 H2 WAT 6052 133.018 95.437 84.465 1.00 0.00 H TER 73889 WAT 6052 ATOM 73889 O WAT 6053 87.625 20.947 110.296 1.00 0.00 O ATOM 73890 H1 WAT 6053 87.329 20.496 111.087 1.00 0.00 H ATOM 73891 H2 WAT 6053 88.566 21.063 110.425 1.00 0.00 H TER 73893 WAT 6053 ATOM 73893 O WAT 6054 72.927 33.176 9.598 1.00 0.00 O ATOM 73894 H1 WAT 6054 73.145 33.295 8.674 1.00 0.00 H ATOM 73895 H2 WAT 6054 72.408 33.948 9.823 1.00 0.00 H TER 73897 WAT 6054 ATOM 73897 O WAT 6055 127.798 53.188 68.075 1.00 0.00 O ATOM 73898 H1 WAT 6055 127.986 52.251 68.022 1.00 0.00 H ATOM 73899 H2 WAT 6055 128.568 53.563 68.502 1.00 0.00 H TER 73901 WAT 6055 ATOM 73901 O WAT 6056 40.348 11.636 3.894 1.00 0.00 O ATOM 73902 H1 WAT 6056 40.190 11.375 2.987 1.00 0.00 H ATOM 73903 H2 WAT 6056 40.850 10.912 4.269 1.00 0.00 H TER 73905 WAT 6056 ATOM 73905 O WAT 6057 59.318 104.878 126.593 1.00 0.00 O ATOM 73906 H1 WAT 6057 59.329 105.628 127.188 1.00 0.00 H ATOM 73907 H2 WAT 6057 58.469 104.464 126.746 1.00 0.00 H TER 73909 WAT 6057 ATOM 73909 O WAT 6058 65.199 9.641 109.965 1.00 0.00 O ATOM 73910 H1 WAT 6058 65.205 10.429 110.509 1.00 0.00 H ATOM 73911 H2 WAT 6058 65.902 9.098 110.321 1.00 0.00 H TER 73913 WAT 6058 ATOM 73913 O WAT 6059 32.019 124.806 128.978 1.00 0.00 O ATOM 73914 H1 WAT 6059 32.024 124.844 128.021 1.00 0.00 H ATOM 73915 H2 WAT 6059 32.557 125.549 129.250 1.00 0.00 H TER 73917 WAT 6059 ATOM 73917 O WAT 6060 104.708 50.419 67.919 1.00 0.00 O ATOM 73918 H1 WAT 6060 103.873 50.212 67.500 1.00 0.00 H ATOM 73919 H2 WAT 6060 105.240 50.797 67.220 1.00 0.00 H TER 73921 WAT 6060 ATOM 73921 O WAT 6061 119.837 104.504 108.181 1.00 0.00 O ATOM 73922 H1 WAT 6061 120.389 105.229 108.474 1.00 0.00 H ATOM 73923 H2 WAT 6061 119.235 104.352 108.909 1.00 0.00 H TER 73925 WAT 6061 ATOM 73925 O WAT 6062 138.493 122.208 9.006 1.00 0.00 O ATOM 73926 H1 WAT 6062 139.291 122.364 9.511 1.00 0.00 H ATOM 73927 H2 WAT 6062 138.188 123.082 8.763 1.00 0.00 H TER 73929 WAT 6062 ATOM 73929 O WAT 6063 60.799 81.467 17.384 1.00 0.00 O ATOM 73930 H1 WAT 6063 61.264 81.801 18.152 1.00 0.00 H ATOM 73931 H2 WAT 6063 61.417 81.581 16.662 1.00 0.00 H TER 73933 WAT 6063 ATOM 73933 O WAT 6064 16.951 50.782 5.313 1.00 0.00 O ATOM 73934 H1 WAT 6064 17.073 51.004 4.390 1.00 0.00 H ATOM 73935 H2 WAT 6064 17.684 50.202 5.519 1.00 0.00 H TER 73937 WAT 6064 ATOM 73937 O WAT 6065 92.243 31.378 16.033 1.00 0.00 O ATOM 73938 H1 WAT 6065 92.871 31.984 15.641 1.00 0.00 H ATOM 73939 H2 WAT 6065 91.472 31.916 16.213 1.00 0.00 H TER 73941 WAT 6065 ATOM 73941 O WAT 6066 22.206 132.290 134.104 1.00 0.00 O ATOM 73942 H1 WAT 6066 22.432 132.220 135.032 1.00 0.00 H ATOM 73943 H2 WAT 6066 23.050 132.296 133.652 1.00 0.00 H TER 73945 WAT 6066 ATOM 73945 O WAT 6067 134.544 61.367 24.737 1.00 0.00 O ATOM 73946 H1 WAT 6067 133.937 61.605 25.438 1.00 0.00 H ATOM 73947 H2 WAT 6067 134.717 62.191 24.280 1.00 0.00 H TER 73949 WAT 6067 ATOM 73949 O WAT 6068 74.116 14.429 0.687 1.00 0.00 O ATOM 73950 H1 WAT 6068 74.987 14.374 0.293 1.00 0.00 H ATOM 73951 H2 WAT 6068 74.207 15.087 1.377 1.00 0.00 H TER 73953 WAT 6068 ATOM 73953 O WAT 6069 37.662 65.080 130.117 1.00 0.00 O ATOM 73954 H1 WAT 6069 38.551 65.207 129.787 1.00 0.00 H ATOM 73955 H2 WAT 6069 37.150 64.845 129.344 1.00 0.00 H TER 73957 WAT 6069 ATOM 73957 O WAT 6070 70.858 24.863 71.628 1.00 0.00 O ATOM 73958 H1 WAT 6070 70.470 25.406 72.314 1.00 0.00 H ATOM 73959 H2 WAT 6070 71.490 25.437 71.197 1.00 0.00 H TER 73961 WAT 6070 ATOM 73961 O WAT 6071 23.219 1.812 10.051 1.00 0.00 O ATOM 73962 H1 WAT 6071 23.095 1.616 10.980 1.00 0.00 H ATOM 73963 H2 WAT 6071 23.570 2.702 10.038 1.00 0.00 H TER 73965 WAT 6071 ATOM 73965 O WAT 6072 102.715 50.939 124.745 1.00 0.00 O ATOM 73966 H1 WAT 6072 102.465 51.516 125.467 1.00 0.00 H ATOM 73967 H2 WAT 6072 101.884 50.601 124.410 1.00 0.00 H TER 73969 WAT 6072 ATOM 73969 O WAT 6073 121.536 132.792 157.029 1.00 0.00 O ATOM 73970 H1 WAT 6073 121.545 133.490 157.684 1.00 0.00 H ATOM 73971 H2 WAT 6073 121.259 133.225 156.222 1.00 0.00 H TER 73973 WAT 6073 ATOM 73973 O WAT 6074 53.728 101.934 7.561 1.00 0.00 O ATOM 73974 H1 WAT 6074 52.966 101.568 8.010 1.00 0.00 H ATOM 73975 H2 WAT 6074 54.352 102.122 8.262 1.00 0.00 H TER 73977 WAT 6074 ATOM 73977 O WAT 6075 45.935 145.112 75.063 1.00 0.00 O ATOM 73978 H1 WAT 6075 46.187 145.429 74.196 1.00 0.00 H ATOM 73979 H2 WAT 6075 45.066 145.486 75.212 1.00 0.00 H TER 73981 WAT 6075 ATOM 73981 O WAT 6076 50.148 86.481 110.812 1.00 0.00 O ATOM 73982 H1 WAT 6076 50.934 87.014 110.929 1.00 0.00 H ATOM 73983 H2 WAT 6076 49.450 87.115 110.647 1.00 0.00 H TER 73985 WAT 6076 ATOM 73985 O WAT 6077 126.890 65.201 152.419 1.00 0.00 O ATOM 73986 H1 WAT 6077 127.205 65.349 151.527 1.00 0.00 H ATOM 73987 H2 WAT 6077 127.505 64.567 152.789 1.00 0.00 H TER 73989 WAT 6077 ATOM 73989 O WAT 6078 16.947 60.619 68.681 1.00 0.00 O ATOM 73990 H1 WAT 6078 16.430 60.948 67.946 1.00 0.00 H ATOM 73991 H2 WAT 6078 17.684 60.166 68.271 1.00 0.00 H TER 73993 WAT 6078 ATOM 73993 O WAT 6079 107.800 89.483 80.039 1.00 0.00 O ATOM 73994 H1 WAT 6079 107.970 89.974 80.843 1.00 0.00 H ATOM 73995 H2 WAT 6079 108.147 88.608 80.214 1.00 0.00 H TER 73997 WAT 6079 ATOM 73997 O WAT 6080 47.144 30.305 73.835 1.00 0.00 O ATOM 73998 H1 WAT 6080 46.608 30.089 73.072 1.00 0.00 H ATOM 73999 H2 WAT 6080 46.721 29.849 74.562 1.00 0.00 H TER 74001 WAT 6080 ATOM 74001 O WAT 6081 25.516 105.001 87.890 1.00 0.00 O ATOM 74002 H1 WAT 6081 25.354 104.244 87.327 1.00 0.00 H ATOM 74003 H2 WAT 6081 24.847 104.941 88.572 1.00 0.00 H TER 74005 WAT 6081 ATOM 74005 O WAT 6082 64.638 87.882 138.694 1.00 0.00 O ATOM 74006 H1 WAT 6082 64.780 87.208 138.029 1.00 0.00 H ATOM 74007 H2 WAT 6082 65.519 88.165 138.940 1.00 0.00 H TER 74009 WAT 6082 ATOM 74009 O WAT 6083 110.444 78.879 71.940 1.00 0.00 O ATOM 74010 H1 WAT 6083 110.441 79.625 72.541 1.00 0.00 H ATOM 74011 H2 WAT 6083 109.553 78.848 71.592 1.00 0.00 H TER 74013 WAT 6083 ATOM 74013 O WAT 6084 3.995 69.869 54.564 1.00 0.00 O ATOM 74014 H1 WAT 6084 3.858 69.080 54.041 1.00 0.00 H ATOM 74015 H2 WAT 6084 3.142 70.044 54.962 1.00 0.00 H TER 74017 WAT 6084 ATOM 74017 O WAT 6085 95.525 84.969 20.906 1.00 0.00 O ATOM 74018 H1 WAT 6085 95.827 84.987 21.815 1.00 0.00 H ATOM 74019 H2 WAT 6085 95.957 84.203 20.526 1.00 0.00 H TER 74021 WAT 6085 ATOM 74021 O WAT 6086 4.960 95.408 64.217 1.00 0.00 O ATOM 74022 H1 WAT 6086 5.416 94.592 64.009 1.00 0.00 H ATOM 74023 H2 WAT 6086 5.646 96.076 64.200 1.00 0.00 H TER 74025 WAT 6086 ATOM 74025 O WAT 6087 68.107 93.359 118.816 1.00 0.00 O ATOM 74026 H1 WAT 6087 69.036 93.195 118.660 1.00 0.00 H ATOM 74027 H2 WAT 6087 67.916 94.151 118.314 1.00 0.00 H TER 74029 WAT 6087 ATOM 74029 O WAT 6088 20.051 105.914 100.070 1.00 0.00 O ATOM 74030 H1 WAT 6088 19.289 105.403 100.345 1.00 0.00 H ATOM 74031 H2 WAT 6088 20.375 105.461 99.292 1.00 0.00 H TER 74033 WAT 6088 ATOM 74033 O WAT 6089 93.527 38.795 118.447 1.00 0.00 O ATOM 74034 H1 WAT 6089 94.261 38.201 118.293 1.00 0.00 H ATOM 74035 H2 WAT 6089 93.170 38.966 117.575 1.00 0.00 H TER 74037 WAT 6089 ATOM 74037 O WAT 6090 102.747 22.681 82.844 1.00 0.00 O ATOM 74038 H1 WAT 6090 102.191 22.446 83.587 1.00 0.00 H ATOM 74039 H2 WAT 6090 103.102 23.540 83.073 1.00 0.00 H TER 74041 WAT 6090 ATOM 74041 O WAT 6091 123.965 6.136 17.486 1.00 0.00 O ATOM 74042 H1 WAT 6091 123.825 6.895 18.052 1.00 0.00 H ATOM 74043 H2 WAT 6091 124.006 5.393 18.088 1.00 0.00 H TER 74045 WAT 6091 ATOM 74045 O WAT 6092 0.839 91.088 122.012 1.00 0.00 O ATOM 74046 H1 WAT 6092 0.790 90.248 121.556 1.00 0.00 H ATOM 74047 H2 WAT 6092 1.258 90.883 122.848 1.00 0.00 H TER 74049 WAT 6092 ATOM 74049 O WAT 6093 33.967 59.554 103.342 1.00 0.00 O ATOM 74050 H1 WAT 6093 33.478 59.498 102.521 1.00 0.00 H ATOM 74051 H2 WAT 6093 33.295 59.689 104.011 1.00 0.00 H TER 74053 WAT 6093 ATOM 74053 O WAT 6094 116.816 141.605 141.492 1.00 0.00 O ATOM 74054 H1 WAT 6094 117.678 142.020 141.509 1.00 0.00 H ATOM 74055 H2 WAT 6094 116.948 140.798 140.994 1.00 0.00 H TER 74057 WAT 6094 ATOM 74057 O WAT 6095 3.790 50.664 70.050 1.00 0.00 O ATOM 74058 H1 WAT 6095 2.879 50.891 69.860 1.00 0.00 H ATOM 74059 H2 WAT 6095 3.980 49.930 69.467 1.00 0.00 H TER 74061 WAT 6095 ATOM 74061 O WAT 6096 114.582 116.223 102.618 1.00 0.00 O ATOM 74062 H1 WAT 6096 115.395 115.765 102.832 1.00 0.00 H ATOM 74063 H2 WAT 6096 114.383 116.736 103.402 1.00 0.00 H TER 74065 WAT 6096 ATOM 74065 O WAT 6097 94.494 143.098 79.506 1.00 0.00 O ATOM 74066 H1 WAT 6097 94.066 142.674 78.762 1.00 0.00 H ATOM 74067 H2 WAT 6097 95.398 142.785 79.472 1.00 0.00 H TER 74069 WAT 6097 ATOM 74069 O WAT 6098 98.837 105.916 73.132 1.00 0.00 O ATOM 74070 H1 WAT 6098 99.083 105.723 74.036 1.00 0.00 H ATOM 74071 H2 WAT 6098 99.660 105.864 72.644 1.00 0.00 H TER 74073 WAT 6098 ATOM 74073 O WAT 6099 71.494 134.277 156.372 1.00 0.00 O ATOM 74074 H1 WAT 6099 71.293 133.955 155.493 1.00 0.00 H ATOM 74075 H2 WAT 6099 71.594 135.222 156.263 1.00 0.00 H TER 74077 WAT 6099 ATOM 74077 O WAT 6100 25.471 12.642 66.999 1.00 0.00 O ATOM 74078 H1 WAT 6100 25.899 12.297 66.216 1.00 0.00 H ATOM 74079 H2 WAT 6100 26.085 13.293 67.340 1.00 0.00 H TER 74081 WAT 6100 ATOM 74081 O WAT 6101 113.916 106.691 112.313 1.00 0.00 O ATOM 74082 H1 WAT 6101 113.940 106.762 113.267 1.00 0.00 H ATOM 74083 H2 WAT 6101 114.265 105.819 112.129 1.00 0.00 H TER 74085 WAT 6101 ATOM 74085 O WAT 6102 102.615 82.903 9.941 1.00 0.00 O ATOM 74086 H1 WAT 6102 103.151 82.164 9.655 1.00 0.00 H ATOM 74087 H2 WAT 6102 102.542 82.794 10.889 1.00 0.00 H TER 74089 WAT 6102 ATOM 74089 O WAT 6103 71.575 37.002 128.827 1.00 0.00 O ATOM 74090 H1 WAT 6103 71.535 36.881 129.775 1.00 0.00 H ATOM 74091 H2 WAT 6103 72.462 37.323 128.664 1.00 0.00 H TER 74093 WAT 6103 ATOM 74093 O WAT 6104 137.666 128.933 150.114 1.00 0.00 O ATOM 74094 H1 WAT 6104 137.963 129.674 149.586 1.00 0.00 H ATOM 74095 H2 WAT 6104 137.480 129.310 150.974 1.00 0.00 H TER 74097 WAT 6104 ATOM 74097 O WAT 6105 35.071 119.660 108.991 1.00 0.00 O ATOM 74098 H1 WAT 6105 35.692 118.931 108.973 1.00 0.00 H ATOM 74099 H2 WAT 6105 34.712 119.690 108.104 1.00 0.00 H TER 74101 WAT 6105 ATOM 74101 O WAT 6106 70.158 27.441 155.863 1.00 0.00 O ATOM 74102 H1 WAT 6106 69.743 26.699 155.424 1.00 0.00 H ATOM 74103 H2 WAT 6106 69.835 28.209 155.393 1.00 0.00 H TER 74105 WAT 6106 ATOM 74105 O WAT 6107 4.539 39.557 148.170 1.00 0.00 O ATOM 74106 H1 WAT 6107 4.233 38.682 147.930 1.00 0.00 H ATOM 74107 H2 WAT 6107 3.788 40.127 148.008 1.00 0.00 H TER 74109 WAT 6107 ATOM 74109 O WAT 6108 58.027 50.349 104.289 1.00 0.00 O ATOM 74110 H1 WAT 6108 57.518 49.580 104.547 1.00 0.00 H ATOM 74111 H2 WAT 6108 57.583 51.083 104.712 1.00 0.00 H TER 74113 WAT 6108 ATOM 74113 O WAT 6109 127.374 9.301 88.740 1.00 0.00 O ATOM 74114 H1 WAT 6109 127.180 8.720 89.476 1.00 0.00 H ATOM 74115 H2 WAT 6109 128.060 8.848 88.251 1.00 0.00 H TER 74117 WAT 6109 ATOM 74117 O WAT 6110 44.765 101.738 149.671 1.00 0.00 O ATOM 74118 H1 WAT 6110 44.788 102.604 150.079 1.00 0.00 H ATOM 74119 H2 WAT 6110 45.016 101.136 150.372 1.00 0.00 H TER 74121 WAT 6110 ATOM 74121 O WAT 6111 37.255 15.455 132.327 1.00 0.00 O ATOM 74122 H1 WAT 6111 36.635 15.751 132.994 1.00 0.00 H ATOM 74123 H2 WAT 6111 37.086 16.022 131.574 1.00 0.00 H TER 74125 WAT 6111 ATOM 74125 O WAT 6112 140.684 38.213 102.512 1.00 0.00 O ATOM 74126 H1 WAT 6112 141.473 38.749 102.588 1.00 0.00 H ATOM 74127 H2 WAT 6112 140.689 37.666 103.297 1.00 0.00 H TER 74129 WAT 6112 ATOM 74129 O WAT 6113 31.037 115.429 134.930 1.00 0.00 O ATOM 74130 H1 WAT 6113 31.626 114.991 135.544 1.00 0.00 H ATOM 74131 H2 WAT 6113 30.479 115.978 135.482 1.00 0.00 H TER 74133 WAT 6113 ATOM 74133 O WAT 6114 5.900 21.439 78.535 1.00 0.00 O ATOM 74134 H1 WAT 6114 6.330 22.183 78.113 1.00 0.00 H ATOM 74135 H2 WAT 6114 5.425 21.004 77.828 1.00 0.00 H TER 74137 WAT 6114 ATOM 74137 O WAT 6115 64.150 59.754 142.250 1.00 0.00 O ATOM 74138 H1 WAT 6115 63.812 60.060 141.409 1.00 0.00 H ATOM 74139 H2 WAT 6115 63.535 60.102 142.896 1.00 0.00 H TER 74141 WAT 6115 ATOM 74141 O WAT 6116 131.093 91.951 138.481 1.00 0.00 O ATOM 74142 H1 WAT 6116 130.664 91.458 139.180 1.00 0.00 H ATOM 74143 H2 WAT 6116 131.319 91.290 137.826 1.00 0.00 H TER 74145 WAT 6116 ATOM 74145 O WAT 6117 6.870 111.876 111.549 1.00 0.00 O ATOM 74146 H1 WAT 6117 5.982 111.737 111.875 1.00 0.00 H ATOM 74147 H2 WAT 6117 7.434 111.695 112.301 1.00 0.00 H TER 74149 WAT 6117 ATOM 74149 O WAT 6118 88.526 62.642 111.226 1.00 0.00 O ATOM 74150 H1 WAT 6118 89.335 62.313 111.618 1.00 0.00 H ATOM 74151 H2 WAT 6118 87.908 62.688 111.956 1.00 0.00 H TER 74153 WAT 6118 ATOM 74153 O WAT 6119 32.946 141.407 103.677 1.00 0.00 O ATOM 74154 H1 WAT 6119 32.448 140.724 104.125 1.00 0.00 H ATOM 74155 H2 WAT 6119 33.813 141.376 104.082 1.00 0.00 H TER 74157 WAT 6119 ATOM 74157 O WAT 6120 101.655 2.157 68.398 1.00 0.00 O ATOM 74158 H1 WAT 6120 101.015 2.703 68.855 1.00 0.00 H ATOM 74159 H2 WAT 6120 101.454 2.278 67.470 1.00 0.00 H TER 74161 WAT 6120 ATOM 74161 O WAT 6121 8.639 19.406 147.595 1.00 0.00 O ATOM 74162 H1 WAT 6121 8.148 18.827 148.177 1.00 0.00 H ATOM 74163 H2 WAT 6121 8.970 20.098 148.168 1.00 0.00 H TER 74165 WAT 6121 ATOM 74165 O WAT 6122 6.826 107.729 141.207 1.00 0.00 O ATOM 74166 H1 WAT 6122 6.680 107.389 142.089 1.00 0.00 H ATOM 74167 H2 WAT 6122 7.643 108.224 141.274 1.00 0.00 H TER 74169 WAT 6122 ATOM 74169 O WAT 6123 49.898 18.710 143.752 1.00 0.00 O ATOM 74170 H1 WAT 6123 50.330 19.243 144.420 1.00 0.00 H ATOM 74171 H2 WAT 6123 48.991 18.642 144.049 1.00 0.00 H TER 74173 WAT 6123 ATOM 74173 O WAT 6124 16.281 33.021 4.179 1.00 0.00 O ATOM 74174 H1 WAT 6124 16.107 32.608 3.333 1.00 0.00 H ATOM 74175 H2 WAT 6124 15.414 33.239 4.522 1.00 0.00 H TER 74177 WAT 6124 ATOM 74177 O WAT 6125 56.065 0.204 13.754 1.00 0.00 O ATOM 74178 H1 WAT 6125 56.465 0.080 12.893 1.00 0.00 H ATOM 74179 H2 WAT 6125 55.179 0.512 13.564 1.00 0.00 H TER 74181 WAT 6125 ATOM 74181 O WAT 6126 106.525 102.280 141.691 1.00 0.00 O ATOM 74182 H1 WAT 6126 107.145 102.287 142.420 1.00 0.00 H ATOM 74183 H2 WAT 6126 105.888 102.961 141.911 1.00 0.00 H TER 74185 WAT 6126 ATOM 74185 O WAT 6127 7.328 105.753 21.123 1.00 0.00 O ATOM 74186 H1 WAT 6127 7.296 106.699 21.265 1.00 0.00 H ATOM 74187 H2 WAT 6127 7.265 105.376 22.000 1.00 0.00 H TER 74189 WAT 6127 ATOM 74189 O WAT 6128 67.698 26.464 88.962 1.00 0.00 O ATOM 74190 H1 WAT 6128 67.263 26.774 89.757 1.00 0.00 H ATOM 74191 H2 WAT 6128 67.729 25.513 89.062 1.00 0.00 H TER 74193 WAT 6128 ATOM 74193 O WAT 6129 145.060 58.068 144.973 1.00 0.00 O ATOM 74194 H1 WAT 6129 145.569 58.348 145.733 1.00 0.00 H ATOM 74195 H2 WAT 6129 144.702 57.217 145.225 1.00 0.00 H TER 74197 WAT 6129 ATOM 74197 O WAT 6130 29.813 96.437 71.695 1.00 0.00 O ATOM 74198 H1 WAT 6130 29.608 96.040 72.541 1.00 0.00 H ATOM 74199 H2 WAT 6130 30.272 95.750 71.212 1.00 0.00 H TER 74201 WAT 6130 ATOM 74201 O WAT 6131 58.359 125.413 100.082 1.00 0.00 O ATOM 74202 H1 WAT 6131 59.062 125.848 99.600 1.00 0.00 H ATOM 74203 H2 WAT 6131 58.803 124.743 100.601 1.00 0.00 H TER 74205 WAT 6131 ATOM 74205 O WAT 6132 16.426 123.316 60.588 1.00 0.00 O ATOM 74206 H1 WAT 6132 17.068 123.888 60.167 1.00 0.00 H ATOM 74207 H2 WAT 6132 16.469 123.549 61.516 1.00 0.00 H TER 74209 WAT 6132 ATOM 74209 O WAT 6133 36.895 13.571 123.702 1.00 0.00 O ATOM 74210 H1 WAT 6133 36.049 13.533 123.257 1.00 0.00 H ATOM 74211 H2 WAT 6133 37.179 14.480 123.599 1.00 0.00 H TER 74213 WAT 6133 ATOM 74213 O WAT 6134 136.510 17.152 105.280 1.00 0.00 O ATOM 74214 H1 WAT 6134 135.851 16.541 105.608 1.00 0.00 H ATOM 74215 H2 WAT 6134 136.112 18.015 105.388 1.00 0.00 H TER 74217 WAT 6134 ATOM 74217 O WAT 6135 97.606 0.595 113.262 1.00 0.00 O ATOM 74218 H1 WAT 6135 97.580 1.247 113.962 1.00 0.00 H ATOM 74219 H2 WAT 6135 96.854 0.807 112.709 1.00 0.00 H TER 74221 WAT 6135 ATOM 74221 O WAT 6136 46.150 131.640 131.972 1.00 0.00 O ATOM 74222 H1 WAT 6136 47.011 131.294 132.207 1.00 0.00 H ATOM 74223 H2 WAT 6136 46.215 131.828 131.036 1.00 0.00 H TER 74225 WAT 6136 ATOM 74225 O WAT 6137 137.356 125.240 18.816 1.00 0.00 O ATOM 74226 H1 WAT 6137 137.968 125.040 19.523 1.00 0.00 H ATOM 74227 H2 WAT 6137 137.914 125.464 18.071 1.00 0.00 H TER 74229 WAT 6137 ATOM 74229 O WAT 6138 37.095 4.588 64.870 1.00 0.00 O ATOM 74230 H1 WAT 6138 36.741 4.372 65.733 1.00 0.00 H ATOM 74231 H2 WAT 6138 37.942 4.142 64.839 1.00 0.00 H TER 74233 WAT 6138 ATOM 74233 O WAT 6139 14.309 82.546 141.836 1.00 0.00 O ATOM 74234 H1 WAT 6139 14.187 81.659 141.496 1.00 0.00 H ATOM 74235 H2 WAT 6139 14.309 82.439 142.787 1.00 0.00 H TER 74237 WAT 6139 ATOM 74237 O WAT 6140 50.432 120.852 149.218 1.00 0.00 O ATOM 74238 H1 WAT 6140 51.271 121.186 149.537 1.00 0.00 H ATOM 74239 H2 WAT 6140 50.265 120.076 149.754 1.00 0.00 H TER 74241 WAT 6140 ATOM 74241 O WAT 6141 79.733 92.386 28.050 1.00 0.00 O ATOM 74242 H1 WAT 6141 78.942 92.580 28.554 1.00 0.00 H ATOM 74243 H2 WAT 6141 80.014 91.527 28.367 1.00 0.00 H TER 74245 WAT 6141 ATOM 74245 O WAT 6142 50.995 96.403 113.098 1.00 0.00 O ATOM 74246 H1 WAT 6142 50.871 97.351 113.151 1.00 0.00 H ATOM 74247 H2 WAT 6142 50.280 96.099 112.539 1.00 0.00 H TER 74249 WAT 6142 ATOM 74249 O WAT 6143 130.695 119.891 146.427 1.00 0.00 O ATOM 74250 H1 WAT 6143 131.286 119.761 145.686 1.00 0.00 H ATOM 74251 H2 WAT 6143 131.258 119.816 147.198 1.00 0.00 H TER 74253 WAT 6143 ATOM 74253 O WAT 6144 6.950 118.346 11.729 1.00 0.00 O ATOM 74254 H1 WAT 6144 7.701 118.308 11.136 1.00 0.00 H ATOM 74255 H2 WAT 6144 7.336 118.355 12.604 1.00 0.00 H TER 74257 WAT 6144 ATOM 74257 O WAT 6145 85.544 74.438 94.851 1.00 0.00 O ATOM 74258 H1 WAT 6145 85.602 74.961 94.052 1.00 0.00 H ATOM 74259 H2 WAT 6145 85.114 73.628 94.577 1.00 0.00 H TER 74261 WAT 6145 ATOM 74261 O WAT 6146 120.805 128.143 70.678 1.00 0.00 O ATOM 74262 H1 WAT 6146 120.893 128.624 71.501 1.00 0.00 H ATOM 74263 H2 WAT 6146 120.007 128.491 70.281 1.00 0.00 H TER 74265 WAT 6146 ATOM 74265 O WAT 6147 57.928 29.617 112.852 1.00 0.00 O ATOM 74266 H1 WAT 6147 58.715 29.668 112.309 1.00 0.00 H ATOM 74267 H2 WAT 6147 57.883 30.469 113.287 1.00 0.00 H TER 74269 WAT 6147 ATOM 74269 O WAT 6148 24.139 42.746 70.228 1.00 0.00 O ATOM 74270 H1 WAT 6148 24.852 43.183 69.761 1.00 0.00 H ATOM 74271 H2 WAT 6148 24.044 43.244 71.040 1.00 0.00 H TER 74273 WAT 6148 ATOM 74273 O WAT 6149 27.189 102.910 7.565 1.00 0.00 O ATOM 74274 H1 WAT 6149 27.551 103.117 6.704 1.00 0.00 H ATOM 74275 H2 WAT 6149 27.589 103.549 8.154 1.00 0.00 H TER 74277 WAT 6149 ATOM 74277 O WAT 6150 68.514 69.319 111.797 1.00 0.00 O ATOM 74278 H1 WAT 6150 69.059 70.037 112.119 1.00 0.00 H ATOM 74279 H2 WAT 6150 69.139 68.672 111.469 1.00 0.00 H TER 74281 WAT 6150 ATOM 74281 O WAT 6151 6.976 12.990 87.035 1.00 0.00 O ATOM 74282 H1 WAT 6151 6.643 13.784 86.617 1.00 0.00 H ATOM 74283 H2 WAT 6151 7.759 12.764 86.533 1.00 0.00 H TER 74285 WAT 6151 ATOM 74285 O WAT 6152 93.776 45.381 94.998 1.00 0.00 O ATOM 74286 H1 WAT 6152 93.572 45.714 95.872 1.00 0.00 H ATOM 74287 H2 WAT 6152 92.922 45.263 94.582 1.00 0.00 H TER 74289 WAT 6152 ATOM 74289 O WAT 6153 34.439 44.338 121.110 1.00 0.00 O ATOM 74290 H1 WAT 6153 33.723 43.705 121.171 1.00 0.00 H ATOM 74291 H2 WAT 6153 34.823 44.182 120.247 1.00 0.00 H TER 74293 WAT 6153 ATOM 74293 O WAT 6154 5.638 2.940 23.139 1.00 0.00 O ATOM 74294 H1 WAT 6154 6.373 2.409 23.446 1.00 0.00 H ATOM 74295 H2 WAT 6154 6.048 3.712 22.748 1.00 0.00 H TER 74297 WAT 6154 ATOM 74297 O WAT 6155 67.869 124.313 122.076 1.00 0.00 O ATOM 74298 H1 WAT 6155 67.273 124.176 121.340 1.00 0.00 H ATOM 74299 H2 WAT 6155 68.531 123.628 121.979 1.00 0.00 H TER 74301 WAT 6155 ATOM 74301 O WAT 6156 71.299 26.114 145.727 1.00 0.00 O ATOM 74302 H1 WAT 6156 71.160 26.548 144.885 1.00 0.00 H ATOM 74303 H2 WAT 6156 70.541 25.537 145.827 1.00 0.00 H TER 74305 WAT 6156 ATOM 74305 O WAT 6157 37.215 123.790 132.339 1.00 0.00 O ATOM 74306 H1 WAT 6157 37.772 123.168 131.871 1.00 0.00 H ATOM 74307 H2 WAT 6157 37.821 124.459 132.659 1.00 0.00 H TER 74309 WAT 6157 ATOM 74309 O WAT 6158 95.694 27.374 92.923 1.00 0.00 O ATOM 74310 H1 WAT 6158 95.243 28.108 92.505 1.00 0.00 H ATOM 74311 H2 WAT 6158 96.195 26.967 92.217 1.00 0.00 H TER 74313 WAT 6158 ATOM 74313 O WAT 6159 104.064 39.557 113.906 1.00 0.00 O ATOM 74314 H1 WAT 6159 103.824 40.467 114.081 1.00 0.00 H ATOM 74315 H2 WAT 6159 103.567 39.324 113.122 1.00 0.00 H TER 74317 WAT 6159 ATOM 74317 O WAT 6160 56.330 46.490 84.996 1.00 0.00 O ATOM 74318 H1 WAT 6160 55.628 46.160 85.556 1.00 0.00 H ATOM 74319 H2 WAT 6160 56.987 45.794 84.999 1.00 0.00 H TER 74321 WAT 6160 ATOM 74321 O WAT 6161 10.771 29.269 129.780 1.00 0.00 O ATOM 74322 H1 WAT 6161 9.839 29.436 129.916 1.00 0.00 H ATOM 74323 H2 WAT 6161 10.999 29.793 129.012 1.00 0.00 H TER 74325 WAT 6161 ATOM 74325 O WAT 6162 81.523 122.395 65.848 1.00 0.00 O ATOM 74326 H1 WAT 6162 81.420 122.650 64.931 1.00 0.00 H ATOM 74327 H2 WAT 6162 82.040 121.590 65.816 1.00 0.00 H TER 74329 WAT 6162 ATOM 74329 O WAT 6163 84.863 93.986 12.109 1.00 0.00 O ATOM 74330 H1 WAT 6163 85.367 94.734 12.429 1.00 0.00 H ATOM 74331 H2 WAT 6163 84.720 94.174 11.181 1.00 0.00 H TER 74333 WAT 6163 ATOM 74333 O WAT 6164 109.882 30.013 111.303 1.00 0.00 O ATOM 74334 H1 WAT 6164 110.238 29.182 111.618 1.00 0.00 H ATOM 74335 H2 WAT 6164 109.617 30.477 112.097 1.00 0.00 H TER 74337 WAT 6164 ATOM 74337 O WAT 6165 76.345 61.701 98.623 1.00 0.00 O ATOM 74338 H1 WAT 6165 76.186 62.286 99.364 1.00 0.00 H ATOM 74339 H2 WAT 6165 76.246 62.260 97.852 1.00 0.00 H TER 74341 WAT 6165 ATOM 74341 O WAT 6166 120.918 38.092 5.121 1.00 0.00 O ATOM 74342 H1 WAT 6166 121.693 37.535 5.197 1.00 0.00 H ATOM 74343 H2 WAT 6166 121.126 38.695 4.407 1.00 0.00 H TER 74345 WAT 6166 ATOM 74345 O WAT 6167 128.154 95.429 121.179 1.00 0.00 O ATOM 74346 H1 WAT 6167 128.812 96.093 120.970 1.00 0.00 H ATOM 74347 H2 WAT 6167 127.519 95.489 120.465 1.00 0.00 H TER 74349 WAT 6167 ATOM 74349 O WAT 6168 34.084 120.762 118.880 1.00 0.00 O ATOM 74350 H1 WAT 6168 33.423 120.504 118.237 1.00 0.00 H ATOM 74351 H2 WAT 6168 33.579 121.111 119.614 1.00 0.00 H TER 74353 WAT 6168 ATOM 74353 O WAT 6169 99.820 39.379 154.245 1.00 0.00 O ATOM 74354 H1 WAT 6169 100.607 39.124 154.726 1.00 0.00 H ATOM 74355 H2 WAT 6169 100.147 39.885 153.501 1.00 0.00 H TER 74357 WAT 6169 ATOM 74357 O WAT 6170 108.971 27.780 93.570 1.00 0.00 O ATOM 74358 H1 WAT 6170 109.349 26.928 93.353 1.00 0.00 H ATOM 74359 H2 WAT 6170 108.144 27.804 93.089 1.00 0.00 H TER 74361 WAT 6170 ATOM 74361 O WAT 6171 21.796 59.426 95.557 1.00 0.00 O ATOM 74362 H1 WAT 6171 22.589 59.947 95.428 1.00 0.00 H ATOM 74363 H2 WAT 6171 22.017 58.824 96.267 1.00 0.00 H TER 74365 WAT 6171 ATOM 74365 O WAT 6172 24.783 126.194 77.045 1.00 0.00 O ATOM 74366 H1 WAT 6172 24.347 125.379 77.295 1.00 0.00 H ATOM 74367 H2 WAT 6172 25.100 126.034 76.156 1.00 0.00 H TER 74369 WAT 6172 ATOM 74369 O WAT 6173 24.203 50.953 112.575 1.00 0.00 O ATOM 74370 H1 WAT 6173 24.108 50.015 112.413 1.00 0.00 H ATOM 74371 H2 WAT 6173 24.710 51.007 113.385 1.00 0.00 H TER 74373 WAT 6173 ATOM 74373 O WAT 6174 88.006 90.968 71.422 1.00 0.00 O ATOM 74374 H1 WAT 6174 88.006 91.358 72.296 1.00 0.00 H ATOM 74375 H2 WAT 6174 87.290 91.408 70.964 1.00 0.00 H TER 74377 WAT 6174 ATOM 74377 O WAT 6175 119.621 83.311 106.310 1.00 0.00 O ATOM 74378 H1 WAT 6175 119.448 82.455 105.919 1.00 0.00 H ATOM 74379 H2 WAT 6175 118.979 83.894 105.905 1.00 0.00 H TER 74381 WAT 6175 ATOM 74381 O WAT 6176 71.126 143.513 62.984 1.00 0.00 O ATOM 74382 H1 WAT 6176 71.304 143.757 63.892 1.00 0.00 H ATOM 74383 H2 WAT 6176 70.675 144.273 62.615 1.00 0.00 H TER 74385 WAT 6176 ATOM 74385 O WAT 6177 41.680 14.726 151.755 1.00 0.00 O ATOM 74386 H1 WAT 6177 42.044 15.526 152.133 1.00 0.00 H ATOM 74387 H2 WAT 6177 41.008 15.033 151.146 1.00 0.00 H TER 74389 WAT 6177 ATOM 74389 O WAT 6178 24.608 96.433 8.189 1.00 0.00 O ATOM 74390 H1 WAT 6178 23.937 97.045 8.491 1.00 0.00 H ATOM 74391 H2 WAT 6178 25.302 96.991 7.840 1.00 0.00 H TER 74393 WAT 6178 ATOM 74393 O WAT 6179 135.674 65.429 5.867 1.00 0.00 O ATOM 74394 H1 WAT 6179 135.070 66.080 5.510 1.00 0.00 H ATOM 74395 H2 WAT 6179 136.541 65.816 5.747 1.00 0.00 H TER 74397 WAT 6179 ATOM 74397 O WAT 6180 48.308 120.172 115.795 1.00 0.00 O ATOM 74398 H1 WAT 6180 47.936 120.867 115.251 1.00 0.00 H ATOM 74399 H2 WAT 6180 48.349 120.551 116.673 1.00 0.00 H TER 74401 WAT 6180 ATOM 74401 O WAT 6181 32.792 17.441 148.669 1.00 0.00 O ATOM 74402 H1 WAT 6181 33.670 17.519 148.295 1.00 0.00 H ATOM 74403 H2 WAT 6181 32.816 17.990 149.453 1.00 0.00 H TER 74405 WAT 6181 ATOM 74405 O WAT 6182 42.894 44.020 123.735 1.00 0.00 O ATOM 74406 H1 WAT 6182 42.773 43.278 124.327 1.00 0.00 H ATOM 74407 H2 WAT 6182 43.830 44.215 123.782 1.00 0.00 H TER 74409 WAT 6182 ATOM 74409 O WAT 6183 105.145 15.029 18.213 1.00 0.00 O ATOM 74410 H1 WAT 6183 104.582 14.416 18.685 1.00 0.00 H ATOM 74411 H2 WAT 6183 104.586 15.789 18.048 1.00 0.00 H TER 74413 WAT 6183 ATOM 74413 O WAT 6184 26.776 54.811 115.005 1.00 0.00 O ATOM 74414 H1 WAT 6184 26.685 54.515 115.911 1.00 0.00 H ATOM 74415 H2 WAT 6184 27.379 55.553 115.055 1.00 0.00 H TER 74417 WAT 6184 ATOM 74417 O WAT 6185 88.809 0.783 113.094 1.00 0.00 O ATOM 74418 H1 WAT 6185 88.258 0.016 112.939 1.00 0.00 H ATOM 74419 H2 WAT 6185 88.789 1.264 112.267 1.00 0.00 H TER 74421 WAT 6185 ATOM 74421 O WAT 6186 78.858 123.089 80.687 1.00 0.00 O ATOM 74422 H1 WAT 6186 79.494 123.251 79.990 1.00 0.00 H ATOM 74423 H2 WAT 6186 78.735 123.943 81.102 1.00 0.00 H TER 74425 WAT 6186 ATOM 74425 O WAT 6187 50.266 69.234 64.085 1.00 0.00 O ATOM 74426 H1 WAT 6187 50.370 69.781 63.307 1.00 0.00 H ATOM 74427 H2 WAT 6187 50.448 68.345 63.780 1.00 0.00 H TER 74429 WAT 6187 ATOM 74429 O WAT 6188 28.568 70.586 146.703 1.00 0.00 O ATOM 74430 H1 WAT 6188 28.011 70.471 147.474 1.00 0.00 H ATOM 74431 H2 WAT 6188 28.339 69.853 146.132 1.00 0.00 H TER 74433 WAT 6188 ATOM 74433 O WAT 6189 31.906 44.134 92.775 1.00 0.00 O ATOM 74434 H1 WAT 6189 31.963 43.209 92.535 1.00 0.00 H ATOM 74435 H2 WAT 6189 30.967 44.322 92.785 1.00 0.00 H TER 74437 WAT 6189 ATOM 74437 O WAT 6190 22.265 64.884 6.537 1.00 0.00 O ATOM 74438 H1 WAT 6190 21.978 63.977 6.642 1.00 0.00 H ATOM 74439 H2 WAT 6190 22.416 65.193 7.430 1.00 0.00 H TER 74441 WAT 6190 ATOM 74441 O WAT 6191 143.098 128.082 82.869 1.00 0.00 O ATOM 74442 H1 WAT 6191 142.938 128.807 83.473 1.00 0.00 H ATOM 74443 H2 WAT 6191 143.579 127.438 83.390 1.00 0.00 H TER 74445 WAT 6191 ATOM 74445 O WAT 6192 18.191 26.279 29.915 1.00 0.00 O ATOM 74446 H1 WAT 6192 18.814 25.781 29.386 1.00 0.00 H ATOM 74447 H2 WAT 6192 18.529 26.213 30.808 1.00 0.00 H TER 74449 WAT 6192 ATOM 74449 O WAT 6193 13.844 89.356 126.938 1.00 0.00 O ATOM 74450 H1 WAT 6193 13.703 88.498 127.338 1.00 0.00 H ATOM 74451 H2 WAT 6193 13.012 89.562 126.512 1.00 0.00 H TER 74453 WAT 6193 ATOM 74453 O WAT 6194 135.387 116.603 69.539 1.00 0.00 O ATOM 74454 H1 WAT 6194 136.072 117.269 69.611 1.00 0.00 H ATOM 74455 H2 WAT 6194 134.951 116.797 68.709 1.00 0.00 H TER 74457 WAT 6194 ATOM 74457 O WAT 6195 128.953 144.856 21.750 1.00 0.00 O ATOM 74458 H1 WAT 6195 128.412 144.068 21.701 1.00 0.00 H ATOM 74459 H2 WAT 6195 129.161 144.946 22.680 1.00 0.00 H TER 74461 WAT 6195 ATOM 74461 O WAT 6196 140.652 33.468 5.537 1.00 0.00 O ATOM 74462 H1 WAT 6196 140.040 34.050 5.087 1.00 0.00 H ATOM 74463 H2 WAT 6196 140.521 33.654 6.467 1.00 0.00 H TER 74465 WAT 6196 ATOM 74465 O WAT 6197 14.592 3.566 137.134 1.00 0.00 O ATOM 74466 H1 WAT 6197 15.072 2.824 137.503 1.00 0.00 H ATOM 74467 H2 WAT 6197 14.882 4.319 137.650 1.00 0.00 H TER 74469 WAT 6197 ATOM 74469 O WAT 6198 53.403 21.101 93.471 1.00 0.00 O ATOM 74470 H1 WAT 6198 53.148 21.507 92.642 1.00 0.00 H ATOM 74471 H2 WAT 6198 54.354 21.207 93.506 1.00 0.00 H TER 74473 WAT 6198 ATOM 74473 O WAT 6199 19.768 13.965 119.674 1.00 0.00 O ATOM 74474 H1 WAT 6199 19.831 13.013 119.750 1.00 0.00 H ATOM 74475 H2 WAT 6199 19.921 14.141 118.745 1.00 0.00 H TER 74477 WAT 6199 ATOM 74477 O WAT 6200 112.795 43.914 60.587 1.00 0.00 O ATOM 74478 H1 WAT 6200 112.692 43.551 61.467 1.00 0.00 H ATOM 74479 H2 WAT 6200 112.596 44.845 60.688 1.00 0.00 H TER 74481 WAT 6200 ATOM 74481 O WAT 6201 1.068 142.971 118.511 1.00 0.00 O ATOM 74482 H1 WAT 6201 0.512 142.225 118.285 1.00 0.00 H ATOM 74483 H2 WAT 6201 0.551 143.471 119.143 1.00 0.00 H TER 74485 WAT 6201 ATOM 74485 O WAT 6202 20.588 142.130 154.917 1.00 0.00 O ATOM 74486 H1 WAT 6202 21.294 141.602 155.289 1.00 0.00 H ATOM 74487 H2 WAT 6202 20.390 142.776 155.595 1.00 0.00 H TER 74489 WAT 6202 ATOM 74489 O WAT 6203 113.246 142.478 60.318 1.00 0.00 O ATOM 74490 H1 WAT 6203 113.882 142.159 60.958 1.00 0.00 H ATOM 74491 H2 WAT 6203 113.555 143.355 60.089 1.00 0.00 H TER 74493 WAT 6203 ATOM 74493 O WAT 6204 145.886 127.520 107.634 1.00 0.00 O ATOM 74494 H1 WAT 6204 146.019 128.421 107.928 1.00 0.00 H ATOM 74495 H2 WAT 6204 145.765 127.593 106.687 1.00 0.00 H TER 74497 WAT 6204 ATOM 74497 O WAT 6205 97.419 126.817 157.649 1.00 0.00 O ATOM 74498 H1 WAT 6205 96.697 127.323 157.275 1.00 0.00 H ATOM 74499 H2 WAT 6205 97.998 126.641 156.907 1.00 0.00 H TER 74501 WAT 6205 ATOM 74501 O WAT 6206 138.754 87.242 149.237 1.00 0.00 O ATOM 74502 H1 WAT 6206 138.090 87.904 149.432 1.00 0.00 H ATOM 74503 H2 WAT 6206 139.545 87.562 149.671 1.00 0.00 H TER 74505 WAT 6206 ATOM 74505 O WAT 6207 137.226 138.702 157.088 1.00 0.00 O ATOM 74506 H1 WAT 6207 137.505 139.584 157.336 1.00 0.00 H ATOM 74507 H2 WAT 6207 136.314 138.650 157.374 1.00 0.00 H TER 74509 WAT 6207 ATOM 74509 O WAT 6208 56.118 3.461 0.876 1.00 0.00 O ATOM 74510 H1 WAT 6208 56.765 3.109 0.265 1.00 0.00 H ATOM 74511 H2 WAT 6208 55.970 2.753 1.503 1.00 0.00 H TER 74513 WAT 6208 ATOM 74513 O WAT 6209 27.428 82.554 122.723 1.00 0.00 O ATOM 74514 H1 WAT 6209 27.872 83.318 123.092 1.00 0.00 H ATOM 74515 H2 WAT 6209 26.584 82.891 122.422 1.00 0.00 H TER 74517 WAT 6209 ATOM 74517 O WAT 6210 34.897 139.382 73.099 1.00 0.00 O ATOM 74518 H1 WAT 6210 34.458 139.036 72.321 1.00 0.00 H ATOM 74519 H2 WAT 6210 34.211 139.414 73.766 1.00 0.00 H TER 74521 WAT 6210 ATOM 74521 O WAT 6211 73.781 110.668 86.563 1.00 0.00 O ATOM 74522 H1 WAT 6211 74.234 110.094 87.180 1.00 0.00 H ATOM 74523 H2 WAT 6211 73.326 110.071 85.969 1.00 0.00 H TER 74525 WAT 6211 ATOM 74525 O WAT 6212 115.420 68.435 77.766 1.00 0.00 O ATOM 74526 H1 WAT 6212 116.345 68.672 77.693 1.00 0.00 H ATOM 74527 H2 WAT 6212 115.398 67.766 78.450 1.00 0.00 H TER 74529 WAT 6212 ATOM 74529 O WAT 6213 142.434 145.749 128.713 1.00 0.00 O ATOM 74530 H1 WAT 6213 141.824 146.217 129.283 1.00 0.00 H ATOM 74531 H2 WAT 6213 142.768 145.034 129.255 1.00 0.00 H TER 74533 WAT 6213 ATOM 74533 O WAT 6214 52.751 23.649 56.018 1.00 0.00 O ATOM 74534 H1 WAT 6214 52.958 24.514 55.665 1.00 0.00 H ATOM 74535 H2 WAT 6214 51.981 23.367 55.524 1.00 0.00 H TER 74537 WAT 6214 ATOM 74537 O WAT 6215 24.455 92.670 21.884 1.00 0.00 O ATOM 74538 H1 WAT 6215 25.239 92.671 22.432 1.00 0.00 H ATOM 74539 H2 WAT 6215 24.680 93.234 21.144 1.00 0.00 H TER 74541 WAT 6215 ATOM 74541 O WAT 6216 101.632 63.775 136.010 1.00 0.00 O ATOM 74542 H1 WAT 6216 101.134 64.568 135.816 1.00 0.00 H ATOM 74543 H2 WAT 6216 102.508 64.090 136.235 1.00 0.00 H TER 74545 WAT 6216 ATOM 74545 O WAT 6217 80.928 57.904 110.334 1.00 0.00 O ATOM 74546 H1 WAT 6217 81.673 57.518 110.796 1.00 0.00 H ATOM 74547 H2 WAT 6217 80.803 58.756 110.752 1.00 0.00 H TER 74549 WAT 6217 ATOM 74549 O WAT 6218 12.124 76.087 146.194 1.00 0.00 O ATOM 74550 H1 WAT 6218 13.020 76.284 145.919 1.00 0.00 H ATOM 74551 H2 WAT 6218 11.629 76.029 145.377 1.00 0.00 H TER 74553 WAT 6218 ATOM 74553 O WAT 6219 33.767 45.367 111.884 1.00 0.00 O ATOM 74554 H1 WAT 6219 34.295 44.610 111.632 1.00 0.00 H ATOM 74555 H2 WAT 6219 33.698 45.304 112.837 1.00 0.00 H TER 74557 WAT 6219 ATOM 74557 O WAT 6220 11.234 121.857 62.134 1.00 0.00 O ATOM 74558 H1 WAT 6220 12.085 122.015 61.726 1.00 0.00 H ATOM 74559 H2 WAT 6220 11.391 121.141 62.749 1.00 0.00 H TER 74561 WAT 6220 ATOM 74561 O WAT 6221 74.501 65.586 11.251 1.00 0.00 O ATOM 74562 H1 WAT 6221 75.139 65.502 11.960 1.00 0.00 H ATOM 74563 H2 WAT 6221 74.979 66.032 10.552 1.00 0.00 H TER 74565 WAT 6221 ATOM 74565 O WAT 6222 129.660 25.589 93.102 1.00 0.00 O ATOM 74566 H1 WAT 6222 129.734 25.899 92.199 1.00 0.00 H ATOM 74567 H2 WAT 6222 130.147 24.765 93.112 1.00 0.00 H TER 74569 WAT 6222 ATOM 74569 O WAT 6223 127.752 112.011 152.027 1.00 0.00 O ATOM 74570 H1 WAT 6223 128.242 112.710 151.594 1.00 0.00 H ATOM 74571 H2 WAT 6223 127.312 111.549 151.314 1.00 0.00 H TER 74573 WAT 6223 ATOM 74573 O WAT 6224 71.610 140.931 135.451 1.00 0.00 O ATOM 74574 H1 WAT 6224 70.992 141.391 136.018 1.00 0.00 H ATOM 74575 H2 WAT 6224 71.545 141.382 134.609 1.00 0.00 H TER 74577 WAT 6224 ATOM 74577 O WAT 6225 40.512 36.850 139.790 1.00 0.00 O ATOM 74578 H1 WAT 6225 40.006 37.246 140.500 1.00 0.00 H ATOM 74579 H2 WAT 6225 40.442 37.474 139.068 1.00 0.00 H TER 74581 WAT 6225 ATOM 74581 O WAT 6226 48.886 50.831 90.461 1.00 0.00 O ATOM 74582 H1 WAT 6226 49.683 50.305 90.389 1.00 0.00 H ATOM 74583 H2 WAT 6226 49.034 51.572 89.874 1.00 0.00 H TER 74585 WAT 6226 ATOM 74585 O WAT 6227 123.514 65.392 114.899 1.00 0.00 O ATOM 74586 H1 WAT 6227 123.222 66.089 115.487 1.00 0.00 H ATOM 74587 H2 WAT 6227 124.203 64.941 115.387 1.00 0.00 H TER 74589 WAT 6227 ATOM 74589 O WAT 6228 84.569 103.963 69.727 1.00 0.00 O ATOM 74590 H1 WAT 6228 84.700 104.461 68.921 1.00 0.00 H ATOM 74591 H2 WAT 6228 84.371 104.626 70.389 1.00 0.00 H TER 74593 WAT 6228 ATOM 74593 O WAT 6229 53.719 10.968 70.114 1.00 0.00 O ATOM 74594 H1 WAT 6229 53.751 11.062 69.162 1.00 0.00 H ATOM 74595 H2 WAT 6229 52.785 10.933 70.319 1.00 0.00 H TER 74597 WAT 6229 ATOM 74597 O WAT 6230 112.546 61.937 114.941 1.00 0.00 O ATOM 74598 H1 WAT 6230 112.630 61.603 115.834 1.00 0.00 H ATOM 74599 H2 WAT 6230 113.261 61.519 114.461 1.00 0.00 H TER 74601 WAT 6230 ATOM 74601 O WAT 6231 123.819 91.315 5.344 1.00 0.00 O ATOM 74602 H1 WAT 6231 124.306 91.832 5.986 1.00 0.00 H ATOM 74603 H2 WAT 6231 123.234 91.945 4.924 1.00 0.00 H TER 74605 WAT 6231 ATOM 74605 O WAT 6232 50.590 8.710 13.448 1.00 0.00 O ATOM 74606 H1 WAT 6232 50.708 9.142 12.602 1.00 0.00 H ATOM 74607 H2 WAT 6232 51.480 8.548 13.760 1.00 0.00 H TER 74609 WAT 6232 ATOM 74609 O WAT 6233 44.673 29.864 57.868 1.00 0.00 O ATOM 74610 H1 WAT 6233 44.393 30.608 58.401 1.00 0.00 H ATOM 74611 H2 WAT 6233 45.625 29.945 57.824 1.00 0.00 H TER 74613 WAT 6233 ATOM 74613 O WAT 6234 0.839 49.283 113.402 1.00 0.00 O ATOM 74614 H1 WAT 6234 0.942 49.385 114.348 1.00 0.00 H ATOM 74615 H2 WAT 6234 0.660 50.169 113.084 1.00 0.00 H TER 74617 WAT 6234 ATOM 74617 O WAT 6235 66.307 137.326 83.899 1.00 0.00 O ATOM 74618 H1 WAT 6235 65.706 137.948 84.310 1.00 0.00 H ATOM 74619 H2 WAT 6235 65.838 137.017 83.124 1.00 0.00 H TER 74621 WAT 6235 ATOM 74621 O WAT 6236 137.329 131.888 102.085 1.00 0.00 O ATOM 74622 H1 WAT 6236 137.551 132.813 101.985 1.00 0.00 H ATOM 74623 H2 WAT 6236 136.677 131.723 101.404 1.00 0.00 H TER 74625 WAT 6236 ATOM 74625 O WAT 6237 88.470 39.535 97.693 1.00 0.00 O ATOM 74626 H1 WAT 6237 89.169 39.424 98.338 1.00 0.00 H ATOM 74627 H2 WAT 6237 88.418 40.481 97.558 1.00 0.00 H TER 74629 WAT 6237 ATOM 74629 O WAT 6238 108.445 122.111 80.072 1.00 0.00 O ATOM 74630 H1 WAT 6238 109.119 122.008 80.744 1.00 0.00 H ATOM 74631 H2 WAT 6238 108.142 121.219 79.898 1.00 0.00 H TER 74633 WAT 6238 ATOM 74633 O WAT 6239 16.791 109.873 134.114 1.00 0.00 O ATOM 74634 H1 WAT 6239 16.506 110.588 133.545 1.00 0.00 H ATOM 74635 H2 WAT 6239 17.266 110.306 134.823 1.00 0.00 H TER 74637 WAT 6239 ATOM 74637 O WAT 6240 56.185 59.477 92.242 1.00 0.00 O ATOM 74638 H1 WAT 6240 56.492 60.279 91.818 1.00 0.00 H ATOM 74639 H2 WAT 6240 55.463 59.764 92.801 1.00 0.00 H TER 74641 WAT 6240 ATOM 74641 O WAT 6241 111.682 108.967 128.782 1.00 0.00 O ATOM 74642 H1 WAT 6241 112.059 108.832 129.651 1.00 0.00 H ATOM 74643 H2 WAT 6241 112.195 109.681 128.405 1.00 0.00 H TER 74645 WAT 6241 ATOM 74645 O WAT 6242 115.425 101.214 77.692 1.00 0.00 O ATOM 74646 H1 WAT 6242 115.727 102.110 77.539 1.00 0.00 H ATOM 74647 H2 WAT 6242 115.056 101.234 78.575 1.00 0.00 H TER 74649 WAT 6242 ATOM 74649 O WAT 6243 124.225 30.564 129.708 1.00 0.00 O ATOM 74650 H1 WAT 6243 123.855 31.215 129.111 1.00 0.00 H ATOM 74651 H2 WAT 6243 124.349 31.038 130.531 1.00 0.00 H TER 74653 WAT 6243 ATOM 74653 O WAT 6244 144.153 85.431 16.458 1.00 0.00 O ATOM 74654 H1 WAT 6244 143.875 86.063 15.795 1.00 0.00 H ATOM 74655 H2 WAT 6244 144.414 85.968 17.206 1.00 0.00 H TER 74657 WAT 6244 ATOM 74657 O WAT 6245 114.889 79.983 93.150 1.00 0.00 O ATOM 74658 H1 WAT 6245 115.332 80.144 92.317 1.00 0.00 H ATOM 74659 H2 WAT 6245 115.147 80.719 93.705 1.00 0.00 H TER 74661 WAT 6245 ATOM 74661 O WAT 6246 89.818 28.497 155.502 1.00 0.00 O ATOM 74662 H1 WAT 6246 89.235 29.196 155.799 1.00 0.00 H ATOM 74663 H2 WAT 6246 90.698 28.822 155.691 1.00 0.00 H TER 74665 WAT 6246 ATOM 74665 O WAT 6247 137.942 20.848 119.836 1.00 0.00 O ATOM 74666 H1 WAT 6247 138.798 20.962 120.250 1.00 0.00 H ATOM 74667 H2 WAT 6247 137.634 20.000 120.154 1.00 0.00 H TER 74669 WAT 6247 ATOM 74669 O WAT 6248 5.552 68.571 137.785 1.00 0.00 O ATOM 74670 H1 WAT 6248 6.374 68.579 137.296 1.00 0.00 H ATOM 74671 H2 WAT 6248 5.031 67.885 137.369 1.00 0.00 H TER 74673 WAT 6248 ATOM 74673 O WAT 6249 24.992 71.593 89.561 1.00 0.00 O ATOM 74674 H1 WAT 6249 24.427 72.234 89.131 1.00 0.00 H ATOM 74675 H2 WAT 6249 24.389 70.940 89.914 1.00 0.00 H TER 74677 WAT 6249 ATOM 74677 O WAT 6250 20.992 134.354 150.667 1.00 0.00 O ATOM 74678 H1 WAT 6250 21.644 134.726 151.260 1.00 0.00 H ATOM 74679 H2 WAT 6250 20.563 133.670 151.181 1.00 0.00 H TER 74681 WAT 6250 ATOM 74681 O WAT 6251 43.742 2.742 137.141 1.00 0.00 O ATOM 74682 H1 WAT 6251 44.187 2.100 136.588 1.00 0.00 H ATOM 74683 H2 WAT 6251 43.846 2.406 138.031 1.00 0.00 H TER 74685 WAT 6251 ATOM 74685 O WAT 6252 127.308 98.197 146.964 1.00 0.00 O ATOM 74686 H1 WAT 6252 126.901 97.470 146.494 1.00 0.00 H ATOM 74687 H2 WAT 6252 127.341 98.908 146.324 1.00 0.00 H TER 74689 WAT 6252 ATOM 74689 O WAT 6253 33.955 100.935 100.020 1.00 0.00 O ATOM 74690 H1 WAT 6253 33.185 100.466 99.700 1.00 0.00 H ATOM 74691 H2 WAT 6253 33.789 101.061 100.954 1.00 0.00 H TER 74693 WAT 6253 ATOM 74693 O WAT 6254 85.351 40.641 158.537 1.00 0.00 O ATOM 74694 H1 WAT 6254 86.280 40.662 158.309 1.00 0.00 H ATOM 74695 H2 WAT 6254 85.263 41.277 159.247 1.00 0.00 H TER 74697 WAT 6254 ATOM 74697 O WAT 6255 64.082 34.402 124.778 1.00 0.00 O ATOM 74698 H1 WAT 6255 64.438 34.969 125.462 1.00 0.00 H ATOM 74699 H2 WAT 6255 64.450 34.749 123.965 1.00 0.00 H TER 74701 WAT 6255 ATOM 74701 O WAT 6256 23.937 41.035 134.425 1.00 0.00 O ATOM 74702 H1 WAT 6256 24.836 40.804 134.195 1.00 0.00 H ATOM 74703 H2 WAT 6256 23.722 40.461 135.161 1.00 0.00 H TER 74705 WAT 6256 ATOM 74705 O WAT 6257 72.044 16.581 7.420 1.00 0.00 O ATOM 74706 H1 WAT 6257 71.136 16.870 7.330 1.00 0.00 H ATOM 74707 H2 WAT 6257 72.020 15.925 8.116 1.00 0.00 H TER 74709 WAT 6257 ATOM 74709 O WAT 6258 103.323 58.026 134.566 1.00 0.00 O ATOM 74710 H1 WAT 6258 104.273 58.141 134.587 1.00 0.00 H ATOM 74711 H2 WAT 6258 102.986 58.705 135.151 1.00 0.00 H TER 74713 WAT 6258 ATOM 74713 O WAT 6259 97.557 102.066 89.121 1.00 0.00 O ATOM 74714 H1 WAT 6259 96.775 102.588 89.303 1.00 0.00 H ATOM 74715 H2 WAT 6259 98.109 102.185 89.894 1.00 0.00 H TER 74717 WAT 6259 ATOM 74717 O WAT 6260 54.491 108.244 99.377 1.00 0.00 O ATOM 74718 H1 WAT 6260 54.488 107.709 100.171 1.00 0.00 H ATOM 74719 H2 WAT 6260 54.266 107.632 98.676 1.00 0.00 H TER 74721 WAT 6260 ATOM 74721 O WAT 6261 101.462 11.237 127.349 1.00 0.00 O ATOM 74722 H1 WAT 6261 101.650 11.910 126.695 1.00 0.00 H ATOM 74723 H2 WAT 6261 101.486 11.703 128.185 1.00 0.00 H TER 74725 WAT 6261 ATOM 74725 O WAT 6262 71.034 142.687 137.545 1.00 0.00 O ATOM 74726 H1 WAT 6262 71.278 142.069 138.233 1.00 0.00 H ATOM 74727 H2 WAT 6262 71.847 143.147 137.336 1.00 0.00 H TER 74729 WAT 6262 ATOM 74729 O WAT 6263 122.526 60.035 78.569 1.00 0.00 O ATOM 74730 H1 WAT 6263 122.107 60.050 77.709 1.00 0.00 H ATOM 74731 H2 WAT 6263 123.103 59.272 78.540 1.00 0.00 H TER 74733 WAT 6263 ATOM 74733 O WAT 6264 41.189 69.164 6.600 1.00 0.00 O ATOM 74734 H1 WAT 6264 41.316 68.228 6.449 1.00 0.00 H ATOM 74735 H2 WAT 6264 40.909 69.224 7.513 1.00 0.00 H TER 74737 WAT 6264 ATOM 74737 O WAT 6265 34.350 123.324 89.169 1.00 0.00 O ATOM 74738 H1 WAT 6265 33.440 123.071 89.325 1.00 0.00 H ATOM 74739 H2 WAT 6265 34.863 122.718 89.704 1.00 0.00 H TER 74741 WAT 6265 ATOM 74741 O WAT 6266 102.077 77.674 29.409 1.00 0.00 O ATOM 74742 H1 WAT 6266 101.281 77.966 29.854 1.00 0.00 H ATOM 74743 H2 WAT 6266 101.798 77.502 28.510 1.00 0.00 H TER 74745 WAT 6266 ATOM 74745 O WAT 6267 48.433 32.795 1.297 1.00 0.00 O ATOM 74746 H1 WAT 6267 48.001 32.053 0.874 1.00 0.00 H ATOM 74747 H2 WAT 6267 49.366 32.586 1.253 1.00 0.00 H TER 74749 WAT 6267 ATOM 74749 O WAT 6268 43.296 70.913 18.966 1.00 0.00 O ATOM 74750 H1 WAT 6268 44.111 70.724 19.431 1.00 0.00 H ATOM 74751 H2 WAT 6268 43.459 70.622 18.068 1.00 0.00 H TER 74753 WAT 6268 ATOM 74753 O WAT 6269 140.389 116.253 1.056 1.00 0.00 O ATOM 74754 H1 WAT 6269 141.311 116.207 0.803 1.00 0.00 H ATOM 74755 H2 WAT 6269 140.201 115.394 1.433 1.00 0.00 H TER 74757 WAT 6269 ATOM 74757 O WAT 6270 104.559 98.317 73.462 1.00 0.00 O ATOM 74758 H1 WAT 6270 103.855 97.691 73.295 1.00 0.00 H ATOM 74759 H2 WAT 6270 104.564 98.883 72.690 1.00 0.00 H TER 74761 WAT 6270 ATOM 74761 O WAT 6271 26.655 114.747 6.007 1.00 0.00 O ATOM 74762 H1 WAT 6271 26.317 114.852 6.896 1.00 0.00 H ATOM 74763 H2 WAT 6271 27.094 113.897 6.016 1.00 0.00 H TER 74765 WAT 6271 ATOM 74765 O WAT 6272 64.508 59.516 158.346 1.00 0.00 O ATOM 74766 H1 WAT 6272 64.845 60.106 157.671 1.00 0.00 H ATOM 74767 H2 WAT 6272 64.210 58.745 157.863 1.00 0.00 H TER 74769 WAT 6272 ATOM 74769 O WAT 6273 116.705 141.464 118.473 1.00 0.00 O ATOM 74770 H1 WAT 6273 115.917 141.749 118.011 1.00 0.00 H ATOM 74771 H2 WAT 6273 116.675 141.931 119.308 1.00 0.00 H TER 74773 WAT 6273 ATOM 74773 O WAT 6274 2.821 23.511 105.886 1.00 0.00 O ATOM 74774 H1 WAT 6274 3.664 23.739 105.494 1.00 0.00 H ATOM 74775 H2 WAT 6274 3.045 22.940 106.621 1.00 0.00 H TER 74777 WAT 6274 ATOM 74777 O WAT 6275 19.482 67.425 92.808 1.00 0.00 O ATOM 74778 H1 WAT 6275 19.701 67.589 91.891 1.00 0.00 H ATOM 74779 H2 WAT 6275 20.083 67.982 93.302 1.00 0.00 H TER 74781 WAT 6275 ATOM 74781 O WAT 6276 78.097 10.265 153.042 1.00 0.00 O ATOM 74782 H1 WAT 6276 78.776 10.559 152.435 1.00 0.00 H ATOM 74783 H2 WAT 6276 77.332 10.796 152.822 1.00 0.00 H TER 74785 WAT 6276 ATOM 74785 O WAT 6277 70.895 134.444 90.478 1.00 0.00 O ATOM 74786 H1 WAT 6277 71.040 134.806 91.352 1.00 0.00 H ATOM 74787 H2 WAT 6277 71.658 134.725 89.973 1.00 0.00 H TER 74789 WAT 6277 ATOM 74789 O WAT 6278 42.054 28.989 118.143 1.00 0.00 O ATOM 74790 H1 WAT 6278 42.248 28.831 117.219 1.00 0.00 H ATOM 74791 H2 WAT 6278 42.892 29.255 118.521 1.00 0.00 H TER 74793 WAT 6278 ATOM 74793 O WAT 6279 43.199 29.286 78.138 1.00 0.00 O ATOM 74794 H1 WAT 6279 43.042 29.376 77.198 1.00 0.00 H ATOM 74795 H2 WAT 6279 42.964 28.379 78.334 1.00 0.00 H TER 74797 WAT 6279 ATOM 74797 O WAT 6280 81.975 23.042 65.245 1.00 0.00 O ATOM 74798 H1 WAT 6280 81.327 22.486 65.677 1.00 0.00 H ATOM 74799 H2 WAT 6280 81.606 23.924 65.296 1.00 0.00 H TER 74801 WAT 6280 ATOM 74801 O WAT 6281 143.116 21.339 90.533 1.00 0.00 O ATOM 74802 H1 WAT 6281 142.424 21.341 89.872 1.00 0.00 H ATOM 74803 H2 WAT 6281 143.345 20.416 90.638 1.00 0.00 H TER 74805 WAT 6281 ATOM 74805 O WAT 6282 123.225 90.921 75.487 1.00 0.00 O ATOM 74806 H1 WAT 6282 122.473 91.371 75.874 1.00 0.00 H ATOM 74807 H2 WAT 6282 122.853 90.407 74.771 1.00 0.00 H TER 74809 WAT 6282 ATOM 74809 O WAT 6283 129.293 35.582 141.759 1.00 0.00 O ATOM 74810 H1 WAT 6283 129.292 36.488 142.067 1.00 0.00 H ATOM 74811 H2 WAT 6283 128.932 35.080 142.491 1.00 0.00 H TER 74813 WAT 6283 ATOM 74813 O WAT 6284 8.232 110.502 106.943 1.00 0.00 O ATOM 74814 H1 WAT 6284 7.940 109.600 107.075 1.00 0.00 H ATOM 74815 H2 WAT 6284 8.499 110.534 106.024 1.00 0.00 H TER 74817 WAT 6284 ATOM 74817 O WAT 6285 103.637 114.050 11.411 1.00 0.00 O ATOM 74818 H1 WAT 6285 104.482 114.196 11.835 1.00 0.00 H ATOM 74819 H2 WAT 6285 103.505 113.103 11.460 1.00 0.00 H TER 74821 WAT 6285 ATOM 74821 O WAT 6286 90.722 125.323 116.734 1.00 0.00 O ATOM 74822 H1 WAT 6286 91.382 124.631 116.697 1.00 0.00 H ATOM 74823 H2 WAT 6286 90.081 125.080 116.066 1.00 0.00 H TER 74825 WAT 6286 ATOM 74825 O WAT 6287 16.233 57.270 138.341 1.00 0.00 O ATOM 74826 H1 WAT 6287 15.614 56.601 138.634 1.00 0.00 H ATOM 74827 H2 WAT 6287 16.145 57.277 137.388 1.00 0.00 H TER 74829 WAT 6287 ATOM 74829 O WAT 6288 1.643 37.889 55.937 1.00 0.00 O ATOM 74830 H1 WAT 6288 1.109 38.682 55.912 1.00 0.00 H ATOM 74831 H2 WAT 6288 1.059 37.196 55.629 1.00 0.00 H TER 74833 WAT 6288 ATOM 74833 O WAT 6289 14.558 117.104 110.927 1.00 0.00 O ATOM 74834 H1 WAT 6289 14.335 117.797 110.305 1.00 0.00 H ATOM 74835 H2 WAT 6289 14.828 116.368 110.379 1.00 0.00 H TER 74837 WAT 6289 ATOM 74837 O WAT 6290 72.864 99.845 56.018 1.00 0.00 O ATOM 74838 H1 WAT 6290 72.906 100.642 56.547 1.00 0.00 H ATOM 74839 H2 WAT 6290 72.227 100.047 55.332 1.00 0.00 H TER 74841 WAT 6290 ATOM 74841 O WAT 6291 95.794 5.822 100.016 1.00 0.00 O ATOM 74842 H1 WAT 6291 95.404 5.190 99.413 1.00 0.00 H ATOM 74843 H2 WAT 6291 95.377 5.639 100.858 1.00 0.00 H TER 74845 WAT 6291 ATOM 74845 O WAT 6292 57.082 112.481 87.315 1.00 0.00 O ATOM 74846 H1 WAT 6292 56.831 112.226 88.203 1.00 0.00 H ATOM 74847 H2 WAT 6292 57.888 112.985 87.429 1.00 0.00 H TER 74849 WAT 6292 ATOM 74849 O WAT 6293 88.426 28.611 140.546 1.00 0.00 O ATOM 74850 H1 WAT 6293 88.481 29.518 140.847 1.00 0.00 H ATOM 74851 H2 WAT 6293 88.837 28.620 139.682 1.00 0.00 H TER 74853 WAT 6293 ATOM 74853 O WAT 6294 20.036 20.907 114.185 1.00 0.00 O ATOM 74854 H1 WAT 6294 20.693 21.509 114.534 1.00 0.00 H ATOM 74855 H2 WAT 6294 19.301 20.976 114.795 1.00 0.00 H TER 74857 WAT 6294 ATOM 74857 O WAT 6295 19.660 61.510 143.342 1.00 0.00 O ATOM 74858 H1 WAT 6295 19.533 62.425 143.594 1.00 0.00 H ATOM 74859 H2 WAT 6295 19.158 61.413 142.532 1.00 0.00 H TER 74861 WAT 6295 ATOM 74861 O WAT 6296 122.055 30.590 6.192 1.00 0.00 O ATOM 74862 H1 WAT 6296 122.136 29.679 6.474 1.00 0.00 H ATOM 74863 H2 WAT 6296 121.517 31.004 6.866 1.00 0.00 H TER 74865 WAT 6296 ATOM 74865 O WAT 6297 83.246 55.433 101.008 1.00 0.00 O ATOM 74866 H1 WAT 6297 82.487 55.540 101.581 1.00 0.00 H ATOM 74867 H2 WAT 6297 83.725 56.258 101.089 1.00 0.00 H TER 74869 WAT 6297 ATOM 74869 O WAT 6298 133.956 98.684 149.098 1.00 0.00 O ATOM 74870 H1 WAT 6298 133.324 98.092 149.506 1.00 0.00 H ATOM 74871 H2 WAT 6298 133.845 99.512 149.566 1.00 0.00 H TER 74873 WAT 6298 ATOM 74873 O WAT 6299 128.483 128.040 135.215 1.00 0.00 O ATOM 74874 H1 WAT 6299 129.122 127.328 135.199 1.00 0.00 H ATOM 74875 H2 WAT 6299 128.831 128.689 134.603 1.00 0.00 H TER 74877 WAT 6299 ATOM 74877 O WAT 6300 5.024 71.354 78.310 1.00 0.00 O ATOM 74878 H1 WAT 6300 4.771 70.478 78.601 1.00 0.00 H ATOM 74879 H2 WAT 6300 4.547 71.480 77.489 1.00 0.00 H TER 74881 WAT 6300 ATOM 74881 O WAT 6301 93.239 128.289 106.330 1.00 0.00 O ATOM 74882 H1 WAT 6301 93.146 129.226 106.503 1.00 0.00 H ATOM 74883 H2 WAT 6301 92.468 127.892 106.735 1.00 0.00 H TER 74885 WAT 6301 ATOM 74885 O WAT 6302 60.544 118.713 10.837 1.00 0.00 O ATOM 74886 H1 WAT 6302 60.354 118.714 11.775 1.00 0.00 H ATOM 74887 H2 WAT 6302 60.802 119.614 10.644 1.00 0.00 H TER 74889 WAT 6302 ATOM 74889 O WAT 6303 73.172 120.881 81.229 1.00 0.00 O ATOM 74890 H1 WAT 6303 74.056 120.610 81.478 1.00 0.00 H ATOM 74891 H2 WAT 6303 72.621 120.129 81.444 1.00 0.00 H TER 74893 WAT 6303 ATOM 74893 O WAT 6304 110.829 48.799 117.638 1.00 0.00 O ATOM 74894 H1 WAT 6304 110.505 48.439 118.463 1.00 0.00 H ATOM 74895 H2 WAT 6304 110.637 48.122 116.989 1.00 0.00 H TER 74897 WAT 6304 ATOM 74897 O WAT 6305 76.004 89.191 64.633 1.00 0.00 O ATOM 74898 H1 WAT 6305 75.679 89.234 63.734 1.00 0.00 H ATOM 74899 H2 WAT 6305 76.954 89.277 64.549 1.00 0.00 H TER 74901 WAT 6305 ATOM 74901 O WAT 6306 126.509 127.346 13.743 1.00 0.00 O ATOM 74902 H1 WAT 6306 125.745 127.897 13.577 1.00 0.00 H ATOM 74903 H2 WAT 6306 127.256 127.890 13.494 1.00 0.00 H TER 74905 WAT 6306 ATOM 74905 O WAT 6307 112.417 121.687 119.596 1.00 0.00 O ATOM 74906 H1 WAT 6307 112.243 120.994 118.959 1.00 0.00 H ATOM 74907 H2 WAT 6307 113.327 121.938 119.434 1.00 0.00 H TER 74909 WAT 6307 ATOM 74909 O WAT 6308 67.328 67.876 148.995 1.00 0.00 O ATOM 74910 H1 WAT 6308 67.839 67.485 148.286 1.00 0.00 H ATOM 74911 H2 WAT 6308 67.468 67.293 149.741 1.00 0.00 H TER 74913 WAT 6308 ATOM 74913 O WAT 6309 92.509 38.229 65.925 1.00 0.00 O ATOM 74914 H1 WAT 6309 92.147 38.916 65.365 1.00 0.00 H ATOM 74915 H2 WAT 6309 91.792 38.001 66.518 1.00 0.00 H TER 74917 WAT 6309 ATOM 74917 O WAT 6310 58.896 19.928 110.218 1.00 0.00 O ATOM 74918 H1 WAT 6310 57.963 19.817 110.036 1.00 0.00 H ATOM 74919 H2 WAT 6310 59.071 19.328 110.944 1.00 0.00 H TER 74921 WAT 6310 ATOM 74921 O WAT 6311 136.668 36.268 151.557 1.00 0.00 O ATOM 74922 H1 WAT 6311 136.554 36.118 152.496 1.00 0.00 H ATOM 74923 H2 WAT 6311 136.039 36.959 151.347 1.00 0.00 H TER 74925 WAT 6311 ATOM 74925 O WAT 6312 103.257 44.210 1.552 1.00 0.00 O ATOM 74926 H1 WAT 6312 102.305 44.291 1.493 1.00 0.00 H ATOM 74927 H2 WAT 6312 103.422 43.986 2.468 1.00 0.00 H TER 74929 WAT 6312 ATOM 74929 O WAT 6313 30.415 4.201 5.226 1.00 0.00 O ATOM 74930 H1 WAT 6313 29.481 4.230 5.015 1.00 0.00 H ATOM 74931 H2 WAT 6313 30.443 4.161 6.182 1.00 0.00 H TER 74933 WAT 6313 ATOM 74933 O WAT 6314 55.213 28.903 80.546 1.00 0.00 O ATOM 74934 H1 WAT 6314 54.795 29.722 80.813 1.00 0.00 H ATOM 74935 H2 WAT 6314 56.085 28.940 80.940 1.00 0.00 H TER 74937 WAT 6314 ATOM 74937 O WAT 6315 111.051 6.113 122.330 1.00 0.00 O ATOM 74938 H1 WAT 6315 110.497 5.809 123.049 1.00 0.00 H ATOM 74939 H2 WAT 6315 110.509 6.006 121.548 1.00 0.00 H TER 74941 WAT 6315 ATOM 74941 O WAT 6316 38.042 29.469 99.123 1.00 0.00 O ATOM 74942 H1 WAT 6316 37.483 28.905 99.658 1.00 0.00 H ATOM 74943 H2 WAT 6316 38.096 29.022 98.279 1.00 0.00 H TER 74945 WAT 6316 ATOM 74945 O WAT 6317 85.461 97.924 150.207 1.00 0.00 O ATOM 74946 H1 WAT 6317 86.254 98.173 149.731 1.00 0.00 H ATOM 74947 H2 WAT 6317 84.886 97.555 149.536 1.00 0.00 H TER 74949 WAT 6317 ATOM 74949 O WAT 6318 94.799 65.815 3.757 1.00 0.00 O ATOM 74950 H1 WAT 6318 94.289 65.051 3.489 1.00 0.00 H ATOM 74951 H2 WAT 6318 95.711 65.532 3.682 1.00 0.00 H TER 74953 WAT 6318 ATOM 74953 O WAT 6319 75.269 115.838 143.898 1.00 0.00 O ATOM 74954 H1 WAT 6319 75.106 115.791 142.956 1.00 0.00 H ATOM 74955 H2 WAT 6319 74.850 115.054 144.254 1.00 0.00 H TER 74957 WAT 6319 ATOM 74957 O WAT 6320 140.904 131.233 6.635 1.00 0.00 O ATOM 74958 H1 WAT 6320 141.667 130.655 6.653 1.00 0.00 H ATOM 74959 H2 WAT 6320 140.612 131.273 7.545 1.00 0.00 H TER 74961 WAT 6320 ATOM 74961 O WAT 6321 71.654 45.606 108.805 1.00 0.00 O ATOM 74962 H1 WAT 6321 72.272 46.196 109.237 1.00 0.00 H ATOM 74963 H2 WAT 6321 71.081 46.186 108.303 1.00 0.00 H TER 74965 WAT 6321 ATOM 74965 O WAT 6322 59.256 73.752 96.555 1.00 0.00 O ATOM 74966 H1 WAT 6322 58.454 73.803 97.076 1.00 0.00 H ATOM 74967 H2 WAT 6322 59.831 74.415 96.937 1.00 0.00 H TER 74969 WAT 6322 ATOM 74969 O WAT 6323 83.397 12.157 13.659 1.00 0.00 O ATOM 74970 H1 WAT 6323 84.336 12.274 13.510 1.00 0.00 H ATOM 74971 H2 WAT 6323 83.308 12.131 14.612 1.00 0.00 H TER 74973 WAT 6323 ATOM 74973 O WAT 6324 62.116 98.545 12.865 1.00 0.00 O ATOM 74974 H1 WAT 6324 63.021 98.438 12.573 1.00 0.00 H ATOM 74975 H2 WAT 6324 62.181 99.082 13.655 1.00 0.00 H TER 74977 WAT 6324 ATOM 74977 O WAT 6325 12.147 125.220 6.649 1.00 0.00 O ATOM 74978 H1 WAT 6325 11.845 124.318 6.754 1.00 0.00 H ATOM 74979 H2 WAT 6325 12.156 125.574 7.538 1.00 0.00 H TER 74981 WAT 6325 ATOM 74981 O WAT 6326 21.459 7.676 134.808 1.00 0.00 O ATOM 74982 H1 WAT 6326 21.518 7.626 135.762 1.00 0.00 H ATOM 74983 H2 WAT 6326 20.642 8.148 134.643 1.00 0.00 H TER 74985 WAT 6326 ATOM 74985 O WAT 6327 99.410 131.486 126.237 1.00 0.00 O ATOM 74986 H1 WAT 6327 99.658 132.367 125.956 1.00 0.00 H ATOM 74987 H2 WAT 6327 99.900 131.347 127.048 1.00 0.00 H TER 74989 WAT 6327 ATOM 74989 O WAT 6328 38.757 119.974 108.271 1.00 0.00 O ATOM 74990 H1 WAT 6328 39.292 120.450 107.636 1.00 0.00 H ATOM 74991 H2 WAT 6328 37.859 120.246 108.080 1.00 0.00 H TER 74993 WAT 6328 ATOM 74993 O WAT 6329 120.873 118.899 108.244 1.00 0.00 O ATOM 74994 H1 WAT 6329 121.493 119.550 108.572 1.00 0.00 H ATOM 74995 H2 WAT 6329 120.267 118.757 108.971 1.00 0.00 H TER 74997 WAT 6329 ATOM 74997 O WAT 6330 119.706 140.044 77.618 1.00 0.00 O ATOM 74998 H1 WAT 6330 119.229 139.274 77.930 1.00 0.00 H ATOM 74999 H2 WAT 6330 120.447 140.126 78.218 1.00 0.00 H TER 75001 WAT 6330 ATOM 75001 O WAT 6331 133.304 24.131 3.533 1.00 0.00 O ATOM 75002 H1 WAT 6331 133.963 23.437 3.530 1.00 0.00 H ATOM 75003 H2 WAT 6331 133.157 24.326 2.608 1.00 0.00 H TER 75005 WAT 6331 ATOM 75005 O WAT 6332 82.399 137.898 70.755 1.00 0.00 O ATOM 75006 H1 WAT 6332 81.645 138.374 70.408 1.00 0.00 H ATOM 75007 H2 WAT 6332 82.055 137.032 70.975 1.00 0.00 H TER 75009 WAT 6332 ATOM 75009 O WAT 6333 12.442 2.379 112.632 1.00 0.00 O ATOM 75010 H1 WAT 6333 13.071 2.872 112.105 1.00 0.00 H ATOM 75011 H2 WAT 6333 12.336 1.550 112.165 1.00 0.00 H TER 75013 WAT 6333 ATOM 75013 O WAT 6334 44.101 83.027 82.179 1.00 0.00 O ATOM 75014 H1 WAT 6334 44.097 82.073 82.104 1.00 0.00 H ATOM 75015 H2 WAT 6334 45.028 83.265 82.161 1.00 0.00 H TER 75017 WAT 6334 ATOM 75017 O WAT 6335 145.097 134.793 19.955 1.00 0.00 O ATOM 75018 H1 WAT 6335 145.321 133.957 19.546 1.00 0.00 H ATOM 75019 H2 WAT 6335 144.839 134.560 20.847 1.00 0.00 H TER 75021 WAT 6335 ATOM 75021 O WAT 6336 43.508 79.041 158.252 1.00 0.00 O ATOM 75022 H1 WAT 6336 43.942 78.381 158.793 1.00 0.00 H ATOM 75023 H2 WAT 6336 42.727 79.283 158.750 1.00 0.00 H TER 75025 WAT 6336 ATOM 75025 O WAT 6337 124.272 55.324 4.750 1.00 0.00 O ATOM 75026 H1 WAT 6337 124.348 54.850 3.923 1.00 0.00 H ATOM 75027 H2 WAT 6337 123.391 55.119 5.064 1.00 0.00 H TER 75029 WAT 6337 ATOM 75029 O WAT 6338 58.745 108.343 10.576 1.00 0.00 O ATOM 75030 H1 WAT 6338 58.701 108.575 9.649 1.00 0.00 H ATOM 75031 H2 WAT 6338 58.847 109.181 11.028 1.00 0.00 H TER 75033 WAT 6338 ATOM 75033 O WAT 6339 78.154 51.016 145.779 1.00 0.00 O ATOM 75034 H1 WAT 6339 78.197 51.967 145.874 1.00 0.00 H ATOM 75035 H2 WAT 6339 79.067 50.743 145.686 1.00 0.00 H TER 75037 WAT 6339 ATOM 75037 O WAT 6340 102.302 134.428 108.744 1.00 0.00 O ATOM 75038 H1 WAT 6340 102.145 135.356 108.572 1.00 0.00 H ATOM 75039 H2 WAT 6340 101.887 133.975 108.010 1.00 0.00 H TER 75041 WAT 6340 ATOM 75041 O WAT 6341 93.215 43.072 16.180 1.00 0.00 O ATOM 75042 H1 WAT 6341 94.062 43.475 15.991 1.00 0.00 H ATOM 75043 H2 WAT 6341 93.273 42.812 17.099 1.00 0.00 H TER 75045 WAT 6341 ATOM 75045 O WAT 6342 116.384 23.313 56.904 1.00 0.00 O ATOM 75046 H1 WAT 6342 116.014 23.228 56.026 1.00 0.00 H ATOM 75047 H2 WAT 6342 116.494 24.256 57.028 1.00 0.00 H TER 75049 WAT 6342 ATOM 75049 O WAT 6343 80.364 4.904 10.881 1.00 0.00 O ATOM 75050 H1 WAT 6343 80.456 5.844 11.036 1.00 0.00 H ATOM 75051 H2 WAT 6343 79.653 4.835 10.244 1.00 0.00 H TER 75053 WAT 6343 ATOM 75053 O WAT 6344 86.612 61.541 17.255 1.00 0.00 O ATOM 75054 H1 WAT 6344 85.711 61.510 16.934 1.00 0.00 H ATOM 75055 H2 WAT 6344 86.529 61.755 18.184 1.00 0.00 H TER 75057 WAT 6344 ATOM 75057 O WAT 6345 82.412 40.389 0.936 1.00 0.00 O ATOM 75058 H1 WAT 6345 82.106 40.589 1.820 1.00 0.00 H ATOM 75059 H2 WAT 6345 82.825 39.529 1.013 1.00 0.00 H TER 75061 WAT 6345 ATOM 75061 O WAT 6346 105.608 87.190 5.605 1.00 0.00 O ATOM 75062 H1 WAT 6346 105.940 87.575 4.793 1.00 0.00 H ATOM 75063 H2 WAT 6346 106.392 86.898 6.069 1.00 0.00 H TER 75065 WAT 6346 ATOM 75065 O WAT 6347 71.629 108.386 3.875 1.00 0.00 O ATOM 75066 H1 WAT 6347 70.941 108.044 3.303 1.00 0.00 H ATOM 75067 H2 WAT 6347 71.633 109.328 3.708 1.00 0.00 H TER 75069 WAT 6347 ATOM 75069 O WAT 6348 68.907 22.392 64.885 1.00 0.00 O ATOM 75070 H1 WAT 6348 67.956 22.500 64.901 1.00 0.00 H ATOM 75071 H2 WAT 6348 69.170 22.710 64.022 1.00 0.00 H TER 75073 WAT 6348 ATOM 75073 O WAT 6349 42.072 121.682 13.497 1.00 0.00 O ATOM 75074 H1 WAT 6349 41.190 121.710 13.126 1.00 0.00 H ATOM 75075 H2 WAT 6349 41.960 121.256 14.348 1.00 0.00 H TER 75077 WAT 6349 ATOM 75077 O WAT 6350 100.406 33.428 130.647 1.00 0.00 O ATOM 75078 H1 WAT 6350 101.145 33.948 130.964 1.00 0.00 H ATOM 75079 H2 WAT 6350 99.754 34.077 130.381 1.00 0.00 H TER 75081 WAT 6350 ATOM 75081 O WAT 6351 131.600 101.361 88.060 1.00 0.00 O ATOM 75082 H1 WAT 6351 132.420 101.017 88.414 1.00 0.00 H ATOM 75083 H2 WAT 6351 130.926 100.773 88.401 1.00 0.00 H TER 75085 WAT 6351 ATOM 75085 O WAT 6352 130.834 61.406 154.996 1.00 0.00 O ATOM 75086 H1 WAT 6352 131.318 61.215 155.800 1.00 0.00 H ATOM 75087 H2 WAT 6352 130.723 60.553 154.575 1.00 0.00 H TER 75089 WAT 6352 ATOM 75089 O WAT 6353 32.368 83.917 82.994 1.00 0.00 O ATOM 75090 H1 WAT 6353 31.853 84.140 82.219 1.00 0.00 H ATOM 75091 H2 WAT 6353 32.176 82.992 83.150 1.00 0.00 H TER 75093 WAT 6353 ATOM 75093 O WAT 6354 101.171 103.481 79.823 1.00 0.00 O ATOM 75094 H1 WAT 6354 101.792 104.209 79.827 1.00 0.00 H ATOM 75095 H2 WAT 6354 100.438 103.787 80.358 1.00 0.00 H TER 75097 WAT 6354 ATOM 75097 O WAT 6355 93.316 79.839 73.269 1.00 0.00 O ATOM 75098 H1 WAT 6355 92.495 79.854 73.760 1.00 0.00 H ATOM 75099 H2 WAT 6355 93.740 80.670 73.486 1.00 0.00 H TER 75101 WAT 6355 ATOM 75101 O WAT 6356 7.169 21.298 92.728 1.00 0.00 O ATOM 75102 H1 WAT 6356 7.099 20.522 93.285 1.00 0.00 H ATOM 75103 H2 WAT 6356 6.322 21.351 92.285 1.00 0.00 H TER 75105 WAT 6356 ATOM 75105 O WAT 6357 38.806 48.499 56.669 1.00 0.00 O ATOM 75106 H1 WAT 6357 38.894 48.153 55.780 1.00 0.00 H ATOM 75107 H2 WAT 6357 39.383 47.948 57.198 1.00 0.00 H TER 75109 WAT 6357 ATOM 75109 O WAT 6358 76.895 138.523 75.856 1.00 0.00 O ATOM 75110 H1 WAT 6358 77.112 137.677 76.246 1.00 0.00 H ATOM 75111 H2 WAT 6358 76.382 138.972 76.528 1.00 0.00 H TER 75113 WAT 6358 ATOM 75113 O WAT 6359 26.552 46.433 1.229 1.00 0.00 O ATOM 75114 H1 WAT 6359 26.233 45.912 1.966 1.00 0.00 H ATOM 75115 H2 WAT 6359 27.501 46.460 1.347 1.00 0.00 H TER 75117 WAT 6359 ATOM 75117 O WAT 6360 72.375 116.019 14.226 1.00 0.00 O ATOM 75118 H1 WAT 6360 72.107 115.272 13.690 1.00 0.00 H ATOM 75119 H2 WAT 6360 71.627 116.615 14.195 1.00 0.00 H TER 75121 WAT 6360 ATOM 75121 O WAT 6361 122.969 32.709 68.993 1.00 0.00 O ATOM 75122 H1 WAT 6361 123.711 33.282 68.801 1.00 0.00 H ATOM 75123 H2 WAT 6361 122.224 33.304 69.083 1.00 0.00 H TER 75125 WAT 6361 ATOM 75125 O WAT 6362 20.776 33.699 94.899 1.00 0.00 O ATOM 75126 H1 WAT 6362 21.558 33.214 95.162 1.00 0.00 H ATOM 75127 H2 WAT 6362 21.094 34.340 94.264 1.00 0.00 H TER 75129 WAT 6362 ATOM 75129 O WAT 6363 26.108 46.421 86.305 1.00 0.00 O ATOM 75130 H1 WAT 6363 26.651 46.307 85.525 1.00 0.00 H ATOM 75131 H2 WAT 6363 25.356 46.930 86.002 1.00 0.00 H TER 75133 WAT 6363 ATOM 75133 O WAT 6364 12.345 113.229 53.409 1.00 0.00 O ATOM 75134 H1 WAT 6364 12.336 112.342 53.052 1.00 0.00 H ATOM 75135 H2 WAT 6364 11.741 113.195 54.151 1.00 0.00 H TER 75137 WAT 6364 ATOM 75137 O WAT 6365 57.360 77.667 93.694 1.00 0.00 O ATOM 75138 H1 WAT 6365 57.209 78.118 94.525 1.00 0.00 H ATOM 75139 H2 WAT 6365 56.629 77.054 93.618 1.00 0.00 H TER 75141 WAT 6365 ATOM 75141 O WAT 6366 117.966 53.232 113.291 1.00 0.00 O ATOM 75142 H1 WAT 6366 118.669 53.871 113.180 1.00 0.00 H ATOM 75143 H2 WAT 6366 117.434 53.583 114.005 1.00 0.00 H TER 75145 WAT 6366 ATOM 75145 O WAT 6367 9.758 143.644 97.928 1.00 0.00 O ATOM 75146 H1 WAT 6367 8.836 143.559 98.170 1.00 0.00 H ATOM 75147 H2 WAT 6367 9.841 143.139 97.120 1.00 0.00 H TER 75149 WAT 6367 ATOM 75149 O WAT 6368 129.859 145.836 4.636 1.00 0.00 O ATOM 75150 H1 WAT 6368 130.413 145.963 5.406 1.00 0.00 H ATOM 75151 H2 WAT 6368 129.623 144.909 4.661 1.00 0.00 H TER 75153 WAT 6368 ATOM 75153 O WAT 6369 29.603 69.955 105.800 1.00 0.00 O ATOM 75154 H1 WAT 6369 29.832 70.779 105.369 1.00 0.00 H ATOM 75155 H2 WAT 6369 28.647 69.925 105.766 1.00 0.00 H TER 75157 WAT 6369 ATOM 75157 O WAT 6370 61.711 40.417 83.375 1.00 0.00 O ATOM 75158 H1 WAT 6370 60.825 40.275 83.040 1.00 0.00 H ATOM 75159 H2 WAT 6370 61.683 40.086 84.272 1.00 0.00 H TER 75161 WAT 6370 ATOM 75161 O WAT 6371 121.817 0.590 71.631 1.00 0.00 O ATOM 75162 H1 WAT 6371 121.476 0.831 70.770 1.00 0.00 H ATOM 75163 H2 WAT 6371 121.058 0.645 72.213 1.00 0.00 H TER 75165 WAT 6371 ATOM 75165 O WAT 6372 125.871 71.480 74.315 1.00 0.00 O ATOM 75166 H1 WAT 6372 126.825 71.518 74.382 1.00 0.00 H ATOM 75167 H2 WAT 6372 125.704 70.821 73.642 1.00 0.00 H TER 75169 WAT 6372 ATOM 75169 O WAT 6373 87.679 26.852 153.950 1.00 0.00 O ATOM 75170 H1 WAT 6373 88.106 27.252 154.708 1.00 0.00 H ATOM 75171 H2 WAT 6373 88.266 27.040 153.217 1.00 0.00 H TER 75173 WAT 6373 ATOM 75173 O WAT 6374 102.813 27.870 139.610 1.00 0.00 O ATOM 75174 H1 WAT 6374 102.655 27.462 138.759 1.00 0.00 H ATOM 75175 H2 WAT 6374 103.701 28.221 139.546 1.00 0.00 H TER 75177 WAT 6374 ATOM 75177 O WAT 6375 109.586 92.477 137.640 1.00 0.00 O ATOM 75178 H1 WAT 6375 109.930 92.906 138.423 1.00 0.00 H ATOM 75179 H2 WAT 6375 108.693 92.228 137.876 1.00 0.00 H TER 75181 WAT 6375 ATOM 75181 O WAT 6376 2.570 43.524 135.455 1.00 0.00 O ATOM 75182 H1 WAT 6376 2.515 44.088 134.684 1.00 0.00 H ATOM 75183 H2 WAT 6376 2.149 42.708 135.186 1.00 0.00 H TER 75185 WAT 6376 ATOM 75185 O WAT 6377 4.744 19.206 71.553 1.00 0.00 O ATOM 75186 H1 WAT 6377 5.108 19.222 70.668 1.00 0.00 H ATOM 75187 H2 WAT 6377 5.368 19.708 72.078 1.00 0.00 H TER 75189 WAT 6377 ATOM 75189 O WAT 6378 0.444 19.974 154.422 1.00 0.00 O ATOM 75190 H1 WAT 6378 0.443 19.167 153.907 1.00 0.00 H ATOM 75191 H2 WAT 6378 0.214 19.694 155.307 1.00 0.00 H TER 75193 WAT 6378 ATOM 75193 O WAT 6379 25.794 54.937 135.494 1.00 0.00 O ATOM 75194 H1 WAT 6379 24.988 55.021 136.003 1.00 0.00 H ATOM 75195 H2 WAT 6379 25.539 54.432 134.722 1.00 0.00 H TER 75197 WAT 6379 ATOM 75197 O WAT 6380 93.070 144.078 137.147 1.00 0.00 O ATOM 75198 H1 WAT 6380 92.464 144.483 137.767 1.00 0.00 H ATOM 75199 H2 WAT 6380 92.527 143.853 136.392 1.00 0.00 H TER 75201 WAT 6380 ATOM 75201 O WAT 6381 88.667 54.513 0.582 1.00 0.00 O ATOM 75202 H1 WAT 6381 89.567 54.503 0.256 1.00 0.00 H ATOM 75203 H2 WAT 6381 88.134 54.700 -0.191 1.00 0.00 H TER 75205 WAT 6381 ATOM 75205 O WAT 6382 57.817 90.164 113.496 1.00 0.00 O ATOM 75206 H1 WAT 6382 58.281 90.032 112.669 1.00 0.00 H ATOM 75207 H2 WAT 6382 58.429 90.662 114.037 1.00 0.00 H TER 75209 WAT 6382 ATOM 75209 O WAT 6383 114.037 72.226 5.915 1.00 0.00 O ATOM 75210 H1 WAT 6383 113.223 72.435 5.456 1.00 0.00 H ATOM 75211 H2 WAT 6383 114.399 71.482 5.432 1.00 0.00 H TER 75213 WAT 6383 ATOM 75213 O WAT 6384 129.348 28.980 5.506 1.00 0.00 O ATOM 75214 H1 WAT 6384 128.655 28.529 5.987 1.00 0.00 H ATOM 75215 H2 WAT 6384 129.185 28.761 4.588 1.00 0.00 H TER 75217 WAT 6384 ATOM 75217 O WAT 6385 82.592 13.370 105.022 1.00 0.00 O ATOM 75218 H1 WAT 6385 82.250 13.483 104.136 1.00 0.00 H ATOM 75219 H2 WAT 6385 82.076 12.653 105.389 1.00 0.00 H TER 75221 WAT 6385 ATOM 75221 O WAT 6386 109.862 12.400 55.120 1.00 0.00 O ATOM 75222 H1 WAT 6386 110.082 13.049 54.452 1.00 0.00 H ATOM 75223 H2 WAT 6386 109.148 11.893 54.734 1.00 0.00 H TER 75225 WAT 6386 ATOM 75225 O WAT 6387 44.453 132.787 150.983 1.00 0.00 O ATOM 75226 H1 WAT 6387 44.506 132.602 151.921 1.00 0.00 H ATOM 75227 H2 WAT 6387 44.605 133.729 150.915 1.00 0.00 H TER 75229 WAT 6387 ATOM 75229 O WAT 6388 47.581 87.926 94.146 1.00 0.00 O ATOM 75230 H1 WAT 6388 47.568 86.993 93.934 1.00 0.00 H ATOM 75231 H2 WAT 6388 46.669 88.141 94.341 1.00 0.00 H TER 75233 WAT 6388 ATOM 75233 O WAT 6389 16.980 138.789 74.485 1.00 0.00 O ATOM 75234 H1 WAT 6389 17.590 138.051 74.501 1.00 0.00 H ATOM 75235 H2 WAT 6389 16.149 138.408 74.202 1.00 0.00 H TER 75237 WAT 6389 ATOM 75237 O WAT 6390 106.285 85.108 65.302 1.00 0.00 O ATOM 75238 H1 WAT 6390 107.110 84.664 65.497 1.00 0.00 H ATOM 75239 H2 WAT 6390 105.710 84.415 64.977 1.00 0.00 H TER 75241 WAT 6390 ATOM 75241 O WAT 6391 123.405 66.356 2.620 1.00 0.00 O ATOM 75242 H1 WAT 6391 124.015 66.406 1.885 1.00 0.00 H ATOM 75243 H2 WAT 6391 123.232 65.421 2.726 1.00 0.00 H TER 75245 WAT 6391 ATOM 75245 O WAT 6392 92.255 120.524 88.182 1.00 0.00 O ATOM 75246 H1 WAT 6392 92.242 119.629 87.844 1.00 0.00 H ATOM 75247 H2 WAT 6392 91.450 120.599 88.693 1.00 0.00 H TER 75249 WAT 6392 ATOM 75249 O WAT 6393 127.310 91.638 107.592 1.00 0.00 O ATOM 75250 H1 WAT 6393 126.840 91.347 108.374 1.00 0.00 H ATOM 75251 H2 WAT 6393 126.770 91.335 106.862 1.00 0.00 H TER 75253 WAT 6393 ATOM 75253 O WAT 6394 77.871 67.440 151.027 1.00 0.00 O ATOM 75254 H1 WAT 6394 77.424 66.805 151.587 1.00 0.00 H ATOM 75255 H2 WAT 6394 77.979 68.214 151.581 1.00 0.00 H TER 75257 WAT 6394 ATOM 75257 O WAT 6395 39.295 101.896 133.571 1.00 0.00 O ATOM 75258 H1 WAT 6395 39.480 102.810 133.353 1.00 0.00 H ATOM 75259 H2 WAT 6395 39.505 101.413 132.771 1.00 0.00 H TER 75261 WAT 6395 ATOM 75261 O WAT 6396 76.784 27.040 81.627 1.00 0.00 O ATOM 75262 H1 WAT 6396 77.208 26.499 80.962 1.00 0.00 H ATOM 75263 H2 WAT 6396 76.945 27.940 81.344 1.00 0.00 H TER 75265 WAT 6396 ATOM 75265 O WAT 6397 48.844 23.031 97.780 1.00 0.00 O ATOM 75266 H1 WAT 6397 49.164 22.400 97.135 1.00 0.00 H ATOM 75267 H2 WAT 6397 47.965 22.721 98.002 1.00 0.00 H TER 75269 WAT 6397 ATOM 75269 O WAT 6398 119.448 142.097 117.218 1.00 0.00 O ATOM 75270 H1 WAT 6398 118.501 142.147 117.352 1.00 0.00 H ATOM 75271 H2 WAT 6398 119.625 142.732 116.523 1.00 0.00 H TER 75273 WAT 6398 ATOM 75273 O WAT 6399 134.456 134.696 17.230 1.00 0.00 O ATOM 75274 H1 WAT 6399 134.826 134.246 17.989 1.00 0.00 H ATOM 75275 H2 WAT 6399 133.951 135.419 17.602 1.00 0.00 H TER 75277 WAT 6399 ATOM 75277 O WAT 6400 119.345 68.512 141.281 1.00 0.00 O ATOM 75278 H1 WAT 6400 120.190 68.096 141.111 1.00 0.00 H ATOM 75279 H2 WAT 6400 119.384 69.338 140.800 1.00 0.00 H TER 75281 WAT 6400 ATOM 75281 O WAT 6401 40.626 28.677 100.841 1.00 0.00 O ATOM 75282 H1 WAT 6401 41.468 28.689 100.386 1.00 0.00 H ATOM 75283 H2 WAT 6401 40.005 28.358 100.186 1.00 0.00 H TER 75285 WAT 6401 ATOM 75285 O WAT 6402 97.926 145.842 128.503 1.00 0.00 O ATOM 75286 H1 WAT 6402 98.777 146.224 128.716 1.00 0.00 H ATOM 75287 H2 WAT 6402 98.124 144.937 128.260 1.00 0.00 H TER 75289 WAT 6402 ATOM 75289 O WAT 6403 61.332 28.233 151.844 1.00 0.00 O ATOM 75290 H1 WAT 6403 62.183 28.603 152.079 1.00 0.00 H ATOM 75291 H2 WAT 6403 61.530 27.343 151.551 1.00 0.00 H TER 75293 WAT 6403 ATOM 75293 O WAT 6404 1.418 41.903 11.948 1.00 0.00 O ATOM 75294 H1 WAT 6404 1.943 42.445 11.359 1.00 0.00 H ATOM 75295 H2 WAT 6404 1.293 42.445 12.726 1.00 0.00 H TER 75297 WAT 6404 ATOM 75297 O WAT 6405 10.347 128.845 154.510 1.00 0.00 O ATOM 75298 H1 WAT 6405 9.782 129.614 154.592 1.00 0.00 H ATOM 75299 H2 WAT 6405 11.107 129.047 155.055 1.00 0.00 H TER 75301 WAT 6405 ATOM 75301 O WAT 6406 35.914 102.261 144.838 1.00 0.00 O ATOM 75302 H1 WAT 6406 34.998 102.404 145.075 1.00 0.00 H ATOM 75303 H2 WAT 6406 36.037 102.775 144.040 1.00 0.00 H TER 75305 WAT 6406 ATOM 75305 O WAT 6407 94.156 78.863 126.060 1.00 0.00 O ATOM 75306 H1 WAT 6407 94.100 79.397 126.853 1.00 0.00 H ATOM 75307 H2 WAT 6407 95.068 78.574 126.031 1.00 0.00 H TER 75309 WAT 6407 ATOM 75309 O WAT 6408 63.875 69.353 0.296 1.00 0.00 O ATOM 75310 H1 WAT 6408 63.640 69.668 1.169 1.00 0.00 H ATOM 75311 H2 WAT 6408 63.035 69.201 -0.137 1.00 0.00 H TER 75313 WAT 6408 ATOM 75313 O WAT 6409 3.414 119.777 12.029 1.00 0.00 O ATOM 75314 H1 WAT 6409 2.459 119.831 12.017 1.00 0.00 H ATOM 75315 H2 WAT 6409 3.615 119.245 12.799 1.00 0.00 H TER 75317 WAT 6409 ATOM 75317 O WAT 6410 109.857 4.930 10.238 1.00 0.00 O ATOM 75318 H1 WAT 6410 109.054 5.005 10.753 1.00 0.00 H ATOM 75319 H2 WAT 6410 109.584 4.493 9.432 1.00 0.00 H TER 75321 WAT 6410 ATOM 75321 O WAT 6411 61.159 138.805 115.032 1.00 0.00 O ATOM 75322 H1 WAT 6411 60.794 138.993 114.167 1.00 0.00 H ATOM 75323 H2 WAT 6411 60.397 138.769 115.610 1.00 0.00 H TER 75325 WAT 6411 ATOM 75325 O WAT 6412 18.057 91.041 121.917 1.00 0.00 O ATOM 75326 H1 WAT 6412 17.743 91.417 121.095 1.00 0.00 H ATOM 75327 H2 WAT 6412 18.984 90.863 121.761 1.00 0.00 H TER 75329 WAT 6412 ATOM 75329 O WAT 6413 62.411 116.866 81.198 1.00 0.00 O ATOM 75330 H1 WAT 6413 62.307 116.527 80.309 1.00 0.00 H ATOM 75331 H2 WAT 6413 63.356 116.978 81.303 1.00 0.00 H TER 75333 WAT 6413 ATOM 75333 O WAT 6414 98.027 128.163 136.792 1.00 0.00 O ATOM 75334 H1 WAT 6414 98.086 129.077 136.513 1.00 0.00 H ATOM 75335 H2 WAT 6414 98.861 127.777 136.527 1.00 0.00 H TER 75337 WAT 6414 ATOM 75337 O WAT 6415 122.582 78.124 87.583 1.00 0.00 O ATOM 75338 H1 WAT 6415 122.015 78.265 88.342 1.00 0.00 H ATOM 75339 H2 WAT 6415 122.470 77.198 87.369 1.00 0.00 H TER 75341 WAT 6415 ATOM 75341 O WAT 6416 17.203 142.327 126.137 1.00 0.00 O ATOM 75342 H1 WAT 6416 17.004 142.696 125.276 1.00 0.00 H ATOM 75343 H2 WAT 6416 16.539 141.650 126.266 1.00 0.00 H TER 75345 WAT 6416 ATOM 75345 O WAT 6417 118.593 83.534 138.101 1.00 0.00 O ATOM 75346 H1 WAT 6417 118.512 83.461 137.150 1.00 0.00 H ATOM 75347 H2 WAT 6417 119.074 84.350 138.238 1.00 0.00 H TER 75349 WAT 6417 ATOM 75349 O WAT 6418 125.964 2.174 57.152 1.00 0.00 O ATOM 75350 H1 WAT 6418 125.733 2.788 57.849 1.00 0.00 H ATOM 75351 H2 WAT 6418 126.523 2.680 56.562 1.00 0.00 H TER 75353 WAT 6418 ATOM 75353 O WAT 6419 91.508 31.635 84.079 1.00 0.00 O ATOM 75354 H1 WAT 6419 92.233 32.072 84.526 1.00 0.00 H ATOM 75355 H2 WAT 6419 91.141 32.308 83.505 1.00 0.00 H TER 75357 WAT 6419 ATOM 75357 O WAT 6420 121.005 107.660 149.609 1.00 0.00 O ATOM 75358 H1 WAT 6420 120.789 107.762 150.536 1.00 0.00 H ATOM 75359 H2 WAT 6420 121.900 107.322 149.607 1.00 0.00 H TER 75361 WAT 6420 ATOM 75361 O WAT 6421 87.497 69.729 12.888 1.00 0.00 O ATOM 75362 H1 WAT 6421 87.212 69.288 12.088 1.00 0.00 H ATOM 75363 H2 WAT 6421 88.178 69.159 13.246 1.00 0.00 H TER 75365 WAT 6421 ATOM 75365 O WAT 6422 126.254 16.492 76.919 1.00 0.00 O ATOM 75366 H1 WAT 6422 126.672 17.214 76.449 1.00 0.00 H ATOM 75367 H2 WAT 6422 126.033 16.860 77.775 1.00 0.00 H TER 75369 WAT 6422 ATOM 75369 O WAT 6423 91.409 107.583 99.174 1.00 0.00 O ATOM 75370 H1 WAT 6423 91.020 108.450 99.060 1.00 0.00 H ATOM 75371 H2 WAT 6423 91.076 107.281 100.019 1.00 0.00 H TER 75373 WAT 6423 ATOM 75373 O WAT 6424 107.952 51.728 102.395 1.00 0.00 O ATOM 75374 H1 WAT 6424 107.066 51.443 102.170 1.00 0.00 H ATOM 75375 H2 WAT 6424 107.897 52.683 102.424 1.00 0.00 H TER 75377 WAT 6424 ATOM 75377 O WAT 6425 88.320 58.819 20.707 1.00 0.00 O ATOM 75378 H1 WAT 6425 88.560 57.906 20.548 1.00 0.00 H ATOM 75379 H2 WAT 6425 87.364 58.828 20.657 1.00 0.00 H TER 75381 WAT 6425 ATOM 75381 O WAT 6426 39.092 90.107 126.439 1.00 0.00 O ATOM 75382 H1 WAT 6426 38.146 90.211 126.343 1.00 0.00 H ATOM 75383 H2 WAT 6426 39.447 90.979 126.265 1.00 0.00 H TER 75385 WAT 6426 ATOM 75385 O WAT 6427 101.281 19.460 155.610 1.00 0.00 O ATOM 75386 H1 WAT 6427 101.405 19.953 156.421 1.00 0.00 H ATOM 75387 H2 WAT 6427 100.334 19.463 155.471 1.00 0.00 H TER 75389 WAT 6427 ATOM 75389 O WAT 6428 26.538 19.557 145.098 1.00 0.00 O ATOM 75390 H1 WAT 6428 26.308 20.436 144.796 1.00 0.00 H ATOM 75391 H2 WAT 6428 27.304 19.689 145.657 1.00 0.00 H TER 75393 WAT 6428 ATOM 75393 O WAT 6429 138.823 76.934 60.219 1.00 0.00 O ATOM 75394 H1 WAT 6429 138.831 76.183 59.626 1.00 0.00 H ATOM 75395 H2 WAT 6429 139.200 77.649 59.705 1.00 0.00 H TER 75397 WAT 6429 ATOM 75397 O WAT 6430 91.276 98.121 68.168 1.00 0.00 O ATOM 75398 H1 WAT 6430 91.886 98.073 67.432 1.00 0.00 H ATOM 75399 H2 WAT 6430 91.822 97.982 68.942 1.00 0.00 H TER 75401 WAT 6430 ATOM 75401 O WAT 6431 51.976 91.895 100.114 1.00 0.00 O ATOM 75402 H1 WAT 6431 51.107 91.497 100.152 1.00 0.00 H ATOM 75403 H2 WAT 6431 52.228 91.833 99.192 1.00 0.00 H TER 75405 WAT 6431 ATOM 75405 O WAT 6432 9.671 88.961 63.685 1.00 0.00 O ATOM 75406 H1 WAT 6432 9.539 89.440 62.867 1.00 0.00 H ATOM 75407 H2 WAT 6432 9.172 88.152 63.572 1.00 0.00 H TER 75409 WAT 6432 ATOM 75409 O WAT 6433 20.526 42.082 65.405 1.00 0.00 O ATOM 75410 H1 WAT 6433 19.643 42.152 65.767 1.00 0.00 H ATOM 75411 H2 WAT 6433 20.619 42.854 64.847 1.00 0.00 H TER 75413 WAT 6433 ATOM 75413 O WAT 6434 140.965 87.655 71.946 1.00 0.00 O ATOM 75414 H1 WAT 6434 141.391 86.838 71.688 1.00 0.00 H ATOM 75415 H2 WAT 6434 140.041 87.423 72.044 1.00 0.00 H TER 75417 WAT 6434 ATOM 75417 O WAT 6435 2.016 63.451 61.445 1.00 0.00 O ATOM 75418 H1 WAT 6435 1.766 63.627 60.538 1.00 0.00 H ATOM 75419 H2 WAT 6435 2.855 62.995 61.378 1.00 0.00 H TER 75421 WAT 6435 ATOM 75421 O WAT 6436 63.221 0.918 96.172 1.00 0.00 O ATOM 75422 H1 WAT 6436 63.417 0.118 96.658 1.00 0.00 H ATOM 75423 H2 WAT 6436 64.062 1.184 95.798 1.00 0.00 H TER 75425 WAT 6436 ATOM 75425 O WAT 6437 20.563 51.961 158.541 1.00 0.00 O ATOM 75426 H1 WAT 6437 20.465 52.862 158.849 1.00 0.00 H ATOM 75427 H2 WAT 6437 20.008 51.912 157.762 1.00 0.00 H TER 75429 WAT 6437 ATOM 75429 O WAT 6438 39.261 24.186 140.169 1.00 0.00 O ATOM 75430 H1 WAT 6438 39.124 23.461 139.559 1.00 0.00 H ATOM 75431 H2 WAT 6438 39.846 23.828 140.838 1.00 0.00 H TER 75433 WAT 6438 ATOM 75433 O WAT 6439 109.472 111.008 94.464 1.00 0.00 O ATOM 75434 H1 WAT 6439 109.355 111.108 95.409 1.00 0.00 H ATOM 75435 H2 WAT 6439 109.392 110.067 94.311 1.00 0.00 H TER 75437 WAT 6439 ATOM 75437 O WAT 6440 143.259 30.979 144.410 1.00 0.00 O ATOM 75438 H1 WAT 6440 143.866 30.543 143.812 1.00 0.00 H ATOM 75439 H2 WAT 6440 143.809 31.576 144.917 1.00 0.00 H TER 75441 WAT 6440 ATOM 75441 O WAT 6441 18.559 78.941 113.359 1.00 0.00 O ATOM 75442 H1 WAT 6441 19.425 79.329 113.233 1.00 0.00 H ATOM 75443 H2 WAT 6441 18.416 78.978 114.305 1.00 0.00 H TER 75445 WAT 6441 ATOM 75445 O WAT 6442 114.779 104.085 135.371 1.00 0.00 O ATOM 75446 H1 WAT 6442 115.164 103.310 134.961 1.00 0.00 H ATOM 75447 H2 WAT 6442 114.936 103.963 136.307 1.00 0.00 H TER 75449 WAT 6442 ATOM 75449 O WAT 6443 128.771 16.493 140.444 1.00 0.00 O ATOM 75450 H1 WAT 6443 129.275 15.736 140.741 1.00 0.00 H ATOM 75451 H2 WAT 6443 129.427 17.096 140.095 1.00 0.00 H TER 75453 WAT 6443 ATOM 75453 O WAT 6444 127.278 125.395 103.857 1.00 0.00 O ATOM 75454 H1 WAT 6444 127.632 124.748 104.467 1.00 0.00 H ATOM 75455 H2 WAT 6444 127.706 126.215 104.102 1.00 0.00 H TER 75457 WAT 6444 ATOM 75457 O WAT 6445 57.819 9.588 147.951 1.00 0.00 O ATOM 75458 H1 WAT 6445 58.280 8.999 147.354 1.00 0.00 H ATOM 75459 H2 WAT 6445 57.688 10.389 147.443 1.00 0.00 H TER 75461 WAT 6445 ATOM 75461 O WAT 6446 107.419 68.978 93.472 1.00 0.00 O ATOM 75462 H1 WAT 6446 106.711 68.824 94.097 1.00 0.00 H ATOM 75463 H2 WAT 6446 108.056 69.503 93.957 1.00 0.00 H TER 75465 WAT 6446 ATOM 75465 O WAT 6447 98.704 145.753 106.341 1.00 0.00 O ATOM 75466 H1 WAT 6447 99.643 145.917 106.253 1.00 0.00 H ATOM 75467 H2 WAT 6447 98.496 146.022 107.236 1.00 0.00 H TER 75469 WAT 6447 ATOM 75469 O WAT 6448 64.763 134.672 132.730 1.00 0.00 O ATOM 75470 H1 WAT 6448 65.493 134.267 133.199 1.00 0.00 H ATOM 75471 H2 WAT 6448 64.010 134.548 133.307 1.00 0.00 H TER 75473 WAT 6448 ATOM 75473 O WAT 6449 102.553 19.489 94.521 1.00 0.00 O ATOM 75474 H1 WAT 6449 102.614 18.987 93.708 1.00 0.00 H ATOM 75475 H2 WAT 6449 103.432 19.845 94.649 1.00 0.00 H TER 75477 WAT 6449 ATOM 75477 O WAT 6450 48.979 143.256 122.361 1.00 0.00 O ATOM 75478 H1 WAT 6450 48.173 143.159 122.867 1.00 0.00 H ATOM 75479 H2 WAT 6450 48.862 144.074 121.877 1.00 0.00 H TER 75481 WAT 6450 ATOM 75481 O WAT 6451 13.748 72.923 156.660 1.00 0.00 O ATOM 75482 H1 WAT 6451 13.564 73.862 156.684 1.00 0.00 H ATOM 75483 H2 WAT 6451 13.220 72.594 155.933 1.00 0.00 H TER 75485 WAT 6451 ATOM 75485 O WAT 6452 127.610 145.851 111.499 1.00 0.00 O ATOM 75486 H1 WAT 6452 128.211 145.296 111.001 1.00 0.00 H ATOM 75487 H2 WAT 6452 128.133 146.170 112.235 1.00 0.00 H TER 75489 WAT 6452 ATOM 75489 O WAT 6453 48.994 41.457 122.206 1.00 0.00 O ATOM 75490 H1 WAT 6453 49.363 42.326 122.047 1.00 0.00 H ATOM 75491 H2 WAT 6453 49.729 40.942 122.539 1.00 0.00 H TER 75493 WAT 6453 ATOM 75493 O WAT 6454 10.213 61.163 129.554 1.00 0.00 O ATOM 75494 H1 WAT 6454 10.458 60.769 128.717 1.00 0.00 H ATOM 75495 H2 WAT 6454 11.035 61.501 129.909 1.00 0.00 H TER 75497 WAT 6454 ATOM 75497 O WAT 6455 63.273 29.124 111.503 1.00 0.00 O ATOM 75498 H1 WAT 6455 62.878 28.596 110.809 1.00 0.00 H ATOM 75499 H2 WAT 6455 63.623 29.892 111.049 1.00 0.00 H TER 75501 WAT 6455 ATOM 75501 O WAT 6456 82.935 48.640 17.591 1.00 0.00 O ATOM 75502 H1 WAT 6456 82.793 47.818 18.062 1.00 0.00 H ATOM 75503 H2 WAT 6456 83.869 48.819 17.699 1.00 0.00 H TER 75505 WAT 6456 ATOM 75505 O WAT 6457 26.514 44.705 77.260 1.00 0.00 O ATOM 75506 H1 WAT 6457 26.771 45.615 77.407 1.00 0.00 H ATOM 75507 H2 WAT 6457 26.454 44.624 76.308 1.00 0.00 H TER 75509 WAT 6457 ATOM 75509 O WAT 6458 141.036 62.582 109.662 1.00 0.00 O ATOM 75510 H1 WAT 6458 140.821 61.672 109.458 1.00 0.00 H ATOM 75511 H2 WAT 6458 140.187 63.015 109.749 1.00 0.00 H TER 75513 WAT 6458 ATOM 75513 O WAT 6459 134.024 130.713 135.823 1.00 0.00 O ATOM 75514 H1 WAT 6459 133.256 130.473 136.340 1.00 0.00 H ATOM 75515 H2 WAT 6459 133.941 130.201 135.018 1.00 0.00 H TER 75517 WAT 6459 ATOM 75517 O WAT 6460 130.662 87.309 65.219 1.00 0.00 O ATOM 75518 H1 WAT 6460 131.407 87.899 65.105 1.00 0.00 H ATOM 75519 H2 WAT 6460 130.884 86.540 64.694 1.00 0.00 H TER 75521 WAT 6460 ATOM 75521 O WAT 6461 73.931 15.652 96.132 1.00 0.00 O ATOM 75522 H1 WAT 6461 74.013 16.604 96.195 1.00 0.00 H ATOM 75523 H2 WAT 6461 73.096 15.513 95.685 1.00 0.00 H TER 75525 WAT 6461 ATOM 75525 O WAT 6462 10.622 133.307 17.512 1.00 0.00 O ATOM 75526 H1 WAT 6462 10.306 134.125 17.895 1.00 0.00 H ATOM 75527 H2 WAT 6462 11.521 133.499 17.244 1.00 0.00 H TER 75529 WAT 6462 ATOM 75529 O WAT 6463 127.374 88.320 21.066 1.00 0.00 O ATOM 75530 H1 WAT 6463 127.734 87.595 21.577 1.00 0.00 H ATOM 75531 H2 WAT 6463 127.245 87.955 20.191 1.00 0.00 H TER 75533 WAT 6463 ATOM 75533 O WAT 6464 49.406 85.037 135.678 1.00 0.00 O ATOM 75534 H1 WAT 6464 50.006 84.356 135.373 1.00 0.00 H ATOM 75535 H2 WAT 6464 49.974 85.778 135.890 1.00 0.00 H TER 75537 WAT 6464 ATOM 75537 O WAT 6465 54.490 136.166 7.363 1.00 0.00 O ATOM 75538 H1 WAT 6465 54.887 135.306 7.222 1.00 0.00 H ATOM 75539 H2 WAT 6465 53.973 136.323 6.573 1.00 0.00 H TER 75541 WAT 6465 ATOM 75541 O WAT 6466 82.682 10.459 86.099 1.00 0.00 O ATOM 75542 H1 WAT 6466 82.392 10.543 85.190 1.00 0.00 H ATOM 75543 H2 WAT 6466 83.624 10.299 86.036 1.00 0.00 H TER 75545 WAT 6466 ATOM 75545 O WAT 6467 54.738 9.316 0.325 1.00 0.00 O ATOM 75546 H1 WAT 6467 54.157 10.050 0.125 1.00 0.00 H ATOM 75547 H2 WAT 6467 54.191 8.539 0.209 1.00 0.00 H TER 75549 WAT 6467 ATOM 75549 O WAT 6468 61.543 46.869 75.336 1.00 0.00 O ATOM 75550 H1 WAT 6468 61.758 46.085 74.831 1.00 0.00 H ATOM 75551 H2 WAT 6468 61.900 46.698 76.208 1.00 0.00 H TER 75553 WAT 6468 ATOM 75553 O WAT 6469 98.477 119.987 96.015 1.00 0.00 O ATOM 75554 H1 WAT 6469 98.932 119.326 95.494 1.00 0.00 H ATOM 75555 H2 WAT 6469 98.792 119.847 96.908 1.00 0.00 H TER 75557 WAT 6469 ATOM 75557 O WAT 6470 31.034 92.822 74.873 1.00 0.00 O ATOM 75558 H1 WAT 6470 31.496 92.312 75.538 1.00 0.00 H ATOM 75559 H2 WAT 6470 31.440 92.563 74.046 1.00 0.00 H TER 75561 WAT 6470 ATOM 75561 O WAT 6471 94.461 114.847 82.288 1.00 0.00 O ATOM 75562 H1 WAT 6471 93.821 114.401 82.844 1.00 0.00 H ATOM 75563 H2 WAT 6471 94.834 115.526 82.850 1.00 0.00 H TER 75565 WAT 6471 ATOM 75565 O WAT 6472 20.037 73.188 105.533 1.00 0.00 O ATOM 75566 H1 WAT 6472 19.292 73.193 106.134 1.00 0.00 H ATOM 75567 H2 WAT 6472 20.574 72.450 105.822 1.00 0.00 H TER 75569 WAT 6472 ATOM 75569 O WAT 6473 111.105 124.826 155.428 1.00 0.00 O ATOM 75570 H1 WAT 6473 110.617 125.645 155.345 1.00 0.00 H ATOM 75571 H2 WAT 6473 112.024 125.095 155.451 1.00 0.00 H TER 75573 WAT 6473 ATOM 75573 O WAT 6474 27.610 79.431 111.966 1.00 0.00 O ATOM 75574 H1 WAT 6474 28.131 80.221 112.112 1.00 0.00 H ATOM 75575 H2 WAT 6474 27.144 79.599 111.147 1.00 0.00 H TER 75577 WAT 6474 ATOM 75577 O WAT 6475 116.612 76.001 93.949 1.00 0.00 O ATOM 75578 H1 WAT 6475 116.977 75.357 93.343 1.00 0.00 H ATOM 75579 H2 WAT 6475 117.157 76.779 93.828 1.00 0.00 H TER 75581 WAT 6475 ATOM 75581 O WAT 6476 49.912 3.004 5.310 1.00 0.00 O ATOM 75582 H1 WAT 6476 50.334 3.353 4.526 1.00 0.00 H ATOM 75583 H2 WAT 6476 49.228 2.424 4.976 1.00 0.00 H TER 75585 WAT 6476 ATOM 75585 O WAT 6477 9.710 4.562 149.126 1.00 0.00 O ATOM 75586 H1 WAT 6477 9.088 3.901 148.823 1.00 0.00 H ATOM 75587 H2 WAT 6477 10.257 4.744 148.362 1.00 0.00 H TER 75589 WAT 6477 ATOM 75589 O WAT 6478 80.330 142.731 2.933 1.00 0.00 O ATOM 75590 H1 WAT 6478 79.848 142.536 2.129 1.00 0.00 H ATOM 75591 H2 WAT 6478 79.828 142.300 3.625 1.00 0.00 H TER 75593 WAT 6478 ATOM 75593 O WAT 6479 78.843 23.852 149.275 1.00 0.00 O ATOM 75594 H1 WAT 6479 78.692 23.207 149.966 1.00 0.00 H ATOM 75595 H2 WAT 6479 79.795 23.880 149.177 1.00 0.00 H TER 75597 WAT 6479 ATOM 75597 O WAT 6480 0.854 14.937 151.058 1.00 0.00 O ATOM 75598 H1 WAT 6480 0.909 14.337 150.314 1.00 0.00 H ATOM 75599 H2 WAT 6480 1.151 15.778 150.710 1.00 0.00 H TER 75601 WAT 6480 ATOM 75601 O WAT 6481 60.290 125.290 147.225 1.00 0.00 O ATOM 75602 H1 WAT 6481 60.189 125.188 148.172 1.00 0.00 H ATOM 75603 H2 WAT 6481 59.396 125.403 146.901 1.00 0.00 H TER 75605 WAT 6481 ATOM 75605 O WAT 6482 143.481 116.102 145.734 1.00 0.00 O ATOM 75606 H1 WAT 6482 143.047 115.423 145.216 1.00 0.00 H ATOM 75607 H2 WAT 6482 143.195 115.937 146.632 1.00 0.00 H TER 75609 WAT 6482 ATOM 75609 O WAT 6483 119.393 99.940 79.709 1.00 0.00 O ATOM 75610 H1 WAT 6483 119.554 99.187 79.140 1.00 0.00 H ATOM 75611 H2 WAT 6483 120.253 100.349 79.813 1.00 0.00 H TER 75613 WAT 6483 ATOM 75613 O WAT 6484 0.873 45.942 138.286 1.00 0.00 O ATOM 75614 H1 WAT 6484 0.503 45.765 139.151 1.00 0.00 H ATOM 75615 H2 WAT 6484 1.703 45.465 138.279 1.00 0.00 H TER 75617 WAT 6484 ATOM 75617 O WAT 6485 31.100 140.318 14.101 1.00 0.00 O ATOM 75618 H1 WAT 6485 31.962 140.460 13.710 1.00 0.00 H ATOM 75619 H2 WAT 6485 30.851 141.173 14.450 1.00 0.00 H TER 75621 WAT 6485 ATOM 75621 O WAT 6486 98.519 13.462 101.216 1.00 0.00 O ATOM 75622 H1 WAT 6486 98.164 13.624 100.342 1.00 0.00 H ATOM 75623 H2 WAT 6486 97.763 13.181 101.732 1.00 0.00 H TER 75625 WAT 6486 ATOM 75625 O WAT 6487 5.306 144.177 17.263 1.00 0.00 O ATOM 75626 H1 WAT 6487 5.309 144.863 16.596 1.00 0.00 H ATOM 75627 H2 WAT 6487 4.388 144.096 17.521 1.00 0.00 H TER 75629 WAT 6487 ATOM 75629 O WAT 6488 89.191 139.314 109.125 1.00 0.00 O ATOM 75630 H1 WAT 6488 89.668 140.144 109.141 1.00 0.00 H ATOM 75631 H2 WAT 6488 89.715 138.726 109.669 1.00 0.00 H TER 75633 WAT 6488 ATOM 75633 O WAT 6489 45.125 33.462 137.290 1.00 0.00 O ATOM 75634 H1 WAT 6489 44.436 32.891 136.951 1.00 0.00 H ATOM 75635 H2 WAT 6489 45.174 34.179 136.658 1.00 0.00 H TER 75637 WAT 6489 ATOM 75637 O WAT 6490 79.983 61.746 139.382 1.00 0.00 O ATOM 75638 H1 WAT 6490 79.380 61.385 138.732 1.00 0.00 H ATOM 75639 H2 WAT 6490 80.383 62.498 138.946 1.00 0.00 H TER 75641 WAT 6490 ATOM 75641 O WAT 6491 69.208 112.112 68.885 1.00 0.00 O ATOM 75642 H1 WAT 6491 68.398 112.466 69.251 1.00 0.00 H ATOM 75643 H2 WAT 6491 69.216 112.418 67.978 1.00 0.00 H TER 75645 WAT 6491 ATOM 75645 O WAT 6492 60.221 49.158 102.620 1.00 0.00 O ATOM 75646 H1 WAT 6492 59.448 49.590 102.985 1.00 0.00 H ATOM 75647 H2 WAT 6492 59.955 48.895 101.739 1.00 0.00 H TER 75649 WAT 6492 ATOM 75649 O WAT 6493 68.807 64.029 139.189 1.00 0.00 O ATOM 75650 H1 WAT 6493 68.594 64.076 138.257 1.00 0.00 H ATOM 75651 H2 WAT 6493 68.429 64.825 139.562 1.00 0.00 H TER 75653 WAT 6493 ATOM 75653 O WAT 6494 134.931 97.484 24.919 1.00 0.00 O ATOM 75654 H1 WAT 6494 134.678 97.313 25.826 1.00 0.00 H ATOM 75655 H2 WAT 6494 135.685 96.913 24.770 1.00 0.00 H TER 75657 WAT 6494 ATOM 75657 O WAT 6495 100.206 129.641 115.182 1.00 0.00 O ATOM 75658 H1 WAT 6495 101.132 129.611 114.939 1.00 0.00 H ATOM 75659 H2 WAT 6495 99.989 128.737 115.410 1.00 0.00 H TER 75661 WAT 6495 ATOM 75661 O WAT 6496 142.340 29.302 114.697 1.00 0.00 O ATOM 75662 H1 WAT 6496 142.739 28.888 115.463 1.00 0.00 H ATOM 75663 H2 WAT 6496 142.000 30.134 115.025 1.00 0.00 H TER 75665 WAT 6496 ATOM 75665 O WAT 6497 98.202 135.988 125.659 1.00 0.00 O ATOM 75666 H1 WAT 6497 97.381 135.716 126.069 1.00 0.00 H ATOM 75667 H2 WAT 6497 98.048 135.882 124.720 1.00 0.00 H TER 75669 WAT 6497 ATOM 75669 O WAT 6498 85.084 94.584 104.385 1.00 0.00 O ATOM 75670 H1 WAT 6498 85.695 95.108 103.868 1.00 0.00 H ATOM 75671 H2 WAT 6498 85.088 93.725 103.962 1.00 0.00 H TER 75673 WAT 6498 ATOM 75673 O WAT 6499 54.274 32.872 20.118 1.00 0.00 O ATOM 75674 H1 WAT 6499 53.506 32.310 20.227 1.00 0.00 H ATOM 75675 H2 WAT 6499 54.174 33.548 20.788 1.00 0.00 H TER 75677 WAT 6499 ATOM 75677 O WAT 6500 29.974 5.182 25.647 1.00 0.00 O ATOM 75678 H1 WAT 6500 30.442 4.973 26.456 1.00 0.00 H ATOM 75679 H2 WAT 6500 29.059 5.268 25.915 1.00 0.00 H TER 75681 WAT 6500 ATOM 75681 O WAT 6501 78.430 79.536 147.436 1.00 0.00 O ATOM 75682 H1 WAT 6501 79.257 80.016 147.472 1.00 0.00 H ATOM 75683 H2 WAT 6501 78.077 79.731 146.568 1.00 0.00 H TER 75685 WAT 6501 ATOM 75685 O WAT 6502 9.754 114.715 99.045 1.00 0.00 O ATOM 75686 H1 WAT 6502 9.319 113.949 99.419 1.00 0.00 H ATOM 75687 H2 WAT 6502 10.466 114.352 98.519 1.00 0.00 H TER 75689 WAT 6502 ATOM 75689 O WAT 6503 28.996 143.148 83.743 1.00 0.00 O ATOM 75690 H1 WAT 6503 28.368 143.825 83.490 1.00 0.00 H ATOM 75691 H2 WAT 6503 29.381 142.858 82.916 1.00 0.00 H TER 75693 WAT 6503 ATOM 75693 O WAT 6504 83.157 79.590 78.308 1.00 0.00 O ATOM 75694 H1 WAT 6504 83.089 80.015 77.453 1.00 0.00 H ATOM 75695 H2 WAT 6504 83.900 80.020 78.731 1.00 0.00 H TER 75697 WAT 6504 ATOM 75697 O WAT 6505 58.690 54.409 140.164 1.00 0.00 O ATOM 75698 H1 WAT 6505 58.951 55.274 140.481 1.00 0.00 H ATOM 75699 H2 WAT 6505 59.333 54.198 139.487 1.00 0.00 H TER 75701 WAT 6505 ATOM 75701 O WAT 6506 20.410 68.467 96.833 1.00 0.00 O ATOM 75702 H1 WAT 6506 20.055 67.604 96.617 1.00 0.00 H ATOM 75703 H2 WAT 6506 20.862 68.746 96.037 1.00 0.00 H TER 75705 WAT 6506 ATOM 75705 O WAT 6507 7.693 59.196 127.242 1.00 0.00 O ATOM 75706 H1 WAT 6507 7.733 58.240 127.225 1.00 0.00 H ATOM 75707 H2 WAT 6507 8.573 59.468 127.505 1.00 0.00 H TER 75709 WAT 6507 ATOM 75709 O WAT 6508 101.765 32.572 10.662 1.00 0.00 O ATOM 75710 H1 WAT 6508 101.407 33.035 9.904 1.00 0.00 H ATOM 75711 H2 WAT 6508 101.065 31.977 10.932 1.00 0.00 H TER 75713 WAT 6508 ATOM 75713 O WAT 6509 131.849 125.138 98.122 1.00 0.00 O ATOM 75714 H1 WAT 6509 131.399 125.377 98.932 1.00 0.00 H ATOM 75715 H2 WAT 6509 132.780 125.222 98.330 1.00 0.00 H TER 75717 WAT 6509 ATOM 75717 O WAT 6510 5.763 64.122 0.182 1.00 0.00 O ATOM 75718 H1 WAT 6510 5.115 64.755 0.492 1.00 0.00 H ATOM 75719 H2 WAT 6510 5.258 63.495 -0.334 1.00 0.00 H TER 75721 WAT 6510 ATOM 75721 O WAT 6511 62.321 96.170 21.664 1.00 0.00 O ATOM 75722 H1 WAT 6511 62.338 95.662 22.475 1.00 0.00 H ATOM 75723 H2 WAT 6511 62.352 97.082 21.952 1.00 0.00 H TER 75725 WAT 6511 ATOM 75725 O WAT 6512 127.586 130.058 144.798 1.00 0.00 O ATOM 75726 H1 WAT 6512 128.280 130.335 145.396 1.00 0.00 H ATOM 75727 H2 WAT 6512 126.801 130.502 145.120 1.00 0.00 H TER 75729 WAT 6512 ATOM 75729 O WAT 6513 111.627 14.643 7.738 1.00 0.00 O ATOM 75730 H1 WAT 6513 110.858 15.089 8.092 1.00 0.00 H ATOM 75731 H2 WAT 6513 111.345 13.736 7.620 1.00 0.00 H TER 75733 WAT 6513 ATOM 75733 O WAT 6514 39.012 26.848 81.673 1.00 0.00 O ATOM 75734 H1 WAT 6514 38.650 26.003 81.408 1.00 0.00 H ATOM 75735 H2 WAT 6514 39.028 27.365 80.868 1.00 0.00 H TER 75737 WAT 6514 ATOM 75737 O WAT 6515 39.155 39.346 98.904 1.00 0.00 O ATOM 75738 H1 WAT 6515 38.796 39.387 98.017 1.00 0.00 H ATOM 75739 H2 WAT 6515 39.724 40.112 98.968 1.00 0.00 H TER 75741 WAT 6515 ATOM 75741 O WAT 6516 81.747 60.220 77.500 1.00 0.00 O ATOM 75742 H1 WAT 6516 82.099 61.110 77.529 1.00 0.00 H ATOM 75743 H2 WAT 6516 82.521 59.657 77.491 1.00 0.00 H TER 75745 WAT 6516 ATOM 75745 O WAT 6517 41.506 40.634 118.443 1.00 0.00 O ATOM 75746 H1 WAT 6517 41.650 41.493 118.044 1.00 0.00 H ATOM 75747 H2 WAT 6517 41.312 40.826 119.360 1.00 0.00 H TER 75749 WAT 6517 ATOM 75749 O WAT 6518 84.268 18.833 109.807 1.00 0.00 O ATOM 75750 H1 WAT 6518 83.616 18.564 109.160 1.00 0.00 H ATOM 75751 H2 WAT 6518 85.099 18.812 109.333 1.00 0.00 H TER 75753 WAT 6518 ATOM 75753 O WAT 6519 142.097 55.633 12.815 1.00 0.00 O ATOM 75754 H1 WAT 6519 142.860 55.595 13.391 1.00 0.00 H ATOM 75755 H2 WAT 6519 141.412 56.033 13.351 1.00 0.00 H TER 75757 WAT 6519 ATOM 75757 O WAT 6520 49.573 58.594 149.110 1.00 0.00 O ATOM 75758 H1 WAT 6520 49.873 57.696 149.248 1.00 0.00 H ATOM 75759 H2 WAT 6520 49.638 58.726 148.164 1.00 0.00 H TER 75761 WAT 6520 ATOM 75761 O WAT 6521 132.728 49.493 135.966 1.00 0.00 O ATOM 75762 H1 WAT 6521 132.923 48.612 135.647 1.00 0.00 H ATOM 75763 H2 WAT 6521 132.073 49.359 136.652 1.00 0.00 H TER 75765 WAT 6521 ATOM 75765 O WAT 6522 47.342 66.595 115.623 1.00 0.00 O ATOM 75766 H1 WAT 6522 47.943 65.853 115.692 1.00 0.00 H ATOM 75767 H2 WAT 6522 47.178 66.856 116.530 1.00 0.00 H TER 75769 WAT 6522 ATOM 75769 O WAT 6523 55.216 59.174 147.021 1.00 0.00 O ATOM 75770 H1 WAT 6523 55.763 59.451 147.756 1.00 0.00 H ATOM 75771 H2 WAT 6523 55.767 58.568 146.527 1.00 0.00 H TER 75773 WAT 6523 ATOM 75773 O WAT 6524 87.389 83.691 99.959 1.00 0.00 O ATOM 75774 H1 WAT 6524 88.338 83.631 99.844 1.00 0.00 H ATOM 75775 H2 WAT 6524 87.207 83.149 100.726 1.00 0.00 H TER 75777 WAT 6524 ATOM 75777 O WAT 6525 49.905 81.268 85.008 1.00 0.00 O ATOM 75778 H1 WAT 6525 50.347 80.436 85.175 1.00 0.00 H ATOM 75779 H2 WAT 6525 50.374 81.643 84.262 1.00 0.00 H TER 75781 WAT 6525 ATOM 75781 O WAT 6526 37.965 23.155 81.083 1.00 0.00 O ATOM 75782 H1 WAT 6526 37.202 23.580 81.475 1.00 0.00 H ATOM 75783 H2 WAT 6526 38.567 23.023 81.816 1.00 0.00 H TER 75785 WAT 6526 ATOM 75785 O WAT 6527 88.074 96.738 4.595 1.00 0.00 O ATOM 75786 H1 WAT 6527 87.408 96.105 4.863 1.00 0.00 H ATOM 75787 H2 WAT 6527 88.187 97.305 5.358 1.00 0.00 H TER 75789 WAT 6527 ATOM 75789 O WAT 6528 145.068 124.312 130.642 1.00 0.00 O ATOM 75790 H1 WAT 6528 145.569 125.093 130.877 1.00 0.00 H ATOM 75791 H2 WAT 6528 145.683 123.588 130.759 1.00 0.00 H TER 75793 WAT 6528 ATOM 75793 O WAT 6529 77.105 52.694 115.094 1.00 0.00 O ATOM 75794 H1 WAT 6529 76.356 52.401 115.612 1.00 0.00 H ATOM 75795 H2 WAT 6529 77.410 53.485 115.538 1.00 0.00 H TER 75797 WAT 6529 ATOM 75797 O WAT 6530 67.682 47.778 61.490 1.00 0.00 O ATOM 75798 H1 WAT 6530 68.487 48.198 61.186 1.00 0.00 H ATOM 75799 H2 WAT 6530 67.306 47.383 60.703 1.00 0.00 H TER 75801 WAT 6530 ATOM 75801 O WAT 6531 131.529 38.998 147.206 1.00 0.00 O ATOM 75802 H1 WAT 6531 131.636 38.288 147.839 1.00 0.00 H ATOM 75803 H2 WAT 6531 132.283 39.569 147.357 1.00 0.00 H TER 75805 WAT 6531 ATOM 75805 O WAT 6532 31.440 139.632 151.413 1.00 0.00 O ATOM 75806 H1 WAT 6532 30.900 139.889 152.160 1.00 0.00 H ATOM 75807 H2 WAT 6532 30.958 139.946 150.649 1.00 0.00 H TER 75809 WAT 6532 ATOM 75809 O WAT 6533 73.489 83.350 64.836 1.00 0.00 O ATOM 75810 H1 WAT 6533 74.003 83.774 65.524 1.00 0.00 H ATOM 75811 H2 WAT 6533 74.090 83.285 64.094 1.00 0.00 H TER 75813 WAT 6533 ATOM 75813 O WAT 6534 8.008 20.621 107.425 1.00 0.00 O ATOM 75814 H1 WAT 6534 8.244 21.074 108.234 1.00 0.00 H ATOM 75815 H2 WAT 6534 7.656 21.308 106.859 1.00 0.00 H TER 75817 WAT 6534 ATOM 75817 O WAT 6535 33.803 91.457 101.125 1.00 0.00 O ATOM 75818 H1 WAT 6535 33.589 92.338 100.818 1.00 0.00 H ATOM 75819 H2 WAT 6535 33.031 90.934 100.909 1.00 0.00 H TER 75821 WAT 6535 ATOM 75821 O WAT 6536 140.914 9.062 154.149 1.00 0.00 O ATOM 75822 H1 WAT 6536 140.117 9.378 153.723 1.00 0.00 H ATOM 75823 H2 WAT 6536 140.608 8.402 154.771 1.00 0.00 H TER 75825 WAT 6536 ATOM 75825 O WAT 6537 86.690 135.321 152.860 1.00 0.00 O ATOM 75826 H1 WAT 6537 86.252 135.738 152.118 1.00 0.00 H ATOM 75827 H2 WAT 6537 87.622 135.468 152.703 1.00 0.00 H TER 75829 WAT 6537 ATOM 75829 O WAT 6538 36.938 4.717 157.528 1.00 0.00 O ATOM 75830 H1 WAT 6538 36.216 4.937 158.117 1.00 0.00 H ATOM 75831 H2 WAT 6538 37.712 5.096 157.945 1.00 0.00 H TER 75833 WAT 6538 ATOM 75833 O WAT 6539 29.547 24.628 67.370 1.00 0.00 O ATOM 75834 H1 WAT 6539 29.156 25.501 67.401 1.00 0.00 H ATOM 75835 H2 WAT 6539 30.375 24.752 66.906 1.00 0.00 H TER 75837 WAT 6539 ATOM 75837 O WAT 6540 41.616 57.043 140.994 1.00 0.00 O ATOM 75838 H1 WAT 6540 41.280 57.811 140.533 1.00 0.00 H ATOM 75839 H2 WAT 6540 41.289 56.298 140.490 1.00 0.00 H TER 75841 WAT 6540 ATOM 75841 O WAT 6541 67.831 23.257 12.138 1.00 0.00 O ATOM 75842 H1 WAT 6541 67.998 22.325 11.997 1.00 0.00 H ATOM 75843 H2 WAT 6541 67.829 23.635 11.258 1.00 0.00 H TER 75845 WAT 6541 ATOM 75845 O WAT 6542 101.250 23.087 142.956 1.00 0.00 O ATOM 75846 H1 WAT 6542 101.974 22.964 143.570 1.00 0.00 H ATOM 75847 H2 WAT 6542 101.426 23.932 142.543 1.00 0.00 H TER 75849 WAT 6542 ATOM 75849 O WAT 6543 123.314 28.293 141.446 1.00 0.00 O ATOM 75850 H1 WAT 6543 122.511 28.765 141.665 1.00 0.00 H ATOM 75851 H2 WAT 6543 123.356 27.582 142.087 1.00 0.00 H TER 75853 WAT 6543 ATOM 75853 O WAT 6544 119.197 48.595 139.410 1.00 0.00 O ATOM 75854 H1 WAT 6544 119.103 47.778 138.921 1.00 0.00 H ATOM 75855 H2 WAT 6544 120.002 48.987 139.070 1.00 0.00 H TER 75857 WAT 6544 ATOM 75857 O WAT 6545 102.278 20.907 66.592 1.00 0.00 O ATOM 75858 H1 WAT 6545 102.250 20.139 66.020 1.00 0.00 H ATOM 75859 H2 WAT 6545 102.677 21.591 66.054 1.00 0.00 H TER 75861 WAT 6545 ATOM 75861 O WAT 6546 89.943 20.077 144.789 1.00 0.00 O ATOM 75862 H1 WAT 6546 90.703 20.503 144.391 1.00 0.00 H ATOM 75863 H2 WAT 6546 90.034 20.252 145.726 1.00 0.00 H TER 75865 WAT 6546 ATOM 75865 O WAT 6547 41.945 122.692 7.123 1.00 0.00 O ATOM 75866 H1 WAT 6547 41.504 123.369 6.610 1.00 0.00 H ATOM 75867 H2 WAT 6547 41.463 122.667 7.950 1.00 0.00 H TER 75869 WAT 6547 ATOM 75869 O WAT 6548 48.667 72.733 132.088 1.00 0.00 O ATOM 75870 H1 WAT 6548 49.431 73.270 132.300 1.00 0.00 H ATOM 75871 H2 WAT 6548 48.522 72.881 131.153 1.00 0.00 H TER 75873 WAT 6548 ATOM 75873 O WAT 6549 0.595 130.588 153.987 1.00 0.00 O ATOM 75874 H1 WAT 6549 0.857 130.286 153.117 1.00 0.00 H ATOM 75875 H2 WAT 6549 1.126 131.370 154.139 1.00 0.00 H TER 75877 WAT 6549 ATOM 75877 O WAT 6550 99.231 3.467 90.350 1.00 0.00 O ATOM 75878 H1 WAT 6550 100.005 4.024 90.429 1.00 0.00 H ATOM 75879 H2 WAT 6550 98.996 3.514 89.423 1.00 0.00 H TER 75881 WAT 6550 ATOM 75881 O WAT 6551 38.816 113.201 140.129 1.00 0.00 O ATOM 75882 H1 WAT 6551 39.409 113.950 140.065 1.00 0.00 H ATOM 75883 H2 WAT 6551 38.425 113.278 141.000 1.00 0.00 H TER 75885 WAT 6551 ATOM 75885 O WAT 6552 48.726 15.568 138.348 1.00 0.00 O ATOM 75886 H1 WAT 6552 48.283 16.400 138.519 1.00 0.00 H ATOM 75887 H2 WAT 6552 48.511 15.366 137.437 1.00 0.00 H TER 75889 WAT 6552 ATOM 75889 O WAT 6553 109.117 11.448 150.903 1.00 0.00 O ATOM 75890 H1 WAT 6553 109.071 12.286 151.364 1.00 0.00 H ATOM 75891 H2 WAT 6553 110.039 11.359 150.660 1.00 0.00 H TER 75893 WAT 6553 ATOM 75893 O WAT 6554 17.954 86.287 6.681 1.00 0.00 O ATOM 75894 H1 WAT 6554 17.007 86.156 6.708 1.00 0.00 H ATOM 75895 H2 WAT 6554 18.173 86.634 7.546 1.00 0.00 H TER 75897 WAT 6554 ATOM 75897 O WAT 6555 33.588 129.564 2.601 1.00 0.00 O ATOM 75898 H1 WAT 6555 33.774 129.771 1.685 1.00 0.00 H ATOM 75899 H2 WAT 6555 32.895 130.176 2.848 1.00 0.00 H TER 75901 WAT 6555 ATOM 75901 O WAT 6556 119.957 91.601 17.272 1.00 0.00 O ATOM 75902 H1 WAT 6556 119.140 91.669 17.766 1.00 0.00 H ATOM 75903 H2 WAT 6556 119.785 92.073 16.458 1.00 0.00 H TER 75905 WAT 6556 ATOM 75905 O WAT 6557 42.591 13.185 93.630 1.00 0.00 O ATOM 75906 H1 WAT 6557 43.365 12.791 94.032 1.00 0.00 H ATOM 75907 H2 WAT 6557 42.500 14.033 94.065 1.00 0.00 H TER 75909 WAT 6557 ATOM 75909 O WAT 6558 31.888 11.236 113.173 1.00 0.00 O ATOM 75910 H1 WAT 6558 31.545 11.342 112.286 1.00 0.00 H ATOM 75911 H2 WAT 6558 31.429 11.899 113.688 1.00 0.00 H TER 75913 WAT 6558 ATOM 75913 O WAT 6559 127.647 122.299 129.541 1.00 0.00 O ATOM 75914 H1 WAT 6559 126.952 121.730 129.210 1.00 0.00 H ATOM 75915 H2 WAT 6559 127.323 123.187 129.389 1.00 0.00 H TER 75917 WAT 6559 ATOM 75917 O WAT 6560 87.275 140.593 106.145 1.00 0.00 O ATOM 75918 H1 WAT 6560 87.443 141.015 106.988 1.00 0.00 H ATOM 75919 H2 WAT 6560 87.320 139.656 106.334 1.00 0.00 H TER 75921 WAT 6560 ATOM 75921 O WAT 6561 114.654 9.055 118.030 1.00 0.00 O ATOM 75922 H1 WAT 6561 113.788 8.682 118.191 1.00 0.00 H ATOM 75923 H2 WAT 6561 115.263 8.417 118.402 1.00 0.00 H TER 75925 WAT 6561 ATOM 75925 O WAT 6562 44.805 134.851 146.193 1.00 0.00 O ATOM 75926 H1 WAT 6562 44.229 134.740 146.949 1.00 0.00 H ATOM 75927 H2 WAT 6562 45.074 135.769 146.230 1.00 0.00 H TER 75929 WAT 6562 ATOM 75929 O WAT 6563 5.835 144.873 3.960 1.00 0.00 O ATOM 75930 H1 WAT 6563 5.279 145.149 3.232 1.00 0.00 H ATOM 75931 H2 WAT 6563 5.542 145.404 4.701 1.00 0.00 H TER 75933 WAT 6563 ATOM 75933 O WAT 6564 120.276 130.819 132.179 1.00 0.00 O ATOM 75934 H1 WAT 6564 120.831 131.079 132.914 1.00 0.00 H ATOM 75935 H2 WAT 6564 120.885 130.456 131.536 1.00 0.00 H TER 75937 WAT 6564 ATOM 75937 O WAT 6565 102.666 55.975 20.928 1.00 0.00 O ATOM 75938 H1 WAT 6565 102.677 55.642 20.031 1.00 0.00 H ATOM 75939 H2 WAT 6565 101.820 56.414 21.010 1.00 0.00 H TER 75941 WAT 6565 ATOM 75941 O WAT 6566 22.862 140.084 90.796 1.00 0.00 O ATOM 75942 H1 WAT 6566 23.260 139.255 90.531 1.00 0.00 H ATOM 75943 H2 WAT 6566 21.986 139.844 91.096 1.00 0.00 H TER 75945 WAT 6566 ATOM 75945 O WAT 6567 24.160 113.001 150.069 1.00 0.00 O ATOM 75946 H1 WAT 6567 24.579 113.325 150.866 1.00 0.00 H ATOM 75947 H2 WAT 6567 24.701 112.258 149.799 1.00 0.00 H TER 75949 WAT 6567 ATOM 75949 O WAT 6568 41.288 61.107 109.294 1.00 0.00 O ATOM 75950 H1 WAT 6568 41.874 61.588 109.879 1.00 0.00 H ATOM 75951 H2 WAT 6568 40.696 61.774 108.947 1.00 0.00 H TER 75953 WAT 6568 ATOM 75953 O WAT 6569 78.712 135.362 69.870 1.00 0.00 O ATOM 75954 H1 WAT 6569 77.982 135.980 69.891 1.00 0.00 H ATOM 75955 H2 WAT 6569 78.378 134.581 70.312 1.00 0.00 H TER 75957 WAT 6569 ATOM 75957 O WAT 6570 21.740 43.261 75.681 1.00 0.00 O ATOM 75958 H1 WAT 6570 21.340 43.183 76.547 1.00 0.00 H ATOM 75959 H2 WAT 6570 21.594 44.173 75.431 1.00 0.00 H TER 75961 WAT 6570 ATOM 75961 O WAT 6571 10.916 83.074 141.863 1.00 0.00 O ATOM 75962 H1 WAT 6571 11.592 83.151 141.189 1.00 0.00 H ATOM 75963 H2 WAT 6571 11.398 82.869 142.664 1.00 0.00 H TER 75965 WAT 6571 ATOM 75965 O WAT 6572 94.439 110.824 79.043 1.00 0.00 O ATOM 75966 H1 WAT 6572 95.292 110.563 78.695 1.00 0.00 H ATOM 75967 H2 WAT 6572 94.555 111.740 79.296 1.00 0.00 H TER 75969 WAT 6572 ATOM 75969 O WAT 6573 82.532 102.493 117.849 1.00 0.00 O ATOM 75970 H1 WAT 6573 82.090 103.115 118.425 1.00 0.00 H ATOM 75971 H2 WAT 6573 83.046 101.942 118.440 1.00 0.00 H TER 75973 WAT 6573 ATOM 75973 O WAT 6574 125.204 38.117 153.366 1.00 0.00 O ATOM 75974 H1 WAT 6574 124.631 38.789 152.996 1.00 0.00 H ATOM 75975 H2 WAT 6574 124.993 38.111 154.300 1.00 0.00 H TER 75977 WAT 6574 ATOM 75977 O WAT 6575 115.348 78.220 61.512 1.00 0.00 O ATOM 75978 H1 WAT 6575 114.956 78.722 62.226 1.00 0.00 H ATOM 75979 H2 WAT 6575 115.617 77.395 61.918 1.00 0.00 H TER 75981 WAT 6575 ATOM 75981 O WAT 6576 62.662 79.915 117.260 1.00 0.00 O ATOM 75982 H1 WAT 6576 62.018 79.228 117.434 1.00 0.00 H ATOM 75983 H2 WAT 6576 62.181 80.732 117.385 1.00 0.00 H TER 75985 WAT 6576 ATOM 75985 O WAT 6577 48.071 141.635 75.854 1.00 0.00 O ATOM 75986 H1 WAT 6577 48.724 140.935 75.852 1.00 0.00 H ATOM 75987 H2 WAT 6577 47.864 141.767 76.780 1.00 0.00 H TER 75989 WAT 6577 ATOM 75989 O WAT 6578 21.745 24.723 77.954 1.00 0.00 O ATOM 75990 H1 WAT 6578 21.103 24.123 77.574 1.00 0.00 H ATOM 75991 H2 WAT 6578 21.704 25.501 77.399 1.00 0.00 H TER 75993 WAT 6578 ATOM 75993 O WAT 6579 123.433 129.203 73.310 1.00 0.00 O ATOM 75994 H1 WAT 6579 123.278 128.992 74.231 1.00 0.00 H ATOM 75995 H2 WAT 6579 124.171 129.813 73.325 1.00 0.00 H TER 75997 WAT 6579 ATOM 75997 O WAT 6580 130.553 84.586 18.688 1.00 0.00 O ATOM 75998 H1 WAT 6580 131.402 84.984 18.880 1.00 0.00 H ATOM 75999 H2 WAT 6580 130.546 83.778 19.201 1.00 0.00 H TER 76001 WAT 6580 ATOM 76001 O WAT 6581 70.441 116.607 91.463 1.00 0.00 O ATOM 76002 H1 WAT 6581 70.472 115.680 91.226 1.00 0.00 H ATOM 76003 H2 WAT 6581 70.622 116.620 92.402 1.00 0.00 H TER 76005 WAT 6581 ATOM 76005 O WAT 6582 124.396 93.377 23.524 1.00 0.00 O ATOM 76006 H1 WAT 6582 124.753 93.198 24.393 1.00 0.00 H ATOM 76007 H2 WAT 6582 123.538 92.951 23.525 1.00 0.00 H TER 76009 WAT 6582 ATOM 76009 O WAT 6583 66.716 132.087 109.018 1.00 0.00 O ATOM 76010 H1 WAT 6583 67.379 131.397 109.028 1.00 0.00 H ATOM 76011 H2 WAT 6583 66.212 131.947 109.820 1.00 0.00 H TER 76013 WAT 6583 ATOM 76013 O WAT 6584 87.634 136.524 111.128 1.00 0.00 O ATOM 76014 H1 WAT 6584 87.687 135.569 111.159 1.00 0.00 H ATOM 76015 H2 WAT 6584 87.090 136.710 110.363 1.00 0.00 H TER 76017 WAT 6584 ATOM 76017 O WAT 6585 81.082 132.772 99.273 1.00 0.00 O ATOM 76018 H1 WAT 6585 81.160 131.842 99.489 1.00 0.00 H ATOM 76019 H2 WAT 6585 80.273 133.050 99.704 1.00 0.00 H TER 76021 WAT 6585 ATOM 76021 O WAT 6586 106.477 94.188 148.511 1.00 0.00 O ATOM 76022 H1 WAT 6586 106.107 95.003 148.170 1.00 0.00 H ATOM 76023 H2 WAT 6586 107.424 94.301 148.422 1.00 0.00 H TER 76025 WAT 6586 ATOM 76025 O WAT 6587 97.344 73.539 120.945 1.00 0.00 O ATOM 76026 H1 WAT 6587 96.604 73.450 121.546 1.00 0.00 H ATOM 76027 H2 WAT 6587 97.359 72.715 120.459 1.00 0.00 H TER 76029 WAT 6587 ATOM 76029 O WAT 6588 15.695 54.376 66.900 1.00 0.00 O ATOM 76030 H1 WAT 6588 15.514 54.962 66.165 1.00 0.00 H ATOM 76031 H2 WAT 6588 15.739 54.954 67.662 1.00 0.00 H TER 76033 WAT 6588 ATOM 76033 O WAT 6589 20.526 68.340 13.450 1.00 0.00 O ATOM 76034 H1 WAT 6589 19.973 68.705 14.140 1.00 0.00 H ATOM 76035 H2 WAT 6589 21.200 67.847 13.918 1.00 0.00 H TER 76037 WAT 6589 ATOM 76037 O WAT 6590 67.995 78.777 99.567 1.00 0.00 O ATOM 76038 H1 WAT 6590 68.392 78.022 100.002 1.00 0.00 H ATOM 76039 H2 WAT 6590 68.486 78.868 98.750 1.00 0.00 H TER 76041 WAT 6590 ATOM 76041 O WAT 6591 5.236 17.404 135.912 1.00 0.00 O ATOM 76042 H1 WAT 6591 5.215 16.833 136.680 1.00 0.00 H ATOM 76043 H2 WAT 6591 6.162 17.452 135.674 1.00 0.00 H TER 76045 WAT 6591 ATOM 76045 O WAT 6592 111.785 124.320 14.759 1.00 0.00 O ATOM 76046 H1 WAT 6592 110.850 124.254 14.564 1.00 0.00 H ATOM 76047 H2 WAT 6592 112.216 123.929 13.999 1.00 0.00 H TER 76049 WAT 6592 ATOM 76049 O WAT 6593 12.616 37.025 73.417 1.00 0.00 O ATOM 76050 H1 WAT 6593 11.743 36.632 73.421 1.00 0.00 H ATOM 76051 H2 WAT 6593 12.453 37.968 73.400 1.00 0.00 H TER 76053 WAT 6593 ATOM 76053 O WAT 6594 49.412 55.117 56.837 1.00 0.00 O ATOM 76054 H1 WAT 6594 49.831 55.365 56.013 1.00 0.00 H ATOM 76055 H2 WAT 6594 49.676 55.800 57.455 1.00 0.00 H TER 76057 WAT 6594 ATOM 76057 O WAT 6595 79.373 54.136 2.962 1.00 0.00 O ATOM 76058 H1 WAT 6595 79.337 53.431 2.315 1.00 0.00 H ATOM 76059 H2 WAT 6595 79.174 53.707 3.794 1.00 0.00 H TER 76061 WAT 6595 ATOM 76061 O WAT 6596 43.744 123.385 112.069 1.00 0.00 O ATOM 76062 H1 WAT 6596 44.355 122.651 111.999 1.00 0.00 H ATOM 76063 H2 WAT 6596 43.534 123.609 111.162 1.00 0.00 H TER 76065 WAT 6596 ATOM 76065 O WAT 6597 28.133 42.672 21.079 1.00 0.00 O ATOM 76066 H1 WAT 6597 29.002 42.754 21.473 1.00 0.00 H ATOM 76067 H2 WAT 6597 28.255 42.058 20.355 1.00 0.00 H TER 76069 WAT 6597 ATOM 76069 O WAT 6598 47.570 55.519 1.877 1.00 0.00 O ATOM 76070 H1 WAT 6598 48.107 54.873 1.419 1.00 0.00 H ATOM 76071 H2 WAT 6598 47.072 55.952 1.183 1.00 0.00 H TER 76073 WAT 6598 ATOM 76073 O WAT 6599 118.964 53.960 96.824 1.00 0.00 O ATOM 76074 H1 WAT 6599 118.474 54.337 97.555 1.00 0.00 H ATOM 76075 H2 WAT 6599 118.824 53.017 96.904 1.00 0.00 H TER 76077 WAT 6599 ATOM 76077 O WAT 6600 22.417 9.822 118.441 1.00 0.00 O ATOM 76078 H1 WAT 6600 22.228 9.138 117.798 1.00 0.00 H ATOM 76079 H2 WAT 6600 23.307 9.633 118.736 1.00 0.00 H TER 76081 WAT 6600 ATOM 76081 O WAT 6601 97.837 79.977 97.847 1.00 0.00 O ATOM 76082 H1 WAT 6601 97.888 80.474 97.030 1.00 0.00 H ATOM 76083 H2 WAT 6601 96.916 79.725 97.916 1.00 0.00 H TER 76085 WAT 6601 ATOM 76085 O WAT 6602 59.671 125.744 58.254 1.00 0.00 O ATOM 76086 H1 WAT 6602 60.101 124.894 58.160 1.00 0.00 H ATOM 76087 H2 WAT 6602 60.172 126.191 58.937 1.00 0.00 H TER 76089 WAT 6602 ATOM 76089 O WAT 6603 94.699 59.260 8.034 1.00 0.00 O ATOM 76090 H1 WAT 6603 94.371 58.982 8.890 1.00 0.00 H ATOM 76091 H2 WAT 6603 95.181 60.067 8.213 1.00 0.00 H TER 76093 WAT 6603 ATOM 76093 O WAT 6604 121.083 36.753 121.011 1.00 0.00 O ATOM 76094 H1 WAT 6604 120.774 37.052 120.156 1.00 0.00 H ATOM 76095 H2 WAT 6604 121.968 36.428 120.846 1.00 0.00 H TER 76097 WAT 6604 ATOM 76097 O WAT 6605 99.241 31.903 55.378 1.00 0.00 O ATOM 76098 H1 WAT 6605 98.480 31.551 55.839 1.00 0.00 H ATOM 76099 H2 WAT 6605 99.993 31.557 55.858 1.00 0.00 H TER 76101 WAT 6605 ATOM 76101 O WAT 6606 138.379 111.220 71.441 1.00 0.00 O ATOM 76102 H1 WAT 6606 138.805 111.843 72.030 1.00 0.00 H ATOM 76103 H2 WAT 6606 137.608 111.685 71.117 1.00 0.00 H TER 76105 WAT 6606 ATOM 76105 O WAT 6607 52.090 61.992 150.755 1.00 0.00 O ATOM 76106 H1 WAT 6607 52.263 61.230 150.203 1.00 0.00 H ATOM 76107 H2 WAT 6607 51.135 62.038 150.806 1.00 0.00 H TER 76109 WAT 6607 ATOM 76109 O WAT 6608 7.662 67.655 20.589 1.00 0.00 O ATOM 76110 H1 WAT 6608 7.545 68.591 20.752 1.00 0.00 H ATOM 76111 H2 WAT 6608 7.574 67.249 21.451 1.00 0.00 H TER 76113 WAT 6608 ATOM 76113 O WAT 6609 62.323 20.835 116.472 1.00 0.00 O ATOM 76114 H1 WAT 6609 63.107 20.286 116.487 1.00 0.00 H ATOM 76115 H2 WAT 6609 62.117 20.982 117.396 1.00 0.00 H TER 76117 WAT 6609 ATOM 76117 O WAT 6610 111.586 10.532 86.906 1.00 0.00 O ATOM 76118 H1 WAT 6610 110.979 11.158 86.511 1.00 0.00 H ATOM 76119 H2 WAT 6610 111.287 9.678 86.594 1.00 0.00 H TER 76121 WAT 6610 ATOM 76121 O WAT 6611 52.046 10.470 110.067 1.00 0.00 O ATOM 76122 H1 WAT 6611 52.535 10.306 109.261 1.00 0.00 H ATOM 76123 H2 WAT 6611 51.428 9.741 110.124 1.00 0.00 H TER 76125 WAT 6611 ATOM 76125 O WAT 6612 24.189 86.755 86.771 1.00 0.00 O ATOM 76126 H1 WAT 6612 25.046 86.713 86.346 1.00 0.00 H ATOM 76127 H2 WAT 6612 23.576 86.927 86.057 1.00 0.00 H TER 76129 WAT 6612 ATOM 76129 O WAT 6613 78.917 135.109 80.932 1.00 0.00 O ATOM 76130 H1 WAT 6613 79.188 135.013 80.019 1.00 0.00 H ATOM 76131 H2 WAT 6613 79.048 136.038 81.124 1.00 0.00 H TER 76133 WAT 6613 ATOM 76133 O WAT 6614 46.821 142.468 136.542 1.00 0.00 O ATOM 76134 H1 WAT 6614 46.918 143.364 136.864 1.00 0.00 H ATOM 76135 H2 WAT 6614 47.718 142.142 136.466 1.00 0.00 H TER 76137 WAT 6614 ATOM 76137 O WAT 6615 18.879 132.167 0.269 1.00 0.00 O ATOM 76138 H1 WAT 6615 18.402 131.343 0.168 1.00 0.00 H ATOM 76139 H2 WAT 6615 19.798 131.906 0.332 1.00 0.00 H TER 76141 WAT 6615 ATOM 76141 O WAT 6616 113.704 120.688 87.973 1.00 0.00 O ATOM 76142 H1 WAT 6616 113.282 119.877 87.688 1.00 0.00 H ATOM 76143 H2 WAT 6616 112.979 121.260 88.224 1.00 0.00 H TER 76145 WAT 6616 ATOM 76145 O WAT 6617 124.884 89.852 146.660 1.00 0.00 O ATOM 76146 H1 WAT 6617 125.739 89.435 146.764 1.00 0.00 H ATOM 76147 H2 WAT 6617 124.302 89.352 147.232 1.00 0.00 H TER 76149 WAT 6617 ATOM 76149 O WAT 6618 112.887 1.336 102.565 1.00 0.00 O ATOM 76150 H1 WAT 6618 113.527 0.924 101.985 1.00 0.00 H ATOM 76151 H2 WAT 6618 113.416 1.791 103.221 1.00 0.00 H TER 76153 WAT 6618 ATOM 76153 O WAT 6619 46.632 97.209 157.565 1.00 0.00 O ATOM 76154 H1 WAT 6619 46.504 96.577 156.858 1.00 0.00 H ATOM 76155 H2 WAT 6619 46.893 98.016 157.120 1.00 0.00 H TER 76157 WAT 6619 ATOM 76157 O WAT 6620 130.450 105.223 128.232 1.00 0.00 O ATOM 76158 H1 WAT 6620 131.082 105.552 128.872 1.00 0.00 H ATOM 76159 H2 WAT 6620 130.856 105.398 127.383 1.00 0.00 H TER 76161 WAT 6620 ATOM 76161 O WAT 6621 96.565 132.182 107.189 1.00 0.00 O ATOM 76162 H1 WAT 6621 96.863 131.273 107.198 1.00 0.00 H ATOM 76163 H2 WAT 6621 96.769 132.492 106.306 1.00 0.00 H TER 76165 WAT 6621 ATOM 76165 O WAT 6622 69.698 111.012 104.789 1.00 0.00 O ATOM 76166 H1 WAT 6622 70.050 110.347 105.381 1.00 0.00 H ATOM 76167 H2 WAT 6622 68.749 110.954 104.900 1.00 0.00 H TER 76169 WAT 6622 ATOM 76169 O WAT 6623 76.744 62.229 82.153 1.00 0.00 O ATOM 76170 H1 WAT 6623 77.463 61.681 82.469 1.00 0.00 H ATOM 76171 H2 WAT 6623 76.930 62.353 81.222 1.00 0.00 H TER 76173 WAT 6623 ATOM 76173 O WAT 6624 49.788 90.131 11.795 1.00 0.00 O ATOM 76174 H1 WAT 6624 49.223 90.701 11.273 1.00 0.00 H ATOM 76175 H2 WAT 6624 49.511 89.244 11.563 1.00 0.00 H TER 76177 WAT 6624 ATOM 76177 O WAT 6625 50.084 79.930 141.567 1.00 0.00 O ATOM 76178 H1 WAT 6625 50.335 80.844 141.433 1.00 0.00 H ATOM 76179 H2 WAT 6625 50.614 79.442 140.936 1.00 0.00 H TER 76181 WAT 6625 ATOM 76181 O WAT 6626 131.538 129.147 145.274 1.00 0.00 O ATOM 76182 H1 WAT 6626 130.693 129.164 145.722 1.00 0.00 H ATOM 76183 H2 WAT 6626 131.777 130.069 145.178 1.00 0.00 H TER 76185 WAT 6626 ATOM 76185 O WAT 6627 100.243 56.412 157.769 1.00 0.00 O ATOM 76186 H1 WAT 6627 100.919 55.878 157.351 1.00 0.00 H ATOM 76187 H2 WAT 6627 100.592 57.303 157.741 1.00 0.00 H TER 76189 WAT 6627 ATOM 76189 O WAT 6628 52.889 123.299 122.890 1.00 0.00 O ATOM 76190 H1 WAT 6628 52.721 122.357 122.906 1.00 0.00 H ATOM 76191 H2 WAT 6628 53.119 123.516 123.794 1.00 0.00 H TER 76193 WAT 6628 ATOM 76193 O WAT 6629 47.400 134.481 60.628 1.00 0.00 O ATOM 76194 H1 WAT 6629 47.358 134.240 59.703 1.00 0.00 H ATOM 76195 H2 WAT 6629 47.856 133.751 61.046 1.00 0.00 H TER 76197 WAT 6629 ATOM 76197 O WAT 6630 3.548 17.557 139.290 1.00 0.00 O ATOM 76198 H1 WAT 6630 4.049 18.372 139.316 1.00 0.00 H ATOM 76199 H2 WAT 6630 4.136 16.927 138.873 1.00 0.00 H TER 76201 WAT 6630 ATOM 76201 O WAT 6631 128.966 120.590 134.645 1.00 0.00 O ATOM 76202 H1 WAT 6631 129.630 120.045 135.068 1.00 0.00 H ATOM 76203 H2 WAT 6631 128.139 120.142 134.825 1.00 0.00 H TER 76205 WAT 6631 ATOM 76205 O WAT 6632 41.653 105.985 1.251 1.00 0.00 O ATOM 76206 H1 WAT 6632 41.077 106.035 2.013 1.00 0.00 H ATOM 76207 H2 WAT 6632 42.120 106.821 1.248 1.00 0.00 H TER 76209 WAT 6632 ATOM 76209 O WAT 6633 54.504 29.140 18.205 1.00 0.00 O ATOM 76210 H1 WAT 6633 54.829 29.515 17.387 1.00 0.00 H ATOM 76211 H2 WAT 6633 54.103 28.311 17.946 1.00 0.00 H TER 76213 WAT 6633 ATOM 76213 O WAT 6634 73.432 13.419 15.321 1.00 0.00 O ATOM 76214 H1 WAT 6634 72.808 13.943 15.824 1.00 0.00 H ATOM 76215 H2 WAT 6634 74.263 13.527 15.784 1.00 0.00 H TER 76217 WAT 6634 ATOM 76217 O WAT 6635 29.986 25.122 10.873 1.00 0.00 O ATOM 76218 H1 WAT 6635 30.934 25.257 10.843 1.00 0.00 H ATOM 76219 H2 WAT 6635 29.701 25.233 9.966 1.00 0.00 H TER 76221 WAT 6635 ATOM 76221 O WAT 6636 82.618 14.325 74.426 1.00 0.00 O ATOM 76222 H1 WAT 6636 83.538 14.289 74.685 1.00 0.00 H ATOM 76223 H2 WAT 6636 82.637 14.304 73.469 1.00 0.00 H TER 76225 WAT 6636 ATOM 76225 O WAT 6637 9.583 30.151 148.146 1.00 0.00 O ATOM 76226 H1 WAT 6637 8.634 30.122 148.026 1.00 0.00 H ATOM 76227 H2 WAT 6637 9.743 30.982 148.594 1.00 0.00 H TER 76229 WAT 6637 ATOM 76229 O WAT 6638 5.492 131.546 79.064 1.00 0.00 O ATOM 76230 H1 WAT 6638 5.351 130.971 78.312 1.00 0.00 H ATOM 76231 H2 WAT 6638 4.632 131.613 79.479 1.00 0.00 H TER 76233 WAT 6638 ATOM 76233 O WAT 6639 14.301 134.538 23.549 1.00 0.00 O ATOM 76234 H1 WAT 6639 13.891 135.244 24.048 1.00 0.00 H ATOM 76235 H2 WAT 6639 15.240 134.651 23.700 1.00 0.00 H TER 76237 WAT 6639 ATOM 76237 O WAT 6640 43.026 92.747 4.768 1.00 0.00 O ATOM 76238 H1 WAT 6640 42.419 93.411 5.096 1.00 0.00 H ATOM 76239 H2 WAT 6640 43.889 93.054 5.046 1.00 0.00 H TER 76241 WAT 6640 ATOM 76241 O WAT 6641 83.060 124.819 143.009 1.00 0.00 O ATOM 76242 H1 WAT 6641 83.963 125.019 143.258 1.00 0.00 H ATOM 76243 H2 WAT 6641 82.767 124.184 143.663 1.00 0.00 H TER 76245 WAT 6641 ATOM 76245 O WAT 6642 103.878 26.192 141.736 1.00 0.00 O ATOM 76246 H1 WAT 6642 103.771 25.425 141.173 1.00 0.00 H ATOM 76247 H2 WAT 6642 103.419 26.894 141.274 1.00 0.00 H TER 76249 WAT 6642 ATOM 76249 O WAT 6643 94.705 27.772 69.333 1.00 0.00 O ATOM 76250 H1 WAT 6643 94.902 28.423 68.660 1.00 0.00 H ATOM 76251 H2 WAT 6643 93.876 28.062 69.712 1.00 0.00 H TER 76253 WAT 6643 ATOM 76253 O WAT 6644 11.870 78.540 78.425 1.00 0.00 O ATOM 76254 H1 WAT 6644 11.709 79.417 78.773 1.00 0.00 H ATOM 76255 H2 WAT 6644 11.231 78.441 77.719 1.00 0.00 H TER 76257 WAT 6644 ATOM 76257 O WAT 6645 66.868 46.828 146.001 1.00 0.00 O ATOM 76258 H1 WAT 6645 66.489 47.693 145.847 1.00 0.00 H ATOM 76259 H2 WAT 6645 67.124 46.839 146.923 1.00 0.00 H TER 76261 WAT 6645 ATOM 76261 O WAT 6646 34.358 9.583 9.691 1.00 0.00 O ATOM 76262 H1 WAT 6646 34.244 8.644 9.836 1.00 0.00 H ATOM 76263 H2 WAT 6646 34.536 9.661 8.754 1.00 0.00 H TER 76265 WAT 6646 ATOM 76265 O WAT 6647 58.493 125.024 78.591 1.00 0.00 O ATOM 76266 H1 WAT 6647 57.729 125.101 78.019 1.00 0.00 H ATOM 76267 H2 WAT 6647 58.951 125.859 78.492 1.00 0.00 H TER 76269 WAT 6647 ATOM 76269 O WAT 6648 60.777 92.411 86.655 1.00 0.00 O ATOM 76270 H1 WAT 6648 60.993 91.849 85.910 1.00 0.00 H ATOM 76271 H2 WAT 6648 61.584 92.893 86.833 1.00 0.00 H TER 76273 WAT 6648 ATOM 76273 O WAT 6649 7.346 62.702 121.816 1.00 0.00 O ATOM 76274 H1 WAT 6649 6.764 62.326 122.476 1.00 0.00 H ATOM 76275 H2 WAT 6649 6.867 62.607 120.992 1.00 0.00 H TER 76277 WAT 6649 ATOM 76277 O WAT 6650 38.279 69.088 99.298 1.00 0.00 O ATOM 76278 H1 WAT 6650 37.831 68.896 100.122 1.00 0.00 H ATOM 76279 H2 WAT 6650 37.975 68.408 98.697 1.00 0.00 H TER 76281 WAT 6650 ATOM 76281 O WAT 6651 131.764 129.394 1.148 1.00 0.00 O ATOM 76282 H1 WAT 6651 130.848 129.271 1.399 1.00 0.00 H ATOM 76283 H2 WAT 6651 131.723 129.868 0.317 1.00 0.00 H TER 76285 WAT 6651 ATOM 76285 O WAT 6652 14.127 41.128 145.050 1.00 0.00 O ATOM 76286 H1 WAT 6652 14.637 41.877 144.739 1.00 0.00 H ATOM 76287 H2 WAT 6652 13.458 40.998 144.377 1.00 0.00 H TER 76289 WAT 6652 ATOM 76289 O WAT 6653 28.592 20.162 92.829 1.00 0.00 O ATOM 76290 H1 WAT 6653 28.969 19.517 92.231 1.00 0.00 H ATOM 76291 H2 WAT 6653 27.649 20.005 92.788 1.00 0.00 H TER 76293 WAT 6653 ATOM 76293 O WAT 6654 126.426 113.334 109.458 1.00 0.00 O ATOM 76294 H1 WAT 6654 127.086 113.700 108.868 1.00 0.00 H ATOM 76295 H2 WAT 6654 126.912 112.723 110.012 1.00 0.00 H TER 76297 WAT 6654 ATOM 76297 O WAT 6655 32.936 85.741 150.116 1.00 0.00 O ATOM 76298 H1 WAT 6655 33.292 85.132 149.468 1.00 0.00 H ATOM 76299 H2 WAT 6655 32.092 85.363 150.361 1.00 0.00 H TER 76301 WAT 6655 ATOM 76301 O WAT 6656 52.811 17.832 122.044 1.00 0.00 O ATOM 76302 H1 WAT 6656 53.079 17.373 121.248 1.00 0.00 H ATOM 76303 H2 WAT 6656 51.868 17.678 122.103 1.00 0.00 H TER 76305 WAT 6656 ATOM 76305 O WAT 6657 67.689 29.923 101.068 1.00 0.00 O ATOM 76306 H1 WAT 6657 66.940 29.327 101.038 1.00 0.00 H ATOM 76307 H2 WAT 6657 68.371 29.428 101.523 1.00 0.00 H TER 76309 WAT 6657 ATOM 76309 O WAT 6658 29.893 3.454 115.558 1.00 0.00 O ATOM 76310 H1 WAT 6658 30.243 2.637 115.914 1.00 0.00 H ATOM 76311 H2 WAT 6658 29.063 3.580 116.017 1.00 0.00 H TER 76313 WAT 6658 ATOM 76313 O WAT 6659 68.423 113.666 118.620 1.00 0.00 O ATOM 76314 H1 WAT 6659 67.773 114.227 119.044 1.00 0.00 H ATOM 76315 H2 WAT 6659 69.005 113.395 119.330 1.00 0.00 H TER 76317 WAT 6659 ATOM 76317 O WAT 6660 142.578 42.069 7.266 1.00 0.00 O ATOM 76318 H1 WAT 6660 142.782 42.866 6.777 1.00 0.00 H ATOM 76319 H2 WAT 6660 141.975 42.356 7.952 1.00 0.00 H TER 76321 WAT 6660 ATOM 76321 O WAT 6661 53.904 80.546 76.507 1.00 0.00 O ATOM 76322 H1 WAT 6661 53.449 80.083 77.210 1.00 0.00 H ATOM 76323 H2 WAT 6661 53.474 81.400 76.465 1.00 0.00 H TER 76325 WAT 6661 ATOM 76325 O WAT 6662 47.299 86.363 112.699 1.00 0.00 O ATOM 76326 H1 WAT 6662 46.704 86.234 111.961 1.00 0.00 H ATOM 76327 H2 WAT 6662 47.042 87.207 113.070 1.00 0.00 H TER 76329 WAT 6662 ATOM 76329 O WAT 6663 4.262 133.689 139.181 1.00 0.00 O ATOM 76330 H1 WAT 6663 5.074 133.223 138.981 1.00 0.00 H ATOM 76331 H2 WAT 6663 4.387 134.017 140.071 1.00 0.00 H TER 76333 WAT 6663 ATOM 76333 O WAT 6664 106.767 116.123 119.985 1.00 0.00 O ATOM 76334 H1 WAT 6664 107.379 115.524 119.557 1.00 0.00 H ATOM 76335 H2 WAT 6664 107.109 116.996 119.789 1.00 0.00 H TER 76337 WAT 6664 ATOM 76337 O WAT 6665 72.671 20.281 92.251 1.00 0.00 O ATOM 76338 H1 WAT 6665 72.259 19.792 91.538 1.00 0.00 H ATOM 76339 H2 WAT 6665 72.172 20.035 93.030 1.00 0.00 H TER 76341 WAT 6665 ATOM 76341 O WAT 6666 137.349 105.108 116.159 1.00 0.00 O ATOM 76342 H1 WAT 6666 137.593 104.853 115.269 1.00 0.00 H ATOM 76343 H2 WAT 6666 137.924 105.846 116.362 1.00 0.00 H TER 76345 WAT 6666 ATOM 76345 O WAT 6667 50.087 101.970 99.880 1.00 0.00 O ATOM 76346 H1 WAT 6667 49.428 102.553 100.256 1.00 0.00 H ATOM 76347 H2 WAT 6667 49.622 101.495 99.191 1.00 0.00 H TER 76349 WAT 6667 ATOM 76349 O WAT 6668 30.784 134.479 99.090 1.00 0.00 O ATOM 76350 H1 WAT 6668 30.491 135.234 99.601 1.00 0.00 H ATOM 76351 H2 WAT 6668 31.145 134.858 98.289 1.00 0.00 H TER 76353 WAT 6668 ATOM 76353 O WAT 6669 110.899 101.789 8.801 1.00 0.00 O ATOM 76354 H1 WAT 6669 110.860 101.196 9.551 1.00 0.00 H ATOM 76355 H2 WAT 6669 111.651 101.484 8.293 1.00 0.00 H TER 76357 WAT 6669 ATOM 76357 O WAT 6670 49.884 122.401 13.464 1.00 0.00 O ATOM 76358 H1 WAT 6670 49.775 122.647 14.383 1.00 0.00 H ATOM 76359 H2 WAT 6670 50.413 123.105 13.089 1.00 0.00 H TER 76361 WAT 6670 ATOM 76361 O WAT 6671 120.423 110.234 68.399 1.00 0.00 O ATOM 76362 H1 WAT 6671 120.046 110.113 67.528 1.00 0.00 H ATOM 76363 H2 WAT 6671 120.470 111.183 68.511 1.00 0.00 H TER 76365 WAT 6671 ATOM 76365 O WAT 6672 42.301 102.637 143.284 1.00 0.00 O ATOM 76366 H1 WAT 6672 41.680 103.158 143.793 1.00 0.00 H ATOM 76367 H2 WAT 6672 43.087 103.181 143.235 1.00 0.00 H TER 76369 WAT 6672 ATOM 76369 O WAT 6673 97.941 28.540 151.700 1.00 0.00 O ATOM 76370 H1 WAT 6673 97.012 28.373 151.538 1.00 0.00 H ATOM 76371 H2 WAT 6673 98.398 27.967 151.085 1.00 0.00 H TER 76373 WAT 6673 ATOM 76373 O WAT 6674 86.232 89.344 93.114 1.00 0.00 O ATOM 76374 H1 WAT 6674 85.557 88.890 93.618 1.00 0.00 H ATOM 76375 H2 WAT 6674 87.015 88.803 93.220 1.00 0.00 H TER 76377 WAT 6674 ATOM 76377 O WAT 6675 131.872 34.610 130.482 1.00 0.00 O ATOM 76378 H1 WAT 6675 132.117 34.493 131.400 1.00 0.00 H ATOM 76379 H2 WAT 6675 132.350 35.392 130.204 1.00 0.00 H TER 76381 WAT 6675 ATOM 76381 O WAT 6676 57.237 79.493 95.783 1.00 0.00 O ATOM 76382 H1 WAT 6676 58.059 79.829 95.426 1.00 0.00 H ATOM 76383 H2 WAT 6676 56.897 80.211 96.318 1.00 0.00 H TER 76385 WAT 6676 ATOM 76385 O WAT 6677 37.019 131.386 98.144 1.00 0.00 O ATOM 76386 H1 WAT 6677 37.673 130.688 98.148 1.00 0.00 H ATOM 76387 H2 WAT 6677 36.875 131.585 99.069 1.00 0.00 H TER 76389 WAT 6677 ATOM 76389 O WAT 6678 130.332 54.353 115.486 1.00 0.00 O ATOM 76390 H1 WAT 6678 130.898 54.090 116.211 1.00 0.00 H ATOM 76391 H2 WAT 6678 129.938 55.176 115.777 1.00 0.00 H TER 76393 WAT 6678 ATOM 76393 O WAT 6679 17.697 66.122 61.319 1.00 0.00 O ATOM 76394 H1 WAT 6679 17.996 66.996 61.572 1.00 0.00 H ATOM 76395 H2 WAT 6679 17.522 66.191 60.381 1.00 0.00 H TER 76397 WAT 6679 ATOM 76397 O WAT 6680 44.833 89.767 19.325 1.00 0.00 O ATOM 76398 H1 WAT 6680 44.986 90.584 18.850 1.00 0.00 H ATOM 76399 H2 WAT 6680 44.094 89.960 19.901 1.00 0.00 H TER 76401 WAT 6680 ATOM 76401 O WAT 6681 44.839 5.201 70.882 1.00 0.00 O ATOM 76402 H1 WAT 6681 44.770 4.915 71.793 1.00 0.00 H ATOM 76403 H2 WAT 6681 44.310 5.997 70.841 1.00 0.00 H TER 76405 WAT 6681 ATOM 76405 O WAT 6682 31.874 13.765 69.248 1.00 0.00 O ATOM 76406 H1 WAT 6682 32.685 13.655 68.751 1.00 0.00 H ATOM 76407 H2 WAT 6682 31.259 13.157 68.839 1.00 0.00 H TER 76409 WAT 6682 ATOM 76409 O WAT 6683 115.738 70.276 1.002 1.00 0.00 O ATOM 76410 H1 WAT 6683 115.162 70.872 0.524 1.00 0.00 H ATOM 76411 H2 WAT 6683 115.887 69.550 0.396 1.00 0.00 H TER 76413 WAT 6683 ATOM 76413 O WAT 6684 39.304 58.184 93.284 1.00 0.00 O ATOM 76414 H1 WAT 6684 39.643 58.036 94.167 1.00 0.00 H ATOM 76415 H2 WAT 6684 38.465 58.625 93.420 1.00 0.00 H TER 76417 WAT 6684 ATOM 76417 O WAT 6685 113.241 84.054 17.535 1.00 0.00 O ATOM 76418 H1 WAT 6685 113.521 83.207 17.880 1.00 0.00 H ATOM 76419 H2 WAT 6685 112.316 84.117 17.775 1.00 0.00 H TER 76421 WAT 6685 ATOM 76421 O WAT 6686 130.177 16.371 102.001 1.00 0.00 O ATOM 76422 H1 WAT 6686 130.893 16.942 101.721 1.00 0.00 H ATOM 76423 H2 WAT 6686 130.229 16.373 102.957 1.00 0.00 H TER 76425 WAT 6686 ATOM 76425 O WAT 6687 97.985 85.896 153.918 1.00 0.00 O ATOM 76426 H1 WAT 6687 98.881 86.013 154.234 1.00 0.00 H ATOM 76427 H2 WAT 6687 98.033 85.137 153.337 1.00 0.00 H TER 76429 WAT 6687 ATOM 76429 O WAT 6688 113.914 1.525 142.880 1.00 0.00 O ATOM 76430 H1 WAT 6688 113.838 0.616 143.171 1.00 0.00 H ATOM 76431 H2 WAT 6688 113.706 1.496 141.947 1.00 0.00 H TER 76433 WAT 6688 ATOM 76433 O WAT 6689 118.459 53.978 149.205 1.00 0.00 O ATOM 76434 H1 WAT 6689 117.713 54.556 149.046 1.00 0.00 H ATOM 76435 H2 WAT 6689 119.017 54.466 149.809 1.00 0.00 H TER 76437 WAT 6689 ATOM 76437 O WAT 6690 46.799 3.133 9.562 1.00 0.00 O ATOM 76438 H1 WAT 6690 46.684 3.145 10.512 1.00 0.00 H ATOM 76439 H2 WAT 6690 46.520 4.003 9.276 1.00 0.00 H TER 76441 WAT 6690 ATOM 76441 O WAT 6691 139.438 45.049 113.468 1.00 0.00 O ATOM 76442 H1 WAT 6691 139.648 45.828 112.953 1.00 0.00 H ATOM 76443 H2 WAT 6691 140.144 44.991 114.113 1.00 0.00 H TER 76445 WAT 6691 ATOM 76445 O WAT 6692 55.673 51.518 130.996 1.00 0.00 O ATOM 76446 H1 WAT 6692 54.755 51.596 130.737 1.00 0.00 H ATOM 76447 H2 WAT 6692 56.047 50.897 130.371 1.00 0.00 H TER 76449 WAT 6692 ATOM 76449 O WAT 6693 104.775 42.003 92.978 1.00 0.00 O ATOM 76450 H1 WAT 6693 104.799 41.065 93.167 1.00 0.00 H ATOM 76451 H2 WAT 6693 104.563 42.054 92.045 1.00 0.00 H TER 76453 WAT 6693 ATOM 76453 O WAT 6694 44.393 101.712 98.255 1.00 0.00 O ATOM 76454 H1 WAT 6694 44.727 101.676 97.359 1.00 0.00 H ATOM 76455 H2 WAT 6694 43.485 102.001 98.161 1.00 0.00 H TER 76457 WAT 6694 ATOM 76457 O WAT 6695 70.534 52.237 21.122 1.00 0.00 O ATOM 76458 H1 WAT 6695 70.389 53.180 21.199 1.00 0.00 H ATOM 76459 H2 WAT 6695 69.794 51.922 20.603 1.00 0.00 H TER 76461 WAT 6695 ATOM 76461 O WAT 6696 23.606 103.722 80.865 1.00 0.00 O ATOM 76462 H1 WAT 6696 24.484 104.102 80.827 1.00 0.00 H ATOM 76463 H2 WAT 6696 23.040 104.450 81.122 1.00 0.00 H TER 76465 WAT 6696 ATOM 76465 O WAT 6697 91.300 28.815 124.053 1.00 0.00 O ATOM 76466 H1 WAT 6697 91.399 28.119 123.404 1.00 0.00 H ATOM 76467 H2 WAT 6697 91.444 28.381 124.894 1.00 0.00 H TER 76469 WAT 6697 ATOM 76469 O WAT 6698 131.925 105.346 113.928 1.00 0.00 O ATOM 76470 H1 WAT 6698 132.854 105.539 113.802 1.00 0.00 H ATOM 76471 H2 WAT 6698 131.595 106.085 114.440 1.00 0.00 H TER 76473 WAT 6698 ATOM 76473 O WAT 6699 41.474 19.941 91.788 1.00 0.00 O ATOM 76474 H1 WAT 6699 41.662 19.008 91.687 1.00 0.00 H ATOM 76475 H2 WAT 6699 41.442 20.277 90.892 1.00 0.00 H TER 76477 WAT 6699 ATOM 76477 O WAT 6700 71.693 131.966 75.354 1.00 0.00 O ATOM 76478 H1 WAT 6700 70.767 131.958 75.115 1.00 0.00 H ATOM 76479 H2 WAT 6700 71.968 131.052 75.283 1.00 0.00 H TER 76481 WAT 6700 ATOM 76481 O WAT 6701 93.272 82.477 27.687 1.00 0.00 O ATOM 76482 H1 WAT 6701 94.205 82.306 27.561 1.00 0.00 H ATOM 76483 H2 WAT 6701 92.985 82.863 26.860 1.00 0.00 H TER 76485 WAT 6701 ATOM 76485 O WAT 6702 77.079 80.328 5.513 1.00 0.00 O ATOM 76486 H1 WAT 6702 76.924 79.840 4.705 1.00 0.00 H ATOM 76487 H2 WAT 6702 77.959 80.690 5.409 1.00 0.00 H TER 76489 WAT 6702 ATOM 76489 O WAT 6703 128.156 117.012 83.995 1.00 0.00 O ATOM 76490 H1 WAT 6703 128.368 116.458 83.244 1.00 0.00 H ATOM 76491 H2 WAT 6703 128.718 116.688 84.699 1.00 0.00 H TER 76493 WAT 6703 ATOM 76493 O WAT 6704 28.770 135.841 118.286 1.00 0.00 O ATOM 76494 H1 WAT 6704 27.934 135.658 117.859 1.00 0.00 H ATOM 76495 H2 WAT 6704 28.532 136.311 119.086 1.00 0.00 H TER 76497 WAT 6704 ATOM 76497 O WAT 6705 142.598 140.638 133.634 1.00 0.00 O ATOM 76498 H1 WAT 6705 141.931 140.407 132.987 1.00 0.00 H ATOM 76499 H2 WAT 6705 142.870 139.799 134.007 1.00 0.00 H TER 76501 WAT 6705 ATOM 76501 O WAT 6706 37.442 104.795 6.798 1.00 0.00 O ATOM 76502 H1 WAT 6706 38.388 104.886 6.684 1.00 0.00 H ATOM 76503 H2 WAT 6706 37.308 103.859 6.949 1.00 0.00 H TER 76505 WAT 6706 ATOM 76505 O WAT 6707 115.251 128.287 72.393 1.00 0.00 O ATOM 76506 H1 WAT 6707 115.910 128.217 73.083 1.00 0.00 H ATOM 76507 H2 WAT 6707 114.807 127.440 72.398 1.00 0.00 H TER 76509 WAT 6707 ATOM 76509 O WAT 6708 144.450 35.562 106.682 1.00 0.00 O ATOM 76510 H1 WAT 6708 144.526 35.982 107.539 1.00 0.00 H ATOM 76511 H2 WAT 6708 144.705 34.653 106.838 1.00 0.00 H TER 76513 WAT 6708 ATOM 76513 O WAT 6709 74.716 104.758 67.238 1.00 0.00 O ATOM 76514 H1 WAT 6709 73.988 104.175 67.022 1.00 0.00 H ATOM 76515 H2 WAT 6709 75.402 104.175 67.562 1.00 0.00 H TER 76517 WAT 6709 ATOM 76517 O WAT 6710 73.404 6.362 144.646 1.00 0.00 O ATOM 76518 H1 WAT 6710 73.722 6.319 143.744 1.00 0.00 H ATOM 76519 H2 WAT 6710 73.803 7.155 145.004 1.00 0.00 H TER 76521 WAT 6710 ATOM 76521 O WAT 6711 89.857 93.726 14.875 1.00 0.00 O ATOM 76522 H1 WAT 6711 89.950 93.513 15.804 1.00 0.00 H ATOM 76523 H2 WAT 6711 89.127 93.182 14.578 1.00 0.00 H TER 76525 WAT 6711 ATOM 76525 O WAT 6712 102.314 73.010 154.803 1.00 0.00 O ATOM 76526 H1 WAT 6712 103.045 72.752 155.364 1.00 0.00 H ATOM 76527 H2 WAT 6712 102.178 72.259 154.226 1.00 0.00 H TER 76529 WAT 6712 ATOM 76529 O WAT 6713 134.465 98.761 130.584 1.00 0.00 O ATOM 76530 H1 WAT 6713 133.706 98.635 130.015 1.00 0.00 H ATOM 76531 H2 WAT 6713 135.119 98.146 130.251 1.00 0.00 H TER 76533 WAT 6713 ATOM 76533 O WAT 6714 41.810 1.901 65.425 1.00 0.00 O ATOM 76534 H1 WAT 6714 41.595 1.956 64.494 1.00 0.00 H ATOM 76535 H2 WAT 6714 42.632 2.383 65.510 1.00 0.00 H TER 76537 WAT 6714 ATOM 76537 O WAT 6715 69.690 11.707 130.378 1.00 0.00 O ATOM 76538 H1 WAT 6715 70.427 12.316 130.421 1.00 0.00 H ATOM 76539 H2 WAT 6715 70.084 10.844 130.503 1.00 0.00 H TER 76541 WAT 6715 ATOM 76541 O WAT 6716 119.167 130.456 4.949 1.00 0.00 O ATOM 76542 H1 WAT 6716 119.696 131.073 4.443 1.00 0.00 H ATOM 76543 H2 WAT 6716 119.111 129.678 4.395 1.00 0.00 H TER 76545 WAT 6716 ATOM 76545 O WAT 6717 67.285 55.614 89.849 1.00 0.00 O ATOM 76546 H1 WAT 6717 67.498 55.710 88.920 1.00 0.00 H ATOM 76547 H2 WAT 6717 66.976 54.712 89.932 1.00 0.00 H TER 76549 WAT 6717 ATOM 76549 O WAT 6718 61.676 136.651 149.079 1.00 0.00 O ATOM 76550 H1 WAT 6718 61.990 137.523 149.320 1.00 0.00 H ATOM 76551 H2 WAT 6718 62.452 136.200 148.748 1.00 0.00 H TER 76553 WAT 6718 ATOM 76553 O WAT 6719 67.576 7.263 10.727 1.00 0.00 O ATOM 76554 H1 WAT 6719 67.270 7.005 9.857 1.00 0.00 H ATOM 76555 H2 WAT 6719 67.178 6.625 11.319 1.00 0.00 H TER 76557 WAT 6719 ATOM 76557 O WAT 6720 4.213 124.617 86.402 1.00 0.00 O ATOM 76558 H1 WAT 6720 4.358 125.288 87.069 1.00 0.00 H ATOM 76559 H2 WAT 6720 3.833 123.880 86.881 1.00 0.00 H TER 76561 WAT 6720 ATOM 76561 O WAT 6721 133.881 12.479 133.758 1.00 0.00 O ATOM 76562 H1 WAT 6721 133.227 11.783 133.700 1.00 0.00 H ATOM 76563 H2 WAT 6721 134.628 12.149 133.259 1.00 0.00 H TER 76565 WAT 6721 ATOM 76565 O WAT 6722 43.596 58.007 101.579 1.00 0.00 O ATOM 76566 H1 WAT 6722 42.880 58.486 101.162 1.00 0.00 H ATOM 76567 H2 WAT 6722 44.107 57.656 100.849 1.00 0.00 H TER 76569 WAT 6722 ATOM 76569 O WAT 6723 49.532 98.442 7.286 1.00 0.00 O ATOM 76570 H1 WAT 6723 49.934 97.696 7.730 1.00 0.00 H ATOM 76571 H2 WAT 6723 49.541 99.143 7.937 1.00 0.00 H TER 76573 WAT 6723 ATOM 76573 O WAT 6724 118.615 21.005 135.343 1.00 0.00 O ATOM 76574 H1 WAT 6724 118.941 21.664 134.730 1.00 0.00 H ATOM 76575 H2 WAT 6724 119.283 20.963 136.027 1.00 0.00 H TER 76577 WAT 6724 ATOM 76577 O WAT 6725 86.673 96.819 0.780 1.00 0.00 O ATOM 76578 H1 WAT 6725 87.042 97.682 0.594 1.00 0.00 H ATOM 76579 H2 WAT 6725 86.257 96.554 -0.040 1.00 0.00 H TER 76581 WAT 6725 ATOM 76581 O WAT 6726 93.573 113.599 74.272 1.00 0.00 O ATOM 76582 H1 WAT 6726 93.917 114.332 73.761 1.00 0.00 H ATOM 76583 H2 WAT 6726 93.536 112.871 73.651 1.00 0.00 H TER 76585 WAT 6726 ATOM 76585 O WAT 6727 68.664 25.338 67.171 1.00 0.00 O ATOM 76586 H1 WAT 6727 69.252 24.665 66.826 1.00 0.00 H ATOM 76587 H2 WAT 6727 67.876 24.859 67.425 1.00 0.00 H TER 76589 WAT 6727 ATOM 76589 O WAT 6728 9.312 121.106 130.088 1.00 0.00 O ATOM 76590 H1 WAT 6728 8.527 121.132 129.540 1.00 0.00 H ATOM 76591 H2 WAT 6728 9.873 121.798 129.737 1.00 0.00 H TER 76593 WAT 6728 ATOM 76593 O WAT 6729 137.363 56.729 93.903 1.00 0.00 O ATOM 76594 H1 WAT 6729 138.041 56.057 93.973 1.00 0.00 H ATOM 76595 H2 WAT 6729 137.833 57.556 94.015 1.00 0.00 H TER 76597 WAT 6729 ATOM 76597 O WAT 6730 106.209 93.202 17.098 1.00 0.00 O ATOM 76598 H1 WAT 6730 107.067 93.628 17.102 1.00 0.00 H ATOM 76599 H2 WAT 6730 105.925 93.227 18.012 1.00 0.00 H TER 76601 WAT 6730 ATOM 76601 O WAT 6731 71.829 3.533 128.610 1.00 0.00 O ATOM 76602 H1 WAT 6731 71.118 4.066 128.965 1.00 0.00 H ATOM 76603 H2 WAT 6731 71.388 2.795 128.189 1.00 0.00 H TER 76605 WAT 6731 ATOM 76605 O WAT 6732 77.116 71.250 85.051 1.00 0.00 O ATOM 76606 H1 WAT 6732 76.236 71.170 84.683 1.00 0.00 H ATOM 76607 H2 WAT 6732 77.286 72.192 85.064 1.00 0.00 H TER 76609 WAT 6732 ATOM 76609 O WAT 6733 117.750 131.707 135.753 1.00 0.00 O ATOM 76610 H1 WAT 6733 118.225 130.913 135.506 1.00 0.00 H ATOM 76611 H2 WAT 6733 117.376 132.027 134.932 1.00 0.00 H TER 76613 WAT 6733 ATOM 76613 O WAT 6734 31.687 75.556 124.717 1.00 0.00 O ATOM 76614 H1 WAT 6734 32.040 74.958 125.376 1.00 0.00 H ATOM 76615 H2 WAT 6734 30.740 75.531 124.854 1.00 0.00 H TER 76617 WAT 6734 ATOM 76617 O WAT 6735 121.076 29.653 147.832 1.00 0.00 O ATOM 76618 H1 WAT 6735 121.700 29.460 148.531 1.00 0.00 H ATOM 76619 H2 WAT 6735 121.468 29.268 147.048 1.00 0.00 H TER 76621 WAT 6735 ATOM 76621 O WAT 6736 78.274 50.548 87.407 1.00 0.00 O ATOM 76622 H1 WAT 6736 79.169 50.225 87.508 1.00 0.00 H ATOM 76623 H2 WAT 6736 78.268 51.386 87.871 1.00 0.00 H TER 76625 WAT 6736 ATOM 76625 O WAT 6737 30.100 29.275 68.785 1.00 0.00 O ATOM 76626 H1 WAT 6737 29.602 28.465 68.676 1.00 0.00 H ATOM 76627 H2 WAT 6737 30.133 29.410 69.732 1.00 0.00 H TER 76629 WAT 6737 ATOM 76629 O WAT 6738 112.344 22.894 106.689 1.00 0.00 O ATOM 76630 H1 WAT 6738 112.123 23.809 106.859 1.00 0.00 H ATOM 76631 H2 WAT 6738 112.858 22.626 107.451 1.00 0.00 H TER 76633 WAT 6738 ATOM 76633 O WAT 6739 39.444 92.804 130.602 1.00 0.00 O ATOM 76634 H1 WAT 6739 39.458 93.749 130.755 1.00 0.00 H ATOM 76635 H2 WAT 6739 39.166 92.430 131.439 1.00 0.00 H TER 76637 WAT 6739 ATOM 76637 O WAT 6740 76.079 71.373 151.758 1.00 0.00 O ATOM 76638 H1 WAT 6740 76.035 71.602 150.829 1.00 0.00 H ATOM 76639 H2 WAT 6740 76.812 70.761 151.819 1.00 0.00 H TER 76641 WAT 6740 ATOM 76641 O WAT 6741 2.467 85.851 12.826 1.00 0.00 O ATOM 76642 H1 WAT 6741 2.467 84.946 13.138 1.00 0.00 H ATOM 76643 H2 WAT 6741 2.280 86.373 13.606 1.00 0.00 H TER 76645 WAT 6741 ATOM 76645 O WAT 6742 66.645 26.799 79.257 1.00 0.00 O ATOM 76646 H1 WAT 6742 67.042 27.486 79.793 1.00 0.00 H ATOM 76647 H2 WAT 6742 67.250 26.060 79.328 1.00 0.00 H TER 76649 WAT 6742 ATOM 76649 O WAT 6743 36.188 68.350 130.999 1.00 0.00 O ATOM 76650 H1 WAT 6743 36.718 67.805 131.581 1.00 0.00 H ATOM 76651 H2 WAT 6743 36.280 67.941 130.138 1.00 0.00 H TER 76653 WAT 6743 ATOM 76653 O WAT 6744 50.176 98.841 17.499 1.00 0.00 O ATOM 76654 H1 WAT 6744 49.532 98.401 18.053 1.00 0.00 H ATOM 76655 H2 WAT 6744 50.502 99.563 18.036 1.00 0.00 H TER 76657 WAT 6744 ATOM 76657 O WAT 6745 95.046 83.179 158.197 1.00 0.00 O ATOM 76658 H1 WAT 6745 95.426 83.502 159.015 1.00 0.00 H ATOM 76659 H2 WAT 6745 94.999 82.230 158.314 1.00 0.00 H TER 76661 WAT 6745 ATOM 76661 O WAT 6746 69.074 50.437 8.789 1.00 0.00 O ATOM 76662 H1 WAT 6746 69.780 49.884 9.124 1.00 0.00 H ATOM 76663 H2 WAT 6746 68.585 49.868 8.195 1.00 0.00 H TER 76665 WAT 6746 ATOM 76665 O WAT 6747 45.064 76.327 17.846 1.00 0.00 O ATOM 76666 H1 WAT 6747 45.575 77.099 17.603 1.00 0.00 H ATOM 76667 H2 WAT 6747 45.313 76.151 18.753 1.00 0.00 H TER 76669 WAT 6747 ATOM 76669 O WAT 6748 71.834 128.982 69.136 1.00 0.00 O ATOM 76670 H1 WAT 6748 72.326 129.801 69.189 1.00 0.00 H ATOM 76671 H2 WAT 6748 70.924 129.257 69.026 1.00 0.00 H TER 76673 WAT 6748 ATOM 76673 O WAT 6749 89.048 121.042 19.527 1.00 0.00 O ATOM 76674 H1 WAT 6749 89.209 120.555 20.335 1.00 0.00 H ATOM 76675 H2 WAT 6749 89.244 120.419 18.828 1.00 0.00 H TER 76677 WAT 6749 ATOM 76677 O WAT 6750 94.348 42.490 100.775 1.00 0.00 O ATOM 76678 H1 WAT 6750 94.968 42.943 101.346 1.00 0.00 H ATOM 76679 H2 WAT 6750 94.085 41.716 101.273 1.00 0.00 H TER 76681 WAT 6750 ATOM 76681 O WAT 6751 37.548 117.466 144.656 1.00 0.00 O ATOM 76682 H1 WAT 6751 36.889 117.514 143.964 1.00 0.00 H ATOM 76683 H2 WAT 6751 37.107 117.017 145.377 1.00 0.00 H TER 76685 WAT 6751 ATOM 76685 O WAT 6752 104.875 100.500 109.550 1.00 0.00 O ATOM 76686 H1 WAT 6752 105.050 99.982 110.336 1.00 0.00 H ATOM 76687 H2 WAT 6752 105.382 100.070 108.862 1.00 0.00 H TER 76689 WAT 6752 ATOM 76689 O WAT 6753 123.995 84.857 4.949 1.00 0.00 O ATOM 76690 H1 WAT 6753 124.254 84.367 4.169 1.00 0.00 H ATOM 76691 H2 WAT 6753 123.648 84.193 5.545 1.00 0.00 H TER 76693 WAT 6753 ATOM 76693 O WAT 6754 107.013 35.371 140.047 1.00 0.00 O ATOM 76694 H1 WAT 6754 107.628 34.901 140.610 1.00 0.00 H ATOM 76695 H2 WAT 6754 107.416 36.230 139.917 1.00 0.00 H TER 76697 WAT 6754 ATOM 76697 O WAT 6755 79.626 124.014 67.087 1.00 0.00 O ATOM 76698 H1 WAT 6755 80.164 124.571 67.650 1.00 0.00 H ATOM 76699 H2 WAT 6755 80.258 123.493 66.592 1.00 0.00 H TER 76701 WAT 6755 ATOM 76701 O WAT 6756 115.717 82.017 94.977 1.00 0.00 O ATOM 76702 H1 WAT 6756 115.076 82.721 94.874 1.00 0.00 H ATOM 76703 H2 WAT 6756 115.547 81.664 95.850 1.00 0.00 H TER 76705 WAT 6756 ATOM 76705 O WAT 6757 20.395 3.191 154.890 1.00 0.00 O ATOM 76706 H1 WAT 6757 20.597 3.419 153.982 1.00 0.00 H ATOM 76707 H2 WAT 6757 20.916 2.406 155.061 1.00 0.00 H TER 76709 WAT 6757 ATOM 76709 O WAT 6758 9.849 95.960 141.342 1.00 0.00 O ATOM 76710 H1 WAT 6758 9.009 95.512 141.236 1.00 0.00 H ATOM 76711 H2 WAT 6758 10.296 95.470 142.032 1.00 0.00 H TER 76713 WAT 6758 ATOM 76713 O WAT 6759 98.365 4.718 154.158 1.00 0.00 O ATOM 76714 H1 WAT 6759 98.843 4.003 153.738 1.00 0.00 H ATOM 76715 H2 WAT 6759 98.344 4.480 155.085 1.00 0.00 H TER 76717 WAT 6759 ATOM 76717 O WAT 6760 49.288 54.960 61.147 1.00 0.00 O ATOM 76718 H1 WAT 6760 48.696 54.986 60.395 1.00 0.00 H ATOM 76719 H2 WAT 6760 49.520 55.876 61.300 1.00 0.00 H TER 76721 WAT 6760 ATOM 76721 O WAT 6761 30.377 29.898 118.756 1.00 0.00 O ATOM 76722 H1 WAT 6761 30.792 30.654 118.341 1.00 0.00 H ATOM 76723 H2 WAT 6761 29.986 29.411 118.031 1.00 0.00 H TER 76725 WAT 6761 ATOM 76725 O WAT 6762 114.389 98.949 118.262 1.00 0.00 O ATOM 76726 H1 WAT 6762 115.310 99.036 118.013 1.00 0.00 H ATOM 76727 H2 WAT 6762 114.203 99.739 118.768 1.00 0.00 H TER 76729 WAT 6762 ATOM 76729 O WAT 6763 69.196 67.888 70.281 1.00 0.00 O ATOM 76730 H1 WAT 6763 69.099 67.204 70.944 1.00 0.00 H ATOM 76731 H2 WAT 6763 68.313 68.012 69.935 1.00 0.00 H TER 76733 WAT 6763 ATOM 76733 O WAT 6764 27.028 122.150 150.230 1.00 0.00 O ATOM 76734 H1 WAT 6764 27.894 121.814 149.998 1.00 0.00 H ATOM 76735 H2 WAT 6764 26.993 123.018 149.829 1.00 0.00 H TER 76737 WAT 6764 ATOM 76737 O WAT 6765 11.038 8.013 150.559 1.00 0.00 O ATOM 76738 H1 WAT 6765 11.156 7.069 150.453 1.00 0.00 H ATOM 76739 H2 WAT 6765 10.113 8.161 150.362 1.00 0.00 H TER 76741 WAT 6765 ATOM 76741 O WAT 6766 114.609 40.775 129.929 1.00 0.00 O ATOM 76742 H1 WAT 6766 114.823 40.885 130.856 1.00 0.00 H ATOM 76743 H2 WAT 6766 113.691 41.040 129.862 1.00 0.00 H TER 76745 WAT 6766 ATOM 76745 O WAT 6767 113.337 116.794 78.553 1.00 0.00 O ATOM 76746 H1 WAT 6767 113.268 116.334 77.716 1.00 0.00 H ATOM 76747 H2 WAT 6767 112.559 117.351 78.585 1.00 0.00 H TER 76749 WAT 6767 ATOM 76749 O WAT 6768 12.049 59.231 154.862 1.00 0.00 O ATOM 76750 H1 WAT 6768 11.517 58.626 154.345 1.00 0.00 H ATOM 76751 H2 WAT 6768 11.484 59.992 154.997 1.00 0.00 H TER 76753 WAT 6768 ATOM 76753 O WAT 6769 85.701 69.733 24.671 1.00 0.00 O ATOM 76754 H1 WAT 6769 86.203 70.481 24.995 1.00 0.00 H ATOM 76755 H2 WAT 6769 85.163 69.465 25.415 1.00 0.00 H TER 76757 WAT 6769 ATOM 76757 O WAT 6770 93.129 34.718 81.420 1.00 0.00 O ATOM 76758 H1 WAT 6770 94.066 34.554 81.526 1.00 0.00 H ATOM 76759 H2 WAT 6770 93.019 34.883 80.484 1.00 0.00 H TER 76761 WAT 6770 ATOM 76761 O WAT 6771 132.864 27.165 113.532 1.00 0.00 O ATOM 76762 H1 WAT 6771 132.305 27.923 113.702 1.00 0.00 H ATOM 76763 H2 WAT 6771 132.270 26.416 113.576 1.00 0.00 H TER 76765 WAT 6771 ATOM 76765 O WAT 6772 25.660 94.337 9.530 1.00 0.00 O ATOM 76766 H1 WAT 6772 26.089 94.571 10.353 1.00 0.00 H ATOM 76767 H2 WAT 6772 25.393 95.175 9.152 1.00 0.00 H TER 76769 WAT 6772 ATOM 76769 O WAT 6773 110.841 19.158 23.569 1.00 0.00 O ATOM 76770 H1 WAT 6773 110.263 19.608 24.185 1.00 0.00 H ATOM 76771 H2 WAT 6773 111.572 18.851 24.106 1.00 0.00 H TER 76773 WAT 6773 ATOM 76773 O WAT 6774 12.593 113.676 125.222 1.00 0.00 O ATOM 76774 H1 WAT 6774 11.938 114.315 125.505 1.00 0.00 H ATOM 76775 H2 WAT 6774 12.568 113.716 124.265 1.00 0.00 H TER 76777 WAT 6774 ATOM 76777 O WAT 6775 21.641 125.156 71.150 1.00 0.00 O ATOM 76778 H1 WAT 6775 21.463 125.253 70.214 1.00 0.00 H ATOM 76779 H2 WAT 6775 22.207 124.386 71.207 1.00 0.00 H TER 76781 WAT 6775 ATOM 76781 O WAT 6776 27.585 109.008 62.532 1.00 0.00 O ATOM 76782 H1 WAT 6776 27.250 108.456 63.239 1.00 0.00 H ATOM 76783 H2 WAT 6776 27.004 109.768 62.525 1.00 0.00 H TER 76785 WAT 6776 ATOM 76785 O WAT 6777 24.200 26.526 17.691 1.00 0.00 O ATOM 76786 H1 WAT 6777 23.643 26.180 16.993 1.00 0.00 H ATOM 76787 H2 WAT 6777 24.098 25.902 18.410 1.00 0.00 H TER 76789 WAT 6777 ATOM 76789 O WAT 6778 86.343 138.492 93.178 1.00 0.00 O ATOM 76790 H1 WAT 6778 86.611 139.116 92.504 1.00 0.00 H ATOM 76791 H2 WAT 6778 87.011 137.806 93.149 1.00 0.00 H TER 76793 WAT 6778 ATOM 76793 O WAT 6779 52.057 110.377 15.804 1.00 0.00 O ATOM 76794 H1 WAT 6779 52.040 109.435 15.638 1.00 0.00 H ATOM 76795 H2 WAT 6779 52.149 110.451 16.754 1.00 0.00 H TER 76797 WAT 6779 ATOM 76797 O WAT 6780 88.825 81.853 156.236 1.00 0.00 O ATOM 76798 H1 WAT 6780 88.855 82.528 155.559 1.00 0.00 H ATOM 76799 H2 WAT 6780 89.380 82.192 156.938 1.00 0.00 H TER 76801 WAT 6780 ATOM 76801 O WAT 6781 53.050 9.136 82.514 1.00 0.00 O ATOM 76802 H1 WAT 6781 52.870 9.616 81.706 1.00 0.00 H ATOM 76803 H2 WAT 6781 53.769 9.618 82.923 1.00 0.00 H TER 76805 WAT 6781 ATOM 76805 O WAT 6782 50.170 141.273 110.914 1.00 0.00 O ATOM 76806 H1 WAT 6782 49.573 141.979 111.162 1.00 0.00 H ATOM 76807 H2 WAT 6782 50.103 140.641 111.630 1.00 0.00 H TER 76809 WAT 6782 ATOM 76809 O WAT 6783 60.838 11.635 133.842 1.00 0.00 O ATOM 76810 H1 WAT 6783 61.128 12.448 133.427 1.00 0.00 H ATOM 76811 H2 WAT 6783 60.936 11.797 134.780 1.00 0.00 H TER 76813 WAT 6783 ATOM 76813 O WAT 6784 113.433 45.565 155.493 1.00 0.00 O ATOM 76814 H1 WAT 6784 113.986 44.853 155.816 1.00 0.00 H ATOM 76815 H2 WAT 6784 113.469 46.227 156.184 1.00 0.00 H TER 76817 WAT 6784 ATOM 76817 O WAT 6785 1.521 116.212 77.198 1.00 0.00 O ATOM 76818 H1 WAT 6785 1.815 117.104 77.017 1.00 0.00 H ATOM 76819 H2 WAT 6785 0.566 116.259 77.147 1.00 0.00 H TER 76821 WAT 6785 ATOM 76821 O WAT 6786 40.906 77.230 23.723 1.00 0.00 O ATOM 76822 H1 WAT 6786 39.977 77.080 23.898 1.00 0.00 H ATOM 76823 H2 WAT 6786 41.358 76.828 24.465 1.00 0.00 H TER 76825 WAT 6786 ATOM 76825 O WAT 6787 129.442 112.642 156.557 1.00 0.00 O ATOM 76826 H1 WAT 6787 129.431 111.732 156.260 1.00 0.00 H ATOM 76827 H2 WAT 6787 129.275 113.154 155.766 1.00 0.00 H TER 76829 WAT 6787 ATOM 76829 O WAT 6788 115.823 120.926 14.897 1.00 0.00 O ATOM 76830 H1 WAT 6788 115.758 120.674 13.976 1.00 0.00 H ATOM 76831 H2 WAT 6788 116.704 121.289 14.985 1.00 0.00 H TER 76833 WAT 6788 ATOM 76833 O WAT 6789 21.032 53.400 54.747 1.00 0.00 O ATOM 76834 H1 WAT 6789 20.274 52.830 54.880 1.00 0.00 H ATOM 76835 H2 WAT 6789 20.966 53.677 53.833 1.00 0.00 H TER 76837 WAT 6789 ATOM 76837 O WAT 6790 94.856 129.950 135.725 1.00 0.00 O ATOM 76838 H1 WAT 6790 94.489 129.740 134.866 1.00 0.00 H ATOM 76839 H2 WAT 6790 94.876 130.907 135.749 1.00 0.00 H TER 76841 WAT 6790 ATOM 76841 O WAT 6791 78.616 133.345 72.358 1.00 0.00 O ATOM 76842 H1 WAT 6791 77.934 132.673 72.369 1.00 0.00 H ATOM 76843 H2 WAT 6791 79.140 133.167 73.139 1.00 0.00 H TER 76845 WAT 6791 ATOM 76845 O WAT 6792 52.722 142.704 68.649 1.00 0.00 O ATOM 76846 H1 WAT 6792 52.020 143.024 68.083 1.00 0.00 H ATOM 76847 H2 WAT 6792 53.363 143.415 68.662 1.00 0.00 H TER 76849 WAT 6792 ATOM 76849 O WAT 6793 85.524 130.361 13.152 1.00 0.00 O ATOM 76850 H1 WAT 6793 85.873 130.812 13.920 1.00 0.00 H ATOM 76851 H2 WAT 6793 85.163 131.061 12.607 1.00 0.00 H TER 76853 WAT 6793 ATOM 76853 O WAT 6794 38.756 4.129 144.251 1.00 0.00 O ATOM 76854 H1 WAT 6794 39.522 4.082 144.823 1.00 0.00 H ATOM 76855 H2 WAT 6794 38.174 3.441 144.574 1.00 0.00 H TER 76857 WAT 6794 ATOM 76857 O WAT 6795 102.931 10.927 120.341 1.00 0.00 O ATOM 76858 H1 WAT 6795 103.019 11.522 121.086 1.00 0.00 H ATOM 76859 H2 WAT 6795 103.404 10.138 120.608 1.00 0.00 H TER 76861 WAT 6795 ATOM 76861 O WAT 6796 65.542 21.385 20.197 1.00 0.00 O ATOM 76862 H1 WAT 6796 66.127 20.706 19.860 1.00 0.00 H ATOM 76863 H2 WAT 6796 65.838 22.190 19.771 1.00 0.00 H TER 76865 WAT 6796 ATOM 76865 O WAT 6797 53.161 121.576 155.797 1.00 0.00 O ATOM 76866 H1 WAT 6797 52.986 122.400 156.251 1.00 0.00 H ATOM 76867 H2 WAT 6797 52.615 121.614 155.012 1.00 0.00 H TER 76869 WAT 6797 ATOM 76869 O WAT 6798 122.000 74.266 121.103 1.00 0.00 O ATOM 76870 H1 WAT 6798 121.266 74.445 121.692 1.00 0.00 H ATOM 76871 H2 WAT 6798 122.152 75.096 120.651 1.00 0.00 H TER 76873 WAT 6798 ATOM 76873 O WAT 6799 87.916 111.031 11.651 1.00 0.00 O ATOM 76874 H1 WAT 6799 87.943 111.766 11.038 1.00 0.00 H ATOM 76875 H2 WAT 6799 88.653 110.477 11.393 1.00 0.00 H TER 76877 WAT 6799 ATOM 76877 O WAT 6800 94.010 84.709 76.806 1.00 0.00 O ATOM 76878 H1 WAT 6800 94.692 85.249 77.206 1.00 0.00 H ATOM 76879 H2 WAT 6800 93.196 85.182 76.983 1.00 0.00 H TER 76881 WAT 6800 ATOM 76881 O WAT 6801 24.424 14.816 77.825 1.00 0.00 O ATOM 76882 H1 WAT 6801 24.001 14.041 78.196 1.00 0.00 H ATOM 76883 H2 WAT 6801 24.844 15.241 78.573 1.00 0.00 H TER 76885 WAT 6801 ATOM 76885 O WAT 6802 35.055 105.046 0.224 1.00 0.00 O ATOM 76886 H1 WAT 6802 34.431 105.749 0.048 1.00 0.00 H ATOM 76887 H2 WAT 6802 34.913 104.823 1.144 1.00 0.00 H TER 76889 WAT 6802 ATOM 76889 O WAT 6803 121.676 77.918 11.247 1.00 0.00 O ATOM 76890 H1 WAT 6803 121.764 77.394 12.043 1.00 0.00 H ATOM 76891 H2 WAT 6803 120.743 77.880 11.036 1.00 0.00 H TER 76893 WAT 6803 ATOM 76893 O WAT 6804 102.043 105.757 7.594 1.00 0.00 O ATOM 76894 H1 WAT 6804 101.907 105.986 8.513 1.00 0.00 H ATOM 76895 H2 WAT 6804 101.422 105.047 7.430 1.00 0.00 H TER 76897 WAT 6804 ATOM 76897 O WAT 6805 84.431 118.628 61.033 1.00 0.00 O ATOM 76898 H1 WAT 6805 84.805 117.770 61.234 1.00 0.00 H ATOM 76899 H2 WAT 6805 84.552 118.727 60.089 1.00 0.00 H TER 76901 WAT 6805 ATOM 76901 O WAT 6806 60.501 59.411 100.888 1.00 0.00 O ATOM 76902 H1 WAT 6806 59.575 59.652 100.930 1.00 0.00 H ATOM 76903 H2 WAT 6806 60.567 58.621 101.426 1.00 0.00 H TER 76905 WAT 6806 ATOM 76905 O WAT 6807 89.589 56.236 131.375 1.00 0.00 O ATOM 76906 H1 WAT 6807 89.297 55.332 131.260 1.00 0.00 H ATOM 76907 H2 WAT 6807 90.376 56.167 131.915 1.00 0.00 H TER 76909 WAT 6807 ATOM 76909 O WAT 6808 122.822 123.467 6.593 1.00 0.00 O ATOM 76910 H1 WAT 6808 122.253 123.054 5.943 1.00 0.00 H ATOM 76911 H2 WAT 6808 122.221 123.805 7.257 1.00 0.00 H TER 76913 WAT 6808 ATOM 76913 O WAT 6809 78.839 50.737 1.302 1.00 0.00 O ATOM 76914 H1 WAT 6809 78.336 50.153 0.735 1.00 0.00 H ATOM 76915 H2 WAT 6809 79.740 50.656 0.991 1.00 0.00 H TER 76917 WAT 6809 ATOM 76917 O WAT 6810 103.855 67.681 70.815 1.00 0.00 O ATOM 76918 H1 WAT 6810 103.729 66.740 70.944 1.00 0.00 H ATOM 76919 H2 WAT 6810 104.064 68.016 71.686 1.00 0.00 H TER 76921 WAT 6810 ATOM 76921 O WAT 6811 87.688 77.052 72.010 1.00 0.00 O ATOM 76922 H1 WAT 6811 87.655 77.834 72.561 1.00 0.00 H ATOM 76923 H2 WAT 6811 88.248 77.301 71.274 1.00 0.00 H TER 76925 WAT 6811 ATOM 76925 O WAT 6812 142.803 133.647 141.910 1.00 0.00 O ATOM 76926 H1 WAT 6812 142.667 133.157 141.100 1.00 0.00 H ATOM 76927 H2 WAT 6812 142.056 134.244 141.957 1.00 0.00 H TER 76929 WAT 6812 ATOM 76929 O WAT 6813 61.990 4.794 74.356 1.00 0.00 O ATOM 76930 H1 WAT 6813 62.072 5.736 74.505 1.00 0.00 H ATOM 76931 H2 WAT 6813 61.081 4.594 74.582 1.00 0.00 H TER 76933 WAT 6813 ATOM 76933 O WAT 6814 34.011 111.490 74.976 1.00 0.00 O ATOM 76934 H1 WAT 6814 33.690 111.642 74.087 1.00 0.00 H ATOM 76935 H2 WAT 6814 33.287 111.046 75.419 1.00 0.00 H TER 76937 WAT 6814 ATOM 76937 O WAT 6815 84.526 85.223 139.182 1.00 0.00 O ATOM 76938 H1 WAT 6815 85.068 85.806 139.713 1.00 0.00 H ATOM 76939 H2 WAT 6815 84.683 85.504 138.281 1.00 0.00 H TER 76941 WAT 6815 ATOM 76941 O WAT 6816 111.931 110.108 153.644 1.00 0.00 O ATOM 76942 H1 WAT 6816 112.734 110.624 153.723 1.00 0.00 H ATOM 76943 H2 WAT 6816 112.142 109.434 152.998 1.00 0.00 H TER 76945 WAT 6816 ATOM 76945 O WAT 6817 36.037 13.281 97.698 1.00 0.00 O ATOM 76946 H1 WAT 6817 36.171 14.074 97.179 1.00 0.00 H ATOM 76947 H2 WAT 6817 35.158 13.381 98.066 1.00 0.00 H TER 76949 WAT 6817 ATOM 76949 O WAT 6818 45.634 116.058 155.176 1.00 0.00 O ATOM 76950 H1 WAT 6818 45.961 115.401 154.561 1.00 0.00 H ATOM 76951 H2 WAT 6818 46.416 116.535 155.455 1.00 0.00 H TER 76953 WAT 6818 ATOM 76953 O WAT 6819 85.836 53.963 77.680 1.00 0.00 O ATOM 76954 H1 WAT 6819 85.105 54.392 78.125 1.00 0.00 H ATOM 76955 H2 WAT 6819 85.486 53.114 77.410 1.00 0.00 H TER 76957 WAT 6819 ATOM 76957 O WAT 6820 42.780 117.402 70.042 1.00 0.00 O ATOM 76958 H1 WAT 6820 42.649 116.929 70.864 1.00 0.00 H ATOM 76959 H2 WAT 6820 41.897 117.635 69.756 1.00 0.00 H TER 76961 WAT 6820 ATOM 76961 O WAT 6821 44.216 18.309 56.575 1.00 0.00 O ATOM 76962 H1 WAT 6821 44.295 17.487 57.059 1.00 0.00 H ATOM 76963 H2 WAT 6821 44.504 18.979 57.195 1.00 0.00 H TER 76965 WAT 6821 ATOM 76965 O WAT 6822 21.058 37.778 14.880 1.00 0.00 O ATOM 76966 H1 WAT 6822 20.206 37.597 15.277 1.00 0.00 H ATOM 76967 H2 WAT 6822 21.492 36.925 14.846 1.00 0.00 H TER 76969 WAT 6822 ATOM 76969 O WAT 6823 7.460 45.641 122.473 1.00 0.00 O ATOM 76970 H1 WAT 6823 6.520 45.510 122.600 1.00 0.00 H ATOM 76971 H2 WAT 6823 7.696 45.024 121.780 1.00 0.00 H TER 76973 WAT 6823 ATOM 76973 O WAT 6824 42.262 1.892 117.867 1.00 0.00 O ATOM 76974 H1 WAT 6824 42.942 2.302 117.332 1.00 0.00 H ATOM 76975 H2 WAT 6824 41.705 2.619 118.145 1.00 0.00 H TER 76977 WAT 6824 ATOM 76977 O WAT 6825 16.807 124.762 154.892 1.00 0.00 O ATOM 76978 H1 WAT 6825 17.322 124.547 155.669 1.00 0.00 H ATOM 76979 H2 WAT 6825 16.052 125.244 155.231 1.00 0.00 H TER 76981 WAT 6825 ATOM 76981 O WAT 6826 102.320 30.607 105.796 1.00 0.00 O ATOM 76982 H1 WAT 6826 103.145 30.141 105.657 1.00 0.00 H ATOM 76983 H2 WAT 6826 102.004 30.801 104.913 1.00 0.00 H TER 76985 WAT 6826 ATOM 76985 O WAT 6827 95.578 95.545 158.132 1.00 0.00 O ATOM 76986 H1 WAT 6827 96.467 95.290 157.885 1.00 0.00 H ATOM 76987 H2 WAT 6827 95.390 95.030 158.916 1.00 0.00 H TER 76989 WAT 6827 ATOM 76989 O WAT 6828 73.885 80.116 85.998 1.00 0.00 O ATOM 76990 H1 WAT 6828 74.494 80.843 85.868 1.00 0.00 H ATOM 76991 H2 WAT 6828 74.379 79.339 85.735 1.00 0.00 H TER 76993 WAT 6828 ATOM 76993 O WAT 6829 84.732 1.379 5.554 1.00 0.00 O ATOM 76994 H1 WAT 6829 83.802 1.537 5.719 1.00 0.00 H ATOM 76995 H2 WAT 6829 85.088 2.242 5.344 1.00 0.00 H TER 76997 WAT 6829 ATOM 76997 O WAT 6830 105.281 28.211 118.277 1.00 0.00 O ATOM 76998 H1 WAT 6830 105.356 27.266 118.141 1.00 0.00 H ATOM 76999 H2 WAT 6830 106.020 28.582 117.796 1.00 0.00 H TER 77001 WAT 6830 ATOM 77001 O WAT 6831 13.120 95.564 95.905 1.00 0.00 O ATOM 77002 H1 WAT 6831 13.619 95.030 96.523 1.00 0.00 H ATOM 77003 H2 WAT 6831 12.252 95.640 96.300 1.00 0.00 H TER 77005 WAT 6831 ATOM 77005 O WAT 6832 0.113 31.050 13.896 1.00 0.00 O ATOM 77006 H1 WAT 6832 0.785 31.425 14.465 1.00 0.00 H ATOM 77007 H2 WAT 6832 0.240 31.488 13.054 1.00 0.00 H TER 77009 WAT 6832 ATOM 77009 O WAT 6833 40.692 34.340 92.398 1.00 0.00 O ATOM 77010 H1 WAT 6833 39.922 34.190 91.850 1.00 0.00 H ATOM 77011 H2 WAT 6833 41.435 34.173 91.817 1.00 0.00 H TER 77013 WAT 6833 ATOM 77013 O WAT 6834 62.850 37.644 1.357 1.00 0.00 O ATOM 77014 H1 WAT 6834 62.206 38.215 1.775 1.00 0.00 H ATOM 77015 H2 WAT 6834 63.447 37.399 2.065 1.00 0.00 H TER 77017 WAT 6834 ATOM 77017 O WAT 6835 39.437 25.564 125.599 1.00 0.00 O ATOM 77018 H1 WAT 6835 39.860 25.293 126.414 1.00 0.00 H ATOM 77019 H2 WAT 6835 40.065 25.333 124.914 1.00 0.00 H TER 77021 WAT 6835 ATOM 77021 O WAT 6836 77.624 9.919 98.181 1.00 0.00 O ATOM 77022 H1 WAT 6836 78.178 9.152 98.034 1.00 0.00 H ATOM 77023 H2 WAT 6836 77.702 10.428 97.374 1.00 0.00 H TER 77025 WAT 6836 ATOM 77025 O WAT 6837 100.650 105.141 132.802 1.00 0.00 O ATOM 77026 H1 WAT 6837 99.988 105.060 132.116 1.00 0.00 H ATOM 77027 H2 WAT 6837 100.175 104.971 133.615 1.00 0.00 H TER 77029 WAT 6837 ATOM 77029 O WAT 6838 95.446 30.710 2.830 1.00 0.00 O ATOM 77030 H1 WAT 6838 95.268 30.544 3.755 1.00 0.00 H ATOM 77031 H2 WAT 6838 94.673 30.377 2.374 1.00 0.00 H TER 77033 WAT 6838 ATOM 77033 O WAT 6839 69.981 51.764 98.865 1.00 0.00 O ATOM 77034 H1 WAT 6839 69.187 51.453 98.431 1.00 0.00 H ATOM 77035 H2 WAT 6839 69.702 52.544 99.345 1.00 0.00 H TER 77037 WAT 6839 ATOM 77037 O WAT 6840 116.398 57.637 13.649 1.00 0.00 O ATOM 77038 H1 WAT 6840 115.991 57.377 12.823 1.00 0.00 H ATOM 77039 H2 WAT 6840 116.252 58.581 13.701 1.00 0.00 H TER 77041 WAT 6840 ATOM 77041 O WAT 6841 22.896 110.142 25.736 1.00 0.00 O ATOM 77042 H1 WAT 6841 23.586 109.586 25.375 1.00 0.00 H ATOM 77043 H2 WAT 6841 23.364 110.816 26.228 1.00 0.00 H TER 77045 WAT 6841 ATOM 77045 O WAT 6842 135.980 7.036 99.053 1.00 0.00 O ATOM 77046 H1 WAT 6842 135.855 6.109 98.848 1.00 0.00 H ATOM 77047 H2 WAT 6842 135.219 7.268 99.586 1.00 0.00 H TER 77049 WAT 6842 ATOM 77049 O WAT 6843 1.680 140.143 147.557 1.00 0.00 O ATOM 77050 H1 WAT 6843 1.599 140.059 146.607 1.00 0.00 H ATOM 77051 H2 WAT 6843 1.580 139.249 147.885 1.00 0.00 H TER 77053 WAT 6843 ATOM 77053 O WAT 6844 82.710 12.487 124.177 1.00 0.00 O ATOM 77054 H1 WAT 6844 82.482 11.935 123.429 1.00 0.00 H ATOM 77055 H2 WAT 6844 83.666 12.471 124.204 1.00 0.00 H TER 77057 WAT 6844 ATOM 77057 O WAT 6845 60.511 46.259 101.238 1.00 0.00 O ATOM 77058 H1 WAT 6845 60.663 46.829 100.484 1.00 0.00 H ATOM 77059 H2 WAT 6845 61.372 46.165 101.644 1.00 0.00 H TER 77061 WAT 6845 ATOM 77061 O WAT 6846 47.794 120.866 67.310 1.00 0.00 O ATOM 77062 H1 WAT 6846 47.047 120.300 67.116 1.00 0.00 H ATOM 77063 H2 WAT 6846 48.225 120.992 66.465 1.00 0.00 H TER 77065 WAT 6846 ATOM 77065 O WAT 6847 43.775 46.955 88.543 1.00 0.00 O ATOM 77066 H1 WAT 6847 44.139 46.070 88.505 1.00 0.00 H ATOM 77067 H2 WAT 6847 43.566 47.167 87.633 1.00 0.00 H TER 77069 WAT 6847 ATOM 77069 O WAT 6848 9.116 31.502 125.683 1.00 0.00 O ATOM 77070 H1 WAT 6848 8.703 32.214 126.172 1.00 0.00 H ATOM 77071 H2 WAT 6848 9.391 31.905 124.860 1.00 0.00 H TER 77073 WAT 6848 ATOM 77073 O WAT 6849 34.133 28.292 3.305 1.00 0.00 O ATOM 77074 H1 WAT 6849 33.609 27.964 4.036 1.00 0.00 H ATOM 77075 H2 WAT 6849 34.736 27.576 3.103 1.00 0.00 H TER 77077 WAT 6849 ATOM 77077 O WAT 6850 91.797 55.104 87.495 1.00 0.00 O ATOM 77078 H1 WAT 6850 91.602 54.817 86.603 1.00 0.00 H ATOM 77079 H2 WAT 6850 91.862 54.292 87.998 1.00 0.00 H TER 77081 WAT 6850 ATOM 77081 O WAT 6851 78.502 26.670 149.324 1.00 0.00 O ATOM 77082 H1 WAT 6851 79.401 26.984 149.230 1.00 0.00 H ATOM 77083 H2 WAT 6851 78.565 25.723 149.203 1.00 0.00 H TER 77085 WAT 6851 ATOM 77085 O WAT 6852 123.079 120.410 92.074 1.00 0.00 O ATOM 77086 H1 WAT 6852 122.550 121.207 92.035 1.00 0.00 H ATOM 77087 H2 WAT 6852 122.444 119.707 92.214 1.00 0.00 H TER 77089 WAT 6852 ATOM 77089 O WAT 6853 142.401 49.992 155.340 1.00 0.00 O ATOM 77090 H1 WAT 6853 141.465 49.990 155.141 1.00 0.00 H ATOM 77091 H2 WAT 6853 142.549 49.168 155.804 1.00 0.00 H TER 77093 WAT 6853 ATOM 77093 O WAT 6854 91.365 85.329 146.696 1.00 0.00 O ATOM 77094 H1 WAT 6854 91.953 85.154 145.962 1.00 0.00 H ATOM 77095 H2 WAT 6854 90.986 86.187 146.500 1.00 0.00 H TER 77097 WAT 6854 ATOM 77097 O WAT 6855 47.596 95.190 122.183 1.00 0.00 O ATOM 77098 H1 WAT 6855 47.770 94.531 122.855 1.00 0.00 H ATOM 77099 H2 WAT 6855 47.588 94.698 121.362 1.00 0.00 H TER 77101 WAT 6855 ATOM 77101 O WAT 6856 139.534 37.690 119.836 1.00 0.00 O ATOM 77102 H1 WAT 6856 139.927 37.979 119.013 1.00 0.00 H ATOM 77103 H2 WAT 6856 140.259 37.300 120.324 1.00 0.00 H TER 77105 WAT 6856 ATOM 77105 O WAT 6857 32.575 9.109 19.116 1.00 0.00 O ATOM 77106 H1 WAT 6857 31.665 9.190 19.402 1.00 0.00 H ATOM 77107 H2 WAT 6857 32.916 8.364 19.610 1.00 0.00 H TER 77109 WAT 6857 ATOM 77109 O WAT 6858 87.079 132.793 77.688 1.00 0.00 O ATOM 77110 H1 WAT 6858 87.879 132.727 77.166 1.00 0.00 H ATOM 77111 H2 WAT 6858 87.022 133.720 77.922 1.00 0.00 H TER 77113 WAT 6858 ATOM 77113 O WAT 6859 51.334 112.760 84.138 1.00 0.00 O ATOM 77114 H1 WAT 6859 50.713 113.195 84.723 1.00 0.00 H ATOM 77115 H2 WAT 6859 52.141 113.267 84.226 1.00 0.00 H TER 77117 WAT 6859 ATOM 77117 O WAT 6860 101.646 87.959 130.073 1.00 0.00 O ATOM 77118 H1 WAT 6860 101.606 87.130 130.548 1.00 0.00 H ATOM 77119 H2 WAT 6860 100.936 88.483 130.444 1.00 0.00 H TER 77121 WAT 6860 ATOM 77121 O WAT 6861 113.120 62.497 127.180 1.00 0.00 O ATOM 77122 H1 WAT 6861 113.042 63.397 126.863 1.00 0.00 H ATOM 77123 H2 WAT 6861 112.230 62.147 127.130 1.00 0.00 H TER 77125 WAT 6861 ATOM 77125 O WAT 6862 118.464 141.888 153.339 1.00 0.00 O ATOM 77126 H1 WAT 6862 118.389 142.527 152.630 1.00 0.00 H ATOM 77127 H2 WAT 6862 119.150 142.240 153.906 1.00 0.00 H TER 77129 WAT 6862 ATOM 77129 O WAT 6863 8.516 106.479 158.606 1.00 0.00 O ATOM 77130 H1 WAT 6863 8.641 107.412 158.433 1.00 0.00 H ATOM 77131 H2 WAT 6863 8.474 106.078 157.738 1.00 0.00 H TER 77133 WAT 6863 ATOM 77133 O WAT 6864 80.103 45.987 137.252 1.00 0.00 O ATOM 77134 H1 WAT 6864 79.723 45.134 137.462 1.00 0.00 H ATOM 77135 H2 WAT 6864 79.561 46.321 136.537 1.00 0.00 H TER 77137 WAT 6864 ATOM 77137 O WAT 6865 8.128 20.451 158.188 1.00 0.00 O ATOM 77138 H1 WAT 6865 7.643 21.032 158.774 1.00 0.00 H ATOM 77139 H2 WAT 6865 7.778 20.642 157.318 1.00 0.00 H TER 77141 WAT 6865 ATOM 77141 O WAT 6866 113.174 108.805 64.602 1.00 0.00 O ATOM 77142 H1 WAT 6866 112.339 108.337 64.619 1.00 0.00 H ATOM 77143 H2 WAT 6866 113.711 108.313 63.981 1.00 0.00 H TER 77145 WAT 6866 ATOM 77145 O WAT 6867 28.241 27.975 5.302 1.00 0.00 O ATOM 77146 H1 WAT 6867 27.350 28.320 5.248 1.00 0.00 H ATOM 77147 H2 WAT 6867 28.468 27.755 4.399 1.00 0.00 H TER 77149 WAT 6867 ATOM 77149 O WAT 6868 113.079 61.215 96.720 1.00 0.00 O ATOM 77150 H1 WAT 6868 112.177 61.524 96.807 1.00 0.00 H ATOM 77151 H2 WAT 6868 113.352 61.514 95.853 1.00 0.00 H TER 77153 WAT 6868 ATOM 77153 O WAT 6869 121.544 24.963 144.329 1.00 0.00 O ATOM 77154 H1 WAT 6869 122.004 24.156 144.096 1.00 0.00 H ATOM 77155 H2 WAT 6869 121.161 25.266 143.506 1.00 0.00 H TER 77157 WAT 6869 ATOM 77157 O WAT 6870 141.430 84.065 26.161 1.00 0.00 O ATOM 77158 H1 WAT 6870 141.309 83.176 25.826 1.00 0.00 H ATOM 77159 H2 WAT 6870 140.795 84.140 26.873 1.00 0.00 H TER 77161 WAT 6870 ATOM 77161 O WAT 6871 45.309 123.504 107.674 1.00 0.00 O ATOM 77162 H1 WAT 6871 44.959 122.672 107.356 1.00 0.00 H ATOM 77163 H2 WAT 6871 45.120 124.127 106.972 1.00 0.00 H TER 77165 WAT 6871 ATOM 77165 O WAT 6872 43.340 108.393 100.632 1.00 0.00 O ATOM 77166 H1 WAT 6872 44.175 107.982 100.856 1.00 0.00 H ATOM 77167 H2 WAT 6872 43.132 108.052 99.762 1.00 0.00 H TER 77169 WAT 6872 ATOM 77169 O WAT 6873 53.141 46.781 113.775 1.00 0.00 O ATOM 77170 H1 WAT 6873 52.871 45.882 113.587 1.00 0.00 H ATOM 77171 H2 WAT 6873 53.719 46.705 114.534 1.00 0.00 H TER 77173 WAT 6873 ATOM 77173 O WAT 6874 59.533 69.076 80.400 1.00 0.00 O ATOM 77174 H1 WAT 6874 59.156 69.475 81.184 1.00 0.00 H ATOM 77175 H2 WAT 6874 58.880 68.434 80.120 1.00 0.00 H TER 77177 WAT 6874 ATOM 77177 O WAT 6875 10.876 128.933 7.542 1.00 0.00 O ATOM 77178 H1 WAT 6875 11.655 128.445 7.276 1.00 0.00 H ATOM 77179 H2 WAT 6875 11.210 129.787 7.817 1.00 0.00 H TER 77181 WAT 6875 ATOM 77181 O WAT 6876 124.168 73.765 139.224 1.00 0.00 O ATOM 77182 H1 WAT 6876 123.837 73.008 138.741 1.00 0.00 H ATOM 77183 H2 WAT 6876 123.884 74.521 138.710 1.00 0.00 H TER 77185 WAT 6876 ATOM 77185 O WAT 6877 90.355 10.070 111.763 1.00 0.00 O ATOM 77186 H1 WAT 6877 90.695 9.985 112.654 1.00 0.00 H ATOM 77187 H2 WAT 6877 90.741 9.334 111.288 1.00 0.00 H TER 77189 WAT 6877 ATOM 77189 O WAT 6878 22.928 116.206 94.431 1.00 0.00 O ATOM 77190 H1 WAT 6878 22.303 116.862 94.124 1.00 0.00 H ATOM 77191 H2 WAT 6878 23.161 115.711 93.646 1.00 0.00 H TER 77193 WAT 6878 ATOM 77193 O WAT 6879 99.428 113.520 106.756 1.00 0.00 O ATOM 77194 H1 WAT 6879 98.545 113.799 106.513 1.00 0.00 H ATOM 77195 H2 WAT 6879 99.949 114.322 106.725 1.00 0.00 H TER 77197 WAT 6879 ATOM 77197 O WAT 6880 111.271 75.498 135.739 1.00 0.00 O ATOM 77198 H1 WAT 6880 111.861 75.712 136.462 1.00 0.00 H ATOM 77199 H2 WAT 6880 111.582 76.034 135.009 1.00 0.00 H TER 77201 WAT 6880 ATOM 77201 O WAT 6881 109.887 117.592 105.238 1.00 0.00 O ATOM 77202 H1 WAT 6881 108.991 117.923 105.297 1.00 0.00 H ATOM 77203 H2 WAT 6881 109.825 116.836 104.655 1.00 0.00 H TER 77205 WAT 6881 ATOM 77205 O WAT 6882 53.417 57.872 156.581 1.00 0.00 O ATOM 77206 H1 WAT 6882 52.587 58.240 156.278 1.00 0.00 H ATOM 77207 H2 WAT 6882 53.988 57.902 155.813 1.00 0.00 H TER 77209 WAT 6882 ATOM 77209 O WAT 6883 66.368 110.606 63.054 1.00 0.00 O ATOM 77210 H1 WAT 6883 66.347 111.555 62.930 1.00 0.00 H ATOM 77211 H2 WAT 6883 65.465 110.373 63.270 1.00 0.00 H TER 77213 WAT 6883 ATOM 77213 O WAT 6884 34.285 48.960 156.033 1.00 0.00 O ATOM 77214 H1 WAT 6884 34.190 49.889 155.822 1.00 0.00 H ATOM 77215 H2 WAT 6884 34.665 48.572 155.245 1.00 0.00 H TER 77217 WAT 6884 ATOM 77217 O WAT 6885 140.745 95.424 136.442 1.00 0.00 O ATOM 77218 H1 WAT 6885 141.205 95.481 135.604 1.00 0.00 H ATOM 77219 H2 WAT 6885 140.719 94.487 136.637 1.00 0.00 H TER 77221 WAT 6885 ATOM 77221 O WAT 6886 3.930 136.356 88.865 1.00 0.00 O ATOM 77222 H1 WAT 6886 3.266 136.493 88.190 1.00 0.00 H ATOM 77223 H2 WAT 6886 3.698 135.517 89.263 1.00 0.00 H TER 77225 WAT 6886 ATOM 77225 O WAT 6887 48.535 25.282 138.476 1.00 0.00 O ATOM 77226 H1 WAT 6887 49.443 25.585 138.499 1.00 0.00 H ATOM 77227 H2 WAT 6887 48.583 24.413 138.076 1.00 0.00 H TER 77229 WAT 6887 ATOM 77229 O WAT 6888 117.038 144.806 110.345 1.00 0.00 O ATOM 77230 H1 WAT 6888 116.789 144.197 111.041 1.00 0.00 H ATOM 77231 H2 WAT 6888 116.246 144.900 109.816 1.00 0.00 H TER 77233 WAT 6888 ATOM 77233 O WAT 6889 51.544 4.130 90.471 1.00 0.00 O ATOM 77234 H1 WAT 6889 51.436 4.441 89.572 1.00 0.00 H ATOM 77235 H2 WAT 6889 51.456 4.917 91.009 1.00 0.00 H TER 77237 WAT 6889 ATOM 77237 O WAT 6890 5.775 62.026 7.128 1.00 0.00 O ATOM 77238 H1 WAT 6890 5.420 61.498 7.842 1.00 0.00 H ATOM 77239 H2 WAT 6890 5.864 62.904 7.500 1.00 0.00 H TER 77241 WAT 6890 ATOM 77241 O WAT 6891 87.497 25.175 132.782 1.00 0.00 O ATOM 77242 H1 WAT 6891 86.910 24.439 132.610 1.00 0.00 H ATOM 77243 H2 WAT 6891 87.232 25.496 133.644 1.00 0.00 H TER 77245 WAT 6891 ATOM 77245 O WAT 6892 119.805 89.702 154.089 1.00 0.00 O ATOM 77246 H1 WAT 6892 118.867 89.892 154.116 1.00 0.00 H ATOM 77247 H2 WAT 6892 120.217 90.551 153.926 1.00 0.00 H TER 77249 WAT 6892 ATOM 77249 O WAT 6893 53.967 75.152 139.262 1.00 0.00 O ATOM 77250 H1 WAT 6893 54.824 75.003 138.863 1.00 0.00 H ATOM 77251 H2 WAT 6893 53.516 75.736 138.652 1.00 0.00 H TER 77253 WAT 6893 ATOM 77253 O WAT 6894 4.740 138.594 75.152 1.00 0.00 O ATOM 77254 H1 WAT 6894 4.821 139.483 75.498 1.00 0.00 H ATOM 77255 H2 WAT 6894 5.615 138.381 74.830 1.00 0.00 H TER 77257 WAT 6894 ATOM 77257 O WAT 6895 104.675 123.557 65.551 1.00 0.00 O ATOM 77258 H1 WAT 6895 104.961 124.333 65.070 1.00 0.00 H ATOM 77259 H2 WAT 6895 104.175 123.050 64.912 1.00 0.00 H TER 77261 WAT 6895 ATOM 77261 O WAT 6896 84.485 17.270 85.670 1.00 0.00 O ATOM 77262 H1 WAT 6896 85.077 16.645 86.090 1.00 0.00 H ATOM 77263 H2 WAT 6896 84.265 17.893 86.363 1.00 0.00 H TER 77265 WAT 6896 ATOM 77265 O WAT 6897 79.243 26.574 119.531 1.00 0.00 O ATOM 77266 H1 WAT 6897 79.791 27.312 119.796 1.00 0.00 H ATOM 77267 H2 WAT 6897 78.357 26.828 119.790 1.00 0.00 H TER 77269 WAT 6897 ATOM 77269 O WAT 6898 27.219 82.297 140.503 1.00 0.00 O ATOM 77270 H1 WAT 6898 27.218 82.009 139.590 1.00 0.00 H ATOM 77271 H2 WAT 6898 26.471 82.891 140.568 1.00 0.00 H TER 77273 WAT 6898 ATOM 77273 O WAT 6899 138.925 49.748 130.825 1.00 0.00 O ATOM 77274 H1 WAT 6899 138.637 50.658 130.895 1.00 0.00 H ATOM 77275 H2 WAT 6899 139.689 49.782 130.249 1.00 0.00 H TER 77277 WAT 6899 ATOM 77277 O WAT 6900 86.383 39.573 70.561 1.00 0.00 O ATOM 77278 H1 WAT 6900 85.443 39.701 70.687 1.00 0.00 H ATOM 77279 H2 WAT 6900 86.763 40.440 70.703 1.00 0.00 H TER 77281 WAT 6900 ATOM 77281 O WAT 6901 43.237 86.452 6.763 1.00 0.00 O ATOM 77282 H1 WAT 6901 44.033 86.927 7.001 1.00 0.00 H ATOM 77283 H2 WAT 6901 43.517 85.540 6.684 1.00 0.00 H TER 77285 WAT 6901 ATOM 77285 O WAT 6902 60.133 93.880 0.977 1.00 0.00 O ATOM 77286 H1 WAT 6902 60.539 94.393 0.279 1.00 0.00 H ATOM 77287 H2 WAT 6902 59.664 93.182 0.519 1.00 0.00 H TER 77289 WAT 6902 ATOM 77289 O WAT 6903 137.451 29.378 153.516 1.00 0.00 O ATOM 77290 H1 WAT 6903 137.065 29.853 152.779 1.00 0.00 H ATOM 77291 H2 WAT 6903 136.997 28.536 153.522 1.00 0.00 H TER 77293 WAT 6903 ATOM 77293 O WAT 6904 40.849 83.625 59.259 1.00 0.00 O ATOM 77294 H1 WAT 6904 40.168 82.953 59.290 1.00 0.00 H ATOM 77295 H2 WAT 6904 40.821 84.036 60.123 1.00 0.00 H TER 77297 WAT 6904 ATOM 77297 O WAT 6905 118.240 79.155 61.514 1.00 0.00 O ATOM 77298 H1 WAT 6905 119.037 79.507 61.116 1.00 0.00 H ATOM 77299 H2 WAT 6905 117.827 78.649 60.815 1.00 0.00 H TER 77301 WAT 6905 ATOM 77301 O WAT 6906 45.628 138.000 97.730 1.00 0.00 O ATOM 77302 H1 WAT 6906 45.983 137.367 97.105 1.00 0.00 H ATOM 77303 H2 WAT 6906 46.366 138.209 98.303 1.00 0.00 H TER 77305 WAT 6906 ATOM 77305 O WAT 6907 23.470 101.365 14.039 1.00 0.00 O ATOM 77306 H1 WAT 6907 24.247 101.891 14.225 1.00 0.00 H ATOM 77307 H2 WAT 6907 22.832 101.638 14.697 1.00 0.00 H TER 77309 WAT 6907 ATOM 77309 O WAT 6908 38.872 49.151 116.499 1.00 0.00 O ATOM 77310 H1 WAT 6908 39.682 48.992 116.014 1.00 0.00 H ATOM 77311 H2 WAT 6908 38.504 48.279 116.643 1.00 0.00 H TER 77313 WAT 6908 ATOM 77313 O WAT 6909 105.161 128.193 6.643 1.00 0.00 O ATOM 77314 H1 WAT 6909 105.250 128.836 5.939 1.00 0.00 H ATOM 77315 H2 WAT 6909 106.007 128.210 7.091 1.00 0.00 H TER 77317 WAT 6909 ATOM 77317 O WAT 6910 59.005 96.953 5.549 1.00 0.00 O ATOM 77318 H1 WAT 6910 58.254 97.011 4.959 1.00 0.00 H ATOM 77319 H2 WAT 6910 58.640 96.628 6.371 1.00 0.00 H TER 77321 WAT 6910 ATOM 77321 O WAT 6911 114.077 77.292 93.199 1.00 0.00 O ATOM 77322 H1 WAT 6911 114.822 76.692 93.206 1.00 0.00 H ATOM 77323 H2 WAT 6911 114.466 78.157 93.073 1.00 0.00 H TER 77325 WAT 6911 ATOM 77325 O WAT 6912 46.211 6.350 9.913 1.00 0.00 O ATOM 77326 H1 WAT 6912 45.912 6.416 10.820 1.00 0.00 H ATOM 77327 H2 WAT 6912 46.862 7.046 9.825 1.00 0.00 H TER 77329 WAT 6912 ATOM 77329 O WAT 6913 76.761 32.067 150.355 1.00 0.00 O ATOM 77330 H1 WAT 6913 77.240 32.647 149.763 1.00 0.00 H ATOM 77331 H2 WAT 6913 75.846 32.155 150.087 1.00 0.00 H TER 77333 WAT 6913 ATOM 77333 O WAT 6914 103.465 120.178 156.469 1.00 0.00 O ATOM 77334 H1 WAT 6914 103.736 119.457 157.037 1.00 0.00 H ATOM 77335 H2 WAT 6914 102.660 119.868 156.055 1.00 0.00 H TER 77337 WAT 6914 ATOM 77337 O WAT 6915 61.991 91.266 80.323 1.00 0.00 O ATOM 77338 H1 WAT 6915 61.092 91.378 80.632 1.00 0.00 H ATOM 77339 H2 WAT 6915 62.067 90.328 80.143 1.00 0.00 H TER 77341 WAT 6915 ATOM 77341 O WAT 6916 36.317 55.925 127.633 1.00 0.00 O ATOM 77342 H1 WAT 6916 36.658 55.149 128.079 1.00 0.00 H ATOM 77343 H2 WAT 6916 35.467 56.083 128.044 1.00 0.00 H TER 77345 WAT 6916 ATOM 77345 O WAT 6917 122.654 143.184 13.086 1.00 0.00 O ATOM 77346 H1 WAT 6917 122.784 144.119 13.241 1.00 0.00 H ATOM 77347 H2 WAT 6917 122.093 143.144 12.312 1.00 0.00 H TER 77349 WAT 6917 ATOM 77349 O WAT 6918 120.552 18.323 126.604 1.00 0.00 O ATOM 77350 H1 WAT 6918 119.871 18.273 125.933 1.00 0.00 H ATOM 77351 H2 WAT 6918 121.000 19.151 126.429 1.00 0.00 H TER 77353 WAT 6918 ATOM 77353 O WAT 6919 34.793 91.750 11.524 1.00 0.00 O ATOM 77354 H1 WAT 6919 33.950 91.574 11.942 1.00 0.00 H ATOM 77355 H2 WAT 6919 35.374 91.986 12.247 1.00 0.00 H TER 77357 WAT 6919 ATOM 77357 O WAT 6920 122.579 63.680 61.379 1.00 0.00 O ATOM 77358 H1 WAT 6920 123.399 63.638 61.871 1.00 0.00 H ATOM 77359 H2 WAT 6920 122.308 62.766 61.286 1.00 0.00 H TER 77361 WAT 6920 ATOM 77361 O WAT 6921 101.565 124.727 83.506 1.00 0.00 O ATOM 77362 H1 WAT 6921 101.552 124.796 84.460 1.00 0.00 H ATOM 77363 H2 WAT 6921 102.314 124.161 83.317 1.00 0.00 H TER 77365 WAT 6921 ATOM 77365 O WAT 6922 84.438 77.539 84.242 1.00 0.00 O ATOM 77366 H1 WAT 6922 84.578 77.548 83.295 1.00 0.00 H ATOM 77367 H2 WAT 6922 85.317 77.604 84.615 1.00 0.00 H TER 77369 WAT 6922 ATOM 77369 O WAT 6923 57.820 84.298 24.432 1.00 0.00 O ATOM 77370 H1 WAT 6923 58.380 83.740 24.972 1.00 0.00 H ATOM 77371 H2 WAT 6923 57.028 83.779 24.292 1.00 0.00 H TER 77373 WAT 6923 ATOM 77373 O WAT 6924 6.704 22.958 139.521 1.00 0.00 O ATOM 77374 H1 WAT 6924 7.269 23.446 138.921 1.00 0.00 H ATOM 77375 H2 WAT 6924 5.918 22.769 139.009 1.00 0.00 H TER 77377 WAT 6924 ATOM 77377 O WAT 6925 122.473 36.486 107.113 1.00 0.00 O ATOM 77378 H1 WAT 6925 122.942 37.250 106.778 1.00 0.00 H ATOM 77379 H2 WAT 6925 122.522 36.573 108.065 1.00 0.00 H TER 77381 WAT 6925 ATOM 77381 O WAT 6926 84.777 18.568 59.231 1.00 0.00 O ATOM 77382 H1 WAT 6926 84.150 18.689 59.944 1.00 0.00 H ATOM 77383 H2 WAT 6926 84.450 17.808 58.750 1.00 0.00 H TER 77385 WAT 6926 ATOM 77385 O WAT 6927 29.797 12.113 13.788 1.00 0.00 O ATOM 77386 H1 WAT 6927 28.850 11.974 13.762 1.00 0.00 H ATOM 77387 H2 WAT 6927 29.923 12.977 13.394 1.00 0.00 H TER 77389 WAT 6927 ATOM 77389 O WAT 6928 109.960 38.780 148.455 1.00 0.00 O ATOM 77390 H1 WAT 6928 109.208 38.918 147.878 1.00 0.00 H ATOM 77391 H2 WAT 6928 110.708 39.105 147.955 1.00 0.00 H TER 77393 WAT 6928 ATOM 77393 O WAT 6929 15.224 122.398 154.862 1.00 0.00 O ATOM 77394 H1 WAT 6929 15.960 123.010 154.868 1.00 0.00 H ATOM 77395 H2 WAT 6929 15.269 121.959 155.711 1.00 0.00 H TER 77397 WAT 6929 ATOM 77397 O WAT 6930 12.020 24.925 77.760 1.00 0.00 O ATOM 77398 H1 WAT 6930 12.892 24.615 78.004 1.00 0.00 H ATOM 77399 H2 WAT 6930 11.667 25.303 78.565 1.00 0.00 H TER 77401 WAT 6930 ATOM 77401 O WAT 6931 145.290 26.031 118.792 1.00 0.00 O ATOM 77402 H1 WAT 6931 144.648 26.263 119.463 1.00 0.00 H ATOM 77403 H2 WAT 6931 145.886 26.780 118.762 1.00 0.00 H TER 77405 WAT 6931 ATOM 77405 O WAT 6932 7.557 26.503 63.328 1.00 0.00 O ATOM 77406 H1 WAT 6932 8.355 26.138 63.710 1.00 0.00 H ATOM 77407 H2 WAT 6932 7.533 26.147 62.439 1.00 0.00 H TER 77409 WAT 6932 ATOM 77409 O WAT 6933 68.759 46.258 94.320 1.00 0.00 O ATOM 77410 H1 WAT 6933 68.974 47.138 94.630 1.00 0.00 H ATOM 77411 H2 WAT 6933 68.386 45.820 95.085 1.00 0.00 H TER 77413 WAT 6933 ATOM 77413 O WAT 6934 16.744 64.168 6.909 1.00 0.00 O ATOM 77414 H1 WAT 6934 16.934 64.724 7.664 1.00 0.00 H ATOM 77415 H2 WAT 6934 17.584 63.767 6.688 1.00 0.00 H TER 77417 WAT 6934 ATOM 77417 O WAT 6935 90.352 22.093 107.844 1.00 0.00 O ATOM 77418 H1 WAT 6935 90.686 22.886 107.425 1.00 0.00 H ATOM 77419 H2 WAT 6935 90.050 22.386 108.704 1.00 0.00 H TER 77421 WAT 6935 ATOM 77421 O WAT 6936 95.776 88.717 109.517 1.00 0.00 O ATOM 77422 H1 WAT 6936 94.872 88.978 109.343 1.00 0.00 H ATOM 77423 H2 WAT 6936 95.748 87.761 109.549 1.00 0.00 H TER 77425 WAT 6936 ATOM 77425 O WAT 6937 38.616 39.690 145.222 1.00 0.00 O ATOM 77426 H1 WAT 6937 39.447 39.625 145.693 1.00 0.00 H ATOM 77427 H2 WAT 6937 38.078 38.989 145.589 1.00 0.00 H TER 77429 WAT 6937 ATOM 77429 O WAT 6938 8.598 114.921 86.438 1.00 0.00 O ATOM 77430 H1 WAT 6938 8.659 114.033 86.791 1.00 0.00 H ATOM 77431 H2 WAT 6938 9.507 115.209 86.357 1.00 0.00 H TER 77433 WAT 6938 ATOM 77433 O WAT 6939 56.155 143.300 118.214 1.00 0.00 O ATOM 77434 H1 WAT 6939 57.087 143.283 117.994 1.00 0.00 H ATOM 77435 H2 WAT 6939 55.719 142.946 117.438 1.00 0.00 H TER 77437 WAT 6939 ATOM 77437 O WAT 6940 54.917 88.636 88.770 1.00 0.00 O ATOM 77438 H1 WAT 6940 55.384 88.478 89.590 1.00 0.00 H ATOM 77439 H2 WAT 6940 55.607 88.810 88.130 1.00 0.00 H TER 77441 WAT 6940 ATOM 77441 O WAT 6941 87.893 69.274 134.713 1.00 0.00 O ATOM 77442 H1 WAT 6941 87.989 68.796 133.890 1.00 0.00 H ATOM 77443 H2 WAT 6941 87.916 70.197 134.458 1.00 0.00 H TER 77445 WAT 6941 ATOM 77445 O WAT 6942 120.629 38.903 147.464 1.00 0.00 O ATOM 77446 H1 WAT 6942 121.179 38.678 146.714 1.00 0.00 H ATOM 77447 H2 WAT 6942 120.592 38.100 147.984 1.00 0.00 H TER 77449 WAT 6942 ATOM 77449 O WAT 6943 25.334 67.136 108.859 1.00 0.00 O ATOM 77450 H1 WAT 6943 25.732 67.743 108.236 1.00 0.00 H ATOM 77451 H2 WAT 6943 24.469 66.951 108.494 1.00 0.00 H TER 77453 WAT 6943 ATOM 77453 O WAT 6944 104.764 119.574 128.084 1.00 0.00 O ATOM 77454 H1 WAT 6944 105.416 120.173 127.719 1.00 0.00 H ATOM 77455 H2 WAT 6944 104.657 118.900 127.413 1.00 0.00 H TER 77457 WAT 6944 ATOM 77457 O WAT 6945 88.429 106.466 10.128 1.00 0.00 O ATOM 77458 H1 WAT 6945 88.803 105.732 10.615 1.00 0.00 H ATOM 77459 H2 WAT 6945 88.843 107.241 10.507 1.00 0.00 H TER 77461 WAT 6945 ATOM 77461 O WAT 6946 75.145 102.458 128.820 1.00 0.00 O ATOM 77462 H1 WAT 6946 74.350 101.991 128.565 1.00 0.00 H ATOM 77463 H2 WAT 6946 74.833 103.300 129.151 1.00 0.00 H TER 77465 WAT 6946 ATOM 77465 O WAT 6947 126.238 19.303 154.225 1.00 0.00 O ATOM 77466 H1 WAT 6947 125.678 19.530 153.482 1.00 0.00 H ATOM 77467 H2 WAT 6947 125.989 19.923 154.911 1.00 0.00 H TER 77469 WAT 6947 ATOM 77469 O WAT 6948 66.119 86.924 70.448 1.00 0.00 O ATOM 77470 H1 WAT 6948 66.991 87.148 70.772 1.00 0.00 H ATOM 77471 H2 WAT 6948 65.898 86.110 70.900 1.00 0.00 H TER 77473 WAT 6948 ATOM 77473 O WAT 6949 92.477 37.425 92.797 1.00 0.00 O ATOM 77474 H1 WAT 6949 92.921 36.586 92.677 1.00 0.00 H ATOM 77475 H2 WAT 6949 92.949 37.844 93.517 1.00 0.00 H TER 77477 WAT 6949 ATOM 77477 O WAT 6950 109.971 88.578 85.291 1.00 0.00 O ATOM 77478 H1 WAT 6950 109.646 87.842 85.811 1.00 0.00 H ATOM 77479 H2 WAT 6950 109.786 88.332 84.385 1.00 0.00 H TER 77481 WAT 6950 ATOM 77481 O WAT 6951 33.008 83.138 109.207 1.00 0.00 O ATOM 77482 H1 WAT 6951 32.222 83.352 108.704 1.00 0.00 H ATOM 77483 H2 WAT 6951 32.833 82.268 109.566 1.00 0.00 H TER 77485 WAT 6951 ATOM 77485 O WAT 6952 21.298 106.357 125.163 1.00 0.00 O ATOM 77486 H1 WAT 6952 21.812 106.819 125.826 1.00 0.00 H ATOM 77487 H2 WAT 6952 20.704 107.023 124.816 1.00 0.00 H TER 77489 WAT 6952 ATOM 77489 O WAT 6953 3.100 97.690 77.002 1.00 0.00 O ATOM 77490 H1 WAT 6953 2.969 96.755 77.157 1.00 0.00 H ATOM 77491 H2 WAT 6953 4.045 97.782 76.878 1.00 0.00 H TER 77493 WAT 6953 ATOM 77493 O WAT 6954 9.940 131.443 73.843 1.00 0.00 O ATOM 77494 H1 WAT 6954 10.408 130.793 74.367 1.00 0.00 H ATOM 77495 H2 WAT 6954 10.204 132.285 74.214 1.00 0.00 H TER 77497 WAT 6954 ATOM 77497 O WAT 6955 114.248 14.333 131.761 1.00 0.00 O ATOM 77498 H1 WAT 6955 114.864 15.024 132.005 1.00 0.00 H ATOM 77499 H2 WAT 6955 113.545 14.401 132.408 1.00 0.00 H TER 77501 WAT 6955 ATOM 77501 O WAT 6956 98.280 23.489 84.469 1.00 0.00 O ATOM 77502 H1 WAT 6956 98.568 22.777 83.898 1.00 0.00 H ATOM 77503 H2 WAT 6956 98.191 23.083 85.331 1.00 0.00 H TER 77505 WAT 6956 ATOM 77505 O WAT 6957 131.046 54.657 92.261 1.00 0.00 O ATOM 77506 H1 WAT 6957 131.680 54.748 91.549 1.00 0.00 H ATOM 77507 H2 WAT 6957 131.003 55.528 92.655 1.00 0.00 H TER 77509 WAT 6957 ATOM 77509 O WAT 6958 103.624 138.725 158.948 1.00 0.00 O ATOM 77510 H1 WAT 6958 103.303 139.311 158.263 1.00 0.00 H ATOM 77511 H2 WAT 6958 104.576 138.818 158.918 1.00 0.00 H TER 77513 WAT 6958 ATOM 77513 O WAT 6959 102.622 132.687 83.216 1.00 0.00 O ATOM 77514 H1 WAT 6959 102.206 132.468 82.383 1.00 0.00 H ATOM 77515 H2 WAT 6959 102.837 133.616 83.140 1.00 0.00 H TER 77517 WAT 6959 ATOM 77517 O WAT 6960 72.064 101.999 72.051 1.00 0.00 O ATOM 77518 H1 WAT 6960 71.257 102.247 72.502 1.00 0.00 H ATOM 77519 H2 WAT 6960 72.752 102.129 72.704 1.00 0.00 H TER 77521 WAT 6960 ATOM 77521 O WAT 6961 44.647 3.745 99.241 1.00 0.00 O ATOM 77522 H1 WAT 6961 44.865 4.525 99.751 1.00 0.00 H ATOM 77523 H2 WAT 6961 45.378 3.645 98.632 1.00 0.00 H TER 77525 WAT 6961 ATOM 77525 O WAT 6962 81.949 26.435 112.988 1.00 0.00 O ATOM 77526 H1 WAT 6962 81.593 25.709 113.501 1.00 0.00 H ATOM 77527 H2 WAT 6962 81.363 27.169 113.172 1.00 0.00 H TER 77529 WAT 6962 ATOM 77529 O WAT 6963 106.982 97.442 17.337 1.00 0.00 O ATOM 77530 H1 WAT 6963 106.315 97.247 16.679 1.00 0.00 H ATOM 77531 H2 WAT 6963 106.685 98.255 17.746 1.00 0.00 H TER 77533 WAT 6963 ATOM 77533 O WAT 6964 65.294 33.897 104.941 1.00 0.00 O ATOM 77534 H1 WAT 6964 65.587 33.322 105.648 1.00 0.00 H ATOM 77535 H2 WAT 6964 64.518 33.464 104.587 1.00 0.00 H TER 77537 WAT 6964 ATOM 77537 O WAT 6965 25.840 23.616 30.087 1.00 0.00 O ATOM 77538 H1 WAT 6965 26.016 23.824 29.169 1.00 0.00 H ATOM 77539 H2 WAT 6965 25.541 24.442 30.467 1.00 0.00 H TER 77541 WAT 6965 ATOM 77541 O WAT 6966 145.244 89.151 102.672 1.00 0.00 O ATOM 77542 H1 WAT 6966 145.388 90.071 102.447 1.00 0.00 H ATOM 77543 H2 WAT 6966 145.635 89.054 103.541 1.00 0.00 H TER 77545 WAT 6966 ATOM 77545 O WAT 6967 36.966 50.092 129.324 1.00 0.00 O ATOM 77546 H1 WAT 6967 36.015 50.162 129.245 1.00 0.00 H ATOM 77547 H2 WAT 6967 37.306 50.721 128.688 1.00 0.00 H TER 77549 WAT 6967 ATOM 77549 O WAT 6968 110.668 80.625 114.540 1.00 0.00 O ATOM 77550 H1 WAT 6968 110.764 79.871 115.123 1.00 0.00 H ATOM 77551 H2 WAT 6968 111.553 80.790 114.215 1.00 0.00 H TER 77553 WAT 6968 ATOM 77553 O WAT 6969 112.254 114.488 126.282 1.00 0.00 O ATOM 77554 H1 WAT 6969 111.913 114.221 125.428 1.00 0.00 H ATOM 77555 H2 WAT 6969 111.510 114.394 126.877 1.00 0.00 H TER 77557 WAT 6969 ATOM 77557 O WAT 6970 107.256 112.599 78.164 1.00 0.00 O ATOM 77558 H1 WAT 6970 107.510 111.710 78.414 1.00 0.00 H ATOM 77559 H2 WAT 6970 107.769 112.782 77.378 1.00 0.00 H TER 77561 WAT 6970 ATOM 77561 O WAT 6971 131.087 115.360 123.126 1.00 0.00 O ATOM 77562 H1 WAT 6971 130.141 115.410 123.266 1.00 0.00 H ATOM 77563 H2 WAT 6971 131.429 114.985 123.938 1.00 0.00 H TER 77565 WAT 6971 ATOM 77565 O WAT 6972 10.985 70.383 20.555 1.00 0.00 O ATOM 77566 H1 WAT 6972 10.550 70.615 19.735 1.00 0.00 H ATOM 77567 H2 WAT 6972 10.269 70.205 21.164 1.00 0.00 H TER 77569 WAT 6972 ATOM 77569 O WAT 6973 142.562 130.729 151.205 1.00 0.00 O ATOM 77570 H1 WAT 6973 142.728 129.788 151.252 1.00 0.00 H ATOM 77571 H2 WAT 6973 142.509 131.010 152.118 1.00 0.00 H TER 77573 WAT 6973 ATOM 77573 O WAT 6974 120.844 57.736 132.033 1.00 0.00 O ATOM 77574 H1 WAT 6974 121.515 58.040 131.421 1.00 0.00 H ATOM 77575 H2 WAT 6974 121.338 57.365 132.764 1.00 0.00 H TER 77577 WAT 6974 ATOM 77577 O WAT 6975 2.008 65.844 83.662 1.00 0.00 O ATOM 77578 H1 WAT 6975 2.197 64.909 83.743 1.00 0.00 H ATOM 77579 H2 WAT 6975 1.339 65.895 82.980 1.00 0.00 H TER 77581 WAT 6975 ATOM 77581 O WAT 6976 134.775 92.927 99.260 1.00 0.00 O ATOM 77582 H1 WAT 6976 134.596 93.182 98.355 1.00 0.00 H ATOM 77583 H2 WAT 6976 134.181 92.194 99.424 1.00 0.00 H TER 77585 WAT 6976 ATOM 77585 O WAT 6977 114.465 29.339 78.076 1.00 0.00 O ATOM 77586 H1 WAT 6977 114.631 29.732 77.219 1.00 0.00 H ATOM 77587 H2 WAT 6977 114.696 30.025 78.703 1.00 0.00 H TER 77589 WAT 6977 ATOM 77589 O WAT 6978 96.548 48.456 143.264 1.00 0.00 O ATOM 77590 H1 WAT 6978 97.011 49.268 143.470 1.00 0.00 H ATOM 77591 H2 WAT 6978 96.085 48.645 142.447 1.00 0.00 H TER 77593 WAT 6978 ATOM 77593 O WAT 6979 82.581 32.833 121.661 1.00 0.00 O ATOM 77594 H1 WAT 6979 82.450 33.726 121.977 1.00 0.00 H ATOM 77595 H2 WAT 6979 81.707 32.442 121.676 1.00 0.00 H TER 77597 WAT 6979 ATOM 77597 O WAT 6980 32.330 129.063 131.596 1.00 0.00 O ATOM 77598 H1 WAT 6980 31.479 129.296 131.967 1.00 0.00 H ATOM 77599 H2 WAT 6980 32.394 128.116 131.719 1.00 0.00 H TER 77601 WAT 6980 ATOM 77601 O WAT 6981 39.120 53.620 19.260 1.00 0.00 O ATOM 77602 H1 WAT 6981 39.080 52.918 18.611 1.00 0.00 H ATOM 77603 H2 WAT 6981 39.316 53.174 20.084 1.00 0.00 H TER 77605 WAT 6981 ATOM 77605 O WAT 6982 120.347 51.274 89.530 1.00 0.00 O ATOM 77606 H1 WAT 6982 119.605 51.878 89.497 1.00 0.00 H ATOM 77607 H2 WAT 6982 121.026 51.755 90.003 1.00 0.00 H TER 77609 WAT 6982 ATOM 77609 O WAT 6983 5.301 91.621 98.692 1.00 0.00 O ATOM 77610 H1 WAT 6983 4.716 91.917 97.995 1.00 0.00 H ATOM 77611 H2 WAT 6983 6.099 91.353 98.237 1.00 0.00 H TER 77613 WAT 6983 ATOM 77613 O WAT 6984 3.013 50.013 82.682 1.00 0.00 O ATOM 77614 H1 WAT 6984 3.294 50.927 82.633 1.00 0.00 H ATOM 77615 H2 WAT 6984 2.993 49.720 81.771 1.00 0.00 H TER 77617 WAT 6984 ATOM 77617 O WAT 6985 72.286 119.593 99.966 1.00 0.00 O ATOM 77618 H1 WAT 6985 71.967 119.291 100.816 1.00 0.00 H ATOM 77619 H2 WAT 6985 72.288 120.548 100.037 1.00 0.00 H TER 77621 WAT 6985 ATOM 77621 O WAT 6986 71.622 4.184 109.474 1.00 0.00 O ATOM 77622 H1 WAT 6986 70.737 3.837 109.590 1.00 0.00 H ATOM 77623 H2 WAT 6986 71.490 5.044 109.074 1.00 0.00 H TER 77625 WAT 6986 ATOM 77625 O WAT 6987 57.887 56.522 105.133 1.00 0.00 O ATOM 77626 H1 WAT 6987 58.142 56.763 106.024 1.00 0.00 H ATOM 77627 H2 WAT 6987 58.603 55.969 104.820 1.00 0.00 H TER 77629 WAT 6987 ATOM 77629 O WAT 6988 108.245 115.068 67.746 1.00 0.00 O ATOM 77630 H1 WAT 6988 108.733 115.224 68.555 1.00 0.00 H ATOM 77631 H2 WAT 6988 108.584 115.719 67.133 1.00 0.00 H TER 77633 WAT 6988 ATOM 77633 O WAT 6989 144.048 142.934 112.312 1.00 0.00 O ATOM 77634 H1 WAT 6989 143.638 143.732 111.980 1.00 0.00 H ATOM 77635 H2 WAT 6989 143.857 142.938 113.250 1.00 0.00 H TER 77637 WAT 6989 ATOM 77637 O WAT 6990 106.944 88.505 143.622 1.00 0.00 O ATOM 77638 H1 WAT 6990 107.126 87.573 143.743 1.00 0.00 H ATOM 77639 H2 WAT 6990 107.446 88.939 144.312 1.00 0.00 H TER 77641 WAT 6990 ATOM 77641 O WAT 6991 2.278 126.581 157.091 1.00 0.00 O ATOM 77642 H1 WAT 6991 1.668 127.203 157.488 1.00 0.00 H ATOM 77643 H2 WAT 6991 1.760 125.786 156.961 1.00 0.00 H TER 77645 WAT 6991 ATOM 77645 O WAT 6992 59.828 58.495 98.094 1.00 0.00 O ATOM 77646 H1 WAT 6992 60.052 57.570 97.983 1.00 0.00 H ATOM 77647 H2 WAT 6992 60.123 58.708 98.980 1.00 0.00 H TER 77649 WAT 6992 ATOM 77649 O WAT 6993 40.110 133.392 8.393 1.00 0.00 O ATOM 77650 H1 WAT 6993 40.768 132.904 8.889 1.00 0.00 H ATOM 77651 H2 WAT 6993 39.713 133.979 9.035 1.00 0.00 H TER 77653 WAT 6993 ATOM 77653 O WAT 6994 121.526 90.235 128.776 1.00 0.00 O ATOM 77654 H1 WAT 6994 121.480 89.331 128.463 1.00 0.00 H ATOM 77655 H2 WAT 6994 120.867 90.282 129.469 1.00 0.00 H TER 77657 WAT 6994 ATOM 77657 O WAT 6995 117.147 72.974 121.099 1.00 0.00 O ATOM 77658 H1 WAT 6995 117.063 72.160 121.595 1.00 0.00 H ATOM 77659 H2 WAT 6995 117.914 72.837 120.543 1.00 0.00 H TER 77661 WAT 6995 ATOM 77661 O WAT 6996 55.488 34.844 155.451 1.00 0.00 O ATOM 77662 H1 WAT 6996 54.856 34.536 156.101 1.00 0.00 H ATOM 77663 H2 WAT 6996 55.663 35.751 155.699 1.00 0.00 H TER 77665 WAT 6996 ATOM 77665 O WAT 6997 18.797 114.683 79.255 1.00 0.00 O ATOM 77666 H1 WAT 6997 19.130 115.535 78.973 1.00 0.00 H ATOM 77667 H2 WAT 6997 19.569 114.223 79.586 1.00 0.00 H TER 77669 WAT 6997 ATOM 77669 O WAT 6998 38.930 13.183 146.913 1.00 0.00 O ATOM 77670 H1 WAT 6998 38.969 12.935 145.989 1.00 0.00 H ATOM 77671 H2 WAT 6998 39.097 14.125 146.915 1.00 0.00 H TER 77673 WAT 6998 ATOM 77673 O WAT 6999 16.410 139.304 15.156 1.00 0.00 O ATOM 77674 H1 WAT 6999 16.812 138.901 14.386 1.00 0.00 H ATOM 77675 H2 WAT 6999 15.860 140.002 14.802 1.00 0.00 H TER 77677 WAT 6999 ATOM 77677 O WAT 7000 143.419 103.120 1.252 1.00 0.00 O ATOM 77678 H1 WAT 7000 144.038 103.498 1.877 1.00 0.00 H ATOM 77679 H2 WAT 7000 143.970 102.660 0.618 1.00 0.00 H TER 77681 WAT 7000 ATOM 77681 O WAT 7001 18.843 138.641 94.193 1.00 0.00 O ATOM 77682 H1 WAT 7001 18.389 139.453 94.417 1.00 0.00 H ATOM 77683 H2 WAT 7001 18.148 137.985 94.137 1.00 0.00 H TER 77685 WAT 7001 ATOM 77685 O WAT 7002 130.691 97.096 17.333 1.00 0.00 O ATOM 77686 H1 WAT 7002 130.195 97.640 16.722 1.00 0.00 H ATOM 77687 H2 WAT 7002 131.294 97.704 17.760 1.00 0.00 H TER 77689 WAT 7002 ATOM 77689 O WAT 7003 10.584 84.383 109.646 1.00 0.00 O ATOM 77690 H1 WAT 7003 10.996 83.623 110.057 1.00 0.00 H ATOM 77691 H2 WAT 7003 9.645 84.240 109.766 1.00 0.00 H TER 77693 WAT 7003 ATOM 77693 O WAT 7004 69.659 120.640 18.790 1.00 0.00 O ATOM 77694 H1 WAT 7004 69.154 120.100 18.181 1.00 0.00 H ATOM 77695 H2 WAT 7004 69.159 120.612 19.606 1.00 0.00 H TER 77697 WAT 7004 ATOM 77697 O WAT 7005 9.938 87.310 11.485 1.00 0.00 O ATOM 77698 H1 WAT 7005 9.632 86.821 10.722 1.00 0.00 H ATOM 77699 H2 WAT 7005 9.999 88.216 11.180 1.00 0.00 H TER 77701 WAT 7005 ATOM 77701 O WAT 7006 67.674 58.731 23.003 1.00 0.00 O ATOM 77702 H1 WAT 7006 67.317 58.040 23.561 1.00 0.00 H ATOM 77703 H2 WAT 7006 67.956 59.411 23.614 1.00 0.00 H TER 77705 WAT 7006 ATOM 77705 O WAT 7007 30.781 118.511 121.884 1.00 0.00 O ATOM 77706 H1 WAT 7007 30.353 118.072 122.619 1.00 0.00 H ATOM 77707 H2 WAT 7007 30.531 119.431 121.976 1.00 0.00 H TER 77709 WAT 7007 ATOM 77709 O WAT 7008 123.070 71.441 64.220 1.00 0.00 O ATOM 77710 H1 WAT 7008 122.477 71.206 63.506 1.00 0.00 H ATOM 77711 H2 WAT 7008 122.739 70.956 64.976 1.00 0.00 H TER 77713 WAT 7008 ATOM 77713 O WAT 7009 50.471 16.496 152.927 1.00 0.00 O ATOM 77714 H1 WAT 7009 50.028 15.904 152.319 1.00 0.00 H ATOM 77715 H2 WAT 7009 49.841 16.627 153.636 1.00 0.00 H TER 77717 WAT 7009 ATOM 77717 O WAT 7010 42.310 107.387 146.513 1.00 0.00 O ATOM 77718 H1 WAT 7010 41.551 106.826 146.673 1.00 0.00 H ATOM 77719 H2 WAT 7010 42.529 107.746 147.373 1.00 0.00 H TER 77721 WAT 7010 ATOM 77721 O WAT 7011 56.961 121.639 114.139 1.00 0.00 O ATOM 77722 H1 WAT 7011 57.247 121.815 115.035 1.00 0.00 H ATOM 77723 H2 WAT 7011 57.589 120.997 113.809 1.00 0.00 H TER 77725 WAT 7011 ATOM 77725 O WAT 7012 138.927 7.527 80.825 1.00 0.00 O ATOM 77726 H1 WAT 7012 139.430 8.106 80.252 1.00 0.00 H ATOM 77727 H2 WAT 7012 138.631 6.820 80.251 1.00 0.00 H TER 77729 WAT 7012 ATOM 77729 O WAT 7013 96.909 59.179 126.018 1.00 0.00 O ATOM 77730 H1 WAT 7013 96.798 58.314 126.412 1.00 0.00 H ATOM 77731 H2 WAT 7013 97.857 59.310 125.990 1.00 0.00 H TER 77733 WAT 7013 ATOM 77733 O WAT 7014 87.060 47.756 9.860 1.00 0.00 O ATOM 77734 H1 WAT 7014 86.132 47.833 10.084 1.00 0.00 H ATOM 77735 H2 WAT 7014 87.502 48.354 10.463 1.00 0.00 H TER 77737 WAT 7014 ATOM 77737 O WAT 7015 18.964 44.997 154.571 1.00 0.00 O ATOM 77738 H1 WAT 7015 18.683 45.721 155.131 1.00 0.00 H ATOM 77739 H2 WAT 7015 18.584 44.218 154.978 1.00 0.00 H TER 77741 WAT 7015 ATOM 77741 O WAT 7016 41.861 96.244 12.499 1.00 0.00 O ATOM 77742 H1 WAT 7016 42.602 96.608 12.983 1.00 0.00 H ATOM 77743 H2 WAT 7016 41.754 95.361 12.853 1.00 0.00 H TER 77745 WAT 7016 ATOM 77745 O WAT 7017 40.071 50.751 98.875 1.00 0.00 O ATOM 77746 H1 WAT 7017 40.846 50.362 99.279 1.00 0.00 H ATOM 77747 H2 WAT 7017 39.548 50.001 98.591 1.00 0.00 H TER 77749 WAT 7017 ATOM 77749 O WAT 7018 5.115 25.675 6.661 1.00 0.00 O ATOM 77750 H1 WAT 7018 5.316 26.241 7.407 1.00 0.00 H ATOM 77751 H2 WAT 7018 4.353 25.169 6.942 1.00 0.00 H TER 77753 WAT 7018 ATOM 77753 O WAT 7019 61.516 29.652 62.900 1.00 0.00 O ATOM 77754 H1 WAT 7019 60.836 30.045 63.446 1.00 0.00 H ATOM 77755 H2 WAT 7019 61.474 30.138 62.077 1.00 0.00 H TER 77757 WAT 7019 ATOM 77757 O WAT 7020 100.325 121.584 61.092 1.00 0.00 O ATOM 77758 H1 WAT 7020 101.018 121.128 61.568 1.00 0.00 H ATOM 77759 H2 WAT 7020 100.708 121.776 60.236 1.00 0.00 H TER 77761 WAT 7020 ATOM 77761 O WAT 7021 88.055 60.836 98.335 1.00 0.00 O ATOM 77762 H1 WAT 7021 88.466 61.622 97.974 1.00 0.00 H ATOM 77763 H2 WAT 7021 88.327 60.824 99.253 1.00 0.00 H TER 77765 WAT 7021 ATOM 77765 O WAT 7022 85.152 40.333 73.982 1.00 0.00 O ATOM 77766 H1 WAT 7022 84.606 40.000 74.694 1.00 0.00 H ATOM 77767 H2 WAT 7022 86.015 39.952 74.145 1.00 0.00 H TER 77769 WAT 7022 ATOM 77769 O WAT 7023 105.882 33.288 111.489 1.00 0.00 O ATOM 77770 H1 WAT 7023 106.045 32.867 110.645 1.00 0.00 H ATOM 77771 H2 WAT 7023 106.651 33.838 111.635 1.00 0.00 H TER 77773 WAT 7023 ATOM 77773 O WAT 7024 29.930 25.779 156.051 1.00 0.00 O ATOM 77774 H1 WAT 7024 29.878 26.732 155.977 1.00 0.00 H ATOM 77775 H2 WAT 7024 30.522 25.515 155.347 1.00 0.00 H TER 77777 WAT 7024 ATOM 77777 O WAT 7025 101.615 80.548 140.332 1.00 0.00 O ATOM 77778 H1 WAT 7025 100.779 80.652 139.878 1.00 0.00 H ATOM 77779 H2 WAT 7025 102.110 79.938 139.784 1.00 0.00 H TER 77781 WAT 7025 ATOM 77781 O WAT 7026 89.312 34.075 61.097 1.00 0.00 O ATOM 77782 H1 WAT 7026 89.027 34.724 60.454 1.00 0.00 H ATOM 77783 H2 WAT 7026 89.332 34.553 61.926 1.00 0.00 H TER 77785 WAT 7026 ATOM 77785 O WAT 7027 144.246 6.110 127.623 1.00 0.00 O ATOM 77786 H1 WAT 7027 144.493 6.191 128.544 1.00 0.00 H ATOM 77787 H2 WAT 7027 144.030 5.183 127.514 1.00 0.00 H TER 77789 WAT 7027 ATOM 77789 O WAT 7028 126.848 128.380 113.362 1.00 0.00 O ATOM 77790 H1 WAT 7028 126.603 127.606 113.868 1.00 0.00 H ATOM 77791 H2 WAT 7028 127.315 128.032 112.603 1.00 0.00 H TER 77793 WAT 7028 ATOM 77793 O WAT 7029 3.258 23.342 21.565 1.00 0.00 O ATOM 77794 H1 WAT 7029 3.364 22.423 21.810 1.00 0.00 H ATOM 77795 H2 WAT 7029 2.925 23.765 22.356 1.00 0.00 H TER 77797 WAT 7029 ATOM 77797 O WAT 7030 17.185 117.757 88.337 1.00 0.00 O ATOM 77798 H1 WAT 7030 17.692 118.569 88.321 1.00 0.00 H ATOM 77799 H2 WAT 7030 17.674 117.159 87.772 1.00 0.00 H TER 77801 WAT 7030 ATOM 77801 O WAT 7031 77.616 43.089 67.915 1.00 0.00 O ATOM 77802 H1 WAT 7031 78.447 42.844 68.322 1.00 0.00 H ATOM 77803 H2 WAT 7031 77.163 42.257 67.775 1.00 0.00 H TER 77805 WAT 7031 ATOM 77805 O WAT 7032 80.353 24.470 143.037 1.00 0.00 O ATOM 77806 H1 WAT 7032 80.783 24.380 143.888 1.00 0.00 H ATOM 77807 H2 WAT 7032 79.429 24.600 143.249 1.00 0.00 H TER 77809 WAT 7032 ATOM 77809 O WAT 7033 6.991 8.262 86.276 1.00 0.00 O ATOM 77810 H1 WAT 7033 6.789 8.472 85.364 1.00 0.00 H ATOM 77811 H2 WAT 7033 6.521 7.444 86.443 1.00 0.00 H TER 77813 WAT 7033 ATOM 77813 O WAT 7034 113.808 74.806 111.255 1.00 0.00 O ATOM 77814 H1 WAT 7034 113.255 75.587 111.257 1.00 0.00 H ATOM 77815 H2 WAT 7034 113.450 74.260 110.555 1.00 0.00 H TER 77817 WAT 7034 ATOM 77817 O WAT 7035 115.275 139.965 153.952 1.00 0.00 O ATOM 77818 H1 WAT 7035 115.173 140.094 153.009 1.00 0.00 H ATOM 77819 H2 WAT 7035 115.283 139.014 154.064 1.00 0.00 H TER 77821 WAT 7035 ATOM 77821 O WAT 7036 13.246 90.978 85.085 1.00 0.00 O ATOM 77822 H1 WAT 7036 13.247 91.517 84.293 1.00 0.00 H ATOM 77823 H2 WAT 7036 12.323 90.771 85.232 1.00 0.00 H TER 77825 WAT 7036 ATOM 77825 O WAT 7037 8.951 28.604 68.538 1.00 0.00 O ATOM 77826 H1 WAT 7037 8.936 28.125 69.367 1.00 0.00 H ATOM 77827 H2 WAT 7037 8.067 28.500 68.185 1.00 0.00 H TER 77829 WAT 7037 ATOM 77829 O WAT 7038 144.451 28.039 64.533 1.00 0.00 O ATOM 77830 H1 WAT 7038 145.142 28.533 64.092 1.00 0.00 H ATOM 77831 H2 WAT 7038 143.841 27.804 63.834 1.00 0.00 H TER 77833 WAT 7038 ATOM 77833 O WAT 7039 72.669 141.711 61.704 1.00 0.00 O ATOM 77834 H1 WAT 7039 72.580 140.837 62.084 1.00 0.00 H ATOM 77835 H2 WAT 7039 71.943 142.210 62.077 1.00 0.00 H TER 77837 WAT 7039 ATOM 77837 O WAT 7040 43.094 141.590 103.105 1.00 0.00 O ATOM 77838 H1 WAT 7040 43.000 142.451 103.513 1.00 0.00 H ATOM 77839 H2 WAT 7040 43.719 141.729 102.394 1.00 0.00 H TER 77841 WAT 7040 ATOM 77841 O WAT 7041 71.931 124.559 105.331 1.00 0.00 O ATOM 77842 H1 WAT 7041 72.055 125.310 104.750 1.00 0.00 H ATOM 77843 H2 WAT 7041 71.267 124.848 105.957 1.00 0.00 H TER 77845 WAT 7041 ATOM 77845 O WAT 7042 121.189 125.364 131.173 1.00 0.00 O ATOM 77846 H1 WAT 7042 121.941 124.774 131.119 1.00 0.00 H ATOM 77847 H2 WAT 7042 120.604 125.069 130.475 1.00 0.00 H TER 77849 WAT 7042 ATOM 77849 O WAT 7043 124.989 125.882 69.413 1.00 0.00 O ATOM 77850 H1 WAT 7043 124.455 125.113 69.210 1.00 0.00 H ATOM 77851 H2 WAT 7043 124.354 126.559 69.646 1.00 0.00 H TER 77853 WAT 7043 ATOM 77853 O WAT 7044 0.406 15.838 75.494 1.00 0.00 O ATOM 77854 H1 WAT 7044 -0.037 16.416 74.873 1.00 0.00 H ATOM 77855 H2 WAT 7044 1.338 15.956 75.308 1.00 0.00 H TER 77857 WAT 7044 ATOM 77857 O WAT 7045 99.098 3.289 10.489 1.00 0.00 O ATOM 77858 H1 WAT 7045 98.739 2.630 9.894 1.00 0.00 H ATOM 77859 H2 WAT 7045 98.344 3.587 10.998 1.00 0.00 H TER 77861 WAT 7045 ATOM 77861 O WAT 7046 17.967 46.726 83.045 1.00 0.00 O ATOM 77862 H1 WAT 7046 17.950 46.184 82.256 1.00 0.00 H ATOM 77863 H2 WAT 7046 17.836 46.107 83.763 1.00 0.00 H TER 77865 WAT 7046 ATOM 77865 O WAT 7047 91.583 26.757 93.724 1.00 0.00 O ATOM 77866 H1 WAT 7047 92.498 26.863 93.466 1.00 0.00 H ATOM 77867 H2 WAT 7047 91.624 26.425 94.621 1.00 0.00 H TER 77869 WAT 7047 ATOM 77869 O WAT 7048 37.881 0.777 110.491 1.00 0.00 O ATOM 77870 H1 WAT 7048 37.147 1.252 110.880 1.00 0.00 H ATOM 77871 H2 WAT 7048 37.748 0.862 109.547 1.00 0.00 H TER 77873 WAT 7048 ATOM 77873 O WAT 7049 14.561 123.952 6.899 1.00 0.00 O ATOM 77874 H1 WAT 7049 14.584 123.693 7.821 1.00 0.00 H ATOM 77875 H2 WAT 7049 13.757 124.464 6.814 1.00 0.00 H TER 77877 WAT 7049 ATOM 77877 O WAT 7050 50.504 15.694 102.607 1.00 0.00 O ATOM 77878 H1 WAT 7050 49.703 15.358 102.203 1.00 0.00 H ATOM 77879 H2 WAT 7050 50.425 16.645 102.540 1.00 0.00 H TER 77881 WAT 7050 ATOM 77881 O WAT 7051 93.247 70.038 128.177 1.00 0.00 O ATOM 77882 H1 WAT 7051 93.476 69.120 128.317 1.00 0.00 H ATOM 77883 H2 WAT 7051 93.993 70.402 127.700 1.00 0.00 H TER 77885 WAT 7051 ATOM 77885 O WAT 7052 64.045 40.953 94.742 1.00 0.00 O ATOM 77886 H1 WAT 7052 63.802 41.134 95.650 1.00 0.00 H ATOM 77887 H2 WAT 7052 63.392 40.321 94.441 1.00 0.00 H TER 77889 WAT 7052 ATOM 77889 O WAT 7053 10.976 83.829 22.390 1.00 0.00 O ATOM 77890 H1 WAT 7053 11.292 84.711 22.587 1.00 0.00 H ATOM 77891 H2 WAT 7053 11.463 83.261 22.987 1.00 0.00 H TER 77893 WAT 7053 ATOM 77893 O WAT 7054 129.735 133.071 83.678 1.00 0.00 O ATOM 77894 H1 WAT 7054 129.048 132.577 83.230 1.00 0.00 H ATOM 77895 H2 WAT 7054 130.443 132.439 83.802 1.00 0.00 H TER 77897 WAT 7054 ATOM 77897 O WAT 7055 140.864 112.280 0.742 1.00 0.00 O ATOM 77898 H1 WAT 7055 139.979 112.632 0.836 1.00 0.00 H ATOM 77899 H2 WAT 7055 140.745 111.331 0.735 1.00 0.00 H TER 77901 WAT 7055 ATOM 77901 O WAT 7056 77.914 117.562 81.316 1.00 0.00 O ATOM 77902 H1 WAT 7056 78.706 118.089 81.208 1.00 0.00 H ATOM 77903 H2 WAT 7056 77.195 118.183 81.195 1.00 0.00 H TER 77905 WAT 7056 ATOM 77905 O WAT 7057 99.417 136.659 65.852 1.00 0.00 O ATOM 77906 H1 WAT 7057 99.192 135.755 66.072 1.00 0.00 H ATOM 77907 H2 WAT 7057 98.661 137.171 66.139 1.00 0.00 H TER 77909 WAT 7057 ATOM 77909 O WAT 7058 84.405 60.723 141.438 1.00 0.00 O ATOM 77910 H1 WAT 7058 83.454 60.767 141.333 1.00 0.00 H ATOM 77911 H2 WAT 7058 84.534 60.209 142.234 1.00 0.00 H TER 77913 WAT 7058 ATOM 77913 O WAT 7059 22.108 6.905 72.909 1.00 0.00 O ATOM 77914 H1 WAT 7059 22.764 7.520 72.579 1.00 0.00 H ATOM 77915 H2 WAT 7059 22.367 6.743 73.816 1.00 0.00 H TER 77917 WAT 7059 ATOM 77917 O WAT 7060 101.839 43.935 146.584 1.00 0.00 O ATOM 77918 H1 WAT 7060 101.566 43.226 146.002 1.00 0.00 H ATOM 77919 H2 WAT 7060 101.030 44.219 147.011 1.00 0.00 H TER 77921 WAT 7060 ATOM 77921 O WAT 7061 141.300 110.803 74.027 1.00 0.00 O ATOM 77922 H1 WAT 7061 140.940 109.986 73.683 1.00 0.00 H ATOM 77923 H2 WAT 7061 140.585 111.434 73.943 1.00 0.00 H TER 77925 WAT 7061 ATOM 77925 O WAT 7062 53.314 52.384 1.936 1.00 0.00 O ATOM 77926 H1 WAT 7062 54.151 52.073 1.591 1.00 0.00 H ATOM 77927 H2 WAT 7062 53.399 52.296 2.885 1.00 0.00 H TER 77929 WAT 7062 ATOM 77929 O WAT 7063 64.403 31.950 101.967 1.00 0.00 O ATOM 77930 H1 WAT 7063 64.603 31.334 101.262 1.00 0.00 H ATOM 77931 H2 WAT 7063 65.198 31.973 102.498 1.00 0.00 H TER 77933 WAT 7063 ATOM 77933 O WAT 7064 22.349 137.938 77.950 1.00 0.00 O ATOM 77934 H1 WAT 7064 22.597 138.710 78.459 1.00 0.00 H ATOM 77935 H2 WAT 7064 21.685 138.257 77.339 1.00 0.00 H TER 77937 WAT 7064 ATOM 77937 O WAT 7065 56.679 34.808 13.009 1.00 0.00 O ATOM 77938 H1 WAT 7065 57.412 35.284 13.400 1.00 0.00 H ATOM 77939 H2 WAT 7065 56.895 33.885 13.142 1.00 0.00 H TER 77941 WAT 7065 ATOM 77941 O WAT 7066 49.941 97.187 91.660 1.00 0.00 O ATOM 77942 H1 WAT 7066 49.484 97.703 92.323 1.00 0.00 H ATOM 77943 H2 WAT 7066 50.319 96.454 92.146 1.00 0.00 H TER 77945 WAT 7066 ATOM 77945 O WAT 7067 46.934 68.152 19.248 1.00 0.00 O ATOM 77946 H1 WAT 7067 46.408 67.867 18.501 1.00 0.00 H ATOM 77947 H2 WAT 7067 47.435 67.376 19.499 1.00 0.00 H TER 77949 WAT 7067 ATOM 77949 O WAT 7068 19.959 118.740 94.287 1.00 0.00 O ATOM 77950 H1 WAT 7068 19.246 119.372 94.379 1.00 0.00 H ATOM 77951 H2 WAT 7068 20.217 118.539 95.187 1.00 0.00 H TER 77953 WAT 7068 ATOM 77953 O WAT 7069 113.109 50.416 0.199 1.00 0.00 O ATOM 77954 H1 WAT 7069 112.851 50.912 0.976 1.00 0.00 H ATOM 77955 H2 WAT 7069 112.284 50.224 -0.247 1.00 0.00 H TER 77957 WAT 7069 ATOM 77957 O WAT 7070 106.748 30.064 17.102 1.00 0.00 O ATOM 77958 H1 WAT 7070 107.025 30.952 17.327 1.00 0.00 H ATOM 77959 H2 WAT 7070 106.920 29.991 16.163 1.00 0.00 H TER 77961 WAT 7070 ATOM 77961 O WAT 7071 85.301 20.763 122.766 1.00 0.00 O ATOM 77962 H1 WAT 7071 84.607 20.674 122.113 1.00 0.00 H ATOM 77963 H2 WAT 7071 86.026 21.170 122.291 1.00 0.00 H TER 77965 WAT 7071 ATOM 77965 O WAT 7072 124.406 142.715 89.815 1.00 0.00 O ATOM 77966 H1 WAT 7072 124.702 142.832 88.912 1.00 0.00 H ATOM 77967 H2 WAT 7072 124.528 143.574 90.220 1.00 0.00 H TER 77969 WAT 7072 ATOM 77969 O WAT 7073 72.777 131.477 124.851 1.00 0.00 O ATOM 77970 H1 WAT 7073 72.988 130.576 125.094 1.00 0.00 H ATOM 77971 H2 WAT 7073 72.439 131.412 123.958 1.00 0.00 H TER 77973 WAT 7073 ATOM 77973 O WAT 7074 48.689 68.992 101.220 1.00 0.00 O ATOM 77974 H1 WAT 7074 49.088 69.858 101.137 1.00 0.00 H ATOM 77975 H2 WAT 7074 48.923 68.542 100.408 1.00 0.00 H TER 77977 WAT 7074 ATOM 77977 O WAT 7075 16.989 116.161 112.811 1.00 0.00 O ATOM 77978 H1 WAT 7075 17.581 116.576 113.438 1.00 0.00 H ATOM 77979 H2 WAT 7075 17.067 116.693 112.019 1.00 0.00 H TER 77981 WAT 7075 ATOM 77981 O WAT 7076 41.267 51.273 10.285 1.00 0.00 O ATOM 77982 H1 WAT 7076 41.578 52.167 10.143 1.00 0.00 H ATOM 77983 H2 WAT 7076 41.887 50.900 10.911 1.00 0.00 H TER 77985 WAT 7076 ATOM 77985 O WAT 7077 70.826 124.048 12.257 1.00 0.00 O ATOM 77986 H1 WAT 7077 71.558 123.489 11.998 1.00 0.00 H ATOM 77987 H2 WAT 7077 71.163 124.556 12.995 1.00 0.00 H TER 77989 WAT 7077 ATOM 77989 O WAT 7078 12.442 132.882 145.977 1.00 0.00 O ATOM 77990 H1 WAT 7078 11.994 132.382 145.295 1.00 0.00 H ATOM 77991 H2 WAT 7078 13.276 133.134 145.581 1.00 0.00 H TER 77993 WAT 7078 ATOM 77993 O WAT 7079 73.719 56.894 152.672 1.00 0.00 O ATOM 77994 H1 WAT 7079 73.162 56.253 152.229 1.00 0.00 H ATOM 77995 H2 WAT 7079 73.509 56.792 153.600 1.00 0.00 H TER 77997 WAT 7079 ATOM 77997 O WAT 7080 16.351 57.134 103.841 1.00 0.00 O ATOM 77998 H1 WAT 7080 16.814 57.350 104.650 1.00 0.00 H ATOM 77999 H2 WAT 7080 17.045 56.961 103.206 1.00 0.00 H TER 78001 WAT 7080 ATOM 78001 O WAT 7081 104.431 102.693 158.079 1.00 0.00 O ATOM 78002 H1 WAT 7081 105.120 103.343 158.217 1.00 0.00 H ATOM 78003 H2 WAT 7081 103.718 102.974 158.652 1.00 0.00 H TER 78005 WAT 7081 ATOM 78005 O WAT 7082 140.925 112.361 62.956 1.00 0.00 O ATOM 78006 H1 WAT 7082 140.528 111.728 62.358 1.00 0.00 H ATOM 78007 H2 WAT 7082 141.813 112.484 62.621 1.00 0.00 H TER 78009 WAT 7082 ATOM 78009 O WAT 7083 64.883 100.549 62.006 1.00 0.00 O ATOM 78010 H1 WAT 7083 64.524 101.255 62.543 1.00 0.00 H ATOM 78011 H2 WAT 7083 64.328 100.537 61.226 1.00 0.00 H TER 78013 WAT 7083 ATOM 78013 O WAT 7084 119.081 28.609 94.338 1.00 0.00 O ATOM 78014 H1 WAT 7084 118.393 29.211 94.053 1.00 0.00 H ATOM 78015 H2 WAT 7084 119.897 29.048 94.099 1.00 0.00 H TER 78017 WAT 7084 ATOM 78017 O WAT 7085 54.673 44.478 2.109 1.00 0.00 O ATOM 78018 H1 WAT 7085 54.868 43.566 1.893 1.00 0.00 H ATOM 78019 H2 WAT 7085 55.503 44.937 1.982 1.00 0.00 H TER 78021 WAT 7085 ATOM 78021 O WAT 7086 22.844 38.882 101.470 1.00 0.00 O ATOM 78022 H1 WAT 7086 22.773 39.093 102.401 1.00 0.00 H ATOM 78023 H2 WAT 7086 23.662 38.390 101.398 1.00 0.00 H TER 78025 WAT 7086 ATOM 78025 O WAT 7087 0.896 113.949 97.052 1.00 0.00 O ATOM 78026 H1 WAT 7087 1.174 114.850 96.889 1.00 0.00 H ATOM 78027 H2 WAT 7087 1.170 113.468 96.271 1.00 0.00 H TER 78029 WAT 7087 ATOM 78029 O WAT 7088 144.365 100.544 13.946 1.00 0.00 O ATOM 78030 H1 WAT 7088 143.534 100.258 13.565 1.00 0.00 H ATOM 78031 H2 WAT 7088 144.577 101.352 13.478 1.00 0.00 H TER 78033 WAT 7088 ATOM 78033 O WAT 7089 112.785 6.810 138.961 1.00 0.00 O ATOM 78034 H1 WAT 7089 112.848 7.667 139.381 1.00 0.00 H ATOM 78035 H2 WAT 7089 113.563 6.339 139.259 1.00 0.00 H TER 78037 WAT 7089 ATOM 78037 O WAT 7090 143.801 14.445 140.334 1.00 0.00 O ATOM 78038 H1 WAT 7090 143.733 14.013 139.482 1.00 0.00 H ATOM 78039 H2 WAT 7090 143.877 15.376 140.125 1.00 0.00 H TER 78041 WAT 7090 ATOM 78041 O WAT 7091 120.451 132.221 93.806 1.00 0.00 O ATOM 78042 H1 WAT 7091 120.925 131.493 93.404 1.00 0.00 H ATOM 78043 H2 WAT 7091 119.971 132.623 93.083 1.00 0.00 H TER 78045 WAT 7091 ATOM 78045 O WAT 7092 82.303 106.964 85.979 1.00 0.00 O ATOM 78046 H1 WAT 7092 81.812 107.785 85.994 1.00 0.00 H ATOM 78047 H2 WAT 7092 82.198 106.606 86.860 1.00 0.00 H TER 78049 WAT 7092 ATOM 78049 O WAT 7093 57.410 140.580 113.791 1.00 0.00 O ATOM 78050 H1 WAT 7093 57.058 140.589 114.680 1.00 0.00 H ATOM 78051 H2 WAT 7093 58.164 139.991 113.837 1.00 0.00 H TER 78053 WAT 7093 ATOM 78053 O WAT 7094 28.398 110.453 96.041 1.00 0.00 O ATOM 78054 H1 WAT 7094 28.850 110.552 95.203 1.00 0.00 H ATOM 78055 H2 WAT 7094 27.951 109.609 95.974 1.00 0.00 H TER 78057 WAT 7094 ATOM 78057 O WAT 7095 86.918 2.031 14.490 1.00 0.00 O ATOM 78058 H1 WAT 7095 87.454 2.031 15.283 1.00 0.00 H ATOM 78059 H2 WAT 7095 87.362 2.640 13.900 1.00 0.00 H TER 78061 WAT 7095 ATOM 78061 O WAT 7096 52.111 45.684 123.704 1.00 0.00 O ATOM 78062 H1 WAT 7096 52.843 45.820 123.103 1.00 0.00 H ATOM 78063 H2 WAT 7096 51.456 45.219 123.182 1.00 0.00 H TER 78065 WAT 7096 ATOM 78065 O WAT 7097 49.448 11.556 102.336 1.00 0.00 O ATOM 78066 H1 WAT 7097 49.221 12.328 101.818 1.00 0.00 H ATOM 78067 H2 WAT 7097 50.097 11.872 102.964 1.00 0.00 H TER 78069 WAT 7097 ATOM 78069 O WAT 7098 15.532 64.599 62.649 1.00 0.00 O ATOM 78070 H1 WAT 7098 16.277 65.020 62.219 1.00 0.00 H ATOM 78071 H2 WAT 7098 14.850 65.269 62.657 1.00 0.00 H TER 78073 WAT 7098 ATOM 78073 O WAT 7099 89.685 17.367 71.520 1.00 0.00 O ATOM 78074 H1 WAT 7099 89.535 18.260 71.210 1.00 0.00 H ATOM 78075 H2 WAT 7099 90.208 17.475 72.315 1.00 0.00 H TER 78077 WAT 7099 ATOM 78077 O WAT 7100 26.708 30.936 102.558 1.00 0.00 O ATOM 78078 H1 WAT 7100 25.889 31.348 102.284 1.00 0.00 H ATOM 78079 H2 WAT 7100 27.342 31.653 102.580 1.00 0.00 H TER 78081 WAT 7100 ATOM 78081 O WAT 7101 7.372 69.594 84.796 1.00 0.00 O ATOM 78082 H1 WAT 7101 7.442 69.991 85.664 1.00 0.00 H ATOM 78083 H2 WAT 7101 6.747 68.878 84.910 1.00 0.00 H TER 78085 WAT 7101 ATOM 78085 O WAT 7102 12.979 33.172 149.368 1.00 0.00 O ATOM 78086 H1 WAT 7102 12.042 33.118 149.558 1.00 0.00 H ATOM 78087 H2 WAT 7102 13.404 32.960 150.199 1.00 0.00 H TER 78089 WAT 7102 ATOM 78089 O WAT 7103 45.665 114.518 131.866 1.00 0.00 O ATOM 78090 H1 WAT 7103 45.539 114.932 131.013 1.00 0.00 H ATOM 78091 H2 WAT 7103 46.430 113.955 131.749 1.00 0.00 H TER 78093 WAT 7103 ATOM 78093 O WAT 7104 10.207 124.516 101.420 1.00 0.00 O ATOM 78094 H1 WAT 7104 9.844 125.390 101.563 1.00 0.00 H ATOM 78095 H2 WAT 7104 11.140 124.665 101.271 1.00 0.00 H TER 78097 WAT 7104 ATOM 78097 O WAT 7105 22.931 141.314 145.770 1.00 0.00 O ATOM 78098 H1 WAT 7105 22.800 141.023 144.867 1.00 0.00 H ATOM 78099 H2 WAT 7105 22.064 141.598 146.059 1.00 0.00 H TER 78101 WAT 7105 ATOM 78101 O WAT 7106 142.512 24.883 156.781 1.00 0.00 O ATOM 78102 H1 WAT 7106 141.696 24.986 157.270 1.00 0.00 H ATOM 78103 H2 WAT 7106 143.109 25.520 157.176 1.00 0.00 H TER 78105 WAT 7106 ATOM 78105 O WAT 7107 142.705 42.153 1.216 1.00 0.00 O ATOM 78106 H1 WAT 7107 143.223 41.628 0.606 1.00 0.00 H ATOM 78107 H2 WAT 7107 142.633 41.608 2.000 1.00 0.00 H TER 78109 WAT 7107 ATOM 78109 O WAT 7108 37.274 16.428 128.119 1.00 0.00 O ATOM 78110 H1 WAT 7108 38.001 15.826 127.959 1.00 0.00 H ATOM 78111 H2 WAT 7108 36.627 16.204 127.450 1.00 0.00 H TER 78113 WAT 7108 ATOM 78113 O WAT 7109 110.568 100.093 144.579 1.00 0.00 O ATOM 78114 H1 WAT 7109 110.109 99.297 144.310 1.00 0.00 H ATOM 78115 H2 WAT 7109 110.494 100.102 145.533 1.00 0.00 H TER 78117 WAT 7109 ATOM 78117 O WAT 7110 78.788 1.949 9.120 1.00 0.00 O ATOM 78118 H1 WAT 7110 78.876 2.869 8.872 1.00 0.00 H ATOM 78119 H2 WAT 7110 78.288 1.968 9.936 1.00 0.00 H TER 78121 WAT 7110 ATOM 78121 O WAT 7111 43.833 2.078 72.709 1.00 0.00 O ATOM 78122 H1 WAT 7111 43.631 1.399 72.066 1.00 0.00 H ATOM 78123 H2 WAT 7111 43.050 2.628 72.732 1.00 0.00 H TER 78125 WAT 7111 ATOM 78125 O WAT 7112 96.636 30.713 114.074 1.00 0.00 O ATOM 78126 H1 WAT 7112 97.007 31.011 113.243 1.00 0.00 H ATOM 78127 H2 WAT 7112 96.266 29.853 113.875 1.00 0.00 H TER 78129 WAT 7112 ATOM 78129 O WAT 7113 47.152 101.982 77.556 1.00 0.00 O ATOM 78130 H1 WAT 7113 46.679 102.215 76.757 1.00 0.00 H ATOM 78131 H2 WAT 7113 47.865 102.619 77.605 1.00 0.00 H TER 78133 WAT 7113 ATOM 78133 O WAT 7114 93.284 0.867 56.802 1.00 0.00 O ATOM 78134 H1 WAT 7114 92.664 1.079 56.104 1.00 0.00 H ATOM 78135 H2 WAT 7114 94.085 1.333 56.560 1.00 0.00 H TER 78137 WAT 7114 ATOM 78137 O WAT 7115 57.364 78.012 26.719 1.00 0.00 O ATOM 78138 H1 WAT 7115 57.028 77.254 27.197 1.00 0.00 H ATOM 78139 H2 WAT 7115 58.205 77.720 26.366 1.00 0.00 H TER 78141 WAT 7115 ATOM 78141 O WAT 7116 133.374 53.371 136.883 1.00 0.00 O ATOM 78142 H1 WAT 7116 133.799 52.546 137.119 1.00 0.00 H ATOM 78143 H2 WAT 7116 133.873 53.691 136.132 1.00 0.00 H TER 78145 WAT 7116 ATOM 78145 O WAT 7117 139.013 36.688 100.496 1.00 0.00 O ATOM 78146 H1 WAT 7117 139.644 37.403 100.581 1.00 0.00 H ATOM 78147 H2 WAT 7117 138.673 36.774 99.606 1.00 0.00 H TER 78149 WAT 7117 ATOM 78149 O WAT 7118 54.425 31.001 68.062 1.00 0.00 O ATOM 78150 H1 WAT 7118 54.831 30.515 67.344 1.00 0.00 H ATOM 78151 H2 WAT 7118 54.945 31.801 68.134 1.00 0.00 H TER 78153 WAT 7118 ATOM 78153 O WAT 7119 16.353 51.531 156.732 1.00 0.00 O ATOM 78154 H1 WAT 7119 15.509 51.941 156.920 1.00 0.00 H ATOM 78155 H2 WAT 7119 16.142 50.805 156.146 1.00 0.00 H TER 78157 WAT 7119 ATOM 78157 O WAT 7120 7.822 113.916 107.786 1.00 0.00 O ATOM 78158 H1 WAT 7120 8.714 114.262 107.748 1.00 0.00 H ATOM 78159 H2 WAT 7120 7.680 113.527 106.923 1.00 0.00 H TER 78161 WAT 7120 ATOM 78161 O WAT 7121 8.975 32.116 136.529 1.00 0.00 O ATOM 78162 H1 WAT 7121 9.152 32.442 137.412 1.00 0.00 H ATOM 78163 H2 WAT 7121 8.290 31.458 136.649 1.00 0.00 H TER 78165 WAT 7121 ATOM 78165 O WAT 7122 90.850 7.773 119.335 1.00 0.00 O ATOM 78166 H1 WAT 7122 91.031 8.701 119.183 1.00 0.00 H ATOM 78167 H2 WAT 7122 90.907 7.373 118.467 1.00 0.00 H TER 78169 WAT 7122 ATOM 78169 O WAT 7123 62.829 84.347 74.713 1.00 0.00 O ATOM 78170 H1 WAT 7123 63.707 84.493 74.361 1.00 0.00 H ATOM 78171 H2 WAT 7123 62.930 84.454 75.659 1.00 0.00 H TER 78173 WAT 7123 ATOM 78173 O WAT 7124 139.391 111.443 87.372 1.00 0.00 O ATOM 78174 H1 WAT 7124 139.791 110.601 87.157 1.00 0.00 H ATOM 78175 H2 WAT 7124 139.428 111.489 88.328 1.00 0.00 H TER 78177 WAT 7124 ATOM 78177 O WAT 7125 56.529 102.167 107.136 1.00 0.00 O ATOM 78178 H1 WAT 7125 56.805 102.425 108.015 1.00 0.00 H ATOM 78179 H2 WAT 7125 56.806 102.892 106.575 1.00 0.00 H TER 78181 WAT 7125 ATOM 78181 O WAT 7126 66.899 1.175 67.077 1.00 0.00 O ATOM 78182 H1 WAT 7126 66.299 1.360 66.355 1.00 0.00 H ATOM 78183 H2 WAT 7126 66.379 1.327 67.866 1.00 0.00 H TER 78185 WAT 7126 ATOM 78185 O WAT 7127 138.272 77.436 74.365 1.00 0.00 O ATOM 78186 H1 WAT 7127 138.776 78.227 74.174 1.00 0.00 H ATOM 78187 H2 WAT 7127 138.509 77.214 75.266 1.00 0.00 H TER 78189 WAT 7127 ATOM 78189 O WAT 7128 77.625 59.072 120.600 1.00 0.00 O ATOM 78190 H1 WAT 7128 76.840 59.505 120.265 1.00 0.00 H ATOM 78191 H2 WAT 7128 77.923 59.636 121.314 1.00 0.00 H TER 78193 WAT 7128 ATOM 78193 O WAT 7129 6.879 121.456 93.340 1.00 0.00 O ATOM 78194 H1 WAT 7129 6.964 120.882 92.579 1.00 0.00 H ATOM 78195 H2 WAT 7129 7.347 120.999 94.039 1.00 0.00 H TER 78197 WAT 7129 ATOM 78197 O WAT 7130 48.684 102.266 106.534 1.00 0.00 O ATOM 78198 H1 WAT 7130 48.443 101.413 106.173 1.00 0.00 H ATOM 78199 H2 WAT 7130 48.472 102.889 105.839 1.00 0.00 H TER 78201 WAT 7130 ATOM 78201 O WAT 7131 4.361 74.585 111.664 1.00 0.00 O ATOM 78202 H1 WAT 7131 4.841 75.412 111.613 1.00 0.00 H ATOM 78203 H2 WAT 7131 4.968 73.981 112.092 1.00 0.00 H TER 78205 WAT 7131 ATOM 78205 O WAT 7132 63.522 45.016 67.666 1.00 0.00 O ATOM 78206 H1 WAT 7132 63.842 45.581 68.370 1.00 0.00 H ATOM 78207 H2 WAT 7132 63.971 45.333 66.882 1.00 0.00 H TER 78209 WAT 7132 ATOM 78209 O WAT 7133 127.062 16.775 17.623 1.00 0.00 O ATOM 78210 H1 WAT 7133 126.973 15.858 17.882 1.00 0.00 H ATOM 78211 H2 WAT 7133 127.905 17.045 17.986 1.00 0.00 H TER 78213 WAT 7133 ATOM 78213 O WAT 7134 85.985 122.799 106.776 1.00 0.00 O ATOM 78214 H1 WAT 7134 86.787 123.085 106.339 1.00 0.00 H ATOM 78215 H2 WAT 7134 85.811 121.931 106.412 1.00 0.00 H TER 78217 WAT 7134 ATOM 78217 O WAT 7135 8.020 12.054 139.563 1.00 0.00 O ATOM 78218 H1 WAT 7135 7.584 11.799 140.376 1.00 0.00 H ATOM 78219 H2 WAT 7135 8.086 13.008 139.615 1.00 0.00 H TER 78221 WAT 7135 ATOM 78221 O WAT 7136 128.757 24.768 69.727 1.00 0.00 O ATOM 78222 H1 WAT 7136 129.494 24.787 69.117 1.00 0.00 H ATOM 78223 H2 WAT 7136 128.904 25.518 70.304 1.00 0.00 H TER 78225 WAT 7136 ATOM 78225 O WAT 7137 8.792 46.963 154.526 1.00 0.00 O ATOM 78226 H1 WAT 7137 9.036 46.136 154.110 1.00 0.00 H ATOM 78227 H2 WAT 7137 8.309 46.704 155.310 1.00 0.00 H TER 78229 WAT 7137 ATOM 78229 O WAT 7138 24.764 131.779 80.684 1.00 0.00 O ATOM 78230 H1 WAT 7138 24.345 131.647 79.833 1.00 0.00 H ATOM 78231 H2 WAT 7138 25.121 132.666 80.641 1.00 0.00 H TER 78233 WAT 7138 ATOM 78233 O WAT 7139 132.823 32.584 146.999 1.00 0.00 O ATOM 78234 H1 WAT 7139 132.704 32.400 146.067 1.00 0.00 H ATOM 78235 H2 WAT 7139 133.076 31.744 147.380 1.00 0.00 H TER 78237 WAT 7139 ATOM 78237 O WAT 7140 44.935 101.741 60.898 1.00 0.00 O ATOM 78238 H1 WAT 7140 44.945 101.604 59.951 1.00 0.00 H ATOM 78239 H2 WAT 7140 45.848 101.629 61.166 1.00 0.00 H TER 78241 WAT 7140 ATOM 78241 O WAT 7141 126.460 66.379 9.805 1.00 0.00 O ATOM 78242 H1 WAT 7141 126.441 65.535 9.354 1.00 0.00 H ATOM 78243 H2 WAT 7141 125.834 66.921 9.325 1.00 0.00 H TER 78245 WAT 7141 ATOM 78245 O WAT 7142 35.220 30.948 76.169 1.00 0.00 O ATOM 78246 H1 WAT 7142 35.278 31.526 76.929 1.00 0.00 H ATOM 78247 H2 WAT 7142 36.062 31.049 75.726 1.00 0.00 H TER 78249 WAT 7142 ATOM 78249 O WAT 7143 99.280 13.146 78.142 1.00 0.00 O ATOM 78250 H1 WAT 7143 99.125 13.161 77.197 1.00 0.00 H ATOM 78251 H2 WAT 7143 99.412 14.065 78.377 1.00 0.00 H TER 78253 WAT 7143 ATOM 78253 O WAT 7144 130.478 99.016 12.986 1.00 0.00 O ATOM 78254 H1 WAT 7144 130.009 99.514 12.317 1.00 0.00 H ATOM 78255 H2 WAT 7144 129.992 99.183 13.794 1.00 0.00 H TER 78257 WAT 7144 ATOM 78257 O WAT 7145 129.480 87.919 152.659 1.00 0.00 O ATOM 78258 H1 WAT 7145 128.837 87.288 152.337 1.00 0.00 H ATOM 78259 H2 WAT 7145 130.273 87.730 152.157 1.00 0.00 H TER 78261 WAT 7145 ATOM 78261 O WAT 7146 18.408 29.159 4.817 1.00 0.00 O ATOM 78262 H1 WAT 7146 18.722 28.895 5.681 1.00 0.00 H ATOM 78263 H2 WAT 7146 19.152 29.612 4.420 1.00 0.00 H TER 78265 WAT 7146 ATOM 78265 O WAT 7147 25.667 47.028 109.600 1.00 0.00 O ATOM 78266 H1 WAT 7147 25.648 47.856 109.121 1.00 0.00 H ATOM 78267 H2 WAT 7147 26.596 46.811 109.669 1.00 0.00 H TER 78269 WAT 7147 ATOM 78269 O WAT 7148 145.602 64.223 75.231 1.00 0.00 O ATOM 78270 H1 WAT 7148 145.712 65.039 74.744 1.00 0.00 H ATOM 78271 H2 WAT 7148 146.492 63.892 75.349 1.00 0.00 H TER 78273 WAT 7148 ATOM 78273 O WAT 7149 35.683 114.455 24.218 1.00 0.00 O ATOM 78274 H1 WAT 7149 36.310 114.415 24.939 1.00 0.00 H ATOM 78275 H2 WAT 7149 36.161 114.109 23.465 1.00 0.00 H TER 78277 WAT 7149 ATOM 78277 O WAT 7150 59.353 95.888 12.167 1.00 0.00 O ATOM 78278 H1 WAT 7150 59.059 95.104 11.703 1.00 0.00 H ATOM 78279 H2 WAT 7150 58.715 96.561 11.928 1.00 0.00 H TER 78281 WAT 7150 ATOM 78281 O WAT 7151 29.110 51.005 69.513 1.00 0.00 O ATOM 78282 H1 WAT 7151 29.475 51.118 68.636 1.00 0.00 H ATOM 78283 H2 WAT 7151 29.771 50.498 69.984 1.00 0.00 H TER 78285 WAT 7151 ATOM 78285 O WAT 7152 81.792 126.812 20.471 1.00 0.00 O ATOM 78286 H1 WAT 7152 81.763 126.423 21.345 1.00 0.00 H ATOM 78287 H2 WAT 7152 81.829 127.755 20.629 1.00 0.00 H TER 78289 WAT 7152 ATOM 78289 O WAT 7153 132.474 16.742 110.533 1.00 0.00 O ATOM 78290 H1 WAT 7153 131.570 16.457 110.400 1.00 0.00 H ATOM 78291 H2 WAT 7153 132.401 17.664 110.781 1.00 0.00 H TER 78293 WAT 7153 ATOM 78293 O WAT 7154 53.344 101.431 59.238 1.00 0.00 O ATOM 78294 H1 WAT 7154 53.848 100.648 59.015 1.00 0.00 H ATOM 78295 H2 WAT 7154 53.554 102.057 58.545 1.00 0.00 H TER 78297 WAT 7154 ATOM 78297 O WAT 7155 43.499 76.091 98.603 1.00 0.00 O ATOM 78298 H1 WAT 7155 43.972 75.283 98.404 1.00 0.00 H ATOM 78299 H2 WAT 7155 42.576 75.859 98.505 1.00 0.00 H TER 78301 WAT 7155 ATOM 78301 O WAT 7156 107.376 1.579 100.517 1.00 0.00 O ATOM 78302 H1 WAT 7156 106.445 1.679 100.717 1.00 0.00 H ATOM 78303 H2 WAT 7156 107.534 0.637 100.580 1.00 0.00 H TER 78305 WAT 7156 ATOM 78305 O WAT 7157 108.228 23.532 109.559 1.00 0.00 O ATOM 78306 H1 WAT 7157 108.503 22.617 109.495 1.00 0.00 H ATOM 78307 H2 WAT 7157 107.392 23.499 110.024 1.00 0.00 H TER 78309 WAT 7157 ATOM 78309 O WAT 7158 0.084 134.994 71.548 1.00 0.00 O ATOM 78310 H1 WAT 7158 0.331 134.071 71.605 1.00 0.00 H ATOM 78311 H2 WAT 7158 0.150 135.202 70.616 1.00 0.00 H TER 78313 WAT 7158 ATOM 78313 O WAT 7159 58.215 140.464 18.258 1.00 0.00 O ATOM 78314 H1 WAT 7159 58.011 139.557 18.032 1.00 0.00 H ATOM 78315 H2 WAT 7159 58.649 140.407 19.110 1.00 0.00 H TER 78317 WAT 7159 ATOM 78317 O WAT 7160 23.375 119.062 139.861 1.00 0.00 O ATOM 78318 H1 WAT 7160 23.850 118.598 139.170 1.00 0.00 H ATOM 78319 H2 WAT 7160 22.471 119.095 139.549 1.00 0.00 H TER 78321 WAT 7160 ATOM 78321 O WAT 7161 134.281 4.612 110.171 1.00 0.00 O ATOM 78322 H1 WAT 7161 133.915 5.398 110.577 1.00 0.00 H ATOM 78323 H2 WAT 7161 135.217 4.653 110.370 1.00 0.00 H TER 78325 WAT 7161 ATOM 78325 O WAT 7162 83.480 90.131 136.298 1.00 0.00 O ATOM 78326 H1 WAT 7162 82.603 89.864 136.022 1.00 0.00 H ATOM 78327 H2 WAT 7162 83.413 90.230 137.248 1.00 0.00 H TER 78329 WAT 7162 ATOM 78329 O WAT 7163 142.180 46.998 78.175 1.00 0.00 O ATOM 78330 H1 WAT 7163 143.062 47.228 77.882 1.00 0.00 H ATOM 78331 H2 WAT 7163 141.668 46.937 77.368 1.00 0.00 H TER 78333 WAT 7163 ATOM 78333 O WAT 7164 20.594 18.275 119.486 1.00 0.00 O ATOM 78334 H1 WAT 7164 19.717 17.896 119.431 1.00 0.00 H ATOM 78335 H2 WAT 7164 21.171 17.524 119.629 1.00 0.00 H TER 78337 WAT 7164 ATOM 78337 O WAT 7165 14.449 24.047 131.264 1.00 0.00 O ATOM 78338 H1 WAT 7165 13.942 23.257 131.450 1.00 0.00 H ATOM 78339 H2 WAT 7165 13.835 24.626 130.813 1.00 0.00 H TER 78341 WAT 7165 ATOM 78341 O WAT 7166 39.525 17.689 12.011 1.00 0.00 O ATOM 78342 H1 WAT 7166 40.362 17.557 12.457 1.00 0.00 H ATOM 78343 H2 WAT 7166 38.973 16.970 12.320 1.00 0.00 H TER 78345 WAT 7166 ATOM 78345 O WAT 7167 34.825 33.195 116.480 1.00 0.00 O ATOM 78346 H1 WAT 7167 34.570 33.741 117.224 1.00 0.00 H ATOM 78347 H2 WAT 7167 34.006 33.025 116.015 1.00 0.00 H TER 78349 WAT 7167 ATOM 78349 O WAT 7168 53.087 24.867 109.798 1.00 0.00 O ATOM 78350 H1 WAT 7168 52.451 25.576 109.897 1.00 0.00 H ATOM 78351 H2 WAT 7168 53.392 24.692 110.688 1.00 0.00 H TER 78353 WAT 7168 ATOM 78353 O WAT 7169 71.512 0.313 69.806 1.00 0.00 O ATOM 78354 H1 WAT 7169 70.899 -0.395 69.610 1.00 0.00 H ATOM 78355 H2 WAT 7169 71.553 0.338 70.762 1.00 0.00 H TER 78357 WAT 7169 ATOM 78357 O WAT 7170 84.558 8.013 109.985 1.00 0.00 O ATOM 78358 H1 WAT 7170 85.011 8.697 109.493 1.00 0.00 H ATOM 78359 H2 WAT 7170 83.860 7.719 109.400 1.00 0.00 H TER 78361 WAT 7170 ATOM 78361 O WAT 7171 20.750 114.086 101.535 1.00 0.00 O ATOM 78362 H1 WAT 7171 21.385 114.540 102.089 1.00 0.00 H ATOM 78363 H2 WAT 7171 20.734 114.594 100.724 1.00 0.00 H TER 78365 WAT 7171 ATOM 78365 O WAT 7172 78.288 124.998 138.960 1.00 0.00 O ATOM 78366 H1 WAT 7172 78.313 125.954 138.972 1.00 0.00 H ATOM 78367 H2 WAT 7172 79.207 124.734 138.921 1.00 0.00 H TER 78369 WAT 7172 ATOM 78369 O WAT 7173 142.404 94.132 112.363 1.00 0.00 O ATOM 78370 H1 WAT 7173 142.937 94.567 113.028 1.00 0.00 H ATOM 78371 H2 WAT 7173 142.653 94.555 111.541 1.00 0.00 H TER 78373 WAT 7173 ATOM 78373 O WAT 7174 69.899 24.219 134.701 1.00 0.00 O ATOM 78374 H1 WAT 7174 70.227 23.362 134.428 1.00 0.00 H ATOM 78375 H2 WAT 7174 69.257 24.455 134.031 1.00 0.00 H TER 78377 WAT 7174 ATOM 78377 O WAT 7175 1.409 75.579 131.755 1.00 0.00 O ATOM 78378 H1 WAT 7175 1.643 76.191 132.453 1.00 0.00 H ATOM 78379 H2 WAT 7175 0.846 76.087 131.170 1.00 0.00 H TER 78381 WAT 7175 ATOM 78381 O WAT 7176 121.465 37.450 14.804 1.00 0.00 O ATOM 78382 H1 WAT 7176 121.300 37.621 15.731 1.00 0.00 H ATOM 78383 H2 WAT 7176 121.805 38.277 14.464 1.00 0.00 H TER 78385 WAT 7176 ATOM 78385 O WAT 7177 135.073 81.151 1.420 1.00 0.00 O ATOM 78386 H1 WAT 7177 135.651 80.785 2.090 1.00 0.00 H ATOM 78387 H2 WAT 7177 134.833 82.014 1.757 1.00 0.00 H TER 78389 WAT 7177 ATOM 78389 O WAT 7178 54.651 120.237 74.564 1.00 0.00 O ATOM 78390 H1 WAT 7178 55.581 120.327 74.770 1.00 0.00 H ATOM 78391 H2 WAT 7178 54.204 120.743 75.243 1.00 0.00 H TER 78393 WAT 7178 ATOM 78393 O WAT 7179 11.145 107.794 106.139 1.00 0.00 O ATOM 78394 H1 WAT 7179 11.435 108.698 106.261 1.00 0.00 H ATOM 78395 H2 WAT 7179 10.477 107.847 105.455 1.00 0.00 H TER 78397 WAT 7179 ATOM 78397 O WAT 7180 54.656 85.020 156.711 1.00 0.00 O ATOM 78398 H1 WAT 7180 54.298 85.857 157.008 1.00 0.00 H ATOM 78399 H2 WAT 7180 53.887 84.474 156.550 1.00 0.00 H TER 78401 WAT 7180 ATOM 78401 O WAT 7181 52.716 130.447 147.135 1.00 0.00 O ATOM 78402 H1 WAT 7181 52.173 130.963 146.539 1.00 0.00 H ATOM 78403 H2 WAT 7181 53.523 130.953 147.222 1.00 0.00 H TER 78405 WAT 7181 ATOM 78405 O WAT 7182 39.917 83.026 7.441 1.00 0.00 O ATOM 78406 H1 WAT 7182 40.724 82.826 7.916 1.00 0.00 H ATOM 78407 H2 WAT 7182 39.592 82.173 7.151 1.00 0.00 H TER 78409 WAT 7182 ATOM 78409 O WAT 7183 44.152 44.899 112.639 1.00 0.00 O ATOM 78410 H1 WAT 7183 43.565 45.406 112.079 1.00 0.00 H ATOM 78411 H2 WAT 7183 44.529 44.239 112.057 1.00 0.00 H TER 78413 WAT 7183 ATOM 78413 O WAT 7184 99.536 61.240 102.566 1.00 0.00 O ATOM 78414 H1 WAT 7184 99.865 61.692 101.789 1.00 0.00 H ATOM 78415 H2 WAT 7184 100.252 60.662 102.828 1.00 0.00 H TER 78417 WAT 7184 ATOM 78417 O WAT 7185 60.743 65.663 129.375 1.00 0.00 O ATOM 78418 H1 WAT 7185 60.895 66.241 130.123 1.00 0.00 H ATOM 78419 H2 WAT 7185 59.791 65.606 129.306 1.00 0.00 H TER 78421 WAT 7185 ATOM 78421 O WAT 7186 137.570 131.477 124.345 1.00 0.00 O ATOM 78422 H1 WAT 7186 136.779 131.432 123.808 1.00 0.00 H ATOM 78423 H2 WAT 7186 137.257 131.365 125.243 1.00 0.00 H TER 78425 WAT 7186 ATOM 78425 O WAT 7187 141.058 86.877 68.480 1.00 0.00 O ATOM 78426 H1 WAT 7187 141.631 87.597 68.215 1.00 0.00 H ATOM 78427 H2 WAT 7187 140.916 86.376 67.677 1.00 0.00 H TER 78429 WAT 7187 ATOM 78429 O WAT 7188 21.712 88.684 149.564 1.00 0.00 O ATOM 78430 H1 WAT 7188 22.585 88.951 149.851 1.00 0.00 H ATOM 78431 H2 WAT 7188 21.705 87.733 149.670 1.00 0.00 H TER 78433 WAT 7188 ATOM 78433 O WAT 7189 10.725 119.956 126.454 1.00 0.00 O ATOM 78434 H1 WAT 7189 9.960 120.323 126.897 1.00 0.00 H ATOM 78435 H2 WAT 7189 10.620 120.218 125.539 1.00 0.00 H TER 78437 WAT 7189 ATOM 78437 O WAT 7190 87.884 44.716 124.664 1.00 0.00 O ATOM 78438 H1 WAT 7190 88.163 44.240 125.446 1.00 0.00 H ATOM 78439 H2 WAT 7190 88.698 44.912 124.200 1.00 0.00 H TER 78441 WAT 7190 ATOM 78441 O WAT 7191 56.907 142.099 81.940 1.00 0.00 O ATOM 78442 H1 WAT 7191 56.551 141.400 81.391 1.00 0.00 H ATOM 78443 H2 WAT 7191 57.797 141.813 82.146 1.00 0.00 H TER 78445 WAT 7191 ATOM 78445 O WAT 7192 104.649 6.734 96.406 1.00 0.00 O ATOM 78446 H1 WAT 7192 104.947 7.305 95.698 1.00 0.00 H ATOM 78447 H2 WAT 7192 103.844 6.339 96.073 1.00 0.00 H TER 78449 WAT 7192 ATOM 78449 O WAT 7193 99.474 111.439 130.409 1.00 0.00 O ATOM 78450 H1 WAT 7193 98.698 111.827 130.003 1.00 0.00 H ATOM 78451 H2 WAT 7193 99.153 111.066 131.230 1.00 0.00 H TER 78453 WAT 7193 ATOM 78453 O WAT 7194 121.849 129.514 135.972 1.00 0.00 O ATOM 78454 H1 WAT 7194 121.003 129.094 135.817 1.00 0.00 H ATOM 78455 H2 WAT 7194 121.739 130.405 135.638 1.00 0.00 H TER 78457 WAT 7194 ATOM 78457 O WAT 7195 13.138 74.811 3.970 1.00 0.00 O ATOM 78458 H1 WAT 7195 13.842 74.244 4.286 1.00 0.00 H ATOM 78459 H2 WAT 7195 12.731 74.313 3.261 1.00 0.00 H TER 78461 WAT 7195 ATOM 78461 O WAT 7196 103.875 129.194 127.291 1.00 0.00 O ATOM 78462 H1 WAT 7196 103.758 129.643 126.454 1.00 0.00 H ATOM 78463 H2 WAT 7196 104.517 128.509 127.108 1.00 0.00 H TER 78465 WAT 7196 ATOM 78465 O WAT 7197 101.681 124.193 95.307 1.00 0.00 O ATOM 78466 H1 WAT 7197 101.337 124.971 95.747 1.00 0.00 H ATOM 78467 H2 WAT 7197 100.974 123.551 95.367 1.00 0.00 H TER 78469 WAT 7197 ATOM 78469 O WAT 7198 134.354 127.656 109.815 1.00 0.00 O ATOM 78470 H1 WAT 7198 134.536 128.451 110.317 1.00 0.00 H ATOM 78471 H2 WAT 7198 133.542 127.850 109.346 1.00 0.00 H TER 78473 WAT 7198 ATOM 78473 O WAT 7199 0.784 82.543 65.356 1.00 0.00 O ATOM 78474 H1 WAT 7199 1.465 82.963 65.881 1.00 0.00 H ATOM 78475 H2 WAT 7199 -0.037 82.817 65.764 1.00 0.00 H TER 78477 WAT 7199 ATOM 78477 O WAT 7200 103.565 136.578 151.954 1.00 0.00 O ATOM 78478 H1 WAT 7200 103.768 135.647 152.045 1.00 0.00 H ATOM 78479 H2 WAT 7200 104.284 136.929 151.428 1.00 0.00 H TER 78481 WAT 7200 ATOM 78481 O WAT 7201 72.885 115.272 66.018 1.00 0.00 O ATOM 78482 H1 WAT 7201 72.504 114.763 66.733 1.00 0.00 H ATOM 78483 H2 WAT 7201 72.497 114.901 65.226 1.00 0.00 H TER 78485 WAT 7201 ATOM 78485 O WAT 7202 4.376 57.897 11.651 1.00 0.00 O ATOM 78486 H1 WAT 7202 5.060 58.101 12.288 1.00 0.00 H ATOM 78487 H2 WAT 7202 3.773 57.323 12.123 1.00 0.00 H TER 78489 WAT 7202 ATOM 78489 O WAT 7203 46.324 -0.088 139.579 1.00 0.00 O ATOM 78490 H1 WAT 7203 46.047 0.598 138.973 1.00 0.00 H ATOM 78491 H2 WAT 7203 46.968 0.338 140.146 1.00 0.00 H TER 78493 WAT 7203 ATOM 78493 O WAT 7204 112.473 8.992 125.403 1.00 0.00 O ATOM 78494 H1 WAT 7204 113.402 8.945 125.174 1.00 0.00 H ATOM 78495 H2 WAT 7204 112.024 9.078 124.562 1.00 0.00 H TER 78497 WAT 7204 ATOM 78497 O WAT 7205 13.154 6.252 111.895 1.00 0.00 O ATOM 78498 H1 WAT 7205 13.748 5.539 111.659 1.00 0.00 H ATOM 78499 H2 WAT 7205 13.485 7.009 111.411 1.00 0.00 H TER 78501 WAT 7205 ATOM 78501 O WAT 7206 83.168 130.641 18.426 1.00 0.00 O ATOM 78502 H1 WAT 7206 83.667 131.276 18.939 1.00 0.00 H ATOM 78503 H2 WAT 7206 82.790 130.050 19.078 1.00 0.00 H TER 78505 WAT 7206 ATOM 78505 O WAT 7207 27.761 50.338 98.665 1.00 0.00 O ATOM 78506 H1 WAT 7207 26.820 50.513 98.649 1.00 0.00 H ATOM 78507 H2 WAT 7207 27.855 49.495 98.220 1.00 0.00 H TER 78509 WAT 7207 ATOM 78509 O WAT 7208 5.332 109.242 9.997 1.00 0.00 O ATOM 78510 H1 WAT 7208 5.652 108.345 9.904 1.00 0.00 H ATOM 78511 H2 WAT 7208 4.917 109.260 10.860 1.00 0.00 H TER 78513 WAT 7208 ATOM 78513 O WAT 7209 131.894 124.078 80.648 1.00 0.00 O ATOM 78514 H1 WAT 7209 132.156 123.188 80.413 1.00 0.00 H ATOM 78515 H2 WAT 7209 131.486 123.988 81.509 1.00 0.00 H TER 78517 WAT 7209 ATOM 78517 O WAT 7210 103.351 138.266 69.260 1.00 0.00 O ATOM 78518 H1 WAT 7210 104.228 137.882 69.291 1.00 0.00 H ATOM 78519 H2 WAT 7210 103.005 138.003 68.407 1.00 0.00 H TER 78521 WAT 7210 ATOM 78521 O WAT 7211 136.977 3.741 10.600 1.00 0.00 O ATOM 78522 H1 WAT 7211 136.502 2.959 10.319 1.00 0.00 H ATOM 78523 H2 WAT 7211 137.898 3.483 10.574 1.00 0.00 H TER 78525 WAT 7211 ATOM 78525 O WAT 7212 124.077 13.697 67.816 1.00 0.00 O ATOM 78526 H1 WAT 7212 124.063 13.767 68.771 1.00 0.00 H ATOM 78527 H2 WAT 7212 124.903 13.255 67.620 1.00 0.00 H TER 78529 WAT 7212 ATOM 78529 O WAT 7213 53.025 113.444 158.134 1.00 0.00 O ATOM 78530 H1 WAT 7213 52.515 112.820 157.618 1.00 0.00 H ATOM 78531 H2 WAT 7213 52.599 114.287 157.980 1.00 0.00 H TER 78533 WAT 7213 ATOM 78533 O WAT 7214 94.808 48.324 119.505 1.00 0.00 O ATOM 78534 H1 WAT 7214 94.900 47.865 120.340 1.00 0.00 H ATOM 78535 H2 WAT 7214 94.159 49.006 119.676 1.00 0.00 H TER 78537 WAT 7214 ATOM 78537 O WAT 7215 108.557 73.003 126.638 1.00 0.00 O ATOM 78538 H1 WAT 7215 108.325 72.825 127.550 1.00 0.00 H ATOM 78539 H2 WAT 7215 109.492 72.806 126.586 1.00 0.00 H TER 78541 WAT 7215 ATOM 78541 O WAT 7216 63.279 97.103 92.812 1.00 0.00 O ATOM 78542 H1 WAT 7216 62.757 97.827 93.157 1.00 0.00 H ATOM 78543 H2 WAT 7216 62.718 96.697 92.151 1.00 0.00 H TER 78545 WAT 7216 ATOM 78545 O WAT 7217 13.883 130.020 57.696 1.00 0.00 O ATOM 78546 H1 WAT 7217 13.905 130.660 58.408 1.00 0.00 H ATOM 78547 H2 WAT 7217 13.068 130.207 57.231 1.00 0.00 H TER 78549 WAT 7217 ATOM 78549 O WAT 7218 116.906 145.007 142.677 1.00 0.00 O ATOM 78550 H1 WAT 7218 116.653 144.794 141.779 1.00 0.00 H ATOM 78551 H2 WAT 7218 117.856 144.895 142.692 1.00 0.00 H TER 78553 WAT 7218 ATOM 78553 O WAT 7219 46.650 14.459 123.636 1.00 0.00 O ATOM 78554 H1 WAT 7219 46.796 14.917 124.464 1.00 0.00 H ATOM 78555 H2 WAT 7219 47.512 14.120 123.395 1.00 0.00 H TER 78557 WAT 7219 ATOM 78557 O WAT 7220 96.667 57.591 61.777 1.00 0.00 O ATOM 78558 H1 WAT 7220 97.396 57.134 61.356 1.00 0.00 H ATOM 78559 H2 WAT 7220 96.002 57.662 61.093 1.00 0.00 H TER 78561 WAT 7220 ATOM 78561 O WAT 7221 121.003 140.622 64.548 1.00 0.00 O ATOM 78562 H1 WAT 7221 121.647 140.156 65.080 1.00 0.00 H ATOM 78563 H2 WAT 7221 121.525 141.204 63.995 1.00 0.00 H TER 78565 WAT 7221 ATOM 78565 O WAT 7222 127.455 78.947 6.004 1.00 0.00 O ATOM 78566 H1 WAT 7222 127.905 79.636 6.492 1.00 0.00 H ATOM 78567 H2 WAT 7222 126.624 79.342 5.741 1.00 0.00 H TER 78569 WAT 7222 ATOM 78569 O WAT 7223 86.098 70.622 1.234 1.00 0.00 O ATOM 78570 H1 WAT 7223 86.811 71.243 1.087 1.00 0.00 H ATOM 78571 H2 WAT 7223 86.284 69.898 0.637 1.00 0.00 H TER 78573 WAT 7223 ATOM 78573 O WAT 7224 55.375 55.614 101.411 1.00 0.00 O ATOM 78574 H1 WAT 7224 55.721 55.990 102.220 1.00 0.00 H ATOM 78575 H2 WAT 7224 56.136 55.222 100.984 1.00 0.00 H TER 78577 WAT 7224 ATOM 78577 O WAT 7225 37.316 9.207 14.190 1.00 0.00 O ATOM 78578 H1 WAT 7225 36.982 9.377 13.310 1.00 0.00 H ATOM 78579 H2 WAT 7225 36.933 9.898 14.730 1.00 0.00 H TER 78581 WAT 7225 ATOM 78581 O WAT 7226 51.192 72.074 3.215 1.00 0.00 O ATOM 78582 H1 WAT 7226 51.398 71.985 2.284 1.00 0.00 H ATOM 78583 H2 WAT 7226 50.413 71.532 3.341 1.00 0.00 H TER 78585 WAT 7226 ATOM 78585 O WAT 7227 110.739 4.084 157.817 1.00 0.00 O ATOM 78586 H1 WAT 7227 110.827 4.970 157.468 1.00 0.00 H ATOM 78587 H2 WAT 7227 110.358 4.205 158.686 1.00 0.00 H TER 78589 WAT 7227 ATOM 78589 O WAT 7228 104.950 117.620 65.539 1.00 0.00 O ATOM 78590 H1 WAT 7228 105.071 117.307 66.436 1.00 0.00 H ATOM 78591 H2 WAT 7228 104.692 116.841 65.047 1.00 0.00 H TER 78593 WAT 7228 ATOM 78593 O WAT 7229 126.825 7.278 122.679 1.00 0.00 O ATOM 78594 H1 WAT 7229 126.992 8.199 122.875 1.00 0.00 H ATOM 78595 H2 WAT 7229 127.588 6.817 123.027 1.00 0.00 H TER 78597 WAT 7229 ATOM 78597 O WAT 7230 63.600 85.630 65.686 1.00 0.00 O ATOM 78598 H1 WAT 7230 63.489 86.153 66.480 1.00 0.00 H ATOM 78599 H2 WAT 7230 64.520 85.747 65.448 1.00 0.00 H TER 78601 WAT 7230 ATOM 78601 O WAT 7231 130.517 0.304 66.704 1.00 0.00 O ATOM 78602 H1 WAT 7231 129.967 1.008 66.361 1.00 0.00 H ATOM 78603 H2 WAT 7231 131.042 0.722 67.387 1.00 0.00 H TER 78605 WAT 7231 ATOM 78605 O WAT 7232 13.720 130.547 93.834 1.00 0.00 O ATOM 78606 H1 WAT 7232 13.472 130.081 93.036 1.00 0.00 H ATOM 78607 H2 WAT 7232 14.658 130.384 93.926 1.00 0.00 H TER 78609 WAT 7232 ATOM 78609 O WAT 7233 125.178 73.236 95.730 1.00 0.00 O ATOM 78610 H1 WAT 7233 124.296 73.105 96.080 1.00 0.00 H ATOM 78611 H2 WAT 7233 125.446 72.369 95.425 1.00 0.00 H TER 78613 WAT 7233 ATOM 78613 O WAT 7234 4.528 70.024 116.427 1.00 0.00 O ATOM 78614 H1 WAT 7234 3.655 70.409 116.498 1.00 0.00 H ATOM 78615 H2 WAT 7234 4.573 69.399 117.150 1.00 0.00 H TER 78617 WAT 7234 ATOM 78617 O WAT 7235 46.196 120.523 63.899 1.00 0.00 O ATOM 78618 H1 WAT 7235 45.529 121.108 64.259 1.00 0.00 H ATOM 78619 H2 WAT 7235 45.749 119.682 63.802 1.00 0.00 H TER 78621 WAT 7235 ATOM 78621 O WAT 7236 88.508 113.838 140.887 1.00 0.00 O ATOM 78622 H1 WAT 7236 88.509 113.306 141.683 1.00 0.00 H ATOM 78623 H2 WAT 7236 89.265 114.415 140.985 1.00 0.00 H TER 78625 WAT 7236 ATOM 78625 O WAT 7237 12.697 68.600 87.420 1.00 0.00 O ATOM 78626 H1 WAT 7237 13.312 67.890 87.232 1.00 0.00 H ATOM 78627 H2 WAT 7237 12.766 68.732 88.366 1.00 0.00 H TER 78629 WAT 7237 ATOM 78629 O WAT 7238 58.613 4.428 137.903 1.00 0.00 O ATOM 78630 H1 WAT 7238 57.929 3.930 138.350 1.00 0.00 H ATOM 78631 H2 WAT 7238 58.622 4.076 137.013 1.00 0.00 H TER 78633 WAT 7238 ATOM 78633 O WAT 7239 136.335 93.900 101.767 1.00 0.00 O ATOM 78634 H1 WAT 7239 137.212 94.101 101.441 1.00 0.00 H ATOM 78635 H2 WAT 7239 136.176 92.998 101.488 1.00 0.00 H TER 78637 WAT 7239 ATOM 78637 O WAT 7240 84.915 15.777 115.680 1.00 0.00 O ATOM 78638 H1 WAT 7240 84.877 15.850 116.634 1.00 0.00 H ATOM 78639 H2 WAT 7240 85.563 16.430 115.415 1.00 0.00 H TER 78641 WAT 7240 ATOM 78641 O WAT 7241 123.924 26.452 15.050 1.00 0.00 O ATOM 78642 H1 WAT 7241 123.623 25.637 15.453 1.00 0.00 H ATOM 78643 H2 WAT 7241 124.563 26.804 15.671 1.00 0.00 H TER 78645 WAT 7241 ATOM 78645 O WAT 7242 118.203 126.406 123.113 1.00 0.00 O ATOM 78646 H1 WAT 7242 118.253 127.289 123.479 1.00 0.00 H ATOM 78647 H2 WAT 7242 118.730 125.871 123.705 1.00 0.00 H TER 78649 WAT 7242 ATOM 78649 O WAT 7243 48.927 145.260 128.493 1.00 0.00 O ATOM 78650 H1 WAT 7243 48.379 145.522 127.753 1.00 0.00 H ATOM 78651 H2 WAT 7243 48.400 144.616 128.965 1.00 0.00 H TER 78653 WAT 7243 ATOM 78653 O WAT 7244 117.632 10.163 107.188 1.00 0.00 O ATOM 78654 H1 WAT 7244 117.104 10.355 106.413 1.00 0.00 H ATOM 78655 H2 WAT 7244 117.062 10.381 107.925 1.00 0.00 H TER 78657 WAT 7244 ATOM 78657 O WAT 7245 60.620 53.057 107.541 1.00 0.00 O ATOM 78658 H1 WAT 7245 60.395 52.292 108.070 1.00 0.00 H ATOM 78659 H2 WAT 7245 61.378 53.439 107.982 1.00 0.00 H TER 78661 WAT 7245 ATOM 78661 O WAT 7246 93.832 139.418 73.849 1.00 0.00 O ATOM 78662 H1 WAT 7246 94.735 139.473 74.162 1.00 0.00 H ATOM 78663 H2 WAT 7246 93.819 138.639 73.292 1.00 0.00 H TER 78665 WAT 7246 ATOM 78665 O WAT 7247 25.229 144.572 151.367 1.00 0.00 O ATOM 78666 H1 WAT 7247 25.464 144.190 152.212 1.00 0.00 H ATOM 78667 H2 WAT 7247 24.654 143.921 150.962 1.00 0.00 H TER 78669 WAT 7247 ATOM 78669 O WAT 7248 6.850 142.340 18.466 1.00 0.00 O ATOM 78670 H1 WAT 7248 6.838 142.694 19.356 1.00 0.00 H ATOM 78671 H2 WAT 7248 6.296 142.937 17.964 1.00 0.00 H TER 78673 WAT 7248 ATOM 78673 O WAT 7249 31.911 75.179 135.187 1.00 0.00 O ATOM 78674 H1 WAT 7249 31.746 76.025 135.604 1.00 0.00 H ATOM 78675 H2 WAT 7249 31.609 74.534 135.826 1.00 0.00 H TER 78677 WAT 7249 ATOM 78677 O WAT 7250 90.207 130.197 72.509 1.00 0.00 O ATOM 78678 H1 WAT 7250 91.116 130.014 72.747 1.00 0.00 H ATOM 78679 H2 WAT 7250 89.767 129.349 72.575 1.00 0.00 H TER 78681 WAT 7250 ATOM 78681 O WAT 7251 62.495 118.221 130.974 1.00 0.00 O ATOM 78682 H1 WAT 7251 62.043 118.828 130.388 1.00 0.00 H ATOM 78683 H2 WAT 7251 61.905 118.125 131.722 1.00 0.00 H TER 78685 WAT 7251 ATOM 78685 O WAT 7252 118.754 46.212 130.617 1.00 0.00 O ATOM 78686 H1 WAT 7252 118.448 46.759 131.340 1.00 0.00 H ATOM 78687 H2 WAT 7252 118.297 46.553 129.848 1.00 0.00 H TER 78689 WAT 7252 ATOM 78689 O WAT 7253 6.008 99.243 118.433 1.00 0.00 O ATOM 78690 H1 WAT 7253 6.516 99.772 117.818 1.00 0.00 H ATOM 78691 H2 WAT 7253 5.464 98.685 117.876 1.00 0.00 H TER 78693 WAT 7253 ATOM 78693 O WAT 7254 8.383 19.634 119.120 1.00 0.00 O ATOM 78694 H1 WAT 7254 9.256 19.966 118.910 1.00 0.00 H ATOM 78695 H2 WAT 7254 7.811 20.034 118.465 1.00 0.00 H TER 78697 WAT 7254 ATOM 78697 O WAT 7255 34.261 61.525 112.672 1.00 0.00 O ATOM 78698 H1 WAT 7255 33.485 60.984 112.529 1.00 0.00 H ATOM 78699 H2 WAT 7255 34.067 62.016 113.471 1.00 0.00 H TER 78701 WAT 7255 ATOM 78701 O WAT 7256 28.972 109.710 105.045 1.00 0.00 O ATOM 78702 H1 WAT 7256 29.710 109.102 105.104 1.00 0.00 H ATOM 78703 H2 WAT 7256 28.549 109.492 104.215 1.00 0.00 H TER 78705 WAT 7256 ATOM 78705 O WAT 7257 139.480 2.072 9.963 1.00 0.00 O ATOM 78706 H1 WAT 7257 140.083 2.498 10.573 1.00 0.00 H ATOM 78707 H2 WAT 7257 139.764 2.371 9.099 1.00 0.00 H TER 78709 WAT 7257 ATOM 78709 O WAT 7258 135.684 39.778 135.920 1.00 0.00 O ATOM 78710 H1 WAT 7258 135.458 39.859 136.846 1.00 0.00 H ATOM 78711 H2 WAT 7258 136.640 39.740 135.909 1.00 0.00 H TER 78713 WAT 7258 ATOM 78713 O WAT 7259 117.745 63.787 144.763 1.00 0.00 O ATOM 78714 H1 WAT 7259 118.147 63.115 145.312 1.00 0.00 H ATOM 78715 H2 WAT 7259 117.182 64.280 145.360 1.00 0.00 H TER 78717 WAT 7259 ATOM 78717 O WAT 7260 135.120 47.902 12.045 1.00 0.00 O ATOM 78718 H1 WAT 7260 135.383 48.246 11.191 1.00 0.00 H ATOM 78719 H2 WAT 7260 134.322 48.384 12.263 1.00 0.00 H TER 78721 WAT 7260 ATOM 78721 O WAT 7261 1.738 32.257 19.864 1.00 0.00 O ATOM 78722 H1 WAT 7261 2.482 32.376 20.454 1.00 0.00 H ATOM 78723 H2 WAT 7261 1.347 33.127 19.793 1.00 0.00 H TER 78725 WAT 7261 ATOM 78725 O WAT 7262 141.608 101.279 5.263 1.00 0.00 O ATOM 78726 H1 WAT 7262 141.769 101.305 4.319 1.00 0.00 H ATOM 78727 H2 WAT 7262 141.521 100.347 5.465 1.00 0.00 H TER 78729 WAT 7262 ATOM 78729 O WAT 7263 82.196 139.973 129.401 1.00 0.00 O ATOM 78730 H1 WAT 7263 82.018 139.042 129.265 1.00 0.00 H ATOM 78731 H2 WAT 7263 81.360 140.404 129.225 1.00 0.00 H TER 78733 WAT 7263 ATOM 78733 O WAT 7264 26.566 1.052 58.254 1.00 0.00 O ATOM 78734 H1 WAT 7264 26.391 1.964 58.025 1.00 0.00 H ATOM 78735 H2 WAT 7264 27.084 0.716 57.523 1.00 0.00 H TER 78737 WAT 7264 ATOM 78737 O WAT 7265 135.849 14.240 119.240 1.00 0.00 O ATOM 78738 H1 WAT 7265 136.022 14.204 120.181 1.00 0.00 H ATOM 78739 H2 WAT 7265 136.220 13.426 118.897 1.00 0.00 H TER 78741 WAT 7265 ATOM 78741 O WAT 7266 140.464 21.977 118.827 1.00 0.00 O ATOM 78742 H1 WAT 7266 140.047 22.702 119.291 1.00 0.00 H ATOM 78743 H2 WAT 7266 140.936 22.393 118.105 1.00 0.00 H TER 78745 WAT 7266 ATOM 78745 O WAT 7267 130.472 7.315 135.026 1.00 0.00 O ATOM 78746 H1 WAT 7267 130.800 6.649 135.630 1.00 0.00 H ATOM 78747 H2 WAT 7267 129.527 7.167 134.995 1.00 0.00 H TER 78749 WAT 7267 ATOM 78749 O WAT 7268 35.801 113.768 78.520 1.00 0.00 O ATOM 78750 H1 WAT 7268 36.615 113.758 78.017 1.00 0.00 H ATOM 78751 H2 WAT 7268 35.111 113.691 77.861 1.00 0.00 H TER 78753 WAT 7268 ATOM 78753 O WAT 7269 136.206 129.265 136.732 1.00 0.00 O ATOM 78754 H1 WAT 7269 135.858 128.677 137.402 1.00 0.00 H ATOM 78755 H2 WAT 7269 135.440 129.740 136.410 1.00 0.00 H TER 78757 WAT 7269 ATOM 78757 O WAT 7270 13.424 69.258 56.605 1.00 0.00 O ATOM 78758 H1 WAT 7270 12.551 68.873 56.524 1.00 0.00 H ATOM 78759 H2 WAT 7270 13.952 68.569 57.008 1.00 0.00 H TER 78761 WAT 7270 ATOM 78761 O WAT 7271 81.270 19.727 128.704 1.00 0.00 O ATOM 78762 H1 WAT 7271 82.074 20.020 128.275 1.00 0.00 H ATOM 78763 H2 WAT 7271 80.895 19.086 128.099 1.00 0.00 H TER 78765 WAT 7271 ATOM 78765 O WAT 7272 7.042 141.390 114.681 1.00 0.00 O ATOM 78766 H1 WAT 7272 7.876 141.853 114.756 1.00 0.00 H ATOM 78767 H2 WAT 7272 7.152 140.609 115.223 1.00 0.00 H TER 78769 WAT 7272 ATOM 78769 O WAT 7273 132.321 38.809 133.861 1.00 0.00 O ATOM 78770 H1 WAT 7273 131.962 38.059 134.336 1.00 0.00 H ATOM 78771 H2 WAT 7273 132.350 39.511 134.511 1.00 0.00 H TER 78773 WAT 7273 ATOM 78773 O WAT 7274 142.346 4.366 118.225 1.00 0.00 O ATOM 78774 H1 WAT 7274 142.163 4.447 119.162 1.00 0.00 H ATOM 78775 H2 WAT 7274 143.258 4.642 118.135 1.00 0.00 H TER 78777 WAT 7274 ATOM 78777 O WAT 7275 123.967 119.937 156.390 1.00 0.00 O ATOM 78778 H1 WAT 7275 123.500 119.203 155.992 1.00 0.00 H ATOM 78779 H2 WAT 7275 123.309 120.629 156.463 1.00 0.00 H TER 78781 WAT 7275 ATOM 78781 O WAT 7276 23.683 0.544 54.094 1.00 0.00 O ATOM 78782 H1 WAT 7276 23.044 1.221 54.317 1.00 0.00 H ATOM 78783 H2 WAT 7276 24.526 0.997 54.104 1.00 0.00 H TER 78785 WAT 7276 ATOM 78785 O WAT 7277 15.693 114.738 107.368 1.00 0.00 O ATOM 78786 H1 WAT 7277 15.836 114.340 108.227 1.00 0.00 H ATOM 78787 H2 WAT 7277 16.087 115.608 107.439 1.00 0.00 H TER 78789 WAT 7277 ATOM 78789 O WAT 7278 68.619 24.815 79.085 1.00 0.00 O ATOM 78790 H1 WAT 7278 69.343 25.291 79.492 1.00 0.00 H ATOM 78791 H2 WAT 7278 68.680 23.931 79.448 1.00 0.00 H TER 78793 WAT 7278 ATOM 78793 O WAT 7279 121.991 10.036 143.627 1.00 0.00 O ATOM 78794 H1 WAT 7279 122.368 10.915 143.578 1.00 0.00 H ATOM 78795 H2 WAT 7279 122.400 9.643 144.399 1.00 0.00 H TER 78797 WAT 7279 ATOM 78797 O WAT 7280 77.870 85.773 69.208 1.00 0.00 O ATOM 78798 H1 WAT 7280 77.585 84.900 68.939 1.00 0.00 H ATOM 78799 H2 WAT 7280 78.124 86.204 68.392 1.00 0.00 H TER 78801 WAT 7280 ATOM 78801 O WAT 7281 23.284 67.728 116.126 1.00 0.00 O ATOM 78802 H1 WAT 7281 23.567 66.871 116.444 1.00 0.00 H ATOM 78803 H2 WAT 7281 23.044 68.210 116.918 1.00 0.00 H TER 78805 WAT 7281 ATOM 78805 O WAT 7282 14.924 52.061 92.636 1.00 0.00 O ATOM 78806 H1 WAT 7282 14.259 52.498 93.168 1.00 0.00 H ATOM 78807 H2 WAT 7282 15.740 52.512 92.855 1.00 0.00 H TER 78809 WAT 7282 ATOM 78809 O WAT 7283 122.341 108.354 67.467 1.00 0.00 O ATOM 78810 H1 WAT 7283 122.875 107.906 68.123 1.00 0.00 H ATOM 78811 H2 WAT 7283 121.786 108.947 67.974 1.00 0.00 H TER 78813 WAT 7283 ATOM 78813 O WAT 7284 118.860 90.490 85.353 1.00 0.00 O ATOM 78814 H1 WAT 7284 118.527 91.383 85.262 1.00 0.00 H ATOM 78815 H2 WAT 7284 118.131 90.001 85.737 1.00 0.00 H TER 78817 WAT 7284 ATOM 78817 O WAT 7285 95.727 82.957 139.341 1.00 0.00 O ATOM 78818 H1 WAT 7285 95.782 82.622 138.446 1.00 0.00 H ATOM 78819 H2 WAT 7285 94.997 83.576 139.320 1.00 0.00 H TER 78821 WAT 7285 ATOM 78821 O WAT 7286 91.427 29.056 6.302 1.00 0.00 O ATOM 78822 H1 WAT 7286 91.689 28.802 5.417 1.00 0.00 H ATOM 78823 H2 WAT 7286 90.672 28.500 6.497 1.00 0.00 H TER 78825 WAT 7286 ATOM 78825 O WAT 7287 4.990 114.662 82.603 1.00 0.00 O ATOM 78826 H1 WAT 7287 4.547 115.506 82.512 1.00 0.00 H ATOM 78827 H2 WAT 7287 5.370 114.684 83.481 1.00 0.00 H TER 78829 WAT 7287 ATOM 78829 O WAT 7288 7.231 95.539 10.611 1.00 0.00 O ATOM 78830 H1 WAT 7288 8.043 95.208 10.996 1.00 0.00 H ATOM 78831 H2 WAT 7288 6.546 95.258 11.218 1.00 0.00 H TER 78833 WAT 7288 ATOM 78833 O WAT 7289 144.052 103.855 78.485 1.00 0.00 O ATOM 78834 H1 WAT 7289 143.818 103.374 77.691 1.00 0.00 H ATOM 78835 H2 WAT 7289 144.962 104.116 78.347 1.00 0.00 H TER 78837 WAT 7289 ATOM 78837 O WAT 7290 94.763 58.682 137.989 1.00 0.00 O ATOM 78838 H1 WAT 7290 94.162 58.522 138.717 1.00 0.00 H ATOM 78839 H2 WAT 7290 95.629 58.481 138.345 1.00 0.00 H TER 78841 WAT 7290 ATOM 78841 O WAT 7291 65.268 102.620 145.735 1.00 0.00 O ATOM 78842 H1 WAT 7291 65.714 103.301 146.238 1.00 0.00 H ATOM 78843 H2 WAT 7291 65.536 101.801 146.151 1.00 0.00 H TER 78845 WAT 7291 ATOM 78845 O WAT 7292 126.485 104.879 2.212 1.00 0.00 O ATOM 78846 H1 WAT 7292 126.180 104.789 3.115 1.00 0.00 H ATOM 78847 H2 WAT 7292 125.706 104.718 1.679 1.00 0.00 H TER 78849 WAT 7292 ATOM 78849 O WAT 7293 85.121 71.834 142.146 1.00 0.00 O ATOM 78850 H1 WAT 7293 86.047 71.609 142.236 1.00 0.00 H ATOM 78851 H2 WAT 7293 84.877 72.190 143.001 1.00 0.00 H TER 78853 WAT 7293 ATOM 78853 O WAT 7294 37.233 107.128 0.384 1.00 0.00 O ATOM 78854 H1 WAT 7294 38.104 106.829 0.125 1.00 0.00 H ATOM 78855 H2 WAT 7294 36.677 106.354 0.289 1.00 0.00 H TER 78857 WAT 7294 ATOM 78857 O WAT 7295 55.601 64.769 158.681 1.00 0.00 O ATOM 78858 H1 WAT 7295 54.830 64.378 158.270 1.00 0.00 H ATOM 78859 H2 WAT 7295 56.342 64.399 158.202 1.00 0.00 H TER 78861 WAT 7295 ATOM 78861 O WAT 7296 121.365 101.367 130.976 1.00 0.00 O ATOM 78862 H1 WAT 7296 121.829 100.725 131.513 1.00 0.00 H ATOM 78863 H2 WAT 7296 120.479 101.387 131.339 1.00 0.00 H TER 78865 WAT 7296 ATOM 78865 O WAT 7297 62.540 83.656 60.596 1.00 0.00 O ATOM 78866 H1 WAT 7297 62.081 82.818 60.524 1.00 0.00 H ATOM 78867 H2 WAT 7297 62.880 83.666 61.491 1.00 0.00 H TER 78869 WAT 7297 ATOM 78869 O WAT 7298 77.055 72.146 142.855 1.00 0.00 O ATOM 78870 H1 WAT 7298 77.487 72.983 143.029 1.00 0.00 H ATOM 78871 H2 WAT 7298 77.621 71.714 142.215 1.00 0.00 H TER 78873 WAT 7298 ATOM 78873 O WAT 7299 130.625 43.930 93.934 1.00 0.00 O ATOM 78874 H1 WAT 7299 131.036 44.786 94.058 1.00 0.00 H ATOM 78875 H2 WAT 7299 129.712 44.130 93.729 1.00 0.00 H TER 78877 WAT 7299 ATOM 78877 O WAT 7300 64.941 144.072 129.836 1.00 0.00 O ATOM 78878 H1 WAT 7300 64.527 144.728 129.275 1.00 0.00 H ATOM 78879 H2 WAT 7300 65.880 144.186 129.685 1.00 0.00 H TER 78881 WAT 7300 ATOM 78881 O WAT 7301 71.930 99.723 26.197 1.00 0.00 O ATOM 78882 H1 WAT 7301 71.585 100.262 25.486 1.00 0.00 H ATOM 78883 H2 WAT 7301 71.188 99.185 26.472 1.00 0.00 H TER 78885 WAT 7301 ATOM 78885 O WAT 7302 130.940 106.188 7.215 1.00 0.00 O ATOM 78886 H1 WAT 7302 131.196 107.110 7.227 1.00 0.00 H ATOM 78887 H2 WAT 7302 130.484 106.078 6.380 1.00 0.00 H TER 78889 WAT 7302 ATOM 78889 O WAT 7303 129.340 31.029 154.108 1.00 0.00 O ATOM 78890 H1 WAT 7303 129.164 30.998 153.168 1.00 0.00 H ATOM 78891 H2 WAT 7303 128.580 30.606 154.508 1.00 0.00 H TER 78893 WAT 7303 ATOM 78893 O WAT 7304 49.835 141.498 114.249 1.00 0.00 O ATOM 78894 H1 WAT 7304 50.639 141.873 113.891 1.00 0.00 H ATOM 78895 H2 WAT 7304 49.500 142.172 114.841 1.00 0.00 H TER 78897 WAT 7304 ATOM 78897 O WAT 7305 27.708 4.369 122.935 1.00 0.00 O ATOM 78898 H1 WAT 7305 27.300 3.846 123.625 1.00 0.00 H ATOM 78899 H2 WAT 7305 27.311 5.235 123.024 1.00 0.00 H TER 78901 WAT 7305 ATOM 78901 O WAT 7306 55.002 96.503 1.891 1.00 0.00 O ATOM 78902 H1 WAT 7306 54.468 97.271 2.092 1.00 0.00 H ATOM 78903 H2 WAT 7306 54.816 96.315 0.971 1.00 0.00 H TER 78905 WAT 7306 ATOM 78905 O WAT 7307 75.084 50.322 133.250 1.00 0.00 O ATOM 78906 H1 WAT 7307 75.325 50.963 133.918 1.00 0.00 H ATOM 78907 H2 WAT 7307 75.755 50.416 132.574 1.00 0.00 H TER 78909 WAT 7307 ATOM 78909 O WAT 7308 0.669 127.817 7.251 1.00 0.00 O ATOM 78910 H1 WAT 7308 -0.108 127.610 6.732 1.00 0.00 H ATOM 78911 H2 WAT 7308 0.572 127.293 8.046 1.00 0.00 H TER 78913 WAT 7308 ATOM 78913 O WAT 7309 7.912 103.918 148.952 1.00 0.00 O ATOM 78914 H1 WAT 7309 8.397 103.408 149.600 1.00 0.00 H ATOM 78915 H2 WAT 7309 7.636 104.704 149.424 1.00 0.00 H TER 78917 WAT 7309 ATOM 78917 O WAT 7310 23.114 42.451 126.950 1.00 0.00 O ATOM 78918 H1 WAT 7310 24.071 42.428 126.943 1.00 0.00 H ATOM 78919 H2 WAT 7310 22.897 43.383 126.989 1.00 0.00 H TER 78921 WAT 7310 ATOM 78921 O WAT 7311 98.436 132.645 112.769 1.00 0.00 O ATOM 78922 H1 WAT 7311 97.543 132.507 113.084 1.00 0.00 H ATOM 78923 H2 WAT 7311 98.714 131.785 112.455 1.00 0.00 H TER 78925 WAT 7311 ATOM 78925 O WAT 7312 144.212 90.375 8.205 1.00 0.00 O ATOM 78926 H1 WAT 7312 144.754 89.740 7.738 1.00 0.00 H ATOM 78927 H2 WAT 7312 144.618 91.221 8.018 1.00 0.00 H TER 78929 WAT 7312 ATOM 78929 O WAT 7313 21.928 40.456 68.865 1.00 0.00 O ATOM 78930 H1 WAT 7313 21.420 41.242 69.067 1.00 0.00 H ATOM 78931 H2 WAT 7313 22.209 40.126 69.719 1.00 0.00 H TER 78933 WAT 7313 ATOM 78933 O WAT 7314 41.437 110.405 127.075 1.00 0.00 O ATOM 78934 H1 WAT 7314 41.233 109.470 127.073 1.00 0.00 H ATOM 78935 H2 WAT 7314 42.390 110.442 127.000 1.00 0.00 H TER 78937 WAT 7314 ATOM 78937 O WAT 7315 136.516 130.100 152.364 1.00 0.00 O ATOM 78938 H1 WAT 7315 135.850 130.513 151.815 1.00 0.00 H ATOM 78939 H2 WAT 7315 136.935 130.830 152.821 1.00 0.00 H TER 78941 WAT 7315 ATOM 78941 O WAT 7316 84.333 11.201 67.894 1.00 0.00 O ATOM 78942 H1 WAT 7316 84.076 11.723 68.654 1.00 0.00 H ATOM 78943 H2 WAT 7316 85.003 10.604 68.229 1.00 0.00 H TER 78945 WAT 7316 ATOM 78945 O WAT 7317 118.865 19.986 110.954 1.00 0.00 O ATOM 78946 H1 WAT 7317 117.935 19.760 110.947 1.00 0.00 H ATOM 78947 H2 WAT 7317 119.060 20.224 110.047 1.00 0.00 H TER 78949 WAT 7317 ATOM 78949 O WAT 7318 143.885 112.624 112.955 1.00 0.00 O ATOM 78950 H1 WAT 7318 144.286 112.273 113.751 1.00 0.00 H ATOM 78951 H2 WAT 7318 143.257 113.273 113.270 1.00 0.00 H TER 78953 WAT 7318 ATOM 78953 O WAT 7319 51.504 142.195 98.667 1.00 0.00 O ATOM 78954 H1 WAT 7319 52.213 142.637 99.136 1.00 0.00 H ATOM 78955 H2 WAT 7319 50.705 142.513 99.087 1.00 0.00 H TER 78957 WAT 7319 ATOM 78957 O WAT 7320 26.760 5.432 145.660 1.00 0.00 O ATOM 78958 H1 WAT 7320 27.659 5.109 145.607 1.00 0.00 H ATOM 78959 H2 WAT 7320 26.388 5.247 144.798 1.00 0.00 H TER 78961 WAT 7320 ATOM 78961 O WAT 7321 3.106 11.057 110.786 1.00 0.00 O ATOM 78962 H1 WAT 7321 2.160 10.942 110.874 1.00 0.00 H ATOM 78963 H2 WAT 7321 3.476 10.584 111.532 1.00 0.00 H TER 78965 WAT 7321 ATOM 78965 O WAT 7322 118.625 9.617 124.646 1.00 0.00 O ATOM 78966 H1 WAT 7322 119.050 8.772 124.505 1.00 0.00 H ATOM 78967 H2 WAT 7322 119.348 10.238 124.730 1.00 0.00 H TER 78969 WAT 7322 ATOM 78969 O WAT 7323 136.853 36.403 3.123 1.00 0.00 O ATOM 78970 H1 WAT 7323 135.946 36.709 3.095 1.00 0.00 H ATOM 78971 H2 WAT 7323 137.244 36.739 2.317 1.00 0.00 H TER 78973 WAT 7323 ATOM 78973 O WAT 7324 135.316 93.803 125.228 1.00 0.00 O ATOM 78974 H1 WAT 7324 136.228 93.694 125.495 1.00 0.00 H ATOM 78975 H2 WAT 7324 134.842 93.125 125.709 1.00 0.00 H TER 78977 WAT 7324 ATOM 78977 O WAT 7325 52.293 56.452 110.782 1.00 0.00 O ATOM 78978 H1 WAT 7325 52.070 56.402 109.852 1.00 0.00 H ATOM 78979 H2 WAT 7325 52.784 57.269 110.867 1.00 0.00 H TER 78981 WAT 7325 ATOM 78981 O WAT 7326 8.091 15.051 104.221 1.00 0.00 O ATOM 78982 H1 WAT 7326 8.184 16.004 104.224 1.00 0.00 H ATOM 78983 H2 WAT 7326 7.420 14.878 103.560 1.00 0.00 H TER 78985 WAT 7326 ATOM 78985 O WAT 7327 34.058 18.388 106.982 1.00 0.00 O ATOM 78986 H1 WAT 7327 33.932 17.586 106.476 1.00 0.00 H ATOM 78987 H2 WAT 7327 33.626 19.068 106.465 1.00 0.00 H TER 78989 WAT 7327 ATOM 78989 O WAT 7328 117.323 89.789 145.170 1.00 0.00 O ATOM 78990 H1 WAT 7328 117.158 89.379 144.321 1.00 0.00 H ATOM 78991 H2 WAT 7328 118.068 89.307 145.528 1.00 0.00 H TER 78993 WAT 7328 ATOM 78993 O WAT 7329 125.515 119.899 131.941 1.00 0.00 O ATOM 78994 H1 WAT 7329 125.093 120.554 132.497 1.00 0.00 H ATOM 78995 H2 WAT 7329 126.448 120.111 131.988 1.00 0.00 H TER 78997 WAT 7329 ATOM 78997 O WAT 7330 126.347 24.162 133.367 1.00 0.00 O ATOM 78998 H1 WAT 7330 127.286 24.295 133.237 1.00 0.00 H ATOM 78999 H2 WAT 7330 126.081 24.879 133.943 1.00 0.00 H TER 79001 WAT 7330 ATOM 79001 O WAT 7331 90.118 119.073 129.226 1.00 0.00 O ATOM 79002 H1 WAT 7331 90.275 119.375 130.120 1.00 0.00 H ATOM 79003 H2 WAT 7331 89.974 119.876 128.725 1.00 0.00 H TER 79005 WAT 7331 ATOM 79005 O WAT 7332 47.629 3.722 89.832 1.00 0.00 O ATOM 79006 H1 WAT 7332 47.919 2.810 89.818 1.00 0.00 H ATOM 79007 H2 WAT 7332 46.673 3.669 89.838 1.00 0.00 H TER 79009 WAT 7332 ATOM 79009 O WAT 7333 136.321 121.482 12.249 1.00 0.00 O ATOM 79010 H1 WAT 7333 136.067 120.854 12.925 1.00 0.00 H ATOM 79011 H2 WAT 7333 137.272 121.390 12.181 1.00 0.00 H TER 79013 WAT 7333 ATOM 79013 O WAT 7334 127.209 123.168 96.091 1.00 0.00 O ATOM 79014 H1 WAT 7334 127.994 123.690 95.924 1.00 0.00 H ATOM 79015 H2 WAT 7334 127.529 122.269 96.160 1.00 0.00 H TER 79017 WAT 7334 ATOM 79017 O WAT 7335 36.266 37.538 3.636 1.00 0.00 O ATOM 79018 H1 WAT 7335 35.890 38.273 3.151 1.00 0.00 H ATOM 79019 H2 WAT 7335 35.951 36.760 3.175 1.00 0.00 H TER 79021 WAT 7335 ATOM 79021 O WAT 7336 45.359 124.502 132.522 1.00 0.00 O ATOM 79022 H1 WAT 7336 45.756 124.714 131.677 1.00 0.00 H ATOM 79023 H2 WAT 7336 44.417 124.579 132.370 1.00 0.00 H TER 79025 WAT 7336 ATOM 79025 O WAT 7337 70.042 143.208 11.680 1.00 0.00 O ATOM 79026 H1 WAT 7337 70.548 142.764 10.999 1.00 0.00 H ATOM 79027 H2 WAT 7337 70.140 142.652 12.453 1.00 0.00 H TER 79029 WAT 7337 ATOM 79029 O WAT 7338 134.811 115.483 116.394 1.00 0.00 O ATOM 79030 H1 WAT 7338 134.699 116.089 117.126 1.00 0.00 H ATOM 79031 H2 WAT 7338 134.255 114.735 116.615 1.00 0.00 H TER 79033 WAT 7338 ATOM 79033 O WAT 7339 128.046 112.591 62.255 1.00 0.00 O ATOM 79034 H1 WAT 7339 127.955 112.545 63.207 1.00 0.00 H ATOM 79035 H2 WAT 7339 127.993 113.525 62.054 1.00 0.00 H TER 79037 WAT 7339 ATOM 79037 O WAT 7340 55.894 115.600 15.635 1.00 0.00 O ATOM 79038 H1 WAT 7340 55.951 114.889 16.273 1.00 0.00 H ATOM 79039 H2 WAT 7340 56.215 116.370 16.104 1.00 0.00 H TER 79041 WAT 7340 ATOM 79041 O WAT 7341 118.917 62.686 66.983 1.00 0.00 O ATOM 79042 H1 WAT 7341 119.703 63.210 67.139 1.00 0.00 H ATOM 79043 H2 WAT 7341 118.851 62.631 66.029 1.00 0.00 H TER 79045 WAT 7341 ATOM 79045 O WAT 7342 142.686 132.494 153.524 1.00 0.00 O ATOM 79046 H1 WAT 7342 141.835 132.246 153.887 1.00 0.00 H ATOM 79047 H2 WAT 7342 143.314 131.935 153.981 1.00 0.00 H TER 79049 WAT 7342 ATOM 79049 O WAT 7343 1.819 117.666 72.339 1.00 0.00 O ATOM 79050 H1 WAT 7343 2.304 116.861 72.159 1.00 0.00 H ATOM 79051 H2 WAT 7343 0.920 117.468 72.075 1.00 0.00 H TER 79053 WAT 7343 ATOM 79053 O WAT 7344 87.976 12.035 156.713 1.00 0.00 O ATOM 79054 H1 WAT 7344 87.295 11.363 156.679 1.00 0.00 H ATOM 79055 H2 WAT 7344 87.518 12.851 156.511 1.00 0.00 H TER 79057 WAT 7344 ATOM 79057 O WAT 7345 51.630 144.667 115.708 1.00 0.00 O ATOM 79058 H1 WAT 7345 52.584 144.738 115.674 1.00 0.00 H ATOM 79059 H2 WAT 7345 51.394 145.019 116.566 1.00 0.00 H TER 79061 WAT 7345 ATOM 79061 O WAT 7346 104.891 116.760 116.218 1.00 0.00 O ATOM 79062 H1 WAT 7346 104.660 117.685 116.136 1.00 0.00 H ATOM 79063 H2 WAT 7346 105.848 116.754 116.251 1.00 0.00 H TER 79065 WAT 7346 ATOM 79065 O WAT 7347 60.232 115.293 78.007 1.00 0.00 O ATOM 79066 H1 WAT 7347 60.157 114.754 78.794 1.00 0.00 H ATOM 79067 H2 WAT 7347 60.387 116.178 78.337 1.00 0.00 H TER 79069 WAT 7347 ATOM 79069 O WAT 7348 59.340 115.070 151.487 1.00 0.00 O ATOM 79070 H1 WAT 7348 59.115 114.237 151.900 1.00 0.00 H ATOM 79071 H2 WAT 7348 59.112 114.950 150.565 1.00 0.00 H TER 79073 WAT 7348 ATOM 79073 O WAT 7349 124.444 55.495 112.839 1.00 0.00 O ATOM 79074 H1 WAT 7349 123.970 55.744 112.045 1.00 0.00 H ATOM 79075 H2 WAT 7349 125.294 55.187 112.523 1.00 0.00 H TER 79077 WAT 7349 ATOM 79077 O WAT 7350 40.867 53.858 119.934 1.00 0.00 O ATOM 79078 H1 WAT 7350 41.654 53.619 119.445 1.00 0.00 H ATOM 79079 H2 WAT 7350 40.526 53.026 120.261 1.00 0.00 H TER 79081 WAT 7350 ATOM 79081 O WAT 7351 67.902 22.088 117.568 1.00 0.00 O ATOM 79082 H1 WAT 7351 68.633 22.666 117.347 1.00 0.00 H ATOM 79083 H2 WAT 7351 68.038 21.312 117.024 1.00 0.00 H TER 79085 WAT 7351 ATOM 79085 O WAT 7352 94.397 130.405 12.952 1.00 0.00 O ATOM 79086 H1 WAT 7352 93.581 130.624 13.400 1.00 0.00 H ATOM 79087 H2 WAT 7352 94.139 129.778 12.277 1.00 0.00 H TER 79089 WAT 7352 ATOM 79089 O WAT 7353 85.494 117.396 124.163 1.00 0.00 O ATOM 79090 H1 WAT 7353 85.725 118.208 124.615 1.00 0.00 H ATOM 79091 H2 WAT 7353 84.738 117.630 123.624 1.00 0.00 H TER 79093 WAT 7353 ATOM 79093 O WAT 7354 52.057 126.958 100.338 1.00 0.00 O ATOM 79094 H1 WAT 7354 52.063 127.882 100.590 1.00 0.00 H ATOM 79095 H2 WAT 7354 51.272 126.601 100.753 1.00 0.00 H TER 79097 WAT 7354 ATOM 79097 O WAT 7355 69.348 81.990 67.714 1.00 0.00 O ATOM 79098 H1 WAT 7355 69.957 82.050 66.978 1.00 0.00 H ATOM 79099 H2 WAT 7355 68.681 81.369 67.422 1.00 0.00 H TER 79101 WAT 7355 ATOM 79101 O WAT 7356 31.006 109.287 11.019 1.00 0.00 O ATOM 79102 H1 WAT 7356 31.868 109.675 11.168 1.00 0.00 H ATOM 79103 H2 WAT 7356 30.507 109.501 11.808 1.00 0.00 H TER 79105 WAT 7356 ATOM 79105 O WAT 7357 28.196 107.311 146.391 1.00 0.00 O ATOM 79106 H1 WAT 7357 27.717 107.948 146.921 1.00 0.00 H ATOM 79107 H2 WAT 7357 28.593 107.831 145.692 1.00 0.00 H TER 79109 WAT 7357 ATOM 79109 O WAT 7358 13.109 39.889 78.326 1.00 0.00 O ATOM 79110 H1 WAT 7358 13.675 39.609 79.045 1.00 0.00 H ATOM 79111 H2 WAT 7358 12.315 40.208 78.756 1.00 0.00 H TER 79113 WAT 7358 ATOM 79113 O WAT 7359 25.145 99.125 123.781 1.00 0.00 O ATOM 79114 H1 WAT 7359 24.827 100.027 123.823 1.00 0.00 H ATOM 79115 H2 WAT 7359 26.099 99.207 123.783 1.00 0.00 H TER 79117 WAT 7359 ATOM 79117 O WAT 7360 138.896 141.506 90.332 1.00 0.00 O ATOM 79118 H1 WAT 7360 138.536 141.925 91.114 1.00 0.00 H ATOM 79119 H2 WAT 7360 139.057 142.229 89.726 1.00 0.00 H TER 79121 WAT 7360 ATOM 79121 O WAT 7361 25.630 36.657 127.754 1.00 0.00 O ATOM 79122 H1 WAT 7361 26.549 36.614 127.489 1.00 0.00 H ATOM 79123 H2 WAT 7361 25.561 36.037 128.479 1.00 0.00 H TER 79125 WAT 7361 ATOM 79125 O WAT 7362 19.449 40.578 21.935 1.00 0.00 O ATOM 79126 H1 WAT 7362 19.621 41.233 22.612 1.00 0.00 H ATOM 79127 H2 WAT 7362 20.159 39.944 22.031 1.00 0.00 H TER 79129 WAT 7362 ATOM 79129 O WAT 7363 6.005 44.656 68.991 1.00 0.00 O ATOM 79130 H1 WAT 7363 6.710 44.072 68.712 1.00 0.00 H ATOM 79131 H2 WAT 7363 5.755 44.332 69.856 1.00 0.00 H TER 79133 WAT 7363 ATOM 79133 O WAT 7364 34.566 67.512 151.469 1.00 0.00 O ATOM 79134 H1 WAT 7364 34.842 66.986 152.219 1.00 0.00 H ATOM 79135 H2 WAT 7364 33.686 67.813 151.698 1.00 0.00 H TER 79137 WAT 7364 ATOM 79137 O WAT 7365 111.575 112.986 8.077 1.00 0.00 O ATOM 79138 H1 WAT 7365 111.514 113.364 7.199 1.00 0.00 H ATOM 79139 H2 WAT 7365 112.487 112.705 8.153 1.00 0.00 H TER 79141 WAT 7365 ATOM 79141 O WAT 7366 115.347 13.670 2.981 1.00 0.00 O ATOM 79142 H1 WAT 7366 115.063 13.598 3.893 1.00 0.00 H ATOM 79143 H2 WAT 7366 116.150 14.189 3.020 1.00 0.00 H TER 79145 WAT 7366 ATOM 79145 O WAT 7367 91.423 58.589 90.799 1.00 0.00 O ATOM 79146 H1 WAT 7367 91.163 58.695 91.714 1.00 0.00 H ATOM 79147 H2 WAT 7367 90.805 59.132 90.310 1.00 0.00 H TER 79149 WAT 7367 ATOM 79149 O WAT 7368 61.751 140.426 143.471 1.00 0.00 O ATOM 79150 H1 WAT 7368 61.116 139.766 143.192 1.00 0.00 H ATOM 79151 H2 WAT 7368 62.590 140.106 143.139 1.00 0.00 H TER 79153 WAT 7368 ATOM 79153 O WAT 7369 131.112 126.520 18.336 1.00 0.00 O ATOM 79154 H1 WAT 7369 131.912 126.106 18.659 1.00 0.00 H ATOM 79155 H2 WAT 7369 130.689 126.869 19.121 1.00 0.00 H TER 79157 WAT 7369 ATOM 79157 O WAT 7370 3.459 122.653 6.903 1.00 0.00 O ATOM 79158 H1 WAT 7370 3.267 121.981 6.249 1.00 0.00 H ATOM 79159 H2 WAT 7370 2.599 122.945 7.205 1.00 0.00 H TER 79161 WAT 7370 ATOM 79161 O WAT 7371 64.531 114.478 158.223 1.00 0.00 O ATOM 79162 H1 WAT 7371 63.789 115.055 158.042 1.00 0.00 H ATOM 79163 H2 WAT 7371 64.290 114.023 159.029 1.00 0.00 H TER 79165 WAT 7371 ATOM 79165 O WAT 7372 145.321 117.975 71.061 1.00 0.00 O ATOM 79166 H1 WAT 7372 144.479 117.606 70.794 1.00 0.00 H ATOM 79167 H2 WAT 7372 145.764 118.180 70.238 1.00 0.00 H TER 79169 WAT 7372 ATOM 79169 O WAT 7373 71.484 42.900 142.346 1.00 0.00 O ATOM 79170 H1 WAT 7373 72.026 43.675 142.201 1.00 0.00 H ATOM 79171 H2 WAT 7373 70.859 42.906 141.621 1.00 0.00 H TER 79173 WAT 7373 ATOM 79173 O WAT 7374 122.485 102.138 137.544 1.00 0.00 O ATOM 79174 H1 WAT 7374 123.343 102.087 137.122 1.00 0.00 H ATOM 79175 H2 WAT 7374 122.175 101.233 137.566 1.00 0.00 H TER 79177 WAT 7374 ATOM 79177 O WAT 7375 74.672 85.011 19.802 1.00 0.00 O ATOM 79178 H1 WAT 7375 74.810 85.671 20.482 1.00 0.00 H ATOM 79179 H2 WAT 7375 74.166 85.465 19.127 1.00 0.00 H TER 79181 WAT 7375 ATOM 79181 O WAT 7376 113.215 116.803 93.294 1.00 0.00 O ATOM 79182 H1 WAT 7376 113.504 116.037 93.790 1.00 0.00 H ATOM 79183 H2 WAT 7376 113.603 117.547 93.755 1.00 0.00 H TER 79185 WAT 7376 ATOM 79185 O WAT 7377 109.542 114.957 12.104 1.00 0.00 O ATOM 79186 H1 WAT 7377 109.664 114.124 12.559 1.00 0.00 H ATOM 79187 H2 WAT 7377 109.842 114.788 11.211 1.00 0.00 H TER 79189 WAT 7377 ATOM 79189 O WAT 7378 47.426 138.398 114.498 1.00 0.00 O ATOM 79190 H1 WAT 7378 48.279 138.503 114.920 1.00 0.00 H ATOM 79191 H2 WAT 7378 47.321 139.188 113.969 1.00 0.00 H TER 79193 WAT 7378 ATOM 79193 O WAT 7379 5.636 116.255 130.621 1.00 0.00 O ATOM 79194 H1 WAT 7379 4.755 116.623 130.546 1.00 0.00 H ATOM 79195 H2 WAT 7379 5.495 115.353 130.908 1.00 0.00 H TER 79197 WAT 7379 ATOM 79197 O WAT 7380 54.097 104.143 94.958 1.00 0.00 O ATOM 79198 H1 WAT 7380 54.092 104.284 95.904 1.00 0.00 H ATOM 79199 H2 WAT 7380 53.722 104.944 94.594 1.00 0.00 H TER 79201 WAT 7380 ATOM 79201 O WAT 7381 104.468 21.135 132.249 1.00 0.00 O ATOM 79202 H1 WAT 7381 104.126 22.027 132.309 1.00 0.00 H ATOM 79203 H2 WAT 7381 105.290 21.160 132.739 1.00 0.00 H TER 79205 WAT 7381 ATOM 79205 O WAT 7382 112.569 100.564 87.225 1.00 0.00 O ATOM 79206 H1 WAT 7382 112.872 100.028 87.959 1.00 0.00 H ATOM 79207 H2 WAT 7382 113.354 101.020 86.922 1.00 0.00 H TER 79209 WAT 7382 ATOM 79209 O WAT 7383 122.731 100.241 133.232 1.00 0.00 O ATOM 79210 H1 WAT 7383 122.960 99.422 132.792 1.00 0.00 H ATOM 79211 H2 WAT 7383 123.573 100.622 133.481 1.00 0.00 H TER 79213 WAT 7383 ATOM 79213 O WAT 7384 62.573 51.288 137.868 1.00 0.00 O ATOM 79214 H1 WAT 7384 63.138 51.851 137.339 1.00 0.00 H ATOM 79215 H2 WAT 7384 62.323 50.577 137.278 1.00 0.00 H TER 79217 WAT 7384 ATOM 79217 O WAT 7385 37.495 129.310 146.077 1.00 0.00 O ATOM 79218 H1 WAT 7385 37.787 129.070 145.198 1.00 0.00 H ATOM 79219 H2 WAT 7385 37.694 130.243 146.149 1.00 0.00 H TER 79221 WAT 7385 ATOM 79221 O WAT 7386 128.773 48.392 76.810 1.00 0.00 O ATOM 79222 H1 WAT 7386 128.184 47.742 76.426 1.00 0.00 H ATOM 79223 H2 WAT 7386 129.554 48.365 76.256 1.00 0.00 H TER 79225 WAT 7386 ATOM 79225 O WAT 7387 74.659 129.789 18.025 1.00 0.00 O ATOM 79226 H1 WAT 7387 73.826 130.218 18.221 1.00 0.00 H ATOM 79227 H2 WAT 7387 75.271 130.151 18.665 1.00 0.00 H TER 79229 WAT 7387 ATOM 79229 O WAT 7388 82.197 0.929 63.584 1.00 0.00 O ATOM 79230 H1 WAT 7388 82.914 1.348 63.108 1.00 0.00 H ATOM 79231 H2 WAT 7388 82.596 0.161 63.992 1.00 0.00 H TER 79233 WAT 7388 ATOM 79233 O WAT 7389 143.022 79.395 15.210 1.00 0.00 O ATOM 79234 H1 WAT 7389 143.574 80.128 15.482 1.00 0.00 H ATOM 79235 H2 WAT 7389 143.013 78.808 15.966 1.00 0.00 H TER 79237 WAT 7389 ATOM 79237 O WAT 7390 31.548 115.813 83.352 1.00 0.00 O ATOM 79238 H1 WAT 7390 32.166 115.597 82.654 1.00 0.00 H ATOM 79239 H2 WAT 7390 30.697 115.852 82.915 1.00 0.00 H TER 79241 WAT 7390 ATOM 79241 O WAT 7391 47.791 5.600 56.654 1.00 0.00 O ATOM 79242 H1 WAT 7391 47.323 6.430 56.563 1.00 0.00 H ATOM 79243 H2 WAT 7391 47.817 5.241 55.767 1.00 0.00 H TER 79245 WAT 7391 ATOM 79245 O WAT 7392 140.879 106.174 112.527 1.00 0.00 O ATOM 79246 H1 WAT 7392 141.123 106.826 111.871 1.00 0.00 H ATOM 79247 H2 WAT 7392 140.900 106.650 113.358 1.00 0.00 H TER 79249 WAT 7392 ATOM 79249 O WAT 7393 142.060 91.225 97.078 1.00 0.00 O ATOM 79250 H1 WAT 7393 141.740 91.089 97.970 1.00 0.00 H ATOM 79251 H2 WAT 7393 141.383 90.844 96.519 1.00 0.00 H TER 79253 WAT 7393 ATOM 79253 O WAT 7394 72.723 99.244 108.468 1.00 0.00 O ATOM 79254 H1 WAT 7394 73.292 99.943 108.791 1.00 0.00 H ATOM 79255 H2 WAT 7394 72.912 99.194 107.531 1.00 0.00 H TER 79257 WAT 7394 ATOM 79257 O WAT 7395 97.839 48.349 138.885 1.00 0.00 O ATOM 79258 H1 WAT 7395 97.764 48.933 139.639 1.00 0.00 H ATOM 79259 H2 WAT 7395 97.036 47.827 138.905 1.00 0.00 H TER 79261 WAT 7395 ATOM 79261 O WAT 7396 1.988 138.335 98.163 1.00 0.00 O ATOM 79262 H1 WAT 7396 1.083 138.060 98.017 1.00 0.00 H ATOM 79263 H2 WAT 7396 2.372 138.370 97.287 1.00 0.00 H TER 79265 WAT 7396 ATOM 79265 O WAT 7397 58.108 116.699 13.483 1.00 0.00 O ATOM 79266 H1 WAT 7397 57.301 116.954 13.930 1.00 0.00 H ATOM 79267 H2 WAT 7397 58.626 117.504 13.447 1.00 0.00 H TER 79269 WAT 7397 ATOM 79269 O WAT 7398 21.800 136.764 146.666 1.00 0.00 O ATOM 79270 H1 WAT 7398 22.123 135.911 146.375 1.00 0.00 H ATOM 79271 H2 WAT 7398 22.584 137.229 146.961 1.00 0.00 H TER 79273 WAT 7398 ATOM 79273 O WAT 7399 137.059 80.683 88.266 1.00 0.00 O ATOM 79274 H1 WAT 7399 136.762 81.362 87.659 1.00 0.00 H ATOM 79275 H2 WAT 7399 136.283 80.145 88.420 1.00 0.00 H TER 79277 WAT 7399 ATOM 79277 O WAT 7400 109.682 141.714 116.320 1.00 0.00 O ATOM 79278 H1 WAT 7400 109.564 141.805 117.265 1.00 0.00 H ATOM 79279 H2 WAT 7400 108.792 141.666 115.971 1.00 0.00 H TER 79281 WAT 7400 ATOM 79281 O WAT 7401 109.917 56.031 90.544 1.00 0.00 O ATOM 79282 H1 WAT 7401 109.555 55.223 90.181 1.00 0.00 H ATOM 79283 H2 WAT 7401 109.890 56.653 89.817 1.00 0.00 H TER 79285 WAT 7401 ATOM 79285 O WAT 7402 120.552 6.746 118.330 1.00 0.00 O ATOM 79286 H1 WAT 7402 119.624 6.752 118.095 1.00 0.00 H ATOM 79287 H2 WAT 7402 120.872 5.899 118.020 1.00 0.00 H TER 79289 WAT 7402 ATOM 79289 O WAT 7403 7.459 114.229 120.077 1.00 0.00 O ATOM 79290 H1 WAT 7403 6.742 113.618 120.245 1.00 0.00 H ATOM 79291 H2 WAT 7403 8.172 113.922 120.638 1.00 0.00 H TER 79293 WAT 7403 ATOM 79293 O WAT 7404 90.407 88.694 8.647 1.00 0.00 O ATOM 79294 H1 WAT 7404 89.927 88.917 9.445 1.00 0.00 H ATOM 79295 H2 WAT 7404 90.935 89.471 8.461 1.00 0.00 H TER 79297 WAT 7404 ATOM 79297 O WAT 7405 47.379 124.924 147.830 1.00 0.00 O ATOM 79298 H1 WAT 7405 47.302 124.754 148.769 1.00 0.00 H ATOM 79299 H2 WAT 7405 48.235 124.569 147.591 1.00 0.00 H TER 79301 WAT 7405 ATOM 79301 O WAT 7406 36.286 113.994 56.716 1.00 0.00 O ATOM 79302 H1 WAT 7406 35.881 113.329 57.273 1.00 0.00 H ATOM 79303 H2 WAT 7406 37.209 113.990 56.971 1.00 0.00 H TER 79305 WAT 7406 ATOM 79305 O WAT 7407 101.462 59.196 128.114 1.00 0.00 O ATOM 79306 H1 WAT 7407 102.196 59.806 128.050 1.00 0.00 H ATOM 79307 H2 WAT 7407 101.870 58.332 128.146 1.00 0.00 H TER 79309 WAT 7407 ATOM 79309 O WAT 7408 91.709 118.002 69.365 1.00 0.00 O ATOM 79310 H1 WAT 7408 92.250 118.783 69.484 1.00 0.00 H ATOM 79311 H2 WAT 7408 91.335 117.837 70.231 1.00 0.00 H TER 79313 WAT 7408 ATOM 79313 O WAT 7409 27.989 41.940 119.195 1.00 0.00 O ATOM 79314 H1 WAT 7409 27.045 41.788 119.246 1.00 0.00 H ATOM 79315 H2 WAT 7409 28.071 42.811 118.808 1.00 0.00 H TER 79317 WAT 7409 ATOM 79317 O WAT 7410 57.714 134.911 55.445 1.00 0.00 O ATOM 79318 H1 WAT 7410 57.422 134.918 54.534 1.00 0.00 H ATOM 79319 H2 WAT 7410 58.454 134.304 55.455 1.00 0.00 H TER 79321 WAT 7410 ATOM 79321 O WAT 7411 17.390 133.467 134.789 1.00 0.00 O ATOM 79322 H1 WAT 7411 18.257 133.529 135.190 1.00 0.00 H ATOM 79323 H2 WAT 7411 16.849 134.075 135.292 1.00 0.00 H TER 79325 WAT 7411 ATOM 79325 O WAT 7412 118.561 51.732 108.855 1.00 0.00 O ATOM 79326 H1 WAT 7412 117.884 51.173 108.473 1.00 0.00 H ATOM 79327 H2 WAT 7412 118.689 52.427 108.211 1.00 0.00 H TER 79329 WAT 7412 ATOM 79329 O WAT 7413 85.966 127.802 73.326 1.00 0.00 O ATOM 79330 H1 WAT 7413 86.766 127.884 73.845 1.00 0.00 H ATOM 79331 H2 WAT 7413 85.794 128.688 73.009 1.00 0.00 H TER 79333 WAT 7413 ATOM 79333 O WAT 7414 80.849 52.715 114.800 1.00 0.00 O ATOM 79334 H1 WAT 7414 80.070 52.515 114.282 1.00 0.00 H ATOM 79335 H2 WAT 7414 81.553 52.230 114.371 1.00 0.00 H TER 79337 WAT 7414 ATOM 79337 O WAT 7415 138.494 60.122 53.531 1.00 0.00 O ATOM 79338 H1 WAT 7415 137.802 60.754 53.727 1.00 0.00 H ATOM 79339 H2 WAT 7415 139.301 60.559 53.804 1.00 0.00 H TER 79341 WAT 7415 ATOM 79341 O WAT 7416 101.424 87.155 115.937 1.00 0.00 O ATOM 79342 H1 WAT 7416 102.170 87.741 115.812 1.00 0.00 H ATOM 79343 H2 WAT 7416 101.744 86.484 116.540 1.00 0.00 H TER 79345 WAT 7416 ATOM 79345 O WAT 7417 71.950 6.664 8.210 1.00 0.00 O ATOM 79346 H1 WAT 7417 71.216 6.252 8.665 1.00 0.00 H ATOM 79347 H2 WAT 7417 72.136 6.078 7.476 1.00 0.00 H TER 79349 WAT 7417 ATOM 79349 O WAT 7418 19.816 104.521 136.369 1.00 0.00 O ATOM 79350 H1 WAT 7418 20.127 103.815 135.802 1.00 0.00 H ATOM 79351 H2 WAT 7418 20.046 104.236 137.254 1.00 0.00 H TER 79353 WAT 7418 ATOM 79353 O WAT 7419 95.056 21.046 121.302 1.00 0.00 O ATOM 79354 H1 WAT 7419 94.477 20.979 120.543 1.00 0.00 H ATOM 79355 H2 WAT 7419 95.344 21.958 121.304 1.00 0.00 H TER 79357 WAT 7419 ATOM 79357 O WAT 7420 110.537 120.093 121.554 1.00 0.00 O ATOM 79358 H1 WAT 7420 111.160 119.620 121.003 1.00 0.00 H ATOM 79359 H2 WAT 7420 111.063 120.764 121.989 1.00 0.00 H TER 79361 WAT 7420 ATOM 79361 O WAT 7421 1.931 38.416 17.265 1.00 0.00 O ATOM 79362 H1 WAT 7421 2.591 38.446 16.572 1.00 0.00 H ATOM 79363 H2 WAT 7421 2.354 37.936 17.978 1.00 0.00 H TER 79365 WAT 7421 ATOM 79365 O WAT 7422 121.883 105.488 91.444 1.00 0.00 O ATOM 79366 H1 WAT 7422 121.517 104.999 92.181 1.00 0.00 H ATOM 79367 H2 WAT 7422 121.333 106.268 91.377 1.00 0.00 H TER 79369 WAT 7422 ATOM 79369 O WAT 7423 33.436 129.464 100.706 1.00 0.00 O ATOM 79370 H1 WAT 7423 33.256 129.497 101.646 1.00 0.00 H ATOM 79371 H2 WAT 7423 33.836 130.310 100.508 1.00 0.00 H TER 79373 WAT 7423 ATOM 79373 O WAT 7424 1.448 131.569 86.864 1.00 0.00 O ATOM 79374 H1 WAT 7424 0.795 131.176 86.285 1.00 0.00 H ATOM 79375 H2 WAT 7424 1.222 131.243 87.735 1.00 0.00 H TER 79377 WAT 7424 ATOM 79377 O WAT 7425 7.337 91.558 76.795 1.00 0.00 O ATOM 79378 H1 WAT 7425 7.191 90.619 76.677 1.00 0.00 H ATOM 79379 H2 WAT 7425 8.002 91.781 76.143 1.00 0.00 H TER 79381 WAT 7425 ATOM 79381 O WAT 7426 134.603 133.712 82.277 1.00 0.00 O ATOM 79382 H1 WAT 7426 134.455 134.417 82.907 1.00 0.00 H ATOM 79383 H2 WAT 7426 135.469 133.370 82.499 1.00 0.00 H TER 79385 WAT 7426 ATOM 79385 O WAT 7427 17.133 131.284 92.106 1.00 0.00 O ATOM 79386 H1 WAT 7427 17.013 130.810 92.928 1.00 0.00 H ATOM 79387 H2 WAT 7427 16.876 132.184 92.308 1.00 0.00 H TER 79389 WAT 7427 ATOM 79389 O WAT 7428 81.841 11.050 141.152 1.00 0.00 O ATOM 79390 H1 WAT 7428 81.880 11.018 142.107 1.00 0.00 H ATOM 79391 H2 WAT 7428 81.771 10.134 140.884 1.00 0.00 H TER 79393 WAT 7428 ATOM 79393 O WAT 7429 41.325 41.128 143.054 1.00 0.00 O ATOM 79394 H1 WAT 7429 41.445 41.539 143.910 1.00 0.00 H ATOM 79395 H2 WAT 7429 41.515 40.202 143.203 1.00 0.00 H TER 79397 WAT 7429 ATOM 79397 O WAT 7430 54.446 2.312 68.280 1.00 0.00 O ATOM 79398 H1 WAT 7430 54.662 3.049 68.851 1.00 0.00 H ATOM 79399 H2 WAT 7430 53.502 2.385 68.142 1.00 0.00 H TER 79401 WAT 7430 ATOM 79401 O WAT 7431 141.964 119.068 4.353 1.00 0.00 O ATOM 79402 H1 WAT 7431 141.513 119.133 3.512 1.00 0.00 H ATOM 79403 H2 WAT 7431 142.875 119.285 4.154 1.00 0.00 H TER 79405 WAT 7431 ATOM 79405 O WAT 7432 144.334 88.199 99.567 1.00 0.00 O ATOM 79406 H1 WAT 7432 145.091 88.586 100.007 1.00 0.00 H ATOM 79407 H2 WAT 7432 144.226 88.723 98.773 1.00 0.00 H TER 79409 WAT 7432 ATOM 79409 O WAT 7433 31.441 141.313 134.827 1.00 0.00 O ATOM 79410 H1 WAT 7433 31.341 141.971 134.139 1.00 0.00 H ATOM 79411 H2 WAT 7433 30.562 141.211 135.191 1.00 0.00 H TER 79413 WAT 7433 ATOM 79413 O WAT 7434 39.277 6.291 135.985 1.00 0.00 O ATOM 79414 H1 WAT 7434 39.906 6.982 136.196 1.00 0.00 H ATOM 79415 H2 WAT 7434 39.793 5.485 136.003 1.00 0.00 H TER 79417 WAT 7434 ATOM 79417 O WAT 7435 128.040 137.638 142.235 1.00 0.00 O ATOM 79418 H1 WAT 7435 127.134 137.438 142.002 1.00 0.00 H ATOM 79419 H2 WAT 7435 128.002 138.519 142.610 1.00 0.00 H TER 79421 WAT 7435 ATOM 79421 O WAT 7436 134.912 45.770 93.095 1.00 0.00 O ATOM 79422 H1 WAT 7436 134.202 45.932 93.716 1.00 0.00 H ATOM 79423 H2 WAT 7436 134.839 46.480 92.457 1.00 0.00 H TER 79425 WAT 7436 ATOM 79425 O WAT 7437 76.911 62.234 116.497 1.00 0.00 O ATOM 79426 H1 WAT 7437 76.880 62.858 115.771 1.00 0.00 H ATOM 79427 H2 WAT 7437 76.754 61.383 116.088 1.00 0.00 H TER 79429 WAT 7437 ATOM 79429 O WAT 7438 15.083 21.147 154.235 1.00 0.00 O ATOM 79430 H1 WAT 7438 15.595 21.621 154.891 1.00 0.00 H ATOM 79431 H2 WAT 7438 15.439 21.439 153.396 1.00 0.00 H TER 79433 WAT 7438 ATOM 79433 O WAT 7439 53.252 116.990 62.883 1.00 0.00 O ATOM 79434 H1 WAT 7439 52.984 116.183 63.322 1.00 0.00 H ATOM 79435 H2 WAT 7439 53.982 116.727 62.323 1.00 0.00 H TER 79437 WAT 7439 ATOM 79437 O WAT 7440 13.401 25.027 91.769 1.00 0.00 O ATOM 79438 H1 WAT 7440 14.297 24.889 91.462 1.00 0.00 H ATOM 79439 H2 WAT 7440 12.971 24.181 91.644 1.00 0.00 H TER 79441 WAT 7440 ATOM 79441 O WAT 7441 67.867 41.693 102.164 1.00 0.00 O ATOM 79442 H1 WAT 7441 68.477 40.980 102.353 1.00 0.00 H ATOM 79443 H2 WAT 7441 67.528 41.951 103.021 1.00 0.00 H TER 79445 WAT 7441 ATOM 79445 O WAT 7442 59.584 110.581 149.826 1.00 0.00 O ATOM 79446 H1 WAT 7442 59.926 110.257 148.993 1.00 0.00 H ATOM 79447 H2 WAT 7442 59.388 109.790 150.328 1.00 0.00 H TER 79449 WAT 7442 ATOM 79449 O WAT 7443 38.895 125.064 128.966 1.00 0.00 O ATOM 79450 H1 WAT 7443 39.850 125.061 129.023 1.00 0.00 H ATOM 79451 H2 WAT 7443 38.627 124.246 129.384 1.00 0.00 H TER 79453 WAT 7443 ATOM 79453 O WAT 7444 81.555 123.169 57.600 1.00 0.00 O ATOM 79454 H1 WAT 7444 81.861 122.390 58.064 1.00 0.00 H ATOM 79455 H2 WAT 7444 81.013 123.632 58.239 1.00 0.00 H TER 79457 WAT 7444 ATOM 79457 O WAT 7445 141.571 123.360 120.310 1.00 0.00 O ATOM 79458 H1 WAT 7445 140.889 122.693 120.387 1.00 0.00 H ATOM 79459 H2 WAT 7445 141.100 124.158 120.070 1.00 0.00 H TER 79461 WAT 7445 ATOM 79461 O WAT 7446 96.238 12.282 70.821 1.00 0.00 O ATOM 79462 H1 WAT 7446 96.401 11.448 71.263 1.00 0.00 H ATOM 79463 H2 WAT 7446 95.788 12.040 70.012 1.00 0.00 H TER 79465 WAT 7446 ATOM 79465 O WAT 7447 48.651 65.852 137.499 1.00 0.00 O ATOM 79466 H1 WAT 7447 49.555 65.919 137.806 1.00 0.00 H ATOM 79467 H2 WAT 7447 48.230 65.257 138.120 1.00 0.00 H TER 79469 WAT 7447 ATOM 79469 O WAT 7448 136.321 63.252 16.005 1.00 0.00 O ATOM 79470 H1 WAT 7448 135.489 63.639 16.278 1.00 0.00 H ATOM 79471 H2 WAT 7448 136.925 63.455 16.718 1.00 0.00 H TER 79473 WAT 7448 ATOM 79473 O WAT 7449 15.096 15.223 17.845 1.00 0.00 O ATOM 79474 H1 WAT 7449 15.926 14.897 17.498 1.00 0.00 H ATOM 79475 H2 WAT 7449 15.348 15.907 18.466 1.00 0.00 H TER 79477 WAT 7449 ATOM 79477 O WAT 7450 117.094 18.469 134.029 1.00 0.00 O ATOM 79478 H1 WAT 7450 117.647 18.640 134.791 1.00 0.00 H ATOM 79479 H2 WAT 7450 116.863 19.338 133.701 1.00 0.00 H TER 79481 WAT 7450 ATOM 79481 O WAT 7451 95.032 20.981 62.903 1.00 0.00 O ATOM 79482 H1 WAT 7451 94.843 20.808 61.981 1.00 0.00 H ATOM 79483 H2 WAT 7451 94.183 21.201 63.285 1.00 0.00 H TER 79485 WAT 7451 ATOM 79485 O WAT 7452 61.346 55.802 75.995 1.00 0.00 O ATOM 79486 H1 WAT 7452 60.915 55.079 76.452 1.00 0.00 H ATOM 79487 H2 WAT 7452 62.114 56.000 76.531 1.00 0.00 H TER 79489 WAT 7452 ATOM 79489 O WAT 7453 73.316 43.744 7.903 1.00 0.00 O ATOM 79490 H1 WAT 7453 74.226 44.030 7.820 1.00 0.00 H ATOM 79491 H2 WAT 7453 73.217 43.531 8.831 1.00 0.00 H TER 79493 WAT 7453 ATOM 79493 O WAT 7454 103.405 121.935 88.841 1.00 0.00 O ATOM 79494 H1 WAT 7454 104.286 122.005 89.209 1.00 0.00 H ATOM 79495 H2 WAT 7454 102.829 122.256 89.535 1.00 0.00 H TER 79497 WAT 7454 ATOM 79497 O WAT 7455 67.512 49.867 117.258 1.00 0.00 O ATOM 79498 H1 WAT 7455 67.372 50.812 117.327 1.00 0.00 H ATOM 79499 H2 WAT 7455 68.288 49.780 116.704 1.00 0.00 H TER 79501 WAT 7455 ATOM 79501 O WAT 7456 83.266 88.720 2.640 1.00 0.00 O ATOM 79502 H1 WAT 7456 83.582 88.200 3.380 1.00 0.00 H ATOM 79503 H2 WAT 7456 83.095 89.585 3.011 1.00 0.00 H TER 79505 WAT 7456 ATOM 79505 O WAT 7457 91.249 98.297 109.923 1.00 0.00 O ATOM 79506 H1 WAT 7457 91.665 98.931 110.507 1.00 0.00 H ATOM 79507 H2 WAT 7457 91.199 98.745 109.079 1.00 0.00 H TER 79509 WAT 7457 ATOM 79509 O WAT 7458 19.506 7.576 24.699 1.00 0.00 O ATOM 79510 H1 WAT 7458 20.021 7.433 25.493 1.00 0.00 H ATOM 79511 H2 WAT 7458 18.668 7.150 24.877 1.00 0.00 H TER 79513 WAT 7458 ATOM 79513 O WAT 7459 72.549 117.849 110.158 1.00 0.00 O ATOM 79514 H1 WAT 7459 72.701 118.651 109.658 1.00 0.00 H ATOM 79515 H2 WAT 7459 72.353 117.187 109.495 1.00 0.00 H TER 79517 WAT 7459 ATOM 79517 O WAT 7460 107.165 111.635 8.877 1.00 0.00 O ATOM 79518 H1 WAT 7460 107.997 111.440 9.308 1.00 0.00 H ATOM 79519 H2 WAT 7460 106.913 110.812 8.459 1.00 0.00 H TER 79521 WAT 7460 ATOM 79521 O WAT 7461 89.551 85.982 20.625 1.00 0.00 O ATOM 79522 H1 WAT 7461 89.391 86.385 19.772 1.00 0.00 H ATOM 79523 H2 WAT 7461 89.041 86.511 21.239 1.00 0.00 H TER 79525 WAT 7461 ATOM 79525 O WAT 7462 15.720 35.833 118.421 1.00 0.00 O ATOM 79526 H1 WAT 7462 14.901 36.294 118.238 1.00 0.00 H ATOM 79527 H2 WAT 7462 15.864 35.286 117.650 1.00 0.00 H TER 79529 WAT 7462 ATOM 79529 O WAT 7463 18.650 144.762 77.023 1.00 0.00 O ATOM 79530 H1 WAT 7463 19.388 145.346 77.198 1.00 0.00 H ATOM 79531 H2 WAT 7463 17.929 145.349 76.793 1.00 0.00 H TER 79533 WAT 7463 ATOM 79533 O WAT 7464 118.182 33.927 118.442 1.00 0.00 O ATOM 79534 H1 WAT 7464 117.944 33.687 117.546 1.00 0.00 H ATOM 79535 H2 WAT 7464 117.344 34.058 118.886 1.00 0.00 H TER 79537 WAT 7464 ATOM 79537 O WAT 7465 36.968 43.543 75.659 1.00 0.00 O ATOM 79538 H1 WAT 7465 37.336 44.324 76.072 1.00 0.00 H ATOM 79539 H2 WAT 7465 37.691 42.915 75.648 1.00 0.00 H TER 79541 WAT 7465 ATOM 79541 O WAT 7466 4.305 115.950 95.769 1.00 0.00 O ATOM 79542 H1 WAT 7466 3.428 116.286 95.953 1.00 0.00 H ATOM 79543 H2 WAT 7466 4.893 116.546 96.234 1.00 0.00 H TER 79545 WAT 7466 ATOM 79545 O WAT 7467 101.151 9.713 76.442 1.00 0.00 O ATOM 79546 H1 WAT 7467 101.295 10.370 77.124 1.00 0.00 H ATOM 79547 H2 WAT 7467 100.308 9.950 76.056 1.00 0.00 H TER 79549 WAT 7467 ATOM 79549 O WAT 7468 132.673 7.438 11.998 1.00 0.00 O ATOM 79550 H1 WAT 7468 132.921 6.626 12.441 1.00 0.00 H ATOM 79551 H2 WAT 7468 131.946 7.188 11.428 1.00 0.00 H TER 79553 WAT 7468 ATOM 79553 O WAT 7469 122.898 84.570 115.228 1.00 0.00 O ATOM 79554 H1 WAT 7469 122.303 85.120 114.719 1.00 0.00 H ATOM 79555 H2 WAT 7469 122.589 83.677 115.074 1.00 0.00 H TER 79557 WAT 7469 ATOM 79557 O WAT 7470 58.050 100.865 0.580 1.00 0.00 O ATOM 79558 H1 WAT 7470 58.196 100.238 1.288 1.00 0.00 H ATOM 79559 H2 WAT 7470 57.851 100.324 -0.184 1.00 0.00 H TER 79561 WAT 7470 ATOM 79561 O WAT 7471 27.303 116.380 64.055 1.00 0.00 O ATOM 79562 H1 WAT 7471 26.881 117.195 63.782 1.00 0.00 H ATOM 79563 H2 WAT 7471 27.770 116.079 63.276 1.00 0.00 H TER 79565 WAT 7471 ATOM 79565 O WAT 7472 86.810 102.866 129.612 1.00 0.00 O ATOM 79566 H1 WAT 7472 86.148 103.200 130.217 1.00 0.00 H ATOM 79567 H2 WAT 7472 87.287 102.209 130.119 1.00 0.00 H TER 79569 WAT 7472 ATOM 79569 O WAT 7473 105.938 58.003 156.647 1.00 0.00 O ATOM 79570 H1 WAT 7473 106.206 58.678 156.023 1.00 0.00 H ATOM 79571 H2 WAT 7473 106.593 57.312 156.548 1.00 0.00 H TER 79573 WAT 7473 ATOM 79573 O WAT 7474 104.062 11.947 95.962 1.00 0.00 O ATOM 79574 H1 WAT 7474 104.069 11.222 95.338 1.00 0.00 H ATOM 79575 H2 WAT 7474 104.740 11.722 96.599 1.00 0.00 H TER 79577 WAT 7474 ATOM 79577 O WAT 7475 16.313 95.408 12.682 1.00 0.00 O ATOM 79578 H1 WAT 7475 16.186 96.338 12.493 1.00 0.00 H ATOM 79579 H2 WAT 7475 15.445 95.093 12.932 1.00 0.00 H TER 79581 WAT 7475 ATOM 79581 O WAT 7476 124.182 82.410 150.629 1.00 0.00 O ATOM 79582 H1 WAT 7476 124.767 81.686 150.406 1.00 0.00 H ATOM 79583 H2 WAT 7476 123.521 82.404 149.937 1.00 0.00 H TER 79585 WAT 7476 ATOM 79585 O WAT 7477 17.434 122.277 7.656 1.00 0.00 O ATOM 79586 H1 WAT 7477 17.721 123.005 7.105 1.00 0.00 H ATOM 79587 H2 WAT 7477 18.176 121.672 7.659 1.00 0.00 H TER 79589 WAT 7477 ATOM 79589 O WAT 7478 95.941 134.886 119.650 1.00 0.00 O ATOM 79590 H1 WAT 7478 95.728 135.184 120.535 1.00 0.00 H ATOM 79591 H2 WAT 7478 96.898 134.855 119.632 1.00 0.00 H TER 79593 WAT 7478 ATOM 79593 O WAT 7479 108.011 23.465 158.322 1.00 0.00 O ATOM 79594 H1 WAT 7479 107.771 22.566 158.546 1.00 0.00 H ATOM 79595 H2 WAT 7479 107.192 23.869 158.038 1.00 0.00 H TER 79597 WAT 7479 ATOM 79597 O WAT 7480 12.821 54.427 107.674 1.00 0.00 O ATOM 79598 H1 WAT 7480 13.257 53.716 107.204 1.00 0.00 H ATOM 79599 H2 WAT 7480 12.847 55.166 107.066 1.00 0.00 H TER 79601 WAT 7480 ATOM 79601 O WAT 7481 36.238 50.195 116.544 1.00 0.00 O ATOM 79602 H1 WAT 7481 35.563 49.711 116.067 1.00 0.00 H ATOM 79603 H2 WAT 7481 37.044 49.706 116.379 1.00 0.00 H TER 79605 WAT 7481 ATOM 79605 O WAT 7482 56.646 111.654 80.728 1.00 0.00 O ATOM 79606 H1 WAT 7482 57.525 111.727 81.101 1.00 0.00 H ATOM 79607 H2 WAT 7482 56.350 110.781 80.983 1.00 0.00 H TER 79609 WAT 7482 ATOM 79609 O WAT 7483 38.625 43.729 147.169 1.00 0.00 O ATOM 79610 H1 WAT 7483 39.089 43.093 147.713 1.00 0.00 H ATOM 79611 H2 WAT 7483 38.342 43.229 146.404 1.00 0.00 H TER 79613 WAT 7483 ATOM 79613 O WAT 7484 30.318 50.951 110.135 1.00 0.00 O ATOM 79614 H1 WAT 7484 30.322 51.514 110.909 1.00 0.00 H ATOM 79615 H2 WAT 7484 29.961 50.119 110.445 1.00 0.00 H TER 79617 WAT 7484 ATOM 79617 O WAT 7485 18.762 104.984 77.956 1.00 0.00 O ATOM 79618 H1 WAT 7485 19.062 104.466 77.210 1.00 0.00 H ATOM 79619 H2 WAT 7485 18.730 104.361 78.682 1.00 0.00 H TER 79621 WAT 7485 ATOM 79621 O WAT 7486 6.312 8.601 114.730 1.00 0.00 O ATOM 79622 H1 WAT 7486 6.822 8.352 113.959 1.00 0.00 H ATOM 79623 H2 WAT 7486 5.422 8.309 114.533 1.00 0.00 H TER 79625 WAT 7486 ATOM 79625 O WAT 7487 72.581 52.996 154.553 1.00 0.00 O ATOM 79626 H1 WAT 7487 71.958 53.143 155.266 1.00 0.00 H ATOM 79627 H2 WAT 7487 73.057 52.207 154.810 1.00 0.00 H TER 79629 WAT 7487 ATOM 79629 O WAT 7488 10.380 116.129 140.946 1.00 0.00 O ATOM 79630 H1 WAT 7488 11.135 115.936 141.503 1.00 0.00 H ATOM 79631 H2 WAT 7488 10.627 115.793 140.084 1.00 0.00 H TER 79633 WAT 7488 ATOM 79633 O WAT 7489 67.522 39.460 138.854 1.00 0.00 O ATOM 79634 H1 WAT 7489 68.453 39.467 139.076 1.00 0.00 H ATOM 79635 H2 WAT 7489 67.344 38.554 138.599 1.00 0.00 H TER 79637 WAT 7489 ATOM 79637 O WAT 7490 79.358 76.242 104.629 1.00 0.00 O ATOM 79638 H1 WAT 7490 78.709 76.722 105.143 1.00 0.00 H ATOM 79639 H2 WAT 7490 79.834 76.921 104.150 1.00 0.00 H TER 79641 WAT 7490 ATOM 79641 O WAT 7491 22.593 5.320 127.535 1.00 0.00 O ATOM 79642 H1 WAT 7491 22.554 5.570 128.458 1.00 0.00 H ATOM 79643 H2 WAT 7491 22.375 6.122 127.060 1.00 0.00 H TER 79645 WAT 7491 ATOM 79645 O WAT 7492 77.525 74.317 147.094 1.00 0.00 O ATOM 79646 H1 WAT 7492 77.693 74.006 146.204 1.00 0.00 H ATOM 79647 H2 WAT 7492 77.672 75.262 147.049 1.00 0.00 H TER 79649 WAT 7492 ATOM 79649 O WAT 7493 16.469 71.357 131.844 1.00 0.00 O ATOM 79650 H1 WAT 7493 15.637 71.178 132.282 1.00 0.00 H ATOM 79651 H2 WAT 7493 16.442 70.823 131.050 1.00 0.00 H TER 79653 WAT 7493 ATOM 79653 O WAT 7494 120.449 53.806 2.570 1.00 0.00 O ATOM 79654 H1 WAT 7494 120.899 54.117 3.355 1.00 0.00 H ATOM 79655 H2 WAT 7494 119.882 54.533 2.314 1.00 0.00 H TER 79657 WAT 7494 ATOM 79657 O WAT 7495 107.473 48.635 62.052 1.00 0.00 O ATOM 79658 H1 WAT 7495 106.632 48.891 62.430 1.00 0.00 H ATOM 79659 H2 WAT 7495 107.908 48.143 62.748 1.00 0.00 H TER 79661 WAT 7495 ATOM 79661 O WAT 7496 52.570 76.272 2.629 1.00 0.00 O ATOM 79662 H1 WAT 7496 52.222 76.989 3.160 1.00 0.00 H ATOM 79663 H2 WAT 7496 51.930 75.567 2.731 1.00 0.00 H TER 79665 WAT 7496 ATOM 79665 O WAT 7497 30.510 140.659 140.033 1.00 0.00 O ATOM 79666 H1 WAT 7497 30.474 140.026 139.316 1.00 0.00 H ATOM 79667 H2 WAT 7497 29.614 140.697 140.365 1.00 0.00 H TER 79669 WAT 7497 ATOM 79669 O WAT 7498 37.091 47.254 128.884 1.00 0.00 O ATOM 79670 H1 WAT 7498 36.286 46.742 128.812 1.00 0.00 H ATOM 79671 H2 WAT 7498 36.821 48.068 129.309 1.00 0.00 H TER 79673 WAT 7498 ATOM 79673 O WAT 7499 56.555 120.474 117.110 1.00 0.00 O ATOM 79674 H1 WAT 7499 55.869 120.156 117.697 1.00 0.00 H ATOM 79675 H2 WAT 7499 57.114 119.712 116.959 1.00 0.00 H TER 79677 WAT 7499 ATOM 79677 O WAT 7500 97.468 114.631 145.121 1.00 0.00 O ATOM 79678 H1 WAT 7500 97.043 115.392 144.726 1.00 0.00 H ATOM 79679 H2 WAT 7500 96.755 114.153 145.545 1.00 0.00 H TER 79681 WAT 7500 ATOM 79681 O WAT 7501 50.986 82.344 151.386 1.00 0.00 O ATOM 79682 H1 WAT 7501 51.317 81.551 150.966 1.00 0.00 H ATOM 79683 H2 WAT 7501 51.767 82.777 151.730 1.00 0.00 H TER 79685 WAT 7501 ATOM 79685 O WAT 7502 61.495 34.149 61.182 1.00 0.00 O ATOM 79686 H1 WAT 7502 61.567 35.054 60.878 1.00 0.00 H ATOM 79687 H2 WAT 7502 62.392 33.817 61.162 1.00 0.00 H TER 79689 WAT 7502 ATOM 79689 O WAT 7503 85.411 30.946 118.751 1.00 0.00 O ATOM 79690 H1 WAT 7503 85.255 31.027 119.692 1.00 0.00 H ATOM 79691 H2 WAT 7503 86.186 30.388 118.684 1.00 0.00 H TER 79693 WAT 7503 ATOM 79693 O WAT 7504 38.374 33.513 14.318 1.00 0.00 O ATOM 79694 H1 WAT 7504 38.616 32.690 14.742 1.00 0.00 H ATOM 79695 H2 WAT 7504 38.513 33.352 13.385 1.00 0.00 H TER 79697 WAT 7504 ATOM 79697 O WAT 7505 80.752 51.104 66.497 1.00 0.00 O ATOM 79698 H1 WAT 7505 80.148 51.707 66.931 1.00 0.00 H ATOM 79699 H2 WAT 7505 80.238 50.719 65.787 1.00 0.00 H TER 79701 WAT 7505 ATOM 79701 O WAT 7506 64.826 89.354 118.639 1.00 0.00 O ATOM 79702 H1 WAT 7506 65.347 88.897 117.979 1.00 0.00 H ATOM 79703 H2 WAT 7506 64.849 90.272 118.370 1.00 0.00 H TER 79705 WAT 7506 ATOM 79705 O WAT 7507 123.015 76.776 82.125 1.00 0.00 O ATOM 79706 H1 WAT 7507 122.687 77.639 81.872 1.00 0.00 H ATOM 79707 H2 WAT 7507 123.621 76.952 82.844 1.00 0.00 H TER 79709 WAT 7507 ATOM 79709 O WAT 7508 54.454 104.297 108.596 1.00 0.00 O ATOM 79710 H1 WAT 7508 53.837 103.575 108.710 1.00 0.00 H ATOM 79711 H2 WAT 7508 53.921 105.086 108.697 1.00 0.00 H TER 79713 WAT 7508 ATOM 79713 O WAT 7509 37.403 121.942 142.740 1.00 0.00 O ATOM 79714 H1 WAT 7509 37.163 122.632 142.122 1.00 0.00 H ATOM 79715 H2 WAT 7509 36.568 121.632 143.090 1.00 0.00 H TER 79717 WAT 7509 ATOM 79717 O WAT 7510 91.862 68.504 143.589 1.00 0.00 O ATOM 79718 H1 WAT 7510 91.355 69.316 143.564 1.00 0.00 H ATOM 79719 H2 WAT 7510 91.273 67.843 143.227 1.00 0.00 H TER 79721 WAT 7510 ATOM 79721 O WAT 7511 63.015 91.139 102.884 1.00 0.00 O ATOM 79722 H1 WAT 7511 62.823 90.742 102.035 1.00 0.00 H ATOM 79723 H2 WAT 7511 63.907 90.855 103.085 1.00 0.00 H TER 79725 WAT 7511 ATOM 79725 O WAT 7512 34.732 121.932 0.831 1.00 0.00 O ATOM 79726 H1 WAT 7512 34.981 122.450 1.596 1.00 0.00 H ATOM 79727 H2 WAT 7512 35.553 121.793 0.359 1.00 0.00 H TER 79729 WAT 7512 ATOM 79729 O WAT 7513 91.827 99.213 77.575 1.00 0.00 O ATOM 79730 H1 WAT 7513 92.755 99.433 77.652 1.00 0.00 H ATOM 79731 H2 WAT 7513 91.371 99.962 77.958 1.00 0.00 H TER 79733 WAT 7513 ATOM 79733 O WAT 7514 98.102 17.709 92.667 1.00 0.00 O ATOM 79734 H1 WAT 7514 97.863 18.190 93.460 1.00 0.00 H ATOM 79735 H2 WAT 7514 97.414 17.051 92.569 1.00 0.00 H TER 79737 WAT 7514 ATOM 79737 O WAT 7515 117.849 26.155 144.184 1.00 0.00 O ATOM 79738 H1 WAT 7515 117.232 26.194 143.453 1.00 0.00 H ATOM 79739 H2 WAT 7515 117.707 26.973 144.661 1.00 0.00 H TER 79741 WAT 7515 ATOM 79741 O WAT 7516 132.963 123.445 70.251 1.00 0.00 O ATOM 79742 H1 WAT 7516 132.487 122.618 70.321 1.00 0.00 H ATOM 79743 H2 WAT 7516 132.537 124.021 70.886 1.00 0.00 H TER 79745 WAT 7516 ATOM 79745 O WAT 7517 95.235 99.663 120.412 1.00 0.00 O ATOM 79746 H1 WAT 7517 95.880 99.581 121.115 1.00 0.00 H ATOM 79747 H2 WAT 7517 95.136 98.773 120.073 1.00 0.00 H TER 79749 WAT 7517 ATOM 79749 O WAT 7518 142.072 34.827 90.007 1.00 0.00 O ATOM 79750 H1 WAT 7518 141.852 35.741 89.824 1.00 0.00 H ATOM 79751 H2 WAT 7518 142.068 34.767 90.963 1.00 0.00 H TER 79753 WAT 7518 ATOM 79753 O WAT 7519 23.360 110.907 56.562 1.00 0.00 O ATOM 79754 H1 WAT 7519 23.003 111.361 55.799 1.00 0.00 H ATOM 79755 H2 WAT 7519 24.116 110.427 56.223 1.00 0.00 H TER 79757 WAT 7519 ATOM 79757 O WAT 7520 77.308 70.647 6.390 1.00 0.00 O ATOM 79758 H1 WAT 7520 77.960 71.250 6.746 1.00 0.00 H ATOM 79759 H2 WAT 7520 77.540 69.796 6.763 1.00 0.00 H TER 79761 WAT 7520 ATOM 79761 O WAT 7521 43.528 10.269 80.388 1.00 0.00 O ATOM 79762 H1 WAT 7521 42.800 10.731 79.972 1.00 0.00 H ATOM 79763 H2 WAT 7521 44.288 10.830 80.233 1.00 0.00 H TER 79765 WAT 7521 ATOM 79765 O WAT 7522 96.725 92.200 117.316 1.00 0.00 O ATOM 79766 H1 WAT 7522 97.653 92.424 117.242 1.00 0.00 H ATOM 79767 H2 WAT 7522 96.656 91.333 116.918 1.00 0.00 H TER 79769 WAT 7522 ATOM 79769 O WAT 7523 132.379 38.973 22.556 1.00 0.00 O ATOM 79770 H1 WAT 7523 132.329 38.023 22.447 1.00 0.00 H ATOM 79771 H2 WAT 7523 133.118 39.238 22.008 1.00 0.00 H TER 79773 WAT 7523 ATOM 79773 O WAT 7524 -0.169 13.025 84.241 1.00 0.00 O ATOM 79774 H1 WAT 7524 -0.303 13.342 83.347 1.00 0.00 H ATOM 79775 H2 WAT 7524 0.782 12.950 84.328 1.00 0.00 H TER 79777 WAT 7524 ATOM 79777 O WAT 7525 83.562 59.308 71.236 1.00 0.00 O ATOM 79778 H1 WAT 7525 84.418 59.713 71.094 1.00 0.00 H ATOM 79779 H2 WAT 7525 83.432 59.351 72.184 1.00 0.00 H TER 79781 WAT 7525 ATOM 79781 O WAT 7526 128.691 65.783 127.331 1.00 0.00 O ATOM 79782 H1 WAT 7526 129.368 66.440 127.491 1.00 0.00 H ATOM 79783 H2 WAT 7526 128.282 65.647 128.186 1.00 0.00 H TER 79785 WAT 7526 ATOM 79785 O WAT 7527 121.372 19.562 20.160 1.00 0.00 O ATOM 79786 H1 WAT 7527 121.901 19.168 19.466 1.00 0.00 H ATOM 79787 H2 WAT 7527 121.205 18.843 20.770 1.00 0.00 H TER 79789 WAT 7527 ATOM 79789 O WAT 7528 65.527 37.877 102.489 1.00 0.00 O ATOM 79790 H1 WAT 7528 65.630 38.048 101.553 1.00 0.00 H ATOM 79791 H2 WAT 7528 65.574 36.924 102.565 1.00 0.00 H TER 79793 WAT 7528 ATOM 79793 O WAT 7529 101.925 109.025 111.367 1.00 0.00 O ATOM 79794 H1 WAT 7529 101.879 108.243 110.817 1.00 0.00 H ATOM 79795 H2 WAT 7529 101.411 108.803 112.143 1.00 0.00 H TER 79797 WAT 7529 ATOM 79797 O WAT 7530 51.089 129.074 2.877 1.00 0.00 O ATOM 79798 H1 WAT 7530 51.709 129.240 3.587 1.00 0.00 H ATOM 79799 H2 WAT 7530 51.327 129.706 2.198 1.00 0.00 H TER 79801 WAT 7530 ATOM 79801 O WAT 7531 55.184 91.750 75.822 1.00 0.00 O ATOM 79802 H1 WAT 7531 55.442 92.225 75.032 1.00 0.00 H ATOM 79803 H2 WAT 7531 55.702 92.149 76.521 1.00 0.00 H TER 79805 WAT 7531 ATOM 79805 O WAT 7532 36.656 129.132 10.596 1.00 0.00 O ATOM 79806 H1 WAT 7532 36.977 128.907 11.469 1.00 0.00 H ATOM 79807 H2 WAT 7532 36.266 130.000 10.700 1.00 0.00 H TER 79809 WAT 7532 ATOM 79809 O WAT 7533 95.886 107.676 24.121 1.00 0.00 O ATOM 79810 H1 WAT 7533 95.237 108.324 23.846 1.00 0.00 H ATOM 79811 H2 WAT 7533 95.927 107.767 25.073 1.00 0.00 H TER 79813 WAT 7533 ATOM 79813 O WAT 7534 21.249 103.039 155.537 1.00 0.00 O ATOM 79814 H1 WAT 7534 21.025 102.309 156.115 1.00 0.00 H ATOM 79815 H2 WAT 7534 20.406 103.352 155.210 1.00 0.00 H TER 79817 WAT 7534 ATOM 79817 O WAT 7535 82.089 1.450 6.615 1.00 0.00 O ATOM 79818 H1 WAT 7535 81.368 1.104 6.088 1.00 0.00 H ATOM 79819 H2 WAT 7535 81.677 2.094 7.191 1.00 0.00 H TER 79821 WAT 7535 ATOM 79821 O WAT 7536 13.627 90.660 141.544 1.00 0.00 O ATOM 79822 H1 WAT 7536 12.671 90.642 141.579 1.00 0.00 H ATOM 79823 H2 WAT 7536 13.903 89.976 142.154 1.00 0.00 H TER 79825 WAT 7536 ATOM 79825 O WAT 7537 22.357 36.439 127.051 1.00 0.00 O ATOM 79826 H1 WAT 7537 22.871 35.780 127.517 1.00 0.00 H ATOM 79827 H2 WAT 7537 21.626 35.950 126.674 1.00 0.00 H TER 79829 WAT 7537 ATOM 79829 O WAT 7538 122.018 67.307 74.489 1.00 0.00 O ATOM 79830 H1 WAT 7538 122.893 67.011 74.742 1.00 0.00 H ATOM 79831 H2 WAT 7538 121.613 67.585 75.310 1.00 0.00 H TER 79833 WAT 7538 ATOM 79833 O WAT 7539 20.774 124.670 113.747 1.00 0.00 O ATOM 79834 H1 WAT 7539 20.775 123.943 113.124 1.00 0.00 H ATOM 79835 H2 WAT 7539 21.620 124.607 114.190 1.00 0.00 H TER 79837 WAT 7539 ATOM 79837 O WAT 7540 118.683 128.716 103.897 1.00 0.00 O ATOM 79838 H1 WAT 7540 117.919 128.174 103.698 1.00 0.00 H ATOM 79839 H2 WAT 7540 119.038 128.343 104.704 1.00 0.00 H TER 79841 WAT 7540 ATOM 79841 O WAT 7541 125.637 114.743 63.180 1.00 0.00 O ATOM 79842 H1 WAT 7541 125.960 113.927 63.563 1.00 0.00 H ATOM 79843 H2 WAT 7541 125.536 115.333 63.927 1.00 0.00 H TER 79845 WAT 7541 ATOM 79845 O WAT 7542 109.568 102.506 65.874 1.00 0.00 O ATOM 79846 H1 WAT 7542 108.657 102.231 65.776 1.00 0.00 H ATOM 79847 H2 WAT 7542 109.577 103.416 65.576 1.00 0.00 H TER 79849 WAT 7542 ATOM 79849 O WAT 7543 120.114 85.870 137.641 1.00 0.00 O ATOM 79850 H1 WAT 7543 120.376 86.370 136.868 1.00 0.00 H ATOM 79851 H2 WAT 7543 120.569 86.296 138.368 1.00 0.00 H TER 79853 WAT 7543 ATOM 79853 O WAT 7544 101.766 139.690 142.770 1.00 0.00 O ATOM 79854 H1 WAT 7544 100.945 140.080 143.070 1.00 0.00 H ATOM 79855 H2 WAT 7544 102.412 139.963 143.422 1.00 0.00 H TER 79857 WAT 7544 ATOM 79857 O WAT 7545 4.094 108.412 21.544 1.00 0.00 O ATOM 79858 H1 WAT 7545 4.828 108.079 22.060 1.00 0.00 H ATOM 79859 H2 WAT 7545 4.449 109.175 21.088 1.00 0.00 H TER 79861 WAT 7545 ATOM 79861 O WAT 7546 109.966 46.154 82.199 1.00 0.00 O ATOM 79862 H1 WAT 7546 110.847 46.482 82.382 1.00 0.00 H ATOM 79863 H2 WAT 7546 110.005 45.225 82.427 1.00 0.00 H TER 79865 WAT 7546 ATOM 79865 O WAT 7547 54.132 53.174 100.820 1.00 0.00 O ATOM 79866 H1 WAT 7547 54.625 53.941 101.114 1.00 0.00 H ATOM 79867 H2 WAT 7547 54.774 52.464 100.819 1.00 0.00 H TER 79869 WAT 7547 ATOM 79869 O WAT 7548 21.817 31.718 5.935 1.00 0.00 O ATOM 79870 H1 WAT 7548 21.445 31.209 5.215 1.00 0.00 H ATOM 79871 H2 WAT 7548 22.432 31.120 6.359 1.00 0.00 H TER 79873 WAT 7548 ATOM 79873 O WAT 7549 67.021 71.926 155.945 1.00 0.00 O ATOM 79874 H1 WAT 7549 66.531 71.166 156.259 1.00 0.00 H ATOM 79875 H2 WAT 7549 67.248 71.708 155.041 1.00 0.00 H TER 79877 WAT 7549 ATOM 79877 O WAT 7550 124.060 111.099 155.500 1.00 0.00 O ATOM 79878 H1 WAT 7550 124.935 111.439 155.687 1.00 0.00 H ATOM 79879 H2 WAT 7550 124.113 110.783 154.598 1.00 0.00 H TER 79881 WAT 7550 ATOM 79881 O WAT 7551 3.106 35.261 122.372 1.00 0.00 O ATOM 79882 H1 WAT 7551 3.621 35.545 123.127 1.00 0.00 H ATOM 79883 H2 WAT 7551 2.281 35.740 122.451 1.00 0.00 H TER 79885 WAT 7551 ATOM 79885 O WAT 7552 13.783 17.141 144.337 1.00 0.00 O ATOM 79886 H1 WAT 7552 13.641 17.023 143.398 1.00 0.00 H ATOM 79887 H2 WAT 7552 13.785 16.253 144.693 1.00 0.00 H TER 79889 WAT 7552 ATOM 79889 O WAT 7553 71.496 124.334 0.918 1.00 0.00 O ATOM 79890 H1 WAT 7553 72.182 124.163 1.564 1.00 0.00 H ATOM 79891 H2 WAT 7553 70.678 124.182 1.393 1.00 0.00 H TER 79893 WAT 7553 ATOM 79893 O WAT 7554 127.920 66.336 63.122 1.00 0.00 O ATOM 79894 H1 WAT 7554 127.901 66.251 64.075 1.00 0.00 H ATOM 79895 H2 WAT 7554 127.081 65.975 62.833 1.00 0.00 H TER 79897 WAT 7554 ATOM 79897 O WAT 7555 136.106 96.655 99.388 1.00 0.00 O ATOM 79898 H1 WAT 7555 136.146 95.759 99.723 1.00 0.00 H ATOM 79899 H2 WAT 7555 135.599 97.134 100.044 1.00 0.00 H TER 79901 WAT 7555 ATOM 79901 O WAT 7556 18.457 13.462 125.418 1.00 0.00 O ATOM 79902 H1 WAT 7556 18.402 12.518 125.563 1.00 0.00 H ATOM 79903 H2 WAT 7556 18.474 13.839 126.298 1.00 0.00 H TER 79905 WAT 7556 ATOM 79905 O WAT 7557 135.166 37.961 158.377 1.00 0.00 O ATOM 79906 H1 WAT 7557 134.796 38.700 158.859 1.00 0.00 H ATOM 79907 H2 WAT 7557 135.684 38.363 157.681 1.00 0.00 H TER 79909 WAT 7557 ATOM 79909 O WAT 7558 76.653 95.979 113.198 1.00 0.00 O ATOM 79910 H1 WAT 7558 77.277 95.287 112.978 1.00 0.00 H ATOM 79911 H2 WAT 7558 75.954 95.886 112.551 1.00 0.00 H TER 79913 WAT 7558 ATOM 79913 O WAT 7559 56.869 80.536 151.636 1.00 0.00 O ATOM 79914 H1 WAT 7559 56.461 81.122 152.274 1.00 0.00 H ATOM 79915 H2 WAT 7559 57.651 80.206 152.079 1.00 0.00 H TER 79917 WAT 7559 ATOM 79917 O WAT 7560 50.012 60.722 118.407 1.00 0.00 O ATOM 79918 H1 WAT 7560 49.225 60.178 118.438 1.00 0.00 H ATOM 79919 H2 WAT 7560 50.489 60.408 117.638 1.00 0.00 H TER 79921 WAT 7560 ATOM 79921 O WAT 7561 23.812 48.518 61.473 1.00 0.00 O ATOM 79922 H1 WAT 7561 23.736 49.408 61.816 1.00 0.00 H ATOM 79923 H2 WAT 7561 24.755 48.362 61.416 1.00 0.00 H TER 79925 WAT 7561 ATOM 79925 O WAT 7562 15.399 47.987 5.143 1.00 0.00 O ATOM 79926 H1 WAT 7562 16.177 48.218 4.634 1.00 0.00 H ATOM 79927 H2 WAT 7562 15.432 48.564 5.906 1.00 0.00 H TER 79929 WAT 7562 ATOM 79929 O WAT 7563 85.299 145.919 158.231 1.00 0.00 O ATOM 79930 H1 WAT 7563 85.340 145.089 157.755 1.00 0.00 H ATOM 79931 H2 WAT 7563 85.127 145.666 159.139 1.00 0.00 H TER 79933 WAT 7563 ATOM 79933 O WAT 7564 27.797 141.543 122.188 1.00 0.00 O ATOM 79934 H1 WAT 7564 28.260 142.353 121.975 1.00 0.00 H ATOM 79935 H2 WAT 7564 28.027 141.368 123.101 1.00 0.00 H TER 79937 WAT 7564 ATOM 79937 O WAT 7565 139.067 131.111 57.331 1.00 0.00 O ATOM 79938 H1 WAT 7565 139.708 131.813 57.448 1.00 0.00 H ATOM 79939 H2 WAT 7565 139.516 130.323 57.640 1.00 0.00 H TER 79941 WAT 7565 ATOM 79941 O WAT 7566 143.169 74.113 138.070 1.00 0.00 O ATOM 79942 H1 WAT 7566 142.291 73.749 138.185 1.00 0.00 H ATOM 79943 H2 WAT 7566 143.738 73.348 137.992 1.00 0.00 H TER 79945 WAT 7566 ATOM 79945 O WAT 7567 27.819 118.788 125.305 1.00 0.00 O ATOM 79946 H1 WAT 7567 27.584 119.331 124.552 1.00 0.00 H ATOM 79947 H2 WAT 7567 27.020 118.751 125.832 1.00 0.00 H TER 79949 WAT 7567 ATOM 79949 O WAT 7568 60.803 52.717 59.056 1.00 0.00 O ATOM 79950 H1 WAT 7568 61.463 53.402 58.955 1.00 0.00 H ATOM 79951 H2 WAT 7568 60.756 52.301 58.195 1.00 0.00 H TER 79953 WAT 7568 ATOM 79953 O WAT 7569 124.969 26.030 139.978 1.00 0.00 O ATOM 79954 H1 WAT 7569 125.415 26.814 139.657 1.00 0.00 H ATOM 79955 H2 WAT 7569 125.607 25.611 140.555 1.00 0.00 H TER 79957 WAT 7569 ATOM 79957 O WAT 7570 30.367 99.357 83.720 1.00 0.00 O ATOM 79958 H1 WAT 7570 30.109 99.538 82.816 1.00 0.00 H ATOM 79959 H2 WAT 7570 29.651 98.828 84.073 1.00 0.00 H TER 79961 WAT 7570 ATOM 79961 O WAT 7571 68.916 113.897 82.309 1.00 0.00 O ATOM 79962 H1 WAT 7571 69.609 114.536 82.145 1.00 0.00 H ATOM 79963 H2 WAT 7571 68.562 114.142 83.164 1.00 0.00 H TER 79965 WAT 7571 ATOM 79965 O WAT 7572 24.835 133.149 151.990 1.00 0.00 O ATOM 79966 H1 WAT 7572 25.734 133.057 152.306 1.00 0.00 H ATOM 79967 H2 WAT 7572 24.354 133.503 152.739 1.00 0.00 H TER 79969 WAT 7572 ATOM 79969 O WAT 7573 13.481 7.130 89.701 1.00 0.00 O ATOM 79970 H1 WAT 7573 12.883 7.509 90.345 1.00 0.00 H ATOM 79971 H2 WAT 7573 13.728 6.284 90.073 1.00 0.00 H TER 79973 WAT 7573 ATOM 79973 O WAT 7574 90.752 74.784 112.709 1.00 0.00 O ATOM 79974 H1 WAT 7574 91.487 75.278 112.344 1.00 0.00 H ATOM 79975 H2 WAT 7574 90.939 73.873 112.482 1.00 0.00 H TER 79977 WAT 7574 ATOM 79977 O WAT 7575 115.756 106.113 1.886 1.00 0.00 O ATOM 79978 H1 WAT 7575 116.580 106.582 1.759 1.00 0.00 H ATOM 79979 H2 WAT 7575 115.974 105.196 1.723 1.00 0.00 H TER 79981 WAT 7575 ATOM 79981 O WAT 7576 121.077 88.873 5.262 1.00 0.00 O ATOM 79982 H1 WAT 7576 120.578 88.076 5.439 1.00 0.00 H ATOM 79983 H2 WAT 7576 121.869 88.566 4.819 1.00 0.00 H TER 79985 WAT 7576 ATOM 79985 O WAT 7577 38.865 109.217 27.266 1.00 0.00 O ATOM 79986 H1 WAT 7577 38.275 109.676 26.668 1.00 0.00 H ATOM 79987 H2 WAT 7577 38.350 109.093 28.063 1.00 0.00 H TER 79989 WAT 7577 ATOM 79989 O WAT 7578 9.066 56.883 90.147 1.00 0.00 O ATOM 79990 H1 WAT 7578 8.830 57.780 90.380 1.00 0.00 H ATOM 79991 H2 WAT 7578 9.997 56.817 90.361 1.00 0.00 H TER 79993 WAT 7578 ATOM 79993 O WAT 7579 76.721 36.349 19.017 1.00 0.00 O ATOM 79994 H1 WAT 7579 77.523 36.042 18.594 1.00 0.00 H ATOM 79995 H2 WAT 7579 76.858 36.171 19.947 1.00 0.00 H TER 79997 WAT 7579 ATOM 79997 O WAT 7580 51.795 125.483 108.420 1.00 0.00 O ATOM 79998 H1 WAT 7580 51.863 126.438 108.443 1.00 0.00 H ATOM 79999 H2 WAT 7580 50.872 125.305 108.600 1.00 0.00 H TER 80001 WAT 7580 ATOM 80001 O WAT 7581 17.713 62.234 135.053 1.00 0.00 O ATOM 80002 H1 WAT 7581 18.249 63.027 135.021 1.00 0.00 H ATOM 80003 H2 WAT 7581 18.289 61.572 135.435 1.00 0.00 H TER 80005 WAT 7581 ATOM 80005 O WAT 7582 43.414 59.080 114.979 1.00 0.00 O ATOM 80006 H1 WAT 7582 43.316 58.230 114.550 1.00 0.00 H ATOM 80007 H2 WAT 7582 44.342 59.293 114.880 1.00 0.00 H TER 80009 WAT 7582 ATOM 80009 O WAT 7583 106.794 50.342 151.838 1.00 0.00 O ATOM 80010 H1 WAT 7583 106.044 50.915 151.674 1.00 0.00 H ATOM 80011 H2 WAT 7583 106.472 49.702 152.472 1.00 0.00 H TER 80013 WAT 7583 ATOM 80013 O WAT 7584 41.125 109.165 112.850 1.00 0.00 O ATOM 80014 H1 WAT 7584 40.831 109.530 113.684 1.00 0.00 H ATOM 80015 H2 WAT 7584 41.822 108.554 113.088 1.00 0.00 H TER 80017 WAT 7584 ATOM 80017 O WAT 7585 4.726 84.864 76.147 1.00 0.00 O ATOM 80018 H1 WAT 7585 3.813 84.857 75.859 1.00 0.00 H ATOM 80019 H2 WAT 7585 5.215 84.520 75.400 1.00 0.00 H TER 80021 WAT 7585 ATOM 80021 O WAT 7586 15.469 19.050 114.233 1.00 0.00 O ATOM 80022 H1 WAT 7586 15.867 18.418 114.832 1.00 0.00 H ATOM 80023 H2 WAT 7586 14.610 19.232 114.613 1.00 0.00 H TER 80025 WAT 7586 ATOM 80025 O WAT 7587 19.404 140.519 129.177 1.00 0.00 O ATOM 80026 H1 WAT 7587 19.867 141.034 129.838 1.00 0.00 H ATOM 80027 H2 WAT 7587 18.961 139.832 129.675 1.00 0.00 H TER 80029 WAT 7587 ATOM 80029 O WAT 7588 25.722 55.624 5.602 1.00 0.00 O ATOM 80030 H1 WAT 7588 24.872 55.888 5.956 1.00 0.00 H ATOM 80031 H2 WAT 7588 26.112 56.439 5.287 1.00 0.00 H TER 80033 WAT 7588 ATOM 80033 O WAT 7589 111.672 136.348 134.652 1.00 0.00 O ATOM 80034 H1 WAT 7589 111.172 135.541 134.533 1.00 0.00 H ATOM 80035 H2 WAT 7589 111.349 136.710 135.477 1.00 0.00 H TER 80037 WAT 7589 ATOM 80037 O WAT 7590 30.559 138.237 2.315 1.00 0.00 O ATOM 80038 H1 WAT 7590 31.302 137.657 2.479 1.00 0.00 H ATOM 80039 H2 WAT 7590 30.758 139.029 2.815 1.00 0.00 H TER 80041 WAT 7590 ATOM 80041 O WAT 7591 0.803 117.618 149.921 1.00 0.00 O ATOM 80042 H1 WAT 7591 0.781 116.846 150.486 1.00 0.00 H ATOM 80043 H2 WAT 7591 0.538 117.294 149.061 1.00 0.00 H TER 80045 WAT 7591 ATOM 80045 O WAT 7592 120.357 80.879 61.041 1.00 0.00 O ATOM 80046 H1 WAT 7592 121.111 80.433 60.655 1.00 0.00 H ATOM 80047 H2 WAT 7592 120.238 81.660 60.500 1.00 0.00 H TER 80049 WAT 7592 ATOM 80049 O WAT 7593 97.571 124.512 13.624 1.00 0.00 O ATOM 80050 H1 WAT 7593 97.005 123.740 13.592 1.00 0.00 H ATOM 80051 H2 WAT 7593 98.434 124.187 13.366 1.00 0.00 H TER 80053 WAT 7593 ATOM 80053 O WAT 7594 79.237 31.681 75.901 1.00 0.00 O ATOM 80054 H1 WAT 7594 79.653 32.468 75.548 1.00 0.00 H ATOM 80055 H2 WAT 7594 78.490 31.526 75.324 1.00 0.00 H TER 80057 WAT 7594 ATOM 80057 O WAT 7595 53.305 137.697 15.778 1.00 0.00 O ATOM 80058 H1 WAT 7595 53.802 138.254 16.377 1.00 0.00 H ATOM 80059 H2 WAT 7595 53.245 138.208 14.970 1.00 0.00 H TER 80061 WAT 7595 ATOM 80061 O WAT 7596 95.420 63.891 121.287 1.00 0.00 O ATOM 80062 H1 WAT 7596 95.420 63.616 122.204 1.00 0.00 H ATOM 80063 H2 WAT 7596 96.116 64.546 121.233 1.00 0.00 H TER 80065 WAT 7596 ATOM 80065 O WAT 7597 32.592 63.104 6.019 1.00 0.00 O ATOM 80066 H1 WAT 7597 33.457 62.876 5.679 1.00 0.00 H ATOM 80067 H2 WAT 7597 32.452 62.497 6.746 1.00 0.00 H TER 80069 WAT 7597 ATOM 80069 O WAT 7598 92.836 27.620 86.140 1.00 0.00 O ATOM 80070 H1 WAT 7598 92.631 28.166 85.381 1.00 0.00 H ATOM 80071 H2 WAT 7598 93.626 28.013 86.511 1.00 0.00 H TER 80073 WAT 7598 ATOM 80073 O WAT 7599 97.663 95.818 15.487 1.00 0.00 O ATOM 80074 H1 WAT 7599 97.215 95.057 15.117 1.00 0.00 H ATOM 80075 H2 WAT 7599 98.046 95.497 16.303 1.00 0.00 H TER 80077 WAT 7599 ATOM 80077 O WAT 7600 73.759 105.039 102.700 1.00 0.00 O ATOM 80078 H1 WAT 7600 73.397 104.367 102.122 1.00 0.00 H ATOM 80079 H2 WAT 7600 74.607 105.255 102.314 1.00 0.00 H TER 80081 WAT 7600 ATOM 80081 O WAT 7601 120.826 122.852 115.781 1.00 0.00 O ATOM 80082 H1 WAT 7601 121.037 122.074 115.265 1.00 0.00 H ATOM 80083 H2 WAT 7601 119.939 123.088 115.508 1.00 0.00 H TER 80085 WAT 7601 ATOM 80085 O WAT 7602 41.598 53.159 142.473 1.00 0.00 O ATOM 80086 H1 WAT 7602 42.197 53.423 143.171 1.00 0.00 H ATOM 80087 H2 WAT 7602 42.148 53.110 141.691 1.00 0.00 H TER 80089 WAT 7602 ATOM 80089 O WAT 7603 11.739 35.021 68.767 1.00 0.00 O ATOM 80090 H1 WAT 7603 11.977 35.230 67.864 1.00 0.00 H ATOM 80091 H2 WAT 7603 12.332 35.550 69.300 1.00 0.00 H TER 80093 WAT 7603 ATOM 80093 O WAT 7604 11.829 54.340 114.970 1.00 0.00 O ATOM 80094 H1 WAT 7604 12.405 54.841 114.393 1.00 0.00 H ATOM 80095 H2 WAT 7604 12.200 54.462 115.844 1.00 0.00 H TER 80097 WAT 7604 ATOM 80097 O WAT 7605 27.842 76.783 112.467 1.00 0.00 O ATOM 80098 H1 WAT 7605 28.019 76.696 113.404 1.00 0.00 H ATOM 80099 H2 WAT 7605 27.522 77.679 112.366 1.00 0.00 H TER 80101 WAT 7605 ATOM 80101 O WAT 7606 40.220 116.696 118.418 1.00 0.00 O ATOM 80102 H1 WAT 7606 40.813 116.000 118.702 1.00 0.00 H ATOM 80103 H2 WAT 7606 40.429 116.827 117.494 1.00 0.00 H TER 80105 WAT 7606 ATOM 80105 O WAT 7607 88.134 45.613 117.967 1.00 0.00 O ATOM 80106 H1 WAT 7607 88.655 46.195 117.414 1.00 0.00 H ATOM 80107 H2 WAT 7607 87.227 45.816 117.740 1.00 0.00 H TER 80109 WAT 7607 ATOM 80109 O WAT 7608 113.064 89.358 67.080 1.00 0.00 O ATOM 80110 H1 WAT 7608 113.752 88.871 66.626 1.00 0.00 H ATOM 80111 H2 WAT 7608 112.265 88.859 66.908 1.00 0.00 H TER 80113 WAT 7608 ATOM 80113 O WAT 7609 12.521 53.386 111.240 1.00 0.00 O ATOM 80114 H1 WAT 7609 12.106 52.793 111.867 1.00 0.00 H ATOM 80115 H2 WAT 7609 12.763 54.152 111.759 1.00 0.00 H TER 80117 WAT 7609 ATOM 80117 O WAT 7610 126.853 17.895 58.007 1.00 0.00 O ATOM 80118 H1 WAT 7610 127.620 17.965 57.439 1.00 0.00 H ATOM 80119 H2 WAT 7610 126.175 17.514 57.449 1.00 0.00 H TER 80121 WAT 7610 ATOM 80121 O WAT 7611 57.080 103.017 109.751 1.00 0.00 O ATOM 80122 H1 WAT 7611 56.459 103.734 109.626 1.00 0.00 H ATOM 80123 H2 WAT 7611 57.789 103.401 110.266 1.00 0.00 H TER 80125 WAT 7611 ATOM 80125 O WAT 7612 126.281 136.718 88.558 1.00 0.00 O ATOM 80126 H1 WAT 7612 126.101 135.818 88.829 1.00 0.00 H ATOM 80127 H2 WAT 7612 126.707 136.631 87.705 1.00 0.00 H TER 80129 WAT 7612 ATOM 80129 O WAT 7613 29.558 109.934 158.627 1.00 0.00 O ATOM 80130 H1 WAT 7613 29.161 110.805 158.649 1.00 0.00 H ATOM 80131 H2 WAT 7613 30.473 110.082 158.865 1.00 0.00 H TER 80133 WAT 7613 ATOM 80133 O WAT 7614 60.952 31.257 18.255 1.00 0.00 O ATOM 80134 H1 WAT 7614 60.591 30.435 18.588 1.00 0.00 H ATOM 80135 H2 WAT 7614 60.896 31.860 18.996 1.00 0.00 H TER 80137 WAT 7614 ATOM 80137 O WAT 7615 5.924 5.097 142.811 1.00 0.00 O ATOM 80138 H1 WAT 7615 5.791 5.988 142.489 1.00 0.00 H ATOM 80139 H2 WAT 7615 6.171 4.596 142.034 1.00 0.00 H TER 80141 WAT 7615 ATOM 80141 O WAT 7616 20.430 102.297 92.810 1.00 0.00 O ATOM 80142 H1 WAT 7616 19.604 101.922 93.117 1.00 0.00 H ATOM 80143 H2 WAT 7616 20.196 103.172 92.501 1.00 0.00 H TER 80145 WAT 7616 ATOM 80145 O WAT 7617 75.128 78.630 9.789 1.00 0.00 O ATOM 80146 H1 WAT 7617 75.617 79.144 9.146 1.00 0.00 H ATOM 80147 H2 WAT 7617 75.286 77.720 9.539 1.00 0.00 H TER 80149 WAT 7617 ATOM 80149 O WAT 7618 51.670 47.821 107.994 1.00 0.00 O ATOM 80150 H1 WAT 7618 51.131 47.314 107.386 1.00 0.00 H ATOM 80151 H2 WAT 7618 51.325 47.603 108.859 1.00 0.00 H TER 80153 WAT 7618 ATOM 80153 O WAT 7619 11.593 77.719 5.169 1.00 0.00 O ATOM 80154 H1 WAT 7619 11.619 77.011 5.813 1.00 0.00 H ATOM 80155 H2 WAT 7619 12.030 78.453 5.601 1.00 0.00 H TER 80157 WAT 7619 ATOM 80157 O WAT 7620 40.363 112.968 117.751 1.00 0.00 O ATOM 80158 H1 WAT 7620 39.549 113.347 118.082 1.00 0.00 H ATOM 80159 H2 WAT 7620 40.087 112.400 117.032 1.00 0.00 H TER 80161 WAT 7620 ATOM 80161 O WAT 7621 92.814 44.986 121.866 1.00 0.00 O ATOM 80162 H1 WAT 7621 92.190 45.273 122.533 1.00 0.00 H ATOM 80163 H2 WAT 7621 92.785 44.030 121.907 1.00 0.00 H TER 80165 WAT 7621 ATOM 80165 O WAT 7622 3.269 93.510 12.796 1.00 0.00 O ATOM 80166 H1 WAT 7622 3.323 92.915 13.544 1.00 0.00 H ATOM 80167 H2 WAT 7622 3.830 93.109 12.131 1.00 0.00 H TER 80169 WAT 7622 ATOM 80169 O WAT 7623 141.936 12.861 141.633 1.00 0.00 O ATOM 80170 H1 WAT 7623 141.901 13.200 142.528 1.00 0.00 H ATOM 80171 H2 WAT 7623 142.602 13.396 141.201 1.00 0.00 H TER 80173 WAT 7623 ATOM 80173 O WAT 7624 56.468 103.536 153.464 1.00 0.00 O ATOM 80174 H1 WAT 7624 57.246 102.979 153.489 1.00 0.00 H ATOM 80175 H2 WAT 7624 56.539 104.081 154.248 1.00 0.00 H TER 80177 WAT 7624 ATOM 80177 O WAT 7625 60.205 136.649 81.269 1.00 0.00 O ATOM 80178 H1 WAT 7625 60.585 137.475 81.567 1.00 0.00 H ATOM 80179 H2 WAT 7625 60.291 136.061 82.018 1.00 0.00 H TER 80181 WAT 7625 ATOM 80181 O WAT 7626 77.606 2.794 111.217 1.00 0.00 O ATOM 80182 H1 WAT 7626 77.974 1.971 110.897 1.00 0.00 H ATOM 80183 H2 WAT 7626 78.344 3.403 111.219 1.00 0.00 H TER 80185 WAT 7626 ATOM 80185 O WAT 7627 3.861 121.863 112.537 1.00 0.00 O ATOM 80186 H1 WAT 7627 3.706 121.024 112.102 1.00 0.00 H ATOM 80187 H2 WAT 7627 4.797 121.858 112.741 1.00 0.00 H TER 80189 WAT 7627 ATOM 80189 O WAT 7628 89.551 47.150 109.688 1.00 0.00 O ATOM 80190 H1 WAT 7628 88.809 46.671 110.056 1.00 0.00 H ATOM 80191 H2 WAT 7628 89.202 47.560 108.897 1.00 0.00 H TER 80193 WAT 7628 ATOM 80193 O WAT 7629 58.311 49.174 151.542 1.00 0.00 O ATOM 80194 H1 WAT 7629 58.115 48.952 152.453 1.00 0.00 H ATOM 80195 H2 WAT 7629 58.822 48.431 151.220 1.00 0.00 H TER 80197 WAT 7629 ATOM 80197 O WAT 7630 138.234 105.528 15.167 1.00 0.00 O ATOM 80198 H1 WAT 7630 138.582 104.833 14.608 1.00 0.00 H ATOM 80199 H2 WAT 7630 138.089 105.105 16.013 1.00 0.00 H TER 80201 WAT 7630 ATOM 80201 O WAT 7631 143.152 125.750 100.650 1.00 0.00 O ATOM 80202 H1 WAT 7631 143.387 125.165 99.930 1.00 0.00 H ATOM 80203 H2 WAT 7631 143.973 125.888 101.124 1.00 0.00 H TER 80205 WAT 7631 ATOM 80205 O WAT 7632 100.719 116.853 88.302 1.00 0.00 O ATOM 80206 H1 WAT 7632 100.109 116.209 87.944 1.00 0.00 H ATOM 80207 H2 WAT 7632 101.508 116.349 88.504 1.00 0.00 H TER 80209 WAT 7632 ATOM 80209 O WAT 7633 76.620 136.909 22.842 1.00 0.00 O ATOM 80210 H1 WAT 7633 75.904 137.382 23.266 1.00 0.00 H ATOM 80211 H2 WAT 7633 76.191 136.191 22.377 1.00 0.00 H TER 80213 WAT 7633 ATOM 80213 O WAT 7634 117.876 79.035 4.963 1.00 0.00 O ATOM 80214 H1 WAT 7634 118.083 79.053 4.029 1.00 0.00 H ATOM 80215 H2 WAT 7634 118.152 79.892 5.286 1.00 0.00 H TER 80217 WAT 7634 ATOM 80217 O WAT 7635 77.611 132.028 64.159 1.00 0.00 O ATOM 80218 H1 WAT 7635 78.191 132.769 63.979 1.00 0.00 H ATOM 80219 H2 WAT 7635 77.638 131.503 63.360 1.00 0.00 H TER 80221 WAT 7635 ATOM 80221 O WAT 7636 99.579 16.748 132.645 1.00 0.00 O ATOM 80222 H1 WAT 7636 99.858 17.200 133.441 1.00 0.00 H ATOM 80223 H2 WAT 7636 99.083 17.407 132.158 1.00 0.00 H TER 80225 WAT 7636 ATOM 80225 O WAT 7637 6.026 33.481 81.874 1.00 0.00 O ATOM 80226 H1 WAT 7637 6.414 34.313 82.145 1.00 0.00 H ATOM 80227 H2 WAT 7637 5.804 33.609 80.952 1.00 0.00 H TER 80229 WAT 7637 ATOM 80229 O WAT 7638 34.013 114.291 70.603 1.00 0.00 O ATOM 80230 H1 WAT 7638 33.622 113.867 69.839 1.00 0.00 H ATOM 80231 H2 WAT 7638 33.684 115.189 70.573 1.00 0.00 H TER 80233 WAT 7638 ATOM 80233 O WAT 7639 66.536 69.853 118.631 1.00 0.00 O ATOM 80234 H1 WAT 7639 65.781 69.265 118.618 1.00 0.00 H ATOM 80235 H2 WAT 7639 67.157 69.431 119.224 1.00 0.00 H TER 80237 WAT 7639 ATOM 80237 O WAT 7640 144.199 41.309 79.767 1.00 0.00 O ATOM 80238 H1 WAT 7640 144.922 41.935 79.752 1.00 0.00 H ATOM 80239 H2 WAT 7640 143.627 41.620 80.469 1.00 0.00 H TER 80241 WAT 7640 ATOM 80241 O WAT 7641 43.268 136.734 80.272 1.00 0.00 O ATOM 80242 H1 WAT 7641 44.108 137.126 80.512 1.00 0.00 H ATOM 80243 H2 WAT 7641 42.992 136.261 81.057 1.00 0.00 H TER 80245 WAT 7641 ATOM 80245 O WAT 7642 17.778 98.123 149.287 1.00 0.00 O ATOM 80246 H1 WAT 7642 18.024 97.715 150.117 1.00 0.00 H ATOM 80247 H2 WAT 7642 18.362 97.725 148.642 1.00 0.00 H TER 80249 WAT 7642 ATOM 80249 O WAT 7643 16.999 83.965 85.710 1.00 0.00 O ATOM 80250 H1 WAT 7643 17.874 83.616 85.538 1.00 0.00 H ATOM 80251 H2 WAT 7643 16.704 83.494 86.490 1.00 0.00 H TER 80253 WAT 7643 ATOM 80253 O WAT 7644 3.819 41.895 7.654 1.00 0.00 O ATOM 80254 H1 WAT 7644 3.392 41.202 8.159 1.00 0.00 H ATOM 80255 H2 WAT 7644 3.631 41.676 6.742 1.00 0.00 H TER 80257 WAT 7644 ATOM 80257 O WAT 7645 29.901 21.956 100.021 1.00 0.00 O ATOM 80258 H1 WAT 7645 30.529 21.234 100.019 1.00 0.00 H ATOM 80259 H2 WAT 7645 30.424 22.729 99.812 1.00 0.00 H TER 80261 WAT 7645 ATOM 80261 O WAT 7646 133.316 10.522 105.833 1.00 0.00 O ATOM 80262 H1 WAT 7646 132.826 10.154 106.569 1.00 0.00 H ATOM 80263 H2 WAT 7646 133.097 11.454 105.841 1.00 0.00 H TER 80265 WAT 7646 ATOM 80265 O WAT 7647 140.510 16.020 7.343 1.00 0.00 O ATOM 80266 H1 WAT 7647 140.417 15.607 8.202 1.00 0.00 H ATOM 80267 H2 WAT 7647 140.098 15.405 6.736 1.00 0.00 H TER 80269 WAT 7647 ATOM 80269 O WAT 7648 114.985 24.887 2.135 1.00 0.00 O ATOM 80270 H1 WAT 7648 115.374 25.532 1.545 1.00 0.00 H ATOM 80271 H2 WAT 7648 114.305 25.370 2.603 1.00 0.00 H TER 80273 WAT 7648 ATOM 80273 O WAT 7649 125.085 117.348 11.523 1.00 0.00 O ATOM 80274 H1 WAT 7649 124.763 118.240 11.656 1.00 0.00 H ATOM 80275 H2 WAT 7649 125.103 117.240 10.572 1.00 0.00 H TER 80277 WAT 7649 ATOM 80277 O WAT 7650 80.755 62.434 120.831 1.00 0.00 O ATOM 80278 H1 WAT 7650 81.673 62.165 120.839 1.00 0.00 H ATOM 80279 H2 WAT 7650 80.747 63.244 120.321 1.00 0.00 H TER 80281 WAT 7650 ATOM 80281 O WAT 7651 138.720 121.774 87.696 1.00 0.00 O ATOM 80282 H1 WAT 7651 139.008 121.396 88.527 1.00 0.00 H ATOM 80283 H2 WAT 7651 139.219 121.300 87.031 1.00 0.00 H TER 80285 WAT 7651 ATOM 80285 O WAT 7652 26.712 25.110 144.768 1.00 0.00 O ATOM 80286 H1 WAT 7652 25.917 25.636 144.852 1.00 0.00 H ATOM 80287 H2 WAT 7652 27.337 25.523 145.364 1.00 0.00 H TER 80289 WAT 7652 ATOM 80289 O WAT 7653 24.687 69.210 151.918 1.00 0.00 O ATOM 80290 H1 WAT 7653 24.537 68.758 152.749 1.00 0.00 H ATOM 80291 H2 WAT 7653 25.341 69.878 152.124 1.00 0.00 H TER 80293 WAT 7653 ATOM 80293 O WAT 7654 68.886 19.613 149.962 1.00 0.00 O ATOM 80294 H1 WAT 7654 69.777 19.413 150.249 1.00 0.00 H ATOM 80295 H2 WAT 7654 68.942 19.635 149.006 1.00 0.00 H TER 80297 WAT 7654 ATOM 80297 O WAT 7655 87.409 20.078 71.392 1.00 0.00 O ATOM 80298 H1 WAT 7655 87.781 20.957 71.325 1.00 0.00 H ATOM 80299 H2 WAT 7655 86.476 20.224 71.547 1.00 0.00 H TER 80301 WAT 7655 ATOM 80301 O WAT 7656 84.781 88.649 0.227 1.00 0.00 O ATOM 80302 H1 WAT 7656 85.209 89.505 0.212 1.00 0.00 H ATOM 80303 H2 WAT 7656 84.283 88.645 1.044 1.00 0.00 H TER 80305 WAT 7656 ATOM 80305 O WAT 7657 68.682 105.792 3.570 1.00 0.00 O ATOM 80306 H1 WAT 7657 67.745 105.604 3.518 1.00 0.00 H ATOM 80307 H2 WAT 7657 69.053 105.032 4.019 1.00 0.00 H TER 80309 WAT 7657 ATOM 80309 O WAT 7658 123.089 33.099 12.340 1.00 0.00 O ATOM 80310 H1 WAT 7658 123.411 32.844 11.475 1.00 0.00 H ATOM 80311 H2 WAT 7658 123.809 32.890 12.935 1.00 0.00 H TER 80313 WAT 7658 ATOM 80313 O WAT 7659 108.799 135.763 53.503 1.00 0.00 O ATOM 80314 H1 WAT 7659 107.858 135.702 53.670 1.00 0.00 H ATOM 80315 H2 WAT 7659 109.083 136.524 54.009 1.00 0.00 H TER 80317 WAT 7659 ATOM 80317 O WAT 7660 124.339 104.955 134.030 1.00 0.00 O ATOM 80318 H1 WAT 7660 124.264 105.882 133.802 1.00 0.00 H ATOM 80319 H2 WAT 7660 125.281 104.792 134.061 1.00 0.00 H TER 80321 WAT 7660 ATOM 80321 O WAT 7661 63.838 58.530 70.412 1.00 0.00 O ATOM 80322 H1 WAT 7661 63.934 58.264 69.497 1.00 0.00 H ATOM 80323 H2 WAT 7661 64.555 58.087 70.866 1.00 0.00 H TER 80325 WAT 7661 ATOM 80325 O WAT 7662 136.060 83.785 155.833 1.00 0.00 O ATOM 80326 H1 WAT 7662 135.477 83.995 156.562 1.00 0.00 H ATOM 80327 H2 WAT 7662 136.936 83.992 156.159 1.00 0.00 H TER 80329 WAT 7662 ATOM 80329 O WAT 7663 85.919 83.001 109.721 1.00 0.00 O ATOM 80330 H1 WAT 7663 85.512 83.255 110.550 1.00 0.00 H ATOM 80331 H2 WAT 7663 85.267 83.222 109.056 1.00 0.00 H TER 80333 WAT 7663 ATOM 80333 O WAT 7664 118.668 8.526 149.891 1.00 0.00 O ATOM 80334 H1 WAT 7664 118.667 9.378 150.329 1.00 0.00 H ATOM 80335 H2 WAT 7664 117.782 8.189 150.021 1.00 0.00 H TER 80337 WAT 7664 ATOM 80337 O WAT 7665 85.900 62.213 22.544 1.00 0.00 O ATOM 80338 H1 WAT 7665 86.762 61.798 22.558 1.00 0.00 H ATOM 80339 H2 WAT 7665 86.054 63.097 22.880 1.00 0.00 H TER 80341 WAT 7665 ATOM 80341 O WAT 7666 111.015 76.060 118.676 1.00 0.00 O ATOM 80342 H1 WAT 7666 111.818 75.543 118.737 1.00 0.00 H ATOM 80343 H2 WAT 7666 110.548 75.691 117.927 1.00 0.00 H TER 80345 WAT 7666 ATOM 80345 O WAT 7667 55.309 72.287 106.053 1.00 0.00 O ATOM 80346 H1 WAT 7667 54.446 72.280 106.467 1.00 0.00 H ATOM 80347 H2 WAT 7667 55.919 72.112 106.769 1.00 0.00 H TER 80349 WAT 7667 ATOM 80349 O WAT 7668 132.644 72.096 19.323 1.00 0.00 O ATOM 80350 H1 WAT 7668 132.208 71.244 19.317 1.00 0.00 H ATOM 80351 H2 WAT 7668 133.054 72.161 18.461 1.00 0.00 H TER 80353 WAT 7668 ATOM 80353 O WAT 7669 74.354 42.966 139.169 1.00 0.00 O ATOM 80354 H1 WAT 7669 73.750 42.270 139.427 1.00 0.00 H ATOM 80355 H2 WAT 7669 74.997 42.530 138.610 1.00 0.00 H TER 80357 WAT 7669 ATOM 80357 O WAT 7670 28.221 77.169 115.303 1.00 0.00 O ATOM 80358 H1 WAT 7670 27.780 77.993 115.512 1.00 0.00 H ATOM 80359 H2 WAT 7670 29.136 77.415 115.169 1.00 0.00 H TER 80361 WAT 7670 ATOM 80361 O WAT 7671 80.433 74.102 117.253 1.00 0.00 O ATOM 80362 H1 WAT 7671 80.818 74.939 117.512 1.00 0.00 H ATOM 80363 H2 WAT 7671 80.121 74.249 116.360 1.00 0.00 H TER 80365 WAT 7671 ATOM 80365 O WAT 7672 80.563 119.647 153.165 1.00 0.00 O ATOM 80366 H1 WAT 7672 80.166 119.927 153.989 1.00 0.00 H ATOM 80367 H2 WAT 7672 80.604 118.693 153.229 1.00 0.00 H TER 80369 WAT 7672 ATOM 80369 O WAT 7673 48.809 87.758 11.634 1.00 0.00 O ATOM 80370 H1 WAT 7673 47.983 88.234 11.714 1.00 0.00 H ATOM 80371 H2 WAT 7673 49.022 87.495 12.529 1.00 0.00 H TER 80373 WAT 7673 ATOM 80373 O WAT 7674 55.618 30.692 111.732 1.00 0.00 O ATOM 80374 H1 WAT 7674 55.903 31.544 111.402 1.00 0.00 H ATOM 80375 H2 WAT 7674 56.419 30.283 112.062 1.00 0.00 H TER 80377 WAT 7674 ATOM 80377 O WAT 7675 126.436 141.145 125.400 1.00 0.00 O ATOM 80378 H1 WAT 7675 126.987 141.694 124.841 1.00 0.00 H ATOM 80379 H2 WAT 7675 125.744 141.731 125.704 1.00 0.00 H TER 80381 WAT 7675 ATOM 80381 O WAT 7676 79.042 25.640 155.107 1.00 0.00 O ATOM 80382 H1 WAT 7676 78.301 25.111 155.402 1.00 0.00 H ATOM 80383 H2 WAT 7676 79.673 25.590 155.825 1.00 0.00 H TER 80385 WAT 7676 ATOM 80385 O WAT 7677 47.856 121.714 75.843 1.00 0.00 O ATOM 80386 H1 WAT 7677 47.356 122.158 76.527 1.00 0.00 H ATOM 80387 H2 WAT 7677 47.495 120.828 75.818 1.00 0.00 H TER 80389 WAT 7677 ATOM 80389 O WAT 7678 117.506 28.946 144.715 1.00 0.00 O ATOM 80390 H1 WAT 7678 118.292 29.488 144.787 1.00 0.00 H ATOM 80391 H2 WAT 7678 117.200 29.086 143.819 1.00 0.00 H TER 80393 WAT 7678 ATOM 80393 O WAT 7679 113.736 27.628 125.149 1.00 0.00 O ATOM 80394 H1 WAT 7679 114.088 27.511 124.267 1.00 0.00 H ATOM 80395 H2 WAT 7679 113.400 26.764 125.390 1.00 0.00 H TER 80397 WAT 7679 ATOM 80397 O WAT 7680 48.669 70.883 3.654 1.00 0.00 O ATOM 80398 H1 WAT 7680 48.498 70.615 2.751 1.00 0.00 H ATOM 80399 H2 WAT 7680 48.640 70.069 4.156 1.00 0.00 H TER 80401 WAT 7680 ATOM 80401 O WAT 7681 136.211 51.937 106.923 1.00 0.00 O ATOM 80402 H1 WAT 7681 137.145 51.962 106.711 1.00 0.00 H ATOM 80403 H2 WAT 7681 136.172 51.532 107.789 1.00 0.00 H TER 80405 WAT 7681 ATOM 80405 O WAT 7682 85.071 34.573 63.055 1.00 0.00 O ATOM 80406 H1 WAT 7682 84.368 35.150 63.354 1.00 0.00 H ATOM 80407 H2 WAT 7682 85.509 35.068 62.363 1.00 0.00 H TER 80409 WAT 7682 ATOM 80409 O WAT 7683 105.188 10.646 20.473 1.00 0.00 O ATOM 80410 H1 WAT 7683 104.761 10.696 21.328 1.00 0.00 H ATOM 80411 H2 WAT 7683 104.785 9.889 20.048 1.00 0.00 H TER 80413 WAT 7683 ATOM 80413 O WAT 7684 6.896 48.730 71.761 1.00 0.00 O ATOM 80414 H1 WAT 7684 7.151 47.807 71.768 1.00 0.00 H ATOM 80415 H2 WAT 7684 6.335 48.829 72.530 1.00 0.00 H TER 80417 WAT 7684 ATOM 80417 O WAT 7685 19.163 97.714 154.588 1.00 0.00 O ATOM 80418 H1 WAT 7685 19.519 98.136 153.806 1.00 0.00 H ATOM 80419 H2 WAT 7685 18.289 97.425 154.328 1.00 0.00 H TER 80421 WAT 7685 ATOM 80421 O WAT 7686 71.931 123.446 71.335 1.00 0.00 O ATOM 80422 H1 WAT 7686 72.179 122.523 71.285 1.00 0.00 H ATOM 80423 H2 WAT 7686 72.762 123.920 71.287 1.00 0.00 H TER 80425 WAT 7686 ATOM 80425 O WAT 7687 110.955 143.341 121.207 1.00 0.00 O ATOM 80426 H1 WAT 7687 111.843 143.376 121.562 1.00 0.00 H ATOM 80427 H2 WAT 7687 110.602 142.510 121.526 1.00 0.00 H TER 80429 WAT 7687 ATOM 80429 O WAT 7688 54.470 14.398 102.546 1.00 0.00 O ATOM 80430 H1 WAT 7688 55.183 13.765 102.632 1.00 0.00 H ATOM 80431 H2 WAT 7688 54.252 14.387 101.614 1.00 0.00 H TER 80433 WAT 7688 ATOM 80433 O WAT 7689 113.685 40.924 113.678 1.00 0.00 O ATOM 80434 H1 WAT 7689 114.319 40.411 114.180 1.00 0.00 H ATOM 80435 H2 WAT 7689 114.201 41.632 113.292 1.00 0.00 H TER 80437 WAT 7689 ATOM 80437 O WAT 7690 110.429 61.944 126.177 1.00 0.00 O ATOM 80438 H1 WAT 7690 109.856 62.588 125.760 1.00 0.00 H ATOM 80439 H2 WAT 7690 110.940 61.576 125.456 1.00 0.00 H TER 80441 WAT 7690 ATOM 80441 O WAT 7691 7.222 0.160 118.674 1.00 0.00 O ATOM 80442 H1 WAT 7691 7.469 1.083 118.615 1.00 0.00 H ATOM 80443 H2 WAT 7691 6.680 0.007 117.900 1.00 0.00 H TER 80445 WAT 7691 ATOM 80445 O WAT 7692 134.627 41.138 58.732 1.00 0.00 O ATOM 80446 H1 WAT 7692 135.528 41.456 58.681 1.00 0.00 H ATOM 80447 H2 WAT 7692 134.091 41.929 58.683 1.00 0.00 H TER 80449 WAT 7692 ATOM 80449 O WAT 7693 35.088 25.293 6.362 1.00 0.00 O ATOM 80450 H1 WAT 7693 34.197 24.948 6.299 1.00 0.00 H ATOM 80451 H2 WAT 7693 34.971 26.216 6.591 1.00 0.00 H TER 80453 WAT 7693 ATOM 80453 O WAT 7694 143.784 139.642 19.815 1.00 0.00 O ATOM 80454 H1 WAT 7694 143.468 140.364 19.273 1.00 0.00 H ATOM 80455 H2 WAT 7694 142.999 139.306 20.248 1.00 0.00 H TER 80457 WAT 7694 ATOM 80457 O WAT 7695 33.000 80.715 110.558 1.00 0.00 O ATOM 80458 H1 WAT 7695 32.631 80.606 111.435 1.00 0.00 H ATOM 80459 H2 WAT 7695 33.534 79.933 110.424 1.00 0.00 H TER 80461 WAT 7695 ATOM 80461 O WAT 7696 81.943 129.240 60.041 1.00 0.00 O ATOM 80462 H1 WAT 7696 81.425 129.696 59.378 1.00 0.00 H ATOM 80463 H2 WAT 7696 81.518 128.387 60.131 1.00 0.00 H TER 80465 WAT 7696 ATOM 80465 O WAT 7697 25.113 23.337 24.158 1.00 0.00 O ATOM 80466 H1 WAT 7697 25.885 23.069 24.658 1.00 0.00 H ATOM 80467 H2 WAT 7697 24.912 22.583 23.604 1.00 0.00 H TER 80469 WAT 7697 ATOM 80469 O WAT 7698 123.763 54.190 11.253 1.00 0.00 O ATOM 80470 H1 WAT 7698 124.263 54.341 10.451 1.00 0.00 H ATOM 80471 H2 WAT 7698 123.272 53.386 11.081 1.00 0.00 H TER 80473 WAT 7698 ATOM 80473 O WAT 7699 5.030 126.835 79.704 1.00 0.00 O ATOM 80474 H1 WAT 7699 4.548 126.373 80.390 1.00 0.00 H ATOM 80475 H2 WAT 7699 4.445 127.544 79.437 1.00 0.00 H TER 80477 WAT 7699 ATOM 80477 O WAT 7700 4.662 136.177 6.905 1.00 0.00 O ATOM 80478 H1 WAT 7700 4.249 136.881 7.404 1.00 0.00 H ATOM 80479 H2 WAT 7700 4.255 136.226 6.039 1.00 0.00 H TER 80481 WAT 7700 ATOM 80481 O WAT 7701 119.279 100.702 128.576 1.00 0.00 O ATOM 80482 H1 WAT 7701 118.793 101.447 128.221 1.00 0.00 H ATOM 80483 H2 WAT 7701 120.127 101.067 128.827 1.00 0.00 H TER 80485 WAT 7701 ATOM 80485 O WAT 7702 96.835 16.753 122.964 1.00 0.00 O ATOM 80486 H1 WAT 7702 96.874 17.435 123.634 1.00 0.00 H ATOM 80487 H2 WAT 7702 97.650 16.263 123.073 1.00 0.00 H TER 80489 WAT 7702 ATOM 80489 O WAT 7703 109.053 94.629 64.746 1.00 0.00 O ATOM 80490 H1 WAT 7703 108.610 95.429 65.029 1.00 0.00 H ATOM 80491 H2 WAT 7703 108.459 94.240 64.104 1.00 0.00 H TER 80493 WAT 7703 ATOM 80493 O WAT 7704 18.285 116.814 147.786 1.00 0.00 O ATOM 80494 H1 WAT 7704 18.062 117.698 147.495 1.00 0.00 H ATOM 80495 H2 WAT 7704 18.831 116.460 147.084 1.00 0.00 H TER 80497 WAT 7704 ATOM 80497 O WAT 7705 132.175 66.828 23.024 1.00 0.00 O ATOM 80498 H1 WAT 7705 132.373 65.994 22.599 1.00 0.00 H ATOM 80499 H2 WAT 7705 131.709 66.585 23.824 1.00 0.00 H TER 80501 WAT 7705 ATOM 80501 O WAT 7706 7.421 64.131 79.008 1.00 0.00 O ATOM 80502 H1 WAT 7706 7.708 64.907 79.490 1.00 0.00 H ATOM 80503 H2 WAT 7706 7.458 63.422 79.650 1.00 0.00 H TER 80505 WAT 7706 ATOM 80505 O WAT 7707 57.944 6.959 121.326 1.00 0.00 O ATOM 80506 H1 WAT 7707 58.688 6.580 120.858 1.00 0.00 H ATOM 80507 H2 WAT 7707 57.399 7.342 120.639 1.00 0.00 H TER 80509 WAT 7707 ATOM 80509 O WAT 7708 83.580 58.444 13.831 1.00 0.00 O ATOM 80510 H1 WAT 7708 83.911 57.862 13.147 1.00 0.00 H ATOM 80511 H2 WAT 7708 84.342 58.624 14.382 1.00 0.00 H TER 80513 WAT 7708 ATOM 80513 O WAT 7709 137.780 42.058 92.404 1.00 0.00 O ATOM 80514 H1 WAT 7709 138.303 42.705 91.930 1.00 0.00 H ATOM 80515 H2 WAT 7709 137.146 41.744 91.759 1.00 0.00 H TER 80517 WAT 7709 ATOM 80517 O WAT 7710 34.029 33.127 64.895 1.00 0.00 O ATOM 80518 H1 WAT 7710 34.165 34.034 65.170 1.00 0.00 H ATOM 80519 H2 WAT 7710 34.439 33.075 64.032 1.00 0.00 H TER 80521 WAT 7710 ATOM 80521 O WAT 7711 131.449 122.336 92.111 1.00 0.00 O ATOM 80522 H1 WAT 7711 132.287 122.249 92.566 1.00 0.00 H ATOM 80523 H2 WAT 7711 131.381 123.270 91.912 1.00 0.00 H TER 80525 WAT 7711 ATOM 80525 O WAT 7712 39.106 23.582 118.917 1.00 0.00 O ATOM 80526 H1 WAT 7712 39.365 24.204 119.598 1.00 0.00 H ATOM 80527 H2 WAT 7712 39.577 23.873 118.136 1.00 0.00 H TER 80529 WAT 7712 ATOM 80529 O WAT 7713 121.354 143.796 70.433 1.00 0.00 O ATOM 80530 H1 WAT 7713 121.563 143.901 69.504 1.00 0.00 H ATOM 80531 H2 WAT 7713 121.370 144.686 70.784 1.00 0.00 H TER 80533 WAT 7713 ATOM 80533 O WAT 7714 33.708 96.639 120.712 1.00 0.00 O ATOM 80534 H1 WAT 7714 33.232 97.393 120.364 1.00 0.00 H ATOM 80535 H2 WAT 7714 33.473 96.615 121.639 1.00 0.00 H TER 80537 WAT 7714 ATOM 80537 O WAT 7715 114.122 135.360 60.913 1.00 0.00 O ATOM 80538 H1 WAT 7715 114.060 136.312 60.983 1.00 0.00 H ATOM 80539 H2 WAT 7715 115.004 135.202 60.573 1.00 0.00 H TER 80541 WAT 7715 ATOM 80541 O WAT 7716 106.054 124.472 122.863 1.00 0.00 O ATOM 80542 H1 WAT 7716 105.330 124.735 123.431 1.00 0.00 H ATOM 80543 H2 WAT 7716 106.158 123.534 123.026 1.00 0.00 H TER 80545 WAT 7716 ATOM 80545 O WAT 7717 132.862 69.464 156.412 1.00 0.00 O ATOM 80546 H1 WAT 7717 132.140 69.080 156.909 1.00 0.00 H ATOM 80547 H2 WAT 7717 133.445 68.727 156.228 1.00 0.00 H TER 80549 WAT 7717 ATOM 80549 O WAT 7718 11.903 40.422 13.026 1.00 0.00 O ATOM 80550 H1 WAT 7718 11.102 40.517 13.542 1.00 0.00 H ATOM 80551 H2 WAT 7718 12.293 41.296 13.026 1.00 0.00 H TER 80553 WAT 7718 ATOM 80553 O WAT 7719 141.557 103.596 155.512 1.00 0.00 O ATOM 80554 H1 WAT 7719 142.424 103.743 155.133 1.00 0.00 H ATOM 80555 H2 WAT 7719 141.101 104.430 155.395 1.00 0.00 H TER 80557 WAT 7719 ATOM 80557 O WAT 7720 19.766 99.302 152.139 1.00 0.00 O ATOM 80558 H1 WAT 7720 20.002 99.342 151.212 1.00 0.00 H ATOM 80559 H2 WAT 7720 20.290 99.990 152.549 1.00 0.00 H TER 80561 WAT 7720 ATOM 80561 O WAT 7721 40.678 134.490 88.894 1.00 0.00 O ATOM 80562 H1 WAT 7721 39.978 133.845 88.789 1.00 0.00 H ATOM 80563 H2 WAT 7721 40.668 134.989 88.078 1.00 0.00 H TER 80565 WAT 7721 ATOM 80565 O WAT 7722 61.947 53.389 100.566 1.00 0.00 O ATOM 80566 H1 WAT 7722 62.457 54.040 100.084 1.00 0.00 H ATOM 80567 H2 WAT 7722 61.318 53.055 99.926 1.00 0.00 H TER 80569 WAT 7722 ATOM 80569 O WAT 7723 51.346 26.269 85.972 1.00 0.00 O ATOM 80570 H1 WAT 7723 51.942 26.906 86.366 1.00 0.00 H ATOM 80571 H2 WAT 7723 51.009 26.707 85.191 1.00 0.00 H TER 80573 WAT 7723 ATOM 80573 O WAT 7724 118.977 21.636 129.212 1.00 0.00 O ATOM 80574 H1 WAT 7724 119.600 21.534 129.931 1.00 0.00 H ATOM 80575 H2 WAT 7724 119.513 21.914 128.469 1.00 0.00 H TER 80577 WAT 7724 ATOM 80577 O WAT 7725 136.953 141.500 11.838 1.00 0.00 O ATOM 80578 H1 WAT 7725 137.840 141.139 11.833 1.00 0.00 H ATOM 80579 H2 WAT 7725 136.382 140.735 11.779 1.00 0.00 H TER 80581 WAT 7725 ATOM 80581 O WAT 7726 35.475 95.462 100.004 1.00 0.00 O ATOM 80582 H1 WAT 7726 36.063 95.062 99.363 1.00 0.00 H ATOM 80583 H2 WAT 7726 35.740 95.081 100.841 1.00 0.00 H TER 80585 WAT 7726 ATOM 80585 O WAT 7727 98.706 144.912 145.004 1.00 0.00 O ATOM 80586 H1 WAT 7727 98.613 144.785 145.948 1.00 0.00 H ATOM 80587 H2 WAT 7727 99.064 145.795 144.915 1.00 0.00 H TER 80589 WAT 7727 ATOM 80589 O WAT 7728 51.907 16.729 63.668 1.00 0.00 O ATOM 80590 H1 WAT 7728 51.238 17.075 63.077 1.00 0.00 H ATOM 80591 H2 WAT 7728 52.622 17.364 63.619 1.00 0.00 H TER 80593 WAT 7728 ATOM 80593 O WAT 7729 40.633 143.515 114.396 1.00 0.00 O ATOM 80594 H1 WAT 7729 40.692 144.465 114.294 1.00 0.00 H ATOM 80595 H2 WAT 7729 41.452 143.183 114.029 1.00 0.00 H TER 80597 WAT 7729 ATOM 80597 O WAT 7730 120.125 16.801 97.235 1.00 0.00 O ATOM 80598 H1 WAT 7730 119.169 16.777 97.237 1.00 0.00 H ATOM 80599 H2 WAT 7730 120.380 16.232 97.961 1.00 0.00 H TER 80601 WAT 7730 ATOM 80601 O WAT 7731 138.952 130.348 72.037 1.00 0.00 O ATOM 80602 H1 WAT 7731 138.696 129.575 71.534 1.00 0.00 H ATOM 80603 H2 WAT 7731 138.144 130.635 72.463 1.00 0.00 H TER 80605 WAT 7731 ATOM 80605 O WAT 7732 14.814 106.138 139.921 1.00 0.00 O ATOM 80606 H1 WAT 7732 14.835 106.740 140.665 1.00 0.00 H ATOM 80607 H2 WAT 7732 13.904 105.843 139.877 1.00 0.00 H TER 80609 WAT 7732 ATOM 80609 O WAT 7733 36.538 74.667 74.888 1.00 0.00 O ATOM 80610 H1 WAT 7733 37.132 73.956 74.646 1.00 0.00 H ATOM 80611 H2 WAT 7733 36.516 74.646 75.844 1.00 0.00 H TER 80613 WAT 7733 ATOM 80613 O WAT 7734 141.943 34.379 9.879 1.00 0.00 O ATOM 80614 H1 WAT 7734 142.457 34.339 9.073 1.00 0.00 H ATOM 80615 H2 WAT 7734 141.569 35.260 9.881 1.00 0.00 H TER 80617 WAT 7734 ATOM 80617 O WAT 7735 19.386 135.292 66.971 1.00 0.00 O ATOM 80618 H1 WAT 7735 18.542 135.300 66.519 1.00 0.00 H ATOM 80619 H2 WAT 7735 19.630 134.367 67.007 1.00 0.00 H TER 80621 WAT 7735 ATOM 80621 O WAT 7736 106.522 103.847 127.510 1.00 0.00 O ATOM 80622 H1 WAT 7736 105.659 103.536 127.782 1.00 0.00 H ATOM 80623 H2 WAT 7736 106.341 104.625 126.983 1.00 0.00 H TER 80625 WAT 7736 ATOM 80625 O WAT 7737 64.981 77.200 77.498 1.00 0.00 O ATOM 80626 H1 WAT 7737 64.904 77.215 78.452 1.00 0.00 H ATOM 80627 H2 WAT 7737 64.489 76.424 77.230 1.00 0.00 H TER 80629 WAT 7737 ATOM 80629 O WAT 7738 74.424 12.688 73.638 1.00 0.00 O ATOM 80630 H1 WAT 7738 75.333 12.433 73.798 1.00 0.00 H ATOM 80631 H2 WAT 7738 74.327 12.646 72.687 1.00 0.00 H TER 80633 WAT 7738 ATOM 80633 O WAT 7739 115.922 33.164 143.102 1.00 0.00 O ATOM 80634 H1 WAT 7739 116.205 33.899 143.646 1.00 0.00 H ATOM 80635 H2 WAT 7739 115.009 33.020 143.351 1.00 0.00 H TER 80637 WAT 7739 ATOM 80637 O WAT 7740 68.809 95.638 155.178 1.00 0.00 O ATOM 80638 H1 WAT 7740 68.833 95.056 154.418 1.00 0.00 H ATOM 80639 H2 WAT 7740 69.700 95.610 155.528 1.00 0.00 H TER 80641 WAT 7740 ATOM 80641 O WAT 7741 68.040 23.940 73.207 1.00 0.00 O ATOM 80642 H1 WAT 7741 67.988 24.498 72.432 1.00 0.00 H ATOM 80643 H2 WAT 7741 68.179 23.059 72.859 1.00 0.00 H TER 80645 WAT 7741 ATOM 80645 O WAT 7742 45.127 87.768 1.157 1.00 0.00 O ATOM 80646 H1 WAT 7742 45.099 87.835 2.111 1.00 0.00 H ATOM 80647 H2 WAT 7742 45.830 88.362 0.895 1.00 0.00 H TER 80649 WAT 7742 ATOM 80649 O WAT 7743 13.232 48.725 92.125 1.00 0.00 O ATOM 80650 H1 WAT 7743 13.214 48.879 91.180 1.00 0.00 H ATOM 80651 H2 WAT 7743 13.966 49.253 92.439 1.00 0.00 H TER 80653 WAT 7743 ATOM 80653 O WAT 7744 44.797 122.153 103.111 1.00 0.00 O ATOM 80654 H1 WAT 7744 45.257 122.430 102.318 1.00 0.00 H ATOM 80655 H2 WAT 7744 45.218 121.328 103.355 1.00 0.00 H TER 80657 WAT 7744 ATOM 80657 O WAT 7745 9.484 47.544 89.169 1.00 0.00 O ATOM 80658 H1 WAT 7745 9.429 47.424 90.117 1.00 0.00 H ATOM 80659 H2 WAT 7745 9.243 48.460 89.030 1.00 0.00 H TER 80661 WAT 7745 ATOM 80661 O WAT 7746 65.259 109.839 117.815 1.00 0.00 O ATOM 80662 H1 WAT 7746 64.780 109.645 117.009 1.00 0.00 H ATOM 80663 H2 WAT 7746 64.581 109.905 118.487 1.00 0.00 H TER 80665 WAT 7746 ATOM 80665 O WAT 7747 102.798 22.731 6.963 1.00 0.00 O ATOM 80666 H1 WAT 7747 102.049 23.019 6.441 1.00 0.00 H ATOM 80667 H2 WAT 7747 102.551 21.862 7.278 1.00 0.00 H TER 80669 WAT 7747 ATOM 80669 O WAT 7748 23.906 142.840 82.339 1.00 0.00 O ATOM 80670 H1 WAT 7748 24.657 142.541 82.851 1.00 0.00 H ATOM 80671 H2 WAT 7748 23.865 143.782 82.503 1.00 0.00 H TER 80673 WAT 7748 ATOM 80673 O WAT 7749 15.780 28.279 133.013 1.00 0.00 O ATOM 80674 H1 WAT 7749 14.952 28.733 133.167 1.00 0.00 H ATOM 80675 H2 WAT 7749 15.625 27.386 133.321 1.00 0.00 H TER 80677 WAT 7749 ATOM 80677 O WAT 7750 9.475 42.028 137.009 1.00 0.00 O ATOM 80678 H1 WAT 7750 9.118 42.853 137.337 1.00 0.00 H ATOM 80679 H2 WAT 7750 8.710 41.544 136.697 1.00 0.00 H TER 80681 WAT 7750 ATOM 80681 O WAT 7751 120.734 36.320 127.621 1.00 0.00 O ATOM 80682 H1 WAT 7751 120.026 35.907 128.115 1.00 0.00 H ATOM 80683 H2 WAT 7751 120.411 37.201 127.432 1.00 0.00 H TER 80685 WAT 7751 ATOM 80685 O WAT 7752 44.783 87.385 81.836 1.00 0.00 O ATOM 80686 H1 WAT 7752 45.124 87.811 81.049 1.00 0.00 H ATOM 80687 H2 WAT 7752 44.191 86.709 81.505 1.00 0.00 H TER 80689 WAT 7752 ATOM 80689 O WAT 7753 88.863 51.174 110.748 1.00 0.00 O ATOM 80690 H1 WAT 7753 88.777 52.127 110.732 1.00 0.00 H ATOM 80691 H2 WAT 7753 89.246 50.982 111.604 1.00 0.00 H TER 80693 WAT 7753 ATOM 80693 O WAT 7754 11.020 19.307 136.066 1.00 0.00 O ATOM 80694 H1 WAT 7754 11.025 20.004 136.723 1.00 0.00 H ATOM 80695 H2 WAT 7754 11.466 19.688 135.310 1.00 0.00 H TER 80697 WAT 7754 ATOM 80697 O WAT 7755 28.781 141.662 99.750 1.00 0.00 O ATOM 80698 H1 WAT 7755 29.324 141.576 100.533 1.00 0.00 H ATOM 80699 H2 WAT 7755 28.756 142.604 99.579 1.00 0.00 H TER 80701 WAT 7755 ATOM 80701 O WAT 7756 88.937 18.900 69.038 1.00 0.00 O ATOM 80702 H1 WAT 7756 89.221 19.194 68.172 1.00 0.00 H ATOM 80703 H2 WAT 7756 88.213 19.484 69.264 1.00 0.00 H TER 80705 WAT 7756 ATOM 80705 O WAT 7757 30.084 38.989 78.210 1.00 0.00 O ATOM 80706 H1 WAT 7757 30.416 38.251 77.699 1.00 0.00 H ATOM 80707 H2 WAT 7757 29.740 38.591 79.010 1.00 0.00 H TER 80709 WAT 7757 ATOM 80709 O WAT 7758 59.651 137.206 140.769 1.00 0.00 O ATOM 80710 H1 WAT 7758 59.891 136.281 140.815 1.00 0.00 H ATOM 80711 H2 WAT 7758 59.725 137.518 141.671 1.00 0.00 H TER 80713 WAT 7758 ATOM 80713 O WAT 7759 116.991 23.294 136.605 1.00 0.00 O ATOM 80714 H1 WAT 7759 116.100 23.141 136.292 1.00 0.00 H ATOM 80715 H2 WAT 7759 117.470 22.501 136.364 1.00 0.00 H TER 80717 WAT 7759 ATOM 80717 O WAT 7760 132.521 31.534 11.128 1.00 0.00 O ATOM 80718 H1 WAT 7760 131.971 31.978 11.773 1.00 0.00 H ATOM 80719 H2 WAT 7760 133.261 32.126 10.994 1.00 0.00 H TER 80721 WAT 7760 ATOM 80721 O WAT 7761 32.749 131.001 116.271 1.00 0.00 O ATOM 80722 H1 WAT 7761 33.442 131.083 115.616 1.00 0.00 H ATOM 80723 H2 WAT 7761 33.091 130.369 116.904 1.00 0.00 H TER 80725 WAT 7761 ATOM 80725 O WAT 7762 108.587 94.453 135.429 1.00 0.00 O ATOM 80726 H1 WAT 7762 108.979 93.955 136.146 1.00 0.00 H ATOM 80727 H2 WAT 7762 108.859 95.357 135.588 1.00 0.00 H TER 80729 WAT 7762 ATOM 80729 O WAT 7763 120.659 112.264 120.962 1.00 0.00 O ATOM 80730 H1 WAT 7763 120.105 112.750 120.351 1.00 0.00 H ATOM 80731 H2 WAT 7763 120.649 112.788 121.763 1.00 0.00 H TER 80733 WAT 7763 ATOM 80733 O WAT 7764 4.896 78.137 104.030 1.00 0.00 O ATOM 80734 H1 WAT 7764 5.556 78.642 103.555 1.00 0.00 H ATOM 80735 H2 WAT 7764 4.501 78.767 104.632 1.00 0.00 H TER 80737 WAT 7764 ATOM 80737 O WAT 7765 109.310 83.719 85.978 1.00 0.00 O ATOM 80738 H1 WAT 7765 109.852 83.125 86.497 1.00 0.00 H ATOM 80739 H2 WAT 7765 109.365 84.557 86.438 1.00 0.00 H TER 80741 WAT 7765 ATOM 80741 O WAT 7766 104.218 140.852 69.250 1.00 0.00 O ATOM 80742 H1 WAT 7766 103.870 140.007 69.536 1.00 0.00 H ATOM 80743 H2 WAT 7766 103.782 141.493 69.812 1.00 0.00 H TER 80745 WAT 7766 ATOM 80745 O WAT 7767 107.728 130.518 74.073 1.00 0.00 O ATOM 80746 H1 WAT 7767 107.212 131.168 73.596 1.00 0.00 H ATOM 80747 H2 WAT 7767 108.325 130.158 73.417 1.00 0.00 H TER 80749 WAT 7767 ATOM 80749 O WAT 7768 44.495 94.671 63.544 1.00 0.00 O ATOM 80750 H1 WAT 7768 44.826 94.758 62.650 1.00 0.00 H ATOM 80751 H2 WAT 7768 43.659 95.139 63.536 1.00 0.00 H TER 80753 WAT 7768 ATOM 80753 O WAT 7769 107.689 92.671 75.674 1.00 0.00 O ATOM 80754 H1 WAT 7769 107.274 93.252 75.036 1.00 0.00 H ATOM 80755 H2 WAT 7769 107.456 91.790 75.383 1.00 0.00 H TER 80757 WAT 7769 ATOM 80757 O WAT 7770 57.934 21.903 8.245 1.00 0.00 O ATOM 80758 H1 WAT 7770 57.363 22.233 7.551 1.00 0.00 H ATOM 80759 H2 WAT 7770 57.351 21.410 8.821 1.00 0.00 H TER 80761 WAT 7770 ATOM 80761 O WAT 7771 62.052 43.323 103.323 1.00 0.00 O ATOM 80762 H1 WAT 7771 61.314 43.359 103.931 1.00 0.00 H ATOM 80763 H2 WAT 7771 62.298 44.238 103.191 1.00 0.00 H TER 80765 WAT 7771 ATOM 80765 O WAT 7772 82.159 83.481 101.782 1.00 0.00 O ATOM 80766 H1 WAT 7772 82.329 83.682 100.861 1.00 0.00 H ATOM 80767 H2 WAT 7772 82.053 82.530 101.804 1.00 0.00 H TER 80769 WAT 7772 ATOM 80769 O WAT 7773 58.765 110.707 89.498 1.00 0.00 O ATOM 80770 H1 WAT 7773 58.500 109.790 89.558 1.00 0.00 H ATOM 80771 H2 WAT 7773 59.000 110.829 88.578 1.00 0.00 H TER 80773 WAT 7773 ATOM 80773 O WAT 7774 121.210 26.537 139.066 1.00 0.00 O ATOM 80774 H1 WAT 7774 121.523 25.937 139.742 1.00 0.00 H ATOM 80775 H2 WAT 7774 120.502 26.061 138.632 1.00 0.00 H TER 80777 WAT 7774 ATOM 80777 O WAT 7775 142.956 104.382 83.145 1.00 0.00 O ATOM 80778 H1 WAT 7775 143.586 104.315 83.862 1.00 0.00 H ATOM 80779 H2 WAT 7775 143.315 103.820 82.458 1.00 0.00 H TER 80781 WAT 7775 ATOM 80781 O WAT 7776 62.513 10.512 96.031 1.00 0.00 O ATOM 80782 H1 WAT 7776 63.100 10.677 95.293 1.00 0.00 H ATOM 80783 H2 WAT 7776 63.033 10.732 96.804 1.00 0.00 H TER 80785 WAT 7776 ATOM 80785 O WAT 7777 117.633 50.338 16.999 1.00 0.00 O ATOM 80786 H1 WAT 7777 117.543 51.069 16.387 1.00 0.00 H ATOM 80787 H2 WAT 7777 116.893 49.765 16.798 1.00 0.00 H TER 80789 WAT 7777 ATOM 80789 O WAT 7778 8.692 128.093 93.218 1.00 0.00 O ATOM 80790 H1 WAT 7778 9.168 128.899 93.018 1.00 0.00 H ATOM 80791 H2 WAT 7778 9.376 127.433 93.333 1.00 0.00 H TER 80793 WAT 7778 ATOM 80793 O WAT 7779 121.126 44.863 158.236 1.00 0.00 O ATOM 80794 H1 WAT 7779 120.468 44.175 158.141 1.00 0.00 H ATOM 80795 H2 WAT 7779 121.572 44.886 157.389 1.00 0.00 H TER 80797 WAT 7779 ATOM 80797 O WAT 7780 109.252 62.187 112.605 1.00 0.00 O ATOM 80798 H1 WAT 7780 108.846 62.764 111.958 1.00 0.00 H ATOM 80799 H2 WAT 7780 108.721 62.299 113.393 1.00 0.00 H TER 80801 WAT 7780 ATOM 80801 O WAT 7781 62.595 144.878 142.171 1.00 0.00 O ATOM 80802 H1 WAT 7781 63.346 144.316 141.982 1.00 0.00 H ATOM 80803 H2 WAT 7781 62.856 145.373 142.947 1.00 0.00 H TER 80805 WAT 7781 ATOM 80805 O WAT 7782 60.306 1.353 153.132 1.00 0.00 O ATOM 80806 H1 WAT 7782 59.546 1.916 152.984 1.00 0.00 H ATOM 80807 H2 WAT 7782 60.938 1.625 152.466 1.00 0.00 H TER 80809 WAT 7782 ATOM 80809 O WAT 7783 36.452 106.587 69.077 1.00 0.00 O ATOM 80810 H1 WAT 7783 36.997 106.199 68.392 1.00 0.00 H ATOM 80811 H2 WAT 7783 36.859 107.435 69.255 1.00 0.00 H TER 80813 WAT 7783 ATOM 80813 O WAT 7784 36.234 22.605 59.504 1.00 0.00 O ATOM 80814 H1 WAT 7784 35.449 22.990 59.115 1.00 0.00 H ATOM 80815 H2 WAT 7784 36.379 21.802 59.004 1.00 0.00 H TER 80817 WAT 7784 ATOM 80817 O WAT 7785 117.552 0.656 78.009 1.00 0.00 O ATOM 80818 H1 WAT 7785 117.366 0.079 77.268 1.00 0.00 H ATOM 80819 H2 WAT 7785 118.496 0.808 77.963 1.00 0.00 H TER 80821 WAT 7785 ATOM 80821 O WAT 7786 73.359 52.683 146.298 1.00 0.00 O ATOM 80822 H1 WAT 7786 73.975 52.331 146.940 1.00 0.00 H ATOM 80823 H2 WAT 7786 73.738 52.453 145.450 1.00 0.00 H TER 80825 WAT 7786 ATOM 80825 O WAT 7787 102.321 17.499 12.140 1.00 0.00 O ATOM 80826 H1 WAT 7787 101.514 17.515 11.625 1.00 0.00 H ATOM 80827 H2 WAT 7787 103.011 17.329 11.499 1.00 0.00 H TER 80829 WAT 7787 ATOM 80829 O WAT 7788 119.557 34.784 91.650 1.00 0.00 O ATOM 80830 H1 WAT 7788 119.510 33.898 92.010 1.00 0.00 H ATOM 80831 H2 WAT 7788 120.001 34.677 90.808 1.00 0.00 H TER 80833 WAT 7788 ATOM 80833 O WAT 7789 62.231 73.560 136.485 1.00 0.00 O ATOM 80834 H1 WAT 7789 62.323 73.112 135.645 1.00 0.00 H ATOM 80835 H2 WAT 7789 61.535 74.201 136.341 1.00 0.00 H TER 80837 WAT 7789 ATOM 80837 O WAT 7790 47.465 19.408 56.983 1.00 0.00 O ATOM 80838 H1 WAT 7790 46.708 19.848 57.369 1.00 0.00 H ATOM 80839 H2 WAT 7790 48.202 19.990 57.169 1.00 0.00 H TER 80841 WAT 7790 ATOM 80841 O WAT 7791 109.532 93.530 58.878 1.00 0.00 O ATOM 80842 H1 WAT 7791 108.794 93.327 59.452 1.00 0.00 H ATOM 80843 H2 WAT 7791 109.521 94.484 58.802 1.00 0.00 H TER 80845 WAT 7791 ATOM 80845 O WAT 7792 4.550 85.057 88.942 1.00 0.00 O ATOM 80846 H1 WAT 7792 5.164 85.680 88.553 1.00 0.00 H ATOM 80847 H2 WAT 7792 5.083 84.540 89.546 1.00 0.00 H TER 80849 WAT 7792 ATOM 80849 O WAT 7793 31.617 53.379 98.791 1.00 0.00 O ATOM 80850 H1 WAT 7793 30.660 53.362 98.816 1.00 0.00 H ATOM 80851 H2 WAT 7793 31.884 52.618 99.305 1.00 0.00 H TER 80853 WAT 7793 ATOM 80853 O WAT 7794 33.171 93.099 122.348 1.00 0.00 O ATOM 80854 H1 WAT 7794 33.442 92.950 123.254 1.00 0.00 H ATOM 80855 H2 WAT 7794 32.388 93.646 122.419 1.00 0.00 H TER 80857 WAT 7794 ATOM 80857 O WAT 7795 109.934 14.769 103.427 1.00 0.00 O ATOM 80858 H1 WAT 7795 110.460 15.488 103.078 1.00 0.00 H ATOM 80859 H2 WAT 7795 109.252 14.630 102.770 1.00 0.00 H TER 80861 WAT 7795 ATOM 80861 O WAT 7796 66.852 53.335 105.137 1.00 0.00 O ATOM 80862 H1 WAT 7796 66.469 52.519 104.815 1.00 0.00 H ATOM 80863 H2 WAT 7796 67.223 53.749 104.357 1.00 0.00 H TER 80865 WAT 7796 ATOM 80865 O WAT 7797 101.967 0.170 18.465 1.00 0.00 O ATOM 80866 H1 WAT 7797 101.741 1.069 18.226 1.00 0.00 H ATOM 80867 H2 WAT 7797 102.910 0.195 18.627 1.00 0.00 H TER 80869 WAT 7797 ATOM 80869 O WAT 7798 104.637 24.697 108.478 1.00 0.00 O ATOM 80870 H1 WAT 7798 104.787 24.519 109.407 1.00 0.00 H ATOM 80871 H2 WAT 7798 104.046 24.000 108.194 1.00 0.00 H TER 80873 WAT 7798 ATOM 80873 O WAT 7799 118.397 78.624 68.077 1.00 0.00 O ATOM 80874 H1 WAT 7799 118.235 78.133 67.272 1.00 0.00 H ATOM 80875 H2 WAT 7799 117.556 78.620 68.534 1.00 0.00 H TER 80877 WAT 7799 ATOM 80877 O WAT 7800 71.490 95.906 138.357 1.00 0.00 O ATOM 80878 H1 WAT 7800 71.336 95.017 138.038 1.00 0.00 H ATOM 80879 H2 WAT 7800 70.614 96.265 138.498 1.00 0.00 H TER 80881 WAT 7800 ATOM 80881 O WAT 7801 34.751 119.914 59.174 1.00 0.00 O ATOM 80882 H1 WAT 7801 34.490 119.147 58.665 1.00 0.00 H ATOM 80883 H2 WAT 7801 35.688 120.008 59.004 1.00 0.00 H TER 80885 WAT 7801 ATOM 80885 O WAT 7802 135.107 97.778 141.551 1.00 0.00 O ATOM 80886 H1 WAT 7802 135.520 98.563 141.910 1.00 0.00 H ATOM 80887 H2 WAT 7802 134.557 98.102 140.838 1.00 0.00 H TER 80889 WAT 7802 ATOM 80889 O WAT 7803 9.765 113.447 121.404 1.00 0.00 O ATOM 80890 H1 WAT 7803 10.632 113.835 121.286 1.00 0.00 H ATOM 80891 H2 WAT 7803 9.628 113.452 122.352 1.00 0.00 H TER 80893 WAT 7803 ATOM 80893 O WAT 7804 112.446 127.282 66.073 1.00 0.00 O ATOM 80894 H1 WAT 7804 112.478 127.387 65.122 1.00 0.00 H ATOM 80895 H2 WAT 7804 111.690 126.715 66.227 1.00 0.00 H TER 80897 WAT 7804 ATOM 80897 O WAT 7805 121.692 78.501 150.054 1.00 0.00 O ATOM 80898 H1 WAT 7805 121.863 79.085 150.794 1.00 0.00 H ATOM 80899 H2 WAT 7805 121.005 78.942 149.555 1.00 0.00 H TER 80901 WAT 7805 ATOM 80901 O WAT 7806 58.443 16.738 134.421 1.00 0.00 O ATOM 80902 H1 WAT 7806 57.956 17.561 134.382 1.00 0.00 H ATOM 80903 H2 WAT 7806 58.253 16.308 133.587 1.00 0.00 H TER 80905 WAT 7806 ATOM 80905 O WAT 7807 101.120 78.556 148.923 1.00 0.00 O ATOM 80906 H1 WAT 7807 100.292 78.371 149.366 1.00 0.00 H ATOM 80907 H2 WAT 7807 101.007 78.193 148.044 1.00 0.00 H TER 80909 WAT 7807 ATOM 80909 O WAT 7808 3.202 124.900 19.445 1.00 0.00 O ATOM 80910 H1 WAT 7808 3.605 124.861 20.313 1.00 0.00 H ATOM 80911 H2 WAT 7808 3.374 124.038 19.064 1.00 0.00 H TER 80913 WAT 7808 ATOM 80913 O WAT 7809 117.990 87.968 86.203 1.00 0.00 O ATOM 80914 H1 WAT 7809 118.665 88.075 86.874 1.00 0.00 H ATOM 80915 H2 WAT 7809 118.097 87.068 85.897 1.00 0.00 H TER 80917 WAT 7809 ATOM 80917 O WAT 7810 26.571 142.025 65.258 1.00 0.00 O ATOM 80918 H1 WAT 7810 26.512 142.694 65.940 1.00 0.00 H ATOM 80919 H2 WAT 7810 26.132 142.415 64.502 1.00 0.00 H TER 80921 WAT 7810 ATOM 80921 O WAT 7811 120.777 79.576 68.549 1.00 0.00 O ATOM 80922 H1 WAT 7811 119.911 79.176 68.621 1.00 0.00 H ATOM 80923 H2 WAT 7811 121.166 79.168 67.775 1.00 0.00 H TER 80925 WAT 7811 ATOM 80925 O WAT 7812 47.368 114.803 149.116 1.00 0.00 O ATOM 80926 H1 WAT 7812 47.682 114.570 148.242 1.00 0.00 H ATOM 80927 H2 WAT 7812 47.315 115.758 149.105 1.00 0.00 H TER 80929 WAT 7812 ATOM 80929 O WAT 7813 132.476 4.137 14.459 1.00 0.00 O ATOM 80930 H1 WAT 7813 132.958 4.102 13.633 1.00 0.00 H ATOM 80931 H2 WAT 7813 133.050 3.704 15.091 1.00 0.00 H TER 80933 WAT 7813 ATOM 80933 O WAT 7814 92.916 134.995 91.318 1.00 0.00 O ATOM 80934 H1 WAT 7814 93.438 134.267 91.656 1.00 0.00 H ATOM 80935 H2 WAT 7814 92.018 134.784 91.572 1.00 0.00 H TER 80937 WAT 7814 ATOM 80937 O WAT 7815 94.429 105.659 86.501 1.00 0.00 O ATOM 80938 H1 WAT 7815 94.492 105.462 85.567 1.00 0.00 H ATOM 80939 H2 WAT 7815 93.923 104.932 86.865 1.00 0.00 H TER 80941 WAT 7815 ATOM 80941 O WAT 7816 41.312 142.851 82.272 1.00 0.00 O ATOM 80942 H1 WAT 7816 40.548 142.583 82.782 1.00 0.00 H ATOM 80943 H2 WAT 7816 40.975 143.504 81.660 1.00 0.00 H TER 80945 WAT 7816 ATOM 80945 O WAT 7817 126.980 28.063 152.363 1.00 0.00 O ATOM 80946 H1 WAT 7817 126.970 28.148 151.410 1.00 0.00 H ATOM 80947 H2 WAT 7817 126.843 27.129 152.522 1.00 0.00 H TER 80949 WAT 7817 ATOM 80949 O WAT 7818 85.740 32.096 61.932 1.00 0.00 O ATOM 80950 H1 WAT 7818 85.543 33.012 62.127 1.00 0.00 H ATOM 80951 H2 WAT 7818 84.900 31.646 62.023 1.00 0.00 H TER 80953 WAT 7818 ATOM 80953 O WAT 7819 1.117 72.665 65.824 1.00 0.00 O ATOM 80954 H1 WAT 7819 0.857 72.611 66.743 1.00 0.00 H ATOM 80955 H2 WAT 7819 0.315 72.475 65.337 1.00 0.00 H TER 80957 WAT 7819 ATOM 80957 O WAT 7820 142.284 137.428 22.917 1.00 0.00 O ATOM 80958 H1 WAT 7820 141.448 137.881 23.029 1.00 0.00 H ATOM 80959 H2 WAT 7820 142.360 137.296 21.972 1.00 0.00 H TER 80961 WAT 7820 ATOM 80961 O WAT 7821 0.504 97.339 94.389 1.00 0.00 O ATOM 80962 H1 WAT 7821 0.744 96.558 93.891 1.00 0.00 H ATOM 80963 H2 WAT 7821 1.339 97.702 94.682 1.00 0.00 H TER 80965 WAT 7821 ATOM 80965 O WAT 7822 132.761 115.501 86.980 1.00 0.00 O ATOM 80966 H1 WAT 7822 132.103 115.309 87.648 1.00 0.00 H ATOM 80967 H2 WAT 7822 132.957 116.430 87.098 1.00 0.00 H TER 80969 WAT 7822 ATOM 80969 O WAT 7823 22.153 124.585 55.174 1.00 0.00 O ATOM 80970 H1 WAT 7823 22.146 125.064 54.346 1.00 0.00 H ATOM 80971 H2 WAT 7823 21.256 124.660 55.502 1.00 0.00 H TER 80973 WAT 7823 ATOM 80973 O WAT 7824 26.739 11.667 127.186 1.00 0.00 O ATOM 80974 H1 WAT 7824 27.513 11.957 126.702 1.00 0.00 H ATOM 80975 H2 WAT 7824 27.091 11.237 127.966 1.00 0.00 H TER 80977 WAT 7824 ATOM 80977 O WAT 7825 115.750 136.623 111.330 1.00 0.00 O ATOM 80978 H1 WAT 7825 115.872 136.262 112.208 1.00 0.00 H ATOM 80979 H2 WAT 7825 114.800 136.666 111.219 1.00 0.00 H TER 80981 WAT 7825 ATOM 80981 O WAT 7826 125.317 126.144 123.001 1.00 0.00 O ATOM 80982 H1 WAT 7826 125.349 126.164 123.957 1.00 0.00 H ATOM 80983 H2 WAT 7826 125.161 127.054 122.748 1.00 0.00 H TER 80985 WAT 7826 ATOM 80985 O WAT 7827 106.616 144.587 115.227 1.00 0.00 O ATOM 80986 H1 WAT 7827 106.425 143.875 114.617 1.00 0.00 H ATOM 80987 H2 WAT 7827 106.781 144.149 116.063 1.00 0.00 H TER 80989 WAT 7827 ATOM 80989 O WAT 7828 84.774 127.643 2.783 1.00 0.00 O ATOM 80990 H1 WAT 7828 84.317 128.067 2.057 1.00 0.00 H ATOM 80991 H2 WAT 7828 84.515 128.145 3.556 1.00 0.00 H TER 80993 WAT 7828 ATOM 80993 O WAT 7829 97.547 75.533 149.308 1.00 0.00 O ATOM 80994 H1 WAT 7829 97.051 75.099 150.002 1.00 0.00 H ATOM 80995 H2 WAT 7829 98.179 74.875 149.018 1.00 0.00 H TER 80997 WAT 7829 ATOM 80997 O WAT 7830 138.475 81.284 90.691 1.00 0.00 O ATOM 80998 H1 WAT 7830 137.950 81.159 89.900 1.00 0.00 H ATOM 80999 H2 WAT 7830 138.249 80.540 91.249 1.00 0.00 H TER 81001 WAT 7830 ATOM 81001 O WAT 7831 74.272 143.063 76.157 1.00 0.00 O ATOM 81002 H1 WAT 7831 74.429 142.317 76.736 1.00 0.00 H ATOM 81003 H2 WAT 7831 73.836 143.709 76.712 1.00 0.00 H TER 81005 WAT 7831 ATOM 81005 O WAT 7832 70.543 59.181 106.194 1.00 0.00 O ATOM 81006 H1 WAT 7832 70.700 59.814 105.494 1.00 0.00 H ATOM 81007 H2 WAT 7832 70.447 59.715 106.983 1.00 0.00 H TER 81009 WAT 7832 ATOM 81009 O WAT 7833 128.920 69.842 21.702 1.00 0.00 O ATOM 81010 H1 WAT 7833 129.822 69.930 22.009 1.00 0.00 H ATOM 81011 H2 WAT 7833 128.451 69.456 22.442 1.00 0.00 H TER 81013 WAT 7833 ATOM 81013 O WAT 7834 30.172 25.351 82.223 1.00 0.00 O ATOM 81014 H1 WAT 7834 30.423 26.033 81.601 1.00 0.00 H ATOM 81015 H2 WAT 7834 30.062 25.813 83.054 1.00 0.00 H TER 81017 WAT 7834 ATOM 81017 O WAT 7835 141.518 127.107 102.604 1.00 0.00 O ATOM 81018 H1 WAT 7835 141.851 126.557 101.895 1.00 0.00 H ATOM 81019 H2 WAT 7835 140.666 126.728 102.820 1.00 0.00 H TER 81021 WAT 7835 ATOM 81021 O WAT 7836 1.796 74.356 105.273 1.00 0.00 O ATOM 81022 H1 WAT 7836 1.795 73.639 105.907 1.00 0.00 H ATOM 81023 H2 WAT 7836 0.935 74.311 104.858 1.00 0.00 H TER 81025 WAT 7836 ATOM 81025 O WAT 7837 132.647 134.751 102.513 1.00 0.00 O ATOM 81026 H1 WAT 7837 132.555 134.386 103.393 1.00 0.00 H ATOM 81027 H2 WAT 7837 131.981 134.297 101.995 1.00 0.00 H TER 81029 WAT 7837 ATOM 81029 O WAT 7838 75.498 120.230 89.428 1.00 0.00 O ATOM 81030 H1 WAT 7838 74.584 119.967 89.533 1.00 0.00 H ATOM 81031 H2 WAT 7838 75.491 120.830 88.683 1.00 0.00 H TER 81033 WAT 7838 ATOM 81033 O WAT 7839 105.914 58.900 67.683 1.00 0.00 O ATOM 81034 H1 WAT 7839 104.964 58.882 67.795 1.00 0.00 H ATOM 81035 H2 WAT 7839 106.067 59.604 67.052 1.00 0.00 H TER 81037 WAT 7839 ATOM 81037 O WAT 7840 124.879 132.646 116.217 1.00 0.00 O ATOM 81038 H1 WAT 7840 124.855 131.860 115.671 1.00 0.00 H ATOM 81039 H2 WAT 7840 125.277 133.313 115.658 1.00 0.00 H TER 81041 WAT 7840 ATOM 81041 O WAT 7841 132.757 47.726 80.289 1.00 0.00 O ATOM 81042 H1 WAT 7841 132.607 48.034 79.396 1.00 0.00 H ATOM 81043 H2 WAT 7841 133.156 46.862 80.181 1.00 0.00 H TER 81045 WAT 7841 ATOM 81045 O WAT 7842 106.322 119.713 96.059 1.00 0.00 O ATOM 81046 H1 WAT 7842 105.473 119.979 95.706 1.00 0.00 H ATOM 81047 H2 WAT 7842 106.483 120.321 96.781 1.00 0.00 H TER 81049 WAT 7842 ATOM 81049 O WAT 7843 54.354 21.731 151.788 1.00 0.00 O ATOM 81050 H1 WAT 7843 54.328 22.087 152.677 1.00 0.00 H ATOM 81051 H2 WAT 7843 53.724 22.261 151.300 1.00 0.00 H TER 81053 WAT 7843 ATOM 81053 O WAT 7844 9.195 74.967 13.405 1.00 0.00 O ATOM 81054 H1 WAT 7844 9.641 74.899 14.249 1.00 0.00 H ATOM 81055 H2 WAT 7844 8.280 75.136 13.630 1.00 0.00 H TER 81057 WAT 7844 ATOM 81057 O WAT 7845 56.231 15.814 155.353 1.00 0.00 O ATOM 81058 H1 WAT 7845 56.837 16.116 156.030 1.00 0.00 H ATOM 81059 H2 WAT 7845 56.690 15.091 154.926 1.00 0.00 H TER 81061 WAT 7845 ATOM 81061 O WAT 7846 57.069 95.306 79.479 1.00 0.00 O ATOM 81062 H1 WAT 7846 57.188 96.252 79.387 1.00 0.00 H ATOM 81063 H2 WAT 7846 57.453 95.098 80.330 1.00 0.00 H TER 81065 WAT 7846 ATOM 81065 O WAT 7847 7.453 53.423 96.423 1.00 0.00 O ATOM 81066 H1 WAT 7847 6.974 54.074 96.937 1.00 0.00 H ATOM 81067 H2 WAT 7847 8.374 53.656 96.539 1.00 0.00 H TER 81069 WAT 7847 ATOM 81069 O WAT 7848 144.861 63.104 17.313 1.00 0.00 O ATOM 81070 H1 WAT 7848 144.965 63.486 16.441 1.00 0.00 H ATOM 81071 H2 WAT 7848 144.263 62.368 17.182 1.00 0.00 H TER 81073 WAT 7848 ATOM 81073 O WAT 7849 37.781 107.495 61.661 1.00 0.00 O ATOM 81074 H1 WAT 7849 37.227 107.066 62.313 1.00 0.00 H ATOM 81075 H2 WAT 7849 38.676 107.304 61.945 1.00 0.00 H TER 81077 WAT 7849 ATOM 81077 O WAT 7850 57.390 131.240 152.006 1.00 0.00 O ATOM 81078 H1 WAT 7850 56.724 130.830 152.558 1.00 0.00 H ATOM 81079 H2 WAT 7850 57.695 130.535 151.435 1.00 0.00 H TER 81081 WAT 7850 ATOM 81081 O WAT 7851 39.073 60.450 89.296 1.00 0.00 O ATOM 81082 H1 WAT 7851 39.903 60.452 88.818 1.00 0.00 H ATOM 81083 H2 WAT 7851 39.248 60.969 90.081 1.00 0.00 H TER 81085 WAT 7851 ATOM 81085 O WAT 7852 27.105 60.693 74.142 1.00 0.00 O ATOM 81086 H1 WAT 7852 26.465 60.063 74.473 1.00 0.00 H ATOM 81087 H2 WAT 7852 27.168 61.355 74.831 1.00 0.00 H TER 81089 WAT 7852 ATOM 81089 O WAT 7853 86.718 139.029 6.880 1.00 0.00 O ATOM 81090 H1 WAT 7853 86.457 138.732 6.008 1.00 0.00 H ATOM 81091 H2 WAT 7853 87.378 139.703 6.716 1.00 0.00 H TER 81093 WAT 7853 ATOM 81093 O WAT 7854 111.232 35.527 108.453 1.00 0.00 O ATOM 81094 H1 WAT 7854 111.245 35.427 107.501 1.00 0.00 H ATOM 81095 H2 WAT 7854 110.702 36.310 108.604 1.00 0.00 H TER 81097 WAT 7854 ATOM 81097 O WAT 7855 63.471 76.485 73.984 1.00 0.00 O ATOM 81098 H1 WAT 7855 62.935 76.947 73.339 1.00 0.00 H ATOM 81099 H2 WAT 7855 64.321 76.924 73.947 1.00 0.00 H TER 81101 WAT 7855 ATOM 81101 O WAT 7856 94.323 22.646 2.340 1.00 0.00 O ATOM 81102 H1 WAT 7856 94.640 21.747 2.250 1.00 0.00 H ATOM 81103 H2 WAT 7856 94.140 22.927 1.444 1.00 0.00 H TER 81105 WAT 7856 ATOM 81105 O WAT 7857 112.390 11.383 129.556 1.00 0.00 O ATOM 81106 H1 WAT 7857 113.029 11.507 128.854 1.00 0.00 H ATOM 81107 H2 WAT 7857 111.902 12.206 129.583 1.00 0.00 H TER 81109 WAT 7857 ATOM 81109 O WAT 7858 50.649 25.463 18.936 1.00 0.00 O ATOM 81110 H1 WAT 7858 50.417 25.469 19.865 1.00 0.00 H ATOM 81111 H2 WAT 7858 51.248 26.203 18.834 1.00 0.00 H TER 81113 WAT 7858 ATOM 81113 O WAT 7859 83.265 24.570 5.373 1.00 0.00 O ATOM 81114 H1 WAT 7859 83.683 24.109 6.101 1.00 0.00 H ATOM 81115 H2 WAT 7859 83.665 24.192 4.590 1.00 0.00 H TER 81117 WAT 7859 ATOM 81117 O WAT 7860 87.711 90.295 97.330 1.00 0.00 O ATOM 81118 H1 WAT 7860 87.844 90.746 96.496 1.00 0.00 H ATOM 81119 H2 WAT 7860 88.451 90.571 97.872 1.00 0.00 H TER 81121 WAT 7860 ATOM 81121 O WAT 7861 78.730 82.775 16.567 1.00 0.00 O ATOM 81122 H1 WAT 7861 78.263 83.517 16.953 1.00 0.00 H ATOM 81123 H2 WAT 7861 78.107 82.051 16.611 1.00 0.00 H TER 81125 WAT 7861 ATOM 81125 O WAT 7862 111.223 40.075 86.505 1.00 0.00 O ATOM 81126 H1 WAT 7862 110.500 40.522 86.065 1.00 0.00 H ATOM 81127 H2 WAT 7862 111.796 40.782 86.801 1.00 0.00 H TER 81129 WAT 7862 ATOM 81129 O WAT 7863 109.848 50.700 123.756 1.00 0.00 O ATOM 81130 H1 WAT 7863 109.882 50.618 124.709 1.00 0.00 H ATOM 81131 H2 WAT 7863 109.103 51.278 123.592 1.00 0.00 H TER 81133 WAT 7863 ATOM 81133 O WAT 7864 47.586 43.576 73.409 1.00 0.00 O ATOM 81134 H1 WAT 7864 47.332 42.753 73.827 1.00 0.00 H ATOM 81135 H2 WAT 7864 47.804 44.157 74.138 1.00 0.00 H TER 81137 WAT 7864 ATOM 81137 O WAT 7865 138.805 83.038 146.742 1.00 0.00 O ATOM 81138 H1 WAT 7865 139.668 82.679 146.534 1.00 0.00 H ATOM 81139 H2 WAT 7865 138.822 83.925 146.383 1.00 0.00 H TER 81141 WAT 7865 ATOM 81141 O WAT 7866 135.671 61.618 137.853 1.00 0.00 O ATOM 81142 H1 WAT 7866 136.448 61.080 137.704 1.00 0.00 H ATOM 81143 H2 WAT 7866 135.783 61.961 138.740 1.00 0.00 H TER 81145 WAT 7866 ATOM 81145 O WAT 7867 80.349 4.961 127.075 1.00 0.00 O ATOM 81146 H1 WAT 7867 79.853 4.188 126.805 1.00 0.00 H ATOM 81147 H2 WAT 7867 80.500 4.834 128.011 1.00 0.00 H TER 81149 WAT 7867 ATOM 81149 O WAT 7868 120.477 107.608 122.684 1.00 0.00 O ATOM 81150 H1 WAT 7868 120.491 108.402 122.151 1.00 0.00 H ATOM 81151 H2 WAT 7868 119.584 107.566 123.026 1.00 0.00 H TER 81153 WAT 7868 ATOM 81153 O WAT 7869 28.955 55.486 1.308 1.00 0.00 O ATOM 81154 H1 WAT 7869 28.731 54.639 1.693 1.00 0.00 H ATOM 81155 H2 WAT 7869 28.438 55.527 0.503 1.00 0.00 H TER 81157 WAT 7869 ATOM 81157 O WAT 7870 50.145 108.566 94.448 1.00 0.00 O ATOM 81158 H1 WAT 7870 49.362 108.051 94.256 1.00 0.00 H ATOM 81159 H2 WAT 7870 50.859 107.927 94.443 1.00 0.00 H TER 81161 WAT 7870 ATOM 81161 O WAT 7871 49.861 86.151 75.800 1.00 0.00 O ATOM 81162 H1 WAT 7871 49.714 85.963 74.873 1.00 0.00 H ATOM 81163 H2 WAT 7871 50.739 86.532 75.831 1.00 0.00 H TER 81165 WAT 7871 ATOM 81165 O WAT 7872 65.175 4.272 102.135 1.00 0.00 O ATOM 81166 H1 WAT 7872 65.551 3.407 102.299 1.00 0.00 H ATOM 81167 H2 WAT 7872 65.467 4.804 102.875 1.00 0.00 H TER 81169 WAT 7872 ATOM 81169 O WAT 7873 33.461 49.178 81.759 1.00 0.00 O ATOM 81170 H1 WAT 7873 33.244 48.395 82.266 1.00 0.00 H ATOM 81171 H2 WAT 7873 33.110 49.002 80.886 1.00 0.00 H TER 81173 WAT 7873 ATOM 81173 O WAT 7874 63.713 21.251 5.458 1.00 0.00 O ATOM 81174 H1 WAT 7874 63.081 21.923 5.203 1.00 0.00 H ATOM 81175 H2 WAT 7874 63.396 20.933 6.303 1.00 0.00 H TER 81177 WAT 7874 ATOM 81177 O WAT 7875 66.951 97.740 114.656 1.00 0.00 O ATOM 81178 H1 WAT 7875 67.686 98.099 115.152 1.00 0.00 H ATOM 81179 H2 WAT 7875 66.174 98.092 115.089 1.00 0.00 H TER 81181 WAT 7875 ATOM 81181 O WAT 7876 133.817 122.760 124.927 1.00 0.00 O ATOM 81182 H1 WAT 7876 134.316 122.000 125.229 1.00 0.00 H ATOM 81183 H2 WAT 7876 133.090 122.831 125.546 1.00 0.00 H TER 81185 WAT 7876 ATOM 81185 O WAT 7877 47.148 8.140 71.802 1.00 0.00 O ATOM 81186 H1 WAT 7877 47.737 8.836 72.095 1.00 0.00 H ATOM 81187 H2 WAT 7877 47.562 7.792 71.013 1.00 0.00 H TER 81189 WAT 7877 ATOM 81189 O WAT 7878 60.297 128.309 18.186 1.00 0.00 O ATOM 81190 H1 WAT 7878 60.706 128.848 18.863 1.00 0.00 H ATOM 81191 H2 WAT 7878 59.632 128.877 17.797 1.00 0.00 H TER 81193 WAT 7878 ATOM 81193 O WAT 7879 128.741 127.258 111.798 1.00 0.00 O ATOM 81194 H1 WAT 7879 129.248 127.355 110.992 1.00 0.00 H ATOM 81195 H2 WAT 7879 129.325 126.789 112.393 1.00 0.00 H TER 81197 WAT 7879 ATOM 81197 O WAT 7880 76.044 137.120 14.296 1.00 0.00 O ATOM 81198 H1 WAT 7880 76.407 136.251 14.123 1.00 0.00 H ATOM 81199 H2 WAT 7880 76.347 137.656 13.563 1.00 0.00 H TER 81201 WAT 7880 ATOM 81201 O WAT 7881 59.180 31.902 71.226 1.00 0.00 O ATOM 81202 H1 WAT 7881 60.130 32.020 71.211 1.00 0.00 H ATOM 81203 H2 WAT 7881 59.049 31.070 71.680 1.00 0.00 H TER 81205 WAT 7881 ATOM 81205 O WAT 7882 115.362 1.644 4.955 1.00 0.00 O ATOM 81206 H1 WAT 7882 115.519 1.285 5.828 1.00 0.00 H ATOM 81207 H2 WAT 7882 116.229 1.674 4.549 1.00 0.00 H TER 81209 WAT 7882 ATOM 81209 O WAT 7883 143.037 119.439 76.321 1.00 0.00 O ATOM 81210 H1 WAT 7883 142.407 120.126 76.535 1.00 0.00 H ATOM 81211 H2 WAT 7883 143.039 118.868 77.089 1.00 0.00 H TER 81213 WAT 7883 ATOM 81213 O WAT 7884 111.031 9.146 102.938 1.00 0.00 O ATOM 81214 H1 WAT 7884 111.245 9.515 102.081 1.00 0.00 H ATOM 81215 H2 WAT 7884 110.229 9.598 103.200 1.00 0.00 H TER 81217 WAT 7884 ATOM 81217 O WAT 7885 40.359 33.107 86.105 1.00 0.00 O ATOM 81218 H1 WAT 7885 40.384 33.520 86.968 1.00 0.00 H ATOM 81219 H2 WAT 7885 40.977 33.615 85.578 1.00 0.00 H TER 81221 WAT 7885 ATOM 81221 O WAT 7886 63.186 73.877 107.451 1.00 0.00 O ATOM 81222 H1 WAT 7886 63.084 74.453 106.693 1.00 0.00 H ATOM 81223 H2 WAT 7886 63.991 74.177 107.873 1.00 0.00 H TER 81225 WAT 7886 ATOM 81225 O WAT 7887 120.467 57.608 128.202 1.00 0.00 O ATOM 81226 H1 WAT 7887 120.129 57.085 127.475 1.00 0.00 H ATOM 81227 H2 WAT 7887 119.980 58.431 128.152 1.00 0.00 H TER 81229 WAT 7887 ATOM 81229 O WAT 7888 27.318 49.623 143.705 1.00 0.00 O ATOM 81230 H1 WAT 7888 26.777 48.864 143.490 1.00 0.00 H ATOM 81231 H2 WAT 7888 28.038 49.591 143.075 1.00 0.00 H TER 81233 WAT 7888 ATOM 81233 O WAT 7889 109.318 20.908 11.601 1.00 0.00 O ATOM 81234 H1 WAT 7889 108.398 20.913 11.335 1.00 0.00 H ATOM 81235 H2 WAT 7889 109.391 21.631 12.224 1.00 0.00 H TER 81237 WAT 7889 ATOM 81237 O WAT 7890 118.792 66.422 68.829 1.00 0.00 O ATOM 81238 H1 WAT 7890 119.126 67.311 68.945 1.00 0.00 H ATOM 81239 H2 WAT 7890 118.262 66.262 69.609 1.00 0.00 H TER 81241 WAT 7890 ATOM 81241 O WAT 7891 68.130 98.839 15.491 1.00 0.00 O ATOM 81242 H1 WAT 7891 67.867 99.693 15.835 1.00 0.00 H ATOM 81243 H2 WAT 7891 68.405 99.017 14.592 1.00 0.00 H TER 81245 WAT 7891 ATOM 81245 O WAT 7892 124.464 125.915 74.722 1.00 0.00 O ATOM 81246 H1 WAT 7892 124.989 125.919 73.922 1.00 0.00 H ATOM 81247 H2 WAT 7892 123.700 125.381 74.506 1.00 0.00 H TER 81249 WAT 7892 ATOM 81249 O WAT 7893 84.439 67.348 59.032 1.00 0.00 O ATOM 81250 H1 WAT 7893 84.872 67.096 59.848 1.00 0.00 H ATOM 81251 H2 WAT 7893 84.970 68.068 58.692 1.00 0.00 H TER 81253 WAT 7893 ATOM 81253 O WAT 7894 120.354 146.192 114.943 1.00 0.00 O ATOM 81254 H1 WAT 7894 120.730 145.532 114.361 1.00 0.00 H ATOM 81255 H2 WAT 7894 119.780 145.697 115.527 1.00 0.00 H TER 81257 WAT 7894 ATOM 81257 O WAT 7895 110.804 15.066 60.450 1.00 0.00 O ATOM 81258 H1 WAT 7895 110.840 16.015 60.563 1.00 0.00 H ATOM 81259 H2 WAT 7895 111.397 14.889 59.719 1.00 0.00 H TER 81261 WAT 7895 ATOM 81261 O WAT 7896 14.197 143.569 7.842 1.00 0.00 O ATOM 81262 H1 WAT 7896 14.337 143.348 6.921 1.00 0.00 H ATOM 81263 H2 WAT 7896 13.359 144.032 7.852 1.00 0.00 H TER 81265 WAT 7896 ATOM 81265 O WAT 7897 54.835 64.945 125.307 1.00 0.00 O ATOM 81266 H1 WAT 7897 54.238 64.950 124.558 1.00 0.00 H ATOM 81267 H2 WAT 7897 55.014 64.017 125.464 1.00 0.00 H TER 81269 WAT 7897 ATOM 81269 O WAT 7898 94.015 14.680 58.119 1.00 0.00 O ATOM 81270 H1 WAT 7898 93.620 14.904 58.961 1.00 0.00 H ATOM 81271 H2 WAT 7898 94.319 15.517 57.767 1.00 0.00 H TER 81273 WAT 7898 ATOM 81273 O WAT 7899 135.834 41.424 107.374 1.00 0.00 O ATOM 81274 H1 WAT 7899 136.671 41.372 107.835 1.00 0.00 H ATOM 81275 H2 WAT 7899 135.612 42.355 107.386 1.00 0.00 H TER 81277 WAT 7899 ATOM 81277 O WAT 7900 43.574 134.668 113.326 1.00 0.00 O ATOM 81278 H1 WAT 7900 43.201 135.394 112.826 1.00 0.00 H ATOM 81279 H2 WAT 7900 44.370 135.029 113.716 1.00 0.00 H TER 81281 WAT 7900 ATOM 81281 O WAT 7901 79.189 35.889 17.890 1.00 0.00 O ATOM 81282 H1 WAT 7901 79.219 35.059 17.415 1.00 0.00 H ATOM 81283 H2 WAT 7901 79.656 35.714 18.707 1.00 0.00 H TER 81285 WAT 7901 ATOM 81285 O WAT 7902 25.362 25.042 80.991 1.00 0.00 O ATOM 81286 H1 WAT 7902 26.179 24.864 81.457 1.00 0.00 H ATOM 81287 H2 WAT 7902 25.517 25.875 80.545 1.00 0.00 H TER 81289 WAT 7902 ATOM 81289 O WAT 7903 106.498 92.379 105.688 1.00 0.00 O ATOM 81290 H1 WAT 7903 107.453 92.392 105.637 1.00 0.00 H ATOM 81291 H2 WAT 7903 106.308 92.369 106.626 1.00 0.00 H TER 81293 WAT 7903 ATOM 81293 O WAT 7904 56.291 73.286 151.503 1.00 0.00 O ATOM 81294 H1 WAT 7904 55.817 74.113 151.590 1.00 0.00 H ATOM 81295 H2 WAT 7904 56.849 73.410 150.735 1.00 0.00 H TER 81297 WAT 7904 ATOM 81297 O WAT 7905 111.024 102.211 20.842 1.00 0.00 O ATOM 81298 H1 WAT 7905 111.359 101.392 20.476 1.00 0.00 H ATOM 81299 H2 WAT 7905 110.724 102.708 20.081 1.00 0.00 H TER 81301 WAT 7905 ATOM 81301 O WAT 7906 115.624 117.093 145.290 1.00 0.00 O ATOM 81302 H1 WAT 7906 115.870 116.664 144.470 1.00 0.00 H ATOM 81303 H2 WAT 7906 116.338 117.707 145.462 1.00 0.00 H TER 81305 WAT 7906 ATOM 81305 O WAT 7907 98.459 134.002 108.463 1.00 0.00 O ATOM 81306 H1 WAT 7907 98.019 134.197 109.290 1.00 0.00 H ATOM 81307 H2 WAT 7907 97.827 133.476 107.973 1.00 0.00 H TER 81309 WAT 7907 ATOM 81309 O WAT 7908 47.345 96.997 70.159 1.00 0.00 O ATOM 81310 H1 WAT 7908 47.402 97.947 70.263 1.00 0.00 H ATOM 81311 H2 WAT 7908 48.008 96.787 69.502 1.00 0.00 H TER 81313 WAT 7908 ATOM 81313 O WAT 7909 22.102 67.946 0.785 1.00 0.00 O ATOM 81314 H1 WAT 7909 21.243 67.828 1.191 1.00 0.00 H ATOM 81315 H2 WAT 7909 22.712 67.526 1.391 1.00 0.00 H TER 81317 WAT 7909 ATOM 81317 O WAT 7910 118.277 107.170 73.768 1.00 0.00 O ATOM 81318 H1 WAT 7910 117.486 107.654 74.004 1.00 0.00 H ATOM 81319 H2 WAT 7910 118.578 107.583 72.958 1.00 0.00 H TER 81321 WAT 7910 ATOM 81321 O WAT 7911 101.371 91.527 131.883 1.00 0.00 O ATOM 81322 H1 WAT 7911 101.214 90.858 132.549 1.00 0.00 H ATOM 81323 H2 WAT 7911 101.756 92.259 132.366 1.00 0.00 H TER 81325 WAT 7911 ATOM 81325 O WAT 7912 48.293 87.527 66.066 1.00 0.00 O ATOM 81326 H1 WAT 7912 48.909 86.934 65.636 1.00 0.00 H ATOM 81327 H2 WAT 7912 48.728 88.379 66.048 1.00 0.00 H TER 81329 WAT 7912 ATOM 81329 O WAT 7913 50.963 80.131 117.622 1.00 0.00 O ATOM 81330 H1 WAT 7913 50.079 80.434 117.416 1.00 0.00 H ATOM 81331 H2 WAT 7913 51.537 80.698 117.107 1.00 0.00 H TER 81333 WAT 7913 ATOM 81333 O WAT 7914 97.627 102.800 11.576 1.00 0.00 O ATOM 81334 H1 WAT 7914 96.754 103.117 11.805 1.00 0.00 H ATOM 81335 H2 WAT 7914 97.911 102.304 12.345 1.00 0.00 H TER 81337 WAT 7914 ATOM 81337 O WAT 7915 131.074 122.304 85.436 1.00 0.00 O ATOM 81338 H1 WAT 7915 130.776 121.442 85.724 1.00 0.00 H ATOM 81339 H2 WAT 7915 130.699 122.913 86.072 1.00 0.00 H TER 81341 WAT 7915 ATOM 81341 O WAT 7916 76.307 123.098 66.148 1.00 0.00 O ATOM 81342 H1 WAT 7916 76.625 123.311 67.026 1.00 0.00 H ATOM 81343 H2 WAT 7916 76.782 122.303 65.907 1.00 0.00 H TER 81345 WAT 7916 ATOM 81345 O WAT 7917 78.104 26.690 8.996 1.00 0.00 O ATOM 81346 H1 WAT 7917 78.197 25.812 9.367 1.00 0.00 H ATOM 81347 H2 WAT 7917 77.204 26.943 9.202 1.00 0.00 H TER 81349 WAT 7917 ATOM 81349 O WAT 7918 97.143 5.745 4.538 1.00 0.00 O ATOM 81350 H1 WAT 7918 97.170 5.850 3.586 1.00 0.00 H ATOM 81351 H2 WAT 7918 97.438 6.589 4.880 1.00 0.00 H TER 81353 WAT 7918 ATOM 81353 O WAT 7919 129.697 37.159 103.488 1.00 0.00 O ATOM 81354 H1 WAT 7919 129.162 36.498 103.927 1.00 0.00 H ATOM 81355 H2 WAT 7919 129.551 37.005 102.555 1.00 0.00 H TER 81357 WAT 7919 ATOM 81357 O WAT 7920 41.974 130.923 52.804 1.00 0.00 O ATOM 81358 H1 WAT 7920 42.143 131.862 52.734 1.00 0.00 H ATOM 81359 H2 WAT 7920 41.672 130.801 53.704 1.00 0.00 H TER 81361 WAT 7920 ATOM 81361 O WAT 7921 84.322 54.994 64.010 1.00 0.00 O ATOM 81362 H1 WAT 7921 83.755 55.244 63.281 1.00 0.00 H ATOM 81363 H2 WAT 7921 85.189 54.896 63.616 1.00 0.00 H TER 81365 WAT 7921 ATOM 81365 O WAT 7922 35.644 60.609 152.876 1.00 0.00 O ATOM 81366 H1 WAT 7922 34.984 59.984 152.574 1.00 0.00 H ATOM 81367 H2 WAT 7922 35.140 61.376 153.147 1.00 0.00 H TER 81369 WAT 7922 ATOM 81369 O WAT 7923 39.422 68.944 123.209 1.00 0.00 O ATOM 81370 H1 WAT 7923 39.103 69.828 123.388 1.00 0.00 H ATOM 81371 H2 WAT 7923 38.651 68.386 123.311 1.00 0.00 H TER 81373 WAT 7923 ATOM 81373 O WAT 7924 56.569 95.093 83.318 1.00 0.00 O ATOM 81374 H1 WAT 7924 56.819 95.125 84.242 1.00 0.00 H ATOM 81375 H2 WAT 7924 55.768 95.615 83.268 1.00 0.00 H TER 81377 WAT 7924 ATOM 81377 O WAT 7925 46.725 5.705 102.585 1.00 0.00 O ATOM 81378 H1 WAT 7925 47.578 6.047 102.853 1.00 0.00 H ATOM 81379 H2 WAT 7925 46.749 5.725 101.628 1.00 0.00 H TER 81381 WAT 7925 ATOM 81381 O WAT 7926 109.918 47.187 151.186 1.00 0.00 O ATOM 81382 H1 WAT 7926 110.641 47.638 150.750 1.00 0.00 H ATOM 81383 H2 WAT 7926 109.548 46.618 150.511 1.00 0.00 H TER 81385 WAT 7926 ATOM 81385 O WAT 7927 7.862 64.185 19.388 1.00 0.00 O ATOM 81386 H1 WAT 7927 8.772 64.293 19.666 1.00 0.00 H ATOM 81387 H2 WAT 7927 7.788 63.258 19.163 1.00 0.00 H TER 81389 WAT 7927 ATOM 81389 O WAT 7928 18.528 6.845 136.883 1.00 0.00 O ATOM 81390 H1 WAT 7928 17.890 7.488 137.194 1.00 0.00 H ATOM 81391 H2 WAT 7928 18.076 6.380 136.178 1.00 0.00 H TER 81393 WAT 7928 ATOM 81393 O WAT 7929 118.939 40.104 1.437 1.00 0.00 O ATOM 81394 H1 WAT 7929 118.422 40.908 1.395 1.00 0.00 H ATOM 81395 H2 WAT 7929 119.651 40.307 2.044 1.00 0.00 H TER 81397 WAT 7929 ATOM 81397 O WAT 7930 23.628 39.819 61.437 1.00 0.00 O ATOM 81398 H1 WAT 7930 24.314 40.393 61.777 1.00 0.00 H ATOM 81399 H2 WAT 7930 24.100 39.064 61.086 1.00 0.00 H TER 81401 WAT 7930 ATOM 81401 O WAT 7931 101.682 129.655 104.218 1.00 0.00 O ATOM 81402 H1 WAT 7931 102.195 129.597 103.412 1.00 0.00 H ATOM 81403 H2 WAT 7931 102.315 129.914 104.887 1.00 0.00 H TER 81405 WAT 7931 ATOM 81405 O WAT 7932 42.345 137.342 142.168 1.00 0.00 O ATOM 81406 H1 WAT 7932 42.640 137.683 141.324 1.00 0.00 H ATOM 81407 H2 WAT 7932 42.768 137.906 142.816 1.00 0.00 H TER 81409 WAT 7932 ATOM 81409 O WAT 7933 83.929 115.523 12.515 1.00 0.00 O ATOM 81410 H1 WAT 7933 83.649 116.364 12.875 1.00 0.00 H ATOM 81411 H2 WAT 7933 83.114 115.056 12.333 1.00 0.00 H TER 81413 WAT 7933 ATOM 81413 O WAT 7934 29.277 32.081 115.406 1.00 0.00 O ATOM 81414 H1 WAT 7934 28.995 32.099 114.491 1.00 0.00 H ATOM 81415 H2 WAT 7934 29.975 31.428 115.429 1.00 0.00 H TER 81417 WAT 7934 ATOM 81417 O WAT 7935 142.572 142.820 70.420 1.00 0.00 O ATOM 81418 H1 WAT 7935 143.114 143.148 71.138 1.00 0.00 H ATOM 81419 H2 WAT 7935 143.163 142.790 69.668 1.00 0.00 H TER 81421 WAT 7935 ATOM 81421 O WAT 7936 44.374 84.781 141.453 1.00 0.00 O ATOM 81422 H1 WAT 7936 44.570 85.661 141.774 1.00 0.00 H ATOM 81423 H2 WAT 7936 43.472 84.835 141.140 1.00 0.00 H TER 81425 WAT 7936 ATOM 81425 O WAT 7937 11.901 9.733 152.556 1.00 0.00 O ATOM 81426 H1 WAT 7937 11.561 9.192 151.843 1.00 0.00 H ATOM 81427 H2 WAT 7937 12.752 10.036 152.241 1.00 0.00 H TER 81429 WAT 7937 ATOM 81429 O WAT 7938 69.309 60.279 70.980 1.00 0.00 O ATOM 81430 H1 WAT 7938 70.154 60.330 70.532 1.00 0.00 H ATOM 81431 H2 WAT 7938 68.732 60.845 70.467 1.00 0.00 H TER 81433 WAT 7938 ATOM 81433 O WAT 7939 12.235 144.914 154.755 1.00 0.00 O ATOM 81434 H1 WAT 7939 13.154 145.169 154.686 1.00 0.00 H ATOM 81435 H2 WAT 7939 11.758 145.743 154.795 1.00 0.00 H TER 81437 WAT 7939 ATOM 81437 O WAT 7940 90.578 37.987 141.476 1.00 0.00 O ATOM 81438 H1 WAT 7940 90.042 37.367 140.981 1.00 0.00 H ATOM 81439 H2 WAT 7940 90.117 38.822 141.394 1.00 0.00 H TER 81441 WAT 7940 ATOM 81441 O WAT 7941 118.470 78.160 71.587 1.00 0.00 O ATOM 81442 H1 WAT 7941 119.047 77.721 70.962 1.00 0.00 H ATOM 81443 H2 WAT 7941 117.644 78.268 71.116 1.00 0.00 H TER 81445 WAT 7941 ATOM 81445 O WAT 7942 81.207 6.978 122.965 1.00 0.00 O ATOM 81446 H1 WAT 7942 80.717 6.994 123.787 1.00 0.00 H ATOM 81447 H2 WAT 7942 81.724 7.784 122.978 1.00 0.00 H TER 81449 WAT 7942 ATOM 81449 O WAT 7943 135.794 145.617 153.759 1.00 0.00 O ATOM 81450 H1 WAT 7943 136.729 145.742 153.924 1.00 0.00 H ATOM 81451 H2 WAT 7943 135.360 146.105 154.458 1.00 0.00 H TER 81453 WAT 7943 ATOM 81453 O WAT 7944 95.599 36.899 73.749 1.00 0.00 O ATOM 81454 H1 WAT 7944 95.477 36.419 74.569 1.00 0.00 H ATOM 81455 H2 WAT 7944 96.428 36.571 73.402 1.00 0.00 H TER 81457 WAT 7944 ATOM 81457 O WAT 7945 51.968 132.146 150.247 1.00 0.00 O ATOM 81458 H1 WAT 7945 51.182 132.394 149.761 1.00 0.00 H ATOM 81459 H2 WAT 7945 52.482 131.631 149.624 1.00 0.00 H TER 81461 WAT 7945 ATOM 81461 O WAT 7946 71.074 133.587 87.000 1.00 0.00 O ATOM 81462 H1 WAT 7946 71.364 132.911 87.613 1.00 0.00 H ATOM 81463 H2 WAT 7946 71.728 133.574 86.302 1.00 0.00 H TER 81465 WAT 7946 ATOM 81465 O WAT 7947 85.962 67.957 113.097 1.00 0.00 O ATOM 81466 H1 WAT 7947 85.222 67.542 112.653 1.00 0.00 H ATOM 81467 H2 WAT 7947 85.636 68.820 113.350 1.00 0.00 H TER 81469 WAT 7947 ATOM 81469 O WAT 7948 57.092 131.822 86.734 1.00 0.00 O ATOM 81470 H1 WAT 7948 57.623 132.328 86.118 1.00 0.00 H ATOM 81471 H2 WAT 7948 56.351 132.393 86.936 1.00 0.00 H TER 81473 WAT 7948 ATOM 81473 O WAT 7949 116.635 127.052 92.541 1.00 0.00 O ATOM 81474 H1 WAT 7949 116.731 127.031 91.589 1.00 0.00 H ATOM 81475 H2 WAT 7949 116.155 127.862 92.716 1.00 0.00 H TER 81477 WAT 7949 ATOM 81477 O WAT 7950 9.206 51.231 150.303 1.00 0.00 O ATOM 81478 H1 WAT 7950 9.443 51.567 149.438 1.00 0.00 H ATOM 81479 H2 WAT 7950 9.882 51.575 150.886 1.00 0.00 H TER 81481 WAT 7950 ATOM 81481 O WAT 7951 50.452 131.876 131.983 1.00 0.00 O ATOM 81482 H1 WAT 7951 50.923 131.735 132.804 1.00 0.00 H ATOM 81483 H2 WAT 7951 50.936 131.360 131.338 1.00 0.00 H TER 81485 WAT 7951 ATOM 81485 O WAT 7952 142.605 129.385 79.013 1.00 0.00 O ATOM 81486 H1 WAT 7952 143.265 128.841 79.441 1.00 0.00 H ATOM 81487 H2 WAT 7952 142.074 128.767 78.510 1.00 0.00 H TER 81489 WAT 7952 ATOM 81489 O WAT 7953 115.310 84.968 84.881 1.00 0.00 O ATOM 81490 H1 WAT 7953 114.963 84.242 84.363 1.00 0.00 H ATOM 81491 H2 WAT 7953 114.859 84.900 85.722 1.00 0.00 H TER 81493 WAT 7953 ATOM 81493 O WAT 7954 101.099 125.180 106.530 1.00 0.00 O ATOM 81494 H1 WAT 7954 102.047 125.155 106.401 1.00 0.00 H ATOM 81495 H2 WAT 7954 100.988 125.455 107.440 1.00 0.00 H TER 81497 WAT 7954 ATOM 81497 O WAT 7955 59.388 5.077 82.312 1.00 0.00 O ATOM 81498 H1 WAT 7955 58.609 5.608 82.147 1.00 0.00 H ATOM 81499 H2 WAT 7955 59.721 4.863 81.441 1.00 0.00 H TER 81501 WAT 7955 ATOM 81501 O WAT 7956 24.505 50.290 150.714 1.00 0.00 O ATOM 81502 H1 WAT 7956 25.413 49.988 150.733 1.00 0.00 H ATOM 81503 H2 WAT 7956 24.005 49.528 150.421 1.00 0.00 H TER 81505 WAT 7956 ATOM 81505 O WAT 7957 30.731 1.885 90.074 1.00 0.00 O ATOM 81506 H1 WAT 7957 31.259 2.501 90.582 1.00 0.00 H ATOM 81507 H2 WAT 7957 29.925 2.364 89.879 1.00 0.00 H TER 81509 WAT 7957 ATOM 81509 O WAT 7958 134.094 108.746 108.755 1.00 0.00 O ATOM 81510 H1 WAT 7958 133.300 108.317 108.437 1.00 0.00 H ATOM 81511 H2 WAT 7958 133.889 108.993 109.657 1.00 0.00 H TER 81513 WAT 7958 ATOM 81513 O WAT 7959 42.449 139.529 71.815 1.00 0.00 O ATOM 81514 H1 WAT 7959 43.232 139.667 72.347 1.00 0.00 H ATOM 81515 H2 WAT 7959 41.911 140.305 71.973 1.00 0.00 H TER 81517 WAT 7959 ATOM 81517 O WAT 7960 17.477 35.790 95.095 1.00 0.00 O ATOM 81518 H1 WAT 7960 17.401 34.896 95.428 1.00 0.00 H ATOM 81519 H2 WAT 7960 18.339 36.084 95.393 1.00 0.00 H TER 81521 WAT 7960 ATOM 81521 O WAT 7961 15.211 128.065 65.499 1.00 0.00 O ATOM 81522 H1 WAT 7961 14.779 128.225 66.338 1.00 0.00 H ATOM 81523 H2 WAT 7961 16.078 128.459 65.597 1.00 0.00 H TER 81525 WAT 7961 ATOM 81525 O WAT 7962 64.165 23.278 145.749 1.00 0.00 O ATOM 81526 H1 WAT 7962 63.469 23.188 145.098 1.00 0.00 H ATOM 81527 H2 WAT 7962 63.851 23.961 146.341 1.00 0.00 H TER 81529 WAT 7962 ATOM 81529 O WAT 7963 105.563 74.304 88.123 1.00 0.00 O ATOM 81530 H1 WAT 7963 104.874 73.643 88.192 1.00 0.00 H ATOM 81531 H2 WAT 7963 105.259 75.026 88.673 1.00 0.00 H TER 81533 WAT 7963 ATOM 81533 O WAT 7964 22.788 91.508 127.084 1.00 0.00 O ATOM 81534 H1 WAT 7964 21.874 91.575 126.810 1.00 0.00 H ATOM 81535 H2 WAT 7964 23.290 91.615 126.276 1.00 0.00 H TER 81537 WAT 7964 ATOM 81537 O WAT 7965 65.623 72.695 126.849 1.00 0.00 O ATOM 81538 H1 WAT 7965 66.511 72.719 127.205 1.00 0.00 H ATOM 81539 H2 WAT 7965 65.587 73.436 126.244 1.00 0.00 H TER 81541 WAT 7965 ATOM 81541 O WAT 7966 32.951 27.074 142.731 1.00 0.00 O ATOM 81542 H1 WAT 7966 33.850 27.157 143.047 1.00 0.00 H ATOM 81543 H2 WAT 7966 32.416 27.458 143.426 1.00 0.00 H TER 81545 WAT 7966 ATOM 81545 O WAT 7967 78.705 72.085 132.113 1.00 0.00 O ATOM 81546 H1 WAT 7967 79.161 72.927 132.116 1.00 0.00 H ATOM 81547 H2 WAT 7967 77.892 72.252 132.590 1.00 0.00 H TER 81549 WAT 7967 ATOM 81549 O WAT 7968 5.804 35.538 15.763 1.00 0.00 O ATOM 81550 H1 WAT 7968 6.532 36.072 16.079 1.00 0.00 H ATOM 81551 H2 WAT 7968 6.195 34.968 15.100 1.00 0.00 H TER 81553 WAT 7968 ATOM 81553 O WAT 7969 18.352 34.054 75.112 1.00 0.00 O ATOM 81554 H1 WAT 7969 19.129 34.598 75.241 1.00 0.00 H ATOM 81555 H2 WAT 7969 17.828 34.193 75.901 1.00 0.00 H TER 81557 WAT 7969 ATOM 81557 O WAT 7970 67.239 94.541 62.381 1.00 0.00 O ATOM 81558 H1 WAT 7970 67.421 94.537 63.320 1.00 0.00 H ATOM 81559 H2 WAT 7970 66.982 93.641 62.182 1.00 0.00 H TER 81561 WAT 7970 ATOM 81561 O WAT 7971 141.807 114.416 87.466 1.00 0.00 O ATOM 81562 H1 WAT 7971 141.213 114.152 86.762 1.00 0.00 H ATOM 81563 H2 WAT 7971 141.258 114.427 88.250 1.00 0.00 H TER 81565 WAT 7971 ATOM 81565 O WAT 7972 53.591 45.240 143.942 1.00 0.00 O ATOM 81566 H1 WAT 7972 54.051 44.464 143.620 1.00 0.00 H ATOM 81567 H2 WAT 7972 52.778 44.899 144.314 1.00 0.00 H TER 81569 WAT 7972 ATOM 81569 O WAT 7973 60.257 59.700 25.296 1.00 0.00 O ATOM 81570 H1 WAT 7973 60.901 59.793 25.998 1.00 0.00 H ATOM 81571 H2 WAT 7973 60.488 58.877 24.866 1.00 0.00 H TER 81573 WAT 7973 ATOM 81573 O WAT 7974 92.734 80.623 61.432 1.00 0.00 O ATOM 81574 H1 WAT 7974 92.402 81.521 61.432 1.00 0.00 H ATOM 81575 H2 WAT 7974 92.134 80.146 60.858 1.00 0.00 H TER 81577 WAT 7974 ATOM 81577 O WAT 7975 45.149 35.295 66.568 1.00 0.00 O ATOM 81578 H1 WAT 7975 45.261 35.102 65.637 1.00 0.00 H ATOM 81579 H2 WAT 7975 45.437 36.203 66.661 1.00 0.00 H TER 81581 WAT 7975 ATOM 81581 O WAT 7976 21.633 95.023 77.061 1.00 0.00 O ATOM 81582 H1 WAT 7976 21.357 95.242 76.171 1.00 0.00 H ATOM 81583 H2 WAT 7976 22.454 94.545 76.947 1.00 0.00 H TER 81585 WAT 7976 ATOM 81585 O WAT 7977 111.786 46.459 6.860 1.00 0.00 O ATOM 81586 H1 WAT 7977 112.159 47.256 6.482 1.00 0.00 H ATOM 81587 H2 WAT 7977 110.887 46.437 6.533 1.00 0.00 H TER 81589 WAT 7977 ATOM 81589 O WAT 7978 28.261 87.556 66.751 1.00 0.00 O ATOM 81590 H1 WAT 7978 28.086 87.669 65.817 1.00 0.00 H ATOM 81591 H2 WAT 7978 27.395 87.470 67.148 1.00 0.00 H TER 81593 WAT 7978 ATOM 81593 O WAT 7979 96.806 52.449 66.765 1.00 0.00 O ATOM 81594 H1 WAT 7979 97.665 52.486 66.345 1.00 0.00 H ATOM 81595 H2 WAT 7979 96.436 53.322 66.632 1.00 0.00 H TER 81597 WAT 7979 ATOM 81597 O WAT 7980 83.753 56.629 70.162 1.00 0.00 O ATOM 81598 H1 WAT 7980 83.601 57.574 70.159 1.00 0.00 H ATOM 81599 H2 WAT 7980 84.706 56.541 70.135 1.00 0.00 H TER 81601 WAT 7980 ATOM 81601 O WAT 7981 13.961 42.244 8.296 1.00 0.00 O ATOM 81602 H1 WAT 7981 14.375 42.705 7.567 1.00 0.00 H ATOM 81603 H2 WAT 7981 13.261 41.733 7.891 1.00 0.00 H TER 81605 WAT 7981 ATOM 81605 O WAT 7982 81.921 84.743 135.398 1.00 0.00 O ATOM 81606 H1 WAT 7982 81.140 85.282 135.272 1.00 0.00 H ATOM 81607 H2 WAT 7982 81.602 83.959 135.846 1.00 0.00 H TER 81609 WAT 7982 ATOM 81609 O WAT 7983 53.639 0.247 132.470 1.00 0.00 O ATOM 81610 H1 WAT 7983 53.649 1.046 132.998 1.00 0.00 H ATOM 81611 H2 WAT 7983 54.046 0.502 131.642 1.00 0.00 H TER 81613 WAT 7983 ATOM 81613 O WAT 7984 47.628 77.444 130.631 1.00 0.00 O ATOM 81614 H1 WAT 7984 47.616 78.292 131.076 1.00 0.00 H ATOM 81615 H2 WAT 7984 47.410 77.648 129.722 1.00 0.00 H TER 81617 WAT 7984 ATOM 81617 O WAT 7985 136.906 22.343 96.729 1.00 0.00 O ATOM 81618 H1 WAT 7985 137.258 21.611 96.223 1.00 0.00 H ATOM 81619 H2 WAT 7985 136.791 21.991 97.611 1.00 0.00 H TER 81621 WAT 7985 ATOM 81621 O WAT 7986 61.146 130.695 139.904 1.00 0.00 O ATOM 81622 H1 WAT 7986 60.318 131.122 139.685 1.00 0.00 H ATOM 81623 H2 WAT 7986 61.814 131.352 139.707 1.00 0.00 H TER 81625 WAT 7986 ATOM 81625 O WAT 7987 119.068 83.393 108.963 1.00 0.00 O ATOM 81626 H1 WAT 7987 119.006 83.210 108.026 1.00 0.00 H ATOM 81627 H2 WAT 7987 118.666 82.632 109.383 1.00 0.00 H TER 81629 WAT 7987 ATOM 81629 O WAT 7988 26.719 125.289 83.206 1.00 0.00 O ATOM 81630 H1 WAT 7988 26.873 125.086 84.129 1.00 0.00 H ATOM 81631 H2 WAT 7988 27.503 125.763 82.930 1.00 0.00 H TER 81633 WAT 7988 ATOM 81633 O WAT 7989 125.980 68.668 66.642 1.00 0.00 O ATOM 81634 H1 WAT 7989 126.167 69.469 67.132 1.00 0.00 H ATOM 81635 H2 WAT 7989 125.557 68.971 65.839 1.00 0.00 H TER 81637 WAT 7989 ATOM 81637 O WAT 7990 72.108 98.870 68.021 1.00 0.00 O ATOM 81638 H1 WAT 7990 71.760 99.239 68.833 1.00 0.00 H ATOM 81639 H2 WAT 7990 72.567 98.077 68.296 1.00 0.00 H TER 81641 WAT 7990 ATOM 81641 O WAT 7991 37.127 64.434 11.715 1.00 0.00 O ATOM 81642 H1 WAT 7991 37.668 64.192 12.467 1.00 0.00 H ATOM 81643 H2 WAT 7991 37.711 64.349 10.962 1.00 0.00 H TER 81645 WAT 7991 ATOM 81645 O WAT 7992 144.905 2.877 99.088 1.00 0.00 O ATOM 81646 H1 WAT 7992 145.209 2.894 99.996 1.00 0.00 H ATOM 81647 H2 WAT 7992 145.217 2.039 98.747 1.00 0.00 H TER 81649 WAT 7992 ATOM 81649 O WAT 7993 122.954 49.984 103.558 1.00 0.00 O ATOM 81650 H1 WAT 7993 123.897 49.985 103.723 1.00 0.00 H ATOM 81651 H2 WAT 7993 122.814 50.719 102.961 1.00 0.00 H TER 81653 WAT 7993 ATOM 81653 O WAT 7994 117.644 124.171 154.833 1.00 0.00 O ATOM 81654 H1 WAT 7994 118.322 124.750 155.181 1.00 0.00 H ATOM 81655 H2 WAT 7994 117.192 123.839 155.608 1.00 0.00 H TER 81657 WAT 7994 ATOM 81657 O WAT 7995 98.551 60.851 131.709 1.00 0.00 O ATOM 81658 H1 WAT 7995 99.097 60.160 131.334 1.00 0.00 H ATOM 81659 H2 WAT 7995 97.908 60.385 132.243 1.00 0.00 H TER 81661 WAT 7995 ATOM 81661 O WAT 7996 106.091 45.849 117.181 1.00 0.00 O ATOM 81662 H1 WAT 7996 106.764 45.583 117.807 1.00 0.00 H ATOM 81663 H2 WAT 7996 106.295 46.763 116.983 1.00 0.00 H TER 81665 WAT 7996 ATOM 81665 O WAT 7997 9.652 92.610 9.741 1.00 0.00 O ATOM 81666 H1 WAT 7997 9.720 91.715 10.073 1.00 0.00 H ATOM 81667 H2 WAT 7997 8.856 92.608 9.210 1.00 0.00 H TER 81669 WAT 7997 ATOM 81669 O WAT 7998 9.708 9.106 79.645 1.00 0.00 O ATOM 81670 H1 WAT 7998 9.545 8.639 78.825 1.00 0.00 H ATOM 81671 H2 WAT 7998 10.623 8.917 79.852 1.00 0.00 H TER 81673 WAT 7998 ATOM 81673 O WAT 7999 17.661 37.870 20.267 1.00 0.00 O ATOM 81674 H1 WAT 7999 17.826 38.805 20.390 1.00 0.00 H ATOM 81675 H2 WAT 7999 18.428 37.439 20.645 1.00 0.00 H TER 81677 WAT 7999 ATOM 81677 O WAT 8000 46.770 32.931 9.642 1.00 0.00 O ATOM 81678 H1 WAT 8000 46.221 32.345 9.121 1.00 0.00 H ATOM 81679 H2 WAT 8000 47.626 32.504 9.661 1.00 0.00 H TER 81681 WAT 8000 ATOM 81681 O WAT 8001 144.310 36.138 112.058 1.00 0.00 O ATOM 81682 H1 WAT 8001 144.521 35.213 112.184 1.00 0.00 H ATOM 81683 H2 WAT 8001 143.692 36.341 112.760 1.00 0.00 H TER 81685 WAT 8001 ATOM 81685 O WAT 8002 81.494 34.521 106.713 1.00 0.00 O ATOM 81686 H1 WAT 8002 82.034 34.104 107.384 1.00 0.00 H ATOM 81687 H2 WAT 8002 80.605 34.486 107.066 1.00 0.00 H TER 81689 WAT 8002 ATOM 81689 O WAT 8003 110.265 66.875 104.925 1.00 0.00 O ATOM 81690 H1 WAT 8003 111.208 66.940 105.072 1.00 0.00 H ATOM 81691 H2 WAT 8003 109.994 66.113 105.437 1.00 0.00 H TER 81693 WAT 8003 ATOM 81693 O WAT 8004 33.014 78.016 86.334 1.00 0.00 O ATOM 81694 H1 WAT 8004 33.386 78.128 87.209 1.00 0.00 H ATOM 81695 H2 WAT 8004 32.076 78.168 86.451 1.00 0.00 H TER 81697 WAT 8004 ATOM 81697 O WAT 8005 70.971 1.992 9.256 1.00 0.00 O ATOM 81698 H1 WAT 8005 70.208 2.298 9.747 1.00 0.00 H ATOM 81699 H2 WAT 8005 71.032 2.589 8.511 1.00 0.00 H TER 81701 WAT 8005 ATOM 81701 O WAT 8006 75.349 14.410 145.264 1.00 0.00 O ATOM 81702 H1 WAT 8006 74.822 15.195 145.413 1.00 0.00 H ATOM 81703 H2 WAT 8006 75.930 14.646 144.540 1.00 0.00 H TER 81705 WAT 8006 ATOM 81705 O WAT 8007 21.070 133.965 95.667 1.00 0.00 O ATOM 81706 H1 WAT 8007 20.644 133.432 94.997 1.00 0.00 H ATOM 81707 H2 WAT 8007 21.998 133.740 95.599 1.00 0.00 H TER 81709 WAT 8007 ATOM 81709 O WAT 8008 57.862 98.610 84.248 1.00 0.00 O ATOM 81710 H1 WAT 8008 57.505 99.100 84.988 1.00 0.00 H ATOM 81711 H2 WAT 8008 58.288 97.851 84.646 1.00 0.00 H TER 81713 WAT 8008 ATOM 81713 O WAT 8009 110.341 18.859 154.332 1.00 0.00 O ATOM 81714 H1 WAT 8009 110.615 17.942 154.301 1.00 0.00 H ATOM 81715 H2 WAT 8009 109.940 19.018 153.478 1.00 0.00 H TER 81717 WAT 8009 ATOM 81717 O WAT 8010 33.669 77.313 155.018 1.00 0.00 O ATOM 81718 H1 WAT 8010 32.894 76.878 154.660 1.00 0.00 H ATOM 81719 H2 WAT 8010 33.512 77.343 155.962 1.00 0.00 H TER 81721 WAT 8010 ATOM 81721 O WAT 8011 114.345 134.820 108.632 1.00 0.00 O ATOM 81722 H1 WAT 8011 115.097 134.710 109.214 1.00 0.00 H ATOM 81723 H2 WAT 8011 114.681 135.345 107.905 1.00 0.00 H TER 81725 WAT 8011 ATOM 81725 O WAT 8012 139.848 103.853 130.557 1.00 0.00 O ATOM 81726 H1 WAT 8012 138.995 104.287 130.531 1.00 0.00 H ATOM 81727 H2 WAT 8012 139.786 103.163 129.895 1.00 0.00 H TER 81729 WAT 8012 ATOM 81729 O WAT 8013 88.031 6.169 84.117 1.00 0.00 O ATOM 81730 H1 WAT 8013 87.879 5.775 84.975 1.00 0.00 H ATOM 81731 H2 WAT 8013 87.600 5.577 83.501 1.00 0.00 H TER 81733 WAT 8013 ATOM 81733 O WAT 8014 112.004 93.549 76.024 1.00 0.00 O ATOM 81734 H1 WAT 8014 111.561 93.292 75.216 1.00 0.00 H ATOM 81735 H2 WAT 8014 112.544 94.299 75.773 1.00 0.00 H TER 81737 WAT 8014 ATOM 81737 O WAT 8015 36.768 59.373 68.706 1.00 0.00 O ATOM 81738 H1 WAT 8015 37.609 59.691 68.377 1.00 0.00 H ATOM 81739 H2 WAT 8015 36.291 59.103 67.922 1.00 0.00 H TER 81741 WAT 8015 ATOM 81741 O WAT 8016 59.912 110.796 8.488 1.00 0.00 O ATOM 81742 H1 WAT 8016 59.318 111.433 8.886 1.00 0.00 H ATOM 81743 H2 WAT 8016 59.664 110.783 7.564 1.00 0.00 H TER 81745 WAT 8016 ATOM 81745 O WAT 8017 49.220 18.612 135.229 1.00 0.00 O ATOM 81746 H1 WAT 8017 49.714 18.637 136.049 1.00 0.00 H ATOM 81747 H2 WAT 8017 48.489 19.213 135.372 1.00 0.00 H TER 81749 WAT 8017 ATOM 81749 O WAT 8018 36.899 85.257 105.221 1.00 0.00 O ATOM 81750 H1 WAT 8018 37.735 84.799 105.301 1.00 0.00 H ATOM 81751 H2 WAT 8018 36.334 84.644 104.751 1.00 0.00 H TER 81753 WAT 8018 ATOM 81753 O WAT 8019 42.372 123.450 80.748 1.00 0.00 O ATOM 81754 H1 WAT 8019 42.343 122.664 80.202 1.00 0.00 H ATOM 81755 H2 WAT 8019 41.492 123.820 80.680 1.00 0.00 H TER 81757 WAT 8019 ATOM 81757 O WAT 8020 125.377 133.780 10.547 1.00 0.00 O ATOM 81758 H1 WAT 8020 124.964 134.625 10.723 1.00 0.00 H ATOM 81759 H2 WAT 8020 125.879 133.921 9.745 1.00 0.00 H TER 81761 WAT 8020 ATOM 81761 O WAT 8021 138.291 26.808 20.858 1.00 0.00 O ATOM 81762 H1 WAT 8021 137.643 27.260 20.318 1.00 0.00 H ATOM 81763 H2 WAT 8021 137.778 26.390 21.550 1.00 0.00 H TER 81765 WAT 8021 ATOM 81765 O WAT 8022 1.586 62.872 87.503 1.00 0.00 O ATOM 81766 H1 WAT 8022 2.176 62.670 86.776 1.00 0.00 H ATOM 81767 H2 WAT 8022 0.801 62.353 87.326 1.00 0.00 H TER 81769 WAT 8022 ATOM 81769 O WAT 8023 102.000 82.757 79.617 1.00 0.00 O ATOM 81770 H1 WAT 8023 101.339 82.567 78.951 1.00 0.00 H ATOM 81771 H2 WAT 8023 101.586 82.510 80.444 1.00 0.00 H TER 81773 WAT 8023 ATOM 81773 O WAT 8024 133.985 106.401 8.040 1.00 0.00 O ATOM 81774 H1 WAT 8024 133.043 106.300 7.897 1.00 0.00 H ATOM 81775 H2 WAT 8024 134.101 106.254 8.979 1.00 0.00 H TER 81777 WAT 8024 ATOM 81777 O WAT 8025 26.168 130.433 106.169 1.00 0.00 O ATOM 81778 H1 WAT 8025 25.895 130.978 106.907 1.00 0.00 H ATOM 81779 H2 WAT 8025 26.800 130.973 105.694 1.00 0.00 H TER 81781 WAT 8025 ATOM 81781 O WAT 8026 17.617 26.897 138.162 1.00 0.00 O ATOM 81782 H1 WAT 8026 18.436 27.369 138.313 1.00 0.00 H ATOM 81783 H2 WAT 8026 17.803 26.327 137.415 1.00 0.00 H TER 81785 WAT 8026 ATOM 81785 O WAT 8027 101.080 38.456 3.107 1.00 0.00 O ATOM 81786 H1 WAT 8027 101.617 38.604 3.886 1.00 0.00 H ATOM 81787 H2 WAT 8027 101.172 37.520 2.928 1.00 0.00 H TER 81789 WAT 8027 ATOM 81789 O WAT 8028 135.939 33.746 74.516 1.00 0.00 O ATOM 81790 H1 WAT 8028 135.985 33.160 75.272 1.00 0.00 H ATOM 81791 H2 WAT 8028 135.002 33.853 74.354 1.00 0.00 H TER 81793 WAT 8028 ATOM 81793 O WAT 8029 37.057 87.930 22.490 1.00 0.00 O ATOM 81794 H1 WAT 8029 36.690 87.148 22.078 1.00 0.00 H ATOM 81795 H2 WAT 8029 36.295 88.476 22.687 1.00 0.00 H TER 81797 WAT 8029 ATOM 81797 O WAT 8030 112.634 114.390 95.573 1.00 0.00 O ATOM 81798 H1 WAT 8030 112.150 113.857 94.942 1.00 0.00 H ATOM 81799 H2 WAT 8030 113.550 114.298 95.310 1.00 0.00 H TER 81801 WAT 8030 ATOM 81801 O WAT 8031 60.692 24.948 65.331 1.00 0.00 O ATOM 81802 H1 WAT 8031 60.143 24.564 66.015 1.00 0.00 H ATOM 81803 H2 WAT 8031 61.239 25.585 65.791 1.00 0.00 H TER 81805 WAT 8031 ATOM 81805 O WAT 8032 107.526 102.946 136.148 1.00 0.00 O ATOM 81806 H1 WAT 8032 107.337 102.120 136.592 1.00 0.00 H ATOM 81807 H2 WAT 8032 108.126 103.403 136.738 1.00 0.00 H TER 81809 WAT 8032 ATOM 81809 O WAT 8033 27.502 90.941 113.997 1.00 0.00 O ATOM 81810 H1 WAT 8033 28.432 90.804 113.816 1.00 0.00 H ATOM 81811 H2 WAT 8033 27.053 90.566 113.240 1.00 0.00 H TER 81813 WAT 8033 ATOM 81813 O WAT 8034 10.539 117.064 63.206 1.00 0.00 O ATOM 81814 H1 WAT 8034 10.146 116.649 62.438 1.00 0.00 H ATOM 81815 H2 WAT 8034 10.006 116.760 63.941 1.00 0.00 H TER 81817 WAT 8034 ATOM 81817 O WAT 8035 137.610 67.171 157.723 1.00 0.00 O ATOM 81818 H1 WAT 8035 137.477 68.018 157.296 1.00 0.00 H ATOM 81819 H2 WAT 8035 137.951 67.390 158.590 1.00 0.00 H TER 81821 WAT 8035 ATOM 81821 O WAT 8036 97.962 82.441 99.117 1.00 0.00 O ATOM 81822 H1 WAT 8036 97.920 81.548 98.775 1.00 0.00 H ATOM 81823 H2 WAT 8036 97.373 82.436 99.872 1.00 0.00 H TER 81825 WAT 8036 ATOM 81825 O WAT 8037 101.276 80.385 101.776 1.00 0.00 O ATOM 81826 H1 WAT 8037 100.490 80.492 102.313 1.00 0.00 H ATOM 81827 H2 WAT 8037 101.888 79.911 102.339 1.00 0.00 H TER 81829 WAT 8037 ATOM 81829 O WAT 8038 37.523 117.050 76.647 1.00 0.00 O ATOM 81830 H1 WAT 8038 36.740 117.236 77.165 1.00 0.00 H ATOM 81831 H2 WAT 8038 37.814 116.191 76.954 1.00 0.00 H TER 81833 WAT 8038 ATOM 81833 O WAT 8039 102.764 72.116 109.905 1.00 0.00 O ATOM 81834 H1 WAT 8039 103.575 72.549 110.173 1.00 0.00 H ATOM 81835 H2 WAT 8039 102.916 71.189 110.088 1.00 0.00 H TER 81837 WAT 8039 ATOM 81837 O WAT 8040 43.493 126.360 70.357 1.00 0.00 O ATOM 81838 H1 WAT 8040 42.655 126.678 70.022 1.00 0.00 H ATOM 81839 H2 WAT 8040 43.439 125.408 70.273 1.00 0.00 H TER 81841 WAT 8040 ATOM 81841 O WAT 8041 109.339 16.796 52.027 1.00 0.00 O ATOM 81842 H1 WAT 8041 110.255 17.024 51.863 1.00 0.00 H ATOM 81843 H2 WAT 8041 108.947 17.604 52.358 1.00 0.00 H TER 81845 WAT 8041 ATOM 81845 O WAT 8042 51.856 95.107 61.935 1.00 0.00 O ATOM 81846 H1 WAT 8042 51.532 95.834 62.468 1.00 0.00 H ATOM 81847 H2 WAT 8042 52.752 95.356 61.709 1.00 0.00 H TER 81849 WAT 8042 ATOM 81849 O WAT 8043 7.448 126.923 129.208 1.00 0.00 O ATOM 81850 H1 WAT 8043 6.497 126.969 129.298 1.00 0.00 H ATOM 81851 H2 WAT 8043 7.605 127.005 128.268 1.00 0.00 H TER 81853 WAT 8043 ATOM 81853 O WAT 8044 142.207 134.392 2.127 1.00 0.00 O ATOM 81854 H1 WAT 8044 141.764 134.616 2.946 1.00 0.00 H ATOM 81855 H2 WAT 8044 141.500 134.135 1.535 1.00 0.00 H TER 81857 WAT 8044 ATOM 81857 O WAT 8045 55.542 129.157 58.398 1.00 0.00 O ATOM 81858 H1 WAT 8045 55.243 128.352 58.819 1.00 0.00 H ATOM 81859 H2 WAT 8045 56.374 128.918 57.988 1.00 0.00 H TER 81861 WAT 8045 ATOM 81861 O WAT 8046 126.715 16.379 1.426 1.00 0.00 O ATOM 81862 H1 WAT 8046 127.316 15.678 1.172 1.00 0.00 H ATOM 81863 H2 WAT 8046 126.525 16.839 0.609 1.00 0.00 H TER 81865 WAT 8046 ATOM 81865 O WAT 8047 111.256 67.341 82.860 1.00 0.00 O ATOM 81866 H1 WAT 8047 111.495 66.483 82.509 1.00 0.00 H ATOM 81867 H2 WAT 8047 110.342 67.243 83.127 1.00 0.00 H TER 81869 WAT 8047 ATOM 81869 O WAT 8048 114.345 145.438 135.217 1.00 0.00 O ATOM 81870 H1 WAT 8048 115.097 145.919 134.871 1.00 0.00 H ATOM 81871 H2 WAT 8048 113.950 146.037 135.851 1.00 0.00 H TER 81873 WAT 8048 ATOM 81873 O WAT 8049 112.439 16.680 124.369 1.00 0.00 O ATOM 81874 H1 WAT 8049 111.869 16.306 125.041 1.00 0.00 H ATOM 81875 H2 WAT 8049 111.881 16.751 123.595 1.00 0.00 H TER 81877 WAT 8049 ATOM 81877 O WAT 8050 17.888 74.208 102.127 1.00 0.00 O ATOM 81878 H1 WAT 8050 17.513 75.022 101.789 1.00 0.00 H ATOM 81879 H2 WAT 8050 17.529 73.526 101.559 1.00 0.00 H TER 81881 WAT 8050 ATOM 81881 O WAT 8051 138.117 3.828 151.934 1.00 0.00 O ATOM 81882 H1 WAT 8051 138.099 2.907 151.671 1.00 0.00 H ATOM 81883 H2 WAT 8051 138.584 3.830 152.770 1.00 0.00 H TER 81885 WAT 8051 ATOM 81885 O WAT 8052 44.347 132.944 123.165 1.00 0.00 O ATOM 81886 H1 WAT 8052 44.423 133.420 123.992 1.00 0.00 H ATOM 81887 H2 WAT 8052 44.397 133.623 122.492 1.00 0.00 H TER 81889 WAT 8052 ATOM 81889 O WAT 8053 118.418 105.234 120.533 1.00 0.00 O ATOM 81890 H1 WAT 8053 119.118 104.890 121.089 1.00 0.00 H ATOM 81891 H2 WAT 8053 118.783 106.035 120.157 1.00 0.00 H TER 81893 WAT 8053 ATOM 81893 O WAT 8054 36.008 90.517 135.700 1.00 0.00 O ATOM 81894 H1 WAT 8054 35.760 90.692 134.792 1.00 0.00 H ATOM 81895 H2 WAT 8054 36.598 91.234 135.929 1.00 0.00 H TER 81897 WAT 8054 ATOM 81897 O WAT 8055 51.294 34.594 130.677 1.00 0.00 O ATOM 81898 H1 WAT 8055 51.148 34.732 131.613 1.00 0.00 H ATOM 81899 H2 WAT 8055 52.052 34.012 130.636 1.00 0.00 H TER 81901 WAT 8055 ATOM 81901 O WAT 8056 57.631 24.194 97.377 1.00 0.00 O ATOM 81902 H1 WAT 8056 58.402 24.009 96.840 1.00 0.00 H ATOM 81903 H2 WAT 8056 57.773 25.084 97.701 1.00 0.00 H TER 81905 WAT 8056 ATOM 81905 O WAT 8057 39.560 142.370 1.532 1.00 0.00 O ATOM 81906 H1 WAT 8057 40.264 141.741 1.375 1.00 0.00 H ATOM 81907 H2 WAT 8057 38.990 142.287 0.768 1.00 0.00 H TER 81909 WAT 8057 ATOM 81909 O WAT 8058 113.433 120.422 18.506 1.00 0.00 O ATOM 81910 H1 WAT 8058 114.381 120.495 18.394 1.00 0.00 H ATOM 81911 H2 WAT 8058 113.321 120.090 19.397 1.00 0.00 H TER 81913 WAT 8058 ATOM 81913 O WAT 8059 57.040 123.142 119.926 1.00 0.00 O ATOM 81914 H1 WAT 8059 57.768 122.524 119.982 1.00 0.00 H ATOM 81915 H2 WAT 8059 56.712 123.045 119.031 1.00 0.00 H TER 81917 WAT 8059 ATOM 81917 O WAT 8060 135.052 56.995 6.579 1.00 0.00 O ATOM 81918 H1 WAT 8060 135.416 57.720 6.072 1.00 0.00 H ATOM 81919 H2 WAT 8060 135.814 56.481 6.844 1.00 0.00 H TER 81921 WAT 8060 ATOM 81921 O WAT 8061 101.892 121.312 139.411 1.00 0.00 O ATOM 81922 H1 WAT 8061 102.783 121.559 139.167 1.00 0.00 H ATOM 81923 H2 WAT 8061 101.966 120.401 139.697 1.00 0.00 H TER 81925 WAT 8061 ATOM 81925 O WAT 8062 30.778 19.546 72.452 1.00 0.00 O ATOM 81926 H1 WAT 8062 31.359 19.087 71.846 1.00 0.00 H ATOM 81927 H2 WAT 8062 31.247 19.536 73.287 1.00 0.00 H TER 81929 WAT 8062 ATOM 81929 O WAT 8063 135.319 17.582 157.269 1.00 0.00 O ATOM 81930 H1 WAT 8063 135.727 18.033 156.529 1.00 0.00 H ATOM 81931 H2 WAT 8063 134.594 17.092 156.881 1.00 0.00 H TER 81933 WAT 8063 ATOM 81933 O WAT 8064 50.267 144.028 138.881 1.00 0.00 O ATOM 81934 H1 WAT 8064 51.082 143.628 138.579 1.00 0.00 H ATOM 81935 H2 WAT 8064 49.738 143.292 139.187 1.00 0.00 H TER 81937 WAT 8064 ATOM 81937 O WAT 8065 108.349 88.178 116.314 1.00 0.00 O ATOM 81938 H1 WAT 8065 109.026 88.097 115.641 1.00 0.00 H ATOM 81939 H2 WAT 8065 107.968 87.302 116.376 1.00 0.00 H TER 81941 WAT 8065 ATOM 81941 O WAT 8066 143.952 52.653 11.476 1.00 0.00 O ATOM 81942 H1 WAT 8066 144.377 52.299 12.258 1.00 0.00 H ATOM 81943 H2 WAT 8066 143.024 52.695 11.705 1.00 0.00 H TER 81945 WAT 8066 ATOM 81945 O WAT 8067 121.862 145.310 131.167 1.00 0.00 O ATOM 81946 H1 WAT 8067 121.032 145.195 131.630 1.00 0.00 H ATOM 81947 H2 WAT 8067 121.853 146.225 130.885 1.00 0.00 H TER 81949 WAT 8067 ATOM 81949 O WAT 8068 1.753 7.868 118.157 1.00 0.00 O ATOM 81950 H1 WAT 8068 0.848 8.151 118.286 1.00 0.00 H ATOM 81951 H2 WAT 8068 1.837 7.080 118.693 1.00 0.00 H TER 81953 WAT 8068 ATOM 81953 O WAT 8069 123.495 72.257 60.798 1.00 0.00 O ATOM 81954 H1 WAT 8069 123.580 73.173 61.065 1.00 0.00 H ATOM 81955 H2 WAT 8069 122.624 72.000 61.098 1.00 0.00 H TER 81957 WAT 8069 ATOM 81957 O WAT 8070 125.598 80.887 120.983 1.00 0.00 O ATOM 81958 H1 WAT 8070 125.597 81.373 121.808 1.00 0.00 H ATOM 81959 H2 WAT 8070 125.969 81.497 120.346 1.00 0.00 H TER 81961 WAT 8070 ATOM 81961 O WAT 8071 17.837 54.305 143.776 1.00 0.00 O ATOM 81962 H1 WAT 8071 18.114 54.845 144.517 1.00 0.00 H ATOM 81963 H2 WAT 8071 18.345 53.499 143.865 1.00 0.00 H TER 81965 WAT 8071 ATOM 81965 O WAT 8072 98.978 104.062 23.423 1.00 0.00 O ATOM 81966 H1 WAT 8072 99.424 104.909 23.399 1.00 0.00 H ATOM 81967 H2 WAT 8072 98.708 103.959 24.335 1.00 0.00 H TER 81969 WAT 8072 ATOM 81969 O WAT 8073 18.867 20.399 74.166 1.00 0.00 O ATOM 81970 H1 WAT 8073 19.306 20.267 75.006 1.00 0.00 H ATOM 81971 H2 WAT 8073 18.098 20.928 74.378 1.00 0.00 H TER 81973 WAT 8073 ATOM 81973 O WAT 8074 138.928 60.045 151.418 1.00 0.00 O ATOM 81974 H1 WAT 8074 138.669 59.154 151.179 1.00 0.00 H ATOM 81975 H2 WAT 8074 139.370 60.383 150.639 1.00 0.00 H TER 81977 WAT 8074 ATOM 81977 O WAT 8075 116.302 37.953 6.486 1.00 0.00 O ATOM 81978 H1 WAT 8075 115.655 38.331 7.081 1.00 0.00 H ATOM 81979 H2 WAT 8075 116.973 37.588 7.063 1.00 0.00 H TER 81981 WAT 8075 ATOM 81981 O WAT 8076 35.132 134.144 73.518 1.00 0.00 O ATOM 81982 H1 WAT 8076 35.935 134.446 73.093 1.00 0.00 H ATOM 81983 H2 WAT 8076 35.430 133.744 74.335 1.00 0.00 H TER 81985 WAT 8076 ATOM 81985 O WAT 8077 59.257 129.253 65.793 1.00 0.00 O ATOM 81986 H1 WAT 8077 59.070 129.292 64.855 1.00 0.00 H ATOM 81987 H2 WAT 8077 58.712 128.535 66.116 1.00 0.00 H TER 81989 WAT 8077 ATOM 81989 O WAT 8078 23.796 142.674 154.848 1.00 0.00 O ATOM 81990 H1 WAT 8078 24.078 142.740 155.760 1.00 0.00 H ATOM 81991 H2 WAT 8078 24.006 141.774 154.597 1.00 0.00 H TER 81993 WAT 8078 ATOM 81993 O WAT 8079 140.603 80.179 6.447 1.00 0.00 O ATOM 81994 H1 WAT 8079 140.879 80.380 7.341 1.00 0.00 H ATOM 81995 H2 WAT 8079 139.917 79.520 6.550 1.00 0.00 H TER 81997 WAT 8079 ATOM 81997 O WAT 8080 120.099 85.023 152.284 1.00 0.00 O ATOM 81998 H1 WAT 8080 120.272 84.092 152.146 1.00 0.00 H ATOM 81999 H2 WAT 8080 120.885 85.351 152.722 1.00 0.00 H TER 82001 WAT 8080 ATOM 82001 O WAT 8081 109.841 65.896 72.659 1.00 0.00 O ATOM 82002 H1 WAT 8081 109.251 66.650 72.658 1.00 0.00 H ATOM 82003 H2 WAT 8081 109.261 65.139 72.740 1.00 0.00 H TER 82005 WAT 8081 ATOM 82005 O WAT 8082 134.539 98.885 115.474 1.00 0.00 O ATOM 82006 H1 WAT 8082 134.977 99.484 116.079 1.00 0.00 H ATOM 82007 H2 WAT 8082 133.999 99.453 114.924 1.00 0.00 H TER 82009 WAT 8082 ATOM 82009 O WAT 8083 82.603 106.277 5.342 1.00 0.00 O ATOM 82010 H1 WAT 8083 82.474 106.809 6.127 1.00 0.00 H ATOM 82011 H2 WAT 8083 81.770 106.334 4.875 1.00 0.00 H TER 82013 WAT 8083 ATOM 82013 O WAT 8084 26.033 4.110 55.442 1.00 0.00 O ATOM 82014 H1 WAT 8084 26.699 4.755 55.203 1.00 0.00 H ATOM 82015 H2 WAT 8084 26.142 3.406 54.804 1.00 0.00 H TER 82017 WAT 8084 ATOM 82017 O WAT 8085 7.712 123.697 2.079 1.00 0.00 O ATOM 82018 H1 WAT 8085 8.597 123.704 2.444 1.00 0.00 H ATOM 82019 H2 WAT 8085 7.720 122.981 1.444 1.00 0.00 H TER 82021 WAT 8085 ATOM 82021 O WAT 8086 46.120 99.276 126.652 1.00 0.00 O ATOM 82022 H1 WAT 8086 45.917 98.452 127.093 1.00 0.00 H ATOM 82023 H2 WAT 8086 45.723 99.188 125.785 1.00 0.00 H TER 82025 WAT 8086 ATOM 82025 O WAT 8087 30.489 79.035 78.531 1.00 0.00 O ATOM 82026 H1 WAT 8087 30.885 79.376 79.334 1.00 0.00 H ATOM 82027 H2 WAT 8087 29.699 78.584 78.827 1.00 0.00 H TER 82029 WAT 8087 ATOM 82029 O WAT 8088 79.454 120.390 155.562 1.00 0.00 O ATOM 82030 H1 WAT 8088 79.977 120.891 156.187 1.00 0.00 H ATOM 82031 H2 WAT 8088 78.607 120.277 155.994 1.00 0.00 H TER 82033 WAT 8088 ATOM 82033 O WAT 8089 72.900 39.657 1.187 1.00 0.00 O ATOM 82034 H1 WAT 8089 71.945 39.588 1.159 1.00 0.00 H ATOM 82035 H2 WAT 8089 73.087 40.528 0.837 1.00 0.00 H TER 82037 WAT 8089 ATOM 82037 O WAT 8090 123.037 44.889 98.238 1.00 0.00 O ATOM 82038 H1 WAT 8090 123.252 43.969 98.388 1.00 0.00 H ATOM 82039 H2 WAT 8090 122.508 45.138 98.996 1.00 0.00 H TER 82041 WAT 8090 ATOM 82041 O WAT 8091 60.423 141.421 120.513 1.00 0.00 O ATOM 82042 H1 WAT 8091 60.124 141.608 121.403 1.00 0.00 H ATOM 82043 H2 WAT 8091 59.808 140.764 120.187 1.00 0.00 H TER 82045 WAT 8091 ATOM 82045 O WAT 8092 112.239 18.130 6.685 1.00 0.00 O ATOM 82046 H1 WAT 8092 112.268 18.343 5.752 1.00 0.00 H ATOM 82047 H2 WAT 8092 111.442 17.610 6.787 1.00 0.00 H TER 82049 WAT 8092 ATOM 82049 O WAT 8093 89.154 115.787 12.937 1.00 0.00 O ATOM 82050 H1 WAT 8093 88.779 115.553 13.785 1.00 0.00 H ATOM 82051 H2 WAT 8093 89.732 115.056 12.720 1.00 0.00 H TER 82053 WAT 8093 ATOM 82053 O WAT 8094 107.311 59.472 70.133 1.00 0.00 O ATOM 82054 H1 WAT 8094 106.934 59.126 69.325 1.00 0.00 H ATOM 82055 H2 WAT 8094 106.850 60.298 70.278 1.00 0.00 H TER 82057 WAT 8094 ATOM 82057 O WAT 8095 67.087 27.533 109.007 1.00 0.00 O ATOM 82058 H1 WAT 8095 66.163 27.320 108.875 1.00 0.00 H ATOM 82059 H2 WAT 8095 67.346 27.014 109.768 1.00 0.00 H TER 82061 WAT 8095 ATOM 82061 O WAT 8096 25.576 92.371 85.957 1.00 0.00 O ATOM 82062 H1 WAT 8096 25.491 92.222 86.899 1.00 0.00 H ATOM 82063 H2 WAT 8096 26.046 93.202 85.888 1.00 0.00 H TER 82065 WAT 8096 ATOM 82065 O WAT 8097 48.704 28.947 118.346 1.00 0.00 O ATOM 82066 H1 WAT 8097 47.870 28.529 118.557 1.00 0.00 H ATOM 82067 H2 WAT 8097 49.051 29.229 119.193 1.00 0.00 H TER 82069 WAT 8097 ATOM 82069 O WAT 8098 96.577 46.236 95.774 1.00 0.00 O ATOM 82070 H1 WAT 8098 95.884 45.938 95.185 1.00 0.00 H ATOM 82071 H2 WAT 8098 96.772 47.127 95.484 1.00 0.00 H TER 82073 WAT 8098 ATOM 82073 O WAT 8099 75.556 126.371 65.958 1.00 0.00 O ATOM 82074 H1 WAT 8099 75.744 127.309 65.934 1.00 0.00 H ATOM 82075 H2 WAT 8099 76.188 125.984 65.352 1.00 0.00 H TER 82077 WAT 8099 ATOM 82077 O WAT 8100 15.544 132.726 15.739 1.00 0.00 O ATOM 82078 H1 WAT 8100 15.480 132.305 14.882 1.00 0.00 H ATOM 82079 H2 WAT 8100 15.688 133.652 15.541 1.00 0.00 H TER 82081 WAT 8100 ATOM 82081 O WAT 8101 92.400 27.038 73.295 1.00 0.00 O ATOM 82082 H1 WAT 8101 92.560 26.707 74.178 1.00 0.00 H ATOM 82083 H2 WAT 8101 92.451 26.263 72.736 1.00 0.00 H TER 82085 WAT 8101 ATOM 82085 O WAT 8102 14.197 66.906 152.768 1.00 0.00 O ATOM 82086 H1 WAT 8102 14.292 65.967 152.610 1.00 0.00 H ATOM 82087 H2 WAT 8102 13.448 66.975 153.360 1.00 0.00 H TER 82089 WAT 8102 ATOM 82089 O WAT 8103 40.833 33.850 147.988 1.00 0.00 O ATOM 82090 H1 WAT 8103 40.398 33.815 147.136 1.00 0.00 H ATOM 82091 H2 WAT 8103 40.118 33.822 148.624 1.00 0.00 H TER 82093 WAT 8103 ATOM 82093 O WAT 8104 129.599 135.909 125.064 1.00 0.00 O ATOM 82094 H1 WAT 8104 128.971 135.714 124.368 1.00 0.00 H ATOM 82095 H2 WAT 8104 129.146 136.536 125.627 1.00 0.00 H TER 82097 WAT 8104 ATOM 82097 O WAT 8105 59.545 62.141 152.351 1.00 0.00 O ATOM 82098 H1 WAT 8105 59.055 61.584 152.955 1.00 0.00 H ATOM 82099 H2 WAT 8105 58.886 62.473 151.742 1.00 0.00 H TER 82101 WAT 8105 ATOM 82101 O WAT 8106 54.633 114.441 148.540 1.00 0.00 O ATOM 82102 H1 WAT 8106 54.758 115.206 149.101 1.00 0.00 H ATOM 82103 H2 WAT 8106 55.241 113.788 148.886 1.00 0.00 H TER 82105 WAT 8106 ATOM 82105 O WAT 8107 0.741 73.844 136.393 1.00 0.00 O ATOM 82106 H1 WAT 8107 0.119 73.343 136.922 1.00 0.00 H ATOM 82107 H2 WAT 8107 0.286 73.991 135.564 1.00 0.00 H TER 82109 WAT 8107 ATOM 82109 O WAT 8108 142.323 28.567 5.504 1.00 0.00 O ATOM 82110 H1 WAT 8108 142.312 27.868 4.850 1.00 0.00 H ATOM 82111 H2 WAT 8108 143.130 29.050 5.324 1.00 0.00 H TER 82113 WAT 8108 ATOM 82113 O WAT 8109 122.098 82.071 157.403 1.00 0.00 O ATOM 82114 H1 WAT 8109 122.213 82.648 158.158 1.00 0.00 H ATOM 82115 H2 WAT 8109 121.423 81.450 157.676 1.00 0.00 H TER 82117 WAT 8109 ATOM 82117 O WAT 8110 129.238 141.973 10.792 1.00 0.00 O ATOM 82118 H1 WAT 8110 129.640 142.832 10.919 1.00 0.00 H ATOM 82119 H2 WAT 8110 128.312 142.161 10.642 1.00 0.00 H TER 82121 WAT 8110 ATOM 82121 O WAT 8111 7.634 1.045 7.180 1.00 0.00 O ATOM 82122 H1 WAT 8111 7.052 0.372 6.826 1.00 0.00 H ATOM 82123 H2 WAT 8111 7.184 1.870 6.999 1.00 0.00 H TER 82125 WAT 8111 ATOM 82125 O WAT 8112 118.624 61.018 75.137 1.00 0.00 O ATOM 82126 H1 WAT 8112 119.235 60.737 74.456 1.00 0.00 H ATOM 82127 H2 WAT 8112 118.733 60.374 75.837 1.00 0.00 H TER 82129 WAT 8112 ATOM 82129 O WAT 8113 13.573 136.885 108.187 1.00 0.00 O ATOM 82130 H1 WAT 8113 13.623 136.359 107.389 1.00 0.00 H ATOM 82131 H2 WAT 8113 13.823 137.766 107.908 1.00 0.00 H TER 82133 WAT 8113 ATOM 82133 O WAT 8114 80.705 19.569 64.514 1.00 0.00 O ATOM 82134 H1 WAT 8114 79.986 19.169 64.024 1.00 0.00 H ATOM 82135 H2 WAT 8114 80.882 20.389 64.053 1.00 0.00 H TER 82137 WAT 8114 ATOM 82137 O WAT 8115 20.926 145.303 107.097 1.00 0.00 O ATOM 82138 H1 WAT 8115 20.799 144.761 106.319 1.00 0.00 H ATOM 82139 H2 WAT 8115 21.467 144.767 107.677 1.00 0.00 H TER 82141 WAT 8115 ATOM 82141 O WAT 8116 51.368 111.485 133.352 1.00 0.00 O ATOM 82142 H1 WAT 8116 50.733 111.203 132.693 1.00 0.00 H ATOM 82143 H2 WAT 8116 51.960 112.070 132.880 1.00 0.00 H TER 82145 WAT 8116 ATOM 82145 O WAT 8117 40.027 143.339 140.353 1.00 0.00 O ATOM 82146 H1 WAT 8117 40.616 142.587 140.414 1.00 0.00 H ATOM 82147 H2 WAT 8117 39.761 143.509 141.257 1.00 0.00 H TER 82149 WAT 8117 ATOM 82149 O WAT 8118 82.594 29.701 113.855 1.00 0.00 O ATOM 82150 H1 WAT 8118 81.780 29.505 114.319 1.00 0.00 H ATOM 82151 H2 WAT 8118 82.990 30.413 114.358 1.00 0.00 H TER 82153 WAT 8118 ATOM 82153 O WAT 8119 66.695 79.052 5.914 1.00 0.00 O ATOM 82154 H1 WAT 8119 67.603 79.195 6.180 1.00 0.00 H ATOM 82155 H2 WAT 8119 66.723 79.050 4.957 1.00 0.00 H TER 82157 WAT 8119 ATOM 82157 O WAT 8120 52.347 64.563 148.971 1.00 0.00 O ATOM 82158 H1 WAT 8120 52.687 63.688 149.161 1.00 0.00 H ATOM 82159 H2 WAT 8120 51.401 64.440 148.894 1.00 0.00 H TER 82161 WAT 8120 ATOM 82161 O WAT 8121 124.448 90.343 130.235 1.00 0.00 O ATOM 82162 H1 WAT 8121 124.788 91.230 130.119 1.00 0.00 H ATOM 82163 H2 WAT 8121 123.604 90.349 129.785 1.00 0.00 H TER 82165 WAT 8121 ATOM 82165 O WAT 8122 63.669 25.685 82.472 1.00 0.00 O ATOM 82166 H1 WAT 8122 63.482 24.998 81.832 1.00 0.00 H ATOM 82167 H2 WAT 8122 64.602 25.866 82.363 1.00 0.00 H TER 82169 WAT 8122 ATOM 82169 O WAT 8123 124.386 137.617 128.326 1.00 0.00 O ATOM 82170 H1 WAT 8123 124.487 138.418 128.840 1.00 0.00 H ATOM 82171 H2 WAT 8123 124.657 137.865 127.442 1.00 0.00 H TER 82173 WAT 8123 ATOM 82173 O WAT 8124 109.916 51.152 8.868 1.00 0.00 O ATOM 82174 H1 WAT 8124 110.802 51.230 9.221 1.00 0.00 H ATOM 82175 H2 WAT 8124 110.043 50.863 7.965 1.00 0.00 H TER 82177 WAT 8124 ATOM 82177 O WAT 8125 116.156 129.341 120.295 1.00 0.00 O ATOM 82178 H1 WAT 8125 116.108 129.270 121.248 1.00 0.00 H ATOM 82179 H2 WAT 8125 115.594 130.086 120.082 1.00 0.00 H TER 82181 WAT 8125 ATOM 82181 O WAT 8126 118.212 94.631 153.928 1.00 0.00 O ATOM 82182 H1 WAT 8126 118.985 95.101 154.239 1.00 0.00 H ATOM 82183 H2 WAT 8126 118.473 94.276 153.078 1.00 0.00 H TER 82185 WAT 8126 ATOM 82185 O WAT 8127 21.423 14.861 158.129 1.00 0.00 O ATOM 82186 H1 WAT 8127 21.568 13.997 157.743 1.00 0.00 H ATOM 82187 H2 WAT 8127 22.303 15.210 158.271 1.00 0.00 H TER 82189 WAT 8127 ATOM 82189 O WAT 8128 25.725 25.663 20.510 1.00 0.00 O ATOM 82190 H1 WAT 8128 26.100 25.564 21.385 1.00 0.00 H ATOM 82191 H2 WAT 8128 26.245 25.078 19.959 1.00 0.00 H TER 82193 WAT 8128 ATOM 82193 O WAT 8129 141.196 131.276 12.733 1.00 0.00 O ATOM 82194 H1 WAT 8129 140.403 130.741 12.767 1.00 0.00 H ATOM 82195 H2 WAT 8129 141.439 131.403 13.650 1.00 0.00 H TER 82197 WAT 8129 ATOM 82197 O WAT 8130 18.788 109.372 3.722 1.00 0.00 O ATOM 82198 H1 WAT 8130 18.316 109.775 4.451 1.00 0.00 H ATOM 82199 H2 WAT 8130 18.181 109.429 2.984 1.00 0.00 H TER 82201 WAT 8130 ATOM 82201 O WAT 8131 22.596 80.810 74.256 1.00 0.00 O ATOM 82202 H1 WAT 8131 21.809 80.894 73.719 1.00 0.00 H ATOM 82203 H2 WAT 8131 22.267 80.627 75.136 1.00 0.00 H TER 82205 WAT 8131 ATOM 82205 O WAT 8132 62.726 105.095 151.159 1.00 0.00 O ATOM 82206 H1 WAT 8132 62.201 105.495 150.466 1.00 0.00 H ATOM 82207 H2 WAT 8132 62.406 105.500 151.965 1.00 0.00 H TER 82209 WAT 8132 ATOM 82209 O WAT 8133 66.693 65.155 111.893 1.00 0.00 O ATOM 82210 H1 WAT 8133 66.526 64.216 111.816 1.00 0.00 H ATOM 82211 H2 WAT 8133 65.860 65.522 112.190 1.00 0.00 H TER 82213 WAT 8133 ATOM 82213 O WAT 8134 42.811 86.638 133.077 1.00 0.00 O ATOM 82214 H1 WAT 8134 43.303 87.041 132.361 1.00 0.00 H ATOM 82215 H2 WAT 8134 43.452 86.535 133.780 1.00 0.00 H TER 82217 WAT 8134 ATOM 82217 O WAT 8135 9.533 39.091 17.961 1.00 0.00 O ATOM 82218 H1 WAT 8135 10.483 39.057 17.851 1.00 0.00 H ATOM 82219 H2 WAT 8135 9.270 39.903 17.529 1.00 0.00 H TER 82221 WAT 8135 ATOM 82221 O WAT 8136 99.820 5.261 65.526 1.00 0.00 O ATOM 82222 H1 WAT 8136 99.281 5.974 65.183 1.00 0.00 H ATOM 82223 H2 WAT 8136 99.382 4.998 66.335 1.00 0.00 H TER 82225 WAT 8136 ATOM 82225 O WAT 8137 68.768 144.530 59.044 1.00 0.00 O ATOM 82226 H1 WAT 8137 69.265 144.932 59.756 1.00 0.00 H ATOM 82227 H2 WAT 8137 68.756 145.195 58.355 1.00 0.00 H TER 82229 WAT 8137 ATOM 82229 O WAT 8138 59.434 12.594 69.867 1.00 0.00 O ATOM 82230 H1 WAT 8138 60.326 12.938 69.920 1.00 0.00 H ATOM 82231 H2 WAT 8138 59.506 11.828 69.297 1.00 0.00 H TER 82233 WAT 8138 ATOM 82233 O WAT 8139 145.136 100.679 18.518 1.00 0.00 O ATOM 82234 H1 WAT 8139 144.972 100.092 17.780 1.00 0.00 H ATOM 82235 H2 WAT 8139 144.478 100.434 19.169 1.00 0.00 H TER 82237 WAT 8139 ATOM 82237 O WAT 8140 82.296 18.738 122.149 1.00 0.00 O ATOM 82238 H1 WAT 8140 82.148 17.873 122.530 1.00 0.00 H ATOM 82239 H2 WAT 8140 81.649 19.301 122.575 1.00 0.00 H TER 82241 WAT 8140 ATOM 82241 O WAT 8141 72.364 141.539 157.093 1.00 0.00 O ATOM 82242 H1 WAT 8141 73.207 141.384 156.668 1.00 0.00 H ATOM 82243 H2 WAT 8141 71.723 141.473 156.385 1.00 0.00 H TER 82245 WAT 8141 ATOM 82245 O WAT 8142 0.826 18.852 119.934 1.00 0.00 O ATOM 82246 H1 WAT 8142 0.222 19.533 119.638 1.00 0.00 H ATOM 82247 H2 WAT 8142 0.586 18.080 119.421 1.00 0.00 H TER 82249 WAT 8142 ATOM 82249 O WAT 8143 31.301 33.551 138.247 1.00 0.00 O ATOM 82250 H1 WAT 8143 30.731 34.184 137.810 1.00 0.00 H ATOM 82251 H2 WAT 8143 30.704 33.007 138.762 1.00 0.00 H TER 82253 WAT 8143 ATOM 82253 O WAT 8144 0.772 64.664 152.909 1.00 0.00 O ATOM 82254 H1 WAT 8144 0.120 65.365 152.883 1.00 0.00 H ATOM 82255 H2 WAT 8144 0.263 63.870 153.071 1.00 0.00 H TER 82257 WAT 8144 ATOM 82257 O WAT 8145 104.197 89.114 95.970 1.00 0.00 O ATOM 82258 H1 WAT 8145 104.450 88.942 96.877 1.00 0.00 H ATOM 82259 H2 WAT 8145 104.356 90.050 95.850 1.00 0.00 H TER 82261 WAT 8145 ATOM 82261 O WAT 8146 106.446 17.583 106.235 1.00 0.00 O ATOM 82262 H1 WAT 8146 106.705 18.414 105.838 1.00 0.00 H ATOM 82263 H2 WAT 8146 106.212 17.811 107.135 1.00 0.00 H TER 82265 WAT 8146 ATOM 82265 O WAT 8147 113.258 27.163 20.261 1.00 0.00 O ATOM 82266 H1 WAT 8147 112.748 26.932 19.484 1.00 0.00 H ATOM 82267 H2 WAT 8147 113.604 26.328 20.577 1.00 0.00 H TER 82269 WAT 8147 ATOM 82269 O WAT 8148 25.225 99.100 141.959 1.00 0.00 O ATOM 82270 H1 WAT 8148 25.982 98.883 141.416 1.00 0.00 H ATOM 82271 H2 WAT 8148 24.527 99.292 141.332 1.00 0.00 H TER 82273 WAT 8148 ATOM 82273 O WAT 8149 85.966 120.397 75.390 1.00 0.00 O ATOM 82274 H1 WAT 8149 85.954 120.805 74.524 1.00 0.00 H ATOM 82275 H2 WAT 8149 86.038 121.131 76.000 1.00 0.00 H TER 82277 WAT 8149 ATOM 82277 O WAT 8150 10.933 76.250 136.148 1.00 0.00 O ATOM 82278 H1 WAT 8150 10.503 77.076 136.368 1.00 0.00 H ATOM 82279 H2 WAT 8150 10.224 75.684 135.843 1.00 0.00 H TER 82281 WAT 8150 ATOM 82281 O WAT 8151 142.817 71.789 108.027 1.00 0.00 O ATOM 82282 H1 WAT 8151 142.900 72.029 108.950 1.00 0.00 H ATOM 82283 H2 WAT 8151 143.334 70.989 107.941 1.00 0.00 H TER 82285 WAT 8151 ATOM 82285 O WAT 8152 129.573 108.920 13.675 1.00 0.00 O ATOM 82286 H1 WAT 8152 129.224 108.155 13.219 1.00 0.00 H ATOM 82287 H2 WAT 8152 129.726 108.617 14.570 1.00 0.00 H TER 82289 WAT 8152 ATOM 82289 O WAT 8153 27.004 27.273 88.490 1.00 0.00 O ATOM 82290 H1 WAT 8153 27.842 27.357 88.035 1.00 0.00 H ATOM 82291 H2 WAT 8153 26.377 27.061 87.799 1.00 0.00 H TER 82293 WAT 8153 ATOM 82293 O WAT 8154 45.097 137.337 139.630 1.00 0.00 O ATOM 82294 H1 WAT 8154 45.966 137.657 139.871 1.00 0.00 H ATOM 82295 H2 WAT 8154 44.985 136.537 140.143 1.00 0.00 H TER 82297 WAT 8154 ATOM 82297 O WAT 8155 7.097 27.336 4.435 1.00 0.00 O ATOM 82298 H1 WAT 8155 7.737 26.650 4.623 1.00 0.00 H ATOM 82299 H2 WAT 8155 6.265 26.979 4.746 1.00 0.00 H TER 82301 WAT 8155 ATOM 82301 O WAT 8156 33.461 108.097 128.829 1.00 0.00 O ATOM 82302 H1 WAT 8156 33.459 108.000 127.876 1.00 0.00 H ATOM 82303 H2 WAT 8156 33.424 109.042 128.974 1.00 0.00 H TER 82305 WAT 8156 ATOM 82305 O WAT 8157 53.310 144.585 93.213 1.00 0.00 O ATOM 82306 H1 WAT 8157 53.148 144.995 94.063 1.00 0.00 H ATOM 82307 H2 WAT 8157 53.871 145.207 92.750 1.00 0.00 H TER 82309 WAT 8157 ATOM 82309 O WAT 8158 83.876 89.851 57.644 1.00 0.00 O ATOM 82310 H1 WAT 8158 83.272 89.132 57.458 1.00 0.00 H ATOM 82311 H2 WAT 8158 84.071 90.228 56.786 1.00 0.00 H TER 82313 WAT 8158 ATOM 82313 O WAT 8159 107.026 70.122 3.503 1.00 0.00 O ATOM 82314 H1 WAT 8159 106.098 69.902 3.418 1.00 0.00 H ATOM 82315 H2 WAT 8159 107.402 69.387 3.987 1.00 0.00 H TER 82317 WAT 8159 ATOM 82317 O WAT 8160 46.709 107.346 8.193 1.00 0.00 O ATOM 82318 H1 WAT 8160 46.093 107.965 7.802 1.00 0.00 H ATOM 82319 H2 WAT 8160 46.901 106.723 7.493 1.00 0.00 H TER 82321 WAT 8160 ATOM 82321 O WAT 8161 67.375 5.829 146.532 1.00 0.00 O ATOM 82322 H1 WAT 8161 68.156 5.960 145.996 1.00 0.00 H ATOM 82323 H2 WAT 8161 67.562 5.038 147.039 1.00 0.00 H TER 82325 WAT 8161 ATOM 82325 O WAT 8162 108.279 31.519 73.294 1.00 0.00 O ATOM 82326 H1 WAT 8162 107.428 31.906 73.091 1.00 0.00 H ATOM 82327 H2 WAT 8162 108.914 32.109 72.887 1.00 0.00 H TER 82329 WAT 8162 ATOM 82329 O WAT 8163 26.432 56.935 83.682 1.00 0.00 O ATOM 82330 H1 WAT 8163 27.348 56.735 83.872 1.00 0.00 H ATOM 82331 H2 WAT 8163 26.274 56.542 82.824 1.00 0.00 H TER 82333 WAT 8163 ATOM 82333 O WAT 8164 125.910 35.055 88.847 1.00 0.00 O ATOM 82334 H1 WAT 8164 125.362 35.669 88.358 1.00 0.00 H ATOM 82335 H2 WAT 8164 126.806 35.349 88.682 1.00 0.00 H TER 82337 WAT 8164 ATOM 82337 O WAT 8165 52.207 131.104 90.509 1.00 0.00 O ATOM 82338 H1 WAT 8165 52.239 130.784 89.607 1.00 0.00 H ATOM 82339 H2 WAT 8165 53.055 131.527 90.643 1.00 0.00 H TER 82341 WAT 8165 ATOM 82341 O WAT 8166 51.500 129.964 87.759 1.00 0.00 O ATOM 82342 H1 WAT 8166 52.191 130.148 87.123 1.00 0.00 H ATOM 82343 H2 WAT 8166 50.702 130.295 87.348 1.00 0.00 H TER 82345 WAT 8166 ATOM 82345 O WAT 8167 67.326 97.360 153.532 1.00 0.00 O ATOM 82346 H1 WAT 8167 67.649 97.111 154.397 1.00 0.00 H ATOM 82347 H2 WAT 8167 67.738 98.206 153.357 1.00 0.00 H TER 82349 WAT 8167 ATOM 82349 O WAT 8168 137.720 75.011 17.847 1.00 0.00 O ATOM 82350 H1 WAT 8168 137.436 75.890 17.597 1.00 0.00 H ATOM 82351 H2 WAT 8168 137.399 74.901 18.742 1.00 0.00 H TER 82353 WAT 8168 ATOM 82353 O WAT 8169 85.956 72.425 123.255 1.00 0.00 O ATOM 82354 H1 WAT 8169 86.535 73.004 123.752 1.00 0.00 H ATOM 82355 H2 WAT 8169 85.439 73.017 122.708 1.00 0.00 H TER 82357 WAT 8169 ATOM 82357 O WAT 8170 74.632 103.080 147.745 1.00 0.00 O ATOM 82358 H1 WAT 8170 74.938 102.180 147.634 1.00 0.00 H ATOM 82359 H2 WAT 8170 73.816 102.997 148.238 1.00 0.00 H TER 82361 WAT 8170 ATOM 82361 O WAT 8171 31.328 66.968 16.650 1.00 0.00 O ATOM 82362 H1 WAT 8171 31.208 66.240 16.040 1.00 0.00 H ATOM 82363 H2 WAT 8171 31.926 66.627 17.315 1.00 0.00 H TER 82365 WAT 8171 ATOM 82365 O WAT 8172 144.019 71.599 149.611 1.00 0.00 O ATOM 82366 H1 WAT 8172 143.757 71.637 148.691 1.00 0.00 H ATOM 82367 H2 WAT 8172 143.820 70.702 149.880 1.00 0.00 H TER 82369 WAT 8172 ATOM 82369 O WAT 8173 28.371 48.941 139.366 1.00 0.00 O ATOM 82370 H1 WAT 8173 28.893 48.140 139.331 1.00 0.00 H ATOM 82371 H2 WAT 8173 28.341 49.248 138.460 1.00 0.00 H TER 82373 WAT 8173 ATOM 82373 O WAT 8174 47.466 61.845 85.331 1.00 0.00 O ATOM 82374 H1 WAT 8174 48.162 61.695 84.692 1.00 0.00 H ATOM 82375 H2 WAT 8174 47.225 60.969 85.633 1.00 0.00 H TER 82377 WAT 8174 ATOM 82377 O WAT 8175 111.631 133.562 101.553 1.00 0.00 O ATOM 82378 H1 WAT 8175 111.968 133.025 100.835 1.00 0.00 H ATOM 82379 H2 WAT 8175 112.016 133.177 102.340 1.00 0.00 H TER 82381 WAT 8175 ATOM 82381 O WAT 8176 128.452 9.065 113.252 1.00 0.00 O ATOM 82382 H1 WAT 8176 129.107 9.476 112.688 1.00 0.00 H ATOM 82383 H2 WAT 8176 127.916 8.542 112.655 1.00 0.00 H TER 82385 WAT 8176 ATOM 82385 O WAT 8177 141.079 11.984 114.834 1.00 0.00 O ATOM 82386 H1 WAT 8177 140.258 11.949 115.324 1.00 0.00 H ATOM 82387 H2 WAT 8177 141.706 12.375 115.442 1.00 0.00 H TER 82389 WAT 8177 ATOM 82389 O WAT 8178 112.964 13.911 96.221 1.00 0.00 O ATOM 82390 H1 WAT 8178 113.708 13.893 96.823 1.00 0.00 H ATOM 82391 H2 WAT 8178 112.220 14.164 96.768 1.00 0.00 H TER 82393 WAT 8178 ATOM 82393 O WAT 8179 28.164 0.875 122.798 1.00 0.00 O ATOM 82394 H1 WAT 8179 27.439 1.147 123.361 1.00 0.00 H ATOM 82395 H2 WAT 8179 28.923 1.349 123.140 1.00 0.00 H TER 82397 WAT 8179 ATOM 82397 O WAT 8180 12.048 113.755 86.588 1.00 0.00 O ATOM 82398 H1 WAT 8180 11.925 113.777 85.639 1.00 0.00 H ATOM 82399 H2 WAT 8180 12.960 113.491 86.706 1.00 0.00 H TER 82401 WAT 8180 ATOM 82401 O WAT 8181 20.869 8.652 129.880 1.00 0.00 O ATOM 82402 H1 WAT 8181 21.731 9.046 130.008 1.00 0.00 H ATOM 82403 H2 WAT 8181 20.808 7.982 130.561 1.00 0.00 H TER 82405 WAT 8181 ATOM 82405 O WAT 8182 9.809 136.931 73.021 1.00 0.00 O ATOM 82406 H1 WAT 8182 9.474 136.035 73.054 1.00 0.00 H ATOM 82407 H2 WAT 8182 10.237 136.995 72.167 1.00 0.00 H TER 82409 WAT 8182 ATOM 82409 O WAT 8183 121.384 103.676 0.768 1.00 0.00 O ATOM 82410 H1 WAT 8183 120.810 102.920 0.897 1.00 0.00 H ATOM 82411 H2 WAT 8183 121.308 104.175 1.581 1.00 0.00 H TER 82413 WAT 8183 ATOM 82413 O WAT 8184 130.161 64.693 113.645 1.00 0.00 O ATOM 82414 H1 WAT 8184 130.520 65.438 113.161 1.00 0.00 H ATOM 82415 H2 WAT 8184 129.566 64.270 113.026 1.00 0.00 H TER 82417 WAT 8184 ATOM 82417 O WAT 8185 58.886 125.932 85.828 1.00 0.00 O ATOM 82418 H1 WAT 8185 58.821 126.830 86.155 1.00 0.00 H ATOM 82419 H2 WAT 8185 58.035 125.542 86.030 1.00 0.00 H TER 82421 WAT 8185 ATOM 82421 O WAT 8186 138.193 128.345 70.257 1.00 0.00 O ATOM 82422 H1 WAT 8186 138.097 128.994 69.560 1.00 0.00 H ATOM 82423 H2 WAT 8186 137.303 128.029 70.414 1.00 0.00 H TER 82425 WAT 8186 ATOM 82425 O WAT 8187 136.747 116.677 114.239 1.00 0.00 O ATOM 82426 H1 WAT 8187 137.134 116.011 113.670 1.00 0.00 H ATOM 82427 H2 WAT 8187 136.098 116.202 114.757 1.00 0.00 H TER 82429 WAT 8187 ATOM 82429 O WAT 8188 79.098 129.315 71.972 1.00 0.00 O ATOM 82430 H1 WAT 8188 79.147 129.919 71.231 1.00 0.00 H ATOM 82431 H2 WAT 8188 78.749 128.506 71.599 1.00 0.00 H TER 82433 WAT 8188 ATOM 82433 O WAT 8189 131.454 114.211 18.678 1.00 0.00 O ATOM 82434 H1 WAT 8189 130.637 114.302 18.187 1.00 0.00 H ATOM 82435 H2 WAT 8189 131.769 113.335 18.457 1.00 0.00 H TER 82437 WAT 8189 ATOM 82437 O WAT 8190 7.787 125.392 115.658 1.00 0.00 O ATOM 82438 H1 WAT 8190 7.603 126.331 115.689 1.00 0.00 H ATOM 82439 H2 WAT 8190 6.965 124.977 115.922 1.00 0.00 H TER 82441 WAT 8190 ATOM 82441 O WAT 8191 54.839 117.317 118.647 1.00 0.00 O ATOM 82442 H1 WAT 8191 53.948 117.163 118.961 1.00 0.00 H ATOM 82443 H2 WAT 8191 55.209 117.939 119.274 1.00 0.00 H TER 82445 WAT 8191 ATOM 82445 O WAT 8192 61.577 89.451 113.070 1.00 0.00 O ATOM 82446 H1 WAT 8192 62.312 89.244 112.493 1.00 0.00 H ATOM 82447 H2 WAT 8192 61.986 89.765 113.877 1.00 0.00 H TER 82449 WAT 8192 ATOM 82449 O WAT 8193 46.572 99.321 58.929 1.00 0.00 O ATOM 82450 H1 WAT 8193 46.365 99.319 59.863 1.00 0.00 H ATOM 82451 H2 WAT 8193 47.451 99.698 58.880 1.00 0.00 H TER 82453 WAT 8193 ATOM 82453 O WAT 8194 145.129 89.707 81.526 1.00 0.00 O ATOM 82454 H1 WAT 8194 144.951 90.267 82.282 1.00 0.00 H ATOM 82455 H2 WAT 8194 146.029 89.408 81.655 1.00 0.00 H TER 82457 WAT 8194 ATOM 82457 O WAT 8195 29.676 92.841 81.299 1.00 0.00 O ATOM 82458 H1 WAT 8195 28.838 92.619 81.705 1.00 0.00 H ATOM 82459 H2 WAT 8195 30.321 92.709 81.994 1.00 0.00 H TER 82461 WAT 8195 ATOM 82461 O WAT 8196 72.618 89.153 137.302 1.00 0.00 O ATOM 82462 H1 WAT 8196 72.428 88.379 137.833 1.00 0.00 H ATOM 82463 H2 WAT 8196 73.483 88.983 136.930 1.00 0.00 H TER 82465 WAT 8196 ATOM 82465 O WAT 8197 119.882 83.640 117.952 1.00 0.00 O ATOM 82466 H1 WAT 8197 120.338 82.833 118.191 1.00 0.00 H ATOM 82467 H2 WAT 8197 119.177 83.715 118.594 1.00 0.00 H TER 82469 WAT 8197 ATOM 82469 O WAT 8198 56.497 36.636 151.088 1.00 0.00 O ATOM 82470 H1 WAT 8198 55.658 36.861 151.491 1.00 0.00 H ATOM 82471 H2 WAT 8198 56.395 36.883 150.169 1.00 0.00 H TER 82473 WAT 8198 ATOM 82473 O WAT 8199 121.758 139.418 100.357 1.00 0.00 O ATOM 82474 H1 WAT 8199 121.148 140.080 100.682 1.00 0.00 H ATOM 82475 H2 WAT 8199 121.197 138.750 99.962 1.00 0.00 H TER 82477 WAT 8199 ATOM 82477 O WAT 8200 129.272 15.784 133.909 1.00 0.00 O ATOM 82478 H1 WAT 8200 129.519 14.937 134.280 1.00 0.00 H ATOM 82479 H2 WAT 8200 129.216 15.625 132.966 1.00 0.00 H TER 82481 WAT 8200 ATOM 82481 O WAT 8201 40.731 138.943 99.640 1.00 0.00 O ATOM 82482 H1 WAT 8201 41.669 138.787 99.529 1.00 0.00 H ATOM 82483 H2 WAT 8201 40.589 139.816 99.275 1.00 0.00 H TER 82485 WAT 8201 ATOM 82485 O WAT 8202 8.505 15.227 138.824 1.00 0.00 O ATOM 82486 H1 WAT 8202 9.154 15.334 139.519 1.00 0.00 H ATOM 82487 H2 WAT 8202 7.731 15.687 139.146 1.00 0.00 H TER 82489 WAT 8202 ATOM 82489 O WAT 8203 79.347 115.251 136.792 1.00 0.00 O ATOM 82490 H1 WAT 8203 79.266 114.378 137.175 1.00 0.00 H ATOM 82491 H2 WAT 8203 78.976 115.837 137.451 1.00 0.00 H TER 82493 WAT 8203 ATOM 82493 O WAT 8204 35.961 132.856 67.354 1.00 0.00 O ATOM 82494 H1 WAT 8204 36.260 133.348 68.118 1.00 0.00 H ATOM 82495 H2 WAT 8204 35.558 133.514 66.787 1.00 0.00 H TER 82497 WAT 8204 ATOM 82497 O WAT 8205 91.929 21.727 56.872 1.00 0.00 O ATOM 82498 H1 WAT 8205 92.195 21.738 55.952 1.00 0.00 H ATOM 82499 H2 WAT 8205 90.997 21.506 56.849 1.00 0.00 H TER 82501 WAT 8205 ATOM 82501 O WAT 8206 73.757 83.815 24.925 1.00 0.00 O ATOM 82502 H1 WAT 8206 73.378 84.683 24.786 1.00 0.00 H ATOM 82503 H2 WAT 8206 73.021 83.275 25.214 1.00 0.00 H TER 82505 WAT 8206 ATOM 82505 O WAT 8207 77.284 137.943 16.726 1.00 0.00 O ATOM 82506 H1 WAT 8207 76.988 137.773 15.832 1.00 0.00 H ATOM 82507 H2 WAT 8207 77.784 137.163 16.965 1.00 0.00 H TER 82509 WAT 8207 ATOM 82509 O WAT 8208 49.655 108.517 142.481 1.00 0.00 O ATOM 82510 H1 WAT 8208 50.051 108.132 143.262 1.00 0.00 H ATOM 82511 H2 WAT 8208 48.997 107.878 142.206 1.00 0.00 H TER 82513 WAT 8208 ATOM 82513 O WAT 8209 22.679 29.443 76.336 1.00 0.00 O ATOM 82514 H1 WAT 8209 22.059 28.754 76.096 1.00 0.00 H ATOM 82515 H2 WAT 8209 22.143 30.232 76.410 1.00 0.00 H TER 82517 WAT 8209 ATOM 82517 O WAT 8210 105.967 111.926 130.439 1.00 0.00 O ATOM 82518 H1 WAT 8210 105.560 112.720 130.786 1.00 0.00 H ATOM 82519 H2 WAT 8210 106.161 111.399 131.214 1.00 0.00 H TER 82521 WAT 8210 ATOM 82521 O WAT 8211 128.885 2.371 125.412 1.00 0.00 O ATOM 82522 H1 WAT 8211 128.235 2.868 124.915 1.00 0.00 H ATOM 82523 H2 WAT 8211 129.668 2.921 125.398 1.00 0.00 H TER 82525 WAT 8211 ATOM 82525 O WAT 8212 108.255 47.349 76.354 1.00 0.00 O ATOM 82526 H1 WAT 8212 107.552 47.303 75.707 1.00 0.00 H ATOM 82527 H2 WAT 8212 108.078 46.623 76.952 1.00 0.00 H TER 82529 WAT 8212 ATOM 82529 O WAT 8213 5.216 71.163 109.219 1.00 0.00 O ATOM 82530 H1 WAT 8213 4.886 72.057 109.134 1.00 0.00 H ATOM 82531 H2 WAT 8213 4.647 70.643 108.652 1.00 0.00 H TER 82533 WAT 8213 ATOM 82533 O WAT 8214 47.735 74.095 156.670 1.00 0.00 O ATOM 82534 H1 WAT 8214 47.087 73.995 157.367 1.00 0.00 H ATOM 82535 H2 WAT 8214 47.543 74.950 156.285 1.00 0.00 H TER 82537 WAT 8214 ATOM 82537 O WAT 8215 15.961 67.488 90.418 1.00 0.00 O ATOM 82538 H1 WAT 8215 16.038 68.122 89.705 1.00 0.00 H ATOM 82539 H2 WAT 8215 16.358 66.689 90.072 1.00 0.00 H TER 82541 WAT 8215 ATOM 82541 O WAT 8216 127.821 39.976 94.626 1.00 0.00 O ATOM 82542 H1 WAT 8216 127.772 40.930 94.686 1.00 0.00 H ATOM 82543 H2 WAT 8216 128.370 39.812 93.859 1.00 0.00 H TER 82545 WAT 8216 ATOM 82545 O WAT 8217 132.286 37.643 118.433 1.00 0.00 O ATOM 82546 H1 WAT 8217 131.768 36.968 117.994 1.00 0.00 H ATOM 82547 H2 WAT 8217 131.736 38.425 118.402 1.00 0.00 H TER 82549 WAT 8217 ATOM 82549 O WAT 8218 126.006 4.679 106.233 1.00 0.00 O ATOM 82550 H1 WAT 8218 126.301 4.236 105.437 1.00 0.00 H ATOM 82551 H2 WAT 8218 125.070 4.484 106.281 1.00 0.00 H TER 82553 WAT 8218 ATOM 82553 O WAT 8219 3.342 73.840 157.583 1.00 0.00 O ATOM 82554 H1 WAT 8219 2.456 73.812 157.222 1.00 0.00 H ATOM 82555 H2 WAT 8219 3.707 72.977 157.389 1.00 0.00 H TER 82557 WAT 8219 ATOM 82557 O WAT 8220 127.504 36.439 82.641 1.00 0.00 O ATOM 82558 H1 WAT 8220 128.227 36.914 82.230 1.00 0.00 H ATOM 82559 H2 WAT 8220 127.898 35.623 82.949 1.00 0.00 H TER 82561 WAT 8220 ATOM 82561 O WAT 8221 141.305 13.278 154.503 1.00 0.00 O ATOM 82562 H1 WAT 8221 140.758 12.996 155.236 1.00 0.00 H ATOM 82563 H2 WAT 8221 142.196 13.045 154.767 1.00 0.00 H TER 82565 WAT 8221 ATOM 82565 O WAT 8222 15.658 36.074 157.921 1.00 0.00 O ATOM 82566 H1 WAT 8222 14.920 36.379 158.449 1.00 0.00 H ATOM 82567 H2 WAT 8222 16.352 35.901 158.557 1.00 0.00 H TER 82569 WAT 8222 ATOM 82569 O WAT 8223 21.573 25.198 87.753 1.00 0.00 O ATOM 82570 H1 WAT 8223 21.965 24.385 88.072 1.00 0.00 H ATOM 82571 H2 WAT 8223 21.859 25.260 86.841 1.00 0.00 H TER 82573 WAT 8223 ATOM 82573 O WAT 8224 114.996 6.129 107.610 1.00 0.00 O ATOM 82574 H1 WAT 8224 115.506 5.681 108.284 1.00 0.00 H ATOM 82575 H2 WAT 8224 114.326 6.610 108.096 1.00 0.00 H TER 82577 WAT 8224 ATOM 82577 O WAT 8225 35.256 42.846 123.370 1.00 0.00 O ATOM 82578 H1 WAT 8225 36.184 42.996 123.189 1.00 0.00 H ATOM 82579 H2 WAT 8225 34.803 43.196 122.603 1.00 0.00 H TER 82581 WAT 8225 ATOM 82581 O WAT 8226 104.972 135.829 7.260 1.00 0.00 O ATOM 82582 H1 WAT 8226 104.198 136.159 7.715 1.00 0.00 H ATOM 82583 H2 WAT 8226 104.662 135.058 6.785 1.00 0.00 H TER 82585 WAT 8226 ATOM 82585 O WAT 8227 60.219 27.568 136.982 1.00 0.00 O ATOM 82586 H1 WAT 8227 60.554 28.257 136.408 1.00 0.00 H ATOM 82587 H2 WAT 8227 60.312 26.764 136.471 1.00 0.00 H TER 82589 WAT 8227 ATOM 82589 O WAT 8228 140.693 85.452 62.824 1.00 0.00 O ATOM 82590 H1 WAT 8228 140.370 86.243 63.254 1.00 0.00 H ATOM 82591 H2 WAT 8228 139.918 84.901 62.721 1.00 0.00 H TER 82593 WAT 8228 ATOM 82593 O WAT 8229 115.782 136.191 117.216 1.00 0.00 O ATOM 82594 H1 WAT 8229 116.660 135.954 116.918 1.00 0.00 H ATOM 82595 H2 WAT 8229 115.900 137.027 117.668 1.00 0.00 H TER 82597 WAT 8229 ATOM 82597 O WAT 8230 60.778 53.740 138.526 1.00 0.00 O ATOM 82598 H1 WAT 8230 60.317 53.241 137.852 1.00 0.00 H ATOM 82599 H2 WAT 8230 61.348 53.099 138.951 1.00 0.00 H TER 82601 WAT 8230 ATOM 82601 O WAT 8231 64.785 55.232 10.585 1.00 0.00 O ATOM 82602 H1 WAT 8231 64.801 56.094 11.001 1.00 0.00 H ATOM 82603 H2 WAT 8231 65.613 54.826 10.844 1.00 0.00 H TER 82605 WAT 8231 ATOM 82605 O WAT 8232 27.601 17.033 147.691 1.00 0.00 O ATOM 82606 H1 WAT 8232 28.468 17.436 147.735 1.00 0.00 H ATOM 82607 H2 WAT 8232 27.579 16.605 146.835 1.00 0.00 H TER 82609 WAT 8232 ATOM 82609 O WAT 8233 140.332 117.323 17.522 1.00 0.00 O ATOM 82610 H1 WAT 8233 140.565 116.602 18.107 1.00 0.00 H ATOM 82611 H2 WAT 8233 139.376 117.305 17.488 1.00 0.00 H TER 82613 WAT 8233 ATOM 82613 O WAT 8234 34.788 110.107 135.343 1.00 0.00 O ATOM 82614 H1 WAT 8234 34.665 109.161 135.420 1.00 0.00 H ATOM 82615 H2 WAT 8234 34.050 110.484 135.822 1.00 0.00 H TER 82617 WAT 8234 ATOM 82617 O WAT 8235 66.122 58.586 26.539 1.00 0.00 O ATOM 82618 H1 WAT 8235 65.681 58.499 25.693 1.00 0.00 H ATOM 82619 H2 WAT 8235 65.550 58.127 27.155 1.00 0.00 H TER 82621 WAT 8235 ATOM 82621 O WAT 8236 2.456 59.537 123.282 1.00 0.00 O ATOM 82622 H1 WAT 8236 2.843 59.977 124.039 1.00 0.00 H ATOM 82623 H2 WAT 8236 2.686 60.094 122.538 1.00 0.00 H TER 82625 WAT 8236 ATOM 82625 O WAT 8237 134.221 79.197 120.055 1.00 0.00 O ATOM 82626 H1 WAT 8237 134.614 78.437 120.485 1.00 0.00 H ATOM 82627 H2 WAT 8237 134.122 79.843 120.754 1.00 0.00 H TER 82629 WAT 8237 ATOM 82629 O WAT 8238 14.877 37.102 101.984 1.00 0.00 O ATOM 82630 H1 WAT 8238 14.910 36.160 101.818 1.00 0.00 H ATOM 82631 H2 WAT 8238 14.093 37.223 102.520 1.00 0.00 H TER 82633 WAT 8238 ATOM 82633 O WAT 8239 65.459 72.069 63.600 1.00 0.00 O ATOM 82634 H1 WAT 8239 65.405 72.862 63.067 1.00 0.00 H ATOM 82635 H2 WAT 8239 66.107 71.524 63.154 1.00 0.00 H TER 82637 WAT 8239 ATOM 82637 O WAT 8240 47.382 44.660 19.653 1.00 0.00 O ATOM 82638 H1 WAT 8240 47.834 44.523 20.486 1.00 0.00 H ATOM 82639 H2 WAT 8240 48.081 44.871 19.033 1.00 0.00 H TER 82641 WAT 8240 ATOM 82641 O WAT 8241 103.594 57.322 91.360 1.00 0.00 O ATOM 82642 H1 WAT 8241 104.368 57.885 91.341 1.00 0.00 H ATOM 82643 H2 WAT 8241 103.940 56.445 91.525 1.00 0.00 H TER 82645 WAT 8241 ATOM 82645 O WAT 8242 34.675 85.386 64.340 1.00 0.00 O ATOM 82646 H1 WAT 8242 34.950 86.243 64.667 1.00 0.00 H ATOM 82647 H2 WAT 8242 35.469 85.006 63.964 1.00 0.00 H TER 82649 WAT 8242 ATOM 82649 O WAT 8243 124.700 4.287 11.216 1.00 0.00 O ATOM 82650 H1 WAT 8243 124.075 4.014 11.887 1.00 0.00 H ATOM 82651 H2 WAT 8243 125.377 4.762 11.697 1.00 0.00 H TER 82653 WAT 8243 ATOM 82653 O WAT 8244 84.635 47.340 26.023 1.00 0.00 O ATOM 82654 H1 WAT 8244 84.715 46.648 25.366 1.00 0.00 H ATOM 82655 H2 WAT 8244 83.695 47.396 26.197 1.00 0.00 H TER 82657 WAT 8244 ATOM 82657 O WAT 8245 140.340 81.490 144.367 1.00 0.00 O ATOM 82658 H1 WAT 8245 140.129 82.417 144.254 1.00 0.00 H ATOM 82659 H2 WAT 8245 139.542 81.106 144.730 1.00 0.00 H TER 82661 WAT 8245 ATOM 82661 O WAT 8246 85.581 116.682 18.821 1.00 0.00 O ATOM 82662 H1 WAT 8246 86.156 115.921 18.747 1.00 0.00 H ATOM 82663 H2 WAT 8246 85.884 117.136 19.607 1.00 0.00 H TER 82665 WAT 8246 ATOM 82665 O WAT 8247 145.448 43.881 5.262 1.00 0.00 O ATOM 82666 H1 WAT 8247 145.195 43.713 4.354 1.00 0.00 H ATOM 82667 H2 WAT 8247 146.353 44.188 5.205 1.00 0.00 H TER 82669 WAT 8247 ATOM 82669 O WAT 8248 134.901 57.824 58.065 1.00 0.00 O ATOM 82670 H1 WAT 8248 134.627 57.037 58.536 1.00 0.00 H ATOM 82671 H2 WAT 8248 134.084 58.214 57.754 1.00 0.00 H TER 82673 WAT 8248 ATOM 82673 O WAT 8249 76.288 137.955 82.355 1.00 0.00 O ATOM 82674 H1 WAT 8249 76.390 137.013 82.223 1.00 0.00 H ATOM 82675 H2 WAT 8249 77.114 138.232 82.751 1.00 0.00 H TER 82677 WAT 8249 ATOM 82677 O WAT 8250 4.071 74.044 122.303 1.00 0.00 O ATOM 82678 H1 WAT 8250 3.220 74.442 122.491 1.00 0.00 H ATOM 82679 H2 WAT 8250 4.580 74.747 121.900 1.00 0.00 H TER 82681 WAT 8250 ATOM 82681 O WAT 8251 -0.132 101.862 5.885 1.00 0.00 O ATOM 82682 H1 WAT 8251 0.590 102.360 5.501 1.00 0.00 H ATOM 82683 H2 WAT 8251 -0.152 101.045 5.385 1.00 0.00 H TER 82685 WAT 8251 ATOM 82685 O WAT 8252 131.546 8.847 144.167 1.00 0.00 O ATOM 82686 H1 WAT 8252 132.275 9.417 143.921 1.00 0.00 H ATOM 82687 H2 WAT 8252 131.037 9.365 144.790 1.00 0.00 H TER 82689 WAT 8252 ATOM 82689 O WAT 8253 39.139 81.001 128.789 1.00 0.00 O ATOM 82690 H1 WAT 8253 38.313 81.178 128.339 1.00 0.00 H ATOM 82691 H2 WAT 8253 38.983 80.185 129.264 1.00 0.00 H TER 82693 WAT 8253 ATOM 82693 O WAT 8254 78.488 128.141 14.201 1.00 0.00 O ATOM 82694 H1 WAT 8254 77.974 127.334 14.185 1.00 0.00 H ATOM 82695 H2 WAT 8254 78.107 128.654 14.914 1.00 0.00 H TER 82697 WAT 8254 ATOM 82697 O WAT 8255 38.089 88.192 129.103 1.00 0.00 O ATOM 82698 H1 WAT 8255 37.900 87.318 129.445 1.00 0.00 H ATOM 82699 H2 WAT 8255 37.327 88.409 128.566 1.00 0.00 H TER 82701 WAT 8255 ATOM 82701 O WAT 8256 116.005 1.854 149.288 1.00 0.00 O ATOM 82702 H1 WAT 8256 115.595 1.160 149.804 1.00 0.00 H ATOM 82703 H2 WAT 8256 116.892 1.923 149.641 1.00 0.00 H TER 82705 WAT 8256 ATOM 82705 O WAT 8257 32.995 67.613 95.824 1.00 0.00 O ATOM 82706 H1 WAT 8257 32.153 67.315 96.167 1.00 0.00 H ATOM 82707 H2 WAT 8257 33.377 66.836 95.417 1.00 0.00 H TER 82709 WAT 8257 ATOM 82709 O WAT 8258 48.347 141.743 152.449 1.00 0.00 O ATOM 82710 H1 WAT 8258 48.242 141.723 153.400 1.00 0.00 H ATOM 82711 H2 WAT 8258 48.913 140.996 152.254 1.00 0.00 H TER 82713 WAT 8258 ATOM 82713 O WAT 8259 127.198 18.969 15.689 1.00 0.00 O ATOM 82714 H1 WAT 8259 126.948 18.220 16.230 1.00 0.00 H ATOM 82715 H2 WAT 8259 127.147 18.644 14.791 1.00 0.00 H TER 82717 WAT 8259 ATOM 82717 O WAT 8260 31.265 123.704 72.505 1.00 0.00 O ATOM 82718 H1 WAT 8260 30.532 123.311 72.980 1.00 0.00 H ATOM 82719 H2 WAT 8260 32.044 123.332 72.918 1.00 0.00 H TER 82721 WAT 8260 ATOM 82721 O WAT 8261 66.696 85.264 116.984 1.00 0.00 O ATOM 82722 H1 WAT 8261 66.843 84.952 117.877 1.00 0.00 H ATOM 82723 H2 WAT 8261 66.707 86.219 117.059 1.00 0.00 H TER 82725 WAT 8261 ATOM 82725 O WAT 8262 44.008 89.634 98.311 1.00 0.00 O ATOM 82726 H1 WAT 8262 43.613 90.476 98.539 1.00 0.00 H ATOM 82727 H2 WAT 8262 44.778 89.864 97.791 1.00 0.00 H TER 82729 WAT 8262 ATOM 82729 O WAT 8263 131.517 70.400 22.409 1.00 0.00 O ATOM 82730 H1 WAT 8263 131.554 71.355 22.355 1.00 0.00 H ATOM 82731 H2 WAT 8263 131.463 70.215 23.347 1.00 0.00 H TER 82733 WAT 8263 ATOM 82733 O WAT 8264 74.491 24.283 150.858 1.00 0.00 O ATOM 82734 H1 WAT 8264 74.631 24.808 150.070 1.00 0.00 H ATOM 82735 H2 WAT 8264 74.514 24.916 151.575 1.00 0.00 H TER 82737 WAT 8264 ATOM 82737 O WAT 8265 52.511 123.547 63.869 1.00 0.00 O ATOM 82738 H1 WAT 8265 52.748 123.669 64.788 1.00 0.00 H ATOM 82739 H2 WAT 8265 51.819 124.190 63.713 1.00 0.00 H TER 82741 WAT 8265 ATOM 82741 O WAT 8266 65.988 4.904 123.745 1.00 0.00 O ATOM 82742 H1 WAT 8266 65.081 4.617 123.644 1.00 0.00 H ATOM 82743 H2 WAT 8266 66.089 5.609 123.105 1.00 0.00 H TER 82745 WAT 8266 ATOM 82745 O WAT 8267 113.592 30.853 6.918 1.00 0.00 O ATOM 82746 H1 WAT 8267 113.587 30.014 7.378 1.00 0.00 H ATOM 82747 H2 WAT 8267 112.750 30.883 6.465 1.00 0.00 H TER 82749 WAT 8267 ATOM 82749 O WAT 8268 136.313 78.531 60.888 1.00 0.00 O ATOM 82750 H1 WAT 8268 136.889 78.055 60.290 1.00 0.00 H ATOM 82751 H2 WAT 8268 136.677 79.416 60.919 1.00 0.00 H TER 82753 WAT 8268 ATOM 82753 O WAT 8269 127.348 139.876 67.859 1.00 0.00 O ATOM 82754 H1 WAT 8269 126.770 139.167 68.141 1.00 0.00 H ATOM 82755 H2 WAT 8269 128.212 139.468 67.794 1.00 0.00 H TER 82757 WAT 8269 ATOM 82757 O WAT 8270 23.303 93.236 117.671 1.00 0.00 O ATOM 82758 H1 WAT 8270 23.096 93.370 116.746 1.00 0.00 H ATOM 82759 H2 WAT 8270 23.637 92.340 117.715 1.00 0.00 H TER 82761 WAT 8270 ATOM 82761 O WAT 8271 99.385 37.755 134.139 1.00 0.00 O ATOM 82762 H1 WAT 8271 100.156 37.923 133.597 1.00 0.00 H ATOM 82763 H2 WAT 8271 98.867 38.556 134.072 1.00 0.00 H TER 82765 WAT 8271 ATOM 82765 O WAT 8272 114.010 143.674 148.562 1.00 0.00 O ATOM 82766 H1 WAT 8272 114.635 143.218 147.999 1.00 0.00 H ATOM 82767 H2 WAT 8272 113.175 143.238 148.395 1.00 0.00 H TER 82769 WAT 8272 ATOM 82769 O WAT 8273 106.781 70.626 91.180 1.00 0.00 O ATOM 82770 H1 WAT 8273 107.094 70.000 91.833 1.00 0.00 H ATOM 82771 H2 WAT 8273 107.413 71.344 91.213 1.00 0.00 H TER 82773 WAT 8273 ATOM 82773 O WAT 8274 92.172 120.619 151.519 1.00 0.00 O ATOM 82774 H1 WAT 8274 92.952 120.079 151.644 1.00 0.00 H ATOM 82775 H2 WAT 8274 91.953 120.514 150.593 1.00 0.00 H TER 82777 WAT 8274 ATOM 82777 O WAT 8275 136.007 101.419 99.060 1.00 0.00 O ATOM 82778 H1 WAT 8275 136.732 101.975 98.776 1.00 0.00 H ATOM 82779 H2 WAT 8275 135.748 100.941 98.272 1.00 0.00 H TER 82781 WAT 8275 ATOM 82781 O WAT 8276 109.323 116.130 112.070 1.00 0.00 O ATOM 82782 H1 WAT 8276 108.643 116.769 112.284 1.00 0.00 H ATOM 82783 H2 WAT 8276 108.931 115.583 111.389 1.00 0.00 H TER 82785 WAT 8276 ATOM 82785 O WAT 8277 17.330 56.704 110.270 1.00 0.00 O ATOM 82786 H1 WAT 8277 17.266 57.652 110.151 1.00 0.00 H ATOM 82787 H2 WAT 8277 16.522 56.360 109.889 1.00 0.00 H TER 82789 WAT 8277 ATOM 82789 O WAT 8278 61.656 23.622 71.982 1.00 0.00 O ATOM 82790 H1 WAT 8278 62.353 22.971 71.906 1.00 0.00 H ATOM 82791 H2 WAT 8278 62.001 24.273 72.594 1.00 0.00 H TER 82793 WAT 8278 ATOM 82793 O WAT 8279 123.867 112.684 101.492 1.00 0.00 O ATOM 82794 H1 WAT 8279 124.448 111.924 101.482 1.00 0.00 H ATOM 82795 H2 WAT 8279 124.455 113.434 101.572 1.00 0.00 H TER 82797 WAT 8279 ATOM 82797 O WAT 8280 91.501 86.960 13.333 1.00 0.00 O ATOM 82798 H1 WAT 8280 90.682 86.850 12.850 1.00 0.00 H ATOM 82799 H2 WAT 8280 91.344 87.715 13.900 1.00 0.00 H TER 82801 WAT 8280 ATOM 82801 O WAT 8281 26.385 144.014 153.849 1.00 0.00 O ATOM 82802 H1 WAT 8281 25.613 143.603 154.237 1.00 0.00 H ATOM 82803 H2 WAT 8281 26.897 144.320 154.598 1.00 0.00 H TER 82805 WAT 8281 ATOM 82805 O WAT 8282 70.454 60.263 156.798 1.00 0.00 O ATOM 82806 H1 WAT 8282 69.988 60.924 156.285 1.00 0.00 H ATOM 82807 H2 WAT 8282 70.800 59.654 156.147 1.00 0.00 H TER 82809 WAT 8282 ATOM 82809 O WAT 8283 71.249 73.624 134.855 1.00 0.00 O ATOM 82810 H1 WAT 8283 71.209 72.722 134.539 1.00 0.00 H ATOM 82811 H2 WAT 8283 72.074 73.963 134.507 1.00 0.00 H TER 82813 WAT 8283 ATOM 82813 O WAT 8284 119.575 110.753 101.723 1.00 0.00 O ATOM 82814 H1 WAT 8284 119.142 110.732 102.577 1.00 0.00 H ATOM 82815 H2 WAT 8284 119.253 109.973 101.272 1.00 0.00 H TER 82817 WAT 8284 ATOM 82817 O WAT 8285 9.041 23.847 117.496 1.00 0.00 O ATOM 82818 H1 WAT 8285 9.610 23.649 116.752 1.00 0.00 H ATOM 82819 H2 WAT 8285 9.618 23.798 118.259 1.00 0.00 H TER 82821 WAT 8285 ATOM 82821 O WAT 8286 35.714 100.029 123.924 1.00 0.00 O ATOM 82822 H1 WAT 8286 35.452 100.928 124.125 1.00 0.00 H ATOM 82823 H2 WAT 8286 36.658 100.083 123.773 1.00 0.00 H TER 82825 WAT 8286 ATOM 82825 O WAT 8287 20.417 124.575 52.325 1.00 0.00 O ATOM 82826 H1 WAT 8287 19.792 124.926 52.959 1.00 0.00 H ATOM 82827 H2 WAT 8287 20.054 123.725 52.076 1.00 0.00 H TER 82829 WAT 8287 ATOM 82829 O WAT 8288 76.599 72.997 107.390 1.00 0.00 O ATOM 82830 H1 WAT 8288 76.296 73.236 106.514 1.00 0.00 H ATOM 82831 H2 WAT 8288 76.157 73.615 107.973 1.00 0.00 H TER 82833 WAT 8288 ATOM 82833 O WAT 8289 55.516 116.788 61.046 1.00 0.00 O ATOM 82834 H1 WAT 8289 55.444 117.156 60.166 1.00 0.00 H ATOM 82835 H2 WAT 8289 56.315 116.261 61.021 1.00 0.00 H TER 82837 WAT 8289 ATOM 82837 O WAT 8290 3.205 101.427 123.281 1.00 0.00 O ATOM 82838 H1 WAT 8290 3.621 100.799 123.871 1.00 0.00 H ATOM 82839 H2 WAT 8290 3.024 102.189 123.831 1.00 0.00 H TER 82841 WAT 8290 ATOM 82841 O WAT 8291 130.771 118.044 88.253 1.00 0.00 O ATOM 82842 H1 WAT 8291 130.404 118.497 89.012 1.00 0.00 H ATOM 82843 H2 WAT 8291 130.114 117.386 88.026 1.00 0.00 H TER 82845 WAT 8291 ATOM 82845 O WAT 8292 63.072 102.588 98.949 1.00 0.00 O ATOM 82846 H1 WAT 8292 63.222 101.716 99.312 1.00 0.00 H ATOM 82847 H2 WAT 8292 62.563 103.043 99.620 1.00 0.00 H TER 82849 WAT 8292 ATOM 82849 O WAT 8293 114.957 23.277 152.448 1.00 0.00 O ATOM 82850 H1 WAT 8293 114.448 23.719 153.128 1.00 0.00 H ATOM 82851 H2 WAT 8293 114.364 23.230 151.698 1.00 0.00 H TER 82853 WAT 8293 ATOM 82853 O WAT 8294 36.688 106.697 57.374 1.00 0.00 O ATOM 82854 H1 WAT 8294 37.240 107.229 57.947 1.00 0.00 H ATOM 82855 H2 WAT 8294 37.247 105.965 57.114 1.00 0.00 H TER 82857 WAT 8294 ATOM 82857 O WAT 8295 31.188 33.730 93.383 1.00 0.00 O ATOM 82858 H1 WAT 8295 31.157 32.775 93.330 1.00 0.00 H ATOM 82859 H2 WAT 8295 30.650 33.945 94.145 1.00 0.00 H TER 82861 WAT 8295 ATOM 82861 O WAT 8296 86.864 132.838 24.093 1.00 0.00 O ATOM 82862 H1 WAT 8296 86.432 132.114 24.547 1.00 0.00 H ATOM 82863 H2 WAT 8296 87.683 132.965 24.571 1.00 0.00 H TER 82865 WAT 8296 ATOM 82865 O WAT 8297 51.114 85.933 149.911 1.00 0.00 O ATOM 82866 H1 WAT 8297 50.543 86.684 150.076 1.00 0.00 H ATOM 82867 H2 WAT 8297 50.525 85.179 149.910 1.00 0.00 H TER 82869 WAT 8297 ATOM 82869 O WAT 8298 38.881 44.349 69.466 1.00 0.00 O ATOM 82870 H1 WAT 8298 39.675 44.847 69.662 1.00 0.00 H ATOM 82871 H2 WAT 8298 38.292 44.987 69.063 1.00 0.00 H TER 82873 WAT 8298 ATOM 82873 O WAT 8299 56.471 75.038 96.971 1.00 0.00 O ATOM 82874 H1 WAT 8299 56.457 74.689 97.862 1.00 0.00 H ATOM 82875 H2 WAT 8299 55.735 75.649 96.941 1.00 0.00 H TER 82877 WAT 8299 ATOM 82877 O WAT 8300 104.001 59.466 95.029 1.00 0.00 O ATOM 82878 H1 WAT 8300 103.367 58.931 94.552 1.00 0.00 H ATOM 82879 H2 WAT 8300 104.817 58.967 94.984 1.00 0.00 H TER 82881 WAT 8300 ATOM 82881 O WAT 8301 105.694 30.963 140.104 1.00 0.00 O ATOM 82882 H1 WAT 8301 105.557 30.036 139.907 1.00 0.00 H ATOM 82883 H2 WAT 8301 105.129 31.134 140.857 1.00 0.00 H TER 82885 WAT 8301 ATOM 82885 O WAT 8302 91.193 87.076 131.837 1.00 0.00 O ATOM 82886 H1 WAT 8302 90.954 87.877 131.370 1.00 0.00 H ATOM 82887 H2 WAT 8302 90.386 86.563 131.862 1.00 0.00 H TER 82889 WAT 8302 ATOM 82889 O WAT 8303 78.240 113.107 111.124 1.00 0.00 O ATOM 82890 H1 WAT 8303 79.060 113.584 111.000 1.00 0.00 H ATOM 82891 H2 WAT 8303 77.708 113.684 111.672 1.00 0.00 H TER 82893 WAT 8303 ATOM 82893 O WAT 8304 12.570 60.983 3.389 1.00 0.00 O ATOM 82894 H1 WAT 8304 13.119 61.047 2.608 1.00 0.00 H ATOM 82895 H2 WAT 8304 12.039 61.780 3.375 1.00 0.00 H TER 82897 WAT 8304 ATOM 82897 O WAT 8305 45.877 107.358 101.285 1.00 0.00 O ATOM 82898 H1 WAT 8305 46.593 107.987 101.377 1.00 0.00 H ATOM 82899 H2 WAT 8305 45.990 106.757 102.021 1.00 0.00 H TER 82901 WAT 8305 ATOM 82901 O WAT 8306 33.235 113.989 114.196 1.00 0.00 O ATOM 82902 H1 WAT 8306 33.844 113.718 114.882 1.00 0.00 H ATOM 82903 H2 WAT 8306 32.457 114.286 114.669 1.00 0.00 H TER 82905 WAT 8306 ATOM 82905 O WAT 8307 98.582 68.274 60.952 1.00 0.00 O ATOM 82906 H1 WAT 8307 98.648 67.552 61.576 1.00 0.00 H ATOM 82907 H2 WAT 8307 99.453 68.332 60.559 1.00 0.00 H TER 82909 WAT 8307 ATOM 82909 O WAT 8308 119.854 98.480 120.970 1.00 0.00 O ATOM 82910 H1 WAT 8308 120.329 98.644 121.785 1.00 0.00 H ATOM 82911 H2 WAT 8308 119.327 99.267 120.838 1.00 0.00 H TER 82913 WAT 8308 ATOM 82913 O WAT 8309 114.195 50.883 95.670 1.00 0.00 O ATOM 82914 H1 WAT 8309 113.602 51.623 95.534 1.00 0.00 H ATOM 82915 H2 WAT 8309 114.593 51.049 96.524 1.00 0.00 H TER 82917 WAT 8309 ATOM 82917 O WAT 8310 0.731 37.100 140.425 1.00 0.00 O ATOM 82918 H1 WAT 8310 0.654 37.319 139.497 1.00 0.00 H ATOM 82919 H2 WAT 8310 1.553 36.613 140.489 1.00 0.00 H TER 82921 WAT 8310 ATOM 82921 O WAT 8311 60.582 105.013 113.467 1.00 0.00 O ATOM 82922 H1 WAT 8311 61.513 104.809 113.371 1.00 0.00 H ATOM 82923 H2 WAT 8311 60.567 105.911 113.800 1.00 0.00 H TER 82925 WAT 8311 ATOM 82925 O WAT 8312 123.644 36.360 133.844 1.00 0.00 O ATOM 82926 H1 WAT 8312 123.398 36.855 134.626 1.00 0.00 H ATOM 82927 H2 WAT 8312 124.444 36.785 133.534 1.00 0.00 H TER 82929 WAT 8312 ATOM 82929 O WAT 8313 60.011 139.518 62.317 1.00 0.00 O ATOM 82930 H1 WAT 8313 60.567 138.959 61.773 1.00 0.00 H ATOM 82931 H2 WAT 8313 59.814 138.984 63.086 1.00 0.00 H TER 82933 WAT 8313 ATOM 82933 O WAT 8314 98.060 3.251 143.256 1.00 0.00 O ATOM 82934 H1 WAT 8314 98.781 3.660 142.779 1.00 0.00 H ATOM 82935 H2 WAT 8314 97.297 3.788 143.043 1.00 0.00 H TER 82937 WAT 8314 ATOM 82937 O WAT 8315 83.623 96.601 23.687 1.00 0.00 O ATOM 82938 H1 WAT 8315 84.142 97.372 23.918 1.00 0.00 H ATOM 82939 H2 WAT 8315 84.270 95.949 23.418 1.00 0.00 H TER 82941 WAT 8315 ATOM 82941 O WAT 8316 122.460 19.553 72.948 1.00 0.00 O ATOM 82942 H1 WAT 8316 122.534 18.783 73.513 1.00 0.00 H ATOM 82943 H2 WAT 8316 123.343 19.680 72.600 1.00 0.00 H TER 82945 WAT 8316 ATOM 82945 O WAT 8317 94.241 124.506 152.711 1.00 0.00 O ATOM 82946 H1 WAT 8317 93.361 124.170 152.539 1.00 0.00 H ATOM 82947 H2 WAT 8317 94.491 124.106 153.544 1.00 0.00 H TER 82949 WAT 8317 ATOM 82949 O WAT 8318 128.950 62.305 17.393 1.00 0.00 O ATOM 82950 H1 WAT 8318 129.280 63.136 17.051 1.00 0.00 H ATOM 82951 H2 WAT 8318 128.129 62.162 16.922 1.00 0.00 H TER 82953 WAT 8318 ATOM 82953 O WAT 8319 50.418 120.740 82.799 1.00 0.00 O ATOM 82954 H1 WAT 8319 50.750 121.637 82.788 1.00 0.00 H ATOM 82955 H2 WAT 8319 49.563 120.796 82.372 1.00 0.00 H TER 82957 WAT 8319 ATOM 82957 O WAT 8320 46.303 97.589 23.200 1.00 0.00 O ATOM 82958 H1 WAT 8320 45.386 97.502 22.941 1.00 0.00 H ATOM 82959 H2 WAT 8320 46.792 97.151 22.503 1.00 0.00 H TER 82961 WAT 8320 ATOM 82961 O WAT 8321 24.032 46.554 11.079 1.00 0.00 O ATOM 82962 H1 WAT 8321 24.137 45.684 11.464 1.00 0.00 H ATOM 82963 H2 WAT 8321 23.700 47.095 11.796 1.00 0.00 H TER 82965 WAT 8321 ATOM 82965 O WAT 8322 25.549 70.039 129.784 1.00 0.00 O ATOM 82966 H1 WAT 8322 26.042 70.838 129.972 1.00 0.00 H ATOM 82967 H2 WAT 8322 24.954 70.287 129.077 1.00 0.00 H TER 82969 WAT 8322 ATOM 82969 O WAT 8323 115.815 86.660 74.786 1.00 0.00 O ATOM 82970 H1 WAT 8323 116.728 86.573 75.058 1.00 0.00 H ATOM 82971 H2 WAT 8323 115.365 87.000 75.559 1.00 0.00 H TER 82973 WAT 8323 ATOM 82973 O WAT 8324 33.903 86.185 107.019 1.00 0.00 O ATOM 82974 H1 WAT 8324 33.787 85.431 106.440 1.00 0.00 H ATOM 82975 H2 WAT 8324 34.675 85.969 107.541 1.00 0.00 H TER 82977 WAT 8324 ATOM 82977 O WAT 8325 87.788 117.558 96.115 1.00 0.00 O ATOM 82978 H1 WAT 8325 87.122 116.872 96.165 1.00 0.00 H ATOM 82979 H2 WAT 8325 88.445 117.303 96.762 1.00 0.00 H TER 82981 WAT 8325 ATOM 82981 O WAT 8326 132.168 67.712 145.447 1.00 0.00 O ATOM 82982 H1 WAT 8326 131.995 68.350 144.755 1.00 0.00 H ATOM 82983 H2 WAT 8326 132.972 68.022 145.864 1.00 0.00 H TER 82985 WAT 8326 ATOM 82985 O WAT 8327 6.776 59.442 97.168 1.00 0.00 O ATOM 82986 H1 WAT 8327 7.531 58.874 97.323 1.00 0.00 H ATOM 82987 H2 WAT 8327 7.135 60.196 96.700 1.00 0.00 H TER 82989 WAT 8327 ATOM 82989 O WAT 8328 117.254 113.142 111.038 1.00 0.00 O ATOM 82990 H1 WAT 8328 116.649 113.874 110.918 1.00 0.00 H ATOM 82991 H2 WAT 8328 116.756 112.500 111.544 1.00 0.00 H TER 82993 WAT 8328 ATOM 82993 O WAT 8329 131.382 48.507 108.786 1.00 0.00 O ATOM 82994 H1 WAT 8329 130.488 48.171 108.844 1.00 0.00 H ATOM 82995 H2 WAT 8329 131.931 47.723 108.761 1.00 0.00 H TER 82997 WAT 8329 ATOM 82997 O WAT 8330 111.577 132.105 93.789 1.00 0.00 O ATOM 82998 H1 WAT 8330 111.526 132.802 94.443 1.00 0.00 H ATOM 82999 H2 WAT 8330 111.221 132.499 92.992 1.00 0.00 H TER 83001 WAT 8330 ATOM 83001 O WAT 8331 86.837 30.031 69.779 1.00 0.00 O ATOM 83002 H1 WAT 8331 86.133 29.908 69.142 1.00 0.00 H ATOM 83003 H2 WAT 8331 87.641 29.935 69.269 1.00 0.00 H TER 83005 WAT 8331 ATOM 83005 O WAT 8332 20.148 122.456 142.765 1.00 0.00 O ATOM 83006 H1 WAT 8332 21.003 122.028 142.808 1.00 0.00 H ATOM 83007 H2 WAT 8332 20.350 123.392 142.751 1.00 0.00 H TER 83009 WAT 8332 ATOM 83009 O WAT 8333 137.509 53.175 110.821 1.00 0.00 O ATOM 83010 H1 WAT 8333 138.190 52.791 110.269 1.00 0.00 H ATOM 83011 H2 WAT 8333 136.754 53.268 110.240 1.00 0.00 H TER 83013 WAT 8333 ATOM 83013 O WAT 8334 86.417 83.773 88.553 1.00 0.00 O ATOM 83014 H1 WAT 8334 86.225 84.258 89.356 1.00 0.00 H ATOM 83015 H2 WAT 8334 87.349 83.925 88.398 1.00 0.00 H TER 83017 WAT 8334 ATOM 83017 O WAT 8335 29.962 23.177 122.351 1.00 0.00 O ATOM 83018 H1 WAT 8335 29.037 23.371 122.501 1.00 0.00 H ATOM 83019 H2 WAT 8335 29.959 22.339 121.889 1.00 0.00 H TER 83021 WAT 8335 ATOM 83021 O WAT 8336 141.741 138.715 67.425 1.00 0.00 O ATOM 83022 H1 WAT 8336 141.376 139.518 67.796 1.00 0.00 H ATOM 83023 H2 WAT 8336 141.006 138.305 66.970 1.00 0.00 H TER 83025 WAT 8336 ATOM 83025 O WAT 8337 72.188 142.209 71.036 1.00 0.00 O ATOM 83026 H1 WAT 8337 72.453 142.371 71.942 1.00 0.00 H ATOM 83027 H2 WAT 8337 71.948 141.282 71.020 1.00 0.00 H TER 83029 WAT 8337 ATOM 83029 O WAT 8338 78.244 93.481 120.168 1.00 0.00 O ATOM 83030 H1 WAT 8338 78.213 92.660 120.660 1.00 0.00 H ATOM 83031 H2 WAT 8338 79.175 93.626 120.002 1.00 0.00 H TER 83033 WAT 8338 ATOM 83033 O WAT 8339 13.102 134.458 115.247 1.00 0.00 O ATOM 83034 H1 WAT 8339 13.990 134.656 114.952 1.00 0.00 H ATOM 83035 H2 WAT 8339 13.159 133.571 115.601 1.00 0.00 H TER 83037 WAT 8339 ATOM 83037 O WAT 8340 103.088 1.160 134.879 1.00 0.00 O ATOM 83038 H1 WAT 8340 102.595 0.358 134.706 1.00 0.00 H ATOM 83039 H2 WAT 8340 103.641 0.943 135.631 1.00 0.00 H TER 83041 WAT 8340 ATOM 83041 O WAT 8341 108.405 15.699 64.651 1.00 0.00 O ATOM 83042 H1 WAT 8341 108.538 16.635 64.505 1.00 0.00 H ATOM 83043 H2 WAT 8341 107.924 15.401 63.879 1.00 0.00 H TER 83045 WAT 8341 ATOM 83045 O WAT 8342 97.465 143.111 52.323 1.00 0.00 O ATOM 83046 H1 WAT 8342 96.540 142.895 52.203 1.00 0.00 H ATOM 83047 H2 WAT 8342 97.565 143.225 53.268 1.00 0.00 H TER 83049 WAT 8342 ATOM 83049 O WAT 8343 103.734 93.168 136.435 1.00 0.00 O ATOM 83050 H1 WAT 8343 103.757 93.419 137.358 1.00 0.00 H ATOM 83051 H2 WAT 8343 102.917 93.541 136.105 1.00 0.00 H TER 83053 WAT 8343 ATOM 83053 O WAT 8344 35.434 8.942 78.696 1.00 0.00 O ATOM 83054 H1 WAT 8344 34.931 9.122 79.490 1.00 0.00 H ATOM 83055 H2 WAT 8344 34.869 9.237 77.982 1.00 0.00 H TER 83057 WAT 8344 ATOM 83057 O WAT 8345 30.970 14.238 1.050 1.00 0.00 O ATOM 83058 H1 WAT 8345 31.904 14.235 0.838 1.00 0.00 H ATOM 83059 H2 WAT 8345 30.586 14.855 0.427 1.00 0.00 H TER 83061 WAT 8345 ATOM 83061 O WAT 8346 132.219 112.496 155.821 1.00 0.00 O ATOM 83062 H1 WAT 8346 132.847 113.141 156.147 1.00 0.00 H ATOM 83063 H2 WAT 8346 131.373 112.794 156.157 1.00 0.00 H TER 83065 WAT 8346 ATOM 83065 O WAT 8347 140.722 54.513 128.720 1.00 0.00 O ATOM 83066 H1 WAT 8347 140.279 54.351 127.887 1.00 0.00 H ATOM 83067 H2 WAT 8347 141.620 54.214 128.576 1.00 0.00 H TER 83069 WAT 8347 ATOM 83069 O WAT 8348 70.434 135.321 82.659 1.00 0.00 O ATOM 83070 H1 WAT 8348 70.434 136.037 82.024 1.00 0.00 H ATOM 83071 H2 WAT 8348 71.001 134.656 82.269 1.00 0.00 H TER 83073 WAT 8348 ATOM 83073 O WAT 8349 91.115 56.879 80.283 1.00 0.00 O ATOM 83074 H1 WAT 8349 91.221 57.787 79.999 1.00 0.00 H ATOM 83075 H2 WAT 8349 91.415 56.876 81.192 1.00 0.00 H TER 83077 WAT 8349 ATOM 83077 O WAT 8350 111.145 1.422 2.542 1.00 0.00 O ATOM 83078 H1 WAT 8350 110.402 1.962 2.271 1.00 0.00 H ATOM 83079 H2 WAT 8350 111.246 0.783 1.836 1.00 0.00 H TER 83081 WAT 8350 ATOM 83081 O WAT 8351 30.412 145.548 140.266 1.00 0.00 O ATOM 83082 H1 WAT 8351 29.839 145.179 140.939 1.00 0.00 H ATOM 83083 H2 WAT 8351 31.217 145.770 140.733 1.00 0.00 H TER 83085 WAT 8351 ATOM 83085 O WAT 8352 5.422 89.559 100.632 1.00 0.00 O ATOM 83086 H1 WAT 8352 5.265 90.157 99.901 1.00 0.00 H ATOM 83087 H2 WAT 8352 4.743 89.777 101.270 1.00 0.00 H TER 83089 WAT 8352 ATOM 83089 O WAT 8353 33.795 16.394 156.221 1.00 0.00 O ATOM 83090 H1 WAT 8353 33.581 15.708 155.589 1.00 0.00 H ATOM 83091 H2 WAT 8353 34.181 17.094 155.693 1.00 0.00 H TER 83093 WAT 8353 ATOM 83093 O WAT 8354 86.527 123.122 102.042 1.00 0.00 O ATOM 83094 H1 WAT 8354 87.187 123.438 102.660 1.00 0.00 H ATOM 83095 H2 WAT 8354 86.256 122.274 102.394 1.00 0.00 H TER 83097 WAT 8354 ATOM 83097 O WAT 8355 131.552 98.493 65.366 1.00 0.00 O ATOM 83098 H1 WAT 8355 131.044 97.768 65.730 1.00 0.00 H ATOM 83099 H2 WAT 8355 131.969 98.899 66.126 1.00 0.00 H TER 83101 WAT 8355 ATOM 83101 O WAT 8356 101.391 106.647 113.310 1.00 0.00 O ATOM 83102 H1 WAT 8356 100.587 106.420 112.843 1.00 0.00 H ATOM 83103 H2 WAT 8356 101.104 106.841 114.202 1.00 0.00 H TER 83105 WAT 8356 ATOM 83105 O WAT 8357 96.599 114.540 89.165 1.00 0.00 O ATOM 83106 H1 WAT 8357 96.862 113.684 89.505 1.00 0.00 H ATOM 83107 H2 WAT 8357 96.833 115.156 89.859 1.00 0.00 H TER 83109 WAT 8357 ATOM 83109 O WAT 8358 91.348 98.323 155.346 1.00 0.00 O ATOM 83110 H1 WAT 8358 92.158 98.379 155.854 1.00 0.00 H ATOM 83111 H2 WAT 8358 90.656 98.270 156.004 1.00 0.00 H TER 83113 WAT 8358 ATOM 83113 O WAT 8359 33.075 22.026 143.154 1.00 0.00 O ATOM 83114 H1 WAT 8359 33.073 21.803 142.223 1.00 0.00 H ATOM 83115 H2 WAT 8359 32.458 21.410 143.549 1.00 0.00 H TER 83117 WAT 8359 ATOM 83117 O WAT 8360 28.738 65.446 58.907 1.00 0.00 O ATOM 83118 H1 WAT 8360 28.382 64.680 58.456 1.00 0.00 H ATOM 83119 H2 WAT 8360 29.662 65.235 59.044 1.00 0.00 H TER 83121 WAT 8360 ATOM 83121 O WAT 8361 114.357 73.062 72.796 1.00 0.00 O ATOM 83122 H1 WAT 8361 114.250 74.009 72.884 1.00 0.00 H ATOM 83123 H2 WAT 8361 113.485 72.743 72.562 1.00 0.00 H TER 83125 WAT 8361 ATOM 83125 O WAT 8362 122.106 21.169 149.084 1.00 0.00 O ATOM 83126 H1 WAT 8362 121.952 21.842 148.421 1.00 0.00 H ATOM 83127 H2 WAT 8362 121.947 21.612 149.917 1.00 0.00 H TER 83129 WAT 8362 ATOM 83129 O WAT 8363 74.532 66.111 1.782 1.00 0.00 O ATOM 83130 H1 WAT 8363 74.926 66.338 0.940 1.00 0.00 H ATOM 83131 H2 WAT 8363 73.810 65.524 1.559 1.00 0.00 H TER 83133 WAT 8363 ATOM 83133 O WAT 8364 113.289 125.439 145.418 1.00 0.00 O ATOM 83134 H1 WAT 8364 112.690 126.184 145.368 1.00 0.00 H ATOM 83135 H2 WAT 8364 114.081 125.738 144.971 1.00 0.00 H TER 83137 WAT 8364 ATOM 83137 O WAT 8365 71.999 131.661 132.964 1.00 0.00 O ATOM 83138 H1 WAT 8365 72.840 131.536 132.524 1.00 0.00 H ATOM 83139 H2 WAT 8365 71.350 131.351 132.333 1.00 0.00 H TER 83141 WAT 8365 ATOM 83141 O WAT 8366 86.593 85.831 0.372 1.00 0.00 O ATOM 83142 H1 WAT 8366 86.239 86.314 1.119 1.00 0.00 H ATOM 83143 H2 WAT 8366 87.448 85.522 0.670 1.00 0.00 H TER 83145 WAT 8366 ATOM 83145 O WAT 8367 82.512 63.675 96.509 1.00 0.00 O ATOM 83146 H1 WAT 8367 83.037 64.343 96.070 1.00 0.00 H ATOM 83147 H2 WAT 8367 81.991 63.281 95.809 1.00 0.00 H TER 83149 WAT 8367 ATOM 83149 O WAT 8368 66.994 73.520 15.275 1.00 0.00 O ATOM 83150 H1 WAT 8368 67.502 73.122 15.982 1.00 0.00 H ATOM 83151 H2 WAT 8368 67.605 73.569 14.540 1.00 0.00 H TER 83153 WAT 8368 ATOM 83153 O WAT 8369 54.393 119.160 149.361 1.00 0.00 O ATOM 83154 H1 WAT 8369 53.964 118.861 148.559 1.00 0.00 H ATOM 83155 H2 WAT 8369 55.178 119.615 149.056 1.00 0.00 H TER 83157 WAT 8369 ATOM 83157 O WAT 8370 40.517 7.716 64.636 1.00 0.00 O ATOM 83158 H1 WAT 8370 40.431 7.041 63.963 1.00 0.00 H ATOM 83159 H2 WAT 8370 39.740 8.265 64.525 1.00 0.00 H TER 83161 WAT 8370 ATOM 83161 O WAT 8371 71.790 138.191 69.865 1.00 0.00 O ATOM 83162 H1 WAT 8371 72.421 138.608 69.279 1.00 0.00 H ATOM 83163 H2 WAT 8371 71.287 137.606 69.298 1.00 0.00 H TER 83165 WAT 8371 ATOM 83165 O WAT 8372 83.524 45.574 79.859 1.00 0.00 O ATOM 83166 H1 WAT 8372 83.839 45.309 78.995 1.00 0.00 H ATOM 83167 H2 WAT 8372 82.730 45.057 79.993 1.00 0.00 H TER 83169 WAT 8372 ATOM 83169 O WAT 8373 142.522 124.913 136.395 1.00 0.00 O ATOM 83170 H1 WAT 8373 141.719 124.909 136.916 1.00 0.00 H ATOM 83171 H2 WAT 8373 142.775 125.836 136.353 1.00 0.00 H TER 83173 WAT 8373 ATOM 83173 O WAT 8374 52.133 121.533 141.742 1.00 0.00 O ATOM 83174 H1 WAT 8374 52.728 122.216 141.434 1.00 0.00 H ATOM 83175 H2 WAT 8374 51.272 121.951 141.754 1.00 0.00 H TER 83177 WAT 8374 ATOM 83177 O WAT 8375 129.523 118.796 21.765 1.00 0.00 O ATOM 83178 H1 WAT 8375 129.861 119.627 22.100 1.00 0.00 H ATOM 83179 H2 WAT 8375 129.021 119.038 20.987 1.00 0.00 H TER 83181 WAT 8375 ATOM 83181 O WAT 8376 55.742 56.587 144.424 1.00 0.00 O ATOM 83182 H1 WAT 8376 55.962 55.783 143.952 1.00 0.00 H ATOM 83183 H2 WAT 8376 56.248 56.534 145.235 1.00 0.00 H TER 83185 WAT 8376 ATOM 83185 O WAT 8377 8.914 81.132 22.608 1.00 0.00 O ATOM 83186 H1 WAT 8377 9.717 81.063 23.124 1.00 0.00 H ATOM 83187 H2 WAT 8377 8.325 81.657 23.150 1.00 0.00 H TER 83189 WAT 8377 ATOM 83189 O WAT 8378 10.424 48.533 96.545 1.00 0.00 O ATOM 83190 H1 WAT 8378 10.906 48.431 95.725 1.00 0.00 H ATOM 83191 H2 WAT 8378 10.906 49.206 97.025 1.00 0.00 H TER 83193 WAT 8378 ATOM 83193 O WAT 8379 138.299 105.695 29.294 1.00 0.00 O ATOM 83194 H1 WAT 8379 138.283 105.510 28.355 1.00 0.00 H ATOM 83195 H2 WAT 8379 138.140 104.847 29.708 1.00 0.00 H TER 83197 WAT 8379 ATOM 83197 O WAT 8380 94.073 48.183 136.513 1.00 0.00 O ATOM 83198 H1 WAT 8380 93.865 47.386 136.025 1.00 0.00 H ATOM 83199 H2 WAT 8380 93.352 48.780 136.314 1.00 0.00 H TER 83201 WAT 8380 ATOM 83201 O WAT 8381 99.671 104.723 111.980 1.00 0.00 O ATOM 83202 H1 WAT 8381 100.041 103.933 112.375 1.00 0.00 H ATOM 83203 H2 WAT 8381 98.763 104.490 111.785 1.00 0.00 H TER 83205 WAT 8381 ATOM 83205 O WAT 8382 105.658 49.710 78.199 1.00 0.00 O ATOM 83206 H1 WAT 8382 105.043 49.450 77.513 1.00 0.00 H ATOM 83207 H2 WAT 8382 106.517 49.668 77.779 1.00 0.00 H TER 83209 WAT 8382 ATOM 83209 O WAT 8383 48.544 94.142 106.025 1.00 0.00 O ATOM 83210 H1 WAT 8383 47.870 93.480 106.177 1.00 0.00 H ATOM 83211 H2 WAT 8383 49.000 94.216 106.864 1.00 0.00 H TER 83213 WAT 8383 ATOM 83213 O WAT 8384 130.236 134.971 5.390 1.00 0.00 O ATOM 83214 H1 WAT 8384 130.840 135.308 6.052 1.00 0.00 H ATOM 83215 H2 WAT 8384 129.443 135.494 5.502 1.00 0.00 H TER 83217 WAT 8384 ATOM 83217 O WAT 8385 117.739 20.144 56.028 1.00 0.00 O ATOM 83218 H1 WAT 8385 118.324 20.901 56.070 1.00 0.00 H ATOM 83219 H2 WAT 8385 118.321 19.400 55.875 1.00 0.00 H TER 83221 WAT 8385 ATOM 83221 O WAT 8386 41.039 69.173 128.668 1.00 0.00 O ATOM 83222 H1 WAT 8386 40.097 69.346 128.675 1.00 0.00 H ATOM 83223 H2 WAT 8386 41.156 68.463 129.300 1.00 0.00 H TER 83225 WAT 8386 ATOM 83225 O WAT 8387 44.957 138.447 112.456 1.00 0.00 O ATOM 83226 H1 WAT 8387 45.499 139.206 112.669 1.00 0.00 H ATOM 83227 H2 WAT 8387 45.547 137.699 112.545 1.00 0.00 H TER 83229 WAT 8387 ATOM 83229 O WAT 8388 96.228 75.375 76.606 1.00 0.00 O ATOM 83230 H1 WAT 8388 97.069 75.543 76.181 1.00 0.00 H ATOM 83231 H2 WAT 8388 95.710 76.160 76.429 1.00 0.00 H TER 83233 WAT 8388 ATOM 83233 O WAT 8389 21.253 62.345 151.136 1.00 0.00 O ATOM 83234 H1 WAT 8389 20.491 61.767 151.092 1.00 0.00 H ATOM 83235 H2 WAT 8389 20.898 63.190 151.412 1.00 0.00 H TER 83237 WAT 8389 ATOM 83237 O WAT 8390 107.541 53.453 58.381 1.00 0.00 O ATOM 83238 H1 WAT 8390 107.414 54.041 57.637 1.00 0.00 H ATOM 83239 H2 WAT 8390 108.481 53.272 58.386 1.00 0.00 H TER 83241 WAT 8390 ATOM 83241 O WAT 8391 99.925 103.761 116.517 1.00 0.00 O ATOM 83242 H1 WAT 8391 99.509 103.990 117.347 1.00 0.00 H ATOM 83243 H2 WAT 8391 100.849 103.979 116.644 1.00 0.00 H TER 83245 WAT 8391 ATOM 83245 O WAT 8392 105.428 38.615 76.743 1.00 0.00 O ATOM 83246 H1 WAT 8392 105.135 39.478 76.450 1.00 0.00 H ATOM 83247 H2 WAT 8392 105.200 38.027 76.023 1.00 0.00 H TER 83249 WAT 8392 ATOM 83249 O WAT 8393 106.172 11.616 115.544 1.00 0.00 O ATOM 83250 H1 WAT 8393 106.037 12.155 114.764 1.00 0.00 H ATOM 83251 H2 WAT 8393 107.017 11.902 115.890 1.00 0.00 H TER 83253 WAT 8393 ATOM 83253 O WAT 8394 28.968 86.612 1.395 1.00 0.00 O ATOM 83254 H1 WAT 8394 29.631 87.011 1.960 1.00 0.00 H ATOM 83255 H2 WAT 8394 29.455 86.320 0.625 1.00 0.00 H TER 83257 WAT 8394 ATOM 83257 O WAT 8395 13.374 143.756 93.335 1.00 0.00 O ATOM 83258 H1 WAT 8395 13.338 143.928 92.394 1.00 0.00 H ATOM 83259 H2 WAT 8395 12.626 144.233 93.695 1.00 0.00 H TER 83261 WAT 8395 ATOM 83261 O WAT 8396 71.329 81.463 125.079 1.00 0.00 O ATOM 83262 H1 WAT 8396 71.474 81.182 124.175 1.00 0.00 H ATOM 83263 H2 WAT 8396 70.897 82.313 124.999 1.00 0.00 H TER 83265 WAT 8396 ATOM 83265 O WAT 8397 127.446 7.216 92.699 1.00 0.00 O ATOM 83266 H1 WAT 8397 128.004 6.612 93.189 1.00 0.00 H ATOM 83267 H2 WAT 8397 127.538 8.051 93.157 1.00 0.00 H TER 83269 WAT 8397 ATOM 83269 O WAT 8398 88.552 101.106 8.470 1.00 0.00 O ATOM 83270 H1 WAT 8398 87.938 100.924 7.759 1.00 0.00 H ATOM 83271 H2 WAT 8398 89.279 101.564 8.049 1.00 0.00 H TER 83273 WAT 8398 ATOM 83273 O WAT 8399 80.793 121.550 89.086 1.00 0.00 O ATOM 83274 H1 WAT 8399 81.748 121.489 89.124 1.00 0.00 H ATOM 83275 H2 WAT 8399 80.486 120.748 89.510 1.00 0.00 H TER 83277 WAT 8399 ATOM 83277 O WAT 8400 97.223 100.091 141.015 1.00 0.00 O ATOM 83278 H1 WAT 8400 97.713 100.807 140.608 1.00 0.00 H ATOM 83279 H2 WAT 8400 97.494 100.108 141.933 1.00 0.00 H TER 83281 WAT 8400 ATOM 83281 O WAT 8401 59.566 10.837 121.274 1.00 0.00 O ATOM 83282 H1 WAT 8401 60.044 10.009 121.312 1.00 0.00 H ATOM 83283 H2 WAT 8401 60.052 11.421 121.855 1.00 0.00 H TER 83285 WAT 8401 ATOM 83285 O WAT 8402 135.441 117.563 153.585 1.00 0.00 O ATOM 83286 H1 WAT 8402 135.133 117.237 152.740 1.00 0.00 H ATOM 83287 H2 WAT 8402 135.505 118.511 153.468 1.00 0.00 H TER 83289 WAT 8402 ATOM 83289 O WAT 8403 102.831 134.618 87.381 1.00 0.00 O ATOM 83290 H1 WAT 8403 102.167 134.445 86.714 1.00 0.00 H ATOM 83291 H2 WAT 8403 102.499 135.380 87.857 1.00 0.00 H TER 83293 WAT 8403 ATOM 83293 O WAT 8404 77.692 125.638 131.157 1.00 0.00 O ATOM 83294 H1 WAT 8404 76.824 125.584 130.756 1.00 0.00 H ATOM 83295 H2 WAT 8404 78.204 124.962 130.713 1.00 0.00 H TER 83297 WAT 8404 ATOM 83297 O WAT 8405 93.719 29.631 105.954 1.00 0.00 O ATOM 83298 H1 WAT 8405 93.650 30.366 106.564 1.00 0.00 H ATOM 83299 H2 WAT 8405 93.989 28.892 106.499 1.00 0.00 H TER 83301 WAT 8405 ATOM 83301 O WAT 8406 10.627 22.213 76.978 1.00 0.00 O ATOM 83302 H1 WAT 8406 11.292 21.938 77.608 1.00 0.00 H ATOM 83303 H2 WAT 8406 10.409 23.109 77.236 1.00 0.00 H TER 83305 WAT 8406 ATOM 83305 O WAT 8407 21.176 39.146 137.502 1.00 0.00 O ATOM 83306 H1 WAT 8407 21.032 38.536 138.225 1.00 0.00 H ATOM 83307 H2 WAT 8407 22.105 39.054 137.291 1.00 0.00 H TER 83309 WAT 8407 ATOM 83309 O WAT 8408 124.910 36.274 15.058 1.00 0.00 O ATOM 83310 H1 WAT 8408 124.728 36.467 14.138 1.00 0.00 H ATOM 83311 H2 WAT 8408 124.648 37.067 15.526 1.00 0.00 H TER 83313 WAT 8408 ATOM 83313 O WAT 8409 130.329 49.608 137.399 1.00 0.00 O ATOM 83314 H1 WAT 8409 130.223 49.184 138.251 1.00 0.00 H ATOM 83315 H2 WAT 8409 129.676 49.188 136.839 1.00 0.00 H TER 83317 WAT 8409 ATOM 83317 O WAT 8410 44.475 131.004 157.018 1.00 0.00 O ATOM 83318 H1 WAT 8410 44.612 131.670 157.691 1.00 0.00 H ATOM 83319 H2 WAT 8410 43.703 131.304 156.537 1.00 0.00 H TER 83321 WAT 8410 ATOM 83321 O WAT 8411 5.790 140.469 112.472 1.00 0.00 O ATOM 83322 H1 WAT 8411 5.010 140.036 112.819 1.00 0.00 H ATOM 83323 H2 WAT 8411 6.212 140.854 113.240 1.00 0.00 H TER 83325 WAT 8411 ATOM 83325 O WAT 8412 49.568 38.676 92.866 1.00 0.00 O ATOM 83326 H1 WAT 8412 49.345 37.749 92.958 1.00 0.00 H ATOM 83327 H2 WAT 8412 49.005 38.989 92.159 1.00 0.00 H TER 83329 WAT 8412 ATOM 83329 O WAT 8413 95.308 1.228 105.121 1.00 0.00 O ATOM 83330 H1 WAT 8413 96.046 0.913 104.599 1.00 0.00 H ATOM 83331 H2 WAT 8413 95.324 0.687 105.910 1.00 0.00 H TER 83333 WAT 8413 ATOM 83333 O WAT 8414 8.262 133.560 93.367 1.00 0.00 O ATOM 83334 H1 WAT 8414 8.822 133.940 94.044 1.00 0.00 H ATOM 83335 H2 WAT 8414 8.300 134.187 92.645 1.00 0.00 H TER 83337 WAT 8414 ATOM 83337 O WAT 8415 29.905 35.439 121.689 1.00 0.00 O ATOM 83338 H1 WAT 8415 28.985 35.662 121.545 1.00 0.00 H ATOM 83339 H2 WAT 8415 29.890 34.520 121.956 1.00 0.00 H TER 83341 WAT 8415 ATOM 83341 O WAT 8416 66.288 37.035 87.469 1.00 0.00 O ATOM 83342 H1 WAT 8416 66.910 37.500 86.909 1.00 0.00 H ATOM 83343 H2 WAT 8416 65.434 37.395 87.229 1.00 0.00 H TER 83345 WAT 8416 ATOM 83345 O WAT 8417 35.946 136.012 89.769 1.00 0.00 O ATOM 83346 H1 WAT 8417 35.164 135.881 89.232 1.00 0.00 H ATOM 83347 H2 WAT 8417 35.844 136.893 90.130 1.00 0.00 H TER 83349 WAT 8417 ATOM 83349 O WAT 8418 141.094 61.730 120.148 1.00 0.00 O ATOM 83350 H1 WAT 8418 141.333 61.199 120.907 1.00 0.00 H ATOM 83351 H2 WAT 8418 140.722 61.105 119.526 1.00 0.00 H TER 83353 WAT 8418 ATOM 83353 O WAT 8419 87.374 11.571 142.742 1.00 0.00 O ATOM 83354 H1 WAT 8419 88.096 12.078 143.113 1.00 0.00 H ATOM 83355 H2 WAT 8419 87.794 10.973 142.124 1.00 0.00 H TER 83357 WAT 8419 ATOM 83357 O WAT 8420 92.343 108.256 93.365 1.00 0.00 O ATOM 83358 H1 WAT 8420 92.255 107.889 92.485 1.00 0.00 H ATOM 83359 H2 WAT 8420 93.283 108.407 93.468 1.00 0.00 H TER 83361 WAT 8420 ATOM 83361 O WAT 8421 115.194 79.005 3.613 1.00 0.00 O ATOM 83362 H1 WAT 8421 115.829 78.827 4.307 1.00 0.00 H ATOM 83363 H2 WAT 8421 114.853 78.144 3.374 1.00 0.00 H TER 83365 WAT 8421 ATOM 83365 O WAT 8422 110.883 138.856 123.478 1.00 0.00 O ATOM 83366 H1 WAT 8422 111.439 138.498 124.170 1.00 0.00 H ATOM 83367 H2 WAT 8422 111.268 138.526 122.667 1.00 0.00 H TER 83369 WAT 8422 ATOM 83369 O WAT 8423 26.739 123.725 127.472 1.00 0.00 O ATOM 83370 H1 WAT 8423 27.345 124.463 127.544 1.00 0.00 H ATOM 83371 H2 WAT 8423 26.775 123.302 128.330 1.00 0.00 H TER 83373 WAT 8423 ATOM 83373 O WAT 8424 96.632 106.445 158.342 1.00 0.00 O ATOM 83374 H1 WAT 8424 95.995 106.878 158.910 1.00 0.00 H ATOM 83375 H2 WAT 8424 96.120 106.151 157.589 1.00 0.00 H TER 83377 WAT 8424 ATOM 83377 O WAT 8425 115.084 83.444 63.715 1.00 0.00 O ATOM 83378 H1 WAT 8425 114.390 82.830 63.956 1.00 0.00 H ATOM 83379 H2 WAT 8425 114.959 84.188 64.304 1.00 0.00 H TER 83381 WAT 8425 ATOM 83381 O WAT 8426 22.985 2.916 140.046 1.00 0.00 O ATOM 83382 H1 WAT 8426 22.628 3.270 140.860 1.00 0.00 H ATOM 83383 H2 WAT 8426 22.515 3.383 139.355 1.00 0.00 H TER 83385 WAT 8426 ATOM 83385 O WAT 8427 16.963 100.806 98.294 1.00 0.00 O ATOM 83386 H1 WAT 8427 16.230 101.409 98.410 1.00 0.00 H ATOM 83387 H2 WAT 8427 17.726 101.373 98.188 1.00 0.00 H TER 83389 WAT 8427 ATOM 83389 O WAT 8428 23.616 110.967 10.588 1.00 0.00 O ATOM 83390 H1 WAT 8428 22.733 111.209 10.310 1.00 0.00 H ATOM 83391 H2 WAT 8428 24.194 111.435 9.984 1.00 0.00 H TER 83393 WAT 8428 ATOM 83393 O WAT 8429 104.262 31.253 142.607 1.00 0.00 O ATOM 83394 H1 WAT 8429 104.470 30.633 143.306 1.00 0.00 H ATOM 83395 H2 WAT 8429 103.312 31.363 142.659 1.00 0.00 H TER 83397 WAT 8429 ATOM 83397 O WAT 8430 53.563 59.227 72.603 1.00 0.00 O ATOM 83398 H1 WAT 8430 52.761 59.725 72.445 1.00 0.00 H ATOM 83399 H2 WAT 8430 54.037 59.738 73.260 1.00 0.00 H TER 83401 WAT 8430 ATOM 83401 O WAT 8431 44.689 56.771 92.731 1.00 0.00 O ATOM 83402 H1 WAT 8431 44.643 55.992 92.177 1.00 0.00 H ATOM 83403 H2 WAT 8431 43.874 56.756 93.233 1.00 0.00 H TER 83405 WAT 8431 ATOM 83405 O WAT 8432 74.784 91.519 101.751 1.00 0.00 O ATOM 83406 H1 WAT 8432 75.430 91.404 101.054 1.00 0.00 H ATOM 83407 H2 WAT 8432 74.119 90.853 101.574 1.00 0.00 H TER 83409 WAT 8432 ATOM 83409 O WAT 8433 78.698 6.418 60.317 1.00 0.00 O ATOM 83410 H1 WAT 8433 79.374 5.962 60.818 1.00 0.00 H ATOM 83411 H2 WAT 8433 78.069 5.735 60.086 1.00 0.00 H TER 83413 WAT 8433 ATOM 83413 O WAT 8434 61.601 109.246 109.894 1.00 0.00 O ATOM 83414 H1 WAT 8434 61.552 108.734 109.087 1.00 0.00 H ATOM 83415 H2 WAT 8434 61.483 110.152 109.610 1.00 0.00 H TER 83417 WAT 8434 ATOM 83417 O WAT 8435 1.072 85.492 147.395 1.00 0.00 O ATOM 83418 H1 WAT 8435 0.552 84.695 147.290 1.00 0.00 H ATOM 83419 H2 WAT 8435 0.435 86.204 147.332 1.00 0.00 H TER 83421 WAT 8435 ATOM 83421 O WAT 8436 68.871 134.405 74.369 1.00 0.00 O ATOM 83422 H1 WAT 8436 69.773 134.593 74.110 1.00 0.00 H ATOM 83423 H2 WAT 8436 68.852 133.457 74.502 1.00 0.00 H TER 83425 WAT 8436 ATOM 83425 O WAT 8437 93.686 29.570 120.584 1.00 0.00 O ATOM 83426 H1 WAT 8437 92.797 29.251 120.430 1.00 0.00 H ATOM 83427 H2 WAT 8437 94.166 29.333 119.790 1.00 0.00 H TER 83429 WAT 8437 ATOM 83429 O WAT 8438 98.244 6.066 59.092 1.00 0.00 O ATOM 83430 H1 WAT 8438 97.298 6.205 59.110 1.00 0.00 H ATOM 83431 H2 WAT 8438 98.501 6.283 58.196 1.00 0.00 H TER 83433 WAT 8438 ATOM 83433 O WAT 8439 9.536 40.147 139.579 1.00 0.00 O ATOM 83434 H1 WAT 8439 9.535 40.799 138.878 1.00 0.00 H ATOM 83435 H2 WAT 8439 10.409 39.756 139.540 1.00 0.00 H TER 83437 WAT 8439 ATOM 83437 O WAT 8440 42.115 96.106 4.189 1.00 0.00 O ATOM 83438 H1 WAT 8440 43.029 96.366 4.307 1.00 0.00 H ATOM 83439 H2 WAT 8440 41.630 96.646 4.813 1.00 0.00 H TER 83441 WAT 8440 ATOM 83441 O WAT 8441 95.042 110.289 17.326 1.00 0.00 O ATOM 83442 H1 WAT 8441 94.497 110.445 16.555 1.00 0.00 H ATOM 83443 H2 WAT 8441 94.956 111.087 17.847 1.00 0.00 H TER 83445 WAT 8441 ATOM 83445 O WAT 8442 133.272 74.391 81.324 1.00 0.00 O ATOM 83446 H1 WAT 8442 133.592 73.562 80.968 1.00 0.00 H ATOM 83447 H2 WAT 8442 132.320 74.294 81.339 1.00 0.00 H TER 83449 WAT 8442 ATOM 83449 O WAT 8443 110.634 44.492 108.869 1.00 0.00 O ATOM 83450 H1 WAT 8443 110.647 44.859 109.752 1.00 0.00 H ATOM 83451 H2 WAT 8443 110.209 45.164 108.336 1.00 0.00 H TER 83453 WAT 8443 ATOM 83453 O WAT 8444 34.157 67.848 136.542 1.00 0.00 O ATOM 83454 H1 WAT 8444 35.003 67.996 136.120 1.00 0.00 H ATOM 83455 H2 WAT 8444 33.739 68.710 136.548 1.00 0.00 H TER 83457 WAT 8444 ATOM 83457 O WAT 8445 83.098 134.154 136.225 1.00 0.00 O ATOM 83458 H1 WAT 8445 83.241 133.227 136.033 1.00 0.00 H ATOM 83459 H2 WAT 8445 82.332 134.164 136.800 1.00 0.00 H TER 83461 WAT 8445 ATOM 83461 O WAT 8446 144.816 7.561 153.694 1.00 0.00 O ATOM 83462 H1 WAT 8446 144.650 7.633 154.634 1.00 0.00 H ATOM 83463 H2 WAT 8446 144.384 6.746 153.436 1.00 0.00 H TER 83465 WAT 8446 ATOM 83465 O WAT 8447 103.700 128.288 81.811 1.00 0.00 O ATOM 83466 H1 WAT 8447 103.176 127.564 81.467 1.00 0.00 H ATOM 83467 H2 WAT 8447 104.557 127.900 81.988 1.00 0.00 H TER 83469 WAT 8447 ATOM 83469 O WAT 8448 83.769 28.265 102.945 1.00 0.00 O ATOM 83470 H1 WAT 8448 83.194 28.827 102.425 1.00 0.00 H ATOM 83471 H2 WAT 8448 84.474 28.022 102.344 1.00 0.00 H TER 83473 WAT 8448 ATOM 83473 O WAT 8449 38.928 64.837 2.751 1.00 0.00 O ATOM 83474 H1 WAT 8449 38.552 65.710 2.856 1.00 0.00 H ATOM 83475 H2 WAT 8449 39.414 64.883 1.928 1.00 0.00 H TER 83477 WAT 8449 ATOM 83477 O WAT 8450 23.316 110.730 143.144 1.00 0.00 O ATOM 83478 H1 WAT 8450 24.112 110.806 142.619 1.00 0.00 H ATOM 83479 H2 WAT 8450 22.759 111.447 142.839 1.00 0.00 H TER 83481 WAT 8450 ATOM 83481 O WAT 8451 40.088 113.345 157.333 1.00 0.00 O ATOM 83482 H1 WAT 8451 39.276 113.170 157.809 1.00 0.00 H ATOM 83483 H2 WAT 8451 40.279 112.526 156.877 1.00 0.00 H TER 83485 WAT 8451 ATOM 83485 O WAT 8452 110.664 77.992 4.984 1.00 0.00 O ATOM 83486 H1 WAT 8452 110.141 77.910 4.186 1.00 0.00 H ATOM 83487 H2 WAT 8452 111.538 77.698 4.728 1.00 0.00 H TER 83489 WAT 8452 ATOM 83489 O WAT 8453 32.106 84.394 155.604 1.00 0.00 O ATOM 83490 H1 WAT 8453 32.151 85.302 155.305 1.00 0.00 H ATOM 83491 H2 WAT 8453 32.767 84.335 156.294 1.00 0.00 H TER 83493 WAT 8453 ATOM 83493 O WAT 8454 134.726 23.685 106.596 1.00 0.00 O ATOM 83494 H1 WAT 8454 135.451 23.174 106.956 1.00 0.00 H ATOM 83495 H2 WAT 8454 135.067 24.036 105.774 1.00 0.00 H TER 83497 WAT 8454 ATOM 83497 O WAT 8455 26.203 108.563 21.821 1.00 0.00 O ATOM 83498 H1 WAT 8455 26.242 109.250 22.486 1.00 0.00 H ATOM 83499 H2 WAT 8455 26.236 109.034 20.988 1.00 0.00 H TER 83501 WAT 8455 ATOM 83501 O WAT 8456 90.514 18.107 150.468 1.00 0.00 O ATOM 83502 H1 WAT 8456 90.254 17.214 150.243 1.00 0.00 H ATOM 83503 H2 WAT 8456 91.367 18.221 150.047 1.00 0.00 H TER 83505 WAT 8456 ATOM 83505 O WAT 8457 53.259 106.231 76.390 1.00 0.00 O ATOM 83506 H1 WAT 8457 52.779 105.480 76.040 1.00 0.00 H ATOM 83507 H2 WAT 8457 54.173 105.948 76.399 1.00 0.00 H TER 83509 WAT 8457 ATOM 83509 O WAT 8458 94.408 9.732 81.255 1.00 0.00 O ATOM 83510 H1 WAT 8458 94.038 9.165 80.578 1.00 0.00 H ATOM 83511 H2 WAT 8458 94.346 10.614 80.887 1.00 0.00 H TER 83513 WAT 8458 ATOM 83513 O WAT 8459 30.490 107.688 110.640 1.00 0.00 O ATOM 83514 H1 WAT 8459 30.279 106.759 110.738 1.00 0.00 H ATOM 83515 H2 WAT 8459 29.642 108.115 110.523 1.00 0.00 H TER 83517 WAT 8459 ATOM 83517 O WAT 8460 10.249 28.997 104.847 1.00 0.00 O ATOM 83518 H1 WAT 8460 10.190 29.553 105.624 1.00 0.00 H ATOM 83519 H2 WAT 8460 11.181 28.991 104.628 1.00 0.00 H TER 83521 WAT 8460 ATOM 83521 O WAT 8461 129.148 42.412 66.309 1.00 0.00 O ATOM 83522 H1 WAT 8461 129.077 43.256 66.755 1.00 0.00 H ATOM 83523 H2 WAT 8461 129.101 41.764 67.013 1.00 0.00 H TER 83525 WAT 8461 ATOM 83525 O WAT 8462 36.835 52.274 74.146 1.00 0.00 O ATOM 83526 H1 WAT 8462 36.075 51.859 74.555 1.00 0.00 H ATOM 83527 H2 WAT 8462 36.461 52.923 73.550 1.00 0.00 H TER 83529 WAT 8462 ATOM 83529 O WAT 8463 132.430 98.635 68.475 1.00 0.00 O ATOM 83530 H1 WAT 8463 133.021 98.974 69.147 1.00 0.00 H ATOM 83531 H2 WAT 8463 131.830 98.060 68.951 1.00 0.00 H TER 83533 WAT 8463 ATOM 83533 O WAT 8464 129.877 141.573 114.455 1.00 0.00 O ATOM 83534 H1 WAT 8464 129.495 142.064 113.727 1.00 0.00 H ATOM 83535 H2 WAT 8464 129.527 141.995 115.239 1.00 0.00 H TER 83537 WAT 8464 ATOM 83537 O WAT 8465 59.803 81.230 130.091 1.00 0.00 O ATOM 83538 H1 WAT 8465 60.389 80.949 130.794 1.00 0.00 H ATOM 83539 H2 WAT 8465 59.206 80.492 129.966 1.00 0.00 H TER 83541 WAT 8465 ATOM 83541 O WAT 8466 47.494 81.091 97.353 1.00 0.00 O ATOM 83542 H1 WAT 8466 46.813 80.490 97.051 1.00 0.00 H ATOM 83543 H2 WAT 8466 48.285 80.555 97.394 1.00 0.00 H TER 83545 WAT 8466 ATOM 83545 O WAT 8467 116.487 4.670 152.863 1.00 0.00 O ATOM 83546 H1 WAT 8467 117.290 4.449 153.335 1.00 0.00 H ATOM 83547 H2 WAT 8467 115.782 4.398 153.450 1.00 0.00 H TER 83549 WAT 8467 ATOM 83549 O WAT 8468 53.635 124.963 87.583 1.00 0.00 O ATOM 83550 H1 WAT 8468 53.546 125.831 87.976 1.00 0.00 H ATOM 83551 H2 WAT 8468 53.423 125.095 86.659 1.00 0.00 H TER 83553 WAT 8468 ATOM 83553 O WAT 8469 27.321 32.195 117.253 1.00 0.00 O ATOM 83554 H1 WAT 8469 28.012 32.254 116.593 1.00 0.00 H ATOM 83555 H2 WAT 8469 26.615 32.743 116.910 1.00 0.00 H TER 83557 WAT 8469 ATOM 83557 O WAT 8470 111.224 142.379 81.518 1.00 0.00 O ATOM 83558 H1 WAT 8470 112.119 142.218 81.220 1.00 0.00 H ATOM 83559 H2 WAT 8470 111.304 143.103 82.139 1.00 0.00 H TER 83561 WAT 8470 ATOM 83561 O WAT 8471 61.371 130.443 62.258 1.00 0.00 O ATOM 83562 H1 WAT 8471 60.613 130.388 62.841 1.00 0.00 H ATOM 83563 H2 WAT 8471 61.054 130.099 61.423 1.00 0.00 H TER 83565 WAT 8471 ATOM 83565 O WAT 8472 99.093 9.216 123.425 1.00 0.00 O ATOM 83566 H1 WAT 8472 99.869 9.116 123.977 1.00 0.00 H ATOM 83567 H2 WAT 8472 99.376 9.792 122.715 1.00 0.00 H TER 83569 WAT 8472 ATOM 83569 O WAT 8473 8.224 94.204 124.325 1.00 0.00 O ATOM 83570 H1 WAT 8473 7.772 95.025 124.523 1.00 0.00 H ATOM 83571 H2 WAT 8473 8.930 94.457 123.731 1.00 0.00 H TER 83573 WAT 8473 ATOM 83573 O WAT 8474 71.861 50.778 100.677 1.00 0.00 O ATOM 83574 H1 WAT 8474 71.703 49.836 100.738 1.00 0.00 H ATOM 83575 H2 WAT 8474 71.297 51.070 99.961 1.00 0.00 H TER 83577 WAT 8474 ATOM 83577 O WAT 8475 144.876 128.997 88.453 1.00 0.00 O ATOM 83578 H1 WAT 8475 145.366 129.615 88.995 1.00 0.00 H ATOM 83579 H2 WAT 8475 145.490 128.280 88.293 1.00 0.00 H TER 83581 WAT 8475 ATOM 83581 O WAT 8476 66.052 12.412 141.121 1.00 0.00 O ATOM 83582 H1 WAT 8476 65.643 11.905 141.822 1.00 0.00 H ATOM 83583 H2 WAT 8476 66.336 13.222 141.546 1.00 0.00 H TER 83585 WAT 8476 ATOM 83585 O WAT 8477 36.831 64.335 148.439 1.00 0.00 O ATOM 83586 H1 WAT 8477 36.575 65.078 148.985 1.00 0.00 H ATOM 83587 H2 WAT 8477 36.854 63.592 149.042 1.00 0.00 H TER 83589 WAT 8477 ATOM 83589 O WAT 8478 90.953 79.301 74.706 1.00 0.00 O ATOM 83590 H1 WAT 8478 91.216 79.825 75.463 1.00 0.00 H ATOM 83591 H2 WAT 8478 91.471 78.499 74.779 1.00 0.00 H TER 83593 WAT 8478 ATOM 83593 O WAT 8479 97.838 34.818 158.434 1.00 0.00 O ATOM 83594 H1 WAT 8479 97.362 35.151 159.195 1.00 0.00 H ATOM 83595 H2 WAT 8479 97.215 34.238 157.996 1.00 0.00 H TER 83597 WAT 8479 ATOM 83597 O WAT 8480 124.733 109.438 77.238 1.00 0.00 O ATOM 83598 H1 WAT 8480 124.940 108.583 76.861 1.00 0.00 H ATOM 83599 H2 WAT 8480 125.552 109.727 77.641 1.00 0.00 H TER 83601 WAT 8480 ATOM 83601 O WAT 8481 34.872 129.452 128.193 1.00 0.00 O ATOM 83602 H1 WAT 8481 34.528 129.859 127.397 1.00 0.00 H ATOM 83603 H2 WAT 8481 34.645 130.065 128.892 1.00 0.00 H TER 83605 WAT 8481 ATOM 83605 O WAT 8482 75.331 143.291 83.134 1.00 0.00 O ATOM 83606 H1 WAT 8482 75.250 144.120 82.661 1.00 0.00 H ATOM 83607 H2 WAT 8482 74.543 143.248 83.676 1.00 0.00 H TER 83609 WAT 8482 ATOM 83609 O WAT 8483 75.157 28.776 138.110 1.00 0.00 O ATOM 83610 H1 WAT 8483 75.270 27.915 137.708 1.00 0.00 H ATOM 83611 H2 WAT 8483 75.406 29.395 137.424 1.00 0.00 H TER 83613 WAT 8483 ATOM 83613 O WAT 8484 136.712 59.747 111.641 1.00 0.00 O ATOM 83614 H1 WAT 8484 137.193 59.385 110.897 1.00 0.00 H ATOM 83615 H2 WAT 8484 135.832 59.909 111.301 1.00 0.00 H TER 83617 WAT 8484 ATOM 83617 O WAT 8485 26.880 28.497 66.119 1.00 0.00 O ATOM 83618 H1 WAT 8485 27.393 28.216 65.361 1.00 0.00 H ATOM 83619 H2 WAT 8485 27.423 29.162 66.542 1.00 0.00 H TER 83621 WAT 8485 ATOM 83621 O WAT 8486 60.052 119.203 2.465 1.00 0.00 O ATOM 83622 H1 WAT 8486 60.731 119.701 2.921 1.00 0.00 H ATOM 83623 H2 WAT 8486 60.190 118.299 2.746 1.00 0.00 H TER 83625 WAT 8486 ATOM 83625 O WAT 8487 134.135 141.046 148.495 1.00 0.00 O ATOM 83626 H1 WAT 8487 135.053 140.842 148.318 1.00 0.00 H ATOM 83627 H2 WAT 8487 133.874 141.620 147.775 1.00 0.00 H TER 83629 WAT 8487 ATOM 83629 O WAT 8488 16.512 122.267 87.249 1.00 0.00 O ATOM 83630 H1 WAT 8488 16.842 122.757 86.495 1.00 0.00 H ATOM 83631 H2 WAT 8488 16.594 121.349 86.991 1.00 0.00 H TER 83633 WAT 8488 ATOM 83633 O WAT 8489 132.351 67.848 104.284 1.00 0.00 O ATOM 83634 H1 WAT 8489 131.994 68.237 105.082 1.00 0.00 H ATOM 83635 H2 WAT 8489 132.224 68.519 103.613 1.00 0.00 H TER 83637 WAT 8489 ATOM 83637 O WAT 8490 121.082 76.012 103.546 1.00 0.00 O ATOM 83638 H1 WAT 8490 122.036 75.958 103.483 1.00 0.00 H ATOM 83639 H2 WAT 8490 120.778 75.929 102.642 1.00 0.00 H TER 83641 WAT 8490 ATOM 83641 O WAT 8491 18.172 9.322 66.186 1.00 0.00 O ATOM 83642 H1 WAT 8491 18.225 9.943 65.460 1.00 0.00 H ATOM 83643 H2 WAT 8491 18.574 9.780 66.924 1.00 0.00 H TER 83645 WAT 8491 ATOM 83645 O WAT 8492 77.970 82.122 123.895 1.00 0.00 O ATOM 83646 H1 WAT 8492 77.654 82.026 122.997 1.00 0.00 H ATOM 83647 H2 WAT 8492 77.981 81.230 124.242 1.00 0.00 H TER 83649 WAT 8492 ATOM 83649 O WAT 8493 46.274 66.037 100.178 1.00 0.00 O ATOM 83650 H1 WAT 8493 46.020 66.904 99.861 1.00 0.00 H ATOM 83651 H2 WAT 8493 45.474 65.516 100.118 1.00 0.00 H TER 83653 WAT 8493 ATOM 83653 O WAT 8494 135.076 129.219 58.891 1.00 0.00 O ATOM 83654 H1 WAT 8494 135.825 129.778 59.099 1.00 0.00 H ATOM 83655 H2 WAT 8494 134.346 129.608 59.372 1.00 0.00 H TER 83657 WAT 8494 ATOM 83657 O WAT 8495 129.302 93.922 96.861 1.00 0.00 O ATOM 83658 H1 WAT 8495 128.974 94.004 95.965 1.00 0.00 H ATOM 83659 H2 WAT 8495 128.665 94.400 97.393 1.00 0.00 H TER 83661 WAT 8495 ATOM 83661 O WAT 8496 49.081 131.050 98.969 1.00 0.00 O ATOM 83662 H1 WAT 8496 48.646 130.566 98.267 1.00 0.00 H ATOM 83663 H2 WAT 8496 48.365 131.407 99.494 1.00 0.00 H TER 83665 WAT 8496 ATOM 83665 O WAT 8497 83.257 112.719 96.411 1.00 0.00 O ATOM 83666 H1 WAT 8497 83.379 113.425 97.045 1.00 0.00 H ATOM 83667 H2 WAT 8497 83.871 112.039 96.688 1.00 0.00 H TER 83669 WAT 8497 ATOM 83669 O WAT 8498 65.110 84.957 11.144 1.00 0.00 O ATOM 83670 H1 WAT 8498 65.872 84.378 11.157 1.00 0.00 H ATOM 83671 H2 WAT 8498 65.396 85.717 10.638 1.00 0.00 H TER 83673 WAT 8498 ATOM 83673 O WAT 8499 131.512 26.163 136.653 1.00 0.00 O ATOM 83674 H1 WAT 8499 130.607 26.026 136.373 1.00 0.00 H ATOM 83675 H2 WAT 8499 131.983 26.373 135.847 1.00 0.00 H TER 83677 WAT 8499 ATOM 83677 O WAT 8500 38.772 118.593 122.209 1.00 0.00 O ATOM 83678 H1 WAT 8500 38.582 117.928 121.547 1.00 0.00 H ATOM 83679 H2 WAT 8500 38.337 118.275 123.000 1.00 0.00 H TER 83681 WAT 8500 ATOM 83681 O WAT 8501 29.048 110.371 12.836 1.00 0.00 O ATOM 83682 H1 WAT 8501 28.567 109.749 13.382 1.00 0.00 H ATOM 83683 H2 WAT 8501 28.545 110.416 12.024 1.00 0.00 H TER 83685 WAT 8501 ATOM 83685 O WAT 8502 31.804 145.635 114.015 1.00 0.00 O ATOM 83686 H1 WAT 8502 32.504 146.238 114.264 1.00 0.00 H ATOM 83687 H2 WAT 8502 32.194 144.766 114.102 1.00 0.00 H TER 83689 WAT 8502 ATOM 83689 O WAT 8503 109.373 100.571 121.420 1.00 0.00 O ATOM 83690 H1 WAT 8503 108.844 100.844 122.170 1.00 0.00 H ATOM 83691 H2 WAT 8503 109.168 99.643 121.307 1.00 0.00 H TER 83693 WAT 8503 ATOM 83693 O WAT 8504 10.049 38.943 57.372 1.00 0.00 O ATOM 83694 H1 WAT 8504 9.608 39.775 57.200 1.00 0.00 H ATOM 83695 H2 WAT 8504 10.878 39.192 57.781 1.00 0.00 H TER 83697 WAT 8504 ATOM 83697 O WAT 8505 13.086 79.751 59.715 1.00 0.00 O ATOM 83698 H1 WAT 8505 13.173 79.807 58.764 1.00 0.00 H ATOM 83699 H2 WAT 8505 13.962 79.946 60.048 1.00 0.00 H TER 83701 WAT 8505 ATOM 83701 O WAT 8506 102.003 29.169 135.765 1.00 0.00 O ATOM 83702 H1 WAT 8506 101.906 29.865 135.115 1.00 0.00 H ATOM 83703 H2 WAT 8506 101.919 29.614 136.608 1.00 0.00 H TER 83705 WAT 8506 ATOM 83705 O WAT 8507 13.044 113.488 103.106 1.00 0.00 O ATOM 83706 H1 WAT 8507 13.446 113.808 102.299 1.00 0.00 H ATOM 83707 H2 WAT 8507 13.085 114.232 103.707 1.00 0.00 H TER 83709 WAT 8507 ATOM 83709 O WAT 8508 85.611 95.812 74.331 1.00 0.00 O ATOM 83710 H1 WAT 8508 85.239 96.019 75.188 1.00 0.00 H ATOM 83711 H2 WAT 8508 86.386 95.286 74.527 1.00 0.00 H TER 83713 WAT 8508 ATOM 83713 O WAT 8509 59.480 133.191 146.042 1.00 0.00 O ATOM 83714 H1 WAT 8509 59.268 132.986 146.953 1.00 0.00 H ATOM 83715 H2 WAT 8509 60.418 133.380 146.051 1.00 0.00 H TER 83717 WAT 8509 ATOM 83717 O WAT 8510 90.363 135.305 147.998 1.00 0.00 O ATOM 83718 H1 WAT 8510 91.152 135.846 147.978 1.00 0.00 H ATOM 83719 H2 WAT 8510 90.443 134.793 148.804 1.00 0.00 H TER 83721 WAT 8510 ATOM 83721 O WAT 8511 15.699 65.103 116.676 1.00 0.00 O ATOM 83722 H1 WAT 8511 15.075 64.935 117.381 1.00 0.00 H ATOM 83723 H2 WAT 8511 15.900 66.036 116.750 1.00 0.00 H TER 83725 WAT 8511 ATOM 83725 O WAT 8512 104.817 31.689 67.553 1.00 0.00 O ATOM 83726 H1 WAT 8512 104.338 31.516 66.743 1.00 0.00 H ATOM 83727 H2 WAT 8512 104.201 31.462 68.249 1.00 0.00 H TER 83729 WAT 8512 ATOM 83729 O WAT 8513 131.211 102.055 151.122 1.00 0.00 O ATOM 83730 H1 WAT 8513 131.013 102.022 152.058 1.00 0.00 H ATOM 83731 H2 WAT 8513 130.492 101.577 150.708 1.00 0.00 H TER 83733 WAT 8513 ATOM 83733 O WAT 8514 139.913 74.515 28.442 1.00 0.00 O ATOM 83734 H1 WAT 8514 139.820 74.237 29.353 1.00 0.00 H ATOM 83735 H2 WAT 8514 140.762 74.956 28.412 1.00 0.00 H TER 83737 WAT 8514 ATOM 83737 O WAT 8515 99.759 64.799 65.661 1.00 0.00 O ATOM 83738 H1 WAT 8515 100.576 65.101 66.057 1.00 0.00 H ATOM 83739 H2 WAT 8515 99.993 63.979 65.225 1.00 0.00 H TER 83741 WAT 8515 ATOM 83741 O WAT 8516 131.270 88.728 3.452 1.00 0.00 O ATOM 83742 H1 WAT 8516 131.930 88.438 4.081 1.00 0.00 H ATOM 83743 H2 WAT 8516 131.348 89.682 3.445 1.00 0.00 H TER 83745 WAT 8516 ATOM 83745 O WAT 8517 139.979 3.518 14.749 1.00 0.00 O ATOM 83746 H1 WAT 8517 139.219 4.039 14.491 1.00 0.00 H ATOM 83747 H2 WAT 8517 140.221 3.857 15.611 1.00 0.00 H TER 83749 WAT 8517 ATOM 83749 O WAT 8518 122.734 51.410 152.240 1.00 0.00 O ATOM 83750 H1 WAT 8518 122.396 51.254 153.122 1.00 0.00 H ATOM 83751 H2 WAT 8518 121.957 51.411 151.682 1.00 0.00 H TER 83753 WAT 8518 ATOM 83753 O WAT 8519 45.408 92.831 6.118 1.00 0.00 O ATOM 83754 H1 WAT 8519 45.601 93.549 6.720 1.00 0.00 H ATOM 83755 H2 WAT 8519 45.776 92.056 6.543 1.00 0.00 H TER 83757 WAT 8519 ATOM 83757 O WAT 8520 122.588 85.838 85.695 1.00 0.00 O ATOM 83758 H1 WAT 8520 123.116 85.473 84.985 1.00 0.00 H ATOM 83759 H2 WAT 8520 121.891 86.322 85.252 1.00 0.00 H TER 83761 WAT 8520 ATOM 83761 O WAT 8521 13.402 55.559 112.658 1.00 0.00 O ATOM 83762 H1 WAT 8521 13.101 56.347 112.204 1.00 0.00 H ATOM 83763 H2 WAT 8521 14.266 55.384 112.286 1.00 0.00 H TER 83765 WAT 8521 ATOM 83765 O WAT 8522 6.974 24.045 7.805 1.00 0.00 O ATOM 83766 H1 WAT 8522 6.612 23.804 8.657 1.00 0.00 H ATOM 83767 H2 WAT 8522 6.271 24.529 7.373 1.00 0.00 H TER 83769 WAT 8522 ATOM 83769 O WAT 8523 86.827 12.574 17.051 1.00 0.00 O ATOM 83770 H1 WAT 8523 87.058 13.501 16.994 1.00 0.00 H ATOM 83771 H2 WAT 8523 87.663 12.127 17.184 1.00 0.00 H TER 83773 WAT 8523 ATOM 83773 O WAT 8524 44.313 82.634 18.551 1.00 0.00 O ATOM 83774 H1 WAT 8524 43.647 83.306 18.696 1.00 0.00 H ATOM 83775 H2 WAT 8524 44.055 82.215 17.729 1.00 0.00 H TER 83777 WAT 8524 ATOM 83777 O WAT 8525 19.985 97.518 62.037 1.00 0.00 O ATOM 83778 H1 WAT 8525 19.223 97.900 61.602 1.00 0.00 H ATOM 83779 H2 WAT 8525 20.617 98.235 62.087 1.00 0.00 H TER 83781 WAT 8525 ATOM 83781 O WAT 8526 1.169 62.148 81.190 1.00 0.00 O ATOM 83782 H1 WAT 8526 1.991 62.091 80.702 1.00 0.00 H ATOM 83783 H2 WAT 8526 0.985 63.086 81.242 1.00 0.00 H TER 83785 WAT 8526 ATOM 83785 O WAT 8527 26.405 69.617 126.676 1.00 0.00 O ATOM 83786 H1 WAT 8527 26.723 70.516 126.594 1.00 0.00 H ATOM 83787 H2 WAT 8527 25.457 69.706 126.774 1.00 0.00 H TER 83789 WAT 8527 ATOM 83789 O WAT 8528 17.975 131.451 144.640 1.00 0.00 O ATOM 83790 H1 WAT 8528 18.565 131.508 145.392 1.00 0.00 H ATOM 83791 H2 WAT 8528 18.063 132.298 144.203 1.00 0.00 H TER 83793 WAT 8528 ATOM 83793 O WAT 8529 98.025 110.732 73.070 1.00 0.00 O ATOM 83794 H1 WAT 8529 97.191 110.911 72.637 1.00 0.00 H ATOM 83795 H2 WAT 8529 97.799 110.144 73.791 1.00 0.00 H TER 83797 WAT 8529 ATOM 83797 O WAT 8530 40.690 83.951 138.528 1.00 0.00 O ATOM 83798 H1 WAT 8530 40.706 83.060 138.877 1.00 0.00 H ATOM 83799 H2 WAT 8530 41.604 84.141 138.316 1.00 0.00 H TER 83801 WAT 8530 ATOM 83801 O WAT 8531 18.386 89.308 76.306 1.00 0.00 O ATOM 83802 H1 WAT 8531 18.577 89.234 75.371 1.00 0.00 H ATOM 83803 H2 WAT 8531 18.121 88.425 76.566 1.00 0.00 H TER 83805 WAT 8531 ATOM 83805 O WAT 8532 144.967 95.730 78.041 1.00 0.00 O ATOM 83806 H1 WAT 8532 145.884 95.980 77.925 1.00 0.00 H ATOM 83807 H2 WAT 8532 144.947 94.793 77.846 1.00 0.00 H TER 83809 WAT 8532 ATOM 83809 O WAT 8533 141.098 82.658 90.928 1.00 0.00 O ATOM 83810 H1 WAT 8533 140.193 82.730 90.623 1.00 0.00 H ATOM 83811 H2 WAT 8533 141.020 82.446 91.858 1.00 0.00 H TER 83813 WAT 8533 ATOM 83813 O WAT 8534 18.992 25.401 5.169 1.00 0.00 O ATOM 83814 H1 WAT 8534 18.116 25.637 4.863 1.00 0.00 H ATOM 83815 H2 WAT 8534 18.994 25.638 6.096 1.00 0.00 H TER 83817 WAT 8534 ATOM 83817 O WAT 8535 98.549 108.183 22.829 1.00 0.00 O ATOM 83818 H1 WAT 8535 98.893 108.987 23.218 1.00 0.00 H ATOM 83819 H2 WAT 8535 97.654 108.119 23.164 1.00 0.00 H TER 83821 WAT 8535 ATOM 83821 O WAT 8536 123.996 135.747 113.470 1.00 0.00 O ATOM 83822 H1 WAT 8536 124.773 135.383 113.895 1.00 0.00 H ATOM 83823 H2 WAT 8536 123.974 136.661 113.752 1.00 0.00 H TER 83825 WAT 8536 ATOM 83825 O WAT 8537 18.494 129.284 5.584 1.00 0.00 O ATOM 83826 H1 WAT 8537 19.033 129.737 4.935 1.00 0.00 H ATOM 83827 H2 WAT 8537 18.162 128.513 5.123 1.00 0.00 H TER 83829 WAT 8537 ATOM 83829 O WAT 8538 128.782 129.011 125.577 1.00 0.00 O ATOM 83830 H1 WAT 8538 128.174 128.869 126.303 1.00 0.00 H ATOM 83831 H2 WAT 8538 129.143 129.884 125.734 1.00 0.00 H TER 83833 WAT 8538 ATOM 83833 O WAT 8539 56.761 99.661 67.863 1.00 0.00 O ATOM 83834 H1 WAT 8539 56.953 100.566 68.109 1.00 0.00 H ATOM 83835 H2 WAT 8539 56.080 99.733 67.194 1.00 0.00 H TER 83837 WAT 8539 ATOM 83837 O WAT 8540 68.165 57.521 106.493 1.00 0.00 O ATOM 83838 H1 WAT 8540 67.887 57.954 107.300 1.00 0.00 H ATOM 83839 H2 WAT 8540 68.897 58.050 106.177 1.00 0.00 H TER 83841 WAT 8540 ATOM 83841 O WAT 8541 89.461 94.769 20.027 1.00 0.00 O ATOM 83842 H1 WAT 8541 89.500 95.719 19.919 1.00 0.00 H ATOM 83843 H2 WAT 8541 89.920 94.602 20.851 1.00 0.00 H TER 83845 WAT 8541 ATOM 83845 O WAT 8542 121.973 131.574 134.246 1.00 0.00 O ATOM 83846 H1 WAT 8542 122.871 131.610 133.917 1.00 0.00 H ATOM 83847 H2 WAT 8542 121.687 132.487 134.263 1.00 0.00 H TER 83849 WAT 8542 ATOM 83849 O WAT 8543 24.924 82.685 62.565 1.00 0.00 O ATOM 83850 H1 WAT 8543 25.442 83.331 62.085 1.00 0.00 H ATOM 83851 H2 WAT 8543 24.073 83.105 62.690 1.00 0.00 H TER 83853 WAT 8543 ATOM 83853 O WAT 8544 58.909 21.320 136.299 1.00 0.00 O ATOM 83854 H1 WAT 8544 59.756 21.629 135.978 1.00 0.00 H ATOM 83855 H2 WAT 8544 58.270 21.711 135.705 1.00 0.00 H TER 83857 WAT 8544 ATOM 83857 O WAT 8545 101.586 68.613 3.123 1.00 0.00 O ATOM 83858 H1 WAT 8545 102.170 67.869 3.269 1.00 0.00 H ATOM 83859 H2 WAT 8545 101.343 68.903 4.003 1.00 0.00 H TER 83861 WAT 8545 ATOM 83861 O WAT 8546 19.577 2.738 129.247 1.00 0.00 O ATOM 83862 H1 WAT 8546 19.787 3.188 128.429 1.00 0.00 H ATOM 83863 H2 WAT 8546 19.027 2.001 128.980 1.00 0.00 H TER 83865 WAT 8546 ATOM 83865 O WAT 8547 45.467 1.293 117.939 1.00 0.00 O ATOM 83866 H1 WAT 8547 44.945 1.705 117.251 1.00 0.00 H ATOM 83867 H2 WAT 8547 46.084 1.972 118.211 1.00 0.00 H TER 83869 WAT 8547 ATOM 83869 O WAT 8548 45.153 119.537 143.786 1.00 0.00 O ATOM 83870 H1 WAT 8548 45.097 118.624 143.504 1.00 0.00 H ATOM 83871 H2 WAT 8548 44.926 120.043 143.006 1.00 0.00 H TER 83873 WAT 8548 ATOM 83873 O WAT 8549 49.953 86.451 64.142 1.00 0.00 O ATOM 83874 H1 WAT 8549 49.886 86.583 63.196 1.00 0.00 H ATOM 83875 H2 WAT 8549 50.779 86.871 64.384 1.00 0.00 H TER 83877 WAT 8549 ATOM 83877 O WAT 8550 121.790 116.636 106.879 1.00 0.00 O ATOM 83878 H1 WAT 8550 121.072 116.063 107.151 1.00 0.00 H ATOM 83879 H2 WAT 8550 121.632 117.456 107.346 1.00 0.00 H TER 83881 WAT 8550 ATOM 83881 O WAT 8551 33.058 99.449 19.198 1.00 0.00 O ATOM 83882 H1 WAT 8551 32.431 100.074 19.562 1.00 0.00 H ATOM 83883 H2 WAT 8551 33.841 99.553 19.738 1.00 0.00 H TER 83885 WAT 8551 ATOM 83885 O WAT 8552 31.087 93.045 8.046 1.00 0.00 O ATOM 83886 H1 WAT 8552 31.066 92.298 8.644 1.00 0.00 H ATOM 83887 H2 WAT 8552 30.319 93.564 8.284 1.00 0.00 H TER 83889 WAT 8552 ATOM 83889 O WAT 8553 20.168 145.108 152.370 1.00 0.00 O ATOM 83890 H1 WAT 8553 20.527 144.854 153.221 1.00 0.00 H ATOM 83891 H2 WAT 8553 19.307 145.473 152.572 1.00 0.00 H TER 83893 WAT 8553 ATOM 83893 O WAT 8554 143.540 61.188 114.388 1.00 0.00 O ATOM 83894 H1 WAT 8554 143.424 61.668 113.568 1.00 0.00 H ATOM 83895 H2 WAT 8554 144.287 61.611 114.810 1.00 0.00 H TER 83897 WAT 8554 ATOM 83897 O WAT 8555 128.385 11.549 139.683 1.00 0.00 O ATOM 83898 H1 WAT 8555 128.521 11.147 140.541 1.00 0.00 H ATOM 83899 H2 WAT 8555 127.446 11.732 139.650 1.00 0.00 H TER 83901 WAT 8555 ATOM 83901 O WAT 8556 4.287 38.762 123.006 1.00 0.00 O ATOM 83902 H1 WAT 8556 3.776 39.263 122.370 1.00 0.00 H ATOM 83903 H2 WAT 8556 4.655 39.423 123.592 1.00 0.00 H TER 83905 WAT 8556 ATOM 83905 O WAT 8557 126.306 48.418 89.227 1.00 0.00 O ATOM 83906 H1 WAT 8557 125.829 47.954 88.539 1.00 0.00 H ATOM 83907 H2 WAT 8557 126.459 49.291 88.864 1.00 0.00 H TER 83909 WAT 8557 ATOM 83909 O WAT 8558 34.583 25.957 71.111 1.00 0.00 O ATOM 83910 H1 WAT 8558 34.158 26.724 70.729 1.00 0.00 H ATOM 83911 H2 WAT 8558 34.159 25.211 70.686 1.00 0.00 H TER 83913 WAT 8558 ATOM 83913 O WAT 8559 89.662 101.909 154.300 1.00 0.00 O ATOM 83914 H1 WAT 8559 88.996 102.132 154.951 1.00 0.00 H ATOM 83915 H2 WAT 8559 89.253 101.232 153.762 1.00 0.00 H TER 83917 WAT 8559 ATOM 83917 O WAT 8560 131.553 1.381 101.092 1.00 0.00 O ATOM 83918 H1 WAT 8560 131.241 0.493 100.917 1.00 0.00 H ATOM 83919 H2 WAT 8560 130.913 1.949 100.663 1.00 0.00 H TER 83921 WAT 8560 ATOM 83921 O WAT 8561 25.414 144.564 52.655 1.00 0.00 O ATOM 83922 H1 WAT 8561 24.758 145.116 53.082 1.00 0.00 H ATOM 83923 H2 WAT 8561 25.267 144.698 51.718 1.00 0.00 H TER 83925 WAT 8561 ATOM 83925 O WAT 8562 7.324 133.265 86.307 1.00 0.00 O ATOM 83926 H1 WAT 8562 6.775 134.001 86.577 1.00 0.00 H ATOM 83927 H2 WAT 8562 8.221 133.581 86.423 1.00 0.00 H TER 83929 WAT 8562 ATOM 83929 O WAT 8563 75.673 90.206 67.301 1.00 0.00 O ATOM 83930 H1 WAT 8563 75.239 91.057 67.235 1.00 0.00 H ATOM 83931 H2 WAT 8563 75.798 89.929 66.394 1.00 0.00 H TER 83933 WAT 8563 ATOM 83933 O WAT 8564 102.300 103.185 106.269 1.00 0.00 O ATOM 83934 H1 WAT 8564 102.591 103.786 106.955 1.00 0.00 H ATOM 83935 H2 WAT 8564 101.392 102.985 106.495 1.00 0.00 H TER 83937 WAT 8564 ATOM 83937 O WAT 8565 124.808 115.317 72.896 1.00 0.00 O ATOM 83938 H1 WAT 8565 125.269 115.445 72.066 1.00 0.00 H ATOM 83939 H2 WAT 8565 123.954 114.967 72.644 1.00 0.00 H TER 83941 WAT 8565 ATOM 83941 O WAT 8566 116.169 46.137 121.375 1.00 0.00 O ATOM 83942 H1 WAT 8566 115.642 46.048 122.169 1.00 0.00 H ATOM 83943 H2 WAT 8566 117.074 46.059 121.679 1.00 0.00 H TER 83945 WAT 8566 ATOM 83945 O WAT 8567 9.828 23.196 113.022 1.00 0.00 O ATOM 83946 H1 WAT 8567 9.485 23.370 112.145 1.00 0.00 H ATOM 83947 H2 WAT 8567 9.158 22.655 113.439 1.00 0.00 H TER 83949 WAT 8567 ATOM 83949 O WAT 8568 59.421 99.572 115.756 1.00 0.00 O ATOM 83950 H1 WAT 8568 60.183 100.151 115.763 1.00 0.00 H ATOM 83951 H2 WAT 8568 59.331 99.282 116.663 1.00 0.00 H TER 83953 WAT 8568 ATOM 83953 O WAT 8569 103.662 40.590 131.343 1.00 0.00 O ATOM 83954 H1 WAT 8569 104.030 40.326 132.186 1.00 0.00 H ATOM 83955 H2 WAT 8569 102.716 40.591 131.484 1.00 0.00 H TER 83957 WAT 8569 ATOM 83957 O WAT 8570 129.723 20.651 101.335 1.00 0.00 O ATOM 83958 H1 WAT 8570 129.049 20.057 101.668 1.00 0.00 H ATOM 83959 H2 WAT 8570 130.245 20.876 102.105 1.00 0.00 H TER 83961 WAT 8570 ATOM 83961 O WAT 8571 64.753 134.215 77.782 1.00 0.00 O ATOM 83962 H1 WAT 8571 64.786 133.941 76.865 1.00 0.00 H ATOM 83963 H2 WAT 8571 64.558 135.151 77.745 1.00 0.00 H TER 83965 WAT 8571 ATOM 83965 O WAT 8572 89.360 92.078 133.825 1.00 0.00 O ATOM 83966 H1 WAT 8572 88.697 91.575 134.298 1.00 0.00 H ATOM 83967 H2 WAT 8572 89.132 92.992 133.993 1.00 0.00 H TER 83969 WAT 8572 ATOM 83969 O WAT 8573 37.638 133.336 71.467 1.00 0.00 O ATOM 83970 H1 WAT 8573 37.672 132.393 71.304 1.00 0.00 H ATOM 83971 H2 WAT 8573 37.719 133.418 72.417 1.00 0.00 H TER 83973 WAT 8573 ATOM 83973 O WAT 8574 32.828 29.806 89.261 1.00 0.00 O ATOM 83974 H1 WAT 8574 33.641 29.320 89.122 1.00 0.00 H ATOM 83975 H2 WAT 8574 33.112 30.664 89.575 1.00 0.00 H TER 83977 WAT 8574 ATOM 83977 O WAT 8575 57.768 9.513 51.788 1.00 0.00 O ATOM 83978 H1 WAT 8575 57.325 9.584 50.943 1.00 0.00 H ATOM 83979 H2 WAT 8575 57.811 8.572 51.959 1.00 0.00 H TER 83981 WAT 8575 ATOM 83981 O WAT 8576 3.475 103.521 125.354 1.00 0.00 O ATOM 83982 H1 WAT 8576 4.372 103.284 125.590 1.00 0.00 H ATOM 83983 H2 WAT 8576 3.527 104.445 125.111 1.00 0.00 H TER 83985 WAT 8576 ATOM 83985 O WAT 8577 144.104 129.690 135.400 1.00 0.00 O ATOM 83986 H1 WAT 8577 144.261 129.486 134.478 1.00 0.00 H ATOM 83987 H2 WAT 8577 144.910 129.426 135.844 1.00 0.00 H TER 83989 WAT 8577 ATOM 83989 O WAT 8578 54.699 29.805 85.723 1.00 0.00 O ATOM 83990 H1 WAT 8578 54.416 29.815 86.637 1.00 0.00 H ATOM 83991 H2 WAT 8578 55.243 29.021 85.649 1.00 0.00 H TER 83993 WAT 8578 ATOM 83993 O WAT 8579 99.799 50.603 71.985 1.00 0.00 O ATOM 83994 H1 WAT 8579 99.692 49.704 71.675 1.00 0.00 H ATOM 83995 H2 WAT 8579 100.745 50.751 71.970 1.00 0.00 H TER 83997 WAT 8579 ATOM 83997 O WAT 8580 78.400 44.881 22.716 1.00 0.00 O ATOM 83998 H1 WAT 8580 79.085 45.134 23.336 1.00 0.00 H ATOM 83999 H2 WAT 8580 78.023 45.710 22.424 1.00 0.00 H TER 84001 WAT 8580 ATOM 84001 O WAT 8581 79.189 57.042 103.808 1.00 0.00 O ATOM 84002 H1 WAT 8581 78.431 56.826 103.265 1.00 0.00 H ATOM 84003 H2 WAT 8581 79.676 57.686 103.294 1.00 0.00 H TER 84005 WAT 8581 ATOM 84005 O WAT 8582 132.641 80.883 146.161 1.00 0.00 O ATOM 84006 H1 WAT 8582 132.442 80.307 146.900 1.00 0.00 H ATOM 84007 H2 WAT 8582 131.897 81.483 146.118 1.00 0.00 H TER 84009 WAT 8582 ATOM 84009 O WAT 8583 19.806 54.477 0.727 1.00 0.00 O ATOM 84010 H1 WAT 8583 19.670 55.357 0.377 1.00 0.00 H ATOM 84011 H2 WAT 8583 19.642 54.564 1.666 1.00 0.00 H TER 84013 WAT 8583 ATOM 84013 O WAT 8584 21.048 145.614 78.125 1.00 0.00 O ATOM 84014 H1 WAT 8584 21.778 145.760 77.523 1.00 0.00 H ATOM 84015 H2 WAT 8584 21.280 144.811 78.591 1.00 0.00 H TER 84017 WAT 8584 ATOM 84017 O WAT 8585 123.581 111.534 75.748 1.00 0.00 O ATOM 84018 H1 WAT 8585 123.982 110.780 76.180 1.00 0.00 H ATOM 84019 H2 WAT 8585 122.769 111.192 75.374 1.00 0.00 H TER 84021 WAT 8585 ATOM 84021 O WAT 8586 8.389 62.134 95.974 1.00 0.00 O ATOM 84022 H1 WAT 8586 8.042 62.848 95.438 1.00 0.00 H ATOM 84023 H2 WAT 8586 9.336 62.169 95.834 1.00 0.00 H TER 84025 WAT 8586 ATOM 84025 O WAT 8587 133.123 104.050 110.408 1.00 0.00 O ATOM 84026 H1 WAT 8587 132.784 103.646 109.610 1.00 0.00 H ATOM 84027 H2 WAT 8587 134.061 104.154 110.245 1.00 0.00 H TER 84029 WAT 8587 ATOM 84029 O WAT 8588 88.740 137.103 121.282 1.00 0.00 O ATOM 84030 H1 WAT 8588 88.663 137.775 120.605 1.00 0.00 H ATOM 84031 H2 WAT 8588 89.187 136.376 120.849 1.00 0.00 H TER 84033 WAT 8588 ATOM 84033 O WAT 8589 45.435 32.721 149.014 1.00 0.00 O ATOM 84034 H1 WAT 8589 45.342 32.476 148.093 1.00 0.00 H ATOM 84035 H2 WAT 8589 44.581 32.527 149.401 1.00 0.00 H TER 84037 WAT 8589 ATOM 84037 O WAT 8590 60.801 88.939 132.102 1.00 0.00 O ATOM 84038 H1 WAT 8590 60.812 89.822 132.472 1.00 0.00 H ATOM 84039 H2 WAT 8590 61.717 88.757 131.891 1.00 0.00 H TER 84041 WAT 8590 ATOM 84041 O WAT 8591 109.270 53.617 85.145 1.00 0.00 O ATOM 84042 H1 WAT 8591 109.191 52.971 85.847 1.00 0.00 H ATOM 84043 H2 WAT 8591 109.878 53.220 84.522 1.00 0.00 H TER 84045 WAT 8591 ATOM 84045 O WAT 8592 78.950 61.594 98.720 1.00 0.00 O ATOM 84046 H1 WAT 8592 77.997 61.552 98.792 1.00 0.00 H ATOM 84047 H2 WAT 8592 79.225 60.681 98.639 1.00 0.00 H TER 84049 WAT 8592 ATOM 84049 O WAT 8593 142.960 28.650 84.768 1.00 0.00 O ATOM 84050 H1 WAT 8593 142.734 29.564 84.595 1.00 0.00 H ATOM 84051 H2 WAT 8593 143.683 28.464 84.169 1.00 0.00 H TER 84053 WAT 8593 ATOM 84053 O WAT 8594 46.659 22.089 88.384 1.00 0.00 O ATOM 84054 H1 WAT 8594 46.202 21.380 88.837 1.00 0.00 H ATOM 84055 H2 WAT 8594 46.378 22.883 88.839 1.00 0.00 H TER 84057 WAT 8594 ATOM 84057 O WAT 8595 37.915 107.638 125.303 1.00 0.00 O ATOM 84058 H1 WAT 8595 38.394 108.003 126.047 1.00 0.00 H ATOM 84059 H2 WAT 8595 37.876 108.354 124.668 1.00 0.00 H TER 84061 WAT 8595 ATOM 84061 O WAT 8596 138.761 84.603 156.408 1.00 0.00 O ATOM 84062 H1 WAT 8596 138.624 84.869 155.499 1.00 0.00 H ATOM 84063 H2 WAT 8596 139.336 83.840 156.351 1.00 0.00 H TER 84065 WAT 8596 ATOM 84065 O WAT 8597 100.070 138.378 2.887 1.00 0.00 O ATOM 84066 H1 WAT 8597 100.325 137.460 2.794 1.00 0.00 H ATOM 84067 H2 WAT 8597 99.761 138.629 2.016 1.00 0.00 H TER 84069 WAT 8597 ATOM 84069 O WAT 8598 1.517 36.402 118.962 1.00 0.00 O ATOM 84070 H1 WAT 8598 1.326 35.907 119.758 1.00 0.00 H ATOM 84071 H2 WAT 8598 1.302 37.308 119.185 1.00 0.00 H TER 84073 WAT 8598 ATOM 84073 O WAT 8599 15.560 125.332 22.302 1.00 0.00 O ATOM 84074 H1 WAT 8599 15.547 125.442 23.252 1.00 0.00 H ATOM 84075 H2 WAT 8599 14.682 125.588 22.019 1.00 0.00 H TER 84077 WAT 8599 ATOM 84077 O WAT 8600 64.605 27.102 26.337 1.00 0.00 O ATOM 84078 H1 WAT 8600 65.491 26.987 25.993 1.00 0.00 H ATOM 84079 H2 WAT 8600 64.047 26.620 25.728 1.00 0.00 H TER 84081 WAT 8600 ATOM 84081 O WAT 8601 31.894 59.296 8.908 1.00 0.00 O ATOM 84082 H1 WAT 8601 31.536 59.403 9.789 1.00 0.00 H ATOM 84083 H2 WAT 8601 31.883 60.177 8.536 1.00 0.00 H TER 84085 WAT 8601 ATOM 84085 O WAT 8602 21.180 11.137 7.948 1.00 0.00 O ATOM 84086 H1 WAT 8602 20.400 11.527 8.343 1.00 0.00 H ATOM 84087 H2 WAT 8602 21.043 11.232 7.005 1.00 0.00 H TER 84089 WAT 8602 ATOM 84089 O WAT 8603 45.682 11.527 82.230 1.00 0.00 O ATOM 84090 H1 WAT 8603 45.820 11.329 83.156 1.00 0.00 H ATOM 84091 H2 WAT 8603 46.412 12.100 81.997 1.00 0.00 H TER 84093 WAT 8603 ATOM 84093 O WAT 8604 108.275 145.617 104.424 1.00 0.00 O ATOM 84094 H1 WAT 8604 107.588 145.348 103.815 1.00 0.00 H ATOM 84095 H2 WAT 8604 107.875 145.532 105.289 1.00 0.00 H TER 84097 WAT 8604 ATOM 84097 O WAT 8605 84.310 143.908 145.195 1.00 0.00 O ATOM 84098 H1 WAT 8605 84.513 143.466 144.371 1.00 0.00 H ATOM 84099 H2 WAT 8605 83.577 144.486 144.983 1.00 0.00 H TER 84101 WAT 8605 ATOM 84101 O WAT 8606 92.588 71.778 108.984 1.00 0.00 O ATOM 84102 H1 WAT 8606 92.197 71.049 108.502 1.00 0.00 H ATOM 84103 H2 WAT 8606 93.077 72.267 108.322 1.00 0.00 H TER 84105 WAT 8606 ATOM 84105 O WAT 8607 23.350 144.956 114.506 1.00 0.00 O ATOM 84106 H1 WAT 8607 23.934 145.102 115.250 1.00 0.00 H ATOM 84107 H2 WAT 8607 22.667 144.379 114.848 1.00 0.00 H TER 84109 WAT 8607 ATOM 84109 O WAT 8608 66.160 49.849 135.604 1.00 0.00 O ATOM 84110 H1 WAT 8608 66.077 49.607 136.526 1.00 0.00 H ATOM 84111 H2 WAT 8608 67.043 49.571 135.362 1.00 0.00 H TER 84113 WAT 8608 ATOM 84113 O WAT 8609 90.740 105.667 122.549 1.00 0.00 O ATOM 84114 H1 WAT 8609 90.774 105.065 123.292 1.00 0.00 H ATOM 84115 H2 WAT 8609 91.207 105.210 121.849 1.00 0.00 H TER 84117 WAT 8609 ATOM 84117 O WAT 8610 62.039 109.492 144.243 1.00 0.00 O ATOM 84118 H1 WAT 8610 61.745 108.588 144.354 1.00 0.00 H ATOM 84119 H2 WAT 8610 61.528 109.821 143.503 1.00 0.00 H TER 84121 WAT 8610 ATOM 84121 O WAT 8611 34.872 101.569 84.751 1.00 0.00 O ATOM 84122 H1 WAT 8611 34.137 101.847 84.204 1.00 0.00 H ATOM 84123 H2 WAT 8611 35.551 101.312 84.127 1.00 0.00 H TER 84125 WAT 8611 ATOM 84125 O WAT 8612 10.169 133.773 98.535 1.00 0.00 O ATOM 84126 H1 WAT 8612 10.800 134.478 98.391 1.00 0.00 H ATOM 84127 H2 WAT 8612 10.485 133.053 97.990 1.00 0.00 H TER 84129 WAT 8612 ATOM 84129 O WAT 8613 21.480 48.290 92.850 1.00 0.00 O ATOM 84130 H1 WAT 8613 21.909 47.812 92.140 1.00 0.00 H ATOM 84131 H2 WAT 8613 20.685 47.788 93.031 1.00 0.00 H TER 84133 WAT 8613 ATOM 84133 O WAT 8614 114.082 33.773 7.710 1.00 0.00 O ATOM 84134 H1 WAT 8614 113.899 32.861 7.485 1.00 0.00 H ATOM 84135 H2 WAT 8614 113.977 33.811 8.661 1.00 0.00 H TER 84137 WAT 8614 ATOM 84137 O WAT 8615 118.751 59.830 121.175 1.00 0.00 O ATOM 84138 H1 WAT 8615 119.500 60.395 120.983 1.00 0.00 H ATOM 84139 H2 WAT 8615 118.935 59.019 120.701 1.00 0.00 H TER 84141 WAT 8615 ATOM 84141 O WAT 8616 22.137 15.973 147.449 1.00 0.00 O ATOM 84142 H1 WAT 8616 21.675 15.231 147.840 1.00 0.00 H ATOM 84143 H2 WAT 8616 22.814 16.197 148.087 1.00 0.00 H TER 84145 WAT 8616 ATOM 84145 O WAT 8617 132.526 90.992 157.082 1.00 0.00 O ATOM 84146 H1 WAT 8617 133.372 91.390 157.289 1.00 0.00 H ATOM 84147 H2 WAT 8617 131.900 91.460 157.633 1.00 0.00 H TER 84149 WAT 8617 ATOM 84149 O WAT 8618 133.813 143.595 150.230 1.00 0.00 O ATOM 84150 H1 WAT 8618 132.955 143.413 149.845 1.00 0.00 H ATOM 84151 H2 WAT 8618 133.618 143.900 151.115 1.00 0.00 H TER 84153 WAT 8618 ATOM 84153 O WAT 8619 33.411 101.361 142.572 1.00 0.00 O ATOM 84154 H1 WAT 8619 33.366 102.156 142.042 1.00 0.00 H ATOM 84155 H2 WAT 8619 32.874 100.726 142.098 1.00 0.00 H TER 84157 WAT 8619 ATOM 84157 O WAT 8620 32.376 1.789 82.895 1.00 0.00 O ATOM 84158 H1 WAT 8620 32.365 0.917 83.289 1.00 0.00 H ATOM 84159 H2 WAT 8620 31.561 2.196 83.190 1.00 0.00 H TER 84161 WAT 8620 ATOM 84161 O WAT 8621 133.611 37.820 114.497 1.00 0.00 O ATOM 84162 H1 WAT 8621 134.091 37.067 114.153 1.00 0.00 H ATOM 84163 H2 WAT 8621 134.285 38.372 114.894 1.00 0.00 H TER 84165 WAT 8621 ATOM 84165 O WAT 8622 96.214 76.591 141.417 1.00 0.00 O ATOM 84166 H1 WAT 8622 95.718 77.336 141.758 1.00 0.00 H ATOM 84167 H2 WAT 8622 97.050 76.626 141.881 1.00 0.00 H TER 84169 WAT 8622 ATOM 84169 O WAT 8623 19.423 131.999 146.928 1.00 0.00 O ATOM 84170 H1 WAT 8623 19.319 131.534 147.758 1.00 0.00 H ATOM 84171 H2 WAT 8623 19.331 132.924 147.158 1.00 0.00 H TER 84173 WAT 8623 ATOM 84173 O WAT 8624 27.706 79.735 158.335 1.00 0.00 O ATOM 84174 H1 WAT 8624 28.529 80.038 157.953 1.00 0.00 H ATOM 84175 H2 WAT 8624 27.168 80.524 158.401 1.00 0.00 H TER 84177 WAT 8624 ATOM 84177 O WAT 8625 137.699 42.976 101.819 1.00 0.00 O ATOM 84178 H1 WAT 8625 137.115 42.227 101.937 1.00 0.00 H ATOM 84179 H2 WAT 8625 137.110 43.721 101.694 1.00 0.00 H TER 84181 WAT 8625 ATOM 84181 O WAT 8626 0.446 19.635 116.504 1.00 0.00 O ATOM 84182 H1 WAT 8626 1.296 19.998 116.754 1.00 0.00 H ATOM 84183 H2 WAT 8626 -0.105 19.763 117.276 1.00 0.00 H TER 84185 WAT 8626 ATOM 84185 O WAT 8627 145.236 75.257 8.366 1.00 0.00 O ATOM 84186 H1 WAT 8627 145.738 74.932 7.619 1.00 0.00 H ATOM 84187 H2 WAT 8627 145.879 75.722 8.903 1.00 0.00 H TER 84189 WAT 8627 ATOM 84189 O WAT 8628 144.392 33.780 58.038 1.00 0.00 O ATOM 84190 H1 WAT 8628 143.473 33.622 57.819 1.00 0.00 H ATOM 84191 H2 WAT 8628 144.361 34.310 58.834 1.00 0.00 H TER 84193 WAT 8628 ATOM 84193 O WAT 8629 81.551 17.825 95.191 1.00 0.00 O ATOM 84194 H1 WAT 8629 81.100 17.048 95.521 1.00 0.00 H ATOM 84195 H2 WAT 8629 82.417 17.508 94.934 1.00 0.00 H TER 84197 WAT 8629 ATOM 84197 O WAT 8630 60.200 100.638 153.696 1.00 0.00 O ATOM 84198 H1 WAT 8630 60.793 101.261 153.276 1.00 0.00 H ATOM 84199 H2 WAT 8630 60.725 100.237 154.388 1.00 0.00 H TER 84201 WAT 8630 ATOM 84201 O WAT 8631 115.708 35.991 122.747 1.00 0.00 O ATOM 84202 H1 WAT 8631 115.599 35.041 122.779 1.00 0.00 H ATOM 84203 H2 WAT 8631 115.333 36.246 121.904 1.00 0.00 H TER 84205 WAT 8631 ATOM 84205 O WAT 8632 48.598 12.345 3.045 1.00 0.00 O ATOM 84206 H1 WAT 8632 47.983 11.627 2.891 1.00 0.00 H ATOM 84207 H2 WAT 8632 49.198 12.309 2.301 1.00 0.00 H TER 84209 WAT 8632 ATOM 84209 O WAT 8633 126.663 29.393 22.613 1.00 0.00 O ATOM 84210 H1 WAT 8633 126.346 28.688 23.178 1.00 0.00 H ATOM 84211 H2 WAT 8633 126.948 28.950 21.814 1.00 0.00 H TER 84213 WAT 8633 ATOM 84213 O WAT 8634 128.189 13.733 126.724 1.00 0.00 O ATOM 84214 H1 WAT 8634 127.664 14.087 127.443 1.00 0.00 H ATOM 84215 H2 WAT 8634 127.556 13.563 126.026 1.00 0.00 H TER 84217 WAT 8634 ATOM 84217 O WAT 8635 107.745 72.184 73.670 1.00 0.00 O ATOM 84218 H1 WAT 8635 107.401 72.884 73.116 1.00 0.00 H ATOM 84219 H2 WAT 8635 107.434 71.378 73.258 1.00 0.00 H TER 84221 WAT 8635 ATOM 84221 O WAT 8636 129.942 22.716 93.132 1.00 0.00 O ATOM 84222 H1 WAT 8636 129.768 22.520 92.211 1.00 0.00 H ATOM 84223 H2 WAT 8636 129.108 23.041 93.470 1.00 0.00 H TER 84225 WAT 8636 ATOM 84225 O WAT 8637 108.198 143.013 2.475 1.00 0.00 O ATOM 84226 H1 WAT 8637 107.454 142.482 2.760 1.00 0.00 H ATOM 84227 H2 WAT 8637 108.818 142.967 3.203 1.00 0.00 H TER 84229 WAT 8637 ATOM 84229 O WAT 8638 45.982 85.431 74.611 1.00 0.00 O ATOM 84230 H1 WAT 8638 45.816 84.763 75.276 1.00 0.00 H ATOM 84231 H2 WAT 8638 45.587 85.078 73.813 1.00 0.00 H TER 84233 WAT 8638 ATOM 84233 O WAT 8639 56.626 21.042 122.396 1.00 0.00 O ATOM 84234 H1 WAT 8639 56.522 20.320 121.777 1.00 0.00 H ATOM 84235 H2 WAT 8639 57.146 20.672 123.110 1.00 0.00 H TER 84237 WAT 8639 ATOM 84237 O WAT 8640 145.627 31.870 124.704 1.00 0.00 O ATOM 84238 H1 WAT 8640 145.876 31.110 124.178 1.00 0.00 H ATOM 84239 H2 WAT 8640 145.293 31.497 125.520 1.00 0.00 H TER 84241 WAT 8640 ATOM 84241 O WAT 8641 15.006 118.656 25.106 1.00 0.00 O ATOM 84242 H1 WAT 8641 14.598 118.067 25.741 1.00 0.00 H ATOM 84243 H2 WAT 8641 15.482 119.293 25.640 1.00 0.00 H TER 84245 WAT 8641 ATOM 84245 O WAT 8642 77.242 113.102 90.520 1.00 0.00 O ATOM 84246 H1 WAT 8642 77.875 112.449 90.818 1.00 0.00 H ATOM 84247 H2 WAT 8642 77.350 113.834 91.127 1.00 0.00 H TER 84249 WAT 8642 ATOM 84249 O WAT 8643 99.469 18.624 146.041 1.00 0.00 O ATOM 84250 H1 WAT 8643 99.753 18.307 146.898 1.00 0.00 H ATOM 84251 H2 WAT 8643 99.357 17.830 145.517 1.00 0.00 H TER 84253 WAT 8643 ATOM 84253 O WAT 8644 43.160 63.380 24.938 1.00 0.00 O ATOM 84254 H1 WAT 8644 42.500 63.744 24.347 1.00 0.00 H ATOM 84255 H2 WAT 8644 43.915 63.961 24.840 1.00 0.00 H TER 84257 WAT 8644 ATOM 84257 O WAT 8645 107.145 85.531 155.937 1.00 0.00 O ATOM 84258 H1 WAT 8645 107.488 85.568 155.044 1.00 0.00 H ATOM 84259 H2 WAT 8645 106.220 85.309 155.828 1.00 0.00 H TER 84261 WAT 8645 ATOM 84261 O WAT 8646 136.808 121.175 114.439 1.00 0.00 O ATOM 84262 H1 WAT 8646 137.147 122.070 114.475 1.00 0.00 H ATOM 84263 H2 WAT 8646 135.910 121.246 114.763 1.00 0.00 H TER 84265 WAT 8646 ATOM 84265 O WAT 8647 41.407 55.902 110.913 1.00 0.00 O ATOM 84266 H1 WAT 8647 41.135 56.587 111.525 1.00 0.00 H ATOM 84267 H2 WAT 8647 40.712 55.246 110.963 1.00 0.00 H TER 84269 WAT 8647 ATOM 84269 O WAT 8648 62.119 52.309 112.905 1.00 0.00 O ATOM 84270 H1 WAT 8648 61.484 51.667 112.587 1.00 0.00 H ATOM 84271 H2 WAT 8648 61.865 52.467 113.814 1.00 0.00 H TER 84273 WAT 8648 ATOM 84273 O WAT 8649 46.977 125.761 144.233 1.00 0.00 O ATOM 84274 H1 WAT 8649 46.710 124.936 143.827 1.00 0.00 H ATOM 84275 H2 WAT 8649 47.532 125.498 144.967 1.00 0.00 H TER 84277 WAT 8649 ATOM 84277 O WAT 8650 58.037 98.141 14.503 1.00 0.00 O ATOM 84278 H1 WAT 8650 58.834 98.626 14.290 1.00 0.00 H ATOM 84279 H2 WAT 8650 57.633 98.643 15.211 1.00 0.00 H TER 84281 WAT 8650 ATOM 84281 O WAT 8651 127.838 70.396 95.913 1.00 0.00 O ATOM 84282 H1 WAT 8651 127.546 69.861 95.175 1.00 0.00 H ATOM 84283 H2 WAT 8651 127.507 69.940 96.686 1.00 0.00 H TER 84285 WAT 8651 ATOM 84285 O WAT 8652 85.146 98.696 99.572 1.00 0.00 O ATOM 84286 H1 WAT 8652 85.233 98.745 100.524 1.00 0.00 H ATOM 84287 H2 WAT 8652 84.584 97.935 99.422 1.00 0.00 H TER 84289 WAT 8652 ATOM 84289 O WAT 8653 38.917 5.198 3.368 1.00 0.00 O ATOM 84290 H1 WAT 8653 38.272 5.599 3.951 1.00 0.00 H ATOM 84291 H2 WAT 8653 39.717 5.702 3.513 1.00 0.00 H TER 84293 WAT 8653 ATOM 84293 O WAT 8654 21.548 133.106 69.734 1.00 0.00 O ATOM 84294 H1 WAT 8654 22.102 133.881 69.640 1.00 0.00 H ATOM 84295 H2 WAT 8654 22.160 132.397 69.933 1.00 0.00 H TER 84297 WAT 8654 ATOM 84297 O WAT 8655 40.184 24.369 77.377 1.00 0.00 O ATOM 84298 H1 WAT 8655 39.268 24.527 77.604 1.00 0.00 H ATOM 84299 H2 WAT 8655 40.470 25.179 76.954 1.00 0.00 H TER 84301 WAT 8655 ATOM 84301 O WAT 8656 136.532 38.765 142.125 1.00 0.00 O ATOM 84302 H1 WAT 8656 137.056 39.188 141.445 1.00 0.00 H ATOM 84303 H2 WAT 8656 136.551 37.835 141.898 1.00 0.00 H TER 84305 WAT 8656 ATOM 84305 O WAT 8657 76.572 92.967 4.726 1.00 0.00 O ATOM 84306 H1 WAT 8657 77.041 92.362 5.301 1.00 0.00 H ATOM 84307 H2 WAT 8657 76.263 92.420 4.004 1.00 0.00 H TER 84309 WAT 8657 ATOM 84309 O WAT 8658 132.209 89.916 121.699 1.00 0.00 O ATOM 84310 H1 WAT 8658 133.028 90.346 121.455 1.00 0.00 H ATOM 84311 H2 WAT 8658 131.706 89.879 120.886 1.00 0.00 H TER 84313 WAT 8658 ATOM 84313 O WAT 8659 81.981 89.092 109.986 1.00 0.00 O ATOM 84314 H1 WAT 8659 81.603 89.152 110.864 1.00 0.00 H ATOM 84315 H2 WAT 8659 81.259 88.788 109.436 1.00 0.00 H TER 84317 WAT 8659 ATOM 84317 O WAT 8660 67.902 101.375 4.829 1.00 0.00 O ATOM 84318 H1 WAT 8660 67.215 101.244 5.482 1.00 0.00 H ATOM 84319 H2 WAT 8660 68.272 100.502 4.692 1.00 0.00 H TER 84321 WAT 8660 ATOM 84321 O WAT 8661 96.706 24.655 88.168 1.00 0.00 O ATOM 84322 H1 WAT 8661 96.359 24.153 88.905 1.00 0.00 H ATOM 84323 H2 WAT 8661 96.450 24.154 87.394 1.00 0.00 H TER 84325 WAT 8661 ATOM 84325 O WAT 8662 27.650 3.274 98.544 1.00 0.00 O ATOM 84326 H1 WAT 8662 27.525 2.494 98.004 1.00 0.00 H ATOM 84327 H2 WAT 8662 27.817 3.977 97.915 1.00 0.00 H TER 84329 WAT 8662 ATOM 84329 O WAT 8663 56.630 2.642 15.184 1.00 0.00 O ATOM 84330 H1 WAT 8663 56.534 1.925 14.556 1.00 0.00 H ATOM 84331 H2 WAT 8663 57.551 2.893 15.121 1.00 0.00 H TER 84333 WAT 8663 ATOM 84333 O WAT 8664 53.091 52.433 130.868 1.00 0.00 O ATOM 84334 H1 WAT 8664 52.773 52.574 129.976 1.00 0.00 H ATOM 84335 H2 WAT 8664 52.859 53.235 131.335 1.00 0.00 H TER 84337 WAT 8664 ATOM 84337 O WAT 8665 36.850 50.347 146.021 1.00 0.00 O ATOM 84338 H1 WAT 8665 36.722 49.712 145.317 1.00 0.00 H ATOM 84339 H2 WAT 8665 37.225 51.114 145.587 1.00 0.00 H TER 84341 WAT 8665 ATOM 84341 O WAT 8666 49.274 125.693 6.037 1.00 0.00 O ATOM 84342 H1 WAT 8666 50.122 125.365 6.336 1.00 0.00 H ATOM 84343 H2 WAT 8666 49.106 126.459 6.586 1.00 0.00 H TER 84345 WAT 8666 ATOM 84345 O WAT 8667 83.951 128.036 24.393 1.00 0.00 O ATOM 84346 H1 WAT 8667 83.775 128.543 23.600 1.00 0.00 H ATOM 84347 H2 WAT 8667 84.605 128.550 24.866 1.00 0.00 H TER 84349 WAT 8667 ATOM 84349 O WAT 8668 121.935 121.657 12.899 1.00 0.00 O ATOM 84350 H1 WAT 8668 121.901 122.073 13.760 1.00 0.00 H ATOM 84351 H2 WAT 8668 122.465 122.251 12.367 1.00 0.00 H TER 84353 WAT 8668 ATOM 84353 O WAT 8669 96.415 70.072 17.106 1.00 0.00 O ATOM 84354 H1 WAT 8669 96.564 69.135 17.237 1.00 0.00 H ATOM 84355 H2 WAT 8669 95.468 70.151 16.996 1.00 0.00 H TER 84357 WAT 8669 ATOM 84357 O WAT 8670 107.270 46.803 1.147 1.00 0.00 O ATOM 84358 H1 WAT 8670 107.173 46.414 2.016 1.00 0.00 H ATOM 84359 H2 WAT 8670 107.459 47.726 1.316 1.00 0.00 H TER 84361 WAT 8670 ATOM 84361 O WAT 8671 127.919 112.383 120.503 1.00 0.00 O ATOM 84362 H1 WAT 8671 127.791 112.759 119.632 1.00 0.00 H ATOM 84363 H2 WAT 8671 127.246 112.797 121.043 1.00 0.00 H TER 84365 WAT 8671 ATOM 84365 O WAT 8672 79.397 108.068 139.400 1.00 0.00 O ATOM 84366 H1 WAT 8672 80.016 108.059 138.670 1.00 0.00 H ATOM 84367 H2 WAT 8672 78.772 108.757 139.175 1.00 0.00 H TER 84369 WAT 8672 ATOM 84369 O WAT 8673 109.109 142.554 14.401 1.00 0.00 O ATOM 84370 H1 WAT 8673 109.993 142.511 14.766 1.00 0.00 H ATOM 84371 H2 WAT 8673 108.533 142.524 15.165 1.00 0.00 H TER 84373 WAT 8673 ATOM 84373 O WAT 8674 59.232 33.570 59.469 1.00 0.00 O ATOM 84374 H1 WAT 8674 59.999 33.491 60.036 1.00 0.00 H ATOM 84375 H2 WAT 8674 58.498 33.293 60.018 1.00 0.00 H TER 84377 WAT 8674 ATOM 84377 O WAT 8675 132.320 81.721 12.498 1.00 0.00 O ATOM 84378 H1 WAT 8675 133.110 81.299 12.160 1.00 0.00 H ATOM 84379 H2 WAT 8675 131.723 80.997 12.686 1.00 0.00 H TER 84381 WAT 8675 ATOM 84381 O WAT 8676 10.234 88.216 3.400 1.00 0.00 O ATOM 84382 H1 WAT 8676 9.878 88.915 2.852 1.00 0.00 H ATOM 84383 H2 WAT 8676 11.071 88.560 3.712 1.00 0.00 H TER 84385 WAT 8676 ATOM 84385 O WAT 8677 19.206 7.947 88.787 1.00 0.00 O ATOM 84386 H1 WAT 8677 19.518 7.214 89.316 1.00 0.00 H ATOM 84387 H2 WAT 8677 19.916 8.587 88.821 1.00 0.00 H TER 84389 WAT 8677 ATOM 84389 O WAT 8678 44.007 67.945 144.504 1.00 0.00 O ATOM 84390 H1 WAT 8678 44.024 67.085 144.084 1.00 0.00 H ATOM 84391 H2 WAT 8678 44.827 68.359 144.237 1.00 0.00 H TER 84393 WAT 8678 ATOM 84393 O WAT 8679 115.428 134.406 148.870 1.00 0.00 O ATOM 84394 H1 WAT 8679 114.880 134.866 149.506 1.00 0.00 H ATOM 84395 H2 WAT 8679 116.142 134.038 149.391 1.00 0.00 H TER 84397 WAT 8679 ATOM 84397 O WAT 8680 54.632 123.405 109.274 1.00 0.00 O ATOM 84398 H1 WAT 8680 55.294 122.743 109.070 1.00 0.00 H ATOM 84399 H2 WAT 8680 54.145 123.516 108.457 1.00 0.00 H TER 84401 WAT 8680 ATOM 84401 O WAT 8681 101.960 57.907 8.769 1.00 0.00 O ATOM 84402 H1 WAT 8681 102.910 57.990 8.688 1.00 0.00 H ATOM 84403 H2 WAT 8681 101.787 56.978 8.620 1.00 0.00 H TER 84405 WAT 8681 ATOM 84405 O WAT 8682 125.887 84.127 154.195 1.00 0.00 O ATOM 84406 H1 WAT 8682 125.775 83.183 154.081 1.00 0.00 H ATOM 84407 H2 WAT 8682 125.604 84.295 155.093 1.00 0.00 H TER 84409 WAT 8682 ATOM 84409 O WAT 8683 79.057 131.339 114.370 1.00 0.00 O ATOM 84410 H1 WAT 8683 78.700 130.492 114.637 1.00 0.00 H ATOM 84411 H2 WAT 8683 79.134 131.278 113.418 1.00 0.00 H TER 84413 WAT 8683 ATOM 84413 O WAT 8684 0.593 10.740 149.571 1.00 0.00 O ATOM 84414 H1 WAT 8684 0.074 10.007 149.900 1.00 0.00 H ATOM 84415 H2 WAT 8684 1.246 10.335 149.000 1.00 0.00 H TER 84417 WAT 8684 ATOM 84417 O WAT 8685 144.546 37.813 76.229 1.00 0.00 O ATOM 84418 H1 WAT 8685 145.307 37.620 75.682 1.00 0.00 H ATOM 84419 H2 WAT 8685 144.423 37.023 76.756 1.00 0.00 H TER 84421 WAT 8685 ATOM 84421 O WAT 8686 86.986 102.231 12.165 1.00 0.00 O ATOM 84422 H1 WAT 8686 87.700 102.867 12.134 1.00 0.00 H ATOM 84423 H2 WAT 8686 86.941 101.966 13.084 1.00 0.00 H TER 84425 WAT 8686 ATOM 84425 O WAT 8687 27.583 34.926 72.492 1.00 0.00 O ATOM 84426 H1 WAT 8687 27.557 34.700 71.562 1.00 0.00 H ATOM 84427 H2 WAT 8687 28.136 34.251 72.886 1.00 0.00 H TER 84429 WAT 8687 ATOM 84429 O WAT 8688 85.704 114.596 85.444 1.00 0.00 O ATOM 84430 H1 WAT 8688 84.833 114.507 85.828 1.00 0.00 H ATOM 84431 H2 WAT 8688 85.615 114.235 84.562 1.00 0.00 H TER 84433 WAT 8688 ATOM 84433 O WAT 8689 70.076 27.966 136.617 1.00 0.00 O ATOM 84434 H1 WAT 8689 69.399 27.314 136.799 1.00 0.00 H ATOM 84435 H2 WAT 8689 69.907 28.241 135.716 1.00 0.00 H TER 84437 WAT 8689 ATOM 84437 O WAT 8690 92.636 70.674 68.927 1.00 0.00 O ATOM 84438 H1 WAT 8690 93.531 70.656 69.268 1.00 0.00 H ATOM 84439 H2 WAT 8690 92.719 71.062 68.056 1.00 0.00 H TER 84441 WAT 8690 ATOM 84441 O WAT 8691 137.212 26.048 0.839 1.00 0.00 O ATOM 84442 H1 WAT 8691 137.234 25.413 1.555 1.00 0.00 H ATOM 84443 H2 WAT 8691 137.173 25.514 0.046 1.00 0.00 H TER 84445 WAT 8691 ATOM 84445 O WAT 8692 7.322 61.545 18.837 1.00 0.00 O ATOM 84446 H1 WAT 8692 7.356 60.706 18.378 1.00 0.00 H ATOM 84447 H2 WAT 8692 6.447 61.570 19.226 1.00 0.00 H TER 84449 WAT 8692 ATOM 84449 O WAT 8693 86.529 26.043 135.328 1.00 0.00 O ATOM 84450 H1 WAT 8693 86.442 25.798 136.249 1.00 0.00 H ATOM 84451 H2 WAT 8693 85.644 26.292 135.061 1.00 0.00 H TER 84453 WAT 8693 ATOM 84453 O WAT 8694 47.035 135.902 117.181 1.00 0.00 O ATOM 84454 H1 WAT 8694 47.646 135.712 116.470 1.00 0.00 H ATOM 84455 H2 WAT 8694 47.364 136.713 117.570 1.00 0.00 H TER 84457 WAT 8694 ATOM 84457 O WAT 8695 131.022 98.557 85.692 1.00 0.00 O ATOM 84458 H1 WAT 8695 131.358 98.677 86.580 1.00 0.00 H ATOM 84459 H2 WAT 8695 131.319 97.683 85.439 1.00 0.00 H TER 84461 WAT 8695 ATOM 84461 O WAT 8696 110.583 19.042 92.047 1.00 0.00 O ATOM 84462 H1 WAT 8696 109.997 18.434 91.596 1.00 0.00 H ATOM 84463 H2 WAT 8696 110.892 18.554 92.810 1.00 0.00 H TER 84465 WAT 8696 ATOM 84465 O WAT 8697 114.634 100.802 84.386 1.00 0.00 O ATOM 84466 H1 WAT 8697 113.973 101.239 83.849 1.00 0.00 H ATOM 84467 H2 WAT 8697 114.815 101.421 85.094 1.00 0.00 H TER 84469 WAT 8697 ATOM 84469 O WAT 8698 93.123 142.637 94.408 1.00 0.00 O ATOM 84470 H1 WAT 8698 92.167 142.609 94.363 1.00 0.00 H ATOM 84471 H2 WAT 8698 93.410 141.886 93.889 1.00 0.00 H TER 84473 WAT 8698 ATOM 84473 O WAT 8699 94.956 17.889 93.683 1.00 0.00 O ATOM 84474 H1 WAT 8699 93.999 17.897 93.675 1.00 0.00 H ATOM 84475 H2 WAT 8699 95.186 17.007 93.975 1.00 0.00 H TER 84477 WAT 8699 ATOM 84477 O WAT 8700 117.100 101.697 145.021 1.00 0.00 O ATOM 84478 H1 WAT 8700 117.714 101.048 145.366 1.00 0.00 H ATOM 84479 H2 WAT 8700 117.657 102.411 144.711 1.00 0.00 H TER 84481 WAT 8700 ATOM 84481 O WAT 8701 74.599 21.428 62.675 1.00 0.00 O ATOM 84482 H1 WAT 8701 74.608 21.601 63.616 1.00 0.00 H ATOM 84483 H2 WAT 8701 75.298 20.787 62.543 1.00 0.00 H TER 84485 WAT 8701 ATOM 84485 O WAT 8702 20.699 54.165 68.192 1.00 0.00 O ATOM 84486 H1 WAT 8702 19.943 53.778 67.751 1.00 0.00 H ATOM 84487 H2 WAT 8702 21.112 53.431 68.647 1.00 0.00 H TER 84489 WAT 8702 ATOM 84489 O WAT 8703 100.670 32.749 86.349 1.00 0.00 O ATOM 84490 H1 WAT 8703 100.984 33.408 85.730 1.00 0.00 H ATOM 84491 H2 WAT 8703 100.390 32.018 85.798 1.00 0.00 H TER 84493 WAT 8703 ATOM 84493 O WAT 8704 135.277 73.512 155.447 1.00 0.00 O ATOM 84494 H1 WAT 8704 134.671 74.149 155.825 1.00 0.00 H ATOM 84495 H2 WAT 8704 135.277 72.784 156.068 1.00 0.00 H TER 84497 WAT 8704 ATOM 84497 O WAT 8705 53.999 71.248 110.017 1.00 0.00 O ATOM 84498 H1 WAT 8705 53.955 70.840 109.152 1.00 0.00 H ATOM 84499 H2 WAT 8705 54.832 70.948 110.381 1.00 0.00 H TER 84501 WAT 8705 ATOM 84501 O WAT 8706 7.599 124.465 95.511 1.00 0.00 O ATOM 84502 H1 WAT 8706 6.778 123.976 95.466 1.00 0.00 H ATOM 84503 H2 WAT 8706 7.358 125.302 95.909 1.00 0.00 H TER 84505 WAT 8706 ATOM 84505 O WAT 8707 74.038 15.550 13.727 1.00 0.00 O ATOM 84506 H1 WAT 8707 74.101 16.299 14.319 1.00 0.00 H ATOM 84507 H2 WAT 8707 73.916 14.797 14.305 1.00 0.00 H TER 84509 WAT 8707 ATOM 84509 O WAT 8708 8.917 73.705 98.616 1.00 0.00 O ATOM 84510 H1 WAT 8708 9.091 73.382 97.732 1.00 0.00 H ATOM 84511 H2 WAT 8708 9.059 74.650 98.557 1.00 0.00 H TER 84513 WAT 8708 ATOM 84513 O WAT 8709 117.648 37.087 95.583 1.00 0.00 O ATOM 84514 H1 WAT 8709 117.180 37.076 94.748 1.00 0.00 H ATOM 84515 H2 WAT 8709 118.522 37.410 95.363 1.00 0.00 H TER 84517 WAT 8709 ATOM 84517 O WAT 8710 56.932 53.753 1.488 1.00 0.00 O ATOM 84518 H1 WAT 8710 57.330 54.155 0.715 1.00 0.00 H ATOM 84519 H2 WAT 8710 56.544 52.941 1.163 1.00 0.00 H TER 84521 WAT 8710 ATOM 84521 O WAT 8711 12.181 38.548 157.168 1.00 0.00 O ATOM 84522 H1 WAT 8711 12.322 37.907 157.866 1.00 0.00 H ATOM 84523 H2 WAT 8711 13.056 38.881 156.968 1.00 0.00 H TER 84525 WAT 8711 ATOM 84525 O WAT 8712 124.158 0.215 153.789 1.00 0.00 O ATOM 84526 H1 WAT 8712 124.279 1.105 153.458 1.00 0.00 H ATOM 84527 H2 WAT 8712 124.155 0.313 154.741 1.00 0.00 H TER 84529 WAT 8712 ATOM 84529 O WAT 8713 135.968 47.228 156.734 1.00 0.00 O ATOM 84530 H1 WAT 8713 136.643 47.705 157.217 1.00 0.00 H ATOM 84531 H2 WAT 8713 135.604 47.875 156.129 1.00 0.00 H TER 84533 WAT 8713 ATOM 84533 O WAT 8714 56.806 39.734 68.551 1.00 0.00 O ATOM 84534 H1 WAT 8714 56.638 40.627 68.250 1.00 0.00 H ATOM 84535 H2 WAT 8714 57.741 39.721 68.754 1.00 0.00 H TER 84537 WAT 8714 ATOM 84537 O WAT 8715 69.657 100.812 85.446 1.00 0.00 O ATOM 84538 H1 WAT 8715 69.264 101.252 84.693 1.00 0.00 H ATOM 84539 H2 WAT 8715 70.581 100.720 85.214 1.00 0.00 H TER 84541 WAT 8715 ATOM 84541 O WAT 8716 6.517 16.151 118.428 1.00 0.00 O ATOM 84542 H1 WAT 8716 5.623 16.460 118.571 1.00 0.00 H ATOM 84543 H2 WAT 8716 6.579 16.025 117.481 1.00 0.00 H TER 84545 WAT 8716 ATOM 84545 O WAT 8717 36.035 113.422 92.492 1.00 0.00 O ATOM 84546 H1 WAT 8717 36.991 113.450 92.536 1.00 0.00 H ATOM 84547 H2 WAT 8717 35.845 112.841 91.756 1.00 0.00 H TER 84549 WAT 8717 ATOM 84549 O WAT 8718 94.940 83.269 142.820 1.00 0.00 O ATOM 84550 H1 WAT 8718 95.288 83.065 141.952 1.00 0.00 H ATOM 84551 H2 WAT 8718 95.684 83.638 143.296 1.00 0.00 H TER 84553 WAT 8718 ATOM 84553 O WAT 8719 136.725 46.478 66.814 1.00 0.00 O ATOM 84554 H1 WAT 8719 137.091 46.745 67.657 1.00 0.00 H ATOM 84555 H2 WAT 8719 136.297 47.265 66.478 1.00 0.00 H TER 84557 WAT 8719 ATOM 84557 O WAT 8720 29.548 59.049 73.763 1.00 0.00 O ATOM 84558 H1 WAT 8720 29.100 58.206 73.827 1.00 0.00 H ATOM 84559 H2 WAT 8720 28.973 59.661 74.221 1.00 0.00 H TER 84561 WAT 8720 ATOM 84561 O WAT 8721 33.857 1.134 147.514 1.00 0.00 O ATOM 84562 H1 WAT 8721 34.416 1.333 148.265 1.00 0.00 H ATOM 84563 H2 WAT 8721 34.421 0.639 146.919 1.00 0.00 H TER 84565 WAT 8721 ATOM 84565 O WAT 8722 90.520 110.261 128.255 1.00 0.00 O ATOM 84566 H1 WAT 8722 90.046 111.092 128.236 1.00 0.00 H ATOM 84567 H2 WAT 8722 90.572 109.993 127.338 1.00 0.00 H TER 84569 WAT 8722 ATOM 84569 O WAT 8723 55.916 19.623 20.163 1.00 0.00 O ATOM 84570 H1 WAT 8723 56.298 20.272 20.754 1.00 0.00 H ATOM 84571 H2 WAT 8723 55.745 18.863 20.720 1.00 0.00 H TER 84573 WAT 8723 ATOM 84573 O WAT 8724 93.086 33.043 140.317 1.00 0.00 O ATOM 84574 H1 WAT 8724 92.371 33.299 140.898 1.00 0.00 H ATOM 84575 H2 WAT 8724 92.901 32.130 140.097 1.00 0.00 H TER 84577 WAT 8724 ATOM 84577 O WAT 8725 65.433 128.240 51.834 1.00 0.00 O ATOM 84578 H1 WAT 8725 65.030 128.743 52.542 1.00 0.00 H ATOM 84579 H2 WAT 8725 64.719 128.083 51.216 1.00 0.00 H TER 84581 WAT 8725 ATOM 84581 O WAT 8726 117.751 86.603 109.613 1.00 0.00 O ATOM 84582 H1 WAT 8726 118.362 85.895 109.816 1.00 0.00 H ATOM 84583 H2 WAT 8726 118.286 87.397 109.641 1.00 0.00 H TER 84585 WAT 8726 ATOM 84585 O WAT 8727 46.993 7.533 123.805 1.00 0.00 O ATOM 84586 H1 WAT 8727 46.419 8.141 124.271 1.00 0.00 H ATOM 84587 H2 WAT 8727 46.511 7.312 123.008 1.00 0.00 H TER 84589 WAT 8727 ATOM 84589 O WAT 8728 58.534 111.537 96.283 1.00 0.00 O ATOM 84590 H1 WAT 8728 57.676 111.268 95.954 1.00 0.00 H ATOM 84591 H2 WAT 8728 58.390 112.413 96.640 1.00 0.00 H TER 84593 WAT 8728 ATOM 84593 O WAT 8729 2.417 15.263 118.094 1.00 0.00 O ATOM 84594 H1 WAT 8729 3.155 14.807 117.692 1.00 0.00 H ATOM 84595 H2 WAT 8729 1.660 14.708 117.904 1.00 0.00 H TER 84597 WAT 8729 ATOM 84597 O WAT 8730 39.794 133.523 93.160 1.00 0.00 O ATOM 84598 H1 WAT 8730 40.436 133.223 92.517 1.00 0.00 H ATOM 84599 H2 WAT 8730 39.238 134.134 92.677 1.00 0.00 H TER 84601 WAT 8730 ATOM 84601 O WAT 8731 101.335 62.928 122.000 1.00 0.00 O ATOM 84602 H1 WAT 8731 102.157 62.513 121.739 1.00 0.00 H ATOM 84603 H2 WAT 8731 101.183 62.618 122.893 1.00 0.00 H TER 84605 WAT 8731 ATOM 84605 O WAT 8732 105.653 67.405 88.327 1.00 0.00 O ATOM 84606 H1 WAT 8732 105.772 68.351 88.411 1.00 0.00 H ATOM 84607 H2 WAT 8732 104.815 67.308 87.875 1.00 0.00 H TER 84609 WAT 8732 ATOM 84609 O WAT 8733 85.946 92.009 58.666 1.00 0.00 O ATOM 84610 H1 WAT 8733 86.234 92.858 58.330 1.00 0.00 H ATOM 84611 H2 WAT 8733 86.739 91.472 58.670 1.00 0.00 H TER 84613 WAT 8733 ATOM 84613 O WAT 8734 120.488 105.026 78.339 1.00 0.00 O ATOM 84614 H1 WAT 8734 119.581 104.723 78.389 1.00 0.00 H ATOM 84615 H2 WAT 8734 120.461 105.763 77.728 1.00 0.00 H TER 84617 WAT 8734 ATOM 84617 O WAT 8735 72.789 22.564 73.640 1.00 0.00 O ATOM 84618 H1 WAT 8735 73.053 21.989 74.358 1.00 0.00 H ATOM 84619 H2 WAT 8735 72.015 22.142 73.267 1.00 0.00 H TER 84621 WAT 8735 ATOM 84621 O WAT 8736 142.823 118.028 122.088 1.00 0.00 O ATOM 84622 H1 WAT 8736 143.471 117.731 121.449 1.00 0.00 H ATOM 84623 H2 WAT 8736 143.011 118.959 122.205 1.00 0.00 H TER 84625 WAT 8736 ATOM 84625 O WAT 8737 104.100 50.466 8.194 1.00 0.00 O ATOM 84626 H1 WAT 8737 104.186 50.935 9.025 1.00 0.00 H ATOM 84627 H2 WAT 8737 103.942 49.557 8.448 1.00 0.00 H TER 84629 WAT 8737 ATOM 84629 O WAT 8738 35.955 14.439 120.226 1.00 0.00 O ATOM 84630 H1 WAT 8738 35.824 13.605 120.677 1.00 0.00 H ATOM 84631 H2 WAT 8738 35.838 15.100 120.908 1.00 0.00 H TER 84633 WAT 8738 ATOM 84633 O WAT 8739 115.052 48.829 116.461 1.00 0.00 O ATOM 84634 H1 WAT 8739 114.531 48.410 117.146 1.00 0.00 H ATOM 84635 H2 WAT 8739 114.579 48.640 115.650 1.00 0.00 H TER 84637 WAT 8739 ATOM 84637 O WAT 8740 43.535 17.884 11.107 1.00 0.00 O ATOM 84638 H1 WAT 8740 43.917 17.007 11.103 1.00 0.00 H ATOM 84639 H2 WAT 8740 42.785 17.822 10.515 1.00 0.00 H TER 84641 WAT 8740 ATOM 84641 O WAT 8741 66.805 106.218 152.872 1.00 0.00 O ATOM 84642 H1 WAT 8741 66.207 106.302 153.615 1.00 0.00 H ATOM 84643 H2 WAT 8741 67.651 106.007 153.267 1.00 0.00 H TER 84645 WAT 8741 ATOM 84645 O WAT 8742 50.731 0.652 14.079 1.00 0.00 O ATOM 84646 H1 WAT 8742 51.630 0.893 13.856 1.00 0.00 H ATOM 84647 H2 WAT 8742 50.821 0.053 14.821 1.00 0.00 H TER 84649 WAT 8742 ATOM 84649 O WAT 8743 93.249 94.593 156.967 1.00 0.00 O ATOM 84650 H1 WAT 8743 94.121 94.793 157.306 1.00 0.00 H ATOM 84651 H2 WAT 8743 92.653 95.087 157.531 1.00 0.00 H TER 84653 WAT 8743 ATOM 84653 O WAT 8744 13.712 109.732 125.468 1.00 0.00 O ATOM 84654 H1 WAT 8744 13.477 108.829 125.257 1.00 0.00 H ATOM 84655 H2 WAT 8744 12.954 110.072 125.945 1.00 0.00 H TER 84657 WAT 8744 ATOM 84657 O WAT 8745 106.604 134.712 81.142 1.00 0.00 O ATOM 84658 H1 WAT 8745 106.942 133.876 80.820 1.00 0.00 H ATOM 84659 H2 WAT 8745 106.024 134.474 81.865 1.00 0.00 H TER 84661 WAT 8745 ATOM 84661 O WAT 8746 64.571 107.824 129.954 1.00 0.00 O ATOM 84662 H1 WAT 8746 64.711 108.288 129.128 1.00 0.00 H ATOM 84663 H2 WAT 8746 63.622 107.835 130.077 1.00 0.00 H TER 84665 WAT 8746 ATOM 84665 O WAT 8747 109.255 20.826 109.429 1.00 0.00 O ATOM 84666 H1 WAT 8747 108.583 20.316 109.882 1.00 0.00 H ATOM 84667 H2 WAT 8747 109.406 20.351 108.612 1.00 0.00 H TER 84669 WAT 8747 ATOM 84669 O WAT 8748 10.345 57.742 81.455 1.00 0.00 O ATOM 84670 H1 WAT 8748 9.741 58.401 81.797 1.00 0.00 H ATOM 84671 H2 WAT 8748 10.512 58.016 80.553 1.00 0.00 H TER 84673 WAT 8748 ATOM 84673 O WAT 8749 68.412 126.990 8.421 1.00 0.00 O ATOM 84674 H1 WAT 8749 67.780 127.609 8.788 1.00 0.00 H ATOM 84675 H2 WAT 8749 68.833 126.596 9.185 1.00 0.00 H TER 84677 WAT 8749 ATOM 84677 O WAT 8750 144.088 85.928 126.263 1.00 0.00 O ATOM 84678 H1 WAT 8750 144.557 85.094 126.293 1.00 0.00 H ATOM 84679 H2 WAT 8750 144.732 86.576 126.549 1.00 0.00 H TER 84681 WAT 8750 ATOM 84681 O WAT 8751 49.609 26.203 68.988 1.00 0.00 O ATOM 84682 H1 WAT 8751 49.534 26.847 69.692 1.00 0.00 H ATOM 84683 H2 WAT 8751 49.889 25.400 69.427 1.00 0.00 H TER 84685 WAT 8751 ATOM 84685 O WAT 8752 81.473 141.907 96.086 1.00 0.00 O ATOM 84686 H1 WAT 8752 81.746 142.307 96.912 1.00 0.00 H ATOM 84687 H2 WAT 8752 82.085 141.184 95.955 1.00 0.00 H TER 84689 WAT 8752 ATOM 84689 O WAT 8753 58.539 48.687 15.423 1.00 0.00 O ATOM 84690 H1 WAT 8753 59.354 48.955 14.998 1.00 0.00 H ATOM 84691 H2 WAT 8753 58.513 47.736 15.315 1.00 0.00 H TER 84693 WAT 8753 ATOM 84693 O WAT 8754 60.858 124.059 128.699 1.00 0.00 O ATOM 84694 H1 WAT 8754 60.795 123.138 128.952 1.00 0.00 H ATOM 84695 H2 WAT 8754 61.719 124.335 129.014 1.00 0.00 H TER 84697 WAT 8754 ATOM 84697 O WAT 8755 92.938 112.030 71.909 1.00 0.00 O ATOM 84698 H1 WAT 8755 93.807 111.867 71.542 1.00 0.00 H ATOM 84699 H2 WAT 8755 92.707 111.212 72.350 1.00 0.00 H TER 84701 WAT 8755 ATOM 84701 O WAT 8756 76.495 140.859 17.164 1.00 0.00 O ATOM 84702 H1 WAT 8756 76.628 140.115 16.577 1.00 0.00 H ATOM 84703 H2 WAT 8756 77.064 140.680 17.912 1.00 0.00 H TER 84705 WAT 8756 ATOM 84705 O WAT 8757 88.596 117.281 25.754 1.00 0.00 O ATOM 84706 H1 WAT 8757 88.094 116.794 25.100 1.00 0.00 H ATOM 84707 H2 WAT 8757 88.062 117.238 26.547 1.00 0.00 H TER 84709 WAT 8757 ATOM 84709 O WAT 8758 84.269 100.380 10.546 1.00 0.00 O ATOM 84710 H1 WAT 8758 84.337 100.791 9.684 1.00 0.00 H ATOM 84711 H2 WAT 8758 84.072 101.103 11.141 1.00 0.00 H TER 84713 WAT 8758 ATOM 84713 O WAT 8759 1.402 72.215 148.125 1.00 0.00 O ATOM 84714 H1 WAT 8759 2.097 72.673 147.652 1.00 0.00 H ATOM 84715 H2 WAT 8759 1.110 72.842 148.787 1.00 0.00 H TER 84717 WAT 8759 ATOM 84717 O WAT 8760 141.331 71.666 137.521 1.00 0.00 O ATOM 84718 H1 WAT 8760 141.215 72.381 136.895 1.00 0.00 H ATOM 84719 H2 WAT 8760 140.444 71.351 137.693 1.00 0.00 H TER 84721 WAT 8760 ATOM 84721 O WAT 8761 116.443 118.064 89.880 1.00 0.00 O ATOM 84722 H1 WAT 8761 115.919 118.127 89.081 1.00 0.00 H ATOM 84723 H2 WAT 8761 116.201 118.839 90.387 1.00 0.00 H TER 84725 WAT 8761 ATOM 84725 O WAT 8762 133.560 123.159 145.806 1.00 0.00 O ATOM 84726 H1 WAT 8762 132.716 122.914 146.187 1.00 0.00 H ATOM 84727 H2 WAT 8762 134.183 122.540 146.187 1.00 0.00 H TER 84729 WAT 8762 ATOM 84729 O WAT 8763 123.570 99.814 100.336 1.00 0.00 O ATOM 84730 H1 WAT 8763 123.368 99.865 101.271 1.00 0.00 H ATOM 84731 H2 WAT 8763 122.991 100.459 99.930 1.00 0.00 H TER 84733 WAT 8763 ATOM 84733 O WAT 8764 68.345 140.792 138.053 1.00 0.00 O ATOM 84734 H1 WAT 8764 67.664 140.355 137.542 1.00 0.00 H ATOM 84735 H2 WAT 8764 67.942 141.613 138.336 1.00 0.00 H TER 84737 WAT 8764 ATOM 84737 O WAT 8765 31.891 94.100 142.627 1.00 0.00 O ATOM 84738 H1 WAT 8765 32.023 95.032 142.451 1.00 0.00 H ATOM 84739 H2 WAT 8765 30.969 94.032 142.876 1.00 0.00 H TER 84741 WAT 8765 ATOM 84741 O WAT 8766 93.938 139.796 68.767 1.00 0.00 O ATOM 84742 H1 WAT 8766 93.434 140.530 68.416 1.00 0.00 H ATOM 84743 H2 WAT 8766 93.749 139.070 68.171 1.00 0.00 H TER 84745 WAT 8766 ATOM 84745 O WAT 8767 141.286 18.226 90.920 1.00 0.00 O ATOM 84746 H1 WAT 8767 142.212 18.468 90.952 1.00 0.00 H ATOM 84747 H2 WAT 8767 141.221 17.628 90.175 1.00 0.00 H TER 84749 WAT 8767 ATOM 84749 O WAT 8768 10.632 104.816 121.522 1.00 0.00 O ATOM 84750 H1 WAT 8768 11.062 103.961 121.552 1.00 0.00 H ATOM 84751 H2 WAT 8768 11.273 105.420 121.897 1.00 0.00 H TER 84753 WAT 8768 ATOM 84753 O WAT 8769 74.443 87.098 104.879 1.00 0.00 O ATOM 84754 H1 WAT 8769 75.377 86.950 104.728 1.00 0.00 H ATOM 84755 H2 WAT 8769 74.250 86.613 105.681 1.00 0.00 H TER 84757 WAT 8769 ATOM 84757 O WAT 8770 76.840 97.673 14.547 1.00 0.00 O ATOM 84758 H1 WAT 8770 76.528 98.577 14.551 1.00 0.00 H ATOM 84759 H2 WAT 8770 77.063 97.492 15.460 1.00 0.00 H TER 84761 WAT 8770 ATOM 84761 O WAT 8771 138.948 98.744 21.985 1.00 0.00 O ATOM 84762 H1 WAT 8771 139.627 99.375 22.223 1.00 0.00 H ATOM 84763 H2 WAT 8771 139.076 98.015 22.591 1.00 0.00 H TER 84765 WAT 8771 ATOM 84765 O WAT 8772 94.919 21.365 100.402 1.00 0.00 O ATOM 84766 H1 WAT 8772 95.180 20.445 100.378 1.00 0.00 H ATOM 84767 H2 WAT 8772 94.037 21.355 100.774 1.00 0.00 H TER 84769 WAT 8772 ATOM 84769 O WAT 8773 9.705 73.277 127.376 1.00 0.00 O ATOM 84770 H1 WAT 8773 9.395 73.762 128.141 1.00 0.00 H ATOM 84771 H2 WAT 8773 10.648 73.188 127.515 1.00 0.00 H TER 84773 WAT 8773 ATOM 84773 O WAT 8774 99.777 52.788 5.542 1.00 0.00 O ATOM 84774 H1 WAT 8774 98.928 52.910 5.967 1.00 0.00 H ATOM 84775 H2 WAT 8774 100.231 52.149 6.091 1.00 0.00 H TER 84777 WAT 8774 ATOM 84777 O WAT 8775 131.543 117.036 106.178 1.00 0.00 O ATOM 84778 H1 WAT 8775 132.151 117.583 105.680 1.00 0.00 H ATOM 84779 H2 WAT 8775 132.034 116.781 106.959 1.00 0.00 H TER 84781 WAT 8775 ATOM 84781 O WAT 8776 105.087 31.587 121.485 1.00 0.00 O ATOM 84782 H1 WAT 8776 105.325 30.722 121.152 1.00 0.00 H ATOM 84783 H2 WAT 8776 105.780 31.803 122.108 1.00 0.00 H TER 84785 WAT 8776 ATOM 84785 O WAT 8777 26.508 140.321 145.769 1.00 0.00 O ATOM 84786 H1 WAT 8777 26.771 140.560 144.880 1.00 0.00 H ATOM 84787 H2 WAT 8777 25.762 139.733 145.649 1.00 0.00 H TER 84789 WAT 8777 ATOM 84789 O WAT 8778 28.447 11.632 72.906 1.00 0.00 O ATOM 84790 H1 WAT 8778 28.803 10.866 73.357 1.00 0.00 H ATOM 84791 H2 WAT 8778 29.217 12.144 72.658 1.00 0.00 H TER 84793 WAT 8778 ATOM 84793 O WAT 8779 118.248 55.027 72.076 1.00 0.00 O ATOM 84794 H1 WAT 8779 118.444 55.943 71.879 1.00 0.00 H ATOM 84795 H2 WAT 8779 117.450 54.841 71.581 1.00 0.00 H TER 84797 WAT 8779 ATOM 84797 O WAT 8780 68.170 4.124 5.881 1.00 0.00 O ATOM 84798 H1 WAT 8780 67.487 4.143 6.551 1.00 0.00 H ATOM 84799 H2 WAT 8780 68.980 3.973 6.368 1.00 0.00 H TER 84801 WAT 8780 ATOM 84801 O WAT 8781 137.069 18.994 84.360 1.00 0.00 O ATOM 84802 H1 WAT 8781 136.167 18.883 84.058 1.00 0.00 H ATOM 84803 H2 WAT 8781 137.362 19.805 83.945 1.00 0.00 H TER 84805 WAT 8781 ATOM 84805 O WAT 8782 2.057 101.920 88.278 1.00 0.00 O ATOM 84806 H1 WAT 8782 1.279 101.367 88.211 1.00 0.00 H ATOM 84807 H2 WAT 8782 2.685 101.525 87.673 1.00 0.00 H TER 84809 WAT 8782 ATOM 84809 O WAT 8783 38.431 68.187 144.067 1.00 0.00 O ATOM 84810 H1 WAT 8783 39.144 67.757 143.595 1.00 0.00 H ATOM 84811 H2 WAT 8783 37.678 67.611 143.940 1.00 0.00 H TER 84813 WAT 8783 ATOM 84813 O WAT 8784 120.991 92.293 137.390 1.00 0.00 O ATOM 84814 H1 WAT 8784 121.012 92.855 136.615 1.00 0.00 H ATOM 84815 H2 WAT 8784 120.536 91.502 137.100 1.00 0.00 H TER 84817 WAT 8784 ATOM 84817 O WAT 8785 53.638 112.855 151.093 1.00 0.00 O ATOM 84818 H1 WAT 8785 53.523 113.533 151.759 1.00 0.00 H ATOM 84819 H2 WAT 8785 54.011 112.113 151.569 1.00 0.00 H TER 84821 WAT 8785 ATOM 84821 O WAT 8786 36.744 127.416 84.480 1.00 0.00 O ATOM 84822 H1 WAT 8786 36.239 128.229 84.451 1.00 0.00 H ATOM 84823 H2 WAT 8786 37.648 127.691 84.329 1.00 0.00 H TER 84825 WAT 8786 ATOM 84825 O WAT 8787 48.666 94.068 95.191 1.00 0.00 O ATOM 84826 H1 WAT 8787 49.074 93.353 95.680 1.00 0.00 H ATOM 84827 H2 WAT 8787 48.331 94.659 95.865 1.00 0.00 H TER 84829 WAT 8787 ATOM 84829 O WAT 8788 23.845 137.695 9.093 1.00 0.00 O ATOM 84830 H1 WAT 8788 23.936 137.884 8.159 1.00 0.00 H ATOM 84831 H2 WAT 8788 24.740 137.538 9.393 1.00 0.00 H TER 84833 WAT 8788 ATOM 84833 O WAT 8789 120.418 47.485 77.275 1.00 0.00 O ATOM 84834 H1 WAT 8789 121.077 48.178 77.245 1.00 0.00 H ATOM 84835 H2 WAT 8789 120.916 46.690 77.471 1.00 0.00 H TER 84837 WAT 8789 ATOM 84837 O WAT 8790 50.096 6.944 57.811 1.00 0.00 O ATOM 84838 H1 WAT 8790 49.214 6.581 57.898 1.00 0.00 H ATOM 84839 H2 WAT 8790 49.987 7.880 57.976 1.00 0.00 H TER 84841 WAT 8790 ATOM 84841 O WAT 8791 77.180 99.328 149.381 1.00 0.00 O ATOM 84842 H1 WAT 8791 78.047 99.580 149.698 1.00 0.00 H ATOM 84843 H2 WAT 8791 77.055 99.847 148.586 1.00 0.00 H TER 84845 WAT 8791 ATOM 84845 O WAT 8792 98.912 21.667 89.450 1.00 0.00 O ATOM 84846 H1 WAT 8792 99.004 20.767 89.762 1.00 0.00 H ATOM 84847 H2 WAT 8792 98.528 21.580 88.577 1.00 0.00 H TER 84849 WAT 8792 ATOM 84849 O WAT 8793 91.690 75.387 125.283 1.00 0.00 O ATOM 84850 H1 WAT 8793 92.230 75.814 124.619 1.00 0.00 H ATOM 84851 H2 WAT 8793 92.172 75.512 126.101 1.00 0.00 H TER 84853 WAT 8793 ATOM 84853 O WAT 8794 80.658 97.238 20.253 1.00 0.00 O ATOM 84854 H1 WAT 8794 80.664 97.729 21.075 1.00 0.00 H ATOM 84855 H2 WAT 8794 80.009 96.548 20.392 1.00 0.00 H TER 84857 WAT 8794 ATOM 84857 O WAT 8795 126.174 106.950 89.187 1.00 0.00 O ATOM 84858 H1 WAT 8795 125.531 106.406 88.733 1.00 0.00 H ATOM 84859 H2 WAT 8795 125.914 106.911 90.108 1.00 0.00 H TER 84861 WAT 8795 ATOM 84861 O WAT 8796 122.429 2.769 12.897 1.00 0.00 O ATOM 84862 H1 WAT 8796 121.713 2.648 13.521 1.00 0.00 H ATOM 84863 H2 WAT 8796 122.039 3.268 12.179 1.00 0.00 H TER 84865 WAT 8796 ATOM 84865 O WAT 8797 134.811 97.870 10.622 1.00 0.00 O ATOM 84866 H1 WAT 8797 134.532 97.736 9.716 1.00 0.00 H ATOM 84867 H2 WAT 8797 134.078 97.551 11.148 1.00 0.00 H TER 84869 WAT 8797 ATOM 84869 O WAT 8798 113.242 48.232 114.531 1.00 0.00 O ATOM 84870 H1 WAT 8798 112.954 48.638 113.713 1.00 0.00 H ATOM 84871 H2 WAT 8798 113.014 47.308 114.433 1.00 0.00 H TER 84873 WAT 8798 ATOM 84873 O WAT 8799 39.364 49.527 11.659 1.00 0.00 O ATOM 84874 H1 WAT 8799 40.125 49.971 11.286 1.00 0.00 H ATOM 84875 H2 WAT 8799 38.952 50.186 12.218 1.00 0.00 H TER 84877 WAT 8799 ATOM 84877 O WAT 8800 76.605 3.794 18.834 1.00 0.00 O ATOM 84878 H1 WAT 8800 77.530 3.921 18.623 1.00 0.00 H ATOM 84879 H2 WAT 8800 76.326 4.634 19.200 1.00 0.00 H TER 84881 WAT 8800 ATOM 84881 O WAT 8801 80.586 134.966 62.656 1.00 0.00 O ATOM 84882 H1 WAT 8801 80.196 134.834 63.520 1.00 0.00 H ATOM 84883 H2 WAT 8801 80.906 135.868 62.672 1.00 0.00 H TER 84885 WAT 8801 ATOM 84885 O WAT 8802 128.883 135.845 150.403 1.00 0.00 O ATOM 84886 H1 WAT 8802 128.087 135.444 150.054 1.00 0.00 H ATOM 84887 H2 WAT 8802 129.588 135.263 150.121 1.00 0.00 H TER 84889 WAT 8802 ATOM 84889 O WAT 8803 116.988 4.587 136.964 1.00 0.00 O ATOM 84890 H1 WAT 8803 116.218 4.972 136.545 1.00 0.00 H ATOM 84891 H2 WAT 8803 117.148 3.780 136.476 1.00 0.00 H TER 84893 WAT 8803 ATOM 84893 O WAT 8804 61.753 95.406 54.620 1.00 0.00 O ATOM 84894 H1 WAT 8804 62.251 96.220 54.695 1.00 0.00 H ATOM 84895 H2 WAT 8804 62.182 94.927 53.911 1.00 0.00 H TER 84897 WAT 8804 ATOM 84897 O WAT 8805 35.567 48.026 17.793 1.00 0.00 O ATOM 84898 H1 WAT 8805 35.542 47.980 18.749 1.00 0.00 H ATOM 84899 H2 WAT 8805 36.385 47.589 17.555 1.00 0.00 H TER 84901 WAT 8805 ATOM 84901 O WAT 8806 120.281 20.000 107.257 1.00 0.00 O ATOM 84902 H1 WAT 8806 120.818 20.782 107.128 1.00 0.00 H ATOM 84903 H2 WAT 8806 119.747 19.943 106.464 1.00 0.00 H TER 84905 WAT 8806 ATOM 84905 O WAT 8807 31.563 52.299 94.138 1.00 0.00 O ATOM 84906 H1 WAT 8807 32.033 52.957 93.626 1.00 0.00 H ATOM 84907 H2 WAT 8807 31.393 51.590 93.517 1.00 0.00 H TER 84909 WAT 8807 ATOM 84909 O WAT 8808 53.824 133.002 102.286 1.00 0.00 O ATOM 84910 H1 WAT 8808 53.009 132.710 101.879 1.00 0.00 H ATOM 84911 H2 WAT 8808 54.313 132.195 102.448 1.00 0.00 H TER 84913 WAT 8808 ATOM 84913 O WAT 8809 142.576 60.378 106.673 1.00 0.00 O ATOM 84914 H1 WAT 8809 142.915 59.828 105.967 1.00 0.00 H ATOM 84915 H2 WAT 8809 143.291 60.984 106.869 1.00 0.00 H TER 84917 WAT 8809 ATOM 84917 O WAT 8810 30.934 81.432 88.977 1.00 0.00 O ATOM 84918 H1 WAT 8810 30.145 81.754 89.414 1.00 0.00 H ATOM 84919 H2 WAT 8810 31.500 81.139 89.691 1.00 0.00 H TER 84921 WAT 8810 ATOM 84921 O WAT 8811 143.642 12.858 116.526 1.00 0.00 O ATOM 84922 H1 WAT 8811 143.848 11.925 116.466 1.00 0.00 H ATOM 84923 H2 WAT 8811 144.478 13.275 116.734 1.00 0.00 H TER 84925 WAT 8811 ATOM 84925 O WAT 8812 46.199 106.759 93.408 1.00 0.00 O ATOM 84926 H1 WAT 8812 46.402 105.925 92.984 1.00 0.00 H ATOM 84927 H2 WAT 8812 45.292 106.938 93.162 1.00 0.00 H TER 84929 WAT 8812 ATOM 84929 O WAT 8813 138.316 113.922 75.465 1.00 0.00 O ATOM 84930 H1 WAT 8813 138.607 113.030 75.653 1.00 0.00 H ATOM 84931 H2 WAT 8813 138.709 114.454 76.157 1.00 0.00 H TER 84933 WAT 8813 ATOM 84933 O WAT 8814 111.761 59.521 27.079 1.00 0.00 O ATOM 84934 H1 WAT 8814 111.512 60.344 27.500 1.00 0.00 H ATOM 84935 H2 WAT 8814 112.650 59.676 26.760 1.00 0.00 H TER 84937 WAT 8814 ATOM 84937 O WAT 8815 56.139 138.084 94.240 1.00 0.00 O ATOM 84938 H1 WAT 8815 55.609 138.859 94.054 1.00 0.00 H ATOM 84939 H2 WAT 8815 56.053 137.955 95.185 1.00 0.00 H TER 84941 WAT 8815 ATOM 84941 O WAT 8816 33.015 106.582 152.620 1.00 0.00 O ATOM 84942 H1 WAT 8816 33.820 106.872 153.049 1.00 0.00 H ATOM 84943 H2 WAT 8816 33.192 106.682 151.685 1.00 0.00 H TER 84945 WAT 8816 ATOM 84945 O WAT 8817 43.042 69.563 126.955 1.00 0.00 O ATOM 84946 H1 WAT 8817 42.251 69.499 127.490 1.00 0.00 H ATOM 84947 H2 WAT 8817 42.721 69.572 126.053 1.00 0.00 H TER 84949 WAT 8817 ATOM 84949 O WAT 8818 25.658 40.196 120.356 1.00 0.00 O ATOM 84950 H1 WAT 8818 24.852 40.642 120.616 1.00 0.00 H ATOM 84951 H2 WAT 8818 26.236 40.284 121.115 1.00 0.00 H TER 84953 WAT 8818 ATOM 84953 O WAT 8819 83.619 139.369 84.120 1.00 0.00 O ATOM 84954 H1 WAT 8819 83.857 138.988 83.275 1.00 0.00 H ATOM 84955 H2 WAT 8819 83.828 140.299 84.031 1.00 0.00 H TER 84957 WAT 8819 ATOM 84957 O WAT 8820 98.310 26.932 12.455 1.00 0.00 O ATOM 84958 H1 WAT 8820 99.245 27.113 12.556 1.00 0.00 H ATOM 84959 H2 WAT 8820 97.996 26.793 13.349 1.00 0.00 H TER 84961 WAT 8820 ATOM 84961 O WAT 8821 138.951 53.676 69.467 1.00 0.00 O ATOM 84962 H1 WAT 8821 138.450 53.329 68.729 1.00 0.00 H ATOM 84963 H2 WAT 8821 138.513 53.323 70.242 1.00 0.00 H TER 84965 WAT 8821 ATOM 84965 O WAT 8822 145.109 79.834 86.732 1.00 0.00 O ATOM 84966 H1 WAT 8822 145.169 80.594 86.152 1.00 0.00 H ATOM 84967 H2 WAT 8822 144.289 79.962 87.209 1.00 0.00 H TER 84969 WAT 8822 ATOM 84969 O WAT 8823 116.461 3.465 70.723 1.00 0.00 O ATOM 84970 H1 WAT 8823 116.059 2.634 70.974 1.00 0.00 H ATOM 84971 H2 WAT 8823 116.083 4.106 71.326 1.00 0.00 H TER 84973 WAT 8823 ATOM 84973 O WAT 8824 64.295 128.128 154.481 1.00 0.00 O ATOM 84974 H1 WAT 8824 64.845 128.709 153.956 1.00 0.00 H ATOM 84975 H2 WAT 8824 64.293 127.301 153.999 1.00 0.00 H TER 84977 WAT 8824 ATOM 84977 O WAT 8825 18.183 35.857 14.079 1.00 0.00 O ATOM 84978 H1 WAT 8825 17.789 36.327 13.344 1.00 0.00 H ATOM 84979 H2 WAT 8825 18.669 35.139 13.672 1.00 0.00 H TER 84981 WAT 8825 ATOM 84981 O WAT 8826 138.046 6.007 89.642 1.00 0.00 O ATOM 84982 H1 WAT 8826 138.698 5.367 89.928 1.00 0.00 H ATOM 84983 H2 WAT 8826 137.652 6.327 90.453 1.00 0.00 H TER 84985 WAT 8826 ATOM 84985 O WAT 8827 69.421 71.068 131.410 1.00 0.00 O ATOM 84986 H1 WAT 8827 68.884 70.275 131.408 1.00 0.00 H ATOM 84987 H2 WAT 8827 69.660 71.197 130.492 1.00 0.00 H TER 84989 WAT 8827 ATOM 84989 O WAT 8828 44.755 36.454 9.137 1.00 0.00 O ATOM 84990 H1 WAT 8828 45.392 37.160 9.030 1.00 0.00 H ATOM 84991 H2 WAT 8828 43.966 36.776 8.702 1.00 0.00 H TER 84993 WAT 8828 ATOM 84993 O WAT 8829 38.700 82.269 145.434 1.00 0.00 O ATOM 84994 H1 WAT 8829 38.277 81.415 145.516 1.00 0.00 H ATOM 84995 H2 WAT 8829 38.655 82.470 144.499 1.00 0.00 H TER 84997 WAT 8829 ATOM 84997 O WAT 8830 93.796 2.827 130.091 1.00 0.00 O ATOM 84998 H1 WAT 8830 93.454 2.111 129.556 1.00 0.00 H ATOM 84999 H2 WAT 8830 93.242 3.576 129.871 1.00 0.00 H TER 85001 WAT 8830 ATOM 85001 O WAT 8831 140.290 45.568 125.005 1.00 0.00 O ATOM 85002 H1 WAT 8831 139.387 45.810 125.213 1.00 0.00 H ATOM 85003 H2 WAT 8831 140.391 44.688 125.366 1.00 0.00 H TER 85005 WAT 8831 ATOM 85005 O WAT 8832 57.227 49.717 145.860 1.00 0.00 O ATOM 85006 H1 WAT 8832 56.599 48.999 145.940 1.00 0.00 H ATOM 85007 H2 WAT 8832 57.485 49.708 144.938 1.00 0.00 H TER 85009 WAT 8832 ATOM 85009 O WAT 8833 38.681 29.883 141.706 1.00 0.00 O ATOM 85010 H1 WAT 8833 38.026 30.490 142.050 1.00 0.00 H ATOM 85011 H2 WAT 8833 39.102 29.519 142.485 1.00 0.00 H TER 85013 WAT 8833 ATOM 85013 O WAT 8834 141.323 16.653 140.428 1.00 0.00 O ATOM 85014 H1 WAT 8834 141.234 17.454 139.912 1.00 0.00 H ATOM 85015 H2 WAT 8834 141.532 16.958 141.310 1.00 0.00 H TER 85017 WAT 8834 ATOM 85017 O WAT 8835 104.222 78.013 70.213 1.00 0.00 O ATOM 85018 H1 WAT 8835 104.576 78.233 71.075 1.00 0.00 H ATOM 85019 H2 WAT 8835 104.327 78.814 69.700 1.00 0.00 H TER 85021 WAT 8835 ATOM 85021 O WAT 8836 42.237 38.819 67.123 1.00 0.00 O ATOM 85022 H1 WAT 8836 42.934 39.430 67.359 1.00 0.00 H ATOM 85023 H2 WAT 8836 42.183 38.217 67.865 1.00 0.00 H TER 85025 WAT 8836 ATOM 85025 O WAT 8837 92.644 19.480 9.821 1.00 0.00 O ATOM 85026 H1 WAT 8837 91.789 19.270 9.445 1.00 0.00 H ATOM 85027 H2 WAT 8837 92.474 20.216 10.408 1.00 0.00 H TER 85029 WAT 8837 ATOM 85029 O WAT 8838 48.641 43.542 140.676 1.00 0.00 O ATOM 85030 H1 WAT 8838 48.417 42.862 140.041 1.00 0.00 H ATOM 85031 H2 WAT 8838 48.183 44.323 140.363 1.00 0.00 H TER 85033 WAT 8838 ATOM 85033 O WAT 8839 96.204 101.680 63.671 1.00 0.00 O ATOM 85034 H1 WAT 8839 95.742 101.292 62.928 1.00 0.00 H ATOM 85035 H2 WAT 8839 96.597 102.478 63.319 1.00 0.00 H TER 85037 WAT 8839 ATOM 85037 O WAT 8840 30.823 32.448 2.015 1.00 0.00 O ATOM 85038 H1 WAT 8840 31.646 31.964 2.078 1.00 0.00 H ATOM 85039 H2 WAT 8840 31.075 33.365 2.125 1.00 0.00 H TER 85041 WAT 8840 ATOM 85041 O WAT 8841 2.280 24.235 74.407 1.00 0.00 O ATOM 85042 H1 WAT 8841 2.728 23.415 74.199 1.00 0.00 H ATOM 85043 H2 WAT 8841 1.595 23.982 75.027 1.00 0.00 H TER 85045 WAT 8841 ATOM 85045 O WAT 8842 94.372 17.284 2.643 1.00 0.00 O ATOM 85046 H1 WAT 8842 94.973 16.542 2.574 1.00 0.00 H ATOM 85047 H2 WAT 8842 93.510 16.884 2.763 1.00 0.00 H TER 85049 WAT 8842 ATOM 85049 O WAT 8843 91.841 67.306 6.199 1.00 0.00 O ATOM 85050 H1 WAT 8843 92.296 67.752 5.485 1.00 0.00 H ATOM 85051 H2 WAT 8843 90.930 67.588 6.115 1.00 0.00 H TER 85053 WAT 8843 ATOM 85053 O WAT 8844 142.914 143.261 93.058 1.00 0.00 O ATOM 85054 H1 WAT 8844 143.552 143.745 92.534 1.00 0.00 H ATOM 85055 H2 WAT 8844 142.613 143.893 93.711 1.00 0.00 H TER 85057 WAT 8844 ATOM 85057 O WAT 8845 79.419 94.386 98.485 1.00 0.00 O ATOM 85058 H1 WAT 8845 79.279 94.988 97.755 1.00 0.00 H ATOM 85059 H2 WAT 8845 78.653 93.812 98.473 1.00 0.00 H TER 85061 WAT 8845 ATOM 85061 O WAT 8846 34.052 59.770 118.655 1.00 0.00 O ATOM 85062 H1 WAT 8846 34.878 59.698 118.177 1.00 0.00 H ATOM 85063 H2 WAT 8846 33.720 60.638 118.430 1.00 0.00 H TER 85065 WAT 8846 ATOM 85065 O WAT 8847 131.485 100.076 78.555 1.00 0.00 O ATOM 85066 H1 WAT 8847 132.162 99.572 78.103 1.00 0.00 H ATOM 85067 H2 WAT 8847 131.962 100.788 78.981 1.00 0.00 H TER 85069 WAT 8847 ATOM 85069 O WAT 8848 91.037 87.147 61.573 1.00 0.00 O ATOM 85070 H1 WAT 8848 91.089 87.605 60.734 1.00 0.00 H ATOM 85071 H2 WAT 8848 90.742 86.265 61.346 1.00 0.00 H TER 85073 WAT 8848 ATOM 85073 O WAT 8849 24.953 140.440 9.943 1.00 0.00 O ATOM 85074 H1 WAT 8849 24.354 139.724 9.733 1.00 0.00 H ATOM 85075 H2 WAT 8849 25.440 140.589 9.132 1.00 0.00 H TER 85077 WAT 8849 ATOM 85077 O WAT 8850 5.678 19.257 69.048 1.00 0.00 O ATOM 85078 H1 WAT 8850 6.159 19.530 68.267 1.00 0.00 H ATOM 85079 H2 WAT 8850 4.995 18.674 68.716 1.00 0.00 H TER 85081 WAT 8850 ATOM 85081 O WAT 8851 33.677 102.137 70.956 1.00 0.00 O ATOM 85082 H1 WAT 8851 33.737 101.275 70.544 1.00 0.00 H ATOM 85083 H2 WAT 8851 34.587 102.409 71.076 1.00 0.00 H TER 85085 WAT 8851 ATOM 85085 O WAT 8852 112.507 24.326 65.181 1.00 0.00 O ATOM 85086 H1 WAT 8852 112.836 23.893 65.968 1.00 0.00 H ATOM 85087 H2 WAT 8852 111.771 23.782 64.899 1.00 0.00 H TER 85089 WAT 8852 ATOM 85089 O WAT 8853 131.537 35.926 67.176 1.00 0.00 O ATOM 85090 H1 WAT 8853 131.810 35.254 67.800 1.00 0.00 H ATOM 85091 H2 WAT 8853 130.639 36.139 67.430 1.00 0.00 H TER 85093 WAT 8853 ATOM 85093 O WAT 8854 6.192 26.219 60.853 1.00 0.00 O ATOM 85094 H1 WAT 8854 5.853 26.977 60.377 1.00 0.00 H ATOM 85095 H2 WAT 8854 6.744 25.765 60.217 1.00 0.00 H TER 85097 WAT 8854 ATOM 85097 O WAT 8855 2.661 70.440 74.163 1.00 0.00 O ATOM 85098 H1 WAT 8855 2.783 69.568 73.788 1.00 0.00 H ATOM 85099 H2 WAT 8855 2.981 71.038 73.488 1.00 0.00 H TER 85101 WAT 8855 ATOM 85101 O WAT 8856 16.062 46.670 101.604 1.00 0.00 O ATOM 85102 H1 WAT 8856 15.171 46.349 101.745 1.00 0.00 H ATOM 85103 H2 WAT 8856 16.601 45.879 101.585 1.00 0.00 H TER 85105 WAT 8856 ATOM 85105 O WAT 8857 130.494 117.977 131.921 1.00 0.00 O ATOM 85106 H1 WAT 8857 131.076 117.259 132.171 1.00 0.00 H ATOM 85107 H2 WAT 8857 130.939 118.765 132.233 1.00 0.00 H TER 85109 WAT 8857 ATOM 85109 O WAT 8858 14.348 121.360 145.771 1.00 0.00 O ATOM 85110 H1 WAT 8858 14.783 121.724 144.999 1.00 0.00 H ATOM 85111 H2 WAT 8858 14.874 121.668 146.509 1.00 0.00 H TER 85113 WAT 8858 ATOM 85113 O WAT 8859 122.543 143.123 59.651 1.00 0.00 O ATOM 85114 H1 WAT 8859 122.691 142.269 60.057 1.00 0.00 H ATOM 85115 H2 WAT 8859 121.698 143.409 59.998 1.00 0.00 H TER 85117 WAT 8859 ATOM 85117 O WAT 8860 126.130 118.686 115.451 1.00 0.00 O ATOM 85118 H1 WAT 8860 126.907 118.799 114.904 1.00 0.00 H ATOM 85119 H2 WAT 8860 126.469 118.358 116.284 1.00 0.00 H TER 85121 WAT 8860 ATOM 85121 O WAT 8861 35.539 66.021 158.125 1.00 0.00 O ATOM 85122 H1 WAT 8861 36.462 66.237 157.994 1.00 0.00 H ATOM 85123 H2 WAT 8861 35.546 65.338 158.795 1.00 0.00 H TER 85125 WAT 8861 ATOM 85125 O WAT 8862 24.382 72.743 12.204 1.00 0.00 O ATOM 85126 H1 WAT 8862 24.406 72.731 11.247 1.00 0.00 H ATOM 85127 H2 WAT 8862 24.681 71.872 12.462 1.00 0.00 H TER 85129 WAT 8862 ATOM 85129 O WAT 8863 10.789 63.250 0.600 1.00 0.00 O ATOM 85130 H1 WAT 8863 9.913 62.922 0.397 1.00 0.00 H ATOM 85131 H2 WAT 8863 10.832 64.102 0.166 1.00 0.00 H TER 85133 WAT 8863 ATOM 85133 O WAT 8864 83.346 52.760 117.103 1.00 0.00 O ATOM 85134 H1 WAT 8864 83.468 53.062 116.203 1.00 0.00 H ATOM 85135 H2 WAT 8864 83.200 53.561 117.607 1.00 0.00 H TER 85137 WAT 8864 ATOM 85137 O WAT 8865 50.733 65.083 0.947 1.00 0.00 O ATOM 85138 H1 WAT 8865 51.222 65.378 1.715 1.00 0.00 H ATOM 85139 H2 WAT 8865 51.406 64.807 0.325 1.00 0.00 H TER 85141 WAT 8865 ATOM 85141 O WAT 8866 72.159 25.178 52.991 1.00 0.00 O ATOM 85142 H1 WAT 8866 72.775 24.540 53.351 1.00 0.00 H ATOM 85143 H2 WAT 8866 71.586 25.398 53.726 1.00 0.00 H TER 85145 WAT 8866 ATOM 85145 O WAT 8867 109.387 107.973 13.200 1.00 0.00 O ATOM 85146 H1 WAT 8867 110.020 107.272 13.041 1.00 0.00 H ATOM 85147 H2 WAT 8867 109.924 108.749 13.361 1.00 0.00 H TER 85149 WAT 8867 ATOM 85149 O WAT 8868 38.123 111.441 58.735 1.00 0.00 O ATOM 85150 H1 WAT 8868 38.487 112.122 58.170 1.00 0.00 H ATOM 85151 H2 WAT 8868 37.208 111.368 58.463 1.00 0.00 H TER 85153 WAT 8868 ATOM 85153 O WAT 8869 73.915 107.806 135.040 1.00 0.00 O ATOM 85154 H1 WAT 8869 73.087 108.113 134.670 1.00 0.00 H ATOM 85155 H2 WAT 8869 74.586 108.192 134.477 1.00 0.00 H TER 85157 WAT 8869 ATOM 85157 O WAT 8870 81.144 62.181 94.778 1.00 0.00 O ATOM 85158 H1 WAT 8870 80.305 61.898 95.142 1.00 0.00 H ATOM 85159 H2 WAT 8870 81.221 61.701 93.954 1.00 0.00 H TER 85161 WAT 8870 ATOM 85161 O WAT 8871 96.628 107.186 19.348 1.00 0.00 O ATOM 85162 H1 WAT 8871 97.439 107.642 19.121 1.00 0.00 H ATOM 85163 H2 WAT 8871 96.087 107.855 19.769 1.00 0.00 H TER 85165 WAT 8871 ATOM 85165 O WAT 8872 55.445 114.765 158.271 1.00 0.00 O ATOM 85166 H1 WAT 8872 56.140 114.741 157.613 1.00 0.00 H ATOM 85167 H2 WAT 8872 54.695 114.355 157.842 1.00 0.00 H TER 85169 WAT 8872 ATOM 85169 O WAT 8873 115.825 108.303 70.434 1.00 0.00 O ATOM 85170 H1 WAT 8873 116.096 107.426 70.162 1.00 0.00 H ATOM 85171 H2 WAT 8873 116.002 108.855 69.672 1.00 0.00 H TER 85173 WAT 8873 ATOM 85173 O WAT 8874 61.867 78.479 84.864 1.00 0.00 O ATOM 85174 H1 WAT 8874 62.065 79.392 85.076 1.00 0.00 H ATOM 85175 H2 WAT 8874 61.549 78.106 85.686 1.00 0.00 H TER 85177 WAT 8874 ATOM 85177 O WAT 8875 42.693 79.460 149.580 1.00 0.00 O ATOM 85178 H1 WAT 8875 43.022 79.291 148.697 1.00 0.00 H ATOM 85179 H2 WAT 8875 41.763 79.235 149.536 1.00 0.00 H TER 85181 WAT 8875 ATOM 85181 O WAT 8876 77.510 15.679 18.706 1.00 0.00 O ATOM 85182 H1 WAT 8876 76.741 15.357 19.175 1.00 0.00 H ATOM 85183 H2 WAT 8876 78.241 15.182 19.076 1.00 0.00 H TER 85185 WAT 8876 ATOM 85185 O WAT 8877 69.355 26.268 121.121 1.00 0.00 O ATOM 85186 H1 WAT 8877 68.966 27.137 121.026 1.00 0.00 H ATOM 85187 H2 WAT 8877 68.798 25.697 120.591 1.00 0.00 H TER 85189 WAT 8877 ATOM 85189 O WAT 8878 86.119 25.397 76.968 1.00 0.00 O ATOM 85190 H1 WAT 8878 86.533 26.222 76.714 1.00 0.00 H ATOM 85191 H2 WAT 8878 85.370 25.659 77.503 1.00 0.00 H TER 85193 WAT 8878 ATOM 85193 O WAT 8879 89.751 83.515 129.633 1.00 0.00 O ATOM 85194 H1 WAT 8879 89.456 83.773 130.506 1.00 0.00 H ATOM 85195 H2 WAT 8879 90.392 82.822 129.792 1.00 0.00 H TER 85197 WAT 8879 ATOM 85197 O WAT 8880 102.731 52.277 117.310 1.00 0.00 O ATOM 85198 H1 WAT 8880 103.581 52.177 116.882 1.00 0.00 H ATOM 85199 H2 WAT 8880 102.452 51.382 117.501 1.00 0.00 H TER 85201 WAT 8880 ATOM 85201 O WAT 8881 1.575 23.957 99.371 1.00 0.00 O ATOM 85202 H1 WAT 8881 0.738 23.588 99.654 1.00 0.00 H ATOM 85203 H2 WAT 8881 2.215 23.271 99.559 1.00 0.00 H TER 85205 WAT 8881 ATOM 85205 O WAT 8882 130.459 87.428 84.930 1.00 0.00 O ATOM 85206 H1 WAT 8882 129.837 87.239 85.633 1.00 0.00 H ATOM 85207 H2 WAT 8882 129.960 87.949 84.302 1.00 0.00 H TER 85209 WAT 8882 ATOM 85209 O WAT 8883 131.144 141.857 75.122 1.00 0.00 O ATOM 85210 H1 WAT 8883 131.840 142.422 74.788 1.00 0.00 H ATOM 85211 H2 WAT 8883 131.422 141.634 76.010 1.00 0.00 H TER 85213 WAT 8883 ATOM 85213 O WAT 8884 15.658 141.244 130.182 1.00 0.00 O ATOM 85214 H1 WAT 8884 14.774 141.289 130.546 1.00 0.00 H ATOM 85215 H2 WAT 8884 16.219 141.599 130.872 1.00 0.00 H TER 85217 WAT 8884 ATOM 85217 O WAT 8885 144.429 57.690 10.969 1.00 0.00 O ATOM 85218 H1 WAT 8885 144.517 58.638 11.068 1.00 0.00 H ATOM 85219 H2 WAT 8885 143.496 57.521 11.099 1.00 0.00 H TER 85221 WAT 8885 ATOM 85221 O WAT 8886 44.331 119.579 13.195 1.00 0.00 O ATOM 85222 H1 WAT 8886 44.893 119.987 13.854 1.00 0.00 H ATOM 85223 H2 WAT 8886 43.742 120.279 12.915 1.00 0.00 H TER 85225 WAT 8886 ATOM 85225 O WAT 8887 65.055 101.048 68.512 1.00 0.00 O ATOM 85226 H1 WAT 8887 64.368 100.558 68.059 1.00 0.00 H ATOM 85227 H2 WAT 8887 65.130 100.620 69.366 1.00 0.00 H TER 85229 WAT 8887 ATOM 85229 O WAT 8888 81.119 43.681 89.001 1.00 0.00 O ATOM 85230 H1 WAT 8888 80.701 43.149 88.324 1.00 0.00 H ATOM 85231 H2 WAT 8888 80.521 44.417 89.130 1.00 0.00 H TER 85233 WAT 8888 ATOM 85233 O WAT 8889 37.307 111.301 136.001 1.00 0.00 O ATOM 85234 H1 WAT 8889 36.467 110.843 136.031 1.00 0.00 H ATOM 85235 H2 WAT 8889 37.215 112.012 136.636 1.00 0.00 H TER 85237 WAT 8889 ATOM 85237 O WAT 8890 26.882 65.573 148.022 1.00 0.00 O ATOM 85238 H1 WAT 8890 27.278 66.434 147.887 1.00 0.00 H ATOM 85239 H2 WAT 8890 25.966 65.688 147.767 1.00 0.00 H TER 85241 WAT 8890 ATOM 85241 O WAT 8891 17.428 102.210 14.536 1.00 0.00 O ATOM 85242 H1 WAT 8891 17.480 102.942 15.151 1.00 0.00 H ATOM 85243 H2 WAT 8891 16.831 101.589 14.953 1.00 0.00 H TER 85245 WAT 8891 ATOM 85245 O WAT 8892 35.687 106.100 83.022 1.00 0.00 O ATOM 85246 H1 WAT 8892 36.031 106.344 82.162 1.00 0.00 H ATOM 85247 H2 WAT 8892 35.874 106.856 83.578 1.00 0.00 H TER 85249 WAT 8892 ATOM 85249 O WAT 8893 76.668 30.502 109.828 1.00 0.00 O ATOM 85250 H1 WAT 8893 76.660 31.087 109.070 1.00 0.00 H ATOM 85251 H2 WAT 8893 77.281 29.807 109.589 1.00 0.00 H TER 85253 WAT 8893 ATOM 85253 O WAT 8894 26.805 140.384 7.977 1.00 0.00 O ATOM 85254 H1 WAT 8894 27.428 140.161 7.286 1.00 0.00 H ATOM 85255 H2 WAT 8894 27.058 141.266 8.252 1.00 0.00 H TER 85257 WAT 8894 ATOM 85257 O WAT 8895 15.529 113.503 94.066 1.00 0.00 O ATOM 85258 H1 WAT 8895 14.888 113.629 93.367 1.00 0.00 H ATOM 85259 H2 WAT 8895 15.804 114.390 94.301 1.00 0.00 H TER 85261 WAT 8895 ATOM 85261 O WAT 8896 119.993 19.134 150.242 1.00 0.00 O ATOM 85262 H1 WAT 8896 120.540 19.575 149.592 1.00 0.00 H ATOM 85263 H2 WAT 8896 119.493 18.493 149.738 1.00 0.00 H TER 85265 WAT 8896 ATOM 85265 O WAT 8897 142.551 11.410 97.376 1.00 0.00 O ATOM 85266 H1 WAT 8897 141.732 11.010 97.086 1.00 0.00 H ATOM 85267 H2 WAT 8897 142.558 11.281 98.325 1.00 0.00 H TER 85269 WAT 8897 ATOM 85269 O WAT 8898 39.766 44.456 138.647 1.00 0.00 O ATOM 85270 H1 WAT 8898 39.488 43.605 138.308 1.00 0.00 H ATOM 85271 H2 WAT 8898 39.767 44.347 139.598 1.00 0.00 H TER 85273 WAT 8898 ATOM 85273 O WAT 8899 107.697 46.260 60.382 1.00 0.00 O ATOM 85274 H1 WAT 8899 107.027 45.586 60.267 1.00 0.00 H ATOM 85275 H2 WAT 8899 107.282 46.917 60.942 1.00 0.00 H TER 85277 WAT 8899 ATOM 85277 O WAT 8900 15.309 133.881 70.968 1.00 0.00 O ATOM 85278 H1 WAT 8900 15.872 134.327 71.600 1.00 0.00 H ATOM 85279 H2 WAT 8900 14.909 134.588 70.462 1.00 0.00 H TER 85281 WAT 8900 ATOM 85281 O WAT 8901 44.804 38.582 73.694 1.00 0.00 O ATOM 85282 H1 WAT 8901 44.012 38.320 73.224 1.00 0.00 H ATOM 85283 H2 WAT 8901 45.470 37.958 73.407 1.00 0.00 H TER 85285 WAT 8901 ATOM 85285 O WAT 8902 95.451 126.255 75.939 1.00 0.00 O ATOM 85286 H1 WAT 8902 96.003 125.580 75.544 1.00 0.00 H ATOM 85287 H2 WAT 8902 96.015 126.675 76.589 1.00 0.00 H TER 85289 WAT 8902 ATOM 85289 O WAT 8903 58.544 144.538 97.910 1.00 0.00 O ATOM 85290 H1 WAT 8903 58.317 145.193 98.569 1.00 0.00 H ATOM 85291 H2 WAT 8903 58.513 143.705 98.380 1.00 0.00 H TER 85293 WAT 8903 ATOM 85293 O WAT 8904 72.800 88.949 66.282 1.00 0.00 O ATOM 85294 H1 WAT 8904 73.713 88.692 66.414 1.00 0.00 H ATOM 85295 H2 WAT 8904 72.831 89.583 65.566 1.00 0.00 H TER 85297 WAT 8904 ATOM 85297 O WAT 8905 113.100 88.487 94.041 1.00 0.00 O ATOM 85298 H1 WAT 8905 113.560 88.735 94.843 1.00 0.00 H ATOM 85299 H2 WAT 8905 112.218 88.256 94.332 1.00 0.00 H TER 85301 WAT 8905 ATOM 85301 O WAT 8906 12.350 124.777 133.518 1.00 0.00 O ATOM 85302 H1 WAT 8906 13.305 124.777 133.454 1.00 0.00 H ATOM 85303 H2 WAT 8906 12.127 125.672 133.771 1.00 0.00 H TER 85305 WAT 8906 ATOM 85305 O WAT 8907 92.251 21.277 87.320 1.00 0.00 O ATOM 85306 H1 WAT 8907 93.197 21.180 87.426 1.00 0.00 H ATOM 85307 H2 WAT 8907 91.893 21.099 88.190 1.00 0.00 H TER 85309 WAT 8907 ATOM 85309 O WAT 8908 78.356 23.730 0.791 1.00 0.00 O ATOM 85310 H1 WAT 8908 77.812 23.757 0.004 1.00 0.00 H ATOM 85311 H2 WAT 8908 77.871 23.171 1.399 1.00 0.00 H TER 85313 WAT 8908 ATOM 85313 O WAT 8909 142.444 4.019 130.881 1.00 0.00 O ATOM 85314 H1 WAT 8909 141.517 3.946 130.654 1.00 0.00 H ATOM 85315 H2 WAT 8909 142.859 3.283 130.431 1.00 0.00 H TER 85317 WAT 8909 ATOM 85317 O WAT 8910 78.495 95.949 138.835 1.00 0.00 O ATOM 85318 H1 WAT 8910 79.119 96.454 139.357 1.00 0.00 H ATOM 85319 H2 WAT 8910 77.981 95.463 139.481 1.00 0.00 H TER 85321 WAT 8910 ATOM 85321 O WAT 8911 145.250 136.919 98.433 1.00 0.00 O ATOM 85322 H1 WAT 8911 144.814 137.061 99.274 1.00 0.00 H ATOM 85323 H2 WAT 8911 144.550 136.634 97.846 1.00 0.00 H TER 85325 WAT 8911 ATOM 85325 O WAT 8912 16.027 87.138 78.020 1.00 0.00 O ATOM 85326 H1 WAT 8912 16.067 88.090 77.935 1.00 0.00 H ATOM 85327 H2 WAT 8912 15.854 86.825 77.132 1.00 0.00 H TER 85329 WAT 8912 ATOM 85329 O WAT 8913 132.794 60.276 126.540 1.00 0.00 O ATOM 85330 H1 WAT 8913 132.205 59.699 127.026 1.00 0.00 H ATOM 85331 H2 WAT 8913 132.248 60.646 125.846 1.00 0.00 H TER 85333 WAT 8913 ATOM 85333 O WAT 8914 95.968 119.772 22.431 1.00 0.00 O ATOM 85334 H1 WAT 8914 96.342 118.894 22.511 1.00 0.00 H ATOM 85335 H2 WAT 8914 95.270 119.796 23.085 1.00 0.00 H TER 85337 WAT 8914 ATOM 85337 O WAT 8915 114.584 54.345 98.343 1.00 0.00 O ATOM 85338 H1 WAT 8915 114.560 53.539 98.858 1.00 0.00 H ATOM 85339 H2 WAT 8915 115.418 54.753 98.576 1.00 0.00 H TER 85341 WAT 8915 ATOM 85341 O WAT 8916 33.519 54.563 93.153 1.00 0.00 O ATOM 85342 H1 WAT 8916 32.638 54.929 93.072 1.00 0.00 H ATOM 85343 H2 WAT 8916 33.538 53.841 92.526 1.00 0.00 H TER 85345 WAT 8916 ATOM 85345 O WAT 8917 115.914 99.947 122.954 1.00 0.00 O ATOM 85346 H1 WAT 8917 115.491 100.510 123.602 1.00 0.00 H ATOM 85347 H2 WAT 8917 116.253 100.553 122.295 1.00 0.00 H TER 85349 WAT 8917 ATOM 85349 O WAT 8918 99.732 97.279 28.120 1.00 0.00 O ATOM 85350 H1 WAT 8918 98.940 96.774 27.939 1.00 0.00 H ATOM 85351 H2 WAT 8918 99.949 97.693 27.284 1.00 0.00 H TER 85353 WAT 8918 ATOM 85353 O WAT 8919 57.849 134.223 8.471 1.00 0.00 O ATOM 85354 H1 WAT 8919 57.806 133.278 8.327 1.00 0.00 H ATOM 85355 H2 WAT 8919 57.451 134.353 9.331 1.00 0.00 H TER 85357 WAT 8919 ATOM 85357 O WAT 8920 125.458 72.788 109.352 1.00 0.00 O ATOM 85358 H1 WAT 8920 124.629 73.267 109.377 1.00 0.00 H ATOM 85359 H2 WAT 8920 125.457 72.353 108.499 1.00 0.00 H TER 85361 WAT 8920 ATOM 85361 O WAT 8921 117.379 60.773 155.114 1.00 0.00 O ATOM 85362 H1 WAT 8921 117.768 61.541 155.531 1.00 0.00 H ATOM 85363 H2 WAT 8921 118.040 60.087 155.210 1.00 0.00 H TER 85365 WAT 8921 ATOM 85365 O WAT 8922 83.457 104.610 78.895 1.00 0.00 O ATOM 85366 H1 WAT 8922 83.356 104.634 77.944 1.00 0.00 H ATOM 85367 H2 WAT 8922 83.931 103.796 79.065 1.00 0.00 H TER 85369 WAT 8922 ATOM 85369 O WAT 8923 63.697 123.063 148.248 1.00 0.00 O ATOM 85370 H1 WAT 8923 64.034 123.715 147.634 1.00 0.00 H ATOM 85371 H2 WAT 8923 64.470 122.758 148.723 1.00 0.00 H TER 85373 WAT 8923 ATOM 85373 O WAT 8924 14.663 126.767 95.959 1.00 0.00 O ATOM 85374 H1 WAT 8924 15.252 126.767 95.205 1.00 0.00 H ATOM 85375 H2 WAT 8924 14.064 127.496 95.795 1.00 0.00 H TER 85377 WAT 8924 ATOM 85377 O WAT 8925 51.073 145.843 123.779 1.00 0.00 O ATOM 85378 H1 WAT 8925 51.382 146.250 124.588 1.00 0.00 H ATOM 85379 H2 WAT 8925 51.743 145.194 123.566 1.00 0.00 H TER 85381 WAT 8925 ATOM 85381 O WAT 8926 54.393 3.758 136.866 1.00 0.00 O ATOM 85382 H1 WAT 8926 55.212 3.901 136.393 1.00 0.00 H ATOM 85383 H2 WAT 8926 54.666 3.469 137.737 1.00 0.00 H TER 85385 WAT 8926 ATOM 85385 O WAT 8927 138.528 25.078 86.966 1.00 0.00 O ATOM 85386 H1 WAT 8927 137.988 25.655 87.507 1.00 0.00 H ATOM 85387 H2 WAT 8927 138.575 24.260 87.461 1.00 0.00 H TER 85389 WAT 8927 ATOM 85389 O WAT 8928 45.321 85.327 13.326 1.00 0.00 O ATOM 85390 H1 WAT 8928 46.184 84.921 13.238 1.00 0.00 H ATOM 85391 H2 WAT 8928 45.411 85.921 14.071 1.00 0.00 H TER 85393 WAT 8928 ATOM 85393 O WAT 8929 139.745 42.455 -0.158 1.00 0.00 O ATOM 85394 H1 WAT 8929 140.622 42.812 -0.017 1.00 0.00 H ATOM 85395 H2 WAT 8929 139.436 42.226 0.718 1.00 0.00 H TER 85397 WAT 8929 ATOM 85397 O WAT 8930 39.787 99.723 0.946 1.00 0.00 O ATOM 85398 H1 WAT 8930 40.178 100.379 0.369 1.00 0.00 H ATOM 85399 H2 WAT 8930 39.046 99.378 0.448 1.00 0.00 H TER 85401 WAT 8930 ATOM 85401 O WAT 8931 115.592 10.274 56.826 1.00 0.00 O ATOM 85402 H1 WAT 8931 115.708 11.016 56.232 1.00 0.00 H ATOM 85403 H2 WAT 8931 116.472 9.911 56.929 1.00 0.00 H TER 85405 WAT 8931 ATOM 85405 O WAT 8932 3.443 42.408 142.132 1.00 0.00 O ATOM 85406 H1 WAT 8932 3.387 43.356 142.254 1.00 0.00 H ATOM 85407 H2 WAT 8932 3.114 42.261 141.245 1.00 0.00 H TER 85409 WAT 8932 ATOM 85409 O WAT 8933 115.605 87.605 98.670 1.00 0.00 O ATOM 85410 H1 WAT 8933 115.056 86.974 99.135 1.00 0.00 H ATOM 85411 H2 WAT 8933 116.203 87.066 98.152 1.00 0.00 H TER 85413 WAT 8933 ATOM 85413 O WAT 8934 24.872 125.148 130.688 1.00 0.00 O ATOM 85414 H1 WAT 8934 25.418 125.902 130.464 1.00 0.00 H ATOM 85415 H2 WAT 8934 24.848 125.146 131.645 1.00 0.00 H TER 85417 WAT 8934 ATOM 85417 O WAT 8935 122.869 133.479 80.010 1.00 0.00 O ATOM 85418 H1 WAT 8935 123.203 132.591 80.140 1.00 0.00 H ATOM 85419 H2 WAT 8935 123.534 134.045 80.402 1.00 0.00 H TER 85421 WAT 8935 ATOM 85421 O WAT 8936 42.422 36.959 146.195 1.00 0.00 O ATOM 85422 H1 WAT 8936 41.966 37.137 147.018 1.00 0.00 H ATOM 85423 H2 WAT 8936 43.309 37.288 146.337 1.00 0.00 H TER 85425 WAT 8936 ATOM 85425 O WAT 8937 32.387 130.132 68.892 1.00 0.00 O ATOM 85426 H1 WAT 8937 32.869 129.487 69.409 1.00 0.00 H ATOM 85427 H2 WAT 8937 33.036 130.804 68.682 1.00 0.00 H TER 85429 WAT 8937 ATOM 85429 O WAT 8938 56.141 127.029 95.072 1.00 0.00 O ATOM 85430 H1 WAT 8938 56.694 126.250 95.012 1.00 0.00 H ATOM 85431 H2 WAT 8938 55.323 126.776 94.645 1.00 0.00 H TER 85433 WAT 8938 ATOM 85433 O WAT 8939 125.702 46.156 8.600 1.00 0.00 O ATOM 85434 H1 WAT 8939 125.148 45.668 9.209 1.00 0.00 H ATOM 85435 H2 WAT 8939 126.133 45.482 8.074 1.00 0.00 H TER 85437 WAT 8939 ATOM 85437 O WAT 8940 68.353 128.868 151.182 1.00 0.00 O ATOM 85438 H1 WAT 8940 68.205 129.754 150.849 1.00 0.00 H ATOM 85439 H2 WAT 8940 68.171 128.931 152.119 1.00 0.00 H TER 85441 WAT 8940 ATOM 85441 O WAT 8941 95.969 25.321 129.170 1.00 0.00 O ATOM 85442 H1 WAT 8941 96.561 25.494 128.438 1.00 0.00 H ATOM 85443 H2 WAT 8941 95.437 26.114 129.239 1.00 0.00 H TER 85445 WAT 8941 ATOM 85445 O WAT 8942 128.833 49.793 142.182 1.00 0.00 O ATOM 85446 H1 WAT 8942 129.424 50.011 142.903 1.00 0.00 H ATOM 85447 H2 WAT 8942 128.503 48.921 142.398 1.00 0.00 H TER 85449 WAT 8942 ATOM 85449 O WAT 8943 69.689 41.387 65.672 1.00 0.00 O ATOM 85450 H1 WAT 8943 70.284 42.020 65.270 1.00 0.00 H ATOM 85451 H2 WAT 8943 69.484 40.770 64.969 1.00 0.00 H TER 85453 WAT 8943 ATOM 85453 O WAT 8944 92.010 109.398 130.483 1.00 0.00 O ATOM 85454 H1 WAT 8944 91.545 109.873 129.795 1.00 0.00 H ATOM 85455 H2 WAT 8944 92.599 110.047 130.868 1.00 0.00 H TER 85457 WAT 8944 ATOM 85457 O WAT 8945 50.785 18.913 69.436 1.00 0.00 O ATOM 85458 H1 WAT 8945 50.321 19.725 69.234 1.00 0.00 H ATOM 85459 H2 WAT 8945 50.091 18.270 69.583 1.00 0.00 H TER 85461 WAT 8945 ATOM 85461 O WAT 8946 92.452 117.923 99.241 1.00 0.00 O ATOM 85462 H1 WAT 8946 92.091 117.472 100.004 1.00 0.00 H ATOM 85463 H2 WAT 8946 91.780 117.827 98.566 1.00 0.00 H TER 85465 WAT 8946 ATOM 85465 O WAT 8947 12.229 134.037 112.077 1.00 0.00 O ATOM 85466 H1 WAT 8947 12.888 134.456 112.631 1.00 0.00 H ATOM 85467 H2 WAT 8947 11.420 134.513 112.266 1.00 0.00 H TER 85469 WAT 8947 ATOM 85469 O WAT 8948 83.970 48.251 135.902 1.00 0.00 O ATOM 85470 H1 WAT 8948 83.983 49.205 135.821 1.00 0.00 H ATOM 85471 H2 WAT 8948 84.151 48.086 136.827 1.00 0.00 H TER 85473 WAT 8948 ATOM 85473 O WAT 8949 56.483 83.377 6.545 1.00 0.00 O ATOM 85474 H1 WAT 8949 56.485 83.901 7.346 1.00 0.00 H ATOM 85475 H2 WAT 8949 56.125 82.531 6.813 1.00 0.00 H TER 85477 WAT 8949 ATOM 85477 O WAT 8950 18.340 137.867 8.756 1.00 0.00 O ATOM 85478 H1 WAT 8950 17.733 137.859 9.496 1.00 0.00 H ATOM 85479 H2 WAT 8950 19.060 137.299 9.030 1.00 0.00 H TER 85481 WAT 8950 ATOM 85481 O WAT 8951 56.663 143.491 75.761 1.00 0.00 O ATOM 85482 H1 WAT 8951 56.327 142.897 75.090 1.00 0.00 H ATOM 85483 H2 WAT 8951 56.286 143.166 76.579 1.00 0.00 H TER 85485 WAT 8951 ATOM 85485 O WAT 8952 6.511 110.815 131.130 1.00 0.00 O ATOM 85486 H1 WAT 8952 6.848 111.039 130.262 1.00 0.00 H ATOM 85487 H2 WAT 8952 6.053 111.604 131.420 1.00 0.00 H TER 85489 WAT 8952 ATOM 85489 O WAT 8953 103.089 18.655 118.625 1.00 0.00 O ATOM 85490 H1 WAT 8953 103.603 18.196 117.960 1.00 0.00 H ATOM 85491 H2 WAT 8953 103.664 18.691 119.389 1.00 0.00 H TER 85493 WAT 8953 ATOM 85493 O WAT 8954 122.001 96.904 94.516 1.00 0.00 O ATOM 85494 H1 WAT 8954 122.674 96.856 95.194 1.00 0.00 H ATOM 85495 H2 WAT 8954 121.233 97.258 94.965 1.00 0.00 H TER 85497 WAT 8954 ATOM 85497 O WAT 8955 21.271 122.462 91.682 1.00 0.00 O ATOM 85498 H1 WAT 8955 21.360 122.333 92.626 1.00 0.00 H ATOM 85499 H2 WAT 8955 20.958 123.363 91.591 1.00 0.00 H TER 85501 WAT 8955 ATOM 85501 O WAT 8956 19.384 77.128 85.340 1.00 0.00 O ATOM 85502 H1 WAT 8956 18.473 76.931 85.121 1.00 0.00 H ATOM 85503 H2 WAT 8956 19.782 77.378 84.506 1.00 0.00 H TER 85505 WAT 8956 ATOM 85505 O WAT 8957 25.162 42.449 5.687 1.00 0.00 O ATOM 85506 H1 WAT 8957 25.116 42.836 6.562 1.00 0.00 H ATOM 85507 H2 WAT 8957 24.531 42.950 5.170 1.00 0.00 H TER 85509 WAT 8957 ATOM 85509 O WAT 8958 77.110 14.997 71.605 1.00 0.00 O ATOM 85510 H1 WAT 8958 76.159 14.893 71.571 1.00 0.00 H ATOM 85511 H2 WAT 8958 77.439 14.122 71.812 1.00 0.00 H TER 85513 WAT 8958 ATOM 85513 O WAT 8959 141.440 1.513 93.377 1.00 0.00 O ATOM 85514 H1 WAT 8959 141.372 0.724 93.915 1.00 0.00 H ATOM 85515 H2 WAT 8959 141.834 2.165 93.957 1.00 0.00 H TER 85517 WAT 8959 ATOM 85517 O WAT 8960 103.726 49.252 12.138 1.00 0.00 O ATOM 85518 H1 WAT 8960 103.982 49.634 12.978 1.00 0.00 H ATOM 85519 H2 WAT 8960 103.892 49.945 11.499 1.00 0.00 H TER 85521 WAT 8960 ATOM 85521 O WAT 8961 101.353 135.201 134.405 1.00 0.00 O ATOM 85522 H1 WAT 8961 101.568 134.656 135.162 1.00 0.00 H ATOM 85523 H2 WAT 8961 100.962 135.990 134.781 1.00 0.00 H TER 85525 WAT 8961 ATOM 85525 O WAT 8962 27.618 138.791 130.856 1.00 0.00 O ATOM 85526 H1 WAT 8962 27.776 138.335 130.029 1.00 0.00 H ATOM 85527 H2 WAT 8962 27.640 139.720 130.625 1.00 0.00 H TER 85529 WAT 8962 ATOM 85529 O WAT 8963 78.464 3.042 126.271 1.00 0.00 O ATOM 85530 H1 WAT 8963 77.728 2.676 126.761 1.00 0.00 H ATOM 85531 H2 WAT 8963 78.833 2.294 125.801 1.00 0.00 H TER 85533 WAT 8963 ATOM 85533 O WAT 8964 135.713 54.153 56.801 1.00 0.00 O ATOM 85534 H1 WAT 8964 135.087 54.180 57.525 1.00 0.00 H ATOM 85535 H2 WAT 8964 135.894 53.221 56.676 1.00 0.00 H TER 85537 WAT 8964 ATOM 85537 O WAT 8965 4.332 31.501 141.401 1.00 0.00 O ATOM 85538 H1 WAT 8965 5.176 31.283 141.006 1.00 0.00 H ATOM 85539 H2 WAT 8965 3.749 30.792 141.130 1.00 0.00 H TER 85541 WAT 8965 ATOM 85541 O WAT 8966 34.104 22.101 22.248 1.00 0.00 O ATOM 85542 H1 WAT 8966 33.301 22.492 22.590 1.00 0.00 H ATOM 85543 H2 WAT 8966 33.945 21.158 22.281 1.00 0.00 H TER 85545 WAT 8966 ATOM 85545 O WAT 8967 39.204 87.535 24.304 1.00 0.00 O ATOM 85546 H1 WAT 8967 38.425 87.676 23.765 1.00 0.00 H ATOM 85547 H2 WAT 8967 39.216 88.279 24.907 1.00 0.00 H TER 85549 WAT 8967 ATOM 85549 O WAT 8968 83.899 81.094 2.352 1.00 0.00 O ATOM 85550 H1 WAT 8968 83.296 81.816 2.529 1.00 0.00 H ATOM 85551 H2 WAT 8968 83.540 80.356 2.845 1.00 0.00 H TER 85553 WAT 8968 ATOM 85553 O WAT 8969 104.464 24.030 74.104 1.00 0.00 O ATOM 85554 H1 WAT 8969 105.105 23.579 73.556 1.00 0.00 H ATOM 85555 H2 WAT 8969 103.623 23.648 73.853 1.00 0.00 H TER 85557 WAT 8969 ATOM 85557 O WAT 8970 46.519 30.710 99.880 1.00 0.00 O ATOM 85558 H1 WAT 8970 46.671 31.312 100.609 1.00 0.00 H ATOM 85559 H2 WAT 8970 46.748 31.216 99.101 1.00 0.00 H TER 85561 WAT 8970 ATOM 85561 O WAT 8971 48.222 121.026 107.095 1.00 0.00 O ATOM 85562 H1 WAT 8971 48.218 121.917 107.445 1.00 0.00 H ATOM 85563 H2 WAT 8971 49.048 120.960 106.617 1.00 0.00 H TER 85565 WAT 8971 ATOM 85565 O WAT 8972 28.835 105.718 122.458 1.00 0.00 O ATOM 85566 H1 WAT 8972 28.340 106.123 123.170 1.00 0.00 H ATOM 85567 H2 WAT 8972 29.382 105.061 122.889 1.00 0.00 H TER 85569 WAT 8972 ATOM 85569 O WAT 8973 99.733 101.794 136.184 1.00 0.00 O ATOM 85570 H1 WAT 8973 98.804 101.566 136.146 1.00 0.00 H ATOM 85571 H2 WAT 8973 99.954 101.747 137.114 1.00 0.00 H TER 85573 WAT 8973 ATOM 85573 O WAT 8974 100.923 12.412 81.473 1.00 0.00 O ATOM 85574 H1 WAT 8974 101.095 11.994 80.630 1.00 0.00 H ATOM 85575 H2 WAT 8974 100.762 13.331 81.256 1.00 0.00 H TER 85577 WAT 8974 ATOM 85577 O WAT 8975 23.683 89.135 132.816 1.00 0.00 O ATOM 85578 H1 WAT 8975 24.291 89.025 132.085 1.00 0.00 H ATOM 85579 H2 WAT 8975 24.226 89.466 133.531 1.00 0.00 H TER 85581 WAT 8975 ATOM 85581 O WAT 8976 41.294 96.192 126.756 1.00 0.00 O ATOM 85582 H1 WAT 8976 41.049 96.833 127.423 1.00 0.00 H ATOM 85583 H2 WAT 8976 40.490 95.698 126.593 1.00 0.00 H TER 85585 WAT 8976 ATOM 85585 O WAT 8977 44.696 52.130 120.671 1.00 0.00 O ATOM 85586 H1 WAT 8977 43.776 52.107 120.935 1.00 0.00 H ATOM 85587 H2 WAT 8977 44.858 51.268 120.290 1.00 0.00 H TER 85589 WAT 8977 ATOM 85589 O WAT 8978 98.338 75.789 98.487 1.00 0.00 O ATOM 85590 H1 WAT 8978 98.774 76.316 99.157 1.00 0.00 H ATOM 85591 H2 WAT 8978 98.698 74.910 98.601 1.00 0.00 H TER 85593 WAT 8978 ATOM 85593 O WAT 8979 108.729 60.327 80.433 1.00 0.00 O ATOM 85594 H1 WAT 8979 107.999 60.025 80.973 1.00 0.00 H ATOM 85595 H2 WAT 8979 108.372 60.364 79.546 1.00 0.00 H TER 85597 WAT 8979 ATOM 85597 O WAT 8980 75.072 5.509 1.524 1.00 0.00 O ATOM 85598 H1 WAT 8980 75.005 4.856 0.828 1.00 0.00 H ATOM 85599 H2 WAT 8980 75.884 5.978 1.335 1.00 0.00 H TER 85601 WAT 8980 ATOM 85601 O WAT 8981 33.346 60.893 79.322 1.00 0.00 O ATOM 85602 H1 WAT 8981 32.597 60.580 78.815 1.00 0.00 H ATOM 85603 H2 WAT 8981 33.927 61.289 78.672 1.00 0.00 H TER 85605 WAT 8981 ATOM 85605 O WAT 8982 74.983 98.561 153.562 1.00 0.00 O ATOM 85606 H1 WAT 8982 75.634 97.859 153.554 1.00 0.00 H ATOM 85607 H2 WAT 8982 75.260 99.136 154.275 1.00 0.00 H TER 85609 WAT 8982 ATOM 85609 O WAT 8983 25.960 104.634 145.176 1.00 0.00 O ATOM 85610 H1 WAT 8983 26.830 104.397 145.498 1.00 0.00 H ATOM 85611 H2 WAT 8983 25.639 103.840 144.748 1.00 0.00 H TER 85613 WAT 8983 ATOM 85613 O WAT 8984 132.772 71.193 98.923 1.00 0.00 O ATOM 85614 H1 WAT 8984 132.932 72.052 98.534 1.00 0.00 H ATOM 85615 H2 WAT 8984 131.892 70.957 98.630 1.00 0.00 H TER 85617 WAT 8984 ATOM 85617 O WAT 8985 52.173 29.177 111.897 1.00 0.00 O ATOM 85618 H1 WAT 8985 51.699 28.467 111.464 1.00 0.00 H ATOM 85619 H2 WAT 8985 52.989 29.256 111.403 1.00 0.00 H TER 85621 WAT 8985 ATOM 85621 O WAT 8986 55.463 31.135 16.450 1.00 0.00 O ATOM 85622 H1 WAT 8986 54.991 31.267 15.627 1.00 0.00 H ATOM 85623 H2 WAT 8986 55.207 31.880 16.994 1.00 0.00 H TER 85625 WAT 8986 ATOM 85625 O WAT 8987 23.809 69.528 16.258 1.00 0.00 O ATOM 85626 H1 WAT 8987 24.103 69.552 15.347 1.00 0.00 H ATOM 85627 H2 WAT 8987 23.008 70.052 16.265 1.00 0.00 H TER 85629 WAT 8987 ATOM 85629 O WAT 8988 15.575 8.052 135.551 1.00 0.00 O ATOM 85630 H1 WAT 8988 15.023 8.643 136.064 1.00 0.00 H ATOM 85631 H2 WAT 8988 15.034 7.273 135.420 1.00 0.00 H TER 85633 WAT 8988 ATOM 85633 O WAT 8989 59.419 46.219 96.224 1.00 0.00 O ATOM 85634 H1 WAT 8989 59.545 45.833 95.358 1.00 0.00 H ATOM 85635 H2 WAT 8989 58.904 47.010 96.061 1.00 0.00 H TER 85637 WAT 8989 ATOM 85637 O WAT 8990 105.448 86.631 78.391 1.00 0.00 O ATOM 85638 H1 WAT 8990 105.260 86.101 79.166 1.00 0.00 H ATOM 85639 H2 WAT 8990 105.563 87.519 78.730 1.00 0.00 H TER 85641 WAT 8990 ATOM 85641 O WAT 8991 131.051 41.764 154.534 1.00 0.00 O ATOM 85642 H1 WAT 8991 131.828 42.314 154.436 1.00 0.00 H ATOM 85643 H2 WAT 8991 130.342 42.381 154.711 1.00 0.00 H TER 85645 WAT 8991 ATOM 85645 O WAT 8992 63.191 65.572 143.441 1.00 0.00 O ATOM 85646 H1 WAT 8992 63.171 65.001 144.210 1.00 0.00 H ATOM 85647 H2 WAT 8992 62.362 65.401 142.994 1.00 0.00 H TER 85649 WAT 8992 ATOM 85649 O WAT 8993 131.650 110.322 60.149 1.00 0.00 O ATOM 85650 H1 WAT 8993 132.119 111.087 59.817 1.00 0.00 H ATOM 85651 H2 WAT 8993 131.853 109.626 59.525 1.00 0.00 H TER 85653 WAT 8993 ATOM 85653 O WAT 8994 90.087 62.282 3.000 1.00 0.00 O ATOM 85654 H1 WAT 8994 90.491 61.592 2.475 1.00 0.00 H ATOM 85655 H2 WAT 8994 89.569 62.788 2.374 1.00 0.00 H TER 85657 WAT 8994 ATOM 85657 O WAT 8995 99.425 137.656 57.837 1.00 0.00 O ATOM 85658 H1 WAT 8995 98.509 137.933 57.842 1.00 0.00 H ATOM 85659 H2 WAT 8995 99.394 136.726 57.613 1.00 0.00 H TER 85661 WAT 8995 ATOM 85661 O WAT 8996 28.177 63.639 93.708 1.00 0.00 O ATOM 85662 H1 WAT 8996 27.877 63.855 92.825 1.00 0.00 H ATOM 85663 H2 WAT 8996 28.999 64.120 93.805 1.00 0.00 H TER 85665 WAT 8996 ATOM 85665 O WAT 8997 61.339 95.764 102.170 1.00 0.00 O ATOM 85666 H1 WAT 8997 62.009 95.349 102.714 1.00 0.00 H ATOM 85667 H2 WAT 8997 61.770 96.539 101.810 1.00 0.00 H TER 85669 WAT 8997 ATOM 85669 O WAT 8998 45.704 99.552 21.608 1.00 0.00 O ATOM 85670 H1 WAT 8998 46.538 99.985 21.425 1.00 0.00 H ATOM 85671 H2 WAT 8998 45.926 98.858 22.230 1.00 0.00 H TER 85673 WAT 8998 ATOM 85673 O WAT 8999 1.983 134.416 17.772 1.00 0.00 O ATOM 85674 H1 WAT 8999 2.367 133.893 17.068 1.00 0.00 H ATOM 85675 H2 WAT 8999 2.642 135.083 17.962 1.00 0.00 H TER 85677 WAT 8999 ATOM 85677 O WAT 9000 3.217 99.227 111.438 1.00 0.00 O ATOM 85678 H1 WAT 9000 3.933 99.861 111.401 1.00 0.00 H ATOM 85679 H2 WAT 9000 2.779 99.407 112.270 1.00 0.00 H TER 85681 WAT 9000 ATOM 85681 O WAT 9001 100.425 129.334 145.276 1.00 0.00 O ATOM 85682 H1 WAT 9001 100.683 129.925 144.569 1.00 0.00 H ATOM 85683 H2 WAT 9001 99.865 129.866 145.840 1.00 0.00 H TER 85685 WAT 9001 ATOM 85685 O WAT 9002 19.826 126.747 75.463 1.00 0.00 O ATOM 85686 H1 WAT 9002 19.598 127.676 75.448 1.00 0.00 H ATOM 85687 H2 WAT 9002 19.923 126.538 76.392 1.00 0.00 H TER 85689 WAT 9002 ATOM 85689 O WAT 9003 80.088 25.767 101.977 1.00 0.00 O ATOM 85690 H1 WAT 9003 79.732 26.076 102.810 1.00 0.00 H ATOM 85691 H2 WAT 9003 79.344 25.358 101.536 1.00 0.00 H TER 85693 WAT 9003 ATOM 85693 O WAT 9004 45.011 142.631 75.994 1.00 0.00 O ATOM 85694 H1 WAT 9004 45.531 143.279 75.519 1.00 0.00 H ATOM 85695 H2 WAT 9004 44.444 143.151 76.565 1.00 0.00 H TER 85697 WAT 9004 ATOM 85697 O WAT 9005 29.902 87.463 91.091 1.00 0.00 O ATOM 85698 H1 WAT 9005 29.584 86.875 90.406 1.00 0.00 H ATOM 85699 H2 WAT 9005 30.378 88.146 90.619 1.00 0.00 H TER 85701 WAT 9005 ATOM 85701 O WAT 9006 85.915 117.276 84.733 1.00 0.00 O ATOM 85702 H1 WAT 9006 85.943 116.325 84.834 1.00 0.00 H ATOM 85703 H2 WAT 9006 85.067 117.449 84.324 1.00 0.00 H TER 85705 WAT 9006 ATOM 85705 O WAT 9007 106.727 36.449 145.587 1.00 0.00 O ATOM 85706 H1 WAT 9007 106.076 36.765 146.213 1.00 0.00 H ATOM 85707 H2 WAT 9007 106.548 36.941 144.786 1.00 0.00 H TER 85709 WAT 9007 ATOM 85709 O WAT 9008 79.070 18.916 129.722 1.00 0.00 O ATOM 85710 H1 WAT 9008 78.617 19.505 130.326 1.00 0.00 H ATOM 85711 H2 WAT 9008 79.830 19.417 129.424 1.00 0.00 H TER 85713 WAT 9008 ATOM 85713 O WAT 9009 121.965 136.965 96.468 1.00 0.00 O ATOM 85714 H1 WAT 9009 121.729 137.407 95.652 1.00 0.00 H ATOM 85715 H2 WAT 9009 122.478 136.206 96.189 1.00 0.00 H TER 85717 WAT 9009 ATOM 85717 O WAT 9010 126.972 99.829 144.479 1.00 0.00 O ATOM 85718 H1 WAT 9010 126.572 99.442 143.700 1.00 0.00 H ATOM 85719 H2 WAT 9010 127.674 100.383 144.138 1.00 0.00 H TER 85721 WAT 9010 ATOM 85721 O WAT 9011 9.680 60.405 68.062 1.00 0.00 O ATOM 85722 H1 WAT 9011 9.458 59.559 67.674 1.00 0.00 H ATOM 85723 H2 WAT 9011 8.912 60.953 67.897 1.00 0.00 H TER 85725 WAT 9011 ATOM 85725 O WAT 9012 40.811 72.177 101.690 1.00 0.00 O ATOM 85726 H1 WAT 9012 41.187 72.927 102.151 1.00 0.00 H ATOM 85727 H2 WAT 9012 40.765 71.488 102.353 1.00 0.00 H TER 85729 WAT 9012 ATOM 85729 O WAT 9013 111.213 110.540 137.742 1.00 0.00 O ATOM 85730 H1 WAT 9013 112.082 110.552 138.142 1.00 0.00 H ATOM 85731 H2 WAT 9013 110.897 111.440 137.827 1.00 0.00 H TER 85733 WAT 9013 ATOM 85733 O WAT 9014 70.148 46.316 69.011 1.00 0.00 O ATOM 85734 H1 WAT 9014 70.024 45.877 68.170 1.00 0.00 H ATOM 85735 H2 WAT 9014 70.974 45.966 69.345 1.00 0.00 H TER 85737 WAT 9014 ATOM 85737 O WAT 9015 41.169 34.099 8.570 1.00 0.00 O ATOM 85738 H1 WAT 9015 40.978 34.875 9.098 1.00 0.00 H ATOM 85739 H2 WAT 9015 42.074 33.877 8.789 1.00 0.00 H TER 85741 WAT 9015 ATOM 85741 O WAT 9016 14.612 115.289 8.335 1.00 0.00 O ATOM 85742 H1 WAT 9016 15.000 116.025 8.808 1.00 0.00 H ATOM 85743 H2 WAT 9016 14.993 114.513 8.746 1.00 0.00 H TER 85745 WAT 9016 ATOM 85745 O WAT 9017 22.733 104.080 1.479 1.00 0.00 O ATOM 85746 H1 WAT 9017 21.996 103.533 1.205 1.00 0.00 H ATOM 85747 H2 WAT 9017 22.476 104.969 1.231 1.00 0.00 H TER 85749 WAT 9017 ATOM 85749 O WAT 9018 110.337 44.796 130.704 1.00 0.00 O ATOM 85750 H1 WAT 9018 109.535 44.495 131.132 1.00 0.00 H ATOM 85751 H2 WAT 9018 111.041 44.505 131.283 1.00 0.00 H TER 85753 WAT 9018 ATOM 85753 O WAT 9019 14.990 65.595 78.782 1.00 0.00 O ATOM 85754 H1 WAT 9019 15.373 65.450 77.917 1.00 0.00 H ATOM 85755 H2 WAT 9019 15.561 65.114 79.381 1.00 0.00 H TER 85757 WAT 9019 ATOM 85757 O WAT 9020 84.009 112.807 63.762 1.00 0.00 O ATOM 85758 H1 WAT 9020 83.658 113.454 63.150 1.00 0.00 H ATOM 85759 H2 WAT 9020 83.309 112.678 64.402 1.00 0.00 H TER 85761 WAT 9020 ATOM 85761 O WAT 9021 30.421 115.412 85.940 1.00 0.00 O ATOM 85762 H1 WAT 9021 30.958 114.775 86.412 1.00 0.00 H ATOM 85763 H2 WAT 9021 30.884 115.550 85.114 1.00 0.00 H TER 85765 WAT 9021 ATOM 85765 O WAT 9022 86.928 86.818 59.460 1.00 0.00 O ATOM 85766 H1 WAT 9022 86.083 86.573 59.082 1.00 0.00 H ATOM 85767 H2 WAT 9022 87.571 86.546 58.806 1.00 0.00 H TER 85769 WAT 9022 ATOM 85769 O WAT 9023 47.479 75.586 144.175 1.00 0.00 O ATOM 85770 H1 WAT 9023 48.404 75.606 144.423 1.00 0.00 H ATOM 85771 H2 WAT 9023 47.454 75.997 143.311 1.00 0.00 H TER 85773 WAT 9023 ATOM 85773 O WAT 9024 133.663 127.177 147.316 1.00 0.00 O ATOM 85774 H1 WAT 9024 133.887 126.593 146.592 1.00 0.00 H ATOM 85775 H2 WAT 9024 132.754 126.962 147.526 1.00 0.00 H TER 85777 WAT 9024 ATOM 85777 O WAT 9025 60.502 93.676 130.704 1.00 0.00 O ATOM 85778 H1 WAT 9025 61.395 93.521 130.396 1.00 0.00 H ATOM 85779 H2 WAT 9025 60.365 93.015 131.382 1.00 0.00 H TER 85781 WAT 9025 ATOM 85781 O WAT 9026 83.789 124.093 117.107 1.00 0.00 O ATOM 85782 H1 WAT 9026 83.099 124.744 117.233 1.00 0.00 H ATOM 85783 H2 WAT 9026 84.545 124.600 116.811 1.00 0.00 H TER 85785 WAT 9026 ATOM 85785 O WAT 9027 119.484 19.700 114.173 1.00 0.00 O ATOM 85786 H1 WAT 9027 118.626 19.675 114.596 1.00 0.00 H ATOM 85787 H2 WAT 9027 119.314 19.432 113.270 1.00 0.00 H TER 85789 WAT 9027 ATOM 85789 O WAT 9028 61.069 143.445 106.749 1.00 0.00 O ATOM 85790 H1 WAT 9028 61.742 144.013 106.374 1.00 0.00 H ATOM 85791 H2 WAT 9028 60.390 143.402 106.075 1.00 0.00 H TER 85793 WAT 9028 ATOM 85793 O WAT 9029 101.201 94.337 135.977 1.00 0.00 O ATOM 85794 H1 WAT 9029 100.904 93.451 135.766 1.00 0.00 H ATOM 85795 H2 WAT 9029 100.836 94.511 136.845 1.00 0.00 H TER 85797 WAT 9029 ATOM 85797 O WAT 9030 26.379 35.842 147.586 1.00 0.00 O ATOM 85798 H1 WAT 9030 26.459 35.886 146.633 1.00 0.00 H ATOM 85799 H2 WAT 9030 27.276 35.938 147.906 1.00 0.00 H TER 85801 WAT 9030 ATOM 85801 O WAT 9031 47.373 89.157 0.380 1.00 0.00 O ATOM 85802 H1 WAT 9031 47.032 89.459 -0.462 1.00 0.00 H ATOM 85803 H2 WAT 9031 48.313 89.048 0.233 1.00 0.00 H TER 85805 WAT 9031 ATOM 85805 O WAT 9032 87.774 118.582 122.686 1.00 0.00 O ATOM 85806 H1 WAT 9032 87.201 117.838 122.871 1.00 0.00 H ATOM 85807 H2 WAT 9032 88.113 118.410 121.807 1.00 0.00 H TER 85809 WAT 9032 ATOM 85809 O WAT 9033 98.349 6.212 143.798 1.00 0.00 O ATOM 85810 H1 WAT 9033 98.521 6.655 142.968 1.00 0.00 H ATOM 85811 H2 WAT 9033 99.176 5.780 144.014 1.00 0.00 H TER 85813 WAT 9033 ATOM 85813 O WAT 9034 22.070 2.689 55.235 1.00 0.00 O ATOM 85814 H1 WAT 9034 22.504 3.038 56.013 1.00 0.00 H ATOM 85815 H2 WAT 9034 21.535 3.415 54.913 1.00 0.00 H TER 85817 WAT 9034 ATOM 85817 O WAT 9035 75.911 102.637 78.777 1.00 0.00 O ATOM 85818 H1 WAT 9035 75.351 102.294 78.080 1.00 0.00 H ATOM 85819 H2 WAT 9035 75.502 103.465 79.027 1.00 0.00 H TER 85821 WAT 9035 ATOM 85821 O WAT 9036 111.095 102.905 68.373 1.00 0.00 O ATOM 85822 H1 WAT 9036 110.632 102.784 67.544 1.00 0.00 H ATOM 85823 H2 WAT 9036 110.804 103.761 68.687 1.00 0.00 H TER 85825 WAT 9036 ATOM 85825 O WAT 9037 25.360 72.913 62.218 1.00 0.00 O ATOM 85826 H1 WAT 9037 25.056 73.804 62.047 1.00 0.00 H ATOM 85827 H2 WAT 9037 26.244 72.887 61.851 1.00 0.00 H TER 85829 WAT 9037 ATOM 85829 O WAT 9038 119.827 83.749 133.858 1.00 0.00 O ATOM 85830 H1 WAT 9038 119.771 84.401 133.160 1.00 0.00 H ATOM 85831 H2 WAT 9038 119.809 82.908 133.401 1.00 0.00 H TER 85833 WAT 9038 ATOM 85833 O WAT 9039 39.183 10.728 120.542 1.00 0.00 O ATOM 85834 H1 WAT 9039 39.345 11.565 120.978 1.00 0.00 H ATOM 85835 H2 WAT 9039 38.993 10.119 121.255 1.00 0.00 H TER 85837 WAT 9039 ATOM 85837 O WAT 9040 138.308 139.290 17.483 1.00 0.00 O ATOM 85838 H1 WAT 9040 138.603 138.481 17.066 1.00 0.00 H ATOM 85839 H2 WAT 9040 139.110 139.698 17.809 1.00 0.00 H TER 85841 WAT 9040 ATOM 85841 O WAT 9041 61.744 119.295 86.405 1.00 0.00 O ATOM 85842 H1 WAT 9041 62.090 118.574 85.879 1.00 0.00 H ATOM 85843 H2 WAT 9041 62.375 120.004 86.285 1.00 0.00 H TER 85845 WAT 9041 ATOM 85845 O WAT 9042 74.223 55.119 131.695 1.00 0.00 O ATOM 85846 H1 WAT 9042 73.667 54.400 131.997 1.00 0.00 H ATOM 85847 H2 WAT 9042 75.046 54.697 131.449 1.00 0.00 H TER 85849 WAT 9042 ATOM 85849 O WAT 9043 59.407 0.563 55.704 1.00 0.00 O ATOM 85850 H1 WAT 9043 59.488 1.393 55.233 1.00 0.00 H ATOM 85851 H2 WAT 9043 59.477 0.804 56.628 1.00 0.00 H TER 85853 WAT 9043 ATOM 85853 O WAT 9044 50.194 27.807 83.799 1.00 0.00 O ATOM 85854 H1 WAT 9044 51.064 28.202 83.848 1.00 0.00 H ATOM 85855 H2 WAT 9044 50.230 27.243 83.026 1.00 0.00 H TER 85857 WAT 9044 ATOM 85857 O WAT 9045 95.707 137.815 124.307 1.00 0.00 O ATOM 85858 H1 WAT 9045 95.529 138.710 124.595 1.00 0.00 H ATOM 85859 H2 WAT 9045 95.416 137.267 125.036 1.00 0.00 H TER 85861 WAT 9045 ATOM 85861 O WAT 9046 128.453 58.248 114.948 1.00 0.00 O ATOM 85862 H1 WAT 9046 128.273 57.568 115.597 1.00 0.00 H ATOM 85863 H2 WAT 9046 128.659 57.766 114.147 1.00 0.00 H TER 85865 WAT 9046 ATOM 85865 O WAT 9047 142.668 80.315 57.415 1.00 0.00 O ATOM 85866 H1 WAT 9047 141.777 80.627 57.258 1.00 0.00 H ATOM 85867 H2 WAT 9047 142.749 79.535 56.866 1.00 0.00 H TER 85869 WAT 9047 ATOM 85869 O WAT 9048 51.501 55.249 91.770 1.00 0.00 O ATOM 85870 H1 WAT 9048 51.401 54.688 91.000 1.00 0.00 H ATOM 85871 H2 WAT 9048 51.174 56.103 91.488 1.00 0.00 H TER 85873 WAT 9048 ATOM 85873 O WAT 9049 119.923 102.315 5.851 1.00 0.00 O ATOM 85874 H1 WAT 9049 120.807 102.650 5.702 1.00 0.00 H ATOM 85875 H2 WAT 9049 119.480 103.013 6.333 1.00 0.00 H TER 85877 WAT 9049 ATOM 85877 O WAT 9050 124.159 89.763 95.569 1.00 0.00 O ATOM 85878 H1 WAT 9050 124.043 89.477 94.663 1.00 0.00 H ATOM 85879 H2 WAT 9050 124.407 88.968 96.041 1.00 0.00 H TER 85881 WAT 9050 ATOM 85881 O WAT 9051 10.086 68.271 86.390 1.00 0.00 O ATOM 85882 H1 WAT 9051 9.734 69.151 86.519 1.00 0.00 H ATOM 85883 H2 WAT 9051 10.948 68.294 86.806 1.00 0.00 H TER 85885 WAT 9051 ATOM 85885 O WAT 9052 22.372 7.303 87.899 1.00 0.00 O ATOM 85886 H1 WAT 9052 22.209 8.157 87.499 1.00 0.00 H ATOM 85887 H2 WAT 9052 21.506 6.903 87.973 1.00 0.00 H TER 85889 WAT 9052 ATOM 85889 O WAT 9053 28.426 33.119 65.409 1.00 0.00 O ATOM 85890 H1 WAT 9053 28.880 33.895 65.080 1.00 0.00 H ATOM 85891 H2 WAT 9053 27.502 33.288 65.228 1.00 0.00 H TER 85893 WAT 9053 ATOM 85893 O WAT 9054 76.328 121.038 120.793 1.00 0.00 O ATOM 85894 H1 WAT 9054 75.586 120.601 120.375 1.00 0.00 H ATOM 85895 H2 WAT 9054 77.082 120.793 120.258 1.00 0.00 H TER 85897 WAT 9054 ATOM 85897 O WAT 9055 122.323 24.575 141.020 1.00 0.00 O ATOM 85898 H1 WAT 9055 123.123 25.058 141.227 1.00 0.00 H ATOM 85899 H2 WAT 9055 122.477 23.696 141.366 1.00 0.00 H TER 85901 WAT 9055 ATOM 85901 O WAT 9056 62.623 32.614 98.488 1.00 0.00 O ATOM 85902 H1 WAT 9056 63.175 33.272 98.912 1.00 0.00 H ATOM 85903 H2 WAT 9056 62.571 32.897 97.575 1.00 0.00 H TER 85905 WAT 9056 ATOM 85905 O WAT 9057 62.059 36.040 135.123 1.00 0.00 O ATOM 85906 H1 WAT 9057 61.667 35.596 135.875 1.00 0.00 H ATOM 85907 H2 WAT 9057 61.742 35.551 134.364 1.00 0.00 H TER 85909 WAT 9057 ATOM 85909 O WAT 9058 144.328 101.982 157.681 1.00 0.00 O ATOM 85910 H1 WAT 9058 143.498 101.827 157.229 1.00 0.00 H ATOM 85911 H2 WAT 9058 144.903 101.282 157.374 1.00 0.00 H TER 85913 WAT 9058 ATOM 85913 O WAT 9059 95.669 141.835 64.255 1.00 0.00 O ATOM 85914 H1 WAT 9059 95.431 142.761 64.203 1.00 0.00 H ATOM 85915 H2 WAT 9059 96.084 141.647 63.413 1.00 0.00 H TER 85917 WAT 9059 ATOM 85917 O WAT 9060 14.847 7.999 70.390 1.00 0.00 O ATOM 85918 H1 WAT 9060 14.758 8.671 71.066 1.00 0.00 H ATOM 85919 H2 WAT 9060 15.732 8.121 70.047 1.00 0.00 H TER 85921 WAT 9060 ATOM 85921 O WAT 9061 56.694 27.714 91.080 1.00 0.00 O ATOM 85922 H1 WAT 9061 56.485 27.050 91.737 1.00 0.00 H ATOM 85923 H2 WAT 9061 57.212 27.248 90.424 1.00 0.00 H TER 85925 WAT 9061 ATOM 85925 O WAT 9062 57.177 61.118 3.635 1.00 0.00 O ATOM 85926 H1 WAT 9062 57.549 61.894 3.218 1.00 0.00 H ATOM 85927 H2 WAT 9062 56.501 61.461 4.220 1.00 0.00 H TER 85929 WAT 9062 ATOM 85929 O WAT 9063 20.645 78.687 120.147 1.00 0.00 O ATOM 85930 H1 WAT 9063 19.794 78.677 119.709 1.00 0.00 H ATOM 85931 H2 WAT 9063 21.024 79.535 119.916 1.00 0.00 H TER 85933 WAT 9063 ATOM 85933 O WAT 9064 38.827 22.165 158.549 1.00 0.00 O ATOM 85934 H1 WAT 9064 38.420 22.407 159.381 1.00 0.00 H ATOM 85935 H2 WAT 9064 38.090 21.975 157.969 1.00 0.00 H TER 85937 WAT 9064 ATOM 85937 O WAT 9065 9.936 107.528 108.649 1.00 0.00 O ATOM 85938 H1 WAT 9065 10.136 107.765 107.744 1.00 0.00 H ATOM 85939 H2 WAT 9065 9.048 107.857 108.792 1.00 0.00 H TER 85941 WAT 9065 ATOM 85941 O WAT 9066 3.464 106.037 124.734 1.00 0.00 O ATOM 85942 H1 WAT 9066 4.119 106.417 125.319 1.00 0.00 H ATOM 85943 H2 WAT 9066 3.701 106.364 123.865 1.00 0.00 H TER 85945 WAT 9066 ATOM 85945 O WAT 9067 143.455 16.378 122.566 1.00 0.00 O ATOM 85946 H1 WAT 9067 143.207 15.471 122.386 1.00 0.00 H ATOM 85947 H2 WAT 9067 143.352 16.471 123.513 1.00 0.00 H TER 85949 WAT 9067 ATOM 85949 O WAT 9068 21.641 43.269 107.296 1.00 0.00 O ATOM 85950 H1 WAT 9068 21.319 42.710 108.003 1.00 0.00 H ATOM 85951 H2 WAT 9068 22.593 43.252 107.392 1.00 0.00 H TER 85953 WAT 9068 ATOM 85953 O WAT 9069 66.055 130.738 10.733 1.00 0.00 O ATOM 85954 H1 WAT 9069 66.833 131.176 11.077 1.00 0.00 H ATOM 85955 H2 WAT 9069 65.447 130.716 11.473 1.00 0.00 H TER 85957 WAT 9069 ATOM 85957 O WAT 9070 58.377 88.282 2.641 1.00 0.00 O ATOM 85958 H1 WAT 9070 57.742 88.986 2.508 1.00 0.00 H ATOM 85959 H2 WAT 9070 58.241 87.694 1.898 1.00 0.00 H TER 85961 WAT 9070 ATOM 85961 O WAT 9071 4.625 138.031 116.845 1.00 0.00 O ATOM 85962 H1 WAT 9071 4.767 137.167 116.458 1.00 0.00 H ATOM 85963 H2 WAT 9071 5.489 138.443 116.836 1.00 0.00 H TER 85965 WAT 9071 ATOM 85965 O WAT 9072 65.067 78.624 152.246 1.00 0.00 O ATOM 85966 H1 WAT 9072 65.818 78.773 152.821 1.00 0.00 H ATOM 85967 H2 WAT 9072 64.366 78.345 152.835 1.00 0.00 H TER 85969 WAT 9072 ATOM 85969 O WAT 9073 39.632 29.008 13.745 1.00 0.00 O ATOM 85970 H1 WAT 9073 39.395 28.158 14.117 1.00 0.00 H ATOM 85971 H2 WAT 9073 40.585 28.978 13.667 1.00 0.00 H TER 85973 WAT 9073 ATOM 85973 O WAT 9074 118.978 105.353 151.707 1.00 0.00 O ATOM 85974 H1 WAT 9074 119.183 104.955 152.553 1.00 0.00 H ATOM 85975 H2 WAT 9074 119.567 104.919 151.090 1.00 0.00 H TER 85977 WAT 9074 ATOM 85977 O WAT 9075 21.039 93.080 151.481 1.00 0.00 O ATOM 85978 H1 WAT 9075 21.210 93.332 152.388 1.00 0.00 H ATOM 85979 H2 WAT 9075 21.819 93.363 151.003 1.00 0.00 H TER 85981 WAT 9075 ATOM 85981 O WAT 9076 82.119 49.065 124.883 1.00 0.00 O ATOM 85982 H1 WAT 9076 81.293 48.724 124.539 1.00 0.00 H ATOM 85983 H2 WAT 9076 82.512 48.323 125.343 1.00 0.00 H TER 85985 WAT 9076 ATOM 85985 O WAT 9077 68.490 48.025 136.060 1.00 0.00 O ATOM 85986 H1 WAT 9077 68.273 47.094 136.114 1.00 0.00 H ATOM 85987 H2 WAT 9077 68.942 48.117 135.221 1.00 0.00 H TER 85989 WAT 9077 ATOM 85989 O WAT 9078 114.796 93.859 3.304 1.00 0.00 O ATOM 85990 H1 WAT 9078 114.719 93.439 4.160 1.00 0.00 H ATOM 85991 H2 WAT 9078 114.785 94.797 3.495 1.00 0.00 H TER 85993 WAT 9078 ATOM 85993 O WAT 9079 61.931 8.807 4.085 1.00 0.00 O ATOM 85994 H1 WAT 9079 62.862 8.834 4.306 1.00 0.00 H ATOM 85995 H2 WAT 9079 61.855 8.086 3.460 1.00 0.00 H TER 85997 WAT 9079 ATOM 85997 O WAT 9080 137.426 114.204 108.254 1.00 0.00 O ATOM 85998 H1 WAT 9080 137.647 113.475 108.834 1.00 0.00 H ATOM 85999 H2 WAT 9080 137.938 114.940 108.590 1.00 0.00 H TER 86001 WAT 9080 ATOM 86001 O WAT 9081 67.012 144.868 143.761 1.00 0.00 O ATOM 86002 H1 WAT 9081 67.944 144.710 143.611 1.00 0.00 H ATOM 86003 H2 WAT 9081 66.990 145.537 144.445 1.00 0.00 H TER 86005 WAT 9081 ATOM 86005 O WAT 9082 25.545 145.740 140.915 1.00 0.00 O ATOM 86006 H1 WAT 9082 24.765 145.400 141.354 1.00 0.00 H ATOM 86007 H2 WAT 9082 26.270 145.248 141.300 1.00 0.00 H TER 86009 WAT 9082 ATOM 86009 O WAT 9083 101.686 32.774 142.972 1.00 0.00 O ATOM 86010 H1 WAT 9083 101.037 33.451 142.780 1.00 0.00 H ATOM 86011 H2 WAT 9083 101.732 32.750 143.928 1.00 0.00 H TER 86013 WAT 9083 ATOM 86013 O WAT 9084 108.121 55.916 70.165 1.00 0.00 O ATOM 86014 H1 WAT 9084 108.800 56.475 70.542 1.00 0.00 H ATOM 86015 H2 WAT 9084 108.416 55.024 70.347 1.00 0.00 H TER 86017 WAT 9084 ATOM 86017 O WAT 9085 49.877 49.627 106.131 1.00 0.00 O ATOM 86018 H1 WAT 9085 50.628 49.351 106.657 1.00 0.00 H ATOM 86019 H2 WAT 9085 49.990 49.173 105.296 1.00 0.00 H TER 86021 WAT 9085 ATOM 86021 O WAT 9086 90.837 112.057 103.941 1.00 0.00 O ATOM 86022 H1 WAT 9086 91.726 111.877 104.249 1.00 0.00 H ATOM 86023 H2 WAT 9086 90.283 111.468 104.453 1.00 0.00 H TER 86025 WAT 9086 ATOM 86025 O WAT 9087 144.035 123.379 94.095 1.00 0.00 O ATOM 86026 H1 WAT 9087 143.606 123.501 93.248 1.00 0.00 H ATOM 86027 H2 WAT 9087 143.322 123.419 94.732 1.00 0.00 H TER 86029 WAT 9087 ATOM 86029 O WAT 9088 95.110 36.419 85.663 1.00 0.00 O ATOM 86030 H1 WAT 9088 94.950 37.228 86.149 1.00 0.00 H ATOM 86031 H2 WAT 9088 95.145 35.739 86.336 1.00 0.00 H TER 86033 WAT 9088 ATOM 86033 O WAT 9089 89.664 71.200 21.131 1.00 0.00 O ATOM 86034 H1 WAT 9089 90.481 70.934 21.553 1.00 0.00 H ATOM 86035 H2 WAT 9089 89.229 70.377 20.911 1.00 0.00 H TER 86037 WAT 9089 ATOM 86037 O WAT 9090 97.883 100.661 119.248 1.00 0.00 O ATOM 86038 H1 WAT 9090 97.190 100.226 118.753 1.00 0.00 H ATOM 86039 H2 WAT 9090 98.689 100.433 118.784 1.00 0.00 H TER 86041 WAT 9090 ATOM 86041 O WAT 9091 142.362 138.623 79.292 1.00 0.00 O ATOM 86042 H1 WAT 9091 142.434 139.257 78.579 1.00 0.00 H ATOM 86043 H2 WAT 9091 143.136 138.068 79.198 1.00 0.00 H TER 86045 WAT 9091 ATOM 86045 O WAT 9092 93.018 132.473 132.658 1.00 0.00 O ATOM 86046 H1 WAT 9092 92.743 132.167 131.793 1.00 0.00 H ATOM 86047 H2 WAT 9092 93.967 132.567 132.588 1.00 0.00 H TER 86049 WAT 9092 ATOM 86049 O WAT 9093 114.485 87.752 72.623 1.00 0.00 O ATOM 86050 H1 WAT 9093 114.936 88.563 72.390 1.00 0.00 H ATOM 86051 H2 WAT 9093 114.823 87.531 73.491 1.00 0.00 H TER 86053 WAT 9093 ATOM 86053 O WAT 9094 77.079 102.436 104.102 1.00 0.00 O ATOM 86054 H1 WAT 9094 76.688 103.294 103.936 1.00 0.00 H ATOM 86055 H2 WAT 9094 77.219 102.414 105.048 1.00 0.00 H TER 86057 WAT 9094 ATOM 86057 O WAT 9095 127.720 1.258 108.953 1.00 0.00 O ATOM 86058 H1 WAT 9095 127.289 0.779 108.246 1.00 0.00 H ATOM 86059 H2 WAT 9095 127.416 0.829 109.753 1.00 0.00 H TER 86061 WAT 9095 ATOM 86061 O WAT 9096 8.032 7.595 152.296 1.00 0.00 O ATOM 86062 H1 WAT 9096 7.835 6.920 151.646 1.00 0.00 H ATOM 86063 H2 WAT 9096 7.875 7.169 153.138 1.00 0.00 H TER 86065 WAT 9096 ATOM 86065 O WAT 9097 47.208 49.247 136.600 1.00 0.00 O ATOM 86066 H1 WAT 9097 46.255 49.208 136.680 1.00 0.00 H ATOM 86067 H2 WAT 9097 47.398 48.804 135.773 1.00 0.00 H TER 86069 WAT 9097 ATOM 86069 O WAT 9098 66.193 139.739 141.296 1.00 0.00 O ATOM 86070 H1 WAT 9098 66.008 139.168 142.042 1.00 0.00 H ATOM 86071 H2 WAT 9098 66.434 139.140 140.590 1.00 0.00 H TER 86073 WAT 9098 ATOM 86073 O WAT 9099 40.521 95.213 120.729 1.00 0.00 O ATOM 86074 H1 WAT 9099 39.743 95.328 120.183 1.00 0.00 H ATOM 86075 H2 WAT 9099 40.295 95.631 121.560 1.00 0.00 H TER 86077 WAT 9099 ATOM 86077 O WAT 9100 72.810 105.411 105.080 1.00 0.00 O ATOM 86078 H1 WAT 9100 71.868 105.240 105.097 1.00 0.00 H ATOM 86079 H2 WAT 9100 73.079 105.185 104.190 1.00 0.00 H TER 86081 WAT 9100 ATOM 86081 O WAT 9101 68.825 40.397 21.848 1.00 0.00 O ATOM 86082 H1 WAT 9101 69.420 40.938 22.367 1.00 0.00 H ATOM 86083 H2 WAT 9101 68.052 40.292 22.403 1.00 0.00 H TER 86085 WAT 9101 ATOM 86085 O WAT 9102 99.357 105.473 149.058 1.00 0.00 O ATOM 86086 H1 WAT 9102 100.098 104.870 149.116 1.00 0.00 H ATOM 86087 H2 WAT 9102 99.284 105.674 148.125 1.00 0.00 H TER 86089 WAT 9102 ATOM 86089 O WAT 9103 140.793 95.740 5.578 1.00 0.00 O ATOM 86090 H1 WAT 9103 141.728 95.551 5.656 1.00 0.00 H ATOM 86091 H2 WAT 9103 140.489 95.825 6.482 1.00 0.00 H TER 86093 WAT 9103 ATOM 86093 O WAT 9104 104.162 6.657 107.098 1.00 0.00 O ATOM 86094 H1 WAT 9104 103.493 6.167 106.621 1.00 0.00 H ATOM 86095 H2 WAT 9104 104.954 6.126 107.012 1.00 0.00 H TER 86097 WAT 9104 ATOM 86097 O WAT 9105 2.609 69.306 77.465 1.00 0.00 O ATOM 86098 H1 WAT 9105 2.130 69.599 78.240 1.00 0.00 H ATOM 86099 H2 WAT 9105 2.011 68.699 77.028 1.00 0.00 H TER 86101 WAT 9105 ATOM 86101 O WAT 9106 9.088 131.412 140.063 1.00 0.00 O ATOM 86102 H1 WAT 9106 9.154 130.564 140.502 1.00 0.00 H ATOM 86103 H2 WAT 9106 9.889 131.476 139.544 1.00 0.00 H TER 86105 WAT 9106 ATOM 86105 O WAT 9107 84.561 68.232 18.372 1.00 0.00 O ATOM 86106 H1 WAT 9107 85.489 68.222 18.606 1.00 0.00 H ATOM 86107 H2 WAT 9107 84.438 69.064 17.915 1.00 0.00 H TER 86109 WAT 9107 ATOM 86109 O WAT 9108 63.209 130.848 3.640 1.00 0.00 O ATOM 86110 H1 WAT 9108 62.783 131.699 3.542 1.00 0.00 H ATOM 86111 H2 WAT 9108 63.147 130.655 4.576 1.00 0.00 H TER 86113 WAT 9108 ATOM 86113 O WAT 9109 35.554 31.968 121.132 1.00 0.00 O ATOM 86114 H1 WAT 9109 35.361 31.743 120.222 1.00 0.00 H ATOM 86115 H2 WAT 9109 34.867 31.531 121.637 1.00 0.00 H TER 86117 WAT 9109 ATOM 86117 O WAT 9110 66.093 56.104 138.175 1.00 0.00 O ATOM 86118 H1 WAT 9110 66.917 56.209 137.698 1.00 0.00 H ATOM 86119 H2 WAT 9110 65.968 56.940 138.624 1.00 0.00 H TER 86121 WAT 9110 ATOM 86121 O WAT 9111 143.924 103.900 154.278 1.00 0.00 O ATOM 86122 H1 WAT 9111 144.193 104.811 154.394 1.00 0.00 H ATOM 86123 H2 WAT 9111 143.567 103.867 153.391 1.00 0.00 H TER 86125 WAT 9111 ATOM 86125 O WAT 9112 55.969 98.631 124.745 1.00 0.00 O ATOM 86126 H1 WAT 9112 55.852 99.557 124.955 1.00 0.00 H ATOM 86127 H2 WAT 9112 55.671 98.168 125.528 1.00 0.00 H TER 86129 WAT 9112 ATOM 86129 O WAT 9113 140.055 120.897 14.915 1.00 0.00 O ATOM 86130 H1 WAT 9113 140.766 121.250 14.380 1.00 0.00 H ATOM 86131 H2 WAT 9113 140.047 119.961 14.714 1.00 0.00 H TER 86133 WAT 9113 ATOM 86133 O WAT 9114 69.351 42.213 8.381 1.00 0.00 O ATOM 86134 H1 WAT 9114 70.064 41.586 8.505 1.00 0.00 H ATOM 86135 H2 WAT 9114 69.139 42.153 7.449 1.00 0.00 H TER 86137 WAT 9114 ATOM 86137 O WAT 9115 70.398 19.025 93.683 1.00 0.00 O ATOM 86138 H1 WAT 9115 70.398 18.873 94.628 1.00 0.00 H ATOM 86139 H2 WAT 9115 69.567 18.658 93.382 1.00 0.00 H TER 86141 WAT 9115 ATOM 86141 O WAT 9116 120.108 114.181 157.472 1.00 0.00 O ATOM 86142 H1 WAT 9116 120.816 113.983 156.858 1.00 0.00 H ATOM 86143 H2 WAT 9116 119.779 115.034 157.192 1.00 0.00 H TER 86145 WAT 9116 ATOM 86145 O WAT 9117 73.189 100.098 80.753 1.00 0.00 O ATOM 86146 H1 WAT 9117 74.128 100.173 80.924 1.00 0.00 H ATOM 86147 H2 WAT 9117 72.939 100.955 80.409 1.00 0.00 H TER 86149 WAT 9117 ATOM 86149 O WAT 9118 36.033 35.228 136.752 1.00 0.00 O ATOM 86150 H1 WAT 9118 36.737 35.527 137.328 1.00 0.00 H ATOM 86151 H2 WAT 9118 35.233 35.364 137.261 1.00 0.00 H TER 86153 WAT 9118 ATOM 86153 O WAT 9119 80.108 106.201 8.764 1.00 0.00 O ATOM 86154 H1 WAT 9119 79.561 106.849 9.209 1.00 0.00 H ATOM 86155 H2 WAT 9119 80.782 106.719 8.323 1.00 0.00 H TER 86157 WAT 9119 ATOM 86157 O WAT 9120 41.299 93.766 117.945 1.00 0.00 O ATOM 86158 H1 WAT 9120 41.695 92.940 117.668 1.00 0.00 H ATOM 86159 H2 WAT 9120 40.433 93.765 117.539 1.00 0.00 H TER 86161 WAT 9120 ATOM 86161 O WAT 9121 89.691 19.168 136.346 1.00 0.00 O ATOM 86162 H1 WAT 9121 90.232 18.404 136.545 1.00 0.00 H ATOM 86163 H2 WAT 9121 89.037 19.187 137.045 1.00 0.00 H TER 86165 WAT 9121 ATOM 86165 O WAT 9122 47.162 79.487 20.827 1.00 0.00 O ATOM 86166 H1 WAT 9122 46.395 79.205 20.330 1.00 0.00 H ATOM 86167 H2 WAT 9122 46.954 79.264 21.735 1.00 0.00 H TER 86169 WAT 9122 ATOM 86169 O WAT 9123 64.438 28.618 155.549 1.00 0.00 O ATOM 86170 H1 WAT 9123 64.414 28.806 154.610 1.00 0.00 H ATOM 86171 H2 WAT 9123 64.224 27.688 155.613 1.00 0.00 H TER 86173 WAT 9123 ATOM 86173 O WAT 9124 4.121 30.558 77.238 1.00 0.00 O ATOM 86174 H1 WAT 9124 5.015 30.894 77.292 1.00 0.00 H ATOM 86175 H2 WAT 9124 3.630 31.080 77.872 1.00 0.00 H TER 86177 WAT 9124 ATOM 86177 O WAT 9125 87.479 21.951 98.822 1.00 0.00 O ATOM 86178 H1 WAT 9125 86.563 21.676 98.875 1.00 0.00 H ATOM 86179 H2 WAT 9125 87.940 21.363 99.420 1.00 0.00 H TER 86181 WAT 9125 ATOM 86181 O WAT 9126 133.313 133.926 132.567 1.00 0.00 O ATOM 86182 H1 WAT 9126 132.938 134.085 133.433 1.00 0.00 H ATOM 86183 H2 WAT 9126 133.974 133.248 132.712 1.00 0.00 H TER 86185 WAT 9126 ATOM 86185 O WAT 9127 114.055 36.245 120.546 1.00 0.00 O ATOM 86186 H1 WAT 9127 113.515 36.143 121.329 1.00 0.00 H ATOM 86187 H2 WAT 9127 113.476 36.662 119.908 1.00 0.00 H TER 86189 WAT 9127 ATOM 86189 O WAT 9128 108.563 117.234 65.880 1.00 0.00 O ATOM 86190 H1 WAT 9128 108.062 117.967 66.237 1.00 0.00 H ATOM 86191 H2 WAT 9128 108.086 116.979 65.091 1.00 0.00 H TER 86193 WAT 9128 ATOM 86193 O WAT 9129 119.076 87.539 0.121 1.00 0.00 O ATOM 86194 H1 WAT 9129 119.454 88.389 0.349 1.00 0.00 H ATOM 86195 H2 WAT 9129 119.626 86.903 0.579 1.00 0.00 H TER 86197 WAT 9129 ATOM 86197 O WAT 9130 141.118 57.420 142.676 1.00 0.00 O ATOM 86198 H1 WAT 9130 141.492 56.770 143.271 1.00 0.00 H ATOM 86199 H2 WAT 9130 140.831 58.132 143.247 1.00 0.00 H TER 86201 WAT 9130 ATOM 86201 O WAT 9131 47.782 65.081 3.340 1.00 0.00 O ATOM 86202 H1 WAT 9131 47.987 64.464 2.638 1.00 0.00 H ATOM 86203 H2 WAT 9131 46.845 64.962 3.497 1.00 0.00 H TER 86205 WAT 9131 ATOM 86205 O WAT 9132 143.847 71.947 66.049 1.00 0.00 O ATOM 86206 H1 WAT 9132 143.501 72.564 66.693 1.00 0.00 H ATOM 86207 H2 WAT 9132 143.071 71.593 65.615 1.00 0.00 H TER 86209 WAT 9132 ATOM 86209 O WAT 9133 17.826 32.052 120.227 1.00 0.00 O ATOM 86210 H1 WAT 9133 18.299 31.239 120.406 1.00 0.00 H ATOM 86211 H2 WAT 9133 17.080 31.782 119.691 1.00 0.00 H TER 86213 WAT 9133 ATOM 86213 O WAT 9134 126.637 3.288 103.836 1.00 0.00 O ATOM 86214 H1 WAT 9134 126.883 3.339 102.912 1.00 0.00 H ATOM 86215 H2 WAT 9134 127.461 3.127 104.295 1.00 0.00 H TER 86217 WAT 9134 ATOM 86217 O WAT 9135 126.069 66.591 72.996 1.00 0.00 O ATOM 86218 H1 WAT 9135 125.318 66.641 72.404 1.00 0.00 H ATOM 86219 H2 WAT 9135 126.823 66.796 72.443 1.00 0.00 H TER 86221 WAT 9135 ATOM 86221 O WAT 9136 124.080 141.280 19.667 1.00 0.00 O ATOM 86222 H1 WAT 9136 124.603 140.633 20.140 1.00 0.00 H ATOM 86223 H2 WAT 9136 124.318 142.117 20.066 1.00 0.00 H TER 86225 WAT 9136 ATOM 86225 O WAT 9137 142.511 13.730 122.171 1.00 0.00 O ATOM 86226 H1 WAT 9137 142.654 12.785 122.227 1.00 0.00 H ATOM 86227 H2 WAT 9137 141.754 13.824 121.593 1.00 0.00 H TER 86229 WAT 9137 ATOM 86229 O WAT 9138 20.515 114.125 150.285 1.00 0.00 O ATOM 86230 H1 WAT 9138 20.072 114.968 150.189 1.00 0.00 H ATOM 86231 H2 WAT 9138 19.928 113.496 149.866 1.00 0.00 H TER 86233 WAT 9138 ATOM 86233 O WAT 9139 21.051 41.358 25.864 1.00 0.00 O ATOM 86234 H1 WAT 9139 20.198 41.756 26.038 1.00 0.00 H ATOM 86235 H2 WAT 9139 21.197 41.502 24.929 1.00 0.00 H TER 86237 WAT 9139 ATOM 86237 O WAT 9140 66.192 135.574 142.464 1.00 0.00 O ATOM 86238 H1 WAT 9140 66.547 135.129 143.234 1.00 0.00 H ATOM 86239 H2 WAT 9140 65.276 135.300 142.431 1.00 0.00 H TER 86241 WAT 9140 ATOM 86241 O WAT 9141 127.512 65.935 83.755 1.00 0.00 O ATOM 86242 H1 WAT 9141 126.984 66.228 84.498 1.00 0.00 H ATOM 86243 H2 WAT 9141 128.282 65.529 84.154 1.00 0.00 H TER 86245 WAT 9141 ATOM 86245 O WAT 9142 143.646 139.044 118.911 1.00 0.00 O ATOM 86246 H1 WAT 9142 143.386 138.147 118.703 1.00 0.00 H ATOM 86247 H2 WAT 9142 144.283 139.272 118.233 1.00 0.00 H TER 86249 WAT 9142 ATOM 86249 O WAT 9143 73.212 89.127 157.304 1.00 0.00 O ATOM 86250 H1 WAT 9143 74.079 88.721 157.293 1.00 0.00 H ATOM 86251 H2 WAT 9143 73.379 90.043 157.525 1.00 0.00 H TER 86253 WAT 9143 ATOM 86253 O WAT 9144 138.713 46.727 116.383 1.00 0.00 O ATOM 86254 H1 WAT 9144 138.807 45.777 116.455 1.00 0.00 H ATOM 86255 H2 WAT 9144 138.034 46.949 117.020 1.00 0.00 H TER 86257 WAT 9144 ATOM 86257 O WAT 9145 102.233 14.088 67.221 1.00 0.00 O ATOM 86258 H1 WAT 9145 102.621 14.708 67.838 1.00 0.00 H ATOM 86259 H2 WAT 9145 101.435 13.786 67.654 1.00 0.00 H TER 86261 WAT 9145 ATOM 86261 O WAT 9146 113.783 45.400 87.600 1.00 0.00 O ATOM 86262 H1 WAT 9146 113.528 45.929 86.844 1.00 0.00 H ATOM 86263 H2 WAT 9146 113.717 45.998 88.345 1.00 0.00 H TER 86265 WAT 9146 ATOM 86265 O WAT 9147 22.187 112.219 89.015 1.00 0.00 O ATOM 86266 H1 WAT 9147 21.841 112.820 88.355 1.00 0.00 H ATOM 86267 H2 WAT 9147 21.679 111.416 88.896 1.00 0.00 H TER 86269 WAT 9147 ATOM 86269 O WAT 9148 102.360 35.669 149.604 1.00 0.00 O ATOM 86270 H1 WAT 9148 101.601 36.125 149.241 1.00 0.00 H ATOM 86271 H2 WAT 9148 103.104 36.230 149.383 1.00 0.00 H TER 86273 WAT 9148 ATOM 86273 O WAT 9149 10.502 13.463 75.977 1.00 0.00 O ATOM 86274 H1 WAT 9149 11.018 12.792 75.530 1.00 0.00 H ATOM 86275 H2 WAT 9149 9.733 13.585 75.420 1.00 0.00 H TER 86277 WAT 9149 ATOM 86277 O WAT 9150 23.561 18.276 138.528 1.00 0.00 O ATOM 86278 H1 WAT 9150 23.903 18.644 137.713 1.00 0.00 H ATOM 86279 H2 WAT 9150 24.341 18.027 139.024 1.00 0.00 H TER 86281 WAT 9150 ATOM 86281 O WAT 9151 142.834 88.693 9.909 1.00 0.00 O ATOM 86282 H1 WAT 9151 143.200 89.306 9.271 1.00 0.00 H ATOM 86283 H2 WAT 9151 142.659 87.899 9.404 1.00 0.00 H TER 86285 WAT 9151 ATOM 86285 O WAT 9152 31.933 44.371 127.944 1.00 0.00 O ATOM 86286 H1 WAT 9152 31.817 44.733 127.066 1.00 0.00 H ATOM 86287 H2 WAT 9152 31.986 43.425 127.807 1.00 0.00 H TER 86289 WAT 9152 ATOM 86289 O WAT 9153 88.796 109.297 4.102 1.00 0.00 O ATOM 86290 H1 WAT 9153 89.300 109.873 4.676 1.00 0.00 H ATOM 86291 H2 WAT 9153 88.503 108.587 4.673 1.00 0.00 H TER 86293 WAT 9153 ATOM 86293 O WAT 9154 100.789 133.863 132.114 1.00 0.00 O ATOM 86294 H1 WAT 9154 101.670 133.724 131.768 1.00 0.00 H ATOM 86295 H2 WAT 9154 100.910 134.479 132.837 1.00 0.00 H TER 86297 WAT 9154 ATOM 86297 O WAT 9155 73.220 119.035 52.619 1.00 0.00 O ATOM 86298 H1 WAT 9155 73.958 119.329 53.154 1.00 0.00 H ATOM 86299 H2 WAT 9155 72.778 119.843 52.358 1.00 0.00 H TER 86301 WAT 9155 ATOM 86301 O WAT 9156 47.802 101.445 110.624 1.00 0.00 O ATOM 86302 H1 WAT 9156 47.002 101.730 110.182 1.00 0.00 H ATOM 86303 H2 WAT 9156 48.202 102.254 110.942 1.00 0.00 H TER 86305 WAT 9156 ATOM 86305 O WAT 9157 51.371 113.623 91.052 1.00 0.00 O ATOM 86306 H1 WAT 9157 51.711 114.288 91.651 1.00 0.00 H ATOM 86307 H2 WAT 9157 50.436 113.576 91.252 1.00 0.00 H TER 86309 WAT 9157 ATOM 86309 O WAT 9158 100.673 45.746 7.420 1.00 0.00 O ATOM 86310 H1 WAT 9158 100.665 45.468 8.336 1.00 0.00 H ATOM 86311 H2 WAT 9158 99.865 46.249 7.315 1.00 0.00 H TER 86313 WAT 9158 ATOM 86313 O WAT 9159 52.056 77.910 152.464 1.00 0.00 O ATOM 86314 H1 WAT 9159 52.239 77.244 151.802 1.00 0.00 H ATOM 86315 H2 WAT 9159 51.292 77.576 152.935 1.00 0.00 H TER 86317 WAT 9159 ATOM 86317 O WAT 9160 17.225 99.621 157.967 1.00 0.00 O ATOM 86318 H1 WAT 9160 16.452 99.070 158.092 1.00 0.00 H ATOM 86319 H2 WAT 9160 17.357 99.635 157.019 1.00 0.00 H TER 86321 WAT 9160 ATOM 86321 O WAT 9161 95.363 59.585 102.595 1.00 0.00 O ATOM 86322 H1 WAT 9161 95.587 60.126 103.352 1.00 0.00 H ATOM 86323 H2 WAT 9161 94.426 59.732 102.464 1.00 0.00 H TER 86325 WAT 9161 ATOM 86325 O WAT 9162 12.075 100.409 149.579 1.00 0.00 O ATOM 86326 H1 WAT 9162 12.165 100.434 148.626 1.00 0.00 H ATOM 86327 H2 WAT 9162 11.131 100.354 149.728 1.00 0.00 H TER 86329 WAT 9162 ATOM 86329 O WAT 9163 144.513 39.317 55.045 1.00 0.00 O ATOM 86330 H1 WAT 9163 144.651 40.237 54.818 1.00 0.00 H ATOM 86331 H2 WAT 9163 143.950 38.980 54.348 1.00 0.00 H TER 86333 WAT 9163 ATOM 86333 O WAT 9164 74.292 32.920 80.949 1.00 0.00 O ATOM 86334 H1 WAT 9164 74.032 33.842 80.952 1.00 0.00 H ATOM 86335 H2 WAT 9164 73.527 32.457 80.607 1.00 0.00 H TER 86337 WAT 9164 ATOM 86337 O WAT 9165 68.728 112.074 145.888 1.00 0.00 O ATOM 86338 H1 WAT 9165 68.385 112.042 146.781 1.00 0.00 H ATOM 86339 H2 WAT 9165 69.515 111.531 145.914 1.00 0.00 H TER 86341 WAT 9165 ATOM 86341 O WAT 9166 104.892 139.178 94.689 1.00 0.00 O ATOM 86342 H1 WAT 9166 103.945 139.126 94.817 1.00 0.00 H ATOM 86343 H2 WAT 9166 105.067 138.591 93.954 1.00 0.00 H TER 86345 WAT 9166 ATOM 86345 O WAT 9167 87.250 73.614 13.760 1.00 0.00 O ATOM 86346 H1 WAT 9167 87.547 74.149 14.497 1.00 0.00 H ATOM 86347 H2 WAT 9167 88.033 73.141 13.477 1.00 0.00 H TER 86349 WAT 9167 ATOM 86349 O WAT 9168 142.256 104.127 56.551 1.00 0.00 O ATOM 86350 H1 WAT 9168 142.583 103.810 55.709 1.00 0.00 H ATOM 86351 H2 WAT 9168 141.472 103.604 56.715 1.00 0.00 H TER 86353 WAT 9168 ATOM 86353 O WAT 9169 106.785 92.690 94.928 1.00 0.00 O ATOM 86354 H1 WAT 9169 107.447 92.015 95.077 1.00 0.00 H ATOM 86355 H2 WAT 9169 106.149 92.562 95.631 1.00 0.00 H TER 86357 WAT 9169 ATOM 86357 O WAT 9170 69.999 13.001 100.608 1.00 0.00 O ATOM 86358 H1 WAT 9170 70.921 12.761 100.516 1.00 0.00 H ATOM 86359 H2 WAT 9170 69.996 13.683 101.280 1.00 0.00 H TER 86361 WAT 9170 ATOM 86361 O WAT 9171 74.340 1.118 104.904 1.00 0.00 O ATOM 86362 H1 WAT 9171 74.188 1.893 104.362 1.00 0.00 H ATOM 86363 H2 WAT 9171 74.891 1.432 105.621 1.00 0.00 H TER 86365 WAT 9171 ATOM 86365 O WAT 9172 112.419 96.191 145.579 1.00 0.00 O ATOM 86366 H1 WAT 9172 112.301 96.849 146.263 1.00 0.00 H ATOM 86367 H2 WAT 9172 112.855 95.462 146.019 1.00 0.00 H TER 86369 WAT 9172 ATOM 86369 O WAT 9173 145.478 50.119 89.085 1.00 0.00 O ATOM 86370 H1 WAT 9173 144.562 49.844 89.044 1.00 0.00 H ATOM 86371 H2 WAT 9173 145.975 49.301 89.077 1.00 0.00 H TER 86373 WAT 9173 ATOM 86373 O WAT 9174 144.421 1.108 90.615 1.00 0.00 O ATOM 86374 H1 WAT 9174 143.523 1.055 90.286 1.00 0.00 H ATOM 86375 H2 WAT 9174 144.596 0.238 90.974 1.00 0.00 H TER 86377 WAT 9174 ATOM 86377 O WAT 9175 20.113 46.796 65.081 1.00 0.00 O ATOM 86378 H1 WAT 9175 20.417 47.249 64.295 1.00 0.00 H ATOM 86379 H2 WAT 9175 20.482 45.916 65.009 1.00 0.00 H TER 86381 WAT 9175 ATOM 86381 O WAT 9176 118.955 72.977 20.986 1.00 0.00 O ATOM 86382 H1 WAT 9176 118.798 73.224 21.897 1.00 0.00 H ATOM 86383 H2 WAT 9176 118.081 72.917 20.600 1.00 0.00 H TER 86385 WAT 9176 ATOM 86385 O WAT 9177 136.028 36.112 131.246 1.00 0.00 O ATOM 86386 H1 WAT 9177 135.981 35.341 131.811 1.00 0.00 H ATOM 86387 H2 WAT 9177 136.957 36.344 131.234 1.00 0.00 H TER 86389 WAT 9177 ATOM 86389 O WAT 9178 134.034 133.467 62.750 1.00 0.00 O ATOM 86390 H1 WAT 9178 134.078 132.511 62.766 1.00 0.00 H ATOM 86391 H2 WAT 9178 134.711 133.727 62.124 1.00 0.00 H TER 86393 WAT 9178 ATOM 86393 O WAT 9179 6.572 4.621 94.461 1.00 0.00 O ATOM 86394 H1 WAT 9179 7.282 5.159 94.810 1.00 0.00 H ATOM 86395 H2 WAT 9179 5.926 4.591 95.167 1.00 0.00 H TER 86397 WAT 9179 ATOM 86397 O WAT 9180 105.774 61.755 129.582 1.00 0.00 O ATOM 86398 H1 WAT 9180 106.656 61.385 129.626 1.00 0.00 H ATOM 86399 H2 WAT 9180 105.430 61.661 130.470 1.00 0.00 H TER 86401 WAT 9180 ATOM 86401 O WAT 9181 61.514 66.799 7.316 1.00 0.00 O ATOM 86402 H1 WAT 9181 62.334 67.184 7.008 1.00 0.00 H ATOM 86403 H2 WAT 9181 61.324 67.261 8.133 1.00 0.00 H TER 86405 WAT 9181 ATOM 86405 O WAT 9182 119.096 32.170 157.184 1.00 0.00 O ATOM 86406 H1 WAT 9182 119.832 32.627 156.778 1.00 0.00 H ATOM 86407 H2 WAT 9182 118.487 32.867 157.428 1.00 0.00 H TER 86409 WAT 9182 ATOM 86409 O WAT 9183 101.789 46.030 151.302 1.00 0.00 O ATOM 86410 H1 WAT 9183 101.564 46.477 150.487 1.00 0.00 H ATOM 86411 H2 WAT 9183 102.624 46.417 151.565 1.00 0.00 H TER 86413 WAT 9183 ATOM 86413 O WAT 9184 70.660 76.165 80.578 1.00 0.00 O ATOM 86414 H1 WAT 9184 69.773 76.170 80.217 1.00 0.00 H ATOM 86415 H2 WAT 9184 70.970 75.270 80.440 1.00 0.00 H TER 86417 WAT 9184 ATOM 86417 O WAT 9185 126.654 17.524 73.333 1.00 0.00 O ATOM 86418 H1 WAT 9185 127.086 18.018 74.030 1.00 0.00 H ATOM 86419 H2 WAT 9185 127.283 17.528 72.611 1.00 0.00 H TER 86421 WAT 9185 ATOM 86421 O WAT 9186 66.303 30.745 97.684 1.00 0.00 O ATOM 86422 H1 WAT 9186 67.099 30.666 98.210 1.00 0.00 H ATOM 86423 H2 WAT 9186 65.596 30.805 98.326 1.00 0.00 H TER 86425 WAT 9186 ATOM 86425 O WAT 9187 15.324 49.646 93.545 1.00 0.00 O ATOM 86426 H1 WAT 9187 16.200 49.519 93.180 1.00 0.00 H ATOM 86427 H2 WAT 9187 15.094 50.544 93.307 1.00 0.00 H TER 86429 WAT 9187 ATOM 86429 O WAT 9188 82.430 120.978 111.641 1.00 0.00 O ATOM 86430 H1 WAT 9188 83.295 120.587 111.760 1.00 0.00 H ATOM 86431 H2 WAT 9188 82.529 121.553 110.882 1.00 0.00 H TER 86433 WAT 9188 ATOM 86433 O WAT 9189 62.614 65.771 2.946 1.00 0.00 O ATOM 86434 H1 WAT 9189 62.270 66.653 3.087 1.00 0.00 H ATOM 86435 H2 WAT 9189 61.878 65.283 2.576 1.00 0.00 H TER 86437 WAT 9189 ATOM 86437 O WAT 9190 125.276 105.890 127.460 1.00 0.00 O ATOM 86438 H1 WAT 9190 124.944 106.106 126.589 1.00 0.00 H ATOM 86439 H2 WAT 9190 124.895 106.556 128.034 1.00 0.00 H TER 86441 WAT 9190 ATOM 86441 O WAT 9191 99.164 145.884 6.839 1.00 0.00 O ATOM 86442 H1 WAT 9191 99.435 145.154 7.397 1.00 0.00 H ATOM 86443 H2 WAT 9191 98.434 146.286 7.309 1.00 0.00 H TER 86445 WAT 9191 ATOM 86445 O WAT 9192 97.218 136.886 139.577 1.00 0.00 O ATOM 86446 H1 WAT 9192 98.007 137.203 139.138 1.00 0.00 H ATOM 86447 H2 WAT 9192 97.489 136.070 139.997 1.00 0.00 H TER 86449 WAT 9192 ATOM 86449 O WAT 9193 120.990 40.739 20.880 1.00 0.00 O ATOM 86450 H1 WAT 9193 121.000 39.871 20.477 1.00 0.00 H ATOM 86451 H2 WAT 9193 121.914 40.956 21.005 1.00 0.00 H TER 86453 WAT 9193 ATOM 86453 O WAT 9194 45.687 110.456 92.178 1.00 0.00 O ATOM 86454 H1 WAT 9194 45.376 110.543 91.277 1.00 0.00 H ATOM 86455 H2 WAT 9194 45.084 109.832 92.580 1.00 0.00 H TER 86457 WAT 9194 ATOM 86457 O WAT 9195 125.736 56.259 148.335 1.00 0.00 O ATOM 86458 H1 WAT 9195 126.235 55.680 147.758 1.00 0.00 H ATOM 86459 H2 WAT 9195 126.402 56.781 148.783 1.00 0.00 H TER 86461 WAT 9195 ATOM 86461 O WAT 9196 85.734 73.507 61.995 1.00 0.00 O ATOM 86462 H1 WAT 9196 85.381 72.754 61.521 1.00 0.00 H ATOM 86463 H2 WAT 9196 86.136 74.050 61.316 1.00 0.00 H TER 86465 WAT 9196 ATOM 86465 O WAT 9197 64.267 55.509 25.639 1.00 0.00 O ATOM 86466 H1 WAT 9197 63.397 55.551 25.241 1.00 0.00 H ATOM 86467 H2 WAT 9197 64.198 56.055 26.423 1.00 0.00 H TER 86469 WAT 9197 ATOM 86469 O WAT 9198 133.992 47.589 101.975 1.00 0.00 O ATOM 86470 H1 WAT 9198 133.557 46.982 101.376 1.00 0.00 H ATOM 86471 H2 WAT 9198 133.318 48.231 102.197 1.00 0.00 H TER 86473 WAT 9198 ATOM 86473 O WAT 9199 61.865 50.030 60.609 1.00 0.00 O ATOM 86474 H1 WAT 9199 62.443 49.983 61.370 1.00 0.00 H ATOM 86475 H2 WAT 9199 62.221 50.744 60.081 1.00 0.00 H TER 86477 WAT 9199 ATOM 86477 O WAT 9200 97.109 84.036 147.112 1.00 0.00 O ATOM 86478 H1 WAT 9200 96.477 84.667 147.455 1.00 0.00 H ATOM 86479 H2 WAT 9200 97.897 84.176 147.639 1.00 0.00 H TER 86481 WAT 9200 ATOM 86481 O WAT 9201 57.607 18.274 107.237 1.00 0.00 O ATOM 86482 H1 WAT 9201 56.753 18.123 106.830 1.00 0.00 H ATOM 86483 H2 WAT 9201 58.168 18.561 106.517 1.00 0.00 H TER 86485 WAT 9201 ATOM 86485 O WAT 9202 15.230 28.804 156.235 1.00 0.00 O ATOM 86486 H1 WAT 9202 14.768 28.000 155.995 1.00 0.00 H ATOM 86487 H2 WAT 9202 16.145 28.537 156.324 1.00 0.00 H TER 86489 WAT 9202 ATOM 86489 O WAT 9203 83.776 108.556 73.603 1.00 0.00 O ATOM 86490 H1 WAT 9203 84.174 109.380 73.885 1.00 0.00 H ATOM 86491 H2 WAT 9203 82.985 108.478 74.135 1.00 0.00 H TER 86493 WAT 9203 ATOM 86493 O WAT 9204 145.225 143.333 0.409 1.00 0.00 O ATOM 86494 H1 WAT 9204 145.704 143.563 1.205 1.00 0.00 H ATOM 86495 H2 WAT 9204 144.529 142.749 0.708 1.00 0.00 H TER 86497 WAT 9204 ATOM 86497 O WAT 9205 0.579 44.467 104.247 1.00 0.00 O ATOM 86498 H1 WAT 9205 1.511 44.318 104.408 1.00 0.00 H ATOM 86499 H2 WAT 9205 0.556 45.213 103.648 1.00 0.00 H TER 86501 WAT 9205 ATOM 86501 O WAT 9206 25.411 16.075 20.472 1.00 0.00 O ATOM 86502 H1 WAT 9206 25.519 17.024 20.537 1.00 0.00 H ATOM 86503 H2 WAT 9206 26.286 15.722 20.632 1.00 0.00 H TER 86505 WAT 9206 ATOM 86505 O WAT 9207 68.928 86.867 121.844 1.00 0.00 O ATOM 86506 H1 WAT 9207 68.942 86.334 122.639 1.00 0.00 H ATOM 86507 H2 WAT 9207 68.827 87.765 122.158 1.00 0.00 H TER 86509 WAT 9207 ATOM 86509 O WAT 9208 120.345 8.097 78.007 1.00 0.00 O ATOM 86510 H1 WAT 9208 121.087 8.582 77.645 1.00 0.00 H ATOM 86511 H2 WAT 9208 120.709 7.627 78.757 1.00 0.00 H TER 86513 WAT 9208 ATOM 86513 O WAT 9209 105.954 64.538 104.424 1.00 0.00 O ATOM 86514 H1 WAT 9209 106.584 64.856 103.777 1.00 0.00 H ATOM 86515 H2 WAT 9209 105.109 64.869 104.119 1.00 0.00 H TER 86517 WAT 9209 ATOM 86517 O WAT 9210 134.054 42.729 21.668 1.00 0.00 O ATOM 86518 H1 WAT 9210 134.594 43.470 21.942 1.00 0.00 H ATOM 86519 H2 WAT 9210 133.259 43.130 21.316 1.00 0.00 H TER 86521 WAT 9210 ATOM 86521 O WAT 9211 117.969 73.868 101.569 1.00 0.00 O ATOM 86522 H1 WAT 9211 118.538 73.319 102.108 1.00 0.00 H ATOM 86523 H2 WAT 9211 117.662 74.552 102.163 1.00 0.00 H TER 86525 WAT 9211 ATOM 86525 O WAT 9212 56.092 86.224 78.404 1.00 0.00 O ATOM 86526 H1 WAT 9212 56.570 86.264 77.576 1.00 0.00 H ATOM 86527 H2 WAT 9212 56.565 86.822 78.983 1.00 0.00 H TER 86529 WAT 9212 ATOM 86529 O WAT 9213 64.433 50.358 154.961 1.00 0.00 O ATOM 86530 H1 WAT 9213 64.219 49.701 154.298 1.00 0.00 H ATOM 86531 H2 WAT 9213 64.892 51.045 154.477 1.00 0.00 H TER 86533 WAT 9213 ATOM 86533 O WAT 9214 139.266 121.091 12.168 1.00 0.00 O ATOM 86534 H1 WAT 9214 139.642 121.854 11.730 1.00 0.00 H ATOM 86535 H2 WAT 9214 139.310 121.304 13.100 1.00 0.00 H TER 86537 WAT 9214 ATOM 86537 O WAT 9215 101.241 11.194 137.429 1.00 0.00 O ATOM 86538 H1 WAT 9215 101.037 12.077 137.120 1.00 0.00 H ATOM 86539 H2 WAT 9215 102.165 11.235 137.677 1.00 0.00 H TER 86541 WAT 9215 ATOM 86541 O WAT 9216 95.106 98.632 73.952 1.00 0.00 O ATOM 86542 H1 WAT 9216 94.990 99.343 73.322 1.00 0.00 H ATOM 86543 H2 WAT 9216 94.243 98.522 74.351 1.00 0.00 H TER 86545 WAT 9216 ATOM 86545 O WAT 9217 26.943 16.896 78.946 1.00 0.00 O ATOM 86546 H1 WAT 9217 27.376 17.389 79.642 1.00 0.00 H ATOM 86547 H2 WAT 9217 27.084 17.420 78.157 1.00 0.00 H TER 86549 WAT 9217 ATOM 86549 O WAT 9218 139.801 111.006 18.875 1.00 0.00 O ATOM 86550 H1 WAT 9218 139.143 111.550 19.308 1.00 0.00 H ATOM 86551 H2 WAT 9218 140.556 111.584 18.764 1.00 0.00 H TER 86553 WAT 9218 ATOM 86553 O WAT 9219 51.514 14.022 108.321 1.00 0.00 O ATOM 86554 H1 WAT 9219 52.181 14.529 107.858 1.00 0.00 H ATOM 86555 H2 WAT 9219 51.967 13.673 109.088 1.00 0.00 H TER 86557 WAT 9219 ATOM 86557 O WAT 9220 77.574 101.479 117.191 1.00 0.00 O ATOM 86558 H1 WAT 9220 78.140 102.245 117.291 1.00 0.00 H ATOM 86559 H2 WAT 9220 76.686 101.823 117.289 1.00 0.00 H TER 86561 WAT 9220 ATOM 86561 O WAT 9221 20.994 91.175 90.909 1.00 0.00 O ATOM 86562 H1 WAT 9221 20.041 91.110 90.846 1.00 0.00 H ATOM 86563 H2 WAT 9221 21.294 90.267 90.943 1.00 0.00 H TER 86565 WAT 9221 ATOM 86565 O WAT 9222 30.026 74.982 84.676 1.00 0.00 O ATOM 86566 H1 WAT 9222 29.604 75.386 83.918 1.00 0.00 H ATOM 86567 H2 WAT 9222 30.349 74.142 84.351 1.00 0.00 H TER 86569 WAT 9222 ATOM 86569 O WAT 9223 115.044 79.147 64.508 1.00 0.00 O ATOM 86570 H1 WAT 9223 114.400 79.547 65.093 1.00 0.00 H ATOM 86571 H2 WAT 9223 115.413 79.882 64.019 1.00 0.00 H TER 86573 WAT 9223 ATOM 86573 O WAT 9224 17.721 16.434 14.630 1.00 0.00 O ATOM 86574 H1 WAT 9224 18.286 16.132 13.919 1.00 0.00 H ATOM 86575 H2 WAT 9224 16.868 16.569 14.216 1.00 0.00 H TER 86577 WAT 9224 ATOM 86577 O WAT 9225 24.938 132.586 133.218 1.00 0.00 O ATOM 86578 H1 WAT 9225 25.196 132.996 134.044 1.00 0.00 H ATOM 86579 H2 WAT 9225 25.664 132.000 133.004 1.00 0.00 H TER 86581 WAT 9225 ATOM 86581 O WAT 9226 76.139 10.212 94.319 1.00 0.00 O ATOM 86582 H1 WAT 9226 76.786 10.799 94.711 1.00 0.00 H ATOM 86583 H2 WAT 9226 76.621 9.402 94.151 1.00 0.00 H TER 86585 WAT 9226 ATOM 86585 O WAT 9227 130.823 122.801 146.684 1.00 0.00 O ATOM 86586 H1 WAT 9227 131.101 122.961 147.586 1.00 0.00 H ATOM 86587 H2 WAT 9227 130.846 121.848 146.592 1.00 0.00 H TER 86589 WAT 9227 ATOM 86589 O WAT 9228 6.403 76.096 2.430 1.00 0.00 O ATOM 86590 H1 WAT 9228 6.662 75.491 1.734 1.00 0.00 H ATOM 86591 H2 WAT 9228 5.984 76.824 1.971 1.00 0.00 H TER 86593 WAT 9228 ATOM 86593 O WAT 9229 142.379 6.420 132.441 1.00 0.00 O ATOM 86594 H1 WAT 9229 142.700 6.261 133.328 1.00 0.00 H ATOM 86595 H2 WAT 9229 142.347 5.552 132.038 1.00 0.00 H TER 86597 WAT 9229 ATOM 86597 O WAT 9230 119.121 92.117 144.991 1.00 0.00 O ATOM 86598 H1 WAT 9230 119.379 92.570 144.188 1.00 0.00 H ATOM 86599 H2 WAT 9230 118.467 91.479 144.706 1.00 0.00 H TER 86601 WAT 9230 ATOM 86601 O WAT 9231 26.608 14.966 84.570 1.00 0.00 O ATOM 86602 H1 WAT 9231 26.906 14.927 85.479 1.00 0.00 H ATOM 86603 H2 WAT 9231 27.406 14.865 84.051 1.00 0.00 H TER 86605 WAT 9231 ATOM 86605 O WAT 9232 16.860 136.053 20.067 1.00 0.00 O ATOM 86606 H1 WAT 9232 16.255 135.707 19.410 1.00 0.00 H ATOM 86607 H2 WAT 9232 17.060 135.303 20.627 1.00 0.00 H TER 86609 WAT 9232 ATOM 86609 O WAT 9233 115.545 44.938 61.003 1.00 0.00 O ATOM 86610 H1 WAT 9233 114.805 44.439 60.659 1.00 0.00 H ATOM 86611 H2 WAT 9233 115.393 45.833 60.701 1.00 0.00 H TER 86613 WAT 9233 ATOM 86613 O WAT 9234 95.685 143.581 149.710 1.00 0.00 O ATOM 86614 H1 WAT 9234 96.348 143.919 149.107 1.00 0.00 H ATOM 86615 H2 WAT 9234 94.875 143.580 149.200 1.00 0.00 H TER 86617 WAT 9234 ATOM 86617 O WAT 9235 13.509 80.407 86.407 1.00 0.00 O ATOM 86618 H1 WAT 9235 12.757 80.114 86.922 1.00 0.00 H ATOM 86619 H2 WAT 9235 13.279 81.294 86.130 1.00 0.00 H TER 86621 WAT 9235 ATOM 86621 O WAT 9236 70.282 69.790 8.828 1.00 0.00 O ATOM 86622 H1 WAT 9236 70.406 68.843 8.887 1.00 0.00 H ATOM 86623 H2 WAT 9236 70.626 70.024 7.966 1.00 0.00 H TER 86625 WAT 9236 ATOM 86625 O WAT 9237 55.071 109.326 17.065 1.00 0.00 O ATOM 86626 H1 WAT 9237 55.428 109.013 17.897 1.00 0.00 H ATOM 86627 H2 WAT 9237 55.842 109.562 16.549 1.00 0.00 H TER 86629 WAT 9237 ATOM 86629 O WAT 9238 67.926 111.016 9.920 1.00 0.00 O ATOM 86630 H1 WAT 9238 68.132 110.393 9.224 1.00 0.00 H ATOM 86631 H2 WAT 9238 67.682 110.469 10.667 1.00 0.00 H TER 86633 WAT 9238 ATOM 86633 O WAT 9239 80.309 54.349 152.889 1.00 0.00 O ATOM 86634 H1 WAT 9239 79.735 54.927 152.387 1.00 0.00 H ATOM 86635 H2 WAT 9239 80.042 54.477 153.799 1.00 0.00 H TER 86637 WAT 9239 ATOM 86637 O WAT 9240 44.486 0.638 60.319 1.00 0.00 O ATOM 86638 H1 WAT 9240 45.001 0.282 59.595 1.00 0.00 H ATOM 86639 H2 WAT 9240 45.099 0.672 61.054 1.00 0.00 H TER 86641 WAT 9240 ATOM 86641 O WAT 9241 72.844 67.461 12.464 1.00 0.00 O ATOM 86642 H1 WAT 9241 73.226 68.254 12.089 1.00 0.00 H ATOM 86643 H2 WAT 9241 73.321 66.744 12.046 1.00 0.00 H TER 86645 WAT 9241 ATOM 86645 O WAT 9242 65.476 95.417 58.510 1.00 0.00 O ATOM 86646 H1 WAT 9242 65.416 96.112 59.166 1.00 0.00 H ATOM 86647 H2 WAT 9242 65.515 95.880 57.673 1.00 0.00 H TER 86649 WAT 9242 ATOM 86649 O WAT 9243 141.755 79.307 60.065 1.00 0.00 O ATOM 86650 H1 WAT 9243 141.986 80.194 60.339 1.00 0.00 H ATOM 86651 H2 WAT 9243 141.158 79.432 59.327 1.00 0.00 H TER 86653 WAT 9243 ATOM 86653 O WAT 9244 19.782 9.448 97.842 1.00 0.00 O ATOM 86654 H1 WAT 9244 18.864 9.716 97.888 1.00 0.00 H ATOM 86655 H2 WAT 9244 19.779 8.677 97.275 1.00 0.00 H TER 86657 WAT 9244 ATOM 86657 O WAT 9245 21.146 92.696 26.898 1.00 0.00 O ATOM 86658 H1 WAT 9245 21.685 91.926 26.718 1.00 0.00 H ATOM 86659 H2 WAT 9245 21.370 93.314 26.202 1.00 0.00 H TER 86661 WAT 9245 ATOM 86661 O WAT 9246 140.762 28.270 72.094 1.00 0.00 O ATOM 86662 H1 WAT 9246 140.102 28.958 72.179 1.00 0.00 H ATOM 86663 H2 WAT 9246 141.240 28.292 72.923 1.00 0.00 H TER 86665 WAT 9246 ATOM 86665 O WAT 9247 31.871 63.292 108.665 1.00 0.00 O ATOM 86666 H1 WAT 9247 32.362 63.507 107.871 1.00 0.00 H ATOM 86667 H2 WAT 9247 32.433 63.586 109.381 1.00 0.00 H TER 86669 WAT 9247 ATOM 86669 O WAT 9248 113.386 30.969 113.758 1.00 0.00 O ATOM 86670 H1 WAT 9248 114.310 30.765 113.902 1.00 0.00 H ATOM 86671 H2 WAT 9248 112.913 30.267 114.204 1.00 0.00 H TER 86673 WAT 9248 ATOM 86673 O WAT 9249 70.438 127.508 102.527 1.00 0.00 O ATOM 86674 H1 WAT 9249 69.932 127.663 103.325 1.00 0.00 H ATOM 86675 H2 WAT 9249 70.358 128.323 102.031 1.00 0.00 H TER 86677 WAT 9249 ATOM 86677 O WAT 9250 22.017 65.744 134.894 1.00 0.00 O ATOM 86678 H1 WAT 9250 22.437 66.603 134.843 1.00 0.00 H ATOM 86679 H2 WAT 9250 22.524 65.269 135.552 1.00 0.00 H TER 86681 WAT 9250 ATOM 86681 O WAT 9251 33.896 77.756 147.049 1.00 0.00 O ATOM 86682 H1 WAT 9251 34.477 77.079 146.701 1.00 0.00 H ATOM 86683 H2 WAT 9251 34.151 77.841 147.968 1.00 0.00 H TER 86685 WAT 9251 ATOM 86685 O WAT 9252 136.069 24.518 81.323 1.00 0.00 O ATOM 86686 H1 WAT 9252 136.961 24.401 81.651 1.00 0.00 H ATOM 86687 H2 WAT 9252 135.965 23.832 80.663 1.00 0.00 H TER 86689 WAT 9252 ATOM 86689 O WAT 9253 129.427 40.030 106.150 1.00 0.00 O ATOM 86690 H1 WAT 9253 128.631 39.497 106.139 1.00 0.00 H ATOM 86691 H2 WAT 9253 129.113 40.927 106.260 1.00 0.00 H TER 86693 WAT 9253 ATOM 86693 O WAT 9254 120.323 14.357 10.029 1.00 0.00 O ATOM 86694 H1 WAT 9254 120.792 14.858 9.363 1.00 0.00 H ATOM 86695 H2 WAT 9254 120.771 14.569 10.848 1.00 0.00 H TER 86697 WAT 9254 ATOM 86697 O WAT 9255 127.275 138.194 74.427 1.00 0.00 O ATOM 86698 H1 WAT 9255 126.931 138.510 75.263 1.00 0.00 H ATOM 86699 H2 WAT 9255 127.869 137.482 74.666 1.00 0.00 H TER 86701 WAT 9255 ATOM 86701 O WAT 9256 50.611 142.397 124.623 1.00 0.00 O ATOM 86702 H1 WAT 9256 50.161 142.912 123.953 1.00 0.00 H ATOM 86703 H2 WAT 9256 50.769 143.016 125.336 1.00 0.00 H TER 86705 WAT 9256 ATOM 86705 O WAT 9257 15.275 63.856 94.379 1.00 0.00 O ATOM 86706 H1 WAT 9257 16.115 64.021 93.951 1.00 0.00 H ATOM 86707 H2 WAT 9257 14.642 64.357 93.865 1.00 0.00 H TER 86709 WAT 9257 ATOM 86709 O WAT 9258 93.167 29.803 1.454 1.00 0.00 O ATOM 86710 H1 WAT 9258 93.381 28.955 1.064 1.00 0.00 H ATOM 86711 H2 WAT 9258 92.511 29.602 2.120 1.00 0.00 H TER 86713 WAT 9258 ATOM 86713 O WAT 9259 86.649 117.830 58.754 1.00 0.00 O ATOM 86714 H1 WAT 9259 86.502 116.907 58.964 1.00 0.00 H ATOM 86715 H2 WAT 9259 85.770 118.198 58.666 1.00 0.00 H TER 86717 WAT 9259 ATOM 86717 O WAT 9260 38.431 36.262 86.522 1.00 0.00 O ATOM 86718 H1 WAT 9260 39.285 36.616 86.771 1.00 0.00 H ATOM 86719 H2 WAT 9260 37.823 36.628 87.164 1.00 0.00 H TER 86721 WAT 9260 ATOM 86721 O WAT 9261 115.271 29.271 146.419 1.00 0.00 O ATOM 86722 H1 WAT 9261 115.932 29.402 145.739 1.00 0.00 H ATOM 86723 H2 WAT 9261 114.691 30.028 146.338 1.00 0.00 H TER 86725 WAT 9261 ATOM 86725 O WAT 9262 122.750 20.765 65.608 1.00 0.00 O ATOM 86726 H1 WAT 9262 122.174 20.423 64.924 1.00 0.00 H ATOM 86727 H2 WAT 9262 122.168 20.932 66.350 1.00 0.00 H TER 86729 WAT 9262 ATOM 86729 O WAT 9263 17.421 31.798 86.334 1.00 0.00 O ATOM 86730 H1 WAT 9263 17.517 31.222 87.093 1.00 0.00 H ATOM 86731 H2 WAT 9263 18.319 32.027 86.093 1.00 0.00 H TER 86733 WAT 9263 ATOM 86733 O WAT 9264 31.646 31.945 65.326 1.00 0.00 O ATOM 86734 H1 WAT 9264 31.810 31.223 65.933 1.00 0.00 H ATOM 86735 H2 WAT 9264 32.506 32.340 65.186 1.00 0.00 H TER 86737 WAT 9264 ATOM 86737 O WAT 9265 105.447 15.118 158.007 1.00 0.00 O ATOM 86738 H1 WAT 9265 104.698 14.526 158.075 1.00 0.00 H ATOM 86739 H2 WAT 9265 105.874 14.871 157.187 1.00 0.00 H TER 86741 WAT 9265 ATOM 86741 O WAT 9266 85.857 133.952 0.113 1.00 0.00 O ATOM 86742 H1 WAT 9266 85.524 133.894 1.008 1.00 0.00 H ATOM 86743 H2 WAT 9266 85.220 134.500 -0.345 1.00 0.00 H TER 86745 WAT 9266 ATOM 86745 O WAT 9267 123.232 31.388 114.647 1.00 0.00 O ATOM 86746 H1 WAT 9267 123.757 31.061 115.377 1.00 0.00 H ATOM 86747 H2 WAT 9267 122.517 30.757 114.564 1.00 0.00 H TER 86749 WAT 9267 ATOM 86749 O WAT 9268 32.864 40.663 137.046 1.00 0.00 O ATOM 86750 H1 WAT 9268 32.578 40.014 136.404 1.00 0.00 H ATOM 86751 H2 WAT 9268 32.263 41.399 136.928 1.00 0.00 H TER 86753 WAT 9268 ATOM 86753 O WAT 9269 99.141 119.797 101.425 1.00 0.00 O ATOM 86754 H1 WAT 9269 99.208 119.349 102.268 1.00 0.00 H ATOM 86755 H2 WAT 9269 99.643 120.603 101.542 1.00 0.00 H TER 86757 WAT 9269 ATOM 86757 O WAT 9270 108.973 14.456 130.959 1.00 0.00 O ATOM 86758 H1 WAT 9270 109.921 14.510 130.838 1.00 0.00 H ATOM 86759 H2 WAT 9270 108.752 13.556 130.723 1.00 0.00 H TER 86761 WAT 9270 ATOM 86761 O WAT 9271 7.555 110.726 139.051 1.00 0.00 O ATOM 86762 H1 WAT 9271 8.341 110.501 139.549 1.00 0.00 H ATOM 86763 H2 WAT 9271 7.358 111.627 139.309 1.00 0.00 H TER 86765 WAT 9271 ATOM 86765 O WAT 9272 22.628 10.492 133.577 1.00 0.00 O ATOM 86766 H1 WAT 9272 23.566 10.309 133.631 1.00 0.00 H ATOM 86767 H2 WAT 9272 22.211 9.635 133.665 1.00 0.00 H TER 86769 WAT 9272 ATOM 86769 O WAT 9273 129.118 55.695 157.239 1.00 0.00 O ATOM 86770 H1 WAT 9273 128.210 55.399 157.171 1.00 0.00 H ATOM 86771 H2 WAT 9273 129.524 55.412 156.420 1.00 0.00 H TER 86773 WAT 9273 ATOM 86773 O WAT 9274 128.222 39.122 0.956 1.00 0.00 O ATOM 86774 H1 WAT 9274 128.538 39.543 0.157 1.00 0.00 H ATOM 86775 H2 WAT 9274 127.788 38.325 0.651 1.00 0.00 H TER 86777 WAT 9274 ATOM 86777 O WAT 9275 70.288 89.346 16.242 1.00 0.00 O ATOM 86778 H1 WAT 9275 70.308 88.794 15.461 1.00 0.00 H ATOM 86779 H2 WAT 9275 71.209 89.521 16.435 1.00 0.00 H TER 86781 WAT 9275 ATOM 86781 O WAT 9276 128.433 112.456 98.890 1.00 0.00 O ATOM 86782 H1 WAT 9276 127.890 111.679 98.758 1.00 0.00 H ATOM 86783 H2 WAT 9276 129.108 112.394 98.214 1.00 0.00 H TER 86785 WAT 9276 ATOM 86785 O WAT 9277 28.726 93.698 116.624 1.00 0.00 O ATOM 86786 H1 WAT 9277 28.037 93.732 115.962 1.00 0.00 H ATOM 86787 H2 WAT 9277 29.402 93.140 116.238 1.00 0.00 H TER 86789 WAT 9277 ATOM 86789 O WAT 9278 76.990 5.856 91.788 1.00 0.00 O ATOM 86790 H1 WAT 9278 76.356 5.235 92.149 1.00 0.00 H ATOM 86791 H2 WAT 9278 76.483 6.386 91.173 1.00 0.00 H TER 86793 WAT 9278 ATOM 86793 O WAT 9279 61.985 114.112 126.902 1.00 0.00 O ATOM 86794 H1 WAT 9279 62.788 114.525 127.217 1.00 0.00 H ATOM 86795 H2 WAT 9279 62.261 113.600 126.142 1.00 0.00 H TER 86797 WAT 9279 ATOM 86797 O WAT 9280 11.557 104.476 18.928 1.00 0.00 O ATOM 86798 H1 WAT 9280 11.710 103.902 19.679 1.00 0.00 H ATOM 86799 H2 WAT 9280 10.611 104.618 18.923 1.00 0.00 H TER 86801 WAT 9280 ATOM 86801 O WAT 9281 135.215 47.299 4.768 1.00 0.00 O ATOM 86802 H1 WAT 9281 135.601 46.442 4.583 1.00 0.00 H ATOM 86803 H2 WAT 9281 135.966 47.870 4.927 1.00 0.00 H TER 86805 WAT 9281 ATOM 86805 O WAT 9282 100.678 84.281 122.954 1.00 0.00 O ATOM 86806 H1 WAT 9282 99.837 84.432 122.523 1.00 0.00 H ATOM 86807 H2 WAT 9282 101.275 84.051 122.242 1.00 0.00 H TER 86809 WAT 9282 ATOM 86809 O WAT 9283 44.787 65.850 97.537 1.00 0.00 O ATOM 86810 H1 WAT 9283 45.196 66.625 97.923 1.00 0.00 H ATOM 86811 H2 WAT 9283 45.329 65.648 96.774 1.00 0.00 H TER 86813 WAT 9283 ATOM 86813 O WAT 9284 122.230 49.642 82.349 1.00 0.00 O ATOM 86814 H1 WAT 9284 122.617 49.282 81.551 1.00 0.00 H ATOM 86815 H2 WAT 9284 122.791 50.385 82.573 1.00 0.00 H TER 86817 WAT 9284 ATOM 86817 O WAT 9285 51.751 14.431 61.888 1.00 0.00 O ATOM 86818 H1 WAT 9285 51.071 14.770 61.306 1.00 0.00 H ATOM 86819 H2 WAT 9285 51.839 15.101 62.567 1.00 0.00 H TER 86821 WAT 9285 ATOM 86821 O WAT 9286 29.297 104.927 132.832 1.00 0.00 O ATOM 86822 H1 WAT 9286 28.605 105.475 133.202 1.00 0.00 H ATOM 86823 H2 WAT 9286 29.248 104.111 133.331 1.00 0.00 H TER 86825 WAT 9286 ATOM 86825 O WAT 9287 126.892 90.335 82.728 1.00 0.00 O ATOM 86826 H1 WAT 9287 126.026 90.387 82.324 1.00 0.00 H ATOM 86827 H2 WAT 9287 126.717 90.316 83.669 1.00 0.00 H TER 86829 WAT 9287 ATOM 86829 O WAT 9288 120.998 43.311 104.004 1.00 0.00 O ATOM 86830 H1 WAT 9288 120.173 43.737 103.770 1.00 0.00 H ATOM 86831 H2 WAT 9288 121.277 42.872 103.201 1.00 0.00 H TER 86833 WAT 9288 ATOM 86833 O WAT 9289 131.484 143.124 149.022 1.00 0.00 O ATOM 86834 H1 WAT 9289 131.688 143.501 148.166 1.00 0.00 H ATOM 86835 H2 WAT 9289 131.035 143.826 149.493 1.00 0.00 H TER 86837 WAT 9289 ATOM 86837 O WAT 9290 134.763 95.156 148.389 1.00 0.00 O ATOM 86838 H1 WAT 9290 135.378 95.528 149.021 1.00 0.00 H ATOM 86839 H2 WAT 9290 134.478 95.904 147.864 1.00 0.00 H TER 86841 WAT 9290 ATOM 86841 O WAT 9291 108.557 58.286 86.462 1.00 0.00 O ATOM 86842 H1 WAT 9291 109.037 58.696 85.743 1.00 0.00 H ATOM 86843 H2 WAT 9291 109.235 58.036 87.091 1.00 0.00 H TER 86845 WAT 9291 ATOM 86845 O WAT 9292 11.903 106.377 117.445 1.00 0.00 O ATOM 86846 H1 WAT 9292 11.027 106.225 117.799 1.00 0.00 H ATOM 86847 H2 WAT 9292 11.845 107.234 117.023 1.00 0.00 H TER 86849 WAT 9292 ATOM 86849 O WAT 9293 70.374 90.337 122.742 1.00 0.00 O ATOM 86850 H1 WAT 9293 70.999 89.838 122.216 1.00 0.00 H ATOM 86851 H2 WAT 9293 70.910 90.984 123.201 1.00 0.00 H TER 86853 WAT 9293 ATOM 86853 O WAT 9294 78.851 114.194 6.984 1.00 0.00 O ATOM 86854 H1 WAT 9294 79.381 113.854 6.263 1.00 0.00 H ATOM 86855 H2 WAT 9294 78.928 113.531 7.670 1.00 0.00 H TER 86857 WAT 9294 ATOM 86857 O WAT 9295 65.691 123.590 137.323 1.00 0.00 O ATOM 86858 H1 WAT 9295 66.472 123.102 137.064 1.00 0.00 H ATOM 86859 H2 WAT 9295 65.176 122.966 137.834 1.00 0.00 H TER 86861 WAT 9295 ATOM 86861 O WAT 9296 119.670 20.625 147.264 1.00 0.00 O ATOM 86862 H1 WAT 9296 118.929 20.075 147.009 1.00 0.00 H ATOM 86863 H2 WAT 9296 120.385 20.343 146.695 1.00 0.00 H TER 86865 WAT 9296 ATOM 86865 O WAT 9297 35.788 66.695 117.964 1.00 0.00 O ATOM 86866 H1 WAT 9297 35.038 66.156 117.714 1.00 0.00 H ATOM 86867 H2 WAT 9297 36.197 66.216 118.685 1.00 0.00 H TER 86869 WAT 9297 ATOM 86869 O WAT 9298 133.635 90.783 95.414 1.00 0.00 O ATOM 86870 H1 WAT 9298 133.937 90.340 96.206 1.00 0.00 H ATOM 86871 H2 WAT 9298 134.387 90.754 94.822 1.00 0.00 H TER 86873 WAT 9298 ATOM 86873 O WAT 9299 56.206 128.153 92.361 1.00 0.00 O ATOM 86874 H1 WAT 9299 56.764 127.799 93.054 1.00 0.00 H ATOM 86875 H2 WAT 9299 55.899 127.383 91.884 1.00 0.00 H TER 86877 WAT 9299 ATOM 86877 O WAT 9300 108.761 44.800 154.930 1.00 0.00 O ATOM 86878 H1 WAT 9300 109.536 44.600 155.455 1.00 0.00 H ATOM 86879 H2 WAT 9300 108.326 43.956 154.813 1.00 0.00 H TER 86881 WAT 9300 ATOM 86881 O WAT 9301 9.226 87.565 125.651 1.00 0.00 O ATOM 86882 H1 WAT 9301 9.978 88.151 125.741 1.00 0.00 H ATOM 86883 H2 WAT 9301 9.468 86.786 126.152 1.00 0.00 H TER 86885 WAT 9301 ATOM 86885 O WAT 9302 2.331 102.411 20.404 1.00 0.00 O ATOM 86886 H1 WAT 9302 1.707 102.727 19.751 1.00 0.00 H ATOM 86887 H2 WAT 9302 1.871 102.499 21.238 1.00 0.00 H TER 86889 WAT 9302 ATOM 86889 O WAT 9303 28.466 43.321 8.013 1.00 0.00 O ATOM 86890 H1 WAT 9303 27.940 43.619 7.271 1.00 0.00 H ATOM 86891 H2 WAT 9303 29.250 42.944 7.615 1.00 0.00 H TER 86893 WAT 9303 ATOM 86893 O WAT 9304 118.502 58.352 16.426 1.00 0.00 O ATOM 86894 H1 WAT 9304 118.380 57.524 15.962 1.00 0.00 H ATOM 86895 H2 WAT 9304 117.836 58.342 17.113 1.00 0.00 H TER 86897 WAT 9304 ATOM 86897 O WAT 9305 19.127 63.100 6.390 1.00 0.00 O ATOM 86898 H1 WAT 9305 19.360 63.741 5.718 1.00 0.00 H ATOM 86899 H2 WAT 9305 19.968 62.784 6.721 1.00 0.00 H TER 86901 WAT 9305 ATOM 86901 O WAT 9306 119.801 105.506 154.722 1.00 0.00 O ATOM 86902 H1 WAT 9306 119.359 104.826 155.230 1.00 0.00 H ATOM 86903 H2 WAT 9306 119.919 106.227 155.340 1.00 0.00 H TER 86905 WAT 9306 ATOM 86905 O WAT 9307 85.198 88.735 127.331 1.00 0.00 O ATOM 86906 H1 WAT 9307 84.826 89.330 127.983 1.00 0.00 H ATOM 86907 H2 WAT 9307 84.487 88.590 126.706 1.00 0.00 H TER 86909 WAT 9307 ATOM 86909 O WAT 9308 92.052 14.475 73.764 1.00 0.00 O ATOM 86910 H1 WAT 9308 92.033 14.237 72.837 1.00 0.00 H ATOM 86911 H2 WAT 9308 91.268 15.011 73.889 1.00 0.00 H TER 86913 WAT 9308 ATOM 86913 O WAT 9309 115.291 34.613 89.113 1.00 0.00 O ATOM 86914 H1 WAT 9309 116.136 35.062 89.107 1.00 0.00 H ATOM 86915 H2 WAT 9309 114.749 35.113 88.503 1.00 0.00 H TER 86917 WAT 9309 ATOM 86917 O WAT 9310 95.050 73.319 122.457 1.00 0.00 O ATOM 86918 H1 WAT 9310 95.233 73.004 123.342 1.00 0.00 H ATOM 86919 H2 WAT 9310 94.125 73.116 122.317 1.00 0.00 H TER 86921 WAT 9310 ATOM 86921 O WAT 9311 28.121 57.131 98.919 1.00 0.00 O ATOM 86922 H1 WAT 9311 28.819 56.991 99.559 1.00 0.00 H ATOM 86923 H2 WAT 9311 28.036 58.083 98.862 1.00 0.00 H TER 86925 WAT 9311 ATOM 86925 O WAT 9312 136.201 47.143 84.504 1.00 0.00 O ATOM 86926 H1 WAT 9312 135.378 46.993 84.038 1.00 0.00 H ATOM 86927 H2 WAT 9312 136.125 46.619 85.301 1.00 0.00 H TER 86929 WAT 9312 ATOM 86929 O WAT 9313 51.730 91.462 153.368 1.00 0.00 O ATOM 86930 H1 WAT 9313 51.203 92.057 152.835 1.00 0.00 H ATOM 86931 H2 WAT 9313 51.283 90.618 153.298 1.00 0.00 H TER 86933 WAT 9313 ATOM 86933 O WAT 9314 53.381 53.627 147.326 1.00 0.00 O ATOM 86934 H1 WAT 9314 53.262 53.665 146.377 1.00 0.00 H ATOM 86935 H2 WAT 9314 54.322 53.501 147.445 1.00 0.00 H TER 86937 WAT 9314 ATOM 86937 O WAT 9315 138.792 97.783 107.831 1.00 0.00 O ATOM 86938 H1 WAT 9315 137.947 98.039 108.199 1.00 0.00 H ATOM 86939 H2 WAT 9315 139.371 98.520 108.025 1.00 0.00 H TER 86941 WAT 9315 ATOM 86941 O WAT 9316 44.536 117.495 4.513 1.00 0.00 O ATOM 86942 H1 WAT 9316 43.842 117.904 3.996 1.00 0.00 H ATOM 86943 H2 WAT 9316 45.295 117.486 3.930 1.00 0.00 H TER 86945 WAT 9316 ATOM 86945 O WAT 9317 82.829 128.961 100.705 1.00 0.00 O ATOM 86946 H1 WAT 9317 82.986 128.907 101.648 1.00 0.00 H ATOM 86947 H2 WAT 9317 82.926 128.061 100.395 1.00 0.00 H TER 86949 WAT 9317 ATOM 86949 O WAT 9318 17.659 102.798 135.911 1.00 0.00 O ATOM 86950 H1 WAT 9318 18.331 103.477 135.966 1.00 0.00 H ATOM 86951 H2 WAT 9318 17.626 102.569 134.982 1.00 0.00 H TER 86953 WAT 9318 ATOM 86953 O WAT 9319 90.671 65.217 135.599 1.00 0.00 O ATOM 86954 H1 WAT 9319 90.490 64.983 134.688 1.00 0.00 H ATOM 86955 H2 WAT 9319 90.652 66.174 135.609 1.00 0.00 H TER 86957 WAT 9319 ATOM 86957 O WAT 9320 4.576 57.538 72.848 1.00 0.00 O ATOM 86958 H1 WAT 9320 4.536 57.716 71.908 1.00 0.00 H ATOM 86959 H2 WAT 9320 3.842 56.945 73.010 1.00 0.00 H TER 86961 WAT 9320 ATOM 86961 O WAT 9321 89.300 45.102 132.825 1.00 0.00 O ATOM 86962 H1 WAT 9321 88.405 45.187 132.495 1.00 0.00 H ATOM 86963 H2 WAT 9321 89.315 44.250 133.260 1.00 0.00 H TER 86965 WAT 9321 ATOM 86965 O WAT 9322 23.562 74.732 65.144 1.00 0.00 O ATOM 86966 H1 WAT 9322 24.202 74.025 65.228 1.00 0.00 H ATOM 86967 H2 WAT 9322 23.884 75.418 65.729 1.00 0.00 H TER 86969 WAT 9322 ATOM 86969 O WAT 9323 83.326 37.643 29.697 1.00 0.00 O ATOM 86970 H1 WAT 9323 83.989 38.299 29.481 1.00 0.00 H ATOM 86971 H2 WAT 9323 83.592 36.864 29.207 1.00 0.00 H TER 86973 WAT 9323 ATOM 86973 O WAT 9324 72.642 126.002 100.576 1.00 0.00 O ATOM 86974 H1 WAT 9324 73.408 125.513 100.876 1.00 0.00 H ATOM 86975 H2 WAT 9324 71.936 125.724 101.160 1.00 0.00 H TER 86977 WAT 9324 ATOM 86977 O WAT 9325 101.622 143.956 91.148 1.00 0.00 O ATOM 86978 H1 WAT 9325 100.971 143.474 91.660 1.00 0.00 H ATOM 86979 H2 WAT 9325 102.023 143.294 90.586 1.00 0.00 H TER 86981 WAT 9325 ATOM 86981 O WAT 9326 141.136 39.804 5.888 1.00 0.00 O ATOM 86982 H1 WAT 9326 141.043 40.069 6.803 1.00 0.00 H ATOM 86983 H2 WAT 9326 141.933 39.274 5.872 1.00 0.00 H TER 86985 WAT 9326 ATOM 86985 O WAT 9327 134.321 123.735 11.241 1.00 0.00 O ATOM 86986 H1 WAT 9327 134.796 124.541 11.445 1.00 0.00 H ATOM 86987 H2 WAT 9327 134.667 123.091 11.858 1.00 0.00 H TER 86989 WAT 9327 ATOM 86989 O WAT 9328 72.513 95.940 19.590 1.00 0.00 O ATOM 86990 H1 WAT 9328 73.358 95.581 19.860 1.00 0.00 H ATOM 86991 H2 WAT 9328 72.639 96.888 19.604 1.00 0.00 H TER 86993 WAT 9328 ATOM 86993 O WAT 9329 145.150 133.460 150.043 1.00 0.00 O ATOM 86994 H1 WAT 9329 145.998 133.845 149.822 1.00 0.00 H ATOM 86995 H2 WAT 9329 144.771 133.215 149.198 1.00 0.00 H TER 86997 WAT 9329 ATOM 86997 O WAT 9330 74.027 115.138 88.390 1.00 0.00 O ATOM 86998 H1 WAT 9330 73.265 114.560 88.362 1.00 0.00 H ATOM 86999 H2 WAT 9330 73.971 115.567 89.244 1.00 0.00 H TER 87001 WAT 9330 ATOM 87001 O WAT 9331 131.877 49.882 93.346 1.00 0.00 O ATOM 87002 H1 WAT 9331 130.999 49.880 93.726 1.00 0.00 H ATOM 87003 H2 WAT 9331 131.736 50.084 92.421 1.00 0.00 H TER 87005 WAT 9331 ATOM 87005 O WAT 9332 63.000 28.485 23.506 1.00 0.00 O ATOM 87006 H1 WAT 9332 63.483 29.157 23.025 1.00 0.00 H ATOM 87007 H2 WAT 9332 62.114 28.839 23.587 1.00 0.00 H TER 87009 WAT 9332 ATOM 87009 O WAT 9333 5.387 112.330 119.419 1.00 0.00 O ATOM 87010 H1 WAT 9333 5.733 111.466 119.196 1.00 0.00 H ATOM 87011 H2 WAT 9333 4.602 112.148 119.935 1.00 0.00 H TER 87013 WAT 9333 ATOM 87013 O WAT 9334 90.759 128.804 141.600 1.00 0.00 O ATOM 87014 H1 WAT 9334 90.990 129.706 141.823 1.00 0.00 H ATOM 87015 H2 WAT 9334 91.539 128.457 141.167 1.00 0.00 H TER 87017 WAT 9334 ATOM 87017 O WAT 9335 115.201 79.404 135.764 1.00 0.00 O ATOM 87018 H1 WAT 9335 115.199 79.286 134.814 1.00 0.00 H ATOM 87019 H2 WAT 9335 114.292 79.606 135.983 1.00 0.00 H TER 87021 WAT 9335 ATOM 87021 O WAT 9336 85.483 60.813 147.581 1.00 0.00 O ATOM 87022 H1 WAT 9336 85.887 61.441 146.982 1.00 0.00 H ATOM 87023 H2 WAT 9336 85.158 61.349 148.305 1.00 0.00 H TER 87025 WAT 9336 ATOM 87025 O WAT 9337 39.496 39.255 24.636 1.00 0.00 O ATOM 87026 H1 WAT 9337 39.423 38.441 24.138 1.00 0.00 H ATOM 87027 H2 WAT 9337 40.033 39.825 24.086 1.00 0.00 H TER 87029 WAT 9337 ATOM 87029 O WAT 9338 56.541 89.400 137.558 1.00 0.00 O ATOM 87030 H1 WAT 9338 55.608 89.573 137.683 1.00 0.00 H ATOM 87031 H2 WAT 9338 56.607 88.445 137.541 1.00 0.00 H TER 87033 WAT 9338 ATOM 87033 O WAT 9339 57.137 65.736 95.198 1.00 0.00 O ATOM 87034 H1 WAT 9339 56.894 66.662 95.189 1.00 0.00 H ATOM 87035 H2 WAT 9339 56.538 65.338 95.829 1.00 0.00 H TER 87037 WAT 9339 ATOM 87037 O WAT 9340 50.860 136.376 95.576 1.00 0.00 O ATOM 87038 H1 WAT 9340 51.374 136.819 96.251 1.00 0.00 H ATOM 87039 H2 WAT 9340 51.506 136.092 94.930 1.00 0.00 H TER 87041 WAT 9340 ATOM 87041 O WAT 9341 91.778 116.429 146.078 1.00 0.00 O ATOM 87042 H1 WAT 9341 91.441 117.124 146.643 1.00 0.00 H ATOM 87043 H2 WAT 9341 91.990 115.714 146.679 1.00 0.00 H TER 87045 WAT 9341 ATOM 87045 O WAT 9342 63.972 16.499 112.144 1.00 0.00 O ATOM 87046 H1 WAT 9342 63.780 17.059 111.393 1.00 0.00 H ATOM 87047 H2 WAT 9342 63.831 15.609 111.822 1.00 0.00 H TER 87049 WAT 9342 ATOM 87049 O WAT 9343 84.765 11.819 112.936 1.00 0.00 O ATOM 87050 H1 WAT 9343 85.332 11.231 113.435 1.00 0.00 H ATOM 87051 H2 WAT 9343 83.902 11.716 113.337 1.00 0.00 H TER 87053 WAT 9343 ATOM 87053 O WAT 9344 6.421 76.211 65.859 1.00 0.00 O ATOM 87054 H1 WAT 9344 6.355 76.926 65.226 1.00 0.00 H ATOM 87055 H2 WAT 9344 5.614 76.268 66.370 1.00 0.00 H TER 87057 WAT 9344 ATOM 87057 O WAT 9345 80.749 43.099 97.476 1.00 0.00 O ATOM 87058 H1 WAT 9345 81.225 43.916 97.329 1.00 0.00 H ATOM 87059 H2 WAT 9345 79.914 43.373 97.854 1.00 0.00 H TER 87061 WAT 9345 ATOM 87061 O WAT 9346 8.421 84.728 144.851 1.00 0.00 O ATOM 87062 H1 WAT 9346 9.078 84.211 145.317 1.00 0.00 H ATOM 87063 H2 WAT 9346 8.553 84.507 143.929 1.00 0.00 H TER 87065 WAT 9346 ATOM 87065 O WAT 9347 47.952 8.607 158.059 1.00 0.00 O ATOM 87066 H1 WAT 9347 47.376 8.265 158.743 1.00 0.00 H ATOM 87067 H2 WAT 9347 47.814 9.553 158.081 1.00 0.00 H TER 87069 WAT 9347 ATOM 87069 O WAT 9348 38.938 75.793 8.143 1.00 0.00 O ATOM 87070 H1 WAT 9348 38.573 76.317 8.856 1.00 0.00 H ATOM 87071 H2 WAT 9348 38.175 75.510 7.639 1.00 0.00 H TER 87073 WAT 9348 ATOM 87073 O WAT 9349 122.444 88.109 87.403 1.00 0.00 O ATOM 87074 H1 WAT 9349 122.697 87.386 86.829 1.00 0.00 H ATOM 87075 H2 WAT 9349 122.541 88.891 86.859 1.00 0.00 H TER 87077 WAT 9349 ATOM 87077 O WAT 9350 52.874 56.771 153.136 1.00 0.00 O ATOM 87078 H1 WAT 9350 52.494 57.617 152.902 1.00 0.00 H ATOM 87079 H2 WAT 9350 53.771 56.976 153.399 1.00 0.00 H TER 87081 WAT 9350 ATOM 87081 O WAT 9351 2.273 93.905 102.082 1.00 0.00 O ATOM 87082 H1 WAT 9351 3.229 93.891 102.133 1.00 0.00 H ATOM 87083 H2 WAT 9351 2.082 93.834 101.147 1.00 0.00 H TER 87085 WAT 9351 ATOM 87085 O WAT 9352 86.203 62.226 10.993 1.00 0.00 O ATOM 87086 H1 WAT 9352 85.331 61.831 10.971 1.00 0.00 H ATOM 87087 H2 WAT 9352 86.477 62.253 10.077 1.00 0.00 H TER 87089 WAT 9352 ATOM 87089 O WAT 9353 57.684 10.934 5.782 1.00 0.00 O ATOM 87090 H1 WAT 9353 57.857 9.995 5.856 1.00 0.00 H ATOM 87091 H2 WAT 9353 57.676 11.102 4.840 1.00 0.00 H TER 87093 WAT 9353 ATOM 87093 O WAT 9354 108.677 26.750 154.780 1.00 0.00 O ATOM 87094 H1 WAT 9354 107.885 26.307 155.085 1.00 0.00 H ATOM 87095 H2 WAT 9354 108.647 26.666 153.827 1.00 0.00 H TER 87097 WAT 9354 ATOM 87097 O WAT 9355 23.125 74.494 71.137 1.00 0.00 O ATOM 87098 H1 WAT 9355 22.591 74.937 70.477 1.00 0.00 H ATOM 87099 H2 WAT 9355 22.493 74.019 71.677 1.00 0.00 H TER 87101 WAT 9355 ATOM 87101 O WAT 9356 13.007 124.981 114.306 1.00 0.00 O ATOM 87102 H1 WAT 9356 13.584 125.199 113.574 1.00 0.00 H ATOM 87103 H2 WAT 9356 12.388 124.347 113.943 1.00 0.00 H TER 87105 WAT 9356 ATOM 87105 O WAT 9357 114.957 134.901 17.172 1.00 0.00 O ATOM 87106 H1 WAT 9357 115.365 134.775 16.316 1.00 0.00 H ATOM 87107 H2 WAT 9357 115.553 135.489 17.637 1.00 0.00 H TER 87109 WAT 9357 ATOM 87109 O WAT 9358 100.408 94.019 88.203 1.00 0.00 O ATOM 87110 H1 WAT 9358 99.726 93.397 87.950 1.00 0.00 H ATOM 87111 H2 WAT 9358 100.295 94.127 89.148 1.00 0.00 H TER 87113 WAT 9358 ATOM 87113 O WAT 9359 115.689 14.388 155.496 1.00 0.00 O ATOM 87114 H1 WAT 9359 115.853 14.383 156.439 1.00 0.00 H ATOM 87115 H2 WAT 9359 115.190 13.588 155.335 1.00 0.00 H TER 87117 WAT 9359 ATOM 87117 O WAT 9360 93.834 31.306 9.190 1.00 0.00 O ATOM 87118 H1 WAT 9360 93.245 31.194 9.936 1.00 0.00 H ATOM 87119 H2 WAT 9360 93.450 32.024 8.688 1.00 0.00 H TER 87121 WAT 9360 ATOM 87121 O WAT 9361 4.319 35.892 64.350 1.00 0.00 O ATOM 87122 H1 WAT 9361 4.983 36.016 63.672 1.00 0.00 H ATOM 87123 H2 WAT 9361 4.149 36.773 64.683 1.00 0.00 H TER 87125 WAT 9361 ATOM 87125 O WAT 9362 23.793 35.614 11.842 1.00 0.00 O ATOM 87126 H1 WAT 9362 24.538 36.206 11.737 1.00 0.00 H ATOM 87127 H2 WAT 9362 23.789 35.089 11.041 1.00 0.00 H TER 87129 WAT 9362 ATOM 87129 O WAT 9363 73.060 35.829 74.282 1.00 0.00 O ATOM 87130 H1 WAT 9363 73.947 36.186 74.339 1.00 0.00 H ATOM 87131 H2 WAT 9363 72.899 35.449 75.145 1.00 0.00 H TER 87133 WAT 9363 ATOM 87133 O WAT 9364 3.666 48.485 60.348 1.00 0.00 O ATOM 87134 H1 WAT 9364 2.811 48.251 59.988 1.00 0.00 H ATOM 87135 H2 WAT 9364 3.787 47.887 61.086 1.00 0.00 H TER 87137 WAT 9364 ATOM 87137 O WAT 9365 79.429 33.306 100.816 1.00 0.00 O ATOM 87138 H1 WAT 9365 79.609 32.890 99.973 1.00 0.00 H ATOM 87139 H2 WAT 9365 79.930 32.791 101.449 1.00 0.00 H TER 87141 WAT 9365 ATOM 87141 O WAT 9366 132.107 129.499 89.082 1.00 0.00 O ATOM 87142 H1 WAT 9366 131.926 130.264 89.628 1.00 0.00 H ATOM 87143 H2 WAT 9366 132.903 129.729 88.603 1.00 0.00 H TER 87145 WAT 9366 ATOM 87145 O WAT 9367 116.543 4.651 75.719 1.00 0.00 O ATOM 87146 H1 WAT 9367 116.268 4.176 76.503 1.00 0.00 H ATOM 87147 H2 WAT 9367 116.208 5.538 75.846 1.00 0.00 H TER 87149 WAT 9367 ATOM 87149 O WAT 9368 130.692 98.724 6.231 1.00 0.00 O ATOM 87150 H1 WAT 9368 130.837 99.441 5.614 1.00 0.00 H ATOM 87151 H2 WAT 9368 129.746 98.579 6.213 1.00 0.00 H TER 87153 WAT 9368 ATOM 87153 O WAT 9369 74.286 38.346 15.236 1.00 0.00 O ATOM 87154 H1 WAT 9369 74.683 37.496 15.428 1.00 0.00 H ATOM 87155 H2 WAT 9369 75.029 38.922 15.056 1.00 0.00 H TER 87157 WAT 9369 ATOM 87157 O WAT 9370 67.238 84.041 149.903 1.00 0.00 O ATOM 87158 H1 WAT 9370 66.978 83.234 150.348 1.00 0.00 H ATOM 87159 H2 WAT 9370 68.041 84.312 150.348 1.00 0.00 H TER 87161 WAT 9370 ATOM 87161 O WAT 9371 78.505 75.696 63.142 1.00 0.00 O ATOM 87162 H1 WAT 9371 78.882 76.125 63.910 1.00 0.00 H ATOM 87163 H2 WAT 9371 77.965 76.372 62.732 1.00 0.00 H TER 87165 WAT 9371 ATOM 87165 O WAT 9372 33.345 90.677 107.812 1.00 0.00 O ATOM 87166 H1 WAT 9372 34.054 90.144 108.170 1.00 0.00 H ATOM 87167 H2 WAT 9372 32.615 90.544 108.418 1.00 0.00 H TER 87169 WAT 9372 ATOM 87169 O WAT 9373 22.332 108.200 1.856 1.00 0.00 O ATOM 87170 H1 WAT 9373 22.006 109.011 2.248 1.00 0.00 H ATOM 87171 H2 WAT 9373 23.046 107.926 2.431 1.00 0.00 H TER 87173 WAT 9373 ATOM 87173 O WAT 9374 145.508 129.805 132.948 1.00 0.00 O ATOM 87174 H1 WAT 9374 145.949 130.634 132.762 1.00 0.00 H ATOM 87175 H2 WAT 9374 145.409 129.390 132.091 1.00 0.00 H TER 87177 WAT 9374 ATOM 87177 O WAT 9375 19.002 31.614 154.225 1.00 0.00 O ATOM 87178 H1 WAT 9375 19.588 31.077 154.757 1.00 0.00 H ATOM 87179 H2 WAT 9375 19.472 32.440 154.110 1.00 0.00 H TER 87181 WAT 9375 ATOM 87181 O WAT 9376 1.534 93.526 155.563 1.00 0.00 O ATOM 87182 H1 WAT 9376 0.995 94.111 155.030 1.00 0.00 H ATOM 87183 H2 WAT 9376 2.088 94.114 156.077 1.00 0.00 H TER 87185 WAT 9376 ATOM 87185 O WAT 9377 65.427 69.733 144.420 1.00 0.00 O ATOM 87186 H1 WAT 9377 64.718 69.241 144.006 1.00 0.00 H ATOM 87187 H2 WAT 9377 66.138 69.099 144.510 1.00 0.00 H TER 87189 WAT 9377 ATOM 87189 O WAT 9378 26.843 4.326 138.648 1.00 0.00 O ATOM 87190 H1 WAT 9378 27.065 3.421 138.866 1.00 0.00 H ATOM 87191 H2 WAT 9378 27.626 4.827 138.877 1.00 0.00 H TER 87193 WAT 9378 ATOM 87193 O WAT 9379 81.114 111.138 89.355 1.00 0.00 O ATOM 87194 H1 WAT 9379 81.008 111.548 88.496 1.00 0.00 H ATOM 87195 H2 WAT 9379 81.723 110.416 89.203 1.00 0.00 H TER 87197 WAT 9379 ATOM 87197 O WAT 9380 42.988 111.222 68.636 1.00 0.00 O ATOM 87198 H1 WAT 9380 42.797 111.793 69.380 1.00 0.00 H ATOM 87199 H2 WAT 9380 42.131 110.904 68.352 1.00 0.00 H TER 87201 WAT 9380 ATOM 87201 O WAT 9381 70.758 22.828 155.452 1.00 0.00 O ATOM 87202 H1 WAT 9381 71.133 23.704 155.546 1.00 0.00 H ATOM 87203 H2 WAT 9381 71.282 22.280 156.036 1.00 0.00 H TER 87205 WAT 9381 ATOM 87205 O WAT 9382 56.329 42.525 73.901 1.00 0.00 O ATOM 87206 H1 WAT 9382 56.322 41.975 74.685 1.00 0.00 H ATOM 87207 H2 WAT 9382 56.683 41.960 73.215 1.00 0.00 H TER 87209 WAT 9382 ATOM 87209 O WAT 9383 33.096 108.332 73.440 1.00 0.00 O ATOM 87210 H1 WAT 9383 32.987 108.219 74.384 1.00 0.00 H ATOM 87211 H2 WAT 9383 33.292 107.454 73.114 1.00 0.00 H TER 87213 WAT 9383 ATOM 87213 O WAT 9384 84.231 22.217 62.097 1.00 0.00 O ATOM 87214 H1 WAT 9384 84.845 22.402 62.808 1.00 0.00 H ATOM 87215 H2 WAT 9384 84.717 22.430 61.300 1.00 0.00 H TER 87217 WAT 9384 ATOM 87217 O WAT 9385 72.353 70.642 101.994 1.00 0.00 O ATOM 87218 H1 WAT 9385 71.584 71.211 102.022 1.00 0.00 H ATOM 87219 H2 WAT 9385 72.102 69.874 102.508 1.00 0.00 H TER 87221 WAT 9385 ATOM 87221 O WAT 9386 131.450 124.065 104.844 1.00 0.00 O ATOM 87222 H1 WAT 9386 132.104 123.445 104.522 1.00 0.00 H ATOM 87223 H2 WAT 9386 131.648 124.161 105.775 1.00 0.00 H TER 87225 WAT 9386 ATOM 87225 O WAT 9387 41.799 12.892 7.621 1.00 0.00 O ATOM 87226 H1 WAT 9387 42.745 12.757 7.563 1.00 0.00 H ATOM 87227 H2 WAT 9387 41.552 13.227 6.759 1.00 0.00 H TER 87229 WAT 9387 ATOM 87229 O WAT 9388 65.045 135.139 64.966 1.00 0.00 O ATOM 87230 H1 WAT 9388 65.317 135.119 64.049 1.00 0.00 H ATOM 87231 H2 WAT 9388 65.861 135.238 65.456 1.00 0.00 H TER 87233 WAT 9388 ATOM 87233 O WAT 9389 100.535 80.937 28.046 1.00 0.00 O ATOM 87234 H1 WAT 9389 100.034 81.296 27.314 1.00 0.00 H ATOM 87235 H2 WAT 9389 101.391 81.362 27.983 1.00 0.00 H TER 87237 WAT 9389 ATOM 87237 O WAT 9390 8.007 37.233 13.047 1.00 0.00 O ATOM 87238 H1 WAT 9390 7.783 37.927 13.667 1.00 0.00 H ATOM 87239 H2 WAT 9390 7.478 36.485 13.324 1.00 0.00 H TER 87241 WAT 9390 ATOM 87241 O WAT 9391 77.815 13.451 130.230 1.00 0.00 O ATOM 87242 H1 WAT 9391 77.286 13.771 130.961 1.00 0.00 H ATOM 87243 H2 WAT 9391 78.423 12.829 130.629 1.00 0.00 H TER 87245 WAT 9391 ATOM 87245 O WAT 9392 66.598 18.353 17.327 1.00 0.00 O ATOM 87246 H1 WAT 9392 66.883 17.440 17.344 1.00 0.00 H ATOM 87247 H2 WAT 9392 67.008 18.748 18.096 1.00 0.00 H TER 87249 WAT 9392 ATOM 87249 O WAT 9393 142.783 36.527 132.708 1.00 0.00 O ATOM 87250 H1 WAT 9393 143.137 36.482 131.820 1.00 0.00 H ATOM 87251 H2 WAT 9393 141.838 36.616 132.585 1.00 0.00 H TER 87253 WAT 9393 ATOM 87253 O WAT 9394 142.809 127.899 150.735 1.00 0.00 O ATOM 87254 H1 WAT 9394 141.964 127.726 151.150 1.00 0.00 H ATOM 87255 H2 WAT 9394 142.613 127.932 149.798 1.00 0.00 H TER 87257 WAT 9394 ATOM 87257 O WAT 9395 8.497 26.244 132.260 1.00 0.00 O ATOM 87258 H1 WAT 9395 8.986 27.024 132.522 1.00 0.00 H ATOM 87259 H2 WAT 9395 8.366 25.758 133.074 1.00 0.00 H TER 87261 WAT 9395 ATOM 87261 O WAT 9396 121.005 111.521 139.154 1.00 0.00 O ATOM 87262 H1 WAT 9396 121.017 111.724 138.219 1.00 0.00 H ATOM 87263 H2 WAT 9396 120.104 111.248 139.329 1.00 0.00 H TER 87265 WAT 9396 ATOM 87265 O WAT 9397 2.978 83.297 87.821 1.00 0.00 O ATOM 87266 H1 WAT 9397 3.615 84.002 87.934 1.00 0.00 H ATOM 87267 H2 WAT 9397 2.785 83.003 88.711 1.00 0.00 H TER 87269 WAT 9397 ATOM 87269 O WAT 9398 94.435 125.554 107.450 1.00 0.00 O ATOM 87270 H1 WAT 9398 94.925 125.614 106.630 1.00 0.00 H ATOM 87271 H2 WAT 9398 93.652 125.052 107.224 1.00 0.00 H TER 87273 WAT 9398 ATOM 87273 O WAT 9399 34.454 95.638 95.559 1.00 0.00 O ATOM 87274 H1 WAT 9399 34.675 96.286 96.228 1.00 0.00 H ATOM 87275 H2 WAT 9399 34.127 96.155 94.823 1.00 0.00 H TER 87277 WAT 9399 ATOM 87277 O WAT 9400 23.948 118.409 87.552 1.00 0.00 O ATOM 87278 H1 WAT 9400 23.618 118.049 86.728 1.00 0.00 H ATOM 87279 H2 WAT 9400 24.581 119.075 87.286 1.00 0.00 H TER 87281 WAT 9400 ATOM 87281 O WAT 9401 7.290 83.540 60.416 1.00 0.00 O ATOM 87282 H1 WAT 9401 7.354 83.018 61.215 1.00 0.00 H ATOM 87283 H2 WAT 9401 6.469 83.260 60.012 1.00 0.00 H TER 87285 WAT 9401 ATOM 87285 O WAT 9402 74.191 114.987 25.164 1.00 0.00 O ATOM 87286 H1 WAT 9402 75.027 114.660 24.832 1.00 0.00 H ATOM 87287 H2 WAT 9402 74.425 115.748 25.695 1.00 0.00 H TER 87289 WAT 9402 ATOM 87289 O WAT 9403 127.425 89.426 119.753 1.00 0.00 O ATOM 87290 H1 WAT 9403 127.282 89.913 120.564 1.00 0.00 H ATOM 87291 H2 WAT 9403 127.415 90.093 119.068 1.00 0.00 H TER 87293 WAT 9403 ATOM 87293 O WAT 9404 29.849 93.050 146.631 1.00 0.00 O ATOM 87294 H1 WAT 9404 30.686 93.496 146.500 1.00 0.00 H ATOM 87295 H2 WAT 9404 29.221 93.568 146.127 1.00 0.00 H TER 87297 WAT 9404 ATOM 87297 O WAT 9405 106.299 81.302 143.345 1.00 0.00 O ATOM 87298 H1 WAT 9405 105.663 81.907 142.962 1.00 0.00 H ATOM 87299 H2 WAT 9405 106.458 81.647 144.224 1.00 0.00 H TER 87301 WAT 9405 ATOM 87301 O WAT 9406 46.616 127.453 94.510 1.00 0.00 O ATOM 87302 H1 WAT 9406 47.456 127.911 94.498 1.00 0.00 H ATOM 87303 H2 WAT 9406 46.044 128.016 95.032 1.00 0.00 H TER 87305 WAT 9406 ATOM 87305 O WAT 9407 58.182 51.613 69.208 1.00 0.00 O ATOM 87306 H1 WAT 9407 58.323 52.294 69.866 1.00 0.00 H ATOM 87307 H2 WAT 9407 59.050 51.457 68.836 1.00 0.00 H TER 87309 WAT 9407 ATOM 87309 O WAT 9408 26.525 135.520 116.683 1.00 0.00 O ATOM 87310 H1 WAT 9408 25.573 135.424 116.656 1.00 0.00 H ATOM 87311 H2 WAT 9408 26.709 136.248 116.089 1.00 0.00 H TER 87313 WAT 9408 ATOM 87313 O WAT 9409 11.943 85.853 142.422 1.00 0.00 O ATOM 87314 H1 WAT 9409 11.453 85.033 142.473 1.00 0.00 H ATOM 87315 H2 WAT 9409 12.861 85.583 142.394 1.00 0.00 H TER 87317 WAT 9409 ATOM 87317 O WAT 9410 17.425 110.243 19.848 1.00 0.00 O ATOM 87318 H1 WAT 9410 17.882 111.082 19.782 1.00 0.00 H ATOM 87319 H2 WAT 9410 17.773 109.844 20.646 1.00 0.00 H TER 87321 WAT 9410 ATOM 87321 O WAT 9411 40.395 145.784 15.119 1.00 0.00 O ATOM 87322 H1 WAT 9411 41.176 145.579 14.605 1.00 0.00 H ATOM 87323 H2 WAT 9411 40.735 146.115 15.950 1.00 0.00 H TER 87325 WAT 9411 ATOM 87325 O WAT 9412 69.592 115.817 144.566 1.00 0.00 O ATOM 87326 H1 WAT 9412 68.796 115.369 144.279 1.00 0.00 H ATOM 87327 H2 WAT 9412 69.742 115.493 145.454 1.00 0.00 H TER 87329 WAT 9412 ATOM 87329 O WAT 9413 11.323 45.864 97.787 1.00 0.00 O ATOM 87330 H1 WAT 9413 11.258 45.294 97.021 1.00 0.00 H ATOM 87331 H2 WAT 9413 10.995 46.711 97.484 1.00 0.00 H TER 87333 WAT 9413 ATOM 87333 O WAT 9414 96.740 86.765 113.815 1.00 0.00 O ATOM 87334 H1 WAT 9414 96.821 85.955 114.319 1.00 0.00 H ATOM 87335 H2 WAT 9414 95.868 87.094 114.030 1.00 0.00 H TER 87337 WAT 9414 ATOM 87337 O WAT 9415 10.284 95.298 158.482 1.00 0.00 O ATOM 87338 H1 WAT 9415 9.933 96.012 159.015 1.00 0.00 H ATOM 87339 H2 WAT 9415 10.520 95.713 157.652 1.00 0.00 H TER 87341 WAT 9415 ATOM 87341 O WAT 9416 68.353 105.938 132.519 1.00 0.00 O ATOM 87342 H1 WAT 9416 67.807 105.480 133.157 1.00 0.00 H ATOM 87343 H2 WAT 9416 68.431 105.326 131.787 1.00 0.00 H TER 87345 WAT 9416 ATOM 87345 O WAT 9417 117.116 55.722 19.040 1.00 0.00 O ATOM 87346 H1 WAT 9417 118.034 55.566 19.262 1.00 0.00 H ATOM 87347 H2 WAT 9417 117.041 56.674 18.988 1.00 0.00 H TER 87349 WAT 9417 ATOM 87349 O WAT 9418 85.686 137.386 104.669 1.00 0.00 O ATOM 87350 H1 WAT 9418 86.172 137.183 103.870 1.00 0.00 H ATOM 87351 H2 WAT 9418 85.540 138.331 104.627 1.00 0.00 H TER 87353 WAT 9418 ATOM 87353 O WAT 9419 108.986 34.718 144.218 1.00 0.00 O ATOM 87354 H1 WAT 9419 108.788 34.352 143.356 1.00 0.00 H ATOM 87355 H2 WAT 9419 108.130 34.927 144.592 1.00 0.00 H TER 87357 WAT 9419 ATOM 87357 O WAT 9420 143.328 3.016 86.109 1.00 0.00 O ATOM 87358 H1 WAT 9420 143.704 2.683 85.294 1.00 0.00 H ATOM 87359 H2 WAT 9420 143.169 3.944 85.937 1.00 0.00 H TER 87361 WAT 9420 ATOM 87361 O WAT 9421 6.657 42.222 5.200 1.00 0.00 O ATOM 87362 H1 WAT 9421 7.022 41.860 4.393 1.00 0.00 H ATOM 87363 H2 WAT 9421 7.280 41.969 5.881 1.00 0.00 H TER 87365 WAT 9421 ATOM 87365 O WAT 9422 91.570 55.435 93.541 1.00 0.00 O ATOM 87366 H1 WAT 9422 91.137 56.267 93.353 1.00 0.00 H ATOM 87367 H2 WAT 9422 92.126 55.619 94.298 1.00 0.00 H TER 87369 WAT 9422 ATOM 87369 O WAT 9423 60.712 14.563 3.482 1.00 0.00 O ATOM 87370 H1 WAT 9423 60.659 13.609 3.532 1.00 0.00 H ATOM 87371 H2 WAT 9423 59.876 14.869 3.834 1.00 0.00 H TER 87373 WAT 9423 ATOM 87373 O WAT 9424 120.249 143.603 84.412 1.00 0.00 O ATOM 87374 H1 WAT 9424 119.793 143.503 85.248 1.00 0.00 H ATOM 87375 H2 WAT 9424 121.139 143.857 84.653 1.00 0.00 H TER 87377 WAT 9424 ATOM 87377 O WAT 9425 36.532 55.302 18.578 1.00 0.00 O ATOM 87378 H1 WAT 9425 35.659 54.948 18.745 1.00 0.00 H ATOM 87379 H2 WAT 9425 37.130 54.621 18.885 1.00 0.00 H TER 87381 WAT 9425 ATOM 87381 O WAT 9426 65.652 8.350 143.161 1.00 0.00 O ATOM 87382 H1 WAT 9426 65.054 7.789 143.655 1.00 0.00 H ATOM 87383 H2 WAT 9426 65.701 7.943 142.296 1.00 0.00 H TER 87385 WAT 9426 ATOM 87385 O WAT 9427 63.139 13.715 82.840 1.00 0.00 O ATOM 87386 H1 WAT 9427 63.769 13.741 82.120 1.00 0.00 H ATOM 87387 H2 WAT 9427 62.799 12.820 82.829 1.00 0.00 H TER 87389 WAT 9427 ATOM 87389 O WAT 9428 64.934 57.890 97.281 1.00 0.00 O ATOM 87390 H1 WAT 9428 64.637 56.981 97.320 1.00 0.00 H ATOM 87391 H2 WAT 9428 65.776 57.886 97.737 1.00 0.00 H TER 87393 WAT 9428 ATOM 87393 O WAT 9429 138.360 94.305 104.551 1.00 0.00 O ATOM 87394 H1 WAT 9429 138.874 93.499 104.499 1.00 0.00 H ATOM 87395 H2 WAT 9429 138.764 94.888 103.908 1.00 0.00 H TER 87397 WAT 9429 ATOM 87397 O WAT 9430 102.508 111.078 57.411 1.00 0.00 O ATOM 87398 H1 WAT 9430 101.910 110.710 58.062 1.00 0.00 H ATOM 87399 H2 WAT 9430 102.108 110.863 56.569 1.00 0.00 H TER 87401 WAT 9430 ATOM 87401 O WAT 9431 137.710 116.085 153.601 1.00 0.00 O ATOM 87402 H1 WAT 9431 138.166 116.070 154.442 1.00 0.00 H ATOM 87403 H2 WAT 9431 136.944 116.638 153.753 1.00 0.00 H TER 87405 WAT 9431 ATOM 87405 O WAT 9432 12.283 77.419 130.867 1.00 0.00 O ATOM 87406 H1 WAT 9432 11.991 76.586 130.497 1.00 0.00 H ATOM 87407 H2 WAT 9432 12.186 77.307 131.813 1.00 0.00 H TER 87409 WAT 9432 ATOM 87409 O WAT 9433 16.291 73.941 142.764 1.00 0.00 O ATOM 87410 H1 WAT 9433 15.579 73.373 143.058 1.00 0.00 H ATOM 87411 H2 WAT 9433 16.505 73.624 141.887 1.00 0.00 H TER 87413 WAT 9433 ATOM 87413 O WAT 9434 126.328 61.675 112.042 1.00 0.00 O ATOM 87414 H1 WAT 9434 126.938 60.995 111.757 1.00 0.00 H ATOM 87415 H2 WAT 9434 126.845 62.480 112.033 1.00 0.00 H TER 87417 WAT 9434 ATOM 87417 O WAT 9435 15.326 12.444 9.029 1.00 0.00 O ATOM 87418 H1 WAT 9435 14.483 12.889 9.115 1.00 0.00 H ATOM 87419 H2 WAT 9435 15.757 12.582 9.873 1.00 0.00 H TER 87421 WAT 9435 ATOM 87421 O WAT 9436 70.769 12.629 7.180 1.00 0.00 O ATOM 87422 H1 WAT 9436 70.922 13.334 7.809 1.00 0.00 H ATOM 87423 H2 WAT 9436 71.203 11.867 7.564 1.00 0.00 H TER 87425 WAT 9436 ATOM 87425 O WAT 9437 12.631 3.489 7.744 1.00 0.00 O ATOM 87426 H1 WAT 9437 12.102 3.564 8.538 1.00 0.00 H ATOM 87427 H2 WAT 9437 13.447 3.083 8.038 1.00 0.00 H TER 87429 WAT 9437 ATOM 87429 O WAT 9438 49.370 15.506 109.001 1.00 0.00 O ATOM 87430 H1 WAT 9438 49.704 16.245 109.509 1.00 0.00 H ATOM 87431 H2 WAT 9438 50.150 15.110 108.612 1.00 0.00 H TER 87433 WAT 9438 ATOM 87433 O WAT 9439 141.020 3.350 11.950 1.00 0.00 O ATOM 87434 H1 WAT 9439 140.591 3.361 12.806 1.00 0.00 H ATOM 87435 H2 WAT 9439 141.715 2.697 12.039 1.00 0.00 H TER 87437 WAT 9439 ATOM 87437 O WAT 9440 32.850 103.800 99.890 1.00 0.00 O ATOM 87438 H1 WAT 9440 33.012 102.861 99.792 1.00 0.00 H ATOM 87439 H2 WAT 9440 31.926 103.859 100.132 1.00 0.00 H TER 87441 WAT 9440 ATOM 87441 O WAT 9441 26.565 53.605 158.864 1.00 0.00 O ATOM 87442 H1 WAT 9441 27.367 53.349 158.408 1.00 0.00 H ATOM 87443 H2 WAT 9441 26.349 54.465 158.503 1.00 0.00 H TER 87445 WAT 9441 ATOM 87445 O WAT 9442 115.682 140.972 144.002 1.00 0.00 O ATOM 87446 H1 WAT 9442 115.216 140.148 143.858 1.00 0.00 H ATOM 87447 H2 WAT 9442 116.285 141.038 143.262 1.00 0.00 H TER 87449 WAT 9442 ATOM 87449 O WAT 9443 78.409 21.393 114.566 1.00 0.00 O ATOM 87450 H1 WAT 9443 78.247 21.393 115.509 1.00 0.00 H ATOM 87451 H2 WAT 9443 78.452 22.320 114.330 1.00 0.00 H TER 87453 WAT 9443 ATOM 87453 O WAT 9444 78.602 101.073 26.526 1.00 0.00 O ATOM 87454 H1 WAT 9444 77.963 100.755 27.163 1.00 0.00 H ATOM 87455 H2 WAT 9444 78.410 102.007 26.439 1.00 0.00 H TER 87457 WAT 9444 ATOM 87457 O WAT 9445 131.139 62.954 90.739 1.00 0.00 O ATOM 87458 H1 WAT 9445 131.261 63.764 90.244 1.00 0.00 H ATOM 87459 H2 WAT 9445 130.701 63.229 91.545 1.00 0.00 H TER 87461 WAT 9445 ATOM 87461 O WAT 9446 122.784 15.617 119.236 1.00 0.00 O ATOM 87462 H1 WAT 9446 122.766 14.663 119.160 1.00 0.00 H ATOM 87463 H2 WAT 9446 123.631 15.871 118.867 1.00 0.00 H TER 87465 WAT 9446 ATOM 87465 O WAT 9447 24.913 140.521 77.045 1.00 0.00 O ATOM 87466 H1 WAT 9447 25.432 141.324 77.101 1.00 0.00 H ATOM 87467 H2 WAT 9447 24.691 140.316 77.953 1.00 0.00 H TER 87469 WAT 9447 ATOM 87469 O WAT 9448 17.390 83.076 129.273 1.00 0.00 O ATOM 87470 H1 WAT 9448 16.853 82.513 128.715 1.00 0.00 H ATOM 87471 H2 WAT 9448 17.805 82.474 129.891 1.00 0.00 H TER 87473 WAT 9448 ATOM 87473 O WAT 9449 113.065 86.611 131.450 1.00 0.00 O ATOM 87474 H1 WAT 9449 112.998 85.853 130.869 1.00 0.00 H ATOM 87475 H2 WAT 9449 112.252 87.096 131.305 1.00 0.00 H TER 87477 WAT 9449 ATOM 87477 O WAT 9450 54.494 40.326 70.967 1.00 0.00 O ATOM 87478 H1 WAT 9450 54.120 40.127 71.825 1.00 0.00 H ATOM 87479 H2 WAT 9450 53.979 39.801 70.354 1.00 0.00 H TER 87481 WAT 9450 ATOM 87481 O WAT 9451 5.051 90.367 94.952 1.00 0.00 O ATOM 87482 H1 WAT 9451 5.935 90.303 95.314 1.00 0.00 H ATOM 87483 H2 WAT 9451 5.063 91.172 94.433 1.00 0.00 H TER 87485 WAT 9451 ATOM 87485 O WAT 9452 64.743 9.941 59.640 1.00 0.00 O ATOM 87486 H1 WAT 9452 64.277 9.452 58.962 1.00 0.00 H ATOM 87487 H2 WAT 9452 65.608 9.535 59.677 1.00 0.00 H TER 87489 WAT 9452 ATOM 87489 O WAT 9453 46.532 49.448 91.667 1.00 0.00 O ATOM 87490 H1 WAT 9453 45.816 49.993 91.342 1.00 0.00 H ATOM 87491 H2 WAT 9453 47.266 49.644 91.085 1.00 0.00 H TER 87493 WAT 9453 ATOM 87493 O WAT 9454 135.620 27.875 102.762 1.00 0.00 O ATOM 87494 H1 WAT 9454 136.209 27.629 102.049 1.00 0.00 H ATOM 87495 H2 WAT 9454 134.745 27.670 102.433 1.00 0.00 H TER 87497 WAT 9454 ATOM 87497 O WAT 9455 70.678 127.116 150.886 1.00 0.00 O ATOM 87498 H1 WAT 9455 71.170 127.317 150.090 1.00 0.00 H ATOM 87499 H2 WAT 9455 69.978 127.768 150.906 1.00 0.00 H TER 87501 WAT 9455 ATOM 87501 O WAT 9456 23.358 96.745 124.584 1.00 0.00 O ATOM 87502 H1 WAT 9456 23.887 97.444 124.199 1.00 0.00 H ATOM 87503 H2 WAT 9456 23.032 96.249 123.833 1.00 0.00 H TER 87505 WAT 9456 ATOM 87505 O WAT 9457 28.302 114.449 145.677 1.00 0.00 O ATOM 87506 H1 WAT 9457 27.876 114.488 146.534 1.00 0.00 H ATOM 87507 H2 WAT 9457 27.581 114.344 145.056 1.00 0.00 H TER 87509 WAT 9457 ATOM 87509 O WAT 9458 60.045 63.559 75.635 1.00 0.00 O ATOM 87510 H1 WAT 9458 59.203 63.263 75.290 1.00 0.00 H ATOM 87511 H2 WAT 9458 60.047 64.504 75.487 1.00 0.00 H TER 87513 WAT 9458 ATOM 87513 O WAT 9459 73.283 88.744 74.141 1.00 0.00 O ATOM 87514 H1 WAT 9459 72.736 88.066 74.537 1.00 0.00 H ATOM 87515 H2 WAT 9459 74.178 88.421 74.245 1.00 0.00 H TER 87517 WAT 9459 ATOM 87517 O WAT 9460 18.465 120.670 15.955 1.00 0.00 O ATOM 87518 H1 WAT 9460 18.491 119.911 15.373 1.00 0.00 H ATOM 87519 H2 WAT 9460 18.062 120.342 16.759 1.00 0.00 H TER 87521 WAT 9460 ATOM 87521 O WAT 9461 60.038 24.772 130.436 1.00 0.00 O ATOM 87522 H1 WAT 9461 59.115 25.024 130.421 1.00 0.00 H ATOM 87523 H2 WAT 9461 60.127 24.145 129.719 1.00 0.00 H TER 87525 WAT 9461 ATOM 87525 O WAT 9462 32.152 142.621 118.655 1.00 0.00 O ATOM 87526 H1 WAT 9462 32.746 142.967 117.989 1.00 0.00 H ATOM 87527 H2 WAT 9462 32.667 141.954 119.111 1.00 0.00 H TER 87529 WAT 9462 ATOM 87529 O WAT 9463 3.315 91.911 136.117 1.00 0.00 O ATOM 87530 H1 WAT 9463 2.549 92.459 136.291 1.00 0.00 H ATOM 87531 H2 WAT 9463 3.024 91.022 136.319 1.00 0.00 H TER 87533 WAT 9463 ATOM 87533 O WAT 9464 67.695 71.015 83.932 1.00 0.00 O ATOM 87534 H1 WAT 9464 67.224 71.350 83.169 1.00 0.00 H ATOM 87535 H2 WAT 9464 68.617 71.186 83.739 1.00 0.00 H TER 87537 WAT 9464 ATOM 87537 O WAT 9465 60.775 62.128 117.106 1.00 0.00 O ATOM 87538 H1 WAT 9465 61.637 62.123 116.692 1.00 0.00 H ATOM 87539 H2 WAT 9465 60.851 61.501 117.826 1.00 0.00 H TER 87541 WAT 9465 ATOM 87541 O WAT 9466 22.737 83.161 105.133 1.00 0.00 O ATOM 87542 H1 WAT 9466 22.824 82.337 105.612 1.00 0.00 H ATOM 87543 H2 WAT 9466 23.605 83.314 104.760 1.00 0.00 H TER 87545 WAT 9466 ATOM 87545 O WAT 9467 133.325 69.561 116.681 1.00 0.00 O ATOM 87546 H1 WAT 9467 133.761 68.815 117.091 1.00 0.00 H ATOM 87547 H2 WAT 9467 132.766 69.171 116.008 1.00 0.00 H TER 87549 WAT 9467 ATOM 87549 O WAT 9468 113.593 25.425 7.386 1.00 0.00 O ATOM 87550 H1 WAT 9468 113.513 24.544 7.020 1.00 0.00 H ATOM 87551 H2 WAT 9468 114.206 25.872 6.803 1.00 0.00 H TER 87553 WAT 9468 ATOM 87553 O WAT 9469 71.789 28.972 132.492 1.00 0.00 O ATOM 87554 H1 WAT 9469 71.141 29.316 133.107 1.00 0.00 H ATOM 87555 H2 WAT 9469 71.329 28.274 132.026 1.00 0.00 H TER 87557 WAT 9469 ATOM 87557 O WAT 9470 16.541 1.009 96.554 1.00 0.00 O ATOM 87558 H1 WAT 9470 17.228 1.672 96.618 1.00 0.00 H ATOM 87559 H2 WAT 9470 15.730 1.512 96.474 1.00 0.00 H TER 87561 WAT 9470 ATOM 87561 O WAT 9471 1.839 70.856 137.720 1.00 0.00 O ATOM 87562 H1 WAT 9471 1.312 71.471 138.229 1.00 0.00 H ATOM 87563 H2 WAT 9471 1.748 70.022 138.182 1.00 0.00 H TER 87565 WAT 9471 ATOM 87565 O WAT 9472 109.630 111.343 10.239 1.00 0.00 O ATOM 87566 H1 WAT 9472 110.417 111.222 9.708 1.00 0.00 H ATOM 87567 H2 WAT 9472 109.954 111.677 11.076 1.00 0.00 H TER 87569 WAT 9472 ATOM 87569 O WAT 9473 50.745 15.861 144.706 1.00 0.00 O ATOM 87570 H1 WAT 9473 49.925 15.994 145.181 1.00 0.00 H ATOM 87571 H2 WAT 9473 50.992 16.735 144.404 1.00 0.00 H TER 87573 WAT 9473 ATOM 87573 O WAT 9474 80.466 25.407 73.867 1.00 0.00 O ATOM 87574 H1 WAT 9474 81.201 25.992 74.049 1.00 0.00 H ATOM 87575 H2 WAT 9474 80.746 24.558 74.208 1.00 0.00 H TER 87577 WAT 9474 ATOM 87577 O WAT 9475 70.072 53.582 129.638 1.00 0.00 O ATOM 87578 H1 WAT 9475 70.141 52.652 129.853 1.00 0.00 H ATOM 87579 H2 WAT 9475 70.792 53.741 129.027 1.00 0.00 H TER 87581 WAT 9475 ATOM 87581 O WAT 9476 96.690 44.684 104.865 1.00 0.00 O ATOM 87582 H1 WAT 9476 96.330 44.829 103.990 1.00 0.00 H ATOM 87583 H2 WAT 9476 96.502 45.495 105.339 1.00 0.00 H TER 87585 WAT 9476 ATOM 87585 O WAT 9477 101.228 26.012 13.901 1.00 0.00 O ATOM 87586 H1 WAT 9477 101.828 25.341 14.226 1.00 0.00 H ATOM 87587 H2 WAT 9477 101.642 26.338 13.101 1.00 0.00 H TER 87589 WAT 9477 ATOM 87589 O WAT 9478 109.954 128.337 67.038 1.00 0.00 O ATOM 87590 H1 WAT 9478 109.789 127.443 66.738 1.00 0.00 H ATOM 87591 H2 WAT 9478 110.472 128.734 66.338 1.00 0.00 H TER 87593 WAT 9478 ATOM 87593 O WAT 9479 68.136 120.877 141.565 1.00 0.00 O ATOM 87594 H1 WAT 9479 67.758 120.934 140.688 1.00 0.00 H ATOM 87595 H2 WAT 9479 67.789 120.060 141.923 1.00 0.00 H TER 87597 WAT 9479 ATOM 87597 O WAT 9480 23.711 0.292 158.082 1.00 0.00 O ATOM 87598 H1 WAT 9480 23.628 0.215 159.032 1.00 0.00 H ATOM 87599 H2 WAT 9480 23.413 -0.553 157.746 1.00 0.00 H TER 87601 WAT 9480 ATOM 87601 O WAT 9481 78.228 97.564 110.946 1.00 0.00 O ATOM 87602 H1 WAT 9481 78.950 97.216 111.470 1.00 0.00 H ATOM 87603 H2 WAT 9481 77.817 96.790 110.560 1.00 0.00 H TER 87605 WAT 9481 ATOM 87605 O WAT 9482 81.107 22.437 111.452 1.00 0.00 O ATOM 87606 H1 WAT 9482 80.844 21.912 110.696 1.00 0.00 H ATOM 87607 H2 WAT 9482 81.196 23.325 111.108 1.00 0.00 H TER 87609 WAT 9482 ATOM 87609 O WAT 9483 76.202 132.259 75.550 1.00 0.00 O ATOM 87610 H1 WAT 9483 76.991 132.214 75.011 1.00 0.00 H ATOM 87611 H2 WAT 9483 75.927 131.347 75.649 1.00 0.00 H TER 87613 WAT 9483 ATOM 87613 O WAT 9484 18.035 10.801 125.915 1.00 0.00 O ATOM 87614 H1 WAT 9484 18.460 10.358 126.649 1.00 0.00 H ATOM 87615 H2 WAT 9484 17.729 10.091 125.351 1.00 0.00 H TER 87617 WAT 9484 ATOM 87617 O WAT 9485 20.382 136.868 91.364 1.00 0.00 O ATOM 87618 H1 WAT 9485 19.867 136.106 91.629 1.00 0.00 H ATOM 87619 H2 WAT 9485 19.884 137.255 90.643 1.00 0.00 H TER 87621 WAT 9485 ATOM 87621 O WAT 9486 61.448 40.015 156.124 1.00 0.00 O ATOM 87622 H1 WAT 9486 62.092 40.033 155.417 1.00 0.00 H ATOM 87623 H2 WAT 9486 61.961 39.836 156.912 1.00 0.00 H TER 87625 WAT 9486 ATOM 87625 O WAT 9487 122.566 123.178 63.203 1.00 0.00 O ATOM 87626 H1 WAT 9487 122.630 122.590 62.451 1.00 0.00 H ATOM 87627 H2 WAT 9487 123.474 123.384 63.424 1.00 0.00 H TER 87629 WAT 9487 ATOM 87629 O WAT 9488 90.719 75.796 7.335 1.00 0.00 O ATOM 87630 H1 WAT 9488 89.886 75.898 7.797 1.00 0.00 H ATOM 87631 H2 WAT 9488 91.262 75.282 7.932 1.00 0.00 H TER 87633 WAT 9488 ATOM 87633 O WAT 9489 103.863 115.203 8.281 1.00 0.00 O ATOM 87634 H1 WAT 9489 103.916 115.680 9.108 1.00 0.00 H ATOM 87635 H2 WAT 9489 103.567 115.856 7.646 1.00 0.00 H TER 87637 WAT 9489 ATOM 87637 O WAT 9490 19.180 31.270 71.257 1.00 0.00 O ATOM 87638 H1 WAT 9490 19.724 30.815 70.614 1.00 0.00 H ATOM 87639 H2 WAT 9490 18.284 31.138 70.948 1.00 0.00 H TER 87641 WAT 9490 ATOM 87641 O WAT 9491 36.944 40.380 89.049 1.00 0.00 O ATOM 87642 H1 WAT 9491 36.630 41.234 89.348 1.00 0.00 H ATOM 87643 H2 WAT 9491 37.836 40.320 89.390 1.00 0.00 H TER 87645 WAT 9491 ATOM 87645 O WAT 9492 50.067 40.632 7.289 1.00 0.00 O ATOM 87646 H1 WAT 9492 49.696 40.736 8.165 1.00 0.00 H ATOM 87647 H2 WAT 9492 50.018 39.692 7.118 1.00 0.00 H TER 87649 WAT 9492 ATOM 87649 O WAT 9493 35.235 4.464 0.991 1.00 0.00 O ATOM 87650 H1 WAT 9493 35.563 4.055 1.791 1.00 0.00 H ATOM 87651 H2 WAT 9493 34.777 3.760 0.532 1.00 0.00 H TER 87653 WAT 9493 ATOM 87653 O WAT 9494 111.343 35.799 9.557 1.00 0.00 O ATOM 87654 H1 WAT 9494 111.623 36.309 8.797 1.00 0.00 H ATOM 87655 H2 WAT 9494 111.504 34.889 9.307 1.00 0.00 H TER 87657 WAT 9494 ATOM 87657 O WAT 9495 47.667 79.915 131.855 1.00 0.00 O ATOM 87658 H1 WAT 9495 47.143 80.353 132.525 1.00 0.00 H ATOM 87659 H2 WAT 9495 47.862 80.602 131.217 1.00 0.00 H TER 87661 WAT 9495 ATOM 87661 O WAT 9496 16.537 12.357 81.082 1.00 0.00 O ATOM 87662 H1 WAT 9496 17.360 12.814 81.253 1.00 0.00 H ATOM 87663 H2 WAT 9496 16.388 11.828 81.865 1.00 0.00 H TER 87665 WAT 9496 ATOM 87665 O WAT 9497 79.127 111.025 91.136 1.00 0.00 O ATOM 87666 H1 WAT 9497 79.816 110.869 90.491 1.00 0.00 H ATOM 87667 H2 WAT 9497 78.556 110.260 91.067 1.00 0.00 H TER 87669 WAT 9497 ATOM 87669 O WAT 9498 78.441 101.422 143.682 1.00 0.00 O ATOM 87670 H1 WAT 9498 78.583 102.035 144.403 1.00 0.00 H ATOM 87671 H2 WAT 9498 77.691 101.781 143.208 1.00 0.00 H TER 87673 WAT 9498 ATOM 87673 O WAT 9499 93.776 145.288 93.409 1.00 0.00 O ATOM 87674 H1 WAT 9499 92.978 145.761 93.170 1.00 0.00 H ATOM 87675 H2 WAT 9499 93.469 144.426 93.687 1.00 0.00 H TER 87677 WAT 9499 ATOM 87677 O WAT 9500 100.594 10.441 156.618 1.00 0.00 O ATOM 87678 H1 WAT 9500 101.371 10.925 156.340 1.00 0.00 H ATOM 87679 H2 WAT 9500 99.965 11.118 156.867 1.00 0.00 H TER 87681 WAT 9500 ATOM 87681 O WAT 9501 138.615 40.197 136.061 1.00 0.00 O ATOM 87682 H1 WAT 9501 138.694 41.033 136.521 1.00 0.00 H ATOM 87683 H2 WAT 9501 139.489 40.037 135.704 1.00 0.00 H TER 87685 WAT 9501 ATOM 87685 O WAT 9502 56.932 79.286 117.835 1.00 0.00 O ATOM 87686 H1 WAT 9502 56.229 78.954 117.277 1.00 0.00 H ATOM 87687 H2 WAT 9502 57.538 78.550 117.920 1.00 0.00 H TER 87689 WAT 9502 ATOM 87689 O WAT 9503 54.111 98.844 61.288 1.00 0.00 O ATOM 87690 H1 WAT 9503 54.579 99.601 61.640 1.00 0.00 H ATOM 87691 H2 WAT 9503 54.345 98.828 60.360 1.00 0.00 H TER 87693 WAT 9503 ATOM 87693 O WAT 9504 80.290 69.480 145.125 1.00 0.00 O ATOM 87694 H1 WAT 9504 80.482 69.354 144.196 1.00 0.00 H ATOM 87695 H2 WAT 9504 81.053 69.121 145.579 1.00 0.00 H TER 87697 WAT 9504 ATOM 87697 O WAT 9505 76.335 110.843 1.344 1.00 0.00 O ATOM 87698 H1 WAT 9505 77.023 111.269 0.833 1.00 0.00 H ATOM 87699 H2 WAT 9505 75.547 110.937 0.810 1.00 0.00 H TER 87701 WAT 9505 ATOM 87701 O WAT 9506 54.078 131.927 78.929 1.00 0.00 O ATOM 87702 H1 WAT 9506 53.764 131.209 79.478 1.00 0.00 H ATOM 87703 H2 WAT 9506 53.916 131.633 78.033 1.00 0.00 H TER 87705 WAT 9506 ATOM 87705 O WAT 9507 137.665 2.470 109.451 1.00 0.00 O ATOM 87706 H1 WAT 9507 136.878 2.045 109.108 1.00 0.00 H ATOM 87707 H2 WAT 9507 138.325 1.776 109.465 1.00 0.00 H TER 87709 WAT 9507 ATOM 87709 O WAT 9508 81.947 10.965 143.883 1.00 0.00 O ATOM 87710 H1 WAT 9508 82.416 11.200 144.683 1.00 0.00 H ATOM 87711 H2 WAT 9508 82.479 10.274 143.488 1.00 0.00 H TER 87713 WAT 9508 ATOM 87713 O WAT 9509 86.620 54.016 14.243 1.00 0.00 O ATOM 87714 H1 WAT 9509 87.050 54.047 15.097 1.00 0.00 H ATOM 87715 H2 WAT 9509 85.972 54.719 14.275 1.00 0.00 H TER 87717 WAT 9509 ATOM 87717 O WAT 9510 52.427 135.379 93.616 1.00 0.00 O ATOM 87718 H1 WAT 9510 51.568 135.515 93.217 1.00 0.00 H ATOM 87719 H2 WAT 9510 52.485 134.432 93.743 1.00 0.00 H TER 87721 WAT 9510 ATOM 87721 O WAT 9511 39.557 96.196 152.990 1.00 0.00 O ATOM 87722 H1 WAT 9511 39.030 95.407 152.865 1.00 0.00 H ATOM 87723 H2 WAT 9511 38.920 96.878 153.205 1.00 0.00 H TER 87725 WAT 9511 ATOM 87725 O WAT 9512 34.644 37.080 96.340 1.00 0.00 O ATOM 87726 H1 WAT 9512 34.264 36.790 95.510 1.00 0.00 H ATOM 87727 H2 WAT 9512 35.521 36.695 96.348 1.00 0.00 H TER 87729 WAT 9512 ATOM 87729 O WAT 9513 94.129 12.299 80.488 1.00 0.00 O ATOM 87730 H1 WAT 9513 94.436 12.796 81.246 1.00 0.00 H ATOM 87731 H2 WAT 9513 94.686 12.594 79.767 1.00 0.00 H TER 87733 WAT 9513 ATOM 87733 O WAT 9514 133.119 106.782 22.491 1.00 0.00 O ATOM 87734 H1 WAT 9514 132.881 107.444 23.140 1.00 0.00 H ATOM 87735 H2 WAT 9514 133.913 106.378 22.841 1.00 0.00 H TER 87737 WAT 9514 ATOM 87737 O WAT 9515 95.723 47.357 105.561 1.00 0.00 O ATOM 87738 H1 WAT 9515 94.904 47.510 105.091 1.00 0.00 H ATOM 87739 H2 WAT 9515 96.252 48.134 105.378 1.00 0.00 H TER 87741 WAT 9515 ATOM 87741 O WAT 9516 32.275 10.226 83.026 1.00 0.00 O ATOM 87742 H1 WAT 9516 32.554 9.720 83.789 1.00 0.00 H ATOM 87743 H2 WAT 9516 32.682 11.084 83.144 1.00 0.00 H TER 87745 WAT 9516 ATOM 87745 O WAT 9517 95.945 44.004 151.132 1.00 0.00 O ATOM 87746 H1 WAT 9517 95.350 43.728 150.434 1.00 0.00 H ATOM 87747 H2 WAT 9517 95.531 43.692 151.937 1.00 0.00 H TER 87749 WAT 9517 ATOM 87749 O WAT 9518 93.950 29.475 13.883 1.00 0.00 O ATOM 87750 H1 WAT 9518 93.081 29.561 14.275 1.00 0.00 H ATOM 87751 H2 WAT 9518 94.041 28.538 13.707 1.00 0.00 H TER 87753 WAT 9518 ATOM 87753 O WAT 9519 125.439 37.250 64.282 1.00 0.00 O ATOM 87754 H1 WAT 9519 125.113 36.988 63.421 1.00 0.00 H ATOM 87755 H2 WAT 9519 124.922 38.023 64.508 1.00 0.00 H TER 87757 WAT 9519 ATOM 87757 O WAT 9520 1.926 77.895 68.372 1.00 0.00 O ATOM 87758 H1 WAT 9520 1.403 77.928 67.570 1.00 0.00 H ATOM 87759 H2 WAT 9520 2.323 78.763 68.435 1.00 0.00 H TER 87761 WAT 9520 ATOM 87761 O WAT 9521 65.563 0.327 101.276 1.00 0.00 O ATOM 87762 H1 WAT 9521 66.258 0.690 101.825 1.00 0.00 H ATOM 87763 H2 WAT 9521 65.982 -0.392 100.803 1.00 0.00 H TER 87765 WAT 9521 ATOM 87765 O WAT 9522 11.328 24.297 115.411 1.00 0.00 O ATOM 87766 H1 WAT 9522 11.005 24.144 114.524 1.00 0.00 H ATOM 87767 H2 WAT 9522 11.572 25.223 115.422 1.00 0.00 H TER 87769 WAT 9522 ATOM 87769 O WAT 9523 71.638 89.620 27.931 1.00 0.00 O ATOM 87770 H1 WAT 9523 70.776 89.955 28.178 1.00 0.00 H ATOM 87771 H2 WAT 9523 71.452 88.896 27.334 1.00 0.00 H TER 87773 WAT 9523 ATOM 87773 O WAT 9524 113.253 132.291 108.318 1.00 0.00 O ATOM 87774 H1 WAT 9524 113.976 131.738 108.023 1.00 0.00 H ATOM 87775 H2 WAT 9524 113.548 133.185 108.142 1.00 0.00 H TER 87777 WAT 9524 ATOM 87777 O WAT 9525 36.967 4.860 148.057 1.00 0.00 O ATOM 87778 H1 WAT 9525 36.629 4.667 147.183 1.00 0.00 H ATOM 87779 H2 WAT 9525 36.214 5.207 148.535 1.00 0.00 H TER 87781 WAT 9525 ATOM 87781 O WAT 9526 104.862 139.255 110.005 1.00 0.00 O ATOM 87782 H1 WAT 9526 104.712 140.184 109.832 1.00 0.00 H ATOM 87783 H2 WAT 9526 103.996 138.908 110.218 1.00 0.00 H TER 87785 WAT 9526 ATOM 87785 O WAT 9527 25.460 16.119 69.032 1.00 0.00 O ATOM 87786 H1 WAT 9527 25.803 16.815 69.592 1.00 0.00 H ATOM 87787 H2 WAT 9527 25.240 15.411 69.638 1.00 0.00 H TER 87789 WAT 9527 ATOM 87789 O WAT 9528 19.813 21.887 68.465 1.00 0.00 O ATOM 87790 H1 WAT 9528 19.405 22.383 67.755 1.00 0.00 H ATOM 87791 H2 WAT 9528 20.693 21.688 68.143 1.00 0.00 H TER 87793 WAT 9528 ATOM 87793 O WAT 9529 110.958 101.794 119.444 1.00 0.00 O ATOM 87794 H1 WAT 9529 110.394 102.284 118.847 1.00 0.00 H ATOM 87795 H2 WAT 9529 110.363 101.452 120.111 1.00 0.00 H TER 87797 WAT 9529 ATOM 87797 O WAT 9530 15.166 57.975 156.721 1.00 0.00 O ATOM 87798 H1 WAT 9530 14.479 57.396 157.050 1.00 0.00 H ATOM 87799 H2 WAT 9530 15.104 58.757 157.270 1.00 0.00 H TER 87801 WAT 9530 ATOM 87801 O WAT 9531 73.524 123.580 97.743 1.00 0.00 O ATOM 87802 H1 WAT 9531 73.848 123.309 98.602 1.00 0.00 H ATOM 87803 H2 WAT 9531 73.122 122.791 97.379 1.00 0.00 H TER 87805 WAT 9531 ATOM 87805 O WAT 9532 36.330 15.577 62.434 1.00 0.00 O ATOM 87806 H1 WAT 9532 36.560 16.279 61.825 1.00 0.00 H ATOM 87807 H2 WAT 9532 35.451 15.308 62.169 1.00 0.00 H TER 87809 WAT 9532 ATOM 87809 O WAT 9533 88.077 75.828 127.651 1.00 0.00 O ATOM 87810 H1 WAT 9533 88.776 75.205 127.456 1.00 0.00 H ATOM 87811 H2 WAT 9533 87.504 75.363 128.260 1.00 0.00 H TER 87813 WAT 9533 ATOM 87813 O WAT 9534 73.738 23.623 67.494 1.00 0.00 O ATOM 87814 H1 WAT 9534 73.550 23.219 68.341 1.00 0.00 H ATOM 87815 H2 WAT 9534 73.392 24.512 67.571 1.00 0.00 H TER 87817 WAT 9534 ATOM 87817 O WAT 9535 140.772 15.507 128.723 1.00 0.00 O ATOM 87818 H1 WAT 9535 140.708 15.821 129.625 1.00 0.00 H ATOM 87819 H2 WAT 9535 141.415 14.799 128.761 1.00 0.00 H TER 87821 WAT 9535 ATOM 87821 O WAT 9536 5.741 77.195 20.581 1.00 0.00 O ATOM 87822 H1 WAT 9536 5.770 78.039 21.033 1.00 0.00 H ATOM 87823 H2 WAT 9536 6.216 76.598 21.158 1.00 0.00 H TER 87825 WAT 9536 ATOM 87825 O WAT 9537 87.922 2.235 129.824 1.00 0.00 O ATOM 87826 H1 WAT 9537 87.463 1.456 130.137 1.00 0.00 H ATOM 87827 H2 WAT 9537 88.492 2.486 130.551 1.00 0.00 H TER 87829 WAT 9537 ATOM 87829 O WAT 9538 132.626 12.599 5.740 1.00 0.00 O ATOM 87830 H1 WAT 9538 132.539 12.733 6.684 1.00 0.00 H ATOM 87831 H2 WAT 9538 132.622 11.648 5.632 1.00 0.00 H TER 87833 WAT 9538 ATOM 87833 O WAT 9539 126.406 28.782 87.870 1.00 0.00 O ATOM 87834 H1 WAT 9539 125.645 28.616 87.315 1.00 0.00 H ATOM 87835 H2 WAT 9539 126.947 29.386 87.361 1.00 0.00 H TER 87837 WAT 9539 ATOM 87837 O WAT 9540 112.251 92.966 56.827 1.00 0.00 O ATOM 87838 H1 WAT 9540 112.699 93.761 57.115 1.00 0.00 H ATOM 87839 H2 WAT 9540 112.370 92.349 57.550 1.00 0.00 H TER 87841 WAT 9540 ATOM 87841 O WAT 9541 1.120 87.028 102.559 1.00 0.00 O ATOM 87842 H1 WAT 9541 1.082 86.078 102.456 1.00 0.00 H ATOM 87843 H2 WAT 9541 0.210 87.314 102.479 1.00 0.00 H TER 87845 WAT 9541 ATOM 87845 O WAT 9542 53.396 81.454 17.263 1.00 0.00 O ATOM 87846 H1 WAT 9542 54.347 81.517 17.357 1.00 0.00 H ATOM 87847 H2 WAT 9542 53.119 82.342 17.040 1.00 0.00 H TER 87849 WAT 9542 ATOM 87849 O WAT 9543 51.345 33.042 118.410 1.00 0.00 O ATOM 87850 H1 WAT 9543 51.433 32.228 117.914 1.00 0.00 H ATOM 87851 H2 WAT 9543 51.135 33.703 117.751 1.00 0.00 H TER 87853 WAT 9543 ATOM 87853 O WAT 9544 10.592 0.145 97.018 1.00 0.00 O ATOM 87854 H1 WAT 9544 10.345 -0.703 97.387 1.00 0.00 H ATOM 87855 H2 WAT 9544 11.181 0.527 97.668 1.00 0.00 H TER 87857 WAT 9544 ATOM 87857 O WAT 9545 69.390 89.893 69.752 1.00 0.00 O ATOM 87858 H1 WAT 9545 68.839 90.498 70.248 1.00 0.00 H ATOM 87859 H2 WAT 9545 70.107 89.678 70.349 1.00 0.00 H TER 87861 WAT 9545 ATOM 87861 O WAT 9546 43.549 81.766 15.961 1.00 0.00 O ATOM 87862 H1 WAT 9546 43.323 82.435 15.315 1.00 0.00 H ATOM 87863 H2 WAT 9546 43.405 80.936 15.507 1.00 0.00 H TER 87865 WAT 9546 ATOM 87865 O WAT 9547 0.326 4.536 146.490 1.00 0.00 O ATOM 87866 H1 WAT 9547 0.737 3.953 147.129 1.00 0.00 H ATOM 87867 H2 WAT 9547 0.944 4.564 145.759 1.00 0.00 H TER 87869 WAT 9547 ATOM 87869 O WAT 9548 27.247 84.239 154.365 1.00 0.00 O ATOM 87870 H1 WAT 9548 26.615 83.869 153.749 1.00 0.00 H ATOM 87871 H2 WAT 9548 28.064 84.289 153.868 1.00 0.00 H TER 87873 WAT 9548 ATOM 87873 O WAT 9549 65.635 124.372 98.578 1.00 0.00 O ATOM 87874 H1 WAT 9549 65.668 124.319 97.623 1.00 0.00 H ATOM 87875 H2 WAT 9549 65.570 125.308 98.764 1.00 0.00 H TER 87877 WAT 9549 ATOM 87877 O WAT 9550 35.622 11.330 1.984 1.00 0.00 O ATOM 87878 H1 WAT 9550 36.308 11.560 2.610 1.00 0.00 H ATOM 87879 H2 WAT 9550 36.089 10.918 1.257 1.00 0.00 H TER 87881 WAT 9550 ATOM 87881 O WAT 9551 37.535 25.424 92.267 1.00 0.00 O ATOM 87882 H1 WAT 9551 37.951 26.227 91.952 1.00 0.00 H ATOM 87883 H2 WAT 9551 38.156 24.730 92.045 1.00 0.00 H TER 87885 WAT 9551 ATOM 87885 O WAT 9552 37.671 7.390 128.835 1.00 0.00 O ATOM 87886 H1 WAT 9552 38.199 7.317 129.629 1.00 0.00 H ATOM 87887 H2 WAT 9552 37.250 6.535 128.747 1.00 0.00 H TER 87889 WAT 9552 ATOM 87889 O WAT 9553 132.194 50.556 110.485 1.00 0.00 O ATOM 87890 H1 WAT 9553 132.555 50.271 111.324 1.00 0.00 H ATOM 87891 H2 WAT 9553 131.992 49.743 110.022 1.00 0.00 H TER 87893 WAT 9553 ATOM 87893 O WAT 9554 41.908 0.194 90.190 1.00 0.00 O ATOM 87894 H1 WAT 9554 42.382 -0.309 90.853 1.00 0.00 H ATOM 87895 H2 WAT 9554 41.188 0.604 90.669 1.00 0.00 H TER 87897 WAT 9554 ATOM 87897 O WAT 9555 45.851 59.612 134.301 1.00 0.00 O ATOM 87898 H1 WAT 9555 46.454 58.989 134.706 1.00 0.00 H ATOM 87899 H2 WAT 9555 45.458 60.079 135.039 1.00 0.00 H TER 87901 WAT 9555 ATOM 87901 O WAT 9556 51.336 3.761 111.606 1.00 0.00 O ATOM 87902 H1 WAT 9556 51.112 3.416 110.742 1.00 0.00 H ATOM 87903 H2 WAT 9556 50.599 3.511 112.163 1.00 0.00 H TER 87905 WAT 9556 ATOM 87905 O WAT 9557 123.876 51.466 1.334 1.00 0.00 O ATOM 87906 H1 WAT 9557 123.705 52.408 1.342 1.00 0.00 H ATOM 87907 H2 WAT 9557 123.160 51.097 0.818 1.00 0.00 H TER 87909 WAT 9557 ATOM 87909 O WAT 9558 7.790 141.692 103.280 1.00 0.00 O ATOM 87910 H1 WAT 9558 7.182 141.114 103.740 1.00 0.00 H ATOM 87911 H2 WAT 9558 7.449 141.735 102.386 1.00 0.00 H TER 87913 WAT 9558 ATOM 87913 O WAT 9559 90.739 115.451 78.539 1.00 0.00 O ATOM 87914 H1 WAT 9559 91.472 115.791 79.053 1.00 0.00 H ATOM 87915 H2 WAT 9559 91.011 114.568 78.289 1.00 0.00 H TER 87917 WAT 9559 ATOM 87917 O WAT 9560 56.604 106.899 3.297 1.00 0.00 O ATOM 87918 H1 WAT 9560 56.943 107.076 4.174 1.00 0.00 H ATOM 87919 H2 WAT 9560 56.266 107.742 2.996 1.00 0.00 H TER 87921 WAT 9560 ATOM 87921 O WAT 9561 16.535 91.667 157.706 1.00 0.00 O ATOM 87922 H1 WAT 9561 17.311 91.108 157.661 1.00 0.00 H ATOM 87923 H2 WAT 9561 15.937 91.300 157.055 1.00 0.00 H TER 87925 WAT 9561 ATOM 87925 O WAT 9562 143.861 141.857 145.341 1.00 0.00 O ATOM 87926 H1 WAT 9562 143.145 142.491 145.379 1.00 0.00 H ATOM 87927 H2 WAT 9562 144.497 142.175 145.981 1.00 0.00 H TER 87929 WAT 9562 ATOM 87929 O WAT 9563 8.562 91.759 120.926 1.00 0.00 O ATOM 87930 H1 WAT 9563 8.434 91.290 121.750 1.00 0.00 H ATOM 87931 H2 WAT 9563 7.781 92.305 120.837 1.00 0.00 H TER 87933 WAT 9563 ATOM 87933 O WAT 9564 13.879 22.901 145.620 1.00 0.00 O ATOM 87934 H1 WAT 9564 13.929 23.796 145.958 1.00 0.00 H ATOM 87935 H2 WAT 9564 14.775 22.569 145.688 1.00 0.00 H TER 87937 WAT 9564 ATOM 87937 O WAT 9565 138.306 104.222 83.432 1.00 0.00 O ATOM 87938 H1 WAT 9565 138.991 103.561 83.533 1.00 0.00 H ATOM 87939 H2 WAT 9565 137.571 103.884 83.943 1.00 0.00 H TER 87941 WAT 9565 ATOM 87941 O WAT 9566 76.635 134.685 65.777 1.00 0.00 O ATOM 87942 H1 WAT 9566 76.407 133.898 66.273 1.00 0.00 H ATOM 87943 H2 WAT 9566 76.976 135.291 66.435 1.00 0.00 H TER 87945 WAT 9566 ATOM 87945 O WAT 9567 116.202 127.187 107.272 1.00 0.00 O ATOM 87946 H1 WAT 9567 117.082 127.275 106.906 1.00 0.00 H ATOM 87947 H2 WAT 9567 116.324 127.291 108.216 1.00 0.00 H TER 87949 WAT 9567 ATOM 87949 O WAT 9568 5.133 44.111 125.948 1.00 0.00 O ATOM 87950 H1 WAT 9568 4.730 44.722 125.331 1.00 0.00 H ATOM 87951 H2 WAT 9568 5.509 43.425 125.396 1.00 0.00 H TER 87953 WAT 9568 ATOM 87953 O WAT 9569 83.180 36.069 120.768 1.00 0.00 O ATOM 87954 H1 WAT 9569 82.351 36.548 120.781 1.00 0.00 H ATOM 87955 H2 WAT 9569 83.338 35.840 121.683 1.00 0.00 H TER 87957 WAT 9569 ATOM 87957 O WAT 9570 101.511 134.254 15.473 1.00 0.00 O ATOM 87958 H1 WAT 9570 101.125 133.942 16.291 1.00 0.00 H ATOM 87959 H2 WAT 9570 100.886 134.901 15.145 1.00 0.00 H TER 87961 WAT 9570 ATOM 87961 O WAT 9571 45.751 45.541 132.541 1.00 0.00 O ATOM 87962 H1 WAT 9571 45.357 44.806 132.071 1.00 0.00 H ATOM 87963 H2 WAT 9571 46.338 45.131 133.177 1.00 0.00 H TER 87965 WAT 9571 ATOM 87965 O WAT 9572 121.448 12.622 136.152 1.00 0.00 O ATOM 87966 H1 WAT 9572 121.672 12.090 135.388 1.00 0.00 H ATOM 87967 H2 WAT 9572 120.593 12.998 135.941 1.00 0.00 H TER 87969 WAT 9572 ATOM 87969 O WAT 9573 138.130 60.446 89.778 1.00 0.00 O ATOM 87970 H1 WAT 9573 138.875 60.978 90.057 1.00 0.00 H ATOM 87971 H2 WAT 9573 138.171 60.457 88.822 1.00 0.00 H TER 87973 WAT 9573 ATOM 87973 O WAT 9574 28.080 31.735 28.300 1.00 0.00 O ATOM 87974 H1 WAT 9574 28.529 32.007 27.499 1.00 0.00 H ATOM 87975 H2 WAT 9574 28.664 31.086 28.692 1.00 0.00 H TER 87977 WAT 9574 ATOM 87977 O WAT 9575 27.064 80.180 99.412 1.00 0.00 O ATOM 87978 H1 WAT 9575 27.064 79.755 98.554 1.00 0.00 H ATOM 87979 H2 WAT 9575 27.856 80.717 99.413 1.00 0.00 H TER 87981 WAT 9575 ATOM 87981 O WAT 9576 118.844 11.542 85.404 1.00 0.00 O ATOM 87982 H1 WAT 9576 118.198 12.248 85.410 1.00 0.00 H ATOM 87983 H2 WAT 9576 118.618 11.017 84.636 1.00 0.00 H TER 87985 WAT 9576 ATOM 87985 O WAT 9577 93.974 1.295 89.095 1.00 0.00 O ATOM 87986 H1 WAT 9577 93.622 1.902 88.444 1.00 0.00 H ATOM 87987 H2 WAT 9577 94.609 1.814 89.589 1.00 0.00 H TER 87989 WAT 9577 ATOM 87989 O WAT 9578 86.036 120.318 80.747 1.00 0.00 O ATOM 87990 H1 WAT 9578 86.217 121.258 80.775 1.00 0.00 H ATOM 87991 H2 WAT 9578 86.519 119.959 81.491 1.00 0.00 H TER 87993 WAT 9578 ATOM 87993 O WAT 9579 38.651 53.181 122.206 1.00 0.00 O ATOM 87994 H1 WAT 9579 38.243 52.974 121.364 1.00 0.00 H ATOM 87995 H2 WAT 9579 38.995 52.343 122.517 1.00 0.00 H TER 87997 WAT 9579 ATOM 87997 O WAT 9580 30.268 34.270 83.125 1.00 0.00 O ATOM 87998 H1 WAT 9580 29.730 35.037 82.931 1.00 0.00 H ATOM 87999 H2 WAT 9580 30.709 34.487 83.946 1.00 0.00 H TER 88001 WAT 9580 ATOM 88001 O WAT 9581 49.012 113.048 117.035 1.00 0.00 O ATOM 88002 H1 WAT 9581 49.747 112.863 117.620 1.00 0.00 H ATOM 88003 H2 WAT 9581 49.188 113.927 116.700 1.00 0.00 H TER 88005 WAT 9581 ATOM 88005 O WAT 9582 131.617 2.732 4.149 1.00 0.00 O ATOM 88006 H1 WAT 9582 131.071 2.906 4.916 1.00 0.00 H ATOM 88007 H2 WAT 9582 130.993 2.623 3.431 1.00 0.00 H TER 88009 WAT 9582 ATOM 88009 O WAT 9583 103.995 111.821 20.284 1.00 0.00 O ATOM 88010 H1 WAT 9583 104.361 112.658 20.569 1.00 0.00 H ATOM 88011 H2 WAT 9583 104.277 111.733 19.373 1.00 0.00 H TER 88013 WAT 9583 ATOM 88013 O WAT 9584 38.948 72.146 86.894 1.00 0.00 O ATOM 88014 H1 WAT 9584 37.998 72.074 86.988 1.00 0.00 H ATOM 88015 H2 WAT 9584 39.153 73.027 87.207 1.00 0.00 H TER 88017 WAT 9584 ATOM 88017 O WAT 9585 54.787 15.224 24.327 1.00 0.00 O ATOM 88018 H1 WAT 9585 54.213 14.644 23.826 1.00 0.00 H ATOM 88019 H2 WAT 9585 54.198 15.876 24.705 1.00 0.00 H TER 88021 WAT 9585 ATOM 88021 O WAT 9586 117.457 13.563 9.580 1.00 0.00 O ATOM 88022 H1 WAT 9586 118.224 14.127 9.679 1.00 0.00 H ATOM 88023 H2 WAT 9586 117.805 12.673 9.642 1.00 0.00 H TER 88025 WAT 9586 ATOM 88025 O WAT 9587 7.683 135.153 98.254 1.00 0.00 O ATOM 88026 H1 WAT 9587 8.509 134.699 98.088 1.00 0.00 H ATOM 88027 H2 WAT 9587 7.009 134.530 97.980 1.00 0.00 H TER 88029 WAT 9587 ATOM 88029 O WAT 9588 56.976 40.328 72.126 1.00 0.00 O ATOM 88030 H1 WAT 9588 56.190 40.238 71.587 1.00 0.00 H ATOM 88031 H2 WAT 9588 57.527 39.587 71.872 1.00 0.00 H TER 88033 WAT 9588 ATOM 88033 O WAT 9589 32.970 115.198 62.566 1.00 0.00 O ATOM 88034 H1 WAT 9589 33.603 115.013 63.259 1.00 0.00 H ATOM 88035 H2 WAT 9589 33.492 115.223 61.764 1.00 0.00 H TER 88037 WAT 9589 ATOM 88037 O WAT 9590 144.437 1.785 157.740 1.00 0.00 O ATOM 88038 H1 WAT 9590 143.783 1.137 158.003 1.00 0.00 H ATOM 88039 H2 WAT 9590 144.369 2.475 158.400 1.00 0.00 H TER 88041 WAT 9590 ATOM 88041 O WAT 9591 52.144 133.860 54.746 1.00 0.00 O ATOM 88042 H1 WAT 9591 51.962 134.727 54.382 1.00 0.00 H ATOM 88043 H2 WAT 9591 53.054 133.686 54.505 1.00 0.00 H TER 88045 WAT 9591 ATOM 88045 O WAT 9592 65.822 75.361 8.139 1.00 0.00 O ATOM 88046 H1 WAT 9592 65.187 75.028 8.772 1.00 0.00 H ATOM 88047 H2 WAT 9592 65.979 76.266 8.409 1.00 0.00 H TER 88049 WAT 9592 ATOM 88049 O WAT 9593 101.584 25.226 155.097 1.00 0.00 O ATOM 88050 H1 WAT 9593 102.214 24.980 154.420 1.00 0.00 H ATOM 88051 H2 WAT 9593 100.752 25.310 154.631 1.00 0.00 H TER 88053 WAT 9593 ATOM 88053 O WAT 9594 29.761 54.099 62.464 1.00 0.00 O ATOM 88054 H1 WAT 9594 29.448 54.880 62.009 1.00 0.00 H ATOM 88055 H2 WAT 9594 29.134 53.968 63.175 1.00 0.00 H TER 88057 WAT 9594 ATOM 88057 O WAT 9595 144.839 87.409 18.422 1.00 0.00 O ATOM 88058 H1 WAT 9595 145.381 87.377 19.210 1.00 0.00 H ATOM 88059 H2 WAT 9595 145.025 88.265 18.038 1.00 0.00 H TER 88061 WAT 9595 ATOM 88061 O WAT 9596 90.706 70.600 113.612 1.00 0.00 O ATOM 88062 H1 WAT 9596 91.656 70.559 113.723 1.00 0.00 H ATOM 88063 H2 WAT 9596 90.453 69.708 113.375 1.00 0.00 H TER 88065 WAT 9596 ATOM 88065 O WAT 9597 132.558 86.214 120.639 1.00 0.00 O ATOM 88066 H1 WAT 9597 133.039 86.847 120.105 1.00 0.00 H ATOM 88067 H2 WAT 9597 133.123 86.064 121.398 1.00 0.00 H TER 88069 WAT 9597 ATOM 88069 O WAT 9598 51.716 4.354 52.752 1.00 0.00 O ATOM 88070 H1 WAT 9598 52.152 5.135 53.092 1.00 0.00 H ATOM 88071 H2 WAT 9598 50.816 4.635 52.585 1.00 0.00 H TER 88073 WAT 9598 ATOM 88073 O WAT 9599 16.417 0.075 4.469 1.00 0.00 O ATOM 88074 H1 WAT 9599 16.999 0.266 5.205 1.00 0.00 H ATOM 88075 H2 WAT 9599 15.806 0.812 4.449 1.00 0.00 H TER 88077 WAT 9599 ATOM 88077 O WAT 9600 114.907 144.001 91.388 1.00 0.00 O ATOM 88078 H1 WAT 9600 115.214 144.577 92.089 1.00 0.00 H ATOM 88079 H2 WAT 9600 115.677 143.866 90.835 1.00 0.00 H TER 88081 WAT 9600 ATOM 88081 O WAT 9601 89.563 71.155 136.016 1.00 0.00 O ATOM 88082 H1 WAT 9601 90.486 71.144 136.271 1.00 0.00 H ATOM 88083 H2 WAT 9601 89.381 70.256 135.742 1.00 0.00 H TER 88085 WAT 9601 ATOM 88085 O WAT 9602 145.350 103.700 57.278 1.00 0.00 O ATOM 88086 H1 WAT 9602 145.791 103.710 56.428 1.00 0.00 H ATOM 88087 H2 WAT 9602 145.465 104.587 57.618 1.00 0.00 H TER 88089 WAT 9602 ATOM 88089 O WAT 9603 15.670 55.660 92.590 1.00 0.00 O ATOM 88090 H1 WAT 9603 16.306 54.958 92.452 1.00 0.00 H ATOM 88091 H2 WAT 9603 14.899 55.218 92.946 1.00 0.00 H TER 88093 WAT 9603 ATOM 88093 O WAT 9604 36.696 54.323 0.836 1.00 0.00 O ATOM 88094 H1 WAT 9604 37.311 53.873 0.257 1.00 0.00 H ATOM 88095 H2 WAT 9604 35.962 53.715 0.924 1.00 0.00 H TER 88097 WAT 9604 ATOM 88097 O WAT 9605 24.898 88.651 59.582 1.00 0.00 O ATOM 88098 H1 WAT 9605 25.686 88.177 59.316 1.00 0.00 H ATOM 88099 H2 WAT 9605 24.200 88.275 59.045 1.00 0.00 H TER 88101 WAT 9605 ATOM 88101 O WAT 9606 39.457 71.996 152.426 1.00 0.00 O ATOM 88102 H1 WAT 9606 39.186 72.283 153.298 1.00 0.00 H ATOM 88103 H2 WAT 9606 38.939 72.531 151.826 1.00 0.00 H TER 88105 WAT 9606 ATOM 88105 O WAT 9607 70.346 135.373 111.446 1.00 0.00 O ATOM 88106 H1 WAT 9607 70.491 135.517 110.511 1.00 0.00 H ATOM 88107 H2 WAT 9607 69.695 134.672 111.482 1.00 0.00 H TER 88109 WAT 9607 ATOM 88109 O WAT 9608 79.473 103.469 116.244 1.00 0.00 O ATOM 88110 H1 WAT 9608 80.192 102.965 115.862 1.00 0.00 H ATOM 88111 H2 WAT 9608 79.859 104.320 116.448 1.00 0.00 H TER 88113 WAT 9608 ATOM 88113 O WAT 9609 2.478 32.237 130.210 1.00 0.00 O ATOM 88114 H1 WAT 9609 2.455 31.297 130.389 1.00 0.00 H ATOM 88115 H2 WAT 9609 1.903 32.350 129.453 1.00 0.00 H TER 88117 WAT 9609 ATOM 88117 O WAT 9610 96.447 37.019 22.455 1.00 0.00 O ATOM 88118 H1 WAT 9610 96.353 37.966 22.556 1.00 0.00 H ATOM 88119 H2 WAT 9610 95.564 36.675 22.593 1.00 0.00 H TER 88121 WAT 9610 ATOM 88121 O WAT 9611 92.087 18.859 103.599 1.00 0.00 O ATOM 88122 H1 WAT 9611 92.000 19.422 104.369 1.00 0.00 H ATOM 88123 H2 WAT 9611 92.120 19.467 102.861 1.00 0.00 H TER 88125 WAT 9611 ATOM 88125 O WAT 9612 93.140 112.782 152.056 1.00 0.00 O ATOM 88126 H1 WAT 9612 92.691 113.016 151.244 1.00 0.00 H ATOM 88127 H2 WAT 9612 92.434 112.556 152.663 1.00 0.00 H TER 88129 WAT 9612 ATOM 88129 O WAT 9613 93.009 95.194 144.406 1.00 0.00 O ATOM 88130 H1 WAT 9613 93.639 95.170 145.125 1.00 0.00 H ATOM 88131 H2 WAT 9613 93.333 94.546 143.781 1.00 0.00 H TER 88133 WAT 9613 ATOM 88133 O WAT 9614 20.615 13.223 79.237 1.00 0.00 O ATOM 88134 H1 WAT 9614 19.993 13.135 79.958 1.00 0.00 H ATOM 88135 H2 WAT 9614 21.336 12.637 79.469 1.00 0.00 H TER 88137 WAT 9614 ATOM 88137 O WAT 9615 19.799 135.786 127.494 1.00 0.00 O ATOM 88138 H1 WAT 9615 19.820 136.479 126.834 1.00 0.00 H ATOM 88139 H2 WAT 9615 18.940 135.378 127.387 1.00 0.00 H TER 88141 WAT 9615 ATOM 88141 O WAT 9616 91.926 35.127 86.464 1.00 0.00 O ATOM 88142 H1 WAT 9616 91.384 35.798 86.880 1.00 0.00 H ATOM 88143 H2 WAT 9616 91.718 35.195 85.532 1.00 0.00 H TER 88145 WAT 9616 ATOM 88145 O WAT 9617 96.549 9.147 120.648 1.00 0.00 O ATOM 88146 H1 WAT 9617 96.371 8.815 119.768 1.00 0.00 H ATOM 88147 H2 WAT 9617 96.131 10.008 120.668 1.00 0.00 H TER 88149 WAT 9617 ATOM 88149 O WAT 9618 6.023 103.035 126.505 1.00 0.00 O ATOM 88150 H1 WAT 9618 6.152 103.620 127.252 1.00 0.00 H ATOM 88151 H2 WAT 9618 6.133 102.156 126.867 1.00 0.00 H TER 88153 WAT 9618 ATOM 88153 O WAT 9619 106.301 104.280 2.878 1.00 0.00 O ATOM 88154 H1 WAT 9619 107.201 104.601 2.934 1.00 0.00 H ATOM 88155 H2 WAT 9619 106.310 103.456 3.365 1.00 0.00 H TER 88157 WAT 9619 ATOM 88157 O WAT 9620 115.486 72.124 113.460 1.00 0.00 O ATOM 88158 H1 WAT 9620 115.363 71.350 114.010 1.00 0.00 H ATOM 88159 H2 WAT 9620 114.746 72.107 112.853 1.00 0.00 H TER 88161 WAT 9620 ATOM 88161 O WAT 9621 109.834 115.229 121.739 1.00 0.00 O ATOM 88162 H1 WAT 9621 109.070 114.675 121.897 1.00 0.00 H ATOM 88163 H2 WAT 9621 109.572 116.094 122.055 1.00 0.00 H TER 88165 WAT 9621 ATOM 88165 O WAT 9622 17.184 79.333 65.007 1.00 0.00 O ATOM 88166 H1 WAT 9622 17.596 78.693 65.588 1.00 0.00 H ATOM 88167 H2 WAT 9622 17.544 80.176 65.285 1.00 0.00 H TER 88169 WAT 9622 ATOM 88169 O WAT 9623 56.945 11.025 150.413 1.00 0.00 O ATOM 88170 H1 WAT 9623 56.296 11.722 150.506 1.00 0.00 H ATOM 88171 H2 WAT 9623 57.671 11.435 149.942 1.00 0.00 H TER 88173 WAT 9623 ATOM 88173 O WAT 9624 81.247 128.868 137.902 1.00 0.00 O ATOM 88174 H1 WAT 9624 80.523 128.243 137.860 1.00 0.00 H ATOM 88175 H2 WAT 9624 81.816 128.625 137.172 1.00 0.00 H TER 88177 WAT 9624 ATOM 88177 O WAT 9625 100.175 145.938 117.255 1.00 0.00 O ATOM 88178 H1 WAT 9625 99.957 145.071 116.914 1.00 0.00 H ATOM 88179 H2 WAT 9625 101.123 146.010 117.140 1.00 0.00 H TER 88181 WAT 9625 ATOM 88181 O WAT 9626 87.416 71.808 89.435 1.00 0.00 O ATOM 88182 H1 WAT 9626 87.248 72.143 90.316 1.00 0.00 H ATOM 88183 H2 WAT 9626 86.573 71.879 88.988 1.00 0.00 H TER 88185 WAT 9626 ATOM 88185 O WAT 9627 64.148 35.994 147.679 1.00 0.00 O ATOM 88186 H1 WAT 9627 63.225 36.137 147.470 1.00 0.00 H ATOM 88187 H2 WAT 9627 64.623 36.359 146.932 1.00 0.00 H TER 88189 WAT 9627 ATOM 88189 O WAT 9628 6.297 24.945 54.671 1.00 0.00 O ATOM 88190 H1 WAT 9628 5.425 24.702 54.982 1.00 0.00 H ATOM 88191 H2 WAT 9628 6.752 24.111 54.557 1.00 0.00 H TER 88193 WAT 9628 ATOM 88193 O WAT 9629 141.303 30.594 76.724 1.00 0.00 O ATOM 88194 H1 WAT 9629 140.396 30.590 77.029 1.00 0.00 H ATOM 88195 H2 WAT 9629 141.300 31.185 75.971 1.00 0.00 H TER 88197 WAT 9629 ATOM 88197 O WAT 9630 9.478 97.016 155.955 1.00 0.00 O ATOM 88198 H1 WAT 9630 9.536 97.180 155.014 1.00 0.00 H ATOM 88199 H2 WAT 9630 8.542 97.065 156.150 1.00 0.00 H TER 88201 WAT 9630 ATOM 88201 O WAT 9631 82.655 92.313 122.050 1.00 0.00 O ATOM 88202 H1 WAT 9631 82.711 92.535 121.120 1.00 0.00 H ATOM 88203 H2 WAT 9631 83.439 91.791 122.220 1.00 0.00 H TER 88205 WAT 9631 ATOM 88205 O WAT 9632 32.089 42.354 76.649 1.00 0.00 O ATOM 88206 H1 WAT 9632 32.865 41.963 77.050 1.00 0.00 H ATOM 88207 H2 WAT 9632 32.101 42.038 75.745 1.00 0.00 H TER 88209 WAT 9632 ATOM 88209 O WAT 9633 116.386 67.166 70.864 1.00 0.00 O ATOM 88210 H1 WAT 9633 117.207 66.945 71.305 1.00 0.00 H ATOM 88211 H2 WAT 9633 115.883 66.351 70.873 1.00 0.00 H TER 88213 WAT 9633 ATOM 88213 O WAT 9634 51.269 130.687 138.484 1.00 0.00 O ATOM 88214 H1 WAT 9634 50.839 130.858 139.322 1.00 0.00 H ATOM 88215 H2 WAT 9634 51.992 130.100 138.701 1.00 0.00 H TER 88217 WAT 9634 ATOM 88217 O WAT 9635 9.437 102.076 78.993 1.00 0.00 O ATOM 88218 H1 WAT 9635 9.584 102.408 78.107 1.00 0.00 H ATOM 88219 H2 WAT 9635 8.959 102.778 79.435 1.00 0.00 H TER 88221 WAT 9635 ATOM 88221 O WAT 9636 79.218 33.883 6.660 1.00 0.00 O ATOM 88222 H1 WAT 9636 79.030 34.339 7.480 1.00 0.00 H ATOM 88223 H2 WAT 9636 78.833 33.014 6.776 1.00 0.00 H TER 88225 WAT 9636 ATOM 88225 O WAT 9637 16.643 10.982 59.236 1.00 0.00 O ATOM 88226 H1 WAT 9637 17.213 10.811 58.487 1.00 0.00 H ATOM 88227 H2 WAT 9637 17.042 11.733 59.674 1.00 0.00 H TER 88229 WAT 9637 ATOM 88229 O WAT 9638 63.529 7.398 68.408 1.00 0.00 O ATOM 88230 H1 WAT 9638 62.781 7.445 69.005 1.00 0.00 H ATOM 88231 H2 WAT 9638 63.180 6.981 67.620 1.00 0.00 H TER 88233 WAT 9638 ATOM 88233 O WAT 9639 23.871 33.089 16.443 1.00 0.00 O ATOM 88234 H1 WAT 9639 24.188 32.208 16.641 1.00 0.00 H ATOM 88235 H2 WAT 9639 23.820 33.116 15.487 1.00 0.00 H TER 88237 WAT 9639 ATOM 88237 O WAT 9640 46.477 135.887 153.001 1.00 0.00 O ATOM 88238 H1 WAT 9640 46.136 135.766 152.114 1.00 0.00 H ATOM 88239 H2 WAT 9640 46.902 136.744 152.979 1.00 0.00 H TER 88241 WAT 9640 ATOM 88241 O WAT 9641 33.694 43.517 3.828 1.00 0.00 O ATOM 88242 H1 WAT 9641 34.418 42.929 4.045 1.00 0.00 H ATOM 88243 H2 WAT 9641 34.117 44.349 3.615 1.00 0.00 H TER 88245 WAT 9641 ATOM 88245 O WAT 9642 27.368 36.646 105.789 1.00 0.00 O ATOM 88246 H1 WAT 9642 27.108 37.317 105.158 1.00 0.00 H ATOM 88247 H2 WAT 9642 26.998 36.941 106.621 1.00 0.00 H TER 88249 WAT 9642 ATOM 88249 O WAT 9643 113.308 86.987 58.873 1.00 0.00 O ATOM 88250 H1 WAT 9643 112.490 86.686 59.269 1.00 0.00 H ATOM 88251 H2 WAT 9643 113.242 86.720 57.956 1.00 0.00 H TER 88253 WAT 9643 ATOM 88253 O WAT 9644 144.950 122.381 117.021 1.00 0.00 O ATOM 88254 H1 WAT 9644 144.517 123.179 116.719 1.00 0.00 H ATOM 88255 H2 WAT 9644 145.327 121.998 116.229 1.00 0.00 H TER 88257 WAT 9644 ATOM 88257 O WAT 9645 86.636 27.996 75.602 1.00 0.00 O ATOM 88258 H1 WAT 9645 87.565 27.867 75.409 1.00 0.00 H ATOM 88259 H2 WAT 9645 86.188 27.771 74.787 1.00 0.00 H TER 88261 WAT 9645 ATOM 88261 O WAT 9646 73.669 128.692 136.493 1.00 0.00 O ATOM 88262 H1 WAT 9646 74.574 129.003 136.479 1.00 0.00 H ATOM 88263 H2 WAT 9646 73.503 128.481 137.411 1.00 0.00 H TER 88265 WAT 9646 ATOM 88265 O WAT 9647 84.606 36.157 101.304 1.00 0.00 O ATOM 88266 H1 WAT 9647 85.071 35.373 101.599 1.00 0.00 H ATOM 88267 H2 WAT 9647 83.824 36.193 101.855 1.00 0.00 H TER 88269 WAT 9647 ATOM 88269 O WAT 9648 123.767 15.827 18.144 1.00 0.00 O ATOM 88270 H1 WAT 9648 124.111 15.409 18.934 1.00 0.00 H ATOM 88271 H2 WAT 9648 124.006 16.749 18.238 1.00 0.00 H TER 88273 WAT 9648 ATOM 88273 O WAT 9649 92.399 50.831 105.175 1.00 0.00 O ATOM 88274 H1 WAT 9649 91.583 50.767 105.671 1.00 0.00 H ATOM 88275 H2 WAT 9649 92.695 51.730 105.315 1.00 0.00 H TER 88277 WAT 9649 ATOM 88277 O WAT 9650 106.070 58.025 89.990 1.00 0.00 O ATOM 88278 H1 WAT 9650 106.556 58.550 90.627 1.00 0.00 H ATOM 88279 H2 WAT 9650 106.036 58.572 89.205 1.00 0.00 H TER 88281 WAT 9650 ATOM 88281 O WAT 9651 83.777 48.140 67.715 1.00 0.00 O ATOM 88282 H1 WAT 9651 84.014 47.641 68.497 1.00 0.00 H ATOM 88283 H2 WAT 9651 83.652 47.477 67.037 1.00 0.00 H TER 88285 WAT 9651 ATOM 88285 O WAT 9652 89.730 133.118 127.338 1.00 0.00 O ATOM 88286 H1 WAT 9652 89.794 133.251 128.283 1.00 0.00 H ATOM 88287 H2 WAT 9652 88.791 133.130 127.157 1.00 0.00 H TER 88289 WAT 9652 ATOM 88289 O WAT 9653 87.917 48.133 89.570 1.00 0.00 O ATOM 88290 H1 WAT 9653 87.799 49.083 89.576 1.00 0.00 H ATOM 88291 H2 WAT 9653 88.866 48.009 89.602 1.00 0.00 H TER 88293 WAT 9653 ATOM 88293 O WAT 9654 76.163 100.433 126.339 1.00 0.00 O ATOM 88294 H1 WAT 9654 76.349 99.779 127.012 1.00 0.00 H ATOM 88295 H2 WAT 9654 76.561 101.238 126.669 1.00 0.00 H TER 88297 WAT 9654 ATOM 88297 O WAT 9655 45.313 137.644 109.447 1.00 0.00 O ATOM 88298 H1 WAT 9655 45.370 137.193 108.605 1.00 0.00 H ATOM 88299 H2 WAT 9655 45.524 136.971 110.094 1.00 0.00 H TER 88301 WAT 9655 ATOM 88301 O WAT 9656 55.178 42.266 58.286 1.00 0.00 O ATOM 88302 H1 WAT 9656 55.098 42.750 59.108 1.00 0.00 H ATOM 88303 H2 WAT 9656 54.465 42.599 57.741 1.00 0.00 H TER 88305 WAT 9656 ATOM 88305 O WAT 9657 104.139 124.814 114.567 1.00 0.00 O ATOM 88306 H1 WAT 9657 103.868 125.429 115.249 1.00 0.00 H ATOM 88307 H2 WAT 9657 103.695 123.996 114.792 1.00 0.00 H TER 88309 WAT 9657 ATOM 88309 O WAT 9658 34.930 28.139 104.905 1.00 0.00 O ATOM 88310 H1 WAT 9658 35.543 27.833 105.573 1.00 0.00 H ATOM 88311 H2 WAT 9658 34.384 28.782 105.357 1.00 0.00 H TER 88313 WAT 9658 ATOM 88313 O WAT 9659 68.659 15.452 92.129 1.00 0.00 O ATOM 88314 H1 WAT 9659 68.201 16.290 92.186 1.00 0.00 H ATOM 88315 H2 WAT 9659 68.489 15.146 91.238 1.00 0.00 H TER 88317 WAT 9659 ATOM 88317 O WAT 9660 25.801 44.792 112.088 1.00 0.00 O ATOM 88318 H1 WAT 9660 26.105 45.380 111.398 1.00 0.00 H ATOM 88319 H2 WAT 9660 26.212 45.126 112.886 1.00 0.00 H TER 88321 WAT 9660 ATOM 88321 O WAT 9661 20.019 134.442 124.246 1.00 0.00 O ATOM 88322 H1 WAT 9661 20.652 134.081 124.867 1.00 0.00 H ATOM 88323 H2 WAT 9661 19.973 135.373 124.464 1.00 0.00 H TER 88325 WAT 9661 ATOM 88325 O WAT 9662 75.625 61.075 71.177 1.00 0.00 O ATOM 88326 H1 WAT 9662 75.587 61.494 70.318 1.00 0.00 H ATOM 88327 H2 WAT 9662 75.817 60.157 70.987 1.00 0.00 H TER 88329 WAT 9662 ATOM 88329 O WAT 9663 47.637 117.567 61.713 1.00 0.00 O ATOM 88330 H1 WAT 9663 47.504 116.843 61.100 1.00 0.00 H ATOM 88331 H2 WAT 9663 46.773 117.720 62.095 1.00 0.00 H TER 88333 WAT 9663 ATOM 88333 O WAT 9664 52.391 12.667 2.266 1.00 0.00 O ATOM 88334 H1 WAT 9664 52.754 12.552 3.144 1.00 0.00 H ATOM 88335 H2 WAT 9664 52.118 13.584 2.237 1.00 0.00 H TER 88337 WAT 9664 ATOM 88337 O WAT 9665 91.364 10.626 121.708 1.00 0.00 O ATOM 88338 H1 WAT 9665 90.541 11.009 122.010 1.00 0.00 H ATOM 88339 H2 WAT 9665 91.416 9.783 122.159 1.00 0.00 H TER 88341 WAT 9665 ATOM 88341 O WAT 9666 24.961 48.210 66.086 1.00 0.00 O ATOM 88342 H1 WAT 9666 25.504 48.420 66.846 1.00 0.00 H ATOM 88343 H2 WAT 9666 24.437 47.460 66.367 1.00 0.00 H TER 88345 WAT 9666 ATOM 88345 O WAT 9667 34.968 128.052 66.042 1.00 0.00 O ATOM 88346 H1 WAT 9667 35.335 128.433 65.244 1.00 0.00 H ATOM 88347 H2 WAT 9667 34.027 128.005 65.875 1.00 0.00 H TER 88349 WAT 9667 ATOM 88349 O WAT 9668 75.065 75.977 9.558 1.00 0.00 O ATOM 88350 H1 WAT 9668 75.271 75.540 10.384 1.00 0.00 H ATOM 88351 H2 WAT 9668 74.113 76.081 9.573 1.00 0.00 H TER 88353 WAT 9668 ATOM 88353 O WAT 9669 39.867 38.030 130.716 1.00 0.00 O ATOM 88354 H1 WAT 9669 39.611 38.541 129.948 1.00 0.00 H ATOM 88355 H2 WAT 9669 39.039 37.756 131.109 1.00 0.00 H TER 88357 WAT 9669 ATOM 88357 O WAT 9670 92.670 121.257 67.679 1.00 0.00 O ATOM 88358 H1 WAT 9670 93.292 121.903 67.344 1.00 0.00 H ATOM 88359 H2 WAT 9670 93.115 120.860 68.427 1.00 0.00 H TER 88361 WAT 9670 ATOM 88361 O WAT 9671 99.269 56.511 15.606 1.00 0.00 O ATOM 88362 H1 WAT 9671 98.702 56.896 16.274 1.00 0.00 H ATOM 88363 H2 WAT 9671 99.280 57.158 14.900 1.00 0.00 H TER 88365 WAT 9671 ATOM 88365 O WAT 9672 70.451 135.764 58.023 1.00 0.00 O ATOM 88366 H1 WAT 9672 70.768 136.287 57.286 1.00 0.00 H ATOM 88367 H2 WAT 9672 70.780 134.882 57.849 1.00 0.00 H TER 88369 WAT 9672 ATOM 88369 O WAT 9673 105.159 2.056 138.965 1.00 0.00 O ATOM 88370 H1 WAT 9673 104.624 2.777 138.633 1.00 0.00 H ATOM 88371 H2 WAT 9673 104.945 1.317 138.395 1.00 0.00 H TER 88373 WAT 9673 ATOM 88373 O WAT 9674 82.596 105.125 81.775 1.00 0.00 O ATOM 88374 H1 WAT 9674 83.280 104.688 82.282 1.00 0.00 H ATOM 88375 H2 WAT 9674 82.938 105.149 80.881 1.00 0.00 H TER 88377 WAT 9674 ATOM 88377 O WAT 9675 141.853 63.206 14.786 1.00 0.00 O ATOM 88378 H1 WAT 9675 141.962 62.484 15.405 1.00 0.00 H ATOM 88379 H2 WAT 9675 141.011 63.596 15.019 1.00 0.00 H TER 88381 WAT 9675 ATOM 88381 O WAT 9676 84.079 139.771 0.616 1.00 0.00 O ATOM 88382 H1 WAT 9676 84.134 140.066 -0.293 1.00 0.00 H ATOM 88383 H2 WAT 9676 84.581 138.956 0.633 1.00 0.00 H TER 88385 WAT 9676 ATOM 88385 O WAT 9677 14.917 40.308 62.033 1.00 0.00 O ATOM 88386 H1 WAT 9677 14.208 40.709 61.529 1.00 0.00 H ATOM 88387 H2 WAT 9677 14.763 39.367 61.955 1.00 0.00 H TER 88389 WAT 9677 ATOM 88389 O WAT 9678 65.421 72.137 11.955 1.00 0.00 O ATOM 88390 H1 WAT 9678 66.242 71.949 12.410 1.00 0.00 H ATOM 88391 H2 WAT 9678 64.903 71.339 12.056 1.00 0.00 H TER 88393 WAT 9678 ATOM 88393 O WAT 9679 103.498 114.369 116.106 1.00 0.00 O ATOM 88394 H1 WAT 9679 103.891 115.240 116.162 1.00 0.00 H ATOM 88395 H2 WAT 9679 104.148 113.787 116.498 1.00 0.00 H TER 88397 WAT 9679 ATOM 88397 O WAT 9680 24.771 62.175 0.466 1.00 0.00 O ATOM 88398 H1 WAT 9680 24.579 61.478 1.093 1.00 0.00 H ATOM 88399 H2 WAT 9680 25.350 61.765 -0.177 1.00 0.00 H TER 88401 WAT 9680 ATOM 88401 O WAT 9681 71.868 90.964 131.536 1.00 0.00 O ATOM 88402 H1 WAT 9681 71.489 91.667 131.008 1.00 0.00 H ATOM 88403 H2 WAT 9681 72.056 91.373 132.381 1.00 0.00 H TER 88405 WAT 9681 ATOM 88405 O WAT 9682 50.250 3.244 19.500 1.00 0.00 O ATOM 88406 H1 WAT 9682 50.999 3.834 19.416 1.00 0.00 H ATOM 88407 H2 WAT 9682 50.636 2.368 19.516 1.00 0.00 H TER 88409 WAT 9682 ATOM 88409 O WAT 9683 134.017 3.362 79.343 1.00 0.00 O ATOM 88410 H1 WAT 9683 134.377 4.219 79.569 1.00 0.00 H ATOM 88411 H2 WAT 9683 134.193 2.818 80.110 1.00 0.00 H TER 88413 WAT 9683 ATOM 88413 O WAT 9684 24.945 35.957 157.470 1.00 0.00 O ATOM 88414 H1 WAT 9684 25.049 36.047 158.418 1.00 0.00 H ATOM 88415 H2 WAT 9684 24.871 35.013 157.326 1.00 0.00 H TER 88417 WAT 9684 ATOM 88417 O WAT 9685 79.806 132.144 102.793 1.00 0.00 O ATOM 88418 H1 WAT 9685 79.238 131.530 103.260 1.00 0.00 H ATOM 88419 H2 WAT 9685 80.097 131.661 102.020 1.00 0.00 H TER 88421 WAT 9685 ATOM 88421 O WAT 9686 106.781 99.389 61.196 1.00 0.00 O ATOM 88422 H1 WAT 9686 105.888 99.202 61.487 1.00 0.00 H ATOM 88423 H2 WAT 9686 107.306 98.677 61.560 1.00 0.00 H TER 88425 WAT 9686 ATOM 88425 O WAT 9687 99.540 14.297 148.370 1.00 0.00 O ATOM 88426 H1 WAT 9687 100.447 14.604 148.353 1.00 0.00 H ATOM 88427 H2 WAT 9687 99.246 14.372 147.462 1.00 0.00 H TER 88429 WAT 9687 ATOM 88429 O WAT 9688 38.642 27.891 116.942 1.00 0.00 O ATOM 88430 H1 WAT 9688 38.337 27.043 117.263 1.00 0.00 H ATOM 88431 H2 WAT 9688 39.462 27.695 116.489 1.00 0.00 H TER 88433 WAT 9688 ATOM 88433 O WAT 9689 62.508 127.749 150.108 1.00 0.00 O ATOM 88434 H1 WAT 9689 62.561 126.794 150.143 1.00 0.00 H ATOM 88435 H2 WAT 9689 62.932 127.982 149.282 1.00 0.00 H TER 88437 WAT 9689 ATOM 88437 O WAT 9690 75.891 141.659 125.781 1.00 0.00 O ATOM 88438 H1 WAT 9690 75.498 142.474 125.470 1.00 0.00 H ATOM 88439 H2 WAT 9690 76.148 141.845 126.684 1.00 0.00 H TER 88441 WAT 9690 ATOM 88441 O WAT 9691 102.468 42.077 118.717 1.00 0.00 O ATOM 88442 H1 WAT 9691 103.137 41.393 118.713 1.00 0.00 H ATOM 88443 H2 WAT 9691 102.951 42.885 118.893 1.00 0.00 H TER 88445 WAT 9691 ATOM 88445 O WAT 9692 107.708 58.931 116.166 1.00 0.00 O ATOM 88446 H1 WAT 9692 108.308 58.967 116.910 1.00 0.00 H ATOM 88447 H2 WAT 9692 108.055 58.232 115.611 1.00 0.00 H TER 88449 WAT 9692 ATOM 88449 O WAT 9693 52.331 88.573 151.761 1.00 0.00 O ATOM 88450 H1 WAT 9693 52.833 88.364 152.549 1.00 0.00 H ATOM 88451 H2 WAT 9693 52.705 89.397 151.450 1.00 0.00 H TER 88453 WAT 9693 ATOM 88453 O WAT 9694 111.422 96.324 113.819 1.00 0.00 O ATOM 88454 H1 WAT 9694 111.821 96.368 114.688 1.00 0.00 H ATOM 88455 H2 WAT 9694 111.611 95.436 113.514 1.00 0.00 H TER 88457 WAT 9694 ATOM 88457 O WAT 9695 90.656 127.729 157.593 1.00 0.00 O ATOM 88458 H1 WAT 9695 90.520 128.295 158.352 1.00 0.00 H ATOM 88459 H2 WAT 9695 89.773 127.547 157.269 1.00 0.00 H TER 88461 WAT 9695 ATOM 88461 O WAT 9696 78.729 45.498 19.129 1.00 0.00 O ATOM 88462 H1 WAT 9696 79.275 46.282 19.066 1.00 0.00 H ATOM 88463 H2 WAT 9696 78.663 45.179 18.229 1.00 0.00 H TER 88465 WAT 9696 ATOM 88465 O WAT 9697 9.438 78.501 68.620 1.00 0.00 O ATOM 88466 H1 WAT 9697 8.507 78.715 68.671 1.00 0.00 H ATOM 88467 H2 WAT 9697 9.480 77.750 68.029 1.00 0.00 H TER 88469 WAT 9697 ATOM 88469 O WAT 9698 132.420 38.253 16.862 1.00 0.00 O ATOM 88470 H1 WAT 9698 133.355 38.095 16.986 1.00 0.00 H ATOM 88471 H2 WAT 9698 132.274 39.126 17.224 1.00 0.00 H TER 88473 WAT 9698 ATOM 88473 O WAT 9699 141.169 44.428 148.409 1.00 0.00 O ATOM 88474 H1 WAT 9699 141.447 44.955 149.158 1.00 0.00 H ATOM 88475 H2 WAT 9699 140.380 43.979 148.712 1.00 0.00 H TER 88477 WAT 9699 ATOM 88477 O WAT 9700 141.625 127.583 99.253 1.00 0.00 O ATOM 88478 H1 WAT 9700 141.874 128.370 99.738 1.00 0.00 H ATOM 88479 H2 WAT 9700 141.892 126.859 99.818 1.00 0.00 H TER 88481 WAT 9700 ATOM 88481 O WAT 9701 8.427 42.562 78.114 1.00 0.00 O ATOM 88482 H1 WAT 9701 8.939 43.252 77.692 1.00 0.00 H ATOM 88483 H2 WAT 9701 7.989 42.113 77.392 1.00 0.00 H TER 88485 WAT 9701 ATOM 88485 O WAT 9702 56.218 96.058 10.100 1.00 0.00 O ATOM 88486 H1 WAT 9702 56.449 96.851 10.585 1.00 0.00 H ATOM 88487 H2 WAT 9702 55.771 95.507 10.742 1.00 0.00 H TER 88489 WAT 9702 ATOM 88489 O WAT 9703 58.276 64.567 148.497 1.00 0.00 O ATOM 88490 H1 WAT 9703 58.404 64.178 147.631 1.00 0.00 H ATOM 88491 H2 WAT 9703 57.350 64.810 148.516 1.00 0.00 H TER 88493 WAT 9703 ATOM 88493 O WAT 9704 47.174 59.446 50.568 1.00 0.00 O ATOM 88494 H1 WAT 9704 46.253 59.202 50.480 1.00 0.00 H ATOM 88495 H2 WAT 9704 47.610 58.641 50.848 1.00 0.00 H TER 88497 WAT 9704 ATOM 88497 O WAT 9705 50.589 76.627 63.725 1.00 0.00 O ATOM 88498 H1 WAT 9705 49.947 77.269 63.421 1.00 0.00 H ATOM 88499 H2 WAT 9705 51.416 76.913 63.336 1.00 0.00 H TER 88501 WAT 9705 ATOM 88501 O WAT 9706 57.677 49.525 107.978 1.00 0.00 O ATOM 88502 H1 WAT 9706 57.608 48.630 108.309 1.00 0.00 H ATOM 88503 H2 WAT 9706 56.776 49.846 107.963 1.00 0.00 H TER 88505 WAT 9706 ATOM 88505 O WAT 9707 84.567 2.189 132.586 1.00 0.00 O ATOM 88506 H1 WAT 9707 83.686 1.924 132.321 1.00 0.00 H ATOM 88507 H2 WAT 9707 84.835 1.526 133.223 1.00 0.00 H TER 88509 WAT 9707 ATOM 88509 O WAT 9708 140.381 114.626 111.130 1.00 0.00 O ATOM 88510 H1 WAT 9708 140.744 114.796 110.261 1.00 0.00 H ATOM 88511 H2 WAT 9708 140.254 113.678 111.155 1.00 0.00 H TER 88513 WAT 9708 ATOM 88513 O WAT 9709 98.891 3.009 103.806 1.00 0.00 O ATOM 88514 H1 WAT 9709 99.586 2.592 103.297 1.00 0.00 H ATOM 88515 H2 WAT 9709 98.280 3.342 103.149 1.00 0.00 H TER 88517 WAT 9709 ATOM 88517 O WAT 9710 70.817 18.192 18.791 1.00 0.00 O ATOM 88518 H1 WAT 9710 71.550 17.576 18.768 1.00 0.00 H ATOM 88519 H2 WAT 9710 70.672 18.425 17.874 1.00 0.00 H TER 88521 WAT 9710 ATOM 88521 O WAT 9711 0.566 96.578 103.983 1.00 0.00 O ATOM 88522 H1 WAT 9711 0.388 95.684 103.691 1.00 0.00 H ATOM 88523 H2 WAT 9711 1.248 96.892 103.390 1.00 0.00 H TER 88525 WAT 9711 ATOM 88525 O WAT 9712 53.531 19.261 133.944 1.00 0.00 O ATOM 88526 H1 WAT 9712 53.018 18.567 133.531 1.00 0.00 H ATOM 88527 H2 WAT 9712 53.959 18.833 134.685 1.00 0.00 H TER 88529 WAT 9712 ATOM 88529 O WAT 9713 39.082 125.202 76.463 1.00 0.00 O ATOM 88530 H1 WAT 9713 39.764 124.571 76.232 1.00 0.00 H ATOM 88531 H2 WAT 9713 38.875 125.008 77.377 1.00 0.00 H TER 88533 WAT 9713 ATOM 88533 O WAT 9714 117.655 71.978 158.767 1.00 0.00 O ATOM 88534 H1 WAT 9714 118.475 71.524 158.573 1.00 0.00 H ATOM 88535 H2 WAT 9714 116.996 71.284 158.793 1.00 0.00 H TER 88537 WAT 9714 ATOM 88537 O WAT 9715 100.302 134.024 125.507 1.00 0.00 O ATOM 88538 H1 WAT 9715 99.689 134.736 125.687 1.00 0.00 H ATOM 88539 H2 WAT 9715 100.513 134.119 124.578 1.00 0.00 H TER 88541 WAT 9715 ATOM 88541 O WAT 9716 42.733 35.825 87.934 1.00 0.00 O ATOM 88542 H1 WAT 9716 42.380 36.617 87.528 1.00 0.00 H ATOM 88543 H2 WAT 9716 43.412 35.527 87.329 1.00 0.00 H TER 88545 WAT 9716 ATOM 88545 O WAT 9717 135.992 105.549 64.192 1.00 0.00 O ATOM 88546 H1 WAT 9717 136.410 106.410 64.195 1.00 0.00 H ATOM 88547 H2 WAT 9717 135.962 105.301 63.268 1.00 0.00 H TER 88549 WAT 9717 ATOM 88549 O WAT 9718 100.103 142.495 72.874 1.00 0.00 O ATOM 88550 H1 WAT 9718 100.627 142.355 73.663 1.00 0.00 H ATOM 88551 H2 WAT 9718 100.732 142.432 72.155 1.00 0.00 H TER 88553 WAT 9718 ATOM 88553 O WAT 9719 131.553 114.677 151.959 1.00 0.00 O ATOM 88554 H1 WAT 9719 131.894 113.806 152.165 1.00 0.00 H ATOM 88555 H2 WAT 9719 130.769 114.509 151.436 1.00 0.00 H TER 88557 WAT 9719 ATOM 88557 O WAT 9720 19.886 98.386 129.938 1.00 0.00 O ATOM 88558 H1 WAT 9720 20.775 98.691 130.117 1.00 0.00 H ATOM 88559 H2 WAT 9720 19.594 98.000 130.764 1.00 0.00 H TER 88561 WAT 9720 ATOM 88561 O WAT 9721 120.193 43.012 148.154 1.00 0.00 O ATOM 88562 H1 WAT 9721 121.132 42.870 148.277 1.00 0.00 H ATOM 88563 H2 WAT 9721 120.136 43.854 147.702 1.00 0.00 H TER 88565 WAT 9721 ATOM 88565 O WAT 9722 2.042 116.948 122.581 1.00 0.00 O ATOM 88566 H1 WAT 9722 1.460 116.307 122.171 1.00 0.00 H ATOM 88567 H2 WAT 9722 1.503 117.733 122.678 1.00 0.00 H TER 88569 WAT 9722 ATOM 88569 O WAT 9723 115.574 97.701 15.327 1.00 0.00 O ATOM 88570 H1 WAT 9723 116.430 98.030 15.055 1.00 0.00 H ATOM 88571 H2 WAT 9723 115.406 98.135 16.164 1.00 0.00 H TER 88573 WAT 9723 ATOM 88573 O WAT 9724 52.370 55.285 114.733 1.00 0.00 O ATOM 88574 H1 WAT 9724 52.054 55.648 115.560 1.00 0.00 H ATOM 88575 H2 WAT 9724 53.036 55.907 114.438 1.00 0.00 H TER 88577 WAT 9724 ATOM 88577 O WAT 9725 100.634 57.099 4.597 1.00 0.00 O ATOM 88578 H1 WAT 9725 99.755 56.899 4.918 1.00 0.00 H ATOM 88579 H2 WAT 9725 101.048 57.577 5.316 1.00 0.00 H TER 88581 WAT 9725 ATOM 88581 O WAT 9726 88.759 96.042 127.685 1.00 0.00 O ATOM 88582 H1 WAT 9726 88.076 95.384 127.555 1.00 0.00 H ATOM 88583 H2 WAT 9726 89.387 95.622 128.273 1.00 0.00 H TER 88585 WAT 9726 ATOM 88585 O WAT 9727 138.364 99.648 99.322 1.00 0.00 O ATOM 88586 H1 WAT 9727 137.727 100.291 99.013 1.00 0.00 H ATOM 88587 H2 WAT 9727 139.032 99.623 98.637 1.00 0.00 H TER 88589 WAT 9727 ATOM 88589 O WAT 9728 16.938 4.005 5.950 1.00 0.00 O ATOM 88590 H1 WAT 9728 17.744 4.415 5.638 1.00 0.00 H ATOM 88591 H2 WAT 9728 16.292 4.712 5.944 1.00 0.00 H TER 88593 WAT 9728 ATOM 88593 O WAT 9729 56.648 39.758 59.407 1.00 0.00 O ATOM 88594 H1 WAT 9729 55.968 39.308 59.908 1.00 0.00 H ATOM 88595 H2 WAT 9729 56.235 40.571 59.118 1.00 0.00 H TER 88597 WAT 9729 ATOM 88597 O WAT 9730 86.416 21.814 107.907 1.00 0.00 O ATOM 88598 H1 WAT 9730 86.754 21.535 108.759 1.00 0.00 H ATOM 88599 H2 WAT 9730 86.907 21.292 107.272 1.00 0.00 H TER 88601 WAT 9730 ATOM 88601 O WAT 9731 143.004 26.760 62.481 1.00 0.00 O ATOM 88602 H1 WAT 9731 142.903 25.820 62.631 1.00 0.00 H ATOM 88603 H2 WAT 9731 142.159 27.135 62.728 1.00 0.00 H TER 88605 WAT 9731 ATOM 88605 O WAT 9732 122.091 24.318 21.221 1.00 0.00 O ATOM 88606 H1 WAT 9732 122.844 24.573 21.754 1.00 0.00 H ATOM 88607 H2 WAT 9732 121.418 24.965 21.431 1.00 0.00 H TER 88609 WAT 9732 ATOM 88609 O WAT 9733 75.283 141.608 156.300 1.00 0.00 O ATOM 88610 H1 WAT 9733 75.659 141.591 157.180 1.00 0.00 H ATOM 88611 H2 WAT 9733 75.282 140.692 156.022 1.00 0.00 H TER 88613 WAT 9733 ATOM 88613 O WAT 9734 74.104 85.097 8.579 1.00 0.00 O ATOM 88614 H1 WAT 9734 75.033 84.915 8.719 1.00 0.00 H ATOM 88615 H2 WAT 9734 73.694 84.233 8.540 1.00 0.00 H TER 88617 WAT 9734 ATOM 88617 O WAT 9735 129.813 66.857 130.751 1.00 0.00 O ATOM 88618 H1 WAT 9735 130.319 66.249 130.212 1.00 0.00 H ATOM 88619 H2 WAT 9735 130.452 67.225 131.362 1.00 0.00 H TER 88621 WAT 9735 ATOM 88621 O WAT 9736 31.484 35.419 112.244 1.00 0.00 O ATOM 88622 H1 WAT 9736 31.800 36.322 112.216 1.00 0.00 H ATOM 88623 H2 WAT 9736 31.340 35.244 113.174 1.00 0.00 H TER 88625 WAT 9736 ATOM 88625 O WAT 9737 71.548 117.857 140.435 1.00 0.00 O ATOM 88626 H1 WAT 9737 71.256 117.562 141.298 1.00 0.00 H ATOM 88627 H2 WAT 9737 71.995 118.687 140.605 1.00 0.00 H TER 88629 WAT 9737 ATOM 88629 O WAT 9738 27.271 17.475 110.841 1.00 0.00 O ATOM 88630 H1 WAT 9738 26.763 18.251 111.078 1.00 0.00 H ATOM 88631 H2 WAT 9738 26.957 16.792 111.434 1.00 0.00 H TER 88633 WAT 9738 ATOM 88633 O WAT 9739 118.482 45.028 103.742 1.00 0.00 O ATOM 88634 H1 WAT 9739 118.353 44.771 102.829 1.00 0.00 H ATOM 88635 H2 WAT 9739 117.695 44.720 104.192 1.00 0.00 H TER 88637 WAT 9739 ATOM 88637 O WAT 9740 90.333 120.717 139.214 1.00 0.00 O ATOM 88638 H1 WAT 9740 90.846 119.910 139.258 1.00 0.00 H ATOM 88639 H2 WAT 9740 89.450 120.453 139.470 1.00 0.00 H TER 88641 WAT 9740 ATOM 88641 O WAT 9741 14.885 32.499 126.641 1.00 0.00 O ATOM 88642 H1 WAT 9741 15.390 33.304 126.524 1.00 0.00 H ATOM 88643 H2 WAT 9741 14.019 32.798 126.919 1.00 0.00 H TER 88645 WAT 9741 ATOM 88645 O WAT 9742 53.710 73.936 146.518 1.00 0.00 O ATOM 88646 H1 WAT 9742 54.200 73.609 147.273 1.00 0.00 H ATOM 88647 H2 WAT 9742 54.123 74.773 146.307 1.00 0.00 H TER 88649 WAT 9742 ATOM 88649 O WAT 9743 34.819 38.934 90.457 1.00 0.00 O ATOM 88650 H1 WAT 9743 35.528 39.296 90.989 1.00 0.00 H ATOM 88651 H2 WAT 9743 34.657 39.601 89.789 1.00 0.00 H TER 88653 WAT 9743 ATOM 88653 O WAT 9744 65.090 42.866 155.961 1.00 0.00 O ATOM 88654 H1 WAT 9744 65.451 42.509 155.149 1.00 0.00 H ATOM 88655 H2 WAT 9744 65.472 42.323 156.650 1.00 0.00 H TER 88657 WAT 9744 ATOM 88657 O WAT 9745 40.236 115.844 121.731 1.00 0.00 O ATOM 88658 H1 WAT 9745 40.235 116.194 122.621 1.00 0.00 H ATOM 88659 H2 WAT 9745 40.840 115.103 121.766 1.00 0.00 H TER 88661 WAT 9745 ATOM 88661 O WAT 9746 113.675 88.667 4.174 1.00 0.00 O ATOM 88662 H1 WAT 9746 112.743 88.539 4.347 1.00 0.00 H ATOM 88663 H2 WAT 9746 114.028 89.003 4.999 1.00 0.00 H TER 88665 WAT 9746 ATOM 88665 O WAT 9747 56.222 105.047 130.516 1.00 0.00 O ATOM 88666 H1 WAT 9747 55.736 105.528 131.186 1.00 0.00 H ATOM 88667 H2 WAT 9747 56.707 104.381 131.004 1.00 0.00 H TER 88669 WAT 9747 ATOM 88669 O WAT 9748 28.607 3.801 113.128 1.00 0.00 O ATOM 88670 H1 WAT 9748 28.684 4.745 112.993 1.00 0.00 H ATOM 88671 H2 WAT 9748 29.197 3.614 113.857 1.00 0.00 H TER 88673 WAT 9748 ATOM 88673 O WAT 9749 89.915 15.033 137.129 1.00 0.00 O ATOM 88674 H1 WAT 9749 90.275 15.854 137.465 1.00 0.00 H ATOM 88675 H2 WAT 9749 89.528 15.268 136.286 1.00 0.00 H TER 88677 WAT 9749 ATOM 88677 O WAT 9750 119.253 87.464 59.442 1.00 0.00 O ATOM 88678 H1 WAT 9750 119.034 87.503 60.373 1.00 0.00 H ATOM 88679 H2 WAT 9750 120.191 87.649 59.409 1.00 0.00 H TER 88681 WAT 9750 ATOM 88681 O WAT 9751 70.740 125.485 147.858 1.00 0.00 O ATOM 88682 H1 WAT 9751 70.382 125.048 147.086 1.00 0.00 H ATOM 88683 H2 WAT 9751 71.587 125.063 148.002 1.00 0.00 H TER 88685 WAT 9751 ATOM 88685 O WAT 9752 57.964 16.115 8.109 1.00 0.00 O ATOM 88686 H1 WAT 9752 57.848 15.808 9.008 1.00 0.00 H ATOM 88687 H2 WAT 9752 57.307 15.633 7.605 1.00 0.00 H TER 88689 WAT 9752 ATOM 88689 O WAT 9753 57.697 43.203 143.951 1.00 0.00 O ATOM 88690 H1 WAT 9753 58.459 42.645 144.112 1.00 0.00 H ATOM 88691 H2 WAT 9753 57.656 43.778 144.715 1.00 0.00 H TER 88693 WAT 9753 ATOM 88693 O WAT 9754 126.675 115.403 12.490 1.00 0.00 O ATOM 88694 H1 WAT 9754 126.079 115.952 11.981 1.00 0.00 H ATOM 88695 H2 WAT 9754 126.921 114.697 11.892 1.00 0.00 H TER 88697 WAT 9754 ATOM 88697 O WAT 9755 74.683 85.478 73.699 1.00 0.00 O ATOM 88698 H1 WAT 9755 74.762 85.972 72.883 1.00 0.00 H ATOM 88699 H2 WAT 9755 73.957 84.875 73.545 1.00 0.00 H TER 88701 WAT 9755 ATOM 88701 O WAT 9756 61.226 100.018 20.217 1.00 0.00 O ATOM 88702 H1 WAT 9756 62.011 99.837 20.733 1.00 0.00 H ATOM 88703 H2 WAT 9756 60.671 100.537 20.799 1.00 0.00 H TER 88705 WAT 9756 ATOM 88705 O WAT 9757 129.526 80.784 66.407 1.00 0.00 O ATOM 88706 H1 WAT 9757 128.899 80.485 67.066 1.00 0.00 H ATOM 88707 H2 WAT 9757 129.123 81.566 66.030 1.00 0.00 H TER 88709 WAT 9757 ATOM 88709 O WAT 9758 136.953 8.162 143.864 1.00 0.00 O ATOM 88710 H1 WAT 9758 136.777 8.846 143.219 1.00 0.00 H ATOM 88711 H2 WAT 9758 137.012 7.357 143.349 1.00 0.00 H TER 88713 WAT 9758 ATOM 88713 O WAT 9759 98.405 141.944 3.028 1.00 0.00 O ATOM 88714 H1 WAT 9759 97.907 142.661 2.636 1.00 0.00 H ATOM 88715 H2 WAT 9759 99.234 141.939 2.549 1.00 0.00 H TER 88717 WAT 9759 ATOM 88717 O WAT 9760 51.476 77.420 117.471 1.00 0.00 O ATOM 88718 H1 WAT 9760 51.272 76.944 118.276 1.00 0.00 H ATOM 88719 H2 WAT 9760 50.992 78.242 117.550 1.00 0.00 H TER 88721 WAT 9760 ATOM 88721 O WAT 9761 133.118 82.606 18.166 1.00 0.00 O ATOM 88722 H1 WAT 9761 132.412 82.325 17.584 1.00 0.00 H ATOM 88723 H2 WAT 9761 133.862 82.758 17.583 1.00 0.00 H TER 88725 WAT 9761 ATOM 88725 O WAT 9762 41.390 5.472 97.231 1.00 0.00 O ATOM 88726 H1 WAT 9762 40.769 5.589 97.950 1.00 0.00 H ATOM 88727 H2 WAT 9762 40.873 5.627 96.440 1.00 0.00 H TER 88729 WAT 9762 ATOM 88729 O WAT 9763 104.812 136.101 1.454 1.00 0.00 O ATOM 88730 H1 WAT 9763 105.555 136.447 0.959 1.00 0.00 H ATOM 88731 H2 WAT 9763 104.753 136.665 2.224 1.00 0.00 H TER 88733 WAT 9763 ATOM 88733 O WAT 9764 83.494 99.048 146.149 1.00 0.00 O ATOM 88734 H1 WAT 9764 83.818 99.304 145.285 1.00 0.00 H ATOM 88735 H2 WAT 9764 83.042 98.218 145.999 1.00 0.00 H TER 88737 WAT 9764 ATOM 88737 O WAT 9765 4.133 28.620 79.424 1.00 0.00 O ATOM 88738 H1 WAT 9765 4.171 27.790 78.950 1.00 0.00 H ATOM 88739 H2 WAT 9765 4.289 29.286 78.754 1.00 0.00 H TER 88741 WAT 9765 ATOM 88741 O WAT 9766 144.969 9.431 67.943 1.00 0.00 O ATOM 88742 H1 WAT 9766 144.654 9.956 68.679 1.00 0.00 H ATOM 88743 H2 WAT 9766 145.335 8.645 68.348 1.00 0.00 H TER 88745 WAT 9766 ATOM 88745 O WAT 9767 42.864 12.859 99.604 1.00 0.00 O ATOM 88746 H1 WAT 9767 43.253 12.212 99.016 1.00 0.00 H ATOM 88747 H2 WAT 9767 43.389 12.803 100.403 1.00 0.00 H TER 88749 WAT 9767 ATOM 88749 O WAT 9768 8.156 122.602 135.111 1.00 0.00 O ATOM 88750 H1 WAT 9768 8.462 121.811 135.555 1.00 0.00 H ATOM 88751 H2 WAT 9768 7.305 122.786 135.509 1.00 0.00 H TER 88753 WAT 9768 ATOM 88753 O WAT 9769 76.219 112.666 121.058 1.00 0.00 O ATOM 88754 H1 WAT 9769 75.589 113.378 120.942 1.00 0.00 H ATOM 88755 H2 WAT 9769 77.074 113.085 120.955 1.00 0.00 H TER 88757 WAT 9769 ATOM 88757 O WAT 9770 22.216 138.183 52.881 1.00 0.00 O ATOM 88758 H1 WAT 9770 21.923 137.519 53.506 1.00 0.00 H ATOM 88759 H2 WAT 9770 21.479 138.288 52.280 1.00 0.00 H TER 88761 WAT 9770 ATOM 88761 O WAT 9771 41.255 143.495 108.751 1.00 0.00 O ATOM 88762 H1 WAT 9771 40.326 143.459 108.524 1.00 0.00 H ATOM 88763 H2 WAT 9771 41.324 142.990 109.561 1.00 0.00 H TER 88765 WAT 9771 ATOM 88765 O WAT 9772 89.443 128.807 144.179 1.00 0.00 O ATOM 88766 H1 WAT 9772 88.697 129.240 143.765 1.00 0.00 H ATOM 88767 H2 WAT 9772 89.997 128.533 143.448 1.00 0.00 H TER 88769 WAT 9772 ATOM 88769 O WAT 9773 45.408 25.833 69.713 1.00 0.00 O ATOM 88770 H1 WAT 9773 45.298 24.884 69.671 1.00 0.00 H ATOM 88771 H2 WAT 9773 45.859 25.986 70.543 1.00 0.00 H TER 88773 WAT 9773 ATOM 88773 O WAT 9774 92.405 89.532 104.760 1.00 0.00 O ATOM 88774 H1 WAT 9774 92.456 88.619 105.043 1.00 0.00 H ATOM 88775 H2 WAT 9774 91.620 89.873 105.191 1.00 0.00 H TER 88777 WAT 9774 ATOM 88777 O WAT 9775 78.475 128.350 153.172 1.00 0.00 O ATOM 88778 H1 WAT 9775 77.752 128.943 152.969 1.00 0.00 H ATOM 88779 H2 WAT 9775 79.084 128.454 152.441 1.00 0.00 H TER 88781 WAT 9775 ATOM 88781 O WAT 9776 30.814 54.372 136.980 1.00 0.00 O ATOM 88782 H1 WAT 9776 30.529 55.080 136.403 1.00 0.00 H ATOM 88783 H2 WAT 9776 31.412 54.792 137.598 1.00 0.00 H TER 88785 WAT 9776 ATOM 88785 O WAT 9777 71.581 122.890 56.937 1.00 0.00 O ATOM 88786 H1 WAT 9777 71.699 123.469 56.184 1.00 0.00 H ATOM 88787 H2 WAT 9777 71.693 122.009 56.581 1.00 0.00 H TER 88789 WAT 9777 ATOM 88789 O WAT 9778 128.937 104.915 68.968 1.00 0.00 O ATOM 88790 H1 WAT 9778 128.145 105.080 69.479 1.00 0.00 H ATOM 88791 H2 WAT 9778 128.688 105.121 68.067 1.00 0.00 H TER 88793 WAT 9778 ATOM 88793 O WAT 9779 32.526 26.294 73.821 1.00 0.00 O ATOM 88794 H1 WAT 9779 32.650 25.571 73.207 1.00 0.00 H ATOM 88795 H2 WAT 9779 33.096 26.989 73.492 1.00 0.00 H TER 88797 WAT 9779 ATOM 88797 O WAT 9780 23.166 42.529 129.683 1.00 0.00 O ATOM 88798 H1 WAT 9780 23.918 41.944 129.781 1.00 0.00 H ATOM 88799 H2 WAT 9780 23.213 42.829 128.776 1.00 0.00 H TER 88801 WAT 9780 ATOM 88801 O WAT 9781 3.432 42.660 2.583 1.00 0.00 O ATOM 88802 H1 WAT 9781 4.021 42.091 2.087 1.00 0.00 H ATOM 88803 H2 WAT 9781 3.789 43.539 2.460 1.00 0.00 H TER 88805 WAT 9781 ATOM 88805 O WAT 9782 25.557 13.078 129.361 1.00 0.00 O ATOM 88806 H1 WAT 9782 25.956 12.925 128.504 1.00 0.00 H ATOM 88807 H2 WAT 9782 24.616 12.999 129.204 1.00 0.00 H TER 88809 WAT 9782 ATOM 88809 O WAT 9783 139.643 54.577 77.494 1.00 0.00 O ATOM 88810 H1 WAT 9783 140.110 54.083 76.820 1.00 0.00 H ATOM 88811 H2 WAT 9783 140.327 54.855 78.104 1.00 0.00 H TER 88813 WAT 9783 ATOM 88813 O WAT 9784 40.782 140.670 156.152 1.00 0.00 O ATOM 88814 H1 WAT 9784 40.256 140.565 156.945 1.00 0.00 H ATOM 88815 H2 WAT 9784 41.165 141.544 156.233 1.00 0.00 H TER 88817 WAT 9784 ATOM 88817 O WAT 9785 113.361 48.622 123.075 1.00 0.00 O ATOM 88818 H1 WAT 9785 113.802 48.944 122.289 1.00 0.00 H ATOM 88819 H2 WAT 9785 112.436 48.578 122.830 1.00 0.00 H TER 88821 WAT 9785 ATOM 88821 O WAT 9786 76.488 14.318 151.848 1.00 0.00 O ATOM 88822 H1 WAT 9786 76.093 13.458 151.990 1.00 0.00 H ATOM 88823 H2 WAT 9786 77.364 14.127 151.514 1.00 0.00 H TER 88825 WAT 9786 ATOM 88825 O WAT 9787 70.995 32.103 128.846 1.00 0.00 O ATOM 88826 H1 WAT 9787 70.072 32.159 128.598 1.00 0.00 H ATOM 88827 H2 WAT 9787 71.322 32.998 128.754 1.00 0.00 H TER 88829 WAT 9787 ATOM 88829 O WAT 9788 19.827 50.274 14.815 1.00 0.00 O ATOM 88830 H1 WAT 9788 19.696 49.755 14.021 1.00 0.00 H ATOM 88831 H2 WAT 9788 20.260 49.675 15.424 1.00 0.00 H TER 88833 WAT 9788 ATOM 88833 O WAT 9789 13.321 5.773 1.560 1.00 0.00 O ATOM 88834 H1 WAT 9789 13.062 5.806 0.639 1.00 0.00 H ATOM 88835 H2 WAT 9789 14.175 6.205 1.584 1.00 0.00 H TER 88837 WAT 9789 ATOM 88837 O WAT 9790 77.581 73.348 91.424 1.00 0.00 O ATOM 88838 H1 WAT 9790 77.244 73.130 92.293 1.00 0.00 H ATOM 88839 H2 WAT 9790 78.151 74.103 91.571 1.00 0.00 H TER 88841 WAT 9790 ATOM 88841 O WAT 9791 42.222 31.425 147.746 1.00 0.00 O ATOM 88842 H1 WAT 9791 41.829 32.297 147.697 1.00 0.00 H ATOM 88843 H2 WAT 9791 42.233 31.219 148.681 1.00 0.00 H TER 88845 WAT 9791 ATOM 88845 O WAT 9792 26.850 48.141 126.667 1.00 0.00 O ATOM 88846 H1 WAT 9792 27.306 48.208 127.506 1.00 0.00 H ATOM 88847 H2 WAT 9792 27.102 48.934 126.193 1.00 0.00 H TER 88849 WAT 9792 ATOM 88849 O WAT 9793 101.928 22.055 89.502 1.00 0.00 O ATOM 88850 H1 WAT 9793 102.386 22.799 89.111 1.00 0.00 H ATOM 88851 H2 WAT 9793 101.035 22.370 89.641 1.00 0.00 H TER 88853 WAT 9793 ATOM 88853 O WAT 9794 26.621 138.191 60.290 1.00 0.00 O ATOM 88854 H1 WAT 9794 26.997 137.980 59.435 1.00 0.00 H ATOM 88855 H2 WAT 9794 26.950 137.505 60.871 1.00 0.00 H TER 88857 WAT 9794 ATOM 88857 O WAT 9795 99.509 113.827 149.277 1.00 0.00 O ATOM 88858 H1 WAT 9795 100.054 113.208 149.763 1.00 0.00 H ATOM 88859 H2 WAT 9795 99.931 114.675 149.413 1.00 0.00 H TER 88861 WAT 9795 ATOM 88861 O WAT 9796 138.232 43.050 137.378 1.00 0.00 O ATOM 88862 H1 WAT 9796 137.750 42.921 138.195 1.00 0.00 H ATOM 88863 H2 WAT 9796 137.551 43.175 136.716 1.00 0.00 H TER 88865 WAT 9796 ATOM 88865 O WAT 9797 84.480 50.251 90.293 1.00 0.00 O ATOM 88866 H1 WAT 9797 84.125 50.935 89.725 1.00 0.00 H ATOM 88867 H2 WAT 9797 84.633 49.509 89.709 1.00 0.00 H TER 88869 WAT 9797 ATOM 88869 O WAT 9798 9.194 78.777 118.454 1.00 0.00 O ATOM 88870 H1 WAT 9798 9.276 78.660 119.400 1.00 0.00 H ATOM 88871 H2 WAT 9798 8.385 78.319 118.226 1.00 0.00 H TER 88873 WAT 9798 ATOM 88873 O WAT 9799 144.168 20.219 95.430 1.00 0.00 O ATOM 88874 H1 WAT 9799 143.494 20.487 94.805 1.00 0.00 H ATOM 88875 H2 WAT 9799 144.966 20.645 95.118 1.00 0.00 H TER 88877 WAT 9799 ATOM 88877 O WAT 9800 28.966 88.854 97.705 1.00 0.00 O ATOM 88878 H1 WAT 9800 29.906 88.923 97.538 1.00 0.00 H ATOM 88879 H2 WAT 9800 28.754 89.641 98.207 1.00 0.00 H TER 88881 WAT 9800 ATOM 88881 O WAT 9801 45.125 97.278 81.244 1.00 0.00 O ATOM 88882 H1 WAT 9801 45.082 98.193 80.965 1.00 0.00 H ATOM 88883 H2 WAT 9801 45.584 96.833 80.532 1.00 0.00 H TER 88885 WAT 9801 ATOM 88885 O WAT 9802 102.733 6.993 143.459 1.00 0.00 O ATOM 88886 H1 WAT 9802 102.285 7.778 143.776 1.00 0.00 H ATOM 88887 H2 WAT 9802 103.119 6.605 144.244 1.00 0.00 H TER 88889 WAT 9802 ATOM 88889 O WAT 9803 137.463 42.811 133.015 1.00 0.00 O ATOM 88890 H1 WAT 9803 137.279 42.324 132.212 1.00 0.00 H ATOM 88891 H2 WAT 9803 138.275 42.428 133.347 1.00 0.00 H TER 88893 WAT 9803 ATOM 88893 O WAT 9804 42.459 137.709 17.877 1.00 0.00 O ATOM 88894 H1 WAT 9804 42.469 137.906 18.814 1.00 0.00 H ATOM 88895 H2 WAT 9804 42.581 136.761 17.830 1.00 0.00 H TER 88897 WAT 9804 ATOM 88897 O WAT 9805 108.712 128.564 134.410 1.00 0.00 O ATOM 88898 H1 WAT 9805 108.432 127.885 135.024 1.00 0.00 H ATOM 88899 H2 WAT 9805 108.916 129.318 134.963 1.00 0.00 H TER 88901 WAT 9805 ATOM 88901 O WAT 9806 144.632 107.982 96.977 1.00 0.00 O ATOM 88902 H1 WAT 9806 145.013 108.847 96.829 1.00 0.00 H ATOM 88903 H2 WAT 9806 144.115 107.809 96.190 1.00 0.00 H TER 88905 WAT 9806 ATOM 88905 O WAT 9807 43.521 25.954 7.826 1.00 0.00 O ATOM 88906 H1 WAT 9807 43.045 25.154 8.053 1.00 0.00 H ATOM 88907 H2 WAT 9807 43.325 26.094 6.900 1.00 0.00 H TER 88909 WAT 9807 ATOM 88909 O WAT 9808 137.760 106.336 61.202 1.00 0.00 O ATOM 88910 H1 WAT 9808 137.104 105.639 61.211 1.00 0.00 H ATOM 88911 H2 WAT 9808 138.599 105.874 61.192 1.00 0.00 H TER 88913 WAT 9808 ATOM 88913 O WAT 9809 112.397 46.623 26.466 1.00 0.00 O ATOM 88914 H1 WAT 9809 111.865 45.829 26.525 1.00 0.00 H ATOM 88915 H2 WAT 9809 112.918 46.504 25.672 1.00 0.00 H TER 88917 WAT 9809 ATOM 88917 O WAT 9810 62.203 70.208 153.621 1.00 0.00 O ATOM 88918 H1 WAT 9810 61.637 70.324 154.384 1.00 0.00 H ATOM 88919 H2 WAT 9810 62.979 69.765 153.964 1.00 0.00 H TER 88921 WAT 9810 ATOM 88921 O WAT 9811 101.440 112.164 150.696 1.00 0.00 O ATOM 88922 H1 WAT 9811 101.009 111.502 151.236 1.00 0.00 H ATOM 88923 H2 WAT 9811 101.706 112.843 151.316 1.00 0.00 H TER 88925 WAT 9811 ATOM 88925 O WAT 9812 99.365 104.659 119.102 1.00 0.00 O ATOM 88926 H1 WAT 9812 99.603 105.579 119.217 1.00 0.00 H ATOM 88927 H2 WAT 9812 98.422 104.634 119.261 1.00 0.00 H TER 88929 WAT 9812 ATOM 88929 O WAT 9813 83.963 115.727 109.590 1.00 0.00 O ATOM 88930 H1 WAT 9813 84.486 115.103 110.096 1.00 0.00 H ATOM 88931 H2 WAT 9813 83.810 115.288 108.754 1.00 0.00 H TER 88933 WAT 9813 ATOM 88933 O WAT 9814 72.798 111.817 155.421 1.00 0.00 O ATOM 88934 H1 WAT 9814 73.146 112.695 155.259 1.00 0.00 H ATOM 88935 H2 WAT 9814 72.839 111.383 154.569 1.00 0.00 H TER 88937 WAT 9814 ATOM 88937 O WAT 9815 88.557 136.618 127.872 1.00 0.00 O ATOM 88938 H1 WAT 9815 87.792 137.012 127.453 1.00 0.00 H ATOM 88939 H2 WAT 9815 89.187 136.502 127.161 1.00 0.00 H TER 88941 WAT 9815 ATOM 88941 O WAT 9816 124.097 44.862 141.730 1.00 0.00 O ATOM 88942 H1 WAT 9816 123.664 45.364 141.039 1.00 0.00 H ATOM 88943 H2 WAT 9816 123.532 44.101 141.863 1.00 0.00 H TER 88945 WAT 9816 ATOM 88945 O WAT 9817 27.135 64.044 104.628 1.00 0.00 O ATOM 88946 H1 WAT 9817 27.608 63.246 104.392 1.00 0.00 H ATOM 88947 H2 WAT 9817 27.369 64.198 105.543 1.00 0.00 H TER 88949 WAT 9817 ATOM 88949 O WAT 9818 127.507 28.823 67.466 1.00 0.00 O ATOM 88950 H1 WAT 9818 127.796 28.908 68.375 1.00 0.00 H ATOM 88951 H2 WAT 9818 127.728 27.923 67.227 1.00 0.00 H TER 88953 WAT 9818 ATOM 88953 O WAT 9819 6.418 128.622 156.433 1.00 0.00 O ATOM 88954 H1 WAT 9819 7.097 128.612 157.107 1.00 0.00 H ATOM 88955 H2 WAT 9819 5.765 127.993 156.741 1.00 0.00 H TER 88957 WAT 9819 ATOM 88957 O WAT 9820 112.464 11.400 55.519 1.00 0.00 O ATOM 88958 H1 WAT 9820 112.565 10.545 55.101 1.00 0.00 H ATOM 88959 H2 WAT 9820 111.593 11.696 55.254 1.00 0.00 H TER 88961 WAT 9820 ATOM 88961 O WAT 9821 99.478 83.938 91.058 1.00 0.00 O ATOM 88962 H1 WAT 9821 100.259 83.845 90.512 1.00 0.00 H ATOM 88963 H2 WAT 9821 98.850 84.397 90.500 1.00 0.00 H TER 88965 WAT 9821 ATOM 88965 O WAT 9822 90.994 71.049 91.136 1.00 0.00 O ATOM 88966 H1 WAT 9822 91.834 71.431 91.393 1.00 0.00 H ATOM 88967 H2 WAT 9822 90.393 71.793 91.105 1.00 0.00 H TER 88969 WAT 9822 ATOM 88969 O WAT 9823 7.352 0.615 71.761 1.00 0.00 O ATOM 88970 H1 WAT 9823 6.504 0.669 71.322 1.00 0.00 H ATOM 88971 H2 WAT 9823 7.171 0.146 72.576 1.00 0.00 H TER 88973 WAT 9823 ATOM 88973 O WAT 9824 76.355 78.729 94.210 1.00 0.00 O ATOM 88974 H1 WAT 9824 76.900 78.451 93.474 1.00 0.00 H ATOM 88975 H2 WAT 9824 76.596 78.139 94.923 1.00 0.00 H TER 88977 WAT 9824 ATOM 88977 O WAT 9825 86.577 115.926 11.411 1.00 0.00 O ATOM 88978 H1 WAT 9825 87.260 115.716 12.047 1.00 0.00 H ATOM 88979 H2 WAT 9825 85.765 115.635 11.826 1.00 0.00 H TER 88981 WAT 9825 ATOM 88981 O WAT 9826 68.325 136.807 60.493 1.00 0.00 O ATOM 88982 H1 WAT 9826 69.266 136.955 60.583 1.00 0.00 H ATOM 88983 H2 WAT 9826 68.084 137.278 59.696 1.00 0.00 H TER 88985 WAT 9826 ATOM 88985 O WAT 9827 134.670 56.228 78.268 1.00 0.00 O ATOM 88986 H1 WAT 9827 133.767 56.532 78.358 1.00 0.00 H ATOM 88987 H2 WAT 9827 134.874 55.829 79.114 1.00 0.00 H TER 88989 WAT 9827 ATOM 88989 O WAT 9828 127.702 128.829 74.806 1.00 0.00 O ATOM 88990 H1 WAT 9828 127.093 128.281 74.312 1.00 0.00 H ATOM 88991 H2 WAT 9828 128.253 129.237 74.138 1.00 0.00 H TER 88993 WAT 9828 ATOM 88993 O WAT 9829 92.204 18.499 66.797 1.00 0.00 O ATOM 88994 H1 WAT 9829 92.503 18.213 65.933 1.00 0.00 H ATOM 88995 H2 WAT 9829 92.588 17.866 67.404 1.00 0.00 H TER 88997 WAT 9829 ATOM 88997 O WAT 9830 20.033 99.568 133.616 1.00 0.00 O ATOM 88998 H1 WAT 9830 20.935 99.398 133.347 1.00 0.00 H ATOM 88999 H2 WAT 9830 19.514 98.921 133.138 1.00 0.00 H TER 89001 WAT 9830 ATOM 89001 O WAT 9831 58.669 35.322 121.642 1.00 0.00 O ATOM 89002 H1 WAT 9831 59.068 34.749 120.987 1.00 0.00 H ATOM 89003 H2 WAT 9831 59.410 35.757 122.063 1.00 0.00 H TER 89005 WAT 9831 ATOM 89005 O WAT 9832 12.766 17.275 84.686 1.00 0.00 O ATOM 89006 H1 WAT 9832 13.325 18.029 84.496 1.00 0.00 H ATOM 89007 H2 WAT 9832 12.029 17.366 84.081 1.00 0.00 H TER 89009 WAT 9832 ATOM 89009 O WAT 9833 94.011 78.044 2.203 1.00 0.00 O ATOM 89010 H1 WAT 9833 94.601 77.427 1.771 1.00 0.00 H ATOM 89011 H2 WAT 9833 93.146 77.834 1.853 1.00 0.00 H TER 89013 WAT 9833 ATOM 89013 O WAT 9834 118.549 14.999 152.259 1.00 0.00 O ATOM 89014 H1 WAT 9834 118.294 14.165 152.655 1.00 0.00 H ATOM 89015 H2 WAT 9834 117.809 15.581 152.431 1.00 0.00 H TER 89017 WAT 9834 ATOM 89017 O WAT 9835 110.820 26.762 13.923 1.00 0.00 O ATOM 89018 H1 WAT 9835 110.433 26.115 14.513 1.00 0.00 H ATOM 89019 H2 WAT 9835 110.136 26.934 13.276 1.00 0.00 H TER 89021 WAT 9835 ATOM 89021 O WAT 9836 75.442 91.637 123.548 1.00 0.00 O ATOM 89022 H1 WAT 9836 75.084 90.869 123.104 1.00 0.00 H ATOM 89023 H2 WAT 9836 74.926 92.370 123.213 1.00 0.00 H TER 89025 WAT 9836 ATOM 89025 O WAT 9837 60.434 53.300 9.645 1.00 0.00 O ATOM 89026 H1 WAT 9837 61.318 53.214 9.288 1.00 0.00 H ATOM 89027 H2 WAT 9837 60.024 53.979 9.108 1.00 0.00 H TER 89029 WAT 9837 ATOM 89029 O WAT 9838 71.459 104.289 22.374 1.00 0.00 O ATOM 89030 H1 WAT 9838 71.156 104.907 21.708 1.00 0.00 H ATOM 89031 H2 WAT 9838 72.372 104.532 22.528 1.00 0.00 H TER 89033 WAT 9838 ATOM 89033 O WAT 9839 32.114 10.283 95.809 1.00 0.00 O ATOM 89034 H1 WAT 9839 31.278 9.817 95.784 1.00 0.00 H ATOM 89035 H2 WAT 9839 32.032 10.958 95.135 1.00 0.00 H TER 89037 WAT 9839 ATOM 89037 O WAT 9840 22.888 87.243 120.128 1.00 0.00 O ATOM 89038 H1 WAT 9840 23.839 87.345 120.176 1.00 0.00 H ATOM 89039 H2 WAT 9840 22.735 86.826 119.280 1.00 0.00 H TER 89041 WAT 9840 ATOM 89041 O WAT 9841 43.842 131.857 14.375 1.00 0.00 O ATOM 89042 H1 WAT 9841 44.104 131.258 13.676 1.00 0.00 H ATOM 89043 H2 WAT 9841 44.000 131.368 15.182 1.00 0.00 H TER 89045 WAT 9841 ATOM 89045 O WAT 9842 132.566 119.898 140.503 1.00 0.00 O ATOM 89046 H1 WAT 9842 133.138 119.345 141.035 1.00 0.00 H ATOM 89047 H2 WAT 9842 132.879 120.789 140.662 1.00 0.00 H TER 89049 WAT 9842 ATOM 89049 O WAT 9843 30.634 44.611 116.914 1.00 0.00 O ATOM 89050 H1 WAT 9843 30.368 44.516 116.000 1.00 0.00 H ATOM 89051 H2 WAT 9843 31.388 45.201 116.884 1.00 0.00 H TER 89053 WAT 9843 ATOM 89053 O WAT 9844 18.039 14.452 91.359 1.00 0.00 O ATOM 89054 H1 WAT 9844 18.384 15.304 91.089 1.00 0.00 H ATOM 89055 H2 WAT 9844 17.734 14.049 90.546 1.00 0.00 H TER 89057 WAT 9844 ATOM 89057 O WAT 9845 18.371 113.685 10.615 1.00 0.00 O ATOM 89058 H1 WAT 9845 17.628 113.323 10.132 1.00 0.00 H ATOM 89059 H2 WAT 9845 18.103 113.642 11.533 1.00 0.00 H TER 89061 WAT 9845 ATOM 89061 O WAT 9846 20.628 61.646 14.366 1.00 0.00 O ATOM 89062 H1 WAT 9846 21.379 61.259 14.816 1.00 0.00 H ATOM 89063 H2 WAT 9846 20.198 60.905 13.938 1.00 0.00 H TER 89065 WAT 9846 ATOM 89065 O WAT 9847 118.289 98.011 110.647 1.00 0.00 O ATOM 89066 H1 WAT 9847 118.087 98.824 111.110 1.00 0.00 H ATOM 89067 H2 WAT 9847 117.545 97.438 110.835 1.00 0.00 H TER 89069 WAT 9847 ATOM 89069 O WAT 9848 80.037 39.330 88.310 1.00 0.00 O ATOM 89070 H1 WAT 9848 80.884 39.361 88.754 1.00 0.00 H ATOM 89071 H2 WAT 9848 79.397 39.493 89.003 1.00 0.00 H TER 89073 WAT 9848 ATOM 89073 O WAT 9849 102.315 5.503 95.914 1.00 0.00 O ATOM 89074 H1 WAT 9849 101.791 5.859 96.631 1.00 0.00 H ATOM 89075 H2 WAT 9849 101.801 5.686 95.128 1.00 0.00 H TER 89077 WAT 9849 ATOM 89077 O WAT 9850 141.894 119.416 26.870 1.00 0.00 O ATOM 89078 H1 WAT 9850 142.620 118.966 26.438 1.00 0.00 H ATOM 89079 H2 WAT 9850 141.615 120.081 26.240 1.00 0.00 H TER 89081 WAT 9850 ATOM 89081 O WAT 9851 4.909 88.108 146.268 1.00 0.00 O ATOM 89082 H1 WAT 9851 5.537 87.988 145.555 1.00 0.00 H ATOM 89083 H2 WAT 9851 4.266 87.410 146.140 1.00 0.00 H TER 89085 WAT 9851 ATOM 89085 O WAT 9852 30.324 125.411 151.443 1.00 0.00 O ATOM 89086 H1 WAT 9852 30.154 124.471 151.498 1.00 0.00 H ATOM 89087 H2 WAT 9852 30.100 125.746 152.312 1.00 0.00 H TER 89089 WAT 9852 ATOM 89089 O WAT 9853 9.954 65.419 105.603 1.00 0.00 O ATOM 89090 H1 WAT 9853 9.104 65.689 105.256 1.00 0.00 H ATOM 89091 H2 WAT 9853 10.130 64.578 105.180 1.00 0.00 H TER 89093 WAT 9853 ATOM 89093 O WAT 9854 99.409 82.539 113.911 1.00 0.00 O ATOM 89094 H1 WAT 9854 100.189 82.758 114.422 1.00 0.00 H ATOM 89095 H2 WAT 9854 99.600 81.679 113.539 1.00 0.00 H TER 89097 WAT 9854 ATOM 89097 O WAT 9855 111.452 32.598 79.590 1.00 0.00 O ATOM 89098 H1 WAT 9855 111.026 33.075 78.879 1.00 0.00 H ATOM 89099 H2 WAT 9855 112.178 33.163 79.856 1.00 0.00 H TER 89101 WAT 9855 ATOM 89101 O WAT 9856 26.735 6.976 111.431 1.00 0.00 O ATOM 89102 H1 WAT 9856 27.554 6.846 111.910 1.00 0.00 H ATOM 89103 H2 WAT 9856 26.615 7.925 111.415 1.00 0.00 H TER 89105 WAT 9856 ATOM 89105 O WAT 9857 5.259 87.939 103.951 1.00 0.00 O ATOM 89106 H1 WAT 9857 6.114 87.816 104.364 1.00 0.00 H ATOM 89107 H2 WAT 9857 5.373 88.704 103.387 1.00 0.00 H TER 89109 WAT 9857 ATOM 89109 O WAT 9858 91.109 121.271 107.372 1.00 0.00 O ATOM 89110 H1 WAT 9858 91.195 120.459 107.872 1.00 0.00 H ATOM 89111 H2 WAT 9858 90.184 121.305 107.128 1.00 0.00 H TER 89113 WAT 9858 ATOM 89113 O WAT 9859 112.696 1.742 18.179 1.00 0.00 O ATOM 89114 H1 WAT 9859 112.827 1.880 19.117 1.00 0.00 H ATOM 89115 H2 WAT 9859 113.293 1.028 17.957 1.00 0.00 H TER 89117 WAT 9859 ATOM 89117 O WAT 9860 49.170 86.918 100.191 1.00 0.00 O ATOM 89118 H1 WAT 9860 49.887 86.955 99.558 1.00 0.00 H ATOM 89119 H2 WAT 9860 48.448 86.511 99.712 1.00 0.00 H TER 89121 WAT 9860 ATOM 89121 O WAT 9861 102.500 137.588 88.438 1.00 0.00 O ATOM 89122 H1 WAT 9861 102.967 138.218 87.889 1.00 0.00 H ATOM 89123 H2 WAT 9861 101.588 137.654 88.155 1.00 0.00 H TER 89125 WAT 9861 ATOM 89125 O WAT 9862 90.239 121.369 143.174 1.00 0.00 O ATOM 89126 H1 WAT 9862 90.077 120.425 143.176 1.00 0.00 H ATOM 89127 H2 WAT 9862 90.871 121.501 142.467 1.00 0.00 H TER 89129 WAT 9862 ATOM 89129 O WAT 9863 50.587 22.388 77.624 1.00 0.00 O ATOM 89130 H1 WAT 9863 50.503 23.011 78.345 1.00 0.00 H ATOM 89131 H2 WAT 9863 49.980 21.682 77.846 1.00 0.00 H TER 89133 WAT 9863 ATOM 89133 O WAT 9864 132.253 51.355 133.678 1.00 0.00 O ATOM 89134 H1 WAT 9864 132.841 51.162 134.408 1.00 0.00 H ATOM 89135 H2 WAT 9864 132.793 51.231 132.897 1.00 0.00 H TER 89137 WAT 9864 ATOM 89137 O WAT 9865 37.188 0.432 151.860 1.00 0.00 O ATOM 89138 H1 WAT 9865 36.836 -0.457 151.805 1.00 0.00 H ATOM 89139 H2 WAT 9865 37.914 0.364 152.479 1.00 0.00 H TER 89141 WAT 9865 ATOM 89141 O WAT 9866 101.953 88.556 112.267 1.00 0.00 O ATOM 89142 H1 WAT 9866 102.066 87.612 112.156 1.00 0.00 H ATOM 89143 H2 WAT 9866 102.760 88.936 111.919 1.00 0.00 H TER 89145 WAT 9866 ATOM 89145 O WAT 9867 107.791 53.154 117.603 1.00 0.00 O ATOM 89146 H1 WAT 9867 106.848 53.219 117.453 1.00 0.00 H ATOM 89147 H2 WAT 9867 108.184 53.449 116.781 1.00 0.00 H TER 89149 WAT 9867 ATOM 89149 O WAT 9868 32.643 112.703 72.816 1.00 0.00 O ATOM 89150 H1 WAT 9868 31.943 112.422 72.227 1.00 0.00 H ATOM 89151 H2 WAT 9868 33.126 113.362 72.318 1.00 0.00 H TER 89153 WAT 9868 ATOM 89153 O WAT 9869 61.315 144.388 113.325 1.00 0.00 O ATOM 89154 H1 WAT 9869 61.621 145.152 112.837 1.00 0.00 H ATOM 89155 H2 WAT 9869 61.940 143.697 113.107 1.00 0.00 H TER 89157 WAT 9869 ATOM 89157 O WAT 9870 85.424 79.773 70.997 1.00 0.00 O ATOM 89158 H1 WAT 9870 85.886 80.384 71.571 1.00 0.00 H ATOM 89159 H2 WAT 9870 84.506 80.038 71.055 1.00 0.00 H TER 89161 WAT 9870 ATOM 89161 O WAT 9871 39.626 141.169 130.564 1.00 0.00 O ATOM 89162 H1 WAT 9871 39.275 141.730 131.255 1.00 0.00 H ATOM 89163 H2 WAT 9871 39.627 141.723 129.783 1.00 0.00 H TER 89165 WAT 9871 ATOM 89165 O WAT 9872 110.695 145.661 17.365 1.00 0.00 O ATOM 89166 H1 WAT 9872 110.985 145.574 16.457 1.00 0.00 H ATOM 89167 H2 WAT 9872 111.295 146.301 17.747 1.00 0.00 H TER 89169 WAT 9872 ATOM 89169 O WAT 9873 94.739 9.668 110.563 1.00 0.00 O ATOM 89170 H1 WAT 9873 95.434 9.503 111.200 1.00 0.00 H ATOM 89171 H2 WAT 9873 95.074 10.385 110.023 1.00 0.00 H TER 89173 WAT 9873 ATOM 89173 O WAT 9874 74.068 140.301 65.746 1.00 0.00 O ATOM 89174 H1 WAT 9874 73.450 141.023 65.861 1.00 0.00 H ATOM 89175 H2 WAT 9874 74.681 140.614 65.081 1.00 0.00 H TER 89177 WAT 9874 ATOM 89177 O WAT 9875 79.264 28.225 18.327 1.00 0.00 O ATOM 89178 H1 WAT 9875 79.112 27.649 19.077 1.00 0.00 H ATOM 89179 H2 WAT 9875 80.194 28.120 18.129 1.00 0.00 H TER 89181 WAT 9875 ATOM 89181 O WAT 9876 51.811 9.129 149.232 1.00 0.00 O ATOM 89182 H1 WAT 9876 52.767 9.148 149.196 1.00 0.00 H ATOM 89183 H2 WAT 9876 51.580 9.851 149.817 1.00 0.00 H TER 89185 WAT 9876 ATOM 89185 O WAT 9877 63.805 80.815 144.201 1.00 0.00 O ATOM 89186 H1 WAT 9877 64.102 81.636 144.593 1.00 0.00 H ATOM 89187 H2 WAT 9877 63.989 80.915 143.267 1.00 0.00 H TER 89189 WAT 9877 ATOM 89189 O WAT 9878 43.265 81.819 139.779 1.00 0.00 O ATOM 89190 H1 WAT 9878 43.356 82.713 139.448 1.00 0.00 H ATOM 89191 H2 WAT 9878 43.543 81.874 140.694 1.00 0.00 H TER 89193 WAT 9878 ATOM 89193 O WAT 9879 57.139 39.629 124.024 1.00 0.00 O ATOM 89194 H1 WAT 9879 56.383 39.530 124.603 1.00 0.00 H ATOM 89195 H2 WAT 9879 57.053 38.915 123.393 1.00 0.00 H TER 89197 WAT 9879 ATOM 89197 O WAT 9880 9.891 138.060 89.210 1.00 0.00 O ATOM 89198 H1 WAT 9880 10.423 137.946 89.998 1.00 0.00 H ATOM 89199 H2 WAT 9880 9.055 138.397 89.532 1.00 0.00 H TER 89201 WAT 9880 ATOM 89201 O WAT 9881 92.156 49.663 135.381 1.00 0.00 O ATOM 89202 H1 WAT 9881 92.512 49.835 134.510 1.00 0.00 H ATOM 89203 H2 WAT 9881 91.510 48.970 135.244 1.00 0.00 H TER 89205 WAT 9881 ATOM 89205 O WAT 9882 132.406 41.161 135.108 1.00 0.00 O ATOM 89206 H1 WAT 9882 133.223 41.498 134.739 1.00 0.00 H ATOM 89207 H2 WAT 9882 132.405 41.473 136.013 1.00 0.00 H TER 89209 WAT 9882 ATOM 89209 O WAT 9883 73.896 29.401 61.405 1.00 0.00 O ATOM 89210 H1 WAT 9883 74.649 28.926 61.053 1.00 0.00 H ATOM 89211 H2 WAT 9883 73.392 29.656 60.632 1.00 0.00 H TER 89213 WAT 9883 ATOM 89213 O WAT 9884 85.988 43.151 73.356 1.00 0.00 O ATOM 89214 H1 WAT 9884 85.628 42.308 73.631 1.00 0.00 H ATOM 89215 H2 WAT 9884 85.917 43.707 74.132 1.00 0.00 H TER 89217 WAT 9884 ATOM 89217 O WAT 9885 133.183 19.133 123.351 1.00 0.00 O ATOM 89218 H1 WAT 9885 132.799 19.071 122.476 1.00 0.00 H ATOM 89219 H2 WAT 9885 133.572 20.008 123.380 1.00 0.00 H TER 89221 WAT 9885 ATOM 89221 O WAT 9886 111.936 17.442 62.962 1.00 0.00 O ATOM 89222 H1 WAT 9886 112.809 17.600 63.322 1.00 0.00 H ATOM 89223 H2 WAT 9886 111.591 16.715 63.481 1.00 0.00 H TER 89225 WAT 9886 ATOM 89225 O WAT 9887 121.455 39.299 63.840 1.00 0.00 O ATOM 89226 H1 WAT 9887 121.432 38.398 64.163 1.00 0.00 H ATOM 89227 H2 WAT 9887 120.661 39.700 64.193 1.00 0.00 H TER 89229 WAT 9887 ATOM 89229 O WAT 9888 62.484 120.083 155.928 1.00 0.00 O ATOM 89230 H1 WAT 9888 63.199 119.819 156.508 1.00 0.00 H ATOM 89231 H2 WAT 9888 62.337 119.320 155.368 1.00 0.00 H TER 89233 WAT 9888 ATOM 89233 O WAT 9889 42.838 46.699 142.188 1.00 0.00 O ATOM 89234 H1 WAT 9889 43.539 46.697 142.840 1.00 0.00 H ATOM 89235 H2 WAT 9889 42.050 46.473 142.682 1.00 0.00 H TER 89237 WAT 9889 ATOM 89237 O WAT 9890 123.973 55.177 27.038 1.00 0.00 O ATOM 89238 H1 WAT 9890 123.611 55.388 27.899 1.00 0.00 H ATOM 89239 H2 WAT 9890 123.253 54.749 26.574 1.00 0.00 H TER 89241 WAT 9890 ATOM 89241 O WAT 9891 136.926 88.347 29.093 1.00 0.00 O ATOM 89242 H1 WAT 9891 136.730 87.641 29.709 1.00 0.00 H ATOM 89243 H2 WAT 9891 137.745 88.725 29.413 1.00 0.00 H TER 89245 WAT 9891 ATOM 89245 O WAT 9892 91.224 33.515 151.939 1.00 0.00 O ATOM 89246 H1 WAT 9892 91.833 32.804 152.140 1.00 0.00 H ATOM 89247 H2 WAT 9892 90.756 33.217 151.159 1.00 0.00 H TER 89249 WAT 9892 ATOM 89249 O WAT 9893 115.496 48.500 8.061 1.00 0.00 O ATOM 89250 H1 WAT 9893 115.962 47.664 8.049 1.00 0.00 H ATOM 89251 H2 WAT 9893 115.979 49.036 8.690 1.00 0.00 H TER 89253 WAT 9893 ATOM 89253 O WAT 9894 45.017 115.347 56.570 1.00 0.00 O ATOM 89254 H1 WAT 9894 45.749 115.396 57.185 1.00 0.00 H ATOM 89255 H2 WAT 9894 45.416 115.491 55.712 1.00 0.00 H TER 89257 WAT 9894 ATOM 89257 O WAT 9895 14.446 76.081 15.702 1.00 0.00 O ATOM 89258 H1 WAT 9895 14.083 75.311 15.264 1.00 0.00 H ATOM 89259 H2 WAT 9895 14.373 75.883 16.635 1.00 0.00 H TER 89261 WAT 9895 ATOM 89261 O WAT 9896 87.019 131.191 124.002 1.00 0.00 O ATOM 89262 H1 WAT 9896 87.081 131.095 124.953 1.00 0.00 H ATOM 89263 H2 WAT 9896 86.314 130.595 123.747 1.00 0.00 H TER 89265 WAT 9896 ATOM 89265 O WAT 9897 44.974 55.120 143.399 1.00 0.00 O ATOM 89266 H1 WAT 9897 45.850 54.766 143.551 1.00 0.00 H ATOM 89267 H2 WAT 9897 44.841 55.743 144.113 1.00 0.00 H TER 89269 WAT 9897 ATOM 89269 O WAT 9898 133.790 76.241 137.247 1.00 0.00 O ATOM 89270 H1 WAT 9898 133.450 76.784 136.536 1.00 0.00 H ATOM 89271 H2 WAT 9898 133.890 76.845 137.983 1.00 0.00 H TER 89273 WAT 9898 ATOM 89273 O WAT 9899 62.194 72.032 138.902 1.00 0.00 O ATOM 89274 H1 WAT 9899 62.070 72.796 139.466 1.00 0.00 H ATOM 89275 H2 WAT 9899 62.011 72.354 138.019 1.00 0.00 H TER 89277 WAT 9899 ATOM 89277 O WAT 9900 145.400 64.158 93.200 1.00 0.00 O ATOM 89278 H1 WAT 9900 145.312 63.846 94.101 1.00 0.00 H ATOM 89279 H2 WAT 9900 144.909 64.979 93.182 1.00 0.00 H TER 89281 WAT 9900 ATOM 89281 O WAT 9901 77.240 23.917 14.499 1.00 0.00 O ATOM 89282 H1 WAT 9901 76.710 23.261 14.046 1.00 0.00 H ATOM 89283 H2 WAT 9901 77.258 23.623 15.409 1.00 0.00 H TER 89285 WAT 9901 ATOM 89285 O WAT 9902 70.809 131.457 111.185 1.00 0.00 O ATOM 89286 H1 WAT 9902 71.683 131.846 111.227 1.00 0.00 H ATOM 89287 H2 WAT 9902 70.227 132.138 111.521 1.00 0.00 H TER 89289 WAT 9902 ATOM 89289 O WAT 9903 122.577 114.567 71.355 1.00 0.00 O ATOM 89290 H1 WAT 9903 123.030 113.833 70.940 1.00 0.00 H ATOM 89291 H2 WAT 9903 121.899 114.158 71.893 1.00 0.00 H TER 89293 WAT 9903 ATOM 89293 O WAT 9904 100.969 138.909 55.761 1.00 0.00 O ATOM 89294 H1 WAT 9904 100.800 138.206 55.134 1.00 0.00 H ATOM 89295 H2 WAT 9904 100.618 138.581 56.589 1.00 0.00 H TER 89297 WAT 9904 ATOM 89297 O WAT 9905 88.490 70.779 82.729 1.00 0.00 O ATOM 89298 H1 WAT 9905 89.363 70.805 83.120 1.00 0.00 H ATOM 89299 H2 WAT 9905 88.598 71.199 81.875 1.00 0.00 H TER 89301 WAT 9905 ATOM 89301 O WAT 9906 141.918 75.736 18.116 1.00 0.00 O ATOM 89302 H1 WAT 9906 142.103 75.697 19.055 1.00 0.00 H ATOM 89303 H2 WAT 9906 142.440 76.474 17.800 1.00 0.00 H TER 89305 WAT 9906 ATOM 89305 O WAT 9907 106.587 134.274 143.825 1.00 0.00 O ATOM 89306 H1 WAT 9907 106.241 133.636 144.450 1.00 0.00 H ATOM 89307 H2 WAT 9907 107.489 134.423 144.111 1.00 0.00 H TER 89309 WAT 9907 ATOM 89309 O WAT 9908 34.093 125.603 98.509 1.00 0.00 O ATOM 89310 H1 WAT 9908 34.594 125.002 97.957 1.00 0.00 H ATOM 89311 H2 WAT 9908 34.148 125.223 99.386 1.00 0.00 H TER 89313 WAT 9908 ATOM 89313 O WAT 9909 11.393 74.614 119.898 1.00 0.00 O ATOM 89314 H1 WAT 9909 11.188 73.683 119.984 1.00 0.00 H ATOM 89315 H2 WAT 9909 12.034 74.784 120.588 1.00 0.00 H TER 89317 WAT 9909 ATOM 89317 O WAT 9910 26.260 116.161 1.769 1.00 0.00 O ATOM 89318 H1 WAT 9910 26.449 116.452 2.661 1.00 0.00 H ATOM 89319 H2 WAT 9910 25.385 115.776 1.823 1.00 0.00 H TER 89321 WAT 9910 ATOM 89321 O WAT 9911 9.183 116.910 150.544 1.00 0.00 O ATOM 89322 H1 WAT 9911 9.236 117.851 150.381 1.00 0.00 H ATOM 89323 H2 WAT 9911 8.245 116.727 150.599 1.00 0.00 H TER 89325 WAT 9911 ATOM 89325 O WAT 9912 46.243 40.894 11.271 1.00 0.00 O ATOM 89326 H1 WAT 9912 46.387 39.970 11.475 1.00 0.00 H ATOM 89327 H2 WAT 9912 46.536 41.360 12.054 1.00 0.00 H TER 89329 WAT 9912 ATOM 89329 O WAT 9913 104.706 142.702 53.636 1.00 0.00 O ATOM 89330 H1 WAT 9913 104.487 142.534 54.553 1.00 0.00 H ATOM 89331 H2 WAT 9913 105.403 142.076 53.438 1.00 0.00 H TER 89333 WAT 9913 ATOM 89333 O WAT 9914 59.839 144.146 2.292 1.00 0.00 O ATOM 89334 H1 WAT 9914 60.245 143.849 3.107 1.00 0.00 H ATOM 89335 H2 WAT 9914 60.576 144.322 1.708 1.00 0.00 H TER 89337 WAT 9914 ATOM 89337 O WAT 9915 54.978 97.304 137.320 1.00 0.00 O ATOM 89338 H1 WAT 9915 55.346 97.396 138.199 1.00 0.00 H ATOM 89339 H2 WAT 9915 54.065 97.058 137.466 1.00 0.00 H TER 89341 WAT 9915 ATOM 89341 O WAT 9916 9.617 102.588 62.849 1.00 0.00 O ATOM 89342 H1 WAT 9916 10.222 103.024 63.449 1.00 0.00 H ATOM 89343 H2 WAT 9916 8.751 102.747 63.225 1.00 0.00 H TER 89345 WAT 9916 ATOM 89345 O WAT 9917 73.106 48.923 91.051 1.00 0.00 O ATOM 89346 H1 WAT 9917 73.483 48.332 90.399 1.00 0.00 H ATOM 89347 H2 WAT 9917 73.834 49.130 91.636 1.00 0.00 H TER 89349 WAT 9917 ATOM 89349 O WAT 9918 135.476 11.122 83.080 1.00 0.00 O ATOM 89350 H1 WAT 9918 136.135 11.587 83.595 1.00 0.00 H ATOM 89351 H2 WAT 9918 134.991 11.813 82.630 1.00 0.00 H TER 89353 WAT 9918 ATOM 89353 O WAT 9919 115.567 127.690 65.125 1.00 0.00 O ATOM 89354 H1 WAT 9919 116.424 127.807 64.715 1.00 0.00 H ATOM 89355 H2 WAT 9919 114.948 128.060 64.496 1.00 0.00 H TER 89357 WAT 9919 ATOM 89357 O WAT 9920 83.810 5.164 107.383 1.00 0.00 O ATOM 89358 H1 WAT 9920 83.376 5.014 106.543 1.00 0.00 H ATOM 89359 H2 WAT 9920 83.673 4.352 107.871 1.00 0.00 H TER 89361 WAT 9920 ATOM 89361 O WAT 9921 142.562 84.980 156.426 1.00 0.00 O ATOM 89362 H1 WAT 9921 142.864 84.876 155.524 1.00 0.00 H ATOM 89363 H2 WAT 9921 142.646 84.107 156.809 1.00 0.00 H TER 89365 WAT 9921 ATOM 89365 O WAT 9922 3.405 33.676 143.129 1.00 0.00 O ATOM 89366 H1 WAT 9922 3.408 32.985 142.467 1.00 0.00 H ATOM 89367 H2 WAT 9922 4.259 34.099 143.037 1.00 0.00 H TER 89369 WAT 9922 ATOM 89369 O WAT 9923 23.153 43.001 132.494 1.00 0.00 O ATOM 89370 H1 WAT 9923 23.093 42.324 131.820 1.00 0.00 H ATOM 89371 H2 WAT 9923 23.417 42.530 133.284 1.00 0.00 H TER 89373 WAT 9923 ATOM 89373 O WAT 9924 144.313 3.785 0.914 1.00 0.00 O ATOM 89374 H1 WAT 9924 143.884 4.622 0.734 1.00 0.00 H ATOM 89375 H2 WAT 9924 143.777 3.383 1.598 1.00 0.00 H TER 89377 WAT 9924 ATOM 89377 O WAT 9925 60.855 48.801 158.670 1.00 0.00 O ATOM 89378 H1 WAT 9925 61.614 48.394 159.088 1.00 0.00 H ATOM 89379 H2 WAT 9925 61.189 49.129 157.835 1.00 0.00 H TER 89381 WAT 9925 ATOM 89381 O WAT 9926 31.148 99.719 149.704 1.00 0.00 O ATOM 89382 H1 WAT 9926 30.916 100.624 149.911 1.00 0.00 H ATOM 89383 H2 WAT 9926 30.459 99.195 150.113 1.00 0.00 H TER 89385 WAT 9926 ATOM 89385 O WAT 9927 36.937 133.775 85.096 1.00 0.00 O ATOM 89386 H1 WAT 9927 37.592 134.352 84.703 1.00 0.00 H ATOM 89387 H2 WAT 9927 37.448 133.099 85.540 1.00 0.00 H TER 89389 WAT 9927 ATOM 89389 O WAT 9928 106.166 59.068 97.524 1.00 0.00 O ATOM 89390 H1 WAT 9928 106.412 58.453 96.832 1.00 0.00 H ATOM 89391 H2 WAT 9928 105.223 58.942 97.632 1.00 0.00 H TER 89393 WAT 9928 ATOM 89393 O WAT 9929 84.774 72.796 131.203 1.00 0.00 O ATOM 89394 H1 WAT 9929 85.600 73.016 130.773 1.00 0.00 H ATOM 89395 H2 WAT 9929 84.113 72.895 130.517 1.00 0.00 H TER 89397 WAT 9929 ATOM 89397 O WAT 9930 126.241 112.682 69.196 1.00 0.00 O ATOM 89398 H1 WAT 9930 126.398 111.826 69.595 1.00 0.00 H ATOM 89399 H2 WAT 9930 125.974 112.482 68.299 1.00 0.00 H TER 89401 WAT 9930 ATOM 89401 O WAT 9931 91.779 105.672 10.837 1.00 0.00 O ATOM 89402 H1 WAT 9931 92.616 105.777 10.385 1.00 0.00 H ATOM 89403 H2 WAT 9931 92.018 105.490 11.746 1.00 0.00 H TER 89405 WAT 9931 ATOM 89405 O WAT 9932 79.404 24.465 94.730 1.00 0.00 O ATOM 89406 H1 WAT 9932 79.534 24.523 95.676 1.00 0.00 H ATOM 89407 H2 WAT 9932 79.697 25.313 94.396 1.00 0.00 H TER 89409 WAT 9932 ATOM 89409 O WAT 9933 139.180 23.561 20.246 1.00 0.00 O ATOM 89410 H1 WAT 9933 138.240 23.486 20.407 1.00 0.00 H ATOM 89411 H2 WAT 9933 139.342 22.986 19.499 1.00 0.00 H TER 89413 WAT 9933 ATOM 89413 O WAT 9934 9.051 127.838 121.227 1.00 0.00 O ATOM 89414 H1 WAT 9934 8.836 128.761 121.091 1.00 0.00 H ATOM 89415 H2 WAT 9934 8.397 127.530 121.854 1.00 0.00 H TER 89417 WAT 9934 ATOM 89417 O WAT 9935 40.614 137.169 135.065 1.00 0.00 O ATOM 89418 H1 WAT 9935 40.981 137.761 134.408 1.00 0.00 H ATOM 89419 H2 WAT 9935 39.666 137.253 134.960 1.00 0.00 H TER 89421 WAT 9935 ATOM 89421 O WAT 9936 0.832 110.121 78.871 1.00 0.00 O ATOM 89422 H1 WAT 9936 1.306 110.251 78.050 1.00 0.00 H ATOM 89423 H2 WAT 9936 1.142 110.825 79.441 1.00 0.00 H TER 89425 WAT 9936 ATOM 89425 O WAT 9937 140.997 50.199 128.793 1.00 0.00 O ATOM 89426 H1 WAT 9937 141.358 49.331 128.614 1.00 0.00 H ATOM 89427 H2 WAT 9937 140.253 50.277 128.195 1.00 0.00 H TER 89429 WAT 9937 ATOM 89429 O WAT 9938 70.936 45.548 120.040 1.00 0.00 O ATOM 89430 H1 WAT 9938 70.810 46.485 119.892 1.00 0.00 H ATOM 89431 H2 WAT 9938 70.446 45.126 119.335 1.00 0.00 H TER 89433 WAT 9938 ATOM 89433 O WAT 9939 144.671 132.132 14.050 1.00 0.00 O ATOM 89434 H1 WAT 9939 145.605 132.219 14.246 1.00 0.00 H ATOM 89435 H2 WAT 9939 144.314 133.008 14.195 1.00 0.00 H TER 89437 WAT 9939 ATOM 89437 O WAT 9940 125.434 70.196 0.697 1.00 0.00 O ATOM 89438 H1 WAT 9940 125.513 70.626 -0.155 1.00 0.00 H ATOM 89439 H2 WAT 9940 125.994 69.423 0.628 1.00 0.00 H TER 89441 WAT 9940 ATOM 89441 O WAT 9941 87.254 59.958 118.819 1.00 0.00 O ATOM 89442 H1 WAT 9941 87.852 59.210 118.804 1.00 0.00 H ATOM 89443 H2 WAT 9941 86.929 60.024 117.921 1.00 0.00 H TER 89445 WAT 9941 ATOM 89445 O WAT 9942 7.455 48.598 97.040 1.00 0.00 O ATOM 89446 H1 WAT 9942 7.021 49.212 96.448 1.00 0.00 H ATOM 89447 H2 WAT 9942 8.347 48.528 96.700 1.00 0.00 H TER 89449 WAT 9942 ATOM 89449 O WAT 9943 40.888 113.705 125.803 1.00 0.00 O ATOM 89450 H1 WAT 9943 40.448 113.313 126.557 1.00 0.00 H ATOM 89451 H2 WAT 9943 40.301 114.406 125.520 1.00 0.00 H TER 89453 WAT 9943 ATOM 89453 O WAT 9944 72.164 84.753 84.399 1.00 0.00 O ATOM 89454 H1 WAT 9944 72.390 83.836 84.248 1.00 0.00 H ATOM 89455 H2 WAT 9944 72.911 85.107 84.882 1.00 0.00 H TER 89457 WAT 9944 ATOM 89457 O WAT 9945 1.055 124.023 87.666 1.00 0.00 O ATOM 89458 H1 WAT 9945 0.108 123.980 87.798 1.00 0.00 H ATOM 89459 H2 WAT 9945 1.175 123.835 86.735 1.00 0.00 H TER 89461 WAT 9945 ATOM 89461 O WAT 9946 111.933 73.206 81.957 1.00 0.00 O ATOM 89462 H1 WAT 9946 112.339 72.501 81.452 1.00 0.00 H ATOM 89463 H2 WAT 9946 111.562 72.769 82.724 1.00 0.00 H TER 89465 WAT 9946 ATOM 89465 O WAT 9947 91.103 118.519 118.366 1.00 0.00 O ATOM 89466 H1 WAT 9947 90.993 119.253 118.969 1.00 0.00 H ATOM 89467 H2 WAT 9947 92.051 118.416 118.284 1.00 0.00 H TER 89469 WAT 9947 ATOM 89469 O WAT 9948 44.568 20.709 91.947 1.00 0.00 O ATOM 89470 H1 WAT 9948 44.397 20.286 92.789 1.00 0.00 H ATOM 89471 H2 WAT 9948 44.088 21.535 91.993 1.00 0.00 H TER 89473 WAT 9948 ATOM 89473 O WAT 9949 42.557 6.227 104.325 1.00 0.00 O ATOM 89474 H1 WAT 9949 41.720 6.635 104.102 1.00 0.00 H ATOM 89475 H2 WAT 9949 42.839 5.800 103.516 1.00 0.00 H TER 89477 WAT 9949 ATOM 89477 O WAT 9950 136.286 29.061 142.932 1.00 0.00 O ATOM 89478 H1 WAT 9950 136.873 29.392 143.612 1.00 0.00 H ATOM 89479 H2 WAT 9950 135.786 28.368 143.364 1.00 0.00 H TER 89481 WAT 9950 ATOM 89481 O WAT 9951 92.794 25.042 151.262 1.00 0.00 O ATOM 89482 H1 WAT 9951 92.486 25.423 150.440 1.00 0.00 H ATOM 89483 H2 WAT 9951 92.646 24.102 151.161 1.00 0.00 H TER 89485 WAT 9951 ATOM 89485 O WAT 9952 134.467 38.845 79.335 1.00 0.00 O ATOM 89486 H1 WAT 9952 135.323 38.474 79.122 1.00 0.00 H ATOM 89487 H2 WAT 9952 134.323 39.514 78.665 1.00 0.00 H TER 89489 WAT 9952 ATOM 89489 O WAT 9953 49.916 146.133 135.500 1.00 0.00 O ATOM 89490 H1 WAT 9953 49.530 145.811 136.314 1.00 0.00 H ATOM 89491 H2 WAT 9953 49.968 145.360 134.938 1.00 0.00 H TER 89493 WAT 9953 ATOM 89493 O WAT 9954 104.320 144.755 145.523 1.00 0.00 O ATOM 89494 H1 WAT 9954 105.197 144.919 145.177 1.00 0.00 H ATOM 89495 H2 WAT 9954 104.285 145.259 146.336 1.00 0.00 H TER 89497 WAT 9954 ATOM 89497 O WAT 9955 134.456 103.000 118.763 1.00 0.00 O ATOM 89498 H1 WAT 9955 135.204 103.130 119.346 1.00 0.00 H ATOM 89499 H2 WAT 9955 134.555 102.104 118.441 1.00 0.00 H TER 89501 WAT 9955 ATOM 89501 O WAT 9956 58.204 35.982 90.589 1.00 0.00 O ATOM 89502 H1 WAT 9956 57.471 35.444 90.888 1.00 0.00 H ATOM 89503 H2 WAT 9956 58.003 36.171 89.672 1.00 0.00 H TER 89505 WAT 9956 ATOM 89505 O WAT 9957 52.316 139.551 137.830 1.00 0.00 O ATOM 89506 H1 WAT 9957 53.122 139.361 137.349 1.00 0.00 H ATOM 89507 H2 WAT 9957 51.644 139.037 137.382 1.00 0.00 H TER 89509 WAT 9957 ATOM 89509 O WAT 9958 133.530 57.180 125.569 1.00 0.00 O ATOM 89510 H1 WAT 9958 133.815 58.091 125.492 1.00 0.00 H ATOM 89511 H2 WAT 9958 132.938 57.050 124.829 1.00 0.00 H TER 89513 WAT 9958 ATOM 89513 O WAT 9959 80.037 16.185 101.175 1.00 0.00 O ATOM 89514 H1 WAT 9959 79.462 16.844 101.564 1.00 0.00 H ATOM 89515 H2 WAT 9959 80.006 16.365 100.235 1.00 0.00 H TER 89517 WAT 9959 ATOM 89517 O WAT 9960 143.178 64.598 103.461 1.00 0.00 O ATOM 89518 H1 WAT 9960 143.915 64.044 103.204 1.00 0.00 H ATOM 89519 H2 WAT 9960 143.537 65.177 104.134 1.00 0.00 H TER 89521 WAT 9960 ATOM 89521 O WAT 9961 54.387 134.267 65.429 1.00 0.00 O ATOM 89522 H1 WAT 9961 54.655 134.951 64.815 1.00 0.00 H ATOM 89523 H2 WAT 9961 54.992 133.544 65.261 1.00 0.00 H TER 89525 WAT 9961 ATOM 89525 O WAT 9962 68.701 15.960 84.748 1.00 0.00 O ATOM 89526 H1 WAT 9962 68.978 15.250 85.327 1.00 0.00 H ATOM 89527 H2 WAT 9962 69.499 16.465 84.590 1.00 0.00 H TER 89529 WAT 9962 ATOM 89529 O WAT 9963 50.333 5.967 114.056 1.00 0.00 O ATOM 89530 H1 WAT 9963 49.756 6.028 113.294 1.00 0.00 H ATOM 89531 H2 WAT 9963 50.992 6.646 113.911 1.00 0.00 H TER 89533 WAT 9963 ATOM 89533 O WAT 9964 119.105 2.718 114.281 1.00 0.00 O ATOM 89534 H1 WAT 9964 119.509 3.290 113.628 1.00 0.00 H ATOM 89535 H2 WAT 9964 119.729 2.000 114.390 1.00 0.00 H TER 89537 WAT 9964 ATOM 89537 O WAT 9965 80.310 123.789 127.578 1.00 0.00 O ATOM 89538 H1 WAT 9965 81.226 123.515 127.627 1.00 0.00 H ATOM 89539 H2 WAT 9965 79.868 123.269 128.250 1.00 0.00 H TER 89541 WAT 9965 ATOM 89541 O WAT 9966 139.750 56.978 58.486 1.00 0.00 O ATOM 89542 H1 WAT 9966 139.293 57.631 59.017 1.00 0.00 H ATOM 89543 H2 WAT 9966 140.294 56.499 59.110 1.00 0.00 H TER 89545 WAT 9966 ATOM 89545 O WAT 9967 67.910 140.144 24.753 1.00 0.00 O ATOM 89546 H1 WAT 9967 67.898 140.994 24.313 1.00 0.00 H ATOM 89547 H2 WAT 9967 68.152 140.346 25.657 1.00 0.00 H TER 89549 WAT 9967 ATOM 89549 O WAT 9968 130.868 126.206 103.377 1.00 0.00 O ATOM 89550 H1 WAT 9968 131.683 126.329 102.890 1.00 0.00 H ATOM 89551 H2 WAT 9968 130.988 125.376 103.838 1.00 0.00 H TER 89553 WAT 9968 ATOM 89553 O WAT 9969 32.115 41.222 127.694 1.00 0.00 O ATOM 89554 H1 WAT 9969 32.400 40.498 127.136 1.00 0.00 H ATOM 89555 H2 WAT 9969 31.812 40.799 128.498 1.00 0.00 H TER 89557 WAT 9969 ATOM 89557 O WAT 9970 21.619 28.497 104.876 1.00 0.00 O ATOM 89558 H1 WAT 9970 21.534 27.810 105.536 1.00 0.00 H ATOM 89559 H2 WAT 9970 22.049 28.068 104.137 1.00 0.00 H TER 89561 WAT 9970 ATOM 89561 O WAT 9971 70.217 87.653 87.157 1.00 0.00 O ATOM 89562 H1 WAT 9971 70.766 86.975 87.550 1.00 0.00 H ATOM 89563 H2 WAT 9971 70.733 87.983 86.421 1.00 0.00 H TER 89565 WAT 9971 ATOM 89565 O WAT 9972 46.188 41.718 98.924 1.00 0.00 O ATOM 89566 H1 WAT 9972 45.399 42.106 98.544 1.00 0.00 H ATOM 89567 H2 WAT 9972 45.895 41.347 99.756 1.00 0.00 H TER 89569 WAT 9972 ATOM 89569 O WAT 9973 8.789 73.190 19.990 1.00 0.00 O ATOM 89570 H1 WAT 9973 8.766 73.373 20.929 1.00 0.00 H ATOM 89571 H2 WAT 9973 8.182 73.825 19.608 1.00 0.00 H TER 89573 WAT 9973 ATOM 89573 O WAT 9974 105.900 111.015 4.730 1.00 0.00 O ATOM 89574 H1 WAT 9974 105.221 110.515 4.276 1.00 0.00 H ATOM 89575 H2 WAT 9974 105.416 111.634 5.276 1.00 0.00 H TER 89577 WAT 9974 ATOM 89577 O WAT 9975 94.362 126.402 4.713 1.00 0.00 O ATOM 89578 H1 WAT 9975 95.099 125.801 4.824 1.00 0.00 H ATOM 89579 H2 WAT 9975 94.713 127.115 4.181 1.00 0.00 H TER 89581 WAT 9975 ATOM 89581 O WAT 9976 118.903 111.399 16.611 1.00 0.00 O ATOM 89582 H1 WAT 9976 118.014 111.465 16.264 1.00 0.00 H ATOM 89583 H2 WAT 9976 119.415 111.033 15.889 1.00 0.00 H TER 89585 WAT 9976 ATOM 89585 O WAT 9977 37.732 43.745 110.240 1.00 0.00 O ATOM 89586 H1 WAT 9977 37.253 44.129 109.506 1.00 0.00 H ATOM 89587 H2 WAT 9977 37.074 43.237 110.715 1.00 0.00 H TER 89589 WAT 9977 ATOM 89589 O WAT 9978 88.300 19.167 64.003 1.00 0.00 O ATOM 89590 H1 WAT 9978 88.732 18.600 63.364 1.00 0.00 H ATOM 89591 H2 WAT 9978 88.726 18.960 64.834 1.00 0.00 H TER 89593 WAT 9978 ATOM 89593 O WAT 9979 137.502 97.590 123.804 1.00 0.00 O ATOM 89594 H1 WAT 9979 138.174 98.265 123.706 1.00 0.00 H ATOM 89595 H2 WAT 9979 137.191 97.690 124.704 1.00 0.00 H TER 89597 WAT 9979 ATOM 89597 O WAT 9980 57.930 70.598 70.927 1.00 0.00 O ATOM 89598 H1 WAT 9980 57.568 69.715 70.998 1.00 0.00 H ATOM 89599 H2 WAT 9980 57.343 71.050 70.322 1.00 0.00 H TER 89601 WAT 9980 ATOM 89601 O WAT 9981 95.622 56.964 119.566 1.00 0.00 O ATOM 89602 H1 WAT 9981 95.722 57.289 118.671 1.00 0.00 H ATOM 89603 H2 WAT 9981 94.911 56.325 119.510 1.00 0.00 H TER 89605 WAT 9981 ATOM 89605 O WAT 9982 95.770 40.303 134.743 1.00 0.00 O ATOM 89606 H1 WAT 9982 95.274 40.512 135.534 1.00 0.00 H ATOM 89607 H2 WAT 9982 95.740 39.348 134.686 1.00 0.00 H TER 89609 WAT 9982 ATOM 89609 O WAT 9983 30.785 112.865 106.132 1.00 0.00 O ATOM 89610 H1 WAT 9983 31.076 113.501 105.479 1.00 0.00 H ATOM 89611 H2 WAT 9983 29.919 112.590 105.830 1.00 0.00 H TER 89613 WAT 9983 ATOM 89613 O WAT 9984 123.057 138.465 141.337 1.00 0.00 O ATOM 89614 H1 WAT 9984 123.313 138.787 142.201 1.00 0.00 H ATOM 89615 H2 WAT 9984 123.282 139.177 140.738 1.00 0.00 H TER 89617 WAT 9984 ATOM 89617 O WAT 9985 52.540 36.424 93.700 1.00 0.00 O ATOM 89618 H1 WAT 9985 52.480 35.759 94.385 1.00 0.00 H ATOM 89619 H2 WAT 9985 52.103 36.031 92.944 1.00 0.00 H TER 89621 WAT 9985 ATOM 89621 O WAT 9986 9.016 27.038 70.820 1.00 0.00 O ATOM 89622 H1 WAT 9986 8.751 27.136 71.735 1.00 0.00 H ATOM 89623 H2 WAT 9986 8.652 26.194 70.555 1.00 0.00 H TER 89625 WAT 9986 ATOM 89625 O WAT 9987 143.997 79.338 66.725 1.00 0.00 O ATOM 89626 H1 WAT 9987 143.858 80.253 66.479 1.00 0.00 H ATOM 89627 H2 WAT 9987 143.464 78.840 66.106 1.00 0.00 H TER 89629 WAT 9987 ATOM 89629 O WAT 9988 113.185 103.673 18.566 1.00 0.00 O ATOM 89630 H1 WAT 9988 113.459 103.187 17.788 1.00 0.00 H ATOM 89631 H2 WAT 9988 112.232 103.725 18.492 1.00 0.00 H TER 89633 WAT 9988 ATOM 89633 O WAT 9989 44.999 37.827 113.713 1.00 0.00 O ATOM 89634 H1 WAT 9989 44.369 38.158 113.073 1.00 0.00 H ATOM 89635 H2 WAT 9989 45.007 36.880 113.574 1.00 0.00 H TER 89637 WAT 9989 ATOM 89637 O WAT 9990 132.636 145.028 59.516 1.00 0.00 O ATOM 89638 H1 WAT 9990 131.770 145.432 59.574 1.00 0.00 H ATOM 89639 H2 WAT 9990 132.489 144.111 59.748 1.00 0.00 H TER 89641 WAT 9990 ATOM 89641 O WAT 9991 39.915 32.300 0.914 1.00 0.00 O ATOM 89642 H1 WAT 9991 40.330 31.507 0.576 1.00 0.00 H ATOM 89643 H2 WAT 9991 40.466 32.563 1.651 1.00 0.00 H TER 89645 WAT 9991 ATOM 89645 O WAT 9992 132.350 62.073 141.094 1.00 0.00 O ATOM 89646 H1 WAT 9992 131.872 62.583 141.748 1.00 0.00 H ATOM 89647 H2 WAT 9992 132.131 62.487 140.260 1.00 0.00 H TER 89649 WAT 9992 ATOM 89649 O WAT 9993 22.908 8.526 13.744 1.00 0.00 O ATOM 89650 H1 WAT 9993 23.394 8.421 14.562 1.00 0.00 H ATOM 89651 H2 WAT 9993 23.272 9.320 13.350 1.00 0.00 H TER 89653 WAT 9993 ATOM 89653 O WAT 9994 134.397 126.137 140.803 1.00 0.00 O ATOM 89654 H1 WAT 9994 134.513 126.596 141.635 1.00 0.00 H ATOM 89655 H2 WAT 9994 133.499 126.339 140.541 1.00 0.00 H TER 89657 WAT 9994 ATOM 89657 O WAT 9995 29.637 62.405 147.885 1.00 0.00 O ATOM 89658 H1 WAT 9995 29.390 61.498 148.063 1.00 0.00 H ATOM 89659 H2 WAT 9995 30.536 62.350 147.563 1.00 0.00 H TER 89661 WAT 9995 ATOM 89661 O WAT 9996 52.260 42.043 146.473 1.00 0.00 O ATOM 89662 H1 WAT 9996 52.039 42.950 146.258 1.00 0.00 H ATOM 89663 H2 WAT 9996 53.209 42.051 146.595 1.00 0.00 H TER 89665 WAT 9996 ATOM 89665 O WAT 9997 127.881 117.986 71.014 1.00 0.00 O ATOM 89666 H1 WAT 9997 128.153 117.429 71.743 1.00 0.00 H ATOM 89667 H2 WAT 9997 126.945 117.811 70.915 1.00 0.00 H TER 89669 WAT 9997 ATOM 89669 O WAT 9998 96.527 104.493 135.476 1.00 0.00 O ATOM 89670 H1 WAT 9998 97.365 104.319 135.047 1.00 0.00 H ATOM 89671 H2 WAT 9998 96.657 104.207 136.380 1.00 0.00 H TER 89673 WAT 9998 ATOM 89673 O WAT 9999 131.688 100.165 16.731 1.00 0.00 O ATOM 89674 H1 WAT 9999 132.180 99.585 17.312 1.00 0.00 H ATOM 89675 H2 WAT 9999 132.307 100.390 16.036 1.00 0.00 H TER 89677 WAT 9999 ATOM 89677 O WAT 0 16.476 13.795 123.447 1.00 0.00 O ATOM 89678 H1 WAT 0 17.234 13.740 124.029 1.00 0.00 H ATOM 89679 H2 WAT 0 15.814 14.257 123.960 1.00 0.00 H TER 89681 WAT 0 ATOM 89681 O WAT 1 143.241 33.427 71.090 1.00 0.00 O ATOM 89682 H1 WAT 1 142.347 33.464 70.749 1.00 0.00 H ATOM 89683 H2 WAT 1 143.549 32.551 70.859 1.00 0.00 H TER 89685 WAT 1 ATOM 89685 O WAT 2 141.382 143.190 145.415 1.00 0.00 O ATOM 89686 H1 WAT 2 140.901 143.550 146.161 1.00 0.00 H ATOM 89687 H2 WAT 2 141.330 142.241 145.532 1.00 0.00 H TER 89689 WAT 2 ATOM 89689 O WAT 3 125.021 25.902 155.848 1.00 0.00 O ATOM 89690 H1 WAT 3 124.186 25.907 156.316 1.00 0.00 H ATOM 89691 H2 WAT 3 125.534 26.594 156.266 1.00 0.00 H TER 89693 WAT 3 ATOM 89693 O WAT 4 23.565 70.785 93.335 1.00 0.00 O ATOM 89694 H1 WAT 4 23.365 70.465 92.456 1.00 0.00 H ATOM 89695 H2 WAT 4 23.572 71.738 93.248 1.00 0.00 H TER 89697 WAT 4 ATOM 89697 O WAT 5 140.061 118.385 110.975 1.00 0.00 O ATOM 89698 H1 WAT 5 139.529 118.524 111.759 1.00 0.00 H ATOM 89699 H2 WAT 5 140.961 118.522 111.269 1.00 0.00 H TER 89701 WAT 5 ATOM 89701 O WAT 6 125.307 41.437 119.365 1.00 0.00 O ATOM 89702 H1 WAT 6 125.759 40.597 119.443 1.00 0.00 H ATOM 89703 H2 WAT 6 125.702 41.852 118.598 1.00 0.00 H TER 89705 WAT 6 ATOM 89705 O WAT 7 87.390 114.379 19.208 1.00 0.00 O ATOM 89706 H1 WAT 7 88.341 114.469 19.264 1.00 0.00 H ATOM 89707 H2 WAT 7 87.125 114.094 20.082 1.00 0.00 H TER 89709 WAT 7 ATOM 89709 O WAT 8 15.736 30.041 30.768 1.00 0.00 O ATOM 89710 H1 WAT 8 16.167 29.231 30.495 1.00 0.00 H ATOM 89711 H2 WAT 8 15.074 30.199 30.094 1.00 0.00 H TER 89713 WAT 8 ATOM 89713 O WAT 9 137.924 103.113 91.068 1.00 0.00 O ATOM 89714 H1 WAT 9 137.586 102.603 90.332 1.00 0.00 H ATOM 89715 H2 WAT 9 138.859 102.910 91.090 1.00 0.00 H TER 89717 WAT 9 ATOM 89717 O WAT 10 19.118 120.519 4.526 1.00 0.00 O ATOM 89718 H1 WAT 10 19.891 120.300 4.005 1.00 0.00 H ATOM 89719 H2 WAT 10 18.789 119.674 4.833 1.00 0.00 H TER 89721 WAT 10 ATOM 89721 O WAT 11 132.564 29.016 142.370 1.00 0.00 O ATOM 89722 H1 WAT 11 133.319 29.603 142.391 1.00 0.00 H ATOM 89723 H2 WAT 11 131.809 29.599 142.289 1.00 0.00 H TER 89725 WAT 11 ATOM 89725 O WAT 12 104.559 43.302 149.500 1.00 0.00 O ATOM 89726 H1 WAT 12 103.682 43.422 149.864 1.00 0.00 H ATOM 89727 H2 WAT 12 105.038 42.829 150.181 1.00 0.00 H TER 89729 WAT 12 ATOM 89729 O WAT 13 143.832 115.102 153.420 1.00 0.00 O ATOM 89730 H1 WAT 13 144.647 115.224 152.933 1.00 0.00 H ATOM 89731 H2 WAT 13 143.937 115.644 154.202 1.00 0.00 H TER 89733 WAT 13 ATOM 89733 O WAT 14 31.053 75.918 154.533 1.00 0.00 O ATOM 89734 H1 WAT 14 30.569 76.521 155.098 1.00 0.00 H ATOM 89735 H2 WAT 14 30.381 75.508 153.989 1.00 0.00 H TER 89737 WAT 14 ATOM 89737 O WAT 15 125.484 79.954 97.304 1.00 0.00 O ATOM 89738 H1 WAT 15 125.386 79.414 96.519 1.00 0.00 H ATOM 89739 H2 WAT 15 126.377 80.295 97.250 1.00 0.00 H TER 89741 WAT 15 ATOM 89741 O WAT 16 41.206 5.817 88.980 1.00 0.00 O ATOM 89742 H1 WAT 16 40.524 5.146 88.947 1.00 0.00 H ATOM 89743 H2 WAT 16 41.661 5.739 88.142 1.00 0.00 H TER 89745 WAT 16 ATOM 89745 O WAT 17 0.436 104.626 123.350 1.00 0.00 O ATOM 89746 H1 WAT 17 0.601 104.600 124.292 1.00 0.00 H ATOM 89747 H2 WAT 17 0.259 105.548 123.163 1.00 0.00 H TER 89749 WAT 17 ATOM 89749 O WAT 18 50.433 106.811 77.557 1.00 0.00 O ATOM 89750 H1 WAT 18 51.173 106.311 77.212 1.00 0.00 H ATOM 89751 H2 WAT 18 49.889 106.994 76.791 1.00 0.00 H TER 89753 WAT 18 ATOM 89753 O WAT 19 47.513 30.519 57.765 1.00 0.00 O ATOM 89754 H1 WAT 19 47.960 30.496 56.919 1.00 0.00 H ATOM 89755 H2 WAT 19 48.173 30.848 58.376 1.00 0.00 H TER 89757 WAT 19 ATOM 89757 O WAT 20 11.703 127.143 4.346 1.00 0.00 O ATOM 89758 H1 WAT 20 11.485 126.688 3.533 1.00 0.00 H ATOM 89759 H2 WAT 20 11.741 126.450 5.006 1.00 0.00 H TER 89761 WAT 20 ATOM 89761 O WAT 21 94.692 117.804 120.408 1.00 0.00 O ATOM 89762 H1 WAT 21 94.418 117.551 119.527 1.00 0.00 H ATOM 89763 H2 WAT 21 93.930 118.249 120.778 1.00 0.00 H TER 89765 WAT 21 ATOM 89765 O WAT 22 95.913 94.080 95.032 1.00 0.00 O ATOM 89766 H1 WAT 22 96.867 94.046 95.101 1.00 0.00 H ATOM 89767 H2 WAT 22 95.600 93.589 95.791 1.00 0.00 H TER 89769 WAT 22 ATOM 89769 O WAT 23 97.430 106.917 60.908 1.00 0.00 O ATOM 89770 H1 WAT 23 97.132 106.448 60.128 1.00 0.00 H ATOM 89771 H2 WAT 23 96.694 106.862 61.517 1.00 0.00 H TER 89773 WAT 23 ATOM 89773 O WAT 24 110.819 14.786 115.272 1.00 0.00 O ATOM 89774 H1 WAT 24 110.621 14.124 115.934 1.00 0.00 H ATOM 89775 H2 WAT 24 109.962 15.075 114.959 1.00 0.00 H TER 89777 WAT 24 ATOM 89777 O WAT 25 14.361 5.354 96.524 1.00 0.00 O ATOM 89778 H1 WAT 25 15.265 5.504 96.249 1.00 0.00 H ATOM 89779 H2 WAT 25 14.356 5.566 97.458 1.00 0.00 H TER 89781 WAT 25 ATOM 89781 O WAT 26 86.719 19.856 78.446 1.00 0.00 O ATOM 89782 H1 WAT 26 87.397 20.278 77.917 1.00 0.00 H ATOM 89783 H2 WAT 26 86.993 20.006 79.351 1.00 0.00 H TER 89785 WAT 26 ATOM 89785 O WAT 27 65.811 53.828 63.665 1.00 0.00 O ATOM 89786 H1 WAT 27 66.238 53.037 63.993 1.00 0.00 H ATOM 89787 H2 WAT 27 64.954 53.529 63.361 1.00 0.00 H TER 89789 WAT 27 ATOM 89789 O WAT 28 10.818 64.559 67.224 1.00 0.00 O ATOM 89790 H1 WAT 28 11.281 63.902 67.743 1.00 0.00 H ATOM 89791 H2 WAT 28 10.973 65.383 67.687 1.00 0.00 H TER 89793 WAT 28 ATOM 89793 O WAT 29 27.468 23.798 6.811 1.00 0.00 O ATOM 89794 H1 WAT 29 27.556 23.066 6.202 1.00 0.00 H ATOM 89795 H2 WAT 29 26.795 24.356 6.420 1.00 0.00 H TER 89797 WAT 29 ATOM 89797 O WAT 30 131.631 106.758 66.469 1.00 0.00 O ATOM 89798 H1 WAT 30 132.218 106.047 66.208 1.00 0.00 H ATOM 89799 H2 WAT 30 132.124 107.556 66.280 1.00 0.00 H TER 89801 WAT 30 ATOM 89801 O WAT 31 16.037 11.991 21.257 1.00 0.00 O ATOM 89802 H1 WAT 31 15.231 12.501 21.177 1.00 0.00 H ATOM 89803 H2 WAT 31 15.892 11.431 22.019 1.00 0.00 H TER 89805 WAT 31 ATOM 89805 O WAT 32 51.750 81.344 72.021 1.00 0.00 O ATOM 89806 H1 WAT 32 52.120 80.717 72.642 1.00 0.00 H ATOM 89807 H2 WAT 32 52.511 81.786 71.644 1.00 0.00 H TER 89809 WAT 32 ATOM 89809 O WAT 33 91.775 45.247 82.414 1.00 0.00 O ATOM 89810 H1 WAT 33 92.320 45.675 83.074 1.00 0.00 H ATOM 89811 H2 WAT 33 92.356 44.610 81.999 1.00 0.00 H TER 89813 WAT 33 ATOM 89813 O WAT 34 100.570 15.015 8.865 1.00 0.00 O ATOM 89814 H1 WAT 34 99.742 15.208 8.426 1.00 0.00 H ATOM 89815 H2 WAT 34 101.159 14.749 8.158 1.00 0.00 H TER 89817 WAT 34 ATOM 89817 O WAT 35 71.960 62.102 94.149 1.00 0.00 O ATOM 89818 H1 WAT 35 72.406 62.938 94.285 1.00 0.00 H ATOM 89819 H2 WAT 35 71.816 62.058 93.204 1.00 0.00 H TER 89821 WAT 35 ATOM 89821 O WAT 36 91.707 15.014 108.902 1.00 0.00 O ATOM 89822 H1 WAT 36 91.515 15.558 109.665 1.00 0.00 H ATOM 89823 H2 WAT 36 91.887 14.147 109.265 1.00 0.00 H TER 89825 WAT 36 ATOM 89825 O WAT 37 73.626 73.969 133.562 1.00 0.00 O ATOM 89826 H1 WAT 37 73.913 73.935 132.649 1.00 0.00 H ATOM 89827 H2 WAT 37 74.093 74.718 133.932 1.00 0.00 H TER 89829 WAT 37 ATOM 89829 O WAT 38 137.915 90.599 14.084 1.00 0.00 O ATOM 89830 H1 WAT 38 138.046 89.949 13.393 1.00 0.00 H ATOM 89831 H2 WAT 38 136.974 90.772 14.074 1.00 0.00 H TER 89833 WAT 38 ATOM 89833 O WAT 39 58.843 107.206 56.883 1.00 0.00 O ATOM 89834 H1 WAT 39 59.254 106.347 56.790 1.00 0.00 H ATOM 89835 H2 WAT 39 59.154 107.530 57.729 1.00 0.00 H TER 89837 WAT 39 ATOM 89837 O WAT 40 41.907 96.242 143.538 1.00 0.00 O ATOM 89838 H1 WAT 40 42.295 95.493 143.084 1.00 0.00 H ATOM 89839 H2 WAT 40 41.269 95.854 144.137 1.00 0.00 H TER 89841 WAT 40 ATOM 89841 O WAT 41 128.644 64.178 119.701 1.00 0.00 O ATOM 89842 H1 WAT 41 127.713 64.347 119.839 1.00 0.00 H ATOM 89843 H2 WAT 41 129.088 64.901 120.145 1.00 0.00 H TER 89845 WAT 41 ATOM 89845 O WAT 42 134.742 113.647 140.102 1.00 0.00 O ATOM 89846 H1 WAT 42 134.168 114.404 139.983 1.00 0.00 H ATOM 89847 H2 WAT 42 134.168 112.891 139.984 1.00 0.00 H TER 89849 WAT 42 ATOM 89849 O WAT 43 49.726 62.924 110.515 1.00 0.00 O ATOM 89850 H1 WAT 43 49.421 63.768 110.850 1.00 0.00 H ATOM 89851 H2 WAT 43 50.038 63.117 109.631 1.00 0.00 H TER 89853 WAT 43 ATOM 89853 O WAT 44 60.166 76.546 114.203 1.00 0.00 O ATOM 89854 H1 WAT 44 59.645 76.863 113.465 1.00 0.00 H ATOM 89855 H2 WAT 44 60.263 75.607 114.042 1.00 0.00 H TER 89857 WAT 44 ATOM 89857 O WAT 45 109.392 80.228 139.932 1.00 0.00 O ATOM 89858 H1 WAT 45 109.339 80.223 140.888 1.00 0.00 H ATOM 89859 H2 WAT 45 109.648 81.124 139.712 1.00 0.00 H TER 89861 WAT 45 ATOM 89861 O WAT 46 20.369 118.779 106.268 1.00 0.00 O ATOM 89862 H1 WAT 46 20.304 117.971 106.778 1.00 0.00 H ATOM 89863 H2 WAT 46 20.228 118.503 105.363 1.00 0.00 H TER 89865 WAT 46 ATOM 89865 O WAT 47 26.539 65.088 97.644 1.00 0.00 O ATOM 89866 H1 WAT 47 26.181 64.950 96.767 1.00 0.00 H ATOM 89867 H2 WAT 47 26.594 66.039 97.734 1.00 0.00 H TER 89869 WAT 47 ATOM 89869 O WAT 48 132.731 141.151 8.799 1.00 0.00 O ATOM 89870 H1 WAT 48 133.204 141.220 7.969 1.00 0.00 H ATOM 89871 H2 WAT 48 131.829 141.385 8.580 1.00 0.00 H TER 89873 WAT 48 ATOM 89873 O WAT 49 143.808 97.379 27.500 1.00 0.00 O ATOM 89874 H1 WAT 49 144.021 96.878 28.287 1.00 0.00 H ATOM 89875 H2 WAT 49 143.392 98.176 27.829 1.00 0.00 H TER 89877 WAT 49 ATOM 89877 O WAT 50 45.756 23.958 92.995 1.00 0.00 O ATOM 89878 H1 WAT 50 46.134 24.697 93.471 1.00 0.00 H ATOM 89879 H2 WAT 50 46.505 23.397 92.791 1.00 0.00 H TER 89881 WAT 50 ATOM 89881 O WAT 51 71.744 38.896 116.579 1.00 0.00 O ATOM 89882 H1 WAT 51 71.022 39.170 116.015 1.00 0.00 H ATOM 89883 H2 WAT 51 71.471 38.045 116.922 1.00 0.00 H TER 89885 WAT 51 ATOM 89885 O WAT 52 113.377 42.709 20.111 1.00 0.00 O ATOM 89886 H1 WAT 52 113.803 42.763 20.967 1.00 0.00 H ATOM 89887 H2 WAT 52 112.868 41.900 20.148 1.00 0.00 H TER 89889 WAT 52 ATOM 89889 O WAT 53 73.810 93.788 145.044 1.00 0.00 O ATOM 89890 H1 WAT 53 73.604 92.980 145.513 1.00 0.00 H ATOM 89891 H2 WAT 53 73.474 93.643 144.159 1.00 0.00 H TER 89893 WAT 53 ATOM 89893 O WAT 54 77.182 89.009 1.589 1.00 0.00 O ATOM 89894 H1 WAT 54 76.336 88.596 1.414 1.00 0.00 H ATOM 89895 H2 WAT 54 76.961 89.891 1.888 1.00 0.00 H TER 89897 WAT 54 ATOM 89897 O WAT 55 116.259 98.187 131.589 1.00 0.00 O ATOM 89898 H1 WAT 55 116.836 98.329 130.839 1.00 0.00 H ATOM 89899 H2 WAT 55 115.469 98.686 131.383 1.00 0.00 H TER 89901 WAT 55 ATOM 89901 O WAT 56 97.110 132.997 78.445 1.00 0.00 O ATOM 89902 H1 WAT 56 98.008 132.774 78.199 1.00 0.00 H ATOM 89903 H2 WAT 56 96.583 132.732 77.691 1.00 0.00 H TER 89905 WAT 56 ATOM 89905 O WAT 57 26.876 101.357 141.898 1.00 0.00 O ATOM 89906 H1 WAT 57 26.493 102.230 141.812 1.00 0.00 H ATOM 89907 H2 WAT 57 26.124 100.777 142.021 1.00 0.00 H TER 89909 WAT 57 ATOM 89909 O WAT 58 121.379 41.024 67.347 1.00 0.00 O ATOM 89910 H1 WAT 58 121.738 41.761 66.854 1.00 0.00 H ATOM 89911 H2 WAT 58 122.145 40.599 67.734 1.00 0.00 H TER 89913 WAT 58 ATOM 89913 O WAT 59 16.447 8.123 115.236 1.00 0.00 O ATOM 89914 H1 WAT 59 16.219 9.025 115.458 1.00 0.00 H ATOM 89915 H2 WAT 59 17.263 7.958 115.710 1.00 0.00 H TER 89917 WAT 59 ATOM 89917 O WAT 60 6.761 128.943 107.807 1.00 0.00 O ATOM 89918 H1 WAT 60 6.189 128.319 108.253 1.00 0.00 H ATOM 89919 H2 WAT 60 6.256 129.756 107.783 1.00 0.00 H TER 89921 WAT 60 ATOM 89921 O WAT 61 17.661 124.169 92.408 1.00 0.00 O ATOM 89922 H1 WAT 61 17.394 123.251 92.351 1.00 0.00 H ATOM 89923 H2 WAT 61 18.472 124.151 92.915 1.00 0.00 H TER 89925 WAT 61 ATOM 89925 O WAT 62 46.997 39.627 97.267 1.00 0.00 O ATOM 89926 H1 WAT 62 47.937 39.688 97.095 1.00 0.00 H ATOM 89927 H2 WAT 62 46.762 40.486 97.617 1.00 0.00 H TER 89929 WAT 62 ATOM 89929 O WAT 63 71.606 21.203 56.909 1.00 0.00 O ATOM 89930 H1 WAT 63 72.167 21.809 56.425 1.00 0.00 H ATOM 89931 H2 WAT 63 71.477 21.623 57.759 1.00 0.00 H TER 89933 WAT 63 ATOM 89933 O WAT 64 59.774 4.900 72.309 1.00 0.00 O ATOM 89934 H1 WAT 64 60.723 4.833 72.205 1.00 0.00 H ATOM 89935 H2 WAT 64 59.557 4.238 72.965 1.00 0.00 H TER 89937 WAT 64 ATOM 89937 O WAT 65 109.454 18.300 10.134 1.00 0.00 O ATOM 89938 H1 WAT 65 109.614 18.825 9.350 1.00 0.00 H ATOM 89939 H2 WAT 65 108.512 18.377 10.286 1.00 0.00 H TER 89941 WAT 65 ATOM 89941 O WAT 66 56.010 66.459 116.253 1.00 0.00 O ATOM 89942 H1 WAT 66 56.175 65.576 115.922 1.00 0.00 H ATOM 89943 H2 WAT 66 56.828 66.711 116.681 1.00 0.00 H TER 89945 WAT 66 ATOM 89945 O WAT 67 65.262 134.071 88.674 1.00 0.00 O ATOM 89946 H1 WAT 67 64.348 133.786 88.677 1.00 0.00 H ATOM 89947 H2 WAT 67 65.705 133.462 89.264 1.00 0.00 H TER 89949 WAT 67 ATOM 89949 O WAT 68 118.954 56.436 101.934 1.00 0.00 O ATOM 89950 H1 WAT 68 119.354 55.588 102.128 1.00 0.00 H ATOM 89951 H2 WAT 68 119.688 57.050 101.924 1.00 0.00 H TER 89953 WAT 68 ATOM 89953 O WAT 69 6.726 6.625 132.274 1.00 0.00 O ATOM 89954 H1 WAT 69 6.702 7.295 131.591 1.00 0.00 H ATOM 89955 H2 WAT 69 6.648 7.115 133.093 1.00 0.00 H TER 89957 WAT 69 ATOM 89957 O WAT 70 9.009 106.754 74.530 1.00 0.00 O ATOM 89958 H1 WAT 70 9.552 107.423 74.113 1.00 0.00 H ATOM 89959 H2 WAT 70 9.631 106.206 75.010 1.00 0.00 H TER 89961 WAT 70 ATOM 89961 O WAT 71 129.340 143.444 95.067 1.00 0.00 O ATOM 89962 H1 WAT 71 129.195 142.734 95.693 1.00 0.00 H ATOM 89963 H2 WAT 71 128.900 143.153 94.268 1.00 0.00 H TER 89965 WAT 71 ATOM 89965 O WAT 72 101.888 106.343 157.158 1.00 0.00 O ATOM 89966 H1 WAT 72 101.013 106.418 156.777 1.00 0.00 H ATOM 89967 H2 WAT 72 102.469 106.234 156.405 1.00 0.00 H TER 89969 WAT 72 ATOM 89969 O WAT 73 32.491 53.265 115.463 1.00 0.00 O ATOM 89970 H1 WAT 73 32.848 52.782 114.717 1.00 0.00 H ATOM 89971 H2 WAT 73 32.773 52.766 116.229 1.00 0.00 H TER 89973 WAT 73 ATOM 89973 O WAT 74 57.967 21.058 85.076 1.00 0.00 O ATOM 89974 H1 WAT 74 57.385 21.744 85.404 1.00 0.00 H ATOM 89975 H2 WAT 74 58.513 21.499 84.424 1.00 0.00 H TER 89977 WAT 74 ATOM 89977 O WAT 75 94.949 23.787 86.168 1.00 0.00 O ATOM 89978 H1 WAT 75 94.377 24.052 86.887 1.00 0.00 H ATOM 89979 H2 WAT 75 94.827 24.464 85.503 1.00 0.00 H TER 89981 WAT 75 ATOM 89981 O WAT 76 40.591 84.859 61.621 1.00 0.00 O ATOM 89982 H1 WAT 76 40.178 84.161 62.130 1.00 0.00 H ATOM 89983 H2 WAT 76 41.361 85.105 62.134 1.00 0.00 H TER 89985 WAT 76 ATOM 89985 O WAT 77 103.870 4.221 153.290 1.00 0.00 O ATOM 89986 H1 WAT 77 103.119 3.921 152.778 1.00 0.00 H ATOM 89987 H2 WAT 77 104.372 4.765 152.682 1.00 0.00 H TER 89989 WAT 77 ATOM 89989 O WAT 78 83.626 76.811 127.944 1.00 0.00 O ATOM 89990 H1 WAT 78 84.164 77.421 128.448 1.00 0.00 H ATOM 89991 H2 WAT 78 84.218 76.467 127.275 1.00 0.00 H TER 89993 WAT 78 ATOM 89993 O WAT 79 15.729 15.607 126.968 1.00 0.00 O ATOM 89994 H1 WAT 79 16.142 15.793 127.811 1.00 0.00 H ATOM 89995 H2 WAT 79 15.480 14.684 127.022 1.00 0.00 H TER 89997 WAT 79 ATOM 89997 O WAT 80 41.305 42.621 145.349 1.00 0.00 O ATOM 89998 H1 WAT 80 40.934 43.480 145.551 1.00 0.00 H ATOM 89999 H2 WAT 80 42.173 42.635 145.752 1.00 0.00 H TER 90001 WAT 80 ATOM 90001 O WAT 81 65.172 143.424 121.236 1.00 0.00 O ATOM 90002 H1 WAT 81 65.416 143.031 120.398 1.00 0.00 H ATOM 90003 H2 WAT 81 65.263 144.366 121.095 1.00 0.00 H TER 90005 WAT 81 ATOM 90005 O WAT 82 9.656 48.916 129.115 1.00 0.00 O ATOM 90006 H1 WAT 82 9.368 48.075 129.471 1.00 0.00 H ATOM 90007 H2 WAT 82 9.040 49.099 128.405 1.00 0.00 H TER 90009 WAT 82 ATOM 90009 O WAT 83 27.638 97.633 90.390 1.00 0.00 O ATOM 90010 H1 WAT 83 27.369 97.547 89.475 1.00 0.00 H ATOM 90011 H2 WAT 83 28.550 97.922 90.345 1.00 0.00 H TER 90013 WAT 83 ATOM 90013 O WAT 84 93.959 13.682 118.979 1.00 0.00 O ATOM 90014 H1 WAT 84 93.800 12.883 118.477 1.00 0.00 H ATOM 90015 H2 WAT 84 94.178 14.340 118.318 1.00 0.00 H TER 90017 WAT 84 ATOM 90017 O WAT 85 25.888 1.539 134.195 1.00 0.00 O ATOM 90018 H1 WAT 85 25.612 0.716 133.791 1.00 0.00 H ATOM 90019 H2 WAT 85 26.452 1.949 133.540 1.00 0.00 H TER 90021 WAT 85 ATOM 90021 O WAT 86 80.362 118.997 1.838 1.00 0.00 O ATOM 90022 H1 WAT 86 80.358 118.668 2.737 1.00 0.00 H ATOM 90023 H2 WAT 86 80.497 119.940 1.929 1.00 0.00 H TER 90025 WAT 86 ATOM 90025 O WAT 87 53.093 27.453 10.783 1.00 0.00 O ATOM 90026 H1 WAT 87 52.429 28.016 10.384 1.00 0.00 H ATOM 90027 H2 WAT 87 53.852 28.023 10.899 1.00 0.00 H TER 90029 WAT 87 ATOM 90029 O WAT 88 38.851 139.607 139.702 1.00 0.00 O ATOM 90030 H1 WAT 88 39.487 139.812 140.388 1.00 0.00 H ATOM 90031 H2 WAT 88 38.280 140.375 139.669 1.00 0.00 H TER 90033 WAT 88 ATOM 90033 O WAT 89 0.328 131.230 96.264 1.00 0.00 O ATOM 90034 H1 WAT 89 -0.265 131.439 95.543 1.00 0.00 H ATOM 90035 H2 WAT 89 0.848 132.024 96.384 1.00 0.00 H TER 90037 WAT 89 ATOM 90037 O WAT 90 124.807 90.410 80.907 1.00 0.00 O ATOM 90038 H1 WAT 90 124.769 90.992 80.148 1.00 0.00 H ATOM 90039 H2 WAT 90 124.974 89.544 80.535 1.00 0.00 H TER 90041 WAT 90 ATOM 90041 O WAT 91 136.766 17.373 115.703 1.00 0.00 O ATOM 90042 H1 WAT 91 135.985 16.826 115.625 1.00 0.00 H ATOM 90043 H2 WAT 91 137.355 17.049 115.022 1.00 0.00 H TER 90045 WAT 91 ATOM 90045 O WAT 92 53.949 69.807 107.445 1.00 0.00 O ATOM 90046 H1 WAT 92 53.059 69.749 107.098 1.00 0.00 H ATOM 90047 H2 WAT 92 54.507 69.516 106.724 1.00 0.00 H TER 90049 WAT 92 ATOM 90049 O WAT 93 97.063 13.296 84.303 1.00 0.00 O ATOM 90050 H1 WAT 93 97.429 14.175 84.399 1.00 0.00 H ATOM 90051 H2 WAT 93 97.736 12.807 83.830 1.00 0.00 H TER 90053 WAT 93 ATOM 90053 O WAT 94 22.426 18.135 19.884 1.00 0.00 O ATOM 90054 H1 WAT 94 22.046 18.647 19.170 1.00 0.00 H ATOM 90055 H2 WAT 94 23.040 18.734 20.309 1.00 0.00 H TER 90057 WAT 94 ATOM 90057 O WAT 95 83.381 45.144 145.496 1.00 0.00 O ATOM 90058 H1 WAT 95 84.274 44.972 145.795 1.00 0.00 H ATOM 90059 H2 WAT 95 83.427 45.061 144.543 1.00 0.00 H TER 90061 WAT 95 ATOM 90061 O WAT 96 3.626 23.837 115.130 1.00 0.00 O ATOM 90062 H1 WAT 96 3.306 23.960 114.236 1.00 0.00 H ATOM 90063 H2 WAT 96 2.842 23.899 115.676 1.00 0.00 H TER 90065 WAT 96 ATOM 90065 O WAT 97 24.905 82.560 81.976 1.00 0.00 O ATOM 90066 H1 WAT 97 24.597 83.429 82.232 1.00 0.00 H ATOM 90067 H2 WAT 97 24.678 81.997 82.716 1.00 0.00 H TER 90069 WAT 97 ATOM 90069 O WAT 98 102.255 64.119 2.199 1.00 0.00 O ATOM 90070 H1 WAT 98 103.122 63.729 2.085 1.00 0.00 H ATOM 90071 H2 WAT 98 101.838 63.583 2.873 1.00 0.00 H TER 90073 WAT 98 ATOM 90073 O WAT 99 50.930 2.435 133.459 1.00 0.00 O ATOM 90074 H1 WAT 99 50.797 1.557 133.103 1.00 0.00 H ATOM 90075 H2 WAT 99 51.843 2.442 133.745 1.00 0.00 H TER 90077 WAT 99 ATOM 90077 O WAT 100 101.826 17.156 111.733 1.00 0.00 O ATOM 90078 H1 WAT 100 101.265 17.920 111.599 1.00 0.00 H ATOM 90079 H2 WAT 100 101.805 17.006 112.678 1.00 0.00 H TER 90081 WAT 100 ATOM 90081 O WAT 101 101.928 24.483 76.558 1.00 0.00 O ATOM 90082 H1 WAT 101 101.554 25.271 76.951 1.00 0.00 H ATOM 90083 H2 WAT 101 102.206 24.760 75.684 1.00 0.00 H TER 90085 WAT 101 ATOM 90085 O WAT 102 40.182 128.459 120.397 1.00 0.00 O ATOM 90086 H1 WAT 102 40.907 128.838 120.893 1.00 0.00 H ATOM 90087 H2 WAT 102 39.658 127.998 121.053 1.00 0.00 H TER 90089 WAT 102 ATOM 90089 O WAT 103 3.546 34.043 86.537 1.00 0.00 O ATOM 90090 H1 WAT 103 4.458 34.235 86.323 1.00 0.00 H ATOM 90091 H2 WAT 103 3.058 34.292 85.752 1.00 0.00 H TER 90093 WAT 103 ATOM 90093 O WAT 104 122.456 96.034 90.673 1.00 0.00 O ATOM 90094 H1 WAT 104 121.913 96.821 90.726 1.00 0.00 H ATOM 90095 H2 WAT 104 123.131 96.164 91.339 1.00 0.00 H TER 90097 WAT 104 ATOM 90097 O WAT 105 126.786 124.977 129.953 1.00 0.00 O ATOM 90098 H1 WAT 105 126.450 125.355 130.766 1.00 0.00 H ATOM 90099 H2 WAT 105 127.480 125.576 129.679 1.00 0.00 H TER 90101 WAT 105 ATOM 90101 O WAT 106 97.036 21.726 128.690 1.00 0.00 O ATOM 90102 H1 WAT 106 96.463 22.488 128.606 1.00 0.00 H ATOM 90103 H2 WAT 106 96.638 21.202 129.385 1.00 0.00 H TER 90105 WAT 106 ATOM 90105 O WAT 107 95.167 10.705 54.040 1.00 0.00 O ATOM 90106 H1 WAT 107 96.099 10.557 54.200 1.00 0.00 H ATOM 90107 H2 WAT 107 95.011 10.329 53.174 1.00 0.00 H TER 90109 WAT 107 ATOM 90109 O WAT 108 102.227 98.820 106.588 1.00 0.00 O ATOM 90110 H1 WAT 108 102.943 98.204 106.431 1.00 0.00 H ATOM 90111 H2 WAT 108 101.923 98.613 107.472 1.00 0.00 H TER 90113 WAT 108 ATOM 90113 O WAT 109 3.477 103.703 51.534 1.00 0.00 O ATOM 90114 H1 WAT 109 4.064 103.360 52.208 1.00 0.00 H ATOM 90115 H2 WAT 109 3.081 104.477 51.933 1.00 0.00 H TER 90117 WAT 109 ATOM 90117 O WAT 110 35.290 128.100 91.084 1.00 0.00 O ATOM 90118 H1 WAT 110 35.410 127.184 91.337 1.00 0.00 H ATOM 90119 H2 WAT 110 35.710 128.599 91.785 1.00 0.00 H TER 90121 WAT 110 ATOM 90121 O WAT 111 17.266 66.964 129.652 1.00 0.00 O ATOM 90122 H1 WAT 111 18.096 67.321 129.335 1.00 0.00 H ATOM 90123 H2 WAT 111 17.513 66.403 130.387 1.00 0.00 H TER 90125 WAT 111 ATOM 90125 O WAT 112 123.411 65.594 107.731 1.00 0.00 O ATOM 90126 H1 WAT 112 123.221 65.905 108.616 1.00 0.00 H ATOM 90127 H2 WAT 112 122.673 65.901 107.206 1.00 0.00 H TER 90129 WAT 112 ATOM 90129 O WAT 113 122.717 46.966 4.514 1.00 0.00 O ATOM 90130 H1 WAT 113 122.145 46.238 4.269 1.00 0.00 H ATOM 90131 H2 WAT 113 122.270 47.744 4.180 1.00 0.00 H TER 90133 WAT 113 ATOM 90133 O WAT 114 92.813 108.385 158.369 1.00 0.00 O ATOM 90134 H1 WAT 114 93.068 109.302 158.472 1.00 0.00 H ATOM 90135 H2 WAT 114 93.108 108.152 157.488 1.00 0.00 H TER 90137 WAT 114 ATOM 90137 O WAT 115 90.514 129.044 101.072 1.00 0.00 O ATOM 90138 H1 WAT 115 90.135 128.173 100.953 1.00 0.00 H ATOM 90139 H2 WAT 115 91.305 129.037 100.532 1.00 0.00 H TER 90141 WAT 115 ATOM 90141 O WAT 116 9.459 133.661 105.687 1.00 0.00 O ATOM 90142 H1 WAT 116 9.959 133.298 104.956 1.00 0.00 H ATOM 90143 H2 WAT 116 8.880 132.949 105.958 1.00 0.00 H TER 90145 WAT 116 ATOM 90145 O WAT 117 65.367 118.463 123.012 1.00 0.00 O ATOM 90146 H1 WAT 117 65.468 118.964 122.203 1.00 0.00 H ATOM 90147 H2 WAT 117 64.928 119.065 123.613 1.00 0.00 H TER 90149 WAT 117 ATOM 90149 O WAT 118 141.502 52.871 69.766 1.00 0.00 O ATOM 90150 H1 WAT 118 142.042 53.485 69.268 1.00 0.00 H ATOM 90151 H2 WAT 118 140.618 53.233 69.713 1.00 0.00 H TER 90153 WAT 118 ATOM 90153 O WAT 119 91.395 128.436 91.337 1.00 0.00 O ATOM 90154 H1 WAT 119 91.983 129.140 91.062 1.00 0.00 H ATOM 90155 H2 WAT 119 90.564 128.875 91.518 1.00 0.00 H TER 90157 WAT 119 ATOM 90157 O WAT 120 127.838 23.220 145.372 1.00 0.00 O ATOM 90158 H1 WAT 120 128.188 23.182 144.482 1.00 0.00 H ATOM 90159 H2 WAT 120 128.126 24.069 145.707 1.00 0.00 H TER 90161 WAT 120 ATOM 90161 O WAT 121 72.834 38.215 150.560 1.00 0.00 O ATOM 90162 H1 WAT 121 73.193 37.526 150.002 1.00 0.00 H ATOM 90163 H2 WAT 121 72.509 37.753 151.332 1.00 0.00 H TER 90165 WAT 121 ATOM 90165 O WAT 122 5.281 136.296 12.573 1.00 0.00 O ATOM 90166 H1 WAT 122 4.477 136.434 12.072 1.00 0.00 H ATOM 90167 H2 WAT 122 5.167 136.827 13.361 1.00 0.00 H TER 90169 WAT 122 ATOM 90169 O WAT 123 49.530 8.624 136.569 1.00 0.00 O ATOM 90170 H1 WAT 123 50.228 8.380 135.962 1.00 0.00 H ATOM 90171 H2 WAT 123 48.795 8.059 136.329 1.00 0.00 H TER 90173 WAT 123 ATOM 90173 O WAT 124 105.967 74.563 7.648 1.00 0.00 O ATOM 90174 H1 WAT 124 105.904 75.146 8.404 1.00 0.00 H ATOM 90175 H2 WAT 124 106.237 75.132 6.928 1.00 0.00 H TER 90177 WAT 124 ATOM 90177 O WAT 125 19.609 99.931 142.525 1.00 0.00 O ATOM 90178 H1 WAT 125 19.769 100.862 142.372 1.00 0.00 H ATOM 90179 H2 WAT 125 20.225 99.692 143.217 1.00 0.00 H TER 90181 WAT 125 ATOM 90181 O WAT 126 26.293 137.038 10.003 1.00 0.00 O ATOM 90182 H1 WAT 126 26.737 136.191 10.026 1.00 0.00 H ATOM 90183 H2 WAT 126 27.000 137.680 10.075 1.00 0.00 H TER 90185 WAT 126 ATOM 90185 O WAT 127 94.968 128.501 3.149 1.00 0.00 O ATOM 90186 H1 WAT 127 95.820 128.931 3.071 1.00 0.00 H ATOM 90187 H2 WAT 127 94.448 129.096 3.689 1.00 0.00 H TER 90189 WAT 127 ATOM 90189 O WAT 128 53.992 49.306 123.742 1.00 0.00 O ATOM 90190 H1 WAT 128 54.808 49.590 124.152 1.00 0.00 H ATOM 90191 H2 WAT 128 53.331 49.910 124.079 1.00 0.00 H TER 90193 WAT 128 ATOM 90193 O WAT 129 17.159 51.890 79.324 1.00 0.00 O ATOM 90194 H1 WAT 129 18.090 51.877 79.548 1.00 0.00 H ATOM 90195 H2 WAT 129 17.143 51.885 78.367 1.00 0.00 H TER 90197 WAT 129 ATOM 90197 O WAT 130 31.442 47.648 126.737 1.00 0.00 O ATOM 90198 H1 WAT 130 30.582 47.405 126.394 1.00 0.00 H ATOM 90199 H2 WAT 130 31.309 47.732 127.681 1.00 0.00 H TER 90201 WAT 130 ATOM 90201 O WAT 131 51.021 12.084 74.817 1.00 0.00 O ATOM 90202 H1 WAT 131 51.581 12.761 75.198 1.00 0.00 H ATOM 90203 H2 WAT 131 50.555 12.529 74.109 1.00 0.00 H TER 90205 WAT 131 ATOM 90205 O WAT 132 127.037 141.131 14.210 1.00 0.00 O ATOM 90206 H1 WAT 132 126.482 141.888 14.396 1.00 0.00 H ATOM 90207 H2 WAT 132 127.790 141.494 13.744 1.00 0.00 H TER 90209 WAT 132 ATOM 90209 O WAT 133 28.473 96.689 117.059 1.00 0.00 O ATOM 90210 H1 WAT 133 29.209 96.112 116.857 1.00 0.00 H ATOM 90211 H2 WAT 133 28.881 97.501 117.359 1.00 0.00 H TER 90213 WAT 133 ATOM 90213 O WAT 134 92.257 128.547 120.808 1.00 0.00 O ATOM 90214 H1 WAT 134 92.714 128.708 119.982 1.00 0.00 H ATOM 90215 H2 WAT 134 91.391 128.235 120.546 1.00 0.00 H TER 90217 WAT 134 ATOM 90217 O WAT 135 103.072 136.550 137.139 1.00 0.00 O ATOM 90218 H1 WAT 135 102.151 136.622 137.392 1.00 0.00 H ATOM 90219 H2 WAT 135 103.543 137.050 137.806 1.00 0.00 H TER 90221 WAT 135 ATOM 90221 O WAT 136 135.530 3.689 19.987 1.00 0.00 O ATOM 90222 H1 WAT 136 136.232 3.666 20.638 1.00 0.00 H ATOM 90223 H2 WAT 136 134.817 3.192 20.388 1.00 0.00 H TER 90225 WAT 136 ATOM 90225 O WAT 137 117.871 132.200 129.422 1.00 0.00 O ATOM 90226 H1 WAT 137 117.024 131.833 129.677 1.00 0.00 H ATOM 90227 H2 WAT 137 118.437 131.437 129.307 1.00 0.00 H TER 90229 WAT 137 ATOM 90229 O WAT 138 38.336 51.736 12.777 1.00 0.00 O ATOM 90230 H1 WAT 138 37.524 51.773 13.282 1.00 0.00 H ATOM 90231 H2 WAT 138 38.931 52.331 13.235 1.00 0.00 H TER 90233 WAT 138 ATOM 90233 O WAT 139 0.801 103.084 126.525 1.00 0.00 O ATOM 90234 H1 WAT 139 0.293 103.769 126.960 1.00 0.00 H ATOM 90235 H2 WAT 139 1.612 103.518 126.260 1.00 0.00 H TER 90237 WAT 139 ATOM 90237 O WAT 140 44.422 56.663 138.181 1.00 0.00 O ATOM 90238 H1 WAT 140 43.637 56.152 137.982 1.00 0.00 H ATOM 90239 H2 WAT 140 44.434 56.721 139.136 1.00 0.00 H TER 90241 WAT 140 ATOM 90241 O WAT 141 57.869 40.054 154.110 1.00 0.00 O ATOM 90242 H1 WAT 141 57.884 39.098 154.147 1.00 0.00 H ATOM 90243 H2 WAT 141 57.695 40.255 153.190 1.00 0.00 H TER 90245 WAT 141 ATOM 90245 O WAT 142 4.969 14.050 77.910 1.00 0.00 O ATOM 90246 H1 WAT 142 5.530 13.794 78.642 1.00 0.00 H ATOM 90247 H2 WAT 142 4.085 13.811 78.191 1.00 0.00 H TER 90249 WAT 142 ATOM 90249 O WAT 143 118.478 39.007 124.326 1.00 0.00 O ATOM 90250 H1 WAT 143 118.695 38.178 123.899 1.00 0.00 H ATOM 90251 H2 WAT 143 117.522 39.009 124.372 1.00 0.00 H TER 90253 WAT 143 ATOM 90253 O WAT 144 68.367 84.647 21.569 1.00 0.00 O ATOM 90254 H1 WAT 144 68.225 84.084 22.330 1.00 0.00 H ATOM 90255 H2 WAT 144 67.588 84.517 21.027 1.00 0.00 H TER 90257 WAT 144 ATOM 90257 O WAT 145 141.308 29.895 126.929 1.00 0.00 O ATOM 90258 H1 WAT 145 140.951 30.124 126.071 1.00 0.00 H ATOM 90259 H2 WAT 145 140.875 29.073 127.157 1.00 0.00 H TER 90261 WAT 145 ATOM 90261 O WAT 146 19.538 31.476 93.711 1.00 0.00 O ATOM 90262 H1 WAT 146 20.205 30.788 93.723 1.00 0.00 H ATOM 90263 H2 WAT 146 20.019 32.279 93.910 1.00 0.00 H TER 90265 WAT 146 ATOM 90265 O WAT 147 94.947 103.962 2.870 1.00 0.00 O ATOM 90266 H1 WAT 147 95.247 104.712 3.384 1.00 0.00 H ATOM 90267 H2 WAT 147 95.655 103.322 2.945 1.00 0.00 H TER 90269 WAT 147 ATOM 90269 O WAT 148 75.842 118.642 149.389 1.00 0.00 O ATOM 90270 H1 WAT 148 75.705 119.551 149.655 1.00 0.00 H ATOM 90271 H2 WAT 148 76.230 118.704 148.516 1.00 0.00 H TER 90273 WAT 148 ATOM 90273 O WAT 149 139.829 52.132 151.707 1.00 0.00 O ATOM 90274 H1 WAT 149 139.350 51.521 152.266 1.00 0.00 H ATOM 90275 H2 WAT 149 139.227 52.867 151.584 1.00 0.00 H TER 90277 WAT 149 ATOM 90277 O WAT 150 73.892 137.864 100.712 1.00 0.00 O ATOM 90278 H1 WAT 150 74.444 137.929 101.492 1.00 0.00 H ATOM 90279 H2 WAT 150 73.936 138.734 100.315 1.00 0.00 H TER 90281 WAT 150 ATOM 90281 O WAT 151 136.596 116.963 149.091 1.00 0.00 O ATOM 90282 H1 WAT 151 135.849 117.141 149.663 1.00 0.00 H ATOM 90283 H2 WAT 151 137.078 116.266 149.536 1.00 0.00 H TER 90285 WAT 151 ATOM 90285 O WAT 152 72.870 24.102 57.630 1.00 0.00 O ATOM 90286 H1 WAT 152 73.128 24.994 57.398 1.00 0.00 H ATOM 90287 H2 WAT 152 72.653 23.690 56.794 1.00 0.00 H TER 90289 WAT 152 ATOM 90289 O WAT 153 59.656 103.581 90.986 1.00 0.00 O ATOM 90290 H1 WAT 153 60.157 103.502 91.798 1.00 0.00 H ATOM 90291 H2 WAT 153 59.578 104.525 90.845 1.00 0.00 H TER 90293 WAT 153 ATOM 90293 O WAT 154 56.979 18.889 113.439 1.00 0.00 O ATOM 90294 H1 WAT 154 57.125 19.257 114.311 1.00 0.00 H ATOM 90295 H2 WAT 154 56.368 18.166 113.584 1.00 0.00 H TER 90297 WAT 154 ATOM 90297 O WAT 155 143.140 34.288 142.952 1.00 0.00 O ATOM 90298 H1 WAT 155 143.030 34.346 143.901 1.00 0.00 H ATOM 90299 H2 WAT 155 142.886 35.153 142.628 1.00 0.00 H TER 90301 WAT 155 ATOM 90301 O WAT 156 22.684 69.535 118.075 1.00 0.00 O ATOM 90302 H1 WAT 156 23.417 70.059 118.399 1.00 0.00 H ATOM 90303 H2 WAT 156 21.986 69.677 118.715 1.00 0.00 H TER 90305 WAT 156 ATOM 90305 O WAT 157 64.281 123.182 107.233 1.00 0.00 O ATOM 90306 H1 WAT 157 64.244 124.114 107.446 1.00 0.00 H ATOM 90307 H2 WAT 157 65.075 123.088 106.707 1.00 0.00 H TER 90309 WAT 157 ATOM 90309 O WAT 158 113.043 92.405 1.769 1.00 0.00 O ATOM 90310 H1 WAT 158 113.362 91.504 1.718 1.00 0.00 H ATOM 90311 H2 WAT 158 113.625 92.830 2.399 1.00 0.00 H TER 90313 WAT 158 ATOM 90313 O WAT 159 51.770 102.824 95.503 1.00 0.00 O ATOM 90314 H1 WAT 159 52.547 103.304 95.218 1.00 0.00 H ATOM 90315 H2 WAT 159 51.554 103.203 96.355 1.00 0.00 H TER 90317 WAT 159 ATOM 90317 O WAT 160 17.961 140.676 89.917 1.00 0.00 O ATOM 90318 H1 WAT 160 18.442 140.219 89.227 1.00 0.00 H ATOM 90319 H2 WAT 160 17.050 140.410 89.790 1.00 0.00 H TER 90321 WAT 160 ATOM 90321 O WAT 161 55.619 89.281 98.714 1.00 0.00 O ATOM 90322 H1 WAT 161 56.535 89.138 98.953 1.00 0.00 H ATOM 90323 H2 WAT 161 55.189 89.506 99.539 1.00 0.00 H TER 90325 WAT 161 ATOM 90325 O WAT 162 38.705 103.688 2.323 1.00 0.00 O ATOM 90326 H1 WAT 162 38.456 103.295 1.487 1.00 0.00 H ATOM 90327 H2 WAT 162 39.623 103.444 2.439 1.00 0.00 H TER 90329 WAT 162 ATOM 90329 O WAT 163 25.331 78.813 15.002 1.00 0.00 O ATOM 90330 H1 WAT 163 24.738 78.452 14.343 1.00 0.00 H ATOM 90331 H2 WAT 163 26.069 79.155 14.497 1.00 0.00 H TER 90333 WAT 163 ATOM 90333 O WAT 164 6.480 121.336 99.374 1.00 0.00 O ATOM 90334 H1 WAT 164 7.045 122.108 99.412 1.00 0.00 H ATOM 90335 H2 WAT 164 6.923 120.688 99.921 1.00 0.00 H TER 90337 WAT 164 ATOM 90337 O WAT 165 90.153 42.657 134.563 1.00 0.00 O ATOM 90338 H1 WAT 165 90.484 43.177 135.295 1.00 0.00 H ATOM 90339 H2 WAT 165 90.261 41.749 134.846 1.00 0.00 H TER 90341 WAT 165 ATOM 90341 O WAT 166 45.173 142.780 142.415 1.00 0.00 O ATOM 90342 H1 WAT 166 44.932 142.988 143.318 1.00 0.00 H ATOM 90343 H2 WAT 166 45.101 141.827 142.361 1.00 0.00 H TER 90345 WAT 166 ATOM 90345 O WAT 167 127.707 36.686 147.221 1.00 0.00 O ATOM 90346 H1 WAT 167 127.306 36.369 146.411 1.00 0.00 H ATOM 90347 H2 WAT 167 127.092 36.432 147.909 1.00 0.00 H TER 90349 WAT 167 ATOM 90349 O WAT 168 80.184 119.440 96.214 1.00 0.00 O ATOM 90350 H1 WAT 168 79.628 120.217 96.159 1.00 0.00 H ATOM 90351 H2 WAT 168 79.582 118.706 96.094 1.00 0.00 H TER 90353 WAT 168 ATOM 90353 O WAT 169 40.439 112.087 14.750 1.00 0.00 O ATOM 90354 H1 WAT 169 39.774 112.245 15.419 1.00 0.00 H ATOM 90355 H2 WAT 169 40.853 112.940 14.617 1.00 0.00 H TER 90357 WAT 169 ATOM 90357 O WAT 170 70.496 113.900 125.619 1.00 0.00 O ATOM 90358 H1 WAT 170 69.570 113.662 125.661 1.00 0.00 H ATOM 90359 H2 WAT 170 70.924 113.133 125.239 1.00 0.00 H TER 90361 WAT 170 ATOM 90361 O WAT 171 48.577 145.439 120.467 1.00 0.00 O ATOM 90362 H1 WAT 171 49.041 145.523 119.634 1.00 0.00 H ATOM 90363 H2 WAT 171 48.903 146.166 120.998 1.00 0.00 H TER 90365 WAT 171 ATOM 90365 O WAT 172 81.975 118.282 155.967 1.00 0.00 O ATOM 90366 H1 WAT 172 81.080 118.020 155.750 1.00 0.00 H ATOM 90367 H2 WAT 172 81.931 118.547 156.886 1.00 0.00 H TER 90369 WAT 172 ATOM 90369 O WAT 173 29.342 40.958 27.140 1.00 0.00 O ATOM 90370 H1 WAT 173 29.986 40.590 26.535 1.00 0.00 H ATOM 90371 H2 WAT 173 28.953 40.196 27.569 1.00 0.00 H TER 90373 WAT 173 ATOM 90373 O WAT 174 33.394 84.163 111.905 1.00 0.00 O ATOM 90374 H1 WAT 174 33.129 83.827 111.049 1.00 0.00 H ATOM 90375 H2 WAT 174 32.772 84.867 112.090 1.00 0.00 H TER 90377 WAT 174 ATOM 90377 O WAT 175 138.455 77.921 116.168 1.00 0.00 O ATOM 90378 H1 WAT 175 138.270 78.858 116.237 1.00 0.00 H ATOM 90379 H2 WAT 175 137.665 77.549 115.777 1.00 0.00 H TER 90381 WAT 175 ATOM 90381 O WAT 176 27.729 122.177 107.287 1.00 0.00 O ATOM 90382 H1 WAT 176 27.878 121.768 108.139 1.00 0.00 H ATOM 90383 H2 WAT 176 27.514 121.448 106.705 1.00 0.00 H TER 90385 WAT 176 ATOM 90385 O WAT 177 139.588 79.036 19.101 1.00 0.00 O ATOM 90386 H1 WAT 177 140.462 79.427 19.107 1.00 0.00 H ATOM 90387 H2 WAT 177 139.570 78.503 18.306 1.00 0.00 H TER 90389 WAT 177 ATOM 90389 O WAT 178 29.258 132.284 123.723 1.00 0.00 O ATOM 90390 H1 WAT 178 29.616 132.940 123.126 1.00 0.00 H ATOM 90391 H2 WAT 178 29.433 131.447 123.292 1.00 0.00 H TER 90393 WAT 178 ATOM 90393 O WAT 179 117.984 95.957 76.211 1.00 0.00 O ATOM 90394 H1 WAT 179 117.113 96.046 76.600 1.00 0.00 H ATOM 90395 H2 WAT 179 117.821 95.906 75.270 1.00 0.00 H TER 90397 WAT 179 ATOM 90397 O WAT 180 17.097 108.762 79.356 1.00 0.00 O ATOM 90398 H1 WAT 180 16.153 108.658 79.237 1.00 0.00 H ATOM 90399 H2 WAT 180 17.473 108.538 78.505 1.00 0.00 H TER 90401 WAT 180 ATOM 90401 O WAT 181 94.534 51.363 128.975 1.00 0.00 O ATOM 90402 H1 WAT 181 93.670 51.699 128.734 1.00 0.00 H ATOM 90403 H2 WAT 181 94.733 50.711 128.303 1.00 0.00 H TER 90405 WAT 181 ATOM 90405 O WAT 182 60.918 140.016 69.705 1.00 0.00 O ATOM 90406 H1 WAT 182 60.880 140.967 69.801 1.00 0.00 H ATOM 90407 H2 WAT 182 61.801 139.843 69.378 1.00 0.00 H TER 90409 WAT 182 ATOM 90409 O WAT 183 111.898 2.028 13.228 1.00 0.00 O ATOM 90410 H1 WAT 183 111.322 1.423 13.695 1.00 0.00 H ATOM 90411 H2 WAT 183 112.556 1.466 12.820 1.00 0.00 H TER 90413 WAT 183 ATOM 90413 O WAT 184 35.547 107.997 101.839 1.00 0.00 O ATOM 90414 H1 WAT 184 34.669 108.177 102.176 1.00 0.00 H ATOM 90415 H2 WAT 184 35.460 107.161 101.380 1.00 0.00 H TER 90417 WAT 184 ATOM 90417 O WAT 185 143.308 137.502 18.217 1.00 0.00 O ATOM 90418 H1 WAT 185 142.802 137.105 18.925 1.00 0.00 H ATOM 90419 H2 WAT 185 143.561 138.361 18.555 1.00 0.00 H TER 90421 WAT 185 ATOM 90421 O WAT 186 18.125 10.526 135.791 1.00 0.00 O ATOM 90422 H1 WAT 186 17.786 10.303 136.658 1.00 0.00 H ATOM 90423 H2 WAT 186 17.342 10.655 135.255 1.00 0.00 H TER 90425 WAT 186 ATOM 90425 O WAT 187 109.372 127.354 144.014 1.00 0.00 O ATOM 90426 H1 WAT 187 109.556 127.318 143.076 1.00 0.00 H ATOM 90427 H2 WAT 187 108.431 127.517 144.068 1.00 0.00 H TER 90429 WAT 187 ATOM 90429 O WAT 188 8.955 105.296 142.038 1.00 0.00 O ATOM 90430 H1 WAT 188 8.987 105.954 141.344 1.00 0.00 H ATOM 90431 H2 WAT 188 9.801 105.372 142.479 1.00 0.00 H TER 90433 WAT 188 ATOM 90433 O WAT 189 78.482 41.102 132.892 1.00 0.00 O ATOM 90434 H1 WAT 189 77.904 40.497 133.357 1.00 0.00 H ATOM 90435 H2 WAT 189 78.545 41.864 133.468 1.00 0.00 H TER 90437 WAT 189 ATOM 90437 O WAT 190 119.696 17.074 17.485 1.00 0.00 O ATOM 90438 H1 WAT 190 120.075 17.598 16.779 1.00 0.00 H ATOM 90439 H2 WAT 190 119.099 17.672 17.934 1.00 0.00 H TER 90441 WAT 190 ATOM 90441 O WAT 191 40.490 34.509 66.285 1.00 0.00 O ATOM 90442 H1 WAT 191 41.340 34.166 66.009 1.00 0.00 H ATOM 90443 H2 WAT 191 40.498 35.423 66.002 1.00 0.00 H TER 90445 WAT 191 ATOM 90445 O WAT 192 103.593 145.552 99.783 1.00 0.00 O ATOM 90446 H1 WAT 192 103.897 146.276 100.331 1.00 0.00 H ATOM 90447 H2 WAT 192 103.110 145.975 99.073 1.00 0.00 H TER 90449 WAT 192 ATOM 90449 O WAT 193 112.178 43.317 63.802 1.00 0.00 O ATOM 90450 H1 WAT 193 112.121 42.854 64.638 1.00 0.00 H ATOM 90451 H2 WAT 193 112.811 44.017 63.959 1.00 0.00 H TER 90453 WAT 193 ATOM 90453 O WAT 194 139.643 60.314 73.226 1.00 0.00 O ATOM 90454 H1 WAT 194 140.430 60.759 72.909 1.00 0.00 H ATOM 90455 H2 WAT 194 139.581 59.525 72.689 1.00 0.00 H TER 90457 WAT 194 ATOM 90457 O WAT 195 3.667 130.721 59.937 1.00 0.00 O ATOM 90458 H1 WAT 195 2.786 131.094 59.893 1.00 0.00 H ATOM 90459 H2 WAT 195 4.010 130.812 59.048 1.00 0.00 H TER 90461 WAT 195 ATOM 90461 O WAT 196 33.300 75.816 14.555 1.00 0.00 O ATOM 90462 H1 WAT 196 33.090 76.659 14.956 1.00 0.00 H ATOM 90463 H2 WAT 196 33.021 75.167 15.201 1.00 0.00 H TER 90465 WAT 196 ATOM 90465 O WAT 197 24.243 2.497 87.160 1.00 0.00 O ATOM 90466 H1 WAT 197 23.330 2.406 86.885 1.00 0.00 H ATOM 90467 H2 WAT 197 24.315 3.405 87.453 1.00 0.00 H TER 90469 WAT 197 ATOM 90469 O WAT 198 99.794 131.223 131.663 1.00 0.00 O ATOM 90470 H1 WAT 198 100.525 130.804 132.117 1.00 0.00 H ATOM 90471 H2 WAT 198 99.908 132.158 131.838 1.00 0.00 H TER 90473 WAT 198 ATOM 90473 O WAT 199 8.898 113.563 58.695 1.00 0.00 O ATOM 90474 H1 WAT 199 9.677 113.024 58.833 1.00 0.00 H ATOM 90475 H2 WAT 199 9.241 114.437 58.510 1.00 0.00 H TER 90477 WAT 199 ATOM 90477 O WAT 200 122.648 69.364 96.835 1.00 0.00 O ATOM 90478 H1 WAT 200 123.405 69.086 97.351 1.00 0.00 H ATOM 90479 H2 WAT 200 122.543 68.678 96.176 1.00 0.00 H TER 90481 WAT 200 ATOM 90481 O WAT 201 22.964 28.440 95.519 1.00 0.00 O ATOM 90482 H1 WAT 201 23.669 29.062 95.339 1.00 0.00 H ATOM 90483 H2 WAT 201 22.872 28.452 96.472 1.00 0.00 H TER 90485 WAT 201 ATOM 90485 O WAT 202 37.076 76.386 123.051 1.00 0.00 O ATOM 90486 H1 WAT 202 36.179 76.639 122.836 1.00 0.00 H ATOM 90487 H2 WAT 202 37.133 76.492 124.001 1.00 0.00 H TER 90489 WAT 202 ATOM 90489 O WAT 203 60.440 5.363 148.214 1.00 0.00 O ATOM 90490 H1 WAT 203 60.763 4.600 147.734 1.00 0.00 H ATOM 90491 H2 WAT 203 59.592 5.086 148.561 1.00 0.00 H TER 90493 WAT 203 ATOM 90493 O WAT 204 117.680 40.235 94.175 1.00 0.00 O ATOM 90494 H1 WAT 204 116.797 39.894 94.317 1.00 0.00 H ATOM 90495 H2 WAT 204 118.114 40.136 95.022 1.00 0.00 H TER 90497 WAT 204 ATOM 90497 O WAT 205 47.587 143.698 130.435 1.00 0.00 O ATOM 90498 H1 WAT 205 47.291 144.291 131.126 1.00 0.00 H ATOM 90499 H2 WAT 205 47.957 142.950 130.904 1.00 0.00 H TER 90501 WAT 205 ATOM 90501 O WAT 206 49.538 40.897 75.846 1.00 0.00 O ATOM 90502 H1 WAT 206 49.769 40.913 74.917 1.00 0.00 H ATOM 90503 H2 WAT 206 48.617 40.636 75.859 1.00 0.00 H TER 90505 WAT 206 ATOM 90505 O WAT 207 54.136 53.877 60.659 1.00 0.00 O ATOM 90506 H1 WAT 207 53.381 53.723 60.091 1.00 0.00 H ATOM 90507 H2 WAT 207 54.781 54.298 60.091 1.00 0.00 H TER 90509 WAT 207 ATOM 90509 O WAT 208 12.333 45.252 72.050 1.00 0.00 O ATOM 90510 H1 WAT 208 12.629 45.258 71.140 1.00 0.00 H ATOM 90511 H2 WAT 208 13.089 44.940 72.546 1.00 0.00 H TER 90513 WAT 208 ATOM 90513 O WAT 209 18.143 116.773 60.875 1.00 0.00 O ATOM 90514 H1 WAT 209 17.662 117.091 60.111 1.00 0.00 H ATOM 90515 H2 WAT 209 17.817 117.306 61.601 1.00 0.00 H TER 90517 WAT 209 ATOM 90517 O WAT 210 35.383 17.284 118.490 1.00 0.00 O ATOM 90518 H1 WAT 210 35.235 16.377 118.223 1.00 0.00 H ATOM 90519 H2 WAT 210 36.319 17.326 118.687 1.00 0.00 H TER 90521 WAT 210 ATOM 90521 O WAT 211 134.418 51.743 16.237 1.00 0.00 O ATOM 90522 H1 WAT 211 133.888 51.009 16.548 1.00 0.00 H ATOM 90523 H2 WAT 211 134.093 52.498 16.728 1.00 0.00 H TER 90525 WAT 211 ATOM 90525 O WAT 212 23.440 16.779 152.255 1.00 0.00 O ATOM 90526 H1 WAT 212 24.133 17.357 152.572 1.00 0.00 H ATOM 90527 H2 WAT 212 22.818 16.729 152.981 1.00 0.00 H TER 90529 WAT 212 ATOM 90529 O WAT 213 15.984 0.699 123.197 1.00 0.00 O ATOM 90530 H1 WAT 213 16.709 0.406 122.645 1.00 0.00 H ATOM 90531 H2 WAT 213 15.203 0.551 122.664 1.00 0.00 H TER 90533 WAT 213 ATOM 90533 O WAT 214 74.895 94.638 19.479 1.00 0.00 O ATOM 90534 H1 WAT 214 74.851 93.880 20.061 1.00 0.00 H ATOM 90535 H2 WAT 214 74.658 94.293 18.618 1.00 0.00 H TER 90537 WAT 214 ATOM 90537 O WAT 215 9.774 27.832 136.063 1.00 0.00 O ATOM 90538 H1 WAT 215 10.140 28.501 136.642 1.00 0.00 H ATOM 90539 H2 WAT 215 10.473 27.185 135.974 1.00 0.00 H TER 90541 WAT 215 ATOM 90541 O WAT 216 3.952 47.292 152.232 1.00 0.00 O ATOM 90542 H1 WAT 216 4.237 48.162 152.512 1.00 0.00 H ATOM 90543 H2 WAT 216 3.020 47.395 152.041 1.00 0.00 H TER 90545 WAT 216 ATOM 90545 O WAT 217 95.663 126.658 12.835 1.00 0.00 O ATOM 90546 H1 WAT 217 94.768 126.925 13.041 1.00 0.00 H ATOM 90547 H2 WAT 217 95.816 125.889 13.384 1.00 0.00 H TER 90549 WAT 217 ATOM 90549 O WAT 218 135.155 9.426 4.813 1.00 0.00 O ATOM 90550 H1 WAT 218 136.074 9.174 4.719 1.00 0.00 H ATOM 90551 H2 WAT 218 135.168 10.383 4.811 1.00 0.00 H TER 90553 WAT 218 ATOM 90553 O WAT 219 97.162 130.612 68.688 1.00 0.00 O ATOM 90554 H1 WAT 219 96.394 131.106 68.401 1.00 0.00 H ATOM 90555 H2 WAT 219 97.165 130.706 69.641 1.00 0.00 H TER 90557 WAT 219 ATOM 90557 O WAT 220 39.707 9.008 112.991 1.00 0.00 O ATOM 90558 H1 WAT 220 39.840 8.255 112.415 1.00 0.00 H ATOM 90559 H2 WAT 220 39.847 9.768 112.427 1.00 0.00 H TER 90561 WAT 220 ATOM 90561 O WAT 221 93.344 103.487 150.599 1.00 0.00 O ATOM 90562 H1 WAT 221 93.291 104.126 151.309 1.00 0.00 H ATOM 90563 H2 WAT 221 92.552 102.959 150.693 1.00 0.00 H TER 90565 WAT 221 ATOM 90565 O WAT 222 124.042 54.679 65.388 1.00 0.00 O ATOM 90566 H1 WAT 222 123.170 54.630 64.997 1.00 0.00 H ATOM 90567 H2 WAT 222 123.894 54.534 66.323 1.00 0.00 H TER 90569 WAT 222 ATOM 90569 O WAT 223 94.481 137.982 1.958 1.00 0.00 O ATOM 90570 H1 WAT 223 95.149 137.830 1.290 1.00 0.00 H ATOM 90571 H2 WAT 223 94.592 137.260 2.577 1.00 0.00 H TER 90573 WAT 223 ATOM 90573 O WAT 224 99.654 46.015 146.848 1.00 0.00 O ATOM 90574 H1 WAT 224 99.342 46.678 146.232 1.00 0.00 H ATOM 90575 H2 WAT 224 98.857 45.611 147.189 1.00 0.00 H TER 90577 WAT 224 ATOM 90577 O WAT 225 76.235 56.543 16.141 1.00 0.00 O ATOM 90578 H1 WAT 225 75.750 57.241 15.701 1.00 0.00 H ATOM 90579 H2 WAT 225 76.555 56.946 16.948 1.00 0.00 H TER 90581 WAT 225 ATOM 90581 O WAT 226 139.034 119.178 92.262 1.00 0.00 O ATOM 90582 H1 WAT 226 138.432 119.723 92.769 1.00 0.00 H ATOM 90583 H2 WAT 226 139.569 119.803 91.773 1.00 0.00 H TER 90585 WAT 226 ATOM 90585 O WAT 227 23.156 105.576 113.832 1.00 0.00 O ATOM 90586 H1 WAT 227 22.470 106.227 113.685 1.00 0.00 H ATOM 90587 H2 WAT 227 22.866 105.093 114.605 1.00 0.00 H TER 90589 WAT 227 ATOM 90589 O WAT 228 118.012 24.343 11.048 1.00 0.00 O ATOM 90590 H1 WAT 228 118.176 23.572 10.506 1.00 0.00 H ATOM 90591 H2 WAT 228 118.882 24.634 11.321 1.00 0.00 H TER 90593 WAT 228 ATOM 90593 O WAT 229 138.914 26.311 138.244 1.00 0.00 O ATOM 90594 H1 WAT 229 139.179 25.433 137.967 1.00 0.00 H ATOM 90595 H2 WAT 229 138.404 26.650 137.508 1.00 0.00 H TER 90597 WAT 229 ATOM 90597 O WAT 230 62.243 133.327 119.631 1.00 0.00 O ATOM 90598 H1 WAT 230 61.855 134.168 119.392 1.00 0.00 H ATOM 90599 H2 WAT 230 62.036 132.749 118.896 1.00 0.00 H TER 90601 WAT 230 ATOM 90601 O WAT 231 57.740 109.685 155.984 1.00 0.00 O ATOM 90602 H1 WAT 231 57.907 108.990 155.347 1.00 0.00 H ATOM 90603 H2 WAT 231 58.539 109.725 156.510 1.00 0.00 H TER 90605 WAT 231 ATOM 90605 O WAT 232 129.646 118.793 26.550 1.00 0.00 O ATOM 90606 H1 WAT 232 128.740 118.490 26.495 1.00 0.00 H ATOM 90607 H2 WAT 232 129.935 118.525 27.422 1.00 0.00 H TER 90609 WAT 232 ATOM 90609 O WAT 233 19.583 59.349 78.843 1.00 0.00 O ATOM 90610 H1 WAT 233 20.237 59.903 79.270 1.00 0.00 H ATOM 90611 H2 WAT 233 20.095 58.758 78.291 1.00 0.00 H TER 90613 WAT 233 ATOM 90613 O WAT 234 19.103 28.804 1.231 1.00 0.00 O ATOM 90614 H1 WAT 234 19.778 28.856 0.554 1.00 0.00 H ATOM 90615 H2 WAT 234 18.603 28.018 1.011 1.00 0.00 H TER 90617 WAT 234 ATOM 90617 O WAT 235 92.843 17.714 64.164 1.00 0.00 O ATOM 90618 H1 WAT 235 92.997 16.784 64.332 1.00 0.00 H ATOM 90619 H2 WAT 235 92.634 17.757 63.231 1.00 0.00 H TER 90621 WAT 235 ATOM 90621 O WAT 236 66.711 89.710 8.295 1.00 0.00 O ATOM 90622 H1 WAT 236 67.507 90.189 8.522 1.00 0.00 H ATOM 90623 H2 WAT 236 66.179 90.344 7.813 1.00 0.00 H TER 90625 WAT 236 ATOM 90625 O WAT 237 115.048 103.536 81.811 1.00 0.00 O ATOM 90626 H1 WAT 237 114.778 104.141 82.502 1.00 0.00 H ATOM 90627 H2 WAT 237 114.590 102.720 82.015 1.00 0.00 H TER 90629 WAT 237 ATOM 90629 O WAT 238 118.137 120.433 109.675 1.00 0.00 O ATOM 90630 H1 WAT 238 118.358 119.505 109.589 1.00 0.00 H ATOM 90631 H2 WAT 238 118.983 120.874 109.756 1.00 0.00 H TER 90633 WAT 238 ATOM 90633 O WAT 239 122.679 19.064 136.244 1.00 0.00 O ATOM 90634 H1 WAT 239 122.203 19.886 136.360 1.00 0.00 H ATOM 90635 H2 WAT 239 123.540 19.329 135.921 1.00 0.00 H TER 90637 WAT 239 ATOM 90637 O WAT 240 87.051 33.461 123.564 1.00 0.00 O ATOM 90638 H1 WAT 240 87.906 33.449 123.134 1.00 0.00 H ATOM 90639 H2 WAT 240 86.495 33.974 122.978 1.00 0.00 H TER 90641 WAT 240 ATOM 90641 O WAT 241 61.177 62.074 24.131 1.00 0.00 O ATOM 90642 H1 WAT 241 61.097 61.250 24.611 1.00 0.00 H ATOM 90643 H2 WAT 241 61.664 62.649 24.721 1.00 0.00 H TER 90645 WAT 241 ATOM 90645 O WAT 242 2.682 5.297 94.015 1.00 0.00 O ATOM 90646 H1 WAT 242 3.205 5.747 93.352 1.00 0.00 H ATOM 90647 H2 WAT 242 3.222 5.324 94.805 1.00 0.00 H TER 90649 WAT 242 ATOM 90649 O WAT 243 130.601 56.218 142.065 1.00 0.00 O ATOM 90650 H1 WAT 243 130.745 56.678 141.238 1.00 0.00 H ATOM 90651 H2 WAT 243 130.645 55.290 141.834 1.00 0.00 H TER 90653 WAT 243 ATOM 90653 O WAT 244 34.984 8.073 110.454 1.00 0.00 O ATOM 90654 H1 WAT 244 34.491 7.984 109.638 1.00 0.00 H ATOM 90655 H2 WAT 244 34.315 8.205 111.125 1.00 0.00 H TER 90657 WAT 244 ATOM 90657 O WAT 245 33.911 95.130 61.150 1.00 0.00 O ATOM 90658 H1 WAT 245 32.969 95.198 61.306 1.00 0.00 H ATOM 90659 H2 WAT 245 33.999 94.409 60.526 1.00 0.00 H TER 90661 WAT 245 ATOM 90661 O WAT 246 29.480 105.664 98.694 1.00 0.00 O ATOM 90662 H1 WAT 246 30.164 105.738 98.028 1.00 0.00 H ATOM 90663 H2 WAT 246 28.941 104.929 98.403 1.00 0.00 H TER 90665 WAT 246 ATOM 90665 O WAT 247 100.201 58.328 103.827 1.00 0.00 O ATOM 90666 H1 WAT 247 100.878 58.773 103.317 1.00 0.00 H ATOM 90667 H2 WAT 247 100.431 57.400 103.774 1.00 0.00 H TER 90669 WAT 247 ATOM 90669 O WAT 248 119.360 123.624 150.840 1.00 0.00 O ATOM 90670 H1 WAT 248 118.523 124.076 150.945 1.00 0.00 H ATOM 90671 H2 WAT 248 119.234 122.782 151.278 1.00 0.00 H TER 90673 WAT 248 ATOM 90673 O WAT 249 53.141 126.815 127.094 1.00 0.00 O ATOM 90674 H1 WAT 249 52.601 127.051 127.847 1.00 0.00 H ATOM 90675 H2 WAT 249 53.126 127.593 126.535 1.00 0.00 H TER 90677 WAT 249 ATOM 90677 O WAT 250 125.853 35.647 122.742 1.00 0.00 O ATOM 90678 H1 WAT 250 126.121 34.804 123.107 1.00 0.00 H ATOM 90679 H2 WAT 250 126.471 35.806 122.028 1.00 0.00 H TER 90681 WAT 250 ATOM 90681 O WAT 251 19.153 118.424 153.925 1.00 0.00 O ATOM 90682 H1 WAT 251 18.845 118.791 153.097 1.00 0.00 H ATOM 90683 H2 WAT 251 20.042 118.123 153.738 1.00 0.00 H TER 90685 WAT 251 ATOM 90685 O WAT 252 15.340 131.920 103.386 1.00 0.00 O ATOM 90686 H1 WAT 252 16.142 132.432 103.489 1.00 0.00 H ATOM 90687 H2 WAT 252 14.869 132.043 104.210 1.00 0.00 H TER 90689 WAT 252 ATOM 90689 O WAT 253 28.246 138.817 63.799 1.00 0.00 O ATOM 90690 H1 WAT 253 28.610 139.694 63.921 1.00 0.00 H ATOM 90691 H2 WAT 253 28.746 138.449 63.070 1.00 0.00 H TER 90693 WAT 253 ATOM 90693 O WAT 254 101.630 117.870 120.394 1.00 0.00 O ATOM 90694 H1 WAT 254 101.743 117.025 119.959 1.00 0.00 H ATOM 90695 H2 WAT 254 100.714 117.876 120.673 1.00 0.00 H TER 90697 WAT 254 ATOM 90697 O WAT 255 132.759 34.939 155.763 1.00 0.00 O ATOM 90698 H1 WAT 255 133.278 34.989 156.566 1.00 0.00 H ATOM 90699 H2 WAT 255 131.973 34.455 156.015 1.00 0.00 H TER 90701 WAT 255 ATOM 90701 O WAT 256 99.768 16.778 61.786 1.00 0.00 O ATOM 90702 H1 WAT 256 99.669 16.132 62.486 1.00 0.00 H ATOM 90703 H2 WAT 256 100.551 17.273 62.026 1.00 0.00 H TER 90705 WAT 256 ATOM 90705 O WAT 257 10.334 85.469 156.627 1.00 0.00 O ATOM 90706 H1 WAT 257 9.945 86.340 156.546 1.00 0.00 H ATOM 90707 H2 WAT 257 9.885 85.075 157.375 1.00 0.00 H TER 90709 WAT 257 ATOM 90709 O WAT 258 35.185 59.840 13.382 1.00 0.00 O ATOM 90710 H1 WAT 258 34.906 60.634 12.927 1.00 0.00 H ATOM 90711 H2 WAT 258 34.397 59.298 13.424 1.00 0.00 H TER 90713 WAT 258 ATOM 90713 O WAT 259 123.739 6.203 131.436 1.00 0.00 O ATOM 90714 H1 WAT 259 124.018 6.451 130.554 1.00 0.00 H ATOM 90715 H2 WAT 259 122.912 5.740 131.304 1.00 0.00 H TER 90717 WAT 259 ATOM 90717 O WAT 260 49.845 115.416 122.686 1.00 0.00 O ATOM 90718 H1 WAT 260 49.850 116.195 123.242 1.00 0.00 H ATOM 90719 H2 WAT 260 50.736 115.362 122.340 1.00 0.00 H TER 90721 WAT 260 ATOM 90721 O WAT 261 9.287 99.745 121.866 1.00 0.00 O ATOM 90722 H1 WAT 261 9.967 100.130 121.313 1.00 0.00 H ATOM 90723 H2 WAT 261 8.964 98.997 121.363 1.00 0.00 H TER 90725 WAT 261 ATOM 90725 O WAT 262 140.494 67.674 153.793 1.00 0.00 O ATOM 90726 H1 WAT 262 139.705 67.168 153.599 1.00 0.00 H ATOM 90727 H2 WAT 262 141.174 67.276 153.251 1.00 0.00 H TER 90729 WAT 262 ATOM 90729 O WAT 263 81.053 96.159 90.037 1.00 0.00 O ATOM 90730 H1 WAT 263 81.496 96.306 89.201 1.00 0.00 H ATOM 90731 H2 WAT 263 81.761 96.128 90.681 1.00 0.00 H TER 90733 WAT 263 ATOM 90733 O WAT 264 51.084 14.081 58.079 1.00 0.00 O ATOM 90734 H1 WAT 264 50.367 13.608 57.658 1.00 0.00 H ATOM 90735 H2 WAT 264 51.651 13.394 58.429 1.00 0.00 H TER 90737 WAT 264 ATOM 90737 O WAT 265 5.649 110.917 -0.027 1.00 0.00 O ATOM 90738 H1 WAT 265 5.717 110.032 -0.386 1.00 0.00 H ATOM 90739 H2 WAT 265 4.843 110.905 0.490 1.00 0.00 H TER 90741 WAT 265 ATOM 90741 O WAT 266 89.304 19.263 148.224 1.00 0.00 O ATOM 90742 H1 WAT 266 89.685 19.038 149.073 1.00 0.00 H ATOM 90743 H2 WAT 266 89.606 18.571 147.635 1.00 0.00 H TER 90745 WAT 266 ATOM 90745 O WAT 267 30.757 128.200 76.740 1.00 0.00 O ATOM 90746 H1 WAT 267 31.391 127.517 76.522 1.00 0.00 H ATOM 90747 H2 WAT 267 31.167 128.687 77.455 1.00 0.00 H TER 90749 WAT 267 ATOM 90749 O WAT 268 129.543 107.150 120.820 1.00 0.00 O ATOM 90750 H1 WAT 268 128.800 107.641 120.470 1.00 0.00 H ATOM 90751 H2 WAT 268 130.313 107.613 120.488 1.00 0.00 H TER 90753 WAT 268 ATOM 90753 O WAT 269 114.612 5.707 72.088 1.00 0.00 O ATOM 90754 H1 WAT 269 113.999 5.680 71.353 1.00 0.00 H ATOM 90755 H2 WAT 269 114.085 5.462 72.849 1.00 0.00 H TER 90757 WAT 269 ATOM 90757 O WAT 270 125.751 81.844 63.244 1.00 0.00 O ATOM 90758 H1 WAT 270 125.965 80.911 63.219 1.00 0.00 H ATOM 90759 H2 WAT 270 125.750 82.064 64.175 1.00 0.00 H TER 90761 WAT 270 ATOM 90761 O WAT 271 24.404 26.930 125.643 1.00 0.00 O ATOM 90762 H1 WAT 271 25.352 26.804 125.684 1.00 0.00 H ATOM 90763 H2 WAT 271 24.134 27.017 126.557 1.00 0.00 H TER 90765 WAT 271 ATOM 90765 O WAT 272 59.936 125.475 95.452 1.00 0.00 O ATOM 90766 H1 WAT 272 60.032 125.723 96.371 1.00 0.00 H ATOM 90767 H2 WAT 272 60.815 125.569 95.085 1.00 0.00 H TER 90769 WAT 272 ATOM 90769 O WAT 273 15.886 84.504 144.525 1.00 0.00 O ATOM 90770 H1 WAT 273 15.908 83.548 144.569 1.00 0.00 H ATOM 90771 H2 WAT 273 15.235 84.759 145.178 1.00 0.00 H TER 90773 WAT 273 ATOM 90773 O WAT 274 74.513 130.694 102.953 1.00 0.00 O ATOM 90774 H1 WAT 274 75.255 131.296 103.016 1.00 0.00 H ATOM 90775 H2 WAT 274 74.795 129.915 103.432 1.00 0.00 H TER 90777 WAT 274 ATOM 90777 O WAT 275 27.324 98.609 140.274 1.00 0.00 O ATOM 90778 H1 WAT 275 27.293 98.169 139.424 1.00 0.00 H ATOM 90779 H2 WAT 275 27.688 99.473 140.083 1.00 0.00 H TER 90781 WAT 275 ATOM 90781 O WAT 276 82.206 27.999 154.076 1.00 0.00 O ATOM 90782 H1 WAT 276 82.767 27.233 153.958 1.00 0.00 H ATOM 90783 H2 WAT 276 82.140 28.384 153.202 1.00 0.00 H TER 90785 WAT 276 ATOM 90785 O WAT 277 14.660 37.602 61.767 1.00 0.00 O ATOM 90786 H1 WAT 277 15.563 37.332 61.936 1.00 0.00 H ATOM 90787 H2 WAT 277 14.180 37.334 62.550 1.00 0.00 H TER 90789 WAT 277 ATOM 90789 O WAT 278 37.501 2.512 21.007 1.00 0.00 O ATOM 90790 H1 WAT 278 37.602 2.059 20.169 1.00 0.00 H ATOM 90791 H2 WAT 278 38.189 3.177 21.004 1.00 0.00 H TER 90793 WAT 278 ATOM 90793 O WAT 279 134.528 36.631 102.038 1.00 0.00 O ATOM 90794 H1 WAT 279 135.005 35.832 101.814 1.00 0.00 H ATOM 90795 H2 WAT 279 134.445 36.601 102.991 1.00 0.00 H TER 90797 WAT 279 ATOM 90797 O WAT 280 65.935 76.387 72.320 1.00 0.00 O ATOM 90798 H1 WAT 280 66.109 77.263 72.663 1.00 0.00 H ATOM 90799 H2 WAT 280 66.611 75.836 72.715 1.00 0.00 H TER 90801 WAT 280 ATOM 90801 O WAT 281 100.416 138.519 127.592 1.00 0.00 O ATOM 90802 H1 WAT 281 100.097 138.662 128.483 1.00 0.00 H ATOM 90803 H2 WAT 281 101.235 139.011 127.548 1.00 0.00 H TER 90805 WAT 281 ATOM 90805 O WAT 282 55.923 3.158 131.776 1.00 0.00 O ATOM 90806 H1 WAT 282 55.374 3.266 132.553 1.00 0.00 H ATOM 90807 H2 WAT 282 56.498 3.923 131.781 1.00 0.00 H TER 90809 WAT 282 ATOM 90809 O WAT 283 37.261 107.511 21.870 1.00 0.00 O ATOM 90810 H1 WAT 283 37.637 108.322 21.527 1.00 0.00 H ATOM 90811 H2 WAT 283 36.978 107.735 22.757 1.00 0.00 H TER 90813 WAT 283 ATOM 90813 O WAT 284 95.920 144.033 82.915 1.00 0.00 O ATOM 90814 H1 WAT 284 95.877 143.151 82.544 1.00 0.00 H ATOM 90815 H2 WAT 284 95.883 143.896 83.862 1.00 0.00 H TER 90817 WAT 284 ATOM 90817 O WAT 285 9.535 35.291 19.334 1.00 0.00 O ATOM 90818 H1 WAT 285 9.473 34.440 19.767 1.00 0.00 H ATOM 90819 H2 WAT 285 8.672 35.687 19.457 1.00 0.00 H TER 90821 WAT 285 ATOM 90821 O WAT 286 98.499 129.543 96.586 1.00 0.00 O ATOM 90822 H1 WAT 286 98.548 128.753 97.124 1.00 0.00 H ATOM 90823 H2 WAT 286 98.189 130.222 97.187 1.00 0.00 H TER 90825 WAT 286 ATOM 90825 O WAT 287 36.454 123.060 75.883 1.00 0.00 O ATOM 90826 H1 WAT 287 36.646 122.713 75.012 1.00 0.00 H ATOM 90827 H2 WAT 287 37.281 123.440 76.178 1.00 0.00 H TER 90829 WAT 287 ATOM 90829 O WAT 288 91.136 111.575 112.825 1.00 0.00 O ATOM 90830 H1 WAT 288 90.496 110.907 112.582 1.00 0.00 H ATOM 90831 H2 WAT 288 91.520 111.852 111.993 1.00 0.00 H TER 90833 WAT 288 ATOM 90833 O WAT 289 115.078 28.709 108.799 1.00 0.00 O ATOM 90834 H1 WAT 289 115.256 28.305 107.949 1.00 0.00 H ATOM 90835 H2 WAT 289 115.020 27.972 109.406 1.00 0.00 H TER 90837 WAT 289 ATOM 90837 O WAT 290 137.874 134.331 151.187 1.00 0.00 O ATOM 90838 H1 WAT 290 137.296 134.607 150.475 1.00 0.00 H ATOM 90839 H2 WAT 290 138.711 134.151 150.760 1.00 0.00 H TER 90841 WAT 290 ATOM 90841 O WAT 291 33.840 1.468 18.655 1.00 0.00 O ATOM 90842 H1 WAT 291 33.174 0.784 18.726 1.00 0.00 H ATOM 90843 H2 WAT 291 33.765 1.961 19.473 1.00 0.00 H TER 90845 WAT 291 ATOM 90845 O WAT 292 135.377 82.516 82.827 1.00 0.00 O ATOM 90846 H1 WAT 292 134.527 82.137 82.607 1.00 0.00 H ATOM 90847 H2 WAT 292 135.166 83.302 83.331 1.00 0.00 H TER 90849 WAT 292 ATOM 90849 O WAT 293 78.350 73.520 67.214 1.00 0.00 O ATOM 90850 H1 WAT 293 78.247 74.434 67.477 1.00 0.00 H ATOM 90851 H2 WAT 293 77.779 73.425 66.451 1.00 0.00 H TER 90853 WAT 293 ATOM 90853 O WAT 294 65.852 10.068 96.102 1.00 0.00 O ATOM 90854 H1 WAT 294 66.013 9.438 96.805 1.00 0.00 H ATOM 90855 H2 WAT 294 66.725 10.336 95.815 1.00 0.00 H TER 90857 WAT 294 ATOM 90857 O WAT 295 103.069 40.140 61.113 1.00 0.00 O ATOM 90858 H1 WAT 295 103.179 39.799 60.225 1.00 0.00 H ATOM 90859 H2 WAT 295 102.297 40.703 61.059 1.00 0.00 H TER 90861 WAT 295 ATOM 90861 O WAT 296 28.107 113.556 128.542 1.00 0.00 O ATOM 90862 H1 WAT 296 28.521 114.119 129.196 1.00 0.00 H ATOM 90863 H2 WAT 296 28.443 113.875 127.705 1.00 0.00 H TER 90865 WAT 296 ATOM 90865 O WAT 297 59.003 112.993 84.245 1.00 0.00 O ATOM 90866 H1 WAT 297 59.737 113.559 84.482 1.00 0.00 H ATOM 90867 H2 WAT 297 58.455 113.536 83.678 1.00 0.00 H TER 90869 WAT 297 ATOM 90869 O WAT 298 73.459 107.937 10.876 1.00 0.00 O ATOM 90870 H1 WAT 298 72.732 108.076 11.482 1.00 0.00 H ATOM 90871 H2 WAT 298 73.095 108.139 10.014 1.00 0.00 H TER 90873 WAT 298 ATOM 90873 O WAT 299 8.919 133.980 136.976 1.00 0.00 O ATOM 90874 H1 WAT 299 8.248 133.703 137.599 1.00 0.00 H ATOM 90875 H2 WAT 299 9.553 134.464 137.506 1.00 0.00 H TER 90877 WAT 299 ATOM 90877 O WAT 300 39.610 77.431 87.410 1.00 0.00 O ATOM 90878 H1 WAT 300 39.103 77.735 86.657 1.00 0.00 H ATOM 90879 H2 WAT 300 40.513 77.398 87.094 1.00 0.00 H TER 90881 WAT 300 ATOM 90881 O WAT 301 135.774 31.837 84.152 1.00 0.00 O ATOM 90882 H1 WAT 301 136.373 32.347 84.697 1.00 0.00 H ATOM 90883 H2 WAT 301 135.017 32.410 84.029 1.00 0.00 H TER 90885 WAT 301 ATOM 90885 O WAT 302 47.561 91.734 113.526 1.00 0.00 O ATOM 90886 H1 WAT 302 47.997 92.576 113.658 1.00 0.00 H ATOM 90887 H2 WAT 302 48.262 91.141 113.256 1.00 0.00 H TER 90889 WAT 302 ATOM 90889 O WAT 303 87.298 80.152 151.802 1.00 0.00 O ATOM 90890 H1 WAT 303 86.487 80.522 152.151 1.00 0.00 H ATOM 90891 H2 WAT 303 87.691 79.694 152.545 1.00 0.00 H TER 90893 WAT 303 ATOM 90893 O WAT 304 66.618 84.100 158.562 1.00 0.00 O ATOM 90894 H1 WAT 304 66.101 83.508 158.017 1.00 0.00 H ATOM 90895 H2 WAT 304 67.507 83.748 158.521 1.00 0.00 H TER 90897 WAT 304 ATOM 90897 O WAT 305 73.780 0.577 11.926 1.00 0.00 O ATOM 90898 H1 WAT 305 74.216 0.045 12.592 1.00 0.00 H ATOM 90899 H2 WAT 305 72.861 0.588 12.191 1.00 0.00 H TER 90901 WAT 305 ATOM 90901 O WAT 306 4.811 32.514 122.896 1.00 0.00 O ATOM 90902 H1 WAT 306 4.090 33.126 122.744 1.00 0.00 H ATOM 90903 H2 WAT 306 4.381 31.676 123.066 1.00 0.00 H TER 90905 WAT 306 ATOM 90905 O WAT 307 120.998 126.580 87.073 1.00 0.00 O ATOM 90906 H1 WAT 307 121.932 126.665 86.883 1.00 0.00 H ATOM 90907 H2 WAT 307 120.657 126.035 86.363 1.00 0.00 H TER 90909 WAT 307 ATOM 90909 O WAT 308 91.060 12.470 53.386 1.00 0.00 O ATOM 90910 H1 WAT 308 90.533 12.905 54.056 1.00 0.00 H ATOM 90911 H2 WAT 308 90.712 11.579 53.348 1.00 0.00 H TER 90913 WAT 308 ATOM 90913 O WAT 309 14.883 82.405 154.311 1.00 0.00 O ATOM 90914 H1 WAT 309 15.317 82.797 155.069 1.00 0.00 H ATOM 90915 H2 WAT 309 14.503 81.593 154.646 1.00 0.00 H TER 90917 WAT 309 ATOM 90917 O WAT 310 84.858 94.063 112.307 1.00 0.00 O ATOM 90918 H1 WAT 310 84.567 93.402 111.678 1.00 0.00 H ATOM 90919 H2 WAT 310 84.048 94.410 112.681 1.00 0.00 H TER 90921 WAT 310 ATOM 90921 O WAT 311 72.500 64.172 1.071 1.00 0.00 O ATOM 90922 H1 WAT 311 71.716 63.759 1.433 1.00 0.00 H ATOM 90923 H2 WAT 311 72.748 63.612 0.336 1.00 0.00 H TER 90925 WAT 311 ATOM 90925 O WAT 312 14.919 31.736 155.973 1.00 0.00 O ATOM 90926 H1 WAT 312 15.801 32.055 155.781 1.00 0.00 H ATOM 90927 H2 WAT 312 14.966 30.793 155.814 1.00 0.00 H TER 90929 WAT 312 ATOM 90929 O WAT 313 51.898 143.004 0.978 1.00 0.00 O ATOM 90930 H1 WAT 313 51.931 143.094 0.025 1.00 0.00 H ATOM 90931 H2 WAT 313 51.000 143.240 1.209 1.00 0.00 H TER 90933 WAT 313 ATOM 90933 O WAT 314 49.992 82.645 16.216 1.00 0.00 O ATOM 90934 H1 WAT 314 50.660 83.007 16.797 1.00 0.00 H ATOM 90935 H2 WAT 314 50.361 81.815 15.914 1.00 0.00 H TER 90937 WAT 314 ATOM 90937 O WAT 315 15.982 133.684 110.800 1.00 0.00 O ATOM 90938 H1 WAT 315 16.337 134.057 109.994 1.00 0.00 H ATOM 90939 H2 WAT 315 15.197 133.213 110.520 1.00 0.00 H TER 90941 WAT 315 ATOM 90941 O WAT 316 34.327 9.944 131.503 1.00 0.00 O ATOM 90942 H1 WAT 316 34.151 10.884 131.460 1.00 0.00 H ATOM 90943 H2 WAT 316 34.434 9.679 130.590 1.00 0.00 H TER 90945 WAT 316 ATOM 90945 O WAT 317 86.812 103.120 63.957 1.00 0.00 O ATOM 90946 H1 WAT 317 86.485 102.239 64.136 1.00 0.00 H ATOM 90947 H2 WAT 317 87.545 102.987 63.357 1.00 0.00 H TER 90949 WAT 317 ATOM 90949 O WAT 318 66.435 135.237 14.471 1.00 0.00 O ATOM 90950 H1 WAT 318 67.179 135.756 14.164 1.00 0.00 H ATOM 90951 H2 WAT 318 66.544 134.387 14.046 1.00 0.00 H TER 90953 WAT 318 ATOM 90953 O WAT 319 91.587 90.946 116.547 1.00 0.00 O ATOM 90954 H1 WAT 319 91.715 90.502 115.708 1.00 0.00 H ATOM 90955 H2 WAT 319 91.696 91.875 116.345 1.00 0.00 H TER 90957 WAT 319 ATOM 90957 O WAT 320 48.498 118.789 157.658 1.00 0.00 O ATOM 90958 H1 WAT 320 48.493 118.532 156.736 1.00 0.00 H ATOM 90959 H2 WAT 320 48.569 117.963 158.136 1.00 0.00 H TER 90961 WAT 320 ATOM 90961 O WAT 321 85.851 73.173 85.689 1.00 0.00 O ATOM 90962 H1 WAT 321 86.586 73.778 85.791 1.00 0.00 H ATOM 90963 H2 WAT 321 86.256 72.347 85.424 1.00 0.00 H TER 90965 WAT 321 ATOM 90965 O WAT 322 24.921 21.575 73.047 1.00 0.00 O ATOM 90966 H1 WAT 322 24.412 21.047 72.432 1.00 0.00 H ATOM 90967 H2 WAT 322 25.403 22.190 72.493 1.00 0.00 H TER 90969 WAT 322 ATOM 90969 O WAT 323 38.200 36.001 78.832 1.00 0.00 O ATOM 90970 H1 WAT 323 38.067 35.720 79.738 1.00 0.00 H ATOM 90971 H2 WAT 323 39.147 35.950 78.703 1.00 0.00 H TER 90973 WAT 323 ATOM 90973 O WAT 324 132.944 83.476 8.651 1.00 0.00 O ATOM 90974 H1 WAT 324 133.720 83.655 9.183 1.00 0.00 H ATOM 90975 H2 WAT 324 133.261 82.905 7.952 1.00 0.00 H TER 90977 WAT 324 ATOM 90977 O WAT 325 62.777 124.363 83.005 1.00 0.00 O ATOM 90978 H1 WAT 325 63.043 123.492 82.711 1.00 0.00 H ATOM 90979 H2 WAT 325 63.558 124.904 82.885 1.00 0.00 H TER 90981 WAT 325 ATOM 90981 O WAT 326 33.122 94.782 91.462 1.00 0.00 O ATOM 90982 H1 WAT 326 33.304 95.366 92.199 1.00 0.00 H ATOM 90983 H2 WAT 326 32.169 94.702 91.450 1.00 0.00 H TER 90985 WAT 326 ATOM 90985 O WAT 327 20.355 0.979 4.775 1.00 0.00 O ATOM 90986 H1 WAT 327 19.908 0.645 3.998 1.00 0.00 H ATOM 90987 H2 WAT 327 21.230 1.214 4.466 1.00 0.00 H TER 90989 WAT 327 ATOM 90989 O WAT 328 127.713 33.822 74.307 1.00 0.00 O ATOM 90990 H1 WAT 328 128.578 33.461 74.504 1.00 0.00 H ATOM 90991 H2 WAT 328 127.120 33.074 74.379 1.00 0.00 H TER 90993 WAT 328 ATOM 90993 O WAT 329 82.571 52.421 73.620 1.00 0.00 O ATOM 90994 H1 WAT 329 82.772 51.486 73.642 1.00 0.00 H ATOM 90995 H2 WAT 329 83.104 52.764 72.902 1.00 0.00 H TER 90997 WAT 329 ATOM 90997 O WAT 330 29.126 69.348 70.286 1.00 0.00 O ATOM 90998 H1 WAT 330 28.216 69.118 70.101 1.00 0.00 H ATOM 90999 H2 WAT 330 29.378 69.929 69.568 1.00 0.00 H TER 91001 WAT 330 ATOM 91001 O WAT 331 28.339 125.149 18.444 1.00 0.00 O ATOM 91002 H1 WAT 331 28.928 125.174 19.198 1.00 0.00 H ATOM 91003 H2 WAT 331 28.027 124.244 18.414 1.00 0.00 H TER 91005 WAT 331 ATOM 91005 O WAT 332 130.605 6.853 142.335 1.00 0.00 O ATOM 91006 H1 WAT 332 131.209 7.190 141.674 1.00 0.00 H ATOM 91007 H2 WAT 332 130.804 7.361 143.122 1.00 0.00 H TER 91009 WAT 332 ATOM 91009 O WAT 333 135.762 120.292 129.667 1.00 0.00 O ATOM 91010 H1 WAT 333 135.429 119.531 130.142 1.00 0.00 H ATOM 91011 H2 WAT 333 136.708 120.152 129.622 1.00 0.00 H TER 91013 WAT 333 ATOM 91013 O WAT 334 3.711 106.801 92.527 1.00 0.00 O ATOM 91014 H1 WAT 334 2.755 106.782 92.572 1.00 0.00 H ATOM 91015 H2 WAT 334 3.903 107.083 91.633 1.00 0.00 H TER 91017 WAT 334 ATOM 91017 O WAT 335 76.717 117.829 90.624 1.00 0.00 O ATOM 91018 H1 WAT 335 75.971 117.567 91.164 1.00 0.00 H ATOM 91019 H2 WAT 335 76.370 118.516 90.055 1.00 0.00 H TER 91021 WAT 335 ATOM 91021 O WAT 336 11.797 41.674 85.412 1.00 0.00 O ATOM 91022 H1 WAT 336 10.902 41.364 85.547 1.00 0.00 H ATOM 91023 H2 WAT 336 12.131 41.834 86.295 1.00 0.00 H TER 91025 WAT 336 ATOM 91025 O WAT 337 49.908 124.570 145.603 1.00 0.00 O ATOM 91026 H1 WAT 337 49.849 123.868 146.250 1.00 0.00 H ATOM 91027 H2 WAT 337 50.608 125.137 145.928 1.00 0.00 H TER 91029 WAT 337 ATOM 91029 O WAT 338 87.207 34.134 115.840 1.00 0.00 O ATOM 91030 H1 WAT 338 87.215 34.042 116.792 1.00 0.00 H ATOM 91031 H2 WAT 338 87.069 33.245 115.514 1.00 0.00 H TER 91033 WAT 338 ATOM 91033 O WAT 339 70.033 96.381 64.723 1.00 0.00 O ATOM 91034 H1 WAT 339 69.487 96.717 64.013 1.00 0.00 H ATOM 91035 H2 WAT 339 69.559 95.615 65.047 1.00 0.00 H TER 91037 WAT 339 ATOM 91037 O WAT 340 134.380 126.845 78.432 1.00 0.00 O ATOM 91038 H1 WAT 340 133.518 126.649 78.065 1.00 0.00 H ATOM 91039 H2 WAT 340 134.484 127.789 78.309 1.00 0.00 H TER 91041 WAT 340 ATOM 91041 O WAT 341 110.366 14.368 144.030 1.00 0.00 O ATOM 91042 H1 WAT 341 111.172 14.009 143.659 1.00 0.00 H ATOM 91043 H2 WAT 341 109.839 13.598 144.247 1.00 0.00 H TER 91045 WAT 341 ATOM 91045 O WAT 342 141.788 68.596 68.256 1.00 0.00 O ATOM 91046 H1 WAT 342 142.487 68.888 67.671 1.00 0.00 H ATOM 91047 H2 WAT 342 140.984 68.910 67.843 1.00 0.00 H TER 91049 WAT 342 ATOM 91049 O WAT 343 100.639 122.329 99.084 1.00 0.00 O ATOM 91050 H1 WAT 343 100.934 122.031 99.944 1.00 0.00 H ATOM 91051 H2 WAT 343 101.296 121.991 98.475 1.00 0.00 H TER 91053 WAT 343 ATOM 91053 O WAT 344 101.254 56.497 115.882 1.00 0.00 O ATOM 91054 H1 WAT 344 102.115 56.426 115.468 1.00 0.00 H ATOM 91055 H2 WAT 344 101.178 55.705 116.413 1.00 0.00 H TER 91057 WAT 344 ATOM 91057 O WAT 345 144.760 145.380 124.199 1.00 0.00 O ATOM 91058 H1 WAT 345 145.308 145.751 123.508 1.00 0.00 H ATOM 91059 H2 WAT 345 145.236 144.601 124.489 1.00 0.00 H TER 91061 WAT 345 ATOM 91061 O WAT 346 76.619 22.149 85.670 1.00 0.00 O ATOM 91062 H1 WAT 346 75.861 22.497 85.201 1.00 0.00 H ATOM 91063 H2 WAT 346 76.407 22.272 86.595 1.00 0.00 H TER 91065 WAT 346 ATOM 91065 O WAT 347 97.010 83.690 119.738 1.00 0.00 O ATOM 91066 H1 WAT 347 97.423 83.720 120.601 1.00 0.00 H ATOM 91067 H2 WAT 347 96.777 82.769 119.616 1.00 0.00 H TER 91069 WAT 347 ATOM 91069 O WAT 348 114.550 38.474 154.643 1.00 0.00 O ATOM 91070 H1 WAT 348 115.487 38.359 154.484 1.00 0.00 H ATOM 91071 H2 WAT 348 114.139 37.732 154.200 1.00 0.00 H TER 91073 WAT 348 ATOM 91073 O WAT 349 117.748 72.407 135.598 1.00 0.00 O ATOM 91074 H1 WAT 349 117.468 72.568 134.697 1.00 0.00 H ATOM 91075 H2 WAT 349 117.858 71.457 135.649 1.00 0.00 H TER 91077 WAT 349 ATOM 91077 O WAT 350 113.472 96.140 109.101 1.00 0.00 O ATOM 91078 H1 WAT 350 113.152 95.752 108.286 1.00 0.00 H ATOM 91079 H2 WAT 350 113.688 97.042 108.867 1.00 0.00 H TER 91081 WAT 350 ATOM 91081 O WAT 351 61.107 63.261 69.843 1.00 0.00 O ATOM 91082 H1 WAT 351 61.358 62.531 70.409 1.00 0.00 H ATOM 91083 H2 WAT 351 60.391 63.691 70.310 1.00 0.00 H TER 91085 WAT 351 ATOM 91085 O WAT 352 104.993 105.700 82.501 1.00 0.00 O ATOM 91086 H1 WAT 352 105.542 104.924 82.612 1.00 0.00 H ATOM 91087 H2 WAT 352 105.559 106.333 82.060 1.00 0.00 H TER 91089 WAT 352 ATOM 91089 O WAT 353 17.175 53.536 114.810 1.00 0.00 O ATOM 91090 H1 WAT 353 17.681 53.462 115.619 1.00 0.00 H ATOM 91091 H2 WAT 353 17.793 53.297 114.119 1.00 0.00 H TER 91093 WAT 353 ATOM 91093 O WAT 354 122.438 74.896 2.490 1.00 0.00 O ATOM 91094 H1 WAT 354 122.943 75.531 1.983 1.00 0.00 H ATOM 91095 H2 WAT 354 122.551 74.070 2.020 1.00 0.00 H TER 91097 WAT 354 ATOM 91097 O WAT 355 13.788 65.434 5.681 1.00 0.00 O ATOM 91098 H1 WAT 355 14.383 66.162 5.864 1.00 0.00 H ATOM 91099 H2 WAT 355 13.176 65.435 6.417 1.00 0.00 H TER 91101 WAT 355 ATOM 91101 O WAT 356 47.890 47.111 59.522 1.00 0.00 O ATOM 91102 H1 WAT 356 48.163 47.393 60.395 1.00 0.00 H ATOM 91103 H2 WAT 356 47.010 47.473 59.418 1.00 0.00 H TER 91105 WAT 356 ATOM 91105 O WAT 357 145.357 127.368 105.016 1.00 0.00 O ATOM 91106 H1 WAT 357 145.126 128.265 104.775 1.00 0.00 H ATOM 91107 H2 WAT 357 144.518 126.942 105.189 1.00 0.00 H TER 91109 WAT 357 ATOM 91109 O WAT 358 39.680 26.362 144.166 1.00 0.00 O ATOM 91110 H1 WAT 358 40.593 26.076 144.212 1.00 0.00 H ATOM 91111 H2 WAT 358 39.434 26.233 143.250 1.00 0.00 H TER 91113 WAT 358 ATOM 91113 O WAT 359 88.687 31.548 141.363 1.00 0.00 O ATOM 91114 H1 WAT 359 88.752 32.204 140.668 1.00 0.00 H ATOM 91115 H2 WAT 359 88.361 32.034 142.121 1.00 0.00 H TER 91117 WAT 359 ATOM 91117 O WAT 360 30.854 134.543 114.954 1.00 0.00 O ATOM 91118 H1 WAT 360 30.430 134.737 114.118 1.00 0.00 H ATOM 91119 H2 WAT 360 30.502 133.691 115.210 1.00 0.00 H TER 91121 WAT 360 ATOM 91121 O WAT 361 3.825 128.641 66.950 1.00 0.00 O ATOM 91122 H1 WAT 361 4.430 128.498 66.222 1.00 0.00 H ATOM 91123 H2 WAT 361 3.285 129.381 66.671 1.00 0.00 H TER 91125 WAT 361 ATOM 91125 O WAT 362 59.279 84.754 13.697 1.00 0.00 O ATOM 91126 H1 WAT 362 60.229 84.858 13.648 1.00 0.00 H ATOM 91127 H2 WAT 362 58.936 85.387 13.066 1.00 0.00 H TER 91129 WAT 362 ATOM 91129 O WAT 363 80.576 4.903 149.135 1.00 0.00 O ATOM 91130 H1 WAT 363 81.370 5.058 149.647 1.00 0.00 H ATOM 91131 H2 WAT 363 80.684 4.018 148.787 1.00 0.00 H TER 91133 WAT 363 ATOM 91133 O WAT 364 55.684 17.592 131.920 1.00 0.00 O ATOM 91134 H1 WAT 364 56.036 18.251 132.518 1.00 0.00 H ATOM 91135 H2 WAT 364 55.207 16.985 132.486 1.00 0.00 H TER 91137 WAT 364 ATOM 91137 O WAT 365 58.638 85.191 102.524 1.00 0.00 O ATOM 91138 H1 WAT 365 58.331 84.682 103.274 1.00 0.00 H ATOM 91139 H2 WAT 365 58.692 84.556 101.809 1.00 0.00 H TER 91141 WAT 365 ATOM 91141 O WAT 366 77.984 100.589 140.192 1.00 0.00 O ATOM 91142 H1 WAT 366 77.521 99.860 139.780 1.00 0.00 H ATOM 91143 H2 WAT 366 77.389 101.333 140.100 1.00 0.00 H TER 91145 WAT 366 ATOM 91145 O WAT 367 120.163 106.522 102.957 1.00 0.00 O ATOM 91146 H1 WAT 367 120.233 105.962 102.184 1.00 0.00 H ATOM 91147 H2 WAT 367 120.821 107.203 102.821 1.00 0.00 H TER 91149 WAT 367 ATOM 91149 O WAT 368 29.468 34.299 22.166 1.00 0.00 O ATOM 91150 H1 WAT 368 30.159 34.960 22.214 1.00 0.00 H ATOM 91151 H2 WAT 368 29.126 34.245 23.059 1.00 0.00 H TER 91153 WAT 368 ATOM 91153 O WAT 369 103.074 101.853 112.721 1.00 0.00 O ATOM 91154 H1 WAT 369 102.926 102.021 111.790 1.00 0.00 H ATOM 91155 H2 WAT 369 103.087 100.899 112.794 1.00 0.00 H TER 91157 WAT 369 ATOM 91157 O WAT 370 70.651 27.546 14.488 1.00 0.00 O ATOM 91158 H1 WAT 370 70.144 28.099 15.082 1.00 0.00 H ATOM 91159 H2 WAT 370 69.999 27.168 13.897 1.00 0.00 H TER 91161 WAT 370 ATOM 91161 O WAT 371 123.054 32.114 109.557 1.00 0.00 O ATOM 91162 H1 WAT 371 124.006 32.181 109.637 1.00 0.00 H ATOM 91163 H2 WAT 371 122.830 31.311 110.027 1.00 0.00 H TER 91165 WAT 371 ATOM 91165 O WAT 372 31.670 82.321 140.146 1.00 0.00 O ATOM 91166 H1 WAT 372 30.814 82.659 139.882 1.00 0.00 H ATOM 91167 H2 WAT 372 31.469 81.566 140.699 1.00 0.00 H TER 91169 WAT 372 ATOM 91169 O WAT 373 47.991 24.223 120.510 1.00 0.00 O ATOM 91170 H1 WAT 373 48.075 23.880 119.620 1.00 0.00 H ATOM 91171 H2 WAT 373 47.194 24.753 120.488 1.00 0.00 H TER 91173 WAT 373 ATOM 91173 O WAT 374 77.779 3.533 150.490 1.00 0.00 O ATOM 91174 H1 WAT 374 77.067 2.959 150.774 1.00 0.00 H ATOM 91175 H2 WAT 374 78.570 3.126 150.842 1.00 0.00 H TER 91177 WAT 374 ATOM 91177 O WAT 375 77.446 68.825 91.198 1.00 0.00 O ATOM 91178 H1 WAT 375 77.553 67.877 91.273 1.00 0.00 H ATOM 91179 H2 WAT 375 78.065 69.187 91.832 1.00 0.00 H TER 91181 WAT 375 ATOM 91181 O WAT 376 140.766 59.050 139.504 1.00 0.00 O ATOM 91182 H1 WAT 376 141.066 58.214 139.147 1.00 0.00 H ATOM 91183 H2 WAT 376 141.551 59.447 139.880 1.00 0.00 H TER 91185 WAT 376 ATOM 91185 O WAT 377 4.457 26.821 11.471 1.00 0.00 O ATOM 91186 H1 WAT 377 3.675 26.969 12.003 1.00 0.00 H ATOM 91187 H2 WAT 377 4.232 26.073 10.917 1.00 0.00 H TER 91189 WAT 377 ATOM 91189 O WAT 378 136.316 85.029 103.774 1.00 0.00 O ATOM 91190 H1 WAT 378 136.678 85.609 104.443 1.00 0.00 H ATOM 91191 H2 WAT 378 136.870 84.249 103.808 1.00 0.00 H TER 91193 WAT 378 ATOM 91193 O WAT 379 21.714 18.809 112.946 1.00 0.00 O ATOM 91194 H1 WAT 379 22.508 18.825 113.481 1.00 0.00 H ATOM 91195 H2 WAT 379 21.046 19.217 113.498 1.00 0.00 H TER 91197 WAT 379 ATOM 91197 O WAT 380 115.621 112.144 100.784 1.00 0.00 O ATOM 91198 H1 WAT 380 114.764 111.914 101.143 1.00 0.00 H ATOM 91199 H2 WAT 380 115.446 112.359 99.868 1.00 0.00 H TER 91201 WAT 380 ATOM 91201 O WAT 381 50.557 75.124 13.496 1.00 0.00 O ATOM 91202 H1 WAT 381 50.300 75.220 14.414 1.00 0.00 H ATOM 91203 H2 WAT 381 50.040 75.783 13.033 1.00 0.00 H TER 91205 WAT 381 ATOM 91205 O WAT 382 26.707 88.901 13.567 1.00 0.00 O ATOM 91206 H1 WAT 382 27.215 88.142 13.280 1.00 0.00 H ATOM 91207 H2 WAT 382 27.306 89.393 14.128 1.00 0.00 H TER 91209 WAT 382 ATOM 91209 O WAT 383 88.431 65.840 5.404 1.00 0.00 O ATOM 91210 H1 WAT 383 88.181 66.568 5.973 1.00 0.00 H ATOM 91211 H2 WAT 383 88.463 66.221 4.527 1.00 0.00 H TER 91213 WAT 383 ATOM 91213 O WAT 384 58.878 88.798 83.049 1.00 0.00 O ATOM 91214 H1 WAT 384 58.911 89.428 82.329 1.00 0.00 H ATOM 91215 H2 WAT 384 58.618 87.975 82.636 1.00 0.00 H TER 91217 WAT 384 ATOM 91217 O WAT 385 101.615 82.616 89.329 1.00 0.00 O ATOM 91218 H1 WAT 385 100.867 82.052 89.132 1.00 0.00 H ATOM 91219 H2 WAT 385 101.467 83.402 88.803 1.00 0.00 H TER 91221 WAT 385 ATOM 91221 O WAT 386 120.693 128.640 125.069 1.00 0.00 O ATOM 91222 H1 WAT 386 121.448 128.524 124.492 1.00 0.00 H ATOM 91223 H2 WAT 386 120.620 127.809 125.538 1.00 0.00 H TER 91225 WAT 386 ATOM 91225 O WAT 387 87.924 34.526 65.589 1.00 0.00 O ATOM 91226 H1 WAT 387 87.392 33.746 65.430 1.00 0.00 H ATOM 91227 H2 WAT 387 88.210 34.802 64.718 1.00 0.00 H TER 91229 WAT 387 ATOM 91229 O WAT 388 95.614 135.539 7.350 1.00 0.00 O ATOM 91230 H1 WAT 388 96.524 135.444 7.071 1.00 0.00 H ATOM 91231 H2 WAT 388 95.149 134.836 6.895 1.00 0.00 H TER 91233 WAT 388 ATOM 91233 O WAT 389 22.150 63.825 63.631 1.00 0.00 O ATOM 91234 H1 WAT 389 22.729 63.238 64.117 1.00 0.00 H ATOM 91235 H2 WAT 389 22.398 63.703 62.715 1.00 0.00 H TER 91237 WAT 389 ATOM 91237 O WAT 390 82.783 86.373 61.586 1.00 0.00 O ATOM 91238 H1 WAT 390 82.437 86.041 62.414 1.00 0.00 H ATOM 91239 H2 WAT 390 82.031 86.784 61.160 1.00 0.00 H TER 91241 WAT 390 ATOM 91241 O WAT 391 4.910 52.703 8.568 1.00 0.00 O ATOM 91242 H1 WAT 391 5.803 52.615 8.235 1.00 0.00 H ATOM 91243 H2 WAT 391 4.834 53.626 8.810 1.00 0.00 H TER 91245 WAT 391 ATOM 91245 O WAT 392 81.529 143.893 135.326 1.00 0.00 O ATOM 91246 H1 WAT 392 81.298 144.393 136.109 1.00 0.00 H ATOM 91247 H2 WAT 392 81.432 142.978 135.590 1.00 0.00 H TER 91249 WAT 392 ATOM 91249 O WAT 393 66.254 132.560 142.087 1.00 0.00 O ATOM 91250 H1 WAT 393 66.720 132.769 141.278 1.00 0.00 H ATOM 91251 H2 WAT 393 66.286 131.605 142.143 1.00 0.00 H TER 91253 WAT 393 ATOM 91253 O WAT 394 89.200 102.724 94.899 1.00 0.00 O ATOM 91254 H1 WAT 394 88.872 102.386 94.065 1.00 0.00 H ATOM 91255 H2 WAT 394 89.934 103.288 94.657 1.00 0.00 H TER 91257 WAT 394 ATOM 91257 O WAT 395 62.094 60.673 131.133 1.00 0.00 O ATOM 91258 H1 WAT 395 61.567 61.099 130.457 1.00 0.00 H ATOM 91259 H2 WAT 395 62.513 59.939 130.684 1.00 0.00 H TER 91261 WAT 395 ATOM 91261 O WAT 396 84.801 20.114 117.711 1.00 0.00 O ATOM 91262 H1 WAT 396 85.615 19.812 117.307 1.00 0.00 H ATOM 91263 H2 WAT 396 84.605 19.453 118.376 1.00 0.00 H TER 91265 WAT 396 ATOM 91265 O WAT 397 24.945 56.668 112.962 1.00 0.00 O ATOM 91266 H1 WAT 397 25.383 55.820 113.036 1.00 0.00 H ATOM 91267 H2 WAT 397 25.505 57.177 112.377 1.00 0.00 H TER 91269 WAT 397 ATOM 91269 O WAT 398 136.571 35.995 67.217 1.00 0.00 O ATOM 91270 H1 WAT 398 135.966 35.828 67.939 1.00 0.00 H ATOM 91271 H2 WAT 398 137.262 36.534 67.603 1.00 0.00 H TER 91273 WAT 398 ATOM 91273 O WAT 399 82.804 144.309 70.456 1.00 0.00 O ATOM 91274 H1 WAT 399 82.362 144.182 71.295 1.00 0.00 H ATOM 91275 H2 WAT 399 82.218 144.883 69.961 1.00 0.00 H TER 91277 WAT 399 ATOM 91277 O WAT 400 3.691 7.458 111.298 1.00 0.00 O ATOM 91278 H1 WAT 400 3.124 6.703 111.458 1.00 0.00 H ATOM 91279 H2 WAT 400 3.256 7.940 110.595 1.00 0.00 H TER 91281 WAT 400 ATOM 91281 O WAT 401 61.850 38.297 100.491 1.00 0.00 O ATOM 91282 H1 WAT 401 61.052 38.766 100.733 1.00 0.00 H ATOM 91283 H2 WAT 401 62.265 38.084 101.327 1.00 0.00 H TER 91285 WAT 401 ATOM 91285 O WAT 402 55.906 14.919 6.656 1.00 0.00 O ATOM 91286 H1 WAT 402 55.382 15.113 5.879 1.00 0.00 H ATOM 91287 H2 WAT 402 55.695 14.009 6.866 1.00 0.00 H TER 91289 WAT 402 ATOM 91289 O WAT 403 64.993 129.315 78.583 1.00 0.00 O ATOM 91290 H1 WAT 403 64.984 128.872 79.432 1.00 0.00 H ATOM 91291 H2 WAT 403 64.846 130.237 78.793 1.00 0.00 H TER 91293 WAT 403 ATOM 91293 O WAT 404 126.635 104.642 18.849 1.00 0.00 O ATOM 91294 H1 WAT 404 126.697 105.247 19.588 1.00 0.00 H ATOM 91295 H2 WAT 404 127.191 105.031 18.174 1.00 0.00 H TER 91297 WAT 404 ATOM 91297 O WAT 405 12.846 0.452 126.123 1.00 0.00 O ATOM 91298 H1 WAT 405 12.240 0.682 126.827 1.00 0.00 H ATOM 91299 H2 WAT 405 12.358 0.633 125.319 1.00 0.00 H TER 91301 WAT 405 ATOM 91301 O WAT 406 144.327 47.829 70.479 1.00 0.00 O ATOM 91302 H1 WAT 406 145.250 47.926 70.713 1.00 0.00 H ATOM 91303 H2 WAT 406 143.964 47.265 71.163 1.00 0.00 H TER 91305 WAT 406 ATOM 91305 O WAT 407 97.246 102.342 94.721 1.00 0.00 O ATOM 91306 H1 WAT 407 97.542 103.042 95.303 1.00 0.00 H ATOM 91307 H2 WAT 407 96.598 102.760 94.154 1.00 0.00 H TER 91309 WAT 407 ATOM 91309 O WAT 408 124.025 3.525 95.497 1.00 0.00 O ATOM 91310 H1 WAT 408 124.799 2.970 95.586 1.00 0.00 H ATOM 91311 H2 WAT 408 124.345 4.412 95.660 1.00 0.00 H TER 91313 WAT 408 ATOM 91313 O WAT 409 126.119 6.839 104.394 1.00 0.00 O ATOM 91314 H1 WAT 409 126.296 6.147 105.031 1.00 0.00 H ATOM 91315 H2 WAT 409 126.812 7.482 104.540 1.00 0.00 H TER 91317 WAT 409 ATOM 91317 O WAT 410 55.490 12.360 58.263 1.00 0.00 O ATOM 91318 H1 WAT 410 55.561 13.289 58.482 1.00 0.00 H ATOM 91319 H2 WAT 410 55.525 12.336 57.307 1.00 0.00 H TER 91321 WAT 410 ATOM 91321 O WAT 411 88.414 31.269 76.485 1.00 0.00 O ATOM 91322 H1 WAT 411 87.850 32.013 76.272 1.00 0.00 H ATOM 91323 H2 WAT 411 88.835 31.516 77.309 1.00 0.00 H TER 91325 WAT 411 ATOM 91325 O WAT 412 96.594 75.799 138.837 1.00 0.00 O ATOM 91326 H1 WAT 412 95.703 75.977 138.534 1.00 0.00 H ATOM 91327 H2 WAT 412 96.610 76.125 139.737 1.00 0.00 H TER 91329 WAT 412 ATOM 91329 O WAT 413 32.925 142.361 110.134 1.00 0.00 O ATOM 91330 H1 WAT 413 32.171 142.097 110.662 1.00 0.00 H ATOM 91331 H2 WAT 413 32.636 143.157 109.686 1.00 0.00 H TER 91333 WAT 413 ATOM 91333 O WAT 414 127.909 23.127 65.420 1.00 0.00 O ATOM 91334 H1 WAT 414 128.647 23.238 66.019 1.00 0.00 H ATOM 91335 H2 WAT 414 127.157 22.974 65.992 1.00 0.00 H TER 91337 WAT 414 ATOM 91337 O WAT 415 40.964 23.468 152.729 1.00 0.00 O ATOM 91338 H1 WAT 415 41.294 22.665 152.327 1.00 0.00 H ATOM 91339 H2 WAT 415 41.489 23.572 153.523 1.00 0.00 H TER 91341 WAT 415 ATOM 91341 O WAT 416 56.765 40.556 151.441 1.00 0.00 O ATOM 91342 H1 WAT 416 55.861 40.722 151.176 1.00 0.00 H ATOM 91343 H2 WAT 416 57.108 39.969 150.768 1.00 0.00 H TER 91345 WAT 416 ATOM 91345 O WAT 417 67.905 138.199 97.404 1.00 0.00 O ATOM 91346 H1 WAT 417 67.692 139.004 97.877 1.00 0.00 H ATOM 91347 H2 WAT 417 68.784 138.349 97.058 1.00 0.00 H TER 91349 WAT 417 ATOM 91349 O WAT 418 13.299 82.803 67.172 1.00 0.00 O ATOM 91350 H1 WAT 418 12.821 83.603 66.954 1.00 0.00 H ATOM 91351 H2 WAT 418 12.615 82.151 67.328 1.00 0.00 H TER 91353 WAT 418 ATOM 91353 O WAT 419 56.874 132.794 78.964 1.00 0.00 O ATOM 91354 H1 WAT 419 57.266 132.338 78.219 1.00 0.00 H ATOM 91355 H2 WAT 419 55.935 132.794 78.778 1.00 0.00 H TER 91357 WAT 419 ATOM 91357 O WAT 420 130.565 141.468 139.537 1.00 0.00 O ATOM 91358 H1 WAT 420 131.259 140.844 139.327 1.00 0.00 H ATOM 91359 H2 WAT 420 130.651 141.613 140.480 1.00 0.00 H TER 91361 WAT 420 ATOM 91361 O WAT 421 56.661 12.798 13.679 1.00 0.00 O ATOM 91362 H1 WAT 421 57.530 13.199 13.637 1.00 0.00 H ATOM 91363 H2 WAT 421 56.305 13.086 14.519 1.00 0.00 H TER 91365 WAT 421 ATOM 91365 O WAT 422 103.510 133.721 3.270 1.00 0.00 O ATOM 91366 H1 WAT 422 103.470 134.579 2.848 1.00 0.00 H ATOM 91367 H2 WAT 422 104.026 133.183 2.669 1.00 0.00 H TER 91369 WAT 422 ATOM 91369 O WAT 423 132.113 53.260 77.343 1.00 0.00 O ATOM 91370 H1 WAT 423 131.655 53.434 78.165 1.00 0.00 H ATOM 91371 H2 WAT 423 132.286 54.127 76.977 1.00 0.00 H TER 91373 WAT 423 ATOM 91373 O WAT 424 29.628 127.499 138.485 1.00 0.00 O ATOM 91374 H1 WAT 424 29.017 127.575 139.218 1.00 0.00 H ATOM 91375 H2 WAT 424 30.222 126.793 138.742 1.00 0.00 H TER 91377 WAT 424 ATOM 91377 O WAT 425 93.865 29.351 7.325 1.00 0.00 O ATOM 91378 H1 WAT 425 93.849 29.751 8.194 1.00 0.00 H ATOM 91379 H2 WAT 425 92.959 29.403 7.020 1.00 0.00 H TER 91381 WAT 425 ATOM 91381 O WAT 426 83.113 109.094 28.304 1.00 0.00 O ATOM 91382 H1 WAT 426 84.070 109.104 28.335 1.00 0.00 H ATOM 91383 H2 WAT 426 82.889 109.723 27.619 1.00 0.00 H TER 91385 WAT 426 ATOM 91385 O WAT 427 38.975 136.316 157.430 1.00 0.00 O ATOM 91386 H1 WAT 427 38.947 136.619 156.523 1.00 0.00 H ATOM 91387 H2 WAT 427 38.220 135.734 157.512 1.00 0.00 H TER 91389 WAT 427 ATOM 91389 O WAT 428 29.793 72.091 96.897 1.00 0.00 O ATOM 91390 H1 WAT 428 30.594 71.908 97.388 1.00 0.00 H ATOM 91391 H2 WAT 428 29.165 72.375 97.561 1.00 0.00 H TER 91393 WAT 428 ATOM 91393 O WAT 429 64.725 47.517 139.836 1.00 0.00 O ATOM 91394 H1 WAT 429 65.081 48.204 139.272 1.00 0.00 H ATOM 91395 H2 WAT 429 63.819 47.415 139.546 1.00 0.00 H TER 91397 WAT 429 ATOM 91397 O WAT 430 6.757 51.642 64.699 1.00 0.00 O ATOM 91398 H1 WAT 430 7.095 51.054 65.375 1.00 0.00 H ATOM 91399 H2 WAT 430 6.301 52.329 65.185 1.00 0.00 H TER 91401 WAT 430 ATOM 91401 O WAT 431 133.174 141.814 121.634 1.00 0.00 O ATOM 91402 H1 WAT 431 133.581 141.009 121.956 1.00 0.00 H ATOM 91403 H2 WAT 431 133.116 141.689 120.686 1.00 0.00 H TER 91405 WAT 431 ATOM 91405 O WAT 432 71.792 29.690 2.287 1.00 0.00 O ATOM 91406 H1 WAT 432 72.001 30.438 1.728 1.00 0.00 H ATOM 91407 H2 WAT 432 71.084 29.238 1.827 1.00 0.00 H TER 91409 WAT 432 ATOM 91409 O WAT 433 19.174 127.901 8.809 1.00 0.00 O ATOM 91410 H1 WAT 433 18.327 127.910 8.363 1.00 0.00 H ATOM 91411 H2 WAT 433 19.575 128.739 8.579 1.00 0.00 H TER 91413 WAT 433 ATOM 91413 O WAT 434 66.856 36.968 136.371 1.00 0.00 O ATOM 91414 H1 WAT 434 67.110 36.362 137.067 1.00 0.00 H ATOM 91415 H2 WAT 434 66.055 36.591 136.006 1.00 0.00 H TER 91417 WAT 434 ATOM 91417 O WAT 435 96.664 103.224 117.126 1.00 0.00 O ATOM 91418 H1 WAT 435 95.814 103.333 116.701 1.00 0.00 H ATOM 91419 H2 WAT 435 96.686 102.303 117.386 1.00 0.00 H TER 91421 WAT 435 ATOM 91421 O WAT 436 12.156 7.197 84.370 1.00 0.00 O ATOM 91422 H1 WAT 436 11.444 6.702 83.966 1.00 0.00 H ATOM 91423 H2 WAT 436 11.944 8.113 84.189 1.00 0.00 H TER 91425 WAT 436 ATOM 91425 O WAT 437 126.618 56.681 73.287 1.00 0.00 O ATOM 91426 H1 WAT 437 127.439 56.938 73.706 1.00 0.00 H ATOM 91427 H2 WAT 437 126.355 57.451 72.784 1.00 0.00 H TER 91429 WAT 437 ATOM 91429 O WAT 438 93.269 11.628 85.238 1.00 0.00 O ATOM 91430 H1 WAT 438 93.936 10.978 85.018 1.00 0.00 H ATOM 91431 H2 WAT 438 93.457 12.369 84.662 1.00 0.00 H TER 91433 WAT 438 ATOM 91433 O WAT 439 60.667 116.390 2.742 1.00 0.00 O ATOM 91434 H1 WAT 439 60.501 116.008 3.604 1.00 0.00 H ATOM 91435 H2 WAT 439 60.809 115.637 2.169 1.00 0.00 H TER 91437 WAT 439 ATOM 91437 O WAT 440 5.433 34.159 97.372 1.00 0.00 O ATOM 91438 H1 WAT 440 4.640 33.950 96.878 1.00 0.00 H ATOM 91439 H2 WAT 440 5.744 34.979 96.990 1.00 0.00 H TER 91441 WAT 440 ATOM 91441 O WAT 441 92.817 87.400 150.673 1.00 0.00 O ATOM 91442 H1 WAT 441 92.879 87.410 151.629 1.00 0.00 H ATOM 91443 H2 WAT 441 93.357 86.656 150.406 1.00 0.00 H TER 91445 WAT 441 ATOM 91445 O WAT 442 12.845 99.627 73.176 1.00 0.00 O ATOM 91446 H1 WAT 442 12.044 99.117 73.296 1.00 0.00 H ATOM 91447 H2 WAT 442 13.552 98.988 73.269 1.00 0.00 H TER 91449 WAT 442 ATOM 91449 O WAT 443 68.246 124.072 82.832 1.00 0.00 O ATOM 91450 H1 WAT 443 67.717 123.392 82.415 1.00 0.00 H ATOM 91451 H2 WAT 443 68.167 124.828 82.250 1.00 0.00 H TER 91453 WAT 443 ATOM 91453 O WAT 444 89.868 22.691 19.573 1.00 0.00 O ATOM 91454 H1 WAT 444 90.281 21.863 19.818 1.00 0.00 H ATOM 91455 H2 WAT 444 88.939 22.560 19.763 1.00 0.00 H TER 91457 WAT 444 ATOM 91457 O WAT 445 133.275 61.271 74.859 1.00 0.00 O ATOM 91458 H1 WAT 445 133.070 61.559 75.749 1.00 0.00 H ATOM 91459 H2 WAT 445 133.292 60.315 74.915 1.00 0.00 H TER 91461 WAT 445 ATOM 91461 O WAT 446 129.472 87.477 1.880 1.00 0.00 O ATOM 91462 H1 WAT 446 129.865 87.927 1.132 1.00 0.00 H ATOM 91463 H2 WAT 446 129.982 87.773 2.633 1.00 0.00 H TER 91465 WAT 446 ATOM 91465 O WAT 447 38.021 36.276 132.073 1.00 0.00 O ATOM 91466 H1 WAT 447 37.326 35.637 131.914 1.00 0.00 H ATOM 91467 H2 WAT 447 38.194 36.214 133.012 1.00 0.00 H TER 91469 WAT 447 ATOM 91469 O WAT 448 20.491 3.987 8.901 1.00 0.00 O ATOM 91470 H1 WAT 448 20.166 3.092 8.799 1.00 0.00 H ATOM 91471 H2 WAT 448 19.813 4.535 8.506 1.00 0.00 H TER 91473 WAT 448 ATOM 91473 O WAT 449 33.265 61.955 71.177 1.00 0.00 O ATOM 91474 H1 WAT 449 33.998 62.040 71.788 1.00 0.00 H ATOM 91475 H2 WAT 449 32.809 62.795 71.231 1.00 0.00 H TER 91477 WAT 449 ATOM 91477 O WAT 450 128.141 105.543 154.674 1.00 0.00 O ATOM 91478 H1 WAT 450 127.948 104.738 154.193 1.00 0.00 H ATOM 91479 H2 WAT 450 128.861 105.945 154.189 1.00 0.00 H TER 91481 WAT 450 ATOM 91481 O WAT 451 24.951 84.573 136.776 1.00 0.00 O ATOM 91482 H1 WAT 451 25.659 84.438 136.147 1.00 0.00 H ATOM 91483 H2 WAT 451 24.643 85.463 136.603 1.00 0.00 H TER 91485 WAT 451 ATOM 91485 O WAT 452 74.689 79.994 149.800 1.00 0.00 O ATOM 91486 H1 WAT 452 74.562 79.802 148.871 1.00 0.00 H ATOM 91487 H2 WAT 452 74.673 80.950 149.851 1.00 0.00 H TER 91489 WAT 452 ATOM 91489 O WAT 453 33.148 98.719 103.736 1.00 0.00 O ATOM 91490 H1 WAT 453 33.645 98.178 103.122 1.00 0.00 H ATOM 91491 H2 WAT 453 33.506 98.498 104.595 1.00 0.00 H TER 91493 WAT 453 ATOM 91493 O WAT 454 122.394 42.841 83.429 1.00 0.00 O ATOM 91494 H1 WAT 454 121.999 42.762 84.297 1.00 0.00 H ATOM 91495 H2 WAT 454 122.436 41.942 83.102 1.00 0.00 H TER 91497 WAT 454 ATOM 91497 O WAT 455 13.236 45.154 118.449 1.00 0.00 O ATOM 91498 H1 WAT 455 14.041 45.665 118.355 1.00 0.00 H ATOM 91499 H2 WAT 455 13.532 44.244 118.478 1.00 0.00 H TER 91501 WAT 455 ATOM 91501 O WAT 456 39.288 142.327 93.269 1.00 0.00 O ATOM 91502 H1 WAT 456 39.659 142.587 94.112 1.00 0.00 H ATOM 91503 H2 WAT 456 40.038 142.305 92.674 1.00 0.00 H TER 91505 WAT 456 ATOM 91505 O WAT 457 44.274 4.647 20.999 1.00 0.00 O ATOM 91506 H1 WAT 457 43.835 5.245 20.394 1.00 0.00 H ATOM 91507 H2 WAT 457 43.651 3.932 21.124 1.00 0.00 H TER 91509 WAT 457 ATOM 91509 O WAT 458 44.643 87.831 3.927 1.00 0.00 O ATOM 91510 H1 WAT 458 43.719 88.076 3.984 1.00 0.00 H ATOM 91511 H2 WAT 458 44.751 87.151 4.591 1.00 0.00 H TER 91513 WAT 458 ATOM 91513 O WAT 459 25.322 94.364 62.311 1.00 0.00 O ATOM 91514 H1 WAT 459 25.401 95.204 62.762 1.00 0.00 H ATOM 91515 H2 WAT 459 24.688 93.871 62.833 1.00 0.00 H TER 91517 WAT 459 ATOM 91517 O WAT 460 29.491 120.683 116.156 1.00 0.00 O ATOM 91518 H1 WAT 460 28.915 121.349 116.532 1.00 0.00 H ATOM 91519 H2 WAT 460 29.614 120.958 115.247 1.00 0.00 H TER 91521 WAT 460 ATOM 91521 O WAT 461 39.448 37.842 102.786 1.00 0.00 O ATOM 91522 H1 WAT 461 39.599 38.630 103.308 1.00 0.00 H ATOM 91523 H2 WAT 461 39.890 38.016 101.956 1.00 0.00 H TER 91525 WAT 461 ATOM 91525 O WAT 462 79.360 102.410 2.909 1.00 0.00 O ATOM 91526 H1 WAT 462 80.089 103.016 2.776 1.00 0.00 H ATOM 91527 H2 WAT 462 79.237 101.992 2.056 1.00 0.00 H TER 91529 WAT 462 ATOM 91529 O WAT 463 91.569 92.639 64.461 1.00 0.00 O ATOM 91530 H1 WAT 463 92.206 92.134 63.955 1.00 0.00 H ATOM 91531 H2 WAT 463 90.913 91.996 64.730 1.00 0.00 H TER 91533 WAT 463 ATOM 91533 O WAT 464 135.996 17.507 70.377 1.00 0.00 O ATOM 91534 H1 WAT 464 135.654 17.307 69.506 1.00 0.00 H ATOM 91535 H2 WAT 464 136.916 17.245 70.339 1.00 0.00 H TER 91537 WAT 464 ATOM 91537 O WAT 465 128.542 83.219 65.769 1.00 0.00 O ATOM 91538 H1 WAT 465 128.911 83.484 64.927 1.00 0.00 H ATOM 91539 H2 WAT 465 128.559 84.016 66.300 1.00 0.00 H TER 91541 WAT 465 ATOM 91541 O WAT 466 36.082 33.506 4.139 1.00 0.00 O ATOM 91542 H1 WAT 466 35.276 33.841 3.746 1.00 0.00 H ATOM 91543 H2 WAT 466 36.102 32.581 3.893 1.00 0.00 H TER 91545 WAT 466 ATOM 91545 O WAT 467 1.226 42.454 84.495 1.00 0.00 O ATOM 91546 H1 WAT 467 0.858 42.761 85.323 1.00 0.00 H ATOM 91547 H2 WAT 467 2.125 42.783 84.496 1.00 0.00 H TER 91549 WAT 467 ATOM 91549 O WAT 468 80.990 75.319 69.165 1.00 0.00 O ATOM 91550 H1 WAT 468 80.714 75.228 70.077 1.00 0.00 H ATOM 91551 H2 WAT 468 80.171 75.367 68.671 1.00 0.00 H TER 91553 WAT 468 ATOM 91553 O WAT 469 56.043 99.107 139.522 1.00 0.00 O ATOM 91554 H1 WAT 469 56.880 99.343 139.123 1.00 0.00 H ATOM 91555 H2 WAT 469 55.384 99.444 138.914 1.00 0.00 H TER 91557 WAT 469 ATOM 91557 O WAT 470 94.716 0.817 140.175 1.00 0.00 O ATOM 91558 H1 WAT 470 94.589 0.832 139.226 1.00 0.00 H ATOM 91559 H2 WAT 470 95.653 0.967 140.294 1.00 0.00 H TER 91561 WAT 470 ATOM 91561 O WAT 471 17.357 91.533 23.995 1.00 0.00 O ATOM 91562 H1 WAT 471 17.382 91.827 24.906 1.00 0.00 H ATOM 91563 H2 WAT 471 17.190 92.330 23.491 1.00 0.00 H TER 91565 WAT 471 ATOM 91565 O WAT 472 20.512 129.020 81.838 1.00 0.00 O ATOM 91566 H1 WAT 472 20.292 129.707 81.209 1.00 0.00 H ATOM 91567 H2 WAT 472 19.814 129.062 82.492 1.00 0.00 H TER 91569 WAT 472 ATOM 91569 O WAT 473 97.240 104.802 20.998 1.00 0.00 O ATOM 91570 H1 WAT 473 97.144 105.584 20.455 1.00 0.00 H ATOM 91571 H2 WAT 473 98.119 104.874 21.370 1.00 0.00 H TER 91573 WAT 473 ATOM 91573 O WAT 474 105.140 21.281 94.909 1.00 0.00 O ATOM 91574 H1 WAT 474 105.145 21.832 94.126 1.00 0.00 H ATOM 91575 H2 WAT 474 104.894 21.875 95.618 1.00 0.00 H TER 91577 WAT 474 ATOM 91577 O WAT 475 35.684 17.591 154.380 1.00 0.00 O ATOM 91578 H1 WAT 475 36.209 17.930 153.654 1.00 0.00 H ATOM 91579 H2 WAT 475 36.072 16.738 154.577 1.00 0.00 H TER 91581 WAT 475 ATOM 91581 O WAT 476 42.794 17.698 123.359 1.00 0.00 O ATOM 91582 H1 WAT 476 43.665 17.837 123.731 1.00 0.00 H ATOM 91583 H2 WAT 476 42.849 18.061 122.476 1.00 0.00 H TER 91585 WAT 476 ATOM 91585 O WAT 477 61.946 107.758 130.519 1.00 0.00 O ATOM 91586 H1 WAT 477 61.855 106.819 130.357 1.00 0.00 H ATOM 91587 H2 WAT 477 61.486 107.904 131.346 1.00 0.00 H TER 91589 WAT 477 ATOM 91589 O WAT 478 131.936 89.593 148.092 1.00 0.00 O ATOM 91590 H1 WAT 478 131.599 90.032 148.873 1.00 0.00 H ATOM 91591 H2 WAT 478 131.767 88.664 148.248 1.00 0.00 H TER 91593 WAT 478 ATOM 91593 O WAT 479 11.073 76.458 73.750 1.00 0.00 O ATOM 91594 H1 WAT 479 11.254 76.785 72.868 1.00 0.00 H ATOM 91595 H2 WAT 479 11.790 76.800 74.284 1.00 0.00 H TER 91597 WAT 479 ATOM 91597 O WAT 480 70.721 52.913 2.791 1.00 0.00 O ATOM 91598 H1 WAT 480 70.479 53.835 2.697 1.00 0.00 H ATOM 91599 H2 WAT 480 70.323 52.645 3.619 1.00 0.00 H TER 91601 WAT 480 ATOM 91601 O WAT 481 104.076 145.804 57.306 1.00 0.00 O ATOM 91602 H1 WAT 481 104.672 145.901 58.048 1.00 0.00 H ATOM 91603 H2 WAT 481 104.236 144.917 56.984 1.00 0.00 H TER 91605 WAT 481 ATOM 91605 O WAT 482 8.869 78.123 129.668 1.00 0.00 O ATOM 91606 H1 WAT 482 9.529 78.807 129.783 1.00 0.00 H ATOM 91607 H2 WAT 482 8.287 78.464 128.989 1.00 0.00 H TER 91609 WAT 482 ATOM 91609 O WAT 483 102.177 141.810 70.739 1.00 0.00 O ATOM 91610 H1 WAT 483 102.578 142.301 71.457 1.00 0.00 H ATOM 91611 H2 WAT 483 102.112 140.914 71.069 1.00 0.00 H TER 91613 WAT 483 ATOM 91613 O WAT 484 55.307 39.271 65.584 1.00 0.00 O ATOM 91614 H1 WAT 484 55.376 38.354 65.316 1.00 0.00 H ATOM 91615 H2 WAT 484 55.833 39.328 66.381 1.00 0.00 H TER 91617 WAT 484 ATOM 91617 O WAT 485 20.900 98.318 67.169 1.00 0.00 O ATOM 91618 H1 WAT 485 20.073 98.177 67.630 1.00 0.00 H ATOM 91619 H2 WAT 485 21.217 99.159 67.497 1.00 0.00 H TER 91621 WAT 485 ATOM 91621 O WAT 486 7.203 1.618 158.230 1.00 0.00 O ATOM 91622 H1 WAT 486 6.895 1.883 159.096 1.00 0.00 H ATOM 91623 H2 WAT 486 7.337 0.673 158.302 1.00 0.00 H TER 91625 WAT 486 ATOM 91625 O WAT 487 66.671 42.390 17.520 1.00 0.00 O ATOM 91626 H1 WAT 487 67.101 42.370 18.375 1.00 0.00 H ATOM 91627 H2 WAT 487 67.130 41.725 17.006 1.00 0.00 H TER 91629 WAT 487 ATOM 91629 O WAT 488 118.426 101.143 69.128 1.00 0.00 O ATOM 91630 H1 WAT 488 117.601 101.244 68.653 1.00 0.00 H ATOM 91631 H2 WAT 488 118.331 101.705 69.897 1.00 0.00 H TER 91633 WAT 488 ATOM 91633 O WAT 489 79.248 1.886 145.016 1.00 0.00 O ATOM 91634 H1 WAT 489 79.091 2.734 144.602 1.00 0.00 H ATOM 91635 H2 WAT 489 78.918 1.247 144.384 1.00 0.00 H TER 91637 WAT 489 ATOM 91637 O WAT 490 63.627 35.441 11.808 1.00 0.00 O ATOM 91638 H1 WAT 490 63.863 35.629 12.716 1.00 0.00 H ATOM 91639 H2 WAT 490 62.681 35.295 11.832 1.00 0.00 H TER 91641 WAT 490 ATOM 91641 O WAT 491 74.899 85.850 147.279 1.00 0.00 O ATOM 91642 H1 WAT 491 74.356 85.126 146.968 1.00 0.00 H ATOM 91643 H2 WAT 491 74.702 86.571 146.681 1.00 0.00 H TER 91645 WAT 491 ATOM 91645 O WAT 492 3.980 77.592 149.485 1.00 0.00 O ATOM 91646 H1 WAT 492 3.055 77.348 149.473 1.00 0.00 H ATOM 91647 H2 WAT 492 3.995 78.452 149.906 1.00 0.00 H TER 91649 WAT 492 ATOM 91649 O WAT 493 132.452 42.862 146.404 1.00 0.00 O ATOM 91650 H1 WAT 493 132.981 42.706 145.622 1.00 0.00 H ATOM 91651 H2 WAT 493 132.106 43.747 146.286 1.00 0.00 H TER 91653 WAT 493 ATOM 91653 O WAT 494 5.075 11.848 98.127 1.00 0.00 O ATOM 91654 H1 WAT 494 5.802 11.257 97.931 1.00 0.00 H ATOM 91655 H2 WAT 494 4.782 12.160 97.271 1.00 0.00 H TER 91657 WAT 494 ATOM 91657 O WAT 495 39.175 55.395 97.100 1.00 0.00 O ATOM 91658 H1 WAT 495 39.040 54.533 96.706 1.00 0.00 H ATOM 91659 H2 WAT 495 39.996 55.310 97.586 1.00 0.00 H TER 91661 WAT 495 ATOM 91661 O WAT 496 129.401 133.536 14.848 1.00 0.00 O ATOM 91662 H1 WAT 496 128.810 133.418 14.104 1.00 0.00 H ATOM 91663 H2 WAT 496 129.893 134.330 14.639 1.00 0.00 H TER 91665 WAT 496 ATOM 91665 O WAT 497 107.216 110.208 89.170 1.00 0.00 O ATOM 91666 H1 WAT 497 107.771 109.692 88.585 1.00 0.00 H ATOM 91667 H2 WAT 497 106.743 109.557 89.687 1.00 0.00 H TER 91669 WAT 497 ATOM 91669 O WAT 498 51.571 119.835 100.593 1.00 0.00 O ATOM 91670 H1 WAT 498 51.289 118.924 100.672 1.00 0.00 H ATOM 91671 H2 WAT 498 51.927 120.051 101.455 1.00 0.00 H TER 91673 WAT 498 ATOM 91673 O WAT 499 78.241 66.959 117.599 1.00 0.00 O ATOM 91674 H1 WAT 499 77.348 66.711 117.357 1.00 0.00 H ATOM 91675 H2 WAT 499 78.795 66.513 116.958 1.00 0.00 H TER 91677 WAT 499 ATOM 91677 O WAT 500 115.998 108.023 9.736 1.00 0.00 O ATOM 91678 H1 WAT 500 115.139 108.133 10.144 1.00 0.00 H ATOM 91679 H2 WAT 500 115.990 107.127 9.400 1.00 0.00 H TER 91681 WAT 500 ATOM 91681 O WAT 501 127.778 103.791 15.743 1.00 0.00 O ATOM 91682 H1 WAT 501 127.100 103.376 15.209 1.00 0.00 H ATOM 91683 H2 WAT 501 128.484 103.145 15.778 1.00 0.00 H TER 91685 WAT 501 ATOM 91685 O WAT 502 127.102 75.611 95.688 1.00 0.00 O ATOM 91686 H1 WAT 502 126.682 74.755 95.761 1.00 0.00 H ATOM 91687 H2 WAT 502 128.026 75.441 95.873 1.00 0.00 H TER 91689 WAT 502 ATOM 91689 O WAT 503 76.191 105.016 137.493 1.00 0.00 O ATOM 91690 H1 WAT 503 75.607 105.061 136.736 1.00 0.00 H ATOM 91691 H2 WAT 503 76.947 104.518 137.184 1.00 0.00 H TER 91693 WAT 503 ATOM 91693 O WAT 504 69.387 98.857 89.683 1.00 0.00 O ATOM 91694 H1 WAT 504 69.212 99.058 90.602 1.00 0.00 H ATOM 91695 H2 WAT 504 69.806 99.647 89.341 1.00 0.00 H TER 91697 WAT 504 ATOM 91697 O WAT 505 19.564 53.137 7.035 1.00 0.00 O ATOM 91698 H1 WAT 505 19.777 52.892 6.134 1.00 0.00 H ATOM 91699 H2 WAT 505 20.299 53.683 7.314 1.00 0.00 H TER 91701 WAT 505 ATOM 91701 O WAT 506 86.720 85.727 98.024 1.00 0.00 O ATOM 91702 H1 WAT 506 87.413 86.387 97.986 1.00 0.00 H ATOM 91703 H2 WAT 506 86.822 85.322 98.885 1.00 0.00 H TER 91705 WAT 506 ATOM 91705 O WAT 507 21.498 73.255 66.543 1.00 0.00 O ATOM 91706 H1 WAT 507 20.918 74.016 66.524 1.00 0.00 H ATOM 91707 H2 WAT 507 22.270 73.530 66.047 1.00 0.00 H TER 91709 WAT 507 ATOM 91709 O WAT 508 102.813 136.998 8.899 1.00 0.00 O ATOM 91710 H1 WAT 508 101.901 136.856 9.152 1.00 0.00 H ATOM 91711 H2 WAT 508 103.137 137.649 9.521 1.00 0.00 H TER 91713 WAT 508 ATOM 91713 O WAT 509 56.733 27.677 13.491 1.00 0.00 O ATOM 91714 H1 WAT 509 57.118 28.316 14.091 1.00 0.00 H ATOM 91715 H2 WAT 509 57.418 27.019 13.371 1.00 0.00 H TER 91717 WAT 509 ATOM 91717 O WAT 510 60.022 57.758 84.586 1.00 0.00 O ATOM 91718 H1 WAT 510 60.846 57.364 84.299 1.00 0.00 H ATOM 91719 H2 WAT 510 59.499 57.827 83.788 1.00 0.00 H TER 91721 WAT 510 ATOM 91721 O WAT 511 71.448 25.289 139.274 1.00 0.00 O ATOM 91722 H1 WAT 511 71.792 25.269 138.381 1.00 0.00 H ATOM 91723 H2 WAT 511 71.228 26.209 139.425 1.00 0.00 H TER 91725 WAT 511 ATOM 91725 O WAT 512 115.717 88.207 10.339 1.00 0.00 O ATOM 91726 H1 WAT 512 116.420 88.542 9.783 1.00 0.00 H ATOM 91727 H2 WAT 512 115.229 88.987 10.604 1.00 0.00 H TER 91729 WAT 512 ATOM 91729 O WAT 513 34.031 28.546 84.859 1.00 0.00 O ATOM 91730 H1 WAT 513 34.476 27.720 85.050 1.00 0.00 H ATOM 91731 H2 WAT 513 33.643 28.414 83.994 1.00 0.00 H TER 91733 WAT 513 ATOM 91733 O WAT 514 11.346 3.736 10.184 1.00 0.00 O ATOM 91734 H1 WAT 514 10.932 2.945 10.528 1.00 0.00 H ATOM 91735 H2 WAT 514 10.644 4.387 10.170 1.00 0.00 H TER 91737 WAT 514 ATOM 91737 O WAT 515 71.501 33.080 140.313 1.00 0.00 O ATOM 91738 H1 WAT 515 71.557 32.689 139.441 1.00 0.00 H ATOM 91739 H2 WAT 515 72.411 33.145 140.605 1.00 0.00 H TER 91741 WAT 515 ATOM 91741 O WAT 516 98.666 3.413 96.992 1.00 0.00 O ATOM 91742 H1 WAT 516 98.232 4.237 97.213 1.00 0.00 H ATOM 91743 H2 WAT 516 97.963 2.851 96.666 1.00 0.00 H TER 91745 WAT 516 ATOM 91745 O WAT 517 112.019 66.157 64.106 1.00 0.00 O ATOM 91746 H1 WAT 517 112.570 65.675 63.489 1.00 0.00 H ATOM 91747 H2 WAT 517 112.302 67.067 64.018 1.00 0.00 H TER 91749 WAT 517 ATOM 91749 O WAT 518 99.554 128.238 2.861 1.00 0.00 O ATOM 91750 H1 WAT 518 100.343 128.759 2.710 1.00 0.00 H ATOM 91751 H2 WAT 518 99.570 127.574 2.171 1.00 0.00 H TER 91753 WAT 518 ATOM 91753 O WAT 519 114.109 55.602 137.995 1.00 0.00 O ATOM 91754 H1 WAT 519 114.199 54.691 138.276 1.00 0.00 H ATOM 91755 H2 WAT 519 113.166 55.761 137.997 1.00 0.00 H TER 91757 WAT 519 ATOM 91757 O WAT 520 33.973 37.274 88.040 1.00 0.00 O ATOM 91758 H1 WAT 520 34.029 36.419 87.612 1.00 0.00 H ATOM 91759 H2 WAT 520 33.915 37.899 87.318 1.00 0.00 H TER 91761 WAT 520 ATOM 91761 O WAT 521 5.235 88.970 59.993 1.00 0.00 O ATOM 91762 H1 WAT 521 4.816 88.572 59.229 1.00 0.00 H ATOM 91763 H2 WAT 521 6.138 89.124 59.717 1.00 0.00 H TER 91765 WAT 521 ATOM 91765 O WAT 522 90.145 42.881 114.271 1.00 0.00 O ATOM 91766 H1 WAT 522 90.445 42.138 113.747 1.00 0.00 H ATOM 91767 H2 WAT 522 90.304 42.615 115.177 1.00 0.00 H TER 91769 WAT 522 ATOM 91769 O WAT 523 124.438 120.216 80.940 1.00 0.00 O ATOM 91770 H1 WAT 523 123.501 120.239 81.135 1.00 0.00 H ATOM 91771 H2 WAT 523 124.735 119.376 81.288 1.00 0.00 H TER 91773 WAT 523 ATOM 91773 O WAT 524 48.345 92.987 84.196 1.00 0.00 O ATOM 91774 H1 WAT 524 47.963 92.115 84.295 1.00 0.00 H ATOM 91775 H2 WAT 524 48.520 93.067 83.258 1.00 0.00 H TER 91777 WAT 524 ATOM 91777 O WAT 525 33.775 55.366 100.065 1.00 0.00 O ATOM 91778 H1 WAT 525 34.408 55.051 100.710 1.00 0.00 H ATOM 91779 H2 WAT 525 33.244 54.598 99.856 1.00 0.00 H TER 91781 WAT 525 ATOM 91781 O WAT 526 13.577 9.225 76.663 1.00 0.00 O ATOM 91782 H1 WAT 526 14.155 9.987 76.697 1.00 0.00 H ATOM 91783 H2 WAT 526 13.347 9.140 75.738 1.00 0.00 H TER 91785 WAT 526 ATOM 91785 O WAT 527 114.711 118.193 9.566 1.00 0.00 O ATOM 91786 H1 WAT 527 114.050 118.811 9.255 1.00 0.00 H ATOM 91787 H2 WAT 527 115.433 118.281 8.943 1.00 0.00 H TER 91789 WAT 527 ATOM 91789 O WAT 528 1.294 82.416 131.700 1.00 0.00 O ATOM 91790 H1 WAT 528 2.088 82.051 131.310 1.00 0.00 H ATOM 91791 H2 WAT 528 0.863 82.877 130.980 1.00 0.00 H TER 91793 WAT 528 ATOM 91793 O WAT 529 111.838 34.801 59.915 1.00 0.00 O ATOM 91794 H1 WAT 529 111.660 35.259 59.093 1.00 0.00 H ATOM 91795 H2 WAT 529 111.198 34.089 59.936 1.00 0.00 H TER 91797 WAT 529 ATOM 91797 O WAT 530 91.789 63.975 131.373 1.00 0.00 O ATOM 91798 H1 WAT 530 91.893 63.595 130.501 1.00 0.00 H ATOM 91799 H2 WAT 530 91.301 64.785 131.225 1.00 0.00 H TER 91801 WAT 530 ATOM 91801 O WAT 531 35.661 43.775 114.248 1.00 0.00 O ATOM 91802 H1 WAT 531 36.590 43.603 114.402 1.00 0.00 H ATOM 91803 H2 WAT 531 35.209 43.271 114.925 1.00 0.00 H TER 91805 WAT 531 ATOM 91805 O WAT 532 20.618 30.539 14.213 1.00 0.00 O ATOM 91806 H1 WAT 532 21.026 29.787 14.642 1.00 0.00 H ATOM 91807 H2 WAT 532 21.090 30.628 13.385 1.00 0.00 H TER 91809 WAT 532 ATOM 91809 O WAT 533 16.379 125.402 117.096 1.00 0.00 O ATOM 91810 H1 WAT 533 17.212 125.276 116.641 1.00 0.00 H ATOM 91811 H2 WAT 533 15.814 124.707 116.757 1.00 0.00 H TER 91813 WAT 533 ATOM 91813 O WAT 534 70.413 43.332 12.825 1.00 0.00 O ATOM 91814 H1 WAT 534 69.877 42.540 12.777 1.00 0.00 H ATOM 91815 H2 WAT 534 70.724 43.466 11.930 1.00 0.00 H TER 91817 WAT 534 ATOM 91817 O WAT 535 35.505 109.786 16.435 1.00 0.00 O ATOM 91818 H1 WAT 535 36.340 109.689 16.894 1.00 0.00 H ATOM 91819 H2 WAT 535 35.424 108.988 15.912 1.00 0.00 H TER 91821 WAT 535 ATOM 91821 O WAT 536 21.229 134.594 155.211 1.00 0.00 O ATOM 91822 H1 WAT 536 20.656 135.328 155.429 1.00 0.00 H ATOM 91823 H2 WAT 536 20.657 133.827 155.240 1.00 0.00 H TER 91825 WAT 536 ATOM 91825 O WAT 537 69.920 8.123 91.021 1.00 0.00 O ATOM 91826 H1 WAT 537 69.263 7.679 90.485 1.00 0.00 H ATOM 91827 H2 WAT 537 70.343 8.737 90.421 1.00 0.00 H TER 91829 WAT 537 ATOM 91829 O WAT 538 35.688 94.877 148.006 1.00 0.00 O ATOM 91830 H1 WAT 538 35.794 95.758 147.646 1.00 0.00 H ATOM 91831 H2 WAT 538 35.945 94.961 148.924 1.00 0.00 H TER 91833 WAT 538 ATOM 91833 O WAT 539 103.681 15.231 143.373 1.00 0.00 O ATOM 91834 H1 WAT 539 104.441 15.800 143.249 1.00 0.00 H ATOM 91835 H2 WAT 539 103.328 15.485 144.225 1.00 0.00 H TER 91837 WAT 539 ATOM 91837 O WAT 540 47.804 25.405 11.636 1.00 0.00 O ATOM 91838 H1 WAT 540 48.115 24.711 11.055 1.00 0.00 H ATOM 91839 H2 WAT 540 47.048 25.777 11.181 1.00 0.00 H TER 91841 WAT 540 ATOM 91841 O WAT 541 87.259 69.276 139.954 1.00 0.00 O ATOM 91842 H1 WAT 541 87.667 68.844 139.203 1.00 0.00 H ATOM 91843 H2 WAT 541 87.737 70.100 140.044 1.00 0.00 H TER 91845 WAT 541 ATOM 91845 O WAT 542 127.884 24.193 15.230 1.00 0.00 O ATOM 91846 H1 WAT 542 128.408 24.986 15.119 1.00 0.00 H ATOM 91847 H2 WAT 542 128.303 23.729 15.955 1.00 0.00 H TER 91849 WAT 542 ATOM 91849 O WAT 543 80.178 109.965 83.041 1.00 0.00 O ATOM 91850 H1 WAT 543 80.463 109.562 83.862 1.00 0.00 H ATOM 91851 H2 WAT 543 80.640 110.803 83.013 1.00 0.00 H TER 91853 WAT 543 ATOM 91853 O WAT 544 37.804 118.429 112.389 1.00 0.00 O ATOM 91854 H1 WAT 544 37.944 119.375 112.404 1.00 0.00 H ATOM 91855 H2 WAT 544 36.934 118.309 112.770 1.00 0.00 H TER 91857 WAT 544 ATOM 91857 O WAT 545 61.412 13.683 139.252 1.00 0.00 O ATOM 91858 H1 WAT 545 61.034 13.009 139.816 1.00 0.00 H ATOM 91859 H2 WAT 545 60.660 14.186 138.942 1.00 0.00 H TER 91861 WAT 545 ATOM 91861 O WAT 546 46.659 137.928 142.321 1.00 0.00 O ATOM 91862 H1 WAT 546 46.903 138.417 143.107 1.00 0.00 H ATOM 91863 H2 WAT 546 47.243 138.263 141.641 1.00 0.00 H TER 91865 WAT 546 ATOM 91865 O WAT 547 96.001 118.747 68.404 1.00 0.00 O ATOM 91866 H1 WAT 547 95.733 118.532 67.511 1.00 0.00 H ATOM 91867 H2 WAT 547 96.136 117.898 68.825 1.00 0.00 H TER 91869 WAT 547 ATOM 91869 O WAT 548 36.257 39.158 92.987 1.00 0.00 O ATOM 91870 H1 WAT 548 35.647 38.994 93.707 1.00 0.00 H ATOM 91871 H2 WAT 548 36.883 38.436 93.035 1.00 0.00 H TER 91873 WAT 548 ATOM 91873 O WAT 549 91.330 23.950 9.904 1.00 0.00 O ATOM 91874 H1 WAT 549 91.767 24.574 9.324 1.00 0.00 H ATOM 91875 H2 WAT 549 91.589 23.091 9.570 1.00 0.00 H TER 91877 WAT 549 ATOM 91877 O WAT 550 57.585 86.573 143.723 1.00 0.00 O ATOM 91878 H1 WAT 550 56.920 87.235 143.909 1.00 0.00 H ATOM 91879 H2 WAT 550 57.702 86.111 144.553 1.00 0.00 H TER 91881 WAT 550 ATOM 91881 O WAT 551 110.153 78.174 61.417 1.00 0.00 O ATOM 91882 H1 WAT 551 110.349 77.482 62.049 1.00 0.00 H ATOM 91883 H2 WAT 551 110.833 78.089 60.749 1.00 0.00 H TER 91885 WAT 551 ATOM 91885 O WAT 552 47.473 110.216 79.695 1.00 0.00 O ATOM 91886 H1 WAT 552 46.876 109.793 79.077 1.00 0.00 H ATOM 91887 H2 WAT 552 48.274 109.694 79.650 1.00 0.00 H TER 91889 WAT 552 ATOM 91889 O WAT 553 120.956 134.422 143.161 1.00 0.00 O ATOM 91890 H1 WAT 553 121.069 135.304 143.516 1.00 0.00 H ATOM 91891 H2 WAT 553 121.247 134.491 142.252 1.00 0.00 H TER 91893 WAT 553 ATOM 91893 O WAT 554 79.160 56.355 113.235 1.00 0.00 O ATOM 91894 H1 WAT 554 78.764 57.178 112.947 1.00 0.00 H ATOM 91895 H2 WAT 554 79.920 56.623 113.752 1.00 0.00 H TER 91897 WAT 554 ATOM 91897 O WAT 555 5.523 90.524 64.024 1.00 0.00 O ATOM 91898 H1 WAT 555 4.759 91.056 64.251 1.00 0.00 H ATOM 91899 H2 WAT 555 6.251 90.945 64.480 1.00 0.00 H TER 91901 WAT 555 ATOM 91901 O WAT 556 21.443 55.199 16.587 1.00 0.00 O ATOM 91902 H1 WAT 556 20.794 54.513 16.743 1.00 0.00 H ATOM 91903 H2 WAT 556 22.271 54.727 16.492 1.00 0.00 H TER 91905 WAT 556 ATOM 91905 O WAT 557 59.884 124.900 83.107 1.00 0.00 O ATOM 91906 H1 WAT 557 60.788 124.845 82.798 1.00 0.00 H ATOM 91907 H2 WAT 557 59.942 124.739 84.049 1.00 0.00 H TER 91909 WAT 557 ATOM 91909 O WAT 558 28.698 105.636 138.702 1.00 0.00 O ATOM 91910 H1 WAT 558 29.499 106.051 138.380 1.00 0.00 H ATOM 91911 H2 WAT 558 28.363 105.147 137.950 1.00 0.00 H TER 91913 WAT 558 ATOM 91913 O WAT 559 52.936 116.308 51.796 1.00 0.00 O ATOM 91914 H1 WAT 559 53.725 116.827 51.951 1.00 0.00 H ATOM 91915 H2 WAT 559 53.207 115.643 51.163 1.00 0.00 H TER 91917 WAT 559 ATOM 91917 O WAT 560 18.598 95.098 72.305 1.00 0.00 O ATOM 91918 H1 WAT 560 17.757 95.128 71.848 1.00 0.00 H ATOM 91919 H2 WAT 560 18.827 94.169 72.326 1.00 0.00 H TER 91921 WAT 560 ATOM 91921 O WAT 561 38.756 96.032 114.400 1.00 0.00 O ATOM 91922 H1 WAT 561 39.335 96.523 114.983 1.00 0.00 H ATOM 91923 H2 WAT 561 38.540 96.650 113.701 1.00 0.00 H TER 91925 WAT 561 ATOM 91925 O WAT 562 82.490 6.735 103.726 1.00 0.00 O ATOM 91926 H1 WAT 562 83.320 6.421 103.367 1.00 0.00 H ATOM 91927 H2 WAT 562 82.097 7.241 103.014 1.00 0.00 H TER 91929 WAT 562 ATOM 91929 O WAT 563 12.506 69.328 92.682 1.00 0.00 O ATOM 91930 H1 WAT 563 11.654 69.301 93.119 1.00 0.00 H ATOM 91931 H2 WAT 563 13.117 68.971 93.326 1.00 0.00 H TER 91933 WAT 563 ATOM 91933 O WAT 564 77.058 61.146 102.161 1.00 0.00 O ATOM 91934 H1 WAT 564 76.833 62.006 101.807 1.00 0.00 H ATOM 91935 H2 WAT 564 76.700 60.525 101.527 1.00 0.00 H TER 91937 WAT 564 ATOM 91937 O WAT 565 93.494 56.271 14.526 1.00 0.00 O ATOM 91938 H1 WAT 565 92.801 55.712 14.879 1.00 0.00 H ATOM 91939 H2 WAT 565 93.028 57.000 14.117 1.00 0.00 H TER 91941 WAT 565 ATOM 91941 O WAT 566 20.771 113.483 65.379 1.00 0.00 O ATOM 91942 H1 WAT 566 20.762 113.908 66.236 1.00 0.00 H ATOM 91943 H2 WAT 566 19.963 113.777 64.957 1.00 0.00 H TER 91945 WAT 566 ATOM 91945 O WAT 567 17.650 140.872 106.639 1.00 0.00 O ATOM 91946 H1 WAT 567 17.854 140.894 105.704 1.00 0.00 H ATOM 91947 H2 WAT 567 18.253 141.504 107.030 1.00 0.00 H TER 91949 WAT 567 ATOM 91949 O WAT 568 2.356 129.072 115.023 1.00 0.00 O ATOM 91950 H1 WAT 568 1.923 128.449 114.439 1.00 0.00 H ATOM 91951 H2 WAT 568 2.537 128.569 115.817 1.00 0.00 H TER 91953 WAT 568 ATOM 91953 O WAT 569 90.433 81.432 87.973 1.00 0.00 O ATOM 91954 H1 WAT 569 91.086 81.767 87.358 1.00 0.00 H ATOM 91955 H2 WAT 569 90.929 80.868 88.566 1.00 0.00 H TER 91957 WAT 569 ATOM 91957 O WAT 570 117.350 27.757 73.723 1.00 0.00 O ATOM 91958 H1 WAT 570 117.755 27.105 73.151 1.00 0.00 H ATOM 91959 H2 WAT 570 116.457 27.845 73.391 1.00 0.00 H TER 91961 WAT 570 ATOM 91961 O WAT 571 20.880 125.123 9.867 1.00 0.00 O ATOM 91962 H1 WAT 571 21.643 125.611 9.557 1.00 0.00 H ATOM 91963 H2 WAT 571 20.311 125.789 10.255 1.00 0.00 H TER 91965 WAT 571 ATOM 91965 O WAT 572 32.248 40.969 106.909 1.00 0.00 O ATOM 91966 H1 WAT 572 32.889 41.534 106.477 1.00 0.00 H ATOM 91967 H2 WAT 572 32.736 40.173 107.122 1.00 0.00 H TER 91969 WAT 572 ATOM 91969 O WAT 573 36.966 50.108 100.662 1.00 0.00 O ATOM 91970 H1 WAT 573 37.171 50.955 100.265 1.00 0.00 H ATOM 91971 H2 WAT 573 37.752 49.880 101.158 1.00 0.00 H TER 91973 WAT 573 ATOM 91973 O WAT 574 0.198 87.065 136.816 1.00 0.00 O ATOM 91974 H1 WAT 574 0.734 86.273 136.859 1.00 0.00 H ATOM 91975 H2 WAT 574 -0.232 87.017 135.963 1.00 0.00 H TER 91977 WAT 574 ATOM 91977 O WAT 575 118.792 117.815 134.988 1.00 0.00 O ATOM 91978 H1 WAT 575 118.264 117.019 135.044 1.00 0.00 H ATOM 91979 H2 WAT 575 118.287 118.472 135.466 1.00 0.00 H TER 91981 WAT 575 ATOM 91981 O WAT 576 134.029 64.767 124.854 1.00 0.00 O ATOM 91982 H1 WAT 576 134.176 63.821 124.843 1.00 0.00 H ATOM 91983 H2 WAT 576 133.078 64.862 124.898 1.00 0.00 H TER 91985 WAT 576 ATOM 91985 O WAT 577 67.885 25.952 106.296 1.00 0.00 O ATOM 91986 H1 WAT 577 67.838 26.014 107.250 1.00 0.00 H ATOM 91987 H2 WAT 577 67.088 25.484 106.047 1.00 0.00 H TER 91989 WAT 577 ATOM 91989 O WAT 578 66.497 25.411 97.517 1.00 0.00 O ATOM 91990 H1 WAT 578 66.971 24.877 96.879 1.00 0.00 H ATOM 91991 H2 WAT 578 65.867 24.808 97.912 1.00 0.00 H TER 91993 WAT 578 ATOM 91993 O WAT 579 47.957 55.114 112.638 1.00 0.00 O ATOM 91994 H1 WAT 579 47.218 55.573 113.038 1.00 0.00 H ATOM 91995 H2 WAT 579 48.719 55.651 112.857 1.00 0.00 H TER 91997 WAT 579 ATOM 91997 O WAT 580 75.574 63.939 96.539 1.00 0.00 O ATOM 91998 H1 WAT 580 75.997 63.476 95.815 1.00 0.00 H ATOM 91999 H2 WAT 580 75.968 64.811 96.528 1.00 0.00 H TER 92001 WAT 580 ATOM 92001 O WAT 581 50.253 29.858 146.985 1.00 0.00 O ATOM 92002 H1 WAT 581 50.648 30.572 147.485 1.00 0.00 H ATOM 92003 H2 WAT 581 49.964 29.232 147.649 1.00 0.00 H TER 92005 WAT 581 ATOM 92005 O WAT 582 129.707 23.064 72.565 1.00 0.00 O ATOM 92006 H1 WAT 582 128.805 23.093 72.246 1.00 0.00 H ATOM 92007 H2 WAT 582 130.229 22.856 71.790 1.00 0.00 H TER 92009 WAT 582 ATOM 92009 O WAT 583 47.243 74.762 4.258 1.00 0.00 O ATOM 92010 H1 WAT 583 47.279 74.661 3.307 1.00 0.00 H ATOM 92011 H2 WAT 583 46.952 75.664 4.393 1.00 0.00 H TER 92013 WAT 583 ATOM 92013 O WAT 584 40.170 22.050 18.585 1.00 0.00 O ATOM 92014 H1 WAT 584 40.817 22.459 19.160 1.00 0.00 H ATOM 92015 H2 WAT 584 39.546 22.749 18.390 1.00 0.00 H TER 92017 WAT 584 ATOM 92017 O WAT 585 140.780 3.554 122.878 1.00 0.00 O ATOM 92018 H1 WAT 585 140.374 4.081 123.567 1.00 0.00 H ATOM 92019 H2 WAT 585 141.555 3.175 123.292 1.00 0.00 H TER 92021 WAT 585 ATOM 92021 O WAT 586 102.348 78.079 127.250 1.00 0.00 O ATOM 92022 H1 WAT 586 102.171 78.464 126.392 1.00 0.00 H ATOM 92023 H2 WAT 586 103.039 77.438 127.087 1.00 0.00 H TER 92025 WAT 586 ATOM 92025 O WAT 587 137.070 97.324 94.879 1.00 0.00 O ATOM 92026 H1 WAT 587 137.415 98.147 94.533 1.00 0.00 H ATOM 92027 H2 WAT 587 137.826 96.897 95.283 1.00 0.00 H TER 92029 WAT 587 ATOM 92029 O WAT 588 44.242 103.156 111.770 1.00 0.00 O ATOM 92030 H1 WAT 588 44.603 103.028 112.647 1.00 0.00 H ATOM 92031 H2 WAT 588 43.820 104.014 111.808 1.00 0.00 H TER 92033 WAT 588 ATOM 92033 O WAT 589 129.827 47.057 67.743 1.00 0.00 O ATOM 92034 H1 WAT 589 130.391 46.472 67.237 1.00 0.00 H ATOM 92035 H2 WAT 589 128.939 46.745 67.567 1.00 0.00 H TER 92037 WAT 589 ATOM 92037 O WAT 590 13.457 103.177 63.415 1.00 0.00 O ATOM 92038 H1 WAT 590 12.886 103.410 64.146 1.00 0.00 H ATOM 92039 H2 WAT 590 13.386 103.915 62.810 1.00 0.00 H TER 92041 WAT 590 ATOM 92041 O WAT 591 50.671 29.828 23.248 1.00 0.00 O ATOM 92042 H1 WAT 591 50.228 29.251 22.627 1.00 0.00 H ATOM 92043 H2 WAT 591 50.804 29.286 24.026 1.00 0.00 H TER 92045 WAT 591 ATOM 92045 O WAT 592 105.111 120.553 72.531 1.00 0.00 O ATOM 92046 H1 WAT 592 105.291 121.482 72.386 1.00 0.00 H ATOM 92047 H2 WAT 592 104.164 120.472 72.415 1.00 0.00 H TER 92049 WAT 592 ATOM 92049 O WAT 593 82.207 37.138 106.210 1.00 0.00 O ATOM 92050 H1 WAT 593 81.796 36.283 106.334 1.00 0.00 H ATOM 92051 H2 WAT 593 82.140 37.562 107.066 1.00 0.00 H TER 92053 WAT 593 ATOM 92053 O WAT 594 45.937 136.918 90.453 1.00 0.00 O ATOM 92054 H1 WAT 594 45.397 137.440 91.046 1.00 0.00 H ATOM 92055 H2 WAT 594 46.467 137.563 89.983 1.00 0.00 H TER 92057 WAT 594 ATOM 92057 O WAT 595 90.697 143.336 89.538 1.00 0.00 O ATOM 92058 H1 WAT 595 90.213 143.515 88.732 1.00 0.00 H ATOM 92059 H2 WAT 595 91.026 144.191 89.815 1.00 0.00 H TER 92061 WAT 595 ATOM 92061 O WAT 596 64.892 142.668 101.133 1.00 0.00 O ATOM 92062 H1 WAT 596 64.215 142.486 100.482 1.00 0.00 H ATOM 92063 H2 WAT 596 65.563 143.153 100.652 1.00 0.00 H TER 92065 WAT 596 ATOM 92065 O WAT 597 144.288 102.958 122.187 1.00 0.00 O ATOM 92066 H1 WAT 597 144.100 103.481 121.408 1.00 0.00 H ATOM 92067 H2 WAT 597 144.932 103.473 122.672 1.00 0.00 H TER 92069 WAT 597 ATOM 92069 O WAT 598 60.773 53.993 145.422 1.00 0.00 O ATOM 92070 H1 WAT 598 61.602 53.611 145.135 1.00 0.00 H ATOM 92071 H2 WAT 598 60.484 53.426 146.137 1.00 0.00 H TER 92073 WAT 598 ATOM 92073 O WAT 599 16.096 87.359 96.791 1.00 0.00 O ATOM 92074 H1 WAT 599 16.425 86.465 96.887 1.00 0.00 H ATOM 92075 H2 WAT 599 15.718 87.381 95.912 1.00 0.00 H TER 92077 WAT 599 ATOM 92077 O WAT 600 133.646 12.706 100.192 1.00 0.00 O ATOM 92078 H1 WAT 600 133.830 11.829 99.855 1.00 0.00 H ATOM 92079 H2 WAT 600 134.241 12.806 100.936 1.00 0.00 H TER 92081 WAT 600 ATOM 92081 O WAT 601 139.868 128.403 20.777 1.00 0.00 O ATOM 92082 H1 WAT 601 140.594 128.759 21.289 1.00 0.00 H ATOM 92083 H2 WAT 601 140.251 128.209 19.921 1.00 0.00 H TER 92085 WAT 601 ATOM 92085 O WAT 602 20.109 72.207 110.245 1.00 0.00 O ATOM 92086 H1 WAT 602 20.068 71.397 109.738 1.00 0.00 H ATOM 92087 H2 WAT 602 20.497 71.948 111.081 1.00 0.00 H TER 92089 WAT 602 ATOM 92089 O WAT 603 76.674 139.995 148.400 1.00 0.00 O ATOM 92090 H1 WAT 603 75.925 140.396 147.959 1.00 0.00 H ATOM 92091 H2 WAT 603 76.855 139.204 147.892 1.00 0.00 H TER 92093 WAT 603 ATOM 92093 O WAT 604 52.782 71.579 132.623 1.00 0.00 O ATOM 92094 H1 WAT 604 53.241 70.884 133.095 1.00 0.00 H ATOM 92095 H2 WAT 604 52.080 71.848 133.215 1.00 0.00 H TER 92097 WAT 604 ATOM 92097 O WAT 605 136.881 54.866 84.396 1.00 0.00 O ATOM 92098 H1 WAT 605 136.539 54.951 85.286 1.00 0.00 H ATOM 92099 H2 WAT 605 136.822 55.749 84.031 1.00 0.00 H TER 92101 WAT 605 ATOM 92101 O WAT 606 38.487 4.769 85.350 1.00 0.00 O ATOM 92102 H1 WAT 606 38.720 4.453 86.223 1.00 0.00 H ATOM 92103 H2 WAT 606 39.324 5.005 84.949 1.00 0.00 H TER 92105 WAT 606 ATOM 92105 O WAT 607 100.561 120.024 18.599 1.00 0.00 O ATOM 92106 H1 WAT 607 100.110 120.344 19.380 1.00 0.00 H ATOM 92107 H2 WAT 607 101.095 119.294 18.911 1.00 0.00 H TER 92109 WAT 607 ATOM 92109 O WAT 608 14.457 91.230 117.565 1.00 0.00 O ATOM 92110 H1 WAT 608 13.901 91.973 117.330 1.00 0.00 H ATOM 92111 H2 WAT 608 14.290 91.092 118.498 1.00 0.00 H TER 92113 WAT 608 ATOM 92113 O WAT 609 41.501 26.096 118.606 1.00 0.00 O ATOM 92114 H1 WAT 609 41.731 26.980 118.322 1.00 0.00 H ATOM 92115 H2 WAT 609 42.328 25.715 118.899 1.00 0.00 H TER 92117 WAT 609 ATOM 92117 O WAT 610 68.291 76.676 68.278 1.00 0.00 O ATOM 92118 H1 WAT 610 68.019 76.193 67.498 1.00 0.00 H ATOM 92119 H2 WAT 610 68.541 75.998 68.905 1.00 0.00 H TER 92121 WAT 610 ATOM 92121 O WAT 611 61.725 68.305 92.449 1.00 0.00 O ATOM 92122 H1 WAT 611 60.888 67.908 92.209 1.00 0.00 H ATOM 92123 H2 WAT 611 62.223 67.591 92.848 1.00 0.00 H TER 92125 WAT 611 ATOM 92125 O WAT 612 59.954 102.566 8.267 1.00 0.00 O ATOM 92126 H1 WAT 612 60.189 103.118 9.013 1.00 0.00 H ATOM 92127 H2 WAT 612 59.800 101.702 8.648 1.00 0.00 H TER 92129 WAT 612 ATOM 92129 O WAT 613 138.985 137.293 114.659 1.00 0.00 O ATOM 92130 H1 WAT 613 138.492 138.033 115.014 1.00 0.00 H ATOM 92131 H2 WAT 613 139.192 137.551 113.761 1.00 0.00 H TER 92133 WAT 613 ATOM 92133 O WAT 614 64.004 128.251 13.867 1.00 0.00 O ATOM 92134 H1 WAT 614 63.177 127.774 13.797 1.00 0.00 H ATOM 92135 H2 WAT 614 64.120 128.391 14.807 1.00 0.00 H TER 92137 WAT 614 ATOM 92137 O WAT 615 136.513 127.841 122.144 1.00 0.00 O ATOM 92138 H1 WAT 615 136.787 128.030 123.042 1.00 0.00 H ATOM 92139 H2 WAT 615 136.920 126.998 121.943 1.00 0.00 H TER 92141 WAT 615 ATOM 92141 O WAT 616 73.042 108.624 108.939 1.00 0.00 O ATOM 92142 H1 WAT 616 73.063 107.703 109.199 1.00 0.00 H ATOM 92143 H2 WAT 616 73.021 108.602 107.982 1.00 0.00 H TER 92145 WAT 616 ATOM 92145 O WAT 617 136.709 90.919 31.612 1.00 0.00 O ATOM 92146 H1 WAT 617 137.230 90.347 32.176 1.00 0.00 H ATOM 92147 H2 WAT 617 135.915 90.416 31.429 1.00 0.00 H TER 92149 WAT 617 ATOM 92149 O WAT 618 49.626 89.184 7.172 1.00 0.00 O ATOM 92150 H1 WAT 618 49.994 88.484 7.711 1.00 0.00 H ATOM 92151 H2 WAT 618 49.235 88.730 6.425 1.00 0.00 H TER 92153 WAT 618 ATOM 92153 O WAT 619 77.202 46.025 101.178 1.00 0.00 O ATOM 92154 H1 WAT 619 76.268 46.207 101.076 1.00 0.00 H ATOM 92155 H2 WAT 619 77.244 45.085 101.353 1.00 0.00 H TER 92157 WAT 619 ATOM 92157 O WAT 620 50.245 8.515 66.428 1.00 0.00 O ATOM 92158 H1 WAT 620 49.538 8.950 65.951 1.00 0.00 H ATOM 92159 H2 WAT 620 50.404 7.709 65.937 1.00 0.00 H TER 92161 WAT 620 ATOM 92161 O WAT 621 114.377 3.994 124.938 1.00 0.00 O ATOM 92162 H1 WAT 621 114.352 3.044 125.057 1.00 0.00 H ATOM 92163 H2 WAT 621 113.940 4.344 125.715 1.00 0.00 H TER 92165 WAT 621 ATOM 92165 O WAT 622 73.924 94.981 1.253 1.00 0.00 O ATOM 92166 H1 WAT 622 74.666 94.515 0.868 1.00 0.00 H ATOM 92167 H2 WAT 622 74.080 95.900 1.039 1.00 0.00 H TER 92169 WAT 622 ATOM 92169 O WAT 623 108.540 121.903 133.419 1.00 0.00 O ATOM 92170 H1 WAT 623 107.690 121.664 133.787 1.00 0.00 H ATOM 92171 H2 WAT 623 109.177 121.572 134.052 1.00 0.00 H TER 92173 WAT 623 ATOM 92173 O WAT 624 144.806 53.403 103.081 1.00 0.00 O ATOM 92174 H1 WAT 624 144.524 53.696 103.948 1.00 0.00 H ATOM 92175 H2 WAT 624 145.722 53.675 103.023 1.00 0.00 H TER 92177 WAT 624 ATOM 92177 O WAT 625 104.631 28.581 108.548 1.00 0.00 O ATOM 92178 H1 WAT 625 105.118 28.913 107.793 1.00 0.00 H ATOM 92179 H2 WAT 625 105.304 28.221 109.126 1.00 0.00 H TER 92181 WAT 625 ATOM 92181 O WAT 626 141.894 100.890 102.557 1.00 0.00 O ATOM 92182 H1 WAT 626 142.178 101.373 101.781 1.00 0.00 H ATOM 92183 H2 WAT 626 142.706 100.678 103.018 1.00 0.00 H TER 92185 WAT 626 ATOM 92185 O WAT 627 118.860 77.784 100.186 1.00 0.00 O ATOM 92186 H1 WAT 627 119.375 77.023 100.455 1.00 0.00 H ATOM 92187 H2 WAT 627 118.905 78.381 100.933 1.00 0.00 H TER 92189 WAT 627 ATOM 92189 O WAT 628 96.379 81.571 103.422 1.00 0.00 O ATOM 92190 H1 WAT 628 96.078 82.123 104.143 1.00 0.00 H ATOM 92191 H2 WAT 628 96.083 80.691 103.654 1.00 0.00 H TER 92193 WAT 628 ATOM 92193 O WAT 629 91.616 39.834 7.350 1.00 0.00 O ATOM 92194 H1 WAT 629 91.809 40.529 6.721 1.00 0.00 H ATOM 92195 H2 WAT 629 90.742 40.043 7.677 1.00 0.00 H TER 92197 WAT 629 ATOM 92197 O WAT 630 114.027 117.605 0.976 1.00 0.00 O ATOM 92198 H1 WAT 630 114.652 117.203 1.580 1.00 0.00 H ATOM 92199 H2 WAT 630 113.171 117.307 1.286 1.00 0.00 H TER 92201 WAT 630 ATOM 92201 O WAT 631 144.910 39.385 99.186 1.00 0.00 O ATOM 92202 H1 WAT 631 144.573 38.691 99.752 1.00 0.00 H ATOM 92203 H2 WAT 631 144.329 40.129 99.347 1.00 0.00 H TER 92205 WAT 631 ATOM 92205 O WAT 632 10.772 104.109 65.015 1.00 0.00 O ATOM 92206 H1 WAT 632 10.733 103.472 65.728 1.00 0.00 H ATOM 92207 H2 WAT 632 10.677 104.958 65.447 1.00 0.00 H TER 92209 WAT 632 ATOM 92209 O WAT 633 27.660 144.238 11.054 1.00 0.00 O ATOM 92210 H1 WAT 633 26.816 144.657 11.220 1.00 0.00 H ATOM 92211 H2 WAT 633 28.192 144.460 11.818 1.00 0.00 H TER 92213 WAT 633 ATOM 92213 O WAT 634 15.944 4.363 72.817 1.00 0.00 O ATOM 92214 H1 WAT 634 16.341 3.764 72.185 1.00 0.00 H ATOM 92215 H2 WAT 634 16.080 3.940 73.665 1.00 0.00 H TER 92217 WAT 634 ATOM 92217 O WAT 635 15.439 50.964 64.004 1.00 0.00 O ATOM 92218 H1 WAT 635 15.957 50.161 63.950 1.00 0.00 H ATOM 92219 H2 WAT 635 16.082 51.669 63.927 1.00 0.00 H TER 92221 WAT 635 ATOM 92221 O WAT 636 45.534 144.301 109.668 1.00 0.00 O ATOM 92222 H1 WAT 636 44.751 144.844 109.579 1.00 0.00 H ATOM 92223 H2 WAT 636 45.775 144.078 108.769 1.00 0.00 H TER 92225 WAT 636 ATOM 92225 O WAT 637 120.990 111.231 117.656 1.00 0.00 O ATOM 92226 H1 WAT 637 121.534 110.910 118.374 1.00 0.00 H ATOM 92227 H2 WAT 637 120.569 112.016 118.007 1.00 0.00 H TER 92229 WAT 637 ATOM 92229 O WAT 638 100.960 127.499 67.701 1.00 0.00 O ATOM 92230 H1 WAT 638 100.194 127.145 68.153 1.00 0.00 H ATOM 92231 H2 WAT 638 100.658 127.657 66.806 1.00 0.00 H TER 92233 WAT 638 ATOM 92233 O WAT 639 130.482 127.552 117.143 1.00 0.00 O ATOM 92234 H1 WAT 639 130.821 128.137 117.821 1.00 0.00 H ATOM 92235 H2 WAT 639 130.050 126.849 117.627 1.00 0.00 H TER 92237 WAT 639 ATOM 92237 O WAT 640 141.197 3.939 133.638 1.00 0.00 O ATOM 92238 H1 WAT 640 141.239 3.870 134.592 1.00 0.00 H ATOM 92239 H2 WAT 640 140.501 4.575 133.474 1.00 0.00 H TER 92241 WAT 640 ATOM 92241 O WAT 641 34.607 73.526 102.006 1.00 0.00 O ATOM 92242 H1 WAT 641 33.987 74.021 101.471 1.00 0.00 H ATOM 92243 H2 WAT 641 34.213 72.658 102.089 1.00 0.00 H TER 92245 WAT 641 ATOM 92245 O WAT 642 33.828 16.345 139.809 1.00 0.00 O ATOM 92246 H1 WAT 642 33.778 15.723 139.082 1.00 0.00 H ATOM 92247 H2 WAT 642 34.115 17.163 139.404 1.00 0.00 H TER 92249 WAT 642 ATOM 92249 O WAT 643 40.980 136.945 127.945 1.00 0.00 O ATOM 92250 H1 WAT 643 41.512 136.161 128.082 1.00 0.00 H ATOM 92251 H2 WAT 643 41.018 137.098 127.000 1.00 0.00 H TER 92253 WAT 643 ATOM 92253 O WAT 644 95.112 25.672 18.754 1.00 0.00 O ATOM 92254 H1 WAT 644 94.336 25.886 19.272 1.00 0.00 H ATOM 92255 H2 WAT 644 95.768 26.313 19.029 1.00 0.00 H TER 92257 WAT 644 ATOM 92257 O WAT 645 124.283 110.018 146.726 1.00 0.00 O ATOM 92258 H1 WAT 645 124.195 109.710 147.628 1.00 0.00 H ATOM 92259 H2 WAT 645 125.212 109.907 146.524 1.00 0.00 H TER 92261 WAT 645 ATOM 92261 O WAT 646 12.803 136.365 25.047 1.00 0.00 O ATOM 92262 H1 WAT 646 13.349 137.116 25.281 1.00 0.00 H ATOM 92263 H2 WAT 646 12.074 136.744 24.557 1.00 0.00 H TER 92265 WAT 646 ATOM 92265 O WAT 647 97.284 123.027 10.873 1.00 0.00 O ATOM 92266 H1 WAT 647 97.517 122.105 10.980 1.00 0.00 H ATOM 92267 H2 WAT 647 98.125 123.481 10.812 1.00 0.00 H TER 92269 WAT 647 ATOM 92269 O WAT 648 101.603 11.670 62.331 1.00 0.00 O ATOM 92270 H1 WAT 648 101.701 12.014 63.219 1.00 0.00 H ATOM 92271 H2 WAT 648 101.023 10.914 62.430 1.00 0.00 H TER 92273 WAT 648 ATOM 92273 O WAT 649 134.872 70.926 125.103 1.00 0.00 O ATOM 92274 H1 WAT 649 133.976 70.675 124.878 1.00 0.00 H ATOM 92275 H2 WAT 649 134.943 70.744 126.040 1.00 0.00 H TER 92277 WAT 649 ATOM 92277 O WAT 650 83.629 61.036 2.467 1.00 0.00 O ATOM 92278 H1 WAT 650 82.972 61.244 3.131 1.00 0.00 H ATOM 92279 H2 WAT 650 84.259 61.755 2.520 1.00 0.00 H TER 92281 WAT 650 ATOM 92281 O WAT 651 39.032 101.513 145.720 1.00 0.00 O ATOM 92282 H1 WAT 651 39.349 102.226 145.166 1.00 0.00 H ATOM 92283 H2 WAT 651 39.433 101.676 146.574 1.00 0.00 H TER 92285 WAT 651 ATOM 92285 O WAT 652 97.298 60.130 79.717 1.00 0.00 O ATOM 92286 H1 WAT 652 96.955 59.241 79.630 1.00 0.00 H ATOM 92287 H2 WAT 652 97.847 60.252 78.942 1.00 0.00 H TER 92289 WAT 652 ATOM 92289 O WAT 653 36.446 22.531 70.512 1.00 0.00 O ATOM 92290 H1 WAT 653 36.880 21.679 70.463 1.00 0.00 H ATOM 92291 H2 WAT 653 36.469 22.863 69.615 1.00 0.00 H TER 92293 WAT 653 ATOM 92293 O WAT 654 17.469 78.425 79.306 1.00 0.00 O ATOM 92294 H1 WAT 654 17.733 77.588 78.924 1.00 0.00 H ATOM 92295 H2 WAT 654 17.510 78.279 80.252 1.00 0.00 H TER 92297 WAT 654 ATOM 92297 O WAT 655 0.549 114.201 82.864 1.00 0.00 O ATOM 92298 H1 WAT 655 0.013 114.841 82.396 1.00 0.00 H ATOM 92299 H2 WAT 655 -0.007 113.905 83.585 1.00 0.00 H TER 92301 WAT 655 ATOM 92301 O WAT 656 3.811 118.977 9.396 1.00 0.00 O ATOM 92302 H1 WAT 656 3.646 119.064 10.334 1.00 0.00 H ATOM 92303 H2 WAT 656 4.437 119.673 9.197 1.00 0.00 H TER 92305 WAT 656 ATOM 92305 O WAT 657 86.967 16.275 80.612 1.00 0.00 O ATOM 92306 H1 WAT 657 86.679 16.443 81.509 1.00 0.00 H ATOM 92307 H2 WAT 657 86.156 16.172 80.114 1.00 0.00 H TER 92309 WAT 657 ATOM 92309 O WAT 658 110.629 53.707 128.605 1.00 0.00 O ATOM 92310 H1 WAT 658 111.237 54.079 127.966 1.00 0.00 H ATOM 92311 H2 WAT 658 111.188 53.220 129.212 1.00 0.00 H TER 92313 WAT 658 ATOM 92313 O WAT 659 121.332 36.249 87.238 1.00 0.00 O ATOM 92314 H1 WAT 659 120.815 36.884 87.733 1.00 0.00 H ATOM 92315 H2 WAT 659 120.754 35.970 86.528 1.00 0.00 H TER 92317 WAT 659 ATOM 92317 O WAT 660 79.214 66.942 9.199 1.00 0.00 O ATOM 92318 H1 WAT 660 79.146 66.464 10.026 1.00 0.00 H ATOM 92319 H2 WAT 660 80.155 67.016 9.042 1.00 0.00 H TER 92321 WAT 660 ATOM 92321 O WAT 661 144.883 7.839 5.141 1.00 0.00 O ATOM 92322 H1 WAT 661 144.431 8.683 5.127 1.00 0.00 H ATOM 92323 H2 WAT 661 144.179 7.191 5.159 1.00 0.00 H TER 92325 WAT 661 ATOM 92325 O WAT 662 140.440 3.745 79.054 1.00 0.00 O ATOM 92326 H1 WAT 662 140.223 2.894 79.436 1.00 0.00 H ATOM 92327 H2 WAT 662 139.680 4.294 79.247 1.00 0.00 H TER 92329 WAT 662 ATOM 92329 O WAT 663 32.614 48.175 133.128 1.00 0.00 O ATOM 92330 H1 WAT 663 31.964 48.216 133.829 1.00 0.00 H ATOM 92331 H2 WAT 663 32.535 47.287 132.778 1.00 0.00 H TER 92333 WAT 663 ATOM 92333 O WAT 664 16.991 134.994 127.520 1.00 0.00 O ATOM 92334 H1 WAT 664 17.045 134.163 127.992 1.00 0.00 H ATOM 92335 H2 WAT 664 16.769 134.745 126.623 1.00 0.00 H TER 92337 WAT 664 ATOM 92337 O WAT 665 143.537 17.978 97.891 1.00 0.00 O ATOM 92338 H1 WAT 665 143.753 18.318 97.023 1.00 0.00 H ATOM 92339 H2 WAT 665 144.382 17.888 98.331 1.00 0.00 H TER 92341 WAT 665 ATOM 92341 O WAT 666 117.049 120.136 5.419 1.00 0.00 O ATOM 92342 H1 WAT 666 117.134 121.080 5.284 1.00 0.00 H ATOM 92343 H2 WAT 666 117.951 119.818 5.458 1.00 0.00 H TER 92345 WAT 666 ATOM 92345 O WAT 667 23.678 33.210 13.669 1.00 0.00 O ATOM 92346 H1 WAT 667 23.227 34.054 13.669 1.00 0.00 H ATOM 92347 H2 WAT 667 24.556 33.407 13.344 1.00 0.00 H TER 92349 WAT 667 ATOM 92349 O WAT 668 -0.113 142.203 10.664 1.00 0.00 O ATOM 92350 H1 WAT 668 0.831 142.319 10.552 1.00 0.00 H ATOM 92351 H2 WAT 668 -0.505 142.830 10.055 1.00 0.00 H TER 92353 WAT 668 ATOM 92353 O WAT 669 102.507 87.936 83.895 1.00 0.00 O ATOM 92354 H1 WAT 669 102.318 88.632 84.525 1.00 0.00 H ATOM 92355 H2 WAT 669 103.412 88.096 83.627 1.00 0.00 H TER 92357 WAT 669 ATOM 92357 O WAT 670 88.935 93.998 72.518 1.00 0.00 O ATOM 92358 H1 WAT 670 89.445 94.798 72.393 1.00 0.00 H ATOM 92359 H2 WAT 670 88.272 94.027 71.827 1.00 0.00 H TER 92361 WAT 670 ATOM 92361 O WAT 671 24.465 41.193 14.984 1.00 0.00 O ATOM 92362 H1 WAT 671 23.859 40.620 15.453 1.00 0.00 H ATOM 92363 H2 WAT 671 24.609 41.929 15.579 1.00 0.00 H TER 92365 WAT 671 ATOM 92365 O WAT 672 108.572 68.669 24.205 1.00 0.00 O ATOM 92366 H1 WAT 672 108.918 68.043 23.568 1.00 0.00 H ATOM 92367 H2 WAT 672 109.107 69.453 24.085 1.00 0.00 H TER 92369 WAT 672 ATOM 92369 O WAT 673 90.925 82.245 64.161 1.00 0.00 O ATOM 92370 H1 WAT 673 91.100 83.035 63.650 1.00 0.00 H ATOM 92371 H2 WAT 673 91.721 81.721 64.073 1.00 0.00 H TER 92373 WAT 673 ATOM 92373 O WAT 674 14.072 126.402 124.475 1.00 0.00 O ATOM 92374 H1 WAT 674 13.734 126.413 125.371 1.00 0.00 H ATOM 92375 H2 WAT 674 13.339 126.703 123.939 1.00 0.00 H TER 92377 WAT 674 ATOM 92377 O WAT 675 56.297 78.591 114.597 1.00 0.00 O ATOM 92378 H1 WAT 675 55.365 78.603 114.379 1.00 0.00 H ATOM 92379 H2 WAT 675 56.424 77.763 115.059 1.00 0.00 H TER 92381 WAT 675 ATOM 92381 O WAT 676 24.709 0.274 95.522 1.00 0.00 O ATOM 92382 H1 WAT 676 23.768 0.419 95.420 1.00 0.00 H ATOM 92383 H2 WAT 676 24.956 -0.239 94.753 1.00 0.00 H TER 92385 WAT 676 ATOM 92385 O WAT 677 31.254 76.489 158.441 1.00 0.00 O ATOM 92386 H1 WAT 677 31.249 76.934 159.288 1.00 0.00 H ATOM 92387 H2 WAT 677 30.701 75.719 158.572 1.00 0.00 H TER 92389 WAT 677 ATOM 92389 O WAT 678 54.627 106.901 66.537 1.00 0.00 O ATOM 92390 H1 WAT 678 53.708 107.073 66.333 1.00 0.00 H ATOM 92391 H2 WAT 678 54.763 105.989 66.283 1.00 0.00 H TER 92393 WAT 678 ATOM 92393 O WAT 679 104.516 60.608 144.722 1.00 0.00 O ATOM 92394 H1 WAT 679 103.730 60.082 144.870 1.00 0.00 H ATOM 92395 H2 WAT 679 104.944 60.645 145.578 1.00 0.00 H TER 92397 WAT 679 ATOM 92397 O WAT 680 136.454 142.119 140.141 1.00 0.00 O ATOM 92398 H1 WAT 680 135.816 142.293 139.450 1.00 0.00 H ATOM 92399 H2 WAT 680 136.862 142.968 140.310 1.00 0.00 H TER 92401 WAT 680 ATOM 92401 O WAT 681 25.376 101.356 107.622 1.00 0.00 O ATOM 92402 H1 WAT 681 25.524 102.084 107.018 1.00 0.00 H ATOM 92403 H2 WAT 681 26.015 100.693 107.358 1.00 0.00 H TER 92405 WAT 681 ATOM 92405 O WAT 682 9.367 112.414 87.715 1.00 0.00 O ATOM 92406 H1 WAT 682 10.137 112.627 87.187 1.00 0.00 H ATOM 92407 H2 WAT 682 8.938 111.703 87.239 1.00 0.00 H TER 92409 WAT 682 ATOM 92409 O WAT 683 143.584 94.411 9.983 1.00 0.00 O ATOM 92410 H1 WAT 683 144.191 93.755 10.328 1.00 0.00 H ATOM 92411 H2 WAT 683 144.056 95.240 10.066 1.00 0.00 H TER 92413 WAT 683 ATOM 92413 O WAT 684 28.460 26.465 142.092 1.00 0.00 O ATOM 92414 H1 WAT 684 28.904 26.573 141.251 1.00 0.00 H ATOM 92415 H2 WAT 684 29.096 26.008 142.641 1.00 0.00 H TER 92417 WAT 684 ATOM 92417 O WAT 685 93.496 6.777 5.054 1.00 0.00 O ATOM 92418 H1 WAT 685 92.633 7.148 4.869 1.00 0.00 H ATOM 92419 H2 WAT 685 93.981 6.880 4.235 1.00 0.00 H TER 92421 WAT 685 ATOM 92421 O WAT 686 127.698 68.663 130.296 1.00 0.00 O ATOM 92422 H1 WAT 686 128.510 68.159 130.346 1.00 0.00 H ATOM 92423 H2 WAT 686 127.214 68.416 131.084 1.00 0.00 H TER 92425 WAT 686 ATOM 92425 O WAT 687 4.476 71.299 102.798 1.00 0.00 O ATOM 92426 H1 WAT 687 4.369 72.157 103.208 1.00 0.00 H ATOM 92427 H2 WAT 687 4.523 71.485 101.860 1.00 0.00 H TER 92429 WAT 687 ATOM 92429 O WAT 688 29.813 20.343 95.427 1.00 0.00 O ATOM 92430 H1 WAT 688 29.416 20.110 94.588 1.00 0.00 H ATOM 92431 H2 WAT 688 30.754 20.244 95.281 1.00 0.00 H TER 92433 WAT 688 ATOM 92433 O WAT 689 121.371 32.334 26.888 1.00 0.00 O ATOM 92434 H1 WAT 689 122.316 32.188 26.865 1.00 0.00 H ATOM 92435 H2 WAT 689 121.191 32.602 27.789 1.00 0.00 H TER 92437 WAT 689 ATOM 92437 O WAT 690 72.996 76.485 135.531 1.00 0.00 O ATOM 92438 H1 WAT 690 73.357 75.688 135.919 1.00 0.00 H ATOM 92439 H2 WAT 690 72.408 76.833 136.202 1.00 0.00 H TER 92441 WAT 690 ATOM 92441 O WAT 691 101.676 145.202 68.898 1.00 0.00 O ATOM 92442 H1 WAT 691 102.482 144.785 68.594 1.00 0.00 H ATOM 92443 H2 WAT 691 101.630 146.023 68.408 1.00 0.00 H TER 92445 WAT 691 ATOM 92445 O WAT 692 44.706 23.337 125.817 1.00 0.00 O ATOM 92446 H1 WAT 692 45.570 22.954 125.963 1.00 0.00 H ATOM 92447 H2 WAT 692 44.855 24.028 125.172 1.00 0.00 H TER 92449 WAT 692 ATOM 92449 O WAT 693 6.597 75.708 128.501 1.00 0.00 O ATOM 92450 H1 WAT 693 6.634 75.248 127.662 1.00 0.00 H ATOM 92451 H2 WAT 693 7.310 75.328 129.014 1.00 0.00 H TER 92453 WAT 693 ATOM 92453 O WAT 694 146.073 13.555 8.209 1.00 0.00 O ATOM 92454 H1 WAT 694 146.115 12.621 8.412 1.00 0.00 H ATOM 92455 H2 WAT 694 145.138 13.741 8.125 1.00 0.00 H TER 92457 WAT 694 ATOM 92457 O WAT 695 80.502 14.459 85.577 1.00 0.00 O ATOM 92458 H1 WAT 695 80.330 14.980 84.793 1.00 0.00 H ATOM 92459 H2 WAT 695 80.578 15.103 86.281 1.00 0.00 H TER 92461 WAT 695 ATOM 92461 O WAT 696 44.579 8.764 149.253 1.00 0.00 O ATOM 92462 H1 WAT 696 44.830 8.015 149.794 1.00 0.00 H ATOM 92463 H2 WAT 696 45.407 9.195 149.041 1.00 0.00 H TER 92465 WAT 696 ATOM 92465 O WAT 697 87.060 101.594 106.926 1.00 0.00 O ATOM 92466 H1 WAT 697 86.554 101.488 107.732 1.00 0.00 H ATOM 92467 H2 WAT 697 87.791 100.984 107.021 1.00 0.00 H TER 92469 WAT 697 ATOM 92469 O WAT 698 91.679 143.759 81.170 1.00 0.00 O ATOM 92470 H1 WAT 698 90.897 143.239 80.985 1.00 0.00 H ATOM 92471 H2 WAT 698 92.393 143.273 80.758 1.00 0.00 H TER 92473 WAT 698 ATOM 92473 O WAT 699 31.636 106.312 144.838 1.00 0.00 O ATOM 92474 H1 WAT 699 31.170 106.246 145.671 1.00 0.00 H ATOM 92475 H2 WAT 699 30.992 106.677 144.231 1.00 0.00 H TER 92477 WAT 699 ATOM 92477 O WAT 700 0.377 65.773 156.632 1.00 0.00 O ATOM 92478 H1 WAT 700 -0.422 65.284 156.827 1.00 0.00 H ATOM 92479 H2 WAT 700 0.963 65.126 156.239 1.00 0.00 H TER 92481 WAT 700 ATOM 92481 O WAT 701 51.026 119.355 13.900 1.00 0.00 O ATOM 92482 H1 WAT 701 50.595 119.363 14.754 1.00 0.00 H ATOM 92483 H2 WAT 701 50.728 120.157 13.473 1.00 0.00 H TER 92485 WAT 701 ATOM 92485 O WAT 702 124.623 99.097 137.967 1.00 0.00 O ATOM 92486 H1 WAT 702 124.638 99.950 137.531 1.00 0.00 H ATOM 92487 H2 WAT 702 124.796 98.468 137.267 1.00 0.00 H TER 92489 WAT 702 ATOM 92489 O WAT 703 6.130 98.741 20.730 1.00 0.00 O ATOM 92490 H1 WAT 703 5.179 98.794 20.629 1.00 0.00 H ATOM 92491 H2 WAT 703 6.344 97.834 20.511 1.00 0.00 H TER 92493 WAT 703 ATOM 92493 O WAT 704 87.329 40.983 6.271 1.00 0.00 O ATOM 92494 H1 WAT 704 86.697 41.558 5.841 1.00 0.00 H ATOM 92495 H2 WAT 704 87.237 41.180 7.203 1.00 0.00 H TER 92497 WAT 704 ATOM 92497 O WAT 705 28.485 19.888 140.514 1.00 0.00 O ATOM 92498 H1 WAT 705 28.447 19.182 141.160 1.00 0.00 H ATOM 92499 H2 WAT 705 29.333 19.774 140.085 1.00 0.00 H TER 92501 WAT 705 ATOM 92501 O WAT 706 126.085 45.293 143.686 1.00 0.00 O ATOM 92502 H1 WAT 706 125.262 45.082 143.245 1.00 0.00 H ATOM 92503 H2 WAT 706 125.874 45.253 144.619 1.00 0.00 H TER 92505 WAT 706 ATOM 92505 O WAT 707 19.601 78.788 116.784 1.00 0.00 O ATOM 92506 H1 WAT 707 20.488 79.081 116.993 1.00 0.00 H ATOM 92507 H2 WAT 707 19.702 77.865 116.553 1.00 0.00 H TER 92509 WAT 707 ATOM 92509 O WAT 708 54.984 133.752 144.543 1.00 0.00 O ATOM 92510 H1 WAT 708 55.799 134.115 144.890 1.00 0.00 H ATOM 92511 H2 WAT 708 54.298 134.310 144.909 1.00 0.00 H TER 92513 WAT 708 ATOM 92513 O WAT 709 132.211 138.605 61.149 1.00 0.00 O ATOM 92514 H1 WAT 709 133.120 138.772 60.900 1.00 0.00 H ATOM 92515 H2 WAT 709 131.700 139.212 60.614 1.00 0.00 H TER 92517 WAT 709 ATOM 92517 O WAT 710 120.792 6.974 86.108 1.00 0.00 O ATOM 92518 H1 WAT 710 121.696 7.160 85.854 1.00 0.00 H ATOM 92519 H2 WAT 710 120.604 7.605 86.802 1.00 0.00 H TER 92521 WAT 710 ATOM 92521 O WAT 711 87.309 68.350 18.675 1.00 0.00 O ATOM 92522 H1 WAT 711 87.639 68.583 19.543 1.00 0.00 H ATOM 92523 H2 WAT 711 87.967 68.691 18.069 1.00 0.00 H TER 92525 WAT 711 ATOM 92525 O WAT 712 111.626 117.989 157.627 1.00 0.00 O ATOM 92526 H1 WAT 712 111.432 117.961 158.564 1.00 0.00 H ATOM 92527 H2 WAT 712 111.833 117.083 157.398 1.00 0.00 H TER 92529 WAT 712 ATOM 92529 O WAT 713 9.713 58.679 62.678 1.00 0.00 O ATOM 92530 H1 WAT 713 9.155 58.699 63.455 1.00 0.00 H ATOM 92531 H2 WAT 713 9.593 57.798 62.321 1.00 0.00 H TER 92533 WAT 713 ATOM 92533 O WAT 714 57.766 117.647 133.168 1.00 0.00 O ATOM 92534 H1 WAT 714 57.705 118.597 133.069 1.00 0.00 H ATOM 92535 H2 WAT 714 58.193 117.349 132.365 1.00 0.00 H TER 92537 WAT 714 ATOM 92537 O WAT 715 69.734 40.675 76.636 1.00 0.00 O ATOM 92538 H1 WAT 715 70.371 39.998 76.409 1.00 0.00 H ATOM 92539 H2 WAT 715 70.094 41.478 76.259 1.00 0.00 H TER 92541 WAT 715 ATOM 92541 O WAT 716 85.272 101.228 109.119 1.00 0.00 O ATOM 92542 H1 WAT 716 84.627 100.522 109.066 1.00 0.00 H ATOM 92543 H2 WAT 716 84.784 102.016 108.880 1.00 0.00 H TER 92545 WAT 716 ATOM 92545 O WAT 717 90.622 3.795 95.691 1.00 0.00 O ATOM 92546 H1 WAT 717 90.899 4.445 95.045 1.00 0.00 H ATOM 92547 H2 WAT 717 90.035 4.274 96.276 1.00 0.00 H TER 92549 WAT 717 ATOM 92549 O WAT 718 112.786 86.402 82.516 1.00 0.00 O ATOM 92550 H1 WAT 718 113.169 86.738 81.706 1.00 0.00 H ATOM 92551 H2 WAT 718 113.428 86.618 83.193 1.00 0.00 H TER 92553 WAT 718 ATOM 92553 O WAT 719 113.038 20.507 139.174 1.00 0.00 O ATOM 92554 H1 WAT 719 113.912 20.885 139.274 1.00 0.00 H ATOM 92555 H2 WAT 719 113.180 19.706 138.670 1.00 0.00 H TER 92557 WAT 719 ATOM 92557 O WAT 720 75.770 63.310 7.434 1.00 0.00 O ATOM 92558 H1 WAT 720 75.040 63.618 7.970 1.00 0.00 H ATOM 92559 H2 WAT 720 75.655 63.753 6.594 1.00 0.00 H TER 92561 WAT 720 ATOM 92561 O WAT 721 49.373 117.354 12.306 1.00 0.00 O ATOM 92562 H1 WAT 721 48.896 116.607 12.667 1.00 0.00 H ATOM 92563 H2 WAT 721 49.609 117.880 13.070 1.00 0.00 H TER 92565 WAT 721 ATOM 92565 O WAT 722 59.699 100.284 12.382 1.00 0.00 O ATOM 92566 H1 WAT 722 59.193 99.644 11.881 1.00 0.00 H ATOM 92567 H2 WAT 722 60.603 99.975 12.322 1.00 0.00 H TER 92569 WAT 722 ATOM 92569 O WAT 723 113.802 14.741 105.088 1.00 0.00 O ATOM 92570 H1 WAT 723 113.398 15.483 105.538 1.00 0.00 H ATOM 92571 H2 WAT 723 113.733 14.960 104.158 1.00 0.00 H TER 92573 WAT 723 ATOM 92573 O WAT 724 23.302 88.249 112.998 1.00 0.00 O ATOM 92574 H1 WAT 724 23.057 88.691 112.185 1.00 0.00 H ATOM 92575 H2 WAT 724 24.241 88.087 112.909 1.00 0.00 H TER 92577 WAT 724 ATOM 92577 O WAT 725 2.060 113.220 119.653 1.00 0.00 O ATOM 92578 H1 WAT 725 1.489 113.528 120.357 1.00 0.00 H ATOM 92579 H2 WAT 725 2.264 112.315 119.890 1.00 0.00 H TER 92581 WAT 725 ATOM 92581 O WAT 726 82.560 65.370 103.238 1.00 0.00 O ATOM 92582 H1 WAT 726 82.131 66.150 103.592 1.00 0.00 H ATOM 92583 H2 WAT 726 83.223 65.145 103.890 1.00 0.00 H TER 92585 WAT 726 ATOM 92585 O WAT 727 75.581 52.286 0.601 1.00 0.00 O ATOM 92586 H1 WAT 727 75.708 52.990 -0.034 1.00 0.00 H ATOM 92587 H2 WAT 727 74.633 52.245 0.726 1.00 0.00 H TER 92589 WAT 727 ATOM 92589 O WAT 728 108.355 72.483 67.312 1.00 0.00 O ATOM 92590 H1 WAT 728 107.948 73.142 66.750 1.00 0.00 H ATOM 92591 H2 WAT 728 107.795 71.712 67.222 1.00 0.00 H TER 92593 WAT 728 ATOM 92593 O WAT 729 44.298 106.712 109.203 1.00 0.00 O ATOM 92594 H1 WAT 729 43.733 106.546 109.958 1.00 0.00 H ATOM 92595 H2 WAT 729 43.768 107.257 108.622 1.00 0.00 H TER 92597 WAT 729 ATOM 92597 O WAT 730 46.693 89.700 156.698 1.00 0.00 O ATOM 92598 H1 WAT 730 46.317 88.961 156.220 1.00 0.00 H ATOM 92599 H2 WAT 730 45.937 90.159 157.064 1.00 0.00 H TER 92601 WAT 730 ATOM 92601 O WAT 731 47.117 18.172 76.217 1.00 0.00 O ATOM 92602 H1 WAT 731 46.311 18.420 75.764 1.00 0.00 H ATOM 92603 H2 WAT 731 47.809 18.639 75.748 1.00 0.00 H TER 92605 WAT 731 ATOM 92605 O WAT 732 6.357 112.005 150.354 1.00 0.00 O ATOM 92606 H1 WAT 732 5.437 112.169 150.144 1.00 0.00 H ATOM 92607 H2 WAT 732 6.335 111.585 151.214 1.00 0.00 H TER 92609 WAT 732 ATOM 92609 O WAT 733 105.768 34.826 74.502 1.00 0.00 O ATOM 92610 H1 WAT 733 105.646 34.394 75.347 1.00 0.00 H ATOM 92611 H2 WAT 733 105.325 34.255 73.875 1.00 0.00 H TER 92613 WAT 733 ATOM 92613 O WAT 734 39.747 64.902 145.483 1.00 0.00 O ATOM 92614 H1 WAT 734 39.597 65.714 145.968 1.00 0.00 H ATOM 92615 H2 WAT 734 38.956 64.384 145.633 1.00 0.00 H TER 92617 WAT 734 ATOM 92617 O WAT 735 63.477 55.934 125.956 1.00 0.00 O ATOM 92618 H1 WAT 735 62.954 56.138 125.180 1.00 0.00 H ATOM 92619 H2 WAT 735 63.214 55.046 126.195 1.00 0.00 H TER 92621 WAT 735 ATOM 92621 O WAT 736 117.200 88.219 125.386 1.00 0.00 O ATOM 92622 H1 WAT 736 117.085 87.435 124.848 1.00 0.00 H ATOM 92623 H2 WAT 736 118.052 88.566 125.122 1.00 0.00 H TER 92625 WAT 736 ATOM 92625 O WAT 737 43.038 36.944 111.579 1.00 0.00 O ATOM 92626 H1 WAT 737 42.828 36.020 111.439 1.00 0.00 H ATOM 92627 H2 WAT 737 42.260 37.305 112.003 1.00 0.00 H TER 92629 WAT 737 ATOM 92629 O WAT 738 120.117 35.067 107.224 1.00 0.00 O ATOM 92630 H1 WAT 738 119.855 34.760 106.355 1.00 0.00 H ATOM 92631 H2 WAT 738 120.949 35.518 107.078 1.00 0.00 H TER 92633 WAT 738 ATOM 92633 O WAT 739 92.960 97.456 18.494 1.00 0.00 O ATOM 92634 H1 WAT 739 92.919 97.429 17.538 1.00 0.00 H ATOM 92635 H2 WAT 739 92.046 97.516 18.771 1.00 0.00 H TER 92637 WAT 739 ATOM 92637 O WAT 740 106.356 139.538 0.631 1.00 0.00 O ATOM 92638 H1 WAT 740 106.516 139.869 1.515 1.00 0.00 H ATOM 92639 H2 WAT 740 107.098 138.961 0.453 1.00 0.00 H TER 92641 WAT 740 ATOM 92641 O WAT 741 112.880 79.113 66.456 1.00 0.00 O ATOM 92642 H1 WAT 741 112.031 79.101 66.013 1.00 0.00 H ATOM 92643 H2 WAT 741 112.813 78.428 67.121 1.00 0.00 H TER 92645 WAT 741 ATOM 92645 O WAT 742 101.793 6.642 6.351 1.00 0.00 O ATOM 92646 H1 WAT 742 101.191 6.448 5.633 1.00 0.00 H ATOM 92647 H2 WAT 742 101.645 5.940 6.985 1.00 0.00 H TER 92649 WAT 742 ATOM 92649 O WAT 743 125.888 138.168 147.665 1.00 0.00 O ATOM 92650 H1 WAT 743 125.681 137.237 147.741 1.00 0.00 H ATOM 92651 H2 WAT 743 126.844 138.201 147.648 1.00 0.00 H TER 92653 WAT 743 ATOM 92653 O WAT 744 118.379 6.183 69.113 1.00 0.00 O ATOM 92654 H1 WAT 744 118.121 6.170 70.034 1.00 0.00 H ATOM 92655 H2 WAT 744 117.630 5.811 68.649 1.00 0.00 H TER 92657 WAT 744 ATOM 92657 O WAT 745 94.098 57.919 148.341 1.00 0.00 O ATOM 92658 H1 WAT 745 93.640 57.994 147.504 1.00 0.00 H ATOM 92659 H2 WAT 745 93.623 58.507 148.928 1.00 0.00 H TER 92661 WAT 745 ATOM 92661 O WAT 746 92.764 132.723 154.385 1.00 0.00 O ATOM 92662 H1 WAT 746 92.215 133.405 154.774 1.00 0.00 H ATOM 92663 H2 WAT 746 92.782 132.935 153.452 1.00 0.00 H TER 92665 WAT 746 ATOM 92665 O WAT 747 78.019 141.621 138.093 1.00 0.00 O ATOM 92666 H1 WAT 747 77.119 141.597 138.417 1.00 0.00 H ATOM 92667 H2 WAT 747 78.030 142.346 137.467 1.00 0.00 H TER 92669 WAT 747 ATOM 92669 O WAT 748 71.141 16.592 156.030 1.00 0.00 O ATOM 92670 H1 WAT 748 71.925 17.141 156.049 1.00 0.00 H ATOM 92671 H2 WAT 748 71.453 15.721 156.277 1.00 0.00 H TER 92673 WAT 748 ATOM 92673 O WAT 749 57.447 33.583 94.271 1.00 0.00 O ATOM 92674 H1 WAT 749 58.240 34.085 94.457 1.00 0.00 H ATOM 92675 H2 WAT 749 57.082 33.382 95.133 1.00 0.00 H TER 92677 WAT 749 ATOM 92677 O WAT 750 33.965 75.386 3.062 1.00 0.00 O ATOM 92678 H1 WAT 750 33.933 75.901 3.869 1.00 0.00 H ATOM 92679 H2 WAT 750 34.589 74.685 3.251 1.00 0.00 H TER 92681 WAT 750 ATOM 92681 O WAT 751 96.088 28.451 138.512 1.00 0.00 O ATOM 92682 H1 WAT 751 96.912 28.192 138.925 1.00 0.00 H ATOM 92683 H2 WAT 751 96.243 28.337 137.575 1.00 0.00 H TER 92685 WAT 751 ATOM 92685 O WAT 752 102.164 96.169 28.462 1.00 0.00 O ATOM 92686 H1 WAT 752 102.138 95.735 27.609 1.00 0.00 H ATOM 92687 H2 WAT 752 101.273 96.495 28.592 1.00 0.00 H TER 92689 WAT 752 ATOM 92689 O WAT 753 1.525 77.679 154.599 1.00 0.00 O ATOM 92690 H1 WAT 753 1.214 76.880 154.174 1.00 0.00 H ATOM 92691 H2 WAT 753 2.426 77.779 154.291 1.00 0.00 H TER 92693 WAT 753 ATOM 92693 O WAT 754 63.382 72.759 60.532 1.00 0.00 O ATOM 92694 H1 WAT 754 62.549 72.729 60.062 1.00 0.00 H ATOM 92695 H2 WAT 754 64.025 72.437 59.901 1.00 0.00 H TER 92697 WAT 754 ATOM 92697 O WAT 755 139.075 7.238 65.926 1.00 0.00 O ATOM 92698 H1 WAT 755 139.253 6.591 65.244 1.00 0.00 H ATOM 92699 H2 WAT 755 138.229 6.976 66.289 1.00 0.00 H TER 92701 WAT 755 ATOM 92701 O WAT 756 59.607 33.507 139.095 1.00 0.00 O ATOM 92702 H1 WAT 756 59.286 32.611 138.996 1.00 0.00 H ATOM 92703 H2 WAT 756 58.826 34.020 139.302 1.00 0.00 H TER 92705 WAT 756 ATOM 92705 O WAT 757 33.533 60.927 108.003 1.00 0.00 O ATOM 92706 H1 WAT 757 33.024 61.734 108.081 1.00 0.00 H ATOM 92707 H2 WAT 757 34.434 61.223 107.874 1.00 0.00 H TER 92709 WAT 757 ATOM 92709 O WAT 758 7.229 143.206 99.358 1.00 0.00 O ATOM 92710 H1 WAT 758 6.796 143.957 99.764 1.00 0.00 H ATOM 92711 H2 WAT 758 7.022 142.470 99.934 1.00 0.00 H TER 92713 WAT 758 ATOM 92713 O WAT 759 138.691 51.445 4.888 1.00 0.00 O ATOM 92714 H1 WAT 759 139.413 51.964 5.241 1.00 0.00 H ATOM 92715 H2 WAT 759 138.604 51.739 3.981 1.00 0.00 H TER 92717 WAT 759 ATOM 92717 O WAT 760 46.942 100.179 64.879 1.00 0.00 O ATOM 92718 H1 WAT 760 47.371 99.659 64.200 1.00 0.00 H ATOM 92719 H2 WAT 760 47.453 100.987 64.921 1.00 0.00 H TER 92721 WAT 760 ATOM 92721 O WAT 761 91.709 129.993 136.860 1.00 0.00 O ATOM 92722 H1 WAT 761 92.449 129.695 137.389 1.00 0.00 H ATOM 92723 H2 WAT 761 91.009 129.370 137.055 1.00 0.00 H TER 92725 WAT 761 ATOM 92725 O WAT 762 41.296 7.149 67.186 1.00 0.00 O ATOM 92726 H1 WAT 762 40.547 6.679 67.553 1.00 0.00 H ATOM 92727 H2 WAT 762 41.006 7.416 66.313 1.00 0.00 H TER 92729 WAT 762 ATOM 92729 O WAT 763 30.098 141.418 11.053 1.00 0.00 O ATOM 92730 H1 WAT 763 29.619 140.853 11.660 1.00 0.00 H ATOM 92731 H2 WAT 763 30.649 140.817 10.551 1.00 0.00 H TER 92733 WAT 763 ATOM 92733 O WAT 764 65.137 88.799 142.005 1.00 0.00 O ATOM 92734 H1 WAT 764 64.408 89.202 141.534 1.00 0.00 H ATOM 92735 H2 WAT 764 65.442 89.480 142.605 1.00 0.00 H TER 92737 WAT 764 ATOM 92737 O WAT 765 0.355 24.312 96.552 1.00 0.00 O ATOM 92738 H1 WAT 765 1.064 24.283 97.195 1.00 0.00 H ATOM 92739 H2 WAT 765 -0.166 25.075 96.804 1.00 0.00 H TER 92741 WAT 765 ATOM 92741 O WAT 766 6.225 29.554 68.141 1.00 0.00 O ATOM 92742 H1 WAT 766 6.057 29.282 69.043 1.00 0.00 H ATOM 92743 H2 WAT 766 5.362 29.554 67.727 1.00 0.00 H TER 92745 WAT 766 ATOM 92745 O WAT 767 0.050 102.054 65.582 1.00 0.00 O ATOM 92746 H1 WAT 767 0.831 102.302 65.088 1.00 0.00 H ATOM 92747 H2 WAT 767 0.076 101.097 65.608 1.00 0.00 H TER 92749 WAT 767 ATOM 92749 O WAT 768 83.546 93.629 60.490 1.00 0.00 O ATOM 92750 H1 WAT 768 82.953 93.492 61.229 1.00 0.00 H ATOM 92751 H2 WAT 768 83.613 94.581 60.410 1.00 0.00 H TER 92753 WAT 768 ATOM 92753 O WAT 769 130.403 110.260 91.666 1.00 0.00 O ATOM 92754 H1 WAT 769 130.443 109.355 91.356 1.00 0.00 H ATOM 92755 H2 WAT 769 130.973 110.743 91.068 1.00 0.00 H TER 92757 WAT 769 ATOM 92757 O WAT 770 101.597 23.310 157.260 1.00 0.00 O ATOM 92758 H1 WAT 770 101.525 23.876 156.492 1.00 0.00 H ATOM 92759 H2 WAT 770 102.181 23.783 157.853 1.00 0.00 H TER 92761 WAT 770 ATOM 92761 O WAT 771 78.906 60.328 76.988 1.00 0.00 O ATOM 92762 H1 WAT 771 78.794 61.075 76.401 1.00 0.00 H ATOM 92763 H2 WAT 771 79.800 60.416 77.321 1.00 0.00 H TER 92765 WAT 771 ATOM 92765 O WAT 772 59.295 12.412 149.848 1.00 0.00 O ATOM 92766 H1 WAT 772 59.706 11.701 150.340 1.00 0.00 H ATOM 92767 H2 WAT 772 59.695 12.365 148.980 1.00 0.00 H TER 92769 WAT 772 ATOM 92769 O WAT 773 139.928 74.850 144.885 1.00 0.00 O ATOM 92770 H1 WAT 773 139.422 74.263 145.447 1.00 0.00 H ATOM 92771 H2 WAT 773 140.673 75.115 145.424 1.00 0.00 H TER 92773 WAT 773 ATOM 92773 O WAT 774 25.526 104.015 58.189 1.00 0.00 O ATOM 92774 H1 WAT 774 25.644 104.408 57.324 1.00 0.00 H ATOM 92775 H2 WAT 774 24.579 104.021 58.327 1.00 0.00 H TER 92777 WAT 774 ATOM 92777 O WAT 775 77.120 120.024 98.303 1.00 0.00 O ATOM 92778 H1 WAT 775 76.227 120.098 97.966 1.00 0.00 H ATOM 92779 H2 WAT 775 77.248 119.085 98.439 1.00 0.00 H TER 92781 WAT 775 ATOM 92781 O WAT 776 50.121 114.385 68.624 1.00 0.00 O ATOM 92782 H1 WAT 776 51.051 114.471 68.834 1.00 0.00 H ATOM 92783 H2 WAT 776 49.861 115.257 68.326 1.00 0.00 H TER 92785 WAT 776 ATOM 92785 O WAT 777 117.366 132.478 112.188 1.00 0.00 O ATOM 92786 H1 WAT 777 116.629 131.930 111.917 1.00 0.00 H ATOM 92787 H2 WAT 777 118.109 131.876 112.231 1.00 0.00 H TER 92789 WAT 777 ATOM 92789 O WAT 778 53.766 136.102 123.085 1.00 0.00 O ATOM 92790 H1 WAT 778 53.807 136.826 122.460 1.00 0.00 H ATOM 92791 H2 WAT 778 53.867 135.316 122.547 1.00 0.00 H TER 92793 WAT 778 ATOM 92793 O WAT 779 28.429 79.575 91.926 1.00 0.00 O ATOM 92794 H1 WAT 779 27.613 79.076 91.944 1.00 0.00 H ATOM 92795 H2 WAT 779 28.756 79.468 91.032 1.00 0.00 H TER 92797 WAT 779 ATOM 92797 O WAT 780 64.633 91.620 59.833 1.00 0.00 O ATOM 92798 H1 WAT 780 64.261 92.500 59.894 1.00 0.00 H ATOM 92799 H2 WAT 780 65.428 91.659 60.365 1.00 0.00 H TER 92801 WAT 780 ATOM 92801 O WAT 781 59.405 136.856 69.434 1.00 0.00 O ATOM 92802 H1 WAT 781 59.836 136.810 70.288 1.00 0.00 H ATOM 92803 H2 WAT 781 60.041 136.479 68.825 1.00 0.00 H TER 92805 WAT 781 ATOM 92805 O WAT 782 120.203 57.190 87.006 1.00 0.00 O ATOM 92806 H1 WAT 782 119.920 57.648 87.798 1.00 0.00 H ATOM 92807 H2 WAT 782 120.102 57.837 86.308 1.00 0.00 H TER 92809 WAT 782 ATOM 92809 O WAT 783 48.965 109.618 10.599 1.00 0.00 O ATOM 92810 H1 WAT 783 48.796 109.388 11.512 1.00 0.00 H ATOM 92811 H2 WAT 783 48.966 110.575 10.589 1.00 0.00 H TER 92813 WAT 783 ATOM 92813 O WAT 784 62.128 131.359 134.307 1.00 0.00 O ATOM 92814 H1 WAT 784 62.975 131.042 133.994 1.00 0.00 H ATOM 92815 H2 WAT 784 62.056 131.012 135.196 1.00 0.00 H TER 92817 WAT 784 ATOM 92817 O WAT 785 5.718 127.384 84.119 1.00 0.00 O ATOM 92818 H1 WAT 785 6.022 127.765 83.295 1.00 0.00 H ATOM 92819 H2 WAT 785 6.500 126.986 84.502 1.00 0.00 H TER 92821 WAT 785 ATOM 92821 O WAT 786 34.541 38.766 79.826 1.00 0.00 O ATOM 92822 H1 WAT 786 34.118 38.041 80.288 1.00 0.00 H ATOM 92823 H2 WAT 786 35.462 38.511 79.774 1.00 0.00 H TER 92825 WAT 786 ATOM 92825 O WAT 787 12.109 54.874 128.057 1.00 0.00 O ATOM 92826 H1 WAT 787 12.719 54.496 127.424 1.00 0.00 H ATOM 92827 H2 WAT 787 11.365 54.272 128.063 1.00 0.00 H TER 92829 WAT 787 ATOM 92829 O WAT 788 44.456 109.495 119.178 1.00 0.00 O ATOM 92830 H1 WAT 788 45.375 109.457 118.911 1.00 0.00 H ATOM 92831 H2 WAT 788 44.044 110.071 118.534 1.00 0.00 H TER 92833 WAT 788 ATOM 92833 O WAT 789 95.987 105.499 155.426 1.00 0.00 O ATOM 92834 H1 WAT 789 95.128 105.880 155.610 1.00 0.00 H ATOM 92835 H2 WAT 789 95.793 104.633 155.068 1.00 0.00 H TER 92837 WAT 789 ATOM 92837 O WAT 790 43.289 70.728 73.251 1.00 0.00 O ATOM 92838 H1 WAT 790 44.230 70.882 73.168 1.00 0.00 H ATOM 92839 H2 WAT 790 43.070 70.174 72.503 1.00 0.00 H TER 92841 WAT 790 ATOM 92841 O WAT 791 124.547 13.093 57.298 1.00 0.00 O ATOM 92842 H1 WAT 791 125.411 13.314 56.949 1.00 0.00 H ATOM 92843 H2 WAT 791 124.517 13.525 58.152 1.00 0.00 H TER 92845 WAT 791 ATOM 92845 O WAT 792 112.298 18.313 129.668 1.00 0.00 O ATOM 92846 H1 WAT 792 113.233 18.223 129.854 1.00 0.00 H ATOM 92847 H2 WAT 792 112.257 18.474 128.725 1.00 0.00 H TER 92849 WAT 792 ATOM 92849 O WAT 793 39.702 126.748 143.119 1.00 0.00 O ATOM 92850 H1 WAT 793 40.112 125.930 143.401 1.00 0.00 H ATOM 92851 H2 WAT 793 39.256 126.523 142.302 1.00 0.00 H TER 92853 WAT 793 ATOM 92853 O WAT 794 145.285 39.556 116.763 1.00 0.00 O ATOM 92854 H1 WAT 794 145.387 40.160 116.028 1.00 0.00 H ATOM 92855 H2 WAT 794 145.003 40.109 117.491 1.00 0.00 H TER 92857 WAT 794 ATOM 92857 O WAT 795 50.774 129.120 151.384 1.00 0.00 O ATOM 92858 H1 WAT 795 50.965 129.128 150.446 1.00 0.00 H ATOM 92859 H2 WAT 795 51.627 129.237 151.803 1.00 0.00 H TER 92861 WAT 795 ATOM 92861 O WAT 796 37.197 139.800 54.481 1.00 0.00 O ATOM 92862 H1 WAT 796 37.897 140.349 54.836 1.00 0.00 H ATOM 92863 H2 WAT 796 37.099 139.094 55.120 1.00 0.00 H TER 92865 WAT 796 ATOM 92865 O WAT 797 139.825 52.243 97.711 1.00 0.00 O ATOM 92866 H1 WAT 797 139.676 51.863 96.845 1.00 0.00 H ATOM 92867 H2 WAT 797 140.673 52.680 97.638 1.00 0.00 H TER 92869 WAT 797 ATOM 92869 O WAT 798 39.892 66.590 13.690 1.00 0.00 O ATOM 92870 H1 WAT 798 39.286 67.036 13.099 1.00 0.00 H ATOM 92871 H2 WAT 798 39.469 65.752 13.880 1.00 0.00 H TER 92873 WAT 798 ATOM 92873 O WAT 799 101.384 3.190 96.855 1.00 0.00 O ATOM 92874 H1 WAT 799 100.436 3.224 96.722 1.00 0.00 H ATOM 92875 H2 WAT 799 101.717 3.964 96.402 1.00 0.00 H TER 92877 WAT 799 ATOM 92877 O WAT 800 110.179 145.648 118.085 1.00 0.00 O ATOM 92878 H1 WAT 800 109.996 145.004 118.769 1.00 0.00 H ATOM 92879 H2 WAT 800 110.924 146.147 118.419 1.00 0.00 H TER 92881 WAT 800 ATOM 92881 O WAT 801 82.676 122.845 134.396 1.00 0.00 O ATOM 92882 H1 WAT 801 82.702 121.901 134.552 1.00 0.00 H ATOM 92883 H2 WAT 801 83.081 123.228 135.174 1.00 0.00 H TER 92885 WAT 801 ATOM 92885 O WAT 802 90.554 52.990 94.354 1.00 0.00 O ATOM 92886 H1 WAT 802 89.733 53.325 94.715 1.00 0.00 H ATOM 92887 H2 WAT 802 90.960 53.751 93.939 1.00 0.00 H TER 92889 WAT 802 ATOM 92889 O WAT 803 127.654 34.365 130.836 1.00 0.00 O ATOM 92890 H1 WAT 803 127.667 33.630 131.450 1.00 0.00 H ATOM 92891 H2 WAT 803 127.824 35.134 131.380 1.00 0.00 H TER 92893 WAT 803 ATOM 92893 O WAT 804 17.457 103.379 114.091 1.00 0.00 O ATOM 92894 H1 WAT 804 16.688 103.673 114.578 1.00 0.00 H ATOM 92895 H2 WAT 804 18.137 104.017 114.309 1.00 0.00 H TER 92897 WAT 804 ATOM 92897 O WAT 805 45.420 57.380 148.854 1.00 0.00 O ATOM 92898 H1 WAT 805 46.015 56.640 148.983 1.00 0.00 H ATOM 92899 H2 WAT 805 45.410 57.516 147.906 1.00 0.00 H TER 92901 WAT 805 ATOM 92901 O WAT 806 53.091 68.766 13.950 1.00 0.00 O ATOM 92902 H1 WAT 806 53.691 68.142 14.359 1.00 0.00 H ATOM 92903 H2 WAT 806 52.219 68.447 14.182 1.00 0.00 H TER 92905 WAT 806 ATOM 92905 O WAT 807 24.473 17.780 80.669 1.00 0.00 O ATOM 92906 H1 WAT 807 24.796 18.606 81.030 1.00 0.00 H ATOM 92907 H2 WAT 807 25.239 17.384 80.255 1.00 0.00 H TER 92909 WAT 807 ATOM 92909 O WAT 808 83.363 35.868 81.489 1.00 0.00 O ATOM 92910 H1 WAT 808 82.529 35.750 81.943 1.00 0.00 H ATOM 92911 H2 WAT 808 83.276 35.350 80.688 1.00 0.00 H TER 92913 WAT 808 ATOM 92913 O WAT 809 11.698 42.330 131.976 1.00 0.00 O ATOM 92914 H1 WAT 809 12.450 42.446 132.556 1.00 0.00 H ATOM 92915 H2 WAT 809 11.119 41.733 132.450 1.00 0.00 H TER 92917 WAT 809 ATOM 92917 O WAT 810 142.229 132.261 139.233 1.00 0.00 O ATOM 92918 H1 WAT 810 142.685 132.145 138.400 1.00 0.00 H ATOM 92919 H2 WAT 810 141.662 131.494 139.305 1.00 0.00 H TER 92921 WAT 810 ATOM 92921 O WAT 811 37.350 136.431 135.048 1.00 0.00 O ATOM 92922 H1 WAT 811 36.557 136.865 135.362 1.00 0.00 H ATOM 92923 H2 WAT 811 37.247 136.402 134.097 1.00 0.00 H TER 92925 WAT 811 ATOM 92925 O WAT 812 29.071 67.397 147.817 1.00 0.00 O ATOM 92926 H1 WAT 812 29.542 66.682 148.244 1.00 0.00 H ATOM 92927 H2 WAT 812 28.888 68.018 148.522 1.00 0.00 H TER 92929 WAT 812 ATOM 92929 O WAT 813 120.432 50.033 131.480 1.00 0.00 O ATOM 92930 H1 WAT 813 119.581 50.209 131.079 1.00 0.00 H ATOM 92931 H2 WAT 813 120.276 50.120 132.421 1.00 0.00 H TER 92933 WAT 813 ATOM 92933 O WAT 814 2.586 6.634 71.983 1.00 0.00 O ATOM 92934 H1 WAT 814 2.408 7.568 71.869 1.00 0.00 H ATOM 92935 H2 WAT 814 2.363 6.457 72.896 1.00 0.00 H TER 92937 WAT 814 ATOM 92937 O WAT 815 69.564 88.501 126.661 1.00 0.00 O ATOM 92938 H1 WAT 815 68.903 88.093 127.219 1.00 0.00 H ATOM 92939 H2 WAT 815 70.154 88.943 127.273 1.00 0.00 H TER 92941 WAT 815 ATOM 92941 O WAT 816 27.299 32.728 110.140 1.00 0.00 O ATOM 92942 H1 WAT 816 26.347 32.774 110.049 1.00 0.00 H ATOM 92943 H2 WAT 816 27.626 33.451 109.605 1.00 0.00 H TER 92945 WAT 816 ATOM 92945 O WAT 817 113.125 45.614 72.846 1.00 0.00 O ATOM 92946 H1 WAT 817 113.034 46.038 73.699 1.00 0.00 H ATOM 92947 H2 WAT 817 113.230 46.338 72.229 1.00 0.00 H TER 92949 WAT 817 ATOM 92949 O WAT 818 111.625 137.819 17.949 1.00 0.00 O ATOM 92950 H1 WAT 818 111.974 137.117 17.399 1.00 0.00 H ATOM 92951 H2 WAT 818 110.748 137.982 17.601 1.00 0.00 H TER 92953 WAT 818 ATOM 92953 O WAT 819 15.447 122.605 119.738 1.00 0.00 O ATOM 92954 H1 WAT 819 16.110 123.286 119.852 1.00 0.00 H ATOM 92955 H2 WAT 819 15.808 122.030 119.063 1.00 0.00 H TER 92957 WAT 819 ATOM 92957 O WAT 820 14.885 136.765 142.533 1.00 0.00 O ATOM 92958 H1 WAT 820 13.974 136.476 142.467 1.00 0.00 H ATOM 92959 H2 WAT 820 15.109 136.640 143.455 1.00 0.00 H TER 92961 WAT 820 ATOM 92961 O WAT 821 35.825 3.116 141.511 1.00 0.00 O ATOM 92962 H1 WAT 821 35.145 3.219 142.176 1.00 0.00 H ATOM 92963 H2 WAT 821 36.158 4.002 141.370 1.00 0.00 H TER 92965 WAT 821 ATOM 92965 O WAT 822 84.791 85.322 153.206 1.00 0.00 O ATOM 92966 H1 WAT 822 83.908 85.646 153.023 1.00 0.00 H ATOM 92967 H2 WAT 822 85.325 85.668 152.491 1.00 0.00 H TER 92969 WAT 822 ATOM 92969 O WAT 823 61.068 143.228 56.395 1.00 0.00 O ATOM 92970 H1 WAT 823 61.474 142.467 55.980 1.00 0.00 H ATOM 92971 H2 WAT 823 61.351 143.971 55.862 1.00 0.00 H TER 92973 WAT 823 ATOM 92973 O WAT 824 83.616 81.451 16.148 1.00 0.00 O ATOM 92974 H1 WAT 824 83.631 82.404 16.059 1.00 0.00 H ATOM 92975 H2 WAT 824 83.314 81.136 15.296 1.00 0.00 H TER 92977 WAT 824 ATOM 92977 O WAT 825 122.569 67.275 144.002 1.00 0.00 O ATOM 92978 H1 WAT 825 122.021 67.015 144.743 1.00 0.00 H ATOM 92979 H2 WAT 825 123.445 67.372 144.374 1.00 0.00 H TER 92981 WAT 825 ATOM 92981 O WAT 826 65.520 21.278 150.281 1.00 0.00 O ATOM 92982 H1 WAT 826 66.405 21.498 149.992 1.00 0.00 H ATOM 92983 H2 WAT 826 65.496 20.321 150.271 1.00 0.00 H TER 92985 WAT 826 ATOM 92985 O WAT 827 -0.137 9.098 146.510 1.00 0.00 O ATOM 92986 H1 WAT 827 -0.413 8.486 147.192 1.00 0.00 H ATOM 92987 H2 WAT 827 0.744 9.367 146.772 1.00 0.00 H TER 92989 WAT 827 ATOM 92989 O WAT 828 93.424 54.898 124.658 1.00 0.00 O ATOM 92990 H1 WAT 828 93.766 55.056 125.537 1.00 0.00 H ATOM 92991 H2 WAT 828 94.148 55.125 124.075 1.00 0.00 H TER 92993 WAT 828 ATOM 92993 O WAT 829 106.858 38.891 114.425 1.00 0.00 O ATOM 92994 H1 WAT 829 105.951 38.886 114.122 1.00 0.00 H ATOM 92995 H2 WAT 829 107.379 38.825 113.625 1.00 0.00 H TER 92997 WAT 829 ATOM 92997 O WAT 830 32.930 17.118 7.144 1.00 0.00 O ATOM 92998 H1 WAT 830 32.958 16.189 6.913 1.00 0.00 H ATOM 92999 H2 WAT 830 31.997 17.323 7.199 1.00 0.00 H TER 93001 WAT 830 ATOM 93001 O WAT 831 40.632 91.917 57.797 1.00 0.00 O ATOM 93002 H1 WAT 831 39.702 92.048 57.612 1.00 0.00 H ATOM 93003 H2 WAT 831 40.752 90.968 57.761 1.00 0.00 H TER 93005 WAT 831 ATOM 93005 O WAT 832 78.906 54.020 111.574 1.00 0.00 O ATOM 93006 H1 WAT 832 79.150 54.845 111.994 1.00 0.00 H ATOM 93007 H2 WAT 832 79.361 54.036 110.732 1.00 0.00 H TER 93009 WAT 832 ATOM 93009 O WAT 833 81.153 5.061 80.784 1.00 0.00 O ATOM 93010 H1 WAT 833 81.015 4.135 80.984 1.00 0.00 H ATOM 93011 H2 WAT 833 80.903 5.147 79.864 1.00 0.00 H TER 93013 WAT 833 ATOM 93013 O WAT 834 16.598 132.677 19.004 1.00 0.00 O ATOM 93014 H1 WAT 834 16.765 132.930 19.912 1.00 0.00 H ATOM 93015 H2 WAT 834 15.820 133.177 18.756 1.00 0.00 H TER 93017 WAT 834 ATOM 93017 O WAT 835 11.994 79.421 105.131 1.00 0.00 O ATOM 93018 H1 WAT 835 12.784 79.299 105.657 1.00 0.00 H ATOM 93019 H2 WAT 835 11.309 79.617 105.770 1.00 0.00 H TER 93021 WAT 835 ATOM 93021 O WAT 836 14.254 129.017 71.518 1.00 0.00 O ATOM 93022 H1 WAT 836 14.086 129.452 72.354 1.00 0.00 H ATOM 93023 H2 WAT 836 13.943 129.637 70.859 1.00 0.00 H TER 93025 WAT 836 ATOM 93025 O WAT 837 5.629 57.962 2.603 1.00 0.00 O ATOM 93026 H1 WAT 837 6.299 58.205 1.964 1.00 0.00 H ATOM 93027 H2 WAT 837 6.044 58.109 3.453 1.00 0.00 H TER 93029 WAT 837 ATOM 93029 O WAT 838 38.862 34.375 129.837 1.00 0.00 O ATOM 93030 H1 WAT 838 38.774 35.100 130.456 1.00 0.00 H ATOM 93031 H2 WAT 838 37.979 34.015 129.763 1.00 0.00 H TER 93033 WAT 838 ATOM 93033 O WAT 839 81.020 84.013 139.150 1.00 0.00 O ATOM 93034 H1 WAT 839 81.782 84.504 138.842 1.00 0.00 H ATOM 93035 H2 WAT 839 80.271 84.465 138.762 1.00 0.00 H TER 93037 WAT 839 ATOM 93037 O WAT 840 134.081 115.098 148.883 1.00 0.00 O ATOM 93038 H1 WAT 840 133.171 114.845 148.726 1.00 0.00 H ATOM 93039 H2 WAT 840 134.227 114.907 149.809 1.00 0.00 H TER 93041 WAT 840 ATOM 93041 O WAT 841 21.406 97.575 104.688 1.00 0.00 O ATOM 93042 H1 WAT 841 20.969 97.550 105.539 1.00 0.00 H ATOM 93043 H2 WAT 841 22.280 97.915 104.878 1.00 0.00 H TER 93045 WAT 841 ATOM 93045 O WAT 842 109.523 74.529 116.705 1.00 0.00 O ATOM 93046 H1 WAT 842 108.602 74.747 116.850 1.00 0.00 H ATOM 93047 H2 WAT 842 109.753 73.963 117.442 1.00 0.00 H TER 93049 WAT 842 ATOM 93049 O WAT 843 33.862 55.794 129.142 1.00 0.00 O ATOM 93050 H1 WAT 843 33.125 56.403 129.100 1.00 0.00 H ATOM 93051 H2 WAT 843 33.959 55.599 130.074 1.00 0.00 H TER 93053 WAT 843 ATOM 93053 O WAT 844 12.312 85.765 105.223 1.00 0.00 O ATOM 93054 H1 WAT 844 12.877 86.382 105.690 1.00 0.00 H ATOM 93055 H2 WAT 844 12.862 85.425 104.517 1.00 0.00 H TER 93057 WAT 844 ATOM 93057 O WAT 845 123.474 107.960 95.429 1.00 0.00 O ATOM 93058 H1 WAT 845 122.624 108.364 95.602 1.00 0.00 H ATOM 93059 H2 WAT 845 123.467 107.778 94.490 1.00 0.00 H TER 93061 WAT 845 ATOM 93061 O WAT 846 146.070 24.173 93.738 1.00 0.00 O ATOM 93062 H1 WAT 846 145.406 23.529 93.492 1.00 0.00 H ATOM 93063 H2 WAT 846 145.961 24.281 94.682 1.00 0.00 H TER 93065 WAT 846 ATOM 93065 O WAT 847 82.955 1.789 126.127 1.00 0.00 O ATOM 93066 H1 WAT 847 83.683 2.400 126.243 1.00 0.00 H ATOM 93067 H2 WAT 847 83.246 1.200 125.431 1.00 0.00 H TER 93069 WAT 847 ATOM 93069 O WAT 848 128.783 39.352 121.563 1.00 0.00 O ATOM 93070 H1 WAT 848 128.974 40.143 122.068 1.00 0.00 H ATOM 93071 H2 WAT 848 129.635 38.931 121.447 1.00 0.00 H TER 93073 WAT 848 ATOM 93073 O WAT 849 130.188 12.365 156.641 1.00 0.00 O ATOM 93074 H1 WAT 849 129.323 12.113 156.315 1.00 0.00 H ATOM 93075 H2 WAT 849 130.568 11.549 156.967 1.00 0.00 H TER 93077 WAT 849 ATOM 93077 O WAT 850 127.638 23.052 107.164 1.00 0.00 O ATOM 93078 H1 WAT 850 127.992 23.519 106.408 1.00 0.00 H ATOM 93079 H2 WAT 850 128.133 23.392 107.910 1.00 0.00 H TER 93081 WAT 850 ATOM 93081 O WAT 851 82.502 48.580 75.549 1.00 0.00 O ATOM 93082 H1 WAT 851 82.402 47.661 75.299 1.00 0.00 H ATOM 93083 H2 WAT 851 82.787 48.550 76.462 1.00 0.00 H TER 93085 WAT 851 ATOM 93085 O WAT 852 111.228 65.815 100.278 1.00 0.00 O ATOM 93086 H1 WAT 852 111.034 65.528 99.386 1.00 0.00 H ATOM 93087 H2 WAT 852 112.156 66.050 100.258 1.00 0.00 H TER 93089 WAT 852 ATOM 93089 O WAT 853 18.923 143.219 116.243 1.00 0.00 O ATOM 93090 H1 WAT 853 19.019 144.095 116.618 1.00 0.00 H ATOM 93091 H2 WAT 853 18.474 143.364 115.410 1.00 0.00 H TER 93093 WAT 853 ATOM 93093 O WAT 854 2.821 46.216 148.725 1.00 0.00 O ATOM 93094 H1 WAT 854 1.986 46.498 149.098 1.00 0.00 H ATOM 93095 H2 WAT 854 2.627 46.049 147.803 1.00 0.00 H TER 93097 WAT 854 ATOM 93097 O WAT 855 3.098 33.891 103.099 1.00 0.00 O ATOM 93098 H1 WAT 855 2.763 34.706 103.474 1.00 0.00 H ATOM 93099 H2 WAT 855 3.519 34.158 102.283 1.00 0.00 H TER 93101 WAT 855 ATOM 93101 O WAT 856 52.474 78.642 133.279 1.00 0.00 O ATOM 93102 H1 WAT 856 52.358 78.415 134.201 1.00 0.00 H ATOM 93103 H2 WAT 856 52.551 77.799 132.833 1.00 0.00 H TER 93105 WAT 856 ATOM 93105 O WAT 857 53.251 13.208 136.734 1.00 0.00 O ATOM 93106 H1 WAT 857 52.682 12.495 137.023 1.00 0.00 H ATOM 93107 H2 WAT 857 53.370 13.055 135.797 1.00 0.00 H TER 93109 WAT 857 ATOM 93109 O WAT 858 114.833 42.097 142.683 1.00 0.00 O ATOM 93110 H1 WAT 858 114.245 42.626 142.144 1.00 0.00 H ATOM 93111 H2 WAT 858 115.644 42.050 142.178 1.00 0.00 H TER 93113 WAT 858 ATOM 93113 O WAT 859 98.220 47.714 119.345 1.00 0.00 O ATOM 93114 H1 WAT 859 98.296 48.556 118.895 1.00 0.00 H ATOM 93115 H2 WAT 859 99.122 47.405 119.427 1.00 0.00 H TER 93117 WAT 859 ATOM 93117 O WAT 860 58.123 72.023 11.355 1.00 0.00 O ATOM 93118 H1 WAT 860 58.107 72.979 11.400 1.00 0.00 H ATOM 93119 H2 WAT 860 57.236 71.781 11.088 1.00 0.00 H TER 93121 WAT 860 ATOM 93121 O WAT 861 108.143 41.212 94.035 1.00 0.00 O ATOM 93122 H1 WAT 861 107.740 42.079 94.003 1.00 0.00 H ATOM 93123 H2 WAT 861 108.880 41.267 93.426 1.00 0.00 H TER 93125 WAT 861 ATOM 93125 O WAT 862 93.145 112.188 126.827 1.00 0.00 O ATOM 93126 H1 WAT 862 92.243 112.042 126.542 1.00 0.00 H ATOM 93127 H2 WAT 862 93.177 113.117 127.056 1.00 0.00 H TER 93129 WAT 862 ATOM 93129 O WAT 863 26.733 51.782 103.243 1.00 0.00 O ATOM 93130 H1 WAT 863 26.606 52.619 102.798 1.00 0.00 H ATOM 93131 H2 WAT 863 25.859 51.539 103.550 1.00 0.00 H TER 93133 WAT 863 ATOM 93133 O WAT 864 129.532 71.104 71.546 1.00 0.00 O ATOM 93134 H1 WAT 864 128.898 70.810 70.891 1.00 0.00 H ATOM 93135 H2 WAT 864 130.202 70.421 71.554 1.00 0.00 H TER 93137 WAT 864 ATOM 93137 O WAT 865 84.547 85.851 58.412 1.00 0.00 O ATOM 93138 H1 WAT 865 84.747 85.263 57.684 1.00 0.00 H ATOM 93139 H2 WAT 865 83.677 86.195 58.209 1.00 0.00 H TER 93141 WAT 865 ATOM 93141 O WAT 866 106.303 42.532 140.627 1.00 0.00 O ATOM 93142 H1 WAT 866 106.254 43.015 139.802 1.00 0.00 H ATOM 93143 H2 WAT 866 106.906 43.043 141.167 1.00 0.00 H TER 93145 WAT 866 ATOM 93145 O WAT 867 110.861 4.702 131.041 1.00 0.00 O ATOM 93146 H1 WAT 867 110.849 3.747 131.108 1.00 0.00 H ATOM 93147 H2 WAT 867 111.586 4.890 130.445 1.00 0.00 H TER 93149 WAT 867 ATOM 93149 O WAT 868 79.886 17.166 80.450 1.00 0.00 O ATOM 93150 H1 WAT 868 79.234 16.795 79.855 1.00 0.00 H ATOM 93151 H2 WAT 868 80.705 17.135 79.956 1.00 0.00 H TER 93153 WAT 868 ATOM 93153 O WAT 869 69.473 50.008 17.757 1.00 0.00 O ATOM 93154 H1 WAT 869 68.535 50.024 17.948 1.00 0.00 H ATOM 93155 H2 WAT 869 69.708 50.929 17.636 1.00 0.00 H TER 93157 WAT 869 ATOM 93157 O WAT 870 51.206 134.065 1.443 1.00 0.00 O ATOM 93158 H1 WAT 870 51.969 134.625 1.296 1.00 0.00 H ATOM 93159 H2 WAT 870 51.537 133.175 1.325 1.00 0.00 H TER 93161 WAT 870 ATOM 93161 O WAT 871 67.892 106.818 96.167 1.00 0.00 O ATOM 93162 H1 WAT 871 67.122 107.091 96.666 1.00 0.00 H ATOM 93163 H2 WAT 871 67.536 106.461 95.353 1.00 0.00 H TER 93165 WAT 871 ATOM 93165 O WAT 872 41.171 74.688 145.883 1.00 0.00 O ATOM 93166 H1 WAT 872 40.906 74.489 146.782 1.00 0.00 H ATOM 93167 H2 WAT 872 42.028 74.272 145.789 1.00 0.00 H TER 93169 WAT 872 ATOM 93169 O WAT 873 18.948 11.631 19.701 1.00 0.00 O ATOM 93170 H1 WAT 873 18.941 12.572 19.525 1.00 0.00 H ATOM 93171 H2 WAT 873 19.464 11.542 20.503 1.00 0.00 H TER 93173 WAT 873 ATOM 93173 O WAT 874 135.675 5.849 156.370 1.00 0.00 O ATOM 93174 H1 WAT 874 136.498 5.532 156.741 1.00 0.00 H ATOM 93175 H2 WAT 874 135.817 6.786 156.237 1.00 0.00 H TER 93177 WAT 874 ATOM 93177 O WAT 875 16.306 24.309 107.695 1.00 0.00 O ATOM 93178 H1 WAT 875 16.938 23.595 107.607 1.00 0.00 H ATOM 93179 H2 WAT 875 16.206 24.651 106.807 1.00 0.00 H TER 93181 WAT 875 ATOM 93181 O WAT 876 71.812 98.618 65.269 1.00 0.00 O ATOM 93182 H1 WAT 876 72.017 98.797 66.187 1.00 0.00 H ATOM 93183 H2 WAT 876 71.302 97.808 65.292 1.00 0.00 H TER 93185 WAT 876 ATOM 93185 O WAT 877 18.495 128.735 123.719 1.00 0.00 O ATOM 93186 H1 WAT 877 19.016 129.038 122.976 1.00 0.00 H ATOM 93187 H2 WAT 877 17.680 128.420 123.328 1.00 0.00 H TER 93189 WAT 877 ATOM 93189 O WAT 878 115.964 133.804 92.209 1.00 0.00 O ATOM 93190 H1 WAT 878 115.394 133.842 92.978 1.00 0.00 H ATOM 93191 H2 WAT 878 116.054 134.716 91.933 1.00 0.00 H TER 93193 WAT 878 ATOM 93193 O WAT 879 43.906 80.532 153.542 1.00 0.00 O ATOM 93194 H1 WAT 879 44.830 80.779 153.570 1.00 0.00 H ATOM 93195 H2 WAT 879 43.699 80.274 154.440 1.00 0.00 H TER 93197 WAT 879 ATOM 93197 O WAT 880 50.916 107.137 97.353 1.00 0.00 O ATOM 93198 H1 WAT 880 50.359 107.914 97.411 1.00 0.00 H ATOM 93199 H2 WAT 880 50.522 106.611 96.657 1.00 0.00 H TER 93201 WAT 880 ATOM 93201 O WAT 881 42.798 86.806 28.240 1.00 0.00 O ATOM 93202 H1 WAT 881 42.928 87.590 27.706 1.00 0.00 H ATOM 93203 H2 WAT 881 42.772 86.088 27.609 1.00 0.00 H TER 93205 WAT 881 ATOM 93205 O WAT 882 43.315 52.651 26.973 1.00 0.00 O ATOM 93206 H1 WAT 882 43.636 53.465 26.584 1.00 0.00 H ATOM 93207 H2 WAT 882 42.696 52.307 26.329 1.00 0.00 H TER 93209 WAT 882 ATOM 93209 O WAT 883 5.820 117.556 97.426 1.00 0.00 O ATOM 93210 H1 WAT 883 5.221 117.338 98.140 1.00 0.00 H ATOM 93211 H2 WAT 883 6.603 117.034 97.603 1.00 0.00 H TER 93213 WAT 883 ATOM 93213 O WAT 884 133.218 25.689 81.245 1.00 0.00 O ATOM 93214 H1 WAT 884 134.121 25.377 81.306 1.00 0.00 H ATOM 93215 H2 WAT 884 133.275 26.625 81.439 1.00 0.00 H TER 93217 WAT 884 ATOM 93217 O WAT 885 131.830 14.403 67.116 1.00 0.00 O ATOM 93218 H1 WAT 885 130.916 14.545 66.870 1.00 0.00 H ATOM 93219 H2 WAT 885 132.326 14.609 66.323 1.00 0.00 H TER 93221 WAT 885 ATOM 93221 O WAT 886 13.671 118.409 79.605 1.00 0.00 O ATOM 93222 H1 WAT 886 14.318 117.705 79.573 1.00 0.00 H ATOM 93223 H2 WAT 886 13.185 118.326 78.784 1.00 0.00 H TER 93225 WAT 886 ATOM 93225 O WAT 887 7.317 43.923 82.240 1.00 0.00 O ATOM 93226 H1 WAT 887 7.992 44.596 82.318 1.00 0.00 H ATOM 93227 H2 WAT 887 7.335 43.466 83.081 1.00 0.00 H TER 93229 WAT 887 ATOM 93229 O WAT 888 9.008 42.070 62.392 1.00 0.00 O ATOM 93230 H1 WAT 888 8.149 42.354 62.705 1.00 0.00 H ATOM 93231 H2 WAT 888 9.127 42.537 61.565 1.00 0.00 H TER 93233 WAT 888 ATOM 93233 O WAT 889 126.896 68.608 133.765 1.00 0.00 O ATOM 93234 H1 WAT 889 126.295 68.115 134.324 1.00 0.00 H ATOM 93235 H2 WAT 889 126.827 69.511 134.076 1.00 0.00 H TER 93237 WAT 889 ATOM 93237 O WAT 890 8.739 125.917 81.455 1.00 0.00 O ATOM 93238 H1 WAT 890 9.366 125.199 81.534 1.00 0.00 H ATOM 93239 H2 WAT 890 9.220 126.689 81.753 1.00 0.00 H TER 93241 WAT 890 ATOM 93241 O WAT 891 49.985 53.579 147.913 1.00 0.00 O ATOM 93242 H1 WAT 891 49.491 53.051 148.540 1.00 0.00 H ATOM 93243 H2 WAT 891 50.400 54.258 148.445 1.00 0.00 H TER 93245 WAT 891 ATOM 93245 O WAT 892 45.032 10.566 121.184 1.00 0.00 O ATOM 93246 H1 WAT 892 44.497 11.350 121.313 1.00 0.00 H ATOM 93247 H2 WAT 892 45.933 10.890 121.177 1.00 0.00 H TER 93249 WAT 892 ATOM 93249 O WAT 893 131.626 127.735 61.460 1.00 0.00 O ATOM 93250 H1 WAT 893 132.557 127.518 61.433 1.00 0.00 H ATOM 93251 H2 WAT 893 131.602 128.658 61.715 1.00 0.00 H TER 93253 WAT 893 ATOM 93253 O WAT 894 75.686 22.786 103.992 1.00 0.00 O ATOM 93254 H1 WAT 894 76.168 23.409 104.535 1.00 0.00 H ATOM 93255 H2 WAT 894 75.979 21.927 104.295 1.00 0.00 H TER 93257 WAT 894 ATOM 93257 O WAT 895 57.553 16.942 157.452 1.00 0.00 O ATOM 93258 H1 WAT 895 57.168 17.779 157.712 1.00 0.00 H ATOM 93259 H2 WAT 895 57.225 16.316 158.097 1.00 0.00 H TER 93261 WAT 895 ATOM 93261 O WAT 896 113.917 71.089 62.506 1.00 0.00 O ATOM 93262 H1 WAT 896 114.766 70.657 62.597 1.00 0.00 H ATOM 93263 H2 WAT 896 113.859 71.665 63.268 1.00 0.00 H TER 93265 WAT 896 ATOM 93265 O WAT 897 89.815 117.492 67.104 1.00 0.00 O ATOM 93266 H1 WAT 897 90.596 117.703 67.616 1.00 0.00 H ATOM 93267 H2 WAT 897 89.864 116.545 66.973 1.00 0.00 H TER 93269 WAT 897 ATOM 93269 O WAT 898 36.273 12.459 84.542 1.00 0.00 O ATOM 93270 H1 WAT 898 35.466 12.959 84.416 1.00 0.00 H ATOM 93271 H2 WAT 898 36.178 12.067 85.410 1.00 0.00 H TER 93273 WAT 898 ATOM 93273 O WAT 899 1.474 82.666 74.057 1.00 0.00 O ATOM 93274 H1 WAT 899 0.954 82.247 74.743 1.00 0.00 H ATOM 93275 H2 WAT 899 2.291 82.166 74.037 1.00 0.00 H TER 93277 WAT 899 ATOM 93277 O WAT 900 89.184 135.383 151.963 1.00 0.00 O ATOM 93278 H1 WAT 900 90.040 135.194 152.346 1.00 0.00 H ATOM 93279 H2 WAT 900 89.142 134.829 151.183 1.00 0.00 H TER 93281 WAT 900 ATOM 93281 O WAT 901 137.851 12.395 83.957 1.00 0.00 O ATOM 93282 H1 WAT 901 138.323 12.712 84.727 1.00 0.00 H ATOM 93283 H2 WAT 901 138.185 11.509 83.820 1.00 0.00 H TER 93285 WAT 901 ATOM 93285 O WAT 902 60.177 28.694 154.264 1.00 0.00 O ATOM 93286 H1 WAT 902 60.540 28.417 153.423 1.00 0.00 H ATOM 93287 H2 WAT 902 60.681 29.474 154.498 1.00 0.00 H TER 93289 WAT 902 ATOM 93289 O WAT 903 23.863 68.720 78.269 1.00 0.00 O ATOM 93290 H1 WAT 903 23.485 69.457 77.789 1.00 0.00 H ATOM 93291 H2 WAT 903 24.787 68.948 78.369 1.00 0.00 H TER 93293 WAT 903 ATOM 93293 O WAT 904 141.771 41.136 117.955 1.00 0.00 O ATOM 93294 H1 WAT 904 141.851 41.881 118.551 1.00 0.00 H ATOM 93295 H2 WAT 904 141.019 41.350 117.403 1.00 0.00 H TER 93297 WAT 904 ATOM 93297 O WAT 905 114.339 21.341 120.969 1.00 0.00 O ATOM 93298 H1 WAT 905 113.684 21.829 120.470 1.00 0.00 H ATOM 93299 H2 WAT 905 113.828 20.828 121.595 1.00 0.00 H TER 93301 WAT 905 ATOM 93301 O WAT 906 44.017 83.674 6.538 1.00 0.00 O ATOM 93302 H1 WAT 906 43.556 83.778 5.706 1.00 0.00 H ATOM 93303 H2 WAT 906 43.394 83.217 7.102 1.00 0.00 H TER 93305 WAT 906 ATOM 93305 O WAT 907 68.909 50.984 109.291 1.00 0.00 O ATOM 93306 H1 WAT 907 68.808 50.134 109.720 1.00 0.00 H ATOM 93307 H2 WAT 907 68.036 51.189 108.957 1.00 0.00 H TER 93309 WAT 907 ATOM 93309 O WAT 908 128.154 118.030 92.938 1.00 0.00 O ATOM 93310 H1 WAT 908 128.760 117.882 93.664 1.00 0.00 H ATOM 93311 H2 WAT 908 128.400 117.377 92.283 1.00 0.00 H TER 93313 WAT 908 ATOM 93313 O WAT 909 54.833 9.156 148.349 1.00 0.00 O ATOM 93314 H1 WAT 909 54.762 8.965 147.414 1.00 0.00 H ATOM 93315 H2 WAT 909 55.774 9.238 148.506 1.00 0.00 H TER 93317 WAT 909 ATOM 93317 O WAT 910 67.371 58.372 133.672 1.00 0.00 O ATOM 93318 H1 WAT 910 67.985 58.417 132.938 1.00 0.00 H ATOM 93319 H2 WAT 910 67.175 57.440 133.763 1.00 0.00 H TER 93321 WAT 910 ATOM 93321 O WAT 911 17.692 19.932 70.346 1.00 0.00 O ATOM 93322 H1 WAT 911 18.165 19.818 69.521 1.00 0.00 H ATOM 93323 H2 WAT 911 17.155 20.712 70.208 1.00 0.00 H TER 93325 WAT 911 ATOM 93325 O WAT 912 144.803 144.906 16.612 1.00 0.00 O ATOM 93326 H1 WAT 912 144.749 144.157 17.207 1.00 0.00 H ATOM 93327 H2 WAT 912 144.472 144.573 15.778 1.00 0.00 H TER 93329 WAT 912 ATOM 93329 O WAT 913 52.390 118.076 156.706 1.00 0.00 O ATOM 93330 H1 WAT 913 52.056 117.262 157.083 1.00 0.00 H ATOM 93331 H2 WAT 913 52.362 118.703 157.428 1.00 0.00 H TER 93333 WAT 913 ATOM 93333 O WAT 914 141.864 81.918 63.469 1.00 0.00 O ATOM 93334 H1 WAT 914 142.067 82.251 62.595 1.00 0.00 H ATOM 93335 H2 WAT 914 141.418 81.086 63.310 1.00 0.00 H TER 93337 WAT 914 ATOM 93337 O WAT 915 95.525 17.407 89.960 1.00 0.00 O ATOM 93338 H1 WAT 915 95.156 16.842 89.281 1.00 0.00 H ATOM 93339 H2 WAT 915 96.028 18.063 89.479 1.00 0.00 H TER 93341 WAT 915 ATOM 93341 O WAT 916 133.795 45.971 148.587 1.00 0.00 O ATOM 93342 H1 WAT 916 132.923 45.953 148.981 1.00 0.00 H ATOM 93343 H2 WAT 916 133.646 46.257 147.686 1.00 0.00 H TER 93345 WAT 916 ATOM 93345 O WAT 917 21.029 14.276 72.228 1.00 0.00 O ATOM 93346 H1 WAT 917 20.434 13.903 72.878 1.00 0.00 H ATOM 93347 H2 WAT 917 20.554 14.208 71.400 1.00 0.00 H TER 93349 WAT 917 ATOM 93349 O WAT 918 99.148 9.375 101.557 1.00 0.00 O ATOM 93350 H1 WAT 918 98.748 9.492 100.695 1.00 0.00 H ATOM 93351 H2 WAT 918 100.018 9.022 101.371 1.00 0.00 H TER 93353 WAT 918 ATOM 93353 O WAT 919 31.625 77.464 110.061 1.00 0.00 O ATOM 93354 H1 WAT 919 31.338 77.280 109.167 1.00 0.00 H ATOM 93355 H2 WAT 919 32.505 77.825 109.961 1.00 0.00 H TER 93357 WAT 919 ATOM 93357 O WAT 920 93.306 116.519 132.148 1.00 0.00 O ATOM 93358 H1 WAT 920 93.457 115.601 132.373 1.00 0.00 H ATOM 93359 H2 WAT 920 94.179 116.910 132.138 1.00 0.00 H TER 93361 WAT 920 ATOM 93361 O WAT 921 18.716 122.728 95.923 1.00 0.00 O ATOM 93362 H1 WAT 921 18.209 123.538 95.977 1.00 0.00 H ATOM 93363 H2 WAT 921 19.186 122.683 96.755 1.00 0.00 H TER 93365 WAT 921 ATOM 93365 O WAT 922 106.457 92.305 65.130 1.00 0.00 O ATOM 93366 H1 WAT 922 105.820 91.637 64.878 1.00 0.00 H ATOM 93367 H2 WAT 922 106.775 92.659 64.300 1.00 0.00 H TER 93369 WAT 922 ATOM 93369 O WAT 923 67.697 133.632 97.722 1.00 0.00 O ATOM 93370 H1 WAT 923 67.097 133.910 97.030 1.00 0.00 H ATOM 93371 H2 WAT 923 67.856 134.424 98.234 1.00 0.00 H TER 93373 WAT 923 ATOM 93373 O WAT 924 52.205 23.727 137.379 1.00 0.00 O ATOM 93374 H1 WAT 924 52.966 23.448 136.870 1.00 0.00 H ATOM 93375 H2 WAT 924 51.525 23.088 137.163 1.00 0.00 H TER 93377 WAT 924 ATOM 93377 O WAT 925 99.994 115.803 103.811 1.00 0.00 O ATOM 93378 H1 WAT 925 100.060 115.330 104.641 1.00 0.00 H ATOM 93379 H2 WAT 925 99.443 116.560 104.009 1.00 0.00 H TER 93381 WAT 925 ATOM 93381 O WAT 926 69.875 100.263 118.391 1.00 0.00 O ATOM 93382 H1 WAT 926 70.188 99.871 119.206 1.00 0.00 H ATOM 93383 H2 WAT 926 70.660 100.627 117.983 1.00 0.00 H TER 93385 WAT 926 ATOM 93385 O WAT 927 121.404 98.507 141.091 1.00 0.00 O ATOM 93386 H1 WAT 927 122.152 98.237 140.559 1.00 0.00 H ATOM 93387 H2 WAT 927 121.783 99.057 141.776 1.00 0.00 H TER 93389 WAT 927 ATOM 93389 O WAT 928 129.020 138.925 113.664 1.00 0.00 O ATOM 93390 H1 WAT 928 129.749 138.690 113.089 1.00 0.00 H ATOM 93391 H2 WAT 928 129.240 139.800 113.984 1.00 0.00 H TER 93393 WAT 928 ATOM 93393 O WAT 929 68.246 78.397 16.053 1.00 0.00 O ATOM 93394 H1 WAT 929 68.124 77.998 15.191 1.00 0.00 H ATOM 93395 H2 WAT 929 67.647 77.917 16.625 1.00 0.00 H TER 93397 WAT 929 ATOM 93397 O WAT 930 60.123 87.034 103.793 1.00 0.00 O ATOM 93398 H1 WAT 930 59.736 86.325 103.279 1.00 0.00 H ATOM 93399 H2 WAT 930 59.451 87.257 104.437 1.00 0.00 H TER 93401 WAT 930 ATOM 93401 O WAT 931 31.382 120.987 12.670 1.00 0.00 O ATOM 93402 H1 WAT 931 31.359 120.904 13.623 1.00 0.00 H ATOM 93403 H2 WAT 931 31.779 121.844 12.514 1.00 0.00 H TER 93405 WAT 931 ATOM 93405 O WAT 932 126.304 37.853 75.325 1.00 0.00 O ATOM 93406 H1 WAT 932 125.357 37.982 75.266 1.00 0.00 H ATOM 93407 H2 WAT 932 126.579 38.419 76.046 1.00 0.00 H TER 93409 WAT 932 ATOM 93409 O WAT 933 75.059 32.770 90.465 1.00 0.00 O ATOM 93410 H1 WAT 933 75.255 33.502 91.050 1.00 0.00 H ATOM 93411 H2 WAT 933 74.955 33.174 89.603 1.00 0.00 H TER 93413 WAT 933 ATOM 93413 O WAT 934 30.544 131.494 102.605 1.00 0.00 O ATOM 93414 H1 WAT 934 30.494 132.034 103.393 1.00 0.00 H ATOM 93415 H2 WAT 934 31.048 130.725 102.873 1.00 0.00 H TER 93417 WAT 934 ATOM 93417 O WAT 935 69.726 123.628 137.847 1.00 0.00 O ATOM 93418 H1 WAT 935 69.949 124.306 137.209 1.00 0.00 H ATOM 93419 H2 WAT 935 69.351 124.108 138.586 1.00 0.00 H TER 93421 WAT 935 ATOM 93421 O WAT 936 93.209 114.962 106.082 1.00 0.00 O ATOM 93422 H1 WAT 936 93.088 114.379 106.832 1.00 0.00 H ATOM 93423 H2 WAT 936 92.903 114.454 105.331 1.00 0.00 H TER 93425 WAT 936 ATOM 93425 O WAT 937 129.231 51.171 133.430 1.00 0.00 O ATOM 93426 H1 WAT 937 129.364 50.796 132.559 1.00 0.00 H ATOM 93427 H2 WAT 937 130.108 51.417 133.721 1.00 0.00 H TER 93429 WAT 937 ATOM 93429 O WAT 938 95.804 75.062 155.494 1.00 0.00 O ATOM 93430 H1 WAT 938 96.274 74.249 155.681 1.00 0.00 H ATOM 93431 H2 WAT 938 95.410 74.918 154.634 1.00 0.00 H TER 93433 WAT 938 ATOM 93433 O WAT 939 7.598 14.669 113.503 1.00 0.00 O ATOM 93434 H1 WAT 939 7.565 13.803 113.910 1.00 0.00 H ATOM 93435 H2 WAT 939 8.497 14.749 113.184 1.00 0.00 H TER 93437 WAT 939 ATOM 93437 O WAT 940 89.170 123.794 68.800 1.00 0.00 O ATOM 93438 H1 WAT 940 88.720 124.259 69.505 1.00 0.00 H ATOM 93439 H2 WAT 940 89.398 124.478 68.170 1.00 0.00 H TER 93441 WAT 940 ATOM 93441 O WAT 941 21.795 106.885 94.558 1.00 0.00 O ATOM 93442 H1 WAT 941 22.420 107.572 94.328 1.00 0.00 H ATOM 93443 H2 WAT 941 22.331 106.098 94.658 1.00 0.00 H TER 93445 WAT 941 ATOM 93445 O WAT 942 86.158 77.349 86.521 1.00 0.00 O ATOM 93446 H1 WAT 942 86.873 77.965 86.359 1.00 0.00 H ATOM 93447 H2 WAT 942 86.544 76.677 87.083 1.00 0.00 H TER 93449 WAT 942 ATOM 93449 O WAT 943 145.848 111.659 156.759 1.00 0.00 O ATOM 93450 H1 WAT 943 144.892 111.709 156.755 1.00 0.00 H ATOM 93451 H2 WAT 943 146.050 110.886 156.232 1.00 0.00 H TER 93453 WAT 943 ATOM 93453 O WAT 944 127.237 20.498 7.409 1.00 0.00 O ATOM 93454 H1 WAT 944 127.554 20.803 6.559 1.00 0.00 H ATOM 93455 H2 WAT 944 126.353 20.857 7.478 1.00 0.00 H TER 93457 WAT 944 ATOM 93457 O WAT 945 99.976 135.548 127.924 1.00 0.00 O ATOM 93458 H1 WAT 945 100.885 135.267 128.025 1.00 0.00 H ATOM 93459 H2 WAT 945 100.036 136.421 127.535 1.00 0.00 H TER 93461 WAT 945 ATOM 93461 O WAT 946 125.761 7.260 118.233 1.00 0.00 O ATOM 93462 H1 WAT 946 125.147 6.621 118.595 1.00 0.00 H ATOM 93463 H2 WAT 946 126.620 6.849 118.330 1.00 0.00 H TER 93465 WAT 946 ATOM 93465 O WAT 947 27.858 10.240 77.961 1.00 0.00 O ATOM 93466 H1 WAT 947 28.384 9.442 77.900 1.00 0.00 H ATOM 93467 H2 WAT 947 27.041 10.024 77.511 1.00 0.00 H TER 93469 WAT 947 ATOM 93469 O WAT 948 6.279 96.165 139.054 1.00 0.00 O ATOM 93470 H1 WAT 948 5.347 96.293 138.876 1.00 0.00 H ATOM 93471 H2 WAT 948 6.677 96.068 138.188 1.00 0.00 H TER 93473 WAT 948 ATOM 93473 O WAT 949 123.654 36.058 7.606 1.00 0.00 O ATOM 93474 H1 WAT 949 123.904 35.135 7.558 1.00 0.00 H ATOM 93475 H2 WAT 949 122.794 36.052 8.026 1.00 0.00 H TER 93477 WAT 949 ATOM 93477 O WAT 950 78.535 71.275 156.119 1.00 0.00 O ATOM 93478 H1 WAT 950 77.932 71.460 156.839 1.00 0.00 H ATOM 93479 H2 WAT 950 77.983 70.896 155.435 1.00 0.00 H TER 93481 WAT 950 ATOM 93481 O WAT 951 144.176 76.865 89.960 1.00 0.00 O ATOM 93482 H1 WAT 951 143.924 75.942 89.963 1.00 0.00 H ATOM 93483 H2 WAT 951 144.791 76.948 90.690 1.00 0.00 H TER 93485 WAT 951 ATOM 93485 O WAT 952 87.691 69.970 150.177 1.00 0.00 O ATOM 93486 H1 WAT 952 86.899 70.400 149.854 1.00 0.00 H ATOM 93487 H2 WAT 952 87.416 69.536 150.984 1.00 0.00 H TER 93489 WAT 952 ATOM 93489 O WAT 953 46.183 13.799 5.733 1.00 0.00 O ATOM 93490 H1 WAT 953 46.439 14.248 4.928 1.00 0.00 H ATOM 93491 H2 WAT 953 46.929 13.235 5.940 1.00 0.00 H TER 93493 WAT 953 ATOM 93493 O WAT 954 72.483 30.776 138.722 1.00 0.00 O ATOM 93494 H1 WAT 954 73.332 30.334 138.736 1.00 0.00 H ATOM 93495 H2 WAT 954 72.137 30.602 137.847 1.00 0.00 H TER 93497 WAT 954 ATOM 93497 O WAT 955 7.027 7.969 92.515 1.00 0.00 O ATOM 93498 H1 WAT 955 7.387 8.490 91.796 1.00 0.00 H ATOM 93499 H2 WAT 955 6.415 8.559 92.955 1.00 0.00 H TER 93501 WAT 955 ATOM 93501 O WAT 956 36.300 121.668 61.511 1.00 0.00 O ATOM 93502 H1 WAT 956 36.877 121.856 62.251 1.00 0.00 H ATOM 93503 H2 WAT 956 36.780 121.021 60.993 1.00 0.00 H TER 93505 WAT 956 ATOM 93505 O WAT 957 94.593 109.338 19.994 1.00 0.00 O ATOM 93506 H1 WAT 957 95.365 109.608 20.492 1.00 0.00 H ATOM 93507 H2 WAT 957 94.688 109.778 19.149 1.00 0.00 H TER 93509 WAT 957 ATOM 93509 O WAT 958 100.667 133.532 90.104 1.00 0.00 O ATOM 93510 H1 WAT 958 100.960 133.259 90.974 1.00 0.00 H ATOM 93511 H2 WAT 958 100.614 134.486 90.158 1.00 0.00 H TER 93513 WAT 958 ATOM 93513 O WAT 959 136.631 16.044 0.863 1.00 0.00 O ATOM 93514 H1 WAT 959 136.139 15.956 1.680 1.00 0.00 H ATOM 93515 H2 WAT 959 136.009 16.436 0.250 1.00 0.00 H TER 93517 WAT 959 ATOM 93517 O WAT 960 21.907 68.794 139.930 1.00 0.00 O ATOM 93518 H1 WAT 960 22.823 68.520 139.962 1.00 0.00 H ATOM 93519 H2 WAT 960 21.547 68.336 139.171 1.00 0.00 H TER 93521 WAT 960 ATOM 93521 O WAT 961 40.731 121.661 128.293 1.00 0.00 O ATOM 93522 H1 WAT 961 41.436 121.361 128.867 1.00 0.00 H ATOM 93523 H2 WAT 961 41.148 121.766 127.437 1.00 0.00 H TER 93525 WAT 961 ATOM 93525 O WAT 962 109.358 58.738 118.621 1.00 0.00 O ATOM 93526 H1 WAT 962 110.212 58.446 118.302 1.00 0.00 H ATOM 93527 H2 WAT 962 109.536 59.093 119.492 1.00 0.00 H TER 93529 WAT 962 ATOM 93529 O WAT 963 95.194 38.169 147.218 1.00 0.00 O ATOM 93530 H1 WAT 963 95.049 39.027 147.616 1.00 0.00 H ATOM 93531 H2 WAT 963 94.460 37.636 147.525 1.00 0.00 H TER 93533 WAT 963 ATOM 93533 O WAT 964 104.231 79.162 28.866 1.00 0.00 O ATOM 93534 H1 WAT 964 104.892 78.471 28.824 1.00 0.00 H ATOM 93535 H2 WAT 964 103.400 78.695 28.953 1.00 0.00 H TER 93537 WAT 964 ATOM 93537 O WAT 965 139.476 144.130 147.610 1.00 0.00 O ATOM 93538 H1 WAT 965 139.228 145.052 147.535 1.00 0.00 H ATOM 93539 H2 WAT 965 138.740 143.651 147.231 1.00 0.00 H TER 93541 WAT 965 ATOM 93541 O WAT 966 58.254 129.173 150.754 1.00 0.00 O ATOM 93542 H1 WAT 966 58.697 128.473 151.234 1.00 0.00 H ATOM 93543 H2 WAT 966 58.721 129.225 149.921 1.00 0.00 H TER 93545 WAT 966 ATOM 93545 O WAT 967 40.428 106.207 105.071 1.00 0.00 O ATOM 93546 H1 WAT 967 40.208 106.078 104.149 1.00 0.00 H ATOM 93547 H2 WAT 967 41.109 105.558 105.248 1.00 0.00 H TER 93549 WAT 967 ATOM 93549 O WAT 968 8.413 78.936 1.641 1.00 0.00 O ATOM 93550 H1 WAT 968 9.133 78.366 1.909 1.00 0.00 H ATOM 93551 H2 WAT 968 8.594 79.771 2.074 1.00 0.00 H TER 93553 WAT 968 ATOM 93553 O WAT 969 61.822 103.332 59.106 1.00 0.00 O ATOM 93554 H1 WAT 969 62.432 102.609 58.965 1.00 0.00 H ATOM 93555 H2 WAT 969 62.186 104.056 58.596 1.00 0.00 H TER 93557 WAT 969 ATOM 93557 O WAT 970 0.850 9.752 121.327 1.00 0.00 O ATOM 93558 H1 WAT 970 0.135 9.169 121.581 1.00 0.00 H ATOM 93559 H2 WAT 970 0.414 10.506 120.929 1.00 0.00 H TER 93561 WAT 970 ATOM 93561 O WAT 971 15.606 2.148 0.736 1.00 0.00 O ATOM 93562 H1 WAT 971 15.215 1.832 -0.079 1.00 0.00 H ATOM 93563 H2 WAT 971 14.858 2.377 1.287 1.00 0.00 H TER 93565 WAT 971 ATOM 93565 O WAT 972 61.125 117.659 112.332 1.00 0.00 O ATOM 93566 H1 WAT 972 60.462 118.146 111.844 1.00 0.00 H ATOM 93567 H2 WAT 972 60.633 116.976 112.789 1.00 0.00 H TER 93569 WAT 972 ATOM 93569 O WAT 973 109.856 35.643 95.732 1.00 0.00 O ATOM 93570 H1 WAT 973 109.357 35.582 94.917 1.00 0.00 H ATOM 93571 H2 WAT 973 110.772 35.629 95.453 1.00 0.00 H TER 93573 WAT 973 ATOM 93573 O WAT 974 124.411 64.637 127.525 1.00 0.00 O ATOM 93574 H1 WAT 974 124.530 64.942 128.424 1.00 0.00 H ATOM 93575 H2 WAT 974 125.160 64.062 127.366 1.00 0.00 H TER 93577 WAT 974 ATOM 93577 O WAT 975 7.022 17.504 18.325 1.00 0.00 O ATOM 93578 H1 WAT 975 7.447 18.027 19.005 1.00 0.00 H ATOM 93579 H2 WAT 975 6.734 18.146 17.675 1.00 0.00 H TER 93581 WAT 975 ATOM 93581 O WAT 976 122.903 31.687 94.666 1.00 0.00 O ATOM 93582 H1 WAT 976 123.270 30.845 94.934 1.00 0.00 H ATOM 93583 H2 WAT 976 122.684 32.125 95.488 1.00 0.00 H TER 93585 WAT 976 ATOM 93585 O WAT 977 37.012 48.010 26.757 1.00 0.00 O ATOM 93586 H1 WAT 977 36.870 47.438 26.003 1.00 0.00 H ATOM 93587 H2 WAT 977 37.821 48.479 26.552 1.00 0.00 H TER 93589 WAT 977 ATOM 93589 O WAT 978 10.001 133.166 153.057 1.00 0.00 O ATOM 93590 H1 WAT 978 9.348 132.713 152.522 1.00 0.00 H ATOM 93591 H2 WAT 978 9.738 134.086 153.028 1.00 0.00 H TER 93593 WAT 978 ATOM 93593 O WAT 979 32.790 84.569 20.106 1.00 0.00 O ATOM 93594 H1 WAT 979 33.319 84.372 20.878 1.00 0.00 H ATOM 93595 H2 WAT 979 32.641 85.513 20.151 1.00 0.00 H TER 93597 WAT 979 ATOM 93597 O WAT 980 47.484 44.866 62.167 1.00 0.00 O ATOM 93598 H1 WAT 980 48.403 44.844 62.435 1.00 0.00 H ATOM 93599 H2 WAT 980 47.414 44.186 61.497 1.00 0.00 H TER 93601 WAT 980 ATOM 93601 O WAT 981 54.258 42.461 10.155 1.00 0.00 O ATOM 93602 H1 WAT 981 53.715 42.038 9.489 1.00 0.00 H ATOM 93603 H2 WAT 981 54.077 41.971 10.958 1.00 0.00 H TER 93605 WAT 981 ATOM 93605 O WAT 982 22.408 55.094 116.486 1.00 0.00 O ATOM 93606 H1 WAT 982 22.323 56.042 116.586 1.00 0.00 H ATOM 93607 H2 WAT 982 21.528 54.756 116.652 1.00 0.00 H TER 93609 WAT 982 ATOM 93609 O WAT 983 13.236 25.245 67.667 1.00 0.00 O ATOM 93610 H1 WAT 983 13.269 24.420 68.153 1.00 0.00 H ATOM 93611 H2 WAT 983 13.786 25.091 66.898 1.00 0.00 H TER 93613 WAT 983 ATOM 93613 O WAT 984 27.923 32.614 155.452 1.00 0.00 O ATOM 93614 H1 WAT 984 28.412 32.356 156.233 1.00 0.00 H ATOM 93615 H2 WAT 984 27.176 32.015 155.428 1.00 0.00 H TER 93617 WAT 984 ATOM 93617 O WAT 985 80.251 131.135 87.605 1.00 0.00 O ATOM 93618 H1 WAT 985 80.075 132.039 87.866 1.00 0.00 H ATOM 93619 H2 WAT 985 80.281 131.162 86.649 1.00 0.00 H TER 93621 WAT 985 ATOM 93621 O WAT 986 108.252 102.422 143.860 1.00 0.00 O ATOM 93622 H1 WAT 986 108.868 101.697 143.963 1.00 0.00 H ATOM 93623 H2 WAT 986 108.698 103.173 144.252 1.00 0.00 H TER 93625 WAT 986 ATOM 93625 O WAT 987 133.951 87.679 118.473 1.00 0.00 O ATOM 93626 H1 WAT 987 134.091 87.272 117.618 1.00 0.00 H ATOM 93627 H2 WAT 987 134.133 88.607 118.330 1.00 0.00 H TER 93629 WAT 987 ATOM 93629 O WAT 988 75.841 98.143 119.408 1.00 0.00 O ATOM 93630 H1 WAT 988 75.180 97.488 119.630 1.00 0.00 H ATOM 93631 H2 WAT 988 76.671 97.666 119.438 1.00 0.00 H TER 93633 WAT 988 ATOM 93633 O WAT 989 30.901 15.855 116.378 1.00 0.00 O ATOM 93634 H1 WAT 989 31.109 16.608 116.930 1.00 0.00 H ATOM 93635 H2 WAT 989 31.248 15.103 116.857 1.00 0.00 H TER 93637 WAT 989 ATOM 93637 O WAT 990 139.240 111.041 145.714 1.00 0.00 O ATOM 93638 H1 WAT 990 139.412 110.990 144.773 1.00 0.00 H ATOM 93639 H2 WAT 990 139.892 110.461 146.108 1.00 0.00 H TER 93641 WAT 990 ATOM 93641 O WAT 991 106.216 65.571 71.973 1.00 0.00 O ATOM 93642 H1 WAT 991 106.915 64.958 72.203 1.00 0.00 H ATOM 93643 H2 WAT 991 106.567 66.066 71.232 1.00 0.00 H TER 93645 WAT 991 ATOM 93645 O WAT 992 3.461 133.640 112.745 1.00 0.00 O ATOM 93646 H1 WAT 992 3.049 132.931 113.240 1.00 0.00 H ATOM 93647 H2 WAT 992 4.386 133.594 112.987 1.00 0.00 H TER 93649 WAT 992 ATOM 93649 O WAT 993 33.973 116.958 65.622 1.00 0.00 O ATOM 93650 H1 WAT 993 34.822 116.829 65.199 1.00 0.00 H ATOM 93651 H2 WAT 993 33.592 116.081 65.668 1.00 0.00 H TER 93653 WAT 993 ATOM 93653 O WAT 994 99.219 59.775 19.640 1.00 0.00 O ATOM 93654 H1 WAT 994 98.266 59.851 19.676 1.00 0.00 H ATOM 93655 H2 WAT 994 99.378 58.856 19.423 1.00 0.00 H TER 93657 WAT 994 ATOM 93657 O WAT 995 16.678 60.771 10.927 1.00 0.00 O ATOM 93658 H1 WAT 995 16.879 61.045 10.032 1.00 0.00 H ATOM 93659 H2 WAT 995 16.473 59.839 10.852 1.00 0.00 H TER 93661 WAT 995 ATOM 93661 O WAT 996 122.197 44.653 61.048 1.00 0.00 O ATOM 93662 H1 WAT 996 122.689 44.619 60.228 1.00 0.00 H ATOM 93663 H2 WAT 996 121.287 44.508 60.788 1.00 0.00 H TER 93665 WAT 996 ATOM 93665 O WAT 997 114.542 92.506 131.267 1.00 0.00 O ATOM 93666 H1 WAT 997 114.281 93.325 130.846 1.00 0.00 H ATOM 93667 H2 WAT 997 114.607 92.724 132.197 1.00 0.00 H TER 93669 WAT 997 ATOM 93669 O WAT 998 23.172 86.655 117.190 1.00 0.00 O ATOM 93670 H1 WAT 998 22.824 85.871 116.766 1.00 0.00 H ATOM 93671 H2 WAT 998 22.917 87.374 116.611 1.00 0.00 H TER 93673 WAT 998 ATOM 93673 O WAT 999 62.319 107.403 103.663 1.00 0.00 O ATOM 93674 H1 WAT 999 62.421 106.979 104.515 1.00 0.00 H ATOM 93675 H2 WAT 999 62.514 106.714 103.027 1.00 0.00 H TER 93677 WAT 999 ATOM 93677 O WAT 1000 81.313 102.225 110.427 1.00 0.00 O ATOM 93678 H1 WAT 1000 81.920 101.902 111.093 1.00 0.00 H ATOM 93679 H2 WAT 1000 81.871 102.679 109.795 1.00 0.00 H TER 93681 WAT 1000 ATOM 93681 O WAT 1001 3.275 25.389 97.619 1.00 0.00 O ATOM 93682 H1 WAT 1001 2.869 26.113 97.142 1.00 0.00 H ATOM 93683 H2 WAT 1001 2.567 25.028 98.154 1.00 0.00 H TER 93685 WAT 1001 ATOM 93685 O WAT 1002 106.950 91.116 24.185 1.00 0.00 O ATOM 93686 H1 WAT 1002 106.230 91.678 23.898 1.00 0.00 H ATOM 93687 H2 WAT 1002 106.666 90.230 23.963 1.00 0.00 H TER 93689 WAT 1002 ATOM 93689 O WAT 1003 144.240 115.210 63.223 1.00 0.00 O ATOM 93690 H1 WAT 1003 143.551 115.865 63.114 1.00 0.00 H ATOM 93691 H2 WAT 1003 143.934 114.455 62.721 1.00 0.00 H TER 93693 WAT 1003 ATOM 93693 O WAT 1004 28.242 47.086 148.484 1.00 0.00 O ATOM 93694 H1 WAT 1004 28.545 46.891 149.371 1.00 0.00 H ATOM 93695 H2 WAT 1004 29.014 46.957 147.933 1.00 0.00 H TER 93697 WAT 1004 ATOM 93697 O WAT 1005 72.822 143.488 84.049 1.00 0.00 O ATOM 93698 H1 WAT 1005 72.180 143.518 84.759 1.00 0.00 H ATOM 93699 H2 WAT 1005 72.487 142.820 83.451 1.00 0.00 H TER 93701 WAT 1005 ATOM 93701 O WAT 1006 77.383 140.606 70.402 1.00 0.00 O ATOM 93702 H1 WAT 1006 76.645 140.021 70.232 1.00 0.00 H ATOM 93703 H2 WAT 1006 78.154 140.041 70.352 1.00 0.00 H TER 93705 WAT 1006 ATOM 93705 O WAT 1007 118.773 67.089 72.155 1.00 0.00 O ATOM 93706 H1 WAT 1007 118.619 67.667 72.903 1.00 0.00 H ATOM 93707 H2 WAT 1007 119.267 66.354 72.518 1.00 0.00 H TER 93709 WAT 1007 ATOM 93709 O WAT 1008 126.932 41.449 109.015 1.00 0.00 O ATOM 93710 H1 WAT 1008 126.597 42.321 109.222 1.00 0.00 H ATOM 93711 H2 WAT 1008 127.427 41.570 108.204 1.00 0.00 H TER 93713 WAT 1008 ATOM 93713 O WAT 1009 116.413 55.635 110.697 1.00 0.00 O ATOM 93714 H1 WAT 1009 116.553 54.690 110.755 1.00 0.00 H ATOM 93715 H2 WAT 1009 116.555 55.953 111.589 1.00 0.00 H TER 93717 WAT 1009 ATOM 93717 O WAT 1010 73.090 33.489 119.258 1.00 0.00 O ATOM 93718 H1 WAT 1010 73.858 32.939 119.412 1.00 0.00 H ATOM 93719 H2 WAT 1010 72.453 33.199 119.910 1.00 0.00 H TER 93721 WAT 1010 ATOM 93721 O WAT 1011 76.278 101.820 63.287 1.00 0.00 O ATOM 93722 H1 WAT 1011 76.488 102.676 63.662 1.00 0.00 H ATOM 93723 H2 WAT 1011 76.583 101.874 62.382 1.00 0.00 H TER 93725 WAT 1011 ATOM 93725 O WAT 1012 57.952 69.353 144.236 1.00 0.00 O ATOM 93726 H1 WAT 1012 58.314 69.495 145.111 1.00 0.00 H ATOM 93727 H2 WAT 1012 57.528 68.496 144.289 1.00 0.00 H TER 93729 WAT 1012 ATOM 93729 O WAT 1013 69.056 41.549 109.751 1.00 0.00 O ATOM 93730 H1 WAT 1013 68.111 41.615 109.888 1.00 0.00 H ATOM 93731 H2 WAT 1013 69.152 41.399 108.811 1.00 0.00 H TER 93733 WAT 1013 ATOM 93733 O WAT 1014 144.931 104.105 85.202 1.00 0.00 O ATOM 93734 H1 WAT 1014 145.769 103.935 84.772 1.00 0.00 H ATOM 93735 H2 WAT 1014 145.060 104.937 85.658 1.00 0.00 H TER 93737 WAT 1014 ATOM 93737 O WAT 1015 118.414 60.505 109.323 1.00 0.00 O ATOM 93738 H1 WAT 1015 119.115 59.888 109.110 1.00 0.00 H ATOM 93739 H2 WAT 1015 118.083 60.208 110.171 1.00 0.00 H TER 93741 WAT 1015 ATOM 93741 O WAT 1016 9.112 103.857 88.466 1.00 0.00 O ATOM 93742 H1 WAT 1016 8.219 104.065 88.740 1.00 0.00 H ATOM 93743 H2 WAT 1016 9.041 103.681 87.528 1.00 0.00 H TER 93745 WAT 1016 ATOM 93745 O WAT 1017 49.697 144.583 102.254 1.00 0.00 O ATOM 93746 H1 WAT 1017 50.571 144.240 102.438 1.00 0.00 H ATOM 93747 H2 WAT 1017 49.267 144.617 103.108 1.00 0.00 H TER 93749 WAT 1017 ATOM 93749 O WAT 1018 25.994 129.861 72.744 1.00 0.00 O ATOM 93750 H1 WAT 1018 25.123 129.503 72.915 1.00 0.00 H ATOM 93751 H2 WAT 1018 25.883 130.809 72.816 1.00 0.00 H TER 93753 WAT 1018 ATOM 93753 O WAT 1019 67.326 63.438 153.298 1.00 0.00 O ATOM 93754 H1 WAT 1019 66.501 63.477 152.815 1.00 0.00 H ATOM 93755 H2 WAT 1019 67.998 63.377 152.619 1.00 0.00 H TER 93757 WAT 1019 ATOM 93757 O WAT 1020 117.676 88.498 150.512 1.00 0.00 O ATOM 93758 H1 WAT 1020 118.575 88.640 150.809 1.00 0.00 H ATOM 93759 H2 WAT 1020 117.334 89.378 150.352 1.00 0.00 H TER 93761 WAT 1020 ATOM 93761 O WAT 1021 51.953 135.281 88.758 1.00 0.00 O ATOM 93762 H1 WAT 1021 52.492 135.973 88.375 1.00 0.00 H ATOM 93763 H2 WAT 1021 51.179 135.736 89.090 1.00 0.00 H TER 93765 WAT 1021 ATOM 93765 O WAT 1022 123.071 130.496 97.032 1.00 0.00 O ATOM 93766 H1 WAT 1022 123.055 131.436 96.855 1.00 0.00 H ATOM 93767 H2 WAT 1022 122.189 130.297 97.346 1.00 0.00 H TER 93769 WAT 1022 ATOM 93769 O WAT 1023 75.541 69.979 118.287 1.00 0.00 O ATOM 93770 H1 WAT 1023 76.265 69.969 117.661 1.00 0.00 H ATOM 93771 H2 WAT 1023 75.808 70.614 118.951 1.00 0.00 H TER 93773 WAT 1023 ATOM 93773 O WAT 1024 0.819 13.422 148.812 1.00 0.00 O ATOM 93774 H1 WAT 1024 0.490 13.447 147.914 1.00 0.00 H ATOM 93775 H2 WAT 1024 0.797 12.496 149.050 1.00 0.00 H TER 93777 WAT 1024 ATOM 93777 O WAT 1025 22.290 122.058 129.763 1.00 0.00 O ATOM 93778 H1 WAT 1025 21.473 122.357 129.362 1.00 0.00 H ATOM 93779 H2 WAT 1025 22.837 121.795 129.023 1.00 0.00 H TER 93781 WAT 1025 ATOM 93781 O WAT 1026 98.115 25.883 157.138 1.00 0.00 O ATOM 93782 H1 WAT 1026 97.949 26.407 156.354 1.00 0.00 H ATOM 93783 H2 WAT 1026 99.015 26.098 157.384 1.00 0.00 H TER 93785 WAT 1026 ATOM 93785 O WAT 1027 64.609 105.737 73.755 1.00 0.00 O ATOM 93786 H1 WAT 1027 65.219 106.344 74.174 1.00 0.00 H ATOM 93787 H2 WAT 1027 64.963 105.610 72.875 1.00 0.00 H TER 93789 WAT 1027 ATOM 93789 O WAT 1028 131.582 19.372 126.937 1.00 0.00 O ATOM 93790 H1 WAT 1028 131.912 20.101 126.412 1.00 0.00 H ATOM 93791 H2 WAT 1028 131.499 19.730 127.820 1.00 0.00 H TER 93793 WAT 1028 ATOM 93793 O WAT 1029 102.159 114.156 5.763 1.00 0.00 O ATOM 93794 H1 WAT 1029 102.388 114.728 5.031 1.00 0.00 H ATOM 93795 H2 WAT 1029 101.243 114.363 5.951 1.00 0.00 H TER 93797 WAT 1029 ATOM 93797 O WAT 1030 19.065 70.872 94.603 1.00 0.00 O ATOM 93798 H1 WAT 1030 18.333 70.436 95.040 1.00 0.00 H ATOM 93799 H2 WAT 1030 19.205 71.671 95.111 1.00 0.00 H TER 93801 WAT 1030 ATOM 93801 O WAT 1031 69.310 89.403 110.256 1.00 0.00 O ATOM 93802 H1 WAT 1031 69.142 88.484 110.046 1.00 0.00 H ATOM 93803 H2 WAT 1031 69.658 89.774 109.444 1.00 0.00 H TER 93805 WAT 1031 ATOM 93805 O WAT 1032 128.997 52.680 60.601 1.00 0.00 O ATOM 93806 H1 WAT 1032 129.409 53.336 61.162 1.00 0.00 H ATOM 93807 H2 WAT 1032 129.623 52.545 59.890 1.00 0.00 H TER 93809 WAT 1032 ATOM 93809 O WAT 1033 68.810 48.242 98.046 1.00 0.00 O ATOM 93810 H1 WAT 1033 68.445 47.364 97.934 1.00 0.00 H ATOM 93811 H2 WAT 1033 69.753 48.127 97.925 1.00 0.00 H TER 93813 WAT 1033 ATOM 93813 O WAT 1034 111.154 1.154 149.843 1.00 0.00 O ATOM 93814 H1 WAT 1034 111.660 0.832 149.097 1.00 0.00 H ATOM 93815 H2 WAT 1034 111.671 1.883 150.186 1.00 0.00 H TER 93817 WAT 1034 ATOM 93817 O WAT 1035 50.490 101.826 142.654 1.00 0.00 O ATOM 93818 H1 WAT 1035 51.428 102.016 142.678 1.00 0.00 H ATOM 93819 H2 WAT 1035 50.210 101.889 143.567 1.00 0.00 H TER 93821 WAT 1035 ATOM 93821 O WAT 1036 55.836 19.658 59.779 1.00 0.00 O ATOM 93822 H1 WAT 1036 54.923 19.582 59.501 1.00 0.00 H ATOM 93823 H2 WAT 1036 56.343 19.380 59.016 1.00 0.00 H TER 93825 WAT 1036 ATOM 93825 O WAT 1037 52.022 24.581 3.606 1.00 0.00 O ATOM 93826 H1 WAT 1037 52.047 24.100 4.433 1.00 0.00 H ATOM 93827 H2 WAT 1037 52.933 24.600 3.313 1.00 0.00 H TER 93829 WAT 1037 ATOM 93829 O WAT 1038 52.252 120.568 122.927 1.00 0.00 O ATOM 93830 H1 WAT 1038 53.146 120.236 122.848 1.00 0.00 H ATOM 93831 H2 WAT 1038 51.981 120.319 123.811 1.00 0.00 H TER 93833 WAT 1038 ATOM 93833 O WAT 1039 71.704 126.981 73.795 1.00 0.00 O ATOM 93834 H1 WAT 1039 70.957 126.388 73.717 1.00 0.00 H ATOM 93835 H2 WAT 1039 72.003 127.110 72.895 1.00 0.00 H TER 93837 WAT 1039 ATOM 93837 O WAT 1040 119.304 110.831 87.692 1.00 0.00 O ATOM 93838 H1 WAT 1040 120.087 110.288 87.602 1.00 0.00 H ATOM 93839 H2 WAT 1040 118.783 110.633 86.914 1.00 0.00 H TER 93841 WAT 1040 ATOM 93841 O WAT 1041 133.893 13.525 88.130 1.00 0.00 O ATOM 93842 H1 WAT 1041 134.489 13.318 87.411 1.00 0.00 H ATOM 93843 H2 WAT 1041 134.336 14.221 88.616 1.00 0.00 H TER 93845 WAT 1041 ATOM 93845 O WAT 1042 124.393 21.028 7.679 1.00 0.00 O ATOM 93846 H1 WAT 1042 124.119 21.839 8.106 1.00 0.00 H ATOM 93847 H2 WAT 1042 123.584 20.527 7.574 1.00 0.00 H TER 93849 WAT 1042 ATOM 93849 O WAT 1043 2.900 118.236 80.244 1.00 0.00 O ATOM 93850 H1 WAT 1043 2.710 119.174 80.233 1.00 0.00 H ATOM 93851 H2 WAT 1043 3.355 118.074 79.418 1.00 0.00 H TER 93853 WAT 1043 ATOM 93853 O WAT 1044 11.262 55.902 109.474 1.00 0.00 O ATOM 93854 H1 WAT 1044 11.796 55.551 108.762 1.00 0.00 H ATOM 93855 H2 WAT 1044 11.026 55.136 109.998 1.00 0.00 H TER 93857 WAT 1044 ATOM 93857 O WAT 1045 123.390 56.109 22.305 1.00 0.00 O ATOM 93858 H1 WAT 1045 122.449 55.981 22.423 1.00 0.00 H ATOM 93859 H2 WAT 1045 123.668 56.584 23.088 1.00 0.00 H TER 93861 WAT 1045 ATOM 93861 O WAT 1046 84.952 34.348 83.393 1.00 0.00 O ATOM 93862 H1 WAT 1046 84.541 34.834 82.678 1.00 0.00 H ATOM 93863 H2 WAT 1046 85.177 35.018 84.039 1.00 0.00 H TER 93865 WAT 1046 ATOM 93865 O WAT 1047 10.542 65.484 10.321 1.00 0.00 O ATOM 93866 H1 WAT 1047 9.911 66.200 10.400 1.00 0.00 H ATOM 93867 H2 WAT 1047 10.010 64.719 10.100 1.00 0.00 H TER 93869 WAT 1047 ATOM 93869 O WAT 1048 135.514 24.453 99.678 1.00 0.00 O ATOM 93870 H1 WAT 1048 134.592 24.331 99.905 1.00 0.00 H ATOM 93871 H2 WAT 1048 135.511 24.592 98.731 1.00 0.00 H TER 93873 WAT 1048 ATOM 93873 O WAT 1049 135.046 54.480 147.358 1.00 0.00 O ATOM 93874 H1 WAT 1049 135.301 54.372 148.274 1.00 0.00 H ATOM 93875 H2 WAT 1049 135.784 54.940 146.957 1.00 0.00 H TER 93877 WAT 1049 ATOM 93877 O WAT 1050 6.830 83.046 134.664 1.00 0.00 O ATOM 93878 H1 WAT 1050 6.972 83.973 134.469 1.00 0.00 H ATOM 93879 H2 WAT 1050 7.049 82.594 133.849 1.00 0.00 H TER 93881 WAT 1050 ATOM 93881 O WAT 1051 23.014 105.137 137.189 1.00 0.00 O ATOM 93882 H1 WAT 1051 23.402 105.128 138.064 1.00 0.00 H ATOM 93883 H2 WAT 1051 22.771 104.226 137.024 1.00 0.00 H TER 93885 WAT 1051 ATOM 93885 O WAT 1052 118.536 3.119 106.336 1.00 0.00 O ATOM 93886 H1 WAT 1052 118.364 2.391 106.933 1.00 0.00 H ATOM 93887 H2 WAT 1052 119.050 3.739 106.854 1.00 0.00 H TER 93889 WAT 1052 ATOM 93889 O WAT 1053 79.513 114.072 122.673 1.00 0.00 O ATOM 93890 H1 WAT 1053 78.890 113.599 123.225 1.00 0.00 H ATOM 93891 H2 WAT 1053 80.265 114.232 123.243 1.00 0.00 H TER 93893 WAT 1053 ATOM 93893 O WAT 1054 136.853 75.732 155.121 1.00 0.00 O ATOM 93894 H1 WAT 1054 136.232 75.027 155.306 1.00 0.00 H ATOM 93895 H2 WAT 1054 136.753 76.338 155.855 1.00 0.00 H TER 93897 WAT 1054 ATOM 93897 O WAT 1055 47.641 68.116 24.540 1.00 0.00 O ATOM 93898 H1 WAT 1055 47.184 68.837 24.105 1.00 0.00 H ATOM 93899 H2 WAT 1055 47.847 68.454 25.411 1.00 0.00 H TER 93901 WAT 1055 ATOM 93901 O WAT 1056 73.088 67.412 76.308 1.00 0.00 O ATOM 93902 H1 WAT 1056 72.235 67.840 76.384 1.00 0.00 H ATOM 93903 H2 WAT 1056 73.646 68.063 75.885 1.00 0.00 H TER 93905 WAT 1056 ATOM 93905 O WAT 1057 39.865 74.493 87.855 1.00 0.00 O ATOM 93906 H1 WAT 1057 39.549 74.349 88.747 1.00 0.00 H ATOM 93907 H2 WAT 1057 39.596 75.388 87.647 1.00 0.00 H TER 93909 WAT 1057 ATOM 93909 O WAT 1058 16.472 100.117 95.674 1.00 0.00 O ATOM 93910 H1 WAT 1058 17.291 99.826 95.272 1.00 0.00 H ATOM 93911 H2 WAT 1058 16.719 100.372 96.563 1.00 0.00 H TER 93913 WAT 1058 ATOM 93913 O WAT 1059 142.302 29.702 131.526 1.00 0.00 O ATOM 93914 H1 WAT 1059 142.231 28.884 132.018 1.00 0.00 H ATOM 93915 H2 WAT 1059 143.243 29.865 131.466 1.00 0.00 H TER 93917 WAT 1059 ATOM 93917 O WAT 1060 52.663 84.728 80.242 1.00 0.00 O ATOM 93918 H1 WAT 1060 51.721 84.560 80.271 1.00 0.00 H ATOM 93919 H2 WAT 1060 52.940 84.698 81.158 1.00 0.00 H TER 93921 WAT 1060 ATOM 93921 O WAT 1061 1.598 114.264 137.203 1.00 0.00 O ATOM 93922 H1 WAT 1061 1.983 113.740 136.501 1.00 0.00 H ATOM 93923 H2 WAT 1061 1.012 114.873 136.754 1.00 0.00 H TER 93925 WAT 1061 ATOM 93925 O WAT 1062 43.932 124.001 154.542 1.00 0.00 O ATOM 93926 H1 WAT 1062 43.464 123.711 155.325 1.00 0.00 H ATOM 93927 H2 WAT 1062 43.597 123.440 153.842 1.00 0.00 H TER 93929 WAT 1062 ATOM 93929 O WAT 1063 3.952 82.660 84.721 1.00 0.00 O ATOM 93930 H1 WAT 1063 4.512 82.159 84.128 1.00 0.00 H ATOM 93931 H2 WAT 1063 3.561 83.336 84.167 1.00 0.00 H TER 93933 WAT 1063 ATOM 93933 O WAT 1064 70.654 12.210 90.726 1.00 0.00 O ATOM 93934 H1 WAT 1064 69.759 11.895 90.857 1.00 0.00 H ATOM 93935 H2 WAT 1064 70.566 12.927 90.098 1.00 0.00 H TER 93937 WAT 1064 ATOM 93937 O WAT 1065 74.781 104.072 89.555 1.00 0.00 O ATOM 93938 H1 WAT 1065 74.064 104.352 90.124 1.00 0.00 H ATOM 93939 H2 WAT 1065 75.408 104.795 89.587 1.00 0.00 H TER 93941 WAT 1065 ATOM 93941 O WAT 1066 107.719 61.258 146.532 1.00 0.00 O ATOM 93942 H1 WAT 1066 107.248 60.998 147.324 1.00 0.00 H ATOM 93943 H2 WAT 1066 108.628 61.356 146.815 1.00 0.00 H TER 93945 WAT 1066 ATOM 93945 O WAT 1067 50.509 17.443 99.452 1.00 0.00 O ATOM 93946 H1 WAT 1067 49.652 17.732 99.139 1.00 0.00 H ATOM 93947 H2 WAT 1067 50.571 17.796 100.340 1.00 0.00 H TER 93949 WAT 1067 ATOM 93949 O WAT 1068 82.112 86.770 72.733 1.00 0.00 O ATOM 93950 H1 WAT 1068 82.892 86.215 72.737 1.00 0.00 H ATOM 93951 H2 WAT 1068 81.480 86.290 72.199 1.00 0.00 H TER 93953 WAT 1068 ATOM 93953 O WAT 1069 9.987 108.200 18.928 1.00 0.00 O ATOM 93954 H1 WAT 1069 10.322 109.036 19.252 1.00 0.00 H ATOM 93955 H2 WAT 1069 10.732 107.802 18.477 1.00 0.00 H TER 93957 WAT 1069 ATOM 93957 O WAT 1070 49.582 94.931 118.184 1.00 0.00 O ATOM 93958 H1 WAT 1070 50.040 94.741 119.002 1.00 0.00 H ATOM 93959 H2 WAT 1070 50.088 95.639 117.785 1.00 0.00 H TER 93961 WAT 1070 ATOM 93961 O WAT 1071 36.237 55.088 107.798 1.00 0.00 O ATOM 93962 H1 WAT 1071 36.143 55.406 106.900 1.00 0.00 H ATOM 93963 H2 WAT 1071 36.473 54.165 107.702 1.00 0.00 H TER 93965 WAT 1071 ATOM 93965 O WAT 1072 85.683 52.586 140.088 1.00 0.00 O ATOM 93966 H1 WAT 1072 85.102 52.768 139.349 1.00 0.00 H ATOM 93967 H2 WAT 1072 86.541 52.898 139.800 1.00 0.00 H TER 93969 WAT 1072 ATOM 93969 O WAT 1073 49.292 16.444 17.895 1.00 0.00 O ATOM 93970 H1 WAT 1073 49.650 16.031 18.681 1.00 0.00 H ATOM 93971 H2 WAT 1073 48.593 15.855 17.612 1.00 0.00 H TER 93973 WAT 1073 ATOM 93973 O WAT 1074 28.704 16.212 117.897 1.00 0.00 O ATOM 93974 H1 WAT 1074 28.898 15.717 118.693 1.00 0.00 H ATOM 93975 H2 WAT 1074 29.428 16.009 117.305 1.00 0.00 H TER 93977 WAT 1074 ATOM 93977 O WAT 1075 33.336 103.840 141.321 1.00 0.00 O ATOM 93978 H1 WAT 1075 34.020 104.250 140.791 1.00 0.00 H ATOM 93979 H2 WAT 1075 32.526 104.011 140.841 1.00 0.00 H TER 93981 WAT 1075 ATOM 93981 O WAT 1076 43.953 117.389 133.833 1.00 0.00 O ATOM 93982 H1 WAT 1076 43.644 116.563 134.206 1.00 0.00 H ATOM 93983 H2 WAT 1076 43.186 117.752 133.389 1.00 0.00 H TER 93985 WAT 1076 ATOM 93985 O WAT 1077 80.281 136.320 107.220 1.00 0.00 O ATOM 93986 H1 WAT 1077 79.374 136.595 107.358 1.00 0.00 H ATOM 93987 H2 WAT 1077 80.676 137.038 106.726 1.00 0.00 H TER 93989 WAT 1077 ATOM 93989 O WAT 1078 124.729 48.004 86.532 1.00 0.00 O ATOM 93990 H1 WAT 1078 125.042 47.304 85.959 1.00 0.00 H ATOM 93991 H2 WAT 1078 123.898 48.278 86.143 1.00 0.00 H TER 93993 WAT 1078 ATOM 93993 O WAT 1079 73.678 21.177 106.452 1.00 0.00 O ATOM 93994 H1 WAT 1079 74.608 21.157 106.226 1.00 0.00 H ATOM 93995 H2 WAT 1079 73.232 20.876 105.660 1.00 0.00 H TER 93997 WAT 1079 ATOM 93997 O WAT 1080 12.510 70.577 62.146 1.00 0.00 O ATOM 93998 H1 WAT 1080 12.285 69.872 62.752 1.00 0.00 H ATOM 93999 H2 WAT 1080 12.154 71.367 62.554 1.00 0.00 H TER 94001 WAT 1080 ATOM 94001 O WAT 1081 29.789 130.042 122.225 1.00 0.00 O ATOM 94002 H1 WAT 1081 29.224 129.354 122.576 1.00 0.00 H ATOM 94003 H2 WAT 1081 30.655 129.846 122.584 1.00 0.00 H TER 94005 WAT 1081 ATOM 94005 O WAT 1082 18.981 136.367 134.131 1.00 0.00 O ATOM 94006 H1 WAT 1082 19.186 135.647 133.535 1.00 0.00 H ATOM 94007 H2 WAT 1082 19.834 136.732 134.367 1.00 0.00 H TER 94009 WAT 1082 ATOM 94009 O WAT 1083 56.554 30.036 134.378 1.00 0.00 O ATOM 94010 H1 WAT 1083 56.471 29.101 134.566 1.00 0.00 H ATOM 94011 H2 WAT 1083 55.718 30.411 134.653 1.00 0.00 H TER 94013 WAT 1083 ATOM 94013 O WAT 1084 81.667 38.821 68.447 1.00 0.00 O ATOM 94014 H1 WAT 1084 82.449 38.467 68.871 1.00 0.00 H ATOM 94015 H2 WAT 1084 81.767 38.585 67.525 1.00 0.00 H TER 94017 WAT 1084 ATOM 94017 O WAT 1085 80.612 16.966 19.302 1.00 0.00 O ATOM 94018 H1 WAT 1085 80.416 16.082 19.612 1.00 0.00 H ATOM 94019 H2 WAT 1085 80.934 17.426 20.077 1.00 0.00 H TER 94021 WAT 1085 ATOM 94021 O WAT 1086 11.480 121.807 79.627 1.00 0.00 O ATOM 94022 H1 WAT 1086 11.476 122.764 79.656 1.00 0.00 H ATOM 94023 H2 WAT 1086 12.275 121.585 79.143 1.00 0.00 H TER 94025 WAT 1086 ATOM 94025 O WAT 1087 119.061 13.059 146.579 1.00 0.00 O ATOM 94026 H1 WAT 1087 119.296 12.747 145.705 1.00 0.00 H ATOM 94027 H2 WAT 1087 118.411 12.429 146.891 1.00 0.00 H TER 94029 WAT 1087 ATOM 94029 O WAT 1088 130.721 142.443 125.354 1.00 0.00 O ATOM 94030 H1 WAT 1088 130.711 143.304 125.774 1.00 0.00 H ATOM 94031 H2 WAT 1088 131.079 142.606 124.482 1.00 0.00 H TER 94033 WAT 1088 ATOM 94033 O WAT 1089 47.728 31.509 93.103 1.00 0.00 O ATOM 94034 H1 WAT 1089 48.520 32.044 93.162 1.00 0.00 H ATOM 94035 H2 WAT 1089 47.009 32.140 93.140 1.00 0.00 H TER 94037 WAT 1089 ATOM 94037 O WAT 1090 80.170 48.045 19.089 1.00 0.00 O ATOM 94038 H1 WAT 1090 80.293 48.680 18.383 1.00 0.00 H ATOM 94039 H2 WAT 1090 79.588 48.484 19.708 1.00 0.00 H TER 94041 WAT 1090 ATOM 94041 O WAT 1091 2.095 139.545 151.804 1.00 0.00 O ATOM 94042 H1 WAT 1091 1.882 140.227 152.441 1.00 0.00 H ATOM 94043 H2 WAT 1091 2.457 138.831 152.329 1.00 0.00 H TER 94045 WAT 1091 ATOM 94045 O WAT 1092 91.511 31.094 154.983 1.00 0.00 O ATOM 94046 H1 WAT 1092 92.084 30.994 155.743 1.00 0.00 H ATOM 94047 H2 WAT 1092 90.693 31.438 155.343 1.00 0.00 H TER 94049 WAT 1092 ATOM 94049 O WAT 1093 55.414 106.355 158.124 1.00 0.00 O ATOM 94050 H1 WAT 1093 55.252 107.278 157.930 1.00 0.00 H ATOM 94051 H2 WAT 1093 55.016 106.218 158.984 1.00 0.00 H TER 94053 WAT 1093 ATOM 94053 O WAT 1094 41.120 116.791 128.267 1.00 0.00 O ATOM 94054 H1 WAT 1094 40.469 116.093 128.344 1.00 0.00 H ATOM 94055 H2 WAT 1094 40.638 117.592 128.469 1.00 0.00 H TER 94057 WAT 1094 ATOM 94057 O WAT 1095 139.856 85.214 19.235 1.00 0.00 O ATOM 94058 H1 WAT 1095 139.773 84.261 19.262 1.00 0.00 H ATOM 94059 H2 WAT 1095 140.286 85.440 20.061 1.00 0.00 H TER 94061 WAT 1095 ATOM 94061 O WAT 1096 94.913 110.283 98.482 1.00 0.00 O ATOM 94062 H1 WAT 1096 94.542 109.412 98.626 1.00 0.00 H ATOM 94063 H2 WAT 1096 94.785 110.738 99.314 1.00 0.00 H TER 94065 WAT 1096 ATOM 94065 O WAT 1097 84.933 65.812 131.477 1.00 0.00 O ATOM 94066 H1 WAT 1097 85.195 65.495 132.342 1.00 0.00 H ATOM 94067 H2 WAT 1097 83.987 65.937 131.544 1.00 0.00 H TER 94069 WAT 1097 ATOM 94069 O WAT 1098 79.863 120.291 85.842 1.00 0.00 O ATOM 94070 H1 WAT 1098 79.692 119.353 85.760 1.00 0.00 H ATOM 94071 H2 WAT 1098 79.363 120.560 86.612 1.00 0.00 H TER 94073 WAT 1098 ATOM 94073 O WAT 1099 48.953 136.674 111.610 1.00 0.00 O ATOM 94074 H1 WAT 1099 49.341 136.103 110.948 1.00 0.00 H ATOM 94075 H2 WAT 1099 49.695 137.155 111.977 1.00 0.00 H TER 94077 WAT 1099 ATOM 94077 O WAT 1100 18.571 29.671 110.242 1.00 0.00 O ATOM 94078 H1 WAT 1100 18.892 28.871 110.659 1.00 0.00 H ATOM 94079 H2 WAT 1100 18.596 29.478 109.305 1.00 0.00 H TER 94081 WAT 1100 ATOM 94081 O WAT 1101 94.931 108.899 117.845 1.00 0.00 O ATOM 94082 H1 WAT 1101 95.174 109.788 118.102 1.00 0.00 H ATOM 94083 H2 WAT 1101 94.380 108.585 118.563 1.00 0.00 H TER 94085 WAT 1101 ATOM 94085 O WAT 1102 67.156 99.223 8.389 1.00 0.00 O ATOM 94086 H1 WAT 1102 67.522 99.848 9.016 1.00 0.00 H ATOM 94087 H2 WAT 1102 66.488 98.750 8.884 1.00 0.00 H TER 94089 WAT 1102 ATOM 94089 O WAT 1103 43.048 11.938 84.783 1.00 0.00 O ATOM 94090 H1 WAT 1103 43.477 12.588 85.338 1.00 0.00 H ATOM 94091 H2 WAT 1103 42.366 11.561 85.339 1.00 0.00 H TER 94093 WAT 1103 ATOM 94093 O WAT 1104 130.720 125.446 74.588 1.00 0.00 O ATOM 94094 H1 WAT 1104 131.380 125.686 73.938 1.00 0.00 H ATOM 94095 H2 WAT 1104 131.093 125.730 75.423 1.00 0.00 H TER 94097 WAT 1104 ATOM 94097 O WAT 1105 37.953 120.647 89.378 1.00 0.00 O ATOM 94098 H1 WAT 1105 37.912 121.307 88.685 1.00 0.00 H ATOM 94099 H2 WAT 1105 37.362 119.954 89.084 1.00 0.00 H TER 94101 WAT 1105 ATOM 94101 O WAT 1106 97.097 73.968 5.027 1.00 0.00 O ATOM 94102 H1 WAT 1106 96.198 73.798 5.309 1.00 0.00 H ATOM 94103 H2 WAT 1106 97.027 74.731 4.453 1.00 0.00 H TER 94105 WAT 1106 ATOM 94105 O WAT 1107 102.362 7.478 136.524 1.00 0.00 O ATOM 94106 H1 WAT 1107 102.719 7.663 137.393 1.00 0.00 H ATOM 94107 H2 WAT 1107 103.106 7.136 136.028 1.00 0.00 H TER 94109 WAT 1107 ATOM 94109 O WAT 1108 111.135 121.019 22.429 1.00 0.00 O ATOM 94110 H1 WAT 1108 111.263 120.986 23.377 1.00 0.00 H ATOM 94111 H2 WAT 1108 110.192 121.141 22.318 1.00 0.00 H TER 94113 WAT 1108 ATOM 94113 O WAT 1109 38.265 94.372 105.217 1.00 0.00 O ATOM 94114 H1 WAT 1109 38.714 93.821 105.859 1.00 0.00 H ATOM 94115 H2 WAT 1109 38.774 95.182 105.199 1.00 0.00 H TER 94117 WAT 1109 ATOM 94117 O WAT 1110 93.139 143.375 85.991 1.00 0.00 O ATOM 94118 H1 WAT 1110 93.917 143.932 85.984 1.00 0.00 H ATOM 94119 H2 WAT 1110 92.631 143.682 86.742 1.00 0.00 H TER 94121 WAT 1110 ATOM 94121 O WAT 1111 125.311 3.975 90.338 1.00 0.00 O ATOM 94122 H1 WAT 1111 124.883 3.437 91.004 1.00 0.00 H ATOM 94123 H2 WAT 1111 126.231 3.994 90.599 1.00 0.00 H TER 94125 WAT 1111 ATOM 94125 O WAT 1112 109.606 23.594 5.802 1.00 0.00 O ATOM 94126 H1 WAT 1112 109.655 24.542 5.926 1.00 0.00 H ATOM 94127 H2 WAT 1112 109.457 23.245 6.681 1.00 0.00 H TER 94129 WAT 1112 ATOM 94129 O WAT 1113 47.091 139.142 61.455 1.00 0.00 O ATOM 94130 H1 WAT 1113 46.478 138.684 60.880 1.00 0.00 H ATOM 94131 H2 WAT 1113 47.492 138.449 61.980 1.00 0.00 H TER 94133 WAT 1113 ATOM 94133 O WAT 1114 75.533 74.459 104.688 1.00 0.00 O ATOM 94134 H1 WAT 1114 74.732 73.942 104.609 1.00 0.00 H ATOM 94135 H2 WAT 1114 76.235 73.851 104.456 1.00 0.00 H TER 94137 WAT 1114 ATOM 94137 O WAT 1115 96.119 123.320 56.930 1.00 0.00 O ATOM 94138 H1 WAT 1115 96.617 122.504 56.909 1.00 0.00 H ATOM 94139 H2 WAT 1115 95.669 123.305 57.775 1.00 0.00 H TER 94141 WAT 1115 ATOM 94141 O WAT 1116 70.892 90.700 135.780 1.00 0.00 O ATOM 94142 H1 WAT 1116 71.347 91.486 135.477 1.00 0.00 H ATOM 94143 H2 WAT 1116 71.437 90.368 136.493 1.00 0.00 H TER 94145 WAT 1116 ATOM 94145 O WAT 1117 106.536 17.556 89.430 1.00 0.00 O ATOM 94146 H1 WAT 1117 106.761 17.408 88.511 1.00 0.00 H ATOM 94147 H2 WAT 1117 107.056 18.317 89.685 1.00 0.00 H TER 94149 WAT 1117 ATOM 94149 O WAT 1118 90.842 102.466 150.731 1.00 0.00 O ATOM 94150 H1 WAT 1118 90.309 102.635 149.954 1.00 0.00 H ATOM 94151 H2 WAT 1118 90.967 101.517 150.734 1.00 0.00 H TER 94153 WAT 1118 ATOM 94153 O WAT 1119 129.176 70.733 142.832 1.00 0.00 O ATOM 94154 H1 WAT 1119 129.398 71.604 143.163 1.00 0.00 H ATOM 94155 H2 WAT 1119 128.565 70.898 142.115 1.00 0.00 H TER 94157 WAT 1119 ATOM 94157 O WAT 1120 6.974 8.680 138.005 1.00 0.00 O ATOM 94158 H1 WAT 1120 7.444 8.051 138.552 1.00 0.00 H ATOM 94159 H2 WAT 1120 7.163 8.404 137.108 1.00 0.00 H TER 94161 WAT 1120 ATOM 94161 O WAT 1121 27.117 42.224 136.941 1.00 0.00 O ATOM 94162 H1 WAT 1121 26.572 41.598 137.418 1.00 0.00 H ATOM 94163 H2 WAT 1121 27.777 42.501 137.578 1.00 0.00 H TER 94165 WAT 1121 ATOM 94165 O WAT 1122 20.857 46.635 18.567 1.00 0.00 O ATOM 94166 H1 WAT 1122 20.721 47.395 19.132 1.00 0.00 H ATOM 94167 H2 WAT 1122 21.316 46.003 19.121 1.00 0.00 H TER 94169 WAT 1122 ATOM 94169 O WAT 1123 125.959 127.523 142.292 1.00 0.00 O ATOM 94170 H1 WAT 1123 125.888 127.897 141.414 1.00 0.00 H ATOM 94171 H2 WAT 1123 125.285 126.843 142.318 1.00 0.00 H TER 94173 WAT 1123 ATOM 94173 O WAT 1124 1.790 120.961 67.684 1.00 0.00 O ATOM 94174 H1 WAT 1124 1.888 120.801 66.746 1.00 0.00 H ATOM 94175 H2 WAT 1124 2.672 120.852 68.040 1.00 0.00 H TER 94177 WAT 1124 ATOM 94177 O WAT 1125 28.271 31.209 2.111 1.00 0.00 O ATOM 94178 H1 WAT 1125 29.222 31.318 2.140 1.00 0.00 H ATOM 94179 H2 WAT 1125 27.943 32.051 1.796 1.00 0.00 H TER 94181 WAT 1125 ATOM 94181 O WAT 1126 99.115 60.974 85.463 1.00 0.00 O ATOM 94182 H1 WAT 1126 100.058 60.921 85.306 1.00 0.00 H ATOM 94183 H2 WAT 1126 98.766 60.161 85.098 1.00 0.00 H TER 94185 WAT 1126 ATOM 94185 O WAT 1127 51.006 101.560 103.986 1.00 0.00 O ATOM 94186 H1 WAT 1127 51.056 101.037 104.786 1.00 0.00 H ATOM 94187 H2 WAT 1127 50.556 102.362 104.252 1.00 0.00 H TER 94189 WAT 1127 ATOM 94189 O WAT 1128 80.767 36.036 147.366 1.00 0.00 O ATOM 94190 H1 WAT 1128 81.233 36.531 146.692 1.00 0.00 H ATOM 94191 H2 WAT 1128 80.220 36.686 147.807 1.00 0.00 H TER 94193 WAT 1128 ATOM 94193 O WAT 1129 49.010 124.405 134.694 1.00 0.00 O ATOM 94194 H1 WAT 1129 49.700 124.861 135.176 1.00 0.00 H ATOM 94195 H2 WAT 1129 48.214 124.899 134.892 1.00 0.00 H TER 94197 WAT 1129 ATOM 94197 O WAT 1130 90.548 28.978 72.659 1.00 0.00 O ATOM 94198 H1 WAT 1130 91.099 28.297 73.046 1.00 0.00 H ATOM 94199 H2 WAT 1130 90.880 29.795 73.031 1.00 0.00 H TER 94201 WAT 1130 ATOM 94201 O WAT 1131 140.629 34.124 120.849 1.00 0.00 O ATOM 94202 H1 WAT 1131 141.491 34.514 120.709 1.00 0.00 H ATOM 94203 H2 WAT 1131 140.099 34.445 120.119 1.00 0.00 H TER 94205 WAT 1131 ATOM 94205 O WAT 1132 1.585 104.399 83.724 1.00 0.00 O ATOM 94206 H1 WAT 1132 2.365 103.976 84.082 1.00 0.00 H ATOM 94207 H2 WAT 1132 1.743 105.335 83.844 1.00 0.00 H TER 94209 WAT 1132 ATOM 94209 O WAT 1133 9.197 80.351 84.019 1.00 0.00 O ATOM 94210 H1 WAT 1133 9.912 79.848 83.628 1.00 0.00 H ATOM 94211 H2 WAT 1133 9.269 81.219 83.622 1.00 0.00 H TER 94213 WAT 1133 ATOM 94213 O WAT 1134 117.634 76.829 132.913 1.00 0.00 O ATOM 94214 H1 WAT 1134 117.839 76.739 133.844 1.00 0.00 H ATOM 94215 H2 WAT 1134 117.308 75.966 132.655 1.00 0.00 H TER 94217 WAT 1134 ATOM 94217 O WAT 1135 30.758 109.802 121.290 1.00 0.00 O ATOM 94218 H1 WAT 1135 30.932 110.294 120.487 1.00 0.00 H ATOM 94219 H2 WAT 1135 30.001 110.239 121.679 1.00 0.00 H TER 94221 WAT 1135 ATOM 94221 O WAT 1136 28.378 81.859 93.609 1.00 0.00 O ATOM 94222 H1 WAT 1136 28.310 82.699 93.157 1.00 0.00 H ATOM 94223 H2 WAT 1136 28.104 81.213 92.958 1.00 0.00 H TER 94225 WAT 1136 ATOM 94225 O WAT 1137 47.652 78.131 152.391 1.00 0.00 O ATOM 94226 H1 WAT 1137 47.058 77.591 152.912 1.00 0.00 H ATOM 94227 H2 WAT 1137 48.415 77.572 152.241 1.00 0.00 H TER 94229 WAT 1137 ATOM 94229 O WAT 1138 113.071 113.183 84.768 1.00 0.00 O ATOM 94230 H1 WAT 1138 113.836 113.719 84.975 1.00 0.00 H ATOM 94231 H2 WAT 1138 113.114 113.061 83.819 1.00 0.00 H TER 94233 WAT 1138 ATOM 94233 O WAT 1139 28.152 70.362 91.810 1.00 0.00 O ATOM 94234 H1 WAT 1139 28.638 70.696 92.564 1.00 0.00 H ATOM 94235 H2 WAT 1139 28.801 69.871 91.306 1.00 0.00 H TER 94237 WAT 1139 ATOM 94237 O WAT 1140 21.232 52.084 90.122 1.00 0.00 O ATOM 94238 H1 WAT 1140 20.819 52.879 90.457 1.00 0.00 H ATOM 94239 H2 WAT 1140 22.156 52.315 90.027 1.00 0.00 H TER 94241 WAT 1140 ATOM 94241 O WAT 1141 1.074 5.109 11.938 1.00 0.00 O ATOM 94242 H1 WAT 1141 0.384 4.449 12.008 1.00 0.00 H ATOM 94243 H2 WAT 1141 1.877 4.640 12.165 1.00 0.00 H TER 94245 WAT 1141 ATOM 94245 O WAT 1142 67.028 20.543 74.767 1.00 0.00 O ATOM 94246 H1 WAT 1142 66.178 20.161 74.548 1.00 0.00 H ATOM 94247 H2 WAT 1142 67.622 20.206 74.096 1.00 0.00 H TER 94249 WAT 1142 ATOM 94249 O WAT 1143 122.125 88.000 125.321 1.00 0.00 O ATOM 94250 H1 WAT 1143 121.335 88.434 124.998 1.00 0.00 H ATOM 94251 H2 WAT 1143 122.844 88.554 125.017 1.00 0.00 H TER 94253 WAT 1143 ATOM 94253 O WAT 1144 82.091 135.789 92.277 1.00 0.00 O ATOM 94254 H1 WAT 1144 81.530 136.516 92.545 1.00 0.00 H ATOM 94255 H2 WAT 1144 82.888 135.897 92.796 1.00 0.00 H TER 94257 WAT 1144 ATOM 94257 O WAT 1145 112.606 94.692 120.134 1.00 0.00 O ATOM 94258 H1 WAT 1145 113.339 95.302 120.047 1.00 0.00 H ATOM 94259 H2 WAT 1145 112.839 93.955 119.570 1.00 0.00 H TER 94261 WAT 1145 ATOM 94261 O WAT 1146 50.308 84.330 13.987 1.00 0.00 O ATOM 94262 H1 WAT 1146 50.549 84.038 14.866 1.00 0.00 H ATOM 94263 H2 WAT 1146 51.110 84.233 13.474 1.00 0.00 H TER 94265 WAT 1146 ATOM 94265 O WAT 1147 95.164 101.730 106.475 1.00 0.00 O ATOM 94266 H1 WAT 1147 94.588 101.588 107.226 1.00 0.00 H ATOM 94267 H2 WAT 1147 95.907 101.147 106.629 1.00 0.00 H TER 94269 WAT 1147 ATOM 94269 O WAT 1148 144.346 94.599 59.484 1.00 0.00 O ATOM 94270 H1 WAT 1148 143.393 94.556 59.411 1.00 0.00 H ATOM 94271 H2 WAT 1148 144.566 93.945 60.147 1.00 0.00 H TER 94273 WAT 1148 ATOM 94273 O WAT 1149 105.210 78.119 153.424 1.00 0.00 O ATOM 94274 H1 WAT 1149 105.486 77.422 152.830 1.00 0.00 H ATOM 94275 H2 WAT 1149 104.488 77.737 153.923 1.00 0.00 H TER 94277 WAT 1149 ATOM 94277 O WAT 1150 102.616 45.517 75.717 1.00 0.00 O ATOM 94278 H1 WAT 1150 103.422 45.473 76.232 1.00 0.00 H ATOM 94279 H2 WAT 1150 102.904 45.411 74.811 1.00 0.00 H TER 94281 WAT 1150 ATOM 94281 O WAT 1151 93.649 94.059 109.746 1.00 0.00 O ATOM 94282 H1 WAT 1151 92.818 93.585 109.763 1.00 0.00 H ATOM 94283 H2 WAT 1151 94.314 93.381 109.870 1.00 0.00 H TER 94285 WAT 1151 ATOM 94285 O WAT 1152 101.874 96.559 87.825 1.00 0.00 O ATOM 94286 H1 WAT 1152 102.610 96.304 87.268 1.00 0.00 H ATOM 94287 H2 WAT 1152 101.238 95.852 87.719 1.00 0.00 H TER 94289 WAT 1152 ATOM 94289 O WAT 1153 50.954 124.528 60.878 1.00 0.00 O ATOM 94290 H1 WAT 1153 50.571 124.466 60.003 1.00 0.00 H ATOM 94291 H2 WAT 1153 51.718 123.952 60.846 1.00 0.00 H TER 94293 WAT 1153 ATOM 94293 O WAT 1154 91.528 3.303 83.891 1.00 0.00 O ATOM 94294 H1 WAT 1154 92.363 3.250 83.427 1.00 0.00 H ATOM 94295 H2 WAT 1154 91.025 3.956 83.404 1.00 0.00 H TER 94297 WAT 1154 ATOM 94297 O WAT 1155 12.811 126.824 58.407 1.00 0.00 O ATOM 94298 H1 WAT 1155 13.371 127.287 59.030 1.00 0.00 H ATOM 94299 H2 WAT 1155 12.812 127.378 57.626 1.00 0.00 H TER 94301 WAT 1155 ATOM 94301 O WAT 1156 92.808 15.500 83.442 1.00 0.00 O ATOM 94302 H1 WAT 1156 92.221 15.926 84.066 1.00 0.00 H ATOM 94303 H2 WAT 1156 92.243 15.261 82.707 1.00 0.00 H TER 94305 WAT 1156 ATOM 94305 O WAT 1157 13.942 95.740 4.156 1.00 0.00 O ATOM 94306 H1 WAT 1157 14.633 95.119 4.386 1.00 0.00 H ATOM 94307 H2 WAT 1157 14.387 96.416 3.645 1.00 0.00 H TER 94309 WAT 1157 ATOM 94309 O WAT 1158 42.762 72.099 153.356 1.00 0.00 O ATOM 94310 H1 WAT 1158 43.507 71.606 153.699 1.00 0.00 H ATOM 94311 H2 WAT 1158 42.670 72.842 153.952 1.00 0.00 H TER 94313 WAT 1158 ATOM 94313 O WAT 1159 81.206 121.731 157.276 1.00 0.00 O ATOM 94314 H1 WAT 1159 81.223 122.687 157.239 1.00 0.00 H ATOM 94315 H2 WAT 1159 82.103 121.467 157.068 1.00 0.00 H TER 94317 WAT 1159 ATOM 94317 O WAT 1160 49.975 125.462 3.501 1.00 0.00 O ATOM 94318 H1 WAT 1160 50.897 125.720 3.506 1.00 0.00 H ATOM 94319 H2 WAT 1160 49.649 125.721 4.363 1.00 0.00 H TER 94321 WAT 1160 ATOM 94321 O WAT 1161 23.179 111.086 71.338 1.00 0.00 O ATOM 94322 H1 WAT 1161 23.384 110.159 71.214 1.00 0.00 H ATOM 94323 H2 WAT 1161 23.349 111.247 72.266 1.00 0.00 H TER 94325 WAT 1161 ATOM 94325 O WAT 1162 141.892 72.475 69.841 1.00 0.00 O ATOM 94326 H1 WAT 1162 140.955 72.656 69.774 1.00 0.00 H ATOM 94327 H2 WAT 1162 142.300 73.098 69.239 1.00 0.00 H TER 94329 WAT 1162 ATOM 94329 O WAT 1163 86.528 107.274 85.580 1.00 0.00 O ATOM 94330 H1 WAT 1163 87.253 107.835 85.302 1.00 0.00 H ATOM 94331 H2 WAT 1163 86.949 106.557 86.055 1.00 0.00 H TER 94333 WAT 1163 ATOM 94333 O WAT 1164 56.288 9.527 87.830 1.00 0.00 O ATOM 94334 H1 WAT 1164 55.971 10.094 87.127 1.00 0.00 H ATOM 94335 H2 WAT 1164 56.461 10.124 88.559 1.00 0.00 H TER 94337 WAT 1164 ATOM 94337 O WAT 1165 82.754 21.758 9.580 1.00 0.00 O ATOM 94338 H1 WAT 1165 82.469 22.581 9.183 1.00 0.00 H ATOM 94339 H2 WAT 1165 81.951 21.243 9.665 1.00 0.00 H TER 94341 WAT 1165 ATOM 94341 O WAT 1166 11.539 30.214 154.452 1.00 0.00 O ATOM 94342 H1 WAT 1166 12.015 30.787 155.054 1.00 0.00 H ATOM 94343 H2 WAT 1166 10.637 30.227 154.773 1.00 0.00 H TER 94345 WAT 1166 ATOM 94345 O WAT 1167 14.268 82.671 9.418 1.00 0.00 O ATOM 94346 H1 WAT 1167 14.213 82.398 10.334 1.00 0.00 H ATOM 94347 H2 WAT 1167 14.854 83.428 9.428 1.00 0.00 H TER 94349 WAT 1167 ATOM 94349 O WAT 1168 34.018 1.070 92.799 1.00 0.00 O ATOM 94350 H1 WAT 1168 34.458 0.306 92.428 1.00 0.00 H ATOM 94351 H2 WAT 1168 33.291 0.706 93.303 1.00 0.00 H TER 94353 WAT 1168 ATOM 94353 O WAT 1169 89.976 133.662 145.460 1.00 0.00 O ATOM 94354 H1 WAT 1169 90.284 133.868 146.343 1.00 0.00 H ATOM 94355 H2 WAT 1169 90.290 134.388 144.921 1.00 0.00 H TER 94357 WAT 1169 ATOM 94357 O WAT 1170 106.959 49.554 145.514 1.00 0.00 O ATOM 94358 H1 WAT 1170 107.592 48.866 145.306 1.00 0.00 H ATOM 94359 H2 WAT 1170 107.315 49.979 146.294 1.00 0.00 H TER 94361 WAT 1170 ATOM 94361 O WAT 1171 19.237 39.973 142.760 1.00 0.00 O ATOM 94362 H1 WAT 1171 20.051 39.714 142.329 1.00 0.00 H ATOM 94363 H2 WAT 1171 18.890 39.160 143.127 1.00 0.00 H TER 94365 WAT 1171 ATOM 94365 O WAT 1172 39.906 13.280 23.072 1.00 0.00 O ATOM 94366 H1 WAT 1172 40.195 14.078 22.631 1.00 0.00 H ATOM 94367 H2 WAT 1172 40.608 13.081 23.692 1.00 0.00 H TER 94369 WAT 1172 ATOM 94369 O WAT 1173 141.776 36.204 20.785 1.00 0.00 O ATOM 94370 H1 WAT 1173 141.164 36.787 21.233 1.00 0.00 H ATOM 94371 H2 WAT 1173 141.217 35.619 20.273 1.00 0.00 H TER 94373 WAT 1173 ATOM 94373 O WAT 1174 143.285 115.727 1.203 1.00 0.00 O ATOM 94374 H1 WAT 1174 143.375 115.456 2.116 1.00 0.00 H ATOM 94375 H2 WAT 1174 143.974 116.380 1.078 1.00 0.00 H TER 94377 WAT 1174 ATOM 94377 O WAT 1175 0.436 68.944 64.664 1.00 0.00 O ATOM 94378 H1 WAT 1175 0.619 68.006 64.707 1.00 0.00 H ATOM 94379 H2 WAT 1175 0.924 69.249 63.899 1.00 0.00 H TER 94381 WAT 1175 ATOM 94381 O WAT 1176 93.853 75.016 137.817 1.00 0.00 O ATOM 94382 H1 WAT 1176 93.207 74.833 137.134 1.00 0.00 H ATOM 94383 H2 WAT 1176 93.757 74.292 138.437 1.00 0.00 H TER 94385 WAT 1176 ATOM 94385 O WAT 1177 64.284 42.436 121.000 1.00 0.00 O ATOM 94386 H1 WAT 1177 64.223 43.391 120.996 1.00 0.00 H ATOM 94387 H2 WAT 1177 64.735 42.228 121.819 1.00 0.00 H TER 94389 WAT 1177 ATOM 94389 O WAT 1178 43.211 144.554 0.855 1.00 0.00 O ATOM 94390 H1 WAT 1178 42.894 143.730 0.483 1.00 0.00 H ATOM 94391 H2 WAT 1178 43.327 145.129 0.098 1.00 0.00 H TER 94393 WAT 1178 ATOM 94393 O WAT 1179 88.659 55.806 66.346 1.00 0.00 O ATOM 94394 H1 WAT 1179 88.328 55.436 65.527 1.00 0.00 H ATOM 94395 H2 WAT 1179 87.897 56.226 66.744 1.00 0.00 H TER 94397 WAT 1179 ATOM 94397 O WAT 1180 70.828 136.293 151.808 1.00 0.00 O ATOM 94398 H1 WAT 1180 69.937 136.613 151.669 1.00 0.00 H ATOM 94399 H2 WAT 1180 70.881 135.497 151.280 1.00 0.00 H TER 94401 WAT 1180 ATOM 94401 O WAT 1181 78.051 6.749 67.273 1.00 0.00 O ATOM 94402 H1 WAT 1181 78.822 6.576 66.733 1.00 0.00 H ATOM 94403 H2 WAT 1181 78.343 6.582 68.169 1.00 0.00 H TER 94405 WAT 1181 ATOM 94405 O WAT 1182 117.768 56.227 82.850 1.00 0.00 O ATOM 94406 H1 WAT 1182 118.596 56.702 82.787 1.00 0.00 H ATOM 94407 H2 WAT 1182 117.983 55.334 82.579 1.00 0.00 H TER 94409 WAT 1182 ATOM 94409 O WAT 1183 23.135 43.782 4.398 1.00 0.00 O ATOM 94410 H1 WAT 1183 22.844 42.929 4.075 1.00 0.00 H ATOM 94411 H2 WAT 1183 22.353 44.168 4.794 1.00 0.00 H TER 94413 WAT 1183 ATOM 94413 O WAT 1184 84.488 74.600 22.177 1.00 0.00 O ATOM 94414 H1 WAT 1184 85.420 74.537 22.387 1.00 0.00 H ATOM 94415 H2 WAT 1184 84.314 75.541 22.140 1.00 0.00 H TER 94417 WAT 1184 ATOM 94417 O WAT 1185 73.796 74.268 152.259 1.00 0.00 O ATOM 94418 H1 WAT 1185 74.181 74.746 151.524 1.00 0.00 H ATOM 94419 H2 WAT 1185 73.660 73.382 151.923 1.00 0.00 H TER 94421 WAT 1185 ATOM 94421 O WAT 1186 24.285 53.761 114.558 1.00 0.00 O ATOM 94422 H1 WAT 1186 25.181 54.090 114.634 1.00 0.00 H ATOM 94423 H2 WAT 1186 23.752 54.411 115.014 1.00 0.00 H TER 94425 WAT 1186 ATOM 94425 O WAT 1187 121.792 14.471 103.368 1.00 0.00 O ATOM 94426 H1 WAT 1187 121.583 13.722 103.926 1.00 0.00 H ATOM 94427 H2 WAT 1187 122.668 14.281 103.030 1.00 0.00 H TER 94429 WAT 1187 ATOM 94429 O WAT 1188 41.783 116.736 76.760 1.00 0.00 O ATOM 94430 H1 WAT 1188 42.352 116.706 77.529 1.00 0.00 H ATOM 94431 H2 WAT 1188 41.044 117.281 77.031 1.00 0.00 H TER 94433 WAT 1188 ATOM 94433 O WAT 1189 37.861 14.642 3.218 1.00 0.00 O ATOM 94434 H1 WAT 1189 37.485 14.843 2.361 1.00 0.00 H ATOM 94435 H2 WAT 1189 37.298 13.952 3.571 1.00 0.00 H TER 94437 WAT 1189 ATOM 94437 O WAT 1190 73.840 68.632 112.028 1.00 0.00 O ATOM 94438 H1 WAT 1190 72.912 68.419 111.928 1.00 0.00 H ATOM 94439 H2 WAT 1190 73.921 69.522 111.684 1.00 0.00 H TER 94441 WAT 1190 ATOM 94441 O WAT 1191 118.554 29.638 124.482 1.00 0.00 O ATOM 94442 H1 WAT 1191 118.269 29.485 125.384 1.00 0.00 H ATOM 94443 H2 WAT 1191 118.002 30.357 124.176 1.00 0.00 H TER 94445 WAT 1191 ATOM 94445 O WAT 1192 23.979 114.651 14.137 1.00 0.00 O ATOM 94446 H1 WAT 1192 24.751 114.478 14.675 1.00 0.00 H ATOM 94447 H2 WAT 1192 23.315 114.047 14.469 1.00 0.00 H TER 94449 WAT 1192 ATOM 94449 O WAT 1193 78.585 14.101 125.936 1.00 0.00 O ATOM 94450 H1 WAT 1193 78.495 13.935 124.997 1.00 0.00 H ATOM 94451 H2 WAT 1193 77.721 14.410 126.208 1.00 0.00 H TER 94453 WAT 1193 ATOM 94453 O WAT 1194 76.286 59.067 84.812 1.00 0.00 O ATOM 94454 H1 WAT 1194 76.353 59.993 85.042 1.00 0.00 H ATOM 94455 H2 WAT 1194 77.098 58.877 84.341 1.00 0.00 H TER 94457 WAT 1194 ATOM 94457 O WAT 1195 65.180 128.079 81.213 1.00 0.00 O ATOM 94458 H1 WAT 1195 64.496 128.524 81.711 1.00 0.00 H ATOM 94459 H2 WAT 1195 65.997 128.463 81.532 1.00 0.00 H TER 94461 WAT 1195 ATOM 94461 O WAT 1196 125.083 32.146 13.951 1.00 0.00 O ATOM 94462 H1 WAT 1196 125.633 31.367 13.867 1.00 0.00 H ATOM 94463 H2 WAT 1196 124.718 32.087 14.834 1.00 0.00 H TER 94465 WAT 1196 ATOM 94465 O WAT 1197 128.074 85.933 125.472 1.00 0.00 O ATOM 94466 H1 WAT 1197 127.193 85.702 125.765 1.00 0.00 H ATOM 94467 H2 WAT 1197 128.445 86.433 126.199 1.00 0.00 H TER 94469 WAT 1197 ATOM 94469 O WAT 1198 10.084 138.430 65.308 1.00 0.00 O ATOM 94470 H1 WAT 1198 10.322 138.096 66.173 1.00 0.00 H ATOM 94471 H2 WAT 1198 10.378 137.751 64.701 1.00 0.00 H TER 94473 WAT 1198 ATOM 94473 O WAT 1199 137.813 6.131 147.887 1.00 0.00 O ATOM 94474 H1 WAT 1199 137.867 5.197 147.686 1.00 0.00 H ATOM 94475 H2 WAT 1199 137.861 6.174 148.842 1.00 0.00 H TER 94477 WAT 1199 ATOM 94477 O WAT 1200 72.870 52.225 72.297 1.00 0.00 O ATOM 94478 H1 WAT 1200 73.786 52.427 72.109 1.00 0.00 H ATOM 94479 H2 WAT 1200 72.416 52.375 71.468 1.00 0.00 H TER 94481 WAT 1200 ATOM 94481 O WAT 1201 31.057 103.371 96.758 1.00 0.00 O ATOM 94482 H1 WAT 1201 31.588 102.698 96.332 1.00 0.00 H ATOM 94483 H2 WAT 1201 30.208 103.318 96.320 1.00 0.00 H TER 94485 WAT 1201 ATOM 94485 O WAT 1202 59.363 116.385 93.244 1.00 0.00 O ATOM 94486 H1 WAT 1202 60.224 116.803 93.214 1.00 0.00 H ATOM 94487 H2 WAT 1202 59.550 115.448 93.186 1.00 0.00 H TER 94489 WAT 1202 ATOM 94489 O WAT 1203 89.404 16.213 68.345 1.00 0.00 O ATOM 94490 H1 WAT 1203 90.034 16.532 67.699 1.00 0.00 H ATOM 94491 H2 WAT 1203 89.006 17.006 68.704 1.00 0.00 H TER 94493 WAT 1203 ATOM 94493 O WAT 1204 86.427 9.360 144.390 1.00 0.00 O ATOM 94494 H1 WAT 1204 86.950 8.608 144.669 1.00 0.00 H ATOM 94495 H2 WAT 1204 87.002 9.845 143.799 1.00 0.00 H TER 94497 WAT 1204 ATOM 94497 O WAT 1205 3.650 30.274 124.479 1.00 0.00 O ATOM 94498 H1 WAT 1205 4.082 29.772 123.788 1.00 0.00 H ATOM 94499 H2 WAT 1205 2.757 29.931 124.501 1.00 0.00 H TER 94501 WAT 1205 ATOM 94501 O WAT 1206 83.648 31.362 130.271 1.00 0.00 O ATOM 94502 H1 WAT 1206 84.045 30.726 130.867 1.00 0.00 H ATOM 94503 H2 WAT 1206 84.124 31.248 129.449 1.00 0.00 H TER 94505 WAT 1206 ATOM 94505 O WAT 1207 113.667 35.905 110.427 1.00 0.00 O ATOM 94506 H1 WAT 1207 113.018 35.733 109.744 1.00 0.00 H ATOM 94507 H2 WAT 1207 113.608 35.148 111.009 1.00 0.00 H TER 94509 WAT 1207 ATOM 94509 O WAT 1208 4.634 101.718 0.466 1.00 0.00 O ATOM 94510 H1 WAT 1208 4.004 101.659 -0.252 1.00 0.00 H ATOM 94511 H2 WAT 1208 4.206 102.278 1.114 1.00 0.00 H TER 94513 WAT 1208 ATOM 94513 O WAT 1209 93.194 51.075 97.406 1.00 0.00 O ATOM 94514 H1 WAT 1209 93.900 51.648 97.108 1.00 0.00 H ATOM 94515 H2 WAT 1209 93.313 51.022 98.355 1.00 0.00 H TER 94517 WAT 1209 ATOM 94517 O WAT 1210 135.223 139.055 11.886 1.00 0.00 O ATOM 94518 H1 WAT 1210 135.022 138.709 11.016 1.00 0.00 H ATOM 94519 H2 WAT 1210 134.409 138.951 12.379 1.00 0.00 H TER 94521 WAT 1210 ATOM 94521 O WAT 1211 100.630 48.692 63.022 1.00 0.00 O ATOM 94522 H1 WAT 1211 101.057 49.546 62.954 1.00 0.00 H ATOM 94523 H2 WAT 1211 100.748 48.296 62.159 1.00 0.00 H TER 94525 WAT 1211 ATOM 94525 O WAT 1212 100.222 128.437 9.154 1.00 0.00 O ATOM 94526 H1 WAT 1212 99.468 128.447 8.565 1.00 0.00 H ATOM 94527 H2 WAT 1212 100.982 128.439 8.572 1.00 0.00 H TER 94529 WAT 1212 ATOM 94529 O WAT 1213 24.302 80.690 134.670 1.00 0.00 O ATOM 94530 H1 WAT 1213 24.250 81.439 134.076 1.00 0.00 H ATOM 94531 H2 WAT 1213 23.671 80.061 134.319 1.00 0.00 H TER 94533 WAT 1213 ATOM 94533 O WAT 1214 36.560 127.496 94.661 1.00 0.00 O ATOM 94534 H1 WAT 1214 36.775 128.235 94.091 1.00 0.00 H ATOM 94535 H2 WAT 1214 36.276 127.901 95.481 1.00 0.00 H TER 94537 WAT 1214 ATOM 94537 O WAT 1215 133.361 83.928 66.479 1.00 0.00 O ATOM 94538 H1 WAT 1215 133.958 83.206 66.283 1.00 0.00 H ATOM 94539 H2 WAT 1215 133.608 84.616 65.860 1.00 0.00 H TER 94541 WAT 1215 ATOM 94541 O WAT 1216 133.780 55.465 120.802 1.00 0.00 O ATOM 94542 H1 WAT 1216 133.294 55.813 121.550 1.00 0.00 H ATOM 94543 H2 WAT 1216 133.506 56.009 120.064 1.00 0.00 H TER 94545 WAT 1216 ATOM 94545 O WAT 1217 66.204 42.345 149.129 1.00 0.00 O ATOM 94546 H1 WAT 1217 65.302 42.025 149.091 1.00 0.00 H ATOM 94547 H2 WAT 1217 66.149 43.153 149.639 1.00 0.00 H TER 94549 WAT 1217 ATOM 94549 O WAT 1218 5.164 107.776 79.561 1.00 0.00 O ATOM 94550 H1 WAT 1218 5.418 107.474 78.689 1.00 0.00 H ATOM 94551 H2 WAT 1218 5.991 107.863 80.035 1.00 0.00 H TER 94553 WAT 1218 ATOM 94553 O WAT 1219 6.874 137.733 138.396 1.00 0.00 O ATOM 94554 H1 WAT 1219 6.236 137.452 139.052 1.00 0.00 H ATOM 94555 H2 WAT 1219 6.408 137.665 137.563 1.00 0.00 H TER 94557 WAT 1219 ATOM 94557 O WAT 1220 141.651 138.176 89.582 1.00 0.00 O ATOM 94558 H1 WAT 1220 141.241 137.423 90.008 1.00 0.00 H ATOM 94559 H2 WAT 1220 140.954 138.829 89.526 1.00 0.00 H TER 94561 WAT 1220 ATOM 94561 O WAT 1221 100.757 108.424 129.917 1.00 0.00 O ATOM 94562 H1 WAT 1221 99.946 108.731 129.512 1.00 0.00 H ATOM 94563 H2 WAT 1221 101.193 107.921 129.230 1.00 0.00 H TER 94565 WAT 1221 ATOM 94565 O WAT 1222 81.745 41.017 20.667 1.00 0.00 O ATOM 94566 H1 WAT 1222 81.780 41.400 21.544 1.00 0.00 H ATOM 94567 H2 WAT 1222 82.319 41.574 20.140 1.00 0.00 H TER 94569 WAT 1222 ATOM 94569 O WAT 1223 129.769 48.969 124.980 1.00 0.00 O ATOM 94570 H1 WAT 1223 130.593 49.364 125.266 1.00 0.00 H ATOM 94571 H2 WAT 1223 129.840 48.051 125.240 1.00 0.00 H TER 94573 WAT 1223 ATOM 94573 O WAT 1224 100.306 133.433 70.785 1.00 0.00 O ATOM 94574 H1 WAT 1224 100.156 132.713 70.172 1.00 0.00 H ATOM 94575 H2 WAT 1224 101.119 133.202 71.233 1.00 0.00 H TER 94577 WAT 1224 ATOM 94577 O WAT 1225 136.061 36.615 96.882 1.00 0.00 O ATOM 94578 H1 WAT 1225 136.118 35.687 97.108 1.00 0.00 H ATOM 94579 H2 WAT 1225 135.803 36.622 95.961 1.00 0.00 H TER 94581 WAT 1225 ATOM 94581 O WAT 1226 92.090 21.412 61.559 1.00 0.00 O ATOM 94582 H1 WAT 1226 91.137 21.347 61.627 1.00 0.00 H ATOM 94583 H2 WAT 1226 92.237 22.008 60.825 1.00 0.00 H TER 94585 WAT 1226 ATOM 94585 O WAT 1227 21.105 43.588 12.173 1.00 0.00 O ATOM 94586 H1 WAT 1227 20.345 43.865 12.685 1.00 0.00 H ATOM 94587 H2 WAT 1227 20.779 42.874 11.625 1.00 0.00 H TER 94589 WAT 1227 ATOM 94589 O WAT 1228 22.727 43.478 156.703 1.00 0.00 O ATOM 94590 H1 WAT 1228 23.503 43.558 156.149 1.00 0.00 H ATOM 94591 H2 WAT 1228 22.247 42.734 156.339 1.00 0.00 H TER 94593 WAT 1228 ATOM 94593 O WAT 1229 123.237 97.968 147.992 1.00 0.00 O ATOM 94594 H1 WAT 1229 123.275 97.884 147.039 1.00 0.00 H ATOM 94595 H2 WAT 1229 122.320 97.802 148.210 1.00 0.00 H TER 94597 WAT 1229 ATOM 94597 O WAT 1230 85.642 22.580 112.547 1.00 0.00 O ATOM 94598 H1 WAT 1230 84.975 22.780 113.203 1.00 0.00 H ATOM 94599 H2 WAT 1230 85.177 22.076 111.879 1.00 0.00 H TER 94601 WAT 1230 ATOM 94601 O WAT 1231 139.233 90.057 124.298 1.00 0.00 O ATOM 94602 H1 WAT 1231 138.439 90.551 124.093 1.00 0.00 H ATOM 94603 H2 WAT 1231 139.615 89.854 123.444 1.00 0.00 H TER 94605 WAT 1231 ATOM 94605 O WAT 1232 121.064 143.701 10.805 1.00 0.00 O ATOM 94606 H1 WAT 1232 120.172 143.368 10.903 1.00 0.00 H ATOM 94607 H2 WAT 1232 120.953 144.637 10.640 1.00 0.00 H TER 94609 WAT 1232 ATOM 94609 O WAT 1233 21.644 134.730 136.591 1.00 0.00 O ATOM 94610 H1 WAT 1233 22.322 135.196 137.080 1.00 0.00 H ATOM 94611 H2 WAT 1233 21.739 135.044 135.692 1.00 0.00 H TER 94613 WAT 1233 ATOM 94613 O WAT 1234 144.926 14.234 12.470 1.00 0.00 O ATOM 94614 H1 WAT 1234 144.925 15.065 11.994 1.00 0.00 H ATOM 94615 H2 WAT 1234 145.770 13.837 12.255 1.00 0.00 H TER 94617 WAT 1234 ATOM 94617 O WAT 1235 144.665 91.000 133.327 1.00 0.00 O ATOM 94618 H1 WAT 1235 143.741 90.769 133.232 1.00 0.00 H ATOM 94619 H2 WAT 1235 144.800 91.062 134.273 1.00 0.00 H TER 94621 WAT 1235 ATOM 94621 O WAT 1236 95.752 97.716 100.517 1.00 0.00 O ATOM 94622 H1 WAT 1236 96.425 97.036 100.481 1.00 0.00 H ATOM 94623 H2 WAT 1236 94.934 97.252 100.339 1.00 0.00 H TER 94625 WAT 1236 ATOM 94625 O WAT 1237 72.237 73.778 147.866 1.00 0.00 O ATOM 94626 H1 WAT 1237 72.883 74.380 147.496 1.00 0.00 H ATOM 94627 H2 WAT 1237 72.604 72.908 147.711 1.00 0.00 H TER 94629 WAT 1237 ATOM 94629 O WAT 1238 48.910 33.590 85.944 1.00 0.00 O ATOM 94630 H1 WAT 1238 49.809 33.883 85.795 1.00 0.00 H ATOM 94631 H2 WAT 1238 48.978 32.639 86.025 1.00 0.00 H TER 94633 WAT 1238 ATOM 94633 O WAT 1239 128.826 95.410 23.473 1.00 0.00 O ATOM 94634 H1 WAT 1239 129.116 95.167 22.594 1.00 0.00 H ATOM 94635 H2 WAT 1239 129.529 95.109 24.049 1.00 0.00 H TER 94637 WAT 1239 ATOM 94637 O WAT 1240 42.692 96.325 106.557 1.00 0.00 O ATOM 94638 H1 WAT 1240 42.190 95.971 105.823 1.00 0.00 H ATOM 94639 H2 WAT 1240 43.319 95.635 106.773 1.00 0.00 H TER 94641 WAT 1240 ATOM 94641 O WAT 1241 69.532 12.182 76.203 1.00 0.00 O ATOM 94642 H1 WAT 1241 70.363 12.344 75.755 1.00 0.00 H ATOM 94643 H2 WAT 1241 69.507 12.832 76.905 1.00 0.00 H TER 94645 WAT 1241 ATOM 94645 O WAT 1242 30.448 128.862 67.604 1.00 0.00 O ATOM 94646 H1 WAT 1242 31.317 129.232 67.760 1.00 0.00 H ATOM 94647 H2 WAT 1242 30.315 128.250 68.328 1.00 0.00 H TER 94649 WAT 1242 ATOM 94649 O WAT 1243 5.388 100.875 130.290 1.00 0.00 O ATOM 94650 H1 WAT 1243 5.393 101.726 129.852 1.00 0.00 H ATOM 94651 H2 WAT 1243 6.314 100.657 130.400 1.00 0.00 H TER 94653 WAT 1243 ATOM 94653 O WAT 1244 15.998 104.029 111.626 1.00 0.00 O ATOM 94654 H1 WAT 1244 16.483 103.637 112.352 1.00 0.00 H ATOM 94655 H2 WAT 1244 16.093 103.402 110.909 1.00 0.00 H TER 94657 WAT 1244 ATOM 94657 O WAT 1245 116.907 114.981 63.542 1.00 0.00 O ATOM 94658 H1 WAT 1245 117.637 114.385 63.705 1.00 0.00 H ATOM 94659 H2 WAT 1245 116.263 114.449 63.075 1.00 0.00 H TER 94661 WAT 1245 ATOM 94661 O WAT 1246 78.005 8.781 148.823 1.00 0.00 O ATOM 94662 H1 WAT 1246 78.925 8.960 149.019 1.00 0.00 H ATOM 94663 H2 WAT 1246 78.026 8.008 148.259 1.00 0.00 H TER 94665 WAT 1246 ATOM 94665 O WAT 1247 141.104 96.717 111.706 1.00 0.00 O ATOM 94666 H1 WAT 1247 140.540 96.099 112.172 1.00 0.00 H ATOM 94667 H2 WAT 1247 141.797 96.927 112.333 1.00 0.00 H TER 94669 WAT 1247 ATOM 94669 O WAT 1248 20.660 128.760 2.199 1.00 0.00 O ATOM 94670 H1 WAT 1248 20.568 128.177 2.952 1.00 0.00 H ATOM 94671 H2 WAT 1248 20.340 129.607 2.511 1.00 0.00 H TER 94673 WAT 1248 ATOM 94673 O WAT 1249 57.059 7.894 62.194 1.00 0.00 O ATOM 94674 H1 WAT 1249 56.458 7.332 62.683 1.00 0.00 H ATOM 94675 H2 WAT 1249 56.962 7.614 61.284 1.00 0.00 H TER 94677 WAT 1249 ATOM 94677 O WAT 1250 61.292 48.752 5.659 1.00 0.00 O ATOM 94678 H1 WAT 1250 60.688 48.072 5.361 1.00 0.00 H ATOM 94679 H2 WAT 1250 61.460 49.282 4.880 1.00 0.00 H TER 94681 WAT 1250 ATOM 94681 O WAT 1251 81.713 68.865 93.423 1.00 0.00 O ATOM 94682 H1 WAT 1251 82.137 69.692 93.650 1.00 0.00 H ATOM 94683 H2 WAT 1251 82.375 68.385 92.925 1.00 0.00 H TER 94685 WAT 1251 ATOM 94685 O WAT 1252 75.568 86.744 128.299 1.00 0.00 O ATOM 94686 H1 WAT 1252 75.106 85.937 128.072 1.00 0.00 H ATOM 94687 H2 WAT 1252 74.953 87.224 128.853 1.00 0.00 H TER 94689 WAT 1252 ATOM 94689 O WAT 1253 93.592 137.144 67.672 1.00 0.00 O ATOM 94690 H1 WAT 1253 93.822 136.961 66.761 1.00 0.00 H ATOM 94691 H2 WAT 1253 92.648 136.994 67.715 1.00 0.00 H TER 94693 WAT 1253 ATOM 94693 O WAT 1254 121.127 83.694 142.093 1.00 0.00 O ATOM 94694 H1 WAT 1254 121.212 83.582 143.039 1.00 0.00 H ATOM 94695 H2 WAT 1254 121.823 84.310 141.862 1.00 0.00 H TER 94697 WAT 1254 ATOM 94697 O WAT 1255 60.881 65.514 142.075 1.00 0.00 O ATOM 94698 H1 WAT 1255 60.558 66.343 141.720 1.00 0.00 H ATOM 94699 H2 WAT 1255 60.475 65.450 142.940 1.00 0.00 H TER 94701 WAT 1255 ATOM 94701 O WAT 1256 68.216 16.097 59.257 1.00 0.00 O ATOM 94702 H1 WAT 1256 68.994 15.622 58.963 1.00 0.00 H ATOM 94703 H2 WAT 1256 67.833 16.449 58.454 1.00 0.00 H TER 94705 WAT 1256 ATOM 94705 O WAT 1257 38.314 63.326 118.839 1.00 0.00 O ATOM 94706 H1 WAT 1257 38.570 62.538 119.319 1.00 0.00 H ATOM 94707 H2 WAT 1257 38.264 63.043 117.926 1.00 0.00 H TER 94709 WAT 1257 ATOM 94709 O WAT 1258 86.250 107.603 149.395 1.00 0.00 O ATOM 94710 H1 WAT 1258 85.804 108.449 149.426 1.00 0.00 H ATOM 94711 H2 WAT 1258 86.165 107.321 148.484 1.00 0.00 H TER 94713 WAT 1258 ATOM 94713 O WAT 1259 68.166 32.674 128.015 1.00 0.00 O ATOM 94714 H1 WAT 1259 67.891 33.591 128.040 1.00 0.00 H ATOM 94715 H2 WAT 1259 68.158 32.447 127.085 1.00 0.00 H TER 94717 WAT 1259 ATOM 94717 O WAT 1260 42.035 58.299 13.012 1.00 0.00 O ATOM 94718 H1 WAT 1260 42.438 57.548 13.446 1.00 0.00 H ATOM 94719 H2 WAT 1260 42.475 58.351 12.164 1.00 0.00 H TER 94721 WAT 1260 ATOM 94721 O WAT 1261 41.460 13.746 96.632 1.00 0.00 O ATOM 94722 H1 WAT 1261 42.030 14.118 95.959 1.00 0.00 H ATOM 94723 H2 WAT 1261 41.921 12.962 96.929 1.00 0.00 H TER 94725 WAT 1261 ATOM 94725 O WAT 1262 113.208 105.421 86.451 1.00 0.00 O ATOM 94726 H1 WAT 1262 113.834 105.942 86.954 1.00 0.00 H ATOM 94727 H2 WAT 1262 113.497 105.510 85.543 1.00 0.00 H TER 94729 WAT 1262 ATOM 94729 O WAT 1263 108.205 14.419 90.065 1.00 0.00 O ATOM 94730 H1 WAT 1263 107.309 14.472 90.399 1.00 0.00 H ATOM 94731 H2 WAT 1263 108.598 13.692 90.547 1.00 0.00 H TER 94733 WAT 1263 ATOM 94733 O WAT 1264 88.573 63.663 18.916 1.00 0.00 O ATOM 94734 H1 WAT 1264 89.205 63.155 18.408 1.00 0.00 H ATOM 94735 H2 WAT 1264 88.885 63.600 19.819 1.00 0.00 H TER 94737 WAT 1264 ATOM 94737 O WAT 1265 75.086 119.171 64.952 1.00 0.00 O ATOM 94738 H1 WAT 1265 74.233 119.468 64.635 1.00 0.00 H ATOM 94739 H2 WAT 1265 74.893 118.381 65.456 1.00 0.00 H TER 94741 WAT 1265 ATOM 94741 O WAT 1266 69.817 77.556 126.718 1.00 0.00 O ATOM 94742 H1 WAT 1266 69.108 77.060 127.127 1.00 0.00 H ATOM 94743 H2 WAT 1266 70.218 76.939 126.105 1.00 0.00 H TER 94745 WAT 1266 ATOM 94745 O WAT 1267 12.511 101.821 75.090 1.00 0.00 O ATOM 94746 H1 WAT 1267 11.954 102.451 74.632 1.00 0.00 H ATOM 94747 H2 WAT 1267 12.484 101.036 74.543 1.00 0.00 H TER 94749 WAT 1267 ATOM 94749 O WAT 1268 29.395 118.892 77.774 1.00 0.00 O ATOM 94750 H1 WAT 1268 28.447 118.997 77.695 1.00 0.00 H ATOM 94751 H2 WAT 1268 29.737 119.786 77.769 1.00 0.00 H TER 94753 WAT 1268 ATOM 94753 O WAT 1269 13.436 50.494 66.217 1.00 0.00 O ATOM 94754 H1 WAT 1269 13.867 49.891 66.824 1.00 0.00 H ATOM 94755 H2 WAT 1269 14.102 50.685 65.557 1.00 0.00 H TER 94757 WAT 1269 ATOM 94757 O WAT 1270 140.622 24.788 7.458 1.00 0.00 O ATOM 94758 H1 WAT 1270 140.326 25.417 6.800 1.00 0.00 H ATOM 94759 H2 WAT 1270 139.953 24.823 8.142 1.00 0.00 H TER 94761 WAT 1270 ATOM 94761 O WAT 1271 37.015 7.407 100.611 1.00 0.00 O ATOM 94762 H1 WAT 1271 37.738 6.785 100.692 1.00 0.00 H ATOM 94763 H2 WAT 1271 36.238 6.902 100.851 1.00 0.00 H TER 94765 WAT 1271 ATOM 94765 O WAT 1272 45.415 115.550 53.730 1.00 0.00 O ATOM 94766 H1 WAT 1272 45.811 114.790 53.304 1.00 0.00 H ATOM 94767 H2 WAT 1272 44.487 115.498 53.499 1.00 0.00 H TER 94769 WAT 1272 ATOM 94769 O WAT 1273 136.555 120.492 153.274 1.00 0.00 O ATOM 94770 H1 WAT 1273 136.160 121.275 152.892 1.00 0.00 H ATOM 94771 H2 WAT 1273 136.725 120.731 154.186 1.00 0.00 H TER 94773 WAT 1273 ATOM 94773 O WAT 1274 35.221 81.033 155.833 1.00 0.00 O ATOM 94774 H1 WAT 1274 34.933 80.428 156.516 1.00 0.00 H ATOM 94775 H2 WAT 1274 34.411 81.333 155.421 1.00 0.00 H TER 94777 WAT 1274 ATOM 94777 O WAT 1275 34.901 140.624 68.715 1.00 0.00 O ATOM 94778 H1 WAT 1275 35.029 141.521 69.024 1.00 0.00 H ATOM 94779 H2 WAT 1275 33.953 140.536 68.620 1.00 0.00 H TER 94781 WAT 1275 ATOM 94781 O WAT 1276 69.186 57.714 139.009 1.00 0.00 O ATOM 94782 H1 WAT 1276 69.213 58.668 138.932 1.00 0.00 H ATOM 94783 H2 WAT 1276 70.033 57.481 139.389 1.00 0.00 H TER 94785 WAT 1276 ATOM 94785 O WAT 1277 101.274 87.492 1.153 1.00 0.00 O ATOM 94786 H1 WAT 1277 100.787 87.019 1.828 1.00 0.00 H ATOM 94787 H2 WAT 1277 101.923 88.002 1.638 1.00 0.00 H TER 94789 WAT 1277 ATOM 94789 O WAT 1278 98.018 79.267 144.173 1.00 0.00 O ATOM 94790 H1 WAT 1278 97.292 79.372 143.558 1.00 0.00 H ATOM 94791 H2 WAT 1278 97.600 79.230 145.033 1.00 0.00 H TER 94793 WAT 1278 ATOM 94793 O WAT 1279 22.111 134.294 10.376 1.00 0.00 O ATOM 94794 H1 WAT 1279 21.784 135.130 10.042 1.00 0.00 H ATOM 94795 H2 WAT 1279 22.134 134.408 11.326 1.00 0.00 H TER 94797 WAT 1279 ATOM 94797 O WAT 1280 62.193 72.777 125.027 1.00 0.00 O ATOM 94798 H1 WAT 1280 62.412 72.407 125.882 1.00 0.00 H ATOM 94799 H2 WAT 1280 61.331 73.174 125.151 1.00 0.00 H TER 94801 WAT 1280 ATOM 94801 O WAT 1281 48.132 44.234 154.552 1.00 0.00 O ATOM 94802 H1 WAT 1281 48.678 44.146 155.333 1.00 0.00 H ATOM 94803 H2 WAT 1281 48.384 45.078 154.178 1.00 0.00 H TER 94805 WAT 1281 ATOM 94805 O WAT 1282 37.010 33.179 83.006 1.00 0.00 O ATOM 94806 H1 WAT 1282 37.157 34.014 82.561 1.00 0.00 H ATOM 94807 H2 WAT 1282 37.126 33.379 83.934 1.00 0.00 H TER 94809 WAT 1282 ATOM 94809 O WAT 1283 119.095 40.285 14.813 1.00 0.00 O ATOM 94810 H1 WAT 1283 118.427 40.303 14.128 1.00 0.00 H ATOM 94811 H2 WAT 1283 119.795 39.741 14.451 1.00 0.00 H TER 94813 WAT 1283 ATOM 94813 O WAT 1284 132.766 139.223 75.588 1.00 0.00 O ATOM 94814 H1 WAT 1284 133.341 139.935 75.309 1.00 0.00 H ATOM 94815 H2 WAT 1284 133.361 138.559 75.937 1.00 0.00 H TER 94817 WAT 1284 ATOM 94817 O WAT 1285 80.799 50.969 151.277 1.00 0.00 O ATOM 94818 H1 WAT 1285 80.041 51.551 151.343 1.00 0.00 H ATOM 94819 H2 WAT 1285 81.533 51.497 151.592 1.00 0.00 H TER 94821 WAT 1285 ATOM 94821 O WAT 1286 107.573 133.767 3.868 1.00 0.00 O ATOM 94822 H1 WAT 1286 107.563 133.565 4.803 1.00 0.00 H ATOM 94823 H2 WAT 1286 107.300 134.683 3.818 1.00 0.00 H TER 94825 WAT 1286 ATOM 94825 O WAT 1287 60.426 15.077 67.167 1.00 0.00 O ATOM 94826 H1 WAT 1287 60.230 15.978 67.424 1.00 0.00 H ATOM 94827 H2 WAT 1287 61.033 15.164 66.432 1.00 0.00 H TER 94829 WAT 1287 ATOM 94829 O WAT 1288 104.582 79.052 63.854 1.00 0.00 O ATOM 94830 H1 WAT 1288 105.195 79.782 63.767 1.00 0.00 H ATOM 94831 H2 WAT 1288 103.852 79.410 64.358 1.00 0.00 H TER 94833 WAT 1288 ATOM 94833 O WAT 1289 2.725 100.386 81.848 1.00 0.00 O ATOM 94834 H1 WAT 1289 1.975 100.941 82.062 1.00 0.00 H ATOM 94835 H2 WAT 1289 2.867 99.861 82.636 1.00 0.00 H TER 94837 WAT 1289 ATOM 94837 O WAT 1290 144.452 41.541 11.853 1.00 0.00 O ATOM 94838 H1 WAT 1290 144.195 41.307 12.745 1.00 0.00 H ATOM 94839 H2 WAT 1290 145.328 41.915 11.946 1.00 0.00 H TER 94841 WAT 1290 ATOM 94841 O WAT 1291 47.644 9.528 6.895 1.00 0.00 O ATOM 94842 H1 WAT 1291 48.159 9.167 6.173 1.00 0.00 H ATOM 94843 H2 WAT 1291 47.735 10.476 6.804 1.00 0.00 H TER 94845 WAT 1291 ATOM 94845 O WAT 1292 92.886 96.452 89.570 1.00 0.00 O ATOM 94846 H1 WAT 1292 93.202 97.293 89.243 1.00 0.00 H ATOM 94847 H2 WAT 1292 93.035 95.842 88.848 1.00 0.00 H TER 94849 WAT 1292 ATOM 94849 O WAT 1293 95.016 125.683 117.172 1.00 0.00 O ATOM 94850 H1 WAT 1293 95.701 126.063 116.621 1.00 0.00 H ATOM 94851 H2 WAT 1293 95.118 124.738 117.063 1.00 0.00 H TER 94853 WAT 1293 ATOM 94853 O WAT 1294 103.828 11.567 137.574 1.00 0.00 O ATOM 94854 H1 WAT 1294 104.045 11.909 138.441 1.00 0.00 H ATOM 94855 H2 WAT 1294 103.456 12.315 137.108 1.00 0.00 H TER 94857 WAT 1294 ATOM 94857 O WAT 1295 138.193 33.864 151.074 1.00 0.00 O ATOM 94858 H1 WAT 1295 137.683 33.267 150.526 1.00 0.00 H ATOM 94859 H2 WAT 1295 137.710 34.689 151.042 1.00 0.00 H TER 94861 WAT 1295 ATOM 94861 O WAT 1296 16.826 124.785 12.029 1.00 0.00 O ATOM 94862 H1 WAT 1296 17.411 125.431 11.633 1.00 0.00 H ATOM 94863 H2 WAT 1296 16.948 123.996 11.501 1.00 0.00 H TER 94865 WAT 1296 ATOM 94865 O WAT 1297 5.624 145.481 154.002 1.00 0.00 O ATOM 94866 H1 WAT 1297 5.253 145.071 154.784 1.00 0.00 H ATOM 94867 H2 WAT 1297 5.362 146.399 154.066 1.00 0.00 H TER 94869 WAT 1297 ATOM 94869 O WAT 1298 25.328 28.303 112.100 1.00 0.00 O ATOM 94870 H1 WAT 1298 24.509 27.811 112.052 1.00 0.00 H ATOM 94871 H2 WAT 1298 25.790 28.079 111.292 1.00 0.00 H TER 94873 WAT 1298 ATOM 94873 O WAT 1299 75.033 137.350 74.201 1.00 0.00 O ATOM 94874 H1 WAT 1299 74.438 136.962 74.843 1.00 0.00 H ATOM 94875 H2 WAT 1299 75.719 137.760 74.727 1.00 0.00 H TER 94877 WAT 1299 ATOM 94877 O WAT 1300 101.247 52.561 129.088 1.00 0.00 O ATOM 94878 H1 WAT 1300 101.631 53.380 129.403 1.00 0.00 H ATOM 94879 H2 WAT 1300 100.485 52.422 129.651 1.00 0.00 H TER 94881 WAT 1300 ATOM 94881 O WAT 1301 68.909 6.106 126.081 1.00 0.00 O ATOM 94882 H1 WAT 1301 69.771 6.289 125.708 1.00 0.00 H ATOM 94883 H2 WAT 1301 68.951 6.459 126.969 1.00 0.00 H TER 94885 WAT 1301 ATOM 94885 O WAT 1302 29.314 56.817 88.536 1.00 0.00 O ATOM 94886 H1 WAT 1302 29.983 56.447 89.112 1.00 0.00 H ATOM 94887 H2 WAT 1302 28.816 57.411 89.097 1.00 0.00 H TER 94889 WAT 1302 ATOM 94889 O WAT 1303 127.716 36.537 158.577 1.00 0.00 O ATOM 94890 H1 WAT 1303 127.550 36.503 157.635 1.00 0.00 H ATOM 94891 H2 WAT 1303 128.597 36.176 158.678 1.00 0.00 H TER 94893 WAT 1303 ATOM 94893 O WAT 1304 54.553 117.965 143.509 1.00 0.00 O ATOM 94894 H1 WAT 1304 54.322 117.756 142.604 1.00 0.00 H ATOM 94895 H2 WAT 1304 55.501 118.095 143.491 1.00 0.00 H TER 94897 WAT 1304 ATOM 94897 O WAT 1305 103.378 53.847 142.245 1.00 0.00 O ATOM 94898 H1 WAT 1305 103.336 52.904 142.408 1.00 0.00 H ATOM 94899 H2 WAT 1305 102.898 53.969 141.426 1.00 0.00 H TER 94901 WAT 1305 ATOM 94901 O WAT 1306 3.320 145.334 10.189 1.00 0.00 O ATOM 94902 H1 WAT 1306 2.977 144.564 10.643 1.00 0.00 H ATOM 94903 H2 WAT 1306 3.146 145.163 9.263 1.00 0.00 H TER 94905 WAT 1306 ATOM 94905 O WAT 1307 64.124 120.419 8.868 1.00 0.00 O ATOM 94906 H1 WAT 1307 63.343 120.751 9.309 1.00 0.00 H ATOM 94907 H2 WAT 1307 63.786 119.828 8.195 1.00 0.00 H TER 94909 WAT 1307 ATOM 94909 O WAT 1308 117.569 28.756 135.576 1.00 0.00 O ATOM 94910 H1 WAT 1308 117.547 28.271 134.751 1.00 0.00 H ATOM 94911 H2 WAT 1308 117.105 28.194 136.196 1.00 0.00 H TER 94913 WAT 1308 ATOM 94913 O WAT 1309 56.809 130.946 89.371 1.00 0.00 O ATOM 94914 H1 WAT 1309 56.670 130.009 89.507 1.00 0.00 H ATOM 94915 H2 WAT 1309 57.011 131.026 88.439 1.00 0.00 H TER 94917 WAT 1309 ATOM 94917 O WAT 1310 112.507 29.897 137.496 1.00 0.00 O ATOM 94918 H1 WAT 1310 112.070 29.162 137.065 1.00 0.00 H ATOM 94919 H2 WAT 1310 113.127 30.222 136.843 1.00 0.00 H TER 94921 WAT 1310 ATOM 94921 O WAT 1311 71.955 32.390 83.409 1.00 0.00 O ATOM 94922 H1 WAT 1311 71.463 32.205 84.209 1.00 0.00 H ATOM 94923 H2 WAT 1311 71.480 33.112 82.998 1.00 0.00 H TER 94925 WAT 1311 ATOM 94925 O WAT 1312 110.418 118.880 77.465 1.00 0.00 O ATOM 94926 H1 WAT 1312 110.534 118.066 77.955 1.00 0.00 H ATOM 94927 H2 WAT 1312 109.527 118.826 77.117 1.00 0.00 H TER 94929 WAT 1312 ATOM 94929 O WAT 1313 108.219 19.588 78.602 1.00 0.00 O ATOM 94930 H1 WAT 1313 108.299 19.981 79.471 1.00 0.00 H ATOM 94931 H2 WAT 1313 108.998 19.885 78.133 1.00 0.00 H TER 94933 WAT 1313 ATOM 94933 O WAT 1314 1.637 122.115 131.049 1.00 0.00 O ATOM 94934 H1 WAT 1314 1.705 122.086 130.094 1.00 0.00 H ATOM 94935 H2 WAT 1314 2.520 121.910 131.357 1.00 0.00 H TER 94937 WAT 1314 ATOM 94937 O WAT 1315 97.519 27.520 0.852 1.00 0.00 O ATOM 94938 H1 WAT 1315 97.570 26.980 0.063 1.00 0.00 H ATOM 94939 H2 WAT 1315 97.335 28.401 0.527 1.00 0.00 H TER 94941 WAT 1315 ATOM 94941 O WAT 1316 60.521 65.780 107.910 1.00 0.00 O ATOM 94942 H1 WAT 1316 60.862 66.019 108.772 1.00 0.00 H ATOM 94943 H2 WAT 1316 60.933 64.939 107.714 1.00 0.00 H TER 94945 WAT 1316 ATOM 94945 O WAT 1317 96.659 0.485 153.995 1.00 0.00 O ATOM 94946 H1 WAT 1317 97.209 0.837 154.695 1.00 0.00 H ATOM 94947 H2 WAT 1317 96.449 1.244 153.451 1.00 0.00 H TER 94949 WAT 1317 ATOM 94949 O WAT 1318 19.320 98.916 111.554 1.00 0.00 O ATOM 94950 H1 WAT 1318 19.933 99.389 110.992 1.00 0.00 H ATOM 94951 H2 WAT 1318 18.598 98.677 110.973 1.00 0.00 H TER 94953 WAT 1318 ATOM 94953 O WAT 1319 6.704 135.825 100.745 1.00 0.00 O ATOM 94954 H1 WAT 1319 6.926 135.572 99.849 1.00 0.00 H ATOM 94955 H2 WAT 1319 6.820 136.776 100.761 1.00 0.00 H TER 94957 WAT 1319 ATOM 94957 O WAT 1320 10.555 39.776 100.463 1.00 0.00 O ATOM 94958 H1 WAT 1320 10.064 39.102 99.992 1.00 0.00 H ATOM 94959 H2 WAT 1320 11.224 40.063 99.842 1.00 0.00 H TER 94961 WAT 1320 ATOM 94961 O WAT 1321 43.849 37.127 129.920 1.00 0.00 O ATOM 94962 H1 WAT 1321 43.030 36.649 129.792 1.00 0.00 H ATOM 94963 H2 WAT 1321 44.396 36.866 129.179 1.00 0.00 H TER 94965 WAT 1321 ATOM 94965 O WAT 1322 87.509 98.535 128.439 1.00 0.00 O ATOM 94966 H1 WAT 1322 87.914 98.969 127.687 1.00 0.00 H ATOM 94967 H2 WAT 1322 87.939 97.682 128.483 1.00 0.00 H TER 94969 WAT 1322 ATOM 94969 O WAT 1323 63.407 60.823 112.973 1.00 0.00 O ATOM 94970 H1 WAT 1323 63.127 59.952 113.255 1.00 0.00 H ATOM 94971 H2 WAT 1323 62.653 61.176 112.501 1.00 0.00 H TER 94973 WAT 1323 ATOM 94973 O WAT 1324 75.170 84.419 131.193 1.00 0.00 O ATOM 94974 H1 WAT 1324 75.687 85.216 131.082 1.00 0.00 H ATOM 94975 H2 WAT 1324 75.017 84.362 132.136 1.00 0.00 H TER 94977 WAT 1324 ATOM 94977 O WAT 1325 46.166 143.443 123.462 1.00 0.00 O ATOM 94978 H1 WAT 1325 46.294 144.391 123.487 1.00 0.00 H ATOM 94979 H2 WAT 1325 45.802 143.228 124.321 1.00 0.00 H TER 94981 WAT 1325 ATOM 94981 O WAT 1326 108.868 114.556 146.585 1.00 0.00 O ATOM 94982 H1 WAT 1326 109.482 115.245 146.839 1.00 0.00 H ATOM 94983 H2 WAT 1326 109.175 114.268 145.725 1.00 0.00 H TER 94985 WAT 1326 ATOM 94985 O WAT 1327 43.852 117.429 8.273 1.00 0.00 O ATOM 94986 H1 WAT 1327 44.462 116.838 7.833 1.00 0.00 H ATOM 94987 H2 WAT 1327 43.180 117.612 7.616 1.00 0.00 H TER 94989 WAT 1327 ATOM 94989 O WAT 1328 9.153 31.499 74.141 1.00 0.00 O ATOM 94990 H1 WAT 1328 9.647 30.894 74.695 1.00 0.00 H ATOM 94991 H2 WAT 1328 9.811 32.110 73.809 1.00 0.00 H TER 94993 WAT 1328 ATOM 94993 O WAT 1329 60.401 46.900 91.896 1.00 0.00 O ATOM 94994 H1 WAT 1329 59.595 47.358 92.134 1.00 0.00 H ATOM 94995 H2 WAT 1329 61.100 47.429 92.281 1.00 0.00 H TER 94997 WAT 1329 ATOM 94997 O WAT 1330 44.191 113.375 14.567 1.00 0.00 O ATOM 94998 H1 WAT 1330 44.531 114.247 14.367 1.00 0.00 H ATOM 94999 H2 WAT 1330 43.293 113.385 14.236 1.00 0.00 H TER 95001 WAT 1330 ATOM 95001 O WAT 1331 22.825 139.487 138.239 1.00 0.00 O ATOM 95002 H1 WAT 1331 22.810 139.505 137.282 1.00 0.00 H ATOM 95003 H2 WAT 1331 22.672 140.395 138.498 1.00 0.00 H TER 95005 WAT 1331 ATOM 95005 O WAT 1332 39.783 40.251 124.017 1.00 0.00 O ATOM 95006 H1 WAT 1332 39.780 40.801 124.800 1.00 0.00 H ATOM 95007 H2 WAT 1332 39.823 39.356 124.353 1.00 0.00 H TER 95009 WAT 1332 ATOM 95009 O WAT 1333 102.107 105.747 123.731 1.00 0.00 O ATOM 95010 H1 WAT 1333 101.434 105.083 123.880 1.00 0.00 H ATOM 95011 H2 WAT 1333 102.934 105.272 123.815 1.00 0.00 H TER 95013 WAT 1333 ATOM 95013 O WAT 1334 129.310 8.313 102.143 1.00 0.00 O ATOM 95014 H1 WAT 1334 128.680 7.693 101.777 1.00 0.00 H ATOM 95015 H2 WAT 1334 129.794 8.639 101.384 1.00 0.00 H TER 95017 WAT 1334 ATOM 95017 O WAT 1335 53.212 128.424 12.332 1.00 0.00 O ATOM 95018 H1 WAT 1335 53.719 129.010 11.769 1.00 0.00 H ATOM 95019 H2 WAT 1335 53.319 128.786 13.212 1.00 0.00 H TER 95021 WAT 1335 ATOM 95021 O WAT 1336 111.499 58.948 138.577 1.00 0.00 O ATOM 95022 H1 WAT 1336 111.066 59.604 139.123 1.00 0.00 H ATOM 95023 H2 WAT 1336 111.648 59.391 137.741 1.00 0.00 H TER 95025 WAT 1336 ATOM 95025 O WAT 1337 68.408 139.366 128.173 1.00 0.00 O ATOM 95026 H1 WAT 1337 68.489 138.938 127.321 1.00 0.00 H ATOM 95027 H2 WAT 1337 68.951 138.839 128.759 1.00 0.00 H TER 95029 WAT 1337 ATOM 95029 O WAT 1338 123.449 28.642 13.199 1.00 0.00 O ATOM 95030 H1 WAT 1338 123.245 29.370 13.786 1.00 0.00 H ATOM 95031 H2 WAT 1338 123.657 27.913 13.784 1.00 0.00 H TER 95033 WAT 1338 ATOM 95033 O WAT 1339 30.674 104.001 123.478 1.00 0.00 O ATOM 95034 H1 WAT 1339 29.972 103.803 124.098 1.00 0.00 H ATOM 95035 H2 WAT 1339 31.253 104.595 123.954 1.00 0.00 H TER 95037 WAT 1339 ATOM 95037 O WAT 1340 18.702 84.932 143.652 1.00 0.00 O ATOM 95038 H1 WAT 1340 17.912 84.679 144.130 1.00 0.00 H ATOM 95039 H2 WAT 1340 19.389 84.369 144.009 1.00 0.00 H TER 95041 WAT 1340 ATOM 95041 O WAT 1341 36.054 21.208 65.330 1.00 0.00 O ATOM 95042 H1 WAT 1341 36.466 20.681 64.646 1.00 0.00 H ATOM 95043 H2 WAT 1341 35.545 21.864 64.854 1.00 0.00 H TER 95045 WAT 1341 ATOM 95045 O WAT 1342 10.475 60.084 14.900 1.00 0.00 O ATOM 95046 H1 WAT 1342 10.486 60.894 15.410 1.00 0.00 H ATOM 95047 H2 WAT 1342 11.158 59.542 15.295 1.00 0.00 H TER 95049 WAT 1342 ATOM 95049 O WAT 1343 32.464 49.000 117.733 1.00 0.00 O ATOM 95050 H1 WAT 1343 31.517 48.876 117.684 1.00 0.00 H ATOM 95051 H2 WAT 1343 32.678 48.850 118.654 1.00 0.00 H TER 95053 WAT 1343 ATOM 95053 O WAT 1344 15.377 32.517 129.990 1.00 0.00 O ATOM 95054 H1 WAT 1344 14.681 31.894 129.783 1.00 0.00 H ATOM 95055 H2 WAT 1344 16.183 32.005 129.928 1.00 0.00 H TER 95057 WAT 1344 ATOM 95057 O WAT 1345 81.885 118.116 84.683 1.00 0.00 O ATOM 95058 H1 WAT 1345 81.884 119.064 84.555 1.00 0.00 H ATOM 95059 H2 WAT 1345 80.971 117.856 84.562 1.00 0.00 H TER 95061 WAT 1345 ATOM 95061 O WAT 1346 81.007 72.593 121.910 1.00 0.00 O ATOM 95062 H1 WAT 1346 81.314 73.200 122.583 1.00 0.00 H ATOM 95063 H2 WAT 1346 81.747 72.005 121.762 1.00 0.00 H TER 95065 WAT 1346 ATOM 95065 O WAT 1347 126.077 43.801 110.172 1.00 0.00 O ATOM 95066 H1 WAT 1347 126.417 44.678 110.346 1.00 0.00 H ATOM 95067 H2 WAT 1347 125.126 43.900 110.210 1.00 0.00 H TER 95069 WAT 1347 ATOM 95069 O WAT 1348 46.318 52.695 153.097 1.00 0.00 O ATOM 95070 H1 WAT 1348 46.205 51.927 152.536 1.00 0.00 H ATOM 95071 H2 WAT 1348 45.585 53.267 152.869 1.00 0.00 H TER 95073 WAT 1348 ATOM 95073 O WAT 1349 7.545 138.320 5.154 1.00 0.00 O ATOM 95074 H1 WAT 1349 7.063 138.258 4.329 1.00 0.00 H ATOM 95075 H2 WAT 1349 8.371 137.867 4.983 1.00 0.00 H TER 95077 WAT 1349 ATOM 95077 O WAT 1350 35.420 37.025 150.338 1.00 0.00 O ATOM 95078 H1 WAT 1350 34.518 37.012 150.658 1.00 0.00 H ATOM 95079 H2 WAT 1350 35.447 36.340 149.670 1.00 0.00 H TER 95081 WAT 1350 ATOM 95081 O WAT 1351 36.977 145.073 124.590 1.00 0.00 O ATOM 95082 H1 WAT 1351 37.496 145.855 124.779 1.00 0.00 H ATOM 95083 H2 WAT 1351 37.031 144.552 125.391 1.00 0.00 H TER 95085 WAT 1351 ATOM 95085 O WAT 1352 131.375 39.965 156.626 1.00 0.00 O ATOM 95086 H1 WAT 1352 132.221 39.569 156.418 1.00 0.00 H ATOM 95087 H2 WAT 1352 131.309 40.714 156.034 1.00 0.00 H TER 95089 WAT 1352 ATOM 95089 O WAT 1353 62.530 54.184 109.433 1.00 0.00 O ATOM 95090 H1 WAT 1353 62.995 54.827 108.897 1.00 0.00 H ATOM 95091 H2 WAT 1353 63.087 54.066 110.202 1.00 0.00 H TER 95093 WAT 1353 ATOM 95093 O WAT 1354 121.953 82.619 22.093 1.00 0.00 O ATOM 95094 H1 WAT 1354 122.280 83.508 21.959 1.00 0.00 H ATOM 95095 H2 WAT 1354 121.851 82.541 23.042 1.00 0.00 H TER 95097 WAT 1354 ATOM 95097 O WAT 1355 87.905 13.318 102.254 1.00 0.00 O ATOM 95098 H1 WAT 1355 87.458 12.581 101.837 1.00 0.00 H ATOM 95099 H2 WAT 1355 87.280 13.641 102.903 1.00 0.00 H TER 95101 WAT 1355 ATOM 95101 O WAT 1356 72.099 73.944 10.730 1.00 0.00 O ATOM 95102 H1 WAT 1356 72.616 73.740 9.951 1.00 0.00 H ATOM 95103 H2 WAT 1356 71.830 73.091 11.070 1.00 0.00 H TER 95105 WAT 1356 ATOM 95105 O WAT 1357 64.329 1.087 72.948 1.00 0.00 O ATOM 95106 H1 WAT 1357 64.777 0.461 73.518 1.00 0.00 H ATOM 95107 H2 WAT 1357 65.036 1.536 72.484 1.00 0.00 H TER 95109 WAT 1357 ATOM 95109 O WAT 1358 12.265 25.143 130.052 1.00 0.00 O ATOM 95110 H1 WAT 1358 12.732 25.676 129.409 1.00 0.00 H ATOM 95111 H2 WAT 1358 11.845 25.779 130.630 1.00 0.00 H TER 95113 WAT 1358 ATOM 95113 O WAT 1359 132.723 53.426 87.369 1.00 0.00 O ATOM 95114 H1 WAT 1359 132.886 54.036 86.650 1.00 0.00 H ATOM 95115 H2 WAT 1359 133.280 52.672 87.174 1.00 0.00 H TER 95117 WAT 1359 ATOM 95117 O WAT 1360 124.278 131.394 83.428 1.00 0.00 O ATOM 95118 H1 WAT 1360 125.227 131.298 83.509 1.00 0.00 H ATOM 95119 H2 WAT 1360 123.984 131.623 84.309 1.00 0.00 H TER 95121 WAT 1360 ATOM 95121 O WAT 1361 137.431 66.423 130.651 1.00 0.00 O ATOM 95122 H1 WAT 1361 137.335 66.902 129.828 1.00 0.00 H ATOM 95123 H2 WAT 1361 138.327 66.608 130.933 1.00 0.00 H TER 95125 WAT 1361 ATOM 95125 O WAT 1362 124.447 60.038 75.035 1.00 0.00 O ATOM 95126 H1 WAT 1362 124.329 59.137 75.336 1.00 0.00 H ATOM 95127 H2 WAT 1362 125.059 60.422 75.663 1.00 0.00 H TER 95129 WAT 1362 ATOM 95129 O WAT 1363 103.614 45.832 91.854 1.00 0.00 O ATOM 95130 H1 WAT 1363 103.191 46.578 91.429 1.00 0.00 H ATOM 95131 H2 WAT 1363 104.432 45.713 91.371 1.00 0.00 H TER 95133 WAT 1363 ATOM 95133 O WAT 1364 108.529 5.902 91.597 1.00 0.00 O ATOM 95134 H1 WAT 1364 109.373 6.349 91.660 1.00 0.00 H ATOM 95135 H2 WAT 1364 108.005 6.279 92.304 1.00 0.00 H TER 95137 WAT 1364 ATOM 95137 O WAT 1365 16.160 14.377 145.318 1.00 0.00 O ATOM 95138 H1 WAT 1365 15.209 14.293 145.373 1.00 0.00 H ATOM 95139 H2 WAT 1365 16.482 13.476 145.340 1.00 0.00 H TER 95141 WAT 1365 ATOM 95141 O WAT 1366 129.583 127.300 100.385 1.00 0.00 O ATOM 95142 H1 WAT 1366 129.062 128.040 100.699 1.00 0.00 H ATOM 95143 H2 WAT 1366 128.936 126.673 100.061 1.00 0.00 H TER 95145 WAT 1366 ATOM 95145 O WAT 1367 78.792 75.597 155.709 1.00 0.00 O ATOM 95146 H1 WAT 1367 78.381 76.288 156.228 1.00 0.00 H ATOM 95147 H2 WAT 1367 78.058 75.127 155.312 1.00 0.00 H TER 95149 WAT 1367 ATOM 95149 O WAT 1368 129.407 95.721 110.243 1.00 0.00 O ATOM 95150 H1 WAT 1368 130.075 95.067 110.035 1.00 0.00 H ATOM 95151 H2 WAT 1368 128.954 95.365 111.008 1.00 0.00 H TER 95153 WAT 1368 ATOM 95153 O WAT 1369 84.829 134.369 17.293 1.00 0.00 O ATOM 95154 H1 WAT 1369 84.190 135.071 17.415 1.00 0.00 H ATOM 95155 H2 WAT 1369 84.797 133.872 18.111 1.00 0.00 H TER 95157 WAT 1369 ATOM 95157 O WAT 1370 100.148 48.385 134.898 1.00 0.00 O ATOM 95158 H1 WAT 1370 99.663 48.868 135.567 1.00 0.00 H ATOM 95159 H2 WAT 1370 100.637 47.723 135.388 1.00 0.00 H TER 95161 WAT 1370 ATOM 95161 O WAT 1371 121.150 2.459 111.101 1.00 0.00 O ATOM 95162 H1 WAT 1371 120.245 2.276 111.352 1.00 0.00 H ATOM 95163 H2 WAT 1371 121.231 2.098 110.218 1.00 0.00 H TER 95165 WAT 1371 ATOM 95165 O WAT 1372 40.736 2.697 147.498 1.00 0.00 O ATOM 95166 H1 WAT 1372 41.106 2.888 148.360 1.00 0.00 H ATOM 95167 H2 WAT 1372 40.830 3.515 147.010 1.00 0.00 H TER 95169 WAT 1372 ATOM 95169 O WAT 1373 56.945 9.950 127.826 1.00 0.00 O ATOM 95170 H1 WAT 1373 56.063 9.627 127.642 1.00 0.00 H ATOM 95171 H2 WAT 1373 57.309 10.157 126.965 1.00 0.00 H TER 95173 WAT 1373 ATOM 95173 O WAT 1374 18.558 120.016 128.325 1.00 0.00 O ATOM 95174 H1 WAT 1374 18.933 119.423 127.674 1.00 0.00 H ATOM 95175 H2 WAT 1374 17.896 119.491 128.774 1.00 0.00 H TER 95177 WAT 1374 ATOM 95177 O WAT 1375 40.531 47.502 8.964 1.00 0.00 O ATOM 95178 H1 WAT 1375 41.112 47.615 9.717 1.00 0.00 H ATOM 95179 H2 WAT 1375 39.728 47.135 9.335 1.00 0.00 H TER 95181 WAT 1375 ATOM 95181 O WAT 1376 51.016 66.792 143.938 1.00 0.00 O ATOM 95182 H1 WAT 1376 50.417 66.773 143.192 1.00 0.00 H ATOM 95183 H2 WAT 1376 51.603 66.050 143.793 1.00 0.00 H TER 95185 WAT 1376 ATOM 95185 O WAT 1377 41.373 48.510 138.011 1.00 0.00 O ATOM 95186 H1 WAT 1377 40.418 48.437 138.007 1.00 0.00 H ATOM 95187 H2 WAT 1377 41.682 47.605 137.966 1.00 0.00 H TER 95189 WAT 1377 ATOM 95189 O WAT 1378 38.575 46.868 6.608 1.00 0.00 O ATOM 95190 H1 WAT 1378 37.905 47.551 6.656 1.00 0.00 H ATOM 95191 H2 WAT 1378 39.399 47.347 6.521 1.00 0.00 H TER 95193 WAT 1378 ATOM 95193 O WAT 1379 108.399 111.734 135.096 1.00 0.00 O ATOM 95194 H1 WAT 1379 109.300 111.544 134.835 1.00 0.00 H ATOM 95195 H2 WAT 1379 107.874 111.504 134.330 1.00 0.00 H TER 95197 WAT 1379 ATOM 95197 O WAT 1380 102.262 26.817 136.985 1.00 0.00 O ATOM 95198 H1 WAT 1380 102.839 26.330 136.396 1.00 0.00 H ATOM 95199 H2 WAT 1380 102.220 27.695 136.606 1.00 0.00 H TER 95201 WAT 1380 ATOM 95201 O WAT 1381 61.344 128.309 102.087 1.00 0.00 O ATOM 95202 H1 WAT 1381 61.676 127.413 102.016 1.00 0.00 H ATOM 95203 H2 WAT 1381 61.241 128.598 101.180 1.00 0.00 H TER 95205 WAT 1381 ATOM 95205 O WAT 1382 35.816 57.540 77.548 1.00 0.00 O ATOM 95206 H1 WAT 1382 35.063 57.323 78.097 1.00 0.00 H ATOM 95207 H2 WAT 1382 35.499 58.234 76.971 1.00 0.00 H TER 95209 WAT 1382 ATOM 95209 O WAT 1383 106.630 129.290 158.637 1.00 0.00 O ATOM 95210 H1 WAT 1383 107.203 130.014 158.893 1.00 0.00 H ATOM 95211 H2 WAT 1383 107.216 128.655 158.225 1.00 0.00 H TER 95213 WAT 1383 ATOM 95213 O WAT 1384 81.938 76.961 94.514 1.00 0.00 O ATOM 95214 H1 WAT 1384 82.107 77.884 94.702 1.00 0.00 H ATOM 95215 H2 WAT 1384 82.794 76.540 94.592 1.00 0.00 H TER 95217 WAT 1384 ATOM 95217 O WAT 1385 54.878 53.747 108.314 1.00 0.00 O ATOM 95218 H1 WAT 1385 54.778 53.980 107.391 1.00 0.00 H ATOM 95219 H2 WAT 1385 55.331 54.496 108.702 1.00 0.00 H TER 95221 WAT 1385 ATOM 95221 O WAT 1386 92.072 114.019 86.842 1.00 0.00 O ATOM 95222 H1 WAT 1386 92.851 114.060 87.397 1.00 0.00 H ATOM 95223 H2 WAT 1386 92.416 113.915 85.955 1.00 0.00 H TER 95225 WAT 1386 ATOM 95225 O WAT 1387 106.273 78.451 142.909 1.00 0.00 O ATOM 95226 H1 WAT 1387 106.082 79.389 142.929 1.00 0.00 H ATOM 95227 H2 WAT 1387 105.551 78.071 142.408 1.00 0.00 H TER 95229 WAT 1387 ATOM 95229 O WAT 1388 2.047 4.733 86.184 1.00 0.00 O ATOM 95230 H1 WAT 1388 1.894 5.313 85.438 1.00 0.00 H ATOM 95231 H2 WAT 1388 1.251 4.804 86.710 1.00 0.00 H TER 95233 WAT 1388 ATOM 95233 O WAT 1389 93.656 97.205 147.094 1.00 0.00 O ATOM 95234 H1 WAT 1389 93.306 98.017 147.463 1.00 0.00 H ATOM 95235 H2 WAT 1389 92.884 96.729 146.789 1.00 0.00 H TER 95237 WAT 1389 ATOM 95237 O WAT 1390 101.296 60.556 152.244 1.00 0.00 O ATOM 95238 H1 WAT 1390 100.900 59.773 152.627 1.00 0.00 H ATOM 95239 H2 WAT 1390 102.232 60.460 152.416 1.00 0.00 H TER 95241 WAT 1390 ATOM 95241 O WAT 1391 37.514 12.240 87.146 1.00 0.00 O ATOM 95242 H1 WAT 1391 38.378 12.522 87.446 1.00 0.00 H ATOM 95243 H2 WAT 1391 36.988 12.189 87.945 1.00 0.00 H TER 95245 WAT 1391 ATOM 95245 O WAT 1392 39.368 2.721 13.082 1.00 0.00 O ATOM 95246 H1 WAT 1392 38.411 2.734 13.057 1.00 0.00 H ATOM 95247 H2 WAT 1392 39.627 3.581 12.752 1.00 0.00 H TER 95249 WAT 1392 ATOM 95249 O WAT 1393 54.900 77.024 130.798 1.00 0.00 O ATOM 95250 H1 WAT 1393 54.655 77.921 130.572 1.00 0.00 H ATOM 95251 H2 WAT 1393 55.816 77.086 131.067 1.00 0.00 H TER 95253 WAT 1393 ATOM 95253 O WAT 1394 56.636 52.533 64.291 1.00 0.00 O ATOM 95254 H1 WAT 1394 55.732 52.845 64.296 1.00 0.00 H ATOM 95255 H2 WAT 1394 57.155 53.304 64.060 1.00 0.00 H TER 95257 WAT 1394 ATOM 95257 O WAT 1395 86.953 100.365 26.816 1.00 0.00 O ATOM 95258 H1 WAT 1395 86.516 100.814 27.540 1.00 0.00 H ATOM 95259 H2 WAT 1395 86.427 99.579 26.669 1.00 0.00 H TER 95261 WAT 1395 ATOM 95261 O WAT 1396 21.358 2.896 93.728 1.00 0.00 O ATOM 95262 H1 WAT 1396 21.633 1.988 93.854 1.00 0.00 H ATOM 95263 H2 WAT 1396 20.570 2.835 93.188 1.00 0.00 H TER 95265 WAT 1396 ATOM 95265 O WAT 1397 42.821 93.498 16.880 1.00 0.00 O ATOM 95266 H1 WAT 1397 43.325 93.045 16.203 1.00 0.00 H ATOM 95267 H2 WAT 1397 42.844 94.419 16.620 1.00 0.00 H TER 95269 WAT 1397 ATOM 95269 O WAT 1398 145.229 120.423 84.854 1.00 0.00 O ATOM 95270 H1 WAT 1398 145.917 121.076 84.724 1.00 0.00 H ATOM 95271 H2 WAT 1398 144.672 120.505 84.080 1.00 0.00 H TER 95273 WAT 1398 ATOM 95273 O WAT 1399 34.696 115.413 105.422 1.00 0.00 O ATOM 95274 H1 WAT 1399 34.999 114.546 105.695 1.00 0.00 H ATOM 95275 H2 WAT 1399 33.764 115.294 105.239 1.00 0.00 H TER 95277 WAT 1399 ATOM 95277 O WAT 1400 25.297 61.591 121.236 1.00 0.00 O ATOM 95278 H1 WAT 1400 25.046 62.436 121.609 1.00 0.00 H ATOM 95279 H2 WAT 1400 26.001 61.278 121.805 1.00 0.00 H TER 95281 WAT 1400 ATOM 95281 O WAT 1401 83.009 125.990 110.935 1.00 0.00 O ATOM 95282 H1 WAT 1401 82.924 125.721 110.020 1.00 0.00 H ATOM 95283 H2 WAT 1401 83.545 126.782 110.902 1.00 0.00 H TER 95285 WAT 1401 ATOM 95285 O WAT 1402 75.769 21.896 150.708 1.00 0.00 O ATOM 95286 H1 WAT 1402 75.833 22.106 149.776 1.00 0.00 H ATOM 95287 H2 WAT 1402 75.305 22.641 151.090 1.00 0.00 H TER 95289 WAT 1402 ATOM 95289 O WAT 1403 67.851 135.093 56.588 1.00 0.00 O ATOM 95290 H1 WAT 1403 66.915 135.286 56.531 1.00 0.00 H ATOM 95291 H2 WAT 1403 68.222 135.839 57.059 1.00 0.00 H TER 95293 WAT 1403 ATOM 95293 O WAT 1404 0.363 91.999 144.413 1.00 0.00 O ATOM 95294 H1 WAT 1404 0.605 92.485 143.625 1.00 0.00 H ATOM 95295 H2 WAT 1404 1.152 91.508 144.643 1.00 0.00 H TER 95297 WAT 1404 ATOM 95297 O WAT 1405 14.182 30.096 152.829 1.00 0.00 O ATOM 95298 H1 WAT 1405 15.039 29.712 153.015 1.00 0.00 H ATOM 95299 H2 WAT 1405 13.598 29.704 153.478 1.00 0.00 H TER 95301 WAT 1405 ATOM 95301 O WAT 1406 6.453 139.013 20.320 1.00 0.00 O ATOM 95302 H1 WAT 1406 5.756 139.511 19.893 1.00 0.00 H ATOM 95303 H2 WAT 1406 6.482 139.359 21.212 1.00 0.00 H TER 95305 WAT 1406 ATOM 95305 O WAT 1407 53.596 6.403 128.999 1.00 0.00 O ATOM 95306 H1 WAT 1407 52.714 6.769 129.063 1.00 0.00 H ATOM 95307 H2 WAT 1407 53.679 6.133 128.085 1.00 0.00 H TER 95309 WAT 1407 ATOM 95309 O WAT 1408 132.855 44.394 7.985 1.00 0.00 O ATOM 95310 H1 WAT 1408 131.972 44.756 7.910 1.00 0.00 H ATOM 95311 H2 WAT 1408 133.417 45.157 8.114 1.00 0.00 H TER 95313 WAT 1408 ATOM 95313 O WAT 1409 109.500 19.927 74.249 1.00 0.00 O ATOM 95314 H1 WAT 1409 109.071 20.042 73.400 1.00 0.00 H ATOM 95315 H2 WAT 1409 109.314 19.019 74.489 1.00 0.00 H TER 95317 WAT 1409 ATOM 95317 O WAT 1410 41.058 88.775 136.566 1.00 0.00 O ATOM 95318 H1 WAT 1410 40.610 88.178 135.967 1.00 0.00 H ATOM 95319 H2 WAT 1410 41.988 88.592 136.436 1.00 0.00 H TER 95321 WAT 1410 ATOM 95321 O WAT 1411 133.811 57.421 -0.215 1.00 0.00 O ATOM 95322 H1 WAT 1411 133.419 56.804 0.402 1.00 0.00 H ATOM 95323 H2 WAT 1411 133.832 58.253 0.259 1.00 0.00 H TER 95325 WAT 1411 ATOM 95325 O WAT 1412 141.851 102.109 144.813 1.00 0.00 O ATOM 95326 H1 WAT 1412 142.801 102.148 144.708 1.00 0.00 H ATOM 95327 H2 WAT 1412 141.707 102.251 145.748 1.00 0.00 H TER 95329 WAT 1412 ATOM 95329 O WAT 1413 102.283 142.787 100.014 1.00 0.00 O ATOM 95330 H1 WAT 1413 102.770 143.588 99.821 1.00 0.00 H ATOM 95331 H2 WAT 1413 102.942 142.094 99.988 1.00 0.00 H TER 95333 WAT 1413 ATOM 95333 O WAT 1414 45.077 71.640 15.718 1.00 0.00 O ATOM 95334 H1 WAT 1414 45.961 71.752 16.067 1.00 0.00 H ATOM 95335 H2 WAT 1414 45.182 71.723 14.770 1.00 0.00 H TER 95337 WAT 1414 ATOM 95337 O WAT 1415 126.432 85.789 17.219 1.00 0.00 O ATOM 95338 H1 WAT 1415 126.532 85.453 18.110 1.00 0.00 H ATOM 95339 H2 WAT 1415 125.485 85.822 17.081 1.00 0.00 H TER 95341 WAT 1415 ATOM 95341 O WAT 1416 140.729 33.495 70.102 1.00 0.00 O ATOM 95342 H1 WAT 1416 139.956 34.059 70.131 1.00 0.00 H ATOM 95343 H2 WAT 1416 141.165 33.728 69.282 1.00 0.00 H TER 95345 WAT 1416 ATOM 95345 O WAT 1417 120.636 59.447 96.962 1.00 0.00 O ATOM 95346 H1 WAT 1417 120.470 60.331 96.633 1.00 0.00 H ATOM 95347 H2 WAT 1417 121.503 59.500 97.364 1.00 0.00 H TER 95349 WAT 1417 ATOM 95349 O WAT 1418 129.610 3.129 100.233 1.00 0.00 O ATOM 95350 H1 WAT 1418 129.621 3.129 99.276 1.00 0.00 H ATOM 95351 H2 WAT 1418 128.794 2.685 100.464 1.00 0.00 H TER 95353 WAT 1418 ATOM 95353 O WAT 1419 60.691 80.989 9.938 1.00 0.00 O ATOM 95354 H1 WAT 1419 60.448 81.522 10.695 1.00 0.00 H ATOM 95355 H2 WAT 1419 60.309 80.130 10.117 1.00 0.00 H TER 95357 WAT 1419 ATOM 95357 O WAT 1420 74.282 127.291 113.214 1.00 0.00 O ATOM 95358 H1 WAT 1420 74.503 128.114 112.778 1.00 0.00 H ATOM 95359 H2 WAT 1420 73.637 126.881 112.637 1.00 0.00 H TER 95361 WAT 1420 ATOM 95361 O WAT 1421 26.563 56.993 152.750 1.00 0.00 O ATOM 95362 H1 WAT 1421 26.323 57.853 152.404 1.00 0.00 H ATOM 95363 H2 WAT 1421 26.497 57.090 153.700 1.00 0.00 H TER 95365 WAT 1421 ATOM 95365 O WAT 1422 99.143 74.631 16.809 1.00 0.00 O ATOM 95366 H1 WAT 1422 99.367 73.775 16.444 1.00 0.00 H ATOM 95367 H2 WAT 1422 99.966 75.120 16.795 1.00 0.00 H TER 95369 WAT 1422 ATOM 95369 O WAT 1423 107.569 30.259 76.779 1.00 0.00 O ATOM 95370 H1 WAT 1423 106.824 29.661 76.710 1.00 0.00 H ATOM 95371 H2 WAT 1423 108.316 29.691 76.965 1.00 0.00 H TER 95373 WAT 1423 ATOM 95373 O WAT 1424 122.399 115.122 12.683 1.00 0.00 O ATOM 95374 H1 WAT 1424 122.783 114.546 12.022 1.00 0.00 H ATOM 95375 H2 WAT 1424 121.892 115.760 12.179 1.00 0.00 H TER 95377 WAT 1424 ATOM 95377 O WAT 1425 5.346 64.368 17.100 1.00 0.00 O ATOM 95378 H1 WAT 1425 6.112 64.842 16.777 1.00 0.00 H ATOM 95379 H2 WAT 1425 4.958 64.955 17.750 1.00 0.00 H TER 95381 WAT 1425 ATOM 95381 O WAT 1426 100.098 101.169 94.899 1.00 0.00 O ATOM 95382 H1 WAT 1426 100.595 100.506 95.377 1.00 0.00 H ATOM 95383 H2 WAT 1426 99.727 101.729 95.581 1.00 0.00 H TER 95385 WAT 1426 ATOM 95385 O WAT 1427 28.939 35.803 67.109 1.00 0.00 O ATOM 95386 H1 WAT 1427 28.822 34.891 67.375 1.00 0.00 H ATOM 95387 H2 WAT 1427 28.075 36.076 66.800 1.00 0.00 H TER 95389 WAT 1427 ATOM 95389 O WAT 1428 134.778 44.840 60.371 1.00 0.00 O ATOM 95390 H1 WAT 1428 133.871 45.053 60.152 1.00 0.00 H ATOM 95391 H2 WAT 1428 135.219 45.689 60.415 1.00 0.00 H TER 95393 WAT 1428 ATOM 95393 O WAT 1429 79.951 113.286 57.040 1.00 0.00 O ATOM 95394 H1 WAT 1429 80.144 112.752 56.269 1.00 0.00 H ATOM 95395 H2 WAT 1429 80.800 113.641 57.304 1.00 0.00 H TER 95397 WAT 1429 ATOM 95397 O WAT 1430 62.852 123.628 139.637 1.00 0.00 O ATOM 95398 H1 WAT 1430 63.531 123.600 140.311 1.00 0.00 H ATOM 95399 H2 WAT 1430 63.182 123.061 138.940 1.00 0.00 H TER 95401 WAT 1430 ATOM 95401 O WAT 1431 65.867 108.301 139.352 1.00 0.00 O ATOM 95402 H1 WAT 1431 65.280 108.328 140.108 1.00 0.00 H ATOM 95403 H2 WAT 1431 66.745 108.267 139.731 1.00 0.00 H TER 95405 WAT 1431 ATOM 95405 O WAT 1432 116.967 103.276 4.121 1.00 0.00 O ATOM 95406 H1 WAT 1432 116.244 103.342 3.498 1.00 0.00 H ATOM 95407 H2 WAT 1432 116.542 103.193 4.974 1.00 0.00 H TER 95409 WAT 1432 ATOM 95409 O WAT 1433 36.860 18.502 15.832 1.00 0.00 O ATOM 95410 H1 WAT 1433 37.104 18.937 15.015 1.00 0.00 H ATOM 95411 H2 WAT 1433 37.678 18.442 16.325 1.00 0.00 H TER 95413 WAT 1433 ATOM 95413 O WAT 1434 0.292 3.588 107.118 1.00 0.00 O ATOM 95414 H1 WAT 1434 0.783 3.581 107.939 1.00 0.00 H ATOM 95415 H2 WAT 1434 -0.481 4.121 107.305 1.00 0.00 H TER 95417 WAT 1434 ATOM 95417 O WAT 1435 107.357 118.402 106.314 1.00 0.00 O ATOM 95418 H1 WAT 1435 106.469 118.706 106.126 1.00 0.00 H ATOM 95419 H2 WAT 1435 107.235 117.546 106.724 1.00 0.00 H TER 95421 WAT 1435 ATOM 95421 O WAT 1436 56.192 113.742 93.493 1.00 0.00 O ATOM 95422 H1 WAT 1436 56.326 114.049 94.390 1.00 0.00 H ATOM 95423 H2 WAT 1436 57.076 113.616 93.148 1.00 0.00 H TER 95425 WAT 1436 ATOM 95425 O WAT 1437 10.582 129.684 64.643 1.00 0.00 O ATOM 95426 H1 WAT 1437 11.511 129.533 64.468 1.00 0.00 H ATOM 95427 H2 WAT 1437 10.131 129.297 63.892 1.00 0.00 H TER 95429 WAT 1437 ATOM 95429 O WAT 1438 8.095 11.882 136.938 1.00 0.00 O ATOM 95430 H1 WAT 1438 7.946 11.804 137.880 1.00 0.00 H ATOM 95431 H2 WAT 1438 8.041 12.821 136.764 1.00 0.00 H TER 95433 WAT 1438 ATOM 95433 O WAT 1439 49.926 132.937 148.502 1.00 0.00 O ATOM 95434 H1 WAT 1439 49.769 133.861 148.305 1.00 0.00 H ATOM 95435 H2 WAT 1439 49.059 132.534 148.469 1.00 0.00 H TER 95437 WAT 1439 ATOM 95437 O WAT 1440 102.699 29.244 78.418 1.00 0.00 O ATOM 95438 H1 WAT 1440 102.898 29.837 79.143 1.00 0.00 H ATOM 95439 H2 WAT 1440 103.555 28.953 78.104 1.00 0.00 H TER 95441 WAT 1440 ATOM 95441 O WAT 1441 25.829 142.207 116.331 1.00 0.00 O ATOM 95442 H1 WAT 1441 25.278 141.598 116.823 1.00 0.00 H ATOM 95443 H2 WAT 1441 25.673 143.057 116.742 1.00 0.00 H TER 95445 WAT 1441 ATOM 95445 O WAT 1442 142.637 145.630 157.990 1.00 0.00 O ATOM 95446 H1 WAT 1442 142.768 144.942 158.643 1.00 0.00 H ATOM 95447 H2 WAT 1442 141.687 145.685 157.887 1.00 0.00 H TER 95449 WAT 1442 ATOM 95449 O WAT 1443 76.911 33.971 11.459 1.00 0.00 O ATOM 95450 H1 WAT 1443 75.984 34.159 11.604 1.00 0.00 H ATOM 95451 H2 WAT 1443 76.916 33.128 11.005 1.00 0.00 H TER 95453 WAT 1443 ATOM 95453 O WAT 1444 122.532 4.932 121.949 1.00 0.00 O ATOM 95454 H1 WAT 1444 122.745 4.893 122.881 1.00 0.00 H ATOM 95455 H2 WAT 1444 121.818 5.567 121.892 1.00 0.00 H TER 95457 WAT 1444 ATOM 95457 O WAT 1445 107.135 107.362 120.377 1.00 0.00 O ATOM 95458 H1 WAT 1445 107.235 107.992 119.664 1.00 0.00 H ATOM 95459 H2 WAT 1445 107.424 107.835 121.157 1.00 0.00 H TER 95461 WAT 1445 ATOM 95461 O WAT 1446 29.864 60.543 89.114 1.00 0.00 O ATOM 95462 H1 WAT 1446 30.666 60.084 88.864 1.00 0.00 H ATOM 95463 H2 WAT 1446 30.055 61.467 88.948 1.00 0.00 H TER 95465 WAT 1446 ATOM 95465 O WAT 1447 62.919 75.726 104.976 1.00 0.00 O ATOM 95466 H1 WAT 1447 62.751 76.615 105.291 1.00 0.00 H ATOM 95467 H2 WAT 1447 63.873 75.665 104.928 1.00 0.00 H TER 95469 WAT 1447 ATOM 95469 O WAT 1448 16.219 109.676 25.089 1.00 0.00 O ATOM 95470 H1 WAT 1448 16.186 110.490 24.587 1.00 0.00 H ATOM 95471 H2 WAT 1448 16.235 108.986 24.426 1.00 0.00 H TER 95473 WAT 1448 ATOM 95473 O WAT 1449 70.082 129.594 87.255 1.00 0.00 O ATOM 95474 H1 WAT 1449 69.912 128.982 87.971 1.00 0.00 H ATOM 95475 H2 WAT 1449 69.216 129.795 86.901 1.00 0.00 H TER 95477 WAT 1449 ATOM 95477 O WAT 1450 75.064 10.545 15.048 1.00 0.00 O ATOM 95478 H1 WAT 1450 74.431 11.260 14.986 1.00 0.00 H ATOM 95479 H2 WAT 1450 75.473 10.661 15.905 1.00 0.00 H TER 95481 WAT 1450 ATOM 95481 O WAT 1451 123.142 59.267 83.971 1.00 0.00 O ATOM 95482 H1 WAT 1451 123.685 59.442 84.739 1.00 0.00 H ATOM 95483 H2 WAT 1451 122.769 60.119 83.743 1.00 0.00 H TER 95485 WAT 1451 ATOM 95485 O WAT 1452 39.840 77.013 76.957 1.00 0.00 O ATOM 95486 H1 WAT 1452 40.006 76.153 76.570 1.00 0.00 H ATOM 95487 H2 WAT 1452 39.484 76.821 77.825 1.00 0.00 H TER 95489 WAT 1452 ATOM 95489 O WAT 1453 36.183 143.297 4.793 1.00 0.00 O ATOM 95490 H1 WAT 1453 36.775 142.649 4.411 1.00 0.00 H ATOM 95491 H2 WAT 1453 35.706 143.656 4.045 1.00 0.00 H TER 95493 WAT 1453 ATOM 95493 O WAT 1454 70.010 129.287 92.834 1.00 0.00 O ATOM 95494 H1 WAT 1454 69.105 128.984 92.761 1.00 0.00 H ATOM 95495 H2 WAT 1454 69.937 130.182 93.166 1.00 0.00 H TER 95497 WAT 1454 ATOM 95497 O WAT 1455 58.420 96.958 75.830 1.00 0.00 O ATOM 95498 H1 WAT 1455 58.099 97.595 76.468 1.00 0.00 H ATOM 95499 H2 WAT 1455 57.649 96.436 75.605 1.00 0.00 H TER 95501 WAT 1455 ATOM 95501 O WAT 1456 70.691 36.155 12.647 1.00 0.00 O ATOM 95502 H1 WAT 1456 70.295 37.025 12.594 1.00 0.00 H ATOM 95503 H2 WAT 1456 70.040 35.623 13.104 1.00 0.00 H TER 95505 WAT 1456 ATOM 95505 O WAT 1457 43.681 130.096 79.997 1.00 0.00 O ATOM 95506 H1 WAT 1457 43.993 130.041 79.094 1.00 0.00 H ATOM 95507 H2 WAT 1457 43.558 131.033 80.151 1.00 0.00 H TER 95509 WAT 1457 ATOM 95509 O WAT 1458 77.727 61.240 91.800 1.00 0.00 O ATOM 95510 H1 WAT 1458 77.594 60.761 90.982 1.00 0.00 H ATOM 95511 H2 WAT 1458 77.349 60.674 92.474 1.00 0.00 H TER 95513 WAT 1458 ATOM 95513 O WAT 1459 5.956 39.760 89.944 1.00 0.00 O ATOM 95514 H1 WAT 1459 5.090 39.709 89.540 1.00 0.00 H ATOM 95515 H2 WAT 1459 5.783 40.011 90.851 1.00 0.00 H TER 95517 WAT 1459 ATOM 95517 O WAT 1460 71.501 89.599 128.462 1.00 0.00 O ATOM 95518 H1 WAT 1460 72.020 89.059 129.057 1.00 0.00 H ATOM 95519 H2 WAT 1460 72.146 90.000 127.879 1.00 0.00 H TER 95521 WAT 1460 ATOM 95521 O WAT 1461 119.893 87.401 88.282 1.00 0.00 O ATOM 95522 H1 WAT 1461 119.937 86.497 88.596 1.00 0.00 H ATOM 95523 H2 WAT 1461 120.715 87.531 87.810 1.00 0.00 H TER 95525 WAT 1461 ATOM 95525 O WAT 1462 140.485 46.566 122.407 1.00 0.00 O ATOM 95526 H1 WAT 1462 140.802 46.292 123.268 1.00 0.00 H ATOM 95527 H2 WAT 1462 139.829 45.909 122.173 1.00 0.00 H TER 95529 WAT 1462 ATOM 95529 O WAT 1463 143.294 82.249 60.874 1.00 0.00 O ATOM 95530 H1 WAT 1463 143.998 82.898 60.892 1.00 0.00 H ATOM 95531 H2 WAT 1463 142.599 82.665 60.365 1.00 0.00 H TER 95533 WAT 1463 ATOM 95533 O WAT 1464 129.033 94.175 139.529 1.00 0.00 O ATOM 95534 H1 WAT 1464 129.899 94.448 139.835 1.00 0.00 H ATOM 95535 H2 WAT 1464 129.115 93.232 139.388 1.00 0.00 H TER 95537 WAT 1464 ATOM 95537 O WAT 1465 132.104 13.529 114.457 1.00 0.00 O ATOM 95538 H1 WAT 1465 131.926 13.861 115.337 1.00 0.00 H ATOM 95539 H2 WAT 1465 131.836 12.611 114.488 1.00 0.00 H TER 95541 WAT 1465 ATOM 95541 O WAT 1466 94.150 37.879 89.503 1.00 0.00 O ATOM 95542 H1 WAT 1466 94.620 37.980 88.675 1.00 0.00 H ATOM 95543 H2 WAT 1466 93.546 37.153 89.347 1.00 0.00 H TER 95545 WAT 1466 ATOM 95545 O WAT 1467 15.020 68.362 150.456 1.00 0.00 O ATOM 95546 H1 WAT 1467 14.410 69.092 150.558 1.00 0.00 H ATOM 95547 H2 WAT 1467 14.829 67.785 151.195 1.00 0.00 H TER 95549 WAT 1467 ATOM 95549 O WAT 1468 84.133 96.192 76.657 1.00 0.00 O ATOM 95550 H1 WAT 1468 83.614 95.388 76.636 1.00 0.00 H ATOM 95551 H2 WAT 1468 83.522 96.879 76.391 1.00 0.00 H TER 95553 WAT 1468 ATOM 95553 O WAT 1469 95.469 79.024 20.373 1.00 0.00 O ATOM 95554 H1 WAT 1469 94.738 78.406 20.387 1.00 0.00 H ATOM 95555 H2 WAT 1469 95.799 78.984 19.475 1.00 0.00 H TER 95557 WAT 1469 ATOM 95557 O WAT 1470 85.034 98.167 152.958 1.00 0.00 O ATOM 95558 H1 WAT 1470 84.751 99.067 153.123 1.00 0.00 H ATOM 95559 H2 WAT 1470 85.125 98.115 152.006 1.00 0.00 H TER 95561 WAT 1470 ATOM 95561 O WAT 1471 52.563 7.574 71.399 1.00 0.00 O ATOM 95562 H1 WAT 1471 52.413 6.691 71.735 1.00 0.00 H ATOM 95563 H2 WAT 1471 52.988 7.440 70.552 1.00 0.00 H TER 95565 WAT 1471 ATOM 95565 O WAT 1472 19.912 18.544 12.745 1.00 0.00 O ATOM 95566 H1 WAT 1472 19.404 18.691 13.543 1.00 0.00 H ATOM 95567 H2 WAT 1472 19.658 17.666 12.458 1.00 0.00 H TER 95569 WAT 1472 ATOM 95569 O WAT 1473 49.043 96.609 3.365 1.00 0.00 O ATOM 95570 H1 WAT 1473 48.786 96.184 2.547 1.00 0.00 H ATOM 95571 H2 WAT 1473 48.877 97.540 3.213 1.00 0.00 H TER 95573 WAT 1473 ATOM 95573 O WAT 1474 83.769 32.127 114.755 1.00 0.00 O ATOM 95574 H1 WAT 1474 83.761 32.855 115.377 1.00 0.00 H ATOM 95575 H2 WAT 1474 84.131 32.503 113.952 1.00 0.00 H TER 95577 WAT 1474 ATOM 95577 O WAT 1475 70.112 118.970 88.116 1.00 0.00 O ATOM 95578 H1 WAT 1475 69.485 118.596 88.735 1.00 0.00 H ATOM 95579 H2 WAT 1475 69.650 119.713 87.727 1.00 0.00 H TER 95581 WAT 1475 ATOM 95581 O WAT 1476 39.189 76.068 142.400 1.00 0.00 O ATOM 95582 H1 WAT 1476 39.511 76.680 141.740 1.00 0.00 H ATOM 95583 H2 WAT 1476 38.371 76.458 142.711 1.00 0.00 H TER 95585 WAT 1476 ATOM 95585 O WAT 1477 83.887 138.019 143.413 1.00 0.00 O ATOM 95586 H1 WAT 1477 83.652 137.984 144.340 1.00 0.00 H ATOM 95587 H2 WAT 1477 84.824 137.824 143.397 1.00 0.00 H TER 95589 WAT 1477 ATOM 95589 O WAT 1478 6.576 7.501 107.783 1.00 0.00 O ATOM 95590 H1 WAT 1478 6.387 6.932 108.529 1.00 0.00 H ATOM 95591 H2 WAT 1478 7.295 7.065 107.326 1.00 0.00 H TER 95593 WAT 1478 ATOM 95593 O WAT 1479 82.987 66.856 96.312 1.00 0.00 O ATOM 95594 H1 WAT 1479 82.837 67.764 96.048 1.00 0.00 H ATOM 95595 H2 WAT 1479 83.023 66.887 97.268 1.00 0.00 H TER 95597 WAT 1479 ATOM 95597 O WAT 1480 35.937 60.551 16.153 1.00 0.00 O ATOM 95598 H1 WAT 1480 36.756 60.071 16.275 1.00 0.00 H ATOM 95599 H2 WAT 1480 35.794 60.542 15.207 1.00 0.00 H TER 95601 WAT 1480 ATOM 95601 O WAT 1481 120.910 109.586 135.997 1.00 0.00 O ATOM 95602 H1 WAT 1481 120.501 109.445 135.143 1.00 0.00 H ATOM 95603 H2 WAT 1481 121.156 110.511 135.994 1.00 0.00 H TER 95605 WAT 1481 ATOM 95605 O WAT 1482 123.382 86.722 72.850 1.00 0.00 O ATOM 95606 H1 WAT 1482 122.557 86.246 72.952 1.00 0.00 H ATOM 95607 H2 WAT 1482 123.693 86.479 71.978 1.00 0.00 H TER 95609 WAT 1482 ATOM 95609 O WAT 1483 14.894 126.301 82.594 1.00 0.00 O ATOM 95610 H1 WAT 1483 15.748 125.918 82.396 1.00 0.00 H ATOM 95611 H2 WAT 1483 15.079 126.974 83.248 1.00 0.00 H TER 95613 WAT 1483 ATOM 95613 O WAT 1484 105.034 145.010 81.057 1.00 0.00 O ATOM 95614 H1 WAT 1484 105.773 144.825 80.478 1.00 0.00 H ATOM 95615 H2 WAT 1484 104.798 145.917 80.862 1.00 0.00 H TER 95617 WAT 1484 ATOM 95617 O WAT 1485 36.041 133.052 150.758 1.00 0.00 O ATOM 95618 H1 WAT 1485 36.654 133.288 150.062 1.00 0.00 H ATOM 95619 H2 WAT 1485 35.878 133.873 151.222 1.00 0.00 H TER 95621 WAT 1485 ATOM 95621 O WAT 1486 63.254 3.931 128.447 1.00 0.00 O ATOM 95622 H1 WAT 1486 63.632 3.251 129.003 1.00 0.00 H ATOM 95623 H2 WAT 1486 62.456 4.198 128.904 1.00 0.00 H TER 95625 WAT 1486 ATOM 95625 O WAT 1487 117.054 126.564 89.877 1.00 0.00 O ATOM 95626 H1 WAT 1487 116.605 126.311 89.070 1.00 0.00 H ATOM 95627 H2 WAT 1487 117.985 126.480 89.669 1.00 0.00 H TER 95629 WAT 1487 ATOM 95629 O WAT 1488 107.822 9.181 99.095 1.00 0.00 O ATOM 95630 H1 WAT 1488 107.204 8.809 99.724 1.00 0.00 H ATOM 95631 H2 WAT 1488 108.309 8.427 98.762 1.00 0.00 H TER 95633 WAT 1488 ATOM 95633 O WAT 1489 140.058 118.019 85.191 1.00 0.00 O ATOM 95634 H1 WAT 1489 140.815 117.595 84.786 1.00 0.00 H ATOM 95635 H2 WAT 1489 139.862 117.478 85.956 1.00 0.00 H TER 95637 WAT 1489 ATOM 95637 O WAT 1490 32.420 109.527 85.875 1.00 0.00 O ATOM 95638 H1 WAT 1490 31.940 109.002 86.516 1.00 0.00 H ATOM 95639 H2 WAT 1490 32.218 109.120 85.033 1.00 0.00 H TER 95641 WAT 1490 ATOM 95641 O WAT 1491 106.595 76.083 19.904 1.00 0.00 O ATOM 95642 H1 WAT 1491 106.813 75.640 20.725 1.00 0.00 H ATOM 95643 H2 WAT 1491 107.186 75.695 19.259 1.00 0.00 H TER 95645 WAT 1491 ATOM 95645 O WAT 1492 63.410 78.496 107.566 1.00 0.00 O ATOM 95646 H1 WAT 1492 62.927 77.801 108.013 1.00 0.00 H ATOM 95647 H2 WAT 1492 62.858 78.729 106.819 1.00 0.00 H TER 95649 WAT 1492 ATOM 95649 O WAT 1493 16.675 103.645 7.311 1.00 0.00 O ATOM 95650 H1 WAT 1493 16.568 102.694 7.317 1.00 0.00 H ATOM 95651 H2 WAT 1493 16.777 103.870 6.386 1.00 0.00 H TER 95653 WAT 1493 ATOM 95653 O WAT 1494 27.990 39.966 88.063 1.00 0.00 O ATOM 95654 H1 WAT 1494 27.944 39.935 87.108 1.00 0.00 H ATOM 95655 H2 WAT 1494 27.475 40.736 88.303 1.00 0.00 H TER 95657 WAT 1494 ATOM 95657 O WAT 1495 92.362 19.158 134.881 1.00 0.00 O ATOM 95658 H1 WAT 1495 92.830 18.492 134.378 1.00 0.00 H ATOM 95659 H2 WAT 1495 92.707 19.990 134.559 1.00 0.00 H TER 95661 WAT 1495 ATOM 95661 O WAT 1496 124.905 91.858 17.716 1.00 0.00 O ATOM 95662 H1 WAT 1496 125.506 92.087 18.425 1.00 0.00 H ATOM 95663 H2 WAT 1496 125.228 92.347 16.960 1.00 0.00 H TER 95665 WAT 1496 ATOM 95665 O WAT 1497 108.376 63.501 138.082 1.00 0.00 O ATOM 95666 H1 WAT 1497 108.137 63.441 139.007 1.00 0.00 H ATOM 95667 H2 WAT 1497 108.776 64.366 137.993 1.00 0.00 H TER 95669 WAT 1497 ATOM 95669 O WAT 1498 25.271 75.935 70.081 1.00 0.00 O ATOM 95670 H1 WAT 1498 24.460 75.509 70.358 1.00 0.00 H ATOM 95671 H2 WAT 1498 25.616 76.335 70.880 1.00 0.00 H TER 95673 WAT 1498 ATOM 95673 O WAT 1499 97.311 10.900 63.208 1.00 0.00 O ATOM 95674 H1 WAT 1499 97.490 11.679 63.733 1.00 0.00 H ATOM 95675 H2 WAT 1499 97.399 11.196 62.302 1.00 0.00 H TER 95677 WAT 1499 ATOM 95677 O WAT 1500 106.227 23.140 72.354 1.00 0.00 O ATOM 95678 H1 WAT 1500 106.043 23.098 71.415 1.00 0.00 H ATOM 95679 H2 WAT 1500 106.753 23.933 72.459 1.00 0.00 H TER 95681 WAT 1500 ATOM 95681 O WAT 1501 19.987 102.408 17.838 1.00 0.00 O ATOM 95682 H1 WAT 1501 20.430 101.607 17.555 1.00 0.00 H ATOM 95683 H2 WAT 1501 19.684 102.212 18.725 1.00 0.00 H TER 95685 WAT 1501 ATOM 95685 O WAT 1502 63.703 79.301 25.163 1.00 0.00 O ATOM 95686 H1 WAT 1502 64.591 79.199 25.505 1.00 0.00 H ATOM 95687 H2 WAT 1502 63.245 78.509 25.444 1.00 0.00 H TER 95689 WAT 1502 ATOM 95689 O WAT 1503 65.252 113.923 145.903 1.00 0.00 O ATOM 95690 H1 WAT 1503 64.572 113.281 145.699 1.00 0.00 H ATOM 95691 H2 WAT 1503 65.041 114.224 146.786 1.00 0.00 H TER 95693 WAT 1503 ATOM 95693 O WAT 1504 54.013 49.376 141.659 1.00 0.00 O ATOM 95694 H1 WAT 1504 54.952 49.441 141.485 1.00 0.00 H ATOM 95695 H2 WAT 1504 53.828 48.437 141.632 1.00 0.00 H TER 95697 WAT 1504 ATOM 95697 O WAT 1505 1.937 10.363 81.600 1.00 0.00 O ATOM 95698 H1 WAT 1505 1.003 10.309 81.801 1.00 0.00 H ATOM 95699 H2 WAT 1505 2.347 9.735 82.195 1.00 0.00 H TER 95701 WAT 1505 ATOM 95701 O WAT 1506 129.474 143.072 90.477 1.00 0.00 O ATOM 95702 H1 WAT 1506 130.330 143.395 90.758 1.00 0.00 H ATOM 95703 H2 WAT 1506 129.395 143.365 89.569 1.00 0.00 H TER 95705 WAT 1506 ATOM 95705 O WAT 1507 46.159 48.404 82.945 1.00 0.00 O ATOM 95706 H1 WAT 1507 46.727 48.825 82.299 1.00 0.00 H ATOM 95707 H2 WAT 1507 45.284 48.451 82.561 1.00 0.00 H TER 95709 WAT 1507 ATOM 95709 O WAT 1508 90.200 3.540 15.105 1.00 0.00 O ATOM 95710 H1 WAT 1508 90.985 4.070 14.970 1.00 0.00 H ATOM 95711 H2 WAT 1508 89.874 3.809 15.964 1.00 0.00 H TER 95713 WAT 1508 ATOM 95713 O WAT 1509 102.455 68.488 5.813 1.00 0.00 O ATOM 95714 H1 WAT 1509 103.269 68.749 6.242 1.00 0.00 H ATOM 95715 H2 WAT 1509 102.631 67.609 5.478 1.00 0.00 H TER 95717 WAT 1509 ATOM 95717 O WAT 1510 34.276 141.046 112.903 1.00 0.00 O ATOM 95718 H1 WAT 1510 33.830 141.172 112.065 1.00 0.00 H ATOM 95719 H2 WAT 1510 34.376 141.931 113.255 1.00 0.00 H TER 95721 WAT 1510 ATOM 95721 O WAT 1511 25.692 121.520 14.241 1.00 0.00 O ATOM 95722 H1 WAT 1511 26.623 121.577 14.456 1.00 0.00 H ATOM 95723 H2 WAT 1511 25.629 121.873 13.353 1.00 0.00 H TER 95725 WAT 1511 ATOM 95725 O WAT 1512 79.914 126.619 135.129 1.00 0.00 O ATOM 95726 H1 WAT 1512 80.102 127.223 134.411 1.00 0.00 H ATOM 95727 H2 WAT 1512 79.024 126.842 135.403 1.00 0.00 H TER 95729 WAT 1512 ATOM 95729 O WAT 1513 121.561 34.209 23.274 1.00 0.00 O ATOM 95730 H1 WAT 1513 121.850 35.083 23.014 1.00 0.00 H ATOM 95731 H2 WAT 1513 121.134 34.340 24.121 1.00 0.00 H TER 95733 WAT 1513 ATOM 95733 O WAT 1514 131.588 73.125 90.247 1.00 0.00 O ATOM 95734 H1 WAT 1514 131.616 73.890 89.673 1.00 0.00 H ATOM 95735 H2 WAT 1514 132.330 72.588 89.968 1.00 0.00 H TER 95737 WAT 1514 ATOM 95737 O WAT 1515 114.234 67.783 -0.114 1.00 0.00 O ATOM 95738 H1 WAT 1515 115.043 67.340 -0.373 1.00 0.00 H ATOM 95739 H2 WAT 1515 113.918 67.284 0.638 1.00 0.00 H TER 95741 WAT 1515 ATOM 95741 O WAT 1516 129.717 69.768 101.435 1.00 0.00 O ATOM 95742 H1 WAT 1516 130.101 68.999 101.013 1.00 0.00 H ATOM 95743 H2 WAT 1516 129.303 69.425 102.227 1.00 0.00 H TER 95745 WAT 1516 ATOM 95745 O WAT 1517 93.041 93.127 87.164 1.00 0.00 O ATOM 95746 H1 WAT 1517 93.437 92.438 86.630 1.00 0.00 H ATOM 95747 H2 WAT 1517 92.593 92.657 87.867 1.00 0.00 H TER 95749 WAT 1517 ATOM 95749 O WAT 1518 3.477 10.498 113.569 1.00 0.00 O ATOM 95750 H1 WAT 1518 3.167 11.100 114.246 1.00 0.00 H ATOM 95751 H2 WAT 1518 3.327 9.627 113.936 1.00 0.00 H TER 95753 WAT 1518 ATOM 95753 O WAT 1519 12.104 62.139 10.685 1.00 0.00 O ATOM 95754 H1 WAT 1519 12.982 62.363 10.993 1.00 0.00 H ATOM 95755 H2 WAT 1519 11.910 61.300 11.102 1.00 0.00 H TER 95757 WAT 1519 ATOM 95757 O WAT 1520 8.233 105.917 122.411 1.00 0.00 O ATOM 95758 H1 WAT 1520 8.976 105.445 122.036 1.00 0.00 H ATOM 95759 H2 WAT 1520 7.822 105.286 123.002 1.00 0.00 H TER 95761 WAT 1520 ATOM 95761 O WAT 1521 130.859 131.904 123.700 1.00 0.00 O ATOM 95762 H1 WAT 1521 130.286 132.052 124.453 1.00 0.00 H ATOM 95763 H2 WAT 1521 131.725 132.177 124.001 1.00 0.00 H TER 95765 WAT 1521 ATOM 95765 O WAT 1522 132.574 48.251 117.150 1.00 0.00 O ATOM 95766 H1 WAT 1522 132.724 47.593 117.830 1.00 0.00 H ATOM 95767 H2 WAT 1522 133.276 48.103 116.516 1.00 0.00 H TER 95769 WAT 1522 ATOM 95769 O WAT 1523 123.576 117.931 118.751 1.00 0.00 O ATOM 95770 H1 WAT 1523 124.480 117.678 118.938 1.00 0.00 H ATOM 95771 H2 WAT 1523 123.338 118.520 119.467 1.00 0.00 H TER 95773 WAT 1523 ATOM 95773 O WAT 1524 81.201 116.802 20.313 1.00 0.00 O ATOM 95774 H1 WAT 1524 81.523 117.642 19.986 1.00 0.00 H ATOM 95775 H2 WAT 1524 80.711 117.025 21.105 1.00 0.00 H TER 95777 WAT 1524 ATOM 95777 O WAT 1525 123.252 124.316 17.365 1.00 0.00 O ATOM 95778 H1 WAT 1525 124.134 124.249 17.731 1.00 0.00 H ATOM 95779 H2 WAT 1525 123.204 123.606 16.724 1.00 0.00 H TER 95781 WAT 1525 ATOM 95781 O WAT 1526 85.656 53.128 132.348 1.00 0.00 O ATOM 95782 H1 WAT 1526 86.013 53.180 133.235 1.00 0.00 H ATOM 95783 H2 WAT 1526 85.078 53.888 132.277 1.00 0.00 H TER 95785 WAT 1526 ATOM 95785 O WAT 1527 43.752 4.276 144.395 1.00 0.00 O ATOM 95786 H1 WAT 1527 44.497 3.676 144.385 1.00 0.00 H ATOM 95787 H2 WAT 1527 43.945 4.910 143.705 1.00 0.00 H TER 95789 WAT 1527 ATOM 95789 O WAT 1528 30.465 114.736 101.739 1.00 0.00 O ATOM 95790 H1 WAT 1528 31.248 114.458 101.262 1.00 0.00 H ATOM 95791 H2 WAT 1528 30.740 114.764 102.655 1.00 0.00 H TER 95793 WAT 1528 ATOM 95793 O WAT 1529 2.920 110.499 105.507 1.00 0.00 O ATOM 95794 H1 WAT 1529 2.395 110.334 106.290 1.00 0.00 H ATOM 95795 H2 WAT 1529 3.528 111.191 105.767 1.00 0.00 H TER 95797 WAT 1529 ATOM 95797 O WAT 1530 72.781 145.116 132.181 1.00 0.00 O ATOM 95798 H1 WAT 1530 72.068 145.753 132.130 1.00 0.00 H ATOM 95799 H2 WAT 1530 73.270 145.238 131.368 1.00 0.00 H TER 95801 WAT 1530 ATOM 95801 O WAT 1531 123.167 35.262 148.795 1.00 0.00 O ATOM 95802 H1 WAT 1531 123.982 35.762 148.840 1.00 0.00 H ATOM 95803 H2 WAT 1531 122.633 35.608 149.509 1.00 0.00 H TER 95805 WAT 1531 ATOM 95805 O WAT 1532 102.250 91.000 117.004 1.00 0.00 O ATOM 95806 H1 WAT 1532 102.597 90.425 116.321 1.00 0.00 H ATOM 95807 H2 WAT 1532 101.745 90.418 117.573 1.00 0.00 H TER 95809 WAT 1532 ATOM 95809 O WAT 1533 29.796 54.927 112.404 1.00 0.00 O ATOM 95810 H1 WAT 1533 29.996 53.992 112.375 1.00 0.00 H ATOM 95811 H2 WAT 1533 29.713 55.183 111.486 1.00 0.00 H TER 95813 WAT 1533 ATOM 95813 O WAT 1534 98.128 50.232 144.442 1.00 0.00 O ATOM 95814 H1 WAT 1534 98.897 49.981 144.953 1.00 0.00 H ATOM 95815 H2 WAT 1534 98.420 50.981 143.922 1.00 0.00 H TER 95817 WAT 1534 ATOM 95817 O WAT 1535 27.685 94.041 95.439 1.00 0.00 O ATOM 95818 H1 WAT 1535 26.863 93.589 95.251 1.00 0.00 H ATOM 95819 H2 WAT 1535 28.285 93.345 95.708 1.00 0.00 H TER 95821 WAT 1535 ATOM 95821 O WAT 1536 124.962 57.137 75.497 1.00 0.00 O ATOM 95822 H1 WAT 1536 124.275 56.614 75.085 1.00 0.00 H ATOM 95823 H2 WAT 1536 125.694 57.099 74.882 1.00 0.00 H TER 95825 WAT 1536 ATOM 95825 O WAT 1537 72.135 56.585 117.161 1.00 0.00 O ATOM 95826 H1 WAT 1537 71.599 56.890 117.893 1.00 0.00 H ATOM 95827 H2 WAT 1537 73.024 56.862 117.383 1.00 0.00 H TER 95829 WAT 1537 ATOM 95829 O WAT 1538 72.086 78.956 116.175 1.00 0.00 O ATOM 95830 H1 WAT 1538 71.857 78.528 117.000 1.00 0.00 H ATOM 95831 H2 WAT 1538 72.914 78.551 115.916 1.00 0.00 H TER 95833 WAT 1538 ATOM 95833 O WAT 1539 126.994 7.437 111.389 1.00 0.00 O ATOM 95834 H1 WAT 1539 126.804 6.845 112.117 1.00 0.00 H ATOM 95835 H2 WAT 1539 127.655 6.977 110.872 1.00 0.00 H TER 95837 WAT 1539 ATOM 95837 O WAT 1540 50.941 77.779 67.750 1.00 0.00 O ATOM 95838 H1 WAT 1540 50.256 78.399 67.499 1.00 0.00 H ATOM 95839 H2 WAT 1540 50.717 77.524 68.645 1.00 0.00 H TER 95841 WAT 1540 ATOM 95841 O WAT 1541 139.095 123.010 64.713 1.00 0.00 O ATOM 95842 H1 WAT 1541 138.140 123.078 64.712 1.00 0.00 H ATOM 95843 H2 WAT 1541 139.392 123.807 64.273 1.00 0.00 H TER 95845 WAT 1541 ATOM 95845 O WAT 1542 44.684 21.944 18.142 1.00 0.00 O ATOM 95846 H1 WAT 1542 45.192 22.239 18.897 1.00 0.00 H ATOM 95847 H2 WAT 1542 44.026 21.354 18.511 1.00 0.00 H TER 95849 WAT 1542 ATOM 95849 O WAT 1543 70.713 116.005 4.711 1.00 0.00 O ATOM 95850 H1 WAT 1543 70.107 116.450 4.118 1.00 0.00 H ATOM 95851 H2 WAT 1543 71.552 116.019 4.250 1.00 0.00 H TER 95853 WAT 1543 ATOM 95853 O WAT 1544 21.637 0.731 68.396 1.00 0.00 O ATOM 95854 H1 WAT 1544 22.269 0.135 68.799 1.00 0.00 H ATOM 95855 H2 WAT 1544 21.102 1.042 69.127 1.00 0.00 H TER 95857 WAT 1544 ATOM 95857 O WAT 1545 88.712 35.731 99.030 1.00 0.00 O ATOM 95858 H1 WAT 1545 88.435 35.016 98.458 1.00 0.00 H ATOM 95859 H2 WAT 1545 88.012 36.381 98.957 1.00 0.00 H TER 95861 WAT 1545 ATOM 95861 O WAT 1546 2.511 141.024 140.552 1.00 0.00 O ATOM 95862 H1 WAT 1546 3.179 140.903 139.877 1.00 0.00 H ATOM 95863 H2 WAT 1546 2.064 141.834 140.304 1.00 0.00 H TER 95865 WAT 1546 ATOM 95865 O WAT 1547 43.246 50.488 71.435 1.00 0.00 O ATOM 95866 H1 WAT 1547 43.233 50.947 72.275 1.00 0.00 H ATOM 95867 H2 WAT 1547 42.534 50.886 70.934 1.00 0.00 H TER 95869 WAT 1547 ATOM 95869 O WAT 1548 105.319 143.788 127.663 1.00 0.00 O ATOM 95870 H1 WAT 1548 105.742 142.986 127.355 1.00 0.00 H ATOM 95871 H2 WAT 1548 105.236 143.667 128.609 1.00 0.00 H TER 95873 WAT 1548 ATOM 95873 O WAT 1549 70.106 64.036 127.890 1.00 0.00 O ATOM 95874 H1 WAT 1549 70.205 63.379 128.579 1.00 0.00 H ATOM 95875 H2 WAT 1549 70.495 64.829 128.258 1.00 0.00 H TER 95877 WAT 1549 ATOM 95877 O WAT 1550 108.354 1.400 91.707 1.00 0.00 O ATOM 95878 H1 WAT 1550 108.284 0.495 91.404 1.00 0.00 H ATOM 95879 H2 WAT 1550 107.669 1.485 92.370 1.00 0.00 H TER 95881 WAT 1550 ATOM 95881 O WAT 1551 70.580 125.388 77.130 1.00 0.00 O ATOM 95882 H1 WAT 1551 69.650 125.590 77.029 1.00 0.00 H ATOM 95883 H2 WAT 1551 70.935 126.130 77.619 1.00 0.00 H TER 95885 WAT 1551 ATOM 95885 O WAT 1552 16.596 29.911 104.150 1.00 0.00 O ATOM 95886 H1 WAT 1552 15.952 29.447 103.615 1.00 0.00 H ATOM 95887 H2 WAT 1552 16.992 30.545 103.552 1.00 0.00 H TER 95889 WAT 1552 ATOM 95889 O WAT 1553 34.780 52.466 98.862 1.00 0.00 O ATOM 95890 H1 WAT 1553 34.884 52.142 97.968 1.00 0.00 H ATOM 95891 H2 WAT 1553 35.198 53.327 98.855 1.00 0.00 H TER 95893 WAT 1553 ATOM 95893 O WAT 1554 40.324 142.530 123.747 1.00 0.00 O ATOM 95894 H1 WAT 1554 40.767 141.698 123.579 1.00 0.00 H ATOM 95895 H2 WAT 1554 39.570 142.295 124.288 1.00 0.00 H TER 95897 WAT 1554 ATOM 95897 O WAT 1555 127.341 60.058 19.238 1.00 0.00 O ATOM 95898 H1 WAT 1555 128.001 59.468 18.875 1.00 0.00 H ATOM 95899 H2 WAT 1555 127.749 60.418 20.026 1.00 0.00 H TER 95901 WAT 1555 ATOM 95901 O WAT 1556 21.590 10.899 66.734 1.00 0.00 O ATOM 95902 H1 WAT 1556 21.439 10.692 65.812 1.00 0.00 H ATOM 95903 H2 WAT 1556 22.485 10.607 66.902 1.00 0.00 H TER 95905 WAT 1556 ATOM 95905 O WAT 1557 8.642 124.208 67.651 1.00 0.00 O ATOM 95906 H1 WAT 1557 9.425 124.454 67.158 1.00 0.00 H ATOM 95907 H2 WAT 1557 8.042 124.944 67.530 1.00 0.00 H TER 95909 WAT 1557 ATOM 95909 O WAT 1558 137.237 46.100 73.430 1.00 0.00 O ATOM 95910 H1 WAT 1558 137.265 45.414 72.764 1.00 0.00 H ATOM 95911 H2 WAT 1558 137.855 46.762 73.119 1.00 0.00 H TER 95913 WAT 1558 ATOM 95913 O WAT 1559 35.747 142.566 99.539 1.00 0.00 O ATOM 95914 H1 WAT 1559 35.034 142.048 99.165 1.00 0.00 H ATOM 95915 H2 WAT 1559 36.331 141.919 99.935 1.00 0.00 H TER 95917 WAT 1559 ATOM 95917 O WAT 1560 125.455 2.936 8.442 1.00 0.00 O ATOM 95918 H1 WAT 1560 124.713 2.980 7.839 1.00 0.00 H ATOM 95919 H2 WAT 1560 125.216 3.523 9.160 1.00 0.00 H TER 95921 WAT 1560 ATOM 95921 O WAT 1561 127.392 36.971 112.525 1.00 0.00 O ATOM 95922 H1 WAT 1561 127.179 37.900 112.615 1.00 0.00 H ATOM 95923 H2 WAT 1561 127.562 36.676 113.420 1.00 0.00 H TER 95925 WAT 1561 ATOM 95925 O WAT 1562 136.672 95.621 62.636 1.00 0.00 O ATOM 95926 H1 WAT 1562 136.689 94.688 62.423 1.00 0.00 H ATOM 95927 H2 WAT 1562 137.587 95.896 62.580 1.00 0.00 H TER 95929 WAT 1562 ATOM 95929 O WAT 1563 28.114 137.880 128.332 1.00 0.00 O ATOM 95930 H1 WAT 1563 28.308 137.059 128.785 1.00 0.00 H ATOM 95931 H2 WAT 1563 27.542 137.625 127.608 1.00 0.00 H TER 95933 WAT 1563 ATOM 95933 O WAT 1564 72.090 60.993 0.296 1.00 0.00 O ATOM 95934 H1 WAT 1564 71.409 60.735 -0.325 1.00 0.00 H ATOM 95935 H2 WAT 1564 72.087 60.301 0.957 1.00 0.00 H TER 95937 WAT 1564 ATOM 95937 O WAT 1565 92.798 19.280 17.707 1.00 0.00 O ATOM 95938 H1 WAT 1565 92.332 19.144 16.882 1.00 0.00 H ATOM 95939 H2 WAT 1565 93.687 18.969 17.534 1.00 0.00 H TER 95941 WAT 1565 ATOM 95941 O WAT 1566 77.815 11.976 16.873 1.00 0.00 O ATOM 95942 H1 WAT 1566 78.145 11.117 16.610 1.00 0.00 H ATOM 95943 H2 WAT 1566 78.600 12.476 17.098 1.00 0.00 H TER 95945 WAT 1566 ATOM 95945 O WAT 1567 92.534 74.249 84.207 1.00 0.00 O ATOM 95946 H1 WAT 1567 92.588 73.646 84.948 1.00 0.00 H ATOM 95947 H2 WAT 1567 93.020 75.023 84.493 1.00 0.00 H TER 95949 WAT 1567 ATOM 95949 O WAT 1568 84.824 142.739 142.825 1.00 0.00 O ATOM 95950 H1 WAT 1568 84.692 143.464 142.214 1.00 0.00 H ATOM 95951 H2 WAT 1568 85.545 142.235 142.448 1.00 0.00 H TER 95953 WAT 1568 ATOM 95953 O WAT 1569 111.004 11.231 139.280 1.00 0.00 O ATOM 95954 H1 WAT 1569 110.533 10.828 140.010 1.00 0.00 H ATOM 95955 H2 WAT 1569 110.970 12.170 139.463 1.00 0.00 H TER 95957 WAT 1569 ATOM 95957 O WAT 1570 128.947 143.064 67.152 1.00 0.00 O ATOM 95958 H1 WAT 1570 129.778 143.483 67.377 1.00 0.00 H ATOM 95959 H2 WAT 1570 128.482 143.719 66.632 1.00 0.00 H TER 95961 WAT 1570 ATOM 95961 O WAT 1571 30.860 144.408 95.694 1.00 0.00 O ATOM 95962 H1 WAT 1571 30.957 144.418 96.646 1.00 0.00 H ATOM 95963 H2 WAT 1571 30.077 143.879 95.538 1.00 0.00 H TER 95965 WAT 1571 ATOM 95965 O WAT 1572 72.154 48.524 56.968 1.00 0.00 O ATOM 95966 H1 WAT 1572 72.769 47.987 56.467 1.00 0.00 H ATOM 95967 H2 WAT 1572 72.699 48.968 57.617 1.00 0.00 H TER 95969 WAT 1572 ATOM 95969 O WAT 1573 129.241 135.545 131.683 1.00 0.00 O ATOM 95970 H1 WAT 1573 128.766 136.104 131.068 1.00 0.00 H ATOM 95971 H2 WAT 1573 130.057 135.331 131.230 1.00 0.00 H TER 95973 WAT 1573 ATOM 95973 O WAT 1574 132.837 142.421 132.999 1.00 0.00 O ATOM 95974 H1 WAT 1574 132.820 141.950 132.166 1.00 0.00 H ATOM 95975 H2 WAT 1574 133.115 141.766 133.639 1.00 0.00 H TER 95977 WAT 1574 ATOM 95977 O WAT 1575 129.582 116.991 156.002 1.00 0.00 O ATOM 95978 H1 WAT 1575 129.736 116.529 155.178 1.00 0.00 H ATOM 95979 H2 WAT 1575 130.230 116.627 156.605 1.00 0.00 H TER 95981 WAT 1575 ATOM 95981 O WAT 1576 63.874 118.651 70.354 1.00 0.00 O ATOM 95982 H1 WAT 1576 64.622 118.214 70.761 1.00 0.00 H ATOM 95983 H2 WAT 1576 63.525 118.004 69.740 1.00 0.00 H TER 95985 WAT 1576 ATOM 95985 O WAT 1577 9.697 68.395 9.656 1.00 0.00 O ATOM 95986 H1 WAT 1577 9.582 68.712 10.552 1.00 0.00 H ATOM 95987 H2 WAT 1577 10.430 68.906 9.313 1.00 0.00 H TER 95989 WAT 1577 ATOM 95989 O WAT 1578 74.832 70.396 14.240 1.00 0.00 O ATOM 95990 H1 WAT 1578 75.009 71.145 14.809 1.00 0.00 H ATOM 95991 H2 WAT 1578 74.071 69.969 14.635 1.00 0.00 H TER 95993 WAT 1578 ATOM 95993 O WAT 1579 3.136 45.253 129.608 1.00 0.00 O ATOM 95994 H1 WAT 1579 3.174 46.137 129.973 1.00 0.00 H ATOM 95995 H2 WAT 1579 2.209 45.112 129.416 1.00 0.00 H TER 95997 WAT 1579 ATOM 95997 O WAT 1580 11.562 1.338 145.524 1.00 0.00 O ATOM 95998 H1 WAT 1580 10.672 1.238 145.860 1.00 0.00 H ATOM 95999 H2 WAT 1580 12.120 0.974 146.211 1.00 0.00 H TER 96001 WAT 1580 ATOM 96001 O WAT 1581 98.461 33.571 89.488 1.00 0.00 O ATOM 96002 H1 WAT 1581 98.660 33.533 88.553 1.00 0.00 H ATOM 96003 H2 WAT 1581 99.142 33.039 89.900 1.00 0.00 H TER 96005 WAT 1581 ATOM 96005 O WAT 1582 133.806 122.307 84.717 1.00 0.00 O ATOM 96006 H1 WAT 1582 133.824 121.856 83.873 1.00 0.00 H ATOM 96007 H2 WAT 1582 132.877 122.458 84.889 1.00 0.00 H TER 96009 WAT 1582 ATOM 96009 O WAT 1583 43.432 119.116 102.999 1.00 0.00 O ATOM 96010 H1 WAT 1583 42.985 119.953 103.126 1.00 0.00 H ATOM 96011 H2 WAT 1583 44.296 119.244 103.391 1.00 0.00 H TER 96013 WAT 1583 ATOM 96013 O WAT 1584 116.181 57.530 127.850 1.00 0.00 O ATOM 96014 H1 WAT 1584 116.284 56.625 127.555 1.00 0.00 H ATOM 96015 H2 WAT 1584 116.195 57.474 128.805 1.00 0.00 H TER 96017 WAT 1584 ATOM 96017 O WAT 1585 0.108 18.933 124.671 1.00 0.00 O ATOM 96018 H1 WAT 1585 0.636 18.144 124.555 1.00 0.00 H ATOM 96019 H2 WAT 1585 -0.405 18.764 125.461 1.00 0.00 H TER 96021 WAT 1585 ATOM 96021 O WAT 1586 126.463 120.236 12.410 1.00 0.00 O ATOM 96022 H1 WAT 1586 126.701 119.330 12.607 1.00 0.00 H ATOM 96023 H2 WAT 1586 126.501 120.290 11.455 1.00 0.00 H TER 96025 WAT 1586 ATOM 96025 O WAT 1587 77.918 55.213 116.749 1.00 0.00 O ATOM 96026 H1 WAT 1587 77.458 55.814 116.163 1.00 0.00 H ATOM 96027 H2 WAT 1587 78.798 55.582 116.828 1.00 0.00 H TER 96029 WAT 1587 ATOM 96029 O WAT 1588 22.252 27.000 98.067 1.00 0.00 O ATOM 96030 H1 WAT 1588 23.132 27.350 98.202 1.00 0.00 H ATOM 96031 H2 WAT 1588 22.144 26.350 98.761 1.00 0.00 H TER 96033 WAT 1588 ATOM 96033 O WAT 1589 10.193 10.044 94.785 1.00 0.00 O ATOM 96034 H1 WAT 1589 9.451 10.571 95.079 1.00 0.00 H ATOM 96035 H2 WAT 1589 10.473 10.458 93.968 1.00 0.00 H TER 96037 WAT 1589 ATOM 96037 O WAT 1590 94.079 58.650 81.049 1.00 0.00 O ATOM 96038 H1 WAT 1590 94.052 59.424 80.486 1.00 0.00 H ATOM 96039 H2 WAT 1590 94.773 58.107 80.677 1.00 0.00 H TER 96041 WAT 1590 ATOM 96041 O WAT 1591 142.785 3.082 108.003 1.00 0.00 O ATOM 96042 H1 WAT 1591 141.844 3.205 108.124 1.00 0.00 H ATOM 96043 H2 WAT 1591 143.067 3.855 107.513 1.00 0.00 H TER 96045 WAT 1591 ATOM 96045 O WAT 1592 42.231 60.130 132.409 1.00 0.00 O ATOM 96046 H1 WAT 1592 43.112 59.841 132.648 1.00 0.00 H ATOM 96047 H2 WAT 1592 41.823 59.357 132.018 1.00 0.00 H TER 96049 WAT 1592 ATOM 96049 O WAT 1593 116.507 84.383 149.730 1.00 0.00 O ATOM 96050 H1 WAT 1593 115.771 84.615 149.164 1.00 0.00 H ATOM 96051 H2 WAT 1593 116.395 84.931 150.506 1.00 0.00 H TER 96053 WAT 1593 ATOM 96053 O WAT 1594 125.885 85.566 9.294 1.00 0.00 O ATOM 96054 H1 WAT 1594 126.628 86.161 9.195 1.00 0.00 H ATOM 96055 H2 WAT 1594 125.440 85.868 10.086 1.00 0.00 H TER 96057 WAT 1594 ATOM 96057 O WAT 1595 8.120 101.364 94.759 1.00 0.00 O ATOM 96058 H1 WAT 1595 7.732 101.522 93.898 1.00 0.00 H ATOM 96059 H2 WAT 1595 8.017 100.422 94.899 1.00 0.00 H TER 96061 WAT 1595 ATOM 96061 O WAT 1596 80.603 70.928 90.479 1.00 0.00 O ATOM 96062 H1 WAT 1596 81.399 70.449 90.252 1.00 0.00 H ATOM 96063 H2 WAT 1596 80.910 71.800 90.726 1.00 0.00 H TER 96065 WAT 1596 ATOM 96065 O WAT 1597 30.422 45.575 146.950 1.00 0.00 O ATOM 96066 H1 WAT 1597 30.787 45.180 146.158 1.00 0.00 H ATOM 96067 H2 WAT 1597 31.179 45.719 147.518 1.00 0.00 H TER 96069 WAT 1597 ATOM 96069 O WAT 1598 56.940 83.508 126.941 1.00 0.00 O ATOM 96070 H1 WAT 1598 57.465 82.762 127.231 1.00 0.00 H ATOM 96071 H2 WAT 1598 56.960 83.458 125.985 1.00 0.00 H TER 96073 WAT 1598 ATOM 96073 O WAT 1599 40.073 55.676 10.865 1.00 0.00 O ATOM 96074 H1 WAT 1599 39.988 56.368 10.210 1.00 0.00 H ATOM 96075 H2 WAT 1599 41.013 55.499 10.908 1.00 0.00 H TER 96077 WAT 1599 ATOM 96077 O WAT 1600 4.867 22.896 128.815 1.00 0.00 O ATOM 96078 H1 WAT 1600 4.330 23.307 129.492 1.00 0.00 H ATOM 96079 H2 WAT 1600 4.291 22.245 128.415 1.00 0.00 H TER 96081 WAT 1600 ATOM 96081 O WAT 1601 70.327 75.751 124.548 1.00 0.00 O ATOM 96082 H1 WAT 1601 70.799 75.958 123.742 1.00 0.00 H ATOM 96083 H2 WAT 1601 69.470 75.446 124.252 1.00 0.00 H TER 96085 WAT 1601 ATOM 96085 O WAT 1602 70.298 43.926 28.869 1.00 0.00 O ATOM 96086 H1 WAT 1602 70.835 43.229 29.246 1.00 0.00 H ATOM 96087 H2 WAT 1602 69.484 43.491 28.617 1.00 0.00 H TER 96089 WAT 1602 ATOM 96089 O WAT 1603 129.385 57.982 144.004 1.00 0.00 O ATOM 96090 H1 WAT 1603 129.843 57.338 143.463 1.00 0.00 H ATOM 96091 H2 WAT 1603 129.332 58.763 143.453 1.00 0.00 H TER 96093 WAT 1603 ATOM 96093 O WAT 1604 82.860 15.191 70.611 1.00 0.00 O ATOM 96094 H1 WAT 1604 83.257 15.813 71.221 1.00 0.00 H ATOM 96095 H2 WAT 1604 83.078 15.534 69.745 1.00 0.00 H TER 96097 WAT 1604 ATOM 96097 O WAT 1605 106.719 100.010 81.523 1.00 0.00 O ATOM 96098 H1 WAT 1605 106.420 100.494 80.753 1.00 0.00 H ATOM 96099 H2 WAT 1605 106.160 99.234 81.550 1.00 0.00 H TER 96101 WAT 1605 ATOM 96101 O WAT 1606 42.130 53.888 100.626 1.00 0.00 O ATOM 96102 H1 WAT 1606 42.505 54.087 101.484 1.00 0.00 H ATOM 96103 H2 WAT 1606 42.735 53.254 100.241 1.00 0.00 H TER 96105 WAT 1606 ATOM 96105 O WAT 1607 53.026 131.567 157.362 1.00 0.00 O ATOM 96106 H1 WAT 1607 53.585 131.766 156.611 1.00 0.00 H ATOM 96107 H2 WAT 1607 52.336 132.230 157.329 1.00 0.00 H TER 96109 WAT 1607 ATOM 96109 O WAT 1608 80.944 18.371 56.218 1.00 0.00 O ATOM 96110 H1 WAT 1608 80.383 17.691 56.592 1.00 0.00 H ATOM 96111 H2 WAT 1608 80.342 19.081 55.995 1.00 0.00 H TER 96113 WAT 1608 ATOM 96113 O WAT 1609 73.479 3.146 10.674 1.00 0.00 O ATOM 96114 H1 WAT 1609 72.657 2.840 10.291 1.00 0.00 H ATOM 96115 H2 WAT 1609 73.768 2.422 11.230 1.00 0.00 H TER 96117 WAT 1609 ATOM 96117 O WAT 1610 2.467 143.056 146.509 1.00 0.00 O ATOM 96118 H1 WAT 1610 1.945 142.369 146.922 1.00 0.00 H ATOM 96119 H2 WAT 1610 2.303 142.951 145.572 1.00 0.00 H TER 96121 WAT 1610 ATOM 96121 O WAT 1611 137.672 88.315 74.031 1.00 0.00 O ATOM 96122 H1 WAT 1611 137.644 87.587 73.409 1.00 0.00 H ATOM 96123 H2 WAT 1611 136.826 88.282 74.476 1.00 0.00 H TER 96125 WAT 1611 ATOM 96125 O WAT 1612 86.797 108.529 123.521 1.00 0.00 O ATOM 96126 H1 WAT 1612 86.782 109.486 123.493 1.00 0.00 H ATOM 96127 H2 WAT 1612 87.662 108.292 123.188 1.00 0.00 H TER 96129 WAT 1612 ATOM 96129 O WAT 1613 72.187 49.435 11.214 1.00 0.00 O ATOM 96130 H1 WAT 1613 72.550 50.231 10.826 1.00 0.00 H ATOM 96131 H2 WAT 1613 71.842 49.717 12.062 1.00 0.00 H TER 96133 WAT 1613 ATOM 96133 O WAT 1614 41.649 42.003 17.321 1.00 0.00 O ATOM 96134 H1 WAT 1614 42.435 42.313 17.771 1.00 0.00 H ATOM 96135 H2 WAT 1614 41.529 42.620 16.599 1.00 0.00 H TER 96137 WAT 1614 ATOM 96137 O WAT 1615 83.176 41.267 111.668 1.00 0.00 O ATOM 96138 H1 WAT 1615 82.600 40.530 111.462 1.00 0.00 H ATOM 96139 H2 WAT 1615 82.730 42.029 111.298 1.00 0.00 H TER 96141 WAT 1615 ATOM 96141 O WAT 1616 107.909 54.780 102.406 1.00 0.00 O ATOM 96142 H1 WAT 1616 108.070 55.723 102.370 1.00 0.00 H ATOM 96143 H2 WAT 1616 107.029 54.674 102.044 1.00 0.00 H TER 96145 WAT 1616 ATOM 96145 O WAT 1617 64.497 7.319 116.674 1.00 0.00 O ATOM 96146 H1 WAT 1617 64.131 8.156 116.387 1.00 0.00 H ATOM 96147 H2 WAT 1617 65.267 7.560 117.190 1.00 0.00 H TER 96149 WAT 1617 ATOM 96149 O WAT 1618 61.476 46.412 57.765 1.00 0.00 O ATOM 96150 H1 WAT 1618 60.668 46.412 57.252 1.00 0.00 H ATOM 96151 H2 WAT 1618 61.870 47.267 57.593 1.00 0.00 H TER 96153 WAT 1618 ATOM 96153 O WAT 1619 129.713 3.743 5.929 1.00 0.00 O ATOM 96154 H1 WAT 1619 129.845 4.691 5.900 1.00 0.00 H ATOM 96155 H2 WAT 1619 129.147 3.604 6.689 1.00 0.00 H TER 96157 WAT 1619 ATOM 96157 O WAT 1620 98.967 84.676 61.728 1.00 0.00 O ATOM 96158 H1 WAT 1620 98.137 84.491 61.289 1.00 0.00 H ATOM 96159 H2 WAT 1620 98.719 84.884 62.630 1.00 0.00 H TER 96161 WAT 1620 ATOM 96161 O WAT 1621 136.245 129.266 133.815 1.00 0.00 O ATOM 96162 H1 WAT 1621 137.126 129.451 133.486 1.00 0.00 H ATOM 96163 H2 WAT 1621 136.325 129.335 134.766 1.00 0.00 H TER 96165 WAT 1621 ATOM 96165 O WAT 1622 107.910 46.168 108.999 1.00 0.00 O ATOM 96166 H1 WAT 1622 108.340 46.387 108.172 1.00 0.00 H ATOM 96167 H2 WAT 1622 107.563 47.002 109.317 1.00 0.00 H TER 96169 WAT 1622 ATOM 96169 O WAT 1623 80.476 41.118 144.269 1.00 0.00 O ATOM 96170 H1 WAT 1623 81.181 40.736 143.747 1.00 0.00 H ATOM 96171 H2 WAT 1623 79.942 41.598 143.636 1.00 0.00 H TER 96173 WAT 1623 ATOM 96173 O WAT 1624 14.901 69.710 127.217 1.00 0.00 O ATOM 96174 H1 WAT 1624 14.493 68.889 126.940 1.00 0.00 H ATOM 96175 H2 WAT 1624 14.180 70.226 127.577 1.00 0.00 H TER 96177 WAT 1624 ATOM 96177 O WAT 1625 0.443 23.619 119.476 1.00 0.00 O ATOM 96178 H1 WAT 1625 0.432 23.551 120.431 1.00 0.00 H ATOM 96179 H2 WAT 1625 0.079 24.485 119.294 1.00 0.00 H TER 96181 WAT 1625 ATOM 96181 O WAT 1626 95.795 29.065 83.976 1.00 0.00 O ATOM 96182 H1 WAT 1626 95.751 28.625 84.825 1.00 0.00 H ATOM 96183 H2 WAT 1626 96.035 28.373 83.360 1.00 0.00 H TER 96185 WAT 1626 ATOM 96185 O WAT 1627 132.921 16.407 3.396 1.00 0.00 O ATOM 96186 H1 WAT 1627 132.014 16.138 3.546 1.00 0.00 H ATOM 96187 H2 WAT 1627 132.943 17.329 3.656 1.00 0.00 H TER 96189 WAT 1627 ATOM 96189 O WAT 1628 2.297 41.200 125.844 1.00 0.00 O ATOM 96190 H1 WAT 1628 2.862 40.669 126.404 1.00 0.00 H ATOM 96191 H2 WAT 1628 2.874 41.510 125.146 1.00 0.00 H TER 96193 WAT 1628 ATOM 96193 O WAT 1629 39.254 145.768 12.114 1.00 0.00 O ATOM 96194 H1 WAT 1629 39.360 146.586 12.602 1.00 0.00 H ATOM 96195 H2 WAT 1629 39.981 145.219 12.407 1.00 0.00 H TER 96197 WAT 1629 ATOM 96197 O WAT 1630 56.600 94.403 114.204 1.00 0.00 O ATOM 96198 H1 WAT 1630 57.105 94.393 113.391 1.00 0.00 H ATOM 96199 H2 WAT 1630 55.954 93.705 114.092 1.00 0.00 H TER 96201 WAT 1630 ATOM 96201 O WAT 1631 11.486 76.309 27.411 1.00 0.00 O ATOM 96202 H1 WAT 1631 12.359 75.925 27.499 1.00 0.00 H ATOM 96203 H2 WAT 1631 11.465 77.010 28.062 1.00 0.00 H TER 96205 WAT 1631 ATOM 96205 O WAT 1632 4.767 39.990 74.263 1.00 0.00 O ATOM 96206 H1 WAT 1632 5.552 39.446 74.333 1.00 0.00 H ATOM 96207 H2 WAT 1632 4.044 39.363 74.224 1.00 0.00 H TER 96209 WAT 1632 ATOM 96209 O WAT 1633 2.215 63.870 155.930 1.00 0.00 O ATOM 96210 H1 WAT 1633 2.771 64.391 155.350 1.00 0.00 H ATOM 96211 H2 WAT 1633 2.830 63.396 156.490 1.00 0.00 H TER 96213 WAT 1633 ATOM 96213 O WAT 1634 112.898 6.669 109.395 1.00 0.00 O ATOM 96214 H1 WAT 1634 112.519 5.802 109.542 1.00 0.00 H ATOM 96215 H2 WAT 1634 112.911 7.075 110.262 1.00 0.00 H TER 96217 WAT 1634 ATOM 96217 O WAT 1635 62.965 34.958 4.797 1.00 0.00 O ATOM 96218 H1 WAT 1635 62.050 35.183 4.628 1.00 0.00 H ATOM 96219 H2 WAT 1635 63.450 35.383 4.089 1.00 0.00 H TER 96221 WAT 1635 ATOM 96221 O WAT 1636 22.752 130.170 19.728 1.00 0.00 O ATOM 96222 H1 WAT 1636 23.047 129.387 20.195 1.00 0.00 H ATOM 96223 H2 WAT 1636 21.858 130.312 20.040 1.00 0.00 H TER 96225 WAT 1636 ATOM 96225 O WAT 1637 116.686 110.579 120.928 1.00 0.00 O ATOM 96226 H1 WAT 1637 117.065 111.386 120.581 1.00 0.00 H ATOM 96227 H2 WAT 1637 116.733 109.960 120.199 1.00 0.00 H TER 96229 WAT 1637 ATOM 96229 O WAT 1638 24.264 121.692 2.743 1.00 0.00 O ATOM 96230 H1 WAT 1638 23.855 120.947 3.184 1.00 0.00 H ATOM 96231 H2 WAT 1638 24.966 121.304 2.221 1.00 0.00 H TER 96233 WAT 1638 ATOM 96233 O WAT 1639 141.948 72.041 84.863 1.00 0.00 O ATOM 96234 H1 WAT 1639 142.169 71.800 83.963 1.00 0.00 H ATOM 96235 H2 WAT 1639 141.390 71.327 85.172 1.00 0.00 H TER 96237 WAT 1639 ATOM 96237 O WAT 1640 131.908 100.404 114.449 1.00 0.00 O ATOM 96238 H1 WAT 1640 131.961 101.344 114.275 1.00 0.00 H ATOM 96239 H2 WAT 1640 131.116 100.120 113.992 1.00 0.00 H TER 96241 WAT 1640 ATOM 96241 O WAT 1641 79.059 49.810 64.598 1.00 0.00 O ATOM 96242 H1 WAT 1641 78.809 50.260 63.790 1.00 0.00 H ATOM 96243 H2 WAT 1641 78.536 49.009 64.597 1.00 0.00 H TER 96245 WAT 1641 ATOM 96245 O WAT 1642 82.420 26.251 13.179 1.00 0.00 O ATOM 96246 H1 WAT 1642 82.754 25.829 13.971 1.00 0.00 H ATOM 96247 H2 WAT 1642 82.099 27.101 13.479 1.00 0.00 H TER 96249 WAT 1642 ATOM 96249 O WAT 1643 36.086 113.935 126.007 1.00 0.00 O ATOM 96250 H1 WAT 1643 35.190 114.269 125.976 1.00 0.00 H ATOM 96251 H2 WAT 1643 36.628 114.715 126.129 1.00 0.00 H TER 96253 WAT 1643 ATOM 96253 O WAT 1644 36.223 53.022 84.210 1.00 0.00 O ATOM 96254 H1 WAT 1644 35.324 52.714 84.327 1.00 0.00 H ATOM 96255 H2 WAT 1644 36.466 52.722 83.334 1.00 0.00 H TER 96257 WAT 1644 ATOM 96257 O WAT 1645 2.764 38.157 144.297 1.00 0.00 O ATOM 96258 H1 WAT 1645 3.559 37.997 143.788 1.00 0.00 H ATOM 96259 H2 WAT 1645 2.570 39.083 144.152 1.00 0.00 H TER 96261 WAT 1645 ATOM 96261 O WAT 1646 18.490 110.326 66.302 1.00 0.00 O ATOM 96262 H1 WAT 1646 18.671 109.430 66.017 1.00 0.00 H ATOM 96263 H2 WAT 1646 18.619 110.306 67.251 1.00 0.00 H TER 96265 WAT 1646 ATOM 96265 O WAT 1647 57.560 62.942 127.270 1.00 0.00 O ATOM 96266 H1 WAT 1647 57.739 62.052 126.968 1.00 0.00 H ATOM 96267 H2 WAT 1647 56.608 62.977 127.362 1.00 0.00 H TER 96269 WAT 1647 ATOM 96269 O WAT 1648 24.434 82.816 107.733 1.00 0.00 O ATOM 96270 H1 WAT 1648 25.137 82.734 108.377 1.00 0.00 H ATOM 96271 H2 WAT 1648 23.630 82.736 108.246 1.00 0.00 H TER 96273 WAT 1648 ATOM 96273 O WAT 1649 72.655 113.427 138.825 1.00 0.00 O ATOM 96274 H1 WAT 1649 72.831 113.020 139.674 1.00 0.00 H ATOM 96275 H2 WAT 1649 73.323 113.064 138.243 1.00 0.00 H TER 96277 WAT 1649 ATOM 96277 O WAT 1650 118.458 9.561 119.501 1.00 0.00 O ATOM 96278 H1 WAT 1650 118.601 8.907 118.817 1.00 0.00 H ATOM 96279 H2 WAT 1650 118.062 9.072 120.222 1.00 0.00 H TER 96281 WAT 1650 ATOM 96281 O WAT 1651 4.843 23.244 82.514 1.00 0.00 O ATOM 96282 H1 WAT 1651 3.924 23.482 82.636 1.00 0.00 H ATOM 96283 H2 WAT 1651 5.285 23.596 83.286 1.00 0.00 H TER 96285 WAT 1651 ATOM 96285 O WAT 1652 119.786 51.499 114.415 1.00 0.00 O ATOM 96286 H1 WAT 1652 119.662 51.660 115.350 1.00 0.00 H ATOM 96287 H2 WAT 1652 119.278 52.186 113.984 1.00 0.00 H TER 96289 WAT 1652 ATOM 96289 O WAT 1653 20.753 110.879 94.060 1.00 0.00 O ATOM 96290 H1 WAT 1653 21.498 111.451 93.874 1.00 0.00 H ATOM 96291 H2 WAT 1653 20.007 111.474 94.135 1.00 0.00 H TER 96293 WAT 1653 ATOM 96293 O WAT 1654 69.852 14.446 103.048 1.00 0.00 O ATOM 96294 H1 WAT 1654 70.724 14.062 103.140 1.00 0.00 H ATOM 96295 H2 WAT 1654 70.007 15.296 102.636 1.00 0.00 H TER 96297 WAT 1654 ATOM 96297 O WAT 1655 4.190 111.865 14.993 1.00 0.00 O ATOM 96298 H1 WAT 1655 4.268 112.644 15.544 1.00 0.00 H ATOM 96299 H2 WAT 1655 5.073 111.726 14.648 1.00 0.00 H TER 96301 WAT 1655 ATOM 96301 O WAT 1656 36.249 109.632 150.635 1.00 0.00 O ATOM 96302 H1 WAT 1656 36.033 109.882 151.533 1.00 0.00 H ATOM 96303 H2 WAT 1656 35.998 108.710 150.576 1.00 0.00 H TER 96305 WAT 1656 ATOM 96305 O WAT 1657 101.854 61.690 118.559 1.00 0.00 O ATOM 96306 H1 WAT 1657 101.598 60.832 118.898 1.00 0.00 H ATOM 96307 H2 WAT 1657 102.439 61.494 117.828 1.00 0.00 H TER 96309 WAT 1657 ATOM 96309 O WAT 1658 125.990 64.269 66.088 1.00 0.00 O ATOM 96310 H1 WAT 1658 125.146 64.303 65.637 1.00 0.00 H ATOM 96311 H2 WAT 1658 126.462 63.554 65.660 1.00 0.00 H TER 96313 WAT 1658 ATOM 96313 O WAT 1659 14.114 84.518 103.466 1.00 0.00 O ATOM 96314 H1 WAT 1659 13.778 83.622 103.462 1.00 0.00 H ATOM 96315 H2 WAT 1659 14.294 84.710 102.546 1.00 0.00 H TER 96317 WAT 1659 ATOM 96317 O WAT 1660 10.290 63.054 146.446 1.00 0.00 O ATOM 96318 H1 WAT 1660 9.636 62.832 147.109 1.00 0.00 H ATOM 96319 H2 WAT 1660 10.045 63.931 146.152 1.00 0.00 H TER 96321 WAT 1660 ATOM 96321 O WAT 1661 33.493 50.274 123.095 1.00 0.00 O ATOM 96322 H1 WAT 1661 33.137 50.002 123.940 1.00 0.00 H ATOM 96323 H2 WAT 1661 33.102 51.133 122.935 1.00 0.00 H TER 96325 WAT 1661 ATOM 96325 O WAT 1662 87.146 24.125 116.046 1.00 0.00 O ATOM 96326 H1 WAT 1662 87.904 24.710 116.049 1.00 0.00 H ATOM 96327 H2 WAT 1662 86.445 24.643 115.651 1.00 0.00 H TER 96329 WAT 1662 ATOM 96329 O WAT 1663 58.401 32.314 129.711 1.00 0.00 O ATOM 96330 H1 WAT 1663 57.745 32.279 129.014 1.00 0.00 H ATOM 96331 H2 WAT 1663 57.898 32.207 130.518 1.00 0.00 H TER 96333 WAT 1663 ATOM 96333 O WAT 1664 125.203 101.605 137.108 1.00 0.00 O ATOM 96334 H1 WAT 1664 125.329 101.974 136.234 1.00 0.00 H ATOM 96335 H2 WAT 1664 125.950 101.926 137.613 1.00 0.00 H TER 96337 WAT 1664 ATOM 96337 O WAT 1665 38.699 50.471 141.832 1.00 0.00 O ATOM 96338 H1 WAT 1665 39.422 50.392 141.211 1.00 0.00 H ATOM 96339 H2 WAT 1665 37.917 50.269 141.317 1.00 0.00 H TER 96341 WAT 1665 ATOM 96341 O WAT 1666 7.685 85.724 69.847 1.00 0.00 O ATOM 96342 H1 WAT 1666 7.762 86.667 69.700 1.00 0.00 H ATOM 96343 H2 WAT 1666 8.263 85.331 69.193 1.00 0.00 H TER 96345 WAT 1666 ATOM 96345 O WAT 1667 137.160 19.133 65.540 1.00 0.00 O ATOM 96346 H1 WAT 1667 136.537 19.557 64.950 1.00 0.00 H ATOM 96347 H2 WAT 1667 137.612 19.858 65.972 1.00 0.00 H TER 96349 WAT 1667 ATOM 96349 O WAT 1668 25.321 51.361 135.744 1.00 0.00 O ATOM 96350 H1 WAT 1668 26.260 51.175 135.747 1.00 0.00 H ATOM 96351 H2 WAT 1668 25.144 51.685 134.861 1.00 0.00 H TER 96353 WAT 1668 ATOM 96353 O WAT 1669 14.759 51.256 129.741 1.00 0.00 O ATOM 96354 H1 WAT 1669 15.052 50.803 130.532 1.00 0.00 H ATOM 96355 H2 WAT 1669 14.202 51.964 130.063 1.00 0.00 H TER 96357 WAT 1669 ATOM 96357 O WAT 1670 35.156 21.670 103.624 1.00 0.00 O ATOM 96358 H1 WAT 1670 35.917 22.114 103.249 1.00 0.00 H ATOM 96359 H2 WAT 1670 35.282 21.737 104.570 1.00 0.00 H TER 96361 WAT 1670 ATOM 96361 O WAT 1671 26.456 120.717 1.102 1.00 0.00 O ATOM 96362 H1 WAT 1671 27.190 121.316 0.968 1.00 0.00 H ATOM 96363 H2 WAT 1671 26.836 119.845 0.990 1.00 0.00 H TER 96365 WAT 1671 ATOM 96365 O WAT 1672 77.454 118.090 8.559 1.00 0.00 O ATOM 96366 H1 WAT 1672 77.193 117.335 9.087 1.00 0.00 H ATOM 96367 H2 WAT 1672 77.343 118.840 9.143 1.00 0.00 H TER 96369 WAT 1672 ATOM 96369 O WAT 1673 135.803 13.298 85.883 1.00 0.00 O ATOM 96370 H1 WAT 1673 135.506 13.818 85.137 1.00 0.00 H ATOM 96371 H2 WAT 1673 136.623 13.712 86.152 1.00 0.00 H TER 96373 WAT 1673 ATOM 96373 O WAT 1674 40.851 99.611 76.048 1.00 0.00 O ATOM 96374 H1 WAT 1674 40.322 100.407 75.992 1.00 0.00 H ATOM 96375 H2 WAT 1674 40.371 99.046 76.653 1.00 0.00 H TER 96377 WAT 1674 ATOM 96377 O WAT 1675 16.132 134.795 153.316 1.00 0.00 O ATOM 96378 H1 WAT 1675 16.650 135.563 153.556 1.00 0.00 H ATOM 96379 H2 WAT 1675 15.224 135.078 153.415 1.00 0.00 H TER 96381 WAT 1675 ATOM 96381 O WAT 1676 35.901 143.369 75.818 1.00 0.00 O ATOM 96382 H1 WAT 1676 36.490 144.124 75.807 1.00 0.00 H ATOM 96383 H2 WAT 1676 36.441 142.648 76.140 1.00 0.00 H TER 96385 WAT 1676 ATOM 96385 O WAT 1677 119.239 26.627 12.865 1.00 0.00 O ATOM 96386 H1 WAT 1677 119.918 26.003 12.607 1.00 0.00 H ATOM 96387 H2 WAT 1677 119.600 27.483 12.633 1.00 0.00 H TER 96389 WAT 1677 ATOM 96389 O WAT 1678 29.345 54.532 142.351 1.00 0.00 O ATOM 96390 H1 WAT 1678 29.577 55.442 142.538 1.00 0.00 H ATOM 96391 H2 WAT 1678 28.981 54.204 143.174 1.00 0.00 H TER 96393 WAT 1678 ATOM 96393 O WAT 1679 144.675 74.764 157.867 1.00 0.00 O ATOM 96394 H1 WAT 1679 143.980 74.543 158.487 1.00 0.00 H ATOM 96395 H2 WAT 1679 145.438 74.947 158.417 1.00 0.00 H TER 96397 WAT 1679 ATOM 96397 O WAT 1680 73.944 104.343 14.984 1.00 0.00 O ATOM 96398 H1 WAT 1680 73.766 103.791 15.746 1.00 0.00 H ATOM 96399 H2 WAT 1680 74.706 103.938 14.568 1.00 0.00 H TER 96401 WAT 1680 ATOM 96401 O WAT 1681 124.154 46.476 65.585 1.00 0.00 O ATOM 96402 H1 WAT 1681 124.012 46.415 64.640 1.00 0.00 H ATOM 96403 H2 WAT 1681 124.709 45.724 65.793 1.00 0.00 H TER 96405 WAT 1681 ATOM 96405 O WAT 1682 83.666 2.984 65.717 1.00 0.00 O ATOM 96406 H1 WAT 1682 84.339 3.159 66.374 1.00 0.00 H ATOM 96407 H2 WAT 1682 83.509 2.042 65.780 1.00 0.00 H TER 96409 WAT 1682 ATOM 96409 O WAT 1683 135.841 20.697 75.227 1.00 0.00 O ATOM 96410 H1 WAT 1683 135.998 20.324 74.360 1.00 0.00 H ATOM 96411 H2 WAT 1683 134.999 20.329 75.497 1.00 0.00 H TER 96413 WAT 1683 ATOM 96413 O WAT 1684 47.789 53.486 96.732 1.00 0.00 O ATOM 96414 H1 WAT 1684 47.579 53.667 97.648 1.00 0.00 H ATOM 96415 H2 WAT 1684 48.699 53.188 96.749 1.00 0.00 H TER 96417 WAT 1684 ATOM 96417 O WAT 1685 78.082 48.267 11.806 1.00 0.00 O ATOM 96418 H1 WAT 1685 78.706 48.764 12.335 1.00 0.00 H ATOM 96419 H2 WAT 1685 77.268 48.293 12.309 1.00 0.00 H TER 96421 WAT 1685 ATOM 96421 O WAT 1686 41.871 77.578 144.037 1.00 0.00 O ATOM 96422 H1 WAT 1686 42.543 77.742 143.376 1.00 0.00 H ATOM 96423 H2 WAT 1686 41.523 76.714 143.815 1.00 0.00 H TER 96425 WAT 1686 ATOM 96425 O WAT 1687 133.975 92.221 8.681 1.00 0.00 O ATOM 96426 H1 WAT 1687 134.861 91.894 8.529 1.00 0.00 H ATOM 96427 H2 WAT 1687 134.101 93.114 9.003 1.00 0.00 H TER 96429 WAT 1687 ATOM 96429 O WAT 1688 25.832 76.440 22.615 1.00 0.00 O ATOM 96430 H1 WAT 1688 25.223 75.901 22.110 1.00 0.00 H ATOM 96431 H2 WAT 1688 25.720 76.145 23.519 1.00 0.00 H TER 96433 WAT 1688 ATOM 96433 O WAT 1689 69.132 123.083 17.685 1.00 0.00 O ATOM 96434 H1 WAT 1689 68.656 123.482 18.414 1.00 0.00 H ATOM 96435 H2 WAT 1689 69.365 122.210 18.000 1.00 0.00 H TER 96437 WAT 1689 ATOM 96437 O WAT 1690 131.156 21.587 124.890 1.00 0.00 O ATOM 96438 H1 WAT 1690 130.305 21.376 124.507 1.00 0.00 H ATOM 96439 H2 WAT 1690 130.949 22.143 125.641 1.00 0.00 H TER 96441 WAT 1690 ATOM 96441 O WAT 1691 133.644 51.600 113.733 1.00 0.00 O ATOM 96442 H1 WAT 1691 132.711 51.513 113.928 1.00 0.00 H ATOM 96443 H2 WAT 1691 134.064 50.924 114.266 1.00 0.00 H TER 96445 WAT 1691 ATOM 96445 O WAT 1692 87.137 24.255 110.893 1.00 0.00 O ATOM 96446 H1 WAT 1692 87.053 25.179 111.128 1.00 0.00 H ATOM 96447 H2 WAT 1692 86.586 23.795 111.526 1.00 0.00 H TER 96449 WAT 1692 ATOM 96449 O WAT 1693 134.846 126.927 96.191 1.00 0.00 O ATOM 96450 H1 WAT 1693 134.568 126.857 95.277 1.00 0.00 H ATOM 96451 H2 WAT 1693 134.274 127.599 96.563 1.00 0.00 H TER 96453 WAT 1693 ATOM 96453 O WAT 1694 70.138 4.316 136.632 1.00 0.00 O ATOM 96454 H1 WAT 1694 70.619 4.693 137.369 1.00 0.00 H ATOM 96455 H2 WAT 1694 69.376 4.886 136.528 1.00 0.00 H TER 96457 WAT 1694 ATOM 96457 O WAT 1695 59.373 14.990 147.453 1.00 0.00 O ATOM 96458 H1 WAT 1695 58.652 15.332 146.924 1.00 0.00 H ATOM 96459 H2 WAT 1695 59.382 15.545 148.232 1.00 0.00 H TER 96461 WAT 1695 ATOM 96461 O WAT 1696 96.240 98.725 69.448 1.00 0.00 O ATOM 96462 H1 WAT 1696 95.567 98.779 68.770 1.00 0.00 H ATOM 96463 H2 WAT 1696 95.964 99.357 70.112 1.00 0.00 H TER 96465 WAT 1696 ATOM 96465 O WAT 1697 14.058 95.578 157.804 1.00 0.00 O ATOM 96466 H1 WAT 1697 13.779 95.036 158.541 1.00 0.00 H ATOM 96467 H2 WAT 1697 14.196 94.957 157.089 1.00 0.00 H TER 96469 WAT 1697 ATOM 96469 O WAT 1698 89.277 11.408 16.846 1.00 0.00 O ATOM 96470 H1 WAT 1698 89.689 12.229 17.115 1.00 0.00 H ATOM 96471 H2 WAT 1698 89.350 10.840 17.613 1.00 0.00 H TER 96473 WAT 1698 ATOM 96473 O WAT 1699 43.038 110.602 135.686 1.00 0.00 O ATOM 96474 H1 WAT 1699 43.106 111.555 135.736 1.00 0.00 H ATOM 96475 H2 WAT 1699 43.861 110.323 135.285 1.00 0.00 H TER 96477 WAT 1699 ATOM 96477 O WAT 1700 68.677 91.391 128.123 1.00 0.00 O ATOM 96478 H1 WAT 1700 68.347 91.553 127.239 1.00 0.00 H ATOM 96479 H2 WAT 1700 69.318 90.690 128.014 1.00 0.00 H TER 96481 WAT 1700 ATOM 96481 O WAT 1701 79.156 10.445 88.959 1.00 0.00 O ATOM 96482 H1 WAT 1701 78.974 10.743 89.850 1.00 0.00 H ATOM 96483 H2 WAT 1701 79.832 11.043 88.640 1.00 0.00 H TER 96485 WAT 1701 ATOM 96485 O WAT 1702 13.249 74.718 59.198 1.00 0.00 O ATOM 96486 H1 WAT 1702 12.345 74.604 59.491 1.00 0.00 H ATOM 96487 H2 WAT 1702 13.639 75.305 59.846 1.00 0.00 H TER 96489 WAT 1702 ATOM 96489 O WAT 1703 144.083 80.342 153.694 1.00 0.00 O ATOM 96490 H1 WAT 1703 144.889 80.140 153.218 1.00 0.00 H ATOM 96491 H2 WAT 1703 143.587 79.523 153.683 1.00 0.00 H TER 96493 WAT 1703 ATOM 96493 O WAT 1704 95.528 38.989 12.121 1.00 0.00 O ATOM 96494 H1 WAT 1704 96.278 38.646 11.635 1.00 0.00 H ATOM 96495 H2 WAT 1704 95.745 38.828 13.040 1.00 0.00 H TER 96497 WAT 1704 ATOM 96497 O WAT 1705 74.061 96.838 3.562 1.00 0.00 O ATOM 96498 H1 WAT 1705 73.251 97.325 3.411 1.00 0.00 H ATOM 96499 H2 WAT 1705 74.260 96.438 2.716 1.00 0.00 H TER 96501 WAT 1705 ATOM 96501 O WAT 1706 90.533 50.010 15.646 1.00 0.00 O ATOM 96502 H1 WAT 1706 90.512 49.120 15.294 1.00 0.00 H ATOM 96503 H2 WAT 1706 90.013 49.964 16.448 1.00 0.00 H TER 96505 WAT 1706 ATOM 96505 O WAT 1707 142.743 45.855 92.299 1.00 0.00 O ATOM 96506 H1 WAT 1707 143.101 46.207 93.113 1.00 0.00 H ATOM 96507 H2 WAT 1707 142.634 44.920 92.469 1.00 0.00 H TER 96509 WAT 1707 ATOM 96509 O WAT 1708 14.445 35.511 104.935 1.00 0.00 O ATOM 96510 H1 WAT 1708 14.458 36.380 105.336 1.00 0.00 H ATOM 96511 H2 WAT 1708 14.692 34.916 105.643 1.00 0.00 H TER 96513 WAT 1708 ATOM 96513 O WAT 1709 96.698 131.278 71.370 1.00 0.00 O ATOM 96514 H1 WAT 1709 95.767 131.440 71.524 1.00 0.00 H ATOM 96515 H2 WAT 1709 97.134 132.066 71.695 1.00 0.00 H TER 96517 WAT 1709 ATOM 96517 O WAT 1710 39.654 42.832 111.844 1.00 0.00 O ATOM 96518 H1 WAT 1710 39.068 43.258 111.218 1.00 0.00 H ATOM 96519 H2 WAT 1710 39.187 42.878 112.678 1.00 0.00 H TER 96521 WAT 1710 ATOM 96521 O WAT 1711 96.707 46.438 90.013 1.00 0.00 O ATOM 96522 H1 WAT 1711 95.906 46.166 89.565 1.00 0.00 H ATOM 96523 H2 WAT 1711 96.408 46.765 90.861 1.00 0.00 H TER 96525 WAT 1711 ATOM 96525 O WAT 1712 112.639 86.048 138.938 1.00 0.00 O ATOM 96526 H1 WAT 1712 113.006 85.169 139.039 1.00 0.00 H ATOM 96527 H2 WAT 1712 112.025 86.136 139.666 1.00 0.00 H TER 96529 WAT 1712 ATOM 96529 O WAT 1713 92.800 34.940 138.029 1.00 0.00 O ATOM 96530 H1 WAT 1713 93.226 34.576 138.805 1.00 0.00 H ATOM 96531 H2 WAT 1713 91.869 34.756 138.159 1.00 0.00 H TER 96533 WAT 1713 ATOM 96533 O WAT 1714 98.641 141.096 147.706 1.00 0.00 O ATOM 96534 H1 WAT 1714 98.301 141.204 148.594 1.00 0.00 H ATOM 96535 H2 WAT 1714 99.371 141.712 147.651 1.00 0.00 H TER 96537 WAT 1714 ATOM 96537 O WAT 1715 86.997 15.921 141.595 1.00 0.00 O ATOM 96538 H1 WAT 1715 86.489 15.114 141.683 1.00 0.00 H ATOM 96539 H2 WAT 1715 86.371 16.564 141.263 1.00 0.00 H TER 96541 WAT 1715 ATOM 96541 O WAT 1716 34.091 69.814 69.267 1.00 0.00 O ATOM 96542 H1 WAT 1716 34.168 70.648 68.803 1.00 0.00 H ATOM 96543 H2 WAT 1716 33.197 69.522 69.090 1.00 0.00 H TER 96545 WAT 1716 ATOM 96545 O WAT 1717 41.634 94.904 71.510 1.00 0.00 O ATOM 96546 H1 WAT 1717 41.938 94.404 70.753 1.00 0.00 H ATOM 96547 H2 WAT 1717 41.350 94.239 72.138 1.00 0.00 H TER 96549 WAT 1717 ATOM 96549 O WAT 1718 100.893 78.453 133.021 1.00 0.00 O ATOM 96550 H1 WAT 1718 101.316 79.151 132.521 1.00 0.00 H ATOM 96551 H2 WAT 1718 101.551 77.759 133.067 1.00 0.00 H TER 96553 WAT 1718 ATOM 96553 O WAT 1719 49.073 112.424 1.425 1.00 0.00 O ATOM 96554 H1 WAT 1719 48.460 113.158 1.398 1.00 0.00 H ATOM 96555 H2 WAT 1719 48.518 111.646 1.371 1.00 0.00 H TER 96557 WAT 1719 ATOM 96557 O WAT 1720 7.730 114.381 150.845 1.00 0.00 O ATOM 96558 H1 WAT 1720 7.385 114.540 151.724 1.00 0.00 H ATOM 96559 H2 WAT 1720 7.242 113.620 150.530 1.00 0.00 H TER 96561 WAT 1720 ATOM 96561 O WAT 1721 94.759 26.235 139.458 1.00 0.00 O ATOM 96562 H1 WAT 1721 94.275 26.645 140.175 1.00 0.00 H ATOM 96563 H2 WAT 1721 95.119 26.970 138.961 1.00 0.00 H TER 96565 WAT 1721 ATOM 96565 O WAT 1722 4.931 15.392 133.618 1.00 0.00 O ATOM 96566 H1 WAT 1722 5.484 15.769 132.934 1.00 0.00 H ATOM 96567 H2 WAT 1722 4.618 16.147 134.117 1.00 0.00 H TER 96569 WAT 1722 ATOM 96569 O WAT 1723 86.980 42.105 143.050 1.00 0.00 O ATOM 96570 H1 WAT 1723 87.038 41.435 142.370 1.00 0.00 H ATOM 96571 H2 WAT 1723 86.757 42.908 142.578 1.00 0.00 H TER 96573 WAT 1723 ATOM 96573 O WAT 1724 37.888 118.413 115.834 1.00 0.00 O ATOM 96574 H1 WAT 1724 37.289 117.865 115.327 1.00 0.00 H ATOM 96575 H2 WAT 1724 38.109 119.134 115.245 1.00 0.00 H TER 96577 WAT 1724 ATOM 96577 O WAT 1725 16.304 109.566 15.392 1.00 0.00 O ATOM 96578 H1 WAT 1725 16.997 109.531 16.051 1.00 0.00 H ATOM 96579 H2 WAT 1725 16.443 108.784 14.857 1.00 0.00 H TER 96581 WAT 1725 ATOM 96581 O WAT 1726 134.180 47.849 82.664 1.00 0.00 O ATOM 96582 H1 WAT 1726 133.503 47.546 82.060 1.00 0.00 H ATOM 96583 H2 WAT 1726 133.792 48.609 83.098 1.00 0.00 H TER 96585 WAT 1726 ATOM 96585 O WAT 1727 56.184 29.113 141.634 1.00 0.00 O ATOM 96586 H1 WAT 1727 56.050 28.501 142.357 1.00 0.00 H ATOM 96587 H2 WAT 1727 57.135 29.196 141.563 1.00 0.00 H TER 96589 WAT 1727 ATOM 96589 O WAT 1728 117.682 54.021 12.183 1.00 0.00 O ATOM 96590 H1 WAT 1728 117.281 53.474 12.858 1.00 0.00 H ATOM 96591 H2 WAT 1728 118.350 53.462 11.787 1.00 0.00 H TER 96593 WAT 1728 ATOM 96593 O WAT 1729 68.875 101.921 23.240 1.00 0.00 O ATOM 96594 H1 WAT 1729 68.029 101.484 23.341 1.00 0.00 H ATOM 96595 H2 WAT 1729 69.201 101.618 22.392 1.00 0.00 H TER 96597 WAT 1729 ATOM 96597 O WAT 1730 70.275 132.041 91.421 1.00 0.00 O ATOM 96598 H1 WAT 1730 69.840 132.133 92.269 1.00 0.00 H ATOM 96599 H2 WAT 1730 70.320 132.933 91.077 1.00 0.00 H TER 96601 WAT 1730 ATOM 96601 O WAT 1731 104.865 51.979 19.243 1.00 0.00 O ATOM 96602 H1 WAT 1731 104.396 51.971 18.408 1.00 0.00 H ATOM 96603 H2 WAT 1731 105.788 52.042 18.998 1.00 0.00 H TER 96605 WAT 1731 ATOM 96605 O WAT 1732 39.434 11.357 61.120 1.00 0.00 O ATOM 96606 H1 WAT 1732 39.327 10.565 60.593 1.00 0.00 H ATOM 96607 H2 WAT 1732 40.045 11.898 60.619 1.00 0.00 H TER 96609 WAT 1732 ATOM 96609 O WAT 1733 89.385 32.033 21.875 1.00 0.00 O ATOM 96610 H1 WAT 1733 89.472 31.397 22.585 1.00 0.00 H ATOM 96611 H2 WAT 1733 89.163 31.505 21.108 1.00 0.00 H TER 96613 WAT 1733 ATOM 96613 O WAT 1734 74.321 124.896 71.079 1.00 0.00 O ATOM 96614 H1 WAT 1734 74.717 125.051 70.221 1.00 0.00 H ATOM 96615 H2 WAT 1734 73.919 125.733 71.311 1.00 0.00 H TER 96617 WAT 1734 ATOM 96617 O WAT 1735 46.433 74.353 110.590 1.00 0.00 O ATOM 96618 H1 WAT 1735 45.765 74.689 111.188 1.00 0.00 H ATOM 96619 H2 WAT 1735 46.908 73.700 111.103 1.00 0.00 H TER 96621 WAT 1735 ATOM 96621 O WAT 1736 120.338 53.247 121.034 1.00 0.00 O ATOM 96622 H1 WAT 1736 120.700 53.493 121.885 1.00 0.00 H ATOM 96623 H2 WAT 1736 120.758 52.412 120.827 1.00 0.00 H TER 96625 WAT 1736 ATOM 96625 O WAT 1737 34.402 110.228 67.038 1.00 0.00 O ATOM 96626 H1 WAT 1737 35.336 110.183 66.832 1.00 0.00 H ATOM 96627 H2 WAT 1737 34.253 109.497 67.637 1.00 0.00 H TER 96629 WAT 1737 ATOM 96629 O WAT 1738 18.270 34.148 69.902 1.00 0.00 O ATOM 96630 H1 WAT 1738 18.086 34.423 70.801 1.00 0.00 H ATOM 96631 H2 WAT 1738 18.575 33.244 69.986 1.00 0.00 H TER 96633 WAT 1738 ATOM 96633 O WAT 1739 41.252 69.537 149.189 1.00 0.00 O ATOM 96634 H1 WAT 1739 42.037 69.342 148.677 1.00 0.00 H ATOM 96635 H2 WAT 1739 41.573 69.658 150.083 1.00 0.00 H TER 96637 WAT 1739 ATOM 96637 O WAT 1740 88.731 54.849 125.600 1.00 0.00 O ATOM 96638 H1 WAT 1740 87.924 55.239 125.936 1.00 0.00 H ATOM 96639 H2 WAT 1740 89.357 55.573 125.582 1.00 0.00 H TER 96641 WAT 1740 ATOM 96641 O WAT 1741 26.601 139.808 22.571 1.00 0.00 O ATOM 96642 H1 WAT 1741 26.085 140.612 22.633 1.00 0.00 H ATOM 96643 H2 WAT 1741 26.932 139.805 21.673 1.00 0.00 H TER 96645 WAT 1741 ATOM 96645 O WAT 1742 66.491 13.835 96.765 1.00 0.00 O ATOM 96646 H1 WAT 1742 65.592 14.140 96.640 1.00 0.00 H ATOM 96647 H2 WAT 1742 66.495 13.454 97.642 1.00 0.00 H TER 96649 WAT 1742 ATOM 96649 O WAT 1743 45.971 119.608 113.116 1.00 0.00 O ATOM 96650 H1 WAT 1743 45.401 119.241 113.792 1.00 0.00 H ATOM 96651 H2 WAT 1743 46.638 118.937 112.974 1.00 0.00 H TER 96653 WAT 1743 ATOM 96653 O WAT 1744 92.371 38.316 4.792 1.00 0.00 O ATOM 96654 H1 WAT 1744 91.699 38.738 4.257 1.00 0.00 H ATOM 96655 H2 WAT 1744 93.197 38.673 4.464 1.00 0.00 H TER 96657 WAT 1744 ATOM 96657 O WAT 1745 97.878 106.067 127.586 1.00 0.00 O ATOM 96658 H1 WAT 1745 98.177 106.921 127.272 1.00 0.00 H ATOM 96659 H2 WAT 1745 98.654 105.509 127.538 1.00 0.00 H TER 96661 WAT 1745 ATOM 96661 O WAT 1746 78.475 99.572 70.544 1.00 0.00 O ATOM 96662 H1 WAT 1746 79.298 99.281 70.151 1.00 0.00 H ATOM 96663 H2 WAT 1746 78.308 98.942 71.245 1.00 0.00 H TER 96665 WAT 1746 ATOM 96665 O WAT 1747 38.709 66.985 116.133 1.00 0.00 O ATOM 96666 H1 WAT 1747 39.123 66.600 116.905 1.00 0.00 H ATOM 96667 H2 WAT 1747 39.113 66.532 115.393 1.00 0.00 H TER 96669 WAT 1747 ATOM 96669 O WAT 1748 119.068 125.992 132.713 1.00 0.00 O ATOM 96670 H1 WAT 1748 119.098 125.448 133.500 1.00 0.00 H ATOM 96671 H2 WAT 1748 119.792 125.674 132.174 1.00 0.00 H TER 96673 WAT 1748 ATOM 96673 O WAT 1749 106.829 23.205 105.361 1.00 0.00 O ATOM 96674 H1 WAT 1749 107.090 23.719 106.125 1.00 0.00 H ATOM 96675 H2 WAT 1749 105.956 23.530 105.140 1.00 0.00 H TER 96677 WAT 1749 ATOM 96677 O WAT 1750 27.403 12.309 135.377 1.00 0.00 O ATOM 96678 H1 WAT 1750 27.778 11.744 134.702 1.00 0.00 H ATOM 96679 H2 WAT 1750 27.811 12.014 136.191 1.00 0.00 H TER 96681 WAT 1750 ATOM 96681 O WAT 1751 63.000 54.439 59.251 1.00 0.00 O ATOM 96682 H1 WAT 1751 63.607 54.991 58.757 1.00 0.00 H ATOM 96683 H2 WAT 1751 63.517 53.672 59.495 1.00 0.00 H TER 96685 WAT 1751 ATOM 96685 O WAT 1752 97.678 105.882 94.164 1.00 0.00 O ATOM 96686 H1 WAT 1752 96.826 105.660 93.789 1.00 0.00 H ATOM 96687 H2 WAT 1752 97.469 106.371 94.960 1.00 0.00 H TER 96689 WAT 1752 ATOM 96689 O WAT 1753 39.305 84.386 134.471 1.00 0.00 O ATOM 96690 H1 WAT 1753 38.944 84.068 133.644 1.00 0.00 H ATOM 96691 H2 WAT 1753 39.413 85.328 134.338 1.00 0.00 H TER 96693 WAT 1753 ATOM 96693 O WAT 1754 121.886 139.996 112.680 1.00 0.00 O ATOM 96694 H1 WAT 1754 122.534 140.699 112.732 1.00 0.00 H ATOM 96695 H2 WAT 1754 121.128 140.332 113.158 1.00 0.00 H TER 96697 WAT 1754 ATOM 96697 O WAT 1755 103.595 21.147 136.874 1.00 0.00 O ATOM 96698 H1 WAT 1755 103.658 20.647 137.688 1.00 0.00 H ATOM 96699 H2 WAT 1755 102.698 21.482 136.867 1.00 0.00 H TER 96701 WAT 1755 ATOM 96701 O WAT 1756 65.970 113.301 86.733 1.00 0.00 O ATOM 96702 H1 WAT 1756 65.697 113.615 87.595 1.00 0.00 H ATOM 96703 H2 WAT 1756 65.778 112.363 86.748 1.00 0.00 H TER 96705 WAT 1756 ATOM 96705 O WAT 1757 98.651 21.780 121.986 1.00 0.00 O ATOM 96706 H1 WAT 1757 99.361 22.421 121.964 1.00 0.00 H ATOM 96707 H2 WAT 1757 98.505 21.615 122.918 1.00 0.00 H TER 96709 WAT 1757 ATOM 96709 O WAT 1758 9.321 34.494 146.909 1.00 0.00 O ATOM 96710 H1 WAT 1758 9.757 35.321 147.115 1.00 0.00 H ATOM 96711 H2 WAT 1758 9.866 34.100 146.227 1.00 0.00 H TER 96713 WAT 1758 ATOM 96713 O WAT 1759 94.541 108.880 70.160 1.00 0.00 O ATOM 96714 H1 WAT 1759 95.175 109.401 69.666 1.00 0.00 H ATOM 96715 H2 WAT 1759 95.075 108.354 70.754 1.00 0.00 H TER 96717 WAT 1759 ATOM 96717 O WAT 1760 102.378 57.868 107.889 1.00 0.00 O ATOM 96718 H1 WAT 1760 102.989 58.495 107.502 1.00 0.00 H ATOM 96719 H2 WAT 1760 101.534 58.080 107.491 1.00 0.00 H TER 96721 WAT 1760 ATOM 96721 O WAT 1761 41.147 53.626 73.609 1.00 0.00 O ATOM 96722 H1 WAT 1761 40.469 53.313 74.207 1.00 0.00 H ATOM 96723 H2 WAT 1761 41.467 54.433 74.012 1.00 0.00 H TER 96725 WAT 1761 ATOM 96725 O WAT 1762 103.745 2.858 74.390 1.00 0.00 O ATOM 96726 H1 WAT 1762 104.469 3.484 74.430 1.00 0.00 H ATOM 96727 H2 WAT 1762 102.995 3.378 74.103 1.00 0.00 H TER 96729 WAT 1762 ATOM 96729 O WAT 1763 85.773 1.539 85.589 1.00 0.00 O ATOM 96730 H1 WAT 1763 85.799 0.582 85.607 1.00 0.00 H ATOM 96731 H2 WAT 1763 86.671 1.798 85.380 1.00 0.00 H TER 96733 WAT 1763 ATOM 96733 O WAT 1764 143.027 100.009 67.375 1.00 0.00 O ATOM 96734 H1 WAT 1764 142.866 99.909 66.437 1.00 0.00 H ATOM 96735 H2 WAT 1764 142.196 99.774 67.787 1.00 0.00 H TER 96737 WAT 1764 ATOM 96737 O WAT 1765 43.721 8.790 111.344 1.00 0.00 O ATOM 96738 H1 WAT 1765 43.958 8.985 110.437 1.00 0.00 H ATOM 96739 H2 WAT 1765 43.282 7.941 111.300 1.00 0.00 H TER 96741 WAT 1765 ATOM 96741 O WAT 1766 50.782 4.405 131.511 1.00 0.00 O ATOM 96742 H1 WAT 1766 51.637 4.372 131.083 1.00 0.00 H ATOM 96743 H2 WAT 1766 50.825 3.728 132.186 1.00 0.00 H TER 96745 WAT 1766 ATOM 96745 O WAT 1767 86.301 3.129 100.560 1.00 0.00 O ATOM 96746 H1 WAT 1767 86.665 3.251 101.437 1.00 0.00 H ATOM 96747 H2 WAT 1767 85.384 3.390 100.644 1.00 0.00 H TER 96749 WAT 1767 ATOM 96749 O WAT 1768 71.128 17.212 149.441 1.00 0.00 O ATOM 96750 H1 WAT 1768 71.461 18.067 149.167 1.00 0.00 H ATOM 96751 H2 WAT 1768 71.672 16.581 148.970 1.00 0.00 H TER 96753 WAT 1768 ATOM 96753 O WAT 1769 134.033 62.610 66.359 1.00 0.00 O ATOM 96754 H1 WAT 1769 133.389 62.322 65.712 1.00 0.00 H ATOM 96755 H2 WAT 1769 133.667 62.335 67.200 1.00 0.00 H TER 96757 WAT 1769 ATOM 96757 O WAT 1770 49.943 46.749 84.289 1.00 0.00 O ATOM 96758 H1 WAT 1770 49.436 46.436 83.539 1.00 0.00 H ATOM 96759 H2 WAT 1770 49.349 47.343 84.748 1.00 0.00 H TER 96761 WAT 1770 ATOM 96761 O WAT 1771 106.519 144.954 4.152 1.00 0.00 O ATOM 96762 H1 WAT 1771 107.020 144.138 4.172 1.00 0.00 H ATOM 96763 H2 WAT 1771 106.960 145.520 4.786 1.00 0.00 H TER 96765 WAT 1771 ATOM 96765 O WAT 1772 25.729 86.696 81.846 1.00 0.00 O ATOM 96766 H1 WAT 1772 26.591 87.029 82.095 1.00 0.00 H ATOM 96767 H2 WAT 1772 25.849 86.361 80.957 1.00 0.00 H TER 96769 WAT 1772 ATOM 96769 O WAT 1773 67.622 61.456 21.186 1.00 0.00 O ATOM 96770 H1 WAT 1773 67.312 60.553 21.258 1.00 0.00 H ATOM 96771 H2 WAT 1773 67.800 61.721 22.088 1.00 0.00 H TER 96773 WAT 1773 ATOM 96773 O WAT 1774 120.655 122.677 106.638 1.00 0.00 O ATOM 96774 H1 WAT 1774 121.273 123.354 106.912 1.00 0.00 H ATOM 96775 H2 WAT 1774 119.997 123.146 106.126 1.00 0.00 H TER 96777 WAT 1774 ATOM 96777 O WAT 1775 125.059 34.529 68.125 1.00 0.00 O ATOM 96778 H1 WAT 1775 125.852 34.539 68.662 1.00 0.00 H ATOM 96779 H2 WAT 1775 124.712 35.418 68.194 1.00 0.00 H TER 96781 WAT 1775 ATOM 96781 O WAT 1776 32.951 89.607 147.068 1.00 0.00 O ATOM 96782 H1 WAT 1776 32.228 90.038 146.613 1.00 0.00 H ATOM 96783 H2 WAT 1776 33.347 90.300 147.597 1.00 0.00 H TER 96785 WAT 1776 ATOM 96785 O WAT 1777 75.982 34.629 110.126 1.00 0.00 O ATOM 96786 H1 WAT 1777 75.759 34.256 110.978 1.00 0.00 H ATOM 96787 H2 WAT 1777 75.560 35.488 110.123 1.00 0.00 H TER 96789 WAT 1777 ATOM 96789 O WAT 1778 131.382 100.233 108.247 1.00 0.00 O ATOM 96790 H1 WAT 1778 131.310 99.914 109.147 1.00 0.00 H ATOM 96791 H2 WAT 1778 131.748 101.113 108.334 1.00 0.00 H TER 96793 WAT 1778 ATOM 96793 O WAT 1779 96.310 23.433 68.408 1.00 0.00 O ATOM 96794 H1 WAT 1779 96.130 22.663 67.868 1.00 0.00 H ATOM 96795 H2 WAT 1779 96.256 23.113 69.308 1.00 0.00 H TER 96797 WAT 1779 ATOM 96797 O WAT 1780 137.359 24.132 3.066 1.00 0.00 O ATOM 96798 H1 WAT 1780 136.654 23.505 3.230 1.00 0.00 H ATOM 96799 H2 WAT 1780 138.140 23.590 2.958 1.00 0.00 H TER 96801 WAT 1780 ATOM 96801 O WAT 1781 53.719 135.495 19.874 1.00 0.00 O ATOM 96802 H1 WAT 1781 54.374 134.797 19.868 1.00 0.00 H ATOM 96803 H2 WAT 1781 53.207 135.350 19.078 1.00 0.00 H TER 96805 WAT 1781 ATOM 96805 O WAT 1782 75.793 110.835 114.502 1.00 0.00 O ATOM 96806 H1 WAT 1782 76.072 111.437 115.193 1.00 0.00 H ATOM 96807 H2 WAT 1782 76.493 110.878 113.850 1.00 0.00 H TER 96809 WAT 1782 ATOM 96809 O WAT 1783 17.502 75.660 98.082 1.00 0.00 O ATOM 96810 H1 WAT 1783 17.964 75.106 98.712 1.00 0.00 H ATOM 96811 H2 WAT 1783 16.830 75.089 97.709 1.00 0.00 H TER 96813 WAT 1783 ATOM 96813 O WAT 1784 81.327 71.360 16.562 1.00 0.00 O ATOM 96814 H1 WAT 1784 81.361 72.073 15.924 1.00 0.00 H ATOM 96815 H2 WAT 1784 80.517 70.892 16.354 1.00 0.00 H TER 96817 WAT 1784 ATOM 96817 O WAT 1785 76.418 99.946 81.684 1.00 0.00 O ATOM 96818 H1 WAT 1785 76.964 100.164 80.928 1.00 0.00 H ATOM 96819 H2 WAT 1785 77.043 99.708 82.369 1.00 0.00 H TER 96821 WAT 1785 ATOM 96821 O WAT 1786 34.537 59.240 124.107 1.00 0.00 O ATOM 96822 H1 WAT 1786 34.305 59.030 123.202 1.00 0.00 H ATOM 96823 H2 WAT 1786 35.318 58.716 124.281 1.00 0.00 H TER 96825 WAT 1786 ATOM 96825 O WAT 1787 134.551 98.461 101.526 1.00 0.00 O ATOM 96826 H1 WAT 1787 135.076 99.163 101.910 1.00 0.00 H ATOM 96827 H2 WAT 1787 134.725 97.701 102.080 1.00 0.00 H TER 96829 WAT 1787 ATOM 96829 O WAT 1788 65.204 132.054 79.439 1.00 0.00 O ATOM 96830 H1 WAT 1788 66.161 132.073 79.440 1.00 0.00 H ATOM 96831 H2 WAT 1788 64.950 132.819 78.923 1.00 0.00 H TER 96833 WAT 1788 ATOM 96833 O WAT 1789 120.486 104.652 89.010 1.00 0.00 O ATOM 96834 H1 WAT 1789 120.881 104.818 89.866 1.00 0.00 H ATOM 96835 H2 WAT 1789 121.152 104.161 88.530 1.00 0.00 H TER 96837 WAT 1789 ATOM 96837 O WAT 1790 8.169 118.778 106.477 1.00 0.00 O ATOM 96838 H1 WAT 1790 7.553 118.671 105.752 1.00 0.00 H ATOM 96839 H2 WAT 1790 9.030 118.799 106.060 1.00 0.00 H TER 96841 WAT 1790 ATOM 96841 O WAT 1791 126.465 24.403 9.745 1.00 0.00 O ATOM 96842 H1 WAT 1791 126.654 24.717 8.861 1.00 0.00 H ATOM 96843 H2 WAT 1791 126.915 25.022 10.320 1.00 0.00 H TER 96845 WAT 1791 ATOM 96845 O WAT 1792 74.673 80.876 121.347 1.00 0.00 O ATOM 96846 H1 WAT 1792 74.826 80.729 120.414 1.00 0.00 H ATOM 96847 H2 WAT 1792 75.430 80.481 121.780 1.00 0.00 H TER 96849 WAT 1792 ATOM 96849 O WAT 1793 121.559 66.514 25.479 1.00 0.00 O ATOM 96850 H1 WAT 1793 121.144 65.655 25.399 1.00 0.00 H ATOM 96851 H2 WAT 1793 122.483 66.319 25.636 1.00 0.00 H TER 96853 WAT 1793 ATOM 96853 O WAT 1794 87.934 136.973 81.771 1.00 0.00 O ATOM 96854 H1 WAT 1794 88.342 137.702 81.303 1.00 0.00 H ATOM 96855 H2 WAT 1794 88.666 136.519 82.189 1.00 0.00 H TER 96857 WAT 1794 ATOM 96857 O WAT 1795 135.418 64.994 94.857 1.00 0.00 O ATOM 96858 H1 WAT 1795 134.759 65.493 94.375 1.00 0.00 H ATOM 96859 H2 WAT 1795 135.973 64.611 94.178 1.00 0.00 H TER 96861 WAT 1795 ATOM 96861 O WAT 1796 136.546 130.957 73.179 1.00 0.00 O ATOM 96862 H1 WAT 1796 136.613 130.272 73.845 1.00 0.00 H ATOM 96863 H2 WAT 1796 135.946 130.599 72.526 1.00 0.00 H TER 96865 WAT 1796 ATOM 96865 O WAT 1797 27.149 75.385 80.035 1.00 0.00 O ATOM 96866 H1 WAT 1797 27.482 74.558 80.384 1.00 0.00 H ATOM 96867 H2 WAT 1797 27.229 75.294 79.085 1.00 0.00 H TER 96869 WAT 1797 ATOM 96869 O WAT 1798 33.334 107.053 104.675 1.00 0.00 O ATOM 96870 H1 WAT 1798 33.109 106.618 103.852 1.00 0.00 H ATOM 96871 H2 WAT 1798 32.560 107.573 104.891 1.00 0.00 H TER 96873 WAT 1798 ATOM 96873 O WAT 1799 132.381 77.601 146.242 1.00 0.00 O ATOM 96874 H1 WAT 1799 132.763 78.478 146.215 1.00 0.00 H ATOM 96875 H2 WAT 1799 132.177 77.399 145.329 1.00 0.00 H TER 96877 WAT 1799 ATOM 96877 O WAT 1800 77.515 108.084 76.250 1.00 0.00 O ATOM 96878 H1 WAT 1800 76.629 108.417 76.109 1.00 0.00 H ATOM 96879 H2 WAT 1800 77.573 107.950 77.196 1.00 0.00 H TER 96881 WAT 1800 ATOM 96881 O WAT 1801 97.024 8.468 12.339 1.00 0.00 O ATOM 96882 H1 WAT 1801 96.083 8.579 12.203 1.00 0.00 H ATOM 96883 H2 WAT 1801 97.217 8.991 13.118 1.00 0.00 H TER 96885 WAT 1801 ATOM 96885 O WAT 1802 24.607 34.585 107.490 1.00 0.00 O ATOM 96886 H1 WAT 1802 24.924 33.853 108.020 1.00 0.00 H ATOM 96887 H2 WAT 1802 25.060 34.487 106.653 1.00 0.00 H TER 96889 WAT 1802 ATOM 96889 O WAT 1803 137.506 54.855 133.525 1.00 0.00 O ATOM 96890 H1 WAT 1803 136.855 54.665 134.202 1.00 0.00 H ATOM 96891 H2 WAT 1803 138.338 54.892 133.996 1.00 0.00 H TER 96893 WAT 1803 ATOM 96893 O WAT 1804 59.795 12.641 83.630 1.00 0.00 O ATOM 96894 H1 WAT 1804 60.125 13.468 83.278 1.00 0.00 H ATOM 96895 H2 WAT 1804 59.965 12.002 82.938 1.00 0.00 H TER 96897 WAT 1804 ATOM 96897 O WAT 1805 94.420 7.551 88.642 1.00 0.00 O ATOM 96898 H1 WAT 1805 93.466 7.515 88.580 1.00 0.00 H ATOM 96899 H2 WAT 1805 94.659 6.758 89.123 1.00 0.00 H TER 96901 WAT 1805 ATOM 96901 O WAT 1806 26.532 105.376 83.289 1.00 0.00 O ATOM 96902 H1 WAT 1806 27.339 105.890 83.248 1.00 0.00 H ATOM 96903 H2 WAT 1806 26.806 104.529 83.641 1.00 0.00 H TER 96905 WAT 1806 ATOM 96905 O WAT 1807 91.275 40.251 78.456 1.00 0.00 O ATOM 96906 H1 WAT 1807 91.773 40.660 77.749 1.00 0.00 H ATOM 96907 H2 WAT 1807 91.884 39.623 78.846 1.00 0.00 H TER 96909 WAT 1807 ATOM 96909 O WAT 1808 35.256 28.511 156.550 1.00 0.00 O ATOM 96910 H1 WAT 1808 34.558 27.979 156.168 1.00 0.00 H ATOM 96911 H2 WAT 1808 35.684 27.929 157.178 1.00 0.00 H TER 96913 WAT 1808 ATOM 96913 O WAT 1809 20.705 107.442 130.732 1.00 0.00 O ATOM 96914 H1 WAT 1809 20.021 107.707 131.347 1.00 0.00 H ATOM 96915 H2 WAT 1809 21.492 107.360 131.270 1.00 0.00 H TER 96917 WAT 1809 ATOM 96917 O WAT 1810 30.103 125.266 84.900 1.00 0.00 O ATOM 96918 H1 WAT 1810 29.426 125.718 85.404 1.00 0.00 H ATOM 96919 H2 WAT 1810 30.605 124.781 85.554 1.00 0.00 H TER 96921 WAT 1810 ATOM 96921 O WAT 1811 71.528 130.571 96.302 1.00 0.00 O ATOM 96922 H1 WAT 1811 72.289 130.390 96.854 1.00 0.00 H ATOM 96923 H2 WAT 1811 71.098 131.315 96.724 1.00 0.00 H TER 96925 WAT 1811 ATOM 96925 O WAT 1812 103.923 61.177 -0.023 1.00 0.00 O ATOM 96926 H1 WAT 1812 102.990 60.968 0.020 1.00 0.00 H ATOM 96927 H2 WAT 1812 104.126 61.544 0.838 1.00 0.00 H TER 96929 WAT 1812 ATOM 96929 O WAT 1813 128.699 63.398 60.735 1.00 0.00 O ATOM 96930 H1 WAT 1813 129.294 63.951 61.242 1.00 0.00 H ATOM 96931 H2 WAT 1813 128.208 62.907 61.394 1.00 0.00 H TER 96933 WAT 1813 ATOM 96933 O WAT 1814 81.377 16.612 117.325 1.00 0.00 O ATOM 96934 H1 WAT 1814 81.777 16.879 116.497 1.00 0.00 H ATOM 96935 H2 WAT 1814 81.086 15.713 117.171 1.00 0.00 H TER 96937 WAT 1814 ATOM 96937 O WAT 1815 38.335 46.045 28.648 1.00 0.00 O ATOM 96938 H1 WAT 1815 38.400 45.496 27.867 1.00 0.00 H ATOM 96939 H2 WAT 1815 37.866 46.826 28.353 1.00 0.00 H TER 96941 WAT 1815 ATOM 96941 O WAT 1816 126.896 0.646 132.641 1.00 0.00 O ATOM 96942 H1 WAT 1816 126.422 0.959 133.411 1.00 0.00 H ATOM 96943 H2 WAT 1816 127.740 1.095 132.681 1.00 0.00 H TER 96945 WAT 1816 ATOM 96945 O WAT 1817 61.904 41.625 130.415 1.00 0.00 O ATOM 96946 H1 WAT 1817 61.904 41.237 129.540 1.00 0.00 H ATOM 96947 H2 WAT 1817 62.390 42.444 130.314 1.00 0.00 H TER 96949 WAT 1817 ATOM 96949 O WAT 1818 52.721 105.520 135.583 1.00 0.00 O ATOM 96950 H1 WAT 1818 51.897 105.544 135.097 1.00 0.00 H ATOM 96951 H2 WAT 1818 52.560 104.905 136.299 1.00 0.00 H TER 96953 WAT 1818 ATOM 96953 O WAT 1819 127.340 131.017 14.355 1.00 0.00 O ATOM 96954 H1 WAT 1819 126.535 131.303 14.787 1.00 0.00 H ATOM 96955 H2 WAT 1819 127.306 131.425 13.490 1.00 0.00 H TER 96957 WAT 1819 ATOM 96957 O WAT 1820 11.460 71.929 110.124 1.00 0.00 O ATOM 96958 H1 WAT 1820 12.056 72.668 110.001 1.00 0.00 H ATOM 96959 H2 WAT 1820 11.217 71.667 109.236 1.00 0.00 H TER 96961 WAT 1820 ATOM 96961 O WAT 1821 104.496 78.093 19.177 1.00 0.00 O ATOM 96962 H1 WAT 1821 103.717 78.124 18.621 1.00 0.00 H ATOM 96963 H2 WAT 1821 104.793 77.184 19.122 1.00 0.00 H TER 96965 WAT 1821 ATOM 96965 O WAT 1822 71.204 106.850 138.652 1.00 0.00 O ATOM 96966 H1 WAT 1822 72.149 106.821 138.804 1.00 0.00 H ATOM 96967 H2 WAT 1822 70.966 107.766 138.795 1.00 0.00 H TER 96969 WAT 1822 ATOM 96969 O WAT 1823 74.567 97.658 0.747 1.00 0.00 O ATOM 96970 H1 WAT 1823 75.165 98.022 1.399 1.00 0.00 H ATOM 96971 H2 WAT 1823 75.103 97.557 -0.039 1.00 0.00 H TER 96973 WAT 1823 ATOM 96973 O WAT 1824 7.038 25.290 121.958 1.00 0.00 O ATOM 96974 H1 WAT 1824 7.883 25.198 122.399 1.00 0.00 H ATOM 96975 H2 WAT 1824 7.037 26.187 121.626 1.00 0.00 H TER 96977 WAT 1824 ATOM 96977 O WAT 1825 127.524 27.448 97.272 1.00 0.00 O ATOM 96978 H1 WAT 1825 127.183 28.335 97.386 1.00 0.00 H ATOM 96979 H2 WAT 1825 127.382 27.254 96.345 1.00 0.00 H TER 96981 WAT 1825 ATOM 96981 O WAT 1826 33.319 140.754 154.091 1.00 0.00 O ATOM 96982 H1 WAT 1826 33.926 140.078 153.790 1.00 0.00 H ATOM 96983 H2 WAT 1826 33.662 141.023 154.943 1.00 0.00 H TER 96985 WAT 1826 ATOM 96985 O WAT 1827 13.418 52.873 56.026 1.00 0.00 O ATOM 96986 H1 WAT 1827 13.749 53.758 55.875 1.00 0.00 H ATOM 96987 H2 WAT 1827 13.797 52.352 55.318 1.00 0.00 H TER 96989 WAT 1827 ATOM 96989 O WAT 1828 141.934 18.826 128.187 1.00 0.00 O ATOM 96990 H1 WAT 1828 141.772 18.053 127.647 1.00 0.00 H ATOM 96991 H2 WAT 1828 141.062 19.149 128.412 1.00 0.00 H TER 96993 WAT 1828 ATOM 96993 O WAT 1829 63.500 35.066 0.266 1.00 0.00 O ATOM 96994 H1 WAT 1829 64.408 34.958 0.547 1.00 0.00 H ATOM 96995 H2 WAT 1829 63.225 35.895 0.659 1.00 0.00 H TER 96997 WAT 1829 ATOM 96997 O WAT 1830 108.658 9.588 124.372 1.00 0.00 O ATOM 96998 H1 WAT 1830 107.866 9.654 123.839 1.00 0.00 H ATOM 96999 H2 WAT 1830 108.510 10.194 125.097 1.00 0.00 H TER 97001 WAT 1830 ATOM 97001 O WAT 1831 36.531 120.917 83.215 1.00 0.00 O ATOM 97002 H1 WAT 1831 36.111 121.519 83.829 1.00 0.00 H ATOM 97003 H2 WAT 1831 37.468 121.090 83.312 1.00 0.00 H TER 97005 WAT 1831 ATOM 97005 O WAT 1832 109.849 140.462 148.090 1.00 0.00 O ATOM 97006 H1 WAT 1832 109.458 140.502 147.217 1.00 0.00 H ATOM 97007 H2 WAT 1832 110.554 141.109 148.067 1.00 0.00 H TER 97009 WAT 1832 ATOM 97009 O WAT 1833 121.653 37.386 11.399 1.00 0.00 O ATOM 97010 H1 WAT 1833 120.914 36.879 11.733 1.00 0.00 H ATOM 97011 H2 WAT 1833 121.575 37.324 10.447 1.00 0.00 H TER 97013 WAT 1833 ATOM 97013 O WAT 1834 25.407 3.616 6.765 1.00 0.00 O ATOM 97014 H1 WAT 1834 24.995 4.468 6.622 1.00 0.00 H ATOM 97015 H2 WAT 1834 26.147 3.803 7.344 1.00 0.00 H TER 97017 WAT 1834 ATOM 97017 O WAT 1835 35.044 5.500 101.441 1.00 0.00 O ATOM 97018 H1 WAT 1835 35.596 5.108 102.117 1.00 0.00 H ATOM 97019 H2 WAT 1835 34.977 4.825 100.765 1.00 0.00 H TER 97021 WAT 1835 ATOM 97021 O WAT 1836 129.487 5.236 93.978 1.00 0.00 O ATOM 97022 H1 WAT 1836 129.552 4.328 93.682 1.00 0.00 H ATOM 97023 H2 WAT 1836 130.221 5.679 93.552 1.00 0.00 H TER 97025 WAT 1836 ATOM 97025 O WAT 1837 9.014 30.789 87.859 1.00 0.00 O ATOM 97026 H1 WAT 1837 8.259 30.892 88.439 1.00 0.00 H ATOM 97027 H2 WAT 1837 9.772 30.843 88.441 1.00 0.00 H TER 97029 WAT 1837 ATOM 97029 O WAT 1838 24.101 81.326 99.254 1.00 0.00 O ATOM 97030 H1 WAT 1838 23.511 80.593 99.431 1.00 0.00 H ATOM 97031 H2 WAT 1838 24.940 81.053 99.625 1.00 0.00 H TER 97033 WAT 1838 ATOM 97033 O WAT 1839 89.271 34.034 122.002 1.00 0.00 O ATOM 97034 H1 WAT 1839 89.138 34.900 121.615 1.00 0.00 H ATOM 97035 H2 WAT 1839 90.195 34.023 122.251 1.00 0.00 H TER 97037 WAT 1839 ATOM 97037 O WAT 1840 10.576 40.894 78.997 1.00 0.00 O ATOM 97038 H1 WAT 1840 10.074 41.688 78.813 1.00 0.00 H ATOM 97039 H2 WAT 1840 9.915 40.239 79.222 1.00 0.00 H TER 97041 WAT 1840 ATOM 97041 O WAT 1841 27.658 116.004 132.840 1.00 0.00 O ATOM 97042 H1 WAT 1841 26.724 115.864 132.685 1.00 0.00 H ATOM 97043 H2 WAT 1841 28.044 116.034 131.965 1.00 0.00 H TER 97045 WAT 1841 ATOM 97045 O WAT 1842 25.017 75.235 107.023 1.00 0.00 O ATOM 97046 H1 WAT 1842 25.368 76.094 107.258 1.00 0.00 H ATOM 97047 H2 WAT 1842 24.109 75.256 107.326 1.00 0.00 H TER 97049 WAT 1842 ATOM 97049 O WAT 1843 42.393 23.973 154.930 1.00 0.00 O ATOM 97050 H1 WAT 1843 42.480 23.082 155.270 1.00 0.00 H ATOM 97051 H2 WAT 1843 42.194 24.505 155.701 1.00 0.00 H TER 97053 WAT 1843 ATOM 97053 O WAT 1844 65.189 76.244 156.984 1.00 0.00 O ATOM 97054 H1 WAT 1844 65.484 77.113 156.712 1.00 0.00 H ATOM 97055 H2 WAT 1844 64.447 76.413 157.564 1.00 0.00 H TER 97057 WAT 1844 ATOM 97057 O WAT 1845 91.475 23.050 91.563 1.00 0.00 O ATOM 97058 H1 WAT 1845 90.908 23.551 92.149 1.00 0.00 H ATOM 97059 H2 WAT 1845 92.058 22.567 92.149 1.00 0.00 H TER 97061 WAT 1845 ATOM 97061 O WAT 1846 97.126 13.053 119.480 1.00 0.00 O ATOM 97062 H1 WAT 1846 96.756 13.639 118.820 1.00 0.00 H ATOM 97063 H2 WAT 1846 97.689 13.615 120.012 1.00 0.00 H TER 97065 WAT 1846 ATOM 97065 O WAT 1847 45.890 143.133 21.642 1.00 0.00 O ATOM 97066 H1 WAT 1847 46.043 142.355 22.178 1.00 0.00 H ATOM 97067 H2 WAT 1847 46.456 143.804 22.026 1.00 0.00 H TER 97069 WAT 1847 ATOM 97069 O WAT 1848 35.322 100.499 20.431 1.00 0.00 O ATOM 97070 H1 WAT 1848 36.057 100.899 19.966 1.00 0.00 H ATOM 97071 H2 WAT 1848 35.055 101.160 21.069 1.00 0.00 H TER 97073 WAT 1848 ATOM 97073 O WAT 1849 60.959 24.352 122.723 1.00 0.00 O ATOM 97074 H1 WAT 1849 61.209 24.617 121.838 1.00 0.00 H ATOM 97075 H2 WAT 1849 60.743 23.423 122.643 1.00 0.00 H TER 97077 WAT 1849 ATOM 97077 O WAT 1850 74.016 80.189 93.882 1.00 0.00 O ATOM 97078 H1 WAT 1850 74.849 79.757 94.069 1.00 0.00 H ATOM 97079 H2 WAT 1850 74.018 80.311 92.932 1.00 0.00 H TER 97081 WAT 1850 ATOM 97081 O WAT 1851 14.738 101.308 22.057 1.00 0.00 O ATOM 97082 H1 WAT 1851 14.762 100.351 22.050 1.00 0.00 H ATOM 97083 H2 WAT 1851 14.061 101.526 22.698 1.00 0.00 H TER 97085 WAT 1851 ATOM 97085 O WAT 1852 0.308 121.157 70.592 1.00 0.00 O ATOM 97086 H1 WAT 1852 0.446 121.202 71.538 1.00 0.00 H ATOM 97087 H2 WAT 1852 -0.350 120.472 70.478 1.00 0.00 H TER 97089 WAT 1852 ATOM 97089 O WAT 1853 89.235 76.124 98.695 1.00 0.00 O ATOM 97090 H1 WAT 1853 89.019 75.450 99.340 1.00 0.00 H ATOM 97091 H2 WAT 1853 89.996 76.572 99.063 1.00 0.00 H TER 97093 WAT 1853 ATOM 97093 O WAT 1854 127.113 143.098 1.169 1.00 0.00 O ATOM 97094 H1 WAT 1854 127.663 142.335 1.346 1.00 0.00 H ATOM 97095 H2 WAT 1854 126.226 142.745 1.101 1.00 0.00 H TER 97097 WAT 1854 ATOM 97097 O WAT 1855 86.961 44.067 136.374 1.00 0.00 O ATOM 97098 H1 WAT 1855 86.385 44.090 137.138 1.00 0.00 H ATOM 97099 H2 WAT 1855 87.257 44.972 136.270 1.00 0.00 H TER 97101 WAT 1855 ATOM 97101 O WAT 1856 9.776 129.849 151.534 1.00 0.00 O ATOM 97102 H1 WAT 1856 10.512 129.493 151.037 1.00 0.00 H ATOM 97103 H2 WAT 1856 9.948 129.586 152.438 1.00 0.00 H TER 97105 WAT 1856 ATOM 97105 O WAT 1857 59.517 7.157 96.483 1.00 0.00 O ATOM 97106 H1 WAT 1857 60.460 7.092 96.337 1.00 0.00 H ATOM 97107 H2 WAT 1857 59.429 7.302 97.426 1.00 0.00 H TER 97109 WAT 1857 ATOM 97109 O WAT 1858 58.606 122.267 50.426 1.00 0.00 O ATOM 97110 H1 WAT 1858 59.477 122.600 50.207 1.00 0.00 H ATOM 97111 H2 WAT 1858 58.003 122.922 50.074 1.00 0.00 H TER 97113 WAT 1858 ATOM 97113 O WAT 1859 115.354 144.267 130.439 1.00 0.00 O ATOM 97114 H1 WAT 1859 115.312 144.180 129.487 1.00 0.00 H ATOM 97115 H2 WAT 1859 116.274 144.458 130.621 1.00 0.00 H TER 97117 WAT 1859 ATOM 97117 O WAT 1860 71.432 136.920 154.594 1.00 0.00 O ATOM 97118 H1 WAT 1860 70.645 137.452 154.471 1.00 0.00 H ATOM 97119 H2 WAT 1860 71.500 136.404 153.790 1.00 0.00 H TER 97121 WAT 1860 ATOM 97121 O WAT 1861 112.044 30.467 28.916 1.00 0.00 O ATOM 97122 H1 WAT 1861 112.854 30.977 28.929 1.00 0.00 H ATOM 97123 H2 WAT 1861 111.423 31.016 28.439 1.00 0.00 H TER 97125 WAT 1861 ATOM 97125 O WAT 1862 53.151 100.965 71.304 1.00 0.00 O ATOM 97126 H1 WAT 1862 52.615 100.543 71.975 1.00 0.00 H ATOM 97127 H2 WAT 1862 54.014 100.561 71.396 1.00 0.00 H TER 97129 WAT 1862 ATOM 97129 O WAT 1863 53.539 115.892 133.177 1.00 0.00 O ATOM 97130 H1 WAT 1863 53.069 116.333 133.885 1.00 0.00 H ATOM 97131 H2 WAT 1863 54.032 116.590 132.745 1.00 0.00 H TER 97133 WAT 1863 ATOM 97133 O WAT 1864 80.795 44.522 80.650 1.00 0.00 O ATOM 97134 H1 WAT 1864 79.865 44.668 80.825 1.00 0.00 H ATOM 97135 H2 WAT 1864 80.832 43.645 80.268 1.00 0.00 H TER 97137 WAT 1864 ATOM 97137 O WAT 1865 107.699 95.902 93.270 1.00 0.00 O ATOM 97138 H1 WAT 1865 108.038 96.547 92.649 1.00 0.00 H ATOM 97139 H2 WAT 1865 108.249 96.004 94.046 1.00 0.00 H TER 97141 WAT 1865 ATOM 97141 O WAT 1866 78.860 103.210 121.271 1.00 0.00 O ATOM 97142 H1 WAT 1866 79.596 102.619 121.108 1.00 0.00 H ATOM 97143 H2 WAT 1866 78.090 102.715 120.990 1.00 0.00 H TER 97145 WAT 1866 ATOM 97145 O WAT 1867 72.983 79.929 62.232 1.00 0.00 O ATOM 97146 H1 WAT 1867 73.256 79.908 63.149 1.00 0.00 H ATOM 97147 H2 WAT 1867 73.799 79.847 61.738 1.00 0.00 H TER 97149 WAT 1867 ATOM 97149 O WAT 1868 79.467 105.180 12.679 1.00 0.00 O ATOM 97150 H1 WAT 1868 79.821 104.595 13.349 1.00 0.00 H ATOM 97151 H2 WAT 1868 78.542 105.274 12.907 1.00 0.00 H TER 97153 WAT 1868 ATOM 97153 O WAT 1869 10.065 99.096 80.232 1.00 0.00 O ATOM 97154 H1 WAT 1869 10.610 99.883 80.241 1.00 0.00 H ATOM 97155 H2 WAT 1869 10.686 98.374 80.332 1.00 0.00 H TER 97157 WAT 1869 ATOM 97157 O WAT 1870 77.348 96.739 150.540 1.00 0.00 O ATOM 97158 H1 WAT 1870 77.441 97.619 150.174 1.00 0.00 H ATOM 97159 H2 WAT 1870 77.050 96.884 151.438 1.00 0.00 H TER 97161 WAT 1870 ATOM 97161 O WAT 1871 18.371 140.378 72.657 1.00 0.00 O ATOM 97162 H1 WAT 1871 18.221 141.167 73.177 1.00 0.00 H ATOM 97163 H2 WAT 1871 17.831 139.708 73.075 1.00 0.00 H TER 97165 WAT 1871 ATOM 97165 O WAT 1872 64.598 131.129 7.054 1.00 0.00 O ATOM 97166 H1 WAT 1872 64.881 130.226 7.199 1.00 0.00 H ATOM 97167 H2 WAT 1872 63.651 131.109 7.196 1.00 0.00 H TER 97169 WAT 1872 ATOM 97169 O WAT 1873 77.557 117.156 98.401 1.00 0.00 O ATOM 97170 H1 WAT 1873 77.053 117.274 97.596 1.00 0.00 H ATOM 97171 H2 WAT 1873 78.442 116.950 98.101 1.00 0.00 H TER 97173 WAT 1873 ATOM 97173 O WAT 1874 99.656 140.532 60.757 1.00 0.00 O ATOM 97174 H1 WAT 1874 99.382 140.835 59.891 1.00 0.00 H ATOM 97175 H2 WAT 1874 99.094 141.009 61.367 1.00 0.00 H TER 97177 WAT 1874 ATOM 97177 O WAT 1875 25.267 49.390 154.407 1.00 0.00 O ATOM 97178 H1 WAT 1875 24.978 48.863 155.152 1.00 0.00 H ATOM 97179 H2 WAT 1875 25.034 48.867 153.639 1.00 0.00 H TER 97181 WAT 1875 ATOM 97181 O WAT 1876 48.816 20.355 78.136 1.00 0.00 O ATOM 97182 H1 WAT 1876 49.488 20.252 78.811 1.00 0.00 H ATOM 97183 H2 WAT 1876 49.082 19.755 77.440 1.00 0.00 H TER 97185 WAT 1876 ATOM 97185 O WAT 1877 14.361 103.369 56.909 1.00 0.00 O ATOM 97186 H1 WAT 1877 14.471 103.862 56.097 1.00 0.00 H ATOM 97187 H2 WAT 1877 13.870 102.589 56.652 1.00 0.00 H TER 97189 WAT 1877 ATOM 97189 O WAT 1878 63.455 2.562 15.871 1.00 0.00 O ATOM 97190 H1 WAT 1878 63.519 1.607 15.854 1.00 0.00 H ATOM 97191 H2 WAT 1878 62.650 2.757 15.391 1.00 0.00 H TER 97193 WAT 1878 ATOM 97193 O WAT 1879 38.160 62.012 133.968 1.00 0.00 O ATOM 97194 H1 WAT 1879 38.392 62.232 134.870 1.00 0.00 H ATOM 97195 H2 WAT 1879 37.745 62.804 133.627 1.00 0.00 H TER 97197 WAT 1879 ATOM 97197 O WAT 1880 128.876 139.415 119.019 1.00 0.00 O ATOM 97198 H1 WAT 1880 128.211 138.844 119.403 1.00 0.00 H ATOM 97199 H2 WAT 1880 128.507 139.678 118.175 1.00 0.00 H TER 97201 WAT 1880 ATOM 97201 O WAT 1881 18.083 94.525 142.079 1.00 0.00 O ATOM 97202 H1 WAT 1881 17.499 94.177 141.405 1.00 0.00 H ATOM 97203 H2 WAT 1881 17.669 95.341 142.357 1.00 0.00 H TER 97205 WAT 1881 ATOM 97205 O WAT 1882 66.887 70.315 89.043 1.00 0.00 O ATOM 97206 H1 WAT 1882 66.740 70.771 89.871 1.00 0.00 H ATOM 97207 H2 WAT 1882 66.054 69.885 88.855 1.00 0.00 H TER 97209 WAT 1882 ATOM 97209 O WAT 1883 59.912 19.143 105.579 1.00 0.00 O ATOM 97210 H1 WAT 1883 59.648 20.025 105.318 1.00 0.00 H ATOM 97211 H2 WAT 1883 60.680 19.277 106.134 1.00 0.00 H TER 97213 WAT 1883 ATOM 97213 O WAT 1884 67.328 85.105 119.894 1.00 0.00 O ATOM 97214 H1 WAT 1884 68.064 84.503 119.781 1.00 0.00 H ATOM 97215 H2 WAT 1884 67.634 85.738 120.543 1.00 0.00 H TER 97217 WAT 1884 ATOM 97217 O WAT 1885 108.655 94.538 79.936 1.00 0.00 O ATOM 97218 H1 WAT 1885 109.010 95.003 79.178 1.00 0.00 H ATOM 97219 H2 WAT 1885 108.934 93.631 79.813 1.00 0.00 H TER 97221 WAT 1885 ATOM 97221 O WAT 1886 53.507 113.830 50.460 1.00 0.00 O ATOM 97222 H1 WAT 1886 52.679 113.417 50.216 1.00 0.00 H ATOM 97223 H2 WAT 1886 53.711 113.466 51.321 1.00 0.00 H TER 97225 WAT 1886 ATOM 97225 O WAT 1887 77.850 138.061 88.586 1.00 0.00 O ATOM 97226 H1 WAT 1887 77.446 138.925 88.665 1.00 0.00 H ATOM 97227 H2 WAT 1887 78.678 138.139 89.060 1.00 0.00 H TER 97229 WAT 1887 ATOM 97229 O WAT 1888 140.801 72.635 4.161 1.00 0.00 O ATOM 97230 H1 WAT 1888 140.808 72.004 4.880 1.00 0.00 H ATOM 97231 H2 WAT 1888 141.627 73.111 4.251 1.00 0.00 H TER 97233 WAT 1888 ATOM 97233 O WAT 1889 46.476 122.725 100.865 1.00 0.00 O ATOM 97234 H1 WAT 1889 47.103 122.122 100.467 1.00 0.00 H ATOM 97235 H2 WAT 1889 47.015 123.334 101.370 1.00 0.00 H TER 97237 WAT 1889 ATOM 97237 O WAT 1890 114.347 85.347 123.618 1.00 0.00 O ATOM 97238 H1 WAT 1890 113.892 84.507 123.559 1.00 0.00 H ATOM 97239 H2 WAT 1890 113.646 85.998 123.635 1.00 0.00 H TER 97241 WAT 1890 ATOM 97241 O WAT 1891 58.818 32.962 86.954 1.00 0.00 O ATOM 97242 H1 WAT 1891 58.699 32.409 86.182 1.00 0.00 H ATOM 97243 H2 WAT 1891 58.025 33.497 86.990 1.00 0.00 H TER 97245 WAT 1891 ATOM 97245 O WAT 1892 112.877 38.697 126.205 1.00 0.00 O ATOM 97246 H1 WAT 1892 112.534 37.811 126.320 1.00 0.00 H ATOM 97247 H2 WAT 1892 113.730 38.682 126.640 1.00 0.00 H TER 97249 WAT 1892 ATOM 97249 O WAT 1893 34.330 58.006 132.384 1.00 0.00 O ATOM 97250 H1 WAT 1893 34.238 58.956 132.451 1.00 0.00 H ATOM 97251 H2 WAT 1893 33.468 57.665 132.623 1.00 0.00 H TER 97253 WAT 1893 ATOM 97253 O WAT 1894 75.506 45.958 84.788 1.00 0.00 O ATOM 97254 H1 WAT 1894 75.755 46.332 83.942 1.00 0.00 H ATOM 97255 H2 WAT 1894 74.679 46.388 85.005 1.00 0.00 H TER 97257 WAT 1894 ATOM 97257 O WAT 1895 11.917 34.349 112.933 1.00 0.00 O ATOM 97258 H1 WAT 1895 12.643 34.076 113.495 1.00 0.00 H ATOM 97259 H2 WAT 1895 11.707 35.236 113.227 1.00 0.00 H TER 97261 WAT 1895 ATOM 97261 O WAT 1896 132.480 42.056 129.842 1.00 0.00 O ATOM 97262 H1 WAT 1896 132.591 41.332 129.225 1.00 0.00 H ATOM 97263 H2 WAT 1896 132.067 42.748 129.326 1.00 0.00 H TER 97265 WAT 1896 ATOM 97265 O WAT 1897 117.401 83.751 98.328 1.00 0.00 O ATOM 97266 H1 WAT 1897 117.526 84.620 97.945 1.00 0.00 H ATOM 97267 H2 WAT 1897 116.931 83.916 99.146 1.00 0.00 H TER 97269 WAT 1897 ATOM 97269 O WAT 1898 107.382 108.927 112.603 1.00 0.00 O ATOM 97270 H1 WAT 1898 107.452 108.605 113.502 1.00 0.00 H ATOM 97271 H2 WAT 1898 106.910 108.236 112.138 1.00 0.00 H TER 97273 WAT 1898 ATOM 97273 O WAT 1899 10.491 91.625 91.304 1.00 0.00 O ATOM 97274 H1 WAT 1899 10.645 92.152 90.520 1.00 0.00 H ATOM 97275 H2 WAT 1899 10.522 92.254 92.025 1.00 0.00 H TER 97277 WAT 1899 ATOM 97277 O WAT 1900 107.303 63.368 110.401 1.00 0.00 O ATOM 97278 H1 WAT 1900 106.683 62.885 110.947 1.00 0.00 H ATOM 97279 H2 WAT 1900 107.275 64.263 110.740 1.00 0.00 H TER 97281 WAT 1900 ATOM 97281 O WAT 1901 54.313 87.646 25.454 1.00 0.00 O ATOM 97282 H1 WAT 1901 55.074 87.895 24.929 1.00 0.00 H ATOM 97283 H2 WAT 1901 53.735 87.193 24.839 1.00 0.00 H TER 97285 WAT 1901 ATOM 97285 O WAT 1902 7.699 42.787 146.846 1.00 0.00 O ATOM 97286 H1 WAT 1902 8.584 42.813 146.482 1.00 0.00 H ATOM 97287 H2 WAT 1902 7.584 41.881 147.131 1.00 0.00 H TER 97289 WAT 1902 ATOM 97289 O WAT 1903 41.751 26.473 72.987 1.00 0.00 O ATOM 97290 H1 WAT 1903 40.942 26.669 73.461 1.00 0.00 H ATOM 97291 H2 WAT 1903 42.186 25.808 73.521 1.00 0.00 H TER 97293 WAT 1903 ATOM 97293 O WAT 1904 129.041 21.029 149.430 1.00 0.00 O ATOM 97294 H1 WAT 1904 128.998 21.973 149.273 1.00 0.00 H ATOM 97295 H2 WAT 1904 129.847 20.907 149.932 1.00 0.00 H TER 97297 WAT 1904 ATOM 97297 O WAT 1905 121.974 22.121 151.783 1.00 0.00 O ATOM 97298 H1 WAT 1905 122.008 23.074 151.710 1.00 0.00 H ATOM 97299 H2 WAT 1905 121.500 21.960 152.599 1.00 0.00 H TER 97301 WAT 1905 ATOM 97301 O WAT 1906 21.036 83.462 87.812 1.00 0.00 O ATOM 97302 H1 WAT 1906 20.895 82.527 87.663 1.00 0.00 H ATOM 97303 H2 WAT 1906 20.709 83.615 88.698 1.00 0.00 H TER 97305 WAT 1906 ATOM 97305 O WAT 1907 120.098 42.680 137.781 1.00 0.00 O ATOM 97306 H1 WAT 1907 120.410 41.794 137.599 1.00 0.00 H ATOM 97307 H2 WAT 1907 119.884 43.040 136.920 1.00 0.00 H TER 97309 WAT 1907 ATOM 97309 O WAT 1908 9.625 111.544 13.051 1.00 0.00 O ATOM 97310 H1 WAT 1908 8.736 111.847 12.864 1.00 0.00 H ATOM 97311 H2 WAT 1908 10.074 112.316 13.395 1.00 0.00 H TER 97313 WAT 1908 ATOM 97313 O WAT 1909 52.029 34.907 55.455 1.00 0.00 O ATOM 97314 H1 WAT 1909 51.159 35.282 55.589 1.00 0.00 H ATOM 97315 H2 WAT 1909 52.414 34.875 56.331 1.00 0.00 H TER 97317 WAT 1909 ATOM 97317 O WAT 1910 63.280 119.089 113.877 1.00 0.00 O ATOM 97318 H1 WAT 1910 62.732 118.606 113.259 1.00 0.00 H ATOM 97319 H2 WAT 1910 64.117 119.194 113.424 1.00 0.00 H TER 97321 WAT 1910 ATOM 97321 O WAT 1911 61.059 4.755 4.202 1.00 0.00 O ATOM 97322 H1 WAT 1911 61.593 4.004 4.461 1.00 0.00 H ATOM 97323 H2 WAT 1911 60.157 4.468 4.346 1.00 0.00 H TER 97325 WAT 1911 ATOM 97325 O WAT 1912 64.173 30.325 99.633 1.00 0.00 O ATOM 97326 H1 WAT 1912 63.659 30.958 99.132 1.00 0.00 H ATOM 97327 H2 WAT 1912 63.721 29.492 99.500 1.00 0.00 H TER 97329 WAT 1912 ATOM 97329 O WAT 1913 15.685 22.652 111.589 1.00 0.00 O ATOM 97330 H1 WAT 1913 16.506 23.094 111.803 1.00 0.00 H ATOM 97331 H2 WAT 1913 15.776 21.779 111.971 1.00 0.00 H TER 97333 WAT 1913 ATOM 97333 O WAT 1914 110.609 101.358 125.245 1.00 0.00 O ATOM 97334 H1 WAT 1914 111.226 100.977 124.620 1.00 0.00 H ATOM 97335 H2 WAT 1914 109.766 101.334 124.793 1.00 0.00 H TER 97337 WAT 1914 ATOM 97337 O WAT 1915 50.986 39.813 122.802 1.00 0.00 O ATOM 97338 H1 WAT 1915 50.803 38.933 123.129 1.00 0.00 H ATOM 97339 H2 WAT 1915 51.628 39.681 122.104 1.00 0.00 H TER 97341 WAT 1915 ATOM 97341 O WAT 1916 42.534 54.585 137.442 1.00 0.00 O ATOM 97342 H1 WAT 1916 43.136 53.982 137.006 1.00 0.00 H ATOM 97343 H2 WAT 1916 42.005 54.950 136.732 1.00 0.00 H TER 97345 WAT 1916 ATOM 97345 O WAT 1917 41.304 28.609 16.573 1.00 0.00 O ATOM 97346 H1 WAT 1917 41.763 28.832 15.762 1.00 0.00 H ATOM 97347 H2 WAT 1917 41.249 29.436 17.052 1.00 0.00 H TER 97349 WAT 1917 ATOM 97349 O WAT 1918 53.768 112.173 17.323 1.00 0.00 O ATOM 97350 H1 WAT 1918 53.769 112.032 18.269 1.00 0.00 H ATOM 97351 H2 WAT 1918 53.883 111.299 16.950 1.00 0.00 H TER 97353 WAT 1918 ATOM 97353 O WAT 1919 114.796 123.125 16.500 1.00 0.00 O ATOM 97354 H1 WAT 1919 113.952 123.040 16.943 1.00 0.00 H ATOM 97355 H2 WAT 1919 114.794 122.427 15.845 1.00 0.00 H TER 97357 WAT 1919 ATOM 97357 O WAT 1920 6.939 98.608 152.665 1.00 0.00 O ATOM 97358 H1 WAT 1920 6.476 98.766 153.487 1.00 0.00 H ATOM 97359 H2 WAT 1920 6.680 99.335 152.100 1.00 0.00 H TER 97361 WAT 1920 ATOM 97361 O WAT 1921 108.524 63.237 69.197 1.00 0.00 O ATOM 97362 H1 WAT 1921 108.908 62.425 68.867 1.00 0.00 H ATOM 97363 H2 WAT 1921 109.248 63.864 69.191 1.00 0.00 H TER 97365 WAT 1921 ATOM 97365 O WAT 1922 91.500 1.904 138.635 1.00 0.00 O ATOM 97366 H1 WAT 1922 92.108 2.023 137.906 1.00 0.00 H ATOM 97367 H2 WAT 1922 90.919 2.663 138.589 1.00 0.00 H TER 97369 WAT 1922 ATOM 97369 O WAT 1923 19.170 139.781 126.295 1.00 0.00 O ATOM 97370 H1 WAT 1923 18.407 139.203 126.300 1.00 0.00 H ATOM 97371 H2 WAT 1923 19.247 140.083 127.200 1.00 0.00 H TER 97373 WAT 1923 ATOM 97373 O WAT 1924 13.392 4.821 12.326 1.00 0.00 O ATOM 97374 H1 WAT 1924 12.698 4.762 11.670 1.00 0.00 H ATOM 97375 H2 WAT 1924 14.147 4.399 11.915 1.00 0.00 H TER 97377 WAT 1924 ATOM 97377 O WAT 1925 5.676 60.088 80.106 1.00 0.00 O ATOM 97378 H1 WAT 1925 6.504 60.567 80.068 1.00 0.00 H ATOM 97379 H2 WAT 1925 5.858 59.259 79.664 1.00 0.00 H TER 97381 WAT 1925 ATOM 97381 O WAT 1926 48.595 118.202 119.840 1.00 0.00 O ATOM 97382 H1 WAT 1926 48.793 118.896 119.212 1.00 0.00 H ATOM 97383 H2 WAT 1926 48.901 117.400 119.415 1.00 0.00 H TER 97385 WAT 1926 ATOM 97385 O WAT 1927 92.261 54.147 16.514 1.00 0.00 O ATOM 97386 H1 WAT 1927 91.342 54.405 16.445 1.00 0.00 H ATOM 97387 H2 WAT 1927 92.344 53.395 15.928 1.00 0.00 H TER 97389 WAT 1927 ATOM 97389 O WAT 1928 47.803 119.275 153.023 1.00 0.00 O ATOM 97390 H1 WAT 1928 47.621 119.958 152.377 1.00 0.00 H ATOM 97391 H2 WAT 1928 48.277 119.726 153.722 1.00 0.00 H TER 97393 WAT 1928 ATOM 97393 O WAT 1929 15.689 145.765 101.761 1.00 0.00 O ATOM 97394 H1 WAT 1929 16.002 145.402 102.589 1.00 0.00 H ATOM 97395 H2 WAT 1929 14.862 145.312 101.597 1.00 0.00 H TER 97397 WAT 1929 ATOM 97397 O WAT 1930 87.295 137.873 146.280 1.00 0.00 O ATOM 97398 H1 WAT 1930 87.517 137.475 147.122 1.00 0.00 H ATOM 97399 H2 WAT 1930 86.413 138.223 146.406 1.00 0.00 H TER 97401 WAT 1930 ATOM 97401 O WAT 1931 122.440 102.141 99.075 1.00 0.00 O ATOM 97402 H1 WAT 1931 122.961 101.789 98.353 1.00 0.00 H ATOM 97403 H2 WAT 1931 122.782 103.025 99.209 1.00 0.00 H TER 97405 WAT 1931 ATOM 97405 O WAT 1932 102.871 46.530 131.877 1.00 0.00 O ATOM 97406 H1 WAT 1932 102.829 46.436 130.925 1.00 0.00 H ATOM 97407 H2 WAT 1932 103.779 46.321 132.098 1.00 0.00 H TER 97409 WAT 1932 ATOM 97409 O WAT 1933 133.624 136.576 143.346 1.00 0.00 O ATOM 97410 H1 WAT 1933 133.809 136.993 142.505 1.00 0.00 H ATOM 97411 H2 WAT 1933 133.233 137.270 143.876 1.00 0.00 H TER 97413 WAT 1933 ATOM 97413 O WAT 1934 114.323 93.585 84.843 1.00 0.00 O ATOM 97414 H1 WAT 1934 113.648 93.213 84.274 1.00 0.00 H ATOM 97415 H2 WAT 1934 113.904 93.647 85.702 1.00 0.00 H TER 97417 WAT 1934 ATOM 97417 O WAT 1935 104.915 16.007 139.029 1.00 0.00 O ATOM 97418 H1 WAT 1935 103.992 15.795 138.890 1.00 0.00 H ATOM 97419 H2 WAT 1935 105.350 15.723 138.225 1.00 0.00 H TER 97421 WAT 1935 ATOM 97421 O WAT 1936 36.058 133.371 111.914 1.00 0.00 O ATOM 97422 H1 WAT 1936 36.930 133.549 111.560 1.00 0.00 H ATOM 97423 H2 WAT 1936 35.722 132.656 111.374 1.00 0.00 H TER 97425 WAT 1936 ATOM 97425 O WAT 1937 125.615 9.376 68.365 1.00 0.00 O ATOM 97426 H1 WAT 1937 126.549 9.174 68.410 1.00 0.00 H ATOM 97427 H2 WAT 1937 125.208 8.563 68.067 1.00 0.00 H TER 97429 WAT 1937 ATOM 97429 O WAT 1938 113.967 87.006 7.790 1.00 0.00 O ATOM 97430 H1 WAT 1938 114.726 87.346 8.264 1.00 0.00 H ATOM 97431 H2 WAT 1938 113.258 87.613 8.005 1.00 0.00 H TER 97433 WAT 1938 ATOM 97433 O WAT 1939 90.838 5.522 103.042 1.00 0.00 O ATOM 97434 H1 WAT 1939 91.362 6.323 103.059 1.00 0.00 H ATOM 97435 H2 WAT 1939 91.196 5.017 102.311 1.00 0.00 H TER 97437 WAT 1939 ATOM 97437 O WAT 1940 82.629 34.762 72.281 1.00 0.00 O ATOM 97438 H1 WAT 1940 83.293 35.355 72.634 1.00 0.00 H ATOM 97439 H2 WAT 1940 82.810 34.733 71.341 1.00 0.00 H TER 97441 WAT 1940 ATOM 97441 O WAT 1941 102.858 25.497 94.731 1.00 0.00 O ATOM 97442 H1 WAT 1941 102.450 24.914 95.371 1.00 0.00 H ATOM 97443 H2 WAT 1941 103.795 25.315 94.804 1.00 0.00 H TER 97445 WAT 1941 ATOM 97445 O WAT 1942 52.249 124.347 111.082 1.00 0.00 O ATOM 97446 H1 WAT 1942 52.121 124.617 110.172 1.00 0.00 H ATOM 97447 H2 WAT 1942 52.953 123.699 111.042 1.00 0.00 H TER 97449 WAT 1942 ATOM 97449 O WAT 1943 108.468 60.399 143.726 1.00 0.00 O ATOM 97450 H1 WAT 1943 108.568 61.210 143.227 1.00 0.00 H ATOM 97451 H2 WAT 1943 108.144 60.682 144.581 1.00 0.00 H TER 97453 WAT 1943 ATOM 97453 O WAT 1944 114.470 41.198 78.182 1.00 0.00 O ATOM 97454 H1 WAT 1944 115.193 41.277 77.558 1.00 0.00 H ATOM 97455 H2 WAT 1944 114.782 41.647 78.967 1.00 0.00 H TER 97457 WAT 1944 ATOM 97457 O WAT 1945 3.652 117.192 125.927 1.00 0.00 O ATOM 97458 H1 WAT 1945 4.146 117.013 125.126 1.00 0.00 H ATOM 97459 H2 WAT 1945 3.923 116.504 126.534 1.00 0.00 H TER 97461 WAT 1945 ATOM 97461 O WAT 1946 16.216 130.754 146.831 1.00 0.00 O ATOM 97462 H1 WAT 1946 17.087 130.456 146.570 1.00 0.00 H ATOM 97463 H2 WAT 1946 16.130 131.621 146.434 1.00 0.00 H TER 97465 WAT 1946 ATOM 97465 O WAT 1947 92.834 87.294 153.427 1.00 0.00 O ATOM 97466 H1 WAT 1947 93.668 87.066 153.837 1.00 0.00 H ATOM 97467 H2 WAT 1947 92.752 88.238 153.561 1.00 0.00 H TER 97469 WAT 1947 ATOM 97469 O WAT 1948 133.020 145.751 119.964 1.00 0.00 O ATOM 97470 H1 WAT 1948 133.575 145.082 120.364 1.00 0.00 H ATOM 97471 H2 WAT 1948 133.491 146.010 119.172 1.00 0.00 H TER 97473 WAT 1948 ATOM 97473 O WAT 1949 139.494 76.794 154.768 1.00 0.00 O ATOM 97474 H1 WAT 1949 138.685 76.403 155.096 1.00 0.00 H ATOM 97475 H2 WAT 1949 139.376 76.828 153.819 1.00 0.00 H TER 97477 WAT 1949 ATOM 97477 O WAT 1950 117.042 52.207 138.015 1.00 0.00 O ATOM 97478 H1 WAT 1950 117.796 52.044 138.581 1.00 0.00 H ATOM 97479 H2 WAT 1950 116.388 52.599 138.593 1.00 0.00 H TER 97481 WAT 1950 ATOM 97481 O WAT 1951 47.753 19.508 105.229 1.00 0.00 O ATOM 97482 H1 WAT 1951 47.225 18.811 105.618 1.00 0.00 H ATOM 97483 H2 WAT 1951 48.658 19.237 105.381 1.00 0.00 H TER 97485 WAT 1951 ATOM 97485 O WAT 1952 38.424 90.765 14.643 1.00 0.00 O ATOM 97486 H1 WAT 1952 38.797 89.955 14.297 1.00 0.00 H ATOM 97487 H2 WAT 1952 38.168 90.548 15.539 1.00 0.00 H TER 97489 WAT 1952 ATOM 97489 O WAT 1953 93.516 119.004 124.107 1.00 0.00 O ATOM 97490 H1 WAT 1953 94.112 119.677 124.437 1.00 0.00 H ATOM 97491 H2 WAT 1953 93.326 119.273 123.208 1.00 0.00 H TER 97493 WAT 1953 ATOM 97493 O WAT 1954 45.554 4.543 59.334 1.00 0.00 O ATOM 97494 H1 WAT 1954 44.791 4.411 58.770 1.00 0.00 H ATOM 97495 H2 WAT 1954 46.140 3.818 59.118 1.00 0.00 H TER 97497 WAT 1954 ATOM 97497 O WAT 1955 90.332 55.448 119.856 1.00 0.00 O ATOM 97498 H1 WAT 1955 89.897 55.901 119.134 1.00 0.00 H ATOM 97499 H2 WAT 1955 90.138 54.522 119.710 1.00 0.00 H TER 97501 WAT 1955 ATOM 97501 O WAT 1956 28.918 117.134 75.744 1.00 0.00 O ATOM 97502 H1 WAT 1956 29.335 117.783 76.312 1.00 0.00 H ATOM 97503 H2 WAT 1956 28.425 117.654 75.109 1.00 0.00 H TER 97505 WAT 1956 ATOM 97505 O WAT 1957 78.204 123.542 115.743 1.00 0.00 O ATOM 97506 H1 WAT 1957 78.258 123.336 116.676 1.00 0.00 H ATOM 97507 H2 WAT 1957 77.834 122.754 115.345 1.00 0.00 H TER 97509 WAT 1957 ATOM 97509 O WAT 1958 54.640 10.673 141.998 1.00 0.00 O ATOM 97510 H1 WAT 1958 54.070 10.604 142.764 1.00 0.00 H ATOM 97511 H2 WAT 1958 54.046 10.598 141.251 1.00 0.00 H TER 97513 WAT 1958 ATOM 97513 O WAT 1959 104.736 93.260 7.046 1.00 0.00 O ATOM 97514 H1 WAT 1959 105.585 92.957 6.724 1.00 0.00 H ATOM 97515 H2 WAT 1959 104.945 93.767 7.831 1.00 0.00 H TER 97517 WAT 1959 ATOM 97517 O WAT 1960 21.222 132.286 142.639 1.00 0.00 O ATOM 97518 H1 WAT 1960 20.960 132.659 141.797 1.00 0.00 H ATOM 97519 H2 WAT 1960 20.630 131.545 142.767 1.00 0.00 H TER 97521 WAT 1960 ATOM 97521 O WAT 1961 20.144 53.933 139.185 1.00 0.00 O ATOM 97522 H1 WAT 1961 19.922 53.647 138.299 1.00 0.00 H ATOM 97523 H2 WAT 1961 19.308 53.936 139.652 1.00 0.00 H TER 97525 WAT 1961 ATOM 97525 O WAT 1962 77.531 90.814 10.652 1.00 0.00 O ATOM 97526 H1 WAT 1962 78.446 90.957 10.411 1.00 0.00 H ATOM 97527 H2 WAT 1962 77.035 91.070 9.875 1.00 0.00 H TER 97529 WAT 1962 ATOM 97529 O WAT 1963 120.425 141.827 107.121 1.00 0.00 O ATOM 97530 H1 WAT 1963 120.259 140.908 107.331 1.00 0.00 H ATOM 97531 H2 WAT 1963 121.302 141.996 107.466 1.00 0.00 H TER 97533 WAT 1963 ATOM 97533 O WAT 1964 48.436 14.130 101.323 1.00 0.00 O ATOM 97534 H1 WAT 1964 48.106 13.927 100.448 1.00 0.00 H ATOM 97535 H2 WAT 1964 47.689 14.525 101.774 1.00 0.00 H TER 97537 WAT 1964 ATOM 97537 O WAT 1965 85.852 81.899 136.747 1.00 0.00 O ATOM 97538 H1 WAT 1965 85.989 81.392 137.548 1.00 0.00 H ATOM 97539 H2 WAT 1965 86.345 81.426 136.077 1.00 0.00 H TER 97541 WAT 1965 ATOM 97541 O WAT 1966 86.855 38.261 143.842 1.00 0.00 O ATOM 97542 H1 WAT 1966 87.765 38.538 143.944 1.00 0.00 H ATOM 97543 H2 WAT 1966 86.342 38.988 144.197 1.00 0.00 H TER 97545 WAT 1966 ATOM 97545 O WAT 1967 91.124 103.643 131.922 1.00 0.00 O ATOM 97546 H1 WAT 1967 91.571 103.637 132.768 1.00 0.00 H ATOM 97547 H2 WAT 1967 90.749 102.765 131.843 1.00 0.00 H TER 97549 WAT 1967 ATOM 97549 O WAT 1968 103.439 44.653 118.894 1.00 0.00 O ATOM 97550 H1 WAT 1968 103.413 45.354 119.545 1.00 0.00 H ATOM 97551 H2 WAT 1968 104.238 44.820 118.394 1.00 0.00 H TER 97553 WAT 1968 ATOM 97553 O WAT 1969 119.895 78.429 97.797 1.00 0.00 O ATOM 97554 H1 WAT 1969 119.592 78.289 98.694 1.00 0.00 H ATOM 97555 H2 WAT 1969 119.860 77.561 97.395 1.00 0.00 H TER 97557 WAT 1969 ATOM 97557 O WAT 1970 62.736 48.548 92.409 1.00 0.00 O ATOM 97558 H1 WAT 1970 63.285 47.901 92.853 1.00 0.00 H ATOM 97559 H2 WAT 1970 62.806 48.325 91.481 1.00 0.00 H TER 97561 WAT 1970 ATOM 97561 O WAT 1971 99.134 88.774 132.180 1.00 0.00 O ATOM 97562 H1 WAT 1971 98.733 89.557 131.801 1.00 0.00 H ATOM 97563 H2 WAT 1971 99.662 89.104 132.906 1.00 0.00 H TER 97565 WAT 1971 ATOM 97565 O WAT 1972 38.090 92.053 6.621 1.00 0.00 O ATOM 97566 H1 WAT 1972 38.462 92.544 7.354 1.00 0.00 H ATOM 97567 H2 WAT 1972 38.153 92.651 5.876 1.00 0.00 H TER 97569 WAT 1972 ATOM 97569 O WAT 1973 17.770 110.649 115.907 1.00 0.00 O ATOM 97570 H1 WAT 1973 18.625 110.466 116.297 1.00 0.00 H ATOM 97571 H2 WAT 1973 17.870 110.411 114.986 1.00 0.00 H TER 97573 WAT 1973 ATOM 97573 O WAT 1974 10.412 68.685 119.847 1.00 0.00 O ATOM 97574 H1 WAT 1974 10.514 67.994 119.192 1.00 0.00 H ATOM 97575 H2 WAT 1974 9.519 69.005 119.721 1.00 0.00 H TER 97577 WAT 1974 ATOM 97577 O WAT 1975 8.050 94.445 64.577 1.00 0.00 O ATOM 97578 H1 WAT 1975 8.844 93.938 64.403 1.00 0.00 H ATOM 97579 H2 WAT 1975 7.390 94.061 64.000 1.00 0.00 H TER 97581 WAT 1975 ATOM 97581 O WAT 1976 21.121 9.983 64.062 1.00 0.00 O ATOM 97582 H1 WAT 1976 20.541 10.656 63.704 1.00 0.00 H ATOM 97583 H2 WAT 1976 20.740 9.157 63.766 1.00 0.00 H TER 97585 WAT 1976 ATOM 97585 O WAT 1977 70.242 95.617 75.784 1.00 0.00 O ATOM 97586 H1 WAT 1977 70.148 96.281 76.467 1.00 0.00 H ATOM 97587 H2 WAT 1977 69.790 95.987 75.026 1.00 0.00 H TER 97589 WAT 1977 ATOM 97589 O WAT 1978 53.847 143.892 60.085 1.00 0.00 O ATOM 97590 H1 WAT 1978 53.162 143.241 60.235 1.00 0.00 H ATOM 97591 H2 WAT 1978 54.354 143.898 60.897 1.00 0.00 H TER 97593 WAT 1978 ATOM 97593 O WAT 1979 82.548 114.511 9.379 1.00 0.00 O ATOM 97594 H1 WAT 1979 82.900 115.397 9.297 1.00 0.00 H ATOM 97595 H2 WAT 1979 82.098 114.509 10.225 1.00 0.00 H TER 97597 WAT 1979 ATOM 97597 O WAT 1980 16.048 67.762 110.856 1.00 0.00 O ATOM 97598 H1 WAT 1980 16.216 68.449 110.211 1.00 0.00 H ATOM 97599 H2 WAT 1980 16.305 66.952 110.415 1.00 0.00 H TER 97601 WAT 1980 ATOM 97601 O WAT 1981 44.056 118.134 147.497 1.00 0.00 O ATOM 97602 H1 WAT 1981 44.122 118.730 146.751 1.00 0.00 H ATOM 97603 H2 WAT 1981 44.187 117.264 147.120 1.00 0.00 H TER 97605 WAT 1981 ATOM 97605 O WAT 1982 101.766 38.745 156.279 1.00 0.00 O ATOM 97606 H1 WAT 1982 102.102 38.263 155.523 1.00 0.00 H ATOM 97607 H2 WAT 1982 102.247 38.386 157.025 1.00 0.00 H TER 97609 WAT 1982 ATOM 97609 O WAT 1983 64.143 107.274 65.582 1.00 0.00 O ATOM 97610 H1 WAT 1983 64.687 107.690 66.250 1.00 0.00 H ATOM 97611 H2 WAT 1983 64.571 106.434 65.414 1.00 0.00 H TER 97613 WAT 1983 ATOM 97613 O WAT 1984 0.651 142.982 88.304 1.00 0.00 O ATOM 97614 H1 WAT 1984 1.013 143.658 88.877 1.00 0.00 H ATOM 97615 H2 WAT 1984 -0.286 143.174 88.269 1.00 0.00 H TER 97617 WAT 1984 ATOM 97617 O WAT 1985 32.780 53.971 86.408 1.00 0.00 O ATOM 97618 H1 WAT 1985 33.358 54.566 86.886 1.00 0.00 H ATOM 97619 H2 WAT 1985 31.996 53.910 86.953 1.00 0.00 H TER 97621 WAT 1985 ATOM 97621 O WAT 1986 54.320 99.386 102.638 1.00 0.00 O ATOM 97622 H1 WAT 1986 54.576 100.295 102.791 1.00 0.00 H ATOM 97623 H2 WAT 1986 53.676 99.434 101.930 1.00 0.00 H TER 97625 WAT 1986 ATOM 97625 O WAT 1987 130.543 118.934 103.622 1.00 0.00 O ATOM 97626 H1 WAT 1987 130.243 119.075 104.520 1.00 0.00 H ATOM 97627 H2 WAT 1987 131.444 118.624 103.716 1.00 0.00 H TER 97629 WAT 1987 ATOM 97629 O WAT 1988 65.501 17.968 108.472 1.00 0.00 O ATOM 97630 H1 WAT 1988 65.547 18.085 107.523 1.00 0.00 H ATOM 97631 H2 WAT 1988 66.402 18.088 108.772 1.00 0.00 H TER 97633 WAT 1988 ATOM 97633 O WAT 1989 75.860 50.073 128.468 1.00 0.00 O ATOM 97634 H1 WAT 1989 75.035 49.599 128.362 1.00 0.00 H ATOM 97635 H2 WAT 1989 75.731 50.890 127.986 1.00 0.00 H TER 97637 WAT 1989 ATOM 97637 O WAT 1990 73.872 8.643 0.542 1.00 0.00 O ATOM 97638 H1 WAT 1990 73.869 8.060 -0.218 1.00 0.00 H ATOM 97639 H2 WAT 1990 74.163 9.486 0.195 1.00 0.00 H TER 97641 WAT 1990 ATOM 97641 O WAT 1991 50.567 109.659 120.374 1.00 0.00 O ATOM 97642 H1 WAT 1991 50.723 110.396 120.965 1.00 0.00 H ATOM 97643 H2 WAT 1991 49.615 109.617 120.290 1.00 0.00 H TER 97645 WAT 1991 ATOM 97645 O WAT 1992 87.167 95.048 138.417 1.00 0.00 O ATOM 97646 H1 WAT 1992 87.700 94.266 138.560 1.00 0.00 H ATOM 97647 H2 WAT 1992 86.802 95.250 139.278 1.00 0.00 H TER 97649 WAT 1992 ATOM 97649 O WAT 1993 3.250 115.361 73.468 1.00 0.00 O ATOM 97650 H1 WAT 1993 3.743 115.984 74.003 1.00 0.00 H ATOM 97651 H2 WAT 1993 2.482 115.146 73.998 1.00 0.00 H TER 97653 WAT 1993 ATOM 97653 O WAT 1994 144.389 26.012 78.690 1.00 0.00 O ATOM 97654 H1 WAT 1994 144.727 25.574 77.908 1.00 0.00 H ATOM 97655 H2 WAT 1994 143.450 25.824 78.683 1.00 0.00 H TER 97657 WAT 1994 ATOM 97657 O WAT 1995 117.616 53.435 140.823 1.00 0.00 O ATOM 97658 H1 WAT 1995 117.661 52.930 141.635 1.00 0.00 H ATOM 97659 H2 WAT 1995 118.449 53.260 140.385 1.00 0.00 H TER 97661 WAT 1995 ATOM 97661 O WAT 1996 123.932 45.343 14.684 1.00 0.00 O ATOM 97662 H1 WAT 1996 124.609 45.199 14.022 1.00 0.00 H ATOM 97663 H2 WAT 1996 124.095 44.668 15.343 1.00 0.00 H TER 97665 WAT 1996 ATOM 97665 O WAT 1997 110.893 95.212 127.767 1.00 0.00 O ATOM 97666 H1 WAT 1997 110.813 94.412 127.249 1.00 0.00 H ATOM 97667 H2 WAT 1997 110.389 95.035 128.561 1.00 0.00 H TER 97669 WAT 1997 ATOM 97669 O WAT 1998 95.636 90.311 16.619 1.00 0.00 O ATOM 97670 H1 WAT 1998 96.063 89.498 16.889 1.00 0.00 H ATOM 97671 H2 WAT 1998 95.922 90.442 15.715 1.00 0.00 H TER 97673 WAT 1998 ATOM 97673 O WAT 1999 26.574 50.875 95.510 1.00 0.00 O ATOM 97674 H1 WAT 1999 25.789 50.400 95.237 1.00 0.00 H ATOM 97675 H2 WAT 1999 27.293 50.266 95.342 1.00 0.00 H TER 97677 WAT 1999 ATOM 97677 O WAT 2000 91.741 46.435 19.107 1.00 0.00 O ATOM 97678 H1 WAT 2000 91.109 45.924 19.612 1.00 0.00 H ATOM 97679 H2 WAT 2000 92.401 46.699 19.748 1.00 0.00 H TER 97681 WAT 2000 ATOM 97681 O WAT 2001 124.653 76.519 69.859 1.00 0.00 O ATOM 97682 H1 WAT 2001 124.778 76.694 68.927 1.00 0.00 H ATOM 97683 H2 WAT 2001 123.769 76.835 70.046 1.00 0.00 H TER 97685 WAT 2001 ATOM 97685 O WAT 2002 133.052 51.053 120.340 1.00 0.00 O ATOM 97686 H1 WAT 2002 132.960 50.744 119.438 1.00 0.00 H ATOM 97687 H2 WAT 2002 133.677 51.775 120.283 1.00 0.00 H TER 97689 WAT 2002 ATOM 97689 O WAT 2003 38.729 64.372 94.322 1.00 0.00 O ATOM 97690 H1 WAT 2003 38.774 63.991 95.199 1.00 0.00 H ATOM 97691 H2 WAT 2003 39.632 64.615 94.119 1.00 0.00 H TER 97693 WAT 2003 ATOM 97693 O WAT 2004 66.579 22.039 82.550 1.00 0.00 O ATOM 97694 H1 WAT 2004 66.342 22.481 81.736 1.00 0.00 H ATOM 97695 H2 WAT 2004 67.495 22.278 82.695 1.00 0.00 H TER 97697 WAT 2004 ATOM 97697 O WAT 2005 45.059 74.148 67.617 1.00 0.00 O ATOM 97698 H1 WAT 2005 45.000 75.100 67.530 1.00 0.00 H ATOM 97699 H2 WAT 2005 44.156 73.843 67.537 1.00 0.00 H TER 97701 WAT 2005 ATOM 97701 O WAT 2006 80.914 66.302 155.386 1.00 0.00 O ATOM 97702 H1 WAT 2006 80.704 65.578 154.796 1.00 0.00 H ATOM 97703 H2 WAT 2006 81.836 66.171 155.607 1.00 0.00 H TER 97705 WAT 2006 ATOM 97705 O WAT 2007 131.595 102.041 111.841 1.00 0.00 O ATOM 97706 H1 WAT 2007 132.238 102.721 111.644 1.00 0.00 H ATOM 97707 H2 WAT 2007 131.401 102.156 112.772 1.00 0.00 H TER 97709 WAT 2007 ATOM 97709 O WAT 2008 134.485 113.231 130.095 1.00 0.00 O ATOM 97710 H1 WAT 2008 133.701 112.754 129.824 1.00 0.00 H ATOM 97711 H2 WAT 2008 134.998 113.326 129.292 1.00 0.00 H TER 97713 WAT 2008 ATOM 97713 O WAT 2009 114.616 84.405 73.307 1.00 0.00 O ATOM 97714 H1 WAT 2009 115.295 85.008 73.609 1.00 0.00 H ATOM 97715 H2 WAT 2009 113.794 84.863 73.482 1.00 0.00 H TER 97717 WAT 2009 ATOM 97717 O WAT 2010 89.443 34.632 111.895 1.00 0.00 O ATOM 97718 H1 WAT 2010 88.526 34.832 111.708 1.00 0.00 H ATOM 97719 H2 WAT 2010 89.419 34.138 112.715 1.00 0.00 H TER 97721 WAT 2010 ATOM 97721 O WAT 2011 72.260 35.218 138.749 1.00 0.00 O ATOM 97722 H1 WAT 2011 71.861 34.479 139.208 1.00 0.00 H ATOM 97723 H2 WAT 2011 71.558 35.568 138.201 1.00 0.00 H TER 97725 WAT 2011 ATOM 97725 O WAT 2012 105.704 44.155 138.310 1.00 0.00 O ATOM 97726 H1 WAT 2012 106.464 44.507 137.847 1.00 0.00 H ATOM 97727 H2 WAT 2012 105.283 44.923 138.698 1.00 0.00 H TER 97729 WAT 2012 ATOM 97729 O WAT 2013 99.303 66.752 63.295 1.00 0.00 O ATOM 97730 H1 WAT 2013 99.895 67.505 63.287 1.00 0.00 H ATOM 97731 H2 WAT 2013 99.539 66.270 64.087 1.00 0.00 H TER 97733 WAT 2013 ATOM 97733 O WAT 2014 118.092 139.731 84.441 1.00 0.00 O ATOM 97734 H1 WAT 2014 118.146 138.940 83.905 1.00 0.00 H ATOM 97735 H2 WAT 2014 118.829 140.268 84.152 1.00 0.00 H TER 97737 WAT 2014 ATOM 97737 O WAT 2015 140.937 86.554 21.502 1.00 0.00 O ATOM 97738 H1 WAT 2015 141.328 86.219 22.309 1.00 0.00 H ATOM 97739 H2 WAT 2015 141.661 86.980 21.044 1.00 0.00 H TER 97741 WAT 2015 ATOM 97741 O WAT 2016 87.223 110.380 59.573 1.00 0.00 O ATOM 97742 H1 WAT 2016 87.477 110.628 58.685 1.00 0.00 H ATOM 97743 H2 WAT 2016 87.216 111.205 60.059 1.00 0.00 H TER 97745 WAT 2016 ATOM 97745 O WAT 2017 133.777 60.407 122.656 1.00 0.00 O ATOM 97746 H1 WAT 2017 134.497 59.787 122.767 1.00 0.00 H ATOM 97747 H2 WAT 2017 133.247 60.034 121.951 1.00 0.00 H TER 97749 WAT 2017 ATOM 97749 O WAT 2018 51.350 43.733 115.412 1.00 0.00 O ATOM 97750 H1 WAT 2018 50.706 44.349 115.761 1.00 0.00 H ATOM 97751 H2 WAT 2018 51.995 43.638 116.113 1.00 0.00 H TER 97753 WAT 2018 ATOM 97753 O WAT 2019 59.747 101.649 70.413 1.00 0.00 O ATOM 97754 H1 WAT 2019 59.661 102.441 69.881 1.00 0.00 H ATOM 97755 H2 WAT 2019 60.504 101.818 70.974 1.00 0.00 H TER 97757 WAT 2019 ATOM 97757 O WAT 2020 139.305 88.158 109.735 1.00 0.00 O ATOM 97758 H1 WAT 2020 139.395 87.907 110.654 1.00 0.00 H ATOM 97759 H2 WAT 2020 139.798 88.975 109.660 1.00 0.00 H TER 97761 WAT 2020 ATOM 97761 O WAT 2021 135.745 116.409 135.922 1.00 0.00 O ATOM 97762 H1 WAT 2021 135.683 117.055 136.625 1.00 0.00 H ATOM 97763 H2 WAT 2021 135.652 115.565 136.365 1.00 0.00 H TER 97765 WAT 2021 ATOM 97765 O WAT 2022 27.810 64.052 21.095 1.00 0.00 O ATOM 97766 H1 WAT 2022 28.347 64.291 20.339 1.00 0.00 H ATOM 97767 H2 WAT 2022 28.426 63.658 21.712 1.00 0.00 H TER 97769 WAT 2022 ATOM 97769 O WAT 2023 86.622 84.630 68.378 1.00 0.00 O ATOM 97770 H1 WAT 2023 87.118 84.482 69.184 1.00 0.00 H ATOM 97771 H2 WAT 2023 85.938 83.960 68.391 1.00 0.00 H TER 97773 WAT 2023 ATOM 97773 O WAT 2024 82.345 120.785 84.780 1.00 0.00 O ATOM 97774 H1 WAT 2024 82.891 121.117 85.492 1.00 0.00 H ATOM 97775 H2 WAT 2024 81.471 120.708 85.164 1.00 0.00 H TER 97777 WAT 2024 ATOM 97777 O WAT 2025 42.781 34.169 111.971 1.00 0.00 O ATOM 97778 H1 WAT 2025 41.906 33.905 112.257 1.00 0.00 H ATOM 97779 H2 WAT 2025 43.118 33.408 111.499 1.00 0.00 H TER 97781 WAT 2025 ATOM 97781 O WAT 2026 78.956 9.610 81.388 1.00 0.00 O ATOM 97782 H1 WAT 2026 79.618 10.152 80.958 1.00 0.00 H ATOM 97783 H2 WAT 2026 79.447 8.870 81.746 1.00 0.00 H TER 97785 WAT 2026 ATOM 97785 O WAT 2027 51.645 30.038 59.449 1.00 0.00 O ATOM 97786 H1 WAT 2027 51.412 29.166 59.768 1.00 0.00 H ATOM 97787 H2 WAT 2027 51.197 30.639 60.045 1.00 0.00 H TER 97789 WAT 2027 ATOM 97789 O WAT 2028 66.663 23.430 92.735 1.00 0.00 O ATOM 97790 H1 WAT 2028 66.668 23.513 91.781 1.00 0.00 H ATOM 97791 H2 WAT 2028 67.571 23.231 92.963 1.00 0.00 H TER 97793 WAT 2028 ATOM 97793 O WAT 2029 62.896 129.154 91.510 1.00 0.00 O ATOM 97794 H1 WAT 2029 63.011 128.273 91.153 1.00 0.00 H ATOM 97795 H2 WAT 2029 62.052 129.121 91.960 1.00 0.00 H TER 97797 WAT 2029 ATOM 97797 O WAT 2030 102.911 81.887 124.801 1.00 0.00 O ATOM 97798 H1 WAT 2030 102.210 81.737 125.435 1.00 0.00 H ATOM 97799 H2 WAT 2030 103.056 82.833 124.823 1.00 0.00 H TER 97801 WAT 2030 ATOM 97801 O WAT 2031 122.229 12.053 147.342 1.00 0.00 O ATOM 97802 H1 WAT 2031 122.436 12.977 147.479 1.00 0.00 H ATOM 97803 H2 WAT 2031 122.951 11.581 147.758 1.00 0.00 H TER 97805 WAT 2031 ATOM 97805 O WAT 2032 119.592 139.616 96.032 1.00 0.00 O ATOM 97806 H1 WAT 2032 119.458 139.585 96.979 1.00 0.00 H ATOM 97807 H2 WAT 2032 120.497 139.909 95.928 1.00 0.00 H TER 97809 WAT 2032 ATOM 97809 O WAT 2033 47.270 35.516 10.785 1.00 0.00 O ATOM 97810 H1 WAT 2033 47.486 34.600 10.613 1.00 0.00 H ATOM 97811 H2 WAT 2033 46.866 35.824 9.973 1.00 0.00 H TER 97813 WAT 2033 ATOM 97813 O WAT 2034 70.501 76.412 73.015 1.00 0.00 O ATOM 97814 H1 WAT 2034 69.662 75.980 72.856 1.00 0.00 H ATOM 97815 H2 WAT 2034 71.035 76.187 72.253 1.00 0.00 H TER 97817 WAT 2034 ATOM 97817 O WAT 2035 80.238 140.168 137.649 1.00 0.00 O ATOM 97818 H1 WAT 2035 80.681 140.252 138.493 1.00 0.00 H ATOM 97819 H2 WAT 2035 79.400 140.614 137.774 1.00 0.00 H TER 97821 WAT 2035 ATOM 97821 O WAT 2036 50.409 57.922 91.447 1.00 0.00 O ATOM 97822 H1 WAT 2036 50.674 57.865 92.366 1.00 0.00 H ATOM 97823 H2 WAT 2036 51.129 58.385 91.019 1.00 0.00 H TER 97825 WAT 2036 ATOM 97825 O WAT 2037 120.540 106.821 143.726 1.00 0.00 O ATOM 97826 H1 WAT 2037 120.797 107.093 142.845 1.00 0.00 H ATOM 97827 H2 WAT 2037 121.225 107.172 144.295 1.00 0.00 H TER 97829 WAT 2037 ATOM 97829 O WAT 2038 102.719 57.641 1.920 1.00 0.00 O ATOM 97830 H1 WAT 2038 103.038 57.761 1.025 1.00 0.00 H ATOM 97831 H2 WAT 2038 101.900 58.135 1.951 1.00 0.00 H TER 97833 WAT 2038 ATOM 97833 O WAT 2039 57.393 117.953 97.198 1.00 0.00 O ATOM 97834 H1 WAT 2039 56.639 117.673 96.679 1.00 0.00 H ATOM 97835 H2 WAT 2039 57.371 117.393 97.974 1.00 0.00 H TER 97837 WAT 2039 ATOM 97837 O WAT 2040 142.642 86.483 8.144 1.00 0.00 O ATOM 97838 H1 WAT 2040 143.542 86.781 8.010 1.00 0.00 H ATOM 97839 H2 WAT 2040 142.225 86.588 7.289 1.00 0.00 H TER 97841 WAT 2040 ATOM 97841 O WAT 2041 47.397 116.017 80.814 1.00 0.00 O ATOM 97842 H1 WAT 2041 47.885 115.384 80.287 1.00 0.00 H ATOM 97843 H2 WAT 2041 47.714 115.879 81.707 1.00 0.00 H TER 97845 WAT 2041 ATOM 97845 O WAT 2042 73.503 30.554 115.607 1.00 0.00 O ATOM 97846 H1 WAT 2042 72.685 30.065 115.524 1.00 0.00 H ATOM 97847 H2 WAT 2042 73.537 31.100 114.821 1.00 0.00 H TER 97849 WAT 2042 ATOM 97849 O WAT 2043 87.101 12.553 68.782 1.00 0.00 O ATOM 97850 H1 WAT 2043 87.357 13.279 69.351 1.00 0.00 H ATOM 97851 H2 WAT 2043 86.154 12.478 68.900 1.00 0.00 H TER 97853 WAT 2043 ATOM 97853 O WAT 2044 75.062 54.642 113.792 1.00 0.00 O ATOM 97854 H1 WAT 2044 74.186 54.402 114.093 1.00 0.00 H ATOM 97855 H2 WAT 2044 75.563 53.827 113.840 1.00 0.00 H TER 97857 WAT 2044 ATOM 97857 O WAT 2045 23.980 128.248 62.323 1.00 0.00 O ATOM 97858 H1 WAT 2045 24.027 129.165 62.594 1.00 0.00 H ATOM 97859 H2 WAT 2045 24.855 128.053 61.988 1.00 0.00 H TER 97861 WAT 2045 ATOM 97861 O WAT 2046 121.822 88.652 112.215 1.00 0.00 O ATOM 97862 H1 WAT 2046 122.742 88.821 112.008 1.00 0.00 H ATOM 97863 H2 WAT 2046 121.539 89.428 112.698 1.00 0.00 H TER 97865 WAT 2046 ATOM 97865 O WAT 2047 93.478 30.570 93.292 1.00 0.00 O ATOM 97866 H1 WAT 2047 94.030 30.541 94.074 1.00 0.00 H ATOM 97867 H2 WAT 2047 93.925 31.181 92.705 1.00 0.00 H TER 97869 WAT 2047 ATOM 97869 O WAT 2048 73.386 70.326 0.521 1.00 0.00 O ATOM 97870 H1 WAT 2048 72.527 69.995 0.784 1.00 0.00 H ATOM 97871 H2 WAT 2048 73.663 69.739 -0.183 1.00 0.00 H TER 97873 WAT 2048 ATOM 97873 O WAT 2049 138.786 23.524 104.960 1.00 0.00 O ATOM 97874 H1 WAT 2049 139.601 23.426 105.452 1.00 0.00 H ATOM 97875 H2 WAT 2049 138.490 24.411 105.161 1.00 0.00 H TER 97877 WAT 2049 ATOM 97877 O WAT 2050 106.971 15.241 51.574 1.00 0.00 O ATOM 97878 H1 WAT 2050 107.843 15.626 51.488 1.00 0.00 H ATOM 97879 H2 WAT 2050 106.480 15.877 52.095 1.00 0.00 H TER 97881 WAT 2050 ATOM 97881 O WAT 2051 99.638 118.464 60.819 1.00 0.00 O ATOM 97882 H1 WAT 2051 99.435 117.671 60.323 1.00 0.00 H ATOM 97883 H2 WAT 2051 100.594 118.476 60.871 1.00 0.00 H TER 97885 WAT 2051 ATOM 97885 O WAT 2052 29.009 3.247 73.303 1.00 0.00 O ATOM 97886 H1 WAT 2052 29.754 3.804 73.530 1.00 0.00 H ATOM 97887 H2 WAT 2052 29.106 3.091 72.363 1.00 0.00 H TER 97889 WAT 2052 ATOM 97889 O WAT 2053 30.000 7.682 8.366 1.00 0.00 O ATOM 97890 H1 WAT 2053 30.304 8.572 8.547 1.00 0.00 H ATOM 97891 H2 WAT 2053 29.593 7.397 9.184 1.00 0.00 H TER 97893 WAT 2053 ATOM 97893 O WAT 2054 22.047 104.185 119.367 1.00 0.00 O ATOM 97894 H1 WAT 2054 22.632 104.859 119.020 1.00 0.00 H ATOM 97895 H2 WAT 2054 22.028 103.511 118.687 1.00 0.00 H TER 97897 WAT 2054 ATOM 97897 O WAT 2055 127.452 30.158 57.081 1.00 0.00 O ATOM 97898 H1 WAT 2055 126.629 29.699 57.254 1.00 0.00 H ATOM 97899 H2 WAT 2055 127.953 29.553 56.534 1.00 0.00 H TER 97901 WAT 2055 ATOM 97901 O WAT 2056 11.467 80.482 117.702 1.00 0.00 O ATOM 97902 H1 WAT 2056 10.800 79.806 117.827 1.00 0.00 H ATOM 97903 H2 WAT 2056 12.278 80.079 118.012 1.00 0.00 H TER 97905 WAT 2056 ATOM 97905 O WAT 2057 96.391 109.675 114.040 1.00 0.00 O ATOM 97906 H1 WAT 2057 95.640 110.267 113.992 1.00 0.00 H ATOM 97907 H2 WAT 2057 96.661 109.706 114.958 1.00 0.00 H TER 97909 WAT 2057 ATOM 97909 O WAT 2058 3.764 116.162 60.381 1.00 0.00 O ATOM 97910 H1 WAT 2058 4.241 116.450 59.603 1.00 0.00 H ATOM 97911 H2 WAT 2058 2.901 116.567 60.296 1.00 0.00 H TER 97913 WAT 2058 ATOM 97913 O WAT 2059 73.051 27.053 73.459 1.00 0.00 O ATOM 97914 H1 WAT 2059 73.274 27.950 73.208 1.00 0.00 H ATOM 97915 H2 WAT 2059 72.208 27.132 73.907 1.00 0.00 H TER 97917 WAT 2059 ATOM 97917 O WAT 2060 21.900 49.614 153.980 1.00 0.00 O ATOM 97918 H1 WAT 2060 22.533 50.331 153.973 1.00 0.00 H ATOM 97919 H2 WAT 2060 21.163 49.940 153.462 1.00 0.00 H TER 97921 WAT 2060 ATOM 97921 O WAT 2061 73.351 8.112 120.278 1.00 0.00 O ATOM 97922 H1 WAT 2061 74.254 7.798 120.317 1.00 0.00 H ATOM 97923 H2 WAT 2061 72.841 7.430 120.716 1.00 0.00 H TER 97925 WAT 2061 ATOM 97925 O WAT 2062 11.903 105.731 127.211 1.00 0.00 O ATOM 97926 H1 WAT 2062 11.977 104.787 127.068 1.00 0.00 H ATOM 97927 H2 WAT 2062 12.329 106.123 126.449 1.00 0.00 H TER 97929 WAT 2062 ATOM 97929 O WAT 2063 93.541 127.995 17.897 1.00 0.00 O ATOM 97930 H1 WAT 2063 93.774 127.826 18.810 1.00 0.00 H ATOM 97931 H2 WAT 2063 93.564 128.949 17.817 1.00 0.00 H TER 97933 WAT 2063 ATOM 97933 O WAT 2064 59.495 46.612 121.569 1.00 0.00 O ATOM 97934 H1 WAT 2064 59.742 46.854 122.462 1.00 0.00 H ATOM 97935 H2 WAT 2064 60.329 46.512 121.109 1.00 0.00 H TER 97937 WAT 2064 ATOM 97937 O WAT 2065 33.782 38.987 6.819 1.00 0.00 O ATOM 97938 H1 WAT 2065 34.704 39.205 6.956 1.00 0.00 H ATOM 97939 H2 WAT 2065 33.323 39.427 7.534 1.00 0.00 H TER 97941 WAT 2065 ATOM 97941 O WAT 2066 98.084 64.413 107.551 1.00 0.00 O ATOM 97942 H1 WAT 2066 97.451 64.837 106.973 1.00 0.00 H ATOM 97943 H2 WAT 2066 98.791 65.051 107.642 1.00 0.00 H TER 97945 WAT 2066 ATOM 97945 O WAT 2067 108.416 134.542 17.352 1.00 0.00 O ATOM 97946 H1 WAT 2067 108.078 134.423 16.465 1.00 0.00 H ATOM 97947 H2 WAT 2067 108.038 133.819 17.852 1.00 0.00 H TER 97949 WAT 2067 ATOM 97949 O WAT 2068 28.988 125.848 124.480 1.00 0.00 O ATOM 97950 H1 WAT 2068 28.578 125.773 125.341 1.00 0.00 H ATOM 97951 H2 WAT 2068 29.897 125.582 124.623 1.00 0.00 H TER 97953 WAT 2068 ATOM 97953 O WAT 2069 55.316 59.018 125.951 1.00 0.00 O ATOM 97954 H1 WAT 2069 56.176 58.863 126.339 1.00 0.00 H ATOM 97955 H2 WAT 2069 55.463 58.950 125.007 1.00 0.00 H TER 97957 WAT 2069 ATOM 97957 O WAT 2070 24.518 116.756 78.234 1.00 0.00 O ATOM 97958 H1 WAT 2070 23.635 116.704 77.869 1.00 0.00 H ATOM 97959 H2 WAT 2070 24.464 116.272 79.059 1.00 0.00 H TER 97961 WAT 2070 ATOM 97961 O WAT 2071 88.811 64.251 1.354 1.00 0.00 O ATOM 97962 H1 WAT 2071 89.396 64.836 1.835 1.00 0.00 H ATOM 97963 H2 WAT 2071 89.345 63.917 0.633 1.00 0.00 H TER 97965 WAT 2071 ATOM 97965 O WAT 2072 37.060 27.868 66.887 1.00 0.00 O ATOM 97966 H1 WAT 2072 36.627 27.346 66.212 1.00 0.00 H ATOM 97967 H2 WAT 2072 37.873 27.397 67.069 1.00 0.00 H TER 97969 WAT 2072 ATOM 97969 O WAT 2073 124.178 51.708 78.455 1.00 0.00 O ATOM 97970 H1 WAT 2073 124.544 52.222 77.736 1.00 0.00 H ATOM 97971 H2 WAT 2073 124.941 51.409 78.949 1.00 0.00 H TER 97973 WAT 2073 ATOM 97973 O WAT 2074 68.818 6.715 116.265 1.00 0.00 O ATOM 97974 H1 WAT 2074 69.439 6.619 116.987 1.00 0.00 H ATOM 97975 H2 WAT 2074 68.704 5.827 115.928 1.00 0.00 H TER 97977 WAT 2074 ATOM 97977 O WAT 2075 70.511 74.702 104.702 1.00 0.00 O ATOM 97978 H1 WAT 2075 70.503 75.503 105.227 1.00 0.00 H ATOM 97979 H2 WAT 2075 69.881 74.126 105.135 1.00 0.00 H TER 97981 WAT 2075 ATOM 97981 O WAT 2076 51.859 57.211 136.373 1.00 0.00 O ATOM 97982 H1 WAT 2076 51.987 56.316 136.060 1.00 0.00 H ATOM 97983 H2 WAT 2076 51.912 57.750 135.583 1.00 0.00 H TER 97985 WAT 2076 ATOM 97985 O WAT 2077 37.689 43.089 131.816 1.00 0.00 O ATOM 97986 H1 WAT 2077 38.198 43.690 131.272 1.00 0.00 H ATOM 97987 H2 WAT 2077 38.341 42.650 132.363 1.00 0.00 H TER 97989 WAT 2077 ATOM 97989 O WAT 2078 129.384 125.132 21.829 1.00 0.00 O ATOM 97990 H1 WAT 2078 128.799 124.526 22.285 1.00 0.00 H ATOM 97991 H2 WAT 2078 130.173 124.619 21.655 1.00 0.00 H TER 97993 WAT 2078 ATOM 97993 O WAT 2079 7.791 41.023 116.134 1.00 0.00 O ATOM 97994 H1 WAT 2079 8.149 40.558 115.378 1.00 0.00 H ATOM 97995 H2 WAT 2079 7.998 40.461 116.881 1.00 0.00 H TER 97997 WAT 2079 ATOM 97997 O WAT 2080 81.712 64.900 91.080 1.00 0.00 O ATOM 97998 H1 WAT 2080 82.480 64.340 90.965 1.00 0.00 H ATOM 97999 H2 WAT 2080 80.974 64.353 90.810 1.00 0.00 H TER 98001 WAT 2080 ATOM 98001 O WAT 2081 101.744 57.121 73.005 1.00 0.00 O ATOM 98002 H1 WAT 2081 101.020 57.731 72.863 1.00 0.00 H ATOM 98003 H2 WAT 2081 101.383 56.264 72.782 1.00 0.00 H TER 98005 WAT 2081 ATOM 98005 O WAT 2082 131.456 138.022 73.474 1.00 0.00 O ATOM 98006 H1 WAT 2082 130.694 138.588 73.348 1.00 0.00 H ATOM 98007 H2 WAT 2082 131.923 138.411 74.214 1.00 0.00 H TER 98009 WAT 2082 ATOM 98009 O WAT 2083 74.794 31.216 70.580 1.00 0.00 O ATOM 98010 H1 WAT 2083 75.704 31.320 70.859 1.00 0.00 H ATOM 98011 H2 WAT 2083 74.786 31.522 69.673 1.00 0.00 H TER 98013 WAT 2083 ATOM 98013 O WAT 2084 25.524 102.648 86.427 1.00 0.00 O ATOM 98014 H1 WAT 2084 26.203 102.626 85.753 1.00 0.00 H ATOM 98015 H2 WAT 2084 25.864 102.093 87.128 1.00 0.00 H TER 98017 WAT 2084 ATOM 98017 O WAT 2085 1.447 47.320 8.249 1.00 0.00 O ATOM 98018 H1 WAT 2085 2.040 46.592 8.437 1.00 0.00 H ATOM 98019 H2 WAT 2085 1.536 47.902 9.004 1.00 0.00 H TER 98021 WAT 2085 ATOM 98021 O WAT 2086 59.833 25.167 24.681 1.00 0.00 O ATOM 98022 H1 WAT 2086 59.348 24.790 23.947 1.00 0.00 H ATOM 98023 H2 WAT 2086 59.522 24.683 25.446 1.00 0.00 H TER 98025 WAT 2086 ATOM 98025 O WAT 2087 64.296 18.188 154.986 1.00 0.00 O ATOM 98026 H1 WAT 2087 63.615 18.776 155.314 1.00 0.00 H ATOM 98027 H2 WAT 2087 64.587 17.704 155.759 1.00 0.00 H TER 98029 WAT 2087 ATOM 98029 O WAT 2088 15.949 18.426 97.632 1.00 0.00 O ATOM 98030 H1 WAT 2088 16.613 19.009 97.265 1.00 0.00 H ATOM 98031 H2 WAT 2088 16.343 18.092 98.438 1.00 0.00 H TER 98033 WAT 2088 ATOM 98033 O WAT 2089 95.708 108.723 128.462 1.00 0.00 O ATOM 98034 H1 WAT 2089 94.839 108.339 128.581 1.00 0.00 H ATOM 98035 H2 WAT 2089 95.631 109.605 128.825 1.00 0.00 H TER 98037 WAT 2089 ATOM 98037 O WAT 2090 143.676 85.431 119.710 1.00 0.00 O ATOM 98038 H1 WAT 2090 143.078 84.684 119.714 1.00 0.00 H ATOM 98039 H2 WAT 2090 144.497 85.079 119.367 1.00 0.00 H TER 98041 WAT 2090 ATOM 98041 O WAT 2091 119.085 59.053 77.487 1.00 0.00 O ATOM 98042 H1 WAT 2091 118.307 59.307 77.984 1.00 0.00 H ATOM 98043 H2 WAT 2091 119.802 59.530 77.904 1.00 0.00 H TER 98045 WAT 2091 ATOM 98045 O WAT 2092 56.900 16.816 90.117 1.00 0.00 O ATOM 98046 H1 WAT 2092 57.033 16.840 91.065 1.00 0.00 H ATOM 98047 H2 WAT 2092 56.797 15.887 89.913 1.00 0.00 H TER 98049 WAT 2092 ATOM 98049 O WAT 2093 100.751 24.131 5.555 1.00 0.00 O ATOM 98050 H1 WAT 2093 99.842 24.302 5.803 1.00 0.00 H ATOM 98051 H2 WAT 2093 100.763 24.231 4.603 1.00 0.00 H TER 98053 WAT 2093 ATOM 98053 O WAT 2094 116.293 46.183 58.431 1.00 0.00 O ATOM 98054 H1 WAT 2094 115.626 45.797 57.863 1.00 0.00 H ATOM 98055 H2 WAT 2094 115.815 46.818 58.964 1.00 0.00 H TER 98057 WAT 2094 ATOM 98057 O WAT 2095 138.685 141.529 114.038 1.00 0.00 O ATOM 98058 H1 WAT 2095 139.401 140.970 113.737 1.00 0.00 H ATOM 98059 H2 WAT 2095 138.692 141.437 114.991 1.00 0.00 H TER 98061 WAT 2095 ATOM 98061 O WAT 2096 109.357 26.591 5.827 1.00 0.00 O ATOM 98062 H1 WAT 2096 108.633 27.048 6.256 1.00 0.00 H ATOM 98063 H2 WAT 2096 109.775 27.260 5.285 1.00 0.00 H TER 98065 WAT 2096 ATOM 98065 O WAT 2097 107.497 84.266 83.434 1.00 0.00 O ATOM 98066 H1 WAT 2097 106.812 83.598 83.414 1.00 0.00 H ATOM 98067 H2 WAT 2097 108.104 83.966 84.111 1.00 0.00 H TER 98069 WAT 2097 ATOM 98069 O WAT 2098 62.876 41.572 116.451 1.00 0.00 O ATOM 98070 H1 WAT 2098 62.757 40.624 116.511 1.00 0.00 H ATOM 98071 H2 WAT 2098 62.741 41.887 117.344 1.00 0.00 H TER 98073 WAT 2098 ATOM 98073 O WAT 2099 130.521 68.435 55.122 1.00 0.00 O ATOM 98074 H1 WAT 2099 130.731 68.900 55.932 1.00 0.00 H ATOM 98075 H2 WAT 2099 131.025 68.890 54.447 1.00 0.00 H TER 98077 WAT 2099 ATOM 98077 O WAT 2100 110.558 112.354 147.538 1.00 0.00 O ATOM 98078 H1 WAT 2100 110.984 112.674 148.334 1.00 0.00 H ATOM 98079 H2 WAT 2100 110.008 113.083 147.252 1.00 0.00 H TER 98081 WAT 2100 ATOM 98081 O WAT 2101 21.195 79.410 112.679 1.00 0.00 O ATOM 98082 H1 WAT 2101 21.093 79.283 111.735 1.00 0.00 H ATOM 98083 H2 WAT 2101 21.750 78.683 112.960 1.00 0.00 H TER 98085 WAT 2101 ATOM 98085 O WAT 2102 49.592 24.039 128.645 1.00 0.00 O ATOM 98086 H1 WAT 2102 48.999 23.469 128.157 1.00 0.00 H ATOM 98087 H2 WAT 2102 49.703 24.806 128.084 1.00 0.00 H TER 98089 WAT 2102 ATOM 98089 O WAT 2103 69.455 67.413 76.798 1.00 0.00 O ATOM 98090 H1 WAT 2103 68.680 67.957 76.939 1.00 0.00 H ATOM 98091 H2 WAT 2103 69.230 66.569 77.190 1.00 0.00 H TER 98093 WAT 2103 ATOM 98093 O WAT 2104 105.871 128.384 94.444 1.00 0.00 O ATOM 98094 H1 WAT 2104 106.577 128.941 94.114 1.00 0.00 H ATOM 98095 H2 WAT 2104 105.478 128.892 95.154 1.00 0.00 H TER 98097 WAT 2104 ATOM 98097 O WAT 2105 88.570 137.507 97.464 1.00 0.00 O ATOM 98098 H1 WAT 2105 88.375 138.219 98.074 1.00 0.00 H ATOM 98099 H2 WAT 2105 87.921 136.833 97.668 1.00 0.00 H TER 98101 WAT 2105 ATOM 98101 O WAT 2106 24.093 11.648 114.821 1.00 0.00 O ATOM 98102 H1 WAT 2106 23.729 12.183 115.527 1.00 0.00 H ATOM 98103 H2 WAT 2106 23.893 10.748 115.076 1.00 0.00 H TER 98105 WAT 2106 ATOM 98105 O WAT 2107 63.704 145.767 127.736 1.00 0.00 O ATOM 98106 H1 WAT 2107 64.385 146.440 127.708 1.00 0.00 H ATOM 98107 H2 WAT 2107 64.053 145.052 127.204 1.00 0.00 H TER 98109 WAT 2107 ATOM 98109 O WAT 2108 55.280 130.432 102.580 1.00 0.00 O ATOM 98110 H1 WAT 2108 55.190 129.876 103.354 1.00 0.00 H ATOM 98111 H2 WAT 2108 56.224 130.551 102.478 1.00 0.00 H TER 98113 WAT 2108 ATOM 98113 O WAT 2109 80.075 101.837 69.508 1.00 0.00 O ATOM 98114 H1 WAT 2109 80.925 102.135 69.182 1.00 0.00 H ATOM 98115 H2 WAT 2109 79.761 102.559 70.052 1.00 0.00 H TER 98117 WAT 2109 ATOM 98117 O WAT 2110 133.962 42.611 79.630 1.00 0.00 O ATOM 98118 H1 WAT 2110 133.436 42.033 80.183 1.00 0.00 H ATOM 98119 H2 WAT 2110 133.798 42.303 78.739 1.00 0.00 H TER 98121 WAT 2110 ATOM 98121 O WAT 2111 54.805 83.785 104.450 1.00 0.00 O ATOM 98122 H1 WAT 2111 54.640 82.947 104.881 1.00 0.00 H ATOM 98123 H2 WAT 2111 55.749 83.918 104.537 1.00 0.00 H TER 98125 WAT 2111 ATOM 98125 O WAT 2112 136.248 113.761 123.829 1.00 0.00 O ATOM 98126 H1 WAT 2112 136.929 114.381 123.568 1.00 0.00 H ATOM 98127 H2 WAT 2112 136.632 112.900 123.661 1.00 0.00 H TER 98129 WAT 2112 ATOM 98129 O WAT 2113 19.898 20.183 76.688 1.00 0.00 O ATOM 98130 H1 WAT 2113 19.546 19.390 77.092 1.00 0.00 H ATOM 98131 H2 WAT 2113 20.843 20.036 76.656 1.00 0.00 H TER 98133 WAT 2113 ATOM 98133 O WAT 2114 133.700 140.116 134.350 1.00 0.00 O ATOM 98134 H1 WAT 2114 133.119 139.460 133.966 1.00 0.00 H ATOM 98135 H2 WAT 2114 134.552 139.948 133.947 1.00 0.00 H TER 98137 WAT 2114 ATOM 98137 O WAT 2115 92.446 122.804 117.814 1.00 0.00 O ATOM 98138 H1 WAT 2115 91.688 122.287 117.541 1.00 0.00 H ATOM 98139 H2 WAT 2115 93.105 122.638 117.140 1.00 0.00 H TER 98141 WAT 2115 ATOM 98141 O WAT 2116 81.720 43.094 130.929 1.00 0.00 O ATOM 98142 H1 WAT 2116 82.658 43.271 130.998 1.00 0.00 H ATOM 98143 H2 WAT 2116 81.669 42.199 130.593 1.00 0.00 H TER 98145 WAT 2116 ATOM 98145 O WAT 2117 98.915 81.083 73.587 1.00 0.00 O ATOM 98146 H1 WAT 2117 98.681 80.281 73.121 1.00 0.00 H ATOM 98147 H2 WAT 2117 99.834 81.231 73.363 1.00 0.00 H TER 98149 WAT 2117 ATOM 98149 O WAT 2118 115.416 8.091 59.989 1.00 0.00 O ATOM 98150 H1 WAT 2118 116.240 7.778 59.617 1.00 0.00 H ATOM 98151 H2 WAT 2118 115.417 9.033 59.818 1.00 0.00 H TER 98153 WAT 2118 ATOM 98153 O WAT 2119 35.334 17.171 68.272 1.00 0.00 O ATOM 98154 H1 WAT 2119 35.951 16.863 68.936 1.00 0.00 H ATOM 98155 H2 WAT 2119 35.295 16.459 67.633 1.00 0.00 H TER 98157 WAT 2119 ATOM 98157 O WAT 2120 138.667 128.910 156.460 1.00 0.00 O ATOM 98158 H1 WAT 2120 138.761 127.995 156.196 1.00 0.00 H ATOM 98159 H2 WAT 2120 138.583 128.877 157.413 1.00 0.00 H TER 98161 WAT 2120 ATOM 98161 O WAT 2121 95.348 18.154 72.392 1.00 0.00 O ATOM 98162 H1 WAT 2121 95.064 17.823 71.540 1.00 0.00 H ATOM 98163 H2 WAT 2121 94.708 17.802 73.011 1.00 0.00 H TER 98165 WAT 2121 ATOM 98165 O WAT 2122 128.466 117.226 97.498 1.00 0.00 O ATOM 98166 H1 WAT 2122 128.629 118.019 98.009 1.00 0.00 H ATOM 98167 H2 WAT 2122 127.518 117.215 97.366 1.00 0.00 H TER 98169 WAT 2122 ATOM 98169 O WAT 2123 140.085 97.322 149.087 1.00 0.00 O ATOM 98170 H1 WAT 2123 139.576 96.511 149.086 1.00 0.00 H ATOM 98171 H2 WAT 2123 140.997 97.033 149.079 1.00 0.00 H TER 98173 WAT 2123 ATOM 98173 O WAT 2124 19.834 133.707 4.249 1.00 0.00 O ATOM 98174 H1 WAT 2124 20.685 133.643 4.683 1.00 0.00 H ATOM 98175 H2 WAT 2124 19.198 133.562 4.949 1.00 0.00 H TER 98177 WAT 2124 ATOM 98177 O WAT 2125 44.189 112.695 157.028 1.00 0.00 O ATOM 98178 H1 WAT 2125 43.826 112.091 156.381 1.00 0.00 H ATOM 98179 H2 WAT 2125 43.493 113.336 157.175 1.00 0.00 H TER 98181 WAT 2125 ATOM 98181 O WAT 2126 70.608 39.672 67.758 1.00 0.00 O ATOM 98182 H1 WAT 2126 71.473 39.892 68.104 1.00 0.00 H ATOM 98183 H2 WAT 2126 70.444 40.332 67.085 1.00 0.00 H TER 98185 WAT 2126 ATOM 98185 O WAT 2127 136.022 8.660 61.571 1.00 0.00 O ATOM 98186 H1 WAT 2127 136.258 9.325 60.923 1.00 0.00 H ATOM 98187 H2 WAT 2127 136.843 8.459 62.018 1.00 0.00 H TER 98189 WAT 2127 ATOM 98189 O WAT 2128 42.099 89.580 95.368 1.00 0.00 O ATOM 98190 H1 WAT 2128 42.213 90.524 95.253 1.00 0.00 H ATOM 98191 H2 WAT 2128 41.636 89.495 96.201 1.00 0.00 H TER 98193 WAT 2128 ATOM 98193 O WAT 2129 5.257 8.920 75.652 1.00 0.00 O ATOM 98194 H1 WAT 2129 4.571 9.528 75.375 1.00 0.00 H ATOM 98195 H2 WAT 2129 5.946 9.022 74.996 1.00 0.00 H TER 98197 WAT 2129 ATOM 98197 O WAT 2130 10.682 107.340 15.216 1.00 0.00 O ATOM 98198 H1 WAT 2130 11.192 107.590 15.987 1.00 0.00 H ATOM 98199 H2 WAT 2130 10.060 106.690 15.541 1.00 0.00 H TER 98201 WAT 2130 ATOM 98201 O WAT 2131 67.379 141.446 4.915 1.00 0.00 O ATOM 98202 H1 WAT 2131 67.678 142.332 4.708 1.00 0.00 H ATOM 98203 H2 WAT 2131 66.445 141.546 5.100 1.00 0.00 H TER 98205 WAT 2131 ATOM 98205 O WAT 2132 92.645 44.418 27.962 1.00 0.00 O ATOM 98206 H1 WAT 2132 91.921 43.987 27.508 1.00 0.00 H ATOM 98207 H2 WAT 2132 93.148 43.701 28.347 1.00 0.00 H TER 98209 WAT 2132 ATOM 98209 O WAT 2133 56.863 116.089 138.495 1.00 0.00 O ATOM 98210 H1 WAT 2133 56.492 115.260 138.797 1.00 0.00 H ATOM 98211 H2 WAT 2133 57.652 115.837 138.016 1.00 0.00 H TER 98213 WAT 2133 ATOM 98213 O WAT 2134 69.687 46.456 140.028 1.00 0.00 O ATOM 98214 H1 WAT 2134 69.881 45.703 139.469 1.00 0.00 H ATOM 98215 H2 WAT 2134 70.544 46.767 140.317 1.00 0.00 H TER 98217 WAT 2134 ATOM 98217 O WAT 2135 69.897 83.956 24.800 1.00 0.00 O ATOM 98218 H1 WAT 2135 69.583 84.721 25.282 1.00 0.00 H ATOM 98219 H2 WAT 2135 69.101 83.535 24.474 1.00 0.00 H TER 98221 WAT 2135 ATOM 98221 O WAT 2136 47.526 96.422 153.222 1.00 0.00 O ATOM 98222 H1 WAT 2136 47.124 95.618 152.895 1.00 0.00 H ATOM 98223 H2 WAT 2136 48.392 96.149 153.527 1.00 0.00 H TER 98225 WAT 2136 ATOM 98225 O WAT 2137 25.769 46.613 70.454 1.00 0.00 O ATOM 98226 H1 WAT 2137 25.576 45.792 70.002 1.00 0.00 H ATOM 98227 H2 WAT 2137 26.643 46.855 70.146 1.00 0.00 H TER 98229 WAT 2137 ATOM 98229 O WAT 2138 17.504 139.507 122.263 1.00 0.00 O ATOM 98230 H1 WAT 2138 18.071 138.754 122.431 1.00 0.00 H ATOM 98231 H2 WAT 2138 16.706 139.321 122.757 1.00 0.00 H TER 98233 WAT 2138 ATOM 98233 O WAT 2139 7.098 43.376 133.346 1.00 0.00 O ATOM 98234 H1 WAT 2139 6.779 43.940 132.641 1.00 0.00 H ATOM 98235 H2 WAT 2139 6.643 43.689 134.128 1.00 0.00 H TER 98237 WAT 2139 ATOM 98237 O WAT 2140 46.202 102.078 123.109 1.00 0.00 O ATOM 98238 H1 WAT 2140 46.590 102.446 123.903 1.00 0.00 H ATOM 98239 H2 WAT 2140 45.551 102.726 122.838 1.00 0.00 H TER 98241 WAT 2140 ATOM 98241 O WAT 2141 32.751 126.423 111.057 1.00 0.00 O ATOM 98242 H1 WAT 2141 33.364 127.099 111.348 1.00 0.00 H ATOM 98243 H2 WAT 2141 32.138 126.326 111.785 1.00 0.00 H TER 98245 WAT 2141 ATOM 98245 O WAT 2142 97.142 49.631 151.270 1.00 0.00 O ATOM 98246 H1 WAT 2142 96.187 49.573 151.261 1.00 0.00 H ATOM 98247 H2 WAT 2142 97.326 50.559 151.125 1.00 0.00 H TER 98249 WAT 2142 ATOM 98249 O WAT 2143 142.537 101.531 92.851 1.00 0.00 O ATOM 98250 H1 WAT 2143 142.763 100.888 92.178 1.00 0.00 H ATOM 98251 H2 WAT 2143 143.332 102.050 92.963 1.00 0.00 H TER 98253 WAT 2143 ATOM 98253 O WAT 2144 80.634 127.607 16.217 1.00 0.00 O ATOM 98254 H1 WAT 2144 80.282 127.454 17.093 1.00 0.00 H ATOM 98255 H2 WAT 2144 79.875 127.538 15.638 1.00 0.00 H TER 98257 WAT 2144 ATOM 98257 O WAT 2145 17.269 9.444 73.821 1.00 0.00 O ATOM 98258 H1 WAT 2145 17.306 10.256 74.326 1.00 0.00 H ATOM 98259 H2 WAT 2145 18.186 9.209 73.677 1.00 0.00 H TER 98261 WAT 2145 ATOM 98261 O WAT 2146 139.360 4.076 94.296 1.00 0.00 O ATOM 98262 H1 WAT 2146 138.551 4.366 94.718 1.00 0.00 H ATOM 98263 H2 WAT 2146 140.016 4.717 94.570 1.00 0.00 H TER 98265 WAT 2146 ATOM 98265 O WAT 2147 7.856 139.112 150.118 1.00 0.00 O ATOM 98266 H1 WAT 2147 7.420 139.537 150.858 1.00 0.00 H ATOM 98267 H2 WAT 2147 7.215 139.152 149.408 1.00 0.00 H TER 98269 WAT 2147 ATOM 98269 O WAT 2148 122.167 103.769 15.138 1.00 0.00 O ATOM 98270 H1 WAT 2148 122.924 103.187 15.208 1.00 0.00 H ATOM 98271 H2 WAT 2148 121.616 103.537 15.886 1.00 0.00 H TER 98273 WAT 2148 ATOM 98273 O WAT 2149 36.157 108.390 54.935 1.00 0.00 O ATOM 98274 H1 WAT 2149 36.427 108.067 55.795 1.00 0.00 H ATOM 98275 H2 WAT 2149 36.216 109.342 55.008 1.00 0.00 H TER 98277 WAT 2149 ATOM 98277 O WAT 2150 12.923 80.054 70.081 1.00 0.00 O ATOM 98278 H1 WAT 2150 12.513 80.260 69.241 1.00 0.00 H ATOM 98279 H2 WAT 2150 13.488 80.805 70.263 1.00 0.00 H TER 98281 WAT 2150 ATOM 98281 O WAT 2151 63.859 144.307 22.858 1.00 0.00 O ATOM 98282 H1 WAT 2151 63.847 145.145 23.320 1.00 0.00 H ATOM 98283 H2 WAT 2151 63.583 144.521 21.967 1.00 0.00 H TER 98285 WAT 2151 ATOM 98285 O WAT 2152 125.512 8.941 109.492 1.00 0.00 O ATOM 98286 H1 WAT 2152 125.054 8.341 108.903 1.00 0.00 H ATOM 98287 H2 WAT 2152 125.943 8.370 110.128 1.00 0.00 H TER 98289 WAT 2152 ATOM 98289 O WAT 2153 17.203 37.553 116.064 1.00 0.00 O ATOM 98290 H1 WAT 2153 17.742 37.342 115.302 1.00 0.00 H ATOM 98291 H2 WAT 2153 17.560 37.011 116.767 1.00 0.00 H TER 98293 WAT 2153 ATOM 98293 O WAT 2154 117.721 2.577 84.510 1.00 0.00 O ATOM 98294 H1 WAT 2154 118.457 2.783 85.088 1.00 0.00 H ATOM 98295 H2 WAT 2154 117.779 3.225 83.808 1.00 0.00 H TER 98297 WAT 2154 ATOM 98297 O WAT 2155 0.410 30.140 108.443 1.00 0.00 O ATOM 98298 H1 WAT 2155 0.842 30.325 107.609 1.00 0.00 H ATOM 98299 H2 WAT 2155 0.986 29.510 108.876 1.00 0.00 H TER 98301 WAT 2155 ATOM 98301 O WAT 2156 121.833 68.891 114.943 1.00 0.00 O ATOM 98302 H1 WAT 2156 121.189 69.578 114.769 1.00 0.00 H ATOM 98303 H2 WAT 2156 122.176 68.661 114.079 1.00 0.00 H TER 98305 WAT 2156 ATOM 98305 O WAT 2157 68.853 12.517 68.416 1.00 0.00 O ATOM 98306 H1 WAT 2157 68.093 13.027 68.136 1.00 0.00 H ATOM 98307 H2 WAT 2157 69.606 13.029 68.122 1.00 0.00 H TER 98309 WAT 2157 ATOM 98309 O WAT 2158 31.952 42.719 147.545 1.00 0.00 O ATOM 98310 H1 WAT 2158 31.631 43.129 146.742 1.00 0.00 H ATOM 98311 H2 WAT 2158 32.895 42.631 147.409 1.00 0.00 H TER 98313 WAT 2158 ATOM 98313 O WAT 2159 66.211 42.608 104.348 1.00 0.00 O ATOM 98314 H1 WAT 2159 65.611 41.988 103.933 1.00 0.00 H ATOM 98315 H2 WAT 2159 65.904 43.468 104.060 1.00 0.00 H TER 98317 WAT 2159 ATOM 98317 O WAT 2160 25.686 85.182 116.235 1.00 0.00 O ATOM 98318 H1 WAT 2160 24.947 85.561 116.712 1.00 0.00 H ATOM 98319 H2 WAT 2160 26.460 85.502 116.698 1.00 0.00 H TER 98321 WAT 2160 ATOM 98321 O WAT 2161 82.774 42.004 106.378 1.00 0.00 O ATOM 98322 H1 WAT 2161 82.992 42.794 106.873 1.00 0.00 H ATOM 98323 H2 WAT 2161 83.337 41.325 106.751 1.00 0.00 H TER 98325 WAT 2161 ATOM 98325 O WAT 2162 14.955 141.268 151.627 1.00 0.00 O ATOM 98326 H1 WAT 2162 15.302 141.902 151.000 1.00 0.00 H ATOM 98327 H2 WAT 2162 15.516 140.499 151.525 1.00 0.00 H TER 98329 WAT 2162 ATOM 98329 O WAT 2163 136.038 31.621 124.390 1.00 0.00 O ATOM 98330 H1 WAT 2163 135.312 31.060 124.118 1.00 0.00 H ATOM 98331 H2 WAT 2163 136.653 31.589 123.658 1.00 0.00 H TER 98333 WAT 2163 ATOM 98333 O WAT 2164 126.593 47.340 66.783 1.00 0.00 O ATOM 98334 H1 WAT 2164 125.886 46.998 66.236 1.00 0.00 H ATOM 98335 H2 WAT 2164 126.150 47.888 67.432 1.00 0.00 H TER 98337 WAT 2164 ATOM 98337 O WAT 2165 108.652 80.406 66.110 1.00 0.00 O ATOM 98338 H1 WAT 2165 109.266 79.862 65.617 1.00 0.00 H ATOM 98339 H2 WAT 2165 107.871 79.861 66.204 1.00 0.00 H TER 98341 WAT 2165 ATOM 98341 O WAT 2166 130.944 71.365 146.443 1.00 0.00 O ATOM 98342 H1 WAT 2166 130.430 70.557 146.436 1.00 0.00 H ATOM 98343 H2 WAT 2166 131.726 71.147 146.949 1.00 0.00 H TER 98345 WAT 2166 ATOM 98345 O WAT 2167 45.468 44.429 122.905 1.00 0.00 O ATOM 98346 H1 WAT 2167 45.029 44.997 122.271 1.00 0.00 H ATOM 98347 H2 WAT 2167 45.668 43.632 122.414 1.00 0.00 H TER 98349 WAT 2167 ATOM 98349 O WAT 2168 77.090 22.061 16.555 1.00 0.00 O ATOM 98350 H1 WAT 2168 77.594 22.600 17.165 1.00 0.00 H ATOM 98351 H2 WAT 2168 76.194 22.391 16.629 1.00 0.00 H TER 98353 WAT 2168 ATOM 98353 O WAT 2169 53.144 33.904 114.194 1.00 0.00 O ATOM 98354 H1 WAT 2169 53.271 34.091 113.263 1.00 0.00 H ATOM 98355 H2 WAT 2169 52.424 33.273 114.215 1.00 0.00 H TER 98357 WAT 2169 ATOM 98357 O WAT 2170 7.293 46.988 15.216 1.00 0.00 O ATOM 98358 H1 WAT 2170 7.092 47.659 15.868 1.00 0.00 H ATOM 98359 H2 WAT 2170 7.996 46.473 15.610 1.00 0.00 H TER 98361 WAT 2170 ATOM 98361 O WAT 2171 50.619 97.684 76.478 1.00 0.00 O ATOM 98362 H1 WAT 2171 49.970 98.324 76.186 1.00 0.00 H ATOM 98363 H2 WAT 2171 50.198 97.234 77.210 1.00 0.00 H TER 98365 WAT 2171 ATOM 98365 O WAT 2172 84.334 140.619 79.547 1.00 0.00 O ATOM 98366 H1 WAT 2172 84.632 140.036 80.246 1.00 0.00 H ATOM 98367 H2 WAT 2172 84.474 141.500 79.895 1.00 0.00 H TER 98369 WAT 2172 ATOM 98369 O WAT 2173 5.658 56.645 114.896 1.00 0.00 O ATOM 98370 H1 WAT 2173 5.676 56.060 115.653 1.00 0.00 H ATOM 98371 H2 WAT 2173 5.847 56.076 114.149 1.00 0.00 H TER 98373 WAT 2173 ATOM 98373 O WAT 2174 123.532 101.141 121.721 1.00 0.00 O ATOM 98374 H1 WAT 2174 122.996 101.275 120.939 1.00 0.00 H ATOM 98375 H2 WAT 2174 124.390 101.495 121.487 1.00 0.00 H TER 98377 WAT 2174 ATOM 98377 O WAT 2175 73.174 102.361 16.795 1.00 0.00 O ATOM 98378 H1 WAT 2175 72.833 101.516 17.088 1.00 0.00 H ATOM 98379 H2 WAT 2175 73.113 102.925 17.566 1.00 0.00 H TER 98381 WAT 2175 ATOM 98381 O WAT 2176 64.835 99.580 4.653 1.00 0.00 O ATOM 98382 H1 WAT 2176 64.795 99.543 3.697 1.00 0.00 H ATOM 98383 H2 WAT 2176 64.806 98.664 4.930 1.00 0.00 H TER 98385 WAT 2176 ATOM 98385 O WAT 2177 65.717 98.059 158.424 1.00 0.00 O ATOM 98386 H1 WAT 2177 65.792 97.111 158.315 1.00 0.00 H ATOM 98387 H2 WAT 2177 65.455 98.379 157.560 1.00 0.00 H TER 98389 WAT 2177 ATOM 98389 O WAT 2178 133.490 81.917 20.841 1.00 0.00 O ATOM 98390 H1 WAT 2178 133.404 82.197 19.930 1.00 0.00 H ATOM 98391 H2 WAT 2178 134.169 82.486 21.204 1.00 0.00 H TER 98393 WAT 2178 ATOM 98393 O WAT 2179 68.784 144.017 149.962 1.00 0.00 O ATOM 98394 H1 WAT 2179 68.712 143.108 149.669 1.00 0.00 H ATOM 98395 H2 WAT 2179 67.963 144.186 150.423 1.00 0.00 H TER 98397 WAT 2179 ATOM 98397 O WAT 2180 21.534 31.482 118.859 1.00 0.00 O ATOM 98398 H1 WAT 2180 21.917 32.338 118.666 1.00 0.00 H ATOM 98399 H2 WAT 2180 21.802 30.929 118.124 1.00 0.00 H TER 98401 WAT 2180 ATOM 98401 O WAT 2181 53.677 117.988 98.903 1.00 0.00 O ATOM 98402 H1 WAT 2181 54.310 118.550 99.351 1.00 0.00 H ATOM 98403 H2 WAT 2181 52.909 118.545 98.777 1.00 0.00 H TER 98405 WAT 2181 ATOM 98405 O WAT 2182 113.536 84.551 70.097 1.00 0.00 O ATOM 98406 H1 WAT 2182 113.565 84.949 70.967 1.00 0.00 H ATOM 98407 H2 WAT 2182 113.243 83.653 70.255 1.00 0.00 H TER 98409 WAT 2182 ATOM 98409 O WAT 2183 83.358 47.271 158.302 1.00 0.00 O ATOM 98410 H1 WAT 2183 84.117 47.444 158.858 1.00 0.00 H ATOM 98411 H2 WAT 2183 83.733 47.034 157.453 1.00 0.00 H TER 98413 WAT 2183 ATOM 98413 O WAT 2184 61.250 119.506 118.992 1.00 0.00 O ATOM 98414 H1 WAT 2184 60.777 118.702 118.778 1.00 0.00 H ATOM 98415 H2 WAT 2184 61.622 119.342 119.859 1.00 0.00 H TER 98417 WAT 2184 ATOM 98417 O WAT 2185 9.142 113.040 62.296 1.00 0.00 O ATOM 98418 H1 WAT 2185 8.496 112.650 62.886 1.00 0.00 H ATOM 98419 H2 WAT 2185 9.284 112.374 61.624 1.00 0.00 H TER 98421 WAT 2185 ATOM 98421 O WAT 2186 115.502 19.362 1.948 1.00 0.00 O ATOM 98422 H1 WAT 2186 115.140 20.047 2.510 1.00 0.00 H ATOM 98423 H2 WAT 2186 114.824 18.685 1.930 1.00 0.00 H TER 98425 WAT 2186 ATOM 98425 O WAT 2187 71.560 108.885 17.104 1.00 0.00 O ATOM 98426 H1 WAT 2187 70.878 109.096 17.741 1.00 0.00 H ATOM 98427 H2 WAT 2187 71.112 108.365 16.436 1.00 0.00 H TER 98429 WAT 2187 ATOM 98429 O WAT 2188 14.034 64.318 105.473 1.00 0.00 O ATOM 98430 H1 WAT 2188 13.452 64.952 105.053 1.00 0.00 H ATOM 98431 H2 WAT 2188 14.305 63.736 104.763 1.00 0.00 H TER 98433 WAT 2188 ATOM 98433 O WAT 2189 122.009 144.704 77.164 1.00 0.00 O ATOM 98434 H1 WAT 2189 122.190 143.764 77.149 1.00 0.00 H ATOM 98435 H2 WAT 2189 122.482 145.051 76.408 1.00 0.00 H TER 98437 WAT 2189 ATOM 98437 O WAT 2190 61.112 132.859 117.014 1.00 0.00 O ATOM 98438 H1 WAT 2190 60.804 132.760 116.113 1.00 0.00 H ATOM 98439 H2 WAT 2190 60.367 133.237 117.481 1.00 0.00 H TER 98441 WAT 2190 ATOM 98441 O WAT 2191 29.242 95.549 0.326 1.00 0.00 O ATOM 98442 H1 WAT 2191 30.040 95.077 0.566 1.00 0.00 H ATOM 98443 H2 WAT 2191 29.099 95.326 -0.594 1.00 0.00 H TER 98445 WAT 2191 ATOM 98445 O WAT 2192 76.066 7.544 121.165 1.00 0.00 O ATOM 98446 H1 WAT 2192 76.885 7.845 120.771 1.00 0.00 H ATOM 98447 H2 WAT 2192 76.313 7.258 122.044 1.00 0.00 H TER 98449 WAT 2192 ATOM 98449 O WAT 2193 31.736 51.445 96.695 1.00 0.00 O ATOM 98450 H1 WAT 2193 31.560 52.029 97.432 1.00 0.00 H ATOM 98451 H2 WAT 2193 31.638 52.000 95.921 1.00 0.00 H TER 98453 WAT 2193 ATOM 98453 O WAT 2194 79.692 68.058 76.615 1.00 0.00 O ATOM 98454 H1 WAT 2194 78.745 67.954 76.528 1.00 0.00 H ATOM 98455 H2 WAT 2194 79.956 68.524 75.822 1.00 0.00 H TER 98457 WAT 2194 ATOM 98457 O WAT 2195 90.002 126.563 81.457 1.00 0.00 O ATOM 98458 H1 WAT 2195 90.659 126.084 81.963 1.00 0.00 H ATOM 98459 H2 WAT 2195 89.232 126.586 82.025 1.00 0.00 H TER 98461 WAT 2195 ATOM 98461 O WAT 2196 18.762 126.324 98.864 1.00 0.00 O ATOM 98462 H1 WAT 2196 18.879 126.982 99.549 1.00 0.00 H ATOM 98463 H2 WAT 2196 17.842 126.402 98.611 1.00 0.00 H TER 98465 WAT 2196 ATOM 98465 O WAT 2197 53.210 98.085 124.281 1.00 0.00 O ATOM 98466 H1 WAT 2197 54.105 98.392 124.133 1.00 0.00 H ATOM 98467 H2 WAT 2197 53.295 97.136 124.374 1.00 0.00 H TER 98469 WAT 2197 ATOM 98469 O WAT 2198 8.570 74.714 157.733 1.00 0.00 O ATOM 98470 H1 WAT 2198 7.794 74.543 158.267 1.00 0.00 H ATOM 98471 H2 WAT 2198 8.936 73.847 157.559 1.00 0.00 H TER 98473 WAT 2198 ATOM 98473 O WAT 2199 128.204 114.396 133.450 1.00 0.00 O ATOM 98474 H1 WAT 2199 127.373 114.487 132.984 1.00 0.00 H ATOM 98475 H2 WAT 2199 128.715 113.791 132.913 1.00 0.00 H TER 98477 WAT 2199 ATOM 98477 O WAT 2200 46.295 0.824 83.197 1.00 0.00 O ATOM 98478 H1 WAT 2200 45.819 0.340 82.522 1.00 0.00 H ATOM 98479 H2 WAT 2200 46.105 0.353 84.008 1.00 0.00 H TER 98481 WAT 2200 ATOM 98481 O WAT 2201 90.543 72.955 124.573 1.00 0.00 O ATOM 98482 H1 WAT 2201 90.630 72.372 125.327 1.00 0.00 H ATOM 98483 H2 WAT 2201 90.867 73.800 124.885 1.00 0.00 H TER 98485 WAT 2201 ATOM 98485 O WAT 2202 49.324 9.637 58.709 1.00 0.00 O ATOM 98486 H1 WAT 2202 48.785 9.743 57.925 1.00 0.00 H ATOM 98487 H2 WAT 2202 50.210 9.859 58.422 1.00 0.00 H TER 98489 WAT 2202 ATOM 98489 O WAT 2203 141.282 97.505 92.226 1.00 0.00 O ATOM 98490 H1 WAT 2203 142.197 97.768 92.128 1.00 0.00 H ATOM 98491 H2 WAT 2203 141.322 96.659 92.672 1.00 0.00 H TER 98493 WAT 2203 ATOM 98493 O WAT 2204 96.454 69.793 59.693 1.00 0.00 O ATOM 98494 H1 WAT 2204 95.650 69.302 59.521 1.00 0.00 H ATOM 98495 H2 WAT 2204 97.034 69.160 60.117 1.00 0.00 H TER 98497 WAT 2204 ATOM 98497 O WAT 2205 44.240 49.181 107.285 1.00 0.00 O ATOM 98498 H1 WAT 2205 43.474 49.630 107.642 1.00 0.00 H ATOM 98499 H2 WAT 2205 44.214 49.370 106.347 1.00 0.00 H TER 98501 WAT 2205 ATOM 98501 O WAT 2206 73.810 26.952 57.309 1.00 0.00 O ATOM 98502 H1 WAT 2206 73.013 27.262 57.740 1.00 0.00 H ATOM 98503 H2 WAT 2206 74.386 26.694 58.029 1.00 0.00 H TER 98505 WAT 2206 ATOM 98505 O WAT 2207 105.722 19.735 80.574 1.00 0.00 O ATOM 98506 H1 WAT 2207 105.246 19.949 79.771 1.00 0.00 H ATOM 98507 H2 WAT 2207 106.115 18.880 80.398 1.00 0.00 H TER 98509 WAT 2207 ATOM 98509 O WAT 2208 13.123 7.075 146.914 1.00 0.00 O ATOM 98510 H1 WAT 2208 13.523 7.253 147.765 1.00 0.00 H ATOM 98511 H2 WAT 2208 13.760 7.400 146.278 1.00 0.00 H TER 98513 WAT 2208 ATOM 98513 O WAT 2209 6.324 68.133 125.722 1.00 0.00 O ATOM 98514 H1 WAT 2209 6.329 68.088 126.678 1.00 0.00 H ATOM 98515 H2 WAT 2209 6.322 69.069 125.526 1.00 0.00 H TER 98517 WAT 2209 ATOM 98517 O WAT 2210 1.144 143.233 139.246 1.00 0.00 O ATOM 98518 H1 WAT 2210 1.308 144.109 139.595 1.00 0.00 H ATOM 98519 H2 WAT 2210 0.226 143.061 139.455 1.00 0.00 H TER 98521 WAT 2210 ATOM 98521 O WAT 2211 142.512 63.471 87.547 1.00 0.00 O ATOM 98522 H1 WAT 2211 141.804 62.957 87.160 1.00 0.00 H ATOM 98523 H2 WAT 2211 142.717 63.018 88.365 1.00 0.00 H TER 98525 WAT 2211 ATOM 98525 O WAT 2212 81.273 6.062 97.453 1.00 0.00 O ATOM 98526 H1 WAT 2212 82.004 6.364 96.913 1.00 0.00 H ATOM 98527 H2 WAT 2212 80.850 6.866 97.755 1.00 0.00 H TER 98529 WAT 2212 ATOM 98529 O WAT 2213 25.289 118.862 10.523 1.00 0.00 O ATOM 98530 H1 WAT 2213 25.771 118.479 9.790 1.00 0.00 H ATOM 98531 H2 WAT 2213 24.537 119.291 10.116 1.00 0.00 H TER 98533 WAT 2213 ATOM 98533 O WAT 2214 65.998 7.268 25.640 1.00 0.00 O ATOM 98534 H1 WAT 2214 66.050 7.545 24.726 1.00 0.00 H ATOM 98535 H2 WAT 2214 65.738 8.057 26.116 1.00 0.00 H TER 98537 WAT 2214 ATOM 98537 O WAT 2215 57.189 38.874 83.762 1.00 0.00 O ATOM 98538 H1 WAT 2215 56.363 39.187 83.394 1.00 0.00 H ATOM 98539 H2 WAT 2215 57.246 37.961 83.481 1.00 0.00 H TER 98541 WAT 2215 ATOM 98541 O WAT 2216 23.300 8.483 90.392 1.00 0.00 O ATOM 98542 H1 WAT 2216 22.799 7.976 89.754 1.00 0.00 H ATOM 98543 H2 WAT 2216 23.379 7.903 91.150 1.00 0.00 H TER 98545 WAT 2216 ATOM 98545 O WAT 2217 4.440 59.717 16.899 1.00 0.00 O ATOM 98546 H1 WAT 2217 4.567 59.017 16.258 1.00 0.00 H ATOM 98547 H2 WAT 2217 4.057 59.279 17.659 1.00 0.00 H TER 98549 WAT 2217 ATOM 98549 O WAT 2218 14.509 102.059 145.278 1.00 0.00 O ATOM 98550 H1 WAT 2218 14.968 101.313 145.663 1.00 0.00 H ATOM 98551 H2 WAT 2218 14.225 102.579 146.029 1.00 0.00 H TER 98553 WAT 2218 ATOM 98553 O WAT 2219 49.460 12.886 141.491 1.00 0.00 O ATOM 98554 H1 WAT 2219 50.037 12.765 142.245 1.00 0.00 H ATOM 98555 H2 WAT 2219 49.452 13.831 141.345 1.00 0.00 H TER 98557 WAT 2219 ATOM 98557 O WAT 2220 2.808 105.172 121.771 1.00 0.00 O ATOM 98558 H1 WAT 2220 2.467 105.070 120.882 1.00 0.00 H ATOM 98559 H2 WAT 2220 2.091 104.885 122.336 1.00 0.00 H TER 98561 WAT 2220 ATOM 98561 O WAT 2221 85.347 89.399 24.749 1.00 0.00 O ATOM 98562 H1 WAT 2221 84.592 89.522 24.172 1.00 0.00 H ATOM 98563 H2 WAT 2221 85.629 88.500 24.585 1.00 0.00 H TER 98565 WAT 2221 ATOM 98565 O WAT 2222 143.890 31.947 7.981 1.00 0.00 O ATOM 98566 H1 WAT 2222 144.830 31.807 7.872 1.00 0.00 H ATOM 98567 H2 WAT 2222 143.716 32.773 7.529 1.00 0.00 H TER 98569 WAT 2222 ATOM 98569 O WAT 2223 38.312 91.293 60.853 1.00 0.00 O ATOM 98570 H1 WAT 2223 37.921 90.461 60.586 1.00 0.00 H ATOM 98571 H2 WAT 2223 37.797 91.957 60.395 1.00 0.00 H TER 98573 WAT 2223 ATOM 98573 O WAT 2224 111.055 39.220 152.164 1.00 0.00 O ATOM 98574 H1 WAT 2224 111.272 40.101 151.857 1.00 0.00 H ATOM 98575 H2 WAT 2224 111.697 38.653 151.736 1.00 0.00 H TER 98577 WAT 2224 ATOM 98577 O WAT 2225 10.599 3.229 69.462 1.00 0.00 O ATOM 98578 H1 WAT 2225 10.793 4.160 69.346 1.00 0.00 H ATOM 98579 H2 WAT 2225 10.631 2.865 68.578 1.00 0.00 H TER 98581 WAT 2225 ATOM 98581 O WAT 2226 145.924 93.075 14.217 1.00 0.00 O ATOM 98582 H1 WAT 2226 145.991 92.870 15.150 1.00 0.00 H ATOM 98583 H2 WAT 2226 145.172 93.663 14.155 1.00 0.00 H TER 98585 WAT 2226 ATOM 98585 O WAT 2227 142.265 67.719 82.409 1.00 0.00 O ATOM 98586 H1 WAT 2227 142.393 68.603 82.066 1.00 0.00 H ATOM 98587 H2 WAT 2227 141.435 67.763 82.883 1.00 0.00 H TER 98589 WAT 2227 ATOM 98589 O WAT 2228 11.016 69.372 99.846 1.00 0.00 O ATOM 98590 H1 WAT 2228 10.446 70.138 99.912 1.00 0.00 H ATOM 98591 H2 WAT 2228 10.532 68.675 100.289 1.00 0.00 H TER 98593 WAT 2228 ATOM 98593 O WAT 2229 130.183 86.360 111.938 1.00 0.00 O ATOM 98594 H1 WAT 2229 129.428 86.384 111.350 1.00 0.00 H ATOM 98595 H2 WAT 2229 130.612 87.207 111.811 1.00 0.00 H TER 98597 WAT 2229 ATOM 98597 O WAT 2230 106.382 25.235 86.145 1.00 0.00 O ATOM 98598 H1 WAT 2230 106.797 24.622 86.752 1.00 0.00 H ATOM 98599 H2 WAT 2230 107.101 25.782 85.829 1.00 0.00 H TER 98601 WAT 2230 ATOM 98601 O WAT 2231 9.683 43.823 65.610 1.00 0.00 O ATOM 98602 H1 WAT 2231 9.947 44.373 66.347 1.00 0.00 H ATOM 98603 H2 WAT 2231 10.252 43.056 65.667 1.00 0.00 H TER 98605 WAT 2231 ATOM 98605 O WAT 2232 134.075 58.368 75.613 1.00 0.00 O ATOM 98606 H1 WAT 2232 133.991 57.832 76.401 1.00 0.00 H ATOM 98607 H2 WAT 2232 135.000 58.302 75.375 1.00 0.00 H TER 98609 WAT 2232 ATOM 98609 O WAT 2233 40.797 145.300 9.462 1.00 0.00 O ATOM 98610 H1 WAT 2233 40.362 145.624 10.250 1.00 0.00 H ATOM 98611 H2 WAT 2233 41.080 146.090 9.002 1.00 0.00 H TER 98613 WAT 2233 ATOM 98613 O WAT 2234 124.331 121.903 124.908 1.00 0.00 O ATOM 98614 H1 WAT 2234 124.754 121.045 124.939 1.00 0.00 H ATOM 98615 H2 WAT 2234 124.227 122.152 125.827 1.00 0.00 H TER 98617 WAT 2234 ATOM 98617 O WAT 2235 43.443 110.397 155.542 1.00 0.00 O ATOM 98618 H1 WAT 2235 43.719 110.809 154.723 1.00 0.00 H ATOM 98619 H2 WAT 2235 42.487 110.390 155.496 1.00 0.00 H TER 98621 WAT 2235 ATOM 98621 O WAT 2236 134.196 78.966 123.926 1.00 0.00 O ATOM 98622 H1 WAT 2236 133.272 78.933 124.173 1.00 0.00 H ATOM 98623 H2 WAT 2236 134.669 78.787 124.739 1.00 0.00 H TER 98625 WAT 2236 ATOM 98625 O WAT 2237 34.434 69.617 87.553 1.00 0.00 O ATOM 98626 H1 WAT 2237 33.581 69.867 87.907 1.00 0.00 H ATOM 98627 H2 WAT 2237 34.938 69.335 88.317 1.00 0.00 H TER 98629 WAT 2237 ATOM 98629 O WAT 2238 67.483 44.449 14.777 1.00 0.00 O ATOM 98630 H1 WAT 2238 68.295 43.951 14.867 1.00 0.00 H ATOM 98631 H2 WAT 2238 67.035 44.044 14.034 1.00 0.00 H TER 98633 WAT 2238 ATOM 98633 O WAT 2239 106.746 80.713 109.922 1.00 0.00 O ATOM 98634 H1 WAT 2239 107.658 80.903 110.142 1.00 0.00 H ATOM 98635 H2 WAT 2239 106.426 80.190 110.657 1.00 0.00 H TER 98637 WAT 2239 ATOM 98637 O WAT 2240 109.317 118.174 118.677 1.00 0.00 O ATOM 98638 H1 WAT 2240 109.179 119.031 118.275 1.00 0.00 H ATOM 98639 H2 WAT 2240 110.168 118.246 119.108 1.00 0.00 H TER 98641 WAT 2240 ATOM 98641 O WAT 2241 108.798 70.051 98.459 1.00 0.00 O ATOM 98642 H1 WAT 2241 108.137 70.378 99.069 1.00 0.00 H ATOM 98643 H2 WAT 2241 109.493 69.706 99.020 1.00 0.00 H TER 98645 WAT 2241 ATOM 98645 O WAT 2242 127.246 95.011 103.801 1.00 0.00 O ATOM 98646 H1 WAT 2242 126.719 95.561 103.221 1.00 0.00 H ATOM 98647 H2 WAT 2242 126.613 94.632 104.411 1.00 0.00 H TER 98649 WAT 2242 ATOM 98649 O WAT 2243 63.758 17.565 12.266 1.00 0.00 O ATOM 98650 H1 WAT 2243 63.673 16.618 12.375 1.00 0.00 H ATOM 98651 H2 WAT 2243 63.562 17.718 11.341 1.00 0.00 H TER 98653 WAT 2243 ATOM 98653 O WAT 2244 41.647 141.428 117.080 1.00 0.00 O ATOM 98654 H1 WAT 2244 41.105 140.672 116.855 1.00 0.00 H ATOM 98655 H2 WAT 2244 41.234 141.793 117.863 1.00 0.00 H TER 98657 WAT 2244 ATOM 98657 O WAT 2245 40.867 41.523 132.055 1.00 0.00 O ATOM 98658 H1 WAT 2245 41.606 42.071 132.320 1.00 0.00 H ATOM 98659 H2 WAT 2245 40.977 41.414 131.110 1.00 0.00 H TER 98661 WAT 2245 ATOM 98661 O WAT 2246 90.034 61.024 77.780 1.00 0.00 O ATOM 98662 H1 WAT 2246 90.037 60.340 77.110 1.00 0.00 H ATOM 98663 H2 WAT 2246 90.701 61.646 77.491 1.00 0.00 H TER 98665 WAT 2246 ATOM 98665 O WAT 2247 143.569 10.219 133.552 1.00 0.00 O ATOM 98666 H1 WAT 2247 143.086 10.999 133.825 1.00 0.00 H ATOM 98667 H2 WAT 2247 144.350 10.561 133.117 1.00 0.00 H TER 98669 WAT 2247 ATOM 98669 O WAT 2248 7.782 90.198 97.944 1.00 0.00 O ATOM 98670 H1 WAT 2248 7.527 89.537 98.587 1.00 0.00 H ATOM 98671 H2 WAT 2248 8.326 90.813 98.435 1.00 0.00 H TER 98673 WAT 2248 ATOM 98673 O WAT 2249 96.954 67.015 57.986 1.00 0.00 O ATOM 98674 H1 WAT 2249 97.450 67.775 57.681 1.00 0.00 H ATOM 98675 H2 WAT 2249 96.037 67.279 57.905 1.00 0.00 H TER 98677 WAT 2249 ATOM 98677 O WAT 2250 54.772 103.442 116.702 1.00 0.00 O ATOM 98678 H1 WAT 2250 55.363 102.934 117.257 1.00 0.00 H ATOM 98679 H2 WAT 2250 55.304 104.175 116.393 1.00 0.00 H TER 98681 WAT 2250 ATOM 98681 O WAT 2251 52.312 68.873 138.849 1.00 0.00 O ATOM 98682 H1 WAT 2251 52.926 69.032 138.132 1.00 0.00 H ATOM 98683 H2 WAT 2251 51.463 68.768 138.420 1.00 0.00 H TER 98685 WAT 2251 ATOM 98685 O WAT 2252 93.176 125.565 114.981 1.00 0.00 O ATOM 98686 H1 WAT 2252 93.730 125.646 115.758 1.00 0.00 H ATOM 98687 H2 WAT 2252 92.589 126.320 115.027 1.00 0.00 H TER 98689 WAT 2252 ATOM 98689 O WAT 2253 84.405 55.806 7.501 1.00 0.00 O ATOM 98690 H1 WAT 2253 84.875 55.030 7.807 1.00 0.00 H ATOM 98691 H2 WAT 2253 84.307 56.350 8.283 1.00 0.00 H TER 98693 WAT 2253 ATOM 98693 O WAT 2254 42.698 101.762 12.658 1.00 0.00 O ATOM 98694 H1 WAT 2254 43.556 102.098 12.399 1.00 0.00 H ATOM 98695 H2 WAT 2254 42.101 102.085 11.983 1.00 0.00 H TER 98697 WAT 2254 ATOM 98697 O WAT 2255 41.112 47.821 83.004 1.00 0.00 O ATOM 98698 H1 WAT 2255 40.486 48.528 82.853 1.00 0.00 H ATOM 98699 H2 WAT 2255 40.815 47.112 82.434 1.00 0.00 H TER 98701 WAT 2255 ATOM 98701 O WAT 2256 20.421 72.045 4.927 1.00 0.00 O ATOM 98702 H1 WAT 2256 20.113 71.168 4.696 1.00 0.00 H ATOM 98703 H2 WAT 2256 19.635 72.506 5.218 1.00 0.00 H TER 98705 WAT 2256 ATOM 98705 O WAT 2257 114.677 120.168 96.273 1.00 0.00 O ATOM 98706 H1 WAT 2257 114.530 121.090 96.065 1.00 0.00 H ATOM 98707 H2 WAT 2257 114.112 119.999 97.027 1.00 0.00 H TER 98709 WAT 2257 ATOM 98709 O WAT 2258 38.672 41.543 107.868 1.00 0.00 O ATOM 98710 H1 WAT 2258 38.366 42.278 108.401 1.00 0.00 H ATOM 98711 H2 WAT 2258 39.608 41.484 108.056 1.00 0.00 H TER 98713 WAT 2258 ATOM 98713 O WAT 2259 34.407 79.037 18.989 1.00 0.00 O ATOM 98714 H1 WAT 2259 33.847 78.282 18.812 1.00 0.00 H ATOM 98715 H2 WAT 2259 34.642 78.949 19.913 1.00 0.00 H TER 98717 WAT 2259 ATOM 98717 O WAT 2260 106.590 14.139 109.251 1.00 0.00 O ATOM 98718 H1 WAT 2260 105.886 13.948 108.631 1.00 0.00 H ATOM 98719 H2 WAT 2260 106.138 14.381 110.060 1.00 0.00 H TER 98721 WAT 2260 ATOM 98721 O WAT 2261 42.496 70.944 145.154 1.00 0.00 O ATOM 98722 H1 WAT 2261 41.865 71.018 144.438 1.00 0.00 H ATOM 98723 H2 WAT 2261 41.961 70.941 145.947 1.00 0.00 H TER 98725 WAT 2261 ATOM 98725 O WAT 2262 66.035 14.100 151.838 1.00 0.00 O ATOM 98726 H1 WAT 2262 65.712 14.920 151.466 1.00 0.00 H ATOM 98727 H2 WAT 2262 66.193 14.300 152.760 1.00 0.00 H TER 98729 WAT 2262 ATOM 98729 O WAT 2263 17.318 82.098 148.231 1.00 0.00 O ATOM 98730 H1 WAT 2263 17.382 82.472 149.110 1.00 0.00 H ATOM 98731 H2 WAT 2263 17.508 81.168 148.352 1.00 0.00 H TER 98733 WAT 2263 ATOM 98733 O WAT 2264 7.378 66.575 158.693 1.00 0.00 O ATOM 98734 H1 WAT 2264 6.850 65.787 158.565 1.00 0.00 H ATOM 98735 H2 WAT 2264 7.990 66.575 157.958 1.00 0.00 H TER 98737 WAT 2264 ATOM 98737 O WAT 2265 12.371 27.452 96.265 1.00 0.00 O ATOM 98738 H1 WAT 2265 13.236 27.684 95.927 1.00 0.00 H ATOM 98739 H2 WAT 2265 11.977 26.923 95.572 1.00 0.00 H TER 98741 WAT 2265 ATOM 98741 O WAT 2266 129.807 99.083 97.058 1.00 0.00 O ATOM 98742 H1 WAT 2266 128.898 98.898 97.293 1.00 0.00 H ATOM 98743 H2 WAT 2266 129.766 99.370 96.146 1.00 0.00 H TER 98745 WAT 2266 ATOM 98745 O WAT 2267 96.985 145.417 142.904 1.00 0.00 O ATOM 98746 H1 WAT 2267 97.385 145.293 143.764 1.00 0.00 H ATOM 98747 H2 WAT 2267 96.055 145.546 143.089 1.00 0.00 H TER 98749 WAT 2267 ATOM 98749 O WAT 2268 116.187 51.839 13.452 1.00 0.00 O ATOM 98750 H1 WAT 2268 115.332 51.552 13.131 1.00 0.00 H ATOM 98751 H2 WAT 2268 116.052 51.992 14.387 1.00 0.00 H TER 98753 WAT 2268 ATOM 98753 O WAT 2269 127.493 46.596 100.802 1.00 0.00 O ATOM 98754 H1 WAT 2269 127.895 47.055 101.540 1.00 0.00 H ATOM 98755 H2 WAT 2269 126.796 47.182 100.506 1.00 0.00 H TER 98757 WAT 2269 ATOM 98757 O WAT 2270 36.288 32.602 102.130 1.00 0.00 O ATOM 98758 H1 WAT 2270 36.905 32.141 101.562 1.00 0.00 H ATOM 98759 H2 WAT 2270 36.657 32.512 103.008 1.00 0.00 H TER 98761 WAT 2270 ATOM 98761 O WAT 2271 13.034 94.801 151.872 1.00 0.00 O ATOM 98762 H1 WAT 2271 13.530 94.334 152.544 1.00 0.00 H ATOM 98763 H2 WAT 2271 13.121 95.725 152.108 1.00 0.00 H TER 98765 WAT 2271 ATOM 98765 O WAT 2272 55.129 125.885 53.802 1.00 0.00 O ATOM 98766 H1 WAT 2272 55.546 125.949 54.662 1.00 0.00 H ATOM 98767 H2 WAT 2272 55.261 126.747 53.408 1.00 0.00 H TER 98769 WAT 2272 ATOM 98769 O WAT 2273 66.596 32.323 74.685 1.00 0.00 O ATOM 98770 H1 WAT 2273 67.112 31.610 75.063 1.00 0.00 H ATOM 98771 H2 WAT 2273 66.168 32.733 75.436 1.00 0.00 H TER 98773 WAT 2273 ATOM 98773 O WAT 2274 55.045 28.625 115.269 1.00 0.00 O ATOM 98774 H1 WAT 2274 55.217 27.753 114.915 1.00 0.00 H ATOM 98775 H2 WAT 2274 54.405 29.006 114.668 1.00 0.00 H TER 98777 WAT 2274 ATOM 98777 O WAT 2275 131.556 118.079 100.457 1.00 0.00 O ATOM 98778 H1 WAT 2275 132.203 118.054 101.163 1.00 0.00 H ATOM 98779 H2 WAT 2275 132.078 118.095 99.655 1.00 0.00 H TER 98781 WAT 2275 ATOM 98781 O WAT 2276 15.119 31.197 15.860 1.00 0.00 O ATOM 98782 H1 WAT 2276 16.074 31.170 15.918 1.00 0.00 H ATOM 98783 H2 WAT 2276 14.869 31.961 16.381 1.00 0.00 H TER 98785 WAT 2276 ATOM 98785 O WAT 2277 85.917 80.726 4.430 1.00 0.00 O ATOM 98786 H1 WAT 2277 86.381 79.903 4.276 1.00 0.00 H ATOM 98787 H2 WAT 2277 85.392 80.856 3.639 1.00 0.00 H TER 98789 WAT 2277 ATOM 98789 O WAT 2278 123.807 137.920 101.322 1.00 0.00 O ATOM 98790 H1 WAT 2278 123.275 138.675 101.073 1.00 0.00 H ATOM 98791 H2 WAT 2278 124.200 137.623 100.501 1.00 0.00 H TER 98793 WAT 2278 ATOM 98793 O WAT 2279 120.234 34.167 112.169 1.00 0.00 O ATOM 98794 H1 WAT 2279 120.415 33.738 111.332 1.00 0.00 H ATOM 98795 H2 WAT 2279 119.456 33.720 112.503 1.00 0.00 H TER 98797 WAT 2279 ATOM 98797 O WAT 2280 70.646 116.590 94.132 1.00 0.00 O ATOM 98798 H1 WAT 2280 69.906 116.473 94.728 1.00 0.00 H ATOM 98799 H2 WAT 2280 70.876 117.516 94.215 1.00 0.00 H TER 98801 WAT 2280 ATOM 98801 O WAT 2281 39.134 96.058 65.480 1.00 0.00 O ATOM 98802 H1 WAT 2281 39.664 95.342 65.833 1.00 0.00 H ATOM 98803 H2 WAT 2281 38.765 95.706 64.670 1.00 0.00 H TER 98805 WAT 2281 ATOM 98805 O WAT 2282 40.414 40.853 66.238 1.00 0.00 O ATOM 98806 H1 WAT 2282 40.790 41.522 66.810 1.00 0.00 H ATOM 98807 H2 WAT 2282 40.899 40.055 66.452 1.00 0.00 H TER 98809 WAT 2282 ATOM 98809 O WAT 2283 21.818 145.243 147.556 1.00 0.00 O ATOM 98810 H1 WAT 2283 22.333 145.646 148.255 1.00 0.00 H ATOM 98811 H2 WAT 2283 20.910 145.338 147.843 1.00 0.00 H TER 98813 WAT 2283 ATOM 98813 O WAT 2284 20.127 121.209 7.748 1.00 0.00 O ATOM 98814 H1 WAT 2284 20.552 121.020 6.911 1.00 0.00 H ATOM 98815 H2 WAT 2284 20.355 120.465 8.305 1.00 0.00 H TER 98817 WAT 2284 ATOM 98817 O WAT 2285 43.577 106.058 155.266 1.00 0.00 O ATOM 98818 H1 WAT 2285 43.055 106.798 154.954 1.00 0.00 H ATOM 98819 H2 WAT 2285 43.834 105.594 154.470 1.00 0.00 H TER 98821 WAT 2285 ATOM 98821 O WAT 2286 16.709 65.966 11.378 1.00 0.00 O ATOM 98822 H1 WAT 2286 16.954 66.581 12.069 1.00 0.00 H ATOM 98823 H2 WAT 2286 15.752 65.960 11.391 1.00 0.00 H TER 98825 WAT 2286 ATOM 98825 O WAT 2287 123.697 17.815 66.696 1.00 0.00 O ATOM 98826 H1 WAT 2287 123.146 17.040 66.582 1.00 0.00 H ATOM 98827 H2 WAT 2287 123.405 18.419 66.014 1.00 0.00 H TER 98829 WAT 2287 ATOM 98829 O WAT 2288 95.624 56.686 5.084 1.00 0.00 O ATOM 98830 H1 WAT 2288 95.200 57.192 4.390 1.00 0.00 H ATOM 98831 H2 WAT 2288 95.961 57.346 5.690 1.00 0.00 H TER 98833 WAT 2288 ATOM 98833 O WAT 2289 26.272 128.994 110.324 1.00 0.00 O ATOM 98834 H1 WAT 2289 26.995 128.845 110.932 1.00 0.00 H ATOM 98835 H2 WAT 2289 26.466 128.427 109.577 1.00 0.00 H TER 98837 WAT 2289 ATOM 98837 O WAT 2290 129.094 72.998 151.057 1.00 0.00 O ATOM 98838 H1 WAT 2290 128.994 72.835 150.119 1.00 0.00 H ATOM 98839 H2 WAT 2290 128.198 73.025 151.392 1.00 0.00 H TER 98841 WAT 2290 ATOM 98841 O WAT 2291 66.220 93.386 104.098 1.00 0.00 O ATOM 98842 H1 WAT 2291 66.931 93.755 103.573 1.00 0.00 H ATOM 98843 H2 WAT 2291 66.215 93.913 104.897 1.00 0.00 H TER 98845 WAT 2291 ATOM 98845 O WAT 2292 63.147 20.114 19.044 1.00 0.00 O ATOM 98846 H1 WAT 2292 63.323 19.195 19.244 1.00 0.00 H ATOM 98847 H2 WAT 2292 63.940 20.575 19.317 1.00 0.00 H TER 98849 WAT 2292 ATOM 98849 O WAT 2293 32.598 2.173 71.750 1.00 0.00 O ATOM 98850 H1 WAT 2293 33.172 1.407 71.757 1.00 0.00 H ATOM 98851 H2 WAT 2293 32.120 2.121 72.578 1.00 0.00 H TER 98853 WAT 2293 ATOM 98853 O WAT 2294 134.581 123.686 1.017 1.00 0.00 O ATOM 98854 H1 WAT 2294 133.933 123.430 0.361 1.00 0.00 H ATOM 98855 H2 WAT 2294 135.424 123.570 0.578 1.00 0.00 H TER 98857 WAT 2294 ATOM 98857 O WAT 2295 132.467 46.109 84.893 1.00 0.00 O ATOM 98858 H1 WAT 2295 132.893 45.706 84.136 1.00 0.00 H ATOM 98859 H2 WAT 2295 131.974 46.844 84.527 1.00 0.00 H TER 98861 WAT 2295 ATOM 98861 O WAT 2296 112.892 90.847 13.864 1.00 0.00 O ATOM 98862 H1 WAT 2296 112.454 91.060 14.688 1.00 0.00 H ATOM 98863 H2 WAT 2296 112.383 90.122 13.502 1.00 0.00 H TER 98865 WAT 2296 ATOM 98865 O WAT 2297 27.939 92.315 88.284 1.00 0.00 O ATOM 98866 H1 WAT 2297 28.530 92.656 87.612 1.00 0.00 H ATOM 98867 H2 WAT 2297 27.774 91.410 88.020 1.00 0.00 H TER 98869 WAT 2297 ATOM 98869 O WAT 2298 60.856 136.124 71.988 1.00 0.00 O ATOM 98870 H1 WAT 2298 61.292 136.458 72.772 1.00 0.00 H ATOM 98871 H2 WAT 2298 60.282 135.429 72.310 1.00 0.00 H TER 98873 WAT 2298 ATOM 98873 O WAT 2299 85.043 76.923 14.383 1.00 0.00 O ATOM 98874 H1 WAT 2299 84.860 76.265 15.054 1.00 0.00 H ATOM 98875 H2 WAT 2299 84.195 77.091 13.973 1.00 0.00 H TER 98877 WAT 2299 ATOM 98877 O WAT 2300 65.432 2.138 82.465 1.00 0.00 O ATOM 98878 H1 WAT 2300 64.707 1.516 82.398 1.00 0.00 H ATOM 98879 H2 WAT 2300 65.701 2.290 81.559 1.00 0.00 H TER 98881 WAT 2300 ATOM 98881 O WAT 2301 38.595 17.713 137.689 1.00 0.00 O ATOM 98882 H1 WAT 2301 38.723 17.176 136.907 1.00 0.00 H ATOM 98883 H2 WAT 2301 38.548 17.081 138.407 1.00 0.00 H TER 98885 WAT 2301 ATOM 98885 O WAT 2302 17.384 63.513 9.719 1.00 0.00 O ATOM 98886 H1 WAT 2302 17.234 64.407 10.027 1.00 0.00 H ATOM 98887 H2 WAT 2302 18.328 63.385 9.803 1.00 0.00 H TER 98889 WAT 2302 ATOM 98889 O WAT 2303 0.652 47.158 95.189 1.00 0.00 O ATOM 98890 H1 WAT 2303 0.949 47.427 94.319 1.00 0.00 H ATOM 98891 H2 WAT 2303 0.826 47.917 95.746 1.00 0.00 H TER 98893 WAT 2303 ATOM 98893 O WAT 2304 15.876 85.818 3.309 1.00 0.00 O ATOM 98894 H1 WAT 2304 16.796 85.637 3.500 1.00 0.00 H ATOM 98895 H2 WAT 2304 15.581 85.058 2.808 1.00 0.00 H TER 98897 WAT 2304 ATOM 98897 O WAT 2305 81.212 88.256 60.211 1.00 0.00 O ATOM 98898 H1 WAT 2305 80.507 88.589 60.765 1.00 0.00 H ATOM 98899 H2 WAT 2305 80.771 87.962 59.413 1.00 0.00 H TER 98901 WAT 2305 ATOM 98901 O WAT 2306 128.710 122.441 60.133 1.00 0.00 O ATOM 98902 H1 WAT 2306 129.105 122.508 61.002 1.00 0.00 H ATOM 98903 H2 WAT 2306 128.772 121.512 59.912 1.00 0.00 H TER 98905 WAT 2306 ATOM 98905 O WAT 2307 43.726 69.457 16.453 1.00 0.00 O ATOM 98906 H1 WAT 2307 43.074 69.177 15.810 1.00 0.00 H ATOM 98907 H2 WAT 2307 44.140 70.224 16.056 1.00 0.00 H TER 98909 WAT 2307 ATOM 98909 O WAT 2308 101.677 17.053 77.234 1.00 0.00 O ATOM 98910 H1 WAT 2308 102.382 16.412 77.334 1.00 0.00 H ATOM 98911 H2 WAT 2308 101.790 17.650 77.974 1.00 0.00 H TER 98913 WAT 2308 ATOM 98913 O WAT 2309 125.820 4.197 150.974 1.00 0.00 O ATOM 98914 H1 WAT 2309 125.430 5.036 150.725 1.00 0.00 H ATOM 98915 H2 WAT 2309 126.748 4.291 150.758 1.00 0.00 H TER 98917 WAT 2309 ATOM 98917 O WAT 2310 5.151 127.093 95.233 1.00 0.00 O ATOM 98918 H1 WAT 2310 5.310 128.026 95.090 1.00 0.00 H ATOM 98919 H2 WAT 2310 5.269 126.694 94.371 1.00 0.00 H TER 98921 WAT 2310 ATOM 98921 O WAT 2311 20.776 123.632 136.249 1.00 0.00 O ATOM 98922 H1 WAT 2311 21.478 123.276 136.793 1.00 0.00 H ATOM 98923 H2 WAT 2311 21.113 124.473 135.941 1.00 0.00 H TER 98925 WAT 2311 ATOM 98925 O WAT 2312 106.363 41.728 103.565 1.00 0.00 O ATOM 98926 H1 WAT 2312 107.138 42.246 103.348 1.00 0.00 H ATOM 98927 H2 WAT 2312 106.686 40.829 103.632 1.00 0.00 H TER 98929 WAT 2312 ATOM 98929 O WAT 2313 37.715 113.336 60.847 1.00 0.00 O ATOM 98930 H1 WAT 2313 36.826 113.181 61.168 1.00 0.00 H ATOM 98931 H2 WAT 2313 37.754 112.869 60.013 1.00 0.00 H TER 98933 WAT 2313 ATOM 98933 O WAT 2314 10.327 116.725 100.799 1.00 0.00 O ATOM 98934 H1 WAT 2314 10.042 115.915 100.377 1.00 0.00 H ATOM 98935 H2 WAT 2314 10.737 117.230 100.097 1.00 0.00 H TER 98937 WAT 2314 ATOM 98937 O WAT 2315 18.244 24.417 19.334 1.00 0.00 O ATOM 98938 H1 WAT 2315 18.169 24.391 20.288 1.00 0.00 H ATOM 98939 H2 WAT 2315 18.066 23.519 19.055 1.00 0.00 H TER 98941 WAT 2315 ATOM 98941 O WAT 2316 129.087 84.660 96.756 1.00 0.00 O ATOM 98942 H1 WAT 2316 129.416 85.559 96.752 1.00 0.00 H ATOM 98943 H2 WAT 2316 129.857 84.122 96.571 1.00 0.00 H TER 98945 WAT 2316 ATOM 98945 O WAT 2317 135.404 109.587 69.368 1.00 0.00 O ATOM 98946 H1 WAT 2317 135.257 110.414 69.829 1.00 0.00 H ATOM 98947 H2 WAT 2317 136.170 109.207 69.797 1.00 0.00 H TER 98949 WAT 2317 ATOM 98949 O WAT 2318 67.317 35.823 71.888 1.00 0.00 O ATOM 98950 H1 WAT 2318 67.301 36.628 72.406 1.00 0.00 H ATOM 98951 H2 WAT 2318 66.395 35.625 71.724 1.00 0.00 H TER 98953 WAT 2318 ATOM 98953 O WAT 2319 91.228 24.104 67.557 1.00 0.00 O ATOM 98954 H1 WAT 2319 91.819 24.595 66.985 1.00 0.00 H ATOM 98955 H2 WAT 2319 91.209 24.607 68.371 1.00 0.00 H TER 98957 WAT 2319 ATOM 98957 O WAT 2320 135.940 108.062 102.297 1.00 0.00 O ATOM 98958 H1 WAT 2320 135.142 108.503 102.588 1.00 0.00 H ATOM 98959 H2 WAT 2320 135.637 107.223 101.949 1.00 0.00 H TER 98961 WAT 2320 ATOM 98961 O WAT 2321 72.710 53.369 139.681 1.00 0.00 O ATOM 98962 H1 WAT 2321 72.853 52.593 140.224 1.00 0.00 H ATOM 98963 H2 WAT 2321 73.542 53.841 139.715 1.00 0.00 H TER 98965 WAT 2321 ATOM 98965 O WAT 2322 7.057 79.550 99.581 1.00 0.00 O ATOM 98966 H1 WAT 2322 6.847 78.782 99.050 1.00 0.00 H ATOM 98967 H2 WAT 2322 8.014 79.582 99.589 1.00 0.00 H TER 98969 WAT 2322 ATOM 98969 O WAT 2323 113.651 69.812 75.493 1.00 0.00 O ATOM 98970 H1 WAT 2323 113.077 69.741 74.730 1.00 0.00 H ATOM 98971 H2 WAT 2323 114.304 70.465 75.242 1.00 0.00 H TER 98973 WAT 2323 ATOM 98973 O WAT 2324 125.198 32.060 78.170 1.00 0.00 O ATOM 98974 H1 WAT 2324 125.572 32.921 78.355 1.00 0.00 H ATOM 98975 H2 WAT 2324 125.210 31.607 79.014 1.00 0.00 H TER 98977 WAT 2324 ATOM 98977 O WAT 2325 96.436 65.704 145.810 1.00 0.00 O ATOM 98978 H1 WAT 2325 95.517 65.447 145.888 1.00 0.00 H ATOM 98979 H2 WAT 2325 96.695 65.942 146.700 1.00 0.00 H TER 98981 WAT 2325 ATOM 98981 O WAT 2326 110.539 88.891 16.223 1.00 0.00 O ATOM 98982 H1 WAT 2326 110.625 88.644 15.303 1.00 0.00 H ATOM 98983 H2 WAT 2326 109.594 88.909 16.379 1.00 0.00 H TER 98985 WAT 2326 ATOM 98985 O WAT 2327 27.743 4.126 4.584 1.00 0.00 O ATOM 98986 H1 WAT 2327 27.949 3.507 3.883 1.00 0.00 H ATOM 98987 H2 WAT 2327 27.087 3.676 5.116 1.00 0.00 H TER 98989 WAT 2327 ATOM 98989 O WAT 2328 43.526 108.535 61.735 1.00 0.00 O ATOM 98990 H1 WAT 2328 43.999 109.268 62.130 1.00 0.00 H ATOM 98991 H2 WAT 2328 44.026 108.326 60.946 1.00 0.00 H TER 98993 WAT 2328 ATOM 98993 O WAT 2329 140.583 68.631 114.557 1.00 0.00 O ATOM 98994 H1 WAT 2329 139.861 68.006 114.624 1.00 0.00 H ATOM 98995 H2 WAT 2329 141.013 68.414 113.730 1.00 0.00 H TER 98997 WAT 2329 ATOM 98997 O WAT 2330 108.714 14.839 140.207 1.00 0.00 O ATOM 98998 H1 WAT 2330 109.631 14.571 140.271 1.00 0.00 H ATOM 98999 H2 WAT 2330 108.475 14.659 139.298 1.00 0.00 H TER 99001 WAT 2330 ATOM 99001 O WAT 2331 98.366 19.207 5.963 1.00 0.00 O ATOM 99002 H1 WAT 2331 98.894 19.965 6.212 1.00 0.00 H ATOM 99003 H2 WAT 2331 98.001 18.887 6.788 1.00 0.00 H TER 99005 WAT 2331 ATOM 99005 O WAT 2332 1.147 113.376 21.675 1.00 0.00 O ATOM 99006 H1 WAT 2332 1.279 114.304 21.482 1.00 0.00 H ATOM 99007 H2 WAT 2332 1.209 112.943 20.824 1.00 0.00 H TER 99009 WAT 2332 ATOM 99009 O WAT 2333 105.454 71.932 85.555 1.00 0.00 O ATOM 99010 H1 WAT 2333 104.916 71.394 86.136 1.00 0.00 H ATOM 99011 H2 WAT 2333 105.577 71.393 84.774 1.00 0.00 H TER 99013 WAT 2333 ATOM 99013 O WAT 2334 124.814 49.283 143.527 1.00 0.00 O ATOM 99014 H1 WAT 2334 125.390 49.371 144.287 1.00 0.00 H ATOM 99015 H2 WAT 2334 124.241 50.048 143.572 1.00 0.00 H TER 99017 WAT 2334 ATOM 99017 O WAT 2335 114.167 20.386 65.708 1.00 0.00 O ATOM 99018 H1 WAT 2335 114.950 20.935 65.738 1.00 0.00 H ATOM 99019 H2 WAT 2335 114.037 20.103 66.613 1.00 0.00 H TER 99021 WAT 2335 ATOM 99021 O WAT 2336 61.605 124.287 56.787 1.00 0.00 O ATOM 99022 H1 WAT 2336 61.530 124.605 55.888 1.00 0.00 H ATOM 99023 H2 WAT 2336 61.762 123.347 56.696 1.00 0.00 H TER 99025 WAT 2336 ATOM 99025 O WAT 2337 145.559 2.120 136.593 1.00 0.00 O ATOM 99026 H1 WAT 2337 145.289 1.222 136.400 1.00 0.00 H ATOM 99027 H2 WAT 2337 144.756 2.634 136.510 1.00 0.00 H TER 99029 WAT 2337 ATOM 99029 O WAT 2338 7.684 40.149 122.943 1.00 0.00 O ATOM 99030 H1 WAT 2338 7.414 39.913 123.830 1.00 0.00 H ATOM 99031 H2 WAT 2338 8.366 39.514 122.724 1.00 0.00 H TER 99033 WAT 2338 ATOM 99033 O WAT 2339 15.011 122.923 81.686 1.00 0.00 O ATOM 99034 H1 WAT 2339 14.158 123.262 81.959 1.00 0.00 H ATOM 99035 H2 WAT 2339 15.291 122.365 82.411 1.00 0.00 H TER 99037 WAT 2339 ATOM 99037 O WAT 2340 20.602 71.857 125.392 1.00 0.00 O ATOM 99038 H1 WAT 2340 21.233 72.507 125.085 1.00 0.00 H ATOM 99039 H2 WAT 2340 20.225 72.243 126.183 1.00 0.00 H TER 99041 WAT 2340 ATOM 99041 O WAT 2341 10.331 139.425 101.232 1.00 0.00 O ATOM 99042 H1 WAT 2341 10.716 139.569 102.096 1.00 0.00 H ATOM 99043 H2 WAT 2341 10.406 140.271 100.792 1.00 0.00 H TER 99045 WAT 2341 ATOM 99045 O WAT 2342 142.221 93.414 80.606 1.00 0.00 O ATOM 99046 H1 WAT 2342 141.503 93.746 81.145 1.00 0.00 H ATOM 99047 H2 WAT 2342 142.961 93.984 80.816 1.00 0.00 H TER 99049 WAT 2342 ATOM 99049 O WAT 2343 72.892 83.577 73.082 1.00 0.00 O ATOM 99050 H1 WAT 2343 73.451 83.335 72.344 1.00 0.00 H ATOM 99051 H2 WAT 2343 72.745 82.755 73.550 1.00 0.00 H TER 99053 WAT 2343 ATOM 99053 O WAT 2344 102.166 140.374 67.170 1.00 0.00 O ATOM 99054 H1 WAT 2344 102.497 139.837 66.449 1.00 0.00 H ATOM 99055 H2 WAT 2344 102.913 140.467 67.761 1.00 0.00 H TER 99057 WAT 2344 ATOM 99057 O WAT 2345 20.075 37.728 63.479 1.00 0.00 O ATOM 99058 H1 WAT 2345 20.609 38.519 63.555 1.00 0.00 H ATOM 99059 H2 WAT 2345 19.906 37.466 64.384 1.00 0.00 H TER 99061 WAT 2345 ATOM 99061 O WAT 2346 72.282 116.821 60.895 1.00 0.00 O ATOM 99062 H1 WAT 2346 72.661 117.538 60.387 1.00 0.00 H ATOM 99063 H2 WAT 2346 71.456 116.624 60.452 1.00 0.00 H TER 99065 WAT 2346 ATOM 99065 O WAT 2347 126.635 19.873 97.655 1.00 0.00 O ATOM 99066 H1 WAT 2347 127.560 20.120 97.635 1.00 0.00 H ATOM 99067 H2 WAT 2347 126.312 20.220 98.487 1.00 0.00 H TER 99069 WAT 2347 ATOM 99069 O WAT 2348 77.601 94.582 122.854 1.00 0.00 O ATOM 99070 H1 WAT 2348 77.737 95.529 122.854 1.00 0.00 H ATOM 99071 H2 WAT 2348 77.994 94.284 122.034 1.00 0.00 H TER 99073 WAT 2348 ATOM 99073 O WAT 2349 8.092 119.026 114.352 1.00 0.00 O ATOM 99074 H1 WAT 2349 8.603 119.481 113.684 1.00 0.00 H ATOM 99075 H2 WAT 2349 8.034 118.124 114.036 1.00 0.00 H TER 99077 WAT 2349 ATOM 99077 O WAT 2350 135.178 92.494 79.587 1.00 0.00 O ATOM 99078 H1 WAT 2350 134.462 92.769 79.014 1.00 0.00 H ATOM 99079 H2 WAT 2350 135.478 91.665 79.216 1.00 0.00 H TER 99081 WAT 2350 ATOM 99081 O WAT 2351 41.143 69.546 121.123 1.00 0.00 O ATOM 99082 H1 WAT 2351 40.596 69.332 121.878 1.00 0.00 H ATOM 99083 H2 WAT 2351 42.007 69.200 121.346 1.00 0.00 H TER 99085 WAT 2351 ATOM 99085 O WAT 2352 111.494 30.414 103.600 1.00 0.00 O ATOM 99086 H1 WAT 2352 111.978 30.571 104.411 1.00 0.00 H ATOM 99087 H2 WAT 2352 112.172 30.262 102.942 1.00 0.00 H TER 99089 WAT 2352 ATOM 99089 O WAT 2353 113.157 41.540 96.298 1.00 0.00 O ATOM 99090 H1 WAT 2353 113.304 40.602 96.177 1.00 0.00 H ATOM 99091 H2 WAT 2353 113.955 41.855 96.723 1.00 0.00 H TER 99093 WAT 2353 ATOM 99093 O WAT 2354 15.850 69.318 88.286 1.00 0.00 O ATOM 99094 H1 WAT 2354 16.594 69.918 88.340 1.00 0.00 H ATOM 99095 H2 WAT 2354 15.375 69.596 87.502 1.00 0.00 H TER 99097 WAT 2354 ATOM 99097 O WAT 2355 92.471 53.001 143.141 1.00 0.00 O ATOM 99098 H1 WAT 2355 91.680 52.750 142.664 1.00 0.00 H ATOM 99099 H2 WAT 2355 92.447 53.958 143.160 1.00 0.00 H TER 99101 WAT 2355 ATOM 99101 O WAT 2356 130.897 53.141 135.333 1.00 0.00 O ATOM 99102 H1 WAT 2356 131.128 52.396 134.778 1.00 0.00 H ATOM 99103 H2 WAT 2356 131.716 53.379 135.768 1.00 0.00 H TER 99105 WAT 2356 ATOM 99105 O WAT 2357 67.238 21.154 154.928 1.00 0.00 O ATOM 99106 H1 WAT 2357 66.465 21.254 155.484 1.00 0.00 H ATOM 99107 H2 WAT 2357 67.016 20.436 154.335 1.00 0.00 H TER 99109 WAT 2357 ATOM 99109 O WAT 2358 6.635 34.894 94.135 1.00 0.00 O ATOM 99110 H1 WAT 2358 6.646 35.420 94.935 1.00 0.00 H ATOM 99111 H2 WAT 2358 7.369 34.287 94.237 1.00 0.00 H TER 99113 WAT 2358 ATOM 99113 O WAT 2359 126.206 2.499 129.666 1.00 0.00 O ATOM 99114 H1 WAT 2359 126.066 1.555 129.595 1.00 0.00 H ATOM 99115 H2 WAT 2359 127.015 2.658 129.179 1.00 0.00 H TER 99117 WAT 2359 ATOM 99117 O WAT 2360 55.156 144.782 134.355 1.00 0.00 O ATOM 99118 H1 WAT 2360 55.766 145.441 134.686 1.00 0.00 H ATOM 99119 H2 WAT 2360 54.554 145.272 133.795 1.00 0.00 H TER 99121 WAT 2360 ATOM 99121 O WAT 2361 73.257 56.815 100.671 1.00 0.00 O ATOM 99122 H1 WAT 2361 72.712 56.085 100.375 1.00 0.00 H ATOM 99123 H2 WAT 2361 72.665 57.567 100.678 1.00 0.00 H TER 99125 WAT 2361 ATOM 99125 O WAT 2362 9.478 126.632 139.569 1.00 0.00 O ATOM 99126 H1 WAT 2362 8.606 126.684 139.960 1.00 0.00 H ATOM 99127 H2 WAT 2362 9.803 125.769 139.825 1.00 0.00 H TER 99129 WAT 2362 ATOM 99129 O WAT 2363 32.607 117.173 116.503 1.00 0.00 O ATOM 99130 H1 WAT 2363 31.953 116.501 116.307 1.00 0.00 H ATOM 99131 H2 WAT 2363 32.227 117.673 117.225 1.00 0.00 H TER 99133 WAT 2363 ATOM 99133 O WAT 2364 99.329 117.355 8.556 1.00 0.00 O ATOM 99134 H1 WAT 2364 99.696 117.185 7.688 1.00 0.00 H ATOM 99135 H2 WAT 2364 98.382 117.302 8.430 1.00 0.00 H TER 99137 WAT 2364 ATOM 99137 O WAT 2365 84.160 111.953 60.499 1.00 0.00 O ATOM 99138 H1 WAT 2365 85.110 112.065 60.449 1.00 0.00 H ATOM 99139 H2 WAT 2365 83.899 111.722 59.608 1.00 0.00 H TER 99141 WAT 2365 ATOM 99141 O WAT 2366 1.049 11.002 1.200 1.00 0.00 O ATOM 99142 H1 WAT 2366 1.962 11.080 0.922 1.00 0.00 H ATOM 99143 H2 WAT 2366 0.644 11.825 0.924 1.00 0.00 H TER 99145 WAT 2366 ATOM 99145 O WAT 2367 28.645 126.148 67.176 1.00 0.00 O ATOM 99146 H1 WAT 2367 29.533 125.805 67.270 1.00 0.00 H ATOM 99147 H2 WAT 2367 28.355 126.311 68.073 1.00 0.00 H TER 99149 WAT 2367 ATOM 99149 O WAT 2368 5.788 85.257 84.216 1.00 0.00 O ATOM 99150 H1 WAT 2368 6.101 84.870 83.399 1.00 0.00 H ATOM 99151 H2 WAT 2368 4.889 85.526 84.025 1.00 0.00 H TER 99153 WAT 2368 ATOM 99153 O WAT 2369 114.511 59.819 144.413 1.00 0.00 O ATOM 99154 H1 WAT 2369 114.039 59.353 143.722 1.00 0.00 H ATOM 99155 H2 WAT 2369 115.323 60.107 143.996 1.00 0.00 H TER 99157 WAT 2369 ATOM 99157 O WAT 2370 68.670 108.557 151.154 1.00 0.00 O ATOM 99158 H1 WAT 2370 68.641 109.403 150.707 1.00 0.00 H ATOM 99159 H2 WAT 2370 68.738 108.779 152.083 1.00 0.00 H TER 99161 WAT 2370 ATOM 99161 O WAT 2371 6.221 64.376 102.981 1.00 0.00 O ATOM 99162 H1 WAT 2371 5.791 64.783 102.229 1.00 0.00 H ATOM 99163 H2 WAT 2371 5.581 63.746 103.311 1.00 0.00 H TER 99165 WAT 2371 ATOM 99165 O WAT 2372 61.606 52.694 155.253 1.00 0.00 O ATOM 99166 H1 WAT 2372 61.641 52.898 154.319 1.00 0.00 H ATOM 99167 H2 WAT 2372 61.236 53.480 155.656 1.00 0.00 H TER 99169 WAT 2372 ATOM 99169 O WAT 2373 63.478 42.241 56.909 1.00 0.00 O ATOM 99170 H1 WAT 2373 63.488 43.010 56.338 1.00 0.00 H ATOM 99171 H2 WAT 2373 62.616 41.850 56.769 1.00 0.00 H TER 99173 WAT 2373 ATOM 99173 O WAT 2374 120.402 132.190 84.198 1.00 0.00 O ATOM 99174 H1 WAT 2374 120.844 132.891 83.719 1.00 0.00 H ATOM 99175 H2 WAT 2374 120.857 131.392 83.929 1.00 0.00 H TER 99177 WAT 2374 ATOM 99177 O WAT 2375 5.092 69.230 152.400 1.00 0.00 O ATOM 99178 H1 WAT 2375 4.954 68.986 151.485 1.00 0.00 H ATOM 99179 H2 WAT 2375 4.275 68.991 152.837 1.00 0.00 H TER 99181 WAT 2375 ATOM 99181 O WAT 2376 130.757 144.737 100.819 1.00 0.00 O ATOM 99182 H1 WAT 2376 130.731 144.217 101.623 1.00 0.00 H ATOM 99183 H2 WAT 2376 130.704 144.091 100.114 1.00 0.00 H TER 99185 WAT 2376 ATOM 99185 O WAT 2377 39.385 143.889 23.176 1.00 0.00 O ATOM 99186 H1 WAT 2377 38.683 144.205 23.746 1.00 0.00 H ATOM 99187 H2 WAT 2377 40.187 144.050 23.672 1.00 0.00 H TER 99189 WAT 2377 ATOM 99189 O WAT 2378 131.425 129.947 9.131 1.00 0.00 O ATOM 99190 H1 WAT 2378 130.706 129.852 8.507 1.00 0.00 H ATOM 99191 H2 WAT 2378 132.055 130.513 8.685 1.00 0.00 H TER 99193 WAT 2378 ATOM 99193 O WAT 2379 1.571 62.750 120.516 1.00 0.00 O ATOM 99194 H1 WAT 2379 1.344 62.069 119.883 1.00 0.00 H ATOM 99195 H2 WAT 2379 1.972 63.442 119.990 1.00 0.00 H TER 99197 WAT 2379 ATOM 99197 O WAT 2380 61.767 76.985 70.921 1.00 0.00 O ATOM 99198 H1 WAT 2380 62.195 77.605 70.331 1.00 0.00 H ATOM 99199 H2 WAT 2380 61.927 76.128 70.524 1.00 0.00 H TER 99201 WAT 2380 ATOM 99201 O WAT 2381 5.459 22.186 85.459 1.00 0.00 O ATOM 99202 H1 WAT 2381 5.518 21.830 86.346 1.00 0.00 H ATOM 99203 H2 WAT 2381 6.366 22.369 85.214 1.00 0.00 H TER 99205 WAT 2381 ATOM 99205 O WAT 2382 110.543 2.158 77.790 1.00 0.00 O ATOM 99206 H1 WAT 2382 110.724 2.164 78.730 1.00 0.00 H ATOM 99207 H2 WAT 2382 110.175 3.023 77.611 1.00 0.00 H TER 99209 WAT 2382 ATOM 99209 O WAT 2383 58.741 102.880 117.666 1.00 0.00 O ATOM 99210 H1 WAT 2383 59.136 103.139 116.833 1.00 0.00 H ATOM 99211 H2 WAT 2383 59.273 103.318 118.330 1.00 0.00 H TER 99213 WAT 2383 ATOM 99213 O WAT 2384 81.529 123.440 63.301 1.00 0.00 O ATOM 99214 H1 WAT 2384 81.582 124.241 63.822 1.00 0.00 H ATOM 99215 H2 WAT 2384 80.880 123.637 62.625 1.00 0.00 H TER 99217 WAT 2384 ATOM 99217 O WAT 2385 22.094 83.309 62.564 1.00 0.00 O ATOM 99218 H1 WAT 2385 21.218 82.923 62.554 1.00 0.00 H ATOM 99219 H2 WAT 2385 21.941 84.253 62.509 1.00 0.00 H TER 99221 WAT 2385 ATOM 99221 O WAT 2386 28.826 111.043 152.421 1.00 0.00 O ATOM 99222 H1 WAT 2386 29.525 111.602 152.758 1.00 0.00 H ATOM 99223 H2 WAT 2386 29.250 110.503 151.754 1.00 0.00 H TER 99225 WAT 2386 ATOM 99225 O WAT 2387 66.892 97.928 130.731 1.00 0.00 O ATOM 99226 H1 WAT 2387 66.526 97.081 130.475 1.00 0.00 H ATOM 99227 H2 WAT 2387 67.142 97.813 131.648 1.00 0.00 H TER 99229 WAT 2387 ATOM 99229 O WAT 2388 19.328 77.149 133.121 1.00 0.00 O ATOM 99230 H1 WAT 2388 19.855 76.819 132.394 1.00 0.00 H ATOM 99231 H2 WAT 2388 18.435 76.870 132.916 1.00 0.00 H TER 99233 WAT 2388 ATOM 99233 O WAT 2389 131.540 96.960 27.245 1.00 0.00 O ATOM 99234 H1 WAT 2389 131.323 97.880 27.096 1.00 0.00 H ATOM 99235 H2 WAT 2389 132.495 96.947 27.313 1.00 0.00 H TER 99237 WAT 2389 ATOM 99237 O WAT 2390 44.247 34.564 153.737 1.00 0.00 O ATOM 99238 H1 WAT 2390 43.906 33.718 154.028 1.00 0.00 H ATOM 99239 H2 WAT 2390 44.316 35.082 154.539 1.00 0.00 H TER 99241 WAT 2390 ATOM 99241 O WAT 2391 133.930 103.403 105.479 1.00 0.00 O ATOM 99242 H1 WAT 2391 133.917 103.049 104.590 1.00 0.00 H ATOM 99243 H2 WAT 2391 133.644 104.311 105.380 1.00 0.00 H TER 99245 WAT 2391 ATOM 99245 O WAT 2392 58.878 124.801 108.909 1.00 0.00 O ATOM 99246 H1 WAT 2392 58.687 124.046 108.353 1.00 0.00 H ATOM 99247 H2 WAT 2392 58.018 125.146 109.149 1.00 0.00 H TER 99249 WAT 2392 ATOM 99249 O WAT 2393 98.214 113.457 24.784 1.00 0.00 O ATOM 99250 H1 WAT 2393 98.033 114.179 24.182 1.00 0.00 H ATOM 99251 H2 WAT 2393 97.553 113.545 25.470 1.00 0.00 H TER 99253 WAT 2393 ATOM 99253 O WAT 2394 142.175 11.256 17.956 1.00 0.00 O ATOM 99254 H1 WAT 2394 142.156 11.439 17.017 1.00 0.00 H ATOM 99255 H2 WAT 2394 142.992 11.651 18.260 1.00 0.00 H TER 99257 WAT 2394 ATOM 99257 O WAT 2395 83.220 130.910 71.042 1.00 0.00 O ATOM 99258 H1 WAT 2395 82.695 130.114 70.959 1.00 0.00 H ATOM 99259 H2 WAT 2395 84.014 130.627 71.496 1.00 0.00 H TER 99261 WAT 2395 ATOM 99261 O WAT 2396 15.045 25.692 133.471 1.00 0.00 O ATOM 99262 H1 WAT 2396 14.801 25.351 132.610 1.00 0.00 H ATOM 99263 H2 WAT 2396 14.633 25.091 134.092 1.00 0.00 H TER 99265 WAT 2396 ATOM 99265 O WAT 2397 126.812 133.191 68.007 1.00 0.00 O ATOM 99266 H1 WAT 2397 126.995 134.020 67.565 1.00 0.00 H ATOM 99267 H2 WAT 2397 125.860 133.098 67.956 1.00 0.00 H TER 99269 WAT 2397 ATOM 99269 O WAT 2398 21.903 36.956 71.609 1.00 0.00 O ATOM 99270 H1 WAT 2398 21.658 36.273 70.985 1.00 0.00 H ATOM 99271 H2 WAT 2398 21.115 37.491 71.700 1.00 0.00 H TER 99273 WAT 2398 ATOM 99273 O WAT 2399 122.246 61.096 93.059 1.00 0.00 O ATOM 99274 H1 WAT 2399 122.386 60.155 93.166 1.00 0.00 H ATOM 99275 H2 WAT 2399 121.456 61.161 92.522 1.00 0.00 H TER 99277 WAT 2399 ATOM 99277 O WAT 2400 142.152 55.691 144.413 1.00 0.00 O ATOM 99278 H1 WAT 2400 142.803 55.396 145.050 1.00 0.00 H ATOM 99279 H2 WAT 2400 141.728 54.887 144.113 1.00 0.00 H TER 99281 WAT 2400 ATOM 99281 O WAT 2401 124.684 20.563 108.991 1.00 0.00 O ATOM 99282 H1 WAT 2401 123.946 20.599 109.599 1.00 0.00 H ATOM 99283 H2 WAT 2401 124.848 21.477 108.759 1.00 0.00 H TER 99285 WAT 2401 ATOM 99285 O WAT 2402 18.291 120.404 101.787 1.00 0.00 O ATOM 99286 H1 WAT 2402 17.457 120.825 101.578 1.00 0.00 H ATOM 99287 H2 WAT 2402 18.319 119.632 101.222 1.00 0.00 H TER 99289 WAT 2402 ATOM 99289 O WAT 2403 22.485 145.499 74.096 1.00 0.00 O ATOM 99290 H1 WAT 2403 22.625 145.430 73.151 1.00 0.00 H ATOM 99291 H2 WAT 2403 22.404 146.439 74.258 1.00 0.00 H TER 99293 WAT 2403 ATOM 99293 O WAT 2404 131.907 4.389 67.896 1.00 0.00 O ATOM 99294 H1 WAT 2404 132.152 4.224 66.985 1.00 0.00 H ATOM 99295 H2 WAT 2404 130.955 4.487 67.874 1.00 0.00 H TER 99297 WAT 2404 ATOM 99297 O WAT 2405 54.952 70.857 59.330 1.00 0.00 O ATOM 99298 H1 WAT 2405 55.279 71.578 59.868 1.00 0.00 H ATOM 99299 H2 WAT 2405 54.058 70.713 59.640 1.00 0.00 H TER 99301 WAT 2405 ATOM 99301 O WAT 2406 124.324 69.185 152.368 1.00 0.00 O ATOM 99302 H1 WAT 2406 124.430 68.235 152.411 1.00 0.00 H ATOM 99303 H2 WAT 2406 124.126 69.445 153.268 1.00 0.00 H TER 99305 WAT 2406 ATOM 99305 O WAT 2407 16.967 132.214 77.258 1.00 0.00 O ATOM 99306 H1 WAT 2407 16.569 132.877 76.695 1.00 0.00 H ATOM 99307 H2 WAT 2407 16.362 131.473 77.220 1.00 0.00 H TER 99309 WAT 2407 ATOM 99309 O WAT 2408 104.490 13.653 12.751 1.00 0.00 O ATOM 99310 H1 WAT 2408 103.647 13.817 12.328 1.00 0.00 H ATOM 99311 H2 WAT 2408 104.446 14.146 13.570 1.00 0.00 H TER 99313 WAT 2408 ATOM 99313 O WAT 2409 104.726 26.906 91.084 1.00 0.00 O ATOM 99314 H1 WAT 2409 104.873 27.844 91.208 1.00 0.00 H ATOM 99315 H2 WAT 2409 105.502 26.490 91.458 1.00 0.00 H TER 99317 WAT 2409 ATOM 99317 O WAT 2410 45.829 7.662 1.122 1.00 0.00 O ATOM 99318 H1 WAT 2410 45.130 7.740 1.772 1.00 0.00 H ATOM 99319 H2 WAT 2410 46.207 6.796 1.280 1.00 0.00 H TER 99321 WAT 2410 ATOM 99321 O WAT 2411 104.435 123.706 91.503 1.00 0.00 O ATOM 99322 H1 WAT 2411 103.504 123.565 91.334 1.00 0.00 H ATOM 99323 H2 WAT 2411 104.502 124.636 91.719 1.00 0.00 H TER 99325 WAT 2411 ATOM 99325 O WAT 2412 121.260 143.081 122.623 1.00 0.00 O ATOM 99326 H1 WAT 2412 121.617 142.209 122.457 1.00 0.00 H ATOM 99327 H2 WAT 2412 120.824 143.003 123.472 1.00 0.00 H TER 99329 WAT 2412 ATOM 99329 O WAT 2413 106.486 5.315 107.059 1.00 0.00 O ATOM 99330 H1 WAT 2413 106.816 5.039 106.204 1.00 0.00 H ATOM 99331 H2 WAT 2413 106.950 6.132 107.242 1.00 0.00 H TER 99333 WAT 2413 ATOM 99333 O WAT 2414 60.353 105.899 124.276 1.00 0.00 O ATOM 99334 H1 WAT 2414 59.866 105.505 125.001 1.00 0.00 H ATOM 99335 H2 WAT 2414 61.101 105.317 124.146 1.00 0.00 H TER 99337 WAT 2414 ATOM 99337 O WAT 2415 144.339 1.275 84.195 1.00 0.00 O ATOM 99338 H1 WAT 2415 144.569 0.360 84.357 1.00 0.00 H ATOM 99339 H2 WAT 2415 144.665 1.451 83.313 1.00 0.00 H TER 99341 WAT 2415 ATOM 99341 O WAT 2416 113.542 56.166 106.882 1.00 0.00 O ATOM 99342 H1 WAT 2416 112.678 55.770 106.999 1.00 0.00 H ATOM 99343 H2 WAT 2416 113.773 55.973 105.974 1.00 0.00 H TER 99345 WAT 2416 ATOM 99345 O WAT 2417 29.044 25.833 78.065 1.00 0.00 O ATOM 99346 H1 WAT 2417 28.834 25.924 77.136 1.00 0.00 H ATOM 99347 H2 WAT 2417 29.184 24.894 78.188 1.00 0.00 H TER 99349 WAT 2417 ATOM 99349 O WAT 2418 85.720 44.300 105.249 1.00 0.00 O ATOM 99350 H1 WAT 2418 86.337 43.736 105.716 1.00 0.00 H ATOM 99351 H2 WAT 2418 86.156 44.498 104.420 1.00 0.00 H TER 99353 WAT 2418 ATOM 99353 O WAT 2419 24.415 9.122 81.859 1.00 0.00 O ATOM 99354 H1 WAT 2419 24.593 8.212 82.098 1.00 0.00 H ATOM 99355 H2 WAT 2419 24.317 9.575 82.697 1.00 0.00 H TER 99357 WAT 2419 ATOM 99357 O WAT 2420 15.975 114.267 149.333 1.00 0.00 O ATOM 99358 H1 WAT 2420 15.534 114.654 148.577 1.00 0.00 H ATOM 99359 H2 WAT 2420 15.980 114.962 149.990 1.00 0.00 H TER 99361 WAT 2420 ATOM 99361 O WAT 2421 15.521 56.677 148.921 1.00 0.00 O ATOM 99362 H1 WAT 2421 15.258 56.314 148.075 1.00 0.00 H ATOM 99363 H2 WAT 2421 15.560 55.919 149.505 1.00 0.00 H TER 99365 WAT 2421 ATOM 99365 O WAT 2422 31.014 139.651 104.323 1.00 0.00 O ATOM 99366 H1 WAT 2422 31.332 138.953 103.751 1.00 0.00 H ATOM 99367 H2 WAT 2422 30.974 139.250 105.192 1.00 0.00 H TER 99369 WAT 2422 ATOM 99369 O WAT 2423 94.315 8.089 151.436 1.00 0.00 O ATOM 99370 H1 WAT 2423 93.721 8.792 151.699 1.00 0.00 H ATOM 99371 H2 WAT 2423 95.188 8.479 151.493 1.00 0.00 H TER 99373 WAT 2423 ATOM 99373 O WAT 2424 58.921 66.881 12.617 1.00 0.00 O ATOM 99374 H1 WAT 2424 59.160 67.065 13.525 1.00 0.00 H ATOM 99375 H2 WAT 2424 59.397 66.078 12.402 1.00 0.00 H TER 99377 WAT 2424 ATOM 99377 O WAT 2425 2.230 28.903 88.182 1.00 0.00 O ATOM 99378 H1 WAT 2425 2.898 29.406 87.716 1.00 0.00 H ATOM 99379 H2 WAT 2425 2.708 28.167 88.564 1.00 0.00 H TER 99381 WAT 2425 ATOM 99381 O WAT 2426 89.021 86.662 17.785 1.00 0.00 O ATOM 99382 H1 WAT 2426 88.834 87.595 17.677 1.00 0.00 H ATOM 99383 H2 WAT 2426 89.687 86.473 17.124 1.00 0.00 H TER 99385 WAT 2426 ATOM 99385 O WAT 2427 86.001 121.432 1.285 1.00 0.00 O ATOM 99386 H1 WAT 2427 85.551 122.250 1.075 1.00 0.00 H ATOM 99387 H2 WAT 2427 86.304 121.101 0.439 1.00 0.00 H TER 99389 WAT 2427 ATOM 99389 O WAT 2428 124.614 54.546 2.165 1.00 0.00 O ATOM 99390 H1 WAT 2428 125.152 53.815 1.860 1.00 0.00 H ATOM 99391 H2 WAT 2428 123.795 54.460 1.678 1.00 0.00 H TER 99393 WAT 2428 ATOM 99393 O WAT 2429 54.168 120.689 90.925 1.00 0.00 O ATOM 99394 H1 WAT 2429 54.400 119.876 90.476 1.00 0.00 H ATOM 99395 H2 WAT 2429 53.843 121.262 90.230 1.00 0.00 H TER 99397 WAT 2429 ATOM 99397 O WAT 2430 84.979 9.501 98.140 1.00 0.00 O ATOM 99398 H1 WAT 2430 85.362 8.990 97.427 1.00 0.00 H ATOM 99399 H2 WAT 2430 85.433 10.343 98.101 1.00 0.00 H TER 99401 WAT 2430 ATOM 99401 O WAT 2431 0.823 139.158 82.783 1.00 0.00 O ATOM 99402 H1 WAT 2431 0.919 138.493 83.465 1.00 0.00 H ATOM 99403 H2 WAT 2431 1.406 139.866 83.056 1.00 0.00 H TER 99405 WAT 2431 ATOM 99405 O WAT 2432 50.581 42.647 58.514 1.00 0.00 O ATOM 99406 H1 WAT 2432 51.084 42.360 57.752 1.00 0.00 H ATOM 99407 H2 WAT 2432 50.057 43.381 58.193 1.00 0.00 H TER 99409 WAT 2432 ATOM 99409 O WAT 2433 118.384 84.245 91.063 1.00 0.00 O ATOM 99410 H1 WAT 2433 118.657 84.251 90.146 1.00 0.00 H ATOM 99411 H2 WAT 2433 117.896 85.062 91.173 1.00 0.00 H TER 99413 WAT 2433 ATOM 99413 O WAT 2434 70.387 136.505 115.145 1.00 0.00 O ATOM 99414 H1 WAT 2434 71.169 136.932 115.496 1.00 0.00 H ATOM 99415 H2 WAT 2434 69.678 137.123 115.319 1.00 0.00 H TER 99417 WAT 2434 ATOM 99417 O WAT 2435 34.961 12.077 12.986 1.00 0.00 O ATOM 99418 H1 WAT 2435 34.237 12.383 12.439 1.00 0.00 H ATOM 99419 H2 WAT 2435 34.588 11.357 13.494 1.00 0.00 H TER 99421 WAT 2435 ATOM 99421 O WAT 2436 127.644 133.931 12.637 1.00 0.00 O ATOM 99422 H1 WAT 2436 127.095 133.668 11.899 1.00 0.00 H ATOM 99423 H2 WAT 2436 128.366 134.417 12.237 1.00 0.00 H TER 99425 WAT 2436 ATOM 99425 O WAT 2437 4.326 62.385 110.691 1.00 0.00 O ATOM 99426 H1 WAT 2437 4.711 61.661 110.198 1.00 0.00 H ATOM 99427 H2 WAT 2437 4.487 63.157 110.149 1.00 0.00 H TER 99429 WAT 2437 ATOM 99429 O WAT 2438 63.766 3.637 19.906 1.00 0.00 O ATOM 99430 H1 WAT 2438 64.053 3.402 19.024 1.00 0.00 H ATOM 99431 H2 WAT 2438 63.882 4.586 19.951 1.00 0.00 H TER 99433 WAT 2438 ATOM 99433 O WAT 2439 11.601 67.178 68.136 1.00 0.00 O ATOM 99434 H1 WAT 2439 10.933 67.856 68.036 1.00 0.00 H ATOM 99435 H2 WAT 2439 12.205 67.328 67.408 1.00 0.00 H TER 99437 WAT 2439 ATOM 99437 O WAT 2440 101.967 25.058 63.687 1.00 0.00 O ATOM 99438 H1 WAT 2440 101.404 24.382 63.311 1.00 0.00 H ATOM 99439 H2 WAT 2440 102.569 25.290 62.980 1.00 0.00 H TER 99441 WAT 2440 ATOM 99441 O WAT 2441 77.041 83.463 141.963 1.00 0.00 O ATOM 99442 H1 WAT 2441 76.948 84.406 141.822 1.00 0.00 H ATOM 99443 H2 WAT 2441 77.495 83.390 142.802 1.00 0.00 H TER 99445 WAT 2441 ATOM 99445 O WAT 2442 98.608 23.201 77.458 1.00 0.00 O ATOM 99446 H1 WAT 2442 97.850 22.759 77.841 1.00 0.00 H ATOM 99447 H2 WAT 2442 98.758 22.746 76.630 1.00 0.00 H TER 99449 WAT 2442 ATOM 99449 O WAT 2443 46.022 29.957 152.600 1.00 0.00 O ATOM 99450 H1 WAT 2443 46.361 30.633 153.188 1.00 0.00 H ATOM 99451 H2 WAT 2443 46.724 29.308 152.551 1.00 0.00 H TER 99453 WAT 2443 ATOM 99453 O WAT 2444 69.193 121.476 72.064 1.00 0.00 O ATOM 99454 H1 WAT 2444 68.534 122.084 72.399 1.00 0.00 H ATOM 99455 H2 WAT 2444 69.976 121.662 72.581 1.00 0.00 H TER 99457 WAT 2444 ATOM 99457 O WAT 2445 83.758 53.194 138.224 1.00 0.00 O ATOM 99458 H1 WAT 2445 83.286 53.775 137.628 1.00 0.00 H ATOM 99459 H2 WAT 2445 83.695 52.330 137.817 1.00 0.00 H TER 99461 WAT 2445 ATOM 99461 O WAT 2446 52.649 24.611 59.087 1.00 0.00 O ATOM 99462 H1 WAT 2446 51.748 24.378 59.310 1.00 0.00 H ATOM 99463 H2 WAT 2446 52.578 25.060 58.244 1.00 0.00 H TER 99465 WAT 2446 ATOM 99465 O WAT 2447 128.322 30.344 82.577 1.00 0.00 O ATOM 99466 H1 WAT 2447 128.999 30.608 83.200 1.00 0.00 H ATOM 99467 H2 WAT 2447 128.763 29.731 81.990 1.00 0.00 H TER 99469 WAT 2447 ATOM 99469 O WAT 2448 87.185 14.770 156.476 1.00 0.00 O ATOM 99470 H1 WAT 2448 87.101 14.521 157.396 1.00 0.00 H ATOM 99471 H2 WAT 2448 86.423 15.324 156.307 1.00 0.00 H TER 99473 WAT 2448 ATOM 99473 O WAT 2449 52.162 110.813 7.091 1.00 0.00 O ATOM 99474 H1 WAT 2449 52.009 111.156 7.971 1.00 0.00 H ATOM 99475 H2 WAT 2449 52.601 109.974 7.233 1.00 0.00 H TER 99477 WAT 2449 ATOM 99477 O WAT 2450 55.600 80.858 7.128 1.00 0.00 O ATOM 99478 H1 WAT 2450 56.048 80.282 7.747 1.00 0.00 H ATOM 99479 H2 WAT 2450 55.501 80.329 6.337 1.00 0.00 H TER 99481 WAT 2450 ATOM 99481 O WAT 2451 95.489 8.672 155.226 1.00 0.00 O ATOM 99482 H1 WAT 2451 96.301 8.934 154.791 1.00 0.00 H ATOM 99483 H2 WAT 2451 95.126 9.490 155.566 1.00 0.00 H TER 99485 WAT 2451 ATOM 99485 O WAT 2452 64.451 21.371 94.175 1.00 0.00 O ATOM 99486 H1 WAT 2452 65.289 21.767 93.935 1.00 0.00 H ATOM 99487 H2 WAT 2452 63.932 22.098 94.519 1.00 0.00 H TER 99489 WAT 2452 ATOM 99489 O WAT 2453 7.909 38.534 132.391 1.00 0.00 O ATOM 99490 H1 WAT 2453 8.578 39.078 131.973 1.00 0.00 H ATOM 99491 H2 WAT 2453 7.079 38.919 132.111 1.00 0.00 H TER 99493 WAT 2453 ATOM 99493 O WAT 2454 83.370 69.380 61.710 1.00 0.00 O ATOM 99494 H1 WAT 2454 83.650 68.736 62.360 1.00 0.00 H ATOM 99495 H2 WAT 2454 83.005 68.857 60.996 1.00 0.00 H TER 99497 WAT 2454 ATOM 99497 O WAT 2455 89.918 105.028 76.398 1.00 0.00 O ATOM 99498 H1 WAT 2455 90.327 105.420 75.626 1.00 0.00 H ATOM 99499 H2 WAT 2455 90.267 104.137 76.427 1.00 0.00 H TER 99501 WAT 2455 ATOM 99501 O WAT 2456 36.612 92.511 76.452 1.00 0.00 O ATOM 99502 H1 WAT 2456 36.321 92.983 77.232 1.00 0.00 H ATOM 99503 H2 WAT 2456 37.391 92.034 76.737 1.00 0.00 H TER 99505 WAT 2456 ATOM 99505 O WAT 2457 5.471 93.687 137.496 1.00 0.00 O ATOM 99506 H1 WAT 2457 4.952 93.582 138.294 1.00 0.00 H ATOM 99507 H2 WAT 2457 4.923 93.319 136.803 1.00 0.00 H TER 99509 WAT 2457 ATOM 99509 O WAT 2458 72.073 83.299 80.761 1.00 0.00 O ATOM 99510 H1 WAT 2458 72.752 83.965 80.655 1.00 0.00 H ATOM 99511 H2 WAT 2458 72.038 82.855 79.914 1.00 0.00 H TER 99513 WAT 2458 ATOM 99513 O WAT 2459 72.857 69.469 119.341 1.00 0.00 O ATOM 99514 H1 WAT 2459 72.190 69.898 118.804 1.00 0.00 H ATOM 99515 H2 WAT 2459 73.687 69.710 118.929 1.00 0.00 H TER 99517 WAT 2459 ATOM 99517 O WAT 2460 34.293 120.597 133.167 1.00 0.00 O ATOM 99518 H1 WAT 2460 33.683 119.871 133.301 1.00 0.00 H ATOM 99519 H2 WAT 2460 34.087 121.215 133.869 1.00 0.00 H TER 99521 WAT 2460 ATOM 99521 O WAT 2461 109.285 72.654 149.004 1.00 0.00 O ATOM 99522 H1 WAT 2461 108.845 72.028 149.579 1.00 0.00 H ATOM 99523 H2 WAT 2461 109.507 72.148 148.223 1.00 0.00 H TER 99525 WAT 2461 ATOM 99525 O WAT 2462 102.885 99.885 158.491 1.00 0.00 O ATOM 99526 H1 WAT 2462 103.453 99.872 157.720 1.00 0.00 H ATOM 99527 H2 WAT 2462 102.700 100.812 158.637 1.00 0.00 H TER 99529 WAT 2462 ATOM 99529 O WAT 2463 20.643 3.002 145.235 1.00 0.00 O ATOM 99530 H1 WAT 2463 20.557 2.161 144.786 1.00 0.00 H ATOM 99531 H2 WAT 2463 21.239 2.825 145.964 1.00 0.00 H TER 99533 WAT 2463 ATOM 99533 O WAT 2464 140.601 47.715 107.644 1.00 0.00 O ATOM 99534 H1 WAT 2464 139.751 47.362 107.907 1.00 0.00 H ATOM 99535 H2 WAT 2464 141.044 46.982 107.217 1.00 0.00 H TER 99537 WAT 2464 ATOM 99537 O WAT 2465 57.699 106.970 110.727 1.00 0.00 O ATOM 99538 H1 WAT 2465 57.738 107.197 109.798 1.00 0.00 H ATOM 99539 H2 WAT 2465 58.097 107.717 111.173 1.00 0.00 H TER 99541 WAT 2465 ATOM 99541 O WAT 2466 99.437 42.829 95.534 1.00 0.00 O ATOM 99542 H1 WAT 2466 99.436 43.616 96.078 1.00 0.00 H ATOM 99543 H2 WAT 2466 100.339 42.754 95.222 1.00 0.00 H TER 99545 WAT 2466 ATOM 99545 O WAT 2467 121.240 118.328 15.154 1.00 0.00 O ATOM 99546 H1 WAT 2467 121.632 118.426 14.286 1.00 0.00 H ATOM 99547 H2 WAT 2467 120.444 117.820 15.002 1.00 0.00 H TER 99549 WAT 2467 ATOM 99549 O WAT 2468 4.236 119.830 154.981 1.00 0.00 O ATOM 99550 H1 WAT 2468 4.505 119.765 155.897 1.00 0.00 H ATOM 99551 H2 WAT 2468 4.696 119.113 154.545 1.00 0.00 H TER 99553 WAT 2468 ATOM 99553 O WAT 2469 53.179 79.563 126.962 1.00 0.00 O ATOM 99554 H1 WAT 2469 53.596 80.421 127.042 1.00 0.00 H ATOM 99555 H2 WAT 2469 52.252 79.731 127.133 1.00 0.00 H TER 99557 WAT 2469 ATOM 99557 O WAT 2470 7.146 59.047 104.051 1.00 0.00 O ATOM 99558 H1 WAT 2470 7.964 59.070 103.555 1.00 0.00 H ATOM 99559 H2 WAT 2470 6.519 58.631 103.459 1.00 0.00 H TER 99561 WAT 2470 ATOM 99561 O WAT 2471 129.246 23.657 140.187 1.00 0.00 O ATOM 99562 H1 WAT 2471 128.870 24.274 139.559 1.00 0.00 H ATOM 99563 H2 WAT 2471 130.169 23.905 140.243 1.00 0.00 H TER 99565 WAT 2471 ATOM 99565 O WAT 2472 56.087 122.411 155.260 1.00 0.00 O ATOM 99566 H1 WAT 2472 55.223 122.013 155.156 1.00 0.00 H ATOM 99567 H2 WAT 2472 56.157 122.589 156.198 1.00 0.00 H TER 99569 WAT 2472 ATOM 99569 O WAT 2473 123.128 62.863 13.628 1.00 0.00 O ATOM 99570 H1 WAT 2473 123.853 62.248 13.739 1.00 0.00 H ATOM 99571 H2 WAT 2473 122.607 62.765 14.426 1.00 0.00 H TER 99573 WAT 2473 ATOM 99573 O WAT 2474 110.191 91.379 128.697 1.00 0.00 O ATOM 99574 H1 WAT 2474 109.355 90.913 128.696 1.00 0.00 H ATOM 99575 H2 WAT 2474 110.734 90.896 129.319 1.00 0.00 H TER 99577 WAT 2474 ATOM 99577 O WAT 2475 72.393 115.228 130.055 1.00 0.00 O ATOM 99578 H1 WAT 2475 72.714 114.500 130.587 1.00 0.00 H ATOM 99579 H2 WAT 2475 72.792 116.005 130.447 1.00 0.00 H TER 99581 WAT 2475 ATOM 99581 O WAT 2476 42.771 54.593 104.105 1.00 0.00 O ATOM 99582 H1 WAT 2476 43.052 53.745 104.447 1.00 0.00 H ATOM 99583 H2 WAT 2476 41.870 54.690 104.413 1.00 0.00 H TER 99585 WAT 2476 ATOM 99585 O WAT 2477 26.782 87.070 133.780 1.00 0.00 O ATOM 99586 H1 WAT 2477 27.248 87.611 134.418 1.00 0.00 H ATOM 99587 H2 WAT 2477 27.142 87.335 132.934 1.00 0.00 H TER 99589 WAT 2477 ATOM 99589 O WAT 2478 126.767 49.073 1.500 1.00 0.00 O ATOM 99590 H1 WAT 2478 126.609 49.611 2.276 1.00 0.00 H ATOM 99591 H2 WAT 2478 127.415 48.429 1.783 1.00 0.00 H TER 99593 WAT 2478 ATOM 99593 O WAT 2479 141.652 16.390 0.202 1.00 0.00 O ATOM 99594 H1 WAT 2479 140.906 16.876 0.553 1.00 0.00 H ATOM 99595 H2 WAT 2479 141.291 15.536 -0.037 1.00 0.00 H TER 99597 WAT 2479 ATOM 99597 O WAT 2480 108.164 0.190 109.553 1.00 0.00 O ATOM 99598 H1 WAT 2480 108.927 -0.193 109.985 1.00 0.00 H ATOM 99599 H2 WAT 2480 108.271 1.134 109.670 1.00 0.00 H TER 99601 WAT 2480 ATOM 99601 O WAT 2481 112.123 106.990 110.061 1.00 0.00 O ATOM 99602 H1 WAT 2481 112.446 106.715 110.919 1.00 0.00 H ATOM 99603 H2 WAT 2481 111.905 107.915 110.172 1.00 0.00 H TER 99605 WAT 2481 ATOM 99605 O WAT 2482 95.870 81.230 76.700 1.00 0.00 O ATOM 99606 H1 WAT 2482 95.648 81.363 77.622 1.00 0.00 H ATOM 99607 H2 WAT 2482 96.772 81.540 76.624 1.00 0.00 H TER 99609 WAT 2482 ATOM 99609 O WAT 2483 78.520 60.008 124.610 1.00 0.00 O ATOM 99610 H1 WAT 2483 78.920 59.693 125.421 1.00 0.00 H ATOM 99611 H2 WAT 2483 77.729 60.465 124.895 1.00 0.00 H TER 99613 WAT 2483 ATOM 99613 O WAT 2484 12.167 67.830 121.828 1.00 0.00 O ATOM 99614 H1 WAT 2484 11.631 68.290 121.181 1.00 0.00 H ATOM 99615 H2 WAT 2484 11.612 67.779 122.606 1.00 0.00 H TER 99617 WAT 2484 ATOM 99617 O WAT 2485 134.487 20.751 141.164 1.00 0.00 O ATOM 99618 H1 WAT 2485 135.273 20.361 141.548 1.00 0.00 H ATOM 99619 H2 WAT 2485 134.070 21.213 141.891 1.00 0.00 H TER 99621 WAT 2485 ATOM 99621 O WAT 2486 72.352 45.445 81.257 1.00 0.00 O ATOM 99622 H1 WAT 2486 71.985 45.586 82.130 1.00 0.00 H ATOM 99623 H2 WAT 2486 72.598 46.320 80.957 1.00 0.00 H TER 99625 WAT 2486 ATOM 99625 O WAT 2487 58.211 96.594 145.525 1.00 0.00 O ATOM 99626 H1 WAT 2487 58.343 97.327 144.924 1.00 0.00 H ATOM 99627 H2 WAT 2487 58.770 95.898 145.180 1.00 0.00 H TER 99629 WAT 2487 ATOM 99629 O WAT 2488 7.299 85.019 103.049 1.00 0.00 O ATOM 99630 H1 WAT 2488 7.824 85.802 103.215 1.00 0.00 H ATOM 99631 H2 WAT 2488 6.862 84.842 103.882 1.00 0.00 H TER 99633 WAT 2488 ATOM 99633 O WAT 2489 80.492 32.346 0.582 1.00 0.00 O ATOM 99634 H1 WAT 2489 79.659 32.289 0.114 1.00 0.00 H ATOM 99635 H2 WAT 2489 81.119 32.637 -0.080 1.00 0.00 H TER 99637 WAT 2489 ATOM 99637 O WAT 2490 25.308 115.461 124.460 1.00 0.00 O ATOM 99638 H1 WAT 2490 26.052 114.861 124.519 1.00 0.00 H ATOM 99639 H2 WAT 2490 25.096 115.670 125.369 1.00 0.00 H TER 99641 WAT 2490 ATOM 99641 O WAT 2491 120.584 107.794 10.733 1.00 0.00 O ATOM 99642 H1 WAT 2491 120.803 106.862 10.714 1.00 0.00 H ATOM 99643 H2 WAT 2491 119.834 107.852 11.324 1.00 0.00 H TER 99645 WAT 2491 ATOM 99645 O WAT 2492 104.319 35.836 65.947 1.00 0.00 O ATOM 99646 H1 WAT 2492 105.175 35.696 65.543 1.00 0.00 H ATOM 99647 H2 WAT 2492 104.133 36.763 65.799 1.00 0.00 H TER 99649 WAT 2492 ATOM 99649 O WAT 2493 46.593 103.612 118.819 1.00 0.00 O ATOM 99650 H1 WAT 2493 46.176 102.786 118.576 1.00 0.00 H ATOM 99651 H2 WAT 2493 47.204 103.376 119.517 1.00 0.00 H TER 99653 WAT 2493 ATOM 99653 O WAT 2494 101.539 37.563 119.103 1.00 0.00 O ATOM 99654 H1 WAT 2494 100.656 37.493 119.466 1.00 0.00 H ATOM 99655 H2 WAT 2494 101.987 36.775 119.411 1.00 0.00 H TER 99657 WAT 2494 ATOM 99657 O WAT 2495 77.643 102.066 71.500 1.00 0.00 O ATOM 99658 H1 WAT 2495 77.324 101.704 72.327 1.00 0.00 H ATOM 99659 H2 WAT 2495 77.848 101.299 70.966 1.00 0.00 H TER 99661 WAT 2495 ATOM 99661 O WAT 2496 9.947 36.040 141.203 1.00 0.00 O ATOM 99662 H1 WAT 2496 9.406 36.823 141.308 1.00 0.00 H ATOM 99663 H2 WAT 2496 10.253 36.081 140.297 1.00 0.00 H TER 99665 WAT 2496 ATOM 99665 O WAT 2497 136.669 81.114 76.542 1.00 0.00 O ATOM 99666 H1 WAT 2497 135.937 81.422 76.009 1.00 0.00 H ATOM 99667 H2 WAT 2497 137.446 81.469 76.110 1.00 0.00 H TER 99669 WAT 2497 ATOM 99669 O WAT 2498 100.636 18.089 15.821 1.00 0.00 O ATOM 99670 H1 WAT 2498 101.284 17.844 16.482 1.00 0.00 H ATOM 99671 H2 WAT 2498 100.099 17.304 15.711 1.00 0.00 H TER 99673 WAT 2498 ATOM 99673 O WAT 2499 123.971 60.817 129.000 1.00 0.00 O ATOM 99674 H1 WAT 2499 123.181 61.037 128.505 1.00 0.00 H ATOM 99675 H2 WAT 2499 123.646 60.529 129.853 1.00 0.00 H TER 99677 WAT 2499 ATOM 99677 O WAT 2500 145.300 44.153 83.409 1.00 0.00 O ATOM 99678 H1 WAT 2500 146.023 43.547 83.572 1.00 0.00 H ATOM 99679 H2 WAT 2500 145.241 44.675 84.209 1.00 0.00 H TER 99681 WAT 2500 ATOM 99681 O WAT 2501 136.127 26.221 59.927 1.00 0.00 O ATOM 99682 H1 WAT 2501 136.705 26.673 59.312 1.00 0.00 H ATOM 99683 H2 WAT 2501 135.282 26.659 59.828 1.00 0.00 H TER 99685 WAT 2501 ATOM 99685 O WAT 2502 67.612 100.414 102.529 1.00 0.00 O ATOM 99686 H1 WAT 2502 67.164 100.083 101.750 1.00 0.00 H ATOM 99687 H2 WAT 2502 68.348 100.920 102.185 1.00 0.00 H TER 99689 WAT 2502 ATOM 99689 O WAT 2503 52.333 104.279 118.041 1.00 0.00 O ATOM 99690 H1 WAT 2503 53.183 104.089 117.645 1.00 0.00 H ATOM 99691 H2 WAT 2503 51.733 104.349 117.299 1.00 0.00 H TER 99693 WAT 2503 ATOM 99693 O WAT 2504 17.249 102.990 122.136 1.00 0.00 O ATOM 99694 H1 WAT 2504 17.858 103.569 122.595 1.00 0.00 H ATOM 99695 H2 WAT 2504 17.005 103.475 121.348 1.00 0.00 H TER 99697 WAT 2504 ATOM 99697 O WAT 2505 144.286 9.322 12.521 1.00 0.00 O ATOM 99698 H1 WAT 2505 144.116 8.656 11.854 1.00 0.00 H ATOM 99699 H2 WAT 2505 143.452 9.781 12.618 1.00 0.00 H TER 99701 WAT 2505 ATOM 99701 O WAT 2506 115.640 21.662 139.037 1.00 0.00 O ATOM 99702 H1 WAT 2506 116.252 21.357 138.366 1.00 0.00 H ATOM 99703 H2 WAT 2506 115.624 22.613 138.932 1.00 0.00 H TER 99705 WAT 2506 ATOM 99705 O WAT 2507 14.478 143.930 5.036 1.00 0.00 O ATOM 99706 H1 WAT 2507 13.844 144.494 4.593 1.00 0.00 H ATOM 99707 H2 WAT 2507 15.275 144.458 5.086 1.00 0.00 H TER 99709 WAT 2507 ATOM 99709 O WAT 2508 110.626 146.059 100.433 1.00 0.00 O ATOM 99710 H1 WAT 2508 111.386 145.477 100.420 1.00 0.00 H ATOM 99711 H2 WAT 2508 110.083 145.760 99.703 1.00 0.00 H TER 99713 WAT 2508 ATOM 99713 O WAT 2509 51.380 73.956 120.438 1.00 0.00 O ATOM 99714 H1 WAT 2509 51.536 74.452 121.242 1.00 0.00 H ATOM 99715 H2 WAT 2509 50.706 74.455 119.976 1.00 0.00 H TER 99717 WAT 2509 ATOM 99717 O WAT 2510 64.382 142.355 87.643 1.00 0.00 O ATOM 99718 H1 WAT 2510 64.783 142.271 88.508 1.00 0.00 H ATOM 99719 H2 WAT 2510 65.013 142.864 87.135 1.00 0.00 H TER 99721 WAT 2510 ATOM 99721 O WAT 2511 61.548 130.200 147.014 1.00 0.00 O ATOM 99722 H1 WAT 2511 62.151 130.253 147.755 1.00 0.00 H ATOM 99723 H2 WAT 2511 61.880 129.474 146.486 1.00 0.00 H TER 99725 WAT 2511 ATOM 99725 O WAT 2512 44.384 37.208 60.114 1.00 0.00 O ATOM 99726 H1 WAT 2512 44.817 36.871 59.330 1.00 0.00 H ATOM 99727 H2 WAT 2512 43.459 37.258 59.875 1.00 0.00 H TER 99729 WAT 2512 ATOM 99729 O WAT 2513 49.200 11.903 116.885 1.00 0.00 O ATOM 99730 H1 WAT 2513 48.759 11.186 117.342 1.00 0.00 H ATOM 99731 H2 WAT 2513 49.375 12.551 117.567 1.00 0.00 H TER 99733 WAT 2513 ATOM 99733 O WAT 2514 50.896 31.034 84.181 1.00 0.00 O ATOM 99734 H1 WAT 2514 50.111 30.705 83.744 1.00 0.00 H ATOM 99735 H2 WAT 2514 51.615 30.539 83.788 1.00 0.00 H TER 99737 WAT 2514 ATOM 99737 O WAT 2515 46.477 18.367 123.349 1.00 0.00 O ATOM 99738 H1 WAT 2515 46.421 17.886 122.523 1.00 0.00 H ATOM 99739 H2 WAT 2515 47.367 18.719 123.362 1.00 0.00 H TER 99741 WAT 2515 ATOM 99741 O WAT 2516 10.016 87.896 107.331 1.00 0.00 O ATOM 99742 H1 WAT 2516 10.116 87.972 108.280 1.00 0.00 H ATOM 99743 H2 WAT 2516 9.767 86.983 107.189 1.00 0.00 H TER 99745 WAT 2516 ATOM 99745 O WAT 2517 52.270 38.809 136.036 1.00 0.00 O ATOM 99746 H1 WAT 2517 52.055 38.193 136.736 1.00 0.00 H ATOM 99747 H2 WAT 2517 52.531 39.609 136.493 1.00 0.00 H TER 99749 WAT 2517 ATOM 99749 O WAT 2518 100.511 136.568 137.607 1.00 0.00 O ATOM 99750 H1 WAT 2518 100.293 136.988 136.774 1.00 0.00 H ATOM 99751 H2 WAT 2518 99.731 136.061 137.830 1.00 0.00 H TER 99753 WAT 2518 ATOM 99753 O WAT 2519 93.511 108.893 146.028 1.00 0.00 O ATOM 99754 H1 WAT 2519 94.447 108.787 145.855 1.00 0.00 H ATOM 99755 H2 WAT 2519 93.112 108.093 145.686 1.00 0.00 H TER 99757 WAT 2519 ATOM 99757 O WAT 2520 82.980 84.731 98.653 1.00 0.00 O ATOM 99758 H1 WAT 2520 82.402 85.165 98.026 1.00 0.00 H ATOM 99759 H2 WAT 2520 83.693 84.380 98.120 1.00 0.00 H TER 99761 WAT 2520 ATOM 99761 O WAT 2521 55.149 135.651 16.164 1.00 0.00 O ATOM 99762 H1 WAT 2521 55.442 135.673 15.253 1.00 0.00 H ATOM 99763 H2 WAT 2521 54.416 136.266 16.196 1.00 0.00 H TER 99765 WAT 2521 ATOM 99765 O WAT 2522 6.827 86.901 10.542 1.00 0.00 O ATOM 99766 H1 WAT 2522 7.180 86.031 10.359 1.00 0.00 H ATOM 99767 H2 WAT 2522 5.885 86.762 10.640 1.00 0.00 H TER 99769 WAT 2522 ATOM 99769 O WAT 2523 63.519 43.505 79.567 1.00 0.00 O ATOM 99770 H1 WAT 2523 62.771 44.086 79.710 1.00 0.00 H ATOM 99771 H2 WAT 2523 63.888 43.791 78.732 1.00 0.00 H TER 99773 WAT 2523 ATOM 99773 O WAT 2524 63.361 76.764 0.352 1.00 0.00 O ATOM 99774 H1 WAT 2524 62.675 76.411 0.919 1.00 0.00 H ATOM 99775 H2 WAT 2524 62.899 77.037 -0.441 1.00 0.00 H TER 99777 WAT 2524 ATOM 99777 O WAT 2525 113.855 74.195 158.573 1.00 0.00 O ATOM 99778 H1 WAT 2525 114.806 74.259 158.658 1.00 0.00 H ATOM 99779 H2 WAT 2525 113.641 74.775 157.842 1.00 0.00 H TER 99781 WAT 2525 ATOM 99781 O WAT 2526 132.766 46.366 99.748 1.00 0.00 O ATOM 99782 H1 WAT 2526 131.855 46.236 99.485 1.00 0.00 H ATOM 99783 H2 WAT 2526 133.025 47.181 99.317 1.00 0.00 H TER 99785 WAT 2526 ATOM 99785 O WAT 2527 16.774 116.603 91.035 1.00 0.00 O ATOM 99786 H1 WAT 2527 17.151 116.971 90.235 1.00 0.00 H ATOM 99787 H2 WAT 2527 17.525 116.252 91.513 1.00 0.00 H TER 99789 WAT 2527 ATOM 99789 O WAT 2528 1.122 86.489 105.457 1.00 0.00 O ATOM 99790 H1 WAT 2528 1.610 86.733 104.670 1.00 0.00 H ATOM 99791 H2 WAT 2528 0.205 86.629 105.224 1.00 0.00 H TER 99793 WAT 2528 ATOM 99793 O WAT 2529 94.864 62.273 118.946 1.00 0.00 O ATOM 99794 H1 WAT 2529 95.587 61.650 119.008 1.00 0.00 H ATOM 99795 H2 WAT 2529 95.043 62.917 119.631 1.00 0.00 H TER 99797 WAT 2529 ATOM 99797 O WAT 2530 21.256 126.288 91.529 1.00 0.00 O ATOM 99798 H1 WAT 2530 20.653 125.626 91.192 1.00 0.00 H ATOM 99799 H2 WAT 2530 20.861 126.575 92.352 1.00 0.00 H TER 99801 WAT 2530 ATOM 99801 O WAT 2531 120.005 124.886 21.266 1.00 0.00 O ATOM 99802 H1 WAT 2531 120.347 124.490 20.464 1.00 0.00 H ATOM 99803 H2 WAT 2531 120.073 124.193 21.923 1.00 0.00 H TER 99805 WAT 2531 ATOM 99805 O WAT 2532 50.855 135.051 68.692 1.00 0.00 O ATOM 99806 H1 WAT 2532 50.474 134.272 69.097 1.00 0.00 H ATOM 99807 H2 WAT 2532 51.742 135.097 69.048 1.00 0.00 H TER 99809 WAT 2532 ATOM 99809 O WAT 2533 108.971 25.855 111.002 1.00 0.00 O ATOM 99810 H1 WAT 2533 108.809 24.929 110.824 1.00 0.00 H ATOM 99811 H2 WAT 2533 109.199 25.885 111.931 1.00 0.00 H TER 99813 WAT 2533 ATOM 99813 O WAT 2534 50.661 125.394 73.310 1.00 0.00 O ATOM 99814 H1 WAT 2534 51.232 124.979 72.663 1.00 0.00 H ATOM 99815 H2 WAT 2534 50.486 124.706 73.952 1.00 0.00 H TER 99817 WAT 2534 ATOM 99817 O WAT 2535 14.348 28.146 64.972 1.00 0.00 O ATOM 99818 H1 WAT 2535 14.478 29.065 64.740 1.00 0.00 H ATOM 99819 H2 WAT 2535 15.142 27.905 65.451 1.00 0.00 H TER 99821 WAT 2535 ATOM 99821 O WAT 2536 132.085 100.161 127.584 1.00 0.00 O ATOM 99822 H1 WAT 2536 131.937 101.042 127.929 1.00 0.00 H ATOM 99823 H2 WAT 2536 132.797 100.267 126.953 1.00 0.00 H TER 99825 WAT 2536 ATOM 99825 O WAT 2537 98.280 76.657 90.981 1.00 0.00 O ATOM 99826 H1 WAT 2537 98.661 77.398 90.510 1.00 0.00 H ATOM 99827 H2 WAT 2537 98.346 75.925 90.368 1.00 0.00 H TER 99829 WAT 2537 ATOM 99829 O WAT 2538 93.860 83.224 135.431 1.00 0.00 O ATOM 99830 H1 WAT 2538 93.240 83.702 135.981 1.00 0.00 H ATOM 99831 H2 WAT 2538 93.310 82.701 134.848 1.00 0.00 H TER 99833 WAT 2538 ATOM 99833 O WAT 2539 89.990 110.020 116.850 1.00 0.00 O ATOM 99834 H1 WAT 2539 90.249 109.785 117.741 1.00 0.00 H ATOM 99835 H2 WAT 2539 89.706 110.932 116.917 1.00 0.00 H TER 99837 WAT 2539 ATOM 99837 O WAT 2540 3.803 62.243 117.745 1.00 0.00 O ATOM 99838 H1 WAT 2540 4.048 62.400 116.833 1.00 0.00 H ATOM 99839 H2 WAT 2540 3.095 61.601 117.696 1.00 0.00 H TER 99841 WAT 2540 ATOM 99841 O WAT 2541 137.356 140.017 86.240 1.00 0.00 O ATOM 99842 H1 WAT 2541 138.288 139.933 86.445 1.00 0.00 H ATOM 99843 H2 WAT 2541 137.320 140.698 85.568 1.00 0.00 H TER 99845 WAT 2541 ATOM 99845 O WAT 2542 135.079 45.925 137.743 1.00 0.00 O ATOM 99846 H1 WAT 2542 135.604 45.167 137.485 1.00 0.00 H ATOM 99847 H2 WAT 2542 135.693 46.493 138.209 1.00 0.00 H TER 99849 WAT 2542 ATOM 99849 O WAT 2543 90.755 128.874 5.001 1.00 0.00 O ATOM 99850 H1 WAT 2543 89.839 129.048 4.785 1.00 0.00 H ATOM 99851 H2 WAT 2543 90.767 128.803 5.956 1.00 0.00 H TER 99853 WAT 2543 ATOM 99853 O WAT 2544 44.171 39.920 77.846 1.00 0.00 O ATOM 99854 H1 WAT 2544 44.515 39.592 78.677 1.00 0.00 H ATOM 99855 H2 WAT 2544 43.948 39.132 77.351 1.00 0.00 H TER 99857 WAT 2544 ATOM 99857 O WAT 2545 42.659 2.522 156.193 1.00 0.00 O ATOM 99858 H1 WAT 2545 41.741 2.379 155.964 1.00 0.00 H ATOM 99859 H2 WAT 2545 43.089 2.705 155.358 1.00 0.00 H TER 99861 WAT 2545 ATOM 99861 O WAT 2546 11.756 103.888 89.492 1.00 0.00 O ATOM 99862 H1 WAT 2546 12.347 103.235 89.867 1.00 0.00 H ATOM 99863 H2 WAT 2546 10.967 103.396 89.267 1.00 0.00 H TER 99865 WAT 2546 ATOM 99865 O WAT 2547 143.534 77.780 17.469 1.00 0.00 O ATOM 99866 H1 WAT 2547 144.281 77.290 17.813 1.00 0.00 H ATOM 99867 H2 WAT 2547 143.324 78.411 18.157 1.00 0.00 H TER 99869 WAT 2547 ATOM 99869 O WAT 2548 112.108 130.123 69.752 1.00 0.00 O ATOM 99870 H1 WAT 2548 112.138 130.125 70.709 1.00 0.00 H ATOM 99871 H2 WAT 2548 112.333 129.225 69.507 1.00 0.00 H TER 99873 WAT 2548 ATOM 99873 O WAT 2549 127.740 66.954 15.698 1.00 0.00 O ATOM 99874 H1 WAT 2549 127.753 66.317 14.984 1.00 0.00 H ATOM 99875 H2 WAT 2549 126.810 67.110 15.863 1.00 0.00 H TER 99877 WAT 2549 ATOM 99877 O WAT 2550 13.120 133.789 149.619 1.00 0.00 O ATOM 99878 H1 WAT 2550 13.883 133.260 149.386 1.00 0.00 H ATOM 99879 H2 WAT 2550 12.789 133.390 150.423 1.00 0.00 H TER 99881 WAT 2550 ATOM 99881 O WAT 2551 80.119 43.045 126.724 1.00 0.00 O ATOM 99882 H1 WAT 2551 81.051 42.825 126.713 1.00 0.00 H ATOM 99883 H2 WAT 2551 80.085 43.927 127.093 1.00 0.00 H TER 99885 WAT 2551 ATOM 99885 O WAT 2552 38.818 65.313 23.591 1.00 0.00 O ATOM 99886 H1 WAT 2552 39.312 65.706 24.310 1.00 0.00 H ATOM 99887 H2 WAT 2552 38.895 64.370 23.735 1.00 0.00 H TER 99889 WAT 2552 ATOM 99889 O WAT 2553 98.086 103.248 99.322 1.00 0.00 O ATOM 99890 H1 WAT 2553 98.139 104.198 99.214 1.00 0.00 H ATOM 99891 H2 WAT 2553 98.274 103.101 100.249 1.00 0.00 H TER 99893 WAT 2553 ATOM 99893 O WAT 2554 44.188 56.931 104.240 1.00 0.00 O ATOM 99894 H1 WAT 2554 44.460 57.120 103.342 1.00 0.00 H ATOM 99895 H2 WAT 2554 43.821 56.048 104.199 1.00 0.00 H TER 99897 WAT 2554 ATOM 99897 O WAT 2555 62.637 11.232 74.495 1.00 0.00 O ATOM 99898 H1 WAT 2555 62.169 12.048 74.320 1.00 0.00 H ATOM 99899 H2 WAT 2555 62.170 10.573 73.981 1.00 0.00 H TER 99901 WAT 2555 ATOM 99901 O WAT 2556 4.385 73.031 125.172 1.00 0.00 O ATOM 99902 H1 WAT 2556 3.850 73.659 125.657 1.00 0.00 H ATOM 99903 H2 WAT 2556 4.367 73.347 124.269 1.00 0.00 H TER 99905 WAT 2556 ATOM 99905 O WAT 2557 51.992 58.034 133.721 1.00 0.00 O ATOM 99906 H1 WAT 2557 52.375 58.579 133.034 1.00 0.00 H ATOM 99907 H2 WAT 2557 51.251 57.601 133.297 1.00 0.00 H TER 99909 WAT 2557 ATOM 99909 O WAT 2558 32.164 69.733 89.190 1.00 0.00 O ATOM 99910 H1 WAT 2558 31.487 70.166 88.668 1.00 0.00 H ATOM 99911 H2 WAT 2558 31.688 69.084 89.708 1.00 0.00 H TER 99913 WAT 2558 ATOM 99913 O WAT 2559 20.849 91.120 156.621 1.00 0.00 O ATOM 99914 H1 WAT 2559 20.356 90.921 157.417 1.00 0.00 H ATOM 99915 H2 WAT 2559 20.347 90.707 155.919 1.00 0.00 H TER 99917 WAT 2559 ATOM 99917 O WAT 2560 68.244 103.208 63.911 1.00 0.00 O ATOM 99918 H1 WAT 2560 68.647 103.719 63.208 1.00 0.00 H ATOM 99919 H2 WAT 2560 67.305 103.258 63.735 1.00 0.00 H TER 99921 WAT 2560 ATOM 99921 O WAT 2561 64.517 29.648 133.508 1.00 0.00 O ATOM 99922 H1 WAT 2561 65.027 29.503 134.305 1.00 0.00 H ATOM 99923 H2 WAT 2561 64.265 28.769 133.222 1.00 0.00 H TER 99925 WAT 2561 ATOM 99925 O WAT 2562 19.341 88.790 98.904 1.00 0.00 O ATOM 99926 H1 WAT 2562 19.511 88.059 99.499 1.00 0.00 H ATOM 99927 H2 WAT 2562 19.992 89.450 99.142 1.00 0.00 H TER 99929 WAT 2562 ATOM 99929 O WAT 2563 94.441 2.782 144.012 1.00 0.00 O ATOM 99930 H1 WAT 2563 94.201 1.959 143.586 1.00 0.00 H ATOM 99931 H2 WAT 2563 93.614 3.124 144.352 1.00 0.00 H TER 99933 WAT 2563 ATOM 99933 O WAT 2564 124.784 18.511 90.325 1.00 0.00 O ATOM 99934 H1 WAT 2564 124.164 18.472 89.597 1.00 0.00 H ATOM 99935 H2 WAT 2564 125.130 19.403 90.297 1.00 0.00 H TER 99937 WAT 2564 ATOM 99937 O WAT 2565 104.665 45.148 104.972 1.00 0.00 O ATOM 99938 H1 WAT 2565 104.688 44.227 105.229 1.00 0.00 H ATOM 99939 H2 WAT 2565 104.748 45.133 104.018 1.00 0.00 H TER 99941 WAT 2565 ATOM 99941 O WAT 2566 127.859 119.769 147.327 1.00 0.00 O ATOM 99942 H1 WAT 2566 127.475 119.047 146.829 1.00 0.00 H ATOM 99943 H2 WAT 2566 128.767 119.811 147.027 1.00 0.00 H TER 99945 WAT 2566 ATOM 99945 O WAT 2567 56.323 28.759 4.739 1.00 0.00 O ATOM 99946 H1 WAT 2567 56.423 29.207 3.899 1.00 0.00 H ATOM 99947 H2 WAT 2567 56.756 27.915 4.614 1.00 0.00 H TER 99949 WAT 2567 ATOM 99949 O WAT 2568 100.692 111.317 146.105 1.00 0.00 O ATOM 99950 H1 WAT 2568 100.198 111.011 146.865 1.00 0.00 H ATOM 99951 H2 WAT 2568 100.027 111.669 145.513 1.00 0.00 H TER 99953 WAT 2568 ATOM 99953 O WAT 2569 7.628 145.411 113.759 1.00 0.00 O ATOM 99954 H1 WAT 2569 7.696 146.339 113.980 1.00 0.00 H ATOM 99955 H2 WAT 2569 7.607 144.964 114.606 1.00 0.00 H TER 99957 WAT 2569 ATOM 99957 O WAT 2570 113.100 133.546 116.366 1.00 0.00 O ATOM 99958 H1 WAT 2570 113.517 132.703 116.542 1.00 0.00 H ATOM 99959 H2 WAT 2570 112.238 133.478 116.778 1.00 0.00 H TER 99961 WAT 2570 ATOM 99961 O WAT 2571 6.077 31.305 102.257 1.00 0.00 O ATOM 99962 H1 WAT 2571 6.815 31.914 102.288 1.00 0.00 H ATOM 99963 H2 WAT 2571 5.518 31.641 101.556 1.00 0.00 H TER 99965 WAT 2571 ATOM 99965 O WAT 2572 122.270 108.163 137.659 1.00 0.00 O ATOM 99966 H1 WAT 2572 121.696 108.601 137.030 1.00 0.00 H ATOM 99967 H2 WAT 2572 122.957 107.769 137.122 1.00 0.00 H TER 99969 WAT 2572 ATOM 99969 O WAT 2573 61.934 98.444 0.770 1.00 0.00 O ATOM 99970 H1 WAT 2573 61.296 98.201 1.440 1.00 0.00 H ATOM 99971 H2 WAT 2573 62.169 97.615 0.351 1.00 0.00 H TER 99973 WAT 2573 ATOM 99973 O WAT 2574 9.984 28.629 132.550 1.00 0.00 O ATOM 99974 H1 WAT 2574 9.597 29.229 133.186 1.00 0.00 H ATOM 99975 H2 WAT 2574 10.433 29.199 131.925 1.00 0.00 H TER 99977 WAT 2574 ATOM 99977 O WAT 2575 139.338 85.774 28.307 1.00 0.00 O ATOM 99978 H1 WAT 2575 138.998 86.574 27.907 1.00 0.00 H ATOM 99979 H2 WAT 2575 139.509 86.016 29.217 1.00 0.00 H TER 99981 WAT 2575 ATOM 99981 O WAT 2576 74.779 44.885 72.181 1.00 0.00 O ATOM 99982 H1 WAT 2576 74.959 43.947 72.125 1.00 0.00 H ATOM 99983 H2 WAT 2576 75.561 45.302 71.820 1.00 0.00 H TER 99985 WAT 2576 ATOM 99985 O WAT 2577 11.096 81.263 107.546 1.00 0.00 O ATOM 99986 H1 WAT 2577 10.424 81.501 106.908 1.00 0.00 H ATOM 99987 H2 WAT 2577 11.701 82.004 107.544 1.00 0.00 H TER 99989 WAT 2577 ATOM 99989 O WAT 2578 30.902 40.219 104.617 1.00 0.00 O ATOM 99990 H1 WAT 2578 30.630 39.398 105.029 1.00 0.00 H ATOM 99991 H2 WAT 2578 31.084 40.806 105.351 1.00 0.00 H TER 99993 WAT 2578 ATOM 99993 O WAT 2579 50.697 4.660 3.017 1.00 0.00 O ATOM 99994 H1 WAT 2579 50.245 4.158 2.340 1.00 0.00 H ATOM 99995 H2 WAT 2579 51.597 4.337 2.995 1.00 0.00 H TER 99997 WAT 2579 ATOM 99997 O WAT 2580 71.138 33.124 2.633 1.00 0.00 O ATOM 99998 H1 WAT 2580 71.026 32.439 3.292 1.00 0.00 H ATOM 99999 H2 WAT 2580 70.250 33.312 2.329 1.00 0.00 H TER 1 WAT 2580 ATOM 1 O WAT 2581 8.102 53.281 102.025 1.00 0.00 O ATOM 2 H1 WAT 2581 7.752 53.125 101.148 1.00 0.00 H ATOM 3 H2 WAT 2581 7.613 54.037 102.348 1.00 0.00 H TER 5 WAT 2581 ATOM 5 O WAT 2582 56.806 42.962 6.178 1.00 0.00 O ATOM 6 H1 WAT 2582 55.915 42.647 6.025 1.00 0.00 H ATOM 7 H2 WAT 2582 56.977 42.759 7.097 1.00 0.00 H TER 9 WAT 2582 ATOM 9 O WAT 2583 106.951 14.089 8.284 1.00 0.00 O ATOM 10 H1 WAT 2583 106.487 14.905 8.098 1.00 0.00 H ATOM 11 H2 WAT 2583 107.754 14.367 8.726 1.00 0.00 H TER 13 WAT 2583 ATOM 13 O WAT 2584 64.331 5.506 82.722 1.00 0.00 O ATOM 14 H1 WAT 2584 63.901 4.703 83.015 1.00 0.00 H ATOM 15 H2 WAT 2584 65.139 5.546 83.235 1.00 0.00 H TER 17 WAT 2584 ATOM 17 O WAT 2585 27.615 7.477 74.129 1.00 0.00 O ATOM 18 H1 WAT 2585 27.518 6.725 73.544 1.00 0.00 H ATOM 19 H2 WAT 2585 26.719 7.769 74.295 1.00 0.00 H TER 21 WAT 2585 ATOM 21 O WAT 2586 22.588 46.520 156.190 1.00 0.00 O ATOM 22 H1 WAT 2586 22.898 46.546 155.285 1.00 0.00 H ATOM 23 H2 WAT 2586 22.570 45.588 156.410 1.00 0.00 H TER 25 WAT 2586 ATOM 25 O WAT 2587 97.134 102.380 3.550 1.00 0.00 O ATOM 26 H1 WAT 2587 97.724 102.337 2.797 1.00 0.00 H ATOM 27 H2 WAT 2587 97.686 102.154 4.299 1.00 0.00 H TER 29 WAT 2587 ATOM 29 O WAT 2588 79.158 74.216 152.252 1.00 0.00 O ATOM 30 H1 WAT 2588 78.479 74.142 151.582 1.00 0.00 H ATOM 31 H2 WAT 2588 79.244 75.157 152.403 1.00 0.00 H TER 33 WAT 2588 ATOM 33 O WAT 2589 38.216 124.258 114.999 1.00 0.00 O ATOM 34 H1 WAT 2589 38.111 125.041 114.459 1.00 0.00 H ATOM 35 H2 WAT 2589 37.435 123.735 114.817 1.00 0.00 H TER 37 WAT 2589 ATOM 37 O WAT 2590 120.989 143.253 154.816 1.00 0.00 O ATOM 38 H1 WAT 2590 121.446 143.055 153.999 1.00 0.00 H ATOM 39 H2 WAT 2590 120.702 144.160 154.717 1.00 0.00 H TER 41 WAT 2590 ATOM 41 O WAT 2591 11.481 6.275 79.248 1.00 0.00 O ATOM 42 H1 WAT 2591 11.756 7.047 79.742 1.00 0.00 H ATOM 43 H2 WAT 2591 10.970 6.628 78.519 1.00 0.00 H TER 45 WAT 2591 ATOM 45 O WAT 2592 26.960 119.665 138.202 1.00 0.00 O ATOM 46 H1 WAT 2592 26.219 120.270 138.236 1.00 0.00 H ATOM 47 H2 WAT 2592 27.728 120.232 138.131 1.00 0.00 H TER 49 WAT 2592 ATOM 49 O WAT 2593 56.226 54.311 17.362 1.00 0.00 O ATOM 50 H1 WAT 2593 56.522 53.421 17.551 1.00 0.00 H ATOM 51 H2 WAT 2593 56.433 54.441 16.437 1.00 0.00 H TER 53 WAT 2593 ATOM 53 O WAT 2594 91.980 33.997 122.375 1.00 0.00 O ATOM 54 H1 WAT 2594 92.238 34.685 122.988 1.00 0.00 H ATOM 55 H2 WAT 2594 92.308 34.296 121.527 1.00 0.00 H TER 57 WAT 2594 ATOM 57 O WAT 2595 73.206 5.311 98.245 1.00 0.00 O ATOM 58 H1 WAT 2595 73.640 5.943 97.673 1.00 0.00 H ATOM 59 H2 WAT 2595 73.749 5.288 99.033 1.00 0.00 H TER 61 WAT 2595 ATOM 61 O WAT 2596 24.627 52.870 146.855 1.00 0.00 O ATOM 62 H1 WAT 2596 24.915 53.731 146.552 1.00 0.00 H ATOM 63 H2 WAT 2596 24.924 52.825 147.764 1.00 0.00 H TER 65 WAT 2596 ATOM 65 O WAT 2597 87.066 12.318 95.371 1.00 0.00 O ATOM 66 H1 WAT 2597 87.914 12.273 94.930 1.00 0.00 H ATOM 67 H2 WAT 2597 86.473 11.827 94.801 1.00 0.00 H TER 69 WAT 2597 ATOM 69 O WAT 2598 18.599 52.080 122.072 1.00 0.00 O ATOM 70 H1 WAT 2598 17.946 52.769 121.943 1.00 0.00 H ATOM 71 H2 WAT 2598 19.424 52.478 121.796 1.00 0.00 H TER 73 WAT 2598 ATOM 73 O WAT 2599 12.707 114.499 78.791 1.00 0.00 O ATOM 74 H1 WAT 2599 13.462 113.915 78.853 1.00 0.00 H ATOM 75 H2 WAT 2599 12.922 115.093 78.072 1.00 0.00 H TER 77 WAT 2599 ATOM 77 O WAT 2600 104.910 135.632 94.365 1.00 0.00 O ATOM 78 H1 WAT 2600 105.128 134.762 94.029 1.00 0.00 H ATOM 79 H2 WAT 2600 105.167 136.231 93.665 1.00 0.00 H TER 81 WAT 2600 ATOM 81 O WAT 2601 40.915 61.506 148.700 1.00 0.00 O ATOM 82 H1 WAT 2601 41.837 61.573 148.945 1.00 0.00 H ATOM 83 H2 WAT 2601 40.546 62.362 148.921 1.00 0.00 H TER 85 WAT 2601 ATOM 85 O WAT 2602 54.075 106.917 13.266 1.00 0.00 O ATOM 86 H1 WAT 2602 54.239 107.292 14.131 1.00 0.00 H ATOM 87 H2 WAT 2602 54.856 107.136 12.758 1.00 0.00 H TER 89 WAT 2602 ATOM 89 O WAT 2603 36.073 88.436 157.599 1.00 0.00 O ATOM 90 H1 WAT 2603 35.179 88.753 157.469 1.00 0.00 H ATOM 91 H2 WAT 2603 36.408 88.294 156.713 1.00 0.00 H TER 93 WAT 2603 ATOM 93 O WAT 2604 115.529 3.676 86.849 1.00 0.00 O ATOM 94 H1 WAT 2604 115.983 3.050 86.286 1.00 0.00 H ATOM 95 H2 WAT 2604 116.189 4.338 87.053 1.00 0.00 H TER 97 WAT 2604 ATOM 97 O WAT 2605 131.284 145.050 87.078 1.00 0.00 O ATOM 98 H1 WAT 2605 132.206 144.840 87.222 1.00 0.00 H ATOM 99 H2 WAT 2605 131.061 145.650 87.790 1.00 0.00 H TER 101 WAT 2605 ATOM 101 O WAT 2606 17.538 136.200 141.684 1.00 0.00 O ATOM 102 H1 WAT 2606 17.363 135.660 140.913 1.00 0.00 H ATOM 103 H2 WAT 2606 16.678 136.337 142.081 1.00 0.00 H TER 105 WAT 2606 ATOM 105 O WAT 2607 70.254 48.335 119.389 1.00 0.00 O ATOM 106 H1 WAT 2607 70.202 48.819 120.212 1.00 0.00 H ATOM 107 H2 WAT 2607 71.009 48.712 118.936 1.00 0.00 H TER 109 WAT 2607 ATOM 109 O WAT 2608 30.737 101.015 147.038 1.00 0.00 O ATOM 110 H1 WAT 2608 30.952 101.939 146.908 1.00 0.00 H ATOM 111 H2 WAT 2608 31.577 100.601 147.238 1.00 0.00 H TER 113 WAT 2608 ATOM 113 O WAT 2609 37.851 83.020 84.023 1.00 0.00 O ATOM 114 H1 WAT 2609 37.106 82.493 84.314 1.00 0.00 H ATOM 115 H2 WAT 2609 38.367 83.164 84.816 1.00 0.00 H TER 117 WAT 2609 ATOM 117 O WAT 2610 69.270 80.441 50.446 1.00 0.00 O ATOM 118 H1 WAT 2610 68.831 81.104 50.979 1.00 0.00 H ATOM 119 H2 WAT 2610 69.628 79.821 51.082 1.00 0.00 H TER 121 WAT 2610 ATOM 121 O WAT 2611 70.008 47.560 133.762 1.00 0.00 O ATOM 122 H1 WAT 2611 69.742 46.674 133.516 1.00 0.00 H ATOM 123 H2 WAT 2611 70.909 47.463 134.068 1.00 0.00 H TER 125 WAT 2611 ATOM 125 O WAT 2612 72.038 129.385 5.079 1.00 0.00 O ATOM 126 H1 WAT 2612 71.303 129.420 5.692 1.00 0.00 H ATOM 127 H2 WAT 2612 72.717 129.920 5.489 1.00 0.00 H TER 129 WAT 2612 ATOM 129 O WAT 2613 122.849 75.058 80.042 1.00 0.00 O ATOM 130 H1 WAT 2613 123.637 75.096 79.499 1.00 0.00 H ATOM 131 H2 WAT 2613 123.004 75.701 80.734 1.00 0.00 H TER 133 WAT 2613 ATOM 133 O WAT 2614 41.545 29.427 81.058 1.00 0.00 O ATOM 134 H1 WAT 2614 42.422 29.783 80.917 1.00 0.00 H ATOM 135 H2 WAT 2614 41.344 29.640 81.969 1.00 0.00 H TER 137 WAT 2614 ATOM 137 O WAT 2615 76.980 35.381 103.073 1.00 0.00 O ATOM 138 H1 WAT 2615 77.879 35.382 103.403 1.00 0.00 H ATOM 139 H2 WAT 2615 76.604 36.198 103.401 1.00 0.00 H TER 141 WAT 2615 ATOM 141 O WAT 2616 61.170 59.856 76.160 1.00 0.00 O ATOM 142 H1 WAT 2616 61.089 59.751 77.108 1.00 0.00 H ATOM 143 H2 WAT 2616 61.874 60.494 76.049 1.00 0.00 H TER 145 WAT 2616 ATOM 145 O WAT 2617 25.497 51.553 1.918 1.00 0.00 O ATOM 146 H1 WAT 2617 26.168 52.082 1.486 1.00 0.00 H ATOM 147 H2 WAT 2617 24.668 51.918 1.608 1.00 0.00 H TER 149 WAT 2617 ATOM 149 O WAT 2618 131.736 38.749 109.235 1.00 0.00 O ATOM 150 H1 WAT 2618 131.329 38.230 108.541 1.00 0.00 H ATOM 151 H2 WAT 2618 131.007 39.008 109.799 1.00 0.00 H TER 153 WAT 2618 ATOM 153 O WAT 2619 29.688 41.070 0.162 1.00 0.00 O ATOM 154 H1 WAT 2619 28.769 40.953 -0.082 1.00 0.00 H ATOM 155 H2 WAT 2619 29.693 41.858 0.704 1.00 0.00 H TER 157 WAT 2619 ATOM 157 O WAT 2620 131.885 65.537 120.546 1.00 0.00 O ATOM 158 H1 WAT 2620 132.047 64.624 120.309 1.00 0.00 H ATOM 159 H2 WAT 2620 131.865 66.002 119.710 1.00 0.00 H TER 161 WAT 2620 ATOM 161 O WAT 2621 88.549 20.483 100.853 1.00 0.00 O ATOM 162 H1 WAT 2621 88.731 20.707 101.765 1.00 0.00 H ATOM 163 H2 WAT 2621 89.091 19.713 100.682 1.00 0.00 H TER 165 WAT 2621 ATOM 165 O WAT 2622 144.209 29.452 153.830 1.00 0.00 O ATOM 166 H1 WAT 2622 144.553 28.730 154.357 1.00 0.00 H ATOM 167 H2 WAT 2622 143.318 29.183 153.607 1.00 0.00 H TER 169 WAT 2622 ATOM 169 O WAT 2623 88.583 79.707 20.603 1.00 0.00 O ATOM 170 H1 WAT 2623 88.721 79.154 19.833 1.00 0.00 H ATOM 171 H2 WAT 2623 89.372 79.582 21.131 1.00 0.00 H TER 173 WAT 2623 ATOM 173 O WAT 2624 25.467 12.201 80.900 1.00 0.00 O ATOM 174 H1 WAT 2624 26.306 12.401 80.485 1.00 0.00 H ATOM 175 H2 WAT 2624 25.375 11.252 80.808 1.00 0.00 H TER 177 WAT 2624 ATOM 177 O WAT 2625 85.820 51.836 85.298 1.00 0.00 O ATOM 178 H1 WAT 2625 84.989 51.406 85.098 1.00 0.00 H ATOM 179 H2 WAT 2625 86.320 51.781 84.484 1.00 0.00 H TER 181 WAT 2625 ATOM 181 O WAT 2626 50.059 142.371 4.158 1.00 0.00 O ATOM 182 H1 WAT 2626 50.795 141.767 4.056 1.00 0.00 H ATOM 183 H2 WAT 2626 50.351 142.994 4.823 1.00 0.00 H TER 185 WAT 2626 ATOM 185 O WAT 2627 133.921 81.811 126.602 1.00 0.00 O ATOM 186 H1 WAT 2627 133.267 82.145 125.988 1.00 0.00 H ATOM 187 H2 WAT 2627 134.709 81.691 126.071 1.00 0.00 H TER 189 WAT 2627 ATOM 189 O WAT 2628 70.636 110.997 3.051 1.00 0.00 O ATOM 190 H1 WAT 2628 69.884 111.291 3.565 1.00 0.00 H ATOM 191 H2 WAT 2628 70.286 110.308 2.487 1.00 0.00 H TER 193 WAT 2628 ATOM 193 O WAT 2629 65.016 23.809 86.971 1.00 0.00 O ATOM 194 H1 WAT 2629 64.561 23.531 86.176 1.00 0.00 H ATOM 195 H2 WAT 2629 65.794 23.252 87.009 1.00 0.00 H TER 197 WAT 2629 ATOM 197 O WAT 2630 19.578 10.072 23.522 1.00 0.00 O ATOM 198 H1 WAT 2630 19.642 9.224 23.962 1.00 0.00 H ATOM 199 H2 WAT 2630 19.003 10.591 24.085 1.00 0.00 H TER 201 WAT 2630 ATOM 201 O WAT 2631 89.543 26.715 142.469 1.00 0.00 O ATOM 202 H1 WAT 2631 89.181 27.407 141.916 1.00 0.00 H ATOM 203 H2 WAT 2631 89.650 27.126 143.327 1.00 0.00 H TER 205 WAT 2631 ATOM 205 O WAT 2632 42.277 38.438 143.527 1.00 0.00 O ATOM 206 H1 WAT 2632 42.351 38.197 144.450 1.00 0.00 H ATOM 207 H2 WAT 2632 41.697 37.775 143.152 1.00 0.00 H TER 209 WAT 2632 ATOM 209 O WAT 2633 53.043 121.455 86.272 1.00 0.00 O ATOM 210 H1 WAT 2633 53.052 121.754 87.181 1.00 0.00 H ATOM 211 H2 WAT 2633 52.253 121.847 85.899 1.00 0.00 H TER 213 WAT 2633 ATOM 213 O WAT 2634 139.123 105.968 11.874 1.00 0.00 O ATOM 214 H1 WAT 2634 139.144 106.688 12.505 1.00 0.00 H ATOM 215 H2 WAT 2634 139.806 105.368 12.174 1.00 0.00 H TER 217 WAT 2634 ATOM 217 O WAT 2635 44.736 8.223 104.642 1.00 0.00 O ATOM 218 H1 WAT 2635 44.093 7.514 104.624 1.00 0.00 H ATOM 219 H2 WAT 2635 45.583 7.776 104.647 1.00 0.00 H TER 221 WAT 2635 ATOM 221 O WAT 2636 85.860 132.017 151.400 1.00 0.00 O ATOM 222 H1 WAT 2636 86.405 132.166 152.173 1.00 0.00 H ATOM 223 H2 WAT 2636 84.981 132.280 151.672 1.00 0.00 H TER 225 WAT 2636 ATOM 225 O WAT 2637 96.938 128.542 113.654 1.00 0.00 O ATOM 226 H1 WAT 2637 96.197 129.145 113.710 1.00 0.00 H ATOM 227 H2 WAT 2637 96.962 128.112 114.509 1.00 0.00 H TER 229 WAT 2637 ATOM 229 O WAT 2638 132.440 45.014 15.597 1.00 0.00 O ATOM 230 H1 WAT 2638 132.456 44.834 16.537 1.00 0.00 H ATOM 231 H2 WAT 2638 132.191 45.937 15.534 1.00 0.00 H TER 233 WAT 2638 ATOM 233 O WAT 2639 59.796 95.186 21.463 1.00 0.00 O ATOM 234 H1 WAT 2639 60.581 95.722 21.577 1.00 0.00 H ATOM 235 H2 WAT 2639 59.485 95.025 22.354 1.00 0.00 H TER 237 WAT 2639 ATOM 237 O WAT 2640 99.101 66.062 113.390 1.00 0.00 O ATOM 238 H1 WAT 2640 98.165 65.996 113.203 1.00 0.00 H ATOM 239 H2 WAT 2640 99.438 66.655 112.719 1.00 0.00 H TER 241 WAT 2640 ATOM 241 O WAT 2641 47.268 32.301 135.896 1.00 0.00 O ATOM 242 H1 WAT 2641 46.487 32.782 136.172 1.00 0.00 H ATOM 243 H2 WAT 2641 46.934 31.458 135.590 1.00 0.00 H TER 245 WAT 2641 ATOM 245 O WAT 2642 54.392 114.241 87.187 1.00 0.00 O ATOM 246 H1 WAT 2642 54.552 113.336 87.455 1.00 0.00 H ATOM 247 H2 WAT 2642 53.504 114.428 87.493 1.00 0.00 H TER 249 WAT 2642 ATOM 249 O WAT 2643 1.330 51.693 69.672 1.00 0.00 O ATOM 250 H1 WAT 2643 0.812 52.341 69.196 1.00 0.00 H ATOM 251 H2 WAT 2643 0.910 51.633 70.530 1.00 0.00 H TER 253 WAT 2643 ATOM 253 O WAT 2644 94.939 61.577 76.742 1.00 0.00 O ATOM 254 H1 WAT 2644 95.561 62.289 76.592 1.00 0.00 H ATOM 255 H2 WAT 2644 94.795 61.199 75.875 1.00 0.00 H TER 257 WAT 2644 ATOM 257 O WAT 2645 37.655 127.657 135.344 1.00 0.00 O ATOM 258 H1 WAT 2645 38.385 127.038 135.382 1.00 0.00 H ATOM 259 H2 WAT 2645 38.057 128.484 135.078 1.00 0.00 H TER 261 WAT 2645 ATOM 261 O WAT 2646 89.932 16.578 96.100 1.00 0.00 O ATOM 262 H1 WAT 2646 90.717 16.251 95.663 1.00 0.00 H ATOM 263 H2 WAT 2646 90.259 17.216 96.734 1.00 0.00 H TER 265 WAT 2646 ATOM 265 O WAT 2647 55.280 127.838 110.480 1.00 0.00 O ATOM 266 H1 WAT 2647 56.134 128.262 110.389 1.00 0.00 H ATOM 267 H2 WAT 2647 55.220 127.620 111.410 1.00 0.00 H TER 269 WAT 2647 ATOM 269 O WAT 2648 46.160 8.309 21.447 1.00 0.00 O ATOM 270 H1 WAT 2648 45.923 9.193 21.729 1.00 0.00 H ATOM 271 H2 WAT 2648 46.828 8.444 20.775 1.00 0.00 H TER 273 WAT 2648 ATOM 273 O WAT 2649 138.641 61.612 130.854 1.00 0.00 O ATOM 274 H1 WAT 2649 138.606 60.803 130.344 1.00 0.00 H ATOM 275 H2 WAT 2649 138.351 62.291 130.246 1.00 0.00 H TER 277 WAT 2649 ATOM 277 O WAT 2650 30.436 122.920 140.186 1.00 0.00 O ATOM 278 H1 WAT 2650 30.146 122.209 139.615 1.00 0.00 H ATOM 279 H2 WAT 2650 30.149 122.658 141.061 1.00 0.00 H TER 281 WAT 2650 ATOM 281 O WAT 2651 87.636 61.050 91.275 1.00 0.00 O ATOM 282 H1 WAT 2651 87.118 60.253 91.157 1.00 0.00 H ATOM 283 H2 WAT 2651 87.381 61.611 90.542 1.00 0.00 H TER 285 WAT 2651 ATOM 285 O WAT 2652 82.782 7.145 136.824 1.00 0.00 O ATOM 286 H1 WAT 2652 83.205 7.377 135.998 1.00 0.00 H ATOM 287 H2 WAT 2652 83.439 6.631 137.294 1.00 0.00 H TER 289 WAT 2652 ATOM 289 O WAT 2653 84.546 16.835 72.292 1.00 0.00 O ATOM 290 H1 WAT 2653 84.368 17.569 72.880 1.00 0.00 H ATOM 291 H2 WAT 2653 85.032 17.223 71.565 1.00 0.00 H TER 293 WAT 2653 ATOM 293 O WAT 2654 95.632 109.343 65.592 1.00 0.00 O ATOM 294 H1 WAT 2654 96.354 109.963 65.698 1.00 0.00 H ATOM 295 H2 WAT 2654 95.252 109.562 64.741 1.00 0.00 H TER 297 WAT 2654 ATOM 297 O WAT 2655 99.120 116.736 62.987 1.00 0.00 O ATOM 298 H1 WAT 2655 99.298 117.510 62.453 1.00 0.00 H ATOM 299 H2 WAT 2655 99.490 116.946 63.844 1.00 0.00 H TER 301 WAT 2655 ATOM 301 O WAT 2656 68.226 145.427 121.607 1.00 0.00 O ATOM 302 H1 WAT 2656 67.329 145.736 121.477 1.00 0.00 H ATOM 303 H2 WAT 2656 68.164 144.811 122.337 1.00 0.00 H TER 305 WAT 2656 ATOM 305 O WAT 2657 26.045 21.868 1.314 1.00 0.00 O ATOM 306 H1 WAT 2657 25.861 21.077 0.809 1.00 0.00 H ATOM 307 H2 WAT 2657 26.134 22.557 0.656 1.00 0.00 H TER 309 WAT 2657 ATOM 309 O WAT 2658 96.170 93.288 27.777 1.00 0.00 O ATOM 310 H1 WAT 2658 95.937 92.387 28.001 1.00 0.00 H ATOM 311 H2 WAT 2658 95.335 93.705 27.565 1.00 0.00 H TER 313 WAT 2658 ATOM 313 O WAT 2659 89.156 70.992 131.378 1.00 0.00 O ATOM 314 H1 WAT 2659 89.713 70.336 131.796 1.00 0.00 H ATOM 315 H2 WAT 2659 88.687 70.510 130.696 1.00 0.00 H TER 317 WAT 2659 ATOM 317 O WAT 2660 20.588 85.297 156.853 1.00 0.00 O ATOM 318 H1 WAT 2660 20.734 86.228 156.685 1.00 0.00 H ATOM 319 H2 WAT 2660 21.225 85.073 157.531 1.00 0.00 H TER 321 WAT 2660 ATOM 321 O WAT 2661 66.666 12.734 56.481 1.00 0.00 O ATOM 322 H1 WAT 2661 66.671 13.365 55.761 1.00 0.00 H ATOM 323 H2 WAT 2661 65.911 12.174 56.302 1.00 0.00 H TER 325 WAT 2661 ATOM 325 O WAT 2662 80.620 39.470 80.544 1.00 0.00 O ATOM 326 H1 WAT 2662 81.247 39.185 81.209 1.00 0.00 H ATOM 327 H2 WAT 2662 80.761 38.874 79.809 1.00 0.00 H TER 329 WAT 2662 ATOM 329 O WAT 2663 42.338 88.954 25.848 1.00 0.00 O ATOM 330 H1 WAT 2663 41.390 88.982 25.975 1.00 0.00 H ATOM 331 H2 WAT 2663 42.450 88.848 24.903 1.00 0.00 H TER 333 WAT 2663 ATOM 333 O WAT 2664 125.789 58.448 130.299 1.00 0.00 O ATOM 334 H1 WAT 2664 126.340 58.712 131.035 1.00 0.00 H ATOM 335 H2 WAT 2664 126.148 58.923 129.549 1.00 0.00 H TER 337 WAT 2664 ATOM 337 O WAT 2665 129.598 88.433 25.862 1.00 0.00 O ATOM 338 H1 WAT 2665 129.309 89.241 25.438 1.00 0.00 H ATOM 339 H2 WAT 2665 130.096 88.727 26.624 1.00 0.00 H TER 341 WAT 2665 ATOM 341 O WAT 2666 81.764 90.957 59.888 1.00 0.00 O ATOM 342 H1 WAT 2666 81.122 91.394 60.447 1.00 0.00 H ATOM 343 H2 WAT 2666 81.559 90.026 59.970 1.00 0.00 H TER 345 WAT 2666 ATOM 345 O WAT 2667 51.003 105.509 84.638 1.00 0.00 O ATOM 346 H1 WAT 2667 51.077 106.240 84.024 1.00 0.00 H ATOM 347 H2 WAT 2667 50.446 104.874 84.188 1.00 0.00 H TER 349 WAT 2667 ATOM 349 O WAT 2668 17.721 34.144 109.060 1.00 0.00 O ATOM 350 H1 WAT 2668 18.435 34.574 108.589 1.00 0.00 H ATOM 351 H2 WAT 2668 16.942 34.332 108.537 1.00 0.00 H TER 353 WAT 2668 ATOM 353 O WAT 2669 87.311 61.898 61.484 1.00 0.00 O ATOM 354 H1 WAT 2669 86.552 62.476 61.568 1.00 0.00 H ATOM 355 H2 WAT 2669 88.038 62.485 61.281 1.00 0.00 H TER 357 WAT 2669 ATOM 357 O WAT 2670 63.806 132.617 131.126 1.00 0.00 O ATOM 358 H1 WAT 2670 64.276 133.126 131.788 1.00 0.00 H ATOM 359 H2 WAT 2670 63.478 133.271 130.509 1.00 0.00 H TER 361 WAT 2670 ATOM 361 O WAT 2671 38.822 140.242 88.226 1.00 0.00 O ATOM 362 H1 WAT 2671 38.171 140.900 88.467 1.00 0.00 H ATOM 363 H2 WAT 2671 38.361 139.657 87.625 1.00 0.00 H TER 365 WAT 2671 ATOM 365 O WAT 2672 29.809 64.637 1.599 1.00 0.00 O ATOM 366 H1 WAT 2672 30.348 64.255 2.291 1.00 0.00 H ATOM 367 H2 WAT 2672 29.245 65.264 2.052 1.00 0.00 H TER 369 WAT 2672 ATOM 369 O WAT 2673 128.973 9.338 3.364 1.00 0.00 O ATOM 370 H1 WAT 2673 129.414 10.156 3.133 1.00 0.00 H ATOM 371 H2 WAT 2673 128.880 8.874 2.532 1.00 0.00 H TER 373 WAT 2673 ATOM 373 O WAT 2674 45.599 38.733 89.836 1.00 0.00 O ATOM 374 H1 WAT 2674 45.157 39.534 90.117 1.00 0.00 H ATOM 375 H2 WAT 2674 45.003 38.029 90.090 1.00 0.00 H TER 377 WAT 2674 ATOM 377 O WAT 2675 46.700 50.378 8.511 1.00 0.00 O ATOM 378 H1 WAT 2675 46.089 49.779 8.940 1.00 0.00 H ATOM 379 H2 WAT 2675 46.860 51.062 9.161 1.00 0.00 H TER 381 WAT 2675 ATOM 381 O WAT 2676 77.090 63.389 120.524 1.00 0.00 O ATOM 382 H1 WAT 2676 77.699 64.086 120.766 1.00 0.00 H ATOM 383 H2 WAT 2676 77.077 62.807 121.284 1.00 0.00 H TER 385 WAT 2676 ATOM 385 O WAT 2677 101.976 22.623 59.801 1.00 0.00 O ATOM 386 H1 WAT 2677 102.673 22.363 59.198 1.00 0.00 H ATOM 387 H2 WAT 2677 101.634 23.438 59.433 1.00 0.00 H TER 389 WAT 2677 ATOM 389 O WAT 2678 35.151 47.601 119.333 1.00 0.00 O ATOM 390 H1 WAT 2678 35.028 47.185 120.186 1.00 0.00 H ATOM 391 H2 WAT 2678 36.097 47.582 119.191 1.00 0.00 H TER 393 WAT 2678 ATOM 393 O WAT 2679 145.316 49.905 61.658 1.00 0.00 O ATOM 394 H1 WAT 2679 145.768 50.092 60.836 1.00 0.00 H ATOM 395 H2 WAT 2679 144.558 49.380 61.401 1.00 0.00 H TER 397 WAT 2679 ATOM 397 O WAT 2680 131.806 69.291 114.274 1.00 0.00 O ATOM 398 H1 WAT 2680 131.056 69.661 114.741 1.00 0.00 H ATOM 399 H2 WAT 2680 132.042 69.961 113.631 1.00 0.00 H TER 401 WAT 2680 ATOM 401 O WAT 2681 18.581 73.779 130.426 1.00 0.00 O ATOM 402 H1 WAT 2681 18.727 73.363 129.576 1.00 0.00 H ATOM 403 H2 WAT 2681 19.367 74.305 130.572 1.00 0.00 H TER 405 WAT 2681 ATOM 405 O WAT 2682 34.771 107.623 21.025 1.00 0.00 O ATOM 406 H1 WAT 2682 35.605 107.814 21.455 1.00 0.00 H ATOM 407 H2 WAT 2682 34.404 108.484 20.822 1.00 0.00 H TER 409 WAT 2682 ATOM 409 O WAT 2683 27.047 86.425 141.393 1.00 0.00 O ATOM 410 H1 WAT 2683 26.402 85.785 141.090 1.00 0.00 H ATOM 411 H2 WAT 2683 26.668 86.785 142.195 1.00 0.00 H TER 413 WAT 2683 ATOM 413 O WAT 2684 98.866 141.465 14.299 1.00 0.00 O ATOM 414 H1 WAT 2684 98.416 141.049 15.034 1.00 0.00 H ATOM 415 H2 WAT 2684 99.457 140.789 13.967 1.00 0.00 H TER 417 WAT 2684 ATOM 417 O WAT 2685 93.497 91.816 119.826 1.00 0.00 O ATOM 418 H1 WAT 2685 93.410 90.947 119.435 1.00 0.00 H ATOM 419 H2 WAT 2685 92.598 92.134 119.907 1.00 0.00 H TER 421 WAT 2685 ATOM 421 O WAT 2686 46.380 107.580 149.908 1.00 0.00 O ATOM 422 H1 WAT 2686 47.317 107.625 150.097 1.00 0.00 H ATOM 423 H2 WAT 2686 45.996 108.285 150.430 1.00 0.00 H TER 425 WAT 2686 ATOM 425 O WAT 2687 33.669 65.659 6.284 1.00 0.00 O ATOM 426 H1 WAT 2687 33.411 64.747 6.152 1.00 0.00 H ATOM 427 H2 WAT 2687 33.204 65.926 7.078 1.00 0.00 H TER 429 WAT 2687 ATOM 429 O WAT 2688 94.895 132.936 109.305 1.00 0.00 O ATOM 430 H1 WAT 2688 95.491 132.649 108.613 1.00 0.00 H ATOM 431 H2 WAT 2688 95.413 132.872 110.108 1.00 0.00 H TER 433 WAT 2688 ATOM 433 O WAT 2689 139.852 16.499 86.764 1.00 0.00 O ATOM 434 H1 WAT 2689 140.479 16.127 87.384 1.00 0.00 H ATOM 435 H2 WAT 2689 140.388 16.794 86.028 1.00 0.00 H TER 437 WAT 2689 ATOM 437 O WAT 2690 48.925 55.359 78.415 1.00 0.00 O ATOM 438 H1 WAT 2690 49.017 54.514 77.974 1.00 0.00 H ATOM 439 H2 WAT 2690 48.006 55.595 78.291 1.00 0.00 H TER 441 WAT 2690 ATOM 441 O WAT 2691 73.160 23.018 2.065 1.00 0.00 O ATOM 442 H1 WAT 2691 72.235 22.986 1.820 1.00 0.00 H ATOM 443 H2 WAT 2691 73.220 23.754 2.674 1.00 0.00 H TER 445 WAT 2691 ATOM 445 O WAT 2692 128.284 107.784 69.945 1.00 0.00 O ATOM 446 H1 WAT 2692 127.961 107.876 69.049 1.00 0.00 H ATOM 447 H2 WAT 2692 129.223 107.625 69.847 1.00 0.00 H TER 449 WAT 2692 ATOM 449 O WAT 2693 89.229 87.731 6.474 1.00 0.00 O ATOM 450 H1 WAT 2693 89.671 87.980 7.285 1.00 0.00 H ATOM 451 H2 WAT 2693 88.414 88.232 6.481 1.00 0.00 H TER 453 WAT 2693 ATOM 453 O WAT 2694 48.449 70.258 29.224 1.00 0.00 O ATOM 454 H1 WAT 2694 48.413 69.542 28.589 1.00 0.00 H ATOM 455 H2 WAT 2694 49.298 70.672 29.069 1.00 0.00 H TER 457 WAT 2694 ATOM 457 O WAT 2695 86.562 3.006 95.849 1.00 0.00 O ATOM 458 H1 WAT 2695 86.872 2.373 95.201 1.00 0.00 H ATOM 459 H2 WAT 2695 85.998 2.497 96.431 1.00 0.00 H TER 461 WAT 2695 ATOM 461 O WAT 2696 55.614 122.717 150.322 1.00 0.00 O ATOM 462 H1 WAT 2696 56.225 122.251 150.892 1.00 0.00 H ATOM 463 H2 WAT 2696 54.951 123.067 150.918 1.00 0.00 H TER 465 WAT 2696 ATOM 465 O WAT 2697 102.786 57.696 151.286 1.00 0.00 O ATOM 466 H1 WAT 2697 103.058 57.699 150.368 1.00 0.00 H ATOM 467 H2 WAT 2697 103.323 58.373 151.697 1.00 0.00 H TER 469 WAT 2697 ATOM 469 O WAT 2698 6.020 120.418 96.857 1.00 0.00 O ATOM 470 H1 WAT 2698 5.952 119.493 97.092 1.00 0.00 H ATOM 471 H2 WAT 2698 6.140 120.869 97.693 1.00 0.00 H TER 473 WAT 2698 ATOM 473 O WAT 2699 47.213 73.412 94.229 1.00 0.00 O ATOM 474 H1 WAT 2699 46.359 73.234 93.834 1.00 0.00 H ATOM 475 H2 WAT 2699 47.012 73.663 95.130 1.00 0.00 H TER 477 WAT 2699 ATOM 477 O WAT 2700 78.782 44.111 124.180 1.00 0.00 O ATOM 478 H1 WAT 2700 78.482 43.262 123.853 1.00 0.00 H ATOM 479 H2 WAT 2700 79.091 43.929 125.068 1.00 0.00 H TER 481 WAT 2700 ATOM 481 O WAT 2701 76.442 93.844 0.567 1.00 0.00 O ATOM 482 H1 WAT 2701 76.820 94.641 0.939 1.00 0.00 H ATOM 483 H2 WAT 2701 77.060 93.581 -0.115 1.00 0.00 H TER 485 WAT 2701 ATOM 485 O WAT 2702 10.418 0.655 6.807 1.00 0.00 O ATOM 486 H1 WAT 2702 10.906 1.299 6.294 1.00 0.00 H ATOM 487 H2 WAT 2702 9.539 1.028 6.885 1.00 0.00 H TER 489 WAT 2702 ATOM 489 O WAT 2703 24.964 61.549 67.659 1.00 0.00 O ATOM 490 H1 WAT 2703 25.443 60.827 67.253 1.00 0.00 H ATOM 491 H2 WAT 2703 24.319 61.123 68.222 1.00 0.00 H TER 493 WAT 2703 ATOM 493 O WAT 2704 128.736 62.596 81.803 1.00 0.00 O ATOM 494 H1 WAT 2704 127.849 62.955 81.802 1.00 0.00 H ATOM 495 H2 WAT 2704 128.765 62.028 81.033 1.00 0.00 H TER 497 WAT 2704 ATOM 497 O WAT 2705 106.623 87.227 68.990 1.00 0.00 O ATOM 498 H1 WAT 2705 106.899 86.337 69.211 1.00 0.00 H ATOM 499 H2 WAT 2705 105.697 87.142 68.764 1.00 0.00 H TER 501 WAT 2705 ATOM 501 O WAT 2706 141.808 88.604 131.134 1.00 0.00 O ATOM 502 H1 WAT 2706 141.746 89.387 131.682 1.00 0.00 H ATOM 503 H2 WAT 2706 140.945 88.196 131.203 1.00 0.00 H TER 505 WAT 2706 ATOM 505 O WAT 2707 133.310 118.584 104.290 1.00 0.00 O ATOM 506 H1 WAT 2707 134.037 118.242 104.811 1.00 0.00 H ATOM 507 H2 WAT 2707 133.620 118.535 103.386 1.00 0.00 H TER 509 WAT 2707 ATOM 509 O WAT 2708 118.774 37.114 69.112 1.00 0.00 O ATOM 510 H1 WAT 2708 119.164 36.567 69.794 1.00 0.00 H ATOM 511 H2 WAT 2708 119.165 37.978 69.245 1.00 0.00 H TER 513 WAT 2708 ATOM 513 O WAT 2709 3.985 2.332 88.136 1.00 0.00 O ATOM 514 H1 WAT 2709 4.781 2.091 88.609 1.00 0.00 H ATOM 515 H2 WAT 2709 4.280 2.958 87.474 1.00 0.00 H TER 517 WAT 2709 ATOM 517 O WAT 2710 34.335 97.250 23.231 1.00 0.00 O ATOM 518 H1 WAT 2710 34.298 97.127 24.180 1.00 0.00 H ATOM 519 H2 WAT 2710 34.345 98.200 23.113 1.00 0.00 H TER 521 WAT 2710 ATOM 521 O WAT 2711 25.593 135.788 119.928 1.00 0.00 O ATOM 522 H1 WAT 2711 25.690 136.538 119.341 1.00 0.00 H ATOM 523 H2 WAT 2711 25.320 136.171 120.762 1.00 0.00 H TER 525 WAT 2711 ATOM 525 O WAT 2712 7.081 82.686 89.375 1.00 0.00 O ATOM 526 H1 WAT 2712 7.650 83.392 89.684 1.00 0.00 H ATOM 527 H2 WAT 2712 6.797 82.970 88.506 1.00 0.00 H TER 529 WAT 2712 ATOM 529 O WAT 2713 101.762 145.043 79.877 1.00 0.00 O ATOM 530 H1 WAT 2713 101.104 145.714 80.058 1.00 0.00 H ATOM 531 H2 WAT 2713 101.305 144.399 79.335 1.00 0.00 H TER 533 WAT 2713 ATOM 533 O WAT 2714 88.608 44.872 144.717 1.00 0.00 O ATOM 534 H1 WAT 2714 88.594 43.925 144.575 1.00 0.00 H ATOM 535 H2 WAT 2714 89.324 45.010 145.336 1.00 0.00 H TER 537 WAT 2714 ATOM 537 O WAT 2715 27.586 141.258 80.285 1.00 0.00 O ATOM 538 H1 WAT 2715 26.756 141.592 79.944 1.00 0.00 H ATOM 539 H2 WAT 2715 27.997 140.826 79.537 1.00 0.00 H TER 541 WAT 2715 ATOM 541 O WAT 2716 66.407 39.902 94.259 1.00 0.00 O ATOM 542 H1 WAT 2716 65.584 40.388 94.213 1.00 0.00 H ATOM 543 H2 WAT 2716 66.634 39.728 93.345 1.00 0.00 H TER 545 WAT 2716 ATOM 545 O WAT 2717 83.903 94.923 95.419 1.00 0.00 O ATOM 546 H1 WAT 2717 84.689 94.945 95.965 1.00 0.00 H ATOM 547 H2 WAT 2717 83.810 95.819 95.097 1.00 0.00 H TER 549 WAT 2717 ATOM 549 O WAT 2718 70.588 63.611 75.468 1.00 0.00 O ATOM 550 H1 WAT 2718 70.469 62.854 74.895 1.00 0.00 H ATOM 551 H2 WAT 2718 71.379 64.039 75.140 1.00 0.00 H TER 553 WAT 2718 ATOM 553 O WAT 2719 43.486 134.909 109.386 1.00 0.00 O ATOM 554 H1 WAT 2719 42.911 134.195 109.109 1.00 0.00 H ATOM 555 H2 WAT 2719 43.489 135.515 108.645 1.00 0.00 H TER 557 WAT 2719 ATOM 557 O WAT 2720 45.204 60.495 107.666 1.00 0.00 O ATOM 558 H1 WAT 2720 44.567 59.957 108.135 1.00 0.00 H ATOM 559 H2 WAT 2720 44.846 60.573 106.781 1.00 0.00 H TER 561 WAT 2720 ATOM 561 O WAT 2721 138.089 80.787 8.197 1.00 0.00 O ATOM 562 H1 WAT 2721 138.207 81.526 7.601 1.00 0.00 H ATOM 563 H2 WAT 2721 137.508 81.120 8.881 1.00 0.00 H TER 565 WAT 2721 ATOM 565 O WAT 2722 76.631 18.057 107.405 1.00 0.00 O ATOM 566 H1 WAT 2722 76.109 18.649 107.947 1.00 0.00 H ATOM 567 H2 WAT 2722 77.495 18.054 107.819 1.00 0.00 H TER 569 WAT 2722 ATOM 569 O WAT 2723 114.202 3.424 106.653 1.00 0.00 O ATOM 570 H1 WAT 2723 114.266 4.357 106.858 1.00 0.00 H ATOM 571 H2 WAT 2723 113.290 3.298 106.391 1.00 0.00 H TER 573 WAT 2723 ATOM 573 O WAT 2724 3.368 46.504 103.379 1.00 0.00 O ATOM 574 H1 WAT 2724 3.855 46.939 102.679 1.00 0.00 H ATOM 575 H2 WAT 2724 3.195 47.197 104.016 1.00 0.00 H TER 577 WAT 2724 ATOM 577 O WAT 2725 85.084 123.856 5.418 1.00 0.00 O ATOM 578 H1 WAT 2725 85.347 123.678 6.321 1.00 0.00 H ATOM 579 H2 WAT 2725 84.453 124.573 5.489 1.00 0.00 H TER 581 WAT 2725 ATOM 581 O WAT 2726 46.141 52.448 23.968 1.00 0.00 O ATOM 582 H1 WAT 2726 46.249 52.948 24.777 1.00 0.00 H ATOM 583 H2 WAT 2726 45.504 52.950 23.459 1.00 0.00 H TER 585 WAT 2726 ATOM 585 O WAT 2727 73.366 124.011 137.046 1.00 0.00 O ATOM 586 H1 WAT 2727 74.059 124.562 136.682 1.00 0.00 H ATOM 587 H2 WAT 2727 72.912 124.578 137.670 1.00 0.00 H TER 589 WAT 2727 ATOM 589 O WAT 2728 128.928 10.328 144.643 1.00 0.00 O ATOM 590 H1 WAT 2728 128.723 10.665 143.771 1.00 0.00 H ATOM 591 H2 WAT 2728 129.374 11.053 145.081 1.00 0.00 H TER 593 WAT 2728 ATOM 593 O WAT 2729 54.337 140.151 142.386 1.00 0.00 O ATOM 594 H1 WAT 2729 54.890 140.917 142.230 1.00 0.00 H ATOM 595 H2 WAT 2729 54.938 139.408 142.341 1.00 0.00 H TER 597 WAT 2729 ATOM 597 O WAT 2730 79.566 116.156 1.002 1.00 0.00 O ATOM 598 H1 WAT 2730 78.633 116.250 1.195 1.00 0.00 H ATOM 599 H2 WAT 2730 79.976 116.031 1.858 1.00 0.00 H TER 601 WAT 2730 ATOM 601 O WAT 2731 137.847 68.299 64.585 1.00 0.00 O ATOM 602 H1 WAT 2731 137.462 68.584 63.756 1.00 0.00 H ATOM 603 H2 WAT 2731 137.102 68.230 65.183 1.00 0.00 H TER 605 WAT 2731 ATOM 605 O WAT 2732 85.967 34.831 87.963 1.00 0.00 O ATOM 606 H1 WAT 2732 86.780 34.632 88.428 1.00 0.00 H ATOM 607 H2 WAT 2732 85.790 34.046 87.445 1.00 0.00 H TER 609 WAT 2732 ATOM 609 O WAT 2733 32.678 118.113 0.188 1.00 0.00 O ATOM 610 H1 WAT 2733 33.103 118.005 -0.663 1.00 0.00 H ATOM 611 H2 WAT 2733 33.375 118.421 0.767 1.00 0.00 H TER 613 WAT 2733 ATOM 613 O WAT 2734 92.521 105.171 120.206 1.00 0.00 O ATOM 614 H1 WAT 2734 92.433 104.772 119.341 1.00 0.00 H ATOM 615 H2 WAT 2734 93.089 104.572 120.690 1.00 0.00 H TER 617 WAT 2734 ATOM 617 O WAT 2735 117.386 71.750 67.050 1.00 0.00 O ATOM 618 H1 WAT 2735 117.037 72.639 66.984 1.00 0.00 H ATOM 619 H2 WAT 2735 116.621 71.184 66.944 1.00 0.00 H TER 621 WAT 2735 ATOM 621 O WAT 2736 41.745 102.325 126.118 1.00 0.00 O ATOM 622 H1 WAT 2736 41.339 102.420 126.980 1.00 0.00 H ATOM 623 H2 WAT 2736 42.505 102.907 126.146 1.00 0.00 H TER 625 WAT 2736 ATOM 625 O WAT 2737 144.960 47.833 77.554 1.00 0.00 O ATOM 626 H1 WAT 2737 144.972 48.629 78.086 1.00 0.00 H ATOM 627 H2 WAT 2737 145.502 47.212 78.041 1.00 0.00 H TER 629 WAT 2737 ATOM 629 O WAT 2738 47.538 126.091 98.500 1.00 0.00 O ATOM 630 H1 WAT 2738 47.715 126.827 97.915 1.00 0.00 H ATOM 631 H2 WAT 2738 48.136 125.403 98.208 1.00 0.00 H TER 633 WAT 2738 ATOM 633 O WAT 2739 83.235 84.950 21.478 1.00 0.00 O ATOM 634 H1 WAT 2739 83.307 85.786 21.938 1.00 0.00 H ATOM 635 H2 WAT 2739 82.746 84.387 22.078 1.00 0.00 H TER 637 WAT 2739 ATOM 637 O WAT 2740 17.918 15.907 69.798 1.00 0.00 O ATOM 638 H1 WAT 2740 17.244 15.465 70.314 1.00 0.00 H ATOM 639 H2 WAT 2740 17.584 15.886 68.901 1.00 0.00 H TER 641 WAT 2740 ATOM 641 O WAT 2741 127.561 96.899 154.750 1.00 0.00 O ATOM 642 H1 WAT 2741 126.660 96.930 155.071 1.00 0.00 H ATOM 643 H2 WAT 2741 127.684 95.992 154.468 1.00 0.00 H TER 645 WAT 2741 ATOM 645 O WAT 2742 134.883 78.964 88.946 1.00 0.00 O ATOM 646 H1 WAT 2742 134.039 78.922 89.397 1.00 0.00 H ATOM 647 H2 WAT 2742 134.814 78.312 88.249 1.00 0.00 H TER 649 WAT 2742 ATOM 649 O WAT 2743 60.641 20.747 154.013 1.00 0.00 O ATOM 650 H1 WAT 2743 60.722 21.701 154.030 1.00 0.00 H ATOM 651 H2 WAT 2743 59.778 20.587 153.629 1.00 0.00 H TER 653 WAT 2743 ATOM 653 O WAT 2744 16.350 11.777 133.990 1.00 0.00 O ATOM 654 H1 WAT 2744 15.459 11.969 134.283 1.00 0.00 H ATOM 655 H2 WAT 2744 16.660 12.599 133.610 1.00 0.00 H TER 657 WAT 2744 ATOM 657 O WAT 2745 145.801 19.029 87.648 1.00 0.00 O ATOM 658 H1 WAT 2745 145.908 19.384 88.531 1.00 0.00 H ATOM 659 H2 WAT 2745 144.873 18.800 87.593 1.00 0.00 H TER 661 WAT 2745 ATOM 661 O WAT 2746 41.604 35.388 77.881 1.00 0.00 O ATOM 662 H1 WAT 2746 41.353 36.296 77.711 1.00 0.00 H ATOM 663 H2 WAT 2746 42.553 35.375 77.758 1.00 0.00 H TER 665 WAT 2746 ATOM 665 O WAT 2747 135.425 15.416 83.609 1.00 0.00 O ATOM 666 H1 WAT 2747 135.345 14.741 82.935 1.00 0.00 H ATOM 667 H2 WAT 2747 136.365 15.587 83.667 1.00 0.00 H TER 669 WAT 2747 ATOM 669 O WAT 2748 56.809 31.901 142.772 1.00 0.00 O ATOM 670 H1 WAT 2748 56.273 31.124 142.612 1.00 0.00 H ATOM 671 H2 WAT 2748 57.672 31.672 142.425 1.00 0.00 H TER 673 WAT 2748 ATOM 673 O WAT 2749 14.611 87.716 88.523 1.00 0.00 O ATOM 674 H1 WAT 2749 14.258 87.733 87.634 1.00 0.00 H ATOM 675 H2 WAT 2749 13.868 87.466 89.071 1.00 0.00 H TER 677 WAT 2749 ATOM 677 O WAT 2750 37.109 109.065 29.624 1.00 0.00 O ATOM 678 H1 WAT 2750 37.242 108.206 30.026 1.00 0.00 H ATOM 679 H2 WAT 2750 36.534 109.528 30.233 1.00 0.00 H TER 681 WAT 2750 ATOM 681 O WAT 2751 33.676 118.250 93.943 1.00 0.00 O ATOM 682 H1 WAT 2751 34.405 118.870 93.945 1.00 0.00 H ATOM 683 H2 WAT 2751 34.071 117.416 93.687 1.00 0.00 H TER 685 WAT 2751 ATOM 685 O WAT 2752 50.625 131.337 13.369 1.00 0.00 O ATOM 686 H1 WAT 2752 50.610 130.619 14.002 1.00 0.00 H ATOM 687 H2 WAT 2752 50.317 132.097 13.862 1.00 0.00 H TER 689 WAT 2752 ATOM 689 O WAT 2753 42.423 115.341 22.388 1.00 0.00 O ATOM 690 H1 WAT 2753 42.485 114.600 22.991 1.00 0.00 H ATOM 691 H2 WAT 2753 43.311 115.446 22.045 1.00 0.00 H TER 693 WAT 2753 ATOM 693 O WAT 2754 104.362 109.928 118.395 1.00 0.00 O ATOM 694 H1 WAT 2754 103.813 109.250 118.790 1.00 0.00 H ATOM 695 H2 WAT 2754 104.040 110.002 117.497 1.00 0.00 H TER 697 WAT 2754 ATOM 697 O WAT 2755 103.820 65.198 12.542 1.00 0.00 O ATOM 698 H1 WAT 2755 104.222 66.036 12.312 1.00 0.00 H ATOM 699 H2 WAT 2755 102.972 65.434 12.918 1.00 0.00 H TER 701 WAT 2755 ATOM 701 O WAT 2756 113.491 68.692 9.832 1.00 0.00 O ATOM 702 H1 WAT 2756 114.379 68.806 9.494 1.00 0.00 H ATOM 703 H2 WAT 2756 113.020 68.251 9.125 1.00 0.00 H TER 705 WAT 2756 ATOM 705 O WAT 2757 57.766 72.107 143.118 1.00 0.00 O ATOM 706 H1 WAT 2757 57.478 71.283 143.512 1.00 0.00 H ATOM 707 H2 WAT 2757 56.955 72.576 142.924 1.00 0.00 H TER 709 WAT 2757 ATOM 709 O WAT 2758 98.955 108.300 14.045 1.00 0.00 O ATOM 710 H1 WAT 2758 98.656 108.035 13.175 1.00 0.00 H ATOM 711 H2 WAT 2758 99.804 107.869 14.148 1.00 0.00 H TER 713 WAT 2758 ATOM 713 O WAT 2759 38.018 89.940 74.878 1.00 0.00 O ATOM 714 H1 WAT 2759 37.246 90.316 75.302 1.00 0.00 H ATOM 715 H2 WAT 2759 38.189 90.518 74.135 1.00 0.00 H TER 717 WAT 2759 ATOM 717 O WAT 2760 131.491 6.432 108.253 1.00 0.00 O ATOM 718 H1 WAT 2760 131.781 6.213 109.139 1.00 0.00 H ATOM 719 H2 WAT 2760 131.810 5.710 107.711 1.00 0.00 H TER 721 WAT 2760 ATOM 721 O WAT 2761 55.463 12.174 6.274 1.00 0.00 O ATOM 722 H1 WAT 2761 55.032 11.859 7.068 1.00 0.00 H ATOM 723 H2 WAT 2761 56.192 11.568 6.140 1.00 0.00 H TER 725 WAT 2761 ATOM 725 O WAT 2762 39.279 136.596 15.108 1.00 0.00 O ATOM 726 H1 WAT 2762 39.446 136.881 16.006 1.00 0.00 H ATOM 727 H2 WAT 2762 38.419 136.177 15.145 1.00 0.00 H TER 729 WAT 2762 ATOM 729 O WAT 2763 78.586 33.200 91.101 1.00 0.00 O ATOM 730 H1 WAT 2763 78.554 34.112 91.389 1.00 0.00 H ATOM 731 H2 WAT 2763 78.415 32.692 91.894 1.00 0.00 H TER 733 WAT 2763 ATOM 733 O WAT 2764 65.065 15.410 19.623 1.00 0.00 O ATOM 734 H1 WAT 2764 64.510 16.154 19.392 1.00 0.00 H ATOM 735 H2 WAT 2764 64.603 14.648 19.273 1.00 0.00 H TER 737 WAT 2764 ATOM 737 O WAT 2765 28.081 20.688 137.154 1.00 0.00 O ATOM 738 H1 WAT 2765 27.225 20.908 136.787 1.00 0.00 H ATOM 739 H2 WAT 2765 27.896 20.007 137.801 1.00 0.00 H TER 741 WAT 2765 ATOM 741 O WAT 2766 135.018 99.566 6.402 1.00 0.00 O ATOM 742 H1 WAT 2766 134.653 98.951 7.039 1.00 0.00 H ATOM 743 H2 WAT 2766 135.914 99.717 6.702 1.00 0.00 H TER 745 WAT 2766 ATOM 745 O WAT 2767 41.869 101.903 65.407 1.00 0.00 O ATOM 746 H1 WAT 2767 42.061 101.454 66.230 1.00 0.00 H ATOM 747 H2 WAT 2767 40.996 101.595 65.163 1.00 0.00 H TER 749 WAT 2767 ATOM 749 O WAT 2768 122.301 22.746 82.660 1.00 0.00 O ATOM 750 H1 WAT 2768 122.390 22.076 83.337 1.00 0.00 H ATOM 751 H2 WAT 2768 123.136 23.214 82.675 1.00 0.00 H TER 753 WAT 2768 ATOM 753 O WAT 2769 38.726 41.286 133.637 1.00 0.00 O ATOM 754 H1 WAT 2769 39.570 41.270 133.186 1.00 0.00 H ATOM 755 H2 WAT 2769 38.289 40.482 133.357 1.00 0.00 H TER 757 WAT 2769 ATOM 757 O WAT 2770 8.804 22.805 55.043 1.00 0.00 O ATOM 758 H1 WAT 2770 8.586 21.950 55.413 1.00 0.00 H ATOM 759 H2 WAT 2770 8.570 22.732 54.117 1.00 0.00 H TER 761 WAT 2770 ATOM 761 O WAT 2771 29.164 121.131 64.536 1.00 0.00 O ATOM 762 H1 WAT 2771 28.970 121.915 64.023 1.00 0.00 H ATOM 763 H2 WAT 2771 29.235 120.431 63.886 1.00 0.00 H TER 765 WAT 2771 ATOM 765 O WAT 2772 82.053 98.741 102.003 1.00 0.00 O ATOM 766 H1 WAT 2772 81.790 97.860 102.271 1.00 0.00 H ATOM 767 H2 WAT 2772 81.861 98.773 101.065 1.00 0.00 H TER 769 WAT 2772 ATOM 769 O WAT 2773 12.372 73.310 71.777 1.00 0.00 O ATOM 770 H1 WAT 2773 11.929 72.702 72.369 1.00 0.00 H ATOM 771 H2 WAT 2773 12.731 72.753 71.087 1.00 0.00 H TER 773 WAT 2773 ATOM 773 O WAT 2774 71.592 102.392 153.439 1.00 0.00 O ATOM 774 H1 WAT 2774 72.337 101.803 153.319 1.00 0.00 H ATOM 775 H2 WAT 2774 71.092 102.003 154.157 1.00 0.00 H TER 777 WAT 2774 ATOM 777 O WAT 2775 62.719 5.068 125.828 1.00 0.00 O ATOM 778 H1 WAT 2775 62.778 4.838 126.755 1.00 0.00 H ATOM 779 H2 WAT 2775 63.302 5.821 125.730 1.00 0.00 H TER 781 WAT 2775 ATOM 781 O WAT 2776 54.844 61.225 140.148 1.00 0.00 O ATOM 782 H1 WAT 2776 54.918 62.121 140.476 1.00 0.00 H ATOM 783 H2 WAT 2776 55.457 60.722 140.684 1.00 0.00 H TER 785 WAT 2776 ATOM 785 O WAT 2777 32.829 81.967 7.144 1.00 0.00 O ATOM 786 H1 WAT 2777 32.722 81.239 7.757 1.00 0.00 H ATOM 787 H2 WAT 2777 33.640 81.769 6.676 1.00 0.00 H TER 789 WAT 2777 ATOM 789 O WAT 2778 131.765 42.737 82.689 1.00 0.00 O ATOM 790 H1 WAT 2778 131.056 43.256 82.310 1.00 0.00 H ATOM 791 H2 WAT 2778 131.931 42.051 82.042 1.00 0.00 H TER 793 WAT 2778 ATOM 793 O WAT 2779 14.444 126.933 118.312 1.00 0.00 O ATOM 794 H1 WAT 2779 14.966 126.351 117.760 1.00 0.00 H ATOM 795 H2 WAT 2779 13.922 126.342 118.856 1.00 0.00 H TER 797 WAT 2779 ATOM 797 O WAT 2780 17.822 81.049 11.121 1.00 0.00 O ATOM 798 H1 WAT 2780 18.271 80.468 11.735 1.00 0.00 H ATOM 799 H2 WAT 2780 17.244 80.472 10.623 1.00 0.00 H TER 801 WAT 2780 ATOM 801 O WAT 2781 102.750 81.526 19.009 1.00 0.00 O ATOM 802 H1 WAT 2781 103.605 81.914 18.822 1.00 0.00 H ATOM 803 H2 WAT 2781 102.503 81.889 19.859 1.00 0.00 H TER 805 WAT 2781 ATOM 805 O WAT 2782 78.496 53.337 88.244 1.00 0.00 O ATOM 806 H1 WAT 2782 78.354 54.163 87.781 1.00 0.00 H ATOM 807 H2 WAT 2782 79.252 53.504 88.806 1.00 0.00 H TER 809 WAT 2782 ATOM 809 O WAT 2783 101.040 61.337 95.794 1.00 0.00 O ATOM 810 H1 WAT 2783 100.749 60.427 95.748 1.00 0.00 H ATOM 811 H2 WAT 2783 100.675 61.746 95.009 1.00 0.00 H TER 813 WAT 2783 ATOM 813 O WAT 2784 115.490 145.315 79.935 1.00 0.00 O ATOM 814 H1 WAT 2784 114.794 145.347 79.279 1.00 0.00 H ATOM 815 H2 WAT 2784 116.262 145.656 79.483 1.00 0.00 H TER 817 WAT 2784 ATOM 817 O WAT 2785 84.971 69.989 14.167 1.00 0.00 O ATOM 818 H1 WAT 2785 85.875 70.101 13.872 1.00 0.00 H ATOM 819 H2 WAT 2785 84.893 69.053 14.349 1.00 0.00 H TER 821 WAT 2785 ATOM 821 O WAT 2786 39.910 45.928 20.035 1.00 0.00 O ATOM 822 H1 WAT 2786 39.703 46.747 20.484 1.00 0.00 H ATOM 823 H2 WAT 2786 40.712 46.117 19.548 1.00 0.00 H TER 825 WAT 2786 ATOM 825 O WAT 2787 5.603 74.922 117.520 1.00 0.00 O ATOM 826 H1 WAT 2787 6.245 74.230 117.359 1.00 0.00 H ATOM 827 H2 WAT 2787 5.363 74.816 118.441 1.00 0.00 H TER 829 WAT 2787 ATOM 829 O WAT 2788 42.530 14.438 142.011 1.00 0.00 O ATOM 830 H1 WAT 2788 42.835 15.346 142.015 1.00 0.00 H ATOM 831 H2 WAT 2788 41.577 14.506 141.954 1.00 0.00 H TER 833 WAT 2788 ATOM 833 O WAT 2789 112.441 57.564 104.018 1.00 0.00 O ATOM 834 H1 WAT 2789 111.676 57.655 104.586 1.00 0.00 H ATOM 835 H2 WAT 2789 112.921 58.385 104.130 1.00 0.00 H TER 837 WAT 2789 ATOM 837 O WAT 2790 127.308 81.089 2.549 1.00 0.00 O ATOM 838 H1 WAT 2790 128.072 81.073 3.125 1.00 0.00 H ATOM 839 H2 WAT 2790 126.563 80.953 3.134 1.00 0.00 H TER 841 WAT 2790 ATOM 841 O WAT 2791 99.472 101.812 19.484 1.00 0.00 O ATOM 842 H1 WAT 2791 99.963 102.072 20.264 1.00 0.00 H ATOM 843 H2 WAT 2791 99.357 102.624 18.991 1.00 0.00 H TER 845 WAT 2791 ATOM 845 O WAT 2792 119.660 74.583 9.515 1.00 0.00 O ATOM 846 H1 WAT 2792 119.181 75.411 9.474 1.00 0.00 H ATOM 847 H2 WAT 2792 119.282 74.053 8.813 1.00 0.00 H TER 849 WAT 2792 ATOM 849 O WAT 2793 60.760 143.846 102.168 1.00 0.00 O ATOM 850 H1 WAT 2793 61.350 143.441 102.804 1.00 0.00 H ATOM 851 H2 WAT 2793 60.384 143.109 101.687 1.00 0.00 H TER 853 WAT 2793 ATOM 853 O WAT 2794 86.214 111.828 129.042 1.00 0.00 O ATOM 854 H1 WAT 2794 87.164 111.945 129.034 1.00 0.00 H ATOM 855 H2 WAT 2794 86.065 111.048 128.506 1.00 0.00 H TER 857 WAT 2794 ATOM 857 O WAT 2795 130.853 39.665 10.141 1.00 0.00 O ATOM 858 H1 WAT 2795 130.455 39.702 11.011 1.00 0.00 H ATOM 859 H2 WAT 2795 131.315 40.499 10.053 1.00 0.00 H TER 861 WAT 2795 ATOM 861 O WAT 2796 91.768 4.695 78.056 1.00 0.00 O ATOM 862 H1 WAT 2796 91.070 5.107 77.546 1.00 0.00 H ATOM 863 H2 WAT 2796 91.316 4.285 78.793 1.00 0.00 H TER 865 WAT 2796 ATOM 865 O WAT 2797 14.187 1.284 18.863 1.00 0.00 O ATOM 866 H1 WAT 2797 13.509 1.933 19.052 1.00 0.00 H ATOM 867 H2 WAT 2797 14.747 1.290 19.639 1.00 0.00 H TER 869 WAT 2797 ATOM 869 O WAT 2798 22.667 100.301 137.888 1.00 0.00 O ATOM 870 H1 WAT 2798 22.636 99.747 138.668 1.00 0.00 H ATOM 871 H2 WAT 2798 21.934 99.999 137.351 1.00 0.00 H TER 873 WAT 2798 ATOM 873 O WAT 2799 119.435 53.657 154.104 1.00 0.00 O ATOM 874 H1 WAT 2799 120.377 53.824 154.117 1.00 0.00 H ATOM 875 H2 WAT 2799 119.314 52.921 154.704 1.00 0.00 H TER 877 WAT 2799 ATOM 877 O WAT 2800 29.294 113.016 18.333 1.00 0.00 O ATOM 878 H1 WAT 2800 29.116 113.864 18.740 1.00 0.00 H ATOM 879 H2 WAT 2800 29.306 112.398 19.064 1.00 0.00 H TER 881 WAT 2800 ATOM 881 O WAT 2801 106.561 70.869 0.895 1.00 0.00 O ATOM 882 H1 WAT 2801 107.290 71.301 0.450 1.00 0.00 H ATOM 883 H2 WAT 2801 106.970 70.401 1.623 1.00 0.00 H TER 885 WAT 2801 ATOM 885 O WAT 2802 91.936 126.215 60.845 1.00 0.00 O ATOM 886 H1 WAT 2802 92.141 125.923 59.957 1.00 0.00 H ATOM 887 H2 WAT 2802 92.765 126.557 61.181 1.00 0.00 H TER 889 WAT 2802 ATOM 889 O WAT 2803 60.948 53.041 72.210 1.00 0.00 O ATOM 890 H1 WAT 2803 61.431 52.852 71.405 1.00 0.00 H ATOM 891 H2 WAT 2803 61.362 53.830 72.559 1.00 0.00 H TER 893 WAT 2803 ATOM 893 O WAT 2804 58.885 64.364 71.016 1.00 0.00 O ATOM 894 H1 WAT 2804 58.489 63.526 70.777 1.00 0.00 H ATOM 895 H2 WAT 2804 58.548 64.547 71.893 1.00 0.00 H TER 897 WAT 2804 ATOM 897 O WAT 2805 105.088 93.806 89.150 1.00 0.00 O ATOM 898 H1 WAT 2805 105.216 94.750 89.054 1.00 0.00 H ATOM 899 H2 WAT 2805 104.368 93.600 88.554 1.00 0.00 H TER 901 WAT 2805 ATOM 901 O WAT 2806 1.076 51.845 79.200 1.00 0.00 O ATOM 902 H1 WAT 2806 1.947 51.558 78.927 1.00 0.00 H ATOM 903 H2 WAT 2806 1.222 52.301 80.029 1.00 0.00 H TER 905 WAT 2806 ATOM 905 O WAT 2807 123.972 143.187 99.256 1.00 0.00 O ATOM 906 H1 WAT 2807 123.870 143.933 99.847 1.00 0.00 H ATOM 907 H2 WAT 2807 123.084 142.999 98.952 1.00 0.00 H TER 909 WAT 2807 ATOM 909 O WAT 2808 27.263 59.092 70.717 1.00 0.00 O ATOM 910 H1 WAT 2808 27.526 58.434 71.361 1.00 0.00 H ATOM 911 H2 WAT 2808 27.389 58.662 69.871 1.00 0.00 H TER 913 WAT 2808 ATOM 913 O WAT 2809 97.291 42.719 0.741 1.00 0.00 O ATOM 914 H1 WAT 2809 97.049 41.989 1.311 1.00 0.00 H ATOM 915 H2 WAT 2809 97.802 42.316 0.040 1.00 0.00 H TER 917 WAT 2809 ATOM 917 O WAT 2810 8.834 44.011 106.980 1.00 0.00 O ATOM 918 H1 WAT 2810 7.934 43.801 107.228 1.00 0.00 H ATOM 919 H2 WAT 2810 9.305 44.067 107.812 1.00 0.00 H TER 921 WAT 2810 ATOM 921 O WAT 2811 75.753 62.329 139.823 1.00 0.00 O ATOM 922 H1 WAT 2811 75.467 62.846 140.575 1.00 0.00 H ATOM 923 H2 WAT 2811 76.104 62.973 139.208 1.00 0.00 H TER 925 WAT 2811 ATOM 925 O WAT 2812 69.952 142.653 19.305 1.00 0.00 O ATOM 926 H1 WAT 2812 70.777 142.231 19.063 1.00 0.00 H ATOM 927 H2 WAT 2812 70.078 142.921 20.215 1.00 0.00 H TER 929 WAT 2812 ATOM 929 O WAT 2813 36.450 31.390 142.650 1.00 0.00 O ATOM 930 H1 WAT 2813 35.687 31.010 142.213 1.00 0.00 H ATOM 931 H2 WAT 2813 36.683 32.146 142.111 1.00 0.00 H TER 933 WAT 2813 ATOM 933 O WAT 2814 60.779 29.457 96.898 1.00 0.00 O ATOM 934 H1 WAT 2814 61.677 29.134 96.970 1.00 0.00 H ATOM 935 H2 WAT 2814 60.847 30.233 96.342 1.00 0.00 H TER 937 WAT 2814 ATOM 937 O WAT 2815 24.400 97.285 19.025 1.00 0.00 O ATOM 938 H1 WAT 2815 24.606 98.218 19.074 1.00 0.00 H ATOM 939 H2 WAT 2815 24.025 97.168 18.152 1.00 0.00 H TER 941 WAT 2815 ATOM 941 O WAT 2816 10.017 60.868 20.040 1.00 0.00 O ATOM 942 H1 WAT 2816 9.200 61.207 19.674 1.00 0.00 H ATOM 943 H2 WAT 2816 10.327 60.238 19.390 1.00 0.00 H TER 945 WAT 2816 ATOM 945 O WAT 2817 17.729 17.380 93.935 1.00 0.00 O ATOM 946 H1 WAT 2817 18.673 17.504 93.840 1.00 0.00 H ATOM 947 H2 WAT 2817 17.450 17.010 93.097 1.00 0.00 H TER 949 WAT 2817 ATOM 949 O WAT 2818 35.646 93.415 82.732 1.00 0.00 O ATOM 950 H1 WAT 2818 34.740 93.721 82.688 1.00 0.00 H ATOM 951 H2 WAT 2818 35.576 92.460 82.743 1.00 0.00 H TER 953 WAT 2818 ATOM 953 O WAT 2819 43.283 101.034 62.898 1.00 0.00 O ATOM 954 H1 WAT 2819 43.120 100.120 62.664 1.00 0.00 H ATOM 955 H2 WAT 2819 43.896 101.346 62.233 1.00 0.00 H TER 957 WAT 2819 ATOM 957 O WAT 2820 77.606 32.272 64.631 1.00 0.00 O ATOM 958 H1 WAT 2820 78.163 31.619 64.207 1.00 0.00 H ATOM 959 H2 WAT 2820 78.170 32.677 65.290 1.00 0.00 H TER 961 WAT 2820 ATOM 961 O WAT 2821 25.435 107.760 152.852 1.00 0.00 O ATOM 962 H1 WAT 2821 25.498 108.492 152.238 1.00 0.00 H ATOM 963 H2 WAT 2821 25.745 107.003 152.355 1.00 0.00 H TER 965 WAT 2821 ATOM 965 O WAT 2822 133.284 22.582 67.177 1.00 0.00 O ATOM 966 H1 WAT 2822 134.098 23.048 67.368 1.00 0.00 H ATOM 967 H2 WAT 2822 132.929 23.027 66.407 1.00 0.00 H TER 969 WAT 2822 ATOM 969 O WAT 2823 22.603 29.041 135.352 1.00 0.00 O ATOM 970 H1 WAT 2823 22.503 29.189 134.412 1.00 0.00 H ATOM 971 H2 WAT 2823 23.545 29.109 135.507 1.00 0.00 H TER 973 WAT 2823 ATOM 973 O WAT 2824 110.451 51.593 80.804 1.00 0.00 O ATOM 974 H1 WAT 2824 110.071 50.716 80.751 1.00 0.00 H ATOM 975 H2 WAT 2824 109.887 52.132 80.249 1.00 0.00 H TER 977 WAT 2824 ATOM 977 O WAT 2825 128.793 0.508 77.857 1.00 0.00 O ATOM 978 H1 WAT 2825 129.003 0.808 76.973 1.00 0.00 H ATOM 979 H2 WAT 2825 129.197 -0.358 77.919 1.00 0.00 H TER 981 WAT 2825 ATOM 981 O WAT 2826 58.500 86.648 115.563 1.00 0.00 O ATOM 982 H1 WAT 2826 59.210 87.176 115.927 1.00 0.00 H ATOM 983 H2 WAT 2826 57.712 86.973 115.998 1.00 0.00 H TER 985 WAT 2826 ATOM 985 O WAT 2827 79.401 5.911 73.790 1.00 0.00 O ATOM 986 H1 WAT 2827 79.965 5.364 73.242 1.00 0.00 H ATOM 987 H2 WAT 2827 78.632 6.082 73.247 1.00 0.00 H TER 989 WAT 2827 ATOM 989 O WAT 2828 75.975 140.389 88.471 1.00 0.00 O ATOM 990 H1 WAT 2828 75.623 140.302 89.357 1.00 0.00 H ATOM 991 H2 WAT 2828 76.441 141.225 88.479 1.00 0.00 H TER 993 WAT 2828 ATOM 993 O WAT 2829 139.466 91.395 67.338 1.00 0.00 O ATOM 994 H1 WAT 2829 139.383 91.239 68.279 1.00 0.00 H ATOM 995 H2 WAT 2829 140.021 90.680 67.025 1.00 0.00 H TER 997 WAT 2829 ATOM 997 O WAT 2830 98.100 102.771 145.379 1.00 0.00 O ATOM 998 H1 WAT 2830 97.717 102.606 146.240 1.00 0.00 H ATOM 999 H2 WAT 2830 98.900 102.244 145.368 1.00 0.00 H TER 1001 WAT 2830 ATOM 1001 O WAT 2831 106.485 114.190 28.815 1.00 0.00 O ATOM 1002 H1 WAT 2831 105.804 114.747 28.438 1.00 0.00 H ATOM 1003 H2 WAT 2831 106.203 114.046 29.718 1.00 0.00 H TER 1005 WAT 2831 ATOM 1005 O WAT 2832 40.681 145.000 68.760 1.00 0.00 O ATOM 1006 H1 WAT 2832 40.115 145.377 69.433 1.00 0.00 H ATOM 1007 H2 WAT 2832 40.454 145.477 67.961 1.00 0.00 H TER 1009 WAT 2832 ATOM 1009 O WAT 2833 133.757 85.610 102.628 1.00 0.00 O ATOM 1010 H1 WAT 2833 134.497 85.403 103.199 1.00 0.00 H ATOM 1011 H2 WAT 2833 133.140 84.891 102.764 1.00 0.00 H TER 1013 WAT 2833 ATOM 1013 O WAT 2834 104.581 16.586 101.552 1.00 0.00 O ATOM 1014 H1 WAT 2834 103.844 16.269 101.030 1.00 0.00 H ATOM 1015 H2 WAT 2834 105.134 17.055 100.926 1.00 0.00 H TER 1017 WAT 2834 ATOM 1017 O WAT 2835 36.222 18.180 110.111 1.00 0.00 O ATOM 1018 H1 WAT 2835 36.473 18.089 109.192 1.00 0.00 H ATOM 1019 H2 WAT 2835 36.080 17.282 110.411 1.00 0.00 H TER 1021 WAT 2835 ATOM 1021 O WAT 2836 107.137 124.364 15.713 1.00 0.00 O ATOM 1022 H1 WAT 2836 106.461 124.085 15.095 1.00 0.00 H ATOM 1023 H2 WAT 2836 106.884 123.961 16.543 1.00 0.00 H TER 1025 WAT 2836 ATOM 1025 O WAT 2837 116.824 25.884 135.425 1.00 0.00 O ATOM 1026 H1 WAT 2837 115.992 26.020 135.878 1.00 0.00 H ATOM 1027 H2 WAT 2837 117.147 25.050 135.766 1.00 0.00 H TER 1029 WAT 2837 ATOM 1029 O WAT 2838 138.065 86.075 54.128 1.00 0.00 O ATOM 1030 H1 WAT 2838 137.359 85.454 54.309 1.00 0.00 H ATOM 1031 H2 WAT 2838 138.553 86.129 54.949 1.00 0.00 H TER 1033 WAT 2838 ATOM 1033 O WAT 2839 71.269 8.875 148.848 1.00 0.00 O ATOM 1034 H1 WAT 2839 70.681 8.197 149.181 1.00 0.00 H ATOM 1035 H2 WAT 2839 70.698 9.466 148.357 1.00 0.00 H TER 1037 WAT 2839 ATOM 1037 O WAT 2840 42.998 8.965 122.260 1.00 0.00 O ATOM 1038 H1 WAT 2840 43.264 8.332 122.928 1.00 0.00 H ATOM 1039 H2 WAT 2840 43.813 9.202 121.817 1.00 0.00 H TER 1041 WAT 2840 ATOM 1041 O WAT 2841 128.946 0.425 114.044 1.00 0.00 O ATOM 1042 H1 WAT 2841 128.212 0.245 114.631 1.00 0.00 H ATOM 1043 H2 WAT 2841 129.330 1.235 114.381 1.00 0.00 H TER 1045 WAT 2841 ATOM 1045 O WAT 2842 124.163 106.427 77.197 1.00 0.00 O ATOM 1046 H1 WAT 2842 123.608 106.949 76.618 1.00 0.00 H ATOM 1047 H2 WAT 2842 123.903 105.521 77.026 1.00 0.00 H TER 1049 WAT 2842 ATOM 1049 O WAT 2843 117.890 11.003 92.366 1.00 0.00 O ATOM 1050 H1 WAT 2843 118.764 11.302 92.116 1.00 0.00 H ATOM 1051 H2 WAT 2843 117.920 10.944 93.320 1.00 0.00 H TER 1053 WAT 2843 ATOM 1053 O WAT 2844 55.012 142.360 92.479 1.00 0.00 O ATOM 1054 H1 WAT 2844 54.605 143.124 92.888 1.00 0.00 H ATOM 1055 H2 WAT 2844 54.311 141.710 92.437 1.00 0.00 H TER 1057 WAT 2844 ATOM 1057 O WAT 2845 127.865 104.782 66.495 1.00 0.00 O ATOM 1058 H1 WAT 2845 128.276 105.390 65.881 1.00 0.00 H ATOM 1059 H2 WAT 2845 127.096 104.454 66.029 1.00 0.00 H TER 1061 WAT 2845 ATOM 1061 O WAT 2846 68.854 71.949 20.382 1.00 0.00 O ATOM 1062 H1 WAT 2846 69.679 71.478 20.500 1.00 0.00 H ATOM 1063 H2 WAT 2846 69.028 72.826 20.724 1.00 0.00 H TER 1065 WAT 2846 ATOM 1065 O WAT 2847 81.214 50.379 137.797 1.00 0.00 O ATOM 1066 H1 WAT 2847 80.462 50.767 138.244 1.00 0.00 H ATOM 1067 H2 WAT 2847 81.719 49.962 138.495 1.00 0.00 H TER 1069 WAT 2847 ATOM 1069 O WAT 2848 31.995 60.386 104.996 1.00 0.00 O ATOM 1070 H1 WAT 2848 31.182 60.674 105.410 1.00 0.00 H ATOM 1071 H2 WAT 2848 32.652 61.016 105.295 1.00 0.00 H TER 1073 WAT 2848 ATOM 1073 O WAT 2849 60.552 5.372 124.117 1.00 0.00 O ATOM 1074 H1 WAT 2849 59.937 4.789 124.563 1.00 0.00 H ATOM 1075 H2 WAT 2849 61.368 5.279 124.609 1.00 0.00 H TER 1077 WAT 2849 ATOM 1077 O WAT 2850 84.110 99.801 81.769 1.00 0.00 O ATOM 1078 H1 WAT 2850 83.220 100.023 82.040 1.00 0.00 H ATOM 1079 H2 WAT 2850 83.996 99.121 81.105 1.00 0.00 H TER 1081 WAT 2850 ATOM 1081 O WAT 2851 30.061 51.543 85.517 1.00 0.00 O ATOM 1082 H1 WAT 2851 30.468 51.372 84.668 1.00 0.00 H ATOM 1083 H2 WAT 2851 29.333 50.922 85.562 1.00 0.00 H TER 1085 WAT 2851 ATOM 1085 O WAT 2852 133.120 65.584 65.075 1.00 0.00 O ATOM 1086 H1 WAT 2852 133.178 64.898 64.410 1.00 0.00 H ATOM 1087 H2 WAT 2852 132.454 66.186 64.742 1.00 0.00 H TER 1089 WAT 2852 ATOM 1089 O WAT 2853 36.706 81.687 16.718 1.00 0.00 O ATOM 1090 H1 WAT 2853 36.044 82.027 16.117 1.00 0.00 H ATOM 1091 H2 WAT 2853 37.311 82.418 16.847 1.00 0.00 H TER 1093 WAT 2853 ATOM 1093 O WAT 2854 121.830 85.590 117.627 1.00 0.00 O ATOM 1094 H1 WAT 2854 121.128 84.958 117.782 1.00 0.00 H ATOM 1095 H2 WAT 2854 122.344 85.207 116.916 1.00 0.00 H TER 1097 WAT 2854 ATOM 1097 O WAT 2855 55.330 3.085 152.734 1.00 0.00 O ATOM 1098 H1 WAT 2855 54.697 3.352 153.401 1.00 0.00 H ATOM 1099 H2 WAT 2855 56.092 3.642 152.890 1.00 0.00 H TER 1101 WAT 2855 ATOM 1101 O WAT 2856 79.535 9.252 93.025 1.00 0.00 O ATOM 1102 H1 WAT 2856 80.163 9.137 93.738 1.00 0.00 H ATOM 1103 H2 WAT 2856 78.789 8.704 93.271 1.00 0.00 H TER 1105 WAT 2856 ATOM 1105 O WAT 2857 10.428 22.563 12.460 1.00 0.00 O ATOM 1106 H1 WAT 2857 10.700 22.791 11.571 1.00 0.00 H ATOM 1107 H2 WAT 2857 9.854 21.805 12.348 1.00 0.00 H TER 1109 WAT 2857 ATOM 1109 O WAT 2858 33.926 22.356 81.589 1.00 0.00 O ATOM 1110 H1 WAT 2858 33.878 22.873 80.785 1.00 0.00 H ATOM 1111 H2 WAT 2858 33.311 22.784 82.185 1.00 0.00 H TER 1113 WAT 2858 ATOM 1113 O WAT 2859 117.078 6.873 156.357 1.00 0.00 O ATOM 1114 H1 WAT 2859 116.601 7.322 157.056 1.00 0.00 H ATOM 1115 H2 WAT 2859 116.829 7.340 155.560 1.00 0.00 H TER 1117 WAT 2859 ATOM 1117 O WAT 2860 3.178 50.425 77.705 1.00 0.00 O ATOM 1118 H1 WAT 2860 2.735 50.781 76.935 1.00 0.00 H ATOM 1119 H2 WAT 2860 3.831 49.823 77.349 1.00 0.00 H TER 1121 WAT 2860 ATOM 1121 O WAT 2861 68.438 144.040 137.812 1.00 0.00 O ATOM 1122 H1 WAT 2861 67.938 143.684 137.077 1.00 0.00 H ATOM 1123 H2 WAT 2861 69.346 143.805 137.620 1.00 0.00 H TER 1125 WAT 2861 ATOM 1125 O WAT 2862 32.654 111.332 12.195 1.00 0.00 O ATOM 1126 H1 WAT 2862 32.169 112.156 12.233 1.00 0.00 H ATOM 1127 H2 WAT 2862 32.424 110.881 13.008 1.00 0.00 H TER 1129 WAT 2862 ATOM 1129 O WAT 2863 7.007 11.578 61.254 1.00 0.00 O ATOM 1130 H1 WAT 2863 6.116 11.234 61.312 1.00 0.00 H ATOM 1131 H2 WAT 2863 7.565 10.801 61.276 1.00 0.00 H TER 1133 WAT 2863 ATOM 1133 O WAT 2864 33.814 3.196 153.477 1.00 0.00 O ATOM 1134 H1 WAT 2864 33.779 2.241 153.418 1.00 0.00 H ATOM 1135 H2 WAT 2864 34.748 3.403 153.440 1.00 0.00 H TER 1137 WAT 2864 ATOM 1137 O WAT 2865 91.201 133.057 62.573 1.00 0.00 O ATOM 1138 H1 WAT 2865 92.053 133.037 62.137 1.00 0.00 H ATOM 1139 H2 WAT 2865 90.576 133.229 61.869 1.00 0.00 H TER 1141 WAT 2865 ATOM 1141 O WAT 2866 50.892 59.191 155.808 1.00 0.00 O ATOM 1142 H1 WAT 2866 50.612 59.696 155.045 1.00 0.00 H ATOM 1143 H2 WAT 2866 50.398 59.565 156.537 1.00 0.00 H TER 1145 WAT 2866 ATOM 1145 O WAT 2867 143.643 35.590 65.138 1.00 0.00 O ATOM 1146 H1 WAT 2867 143.604 34.647 65.294 1.00 0.00 H ATOM 1147 H2 WAT 2867 144.429 35.878 65.601 1.00 0.00 H TER 1149 WAT 2867 ATOM 1149 O WAT 2868 19.910 73.792 150.914 1.00 0.00 O ATOM 1150 H1 WAT 2868 19.371 73.009 150.801 1.00 0.00 H ATOM 1151 H2 WAT 2868 19.411 74.341 151.519 1.00 0.00 H TER 1153 WAT 2868 ATOM 1153 O WAT 2869 99.908 33.253 65.429 1.00 0.00 O ATOM 1154 H1 WAT 2869 99.750 32.338 65.194 1.00 0.00 H ATOM 1155 H2 WAT 2869 99.173 33.730 65.043 1.00 0.00 H TER 1157 WAT 2869 ATOM 1157 O WAT 2870 102.973 51.561 106.416 1.00 0.00 O ATOM 1158 H1 WAT 2870 103.369 51.514 107.287 1.00 0.00 H ATOM 1159 H2 WAT 2870 103.710 51.723 105.827 1.00 0.00 H TER 1161 WAT 2870 ATOM 1161 O WAT 2871 15.814 139.754 82.227 1.00 0.00 O ATOM 1162 H1 WAT 2871 16.747 139.544 82.194 1.00 0.00 H ATOM 1163 H2 WAT 2871 15.660 140.018 83.134 1.00 0.00 H TER 1165 WAT 2871 ATOM 1165 O WAT 2872 69.412 133.961 115.153 1.00 0.00 O ATOM 1166 H1 WAT 2872 69.363 133.752 116.085 1.00 0.00 H ATOM 1167 H2 WAT 2872 69.770 134.849 115.125 1.00 0.00 H TER 1169 WAT 2872 ATOM 1169 O WAT 2873 49.275 46.722 153.385 1.00 0.00 O ATOM 1170 H1 WAT 2873 50.192 46.674 153.113 1.00 0.00 H ATOM 1171 H2 WAT 2873 48.781 46.714 152.566 1.00 0.00 H TER 1173 WAT 2873 ATOM 1173 O WAT 2874 72.203 35.692 101.250 1.00 0.00 O ATOM 1174 H1 WAT 2874 71.491 35.054 101.190 1.00 0.00 H ATOM 1175 H2 WAT 2874 72.701 35.423 102.022 1.00 0.00 H TER 1177 WAT 2874 ATOM 1177 O WAT 2875 12.076 89.254 111.079 1.00 0.00 O ATOM 1178 H1 WAT 2875 12.448 88.705 111.769 1.00 0.00 H ATOM 1179 H2 WAT 2875 11.269 88.807 110.825 1.00 0.00 H TER 1181 WAT 2875 ATOM 1181 O WAT 2876 33.579 17.000 18.300 1.00 0.00 O ATOM 1182 H1 WAT 2876 33.786 17.860 17.935 1.00 0.00 H ATOM 1183 H2 WAT 2876 33.510 17.151 19.243 1.00 0.00 H TER 1185 WAT 2876 ATOM 1185 O WAT 2877 113.985 1.638 137.273 1.00 0.00 O ATOM 1186 H1 WAT 2877 113.624 2.499 137.060 1.00 0.00 H ATOM 1187 H2 WAT 2877 113.553 1.394 138.091 1.00 0.00 H TER 1189 WAT 2877 ATOM 1189 O WAT 2878 28.944 43.625 143.645 1.00 0.00 O ATOM 1190 H1 WAT 2878 28.463 42.798 143.677 1.00 0.00 H ATOM 1191 H2 WAT 2878 28.554 44.156 144.340 1.00 0.00 H TER 1193 WAT 2878 ATOM 1193 O WAT 2879 118.001 80.151 134.900 1.00 0.00 O ATOM 1194 H1 WAT 2879 117.125 79.889 135.183 1.00 0.00 H ATOM 1195 H2 WAT 2879 117.861 80.585 134.058 1.00 0.00 H TER 1197 WAT 2879 ATOM 1197 O WAT 2880 104.568 19.126 60.928 1.00 0.00 O ATOM 1198 H1 WAT 2880 104.600 19.055 59.973 1.00 0.00 H ATOM 1199 H2 WAT 2880 105.437 19.442 61.174 1.00 0.00 H TER 1201 WAT 2880 ATOM 1201 O WAT 2881 110.643 136.580 101.884 1.00 0.00 O ATOM 1202 H1 WAT 2881 109.690 136.653 101.826 1.00 0.00 H ATOM 1203 H2 WAT 2881 110.846 135.749 101.456 1.00 0.00 H TER 1205 WAT 2881 ATOM 1205 O WAT 2882 141.485 127.639 13.668 1.00 0.00 O ATOM 1206 H1 WAT 2882 141.739 126.725 13.795 1.00 0.00 H ATOM 1207 H2 WAT 2882 142.285 128.136 13.842 1.00 0.00 H TER 1209 WAT 2882 ATOM 1209 O WAT 2883 23.414 20.256 71.111 1.00 0.00 O ATOM 1210 H1 WAT 2883 23.739 20.047 70.235 1.00 0.00 H ATOM 1211 H2 WAT 2883 22.500 20.504 70.974 1.00 0.00 H TER 1213 WAT 2883 ATOM 1213 O WAT 2884 41.256 10.741 86.612 1.00 0.00 O ATOM 1214 H1 WAT 2884 40.946 9.944 86.182 1.00 0.00 H ATOM 1215 H2 WAT 2884 41.075 10.598 87.541 1.00 0.00 H TER 1217 WAT 2884 ATOM 1217 O WAT 2885 68.486 55.454 92.501 1.00 0.00 O ATOM 1218 H1 WAT 2885 69.331 55.008 92.554 1.00 0.00 H ATOM 1219 H2 WAT 2885 68.417 55.731 91.587 1.00 0.00 H TER 1221 WAT 2885 ATOM 1221 O WAT 2886 45.969 42.543 120.869 1.00 0.00 O ATOM 1222 H1 WAT 2886 46.624 42.672 120.183 1.00 0.00 H ATOM 1223 H2 WAT 2886 45.514 41.740 120.616 1.00 0.00 H TER 1225 WAT 2886 ATOM 1225 O WAT 2887 90.361 98.594 12.815 1.00 0.00 O ATOM 1226 H1 WAT 2887 89.711 98.381 13.485 1.00 0.00 H ATOM 1227 H2 WAT 2887 89.849 98.956 12.091 1.00 0.00 H TER 1229 WAT 2887 ATOM 1229 O WAT 2888 68.041 28.693 119.953 1.00 0.00 O ATOM 1230 H1 WAT 2888 67.311 28.500 120.542 1.00 0.00 H ATOM 1231 H2 WAT 2888 67.751 28.372 119.100 1.00 0.00 H TER 1233 WAT 2888 ATOM 1233 O WAT 2889 1.497 4.829 60.094 1.00 0.00 O ATOM 1234 H1 WAT 2889 1.414 5.734 59.791 1.00 0.00 H ATOM 1235 H2 WAT 2889 1.303 4.300 59.320 1.00 0.00 H TER 1237 WAT 2889 ATOM 1237 O WAT 2890 101.055 50.129 113.433 1.00 0.00 O ATOM 1238 H1 WAT 2890 101.456 49.877 112.601 1.00 0.00 H ATOM 1239 H2 WAT 2890 101.792 50.217 114.037 1.00 0.00 H TER 1241 WAT 2890 ATOM 1241 O WAT 2891 75.282 58.133 81.981 1.00 0.00 O ATOM 1242 H1 WAT 2891 75.432 58.172 82.926 1.00 0.00 H ATOM 1243 H2 WAT 2891 76.157 58.038 81.604 1.00 0.00 H TER 1245 WAT 2891 ATOM 1245 O WAT 2892 77.768 76.631 149.276 1.00 0.00 O ATOM 1246 H1 WAT 2892 77.301 77.238 149.851 1.00 0.00 H ATOM 1247 H2 WAT 2892 78.689 76.735 149.515 1.00 0.00 H TER 1249 WAT 2892 ATOM 1249 O WAT 2893 17.233 4.538 15.637 1.00 0.00 O ATOM 1250 H1 WAT 2893 16.556 3.888 15.821 1.00 0.00 H ATOM 1251 H2 WAT 2893 17.005 4.885 14.775 1.00 0.00 H TER 1253 WAT 2893 ATOM 1253 O WAT 2894 45.150 104.220 18.036 1.00 0.00 O ATOM 1254 H1 WAT 2894 45.838 103.555 18.049 1.00 0.00 H ATOM 1255 H2 WAT 2894 45.142 104.575 18.925 1.00 0.00 H TER 1257 WAT 2894 ATOM 1257 O WAT 2895 135.996 0.940 131.763 1.00 0.00 O ATOM 1258 H1 WAT 2895 135.062 0.969 131.554 1.00 0.00 H ATOM 1259 H2 WAT 2895 136.424 1.330 131.001 1.00 0.00 H TER 1261 WAT 2895 ATOM 1261 O WAT 2896 114.913 116.877 133.593 1.00 0.00 O ATOM 1262 H1 WAT 2896 115.664 116.312 133.413 1.00 0.00 H ATOM 1263 H2 WAT 2896 115.020 117.616 132.995 1.00 0.00 H TER 1265 WAT 2896 ATOM 1265 O WAT 2897 23.417 125.375 17.208 1.00 0.00 O ATOM 1266 H1 WAT 2897 22.847 125.328 16.441 1.00 0.00 H ATOM 1267 H2 WAT 2897 23.815 124.506 17.264 1.00 0.00 H TER 1269 WAT 2897 ATOM 1269 O WAT 2898 99.285 131.507 146.602 1.00 0.00 O ATOM 1270 H1 WAT 2898 98.990 132.190 147.204 1.00 0.00 H ATOM 1271 H2 WAT 2898 99.118 131.867 145.731 1.00 0.00 H TER 1273 WAT 2898 ATOM 1273 O WAT 2899 89.359 122.702 6.239 1.00 0.00 O ATOM 1274 H1 WAT 2899 89.789 123.224 6.916 1.00 0.00 H ATOM 1275 H2 WAT 2899 88.776 123.318 5.796 1.00 0.00 H TER 1277 WAT 2899 ATOM 1277 O WAT 2900 108.513 118.632 82.294 1.00 0.00 O ATOM 1278 H1 WAT 2900 108.380 119.579 82.345 1.00 0.00 H ATOM 1279 H2 WAT 2900 109.193 118.521 81.630 1.00 0.00 H TER 1281 WAT 2900 ATOM 1281 O WAT 2901 110.820 98.966 85.429 1.00 0.00 O ATOM 1282 H1 WAT 2901 111.173 99.544 86.106 1.00 0.00 H ATOM 1283 H2 WAT 2901 110.790 99.510 84.642 1.00 0.00 H TER 1285 WAT 2901 ATOM 1285 O WAT 2902 10.242 32.438 92.046 1.00 0.00 O ATOM 1286 H1 WAT 2902 10.755 31.872 91.470 1.00 0.00 H ATOM 1287 H2 WAT 2902 9.863 33.094 91.461 1.00 0.00 H TER 1289 WAT 2902 ATOM 1289 O WAT 2903 64.116 118.907 58.030 1.00 0.00 O ATOM 1290 H1 WAT 2903 63.682 118.433 57.320 1.00 0.00 H ATOM 1291 H2 WAT 2903 64.368 119.744 57.639 1.00 0.00 H TER 1293 WAT 2903 ATOM 1293 O WAT 2904 59.468 72.808 14.063 1.00 0.00 O ATOM 1294 H1 WAT 2904 59.980 72.582 14.839 1.00 0.00 H ATOM 1295 H2 WAT 2904 58.626 73.103 14.409 1.00 0.00 H TER 1297 WAT 2904 ATOM 1297 O WAT 2905 3.647 3.009 2.669 1.00 0.00 O ATOM 1298 H1 WAT 2905 2.954 2.739 2.066 1.00 0.00 H ATOM 1299 H2 WAT 2905 3.451 3.925 2.865 1.00 0.00 H TER 1301 WAT 2905 ATOM 1301 O WAT 2906 88.735 109.748 142.642 1.00 0.00 O ATOM 1302 H1 WAT 2906 88.677 108.828 142.900 1.00 0.00 H ATOM 1303 H2 WAT 2906 88.511 109.750 141.712 1.00 0.00 H TER 1305 WAT 2906 ATOM 1305 O WAT 2907 33.866 85.952 75.913 1.00 0.00 O ATOM 1306 H1 WAT 2907 34.609 85.833 75.321 1.00 0.00 H ATOM 1307 H2 WAT 2907 33.434 86.746 75.599 1.00 0.00 H TER 1309 WAT 2907 ATOM 1309 O WAT 2908 35.132 29.422 124.241 1.00 0.00 O ATOM 1310 H1 WAT 2908 35.885 29.431 123.650 1.00 0.00 H ATOM 1311 H2 WAT 2908 35.298 30.141 124.851 1.00 0.00 H TER 1313 WAT 2908 ATOM 1313 O WAT 2909 78.353 45.199 120.028 1.00 0.00 O ATOM 1314 H1 WAT 2909 77.812 44.458 120.301 1.00 0.00 H ATOM 1315 H2 WAT 2909 78.762 44.908 119.212 1.00 0.00 H TER 1317 WAT 2909 ATOM 1317 O WAT 2910 139.773 26.791 5.581 1.00 0.00 O ATOM 1318 H1 WAT 2910 138.832 26.622 5.521 1.00 0.00 H ATOM 1319 H2 WAT 2910 139.882 27.671 5.221 1.00 0.00 H TER 1321 WAT 2910 ATOM 1321 O WAT 2911 47.141 142.276 15.078 1.00 0.00 O ATOM 1322 H1 WAT 2911 47.239 141.572 14.436 1.00 0.00 H ATOM 1323 H2 WAT 2911 46.249 142.177 15.408 1.00 0.00 H TER 1325 WAT 2911 ATOM 1325 O WAT 2912 13.604 144.795 17.605 1.00 0.00 O ATOM 1326 H1 WAT 2912 12.658 144.672 17.681 1.00 0.00 H ATOM 1327 H2 WAT 2912 13.774 145.629 18.042 1.00 0.00 H TER 1329 WAT 2912 ATOM 1329 O WAT 2913 139.637 106.702 128.164 1.00 0.00 O ATOM 1330 H1 WAT 2913 139.370 107.256 128.898 1.00 0.00 H ATOM 1331 H2 WAT 2913 140.422 107.125 127.818 1.00 0.00 H TER 1333 WAT 2913 ATOM 1333 O WAT 2914 101.606 145.514 113.645 1.00 0.00 O ATOM 1334 H1 WAT 2914 102.505 145.744 113.409 1.00 0.00 H ATOM 1335 H2 WAT 2914 101.335 144.887 112.974 1.00 0.00 H TER 1337 WAT 2914 ATOM 1337 O WAT 2915 13.399 55.959 157.404 1.00 0.00 O ATOM 1338 H1 WAT 2915 12.709 56.621 157.445 1.00 0.00 H ATOM 1339 H2 WAT 2915 13.547 55.712 158.317 1.00 0.00 H TER 1341 WAT 2915 ATOM 1341 O WAT 2916 8.808 116.988 108.485 1.00 0.00 O ATOM 1342 H1 WAT 2916 8.305 117.356 107.759 1.00 0.00 H ATOM 1343 H2 WAT 2916 9.718 117.201 108.279 1.00 0.00 H TER 1345 WAT 2916 ATOM 1345 O WAT 2917 15.071 61.159 123.309 1.00 0.00 O ATOM 1346 H1 WAT 2917 15.108 61.416 122.388 1.00 0.00 H ATOM 1347 H2 WAT 2917 14.790 61.951 123.767 1.00 0.00 H TER 1349 WAT 2917 ATOM 1349 O WAT 2918 0.681 21.763 95.597 1.00 0.00 O ATOM 1350 H1 WAT 2918 0.337 22.578 95.964 1.00 0.00 H ATOM 1351 H2 WAT 2918 1.545 21.999 95.259 1.00 0.00 H TER 1353 WAT 2918 ATOM 1353 O WAT 2919 94.660 142.569 52.172 1.00 0.00 O ATOM 1354 H1 WAT 2919 94.312 143.037 52.932 1.00 0.00 H ATOM 1355 H2 WAT 2919 94.284 143.023 51.418 1.00 0.00 H TER 1357 WAT 2919 ATOM 1357 O WAT 2920 76.031 47.909 135.947 1.00 0.00 O ATOM 1358 H1 WAT 2920 76.516 48.615 136.373 1.00 0.00 H ATOM 1359 H2 WAT 2920 75.228 48.325 135.633 1.00 0.00 H TER 1361 WAT 2920 ATOM 1361 O WAT 2921 106.172 120.155 145.297 1.00 0.00 O ATOM 1362 H1 WAT 2921 105.575 120.827 144.967 1.00 0.00 H ATOM 1363 H2 WAT 2921 106.916 120.180 144.696 1.00 0.00 H TER 1365 WAT 2921 ATOM 1365 O WAT 2922 43.666 20.346 23.961 1.00 0.00 O ATOM 1366 H1 WAT 2922 44.008 20.425 23.070 1.00 0.00 H ATOM 1367 H2 WAT 2922 43.948 21.150 24.398 1.00 0.00 H TER 1369 WAT 2922 ATOM 1369 O WAT 2923 139.931 54.554 134.740 1.00 0.00 O ATOM 1370 H1 WAT 2923 139.972 54.790 135.666 1.00 0.00 H ATOM 1371 H2 WAT 2923 140.774 54.138 134.560 1.00 0.00 H TER 1373 WAT 2923 ATOM 1373 O WAT 2924 23.589 129.725 132.018 1.00 0.00 O ATOM 1374 H1 WAT 2924 23.278 129.771 131.114 1.00 0.00 H ATOM 1375 H2 WAT 2924 24.323 129.112 131.988 1.00 0.00 H TER 1377 WAT 2924 ATOM 1377 O WAT 2925 106.664 25.983 142.716 1.00 0.00 O ATOM 1378 H1 WAT 2925 106.163 25.314 143.183 1.00 0.00 H ATOM 1379 H2 WAT 2925 106.298 25.983 141.832 1.00 0.00 H TER 1381 WAT 2925 ATOM 1381 O WAT 2926 125.083 118.811 151.858 1.00 0.00 O ATOM 1382 H1 WAT 2926 125.511 119.113 151.057 1.00 0.00 H ATOM 1383 H2 WAT 2926 124.243 119.269 151.868 1.00 0.00 H TER 1385 WAT 2926 ATOM 1385 O WAT 2927 145.344 76.188 20.793 1.00 0.00 O ATOM 1386 H1 WAT 2927 144.387 76.223 20.815 1.00 0.00 H ATOM 1387 H2 WAT 2927 145.623 76.957 21.291 1.00 0.00 H TER 1389 WAT 2927 ATOM 1389 O WAT 2928 17.903 28.868 64.599 1.00 0.00 O ATOM 1390 H1 WAT 2928 17.380 29.658 64.462 1.00 0.00 H ATOM 1391 H2 WAT 2928 17.839 28.393 63.771 1.00 0.00 H TER 1393 WAT 2928 ATOM 1393 O WAT 2929 50.235 74.416 157.789 1.00 0.00 O ATOM 1394 H1 WAT 2929 50.820 73.676 157.628 1.00 0.00 H ATOM 1395 H2 WAT 2929 49.416 74.172 157.357 1.00 0.00 H TER 1397 WAT 2929 ATOM 1397 O WAT 2930 52.935 106.803 108.905 1.00 0.00 O ATOM 1398 H1 WAT 2930 53.170 107.503 109.513 1.00 0.00 H ATOM 1399 H2 WAT 2930 52.197 106.360 109.324 1.00 0.00 H TER 1401 WAT 2930 ATOM 1401 O WAT 2931 107.229 37.676 20.683 1.00 0.00 O ATOM 1402 H1 WAT 2931 107.895 38.298 20.976 1.00 0.00 H ATOM 1403 H2 WAT 2931 106.957 37.223 21.482 1.00 0.00 H TER 1405 WAT 2931 ATOM 1405 O WAT 2932 73.026 132.184 3.684 1.00 0.00 O ATOM 1406 H1 WAT 2932 73.218 131.899 4.578 1.00 0.00 H ATOM 1407 H2 WAT 2932 72.441 131.510 3.338 1.00 0.00 H TER 1409 WAT 2932 ATOM 1409 O WAT 2933 124.335 93.688 92.550 1.00 0.00 O ATOM 1410 H1 WAT 2933 123.524 93.532 93.033 1.00 0.00 H ATOM 1411 H2 WAT 2933 124.501 94.624 92.655 1.00 0.00 H TER 1413 WAT 2933 ATOM 1413 O WAT 2934 5.754 115.842 107.846 1.00 0.00 O ATOM 1414 H1 WAT 2934 5.995 116.488 107.182 1.00 0.00 H ATOM 1415 H2 WAT 2934 6.504 115.248 107.885 1.00 0.00 H TER 1417 WAT 2934 ATOM 1417 O WAT 2935 67.786 24.965 15.748 1.00 0.00 O ATOM 1418 H1 WAT 2935 67.255 25.646 15.335 1.00 0.00 H ATOM 1419 H2 WAT 2935 67.265 24.167 15.656 1.00 0.00 H TER 1421 WAT 2935 ATOM 1421 O WAT 2936 26.043 19.053 106.511 1.00 0.00 O ATOM 1422 H1 WAT 2936 26.681 18.584 105.973 1.00 0.00 H ATOM 1423 H2 WAT 2936 25.196 18.694 106.245 1.00 0.00 H TER 1425 WAT 2936 ATOM 1425 O WAT 2937 16.708 134.638 73.836 1.00 0.00 O ATOM 1426 H1 WAT 2937 17.216 133.892 73.517 1.00 0.00 H ATOM 1427 H2 WAT 2937 17.366 135.282 74.097 1.00 0.00 H TER 1429 WAT 2937 ATOM 1429 O WAT 2938 48.162 7.242 145.272 1.00 0.00 O ATOM 1430 H1 WAT 2938 48.540 6.410 144.987 1.00 0.00 H ATOM 1431 H2 WAT 2938 47.542 7.472 144.580 1.00 0.00 H TER 1433 WAT 2938 ATOM 1433 O WAT 2939 131.279 85.935 92.456 1.00 0.00 O ATOM 1434 H1 WAT 2939 130.362 85.842 92.200 1.00 0.00 H ATOM 1435 H2 WAT 2939 131.259 85.976 93.412 1.00 0.00 H TER 1437 WAT 2939 ATOM 1437 O WAT 2940 10.580 110.087 4.244 1.00 0.00 O ATOM 1438 H1 WAT 2940 10.105 109.514 3.644 1.00 0.00 H ATOM 1439 H2 WAT 2940 9.923 110.362 4.884 1.00 0.00 H TER 1441 WAT 2940 ATOM 1441 O WAT 2941 132.042 141.031 116.395 1.00 0.00 O ATOM 1442 H1 WAT 2941 132.149 140.082 116.445 1.00 0.00 H ATOM 1443 H2 WAT 2941 131.370 141.162 115.726 1.00 0.00 H TER 1445 WAT 2941 ATOM 1445 O WAT 2942 39.577 89.850 25.988 1.00 0.00 O ATOM 1446 H1 WAT 2942 38.998 90.265 26.628 1.00 0.00 H ATOM 1447 H2 WAT 2942 39.638 90.484 25.274 1.00 0.00 H TER 1449 WAT 2942 ATOM 1449 O WAT 2943 86.987 11.608 98.098 1.00 0.00 O ATOM 1450 H1 WAT 2943 86.638 11.828 97.235 1.00 0.00 H ATOM 1451 H2 WAT 2943 86.425 12.082 98.712 1.00 0.00 H TER 1453 WAT 2943 ATOM 1453 O WAT 2944 6.042 39.657 67.307 1.00 0.00 O ATOM 1454 H1 WAT 2944 5.431 40.356 67.540 1.00 0.00 H ATOM 1455 H2 WAT 2944 5.507 39.021 66.831 1.00 0.00 H TER 1457 WAT 2944 ATOM 1457 O WAT 2945 60.709 3.899 142.158 1.00 0.00 O ATOM 1458 H1 WAT 2945 61.015 4.137 141.283 1.00 0.00 H ATOM 1459 H2 WAT 2945 59.758 3.838 142.071 1.00 0.00 H TER 1461 WAT 2945 ATOM 1461 O WAT 2946 87.545 87.588 130.024 1.00 0.00 O ATOM 1462 H1 WAT 2946 87.367 86.892 129.391 1.00 0.00 H ATOM 1463 H2 WAT 2946 87.770 88.348 129.487 1.00 0.00 H TER 1465 WAT 2946 ATOM 1465 O WAT 2947 14.657 43.796 80.101 1.00 0.00 O ATOM 1466 H1 WAT 2947 15.270 44.014 80.802 1.00 0.00 H ATOM 1467 H2 WAT 2947 14.945 44.325 79.357 1.00 0.00 H TER 1469 WAT 2947 ATOM 1469 O WAT 2948 119.693 70.069 124.794 1.00 0.00 O ATOM 1470 H1 WAT 2948 119.630 69.215 124.366 1.00 0.00 H ATOM 1471 H2 WAT 2948 120.359 69.948 125.471 1.00 0.00 H TER 1473 WAT 2948 ATOM 1473 O WAT 2949 2.975 83.248 12.989 1.00 0.00 O ATOM 1474 H1 WAT 2949 2.621 82.365 13.093 1.00 0.00 H ATOM 1475 H2 WAT 2949 3.349 83.255 12.108 1.00 0.00 H TER 1477 WAT 2949 ATOM 1477 O WAT 2950 82.791 2.646 129.221 1.00 0.00 O ATOM 1478 H1 WAT 2950 83.076 2.852 128.331 1.00 0.00 H ATOM 1479 H2 WAT 2950 83.133 3.364 129.754 1.00 0.00 H TER 1481 WAT 2950 ATOM 1481 O WAT 2951 56.432 67.762 129.750 1.00 0.00 O ATOM 1482 H1 WAT 2951 56.781 67.371 128.949 1.00 0.00 H ATOM 1483 H2 WAT 2951 55.487 67.622 129.693 1.00 0.00 H TER 1485 WAT 2951 ATOM 1485 O WAT 2952 103.467 141.889 107.241 1.00 0.00 O ATOM 1486 H1 WAT 2952 102.818 142.000 106.546 1.00 0.00 H ATOM 1487 H2 WAT 2952 104.083 141.244 106.892 1.00 0.00 H TER 1489 WAT 2952 ATOM 1489 O WAT 2953 8.560 30.373 154.960 1.00 0.00 O ATOM 1490 H1 WAT 2953 8.440 30.562 154.029 1.00 0.00 H ATOM 1491 H2 WAT 2953 8.166 29.509 155.081 1.00 0.00 H TER 1493 WAT 2953 ATOM 1493 O WAT 2954 67.648 10.877 74.616 1.00 0.00 O ATOM 1494 H1 WAT 2954 68.159 11.223 75.348 1.00 0.00 H ATOM 1495 H2 WAT 2954 66.829 10.583 75.014 1.00 0.00 H TER 1497 WAT 2954 ATOM 1497 O WAT 2955 132.504 106.598 79.357 1.00 0.00 O ATOM 1498 H1 WAT 2955 132.530 106.878 80.272 1.00 0.00 H ATOM 1499 H2 WAT 2955 132.393 105.648 79.400 1.00 0.00 H TER 1501 WAT 2955 ATOM 1501 O WAT 2956 59.702 128.755 10.017 1.00 0.00 O ATOM 1502 H1 WAT 2956 59.968 129.590 10.403 1.00 0.00 H ATOM 1503 H2 WAT 2956 59.147 128.349 10.683 1.00 0.00 H TER 1505 WAT 2956 ATOM 1505 O WAT 2957 61.515 77.834 149.219 1.00 0.00 O ATOM 1506 H1 WAT 2957 62.044 77.534 148.480 1.00 0.00 H ATOM 1507 H2 WAT 2957 60.732 78.209 148.816 1.00 0.00 H TER 1509 WAT 2957 ATOM 1509 O WAT 2958 59.257 144.861 150.801 1.00 0.00 O ATOM 1510 H1 WAT 2958 59.389 144.649 151.725 1.00 0.00 H ATOM 1511 H2 WAT 2958 58.549 144.280 150.522 1.00 0.00 H TER 1513 WAT 2958 ATOM 1513 O WAT 2959 96.650 79.034 60.876 1.00 0.00 O ATOM 1514 H1 WAT 2959 96.583 79.773 60.272 1.00 0.00 H ATOM 1515 H2 WAT 2959 97.528 78.683 60.728 1.00 0.00 H TER 1517 WAT 2959 ATOM 1517 O WAT 2960 4.139 111.958 155.091 1.00 0.00 O ATOM 1518 H1 WAT 2960 4.816 112.456 155.548 1.00 0.00 H ATOM 1519 H2 WAT 2960 3.904 112.504 154.341 1.00 0.00 H TER 1521 WAT 2960 ATOM 1521 O WAT 2961 125.346 113.316 136.944 1.00 0.00 O ATOM 1522 H1 WAT 2961 125.889 112.748 136.397 1.00 0.00 H ATOM 1523 H2 WAT 2961 125.587 113.086 137.841 1.00 0.00 H TER 1525 WAT 2961 ATOM 1525 O WAT 2962 34.294 64.591 101.919 1.00 0.00 O ATOM 1526 H1 WAT 2962 34.169 65.388 101.404 1.00 0.00 H ATOM 1527 H2 WAT 2962 34.606 63.944 101.287 1.00 0.00 H TER 1529 WAT 2962 ATOM 1529 O WAT 2963 72.647 91.326 73.506 1.00 0.00 O ATOM 1530 H1 WAT 2963 73.128 90.605 73.913 1.00 0.00 H ATOM 1531 H2 WAT 2963 71.799 91.329 73.950 1.00 0.00 H TER 1533 WAT 2963 ATOM 1533 O WAT 2964 89.748 37.069 124.494 1.00 0.00 O ATOM 1534 H1 WAT 2964 89.467 36.245 124.893 1.00 0.00 H ATOM 1535 H2 WAT 2964 89.988 37.624 125.235 1.00 0.00 H TER 1537 WAT 2964 ATOM 1537 O WAT 2965 59.749 144.416 59.420 1.00 0.00 O ATOM 1538 H1 WAT 2965 59.220 144.064 58.705 1.00 0.00 H ATOM 1539 H2 WAT 2965 59.193 144.332 60.194 1.00 0.00 H TER 1541 WAT 2965 ATOM 1541 O WAT 2966 30.578 86.338 102.135 1.00 0.00 O ATOM 1542 H1 WAT 2966 30.194 86.175 101.273 1.00 0.00 H ATOM 1543 H2 WAT 2966 30.328 87.238 102.342 1.00 0.00 H TER 1545 WAT 2966 ATOM 1545 O WAT 2967 73.490 87.108 141.029 1.00 0.00 O ATOM 1546 H1 WAT 2967 73.910 87.911 141.337 1.00 0.00 H ATOM 1547 H2 WAT 2967 73.552 86.505 141.770 1.00 0.00 H TER 1549 WAT 2967 ATOM 1549 O WAT 2968 87.741 48.881 60.653 1.00 0.00 O ATOM 1550 H1 WAT 2968 87.294 49.371 59.964 1.00 0.00 H ATOM 1551 H2 WAT 2968 88.414 48.380 60.193 1.00 0.00 H TER 1553 WAT 2968 ATOM 1553 O WAT 2969 60.496 96.274 133.006 1.00 0.00 O ATOM 1554 H1 WAT 2969 61.330 96.718 133.163 1.00 0.00 H ATOM 1555 H2 WAT 2969 60.358 96.352 132.062 1.00 0.00 H TER 1557 WAT 2969 ATOM 1557 O WAT 2970 143.012 53.285 22.717 1.00 0.00 O ATOM 1558 H1 WAT 2970 142.381 53.880 23.123 1.00 0.00 H ATOM 1559 H2 WAT 2970 142.476 52.682 22.203 1.00 0.00 H TER 1561 WAT 2970 ATOM 1561 O WAT 2971 31.538 104.600 118.151 1.00 0.00 O ATOM 1562 H1 WAT 2971 31.744 104.648 119.084 1.00 0.00 H ATOM 1563 H2 WAT 2971 30.731 105.106 118.057 1.00 0.00 H TER 1565 WAT 2971 ATOM 1565 O WAT 2972 142.842 98.305 113.170 1.00 0.00 O ATOM 1566 H1 WAT 2972 142.727 98.790 112.352 1.00 0.00 H ATOM 1567 H2 WAT 2972 142.288 98.764 113.801 1.00 0.00 H TER 1569 WAT 2972 ATOM 1569 O WAT 2973 93.158 107.270 122.787 1.00 0.00 O ATOM 1570 H1 WAT 2973 92.255 106.963 122.704 1.00 0.00 H ATOM 1571 H2 WAT 2973 93.415 107.502 121.894 1.00 0.00 H TER 1573 WAT 2973 ATOM 1573 O WAT 2974 2.318 67.575 98.794 1.00 0.00 O ATOM 1574 H1 WAT 2974 1.716 67.800 98.085 1.00 0.00 H ATOM 1575 H2 WAT 2974 2.161 68.240 99.463 1.00 0.00 H TER 1577 WAT 2974 ATOM 1577 O WAT 2975 84.945 96.775 157.506 1.00 0.00 O ATOM 1578 H1 WAT 2975 85.157 96.348 156.676 1.00 0.00 H ATOM 1579 H2 WAT 2975 84.049 96.497 157.697 1.00 0.00 H TER 1581 WAT 2975 ATOM 1581 O WAT 2976 35.614 82.685 78.666 1.00 0.00 O ATOM 1582 H1 WAT 2976 34.675 82.694 78.851 1.00 0.00 H ATOM 1583 H2 WAT 2976 35.889 83.594 78.780 1.00 0.00 H TER 1585 WAT 2976 ATOM 1585 O WAT 2977 53.123 60.843 82.358 1.00 0.00 O ATOM 1586 H1 WAT 2977 52.430 60.352 82.800 1.00 0.00 H ATOM 1587 H2 WAT 2977 53.605 60.184 81.860 1.00 0.00 H TER 1589 WAT 2977 ATOM 1589 O WAT 2978 64.551 108.821 74.900 1.00 0.00 O ATOM 1590 H1 WAT 2978 65.236 108.385 74.392 1.00 0.00 H ATOM 1591 H2 WAT 2978 63.733 108.516 74.508 1.00 0.00 H TER 1593 WAT 2978 ATOM 1593 O WAT 2979 118.914 17.696 93.684 1.00 0.00 O ATOM 1594 H1 WAT 2979 118.518 17.671 92.813 1.00 0.00 H ATOM 1595 H2 WAT 2979 119.042 18.627 93.862 1.00 0.00 H TER 1597 WAT 2979 ATOM 1597 O WAT 2980 41.260 106.355 79.516 1.00 0.00 O ATOM 1598 H1 WAT 2980 41.429 105.531 79.060 1.00 0.00 H ATOM 1599 H2 WAT 2980 41.482 107.032 78.878 1.00 0.00 H TER 1601 WAT 2980 ATOM 1601 O WAT 2981 113.384 2.277 77.315 1.00 0.00 O ATOM 1602 H1 WAT 2981 113.267 2.314 76.366 1.00 0.00 H ATOM 1603 H2 WAT 2981 112.615 2.724 77.668 1.00 0.00 H TER 1605 WAT 2981 ATOM 1605 O WAT 2982 35.763 37.666 14.538 1.00 0.00 O ATOM 1606 H1 WAT 2982 35.742 36.796 14.936 1.00 0.00 H ATOM 1607 H2 WAT 2982 36.661 37.969 14.671 1.00 0.00 H TER 1609 WAT 2982 ATOM 1609 O WAT 2983 36.836 23.330 150.700 1.00 0.00 O ATOM 1610 H1 WAT 2983 37.033 22.434 150.428 1.00 0.00 H ATOM 1611 H2 WAT 2983 37.080 23.868 149.947 1.00 0.00 H TER 1613 WAT 2983 ATOM 1613 O WAT 2984 43.441 73.561 106.871 1.00 0.00 O ATOM 1614 H1 WAT 2984 42.879 74.278 107.166 1.00 0.00 H ATOM 1615 H2 WAT 2984 44.025 73.964 106.229 1.00 0.00 H TER 1617 WAT 2984 ATOM 1617 O WAT 2985 100.557 62.616 68.367 1.00 0.00 O ATOM 1618 H1 WAT 2985 100.380 62.219 69.220 1.00 0.00 H ATOM 1619 H2 WAT 2985 101.418 63.022 68.466 1.00 0.00 H TER 1621 WAT 2985 ATOM 1621 O WAT 2986 97.107 10.482 124.789 1.00 0.00 O ATOM 1622 H1 WAT 2986 97.616 9.822 124.319 1.00 0.00 H ATOM 1623 H2 WAT 2986 97.583 10.613 125.609 1.00 0.00 H TER 1625 WAT 2986 ATOM 1625 O WAT 2987 73.189 10.833 77.088 1.00 0.00 O ATOM 1626 H1 WAT 2987 72.406 10.962 76.552 1.00 0.00 H ATOM 1627 H2 WAT 2987 73.240 9.886 77.214 1.00 0.00 H TER 1629 WAT 2987 ATOM 1629 O WAT 2988 56.272 42.669 109.924 1.00 0.00 O ATOM 1630 H1 WAT 2988 56.675 42.476 110.770 1.00 0.00 H ATOM 1631 H2 WAT 2988 55.398 42.282 109.980 1.00 0.00 H TER 1633 WAT 2988 ATOM 1633 O WAT 2989 122.622 142.983 93.946 1.00 0.00 O ATOM 1634 H1 WAT 2989 122.368 142.186 94.412 1.00 0.00 H ATOM 1635 H2 WAT 2989 122.441 142.790 93.026 1.00 0.00 H TER 1637 WAT 2989 ATOM 1637 O WAT 2990 52.264 8.083 86.546 1.00 0.00 O ATOM 1638 H1 WAT 2990 52.064 7.244 86.131 1.00 0.00 H ATOM 1639 H2 WAT 2990 52.928 7.873 87.203 1.00 0.00 H TER 1641 WAT 2990 ATOM 1641 O WAT 2991 56.102 17.754 121.543 1.00 0.00 O ATOM 1642 H1 WAT 2991 55.351 17.995 122.085 1.00 0.00 H ATOM 1643 H2 WAT 2991 55.912 18.137 120.687 1.00 0.00 H TER 1645 WAT 2991 ATOM 1645 O WAT 2992 37.379 7.313 64.408 1.00 0.00 O ATOM 1646 H1 WAT 2992 37.389 7.457 63.461 1.00 0.00 H ATOM 1647 H2 WAT 2992 37.284 6.365 64.505 1.00 0.00 H TER 1649 WAT 2992 ATOM 1649 O WAT 2993 142.523 66.209 152.536 1.00 0.00 O ATOM 1650 H1 WAT 2993 142.551 65.259 152.653 1.00 0.00 H ATOM 1651 H2 WAT 2993 142.417 66.331 151.592 1.00 0.00 H TER 1653 WAT 2993 ATOM 1653 O WAT 2994 46.982 88.583 20.806 1.00 0.00 O ATOM 1654 H1 WAT 2994 46.309 88.991 20.261 1.00 0.00 H ATOM 1655 H2 WAT 2994 47.321 89.298 21.344 1.00 0.00 H TER 1657 WAT 2994 ATOM 1657 O WAT 2995 120.483 61.928 91.052 1.00 0.00 O ATOM 1658 H1 WAT 2995 121.084 61.574 90.397 1.00 0.00 H ATOM 1659 H2 WAT 2995 120.667 62.867 91.063 1.00 0.00 H TER 1661 WAT 2995 ATOM 1661 O WAT 2996 77.413 8.343 126.018 1.00 0.00 O ATOM 1662 H1 WAT 2996 77.169 8.925 125.298 1.00 0.00 H ATOM 1663 H2 WAT 2996 78.237 7.945 125.735 1.00 0.00 H TER 1665 WAT 2996 ATOM 1665 O WAT 2997 65.226 114.784 84.146 1.00 0.00 O ATOM 1666 H1 WAT 2997 65.585 114.032 83.676 1.00 0.00 H ATOM 1667 H2 WAT 2997 65.099 114.469 85.041 1.00 0.00 H TER 1669 WAT 2997 ATOM 1669 O WAT 2998 57.906 42.085 94.550 1.00 0.00 O ATOM 1670 H1 WAT 2998 58.421 41.863 95.326 1.00 0.00 H ATOM 1671 H2 WAT 2998 58.124 43.000 94.371 1.00 0.00 H TER 1673 WAT 2998 ATOM 1673 O WAT 2999 73.128 134.848 145.136 1.00 0.00 O ATOM 1674 H1 WAT 2999 74.009 135.194 145.276 1.00 0.00 H ATOM 1675 H2 WAT 2999 72.754 135.412 144.460 1.00 0.00 H TER 1677 WAT 2999 ATOM 1677 O WAT 3000 92.344 131.055 90.505 1.00 0.00 O ATOM 1678 H1 WAT 3000 92.419 130.678 89.628 1.00 0.00 H ATOM 1679 H2 WAT 3000 93.180 131.499 90.647 1.00 0.00 H TER 1681 WAT 3000 ATOM 1681 O WAT 3001 34.609 41.321 157.482 1.00 0.00 O ATOM 1682 H1 WAT 3001 35.518 41.430 157.201 1.00 0.00 H ATOM 1683 H2 WAT 3001 34.099 41.392 156.675 1.00 0.00 H TER 1685 WAT 3001 ATOM 1685 O WAT 3002 4.705 32.191 13.453 1.00 0.00 O ATOM 1686 H1 WAT 3002 4.751 31.282 13.157 1.00 0.00 H ATOM 1687 H2 WAT 3002 3.859 32.255 13.897 1.00 0.00 H TER 1689 WAT 3002 ATOM 1689 O WAT 3003 37.584 106.988 136.821 1.00 0.00 O ATOM 1690 H1 WAT 3003 37.819 107.312 135.951 1.00 0.00 H ATOM 1691 H2 WAT 3003 37.256 106.103 136.666 1.00 0.00 H TER 1693 WAT 3003 ATOM 1693 O WAT 3004 102.121 79.848 75.133 1.00 0.00 O ATOM 1694 H1 WAT 3004 103.076 79.883 75.196 1.00 0.00 H ATOM 1695 H2 WAT 3004 101.818 80.579 75.670 1.00 0.00 H TER 1697 WAT 3004 ATOM 1697 O WAT 3005 123.544 92.027 68.201 1.00 0.00 O ATOM 1698 H1 WAT 3005 124.078 92.388 68.909 1.00 0.00 H ATOM 1699 H2 WAT 3005 122.851 91.541 68.648 1.00 0.00 H TER 1701 WAT 3005 ATOM 1701 O WAT 3006 47.262 137.688 134.467 1.00 0.00 O ATOM 1702 H1 WAT 3006 46.334 137.822 134.660 1.00 0.00 H ATOM 1703 H2 WAT 3006 47.275 136.960 133.846 1.00 0.00 H TER 1705 WAT 3006 ATOM 1705 O WAT 3007 140.639 57.528 149.434 1.00 0.00 O ATOM 1706 H1 WAT 3007 140.668 57.545 148.477 1.00 0.00 H ATOM 1707 H2 WAT 3007 141.046 58.353 149.700 1.00 0.00 H TER 1709 WAT 3007 ATOM 1709 O WAT 3008 111.752 103.222 106.736 1.00 0.00 O ATOM 1710 H1 WAT 3008 112.598 102.873 107.018 1.00 0.00 H ATOM 1711 H2 WAT 3008 111.817 104.164 106.894 1.00 0.00 H TER 1713 WAT 3008 ATOM 1713 O WAT 3009 35.217 116.173 128.460 1.00 0.00 O ATOM 1714 H1 WAT 3009 34.473 115.735 128.047 1.00 0.00 H ATOM 1715 H2 WAT 3009 35.484 115.580 129.161 1.00 0.00 H TER 1717 WAT 3009 ATOM 1717 O WAT 3010 138.428 61.150 80.462 1.00 0.00 O ATOM 1718 H1 WAT 3010 138.333 62.028 80.831 1.00 0.00 H ATOM 1719 H2 WAT 3010 139.148 61.229 79.837 1.00 0.00 H TER 1721 WAT 3010 ATOM 1721 O WAT 3011 88.862 31.674 146.495 1.00 0.00 O ATOM 1722 H1 WAT 3011 87.956 31.612 146.800 1.00 0.00 H ATOM 1723 H2 WAT 3011 89.373 31.226 147.169 1.00 0.00 H TER 1725 WAT 3011 ATOM 1725 O WAT 3012 88.981 82.327 151.492 1.00 0.00 O ATOM 1726 H1 WAT 3012 88.427 81.556 151.369 1.00 0.00 H ATOM 1727 H2 WAT 3012 89.802 81.980 151.840 1.00 0.00 H TER 1729 WAT 3012 ATOM 1729 O WAT 3013 58.436 54.608 128.598 1.00 0.00 O ATOM 1730 H1 WAT 3013 59.249 55.109 128.658 1.00 0.00 H ATOM 1731 H2 WAT 3013 58.022 54.718 129.454 1.00 0.00 H TER 1733 WAT 3013 ATOM 1733 O WAT 3014 99.304 97.593 117.179 1.00 0.00 O ATOM 1734 H1 WAT 3014 98.736 97.581 117.949 1.00 0.00 H ATOM 1735 H2 WAT 3014 98.729 97.856 116.461 1.00 0.00 H TER 1737 WAT 3014 ATOM 1737 O WAT 3015 29.619 84.033 140.175 1.00 0.00 O ATOM 1738 H1 WAT 3015 28.995 83.857 140.879 1.00 0.00 H ATOM 1739 H2 WAT 3015 29.082 84.077 139.384 1.00 0.00 H TER 1741 WAT 3015 ATOM 1741 O WAT 3016 17.990 19.442 127.960 1.00 0.00 O ATOM 1742 H1 WAT 3016 18.092 19.346 128.907 1.00 0.00 H ATOM 1743 H2 WAT 3016 17.407 20.194 127.857 1.00 0.00 H TER 1745 WAT 3016 ATOM 1745 O WAT 3017 100.470 126.700 95.878 1.00 0.00 O ATOM 1746 H1 WAT 3017 100.968 127.474 96.143 1.00 0.00 H ATOM 1747 H2 WAT 3017 99.862 127.024 95.213 1.00 0.00 H TER 1749 WAT 3017 ATOM 1749 O WAT 3018 141.244 37.664 125.066 1.00 0.00 O ATOM 1750 H1 WAT 3018 141.773 38.416 125.332 1.00 0.00 H ATOM 1751 H2 WAT 3018 140.625 38.019 124.428 1.00 0.00 H TER 1753 WAT 3018 ATOM 1753 O WAT 3019 12.833 78.102 137.939 1.00 0.00 O ATOM 1754 H1 WAT 3019 11.881 78.017 137.902 1.00 0.00 H ATOM 1755 H2 WAT 3019 13.046 78.720 137.240 1.00 0.00 H TER 1757 WAT 3019 ATOM 1757 O WAT 3020 40.457 141.699 99.406 1.00 0.00 O ATOM 1758 H1 WAT 3020 40.583 141.701 100.355 1.00 0.00 H ATOM 1759 H2 WAT 3020 39.839 142.411 99.245 1.00 0.00 H TER 1761 WAT 3020 ATOM 1761 O WAT 3021 106.950 43.592 94.461 1.00 0.00 O ATOM 1762 H1 WAT 3021 106.265 43.286 93.867 1.00 0.00 H ATOM 1763 H2 WAT 3021 106.485 43.818 95.267 1.00 0.00 H TER 1765 WAT 3021 ATOM 1765 O WAT 3022 29.650 60.065 151.261 1.00 0.00 O ATOM 1766 H1 WAT 3022 30.574 59.837 151.367 1.00 0.00 H ATOM 1767 H2 WAT 3022 29.660 60.982 150.986 1.00 0.00 H TER 1769 WAT 3022 ATOM 1769 O WAT 3023 72.541 138.917 105.462 1.00 0.00 O ATOM 1770 H1 WAT 3023 72.203 139.760 105.762 1.00 0.00 H ATOM 1771 H2 WAT 3023 72.515 138.974 104.507 1.00 0.00 H TER 1773 WAT 3023 ATOM 1773 O WAT 3024 133.566 110.224 116.677 1.00 0.00 O ATOM 1774 H1 WAT 3024 134.490 110.471 116.638 1.00 0.00 H ATOM 1775 H2 WAT 3024 133.175 110.858 117.279 1.00 0.00 H TER 1777 WAT 3024 ATOM 1777 O WAT 3025 114.091 92.889 94.149 1.00 0.00 O ATOM 1778 H1 WAT 3025 114.370 93.610 94.714 1.00 0.00 H ATOM 1779 H2 WAT 3025 114.098 93.260 93.266 1.00 0.00 H TER 1781 WAT 3025 ATOM 1781 O WAT 3026 82.982 104.612 152.839 1.00 0.00 O ATOM 1782 H1 WAT 3026 82.507 105.416 152.628 1.00 0.00 H ATOM 1783 H2 WAT 3026 82.298 103.955 152.963 1.00 0.00 H TER 1785 WAT 3026 ATOM 1785 O WAT 3027 139.665 107.965 65.459 1.00 0.00 O ATOM 1786 H1 WAT 3027 139.115 108.226 66.198 1.00 0.00 H ATOM 1787 H2 WAT 3027 140.308 108.669 65.379 1.00 0.00 H TER 1789 WAT 3027 ATOM 1789 O WAT 3028 34.214 15.049 129.489 1.00 0.00 O ATOM 1790 H1 WAT 3028 34.594 15.773 129.987 1.00 0.00 H ATOM 1791 H2 WAT 3028 33.848 14.467 130.155 1.00 0.00 H TER 1793 WAT 3028 ATOM 1793 O WAT 3029 141.889 65.185 132.357 1.00 0.00 O ATOM 1794 H1 WAT 3029 141.993 65.745 131.587 1.00 0.00 H ATOM 1795 H2 WAT 3029 141.724 64.313 131.999 1.00 0.00 H TER 1797 WAT 3029 ATOM 1797 O WAT 3030 114.729 39.982 147.243 1.00 0.00 O ATOM 1798 H1 WAT 3030 114.022 40.455 146.805 1.00 0.00 H ATOM 1799 H2 WAT 3030 114.499 40.014 148.172 1.00 0.00 H TER 1801 WAT 3030 ATOM 1801 O WAT 3031 128.001 136.738 5.118 1.00 0.00 O ATOM 1802 H1 WAT 3031 128.223 137.611 4.794 1.00 0.00 H ATOM 1803 H2 WAT 3031 127.051 136.760 5.234 1.00 0.00 H TER 1805 WAT 3031 ATOM 1805 O WAT 3032 79.647 13.971 78.034 1.00 0.00 O ATOM 1806 H1 WAT 3032 80.328 13.625 78.611 1.00 0.00 H ATOM 1807 H2 WAT 3032 79.011 14.369 78.627 1.00 0.00 H TER 1809 WAT 3032 ATOM 1809 O WAT 3033 13.034 66.066 137.073 1.00 0.00 O ATOM 1810 H1 WAT 3033 12.113 66.199 137.297 1.00 0.00 H ATOM 1811 H2 WAT 3033 13.081 66.248 136.134 1.00 0.00 H TER 1813 WAT 3033 ATOM 1813 O WAT 3034 89.994 73.977 70.300 1.00 0.00 O ATOM 1814 H1 WAT 3034 90.564 74.293 69.599 1.00 0.00 H ATOM 1815 H2 WAT 3034 90.449 73.211 70.651 1.00 0.00 H TER 1817 WAT 3034 ATOM 1817 O WAT 3035 101.426 142.455 7.550 1.00 0.00 O ATOM 1818 H1 WAT 3035 100.705 142.229 8.138 1.00 0.00 H ATOM 1819 H2 WAT 3035 102.166 141.938 7.869 1.00 0.00 H TER 1821 WAT 3035 ATOM 1821 O WAT 3036 107.113 16.396 55.765 1.00 0.00 O ATOM 1822 H1 WAT 3036 106.368 16.586 56.334 1.00 0.00 H ATOM 1823 H2 WAT 3036 107.648 17.190 55.797 1.00 0.00 H TER 1825 WAT 3036 ATOM 1825 O WAT 3037 10.499 53.694 72.160 1.00 0.00 O ATOM 1826 H1 WAT 3037 9.980 54.336 72.645 1.00 0.00 H ATOM 1827 H2 WAT 3037 10.412 53.958 71.244 1.00 0.00 H TER 1829 WAT 3037 ATOM 1829 O WAT 3038 102.618 35.777 116.494 1.00 0.00 O ATOM 1830 H1 WAT 3038 101.873 36.316 116.762 1.00 0.00 H ATOM 1831 H2 WAT 3038 103.331 36.050 117.070 1.00 0.00 H TER 1833 WAT 3038 ATOM 1833 O WAT 3039 79.864 113.246 98.764 1.00 0.00 O ATOM 1834 H1 WAT 3039 80.077 112.650 99.482 1.00 0.00 H ATOM 1835 H2 WAT 3039 79.780 112.677 97.998 1.00 0.00 H TER 1837 WAT 3039 ATOM 1837 O WAT 3040 5.421 53.347 73.436 1.00 0.00 O ATOM 1838 H1 WAT 3040 4.988 52.495 73.383 1.00 0.00 H ATOM 1839 H2 WAT 3040 5.221 53.770 72.600 1.00 0.00 H TER 1841 WAT 3040 ATOM 1841 O WAT 3041 62.273 133.790 90.509 1.00 0.00 O ATOM 1842 H1 WAT 3041 62.910 133.082 90.598 1.00 0.00 H ATOM 1843 H2 WAT 3041 61.677 133.671 91.249 1.00 0.00 H TER 1845 WAT 3041 ATOM 1845 O WAT 3042 18.253 46.391 150.118 1.00 0.00 O ATOM 1846 H1 WAT 3042 18.048 47.277 149.819 1.00 0.00 H ATOM 1847 H2 WAT 3042 19.173 46.434 150.381 1.00 0.00 H TER 1849 WAT 3042 ATOM 1849 O WAT 3043 135.746 2.366 141.471 1.00 0.00 O ATOM 1850 H1 WAT 3043 135.292 2.834 142.171 1.00 0.00 H ATOM 1851 H2 WAT 3043 135.444 1.461 141.552 1.00 0.00 H TER 1853 WAT 3043 ATOM 1853 O WAT 3044 115.582 122.988 11.273 1.00 0.00 O ATOM 1854 H1 WAT 3044 115.486 123.898 11.555 1.00 0.00 H ATOM 1855 H2 WAT 3044 116.233 122.620 11.870 1.00 0.00 H TER 1857 WAT 3044 ATOM 1857 O WAT 3045 108.881 52.180 152.476 1.00 0.00 O ATOM 1858 H1 WAT 3045 108.167 51.621 152.170 1.00 0.00 H ATOM 1859 H2 WAT 3045 108.516 53.065 152.459 1.00 0.00 H TER 1861 WAT 3045 ATOM 1861 O WAT 3046 65.538 45.880 122.948 1.00 0.00 O ATOM 1862 H1 WAT 3046 66.350 45.983 122.452 1.00 0.00 H ATOM 1863 H2 WAT 3046 65.585 44.993 123.303 1.00 0.00 H TER 1865 WAT 3046 ATOM 1865 O WAT 3047 140.110 66.266 111.149 1.00 0.00 O ATOM 1866 H1 WAT 3047 139.372 65.715 110.888 1.00 0.00 H ATOM 1867 H2 WAT 3047 140.782 66.095 110.489 1.00 0.00 H TER 1869 WAT 3047 ATOM 1869 O WAT 3048 7.682 52.599 7.802 1.00 0.00 O ATOM 1870 H1 WAT 3048 8.460 52.649 8.358 1.00 0.00 H ATOM 1871 H2 WAT 3048 7.915 51.967 7.122 1.00 0.00 H TER 1873 WAT 3048 ATOM 1873 O WAT 3049 31.569 60.614 129.366 1.00 0.00 O ATOM 1874 H1 WAT 3049 30.987 61.351 129.181 1.00 0.00 H ATOM 1875 H2 WAT 3049 31.587 60.557 130.321 1.00 0.00 H TER 1877 WAT 3049 ATOM 1877 O WAT 3050 28.092 136.755 79.822 1.00 0.00 O ATOM 1878 H1 WAT 3050 27.634 137.579 79.991 1.00 0.00 H ATOM 1879 H2 WAT 3050 28.990 137.017 79.619 1.00 0.00 H TER 1881 WAT 3050 ATOM 1881 O WAT 3051 135.109 130.034 7.226 1.00 0.00 O ATOM 1882 H1 WAT 3051 134.344 130.258 6.695 1.00 0.00 H ATOM 1883 H2 WAT 3051 135.272 129.111 7.033 1.00 0.00 H TER 1885 WAT 3051 ATOM 1885 O WAT 3052 6.629 80.971 86.061 1.00 0.00 O ATOM 1886 H1 WAT 3052 7.036 80.134 85.838 1.00 0.00 H ATOM 1887 H2 WAT 3052 5.732 80.744 86.304 1.00 0.00 H TER 1889 WAT 3052 ATOM 1889 O WAT 3053 25.926 98.154 94.927 1.00 0.00 O ATOM 1890 H1 WAT 3053 25.825 99.083 95.136 1.00 0.00 H ATOM 1891 H2 WAT 3053 25.724 98.095 93.993 1.00 0.00 H TER 1893 WAT 3053 ATOM 1893 O WAT 3054 24.717 107.781 138.999 1.00 0.00 O ATOM 1894 H1 WAT 3054 25.661 107.833 139.149 1.00 0.00 H ATOM 1895 H2 WAT 3054 24.603 108.069 138.093 1.00 0.00 H TER 1897 WAT 3054 ATOM 1897 O WAT 3055 143.820 111.560 90.359 1.00 0.00 O ATOM 1898 H1 WAT 3055 143.852 111.674 91.309 1.00 0.00 H ATOM 1899 H2 WAT 3055 144.026 112.425 90.007 1.00 0.00 H TER 1901 WAT 3055 ATOM 1901 O WAT 3056 11.902 1.731 92.370 1.00 0.00 O ATOM 1902 H1 WAT 3056 12.815 1.657 92.092 1.00 0.00 H ATOM 1903 H2 WAT 3056 11.630 0.829 92.541 1.00 0.00 H TER 1905 WAT 3056 ATOM 1905 O WAT 3057 40.335 128.653 157.559 1.00 0.00 O ATOM 1906 H1 WAT 3057 40.245 129.049 156.692 1.00 0.00 H ATOM 1907 H2 WAT 3057 41.275 128.496 157.654 1.00 0.00 H TER 1909 WAT 3057 ATOM 1909 O WAT 3058 3.850 47.177 71.951 1.00 0.00 O ATOM 1910 H1 WAT 3058 4.150 46.277 71.826 1.00 0.00 H ATOM 1911 H2 WAT 3058 4.208 47.656 71.203 1.00 0.00 H TER 1913 WAT 3058 ATOM 1913 O WAT 3059 82.580 134.563 103.994 1.00 0.00 O ATOM 1914 H1 WAT 3059 83.027 133.940 104.566 1.00 0.00 H ATOM 1915 H2 WAT 3059 82.851 134.314 103.110 1.00 0.00 H TER 1917 WAT 3059 ATOM 1917 O WAT 3060 67.525 75.245 63.524 1.00 0.00 O ATOM 1918 H1 WAT 3060 67.969 74.446 63.810 1.00 0.00 H ATOM 1919 H2 WAT 3060 66.949 75.473 64.253 1.00 0.00 H TER 1921 WAT 3060 ATOM 1921 O WAT 3061 109.302 83.570 111.793 1.00 0.00 O ATOM 1922 H1 WAT 3061 109.230 83.846 112.707 1.00 0.00 H ATOM 1923 H2 WAT 3061 108.474 83.124 111.612 1.00 0.00 H TER 1925 WAT 3061 ATOM 1925 O WAT 3062 52.834 140.476 123.688 1.00 0.00 O ATOM 1926 H1 WAT 3062 52.052 140.906 123.342 1.00 0.00 H ATOM 1927 H2 WAT 3062 53.444 140.459 122.950 1.00 0.00 H TER 1929 WAT 3062 ATOM 1929 O WAT 3063 145.556 72.181 78.259 1.00 0.00 O ATOM 1930 H1 WAT 3063 146.376 72.653 78.111 1.00 0.00 H ATOM 1931 H2 WAT 3063 144.987 72.819 78.691 1.00 0.00 H TER 1933 WAT 3063 ATOM 1933 O WAT 3064 106.319 70.602 16.097 1.00 0.00 O ATOM 1934 H1 WAT 3064 105.798 69.955 15.623 1.00 0.00 H ATOM 1935 H2 WAT 3064 106.981 70.886 15.465 1.00 0.00 H TER 1937 WAT 3064 ATOM 1937 O WAT 3065 140.813 14.455 113.795 1.00 0.00 O ATOM 1938 H1 WAT 3065 141.714 14.765 113.883 1.00 0.00 H ATOM 1939 H2 WAT 3065 140.816 13.590 114.203 1.00 0.00 H TER 1941 WAT 3065 ATOM 1941 O WAT 3066 144.485 6.059 84.950 1.00 0.00 O ATOM 1942 H1 WAT 3066 143.944 6.396 84.236 1.00 0.00 H ATOM 1943 H2 WAT 3066 145.356 5.963 84.566 1.00 0.00 H TER 1945 WAT 3066 ATOM 1945 O WAT 3067 136.080 133.806 61.030 1.00 0.00 O ATOM 1946 H1 WAT 3067 136.193 134.399 60.287 1.00 0.00 H ATOM 1947 H2 WAT 3067 136.222 132.933 60.663 1.00 0.00 H TER 1949 WAT 3067 ATOM 1949 O WAT 3068 139.307 26.128 54.034 1.00 0.00 O ATOM 1950 H1 WAT 3068 139.780 26.850 54.447 1.00 0.00 H ATOM 1951 H2 WAT 3068 138.383 26.331 54.182 1.00 0.00 H TER 1953 WAT 3068 ATOM 1953 O WAT 3069 10.767 82.919 88.464 1.00 0.00 O ATOM 1954 H1 WAT 3069 10.746 82.440 87.636 1.00 0.00 H ATOM 1955 H2 WAT 3069 9.853 83.145 88.634 1.00 0.00 H TER 1957 WAT 3069 ATOM 1957 O WAT 3070 28.946 55.265 155.234 1.00 0.00 O ATOM 1958 H1 WAT 3070 29.396 55.845 155.848 1.00 0.00 H ATOM 1959 H2 WAT 3070 29.273 55.527 154.373 1.00 0.00 H TER 1961 WAT 3070 ATOM 1961 O WAT 3071 117.740 72.963 128.469 1.00 0.00 O ATOM 1962 H1 WAT 3071 117.029 73.526 128.163 1.00 0.00 H ATOM 1963 H2 WAT 3071 118.111 72.591 127.669 1.00 0.00 H TER 1965 WAT 3071 ATOM 1965 O WAT 3072 9.346 38.327 2.017 1.00 0.00 O ATOM 1966 H1 WAT 3072 8.677 38.255 2.698 1.00 0.00 H ATOM 1967 H2 WAT 3072 8.891 38.726 1.276 1.00 0.00 H TER 1969 WAT 3072 ATOM 1969 O WAT 3073 1.453 70.042 93.510 1.00 0.00 O ATOM 1970 H1 WAT 3073 1.164 69.155 93.295 1.00 0.00 H ATOM 1971 H2 WAT 3073 2.330 70.106 93.131 1.00 0.00 H TER 1973 WAT 3073 ATOM 1973 O WAT 3074 102.792 119.347 124.459 1.00 0.00 O ATOM 1974 H1 WAT 3074 102.893 118.478 124.071 1.00 0.00 H ATOM 1975 H2 WAT 3074 102.097 119.240 125.108 1.00 0.00 H TER 1977 WAT 3074 ATOM 1977 O WAT 3075 55.534 91.251 112.122 1.00 0.00 O ATOM 1978 H1 WAT 3075 56.400 91.021 112.459 1.00 0.00 H ATOM 1979 H2 WAT 3075 55.125 91.747 112.831 1.00 0.00 H TER 1981 WAT 3075 ATOM 1981 O WAT 3076 132.657 74.722 12.232 1.00 0.00 O ATOM 1982 H1 WAT 3076 131.766 74.506 12.509 1.00 0.00 H ATOM 1983 H2 WAT 3076 133.194 74.567 13.009 1.00 0.00 H TER 1985 WAT 3076 ATOM 1985 O WAT 3077 60.913 119.796 75.894 1.00 0.00 O ATOM 1986 H1 WAT 3077 61.225 120.180 75.075 1.00 0.00 H ATOM 1987 H2 WAT 3077 60.445 120.509 76.329 1.00 0.00 H TER 1989 WAT 3077 ATOM 1989 O WAT 3078 87.688 69.156 104.213 1.00 0.00 O ATOM 1990 H1 WAT 3078 87.594 68.246 103.933 1.00 0.00 H ATOM 1991 H2 WAT 3078 88.408 69.140 104.843 1.00 0.00 H TER 1993 WAT 3078 ATOM 1993 O WAT 3079 46.442 77.792 25.612 1.00 0.00 O ATOM 1994 H1 WAT 3079 46.622 78.592 26.106 1.00 0.00 H ATOM 1995 H2 WAT 3079 45.783 77.332 26.132 1.00 0.00 H TER 1997 WAT 3079 ATOM 1997 O WAT 3080 118.145 4.343 156.383 1.00 0.00 O ATOM 1998 H1 WAT 3080 117.327 3.871 156.538 1.00 0.00 H ATOM 1999 H2 WAT 3080 117.911 5.266 156.481 1.00 0.00 H TER 2001 WAT 3080 ATOM 2001 O WAT 3081 67.216 121.861 16.013 1.00 0.00 O ATOM 2002 H1 WAT 3081 67.844 122.275 16.606 1.00 0.00 H ATOM 2003 H2 WAT 3081 67.324 120.923 16.167 1.00 0.00 H TER 2005 WAT 3081 ATOM 2005 O WAT 3082 34.611 142.557 93.968 1.00 0.00 O ATOM 2006 H1 WAT 3082 34.936 141.749 94.366 1.00 0.00 H ATOM 2007 H2 WAT 3082 34.791 142.453 93.034 1.00 0.00 H TER 2009 WAT 3082 ATOM 2009 O WAT 3083 119.313 28.959 155.080 1.00 0.00 O ATOM 2010 H1 WAT 3083 120.202 29.098 155.408 1.00 0.00 H ATOM 2011 H2 WAT 3083 119.267 29.488 154.284 1.00 0.00 H TER 2013 WAT 3083 ATOM 2013 O WAT 3084 57.800 142.968 112.165 1.00 0.00 O ATOM 2014 H1 WAT 3084 58.100 143.630 112.788 1.00 0.00 H ATOM 2015 H2 WAT 3084 57.577 142.212 112.709 1.00 0.00 H TER 2017 WAT 3084 ATOM 2017 O WAT 3085 43.576 78.485 142.073 1.00 0.00 O ATOM 2018 H1 WAT 3085 44.332 78.893 142.494 1.00 0.00 H ATOM 2019 H2 WAT 3085 43.724 78.614 141.136 1.00 0.00 H TER 2021 WAT 3085 ATOM 2021 O WAT 3086 57.601 82.410 15.307 1.00 0.00 O ATOM 2022 H1 WAT 3086 58.356 81.825 15.363 1.00 0.00 H ATOM 2023 H2 WAT 3086 56.969 82.047 15.928 1.00 0.00 H TER 2025 WAT 3086 ATOM 2025 O WAT 3087 28.899 101.160 62.165 1.00 0.00 O ATOM 2026 H1 WAT 3087 28.975 101.305 63.108 1.00 0.00 H ATOM 2027 H2 WAT 3087 27.969 100.984 62.023 1.00 0.00 H TER 2029 WAT 3087 ATOM 2029 O WAT 3088 1.933 33.346 88.864 1.00 0.00 O ATOM 2030 H1 WAT 3088 2.331 33.361 87.993 1.00 0.00 H ATOM 2031 H2 WAT 3088 2.396 32.647 89.327 1.00 0.00 H TER 2033 WAT 3088 ATOM 2033 O WAT 3089 145.620 132.953 122.917 1.00 0.00 O ATOM 2034 H1 WAT 3089 145.257 133.576 122.288 1.00 0.00 H ATOM 2035 H2 WAT 3089 146.491 133.296 123.118 1.00 0.00 H TER 2037 WAT 3089 ATOM 2037 O WAT 3090 97.437 143.717 114.252 1.00 0.00 O ATOM 2038 H1 WAT 3090 97.495 144.420 113.605 1.00 0.00 H ATOM 2039 H2 WAT 3090 96.922 143.035 113.819 1.00 0.00 H TER 2041 WAT 3090 ATOM 2041 O WAT 3091 130.379 59.868 64.170 1.00 0.00 O ATOM 2042 H1 WAT 3091 130.959 60.626 64.242 1.00 0.00 H ATOM 2043 H2 WAT 3091 130.948 59.158 63.872 1.00 0.00 H TER 2045 WAT 3091 ATOM 2045 O WAT 3092 70.003 139.773 66.530 1.00 0.00 O ATOM 2046 H1 WAT 3092 69.763 140.301 65.769 1.00 0.00 H ATOM 2047 H2 WAT 3092 69.230 139.801 67.094 1.00 0.00 H TER 2049 WAT 3092 ATOM 2049 O WAT 3093 33.618 93.774 98.972 1.00 0.00 O ATOM 2050 H1 WAT 3093 34.073 94.532 99.338 1.00 0.00 H ATOM 2051 H2 WAT 3093 32.777 94.121 98.675 1.00 0.00 H TER 2053 WAT 3093 ATOM 2053 O WAT 3094 93.548 14.187 96.296 1.00 0.00 O ATOM 2054 H1 WAT 3094 94.335 13.762 96.637 1.00 0.00 H ATOM 2055 H2 WAT 3094 93.482 15.003 96.791 1.00 0.00 H TER 2057 WAT 3094 ATOM 2057 O WAT 3095 105.792 16.869 143.026 1.00 0.00 O ATOM 2058 H1 WAT 3095 106.211 16.486 143.797 1.00 0.00 H ATOM 2059 H2 WAT 3095 106.410 16.709 142.313 1.00 0.00 H TER 2061 WAT 3095 ATOM 2061 O WAT 3096 87.321 8.742 4.296 1.00 0.00 O ATOM 2062 H1 WAT 3096 88.132 8.290 4.063 1.00 0.00 H ATOM 2063 H2 WAT 3096 86.712 8.040 4.527 1.00 0.00 H TER 2065 WAT 3096 ATOM 2065 O WAT 3097 80.008 13.015 97.119 1.00 0.00 O ATOM 2066 H1 WAT 3097 80.778 12.506 97.372 1.00 0.00 H ATOM 2067 H2 WAT 3097 79.560 13.199 97.945 1.00 0.00 H TER 2069 WAT 3097 ATOM 2069 O WAT 3098 78.908 17.496 16.701 1.00 0.00 O ATOM 2070 H1 WAT 3098 78.544 16.919 17.372 1.00 0.00 H ATOM 2071 H2 WAT 3098 78.308 17.411 15.960 1.00 0.00 H TER 2073 WAT 3098 ATOM 2073 O WAT 3099 56.246 110.241 133.016 1.00 0.00 O ATOM 2074 H1 WAT 3099 57.202 110.184 132.998 1.00 0.00 H ATOM 2075 H2 WAT 3099 56.048 111.069 132.578 1.00 0.00 H TER 2077 WAT 3099 ATOM 2077 O WAT 3100 47.904 86.219 16.385 1.00 0.00 O ATOM 2078 H1 WAT 3100 46.992 86.273 16.099 1.00 0.00 H ATOM 2079 H2 WAT 3100 48.414 86.435 15.604 1.00 0.00 H TER 2081 WAT 3100 ATOM 2081 O WAT 3101 131.564 53.761 98.777 1.00 0.00 O ATOM 2082 H1 WAT 3101 132.170 53.685 99.514 1.00 0.00 H ATOM 2083 H2 WAT 3101 130.770 54.134 99.157 1.00 0.00 H TER 2085 WAT 3101 ATOM 2085 O WAT 3102 8.174 54.491 67.257 1.00 0.00 O ATOM 2086 H1 WAT 3102 7.293 54.810 67.454 1.00 0.00 H ATOM 2087 H2 WAT 3102 8.075 53.541 67.187 1.00 0.00 H TER 2089 WAT 3102 ATOM 2089 O WAT 3103 59.590 12.863 10.500 1.00 0.00 O ATOM 2090 H1 WAT 3103 58.748 12.473 10.265 1.00 0.00 H ATOM 2091 H2 WAT 3103 59.748 13.520 9.822 1.00 0.00 H TER 2093 WAT 3103 ATOM 2093 O WAT 3104 5.598 8.710 5.505 1.00 0.00 O ATOM 2094 H1 WAT 3104 4.709 8.805 5.846 1.00 0.00 H ATOM 2095 H2 WAT 3104 6.074 9.459 5.863 1.00 0.00 H TER 2097 WAT 3104 ATOM 2097 O WAT 3105 84.914 5.156 83.329 1.00 0.00 O ATOM 2098 H1 WAT 3105 84.239 4.573 83.675 1.00 0.00 H ATOM 2099 H2 WAT 3105 84.441 5.750 82.746 1.00 0.00 H TER 2101 WAT 3105 ATOM 2101 O WAT 3106 99.505 138.609 139.134 1.00 0.00 O ATOM 2102 H1 WAT 3106 99.727 139.527 138.984 1.00 0.00 H ATOM 2103 H2 WAT 3106 99.976 138.133 138.449 1.00 0.00 H TER 2105 WAT 3106 ATOM 2105 O WAT 3107 48.472 68.977 67.439 1.00 0.00 O ATOM 2106 H1 WAT 3107 49.285 68.557 67.719 1.00 0.00 H ATOM 2107 H2 WAT 3107 48.739 69.852 67.158 1.00 0.00 H TER 2109 WAT 3107 ATOM 2109 O WAT 3108 5.783 26.227 18.052 1.00 0.00 O ATOM 2110 H1 WAT 3108 5.871 25.608 17.327 1.00 0.00 H ATOM 2111 H2 WAT 3108 5.653 25.676 18.824 1.00 0.00 H TER 2113 WAT 3108 ATOM 2113 O WAT 3109 72.025 21.303 11.497 1.00 0.00 O ATOM 2114 H1 WAT 3109 71.669 22.083 11.072 1.00 0.00 H ATOM 2115 H2 WAT 3109 71.266 20.882 11.900 1.00 0.00 H TER 2117 WAT 3109 ATOM 2117 O WAT 3110 119.029 41.623 124.966 1.00 0.00 O ATOM 2118 H1 WAT 3110 118.858 40.734 124.655 1.00 0.00 H ATOM 2119 H2 WAT 3110 118.312 41.807 125.573 1.00 0.00 H TER 2121 WAT 3110 ATOM 2121 O WAT 3111 44.180 141.726 62.034 1.00 0.00 O ATOM 2122 H1 WAT 3111 43.776 142.574 61.846 1.00 0.00 H ATOM 2123 H2 WAT 3111 45.110 141.923 62.142 1.00 0.00 H TER 2125 WAT 3111 ATOM 2125 O WAT 3112 13.468 85.084 100.704 1.00 0.00 O ATOM 2126 H1 WAT 3112 13.467 86.032 100.842 1.00 0.00 H ATOM 2127 H2 WAT 3112 14.142 84.940 100.039 1.00 0.00 H TER 2129 WAT 3112 ATOM 2129 O WAT 3113 37.933 44.541 96.713 1.00 0.00 O ATOM 2130 H1 WAT 3113 37.345 45.296 96.685 1.00 0.00 H ATOM 2131 H2 WAT 3113 37.787 44.156 97.577 1.00 0.00 H TER 2133 WAT 3113 ATOM 2133 O WAT 3114 57.098 64.979 123.385 1.00 0.00 O ATOM 2134 H1 WAT 3114 56.289 65.004 123.895 1.00 0.00 H ATOM 2135 H2 WAT 3114 56.918 64.358 122.679 1.00 0.00 H TER 2137 WAT 3114 ATOM 2137 O WAT 3115 56.688 107.049 151.947 1.00 0.00 O ATOM 2138 H1 WAT 3115 56.079 107.031 151.209 1.00 0.00 H ATOM 2139 H2 WAT 3115 57.378 106.432 151.703 1.00 0.00 H TER 2141 WAT 3115 ATOM 2141 O WAT 3116 104.017 111.154 75.632 1.00 0.00 O ATOM 2142 H1 WAT 3116 104.473 111.953 75.368 1.00 0.00 H ATOM 2143 H2 WAT 3116 104.717 110.516 75.775 1.00 0.00 H TER 2145 WAT 3116 ATOM 2145 O WAT 3117 42.611 84.055 101.783 1.00 0.00 O ATOM 2146 H1 WAT 3117 42.300 83.458 102.463 1.00 0.00 H ATOM 2147 H2 WAT 3117 42.726 83.500 101.011 1.00 0.00 H TER 2149 WAT 3117 ATOM 2149 O WAT 3118 55.522 49.980 25.020 1.00 0.00 O ATOM 2150 H1 WAT 3118 55.403 50.865 25.365 1.00 0.00 H ATOM 2151 H2 WAT 3118 56.376 50.004 24.589 1.00 0.00 H TER 2153 WAT 3118 ATOM 2153 O WAT 3119 50.818 129.007 49.699 1.00 0.00 O ATOM 2154 H1 WAT 3119 51.333 128.338 49.248 1.00 0.00 H ATOM 2155 H2 WAT 3119 51.227 129.083 50.561 1.00 0.00 H TER 2157 WAT 3119 ATOM 2157 O WAT 3120 44.708 137.394 77.556 1.00 0.00 O ATOM 2158 H1 WAT 3120 43.922 137.839 77.873 1.00 0.00 H ATOM 2159 H2 WAT 3120 45.411 138.032 77.679 1.00 0.00 H TER 2161 WAT 3120 ATOM 2161 O WAT 3121 141.361 90.156 62.951 1.00 0.00 O ATOM 2162 H1 WAT 3121 141.165 89.364 63.452 1.00 0.00 H ATOM 2163 H2 WAT 3121 140.974 89.997 62.090 1.00 0.00 H TER 2165 WAT 3121 ATOM 2165 O WAT 3122 126.183 67.991 102.234 1.00 0.00 O ATOM 2166 H1 WAT 3122 126.285 68.655 102.915 1.00 0.00 H ATOM 2167 H2 WAT 3122 126.718 67.255 102.533 1.00 0.00 H TER 2169 WAT 3122 ATOM 2169 O WAT 3123 77.969 135.861 62.210 1.00 0.00 O ATOM 2170 H1 WAT 3123 77.427 135.177 61.817 1.00 0.00 H ATOM 2171 H2 WAT 3123 78.862 135.520 62.154 1.00 0.00 H TER 2173 WAT 3123 ATOM 2173 O WAT 3124 67.686 108.361 2.847 1.00 0.00 O ATOM 2174 H1 WAT 3124 66.851 108.037 3.187 1.00 0.00 H ATOM 2175 H2 WAT 3124 68.325 107.701 3.115 1.00 0.00 H TER 2177 WAT 3124 ATOM 2177 O WAT 3125 3.594 117.291 82.578 1.00 0.00 O ATOM 2178 H1 WAT 3125 3.302 117.616 81.726 1.00 0.00 H ATOM 2179 H2 WAT 3125 4.409 117.763 82.748 1.00 0.00 H TER 2181 WAT 3125 ATOM 2181 O WAT 3126 78.369 70.293 152.795 1.00 0.00 O ATOM 2182 H1 WAT 3126 79.002 70.916 152.437 1.00 0.00 H ATOM 2183 H2 WAT 3126 78.886 69.510 152.986 1.00 0.00 H TER 2185 WAT 3126 ATOM 2185 O WAT 3127 109.706 112.443 131.962 1.00 0.00 O ATOM 2186 H1 WAT 3127 109.171 111.858 131.425 1.00 0.00 H ATOM 2187 H2 WAT 3127 110.592 112.086 131.895 1.00 0.00 H TER 2189 WAT 3127 ATOM 2189 O WAT 3128 1.398 88.699 63.840 1.00 0.00 O ATOM 2190 H1 WAT 3128 2.015 88.949 63.152 1.00 0.00 H ATOM 2191 H2 WAT 3128 1.943 88.292 64.514 1.00 0.00 H TER 2193 WAT 3128 ATOM 2193 O WAT 3129 128.112 74.551 75.517 1.00 0.00 O ATOM 2194 H1 WAT 3129 127.338 75.114 75.493 1.00 0.00 H ATOM 2195 H2 WAT 3129 128.098 74.089 74.678 1.00 0.00 H TER 2197 WAT 3129 ATOM 2197 O WAT 3130 58.005 91.563 102.033 1.00 0.00 O ATOM 2198 H1 WAT 3130 57.450 91.056 102.625 1.00 0.00 H ATOM 2199 H2 WAT 3130 58.480 92.164 102.607 1.00 0.00 H TER 2201 WAT 3130 ATOM 2201 O WAT 3131 89.247 64.829 133.144 1.00 0.00 O ATOM 2202 H1 WAT 3131 89.262 63.898 133.368 1.00 0.00 H ATOM 2203 H2 WAT 3131 88.375 65.124 133.409 1.00 0.00 H TER 2205 WAT 3131 ATOM 2205 O WAT 3132 81.841 14.240 138.429 1.00 0.00 O ATOM 2206 H1 WAT 3132 81.184 14.386 139.110 1.00 0.00 H ATOM 2207 H2 WAT 3132 82.520 13.720 138.860 1.00 0.00 H TER 2209 WAT 3132 ATOM 2209 O WAT 3133 108.803 22.659 69.730 1.00 0.00 O ATOM 2210 H1 WAT 3133 108.480 21.953 70.289 1.00 0.00 H ATOM 2211 H2 WAT 3133 108.035 22.942 69.234 1.00 0.00 H TER 2213 WAT 3133 ATOM 2213 O WAT 3134 79.654 70.928 101.372 1.00 0.00 O ATOM 2214 H1 WAT 3134 78.920 71.235 100.841 1.00 0.00 H ATOM 2215 H2 WAT 3134 80.252 71.675 101.410 1.00 0.00 H TER 2217 WAT 3134 ATOM 2217 O WAT 3135 129.102 110.066 155.382 1.00 0.00 O ATOM 2218 H1 WAT 3135 128.605 109.788 154.613 1.00 0.00 H ATOM 2219 H2 WAT 3135 128.729 109.559 156.104 1.00 0.00 H TER 2221 WAT 3135 ATOM 2221 O WAT 3136 112.785 96.639 87.762 1.00 0.00 O ATOM 2222 H1 WAT 3136 113.707 96.891 87.704 1.00 0.00 H ATOM 2223 H2 WAT 3136 112.372 97.353 88.248 1.00 0.00 H TER 2225 WAT 3136 ATOM 2225 O WAT 3137 119.699 39.717 101.771 1.00 0.00 O ATOM 2226 H1 WAT 3137 119.690 39.343 100.890 1.00 0.00 H ATOM 2227 H2 WAT 3137 120.263 39.130 102.275 1.00 0.00 H TER 2229 WAT 3137 ATOM 2229 O WAT 3138 66.959 37.687 128.735 1.00 0.00 O ATOM 2230 H1 WAT 3138 66.552 38.552 128.757 1.00 0.00 H ATOM 2231 H2 WAT 3138 66.888 37.366 129.634 1.00 0.00 H TER 2233 WAT 3138 ATOM 2233 O WAT 3139 2.040 17.335 115.441 1.00 0.00 O ATOM 2234 H1 WAT 3139 1.565 16.990 116.197 1.00 0.00 H ATOM 2235 H2 WAT 3139 2.451 18.138 115.763 1.00 0.00 H TER 2237 WAT 3139 ATOM 2237 O WAT 3140 102.873 13.066 150.039 1.00 0.00 O ATOM 2238 H1 WAT 3140 103.261 13.531 150.781 1.00 0.00 H ATOM 2239 H2 WAT 3140 102.178 12.535 150.427 1.00 0.00 H TER 2241 WAT 3140 ATOM 2241 O WAT 3141 45.151 75.821 20.555 1.00 0.00 O ATOM 2242 H1 WAT 3141 44.371 75.317 20.789 1.00 0.00 H ATOM 2243 H2 WAT 3141 45.218 76.488 21.238 1.00 0.00 H TER 2245 WAT 3141 ATOM 2245 O WAT 3142 4.514 125.359 111.113 1.00 0.00 O ATOM 2246 H1 WAT 3142 4.418 125.111 112.032 1.00 0.00 H ATOM 2247 H2 WAT 3142 4.535 124.527 110.641 1.00 0.00 H TER 2249 WAT 3142 ATOM 2249 O WAT 3143 30.332 14.818 19.128 1.00 0.00 O ATOM 2250 H1 WAT 3143 31.124 14.284 19.067 1.00 0.00 H ATOM 2251 H2 WAT 3143 30.446 15.493 18.460 1.00 0.00 H TER 2253 WAT 3143 ATOM 2253 O WAT 3144 84.516 110.074 64.652 1.00 0.00 O ATOM 2254 H1 WAT 3144 84.496 110.939 64.243 1.00 0.00 H ATOM 2255 H2 WAT 3144 85.351 110.051 65.121 1.00 0.00 H TER 2257 WAT 3144 ATOM 2257 O WAT 3145 77.178 99.298 134.067 1.00 0.00 O ATOM 2258 H1 WAT 3145 77.460 98.495 134.504 1.00 0.00 H ATOM 2259 H2 WAT 3145 77.682 99.319 133.254 1.00 0.00 H TER 2261 WAT 3145 ATOM 2261 O WAT 3146 30.749 52.394 19.560 1.00 0.00 O ATOM 2262 H1 WAT 3146 29.965 52.058 19.994 1.00 0.00 H ATOM 2263 H2 WAT 3146 31.226 52.856 20.250 1.00 0.00 H TER 2265 WAT 3146 ATOM 2265 O WAT 3147 81.467 16.041 155.396 1.00 0.00 O ATOM 2266 H1 WAT 3147 82.068 16.783 155.466 1.00 0.00 H ATOM 2267 H2 WAT 3147 80.709 16.297 155.922 1.00 0.00 H TER 2269 WAT 3147 ATOM 2269 O WAT 3148 44.359 71.629 128.853 1.00 0.00 O ATOM 2270 H1 WAT 3148 44.031 70.795 128.516 1.00 0.00 H ATOM 2271 H2 WAT 3148 43.578 72.083 129.169 1.00 0.00 H TER 2273 WAT 3148 ATOM 2273 O WAT 3149 3.345 57.146 129.554 1.00 0.00 O ATOM 2274 H1 WAT 3149 3.466 57.682 130.338 1.00 0.00 H ATOM 2275 H2 WAT 3149 3.299 57.778 128.837 1.00 0.00 H TER 2277 WAT 3149 ATOM 2277 O WAT 3150 121.370 145.547 4.819 1.00 0.00 O ATOM 2278 H1 WAT 3150 120.578 146.084 4.804 1.00 0.00 H ATOM 2279 H2 WAT 3150 121.149 144.811 5.390 1.00 0.00 H TER 2281 WAT 3150 ATOM 2281 O WAT 3151 123.166 11.902 60.051 1.00 0.00 O ATOM 2282 H1 WAT 3151 122.616 11.149 60.270 1.00 0.00 H ATOM 2283 H2 WAT 3151 124.051 11.632 60.298 1.00 0.00 H TER 2285 WAT 3151 ATOM 2285 O WAT 3152 0.853 25.185 67.684 1.00 0.00 O ATOM 2286 H1 WAT 3152 1.227 25.970 67.282 1.00 0.00 H ATOM 2287 H2 WAT 3152 0.024 25.053 67.224 1.00 0.00 H TER 2289 WAT 3152 ATOM 2289 O WAT 3153 0.952 120.474 118.125 1.00 0.00 O ATOM 2290 H1 WAT 3153 1.429 121.085 118.686 1.00 0.00 H ATOM 2291 H2 WAT 3153 0.226 120.988 117.773 1.00 0.00 H TER 2293 WAT 3153 ATOM 2293 O WAT 3154 1.088 139.833 23.146 1.00 0.00 O ATOM 2294 H1 WAT 3154 1.292 139.440 23.995 1.00 0.00 H ATOM 2295 H2 WAT 3154 0.780 140.715 23.358 1.00 0.00 H TER 2297 WAT 3154 ATOM 2297 O WAT 3155 139.024 114.351 138.771 1.00 0.00 O ATOM 2298 H1 WAT 3155 138.371 114.533 139.447 1.00 0.00 H ATOM 2299 H2 WAT 3155 139.318 113.459 138.955 1.00 0.00 H TER 2301 WAT 3155 ATOM 2301 O WAT 3156 23.514 121.863 107.884 1.00 0.00 O ATOM 2302 H1 WAT 3156 22.980 121.488 107.184 1.00 0.00 H ATOM 2303 H2 WAT 3156 23.557 121.175 108.548 1.00 0.00 H TER 2305 WAT 3156 ATOM 2305 O WAT 3157 43.739 144.053 121.500 1.00 0.00 O ATOM 2306 H1 WAT 3157 43.732 144.846 120.964 1.00 0.00 H ATOM 2307 H2 WAT 3157 44.557 144.107 121.995 1.00 0.00 H TER 2309 WAT 3157 ATOM 2309 O WAT 3158 102.897 121.483 9.495 1.00 0.00 O ATOM 2310 H1 WAT 3158 103.717 121.051 9.255 1.00 0.00 H ATOM 2311 H2 WAT 3158 102.254 120.775 9.526 1.00 0.00 H TER 2313 WAT 3158 ATOM 2313 O WAT 3159 128.328 23.505 99.050 1.00 0.00 O ATOM 2314 H1 WAT 3159 128.755 23.355 98.206 1.00 0.00 H ATOM 2315 H2 WAT 3159 129.023 23.849 99.612 1.00 0.00 H TER 2317 WAT 3159 ATOM 2317 O WAT 3160 125.498 84.904 63.250 1.00 0.00 O ATOM 2318 H1 WAT 3160 125.015 85.169 64.033 1.00 0.00 H ATOM 2319 H2 WAT 3160 125.855 84.043 63.468 1.00 0.00 H TER 2321 WAT 3160 ATOM 2321 O WAT 3161 47.157 38.042 104.971 1.00 0.00 O ATOM 2322 H1 WAT 3161 48.030 38.387 104.784 1.00 0.00 H ATOM 2323 H2 WAT 3161 46.560 38.734 104.686 1.00 0.00 H TER 2325 WAT 3161 ATOM 2325 O WAT 3162 135.063 100.162 126.795 1.00 0.00 O ATOM 2326 H1 WAT 3162 135.339 100.445 127.667 1.00 0.00 H ATOM 2327 H2 WAT 3162 135.481 100.783 126.198 1.00 0.00 H TER 2329 WAT 3162 ATOM 2329 O WAT 3163 23.971 16.857 61.723 1.00 0.00 O ATOM 2330 H1 WAT 3163 24.182 15.975 62.029 1.00 0.00 H ATOM 2331 H2 WAT 3163 24.685 17.080 61.125 1.00 0.00 H TER 2333 WAT 3163 ATOM 2333 O WAT 3164 92.290 73.935 93.351 1.00 0.00 O ATOM 2334 H1 WAT 3164 91.349 73.762 93.345 1.00 0.00 H ATOM 2335 H2 WAT 3164 92.546 73.837 94.268 1.00 0.00 H TER 2337 WAT 3164 ATOM 2337 O WAT 3165 143.956 0.376 154.231 1.00 0.00 O ATOM 2338 H1 WAT 3165 143.053 0.671 154.349 1.00 0.00 H ATOM 2339 H2 WAT 3165 143.971 -0.504 154.606 1.00 0.00 H TER 2341 WAT 3165 ATOM 2341 O WAT 3166 134.343 139.248 100.052 1.00 0.00 O ATOM 2342 H1 WAT 3166 134.171 139.891 100.740 1.00 0.00 H ATOM 2343 H2 WAT 3166 134.870 138.574 100.481 1.00 0.00 H TER 2345 WAT 3166 ATOM 2345 O WAT 3167 132.919 21.306 107.068 1.00 0.00 O ATOM 2346 H1 WAT 3167 133.339 20.702 106.456 1.00 0.00 H ATOM 2347 H2 WAT 3167 133.237 22.170 106.808 1.00 0.00 H TER 2349 WAT 3167 ATOM 2349 O WAT 3168 79.162 54.895 59.953 1.00 0.00 O ATOM 2350 H1 WAT 3168 78.718 55.697 59.679 1.00 0.00 H ATOM 2351 H2 WAT 3168 79.753 55.176 60.652 1.00 0.00 H TER 2353 WAT 3168 ATOM 2353 O WAT 3169 32.965 109.904 20.238 1.00 0.00 O ATOM 2354 H1 WAT 3169 33.104 109.755 19.303 1.00 0.00 H ATOM 2355 H2 WAT 3169 33.291 110.791 20.391 1.00 0.00 H TER 2357 WAT 3169 ATOM 2357 O WAT 3170 40.639 58.846 153.586 1.00 0.00 O ATOM 2358 H1 WAT 3170 39.699 58.780 153.419 1.00 0.00 H ATOM 2359 H2 WAT 3170 40.733 58.633 154.514 1.00 0.00 H TER 2361 WAT 3170 ATOM 2361 O WAT 3171 64.122 45.364 108.707 1.00 0.00 O ATOM 2362 H1 WAT 3171 64.048 45.252 107.759 1.00 0.00 H ATOM 2363 H2 WAT 3171 65.046 45.201 108.896 1.00 0.00 H TER 2365 WAT 3171 ATOM 2365 O WAT 3172 104.745 120.714 69.150 1.00 0.00 O ATOM 2366 H1 WAT 3172 105.305 120.170 69.703 1.00 0.00 H ATOM 2367 H2 WAT 3172 104.833 121.595 69.512 1.00 0.00 H TER 2369 WAT 3172 ATOM 2369 O WAT 3173 90.663 21.600 119.037 1.00 0.00 O ATOM 2370 H1 WAT 3173 90.648 22.200 118.291 1.00 0.00 H ATOM 2371 H2 WAT 3173 91.333 21.958 119.619 1.00 0.00 H TER 2373 WAT 3173 ATOM 2373 O WAT 3174 85.978 99.702 70.106 1.00 0.00 O ATOM 2374 H1 WAT 3174 86.061 98.852 69.673 1.00 0.00 H ATOM 2375 H2 WAT 3174 85.375 99.543 70.832 1.00 0.00 H TER 2377 WAT 3174 ATOM 2377 O WAT 3175 105.685 40.006 155.471 1.00 0.00 O ATOM 2378 H1 WAT 3175 105.277 40.656 156.042 1.00 0.00 H ATOM 2379 H2 WAT 3175 106.605 40.267 155.429 1.00 0.00 H TER 2381 WAT 3175 ATOM 2381 O WAT 3176 99.016 53.697 10.419 1.00 0.00 O ATOM 2382 H1 WAT 3176 99.196 52.789 10.173 1.00 0.00 H ATOM 2383 H2 WAT 3176 98.237 53.645 10.973 1.00 0.00 H TER 2385 WAT 3176 ATOM 2385 O WAT 3177 70.660 47.843 63.036 1.00 0.00 O ATOM 2386 H1 WAT 3177 71.444 48.227 62.645 1.00 0.00 H ATOM 2387 H2 WAT 3177 69.938 48.368 62.691 1.00 0.00 H TER 2389 WAT 3177 ATOM 2389 O WAT 3178 133.407 50.295 20.554 1.00 0.00 O ATOM 2390 H1 WAT 3178 133.206 50.352 21.488 1.00 0.00 H ATOM 2391 H2 WAT 3178 134.030 49.571 20.487 1.00 0.00 H TER 2393 WAT 3178 ATOM 2393 O WAT 3179 120.013 25.767 132.839 1.00 0.00 O ATOM 2394 H1 WAT 3179 120.245 25.904 131.921 1.00 0.00 H ATOM 2395 H2 WAT 3179 120.798 26.021 133.325 1.00 0.00 H TER 2397 WAT 3179 ATOM 2397 O WAT 3180 69.276 122.003 68.151 1.00 0.00 O ATOM 2398 H1 WAT 3180 68.544 122.413 68.613 1.00 0.00 H ATOM 2399 H2 WAT 3180 68.896 121.690 67.330 1.00 0.00 H TER 2401 WAT 3180 ATOM 2401 O WAT 3181 36.760 112.857 123.432 1.00 0.00 O ATOM 2402 H1 WAT 3181 36.405 113.413 124.125 1.00 0.00 H ATOM 2403 H2 WAT 3181 37.573 112.508 123.799 1.00 0.00 H TER 2405 WAT 3181 ATOM 2405 O WAT 3182 51.197 91.262 125.567 1.00 0.00 O ATOM 2406 H1 WAT 3182 50.776 91.275 126.426 1.00 0.00 H ATOM 2407 H2 WAT 3182 51.463 92.170 125.417 1.00 0.00 H TER 2409 WAT 3182 ATOM 2409 O WAT 3183 115.672 111.749 151.634 1.00 0.00 O ATOM 2410 H1 WAT 3183 116.185 111.426 150.893 1.00 0.00 H ATOM 2411 H2 WAT 3183 116.050 112.607 151.830 1.00 0.00 H TER 2413 WAT 3183 ATOM 2413 O WAT 3184 87.479 138.388 131.335 1.00 0.00 O ATOM 2414 H1 WAT 3184 86.526 138.302 131.305 1.00 0.00 H ATOM 2415 H2 WAT 3184 87.644 139.306 131.120 1.00 0.00 H TER 2417 WAT 3184 ATOM 2417 O WAT 3185 11.493 56.536 132.007 1.00 0.00 O ATOM 2418 H1 WAT 3185 11.236 56.117 131.186 1.00 0.00 H ATOM 2419 H2 WAT 3185 11.193 55.933 132.688 1.00 0.00 H TER 2421 WAT 3185 ATOM 2421 O WAT 3186 13.783 87.103 112.625 1.00 0.00 O ATOM 2422 H1 WAT 3186 14.531 86.518 112.503 1.00 0.00 H ATOM 2423 H2 WAT 3186 13.256 86.680 113.303 1.00 0.00 H TER 2425 WAT 3186 ATOM 2425 O WAT 3187 5.158 104.562 92.785 1.00 0.00 O ATOM 2426 H1 WAT 3187 4.510 105.267 92.802 1.00 0.00 H ATOM 2427 H2 WAT 3187 4.803 103.897 93.375 1.00 0.00 H TER 2429 WAT 3187 ATOM 2429 O WAT 3188 52.632 54.033 19.882 1.00 0.00 O ATOM 2430 H1 WAT 3188 51.686 53.913 19.803 1.00 0.00 H ATOM 2431 H2 WAT 3188 52.773 54.217 20.811 1.00 0.00 H TER 2433 WAT 3188 ATOM 2433 O WAT 3189 16.771 82.048 89.684 1.00 0.00 O ATOM 2434 H1 WAT 3189 16.499 82.645 90.381 1.00 0.00 H ATOM 2435 H2 WAT 3189 16.291 82.346 88.912 1.00 0.00 H TER 2437 WAT 3189 ATOM 2437 O WAT 3190 129.342 101.486 139.609 1.00 0.00 O ATOM 2438 H1 WAT 3190 128.707 102.200 139.552 1.00 0.00 H ATOM 2439 H2 WAT 3190 129.207 101.114 140.480 1.00 0.00 H TER 2441 WAT 3190 ATOM 2441 O WAT 3191 71.534 124.626 155.126 1.00 0.00 O ATOM 2442 H1 WAT 3191 72.207 124.888 155.754 1.00 0.00 H ATOM 2443 H2 WAT 3191 71.810 125.023 154.300 1.00 0.00 H TER 2445 WAT 3191 ATOM 2445 O WAT 3192 135.699 136.852 147.326 1.00 0.00 O ATOM 2446 H1 WAT 3192 135.760 136.722 146.380 1.00 0.00 H ATOM 2447 H2 WAT 3192 136.501 137.322 147.556 1.00 0.00 H TER 2449 WAT 3192 ATOM 2449 O WAT 3193 109.241 101.467 111.135 1.00 0.00 O ATOM 2450 H1 WAT 3193 109.403 101.381 110.195 1.00 0.00 H ATOM 2451 H2 WAT 3193 108.472 102.034 111.194 1.00 0.00 H TER 2453 WAT 3193 ATOM 2453 O WAT 3194 61.644 138.835 119.220 1.00 0.00 O ATOM 2454 H1 WAT 3194 60.891 138.886 118.631 1.00 0.00 H ATOM 2455 H2 WAT 3194 61.536 139.578 119.813 1.00 0.00 H TER 2457 WAT 3194 ATOM 2457 O WAT 3195 46.089 143.761 153.204 1.00 0.00 O ATOM 2458 H1 WAT 3195 46.350 143.332 152.389 1.00 0.00 H ATOM 2459 H2 WAT 3195 46.836 143.638 153.790 1.00 0.00 H TER 2461 WAT 3195 ATOM 2461 O WAT 3196 58.384 29.915 122.476 1.00 0.00 O ATOM 2462 H1 WAT 3196 59.244 29.773 122.872 1.00 0.00 H ATOM 2463 H2 WAT 3196 58.487 29.626 121.569 1.00 0.00 H TER 2465 WAT 3196 ATOM 2465 O WAT 3197 124.299 65.895 118.402 1.00 0.00 O ATOM 2466 H1 WAT 3197 124.308 66.649 117.813 1.00 0.00 H ATOM 2467 H2 WAT 3197 125.007 66.066 119.022 1.00 0.00 H TER 2469 WAT 3197 ATOM 2469 O WAT 3198 8.786 99.232 82.596 1.00 0.00 O ATOM 2470 H1 WAT 3198 9.133 99.166 81.706 1.00 0.00 H ATOM 2471 H2 WAT 3198 8.059 98.610 82.617 1.00 0.00 H TER 2473 WAT 3198 ATOM 2473 O WAT 3199 34.235 131.890 5.592 1.00 0.00 O ATOM 2474 H1 WAT 3199 34.164 132.392 6.404 1.00 0.00 H ATOM 2475 H2 WAT 3199 33.432 131.371 5.560 1.00 0.00 H TER 2477 WAT 3199 ATOM 2477 O WAT 3200 93.768 114.369 77.547 1.00 0.00 O ATOM 2478 H1 WAT 3200 94.260 114.256 78.361 1.00 0.00 H ATOM 2479 H2 WAT 3200 93.030 113.765 77.628 1.00 0.00 H TER 2481 WAT 3200 ATOM 2481 O WAT 3201 58.818 96.171 18.977 1.00 0.00 O ATOM 2482 H1 WAT 3201 58.803 97.127 18.942 1.00 0.00 H ATOM 2483 H2 WAT 3201 58.956 95.967 19.902 1.00 0.00 H TER 2485 WAT 3201 ATOM 2485 O WAT 3202 107.461 111.487 27.990 1.00 0.00 O ATOM 2486 H1 WAT 3202 106.946 110.726 28.259 1.00 0.00 H ATOM 2487 H2 WAT 3202 107.137 112.201 28.539 1.00 0.00 H TER 2489 WAT 3202 ATOM 2489 O WAT 3203 86.455 122.259 136.416 1.00 0.00 O ATOM 2490 H1 WAT 3203 86.607 122.382 135.479 1.00 0.00 H ATOM 2491 H2 WAT 3203 87.257 122.575 136.832 1.00 0.00 H TER 2493 WAT 3203 ATOM 2493 O WAT 3204 17.192 4.486 8.946 1.00 0.00 O ATOM 2494 H1 WAT 3204 17.556 5.320 9.244 1.00 0.00 H ATOM 2495 H2 WAT 3204 17.006 4.624 8.017 1.00 0.00 H TER 2497 WAT 3204 ATOM 2497 O WAT 3205 4.114 106.799 105.428 1.00 0.00 O ATOM 2498 H1 WAT 3205 3.177 106.680 105.275 1.00 0.00 H ATOM 2499 H2 WAT 3205 4.387 107.430 104.761 1.00 0.00 H TER 2501 WAT 3205 ATOM 2501 O WAT 3206 25.238 119.166 112.918 1.00 0.00 O ATOM 2502 H1 WAT 3206 24.988 119.345 113.824 1.00 0.00 H ATOM 2503 H2 WAT 3206 26.190 119.263 112.909 1.00 0.00 H TER 2505 WAT 3206 ATOM 2505 O WAT 3207 56.742 122.872 158.076 1.00 0.00 O ATOM 2506 H1 WAT 3207 56.524 122.291 158.805 1.00 0.00 H ATOM 2507 H2 WAT 3207 56.087 123.568 158.119 1.00 0.00 H TER 2509 WAT 3207 ATOM 2509 O WAT 3208 13.594 125.341 62.180 1.00 0.00 O ATOM 2510 H1 WAT 3208 12.787 125.820 62.367 1.00 0.00 H ATOM 2511 H2 WAT 3208 14.203 126.010 61.869 1.00 0.00 H TER 2513 WAT 3208 ATOM 2513 O WAT 3209 54.773 83.763 124.771 1.00 0.00 O ATOM 2514 H1 WAT 3209 55.563 83.501 124.298 1.00 0.00 H ATOM 2515 H2 WAT 3209 54.822 84.718 124.810 1.00 0.00 H TER 2517 WAT 3209 ATOM 2517 O WAT 3210 12.764 30.994 63.130 1.00 0.00 O ATOM 2518 H1 WAT 3210 13.652 31.080 62.783 1.00 0.00 H ATOM 2519 H2 WAT 3210 12.197 31.267 62.409 1.00 0.00 H TER 2521 WAT 3210 ATOM 2521 O WAT 3211 90.702 28.596 102.653 1.00 0.00 O ATOM 2522 H1 WAT 3211 90.497 29.478 102.964 1.00 0.00 H ATOM 2523 H2 WAT 3211 91.618 28.646 102.379 1.00 0.00 H TER 2525 WAT 3211 ATOM 2525 O WAT 3212 67.039 126.648 107.723 1.00 0.00 O ATOM 2526 H1 WAT 3212 66.175 127.050 107.809 1.00 0.00 H ATOM 2527 H2 WAT 3212 66.980 125.840 108.233 1.00 0.00 H TER 2529 WAT 3212 ATOM 2529 O WAT 3213 2.210 109.892 136.048 1.00 0.00 O ATOM 2530 H1 WAT 3213 1.320 110.246 136.041 1.00 0.00 H ATOM 2531 H2 WAT 3213 2.132 109.041 135.618 1.00 0.00 H TER 2533 WAT 3213 ATOM 2533 O WAT 3214 59.356 22.056 121.785 1.00 0.00 O ATOM 2534 H1 WAT 3214 59.515 21.143 121.546 1.00 0.00 H ATOM 2535 H2 WAT 3214 58.661 22.014 122.442 1.00 0.00 H TER 2537 WAT 3214 ATOM 2537 O WAT 3215 56.201 3.738 78.505 1.00 0.00 O ATOM 2538 H1 WAT 3215 55.379 3.352 78.809 1.00 0.00 H ATOM 2539 H2 WAT 3215 56.491 3.159 77.800 1.00 0.00 H TER 2541 WAT 3215 ATOM 2541 O WAT 3216 76.842 9.895 131.096 1.00 0.00 O ATOM 2542 H1 WAT 3216 76.442 10.749 131.260 1.00 0.00 H ATOM 2543 H2 WAT 3216 76.986 9.876 130.150 1.00 0.00 H TER 2545 WAT 3216 ATOM 2545 O WAT 3217 136.650 77.392 16.949 1.00 0.00 O ATOM 2546 H1 WAT 3217 135.976 77.199 16.298 1.00 0.00 H ATOM 2547 H2 WAT 3217 136.289 78.116 17.460 1.00 0.00 H TER 2549 WAT 3217 ATOM 2549 O WAT 3218 105.650 37.273 103.387 1.00 0.00 O ATOM 2550 H1 WAT 3218 104.853 37.192 102.863 1.00 0.00 H ATOM 2551 H2 WAT 3218 106.360 37.266 102.745 1.00 0.00 H TER 2553 WAT 3218 ATOM 2553 O WAT 3219 142.833 26.567 143.561 1.00 0.00 O ATOM 2554 H1 WAT 3219 143.459 26.872 144.217 1.00 0.00 H ATOM 2555 H2 WAT 3219 142.144 27.231 143.559 1.00 0.00 H TER 2557 WAT 3219 ATOM 2557 O WAT 3220 104.081 141.832 114.593 1.00 0.00 O ATOM 2558 H1 WAT 3220 104.258 141.287 115.360 1.00 0.00 H ATOM 2559 H2 WAT 3220 103.585 142.575 114.936 1.00 0.00 H TER 2561 WAT 3220 ATOM 2561 O WAT 3221 52.845 85.831 119.155 1.00 0.00 O ATOM 2562 H1 WAT 3221 51.935 85.883 118.862 1.00 0.00 H ATOM 2563 H2 WAT 3221 53.344 85.657 118.357 1.00 0.00 H TER 2565 WAT 3221 ATOM 2565 O WAT 3222 105.251 137.984 83.743 1.00 0.00 O ATOM 2566 H1 WAT 3222 104.588 138.662 83.617 1.00 0.00 H ATOM 2567 H2 WAT 3222 104.833 137.345 84.321 1.00 0.00 H TER 2569 WAT 3222 ATOM 2569 O WAT 3223 22.396 37.078 96.573 1.00 0.00 O ATOM 2570 H1 WAT 3223 22.405 37.054 95.616 1.00 0.00 H ATOM 2571 H2 WAT 3223 23.214 36.653 96.831 1.00 0.00 H TER 2573 WAT 3223 ATOM 2573 O WAT 3224 51.814 48.597 148.922 1.00 0.00 O ATOM 2574 H1 WAT 3224 52.030 49.124 148.153 1.00 0.00 H ATOM 2575 H2 WAT 3224 52.162 47.728 148.722 1.00 0.00 H TER 2577 WAT 3224 ATOM 2577 O WAT 3225 8.952 43.052 128.947 1.00 0.00 O ATOM 2578 H1 WAT 3225 9.902 43.007 129.050 1.00 0.00 H ATOM 2579 H2 WAT 3225 8.610 42.953 129.836 1.00 0.00 H TER 2581 WAT 3225 ATOM 2581 O WAT 3226 121.422 46.672 118.673 1.00 0.00 O ATOM 2582 H1 WAT 3226 120.682 46.167 118.336 1.00 0.00 H ATOM 2583 H2 WAT 3226 121.683 47.231 117.941 1.00 0.00 H TER 2585 WAT 3226 ATOM 2585 O WAT 3227 131.699 24.708 12.888 1.00 0.00 O ATOM 2586 H1 WAT 3227 130.980 24.190 12.525 1.00 0.00 H ATOM 2587 H2 WAT 3227 132.249 24.069 13.342 1.00 0.00 H TER 2589 WAT 3227 ATOM 2589 O WAT 3228 112.529 32.320 10.374 1.00 0.00 O ATOM 2590 H1 WAT 3228 112.731 32.769 11.195 1.00 0.00 H ATOM 2591 H2 WAT 3228 111.622 32.030 10.476 1.00 0.00 H TER 2593 WAT 3228 ATOM 2593 O WAT 3229 17.748 139.773 2.880 1.00 0.00 O ATOM 2594 H1 WAT 3229 17.184 139.095 3.251 1.00 0.00 H ATOM 2595 H2 WAT 3229 18.539 139.749 3.419 1.00 0.00 H TER 2597 WAT 3229 ATOM 2597 O WAT 3230 23.615 44.029 140.092 1.00 0.00 O ATOM 2598 H1 WAT 3230 23.360 43.406 139.411 1.00 0.00 H ATOM 2599 H2 WAT 3230 24.205 44.639 139.650 1.00 0.00 H TER 2601 WAT 3230 ATOM 2601 O WAT 3231 111.509 13.021 80.222 1.00 0.00 O ATOM 2602 H1 WAT 3231 111.969 13.210 79.403 1.00 0.00 H ATOM 2603 H2 WAT 3231 111.233 12.108 80.136 1.00 0.00 H TER 2605 WAT 3231 ATOM 2605 O WAT 3232 95.286 33.767 17.229 1.00 0.00 O ATOM 2606 H1 WAT 3232 95.401 32.898 16.845 1.00 0.00 H ATOM 2607 H2 WAT 3232 95.228 34.356 16.477 1.00 0.00 H TER 2609 WAT 3232 ATOM 2609 O WAT 3233 110.808 105.680 12.438 1.00 0.00 O ATOM 2610 H1 WAT 3233 111.130 105.255 11.643 1.00 0.00 H ATOM 2611 H2 WAT 3233 110.883 105.008 13.116 1.00 0.00 H TER 2613 WAT 3233 ATOM 2613 O WAT 3234 113.065 82.034 128.256 1.00 0.00 O ATOM 2614 H1 WAT 3234 112.401 81.784 128.899 1.00 0.00 H ATOM 2615 H2 WAT 3234 112.805 81.580 127.454 1.00 0.00 H TER 2617 WAT 3234 ATOM 2617 O WAT 3235 95.537 32.375 150.749 1.00 0.00 O ATOM 2618 H1 WAT 3235 95.000 32.448 149.960 1.00 0.00 H ATOM 2619 H2 WAT 3235 94.942 32.026 151.412 1.00 0.00 H TER 2621 WAT 3235 ATOM 2621 O WAT 3236 98.473 144.777 82.096 1.00 0.00 O ATOM 2622 H1 WAT 3236 97.573 144.508 82.280 1.00 0.00 H ATOM 2623 H2 WAT 3236 98.519 144.820 81.141 1.00 0.00 H TER 2625 WAT 3236 ATOM 2625 O WAT 3237 86.503 38.185 95.741 1.00 0.00 O ATOM 2626 H1 WAT 3237 87.065 38.698 96.321 1.00 0.00 H ATOM 2627 H2 WAT 3237 85.974 38.837 95.281 1.00 0.00 H TER 2629 WAT 3237 ATOM 2629 O WAT 3238 102.793 91.791 85.349 1.00 0.00 O ATOM 2630 H1 WAT 3238 102.607 90.899 85.645 1.00 0.00 H ATOM 2631 H2 WAT 3238 103.148 92.230 86.121 1.00 0.00 H TER 2633 WAT 3238 ATOM 2633 O WAT 3239 135.862 12.973 138.835 1.00 0.00 O ATOM 2634 H1 WAT 3239 136.424 13.706 139.088 1.00 0.00 H ATOM 2635 H2 WAT 3239 136.455 12.224 138.778 1.00 0.00 H TER 2637 WAT 3239 ATOM 2637 O WAT 3240 54.618 40.229 141.189 1.00 0.00 O ATOM 2638 H1 WAT 3240 53.810 40.666 140.918 1.00 0.00 H ATOM 2639 H2 WAT 3240 55.310 40.855 140.977 1.00 0.00 H TER 2641 WAT 3240 ATOM 2641 O WAT 3241 20.298 56.500 123.737 1.00 0.00 O ATOM 2642 H1 WAT 3241 20.934 56.995 124.253 1.00 0.00 H ATOM 2643 H2 WAT 3241 19.472 56.608 124.209 1.00 0.00 H TER 2645 WAT 3241 ATOM 2645 O WAT 3242 12.158 69.971 144.124 1.00 0.00 O ATOM 2646 H1 WAT 3242 11.801 70.859 144.160 1.00 0.00 H ATOM 2647 H2 WAT 3242 12.180 69.685 145.037 1.00 0.00 H TER 2649 WAT 3242 ATOM 2649 O WAT 3243 80.292 65.046 135.299 1.00 0.00 O ATOM 2650 H1 WAT 3243 79.656 64.924 134.595 1.00 0.00 H ATOM 2651 H2 WAT 3243 80.070 65.896 135.679 1.00 0.00 H TER 2653 WAT 3243 ATOM 2653 O WAT 3244 93.645 18.712 81.342 1.00 0.00 O ATOM 2654 H1 WAT 3244 93.904 18.402 80.475 1.00 0.00 H ATOM 2655 H2 WAT 3244 94.157 18.178 81.950 1.00 0.00 H TER 2657 WAT 3244 ATOM 2657 O WAT 3245 131.437 46.639 69.944 1.00 0.00 O ATOM 2658 H1 WAT 3245 130.882 46.670 69.166 1.00 0.00 H ATOM 2659 H2 WAT 3245 131.021 45.988 70.510 1.00 0.00 H TER 2661 WAT 3245 ATOM 2661 O WAT 3246 6.809 50.705 155.790 1.00 0.00 O ATOM 2662 H1 WAT 3246 6.716 49.887 155.301 1.00 0.00 H ATOM 2663 H2 WAT 3246 7.611 50.589 156.300 1.00 0.00 H TER 2665 WAT 3246 ATOM 2665 O WAT 3247 31.783 112.937 131.124 1.00 0.00 O ATOM 2666 H1 WAT 3247 31.670 112.802 130.183 1.00 0.00 H ATOM 2667 H2 WAT 3247 31.465 113.827 131.278 1.00 0.00 H TER 2669 WAT 3247 ATOM 2669 O WAT 3248 69.291 73.325 98.235 1.00 0.00 O ATOM 2670 H1 WAT 3248 69.472 74.063 98.816 1.00 0.00 H ATOM 2671 H2 WAT 3248 70.015 73.329 97.609 1.00 0.00 H TER 2673 WAT 3248 ATOM 2673 O WAT 3249 30.804 5.574 129.367 1.00 0.00 O ATOM 2674 H1 WAT 3249 31.299 5.027 129.977 1.00 0.00 H ATOM 2675 H2 WAT 3249 31.456 5.882 128.738 1.00 0.00 H TER 2677 WAT 3249 ATOM 2677 O WAT 3250 112.741 142.118 71.649 1.00 0.00 O ATOM 2678 H1 WAT 3250 113.396 141.603 71.177 1.00 0.00 H ATOM 2679 H2 WAT 3250 112.507 141.575 72.401 1.00 0.00 H TER 2681 WAT 3250 ATOM 2681 O WAT 3251 112.174 98.970 14.019 1.00 0.00 O ATOM 2682 H1 WAT 3251 112.596 98.597 14.793 1.00 0.00 H ATOM 2683 H2 WAT 3251 111.483 98.345 13.799 1.00 0.00 H TER 2685 WAT 3251 ATOM 2685 O WAT 3252 85.844 51.846 118.126 1.00 0.00 O ATOM 2686 H1 WAT 3252 85.091 52.290 117.736 1.00 0.00 H ATOM 2687 H2 WAT 3252 85.628 51.780 119.056 1.00 0.00 H TER 2689 WAT 3252 ATOM 2689 O WAT 3253 70.253 55.117 156.180 1.00 0.00 O ATOM 2690 H1 WAT 3253 71.091 55.532 156.382 1.00 0.00 H ATOM 2691 H2 WAT 3253 69.663 55.421 156.870 1.00 0.00 H TER 2693 WAT 3253 ATOM 2693 O WAT 3254 13.031 123.600 2.561 1.00 0.00 O ATOM 2694 H1 WAT 3254 13.321 124.486 2.341 1.00 0.00 H ATOM 2695 H2 WAT 3254 13.448 123.414 3.402 1.00 0.00 H TER 2697 WAT 3254 ATOM 2697 O WAT 3255 116.142 66.283 104.507 1.00 0.00 O ATOM 2698 H1 WAT 3255 115.548 66.480 103.783 1.00 0.00 H ATOM 2699 H2 WAT 3255 115.905 65.395 104.776 1.00 0.00 H TER 2701 WAT 3255 ATOM 2701 O WAT 3256 49.325 6.869 90.297 1.00 0.00 O ATOM 2702 H1 WAT 3256 49.418 6.418 89.458 1.00 0.00 H ATOM 2703 H2 WAT 3256 50.219 7.112 90.539 1.00 0.00 H TER 2705 WAT 3256 ATOM 2705 O WAT 3257 91.872 26.281 148.826 1.00 0.00 O ATOM 2706 H1 WAT 3257 91.057 26.726 149.060 1.00 0.00 H ATOM 2707 H2 WAT 3257 91.651 25.771 148.047 1.00 0.00 H TER 2709 WAT 3257 ATOM 2709 O WAT 3258 135.728 13.938 135.954 1.00 0.00 O ATOM 2710 H1 WAT 3258 135.749 13.723 136.887 1.00 0.00 H ATOM 2711 H2 WAT 3258 134.828 13.751 135.685 1.00 0.00 H TER 2713 WAT 3258 ATOM 2713 O WAT 3259 138.419 11.687 3.035 1.00 0.00 O ATOM 2714 H1 WAT 3259 137.487 11.839 3.188 1.00 0.00 H ATOM 2715 H2 WAT 3259 138.775 11.490 3.902 1.00 0.00 H TER 2717 WAT 3259 ATOM 2717 O WAT 3260 73.697 113.760 112.261 1.00 0.00 O ATOM 2718 H1 WAT 3260 74.465 114.166 111.859 1.00 0.00 H ATOM 2719 H2 WAT 3260 72.956 114.111 111.768 1.00 0.00 H TER 2721 WAT 3260 ATOM 2721 O WAT 3261 33.422 100.181 81.318 1.00 0.00 O ATOM 2722 H1 WAT 3261 33.006 100.926 81.750 1.00 0.00 H ATOM 2723 H2 WAT 3261 32.765 99.486 81.354 1.00 0.00 H TER 2725 WAT 3261 ATOM 2725 O WAT 3262 37.947 108.550 58.899 1.00 0.00 O ATOM 2726 H1 WAT 3262 37.964 109.484 59.106 1.00 0.00 H ATOM 2727 H2 WAT 3262 38.101 108.116 59.738 1.00 0.00 H TER 2729 WAT 3262 ATOM 2729 O WAT 3263 98.113 122.452 104.888 1.00 0.00 O ATOM 2730 H1 WAT 3263 98.984 122.501 105.282 1.00 0.00 H ATOM 2731 H2 WAT 3263 97.512 122.626 105.612 1.00 0.00 H TER 2733 WAT 3263 ATOM 2733 O WAT 3264 104.023 32.434 6.358 1.00 0.00 O ATOM 2734 H1 WAT 3264 104.184 33.166 6.954 1.00 0.00 H ATOM 2735 H2 WAT 3264 103.870 32.846 5.508 1.00 0.00 H TER 2737 WAT 3264 ATOM 2737 O WAT 3265 70.520 12.700 61.062 1.00 0.00 O ATOM 2738 H1 WAT 3265 70.740 12.230 60.258 1.00 0.00 H ATOM 2739 H2 WAT 3265 71.364 12.984 61.412 1.00 0.00 H TER 2741 WAT 3265 ATOM 2741 O WAT 3266 7.981 124.659 142.534 1.00 0.00 O ATOM 2742 H1 WAT 3266 8.461 124.249 141.814 1.00 0.00 H ATOM 2743 H2 WAT 3266 8.566 124.580 143.288 1.00 0.00 H TER 2745 WAT 3266 ATOM 2745 O WAT 3267 34.497 40.481 82.120 1.00 0.00 O ATOM 2746 H1 WAT 3267 34.886 39.939 82.805 1.00 0.00 H ATOM 2747 H2 WAT 3267 34.616 39.974 81.317 1.00 0.00 H TER 2749 WAT 3267 ATOM 2749 O WAT 3268 86.262 57.619 14.957 1.00 0.00 O ATOM 2750 H1 WAT 3268 86.873 58.291 15.259 1.00 0.00 H ATOM 2751 H2 WAT 3268 86.511 57.460 14.047 1.00 0.00 H TER 2753 WAT 3268 ATOM 2753 O WAT 3269 46.006 57.273 158.919 1.00 0.00 O ATOM 2754 H1 WAT 3269 45.502 58.086 158.866 1.00 0.00 H ATOM 2755 H2 WAT 3269 46.401 57.180 158.052 1.00 0.00 H TER 2757 WAT 3269 ATOM 2757 O WAT 3270 70.746 127.541 62.956 1.00 0.00 O ATOM 2758 H1 WAT 3270 71.346 126.821 63.150 1.00 0.00 H ATOM 2759 H2 WAT 3270 71.007 128.239 63.557 1.00 0.00 H TER 2761 WAT 3270 ATOM 2761 O WAT 3271 48.476 72.525 123.369 1.00 0.00 O ATOM 2762 H1 WAT 3271 48.325 72.196 124.255 1.00 0.00 H ATOM 2763 H2 WAT 3271 49.414 72.401 123.225 1.00 0.00 H TER 2765 WAT 3271 ATOM 2765 O WAT 3272 39.924 43.402 11.163 1.00 0.00 O ATOM 2766 H1 WAT 3272 39.317 43.832 11.765 1.00 0.00 H ATOM 2767 H2 WAT 3272 40.500 42.889 11.730 1.00 0.00 H TER 2769 WAT 3272 ATOM 2769 O WAT 3273 16.426 6.149 0.912 1.00 0.00 O ATOM 2770 H1 WAT 3273 17.237 5.645 0.842 1.00 0.00 H ATOM 2771 H2 WAT 3273 15.808 5.688 0.346 1.00 0.00 H TER 2773 WAT 3273 ATOM 2773 O WAT 3274 24.033 135.938 138.011 1.00 0.00 O ATOM 2774 H1 WAT 3274 23.529 135.924 138.825 1.00 0.00 H ATOM 2775 H2 WAT 3274 23.859 136.802 137.637 1.00 0.00 H TER 2777 WAT 3274 ATOM 2777 O WAT 3275 22.585 40.022 85.572 1.00 0.00 O ATOM 2778 H1 WAT 3275 22.988 40.576 84.904 1.00 0.00 H ATOM 2779 H2 WAT 3275 23.255 39.371 85.779 1.00 0.00 H TER 2781 WAT 3275 ATOM 2781 O WAT 3276 92.777 134.782 5.809 1.00 0.00 O ATOM 2782 H1 WAT 3276 92.364 133.967 5.524 1.00 0.00 H ATOM 2783 H2 WAT 3276 92.610 134.818 6.751 1.00 0.00 H TER 2785 WAT 3276 ATOM 2785 O WAT 3277 38.180 79.535 111.347 1.00 0.00 O ATOM 2786 H1 WAT 3277 38.450 78.617 111.319 1.00 0.00 H ATOM 2787 H2 WAT 3277 37.601 79.638 110.592 1.00 0.00 H TER 2789 WAT 3277 ATOM 2789 O WAT 3278 9.215 65.282 120.210 1.00 0.00 O ATOM 2790 H1 WAT 3278 9.639 65.788 119.516 1.00 0.00 H ATOM 2791 H2 WAT 3278 9.931 65.024 120.790 1.00 0.00 H TER 2793 WAT 3278 ATOM 2793 O WAT 3279 32.239 54.948 155.100 1.00 0.00 O ATOM 2794 H1 WAT 3279 33.118 54.943 155.479 1.00 0.00 H ATOM 2795 H2 WAT 3279 31.731 55.516 155.680 1.00 0.00 H TER 2797 WAT 3279 ATOM 2797 O WAT 3280 44.994 31.393 146.649 1.00 0.00 O ATOM 2798 H1 WAT 3280 44.100 31.512 146.970 1.00 0.00 H ATOM 2799 H2 WAT 3280 45.361 30.711 147.212 1.00 0.00 H TER 2801 WAT 3280 ATOM 2801 O WAT 3281 21.355 117.949 16.050 1.00 0.00 O ATOM 2802 H1 WAT 3281 22.234 117.840 15.688 1.00 0.00 H ATOM 2803 H2 WAT 3281 21.498 118.117 16.981 1.00 0.00 H TER 2805 WAT 3281 ATOM 2805 O WAT 3282 1.741 141.307 3.537 1.00 0.00 O ATOM 2806 H1 WAT 3282 1.737 141.213 2.585 1.00 0.00 H ATOM 2807 H2 WAT 3282 1.002 140.775 3.833 1.00 0.00 H TER 2809 WAT 3282 ATOM 2809 O WAT 3283 94.813 84.593 73.893 1.00 0.00 O ATOM 2810 H1 WAT 3283 94.146 84.925 73.293 1.00 0.00 H ATOM 2811 H2 WAT 3283 94.483 84.813 74.764 1.00 0.00 H TER 2813 WAT 3283 ATOM 2813 O WAT 3284 42.409 134.636 131.094 1.00 0.00 O ATOM 2814 H1 WAT 3284 43.132 135.098 131.519 1.00 0.00 H ATOM 2815 H2 WAT 3284 42.408 133.769 131.499 1.00 0.00 H TER 2817 WAT 3284 ATOM 2817 O WAT 3285 103.684 92.974 114.063 1.00 0.00 O ATOM 2818 H1 WAT 3285 103.408 93.019 114.978 1.00 0.00 H ATOM 2819 H2 WAT 3285 104.588 92.663 114.100 1.00 0.00 H TER 2821 WAT 3285 ATOM 2821 O WAT 3286 110.973 125.055 96.953 1.00 0.00 O ATOM 2822 H1 WAT 3286 110.536 124.556 97.642 1.00 0.00 H ATOM 2823 H2 WAT 3286 110.517 125.897 96.940 1.00 0.00 H TER 2825 WAT 3286 ATOM 2825 O WAT 3287 137.564 80.526 80.727 1.00 0.00 O ATOM 2826 H1 WAT 3287 137.656 81.477 80.784 1.00 0.00 H ATOM 2827 H2 WAT 3287 136.635 80.387 80.543 1.00 0.00 H TER 2829 WAT 3287 ATOM 2829 O WAT 3288 70.517 132.148 70.725 1.00 0.00 O ATOM 2830 H1 WAT 3288 70.751 131.473 71.362 1.00 0.00 H ATOM 2831 H2 WAT 3288 71.299 132.245 70.181 1.00 0.00 H TER 2833 WAT 3288 ATOM 2833 O WAT 3289 56.143 138.969 83.465 1.00 0.00 O ATOM 2834 H1 WAT 3289 55.789 139.410 82.693 1.00 0.00 H ATOM 2835 H2 WAT 3289 57.092 139.065 83.381 1.00 0.00 H TER 2837 WAT 3289 ATOM 2837 O WAT 3290 126.168 85.127 6.469 1.00 0.00 O ATOM 2838 H1 WAT 3290 125.683 85.347 7.265 1.00 0.00 H ATOM 2839 H2 WAT 3290 125.492 84.998 5.804 1.00 0.00 H TER 2841 WAT 3290 ATOM 2841 O WAT 3291 122.093 12.829 157.869 1.00 0.00 O ATOM 2842 H1 WAT 3291 121.205 12.779 157.516 1.00 0.00 H ATOM 2843 H2 WAT 3291 122.331 11.919 158.049 1.00 0.00 H TER 2845 WAT 3291 ATOM 2845 O WAT 3292 57.382 78.779 9.170 1.00 0.00 O ATOM 2846 H1 WAT 3292 56.829 78.889 9.943 1.00 0.00 H ATOM 2847 H2 WAT 3292 58.251 78.586 9.522 1.00 0.00 H TER 2849 WAT 3292 ATOM 2849 O WAT 3293 141.231 134.592 10.233 1.00 0.00 O ATOM 2850 H1 WAT 3293 141.003 134.017 10.963 1.00 0.00 H ATOM 2851 H2 WAT 3293 140.885 134.146 9.459 1.00 0.00 H TER 2853 WAT 3293 ATOM 2853 O WAT 3294 54.931 124.451 143.473 1.00 0.00 O ATOM 2854 H1 WAT 3294 55.596 124.126 142.866 1.00 0.00 H ATOM 2855 H2 WAT 3294 54.743 125.340 143.169 1.00 0.00 H TER 2857 WAT 3294 ATOM 2857 O WAT 3295 68.004 40.811 15.274 1.00 0.00 O ATOM 2858 H1 WAT 3295 68.919 40.630 15.062 1.00 0.00 H ATOM 2859 H2 WAT 3295 67.612 39.947 15.402 1.00 0.00 H TER 2861 WAT 3295 ATOM 2861 O WAT 3296 123.086 39.145 132.879 1.00 0.00 O ATOM 2862 H1 WAT 3296 123.936 39.440 133.206 1.00 0.00 H ATOM 2863 H2 WAT 3296 123.093 38.198 133.018 1.00 0.00 H TER 2865 WAT 3296 ATOM 2865 O WAT 3297 14.564 64.438 73.894 1.00 0.00 O ATOM 2866 H1 WAT 3297 15.152 64.896 73.294 1.00 0.00 H ATOM 2867 H2 WAT 3297 14.479 63.560 73.523 1.00 0.00 H TER 2869 WAT 3297 ATOM 2869 O WAT 3298 125.809 62.834 130.690 1.00 0.00 O ATOM 2870 H1 WAT 3298 126.716 62.529 130.678 1.00 0.00 H ATOM 2871 H2 WAT 3298 125.351 62.245 130.089 1.00 0.00 H TER 2873 WAT 3298 ATOM 2873 O WAT 3299 88.302 77.547 62.617 1.00 0.00 O ATOM 2874 H1 WAT 3299 88.241 76.600 62.497 1.00 0.00 H ATOM 2875 H2 WAT 3299 87.471 77.792 63.025 1.00 0.00 H TER 2877 WAT 3299 ATOM 2877 O WAT 3300 2.290 41.395 104.951 1.00 0.00 O ATOM 2878 H1 WAT 3300 1.826 40.743 104.426 1.00 0.00 H ATOM 2879 H2 WAT 3300 2.061 41.182 105.855 1.00 0.00 H TER 2881 WAT 3300 ATOM 2881 O WAT 3301 74.941 142.525 18.741 1.00 0.00 O ATOM 2882 H1 WAT 3301 75.540 141.858 18.406 1.00 0.00 H ATOM 2883 H2 WAT 3301 75.313 142.780 19.585 1.00 0.00 H TER 2885 WAT 3301 ATOM 2885 O WAT 3302 110.009 4.753 77.059 1.00 0.00 O ATOM 2886 H1 WAT 3302 110.067 4.997 76.135 1.00 0.00 H ATOM 2887 H2 WAT 3302 109.449 5.425 77.449 1.00 0.00 H TER 2889 WAT 3302 ATOM 2889 O WAT 3303 22.628 103.915 116.015 1.00 0.00 O ATOM 2890 H1 WAT 3303 22.017 103.190 115.882 1.00 0.00 H ATOM 2891 H2 WAT 3303 23.494 103.517 115.932 1.00 0.00 H TER 2893 WAT 3303 ATOM 2893 O WAT 3304 91.200 77.370 120.991 1.00 0.00 O ATOM 2894 H1 WAT 3304 90.883 76.891 121.757 1.00 0.00 H ATOM 2895 H2 WAT 3304 91.177 76.729 120.281 1.00 0.00 H TER 2897 WAT 3304 ATOM 2897 O WAT 3305 99.719 36.616 102.897 1.00 0.00 O ATOM 2898 H1 WAT 3305 99.527 36.190 103.733 1.00 0.00 H ATOM 2899 H2 WAT 3305 100.555 36.237 102.623 1.00 0.00 H TER 2901 WAT 3305 ATOM 2901 O WAT 3306 18.146 56.959 13.803 1.00 0.00 O ATOM 2902 H1 WAT 3306 17.745 56.105 13.967 1.00 0.00 H ATOM 2903 H2 WAT 3306 19.073 56.832 14.006 1.00 0.00 H TER 2905 WAT 3306 ATOM 2905 O WAT 3307 144.410 52.758 109.192 1.00 0.00 O ATOM 2906 H1 WAT 3307 143.548 52.814 109.604 1.00 0.00 H ATOM 2907 H2 WAT 3307 144.699 51.862 109.364 1.00 0.00 H TER 2909 WAT 3307 ATOM 2909 O WAT 3308 69.126 34.095 1.066 1.00 0.00 O ATOM 2910 H1 WAT 3308 68.911 33.344 0.514 1.00 0.00 H ATOM 2911 H2 WAT 3308 69.891 34.489 0.647 1.00 0.00 H TER 2913 WAT 3308 ATOM 2913 O WAT 3309 11.410 56.127 145.396 1.00 0.00 O ATOM 2914 H1 WAT 3309 10.678 55.714 145.854 1.00 0.00 H ATOM 2915 H2 WAT 3309 12.176 55.616 145.659 1.00 0.00 H TER 2917 WAT 3309 ATOM 2917 O WAT 3310 131.355 85.327 118.365 1.00 0.00 O ATOM 2918 H1 WAT 3310 131.696 85.602 119.216 1.00 0.00 H ATOM 2919 H2 WAT 3310 132.124 85.015 117.888 1.00 0.00 H TER 2921 WAT 3310 ATOM 2921 O WAT 3311 40.133 65.164 128.841 1.00 0.00 O ATOM 2922 H1 WAT 3311 40.091 65.758 128.092 1.00 0.00 H ATOM 2923 H2 WAT 3311 40.671 65.627 129.483 1.00 0.00 H TER 2925 WAT 3311 ATOM 2925 O WAT 3312 45.997 11.258 67.647 1.00 0.00 O ATOM 2926 H1 WAT 3312 46.303 11.427 66.756 1.00 0.00 H ATOM 2927 H2 WAT 3312 45.963 12.122 68.057 1.00 0.00 H TER 2929 WAT 3312 ATOM 2929 O WAT 3313 83.892 130.826 117.882 1.00 0.00 O ATOM 2930 H1 WAT 3313 84.632 130.738 118.483 1.00 0.00 H ATOM 2931 H2 WAT 3313 84.050 131.654 117.428 1.00 0.00 H TER 2933 WAT 3313 ATOM 2933 O WAT 3314 48.993 25.923 78.601 1.00 0.00 O ATOM 2934 H1 WAT 3314 48.152 26.014 78.154 1.00 0.00 H ATOM 2935 H2 WAT 3314 49.455 26.739 78.409 1.00 0.00 H TER 2937 WAT 3314 ATOM 2937 O WAT 3315 70.988 69.154 126.222 1.00 0.00 O ATOM 2938 H1 WAT 3315 71.293 68.255 126.094 1.00 0.00 H ATOM 2939 H2 WAT 3315 71.077 69.305 127.163 1.00 0.00 H TER 2941 WAT 3315 ATOM 2941 O WAT 3316 142.808 15.580 107.780 1.00 0.00 O ATOM 2942 H1 WAT 3316 143.734 15.390 107.929 1.00 0.00 H ATOM 2943 H2 WAT 3316 142.507 14.875 107.207 1.00 0.00 H TER 2945 WAT 3316 ATOM 2945 O WAT 3317 101.004 131.614 95.165 1.00 0.00 O ATOM 2946 H1 WAT 3317 100.112 131.283 95.270 1.00 0.00 H ATOM 2947 H2 WAT 3317 100.999 132.461 95.610 1.00 0.00 H TER 2949 WAT 3317 ATOM 2949 O WAT 3318 27.296 50.941 117.948 1.00 0.00 O ATOM 2950 H1 WAT 3318 26.431 50.765 118.319 1.00 0.00 H ATOM 2951 H2 WAT 3318 27.896 50.858 118.689 1.00 0.00 H TER 2953 WAT 3318 ATOM 2953 O WAT 3319 99.944 72.069 19.198 1.00 0.00 O ATOM 2954 H1 WAT 3319 100.821 72.277 18.876 1.00 0.00 H ATOM 2955 H2 WAT 3319 100.085 71.384 19.852 1.00 0.00 H TER 2957 WAT 3319 ATOM 2957 O WAT 3320 23.974 92.268 124.754 1.00 0.00 O ATOM 2958 H1 WAT 3320 23.310 92.465 124.093 1.00 0.00 H ATOM 2959 H2 WAT 3320 24.327 93.123 125.001 1.00 0.00 H TER 2961 WAT 3320 ATOM 2961 O WAT 3321 111.374 113.095 93.575 1.00 0.00 O ATOM 2962 H1 WAT 3321 110.654 112.499 93.783 1.00 0.00 H ATOM 2963 H2 WAT 3321 111.256 113.296 92.646 1.00 0.00 H TER 2965 WAT 3321 ATOM 2965 O WAT 3322 63.488 108.326 113.902 1.00 0.00 O ATOM 2966 H1 WAT 3322 63.574 108.707 113.029 1.00 0.00 H ATOM 2967 H2 WAT 3322 62.586 108.010 113.938 1.00 0.00 H TER 2969 WAT 3322 ATOM 2969 O WAT 3323 63.769 105.864 139.233 1.00 0.00 O ATOM 2970 H1 WAT 3323 64.463 106.291 139.736 1.00 0.00 H ATOM 2971 H2 WAT 3323 63.893 106.179 138.338 1.00 0.00 H TER 2973 WAT 3323 ATOM 2973 O WAT 3324 87.907 136.662 7.380 1.00 0.00 O ATOM 2974 H1 WAT 3324 87.397 137.437 7.143 1.00 0.00 H ATOM 2975 H2 WAT 3324 88.264 136.866 8.244 1.00 0.00 H TER 2977 WAT 3324 ATOM 2977 O WAT 3325 134.337 73.108 72.013 1.00 0.00 O ATOM 2978 H1 WAT 3325 135.175 73.149 72.473 1.00 0.00 H ATOM 2979 H2 WAT 3325 133.813 72.492 72.525 1.00 0.00 H TER 2981 WAT 3325 ATOM 2981 O WAT 3326 93.269 76.913 150.850 1.00 0.00 O ATOM 2982 H1 WAT 3326 93.853 77.556 150.449 1.00 0.00 H ATOM 2983 H2 WAT 3326 92.462 77.399 151.025 1.00 0.00 H TER 2985 WAT 3326 ATOM 2985 O WAT 3327 13.930 34.216 82.790 1.00 0.00 O ATOM 2986 H1 WAT 3327 14.308 34.226 83.669 1.00 0.00 H ATOM 2987 H2 WAT 3327 14.329 33.456 82.366 1.00 0.00 H TER 2989 WAT 3327 ATOM 2989 O WAT 3328 24.686 27.385 99.945 1.00 0.00 O ATOM 2990 H1 WAT 3328 24.928 26.509 99.644 1.00 0.00 H ATOM 2991 H2 WAT 3328 25.246 27.540 100.706 1.00 0.00 H TER 2993 WAT 3328 ATOM 2993 O WAT 3329 36.617 106.551 116.916 1.00 0.00 O ATOM 2994 H1 WAT 3329 37.368 106.914 116.447 1.00 0.00 H ATOM 2995 H2 WAT 3329 35.961 106.397 116.236 1.00 0.00 H TER 2997 WAT 3329 ATOM 2997 O WAT 3330 117.867 13.804 94.190 1.00 0.00 O ATOM 2998 H1 WAT 3330 118.654 14.348 94.159 1.00 0.00 H ATOM 2999 H2 WAT 3330 117.180 14.353 93.815 1.00 0.00 H TER 3001 WAT 3330 ATOM 3001 O WAT 3331 138.242 26.101 117.319 1.00 0.00 O ATOM 3002 H1 WAT 3331 138.592 25.958 118.198 1.00 0.00 H ATOM 3003 H2 WAT 3331 138.317 25.248 116.890 1.00 0.00 H TER 3005 WAT 3331 ATOM 3005 O WAT 3332 62.612 137.251 117.164 1.00 0.00 O ATOM 3006 H1 WAT 3332 62.080 137.625 116.461 1.00 0.00 H ATOM 3007 H2 WAT 3332 62.585 137.908 117.860 1.00 0.00 H TER 3009 WAT 3332 ATOM 3009 O WAT 3333 1.501 23.329 144.521 1.00 0.00 O ATOM 3010 H1 WAT 3333 1.271 24.054 145.102 1.00 0.00 H ATOM 3011 H2 WAT 3333 0.668 23.059 144.135 1.00 0.00 H TER 3013 WAT 3333 ATOM 3013 O WAT 3334 117.736 103.615 80.881 1.00 0.00 O ATOM 3014 H1 WAT 3334 118.478 103.266 81.374 1.00 0.00 H ATOM 3015 H2 WAT 3334 116.967 103.344 81.383 1.00 0.00 H TER 3017 WAT 3334 ATOM 3017 O WAT 3335 82.931 62.789 9.395 1.00 0.00 O ATOM 3018 H1 WAT 3335 82.736 62.268 8.616 1.00 0.00 H ATOM 3019 H2 WAT 3335 83.492 63.496 9.076 1.00 0.00 H TER 3021 WAT 3335 ATOM 3021 O WAT 3336 99.108 95.021 67.544 1.00 0.00 O ATOM 3022 H1 WAT 3336 98.579 95.485 68.194 1.00 0.00 H ATOM 3023 H2 WAT 3336 99.967 94.930 67.956 1.00 0.00 H TER 3025 WAT 3336 ATOM 3025 O WAT 3337 27.420 17.685 87.977 1.00 0.00 O ATOM 3026 H1 WAT 3337 27.703 17.961 88.849 1.00 0.00 H ATOM 3027 H2 WAT 3337 26.546 18.063 87.879 1.00 0.00 H TER 3029 WAT 3337 ATOM 3029 O WAT 3338 51.624 123.937 99.628 1.00 0.00 O ATOM 3030 H1 WAT 3338 52.202 124.693 99.521 1.00 0.00 H ATOM 3031 H2 WAT 3338 52.212 123.181 99.600 1.00 0.00 H TER 3033 WAT 3338 ATOM 3033 O WAT 3339 43.642 124.957 88.869 1.00 0.00 O ATOM 3034 H1 WAT 3339 44.424 125.449 89.118 1.00 0.00 H ATOM 3035 H2 WAT 3339 43.441 124.421 89.636 1.00 0.00 H TER 3037 WAT 3339 ATOM 3037 O WAT 3340 77.434 34.010 130.211 1.00 0.00 O ATOM 3038 H1 WAT 3340 77.007 34.864 130.274 1.00 0.00 H ATOM 3039 H2 WAT 3340 78.304 34.148 130.586 1.00 0.00 H TER 3041 WAT 3340 ATOM 3041 O WAT 3341 87.373 49.018 138.120 1.00 0.00 O ATOM 3042 H1 WAT 3341 87.679 49.823 137.702 1.00 0.00 H ATOM 3043 H2 WAT 3341 87.707 49.071 139.016 1.00 0.00 H TER 3045 WAT 3341 ATOM 3045 O WAT 3342 132.221 40.191 73.022 1.00 0.00 O ATOM 3046 H1 WAT 3342 132.370 40.321 73.959 1.00 0.00 H ATOM 3047 H2 WAT 3342 133.061 39.877 72.687 1.00 0.00 H TER 3049 WAT 3342 ATOM 3049 O WAT 3343 78.412 13.292 82.395 1.00 0.00 O ATOM 3050 H1 WAT 3343 78.682 12.918 83.234 1.00 0.00 H ATOM 3051 H2 WAT 3343 77.883 12.607 81.986 1.00 0.00 H TER 3053 WAT 3343 ATOM 3053 O WAT 3344 24.192 60.919 155.526 1.00 0.00 O ATOM 3054 H1 WAT 3344 24.722 61.598 155.944 1.00 0.00 H ATOM 3055 H2 WAT 3344 23.730 60.497 156.251 1.00 0.00 H TER 3057 WAT 3344 ATOM 3057 O WAT 3345 128.202 144.129 12.571 1.00 0.00 O ATOM 3058 H1 WAT 3345 128.069 145.063 12.735 1.00 0.00 H ATOM 3059 H2 WAT 3345 127.378 143.834 12.184 1.00 0.00 H TER 3061 WAT 3345 ATOM 3061 O WAT 3346 31.599 109.175 65.848 1.00 0.00 O ATOM 3062 H1 WAT 3346 31.254 108.661 66.578 1.00 0.00 H ATOM 3063 H2 WAT 3346 31.353 110.077 66.052 1.00 0.00 H TER 3065 WAT 3346 ATOM 3065 O WAT 3347 139.077 121.908 157.856 1.00 0.00 O ATOM 3066 H1 WAT 3347 138.374 121.307 158.104 1.00 0.00 H ATOM 3067 H2 WAT 3347 138.675 122.776 157.897 1.00 0.00 H TER 3069 WAT 3347 ATOM 3069 O WAT 3348 134.879 139.035 118.784 1.00 0.00 O ATOM 3070 H1 WAT 3348 135.554 139.441 119.330 1.00 0.00 H ATOM 3071 H2 WAT 3348 135.178 138.134 118.664 1.00 0.00 H TER 3073 WAT 3348 ATOM 3073 O WAT 3349 141.894 52.834 153.553 1.00 0.00 O ATOM 3074 H1 WAT 3349 142.730 52.484 153.245 1.00 0.00 H ATOM 3075 H2 WAT 3349 141.252 52.516 152.919 1.00 0.00 H TER 3077 WAT 3349 ATOM 3077 O WAT 3350 143.607 67.945 112.984 1.00 0.00 O ATOM 3078 H1 WAT 3350 144.130 68.581 113.472 1.00 0.00 H ATOM 3079 H2 WAT 3350 143.473 67.224 113.600 1.00 0.00 H TER 3081 WAT 3350 ATOM 3081 O WAT 3351 66.748 6.615 8.255 1.00 0.00 O ATOM 3082 H1 WAT 3351 65.895 6.971 8.009 1.00 0.00 H ATOM 3083 H2 WAT 3351 67.363 7.026 7.648 1.00 0.00 H TER 3085 WAT 3351 ATOM 3085 O WAT 3352 58.773 104.942 103.502 1.00 0.00 O ATOM 3086 H1 WAT 3352 58.523 104.879 102.580 1.00 0.00 H ATOM 3087 H2 WAT 3352 59.490 104.315 103.599 1.00 0.00 H TER 3089 WAT 3352 ATOM 3089 O WAT 3353 99.475 97.940 123.337 1.00 0.00 O ATOM 3090 H1 WAT 3353 99.614 97.202 122.744 1.00 0.00 H ATOM 3091 H2 WAT 3353 99.727 97.607 124.198 1.00 0.00 H TER 3093 WAT 3353 ATOM 3093 O WAT 3354 69.477 22.796 83.106 1.00 0.00 O ATOM 3094 H1 WAT 3354 70.232 23.045 83.639 1.00 0.00 H ATOM 3095 H2 WAT 3354 69.834 22.673 82.227 1.00 0.00 H TER 3097 WAT 3354 ATOM 3097 O WAT 3355 91.108 80.942 71.708 1.00 0.00 O ATOM 3098 H1 WAT 3355 91.868 80.497 72.081 1.00 0.00 H ATOM 3099 H2 WAT 3355 91.479 81.584 71.103 1.00 0.00 H TER 3101 WAT 3355 ATOM 3101 O WAT 3356 11.515 18.584 71.330 1.00 0.00 O ATOM 3102 H1 WAT 3356 10.703 18.908 70.941 1.00 0.00 H ATOM 3103 H2 WAT 3356 11.473 17.635 71.214 1.00 0.00 H TER 3105 WAT 3356 ATOM 3105 O WAT 3357 23.945 0.485 102.415 1.00 0.00 O ATOM 3106 H1 WAT 3357 23.300 0.447 103.121 1.00 0.00 H ATOM 3107 H2 WAT 3357 23.468 0.193 101.639 1.00 0.00 H TER 3109 WAT 3357 ATOM 3109 O WAT 3358 0.441 84.546 143.052 1.00 0.00 O ATOM 3110 H1 WAT 3358 -0.445 84.599 143.410 1.00 0.00 H ATOM 3111 H2 WAT 3358 0.313 84.423 142.112 1.00 0.00 H TER 3113 WAT 3358 ATOM 3113 O WAT 3359 81.637 106.966 119.082 1.00 0.00 O ATOM 3114 H1 WAT 3359 81.552 106.038 119.302 1.00 0.00 H ATOM 3115 H2 WAT 3359 82.161 106.975 118.281 1.00 0.00 H TER 3117 WAT 3359 ATOM 3117 O WAT 3360 116.140 143.647 112.823 1.00 0.00 O ATOM 3118 H1 WAT 3360 116.562 143.130 113.510 1.00 0.00 H ATOM 3119 H2 WAT 3360 116.431 144.544 112.985 1.00 0.00 H TER 3121 WAT 3360 ATOM 3121 O WAT 3361 13.751 36.226 144.362 1.00 0.00 O ATOM 3122 H1 WAT 3361 12.993 35.747 144.698 1.00 0.00 H ATOM 3123 H2 WAT 3361 14.497 35.658 144.552 1.00 0.00 H TER 3125 WAT 3361 ATOM 3125 O WAT 3362 37.925 124.127 78.906 1.00 0.00 O ATOM 3126 H1 WAT 3362 38.405 123.413 78.486 1.00 0.00 H ATOM 3127 H2 WAT 3362 37.202 123.695 79.361 1.00 0.00 H TER 3129 WAT 3362 ATOM 3129 O WAT 3363 118.045 13.320 126.140 1.00 0.00 O ATOM 3130 H1 WAT 3363 118.159 12.586 126.744 1.00 0.00 H ATOM 3131 H2 WAT 3363 118.481 13.039 125.336 1.00 0.00 H TER 3133 WAT 3363 ATOM 3133 O WAT 3364 11.317 48.201 142.796 1.00 0.00 O ATOM 3134 H1 WAT 3364 10.417 48.190 142.471 1.00 0.00 H ATOM 3135 H2 WAT 3364 11.504 47.287 143.013 1.00 0.00 H TER 3137 WAT 3364 ATOM 3137 O WAT 3365 54.346 45.674 86.719 1.00 0.00 O ATOM 3138 H1 WAT 3365 53.393 45.611 86.651 1.00 0.00 H ATOM 3139 H2 WAT 3365 54.626 44.795 86.972 1.00 0.00 H TER 3141 WAT 3365 ATOM 3141 O WAT 3366 28.664 38.397 90.936 1.00 0.00 O ATOM 3142 H1 WAT 3366 28.244 39.144 90.510 1.00 0.00 H ATOM 3143 H2 WAT 3366 28.564 38.568 91.873 1.00 0.00 H TER 3145 WAT 3366 ATOM 3145 O WAT 3367 44.072 17.218 151.702 1.00 0.00 O ATOM 3146 H1 WAT 3367 44.842 16.771 152.054 1.00 0.00 H ATOM 3147 H2 WAT 3367 44.106 18.093 152.088 1.00 0.00 H TER 3149 WAT 3367 ATOM 3149 O WAT 3368 85.971 100.424 64.571 1.00 0.00 O ATOM 3150 H1 WAT 3368 85.324 100.879 65.112 1.00 0.00 H ATOM 3151 H2 WAT 3368 85.982 99.530 64.912 1.00 0.00 H TER 3153 WAT 3368 ATOM 3153 O WAT 3369 128.841 39.923 82.871 1.00 0.00 O ATOM 3154 H1 WAT 3369 128.789 39.391 82.077 1.00 0.00 H ATOM 3155 H2 WAT 3369 127.959 40.276 82.981 1.00 0.00 H TER 3157 WAT 3369 ATOM 3157 O WAT 3370 98.228 7.065 116.077 1.00 0.00 O ATOM 3158 H1 WAT 3370 98.695 6.285 116.378 1.00 0.00 H ATOM 3159 H2 WAT 3370 98.181 6.964 115.126 1.00 0.00 H TER 3161 WAT 3370 ATOM 3161 O WAT 3371 132.869 41.596 111.404 1.00 0.00 O ATOM 3162 H1 WAT 3371 133.537 40.912 111.448 1.00 0.00 H ATOM 3163 H2 WAT 3371 132.896 41.898 110.496 1.00 0.00 H TER 3165 WAT 3371 ATOM 3165 O WAT 3372 116.321 119.255 139.636 1.00 0.00 O ATOM 3166 H1 WAT 3372 116.518 118.318 139.632 1.00 0.00 H ATOM 3167 H2 WAT 3372 115.525 119.335 139.111 1.00 0.00 H TER 3169 WAT 3372 ATOM 3169 O WAT 3373 35.839 112.663 109.998 1.00 0.00 O ATOM 3170 H1 WAT 3373 36.346 113.254 110.554 1.00 0.00 H ATOM 3171 H2 WAT 3373 35.643 111.914 110.561 1.00 0.00 H TER 3173 WAT 3373 ATOM 3173 O WAT 3374 108.498 145.378 13.708 1.00 0.00 O ATOM 3174 H1 WAT 3374 108.704 146.098 14.304 1.00 0.00 H ATOM 3175 H2 WAT 3374 108.261 144.651 14.284 1.00 0.00 H TER 3177 WAT 3374 ATOM 3177 O WAT 3375 67.534 68.029 144.693 1.00 0.00 O ATOM 3178 H1 WAT 3375 68.137 68.576 145.196 1.00 0.00 H ATOM 3179 H2 WAT 3375 67.976 67.893 143.855 1.00 0.00 H TER 3181 WAT 3375 ATOM 3181 O WAT 3376 22.902 19.801 110.353 1.00 0.00 O ATOM 3182 H1 WAT 3376 22.377 19.537 111.109 1.00 0.00 H ATOM 3183 H2 WAT 3376 22.791 20.750 110.304 1.00 0.00 H TER 3185 WAT 3376 ATOM 3185 O WAT 3377 70.630 132.595 102.894 1.00 0.00 O ATOM 3186 H1 WAT 3377 71.540 132.366 103.084 1.00 0.00 H ATOM 3187 H2 WAT 3377 70.664 133.016 102.035 1.00 0.00 H TER 3189 WAT 3377 ATOM 3189 O WAT 3378 47.028 33.376 112.737 1.00 0.00 O ATOM 3190 H1 WAT 3378 47.146 32.666 113.369 1.00 0.00 H ATOM 3191 H2 WAT 3378 46.878 32.931 111.903 1.00 0.00 H TER 3193 WAT 3378 ATOM 3193 O WAT 3379 39.617 31.288 15.403 1.00 0.00 O ATOM 3194 H1 WAT 3379 40.450 31.609 15.056 1.00 0.00 H ATOM 3195 H2 WAT 3379 39.339 30.620 14.778 1.00 0.00 H TER 3197 WAT 3379 ATOM 3197 O WAT 3380 24.734 88.936 88.594 1.00 0.00 O ATOM 3198 H1 WAT 3380 24.403 88.383 87.887 1.00 0.00 H ATOM 3199 H2 WAT 3380 24.958 88.322 89.294 1.00 0.00 H TER 3201 WAT 3380 ATOM 3201 O WAT 3381 70.690 36.421 117.429 1.00 0.00 O ATOM 3202 H1 WAT 3381 69.921 36.688 117.932 1.00 0.00 H ATOM 3203 H2 WAT 3381 70.339 36.142 116.584 1.00 0.00 H TER 3205 WAT 3381 ATOM 3205 O WAT 3382 37.958 85.507 138.150 1.00 0.00 O ATOM 3206 H1 WAT 3382 37.743 86.019 137.370 1.00 0.00 H ATOM 3207 H2 WAT 3382 38.845 85.186 137.989 1.00 0.00 H TER 3209 WAT 3382 ATOM 3209 O WAT 3383 22.861 100.779 20.871 1.00 0.00 O ATOM 3210 H1 WAT 3383 22.163 101.082 21.452 1.00 0.00 H ATOM 3211 H2 WAT 3383 23.279 100.064 21.351 1.00 0.00 H TER 3213 WAT 3383 ATOM 3213 O WAT 3384 88.581 80.764 6.811 1.00 0.00 O ATOM 3214 H1 WAT 3384 88.836 80.390 7.654 1.00 0.00 H ATOM 3215 H2 WAT 3384 89.198 80.384 6.185 1.00 0.00 H TER 3217 WAT 3384 ATOM 3217 O WAT 3385 119.213 27.982 100.074 1.00 0.00 O ATOM 3218 H1 WAT 3385 119.211 27.803 101.014 1.00 0.00 H ATOM 3219 H2 WAT 3385 120.066 28.385 99.910 1.00 0.00 H TER 3221 WAT 3385 ATOM 3221 O WAT 3386 81.759 51.259 78.931 1.00 0.00 O ATOM 3222 H1 WAT 3386 82.012 51.420 78.022 1.00 0.00 H ATOM 3223 H2 WAT 3386 82.452 51.669 79.449 1.00 0.00 H TER 3225 WAT 3386 ATOM 3225 O WAT 3387 89.980 8.055 98.011 1.00 0.00 O ATOM 3226 H1 WAT 3387 89.528 8.722 97.494 1.00 0.00 H ATOM 3227 H2 WAT 3387 89.637 7.224 97.681 1.00 0.00 H TER 3229 WAT 3387 ATOM 3229 O WAT 3388 39.185 31.038 89.376 1.00 0.00 O ATOM 3230 H1 WAT 3388 39.494 30.214 88.999 1.00 0.00 H ATOM 3231 H2 WAT 3388 38.261 31.082 89.132 1.00 0.00 H TER 3233 WAT 3388 ATOM 3233 O WAT 3389 63.979 53.357 136.653 1.00 0.00 O ATOM 3234 H1 WAT 3389 63.260 53.787 136.190 1.00 0.00 H ATOM 3235 H2 WAT 3389 64.022 53.806 137.498 1.00 0.00 H TER 3237 WAT 3389 ATOM 3237 O WAT 3390 89.534 130.310 123.934 1.00 0.00 O ATOM 3238 H1 WAT 3390 88.625 130.594 124.030 1.00 0.00 H ATOM 3239 H2 WAT 3390 89.552 129.432 124.316 1.00 0.00 H TER 3241 WAT 3390 ATOM 3241 O WAT 3391 83.649 128.601 0.244 1.00 0.00 O ATOM 3242 H1 WAT 3391 84.281 128.300 -0.408 1.00 0.00 H ATOM 3243 H2 WAT 3391 83.036 127.872 0.338 1.00 0.00 H TER 3245 WAT 3391 ATOM 3245 O WAT 3392 100.393 58.958 149.922 1.00 0.00 O ATOM 3246 H1 WAT 3392 99.753 58.459 150.429 1.00 0.00 H ATOM 3247 H2 WAT 3392 101.183 58.952 150.464 1.00 0.00 H TER 3249 WAT 3392 ATOM 3249 O WAT 3393 89.095 117.526 137.645 1.00 0.00 O ATOM 3250 H1 WAT 3393 89.573 118.294 137.332 1.00 0.00 H ATOM 3251 H2 WAT 3393 89.741 116.819 137.630 1.00 0.00 H TER 3253 WAT 3393 ATOM 3253 O WAT 3394 132.080 123.592 95.903 1.00 0.00 O ATOM 3254 H1 WAT 3394 131.952 124.216 96.617 1.00 0.00 H ATOM 3255 H2 WAT 3394 131.243 123.131 95.835 1.00 0.00 H TER 3257 WAT 3394 ATOM 3257 O WAT 3395 46.395 24.537 80.170 1.00 0.00 O ATOM 3258 H1 WAT 3395 46.488 24.730 79.237 1.00 0.00 H ATOM 3259 H2 WAT 3395 45.894 25.275 80.518 1.00 0.00 H TER 3261 WAT 3395 ATOM 3261 O WAT 3396 39.106 124.724 0.856 1.00 0.00 O ATOM 3262 H1 WAT 3396 39.452 125.419 1.415 1.00 0.00 H ATOM 3263 H2 WAT 3396 38.309 125.095 0.477 1.00 0.00 H TER 3265 WAT 3396 ATOM 3265 O WAT 3397 57.902 37.152 154.108 1.00 0.00 O ATOM 3266 H1 WAT 3397 58.407 37.200 154.920 1.00 0.00 H ATOM 3267 H2 WAT 3397 58.129 36.300 153.735 1.00 0.00 H TER 3269 WAT 3397 ATOM 3269 O WAT 3398 83.978 77.465 22.482 1.00 0.00 O ATOM 3270 H1 WAT 3398 83.839 77.773 23.377 1.00 0.00 H ATOM 3271 H2 WAT 3398 84.752 77.943 22.182 1.00 0.00 H TER 3273 WAT 3398 ATOM 3273 O WAT 3399 138.080 35.343 143.791 1.00 0.00 O ATOM 3274 H1 WAT 3399 138.634 34.724 144.267 1.00 0.00 H ATOM 3275 H2 WAT 3399 138.556 35.513 142.978 1.00 0.00 H TER 3277 WAT 3399 ATOM 3277 O WAT 3400 88.810 22.595 88.458 1.00 0.00 O ATOM 3278 H1 WAT 3400 89.531 22.110 88.859 1.00 0.00 H ATOM 3279 H2 WAT 3400 88.599 23.280 89.093 1.00 0.00 H TER 3281 WAT 3400 ATOM 3281 O WAT 3401 92.283 108.339 17.346 1.00 0.00 O ATOM 3282 H1 WAT 3401 92.922 108.883 16.885 1.00 0.00 H ATOM 3283 H2 WAT 3401 91.532 108.298 16.754 1.00 0.00 H TER 3285 WAT 3401 ATOM 3285 O WAT 3402 22.701 5.802 116.405 1.00 0.00 O ATOM 3286 H1 WAT 3402 22.287 4.977 116.151 1.00 0.00 H ATOM 3287 H2 WAT 3402 23.635 5.659 116.254 1.00 0.00 H TER 3289 WAT 3402 ATOM 3289 O WAT 3403 45.162 55.001 56.978 1.00 0.00 O ATOM 3290 H1 WAT 3403 45.504 55.324 57.812 1.00 0.00 H ATOM 3291 H2 WAT 3403 44.681 54.205 57.209 1.00 0.00 H TER 3293 WAT 3403 ATOM 3293 O WAT 3404 37.777 52.968 93.748 1.00 0.00 O ATOM 3294 H1 WAT 3404 37.432 53.740 93.301 1.00 0.00 H ATOM 3295 H2 WAT 3404 38.580 52.755 93.273 1.00 0.00 H TER 3297 WAT 3404 ATOM 3297 O WAT 3405 1.248 119.730 15.206 1.00 0.00 O ATOM 3298 H1 WAT 3405 0.789 119.907 14.385 1.00 0.00 H ATOM 3299 H2 WAT 3405 1.657 120.564 15.436 1.00 0.00 H TER 3301 WAT 3405 ATOM 3301 O WAT 3406 70.375 73.034 92.927 1.00 0.00 O ATOM 3302 H1 WAT 3406 69.663 73.669 92.845 1.00 0.00 H ATOM 3303 H2 WAT 3406 70.544 72.747 92.029 1.00 0.00 H TER 3305 WAT 3406 ATOM 3305 O WAT 3407 25.243 5.834 17.485 1.00 0.00 O ATOM 3306 H1 WAT 3407 26.170 6.000 17.659 1.00 0.00 H ATOM 3307 H2 WAT 3407 24.934 5.365 18.260 1.00 0.00 H TER 3309 WAT 3407 ATOM 3309 O WAT 3408 129.277 139.043 86.886 1.00 0.00 O ATOM 3310 H1 WAT 3408 129.488 138.954 87.815 1.00 0.00 H ATOM 3311 H2 WAT 3408 128.841 138.222 86.659 1.00 0.00 H TER 3313 WAT 3408 ATOM 3313 O WAT 3409 2.888 100.119 119.289 1.00 0.00 O ATOM 3314 H1 WAT 3409 3.784 99.851 119.494 1.00 0.00 H ATOM 3315 H2 WAT 3409 2.441 99.305 119.057 1.00 0.00 H TER 3317 WAT 3409 ATOM 3317 O WAT 3410 54.740 105.330 24.761 1.00 0.00 O ATOM 3318 H1 WAT 3410 53.926 105.829 24.693 1.00 0.00 H ATOM 3319 H2 WAT 3410 55.334 105.905 25.244 1.00 0.00 H TER 3321 WAT 3410 ATOM 3321 O WAT 3411 129.037 55.447 99.347 1.00 0.00 O ATOM 3322 H1 WAT 3411 129.101 56.165 98.718 1.00 0.00 H ATOM 3323 H2 WAT 3411 128.396 55.750 99.991 1.00 0.00 H TER 3325 WAT 3411 ATOM 3325 O WAT 3412 11.945 125.638 15.012 1.00 0.00 O ATOM 3326 H1 WAT 3412 12.348 124.966 15.562 1.00 0.00 H ATOM 3327 H2 WAT 3412 12.043 125.307 14.119 1.00 0.00 H TER 3329 WAT 3412 ATOM 3329 O WAT 3413 20.616 74.719 81.977 1.00 0.00 O ATOM 3330 H1 WAT 3413 20.542 73.885 82.441 1.00 0.00 H ATOM 3331 H2 WAT 3413 19.713 74.957 81.767 1.00 0.00 H TER 3333 WAT 3413 ATOM 3333 O WAT 3414 137.509 69.543 156.222 1.00 0.00 O ATOM 3334 H1 WAT 3414 136.866 69.953 156.800 1.00 0.00 H ATOM 3335 H2 WAT 3414 137.141 69.645 155.344 1.00 0.00 H TER 3337 WAT 3414 ATOM 3337 O WAT 3415 121.774 125.975 105.313 1.00 0.00 O ATOM 3338 H1 WAT 3415 121.775 126.926 105.422 1.00 0.00 H ATOM 3339 H2 WAT 3415 122.579 125.788 104.830 1.00 0.00 H TER 3341 WAT 3415 ATOM 3341 O WAT 3416 16.232 35.145 126.194 1.00 0.00 O ATOM 3342 H1 WAT 3416 16.459 35.327 127.106 1.00 0.00 H ATOM 3343 H2 WAT 3416 15.848 35.961 125.874 1.00 0.00 H TER 3345 WAT 3416 ATOM 3345 O WAT 3417 134.442 15.775 154.276 1.00 0.00 O ATOM 3346 H1 WAT 3417 134.067 16.240 153.528 1.00 0.00 H ATOM 3347 H2 WAT 3417 135.296 15.474 153.967 1.00 0.00 H TER 3349 WAT 3417 ATOM 3349 O WAT 3418 74.940 134.285 91.507 1.00 0.00 O ATOM 3350 H1 WAT 3418 74.177 133.722 91.374 1.00 0.00 H ATOM 3351 H2 WAT 3418 75.660 133.814 91.087 1.00 0.00 H TER 3353 WAT 3418 ATOM 3353 O WAT 3419 20.624 71.913 77.851 1.00 0.00 O ATOM 3354 H1 WAT 3419 20.101 71.158 77.578 1.00 0.00 H ATOM 3355 H2 WAT 3419 21.107 71.605 78.617 1.00 0.00 H TER 3357 WAT 3419 ATOM 3357 O WAT 3420 62.095 47.042 138.570 1.00 0.00 O ATOM 3358 H1 WAT 3420 62.234 47.745 137.935 1.00 0.00 H ATOM 3359 H2 WAT 3420 62.569 46.294 138.206 1.00 0.00 H TER 3361 WAT 3420 ATOM 3361 O WAT 3421 35.807 112.223 89.827 1.00 0.00 O ATOM 3362 H1 WAT 3421 36.644 112.648 89.638 1.00 0.00 H ATOM 3363 H2 WAT 3421 35.932 111.314 89.554 1.00 0.00 H TER 3365 WAT 3421 ATOM 3365 O WAT 3422 142.950 125.801 104.764 1.00 0.00 O ATOM 3366 H1 WAT 3422 142.283 126.279 104.271 1.00 0.00 H ATOM 3367 H2 WAT 3422 142.659 125.851 105.674 1.00 0.00 H TER 3369 WAT 3422 ATOM 3369 O WAT 3423 7.903 17.520 134.744 1.00 0.00 O ATOM 3370 H1 WAT 3423 8.310 17.250 133.921 1.00 0.00 H ATOM 3371 H2 WAT 3423 8.322 16.975 135.409 1.00 0.00 H TER 3373 WAT 3423 ATOM 3373 O WAT 3424 134.591 127.885 138.506 1.00 0.00 O ATOM 3374 H1 WAT 3424 134.541 127.666 139.436 1.00 0.00 H ATOM 3375 H2 WAT 3424 133.772 127.552 138.138 1.00 0.00 H TER 3377 WAT 3424 ATOM 3377 O WAT 3425 32.124 123.815 13.122 1.00 0.00 O ATOM 3378 H1 WAT 3425 32.492 124.156 13.938 1.00 0.00 H ATOM 3379 H2 WAT 3425 32.860 123.812 12.510 1.00 0.00 H TER 3381 WAT 3425 ATOM 3381 O WAT 3426 79.592 35.359 104.086 1.00 0.00 O ATOM 3382 H1 WAT 3426 80.258 34.868 103.604 1.00 0.00 H ATOM 3383 H2 WAT 3426 79.877 36.271 104.026 1.00 0.00 H TER 3385 WAT 3426 ATOM 3385 O WAT 3427 77.988 86.885 126.992 1.00 0.00 O ATOM 3386 H1 WAT 3427 77.267 86.886 127.621 1.00 0.00 H ATOM 3387 H2 WAT 3427 78.314 87.785 127.000 1.00 0.00 H TER 3389 WAT 3427 ATOM 3389 O WAT 3428 56.485 32.476 109.486 1.00 0.00 O ATOM 3390 H1 WAT 3428 56.225 33.302 109.077 1.00 0.00 H ATOM 3391 H2 WAT 3428 57.433 32.551 109.597 1.00 0.00 H TER 3393 WAT 3428 ATOM 3393 O WAT 3429 93.728 61.147 155.596 1.00 0.00 O ATOM 3394 H1 WAT 3429 94.275 61.929 155.519 1.00 0.00 H ATOM 3395 H2 WAT 3429 92.848 61.447 155.368 1.00 0.00 H TER 3397 WAT 3429 ATOM 3397 O WAT 3430 58.634 94.767 81.763 1.00 0.00 O ATOM 3398 H1 WAT 3430 59.131 95.537 82.042 1.00 0.00 H ATOM 3399 H2 WAT 3430 57.898 94.724 82.373 1.00 0.00 H TER 3401 WAT 3430 ATOM 3401 O WAT 3431 78.733 91.039 15.031 1.00 0.00 O ATOM 3402 H1 WAT 3431 79.458 91.287 14.457 1.00 0.00 H ATOM 3403 H2 WAT 3431 78.735 90.082 15.019 1.00 0.00 H TER 3405 WAT 3431 ATOM 3405 O WAT 3432 108.071 70.549 150.376 1.00 0.00 O ATOM 3406 H1 WAT 3432 108.673 69.831 150.183 1.00 0.00 H ATOM 3407 H2 WAT 3432 107.252 70.297 149.950 1.00 0.00 H TER 3409 WAT 3432 ATOM 3409 O WAT 3433 35.090 111.990 102.243 1.00 0.00 O ATOM 3410 H1 WAT 3433 35.448 111.906 101.359 1.00 0.00 H ATOM 3411 H2 WAT 3433 34.411 112.660 102.165 1.00 0.00 H TER 3413 WAT 3433 ATOM 3413 O WAT 3434 79.098 123.726 14.129 1.00 0.00 O ATOM 3414 H1 WAT 3434 79.360 122.823 14.310 1.00 0.00 H ATOM 3415 H2 WAT 3434 79.912 124.227 14.182 1.00 0.00 H TER 3417 WAT 3434 ATOM 3417 O WAT 3435 131.702 94.240 3.842 1.00 0.00 O ATOM 3418 H1 WAT 3435 131.954 94.200 4.764 1.00 0.00 H ATOM 3419 H2 WAT 3435 132.264 94.919 3.469 1.00 0.00 H TER 3421 WAT 3435 ATOM 3421 O WAT 3436 15.687 29.407 9.375 1.00 0.00 O ATOM 3422 H1 WAT 3436 14.898 29.266 9.898 1.00 0.00 H ATOM 3423 H2 WAT 3436 15.420 29.204 8.479 1.00 0.00 H TER 3425 WAT 3436 ATOM 3425 O WAT 3437 84.823 119.383 146.457 1.00 0.00 O ATOM 3426 H1 WAT 3437 84.796 120.340 146.457 1.00 0.00 H ATOM 3427 H2 WAT 3437 83.908 119.117 146.542 1.00 0.00 H TER 3429 WAT 3437 ATOM 3429 O WAT 3438 142.777 87.648 82.202 1.00 0.00 O ATOM 3430 H1 WAT 3438 142.153 87.884 82.889 1.00 0.00 H ATOM 3431 H2 WAT 3438 143.571 87.397 82.676 1.00 0.00 H TER 3433 WAT 3438 ATOM 3433 O WAT 3439 60.772 44.771 90.021 1.00 0.00 O ATOM 3434 H1 WAT 3439 60.728 45.457 90.687 1.00 0.00 H ATOM 3435 H2 WAT 3439 61.536 45.000 89.492 1.00 0.00 H TER 3437 WAT 3439 ATOM 3437 O WAT 3440 14.462 63.515 9.059 1.00 0.00 O ATOM 3438 H1 WAT 3440 14.504 63.474 8.104 1.00 0.00 H ATOM 3439 H2 WAT 3440 15.143 62.911 9.355 1.00 0.00 H TER 3441 WAT 3440 ATOM 3441 O WAT 3441 38.619 74.544 150.116 1.00 0.00 O ATOM 3442 H1 WAT 3441 39.010 75.139 150.756 1.00 0.00 H ATOM 3443 H2 WAT 3441 39.365 74.181 149.638 1.00 0.00 H TER 3445 WAT 3441 ATOM 3445 O WAT 3442 88.383 92.054 146.377 1.00 0.00 O ATOM 3446 H1 WAT 3442 89.060 92.729 146.339 1.00 0.00 H ATOM 3447 H2 WAT 3442 87.567 92.540 146.494 1.00 0.00 H TER 3449 WAT 3442 ATOM 3449 O WAT 3443 19.422 109.195 141.113 1.00 0.00 O ATOM 3450 H1 WAT 3443 19.133 108.324 141.382 1.00 0.00 H ATOM 3451 H2 WAT 3443 19.203 109.243 140.182 1.00 0.00 H TER 3453 WAT 3443 ATOM 3453 O WAT 3444 24.645 130.269 13.989 1.00 0.00 O ATOM 3454 H1 WAT 3444 25.386 129.671 14.094 1.00 0.00 H ATOM 3455 H2 WAT 3444 24.961 131.104 14.334 1.00 0.00 H TER 3457 WAT 3444 ATOM 3457 O WAT 3445 60.568 127.265 77.416 1.00 0.00 O ATOM 3458 H1 WAT 3445 60.689 127.314 76.468 1.00 0.00 H ATOM 3459 H2 WAT 3445 60.967 128.068 77.751 1.00 0.00 H TER 3461 WAT 3445 ATOM 3461 O WAT 3446 90.238 12.928 76.169 1.00 0.00 O ATOM 3462 H1 WAT 3446 90.675 12.729 76.997 1.00 0.00 H ATOM 3463 H2 WAT 3446 90.251 13.883 76.114 1.00 0.00 H TER 3465 WAT 3446 ATOM 3465 O WAT 3447 23.122 130.655 95.993 1.00 0.00 O ATOM 3466 H1 WAT 3447 23.907 130.263 96.376 1.00 0.00 H ATOM 3467 H2 WAT 3447 22.434 130.496 96.640 1.00 0.00 H TER 3469 WAT 3447 ATOM 3469 O WAT 3448 85.853 17.971 15.248 1.00 0.00 O ATOM 3470 H1 WAT 3448 85.127 18.570 15.075 1.00 0.00 H ATOM 3471 H2 WAT 3448 85.547 17.123 14.929 1.00 0.00 H TER 3473 WAT 3448 ATOM 3473 O WAT 3449 99.331 26.175 96.579 1.00 0.00 O ATOM 3474 H1 WAT 3449 100.069 26.473 97.111 1.00 0.00 H ATOM 3475 H2 WAT 3449 99.539 26.472 95.693 1.00 0.00 H TER 3477 WAT 3449 ATOM 3477 O WAT 3450 57.908 74.598 113.826 1.00 0.00 O ATOM 3478 H1 WAT 3450 57.437 75.263 113.323 1.00 0.00 H ATOM 3479 H2 WAT 3450 57.446 73.781 113.635 1.00 0.00 H TER 3481 WAT 3450 ATOM 3481 O WAT 3451 80.520 144.944 97.440 1.00 0.00 O ATOM 3482 H1 WAT 3451 80.892 145.640 96.898 1.00 0.00 H ATOM 3483 H2 WAT 3451 79.574 145.078 97.386 1.00 0.00 H TER 3485 WAT 3451 ATOM 3485 O WAT 3452 24.995 14.055 124.658 1.00 0.00 O ATOM 3486 H1 WAT 3452 24.881 13.140 124.916 1.00 0.00 H ATOM 3487 H2 WAT 3452 24.439 14.545 125.264 1.00 0.00 H TER 3489 WAT 3452 ATOM 3489 O WAT 3453 70.176 44.687 72.648 1.00 0.00 O ATOM 3490 H1 WAT 3453 70.671 45.133 73.336 1.00 0.00 H ATOM 3491 H2 WAT 3453 69.462 45.290 72.439 1.00 0.00 H TER 3493 WAT 3453 ATOM 3493 O WAT 3454 140.916 60.705 98.302 1.00 0.00 O ATOM 3494 H1 WAT 3454 141.096 61.579 98.648 1.00 0.00 H ATOM 3495 H2 WAT 3454 139.962 60.626 98.336 1.00 0.00 H TER 3497 WAT 3454 ATOM 3497 O WAT 3455 73.425 91.349 2.305 1.00 0.00 O ATOM 3498 H1 WAT 3455 72.765 92.014 2.502 1.00 0.00 H ATOM 3499 H2 WAT 3455 72.973 90.516 2.441 1.00 0.00 H TER 3501 WAT 3455 ATOM 3501 O WAT 3456 92.899 131.845 116.487 1.00 0.00 O ATOM 3502 H1 WAT 3456 92.995 132.184 117.377 1.00 0.00 H ATOM 3503 H2 WAT 3456 92.925 132.624 115.931 1.00 0.00 H TER 3505 WAT 3456 ATOM 3505 O WAT 3457 131.965 89.142 140.229 1.00 0.00 O ATOM 3506 H1 WAT 3457 132.740 88.926 139.710 1.00 0.00 H ATOM 3507 H2 WAT 3457 131.922 88.454 140.892 1.00 0.00 H TER 3509 WAT 3457 ATOM 3509 O WAT 3458 135.391 54.800 80.498 1.00 0.00 O ATOM 3510 H1 WAT 3458 136.261 54.462 80.710 1.00 0.00 H ATOM 3511 H2 WAT 3458 134.821 54.032 80.532 1.00 0.00 H TER 3513 WAT 3458 ATOM 3513 O WAT 3459 50.180 126.186 88.187 1.00 0.00 O ATOM 3514 H1 WAT 3459 51.056 126.572 88.215 1.00 0.00 H ATOM 3515 H2 WAT 3459 50.333 125.242 88.236 1.00 0.00 H TER 3517 WAT 3459 ATOM 3517 O WAT 3460 70.128 7.426 136.802 1.00 0.00 O ATOM 3518 H1 WAT 3460 69.608 7.078 137.527 1.00 0.00 H ATOM 3519 H2 WAT 3460 69.779 8.305 136.658 1.00 0.00 H TER 3521 WAT 3460 ATOM 3521 O WAT 3461 98.307 143.536 8.672 1.00 0.00 O ATOM 3522 H1 WAT 3461 97.451 143.907 8.889 1.00 0.00 H ATOM 3523 H2 WAT 3461 98.296 143.448 7.719 1.00 0.00 H TER 3525 WAT 3461 ATOM 3525 O WAT 3462 121.431 55.360 64.844 1.00 0.00 O ATOM 3526 H1 WAT 3462 120.757 54.681 64.876 1.00 0.00 H ATOM 3527 H2 WAT 3462 121.264 55.826 64.025 1.00 0.00 H TER 3529 WAT 3462 ATOM 3529 O WAT 3463 101.548 6.663 69.197 1.00 0.00 O ATOM 3530 H1 WAT 3463 101.730 7.573 68.964 1.00 0.00 H ATOM 3531 H2 WAT 3463 101.791 6.163 68.418 1.00 0.00 H TER 3533 WAT 3463 ATOM 3533 O WAT 3464 11.777 11.520 74.648 1.00 0.00 O ATOM 3534 H1 WAT 3464 11.638 11.474 73.702 1.00 0.00 H ATOM 3535 H2 WAT 3464 12.728 11.549 74.750 1.00 0.00 H TER 3537 WAT 3464 ATOM 3537 O WAT 3465 61.781 90.151 100.453 1.00 0.00 O ATOM 3538 H1 WAT 3465 61.080 89.808 101.007 1.00 0.00 H ATOM 3539 H2 WAT 3465 61.629 89.749 99.598 1.00 0.00 H TER 3541 WAT 3465 ATOM 3541 O WAT 3466 100.123 31.566 120.173 1.00 0.00 O ATOM 3542 H1 WAT 3466 100.458 32.354 120.600 1.00 0.00 H ATOM 3543 H2 WAT 3466 100.403 30.848 120.742 1.00 0.00 H TER 3545 WAT 3466 ATOM 3545 O WAT 3467 22.093 112.131 54.383 1.00 0.00 O ATOM 3546 H1 WAT 3467 22.763 112.573 53.863 1.00 0.00 H ATOM 3547 H2 WAT 3467 21.624 112.840 54.823 1.00 0.00 H TER 3549 WAT 3467 ATOM 3549 O WAT 3468 142.257 107.874 6.607 1.00 0.00 O ATOM 3550 H1 WAT 3468 142.141 108.153 7.515 1.00 0.00 H ATOM 3551 H2 WAT 3468 141.402 108.018 6.201 1.00 0.00 H TER 3553 WAT 3468 ATOM 3553 O WAT 3469 104.467 76.879 138.535 1.00 0.00 O ATOM 3554 H1 WAT 3469 104.006 76.092 138.245 1.00 0.00 H ATOM 3555 H2 WAT 3469 104.933 76.607 139.325 1.00 0.00 H TER 3557 WAT 3469 ATOM 3557 O WAT 3470 35.120 95.004 21.719 1.00 0.00 O ATOM 3558 H1 WAT 3470 35.384 94.406 22.417 1.00 0.00 H ATOM 3559 H2 WAT 3470 34.670 95.717 22.172 1.00 0.00 H TER 3561 WAT 3470 ATOM 3561 O WAT 3471 142.969 98.686 141.711 1.00 0.00 O ATOM 3562 H1 WAT 3471 143.838 98.644 142.108 1.00 0.00 H ATOM 3563 H2 WAT 3471 142.949 99.533 141.266 1.00 0.00 H TER 3565 WAT 3471 ATOM 3565 O WAT 3472 6.228 73.382 72.239 1.00 0.00 O ATOM 3566 H1 WAT 3472 6.893 74.069 72.282 1.00 0.00 H ATOM 3567 H2 WAT 3472 6.702 72.609 71.933 1.00 0.00 H TER 3569 WAT 3472 ATOM 3569 O WAT 3473 95.810 140.705 5.497 1.00 0.00 O ATOM 3570 H1 WAT 3473 96.721 140.442 5.364 1.00 0.00 H ATOM 3571 H2 WAT 3473 95.445 140.024 6.061 1.00 0.00 H TER 3573 WAT 3473 ATOM 3573 O WAT 3474 82.932 28.355 118.609 1.00 0.00 O ATOM 3574 H1 WAT 3474 82.451 28.996 118.086 1.00 0.00 H ATOM 3575 H2 WAT 3474 82.818 27.528 118.140 1.00 0.00 H TER 3577 WAT 3474 ATOM 3577 O WAT 3475 53.634 8.754 64.091 1.00 0.00 O ATOM 3578 H1 WAT 3475 53.828 7.826 63.960 1.00 0.00 H ATOM 3579 H2 WAT 3475 52.995 8.964 63.410 1.00 0.00 H TER 3581 WAT 3475 ATOM 3581 O WAT 3476 111.669 28.504 147.967 1.00 0.00 O ATOM 3582 H1 WAT 3476 112.242 28.875 148.639 1.00 0.00 H ATOM 3583 H2 WAT 3476 112.102 27.691 147.706 1.00 0.00 H TER 3585 WAT 3476 ATOM 3585 O WAT 3477 32.847 88.364 149.881 1.00 0.00 O ATOM 3586 H1 WAT 3477 32.800 87.412 149.792 1.00 0.00 H ATOM 3587 H2 WAT 3477 32.702 88.695 148.994 1.00 0.00 H TER 3589 WAT 3477 ATOM 3589 O WAT 3478 132.551 26.467 66.905 1.00 0.00 O ATOM 3590 H1 WAT 3478 133.342 25.957 67.081 1.00 0.00 H ATOM 3591 H2 WAT 3478 132.104 25.984 66.210 1.00 0.00 H TER 3593 WAT 3478 ATOM 3593 O WAT 3479 69.998 77.981 114.418 1.00 0.00 O ATOM 3594 H1 WAT 3479 70.606 78.291 115.089 1.00 0.00 H ATOM 3595 H2 WAT 3479 70.508 77.996 113.608 1.00 0.00 H TER 3597 WAT 3479 ATOM 3597 O WAT 3480 2.448 82.889 116.834 1.00 0.00 O ATOM 3598 H1 WAT 3480 1.723 82.265 116.799 1.00 0.00 H ATOM 3599 H2 WAT 3480 3.234 82.343 116.851 1.00 0.00 H TER 3601 WAT 3480 ATOM 3601 O WAT 3481 93.520 36.528 126.701 1.00 0.00 O ATOM 3602 H1 WAT 3481 93.602 37.290 127.275 1.00 0.00 H ATOM 3603 H2 WAT 3481 92.953 35.925 127.183 1.00 0.00 H TER 3605 WAT 3481 ATOM 3605 O WAT 3482 101.752 107.738 104.694 1.00 0.00 O ATOM 3606 H1 WAT 3482 100.903 107.859 105.120 1.00 0.00 H ATOM 3607 H2 WAT 3482 101.716 106.851 104.335 1.00 0.00 H TER 3609 WAT 3482 ATOM 3609 O WAT 3483 102.184 128.072 99.411 1.00 0.00 O ATOM 3610 H1 WAT 3483 102.491 128.144 100.314 1.00 0.00 H ATOM 3611 H2 WAT 3483 102.051 127.134 99.277 1.00 0.00 H TER 3613 WAT 3483 ATOM 3613 O WAT 3484 85.554 74.183 57.937 1.00 0.00 O ATOM 3614 H1 WAT 3484 85.574 73.266 57.665 1.00 0.00 H ATOM 3615 H2 WAT 3484 85.698 74.676 57.129 1.00 0.00 H TER 3617 WAT 3484 ATOM 3617 O WAT 3485 95.037 52.202 150.570 1.00 0.00 O ATOM 3618 H1 WAT 3485 95.630 51.662 150.047 1.00 0.00 H ATOM 3619 H2 WAT 3485 95.284 53.102 150.360 1.00 0.00 H TER 3621 WAT 3485 ATOM 3621 O WAT 3486 111.282 7.754 68.883 1.00 0.00 O ATOM 3622 H1 WAT 3486 111.560 7.979 69.771 1.00 0.00 H ATOM 3623 H2 WAT 3486 112.084 7.471 68.445 1.00 0.00 H TER 3625 WAT 3486 ATOM 3625 O WAT 3487 109.467 34.163 110.105 1.00 0.00 O ATOM 3626 H1 WAT 3487 110.234 34.504 109.645 1.00 0.00 H ATOM 3627 H2 WAT 3487 109.205 33.396 109.595 1.00 0.00 H TER 3629 WAT 3487 ATOM 3629 O WAT 3488 108.551 40.915 133.402 1.00 0.00 O ATOM 3630 H1 WAT 3488 109.449 40.826 133.721 1.00 0.00 H ATOM 3631 H2 WAT 3488 108.106 41.428 134.077 1.00 0.00 H TER 3633 WAT 3488 ATOM 3633 O WAT 3489 100.041 20.113 62.343 1.00 0.00 O ATOM 3634 H1 WAT 3489 99.930 19.731 63.213 1.00 0.00 H ATOM 3635 H2 WAT 3489 99.785 21.029 62.450 1.00 0.00 H TER 3637 WAT 3489 ATOM 3637 O WAT 3490 49.872 13.190 14.136 1.00 0.00 O ATOM 3638 H1 WAT 3490 50.180 13.806 14.800 1.00 0.00 H ATOM 3639 H2 WAT 3490 50.632 12.640 13.948 1.00 0.00 H TER 3641 WAT 3490 ATOM 3641 O WAT 3491 100.421 98.674 158.418 1.00 0.00 O ATOM 3642 H1 WAT 3491 100.127 98.648 157.507 1.00 0.00 H ATOM 3643 H2 WAT 3491 101.338 98.943 158.366 1.00 0.00 H TER 3645 WAT 3491 ATOM 3645 O WAT 3492 86.168 32.545 7.340 1.00 0.00 O ATOM 3646 H1 WAT 3492 86.822 32.063 7.846 1.00 0.00 H ATOM 3647 H2 WAT 3492 86.668 33.225 6.889 1.00 0.00 H TER 3649 WAT 3492 ATOM 3649 O WAT 3493 51.406 108.140 68.715 1.00 0.00 O ATOM 3650 H1 WAT 3493 51.743 107.246 68.765 1.00 0.00 H ATOM 3651 H2 WAT 3493 51.082 108.225 67.818 1.00 0.00 H TER 3653 WAT 3493 ATOM 3653 O WAT 3494 124.787 120.041 84.660 1.00 0.00 O ATOM 3654 H1 WAT 3494 124.759 120.799 84.076 1.00 0.00 H ATOM 3655 H2 WAT 3494 125.092 120.393 85.496 1.00 0.00 H TER 3657 WAT 3494 ATOM 3657 O WAT 3495 53.607 27.864 4.794 1.00 0.00 O ATOM 3658 H1 WAT 3495 54.516 27.941 5.083 1.00 0.00 H ATOM 3659 H2 WAT 3495 53.168 27.400 5.507 1.00 0.00 H TER 3661 WAT 3495 ATOM 3661 O WAT 3496 95.870 111.130 25.912 1.00 0.00 O ATOM 3662 H1 WAT 3496 95.078 110.612 26.055 1.00 0.00 H ATOM 3663 H2 WAT 3496 95.634 112.013 26.197 1.00 0.00 H TER 3665 WAT 3496 ATOM 3665 O WAT 3497 51.233 92.422 62.244 1.00 0.00 O ATOM 3666 H1 WAT 3497 51.657 93.246 62.005 1.00 0.00 H ATOM 3667 H2 WAT 3497 50.490 92.683 62.787 1.00 0.00 H TER 3669 WAT 3497 ATOM 3669 O WAT 3498 77.063 115.960 76.358 1.00 0.00 O ATOM 3670 H1 WAT 3498 76.147 116.170 76.180 1.00 0.00 H ATOM 3671 H2 WAT 3498 77.275 116.459 77.147 1.00 0.00 H TER 3673 WAT 3498 ATOM 3673 O WAT 3499 33.211 101.207 145.410 1.00 0.00 O ATOM 3674 H1 WAT 3499 32.352 101.589 145.589 1.00 0.00 H ATOM 3675 H2 WAT 3499 33.409 101.473 144.512 1.00 0.00 H TER 3677 WAT 3499 ATOM 3677 O WAT 3500 72.974 48.730 158.497 1.00 0.00 O ATOM 3678 H1 WAT 3500 72.278 48.159 158.170 1.00 0.00 H ATOM 3679 H2 WAT 3500 72.843 48.746 159.445 1.00 0.00 H TER 3681 WAT 3500 ATOM 3681 O WAT 3501 16.009 124.861 108.816 1.00 0.00 O ATOM 3682 H1 WAT 3501 15.168 125.283 108.640 1.00 0.00 H ATOM 3683 H2 WAT 3501 16.032 124.760 109.768 1.00 0.00 H TER 3685 WAT 3501 ATOM 3685 O WAT 3502 127.794 13.773 94.000 1.00 0.00 O ATOM 3686 H1 WAT 3502 126.993 13.255 93.921 1.00 0.00 H ATOM 3687 H2 WAT 3502 128.331 13.290 94.627 1.00 0.00 H TER 3689 WAT 3502 ATOM 3689 O WAT 3503 128.118 17.276 155.696 1.00 0.00 O ATOM 3690 H1 WAT 3503 128.000 16.433 155.259 1.00 0.00 H ATOM 3691 H2 WAT 3503 127.523 17.869 155.236 1.00 0.00 H TER 3693 WAT 3503 ATOM 3693 O WAT 3504 91.948 116.650 11.481 1.00 0.00 O ATOM 3694 H1 WAT 3504 91.450 116.673 10.664 1.00 0.00 H ATOM 3695 H2 WAT 3504 91.500 115.995 12.016 1.00 0.00 H TER 3697 WAT 3504 ATOM 3697 O WAT 3505 144.767 116.814 76.811 1.00 0.00 O ATOM 3698 H1 WAT 3505 144.149 117.194 77.436 1.00 0.00 H ATOM 3699 H2 WAT 3505 145.007 117.543 76.239 1.00 0.00 H TER 3701 WAT 3505 ATOM 3701 O WAT 3506 18.024 71.369 123.023 1.00 0.00 O ATOM 3702 H1 WAT 3506 17.469 71.299 123.800 1.00 0.00 H ATOM 3703 H2 WAT 3506 17.814 70.590 122.508 1.00 0.00 H TER 3705 WAT 3506 ATOM 3705 O WAT 3507 53.546 25.277 63.492 1.00 0.00 O ATOM 3706 H1 WAT 3507 53.258 26.001 64.049 1.00 0.00 H ATOM 3707 H2 WAT 3507 52.924 24.573 63.674 1.00 0.00 H TER 3709 WAT 3507 ATOM 3709 O WAT 3508 64.050 93.039 71.041 1.00 0.00 O ATOM 3710 H1 WAT 3508 64.673 92.514 70.537 1.00 0.00 H ATOM 3711 H2 WAT 3508 63.397 92.409 71.345 1.00 0.00 H TER 3713 WAT 3508 ATOM 3713 O WAT 3509 101.094 143.532 150.210 1.00 0.00 O ATOM 3714 H1 WAT 3509 100.787 144.376 150.541 1.00 0.00 H ATOM 3715 H2 WAT 3509 100.639 142.884 150.748 1.00 0.00 H TER 3717 WAT 3509 ATOM 3717 O WAT 3510 34.430 141.978 88.671 1.00 0.00 O ATOM 3718 H1 WAT 3510 33.915 142.749 88.908 1.00 0.00 H ATOM 3719 H2 WAT 3510 35.318 142.311 88.548 1.00 0.00 H TER 3721 WAT 3510 ATOM 3721 O WAT 3511 84.014 48.370 143.899 1.00 0.00 O ATOM 3722 H1 WAT 3511 84.012 48.959 144.653 1.00 0.00 H ATOM 3723 H2 WAT 3511 83.396 48.766 143.284 1.00 0.00 H TER 3725 WAT 3511 ATOM 3725 O WAT 3512 136.292 88.720 150.300 1.00 0.00 O ATOM 3726 H1 WAT 3512 136.127 88.188 151.079 1.00 0.00 H ATOM 3727 H2 WAT 3512 135.993 89.597 150.541 1.00 0.00 H TER 3729 WAT 3512 ATOM 3729 O WAT 3513 43.053 141.350 18.625 1.00 0.00 O ATOM 3730 H1 WAT 3513 42.800 141.873 19.385 1.00 0.00 H ATOM 3731 H2 WAT 3513 42.936 140.443 18.908 1.00 0.00 H TER 3733 WAT 3513 ATOM 3733 O WAT 3514 33.046 114.600 77.853 1.00 0.00 O ATOM 3734 H1 WAT 3514 33.392 115.485 77.736 1.00 0.00 H ATOM 3735 H2 WAT 3514 32.669 114.376 77.003 1.00 0.00 H TER 3737 WAT 3514 ATOM 3737 O WAT 3515 32.506 101.419 125.512 1.00 0.00 O ATOM 3738 H1 WAT 3515 32.417 102.372 125.513 1.00 0.00 H ATOM 3739 H2 WAT 3515 33.356 101.258 125.923 1.00 0.00 H TER 3741 WAT 3515 ATOM 3741 O WAT 3516 38.927 95.707 100.820 1.00 0.00 O ATOM 3742 H1 WAT 3516 39.258 94.951 101.305 1.00 0.00 H ATOM 3743 H2 WAT 3516 39.704 96.089 100.412 1.00 0.00 H TER 3745 WAT 3516 ATOM 3745 O WAT 3517 125.125 58.839 88.219 1.00 0.00 O ATOM 3746 H1 WAT 3517 125.355 58.090 87.669 1.00 0.00 H ATOM 3747 H2 WAT 3517 124.893 59.529 87.598 1.00 0.00 H TER 3749 WAT 3517 ATOM 3749 O WAT 3518 72.713 135.952 23.252 1.00 0.00 O ATOM 3750 H1 WAT 3518 73.189 136.783 23.264 1.00 0.00 H ATOM 3751 H2 WAT 3518 71.818 136.185 23.497 1.00 0.00 H TER 3753 WAT 3518 ATOM 3753 O WAT 3519 135.508 0.767 122.478 1.00 0.00 O ATOM 3754 H1 WAT 3519 135.597 1.666 122.161 1.00 0.00 H ATOM 3755 H2 WAT 3519 136.063 0.732 123.256 1.00 0.00 H TER 3757 WAT 3519 ATOM 3757 O WAT 3520 110.048 60.728 116.013 1.00 0.00 O ATOM 3758 H1 WAT 3520 110.730 60.661 116.682 1.00 0.00 H ATOM 3759 H2 WAT 3520 110.524 60.911 115.203 1.00 0.00 H TER 3761 WAT 3520 ATOM 3761 O WAT 3521 113.330 73.054 18.868 1.00 0.00 O ATOM 3762 H1 WAT 3521 112.439 72.819 19.130 1.00 0.00 H ATOM 3763 H2 WAT 3521 113.488 73.899 19.287 1.00 0.00 H TER 3765 WAT 3521 ATOM 3765 O WAT 3522 96.786 54.279 0.757 1.00 0.00 O ATOM 3766 H1 WAT 3522 97.410 55.001 0.682 1.00 0.00 H ATOM 3767 H2 WAT 3522 96.467 54.331 1.658 1.00 0.00 H TER 3769 WAT 3522 ATOM 3769 O WAT 3523 145.894 46.698 102.489 1.00 0.00 O ATOM 3770 H1 WAT 3523 146.411 47.431 102.155 1.00 0.00 H ATOM 3771 H2 WAT 3523 145.250 47.104 103.070 1.00 0.00 H TER 3773 WAT 3523 ATOM 3773 O WAT 3524 128.575 75.203 144.200 1.00 0.00 O ATOM 3774 H1 WAT 3524 128.345 74.912 143.318 1.00 0.00 H ATOM 3775 H2 WAT 3524 127.749 75.173 144.685 1.00 0.00 H TER 3777 WAT 3524 ATOM 3777 O WAT 3525 13.082 36.628 0.360 1.00 0.00 O ATOM 3778 H1 WAT 3525 12.321 36.140 0.676 1.00 0.00 H ATOM 3779 H2 WAT 3525 13.190 37.338 0.993 1.00 0.00 H TER 3781 WAT 3525 ATOM 3781 O WAT 3526 100.729 99.482 104.435 1.00 0.00 O ATOM 3782 H1 WAT 3526 101.171 99.474 105.284 1.00 0.00 H ATOM 3783 H2 WAT 3526 99.881 99.070 104.602 1.00 0.00 H TER 3785 WAT 3526 ATOM 3785 O WAT 3527 28.038 29.806 120.674 1.00 0.00 O ATOM 3786 H1 WAT 3527 27.774 29.140 120.039 1.00 0.00 H ATOM 3787 H2 WAT 3527 28.836 30.185 120.305 1.00 0.00 H TER 3789 WAT 3527 ATOM 3789 O WAT 3528 133.494 129.436 133.488 1.00 0.00 O ATOM 3790 H1 WAT 3528 134.357 129.212 133.140 1.00 0.00 H ATOM 3791 H2 WAT 3528 133.158 130.099 132.885 1.00 0.00 H TER 3793 WAT 3528 ATOM 3793 O WAT 3529 97.378 59.018 7.452 1.00 0.00 O ATOM 3794 H1 WAT 3529 96.425 58.967 7.524 1.00 0.00 H ATOM 3795 H2 WAT 3529 97.531 59.554 6.674 1.00 0.00 H TER 3797 WAT 3529 ATOM 3797 O WAT 3530 82.932 132.197 58.599 1.00 0.00 O ATOM 3798 H1 WAT 3530 82.312 132.791 58.176 1.00 0.00 H ATOM 3799 H2 WAT 3530 82.741 131.340 58.218 1.00 0.00 H TER 3801 WAT 3530 ATOM 3801 O WAT 3531 66.405 130.420 136.352 1.00 0.00 O ATOM 3802 H1 WAT 3531 66.644 129.552 136.677 1.00 0.00 H ATOM 3803 H2 WAT 3531 67.229 130.906 136.336 1.00 0.00 H TER 3805 WAT 3531 ATOM 3805 O WAT 3532 38.108 21.712 122.316 1.00 0.00 O ATOM 3806 H1 WAT 3532 37.291 22.186 122.471 1.00 0.00 H ATOM 3807 H2 WAT 3532 38.491 21.603 123.187 1.00 0.00 H TER 3809 WAT 3532 ATOM 3809 O WAT 3533 122.687 117.356 155.263 1.00 0.00 O ATOM 3810 H1 WAT 3533 121.943 117.004 155.752 1.00 0.00 H ATOM 3811 H2 WAT 3533 123.400 116.742 155.436 1.00 0.00 H TER 3813 WAT 3533 ATOM 3813 O WAT 3534 0.037 71.535 74.099 1.00 0.00 O ATOM 3814 H1 WAT 3534 -0.725 70.989 73.907 1.00 0.00 H ATOM 3815 H2 WAT 3534 0.775 70.925 74.097 1.00 0.00 H TER 3817 WAT 3534 ATOM 3817 O WAT 3535 28.207 11.374 70.242 1.00 0.00 O ATOM 3818 H1 WAT 3535 27.362 10.983 70.022 1.00 0.00 H ATOM 3819 H2 WAT 3535 28.203 11.431 71.198 1.00 0.00 H TER 3821 WAT 3535 ATOM 3821 O WAT 3536 100.139 62.551 124.784 1.00 0.00 O ATOM 3822 H1 WAT 3536 100.164 63.188 125.498 1.00 0.00 H ATOM 3823 H2 WAT 3536 99.207 62.403 124.627 1.00 0.00 H TER 3825 WAT 3536 ATOM 3825 O WAT 3537 62.535 22.338 64.422 1.00 0.00 O ATOM 3826 H1 WAT 3537 61.835 22.052 63.835 1.00 0.00 H ATOM 3827 H2 WAT 3537 63.135 21.593 64.460 1.00 0.00 H TER 3829 WAT 3537 ATOM 3829 O WAT 3538 11.716 125.720 146.463 1.00 0.00 O ATOM 3830 H1 WAT 3538 11.962 126.265 147.211 1.00 0.00 H ATOM 3831 H2 WAT 3538 12.178 124.894 146.607 1.00 0.00 H TER 3833 WAT 3538 ATOM 3833 O WAT 3539 31.485 27.337 129.299 1.00 0.00 O ATOM 3834 H1 WAT 3539 31.778 27.874 128.562 1.00 0.00 H ATOM 3835 H2 WAT 3539 30.550 27.205 129.142 1.00 0.00 H TER 3837 WAT 3539 ATOM 3837 O WAT 3540 36.736 85.074 94.344 1.00 0.00 O ATOM 3838 H1 WAT 3540 35.846 85.169 94.684 1.00 0.00 H ATOM 3839 H2 WAT 3540 37.298 85.391 95.051 1.00 0.00 H TER 3841 WAT 3540 ATOM 3841 O WAT 3541 91.920 50.756 147.750 1.00 0.00 O ATOM 3842 H1 WAT 3541 90.970 50.645 147.734 1.00 0.00 H ATOM 3843 H2 WAT 3541 92.104 51.117 148.617 1.00 0.00 H TER 3845 WAT 3541 ATOM 3845 O WAT 3542 117.512 124.037 55.392 1.00 0.00 O ATOM 3846 H1 WAT 3542 117.033 123.227 55.566 1.00 0.00 H ATOM 3847 H2 WAT 3542 118.317 123.954 55.903 1.00 0.00 H TER 3849 WAT 3542 ATOM 3849 O WAT 3543 132.834 27.171 98.484 1.00 0.00 O ATOM 3850 H1 WAT 3543 131.882 27.210 98.567 1.00 0.00 H ATOM 3851 H2 WAT 3543 133.004 26.327 98.066 1.00 0.00 H TER 3853 WAT 3543 ATOM 3853 O WAT 3544 82.111 57.748 94.514 1.00 0.00 O ATOM 3854 H1 WAT 3544 82.548 58.572 94.730 1.00 0.00 H ATOM 3855 H2 WAT 3544 81.272 57.794 94.973 1.00 0.00 H TER 3857 WAT 3544 ATOM 3857 O WAT 3545 48.456 66.939 83.724 1.00 0.00 O ATOM 3858 H1 WAT 3545 48.250 66.437 82.935 1.00 0.00 H ATOM 3859 H2 WAT 3545 49.067 67.613 83.426 1.00 0.00 H TER 3861 WAT 3545 ATOM 3861 O WAT 3546 135.080 12.789 113.764 1.00 0.00 O ATOM 3862 H1 WAT 3546 134.252 12.934 114.220 1.00 0.00 H ATOM 3863 H2 WAT 3546 135.360 11.918 114.046 1.00 0.00 H TER 3865 WAT 3546 ATOM 3865 O WAT 3547 27.170 139.642 15.010 1.00 0.00 O ATOM 3866 H1 WAT 3547 27.055 139.757 15.954 1.00 0.00 H ATOM 3867 H2 WAT 3547 26.477 139.032 14.757 1.00 0.00 H TER 3869 WAT 3547 ATOM 3869 O WAT 3548 115.333 49.972 112.924 1.00 0.00 O ATOM 3870 H1 WAT 3548 114.872 50.515 113.563 1.00 0.00 H ATOM 3871 H2 WAT 3548 116.214 49.874 113.284 1.00 0.00 H TER 3873 WAT 3548 ATOM 3873 O WAT 3549 114.574 105.283 142.976 1.00 0.00 O ATOM 3874 H1 WAT 3549 114.382 104.492 143.480 1.00 0.00 H ATOM 3875 H2 WAT 3549 114.333 106.002 143.559 1.00 0.00 H TER 3877 WAT 3549 ATOM 3877 O WAT 3550 46.818 83.296 150.838 1.00 0.00 O ATOM 3878 H1 WAT 3550 46.238 83.777 150.248 1.00 0.00 H ATOM 3879 H2 WAT 3550 47.699 83.483 150.512 1.00 0.00 H TER 3881 WAT 3550 ATOM 3881 O WAT 3551 139.495 5.380 144.648 1.00 0.00 O ATOM 3882 H1 WAT 3551 140.404 5.089 144.580 1.00 0.00 H ATOM 3883 H2 WAT 3551 139.557 6.300 144.907 1.00 0.00 H TER 3885 WAT 3551 ATOM 3885 O WAT 3552 94.422 25.665 80.132 1.00 0.00 O ATOM 3886 H1 WAT 3552 94.419 26.610 79.976 1.00 0.00 H ATOM 3887 H2 WAT 3552 93.647 25.344 79.672 1.00 0.00 H TER 3889 WAT 3552 ATOM 3889 O WAT 3553 27.119 75.987 63.590 1.00 0.00 O ATOM 3890 H1 WAT 3553 26.343 76.543 63.665 1.00 0.00 H ATOM 3891 H2 WAT 3553 27.324 75.987 62.655 1.00 0.00 H TER 3893 WAT 3553 ATOM 3893 O WAT 3554 143.610 98.781 61.982 1.00 0.00 O ATOM 3894 H1 WAT 3554 142.741 98.510 62.278 1.00 0.00 H ATOM 3895 H2 WAT 3554 143.550 98.775 61.026 1.00 0.00 H TER 3897 WAT 3554 ATOM 3897 O WAT 3555 2.517 22.992 68.006 1.00 0.00 O ATOM 3898 H1 WAT 3555 1.967 23.776 67.984 1.00 0.00 H ATOM 3899 H2 WAT 3555 2.353 22.560 67.168 1.00 0.00 H TER 3901 WAT 3555 ATOM 3901 O WAT 3556 73.609 2.032 108.573 1.00 0.00 O ATOM 3902 H1 WAT 3556 73.561 1.421 109.308 1.00 0.00 H ATOM 3903 H2 WAT 3556 73.209 2.836 108.902 1.00 0.00 H TER 3905 WAT 3556 ATOM 3905 O WAT 3557 8.554 48.139 1.130 1.00 0.00 O ATOM 3906 H1 WAT 3557 8.264 48.817 1.740 1.00 0.00 H ATOM 3907 H2 WAT 3557 7.760 47.882 0.663 1.00 0.00 H TER 3909 WAT 3557 ATOM 3909 O WAT 3558 8.863 59.064 114.119 1.00 0.00 O ATOM 3910 H1 WAT 3558 9.361 58.935 113.312 1.00 0.00 H ATOM 3911 H2 WAT 3558 9.066 59.961 114.385 1.00 0.00 H TER 3913 WAT 3558 ATOM 3913 O WAT 3559 138.170 49.747 65.996 1.00 0.00 O ATOM 3914 H1 WAT 3559 138.805 49.039 65.885 1.00 0.00 H ATOM 3915 H2 WAT 3559 137.348 49.385 65.664 1.00 0.00 H TER 3917 WAT 3559 ATOM 3917 O WAT 3560 123.887 48.063 93.526 1.00 0.00 O ATOM 3918 H1 WAT 3560 124.117 48.500 92.706 1.00 0.00 H ATOM 3919 H2 WAT 3560 124.131 48.689 94.208 1.00 0.00 H TER 3921 WAT 3560 ATOM 3921 O WAT 3561 80.092 128.945 155.488 1.00 0.00 O ATOM 3922 H1 WAT 3561 79.485 128.799 154.762 1.00 0.00 H ATOM 3923 H2 WAT 3561 80.639 129.675 155.200 1.00 0.00 H TER 3925 WAT 3561 ATOM 3925 O WAT 3562 93.476 120.760 128.261 1.00 0.00 O ATOM 3926 H1 WAT 3562 94.432 120.791 128.315 1.00 0.00 H ATOM 3927 H2 WAT 3562 93.206 120.300 129.056 1.00 0.00 H TER 3929 WAT 3562 ATOM 3929 O WAT 3563 77.965 75.522 119.585 1.00 0.00 O ATOM 3930 H1 WAT 3563 77.291 75.158 119.012 1.00 0.00 H ATOM 3931 H2 WAT 3563 78.082 74.861 120.267 1.00 0.00 H TER 3933 WAT 3563 ATOM 3933 O WAT 3564 54.617 131.799 118.533 1.00 0.00 O ATOM 3934 H1 WAT 3564 55.545 131.658 118.719 1.00 0.00 H ATOM 3935 H2 WAT 3564 54.301 130.948 118.229 1.00 0.00 H TER 3937 WAT 3564 ATOM 3937 O WAT 3565 123.034 115.562 139.088 1.00 0.00 O ATOM 3938 H1 WAT 3565 123.863 115.920 139.406 1.00 0.00 H ATOM 3939 H2 WAT 3565 123.124 115.559 138.135 1.00 0.00 H TER 3941 WAT 3565 ATOM 3941 O WAT 3566 109.994 47.857 104.485 1.00 0.00 O ATOM 3942 H1 WAT 3566 110.243 48.672 104.050 1.00 0.00 H ATOM 3943 H2 WAT 3566 109.113 47.671 104.160 1.00 0.00 H TER 3945 WAT 3566 ATOM 3945 O WAT 3567 7.915 2.852 127.404 1.00 0.00 O ATOM 3946 H1 WAT 3567 8.862 2.905 127.536 1.00 0.00 H ATOM 3947 H2 WAT 3567 7.594 2.373 128.167 1.00 0.00 H TER 3949 WAT 3567 ATOM 3949 O WAT 3568 11.571 106.257 158.114 1.00 0.00 O ATOM 3950 H1 WAT 3568 11.476 106.984 157.499 1.00 0.00 H ATOM 3951 H2 WAT 3568 10.828 106.349 158.711 1.00 0.00 H TER 3953 WAT 3568 ATOM 3953 O WAT 3569 39.916 40.035 1.981 1.00 0.00 O ATOM 3954 H1 WAT 3569 40.812 40.355 2.082 1.00 0.00 H ATOM 3955 H2 WAT 3569 39.688 40.244 1.075 1.00 0.00 H TER 3957 WAT 3569 ATOM 3957 O WAT 3570 96.685 125.848 21.869 1.00 0.00 O ATOM 3958 H1 WAT 3570 96.350 125.044 22.266 1.00 0.00 H ATOM 3959 H2 WAT 3570 97.297 125.546 21.198 1.00 0.00 H TER 3961 WAT 3570 ATOM 3961 O WAT 3571 60.039 86.964 124.321 1.00 0.00 O ATOM 3962 H1 WAT 3571 60.131 87.013 125.272 1.00 0.00 H ATOM 3963 H2 WAT 3571 60.382 87.800 124.003 1.00 0.00 H TER 3965 WAT 3571 ATOM 3965 O WAT 3572 115.232 127.109 61.875 1.00 0.00 O ATOM 3966 H1 WAT 3572 114.378 127.507 61.706 1.00 0.00 H ATOM 3967 H2 WAT 3572 115.280 126.375 61.262 1.00 0.00 H TER 3969 WAT 3572 ATOM 3969 O WAT 3573 89.834 139.889 146.355 1.00 0.00 O ATOM 3970 H1 WAT 3573 88.880 139.822 146.379 1.00 0.00 H ATOM 3971 H2 WAT 3573 90.084 139.458 145.538 1.00 0.00 H TER 3973 WAT 3573 ATOM 3973 O WAT 3574 81.253 113.455 103.959 1.00 0.00 O ATOM 3974 H1 WAT 3574 80.934 114.049 103.279 1.00 0.00 H ATOM 3975 H2 WAT 3574 80.461 113.140 104.393 1.00 0.00 H TER 3977 WAT 3574 ATOM 3977 O WAT 3575 87.462 16.850 75.199 1.00 0.00 O ATOM 3978 H1 WAT 3575 88.358 16.618 75.443 1.00 0.00 H ATOM 3979 H2 WAT 3575 87.091 16.039 74.851 1.00 0.00 H TER 3981 WAT 3575 ATOM 3981 O WAT 3576 44.607 120.181 151.546 1.00 0.00 O ATOM 3982 H1 WAT 3576 44.760 119.650 152.328 1.00 0.00 H ATOM 3983 H2 WAT 3576 44.611 119.552 150.825 1.00 0.00 H TER 3985 WAT 3576 ATOM 3985 O WAT 3577 126.466 14.983 25.702 1.00 0.00 O ATOM 3986 H1 WAT 3577 126.227 14.399 24.982 1.00 0.00 H ATOM 3987 H2 WAT 3577 126.285 15.861 25.369 1.00 0.00 H TER 3989 WAT 3577 ATOM 3989 O WAT 3578 56.128 122.547 71.589 1.00 0.00 O ATOM 3990 H1 WAT 3578 55.366 122.046 71.300 1.00 0.00 H ATOM 3991 H2 WAT 3578 56.544 121.992 72.248 1.00 0.00 H TER 3993 WAT 3578 ATOM 3993 O WAT 3579 116.057 65.813 131.743 1.00 0.00 O ATOM 3994 H1 WAT 3579 116.688 65.995 131.047 1.00 0.00 H ATOM 3995 H2 WAT 3579 116.192 64.889 131.954 1.00 0.00 H TER 3997 WAT 3579 ATOM 3997 O WAT 3580 137.314 117.518 16.534 1.00 0.00 O ATOM 3998 H1 WAT 3580 137.193 116.575 16.421 1.00 0.00 H ATOM 3999 H2 WAT 3580 136.911 117.712 17.380 1.00 0.00 H TER 4001 WAT 3580 ATOM 4001 O WAT 3581 52.780 141.249 151.587 1.00 0.00 O ATOM 4002 H1 WAT 3581 51.996 141.111 152.119 1.00 0.00 H ATOM 4003 H2 WAT 3581 52.994 142.174 151.710 1.00 0.00 H TER 4005 WAT 3581 ATOM 4005 O WAT 3582 142.632 142.853 5.158 1.00 0.00 O ATOM 4006 H1 WAT 3582 142.742 142.127 4.544 1.00 0.00 H ATOM 4007 H2 WAT 3582 143.013 143.607 4.709 1.00 0.00 H TER 4009 WAT 3582 ATOM 4009 O WAT 3583 47.816 46.230 95.600 1.00 0.00 O ATOM 4010 H1 WAT 3583 48.719 46.283 95.287 1.00 0.00 H ATOM 4011 H2 WAT 3583 47.396 45.599 95.015 1.00 0.00 H TER 4013 WAT 3583 ATOM 4013 O WAT 3584 22.041 88.412 90.595 1.00 0.00 O ATOM 4014 H1 WAT 3584 22.899 87.991 90.638 1.00 0.00 H ATOM 4015 H2 WAT 3584 21.417 87.694 90.704 1.00 0.00 H TER 4017 WAT 3584 ATOM 4017 O WAT 3585 124.864 19.215 75.757 1.00 0.00 O ATOM 4018 H1 WAT 3585 124.984 19.307 76.703 1.00 0.00 H ATOM 4019 H2 WAT 3585 125.753 19.166 75.407 1.00 0.00 H TER 4021 WAT 3585 ATOM 4021 O WAT 3586 92.616 33.240 25.120 1.00 0.00 O ATOM 4022 H1 WAT 3586 93.200 33.829 24.642 1.00 0.00 H ATOM 4023 H2 WAT 3586 93.193 32.761 25.715 1.00 0.00 H TER 4025 WAT 3586 ATOM 4025 O WAT 3587 23.473 0.604 152.420 1.00 0.00 O ATOM 4026 H1 WAT 3587 24.076 0.052 151.922 1.00 0.00 H ATOM 4027 H2 WAT 3587 24.032 1.061 153.049 1.00 0.00 H TER 4029 WAT 3587 ATOM 4029 O WAT 3588 58.545 141.609 68.390 1.00 0.00 O ATOM 4030 H1 WAT 3588 59.417 141.884 68.673 1.00 0.00 H ATOM 4031 H2 WAT 3588 58.484 141.903 67.481 1.00 0.00 H TER 4033 WAT 3588 ATOM 4033 O WAT 3589 133.984 23.991 85.354 1.00 0.00 O ATOM 4034 H1 WAT 3589 134.228 24.690 85.960 1.00 0.00 H ATOM 4035 H2 WAT 3589 134.679 23.339 85.448 1.00 0.00 H TER 4037 WAT 3589 ATOM 4037 O WAT 3590 106.669 145.603 74.482 1.00 0.00 O ATOM 4038 H1 WAT 3590 107.033 146.166 75.166 1.00 0.00 H ATOM 4039 H2 WAT 3590 107.409 145.424 73.902 1.00 0.00 H TER 4041 WAT 3590 ATOM 4041 O WAT 3591 80.080 41.982 87.138 1.00 0.00 O ATOM 4042 H1 WAT 3591 80.145 41.977 86.183 1.00 0.00 H ATOM 4043 H2 WAT 3591 79.924 41.067 87.372 1.00 0.00 H TER 4045 WAT 3591 ATOM 4045 O WAT 3592 102.665 82.618 62.715 1.00 0.00 O ATOM 4046 H1 WAT 3592 103.174 82.138 62.062 1.00 0.00 H ATOM 4047 H2 WAT 3592 101.984 82.003 62.987 1.00 0.00 H TER 4049 WAT 3592 ATOM 4049 O WAT 3593 112.374 2.589 68.761 1.00 0.00 O ATOM 4050 H1 WAT 3593 113.205 2.114 68.766 1.00 0.00 H ATOM 4051 H2 WAT 3593 111.908 2.264 69.531 1.00 0.00 H TER 4053 WAT 3593 ATOM 4053 O WAT 3594 71.297 71.652 12.454 1.00 0.00 O ATOM 4054 H1 WAT 3594 70.962 71.816 13.335 1.00 0.00 H ATOM 4055 H2 WAT 3594 70.773 70.919 12.130 1.00 0.00 H TER 4057 WAT 3594 ATOM 4057 O WAT 3595 73.086 103.777 158.017 1.00 0.00 O ATOM 4058 H1 WAT 3595 72.747 102.884 157.947 1.00 0.00 H ATOM 4059 H2 WAT 3595 73.073 104.109 157.119 1.00 0.00 H TER 4061 WAT 3595 ATOM 4061 O WAT 3596 128.177 26.925 142.330 1.00 0.00 O ATOM 4062 H1 WAT 3596 128.174 27.736 141.822 1.00 0.00 H ATOM 4063 H2 WAT 3596 127.998 27.204 143.228 1.00 0.00 H TER 4065 WAT 3596 ATOM 4065 O WAT 3597 97.879 130.027 124.518 1.00 0.00 O ATOM 4066 H1 WAT 3597 97.063 130.527 124.551 1.00 0.00 H ATOM 4067 H2 WAT 3597 98.479 130.512 125.085 1.00 0.00 H TER 4069 WAT 3597 ATOM 4069 O WAT 3598 1.151 86.540 129.461 1.00 0.00 O ATOM 4070 H1 WAT 3598 2.086 86.598 129.261 1.00 0.00 H ATOM 4071 H2 WAT 3598 1.060 86.978 130.307 1.00 0.00 H TER 4073 WAT 3598 ATOM 4073 O WAT 3599 31.375 37.057 141.781 1.00 0.00 O ATOM 4074 H1 WAT 3599 30.443 36.875 141.658 1.00 0.00 H ATOM 4075 H2 WAT 3599 31.400 37.713 142.478 1.00 0.00 H TER 4077 WAT 3599 ATOM 4077 O WAT 3600 76.974 17.879 122.707 1.00 0.00 O ATOM 4078 H1 WAT 3600 77.832 17.984 123.117 1.00 0.00 H ATOM 4079 H2 WAT 3600 77.167 17.728 121.782 1.00 0.00 H TER 4081 WAT 3600 ATOM 4081 O WAT 3601 139.808 106.148 80.439 1.00 0.00 O ATOM 4082 H1 WAT 3601 139.306 106.811 79.965 1.00 0.00 H ATOM 4083 H2 WAT 3601 140.478 105.865 79.817 1.00 0.00 H TER 4085 WAT 3601 ATOM 4085 O WAT 3602 108.977 9.893 12.833 1.00 0.00 O ATOM 4086 H1 WAT 3602 108.350 10.590 12.638 1.00 0.00 H ATOM 4087 H2 WAT 3602 108.477 9.260 13.348 1.00 0.00 H TER 4089 WAT 3602 ATOM 4089 O WAT 3603 36.588 122.535 18.776 1.00 0.00 O ATOM 4090 H1 WAT 3603 36.962 122.287 19.622 1.00 0.00 H ATOM 4091 H2 WAT 3603 35.679 122.237 18.820 1.00 0.00 H TER 4093 WAT 3603 ATOM 4093 O WAT 3604 97.390 62.440 109.507 1.00 0.00 O ATOM 4094 H1 WAT 3604 97.419 62.977 108.715 1.00 0.00 H ATOM 4095 H2 WAT 3604 97.188 61.559 109.192 1.00 0.00 H TER 4097 WAT 3604 ATOM 4097 O WAT 3605 39.506 88.542 19.251 1.00 0.00 O ATOM 4098 H1 WAT 3605 39.202 88.990 20.040 1.00 0.00 H ATOM 4099 H2 WAT 3605 39.341 87.615 19.423 1.00 0.00 H TER 4101 WAT 3605 ATOM 4101 O WAT 3606 8.711 47.496 9.494 1.00 0.00 O ATOM 4102 H1 WAT 3606 8.850 46.549 9.497 1.00 0.00 H ATOM 4103 H2 WAT 3606 7.901 47.621 9.989 1.00 0.00 H TER 4105 WAT 3606 ATOM 4105 O WAT 3607 73.837 68.695 149.785 1.00 0.00 O ATOM 4106 H1 WAT 3607 73.024 68.218 149.951 1.00 0.00 H ATOM 4107 H2 WAT 3607 74.494 68.011 149.654 1.00 0.00 H TER 4109 WAT 3607 ATOM 4109 O WAT 3608 118.704 92.163 80.092 1.00 0.00 O ATOM 4110 H1 WAT 3608 118.297 92.534 80.875 1.00 0.00 H ATOM 4111 H2 WAT 3608 119.347 92.818 79.823 1.00 0.00 H TER 4113 WAT 3608 ATOM 4113 O WAT 3609 141.633 106.597 148.150 1.00 0.00 O ATOM 4114 H1 WAT 3609 141.015 106.203 147.534 1.00 0.00 H ATOM 4115 H2 WAT 3609 141.651 105.992 148.891 1.00 0.00 H TER 4117 WAT 3609 ATOM 4117 O WAT 3610 103.964 79.287 26.286 1.00 0.00 O ATOM 4118 H1 WAT 3610 104.436 79.402 27.111 1.00 0.00 H ATOM 4119 H2 WAT 3610 103.915 80.167 25.913 1.00 0.00 H TER 4121 WAT 3610 ATOM 4121 O WAT 3611 35.094 129.431 7.282 1.00 0.00 O ATOM 4122 H1 WAT 3611 35.184 130.229 6.762 1.00 0.00 H ATOM 4123 H2 WAT 3611 34.780 128.774 6.660 1.00 0.00 H TER 4125 WAT 3611 ATOM 4125 O WAT 3612 49.934 106.716 0.658 1.00 0.00 O ATOM 4126 H1 WAT 3612 49.931 105.765 0.766 1.00 0.00 H ATOM 4127 H2 WAT 3612 50.832 106.977 0.862 1.00 0.00 H TER 4129 WAT 3612 ATOM 4129 O WAT 3613 75.879 128.395 21.530 1.00 0.00 O ATOM 4130 H1 WAT 3613 76.229 129.200 21.147 1.00 0.00 H ATOM 4131 H2 WAT 3613 74.938 128.440 21.363 1.00 0.00 H TER 4133 WAT 3613 ATOM 4133 O WAT 3614 32.070 29.181 140.286 1.00 0.00 O ATOM 4134 H1 WAT 3614 31.320 29.547 140.755 1.00 0.00 H ATOM 4135 H2 WAT 3614 31.911 29.404 139.369 1.00 0.00 H TER 4137 WAT 3614 ATOM 4137 O WAT 3615 123.360 104.249 149.345 1.00 0.00 O ATOM 4138 H1 WAT 3615 123.669 104.897 149.978 1.00 0.00 H ATOM 4139 H2 WAT 3615 123.967 103.515 149.438 1.00 0.00 H TER 4141 WAT 3615 ATOM 4141 O WAT 3616 4.924 80.511 3.844 1.00 0.00 O ATOM 4142 H1 WAT 3616 4.017 80.659 3.576 1.00 0.00 H ATOM 4143 H2 WAT 3616 4.885 79.731 4.398 1.00 0.00 H TER 4145 WAT 3616 ATOM 4145 O WAT 3617 43.775 21.962 83.951 1.00 0.00 O ATOM 4146 H1 WAT 3617 43.894 21.353 83.222 1.00 0.00 H ATOM 4147 H2 WAT 3617 44.192 22.772 83.658 1.00 0.00 H TER 4149 WAT 3617 ATOM 4149 O WAT 3618 14.446 43.164 92.158 1.00 0.00 O ATOM 4150 H1 WAT 3618 13.504 43.004 92.095 1.00 0.00 H ATOM 4151 H2 WAT 3618 14.655 43.673 91.375 1.00 0.00 H TER 4153 WAT 3618 ATOM 4153 O WAT 3619 78.581 44.816 105.461 1.00 0.00 O ATOM 4154 H1 WAT 3619 79.306 45.051 104.882 1.00 0.00 H ATOM 4155 H2 WAT 3619 78.996 44.639 106.305 1.00 0.00 H TER 4157 WAT 3619 ATOM 4157 O WAT 3620 28.240 58.258 19.333 1.00 0.00 O ATOM 4158 H1 WAT 3620 28.427 57.468 19.840 1.00 0.00 H ATOM 4159 H2 WAT 3620 27.290 58.251 19.221 1.00 0.00 H TER 4161 WAT 3620 ATOM 4161 O WAT 3621 55.261 115.165 113.381 1.00 0.00 O ATOM 4162 H1 WAT 3621 55.669 115.948 113.013 1.00 0.00 H ATOM 4163 H2 WAT 3621 54.966 115.435 114.251 1.00 0.00 H TER 4165 WAT 3621 ATOM 4165 O WAT 3622 63.802 125.044 54.541 1.00 0.00 O ATOM 4166 H1 WAT 3622 64.066 125.961 54.472 1.00 0.00 H ATOM 4167 H2 WAT 3622 62.881 125.039 54.280 1.00 0.00 H TER 4169 WAT 3622 ATOM 4169 O WAT 3623 85.032 137.205 90.550 1.00 0.00 O ATOM 4170 H1 WAT 3623 85.686 137.823 90.873 1.00 0.00 H ATOM 4171 H2 WAT 3623 84.192 137.627 90.733 1.00 0.00 H TER 4173 WAT 3623 ATOM 4173 O WAT 3624 71.656 53.755 83.009 1.00 0.00 O ATOM 4174 H1 WAT 3624 71.760 53.523 82.086 1.00 0.00 H ATOM 4175 H2 WAT 3624 71.350 52.949 83.425 1.00 0.00 H TER 4177 WAT 3624 ATOM 4177 O WAT 3625 34.724 0.720 125.363 1.00 0.00 O ATOM 4178 H1 WAT 3625 34.886 0.628 126.302 1.00 0.00 H ATOM 4179 H2 WAT 3625 35.390 0.170 124.950 1.00 0.00 H TER 4181 WAT 3625 ATOM 4181 O WAT 3626 65.452 44.764 144.738 1.00 0.00 O ATOM 4182 H1 WAT 3626 64.748 45.162 144.226 1.00 0.00 H ATOM 4183 H2 WAT 3626 65.955 45.507 145.071 1.00 0.00 H TER 4185 WAT 3626 ATOM 4185 O WAT 3627 85.191 2.078 142.175 1.00 0.00 O ATOM 4186 H1 WAT 3627 85.465 2.995 142.147 1.00 0.00 H ATOM 4187 H2 WAT 3627 85.929 1.619 142.576 1.00 0.00 H TER 4189 WAT 3627 ATOM 4189 O WAT 3628 67.301 118.610 14.238 1.00 0.00 O ATOM 4190 H1 WAT 3628 67.538 118.678 15.163 1.00 0.00 H ATOM 4191 H2 WAT 3628 66.529 118.045 14.229 1.00 0.00 H TER 4193 WAT 3628 ATOM 4193 O WAT 3629 116.766 115.145 132.568 1.00 0.00 O ATOM 4194 H1 WAT 3629 116.732 115.247 131.617 1.00 0.00 H ATOM 4195 H2 WAT 3629 116.489 114.242 132.722 1.00 0.00 H TER 4197 WAT 3629 ATOM 4197 O WAT 3630 66.188 25.572 103.005 1.00 0.00 O ATOM 4198 H1 WAT 3630 67.145 25.613 102.992 1.00 0.00 H ATOM 4199 H2 WAT 3630 65.975 25.222 103.871 1.00 0.00 H TER 4201 WAT 3630 ATOM 4201 O WAT 3631 139.976 56.011 108.619 1.00 0.00 O ATOM 4202 H1 WAT 3631 139.316 56.142 109.300 1.00 0.00 H ATOM 4203 H2 WAT 3631 140.719 55.619 109.079 1.00 0.00 H TER 4205 WAT 3631 ATOM 4205 O WAT 3632 73.500 109.537 118.372 1.00 0.00 O ATOM 4206 H1 WAT 3632 72.599 109.796 118.179 1.00 0.00 H ATOM 4207 H2 WAT 3632 73.718 110.009 119.176 1.00 0.00 H TER 4209 WAT 3632 ATOM 4209 O WAT 3633 69.946 50.675 115.598 1.00 0.00 O ATOM 4210 H1 WAT 3633 69.913 49.772 115.281 1.00 0.00 H ATOM 4211 H2 WAT 3633 70.113 51.197 114.813 1.00 0.00 H TER 4213 WAT 3633 ATOM 4213 O WAT 3634 99.652 83.773 22.452 1.00 0.00 O ATOM 4214 H1 WAT 3634 98.928 83.148 22.499 1.00 0.00 H ATOM 4215 H2 WAT 3634 99.890 83.931 23.366 1.00 0.00 H TER 4217 WAT 3634 ATOM 4217 O WAT 3635 84.892 143.553 108.081 1.00 0.00 O ATOM 4218 H1 WAT 3635 84.490 142.707 108.279 1.00 0.00 H ATOM 4219 H2 WAT 3635 84.975 143.984 108.932 1.00 0.00 H TER 4221 WAT 3635 ATOM 4221 O WAT 3636 114.980 61.982 17.447 1.00 0.00 O ATOM 4222 H1 WAT 3636 114.865 61.151 16.986 1.00 0.00 H ATOM 4223 H2 WAT 3636 114.732 61.791 18.352 1.00 0.00 H TER 4225 WAT 3636 ATOM 4225 O WAT 3637 33.034 47.615 105.706 1.00 0.00 O ATOM 4226 H1 WAT 3637 33.109 48.448 105.240 1.00 0.00 H ATOM 4227 H2 WAT 3637 33.353 46.963 105.082 1.00 0.00 H TER 4229 WAT 3637 ATOM 4229 O WAT 3638 122.146 45.931 58.047 1.00 0.00 O ATOM 4230 H1 WAT 3638 122.591 45.083 58.074 1.00 0.00 H ATOM 4231 H2 WAT 3638 121.220 45.719 58.164 1.00 0.00 H TER 4233 WAT 3638 ATOM 4233 O WAT 3639 114.692 100.110 93.248 1.00 0.00 O ATOM 4234 H1 WAT 3639 114.833 100.549 92.409 1.00 0.00 H ATOM 4235 H2 WAT 3639 115.524 100.204 93.711 1.00 0.00 H TER 4237 WAT 3639 ATOM 4237 O WAT 3640 65.424 63.641 83.458 1.00 0.00 O ATOM 4238 H1 WAT 3640 65.996 63.364 84.174 1.00 0.00 H ATOM 4239 H2 WAT 3640 65.112 62.823 83.070 1.00 0.00 H TER 4241 WAT 3640 ATOM 4241 O WAT 3641 29.535 65.060 156.285 1.00 0.00 O ATOM 4242 H1 WAT 3641 29.696 64.456 157.010 1.00 0.00 H ATOM 4243 H2 WAT 3641 28.790 64.681 155.819 1.00 0.00 H TER 4245 WAT 3641 ATOM 4245 O WAT 3642 109.597 54.473 149.894 1.00 0.00 O ATOM 4246 H1 WAT 3642 108.987 54.406 150.629 1.00 0.00 H ATOM 4247 H2 WAT 3642 110.250 55.110 150.182 1.00 0.00 H TER 4249 WAT 3642 ATOM 4249 O WAT 3643 31.221 112.781 8.971 1.00 0.00 O ATOM 4250 H1 WAT 3643 30.491 113.385 9.105 1.00 0.00 H ATOM 4251 H2 WAT 3643 30.855 111.917 9.159 1.00 0.00 H TER 4253 WAT 3643 ATOM 4253 O WAT 3644 113.462 145.283 78.110 1.00 0.00 O ATOM 4254 H1 WAT 3644 113.449 146.164 77.736 1.00 0.00 H ATOM 4255 H2 WAT 3644 112.620 145.199 78.556 1.00 0.00 H TER 4257 WAT 3644 ATOM 4257 O WAT 3645 52.926 89.522 3.317 1.00 0.00 O ATOM 4258 H1 WAT 3645 53.055 89.883 2.440 1.00 0.00 H ATOM 4259 H2 WAT 3645 52.320 90.131 3.740 1.00 0.00 H TER 4261 WAT 3645 ATOM 4261 O WAT 3646 142.386 74.378 124.152 1.00 0.00 O ATOM 4262 H1 WAT 3646 142.770 74.504 123.285 1.00 0.00 H ATOM 4263 H2 WAT 3646 142.769 73.560 124.468 1.00 0.00 H TER 4265 WAT 3646 ATOM 4265 O WAT 3647 63.367 112.885 72.462 1.00 0.00 O ATOM 4266 H1 WAT 3647 62.919 112.673 71.643 1.00 0.00 H ATOM 4267 H2 WAT 3647 63.981 113.581 72.226 1.00 0.00 H TER 4269 WAT 3647 ATOM 4269 O WAT 3648 46.335 2.796 53.823 1.00 0.00 O ATOM 4270 H1 WAT 3648 45.579 2.210 53.826 1.00 0.00 H ATOM 4271 H2 WAT 3648 47.027 2.297 54.257 1.00 0.00 H TER 4273 WAT 3648 ATOM 4273 O WAT 3649 10.860 93.295 2.065 1.00 0.00 O ATOM 4274 H1 WAT 3649 10.704 93.221 3.006 1.00 0.00 H ATOM 4275 H2 WAT 3649 10.412 94.102 1.811 1.00 0.00 H TER 4277 WAT 3649 ATOM 4277 O WAT 3650 110.947 86.014 141.047 1.00 0.00 O ATOM 4278 H1 WAT 3650 110.480 85.326 141.521 1.00 0.00 H ATOM 4279 H2 WAT 3650 110.288 86.692 140.897 1.00 0.00 H TER 4281 WAT 3650 ATOM 4281 O WAT 3651 83.090 135.906 81.980 1.00 0.00 O ATOM 4282 H1 WAT 3651 82.349 136.469 81.756 1.00 0.00 H ATOM 4283 H2 WAT 3651 83.313 136.150 82.878 1.00 0.00 H TER 4285 WAT 3651 ATOM 4285 O WAT 3652 116.717 78.587 15.877 1.00 0.00 O ATOM 4286 H1 WAT 3652 116.126 77.845 16.005 1.00 0.00 H ATOM 4287 H2 WAT 3652 117.188 78.664 16.707 1.00 0.00 H TER 4289 WAT 3652 ATOM 4289 O WAT 3653 12.507 15.079 6.405 1.00 0.00 O ATOM 4290 H1 WAT 3653 12.202 14.573 5.652 1.00 0.00 H ATOM 4291 H2 WAT 3653 13.461 15.075 6.326 1.00 0.00 H TER 4293 WAT 3653 ATOM 4293 O WAT 3654 62.428 73.349 83.023 1.00 0.00 O ATOM 4294 H1 WAT 3654 62.160 72.959 82.191 1.00 0.00 H ATOM 4295 H2 WAT 3654 62.294 72.654 83.668 1.00 0.00 H TER 4297 WAT 3654 ATOM 4297 O WAT 3655 0.919 9.295 115.297 1.00 0.00 O ATOM 4298 H1 WAT 3655 0.809 9.503 114.370 1.00 0.00 H ATOM 4299 H2 WAT 3655 1.055 8.348 115.316 1.00 0.00 H TER 4301 WAT 3655 ATOM 4301 O WAT 3656 68.289 38.453 82.636 1.00 0.00 O ATOM 4302 H1 WAT 3656 68.765 38.106 81.882 1.00 0.00 H ATOM 4303 H2 WAT 3656 68.958 38.894 83.160 1.00 0.00 H TER 4305 WAT 3656 ATOM 4305 O WAT 3657 28.698 120.494 88.388 1.00 0.00 O ATOM 4306 H1 WAT 3657 28.194 119.717 88.147 1.00 0.00 H ATOM 4307 H2 WAT 3657 28.708 120.486 89.345 1.00 0.00 H TER 4309 WAT 3657 ATOM 4309 O WAT 3658 62.279 126.626 121.238 1.00 0.00 O ATOM 4310 H1 WAT 3658 61.548 126.809 121.828 1.00 0.00 H ATOM 4311 H2 WAT 3658 61.865 126.389 120.409 1.00 0.00 H TER 4313 WAT 3658 ATOM 4313 O WAT 3659 0.755 46.472 61.732 1.00 0.00 O ATOM 4314 H1 WAT 3659 1.086 45.595 61.923 1.00 0.00 H ATOM 4315 H2 WAT 3659 -0.190 46.407 61.868 1.00 0.00 H TER 4317 WAT 3659 ATOM 4317 O WAT 3660 116.808 10.572 73.170 1.00 0.00 O ATOM 4318 H1 WAT 3660 117.308 9.921 72.677 1.00 0.00 H ATOM 4319 H2 WAT 3660 116.039 10.745 72.628 1.00 0.00 H TER 4321 WAT 3660 ATOM 4321 O WAT 3661 72.110 105.758 84.689 1.00 0.00 O ATOM 4322 H1 WAT 3661 71.892 105.524 83.787 1.00 0.00 H ATOM 4323 H2 WAT 3661 73.019 105.477 84.796 1.00 0.00 H TER 4325 WAT 3661 ATOM 4325 O WAT 3662 131.423 48.254 153.423 1.00 0.00 O ATOM 4326 H1 WAT 3662 131.242 49.109 153.033 1.00 0.00 H ATOM 4327 H2 WAT 3662 131.826 48.456 154.267 1.00 0.00 H TER 4329 WAT 3662 ATOM 4329 O WAT 3663 98.347 31.762 68.868 1.00 0.00 O ATOM 4330 H1 WAT 3663 98.055 31.864 67.962 1.00 0.00 H ATOM 4331 H2 WAT 3663 97.635 31.289 69.297 1.00 0.00 H TER 4333 WAT 3663 ATOM 4333 O WAT 3664 95.073 128.253 95.371 1.00 0.00 O ATOM 4334 H1 WAT 3664 94.934 128.952 94.732 1.00 0.00 H ATOM 4335 H2 WAT 3664 95.546 127.577 94.886 1.00 0.00 H TER 4337 WAT 3664 ATOM 4337 O WAT 3665 120.272 131.321 67.928 1.00 0.00 O ATOM 4338 H1 WAT 3665 119.861 130.457 67.904 1.00 0.00 H ATOM 4339 H2 WAT 3665 119.758 131.848 67.316 1.00 0.00 H TER 4341 WAT 3665 ATOM 4341 O WAT 3666 45.015 41.597 116.378 1.00 0.00 O ATOM 4342 H1 WAT 3666 45.898 41.556 116.010 1.00 0.00 H ATOM 4343 H2 WAT 3666 45.144 41.900 117.276 1.00 0.00 H TER 4345 WAT 3666 ATOM 4345 O WAT 3667 11.263 41.154 92.157 1.00 0.00 O ATOM 4346 H1 WAT 3667 10.972 41.644 91.388 1.00 0.00 H ATOM 4347 H2 WAT 3667 12.036 40.676 91.859 1.00 0.00 H TER 4349 WAT 3667 ATOM 4349 O WAT 3668 145.153 13.432 124.531 1.00 0.00 O ATOM 4350 H1 WAT 3668 145.945 12.906 124.420 1.00 0.00 H ATOM 4351 H2 WAT 3668 145.270 14.171 123.933 1.00 0.00 H TER 4353 WAT 3668 ATOM 4353 O WAT 3669 42.492 43.393 73.871 1.00 0.00 O ATOM 4354 H1 WAT 3669 41.616 43.767 73.779 1.00 0.00 H ATOM 4355 H2 WAT 3669 43.079 44.149 73.844 1.00 0.00 H TER 4357 WAT 3669 ATOM 4357 O WAT 3670 101.433 0.196 106.480 1.00 0.00 O ATOM 4358 H1 WAT 3670 102.175 -0.260 106.082 1.00 0.00 H ATOM 4359 H2 WAT 3670 101.516 0.016 107.417 1.00 0.00 H TER 4361 WAT 3670 ATOM 4361 O WAT 3671 38.651 7.196 124.535 1.00 0.00 O ATOM 4362 H1 WAT 3671 37.913 6.703 124.177 1.00 0.00 H ATOM 4363 H2 WAT 3671 39.393 6.594 124.475 1.00 0.00 H TER 4365 WAT 3671 ATOM 4365 O WAT 3672 22.550 94.982 156.324 1.00 0.00 O ATOM 4366 H1 WAT 3672 23.128 94.994 157.086 1.00 0.00 H ATOM 4367 H2 WAT 3672 22.210 95.875 156.267 1.00 0.00 H TER 4369 WAT 3672 ATOM 4369 O WAT 3673 70.643 41.385 136.532 1.00 0.00 O ATOM 4370 H1 WAT 3673 69.729 41.389 136.818 1.00 0.00 H ATOM 4371 H2 WAT 3673 70.739 40.561 136.053 1.00 0.00 H TER 4373 WAT 3673 ATOM 4373 O WAT 3674 102.886 116.973 5.712 1.00 0.00 O ATOM 4374 H1 WAT 3674 102.577 117.829 5.416 1.00 0.00 H ATOM 4375 H2 WAT 3674 103.767 116.897 5.344 1.00 0.00 H TER 4377 WAT 3674 ATOM 4377 O WAT 3675 17.088 143.848 134.673 1.00 0.00 O ATOM 4378 H1 WAT 3675 17.320 144.766 134.536 1.00 0.00 H ATOM 4379 H2 WAT 3675 17.306 143.680 135.590 1.00 0.00 H TER 4381 WAT 3675 ATOM 4381 O WAT 3676 32.335 131.733 65.710 1.00 0.00 O ATOM 4382 H1 WAT 3676 32.263 132.641 65.417 1.00 0.00 H ATOM 4383 H2 WAT 3676 33.086 131.385 65.230 1.00 0.00 H TER 4385 WAT 3676 ATOM 4385 O WAT 3677 79.872 34.472 131.317 1.00 0.00 O ATOM 4386 H1 WAT 3677 80.116 35.353 131.036 1.00 0.00 H ATOM 4387 H2 WAT 3677 80.332 33.891 130.711 1.00 0.00 H TER 4389 WAT 3677 ATOM 4389 O WAT 3678 24.098 117.308 15.201 1.00 0.00 O ATOM 4390 H1 WAT 3678 24.652 117.831 14.621 1.00 0.00 H ATOM 4391 H2 WAT 3678 23.921 116.508 14.707 1.00 0.00 H TER 4393 WAT 3678 ATOM 4393 O WAT 3679 131.238 98.659 0.556 1.00 0.00 O ATOM 4394 H1 WAT 3679 130.440 98.755 0.036 1.00 0.00 H ATOM 4395 H2 WAT 3679 131.862 98.240 -0.037 1.00 0.00 H TER 4397 WAT 3679 ATOM 4397 O WAT 3680 45.041 16.197 157.868 1.00 0.00 O ATOM 4398 H1 WAT 3680 44.646 15.869 157.061 1.00 0.00 H ATOM 4399 H2 WAT 3680 45.328 17.084 157.650 1.00 0.00 H TER 4401 WAT 3680 ATOM 4401 O WAT 3681 20.831 70.113 60.894 1.00 0.00 O ATOM 4402 H1 WAT 3681 20.388 69.439 60.379 1.00 0.00 H ATOM 4403 H2 WAT 3681 21.039 70.800 60.260 1.00 0.00 H TER 4405 WAT 3681 ATOM 4405 O WAT 3682 106.480 92.489 80.506 1.00 0.00 O ATOM 4406 H1 WAT 3682 105.811 92.850 79.925 1.00 0.00 H ATOM 4407 H2 WAT 3682 106.973 93.252 80.807 1.00 0.00 H TER 4409 WAT 3682 ATOM 4409 O WAT 3683 10.916 48.658 105.676 1.00 0.00 O ATOM 4410 H1 WAT 3683 10.695 49.061 104.837 1.00 0.00 H ATOM 4411 H2 WAT 3683 10.391 47.858 105.704 1.00 0.00 H TER 4413 WAT 3683 ATOM 4413 O WAT 3684 28.797 1.370 22.219 1.00 0.00 O ATOM 4414 H1 WAT 3684 29.704 1.595 22.012 1.00 0.00 H ATOM 4415 H2 WAT 3684 28.470 2.121 22.713 1.00 0.00 H TER 4417 WAT 3684 ATOM 4417 O WAT 3685 70.198 3.885 101.325 1.00 0.00 O ATOM 4418 H1 WAT 3685 69.888 3.047 100.981 1.00 0.00 H ATOM 4419 H2 WAT 3685 70.962 3.657 101.855 1.00 0.00 H TER 4421 WAT 3685 ATOM 4421 O WAT 3686 66.777 19.678 7.992 1.00 0.00 O ATOM 4422 H1 WAT 3686 66.141 19.224 8.546 1.00 0.00 H ATOM 4423 H2 WAT 3686 66.849 19.130 7.211 1.00 0.00 H TER 4425 WAT 3686 ATOM 4425 O WAT 3687 6.102 8.567 83.530 1.00 0.00 O ATOM 4426 H1 WAT 3687 6.547 9.216 82.985 1.00 0.00 H ATOM 4427 H2 WAT 3687 6.485 7.730 83.266 1.00 0.00 H TER 4429 WAT 3687 ATOM 4429 O WAT 3688 138.884 48.463 123.992 1.00 0.00 O ATOM 4430 H1 WAT 3688 138.199 47.796 124.028 1.00 0.00 H ATOM 4431 H2 WAT 3688 139.510 48.130 123.350 1.00 0.00 H TER 4433 WAT 3688 ATOM 4433 O WAT 3689 97.228 8.251 9.270 1.00 0.00 O ATOM 4434 H1 WAT 3689 96.807 7.608 9.840 1.00 0.00 H ATOM 4435 H2 WAT 3689 97.597 8.899 9.870 1.00 0.00 H TER 4437 WAT 3689 ATOM 4437 O WAT 3690 144.497 55.314 117.962 1.00 0.00 O ATOM 4438 H1 WAT 3690 144.864 54.978 117.144 1.00 0.00 H ATOM 4439 H2 WAT 3690 143.701 54.798 118.096 1.00 0.00 H TER 4441 WAT 3690 ATOM 4441 O WAT 3691 48.224 131.770 77.167 1.00 0.00 O ATOM 4442 H1 WAT 3691 48.739 130.975 77.029 1.00 0.00 H ATOM 4443 H2 WAT 3691 48.864 132.425 77.446 1.00 0.00 H TER 4445 WAT 3691 ATOM 4445 O WAT 3692 5.231 37.522 116.452 1.00 0.00 O ATOM 4446 H1 WAT 3692 4.709 38.324 116.441 1.00 0.00 H ATOM 4447 H2 WAT 3692 5.826 37.635 117.193 1.00 0.00 H TER 4449 WAT 3692 ATOM 4449 O WAT 3693 20.529 110.405 75.931 1.00 0.00 O ATOM 4450 H1 WAT 3693 21.438 110.612 76.146 1.00 0.00 H ATOM 4451 H2 WAT 3693 20.020 111.101 76.346 1.00 0.00 H TER 4453 WAT 3693 ATOM 4453 O WAT 3694 79.421 65.575 115.717 1.00 0.00 O ATOM 4454 H1 WAT 3694 80.089 64.986 116.066 1.00 0.00 H ATOM 4455 H2 WAT 3694 78.901 65.026 115.129 1.00 0.00 H TER 4457 WAT 3694 ATOM 4457 O WAT 3695 33.300 17.015 89.572 1.00 0.00 O ATOM 4458 H1 WAT 3695 33.391 16.863 88.632 1.00 0.00 H ATOM 4459 H2 WAT 3695 32.405 17.337 89.677 1.00 0.00 H TER 4461 WAT 3695 ATOM 4461 O WAT 3696 91.346 60.051 1.440 1.00 0.00 O ATOM 4462 H1 WAT 3696 92.212 60.237 1.075 1.00 0.00 H ATOM 4463 H2 WAT 3696 91.478 59.275 1.985 1.00 0.00 H TER 4465 WAT 3696 ATOM 4465 O WAT 3697 86.045 80.357 59.637 1.00 0.00 O ATOM 4466 H1 WAT 3697 85.709 79.461 59.670 1.00 0.00 H ATOM 4467 H2 WAT 3697 86.414 80.507 60.508 1.00 0.00 H TER 4469 WAT 3697 ATOM 4469 O WAT 3698 45.698 142.714 134.028 1.00 0.00 O ATOM 4470 H1 WAT 3698 46.216 142.843 134.823 1.00 0.00 H ATOM 4471 H2 WAT 3698 44.796 142.643 134.340 1.00 0.00 H TER 4473 WAT 3698 ATOM 4473 O WAT 3699 37.582 4.941 137.981 1.00 0.00 O ATOM 4474 H1 WAT 3699 38.384 4.460 138.184 1.00 0.00 H ATOM 4475 H2 WAT 3699 37.886 5.758 137.585 1.00 0.00 H TER 4477 WAT 3699 ATOM 4477 O WAT 3700 110.171 50.426 131.565 1.00 0.00 O ATOM 4478 H1 WAT 3700 110.140 50.872 132.411 1.00 0.00 H ATOM 4479 H2 WAT 3700 109.797 49.562 131.735 1.00 0.00 H TER 4481 WAT 3700 ATOM 4481 O WAT 3701 94.063 11.279 117.525 1.00 0.00 O ATOM 4482 H1 WAT 3701 94.715 10.954 118.146 1.00 0.00 H ATOM 4483 H2 WAT 3701 93.295 10.728 117.673 1.00 0.00 H TER 4485 WAT 3701 ATOM 4485 O WAT 3702 29.524 144.262 0.073 1.00 0.00 O ATOM 4486 H1 WAT 3702 30.228 144.882 -0.117 1.00 0.00 H ATOM 4487 H2 WAT 3702 29.976 143.462 0.343 1.00 0.00 H TER 4489 WAT 3702 ATOM 4489 O WAT 3703 111.090 48.203 109.353 1.00 0.00 O ATOM 4490 H1 WAT 3703 111.788 48.210 108.699 1.00 0.00 H ATOM 4491 H2 WAT 3703 110.713 49.082 109.312 1.00 0.00 H TER 4493 WAT 3703 ATOM 4493 O WAT 3704 56.258 12.240 131.439 1.00 0.00 O ATOM 4494 H1 WAT 3704 57.151 11.923 131.575 1.00 0.00 H ATOM 4495 H2 WAT 3704 56.104 12.840 132.168 1.00 0.00 H TER 4497 WAT 3704 ATOM 4497 O WAT 3705 11.566 44.795 6.570 1.00 0.00 O ATOM 4498 H1 WAT 3705 11.384 44.505 5.677 1.00 0.00 H ATOM 4499 H2 WAT 3705 11.674 45.744 6.497 1.00 0.00 H TER 4501 WAT 3705 ATOM 4501 O WAT 3706 82.012 84.926 108.418 1.00 0.00 O ATOM 4502 H1 WAT 3706 81.946 84.454 109.248 1.00 0.00 H ATOM 4503 H2 WAT 3706 81.113 84.961 108.090 1.00 0.00 H TER 4505 WAT 3706 ATOM 4505 O WAT 3707 2.388 8.672 108.945 1.00 0.00 O ATOM 4506 H1 WAT 3707 2.574 8.345 108.065 1.00 0.00 H ATOM 4507 H2 WAT 3707 2.641 9.595 108.916 1.00 0.00 H TER 4509 WAT 3707 ATOM 4509 O WAT 3708 107.717 86.141 89.453 1.00 0.00 O ATOM 4510 H1 WAT 3708 106.903 85.698 89.213 1.00 0.00 H ATOM 4511 H2 WAT 3708 107.691 86.189 90.409 1.00 0.00 H TER 4513 WAT 3708 ATOM 4513 O WAT 3709 33.801 42.180 53.963 1.00 0.00 O ATOM 4514 H1 WAT 3709 33.960 41.273 54.224 1.00 0.00 H ATOM 4515 H2 WAT 3709 34.647 42.614 54.078 1.00 0.00 H TER 4517 WAT 3709 ATOM 4517 O WAT 3710 126.731 38.348 126.202 1.00 0.00 O ATOM 4518 H1 WAT 3710 126.036 38.247 126.852 1.00 0.00 H ATOM 4519 H2 WAT 3710 127.210 39.128 126.481 1.00 0.00 H TER 4521 WAT 3710 ATOM 4521 O WAT 3711 74.674 136.641 140.870 1.00 0.00 O ATOM 4522 H1 WAT 3711 74.199 135.813 140.931 1.00 0.00 H ATOM 4523 H2 WAT 3711 75.549 136.394 140.571 1.00 0.00 H TER 4525 WAT 3711 ATOM 4525 O WAT 3712 101.821 121.624 123.111 1.00 0.00 O ATOM 4526 H1 WAT 3712 102.321 121.735 122.303 1.00 0.00 H ATOM 4527 H2 WAT 3712 102.217 120.863 123.535 1.00 0.00 H TER 4529 WAT 3712 ATOM 4529 O WAT 3713 89.494 61.060 57.880 1.00 0.00 O ATOM 4530 H1 WAT 3713 88.875 60.769 58.550 1.00 0.00 H ATOM 4531 H2 WAT 3713 89.430 60.399 57.191 1.00 0.00 H TER 4533 WAT 3713 ATOM 4533 O WAT 3714 96.231 0.315 12.405 1.00 0.00 O ATOM 4534 H1 WAT 3714 97.143 0.497 12.628 1.00 0.00 H ATOM 4535 H2 WAT 3714 96.074 -0.569 12.739 1.00 0.00 H TER 4537 WAT 3714 ATOM 4537 O WAT 3715 49.493 136.130 84.280 1.00 0.00 O ATOM 4538 H1 WAT 3715 48.802 135.573 83.921 1.00 0.00 H ATOM 4539 H2 WAT 3715 49.623 136.808 83.616 1.00 0.00 H TER 4541 WAT 3715 ATOM 4541 O WAT 3716 142.090 45.117 20.335 1.00 0.00 O ATOM 4542 H1 WAT 3716 142.386 44.829 19.471 1.00 0.00 H ATOM 4543 H2 WAT 3716 141.215 45.475 20.181 1.00 0.00 H TER 4545 WAT 3716 ATOM 4545 O WAT 3717 99.445 107.780 151.804 1.00 0.00 O ATOM 4546 H1 WAT 3717 99.245 108.697 151.988 1.00 0.00 H ATOM 4547 H2 WAT 3717 99.952 107.804 150.992 1.00 0.00 H TER 4549 WAT 3717 ATOM 4549 O WAT 3718 141.217 68.607 7.571 1.00 0.00 O ATOM 4550 H1 WAT 3718 140.970 69.532 7.600 1.00 0.00 H ATOM 4551 H2 WAT 3718 140.384 68.137 7.546 1.00 0.00 H TER 4553 WAT 3718 ATOM 4553 O WAT 3719 94.574 72.345 90.698 1.00 0.00 O ATOM 4554 H1 WAT 3719 94.976 72.522 91.549 1.00 0.00 H ATOM 4555 H2 WAT 3719 94.417 73.212 90.322 1.00 0.00 H TER 4557 WAT 3719 ATOM 4557 O WAT 3720 57.988 123.536 130.756 1.00 0.00 O ATOM 4558 H1 WAT 3720 58.464 123.203 131.517 1.00 0.00 H ATOM 4559 H2 WAT 3720 58.473 124.318 130.493 1.00 0.00 H TER 4561 WAT 3720 ATOM 4561 O WAT 3721 10.985 70.619 113.525 1.00 0.00 O ATOM 4562 H1 WAT 3721 11.567 70.362 112.810 1.00 0.00 H ATOM 4563 H2 WAT 3721 10.108 70.580 113.145 1.00 0.00 H TER 4565 WAT 3721 ATOM 4565 O WAT 3722 41.782 35.490 6.208 1.00 0.00 O ATOM 4566 H1 WAT 3722 41.120 36.181 6.158 1.00 0.00 H ATOM 4567 H2 WAT 3722 41.464 34.904 6.895 1.00 0.00 H TER 4569 WAT 3722 ATOM 4569 O WAT 3723 75.144 21.902 80.718 1.00 0.00 O ATOM 4570 H1 WAT 3723 74.766 21.255 80.123 1.00 0.00 H ATOM 4571 H2 WAT 3723 76.051 21.618 80.837 1.00 0.00 H TER 4573 WAT 3723 ATOM 4573 O WAT 3724 49.625 132.603 111.957 1.00 0.00 O ATOM 4574 H1 WAT 3724 49.219 131.747 112.093 1.00 0.00 H ATOM 4575 H2 WAT 3724 48.930 133.139 111.575 1.00 0.00 H TER 4577 WAT 3724 ATOM 4577 O WAT 3725 74.620 19.059 66.675 1.00 0.00 O ATOM 4578 H1 WAT 3725 74.927 18.709 65.838 1.00 0.00 H ATOM 4579 H2 WAT 3725 74.567 18.295 67.249 1.00 0.00 H TER 4581 WAT 3725 ATOM 4581 O WAT 3726 1.925 70.063 96.439 1.00 0.00 O ATOM 4582 H1 WAT 3726 1.953 70.216 95.494 1.00 0.00 H ATOM 4583 H2 WAT 3726 1.426 69.253 96.536 1.00 0.00 H TER 4585 WAT 3726 ATOM 4585 O WAT 3727 81.107 103.676 96.614 1.00 0.00 O ATOM 4586 H1 WAT 3727 80.467 102.990 96.803 1.00 0.00 H ATOM 4587 H2 WAT 3727 80.861 104.399 97.190 1.00 0.00 H TER 4589 WAT 3727 ATOM 4589 O WAT 3728 30.422 51.557 152.133 1.00 0.00 O ATOM 4590 H1 WAT 3728 29.630 52.095 152.165 1.00 0.00 H ATOM 4591 H2 WAT 3728 30.267 50.864 152.775 1.00 0.00 H TER 4593 WAT 3728 ATOM 4593 O WAT 3729 145.214 3.232 102.327 1.00 0.00 O ATOM 4594 H1 WAT 3729 144.730 3.607 103.063 1.00 0.00 H ATOM 4595 H2 WAT 3729 145.300 2.304 102.544 1.00 0.00 H TER 4597 WAT 3729 ATOM 4597 O WAT 3730 123.174 103.648 124.644 1.00 0.00 O ATOM 4598 H1 WAT 3730 124.104 103.696 124.423 1.00 0.00 H ATOM 4599 H2 WAT 3730 122.955 102.720 124.559 1.00 0.00 H TER 4601 WAT 3730 ATOM 4601 O WAT 3731 75.477 119.224 81.161 1.00 0.00 O ATOM 4602 H1 WAT 3731 75.679 119.252 82.097 1.00 0.00 H ATOM 4603 H2 WAT 3731 76.013 119.919 80.780 1.00 0.00 H TER 4605 WAT 3731 ATOM 4605 O WAT 3732 24.873 35.108 101.437 1.00 0.00 O ATOM 4606 H1 WAT 3732 24.711 36.018 101.187 1.00 0.00 H ATOM 4607 H2 WAT 3732 25.190 35.161 102.339 1.00 0.00 H TER 4609 WAT 3732 ATOM 4609 O WAT 3733 114.469 15.178 0.586 1.00 0.00 O ATOM 4610 H1 WAT 3733 115.312 15.189 0.132 1.00 0.00 H ATOM 4611 H2 WAT 3733 114.565 14.498 1.253 1.00 0.00 H TER 4613 WAT 3733 ATOM 4613 O WAT 3734 134.808 82.791 118.018 1.00 0.00 O ATOM 4614 H1 WAT 3734 135.281 81.990 117.794 1.00 0.00 H ATOM 4615 H2 WAT 3734 135.362 83.222 118.669 1.00 0.00 H TER 4617 WAT 3734 ATOM 4617 O WAT 3735 58.142 10.997 140.027 1.00 0.00 O ATOM 4618 H1 WAT 3735 58.460 11.234 139.156 1.00 0.00 H ATOM 4619 H2 WAT 3735 57.293 11.433 140.099 1.00 0.00 H TER 4621 WAT 3735 ATOM 4621 O WAT 3736 144.542 133.274 87.205 1.00 0.00 O ATOM 4622 H1 WAT 3736 144.921 133.887 87.835 1.00 0.00 H ATOM 4623 H2 WAT 3736 145.276 133.026 86.642 1.00 0.00 H TER 4625 WAT 3736 ATOM 4625 O WAT 3737 125.158 88.261 104.881 1.00 0.00 O ATOM 4626 H1 WAT 3737 124.265 88.130 104.560 1.00 0.00 H ATOM 4627 H2 WAT 3737 125.140 89.126 105.290 1.00 0.00 H TER 4629 WAT 3737 ATOM 4629 O WAT 3738 33.343 98.129 12.501 1.00 0.00 O ATOM 4630 H1 WAT 3738 33.872 97.467 12.946 1.00 0.00 H ATOM 4631 H2 WAT 3738 32.711 98.415 13.161 1.00 0.00 H TER 4633 WAT 3738 ATOM 4633 O WAT 3739 136.498 39.291 156.395 1.00 0.00 O ATOM 4634 H1 WAT 3739 137.087 38.810 155.813 1.00 0.00 H ATOM 4635 H2 WAT 3739 136.590 40.205 156.126 1.00 0.00 H TER 4637 WAT 3739 ATOM 4637 O WAT 3740 86.547 129.227 24.757 1.00 0.00 O ATOM 4638 H1 WAT 3740 86.075 129.942 25.184 1.00 0.00 H ATOM 4639 H2 WAT 3740 86.351 129.333 23.826 1.00 0.00 H TER 4641 WAT 3740 ATOM 4641 O WAT 3741 144.255 81.282 156.220 1.00 0.00 O ATOM 4642 H1 WAT 3741 144.990 80.791 156.586 1.00 0.00 H ATOM 4643 H2 WAT 3741 144.199 80.988 155.311 1.00 0.00 H TER 4645 WAT 3741 ATOM 4645 O WAT 3742 44.030 44.413 55.799 1.00 0.00 O ATOM 4646 H1 WAT 3742 43.885 44.540 54.862 1.00 0.00 H ATOM 4647 H2 WAT 3742 44.980 44.327 55.885 1.00 0.00 H TER 4649 WAT 3742 ATOM 4649 O WAT 3743 101.585 80.726 143.104 1.00 0.00 O ATOM 4650 H1 WAT 3743 100.631 80.795 143.055 1.00 0.00 H ATOM 4651 H2 WAT 3743 101.854 80.488 142.216 1.00 0.00 H TER 4653 WAT 3743 ATOM 4653 O WAT 3744 82.682 54.428 149.521 1.00 0.00 O ATOM 4654 H1 WAT 3744 82.981 53.550 149.282 1.00 0.00 H ATOM 4655 H2 WAT 3744 83.132 55.009 148.908 1.00 0.00 H TER 4657 WAT 3744 ATOM 4657 O WAT 3745 5.899 120.711 115.398 1.00 0.00 O ATOM 4658 H1 WAT 3745 6.616 120.163 115.080 1.00 0.00 H ATOM 4659 H2 WAT 3745 5.108 120.206 115.206 1.00 0.00 H TER 4661 WAT 3745 ATOM 4661 O WAT 3746 44.479 22.407 62.659 1.00 0.00 O ATOM 4662 H1 WAT 3746 44.862 23.284 62.640 1.00 0.00 H ATOM 4663 H2 WAT 3746 44.991 21.908 62.023 1.00 0.00 H TER 4665 WAT 3746 ATOM 4665 O WAT 3747 79.723 138.789 4.734 1.00 0.00 O ATOM 4666 H1 WAT 3747 79.026 138.390 5.254 1.00 0.00 H ATOM 4667 H2 WAT 3747 79.559 138.487 3.841 1.00 0.00 H TER 4669 WAT 3747 ATOM 4669 O WAT 3748 76.142 145.030 156.984 1.00 0.00 O ATOM 4670 H1 WAT 3748 77.044 144.796 156.766 1.00 0.00 H ATOM 4671 H2 WAT 3748 75.662 144.929 156.162 1.00 0.00 H TER 4673 WAT 3748 ATOM 4673 O WAT 3749 25.142 21.741 125.033 1.00 0.00 O ATOM 4674 H1 WAT 3749 24.391 22.305 124.848 1.00 0.00 H ATOM 4675 H2 WAT 3749 25.459 22.038 125.886 1.00 0.00 H TER 4677 WAT 3749 ATOM 4677 O WAT 3750 38.885 65.222 100.941 1.00 0.00 O ATOM 4678 H1 WAT 3750 38.985 64.280 101.080 1.00 0.00 H ATOM 4679 H2 WAT 3750 38.219 65.489 101.575 1.00 0.00 H TER 4681 WAT 3750 ATOM 4681 O WAT 3751 117.775 115.216 1.893 1.00 0.00 O ATOM 4682 H1 WAT 3751 117.434 114.685 2.613 1.00 0.00 H ATOM 4683 H2 WAT 3751 118.639 114.847 1.712 1.00 0.00 H TER 4685 WAT 3751 ATOM 4685 O WAT 3752 134.728 27.524 1.020 1.00 0.00 O ATOM 4686 H1 WAT 3752 134.504 27.150 1.872 1.00 0.00 H ATOM 4687 H2 WAT 3752 135.568 27.123 0.796 1.00 0.00 H TER 4689 WAT 3752 ATOM 4689 O WAT 3753 131.841 114.787 142.513 1.00 0.00 O ATOM 4690 H1 WAT 3753 131.827 113.933 142.081 1.00 0.00 H ATOM 4691 H2 WAT 3753 131.089 115.253 142.147 1.00 0.00 H TER 4693 WAT 3753 ATOM 4693 O WAT 3754 50.346 68.189 14.521 1.00 0.00 O ATOM 4694 H1 WAT 3754 50.273 68.541 13.634 1.00 0.00 H ATOM 4695 H2 WAT 3754 49.997 67.300 14.455 1.00 0.00 H TER 4697 WAT 3754 ATOM 4697 O WAT 3755 125.916 36.181 149.305 1.00 0.00 O ATOM 4698 H1 WAT 3755 125.813 37.007 149.777 1.00 0.00 H ATOM 4699 H2 WAT 3755 126.273 35.576 149.955 1.00 0.00 H TER 4701 WAT 3755 ATOM 4701 O WAT 3756 26.010 56.628 91.163 1.00 0.00 O ATOM 4702 H1 WAT 3756 26.559 57.277 91.602 1.00 0.00 H ATOM 4703 H2 WAT 3756 26.177 56.764 90.230 1.00 0.00 H TER 4705 WAT 3756 ATOM 4705 O WAT 3757 104.459 143.116 56.715 1.00 0.00 O ATOM 4706 H1 WAT 3757 104.042 142.291 56.965 1.00 0.00 H ATOM 4707 H2 WAT 3757 105.262 143.145 57.235 1.00 0.00 H TER 4709 WAT 3757 ATOM 4709 O WAT 3758 95.954 84.043 1.969 1.00 0.00 O ATOM 4710 H1 WAT 3758 95.998 84.977 2.175 1.00 0.00 H ATOM 4711 H2 WAT 3758 96.815 83.704 2.211 1.00 0.00 H TER 4713 WAT 3758 ATOM 4713 O WAT 3759 26.183 85.863 79.286 1.00 0.00 O ATOM 4714 H1 WAT 3759 25.717 85.112 78.918 1.00 0.00 H ATOM 4715 H2 WAT 3759 25.607 86.609 79.116 1.00 0.00 H TER 4717 WAT 3759 ATOM 4717 O WAT 3760 2.746 42.157 139.459 1.00 0.00 O ATOM 4718 H1 WAT 3760 1.834 42.176 139.168 1.00 0.00 H ATOM 4719 H2 WAT 3760 3.108 42.993 139.165 1.00 0.00 H TER 4721 WAT 3760 ATOM 4721 O WAT 3761 78.031 143.538 135.894 1.00 0.00 O ATOM 4722 H1 WAT 3761 78.482 143.929 135.145 1.00 0.00 H ATOM 4723 H2 WAT 3761 78.051 144.217 136.568 1.00 0.00 H TER 4725 WAT 3761 ATOM 4725 O WAT 3762 69.021 36.448 69.598 1.00 0.00 O ATOM 4726 H1 WAT 3762 69.857 36.045 69.829 1.00 0.00 H ATOM 4727 H2 WAT 3762 68.481 36.346 70.382 1.00 0.00 H TER 4729 WAT 3762 ATOM 4729 O WAT 3763 134.524 103.831 94.069 1.00 0.00 O ATOM 4730 H1 WAT 3763 133.692 103.800 94.541 1.00 0.00 H ATOM 4731 H2 WAT 3763 134.426 104.561 93.458 1.00 0.00 H TER 4733 WAT 3763 ATOM 4733 O WAT 3764 18.188 62.192 119.010 1.00 0.00 O ATOM 4734 H1 WAT 3764 18.750 62.596 119.671 1.00 0.00 H ATOM 4735 H2 WAT 3764 17.327 62.142 119.426 1.00 0.00 H TER 4737 WAT 3764 ATOM 4737 O WAT 3765 75.547 82.952 12.040 1.00 0.00 O ATOM 4738 H1 WAT 3765 74.734 83.322 12.385 1.00 0.00 H ATOM 4739 H2 WAT 3765 75.842 83.587 11.388 1.00 0.00 H TER 4741 WAT 3765 ATOM 4741 O WAT 3766 17.289 106.585 103.975 1.00 0.00 O ATOM 4742 H1 WAT 3766 17.487 105.751 103.548 1.00 0.00 H ATOM 4743 H2 WAT 3766 17.353 107.233 103.274 1.00 0.00 H TER 4745 WAT 3766 ATOM 4745 O WAT 3767 38.714 3.185 103.419 1.00 0.00 O ATOM 4746 H1 WAT 3767 37.843 3.526 103.625 1.00 0.00 H ATOM 4747 H2 WAT 3767 38.741 2.326 103.841 1.00 0.00 H TER 4749 WAT 3767 ATOM 4749 O WAT 3768 73.140 89.800 116.923 1.00 0.00 O ATOM 4750 H1 WAT 3768 73.792 89.459 116.311 1.00 0.00 H ATOM 4751 H2 WAT 3768 73.566 90.553 117.332 1.00 0.00 H TER 4753 WAT 3768 ATOM 4753 O WAT 3769 28.336 78.388 133.635 1.00 0.00 O ATOM 4754 H1 WAT 3769 27.633 78.934 133.985 1.00 0.00 H ATOM 4755 H2 WAT 3769 29.069 78.991 133.510 1.00 0.00 H TER 4757 WAT 3769 ATOM 4757 O WAT 3770 56.228 32.469 127.969 1.00 0.00 O ATOM 4758 H1 WAT 3770 56.849 32.817 127.328 1.00 0.00 H ATOM 4759 H2 WAT 3770 56.025 31.589 127.652 1.00 0.00 H TER 4761 WAT 3770 ATOM 4761 O WAT 3771 48.507 103.493 73.885 1.00 0.00 O ATOM 4762 H1 WAT 3771 49.055 102.809 74.270 1.00 0.00 H ATOM 4763 H2 WAT 3771 48.703 103.458 72.949 1.00 0.00 H TER 4765 WAT 3771 ATOM 4765 O WAT 3772 59.684 93.543 128.045 1.00 0.00 O ATOM 4766 H1 WAT 3772 59.491 92.631 127.827 1.00 0.00 H ATOM 4767 H2 WAT 3772 59.826 93.538 128.991 1.00 0.00 H TER 4769 WAT 3772 ATOM 4769 O WAT 3773 85.065 53.012 2.403 1.00 0.00 O ATOM 4770 H1 WAT 3773 85.667 52.300 2.618 1.00 0.00 H ATOM 4771 H2 WAT 3773 85.220 53.669 3.082 1.00 0.00 H TER 4773 WAT 3773 ATOM 4773 O WAT 3774 12.415 103.987 97.495 1.00 0.00 O ATOM 4774 H1 WAT 3774 11.850 104.677 97.843 1.00 0.00 H ATOM 4775 H2 WAT 3774 12.350 104.083 96.544 1.00 0.00 H TER 4777 WAT 3774 ATOM 4777 O WAT 3775 90.131 106.483 154.879 1.00 0.00 O ATOM 4778 H1 WAT 3775 90.593 105.871 155.452 1.00 0.00 H ATOM 4779 H2 WAT 3775 89.305 106.044 154.677 1.00 0.00 H TER 4781 WAT 3775 ATOM 4781 O WAT 3776 144.851 12.892 0.366 1.00 0.00 O ATOM 4782 H1 WAT 3776 144.305 13.456 -0.181 1.00 0.00 H ATOM 4783 H2 WAT 3776 144.245 12.239 0.716 1.00 0.00 H TER 4785 WAT 3776 ATOM 4785 O WAT 3777 53.156 40.041 73.487 1.00 0.00 O ATOM 4786 H1 WAT 3777 52.499 40.727 73.609 1.00 0.00 H ATOM 4787 H2 WAT 3777 52.659 39.224 73.521 1.00 0.00 H TER 4789 WAT 3777 ATOM 4789 O WAT 3778 68.876 131.580 74.473 1.00 0.00 O ATOM 4790 H1 WAT 3778 68.279 131.574 73.725 1.00 0.00 H ATOM 4791 H2 WAT 3778 68.841 130.687 74.814 1.00 0.00 H TER 4793 WAT 3778 ATOM 4793 O WAT 3779 26.008 50.250 139.957 1.00 0.00 O ATOM 4794 H1 WAT 3779 26.260 51.108 140.299 1.00 0.00 H ATOM 4795 H2 WAT 3779 26.839 49.821 139.751 1.00 0.00 H TER 4797 WAT 3779 ATOM 4797 O WAT 3780 81.721 144.415 72.963 1.00 0.00 O ATOM 4798 H1 WAT 3780 81.691 143.975 73.813 1.00 0.00 H ATOM 4799 H2 WAT 3780 81.217 145.218 73.091 1.00 0.00 H TER 4801 WAT 3780 ATOM 4801 O WAT 3781 34.950 90.089 78.049 1.00 0.00 O ATOM 4802 H1 WAT 3781 34.055 89.751 78.076 1.00 0.00 H ATOM 4803 H2 WAT 3781 34.891 90.881 77.514 1.00 0.00 H TER 4805 WAT 3781 ATOM 4805 O WAT 3782 55.134 44.194 112.342 1.00 0.00 O ATOM 4806 H1 WAT 3782 55.391 44.207 113.264 1.00 0.00 H ATOM 4807 H2 WAT 3782 54.206 43.961 112.355 1.00 0.00 H TER 4809 WAT 3782 ATOM 4809 O WAT 3783 16.901 99.963 144.147 1.00 0.00 O ATOM 4810 H1 WAT 3783 17.255 99.790 145.020 1.00 0.00 H ATOM 4811 H2 WAT 3783 17.601 99.701 143.549 1.00 0.00 H TER 4813 WAT 3783 ATOM 4813 O WAT 3784 54.877 70.043 153.979 1.00 0.00 O ATOM 4814 H1 WAT 3784 54.381 69.293 154.309 1.00 0.00 H ATOM 4815 H2 WAT 3784 54.235 70.557 153.488 1.00 0.00 H TER 4817 WAT 3784 ATOM 4817 O WAT 3785 49.407 115.710 118.727 1.00 0.00 O ATOM 4818 H1 WAT 3785 49.215 114.874 119.150 1.00 0.00 H ATOM 4819 H2 WAT 3785 48.816 115.739 117.974 1.00 0.00 H TER 4821 WAT 3785 ATOM 4821 O WAT 3786 23.987 31.090 74.264 1.00 0.00 O ATOM 4822 H1 WAT 3786 24.915 31.184 74.479 1.00 0.00 H ATOM 4823 H2 WAT 3786 23.656 30.461 74.905 1.00 0.00 H TER 4825 WAT 3786 ATOM 4825 O WAT 3787 100.739 55.515 107.251 1.00 0.00 O ATOM 4826 H1 WAT 3787 101.651 55.740 107.434 1.00 0.00 H ATOM 4827 H2 WAT 3787 100.694 55.455 106.296 1.00 0.00 H TER 4829 WAT 3787 ATOM 4829 O WAT 3788 133.054 7.005 87.628 1.00 0.00 O ATOM 4830 H1 WAT 3788 132.749 7.639 88.276 1.00 0.00 H ATOM 4831 H2 WAT 3788 133.638 7.505 87.059 1.00 0.00 H TER 4833 WAT 3788 ATOM 4833 O WAT 3789 142.467 83.304 127.915 1.00 0.00 O ATOM 4834 H1 WAT 3789 142.719 84.196 128.157 1.00 0.00 H ATOM 4835 H2 WAT 3789 143.056 83.076 127.196 1.00 0.00 H TER 4837 WAT 3789 ATOM 4837 O WAT 3790 32.183 144.258 15.583 1.00 0.00 O ATOM 4838 H1 WAT 3790 31.299 143.895 15.632 1.00 0.00 H ATOM 4839 H2 WAT 3790 32.192 144.956 16.238 1.00 0.00 H TER 4841 WAT 3790 ATOM 4841 O WAT 3791 5.405 20.118 21.945 1.00 0.00 O ATOM 4842 H1 WAT 3791 4.548 20.181 21.523 1.00 0.00 H ATOM 4843 H2 WAT 3791 6.033 20.208 21.227 1.00 0.00 H TER 4845 WAT 3791 ATOM 4845 O WAT 3792 145.239 9.081 95.988 1.00 0.00 O ATOM 4846 H1 WAT 3792 145.336 9.770 95.331 1.00 0.00 H ATOM 4847 H2 WAT 3792 144.293 8.995 96.108 1.00 0.00 H TER 4849 WAT 3792 ATOM 4849 O WAT 3793 139.373 18.446 7.445 1.00 0.00 O ATOM 4850 H1 WAT 3793 139.933 17.681 7.309 1.00 0.00 H ATOM 4851 H2 WAT 3793 139.693 18.835 8.258 1.00 0.00 H TER 4853 WAT 3793 ATOM 4853 O WAT 3794 104.076 84.363 124.868 1.00 0.00 O ATOM 4854 H1 WAT 3794 104.664 84.035 124.187 1.00 0.00 H ATOM 4855 H2 WAT 3794 104.603 84.345 125.667 1.00 0.00 H TER 4857 WAT 3794 ATOM 4857 O WAT 3795 132.157 137.334 125.287 1.00 0.00 O ATOM 4858 H1 WAT 3795 131.990 138.159 124.833 1.00 0.00 H ATOM 4859 H2 WAT 3795 131.406 136.783 125.066 1.00 0.00 H TER 4861 WAT 3795 ATOM 4861 O WAT 3796 39.277 95.688 130.791 1.00 0.00 O ATOM 4862 H1 WAT 3796 39.783 96.411 131.162 1.00 0.00 H ATOM 4863 H2 WAT 3796 38.726 95.386 131.514 1.00 0.00 H TER 4865 WAT 3796 ATOM 4865 O WAT 3797 83.390 81.241 155.444 1.00 0.00 O ATOM 4866 H1 WAT 3797 82.462 81.009 155.417 1.00 0.00 H ATOM 4867 H2 WAT 3797 83.652 81.076 156.350 1.00 0.00 H TER 4869 WAT 3797 ATOM 4869 O WAT 3798 34.071 2.889 69.296 1.00 0.00 O ATOM 4870 H1 WAT 3798 33.893 2.455 68.461 1.00 0.00 H ATOM 4871 H2 WAT 3798 33.278 2.750 69.812 1.00 0.00 H TER 4873 WAT 3798 ATOM 4873 O WAT 3799 44.481 17.995 72.086 1.00 0.00 O ATOM 4874 H1 WAT 3799 43.635 18.238 71.709 1.00 0.00 H ATOM 4875 H2 WAT 3799 44.379 18.153 73.025 1.00 0.00 H TER 4877 WAT 3799 ATOM 4877 O WAT 3800 7.022 1.939 130.203 1.00 0.00 O ATOM 4878 H1 WAT 3800 7.234 1.028 130.405 1.00 0.00 H ATOM 4879 H2 WAT 3800 6.141 1.903 129.830 1.00 0.00 H TER 4881 WAT 3800 ATOM 4881 O WAT 3801 16.241 2.840 70.431 1.00 0.00 O ATOM 4882 H1 WAT 3801 15.412 2.781 69.957 1.00 0.00 H ATOM 4883 H2 WAT 3801 16.488 1.930 70.596 1.00 0.00 H TER 4885 WAT 3801 ATOM 4885 O WAT 3802 90.310 62.886 10.859 1.00 0.00 O ATOM 4886 H1 WAT 3802 89.871 63.474 11.474 1.00 0.00 H ATOM 4887 H2 WAT 3802 90.060 62.008 11.149 1.00 0.00 H TER 4889 WAT 3802 ATOM 4889 O WAT 3803 76.771 20.302 68.552 1.00 0.00 O ATOM 4890 H1 WAT 3803 76.729 21.256 68.489 1.00 0.00 H ATOM 4891 H2 WAT 3803 76.536 19.993 67.678 1.00 0.00 H TER 4893 WAT 3803 ATOM 4893 O WAT 3804 33.343 143.491 157.774 1.00 0.00 O ATOM 4894 H1 WAT 3804 34.160 143.806 158.160 1.00 0.00 H ATOM 4895 H2 WAT 3804 33.198 144.063 157.019 1.00 0.00 H TER 4897 WAT 3804 ATOM 4897 O WAT 3805 18.899 17.192 9.746 1.00 0.00 O ATOM 4898 H1 WAT 3805 18.263 16.868 9.109 1.00 0.00 H ATOM 4899 H2 WAT 3805 19.455 17.790 9.247 1.00 0.00 H TER 4901 WAT 3805 ATOM 4901 O WAT 3806 3.942 64.919 2.319 1.00 0.00 O ATOM 4902 H1 WAT 3806 3.419 65.281 3.034 1.00 0.00 H ATOM 4903 H2 WAT 3806 3.542 64.068 2.137 1.00 0.00 H TER 4905 WAT 3806 ATOM 4905 O WAT 3807 89.010 108.997 17.561 1.00 0.00 O ATOM 4906 H1 WAT 3807 88.724 109.906 17.475 1.00 0.00 H ATOM 4907 H2 WAT 3807 88.812 108.767 18.469 1.00 0.00 H TER 4909 WAT 3807 ATOM 4909 O WAT 3808 64.410 104.950 14.919 1.00 0.00 O ATOM 4910 H1 WAT 3808 63.531 104.590 14.799 1.00 0.00 H ATOM 4911 H2 WAT 3808 64.291 105.898 14.858 1.00 0.00 H TER 4913 WAT 3808 ATOM 4913 O WAT 3809 57.790 43.783 156.374 1.00 0.00 O ATOM 4914 H1 WAT 3809 57.520 43.545 155.487 1.00 0.00 H ATOM 4915 H2 WAT 3809 58.555 43.234 156.547 1.00 0.00 H TER 4917 WAT 3809 ATOM 4917 O WAT 3810 123.276 95.742 81.315 1.00 0.00 O ATOM 4918 H1 WAT 3810 122.325 95.808 81.227 1.00 0.00 H ATOM 4919 H2 WAT 3810 123.417 95.535 82.239 1.00 0.00 H TER 4921 WAT 3810 ATOM 4921 O WAT 3811 78.207 50.237 153.182 1.00 0.00 O ATOM 4922 H1 WAT 3811 78.004 50.997 152.637 1.00 0.00 H ATOM 4923 H2 WAT 3811 77.816 49.497 152.718 1.00 0.00 H TER 4925 WAT 3811 ATOM 4925 O WAT 3812 131.012 97.289 112.985 1.00 0.00 O ATOM 4926 H1 WAT 3812 130.089 97.541 112.974 1.00 0.00 H ATOM 4927 H2 WAT 3812 131.225 97.195 113.913 1.00 0.00 H TER 4929 WAT 3812 ATOM 4929 O WAT 3813 14.562 84.649 84.407 1.00 0.00 O ATOM 4930 H1 WAT 3813 14.046 83.908 84.723 1.00 0.00 H ATOM 4931 H2 WAT 3813 15.452 84.468 84.711 1.00 0.00 H TER 4933 WAT 3813 ATOM 4933 O WAT 3814 81.871 52.625 13.449 1.00 0.00 O ATOM 4934 H1 WAT 3814 81.603 52.238 14.284 1.00 0.00 H ATOM 4935 H2 WAT 3814 81.368 53.437 13.389 1.00 0.00 H TER 4937 WAT 3814 ATOM 4937 O WAT 3815 115.020 4.395 149.986 1.00 0.00 O ATOM 4938 H1 WAT 3815 115.382 3.547 149.727 1.00 0.00 H ATOM 4939 H2 WAT 3815 115.690 4.778 150.553 1.00 0.00 H TER 4941 WAT 3815 ATOM 4941 O WAT 3816 0.231 71.575 84.972 1.00 0.00 O ATOM 4942 H1 WAT 3816 0.061 70.657 85.184 1.00 0.00 H ATOM 4943 H2 WAT 3816 -0.326 72.068 85.575 1.00 0.00 H TER 4945 WAT 3816 ATOM 4945 O WAT 3817 9.884 127.675 56.262 1.00 0.00 O ATOM 4946 H1 WAT 3817 9.494 127.277 55.484 1.00 0.00 H ATOM 4947 H2 WAT 3817 9.145 127.824 56.852 1.00 0.00 H TER 4949 WAT 3817 ATOM 4949 O WAT 3818 47.324 119.149 75.695 1.00 0.00 O ATOM 4950 H1 WAT 3818 46.707 118.418 75.656 1.00 0.00 H ATOM 4951 H2 WAT 3818 47.867 119.045 74.913 1.00 0.00 H TER 4953 WAT 3818 ATOM 4953 O WAT 3819 116.758 17.162 83.153 1.00 0.00 O ATOM 4954 H1 WAT 3819 115.958 16.685 82.933 1.00 0.00 H ATOM 4955 H2 WAT 3819 117.084 17.482 82.312 1.00 0.00 H TER 4957 WAT 3819 ATOM 4957 O WAT 3820 119.530 86.893 116.364 1.00 0.00 O ATOM 4958 H1 WAT 3820 119.523 87.773 116.742 1.00 0.00 H ATOM 4959 H2 WAT 3820 120.341 86.500 116.688 1.00 0.00 H TER 4961 WAT 3820 ATOM 4961 O WAT 3821 119.953 37.076 73.104 1.00 0.00 O ATOM 4962 H1 WAT 3821 119.420 37.864 72.993 1.00 0.00 H ATOM 4963 H2 WAT 3821 120.636 37.153 72.437 1.00 0.00 H TER 4965 WAT 3821 ATOM 4965 O WAT 3822 61.639 52.621 115.755 1.00 0.00 O ATOM 4966 H1 WAT 3822 61.863 53.138 116.529 1.00 0.00 H ATOM 4967 H2 WAT 3822 61.087 51.914 116.090 1.00 0.00 H TER 4969 WAT 3822 ATOM 4969 O WAT 3823 60.532 1.269 149.379 1.00 0.00 O ATOM 4970 H1 WAT 3823 61.230 1.439 150.011 1.00 0.00 H ATOM 4971 H2 WAT 3823 59.845 0.843 149.891 1.00 0.00 H TER 4973 WAT 3823 ATOM 4973 O WAT 3824 121.779 86.051 99.364 1.00 0.00 O ATOM 4974 H1 WAT 3824 122.086 85.778 100.229 1.00 0.00 H ATOM 4975 H2 WAT 3824 121.671 85.233 98.879 1.00 0.00 H TER 4977 WAT 3824 ATOM 4977 O WAT 3825 49.892 92.887 116.368 1.00 0.00 O ATOM 4978 H1 WAT 3825 50.369 92.321 116.975 1.00 0.00 H ATOM 4979 H2 WAT 3825 49.613 93.630 116.903 1.00 0.00 H TER 4981 WAT 3825 ATOM 4981 O WAT 3826 26.259 24.698 27.464 1.00 0.00 O ATOM 4982 H1 WAT 3826 26.388 24.458 26.547 1.00 0.00 H ATOM 4983 H2 WAT 3826 25.741 25.503 27.430 1.00 0.00 H TER 4985 WAT 3826 ATOM 4985 O WAT 3827 25.856 143.984 2.369 1.00 0.00 O ATOM 4986 H1 WAT 3827 25.603 144.790 2.820 1.00 0.00 H ATOM 4987 H2 WAT 3827 25.228 143.331 2.676 1.00 0.00 H TER 4989 WAT 3827 ATOM 4989 O WAT 3828 67.597 136.197 65.652 1.00 0.00 O ATOM 4990 H1 WAT 3828 67.342 136.638 66.463 1.00 0.00 H ATOM 4991 H2 WAT 3828 68.331 135.637 65.905 1.00 0.00 H TER 4993 WAT 3828 ATOM 4993 O WAT 3829 30.486 100.459 138.587 1.00 0.00 O ATOM 4994 H1 WAT 3829 29.614 100.447 138.194 1.00 0.00 H ATOM 4995 H2 WAT 3829 30.743 99.537 138.628 1.00 0.00 H TER 4997 WAT 3829 ATOM 4997 O WAT 3830 26.717 45.294 99.454 1.00 0.00 O ATOM 4998 H1 WAT 3830 27.314 44.892 98.823 1.00 0.00 H ATOM 4999 H2 WAT 3830 25.869 45.304 99.010 1.00 0.00 H TER 5001 WAT 3830 ATOM 5001 O WAT 3831 117.311 114.928 6.677 1.00 0.00 O ATOM 5002 H1 WAT 3831 118.237 115.109 6.836 1.00 0.00 H ATOM 5003 H2 WAT 3831 117.036 114.406 7.431 1.00 0.00 H TER 5005 WAT 3831 ATOM 5005 O WAT 3832 89.988 51.068 61.083 1.00 0.00 O ATOM 5006 H1 WAT 3832 90.471 51.792 61.482 1.00 0.00 H ATOM 5007 H2 WAT 3832 90.246 51.087 60.162 1.00 0.00 H TER 5009 WAT 3832 ATOM 5009 O WAT 3833 6.996 92.147 103.683 1.00 0.00 O ATOM 5010 H1 WAT 3833 7.404 92.675 104.369 1.00 0.00 H ATOM 5011 H2 WAT 3833 7.709 91.606 103.342 1.00 0.00 H TER 5013 WAT 3833 ATOM 5013 O WAT 3834 128.163 53.304 88.308 1.00 0.00 O ATOM 5014 H1 WAT 3834 128.651 53.385 87.488 1.00 0.00 H ATOM 5015 H2 WAT 3834 127.806 52.417 88.287 1.00 0.00 H TER 5017 WAT 3834 ATOM 5017 O WAT 3835 136.255 40.884 131.099 1.00 0.00 O ATOM 5018 H1 WAT 3835 135.698 40.280 131.591 1.00 0.00 H ATOM 5019 H2 WAT 3835 135.718 41.669 130.989 1.00 0.00 H TER 5021 WAT 3835 ATOM 5021 O WAT 3836 119.520 137.500 156.142 1.00 0.00 O ATOM 5022 H1 WAT 3836 120.355 137.551 156.606 1.00 0.00 H ATOM 5023 H2 WAT 3836 119.759 137.516 155.215 1.00 0.00 H TER 5025 WAT 3836 ATOM 5025 O WAT 3837 92.397 45.090 150.943 1.00 0.00 O ATOM 5026 H1 WAT 3837 91.747 44.552 150.492 1.00 0.00 H ATOM 5027 H2 WAT 3837 92.536 44.647 151.780 1.00 0.00 H TER 5029 WAT 3837 ATOM 5029 O WAT 3838 10.462 50.273 19.983 1.00 0.00 O ATOM 5030 H1 WAT 3838 9.675 50.521 20.468 1.00 0.00 H ATOM 5031 H2 WAT 3838 10.930 49.682 20.573 1.00 0.00 H TER 5033 WAT 3838 ATOM 5033 O WAT 3839 93.690 92.637 126.055 1.00 0.00 O ATOM 5034 H1 WAT 3839 93.855 92.853 125.137 1.00 0.00 H ATOM 5035 H2 WAT 3839 94.381 93.092 126.536 1.00 0.00 H TER 5037 WAT 3839 ATOM 5037 O WAT 3840 130.467 75.975 148.105 1.00 0.00 O ATOM 5038 H1 WAT 3840 130.832 76.743 147.665 1.00 0.00 H ATOM 5039 H2 WAT 3840 131.169 75.326 148.076 1.00 0.00 H TER 5041 WAT 3840 ATOM 5041 O WAT 3841 114.990 94.088 127.732 1.00 0.00 O ATOM 5042 H1 WAT 3841 114.264 93.486 127.570 1.00 0.00 H ATOM 5043 H2 WAT 3841 114.596 94.815 128.213 1.00 0.00 H TER 5045 WAT 3841 ATOM 5045 O WAT 3842 56.094 25.815 78.992 1.00 0.00 O ATOM 5046 H1 WAT 3842 56.512 24.983 78.772 1.00 0.00 H ATOM 5047 H2 WAT 3842 56.559 26.464 78.464 1.00 0.00 H TER 5049 WAT 3842 ATOM 5049 O WAT 3843 121.241 26.863 115.118 1.00 0.00 O ATOM 5050 H1 WAT 3843 121.668 26.720 115.963 1.00 0.00 H ATOM 5051 H2 WAT 3843 120.307 26.893 115.325 1.00 0.00 H TER 5053 WAT 3843 ATOM 5053 O WAT 3844 71.135 131.835 114.594 1.00 0.00 O ATOM 5054 H1 WAT 3844 71.571 132.106 115.402 1.00 0.00 H ATOM 5055 H2 WAT 3844 70.471 132.508 114.444 1.00 0.00 H TER 5057 WAT 3844 ATOM 5057 O WAT 3845 121.511 67.250 28.230 1.00 0.00 O ATOM 5058 H1 WAT 3845 121.467 67.161 27.278 1.00 0.00 H ATOM 5059 H2 WAT 3845 120.601 67.376 28.500 1.00 0.00 H TER 5061 WAT 3845 ATOM 5061 O WAT 3846 83.201 70.088 2.570 1.00 0.00 O ATOM 5062 H1 WAT 3846 84.108 70.338 2.393 1.00 0.00 H ATOM 5063 H2 WAT 3846 82.681 70.658 2.003 1.00 0.00 H TER 5065 WAT 3846 ATOM 5065 O WAT 3847 18.293 14.550 102.186 1.00 0.00 O ATOM 5066 H1 WAT 3847 17.954 14.334 101.318 1.00 0.00 H ATOM 5067 H2 WAT 3847 17.670 14.150 102.793 1.00 0.00 H TER 5069 WAT 3847 ATOM 5069 O WAT 3848 30.756 48.048 152.843 1.00 0.00 O ATOM 5070 H1 WAT 3848 30.690 48.451 153.709 1.00 0.00 H ATOM 5071 H2 WAT 3848 31.477 47.424 152.924 1.00 0.00 H TER 5073 WAT 3848 ATOM 5073 O WAT 3849 5.677 122.986 133.444 1.00 0.00 O ATOM 5074 H1 WAT 3849 5.929 122.978 134.367 1.00 0.00 H ATOM 5075 H2 WAT 3849 6.351 122.464 133.008 1.00 0.00 H TER 5077 WAT 3849 ATOM 5077 O WAT 3850 67.882 13.986 77.744 1.00 0.00 O ATOM 5078 H1 WAT 3850 68.073 14.699 77.134 1.00 0.00 H ATOM 5079 H2 WAT 3850 68.039 14.364 78.610 1.00 0.00 H TER 5081 WAT 3850 ATOM 5081 O WAT 3851 16.582 23.139 121.925 1.00 0.00 O ATOM 5082 H1 WAT 3851 16.930 22.285 122.182 1.00 0.00 H ATOM 5083 H2 WAT 3851 15.772 23.228 122.426 1.00 0.00 H TER 5085 WAT 3851 ATOM 5085 O WAT 3852 122.390 112.377 85.299 1.00 0.00 O ATOM 5086 H1 WAT 3852 121.528 112.725 85.069 1.00 0.00 H ATOM 5087 H2 WAT 3852 122.789 113.062 85.834 1.00 0.00 H TER 5089 WAT 3852 ATOM 5089 O WAT 3853 32.517 45.536 54.163 1.00 0.00 O ATOM 5090 H1 WAT 3853 31.689 45.731 54.602 1.00 0.00 H ATOM 5091 H2 WAT 3853 33.189 45.779 54.800 1.00 0.00 H TER 5093 WAT 3853 ATOM 5093 O WAT 3854 64.357 37.216 97.949 1.00 0.00 O ATOM 5094 H1 WAT 3854 64.580 37.206 97.018 1.00 0.00 H ATOM 5095 H2 WAT 3854 63.406 37.320 97.967 1.00 0.00 H TER 5097 WAT 3854 ATOM 5097 O WAT 3855 89.434 82.595 0.281 1.00 0.00 O ATOM 5098 H1 WAT 3855 89.668 81.886 0.881 1.00 0.00 H ATOM 5099 H2 WAT 3855 90.229 83.124 0.216 1.00 0.00 H TER 5101 WAT 3855 ATOM 5101 O WAT 3856 98.733 124.883 151.571 1.00 0.00 O ATOM 5102 H1 WAT 3856 98.272 125.171 150.783 1.00 0.00 H ATOM 5103 H2 WAT 3856 98.774 125.665 152.123 1.00 0.00 H TER 5105 WAT 3856 ATOM 5105 O WAT 3857 65.182 112.030 17.779 1.00 0.00 O ATOM 5106 H1 WAT 3857 65.871 112.265 17.156 1.00 0.00 H ATOM 5107 H2 WAT 3857 65.647 111.872 18.601 1.00 0.00 H TER 5109 WAT 3857 ATOM 5109 O WAT 3858 68.738 81.406 114.187 1.00 0.00 O ATOM 5110 H1 WAT 3858 68.053 80.835 114.534 1.00 0.00 H ATOM 5111 H2 WAT 3858 69.270 80.834 113.634 1.00 0.00 H TER 5113 WAT 3858 ATOM 5113 O WAT 3859 69.944 125.056 107.031 1.00 0.00 O ATOM 5114 H1 WAT 3859 69.514 124.236 107.272 1.00 0.00 H ATOM 5115 H2 WAT 3859 69.228 125.685 106.940 1.00 0.00 H TER 5117 WAT 3859 ATOM 5117 O WAT 3860 6.793 30.955 10.062 1.00 0.00 O ATOM 5118 H1 WAT 3860 6.444 31.832 10.223 1.00 0.00 H ATOM 5119 H2 WAT 3860 7.736 31.087 9.962 1.00 0.00 H TER 5121 WAT 3860 ATOM 5121 O WAT 3861 38.627 75.572 65.511 1.00 0.00 O ATOM 5122 H1 WAT 3861 37.936 75.744 66.152 1.00 0.00 H ATOM 5123 H2 WAT 3861 38.359 76.062 64.734 1.00 0.00 H TER 5125 WAT 3861 ATOM 5125 O WAT 3862 108.217 114.495 109.989 1.00 0.00 O ATOM 5126 H1 WAT 3862 108.997 113.985 109.771 1.00 0.00 H ATOM 5127 H2 WAT 3862 107.594 113.849 110.323 1.00 0.00 H TER 5129 WAT 3862 ATOM 5129 O WAT 3863 85.199 128.826 88.768 1.00 0.00 O ATOM 5130 H1 WAT 3863 85.105 128.458 87.890 1.00 0.00 H ATOM 5131 H2 WAT 3863 86.120 128.686 88.988 1.00 0.00 H TER 5133 WAT 3863 ATOM 5133 O WAT 3864 36.325 20.398 128.674 1.00 0.00 O ATOM 5134 H1 WAT 3864 36.270 21.272 128.287 1.00 0.00 H ATOM 5135 H2 WAT 3864 37.062 19.984 128.226 1.00 0.00 H TER 5137 WAT 3864 ATOM 5137 O WAT 3865 16.280 79.145 131.163 1.00 0.00 O ATOM 5138 H1 WAT 3865 16.909 79.724 130.733 1.00 0.00 H ATOM 5139 H2 WAT 3865 15.480 79.233 130.644 1.00 0.00 H TER 5141 WAT 3865 ATOM 5141 O WAT 3866 9.490 110.783 136.207 1.00 0.00 O ATOM 5142 H1 WAT 3866 8.685 110.359 136.503 1.00 0.00 H ATOM 5143 H2 WAT 3866 10.019 110.069 135.851 1.00 0.00 H TER 5145 WAT 3866 ATOM 5145 O WAT 3867 112.237 17.108 79.102 1.00 0.00 O ATOM 5146 H1 WAT 3867 111.988 17.678 78.374 1.00 0.00 H ATOM 5147 H2 WAT 3867 113.107 16.787 78.868 1.00 0.00 H TER 5149 WAT 3867 ATOM 5149 O WAT 3868 12.497 10.918 15.583 1.00 0.00 O ATOM 5150 H1 WAT 3868 12.818 10.353 16.285 1.00 0.00 H ATOM 5151 H2 WAT 3868 11.546 10.823 15.613 1.00 0.00 H TER 5153 WAT 3868 ATOM 5153 O WAT 3869 30.251 90.702 105.140 1.00 0.00 O ATOM 5154 H1 WAT 3869 29.605 91.393 105.289 1.00 0.00 H ATOM 5155 H2 WAT 3869 31.073 91.171 104.992 1.00 0.00 H TER 5157 WAT 3869 ATOM 5157 O WAT 3870 68.099 50.867 78.146 1.00 0.00 O ATOM 5158 H1 WAT 3870 68.116 51.538 78.828 1.00 0.00 H ATOM 5159 H2 WAT 3870 67.746 50.091 78.581 1.00 0.00 H TER 5161 WAT 3870 ATOM 5161 O WAT 3871 121.109 138.543 81.696 1.00 0.00 O ATOM 5162 H1 WAT 3871 120.665 137.701 81.801 1.00 0.00 H ATOM 5163 H2 WAT 3871 121.005 138.975 82.543 1.00 0.00 H TER 5165 WAT 3871 ATOM 5165 O WAT 3872 122.679 72.088 104.829 1.00 0.00 O ATOM 5166 H1 WAT 3872 122.653 71.278 104.321 1.00 0.00 H ATOM 5167 H2 WAT 3872 122.236 72.732 104.276 1.00 0.00 H TER 5169 WAT 3872 ATOM 5169 O WAT 3873 56.510 72.342 0.999 1.00 0.00 O ATOM 5170 H1 WAT 3873 57.286 72.231 1.547 1.00 0.00 H ATOM 5171 H2 WAT 3873 56.611 73.213 0.614 1.00 0.00 H TER 5173 WAT 3873 ATOM 5173 O WAT 3874 59.501 92.646 78.451 1.00 0.00 O ATOM 5174 H1 WAT 3874 59.821 93.492 78.137 1.00 0.00 H ATOM 5175 H2 WAT 3874 60.000 92.000 77.951 1.00 0.00 H TER 5177 WAT 3874 ATOM 5177 O WAT 3875 49.092 96.554 72.285 1.00 0.00 O ATOM 5178 H1 WAT 3875 48.380 96.574 71.646 1.00 0.00 H ATOM 5179 H2 WAT 3875 48.728 96.079 73.033 1.00 0.00 H TER 5181 WAT 3875 ATOM 5181 O WAT 3876 116.112 1.810 89.144 1.00 0.00 O ATOM 5182 H1 WAT 3876 115.693 2.470 88.592 1.00 0.00 H ATOM 5183 H2 WAT 3876 115.941 0.980 88.698 1.00 0.00 H TER 5185 WAT 3876 ATOM 5185 O WAT 3877 61.444 90.166 126.833 1.00 0.00 O ATOM 5186 H1 WAT 3877 61.762 90.338 127.720 1.00 0.00 H ATOM 5187 H2 WAT 3877 60.506 90.352 126.875 1.00 0.00 H TER 5189 WAT 3877 ATOM 5189 O WAT 3878 78.244 145.624 69.568 1.00 0.00 O ATOM 5190 H1 WAT 3878 77.398 145.550 70.010 1.00 0.00 H ATOM 5191 H2 WAT 3878 78.051 146.099 68.759 1.00 0.00 H TER 5193 WAT 3878 ATOM 5193 O WAT 3879 63.525 75.142 76.384 1.00 0.00 O ATOM 5194 H1 WAT 3879 62.705 74.926 76.828 1.00 0.00 H ATOM 5195 H2 WAT 3879 63.253 75.537 75.556 1.00 0.00 H TER 5197 WAT 3879 ATOM 5197 O WAT 3880 28.440 10.470 95.926 1.00 0.00 O ATOM 5198 H1 WAT 3880 28.813 10.877 96.708 1.00 0.00 H ATOM 5199 H2 WAT 3880 28.735 9.560 95.966 1.00 0.00 H TER 5201 WAT 3880 ATOM 5201 O WAT 3881 95.914 17.563 64.187 1.00 0.00 O ATOM 5202 H1 WAT 3881 96.331 18.253 64.702 1.00 0.00 H ATOM 5203 H2 WAT 3881 95.028 17.887 64.025 1.00 0.00 H TER 5205 WAT 3881 ATOM 5205 O WAT 3882 84.978 72.382 88.093 1.00 0.00 O ATOM 5206 H1 WAT 3882 84.053 72.617 88.023 1.00 0.00 H ATOM 5207 H2 WAT 3882 85.381 72.759 87.311 1.00 0.00 H TER 5209 WAT 3882 ATOM 5209 O WAT 3883 4.376 65.425 68.307 1.00 0.00 O ATOM 5210 H1 WAT 3883 4.931 66.100 67.915 1.00 0.00 H ATOM 5211 H2 WAT 3883 3.797 65.150 67.597 1.00 0.00 H TER 5213 WAT 3883 ATOM 5213 O WAT 3884 79.486 85.922 154.753 1.00 0.00 O ATOM 5214 H1 WAT 3884 79.336 86.020 155.693 1.00 0.00 H ATOM 5215 H2 WAT 3884 79.361 84.987 154.587 1.00 0.00 H TER 5217 WAT 3884 ATOM 5217 O WAT 3885 68.531 63.546 114.144 1.00 0.00 O ATOM 5218 H1 WAT 3885 68.322 62.960 114.871 1.00 0.00 H ATOM 5219 H2 WAT 3885 67.701 63.973 113.934 1.00 0.00 H TER 5221 WAT 3885 ATOM 5221 O WAT 3886 138.542 129.953 79.235 1.00 0.00 O ATOM 5222 H1 WAT 3886 138.975 130.257 80.033 1.00 0.00 H ATOM 5223 H2 WAT 3886 138.496 129.002 79.335 1.00 0.00 H TER 5225 WAT 3886 ATOM 5225 O WAT 3887 131.302 52.022 9.306 1.00 0.00 O ATOM 5226 H1 WAT 3887 131.918 51.327 9.539 1.00 0.00 H ATOM 5227 H2 WAT 3887 131.303 52.032 8.349 1.00 0.00 H TER 5229 WAT 3887 ATOM 5229 O WAT 3888 12.624 21.261 5.311 1.00 0.00 O ATOM 5230 H1 WAT 3888 12.268 21.836 4.633 1.00 0.00 H ATOM 5231 H2 WAT 3888 13.554 21.185 5.096 1.00 0.00 H TER 5233 WAT 3888 ATOM 5233 O WAT 3889 89.065 15.695 150.137 1.00 0.00 O ATOM 5234 H1 WAT 3889 88.270 15.985 149.691 1.00 0.00 H ATOM 5235 H2 WAT 3889 89.258 14.841 149.752 1.00 0.00 H TER 5237 WAT 3889 ATOM 5237 O WAT 3890 75.237 33.781 87.483 1.00 0.00 O ATOM 5238 H1 WAT 3890 75.146 33.700 86.534 1.00 0.00 H ATOM 5239 H2 WAT 3890 76.107 34.161 87.608 1.00 0.00 H TER 5241 WAT 3890 ATOM 5241 O WAT 3891 91.677 35.830 69.684 1.00 0.00 O ATOM 5242 H1 WAT 3891 91.818 35.082 70.265 1.00 0.00 H ATOM 5243 H2 WAT 3891 92.363 36.453 69.925 1.00 0.00 H TER 5245 WAT 3891 ATOM 5245 O WAT 3892 36.547 45.547 0.469 1.00 0.00 O ATOM 5246 H1 WAT 3892 37.446 45.654 0.781 1.00 0.00 H ATOM 5247 H2 WAT 3892 36.342 46.377 0.039 1.00 0.00 H TER 5249 WAT 3892 ATOM 5249 O WAT 3893 90.956 135.458 3.661 1.00 0.00 O ATOM 5250 H1 WAT 3893 91.417 134.790 3.153 1.00 0.00 H ATOM 5251 H2 WAT 3893 91.319 135.382 4.543 1.00 0.00 H TER 5253 WAT 3893 ATOM 5253 O WAT 3894 80.013 72.790 126.990 1.00 0.00 O ATOM 5254 H1 WAT 3894 79.961 72.354 126.139 1.00 0.00 H ATOM 5255 H2 WAT 3894 79.103 72.865 127.277 1.00 0.00 H TER 5257 WAT 3894 ATOM 5257 O WAT 3895 60.814 73.379 18.638 1.00 0.00 O ATOM 5258 H1 WAT 3895 61.432 73.870 19.179 1.00 0.00 H ATOM 5259 H2 WAT 3895 59.967 73.792 18.806 1.00 0.00 H TER 5261 WAT 3895 ATOM 5261 O WAT 3896 95.694 42.793 133.309 1.00 0.00 O ATOM 5262 H1 WAT 3896 95.538 42.095 133.946 1.00 0.00 H ATOM 5263 H2 WAT 3896 96.310 43.382 133.745 1.00 0.00 H TER 5265 WAT 3896 ATOM 5265 O WAT 3897 111.670 71.007 156.990 1.00 0.00 O ATOM 5266 H1 WAT 3897 111.076 71.555 156.477 1.00 0.00 H ATOM 5267 H2 WAT 3897 111.183 70.808 157.789 1.00 0.00 H TER 5269 WAT 3897 ATOM 5269 O WAT 3898 31.355 125.479 138.946 1.00 0.00 O ATOM 5270 H1 WAT 3898 31.131 124.909 139.682 1.00 0.00 H ATOM 5271 H2 WAT 3898 30.951 125.060 138.186 1.00 0.00 H TER 5273 WAT 3898 ATOM 5273 O WAT 3899 96.078 7.862 86.377 1.00 0.00 O ATOM 5274 H1 WAT 3899 95.317 7.630 86.910 1.00 0.00 H ATOM 5275 H2 WAT 3899 96.635 8.373 86.964 1.00 0.00 H TER 5277 WAT 3899 ATOM 5277 O WAT 3900 93.524 5.513 150.297 1.00 0.00 O ATOM 5278 H1 WAT 3900 94.360 5.797 150.667 1.00 0.00 H ATOM 5279 H2 WAT 3900 93.075 6.326 150.068 1.00 0.00 H TER 5281 WAT 3900 ATOM 5281 O WAT 3901 44.428 63.942 147.277 1.00 0.00 O ATOM 5282 H1 WAT 3901 45.135 64.545 147.047 1.00 0.00 H ATOM 5283 H2 WAT 3901 43.723 64.156 146.665 1.00 0.00 H TER 5285 WAT 3901 ATOM 5285 O WAT 3902 66.337 115.263 99.388 1.00 0.00 O ATOM 5286 H1 WAT 3902 65.387 115.237 99.500 1.00 0.00 H ATOM 5287 H2 WAT 3902 66.465 115.608 98.504 1.00 0.00 H TER 5289 WAT 3902 ATOM 5289 O WAT 3903 0.349 136.933 4.696 1.00 0.00 O ATOM 5290 H1 WAT 3903 -0.254 136.526 4.074 1.00 0.00 H ATOM 5291 H2 WAT 3903 -0.175 137.067 5.485 1.00 0.00 H TER 5293 WAT 3903 ATOM 5293 O WAT 3904 102.366 128.283 158.093 1.00 0.00 O ATOM 5294 H1 WAT 3904 102.117 127.359 158.062 1.00 0.00 H ATOM 5295 H2 WAT 3904 101.803 128.705 157.444 1.00 0.00 H TER 5297 WAT 3904 ATOM 5297 O WAT 3905 144.586 8.310 118.624 1.00 0.00 O ATOM 5298 H1 WAT 3905 143.823 8.466 119.181 1.00 0.00 H ATOM 5299 H2 WAT 3905 144.776 9.162 118.233 1.00 0.00 H TER 5301 WAT 3905 ATOM 5301 O WAT 3906 93.389 129.126 80.656 1.00 0.00 O ATOM 5302 H1 WAT 3906 92.876 129.872 80.344 1.00 0.00 H ATOM 5303 H2 WAT 3906 94.185 129.144 80.126 1.00 0.00 H TER 5305 WAT 3906 ATOM 5305 O WAT 3907 100.426 9.751 119.637 1.00 0.00 O ATOM 5306 H1 WAT 3907 101.259 10.220 119.691 1.00 0.00 H ATOM 5307 H2 WAT 3907 100.561 8.962 120.162 1.00 0.00 H TER 5309 WAT 3907 ATOM 5309 O WAT 3908 107.754 38.876 12.293 1.00 0.00 O ATOM 5310 H1 WAT 3908 106.841 38.587 12.282 1.00 0.00 H ATOM 5311 H2 WAT 3908 108.232 38.175 11.849 1.00 0.00 H TER 5313 WAT 3908 ATOM 5313 O WAT 3909 74.093 53.646 106.748 1.00 0.00 O ATOM 5314 H1 WAT 3909 74.707 54.042 107.367 1.00 0.00 H ATOM 5315 H2 WAT 3909 74.096 52.715 106.971 1.00 0.00 H TER 5317 WAT 3909 ATOM 5317 O WAT 3910 24.278 139.722 53.990 1.00 0.00 O ATOM 5318 H1 WAT 3910 23.618 139.111 53.662 1.00 0.00 H ATOM 5319 H2 WAT 3910 24.359 140.380 53.300 1.00 0.00 H TER 5321 WAT 3910 ATOM 5321 O WAT 3911 57.776 83.016 74.507 1.00 0.00 O ATOM 5322 H1 WAT 3911 58.570 83.349 74.925 1.00 0.00 H ATOM 5323 H2 WAT 3911 57.979 83.018 73.572 1.00 0.00 H TER 5325 WAT 3911 ATOM 5325 O WAT 3912 115.061 126.435 8.127 1.00 0.00 O ATOM 5326 H1 WAT 3912 114.119 126.551 7.999 1.00 0.00 H ATOM 5327 H2 WAT 3912 115.181 126.484 9.075 1.00 0.00 H TER 5329 WAT 3912 ATOM 5329 O WAT 3913 85.803 145.498 73.024 1.00 0.00 O ATOM 5330 H1 WAT 3913 85.710 145.036 72.191 1.00 0.00 H ATOM 5331 H2 WAT 3913 86.598 145.133 73.413 1.00 0.00 H TER 5333 WAT 3913 ATOM 5333 O WAT 3914 1.902 8.458 8.691 1.00 0.00 O ATOM 5334 H1 WAT 3914 1.517 7.870 8.042 1.00 0.00 H ATOM 5335 H2 WAT 3914 1.981 7.924 9.482 1.00 0.00 H TER 5337 WAT 3914 ATOM 5337 O WAT 3915 75.060 95.155 110.948 1.00 0.00 O ATOM 5338 H1 WAT 3915 74.163 94.932 111.199 1.00 0.00 H ATOM 5339 H2 WAT 3915 74.978 95.990 110.486 1.00 0.00 H TER 5341 WAT 3915 ATOM 5341 O WAT 3916 61.337 143.421 90.031 1.00 0.00 O ATOM 5342 H1 WAT 3916 61.903 144.185 90.139 1.00 0.00 H ATOM 5343 H2 WAT 3916 61.910 142.673 90.200 1.00 0.00 H TER 5345 WAT 3916 ATOM 5345 O WAT 3917 74.040 7.806 102.642 1.00 0.00 O ATOM 5346 H1 WAT 3917 73.976 8.314 103.450 1.00 0.00 H ATOM 5347 H2 WAT 3917 73.988 6.894 102.928 1.00 0.00 H TER 5349 WAT 3917 ATOM 5349 O WAT 3918 40.658 89.193 122.720 1.00 0.00 O ATOM 5350 H1 WAT 3918 40.725 90.116 122.478 1.00 0.00 H ATOM 5351 H2 WAT 3918 39.729 89.061 122.911 1.00 0.00 H TER 5353 WAT 3918 ATOM 5353 O WAT 3919 112.706 125.883 99.176 1.00 0.00 O ATOM 5354 H1 WAT 3919 112.640 125.434 98.333 1.00 0.00 H ATOM 5355 H2 WAT 3919 111.890 125.665 99.627 1.00 0.00 H TER 5357 WAT 3919 ATOM 5357 O WAT 3920 37.766 20.133 70.176 1.00 0.00 O ATOM 5358 H1 WAT 3920 38.132 19.755 69.376 1.00 0.00 H ATOM 5359 H2 WAT 3920 38.430 19.967 70.844 1.00 0.00 H TER 5361 WAT 3920 ATOM 5361 O WAT 3921 41.875 88.938 4.289 1.00 0.00 O ATOM 5362 H1 WAT 3921 41.546 89.643 3.732 1.00 0.00 H ATOM 5363 H2 WAT 3921 41.954 89.334 5.156 1.00 0.00 H TER 5365 WAT 3921 ATOM 5365 O WAT 3922 86.273 67.862 0.512 1.00 0.00 O ATOM 5366 H1 WAT 3922 85.329 67.834 0.357 1.00 0.00 H ATOM 5367 H2 WAT 3922 86.386 67.466 1.376 1.00 0.00 H TER 5369 WAT 3922 ATOM 5369 O WAT 3923 128.061 138.711 96.703 1.00 0.00 O ATOM 5370 H1 WAT 3923 127.226 138.959 96.306 1.00 0.00 H ATOM 5371 H2 WAT 3923 128.332 137.929 96.222 1.00 0.00 H TER 5373 WAT 3923 ATOM 5373 O WAT 3924 60.777 84.765 26.615 1.00 0.00 O ATOM 5374 H1 WAT 3924 60.528 85.561 27.085 1.00 0.00 H ATOM 5375 H2 WAT 3924 61.184 85.081 25.808 1.00 0.00 H TER 5377 WAT 3924 ATOM 5377 O WAT 3925 62.321 140.969 3.767 1.00 0.00 O ATOM 5378 H1 WAT 3925 61.715 141.376 4.387 1.00 0.00 H ATOM 5379 H2 WAT 3925 63.140 140.880 4.256 1.00 0.00 H TER 5381 WAT 3925 ATOM 5381 O WAT 3926 79.490 76.254 127.172 1.00 0.00 O ATOM 5382 H1 WAT 3926 80.085 76.968 126.943 1.00 0.00 H ATOM 5383 H2 WAT 3926 79.540 75.654 126.427 1.00 0.00 H TER 5385 WAT 3926 ATOM 5385 O WAT 3927 141.383 57.710 10.941 1.00 0.00 O ATOM 5386 H1 WAT 3927 141.183 57.152 10.189 1.00 0.00 H ATOM 5387 H2 WAT 3927 141.593 57.096 11.645 1.00 0.00 H TER 5389 WAT 3927 ATOM 5389 O WAT 3928 141.040 72.008 120.533 1.00 0.00 O ATOM 5390 H1 WAT 3928 140.915 72.706 121.177 1.00 0.00 H ATOM 5391 H2 WAT 3928 140.499 72.270 119.788 1.00 0.00 H TER 5393 WAT 3928 ATOM 5393 O WAT 3929 50.808 74.373 145.967 1.00 0.00 O ATOM 5394 H1 WAT 3929 50.857 74.977 145.226 1.00 0.00 H ATOM 5395 H2 WAT 3929 51.709 74.073 146.090 1.00 0.00 H TER 5397 WAT 3929 ATOM 5397 O WAT 3930 27.014 46.729 13.497 1.00 0.00 O ATOM 5398 H1 WAT 3930 27.107 47.579 13.068 1.00 0.00 H ATOM 5399 H2 WAT 3930 27.824 46.264 13.288 1.00 0.00 H TER 5401 WAT 3930 ATOM 5401 O WAT 3931 107.720 113.456 22.777 1.00 0.00 O ATOM 5402 H1 WAT 3931 108.671 113.521 22.684 1.00 0.00 H ATOM 5403 H2 WAT 3931 107.555 113.663 23.697 1.00 0.00 H TER 5405 WAT 3931 ATOM 5405 O WAT 3932 90.249 101.315 137.734 1.00 0.00 O ATOM 5406 H1 WAT 3932 90.718 102.093 138.038 1.00 0.00 H ATOM 5407 H2 WAT 3932 89.381 101.637 137.492 1.00 0.00 H TER 5409 WAT 3932 ATOM 5409 O WAT 3933 47.330 124.647 81.372 1.00 0.00 O ATOM 5410 H1 WAT 3933 46.438 124.739 81.709 1.00 0.00 H ATOM 5411 H2 WAT 3933 47.862 125.190 81.953 1.00 0.00 H TER 5413 WAT 3933 ATOM 5413 O WAT 3934 53.887 49.616 111.516 1.00 0.00 O ATOM 5414 H1 WAT 3934 52.985 49.841 111.290 1.00 0.00 H ATOM 5415 H2 WAT 3934 54.421 50.225 111.006 1.00 0.00 H TER 5417 WAT 3934 ATOM 5417 O WAT 3935 134.395 45.309 67.936 1.00 0.00 O ATOM 5418 H1 WAT 3935 134.230 45.930 68.646 1.00 0.00 H ATOM 5419 H2 WAT 3935 135.134 45.685 67.457 1.00 0.00 H TER 5421 WAT 3935 ATOM 5421 O WAT 3936 8.913 56.951 116.113 1.00 0.00 O ATOM 5422 H1 WAT 3936 8.209 56.469 116.547 1.00 0.00 H ATOM 5423 H2 WAT 3936 8.480 57.409 115.392 1.00 0.00 H TER 5425 WAT 3936 ATOM 5425 O WAT 3937 131.387 77.662 123.653 1.00 0.00 O ATOM 5426 H1 WAT 3937 131.745 77.035 124.282 1.00 0.00 H ATOM 5427 H2 WAT 3937 131.245 78.459 124.165 1.00 0.00 H TER 5429 WAT 3937 ATOM 5429 O WAT 3938 47.159 13.969 150.673 1.00 0.00 O ATOM 5430 H1 WAT 3938 47.340 13.044 150.845 1.00 0.00 H ATOM 5431 H2 WAT 3938 48.016 14.348 150.478 1.00 0.00 H TER 5433 WAT 3938 ATOM 5433 O WAT 3939 124.245 66.348 25.996 1.00 0.00 O ATOM 5434 H1 WAT 3939 124.773 66.860 25.384 1.00 0.00 H ATOM 5435 H2 WAT 3939 124.544 66.627 26.862 1.00 0.00 H TER 5437 WAT 3939 ATOM 5437 O WAT 3940 117.084 -0.229 92.552 1.00 0.00 O ATOM 5438 H1 WAT 3940 116.381 -0.020 93.167 1.00 0.00 H ATOM 5439 H2 WAT 3940 117.346 0.618 92.191 1.00 0.00 H TER 5441 WAT 3940 ATOM 5441 O WAT 3941 79.597 120.839 141.568 1.00 0.00 O ATOM 5442 H1 WAT 3941 79.096 121.104 140.796 1.00 0.00 H ATOM 5443 H2 WAT 3941 79.911 121.662 141.943 1.00 0.00 H TER 5445 WAT 3941 ATOM 5445 O WAT 3942 17.391 121.132 69.665 1.00 0.00 O ATOM 5446 H1 WAT 3942 17.089 121.391 68.795 1.00 0.00 H ATOM 5447 H2 WAT 3942 18.103 120.514 69.497 1.00 0.00 H TER 5449 WAT 3942 ATOM 5449 O WAT 3943 101.647 99.099 115.745 1.00 0.00 O ATOM 5450 H1 WAT 3943 101.061 98.365 115.929 1.00 0.00 H ATOM 5451 H2 WAT 3943 101.169 99.869 116.054 1.00 0.00 H TER 5453 WAT 3943 ATOM 5453 O WAT 3944 123.174 113.769 16.688 1.00 0.00 O ATOM 5454 H1 WAT 3944 123.534 114.430 17.280 1.00 0.00 H ATOM 5455 H2 WAT 3944 122.362 114.157 16.361 1.00 0.00 H TER 5457 WAT 3944 ATOM 5457 O WAT 3945 59.837 84.188 100.396 1.00 0.00 O ATOM 5458 H1 WAT 3945 60.543 84.005 101.015 1.00 0.00 H ATOM 5459 H2 WAT 3945 59.412 83.341 100.261 1.00 0.00 H TER 5461 WAT 3945 ATOM 5461 O WAT 3946 14.618 115.992 87.436 1.00 0.00 O ATOM 5462 H1 WAT 3946 13.712 116.264 87.586 1.00 0.00 H ATOM 5463 H2 WAT 3946 14.628 115.680 86.531 1.00 0.00 H TER 5465 WAT 3946 ATOM 5465 O WAT 3947 45.295 86.726 150.869 1.00 0.00 O ATOM 5466 H1 WAT 3947 44.437 87.136 150.754 1.00 0.00 H ATOM 5467 H2 WAT 3947 45.229 85.897 150.396 1.00 0.00 H TER 5469 WAT 3947 ATOM 5469 O WAT 3948 44.049 69.811 78.267 1.00 0.00 O ATOM 5470 H1 WAT 3948 44.064 68.913 78.597 1.00 0.00 H ATOM 5471 H2 WAT 3948 43.529 70.294 78.909 1.00 0.00 H TER 5473 WAT 3948 ATOM 5473 O WAT 3949 134.082 102.384 102.637 1.00 0.00 O ATOM 5474 H1 WAT 3949 134.897 101.982 102.337 1.00 0.00 H ATOM 5475 H2 WAT 3949 133.970 103.149 102.072 1.00 0.00 H TER 5477 WAT 3949 ATOM 5477 O WAT 3950 42.076 64.126 124.321 1.00 0.00 O ATOM 5478 H1 WAT 3950 42.026 64.932 124.834 1.00 0.00 H ATOM 5479 H2 WAT 3950 42.806 64.271 123.718 1.00 0.00 H TER 5481 WAT 3950 ATOM 5481 O WAT 3951 8.001 4.308 121.344 1.00 0.00 O ATOM 5482 H1 WAT 3951 7.111 4.092 121.625 1.00 0.00 H ATOM 5483 H2 WAT 3951 7.883 4.960 120.654 1.00 0.00 H TER 5485 WAT 3951 ATOM 5485 O WAT 3952 93.254 66.472 145.277 1.00 0.00 O ATOM 5486 H1 WAT 3952 93.227 65.750 144.650 1.00 0.00 H ATOM 5487 H2 WAT 3952 92.666 67.132 144.908 1.00 0.00 H TER 5489 WAT 3952 ATOM 5489 O WAT 3953 117.616 40.004 143.741 1.00 0.00 O ATOM 5490 H1 WAT 3953 118.213 40.731 143.916 1.00 0.00 H ATOM 5491 H2 WAT 3953 118.070 39.474 143.086 1.00 0.00 H TER 5493 WAT 3953 ATOM 5493 O WAT 3954 23.156 47.288 137.873 1.00 0.00 O ATOM 5494 H1 WAT 3954 23.804 47.721 137.318 1.00 0.00 H ATOM 5495 H2 WAT 3954 23.040 46.424 137.476 1.00 0.00 H TER 5497 WAT 3954 ATOM 5497 O WAT 3955 2.703 56.107 145.494 1.00 0.00 O ATOM 5498 H1 WAT 3955 3.632 55.884 145.448 1.00 0.00 H ATOM 5499 H2 WAT 3955 2.290 55.555 144.830 1.00 0.00 H TER 5501 WAT 3955 ATOM 5501 O WAT 3956 105.060 108.335 94.931 1.00 0.00 O ATOM 5502 H1 WAT 3956 105.529 107.834 94.263 1.00 0.00 H ATOM 5503 H2 WAT 3956 104.838 109.160 94.498 1.00 0.00 H TER 5505 WAT 3956 ATOM 5505 O WAT 3957 66.835 81.643 64.197 1.00 0.00 O ATOM 5506 H1 WAT 3957 66.347 81.069 63.607 1.00 0.00 H ATOM 5507 H2 WAT 3957 66.468 82.513 64.043 1.00 0.00 H TER 5509 WAT 3957 ATOM 5509 O WAT 3958 46.952 75.260 132.270 1.00 0.00 O ATOM 5510 H1 WAT 3958 47.042 75.829 131.505 1.00 0.00 H ATOM 5511 H2 WAT 3958 47.344 74.430 131.998 1.00 0.00 H TER 5513 WAT 3958 ATOM 5513 O WAT 3959 31.638 140.587 3.269 1.00 0.00 O ATOM 5514 H1 WAT 3959 31.259 141.188 3.910 1.00 0.00 H ATOM 5515 H2 WAT 3959 32.506 140.948 3.086 1.00 0.00 H TER 5517 WAT 3959 ATOM 5517 O WAT 3960 37.790 139.169 72.455 1.00 0.00 O ATOM 5518 H1 WAT 3960 36.957 138.735 72.273 1.00 0.00 H ATOM 5519 H2 WAT 3960 38.353 138.926 71.721 1.00 0.00 H TER 5521 WAT 3960 ATOM 5521 O WAT 3961 127.693 120.976 118.439 1.00 0.00 O ATOM 5522 H1 WAT 3961 127.304 120.455 119.141 1.00 0.00 H ATOM 5523 H2 WAT 3961 128.057 120.330 117.834 1.00 0.00 H TER 5525 WAT 3961 ATOM 5525 O WAT 3962 16.518 31.400 70.622 1.00 0.00 O ATOM 5526 H1 WAT 3962 16.095 32.258 70.581 1.00 0.00 H ATOM 5527 H2 WAT 3962 15.886 30.844 71.078 1.00 0.00 H TER 5529 WAT 3962 ATOM 5529 O WAT 3963 78.496 29.313 94.770 1.00 0.00 O ATOM 5530 H1 WAT 3963 79.401 29.535 94.553 1.00 0.00 H ATOM 5531 H2 WAT 3963 78.502 29.183 95.719 1.00 0.00 H TER 5533 WAT 3963 ATOM 5533 O WAT 3964 8.676 61.101 61.630 1.00 0.00 O ATOM 5534 H1 WAT 3964 8.708 61.577 62.460 1.00 0.00 H ATOM 5535 H2 WAT 3964 9.210 60.321 61.780 1.00 0.00 H TER 5537 WAT 3964 ATOM 5537 O WAT 3965 8.869 24.656 96.274 1.00 0.00 O ATOM 5538 H1 WAT 3965 9.012 24.032 95.562 1.00 0.00 H ATOM 5539 H2 WAT 3965 7.957 24.520 96.532 1.00 0.00 H TER 5541 WAT 3965 ATOM 5541 O WAT 3966 7.716 53.086 122.456 1.00 0.00 O ATOM 5542 H1 WAT 3966 7.857 54.021 122.307 1.00 0.00 H ATOM 5543 H2 WAT 3966 6.909 53.044 122.969 1.00 0.00 H TER 5545 WAT 3966 ATOM 5545 O WAT 3967 108.972 14.233 110.666 1.00 0.00 O ATOM 5546 H1 WAT 3967 109.809 14.474 110.269 1.00 0.00 H ATOM 5547 H2 WAT 3967 108.329 14.368 109.970 1.00 0.00 H TER 5549 WAT 3967 ATOM 5549 O WAT 3968 32.637 100.190 27.660 1.00 0.00 O ATOM 5550 H1 WAT 3968 32.190 100.721 28.319 1.00 0.00 H ATOM 5551 H2 WAT 3968 32.006 100.114 26.945 1.00 0.00 H TER 5553 WAT 3968 ATOM 5553 O WAT 3969 4.384 41.656 92.253 1.00 0.00 O ATOM 5554 H1 WAT 3969 3.471 41.371 92.231 1.00 0.00 H ATOM 5555 H2 WAT 3969 4.710 41.350 93.100 1.00 0.00 H TER 5557 WAT 3969 ATOM 5557 O WAT 3970 44.001 6.541 142.873 1.00 0.00 O ATOM 5558 H1 WAT 3970 43.783 6.421 141.949 1.00 0.00 H ATOM 5559 H2 WAT 3970 43.212 6.923 143.258 1.00 0.00 H TER 5561 WAT 3970 ATOM 5561 O WAT 3971 62.357 79.241 110.242 1.00 0.00 O ATOM 5562 H1 WAT 3971 62.567 79.282 109.309 1.00 0.00 H ATOM 5563 H2 WAT 3971 63.188 79.026 110.666 1.00 0.00 H TER 5565 WAT 3971 ATOM 5565 O WAT 3972 18.516 12.684 109.802 1.00 0.00 O ATOM 5566 H1 WAT 3972 18.317 13.086 108.957 1.00 0.00 H ATOM 5567 H2 WAT 3972 19.140 13.283 110.212 1.00 0.00 H TER 5569 WAT 3972 ATOM 5569 O WAT 3973 67.329 8.146 110.818 1.00 0.00 O ATOM 5570 H1 WAT 3973 67.241 7.831 111.718 1.00 0.00 H ATOM 5571 H2 WAT 3973 68.211 8.515 110.779 1.00 0.00 H TER 5573 WAT 3973 ATOM 5573 O WAT 3974 3.326 86.606 19.849 1.00 0.00 O ATOM 5574 H1 WAT 3974 2.803 87.126 19.238 1.00 0.00 H ATOM 5575 H2 WAT 3974 4.198 86.999 19.812 1.00 0.00 H TER 5577 WAT 3974 ATOM 5577 O WAT 3975 95.026 9.519 5.700 1.00 0.00 O ATOM 5578 H1 WAT 3975 95.888 9.127 5.562 1.00 0.00 H ATOM 5579 H2 WAT 3975 94.486 8.800 6.028 1.00 0.00 H TER 5581 WAT 3975 ATOM 5581 O WAT 3976 94.290 105.011 123.808 1.00 0.00 O ATOM 5582 H1 WAT 3976 94.019 105.786 123.316 1.00 0.00 H ATOM 5583 H2 WAT 3976 94.354 104.319 123.149 1.00 0.00 H TER 5585 WAT 3976 ATOM 5585 O WAT 3977 139.088 34.811 0.658 1.00 0.00 O ATOM 5586 H1 WAT 3977 139.069 34.740 1.612 1.00 0.00 H ATOM 5587 H2 WAT 3977 138.589 34.053 0.352 1.00 0.00 H TER 5589 WAT 3977 ATOM 5589 O WAT 3978 45.756 53.935 69.177 1.00 0.00 O ATOM 5590 H1 WAT 3978 45.742 53.683 70.100 1.00 0.00 H ATOM 5591 H2 WAT 3978 46.665 54.186 69.011 1.00 0.00 H TER 5593 WAT 3978 ATOM 5593 O WAT 3979 27.346 74.299 131.676 1.00 0.00 O ATOM 5594 H1 WAT 3979 27.933 73.623 132.015 1.00 0.00 H ATOM 5595 H2 WAT 3979 27.931 74.946 131.281 1.00 0.00 H TER 5597 WAT 3979 ATOM 5597 O WAT 3980 57.115 56.439 146.944 1.00 0.00 O ATOM 5598 H1 WAT 3980 57.433 57.052 147.607 1.00 0.00 H ATOM 5599 H2 WAT 3980 57.144 55.585 147.374 1.00 0.00 H TER 5601 WAT 3980 ATOM 5601 O WAT 3981 26.879 73.874 138.939 1.00 0.00 O ATOM 5602 H1 WAT 3981 27.215 74.766 139.029 1.00 0.00 H ATOM 5603 H2 WAT 3981 25.928 73.977 138.925 1.00 0.00 H TER 5605 WAT 3981 ATOM 5605 O WAT 3982 94.870 91.859 96.920 1.00 0.00 O ATOM 5606 H1 WAT 3982 93.926 91.714 96.860 1.00 0.00 H ATOM 5607 H2 WAT 3982 95.246 90.979 96.950 1.00 0.00 H TER 5609 WAT 3982 ATOM 5609 O WAT 3983 50.649 125.121 105.806 1.00 0.00 O ATOM 5610 H1 WAT 3983 50.845 125.930 105.333 1.00 0.00 H ATOM 5611 H2 WAT 3983 51.092 125.222 106.648 1.00 0.00 H TER 5613 WAT 3983 ATOM 5613 O WAT 3984 75.752 120.156 135.179 1.00 0.00 O ATOM 5614 H1 WAT 3984 75.693 120.762 135.918 1.00 0.00 H ATOM 5615 H2 WAT 3984 74.958 119.625 135.241 1.00 0.00 H TER 5617 WAT 3984 ATOM 5617 O WAT 3985 46.187 125.313 4.288 1.00 0.00 O ATOM 5618 H1 WAT 3985 45.236 125.377 4.193 1.00 0.00 H ATOM 5619 H2 WAT 3985 46.318 125.014 5.188 1.00 0.00 H TER 5621 WAT 3985 ATOM 5621 O WAT 3986 0.520 30.666 115.868 1.00 0.00 O ATOM 5622 H1 WAT 3986 0.194 30.477 114.988 1.00 0.00 H ATOM 5623 H2 WAT 3986 1.399 31.018 115.727 1.00 0.00 H TER 5625 WAT 3986 ATOM 5625 O WAT 3987 54.034 89.805 138.247 1.00 0.00 O ATOM 5626 H1 WAT 3987 53.338 89.327 138.698 1.00 0.00 H ATOM 5627 H2 WAT 3987 53.687 90.690 138.141 1.00 0.00 H TER 5629 WAT 3987 ATOM 5629 O WAT 3988 91.749 114.989 119.315 1.00 0.00 O ATOM 5630 H1 WAT 3988 90.938 114.697 118.898 1.00 0.00 H ATOM 5631 H2 WAT 3988 91.460 115.558 120.028 1.00 0.00 H TER 5633 WAT 3988 ATOM 5633 O WAT 3989 75.671 137.280 152.622 1.00 0.00 O ATOM 5634 H1 WAT 3989 74.779 137.442 152.315 1.00 0.00 H ATOM 5635 H2 WAT 3989 76.074 138.147 152.655 1.00 0.00 H TER 5637 WAT 3989 ATOM 5637 O WAT 3990 44.281 52.900 13.373 1.00 0.00 O ATOM 5638 H1 WAT 3990 43.805 52.762 14.192 1.00 0.00 H ATOM 5639 H2 WAT 3990 45.080 53.357 13.635 1.00 0.00 H TER 5641 WAT 3990 ATOM 5641 O WAT 3991 96.441 16.095 143.872 1.00 0.00 O ATOM 5642 H1 WAT 3991 96.448 15.493 144.616 1.00 0.00 H ATOM 5643 H2 WAT 3991 96.322 15.531 143.108 1.00 0.00 H TER 5645 WAT 3991 ATOM 5645 O WAT 3992 87.031 22.106 0.544 1.00 0.00 O ATOM 5646 H1 WAT 3992 86.190 21.941 0.118 1.00 0.00 H ATOM 5647 H2 WAT 3992 87.060 23.057 0.655 1.00 0.00 H TER 5649 WAT 3992 ATOM 5649 O WAT 3993 76.051 54.127 108.613 1.00 0.00 O ATOM 5650 H1 WAT 3993 76.169 54.718 109.356 1.00 0.00 H ATOM 5651 H2 WAT 3993 76.910 54.100 108.190 1.00 0.00 H TER 5653 WAT 3993 ATOM 5653 O WAT 3994 44.059 62.581 7.095 1.00 0.00 O ATOM 5654 H1 WAT 3994 44.608 62.098 6.477 1.00 0.00 H ATOM 5655 H2 WAT 3994 43.361 61.967 7.324 1.00 0.00 H TER 5657 WAT 3994 ATOM 5657 O WAT 3995 17.378 91.020 139.615 1.00 0.00 O ATOM 5658 H1 WAT 3995 18.313 91.226 139.637 1.00 0.00 H ATOM 5659 H2 WAT 3995 17.303 90.315 138.972 1.00 0.00 H TER 5661 WAT 3995 ATOM 5661 O WAT 3996 24.102 130.315 113.360 1.00 0.00 O ATOM 5662 H1 WAT 3996 24.450 129.424 113.374 1.00 0.00 H ATOM 5663 H2 WAT 3996 23.628 130.400 114.187 1.00 0.00 H TER 5665 WAT 3996 ATOM 5665 O WAT 3997 133.938 78.265 85.345 1.00 0.00 O ATOM 5666 H1 WAT 3997 133.877 78.146 84.397 1.00 0.00 H ATOM 5667 H2 WAT 3997 134.827 78.590 85.489 1.00 0.00 H TER 5669 WAT 3997 ATOM 5669 O WAT 3998 59.888 92.453 137.171 1.00 0.00 O ATOM 5670 H1 WAT 3998 59.685 91.750 136.553 1.00 0.00 H ATOM 5671 H2 WAT 3998 60.283 93.139 136.633 1.00 0.00 H TER 5673 WAT 3998 ATOM 5673 O WAT 3999 126.996 75.747 7.971 1.00 0.00 O ATOM 5674 H1 WAT 3999 127.164 76.177 7.132 1.00 0.00 H ATOM 5675 H2 WAT 3999 126.121 75.372 7.877 1.00 0.00 H TER 5677 WAT 3999 ATOM 5677 O WAT 4000 129.650 30.309 148.358 1.00 0.00 O ATOM 5678 H1 WAT 4000 130.114 30.944 148.904 1.00 0.00 H ATOM 5679 H2 WAT 4000 129.221 30.840 147.687 1.00 0.00 H TER 5681 WAT 4000 ATOM 5681 O WAT 4001 143.239 109.852 107.981 1.00 0.00 O ATOM 5682 H1 WAT 4001 143.757 109.944 107.181 1.00 0.00 H ATOM 5683 H2 WAT 4001 142.905 110.732 108.152 1.00 0.00 H TER 5685 WAT 4001 ATOM 5685 O WAT 4002 26.886 84.153 134.809 1.00 0.00 O ATOM 5686 H1 WAT 4002 26.975 85.052 134.494 1.00 0.00 H ATOM 5687 H2 WAT 4002 27.524 84.084 135.519 1.00 0.00 H TER 5689 WAT 4002 ATOM 5689 O WAT 4003 120.241 114.861 65.362 1.00 0.00 O ATOM 5690 H1 WAT 4003 119.459 114.399 65.664 1.00 0.00 H ATOM 5691 H2 WAT 4003 120.014 115.788 65.433 1.00 0.00 H TER 5693 WAT 4003 ATOM 5693 O WAT 4004 142.579 12.508 15.495 1.00 0.00 O ATOM 5694 H1 WAT 4004 143.022 12.754 14.683 1.00 0.00 H ATOM 5695 H2 WAT 4004 142.900 13.135 16.143 1.00 0.00 H TER 5697 WAT 4004 ATOM 5697 O WAT 4005 79.332 21.681 106.695 1.00 0.00 O ATOM 5698 H1 WAT 4005 78.652 22.351 106.774 1.00 0.00 H ATOM 5699 H2 WAT 4005 79.040 21.127 105.971 1.00 0.00 H TER 5701 WAT 4005 ATOM 5701 O WAT 4006 5.873 104.105 156.003 1.00 0.00 O ATOM 5702 H1 WAT 4006 5.492 104.944 155.742 1.00 0.00 H ATOM 5703 H2 WAT 4006 6.797 104.178 155.765 1.00 0.00 H TER 5705 WAT 4006 ATOM 5705 O WAT 4007 111.478 128.843 119.872 1.00 0.00 O ATOM 5706 H1 WAT 4007 111.594 128.115 120.482 1.00 0.00 H ATOM 5707 H2 WAT 4007 111.068 129.531 120.395 1.00 0.00 H TER 5709 WAT 4007 ATOM 5709 O WAT 4008 84.696 75.114 16.655 1.00 0.00 O ATOM 5710 H1 WAT 4008 84.743 75.676 17.429 1.00 0.00 H ATOM 5711 H2 WAT 4008 85.393 74.471 16.784 1.00 0.00 H TER 5713 WAT 4008 ATOM 5713 O WAT 4009 137.145 61.781 147.907 1.00 0.00 O ATOM 5714 H1 WAT 4009 136.565 61.225 147.386 1.00 0.00 H ATOM 5715 H2 WAT 4009 136.888 61.611 148.813 1.00 0.00 H TER 5717 WAT 4009 ATOM 5717 O WAT 4010 63.948 93.133 18.439 1.00 0.00 O ATOM 5718 H1 WAT 4010 64.223 93.907 18.930 1.00 0.00 H ATOM 5719 H2 WAT 4010 64.744 92.609 18.351 1.00 0.00 H TER 5721 WAT 4010 ATOM 5721 O WAT 4011 40.664 87.622 1.304 1.00 0.00 O ATOM 5722 H1 WAT 4011 41.113 86.877 1.705 1.00 0.00 H ATOM 5723 H2 WAT 4011 40.342 87.286 0.467 1.00 0.00 H TER 5725 WAT 4011 ATOM 5725 O WAT 4012 101.458 140.298 108.063 1.00 0.00 O ATOM 5726 H1 WAT 4012 102.223 140.715 107.668 1.00 0.00 H ATOM 5727 H2 WAT 4012 100.807 140.998 108.121 1.00 0.00 H TER 5729 WAT 4012 ATOM 5729 O WAT 4013 133.962 110.966 141.617 1.00 0.00 O ATOM 5730 H1 WAT 4013 134.744 110.967 142.169 1.00 0.00 H ATOM 5731 H2 WAT 4013 133.950 110.095 141.221 1.00 0.00 H TER 5733 WAT 4013 ATOM 5733 O WAT 4014 111.561 84.410 147.985 1.00 0.00 O ATOM 5734 H1 WAT 4014 111.727 83.786 148.692 1.00 0.00 H ATOM 5735 H2 WAT 4014 110.761 84.090 147.568 1.00 0.00 H TER 5737 WAT 4014 ATOM 5737 O WAT 4015 75.951 13.421 68.557 1.00 0.00 O ATOM 5738 H1 WAT 4015 76.086 13.081 69.442 1.00 0.00 H ATOM 5739 H2 WAT 4015 76.733 13.151 68.075 1.00 0.00 H TER 5741 WAT 4015 ATOM 5741 O WAT 4016 84.884 6.734 77.926 1.00 0.00 O ATOM 5742 H1 WAT 4016 84.406 5.987 77.566 1.00 0.00 H ATOM 5743 H2 WAT 4016 84.266 7.145 78.531 1.00 0.00 H TER 5745 WAT 4016 ATOM 5745 O WAT 4017 139.221 42.864 72.647 1.00 0.00 O ATOM 5746 H1 WAT 4017 139.852 43.484 73.011 1.00 0.00 H ATOM 5747 H2 WAT 4017 139.712 42.389 71.976 1.00 0.00 H TER 5749 WAT 4017 ATOM 5749 O WAT 4018 79.329 17.765 92.149 1.00 0.00 O ATOM 5750 H1 WAT 4018 78.586 18.024 92.694 1.00 0.00 H ATOM 5751 H2 WAT 4018 80.086 18.179 92.563 1.00 0.00 H TER 5753 WAT 4018 ATOM 5753 O WAT 4019 144.424 1.260 18.102 1.00 0.00 O ATOM 5754 H1 WAT 4019 144.389 0.355 17.795 1.00 0.00 H ATOM 5755 H2 WAT 4019 145.177 1.638 17.648 1.00 0.00 H TER 5757 WAT 4019 ATOM 5757 O WAT 4020 78.387 44.942 6.180 1.00 0.00 O ATOM 5758 H1 WAT 4020 78.707 45.164 5.305 1.00 0.00 H ATOM 5759 H2 WAT 4020 79.081 45.236 6.770 1.00 0.00 H TER 5761 WAT 4020 ATOM 5761 O WAT 4021 144.436 21.747 127.379 1.00 0.00 O ATOM 5762 H1 WAT 4021 145.288 21.519 127.007 1.00 0.00 H ATOM 5763 H2 WAT 4021 143.943 22.108 126.642 1.00 0.00 H TER 5765 WAT 4021 ATOM 5765 O WAT 4022 105.974 125.403 88.507 1.00 0.00 O ATOM 5766 H1 WAT 4022 106.184 125.350 89.439 1.00 0.00 H ATOM 5767 H2 WAT 4022 105.742 126.321 88.365 1.00 0.00 H TER 5769 WAT 4022 ATOM 5769 O WAT 4023 6.444 121.025 129.539 1.00 0.00 O ATOM 5770 H1 WAT 4023 5.951 121.845 129.561 1.00 0.00 H ATOM 5771 H2 WAT 4023 6.102 120.521 130.278 1.00 0.00 H TER 5773 WAT 4023 ATOM 5773 O WAT 4024 40.202 111.207 114.659 1.00 0.00 O ATOM 5774 H1 WAT 4024 39.254 111.256 114.532 1.00 0.00 H ATOM 5775 H2 WAT 4024 40.502 112.113 114.578 1.00 0.00 H TER 5777 WAT 4024 ATOM 5777 O WAT 4025 40.309 80.252 152.427 1.00 0.00 O ATOM 5778 H1 WAT 4025 41.037 80.814 152.161 1.00 0.00 H ATOM 5779 H2 WAT 4025 40.539 79.965 153.311 1.00 0.00 H TER 5781 WAT 4025 ATOM 5781 O WAT 4026 128.338 143.390 152.815 1.00 0.00 O ATOM 5782 H1 WAT 4026 128.799 143.071 152.039 1.00 0.00 H ATOM 5783 H2 WAT 4026 128.894 144.092 153.153 1.00 0.00 H TER 5785 WAT 4026 ATOM 5785 O WAT 4027 35.875 112.106 52.622 1.00 0.00 O ATOM 5786 H1 WAT 4027 36.137 112.977 52.919 1.00 0.00 H ATOM 5787 H2 WAT 4027 35.818 111.586 53.424 1.00 0.00 H TER 5789 WAT 4027 ATOM 5789 O WAT 4028 84.285 18.063 100.308 1.00 0.00 O ATOM 5790 H1 WAT 4028 84.730 17.289 100.654 1.00 0.00 H ATOM 5791 H2 WAT 4028 84.083 17.837 99.400 1.00 0.00 H TER 5793 WAT 4028 ATOM 5793 O WAT 4029 97.607 98.598 110.908 1.00 0.00 O ATOM 5794 H1 WAT 4029 96.748 98.520 110.493 1.00 0.00 H ATOM 5795 H2 WAT 4029 97.778 99.539 110.931 1.00 0.00 H TER 5797 WAT 4029 ATOM 5797 O WAT 4030 139.508 138.812 70.048 1.00 0.00 O ATOM 5798 H1 WAT 4030 139.713 139.372 69.299 1.00 0.00 H ATOM 5799 H2 WAT 4030 139.239 137.980 69.658 1.00 0.00 H TER 5801 WAT 4030 ATOM 5801 O WAT 4031 17.151 65.272 119.587 1.00 0.00 O ATOM 5802 H1 WAT 4031 17.488 65.429 120.469 1.00 0.00 H ATOM 5803 H2 WAT 4031 17.777 64.664 119.196 1.00 0.00 H TER 5805 WAT 4031 ATOM 5805 O WAT 4032 125.058 31.739 132.166 1.00 0.00 O ATOM 5806 H1 WAT 4032 125.966 32.027 132.255 1.00 0.00 H ATOM 5807 H2 WAT 4032 124.539 32.508 132.400 1.00 0.00 H TER 5809 WAT 4032 ATOM 5809 O WAT 4033 112.484 22.728 98.419 1.00 0.00 O ATOM 5810 H1 WAT 4033 112.544 23.548 98.910 1.00 0.00 H ATOM 5811 H2 WAT 4033 112.423 23.001 97.504 1.00 0.00 H TER 5813 WAT 4033 ATOM 5813 O WAT 4034 68.649 40.965 130.414 1.00 0.00 O ATOM 5814 H1 WAT 4034 68.921 41.882 130.370 1.00 0.00 H ATOM 5815 H2 WAT 4034 69.356 40.485 129.981 1.00 0.00 H TER 5817 WAT 4034 ATOM 5817 O WAT 4035 120.367 121.961 102.803 1.00 0.00 O ATOM 5818 H1 WAT 4035 120.450 122.895 102.994 1.00 0.00 H ATOM 5819 H2 WAT 4035 121.094 121.554 103.274 1.00 0.00 H TER 5821 WAT 4035 ATOM 5821 O WAT 4036 129.814 102.021 156.451 1.00 0.00 O ATOM 5822 H1 WAT 4036 129.817 101.775 155.526 1.00 0.00 H ATOM 5823 H2 WAT 4036 129.622 101.207 156.915 1.00 0.00 H TER 5825 WAT 4036 ATOM 5825 O WAT 4037 121.943 95.545 137.157 1.00 0.00 O ATOM 5826 H1 WAT 4037 121.720 96.319 136.640 1.00 0.00 H ATOM 5827 H2 WAT 4037 121.112 95.081 137.264 1.00 0.00 H TER 5829 WAT 4037 ATOM 5829 O WAT 4038 126.336 34.825 142.485 1.00 0.00 O ATOM 5830 H1 WAT 4038 126.609 35.420 141.787 1.00 0.00 H ATOM 5831 H2 WAT 4038 126.414 33.952 142.100 1.00 0.00 H TER 5833 WAT 4038 ATOM 5833 O WAT 4039 35.746 58.482 10.994 1.00 0.00 O ATOM 5834 H1 WAT 4039 35.393 59.068 11.664 1.00 0.00 H ATOM 5835 H2 WAT 4039 36.573 58.170 11.362 1.00 0.00 H TER 5837 WAT 4039 ATOM 5837 O WAT 4040 30.890 72.664 80.580 1.00 0.00 O ATOM 5838 H1 WAT 4040 30.987 73.577 80.308 1.00 0.00 H ATOM 5839 H2 WAT 4040 31.332 72.619 81.428 1.00 0.00 H TER 5841 WAT 4040 ATOM 5841 O WAT 4041 102.539 64.616 115.658 1.00 0.00 O ATOM 5842 H1 WAT 4041 102.691 64.448 116.588 1.00 0.00 H ATOM 5843 H2 WAT 4041 101.696 64.201 115.475 1.00 0.00 H TER 5845 WAT 4041 ATOM 5845 O WAT 4042 81.490 55.525 133.644 1.00 0.00 O ATOM 5846 H1 WAT 4042 82.332 55.426 133.201 1.00 0.00 H ATOM 5847 H2 WAT 4042 81.080 54.663 133.576 1.00 0.00 H TER 5849 WAT 4042 ATOM 5849 O WAT 4043 128.937 138.236 138.789 1.00 0.00 O ATOM 5850 H1 WAT 4043 128.296 137.538 138.653 1.00 0.00 H ATOM 5851 H2 WAT 4043 128.447 138.929 139.232 1.00 0.00 H TER 5853 WAT 4043 ATOM 5853 O WAT 4044 53.980 91.273 79.719 1.00 0.00 O ATOM 5854 H1 WAT 4044 53.398 91.371 80.472 1.00 0.00 H ATOM 5855 H2 WAT 4044 54.487 90.483 79.908 1.00 0.00 H TER 5857 WAT 4044 ATOM 5857 O WAT 4045 18.310 19.059 67.566 1.00 0.00 O ATOM 5858 H1 WAT 4045 18.036 19.670 66.882 1.00 0.00 H ATOM 5859 H2 WAT 4045 19.189 18.786 67.305 1.00 0.00 H TER 5861 WAT 4045 ATOM 5861 O WAT 4046 2.277 79.605 60.778 1.00 0.00 O ATOM 5862 H1 WAT 4046 2.186 80.112 61.585 1.00 0.00 H ATOM 5863 H2 WAT 4046 2.892 80.110 60.246 1.00 0.00 H TER 5865 WAT 4046 ATOM 5865 O WAT 4047 57.245 45.615 145.426 1.00 0.00 O ATOM 5866 H1 WAT 4047 58.011 45.653 145.999 1.00 0.00 H ATOM 5867 H2 WAT 4047 57.533 46.031 144.614 1.00 0.00 H TER 5869 WAT 4047 ATOM 5869 O WAT 4048 38.502 130.939 142.637 1.00 0.00 O ATOM 5870 H1 WAT 4048 39.280 131.141 143.155 1.00 0.00 H ATOM 5871 H2 WAT 4048 38.816 130.912 141.733 1.00 0.00 H TER 5873 WAT 4048 ATOM 5873 O WAT 4049 133.878 19.573 -0.010 1.00 0.00 O ATOM 5874 H1 WAT 4049 134.085 19.788 0.899 1.00 0.00 H ATOM 5875 H2 WAT 4049 134.684 19.190 -0.355 1.00 0.00 H TER 5877 WAT 4049 ATOM 5877 O WAT 4050 7.463 125.924 79.101 1.00 0.00 O ATOM 5878 H1 WAT 4050 6.529 126.092 79.227 1.00 0.00 H ATOM 5879 H2 WAT 4050 7.823 125.893 79.987 1.00 0.00 H TER 5881 WAT 4050 ATOM 5881 O WAT 4051 18.335 116.385 155.649 1.00 0.00 O ATOM 5882 H1 WAT 4051 18.659 117.079 155.075 1.00 0.00 H ATOM 5883 H2 WAT 4051 19.027 115.723 155.638 1.00 0.00 H TER 5885 WAT 4051 ATOM 5885 O WAT 4052 26.724 11.610 14.292 1.00 0.00 O ATOM 5886 H1 WAT 4052 26.159 11.762 15.049 1.00 0.00 H ATOM 5887 H2 WAT 4052 26.199 11.889 13.541 1.00 0.00 H TER 5889 WAT 4052 ATOM 5889 O WAT 4053 129.838 57.580 71.054 1.00 0.00 O ATOM 5890 H1 WAT 4053 129.236 57.400 70.332 1.00 0.00 H ATOM 5891 H2 WAT 4053 130.109 56.714 71.361 1.00 0.00 H TER 5893 WAT 4053 ATOM 5893 O WAT 4054 125.311 16.121 101.639 1.00 0.00 O ATOM 5894 H1 WAT 4054 124.794 15.764 100.917 1.00 0.00 H ATOM 5895 H2 WAT 4054 126.207 16.147 101.302 1.00 0.00 H TER 5897 WAT 4054 ATOM 5897 O WAT 4055 117.592 31.110 103.289 1.00 0.00 O ATOM 5898 H1 WAT 4055 117.275 30.783 102.447 1.00 0.00 H ATOM 5899 H2 WAT 4055 117.144 31.948 103.404 1.00 0.00 H TER 5901 WAT 4055 ATOM 5901 O WAT 4056 47.865 137.059 22.429 1.00 0.00 O ATOM 5902 H1 WAT 4056 47.292 136.340 22.163 1.00 0.00 H ATOM 5903 H2 WAT 4056 47.989 137.574 21.632 1.00 0.00 H TER 5905 WAT 4056 ATOM 5905 O WAT 4057 40.102 64.626 81.613 1.00 0.00 O ATOM 5906 H1 WAT 4057 39.679 64.811 80.774 1.00 0.00 H ATOM 5907 H2 WAT 4057 39.510 64.014 82.050 1.00 0.00 H TER 5909 WAT 4057 ATOM 5909 O WAT 4058 136.510 96.687 138.370 1.00 0.00 O ATOM 5910 H1 WAT 4058 136.761 96.578 137.453 1.00 0.00 H ATOM 5911 H2 WAT 4058 135.806 96.053 138.503 1.00 0.00 H TER 5913 WAT 4058 ATOM 5913 O WAT 4059 9.770 18.664 1.929 1.00 0.00 O ATOM 5914 H1 WAT 4059 10.551 18.525 2.465 1.00 0.00 H ATOM 5915 H2 WAT 4059 10.082 19.164 1.175 1.00 0.00 H TER 5917 WAT 4059 ATOM 5917 O WAT 4060 34.998 100.330 16.980 1.00 0.00 O ATOM 5918 H1 WAT 4060 35.750 99.864 17.344 1.00 0.00 H ATOM 5919 H2 WAT 4060 34.295 100.181 17.613 1.00 0.00 H TER 5921 WAT 4060 ATOM 5921 O WAT 4061 10.519 8.113 99.226 1.00 0.00 O ATOM 5922 H1 WAT 4061 10.614 8.821 99.864 1.00 0.00 H ATOM 5923 H2 WAT 4061 10.836 8.488 98.404 1.00 0.00 H TER 5925 WAT 4061 ATOM 5925 O WAT 4062 101.178 22.846 12.257 1.00 0.00 O ATOM 5926 H1 WAT 4062 101.393 23.738 11.981 1.00 0.00 H ATOM 5927 H2 WAT 4062 100.305 22.688 11.898 1.00 0.00 H TER 5929 WAT 4062 ATOM 5929 O WAT 4063 13.676 49.193 105.060 1.00 0.00 O ATOM 5930 H1 WAT 4063 12.741 49.007 105.154 1.00 0.00 H ATOM 5931 H2 WAT 4063 14.096 48.649 105.727 1.00 0.00 H TER 5933 WAT 4063 ATOM 5933 O WAT 4064 73.697 133.524 65.583 1.00 0.00 O ATOM 5934 H1 WAT 4064 73.576 134.471 65.510 1.00 0.00 H ATOM 5935 H2 WAT 4064 73.682 133.210 64.679 1.00 0.00 H TER 5937 WAT 4064 ATOM 5937 O WAT 4065 65.898 0.966 7.417 1.00 0.00 O ATOM 5938 H1 WAT 4065 66.286 1.532 8.085 1.00 0.00 H ATOM 5939 H2 WAT 4065 65.917 0.091 7.805 1.00 0.00 H TER 5941 WAT 4065 ATOM 5941 O WAT 4066 0.371 46.990 132.065 1.00 0.00 O ATOM 5942 H1 WAT 4066 0.233 46.462 131.278 1.00 0.00 H ATOM 5943 H2 WAT 4066 0.252 47.893 131.771 1.00 0.00 H TER 5945 WAT 4066 ATOM 5945 O WAT 4067 114.353 120.159 4.617 1.00 0.00 O ATOM 5946 H1 WAT 4067 115.236 120.150 4.987 1.00 0.00 H ATOM 5947 H2 WAT 4067 113.827 120.626 5.265 1.00 0.00 H TER 5949 WAT 4067 ATOM 5949 O WAT 4068 139.074 93.706 31.030 1.00 0.00 O ATOM 5950 H1 WAT 4068 138.329 94.196 30.683 1.00 0.00 H ATOM 5951 H2 WAT 4068 139.393 94.238 31.759 1.00 0.00 H TER 5953 WAT 4068 ATOM 5953 O WAT 4069 120.697 4.608 107.411 1.00 0.00 O ATOM 5954 H1 WAT 4069 120.916 3.755 107.785 1.00 0.00 H ATOM 5955 H2 WAT 4069 120.200 5.051 108.100 1.00 0.00 H TER 5957 WAT 4069 ATOM 5957 O WAT 4070 64.083 69.247 82.050 1.00 0.00 O ATOM 5958 H1 WAT 4070 64.266 69.425 81.127 1.00 0.00 H ATOM 5959 H2 WAT 4070 64.920 68.948 82.406 1.00 0.00 H TER 5961 WAT 4070 ATOM 5961 O WAT 4071 55.522 110.745 8.951 1.00 0.00 O ATOM 5962 H1 WAT 4071 55.597 111.271 8.155 1.00 0.00 H ATOM 5963 H2 WAT 4071 54.591 110.771 9.170 1.00 0.00 H TER 5965 WAT 4071 ATOM 5965 O WAT 4072 128.559 104.985 10.898 1.00 0.00 O ATOM 5966 H1 WAT 4072 127.886 104.933 10.219 1.00 0.00 H ATOM 5967 H2 WAT 4072 128.333 105.768 11.400 1.00 0.00 H TER 5969 WAT 4072 ATOM 5969 O WAT 4073 117.944 36.184 108.806 1.00 0.00 O ATOM 5970 H1 WAT 4073 118.623 35.710 108.326 1.00 0.00 H ATOM 5971 H2 WAT 4073 117.420 36.606 108.125 1.00 0.00 H TER 5973 WAT 4073 ATOM 5973 O WAT 4074 43.073 28.883 134.569 1.00 0.00 O ATOM 5974 H1 WAT 4074 43.872 29.305 134.253 1.00 0.00 H ATOM 5975 H2 WAT 4074 43.197 28.812 135.516 1.00 0.00 H TER 5977 WAT 4074 ATOM 5977 O WAT 4075 25.649 93.155 136.588 1.00 0.00 O ATOM 5978 H1 WAT 4075 25.153 92.780 137.315 1.00 0.00 H ATOM 5979 H2 WAT 4075 25.959 93.998 136.919 1.00 0.00 H TER 5981 WAT 4075 ATOM 5981 O WAT 4076 43.910 38.798 132.107 1.00 0.00 O ATOM 5982 H1 WAT 4076 43.048 38.644 132.494 1.00 0.00 H ATOM 5983 H2 WAT 4076 43.851 38.419 131.230 1.00 0.00 H TER 5985 WAT 4076 ATOM 5985 O WAT 4077 74.669 73.202 140.290 1.00 0.00 O ATOM 5986 H1 WAT 4077 74.623 73.844 140.999 1.00 0.00 H ATOM 5987 H2 WAT 4077 75.097 73.669 139.573 1.00 0.00 H TER 5989 WAT 4077 ATOM 5989 O WAT 4078 11.667 125.074 71.668 1.00 0.00 O ATOM 5990 H1 WAT 4078 12.299 124.704 72.285 1.00 0.00 H ATOM 5991 H2 WAT 4078 11.197 125.736 72.174 1.00 0.00 H TER 5993 WAT 4078 ATOM 5993 O WAT 4079 124.024 96.496 92.823 1.00 0.00 O ATOM 5994 H1 WAT 4079 124.600 97.222 92.582 1.00 0.00 H ATOM 5995 H2 WAT 4079 123.390 96.884 93.427 1.00 0.00 H TER 5997 WAT 4079 ATOM 5997 O WAT 4080 114.367 11.842 93.051 1.00 0.00 O ATOM 5998 H1 WAT 4080 114.679 12.719 93.276 1.00 0.00 H ATOM 5999 H2 WAT 4080 115.158 11.362 92.806 1.00 0.00 H TER 6001 WAT 4080 ATOM 6001 O WAT 4081 105.194 16.181 82.799 1.00 0.00 O ATOM 6002 H1 WAT 4081 105.141 15.266 83.076 1.00 0.00 H ATOM 6003 H2 WAT 4081 104.952 16.681 83.579 1.00 0.00 H TER 6005 WAT 4081 ATOM 6005 O WAT 4082 104.009 122.967 141.720 1.00 0.00 O ATOM 6006 H1 WAT 4082 103.921 123.859 142.056 1.00 0.00 H ATOM 6007 H2 WAT 4082 103.182 122.542 141.950 1.00 0.00 H TER 6009 WAT 4082 ATOM 6009 O WAT 4083 126.860 131.747 152.827 1.00 0.00 O ATOM 6010 H1 WAT 4083 127.383 132.262 153.442 1.00 0.00 H ATOM 6011 H2 WAT 4083 126.177 132.350 152.533 1.00 0.00 H TER 6013 WAT 4083 ATOM 6013 O WAT 4084 22.004 85.923 150.336 1.00 0.00 O ATOM 6014 H1 WAT 4084 22.875 86.115 150.683 1.00 0.00 H ATOM 6015 H2 WAT 4084 22.164 85.333 149.599 1.00 0.00 H TER 6017 WAT 4084 ATOM 6017 O WAT 4085 39.161 0.995 149.659 1.00 0.00 O ATOM 6018 H1 WAT 4085 38.497 0.797 150.319 1.00 0.00 H ATOM 6019 H2 WAT 4085 39.063 1.932 149.494 1.00 0.00 H TER 6021 WAT 4085 ATOM 6021 O WAT 4086 72.979 55.845 155.298 1.00 0.00 O ATOM 6022 H1 WAT 4086 73.769 56.115 155.766 1.00 0.00 H ATOM 6023 H2 WAT 4086 73.111 54.913 155.124 1.00 0.00 H TER 6025 WAT 4086 ATOM 6025 O WAT 4087 12.888 5.461 16.389 1.00 0.00 O ATOM 6026 H1 WAT 4087 12.943 4.696 15.817 1.00 0.00 H ATOM 6027 H2 WAT 4087 11.964 5.709 16.369 1.00 0.00 H TER 6029 WAT 4087 ATOM 6029 O WAT 4088 35.228 28.714 77.742 1.00 0.00 O ATOM 6030 H1 WAT 4088 36.110 29.003 77.979 1.00 0.00 H ATOM 6031 H2 WAT 4088 34.952 29.324 77.059 1.00 0.00 H TER 6033 WAT 4088 ATOM 6033 O WAT 4089 115.229 59.486 56.404 1.00 0.00 O ATOM 6034 H1 WAT 4089 114.964 60.089 57.099 1.00 0.00 H ATOM 6035 H2 WAT 4089 115.288 60.034 55.621 1.00 0.00 H TER 6037 WAT 4089 ATOM 6037 O WAT 4090 15.102 7.063 77.166 1.00 0.00 O ATOM 6038 H1 WAT 4090 14.552 7.826 76.992 1.00 0.00 H ATOM 6039 H2 WAT 4090 15.777 7.094 76.488 1.00 0.00 H TER 6041 WAT 4090 ATOM 6041 O WAT 4091 74.302 64.069 141.931 1.00 0.00 O ATOM 6042 H1 WAT 4091 73.925 63.245 142.238 1.00 0.00 H ATOM 6043 H2 WAT 4091 73.651 64.419 141.324 1.00 0.00 H TER 6045 WAT 4091 ATOM 6045 O WAT 4092 87.387 134.108 8.584 1.00 0.00 O ATOM 6046 H1 WAT 4092 87.524 134.985 8.228 1.00 0.00 H ATOM 6047 H2 WAT 4092 88.120 133.977 9.186 1.00 0.00 H TER 6049 WAT 4092 ATOM 6049 O WAT 4093 138.125 80.592 61.610 1.00 0.00 O ATOM 6050 H1 WAT 4093 138.627 80.601 60.795 1.00 0.00 H ATOM 6051 H2 WAT 4093 137.858 81.502 61.736 1.00 0.00 H TER 6053 WAT 4093 ATOM 6053 O WAT 4094 63.446 15.661 56.615 1.00 0.00 O ATOM 6054 H1 WAT 4094 62.955 15.025 57.136 1.00 0.00 H ATOM 6055 H2 WAT 4094 64.272 15.769 57.086 1.00 0.00 H TER 6057 WAT 4094 ATOM 6057 O WAT 4095 121.968 115.663 97.862 1.00 0.00 O ATOM 6058 H1 WAT 4095 121.027 115.630 98.037 1.00 0.00 H ATOM 6059 H2 WAT 4095 122.365 115.814 98.720 1.00 0.00 H TER 6061 WAT 4095 ATOM 6061 O WAT 4096 2.323 4.884 5.533 1.00 0.00 O ATOM 6062 H1 WAT 4096 2.926 5.195 4.858 1.00 0.00 H ATOM 6063 H2 WAT 4096 2.884 4.441 6.170 1.00 0.00 H TER 6065 WAT 4096 ATOM 6065 O WAT 4097 56.098 72.391 22.217 1.00 0.00 O ATOM 6066 H1 WAT 4097 56.884 72.108 21.750 1.00 0.00 H ATOM 6067 H2 WAT 4097 56.425 72.740 23.047 1.00 0.00 H TER 6069 WAT 4097 ATOM 6069 O WAT 4098 135.989 39.343 6.558 1.00 0.00 O ATOM 6070 H1 WAT 4098 135.962 39.316 5.602 1.00 0.00 H ATOM 6071 H2 WAT 4098 136.330 38.486 6.813 1.00 0.00 H TER 6073 WAT 4098 ATOM 6073 O WAT 4099 18.228 130.731 70.130 1.00 0.00 O ATOM 6074 H1 WAT 4099 17.419 131.138 69.820 1.00 0.00 H ATOM 6075 H2 WAT 4099 18.709 131.444 70.550 1.00 0.00 H TER 6077 WAT 4099 ATOM 6077 O WAT 4100 83.045 70.126 104.071 1.00 0.00 O ATOM 6078 H1 WAT 4100 83.729 70.169 104.739 1.00 0.00 H ATOM 6079 H2 WAT 4100 82.421 70.806 104.323 1.00 0.00 H TER 6081 WAT 4100 ATOM 6081 O WAT 4101 19.560 22.353 92.166 1.00 0.00 O ATOM 6082 H1 WAT 4101 18.955 22.930 91.700 1.00 0.00 H ATOM 6083 H2 WAT 4101 20.329 22.897 92.333 1.00 0.00 H TER 6085 WAT 4101 ATOM 6085 O WAT 4102 106.875 108.802 122.944 1.00 0.00 O ATOM 6086 H1 WAT 4102 107.289 109.660 122.850 1.00 0.00 H ATOM 6087 H2 WAT 4102 106.017 108.991 123.323 1.00 0.00 H TER 6089 WAT 4102 ATOM 6089 O WAT 4103 4.476 54.302 120.539 1.00 0.00 O ATOM 6090 H1 WAT 4103 5.377 54.059 120.324 1.00 0.00 H ATOM 6091 H2 WAT 4103 4.007 53.469 120.580 1.00 0.00 H TER 6093 WAT 4103 ATOM 6093 O WAT 4104 145.891 97.041 85.978 1.00 0.00 O ATOM 6094 H1 WAT 4104 146.580 97.250 86.609 1.00 0.00 H ATOM 6095 H2 WAT 4104 145.093 97.399 86.367 1.00 0.00 H TER 6097 WAT 4104 ATOM 6097 O WAT 4105 87.387 50.979 127.318 1.00 0.00 O ATOM 6098 H1 WAT 4105 87.344 50.760 126.387 1.00 0.00 H ATOM 6099 H2 WAT 4105 86.958 51.832 127.383 1.00 0.00 H TER 6101 WAT 4105 ATOM 6101 O WAT 4106 114.215 138.587 142.726 1.00 0.00 O ATOM 6102 H1 WAT 4106 114.025 137.784 143.211 1.00 0.00 H ATOM 6103 H2 WAT 4106 114.791 138.307 142.015 1.00 0.00 H TER 6105 WAT 4106 ATOM 6105 O WAT 4107 108.904 136.969 21.256 1.00 0.00 O ATOM 6106 H1 WAT 4107 109.135 137.453 20.463 1.00 0.00 H ATOM 6107 H2 WAT 4107 108.382 136.231 20.942 1.00 0.00 H TER 6109 WAT 4107 ATOM 6109 O WAT 4108 20.818 11.234 5.047 1.00 0.00 O ATOM 6110 H1 WAT 4108 21.563 11.696 4.662 1.00 0.00 H ATOM 6111 H2 WAT 4108 20.078 11.828 4.925 1.00 0.00 H TER 6113 WAT 4108 ATOM 6113 O WAT 4109 96.305 113.471 27.122 1.00 0.00 O ATOM 6114 H1 WAT 4109 95.643 113.983 27.586 1.00 0.00 H ATOM 6115 H2 WAT 4109 96.914 113.191 27.806 1.00 0.00 H TER 6117 WAT 4109 ATOM 6117 O WAT 4110 26.498 65.077 134.451 1.00 0.00 O ATOM 6118 H1 WAT 4110 26.597 65.982 134.154 1.00 0.00 H ATOM 6119 H2 WAT 4110 27.276 64.913 134.984 1.00 0.00 H TER 6121 WAT 4110 ATOM 6121 O WAT 4111 83.584 135.113 149.501 1.00 0.00 O ATOM 6122 H1 WAT 4111 83.473 134.637 150.324 1.00 0.00 H ATOM 6123 H2 WAT 4111 83.921 134.458 148.890 1.00 0.00 H TER 6125 WAT 4111 ATOM 6125 O WAT 4112 61.677 115.310 67.834 1.00 0.00 O ATOM 6126 H1 WAT 4112 62.300 116.024 67.967 1.00 0.00 H ATOM 6127 H2 WAT 4112 60.927 115.722 67.406 1.00 0.00 H TER 6129 WAT 4112 ATOM 6129 O WAT 4113 113.651 66.080 10.962 1.00 0.00 O ATOM 6130 H1 WAT 4113 113.576 66.970 10.617 1.00 0.00 H ATOM 6131 H2 WAT 4113 112.786 65.696 10.821 1.00 0.00 H TER 6133 WAT 4113 ATOM 6133 O WAT 4114 108.764 37.128 10.480 1.00 0.00 O ATOM 6134 H1 WAT 4114 109.534 36.662 10.154 1.00 0.00 H ATOM 6135 H2 WAT 4114 108.023 36.673 10.081 1.00 0.00 H TER 6137 WAT 4114 ATOM 6137 O WAT 4115 20.992 70.809 8.042 1.00 0.00 O ATOM 6138 H1 WAT 4115 21.357 70.246 7.360 1.00 0.00 H ATOM 6139 H2 WAT 4115 20.121 71.042 7.720 1.00 0.00 H TER 6141 WAT 4115 ATOM 6141 O WAT 4116 106.625 123.267 108.728 1.00 0.00 O ATOM 6142 H1 WAT 4116 105.709 123.133 108.972 1.00 0.00 H ATOM 6143 H2 WAT 4116 106.799 122.590 108.074 1.00 0.00 H TER 6145 WAT 4116 ATOM 6145 O WAT 4117 80.183 47.414 139.816 1.00 0.00 O ATOM 6146 H1 WAT 4117 80.217 46.980 138.963 1.00 0.00 H ATOM 6147 H2 WAT 4117 79.542 48.116 139.702 1.00 0.00 H TER 6149 WAT 4117 ATOM 6149 O WAT 4118 141.382 59.182 75.159 1.00 0.00 O ATOM 6150 H1 WAT 4118 141.104 58.521 75.793 1.00 0.00 H ATOM 6151 H2 WAT 4118 140.581 59.419 74.693 1.00 0.00 H TER 6153 WAT 4118 ATOM 6153 O WAT 4119 75.527 139.035 155.430 1.00 0.00 O ATOM 6154 H1 WAT 4119 75.162 138.722 154.602 1.00 0.00 H ATOM 6155 H2 WAT 4119 76.460 138.832 155.373 1.00 0.00 H TER 6157 WAT 4119 ATOM 6157 O WAT 4120 124.527 37.230 69.055 1.00 0.00 O ATOM 6158 H1 WAT 4120 125.443 37.126 69.310 1.00 0.00 H ATOM 6159 H2 WAT 4120 124.050 36.625 69.624 1.00 0.00 H TER 6161 WAT 4120 ATOM 6161 O WAT 4121 26.779 97.284 81.609 1.00 0.00 O ATOM 6162 H1 WAT 4121 25.864 97.527 81.469 1.00 0.00 H ATOM 6163 H2 WAT 4121 27.186 97.376 80.747 1.00 0.00 H TER 6165 WAT 4121 ATOM 6165 O WAT 4122 83.027 114.799 6.440 1.00 0.00 O ATOM 6166 H1 WAT 4122 82.572 114.919 7.274 1.00 0.00 H ATOM 6167 H2 WAT 4122 83.919 115.101 6.609 1.00 0.00 H TER 6169 WAT 4122 ATOM 6169 O WAT 4123 13.815 2.321 116.889 1.00 0.00 O ATOM 6170 H1 WAT 4123 14.332 2.976 117.357 1.00 0.00 H ATOM 6171 H2 WAT 4123 13.652 1.636 117.537 1.00 0.00 H TER 6173 WAT 4123 ATOM 6173 O WAT 4124 124.889 110.581 152.927 1.00 0.00 O ATOM 6174 H1 WAT 4124 125.218 111.224 152.299 1.00 0.00 H ATOM 6175 H2 WAT 4124 124.295 110.031 152.418 1.00 0.00 H TER 6177 WAT 4124 ATOM 6177 O WAT 4125 86.696 67.923 155.205 1.00 0.00 O ATOM 6178 H1 WAT 4125 86.722 67.297 155.928 1.00 0.00 H ATOM 6179 H2 WAT 4125 85.871 67.738 154.757 1.00 0.00 H TER 6181 WAT 4125 ATOM 6181 O WAT 4126 35.242 56.379 71.223 1.00 0.00 O ATOM 6182 H1 WAT 4126 34.520 56.803 71.688 1.00 0.00 H ATOM 6183 H2 WAT 4126 35.946 57.027 71.234 1.00 0.00 H TER 6185 WAT 4126 ATOM 6185 O WAT 4127 123.089 139.470 117.389 1.00 0.00 O ATOM 6186 H1 WAT 4127 123.763 140.115 117.603 1.00 0.00 H ATOM 6187 H2 WAT 4127 123.212 139.296 116.455 1.00 0.00 H TER 6189 WAT 4127 ATOM 6189 O WAT 4128 45.232 13.014 95.136 1.00 0.00 O ATOM 6190 H1 WAT 4128 45.309 12.844 96.075 1.00 0.00 H ATOM 6191 H2 WAT 4128 45.099 13.960 95.074 1.00 0.00 H TER 6193 WAT 4128 ATOM 6193 O WAT 4129 103.958 145.592 119.417 1.00 0.00 O ATOM 6194 H1 WAT 4129 104.903 145.482 119.522 1.00 0.00 H ATOM 6195 H2 WAT 4129 103.579 145.126 120.162 1.00 0.00 H TER 6197 WAT 4129 ATOM 6197 O WAT 4130 39.408 6.780 102.629 1.00 0.00 O ATOM 6198 H1 WAT 4130 39.761 5.932 102.357 1.00 0.00 H ATOM 6199 H2 WAT 4130 39.912 7.421 102.129 1.00 0.00 H TER 6201 WAT 4130 ATOM 6201 O WAT 4131 30.021 81.643 116.713 1.00 0.00 O ATOM 6202 H1 WAT 4131 29.490 81.007 117.191 1.00 0.00 H ATOM 6203 H2 WAT 4131 29.964 82.444 117.234 1.00 0.00 H TER 6205 WAT 4131 ATOM 6205 O WAT 4132 126.814 93.544 136.179 1.00 0.00 O ATOM 6206 H1 WAT 4132 126.821 93.135 135.313 1.00 0.00 H ATOM 6207 H2 WAT 4132 127.724 93.797 136.331 1.00 0.00 H TER 6209 WAT 4132 ATOM 6209 O WAT 4133 104.470 108.630 98.242 1.00 0.00 O ATOM 6210 H1 WAT 4133 103.713 109.051 97.834 1.00 0.00 H ATOM 6211 H2 WAT 4133 104.335 107.694 98.088 1.00 0.00 H TER 6213 WAT 4133 ATOM 6213 O WAT 4134 30.139 101.876 12.190 1.00 0.00 O ATOM 6214 H1 WAT 4134 30.976 102.189 12.533 1.00 0.00 H ATOM 6215 H2 WAT 4134 29.783 101.329 12.891 1.00 0.00 H TER 6217 WAT 4134 ATOM 6217 O WAT 4135 130.049 120.335 101.139 1.00 0.00 O ATOM 6218 H1 WAT 4135 129.836 120.107 102.044 1.00 0.00 H ATOM 6219 H2 WAT 4135 130.489 119.558 100.794 1.00 0.00 H TER 6221 WAT 4135 ATOM 6221 O WAT 4136 98.344 52.228 151.127 1.00 0.00 O ATOM 6222 H1 WAT 4136 99.261 52.500 151.090 1.00 0.00 H ATOM 6223 H2 WAT 4136 97.863 52.950 150.723 1.00 0.00 H TER 6225 WAT 4136 ATOM 6225 O WAT 4137 58.965 36.357 13.265 1.00 0.00 O ATOM 6226 H1 WAT 4137 58.531 36.950 12.650 1.00 0.00 H ATOM 6227 H2 WAT 4137 59.608 35.889 12.734 1.00 0.00 H TER 6229 WAT 4137 ATOM 6229 O WAT 4138 21.319 19.504 3.882 1.00 0.00 O ATOM 6230 H1 WAT 4138 22.190 19.898 3.837 1.00 0.00 H ATOM 6231 H2 WAT 4138 20.809 19.971 3.220 1.00 0.00 H TER 6233 WAT 4138 ATOM 6233 O WAT 4139 120.467 133.218 102.785 1.00 0.00 O ATOM 6234 H1 WAT 4139 120.620 132.632 102.044 1.00 0.00 H ATOM 6235 H2 WAT 4139 120.589 134.096 102.426 1.00 0.00 H TER 6237 WAT 4139 ATOM 6237 O WAT 4140 61.512 85.135 89.080 1.00 0.00 O ATOM 6238 H1 WAT 4140 60.948 84.383 88.901 1.00 0.00 H ATOM 6239 H2 WAT 4140 61.111 85.560 89.839 1.00 0.00 H TER 6241 WAT 4140 ATOM 6241 O WAT 4141 43.990 17.359 18.159 1.00 0.00 O ATOM 6242 H1 WAT 4141 44.831 17.419 18.613 1.00 0.00 H ATOM 6243 H2 WAT 4141 43.541 16.627 18.582 1.00 0.00 H TER 6245 WAT 4141 ATOM 6245 O WAT 4142 65.992 76.354 102.436 1.00 0.00 O ATOM 6246 H1 WAT 4142 66.779 76.898 102.432 1.00 0.00 H ATOM 6247 H2 WAT 4142 65.330 76.887 101.997 1.00 0.00 H TER 6249 WAT 4142 ATOM 6249 O WAT 4143 58.590 93.792 73.121 1.00 0.00 O ATOM 6250 H1 WAT 4143 58.998 94.486 72.603 1.00 0.00 H ATOM 6251 H2 WAT 4143 59.284 93.493 73.709 1.00 0.00 H TER 6253 WAT 4143 ATOM 6253 O WAT 4144 15.771 41.698 137.564 1.00 0.00 O ATOM 6254 H1 WAT 4144 16.517 41.278 137.993 1.00 0.00 H ATOM 6255 H2 WAT 4144 16.108 41.971 136.710 1.00 0.00 H TER 6257 WAT 4144 ATOM 6257 O WAT 4145 24.681 100.977 119.066 1.00 0.00 O ATOM 6258 H1 WAT 4145 24.985 100.312 119.683 1.00 0.00 H ATOM 6259 H2 WAT 4145 24.572 101.765 119.598 1.00 0.00 H TER 6261 WAT 4145 ATOM 6261 O WAT 4146 119.948 124.631 124.837 1.00 0.00 O ATOM 6262 H1 WAT 4146 120.788 124.614 124.378 1.00 0.00 H ATOM 6263 H2 WAT 4146 119.744 123.710 124.997 1.00 0.00 H TER 6265 WAT 4146 ATOM 6265 O WAT 4147 72.444 5.820 2.488 1.00 0.00 O ATOM 6266 H1 WAT 4147 72.551 5.824 3.439 1.00 0.00 H ATOM 6267 H2 WAT 4147 73.333 5.921 2.147 1.00 0.00 H TER 6269 WAT 4147 ATOM 6269 O WAT 4148 142.159 71.546 94.476 1.00 0.00 O ATOM 6270 H1 WAT 4148 142.000 71.306 93.562 1.00 0.00 H ATOM 6271 H2 WAT 4148 143.061 71.274 94.641 1.00 0.00 H TER 6273 WAT 4148 ATOM 6273 O WAT 4149 8.097 100.452 130.215 1.00 0.00 O ATOM 6274 H1 WAT 4149 8.330 100.572 131.135 1.00 0.00 H ATOM 6275 H2 WAT 4149 8.554 101.158 129.758 1.00 0.00 H TER 6277 WAT 4149 ATOM 6277 O WAT 4150 117.995 72.322 132.412 1.00 0.00 O ATOM 6278 H1 WAT 4150 117.502 71.523 132.226 1.00 0.00 H ATOM 6279 H2 WAT 4150 118.883 72.016 132.599 1.00 0.00 H TER 6281 WAT 4150 ATOM 6281 O WAT 4151 135.403 89.174 25.019 1.00 0.00 O ATOM 6282 H1 WAT 4151 135.193 89.814 24.339 1.00 0.00 H ATOM 6283 H2 WAT 4151 135.770 88.429 24.543 1.00 0.00 H TER 6285 WAT 4151 ATOM 6285 O WAT 4152 89.363 99.820 106.780 1.00 0.00 O ATOM 6286 H1 WAT 4152 89.741 100.504 107.333 1.00 0.00 H ATOM 6287 H2 WAT 4152 90.046 99.153 106.723 1.00 0.00 H TER 6289 WAT 4152 ATOM 6289 O WAT 4153 121.074 98.851 20.057 1.00 0.00 O ATOM 6290 H1 WAT 4153 121.483 98.949 20.918 1.00 0.00 H ATOM 6291 H2 WAT 4153 120.759 99.728 19.841 1.00 0.00 H TER 6293 WAT 4153 ATOM 6293 O WAT 4154 114.641 18.154 71.577 1.00 0.00 O ATOM 6294 H1 WAT 4154 115.387 18.468 72.089 1.00 0.00 H ATOM 6295 H2 WAT 4154 114.525 18.815 70.894 1.00 0.00 H TER 6297 WAT 4154 ATOM 6297 O WAT 4155 126.021 44.652 122.310 1.00 0.00 O ATOM 6298 H1 WAT 4155 125.528 45.450 122.498 1.00 0.00 H ATOM 6299 H2 WAT 4155 125.941 44.538 121.363 1.00 0.00 H TER 6301 WAT 4155 ATOM 6301 O WAT 4156 135.447 75.340 107.744 1.00 0.00 O ATOM 6302 H1 WAT 4156 136.131 75.265 108.409 1.00 0.00 H ATOM 6303 H2 WAT 4156 134.964 76.131 107.984 1.00 0.00 H TER 6305 WAT 4156 ATOM 6305 O WAT 4157 84.910 93.722 149.431 1.00 0.00 O ATOM 6306 H1 WAT 4157 84.231 93.127 149.749 1.00 0.00 H ATOM 6307 H2 WAT 4157 85.279 93.278 148.668 1.00 0.00 H TER 6309 WAT 4157 ATOM 6309 O WAT 4158 10.637 38.655 5.125 1.00 0.00 O ATOM 6310 H1 WAT 4158 10.976 38.238 4.334 1.00 0.00 H ATOM 6311 H2 WAT 4158 10.816 38.025 5.823 1.00 0.00 H TER 6313 WAT 4158 ATOM 6313 O WAT 4159 32.969 143.137 61.795 1.00 0.00 O ATOM 6314 H1 WAT 4159 32.880 143.704 62.561 1.00 0.00 H ATOM 6315 H2 WAT 4159 32.136 142.667 61.746 1.00 0.00 H TER 6317 WAT 4159 ATOM 6317 O WAT 4160 29.630 60.941 84.331 1.00 0.00 O ATOM 6318 H1 WAT 4160 29.137 60.803 85.140 1.00 0.00 H ATOM 6319 H2 WAT 4160 28.967 61.184 83.685 1.00 0.00 H TER 6321 WAT 4160 ATOM 6321 O WAT 4161 72.097 121.817 138.710 1.00 0.00 O ATOM 6322 H1 WAT 4161 72.486 122.621 138.365 1.00 0.00 H ATOM 6323 H2 WAT 4161 71.162 122.011 138.775 1.00 0.00 H TER 6325 WAT 4161 ATOM 6325 O WAT 4162 47.445 53.612 115.349 1.00 0.00 O ATOM 6326 H1 WAT 4162 47.782 53.784 114.470 1.00 0.00 H ATOM 6327 H2 WAT 4162 47.311 54.481 115.728 1.00 0.00 H TER 6329 WAT 4162 ATOM 6329 O WAT 4163 33.303 143.509 81.449 1.00 0.00 O ATOM 6330 H1 WAT 4163 32.844 143.788 82.241 1.00 0.00 H ATOM 6331 H2 WAT 4163 32.899 142.672 81.219 1.00 0.00 H TER 6333 WAT 4163 ATOM 6333 O WAT 4164 68.378 67.812 156.126 1.00 0.00 O ATOM 6334 H1 WAT 4164 69.207 67.983 155.679 1.00 0.00 H ATOM 6335 H2 WAT 4164 68.044 67.014 155.716 1.00 0.00 H TER 6337 WAT 4164 ATOM 6337 O WAT 4165 126.881 114.901 87.472 1.00 0.00 O ATOM 6338 H1 WAT 4165 126.143 114.582 87.993 1.00 0.00 H ATOM 6339 H2 WAT 4165 126.682 114.622 86.578 1.00 0.00 H TER 6341 WAT 4165 ATOM 6341 O WAT 4166 83.229 5.052 123.874 1.00 0.00 O ATOM 6342 H1 WAT 4166 82.693 4.271 124.010 1.00 0.00 H ATOM 6343 H2 WAT 4166 82.604 5.731 123.621 1.00 0.00 H TER 6345 WAT 4166 ATOM 6345 O WAT 4167 47.046 5.112 1.284 1.00 0.00 O ATOM 6346 H1 WAT 4167 46.634 4.629 0.568 1.00 0.00 H ATOM 6347 H2 WAT 4167 46.869 4.584 2.063 1.00 0.00 H TER 6349 WAT 4167 ATOM 6349 O WAT 4168 2.934 86.155 23.282 1.00 0.00 O ATOM 6350 H1 WAT 4168 3.281 85.577 23.961 1.00 0.00 H ATOM 6351 H2 WAT 4168 2.620 85.562 22.600 1.00 0.00 H TER 6353 WAT 4168 ATOM 6353 O WAT 4169 144.943 30.518 97.947 1.00 0.00 O ATOM 6354 H1 WAT 4169 145.662 30.380 98.564 1.00 0.00 H ATOM 6355 H2 WAT 4169 144.810 29.663 97.539 1.00 0.00 H TER 6357 WAT 4169 ATOM 6357 O WAT 4170 8.964 73.517 3.556 1.00 0.00 O ATOM 6358 H1 WAT 4170 9.587 73.346 4.262 1.00 0.00 H ATOM 6359 H2 WAT 4170 9.282 72.988 2.824 1.00 0.00 H TER 6361 WAT 4170 ATOM 6361 O WAT 4171 68.991 26.981 93.490 1.00 0.00 O ATOM 6362 H1 WAT 4171 69.245 26.957 94.412 1.00 0.00 H ATOM 6363 H2 WAT 4171 68.096 26.642 93.479 1.00 0.00 H TER 6365 WAT 4171 ATOM 6365 O WAT 4172 77.691 92.110 149.553 1.00 0.00 O ATOM 6366 H1 WAT 4172 77.689 93.066 149.597 1.00 0.00 H ATOM 6367 H2 WAT 4172 76.951 91.895 148.986 1.00 0.00 H TER 6369 WAT 4172 ATOM 6369 O WAT 4173 97.485 131.698 98.533 1.00 0.00 O ATOM 6370 H1 WAT 4173 97.209 131.018 99.147 1.00 0.00 H ATOM 6371 H2 WAT 4173 96.780 131.739 97.888 1.00 0.00 H TER 6373 WAT 4173 ATOM 6373 O WAT 4174 16.903 6.252 128.271 1.00 0.00 O ATOM 6374 H1 WAT 4174 17.731 6.473 127.843 1.00 0.00 H ATOM 6375 H2 WAT 4174 16.745 6.976 128.876 1.00 0.00 H TER 6377 WAT 4174 ATOM 6377 O WAT 4175 59.400 12.685 66.166 1.00 0.00 O ATOM 6378 H1 WAT 4175 59.070 12.953 65.309 1.00 0.00 H ATOM 6379 H2 WAT 4175 59.792 13.479 66.530 1.00 0.00 H TER 6381 WAT 4175 ATOM 6381 O WAT 4176 19.905 99.507 11.856 1.00 0.00 O ATOM 6382 H1 WAT 4176 19.879 100.384 11.472 1.00 0.00 H ATOM 6383 H2 WAT 4176 19.596 99.629 12.754 1.00 0.00 H TER 6385 WAT 4176 ATOM 6385 O WAT 4177 125.704 103.513 157.664 1.00 0.00 O ATOM 6386 H1 WAT 4177 126.571 103.881 157.832 1.00 0.00 H ATOM 6387 H2 WAT 4177 125.680 103.378 156.717 1.00 0.00 H TER 6389 WAT 4177 ATOM 6389 O WAT 4178 115.393 90.635 127.856 1.00 0.00 O ATOM 6390 H1 WAT 4178 114.951 89.838 128.147 1.00 0.00 H ATOM 6391 H2 WAT 4178 116.244 90.611 128.294 1.00 0.00 H TER 6393 WAT 4178 ATOM 6393 O WAT 4179 138.461 1.238 127.436 1.00 0.00 O ATOM 6394 H1 WAT 4179 138.861 0.371 127.499 1.00 0.00 H ATOM 6395 H2 WAT 4179 138.011 1.234 126.592 1.00 0.00 H TER 6397 WAT 4179 ATOM 6397 O WAT 4180 98.120 97.094 71.015 1.00 0.00 O ATOM 6398 H1 WAT 4180 97.704 97.798 70.518 1.00 0.00 H ATOM 6399 H2 WAT 4180 97.499 96.896 71.715 1.00 0.00 H TER 6401 WAT 4180 ATOM 6401 O WAT 4181 50.706 71.729 108.620 1.00 0.00 O ATOM 6402 H1 WAT 4181 50.880 72.326 109.347 1.00 0.00 H ATOM 6403 H2 WAT 4181 49.764 71.805 108.468 1.00 0.00 H TER 6405 WAT 4181 ATOM 6405 O WAT 4182 74.421 4.855 131.964 1.00 0.00 O ATOM 6406 H1 WAT 4182 74.942 4.825 132.766 1.00 0.00 H ATOM 6407 H2 WAT 4182 74.666 5.683 131.550 1.00 0.00 H TER 6409 WAT 4182 ATOM 6409 O WAT 4183 119.493 133.429 131.263 1.00 0.00 O ATOM 6410 H1 WAT 4183 119.947 132.634 131.543 1.00 0.00 H ATOM 6411 H2 WAT 4183 118.767 133.113 130.724 1.00 0.00 H TER 6413 WAT 4183 ATOM 6413 O WAT 4184 36.465 45.634 68.088 1.00 0.00 O ATOM 6414 H1 WAT 4184 36.254 46.558 68.227 1.00 0.00 H ATOM 6415 H2 WAT 4184 36.408 45.516 67.140 1.00 0.00 H TER 6417 WAT 4184 ATOM 6417 O WAT 4185 125.248 35.541 104.577 1.00 0.00 O ATOM 6418 H1 WAT 4185 124.594 35.210 103.961 1.00 0.00 H ATOM 6419 H2 WAT 4185 124.948 36.425 104.792 1.00 0.00 H TER 6421 WAT 4185 ATOM 6421 O WAT 4186 11.574 42.626 81.707 1.00 0.00 O ATOM 6422 H1 WAT 4186 10.984 41.893 81.534 1.00 0.00 H ATOM 6423 H2 WAT 4186 11.695 43.043 80.854 1.00 0.00 H TER 6425 WAT 4186 ATOM 6425 O WAT 4187 66.872 40.810 143.429 1.00 0.00 O ATOM 6426 H1 WAT 4187 66.782 40.125 142.767 1.00 0.00 H ATOM 6427 H2 WAT 4187 67.285 41.539 142.965 1.00 0.00 H TER 6429 WAT 4187 ATOM 6429 O WAT 4188 37.713 52.476 99.716 1.00 0.00 O ATOM 6430 H1 WAT 4188 37.536 53.398 99.902 1.00 0.00 H ATOM 6431 H2 WAT 4188 37.603 52.397 98.768 1.00 0.00 H TER 6433 WAT 4188 ATOM 6433 O WAT 4189 41.180 99.279 73.306 1.00 0.00 O ATOM 6434 H1 WAT 4189 41.253 99.485 74.238 1.00 0.00 H ATOM 6435 H2 WAT 4189 41.935 98.719 73.125 1.00 0.00 H TER 6437 WAT 4189 ATOM 6437 O WAT 4190 19.349 128.084 96.513 1.00 0.00 O ATOM 6438 H1 WAT 4190 19.843 128.874 96.732 1.00 0.00 H ATOM 6439 H2 WAT 4190 19.038 127.755 97.357 1.00 0.00 H TER 6441 WAT 4190 ATOM 6441 O WAT 4191 89.650 7.939 156.433 1.00 0.00 O ATOM 6442 H1 WAT 4191 88.723 8.003 156.666 1.00 0.00 H ATOM 6443 H2 WAT 4191 90.062 8.675 156.886 1.00 0.00 H TER 6445 WAT 4191 ATOM 6445 O WAT 4192 23.823 124.699 135.959 1.00 0.00 O ATOM 6446 H1 WAT 4192 23.732 125.607 136.246 1.00 0.00 H ATOM 6447 H2 WAT 4192 24.700 124.444 136.246 1.00 0.00 H TER 6449 WAT 4192 ATOM 6449 O WAT 4193 97.049 101.158 136.871 1.00 0.00 O ATOM 6450 H1 WAT 4193 96.278 100.617 137.039 1.00 0.00 H ATOM 6451 H2 WAT 4193 96.799 102.032 137.171 1.00 0.00 H TER 6453 WAT 4193 ATOM 6453 O WAT 4194 57.911 4.454 149.136 1.00 0.00 O ATOM 6454 H1 WAT 4194 57.079 4.358 148.674 1.00 0.00 H ATOM 6455 H2 WAT 4194 57.697 4.974 149.910 1.00 0.00 H TER 6457 WAT 4194 ATOM 6457 O WAT 4195 74.709 76.275 6.143 1.00 0.00 O ATOM 6458 H1 WAT 4195 74.215 77.090 6.058 1.00 0.00 H ATOM 6459 H2 WAT 4195 74.046 75.611 6.333 1.00 0.00 H TER 6461 WAT 4195 ATOM 6461 O WAT 4196 138.792 110.201 16.559 1.00 0.00 O ATOM 6462 H1 WAT 4196 139.102 110.420 17.438 1.00 0.00 H ATOM 6463 H2 WAT 4196 139.179 109.345 16.376 1.00 0.00 H TER 6465 WAT 4196 ATOM 6465 O WAT 4197 76.492 45.537 68.251 1.00 0.00 O ATOM 6466 H1 WAT 4197 76.729 44.657 67.957 1.00 0.00 H ATOM 6467 H2 WAT 4197 76.937 45.636 69.093 1.00 0.00 H TER 6469 WAT 4197 ATOM 6469 O WAT 4198 59.565 67.414 25.304 1.00 0.00 O ATOM 6470 H1 WAT 4198 59.837 66.845 26.023 1.00 0.00 H ATOM 6471 H2 WAT 4198 60.141 68.176 25.370 1.00 0.00 H TER 6473 WAT 4198 ATOM 6473 O WAT 4199 137.620 72.979 6.102 1.00 0.00 O ATOM 6474 H1 WAT 4199 137.838 72.298 5.465 1.00 0.00 H ATOM 6475 H2 WAT 4199 137.550 72.513 6.935 1.00 0.00 H TER 6477 WAT 4199 ATOM 6477 O WAT 4200 89.237 23.998 103.918 1.00 0.00 O ATOM 6478 H1 WAT 4200 89.774 24.470 103.281 1.00 0.00 H ATOM 6479 H2 WAT 4200 89.382 23.074 103.715 1.00 0.00 H TER 6481 WAT 4200 ATOM 6481 O WAT 4201 95.515 102.069 99.681 1.00 0.00 O ATOM 6482 H1 WAT 4201 96.380 102.420 99.469 1.00 0.00 H ATOM 6483 H2 WAT 4201 94.954 102.841 99.756 1.00 0.00 H TER 6485 WAT 4201 ATOM 6485 O WAT 4202 124.744 57.963 109.334 1.00 0.00 O ATOM 6486 H1 WAT 4202 124.569 58.612 108.651 1.00 0.00 H ATOM 6487 H2 WAT 4202 124.002 57.360 109.286 1.00 0.00 H TER 6489 WAT 4202 ATOM 6489 O WAT 4203 137.430 91.164 105.069 1.00 0.00 O ATOM 6490 H1 WAT 4203 136.733 91.821 105.073 1.00 0.00 H ATOM 6491 H2 WAT 4203 137.552 90.939 105.992 1.00 0.00 H TER 6493 WAT 4203 ATOM 6493 O WAT 4204 22.555 1.571 2.629 1.00 0.00 O ATOM 6494 H1 WAT 4204 22.092 0.787 2.331 1.00 0.00 H ATOM 6495 H2 WAT 4204 23.402 1.246 2.934 1.00 0.00 H TER 6497 WAT 4204 ATOM 6497 O WAT 4205 45.089 52.008 16.836 1.00 0.00 O ATOM 6498 H1 WAT 4205 45.300 51.088 16.991 1.00 0.00 H ATOM 6499 H2 WAT 4205 45.386 52.458 17.627 1.00 0.00 H TER 6501 WAT 4205 ATOM 6501 O WAT 4206 36.151 48.894 57.646 1.00 0.00 O ATOM 6502 H1 WAT 4206 36.927 48.820 57.092 1.00 0.00 H ATOM 6503 H2 WAT 4206 36.324 49.655 58.201 1.00 0.00 H TER 6505 WAT 4206 ATOM 6505 O WAT 4207 134.000 13.411 14.266 1.00 0.00 O ATOM 6506 H1 WAT 4207 133.150 13.850 14.228 1.00 0.00 H ATOM 6507 H2 WAT 4207 133.799 12.486 14.121 1.00 0.00 H TER 6509 WAT 4207 ATOM 6509 O WAT 4208 74.917 71.516 5.442 1.00 0.00 O ATOM 6510 H1 WAT 4208 75.798 71.288 5.737 1.00 0.00 H ATOM 6511 H2 WAT 4208 74.804 71.028 4.626 1.00 0.00 H TER 6513 WAT 4208 ATOM 6513 O WAT 4209 8.340 76.567 16.319 1.00 0.00 O ATOM 6514 H1 WAT 4209 7.843 77.177 16.864 1.00 0.00 H ATOM 6515 H2 WAT 4209 8.949 76.146 16.927 1.00 0.00 H TER 6517 WAT 4209 ATOM 6517 O WAT 4210 18.250 127.094 157.435 1.00 0.00 O ATOM 6518 H1 WAT 4210 18.989 126.519 157.636 1.00 0.00 H ATOM 6519 H2 WAT 4210 17.521 126.733 157.939 1.00 0.00 H TER 6521 WAT 4210 ATOM 6521 O WAT 4211 124.117 122.424 70.514 1.00 0.00 O ATOM 6522 H1 WAT 4211 124.973 122.095 70.787 1.00 0.00 H ATOM 6523 H2 WAT 4211 124.003 122.088 69.625 1.00 0.00 H TER 6525 WAT 4211 ATOM 6525 O WAT 4212 82.449 99.300 124.871 1.00 0.00 O ATOM 6526 H1 WAT 4212 82.250 99.461 125.794 1.00 0.00 H ATOM 6527 H2 WAT 4212 83.308 99.702 124.738 1.00 0.00 H TER 6529 WAT 4212 ATOM 6529 O WAT 4213 74.276 124.510 68.051 1.00 0.00 O ATOM 6530 H1 WAT 4213 74.733 125.098 67.450 1.00 0.00 H ATOM 6531 H2 WAT 4213 73.356 124.570 67.793 1.00 0.00 H TER 6533 WAT 4213 ATOM 6533 O WAT 4214 28.255 68.885 154.558 1.00 0.00 O ATOM 6534 H1 WAT 4214 28.924 69.198 153.949 1.00 0.00 H ATOM 6535 H2 WAT 4214 27.942 68.068 154.171 1.00 0.00 H TER 6537 WAT 4214 ATOM 6537 O WAT 4215 38.284 86.009 19.495 1.00 0.00 O ATOM 6538 H1 WAT 4215 37.479 86.033 20.014 1.00 0.00 H ATOM 6539 H2 WAT 4215 38.068 85.459 18.743 1.00 0.00 H TER 6541 WAT 4215 ATOM 6541 O WAT 4216 12.684 142.956 109.611 1.00 0.00 O ATOM 6542 H1 WAT 4216 12.118 143.626 109.226 1.00 0.00 H ATOM 6543 H2 WAT 4216 12.094 142.424 110.146 1.00 0.00 H TER 6545 WAT 4216 ATOM 6545 O WAT 4217 125.459 20.817 143.709 1.00 0.00 O ATOM 6546 H1 WAT 4217 125.434 21.214 144.580 1.00 0.00 H ATOM 6547 H2 WAT 4217 126.181 20.190 143.752 1.00 0.00 H TER 6549 WAT 4217 ATOM 6549 O WAT 4218 93.248 72.326 66.533 1.00 0.00 O ATOM 6550 H1 WAT 4218 92.821 72.744 65.785 1.00 0.00 H ATOM 6551 H2 WAT 4218 93.909 72.958 66.815 1.00 0.00 H TER 6553 WAT 4218 ATOM 6553 O WAT 4219 122.560 81.022 138.307 1.00 0.00 O ATOM 6554 H1 WAT 4219 122.184 81.880 138.110 1.00 0.00 H ATOM 6555 H2 WAT 4219 121.815 80.493 138.591 1.00 0.00 H TER 6557 WAT 4219 ATOM 6557 O WAT 4220 110.832 58.948 81.482 1.00 0.00 O ATOM 6558 H1 WAT 4220 110.294 59.609 81.046 1.00 0.00 H ATOM 6559 H2 WAT 4220 111.696 59.353 81.556 1.00 0.00 H TER 6561 WAT 4220 ATOM 6561 O WAT 4221 38.627 8.682 96.739 1.00 0.00 O ATOM 6562 H1 WAT 4221 38.126 9.498 96.739 1.00 0.00 H ATOM 6563 H2 WAT 4221 39.533 8.957 96.603 1.00 0.00 H TER 6565 WAT 4221 ATOM 6565 O WAT 4222 47.389 74.249 146.964 1.00 0.00 O ATOM 6566 H1 WAT 4222 47.977 73.503 147.081 1.00 0.00 H ATOM 6567 H2 WAT 4222 46.512 73.880 147.065 1.00 0.00 H TER 6569 WAT 4222 ATOM 6569 O WAT 4223 68.187 39.972 149.985 1.00 0.00 O ATOM 6570 H1 WAT 4223 68.544 40.860 150.017 1.00 0.00 H ATOM 6571 H2 WAT 4223 67.302 40.056 150.340 1.00 0.00 H TER 6573 WAT 4223 ATOM 6573 O WAT 4224 123.490 120.994 74.328 1.00 0.00 O ATOM 6574 H1 WAT 4224 124.290 121.014 74.853 1.00 0.00 H ATOM 6575 H2 WAT 4224 123.229 120.073 74.324 1.00 0.00 H TER 6577 WAT 4224 ATOM 6577 O WAT 4225 44.607 140.124 141.557 1.00 0.00 O ATOM 6578 H1 WAT 4225 45.016 139.279 141.742 1.00 0.00 H ATOM 6579 H2 WAT 4225 44.949 140.373 140.698 1.00 0.00 H TER 6581 WAT 4225 ATOM 6581 O WAT 4226 20.325 19.228 61.974 1.00 0.00 O ATOM 6582 H1 WAT 4226 20.944 18.713 62.491 1.00 0.00 H ATOM 6583 H2 WAT 4226 20.197 18.717 61.175 1.00 0.00 H TER 6585 WAT 4226 ATOM 6585 O WAT 4227 110.251 34.492 114.467 1.00 0.00 O ATOM 6586 H1 WAT 4227 110.974 33.936 114.758 1.00 0.00 H ATOM 6587 H2 WAT 4227 110.081 35.072 115.209 1.00 0.00 H TER 6589 WAT 4227 ATOM 6589 O WAT 4228 144.534 144.554 71.705 1.00 0.00 O ATOM 6590 H1 WAT 4228 145.269 144.644 71.098 1.00 0.00 H ATOM 6591 H2 WAT 4228 144.941 144.352 72.547 1.00 0.00 H TER 6593 WAT 4228 ATOM 6593 O WAT 4229 9.116 105.762 117.649 1.00 0.00 O ATOM 6594 H1 WAT 4229 8.636 106.411 117.134 1.00 0.00 H ATOM 6595 H2 WAT 4229 9.478 105.161 116.998 1.00 0.00 H TER 6597 WAT 4229 ATOM 6597 O WAT 4230 86.653 18.515 102.797 1.00 0.00 O ATOM 6598 H1 WAT 4230 86.313 19.302 102.371 1.00 0.00 H ATOM 6599 H2 WAT 4230 86.399 17.799 102.214 1.00 0.00 H TER 6601 WAT 4230 ATOM 6601 O WAT 4231 100.546 106.483 23.141 1.00 0.00 O ATOM 6602 H1 WAT 4231 99.730 106.982 23.099 1.00 0.00 H ATOM 6603 H2 WAT 4231 100.919 106.561 22.263 1.00 0.00 H TER 6605 WAT 4231 ATOM 6605 O WAT 4232 24.036 114.979 21.686 1.00 0.00 O ATOM 6606 H1 WAT 4232 24.964 114.740 21.688 1.00 0.00 H ATOM 6607 H2 WAT 4232 23.801 115.035 22.612 1.00 0.00 H TER 6609 WAT 4232 ATOM 6609 O WAT 4233 89.131 36.670 7.716 1.00 0.00 O ATOM 6610 H1 WAT 4233 89.595 36.573 6.885 1.00 0.00 H ATOM 6611 H2 WAT 4233 88.220 36.826 7.466 1.00 0.00 H TER 6613 WAT 4233 ATOM 6613 O WAT 4234 33.340 140.093 119.535 1.00 0.00 O ATOM 6614 H1 WAT 4234 33.926 139.981 118.786 1.00 0.00 H ATOM 6615 H2 WAT 4234 32.582 139.546 119.330 1.00 0.00 H TER 6617 WAT 4234 ATOM 6617 O WAT 4235 71.829 118.245 105.068 1.00 0.00 O ATOM 6618 H1 WAT 4235 71.196 117.569 105.311 1.00 0.00 H ATOM 6619 H2 WAT 4235 72.010 118.082 104.143 1.00 0.00 H TER 6621 WAT 4235 ATOM 6621 O WAT 4236 137.673 48.728 87.996 1.00 0.00 O ATOM 6622 H1 WAT 4236 138.222 48.064 87.580 1.00 0.00 H ATOM 6623 H2 WAT 4236 137.689 49.467 87.388 1.00 0.00 H TER 6625 WAT 4236 ATOM 6625 O WAT 4237 13.866 27.671 121.248 1.00 0.00 O ATOM 6626 H1 WAT 4237 13.120 28.243 121.065 1.00 0.00 H ATOM 6627 H2 WAT 4237 13.670 27.287 122.103 1.00 0.00 H TER 6629 WAT 4237 ATOM 6629 O WAT 4238 28.491 38.443 85.508 1.00 0.00 O ATOM 6630 H1 WAT 4238 29.018 39.074 85.018 1.00 0.00 H ATOM 6631 H2 WAT 4238 28.060 37.917 84.834 1.00 0.00 H TER 6633 WAT 4238 ATOM 6633 O WAT 4239 46.574 89.092 12.215 1.00 0.00 O ATOM 6634 H1 WAT 4239 46.003 88.378 11.931 1.00 0.00 H ATOM 6635 H2 WAT 4239 46.302 89.841 11.684 1.00 0.00 H TER 6637 WAT 4239 ATOM 6637 O WAT 4240 125.242 123.852 148.534 1.00 0.00 O ATOM 6638 H1 WAT 4240 125.716 123.364 147.860 1.00 0.00 H ATOM 6639 H2 WAT 4240 125.084 124.710 148.142 1.00 0.00 H TER 6641 WAT 4240 ATOM 6641 O WAT 4241 23.822 114.177 64.587 1.00 0.00 O ATOM 6642 H1 WAT 4241 24.152 114.515 63.755 1.00 0.00 H ATOM 6643 H2 WAT 4241 22.917 114.485 64.629 1.00 0.00 H TER 6645 WAT 4241 ATOM 6645 O WAT 4242 51.752 111.819 60.180 1.00 0.00 O ATOM 6646 H1 WAT 4242 52.402 111.183 60.479 1.00 0.00 H ATOM 6647 H2 WAT 4242 52.238 112.641 60.109 1.00 0.00 H TER 6649 WAT 4242 ATOM 6649 O WAT 4243 60.584 45.070 143.350 1.00 0.00 O ATOM 6650 H1 WAT 4243 61.286 44.520 143.002 1.00 0.00 H ATOM 6651 H2 WAT 4243 60.861 45.965 143.153 1.00 0.00 H TER 6653 WAT 4243 ATOM 6653 O WAT 4244 104.185 87.175 67.622 1.00 0.00 O ATOM 6654 H1 WAT 4244 103.253 86.973 67.707 1.00 0.00 H ATOM 6655 H2 WAT 4244 104.356 87.127 66.682 1.00 0.00 H TER 6657 WAT 4244 ATOM 6657 O WAT 4245 135.623 74.689 128.225 1.00 0.00 O ATOM 6658 H1 WAT 4245 135.871 74.708 127.301 1.00 0.00 H ATOM 6659 H2 WAT 4245 134.940 75.354 128.304 1.00 0.00 H TER 6661 WAT 4245 ATOM 6661 O WAT 4246 93.866 3.839 147.821 1.00 0.00 O ATOM 6662 H1 WAT 4246 94.714 3.814 147.378 1.00 0.00 H ATOM 6663 H2 WAT 4246 93.864 4.673 148.289 1.00 0.00 H TER 6665 WAT 4246 ATOM 6665 O WAT 4247 129.336 80.401 20.286 1.00 0.00 O ATOM 6666 H1 WAT 4247 128.631 81.014 20.079 1.00 0.00 H ATOM 6667 H2 WAT 4247 128.925 79.538 20.236 1.00 0.00 H TER 6669 WAT 4247 ATOM 6669 O WAT 4248 123.544 4.493 116.009 1.00 0.00 O ATOM 6670 H1 WAT 4248 122.641 4.637 115.725 1.00 0.00 H ATOM 6671 H2 WAT 4248 123.986 5.324 115.831 1.00 0.00 H TER 6673 WAT 4248 ATOM 6673 O WAT 4249 143.774 21.916 146.802 1.00 0.00 O ATOM 6674 H1 WAT 4249 143.410 21.142 147.230 1.00 0.00 H ATOM 6675 H2 WAT 4249 143.283 21.990 145.983 1.00 0.00 H TER 6677 WAT 4249 ATOM 6677 O WAT 4250 88.645 27.594 125.348 1.00 0.00 O ATOM 6678 H1 WAT 4250 89.077 28.342 125.761 1.00 0.00 H ATOM 6679 H2 WAT 4250 87.769 27.582 125.733 1.00 0.00 H TER 6681 WAT 4250 ATOM 6681 O WAT 4251 22.303 88.327 58.384 1.00 0.00 O ATOM 6682 H1 WAT 4251 22.028 87.410 58.356 1.00 0.00 H ATOM 6683 H2 WAT 4251 21.635 88.762 58.912 1.00 0.00 H TER 6685 WAT 4251 ATOM 6685 O WAT 4252 126.967 44.702 81.912 1.00 0.00 O ATOM 6686 H1 WAT 4252 127.876 44.837 82.180 1.00 0.00 H ATOM 6687 H2 WAT 4252 126.577 45.576 81.939 1.00 0.00 H TER 6689 WAT 4252 ATOM 6689 O WAT 4253 141.156 120.933 0.551 1.00 0.00 O ATOM 6690 H1 WAT 4253 140.410 121.372 0.142 1.00 0.00 H ATOM 6691 H2 WAT 4253 140.764 120.370 1.220 1.00 0.00 H TER 6693 WAT 4253 ATOM 6693 O WAT 4254 79.105 37.162 56.821 1.00 0.00 O ATOM 6694 H1 WAT 4254 78.543 37.185 57.596 1.00 0.00 H ATOM 6695 H2 WAT 4254 78.496 37.195 56.083 1.00 0.00 H TER 6697 WAT 4254 ATOM 6697 O WAT 4255 79.867 144.503 82.341 1.00 0.00 O ATOM 6698 H1 WAT 4255 79.102 144.766 81.830 1.00 0.00 H ATOM 6699 H2 WAT 4255 80.423 144.037 81.717 1.00 0.00 H TER 6701 WAT 4255 ATOM 6701 O WAT 4256 18.755 60.100 103.497 1.00 0.00 O ATOM 6702 H1 WAT 4256 18.301 59.306 103.214 1.00 0.00 H ATOM 6703 H2 WAT 4256 18.360 60.312 104.343 1.00 0.00 H TER 6705 WAT 4256 ATOM 6705 O WAT 4257 9.476 59.076 101.906 1.00 0.00 O ATOM 6706 H1 WAT 4257 9.130 59.898 101.558 1.00 0.00 H ATOM 6707 H2 WAT 4257 10.403 59.254 102.063 1.00 0.00 H TER 6709 WAT 4257 ATOM 6709 O WAT 4258 54.400 59.112 66.132 1.00 0.00 O ATOM 6710 H1 WAT 4258 53.461 58.958 66.230 1.00 0.00 H ATOM 6711 H2 WAT 4258 54.590 58.863 65.227 1.00 0.00 H TER 6713 WAT 4258 ATOM 6713 O WAT 4259 63.336 39.378 139.924 1.00 0.00 O ATOM 6714 H1 WAT 4259 62.754 39.797 140.558 1.00 0.00 H ATOM 6715 H2 WAT 4259 64.179 39.320 140.374 1.00 0.00 H TER 6717 WAT 4259 ATOM 6717 O WAT 4260 133.998 47.422 7.661 1.00 0.00 O ATOM 6718 H1 WAT 4260 133.940 47.472 6.707 1.00 0.00 H ATOM 6719 H2 WAT 4260 134.700 48.031 7.891 1.00 0.00 H TER 6721 WAT 4260 ATOM 6721 O WAT 4261 57.089 22.393 129.722 1.00 0.00 O ATOM 6722 H1 WAT 4261 57.410 22.319 128.823 1.00 0.00 H ATOM 6723 H2 WAT 4261 56.175 22.113 129.674 1.00 0.00 H TER 6725 WAT 4261 ATOM 6725 O WAT 4262 40.957 8.541 136.144 1.00 0.00 O ATOM 6726 H1 WAT 4262 40.397 9.117 135.622 1.00 0.00 H ATOM 6727 H2 WAT 4262 41.849 8.801 135.913 1.00 0.00 H TER 6729 WAT 4262 ATOM 6729 O WAT 4263 139.475 2.328 158.681 1.00 0.00 O ATOM 6730 H1 WAT 4263 138.874 3.068 158.763 1.00 0.00 H ATOM 6731 H2 WAT 4263 140.300 2.719 158.394 1.00 0.00 H TER 6733 WAT 4263 ATOM 6733 O WAT 4264 83.351 128.180 135.488 1.00 0.00 O ATOM 6734 H1 WAT 4264 84.100 128.170 134.892 1.00 0.00 H ATOM 6735 H2 WAT 4264 82.898 127.354 135.317 1.00 0.00 H TER 6737 WAT 4264 ATOM 6737 O WAT 4265 83.796 21.553 110.344 1.00 0.00 O ATOM 6738 H1 WAT 4265 83.936 20.654 110.045 1.00 0.00 H ATOM 6739 H2 WAT 4265 82.854 21.693 110.251 1.00 0.00 H TER 6741 WAT 4265 ATOM 6741 O WAT 4266 71.540 12.470 93.364 1.00 0.00 O ATOM 6742 H1 WAT 4266 71.259 12.517 92.450 1.00 0.00 H ATOM 6743 H2 WAT 4266 70.788 12.789 93.862 1.00 0.00 H TER 6745 WAT 4266 ATOM 6745 O WAT 4267 13.748 114.449 21.245 1.00 0.00 O ATOM 6746 H1 WAT 4267 14.437 114.976 21.648 1.00 0.00 H ATOM 6747 H2 WAT 4267 13.159 115.089 20.846 1.00 0.00 H TER 6749 WAT 4267 ATOM 6749 O WAT 4268 15.228 85.247 5.975 1.00 0.00 O ATOM 6750 H1 WAT 4268 15.455 84.342 6.189 1.00 0.00 H ATOM 6751 H2 WAT 4268 15.254 85.281 5.019 1.00 0.00 H TER 6753 WAT 4268 ATOM 6753 O WAT 4269 121.535 82.973 148.936 1.00 0.00 O ATOM 6754 H1 WAT 4269 121.798 82.465 148.169 1.00 0.00 H ATOM 6755 H2 WAT 4269 120.808 83.514 148.626 1.00 0.00 H TER 6757 WAT 4269 ATOM 6757 O WAT 4270 27.783 70.306 21.901 1.00 0.00 O ATOM 6758 H1 WAT 4270 27.993 70.409 22.829 1.00 0.00 H ATOM 6759 H2 WAT 4270 26.852 70.524 21.841 1.00 0.00 H TER 6761 WAT 4270 ATOM 6761 O WAT 4271 66.890 48.180 151.575 1.00 0.00 O ATOM 6762 H1 WAT 4271 66.249 48.547 152.183 1.00 0.00 H ATOM 6763 H2 WAT 4271 67.176 48.926 151.049 1.00 0.00 H TER 6765 WAT 4271 ATOM 6765 O WAT 4272 17.006 21.521 13.272 1.00 0.00 O ATOM 6766 H1 WAT 4272 17.620 22.244 13.146 1.00 0.00 H ATOM 6767 H2 WAT 4272 17.502 20.870 13.770 1.00 0.00 H TER 6769 WAT 4272 ATOM 6769 O WAT 4273 47.231 78.156 75.488 1.00 0.00 O ATOM 6770 H1 WAT 4273 47.973 78.686 75.778 1.00 0.00 H ATOM 6771 H2 WAT 4273 46.765 77.935 76.294 1.00 0.00 H TER 6773 WAT 4273 ATOM 6773 O WAT 4274 58.700 127.095 117.656 1.00 0.00 O ATOM 6774 H1 WAT 4274 57.840 127.395 117.951 1.00 0.00 H ATOM 6775 H2 WAT 4274 58.541 126.220 117.304 1.00 0.00 H TER 6777 WAT 4274 ATOM 6777 O WAT 4275 50.585 104.090 63.605 1.00 0.00 O ATOM 6778 H1 WAT 4275 50.652 104.795 62.960 1.00 0.00 H ATOM 6779 H2 WAT 4275 49.656 103.860 63.612 1.00 0.00 H TER 6781 WAT 4275 ATOM 6781 O WAT 4276 57.593 73.922 149.274 1.00 0.00 O ATOM 6782 H1 WAT 4276 57.580 74.867 149.430 1.00 0.00 H ATOM 6783 H2 WAT 4276 58.042 73.825 148.434 1.00 0.00 H TER 6785 WAT 4276 ATOM 6785 O WAT 4277 17.077 18.355 106.084 1.00 0.00 O ATOM 6786 H1 WAT 4277 17.482 17.726 105.487 1.00 0.00 H ATOM 6787 H2 WAT 4277 17.290 19.210 105.712 1.00 0.00 H TER 6789 WAT 4277 ATOM 6789 O WAT 4278 32.438 121.884 94.291 1.00 0.00 O ATOM 6790 H1 WAT 4278 31.815 122.604 94.196 1.00 0.00 H ATOM 6791 H2 WAT 4278 33.284 122.314 94.418 1.00 0.00 H TER 6793 WAT 4278 ATOM 6793 O WAT 4279 120.370 137.266 137.953 1.00 0.00 O ATOM 6794 H1 WAT 4279 119.474 137.071 138.229 1.00 0.00 H ATOM 6795 H2 WAT 4279 120.444 136.870 137.084 1.00 0.00 H TER 6797 WAT 4279 ATOM 6797 O WAT 4280 43.105 109.367 15.895 1.00 0.00 O ATOM 6798 H1 WAT 4280 42.865 108.710 16.548 1.00 0.00 H ATOM 6799 H2 WAT 4280 42.354 109.403 15.303 1.00 0.00 H TER 6801 WAT 4280 ATOM 6801 O WAT 4281 105.864 109.429 72.351 1.00 0.00 O ATOM 6802 H1 WAT 4281 106.150 109.219 73.240 1.00 0.00 H ATOM 6803 H2 WAT 4281 106.288 110.264 72.154 1.00 0.00 H TER 6805 WAT 4281 ATOM 6805 O WAT 4282 12.434 72.860 127.379 1.00 0.00 O ATOM 6806 H1 WAT 4282 12.349 72.325 126.590 1.00 0.00 H ATOM 6807 H2 WAT 4282 13.080 73.527 127.148 1.00 0.00 H TER 6809 WAT 4282 ATOM 6809 O WAT 4283 22.357 121.553 94.132 1.00 0.00 O ATOM 6810 H1 WAT 4283 23.305 121.534 94.001 1.00 0.00 H ATOM 6811 H2 WAT 4283 22.225 121.136 94.984 1.00 0.00 H TER 6813 WAT 4283 ATOM 6813 O WAT 4284 18.305 127.915 93.980 1.00 0.00 O ATOM 6814 H1 WAT 4284 18.696 127.884 94.853 1.00 0.00 H ATOM 6815 H2 WAT 4284 17.650 127.217 93.986 1.00 0.00 H TER 6817 WAT 4284 ATOM 6817 O WAT 4285 51.138 142.998 127.184 1.00 0.00 O ATOM 6818 H1 WAT 4285 51.934 143.423 127.503 1.00 0.00 H ATOM 6819 H2 WAT 4285 51.043 142.222 127.737 1.00 0.00 H TER 6821 WAT 4285 ATOM 6821 O WAT 4286 120.501 83.925 122.064 1.00 0.00 O ATOM 6822 H1 WAT 4286 119.897 84.248 121.395 1.00 0.00 H ATOM 6823 H2 WAT 4286 119.953 83.791 122.837 1.00 0.00 H TER 6825 WAT 4286 ATOM 6825 O WAT 4287 60.568 47.645 108.428 1.00 0.00 O ATOM 6826 H1 WAT 4287 59.901 48.313 108.582 1.00 0.00 H ATOM 6827 H2 WAT 4287 60.326 46.925 109.011 1.00 0.00 H TER 6829 WAT 4287 ATOM 6829 O WAT 4288 127.327 9.300 62.549 1.00 0.00 O ATOM 6830 H1 WAT 4288 126.826 10.105 62.423 1.00 0.00 H ATOM 6831 H2 WAT 4288 128.044 9.553 63.131 1.00 0.00 H TER 6833 WAT 4288 ATOM 6833 O WAT 4289 40.108 7.214 82.604 1.00 0.00 O ATOM 6834 H1 WAT 4289 40.819 7.055 81.984 1.00 0.00 H ATOM 6835 H2 WAT 4289 39.310 7.066 82.097 1.00 0.00 H TER 6837 WAT 4289 ATOM 6837 O WAT 4290 128.338 64.913 156.915 1.00 0.00 O ATOM 6838 H1 WAT 4290 128.772 65.001 156.066 1.00 0.00 H ATOM 6839 H2 WAT 4290 128.928 65.348 157.532 1.00 0.00 H TER 6841 WAT 4290 ATOM 6841 O WAT 4291 16.033 7.980 155.691 1.00 0.00 O ATOM 6842 H1 WAT 4291 15.539 7.457 155.059 1.00 0.00 H ATOM 6843 H2 WAT 4291 15.725 8.875 155.554 1.00 0.00 H TER 6845 WAT 4291 ATOM 6845 O WAT 4292 84.318 139.391 5.270 1.00 0.00 O ATOM 6846 H1 WAT 4292 83.702 139.777 5.892 1.00 0.00 H ATOM 6847 H2 WAT 4292 83.889 139.482 4.419 1.00 0.00 H TER 6849 WAT 4292 ATOM 6849 O WAT 4293 52.697 75.788 150.765 1.00 0.00 O ATOM 6850 H1 WAT 4293 53.539 76.097 150.431 1.00 0.00 H ATOM 6851 H2 WAT 4293 52.152 75.688 149.985 1.00 0.00 H TER 6853 WAT 4293 ATOM 6853 O WAT 4294 71.227 118.893 154.840 1.00 0.00 O ATOM 6854 H1 WAT 4294 72.172 118.970 154.706 1.00 0.00 H ATOM 6855 H2 WAT 4294 71.060 119.376 155.650 1.00 0.00 H TER 6857 WAT 4294 ATOM 6857 O WAT 4295 43.054 85.700 62.829 1.00 0.00 O ATOM 6858 H1 WAT 4295 43.027 86.599 62.501 1.00 0.00 H ATOM 6859 H2 WAT 4295 43.113 85.793 63.780 1.00 0.00 H TER 6861 WAT 4295 ATOM 6861 O WAT 4296 83.285 27.742 61.570 1.00 0.00 O ATOM 6862 H1 WAT 4296 83.205 27.782 62.523 1.00 0.00 H ATOM 6863 H2 WAT 4296 84.131 27.320 61.418 1.00 0.00 H TER 6865 WAT 4296 ATOM 6865 O WAT 4297 82.851 11.654 119.337 1.00 0.00 O ATOM 6866 H1 WAT 4297 83.171 11.663 118.435 1.00 0.00 H ATOM 6867 H2 WAT 4297 83.644 11.603 119.871 1.00 0.00 H TER 6869 WAT 4297 ATOM 6869 O WAT 4298 76.953 25.441 56.106 1.00 0.00 O ATOM 6870 H1 WAT 4298 76.194 25.366 55.527 1.00 0.00 H ATOM 6871 H2 WAT 4298 77.431 24.620 55.982 1.00 0.00 H TER 6873 WAT 4298 ATOM 6873 O WAT 4299 52.466 134.011 141.006 1.00 0.00 O ATOM 6874 H1 WAT 4299 52.467 134.840 141.486 1.00 0.00 H ATOM 6875 H2 WAT 4299 52.128 133.372 141.633 1.00 0.00 H TER 6877 WAT 4299 ATOM 6877 O WAT 4300 104.892 125.667 63.725 1.00 0.00 O ATOM 6878 H1 WAT 4300 103.981 125.830 63.970 1.00 0.00 H ATOM 6879 H2 WAT 4300 105.348 126.480 63.941 1.00 0.00 H TER 6881 WAT 4300 ATOM 6881 O WAT 4301 93.979 41.143 85.156 1.00 0.00 O ATOM 6882 H1 WAT 4301 94.541 40.863 84.433 1.00 0.00 H ATOM 6883 H2 WAT 4301 93.145 41.361 84.740 1.00 0.00 H TER 6885 WAT 4301 ATOM 6885 O WAT 4302 126.403 114.785 129.248 1.00 0.00 O ATOM 6886 H1 WAT 4302 127.103 115.390 129.495 1.00 0.00 H ATOM 6887 H2 WAT 4302 126.739 114.334 128.473 1.00 0.00 H TER 6889 WAT 4302 ATOM 6889 O WAT 4303 34.183 9.807 14.583 1.00 0.00 O ATOM 6890 H1 WAT 4303 33.259 9.776 14.334 1.00 0.00 H ATOM 6891 H2 WAT 4303 34.536 8.964 14.298 1.00 0.00 H TER 6893 WAT 4303 ATOM 6893 O WAT 4304 117.827 22.439 141.597 1.00 0.00 O ATOM 6894 H1 WAT 4304 117.698 23.332 141.279 1.00 0.00 H ATOM 6895 H2 WAT 4304 118.268 22.546 142.440 1.00 0.00 H TER 6897 WAT 4304 ATOM 6897 O WAT 4305 71.852 103.568 131.340 1.00 0.00 O ATOM 6898 H1 WAT 4305 71.766 104.206 132.048 1.00 0.00 H ATOM 6899 H2 WAT 4305 71.978 104.098 130.553 1.00 0.00 H TER 6901 WAT 4305 ATOM 6901 O WAT 4306 2.084 3.763 89.433 1.00 0.00 O ATOM 6902 H1 WAT 4306 2.722 3.304 88.887 1.00 0.00 H ATOM 6903 H2 WAT 4306 1.343 3.160 89.494 1.00 0.00 H TER 6905 WAT 4306 ATOM 6905 O WAT 4307 118.952 92.192 2.653 1.00 0.00 O ATOM 6906 H1 WAT 4307 119.505 91.428 2.494 1.00 0.00 H ATOM 6907 H2 WAT 4307 118.207 92.076 2.063 1.00 0.00 H TER 6909 WAT 4307 ATOM 6909 O WAT 4308 132.173 74.853 20.508 1.00 0.00 O ATOM 6910 H1 WAT 4308 132.266 75.013 21.448 1.00 0.00 H ATOM 6911 H2 WAT 4308 132.208 73.901 20.423 1.00 0.00 H TER 6913 WAT 4308 ATOM 6913 O WAT 4309 128.758 56.197 96.701 1.00 0.00 O ATOM 6914 H1 WAT 4309 128.637 56.566 95.826 1.00 0.00 H ATOM 6915 H2 WAT 4309 129.129 55.329 96.546 1.00 0.00 H TER 6917 WAT 4309 ATOM 6917 O WAT 4310 11.141 79.389 9.256 1.00 0.00 O ATOM 6918 H1 WAT 4310 11.634 79.713 10.010 1.00 0.00 H ATOM 6919 H2 WAT 4310 10.869 78.507 9.509 1.00 0.00 H TER 6921 WAT 4310 ATOM 6921 O WAT 4311 41.527 100.861 9.136 1.00 0.00 O ATOM 6922 H1 WAT 4311 41.276 101.314 9.941 1.00 0.00 H ATOM 6923 H2 WAT 4311 41.748 101.564 8.524 1.00 0.00 H TER 6925 WAT 4311 ATOM 6925 O WAT 4312 139.254 129.678 102.373 1.00 0.00 O ATOM 6926 H1 WAT 4312 139.424 129.507 101.447 1.00 0.00 H ATOM 6927 H2 WAT 4312 138.792 130.517 102.381 1.00 0.00 H TER 6929 WAT 4312 ATOM 6929 O WAT 4313 100.549 51.612 96.258 1.00 0.00 O ATOM 6930 H1 WAT 4313 100.230 52.155 96.978 1.00 0.00 H ATOM 6931 H2 WAT 4313 100.219 52.043 95.469 1.00 0.00 H TER 6933 WAT 4313 ATOM 6933 O WAT 4314 3.288 109.774 93.301 1.00 0.00 O ATOM 6934 H1 WAT 4314 3.767 109.593 92.492 1.00 0.00 H ATOM 6935 H2 WAT 4314 3.248 110.730 93.346 1.00 0.00 H TER 6937 WAT 4314 ATOM 6937 O WAT 4315 81.217 0.951 70.473 1.00 0.00 O ATOM 6938 H1 WAT 4315 81.671 1.323 71.229 1.00 0.00 H ATOM 6939 H2 WAT 4315 80.359 0.694 70.811 1.00 0.00 H TER 6941 WAT 4315 ATOM 6941 O WAT 4316 48.735 35.911 93.091 1.00 0.00 O ATOM 6942 H1 WAT 4316 49.135 35.047 92.992 1.00 0.00 H ATOM 6943 H2 WAT 4316 48.168 35.826 93.858 1.00 0.00 H TER 6945 WAT 4316 ATOM 6945 O WAT 4317 67.603 85.679 77.157 1.00 0.00 O ATOM 6946 H1 WAT 4317 68.543 85.506 77.192 1.00 0.00 H ATOM 6947 H2 WAT 4317 67.209 84.829 76.961 1.00 0.00 H TER 6949 WAT 4317 ATOM 6949 O WAT 4318 89.281 109.536 125.657 1.00 0.00 O ATOM 6950 H1 WAT 4318 89.310 108.659 126.040 1.00 0.00 H ATOM 6951 H2 WAT 4318 90.158 109.670 125.297 1.00 0.00 H TER 6953 WAT 4318 ATOM 6953 O WAT 4319 136.648 102.227 67.061 1.00 0.00 O ATOM 6954 H1 WAT 4319 136.658 103.166 67.245 1.00 0.00 H ATOM 6955 H2 WAT 4319 136.824 102.165 66.122 1.00 0.00 H TER 6957 WAT 4319 ATOM 6957 O WAT 4320 92.262 106.012 3.691 1.00 0.00 O ATOM 6958 H1 WAT 4320 92.815 105.324 3.320 1.00 0.00 H ATOM 6959 H2 WAT 4320 91.766 106.348 2.945 1.00 0.00 H TER 6961 WAT 4320 ATOM 6961 O WAT 4321 141.488 53.180 0.877 1.00 0.00 O ATOM 6962 H1 WAT 4321 141.919 53.040 0.034 1.00 0.00 H ATOM 6963 H2 WAT 4321 140.782 53.797 0.686 1.00 0.00 H TER 6965 WAT 4321 ATOM 6965 O WAT 4322 87.108 124.146 10.760 1.00 0.00 O ATOM 6966 H1 WAT 4322 87.759 124.616 11.280 1.00 0.00 H ATOM 6967 H2 WAT 4322 86.387 123.984 11.368 1.00 0.00 H TER 6969 WAT 4322 ATOM 6969 O WAT 4323 30.786 144.609 22.223 1.00 0.00 O ATOM 6970 H1 WAT 4323 31.204 145.450 22.041 1.00 0.00 H ATOM 6971 H2 WAT 4323 31.304 143.972 21.731 1.00 0.00 H TER 6973 WAT 4323 ATOM 6973 O WAT 4324 82.386 35.998 76.021 1.00 0.00 O ATOM 6974 H1 WAT 4324 81.648 36.091 76.624 1.00 0.00 H ATOM 6975 H2 WAT 4324 82.544 35.055 75.980 1.00 0.00 H TER 6977 WAT 4324 ATOM 6977 O WAT 4325 100.848 125.989 122.686 1.00 0.00 O ATOM 6978 H1 WAT 4325 99.918 126.214 122.710 1.00 0.00 H ATOM 6979 H2 WAT 4325 100.944 125.296 123.339 1.00 0.00 H TER 6981 WAT 4325 ATOM 6981 O WAT 4326 137.920 53.816 73.534 1.00 0.00 O ATOM 6982 H1 WAT 4326 138.845 54.054 73.461 1.00 0.00 H ATOM 6983 H2 WAT 4326 137.779 53.685 74.471 1.00 0.00 H TER 6985 WAT 4326 ATOM 6985 O WAT 4327 11.600 107.249 66.452 1.00 0.00 O ATOM 6986 H1 WAT 4327 12.210 106.652 66.886 1.00 0.00 H ATOM 6987 H2 WAT 4327 11.725 107.081 65.518 1.00 0.00 H TER 6989 WAT 4327 ATOM 6989 O WAT 4328 133.657 136.300 100.336 1.00 0.00 O ATOM 6990 H1 WAT 4328 133.216 135.622 100.848 1.00 0.00 H ATOM 6991 H2 WAT 4328 132.949 136.872 100.039 1.00 0.00 H TER 6993 WAT 4328 ATOM 6993 O WAT 4329 36.460 17.315 0.538 1.00 0.00 O ATOM 6994 H1 WAT 4329 36.435 16.361 0.470 1.00 0.00 H ATOM 6995 H2 WAT 4329 37.368 17.515 0.767 1.00 0.00 H TER 6997 WAT 4329 ATOM 6997 O WAT 4330 13.534 91.279 18.676 1.00 0.00 O ATOM 6998 H1 WAT 4330 13.804 92.061 18.194 1.00 0.00 H ATOM 6999 H2 WAT 4330 14.018 90.564 18.261 1.00 0.00 H TER 7001 WAT 4330 ATOM 7001 O WAT 4331 37.994 141.529 96.851 1.00 0.00 O ATOM 7002 H1 WAT 4331 38.815 142.021 96.839 1.00 0.00 H ATOM 7003 H2 WAT 4331 38.010 141.016 96.043 1.00 0.00 H TER 7005 WAT 4331 ATOM 7005 O WAT 4332 7.218 33.817 17.684 1.00 0.00 O ATOM 7006 H1 WAT 4332 7.700 34.414 18.257 1.00 0.00 H ATOM 7007 H2 WAT 4332 6.508 34.351 17.327 1.00 0.00 H TER 7009 WAT 4332 ATOM 7009 O WAT 4333 117.847 24.136 82.561 1.00 0.00 O ATOM 7010 H1 WAT 4333 117.963 25.086 82.571 1.00 0.00 H ATOM 7011 H2 WAT 4333 117.050 23.997 82.050 1.00 0.00 H TER 7013 WAT 4333 ATOM 7013 O WAT 4334 12.009 39.014 139.536 1.00 0.00 O ATOM 7014 H1 WAT 4334 12.638 38.552 140.091 1.00 0.00 H ATOM 7015 H2 WAT 4334 12.550 39.513 138.925 1.00 0.00 H TER 7017 WAT 4334 ATOM 7017 O WAT 4335 106.932 60.010 155.016 1.00 0.00 O ATOM 7018 H1 WAT 4335 106.606 60.909 154.975 1.00 0.00 H ATOM 7019 H2 WAT 4335 107.883 60.102 155.064 1.00 0.00 H TER 7021 WAT 4335 ATOM 7021 O WAT 4336 13.648 35.518 12.440 1.00 0.00 O ATOM 7022 H1 WAT 4336 14.325 35.705 11.790 1.00 0.00 H ATOM 7023 H2 WAT 4336 13.522 36.347 12.900 1.00 0.00 H TER 7025 WAT 4336 ATOM 7025 O WAT 4337 93.665 51.440 113.509 1.00 0.00 O ATOM 7026 H1 WAT 4337 94.081 51.130 112.704 1.00 0.00 H ATOM 7027 H2 WAT 4337 94.041 50.893 114.199 1.00 0.00 H TER 7029 WAT 4337 ATOM 7029 O WAT 4338 104.703 114.256 56.438 1.00 0.00 O ATOM 7030 H1 WAT 4338 104.980 115.162 56.574 1.00 0.00 H ATOM 7031 H2 WAT 4338 103.871 114.187 56.908 1.00 0.00 H TER 7033 WAT 4338 ATOM 7033 O WAT 4339 125.666 41.235 86.058 1.00 0.00 O ATOM 7034 H1 WAT 4339 125.683 41.176 85.103 1.00 0.00 H ATOM 7035 H2 WAT 4339 126.107 40.439 86.355 1.00 0.00 H TER 7037 WAT 4339 ATOM 7037 O WAT 4340 120.171 127.511 150.383 1.00 0.00 O ATOM 7038 H1 WAT 4340 120.741 126.745 150.316 1.00 0.00 H ATOM 7039 H2 WAT 4340 119.329 127.214 150.037 1.00 0.00 H TER 7041 WAT 4340 ATOM 7041 O WAT 4341 40.464 81.219 139.662 1.00 0.00 O ATOM 7042 H1 WAT 4341 41.399 81.366 139.801 1.00 0.00 H ATOM 7043 H2 WAT 4341 40.415 80.772 138.817 1.00 0.00 H TER 7045 WAT 4341 ATOM 7045 O WAT 4342 100.257 90.370 1.745 1.00 0.00 O ATOM 7046 H1 WAT 4342 100.310 89.546 1.261 1.00 0.00 H ATOM 7047 H2 WAT 4342 99.504 90.259 2.326 1.00 0.00 H TER 7049 WAT 4342 ATOM 7049 O WAT 4343 26.973 40.423 158.601 1.00 0.00 O ATOM 7050 H1 WAT 4343 27.232 39.633 158.127 1.00 0.00 H ATOM 7051 H2 WAT 4343 26.949 40.154 159.519 1.00 0.00 H TER 7053 WAT 4343 ATOM 7053 O WAT 4344 123.423 44.858 118.376 1.00 0.00 O ATOM 7054 H1 WAT 4344 123.209 44.015 117.976 1.00 0.00 H ATOM 7055 H2 WAT 4344 122.581 45.308 118.452 1.00 0.00 H TER 7057 WAT 4344 ATOM 7057 O WAT 4345 58.947 3.865 144.871 1.00 0.00 O ATOM 7058 H1 WAT 4345 59.253 2.992 145.116 1.00 0.00 H ATOM 7059 H2 WAT 4345 58.485 3.732 144.043 1.00 0.00 H TER 7061 WAT 4345 ATOM 7061 O WAT 4346 36.904 59.902 115.198 1.00 0.00 O ATOM 7062 H1 WAT 4346 36.014 59.590 115.030 1.00 0.00 H ATOM 7063 H2 WAT 4346 37.444 59.436 114.560 1.00 0.00 H TER 7065 WAT 4346 ATOM 7065 O WAT 4347 118.600 119.473 106.504 1.00 0.00 O ATOM 7066 H1 WAT 4347 119.299 119.259 107.123 1.00 0.00 H ATOM 7067 H2 WAT 4347 118.603 118.747 105.880 1.00 0.00 H TER 7069 WAT 4347 ATOM 7069 O WAT 4348 62.950 110.821 85.649 1.00 0.00 O ATOM 7070 H1 WAT 4348 63.643 110.482 86.216 1.00 0.00 H ATOM 7071 H2 WAT 4348 63.330 110.804 84.771 1.00 0.00 H TER 7073 WAT 4348 ATOM 7073 O WAT 4349 138.925 71.369 58.782 1.00 0.00 O ATOM 7074 H1 WAT 4349 139.813 71.719 58.857 1.00 0.00 H ATOM 7075 H2 WAT 4349 138.707 71.467 57.855 1.00 0.00 H TER 7077 WAT 4349 ATOM 7077 O WAT 4350 35.982 93.261 91.374 1.00 0.00 O ATOM 7078 H1 WAT 4350 35.799 92.322 91.342 1.00 0.00 H ATOM 7079 H2 WAT 4350 35.157 93.675 91.121 1.00 0.00 H TER 7081 WAT 4350 ATOM 7081 O WAT 4351 138.978 46.759 103.252 1.00 0.00 O ATOM 7082 H1 WAT 4351 138.979 46.374 102.376 1.00 0.00 H ATOM 7083 H2 WAT 4351 138.244 47.373 103.243 1.00 0.00 H TER 7085 WAT 4351 ATOM 7085 O WAT 4352 77.380 18.480 145.704 1.00 0.00 O ATOM 7086 H1 WAT 4352 77.972 17.735 145.598 1.00 0.00 H ATOM 7087 H2 WAT 4352 77.447 18.710 146.630 1.00 0.00 H TER 7089 WAT 4352 ATOM 7089 O WAT 4353 137.604 139.291 9.068 1.00 0.00 O ATOM 7090 H1 WAT 4353 138.019 138.742 9.733 1.00 0.00 H ATOM 7091 H2 WAT 4353 138.226 140.004 8.923 1.00 0.00 H TER 7093 WAT 4353 ATOM 7093 O WAT 4354 76.439 2.067 154.487 1.00 0.00 O ATOM 7094 H1 WAT 4354 76.202 2.132 155.412 1.00 0.00 H ATOM 7095 H2 WAT 4354 76.998 1.291 154.438 1.00 0.00 H TER 7097 WAT 4354 ATOM 7097 O WAT 4355 105.178 13.189 139.472 1.00 0.00 O ATOM 7098 H1 WAT 4355 105.983 12.940 139.017 1.00 0.00 H ATOM 7099 H2 WAT 4355 105.079 14.123 139.290 1.00 0.00 H TER 7101 WAT 4355 ATOM 7101 O WAT 4356 77.709 53.398 57.812 1.00 0.00 O ATOM 7102 H1 WAT 4356 78.109 53.826 58.569 1.00 0.00 H ATOM 7103 H2 WAT 4356 78.408 53.363 57.159 1.00 0.00 H TER 7105 WAT 4356 ATOM 7105 O WAT 4357 126.791 108.713 16.635 1.00 0.00 O ATOM 7106 H1 WAT 4357 126.069 109.013 16.083 1.00 0.00 H ATOM 7107 H2 WAT 4357 127.321 109.496 16.782 1.00 0.00 H TER 7109 WAT 4357 ATOM 7109 O WAT 4358 79.113 14.002 150.690 1.00 0.00 O ATOM 7110 H1 WAT 4358 78.948 13.517 149.881 1.00 0.00 H ATOM 7111 H2 WAT 4358 79.978 14.391 150.564 1.00 0.00 H TER 7113 WAT 4358 ATOM 7113 O WAT 4359 45.839 68.847 66.629 1.00 0.00 O ATOM 7114 H1 WAT 4359 45.794 68.987 65.683 1.00 0.00 H ATOM 7115 H2 WAT 4359 46.773 68.896 66.834 1.00 0.00 H TER 7117 WAT 4359 ATOM 7117 O WAT 4360 93.491 102.477 129.813 1.00 0.00 O ATOM 7118 H1 WAT 4360 93.591 103.395 130.066 1.00 0.00 H ATOM 7119 H2 WAT 4360 92.827 102.135 130.411 1.00 0.00 H TER 7121 WAT 4360 ATOM 7121 O WAT 4361 42.820 116.969 85.509 1.00 0.00 O ATOM 7122 H1 WAT 4361 42.370 116.502 86.214 1.00 0.00 H ATOM 7123 H2 WAT 4361 42.330 117.786 85.412 1.00 0.00 H TER 7125 WAT 4361 ATOM 7125 O WAT 4362 31.234 45.807 9.841 1.00 0.00 O ATOM 7126 H1 WAT 4362 31.228 46.371 9.068 1.00 0.00 H ATOM 7127 H2 WAT 4362 31.884 46.203 10.422 1.00 0.00 H TER 7129 WAT 4362 ATOM 7129 O WAT 4363 53.491 6.153 141.116 1.00 0.00 O ATOM 7130 H1 WAT 4363 53.074 5.653 141.818 1.00 0.00 H ATOM 7131 H2 WAT 4363 54.142 6.694 141.561 1.00 0.00 H TER 7133 WAT 4363 ATOM 7133 O WAT 4364 102.046 129.798 122.215 1.00 0.00 O ATOM 7134 H1 WAT 4364 101.183 129.535 121.894 1.00 0.00 H ATOM 7135 H2 WAT 4364 102.007 129.644 123.159 1.00 0.00 H TER 7137 WAT 4364 ATOM 7137 O WAT 4365 85.298 113.708 72.720 1.00 0.00 O ATOM 7138 H1 WAT 4365 84.486 114.197 72.852 1.00 0.00 H ATOM 7139 H2 WAT 4365 85.465 113.771 71.779 1.00 0.00 H TER 7141 WAT 4365 ATOM 7141 O WAT 4366 138.193 10.667 155.879 1.00 0.00 O ATOM 7142 H1 WAT 4366 137.426 11.226 156.007 1.00 0.00 H ATOM 7143 H2 WAT 4366 137.874 9.780 156.043 1.00 0.00 H TER 7145 WAT 4366 ATOM 7145 O WAT 4367 119.290 8.920 71.507 1.00 0.00 O ATOM 7146 H1 WAT 4367 119.615 9.081 70.622 1.00 0.00 H ATOM 7147 H2 WAT 4367 119.797 8.169 71.816 1.00 0.00 H TER 7149 WAT 4367 ATOM 7149 O WAT 4368 104.543 72.475 116.095 1.00 0.00 O ATOM 7150 H1 WAT 4368 103.976 72.434 115.325 1.00 0.00 H ATOM 7151 H2 WAT 4368 105.364 72.844 115.768 1.00 0.00 H TER 7153 WAT 4368 ATOM 7153 O WAT 4369 113.717 88.719 152.635 1.00 0.00 O ATOM 7154 H1 WAT 4369 112.771 88.572 152.617 1.00 0.00 H ATOM 7155 H2 WAT 4369 113.901 89.192 151.824 1.00 0.00 H TER 7157 WAT 4369 ATOM 7157 O WAT 4370 78.177 135.676 94.644 1.00 0.00 O ATOM 7158 H1 WAT 4370 78.445 135.243 95.454 1.00 0.00 H ATOM 7159 H2 WAT 4370 77.226 135.758 94.718 1.00 0.00 H TER 7161 WAT 4370 ATOM 7161 O WAT 4371 113.688 37.083 67.157 1.00 0.00 O ATOM 7162 H1 WAT 4371 114.158 37.600 66.503 1.00 0.00 H ATOM 7163 H2 WAT 4371 114.378 36.667 67.674 1.00 0.00 H TER 7165 WAT 4371 ATOM 7165 O WAT 4372 7.891 89.409 9.283 1.00 0.00 O ATOM 7166 H1 WAT 4372 7.486 88.681 9.755 1.00 0.00 H ATOM 7167 H2 WAT 4372 8.641 89.657 9.823 1.00 0.00 H TER 7169 WAT 4372 ATOM 7169 O WAT 4373 7.446 125.731 98.254 1.00 0.00 O ATOM 7170 H1 WAT 4373 7.709 124.890 98.630 1.00 0.00 H ATOM 7171 H2 WAT 4373 6.564 125.577 97.917 1.00 0.00 H TER 7173 WAT 4373 ATOM 7173 O WAT 4374 74.422 118.425 105.868 1.00 0.00 O ATOM 7174 H1 WAT 4374 74.759 119.309 105.721 1.00 0.00 H ATOM 7175 H2 WAT 4374 73.565 118.422 105.443 1.00 0.00 H TER 7177 WAT 4374 ATOM 7177 O WAT 4375 76.098 15.202 58.244 1.00 0.00 O ATOM 7178 H1 WAT 4375 75.326 14.954 57.736 1.00 0.00 H ATOM 7179 H2 WAT 4375 76.411 16.005 57.828 1.00 0.00 H TER 7181 WAT 4375 ATOM 7181 O WAT 4376 67.784 108.408 125.990 1.00 0.00 O ATOM 7182 H1 WAT 4376 67.508 107.492 126.027 1.00 0.00 H ATOM 7183 H2 WAT 4376 67.771 108.699 126.902 1.00 0.00 H TER 7185 WAT 4376 ATOM 7185 O WAT 4377 3.713 116.077 112.951 1.00 0.00 O ATOM 7186 H1 WAT 4377 3.771 117.003 113.187 1.00 0.00 H ATOM 7187 H2 WAT 4377 4.250 115.997 112.162 1.00 0.00 H TER 7189 WAT 4377 ATOM 7189 O WAT 4378 116.625 94.855 0.965 1.00 0.00 O ATOM 7190 H1 WAT 4378 116.221 94.953 0.103 1.00 0.00 H ATOM 7191 H2 WAT 4378 116.282 94.025 1.297 1.00 0.00 H TER 7193 WAT 4378 ATOM 7193 O WAT 4379 82.328 9.992 89.904 1.00 0.00 O ATOM 7194 H1 WAT 4379 82.013 10.749 89.410 1.00 0.00 H ATOM 7195 H2 WAT 4379 82.471 9.316 89.241 1.00 0.00 H TER 7197 WAT 4379 ATOM 7197 O WAT 4380 119.574 134.203 21.125 1.00 0.00 O ATOM 7198 H1 WAT 4380 118.657 133.932 21.074 1.00 0.00 H ATOM 7199 H2 WAT 4380 119.789 134.147 22.056 1.00 0.00 H TER 7201 WAT 4380 ATOM 7201 O WAT 4381 125.367 97.364 107.658 1.00 0.00 O ATOM 7202 H1 WAT 4381 126.041 97.164 107.009 1.00 0.00 H ATOM 7203 H2 WAT 4381 124.764 97.953 107.203 1.00 0.00 H TER 7205 WAT 4381 ATOM 7205 O WAT 4382 78.384 56.932 11.188 1.00 0.00 O ATOM 7206 H1 WAT 4382 78.221 56.014 10.970 1.00 0.00 H ATOM 7207 H2 WAT 4382 78.813 56.902 12.043 1.00 0.00 H TER 7209 WAT 4382 ATOM 7209 O WAT 4383 111.219 97.060 131.695 1.00 0.00 O ATOM 7210 H1 WAT 4383 110.669 97.800 131.439 1.00 0.00 H ATOM 7211 H2 WAT 4383 110.629 96.476 132.171 1.00 0.00 H TER 7213 WAT 4383 ATOM 7213 O WAT 4384 96.320 27.665 8.569 1.00 0.00 O ATOM 7214 H1 WAT 4384 95.800 27.595 7.769 1.00 0.00 H ATOM 7215 H2 WAT 4384 96.983 28.326 8.367 1.00 0.00 H TER 7217 WAT 4384 ATOM 7217 O WAT 4385 123.428 136.051 14.189 1.00 0.00 O ATOM 7218 H1 WAT 4385 123.278 135.361 14.835 1.00 0.00 H ATOM 7219 H2 WAT 4385 122.781 136.724 14.404 1.00 0.00 H TER 7221 WAT 4385 ATOM 7221 O WAT 4386 8.927 65.602 12.979 1.00 0.00 O ATOM 7222 H1 WAT 4386 8.472 65.783 12.157 1.00 0.00 H ATOM 7223 H2 WAT 4386 9.367 64.765 12.830 1.00 0.00 H TER 7225 WAT 4386 ATOM 7225 O WAT 4387 76.319 59.947 143.590 1.00 0.00 O ATOM 7226 H1 WAT 4387 77.140 60.035 143.106 1.00 0.00 H ATOM 7227 H2 WAT 4387 75.722 59.521 142.974 1.00 0.00 H TER 7229 WAT 4387 ATOM 7229 O WAT 4388 44.860 143.039 16.367 1.00 0.00 O ATOM 7230 H1 WAT 4388 45.370 142.874 17.160 1.00 0.00 H ATOM 7231 H2 WAT 4388 44.184 142.361 16.371 1.00 0.00 H TER 7233 WAT 4388 ATOM 7233 O WAT 4389 120.427 117.125 72.760 1.00 0.00 O ATOM 7234 H1 WAT 4389 120.099 117.679 73.469 1.00 0.00 H ATOM 7235 H2 WAT 4389 119.925 116.314 72.840 1.00 0.00 H TER 7237 WAT 4389 ATOM 7237 O WAT 4390 77.055 5.079 69.472 1.00 0.00 O ATOM 7238 H1 WAT 4390 76.483 4.361 69.743 1.00 0.00 H ATOM 7239 H2 WAT 4390 76.554 5.546 68.803 1.00 0.00 H TER 7241 WAT 4390 ATOM 7241 O WAT 4391 97.696 141.395 124.486 1.00 0.00 O ATOM 7242 H1 WAT 4391 98.634 141.506 124.332 1.00 0.00 H ATOM 7243 H2 WAT 4391 97.614 140.510 124.841 1.00 0.00 H TER 7245 WAT 4391 ATOM 7245 O WAT 4392 18.876 124.745 115.837 1.00 0.00 O ATOM 7246 H1 WAT 4392 18.611 123.828 115.911 1.00 0.00 H ATOM 7247 H2 WAT 4392 19.447 124.768 115.069 1.00 0.00 H TER 7249 WAT 4392 ATOM 7249 O WAT 4393 79.634 82.636 106.113 1.00 0.00 O ATOM 7250 H1 WAT 4393 78.789 82.386 106.487 1.00 0.00 H ATOM 7251 H2 WAT 4393 79.442 82.826 105.194 1.00 0.00 H TER 7253 WAT 4393 ATOM 7253 O WAT 4394 63.706 87.409 122.726 1.00 0.00 O ATOM 7254 H1 WAT 4394 64.564 87.822 122.630 1.00 0.00 H ATOM 7255 H2 WAT 4394 63.229 87.985 123.323 1.00 0.00 H TER 7257 WAT 4394 ATOM 7257 O WAT 4395 56.622 70.003 110.685 1.00 0.00 O ATOM 7258 H1 WAT 4395 56.808 70.503 109.890 1.00 0.00 H ATOM 7259 H2 WAT 4395 56.623 70.656 111.385 1.00 0.00 H TER 7261 WAT 4395 ATOM 7261 O WAT 4396 60.601 116.523 128.845 1.00 0.00 O ATOM 7262 H1 WAT 4396 61.553 116.491 128.757 1.00 0.00 H ATOM 7263 H2 WAT 4396 60.332 115.605 128.873 1.00 0.00 H TER 7265 WAT 4396 ATOM 7265 O WAT 4397 113.919 69.647 103.498 1.00 0.00 O ATOM 7266 H1 WAT 4397 114.577 70.222 103.107 1.00 0.00 H ATOM 7267 H2 WAT 4397 114.203 69.541 104.406 1.00 0.00 H TER 7269 WAT 4397 ATOM 7269 O WAT 4398 41.415 143.785 59.296 1.00 0.00 O ATOM 7270 H1 WAT 4398 41.471 144.664 58.921 1.00 0.00 H ATOM 7271 H2 WAT 4398 41.081 143.241 58.583 1.00 0.00 H TER 7273 WAT 4398 ATOM 7273 O WAT 4399 96.933 62.652 152.972 1.00 0.00 O ATOM 7274 H1 WAT 4399 97.335 62.916 152.145 1.00 0.00 H ATOM 7275 H2 WAT 4399 97.666 62.353 153.510 1.00 0.00 H TER 7277 WAT 4399 ATOM 7277 O WAT 4400 143.340 126.146 107.573 1.00 0.00 O ATOM 7278 H1 WAT 4400 142.724 126.857 107.751 1.00 0.00 H ATOM 7279 H2 WAT 4400 144.204 126.548 107.667 1.00 0.00 H TER 7281 WAT 4400 ATOM 7281 O WAT 4401 113.088 36.426 153.517 1.00 0.00 O ATOM 7282 H1 WAT 4401 112.260 35.964 153.642 1.00 0.00 H ATOM 7283 H2 WAT 4401 113.012 36.824 152.649 1.00 0.00 H TER 7285 WAT 4401 ATOM 7285 O WAT 4402 99.200 61.851 9.242 1.00 0.00 O ATOM 7286 H1 WAT 4402 99.709 61.701 8.445 1.00 0.00 H ATOM 7287 H2 WAT 4402 99.857 61.982 9.925 1.00 0.00 H TER 7289 WAT 4402 ATOM 7289 O WAT 4403 15.058 105.556 77.761 1.00 0.00 O ATOM 7290 H1 WAT 4403 15.465 104.845 78.257 1.00 0.00 H ATOM 7291 H2 WAT 4403 15.555 105.593 76.944 1.00 0.00 H TER 7293 WAT 4403 ATOM 7293 O WAT 4404 113.845 70.952 148.212 1.00 0.00 O ATOM 7294 H1 WAT 4404 113.637 71.886 148.196 1.00 0.00 H ATOM 7295 H2 WAT 4404 114.723 70.895 147.836 1.00 0.00 H TER 7297 WAT 4404 ATOM 7297 O WAT 4405 84.660 10.356 135.731 1.00 0.00 O ATOM 7298 H1 WAT 4405 84.395 11.276 135.716 1.00 0.00 H ATOM 7299 H2 WAT 4405 85.601 10.381 135.906 1.00 0.00 H TER 7301 WAT 4405 ATOM 7301 O WAT 4406 83.422 133.221 154.738 1.00 0.00 O ATOM 7302 H1 WAT 4406 82.655 132.662 154.866 1.00 0.00 H ATOM 7303 H2 WAT 4406 83.516 133.692 155.566 1.00 0.00 H TER 7305 WAT 4406 ATOM 7305 O WAT 4407 18.754 106.852 108.609 1.00 0.00 O ATOM 7306 H1 WAT 4407 18.812 107.285 107.757 1.00 0.00 H ATOM 7307 H2 WAT 4407 17.815 106.780 108.778 1.00 0.00 H TER 7309 WAT 4407 ATOM 7309 O WAT 4408 22.209 50.788 120.303 1.00 0.00 O ATOM 7310 H1 WAT 4408 22.549 51.300 119.570 1.00 0.00 H ATOM 7311 H2 WAT 4408 22.932 50.761 120.931 1.00 0.00 H TER 7313 WAT 4408 ATOM 7313 O WAT 4409 114.175 60.215 11.532 1.00 0.00 O ATOM 7314 H1 WAT 4409 115.099 60.459 11.582 1.00 0.00 H ATOM 7315 H2 WAT 4409 113.763 60.685 12.257 1.00 0.00 H TER 7317 WAT 4409 ATOM 7317 O WAT 4410 62.055 42.361 114.009 1.00 0.00 O ATOM 7318 H1 WAT 4410 62.184 42.134 114.930 1.00 0.00 H ATOM 7319 H2 WAT 4410 62.123 41.526 113.546 1.00 0.00 H TER 7321 WAT 4410 ATOM 7321 O WAT 4411 88.663 64.381 13.503 1.00 0.00 O ATOM 7322 H1 WAT 4411 88.473 63.701 14.149 1.00 0.00 H ATOM 7323 H2 WAT 4411 87.803 64.653 13.183 1.00 0.00 H TER 7325 WAT 4411 ATOM 7325 O WAT 4412 7.819 131.283 12.992 1.00 0.00 O ATOM 7326 H1 WAT 4412 6.880 131.347 13.164 1.00 0.00 H ATOM 7327 H2 WAT 4412 8.065 132.153 12.680 1.00 0.00 H TER 7329 WAT 4412 ATOM 7329 O WAT 4413 10.936 103.179 93.222 1.00 0.00 O ATOM 7330 H1 WAT 4413 11.491 103.869 93.586 1.00 0.00 H ATOM 7331 H2 WAT 4413 10.042 103.477 93.391 1.00 0.00 H TER 7333 WAT 4413 ATOM 7333 O WAT 4414 78.404 9.024 61.565 1.00 0.00 O ATOM 7334 H1 WAT 4414 78.434 8.120 61.252 1.00 0.00 H ATOM 7335 H2 WAT 4414 79.275 9.373 61.372 1.00 0.00 H TER 7337 WAT 4414 ATOM 7337 O WAT 4415 56.200 43.058 105.248 1.00 0.00 O ATOM 7338 H1 WAT 4415 56.257 43.452 106.118 1.00 0.00 H ATOM 7339 H2 WAT 4415 56.435 42.140 105.385 1.00 0.00 H TER 7341 WAT 4415 ATOM 7341 O WAT 4416 119.237 106.010 135.567 1.00 0.00 O ATOM 7342 H1 WAT 4416 119.495 105.089 135.597 1.00 0.00 H ATOM 7343 H2 WAT 4416 119.829 106.404 134.925 1.00 0.00 H TER 7345 WAT 4416 ATOM 7345 O WAT 4417 39.399 81.969 109.995 1.00 0.00 O ATOM 7346 H1 WAT 4417 39.038 81.578 109.199 1.00 0.00 H ATOM 7347 H2 WAT 4417 38.634 82.286 110.474 1.00 0.00 H TER 7349 WAT 4417 ATOM 7349 O WAT 4418 110.624 23.205 85.458 1.00 0.00 O ATOM 7350 H1 WAT 4418 111.150 22.891 84.723 1.00 0.00 H ATOM 7351 H2 WAT 4418 110.505 24.139 85.286 1.00 0.00 H TER 7353 WAT 4418 ATOM 7353 O WAT 4419 52.459 5.054 68.907 1.00 0.00 O ATOM 7354 H1 WAT 4419 51.678 4.674 68.505 1.00 0.00 H ATOM 7355 H2 WAT 4419 52.506 4.645 69.771 1.00 0.00 H TER 7357 WAT 4419 ATOM 7357 O WAT 4420 57.462 109.747 116.574 1.00 0.00 O ATOM 7358 H1 WAT 4420 58.013 108.983 116.405 1.00 0.00 H ATOM 7359 H2 WAT 4420 56.611 109.380 116.814 1.00 0.00 H TER 7361 WAT 4420 ATOM 7361 O WAT 4421 62.024 126.590 156.465 1.00 0.00 O ATOM 7362 H1 WAT 4421 62.393 127.303 156.987 1.00 0.00 H ATOM 7363 H2 WAT 4421 61.213 126.357 156.917 1.00 0.00 H TER 7365 WAT 4421 ATOM 7365 O WAT 4422 79.506 52.336 139.116 1.00 0.00 O ATOM 7366 H1 WAT 4422 79.072 52.332 139.969 1.00 0.00 H ATOM 7367 H2 WAT 4422 79.105 53.068 138.647 1.00 0.00 H TER 7369 WAT 4422 ATOM 7369 O WAT 4423 66.393 117.300 91.531 1.00 0.00 O ATOM 7370 H1 WAT 4423 66.149 118.105 91.987 1.00 0.00 H ATOM 7371 H2 WAT 4423 67.152 117.545 91.001 1.00 0.00 H TER 7373 WAT 4423 ATOM 7373 O WAT 4424 110.809 68.135 152.758 1.00 0.00 O ATOM 7374 H1 WAT 4424 111.716 68.423 152.861 1.00 0.00 H ATOM 7375 H2 WAT 4424 110.635 68.224 151.821 1.00 0.00 H TER 7377 WAT 4424 ATOM 7377 O WAT 4425 15.233 30.957 61.829 1.00 0.00 O ATOM 7378 H1 WAT 4425 15.082 31.817 61.436 1.00 0.00 H ATOM 7379 H2 WAT 4425 16.004 30.618 61.374 1.00 0.00 H TER 7381 WAT 4425 ATOM 7381 O WAT 4426 94.890 45.304 155.855 1.00 0.00 O ATOM 7382 H1 WAT 4426 94.776 45.000 156.755 1.00 0.00 H ATOM 7383 H2 WAT 4426 94.009 45.546 155.570 1.00 0.00 H TER 7385 WAT 4426 ATOM 7385 O WAT 4427 72.921 40.961 141.397 1.00 0.00 O ATOM 7386 H1 WAT 4427 72.447 40.979 140.566 1.00 0.00 H ATOM 7387 H2 WAT 4427 72.508 41.647 141.923 1.00 0.00 H TER 7389 WAT 4427 ATOM 7389 O WAT 4428 133.144 79.796 14.970 1.00 0.00 O ATOM 7390 H1 WAT 4428 133.113 78.841 15.037 1.00 0.00 H ATOM 7391 H2 WAT 4428 134.007 80.032 15.312 1.00 0.00 H TER 7393 WAT 4428 ATOM 7393 O WAT 4429 88.279 102.612 18.179 1.00 0.00 O ATOM 7394 H1 WAT 4429 87.568 102.197 18.668 1.00 0.00 H ATOM 7395 H2 WAT 4429 88.537 103.359 18.719 1.00 0.00 H TER 7397 WAT 4429 ATOM 7397 O WAT 4430 52.271 139.770 107.920 1.00 0.00 O ATOM 7398 H1 WAT 4430 52.472 140.547 108.442 1.00 0.00 H ATOM 7399 H2 WAT 4430 51.315 139.731 107.905 1.00 0.00 H TER 7401 WAT 4430 ATOM 7401 O WAT 4431 31.713 17.017 77.222 1.00 0.00 O ATOM 7402 H1 WAT 4431 32.499 17.229 76.718 1.00 0.00 H ATOM 7403 H2 WAT 4431 31.737 17.616 77.967 1.00 0.00 H TER 7405 WAT 4431 ATOM 7405 O WAT 4432 120.053 18.985 15.184 1.00 0.00 O ATOM 7406 H1 WAT 4432 120.066 19.772 15.729 1.00 0.00 H ATOM 7407 H2 WAT 4432 120.970 18.840 14.952 1.00 0.00 H TER 7409 WAT 4432 ATOM 7409 O WAT 4433 138.702 49.924 68.903 1.00 0.00 O ATOM 7410 H1 WAT 4433 138.345 49.732 68.035 1.00 0.00 H ATOM 7411 H2 WAT 4433 139.545 50.342 68.728 1.00 0.00 H TER 7413 WAT 4433 ATOM 7413 O WAT 4434 24.604 76.467 118.250 1.00 0.00 O ATOM 7414 H1 WAT 4434 23.721 76.125 118.114 1.00 0.00 H ATOM 7415 H2 WAT 4434 24.487 77.196 118.861 1.00 0.00 H TER 7417 WAT 4434 ATOM 7417 O WAT 4435 81.576 88.692 74.637 1.00 0.00 O ATOM 7418 H1 WAT 4435 81.575 88.137 75.417 1.00 0.00 H ATOM 7419 H2 WAT 4435 81.802 88.098 73.921 1.00 0.00 H TER 7421 WAT 4435 ATOM 7421 O WAT 4436 119.213 122.926 74.105 1.00 0.00 O ATOM 7422 H1 WAT 4436 119.179 123.846 73.843 1.00 0.00 H ATOM 7423 H2 WAT 4436 119.565 122.943 74.995 1.00 0.00 H TER 7425 WAT 4436 ATOM 7425 O WAT 4437 96.076 35.263 150.174 1.00 0.00 O ATOM 7426 H1 WAT 4437 95.441 35.840 150.597 1.00 0.00 H ATOM 7427 H2 WAT 4437 95.996 34.433 150.643 1.00 0.00 H TER 7429 WAT 4437 ATOM 7429 O WAT 4438 123.205 35.341 155.241 1.00 0.00 O ATOM 7430 H1 WAT 4438 122.403 35.508 154.745 1.00 0.00 H ATOM 7431 H2 WAT 4438 123.589 36.207 155.375 1.00 0.00 H TER 7433 WAT 4438 ATOM 7433 O WAT 4439 144.760 66.573 56.307 1.00 0.00 O ATOM 7434 H1 WAT 4439 145.527 66.376 56.845 1.00 0.00 H ATOM 7435 H2 WAT 4439 145.112 66.692 55.424 1.00 0.00 H TER 7437 WAT 4439 ATOM 7437 O WAT 4440 132.089 130.954 78.804 1.00 0.00 O ATOM 7438 H1 WAT 4440 131.496 131.697 78.920 1.00 0.00 H ATOM 7439 H2 WAT 4440 131.589 130.328 78.281 1.00 0.00 H TER 7441 WAT 4440 ATOM 7441 O WAT 4441 4.815 86.214 123.364 1.00 0.00 O ATOM 7442 H1 WAT 4441 4.119 85.666 123.003 1.00 0.00 H ATOM 7443 H2 WAT 4441 4.741 87.041 122.887 1.00 0.00 H TER 7445 WAT 4441 ATOM 7445 O WAT 4442 117.396 43.006 78.331 1.00 0.00 O ATOM 7446 H1 WAT 4442 118.344 43.073 78.446 1.00 0.00 H ATOM 7447 H2 WAT 4442 117.287 42.680 77.437 1.00 0.00 H TER 7449 WAT 4442 ATOM 7449 O WAT 4443 86.382 24.259 153.473 1.00 0.00 O ATOM 7450 H1 WAT 4443 86.787 25.126 153.467 1.00 0.00 H ATOM 7451 H2 WAT 4443 86.962 23.728 154.019 1.00 0.00 H TER 7453 WAT 4443 ATOM 7453 O WAT 4444 93.864 122.448 19.304 1.00 0.00 O ATOM 7454 H1 WAT 4444 93.004 122.670 19.661 1.00 0.00 H ATOM 7455 H2 WAT 4444 94.322 123.286 19.244 1.00 0.00 H TER 7457 WAT 4444 ATOM 7457 O WAT 4445 123.982 134.635 128.817 1.00 0.00 O ATOM 7458 H1 WAT 4445 123.027 134.707 128.829 1.00 0.00 H ATOM 7459 H2 WAT 4445 124.273 135.391 128.308 1.00 0.00 H TER 7461 WAT 4445 ATOM 7461 O WAT 4446 55.951 125.633 3.476 1.00 0.00 O ATOM 7462 H1 WAT 4446 56.639 126.074 3.975 1.00 0.00 H ATOM 7463 H2 WAT 4446 56.308 124.764 3.293 1.00 0.00 H TER 7465 WAT 4446 ATOM 7465 O WAT 4447 91.095 144.186 3.047 1.00 0.00 O ATOM 7466 H1 WAT 4447 90.236 143.779 2.937 1.00 0.00 H ATOM 7467 H2 WAT 4447 91.000 144.741 3.821 1.00 0.00 H TER 7469 WAT 4447 ATOM 7469 O WAT 4448 82.241 4.479 105.124 1.00 0.00 O ATOM 7470 H1 WAT 4448 81.916 5.174 104.551 1.00 0.00 H ATOM 7471 H2 WAT 4448 81.911 3.671 104.731 1.00 0.00 H TER 7473 WAT 4448 ATOM 7473 O WAT 4449 117.530 39.095 57.581 1.00 0.00 O ATOM 7474 H1 WAT 4449 118.302 38.603 57.300 1.00 0.00 H ATOM 7475 H2 WAT 4449 117.175 39.465 56.773 1.00 0.00 H TER 7477 WAT 4449 ATOM 7477 O WAT 4450 39.191 29.562 112.275 1.00 0.00 O ATOM 7478 H1 WAT 4450 38.833 29.991 113.051 1.00 0.00 H ATOM 7479 H2 WAT 4450 39.066 30.198 111.570 1.00 0.00 H TER 7481 WAT 4450 ATOM 7481 O WAT 4451 18.503 124.398 5.717 1.00 0.00 O ATOM 7482 H1 WAT 4451 19.078 124.611 6.452 1.00 0.00 H ATOM 7483 H2 WAT 4451 18.959 123.695 5.253 1.00 0.00 H TER 7485 WAT 4451 ATOM 7485 O WAT 4452 107.644 65.391 102.201 1.00 0.00 O ATOM 7486 H1 WAT 4452 108.578 65.184 102.235 1.00 0.00 H ATOM 7487 H2 WAT 4452 107.597 66.323 102.414 1.00 0.00 H TER 7489 WAT 4452 ATOM 7489 O WAT 4453 73.986 126.738 77.706 1.00 0.00 O ATOM 7490 H1 WAT 4453 73.889 125.872 78.101 1.00 0.00 H ATOM 7491 H2 WAT 4453 74.077 126.565 76.769 1.00 0.00 H TER 7493 WAT 4453 ATOM 7493 O WAT 4454 124.462 136.949 91.379 1.00 0.00 O ATOM 7494 H1 WAT 4454 124.092 136.157 91.769 1.00 0.00 H ATOM 7495 H2 WAT 4454 125.396 136.905 91.587 1.00 0.00 H TER 7497 WAT 4454 ATOM 7497 O WAT 4455 52.832 124.595 103.805 1.00 0.00 O ATOM 7498 H1 WAT 4455 53.065 124.970 104.655 1.00 0.00 H ATOM 7499 H2 WAT 4455 53.063 125.276 103.172 1.00 0.00 H TER 7501 WAT 4455 ATOM 7501 O WAT 4456 23.531 122.299 145.350 1.00 0.00 O ATOM 7502 H1 WAT 4456 23.323 122.029 144.456 1.00 0.00 H ATOM 7503 H2 WAT 4456 23.288 121.547 145.890 1.00 0.00 H TER 7505 WAT 4456 ATOM 7505 O WAT 4457 79.791 88.003 21.248 1.00 0.00 O ATOM 7506 H1 WAT 4457 80.339 88.783 21.341 1.00 0.00 H ATOM 7507 H2 WAT 4457 79.879 87.548 22.085 1.00 0.00 H TER 7509 WAT 4457 ATOM 7509 O WAT 4458 76.039 51.860 139.502 1.00 0.00 O ATOM 7510 H1 WAT 4458 75.725 52.732 139.262 1.00 0.00 H ATOM 7511 H2 WAT 4458 76.648 52.015 140.224 1.00 0.00 H TER 7513 WAT 4458 ATOM 7513 O WAT 4459 112.903 7.560 77.170 1.00 0.00 O ATOM 7514 H1 WAT 4459 113.084 8.377 77.635 1.00 0.00 H ATOM 7515 H2 WAT 4459 113.730 7.339 76.742 1.00 0.00 H TER 7517 WAT 4459 ATOM 7517 O WAT 4460 130.816 92.898 91.624 1.00 0.00 O ATOM 7518 H1 WAT 4460 130.028 92.356 91.621 1.00 0.00 H ATOM 7519 H2 WAT 4460 131.203 92.764 90.759 1.00 0.00 H TER 7521 WAT 4460 ATOM 7521 O WAT 4461 38.146 138.811 14.148 1.00 0.00 O ATOM 7522 H1 WAT 4461 38.541 138.025 14.525 1.00 0.00 H ATOM 7523 H2 WAT 4461 37.791 139.284 14.900 1.00 0.00 H TER 7525 WAT 4461 ATOM 7525 O WAT 4462 88.910 96.847 59.845 1.00 0.00 O ATOM 7526 H1 WAT 4462 88.215 97.486 60.005 1.00 0.00 H ATOM 7527 H2 WAT 4462 89.716 97.304 60.085 1.00 0.00 H TER 7529 WAT 4462 ATOM 7529 O WAT 4463 99.540 84.869 128.684 1.00 0.00 O ATOM 7530 H1 WAT 4463 99.673 83.967 128.976 1.00 0.00 H ATOM 7531 H2 WAT 4463 99.170 85.315 129.446 1.00 0.00 H TER 7533 WAT 4463 ATOM 7533 O WAT 4464 58.224 131.606 60.883 1.00 0.00 O ATOM 7534 H1 WAT 4464 58.636 132.439 61.111 1.00 0.00 H ATOM 7535 H2 WAT 4464 57.319 131.836 60.673 1.00 0.00 H TER 7537 WAT 4464 ATOM 7537 O WAT 4465 110.256 78.131 109.117 1.00 0.00 O ATOM 7538 H1 WAT 4465 109.406 77.692 109.095 1.00 0.00 H ATOM 7539 H2 WAT 4465 110.418 78.386 108.209 1.00 0.00 H TER 7541 WAT 4465 ATOM 7541 O WAT 4466 113.302 42.108 122.500 1.00 0.00 O ATOM 7542 H1 WAT 4466 112.671 42.176 121.783 1.00 0.00 H ATOM 7543 H2 WAT 4466 114.149 42.017 122.065 1.00 0.00 H TER 7545 WAT 4466 ATOM 7545 O WAT 4467 47.718 123.485 111.786 1.00 0.00 O ATOM 7546 H1 WAT 4467 47.760 123.741 110.865 1.00 0.00 H ATOM 7547 H2 WAT 4467 48.624 123.279 112.019 1.00 0.00 H TER 7549 WAT 4467 ATOM 7549 O WAT 4468 118.281 121.217 144.595 1.00 0.00 O ATOM 7550 H1 WAT 4468 117.713 120.820 143.935 1.00 0.00 H ATOM 7551 H2 WAT 4468 117.778 121.162 145.407 1.00 0.00 H TER 7553 WAT 4468 ATOM 7553 O WAT 4469 37.000 85.201 12.957 1.00 0.00 O ATOM 7554 H1 WAT 4469 37.031 85.985 13.504 1.00 0.00 H ATOM 7555 H2 WAT 4469 36.133 85.225 12.552 1.00 0.00 H TER 7557 WAT 4469 ATOM 7557 O WAT 4470 102.478 53.515 78.350 1.00 0.00 O ATOM 7558 H1 WAT 4470 102.369 52.567 78.276 1.00 0.00 H ATOM 7559 H2 WAT 4470 101.691 53.879 77.946 1.00 0.00 H TER 7561 WAT 4470 ATOM 7561 O WAT 4471 142.899 130.998 130.938 1.00 0.00 O ATOM 7562 H1 WAT 4471 143.082 131.132 131.869 1.00 0.00 H ATOM 7563 H2 WAT 4471 142.462 131.804 130.662 1.00 0.00 H TER 7565 WAT 4471 ATOM 7565 O WAT 4472 44.184 7.857 3.330 1.00 0.00 O ATOM 7566 H1 WAT 4472 43.577 7.210 2.972 1.00 0.00 H ATOM 7567 H2 WAT 4472 43.627 8.590 3.591 1.00 0.00 H TER 7569 WAT 4472 ATOM 7569 O WAT 4473 127.693 30.187 135.427 1.00 0.00 O ATOM 7570 H1 WAT 4473 127.733 30.993 135.942 1.00 0.00 H ATOM 7571 H2 WAT 4473 128.554 29.785 135.543 1.00 0.00 H TER 7573 WAT 4473 ATOM 7573 O WAT 4474 105.605 121.201 114.782 1.00 0.00 O ATOM 7574 H1 WAT 4474 104.658 121.185 114.642 1.00 0.00 H ATOM 7575 H2 WAT 4474 105.777 122.066 115.155 1.00 0.00 H TER 7577 WAT 4474 ATOM 7577 O WAT 4475 108.163 75.821 75.477 1.00 0.00 O ATOM 7578 H1 WAT 4475 108.903 76.390 75.266 1.00 0.00 H ATOM 7579 H2 WAT 4475 108.532 75.155 76.058 1.00 0.00 H TER 7581 WAT 4475 ATOM 7581 O WAT 4476 28.078 110.560 114.541 1.00 0.00 O ATOM 7582 H1 WAT 4476 27.445 111.218 114.829 1.00 0.00 H ATOM 7583 H2 WAT 4476 27.695 110.190 113.746 1.00 0.00 H TER 7585 WAT 4476 ATOM 7585 O WAT 4477 120.829 94.649 106.072 1.00 0.00 O ATOM 7586 H1 WAT 4477 121.261 94.770 106.918 1.00 0.00 H ATOM 7587 H2 WAT 4477 121.546 94.505 105.455 1.00 0.00 H TER 7589 WAT 4477 ATOM 7589 O WAT 4478 127.570 82.821 69.069 1.00 0.00 O ATOM 7590 H1 WAT 4478 128.415 83.185 69.332 1.00 0.00 H ATOM 7591 H2 WAT 4478 127.720 82.477 68.188 1.00 0.00 H TER 7593 WAT 4478 ATOM 7593 O WAT 4479 5.209 56.198 65.658 1.00 0.00 O ATOM 7594 H1 WAT 4479 5.765 55.992 64.906 1.00 0.00 H ATOM 7595 H2 WAT 4479 4.763 55.375 65.858 1.00 0.00 H TER 7597 WAT 4479 ATOM 7597 O WAT 4480 101.848 72.373 80.798 1.00 0.00 O ATOM 7598 H1 WAT 4480 101.344 73.023 81.287 1.00 0.00 H ATOM 7599 H2 WAT 4480 101.477 71.532 81.066 1.00 0.00 H TER 7601 WAT 4480 ATOM 7601 O WAT 4481 63.740 76.869 115.668 1.00 0.00 O ATOM 7602 H1 WAT 4481 63.307 77.237 114.898 1.00 0.00 H ATOM 7603 H2 WAT 4481 64.204 76.100 115.336 1.00 0.00 H TER 7605 WAT 4481 ATOM 7605 O WAT 4482 109.719 47.589 120.438 1.00 0.00 O ATOM 7606 H1 WAT 4482 110.135 47.827 121.267 1.00 0.00 H ATOM 7607 H2 WAT 4482 108.864 48.019 120.467 1.00 0.00 H TER 7609 WAT 4482 ATOM 7609 O WAT 4483 80.213 122.687 20.274 1.00 0.00 O ATOM 7610 H1 WAT 4483 79.778 123.268 20.898 1.00 0.00 H ATOM 7611 H2 WAT 4483 80.857 122.211 20.798 1.00 0.00 H TER 7613 WAT 4483 ATOM 7613 O WAT 4484 58.196 59.784 138.333 1.00 0.00 O ATOM 7614 H1 WAT 4484 58.314 60.683 138.025 1.00 0.00 H ATOM 7615 H2 WAT 4484 58.882 59.286 137.889 1.00 0.00 H TER 7617 WAT 4484 ATOM 7617 O WAT 4485 31.270 138.457 154.621 1.00 0.00 O ATOM 7618 H1 WAT 4485 30.800 138.776 155.391 1.00 0.00 H ATOM 7619 H2 WAT 4485 31.590 139.250 154.191 1.00 0.00 H TER 7621 WAT 4485 ATOM 7621 O WAT 4486 25.372 92.560 81.933 1.00 0.00 O ATOM 7622 H1 WAT 4486 25.462 91.608 81.976 1.00 0.00 H ATOM 7623 H2 WAT 4486 24.436 92.718 82.052 1.00 0.00 H TER 7625 WAT 4486 ATOM 7625 O WAT 4487 22.073 58.413 65.574 1.00 0.00 O ATOM 7626 H1 WAT 4487 21.394 57.965 65.069 1.00 0.00 H ATOM 7627 H2 WAT 4487 21.723 59.293 65.718 1.00 0.00 H TER 7629 WAT 4487 ATOM 7629 O WAT 4488 139.716 11.523 15.317 1.00 0.00 O ATOM 7630 H1 WAT 4488 140.469 12.106 15.219 1.00 0.00 H ATOM 7631 H2 WAT 4488 139.217 11.897 16.044 1.00 0.00 H TER 7633 WAT 4488 ATOM 7633 O WAT 4489 116.048 32.568 71.211 1.00 0.00 O ATOM 7634 H1 WAT 4489 116.746 32.032 71.587 1.00 0.00 H ATOM 7635 H2 WAT 4489 116.231 32.575 70.271 1.00 0.00 H TER 7637 WAT 4489 ATOM 7637 O WAT 4490 45.594 7.659 6.858 1.00 0.00 O ATOM 7638 H1 WAT 4490 44.799 8.192 6.884 1.00 0.00 H ATOM 7639 H2 WAT 4490 46.291 8.279 6.645 1.00 0.00 H TER 7641 WAT 4490 ATOM 7641 O WAT 4491 107.569 62.078 132.741 1.00 0.00 O ATOM 7642 H1 WAT 4491 107.664 61.823 133.659 1.00 0.00 H ATOM 7643 H2 WAT 4491 107.904 62.974 132.705 1.00 0.00 H TER 7645 WAT 4491 ATOM 7645 O WAT 4492 19.612 53.139 88.034 1.00 0.00 O ATOM 7646 H1 WAT 4492 18.891 53.663 88.384 1.00 0.00 H ATOM 7647 H2 WAT 4492 19.810 52.509 88.728 1.00 0.00 H TER 7649 WAT 4492 ATOM 7649 O WAT 4493 105.431 132.957 102.564 1.00 0.00 O ATOM 7650 H1 WAT 4493 106.251 132.794 103.029 1.00 0.00 H ATOM 7651 H2 WAT 4493 104.775 133.040 103.257 1.00 0.00 H TER 7653 WAT 4493 ATOM 7653 O WAT 4494 54.590 99.697 135.290 1.00 0.00 O ATOM 7654 H1 WAT 4494 54.770 100.139 136.119 1.00 0.00 H ATOM 7655 H2 WAT 4494 54.476 98.777 135.528 1.00 0.00 H TER 7657 WAT 4494 ATOM 7657 O WAT 4495 80.196 92.278 123.809 1.00 0.00 O ATOM 7658 H1 WAT 4495 80.417 92.715 124.632 1.00 0.00 H ATOM 7659 H2 WAT 4495 81.033 92.195 123.351 1.00 0.00 H TER 7661 WAT 4495 ATOM 7661 O WAT 4496 84.701 15.526 123.604 1.00 0.00 O ATOM 7662 H1 WAT 4496 83.790 15.752 123.792 1.00 0.00 H ATOM 7663 H2 WAT 4496 85.162 16.365 123.612 1.00 0.00 H TER 7665 WAT 4496 ATOM 7665 O WAT 4497 108.040 134.589 89.178 1.00 0.00 O ATOM 7666 H1 WAT 4497 107.486 134.565 88.398 1.00 0.00 H ATOM 7667 H2 WAT 4497 108.686 135.269 88.993 1.00 0.00 H TER 7669 WAT 4497 ATOM 7669 O WAT 4498 53.039 100.550 96.044 1.00 0.00 O ATOM 7670 H1 WAT 4498 52.515 101.340 95.913 1.00 0.00 H ATOM 7671 H2 WAT 4498 52.624 99.892 95.486 1.00 0.00 H TER 7673 WAT 4498 ATOM 7673 O WAT 4499 88.224 32.728 73.344 1.00 0.00 O ATOM 7674 H1 WAT 4499 88.138 31.778 73.421 1.00 0.00 H ATOM 7675 H2 WAT 4499 88.740 32.984 74.108 1.00 0.00 H TER 7677 WAT 4499 ATOM 7677 O WAT 4500 7.922 63.988 118.045 1.00 0.00 O ATOM 7678 H1 WAT 4500 8.176 63.066 118.082 1.00 0.00 H ATOM 7679 H2 WAT 4500 8.238 64.356 118.870 1.00 0.00 H TER 7681 WAT 4500 ATOM 7681 O WAT 4501 31.492 16.386 152.920 1.00 0.00 O ATOM 7682 H1 WAT 4501 31.591 17.228 153.364 1.00 0.00 H ATOM 7683 H2 WAT 4501 32.306 16.276 152.430 1.00 0.00 H TER 7685 WAT 4501 ATOM 7685 O WAT 4502 49.921 122.987 151.712 1.00 0.00 O ATOM 7686 H1 WAT 4502 49.305 122.616 151.080 1.00 0.00 H ATOM 7687 H2 WAT 4502 50.525 123.506 151.183 1.00 0.00 H TER 7689 WAT 4502 ATOM 7689 O WAT 4503 127.423 4.757 70.776 1.00 0.00 O ATOM 7690 H1 WAT 4503 126.565 5.100 70.527 1.00 0.00 H ATOM 7691 H2 WAT 4503 127.478 3.907 70.338 1.00 0.00 H TER 7693 WAT 4503 ATOM 7693 O WAT 4504 4.536 13.644 117.136 1.00 0.00 O ATOM 7694 H1 WAT 4504 4.587 12.897 117.732 1.00 0.00 H ATOM 7695 H2 WAT 4504 5.402 13.685 116.729 1.00 0.00 H TER 7697 WAT 4504 ATOM 7697 O WAT 4505 128.027 25.632 146.429 1.00 0.00 O ATOM 7698 H1 WAT 4505 128.661 26.281 146.736 1.00 0.00 H ATOM 7699 H2 WAT 4505 127.338 25.638 147.094 1.00 0.00 H TER 7701 WAT 4505 ATOM 7701 O WAT 4506 7.142 125.262 107.725 1.00 0.00 O ATOM 7702 H1 WAT 4506 6.516 125.923 107.429 1.00 0.00 H ATOM 7703 H2 WAT 4506 7.468 125.599 108.560 1.00 0.00 H TER 7705 WAT 4506 ATOM 7705 O WAT 4507 47.556 3.113 118.508 1.00 0.00 O ATOM 7706 H1 WAT 4507 47.897 3.821 119.056 1.00 0.00 H ATOM 7707 H2 WAT 4507 48.037 3.195 117.684 1.00 0.00 H TER 7709 WAT 4507 ATOM 7709 O WAT 4508 0.945 84.701 133.416 1.00 0.00 O ATOM 7710 H1 WAT 4508 1.248 85.431 132.877 1.00 0.00 H ATOM 7711 H2 WAT 4508 1.190 83.919 132.920 1.00 0.00 H TER 7713 WAT 4508 ATOM 7713 O WAT 4509 106.462 41.518 64.895 1.00 0.00 O ATOM 7714 H1 WAT 4509 106.820 41.218 65.731 1.00 0.00 H ATOM 7715 H2 WAT 4509 105.528 41.639 65.065 1.00 0.00 H TER 7717 WAT 4509 ATOM 7717 O WAT 4510 104.438 54.539 136.484 1.00 0.00 O ATOM 7718 H1 WAT 4510 104.763 55.074 135.760 1.00 0.00 H ATOM 7719 H2 WAT 4510 104.457 53.643 136.147 1.00 0.00 H TER 7721 WAT 4510 ATOM 7721 O WAT 4511 21.137 95.480 148.221 1.00 0.00 O ATOM 7722 H1 WAT 4511 21.859 95.344 147.607 1.00 0.00 H ATOM 7723 H2 WAT 4511 21.442 96.181 148.797 1.00 0.00 H TER 7725 WAT 4511 ATOM 7725 O WAT 4512 137.013 89.420 121.587 1.00 0.00 O ATOM 7726 H1 WAT 4512 136.869 88.618 121.086 1.00 0.00 H ATOM 7727 H2 WAT 4512 136.787 89.184 122.487 1.00 0.00 H TER 7729 WAT 4512 ATOM 7729 O WAT 4513 55.268 76.740 73.099 1.00 0.00 O ATOM 7730 H1 WAT 4513 55.087 77.670 73.236 1.00 0.00 H ATOM 7731 H2 WAT 4513 55.932 76.526 73.754 1.00 0.00 H TER 7733 WAT 4513 ATOM 7733 O WAT 4514 49.968 114.870 135.669 1.00 0.00 O ATOM 7734 H1 WAT 4514 50.039 115.348 134.843 1.00 0.00 H ATOM 7735 H2 WAT 4514 50.297 115.482 136.328 1.00 0.00 H TER 7737 WAT 4514 ATOM 7737 O WAT 4515 92.788 0.531 78.175 1.00 0.00 O ATOM 7738 H1 WAT 4515 93.673 0.255 78.413 1.00 0.00 H ATOM 7739 H2 WAT 4515 92.916 1.314 77.640 1.00 0.00 H TER 7741 WAT 4515 ATOM 7741 O WAT 4516 59.238 81.127 134.778 1.00 0.00 O ATOM 7742 H1 WAT 4516 58.953 81.806 134.167 1.00 0.00 H ATOM 7743 H2 WAT 4516 58.569 81.124 135.463 1.00 0.00 H TER 7745 WAT 4516 ATOM 7745 O WAT 4517 13.687 106.183 105.654 1.00 0.00 O ATOM 7746 H1 WAT 4517 14.076 106.874 105.118 1.00 0.00 H ATOM 7747 H2 WAT 4517 12.911 106.588 106.041 1.00 0.00 H TER 7749 WAT 4517 ATOM 7749 O WAT 4518 46.522 63.455 28.337 1.00 0.00 O ATOM 7750 H1 WAT 4518 45.873 62.932 27.867 1.00 0.00 H ATOM 7751 H2 WAT 4518 47.145 62.814 28.678 1.00 0.00 H TER 7753 WAT 4518 ATOM 7753 O WAT 4519 61.038 115.924 7.796 1.00 0.00 O ATOM 7754 H1 WAT 4519 60.205 115.651 8.180 1.00 0.00 H ATOM 7755 H2 WAT 4519 60.937 115.755 6.859 1.00 0.00 H TER 7757 WAT 4519 ATOM 7757 O WAT 4520 88.815 46.920 141.400 1.00 0.00 O ATOM 7758 H1 WAT 4520 88.576 46.008 141.237 1.00 0.00 H ATOM 7759 H2 WAT 4520 89.362 46.888 142.184 1.00 0.00 H TER 7761 WAT 4520 ATOM 7761 O WAT 4521 12.886 118.453 1.125 1.00 0.00 O ATOM 7762 H1 WAT 4521 12.494 119.323 1.198 1.00 0.00 H ATOM 7763 H2 WAT 4521 12.699 118.181 0.226 1.00 0.00 H TER 7765 WAT 4521 ATOM 7765 O WAT 4522 26.032 79.855 80.112 1.00 0.00 O ATOM 7766 H1 WAT 4522 25.227 79.367 79.939 1.00 0.00 H ATOM 7767 H2 WAT 4522 26.052 80.532 79.435 1.00 0.00 H TER 7769 WAT 4522 ATOM 7769 O WAT 4523 67.243 102.058 72.246 1.00 0.00 O ATOM 7770 H1 WAT 4523 67.376 101.389 72.917 1.00 0.00 H ATOM 7771 H2 WAT 4523 66.741 102.743 72.688 1.00 0.00 H TER 7773 WAT 4523 ATOM 7773 O WAT 4524 63.489 29.900 19.557 1.00 0.00 O ATOM 7774 H1 WAT 4524 62.554 29.725 19.447 1.00 0.00 H ATOM 7775 H2 WAT 4524 63.550 30.354 20.397 1.00 0.00 H TER 7777 WAT 4524 ATOM 7777 O WAT 4525 107.941 32.494 18.119 1.00 0.00 O ATOM 7778 H1 WAT 4525 108.775 32.043 17.991 1.00 0.00 H ATOM 7779 H2 WAT 4525 107.965 32.787 19.030 1.00 0.00 H TER 7781 WAT 4525 ATOM 7781 O WAT 4526 123.064 88.898 10.908 1.00 0.00 O ATOM 7782 H1 WAT 4526 123.940 89.183 11.167 1.00 0.00 H ATOM 7783 H2 WAT 4526 122.472 89.417 11.452 1.00 0.00 H TER 7785 WAT 4526 ATOM 7785 O WAT 4527 124.643 29.185 70.530 1.00 0.00 O ATOM 7786 H1 WAT 4527 124.700 28.821 69.647 1.00 0.00 H ATOM 7787 H2 WAT 4527 124.901 30.101 70.430 1.00 0.00 H TER 7789 WAT 4527 ATOM 7789 O WAT 4528 35.481 107.472 14.870 1.00 0.00 O ATOM 7790 H1 WAT 4528 34.635 107.405 14.426 1.00 0.00 H ATOM 7791 H2 WAT 4528 35.656 106.585 15.186 1.00 0.00 H TER 7793 WAT 4528 ATOM 7793 O WAT 4529 109.543 17.185 20.504 1.00 0.00 O ATOM 7794 H1 WAT 4529 110.432 16.838 20.569 1.00 0.00 H ATOM 7795 H2 WAT 4529 109.603 18.067 20.871 1.00 0.00 H TER 7797 WAT 4529 ATOM 7797 O WAT 4530 101.663 76.273 8.523 1.00 0.00 O ATOM 7798 H1 WAT 4530 102.404 75.778 8.175 1.00 0.00 H ATOM 7799 H2 WAT 4530 100.926 76.027 7.963 1.00 0.00 H TER 7801 WAT 4530 ATOM 7801 O WAT 4531 16.676 134.990 108.341 1.00 0.00 O ATOM 7802 H1 WAT 4531 16.233 134.659 107.559 1.00 0.00 H ATOM 7803 H2 WAT 4531 16.128 135.716 108.638 1.00 0.00 H TER 7805 WAT 4531 ATOM 7805 O WAT 4532 122.840 18.484 143.247 1.00 0.00 O ATOM 7806 H1 WAT 4532 123.416 18.438 142.484 1.00 0.00 H ATOM 7807 H2 WAT 4532 123.317 18.018 143.935 1.00 0.00 H TER 7809 WAT 4532 ATOM 7809 O WAT 4533 96.344 30.968 133.037 1.00 0.00 O ATOM 7810 H1 WAT 4533 97.134 30.452 133.198 1.00 0.00 H ATOM 7811 H2 WAT 4533 95.703 30.623 133.659 1.00 0.00 H TER 7813 WAT 4533 ATOM 7813 O WAT 4534 102.476 0.317 3.015 1.00 0.00 O ATOM 7814 H1 WAT 4534 101.535 0.285 3.183 1.00 0.00 H ATOM 7815 H2 WAT 4534 102.862 0.560 3.856 1.00 0.00 H TER 7817 WAT 4534 ATOM 7817 O WAT 4535 62.817 140.529 122.988 1.00 0.00 O ATOM 7818 H1 WAT 4535 63.553 140.318 122.413 1.00 0.00 H ATOM 7819 H2 WAT 4535 63.145 141.232 123.548 1.00 0.00 H TER 7821 WAT 4535 ATOM 7821 O WAT 4536 78.130 91.322 6.193 1.00 0.00 O ATOM 7822 H1 WAT 4536 78.233 92.096 6.747 1.00 0.00 H ATOM 7823 H2 WAT 4536 77.985 90.604 6.809 1.00 0.00 H TER 7825 WAT 4536 ATOM 7825 O WAT 4537 122.423 115.800 152.701 1.00 0.00 O ATOM 7826 H1 WAT 4537 121.578 115.883 152.259 1.00 0.00 H ATOM 7827 H2 WAT 4537 122.521 116.619 153.186 1.00 0.00 H TER 7829 WAT 4537 ATOM 7829 O WAT 4538 22.406 76.438 105.490 1.00 0.00 O ATOM 7830 H1 WAT 4538 22.410 75.487 105.604 1.00 0.00 H ATOM 7831 H2 WAT 4538 21.535 76.710 105.779 1.00 0.00 H TER 7833 WAT 4538 ATOM 7833 O WAT 4539 84.211 55.451 14.687 1.00 0.00 O ATOM 7834 H1 WAT 4539 84.680 56.239 14.962 1.00 0.00 H ATOM 7835 H2 WAT 4539 83.916 55.646 13.798 1.00 0.00 H TER 7837 WAT 4539 ATOM 7837 O WAT 4540 53.970 109.195 129.369 1.00 0.00 O ATOM 7838 H1 WAT 4540 54.125 108.361 128.924 1.00 0.00 H ATOM 7839 H2 WAT 4540 54.820 109.428 129.743 1.00 0.00 H TER 7841 WAT 4540 ATOM 7841 O WAT 4541 56.071 61.684 144.206 1.00 0.00 O ATOM 7842 H1 WAT 4541 56.447 62.308 143.584 1.00 0.00 H ATOM 7843 H2 WAT 4541 56.760 61.033 144.338 1.00 0.00 H TER 7845 WAT 4541 ATOM 7845 O WAT 4542 54.131 46.448 148.581 1.00 0.00 O ATOM 7846 H1 WAT 4542 54.425 46.093 147.742 1.00 0.00 H ATOM 7847 H2 WAT 4542 54.334 45.762 149.216 1.00 0.00 H TER 7849 WAT 4542 ATOM 7849 O WAT 4543 7.347 142.120 89.691 1.00 0.00 O ATOM 7850 H1 WAT 4543 6.463 142.477 89.782 1.00 0.00 H ATOM 7851 H2 WAT 4543 7.729 142.203 90.565 1.00 0.00 H TER 7853 WAT 4543 ATOM 7853 O WAT 4544 40.563 59.879 143.802 1.00 0.00 O ATOM 7854 H1 WAT 4544 41.082 59.796 143.002 1.00 0.00 H ATOM 7855 H2 WAT 4544 41.108 60.405 144.388 1.00 0.00 H TER 7857 WAT 4544 ATOM 7857 O WAT 4545 72.331 29.350 93.731 1.00 0.00 O ATOM 7858 H1 WAT 4545 73.267 29.151 93.765 1.00 0.00 H ATOM 7859 H2 WAT 4545 71.953 28.848 94.453 1.00 0.00 H TER 7861 WAT 4545 ATOM 7861 O WAT 4546 110.128 15.692 125.681 1.00 0.00 O ATOM 7862 H1 WAT 4546 109.854 16.110 126.497 1.00 0.00 H ATOM 7863 H2 WAT 4546 109.348 15.714 125.127 1.00 0.00 H TER 7865 WAT 4546 ATOM 7865 O WAT 4547 136.823 98.690 109.319 1.00 0.00 O ATOM 7866 H1 WAT 4547 137.596 98.780 109.876 1.00 0.00 H ATOM 7867 H2 WAT 4547 136.245 98.102 109.806 1.00 0.00 H TER 7869 WAT 4547 ATOM 7869 O WAT 4548 48.461 30.664 86.581 1.00 0.00 O ATOM 7870 H1 WAT 4548 49.405 30.508 86.568 1.00 0.00 H ATOM 7871 H2 WAT 4548 48.096 29.972 86.031 1.00 0.00 H TER 7873 WAT 4548 ATOM 7873 O WAT 4549 118.380 52.464 85.929 1.00 0.00 O ATOM 7874 H1 WAT 4549 118.904 51.676 86.076 1.00 0.00 H ATOM 7875 H2 WAT 4549 119.007 53.110 85.604 1.00 0.00 H TER 7877 WAT 4549 ATOM 7877 O WAT 4550 136.033 114.576 22.637 1.00 0.00 O ATOM 7878 H1 WAT 4550 136.538 114.609 23.450 1.00 0.00 H ATOM 7879 H2 WAT 4550 136.227 113.714 22.270 1.00 0.00 H TER 7881 WAT 4550 ATOM 7881 O WAT 4551 139.286 124.436 92.901 1.00 0.00 O ATOM 7882 H1 WAT 4551 138.647 124.321 92.197 1.00 0.00 H ATOM 7883 H2 WAT 4551 139.106 125.310 93.248 1.00 0.00 H TER 7885 WAT 4551 ATOM 7885 O WAT 4552 121.916 141.071 103.748 1.00 0.00 O ATOM 7886 H1 WAT 4552 122.228 141.737 104.360 1.00 0.00 H ATOM 7887 H2 WAT 4552 121.516 140.403 104.305 1.00 0.00 H TER 7889 WAT 4552 ATOM 7889 O WAT 4553 64.661 8.905 4.472 1.00 0.00 O ATOM 7890 H1 WAT 4553 64.753 8.351 3.697 1.00 0.00 H ATOM 7891 H2 WAT 4553 64.948 9.771 4.182 1.00 0.00 H TER 7893 WAT 4553 ATOM 7893 O WAT 4554 37.496 52.208 86.738 1.00 0.00 O ATOM 7894 H1 WAT 4554 37.436 52.371 85.797 1.00 0.00 H ATOM 7895 H2 WAT 4554 37.330 51.269 86.829 1.00 0.00 H TER 7897 WAT 4554 ATOM 7897 O WAT 4555 106.645 123.114 8.400 1.00 0.00 O ATOM 7898 H1 WAT 4555 106.200 123.950 8.263 1.00 0.00 H ATOM 7899 H2 WAT 4555 106.994 123.171 9.289 1.00 0.00 H TER 7901 WAT 4555 ATOM 7901 O WAT 4556 14.813 59.675 85.905 1.00 0.00 O ATOM 7902 H1 WAT 4556 13.921 59.327 85.915 1.00 0.00 H ATOM 7903 H2 WAT 4556 15.143 59.461 85.033 1.00 0.00 H TER 7905 WAT 4556 ATOM 7905 O WAT 4557 42.688 44.627 20.816 1.00 0.00 O ATOM 7906 H1 WAT 4557 42.945 44.452 19.910 1.00 0.00 H ATOM 7907 H2 WAT 4557 43.151 45.433 21.044 1.00 0.00 H TER 7909 WAT 4557 ATOM 7909 O WAT 4558 66.742 17.505 87.655 1.00 0.00 O ATOM 7910 H1 WAT 4558 66.045 17.708 88.279 1.00 0.00 H ATOM 7911 H2 WAT 4558 66.412 16.753 87.163 1.00 0.00 H TER 7913 WAT 4558 ATOM 7913 O WAT 4559 24.606 32.673 79.141 1.00 0.00 O ATOM 7914 H1 WAT 4559 24.592 32.802 78.192 1.00 0.00 H ATOM 7915 H2 WAT 4559 25.531 32.739 79.378 1.00 0.00 H TER 7917 WAT 4559 ATOM 7917 O WAT 4560 141.455 116.923 124.707 1.00 0.00 O ATOM 7918 H1 WAT 4560 141.741 116.239 124.102 1.00 0.00 H ATOM 7919 H2 WAT 4560 142.187 117.539 124.735 1.00 0.00 H TER 7921 WAT 4560 ATOM 7921 O WAT 4561 117.025 100.474 82.895 1.00 0.00 O ATOM 7922 H1 WAT 4561 116.740 100.071 82.074 1.00 0.00 H ATOM 7923 H2 WAT 4561 116.221 100.820 83.283 1.00 0.00 H TER 7925 WAT 4561 ATOM 7925 O WAT 4562 18.533 101.110 129.862 1.00 0.00 O ATOM 7926 H1 WAT 4562 17.580 101.030 129.904 1.00 0.00 H ATOM 7927 H2 WAT 4562 18.854 100.215 129.973 1.00 0.00 H TER 7929 WAT 4562 ATOM 7929 O WAT 4563 17.796 13.208 140.177 1.00 0.00 O ATOM 7930 H1 WAT 4563 18.062 12.833 141.017 1.00 0.00 H ATOM 7931 H2 WAT 4563 17.514 14.097 140.390 1.00 0.00 H TER 7933 WAT 4563 ATOM 7933 O WAT 4564 112.836 90.308 133.727 1.00 0.00 O ATOM 7934 H1 WAT 4564 112.522 90.333 134.630 1.00 0.00 H ATOM 7935 H2 WAT 4564 112.609 91.167 133.371 1.00 0.00 H TER 7937 WAT 4564 ATOM 7937 O WAT 4565 137.166 124.442 7.895 1.00 0.00 O ATOM 7938 H1 WAT 4565 136.234 124.249 7.797 1.00 0.00 H ATOM 7939 H2 WAT 4565 137.457 124.668 7.011 1.00 0.00 H TER 7941 WAT 4565 ATOM 7941 O WAT 4566 112.155 37.564 85.037 1.00 0.00 O ATOM 7942 H1 WAT 4566 113.033 37.457 84.672 1.00 0.00 H ATOM 7943 H2 WAT 4566 112.151 38.451 85.396 1.00 0.00 H TER 7945 WAT 4566 ATOM 7945 O WAT 4567 75.728 100.636 0.833 1.00 0.00 O ATOM 7946 H1 WAT 4567 75.636 101.583 0.940 1.00 0.00 H ATOM 7947 H2 WAT 4567 74.926 100.367 0.384 1.00 0.00 H TER 7949 WAT 4567 ATOM 7949 O WAT 4568 110.229 87.873 21.247 1.00 0.00 O ATOM 7950 H1 WAT 4568 110.020 87.976 22.175 1.00 0.00 H ATOM 7951 H2 WAT 4568 110.888 87.178 21.226 1.00 0.00 H TER 7953 WAT 4568 ATOM 7953 O WAT 4569 141.069 14.173 12.763 1.00 0.00 O ATOM 7954 H1 WAT 4569 140.902 14.298 13.697 1.00 0.00 H ATOM 7955 H2 WAT 4569 140.198 14.092 12.373 1.00 0.00 H TER 7957 WAT 4569 ATOM 7957 O WAT 4570 89.178 105.855 132.226 1.00 0.00 O ATOM 7958 H1 WAT 4570 88.719 105.816 133.064 1.00 0.00 H ATOM 7959 H2 WAT 4570 89.686 105.044 132.193 1.00 0.00 H TER 7961 WAT 4570 ATOM 7961 O WAT 4571 64.426 66.442 102.414 1.00 0.00 O ATOM 7962 H1 WAT 4571 63.811 65.944 102.953 1.00 0.00 H ATOM 7963 H2 WAT 4571 64.598 67.237 102.920 1.00 0.00 H TER 7965 WAT 4571 ATOM 7965 O WAT 4572 144.691 52.869 62.403 1.00 0.00 O ATOM 7966 H1 WAT 4572 144.210 52.500 61.663 1.00 0.00 H ATOM 7967 H2 WAT 4572 145.608 52.843 62.130 1.00 0.00 H TER 7969 WAT 4572 ATOM 7969 O WAT 4573 70.128 61.610 73.519 1.00 0.00 O ATOM 7970 H1 WAT 4573 69.404 61.751 72.909 1.00 0.00 H ATOM 7971 H2 WAT 4573 70.881 61.423 72.958 1.00 0.00 H TER 7973 WAT 4573 ATOM 7973 O WAT 4574 22.190 54.406 87.832 1.00 0.00 O ATOM 7974 H1 WAT 4574 22.236 55.303 88.161 1.00 0.00 H ATOM 7975 H2 WAT 4574 21.302 54.119 88.042 1.00 0.00 H TER 7977 WAT 4574 ATOM 7977 O WAT 4575 42.064 6.270 12.125 1.00 0.00 O ATOM 7978 H1 WAT 4575 41.478 6.283 12.882 1.00 0.00 H ATOM 7979 H2 WAT 4575 41.916 5.414 11.723 1.00 0.00 H TER 7981 WAT 4575 ATOM 7981 O WAT 4576 59.313 123.064 157.405 1.00 0.00 O ATOM 7982 H1 WAT 4576 58.364 123.094 157.529 1.00 0.00 H ATOM 7983 H2 WAT 4576 59.592 122.282 157.881 1.00 0.00 H TER 7985 WAT 4576 ATOM 7985 O WAT 4577 26.637 82.588 21.693 1.00 0.00 O ATOM 7986 H1 WAT 4577 27.408 82.516 22.255 1.00 0.00 H ATOM 7987 H2 WAT 4577 26.361 81.683 21.549 1.00 0.00 H TER 7989 WAT 4577 ATOM 7989 O WAT 4578 130.172 134.368 141.343 1.00 0.00 O ATOM 7990 H1 WAT 4578 129.714 134.742 142.096 1.00 0.00 H ATOM 7991 H2 WAT 4578 129.553 133.738 140.974 1.00 0.00 H TER 7993 WAT 4578 ATOM 7993 O WAT 4579 29.516 121.801 80.669 1.00 0.00 O ATOM 7994 H1 WAT 4579 28.716 121.665 81.176 1.00 0.00 H ATOM 7995 H2 WAT 4579 29.911 122.585 81.050 1.00 0.00 H TER 7997 WAT 4579 ATOM 7997 O WAT 4580 142.757 29.886 93.651 1.00 0.00 O ATOM 7998 H1 WAT 4580 142.237 30.676 93.796 1.00 0.00 H ATOM 7999 H2 WAT 4580 143.521 30.188 93.161 1.00 0.00 H TER 8001 WAT 4580 ATOM 8001 O WAT 4581 4.191 66.464 120.831 1.00 0.00 O ATOM 8002 H1 WAT 4581 3.406 66.666 121.340 1.00 0.00 H ATOM 8003 H2 WAT 4581 3.895 65.833 120.175 1.00 0.00 H TER 8005 WAT 4581 ATOM 8005 O WAT 4582 104.792 66.909 68.220 1.00 0.00 O ATOM 8006 H1 WAT 4582 104.723 67.731 67.735 1.00 0.00 H ATOM 8007 H2 WAT 4582 104.947 67.178 69.126 1.00 0.00 H TER 8009 WAT 4582 ATOM 8009 O WAT 4583 115.158 72.078 95.847 1.00 0.00 O ATOM 8010 H1 WAT 4583 115.559 72.908 96.106 1.00 0.00 H ATOM 8011 H2 WAT 4583 114.858 72.226 94.951 1.00 0.00 H TER 8013 WAT 4583 ATOM 8013 O WAT 4584 17.418 101.731 69.045 1.00 0.00 O ATOM 8014 H1 WAT 4584 17.284 102.439 68.414 1.00 0.00 H ATOM 8015 H2 WAT 4584 16.951 100.985 68.670 1.00 0.00 H TER 8017 WAT 4584 ATOM 8017 O WAT 4585 116.272 25.815 153.311 1.00 0.00 O ATOM 8018 H1 WAT 4585 117.074 25.991 153.804 1.00 0.00 H ATOM 8019 H2 WAT 4585 116.213 24.860 153.284 1.00 0.00 H TER 8021 WAT 4585 ATOM 8021 O WAT 4586 24.932 102.360 112.893 1.00 0.00 O ATOM 8022 H1 WAT 4586 24.527 101.493 112.896 1.00 0.00 H ATOM 8023 H2 WAT 4586 24.243 102.946 112.580 1.00 0.00 H TER 8025 WAT 4586 ATOM 8025 O WAT 4587 100.574 83.495 134.320 1.00 0.00 O ATOM 8026 H1 WAT 4587 99.958 83.268 135.017 1.00 0.00 H ATOM 8027 H2 WAT 4587 100.561 84.451 134.291 1.00 0.00 H TER 8029 WAT 4587 ATOM 8029 O WAT 4588 14.010 23.500 0.627 1.00 0.00 O ATOM 8030 H1 WAT 4588 13.524 24.322 0.684 1.00 0.00 H ATOM 8031 H2 WAT 4588 13.985 23.271 -0.302 1.00 0.00 H TER 8033 WAT 4588 ATOM 8033 O WAT 4589 4.355 90.420 80.957 1.00 0.00 O ATOM 8034 H1 WAT 4589 3.919 91.062 80.396 1.00 0.00 H ATOM 8035 H2 WAT 4589 5.107 90.889 81.317 1.00 0.00 H TER 8037 WAT 4589 ATOM 8037 O WAT 4590 48.453 88.444 4.674 1.00 0.00 O ATOM 8038 H1 WAT 4590 47.775 89.096 4.852 1.00 0.00 H ATOM 8039 H2 WAT 4590 48.940 88.802 3.931 1.00 0.00 H TER 8041 WAT 4590 ATOM 8041 O WAT 4591 76.612 18.526 156.872 1.00 0.00 O ATOM 8042 H1 WAT 4591 76.498 18.187 155.984 1.00 0.00 H ATOM 8043 H2 WAT 4591 76.516 19.474 156.781 1.00 0.00 H TER 8045 WAT 4591 ATOM 8045 O WAT 4592 56.213 134.817 10.990 1.00 0.00 O ATOM 8046 H1 WAT 4592 55.338 135.032 10.665 1.00 0.00 H ATOM 8047 H2 WAT 4592 56.202 135.094 11.906 1.00 0.00 H TER 8049 WAT 4592 ATOM 8049 O WAT 4593 85.242 113.846 82.360 1.00 0.00 O ATOM 8050 H1 WAT 4593 85.653 114.509 81.805 1.00 0.00 H ATOM 8051 H2 WAT 4593 85.054 113.119 81.766 1.00 0.00 H TER 8053 WAT 4593 ATOM 8053 O WAT 4594 101.407 15.544 103.686 1.00 0.00 O ATOM 8054 H1 WAT 4594 100.562 15.744 103.282 1.00 0.00 H ATOM 8055 H2 WAT 4594 101.996 16.223 103.356 1.00 0.00 H TER 8057 WAT 4594 ATOM 8057 O WAT 4595 122.998 32.613 156.056 1.00 0.00 O ATOM 8058 H1 WAT 4595 123.515 33.410 156.171 1.00 0.00 H ATOM 8059 H2 WAT 4595 122.341 32.846 155.400 1.00 0.00 H TER 8061 WAT 4595 ATOM 8061 O WAT 4596 42.676 45.804 30.146 1.00 0.00 O ATOM 8062 H1 WAT 4596 41.762 45.779 30.429 1.00 0.00 H ATOM 8063 H2 WAT 4596 42.766 45.054 29.558 1.00 0.00 H TER 8065 WAT 4596 ATOM 8065 O WAT 4597 75.851 7.426 131.243 1.00 0.00 O ATOM 8066 H1 WAT 4597 76.434 6.995 130.617 1.00 0.00 H ATOM 8067 H2 WAT 4597 76.255 8.279 131.398 1.00 0.00 H TER 8069 WAT 4597 ATOM 8069 O WAT 4598 70.816 107.287 149.941 1.00 0.00 O ATOM 8070 H1 WAT 4598 70.164 107.787 150.433 1.00 0.00 H ATOM 8071 H2 WAT 4598 71.450 107.943 149.650 1.00 0.00 H TER 8073 WAT 4598 ATOM 8073 O WAT 4599 6.975 10.119 127.699 1.00 0.00 O ATOM 8074 H1 WAT 4599 6.909 11.069 127.602 1.00 0.00 H ATOM 8075 H2 WAT 4599 6.155 9.783 127.337 1.00 0.00 H TER 8077 WAT 4599 ATOM 8077 O WAT 4600 63.727 18.532 90.064 1.00 0.00 O ATOM 8078 H1 WAT 4600 63.837 19.072 89.282 1.00 0.00 H ATOM 8079 H2 WAT 4600 64.174 19.019 90.757 1.00 0.00 H TER 8081 WAT 4600 ATOM 8081 O WAT 4601 115.468 76.581 65.660 1.00 0.00 O ATOM 8082 H1 WAT 4601 115.214 77.394 65.224 1.00 0.00 H ATOM 8083 H2 WAT 4601 114.881 76.518 66.413 1.00 0.00 H TER 8085 WAT 4601 ATOM 8085 O WAT 4602 44.938 42.663 104.907 1.00 0.00 O ATOM 8086 H1 WAT 4602 45.288 43.023 105.723 1.00 0.00 H ATOM 8087 H2 WAT 4602 44.692 43.432 104.393 1.00 0.00 H TER 8089 WAT 4602 ATOM 8089 O WAT 4603 88.135 81.776 74.907 1.00 0.00 O ATOM 8090 H1 WAT 4603 88.975 82.128 74.613 1.00 0.00 H ATOM 8091 H2 WAT 4603 87.737 82.489 75.406 1.00 0.00 H TER 8093 WAT 4603 ATOM 8093 O WAT 4604 55.479 68.706 105.207 1.00 0.00 O ATOM 8094 H1 WAT 4604 56.424 68.562 105.145 1.00 0.00 H ATOM 8095 H2 WAT 4604 55.348 69.588 104.857 1.00 0.00 H TER 8097 WAT 4604 ATOM 8097 O WAT 4605 57.099 67.721 79.440 1.00 0.00 O ATOM 8098 H1 WAT 4605 57.180 66.832 79.786 1.00 0.00 H ATOM 8099 H2 WAT 4605 56.664 68.210 80.138 1.00 0.00 H TER 8101 WAT 4605 ATOM 8101 O WAT 4606 90.580 51.363 69.697 1.00 0.00 O ATOM 8102 H1 WAT 4606 91.207 51.774 70.292 1.00 0.00 H ATOM 8103 H2 WAT 4606 90.342 52.056 69.082 1.00 0.00 H TER 8105 WAT 4606 ATOM 8105 O WAT 4607 135.008 54.175 70.024 1.00 0.00 O ATOM 8106 H1 WAT 4607 135.320 54.712 70.753 1.00 0.00 H ATOM 8107 H2 WAT 4607 135.134 54.724 69.251 1.00 0.00 H TER 8109 WAT 4607 ATOM 8109 O WAT 4608 10.285 128.809 69.730 1.00 0.00 O ATOM 8110 H1 WAT 4608 9.965 128.716 68.833 1.00 0.00 H ATOM 8111 H2 WAT 4608 10.919 128.099 69.833 1.00 0.00 H TER 8113 WAT 4608 ATOM 8113 O WAT 4609 106.044 119.832 110.729 1.00 0.00 O ATOM 8114 H1 WAT 4609 106.729 119.625 110.094 1.00 0.00 H ATOM 8115 H2 WAT 4609 106.311 120.672 111.104 1.00 0.00 H TER 8117 WAT 4609 ATOM 8117 O WAT 4610 37.040 120.685 6.247 1.00 0.00 O ATOM 8118 H1 WAT 4610 37.591 120.809 5.474 1.00 0.00 H ATOM 8119 H2 WAT 4610 36.507 119.916 6.041 1.00 0.00 H TER 8121 WAT 4610 ATOM 8121 O WAT 4611 32.777 84.591 102.946 1.00 0.00 O ATOM 8122 H1 WAT 4611 33.509 85.030 102.513 1.00 0.00 H ATOM 8123 H2 WAT 4611 32.068 85.234 102.929 1.00 0.00 H TER 8125 WAT 4611 ATOM 8125 O WAT 4612 62.555 145.080 78.581 1.00 0.00 O ATOM 8126 H1 WAT 4612 61.786 144.533 78.740 1.00 0.00 H ATOM 8127 H2 WAT 4612 62.362 145.902 79.032 1.00 0.00 H TER 8129 WAT 4612 ATOM 8129 O WAT 4613 63.885 64.949 153.162 1.00 0.00 O ATOM 8130 H1 WAT 4613 64.466 65.414 152.560 1.00 0.00 H ATOM 8131 H2 WAT 4613 63.232 64.538 152.595 1.00 0.00 H TER 8133 WAT 4613 ATOM 8133 O WAT 4614 7.141 72.709 77.315 1.00 0.00 O ATOM 8134 H1 WAT 4614 6.485 72.159 77.744 1.00 0.00 H ATOM 8135 H2 WAT 4614 7.394 73.346 77.983 1.00 0.00 H TER 8137 WAT 4614 ATOM 8137 O WAT 4615 102.640 77.999 90.931 1.00 0.00 O ATOM 8138 H1 WAT 4615 102.057 78.058 90.174 1.00 0.00 H ATOM 8139 H2 WAT 4615 102.858 78.908 91.136 1.00 0.00 H TER 8141 WAT 4615 ATOM 8141 O WAT 4616 62.391 34.223 107.293 1.00 0.00 O ATOM 8142 H1 WAT 4616 61.451 34.223 107.473 1.00 0.00 H ATOM 8143 H2 WAT 4616 62.781 34.646 108.057 1.00 0.00 H TER 8145 WAT 4616 ATOM 8145 O WAT 4617 92.312 81.544 127.051 1.00 0.00 O ATOM 8146 H1 WAT 4617 92.338 82.452 126.749 1.00 0.00 H ATOM 8147 H2 WAT 4617 93.183 81.387 127.416 1.00 0.00 H TER 8149 WAT 4617 ATOM 8149 O WAT 4618 93.196 141.445 100.216 1.00 0.00 O ATOM 8150 H1 WAT 4618 93.078 142.304 100.621 1.00 0.00 H ATOM 8151 H2 WAT 4618 93.883 141.028 100.736 1.00 0.00 H TER 8153 WAT 4618 ATOM 8153 O WAT 4619 118.472 17.495 63.664 1.00 0.00 O ATOM 8154 H1 WAT 4619 117.645 17.130 63.980 1.00 0.00 H ATOM 8155 H2 WAT 4619 119.131 16.849 63.916 1.00 0.00 H TER 8157 WAT 4619 ATOM 8157 O WAT 4620 117.600 14.982 121.058 1.00 0.00 O ATOM 8158 H1 WAT 4620 118.097 14.174 120.930 1.00 0.00 H ATOM 8159 H2 WAT 4620 117.119 14.841 121.873 1.00 0.00 H TER 8161 WAT 4620 ATOM 8161 O WAT 4621 140.911 127.176 1.882 1.00 0.00 O ATOM 8162 H1 WAT 4621 141.862 127.167 1.773 1.00 0.00 H ATOM 8163 H2 WAT 4621 140.688 126.274 2.113 1.00 0.00 H TER 8165 WAT 4621 ATOM 8165 O WAT 4622 8.887 136.646 84.577 1.00 0.00 O ATOM 8166 H1 WAT 4622 9.153 137.360 83.997 1.00 0.00 H ATOM 8167 H2 WAT 4622 7.975 136.476 84.343 1.00 0.00 H TER 8169 WAT 4622 ATOM 8169 O WAT 4623 126.625 2.876 62.835 1.00 0.00 O ATOM 8170 H1 WAT 4623 125.675 2.836 62.942 1.00 0.00 H ATOM 8171 H2 WAT 4623 126.777 2.599 61.932 1.00 0.00 H TER 8173 WAT 4623 ATOM 8173 O WAT 4624 107.339 65.759 10.492 1.00 0.00 O ATOM 8174 H1 WAT 4624 107.109 65.598 9.577 1.00 0.00 H ATOM 8175 H2 WAT 4624 107.238 64.908 10.917 1.00 0.00 H TER 8177 WAT 4624 ATOM 8177 O WAT 4625 64.566 114.999 75.457 1.00 0.00 O ATOM 8178 H1 WAT 4625 63.763 114.690 75.877 1.00 0.00 H ATOM 8179 H2 WAT 4625 65.255 114.443 75.820 1.00 0.00 H TER 8181 WAT 4625 ATOM 8181 O WAT 4626 77.576 130.004 119.194 1.00 0.00 O ATOM 8182 H1 WAT 4626 77.055 129.947 119.996 1.00 0.00 H ATOM 8183 H2 WAT 4626 77.219 129.320 118.628 1.00 0.00 H TER 8185 WAT 4626 ATOM 8185 O WAT 4627 47.513 142.684 66.990 1.00 0.00 O ATOM 8186 H1 WAT 4627 46.746 142.635 67.560 1.00 0.00 H ATOM 8187 H2 WAT 4627 47.152 142.794 66.111 1.00 0.00 H TER 8189 WAT 4627 ATOM 8189 O WAT 4628 144.872 80.563 59.442 1.00 0.00 O ATOM 8190 H1 WAT 4628 144.444 81.285 59.901 1.00 0.00 H ATOM 8191 H2 WAT 4628 144.270 80.339 58.732 1.00 0.00 H TER 8193 WAT 4628 ATOM 8193 O WAT 4629 78.844 83.542 20.800 1.00 0.00 O ATOM 8194 H1 WAT 4629 79.397 83.303 21.544 1.00 0.00 H ATOM 8195 H2 WAT 4629 79.398 84.106 20.261 1.00 0.00 H TER 8197 WAT 4629 ATOM 8197 O WAT 4630 22.757 93.762 101.382 1.00 0.00 O ATOM 8198 H1 WAT 4630 22.955 93.698 102.316 1.00 0.00 H ATOM 8199 H2 WAT 4630 21.813 93.916 101.347 1.00 0.00 H TER 8201 WAT 4630 ATOM 8201 O WAT 4631 136.919 106.280 4.390 1.00 0.00 O ATOM 8202 H1 WAT 4631 136.088 105.847 4.196 1.00 0.00 H ATOM 8203 H2 WAT 4631 136.682 107.195 4.543 1.00 0.00 H TER 8205 WAT 4631 ATOM 8205 O WAT 4632 7.393 96.129 23.296 1.00 0.00 O ATOM 8206 H1 WAT 4632 6.940 95.372 23.668 1.00 0.00 H ATOM 8207 H2 WAT 4632 6.912 96.885 23.632 1.00 0.00 H TER 8209 WAT 4632 ATOM 8209 O WAT 4633 20.921 133.754 101.626 1.00 0.00 O ATOM 8210 H1 WAT 4633 20.735 132.925 102.067 1.00 0.00 H ATOM 8211 H2 WAT 4633 20.277 133.800 100.919 1.00 0.00 H TER 8213 WAT 4633 ATOM 8213 O WAT 4634 42.358 95.118 77.079 1.00 0.00 O ATOM 8214 H1 WAT 4634 42.126 95.730 77.778 1.00 0.00 H ATOM 8215 H2 WAT 4634 43.053 95.562 76.593 1.00 0.00 H TER 8217 WAT 4634 ATOM 8217 O WAT 4635 33.566 71.445 90.921 1.00 0.00 O ATOM 8218 H1 WAT 4635 33.142 71.145 90.116 1.00 0.00 H ATOM 8219 H2 WAT 4635 34.348 71.908 90.621 1.00 0.00 H TER 8221 WAT 4635 ATOM 8221 O WAT 4636 67.445 41.799 140.752 1.00 0.00 O ATOM 8222 H1 WAT 4636 66.740 42.445 140.730 1.00 0.00 H ATOM 8223 H2 WAT 4636 67.125 41.076 140.212 1.00 0.00 H TER 8225 WAT 4636 ATOM 8225 O WAT 4637 30.243 94.151 98.238 1.00 0.00 O ATOM 8226 H1 WAT 4637 30.847 94.433 97.551 1.00 0.00 H ATOM 8227 H2 WAT 4637 30.608 93.324 98.552 1.00 0.00 H TER 8229 WAT 4637 ATOM 8229 O WAT 4638 15.923 122.628 76.293 1.00 0.00 O ATOM 8230 H1 WAT 4638 16.293 122.014 76.927 1.00 0.00 H ATOM 8231 H2 WAT 4638 16.587 123.313 76.207 1.00 0.00 H TER 8233 WAT 4638 ATOM 8233 O WAT 4639 128.549 97.564 93.243 1.00 0.00 O ATOM 8234 H1 WAT 4639 129.269 96.939 93.320 1.00 0.00 H ATOM 8235 H2 WAT 4639 128.978 98.419 93.201 1.00 0.00 H TER 8237 WAT 4639 ATOM 8237 O WAT 4640 67.679 63.810 136.583 1.00 0.00 O ATOM 8238 H1 WAT 4640 67.515 62.869 136.648 1.00 0.00 H ATOM 8239 H2 WAT 4640 66.810 64.208 136.627 1.00 0.00 H TER 8241 WAT 4640 ATOM 8241 O WAT 4641 66.465 36.309 112.251 1.00 0.00 O ATOM 8242 H1 WAT 4641 65.538 36.091 112.158 1.00 0.00 H ATOM 8243 H2 WAT 4641 66.778 36.418 111.353 1.00 0.00 H TER 8245 WAT 4641 ATOM 8245 O WAT 4642 55.171 85.592 72.268 1.00 0.00 O ATOM 8246 H1 WAT 4642 55.755 86.328 72.449 1.00 0.00 H ATOM 8247 H2 WAT 4642 55.287 85.004 73.015 1.00 0.00 H TER 8249 WAT 4642 ATOM 8249 O WAT 4643 28.255 43.422 18.238 1.00 0.00 O ATOM 8250 H1 WAT 4643 28.674 43.738 19.039 1.00 0.00 H ATOM 8251 H2 WAT 4643 27.325 43.616 18.362 1.00 0.00 H TER 8253 WAT 4643 ATOM 8253 O WAT 4644 115.053 2.469 104.093 1.00 0.00 O ATOM 8254 H1 WAT 4644 115.047 2.923 104.936 1.00 0.00 H ATOM 8255 H2 WAT 4644 115.944 2.131 104.009 1.00 0.00 H TER 8257 WAT 4644 ATOM 8257 O WAT 4645 11.619 141.339 144.730 1.00 0.00 O ATOM 8258 H1 WAT 4645 12.188 141.893 144.197 1.00 0.00 H ATOM 8259 H2 WAT 4645 11.760 141.641 145.627 1.00 0.00 H TER 8261 WAT 4645 ATOM 8261 O WAT 4646 83.150 101.709 96.775 1.00 0.00 O ATOM 8262 H1 WAT 4646 82.528 102.435 96.816 1.00 0.00 H ATOM 8263 H2 WAT 4646 82.625 100.959 96.495 1.00 0.00 H TER 8265 WAT 4646 ATOM 8265 O WAT 4647 25.944 128.331 146.240 1.00 0.00 O ATOM 8266 H1 WAT 4647 25.837 128.436 147.185 1.00 0.00 H ATOM 8267 H2 WAT 4647 26.850 128.591 146.071 1.00 0.00 H TER 8269 WAT 4647 ATOM 8269 O WAT 4648 9.777 81.006 19.900 1.00 0.00 O ATOM 8270 H1 WAT 4648 10.497 81.615 19.734 1.00 0.00 H ATOM 8271 H2 WAT 4648 9.534 81.165 20.812 1.00 0.00 H TER 8273 WAT 4648 ATOM 8273 O WAT 4649 19.586 114.331 120.785 1.00 0.00 O ATOM 8274 H1 WAT 4649 20.159 114.832 121.365 1.00 0.00 H ATOM 8275 H2 WAT 4649 19.096 113.754 121.372 1.00 0.00 H TER 8277 WAT 4649 ATOM 8277 O WAT 4650 124.085 31.254 135.132 1.00 0.00 O ATOM 8278 H1 WAT 4650 123.172 31.150 134.865 1.00 0.00 H ATOM 8279 H2 WAT 4650 124.589 30.865 134.418 1.00 0.00 H TER 8281 WAT 4650 ATOM 8281 O WAT 4651 66.069 90.478 5.011 1.00 0.00 O ATOM 8282 H1 WAT 4651 65.230 90.819 5.319 1.00 0.00 H ATOM 8283 H2 WAT 4651 65.924 89.536 4.916 1.00 0.00 H TER 8285 WAT 4651 ATOM 8285 O WAT 4652 141.802 45.195 1.658 1.00 0.00 O ATOM 8286 H1 WAT 4652 142.418 45.811 2.054 1.00 0.00 H ATOM 8287 H2 WAT 4652 141.605 44.571 2.357 1.00 0.00 H TER 8289 WAT 4652 ATOM 8289 O WAT 4653 24.311 78.219 140.280 1.00 0.00 O ATOM 8290 H1 WAT 4653 24.425 78.037 139.347 1.00 0.00 H ATOM 8291 H2 WAT 4653 24.688 77.457 140.720 1.00 0.00 H TER 8293 WAT 4653 ATOM 8293 O WAT 4654 55.715 4.394 59.595 1.00 0.00 O ATOM 8294 H1 WAT 4654 55.368 4.058 58.769 1.00 0.00 H ATOM 8295 H2 WAT 4654 55.216 5.194 59.757 1.00 0.00 H TER 8297 WAT 4654 ATOM 8297 O WAT 4655 131.018 18.128 65.456 1.00 0.00 O ATOM 8298 H1 WAT 4655 131.970 18.181 65.368 1.00 0.00 H ATOM 8299 H2 WAT 4655 130.725 19.039 65.448 1.00 0.00 H TER 8301 WAT 4655 ATOM 8301 O WAT 4656 25.872 6.650 5.012 1.00 0.00 O ATOM 8302 H1 WAT 4656 25.562 5.811 4.670 1.00 0.00 H ATOM 8303 H2 WAT 4656 26.715 6.446 5.418 1.00 0.00 H TER 8305 WAT 4656 ATOM 8305 O WAT 4657 20.697 119.692 139.052 1.00 0.00 O ATOM 8306 H1 WAT 4657 20.560 119.529 138.119 1.00 0.00 H ATOM 8307 H2 WAT 4657 19.886 119.399 139.467 1.00 0.00 H TER 8309 WAT 4657 ATOM 8309 O WAT 4658 83.670 44.522 68.099 1.00 0.00 O ATOM 8310 H1 WAT 4658 83.624 44.426 67.148 1.00 0.00 H ATOM 8311 H2 WAT 4658 84.462 44.047 68.350 1.00 0.00 H TER 8313 WAT 4658 ATOM 8313 O WAT 4659 74.374 40.720 127.485 1.00 0.00 O ATOM 8314 H1 WAT 4659 74.563 40.655 128.421 1.00 0.00 H ATOM 8315 H2 WAT 4659 73.465 41.016 127.445 1.00 0.00 H TER 8317 WAT 4659 ATOM 8317 O WAT 4660 27.422 87.492 122.678 1.00 0.00 O ATOM 8318 H1 WAT 4660 27.179 88.008 123.447 1.00 0.00 H ATOM 8319 H2 WAT 4660 28.249 87.874 122.385 1.00 0.00 H TER 8321 WAT 4660 ATOM 8321 O WAT 4661 15.026 143.321 127.897 1.00 0.00 O ATOM 8322 H1 WAT 4661 15.194 142.682 128.590 1.00 0.00 H ATOM 8323 H2 WAT 4661 15.647 143.094 127.206 1.00 0.00 H TER 8325 WAT 4661 ATOM 8325 O WAT 4662 76.147 114.504 7.795 1.00 0.00 O ATOM 8326 H1 WAT 4662 77.043 114.371 7.484 1.00 0.00 H ATOM 8327 H2 WAT 4662 76.238 115.101 8.537 1.00 0.00 H TER 8329 WAT 4662 ATOM 8329 O WAT 4663 73.709 32.238 73.623 1.00 0.00 O ATOM 8330 H1 WAT 4663 73.609 32.520 72.714 1.00 0.00 H ATOM 8331 H2 WAT 4663 74.411 32.789 73.968 1.00 0.00 H TER 8333 WAT 4663 ATOM 8333 O WAT 4664 132.266 79.692 58.956 1.00 0.00 O ATOM 8334 H1 WAT 4664 132.213 80.490 59.483 1.00 0.00 H ATOM 8335 H2 WAT 4664 131.519 79.750 58.360 1.00 0.00 H TER 8337 WAT 4664 ATOM 8337 O WAT 4665 10.101 144.072 124.901 1.00 0.00 O ATOM 8338 H1 WAT 4665 9.252 144.511 124.852 1.00 0.00 H ATOM 8339 H2 WAT 4665 10.244 143.930 125.837 1.00 0.00 H TER 8341 WAT 4665 ATOM 8341 O WAT 4666 42.335 116.901 108.867 1.00 0.00 O ATOM 8342 H1 WAT 4666 42.176 117.571 108.202 1.00 0.00 H ATOM 8343 H2 WAT 4666 42.945 116.292 108.453 1.00 0.00 H TER 8345 WAT 4666 ATOM 8345 O WAT 4667 64.055 145.706 15.878 1.00 0.00 O ATOM 8346 H1 WAT 4667 64.704 145.008 15.800 1.00 0.00 H ATOM 8347 H2 WAT 4667 63.859 145.749 16.814 1.00 0.00 H TER 8349 WAT 4667 ATOM 8349 O WAT 4668 117.642 115.889 13.006 1.00 0.00 O ATOM 8350 H1 WAT 4668 117.032 115.357 12.495 1.00 0.00 H ATOM 8351 H2 WAT 4668 118.335 115.281 13.261 1.00 0.00 H TER 8353 WAT 4668 ATOM 8353 O WAT 4669 83.634 89.819 142.887 1.00 0.00 O ATOM 8354 H1 WAT 4669 83.158 90.383 142.277 1.00 0.00 H ATOM 8355 H2 WAT 4669 83.161 88.987 142.862 1.00 0.00 H TER 8357 WAT 4669 ATOM 8357 O WAT 4670 117.548 35.995 61.913 1.00 0.00 O ATOM 8358 H1 WAT 4670 118.377 36.082 61.441 1.00 0.00 H ATOM 8359 H2 WAT 4670 117.086 35.293 61.457 1.00 0.00 H TER 8361 WAT 4670 ATOM 8361 O WAT 4671 84.767 75.272 114.608 1.00 0.00 O ATOM 8362 H1 WAT 4671 84.531 76.194 114.502 1.00 0.00 H ATOM 8363 H2 WAT 4671 83.974 74.793 114.365 1.00 0.00 H TER 8365 WAT 4671 ATOM 8365 O WAT 4672 17.377 33.796 88.674 1.00 0.00 O ATOM 8366 H1 WAT 4672 16.502 34.152 88.518 1.00 0.00 H ATOM 8367 H2 WAT 4672 17.470 33.098 88.026 1.00 0.00 H TER 8369 WAT 4672 ATOM 8369 O WAT 4673 137.514 131.803 8.138 1.00 0.00 O ATOM 8370 H1 WAT 4673 137.102 132.486 7.610 1.00 0.00 H ATOM 8371 H2 WAT 4673 137.243 130.983 7.724 1.00 0.00 H TER 8373 WAT 4673 ATOM 8373 O WAT 4674 60.165 135.155 3.308 1.00 0.00 O ATOM 8374 H1 WAT 4674 60.427 136.072 3.394 1.00 0.00 H ATOM 8375 H2 WAT 4674 59.759 135.103 2.442 1.00 0.00 H TER 8377 WAT 4674 ATOM 8377 O WAT 4675 62.290 48.842 136.635 1.00 0.00 O ATOM 8378 H1 WAT 4675 61.469 48.564 136.229 1.00 0.00 H ATOM 8379 H2 WAT 4675 62.972 48.448 136.092 1.00 0.00 H TER 8381 WAT 4675 ATOM 8381 O WAT 4676 12.177 114.731 147.543 1.00 0.00 O ATOM 8382 H1 WAT 4676 12.292 115.575 147.979 1.00 0.00 H ATOM 8383 H2 WAT 4676 11.380 114.368 147.929 1.00 0.00 H TER 8385 WAT 4676 ATOM 8385 O WAT 4677 78.885 3.128 132.912 1.00 0.00 O ATOM 8386 H1 WAT 4677 79.213 4.001 132.693 1.00 0.00 H ATOM 8387 H2 WAT 4677 79.579 2.737 133.441 1.00 0.00 H TER 8389 WAT 4677 ATOM 8389 O WAT 4678 48.013 10.693 104.568 1.00 0.00 O ATOM 8390 H1 WAT 4678 48.363 11.104 103.777 1.00 0.00 H ATOM 8391 H2 WAT 4678 47.851 11.424 105.165 1.00 0.00 H TER 8393 WAT 4678 ATOM 8393 O WAT 4679 115.609 67.284 13.003 1.00 0.00 O ATOM 8394 H1 WAT 4679 116.086 66.674 12.440 1.00 0.00 H ATOM 8395 H2 WAT 4679 114.695 67.194 12.733 1.00 0.00 H TER 8397 WAT 4679 ATOM 8397 O WAT 4680 71.435 84.649 22.552 1.00 0.00 O ATOM 8398 H1 WAT 4680 70.814 84.463 23.256 1.00 0.00 H ATOM 8399 H2 WAT 4680 72.085 85.226 22.953 1.00 0.00 H TER 8401 WAT 4680 ATOM 8401 O WAT 4681 59.912 140.853 123.289 1.00 0.00 O ATOM 8402 H1 WAT 4681 60.867 140.843 123.346 1.00 0.00 H ATOM 8403 H2 WAT 4681 59.690 140.043 122.831 1.00 0.00 H TER 8405 WAT 4681 ATOM 8405 O WAT 4682 34.768 28.942 152.136 1.00 0.00 O ATOM 8406 H1 WAT 4682 33.982 29.349 152.499 1.00 0.00 H ATOM 8407 H2 WAT 4682 34.555 28.010 152.089 1.00 0.00 H TER 8409 WAT 4682 ATOM 8409 O WAT 4683 4.829 52.773 154.583 1.00 0.00 O ATOM 8410 H1 WAT 4683 4.548 53.678 154.719 1.00 0.00 H ATOM 8411 H2 WAT 4683 4.126 52.245 154.960 1.00 0.00 H TER 8413 WAT 4683 ATOM 8413 O WAT 4684 3.883 100.168 92.812 1.00 0.00 O ATOM 8414 H1 WAT 4684 4.032 100.196 93.757 1.00 0.00 H ATOM 8415 H2 WAT 4684 3.896 101.086 92.541 1.00 0.00 H TER 8417 WAT 4684 ATOM 8417 O WAT 4685 46.868 127.711 134.224 1.00 0.00 O ATOM 8418 H1 WAT 4685 46.863 128.212 135.040 1.00 0.00 H ATOM 8419 H2 WAT 4685 47.581 128.094 133.713 1.00 0.00 H TER 8421 WAT 4685 ATOM 8421 O WAT 4686 111.565 25.600 9.781 1.00 0.00 O ATOM 8422 H1 WAT 4686 111.767 26.503 10.026 1.00 0.00 H ATOM 8423 H2 WAT 4686 112.241 25.367 9.144 1.00 0.00 H TER 8425 WAT 4686 ATOM 8425 O WAT 4687 2.831 27.105 74.196 1.00 0.00 O ATOM 8426 H1 WAT 4687 2.796 26.162 74.352 1.00 0.00 H ATOM 8427 H2 WAT 4687 2.830 27.493 75.071 1.00 0.00 H TER 8429 WAT 4687 ATOM 8429 O WAT 4688 76.010 134.396 77.436 1.00 0.00 O ATOM 8430 H1 WAT 4688 76.299 133.536 77.131 1.00 0.00 H ATOM 8431 H2 WAT 4688 75.575 134.221 78.271 1.00 0.00 H TER 8433 WAT 4688 ATOM 8433 O WAT 4689 3.173 108.300 118.884 1.00 0.00 O ATOM 8434 H1 WAT 4689 2.227 108.355 118.749 1.00 0.00 H ATOM 8435 H2 WAT 4689 3.287 107.562 119.483 1.00 0.00 H TER 8437 WAT 4689 ATOM 8437 O WAT 4690 45.257 57.768 125.297 1.00 0.00 O ATOM 8438 H1 WAT 4690 44.640 58.233 125.862 1.00 0.00 H ATOM 8439 H2 WAT 4690 45.064 56.842 125.445 1.00 0.00 H TER 8441 WAT 4690 ATOM 8441 O WAT 4691 1.495 18.543 127.824 1.00 0.00 O ATOM 8442 H1 WAT 4691 1.738 19.186 128.490 1.00 0.00 H ATOM 8443 H2 WAT 4691 1.970 18.819 127.041 1.00 0.00 H TER 8445 WAT 4691 ATOM 8445 O WAT 4692 20.761 134.229 18.652 1.00 0.00 O ATOM 8446 H1 WAT 4692 21.138 135.053 18.959 1.00 0.00 H ATOM 8447 H2 WAT 4692 19.879 134.461 18.363 1.00 0.00 H TER 8449 WAT 4692 ATOM 8449 O WAT 4693 59.676 27.793 25.408 1.00 0.00 O ATOM 8450 H1 WAT 4693 59.903 28.438 24.739 1.00 0.00 H ATOM 8451 H2 WAT 4693 59.814 26.947 24.982 1.00 0.00 H TER 8453 WAT 4693 ATOM 8453 O WAT 4694 129.294 109.087 113.883 1.00 0.00 O ATOM 8454 H1 WAT 4694 129.353 110.008 114.138 1.00 0.00 H ATOM 8455 H2 WAT 4694 129.947 108.645 114.426 1.00 0.00 H TER 8457 WAT 4694 ATOM 8457 O WAT 4695 59.234 8.057 123.800 1.00 0.00 O ATOM 8458 H1 WAT 4695 59.494 7.240 124.226 1.00 0.00 H ATOM 8459 H2 WAT 4695 58.846 7.780 122.970 1.00 0.00 H TER 8461 WAT 4695 ATOM 8461 O WAT 4696 20.422 87.910 82.340 1.00 0.00 O ATOM 8462 H1 WAT 4696 19.625 87.501 82.675 1.00 0.00 H ATOM 8463 H2 WAT 4696 20.312 87.906 81.389 1.00 0.00 H TER 8465 WAT 4696 ATOM 8465 O WAT 4697 46.642 30.610 103.984 1.00 0.00 O ATOM 8466 H1 WAT 4697 45.734 30.514 103.696 1.00 0.00 H ATOM 8467 H2 WAT 4697 47.023 29.739 103.868 1.00 0.00 H TER 8469 WAT 4697 ATOM 8469 O WAT 4698 26.000 84.209 8.511 1.00 0.00 O ATOM 8470 H1 WAT 4698 26.268 83.297 8.618 1.00 0.00 H ATOM 8471 H2 WAT 4698 25.362 84.190 7.798 1.00 0.00 H TER 8473 WAT 4698 ATOM 8473 O WAT 4699 96.955 41.408 110.328 1.00 0.00 O ATOM 8474 H1 WAT 4699 96.669 42.206 109.885 1.00 0.00 H ATOM 8475 H2 WAT 4699 96.478 41.410 111.158 1.00 0.00 H TER 8477 WAT 4699 ATOM 8477 O WAT 4700 47.558 122.811 157.230 1.00 0.00 O ATOM 8478 H1 WAT 4700 46.675 122.713 157.586 1.00 0.00 H ATOM 8479 H2 WAT 4700 47.640 123.747 157.047 1.00 0.00 H TER 8481 WAT 4700 ATOM 8481 O WAT 4701 72.760 26.131 67.800 1.00 0.00 O ATOM 8482 H1 WAT 4701 72.473 26.850 67.236 1.00 0.00 H ATOM 8483 H2 WAT 4701 72.781 26.510 68.679 1.00 0.00 H TER 8485 WAT 4701 ATOM 8485 O WAT 4702 41.346 70.840 88.336 1.00 0.00 O ATOM 8486 H1 WAT 4702 40.634 71.081 87.743 1.00 0.00 H ATOM 8487 H2 WAT 4702 41.071 70.004 88.713 1.00 0.00 H TER 8489 WAT 4702 ATOM 8489 O WAT 4703 122.155 100.168 79.384 1.00 0.00 O ATOM 8490 H1 WAT 4703 122.128 99.752 78.522 1.00 0.00 H ATOM 8491 H2 WAT 4703 122.358 101.085 79.201 1.00 0.00 H TER 8493 WAT 4703 ATOM 8493 O WAT 4704 126.207 119.753 120.184 1.00 0.00 O ATOM 8494 H1 WAT 4704 126.590 119.185 120.852 1.00 0.00 H ATOM 8495 H2 WAT 4704 125.324 119.938 120.504 1.00 0.00 H TER 8497 WAT 4704 ATOM 8497 O WAT 4705 139.043 15.537 124.035 1.00 0.00 O ATOM 8498 H1 WAT 4705 138.417 15.413 124.749 1.00 0.00 H ATOM 8499 H2 WAT 4705 139.742 14.909 124.218 1.00 0.00 H TER 8501 WAT 4705 ATOM 8501 O WAT 4706 45.179 93.444 100.471 1.00 0.00 O ATOM 8502 H1 WAT 4706 45.684 93.882 101.155 1.00 0.00 H ATOM 8503 H2 WAT 4706 45.786 93.369 99.735 1.00 0.00 H TER 8505 WAT 4706 ATOM 8505 O WAT 4707 52.911 41.344 8.068 1.00 0.00 O ATOM 8506 H1 WAT 4707 53.054 40.399 8.129 1.00 0.00 H ATOM 8507 H2 WAT 4707 51.960 41.446 8.106 1.00 0.00 H TER 8509 WAT 4707 ATOM 8509 O WAT 4708 26.204 54.291 74.599 1.00 0.00 O ATOM 8510 H1 WAT 4708 26.327 53.346 74.681 1.00 0.00 H ATOM 8511 H2 WAT 4708 25.883 54.566 75.458 1.00 0.00 H TER 8513 WAT 4708 ATOM 8513 O WAT 4709 42.713 126.701 149.930 1.00 0.00 O ATOM 8514 H1 WAT 4709 41.850 126.306 150.057 1.00 0.00 H ATOM 8515 H2 WAT 4709 42.529 127.618 149.724 1.00 0.00 H TER 8517 WAT 4709 ATOM 8517 O WAT 4710 96.647 134.341 128.430 1.00 0.00 O ATOM 8518 H1 WAT 4710 96.780 133.619 127.816 1.00 0.00 H ATOM 8519 H2 WAT 4710 97.455 134.373 128.942 1.00 0.00 H TER 8521 WAT 4710 ATOM 8521 O WAT 4711 132.403 52.476 72.717 1.00 0.00 O ATOM 8522 H1 WAT 4711 132.782 51.626 72.943 1.00 0.00 H ATOM 8523 H2 WAT 4711 131.589 52.516 73.219 1.00 0.00 H TER 8525 WAT 4711 ATOM 8525 O WAT 4712 85.288 141.335 117.295 1.00 0.00 O ATOM 8526 H1 WAT 4712 84.653 141.308 118.010 1.00 0.00 H ATOM 8527 H2 WAT 4712 86.140 141.342 117.732 1.00 0.00 H TER 8529 WAT 4712 ATOM 8529 O WAT 4713 24.934 20.520 142.332 1.00 0.00 O ATOM 8530 H1 WAT 4713 24.277 20.049 142.845 1.00 0.00 H ATOM 8531 H2 WAT 4713 24.718 21.444 142.457 1.00 0.00 H TER 8533 WAT 4713 ATOM 8533 O WAT 4714 62.040 56.206 138.099 1.00 0.00 O ATOM 8534 H1 WAT 4714 61.704 55.366 138.411 1.00 0.00 H ATOM 8535 H2 WAT 4714 62.603 55.979 137.359 1.00 0.00 H TER 8537 WAT 4714 ATOM 8537 O WAT 4715 32.613 103.133 18.812 1.00 0.00 O ATOM 8538 H1 WAT 4715 32.314 102.617 19.562 1.00 0.00 H ATOM 8539 H2 WAT 4715 31.937 103.002 18.147 1.00 0.00 H TER 8541 WAT 4715 ATOM 8541 O WAT 4716 109.425 28.661 2.000 1.00 0.00 O ATOM 8542 H1 WAT 4716 109.056 29.457 1.618 1.00 0.00 H ATOM 8543 H2 WAT 4716 108.785 27.979 1.795 1.00 0.00 H TER 8545 WAT 4716 ATOM 8545 O WAT 4717 137.931 53.601 80.598 1.00 0.00 O ATOM 8546 H1 WAT 4717 138.133 53.071 79.827 1.00 0.00 H ATOM 8547 H2 WAT 4717 138.770 53.700 81.047 1.00 0.00 H TER 8549 WAT 4717 ATOM 8549 O WAT 4718 45.200 26.877 144.975 1.00 0.00 O ATOM 8550 H1 WAT 4718 45.592 26.876 145.848 1.00 0.00 H ATOM 8551 H2 WAT 4718 45.070 27.803 144.772 1.00 0.00 H TER 8553 WAT 4718 ATOM 8553 O WAT 4719 104.998 130.696 67.420 1.00 0.00 O ATOM 8554 H1 WAT 4719 104.806 129.817 67.094 1.00 0.00 H ATOM 8555 H2 WAT 4719 105.341 130.554 68.302 1.00 0.00 H TER 8557 WAT 4719 ATOM 8557 O WAT 4720 7.352 42.885 73.133 1.00 0.00 O ATOM 8558 H1 WAT 4720 7.403 41.970 72.856 1.00 0.00 H ATOM 8559 H2 WAT 4720 8.175 43.272 72.833 1.00 0.00 H TER 8561 WAT 4720 ATOM 8561 O WAT 4721 103.498 17.530 89.781 1.00 0.00 O ATOM 8562 H1 WAT 4721 104.441 17.623 89.641 1.00 0.00 H ATOM 8563 H2 WAT 4721 103.229 16.856 89.158 1.00 0.00 H TER 8565 WAT 4721 ATOM 8565 O WAT 4722 48.612 52.414 154.611 1.00 0.00 O ATOM 8566 H1 WAT 4722 47.814 52.543 154.098 1.00 0.00 H ATOM 8567 H2 WAT 4722 49.205 51.951 154.020 1.00 0.00 H TER 8569 WAT 4722 ATOM 8569 O WAT 4723 78.867 56.381 158.536 1.00 0.00 O ATOM 8570 H1 WAT 4723 79.091 57.116 157.965 1.00 0.00 H ATOM 8571 H2 WAT 4723 79.704 56.103 158.908 1.00 0.00 H TER 8573 WAT 4723 ATOM 8573 O WAT 4724 62.836 23.099 57.180 1.00 0.00 O ATOM 8574 H1 WAT 4724 63.574 23.214 56.582 1.00 0.00 H ATOM 8575 H2 WAT 4724 62.610 23.987 57.456 1.00 0.00 H TER 8577 WAT 4724 ATOM 8577 O WAT 4725 52.583 46.053 6.508 1.00 0.00 O ATOM 8578 H1 WAT 4725 52.287 45.719 7.355 1.00 0.00 H ATOM 8579 H2 WAT 4725 52.755 45.268 5.988 1.00 0.00 H TER 8581 WAT 4725 ATOM 8581 O WAT 4726 131.971 52.714 62.384 1.00 0.00 O ATOM 8582 H1 WAT 4726 132.144 51.824 62.691 1.00 0.00 H ATOM 8583 H2 WAT 4726 131.631 53.171 63.154 1.00 0.00 H TER 8585 WAT 4726 ATOM 8585 O WAT 4727 51.536 40.105 97.921 1.00 0.00 O ATOM 8586 H1 WAT 4727 51.218 39.595 97.176 1.00 0.00 H ATOM 8587 H2 WAT 4727 52.292 40.582 97.579 1.00 0.00 H TER 8589 WAT 4727 ATOM 8589 O WAT 4728 128.311 7.861 126.863 1.00 0.00 O ATOM 8590 H1 WAT 4728 128.671 8.162 126.029 1.00 0.00 H ATOM 8591 H2 WAT 4728 127.877 7.034 126.653 1.00 0.00 H TER 8593 WAT 4728 ATOM 8593 O WAT 4729 95.854 62.938 149.239 1.00 0.00 O ATOM 8594 H1 WAT 4729 96.071 62.013 149.119 1.00 0.00 H ATOM 8595 H2 WAT 4729 96.654 63.327 149.593 1.00 0.00 H TER 8597 WAT 4729 ATOM 8597 O WAT 4730 75.378 50.552 65.077 1.00 0.00 O ATOM 8598 H1 WAT 4730 75.615 50.353 65.983 1.00 0.00 H ATOM 8599 H2 WAT 4730 74.795 51.309 65.143 1.00 0.00 H TER 8601 WAT 4730 ATOM 8601 O WAT 4731 10.662 94.242 112.970 1.00 0.00 O ATOM 8602 H1 WAT 4731 10.599 94.122 113.917 1.00 0.00 H ATOM 8603 H2 WAT 4731 10.177 93.503 112.602 1.00 0.00 H TER 8605 WAT 4731 ATOM 8605 O WAT 4732 61.619 21.989 89.058 1.00 0.00 O ATOM 8606 H1 WAT 4732 62.398 22.466 89.342 1.00 0.00 H ATOM 8607 H2 WAT 4732 61.071 22.652 88.640 1.00 0.00 H TER 8609 WAT 4732 ATOM 8609 O WAT 4733 84.287 17.198 94.462 1.00 0.00 O ATOM 8610 H1 WAT 4733 85.110 17.223 94.950 1.00 0.00 H ATOM 8611 H2 WAT 4733 84.378 16.447 93.876 1.00 0.00 H TER 8613 WAT 4733 ATOM 8613 O WAT 4734 1.190 34.369 114.387 1.00 0.00 O ATOM 8614 H1 WAT 4734 1.050 34.517 113.452 1.00 0.00 H ATOM 8615 H2 WAT 4734 1.555 35.194 114.708 1.00 0.00 H TER 8617 WAT 4734 ATOM 8617 O WAT 4735 36.400 41.224 130.119 1.00 0.00 O ATOM 8618 H1 WAT 4735 35.859 41.840 129.624 1.00 0.00 H ATOM 8619 H2 WAT 4735 36.980 41.779 130.639 1.00 0.00 H TER 8621 WAT 4735 ATOM 8621 O WAT 4736 3.206 15.259 152.620 1.00 0.00 O ATOM 8622 H1 WAT 4736 3.511 16.153 152.466 1.00 0.00 H ATOM 8623 H2 WAT 4736 2.527 15.121 151.960 1.00 0.00 H TER 8625 WAT 4736 ATOM 8625 O WAT 4737 88.051 127.702 77.250 1.00 0.00 O ATOM 8626 H1 WAT 4737 87.684 128.404 77.788 1.00 0.00 H ATOM 8627 H2 WAT 4737 88.514 127.141 77.873 1.00 0.00 H TER 8629 WAT 4737 ATOM 8629 O WAT 4738 52.900 105.542 20.940 1.00 0.00 O ATOM 8630 H1 WAT 4738 53.655 105.063 21.284 1.00 0.00 H ATOM 8631 H2 WAT 4738 52.880 106.353 21.448 1.00 0.00 H TER 8633 WAT 4738 ATOM 8633 O WAT 4739 19.418 64.656 73.478 1.00 0.00 O ATOM 8634 H1 WAT 4739 19.420 63.702 73.395 1.00 0.00 H ATOM 8635 H2 WAT 4739 18.973 64.823 74.309 1.00 0.00 H TER 8637 WAT 4739 ATOM 8637 O WAT 4740 60.895 57.304 102.625 1.00 0.00 O ATOM 8638 H1 WAT 4740 61.746 57.031 102.970 1.00 0.00 H ATOM 8639 H2 WAT 4740 60.529 57.865 103.309 1.00 0.00 H TER 8641 WAT 4740 ATOM 8641 O WAT 4741 113.922 125.163 68.437 1.00 0.00 O ATOM 8642 H1 WAT 4741 114.052 124.891 67.528 1.00 0.00 H ATOM 8643 H2 WAT 4741 114.079 126.107 68.429 1.00 0.00 H TER 8645 WAT 4741 ATOM 8645 O WAT 4742 135.810 46.528 120.545 1.00 0.00 O ATOM 8646 H1 WAT 4742 134.882 46.331 120.415 1.00 0.00 H ATOM 8647 H2 WAT 4742 136.108 45.873 121.175 1.00 0.00 H TER 8649 WAT 4742 ATOM 8649 O WAT 4743 94.797 63.215 107.070 1.00 0.00 O ATOM 8650 H1 WAT 4743 95.006 62.987 106.164 1.00 0.00 H ATOM 8651 H2 WAT 4743 94.022 63.773 107.005 1.00 0.00 H TER 8653 WAT 4743 ATOM 8653 O WAT 4744 10.245 112.776 94.985 1.00 0.00 O ATOM 8654 H1 WAT 4744 10.297 112.487 94.074 1.00 0.00 H ATOM 8655 H2 WAT 4744 9.609 113.492 94.973 1.00 0.00 H TER 8657 WAT 4744 ATOM 8657 O WAT 4745 83.468 122.386 93.495 1.00 0.00 O ATOM 8658 H1 WAT 4745 82.836 122.963 93.068 1.00 0.00 H ATOM 8659 H2 WAT 4745 84.009 122.972 94.024 1.00 0.00 H TER 8661 WAT 4745 ATOM 8661 O WAT 4746 25.485 125.529 65.529 1.00 0.00 O ATOM 8662 H1 WAT 4746 25.424 124.593 65.336 1.00 0.00 H ATOM 8663 H2 WAT 4746 24.794 125.686 66.172 1.00 0.00 H TER 8665 WAT 4746 ATOM 8665 O WAT 4747 54.455 101.205 105.577 1.00 0.00 O ATOM 8666 H1 WAT 4747 54.664 101.485 104.686 1.00 0.00 H ATOM 8667 H2 WAT 4747 55.201 101.499 106.101 1.00 0.00 H TER 8669 WAT 4747 ATOM 8669 O WAT 4748 64.547 95.380 94.495 1.00 0.00 O ATOM 8670 H1 WAT 4748 63.792 94.815 94.656 1.00 0.00 H ATOM 8671 H2 WAT 4748 64.198 96.103 93.973 1.00 0.00 H TER 8673 WAT 4748 ATOM 8673 O WAT 4749 30.038 122.497 152.379 1.00 0.00 O ATOM 8674 H1 WAT 4749 29.999 121.843 151.681 1.00 0.00 H ATOM 8675 H2 WAT 4749 29.246 122.344 152.895 1.00 0.00 H TER 8677 WAT 4749 ATOM 8677 O WAT 4750 57.598 26.076 7.514 1.00 0.00 O ATOM 8678 H1 WAT 4750 56.689 26.233 7.259 1.00 0.00 H ATOM 8679 H2 WAT 4750 58.116 26.519 6.842 1.00 0.00 H TER 8681 WAT 4750 ATOM 8681 O WAT 4751 73.775 37.532 94.649 1.00 0.00 O ATOM 8682 H1 WAT 4751 74.534 38.021 94.967 1.00 0.00 H ATOM 8683 H2 WAT 4751 73.108 38.200 94.492 1.00 0.00 H TER 8685 WAT 4751 ATOM 8685 O WAT 4752 141.939 43.573 65.038 1.00 0.00 O ATOM 8686 H1 WAT 4752 141.085 43.508 64.613 1.00 0.00 H ATOM 8687 H2 WAT 4752 142.047 42.735 65.489 1.00 0.00 H TER 8689 WAT 4752 ATOM 8689 O WAT 4753 11.550 87.918 69.420 1.00 0.00 O ATOM 8690 H1 WAT 4753 12.167 88.599 69.153 1.00 0.00 H ATOM 8691 H2 WAT 4753 11.363 88.111 70.339 1.00 0.00 H TER 8693 WAT 4753 ATOM 8693 O WAT 4754 42.378 93.297 137.446 1.00 0.00 O ATOM 8694 H1 WAT 4754 42.472 93.068 136.521 1.00 0.00 H ATOM 8695 H2 WAT 4754 43.157 93.817 137.645 1.00 0.00 H TER 8697 WAT 4754 ATOM 8697 O WAT 4755 88.567 109.070 84.834 1.00 0.00 O ATOM 8698 H1 WAT 4755 89.413 109.459 85.054 1.00 0.00 H ATOM 8699 H2 WAT 4755 88.039 109.804 84.521 1.00 0.00 H TER 8701 WAT 4755 ATOM 8701 O WAT 4756 63.564 136.851 78.266 1.00 0.00 O ATOM 8702 H1 WAT 4756 63.684 136.552 79.168 1.00 0.00 H ATOM 8703 H2 WAT 4756 63.724 137.794 78.303 1.00 0.00 H TER 8705 WAT 4756 ATOM 8705 O WAT 4757 61.858 124.534 132.113 1.00 0.00 O ATOM 8706 H1 WAT 4757 62.268 124.897 131.328 1.00 0.00 H ATOM 8707 H2 WAT 4757 61.663 125.297 132.656 1.00 0.00 H TER 8709 WAT 4757 ATOM 8709 O WAT 4758 73.152 86.507 18.028 1.00 0.00 O ATOM 8710 H1 WAT 4758 72.359 86.565 18.561 1.00 0.00 H ATOM 8711 H2 WAT 4758 73.014 85.738 17.476 1.00 0.00 H TER 8713 WAT 4758 ATOM 8713 O WAT 4759 44.186 71.894 83.078 1.00 0.00 O ATOM 8714 H1 WAT 4759 43.412 72.179 82.593 1.00 0.00 H ATOM 8715 H2 WAT 4759 44.015 70.975 83.283 1.00 0.00 H TER 8717 WAT 4759 ATOM 8717 O WAT 4760 55.676 48.590 70.924 1.00 0.00 O ATOM 8718 H1 WAT 4760 54.743 48.492 71.111 1.00 0.00 H ATOM 8719 H2 WAT 4760 55.982 49.232 71.564 1.00 0.00 H TER 8721 WAT 4760 ATOM 8721 O WAT 4761 89.863 30.309 108.577 1.00 0.00 O ATOM 8722 H1 WAT 4761 89.485 29.462 108.812 1.00 0.00 H ATOM 8723 H2 WAT 4761 90.724 30.311 108.994 1.00 0.00 H TER 8725 WAT 4761 ATOM 8725 O WAT 4762 77.012 93.122 89.690 1.00 0.00 O ATOM 8726 H1 WAT 4762 77.609 92.421 89.430 1.00 0.00 H ATOM 8727 H2 WAT 4762 77.395 93.915 89.315 1.00 0.00 H TER 8729 WAT 4762 ATOM 8729 O WAT 4763 96.771 120.154 104.365 1.00 0.00 O ATOM 8730 H1 WAT 4763 96.552 120.324 103.449 1.00 0.00 H ATOM 8731 H2 WAT 4763 97.317 120.897 104.623 1.00 0.00 H TER 8733 WAT 4763 ATOM 8733 O WAT 4764 139.504 10.571 147.214 1.00 0.00 O ATOM 8734 H1 WAT 4764 139.446 10.391 148.152 1.00 0.00 H ATOM 8735 H2 WAT 4764 140.198 11.227 147.139 1.00 0.00 H TER 8737 WAT 4764 ATOM 8737 O WAT 4765 3.520 66.387 133.162 1.00 0.00 O ATOM 8738 H1 WAT 4765 4.070 66.560 133.926 1.00 0.00 H ATOM 8739 H2 WAT 4765 2.716 66.879 133.330 1.00 0.00 H TER 8741 WAT 4765 ATOM 8741 O WAT 4766 139.817 145.997 123.996 1.00 0.00 O ATOM 8742 H1 WAT 4766 140.390 145.748 123.271 1.00 0.00 H ATOM 8743 H2 WAT 4766 140.340 145.831 124.781 1.00 0.00 H TER 8745 WAT 4766 ATOM 8745 O WAT 4767 66.572 113.389 15.541 1.00 0.00 O ATOM 8746 H1 WAT 4767 66.607 113.076 14.637 1.00 0.00 H ATOM 8747 H2 WAT 4767 66.248 114.287 15.471 1.00 0.00 H TER 8749 WAT 4767 ATOM 8749 O WAT 4768 81.878 61.514 101.237 1.00 0.00 O ATOM 8750 H1 WAT 4768 82.217 61.335 100.360 1.00 0.00 H ATOM 8751 H2 WAT 4768 81.279 62.251 101.117 1.00 0.00 H TER 8753 WAT 4768 ATOM 8753 O WAT 4769 136.786 143.653 111.469 1.00 0.00 O ATOM 8754 H1 WAT 4769 135.933 143.765 111.049 1.00 0.00 H ATOM 8755 H2 WAT 4769 137.403 143.573 110.742 1.00 0.00 H TER 8757 WAT 4769 ATOM 8757 O WAT 4770 105.235 33.441 76.997 1.00 0.00 O ATOM 8758 H1 WAT 4770 105.589 32.964 77.747 1.00 0.00 H ATOM 8759 H2 WAT 4770 104.403 33.797 77.309 1.00 0.00 H TER 8761 WAT 4770 ATOM 8761 O WAT 4771 98.679 46.664 151.469 1.00 0.00 O ATOM 8762 H1 WAT 4771 99.127 46.758 152.309 1.00 0.00 H ATOM 8763 H2 WAT 4771 99.335 46.278 150.889 1.00 0.00 H TER 8765 WAT 4771 ATOM 8765 O WAT 4772 112.493 145.326 104.843 1.00 0.00 O ATOM 8766 H1 WAT 4772 111.686 144.853 104.644 1.00 0.00 H ATOM 8767 H2 WAT 4772 112.604 145.931 104.109 1.00 0.00 H TER 8769 WAT 4772 ATOM 8769 O WAT 4773 88.315 14.767 57.694 1.00 0.00 O ATOM 8770 H1 WAT 4773 87.632 15.007 57.068 1.00 0.00 H ATOM 8771 H2 WAT 4773 89.084 14.587 57.152 1.00 0.00 H TER 8773 WAT 4773 ATOM 8773 O WAT 4774 74.454 56.738 25.864 1.00 0.00 O ATOM 8774 H1 WAT 4774 75.100 57.341 25.497 1.00 0.00 H ATOM 8775 H2 WAT 4774 73.647 57.250 25.912 1.00 0.00 H TER 8777 WAT 4774 ATOM 8777 O WAT 4775 80.589 29.382 117.029 1.00 0.00 O ATOM 8778 H1 WAT 4775 79.925 29.766 116.457 1.00 0.00 H ATOM 8779 H2 WAT 4775 80.300 28.478 117.159 1.00 0.00 H TER 8781 WAT 4775 ATOM 8781 O WAT 4776 32.164 77.061 77.576 1.00 0.00 O ATOM 8782 H1 WAT 4776 31.541 77.751 77.805 1.00 0.00 H ATOM 8783 H2 WAT 4776 32.906 77.526 77.191 1.00 0.00 H TER 8785 WAT 4776 ATOM 8785 O WAT 4777 122.397 69.354 108.850 1.00 0.00 O ATOM 8786 H1 WAT 4777 122.457 70.158 108.335 1.00 0.00 H ATOM 8787 H2 WAT 4777 123.284 69.215 109.182 1.00 0.00 H TER 8789 WAT 4777 ATOM 8789 O WAT 4778 100.328 68.852 119.255 1.00 0.00 O ATOM 8790 H1 WAT 4778 100.778 68.035 119.468 1.00 0.00 H ATOM 8791 H2 WAT 4778 100.970 69.355 118.754 1.00 0.00 H TER 8793 WAT 4778 ATOM 8793 O WAT 4779 88.881 73.223 132.710 1.00 0.00 O ATOM 8794 H1 WAT 4779 88.156 73.756 132.383 1.00 0.00 H ATOM 8795 H2 WAT 4779 88.893 72.457 132.137 1.00 0.00 H TER 8797 WAT 4779 ATOM 8797 O WAT 4780 117.576 90.716 114.482 1.00 0.00 O ATOM 8798 H1 WAT 4780 116.868 91.303 114.217 1.00 0.00 H ATOM 8799 H2 WAT 4780 117.687 90.882 115.418 1.00 0.00 H TER 8801 WAT 4780 ATOM 8801 O WAT 4781 35.326 140.375 105.392 1.00 0.00 O ATOM 8802 H1 WAT 4781 35.412 141.003 106.109 1.00 0.00 H ATOM 8803 H2 WAT 4781 36.206 140.017 105.280 1.00 0.00 H TER 8805 WAT 4781 ATOM 8805 O WAT 4782 101.568 110.594 16.750 1.00 0.00 O ATOM 8806 H1 WAT 4782 100.672 110.328 16.956 1.00 0.00 H ATOM 8807 H2 WAT 4782 101.466 111.372 16.201 1.00 0.00 H TER 8809 WAT 4782 ATOM 8809 O WAT 4783 46.897 10.448 113.557 1.00 0.00 O ATOM 8810 H1 WAT 4783 47.848 10.453 113.659 1.00 0.00 H ATOM 8811 H2 WAT 4783 46.703 9.599 113.160 1.00 0.00 H TER 8813 WAT 4783 ATOM 8813 O WAT 4784 3.283 94.488 2.865 1.00 0.00 O ATOM 8814 H1 WAT 4784 4.164 94.863 2.897 1.00 0.00 H ATOM 8815 H2 WAT 4784 3.427 93.542 2.829 1.00 0.00 H TER 8817 WAT 4784 ATOM 8817 O WAT 4785 130.226 65.394 73.971 1.00 0.00 O ATOM 8818 H1 WAT 4785 129.965 64.726 73.337 1.00 0.00 H ATOM 8819 H2 WAT 4785 131.077 65.701 73.659 1.00 0.00 H TER 8821 WAT 4785 ATOM 8821 O WAT 4786 130.166 135.365 12.929 1.00 0.00 O ATOM 8822 H1 WAT 4786 131.108 135.222 12.840 1.00 0.00 H ATOM 8823 H2 WAT 4786 130.092 136.236 13.319 1.00 0.00 H TER 8825 WAT 4786 ATOM 8825 O WAT 4787 36.002 112.120 4.255 1.00 0.00 O ATOM 8826 H1 WAT 4787 35.337 111.917 3.597 1.00 0.00 H ATOM 8827 H2 WAT 4787 36.118 111.302 4.739 1.00 0.00 H TER 8829 WAT 4787 ATOM 8829 O WAT 4788 104.525 92.673 62.374 1.00 0.00 O ATOM 8830 H1 WAT 4788 104.434 93.213 61.589 1.00 0.00 H ATOM 8831 H2 WAT 4788 105.095 91.953 62.104 1.00 0.00 H TER 8833 WAT 4788 ATOM 8833 O WAT 4789 70.755 113.964 8.229 1.00 0.00 O ATOM 8834 H1 WAT 4789 70.890 113.328 7.526 1.00 0.00 H ATOM 8835 H2 WAT 4789 70.161 114.614 7.853 1.00 0.00 H TER 8837 WAT 4789 ATOM 8837 O WAT 4790 121.466 26.909 83.157 1.00 0.00 O ATOM 8838 H1 WAT 4790 121.616 27.841 83.315 1.00 0.00 H ATOM 8839 H2 WAT 4790 120.585 26.868 82.786 1.00 0.00 H TER 8841 WAT 4790 ATOM 8841 O WAT 4791 9.012 9.914 119.778 1.00 0.00 O ATOM 8842 H1 WAT 4791 9.869 9.923 120.205 1.00 0.00 H ATOM 8843 H2 WAT 4791 8.431 9.498 120.415 1.00 0.00 H TER 8845 WAT 4791 ATOM 8845 O WAT 4792 92.282 41.340 76.091 1.00 0.00 O ATOM 8846 H1 WAT 4792 91.519 41.428 75.520 1.00 0.00 H ATOM 8847 H2 WAT 4792 92.674 40.503 75.839 1.00 0.00 H TER 8849 WAT 4792 ATOM 8849 O WAT 4793 4.635 95.376 78.827 1.00 0.00 O ATOM 8850 H1 WAT 4793 5.479 94.993 78.586 1.00 0.00 H ATOM 8851 H2 WAT 4793 4.862 96.136 79.363 1.00 0.00 H TER 8853 WAT 4793 ATOM 8853 O WAT 4794 39.443 144.040 105.296 1.00 0.00 O ATOM 8854 H1 WAT 4794 39.149 143.911 106.198 1.00 0.00 H ATOM 8855 H2 WAT 4794 38.787 143.591 104.763 1.00 0.00 H TER 8857 WAT 4794 ATOM 8857 O WAT 4795 127.264 135.186 75.849 1.00 0.00 O ATOM 8858 H1 WAT 4795 127.936 135.367 75.192 1.00 0.00 H ATOM 8859 H2 WAT 4795 126.533 135.754 75.605 1.00 0.00 H TER 8861 WAT 4795 ATOM 8861 O WAT 4796 143.104 26.510 2.541 1.00 0.00 O ATOM 8862 H1 WAT 4796 143.942 26.192 2.876 1.00 0.00 H ATOM 8863 H2 WAT 4796 142.755 25.776 2.035 1.00 0.00 H TER 8865 WAT 4796 ATOM 8865 O WAT 4797 43.941 47.556 21.127 1.00 0.00 O ATOM 8866 H1 WAT 4797 43.975 48.278 21.754 1.00 0.00 H ATOM 8867 H2 WAT 4797 44.849 47.435 20.851 1.00 0.00 H TER 8869 WAT 4797 ATOM 8869 O WAT 4798 13.224 138.729 115.633 1.00 0.00 O ATOM 8870 H1 WAT 4798 13.481 138.377 114.781 1.00 0.00 H ATOM 8871 H2 WAT 4798 13.965 139.272 115.901 1.00 0.00 H TER 8873 WAT 4798 ATOM 8873 O WAT 4799 118.179 115.373 121.023 1.00 0.00 O ATOM 8874 H1 WAT 4799 119.092 115.612 121.182 1.00 0.00 H ATOM 8875 H2 WAT 4799 117.701 116.199 121.087 1.00 0.00 H TER 8877 WAT 4799 ATOM 8877 O WAT 4800 141.298 50.796 67.818 1.00 0.00 O ATOM 8878 H1 WAT 4800 141.766 50.004 68.083 1.00 0.00 H ATOM 8879 H2 WAT 4800 141.619 51.474 68.413 1.00 0.00 H TER 8881 WAT 4800 ATOM 8881 O WAT 4801 60.455 3.320 98.940 1.00 0.00 O ATOM 8882 H1 WAT 4801 59.727 3.544 98.360 1.00 0.00 H ATOM 8883 H2 WAT 4801 60.726 4.156 99.319 1.00 0.00 H TER 8885 WAT 4801 ATOM 8885 O WAT 4802 84.995 7.811 75.158 1.00 0.00 O ATOM 8886 H1 WAT 4802 84.772 7.963 76.076 1.00 0.00 H ATOM 8887 H2 WAT 4802 85.277 8.667 74.835 1.00 0.00 H TER 8889 WAT 4802 ATOM 8889 O WAT 4803 102.085 26.906 151.280 1.00 0.00 O ATOM 8890 H1 WAT 4803 101.949 27.452 152.054 1.00 0.00 H ATOM 8891 H2 WAT 4803 102.989 27.082 151.019 1.00 0.00 H TER 8893 WAT 4803 ATOM 8893 O WAT 4804 82.884 80.245 13.633 1.00 0.00 O ATOM 8894 H1 WAT 4804 82.500 80.870 13.018 1.00 0.00 H ATOM 8895 H2 WAT 4804 82.610 79.388 13.305 1.00 0.00 H TER 8897 WAT 4804 ATOM 8897 O WAT 4805 87.280 78.345 98.686 1.00 0.00 O ATOM 8898 H1 WAT 4805 87.894 78.930 98.242 1.00 0.00 H ATOM 8899 H2 WAT 4805 87.671 77.476 98.596 1.00 0.00 H TER 8901 WAT 4805 ATOM 8901 O WAT 4806 47.469 58.950 154.899 1.00 0.00 O ATOM 8902 H1 WAT 4806 46.601 58.845 154.510 1.00 0.00 H ATOM 8903 H2 WAT 4806 47.504 59.869 155.163 1.00 0.00 H TER 8905 WAT 4806 ATOM 8905 O WAT 4807 28.645 120.744 145.807 1.00 0.00 O ATOM 8906 H1 WAT 4807 28.006 121.359 145.447 1.00 0.00 H ATOM 8907 H2 WAT 4807 28.172 120.286 146.502 1.00 0.00 H TER 8909 WAT 4807 ATOM 8909 O WAT 4808 7.800 20.065 61.473 1.00 0.00 O ATOM 8910 H1 WAT 4808 8.085 19.383 60.864 1.00 0.00 H ATOM 8911 H2 WAT 4808 8.331 20.827 61.244 1.00 0.00 H TER 8913 WAT 4808 ATOM 8913 O WAT 4809 101.352 84.704 145.740 1.00 0.00 O ATOM 8914 H1 WAT 4809 101.761 85.570 145.736 1.00 0.00 H ATOM 8915 H2 WAT 4809 101.444 84.401 146.643 1.00 0.00 H TER 8917 WAT 4809 ATOM 8917 O WAT 4810 74.648 105.218 120.060 1.00 0.00 O ATOM 8918 H1 WAT 4810 74.788 104.527 119.412 1.00 0.00 H ATOM 8919 H2 WAT 4810 73.932 105.741 119.700 1.00 0.00 H TER 8921 WAT 4810 ATOM 8921 O WAT 4811 86.243 38.195 87.759 1.00 0.00 O ATOM 8922 H1 WAT 4811 86.932 38.858 87.736 1.00 0.00 H ATOM 8923 H2 WAT 4811 86.708 37.371 87.905 1.00 0.00 H TER 8925 WAT 4811 ATOM 8925 O WAT 4812 109.664 83.954 9.790 1.00 0.00 O ATOM 8926 H1 WAT 4812 109.631 83.776 10.730 1.00 0.00 H ATOM 8927 H2 WAT 4812 109.033 83.343 9.409 1.00 0.00 H TER 8929 WAT 4812 ATOM 8929 O WAT 4813 1.145 137.754 9.370 1.00 0.00 O ATOM 8930 H1 WAT 4813 1.948 138.257 9.237 1.00 0.00 H ATOM 8931 H2 WAT 4813 0.541 138.371 9.781 1.00 0.00 H TER 8933 WAT 4813 ATOM 8933 O WAT 4814 114.678 3.166 95.679 1.00 0.00 O ATOM 8934 H1 WAT 4814 115.454 2.770 96.074 1.00 0.00 H ATOM 8935 H2 WAT 4814 114.100 3.350 96.419 1.00 0.00 H TER 8937 WAT 4814 ATOM 8937 O WAT 4815 93.424 144.883 103.395 1.00 0.00 O ATOM 8938 H1 WAT 4815 93.480 143.958 103.636 1.00 0.00 H ATOM 8939 H2 WAT 4815 94.323 145.204 103.465 1.00 0.00 H TER 8941 WAT 4815 ATOM 8941 O WAT 4816 108.054 80.449 2.005 1.00 0.00 O ATOM 8942 H1 WAT 4816 107.435 80.520 1.279 1.00 0.00 H ATOM 8943 H2 WAT 4816 107.682 81.001 2.692 1.00 0.00 H TER 8945 WAT 4816 ATOM 8945 O WAT 4817 65.870 122.272 67.067 1.00 0.00 O ATOM 8946 H1 WAT 4817 65.039 122.633 66.758 1.00 0.00 H ATOM 8947 H2 WAT 4817 66.258 122.977 67.586 1.00 0.00 H TER 8949 WAT 4817 ATOM 8949 O WAT 4818 62.275 13.823 58.239 1.00 0.00 O ATOM 8950 H1 WAT 4818 61.335 13.903 58.396 1.00 0.00 H ATOM 8951 H2 WAT 4818 62.387 12.935 57.900 1.00 0.00 H TER 8953 WAT 4818 ATOM 8953 O WAT 4819 39.984 128.843 60.134 1.00 0.00 O ATOM 8954 H1 WAT 4819 40.880 129.060 59.877 1.00 0.00 H ATOM 8955 H2 WAT 4819 39.457 129.570 59.803 1.00 0.00 H TER 8957 WAT 4819 ATOM 8957 O WAT 4820 67.332 130.964 50.523 1.00 0.00 O ATOM 8958 H1 WAT 4820 66.808 131.591 50.025 1.00 0.00 H ATOM 8959 H2 WAT 4820 66.689 130.453 51.016 1.00 0.00 H TER 8961 WAT 4820 ATOM 8961 O WAT 4821 49.302 89.353 105.499 1.00 0.00 O ATOM 8962 H1 WAT 4821 48.491 89.262 104.998 1.00 0.00 H ATOM 8963 H2 WAT 4821 49.990 89.399 104.836 1.00 0.00 H TER 8965 WAT 4821 ATOM 8965 O WAT 4822 86.267 132.192 15.345 1.00 0.00 O ATOM 8966 H1 WAT 4822 86.746 133.002 15.174 1.00 0.00 H ATOM 8967 H2 WAT 4822 86.584 131.902 16.201 1.00 0.00 H TER 8969 WAT 4822 ATOM 8969 O WAT 4823 71.112 4.033 156.605 1.00 0.00 O ATOM 8970 H1 WAT 4823 71.900 3.955 157.142 1.00 0.00 H ATOM 8971 H2 WAT 4823 71.064 4.963 156.384 1.00 0.00 H TER 8973 WAT 4823 ATOM 8973 O WAT 4824 46.610 128.318 140.853 1.00 0.00 O ATOM 8974 H1 WAT 4824 46.096 127.529 140.685 1.00 0.00 H ATOM 8975 H2 WAT 4824 47.349 128.015 141.380 1.00 0.00 H TER 8977 WAT 4824 ATOM 8977 O WAT 4825 39.297 4.012 87.820 1.00 0.00 O ATOM 8978 H1 WAT 4825 39.243 3.059 87.890 1.00 0.00 H ATOM 8979 H2 WAT 4825 38.429 4.321 88.079 1.00 0.00 H TER 8981 WAT 4825 ATOM 8981 O WAT 4826 127.228 67.647 19.524 1.00 0.00 O ATOM 8982 H1 WAT 4826 127.298 66.754 19.188 1.00 0.00 H ATOM 8983 H2 WAT 4826 127.356 67.558 20.469 1.00 0.00 H TER 8985 WAT 4826 ATOM 8985 O WAT 4827 14.957 67.835 141.173 1.00 0.00 O ATOM 8986 H1 WAT 4827 14.038 67.824 141.441 1.00 0.00 H ATOM 8987 H2 WAT 4827 15.436 67.539 141.947 1.00 0.00 H TER 8989 WAT 4827 ATOM 8989 O WAT 4828 114.560 144.673 109.281 1.00 0.00 O ATOM 8990 H1 WAT 4828 114.470 143.736 109.106 1.00 0.00 H ATOM 8991 H2 WAT 4828 114.281 145.096 108.469 1.00 0.00 H TER 8993 WAT 4828 ATOM 8993 O WAT 4829 138.624 114.295 8.626 1.00 0.00 O ATOM 8994 H1 WAT 4829 138.705 113.442 8.200 1.00 0.00 H ATOM 8995 H2 WAT 4829 138.292 114.875 7.941 1.00 0.00 H TER 8997 WAT 4829 ATOM 8997 O WAT 4830 119.420 82.288 101.863 1.00 0.00 O ATOM 8998 H1 WAT 4830 120.047 82.621 102.505 1.00 0.00 H ATOM 8999 H2 WAT 4830 119.429 81.340 101.990 1.00 0.00 H TER 9001 WAT 4830 ATOM 9001 O WAT 4831 60.171 85.076 61.853 1.00 0.00 O ATOM 9002 H1 WAT 4831 60.892 84.611 61.428 1.00 0.00 H ATOM 9003 H2 WAT 4831 60.598 85.760 62.369 1.00 0.00 H TER 9005 WAT 4831 ATOM 9005 O WAT 4832 30.701 33.185 103.861 1.00 0.00 O ATOM 9006 H1 WAT 4832 30.992 32.408 103.384 1.00 0.00 H ATOM 9007 H2 WAT 4832 30.327 32.842 104.673 1.00 0.00 H TER 9009 WAT 4832 ATOM 9009 O WAT 4833 101.606 95.076 108.212 1.00 0.00 O ATOM 9010 H1 WAT 4833 101.110 94.314 108.511 1.00 0.00 H ATOM 9011 H2 WAT 4833 101.138 95.826 108.580 1.00 0.00 H TER 9013 WAT 4833 ATOM 9013 O WAT 4834 23.089 70.869 76.912 1.00 0.00 O ATOM 9014 H1 WAT 4834 23.598 71.634 77.178 1.00 0.00 H ATOM 9015 H2 WAT 4834 22.179 71.121 77.066 1.00 0.00 H TER 9017 WAT 4834 ATOM 9017 O WAT 4835 59.978 144.269 109.216 1.00 0.00 O ATOM 9018 H1 WAT 4835 59.693 145.179 109.131 1.00 0.00 H ATOM 9019 H2 WAT 4835 60.443 144.087 108.399 1.00 0.00 H TER 9021 WAT 4835 ATOM 9021 O WAT 4836 27.715 99.003 155.834 1.00 0.00 O ATOM 9022 H1 WAT 4836 26.934 98.490 156.039 1.00 0.00 H ATOM 9023 H2 WAT 4836 28.049 98.617 155.024 1.00 0.00 H TER 9025 WAT 4836 ATOM 9025 O WAT 4837 121.424 97.606 104.573 1.00 0.00 O ATOM 9026 H1 WAT 4837 120.672 97.078 104.840 1.00 0.00 H ATOM 9027 H2 WAT 4837 121.750 97.988 105.388 1.00 0.00 H TER 9029 WAT 4837 ATOM 9029 O WAT 4838 117.760 69.342 108.943 1.00 0.00 O ATOM 9030 H1 WAT 4838 118.629 69.419 109.338 1.00 0.00 H ATOM 9031 H2 WAT 4838 117.816 68.564 108.389 1.00 0.00 H TER 9033 WAT 4838 ATOM 9033 O WAT 4839 104.827 72.156 140.104 1.00 0.00 O ATOM 9034 H1 WAT 4839 104.310 72.103 139.300 1.00 0.00 H ATOM 9035 H2 WAT 4839 105.158 73.054 140.117 1.00 0.00 H TER 9037 WAT 4839 ATOM 9037 O WAT 4840 6.347 25.556 107.620 1.00 0.00 O ATOM 9038 H1 WAT 4840 6.814 26.277 107.198 1.00 0.00 H ATOM 9039 H2 WAT 4840 6.063 24.999 106.895 1.00 0.00 H TER 9041 WAT 4840 ATOM 9041 O WAT 4841 57.309 109.913 122.250 1.00 0.00 O ATOM 9042 H1 WAT 4841 57.568 110.611 122.852 1.00 0.00 H ATOM 9043 H2 WAT 4841 57.080 110.369 121.440 1.00 0.00 H TER 9045 WAT 4841 ATOM 9045 O WAT 4842 44.979 58.461 75.007 1.00 0.00 O ATOM 9046 H1 WAT 4842 45.034 57.542 74.746 1.00 0.00 H ATOM 9047 H2 WAT 4842 45.588 58.913 74.423 1.00 0.00 H TER 9049 WAT 4842 ATOM 9049 O WAT 4843 126.044 114.451 132.004 1.00 0.00 O ATOM 9050 H1 WAT 4843 126.178 114.276 131.073 1.00 0.00 H ATOM 9051 H2 WAT 4843 125.791 115.373 132.041 1.00 0.00 H TER 9053 WAT 4843 ATOM 9053 O WAT 4844 71.591 26.713 124.799 1.00 0.00 O ATOM 9054 H1 WAT 4844 72.132 26.646 124.013 1.00 0.00 H ATOM 9055 H2 WAT 4844 70.836 26.153 124.618 1.00 0.00 H TER 9057 WAT 4844 ATOM 9057 O WAT 4845 61.477 126.060 63.750 1.00 0.00 O ATOM 9058 H1 WAT 4845 62.253 126.246 64.280 1.00 0.00 H ATOM 9059 H2 WAT 4845 61.776 126.160 62.846 1.00 0.00 H TER 9061 WAT 4845 ATOM 9061 O WAT 4846 29.521 125.655 50.414 1.00 0.00 O ATOM 9062 H1 WAT 4846 28.716 125.143 50.339 1.00 0.00 H ATOM 9063 H2 WAT 4846 30.205 125.005 50.572 1.00 0.00 H TER 9065 WAT 4846 ATOM 9065 O WAT 4847 56.383 59.367 30.774 1.00 0.00 O ATOM 9066 H1 WAT 4847 56.392 60.285 31.044 1.00 0.00 H ATOM 9067 H2 WAT 4847 55.455 59.143 30.715 1.00 0.00 H TER 9069 WAT 4847 ATOM 9069 O WAT 4848 2.288 28.936 5.593 1.00 0.00 O ATOM 9070 H1 WAT 4848 2.939 29.007 6.292 1.00 0.00 H ATOM 9071 H2 WAT 4848 2.644 29.465 4.880 1.00 0.00 H TER 9073 WAT 4848 ATOM 9073 O WAT 4849 94.485 23.133 20.059 1.00 0.00 O ATOM 9074 H1 WAT 4849 93.712 23.510 20.479 1.00 0.00 H ATOM 9075 H2 WAT 4849 94.871 23.859 19.570 1.00 0.00 H TER 9077 WAT 4849 ATOM 9077 O WAT 4850 115.209 26.665 89.795 1.00 0.00 O ATOM 9078 H1 WAT 4850 114.446 26.489 89.245 1.00 0.00 H ATOM 9079 H2 WAT 4850 114.872 27.213 90.504 1.00 0.00 H TER 9081 WAT 4850 ATOM 9081 O WAT 4851 14.361 17.825 154.574 1.00 0.00 O ATOM 9082 H1 WAT 4851 14.820 18.177 155.337 1.00 0.00 H ATOM 9083 H2 WAT 4851 13.722 18.500 154.347 1.00 0.00 H TER 9085 WAT 4851 ATOM 9085 O WAT 4852 17.665 90.732 107.878 1.00 0.00 O ATOM 9086 H1 WAT 4852 17.096 90.179 108.414 1.00 0.00 H ATOM 9087 H2 WAT 4852 17.330 91.619 108.011 1.00 0.00 H TER 9089 WAT 4852 ATOM 9089 O WAT 4853 57.940 55.513 70.576 1.00 0.00 O ATOM 9090 H1 WAT 4853 57.166 55.308 70.051 1.00 0.00 H ATOM 9091 H2 WAT 4853 58.117 54.709 71.065 1.00 0.00 H TER 9093 WAT 4853 ATOM 9093 O WAT 4854 66.472 87.627 157.759 1.00 0.00 O ATOM 9094 H1 WAT 4854 66.760 88.539 157.722 1.00 0.00 H ATOM 9095 H2 WAT 4854 67.109 87.153 157.224 1.00 0.00 H TER 9097 WAT 4854 ATOM 9097 O WAT 4855 140.440 39.993 74.524 1.00 0.00 O ATOM 9098 H1 WAT 4855 139.972 40.298 75.301 1.00 0.00 H ATOM 9099 H2 WAT 4855 141.354 39.934 74.803 1.00 0.00 H TER 9101 WAT 4855 ATOM 9101 O WAT 4856 100.231 46.160 129.510 1.00 0.00 O ATOM 9102 H1 WAT 4856 99.543 46.133 128.845 1.00 0.00 H ATOM 9103 H2 WAT 4856 99.964 45.505 130.156 1.00 0.00 H TER 9105 WAT 4856 ATOM 9105 O WAT 4857 43.933 118.380 17.929 1.00 0.00 O ATOM 9106 H1 WAT 4857 44.087 119.226 18.349 1.00 0.00 H ATOM 9107 H2 WAT 4857 44.505 118.387 17.161 1.00 0.00 H TER 9109 WAT 4857 ATOM 9109 O WAT 4858 22.013 15.500 120.628 1.00 0.00 O ATOM 9110 H1 WAT 4858 21.182 15.028 120.569 1.00 0.00 H ATOM 9111 H2 WAT 4858 22.553 14.964 121.209 1.00 0.00 H TER 9113 WAT 4858 ATOM 9113 O WAT 4859 15.819 31.235 19.364 1.00 0.00 O ATOM 9114 H1 WAT 4859 16.070 31.085 18.453 1.00 0.00 H ATOM 9115 H2 WAT 4859 16.228 32.070 19.591 1.00 0.00 H TER 9117 WAT 4859 ATOM 9117 O WAT 4860 108.587 55.880 147.724 1.00 0.00 O ATOM 9118 H1 WAT 4860 108.826 55.300 148.447 1.00 0.00 H ATOM 9119 H2 WAT 4860 109.263 56.557 147.727 1.00 0.00 H TER 9121 WAT 4860 ATOM 9121 O WAT 4861 79.709 101.877 138.532 1.00 0.00 O ATOM 9122 H1 WAT 4861 79.815 102.708 138.995 1.00 0.00 H ATOM 9123 H2 WAT 4861 79.118 101.367 139.086 1.00 0.00 H TER 9125 WAT 4861 ATOM 9125 O WAT 4862 96.433 19.437 134.299 1.00 0.00 O ATOM 9126 H1 WAT 4862 96.402 18.508 134.073 1.00 0.00 H ATOM 9127 H2 WAT 4862 97.299 19.561 134.687 1.00 0.00 H TER 9129 WAT 4862 ATOM 9129 O WAT 4863 35.381 82.665 105.418 1.00 0.00 O ATOM 9130 H1 WAT 4863 34.464 82.833 105.199 1.00 0.00 H ATOM 9131 H2 WAT 4863 35.713 82.154 104.681 1.00 0.00 H TER 9133 WAT 4863 ATOM 9133 O WAT 4864 134.428 65.735 99.635 1.00 0.00 O ATOM 9134 H1 WAT 4864 134.785 66.623 99.646 1.00 0.00 H ATOM 9135 H2 WAT 4864 133.756 65.755 98.953 1.00 0.00 H TER 9137 WAT 4864 ATOM 9137 O WAT 4865 38.965 49.567 16.017 1.00 0.00 O ATOM 9138 H1 WAT 4865 38.668 49.582 15.107 1.00 0.00 H ATOM 9139 H2 WAT 4865 38.782 48.676 16.314 1.00 0.00 H TER 9141 WAT 4865 ATOM 9141 O WAT 4866 52.752 3.969 14.151 1.00 0.00 O ATOM 9142 H1 WAT 4866 52.571 4.571 14.873 1.00 0.00 H ATOM 9143 H2 WAT 4866 52.520 4.463 13.364 1.00 0.00 H TER 9145 WAT 4866 ATOM 9145 O WAT 4867 88.599 28.215 14.175 1.00 0.00 O ATOM 9146 H1 WAT 4867 88.435 27.297 14.393 1.00 0.00 H ATOM 9147 H2 WAT 4867 88.152 28.708 14.863 1.00 0.00 H TER 9149 WAT 4867 ATOM 9149 O WAT 4868 140.160 24.630 102.561 1.00 0.00 O ATOM 9150 H1 WAT 4868 140.238 23.963 103.244 1.00 0.00 H ATOM 9151 H2 WAT 4868 140.409 24.177 101.755 1.00 0.00 H TER 9153 WAT 4868 ATOM 9153 O WAT 4869 26.607 8.525 126.333 1.00 0.00 O ATOM 9154 H1 WAT 4869 27.438 8.652 126.790 1.00 0.00 H ATOM 9155 H2 WAT 4869 26.218 9.399 126.295 1.00 0.00 H TER 9157 WAT 4869 ATOM 9157 O WAT 4870 121.998 143.767 140.896 1.00 0.00 O ATOM 9158 H1 WAT 4870 122.664 143.357 141.448 1.00 0.00 H ATOM 9159 H2 WAT 4870 121.303 144.018 141.504 1.00 0.00 H TER 9161 WAT 4870 ATOM 9161 O WAT 4871 135.759 6.132 84.778 1.00 0.00 O ATOM 9162 H1 WAT 4871 136.586 5.768 85.092 1.00 0.00 H ATOM 9163 H2 WAT 4871 135.731 7.015 85.145 1.00 0.00 H TER 9165 WAT 4871 ATOM 9165 O WAT 4872 61.867 90.634 105.548 1.00 0.00 O ATOM 9166 H1 WAT 4872 62.252 91.038 104.770 1.00 0.00 H ATOM 9167 H2 WAT 4872 62.361 91.004 106.279 1.00 0.00 H TER 9169 WAT 4872 ATOM 9169 O WAT 4873 106.167 6.443 137.450 1.00 0.00 O ATOM 9170 H1 WAT 4873 106.068 7.352 137.735 1.00 0.00 H ATOM 9171 H2 WAT 4873 106.999 6.430 136.976 1.00 0.00 H TER 9173 WAT 4873 ATOM 9173 O WAT 4874 53.607 8.649 73.786 1.00 0.00 O ATOM 9174 H1 WAT 4874 52.974 8.558 74.497 1.00 0.00 H ATOM 9175 H2 WAT 4874 53.181 8.240 73.032 1.00 0.00 H TER 9177 WAT 4874 ATOM 9177 O WAT 4875 130.091 53.335 96.153 1.00 0.00 O ATOM 9178 H1 WAT 4875 130.640 53.002 95.444 1.00 0.00 H ATOM 9179 H2 WAT 4875 130.657 53.313 96.925 1.00 0.00 H TER 9181 WAT 4875 ATOM 9181 O WAT 4876 144.498 85.176 87.789 1.00 0.00 O ATOM 9182 H1 WAT 4876 144.853 84.409 88.240 1.00 0.00 H ATOM 9183 H2 WAT 4876 143.614 84.914 87.531 1.00 0.00 H TER 9185 WAT 4876 ATOM 9185 O WAT 4877 68.994 71.021 87.254 1.00 0.00 O ATOM 9186 H1 WAT 4877 69.813 71.045 87.748 1.00 0.00 H ATOM 9187 H2 WAT 4877 68.335 70.753 87.896 1.00 0.00 H TER 9189 WAT 4877 ATOM 9189 O WAT 4878 53.008 121.912 76.622 1.00 0.00 O ATOM 9190 H1 WAT 4878 52.422 121.934 77.378 1.00 0.00 H ATOM 9191 H2 WAT 4878 53.737 122.481 76.867 1.00 0.00 H TER 9193 WAT 4878 ATOM 9193 O WAT 4879 132.726 23.280 92.628 1.00 0.00 O ATOM 9194 H1 WAT 4879 133.263 22.571 92.981 1.00 0.00 H ATOM 9195 H2 WAT 4879 131.829 22.948 92.677 1.00 0.00 H TER 9197 WAT 4879 ATOM 9197 O WAT 4880 64.821 131.392 119.391 1.00 0.00 O ATOM 9198 H1 WAT 4880 64.318 130.663 119.753 1.00 0.00 H ATOM 9199 H2 WAT 4880 65.566 131.486 119.984 1.00 0.00 H TER 9201 WAT 4880 ATOM 9201 O WAT 4881 111.494 112.579 80.458 1.00 0.00 O ATOM 9202 H1 WAT 4881 110.893 113.318 80.366 1.00 0.00 H ATOM 9203 H2 WAT 4881 111.739 112.356 79.560 1.00 0.00 H TER 9205 WAT 4881 ATOM 9205 O WAT 4882 107.976 6.832 95.858 1.00 0.00 O ATOM 9206 H1 WAT 4882 108.672 6.276 95.509 1.00 0.00 H ATOM 9207 H2 WAT 4882 107.536 6.285 96.509 1.00 0.00 H TER 9209 WAT 4882 ATOM 9209 O WAT 4883 111.921 121.383 101.531 1.00 0.00 O ATOM 9210 H1 WAT 4883 111.266 121.828 100.993 1.00 0.00 H ATOM 9211 H2 WAT 4883 111.417 120.982 102.239 1.00 0.00 H TER 9213 WAT 4883 ATOM 9213 O WAT 4884 117.215 20.349 93.779 1.00 0.00 O ATOM 9214 H1 WAT 4884 117.531 20.455 92.882 1.00 0.00 H ATOM 9215 H2 WAT 4884 116.287 20.133 93.682 1.00 0.00 H TER 9217 WAT 4884 ATOM 9217 O WAT 4885 96.063 139.100 78.810 1.00 0.00 O ATOM 9218 H1 WAT 4885 95.462 139.703 78.372 1.00 0.00 H ATOM 9219 H2 WAT 4885 96.898 139.568 78.833 1.00 0.00 H TER 9221 WAT 4885 ATOM 9221 O WAT 4886 131.456 0.091 93.623 1.00 0.00 O ATOM 9222 H1 WAT 4886 131.673 0.507 94.457 1.00 0.00 H ATOM 9223 H2 WAT 4886 132.231 0.228 93.078 1.00 0.00 H TER 9225 WAT 4886 ATOM 9225 O WAT 4887 4.193 80.556 76.920 1.00 0.00 O ATOM 9226 H1 WAT 4887 4.738 80.168 76.236 1.00 0.00 H ATOM 9227 H2 WAT 4887 3.508 81.024 76.443 1.00 0.00 H TER 9229 WAT 4887 ATOM 9229 O WAT 4888 137.895 35.555 104.871 1.00 0.00 O ATOM 9230 H1 WAT 4888 136.960 35.761 104.841 1.00 0.00 H ATOM 9231 H2 WAT 4888 137.940 34.712 105.323 1.00 0.00 H TER 9233 WAT 4888 ATOM 9233 O WAT 4889 53.303 55.044 95.703 1.00 0.00 O ATOM 9234 H1 WAT 4889 53.217 54.294 96.291 1.00 0.00 H ATOM 9235 H2 WAT 4889 52.451 55.478 95.741 1.00 0.00 H TER 9237 WAT 4889 ATOM 9237 O WAT 4890 19.039 37.730 126.922 1.00 0.00 O ATOM 9238 H1 WAT 4890 18.511 37.886 126.139 1.00 0.00 H ATOM 9239 H2 WAT 4890 18.963 38.540 127.427 1.00 0.00 H TER 9241 WAT 4890 ATOM 9241 O WAT 4891 140.635 116.615 99.266 1.00 0.00 O ATOM 9242 H1 WAT 4891 140.631 117.321 99.912 1.00 0.00 H ATOM 9243 H2 WAT 4891 140.781 117.058 98.429 1.00 0.00 H TER 9245 WAT 4891 ATOM 9245 O WAT 4892 6.782 14.139 136.011 1.00 0.00 O ATOM 9246 H1 WAT 4892 6.328 14.560 136.741 1.00 0.00 H ATOM 9247 H2 WAT 4892 6.123 14.081 135.320 1.00 0.00 H TER 9249 WAT 4892 ATOM 9249 O WAT 4893 7.366 71.617 105.514 1.00 0.00 O ATOM 9250 H1 WAT 4893 7.995 72.204 105.933 1.00 0.00 H ATOM 9251 H2 WAT 4893 7.265 70.893 106.132 1.00 0.00 H TER 9253 WAT 4893 ATOM 9253 O WAT 4894 87.139 91.276 91.165 1.00 0.00 O ATOM 9254 H1 WAT 4894 86.690 92.084 91.412 1.00 0.00 H ATOM 9255 H2 WAT 4894 86.744 90.603 91.720 1.00 0.00 H TER 9257 WAT 4894 ATOM 9257 O WAT 4895 46.259 20.848 61.389 1.00 0.00 O ATOM 9258 H1 WAT 4895 46.288 19.933 61.110 1.00 0.00 H ATOM 9259 H2 WAT 4895 46.638 21.334 60.657 1.00 0.00 H TER 9261 WAT 4895 ATOM 9261 O WAT 4896 62.095 7.033 139.381 1.00 0.00 O ATOM 9262 H1 WAT 4896 61.185 7.200 139.134 1.00 0.00 H ATOM 9263 H2 WAT 4896 62.127 7.220 140.319 1.00 0.00 H TER 9265 WAT 4896 ATOM 9265 O WAT 4897 40.934 29.211 87.671 1.00 0.00 O ATOM 9266 H1 WAT 4897 40.572 28.786 86.894 1.00 0.00 H ATOM 9267 H2 WAT 4897 41.341 30.011 87.338 1.00 0.00 H TER 9269 WAT 4897 ATOM 9269 O WAT 4898 122.466 108.935 79.041 1.00 0.00 O ATOM 9270 H1 WAT 4898 123.082 109.015 78.313 1.00 0.00 H ATOM 9271 H2 WAT 4898 122.615 109.719 79.569 1.00 0.00 H TER 9273 WAT 4898 ATOM 9273 O WAT 4899 95.383 87.795 6.967 1.00 0.00 O ATOM 9274 H1 WAT 4899 94.726 88.152 6.370 1.00 0.00 H ATOM 9275 H2 WAT 4899 95.305 88.331 7.756 1.00 0.00 H TER 9277 WAT 4899 ATOM 9277 O WAT 4900 118.378 47.138 105.815 1.00 0.00 O ATOM 9278 H1 WAT 4900 118.431 46.474 105.128 1.00 0.00 H ATOM 9279 H2 WAT 4900 119.085 46.913 106.420 1.00 0.00 H TER 9281 WAT 4900 ATOM 9281 O WAT 4901 65.761 71.784 101.598 1.00 0.00 O ATOM 9282 H1 WAT 4901 66.065 72.671 101.409 1.00 0.00 H ATOM 9283 H2 WAT 4901 64.835 71.889 101.818 1.00 0.00 H TER 9285 WAT 4901 ATOM 9285 O WAT 4902 133.811 66.739 78.519 1.00 0.00 O ATOM 9286 H1 WAT 4902 134.389 66.975 77.793 1.00 0.00 H ATOM 9287 H2 WAT 4902 132.974 66.532 78.102 1.00 0.00 H TER 9289 WAT 4902 ATOM 9289 O WAT 4903 86.130 138.641 153.412 1.00 0.00 O ATOM 9290 H1 WAT 4903 86.697 139.219 153.924 1.00 0.00 H ATOM 9291 H2 WAT 4903 86.416 138.765 152.507 1.00 0.00 H TER 9293 WAT 4903 ATOM 9293 O WAT 4904 10.378 101.283 134.842 1.00 0.00 O ATOM 9294 H1 WAT 4904 10.264 101.835 135.615 1.00 0.00 H ATOM 9295 H2 WAT 4904 11.107 101.684 134.367 1.00 0.00 H TER 9297 WAT 4904 ATOM 9297 O WAT 4905 91.741 74.625 67.915 1.00 0.00 O ATOM 9298 H1 WAT 4905 92.674 74.770 68.072 1.00 0.00 H ATOM 9299 H2 WAT 4905 91.381 75.502 67.788 1.00 0.00 H TER 9301 WAT 4905 ATOM 9301 O WAT 4906 131.609 20.400 150.500 1.00 0.00 O ATOM 9302 H1 WAT 4906 132.066 20.156 149.695 1.00 0.00 H ATOM 9303 H2 WAT 4906 131.929 21.280 150.701 1.00 0.00 H TER 9305 WAT 4906 ATOM 9305 O WAT 4907 145.151 34.188 102.977 1.00 0.00 O ATOM 9306 H1 WAT 4907 145.905 34.344 103.546 1.00 0.00 H ATOM 9307 H2 WAT 4907 144.648 35.001 103.016 1.00 0.00 H TER 9309 WAT 4907 ATOM 9309 O WAT 4908 138.501 0.857 114.799 1.00 0.00 O ATOM 9310 H1 WAT 4908 138.062 0.578 113.996 1.00 0.00 H ATOM 9311 H2 WAT 4908 138.707 0.041 115.255 1.00 0.00 H TER 9313 WAT 4908 ATOM 9313 O WAT 4909 34.407 76.743 118.953 1.00 0.00 O ATOM 9314 H1 WAT 4909 33.665 77.301 118.719 1.00 0.00 H ATOM 9315 H2 WAT 4909 34.509 76.154 118.206 1.00 0.00 H TER 9317 WAT 4909 ATOM 9317 O WAT 4910 93.840 72.422 100.569 1.00 0.00 O ATOM 9318 H1 WAT 4910 94.131 72.739 99.714 1.00 0.00 H ATOM 9319 H2 WAT 4910 92.952 72.767 100.662 1.00 0.00 H TER 9321 WAT 4910 ATOM 9321 O WAT 4911 145.785 71.374 154.054 1.00 0.00 O ATOM 9322 H1 WAT 4911 144.987 71.861 153.845 1.00 0.00 H ATOM 9323 H2 WAT 4911 145.514 70.746 154.724 1.00 0.00 H TER 9325 WAT 4911 ATOM 9325 O WAT 4912 96.283 67.572 79.478 1.00 0.00 O ATOM 9326 H1 WAT 4912 95.790 67.102 80.151 1.00 0.00 H ATOM 9327 H2 WAT 4912 97.140 67.729 79.875 1.00 0.00 H TER 9329 WAT 4912 ATOM 9329 O WAT 4913 44.799 22.596 12.353 1.00 0.00 O ATOM 9330 H1 WAT 4913 44.490 22.259 11.513 1.00 0.00 H ATOM 9331 H2 WAT 4913 44.119 22.343 12.978 1.00 0.00 H TER 9333 WAT 4913 ATOM 9333 O WAT 4914 78.767 83.851 13.047 1.00 0.00 O ATOM 9334 H1 WAT 4914 79.326 84.523 13.438 1.00 0.00 H ATOM 9335 H2 WAT 4914 78.196 83.569 13.761 1.00 0.00 H TER 9337 WAT 4914 ATOM 9337 O WAT 4915 140.852 4.294 149.021 1.00 0.00 O ATOM 9338 H1 WAT 4915 141.771 4.534 148.900 1.00 0.00 H ATOM 9339 H2 WAT 4915 140.875 3.567 149.644 1.00 0.00 H TER 9341 WAT 4915 ATOM 9341 O WAT 4916 132.312 10.790 140.603 1.00 0.00 O ATOM 9342 H1 WAT 4916 131.372 10.705 140.761 1.00 0.00 H ATOM 9343 H2 WAT 4916 132.379 11.424 139.889 1.00 0.00 H TER 9345 WAT 4916 ATOM 9345 O WAT 4917 32.622 129.979 147.192 1.00 0.00 O ATOM 9346 H1 WAT 4917 33.520 130.196 147.441 1.00 0.00 H ATOM 9347 H2 WAT 4917 32.097 130.703 147.533 1.00 0.00 H TER 9349 WAT 4917 ATOM 9349 O WAT 4918 136.393 32.384 101.477 1.00 0.00 O ATOM 9350 H1 WAT 4918 137.044 33.063 101.651 1.00 0.00 H ATOM 9351 H2 WAT 4918 136.356 31.875 102.287 1.00 0.00 H TER 9353 WAT 4918 ATOM 9353 O WAT 4919 15.786 104.510 95.712 1.00 0.00 O ATOM 9354 H1 WAT 4919 15.384 105.310 95.374 1.00 0.00 H ATOM 9355 H2 WAT 4919 16.316 104.803 96.453 1.00 0.00 H TER 9357 WAT 4919 ATOM 9357 O WAT 4920 40.957 29.150 69.029 1.00 0.00 O ATOM 9358 H1 WAT 4920 40.250 29.705 68.699 1.00 0.00 H ATOM 9359 H2 WAT 4920 41.616 29.162 68.336 1.00 0.00 H TER 9361 WAT 4920 ATOM 9361 O WAT 4921 67.459 52.218 60.867 1.00 0.00 O ATOM 9362 H1 WAT 4921 67.043 51.505 61.352 1.00 0.00 H ATOM 9363 H2 WAT 4921 68.361 51.925 60.737 1.00 0.00 H TER 9365 WAT 4921 ATOM 9365 O WAT 4922 18.198 105.297 133.039 1.00 0.00 O ATOM 9366 H1 WAT 4922 18.207 105.543 133.964 1.00 0.00 H ATOM 9367 H2 WAT 4922 17.310 105.502 132.746 1.00 0.00 H TER 9369 WAT 4922 ATOM 9369 O WAT 4923 137.535 12.113 153.544 1.00 0.00 O ATOM 9370 H1 WAT 4923 136.740 12.544 153.858 1.00 0.00 H ATOM 9371 H2 WAT 4923 137.864 11.633 154.304 1.00 0.00 H TER 9373 WAT 4923 ATOM 9373 O WAT 4924 42.462 100.976 130.601 1.00 0.00 O ATOM 9374 H1 WAT 4924 43.290 100.632 130.266 1.00 0.00 H ATOM 9375 H2 WAT 4924 42.716 101.715 131.154 1.00 0.00 H TER 9377 WAT 4924 ATOM 9377 O WAT 4925 72.161 46.059 77.514 1.00 0.00 O ATOM 9378 H1 WAT 4925 72.090 46.963 77.821 1.00 0.00 H ATOM 9379 H2 WAT 4925 71.870 46.091 76.603 1.00 0.00 H TER 9381 WAT 4925 ATOM 9381 O WAT 4926 91.921 42.868 12.270 1.00 0.00 O ATOM 9382 H1 WAT 4926 91.551 43.300 11.499 1.00 0.00 H ATOM 9383 H2 WAT 4926 91.920 41.937 12.046 1.00 0.00 H TER 9385 WAT 4926 ATOM 9385 O WAT 4927 93.099 82.368 86.640 1.00 0.00 O ATOM 9386 H1 WAT 4927 93.823 82.992 86.598 1.00 0.00 H ATOM 9387 H2 WAT 4927 93.039 82.010 85.754 1.00 0.00 H TER 9389 WAT 4927 ATOM 9389 O WAT 4928 54.271 86.253 133.182 1.00 0.00 O ATOM 9390 H1 WAT 4928 53.944 86.789 133.905 1.00 0.00 H ATOM 9391 H2 WAT 4928 53.511 85.743 132.900 1.00 0.00 H TER 9393 WAT 4928 ATOM 9393 O WAT 4929 145.592 56.424 104.143 1.00 0.00 O ATOM 9394 H1 WAT 4929 145.315 55.714 104.723 1.00 0.00 H ATOM 9395 H2 WAT 4929 145.369 57.223 104.619 1.00 0.00 H TER 9397 WAT 4929 ATOM 9397 O WAT 4930 30.997 22.966 4.688 1.00 0.00 O ATOM 9398 H1 WAT 4930 30.828 23.801 4.252 1.00 0.00 H ATOM 9399 H2 WAT 4930 31.216 22.364 3.977 1.00 0.00 H TER 9401 WAT 4930 ATOM 9401 O WAT 4931 23.914 114.320 2.235 1.00 0.00 O ATOM 9402 H1 WAT 4931 23.464 115.003 1.738 1.00 0.00 H ATOM 9403 H2 WAT 4931 23.956 113.575 1.636 1.00 0.00 H TER 9405 WAT 4931 ATOM 9405 O WAT 4932 24.271 140.748 6.313 1.00 0.00 O ATOM 9406 H1 WAT 4932 23.565 140.691 6.956 1.00 0.00 H ATOM 9407 H2 WAT 4932 25.071 140.775 6.838 1.00 0.00 H TER 9409 WAT 4932 ATOM 9409 O WAT 4933 69.653 130.297 79.844 1.00 0.00 O ATOM 9410 H1 WAT 4933 70.529 129.911 79.862 1.00 0.00 H ATOM 9411 H2 WAT 4933 69.060 129.548 79.892 1.00 0.00 H TER 9413 WAT 4933 ATOM 9413 O WAT 4934 30.524 56.882 66.346 1.00 0.00 O ATOM 9414 H1 WAT 4934 31.390 56.685 66.704 1.00 0.00 H ATOM 9415 H2 WAT 4934 30.356 57.787 66.607 1.00 0.00 H TER 9417 WAT 4934 ATOM 9417 O WAT 4935 96.760 45.865 20.245 1.00 0.00 O ATOM 9418 H1 WAT 4935 97.211 46.701 20.360 1.00 0.00 H ATOM 9419 H2 WAT 4935 96.228 45.985 19.459 1.00 0.00 H TER 9421 WAT 4935 ATOM 9421 O WAT 4936 24.129 118.059 157.989 1.00 0.00 O ATOM 9422 H1 WAT 4936 23.476 118.749 157.874 1.00 0.00 H ATOM 9423 H2 WAT 4936 24.963 118.481 157.783 1.00 0.00 H TER 9425 WAT 4936 ATOM 9425 O WAT 4937 114.196 10.820 74.060 1.00 0.00 O ATOM 9426 H1 WAT 4937 115.094 11.144 74.127 1.00 0.00 H ATOM 9427 H2 WAT 4937 114.275 9.987 73.595 1.00 0.00 H TER 9429 WAT 4937 ATOM 9429 O WAT 4938 65.867 94.962 151.763 1.00 0.00 O ATOM 9430 H1 WAT 4938 65.737 95.910 151.744 1.00 0.00 H ATOM 9431 H2 WAT 4938 65.676 94.712 152.667 1.00 0.00 H TER 9433 WAT 4938 ATOM 9433 O WAT 4939 27.602 71.851 12.703 1.00 0.00 O ATOM 9434 H1 WAT 4939 26.828 71.287 12.692 1.00 0.00 H ATOM 9435 H2 WAT 4939 27.272 72.715 12.456 1.00 0.00 H TER 9437 WAT 4939 ATOM 9437 O WAT 4940 21.413 11.621 138.655 1.00 0.00 O ATOM 9438 H1 WAT 4940 20.771 11.885 137.996 1.00 0.00 H ATOM 9439 H2 WAT 4940 21.912 10.920 138.236 1.00 0.00 H TER 9441 WAT 4940 ATOM 9441 O WAT 4941 51.951 87.788 21.293 1.00 0.00 O ATOM 9442 H1 WAT 4941 51.288 87.107 21.180 1.00 0.00 H ATOM 9443 H2 WAT 4941 51.449 88.593 21.421 1.00 0.00 H TER 9445 WAT 4941 ATOM 9445 O WAT 4942 28.201 59.267 130.518 1.00 0.00 O ATOM 9446 H1 WAT 4942 27.610 60.010 130.644 1.00 0.00 H ATOM 9447 H2 WAT 4942 27.757 58.715 129.873 1.00 0.00 H TER 9449 WAT 4942 ATOM 9449 O WAT 4943 44.406 116.422 20.267 1.00 0.00 O ATOM 9450 H1 WAT 4943 44.159 117.214 19.787 1.00 0.00 H ATOM 9451 H2 WAT 4943 44.831 115.868 19.612 1.00 0.00 H TER 9453 WAT 4943 ATOM 9453 O WAT 4944 86.406 23.823 103.890 1.00 0.00 O ATOM 9454 H1 WAT 4944 86.081 24.707 103.723 1.00 0.00 H ATOM 9455 H2 WAT 4944 87.341 23.870 103.692 1.00 0.00 H TER 9457 WAT 4944 ATOM 9457 O WAT 4945 100.559 87.409 64.012 1.00 0.00 O ATOM 9458 H1 WAT 4945 101.088 86.735 63.586 1.00 0.00 H ATOM 9459 H2 WAT 4945 99.869 86.922 64.462 1.00 0.00 H TER 9461 WAT 4945 ATOM 9461 O WAT 4946 97.726 13.035 75.779 1.00 0.00 O ATOM 9462 H1 WAT 4946 97.835 13.273 74.858 1.00 0.00 H ATOM 9463 H2 WAT 4946 97.948 12.105 75.814 1.00 0.00 H TER 9465 WAT 4946 ATOM 9465 O WAT 4947 94.055 145.353 114.965 1.00 0.00 O ATOM 9466 H1 WAT 4947 93.827 145.990 115.642 1.00 0.00 H ATOM 9467 H2 WAT 4947 94.181 144.532 115.441 1.00 0.00 H TER 9469 WAT 4947 ATOM 9469 O WAT 4948 55.925 78.965 134.564 1.00 0.00 O ATOM 9470 H1 WAT 4948 56.383 79.498 135.214 1.00 0.00 H ATOM 9471 H2 WAT 4948 55.192 78.579 135.043 1.00 0.00 H TER 9473 WAT 4948 ATOM 9473 O WAT 4949 143.036 17.967 9.802 1.00 0.00 O ATOM 9474 H1 WAT 4949 143.978 18.134 9.810 1.00 0.00 H ATOM 9475 H2 WAT 4949 142.854 17.665 8.912 1.00 0.00 H TER 9477 WAT 4949 ATOM 9477 O WAT 4950 14.013 124.582 19.082 1.00 0.00 O ATOM 9478 H1 WAT 4950 14.523 125.243 18.614 1.00 0.00 H ATOM 9479 H2 WAT 4950 13.227 125.046 19.369 1.00 0.00 H TER 9481 WAT 4950 ATOM 9481 O WAT 4951 50.920 126.070 64.099 1.00 0.00 O ATOM 9482 H1 WAT 4951 50.184 125.744 64.617 1.00 0.00 H ATOM 9483 H2 WAT 4951 51.594 126.280 64.745 1.00 0.00 H TER 9485 WAT 4951 ATOM 9485 O WAT 4952 68.443 39.975 154.853 1.00 0.00 O ATOM 9486 H1 WAT 4952 69.027 40.220 155.570 1.00 0.00 H ATOM 9487 H2 WAT 4952 68.130 39.101 155.085 1.00 0.00 H TER 9489 WAT 4952 ATOM 9489 O WAT 4953 117.268 51.275 96.670 1.00 0.00 O ATOM 9490 H1 WAT 4953 117.013 51.924 96.014 1.00 0.00 H ATOM 9491 H2 WAT 4953 116.688 51.444 97.412 1.00 0.00 H TER 9493 WAT 4953 ATOM 9493 O WAT 4954 66.753 17.717 5.429 1.00 0.00 O ATOM 9494 H1 WAT 4954 66.273 17.661 4.603 1.00 0.00 H ATOM 9495 H2 WAT 4954 67.468 17.088 5.334 1.00 0.00 H TER 9497 WAT 4954 ATOM 9497 O WAT 4955 39.409 94.743 19.483 1.00 0.00 O ATOM 9498 H1 WAT 4955 40.276 95.120 19.631 1.00 0.00 H ATOM 9499 H2 WAT 4955 39.328 94.057 20.146 1.00 0.00 H TER 9501 WAT 4955 ATOM 9501 O WAT 4956 35.393 124.828 117.553 1.00 0.00 O ATOM 9502 H1 WAT 4956 36.039 125.114 118.199 1.00 0.00 H ATOM 9503 H2 WAT 4956 35.507 123.879 117.504 1.00 0.00 H TER 9505 WAT 4956 ATOM 9505 O WAT 4957 118.215 100.312 22.319 1.00 0.00 O ATOM 9506 H1 WAT 4957 118.926 99.839 22.751 1.00 0.00 H ATOM 9507 H2 WAT 4957 118.091 101.097 22.852 1.00 0.00 H TER 9509 WAT 4957 ATOM 9509 O WAT 4958 121.617 55.145 96.920 1.00 0.00 O ATOM 9510 H1 WAT 4958 120.770 54.713 96.808 1.00 0.00 H ATOM 9511 H2 WAT 4958 122.145 54.832 96.186 1.00 0.00 H TER 9513 WAT 4958 ATOM 9513 O WAT 4959 86.718 67.288 3.292 1.00 0.00 O ATOM 9514 H1 WAT 4959 87.160 68.082 3.593 1.00 0.00 H ATOM 9515 H2 WAT 4959 85.854 67.325 3.702 1.00 0.00 H TER 9517 WAT 4959 ATOM 9517 O WAT 4960 144.770 90.857 88.639 1.00 0.00 O ATOM 9518 H1 WAT 4960 145.100 91.738 88.464 1.00 0.00 H ATOM 9519 H2 WAT 4960 145.365 90.279 88.161 1.00 0.00 H TER 9521 WAT 4960 ATOM 9521 O WAT 4961 52.613 88.591 96.995 1.00 0.00 O ATOM 9522 H1 WAT 4961 52.148 88.153 97.709 1.00 0.00 H ATOM 9523 H2 WAT 4961 52.977 89.380 97.395 1.00 0.00 H TER 9525 WAT 4961 ATOM 9525 O WAT 4962 20.853 1.083 102.320 1.00 0.00 O ATOM 9526 H1 WAT 4962 21.208 1.632 101.621 1.00 0.00 H ATOM 9527 H2 WAT 4962 21.386 1.296 103.086 1.00 0.00 H TER 9529 WAT 4962 ATOM 9529 O WAT 4963 2.661 56.174 12.724 1.00 0.00 O ATOM 9530 H1 WAT 4963 2.436 55.686 11.932 1.00 0.00 H ATOM 9531 H2 WAT 4963 3.234 55.583 13.214 1.00 0.00 H TER 9533 WAT 4963 ATOM 9533 O WAT 4964 135.237 133.283 115.045 1.00 0.00 O ATOM 9534 H1 WAT 4964 135.324 134.227 114.911 1.00 0.00 H ATOM 9535 H2 WAT 4964 134.736 133.201 115.856 1.00 0.00 H TER 9537 WAT 4964 ATOM 9537 O WAT 4965 42.887 58.784 126.963 1.00 0.00 O ATOM 9538 H1 WAT 4965 42.144 59.016 126.406 1.00 0.00 H ATOM 9539 H2 WAT 4965 43.297 59.622 127.177 1.00 0.00 H TER 9541 WAT 4965 ATOM 9541 O WAT 4966 73.762 60.275 114.976 1.00 0.00 O ATOM 9542 H1 WAT 4966 73.862 60.953 114.309 1.00 0.00 H ATOM 9543 H2 WAT 4966 74.645 59.922 115.092 1.00 0.00 H TER 9545 WAT 4966 ATOM 9545 O WAT 4967 60.365 109.955 68.785 1.00 0.00 O ATOM 9546 H1 WAT 4967 60.628 109.923 69.705 1.00 0.00 H ATOM 9547 H2 WAT 4967 61.059 109.485 68.322 1.00 0.00 H TER 9549 WAT 4967 ATOM 9549 O WAT 4968 46.855 47.351 53.807 1.00 0.00 O ATOM 9550 H1 WAT 4968 47.259 48.184 54.053 1.00 0.00 H ATOM 9551 H2 WAT 4968 46.034 47.600 53.383 1.00 0.00 H TER 9553 WAT 4968 ATOM 9553 O WAT 4969 63.081 5.853 23.713 1.00 0.00 O ATOM 9554 H1 WAT 4969 62.512 5.301 23.177 1.00 0.00 H ATOM 9555 H2 WAT 4969 63.145 6.675 23.227 1.00 0.00 H TER 9557 WAT 4969 ATOM 9557 O WAT 4970 35.524 117.580 104.042 1.00 0.00 O ATOM 9558 H1 WAT 4970 35.190 116.946 104.676 1.00 0.00 H ATOM 9559 H2 WAT 4970 34.874 118.282 104.040 1.00 0.00 H TER 9561 WAT 4970 ATOM 9561 O WAT 4971 135.179 25.100 19.569 1.00 0.00 O ATOM 9562 H1 WAT 4971 135.437 24.306 20.036 1.00 0.00 H ATOM 9563 H2 WAT 4971 134.240 25.183 19.738 1.00 0.00 H TER 9565 WAT 4971 ATOM 9565 O WAT 4972 114.992 43.179 84.412 1.00 0.00 O ATOM 9566 H1 WAT 4972 115.907 43.147 84.134 1.00 0.00 H ATOM 9567 H2 WAT 4972 114.940 43.949 84.978 1.00 0.00 H TER 9569 WAT 4972 ATOM 9569 O WAT 4973 64.882 30.093 11.614 1.00 0.00 O ATOM 9570 H1 WAT 4973 64.051 29.621 11.672 1.00 0.00 H ATOM 9571 H2 WAT 4973 65.102 30.303 12.522 1.00 0.00 H TER 9573 WAT 4973 ATOM 9573 O WAT 4974 6.645 88.531 81.864 1.00 0.00 O ATOM 9574 H1 WAT 4974 6.903 87.665 81.548 1.00 0.00 H ATOM 9575 H2 WAT 4974 6.659 89.084 81.083 1.00 0.00 H TER 9577 WAT 4974 ATOM 9577 O WAT 4975 131.543 9.147 151.277 1.00 0.00 O ATOM 9578 H1 WAT 4975 130.737 9.110 151.791 1.00 0.00 H ATOM 9579 H2 WAT 4975 131.951 8.291 151.409 1.00 0.00 H TER 9581 WAT 4975 ATOM 9581 O WAT 4976 94.923 75.336 1.264 1.00 0.00 O ATOM 9582 H1 WAT 4976 94.307 74.881 1.838 1.00 0.00 H ATOM 9583 H2 WAT 4976 95.219 74.664 0.650 1.00 0.00 H TER 9585 WAT 4976 ATOM 9585 O WAT 4977 140.652 124.784 144.573 1.00 0.00 O ATOM 9586 H1 WAT 4977 141.218 124.282 143.987 1.00 0.00 H ATOM 9587 H2 WAT 4977 140.898 125.696 144.422 1.00 0.00 H TER 9589 WAT 4977 ATOM 9589 O WAT 4978 90.662 29.429 105.881 1.00 0.00 O ATOM 9590 H1 WAT 4978 90.686 29.805 106.762 1.00 0.00 H ATOM 9591 H2 WAT 4978 91.573 29.451 105.587 1.00 0.00 H TER 9593 WAT 4978 ATOM 9593 O WAT 4979 45.668 32.793 74.072 1.00 0.00 O ATOM 9594 H1 WAT 4979 45.070 32.631 73.342 1.00 0.00 H ATOM 9595 H2 WAT 4979 46.197 31.998 74.130 1.00 0.00 H TER 9597 WAT 4979 ATOM 9597 O WAT 4980 124.228 11.088 121.769 1.00 0.00 O ATOM 9598 H1 WAT 4980 124.720 10.490 121.207 1.00 0.00 H ATOM 9599 H2 WAT 4980 123.358 11.128 121.372 1.00 0.00 H TER 9601 WAT 4980 ATOM 9601 O WAT 4981 44.645 34.484 60.998 1.00 0.00 O ATOM 9602 H1 WAT 4981 44.277 35.361 60.885 1.00 0.00 H ATOM 9603 H2 WAT 4981 45.500 34.526 60.569 1.00 0.00 H TER 9605 WAT 4981 ATOM 9605 O WAT 4982 125.548 80.114 20.005 1.00 0.00 O ATOM 9606 H1 WAT 4982 125.579 79.282 19.533 1.00 0.00 H ATOM 9607 H2 WAT 4982 124.663 80.444 19.849 1.00 0.00 H TER 9609 WAT 4982 ATOM 9609 O WAT 4983 8.773 127.686 113.355 1.00 0.00 O ATOM 9610 H1 WAT 4983 8.253 127.377 112.613 1.00 0.00 H ATOM 9611 H2 WAT 4983 8.422 128.555 113.549 1.00 0.00 H TER 9613 WAT 4983 ATOM 9613 O WAT 4984 2.501 138.807 134.662 1.00 0.00 O ATOM 9614 H1 WAT 4984 1.755 139.234 135.084 1.00 0.00 H ATOM 9615 H2 WAT 4984 3.159 138.737 135.353 1.00 0.00 H TER 9617 WAT 4984 ATOM 9617 O WAT 4985 62.800 137.701 135.702 1.00 0.00 O ATOM 9618 H1 WAT 4985 62.835 137.751 134.747 1.00 0.00 H ATOM 9619 H2 WAT 4985 61.895 137.454 135.896 1.00 0.00 H TER 9621 WAT 4985 ATOM 9621 O WAT 4986 74.655 53.167 152.208 1.00 0.00 O ATOM 9622 H1 WAT 4986 73.830 53.652 152.242 1.00 0.00 H ATOM 9623 H2 WAT 4986 75.181 53.633 151.558 1.00 0.00 H TER 9625 WAT 4986 ATOM 9625 O WAT 4987 142.135 55.888 59.961 1.00 0.00 O ATOM 9626 H1 WAT 4987 142.383 56.702 60.400 1.00 0.00 H ATOM 9627 H2 WAT 4987 142.897 55.661 59.428 1.00 0.00 H TER 9629 WAT 4987 ATOM 9629 O WAT 4988 111.566 129.499 146.886 1.00 0.00 O ATOM 9630 H1 WAT 4988 110.856 130.027 146.520 1.00 0.00 H ATOM 9631 H2 WAT 4988 112.338 129.752 146.380 1.00 0.00 H TER 9633 WAT 4988 ATOM 9633 O WAT 4989 19.051 107.636 155.840 1.00 0.00 O ATOM 9634 H1 WAT 4989 18.292 107.913 156.353 1.00 0.00 H ATOM 9635 H2 WAT 4989 18.883 106.714 155.644 1.00 0.00 H TER 9637 WAT 4989 ATOM 9637 O WAT 4990 25.778 116.376 114.263 1.00 0.00 O ATOM 9638 H1 WAT 4990 25.236 117.094 114.591 1.00 0.00 H ATOM 9639 H2 WAT 4990 25.938 116.595 113.345 1.00 0.00 H TER 9641 WAT 4990 ATOM 9641 O WAT 4991 107.472 51.748 75.431 1.00 0.00 O ATOM 9642 H1 WAT 4991 106.530 51.852 75.293 1.00 0.00 H ATOM 9643 H2 WAT 4991 107.779 51.285 74.652 1.00 0.00 H TER 9645 WAT 4991 ATOM 9645 O WAT 4992 99.978 109.681 64.066 1.00 0.00 O ATOM 9646 H1 WAT 4992 100.612 108.977 64.200 1.00 0.00 H ATOM 9647 H2 WAT 4992 100.014 109.860 63.126 1.00 0.00 H TER 9649 WAT 4992 ATOM 9649 O WAT 4993 92.293 24.780 78.289 1.00 0.00 O ATOM 9650 H1 WAT 4993 91.346 24.772 78.424 1.00 0.00 H ATOM 9651 H2 WAT 4993 92.570 23.884 78.483 1.00 0.00 H TER 9653 WAT 4993 ATOM 9653 O WAT 4994 124.949 39.046 99.614 1.00 0.00 O ATOM 9654 H1 WAT 4994 125.857 38.750 99.674 1.00 0.00 H ATOM 9655 H2 WAT 4994 124.464 38.274 99.323 1.00 0.00 H TER 9657 WAT 4994 ATOM 9657 O WAT 4995 125.945 68.087 114.490 1.00 0.00 O ATOM 9658 H1 WAT 4995 126.336 67.227 114.336 1.00 0.00 H ATOM 9659 H2 WAT 4995 126.521 68.500 115.134 1.00 0.00 H TER 9661 WAT 4995 ATOM 9661 O WAT 4996 31.158 86.357 59.155 1.00 0.00 O ATOM 9662 H1 WAT 4996 31.376 86.990 58.471 1.00 0.00 H ATOM 9663 H2 WAT 4996 30.592 85.719 58.720 1.00 0.00 H TER 9665 WAT 4996 ATOM 9665 O WAT 4997 41.993 109.679 116.190 1.00 0.00 O ATOM 9666 H1 WAT 4997 41.460 110.290 115.681 1.00 0.00 H ATOM 9667 H2 WAT 4997 41.393 109.328 116.848 1.00 0.00 H TER 9669 WAT 4997 ATOM 9669 O WAT 4998 18.207 4.565 23.635 1.00 0.00 O ATOM 9670 H1 WAT 4998 18.517 5.122 22.922 1.00 0.00 H ATOM 9671 H2 WAT 4998 18.027 5.172 24.353 1.00 0.00 H TER 9673 WAT 4998 ATOM 9673 O WAT 4999 20.927 95.305 10.351 1.00 0.00 O ATOM 9674 H1 WAT 4999 20.211 94.972 10.891 1.00 0.00 H ATOM 9675 H2 WAT 4999 21.590 94.615 10.378 1.00 0.00 H TER 9677 WAT 4999 ATOM 9677 O WAT 5000 134.253 48.044 145.844 1.00 0.00 O ATOM 9678 H1 WAT 5000 133.502 48.531 146.185 1.00 0.00 H ATOM 9679 H2 WAT 5000 133.874 47.246 145.477 1.00 0.00 H TER 9681 WAT 5000 ATOM 9681 O WAT 5001 75.573 138.494 133.951 1.00 0.00 O ATOM 9682 H1 WAT 5001 76.014 139.070 133.327 1.00 0.00 H ATOM 9683 H2 WAT 5001 75.206 139.087 134.607 1.00 0.00 H TER 9685 WAT 5001 ATOM 9685 O WAT 5002 27.864 65.334 142.346 1.00 0.00 O ATOM 9686 H1 WAT 5002 27.397 64.583 142.713 1.00 0.00 H ATOM 9687 H2 WAT 5002 27.680 66.051 142.952 1.00 0.00 H TER 9689 WAT 5002 ATOM 9689 O WAT 5003 115.145 138.080 124.913 1.00 0.00 O ATOM 9690 H1 WAT 5003 114.336 138.403 125.311 1.00 0.00 H ATOM 9691 H2 WAT 5003 115.174 137.153 125.150 1.00 0.00 H TER 9693 WAT 5003 ATOM 9693 O WAT 5004 112.101 61.759 23.493 1.00 0.00 O ATOM 9694 H1 WAT 5004 112.506 61.382 24.274 1.00 0.00 H ATOM 9695 H2 WAT 5004 111.653 61.022 23.077 1.00 0.00 H TER 9697 WAT 5004 ATOM 9697 O WAT 5005 79.476 88.263 108.557 1.00 0.00 O ATOM 9698 H1 WAT 5005 79.095 88.688 107.789 1.00 0.00 H ATOM 9699 H2 WAT 5005 80.067 87.602 108.196 1.00 0.00 H TER 9701 WAT 5005 ATOM 9701 O WAT 5006 40.951 44.908 84.909 1.00 0.00 O ATOM 9702 H1 WAT 5006 40.990 44.940 83.953 1.00 0.00 H ATOM 9703 H2 WAT 5006 41.557 45.591 85.196 1.00 0.00 H TER 9705 WAT 5006 ATOM 9705 O WAT 5007 65.930 5.563 29.041 1.00 0.00 O ATOM 9706 H1 WAT 5007 65.956 5.209 28.152 1.00 0.00 H ATOM 9707 H2 WAT 5007 65.034 5.885 29.145 1.00 0.00 H TER 9709 WAT 5007 ATOM 9709 O WAT 5008 16.216 2.997 141.726 1.00 0.00 O ATOM 9710 H1 WAT 5008 17.070 3.280 141.400 1.00 0.00 H ATOM 9711 H2 WAT 5008 16.411 2.254 142.297 1.00 0.00 H TER 9713 WAT 5008 ATOM 9713 O WAT 5009 116.924 94.962 148.184 1.00 0.00 O ATOM 9714 H1 WAT 5009 116.320 94.269 148.452 1.00 0.00 H ATOM 9715 H2 WAT 5009 117.773 94.685 148.529 1.00 0.00 H TER 9717 WAT 5009 ATOM 9717 O WAT 5010 25.682 37.310 75.435 1.00 0.00 O ATOM 9718 H1 WAT 5010 25.577 38.221 75.709 1.00 0.00 H ATOM 9719 H2 WAT 5010 24.842 37.081 75.036 1.00 0.00 H TER 9721 WAT 5010 ATOM 9721 O WAT 5011 125.002 68.252 137.851 1.00 0.00 O ATOM 9722 H1 WAT 5011 125.004 67.318 138.059 1.00 0.00 H ATOM 9723 H2 WAT 5011 125.927 68.477 137.750 1.00 0.00 H TER 9725 WAT 5011 ATOM 9725 O WAT 5012 134.949 105.386 101.990 1.00 0.00 O ATOM 9726 H1 WAT 5012 135.291 105.212 101.113 1.00 0.00 H ATOM 9727 H2 WAT 5012 135.567 104.952 102.579 1.00 0.00 H TER 9729 WAT 5012 ATOM 9729 O WAT 5013 112.683 126.663 132.754 1.00 0.00 O ATOM 9730 H1 WAT 5013 113.463 126.110 132.791 1.00 0.00 H ATOM 9731 H2 WAT 5013 112.022 126.115 132.330 1.00 0.00 H TER 9733 WAT 5013 ATOM 9733 O WAT 5014 104.090 75.874 100.934 1.00 0.00 O ATOM 9734 H1 WAT 5014 104.843 75.505 100.471 1.00 0.00 H ATOM 9735 H2 WAT 5014 104.087 76.799 100.688 1.00 0.00 H TER 9737 WAT 5014 ATOM 9737 O WAT 5015 114.391 59.314 107.364 1.00 0.00 O ATOM 9738 H1 WAT 5015 114.267 58.430 107.709 1.00 0.00 H ATOM 9739 H2 WAT 5015 115.321 59.356 107.141 1.00 0.00 H TER 9741 WAT 5015 ATOM 9741 O WAT 5016 37.594 72.244 10.570 1.00 0.00 O ATOM 9742 H1 WAT 5016 38.349 72.053 11.127 1.00 0.00 H ATOM 9743 H2 WAT 5016 37.920 72.129 9.678 1.00 0.00 H TER 9745 WAT 5016 ATOM 9745 O WAT 5017 96.899 9.349 151.614 1.00 0.00 O ATOM 9746 H1 WAT 5017 97.559 9.155 150.948 1.00 0.00 H ATOM 9747 H2 WAT 5017 96.505 10.173 151.327 1.00 0.00 H TER 9749 WAT 5017 ATOM 9749 O WAT 5018 52.785 77.414 77.873 1.00 0.00 O ATOM 9750 H1 WAT 5018 52.407 76.855 78.552 1.00 0.00 H ATOM 9751 H2 WAT 5018 53.725 77.235 77.911 1.00 0.00 H TER 9753 WAT 5018 ATOM 9753 O WAT 5019 34.031 85.376 95.435 1.00 0.00 O ATOM 9754 H1 WAT 5019 33.535 85.045 94.686 1.00 0.00 H ATOM 9755 H2 WAT 5019 34.283 84.591 95.921 1.00 0.00 H TER 9757 WAT 5019 ATOM 9757 O WAT 5020 114.438 133.558 63.045 1.00 0.00 O ATOM 9758 H1 WAT 5020 114.293 134.284 62.439 1.00 0.00 H ATOM 9759 H2 WAT 5020 115.291 133.741 63.439 1.00 0.00 H TER 9761 WAT 5020 ATOM 9761 O WAT 5021 90.149 43.906 10.619 1.00 0.00 O ATOM 9762 H1 WAT 5021 89.414 43.875 11.232 1.00 0.00 H ATOM 9763 H2 WAT 5021 90.135 43.053 10.185 1.00 0.00 H TER 9765 WAT 5021 ATOM 9765 O WAT 5022 19.011 136.060 1.045 1.00 0.00 O ATOM 9766 H1 WAT 5022 18.709 136.885 0.665 1.00 0.00 H ATOM 9767 H2 WAT 5022 18.449 135.928 1.808 1.00 0.00 H TER 9769 WAT 5022 ATOM 9769 O WAT 5023 85.479 30.637 78.281 1.00 0.00 O ATOM 9770 H1 WAT 5023 84.907 29.895 78.475 1.00 0.00 H ATOM 9771 H2 WAT 5023 85.754 30.497 77.375 1.00 0.00 H TER 9773 WAT 5023 ATOM 9773 O WAT 5024 106.115 12.223 72.129 1.00 0.00 O ATOM 9774 H1 WAT 5024 106.882 12.389 71.582 1.00 0.00 H ATOM 9775 H2 WAT 5024 105.766 11.392 71.806 1.00 0.00 H TER 9777 WAT 5024 ATOM 9777 O WAT 5025 6.991 11.439 72.507 1.00 0.00 O ATOM 9778 H1 WAT 5025 7.850 11.806 72.301 1.00 0.00 H ATOM 9779 H2 WAT 5025 7.182 10.673 73.050 1.00 0.00 H TER 9781 WAT 5025 ATOM 9781 O WAT 5026 120.660 33.632 145.559 1.00 0.00 O ATOM 9782 H1 WAT 5026 119.879 33.091 145.677 1.00 0.00 H ATOM 9783 H2 WAT 5026 121.279 33.063 145.100 1.00 0.00 H TER 9785 WAT 5026 ATOM 9785 O WAT 5027 51.100 35.877 65.689 1.00 0.00 O ATOM 9786 H1 WAT 5027 51.757 35.184 65.626 1.00 0.00 H ATOM 9787 H2 WAT 5027 50.396 35.492 66.210 1.00 0.00 H TER 9789 WAT 5027 ATOM 9789 O WAT 5028 122.156 29.497 83.800 1.00 0.00 O ATOM 9790 H1 WAT 5028 123.024 29.325 84.164 1.00 0.00 H ATOM 9791 H2 WAT 5028 122.178 30.423 83.555 1.00 0.00 H TER 9793 WAT 5028 ATOM 9793 O WAT 5029 103.785 141.888 158.537 1.00 0.00 O ATOM 9794 H1 WAT 5029 104.631 141.751 158.963 1.00 0.00 H ATOM 9795 H2 WAT 5029 103.611 142.823 158.644 1.00 0.00 H TER 9797 WAT 5029 ATOM 9797 O WAT 5030 7.719 74.993 9.554 1.00 0.00 O ATOM 9798 H1 WAT 5030 8.467 75.036 8.958 1.00 0.00 H ATOM 9799 H2 WAT 5030 7.682 75.861 9.956 1.00 0.00 H TER 9801 WAT 5030 ATOM 9801 O WAT 5031 43.970 31.360 64.135 1.00 0.00 O ATOM 9802 H1 WAT 5031 43.560 32.076 64.618 1.00 0.00 H ATOM 9803 H2 WAT 5031 43.511 30.575 64.433 1.00 0.00 H TER 9805 WAT 5031 ATOM 9805 O WAT 5032 53.884 3.329 150.120 1.00 0.00 O ATOM 9806 H1 WAT 5032 54.457 3.447 149.363 1.00 0.00 H ATOM 9807 H2 WAT 5032 54.483 3.224 150.860 1.00 0.00 H TER 9809 WAT 5032 ATOM 9809 O WAT 5033 19.999 44.445 140.215 1.00 0.00 O ATOM 9810 H1 WAT 5033 20.607 45.037 140.658 1.00 0.00 H ATOM 9811 H2 WAT 5033 20.513 43.656 140.045 1.00 0.00 H TER 9813 WAT 5033 ATOM 9813 O WAT 5034 86.680 32.145 64.720 1.00 0.00 O ATOM 9814 H1 WAT 5034 86.581 32.088 63.770 1.00 0.00 H ATOM 9815 H2 WAT 5034 86.955 31.267 64.985 1.00 0.00 H TER 9817 WAT 5034 ATOM 9817 O WAT 5035 55.306 97.233 13.819 1.00 0.00 O ATOM 9818 H1 WAT 5035 55.451 96.395 13.379 1.00 0.00 H ATOM 9819 H2 WAT 5035 56.026 97.301 14.446 1.00 0.00 H TER 9821 WAT 5035 ATOM 9821 O WAT 5036 71.703 140.091 75.384 1.00 0.00 O ATOM 9822 H1 WAT 5036 71.329 139.417 74.815 1.00 0.00 H ATOM 9823 H2 WAT 5036 72.251 140.618 74.802 1.00 0.00 H TER 9825 WAT 5036 ATOM 9825 O WAT 5037 7.914 88.469 21.300 1.00 0.00 O ATOM 9826 H1 WAT 5037 8.184 89.211 21.840 1.00 0.00 H ATOM 9827 H2 WAT 5037 7.503 87.862 21.915 1.00 0.00 H TER 9829 WAT 5037 ATOM 9829 O WAT 5038 43.463 68.401 117.981 1.00 0.00 O ATOM 9830 H1 WAT 5038 42.621 68.660 118.355 1.00 0.00 H ATOM 9831 H2 WAT 5038 44.056 69.117 118.209 1.00 0.00 H TER 9833 WAT 5038 ATOM 9833 O WAT 5039 20.892 109.737 103.794 1.00 0.00 O ATOM 9834 H1 WAT 5039 21.831 109.552 103.786 1.00 0.00 H ATOM 9835 H2 WAT 5039 20.738 110.156 104.641 1.00 0.00 H TER 9837 WAT 5039 ATOM 9837 O WAT 5040 121.166 25.109 11.121 1.00 0.00 O ATOM 9838 H1 WAT 5040 122.016 25.548 11.091 1.00 0.00 H ATOM 9839 H2 WAT 5040 120.790 25.256 10.253 1.00 0.00 H TER 9841 WAT 5040 ATOM 9841 O WAT 5041 99.081 18.947 76.530 1.00 0.00 O ATOM 9842 H1 WAT 5041 98.538 18.299 76.082 1.00 0.00 H ATOM 9843 H2 WAT 5041 99.818 19.094 75.937 1.00 0.00 H TER 9845 WAT 5041 ATOM 9845 O WAT 5042 61.089 66.160 72.791 1.00 0.00 O ATOM 9846 H1 WAT 5042 61.917 65.697 72.664 1.00 0.00 H ATOM 9847 H2 WAT 5042 60.458 65.672 72.262 1.00 0.00 H TER 9849 WAT 5042 ATOM 9849 O WAT 5043 47.607 111.759 144.725 1.00 0.00 O ATOM 9850 H1 WAT 5043 47.759 112.021 143.817 1.00 0.00 H ATOM 9851 H2 WAT 5043 46.657 111.808 144.832 1.00 0.00 H TER 9853 WAT 5043 ATOM 9853 O WAT 5044 0.070 66.522 139.628 1.00 0.00 O ATOM 9854 H1 WAT 5044 0.208 65.588 139.468 1.00 0.00 H ATOM 9855 H2 WAT 5044 0.054 66.601 140.582 1.00 0.00 H TER 9857 WAT 5044 ATOM 9857 O WAT 5045 89.096 126.288 8.803 1.00 0.00 O ATOM 9858 H1 WAT 5045 88.606 126.589 9.568 1.00 0.00 H ATOM 9859 H2 WAT 5045 89.554 127.067 8.489 1.00 0.00 H TER 9861 WAT 5045 ATOM 9861 O WAT 5046 85.063 107.914 8.062 1.00 0.00 O ATOM 9862 H1 WAT 5046 85.390 107.802 8.955 1.00 0.00 H ATOM 9863 H2 WAT 5046 85.786 107.626 7.504 1.00 0.00 H TER 9865 WAT 5046 ATOM 9865 O WAT 5047 116.329 60.783 13.930 1.00 0.00 O ATOM 9866 H1 WAT 5047 116.820 60.751 13.109 1.00 0.00 H ATOM 9867 H2 WAT 5047 116.102 61.706 14.038 1.00 0.00 H TER 9869 WAT 5047 ATOM 9869 O WAT 5048 29.279 145.287 13.100 1.00 0.00 O ATOM 9870 H1 WAT 5048 29.481 146.210 12.948 1.00 0.00 H ATOM 9871 H2 WAT 5048 30.129 144.849 13.079 1.00 0.00 H TER 9873 WAT 5048 ATOM 9873 O WAT 5049 109.427 50.079 137.328 1.00 0.00 O ATOM 9874 H1 WAT 5049 110.348 49.820 137.329 1.00 0.00 H ATOM 9875 H2 WAT 5049 108.951 49.273 137.125 1.00 0.00 H TER 9877 WAT 5049 ATOM 9877 O WAT 5050 8.634 60.889 142.616 1.00 0.00 O ATOM 9878 H1 WAT 5050 9.007 60.750 143.486 1.00 0.00 H ATOM 9879 H2 WAT 5050 9.282 60.522 142.015 1.00 0.00 H TER 9881 WAT 5050 ATOM 9881 O WAT 5051 14.493 57.724 78.350 1.00 0.00 O ATOM 9882 H1 WAT 5051 15.260 58.279 78.488 1.00 0.00 H ATOM 9883 H2 WAT 5051 13.863 58.019 79.008 1.00 0.00 H TER 9885 WAT 5051 ATOM 9885 O WAT 5052 57.256 50.004 137.563 1.00 0.00 O ATOM 9886 H1 WAT 5052 56.631 49.287 137.454 1.00 0.00 H ATOM 9887 H2 WAT 5052 57.404 50.329 136.675 1.00 0.00 H TER 9889 WAT 5052 ATOM 9889 O WAT 5053 100.949 143.308 17.438 1.00 0.00 O ATOM 9890 H1 WAT 5053 101.832 143.254 17.805 1.00 0.00 H ATOM 9891 H2 WAT 5053 101.004 144.006 16.785 1.00 0.00 H TER 9893 WAT 5053 ATOM 9893 O WAT 5054 115.207 67.846 137.441 1.00 0.00 O ATOM 9894 H1 WAT 5054 114.671 68.517 137.018 1.00 0.00 H ATOM 9895 H2 WAT 5054 114.610 67.414 138.053 1.00 0.00 H TER 9897 WAT 5054 ATOM 9897 O WAT 5055 80.065 45.474 130.108 1.00 0.00 O ATOM 9898 H1 WAT 5055 80.371 44.619 130.408 1.00 0.00 H ATOM 9899 H2 WAT 5055 79.978 45.378 129.159 1.00 0.00 H TER 9901 WAT 5055 ATOM 9901 O WAT 5056 74.031 134.808 118.305 1.00 0.00 O ATOM 9902 H1 WAT 5056 74.858 134.472 117.959 1.00 0.00 H ATOM 9903 H2 WAT 5056 74.253 135.138 119.176 1.00 0.00 H TER 9905 WAT 5056 ATOM 9905 O WAT 5057 92.314 136.030 121.784 1.00 0.00 O ATOM 9906 H1 WAT 5057 92.374 136.785 122.369 1.00 0.00 H ATOM 9907 H2 WAT 5057 92.220 136.411 120.911 1.00 0.00 H TER 9909 WAT 5057 ATOM 9909 O WAT 5058 65.774 122.846 18.570 1.00 0.00 O ATOM 9910 H1 WAT 5058 65.699 122.321 17.773 1.00 0.00 H ATOM 9911 H2 WAT 5058 65.099 123.519 18.479 1.00 0.00 H TER 9913 WAT 5058 ATOM 9913 O WAT 5059 124.326 12.794 106.787 1.00 0.00 O ATOM 9914 H1 WAT 5059 123.940 13.559 106.361 1.00 0.00 H ATOM 9915 H2 WAT 5059 123.574 12.266 107.057 1.00 0.00 H TER 9917 WAT 5059 ATOM 9917 O WAT 5060 43.474 76.846 116.249 1.00 0.00 O ATOM 9918 H1 WAT 5060 43.213 77.624 115.755 1.00 0.00 H ATOM 9919 H2 WAT 5060 43.031 76.122 115.807 1.00 0.00 H TER 9921 WAT 5060 ATOM 9921 O WAT 5061 59.557 95.615 126.257 1.00 0.00 O ATOM 9922 H1 WAT 5061 59.810 94.780 126.651 1.00 0.00 H ATOM 9923 H2 WAT 5061 59.016 96.039 126.922 1.00 0.00 H TER 9925 WAT 5061 ATOM 9925 O WAT 5062 61.269 33.841 91.281 1.00 0.00 O ATOM 9926 H1 WAT 5062 60.697 33.580 90.560 1.00 0.00 H ATOM 9927 H2 WAT 5062 61.904 34.435 90.881 1.00 0.00 H TER 9929 WAT 5062 ATOM 9929 O WAT 5063 126.245 81.108 93.003 1.00 0.00 O ATOM 9930 H1 WAT 5063 125.390 80.680 92.956 1.00 0.00 H ATOM 9931 H2 WAT 5063 126.192 81.663 93.781 1.00 0.00 H TER 9933 WAT 5063 ATOM 9933 O WAT 5064 77.804 100.888 111.437 1.00 0.00 O ATOM 9934 H1 WAT 5064 77.928 101.635 110.851 1.00 0.00 H ATOM 9935 H2 WAT 5064 77.734 101.277 112.309 1.00 0.00 H TER 9937 WAT 5064 ATOM 9937 O WAT 5065 50.673 0.892 106.454 1.00 0.00 O ATOM 9938 H1 WAT 5065 51.578 0.616 106.603 1.00 0.00 H ATOM 9939 H2 WAT 5065 50.717 1.442 105.672 1.00 0.00 H TER 9941 WAT 5065 ATOM 9941 O WAT 5066 60.526 107.166 146.612 1.00 0.00 O ATOM 9942 H1 WAT 5066 60.957 107.685 147.291 1.00 0.00 H ATOM 9943 H2 WAT 5066 59.920 107.776 146.193 1.00 0.00 H TER 9945 WAT 5066 ATOM 9945 O WAT 5067 11.027 100.347 111.087 1.00 0.00 O ATOM 9946 H1 WAT 5067 11.881 100.772 111.167 1.00 0.00 H ATOM 9947 H2 WAT 5067 10.871 100.298 110.144 1.00 0.00 H TER 9949 WAT 5067 ATOM 9949 O WAT 5068 11.584 80.588 125.498 1.00 0.00 O ATOM 9950 H1 WAT 5068 12.208 80.932 126.136 1.00 0.00 H ATOM 9951 H2 WAT 5068 12.052 80.623 124.663 1.00 0.00 H TER 9953 WAT 5068 ATOM 9953 O WAT 5069 61.109 17.853 14.946 1.00 0.00 O ATOM 9954 H1 WAT 5069 61.952 18.148 14.601 1.00 0.00 H ATOM 9955 H2 WAT 5069 60.980 18.373 15.739 1.00 0.00 H TER 9957 WAT 5069 ATOM 9957 O WAT 5070 7.803 113.735 10.184 1.00 0.00 O ATOM 9958 H1 WAT 5070 8.307 114.432 10.605 1.00 0.00 H ATOM 9959 H2 WAT 5070 7.071 113.577 10.779 1.00 0.00 H TER 9961 WAT 5070 ATOM 9961 O WAT 5071 119.454 132.937 87.582 1.00 0.00 O ATOM 9962 H1 WAT 5071 118.640 133.442 87.590 1.00 0.00 H ATOM 9963 H2 WAT 5071 120.142 133.590 87.712 1.00 0.00 H TER 9965 WAT 5071 ATOM 9965 O WAT 5072 73.645 95.189 22.358 1.00 0.00 O ATOM 9966 H1 WAT 5072 73.650 94.403 22.904 1.00 0.00 H ATOM 9967 H2 WAT 5072 74.567 95.433 22.279 1.00 0.00 H TER 9969 WAT 5072 ATOM 9969 O WAT 5073 48.463 126.558 128.029 1.00 0.00 O ATOM 9970 H1 WAT 5073 47.512 126.639 127.965 1.00 0.00 H ATOM 9971 H2 WAT 5073 48.662 126.777 128.939 1.00 0.00 H TER 9973 WAT 5073 ATOM 9973 O WAT 5074 127.866 135.130 21.230 1.00 0.00 O ATOM 9974 H1 WAT 5074 127.815 135.482 22.119 1.00 0.00 H ATOM 9975 H2 WAT 5074 127.760 134.185 21.339 1.00 0.00 H TER 9977 WAT 5074 ATOM 9977 O WAT 5075 137.646 82.407 4.657 1.00 0.00 O ATOM 9978 H1 WAT 5075 136.943 82.924 4.265 1.00 0.00 H ATOM 9979 H2 WAT 5075 137.399 81.498 4.487 1.00 0.00 H TER 9981 WAT 5075 ATOM 9981 O WAT 5076 104.574 6.186 8.611 1.00 0.00 O ATOM 9982 H1 WAT 5076 105.102 6.723 9.202 1.00 0.00 H ATOM 9983 H2 WAT 5076 103.691 6.223 8.979 1.00 0.00 H TER 9985 WAT 5076 ATOM 9985 O WAT 5077 73.596 122.300 134.671 1.00 0.00 O ATOM 9986 H1 WAT 5077 72.790 121.879 134.969 1.00 0.00 H ATOM 9987 H2 WAT 5077 73.849 122.874 135.394 1.00 0.00 H TER 9989 WAT 5077 ATOM 9989 O WAT 5078 41.849 128.529 152.246 1.00 0.00 O ATOM 9990 H1 WAT 5078 42.155 129.338 151.835 1.00 0.00 H ATOM 9991 H2 WAT 5078 42.117 127.837 151.641 1.00 0.00 H TER 9993 WAT 5078 ATOM 9993 O WAT 5079 82.644 51.099 95.209 1.00 0.00 O ATOM 9994 H1 WAT 5079 81.788 51.164 95.632 1.00 0.00 H ATOM 9995 H2 WAT 5079 83.131 50.476 95.747 1.00 0.00 H TER 9997 WAT 5079 ATOM 9997 O WAT 5080 140.791 53.644 5.167 1.00 0.00 O ATOM 9998 H1 WAT 5080 140.974 53.308 6.045 1.00 0.00 H ATOM 9999 H2 WAT 5080 141.048 54.566 5.205 1.00 0.00 H TER 10001 WAT 5080 ATOM 10001 O WAT 5081 28.814 136.985 89.903 1.00 0.00 O ATOM 10002 H1 WAT 5081 28.813 137.011 88.946 1.00 0.00 H ATOM 10003 H2 WAT 5081 28.072 136.424 90.128 1.00 0.00 H TER 10005 WAT 5081 ATOM 10005 O WAT 5082 31.961 29.663 98.963 1.00 0.00 O ATOM 10006 H1 WAT 5082 31.869 30.083 98.107 1.00 0.00 H ATOM 10007 H2 WAT 5082 32.718 29.086 98.867 1.00 0.00 H TER 10009 WAT 5082 ATOM 10009 O WAT 5083 75.925 121.811 130.108 1.00 0.00 O ATOM 10010 H1 WAT 5083 75.766 121.989 131.035 1.00 0.00 H ATOM 10011 H2 WAT 5083 75.055 121.817 129.710 1.00 0.00 H TER 10013 WAT 5083 ATOM 10013 O WAT 5084 90.891 14.463 56.507 1.00 0.00 O ATOM 10014 H1 WAT 5084 91.100 14.604 55.584 1.00 0.00 H ATOM 10015 H2 WAT 5084 90.909 15.338 56.893 1.00 0.00 H TER 10017 WAT 5084 ATOM 10017 O WAT 5085 99.432 102.469 106.708 1.00 0.00 O ATOM 10018 H1 WAT 5085 99.140 102.674 105.819 1.00 0.00 H ATOM 10019 H2 WAT 5085 99.165 103.228 107.228 1.00 0.00 H TER 10021 WAT 5085 ATOM 10021 O WAT 5086 10.177 98.583 140.627 1.00 0.00 O ATOM 10022 H1 WAT 5086 9.640 98.544 139.836 1.00 0.00 H ATOM 10023 H2 WAT 5086 10.240 97.673 140.919 1.00 0.00 H TER 10025 WAT 5086 ATOM 10025 O WAT 5087 70.964 117.270 52.006 1.00 0.00 O ATOM 10026 H1 WAT 5087 71.662 117.889 52.218 1.00 0.00 H ATOM 10027 H2 WAT 5087 70.269 117.469 52.633 1.00 0.00 H TER 10029 WAT 5087 ATOM 10029 O WAT 5088 69.586 104.740 93.701 1.00 0.00 O ATOM 10030 H1 WAT 5088 69.067 103.949 93.554 1.00 0.00 H ATOM 10031 H2 WAT 5088 70.243 104.728 93.005 1.00 0.00 H TER 10033 WAT 5088 ATOM 10033 O WAT 5089 38.334 21.245 125.381 1.00 0.00 O ATOM 10034 H1 WAT 5089 39.161 21.228 125.862 1.00 0.00 H ATOM 10035 H2 WAT 5089 37.979 20.362 125.484 1.00 0.00 H TER 10037 WAT 5089 ATOM 10037 O WAT 5090 75.503 42.629 79.618 1.00 0.00 O ATOM 10038 H1 WAT 5090 75.467 41.696 79.829 1.00 0.00 H ATOM 10039 H2 WAT 5090 74.592 42.872 79.451 1.00 0.00 H TER 10041 WAT 5090 ATOM 10041 O WAT 5091 130.278 81.873 25.051 1.00 0.00 O ATOM 10042 H1 WAT 5091 130.520 81.091 24.556 1.00 0.00 H ATOM 10043 H2 WAT 5091 131.107 82.325 25.207 1.00 0.00 H TER 10045 WAT 5091 ATOM 10045 O WAT 5092 143.234 59.370 154.658 1.00 0.00 O ATOM 10046 H1 WAT 5092 143.741 58.682 154.229 1.00 0.00 H ATOM 10047 H2 WAT 5092 143.263 59.144 155.588 1.00 0.00 H TER 10049 WAT 5092 ATOM 10049 O WAT 5093 20.336 131.089 127.731 1.00 0.00 O ATOM 10050 H1 WAT 5093 19.617 130.835 127.152 1.00 0.00 H ATOM 10051 H2 WAT 5093 20.532 131.994 127.486 1.00 0.00 H TER 10053 WAT 5093 ATOM 10053 O WAT 5094 88.404 103.602 87.591 1.00 0.00 O ATOM 10054 H1 WAT 5094 88.871 102.887 87.159 1.00 0.00 H ATOM 10055 H2 WAT 5094 88.937 104.378 87.415 1.00 0.00 H TER 10057 WAT 5094 ATOM 10057 O WAT 5095 63.731 92.475 145.032 1.00 0.00 O ATOM 10058 H1 WAT 5095 63.268 91.723 145.401 1.00 0.00 H ATOM 10059 H2 WAT 5095 64.468 92.092 144.555 1.00 0.00 H TER 10061 WAT 5095 ATOM 10061 O WAT 5096 1.112 61.417 109.937 1.00 0.00 O ATOM 10062 H1 WAT 5096 2.027 61.276 110.181 1.00 0.00 H ATOM 10063 H2 WAT 5096 1.032 62.366 109.843 1.00 0.00 H TER 10065 WAT 5096 ATOM 10065 O WAT 5097 138.377 109.565 93.192 1.00 0.00 O ATOM 10066 H1 WAT 5097 138.503 108.627 93.336 1.00 0.00 H ATOM 10067 H2 WAT 5097 138.637 109.705 92.282 1.00 0.00 H TER 10069 WAT 5097 ATOM 10069 O WAT 5098 77.843 83.169 66.106 1.00 0.00 O ATOM 10070 H1 WAT 5098 77.467 82.293 66.188 1.00 0.00 H ATOM 10071 H2 WAT 5098 77.152 83.757 66.411 1.00 0.00 H TER 10073 WAT 5098 ATOM 10073 O WAT 5099 52.489 6.115 117.019 1.00 0.00 O ATOM 10074 H1 WAT 5099 52.793 6.911 116.583 1.00 0.00 H ATOM 10075 H2 WAT 5099 52.857 6.168 117.900 1.00 0.00 H TER 10077 WAT 5099 ATOM 10077 O WAT 5100 77.040 13.763 135.776 1.00 0.00 O ATOM 10078 H1 WAT 5100 77.845 13.352 136.090 1.00 0.00 H ATOM 10079 H2 WAT 5100 77.042 13.603 134.832 1.00 0.00 H TER 10081 WAT 5100 ATOM 10081 O WAT 5101 108.855 110.877 107.405 1.00 0.00 O ATOM 10082 H1 WAT 5101 108.707 111.822 107.368 1.00 0.00 H ATOM 10083 H2 WAT 5101 108.933 110.683 108.339 1.00 0.00 H TER 10085 WAT 5101 ATOM 10085 O WAT 5102 19.424 88.255 95.764 1.00 0.00 O ATOM 10086 H1 WAT 5102 18.480 88.118 95.682 1.00 0.00 H ATOM 10087 H2 WAT 5102 19.558 88.449 96.691 1.00 0.00 H TER 10089 WAT 5102 ATOM 10089 O WAT 5103 108.539 61.496 84.416 1.00 0.00 O ATOM 10090 H1 WAT 5103 107.966 61.692 85.157 1.00 0.00 H ATOM 10091 H2 WAT 5103 108.757 62.353 84.049 1.00 0.00 H TER 10093 WAT 5103 ATOM 10093 O WAT 5104 73.630 44.504 127.970 1.00 0.00 O ATOM 10094 H1 WAT 5104 72.701 44.374 127.782 1.00 0.00 H ATOM 10095 H2 WAT 5104 73.866 45.290 127.478 1.00 0.00 H TER 10097 WAT 5104 ATOM 10097 O WAT 5105 105.266 133.652 131.627 1.00 0.00 O ATOM 10098 H1 WAT 5105 105.773 133.776 130.824 1.00 0.00 H ATOM 10099 H2 WAT 5105 104.402 133.372 131.325 1.00 0.00 H TER 10101 WAT 5105 ATOM 10101 O WAT 5106 16.164 20.504 10.719 1.00 0.00 O ATOM 10102 H1 WAT 5106 15.871 21.389 10.502 1.00 0.00 H ATOM 10103 H2 WAT 5106 16.114 20.463 11.674 1.00 0.00 H TER 10105 WAT 5106 ATOM 10105 O WAT 5107 66.308 89.378 67.501 1.00 0.00 O ATOM 10106 H1 WAT 5107 67.183 89.019 67.351 1.00 0.00 H ATOM 10107 H2 WAT 5107 65.872 89.307 66.652 1.00 0.00 H TER 10109 WAT 5107 ATOM 10109 O WAT 5108 130.808 49.188 113.338 1.00 0.00 O ATOM 10110 H1 WAT 5108 129.865 49.071 113.226 1.00 0.00 H ATOM 10111 H2 WAT 5108 130.891 50.001 113.836 1.00 0.00 H TER 10113 WAT 5108 ATOM 10113 O WAT 5109 85.131 124.724 92.612 1.00 0.00 O ATOM 10114 H1 WAT 5109 84.572 125.358 93.060 1.00 0.00 H ATOM 10115 H2 WAT 5109 85.312 125.123 91.761 1.00 0.00 H TER 10117 WAT 5109 ATOM 10117 O WAT 5110 7.406 27.853 155.159 1.00 0.00 O ATOM 10118 H1 WAT 5110 7.345 27.941 156.110 1.00 0.00 H ATOM 10119 H2 WAT 5110 6.603 27.396 154.909 1.00 0.00 H TER 10121 WAT 5110 ATOM 10121 O WAT 5111 17.204 104.172 4.747 1.00 0.00 O ATOM 10122 H1 WAT 5111 17.009 105.102 4.868 1.00 0.00 H ATOM 10123 H2 WAT 5111 16.385 103.796 4.425 1.00 0.00 H TER 10125 WAT 5111 ATOM 10125 O WAT 5112 66.451 49.080 110.331 1.00 0.00 O ATOM 10126 H1 WAT 5112 67.340 48.735 110.417 1.00 0.00 H ATOM 10127 H2 WAT 5112 66.408 49.409 109.433 1.00 0.00 H TER 10129 WAT 5112 ATOM 10129 O WAT 5113 86.669 120.361 66.340 1.00 0.00 O ATOM 10130 H1 WAT 5113 86.986 121.261 66.262 1.00 0.00 H ATOM 10131 H2 WAT 5113 87.291 119.938 66.931 1.00 0.00 H TER 10133 WAT 5113 ATOM 10133 O WAT 5114 139.938 108.392 132.819 1.00 0.00 O ATOM 10134 H1 WAT 5114 139.638 108.473 133.725 1.00 0.00 H ATOM 10135 H2 WAT 5114 140.329 107.520 132.773 1.00 0.00 H TER 10137 WAT 5114 ATOM 10137 O WAT 5115 20.199 13.029 62.959 1.00 0.00 O ATOM 10138 H1 WAT 5115 20.076 13.908 62.602 1.00 0.00 H ATOM 10139 H2 WAT 5115 21.146 12.894 62.942 1.00 0.00 H TER 10141 WAT 5115 ATOM 10141 O WAT 5116 77.293 85.722 7.594 1.00 0.00 O ATOM 10142 H1 WAT 5116 77.202 86.153 8.443 1.00 0.00 H ATOM 10143 H2 WAT 5116 77.903 86.277 7.108 1.00 0.00 H TER 10145 WAT 5116 ATOM 10145 O WAT 5117 11.703 0.409 123.552 1.00 0.00 O ATOM 10146 H1 WAT 5117 11.299 -0.429 123.777 1.00 0.00 H ATOM 10147 H2 WAT 5117 11.003 1.051 123.671 1.00 0.00 H TER 10149 WAT 5117 ATOM 10149 O WAT 5118 69.792 90.790 20.246 1.00 0.00 O ATOM 10150 H1 WAT 5118 69.400 91.566 19.845 1.00 0.00 H ATOM 10151 H2 WAT 5118 70.527 91.129 20.757 1.00 0.00 H TER 10153 WAT 5118 ATOM 10153 O WAT 5119 77.705 120.871 114.786 1.00 0.00 O ATOM 10154 H1 WAT 5119 78.172 120.738 113.961 1.00 0.00 H ATOM 10155 H2 WAT 5119 76.834 121.168 114.523 1.00 0.00 H TER 10157 WAT 5119 ATOM 10157 O WAT 5120 11.941 44.832 104.621 1.00 0.00 O ATOM 10158 H1 WAT 5120 12.142 43.917 104.820 1.00 0.00 H ATOM 10159 H2 WAT 5120 12.705 45.145 104.136 1.00 0.00 H TER 10161 WAT 5120 ATOM 10161 O WAT 5121 118.931 23.216 147.905 1.00 0.00 O ATOM 10162 H1 WAT 5121 118.393 23.603 147.215 1.00 0.00 H ATOM 10163 H2 WAT 5121 118.942 22.280 147.704 1.00 0.00 H TER 10165 WAT 5121 ATOM 10165 O WAT 5122 83.655 17.036 68.154 1.00 0.00 O ATOM 10166 H1 WAT 5122 83.015 17.499 67.613 1.00 0.00 H ATOM 10167 H2 WAT 5122 84.437 17.588 68.124 1.00 0.00 H TER 10169 WAT 5122 ATOM 10169 O WAT 5123 128.669 4.009 157.252 1.00 0.00 O ATOM 10170 H1 WAT 5123 129.354 3.390 157.001 1.00 0.00 H ATOM 10171 H2 WAT 5123 127.947 3.459 157.557 1.00 0.00 H TER 10173 WAT 5123 ATOM 10173 O WAT 5124 5.479 60.759 75.647 1.00 0.00 O ATOM 10174 H1 WAT 5124 6.100 61.079 74.992 1.00 0.00 H ATOM 10175 H2 WAT 5124 4.743 60.425 75.135 1.00 0.00 H TER 10177 WAT 5124 ATOM 10177 O WAT 5125 107.627 123.614 147.009 1.00 0.00 O ATOM 10178 H1 WAT 5125 106.726 123.333 147.168 1.00 0.00 H ATOM 10179 H2 WAT 5125 107.936 123.920 147.861 1.00 0.00 H TER 10181 WAT 5125 ATOM 10181 O WAT 5126 26.127 36.600 91.239 1.00 0.00 O ATOM 10182 H1 WAT 5126 26.350 36.991 90.394 1.00 0.00 H ATOM 10183 H2 WAT 5126 25.420 35.986 91.039 1.00 0.00 H TER 10185 WAT 5126 ATOM 10185 O WAT 5127 103.484 1.959 104.248 1.00 0.00 O ATOM 10186 H1 WAT 5127 103.743 1.897 105.168 1.00 0.00 H ATOM 10187 H2 WAT 5127 103.757 2.837 103.981 1.00 0.00 H TER 10189 WAT 5127 ATOM 10189 O WAT 5128 140.447 124.601 2.962 1.00 0.00 O ATOM 10190 H1 WAT 5128 139.643 124.107 2.803 1.00 0.00 H ATOM 10191 H2 WAT 5128 140.553 124.587 3.913 1.00 0.00 H TER 10193 WAT 5128 ATOM 10193 O WAT 5129 17.628 42.651 155.599 1.00 0.00 O ATOM 10194 H1 WAT 5129 16.965 42.890 154.952 1.00 0.00 H ATOM 10195 H2 WAT 5129 17.306 43.023 156.420 1.00 0.00 H TER 10197 WAT 5129 ATOM 10197 O WAT 5130 91.780 41.048 61.421 1.00 0.00 O ATOM 10198 H1 WAT 5130 92.310 40.609 60.756 1.00 0.00 H ATOM 10199 H2 WAT 5130 92.420 41.447 62.011 1.00 0.00 H TER 10201 WAT 5130 ATOM 10201 O WAT 5131 111.739 25.332 151.765 1.00 0.00 O ATOM 10202 H1 WAT 5131 111.173 24.660 152.145 1.00 0.00 H ATOM 10203 H2 WAT 5131 112.245 25.666 152.506 1.00 0.00 H TER 10205 WAT 5131 ATOM 10205 O WAT 5132 139.051 74.862 58.501 1.00 0.00 O ATOM 10206 H1 WAT 5132 139.514 75.021 57.678 1.00 0.00 H ATOM 10207 H2 WAT 5132 139.410 74.035 58.822 1.00 0.00 H TER 10209 WAT 5132 ATOM 10209 O WAT 5133 50.418 1.436 75.998 1.00 0.00 O ATOM 10210 H1 WAT 5133 50.496 0.650 76.538 1.00 0.00 H ATOM 10211 H2 WAT 5133 51.172 1.971 76.244 1.00 0.00 H TER 10213 WAT 5133 ATOM 10213 O WAT 5134 9.960 143.177 81.439 1.00 0.00 O ATOM 10214 H1 WAT 5134 10.332 143.230 82.319 1.00 0.00 H ATOM 10215 H2 WAT 5134 10.696 142.920 80.883 1.00 0.00 H TER 10217 WAT 5134 ATOM 10217 O WAT 5135 37.525 34.671 105.375 1.00 0.00 O ATOM 10218 H1 WAT 5135 38.369 34.663 105.826 1.00 0.00 H ATOM 10219 H2 WAT 5135 37.209 33.770 105.443 1.00 0.00 H TER 10221 WAT 5135 ATOM 10221 O WAT 5136 47.582 129.853 62.282 1.00 0.00 O ATOM 10222 H1 WAT 5136 46.829 129.907 61.695 1.00 0.00 H ATOM 10223 H2 WAT 5136 47.201 129.713 63.149 1.00 0.00 H TER 10225 WAT 5136 ATOM 10225 O WAT 5137 110.993 62.156 138.188 1.00 0.00 O ATOM 10226 H1 WAT 5137 111.464 62.385 137.387 1.00 0.00 H ATOM 10227 H2 WAT 5137 110.148 62.598 138.104 1.00 0.00 H TER 10229 WAT 5137 ATOM 10229 O WAT 5138 79.463 88.046 26.184 1.00 0.00 O ATOM 10230 H1 WAT 5138 78.803 88.400 26.781 1.00 0.00 H ATOM 10231 H2 WAT 5138 80.274 88.490 26.433 1.00 0.00 H TER 10233 WAT 5138 ATOM 10233 O WAT 5139 40.825 1.756 62.942 1.00 0.00 O ATOM 10234 H1 WAT 5139 41.253 2.157 62.185 1.00 0.00 H ATOM 10235 H2 WAT 5139 41.060 0.830 62.886 1.00 0.00 H TER 10237 WAT 5139 ATOM 10237 O WAT 5140 134.005 101.162 96.783 1.00 0.00 O ATOM 10238 H1 WAT 5140 133.626 100.417 97.249 1.00 0.00 H ATOM 10239 H2 WAT 5140 134.667 100.774 96.211 1.00 0.00 H TER 10241 WAT 5140 ATOM 10241 O WAT 5141 43.197 108.549 137.920 1.00 0.00 O ATOM 10242 H1 WAT 5141 43.349 109.161 137.200 1.00 0.00 H ATOM 10243 H2 WAT 5141 43.441 107.695 137.562 1.00 0.00 H TER 10245 WAT 5141 ATOM 10245 O WAT 5142 19.593 65.496 17.296 1.00 0.00 O ATOM 10246 H1 WAT 5142 20.479 65.381 17.637 1.00 0.00 H ATOM 10247 H2 WAT 5142 19.077 64.821 17.738 1.00 0.00 H TER 10249 WAT 5142 ATOM 10249 O WAT 5143 15.608 84.501 131.219 1.00 0.00 O ATOM 10250 H1 WAT 5143 16.221 84.180 130.558 1.00 0.00 H ATOM 10251 H2 WAT 5143 15.585 85.448 131.086 1.00 0.00 H TER 10253 WAT 5143 ATOM 10253 O WAT 5144 55.595 5.197 15.860 1.00 0.00 O ATOM 10254 H1 WAT 5144 54.678 5.093 16.111 1.00 0.00 H ATOM 10255 H2 WAT 5144 55.874 4.318 15.603 1.00 0.00 H TER 10257 WAT 5144 ATOM 10257 O WAT 5145 17.871 66.069 122.264 1.00 0.00 O ATOM 10258 H1 WAT 5145 18.772 66.326 122.462 1.00 0.00 H ATOM 10259 H2 WAT 5145 17.771 65.211 122.678 1.00 0.00 H TER 10261 WAT 5145 ATOM 10261 O WAT 5146 65.419 125.282 3.787 1.00 0.00 O ATOM 10262 H1 WAT 5146 66.049 125.473 3.092 1.00 0.00 H ATOM 10263 H2 WAT 5146 65.913 124.763 4.422 1.00 0.00 H TER 10265 WAT 5146 ATOM 10265 O WAT 5147 63.299 95.086 74.698 1.00 0.00 O ATOM 10266 H1 WAT 5147 63.067 95.713 75.382 1.00 0.00 H ATOM 10267 H2 WAT 5147 63.565 95.628 73.955 1.00 0.00 H TER 10269 WAT 5147 ATOM 10269 O WAT 5148 84.642 59.918 74.152 1.00 0.00 O ATOM 10270 H1 WAT 5148 84.191 59.379 74.801 1.00 0.00 H ATOM 10271 H2 WAT 5148 84.020 60.617 73.948 1.00 0.00 H TER 10273 WAT 5148 ATOM 10273 O WAT 5149 66.665 116.245 137.522 1.00 0.00 O ATOM 10274 H1 WAT 5149 67.387 116.814 137.786 1.00 0.00 H ATOM 10275 H2 WAT 5149 66.485 116.491 136.614 1.00 0.00 H TER 10277 WAT 5149 ATOM 10277 O WAT 5150 67.680 116.079 127.340 1.00 0.00 O ATOM 10278 H1 WAT 5150 68.468 115.991 127.876 1.00 0.00 H ATOM 10279 H2 WAT 5150 68.004 116.353 126.482 1.00 0.00 H TER 10281 WAT 5150 ATOM 10281 O WAT 5151 9.426 19.038 79.178 1.00 0.00 O ATOM 10282 H1 WAT 5151 8.834 19.306 79.880 1.00 0.00 H ATOM 10283 H2 WAT 5151 8.993 19.330 78.375 1.00 0.00 H TER 10285 WAT 5151 ATOM 10285 O WAT 5152 31.120 44.777 84.945 1.00 0.00 O ATOM 10286 H1 WAT 5152 30.710 44.912 84.091 1.00 0.00 H ATOM 10287 H2 WAT 5152 31.476 43.889 84.901 1.00 0.00 H TER 10289 WAT 5152 ATOM 10289 O WAT 5153 93.128 65.892 133.308 1.00 0.00 O ATOM 10290 H1 WAT 5153 93.182 65.515 134.187 1.00 0.00 H ATOM 10291 H2 WAT 5153 92.647 65.241 132.798 1.00 0.00 H TER 10293 WAT 5153 ATOM 10293 O WAT 5154 11.495 37.530 95.171 1.00 0.00 O ATOM 10294 H1 WAT 5154 10.796 37.563 94.517 1.00 0.00 H ATOM 10295 H2 WAT 5154 11.233 38.169 95.833 1.00 0.00 H TER 10297 WAT 5154 ATOM 10297 O WAT 5155 124.311 119.056 136.950 1.00 0.00 O ATOM 10298 H1 WAT 5155 125.142 118.794 136.554 1.00 0.00 H ATOM 10299 H2 WAT 5155 123.754 119.289 136.207 1.00 0.00 H TER 10301 WAT 5155 ATOM 10301 O WAT 5156 79.303 46.452 134.609 1.00 0.00 O ATOM 10302 H1 WAT 5156 78.624 46.997 134.209 1.00 0.00 H ATOM 10303 H2 WAT 5156 80.122 46.783 134.241 1.00 0.00 H TER 10305 WAT 5156 ATOM 10305 O WAT 5157 80.867 106.475 83.633 1.00 0.00 O ATOM 10306 H1 WAT 5157 81.135 106.488 84.552 1.00 0.00 H ATOM 10307 H2 WAT 5157 81.368 105.755 83.248 1.00 0.00 H TER 10309 WAT 5157 ATOM 10309 O WAT 5158 143.603 66.542 137.537 1.00 0.00 O ATOM 10310 H1 WAT 5158 143.472 65.741 138.044 1.00 0.00 H ATOM 10311 H2 WAT 5158 143.414 66.287 136.634 1.00 0.00 H TER 10313 WAT 5158 ATOM 10313 O WAT 5159 136.135 43.731 158.108 1.00 0.00 O ATOM 10314 H1 WAT 5159 136.982 44.164 157.996 1.00 0.00 H ATOM 10315 H2 WAT 5159 135.500 44.447 158.119 1.00 0.00 H TER 10317 WAT 5159 ATOM 10317 O WAT 5160 66.977 6.294 108.627 1.00 0.00 O ATOM 10318 H1 WAT 5160 67.227 7.044 109.167 1.00 0.00 H ATOM 10319 H2 WAT 5160 67.213 5.530 109.153 1.00 0.00 H TER 10321 WAT 5160 ATOM 10321 O WAT 5161 100.958 7.137 1.214 1.00 0.00 O ATOM 10322 H1 WAT 5161 100.906 8.054 0.942 1.00 0.00 H ATOM 10323 H2 WAT 5161 100.872 6.641 0.400 1.00 0.00 H TER 10325 WAT 5161 ATOM 10325 O WAT 5162 110.804 135.967 62.957 1.00 0.00 O ATOM 10326 H1 WAT 5162 111.637 136.431 63.034 1.00 0.00 H ATOM 10327 H2 WAT 5162 110.567 135.749 63.859 1.00 0.00 H TER 10329 WAT 5162 ATOM 10329 O WAT 5163 60.904 144.341 122.705 1.00 0.00 O ATOM 10330 H1 WAT 5163 60.015 144.220 122.373 1.00 0.00 H ATOM 10331 H2 WAT 5163 61.466 144.184 121.947 1.00 0.00 H TER 10333 WAT 5163 ATOM 10333 O WAT 5164 119.316 138.054 141.801 1.00 0.00 O ATOM 10334 H1 WAT 5164 119.958 137.493 141.366 1.00 0.00 H ATOM 10335 H2 WAT 5164 119.058 137.563 142.581 1.00 0.00 H TER 10337 WAT 5164 ATOM 10337 O WAT 5165 108.296 32.845 150.215 1.00 0.00 O ATOM 10338 H1 WAT 5165 108.816 32.590 149.453 1.00 0.00 H ATOM 10339 H2 WAT 5165 108.720 33.639 150.540 1.00 0.00 H TER 10341 WAT 5165 ATOM 10341 O WAT 5166 139.878 111.594 128.740 1.00 0.00 O ATOM 10342 H1 WAT 5166 140.639 111.077 128.475 1.00 0.00 H ATOM 10343 H2 WAT 5166 139.915 111.602 129.696 1.00 0.00 H TER 10345 WAT 5166 ATOM 10345 O WAT 5167 66.164 10.120 153.274 1.00 0.00 O ATOM 10346 H1 WAT 5167 65.449 9.595 152.915 1.00 0.00 H ATOM 10347 H2 WAT 5167 66.916 9.912 152.719 1.00 0.00 H TER 10349 WAT 5167 ATOM 10349 O WAT 5168 87.114 13.185 80.763 1.00 0.00 O ATOM 10350 H1 WAT 5168 87.394 14.072 80.540 1.00 0.00 H ATOM 10351 H2 WAT 5168 86.342 13.033 80.218 1.00 0.00 H TER 10353 WAT 5168 ATOM 10353 O WAT 5169 48.884 22.625 123.152 1.00 0.00 O ATOM 10354 H1 WAT 5169 48.482 23.004 122.370 1.00 0.00 H ATOM 10355 H2 WAT 5169 49.790 22.932 123.127 1.00 0.00 H TER 10357 WAT 5169 ATOM 10357 O WAT 5170 72.044 23.755 22.331 1.00 0.00 O ATOM 10358 H1 WAT 5170 71.626 22.899 22.430 1.00 0.00 H ATOM 10359 H2 WAT 5170 72.982 23.571 22.378 1.00 0.00 H TER 10361 WAT 5170 ATOM 10361 O WAT 5171 119.091 78.659 144.210 1.00 0.00 O ATOM 10362 H1 WAT 5171 119.133 79.487 143.733 1.00 0.00 H ATOM 10363 H2 WAT 5171 119.844 78.683 144.800 1.00 0.00 H TER 10365 WAT 5171 ATOM 10365 O WAT 5172 118.598 99.218 87.465 1.00 0.00 O ATOM 10366 H1 WAT 5172 118.612 99.522 86.558 1.00 0.00 H ATOM 10367 H2 WAT 5172 118.915 99.966 87.973 1.00 0.00 H TER 10369 WAT 5172 ATOM 10369 O WAT 5173 85.939 113.562 138.390 1.00 0.00 O ATOM 10370 H1 WAT 5173 86.666 113.711 137.785 1.00 0.00 H ATOM 10371 H2 WAT 5173 86.027 114.254 139.045 1.00 0.00 H TER 10373 WAT 5173 ATOM 10373 O WAT 5174 132.943 62.736 15.672 1.00 0.00 O ATOM 10374 H1 WAT 5174 133.552 62.268 15.101 1.00 0.00 H ATOM 10375 H2 WAT 5174 132.915 62.213 16.473 1.00 0.00 H TER 10377 WAT 5174 ATOM 10377 O WAT 5175 95.474 60.935 115.686 1.00 0.00 O ATOM 10378 H1 WAT 5175 96.172 60.462 115.232 1.00 0.00 H ATOM 10379 H2 WAT 5175 95.829 61.813 115.822 1.00 0.00 H TER 10381 WAT 5175 ATOM 10381 O WAT 5176 32.005 21.398 78.170 1.00 0.00 O ATOM 10382 H1 WAT 5176 32.545 21.844 77.518 1.00 0.00 H ATOM 10383 H2 WAT 5176 31.176 21.876 78.161 1.00 0.00 H TER 10385 WAT 5176 ATOM 10385 O WAT 5177 114.460 26.169 12.076 1.00 0.00 O ATOM 10386 H1 WAT 5177 115.099 25.614 12.524 1.00 0.00 H ATOM 10387 H2 WAT 5177 114.770 26.209 11.172 1.00 0.00 H TER 10389 WAT 5177 ATOM 10389 O WAT 5178 88.735 47.231 7.793 1.00 0.00 O ATOM 10390 H1 WAT 5178 88.362 47.532 6.964 1.00 0.00 H ATOM 10391 H2 WAT 5178 88.155 47.595 8.462 1.00 0.00 H TER 10393 WAT 5178 ATOM 10393 O WAT 5179 49.753 83.863 94.655 1.00 0.00 O ATOM 10394 H1 WAT 5179 49.271 83.037 94.704 1.00 0.00 H ATOM 10395 H2 WAT 5179 49.277 84.380 94.005 1.00 0.00 H TER 10397 WAT 5179 ATOM 10397 O WAT 5180 4.390 32.110 113.437 1.00 0.00 O ATOM 10398 H1 WAT 5180 4.479 33.056 113.319 1.00 0.00 H ATOM 10399 H2 WAT 5180 4.748 31.734 112.633 1.00 0.00 H TER 10401 WAT 5180 ATOM 10401 O WAT 5181 113.344 73.371 154.262 1.00 0.00 O ATOM 10402 H1 WAT 5181 114.200 73.647 154.588 1.00 0.00 H ATOM 10403 H2 WAT 5181 113.441 73.365 153.310 1.00 0.00 H TER 10405 WAT 5181 ATOM 10405 O WAT 5182 46.288 29.878 96.633 1.00 0.00 O ATOM 10406 H1 WAT 5182 46.074 29.622 95.736 1.00 0.00 H ATOM 10407 H2 WAT 5182 47.217 30.104 96.602 1.00 0.00 H TER 10409 WAT 5182 ATOM 10409 O WAT 5183 122.196 42.507 16.706 1.00 0.00 O ATOM 10410 H1 WAT 5183 121.829 41.664 16.972 1.00 0.00 H ATOM 10411 H2 WAT 5183 121.534 43.149 16.964 1.00 0.00 H TER 10413 WAT 5183 ATOM 10413 O WAT 5184 145.298 77.644 116.002 1.00 0.00 O ATOM 10414 H1 WAT 5184 145.021 78.485 115.638 1.00 0.00 H ATOM 10415 H2 WAT 5184 144.549 77.350 116.521 1.00 0.00 H TER 10417 WAT 5184 ATOM 10417 O WAT 5185 134.183 21.249 118.496 1.00 0.00 O ATOM 10418 H1 WAT 5185 133.574 20.576 118.194 1.00 0.00 H ATOM 10419 H2 WAT 5185 134.913 21.206 117.879 1.00 0.00 H TER 10421 WAT 5185 ATOM 10421 O WAT 5186 63.756 37.694 143.081 1.00 0.00 O ATOM 10422 H1 WAT 5186 63.107 37.008 142.929 1.00 0.00 H ATOM 10423 H2 WAT 5186 63.623 37.951 143.994 1.00 0.00 H TER 10425 WAT 5186 ATOM 10425 O WAT 5187 66.246 26.120 93.079 1.00 0.00 O ATOM 10426 H1 WAT 5187 66.193 25.164 93.055 1.00 0.00 H ATOM 10427 H2 WAT 5187 65.831 26.362 93.907 1.00 0.00 H TER 10429 WAT 5187 ATOM 10429 O WAT 5188 47.228 57.082 55.924 1.00 0.00 O ATOM 10430 H1 WAT 5188 47.668 56.251 55.744 1.00 0.00 H ATOM 10431 H2 WAT 5188 47.270 57.174 56.876 1.00 0.00 H TER 10433 WAT 5188 ATOM 10433 O WAT 5189 142.527 36.718 156.904 1.00 0.00 O ATOM 10434 H1 WAT 5189 141.888 37.411 157.065 1.00 0.00 H ATOM 10435 H2 WAT 5189 141.999 35.950 156.685 1.00 0.00 H TER 10437 WAT 5189 ATOM 10437 O WAT 5190 125.866 140.721 24.440 1.00 0.00 O ATOM 10438 H1 WAT 5190 125.034 140.544 24.002 1.00 0.00 H ATOM 10439 H2 WAT 5190 125.672 141.439 25.043 1.00 0.00 H TER 10441 WAT 5190 ATOM 10441 O WAT 5191 14.764 55.100 78.918 1.00 0.00 O ATOM 10442 H1 WAT 5191 15.706 55.001 79.057 1.00 0.00 H ATOM 10443 H2 WAT 5191 14.668 55.977 78.546 1.00 0.00 H TER 10445 WAT 5191 ATOM 10445 O WAT 5192 58.539 79.623 156.808 1.00 0.00 O ATOM 10446 H1 WAT 5192 59.068 78.905 157.154 1.00 0.00 H ATOM 10447 H2 WAT 5192 58.060 79.956 157.567 1.00 0.00 H TER 10449 WAT 5192 ATOM 10449 O WAT 5193 53.663 120.175 151.784 1.00 0.00 O ATOM 10450 H1 WAT 5193 54.072 119.962 150.945 1.00 0.00 H ATOM 10451 H2 WAT 5193 54.302 119.895 152.440 1.00 0.00 H TER 10453 WAT 5193 ATOM 10453 O WAT 5194 81.250 56.399 86.273 1.00 0.00 O ATOM 10454 H1 WAT 5194 81.814 56.826 85.628 1.00 0.00 H ATOM 10455 H2 WAT 5194 81.398 55.463 86.139 1.00 0.00 H TER 10457 WAT 5194 ATOM 10457 O WAT 5195 78.940 8.116 87.072 1.00 0.00 O ATOM 10458 H1 WAT 5195 79.033 8.096 86.120 1.00 0.00 H ATOM 10459 H2 WAT 5195 79.413 8.902 87.343 1.00 0.00 H TER 10461 WAT 5195 ATOM 10461 O WAT 5196 26.561 124.578 111.264 1.00 0.00 O ATOM 10462 H1 WAT 5196 26.316 125.064 110.477 1.00 0.00 H ATOM 10463 H2 WAT 5196 27.291 125.073 111.635 1.00 0.00 H TER 10465 WAT 5196 ATOM 10465 O WAT 5197 20.034 83.804 98.455 1.00 0.00 O ATOM 10466 H1 WAT 5197 19.462 83.217 98.950 1.00 0.00 H ATOM 10467 H2 WAT 5197 20.815 83.893 99.000 1.00 0.00 H TER 10469 WAT 5197 ATOM 10469 O WAT 5198 106.606 7.125 126.381 1.00 0.00 O ATOM 10470 H1 WAT 5198 107.291 7.303 125.737 1.00 0.00 H ATOM 10471 H2 WAT 5198 105.959 6.605 125.905 1.00 0.00 H TER 10473 WAT 5198 ATOM 10473 O WAT 5199 111.345 20.013 102.247 1.00 0.00 O ATOM 10474 H1 WAT 5199 111.029 20.450 103.038 1.00 0.00 H ATOM 10475 H2 WAT 5199 112.293 19.962 102.363 1.00 0.00 H TER 10477 WAT 5199 ATOM 10477 O WAT 5200 1.406 51.164 93.874 1.00 0.00 O ATOM 10478 H1 WAT 5200 0.614 51.603 93.562 1.00 0.00 H ATOM 10479 H2 WAT 5200 2.124 51.646 93.464 1.00 0.00 H TER 10481 WAT 5200 ATOM 10481 O WAT 5201 127.641 1.391 153.378 1.00 0.00 O ATOM 10482 H1 WAT 5201 127.668 1.302 154.331 1.00 0.00 H ATOM 10483 H2 WAT 5201 126.993 0.745 153.096 1.00 0.00 H TER 10485 WAT 5201 ATOM 10485 O WAT 5202 5.350 111.318 55.717 1.00 0.00 O ATOM 10486 H1 WAT 5202 4.447 111.632 55.670 1.00 0.00 H ATOM 10487 H2 WAT 5202 5.452 110.766 54.941 1.00 0.00 H TER 10489 WAT 5202 ATOM 10489 O WAT 5203 120.061 95.205 121.595 1.00 0.00 O ATOM 10490 H1 WAT 5203 120.696 95.730 122.082 1.00 0.00 H ATOM 10491 H2 WAT 5203 119.217 95.616 121.782 1.00 0.00 H TER 10493 WAT 5203 ATOM 10493 O WAT 5204 123.366 81.576 17.284 1.00 0.00 O ATOM 10494 H1 WAT 5204 122.436 81.648 17.068 1.00 0.00 H ATOM 10495 H2 WAT 5204 123.546 82.343 17.827 1.00 0.00 H TER 10497 WAT 5204 ATOM 10497 O WAT 5205 55.756 28.394 59.853 1.00 0.00 O ATOM 10498 H1 WAT 5205 55.296 29.231 59.782 1.00 0.00 H ATOM 10499 H2 WAT 5205 55.411 27.997 60.652 1.00 0.00 H TER 10501 WAT 5205 ATOM 10501 O WAT 5206 112.688 17.551 0.955 1.00 0.00 O ATOM 10502 H1 WAT 5206 112.664 18.442 0.605 1.00 0.00 H ATOM 10503 H2 WAT 5206 113.194 17.055 0.312 1.00 0.00 H TER 10505 WAT 5206 ATOM 10505 O WAT 5207 103.232 3.287 143.901 1.00 0.00 O ATOM 10506 H1 WAT 5207 103.035 2.370 143.712 1.00 0.00 H ATOM 10507 H2 WAT 5207 103.998 3.484 143.361 1.00 0.00 H TER 10509 WAT 5207 ATOM 10509 O WAT 5208 48.331 110.846 114.774 1.00 0.00 O ATOM 10510 H1 WAT 5208 48.724 110.822 115.646 1.00 0.00 H ATOM 10511 H2 WAT 5208 47.402 111.013 114.935 1.00 0.00 H TER 10513 WAT 5208 ATOM 10513 O WAT 5209 80.123 50.518 155.112 1.00 0.00 O ATOM 10514 H1 WAT 5209 80.617 49.722 155.312 1.00 0.00 H ATOM 10515 H2 WAT 5209 79.626 50.299 154.324 1.00 0.00 H TER 10517 WAT 5209 ATOM 10517 O WAT 5210 93.624 59.726 128.264 1.00 0.00 O ATOM 10518 H1 WAT 5210 94.261 59.384 128.891 1.00 0.00 H ATOM 10519 H2 WAT 5210 93.945 59.433 127.411 1.00 0.00 H TER 10521 WAT 5210 ATOM 10521 O WAT 5211 3.237 105.802 114.681 1.00 0.00 O ATOM 10522 H1 WAT 5211 3.773 106.027 115.442 1.00 0.00 H ATOM 10523 H2 WAT 5211 2.379 105.589 115.048 1.00 0.00 H TER 10525 WAT 5211 ATOM 10525 O WAT 5212 132.800 23.401 131.042 1.00 0.00 O ATOM 10526 H1 WAT 5212 133.308 22.715 130.608 1.00 0.00 H ATOM 10527 H2 WAT 5212 131.954 23.391 130.595 1.00 0.00 H TER 10529 WAT 5212 ATOM 10529 O WAT 5213 59.505 28.516 105.570 1.00 0.00 O ATOM 10530 H1 WAT 5213 58.860 28.421 106.271 1.00 0.00 H ATOM 10531 H2 WAT 5213 60.018 29.285 105.820 1.00 0.00 H TER 10533 WAT 5213 ATOM 10533 O WAT 5214 141.286 64.858 156.874 1.00 0.00 O ATOM 10534 H1 WAT 5214 141.230 64.109 157.468 1.00 0.00 H ATOM 10535 H2 WAT 5214 141.351 65.618 157.453 1.00 0.00 H TER 10537 WAT 5214 ATOM 10537 O WAT 5215 71.963 127.853 85.481 1.00 0.00 O ATOM 10538 H1 WAT 5215 72.155 128.500 86.160 1.00 0.00 H ATOM 10539 H2 WAT 5215 71.554 128.357 84.778 1.00 0.00 H TER 10541 WAT 5215 ATOM 10541 O WAT 5216 130.829 92.525 121.856 1.00 0.00 O ATOM 10542 H1 WAT 5216 129.912 92.318 122.034 1.00 0.00 H ATOM 10543 H2 WAT 5216 131.236 91.678 121.676 1.00 0.00 H TER 10545 WAT 5216 ATOM 10545 O WAT 5217 80.250 75.509 16.230 1.00 0.00 O ATOM 10546 H1 WAT 5217 79.974 74.845 15.597 1.00 0.00 H ATOM 10547 H2 WAT 5217 80.837 75.043 16.825 1.00 0.00 H TER 10549 WAT 5217 ATOM 10549 O WAT 5218 38.281 63.874 151.136 1.00 0.00 O ATOM 10550 H1 WAT 5218 38.644 63.115 151.591 1.00 0.00 H ATOM 10551 H2 WAT 5218 38.555 63.761 150.226 1.00 0.00 H TER 10553 WAT 5218 ATOM 10553 O WAT 5219 34.982 45.656 2.771 1.00 0.00 O ATOM 10554 H1 WAT 5219 35.625 45.477 2.085 1.00 0.00 H ATOM 10555 H2 WAT 5219 35.435 46.241 3.378 1.00 0.00 H TER 10557 WAT 5219 ATOM 10557 O WAT 5220 124.799 144.901 119.407 1.00 0.00 O ATOM 10558 H1 WAT 5220 124.306 145.631 119.781 1.00 0.00 H ATOM 10559 H2 WAT 5220 124.281 144.625 118.651 1.00 0.00 H TER 10561 WAT 5220 ATOM 10561 O WAT 5221 77.435 144.138 152.195 1.00 0.00 O ATOM 10562 H1 WAT 5221 76.596 144.329 151.777 1.00 0.00 H ATOM 10563 H2 WAT 5221 77.965 143.747 151.500 1.00 0.00 H TER 10565 WAT 5221 ATOM 10565 O WAT 5222 53.407 62.140 103.201 1.00 0.00 O ATOM 10566 H1 WAT 5222 54.156 61.592 103.437 1.00 0.00 H ATOM 10567 H2 WAT 5222 53.572 62.973 103.643 1.00 0.00 H TER 10569 WAT 5222 ATOM 10569 O WAT 5223 24.667 112.755 126.860 1.00 0.00 O ATOM 10570 H1 WAT 5223 24.000 112.210 127.278 1.00 0.00 H ATOM 10571 H2 WAT 5223 24.183 113.507 126.518 1.00 0.00 H TER 10573 WAT 5223 ATOM 10573 O WAT 5224 91.169 3.647 156.014 1.00 0.00 O ATOM 10574 H1 WAT 5224 90.964 4.091 156.838 1.00 0.00 H ATOM 10575 H2 WAT 5224 90.805 4.217 155.338 1.00 0.00 H TER 10577 WAT 5224 ATOM 10577 O WAT 5225 52.624 98.424 151.096 1.00 0.00 O ATOM 10578 H1 WAT 5225 53.113 99.199 150.821 1.00 0.00 H ATOM 10579 H2 WAT 5225 51.919 98.346 150.453 1.00 0.00 H TER 10581 WAT 5225 ATOM 10581 O WAT 5226 94.576 110.964 92.282 1.00 0.00 O ATOM 10582 H1 WAT 5226 95.436 111.384 92.296 1.00 0.00 H ATOM 10583 H2 WAT 5226 94.226 111.107 93.162 1.00 0.00 H TER 10585 WAT 5226 ATOM 10585 O WAT 5227 71.074 137.247 118.877 1.00 0.00 O ATOM 10586 H1 WAT 5227 71.601 137.235 118.078 1.00 0.00 H ATOM 10587 H2 WAT 5227 70.175 137.119 118.574 1.00 0.00 H TER 10589 WAT 5227 ATOM 10589 O WAT 5228 103.072 82.966 144.446 1.00 0.00 O ATOM 10590 H1 WAT 5228 102.640 82.320 143.887 1.00 0.00 H ATOM 10591 H2 WAT 5228 102.369 83.555 144.719 1.00 0.00 H TER 10593 WAT 5228 ATOM 10593 O WAT 5229 36.793 40.773 101.681 1.00 0.00 O ATOM 10594 H1 WAT 5229 37.582 40.233 101.637 1.00 0.00 H ATOM 10595 H2 WAT 5229 36.559 40.930 100.767 1.00 0.00 H TER 10597 WAT 5229 ATOM 10597 O WAT 5230 60.042 128.114 92.708 1.00 0.00 O ATOM 10598 H1 WAT 5230 59.436 127.784 92.043 1.00 0.00 H ATOM 10599 H2 WAT 5230 60.691 127.418 92.806 1.00 0.00 H TER 10601 WAT 5230 ATOM 10601 O WAT 5231 3.647 41.134 4.888 1.00 0.00 O ATOM 10602 H1 WAT 5231 3.340 41.850 4.331 1.00 0.00 H ATOM 10603 H2 WAT 5231 4.583 41.069 4.699 1.00 0.00 H TER 10605 WAT 5231 ATOM 10605 O WAT 5232 94.710 51.842 20.401 1.00 0.00 O ATOM 10606 H1 WAT 5232 94.292 52.272 21.147 1.00 0.00 H ATOM 10607 H2 WAT 5232 95.554 52.285 20.312 1.00 0.00 H TER 10609 WAT 5232 ATOM 10609 O WAT 5233 76.588 97.402 57.080 1.00 0.00 O ATOM 10610 H1 WAT 5233 76.564 97.463 56.125 1.00 0.00 H ATOM 10611 H2 WAT 5233 75.701 97.629 57.357 1.00 0.00 H TER 10613 WAT 5233 ATOM 10613 O WAT 5234 40.191 132.898 95.657 1.00 0.00 O ATOM 10614 H1 WAT 5234 40.199 133.779 96.032 1.00 0.00 H ATOM 10615 H2 WAT 5234 39.784 133.009 94.797 1.00 0.00 H TER 10617 WAT 5234 ATOM 10617 O WAT 5235 64.633 78.850 133.340 1.00 0.00 O ATOM 10618 H1 WAT 5235 65.063 78.369 134.048 1.00 0.00 H ATOM 10619 H2 WAT 5235 64.934 78.418 132.540 1.00 0.00 H TER 10621 WAT 5235 ATOM 10621 O WAT 5236 83.718 124.855 131.903 1.00 0.00 O ATOM 10622 H1 WAT 5236 83.308 124.081 131.516 1.00 0.00 H ATOM 10623 H2 WAT 5236 83.567 124.761 132.843 1.00 0.00 H TER 10625 WAT 5236 ATOM 10625 O WAT 5237 15.517 20.805 81.363 1.00 0.00 O ATOM 10626 H1 WAT 5237 16.440 20.820 81.111 1.00 0.00 H ATOM 10627 H2 WAT 5237 15.050 20.609 80.551 1.00 0.00 H TER 10629 WAT 5237 ATOM 10629 O WAT 5238 109.752 19.566 7.783 1.00 0.00 O ATOM 10630 H1 WAT 5238 110.498 19.316 7.238 1.00 0.00 H ATOM 10631 H2 WAT 5238 109.870 20.504 7.933 1.00 0.00 H TER 10633 WAT 5238 ATOM 10633 O WAT 5239 1.302 91.164 66.300 1.00 0.00 O ATOM 10634 H1 WAT 5239 1.117 92.000 65.873 1.00 0.00 H ATOM 10635 H2 WAT 5239 0.511 90.643 66.159 1.00 0.00 H TER 10637 WAT 5239 ATOM 10637 O WAT 5240 40.862 80.302 111.828 1.00 0.00 O ATOM 10638 H1 WAT 5240 40.865 81.099 111.298 1.00 0.00 H ATOM 10639 H2 WAT 5240 40.041 79.866 111.601 1.00 0.00 H TER 10641 WAT 5240 ATOM 10641 O WAT 5241 115.005 66.477 19.089 1.00 0.00 O ATOM 10642 H1 WAT 5241 114.935 65.774 18.444 1.00 0.00 H ATOM 10643 H2 WAT 5241 114.365 67.129 18.802 1.00 0.00 H TER 10645 WAT 5241 ATOM 10645 O WAT 5242 134.581 84.883 137.951 1.00 0.00 O ATOM 10646 H1 WAT 5242 134.790 85.054 138.869 1.00 0.00 H ATOM 10647 H2 WAT 5242 135.424 84.934 137.500 1.00 0.00 H TER 10649 WAT 5242 ATOM 10649 O WAT 5243 42.456 56.033 158.990 1.00 0.00 O ATOM 10650 H1 WAT 5243 41.727 55.417 159.064 1.00 0.00 H ATOM 10651 H2 WAT 5243 42.701 56.004 158.065 1.00 0.00 H TER 10653 WAT 5243 ATOM 10653 O WAT 5244 66.224 27.020 82.390 1.00 0.00 O ATOM 10654 H1 WAT 5244 66.943 26.671 82.916 1.00 0.00 H ATOM 10655 H2 WAT 5244 65.626 27.408 83.029 1.00 0.00 H TER 10657 WAT 5244 ATOM 10657 O WAT 5245 143.793 122.503 6.588 1.00 0.00 O ATOM 10658 H1 WAT 5245 143.442 121.624 6.732 1.00 0.00 H ATOM 10659 H2 WAT 5245 143.506 123.003 7.352 1.00 0.00 H TER 10661 WAT 5245 ATOM 10661 O WAT 5246 102.214 96.624 72.856 1.00 0.00 O ATOM 10662 H1 WAT 5246 102.633 96.230 72.090 1.00 0.00 H ATOM 10663 H2 WAT 5246 101.284 96.424 72.750 1.00 0.00 H TER 10665 WAT 5246 ATOM 10665 O WAT 5247 21.074 14.651 125.132 1.00 0.00 O ATOM 10666 H1 WAT 5247 21.023 15.278 124.410 1.00 0.00 H ATOM 10667 H2 WAT 5247 20.164 14.408 125.302 1.00 0.00 H TER 10669 WAT 5247 ATOM 10669 O WAT 5248 93.587 142.781 157.267 1.00 0.00 O ATOM 10670 H1 WAT 5248 93.266 142.906 156.374 1.00 0.00 H ATOM 10671 H2 WAT 5248 93.783 143.665 157.577 1.00 0.00 H TER 10673 WAT 5248 ATOM 10673 O WAT 5249 128.049 140.501 104.640 1.00 0.00 O ATOM 10674 H1 WAT 5249 127.138 140.291 104.434 1.00 0.00 H ATOM 10675 H2 WAT 5249 128.527 140.309 103.834 1.00 0.00 H TER 10677 WAT 5249 ATOM 10677 O WAT 5250 50.229 25.036 14.051 1.00 0.00 O ATOM 10678 H1 WAT 5250 49.708 25.766 13.717 1.00 0.00 H ATOM 10679 H2 WAT 5250 49.600 24.488 14.521 1.00 0.00 H TER 10681 WAT 5250 ATOM 10681 O WAT 5251 131.640 77.266 67.806 1.00 0.00 O ATOM 10682 H1 WAT 5251 131.694 76.903 68.690 1.00 0.00 H ATOM 10683 H2 WAT 5251 131.843 76.529 67.232 1.00 0.00 H TER 10685 WAT 5251 ATOM 10685 O WAT 5252 48.687 20.021 124.398 1.00 0.00 O ATOM 10686 H1 WAT 5252 49.644 20.042 124.413 1.00 0.00 H ATOM 10687 H2 WAT 5252 48.442 20.722 123.793 1.00 0.00 H TER 10689 WAT 5252 ATOM 10689 O WAT 5253 48.406 93.506 124.316 1.00 0.00 O ATOM 10690 H1 WAT 5253 49.171 93.710 123.778 1.00 0.00 H ATOM 10691 H2 WAT 5253 48.592 93.913 125.162 1.00 0.00 H TER 10693 WAT 5253 ATOM 10693 O WAT 5254 131.475 22.253 70.193 1.00 0.00 O ATOM 10694 H1 WAT 5254 131.674 23.115 69.827 1.00 0.00 H ATOM 10695 H2 WAT 5254 132.288 21.978 70.616 1.00 0.00 H TER 10697 WAT 5254 ATOM 10697 O WAT 5255 51.282 41.221 111.769 1.00 0.00 O ATOM 10698 H1 WAT 5255 52.077 40.688 111.745 1.00 0.00 H ATOM 10699 H2 WAT 5255 51.577 42.077 112.078 1.00 0.00 H TER 10701 WAT 5255 ATOM 10701 O WAT 5256 97.291 71.868 110.503 1.00 0.00 O ATOM 10702 H1 WAT 5256 96.702 71.931 109.752 1.00 0.00 H ATOM 10703 H2 WAT 5256 97.301 70.936 110.722 1.00 0.00 H TER 10705 WAT 5256 ATOM 10705 O WAT 5257 104.525 119.211 106.514 1.00 0.00 O ATOM 10706 H1 WAT 5257 104.441 119.326 107.461 1.00 0.00 H ATOM 10707 H2 WAT 5257 104.145 118.350 106.343 1.00 0.00 H TER 10709 WAT 5257 ATOM 10709 O WAT 5258 11.565 92.404 70.687 1.00 0.00 O ATOM 10710 H1 WAT 5258 12.320 91.838 70.848 1.00 0.00 H ATOM 10711 H2 WAT 5258 11.274 92.170 69.805 1.00 0.00 H TER 10713 WAT 5258 ATOM 10713 O WAT 5259 115.081 50.731 93.109 1.00 0.00 O ATOM 10714 H1 WAT 5259 115.462 49.875 92.911 1.00 0.00 H ATOM 10715 H2 WAT 5259 114.847 50.680 94.035 1.00 0.00 H TER 10717 WAT 5259 ATOM 10717 O WAT 5260 24.114 63.310 101.773 1.00 0.00 O ATOM 10718 H1 WAT 5260 24.677 63.390 101.003 1.00 0.00 H ATOM 10719 H2 WAT 5260 23.239 63.155 101.415 1.00 0.00 H TER 10721 WAT 5260 ATOM 10721 O WAT 5261 40.096 89.155 97.365 1.00 0.00 O ATOM 10722 H1 WAT 5261 39.571 89.633 96.722 1.00 0.00 H ATOM 10723 H2 WAT 5261 39.789 89.478 98.212 1.00 0.00 H TER 10725 WAT 5261 ATOM 10725 O WAT 5262 51.818 110.069 112.067 1.00 0.00 O ATOM 10726 H1 WAT 5262 51.416 110.875 112.391 1.00 0.00 H ATOM 10727 H2 WAT 5262 52.000 109.558 112.856 1.00 0.00 H TER 10729 WAT 5262 ATOM 10729 O WAT 5263 44.725 131.919 153.637 1.00 0.00 O ATOM 10730 H1 WAT 5263 45.410 132.263 154.210 1.00 0.00 H ATOM 10731 H2 WAT 5263 44.908 130.981 153.582 1.00 0.00 H TER 10733 WAT 5263 ATOM 10733 O WAT 5264 29.364 30.143 77.777 1.00 0.00 O ATOM 10734 H1 WAT 5264 30.020 29.763 77.192 1.00 0.00 H ATOM 10735 H2 WAT 5264 29.307 29.525 78.506 1.00 0.00 H TER 10737 WAT 5264 ATOM 10737 O WAT 5265 126.535 61.804 137.863 1.00 0.00 O ATOM 10738 H1 WAT 5265 126.443 62.529 137.244 1.00 0.00 H ATOM 10739 H2 WAT 5265 126.736 61.046 137.315 1.00 0.00 H TER 10741 WAT 5265 ATOM 10741 O WAT 5266 26.290 116.572 84.159 1.00 0.00 O ATOM 10742 H1 WAT 5266 25.744 115.861 83.823 1.00 0.00 H ATOM 10743 H2 WAT 5266 27.142 116.437 83.745 1.00 0.00 H TER 10745 WAT 5266 ATOM 10745 O WAT 5267 18.594 93.447 134.722 1.00 0.00 O ATOM 10746 H1 WAT 5267 19.281 93.986 134.330 1.00 0.00 H ATOM 10747 H2 WAT 5267 18.003 94.077 135.136 1.00 0.00 H TER 10749 WAT 5267 ATOM 10749 O WAT 5268 55.609 8.847 108.016 1.00 0.00 O ATOM 10750 H1 WAT 5268 56.112 8.951 107.209 1.00 0.00 H ATOM 10751 H2 WAT 5268 55.031 9.610 108.038 1.00 0.00 H TER 10753 WAT 5268 ATOM 10753 O WAT 5269 141.050 80.649 11.876 1.00 0.00 O ATOM 10754 H1 WAT 5269 140.175 80.795 12.234 1.00 0.00 H ATOM 10755 H2 WAT 5269 141.199 79.709 11.982 1.00 0.00 H TER 10757 WAT 5269 ATOM 10757 O WAT 5270 72.812 95.162 133.755 1.00 0.00 O ATOM 10758 H1 WAT 5270 72.853 95.209 132.799 1.00 0.00 H ATOM 10759 H2 WAT 5270 71.888 95.298 133.962 1.00 0.00 H TER 10761 WAT 5270 ATOM 10761 O WAT 5271 26.565 34.540 15.108 1.00 0.00 O ATOM 10762 H1 WAT 5271 25.910 35.218 15.274 1.00 0.00 H ATOM 10763 H2 WAT 5271 26.689 34.114 15.956 1.00 0.00 H TER 10765 WAT 5271 ATOM 10765 O WAT 5272 91.945 98.566 103.692 1.00 0.00 O ATOM 10766 H1 WAT 5272 92.844 98.866 103.558 1.00 0.00 H ATOM 10767 H2 WAT 5272 91.604 98.428 102.808 1.00 0.00 H TER 10769 WAT 5272 ATOM 10769 O WAT 5273 25.821 74.626 89.537 1.00 0.00 O ATOM 10770 H1 WAT 5273 25.970 74.300 88.650 1.00 0.00 H ATOM 10771 H2 WAT 5273 26.685 74.609 89.948 1.00 0.00 H TER 10773 WAT 5273 ATOM 10773 O WAT 5274 37.529 49.172 9.761 1.00 0.00 O ATOM 10774 H1 WAT 5274 38.305 49.324 10.301 1.00 0.00 H ATOM 10775 H2 WAT 5274 37.646 48.286 9.418 1.00 0.00 H TER 10777 WAT 5274 ATOM 10777 O WAT 5275 112.470 61.037 117.658 1.00 0.00 O ATOM 10778 H1 WAT 5275 112.473 60.356 118.331 1.00 0.00 H ATOM 10779 H2 WAT 5275 112.427 61.858 118.148 1.00 0.00 H TER 10781 WAT 5275 ATOM 10781 O WAT 5276 136.425 81.619 125.289 1.00 0.00 O ATOM 10782 H1 WAT 5276 136.964 81.259 125.994 1.00 0.00 H ATOM 10783 H2 WAT 5276 136.698 82.534 125.223 1.00 0.00 H TER 10785 WAT 5276 ATOM 10785 O WAT 5277 125.530 78.360 28.199 1.00 0.00 O ATOM 10786 H1 WAT 5277 126.340 78.589 28.655 1.00 0.00 H ATOM 10787 H2 WAT 5277 125.247 77.543 28.611 1.00 0.00 H TER 10789 WAT 5277 ATOM 10789 O WAT 5278 19.943 76.992 71.092 1.00 0.00 O ATOM 10790 H1 WAT 5278 19.269 76.422 71.464 1.00 0.00 H ATOM 10791 H2 WAT 5278 20.206 76.554 70.282 1.00 0.00 H TER 10793 WAT 5278 ATOM 10793 O WAT 5279 126.073 83.906 13.916 1.00 0.00 O ATOM 10794 H1 WAT 5279 126.733 83.419 13.422 1.00 0.00 H ATOM 10795 H2 WAT 5279 126.196 84.817 13.647 1.00 0.00 H TER 10797 WAT 5279 ATOM 10797 O WAT 5280 108.398 40.164 154.938 1.00 0.00 O ATOM 10798 H1 WAT 5280 109.036 39.453 154.881 1.00 0.00 H ATOM 10799 H2 WAT 5280 108.469 40.617 154.097 1.00 0.00 H TER 10801 WAT 5280 ATOM 10801 O WAT 5281 137.477 68.491 83.113 1.00 0.00 O ATOM 10802 H1 WAT 5281 137.256 67.951 82.355 1.00 0.00 H ATOM 10803 H2 WAT 5281 137.481 69.387 82.777 1.00 0.00 H TER 10805 WAT 5281 ATOM 10805 O WAT 5282 36.671 81.574 113.943 1.00 0.00 O ATOM 10806 H1 WAT 5282 36.814 80.652 113.727 1.00 0.00 H ATOM 10807 H2 WAT 5282 37.413 81.807 114.500 1.00 0.00 H TER 10809 WAT 5282 ATOM 10809 O WAT 5283 40.808 5.539 62.998 1.00 0.00 O ATOM 10810 H1 WAT 5283 40.460 5.068 63.755 1.00 0.00 H ATOM 10811 H2 WAT 5283 40.154 5.404 62.311 1.00 0.00 H TER 10813 WAT 5283 ATOM 10813 O WAT 5284 87.492 28.031 146.415 1.00 0.00 O ATOM 10814 H1 WAT 5284 87.090 27.987 147.282 1.00 0.00 H ATOM 10815 H2 WAT 5284 87.648 27.117 146.176 1.00 0.00 H TER 10817 WAT 5284 ATOM 10817 O WAT 5285 40.509 86.827 5.511 1.00 0.00 O ATOM 10818 H1 WAT 5285 41.215 86.517 6.079 1.00 0.00 H ATOM 10819 H2 WAT 5285 40.954 87.332 4.830 1.00 0.00 H TER 10821 WAT 5285 ATOM 10821 O WAT 5286 33.109 115.665 98.427 1.00 0.00 O ATOM 10822 H1 WAT 5286 33.894 115.117 98.431 1.00 0.00 H ATOM 10823 H2 WAT 5286 33.311 116.368 97.810 1.00 0.00 H TER 10825 WAT 5286 ATOM 10825 O WAT 5287 96.534 107.462 26.774 1.00 0.00 O ATOM 10826 H1 WAT 5287 96.983 108.278 26.995 1.00 0.00 H ATOM 10827 H2 WAT 5287 95.736 107.477 27.301 1.00 0.00 H TER 10829 WAT 5287 ATOM 10829 O WAT 5288 65.085 98.328 137.556 1.00 0.00 O ATOM 10830 H1 WAT 5288 65.909 98.775 137.749 1.00 0.00 H ATOM 10831 H2 WAT 5288 65.155 97.490 138.013 1.00 0.00 H TER 10833 WAT 5288 ATOM 10833 O WAT 5289 27.430 66.823 127.486 1.00 0.00 O ATOM 10834 H1 WAT 5289 27.313 66.192 126.776 1.00 0.00 H ATOM 10835 H2 WAT 5289 27.250 67.672 127.084 1.00 0.00 H TER 10837 WAT 5289 ATOM 10837 O WAT 5290 94.488 120.126 141.718 1.00 0.00 O ATOM 10838 H1 WAT 5290 94.682 119.690 140.889 1.00 0.00 H ATOM 10839 H2 WAT 5290 93.784 120.739 141.507 1.00 0.00 H TER 10841 WAT 5290 ATOM 10841 O WAT 5291 50.801 86.138 128.241 1.00 0.00 O ATOM 10842 H1 WAT 5291 51.066 86.305 127.337 1.00 0.00 H ATOM 10843 H2 WAT 5291 51.598 86.275 128.754 1.00 0.00 H TER 10845 WAT 5291 ATOM 10845 O WAT 5292 24.292 5.264 88.333 1.00 0.00 O ATOM 10846 H1 WAT 5292 23.619 5.776 87.884 1.00 0.00 H ATOM 10847 H2 WAT 5292 25.070 5.822 88.314 1.00 0.00 H TER 10849 WAT 5292 ATOM 10849 O WAT 5293 23.086 122.181 158.728 1.00 0.00 O ATOM 10850 H1 WAT 5293 22.842 122.726 157.979 1.00 0.00 H ATOM 10851 H2 WAT 5293 24.036 122.277 158.794 1.00 0.00 H TER 10853 WAT 5293 ATOM 10853 O WAT 5294 133.098 117.696 23.782 1.00 0.00 O ATOM 10854 H1 WAT 5294 133.315 117.033 24.437 1.00 0.00 H ATOM 10855 H2 WAT 5294 133.796 118.346 23.858 1.00 0.00 H TER 10857 WAT 5294 ATOM 10857 O WAT 5295 145.069 21.004 104.745 1.00 0.00 O ATOM 10858 H1 WAT 5295 145.687 21.253 104.058 1.00 0.00 H ATOM 10859 H2 WAT 5295 144.539 20.311 104.350 1.00 0.00 H TER 10861 WAT 5295 ATOM 10861 O WAT 5296 84.282 75.037 139.584 1.00 0.00 O ATOM 10862 H1 WAT 5296 84.442 74.111 139.762 1.00 0.00 H ATOM 10863 H2 WAT 5296 83.328 75.122 139.597 1.00 0.00 H TER 10865 WAT 5296 ATOM 10865 O WAT 5297 14.907 141.988 13.909 1.00 0.00 O ATOM 10866 H1 WAT 5297 13.972 141.803 13.824 1.00 0.00 H ATOM 10867 H2 WAT 5297 15.022 142.220 14.831 1.00 0.00 H TER 10869 WAT 5297 ATOM 10869 O WAT 5298 129.214 128.825 12.568 1.00 0.00 O ATOM 10870 H1 WAT 5298 129.391 129.266 13.399 1.00 0.00 H ATOM 10871 H2 WAT 5298 128.473 129.304 12.197 1.00 0.00 H TER 10873 WAT 5298 ATOM 10873 O WAT 5299 41.392 137.583 90.719 1.00 0.00 O ATOM 10874 H1 WAT 5299 41.596 138.278 91.346 1.00 0.00 H ATOM 10875 H2 WAT 5299 40.478 137.736 90.482 1.00 0.00 H TER 10877 WAT 5299 ATOM 10877 O WAT 5300 76.165 98.575 78.579 1.00 0.00 O ATOM 10878 H1 WAT 5300 76.721 97.852 78.287 1.00 0.00 H ATOM 10879 H2 WAT 5300 76.780 99.271 78.809 1.00 0.00 H TER 10881 WAT 5300 ATOM 10881 O WAT 5301 89.774 117.066 21.451 1.00 0.00 O ATOM 10882 H1 WAT 5301 90.036 117.965 21.650 1.00 0.00 H ATOM 10883 H2 WAT 5301 90.540 116.684 21.022 1.00 0.00 H TER 10885 WAT 5301 ATOM 10885 O WAT 5302 50.913 47.685 130.165 1.00 0.00 O ATOM 10886 H1 WAT 5302 50.856 46.849 130.629 1.00 0.00 H ATOM 10887 H2 WAT 5302 50.175 48.195 130.500 1.00 0.00 H TER 10889 WAT 5302 ATOM 10889 O WAT 5303 142.418 79.812 19.643 1.00 0.00 O ATOM 10890 H1 WAT 5303 142.545 80.685 19.271 1.00 0.00 H ATOM 10891 H2 WAT 5303 142.178 79.973 20.555 1.00 0.00 H TER 10893 WAT 5303 ATOM 10893 O WAT 5304 77.684 107.819 101.312 1.00 0.00 O ATOM 10894 H1 WAT 5304 77.328 108.383 100.625 1.00 0.00 H ATOM 10895 H2 WAT 5304 77.972 107.032 100.851 1.00 0.00 H TER 10897 WAT 5304 ATOM 10897 O WAT 5305 108.620 35.274 87.835 1.00 0.00 O ATOM 10898 H1 WAT 5305 108.868 35.120 86.923 1.00 0.00 H ATOM 10899 H2 WAT 5305 109.451 35.295 88.309 1.00 0.00 H TER 10901 WAT 5305 ATOM 10901 O WAT 5306 19.893 7.754 19.607 1.00 0.00 O ATOM 10902 H1 WAT 5306 19.110 8.047 19.142 1.00 0.00 H ATOM 10903 H2 WAT 5306 20.519 7.545 18.914 1.00 0.00 H TER 10905 WAT 5306 ATOM 10905 O WAT 5307 26.794 144.095 66.978 1.00 0.00 O ATOM 10906 H1 WAT 5307 27.689 144.062 66.639 1.00 0.00 H ATOM 10907 H2 WAT 5307 26.788 143.467 67.700 1.00 0.00 H TER 10909 WAT 5307 ATOM 10909 O WAT 5308 103.592 4.732 103.613 1.00 0.00 O ATOM 10910 H1 WAT 5308 104.199 5.342 103.193 1.00 0.00 H ATOM 10911 H2 WAT 5308 103.232 5.223 104.352 1.00 0.00 H TER 10913 WAT 5308 ATOM 10913 O WAT 5309 16.570 126.280 150.888 1.00 0.00 O ATOM 10914 H1 WAT 5309 15.697 125.998 150.615 1.00 0.00 H ATOM 10915 H2 WAT 5309 16.436 126.670 151.752 1.00 0.00 H TER 10917 WAT 5309 ATOM 10917 O WAT 5310 132.910 11.047 73.331 1.00 0.00 O ATOM 10918 H1 WAT 5310 131.999 11.330 73.253 1.00 0.00 H ATOM 10919 H2 WAT 5310 133.410 11.716 72.863 1.00 0.00 H TER 10921 WAT 5310 ATOM 10921 O WAT 5311 57.807 103.254 57.728 1.00 0.00 O ATOM 10922 H1 WAT 5311 58.501 103.573 57.151 1.00 0.00 H ATOM 10923 H2 WAT 5311 57.679 102.342 57.467 1.00 0.00 H TER 10925 WAT 5311 ATOM 10925 O WAT 5312 120.229 66.324 133.357 1.00 0.00 O ATOM 10926 H1 WAT 5312 120.239 65.382 133.190 1.00 0.00 H ATOM 10927 H2 WAT 5312 121.003 66.480 133.898 1.00 0.00 H TER 10929 WAT 5312 ATOM 10929 O WAT 5313 137.357 141.177 122.709 1.00 0.00 O ATOM 10930 H1 WAT 5313 136.564 141.373 123.207 1.00 0.00 H ATOM 10931 H2 WAT 5313 137.939 140.756 123.342 1.00 0.00 H TER 10933 WAT 5313 ATOM 10933 O WAT 5314 56.661 136.939 72.193 1.00 0.00 O ATOM 10934 H1 WAT 5314 56.861 137.782 71.787 1.00 0.00 H ATOM 10935 H2 WAT 5314 56.622 136.323 71.461 1.00 0.00 H TER 10937 WAT 5314 ATOM 10937 O WAT 5315 143.877 14.672 2.444 1.00 0.00 O ATOM 10938 H1 WAT 5315 142.950 14.674 2.207 1.00 0.00 H ATOM 10939 H2 WAT 5315 144.288 14.095 1.799 1.00 0.00 H TER 10941 WAT 5315 ATOM 10941 O WAT 5316 56.470 92.050 83.321 1.00 0.00 O ATOM 10942 H1 WAT 5316 57.297 92.087 83.803 1.00 0.00 H ATOM 10943 H2 WAT 5316 56.300 92.957 83.067 1.00 0.00 H TER 10945 WAT 5316 ATOM 10945 O WAT 5317 96.570 58.752 111.657 1.00 0.00 O ATOM 10946 H1 WAT 5317 97.395 58.364 111.364 1.00 0.00 H ATOM 10947 H2 WAT 5317 96.194 58.099 112.247 1.00 0.00 H TER 10949 WAT 5317 ATOM 10949 O WAT 5318 92.765 126.265 110.812 1.00 0.00 O ATOM 10950 H1 WAT 5318 93.380 126.620 110.170 1.00 0.00 H ATOM 10951 H2 WAT 5318 93.292 125.668 111.343 1.00 0.00 H TER 10953 WAT 5318 ATOM 10953 O WAT 5319 75.325 54.600 139.795 1.00 0.00 O ATOM 10954 H1 WAT 5319 75.562 54.767 140.708 1.00 0.00 H ATOM 10955 H2 WAT 5319 75.837 55.235 139.295 1.00 0.00 H TER 10957 WAT 5319 ATOM 10957 O WAT 5320 65.069 31.561 91.660 1.00 0.00 O ATOM 10958 H1 WAT 5320 65.399 32.444 91.827 1.00 0.00 H ATOM 10959 H2 WAT 5320 64.828 31.567 90.734 1.00 0.00 H TER 10961 WAT 5320 ATOM 10961 O WAT 5321 4.246 12.912 151.428 1.00 0.00 O ATOM 10962 H1 WAT 5321 3.496 12.316 151.425 1.00 0.00 H ATOM 10963 H2 WAT 5321 3.877 13.758 151.680 1.00 0.00 H TER 10965 WAT 5321 ATOM 10965 O WAT 5322 73.977 0.370 22.517 1.00 0.00 O ATOM 10966 H1 WAT 5322 74.508 -0.134 23.134 1.00 0.00 H ATOM 10967 H2 WAT 5322 73.308 -0.245 22.218 1.00 0.00 H TER 10969 WAT 5322 ATOM 10969 O WAT 5323 101.544 41.465 69.331 1.00 0.00 O ATOM 10970 H1 WAT 5323 100.849 40.879 69.029 1.00 0.00 H ATOM 10971 H2 WAT 5323 101.412 42.270 68.831 1.00 0.00 H TER 10973 WAT 5323 ATOM 10973 O WAT 5324 95.951 79.496 135.119 1.00 0.00 O ATOM 10974 H1 WAT 5324 95.698 80.340 135.495 1.00 0.00 H ATOM 10975 H2 WAT 5324 95.193 78.931 135.268 1.00 0.00 H TER 10977 WAT 5324 ATOM 10977 O WAT 5325 35.570 140.276 95.395 1.00 0.00 O ATOM 10978 H1 WAT 5325 35.037 139.872 96.080 1.00 0.00 H ATOM 10979 H2 WAT 5325 36.300 139.670 95.271 1.00 0.00 H TER 10981 WAT 5325 ATOM 10981 O WAT 5326 15.451 74.790 71.229 1.00 0.00 O ATOM 10982 H1 WAT 5326 15.608 74.134 70.550 1.00 0.00 H ATOM 10983 H2 WAT 5326 16.321 75.125 71.444 1.00 0.00 H TER 10985 WAT 5326 ATOM 10985 O WAT 5327 144.984 37.772 96.942 1.00 0.00 O ATOM 10986 H1 WAT 5327 144.915 38.108 97.835 1.00 0.00 H ATOM 10987 H2 WAT 5327 145.919 37.812 96.743 1.00 0.00 H TER 10989 WAT 5327 ATOM 10989 O WAT 5328 107.771 82.188 8.697 1.00 0.00 O ATOM 10990 H1 WAT 5328 108.114 81.570 8.051 1.00 0.00 H ATOM 10991 H2 WAT 5328 107.260 82.813 8.182 1.00 0.00 H TER 10993 WAT 5328 ATOM 10993 O WAT 5329 110.759 71.928 132.371 1.00 0.00 O ATOM 10994 H1 WAT 5329 110.024 72.025 132.977 1.00 0.00 H ATOM 10995 H2 WAT 5329 110.648 71.054 131.998 1.00 0.00 H TER 10997 WAT 5329 ATOM 10997 O WAT 5330 72.760 98.824 20.059 1.00 0.00 O ATOM 10998 H1 WAT 5330 72.504 99.147 19.195 1.00 0.00 H ATOM 10999 H2 WAT 5330 72.731 99.597 20.622 1.00 0.00 H TER 11001 WAT 5330 ATOM 11001 O WAT 5331 61.585 102.370 66.399 1.00 0.00 O ATOM 11002 H1 WAT 5331 61.890 101.499 66.146 1.00 0.00 H ATOM 11003 H2 WAT 5331 62.378 102.832 66.669 1.00 0.00 H TER 11005 WAT 5331 ATOM 11005 O WAT 5332 19.079 93.089 130.698 1.00 0.00 O ATOM 11006 H1 WAT 5332 19.609 92.401 130.296 1.00 0.00 H ATOM 11007 H2 WAT 5332 18.545 93.430 129.980 1.00 0.00 H TER 11009 WAT 5332 ATOM 11009 O WAT 5333 84.981 132.697 19.560 1.00 0.00 O ATOM 11010 H1 WAT 5333 85.718 132.467 20.126 1.00 0.00 H ATOM 11011 H2 WAT 5333 84.385 133.185 20.128 1.00 0.00 H TER 11013 WAT 5333 ATOM 11013 O WAT 5334 135.965 45.753 86.716 1.00 0.00 O ATOM 11014 H1 WAT 5334 135.054 45.800 87.009 1.00 0.00 H ATOM 11015 H2 WAT 5334 136.039 44.894 86.301 1.00 0.00 H TER 11017 WAT 5334 ATOM 11017 O WAT 5335 47.316 135.361 143.648 1.00 0.00 O ATOM 11018 H1 WAT 5335 47.127 136.198 143.224 1.00 0.00 H ATOM 11019 H2 WAT 5335 46.564 134.809 143.434 1.00 0.00 H TER 11021 WAT 5335 ATOM 11021 O WAT 5336 8.252 115.219 17.914 1.00 0.00 O ATOM 11022 H1 WAT 5336 8.513 114.488 18.474 1.00 0.00 H ATOM 11023 H2 WAT 5336 7.598 115.692 18.428 1.00 0.00 H TER 11025 WAT 5336 ATOM 11025 O WAT 5337 58.302 130.310 141.870 1.00 0.00 O ATOM 11026 H1 WAT 5337 58.448 130.302 142.816 1.00 0.00 H ATOM 11027 H2 WAT 5337 58.512 129.420 141.588 1.00 0.00 H TER 11029 WAT 5337 ATOM 11029 O WAT 5338 55.946 126.571 56.397 1.00 0.00 O ATOM 11030 H1 WAT 5338 55.633 126.993 57.197 1.00 0.00 H ATOM 11031 H2 WAT 5338 56.601 127.175 56.048 1.00 0.00 H TER 11033 WAT 5338 ATOM 11033 O WAT 5339 93.532 62.509 13.575 1.00 0.00 O ATOM 11034 H1 WAT 5339 93.596 61.682 14.054 1.00 0.00 H ATOM 11035 H2 WAT 5339 94.360 62.575 13.099 1.00 0.00 H TER 11037 WAT 5339 ATOM 11037 O WAT 5340 144.025 109.256 105.292 1.00 0.00 O ATOM 11038 H1 WAT 5340 144.208 108.323 105.180 1.00 0.00 H ATOM 11039 H2 WAT 5340 144.832 109.692 105.019 1.00 0.00 H TER 11041 WAT 5340 ATOM 11041 O WAT 5341 44.135 11.725 89.525 1.00 0.00 O ATOM 11042 H1 WAT 5341 44.076 12.547 90.012 1.00 0.00 H ATOM 11043 H2 WAT 5341 44.126 11.046 90.200 1.00 0.00 H TER 11045 WAT 5341 ATOM 11045 O WAT 5342 7.430 61.008 108.912 1.00 0.00 O ATOM 11046 H1 WAT 5342 7.651 61.486 109.711 1.00 0.00 H ATOM 11047 H2 WAT 5342 8.099 61.274 108.281 1.00 0.00 H TER 11049 WAT 5342 ATOM 11049 O WAT 5343 17.593 141.106 94.214 1.00 0.00 O ATOM 11050 H1 WAT 5343 17.289 141.574 94.991 1.00 0.00 H ATOM 11051 H2 WAT 5343 18.462 141.469 94.041 1.00 0.00 H TER 11053 WAT 5343 ATOM 11053 O WAT 5344 86.848 143.250 83.594 1.00 0.00 O ATOM 11054 H1 WAT 5344 87.637 142.994 84.072 1.00 0.00 H ATOM 11055 H2 WAT 5344 86.311 143.703 84.244 1.00 0.00 H TER 11057 WAT 5344 ATOM 11057 O WAT 5345 129.158 127.775 156.946 1.00 0.00 O ATOM 11058 H1 WAT 5345 128.630 127.576 156.173 1.00 0.00 H ATOM 11059 H2 WAT 5345 129.444 128.679 156.815 1.00 0.00 H TER 11061 WAT 5345 ATOM 11061 O WAT 5346 62.246 129.718 78.485 1.00 0.00 O ATOM 11062 H1 WAT 5346 61.744 130.353 77.973 1.00 0.00 H ATOM 11063 H2 WAT 5346 63.100 129.685 78.055 1.00 0.00 H TER 11065 WAT 5346 ATOM 11065 O WAT 5347 130.855 102.846 133.541 1.00 0.00 O ATOM 11066 H1 WAT 5347 131.348 103.401 134.145 1.00 0.00 H ATOM 11067 H2 WAT 5347 131.513 102.518 132.927 1.00 0.00 H TER 11069 WAT 5347 ATOM 11069 O WAT 5348 0.477 45.477 92.103 1.00 0.00 O ATOM 11070 H1 WAT 5348 -0.157 45.828 91.477 1.00 0.00 H ATOM 11071 H2 WAT 5348 1.273 45.344 91.588 1.00 0.00 H TER 11073 WAT 5348 ATOM 11073 O WAT 5349 15.684 47.343 133.924 1.00 0.00 O ATOM 11074 H1 WAT 5349 15.475 46.414 133.826 1.00 0.00 H ATOM 11075 H2 WAT 5349 14.981 47.689 134.474 1.00 0.00 H TER 11077 WAT 5349 ATOM 11077 O WAT 5350 145.493 80.839 93.195 1.00 0.00 O ATOM 11078 H1 WAT 5350 145.989 81.069 92.409 1.00 0.00 H ATOM 11079 H2 WAT 5350 145.239 81.681 93.572 1.00 0.00 H TER 11081 WAT 5350 ATOM 11081 O WAT 5351 88.131 22.661 130.819 1.00 0.00 O ATOM 11082 H1 WAT 5351 88.194 21.796 130.415 1.00 0.00 H ATOM 11083 H2 WAT 5351 87.277 22.661 131.252 1.00 0.00 H TER 11085 WAT 5351 ATOM 11085 O WAT 5352 86.199 90.923 11.087 1.00 0.00 O ATOM 11086 H1 WAT 5352 85.553 90.464 11.624 1.00 0.00 H ATOM 11087 H2 WAT 5352 85.677 91.442 10.475 1.00 0.00 H TER 11089 WAT 5352 ATOM 11089 O WAT 5353 32.383 69.923 121.545 1.00 0.00 O ATOM 11090 H1 WAT 5353 32.082 69.643 120.681 1.00 0.00 H ATOM 11091 H2 WAT 5353 31.602 69.877 122.098 1.00 0.00 H TER 11093 WAT 5353 ATOM 11093 O WAT 5354 104.158 56.198 114.978 1.00 0.00 O ATOM 11094 H1 WAT 5354 104.497 56.292 115.868 1.00 0.00 H ATOM 11095 H2 WAT 5354 104.692 56.796 114.454 1.00 0.00 H TER 11097 WAT 5354 ATOM 11097 O WAT 5355 91.430 94.080 80.102 1.00 0.00 O ATOM 11098 H1 WAT 5355 91.204 94.747 79.453 1.00 0.00 H ATOM 11099 H2 WAT 5355 91.358 93.251 79.629 1.00 0.00 H TER 11101 WAT 5355 ATOM 11101 O WAT 5356 106.769 34.013 130.151 1.00 0.00 O ATOM 11102 H1 WAT 5356 107.431 34.473 129.635 1.00 0.00 H ATOM 11103 H2 WAT 5356 106.918 33.087 129.961 1.00 0.00 H TER 11105 WAT 5356 ATOM 11105 O WAT 5357 105.394 26.609 75.349 1.00 0.00 O ATOM 11106 H1 WAT 5357 105.178 25.739 75.011 1.00 0.00 H ATOM 11107 H2 WAT 5357 106.053 26.945 74.742 1.00 0.00 H TER 11109 WAT 5357 ATOM 11109 O WAT 5358 112.309 71.735 77.485 1.00 0.00 O ATOM 11110 H1 WAT 5358 112.912 71.137 77.044 1.00 0.00 H ATOM 11111 H2 WAT 5358 111.461 71.294 77.444 1.00 0.00 H TER 11113 WAT 5358 ATOM 11113 O WAT 5359 119.794 40.890 145.132 1.00 0.00 O ATOM 11114 H1 WAT 5359 120.311 41.608 144.767 1.00 0.00 H ATOM 11115 H2 WAT 5359 120.372 40.129 145.082 1.00 0.00 H TER 11117 WAT 5359 ATOM 11117 O WAT 5360 45.897 54.640 95.195 1.00 0.00 O ATOM 11118 H1 WAT 5360 45.660 53.869 94.679 1.00 0.00 H ATOM 11119 H2 WAT 5360 46.511 54.309 95.851 1.00 0.00 H TER 11121 WAT 5360 ATOM 11121 O WAT 5361 99.541 99.506 21.524 1.00 0.00 O ATOM 11122 H1 WAT 5361 100.232 98.843 21.527 1.00 0.00 H ATOM 11123 H2 WAT 5361 99.833 100.160 22.158 1.00 0.00 H TER 11125 WAT 5361 ATOM 11125 O WAT 5362 31.372 16.069 125.376 1.00 0.00 O ATOM 11126 H1 WAT 5362 31.722 15.559 126.106 1.00 0.00 H ATOM 11127 H2 WAT 5362 31.553 15.535 124.602 1.00 0.00 H TER 11129 WAT 5362 ATOM 11129 O WAT 5363 137.087 38.585 12.265 1.00 0.00 O ATOM 11130 H1 WAT 5363 137.231 38.049 13.045 1.00 0.00 H ATOM 11131 H2 WAT 5363 136.663 39.377 12.593 1.00 0.00 H TER 11133 WAT 5363 ATOM 11133 O WAT 5364 120.017 69.535 154.047 1.00 0.00 O ATOM 11134 H1 WAT 5364 120.510 69.655 153.235 1.00 0.00 H ATOM 11135 H2 WAT 5364 119.894 68.588 154.115 1.00 0.00 H TER 11137 WAT 5364 ATOM 11137 O WAT 5365 122.608 86.016 106.832 1.00 0.00 O ATOM 11138 H1 WAT 5365 121.848 85.927 107.407 1.00 0.00 H ATOM 11139 H2 WAT 5365 123.325 86.258 107.419 1.00 0.00 H TER 11141 WAT 5365 ATOM 11141 O WAT 5366 67.768 121.932 136.782 1.00 0.00 O ATOM 11142 H1 WAT 5366 67.617 121.161 137.329 1.00 0.00 H ATOM 11143 H2 WAT 5366 68.409 122.450 137.269 1.00 0.00 H TER 11145 WAT 5366 ATOM 11145 O WAT 5367 84.007 57.345 155.028 1.00 0.00 O ATOM 11146 H1 WAT 5367 83.053 57.294 154.962 1.00 0.00 H ATOM 11147 H2 WAT 5367 84.318 56.520 154.655 1.00 0.00 H TER 11149 WAT 5367 ATOM 11149 O WAT 5368 69.807 116.899 119.711 1.00 0.00 O ATOM 11150 H1 WAT 5368 69.298 116.284 120.239 1.00 0.00 H ATOM 11151 H2 WAT 5368 70.428 117.288 120.327 1.00 0.00 H TER 11153 WAT 5368 ATOM 11153 O WAT 5369 7.972 128.958 95.953 1.00 0.00 O ATOM 11154 H1 WAT 5369 8.628 128.440 96.419 1.00 0.00 H ATOM 11155 H2 WAT 5369 8.021 128.648 95.048 1.00 0.00 H TER 11157 WAT 5369 ATOM 11157 O WAT 5370 105.996 115.443 101.443 1.00 0.00 O ATOM 11158 H1 WAT 5370 106.835 115.030 101.650 1.00 0.00 H ATOM 11159 H2 WAT 5370 106.202 116.066 100.747 1.00 0.00 H TER 11161 WAT 5370 ATOM 11161 O WAT 5371 9.883 116.980 118.066 1.00 0.00 O ATOM 11162 H1 WAT 5371 10.170 117.568 117.366 1.00 0.00 H ATOM 11163 H2 WAT 5371 10.617 116.380 118.191 1.00 0.00 H TER 11165 WAT 5371 ATOM 11165 O WAT 5372 87.535 73.897 2.853 1.00 0.00 O ATOM 11166 H1 WAT 5372 87.529 74.836 2.669 1.00 0.00 H ATOM 11167 H2 WAT 5372 88.219 73.785 3.512 1.00 0.00 H TER 11169 WAT 5372 ATOM 11169 O WAT 5373 103.652 101.202 94.636 1.00 0.00 O ATOM 11170 H1 WAT 5373 103.109 101.929 94.331 1.00 0.00 H ATOM 11171 H2 WAT 5373 103.076 100.439 94.591 1.00 0.00 H TER 11173 WAT 5373 ATOM 11173 O WAT 5374 14.754 64.353 147.271 1.00 0.00 O ATOM 11174 H1 WAT 5374 14.008 63.771 147.416 1.00 0.00 H ATOM 11175 H2 WAT 5374 14.544 64.815 146.460 1.00 0.00 H TER 11177 WAT 5374 ATOM 11177 O WAT 5375 66.431 101.149 114.424 1.00 0.00 O ATOM 11178 H1 WAT 5375 66.166 102.068 114.477 1.00 0.00 H ATOM 11179 H2 WAT 5375 66.310 100.918 113.503 1.00 0.00 H TER 11181 WAT 5375 ATOM 11181 O WAT 5376 15.039 48.913 102.543 1.00 0.00 O ATOM 11182 H1 WAT 5376 14.592 48.770 103.377 1.00 0.00 H ATOM 11183 H2 WAT 5376 15.420 48.062 102.326 1.00 0.00 H TER 11185 WAT 5376 ATOM 11185 O WAT 5377 105.143 80.232 74.822 1.00 0.00 O ATOM 11186 H1 WAT 5377 105.629 80.197 75.646 1.00 0.00 H ATOM 11187 H2 WAT 5377 105.584 80.912 74.313 1.00 0.00 H TER 11189 WAT 5377 ATOM 11189 O WAT 5378 2.449 107.264 15.160 1.00 0.00 O ATOM 11190 H1 WAT 5378 3.268 106.814 15.367 1.00 0.00 H ATOM 11191 H2 WAT 5378 2.532 108.119 15.581 1.00 0.00 H TER 11193 WAT 5378 ATOM 11193 O WAT 5379 135.321 85.985 61.075 1.00 0.00 O ATOM 11194 H1 WAT 5379 134.495 85.962 61.557 1.00 0.00 H ATOM 11195 H2 WAT 5379 135.415 86.898 60.803 1.00 0.00 H TER 11197 WAT 5379 ATOM 11197 O WAT 5380 64.881 85.134 128.082 1.00 0.00 O ATOM 11198 H1 WAT 5380 64.338 85.915 128.195 1.00 0.00 H ATOM 11199 H2 WAT 5380 65.780 85.462 128.113 1.00 0.00 H TER 11201 WAT 5380 ATOM 11201 O WAT 5381 53.043 25.359 89.894 1.00 0.00 O ATOM 11202 H1 WAT 5381 53.246 25.447 88.962 1.00 0.00 H ATOM 11203 H2 WAT 5381 53.115 26.249 90.240 1.00 0.00 H TER 11205 WAT 5381 ATOM 11205 O WAT 5382 13.107 129.596 109.186 1.00 0.00 O ATOM 11206 H1 WAT 5382 12.512 129.630 109.936 1.00 0.00 H ATOM 11207 H2 WAT 5382 13.504 130.466 109.156 1.00 0.00 H TER 11209 WAT 5382 ATOM 11209 O WAT 5383 123.824 83.078 84.845 1.00 0.00 O ATOM 11210 H1 WAT 5383 123.414 82.803 85.665 1.00 0.00 H ATOM 11211 H2 WAT 5383 123.662 82.353 84.242 1.00 0.00 H TER 11213 WAT 5383 ATOM 11213 O WAT 5384 82.031 6.756 144.061 1.00 0.00 O ATOM 11214 H1 WAT 5384 82.698 7.335 143.691 1.00 0.00 H ATOM 11215 H2 WAT 5384 81.339 6.736 143.401 1.00 0.00 H TER 11217 WAT 5384 ATOM 11217 O WAT 5385 129.631 28.363 87.718 1.00 0.00 O ATOM 11218 H1 WAT 5385 130.437 28.840 87.522 1.00 0.00 H ATOM 11219 H2 WAT 5385 128.979 29.047 87.872 1.00 0.00 H TER 11221 WAT 5385 ATOM 11221 O WAT 5386 129.765 67.271 93.731 1.00 0.00 O ATOM 11222 H1 WAT 5386 129.765 66.503 93.160 1.00 0.00 H ATOM 11223 H2 WAT 5386 129.837 68.014 93.132 1.00 0.00 H TER 11225 WAT 5386 ATOM 11225 O WAT 5387 115.364 143.275 154.042 1.00 0.00 O ATOM 11226 H1 WAT 5387 115.130 143.055 153.141 1.00 0.00 H ATOM 11227 H2 WAT 5387 114.628 143.799 154.360 1.00 0.00 H TER 11229 WAT 5387 ATOM 11229 O WAT 5388 10.754 117.721 132.687 1.00 0.00 O ATOM 11230 H1 WAT 5388 11.024 118.456 133.238 1.00 0.00 H ATOM 11231 H2 WAT 5388 9.797 117.744 132.711 1.00 0.00 H TER 11233 WAT 5388 ATOM 11233 O WAT 5389 89.137 52.436 155.453 1.00 0.00 O ATOM 11234 H1 WAT 5389 89.824 52.949 155.030 1.00 0.00 H ATOM 11235 H2 WAT 5389 88.561 53.088 155.852 1.00 0.00 H TER 11237 WAT 5389 ATOM 11237 O WAT 5390 18.045 50.101 70.816 1.00 0.00 O ATOM 11238 H1 WAT 5390 18.747 50.618 71.210 1.00 0.00 H ATOM 11239 H2 WAT 5390 17.604 50.709 70.222 1.00 0.00 H TER 11241 WAT 5390 ATOM 11241 O WAT 5391 58.798 26.853 10.558 1.00 0.00 O ATOM 11242 H1 WAT 5391 59.018 26.901 11.489 1.00 0.00 H ATOM 11243 H2 WAT 5391 58.525 25.946 10.422 1.00 0.00 H TER 11245 WAT 5391 ATOM 11245 O WAT 5392 103.049 20.707 62.898 1.00 0.00 O ATOM 11246 H1 WAT 5392 102.094 20.775 62.894 1.00 0.00 H ATOM 11247 H2 WAT 5392 103.258 20.228 62.096 1.00 0.00 H TER 11249 WAT 5392 ATOM 11249 O WAT 5393 9.212 44.306 143.683 1.00 0.00 O ATOM 11250 H1 WAT 5393 9.958 44.793 143.332 1.00 0.00 H ATOM 11251 H2 WAT 5393 9.193 44.532 144.612 1.00 0.00 H TER 11253 WAT 5393 ATOM 11253 O WAT 5394 30.296 62.043 118.666 1.00 0.00 O ATOM 11254 H1 WAT 5394 29.943 61.673 117.857 1.00 0.00 H ATOM 11255 H2 WAT 5394 29.619 61.876 119.322 1.00 0.00 H TER 11257 WAT 5394 ATOM 11257 O WAT 5395 138.642 20.935 133.039 1.00 0.00 O ATOM 11258 H1 WAT 5395 139.434 21.106 132.529 1.00 0.00 H ATOM 11259 H2 WAT 5395 138.527 19.986 132.990 1.00 0.00 H TER 11261 WAT 5395 ATOM 11261 O WAT 5396 64.604 5.532 57.177 1.00 0.00 O ATOM 11262 H1 WAT 5396 63.684 5.448 57.428 1.00 0.00 H ATOM 11263 H2 WAT 5396 65.067 5.661 58.005 1.00 0.00 H TER 11265 WAT 5396 ATOM 11265 O WAT 5397 135.760 121.497 15.168 1.00 0.00 O ATOM 11266 H1 WAT 5397 134.953 121.026 14.958 1.00 0.00 H ATOM 11267 H2 WAT 5397 135.844 121.413 16.118 1.00 0.00 H TER 11269 WAT 5397 ATOM 11269 O WAT 5398 102.873 95.729 121.127 1.00 0.00 O ATOM 11270 H1 WAT 5398 103.115 95.695 122.053 1.00 0.00 H ATOM 11271 H2 WAT 5398 101.952 95.991 121.130 1.00 0.00 H TER 11273 WAT 5398 ATOM 11273 O WAT 5399 144.934 88.376 117.049 1.00 0.00 O ATOM 11274 H1 WAT 5399 145.023 89.238 117.456 1.00 0.00 H ATOM 11275 H2 WAT 5399 145.812 87.999 117.093 1.00 0.00 H TER 11277 WAT 5399 ATOM 11277 O WAT 5400 132.953 82.446 131.579 1.00 0.00 O ATOM 11278 H1 WAT 5400 132.397 81.681 131.728 1.00 0.00 H ATOM 11279 H2 WAT 5400 133.794 82.210 131.969 1.00 0.00 H TER 11281 WAT 5400 ATOM 11281 O WAT 5401 51.475 135.976 105.606 1.00 0.00 O ATOM 11282 H1 WAT 5401 51.864 136.164 104.752 1.00 0.00 H ATOM 11283 H2 WAT 5401 52.147 136.233 106.237 1.00 0.00 H TER 11285 WAT 5401 ATOM 11285 O WAT 5402 128.982 70.632 60.310 1.00 0.00 O ATOM 11286 H1 WAT 5402 128.647 69.933 59.748 1.00 0.00 H ATOM 11287 H2 WAT 5402 128.901 71.425 59.780 1.00 0.00 H TER 11289 WAT 5402 ATOM 11289 O WAT 5403 109.391 105.460 148.526 1.00 0.00 O ATOM 11290 H1 WAT 5403 109.331 105.108 149.414 1.00 0.00 H ATOM 11291 H2 WAT 5403 110.188 105.070 148.167 1.00 0.00 H TER 11293 WAT 5403 ATOM 11293 O WAT 5404 1.012 126.465 80.186 1.00 0.00 O ATOM 11294 H1 WAT 5404 1.492 127.089 79.642 1.00 0.00 H ATOM 11295 H2 WAT 5404 0.601 127.003 80.862 1.00 0.00 H TER 11297 WAT 5404 ATOM 11297 O WAT 5405 61.245 69.799 25.381 1.00 0.00 O ATOM 11298 H1 WAT 5405 62.013 69.568 25.903 1.00 0.00 H ATOM 11299 H2 WAT 5405 61.440 70.673 25.043 1.00 0.00 H TER 11301 WAT 5405 ATOM 11301 O WAT 5406 71.972 82.054 83.625 1.00 0.00 O ATOM 11302 H1 WAT 5406 71.525 82.385 82.846 1.00 0.00 H ATOM 11303 H2 WAT 5406 71.288 82.012 84.294 1.00 0.00 H TER 11305 WAT 5406 ATOM 11305 O WAT 5407 60.757 122.682 66.612 1.00 0.00 O ATOM 11306 H1 WAT 5407 59.915 123.137 66.636 1.00 0.00 H ATOM 11307 H2 WAT 5407 60.815 122.242 67.460 1.00 0.00 H TER 11309 WAT 5407 ATOM 11309 O WAT 5408 36.928 54.597 15.794 1.00 0.00 O ATOM 11310 H1 WAT 5408 36.903 55.084 16.617 1.00 0.00 H ATOM 11311 H2 WAT 5408 37.350 53.768 16.019 1.00 0.00 H TER 11313 WAT 5408 ATOM 11313 O WAT 5409 128.008 65.743 102.516 1.00 0.00 O ATOM 11314 H1 WAT 5409 128.682 66.028 103.134 1.00 0.00 H ATOM 11315 H2 WAT 5409 127.433 65.178 103.032 1.00 0.00 H TER 11317 WAT 5409 ATOM 11317 O WAT 5410 32.322 64.764 11.580 1.00 0.00 O ATOM 11318 H1 WAT 5410 33.102 65.151 11.181 1.00 0.00 H ATOM 11319 H2 WAT 5410 32.646 63.984 12.030 1.00 0.00 H TER 11321 WAT 5410 ATOM 11321 O WAT 5411 2.784 145.001 122.037 1.00 0.00 O ATOM 11322 H1 WAT 5411 3.535 145.579 121.896 1.00 0.00 H ATOM 11323 H2 WAT 5411 3.075 144.391 122.715 1.00 0.00 H TER 11325 WAT 5411 ATOM 11325 O WAT 5412 22.097 98.470 74.863 1.00 0.00 O ATOM 11326 H1 WAT 5412 21.141 98.429 74.845 1.00 0.00 H ATOM 11327 H2 WAT 5412 22.302 99.383 74.663 1.00 0.00 H TER 11329 WAT 5412 ATOM 11329 O WAT 5413 29.700 144.704 77.836 1.00 0.00 O ATOM 11330 H1 WAT 5413 29.734 144.671 78.792 1.00 0.00 H ATOM 11331 H2 WAT 5413 30.362 145.352 77.596 1.00 0.00 H TER 11333 WAT 5413 ATOM 11333 O WAT 5414 93.021 22.109 17.993 1.00 0.00 O ATOM 11334 H1 WAT 5414 92.932 21.156 18.026 1.00 0.00 H ATOM 11335 H2 WAT 5414 93.661 22.313 18.675 1.00 0.00 H TER 11337 WAT 5414 ATOM 11337 O WAT 5415 104.492 40.215 80.880 1.00 0.00 O ATOM 11338 H1 WAT 5415 105.097 40.531 80.209 1.00 0.00 H ATOM 11339 H2 WAT 5415 104.602 40.825 81.609 1.00 0.00 H TER 11341 WAT 5415 ATOM 11341 O WAT 5416 145.149 83.260 126.184 1.00 0.00 O ATOM 11342 H1 WAT 5416 145.445 82.472 126.641 1.00 0.00 H ATOM 11343 H2 WAT 5416 144.581 82.933 125.487 1.00 0.00 H TER 11345 WAT 5416 ATOM 11345 O WAT 5417 51.990 8.256 155.679 1.00 0.00 O ATOM 11346 H1 WAT 5417 52.177 9.143 155.370 1.00 0.00 H ATOM 11347 H2 WAT 5417 51.680 8.375 156.577 1.00 0.00 H TER 11349 WAT 5417 ATOM 11349 O WAT 5418 141.663 121.040 118.361 1.00 0.00 O ATOM 11350 H1 WAT 5418 142.238 121.193 117.611 1.00 0.00 H ATOM 11351 H2 WAT 5418 141.588 121.896 118.783 1.00 0.00 H TER 11353 WAT 5418 ATOM 11353 O WAT 5419 20.668 38.178 4.011 1.00 0.00 O ATOM 11354 H1 WAT 5419 19.770 38.486 4.131 1.00 0.00 H ATOM 11355 H2 WAT 5419 20.973 37.975 4.895 1.00 0.00 H TER 11357 WAT 5419 ATOM 11357 O WAT 5420 122.529 43.344 150.393 1.00 0.00 O ATOM 11358 H1 WAT 5420 121.781 43.932 150.503 1.00 0.00 H ATOM 11359 H2 WAT 5420 122.173 42.471 150.554 1.00 0.00 H TER 11361 WAT 5420 ATOM 11361 O WAT 5421 137.738 12.944 150.838 1.00 0.00 O ATOM 11362 H1 WAT 5421 137.333 12.715 151.674 1.00 0.00 H ATOM 11363 H2 WAT 5421 138.154 12.134 150.543 1.00 0.00 H TER 11365 WAT 5421 ATOM 11365 O WAT 5422 109.936 59.937 121.242 1.00 0.00 O ATOM 11366 H1 WAT 5422 109.036 60.249 121.345 1.00 0.00 H ATOM 11367 H2 WAT 5422 110.008 59.209 121.859 1.00 0.00 H TER 11369 WAT 5422 ATOM 11369 O WAT 5423 5.418 85.877 140.864 1.00 0.00 O ATOM 11370 H1 WAT 5423 5.356 85.569 141.769 1.00 0.00 H ATOM 11371 H2 WAT 5423 5.704 85.109 140.370 1.00 0.00 H TER 11373 WAT 5423 ATOM 11373 O WAT 5424 108.424 90.791 153.133 1.00 0.00 O ATOM 11374 H1 WAT 5424 109.145 90.184 152.966 1.00 0.00 H ATOM 11375 H2 WAT 5424 107.634 90.275 152.973 1.00 0.00 H TER 11377 WAT 5424 ATOM 11377 O WAT 5425 113.832 52.891 108.273 1.00 0.00 O ATOM 11378 H1 WAT 5425 114.430 53.203 107.593 1.00 0.00 H ATOM 11379 H2 WAT 5425 114.148 53.302 109.077 1.00 0.00 H TER 11381 WAT 5425 ATOM 11381 O WAT 5426 5.248 103.389 122.041 1.00 0.00 O ATOM 11382 H1 WAT 5426 4.539 104.010 121.873 1.00 0.00 H ATOM 11383 H2 WAT 5426 4.806 102.548 122.159 1.00 0.00 H TER 11385 WAT 5426 ATOM 11385 O WAT 5427 130.526 76.286 156.928 1.00 0.00 O ATOM 11386 H1 WAT 5427 130.876 77.155 156.732 1.00 0.00 H ATOM 11387 H2 WAT 5427 130.039 76.403 157.745 1.00 0.00 H TER 11389 WAT 5427 ATOM 11389 O WAT 5428 18.583 24.088 120.343 1.00 0.00 O ATOM 11390 H1 WAT 5428 17.809 23.762 120.803 1.00 0.00 H ATOM 11391 H2 WAT 5428 18.891 23.339 119.833 1.00 0.00 H TER 11393 WAT 5428 ATOM 11393 O WAT 5429 99.161 119.423 152.530 1.00 0.00 O ATOM 11394 H1 WAT 5429 98.866 118.606 152.127 1.00 0.00 H ATOM 11395 H2 WAT 5429 98.805 120.110 151.967 1.00 0.00 H TER 11397 WAT 5429 ATOM 11397 O WAT 5430 14.543 8.368 110.896 1.00 0.00 O ATOM 11398 H1 WAT 5430 15.250 8.052 111.459 1.00 0.00 H ATOM 11399 H2 WAT 5430 14.966 8.539 110.054 1.00 0.00 H TER 11401 WAT 5430 ATOM 11401 O WAT 5431 107.939 29.643 85.710 1.00 0.00 O ATOM 11402 H1 WAT 5431 107.220 29.291 86.234 1.00 0.00 H ATOM 11403 H2 WAT 5431 108.370 30.273 86.288 1.00 0.00 H TER 11405 WAT 5431 ATOM 11405 O WAT 5432 73.883 90.733 83.729 1.00 0.00 O ATOM 11406 H1 WAT 5432 72.976 90.864 84.004 1.00 0.00 H ATOM 11407 H2 WAT 5432 73.862 90.833 82.777 1.00 0.00 H TER 11409 WAT 5432 ATOM 11409 O WAT 5433 18.588 14.256 128.106 1.00 0.00 O ATOM 11410 H1 WAT 5433 19.371 14.767 128.311 1.00 0.00 H ATOM 11411 H2 WAT 5433 17.870 14.888 128.155 1.00 0.00 H TER 11413 WAT 5433 ATOM 11413 O WAT 5434 112.779 4.893 74.272 1.00 0.00 O ATOM 11414 H1 WAT 5434 113.145 5.131 75.124 1.00 0.00 H ATOM 11415 H2 WAT 5434 111.972 5.405 74.207 1.00 0.00 H TER 11417 WAT 5434 ATOM 11417 O WAT 5435 73.238 90.118 55.651 1.00 0.00 O ATOM 11418 H1 WAT 5435 73.794 89.754 56.340 1.00 0.00 H ATOM 11419 H2 WAT 5435 72.596 89.431 55.473 1.00 0.00 H TER 11421 WAT 5435 ATOM 11421 O WAT 5436 105.091 69.412 75.986 1.00 0.00 O ATOM 11422 H1 WAT 5436 104.926 68.970 75.153 1.00 0.00 H ATOM 11423 H2 WAT 5436 104.374 70.041 76.069 1.00 0.00 H TER 11425 WAT 5436 ATOM 11425 O WAT 5437 82.776 119.678 95.162 1.00 0.00 O ATOM 11426 H1 WAT 5437 82.634 120.454 94.619 1.00 0.00 H ATOM 11427 H2 WAT 5437 81.925 119.510 95.566 1.00 0.00 H TER 11429 WAT 5437 ATOM 11429 O WAT 5438 73.123 47.453 116.038 1.00 0.00 O ATOM 11430 H1 WAT 5438 73.265 46.603 116.455 1.00 0.00 H ATOM 11431 H2 WAT 5438 73.979 47.692 115.682 1.00 0.00 H TER 11433 WAT 5438 ATOM 11433 O WAT 5439 104.415 35.343 114.121 1.00 0.00 O ATOM 11434 H1 WAT 5439 103.808 35.569 114.826 1.00 0.00 H ATOM 11435 H2 WAT 5439 103.907 34.778 113.540 1.00 0.00 H TER 11437 WAT 5439 ATOM 11437 O WAT 5440 122.662 84.082 9.998 1.00 0.00 O ATOM 11438 H1 WAT 5440 122.897 84.726 10.666 1.00 0.00 H ATOM 11439 H2 WAT 5440 122.837 84.523 9.167 1.00 0.00 H TER 11441 WAT 5440 ATOM 11441 O WAT 5441 110.973 48.746 73.971 1.00 0.00 O ATOM 11442 H1 WAT 5441 110.633 47.855 73.889 1.00 0.00 H ATOM 11443 H2 WAT 5441 111.377 48.769 74.838 1.00 0.00 H TER 11445 WAT 5441 ATOM 11445 O WAT 5442 134.861 5.085 2.095 1.00 0.00 O ATOM 11446 H1 WAT 5442 134.143 4.981 2.719 1.00 0.00 H ATOM 11447 H2 WAT 5442 135.650 4.897 2.603 1.00 0.00 H TER 11449 WAT 5442 ATOM 11449 O WAT 5443 47.483 60.349 121.899 1.00 0.00 O ATOM 11450 H1 WAT 5443 48.202 60.921 122.169 1.00 0.00 H ATOM 11451 H2 WAT 5443 47.533 59.603 122.496 1.00 0.00 H TER 11453 WAT 5443 ATOM 11453 O WAT 5444 64.701 139.752 145.047 1.00 0.00 O ATOM 11454 H1 WAT 5444 64.846 140.668 144.809 1.00 0.00 H ATOM 11455 H2 WAT 5444 65.512 139.309 144.799 1.00 0.00 H TER 11457 WAT 5444 ATOM 11457 O WAT 5445 38.411 128.964 98.469 1.00 0.00 O ATOM 11458 H1 WAT 5445 39.024 128.801 97.752 1.00 0.00 H ATOM 11459 H2 WAT 5445 37.608 128.515 98.205 1.00 0.00 H TER 11461 WAT 5445 ATOM 11461 O WAT 5446 69.042 30.092 98.608 1.00 0.00 O ATOM 11462 H1 WAT 5446 69.994 30.124 98.698 1.00 0.00 H ATOM 11463 H2 WAT 5446 68.716 30.105 99.508 1.00 0.00 H TER 11465 WAT 5446 ATOM 11465 O WAT 5447 76.054 89.526 119.499 1.00 0.00 O ATOM 11466 H1 WAT 5447 75.348 88.881 119.452 1.00 0.00 H ATOM 11467 H2 WAT 5447 76.509 89.324 120.317 1.00 0.00 H TER 11469 WAT 5447 ATOM 11469 O WAT 5448 110.430 65.801 110.256 1.00 0.00 O ATOM 11470 H1 WAT 5448 111.312 65.548 110.530 1.00 0.00 H ATOM 11471 H2 WAT 5448 110.551 66.190 109.390 1.00 0.00 H TER 11473 WAT 5448 ATOM 11473 O WAT 5449 52.643 127.283 133.046 1.00 0.00 O ATOM 11474 H1 WAT 5449 51.786 127.611 133.317 1.00 0.00 H ATOM 11475 H2 WAT 5449 53.161 127.273 133.850 1.00 0.00 H TER 11477 WAT 5449 ATOM 11477 O WAT 5450 43.725 129.893 132.056 1.00 0.00 O ATOM 11478 H1 WAT 5450 44.497 130.404 132.298 1.00 0.00 H ATOM 11479 H2 WAT 5450 43.886 129.630 131.150 1.00 0.00 H TER 11481 WAT 5450 ATOM 11481 O WAT 5451 58.725 138.640 122.001 1.00 0.00 O ATOM 11482 H1 WAT 5451 57.892 138.302 122.331 1.00 0.00 H ATOM 11483 H2 WAT 5451 58.487 139.153 121.229 1.00 0.00 H TER 11485 WAT 5451 ATOM 11485 O WAT 5452 122.570 51.076 96.640 1.00 0.00 O ATOM 11486 H1 WAT 5452 123.206 50.542 96.165 1.00 0.00 H ATOM 11487 H2 WAT 5452 122.084 50.449 97.177 1.00 0.00 H TER 11489 WAT 5452 ATOM 11489 O WAT 5453 128.591 136.907 1.665 1.00 0.00 O ATOM 11490 H1 WAT 5453 128.120 136.159 2.031 1.00 0.00 H ATOM 11491 H2 WAT 5453 127.909 137.447 1.266 1.00 0.00 H TER 11493 WAT 5453 ATOM 11493 O WAT 5454 133.163 57.514 20.414 1.00 0.00 O ATOM 11494 H1 WAT 5454 133.698 57.836 21.139 1.00 0.00 H ATOM 11495 H2 WAT 5454 132.311 57.933 20.541 1.00 0.00 H TER 11497 WAT 5454 ATOM 11497 O WAT 5455 117.951 128.799 144.849 1.00 0.00 O ATOM 11498 H1 WAT 5455 118.498 128.681 145.625 1.00 0.00 H ATOM 11499 H2 WAT 5455 117.135 128.346 145.060 1.00 0.00 H TER 11501 WAT 5455 ATOM 11501 O WAT 5456 59.759 49.920 121.525 1.00 0.00 O ATOM 11502 H1 WAT 5456 58.926 50.131 121.947 1.00 0.00 H ATOM 11503 H2 WAT 5456 59.952 49.027 121.811 1.00 0.00 H TER 11505 WAT 5456 ATOM 11505 O WAT 5457 11.860 27.588 68.825 1.00 0.00 O ATOM 11506 H1 WAT 5457 10.932 27.567 68.592 1.00 0.00 H ATOM 11507 H2 WAT 5457 12.241 26.846 68.355 1.00 0.00 H TER 11509 WAT 5457 ATOM 11509 O WAT 5458 79.438 111.821 141.429 1.00 0.00 O ATOM 11510 H1 WAT 5458 78.591 112.044 141.044 1.00 0.00 H ATOM 11511 H2 WAT 5458 79.970 112.608 141.310 1.00 0.00 H TER 11513 WAT 5458 ATOM 11513 O WAT 5459 123.719 0.900 6.503 1.00 0.00 O ATOM 11514 H1 WAT 5459 123.219 0.635 5.731 1.00 0.00 H ATOM 11515 H2 WAT 5459 124.610 0.598 6.327 1.00 0.00 H TER 11517 WAT 5459 ATOM 11517 O WAT 5460 52.782 98.427 7.214 1.00 0.00 O ATOM 11518 H1 WAT 5460 52.511 99.331 7.370 1.00 0.00 H ATOM 11519 H2 WAT 5460 52.595 97.975 8.037 1.00 0.00 H TER 11521 WAT 5460 ATOM 11521 O WAT 5461 131.477 58.996 133.532 1.00 0.00 O ATOM 11522 H1 WAT 5461 130.750 58.814 134.127 1.00 0.00 H ATOM 11523 H2 WAT 5461 131.056 59.261 132.714 1.00 0.00 H TER 11525 WAT 5461 ATOM 11525 O WAT 5462 82.801 11.158 95.333 1.00 0.00 O ATOM 11526 H1 WAT 5462 82.606 11.363 96.247 1.00 0.00 H ATOM 11527 H2 WAT 5462 82.352 11.840 94.833 1.00 0.00 H TER 11529 WAT 5462 ATOM 11529 O WAT 5463 59.843 78.214 76.901 1.00 0.00 O ATOM 11530 H1 WAT 5463 59.102 78.798 76.741 1.00 0.00 H ATOM 11531 H2 WAT 5463 60.521 78.516 76.296 1.00 0.00 H TER 11533 WAT 5463 ATOM 11533 O WAT 5464 5.882 35.063 85.380 1.00 0.00 O ATOM 11534 H1 WAT 5464 6.460 34.417 84.974 1.00 0.00 H ATOM 11535 H2 WAT 5464 5.575 35.602 84.651 1.00 0.00 H TER 11537 WAT 5464 ATOM 11537 O WAT 5465 50.305 72.777 76.018 1.00 0.00 O ATOM 11538 H1 WAT 5465 50.487 72.376 75.168 1.00 0.00 H ATOM 11539 H2 WAT 5465 50.507 73.704 75.894 1.00 0.00 H TER 11541 WAT 5465 ATOM 11541 O WAT 5466 85.416 103.976 94.812 1.00 0.00 O ATOM 11542 H1 WAT 5466 85.627 103.058 94.979 1.00 0.00 H ATOM 11543 H2 WAT 5466 84.470 103.981 94.664 1.00 0.00 H TER 11545 WAT 5466 ATOM 11545 O WAT 5467 144.542 134.673 25.150 1.00 0.00 O ATOM 11546 H1 WAT 5467 144.721 134.466 24.233 1.00 0.00 H ATOM 11547 H2 WAT 5467 144.626 135.625 25.202 1.00 0.00 H TER 11549 WAT 5467 ATOM 11549 O WAT 5468 29.946 117.235 147.438 1.00 0.00 O ATOM 11550 H1 WAT 5468 29.113 117.691 147.553 1.00 0.00 H ATOM 11551 H2 WAT 5468 29.929 116.927 146.532 1.00 0.00 H TER 11553 WAT 5468 ATOM 11553 O WAT 5469 97.988 32.862 15.554 1.00 0.00 O ATOM 11554 H1 WAT 5469 98.709 33.478 15.428 1.00 0.00 H ATOM 11555 H2 WAT 5469 97.249 33.262 15.095 1.00 0.00 H TER 11557 WAT 5469 ATOM 11557 O WAT 5470 104.335 79.354 87.061 1.00 0.00 O ATOM 11558 H1 WAT 5470 104.809 79.998 87.586 1.00 0.00 H ATOM 11559 H2 WAT 5470 105.009 78.942 86.521 1.00 0.00 H TER 11561 WAT 5470 ATOM 11561 O WAT 5471 124.302 120.598 148.257 1.00 0.00 O ATOM 11562 H1 WAT 5471 125.124 121.039 148.042 1.00 0.00 H ATOM 11563 H2 WAT 5471 124.485 119.669 148.118 1.00 0.00 H TER 11565 WAT 5471 ATOM 11565 O WAT 5472 138.572 74.020 129.114 1.00 0.00 O ATOM 11566 H1 WAT 5472 137.705 73.625 129.016 1.00 0.00 H ATOM 11567 H2 WAT 5472 138.938 73.605 129.895 1.00 0.00 H TER 11569 WAT 5472 ATOM 11569 O WAT 5473 96.865 107.411 101.071 1.00 0.00 O ATOM 11570 H1 WAT 5473 96.231 108.122 100.981 1.00 0.00 H ATOM 11571 H2 WAT 5473 96.330 106.622 101.159 1.00 0.00 H TER 11573 WAT 5473 ATOM 11573 O WAT 5474 44.739 113.875 121.298 1.00 0.00 O ATOM 11574 H1 WAT 5474 44.522 112.995 121.606 1.00 0.00 H ATOM 11575 H2 WAT 5474 44.219 113.985 120.502 1.00 0.00 H TER 11577 WAT 5474 ATOM 11577 O WAT 5475 71.589 41.519 119.075 1.00 0.00 O ATOM 11578 H1 WAT 5475 71.289 40.628 118.894 1.00 0.00 H ATOM 11579 H2 WAT 5475 72.522 41.423 119.265 1.00 0.00 H TER 11581 WAT 5475 ATOM 11581 O WAT 5476 137.185 118.131 155.961 1.00 0.00 O ATOM 11582 H1 WAT 5476 137.426 117.452 156.591 1.00 0.00 H ATOM 11583 H2 WAT 5476 137.998 118.326 155.496 1.00 0.00 H TER 11585 WAT 5476 ATOM 11585 O WAT 5477 78.758 23.782 4.730 1.00 0.00 O ATOM 11586 H1 WAT 5477 79.048 22.915 5.012 1.00 0.00 H ATOM 11587 H2 WAT 5477 78.913 24.345 5.489 1.00 0.00 H TER 11589 WAT 5477 ATOM 11589 O WAT 5478 28.858 43.481 1.581 1.00 0.00 O ATOM 11590 H1 WAT 5478 28.836 44.372 1.230 1.00 0.00 H ATOM 11591 H2 WAT 5478 27.947 43.290 1.806 1.00 0.00 H TER 11593 WAT 5478 ATOM 11593 O WAT 5479 122.233 122.714 111.235 1.00 0.00 O ATOM 11594 H1 WAT 5479 121.502 122.465 110.669 1.00 0.00 H ATOM 11595 H2 WAT 5479 122.047 122.283 112.069 1.00 0.00 H TER 11597 WAT 5479 ATOM 11597 O WAT 5480 27.506 88.212 9.211 1.00 0.00 O ATOM 11598 H1 WAT 5480 27.603 87.500 8.579 1.00 0.00 H ATOM 11599 H2 WAT 5480 26.588 88.169 9.479 1.00 0.00 H TER 11601 WAT 5480 ATOM 11601 O WAT 5481 108.335 35.876 73.686 1.00 0.00 O ATOM 11602 H1 WAT 5481 108.416 36.583 74.326 1.00 0.00 H ATOM 11603 H2 WAT 5481 107.507 35.449 73.905 1.00 0.00 H TER 11605 WAT 5481 ATOM 11605 O WAT 5482 73.709 65.052 124.647 1.00 0.00 O ATOM 11606 H1 WAT 5482 73.535 65.455 123.796 1.00 0.00 H ATOM 11607 H2 WAT 5482 73.350 64.168 124.572 1.00 0.00 H TER 11609 WAT 5482 ATOM 11609 O WAT 5483 113.834 5.820 60.215 1.00 0.00 O ATOM 11610 H1 WAT 5483 114.361 6.604 60.056 1.00 0.00 H ATOM 11611 H2 WAT 5483 113.725 5.425 59.350 1.00 0.00 H TER 11613 WAT 5483 ATOM 11613 O WAT 5484 138.441 93.471 139.869 1.00 0.00 O ATOM 11614 H1 WAT 5484 138.683 94.370 139.646 1.00 0.00 H ATOM 11615 H2 WAT 5484 139.199 92.947 139.608 1.00 0.00 H TER 11617 WAT 5484 ATOM 11617 O WAT 5485 33.804 79.775 80.762 1.00 0.00 O ATOM 11618 H1 WAT 5485 34.179 79.029 80.294 1.00 0.00 H ATOM 11619 H2 WAT 5485 33.850 79.525 81.685 1.00 0.00 H TER 11621 WAT 5485 ATOM 11621 O WAT 5486 62.534 125.008 115.508 1.00 0.00 O ATOM 11622 H1 WAT 5486 63.235 125.140 116.146 1.00 0.00 H ATOM 11623 H2 WAT 5486 62.362 125.881 115.155 1.00 0.00 H TER 11625 WAT 5486 ATOM 11625 O WAT 5487 99.354 135.758 78.126 1.00 0.00 O ATOM 11626 H1 WAT 5487 98.863 135.856 78.942 1.00 0.00 H ATOM 11627 H2 WAT 5487 98.690 135.819 77.439 1.00 0.00 H TER 11629 WAT 5487 ATOM 11629 O WAT 5488 5.393 48.909 65.067 1.00 0.00 O ATOM 11630 H1 WAT 5488 4.845 49.478 64.527 1.00 0.00 H ATOM 11631 H2 WAT 5488 5.026 48.988 65.947 1.00 0.00 H TER 11633 WAT 5488 ATOM 11633 O WAT 5489 33.702 71.080 95.401 1.00 0.00 O ATOM 11634 H1 WAT 5489 33.830 70.528 94.629 1.00 0.00 H ATOM 11635 H2 WAT 5489 33.050 70.613 95.923 1.00 0.00 H TER 11637 WAT 5489 ATOM 11637 O WAT 5490 129.170 130.153 133.028 1.00 0.00 O ATOM 11638 H1 WAT 5490 129.742 129.422 132.792 1.00 0.00 H ATOM 11639 H2 WAT 5490 129.395 130.844 132.404 1.00 0.00 H TER 11641 WAT 5490 ATOM 11641 O WAT 5491 32.144 128.298 65.450 1.00 0.00 O ATOM 11642 H1 WAT 5491 31.855 128.804 64.691 1.00 0.00 H ATOM 11643 H2 WAT 5491 31.401 128.325 66.053 1.00 0.00 H TER 11645 WAT 5491 ATOM 11645 O WAT 5492 96.560 116.549 9.413 1.00 0.00 O ATOM 11646 H1 WAT 5492 96.178 117.396 9.645 1.00 0.00 H ATOM 11647 H2 WAT 5492 97.068 116.296 10.184 1.00 0.00 H TER 11649 WAT 5492 ATOM 11649 O WAT 5493 3.966 135.430 75.236 1.00 0.00 O ATOM 11650 H1 WAT 5493 3.452 136.118 75.658 1.00 0.00 H ATOM 11651 H2 WAT 5493 4.403 134.980 75.959 1.00 0.00 H TER 11653 WAT 5493 ATOM 11653 O WAT 5494 130.803 104.311 0.113 1.00 0.00 O ATOM 11654 H1 WAT 5494 131.204 103.442 0.098 1.00 0.00 H ATOM 11655 H2 WAT 5494 129.931 104.179 -0.258 1.00 0.00 H TER 11657 WAT 5494 ATOM 11657 O WAT 5495 142.481 28.760 89.081 1.00 0.00 O ATOM 11658 H1 WAT 5495 142.256 29.674 88.911 1.00 0.00 H ATOM 11659 H2 WAT 5495 142.286 28.633 90.009 1.00 0.00 H TER 11661 WAT 5495 ATOM 11661 O WAT 5496 85.637 66.508 140.837 1.00 0.00 O ATOM 11662 H1 WAT 5496 86.093 67.187 141.334 1.00 0.00 H ATOM 11663 H2 WAT 5496 86.196 65.735 140.919 1.00 0.00 H TER 11665 WAT 5496 ATOM 11665 O WAT 5497 90.860 27.851 116.703 1.00 0.00 O ATOM 11666 H1 WAT 5497 90.130 28.409 116.436 1.00 0.00 H ATOM 11667 H2 WAT 5497 91.585 28.119 116.137 1.00 0.00 H TER 11669 WAT 5497 ATOM 11669 O WAT 5498 39.803 78.637 150.339 1.00 0.00 O ATOM 11670 H1 WAT 5498 38.898 78.801 150.076 1.00 0.00 H ATOM 11671 H2 WAT 5498 39.952 79.234 151.073 1.00 0.00 H TER 11673 WAT 5498 ATOM 11673 O WAT 5499 58.364 72.547 8.121 1.00 0.00 O ATOM 11674 H1 WAT 5499 58.165 73.461 7.921 1.00 0.00 H ATOM 11675 H2 WAT 5499 59.235 72.572 8.519 1.00 0.00 H TER 11677 WAT 5499 ATOM 11677 O WAT 5500 63.787 59.643 109.168 1.00 0.00 O ATOM 11678 H1 WAT 5500 63.784 59.086 109.946 1.00 0.00 H ATOM 11679 H2 WAT 5500 64.167 59.095 108.482 1.00 0.00 H TER 11681 WAT 5500 ATOM 11681 O WAT 5501 108.943 7.245 80.973 1.00 0.00 O ATOM 11682 H1 WAT 5501 109.801 7.171 80.555 1.00 0.00 H ATOM 11683 H2 WAT 5501 108.996 8.051 81.486 1.00 0.00 H TER 11685 WAT 5501 ATOM 11685 O WAT 5502 80.298 76.165 113.736 1.00 0.00 O ATOM 11686 H1 WAT 5502 80.376 76.841 114.409 1.00 0.00 H ATOM 11687 H2 WAT 5502 80.638 76.578 112.942 1.00 0.00 H TER 11689 WAT 5502 ATOM 11689 O WAT 5503 109.135 129.449 78.314 1.00 0.00 O ATOM 11690 H1 WAT 5503 109.702 128.714 78.079 1.00 0.00 H ATOM 11691 H2 WAT 5503 109.740 130.147 78.567 1.00 0.00 H TER 11693 WAT 5503 ATOM 11693 O WAT 5504 85.508 97.611 83.048 1.00 0.00 O ATOM 11694 H1 WAT 5504 85.260 98.394 82.556 1.00 0.00 H ATOM 11695 H2 WAT 5504 86.465 97.625 83.054 1.00 0.00 H TER 11697 WAT 5504 ATOM 11697 O WAT 5505 33.078 102.864 65.724 1.00 0.00 O ATOM 11698 H1 WAT 5505 32.776 103.251 66.546 1.00 0.00 H ATOM 11699 H2 WAT 5505 33.707 103.496 65.378 1.00 0.00 H TER 11701 WAT 5505 ATOM 11701 O WAT 5506 111.456 133.774 143.431 1.00 0.00 O ATOM 11702 H1 WAT 5506 111.208 132.858 143.555 1.00 0.00 H ATOM 11703 H2 WAT 5506 112.347 133.830 143.776 1.00 0.00 H TER 11705 WAT 5506 ATOM 11705 O WAT 5507 35.855 132.009 78.027 1.00 0.00 O ATOM 11706 H1 WAT 5507 36.735 131.916 78.392 1.00 0.00 H ATOM 11707 H2 WAT 5507 35.351 131.306 78.435 1.00 0.00 H TER 11709 WAT 5507 ATOM 11709 O WAT 5508 9.542 96.176 126.849 1.00 0.00 O ATOM 11710 H1 WAT 5508 9.607 96.910 127.461 1.00 0.00 H ATOM 11711 H2 WAT 5508 9.330 95.423 127.400 1.00 0.00 H TER 11713 WAT 5508 ATOM 11713 O WAT 5509 22.356 18.548 128.122 1.00 0.00 O ATOM 11714 H1 WAT 5509 22.547 18.850 127.234 1.00 0.00 H ATOM 11715 H2 WAT 5509 23.150 18.746 128.619 1.00 0.00 H TER 11717 WAT 5509 ATOM 11717 O WAT 5510 105.959 77.045 122.314 1.00 0.00 O ATOM 11718 H1 WAT 5510 106.553 76.329 122.540 1.00 0.00 H ATOM 11719 H2 WAT 5510 105.295 77.032 123.003 1.00 0.00 H TER 11721 WAT 5510 ATOM 11721 O WAT 5511 96.550 41.188 56.315 1.00 0.00 O ATOM 11722 H1 WAT 5511 95.840 41.060 56.943 1.00 0.00 H ATOM 11723 H2 WAT 5511 96.697 42.134 56.309 1.00 0.00 H TER 11725 WAT 5511 ATOM 11725 O WAT 5512 21.253 57.523 103.455 1.00 0.00 O ATOM 11726 H1 WAT 5512 21.950 58.047 103.060 1.00 0.00 H ATOM 11727 H2 WAT 5512 21.566 56.621 103.390 1.00 0.00 H TER 11729 WAT 5512 ATOM 11729 O WAT 5513 60.127 93.635 134.006 1.00 0.00 O ATOM 11730 H1 WAT 5513 60.572 94.466 133.839 1.00 0.00 H ATOM 11731 H2 WAT 5513 59.217 93.796 133.759 1.00 0.00 H TER 11733 WAT 5513 ATOM 11733 O WAT 5514 121.496 105.343 146.531 1.00 0.00 O ATOM 11734 H1 WAT 5514 121.031 105.551 145.721 1.00 0.00 H ATOM 11735 H2 WAT 5514 122.089 106.082 146.664 1.00 0.00 H TER 11737 WAT 5514 ATOM 11737 O WAT 5515 21.003 139.264 50.655 1.00 0.00 O ATOM 11738 H1 WAT 5515 20.514 139.924 51.147 1.00 0.00 H ATOM 11739 H2 WAT 5515 21.651 139.766 50.161 1.00 0.00 H TER 11741 WAT 5515 ATOM 11741 O WAT 5516 28.234 30.848 151.680 1.00 0.00 O ATOM 11742 H1 WAT 5516 27.434 30.487 151.297 1.00 0.00 H ATOM 11743 H2 WAT 5516 28.305 30.422 152.534 1.00 0.00 H TER 11745 WAT 5516 ATOM 11745 O WAT 5517 114.672 137.910 94.074 1.00 0.00 O ATOM 11746 H1 WAT 5517 114.311 137.975 93.191 1.00 0.00 H ATOM 11747 H2 WAT 5517 115.621 137.943 93.948 1.00 0.00 H TER 11749 WAT 5517 ATOM 11749 O WAT 5518 4.089 84.771 111.113 1.00 0.00 O ATOM 11750 H1 WAT 5518 4.445 84.144 111.742 1.00 0.00 H ATOM 11751 H2 WAT 5518 4.336 84.418 110.258 1.00 0.00 H TER 11753 WAT 5518 ATOM 11753 O WAT 5519 4.906 13.056 22.106 1.00 0.00 O ATOM 11754 H1 WAT 5519 4.536 12.740 22.931 1.00 0.00 H ATOM 11755 H2 WAT 5519 4.144 13.299 21.580 1.00 0.00 H TER 11757 WAT 5519 ATOM 11757 O WAT 5520 96.497 140.245 74.068 1.00 0.00 O ATOM 11758 H1 WAT 5520 96.083 141.020 73.688 1.00 0.00 H ATOM 11759 H2 WAT 5520 97.261 140.585 74.533 1.00 0.00 H TER 11761 WAT 5520 ATOM 11761 O WAT 5521 108.579 58.074 93.346 1.00 0.00 O ATOM 11762 H1 WAT 5521 108.932 57.196 93.203 1.00 0.00 H ATOM 11763 H2 WAT 5521 108.674 58.511 92.500 1.00 0.00 H TER 11765 WAT 5521 ATOM 11765 O WAT 5522 106.919 96.548 136.339 1.00 0.00 O ATOM 11766 H1 WAT 5522 107.134 95.623 136.457 1.00 0.00 H ATOM 11767 H2 WAT 5522 107.642 97.017 136.755 1.00 0.00 H TER 11769 WAT 5522 ATOM 11769 O WAT 5523 6.055 94.544 145.264 1.00 0.00 O ATOM 11770 H1 WAT 5523 5.915 93.618 145.064 1.00 0.00 H ATOM 11771 H2 WAT 5523 5.351 94.765 145.874 1.00 0.00 H TER 11773 WAT 5523 ATOM 11773 O WAT 5524 35.696 15.527 24.580 1.00 0.00 O ATOM 11774 H1 WAT 5524 35.337 15.076 25.345 1.00 0.00 H ATOM 11775 H2 WAT 5524 35.344 16.415 24.639 1.00 0.00 H TER 11777 WAT 5524 ATOM 11777 O WAT 5525 116.684 96.835 101.688 1.00 0.00 O ATOM 11778 H1 WAT 5525 116.402 96.768 100.776 1.00 0.00 H ATOM 11779 H2 WAT 5525 117.491 96.322 101.727 1.00 0.00 H TER 11781 WAT 5525 ATOM 11781 O WAT 5526 42.951 55.482 83.212 1.00 0.00 O ATOM 11782 H1 WAT 5526 42.740 55.893 84.050 1.00 0.00 H ATOM 11783 H2 WAT 5526 43.879 55.260 83.281 1.00 0.00 H TER 11785 WAT 5526 ATOM 11785 O WAT 5527 13.502 28.720 11.133 1.00 0.00 O ATOM 11786 H1 WAT 5527 13.983 28.718 11.961 1.00 0.00 H ATOM 11787 H2 WAT 5527 13.435 27.795 10.893 1.00 0.00 H TER 11789 WAT 5527 ATOM 11789 O WAT 5528 19.416 12.704 137.066 1.00 0.00 O ATOM 11790 H1 WAT 5528 19.655 13.483 136.563 1.00 0.00 H ATOM 11791 H2 WAT 5528 19.270 12.027 136.406 1.00 0.00 H TER 11793 WAT 5528 ATOM 11793 O WAT 5529 142.139 94.500 84.673 1.00 0.00 O ATOM 11794 H1 WAT 5529 141.896 93.735 85.195 1.00 0.00 H ATOM 11795 H2 WAT 5529 143.087 94.424 84.563 1.00 0.00 H TER 11797 WAT 5529 ATOM 11797 O WAT 5530 26.160 6.427 108.646 1.00 0.00 O ATOM 11798 H1 WAT 5530 25.333 6.897 108.540 1.00 0.00 H ATOM 11799 H2 WAT 5530 26.475 6.688 109.512 1.00 0.00 H TER 11801 WAT 5530 ATOM 11801 O WAT 5531 41.511 55.018 126.590 1.00 0.00 O ATOM 11802 H1 WAT 5531 41.177 55.771 126.103 1.00 0.00 H ATOM 11803 H2 WAT 5531 42.416 54.923 126.293 1.00 0.00 H TER 11805 WAT 5531 ATOM 11805 O WAT 5532 66.936 55.880 62.131 1.00 0.00 O ATOM 11806 H1 WAT 5532 66.168 56.438 62.253 1.00 0.00 H ATOM 11807 H2 WAT 5532 66.763 55.113 62.676 1.00 0.00 H TER 11809 WAT 5532 ATOM 11809 O WAT 5533 64.215 127.220 112.210 1.00 0.00 O ATOM 11810 H1 WAT 5533 63.718 126.697 111.580 1.00 0.00 H ATOM 11811 H2 WAT 5533 63.554 127.562 112.811 1.00 0.00 H TER 11813 WAT 5533 ATOM 11813 O WAT 5534 47.093 99.034 130.364 1.00 0.00 O ATOM 11814 H1 WAT 5534 46.393 99.364 129.801 1.00 0.00 H ATOM 11815 H2 WAT 5534 47.539 99.821 130.677 1.00 0.00 H TER 11817 WAT 5534 ATOM 11817 O WAT 5535 71.802 20.370 156.942 1.00 0.00 O ATOM 11818 H1 WAT 5535 70.889 20.153 156.751 1.00 0.00 H ATOM 11819 H2 WAT 5535 72.240 19.521 157.012 1.00 0.00 H TER 11821 WAT 5535 ATOM 11821 O WAT 5536 29.326 96.671 99.153 1.00 0.00 O ATOM 11822 H1 WAT 5536 29.456 95.802 98.773 1.00 0.00 H ATOM 11823 H2 WAT 5536 30.155 96.867 99.590 1.00 0.00 H TER 11825 WAT 5536 ATOM 11825 O WAT 5537 1.708 4.047 78.108 1.00 0.00 O ATOM 11826 H1 WAT 5537 0.972 3.463 78.289 1.00 0.00 H ATOM 11827 H2 WAT 5537 1.326 4.925 78.123 1.00 0.00 H TER 11829 WAT 5537 ATOM 11829 O WAT 5538 28.651 129.305 145.996 1.00 0.00 O ATOM 11830 H1 WAT 5538 28.858 129.150 145.074 1.00 0.00 H ATOM 11831 H2 WAT 5538 28.650 130.259 146.084 1.00 0.00 H TER 11833 WAT 5538 ATOM 11833 O WAT 5539 100.531 65.439 79.887 1.00 0.00 O ATOM 11834 H1 WAT 5539 99.855 66.113 79.950 1.00 0.00 H ATOM 11835 H2 WAT 5539 101.346 65.896 80.095 1.00 0.00 H TER 11837 WAT 5539 ATOM 11837 O WAT 5540 129.052 38.714 63.061 1.00 0.00 O ATOM 11838 H1 WAT 5540 128.754 38.288 63.865 1.00 0.00 H ATOM 11839 H2 WAT 5540 128.330 38.595 62.445 1.00 0.00 H TER 11841 WAT 5540 ATOM 11841 O WAT 5541 60.450 1.081 58.411 1.00 0.00 O ATOM 11842 H1 WAT 5541 60.276 0.224 58.802 1.00 0.00 H ATOM 11843 H2 WAT 5541 59.976 1.699 58.968 1.00 0.00 H TER 11845 WAT 5541 ATOM 11845 O WAT 5542 101.234 31.003 22.399 1.00 0.00 O ATOM 11846 H1 WAT 5542 101.540 31.854 22.086 1.00 0.00 H ATOM 11847 H2 WAT 5542 100.306 30.982 22.168 1.00 0.00 H TER 11849 WAT 5542 ATOM 11849 O WAT 5543 123.704 60.132 72.500 1.00 0.00 O ATOM 11850 H1 WAT 5543 124.108 60.886 72.072 1.00 0.00 H ATOM 11851 H2 WAT 5543 123.965 60.209 73.418 1.00 0.00 H TER 11853 WAT 5543 ATOM 11853 O WAT 5544 55.285 139.756 112.039 1.00 0.00 O ATOM 11854 H1 WAT 5544 55.960 139.995 112.673 1.00 0.00 H ATOM 11855 H2 WAT 5544 54.726 140.531 111.980 1.00 0.00 H TER 11857 WAT 5544 ATOM 11857 O WAT 5545 95.335 64.853 73.800 1.00 0.00 O ATOM 11858 H1 WAT 5545 94.995 65.413 74.497 1.00 0.00 H ATOM 11859 H2 WAT 5545 94.952 65.208 72.998 1.00 0.00 H TER 11861 WAT 5545 ATOM 11861 O WAT 5546 60.356 67.049 99.264 1.00 0.00 O ATOM 11862 H1 WAT 5546 60.084 66.565 100.044 1.00 0.00 H ATOM 11863 H2 WAT 5546 61.274 67.268 99.425 1.00 0.00 H TER 11865 WAT 5546 ATOM 11865 O WAT 5547 103.109 34.761 127.517 1.00 0.00 O ATOM 11866 H1 WAT 5547 103.421 34.838 128.419 1.00 0.00 H ATOM 11867 H2 WAT 5547 103.372 35.583 127.102 1.00 0.00 H TER 11869 WAT 5547 ATOM 11869 O WAT 5548 86.039 52.271 154.836 1.00 0.00 O ATOM 11870 H1 WAT 5548 86.621 52.287 155.595 1.00 0.00 H ATOM 11871 H2 WAT 5548 85.632 53.137 154.827 1.00 0.00 H TER 11873 WAT 5548 ATOM 11873 O WAT 5549 60.564 6.035 10.880 1.00 0.00 O ATOM 11874 H1 WAT 5549 61.168 5.321 10.677 1.00 0.00 H ATOM 11875 H2 WAT 5549 59.752 5.598 11.137 1.00 0.00 H TER 11877 WAT 5549 ATOM 11877 O WAT 5550 140.411 17.649 135.287 1.00 0.00 O ATOM 11878 H1 WAT 5550 140.339 18.592 135.140 1.00 0.00 H ATOM 11879 H2 WAT 5550 141.353 17.486 135.338 1.00 0.00 H TER 11881 WAT 5550 ATOM 11881 O WAT 5551 61.247 77.709 96.762 1.00 0.00 O ATOM 11882 H1 WAT 5551 61.185 78.064 95.875 1.00 0.00 H ATOM 11883 H2 WAT 5551 60.415 77.254 96.896 1.00 0.00 H TER 11885 WAT 5551 ATOM 11885 O WAT 5552 122.520 13.123 91.401 1.00 0.00 O ATOM 11886 H1 WAT 5552 123.176 13.078 92.097 1.00 0.00 H ATOM 11887 H2 WAT 5552 121.817 13.657 91.770 1.00 0.00 H TER 11889 WAT 5552 ATOM 11889 O WAT 5553 30.659 97.614 19.570 1.00 0.00 O ATOM 11890 H1 WAT 5553 30.212 97.897 20.368 1.00 0.00 H ATOM 11891 H2 WAT 5553 31.590 97.717 19.769 1.00 0.00 H TER 11893 WAT 5553 ATOM 11893 O WAT 5554 6.165 12.552 19.770 1.00 0.00 O ATOM 11894 H1 WAT 5554 5.821 12.610 20.662 1.00 0.00 H ATOM 11895 H2 WAT 5554 6.922 11.971 19.843 1.00 0.00 H TER 11897 WAT 5554 ATOM 11897 O WAT 5555 38.984 22.263 137.500 1.00 0.00 O ATOM 11898 H1 WAT 5555 38.836 22.627 136.627 1.00 0.00 H ATOM 11899 H2 WAT 5555 38.335 21.565 137.582 1.00 0.00 H TER 11901 WAT 5555 ATOM 11901 O WAT 5556 118.382 89.980 97.002 1.00 0.00 O ATOM 11902 H1 WAT 5556 118.670 89.716 96.128 1.00 0.00 H ATOM 11903 H2 WAT 5556 118.996 90.667 97.259 1.00 0.00 H TER 11905 WAT 5556 ATOM 11905 O WAT 5557 8.183 1.345 109.349 1.00 0.00 O ATOM 11906 H1 WAT 5557 8.399 0.461 109.645 1.00 0.00 H ATOM 11907 H2 WAT 5557 7.394 1.235 108.819 1.00 0.00 H TER 11909 WAT 5557 ATOM 11909 O WAT 5558 72.611 135.260 20.545 1.00 0.00 O ATOM 11910 H1 WAT 5558 72.525 135.329 21.495 1.00 0.00 H ATOM 11911 H2 WAT 5558 72.595 136.166 20.236 1.00 0.00 H TER 11913 WAT 5558 ATOM 11913 O WAT 5559 0.175 135.813 121.450 1.00 0.00 O ATOM 11914 H1 WAT 5559 -0.398 136.499 121.791 1.00 0.00 H ATOM 11915 H2 WAT 5559 1.057 136.178 121.526 1.00 0.00 H TER 11917 WAT 5559 ATOM 11917 O WAT 5560 136.573 70.978 12.154 1.00 0.00 O ATOM 11918 H1 WAT 5560 135.725 70.536 12.121 1.00 0.00 H ATOM 11919 H2 WAT 5560 136.751 71.085 13.089 1.00 0.00 H TER 11921 WAT 5560 ATOM 11921 O WAT 5561 29.338 47.321 100.241 1.00 0.00 O ATOM 11922 H1 WAT 5561 29.718 46.443 100.232 1.00 0.00 H ATOM 11923 H2 WAT 5561 30.066 47.899 100.011 1.00 0.00 H TER 11925 WAT 5561 ATOM 11925 O WAT 5562 45.045 89.066 105.925 1.00 0.00 O ATOM 11926 H1 WAT 5562 44.924 88.306 106.495 1.00 0.00 H ATOM 11927 H2 WAT 5562 44.360 88.981 105.263 1.00 0.00 H TER 11929 WAT 5562 ATOM 11929 O WAT 5563 50.325 16.887 122.545 1.00 0.00 O ATOM 11930 H1 WAT 5563 49.904 16.561 123.340 1.00 0.00 H ATOM 11931 H2 WAT 5563 49.664 16.779 121.862 1.00 0.00 H TER 11933 WAT 5563 ATOM 11933 O WAT 5564 50.546 13.345 96.789 1.00 0.00 O ATOM 11934 H1 WAT 5564 50.362 12.431 97.002 1.00 0.00 H ATOM 11935 H2 WAT 5564 50.587 13.786 97.638 1.00 0.00 H TER 11937 WAT 5564 ATOM 11937 O WAT 5565 41.197 2.090 68.774 1.00 0.00 O ATOM 11938 H1 WAT 5565 41.546 2.957 68.980 1.00 0.00 H ATOM 11939 H2 WAT 5565 41.805 1.736 68.125 1.00 0.00 H TER 11941 WAT 5565 ATOM 11941 O WAT 5566 89.987 54.341 76.946 1.00 0.00 O ATOM 11942 H1 WAT 5566 89.560 54.248 77.797 1.00 0.00 H ATOM 11943 H2 WAT 5566 89.367 53.960 76.324 1.00 0.00 H TER 11945 WAT 5566 ATOM 11945 O WAT 5567 130.204 27.453 147.527 1.00 0.00 O ATOM 11946 H1 WAT 5567 130.272 28.337 147.889 1.00 0.00 H ATOM 11947 H2 WAT 5567 130.848 27.435 146.818 1.00 0.00 H TER 11949 WAT 5567 ATOM 11949 O WAT 5568 93.246 59.666 150.644 1.00 0.00 O ATOM 11950 H1 WAT 5568 93.824 60.312 151.051 1.00 0.00 H ATOM 11951 H2 WAT 5568 92.711 60.173 150.034 1.00 0.00 H TER 11953 WAT 5568 ATOM 11953 O WAT 5569 6.378 92.666 15.976 1.00 0.00 O ATOM 11954 H1 WAT 5569 5.513 92.589 15.574 1.00 0.00 H ATOM 11955 H2 WAT 5569 6.929 93.038 15.287 1.00 0.00 H TER 11957 WAT 5569 ATOM 11957 O WAT 5570 3.933 65.109 138.753 1.00 0.00 O ATOM 11958 H1 WAT 5570 3.470 64.832 139.544 1.00 0.00 H ATOM 11959 H2 WAT 5570 4.860 65.027 138.977 1.00 0.00 H TER 11961 WAT 5570 ATOM 11961 O WAT 5571 43.429 52.174 149.221 1.00 0.00 O ATOM 11962 H1 WAT 5571 44.176 51.608 149.416 1.00 0.00 H ATOM 11963 H2 WAT 5571 43.303 52.087 148.276 1.00 0.00 H TER 11965 WAT 5571 ATOM 11965 O WAT 5572 123.230 128.112 69.007 1.00 0.00 O ATOM 11966 H1 WAT 5572 123.704 128.532 69.725 1.00 0.00 H ATOM 11967 H2 WAT 5572 122.317 128.362 69.145 1.00 0.00 H TER 11969 WAT 5572 ATOM 11969 O WAT 5573 87.810 124.418 110.503 1.00 0.00 O ATOM 11970 H1 WAT 5573 88.661 123.984 110.570 1.00 0.00 H ATOM 11971 H2 WAT 5573 87.545 124.567 111.411 1.00 0.00 H TER 11973 WAT 5573 ATOM 11973 O WAT 5574 20.742 120.419 86.039 1.00 0.00 O ATOM 11974 H1 WAT 5574 21.008 119.599 86.455 1.00 0.00 H ATOM 11975 H2 WAT 5574 21.117 121.102 86.596 1.00 0.00 H TER 11977 WAT 5574 ATOM 11977 O WAT 5575 89.375 1.809 104.110 1.00 0.00 O ATOM 11978 H1 WAT 5575 89.148 2.402 104.825 1.00 0.00 H ATOM 11979 H2 WAT 5575 90.102 1.288 104.452 1.00 0.00 H TER 11981 WAT 5575 ATOM 11981 O WAT 5576 29.038 99.517 75.250 1.00 0.00 O ATOM 11982 H1 WAT 5576 28.297 99.977 75.645 1.00 0.00 H ATOM 11983 H2 WAT 5576 29.798 100.059 75.462 1.00 0.00 H TER 11985 WAT 5576 ATOM 11985 O WAT 5577 106.033 89.445 104.673 1.00 0.00 O ATOM 11986 H1 WAT 5577 105.265 89.158 105.168 1.00 0.00 H ATOM 11987 H2 WAT 5577 106.222 90.320 105.012 1.00 0.00 H TER 11989 WAT 5577 ATOM 11989 O WAT 5578 74.558 1.574 92.911 1.00 0.00 O ATOM 11990 H1 WAT 5578 74.156 0.916 93.479 1.00 0.00 H ATOM 11991 H2 WAT 5578 73.832 1.914 92.388 1.00 0.00 H TER 11993 WAT 5578 ATOM 11993 O WAT 5579 139.994 9.505 18.562 1.00 0.00 O ATOM 11994 H1 WAT 5579 140.839 9.777 18.205 1.00 0.00 H ATOM 11995 H2 WAT 5579 139.689 10.263 19.060 1.00 0.00 H TER 11997 WAT 5579 ATOM 11997 O WAT 5580 76.239 108.114 57.259 1.00 0.00 O ATOM 11998 H1 WAT 5580 75.526 108.671 57.571 1.00 0.00 H ATOM 11999 H2 WAT 5580 76.865 108.723 56.867 1.00 0.00 H TER 12001 WAT 5580 ATOM 12001 O WAT 5581 24.290 8.055 16.053 1.00 0.00 O ATOM 12002 H1 WAT 5581 24.531 7.386 16.693 1.00 0.00 H ATOM 12003 H2 WAT 5581 23.965 8.785 16.580 1.00 0.00 H TER 12005 WAT 5581 ATOM 12005 O WAT 5582 63.215 89.925 92.197 1.00 0.00 O ATOM 12006 H1 WAT 5582 62.787 89.835 91.345 1.00 0.00 H ATOM 12007 H2 WAT 5582 62.680 89.398 92.790 1.00 0.00 H TER 12009 WAT 5582 ATOM 12009 O WAT 5583 20.366 41.050 6.167 1.00 0.00 O ATOM 12010 H1 WAT 5583 20.897 41.478 6.840 1.00 0.00 H ATOM 12011 H2 WAT 5583 20.421 40.118 6.377 1.00 0.00 H TER 12013 WAT 5583 ATOM 12013 O WAT 5584 113.514 40.609 17.834 1.00 0.00 O ATOM 12014 H1 WAT 5584 114.288 41.099 18.112 1.00 0.00 H ATOM 12015 H2 WAT 5584 113.071 41.193 17.217 1.00 0.00 H TER 12017 WAT 5584 ATOM 12017 O WAT 5585 84.343 25.123 91.021 1.00 0.00 O ATOM 12018 H1 WAT 5585 83.603 24.927 90.447 1.00 0.00 H ATOM 12019 H2 WAT 5585 84.793 24.285 91.128 1.00 0.00 H TER 12021 WAT 5585 ATOM 12021 O WAT 5586 70.945 97.607 158.741 1.00 0.00 O ATOM 12022 H1 WAT 5586 71.149 97.641 157.806 1.00 0.00 H ATOM 12023 H2 WAT 5586 70.607 96.723 158.881 1.00 0.00 H TER 12025 WAT 5586 ATOM 12025 O WAT 5587 87.215 54.509 59.893 1.00 0.00 O ATOM 12026 H1 WAT 5587 87.362 53.604 60.170 1.00 0.00 H ATOM 12027 H2 WAT 5587 86.263 54.590 59.836 1.00 0.00 H TER 12029 WAT 5587 ATOM 12029 O WAT 5588 140.600 120.304 73.901 1.00 0.00 O ATOM 12030 H1 WAT 5588 140.681 120.268 72.948 1.00 0.00 H ATOM 12031 H2 WAT 5588 140.105 119.518 74.129 1.00 0.00 H TER 12033 WAT 5588 ATOM 12033 O WAT 5589 74.965 81.800 145.026 1.00 0.00 O ATOM 12034 H1 WAT 5589 74.516 81.986 144.201 1.00 0.00 H ATOM 12035 H2 WAT 5589 75.648 81.173 144.791 1.00 0.00 H TER 12037 WAT 5589 ATOM 12037 O WAT 5590 109.257 71.546 155.404 1.00 0.00 O ATOM 12038 H1 WAT 5590 109.383 71.953 154.546 1.00 0.00 H ATOM 12039 H2 WAT 5590 109.336 70.607 155.238 1.00 0.00 H TER 12041 WAT 5590 ATOM 12041 O WAT 5591 5.816 130.162 2.635 1.00 0.00 O ATOM 12042 H1 WAT 5591 6.039 130.593 1.809 1.00 0.00 H ATOM 12043 H2 WAT 5591 6.472 130.481 3.255 1.00 0.00 H TER 12045 WAT 5591 ATOM 12045 O WAT 5592 43.015 60.698 14.237 1.00 0.00 O ATOM 12046 H1 WAT 5592 42.514 59.895 14.098 1.00 0.00 H ATOM 12047 H2 WAT 5592 43.708 60.445 14.848 1.00 0.00 H TER 12049 WAT 5592 ATOM 12049 O WAT 5593 17.610 91.969 132.631 1.00 0.00 O ATOM 12050 H1 WAT 5593 17.991 92.283 133.451 1.00 0.00 H ATOM 12051 H2 WAT 5593 18.112 92.413 131.948 1.00 0.00 H TER 12053 WAT 5593 ATOM 12053 O WAT 5594 105.721 118.041 73.817 1.00 0.00 O ATOM 12054 H1 WAT 5594 106.429 118.287 74.412 1.00 0.00 H ATOM 12055 H2 WAT 5594 105.650 118.779 73.211 1.00 0.00 H TER 12057 WAT 5594 ATOM 12057 O WAT 5595 100.795 15.625 59.541 1.00 0.00 O ATOM 12058 H1 WAT 5595 101.593 15.239 59.901 1.00 0.00 H ATOM 12059 H2 WAT 5595 100.416 16.115 60.271 1.00 0.00 H TER 12061 WAT 5595 ATOM 12061 O WAT 5596 10.314 52.528 103.896 1.00 0.00 O ATOM 12062 H1 WAT 5596 9.596 52.925 103.403 1.00 0.00 H ATOM 12063 H2 WAT 5596 10.210 51.587 103.755 1.00 0.00 H TER 12065 WAT 5596 ATOM 12065 O WAT 5597 15.827 65.172 85.547 1.00 0.00 O ATOM 12066 H1 WAT 5597 16.207 65.718 84.858 1.00 0.00 H ATOM 12067 H2 WAT 5597 15.422 64.442 85.078 1.00 0.00 H TER 12069 WAT 5597 ATOM 12069 O WAT 5598 37.197 27.035 152.417 1.00 0.00 O ATOM 12070 H1 WAT 5598 36.465 26.697 152.932 1.00 0.00 H ATOM 12071 H2 WAT 5598 37.793 26.291 152.330 1.00 0.00 H TER 12073 WAT 5598 ATOM 12073 O WAT 5599 98.643 110.660 17.670 1.00 0.00 O ATOM 12074 H1 WAT 5599 98.479 111.142 18.481 1.00 0.00 H ATOM 12075 H2 WAT 5599 98.064 111.069 17.027 1.00 0.00 H TER 12077 WAT 5599 ATOM 12077 O WAT 5600 20.501 137.672 125.176 1.00 0.00 O ATOM 12078 H1 WAT 5600 20.032 138.352 125.660 1.00 0.00 H ATOM 12079 H2 WAT 5600 20.090 137.668 124.311 1.00 0.00 H TER 12081 WAT 5600 ATOM 12081 O WAT 5601 60.112 37.979 152.373 1.00 0.00 O ATOM 12082 H1 WAT 5601 59.336 37.673 152.843 1.00 0.00 H ATOM 12083 H2 WAT 5601 60.790 37.338 152.587 1.00 0.00 H TER 12085 WAT 5601 ATOM 12085 O WAT 5602 96.479 67.006 143.527 1.00 0.00 O ATOM 12086 H1 WAT 5602 96.392 66.538 144.358 1.00 0.00 H ATOM 12087 H2 WAT 5602 97.169 67.650 143.686 1.00 0.00 H TER 12089 WAT 5602 ATOM 12089 O WAT 5603 94.199 99.106 131.365 1.00 0.00 O ATOM 12090 H1 WAT 5603 94.622 99.849 130.934 1.00 0.00 H ATOM 12091 H2 WAT 5603 93.842 99.471 132.175 1.00 0.00 H TER 12093 WAT 5603 ATOM 12093 O WAT 5604 74.203 53.215 91.808 1.00 0.00 O ATOM 12094 H1 WAT 5604 74.468 54.049 91.421 1.00 0.00 H ATOM 12095 H2 WAT 5604 74.511 53.261 92.713 1.00 0.00 H TER 12097 WAT 5604 ATOM 12097 O WAT 5605 30.114 82.069 78.897 1.00 0.00 O ATOM 12098 H1 WAT 5605 29.990 81.297 79.451 1.00 0.00 H ATOM 12099 H2 WAT 5605 29.692 81.840 78.069 1.00 0.00 H TER 12101 WAT 5605 ATOM 12101 O WAT 5606 3.774 118.936 113.513 1.00 0.00 O ATOM 12102 H1 WAT 5606 2.907 118.778 113.887 1.00 0.00 H ATOM 12103 H2 WAT 5606 3.615 119.041 112.575 1.00 0.00 H TER 12105 WAT 5606 ATOM 12105 O WAT 5607 67.930 29.131 61.753 1.00 0.00 O ATOM 12106 H1 WAT 5607 67.030 28.805 61.727 1.00 0.00 H ATOM 12107 H2 WAT 5607 68.442 28.458 61.304 1.00 0.00 H TER 12109 WAT 5607 ATOM 12109 O WAT 5608 37.245 73.603 0.363 1.00 0.00 O ATOM 12110 H1 WAT 5608 37.896 73.209 -0.218 1.00 0.00 H ATOM 12111 H2 WAT 5608 37.586 74.479 0.545 1.00 0.00 H TER 12113 WAT 5608 ATOM 12113 O WAT 5609 76.391 11.357 137.848 1.00 0.00 O ATOM 12114 H1 WAT 5609 76.613 11.282 136.920 1.00 0.00 H ATOM 12115 H2 WAT 5609 77.059 11.941 138.208 1.00 0.00 H TER 12117 WAT 5609 ATOM 12117 O WAT 5610 89.178 87.890 142.215 1.00 0.00 O ATOM 12118 H1 WAT 5610 88.614 88.590 142.542 1.00 0.00 H ATOM 12119 H2 WAT 5610 89.360 88.132 141.307 1.00 0.00 H TER 12121 WAT 5610 ATOM 12121 O WAT 5611 28.807 81.588 23.269 1.00 0.00 O ATOM 12122 H1 WAT 5611 29.052 82.205 23.958 1.00 0.00 H ATOM 12123 H2 WAT 5611 28.226 80.963 23.703 1.00 0.00 H TER 12125 WAT 5611 ATOM 12125 O WAT 5612 60.277 110.855 87.062 1.00 0.00 O ATOM 12126 H1 WAT 5612 61.161 110.692 86.735 1.00 0.00 H ATOM 12127 H2 WAT 5612 59.702 110.472 86.400 1.00 0.00 H TER 12129 WAT 5612 ATOM 12129 O WAT 5613 123.143 125.766 94.677 1.00 0.00 O ATOM 12130 H1 WAT 5613 122.697 125.854 93.834 1.00 0.00 H ATOM 12131 H2 WAT 5613 123.794 125.079 94.532 1.00 0.00 H TER 12133 WAT 5613 ATOM 12133 O WAT 5614 87.365 89.949 60.756 1.00 0.00 O ATOM 12134 H1 WAT 5614 86.889 89.154 60.512 1.00 0.00 H ATOM 12135 H2 WAT 5614 87.868 90.177 59.974 1.00 0.00 H TER 12137 WAT 5614 ATOM 12137 O WAT 5615 132.101 33.841 62.792 1.00 0.00 O ATOM 12138 H1 WAT 5615 132.396 34.750 62.736 1.00 0.00 H ATOM 12139 H2 WAT 5615 131.375 33.787 62.170 1.00 0.00 H TER 12141 WAT 5615 ATOM 12141 O WAT 5616 43.911 101.748 153.890 1.00 0.00 O ATOM 12142 H1 WAT 5616 44.816 101.669 153.589 1.00 0.00 H ATOM 12143 H2 WAT 5616 43.411 101.939 153.096 1.00 0.00 H TER 12145 WAT 5616 ATOM 12145 O WAT 5617 117.487 14.894 116.893 1.00 0.00 O ATOM 12146 H1 WAT 5617 117.057 14.113 116.545 1.00 0.00 H ATOM 12147 H2 WAT 5617 116.996 15.103 117.688 1.00 0.00 H TER 12149 WAT 5617 ATOM 12149 O WAT 5618 74.792 138.295 18.033 1.00 0.00 O ATOM 12150 H1 WAT 5618 75.672 138.144 17.690 1.00 0.00 H ATOM 12151 H2 WAT 5618 74.809 139.199 18.347 1.00 0.00 H TER 12153 WAT 5618 ATOM 12153 O WAT 5619 35.836 91.504 115.609 1.00 0.00 O ATOM 12154 H1 WAT 5619 36.307 92.320 115.438 1.00 0.00 H ATOM 12155 H2 WAT 5619 36.330 90.838 115.132 1.00 0.00 H TER 12157 WAT 5619 ATOM 12157 O WAT 5620 144.631 86.574 84.161 1.00 0.00 O ATOM 12158 H1 WAT 5620 144.692 85.817 84.743 1.00 0.00 H ATOM 12159 H2 WAT 5620 145.256 87.203 84.520 1.00 0.00 H TER 12161 WAT 5620 ATOM 12161 O WAT 5621 56.110 56.322 10.505 1.00 0.00 O ATOM 12162 H1 WAT 5621 55.389 56.264 9.877 1.00 0.00 H ATOM 12163 H2 WAT 5621 55.832 56.995 11.127 1.00 0.00 H TER 12165 WAT 5621 ATOM 12165 O WAT 5622 91.113 0.828 15.179 1.00 0.00 O ATOM 12166 H1 WAT 5622 91.991 0.954 15.540 1.00 0.00 H ATOM 12167 H2 WAT 5622 90.758 1.713 15.098 1.00 0.00 H TER 12169 WAT 5622 ATOM 12169 O WAT 5623 129.441 24.124 89.114 1.00 0.00 O ATOM 12170 H1 WAT 5623 129.664 25.047 89.233 1.00 0.00 H ATOM 12171 H2 WAT 5623 129.535 23.974 88.173 1.00 0.00 H TER 12173 WAT 5623 ATOM 12173 O WAT 5624 77.395 40.598 116.003 1.00 0.00 O ATOM 12174 H1 WAT 5624 77.999 41.297 116.254 1.00 0.00 H ATOM 12175 H2 WAT 5624 76.794 40.523 116.744 1.00 0.00 H TER 12177 WAT 5624 ATOM 12177 O WAT 5625 21.121 26.488 154.391 1.00 0.00 O ATOM 12178 H1 WAT 5625 21.934 26.287 154.855 1.00 0.00 H ATOM 12179 H2 WAT 5625 21.390 26.613 153.481 1.00 0.00 H TER 12181 WAT 5625 ATOM 12181 O WAT 5626 104.532 41.608 89.505 1.00 0.00 O ATOM 12182 H1 WAT 5626 103.711 42.022 89.770 1.00 0.00 H ATOM 12183 H2 WAT 5626 105.117 42.340 89.308 1.00 0.00 H TER 12185 WAT 5626 ATOM 12185 O WAT 5627 135.029 67.931 118.495 1.00 0.00 O ATOM 12186 H1 WAT 5627 134.586 67.087 118.411 1.00 0.00 H ATOM 12187 H2 WAT 5627 134.968 68.142 119.427 1.00 0.00 H TER 12189 WAT 5627 ATOM 12189 O WAT 5628 104.410 134.763 72.159 1.00 0.00 O ATOM 12190 H1 WAT 5628 105.133 134.572 72.756 1.00 0.00 H ATOM 12191 H2 WAT 5628 103.844 135.359 72.650 1.00 0.00 H TER 12193 WAT 5628 ATOM 12193 O WAT 5629 61.734 38.009 62.838 1.00 0.00 O ATOM 12194 H1 WAT 5629 62.593 37.626 63.014 1.00 0.00 H ATOM 12195 H2 WAT 5629 61.530 37.738 61.943 1.00 0.00 H TER 12197 WAT 5629 ATOM 12197 O WAT 5630 44.231 57.289 17.899 1.00 0.00 O ATOM 12198 H1 WAT 5630 44.358 57.879 18.642 1.00 0.00 H ATOM 12199 H2 WAT 5630 43.516 56.714 18.170 1.00 0.00 H TER 12201 WAT 5630 ATOM 12201 O WAT 5631 119.238 56.982 121.592 1.00 0.00 O ATOM 12202 H1 WAT 5631 118.703 56.209 121.773 1.00 0.00 H ATOM 12203 H2 WAT 5631 119.403 57.367 122.452 1.00 0.00 H TER 12205 WAT 5631 ATOM 12205 O WAT 5632 51.513 6.564 124.019 1.00 0.00 O ATOM 12206 H1 WAT 5632 51.149 6.005 124.705 1.00 0.00 H ATOM 12207 H2 WAT 5632 51.741 7.377 124.468 1.00 0.00 H TER 12209 WAT 5632 ATOM 12209 O WAT 5633 98.240 107.906 81.207 1.00 0.00 O ATOM 12210 H1 WAT 5633 97.363 108.254 81.370 1.00 0.00 H ATOM 12211 H2 WAT 5633 98.109 106.962 81.112 1.00 0.00 H TER 12213 WAT 5633 ATOM 12213 O WAT 5634 103.091 116.154 144.766 1.00 0.00 O ATOM 12214 H1 WAT 5634 102.599 115.602 144.158 1.00 0.00 H ATOM 12215 H2 WAT 5634 104.007 116.023 144.522 1.00 0.00 H TER 12217 WAT 5634 ATOM 12217 O WAT 5635 32.400 81.642 20.395 1.00 0.00 O ATOM 12218 H1 WAT 5635 32.459 82.576 20.193 1.00 0.00 H ATOM 12219 H2 WAT 5635 32.093 81.612 21.301 1.00 0.00 H TER 12221 WAT 5635 ATOM 12221 O WAT 5636 6.348 92.120 81.687 1.00 0.00 O ATOM 12222 H1 WAT 5636 6.582 92.413 80.806 1.00 0.00 H ATOM 12223 H2 WAT 5636 7.158 91.753 82.041 1.00 0.00 H TER 12225 WAT 5636 ATOM 12225 O WAT 5637 98.782 85.768 24.843 1.00 0.00 O ATOM 12226 H1 WAT 5637 98.199 86.378 25.296 1.00 0.00 H ATOM 12227 H2 WAT 5637 99.177 85.249 25.543 1.00 0.00 H TER 12229 WAT 5637 ATOM 12229 O WAT 5638 48.996 46.078 91.161 1.00 0.00 O ATOM 12230 H1 WAT 5638 48.958 45.174 90.848 1.00 0.00 H ATOM 12231 H2 WAT 5638 48.493 46.576 90.517 1.00 0.00 H TER 12233 WAT 5638 ATOM 12233 O WAT 5639 67.825 27.016 17.781 1.00 0.00 O ATOM 12234 H1 WAT 5639 67.004 27.021 18.272 1.00 0.00 H ATOM 12235 H2 WAT 5639 67.786 26.215 17.257 1.00 0.00 H TER 12237 WAT 5639 ATOM 12237 O WAT 5640 22.281 17.470 14.244 1.00 0.00 O ATOM 12238 H1 WAT 5640 21.744 17.949 13.612 1.00 0.00 H ATOM 12239 H2 WAT 5640 22.659 16.749 13.740 1.00 0.00 H TER 12241 WAT 5640 ATOM 12241 O WAT 5641 94.600 122.627 66.184 1.00 0.00 O ATOM 12242 H1 WAT 5641 95.260 122.514 65.500 1.00 0.00 H ATOM 12243 H2 WAT 5641 94.825 123.460 66.599 1.00 0.00 H TER 12245 WAT 5641 ATOM 12245 O WAT 5642 5.192 127.757 16.293 1.00 0.00 O ATOM 12246 H1 WAT 5642 5.338 127.165 15.555 1.00 0.00 H ATOM 12247 H2 WAT 5642 5.251 128.633 15.912 1.00 0.00 H TER 12249 WAT 5642 ATOM 12249 O WAT 5643 2.050 145.207 1.463 1.00 0.00 O ATOM 12250 H1 WAT 5643 1.787 146.121 1.577 1.00 0.00 H ATOM 12251 H2 WAT 5643 3.002 145.241 1.374 1.00 0.00 H TER 12253 WAT 5643 ATOM 12253 O WAT 5644 74.702 88.734 142.795 1.00 0.00 O ATOM 12254 H1 WAT 5644 75.106 89.595 142.691 1.00 0.00 H ATOM 12255 H2 WAT 5644 75.434 88.146 142.982 1.00 0.00 H TER 12257 WAT 5644 ATOM 12257 O WAT 5645 89.024 35.263 102.048 1.00 0.00 O ATOM 12258 H1 WAT 5645 88.854 35.401 101.116 1.00 0.00 H ATOM 12259 H2 WAT 5645 88.672 34.392 102.229 1.00 0.00 H TER 12261 WAT 5645 ATOM 12261 O WAT 5646 55.306 23.955 68.679 1.00 0.00 O ATOM 12262 H1 WAT 5646 55.848 23.505 68.032 1.00 0.00 H ATOM 12263 H2 WAT 5646 54.414 23.874 68.343 1.00 0.00 H TER 12265 WAT 5646 ATOM 12265 O WAT 5647 77.913 41.781 130.279 1.00 0.00 O ATOM 12266 H1 WAT 5647 78.000 41.509 131.192 1.00 0.00 H ATOM 12267 H2 WAT 5647 78.621 41.324 129.825 1.00 0.00 H TER 12269 WAT 5647 ATOM 12269 O WAT 5648 95.299 78.886 142.569 1.00 0.00 O ATOM 12270 H1 WAT 5648 94.483 78.585 142.969 1.00 0.00 H ATOM 12271 H2 WAT 5648 95.020 79.456 141.853 1.00 0.00 H TER 12273 WAT 5648 ATOM 12273 O WAT 5649 38.397 70.600 109.712 1.00 0.00 O ATOM 12274 H1 WAT 5649 38.166 69.794 110.174 1.00 0.00 H ATOM 12275 H2 WAT 5649 39.283 70.444 109.387 1.00 0.00 H TER 12277 WAT 5649 ATOM 12277 O WAT 5650 88.859 87.140 106.140 1.00 0.00 O ATOM 12278 H1 WAT 5650 88.037 87.201 106.628 1.00 0.00 H ATOM 12279 H2 WAT 5650 88.770 86.341 105.621 1.00 0.00 H TER 12281 WAT 5650 ATOM 12281 O WAT 5651 54.376 101.906 14.344 1.00 0.00 O ATOM 12282 H1 WAT 5651 54.503 102.580 13.676 1.00 0.00 H ATOM 12283 H2 WAT 5651 54.229 101.101 13.847 1.00 0.00 H TER 12285 WAT 5651 ATOM 12285 O WAT 5652 61.391 37.889 110.773 1.00 0.00 O ATOM 12286 H1 WAT 5652 61.088 37.935 111.680 1.00 0.00 H ATOM 12287 H2 WAT 5652 60.599 37.709 110.266 1.00 0.00 H TER 12289 WAT 5652 ATOM 12289 O WAT 5653 91.684 43.262 153.315 1.00 0.00 O ATOM 12290 H1 WAT 5653 92.049 43.936 153.889 1.00 0.00 H ATOM 12291 H2 WAT 5653 90.736 43.357 153.406 1.00 0.00 H TER 12293 WAT 5653 ATOM 12293 O WAT 5654 26.055 54.224 84.856 1.00 0.00 O ATOM 12294 H1 WAT 5654 26.487 54.958 84.419 1.00 0.00 H ATOM 12295 H2 WAT 5654 25.286 54.612 85.273 1.00 0.00 H TER 12297 WAT 5654 ATOM 12297 O WAT 5655 90.355 141.292 59.735 1.00 0.00 O ATOM 12298 H1 WAT 5655 89.777 140.625 60.107 1.00 0.00 H ATOM 12299 H2 WAT 5655 89.928 141.550 58.918 1.00 0.00 H TER 12301 WAT 5655 ATOM 12301 O WAT 5656 94.270 56.967 115.676 1.00 0.00 O ATOM 12302 H1 WAT 5656 93.401 57.300 115.455 1.00 0.00 H ATOM 12303 H2 WAT 5656 94.665 57.661 116.204 1.00 0.00 H TER 12305 WAT 5656 ATOM 12305 O WAT 5657 137.152 137.466 134.918 1.00 0.00 O ATOM 12306 H1 WAT 5657 136.451 137.480 135.570 1.00 0.00 H ATOM 12307 H2 WAT 5657 137.343 136.536 134.792 1.00 0.00 H TER 12309 WAT 5657 ATOM 12309 O WAT 5658 51.388 109.806 71.023 1.00 0.00 O ATOM 12310 H1 WAT 5658 51.523 109.366 70.184 1.00 0.00 H ATOM 12311 H2 WAT 5658 51.766 110.677 70.901 1.00 0.00 H TER 12313 WAT 5658 ATOM 12313 O WAT 5659 143.606 41.562 69.657 1.00 0.00 O ATOM 12314 H1 WAT 5659 143.629 40.607 69.714 1.00 0.00 H ATOM 12315 H2 WAT 5659 143.511 41.854 70.563 1.00 0.00 H TER 12317 WAT 5659 ATOM 12317 O WAT 5660 130.305 59.087 67.052 1.00 0.00 O ATOM 12318 H1 WAT 5660 130.380 59.352 66.136 1.00 0.00 H ATOM 12319 H2 WAT 5660 130.085 59.895 67.517 1.00 0.00 H TER 12321 WAT 5660 ATOM 12321 O WAT 5661 71.518 75.411 70.472 1.00 0.00 O ATOM 12322 H1 WAT 5661 71.096 74.585 70.709 1.00 0.00 H ATOM 12323 H2 WAT 5661 72.452 75.205 70.445 1.00 0.00 H TER 12325 WAT 5661 ATOM 12325 O WAT 5662 42.972 94.908 91.252 1.00 0.00 O ATOM 12326 H1 WAT 5662 42.123 95.351 91.235 1.00 0.00 H ATOM 12327 H2 WAT 5662 43.610 95.608 91.112 1.00 0.00 H TER 12329 WAT 5662 ATOM 12329 O WAT 5663 44.781 126.334 116.906 1.00 0.00 O ATOM 12330 H1 WAT 5663 43.986 126.798 116.644 1.00 0.00 H ATOM 12331 H2 WAT 5663 44.654 125.442 116.584 1.00 0.00 H TER 12333 WAT 5663 ATOM 12333 O WAT 5664 112.222 110.953 157.963 1.00 0.00 O ATOM 12334 H1 WAT 5664 112.003 111.554 157.251 1.00 0.00 H ATOM 12335 H2 WAT 5664 112.761 110.278 157.549 1.00 0.00 H TER 12337 WAT 5664 ATOM 12337 O WAT 5665 47.624 65.577 26.693 1.00 0.00 O ATOM 12338 H1 WAT 5665 47.216 64.847 27.159 1.00 0.00 H ATOM 12339 H2 WAT 5665 46.993 65.809 26.011 1.00 0.00 H TER 12341 WAT 5665 ATOM 12341 O WAT 5666 130.596 29.392 1.307 1.00 0.00 O ATOM 12342 H1 WAT 5666 131.507 29.544 1.555 1.00 0.00 H ATOM 12343 H2 WAT 5666 130.186 29.043 2.099 1.00 0.00 H TER 12345 WAT 5666 ATOM 12345 O WAT 5667 56.830 105.711 75.486 1.00 0.00 O ATOM 12346 H1 WAT 5667 56.716 105.395 74.590 1.00 0.00 H ATOM 12347 H2 WAT 5667 57.551 106.337 75.430 1.00 0.00 H TER 12349 WAT 5667 ATOM 12349 O WAT 5668 59.030 110.117 54.363 1.00 0.00 O ATOM 12350 H1 WAT 5668 59.668 110.644 54.845 1.00 0.00 H ATOM 12351 H2 WAT 5668 59.196 110.321 53.443 1.00 0.00 H TER 12353 WAT 5668 ATOM 12353 O WAT 5669 88.470 87.778 93.916 1.00 0.00 O ATOM 12354 H1 WAT 5669 89.077 87.885 93.184 1.00 0.00 H ATOM 12355 H2 WAT 5669 87.997 86.969 93.718 1.00 0.00 H TER 12357 WAT 5669 ATOM 12357 O WAT 5670 19.505 97.704 9.686 1.00 0.00 O ATOM 12358 H1 WAT 5670 19.399 98.180 10.510 1.00 0.00 H ATOM 12359 H2 WAT 5670 20.009 96.925 9.923 1.00 0.00 H TER 12361 WAT 5670 ATOM 12361 O WAT 5671 6.942 94.443 83.349 1.00 0.00 O ATOM 12362 H1 WAT 5671 6.631 93.682 82.858 1.00 0.00 H ATOM 12363 H2 WAT 5671 7.510 94.908 82.735 1.00 0.00 H TER 12365 WAT 5671 ATOM 12365 O WAT 5672 131.556 31.981 136.058 1.00 0.00 O ATOM 12366 H1 WAT 5672 132.436 31.988 135.683 1.00 0.00 H ATOM 12367 H2 WAT 5672 131.475 31.118 136.464 1.00 0.00 H TER 12369 WAT 5672 ATOM 12369 O WAT 5673 25.794 127.749 114.220 1.00 0.00 O ATOM 12370 H1 WAT 5673 25.367 126.989 113.827 1.00 0.00 H ATOM 12371 H2 WAT 5673 25.335 127.879 115.050 1.00 0.00 H TER 12373 WAT 5673 ATOM 12373 O WAT 5674 76.558 67.107 72.887 1.00 0.00 O ATOM 12374 H1 WAT 5674 77.106 67.800 72.517 1.00 0.00 H ATOM 12375 H2 WAT 5674 76.328 67.424 73.760 1.00 0.00 H TER 12377 WAT 5674 ATOM 12377 O WAT 5675 119.911 73.458 88.605 1.00 0.00 O ATOM 12378 H1 WAT 5675 120.263 73.218 87.747 1.00 0.00 H ATOM 12379 H2 WAT 5675 120.253 72.790 89.199 1.00 0.00 H TER 12381 WAT 5675 ATOM 12381 O WAT 5676 135.194 91.422 102.072 1.00 0.00 O ATOM 12382 H1 WAT 5676 134.250 91.544 102.171 1.00 0.00 H ATOM 12383 H2 WAT 5676 135.282 90.566 101.652 1.00 0.00 H TER 12385 WAT 5676 ATOM 12385 O WAT 5677 96.387 38.124 70.665 1.00 0.00 O ATOM 12386 H1 WAT 5677 96.599 39.056 70.711 1.00 0.00 H ATOM 12387 H2 WAT 5677 95.507 38.060 71.037 1.00 0.00 H TER 12389 WAT 5677 ATOM 12389 O WAT 5678 84.376 46.461 155.953 1.00 0.00 O ATOM 12390 H1 WAT 5678 83.922 47.011 155.315 1.00 0.00 H ATOM 12391 H2 WAT 5678 83.967 45.600 155.860 1.00 0.00 H TER 12393 WAT 5678 ATOM 12393 O WAT 5679 6.974 96.221 102.989 1.00 0.00 O ATOM 12394 H1 WAT 5679 7.398 95.565 103.542 1.00 0.00 H ATOM 12395 H2 WAT 5679 7.031 97.032 103.494 1.00 0.00 H TER 12397 WAT 5679 ATOM 12397 O WAT 5680 64.036 33.442 59.558 1.00 0.00 O ATOM 12398 H1 WAT 5680 63.779 32.816 58.881 1.00 0.00 H ATOM 12399 H2 WAT 5680 64.454 34.156 59.078 1.00 0.00 H TER 12401 WAT 5680 ATOM 12401 O WAT 5681 80.993 69.492 142.248 1.00 0.00 O ATOM 12402 H1 WAT 5681 81.644 68.822 142.041 1.00 0.00 H ATOM 12403 H2 WAT 5681 81.307 70.277 141.798 1.00 0.00 H TER 12405 WAT 5681 ATOM 12405 O WAT 5682 8.158 84.231 142.041 1.00 0.00 O ATOM 12406 H1 WAT 5682 9.016 83.805 142.037 1.00 0.00 H ATOM 12407 H2 WAT 5682 7.627 83.705 141.443 1.00 0.00 H TER 12409 WAT 5682 ATOM 12409 O WAT 5683 89.693 69.182 5.684 1.00 0.00 O ATOM 12410 H1 WAT 5683 90.218 69.381 6.460 1.00 0.00 H ATOM 12411 H2 WAT 5683 90.110 69.679 4.979 1.00 0.00 H TER 12413 WAT 5683 ATOM 12413 O WAT 5684 4.570 78.721 58.188 1.00 0.00 O ATOM 12414 H1 WAT 5684 4.436 79.551 58.645 1.00 0.00 H ATOM 12415 H2 WAT 5684 5.303 78.889 57.595 1.00 0.00 H TER 12417 WAT 5684 ATOM 12417 O WAT 5685 144.261 57.120 140.231 1.00 0.00 O ATOM 12418 H1 WAT 5685 143.867 57.990 140.299 1.00 0.00 H ATOM 12419 H2 WAT 5685 144.127 56.867 139.318 1.00 0.00 H TER 12421 WAT 5685 ATOM 12421 O WAT 5686 26.409 62.705 85.548 1.00 0.00 O ATOM 12422 H1 WAT 5686 26.879 63.520 85.724 1.00 0.00 H ATOM 12423 H2 WAT 5686 27.001 62.017 85.852 1.00 0.00 H TER 12425 WAT 5686 ATOM 12425 O WAT 5687 53.497 95.497 114.170 1.00 0.00 O ATOM 12426 H1 WAT 5687 53.982 96.268 114.467 1.00 0.00 H ATOM 12427 H2 WAT 5687 52.768 95.853 113.662 1.00 0.00 H TER 12429 WAT 5687 ATOM 12429 O WAT 5688 132.872 113.505 117.097 1.00 0.00 O ATOM 12430 H1 WAT 5688 132.407 114.331 117.227 1.00 0.00 H ATOM 12431 H2 WAT 5688 132.697 113.271 116.186 1.00 0.00 H TER 12433 WAT 5688 ATOM 12433 O WAT 5689 59.875 54.343 123.840 1.00 0.00 O ATOM 12434 H1 WAT 5689 59.716 54.788 123.007 1.00 0.00 H ATOM 12435 H2 WAT 5689 60.105 53.448 123.593 1.00 0.00 H TER 12437 WAT 5689 ATOM 12437 O WAT 5690 101.569 45.208 108.629 1.00 0.00 O ATOM 12438 H1 WAT 5690 102.236 45.639 108.094 1.00 0.00 H ATOM 12439 H2 WAT 5690 100.740 45.431 108.205 1.00 0.00 H TER 12441 WAT 5690 ATOM 12441 O WAT 5691 -0.029 144.036 98.172 1.00 0.00 O ATOM 12442 H1 WAT 5691 0.745 143.585 97.832 1.00 0.00 H ATOM 12443 H2 WAT 5691 0.046 143.955 99.123 1.00 0.00 H TER 12445 WAT 5691 ATOM 12445 O WAT 5692 115.843 25.159 77.483 1.00 0.00 O ATOM 12446 H1 WAT 5692 116.465 25.781 77.860 1.00 0.00 H ATOM 12447 H2 WAT 5692 115.905 24.387 78.047 1.00 0.00 H TER 12449 WAT 5692 ATOM 12449 O WAT 5693 101.691 55.867 86.320 1.00 0.00 O ATOM 12450 H1 WAT 5693 101.839 55.464 85.465 1.00 0.00 H ATOM 12451 H2 WAT 5693 102.570 56.023 86.667 1.00 0.00 H TER 12453 WAT 5693 ATOM 12453 O WAT 5694 36.884 88.366 67.930 1.00 0.00 O ATOM 12454 H1 WAT 5694 36.519 87.508 68.149 1.00 0.00 H ATOM 12455 H2 WAT 5694 36.546 88.951 68.608 1.00 0.00 H TER 12457 WAT 5694 ATOM 12457 O WAT 5695 64.265 48.624 158.422 1.00 0.00 O ATOM 12458 H1 WAT 5695 63.913 49.511 158.488 1.00 0.00 H ATOM 12459 H2 WAT 5695 65.211 48.747 158.337 1.00 0.00 H TER 12461 WAT 5695 ATOM 12461 O WAT 5696 30.821 27.616 71.990 1.00 0.00 O ATOM 12462 H1 WAT 5696 31.537 27.571 71.356 1.00 0.00 H ATOM 12463 H2 WAT 5696 31.103 27.052 72.710 1.00 0.00 H TER 12465 WAT 5696 ATOM 12465 O WAT 5697 132.965 136.786 18.084 1.00 0.00 O ATOM 12466 H1 WAT 5697 132.048 136.618 18.300 1.00 0.00 H ATOM 12467 H2 WAT 5697 133.420 136.750 18.925 1.00 0.00 H TER 12469 WAT 5697 ATOM 12469 O WAT 5698 138.665 70.368 118.585 1.00 0.00 O ATOM 12470 H1 WAT 5698 138.698 69.508 118.166 1.00 0.00 H ATOM 12471 H2 WAT 5698 138.659 70.177 119.523 1.00 0.00 H TER 12473 WAT 5698 ATOM 12473 O WAT 5699 41.914 55.946 58.803 1.00 0.00 O ATOM 12474 H1 WAT 5699 42.153 55.068 59.098 1.00 0.00 H ATOM 12475 H2 WAT 5699 41.929 55.890 57.847 1.00 0.00 H TER 12477 WAT 5699 ATOM 12477 O WAT 5700 126.238 89.098 77.161 1.00 0.00 O ATOM 12478 H1 WAT 5700 126.034 89.896 76.674 1.00 0.00 H ATOM 12479 H2 WAT 5700 127.181 89.148 77.319 1.00 0.00 H TER 12481 WAT 5700 ATOM 12481 O WAT 5701 52.642 123.743 1.685 1.00 0.00 O ATOM 12482 H1 WAT 5701 53.050 122.919 1.420 1.00 0.00 H ATOM 12483 H2 WAT 5701 51.710 123.538 1.755 1.00 0.00 H TER 12485 WAT 5701 ATOM 12485 O WAT 5702 108.547 12.569 147.453 1.00 0.00 O ATOM 12486 H1 WAT 5702 108.670 11.653 147.703 1.00 0.00 H ATOM 12487 H2 WAT 5702 108.711 12.584 146.510 1.00 0.00 H TER 12489 WAT 5702 ATOM 12489 O WAT 5703 1.039 18.852 139.233 1.00 0.00 O ATOM 12490 H1 WAT 5703 1.894 18.432 139.138 1.00 0.00 H ATOM 12491 H2 WAT 5703 1.139 19.700 138.800 1.00 0.00 H TER 12493 WAT 5703 ATOM 12493 O WAT 5704 88.465 68.319 137.525 1.00 0.00 O ATOM 12494 H1 WAT 5704 88.424 68.754 136.673 1.00 0.00 H ATOM 12495 H2 WAT 5704 89.286 68.626 137.910 1.00 0.00 H TER 12497 WAT 5704 ATOM 12497 O WAT 5705 19.632 50.375 140.490 1.00 0.00 O ATOM 12498 H1 WAT 5705 18.914 50.987 140.324 1.00 0.00 H ATOM 12499 H2 WAT 5705 20.310 50.909 140.905 1.00 0.00 H TER 12501 WAT 5705 ATOM 12501 O WAT 5706 49.324 130.743 86.282 1.00 0.00 O ATOM 12502 H1 WAT 5706 49.644 131.100 85.453 1.00 0.00 H ATOM 12503 H2 WAT 5706 48.806 129.979 86.030 1.00 0.00 H TER 12505 WAT 5706 ATOM 12505 O WAT 5707 87.328 16.439 98.632 1.00 0.00 O ATOM 12506 H1 WAT 5707 87.092 15.746 98.015 1.00 0.00 H ATOM 12507 H2 WAT 5707 88.248 16.275 98.836 1.00 0.00 H TER 12509 WAT 5707 ATOM 12509 O WAT 5708 34.932 21.770 96.873 1.00 0.00 O ATOM 12510 H1 WAT 5708 35.834 21.758 96.553 1.00 0.00 H ATOM 12511 H2 WAT 5708 34.808 22.658 97.207 1.00 0.00 H TER 12513 WAT 5708 ATOM 12513 O WAT 5709 132.301 101.034 139.247 1.00 0.00 O ATOM 12514 H1 WAT 5709 132.268 101.498 138.411 1.00 0.00 H ATOM 12515 H2 WAT 5709 131.395 101.034 139.557 1.00 0.00 H TER 12517 WAT 5709 ATOM 12517 O WAT 5710 22.288 44.178 150.310 1.00 0.00 O ATOM 12518 H1 WAT 5710 23.121 44.520 149.986 1.00 0.00 H ATOM 12519 H2 WAT 5710 22.516 43.715 151.116 1.00 0.00 H TER 12521 WAT 5710 ATOM 12521 O WAT 5711 7.496 100.282 157.937 1.00 0.00 O ATOM 12522 H1 WAT 5711 7.487 99.327 157.862 1.00 0.00 H ATOM 12523 H2 WAT 5711 7.171 100.456 158.820 1.00 0.00 H TER 12525 WAT 5711 ATOM 12525 O WAT 5712 22.530 2.676 123.664 1.00 0.00 O ATOM 12526 H1 WAT 5712 23.128 2.896 124.379 1.00 0.00 H ATOM 12527 H2 WAT 5712 22.868 3.161 122.911 1.00 0.00 H TER 12529 WAT 5712 ATOM 12529 O WAT 5713 38.642 137.780 131.345 1.00 0.00 O ATOM 12530 H1 WAT 5713 39.074 138.357 131.975 1.00 0.00 H ATOM 12531 H2 WAT 5713 38.049 138.354 130.862 1.00 0.00 H TER 12533 WAT 5713 ATOM 12533 O WAT 5714 142.072 123.660 95.984 1.00 0.00 O ATOM 12534 H1 WAT 5714 141.743 122.809 96.273 1.00 0.00 H ATOM 12535 H2 WAT 5714 141.440 124.291 96.327 1.00 0.00 H TER 12537 WAT 5714 ATOM 12537 O WAT 5715 93.693 98.515 156.653 1.00 0.00 O ATOM 12538 H1 WAT 5715 93.834 99.396 156.307 1.00 0.00 H ATOM 12539 H2 WAT 5715 93.928 98.580 157.579 1.00 0.00 H TER 12541 WAT 5715 ATOM 12541 O WAT 5716 40.130 93.050 90.939 1.00 0.00 O ATOM 12542 H1 WAT 5716 40.033 92.130 91.187 1.00 0.00 H ATOM 12543 H2 WAT 5716 40.769 93.040 90.226 1.00 0.00 H TER 12545 WAT 5716 ATOM 12545 O WAT 5717 82.299 136.625 66.794 1.00 0.00 O ATOM 12546 H1 WAT 5717 82.221 136.405 65.866 1.00 0.00 H ATOM 12547 H2 WAT 5717 81.593 136.135 67.216 1.00 0.00 H TER 12549 WAT 5717 ATOM 12549 O WAT 5718 110.577 142.571 91.272 1.00 0.00 O ATOM 12550 H1 WAT 5718 111.103 142.327 90.510 1.00 0.00 H ATOM 12551 H2 WAT 5718 110.608 141.801 91.841 1.00 0.00 H TER 12553 WAT 5718 ATOM 12553 O WAT 5719 29.520 126.295 14.043 1.00 0.00 O ATOM 12554 H1 WAT 5719 30.186 126.881 13.684 1.00 0.00 H ATOM 12555 H2 WAT 5719 29.648 125.471 13.572 1.00 0.00 H TER 12557 WAT 5719 ATOM 12557 O WAT 5720 92.756 40.245 55.143 1.00 0.00 O ATOM 12558 H1 WAT 5720 91.934 40.635 55.440 1.00 0.00 H ATOM 12559 H2 WAT 5720 93.219 40.018 55.949 1.00 0.00 H TER 12561 WAT 5720 ATOM 12561 O WAT 5721 143.048 18.856 121.566 1.00 0.00 O ATOM 12562 H1 WAT 5721 143.229 18.013 121.981 1.00 0.00 H ATOM 12563 H2 WAT 5721 143.799 19.403 121.798 1.00 0.00 H TER 12565 WAT 5721 ATOM 12565 O WAT 5722 118.033 73.258 140.284 1.00 0.00 O ATOM 12566 H1 WAT 5722 117.349 73.482 139.653 1.00 0.00 H ATOM 12567 H2 WAT 5722 117.556 73.006 141.075 1.00 0.00 H TER 12569 WAT 5722 ATOM 12569 O WAT 5723 136.860 88.832 91.545 1.00 0.00 O ATOM 12570 H1 WAT 5723 136.751 88.493 90.656 1.00 0.00 H ATOM 12571 H2 WAT 5723 136.287 89.598 91.581 1.00 0.00 H TER 12573 WAT 5723 ATOM 12573 O WAT 5724 95.420 25.833 67.351 1.00 0.00 O ATOM 12574 H1 WAT 5724 95.195 26.451 68.046 1.00 0.00 H ATOM 12575 H2 WAT 5724 95.799 25.084 67.811 1.00 0.00 H TER 12577 WAT 5724 ATOM 12577 O WAT 5725 27.930 135.156 124.589 1.00 0.00 O ATOM 12578 H1 WAT 5725 28.838 135.400 124.406 1.00 0.00 H ATOM 12579 H2 WAT 5725 27.918 134.961 125.526 1.00 0.00 H TER 12581 WAT 5725 ATOM 12581 O WAT 5726 4.623 103.444 62.134 1.00 0.00 O ATOM 12582 H1 WAT 5726 5.498 103.385 62.519 1.00 0.00 H ATOM 12583 H2 WAT 5726 4.284 102.550 62.172 1.00 0.00 H TER 12585 WAT 5726 ATOM 12585 O WAT 5727 45.045 96.051 95.684 1.00 0.00 O ATOM 12586 H1 WAT 5727 44.654 95.410 95.090 1.00 0.00 H ATOM 12587 H2 WAT 5727 45.256 96.799 95.124 1.00 0.00 H TER 12589 WAT 5727 ATOM 12589 O WAT 5728 45.591 26.038 124.842 1.00 0.00 O ATOM 12590 H1 WAT 5728 45.252 26.313 125.694 1.00 0.00 H ATOM 12591 H2 WAT 5728 46.481 25.736 125.025 1.00 0.00 H TER 12593 WAT 5728 ATOM 12593 O WAT 5729 44.069 35.354 108.525 1.00 0.00 O ATOM 12594 H1 WAT 5729 43.738 36.092 108.014 1.00 0.00 H ATOM 12595 H2 WAT 5729 44.363 35.744 109.348 1.00 0.00 H TER 12597 WAT 5729 ATOM 12597 O WAT 5730 16.528 35.232 144.657 1.00 0.00 O ATOM 12598 H1 WAT 5730 16.909 34.904 145.472 1.00 0.00 H ATOM 12599 H2 WAT 5730 17.195 35.816 144.298 1.00 0.00 H TER 12601 WAT 5730 ATOM 12601 O WAT 5731 107.776 92.376 141.221 1.00 0.00 O ATOM 12602 H1 WAT 5731 108.485 92.839 140.773 1.00 0.00 H ATOM 12603 H2 WAT 5731 107.984 92.462 142.151 1.00 0.00 H TER 12605 WAT 5731 ATOM 12605 O WAT 5732 46.123 68.871 123.228 1.00 0.00 O ATOM 12606 H1 WAT 5732 45.959 68.943 124.168 1.00 0.00 H ATOM 12607 H2 WAT 5732 47.064 69.019 123.136 1.00 0.00 H TER 12609 WAT 5732 ATOM 12609 O WAT 5733 49.505 112.554 149.331 1.00 0.00 O ATOM 12610 H1 WAT 5733 49.444 112.118 148.481 1.00 0.00 H ATOM 12611 H2 WAT 5733 50.040 111.966 149.864 1.00 0.00 H TER 12613 WAT 5733 ATOM 12613 O WAT 5734 60.722 145.397 64.843 1.00 0.00 O ATOM 12614 H1 WAT 5734 60.286 144.905 64.147 1.00 0.00 H ATOM 12615 H2 WAT 5734 61.652 145.350 64.623 1.00 0.00 H TER 12617 WAT 5734 ATOM 12617 O WAT 5735 46.480 86.710 84.644 1.00 0.00 O ATOM 12618 H1 WAT 5735 45.907 86.443 83.925 1.00 0.00 H ATOM 12619 H2 WAT 5735 47.334 86.340 84.419 1.00 0.00 H TER 12621 WAT 5735 ATOM 12621 O WAT 5736 107.287 121.770 94.085 1.00 0.00 O ATOM 12622 H1 WAT 5736 106.391 122.107 94.095 1.00 0.00 H ATOM 12623 H2 WAT 5736 107.441 121.472 94.981 1.00 0.00 H TER 12625 WAT 5736 ATOM 12625 O WAT 5737 126.946 99.413 17.592 1.00 0.00 O ATOM 12626 H1 WAT 5737 126.919 100.343 17.817 1.00 0.00 H ATOM 12627 H2 WAT 5737 126.193 99.284 17.015 1.00 0.00 H TER 12629 WAT 5737 ATOM 12629 O WAT 5738 75.186 129.744 76.559 1.00 0.00 O ATOM 12630 H1 WAT 5738 75.859 129.092 76.752 1.00 0.00 H ATOM 12631 H2 WAT 5738 74.490 129.250 76.126 1.00 0.00 H TER 12633 WAT 5738 ATOM 12633 O WAT 5739 41.325 12.907 18.505 1.00 0.00 O ATOM 12634 H1 WAT 5739 41.211 12.845 17.556 1.00 0.00 H ATOM 12635 H2 WAT 5739 40.530 13.343 18.814 1.00 0.00 H TER 12637 WAT 5739 ATOM 12637 O WAT 5740 16.072 30.489 68.007 1.00 0.00 O ATOM 12638 H1 WAT 5740 15.136 30.520 68.207 1.00 0.00 H ATOM 12639 H2 WAT 5740 16.493 30.876 68.774 1.00 0.00 H TER 12641 WAT 5740 ATOM 12641 O WAT 5741 23.154 143.526 5.242 1.00 0.00 O ATOM 12642 H1 WAT 5741 23.454 143.197 6.090 1.00 0.00 H ATOM 12643 H2 WAT 5741 22.368 144.033 5.446 1.00 0.00 H TER 12645 WAT 5741 ATOM 12645 O WAT 5742 63.993 108.814 141.428 1.00 0.00 O ATOM 12646 H1 WAT 5742 64.111 108.453 142.306 1.00 0.00 H ATOM 12647 H2 WAT 5742 63.084 109.114 141.412 1.00 0.00 H TER 12649 WAT 5742 ATOM 12649 O WAT 5743 63.970 101.128 91.847 1.00 0.00 O ATOM 12650 H1 WAT 5743 63.969 102.034 91.537 1.00 0.00 H ATOM 12651 H2 WAT 5743 63.962 101.202 92.801 1.00 0.00 H TER 12653 WAT 5743 ATOM 12653 O WAT 5744 120.613 53.531 102.389 1.00 0.00 O ATOM 12654 H1 WAT 5744 121.281 53.820 103.011 1.00 0.00 H ATOM 12655 H2 WAT 5744 120.003 53.015 102.916 1.00 0.00 H TER 12657 WAT 5744 ATOM 12657 O WAT 5745 96.193 51.912 16.341 1.00 0.00 O ATOM 12658 H1 WAT 5745 96.129 52.867 16.322 1.00 0.00 H ATOM 12659 H2 WAT 5745 96.760 51.725 17.089 1.00 0.00 H TER 12661 WAT 5745 ATOM 12661 O WAT 5746 18.634 58.923 83.910 1.00 0.00 O ATOM 12662 H1 WAT 5746 19.540 58.776 84.183 1.00 0.00 H ATOM 12663 H2 WAT 5746 18.437 59.814 84.200 1.00 0.00 H TER 12665 WAT 5746 ATOM 12665 O WAT 5747 11.290 87.924 96.948 1.00 0.00 O ATOM 12666 H1 WAT 5747 12.156 88.247 97.197 1.00 0.00 H ATOM 12667 H2 WAT 5747 11.443 87.418 96.150 1.00 0.00 H TER 12669 WAT 5747 ATOM 12669 O WAT 5748 70.457 59.798 11.622 1.00 0.00 O ATOM 12670 H1 WAT 5748 69.949 60.279 12.275 1.00 0.00 H ATOM 12671 H2 WAT 5748 71.369 59.944 11.874 1.00 0.00 H TER 12673 WAT 5748 ATOM 12673 O WAT 5749 31.083 80.864 94.097 1.00 0.00 O ATOM 12674 H1 WAT 5749 31.512 80.894 93.242 1.00 0.00 H ATOM 12675 H2 WAT 5749 30.181 81.133 93.923 1.00 0.00 H TER 12677 WAT 5749 ATOM 12677 O WAT 5750 140.218 124.610 5.712 1.00 0.00 O ATOM 12678 H1 WAT 5750 140.899 125.258 5.892 1.00 0.00 H ATOM 12679 H2 WAT 5750 139.409 125.120 5.661 1.00 0.00 H TER 12681 WAT 5750 ATOM 12681 O WAT 5751 92.047 125.822 86.175 1.00 0.00 O ATOM 12682 H1 WAT 5751 92.237 126.278 85.355 1.00 0.00 H ATOM 12683 H2 WAT 5751 91.633 125.003 85.903 1.00 0.00 H TER 12685 WAT 5751 ATOM 12685 O WAT 5752 72.497 44.480 2.453 1.00 0.00 O ATOM 12686 H1 WAT 5752 72.489 43.544 2.654 1.00 0.00 H ATOM 12687 H2 WAT 5752 73.414 44.675 2.259 1.00 0.00 H TER 12689 WAT 5752 ATOM 12689 O WAT 5753 70.998 23.694 148.987 1.00 0.00 O ATOM 12690 H1 WAT 5753 70.680 24.363 149.593 1.00 0.00 H ATOM 12691 H2 WAT 5753 71.101 22.911 149.528 1.00 0.00 H TER 12693 WAT 5753 ATOM 12693 O WAT 5754 10.548 25.801 143.655 1.00 0.00 O ATOM 12694 H1 WAT 5754 9.694 25.754 143.225 1.00 0.00 H ATOM 12695 H2 WAT 5754 10.491 26.573 144.218 1.00 0.00 H TER 12697 WAT 5754 ATOM 12697 O WAT 5755 116.607 53.407 22.253 1.00 0.00 O ATOM 12698 H1 WAT 5755 116.178 54.174 21.872 1.00 0.00 H ATOM 12699 H2 WAT 5755 117.423 53.747 22.621 1.00 0.00 H TER 12701 WAT 5755 ATOM 12701 O WAT 5756 82.140 84.437 141.861 1.00 0.00 O ATOM 12702 H1 WAT 5756 82.794 83.740 141.909 1.00 0.00 H ATOM 12703 H2 WAT 5756 81.492 84.115 141.233 1.00 0.00 H TER 12705 WAT 5756 ATOM 12705 O WAT 5757 85.860 58.712 90.645 1.00 0.00 O ATOM 12706 H1 WAT 5757 84.909 58.699 90.745 1.00 0.00 H ATOM 12707 H2 WAT 5757 86.017 58.309 89.791 1.00 0.00 H TER 12709 WAT 5757 ATOM 12709 O WAT 5758 23.098 25.391 90.687 1.00 0.00 O ATOM 12710 H1 WAT 5758 23.717 26.067 90.963 1.00 0.00 H ATOM 12711 H2 WAT 5758 23.455 25.063 89.861 1.00 0.00 H TER 12713 WAT 5758 ATOM 12713 O WAT 5759 100.971 81.988 126.553 1.00 0.00 O ATOM 12714 H1 WAT 5759 101.185 82.835 126.943 1.00 0.00 H ATOM 12715 H2 WAT 5759 100.156 82.143 126.075 1.00 0.00 H TER 12717 WAT 5759 ATOM 12717 O WAT 5760 7.372 120.638 80.750 1.00 0.00 O ATOM 12718 H1 WAT 5760 6.765 120.194 80.159 1.00 0.00 H ATOM 12719 H2 WAT 5760 7.046 121.537 80.797 1.00 0.00 H TER 12721 WAT 5760 ATOM 12721 O WAT 5761 87.745 96.194 93.149 1.00 0.00 O ATOM 12722 H1 WAT 5761 86.962 96.708 93.345 1.00 0.00 H ATOM 12723 H2 WAT 5761 88.474 96.767 93.386 1.00 0.00 H TER 12725 WAT 5761 ATOM 12725 O WAT 5762 111.704 129.095 86.787 1.00 0.00 O ATOM 12726 H1 WAT 5762 111.901 129.782 87.424 1.00 0.00 H ATOM 12727 H2 WAT 5762 111.050 128.548 87.221 1.00 0.00 H TER 12729 WAT 5762 ATOM 12729 O WAT 5763 91.946 133.327 120.890 1.00 0.00 O ATOM 12730 H1 WAT 5763 92.074 134.147 121.367 1.00 0.00 H ATOM 12731 H2 WAT 5763 91.882 132.660 121.574 1.00 0.00 H TER 12733 WAT 5763 ATOM 12733 O WAT 5764 60.478 77.755 137.480 1.00 0.00 O ATOM 12734 H1 WAT 5764 59.764 78.187 137.948 1.00 0.00 H ATOM 12735 H2 WAT 5764 60.672 78.340 136.747 1.00 0.00 H TER 12737 WAT 5764 ATOM 12737 O WAT 5765 91.721 68.519 74.909 1.00 0.00 O ATOM 12738 H1 WAT 5765 91.385 67.867 75.524 1.00 0.00 H ATOM 12739 H2 WAT 5765 91.802 69.319 75.428 1.00 0.00 H TER 12741 WAT 5765 ATOM 12741 O WAT 5766 27.904 92.309 75.023 1.00 0.00 O ATOM 12742 H1 WAT 5766 28.539 91.887 75.602 1.00 0.00 H ATOM 12743 H2 WAT 5766 27.886 93.221 75.311 1.00 0.00 H TER 12745 WAT 5766 ATOM 12745 O WAT 5767 98.822 15.086 4.088 1.00 0.00 O ATOM 12746 H1 WAT 5767 98.773 14.131 4.048 1.00 0.00 H ATOM 12747 H2 WAT 5767 97.980 15.384 3.741 1.00 0.00 H TER 12749 WAT 5767 ATOM 12749 O WAT 5768 114.387 66.619 119.909 1.00 0.00 O ATOM 12750 H1 WAT 5768 115.065 66.035 119.570 1.00 0.00 H ATOM 12751 H2 WAT 5768 113.564 66.190 119.677 1.00 0.00 H TER 12753 WAT 5768 ATOM 12753 O WAT 5769 126.934 35.219 127.057 1.00 0.00 O ATOM 12754 H1 WAT 5769 127.484 36.002 127.016 1.00 0.00 H ATOM 12755 H2 WAT 5769 126.102 35.491 126.668 1.00 0.00 H TER 12757 WAT 5769 ATOM 12757 O WAT 5770 95.219 145.730 79.197 1.00 0.00 O ATOM 12758 H1 WAT 5770 95.744 145.698 78.397 1.00 0.00 H ATOM 12759 H2 WAT 5770 94.981 144.818 79.364 1.00 0.00 H TER 12761 WAT 5770 ATOM 12761 O WAT 5771 32.132 135.379 69.668 1.00 0.00 O ATOM 12762 H1 WAT 5771 32.522 135.051 70.478 1.00 0.00 H ATOM 12763 H2 WAT 5771 31.189 135.280 69.799 1.00 0.00 H TER 12765 WAT 5771 ATOM 12765 O WAT 5772 3.189 80.659 126.407 1.00 0.00 O ATOM 12766 H1 WAT 5772 3.479 81.335 125.795 1.00 0.00 H ATOM 12767 H2 WAT 5772 2.508 81.084 126.929 1.00 0.00 H TER 12769 WAT 5772 ATOM 12769 O WAT 5773 79.185 40.680 14.812 1.00 0.00 O ATOM 12770 H1 WAT 5773 80.083 40.428 15.024 1.00 0.00 H ATOM 12771 H2 WAT 5773 78.641 40.059 15.296 1.00 0.00 H TER 12773 WAT 5773 ATOM 12773 O WAT 5774 52.744 143.864 130.900 1.00 0.00 O ATOM 12774 H1 WAT 5774 53.125 144.295 131.665 1.00 0.00 H ATOM 12775 H2 WAT 5774 52.409 143.032 131.237 1.00 0.00 H TER 12777 WAT 5774 ATOM 12777 O WAT 5775 123.546 100.800 17.826 1.00 0.00 O ATOM 12778 H1 WAT 5775 123.998 101.417 17.251 1.00 0.00 H ATOM 12779 H2 WAT 5775 123.393 100.030 17.278 1.00 0.00 H TER 12781 WAT 5775 ATOM 12781 O WAT 5776 54.642 21.092 157.404 1.00 0.00 O ATOM 12782 H1 WAT 5776 55.201 21.090 156.628 1.00 0.00 H ATOM 12783 H2 WAT 5776 53.943 20.471 157.198 1.00 0.00 H TER 12785 WAT 5776 ATOM 12785 O WAT 5777 42.477 21.564 64.820 1.00 0.00 O ATOM 12786 H1 WAT 5777 43.125 22.032 64.293 1.00 0.00 H ATOM 12787 H2 WAT 5777 42.422 22.065 65.634 1.00 0.00 H TER 12789 WAT 5777 ATOM 12789 O WAT 5778 67.727 16.207 13.722 1.00 0.00 O ATOM 12790 H1 WAT 5778 67.295 16.724 13.041 1.00 0.00 H ATOM 12791 H2 WAT 5778 68.652 16.211 13.475 1.00 0.00 H TER 12793 WAT 5778 ATOM 12793 O WAT 5779 51.194 7.676 129.406 1.00 0.00 O ATOM 12794 H1 WAT 5779 50.645 8.425 129.173 1.00 0.00 H ATOM 12795 H2 WAT 5779 50.705 6.915 129.093 1.00 0.00 H TER 12797 WAT 5779 ATOM 12797 O WAT 5780 44.881 67.465 9.466 1.00 0.00 O ATOM 12798 H1 WAT 5780 44.780 68.182 10.092 1.00 0.00 H ATOM 12799 H2 WAT 5780 45.016 67.900 8.624 1.00 0.00 H TER 12801 WAT 5780 ATOM 12801 O WAT 5781 141.433 5.350 95.539 1.00 0.00 O ATOM 12802 H1 WAT 5781 142.225 4.895 95.253 1.00 0.00 H ATOM 12803 H2 WAT 5781 141.667 5.727 96.387 1.00 0.00 H TER 12805 WAT 5781 ATOM 12805 O WAT 5782 138.989 104.956 26.526 1.00 0.00 O ATOM 12806 H1 WAT 5782 139.704 104.365 26.286 1.00 0.00 H ATOM 12807 H2 WAT 5782 138.238 104.639 26.025 1.00 0.00 H TER 12809 WAT 5782 ATOM 12809 O WAT 5783 121.814 124.723 1.853 1.00 0.00 O ATOM 12810 H1 WAT 5783 121.852 124.005 1.222 1.00 0.00 H ATOM 12811 H2 WAT 5783 122.474 125.346 1.547 1.00 0.00 H TER 12813 WAT 5783 ATOM 12813 O WAT 5784 14.387 35.866 75.335 1.00 0.00 O ATOM 12814 H1 WAT 5784 15.181 36.256 74.969 1.00 0.00 H ATOM 12815 H2 WAT 5784 13.675 36.237 74.814 1.00 0.00 H TER 12817 WAT 5784 ATOM 12817 O WAT 5785 102.377 77.651 12.568 1.00 0.00 O ATOM 12818 H1 WAT 5785 101.777 77.747 13.308 1.00 0.00 H ATOM 12819 H2 WAT 5785 102.256 78.451 12.057 1.00 0.00 H TER 12821 WAT 5785 ATOM 12821 O WAT 5786 110.215 57.875 157.295 1.00 0.00 O ATOM 12822 H1 WAT 5786 110.511 58.758 157.073 1.00 0.00 H ATOM 12823 H2 WAT 5786 109.898 57.949 158.196 1.00 0.00 H TER 12825 WAT 5786 ATOM 12825 O WAT 5787 141.291 117.666 74.692 1.00 0.00 O ATOM 12826 H1 WAT 5787 141.664 118.354 75.242 1.00 0.00 H ATOM 12827 H2 WAT 5787 141.926 116.951 74.737 1.00 0.00 H TER 12829 WAT 5787 ATOM 12829 O WAT 5788 10.195 100.854 2.093 1.00 0.00 O ATOM 12830 H1 WAT 5788 10.314 101.545 1.441 1.00 0.00 H ATOM 12831 H2 WAT 5788 10.725 100.126 1.768 1.00 0.00 H TER 12833 WAT 5788 ATOM 12833 O WAT 5789 125.249 40.858 78.704 1.00 0.00 O ATOM 12834 H1 WAT 5789 125.425 39.952 78.958 1.00 0.00 H ATOM 12835 H2 WAT 5789 125.822 41.379 79.267 1.00 0.00 H TER 12837 WAT 5789 ATOM 12837 O WAT 5790 83.954 124.017 136.741 1.00 0.00 O ATOM 12838 H1 WAT 5790 83.483 124.724 137.181 1.00 0.00 H ATOM 12839 H2 WAT 5790 84.619 123.742 137.373 1.00 0.00 H TER 12841 WAT 5790 ATOM 12841 O WAT 5791 19.392 5.883 7.229 1.00 0.00 O ATOM 12842 H1 WAT 5791 19.592 5.940 6.295 1.00 0.00 H ATOM 12843 H2 WAT 5791 19.526 6.772 7.558 1.00 0.00 H TER 12845 WAT 5791 ATOM 12845 O WAT 5792 76.463 132.607 4.711 1.00 0.00 O ATOM 12846 H1 WAT 5792 77.278 132.594 5.212 1.00 0.00 H ATOM 12847 H2 WAT 5792 76.613 131.991 3.994 1.00 0.00 H TER 12849 WAT 5792 ATOM 12849 O WAT 5793 11.623 116.125 6.138 1.00 0.00 O ATOM 12850 H1 WAT 5793 12.484 116.019 5.734 1.00 0.00 H ATOM 12851 H2 WAT 5793 11.344 115.233 6.345 1.00 0.00 H TER 12853 WAT 5793 ATOM 12853 O WAT 5794 135.772 103.961 84.743 1.00 0.00 O ATOM 12854 H1 WAT 5794 136.315 104.213 85.490 1.00 0.00 H ATOM 12855 H2 WAT 5794 135.821 103.005 84.722 1.00 0.00 H TER 12857 WAT 5794 ATOM 12857 O WAT 5795 79.062 109.563 102.977 1.00 0.00 O ATOM 12858 H1 WAT 5795 78.440 110.135 103.426 1.00 0.00 H ATOM 12859 H2 WAT 5795 78.517 109.006 102.420 1.00 0.00 H TER 12861 WAT 5795 ATOM 12861 O WAT 5796 101.442 41.507 2.930 1.00 0.00 O ATOM 12862 H1 WAT 5796 101.597 40.675 2.483 1.00 0.00 H ATOM 12863 H2 WAT 5796 100.966 42.037 2.290 1.00 0.00 H TER 12865 WAT 5796 ATOM 12865 O WAT 5797 92.215 1.802 111.905 1.00 0.00 O ATOM 12866 H1 WAT 5797 91.710 2.514 112.299 1.00 0.00 H ATOM 12867 H2 WAT 5797 92.567 2.176 111.097 1.00 0.00 H TER 12869 WAT 5797 ATOM 12869 O WAT 5798 88.340 40.172 102.371 1.00 0.00 O ATOM 12870 H1 WAT 5798 89.156 39.672 102.398 1.00 0.00 H ATOM 12871 H2 WAT 5798 88.617 41.086 102.432 1.00 0.00 H TER 12873 WAT 5798 ATOM 12873 O WAT 5799 84.351 2.230 15.300 1.00 0.00 O ATOM 12874 H1 WAT 5799 85.215 2.144 14.895 1.00 0.00 H ATOM 12875 H2 WAT 5799 84.310 1.510 15.930 1.00 0.00 H TER 12877 WAT 5799 ATOM 12877 O WAT 5800 84.325 135.199 133.637 1.00 0.00 O ATOM 12878 H1 WAT 5800 84.813 135.992 133.861 1.00 0.00 H ATOM 12879 H2 WAT 5800 83.728 135.069 134.374 1.00 0.00 H TER 12881 WAT 5800 ATOM 12881 O WAT 5801 5.369 81.516 117.306 1.00 0.00 O ATOM 12882 H1 WAT 5801 5.757 81.799 118.134 1.00 0.00 H ATOM 12883 H2 WAT 5801 5.520 80.571 117.281 1.00 0.00 H TER 12885 WAT 5801 ATOM 12885 O WAT 5802 10.590 136.104 106.507 1.00 0.00 O ATOM 12886 H1 WAT 5802 10.259 135.287 106.132 1.00 0.00 H ATOM 12887 H2 WAT 5802 10.111 136.791 106.044 1.00 0.00 H TER 12889 WAT 5802 ATOM 12889 O WAT 5803 89.209 129.671 79.626 1.00 0.00 O ATOM 12890 H1 WAT 5803 88.276 129.561 79.811 1.00 0.00 H ATOM 12891 H2 WAT 5803 89.640 129.511 80.465 1.00 0.00 H TER 12893 WAT 5803 ATOM 12893 O WAT 5804 14.605 48.519 68.382 1.00 0.00 O ATOM 12894 H1 WAT 5804 14.456 47.712 68.875 1.00 0.00 H ATOM 12895 H2 WAT 5804 15.394 48.343 67.869 1.00 0.00 H TER 12897 WAT 5804 ATOM 12897 O WAT 5805 63.966 19.740 112.616 1.00 0.00 O ATOM 12898 H1 WAT 5805 64.384 19.155 113.248 1.00 0.00 H ATOM 12899 H2 WAT 5805 63.217 20.105 113.087 1.00 0.00 H TER 12901 WAT 5805 ATOM 12901 O WAT 5806 116.118 8.160 4.907 1.00 0.00 O ATOM 12902 H1 WAT 5806 116.557 8.058 4.063 1.00 0.00 H ATOM 12903 H2 WAT 5806 115.185 8.099 4.701 1.00 0.00 H TER 12905 WAT 5806 ATOM 12905 O WAT 5807 6.051 55.513 13.731 1.00 0.00 O ATOM 12906 H1 WAT 5807 6.042 54.942 12.962 1.00 0.00 H ATOM 12907 H2 WAT 5807 6.266 54.930 14.459 1.00 0.00 H TER 12909 WAT 5807 ATOM 12909 O WAT 5808 125.306 114.195 154.006 1.00 0.00 O ATOM 12910 H1 WAT 5808 124.848 114.150 153.167 1.00 0.00 H ATOM 12911 H2 WAT 5808 124.647 114.521 154.620 1.00 0.00 H TER 12913 WAT 5808 ATOM 12913 O WAT 5809 2.929 123.409 144.082 1.00 0.00 O ATOM 12914 H1 WAT 5809 2.118 122.984 143.802 1.00 0.00 H ATOM 12915 H2 WAT 5809 3.252 122.861 144.796 1.00 0.00 H TER 12917 WAT 5809 ATOM 12917 O WAT 5810 127.145 139.438 65.152 1.00 0.00 O ATOM 12918 H1 WAT 5810 127.129 139.637 66.088 1.00 0.00 H ATOM 12919 H2 WAT 5810 127.287 138.492 65.110 1.00 0.00 H TER 12921 WAT 5810 ATOM 12921 O WAT 5811 31.343 142.288 100.612 1.00 0.00 O ATOM 12922 H1 WAT 5811 31.722 143.014 101.107 1.00 0.00 H ATOM 12923 H2 WAT 5811 32.012 141.604 100.639 1.00 0.00 H TER 12925 WAT 5811 ATOM 12925 O WAT 5812 62.320 113.818 110.976 1.00 0.00 O ATOM 12926 H1 WAT 5812 62.094 114.710 110.713 1.00 0.00 H ATOM 12927 H2 WAT 5812 63.237 113.872 111.245 1.00 0.00 H TER 12929 WAT 5812 ATOM 12929 O WAT 5813 27.196 95.010 78.346 1.00 0.00 O ATOM 12930 H1 WAT 5813 26.518 94.433 78.697 1.00 0.00 H ATOM 12931 H2 WAT 5813 26.865 95.893 78.505 1.00 0.00 H TER 12933 WAT 5813 ATOM 12933 O WAT 5814 109.706 131.484 149.172 1.00 0.00 O ATOM 12934 H1 WAT 5814 110.587 131.815 148.997 1.00 0.00 H ATOM 12935 H2 WAT 5814 109.846 130.603 149.518 1.00 0.00 H TER 12937 WAT 5814 ATOM 12937 O WAT 5815 81.809 68.247 117.450 1.00 0.00 O ATOM 12938 H1 WAT 5815 81.729 68.027 118.378 1.00 0.00 H ATOM 12939 H2 WAT 5815 82.683 67.943 117.206 1.00 0.00 H TER 12941 WAT 5815 ATOM 12941 O WAT 5816 143.079 87.152 141.317 1.00 0.00 O ATOM 12942 H1 WAT 5816 142.488 87.900 141.229 1.00 0.00 H ATOM 12943 H2 WAT 5816 143.565 87.132 140.492 1.00 0.00 H TER 12945 WAT 5816 ATOM 12945 O WAT 5817 45.281 93.369 73.243 1.00 0.00 O ATOM 12946 H1 WAT 5817 44.583 93.500 73.885 1.00 0.00 H ATOM 12947 H2 WAT 5817 45.131 94.046 72.584 1.00 0.00 H TER 12949 WAT 5817 ATOM 12949 O WAT 5818 134.890 92.034 15.246 1.00 0.00 O ATOM 12950 H1 WAT 5818 134.814 92.978 15.385 1.00 0.00 H ATOM 12951 H2 WAT 5818 135.561 91.754 15.868 1.00 0.00 H TER 12953 WAT 5818 ATOM 12953 O WAT 5819 12.446 51.396 89.293 1.00 0.00 O ATOM 12954 H1 WAT 5819 11.684 51.836 89.671 1.00 0.00 H ATOM 12955 H2 WAT 5819 12.203 51.239 88.381 1.00 0.00 H TER 12957 WAT 5819 ATOM 12957 O WAT 5820 144.985 27.942 133.816 1.00 0.00 O ATOM 12958 H1 WAT 5820 144.679 27.035 133.795 1.00 0.00 H ATOM 12959 H2 WAT 5820 144.538 28.329 134.569 1.00 0.00 H TER 12961 WAT 5820 ATOM 12961 O WAT 5821 77.995 14.221 123.139 1.00 0.00 O ATOM 12962 H1 WAT 5821 77.151 14.230 123.590 1.00 0.00 H ATOM 12963 H2 WAT 5821 78.027 13.368 122.706 1.00 0.00 H TER 12965 WAT 5821 ATOM 12965 O WAT 5822 96.998 90.689 105.506 1.00 0.00 O ATOM 12966 H1 WAT 5822 97.666 90.461 104.859 1.00 0.00 H ATOM 12967 H2 WAT 5822 97.287 91.529 105.862 1.00 0.00 H TER 12969 WAT 5822 ATOM 12969 O WAT 5823 83.958 1.652 155.039 1.00 0.00 O ATOM 12970 H1 WAT 5823 84.320 0.835 154.698 1.00 0.00 H ATOM 12971 H2 WAT 5823 84.062 2.278 154.322 1.00 0.00 H TER 12973 WAT 5823 ATOM 12973 O WAT 5824 133.601 119.491 123.675 1.00 0.00 O ATOM 12974 H1 WAT 5824 132.822 119.239 123.181 1.00 0.00 H ATOM 12975 H2 WAT 5824 134.265 119.661 123.006 1.00 0.00 H TER 12977 WAT 5824 ATOM 12977 O WAT 5825 85.786 127.049 85.635 1.00 0.00 O ATOM 12978 H1 WAT 5825 85.282 126.508 86.243 1.00 0.00 H ATOM 12979 H2 WAT 5825 85.464 126.799 84.769 1.00 0.00 H TER 12981 WAT 5825 ATOM 12981 O WAT 5826 90.466 136.089 79.390 1.00 0.00 O ATOM 12982 H1 WAT 5826 90.090 135.279 79.735 1.00 0.00 H ATOM 12983 H2 WAT 5826 91.346 135.843 79.106 1.00 0.00 H TER 12985 WAT 5826 ATOM 12985 O WAT 5827 123.061 120.753 109.127 1.00 0.00 O ATOM 12986 H1 WAT 5827 123.918 120.335 109.038 1.00 0.00 H ATOM 12987 H2 WAT 5827 122.960 120.895 110.068 1.00 0.00 H TER 12989 WAT 5827 ATOM 12989 O WAT 5828 49.706 86.154 20.880 1.00 0.00 O ATOM 12990 H1 WAT 5828 49.743 85.219 21.080 1.00 0.00 H ATOM 12991 H2 WAT 5828 49.562 86.192 19.934 1.00 0.00 H TER 12993 WAT 5828 ATOM 12993 O WAT 5829 69.183 42.106 88.296 1.00 0.00 O ATOM 12994 H1 WAT 5829 68.247 42.304 88.271 1.00 0.00 H ATOM 12995 H2 WAT 5829 69.227 41.193 88.580 1.00 0.00 H TER 12997 WAT 5829 ATOM 12997 O WAT 5830 26.353 69.105 123.740 1.00 0.00 O ATOM 12998 H1 WAT 5830 25.508 68.929 123.326 1.00 0.00 H ATOM 12999 H2 WAT 5830 26.132 69.360 124.636 1.00 0.00 H TER 13001 WAT 5830 ATOM 13001 O WAT 5831 93.949 67.423 142.226 1.00 0.00 O ATOM 13002 H1 WAT 5831 93.312 67.883 142.772 1.00 0.00 H ATOM 13003 H2 WAT 5831 94.689 67.256 142.810 1.00 0.00 H TER 13005 WAT 5831 ATOM 13005 O WAT 5832 58.885 65.800 133.777 1.00 0.00 O ATOM 13006 H1 WAT 5832 58.553 66.433 133.140 1.00 0.00 H ATOM 13007 H2 WAT 5832 59.097 66.325 134.548 1.00 0.00 H TER 13009 WAT 5832 ATOM 13009 O WAT 5833 28.917 40.717 73.694 1.00 0.00 O ATOM 13010 H1 WAT 5833 29.776 40.324 73.538 1.00 0.00 H ATOM 13011 H2 WAT 5833 29.112 41.589 74.037 1.00 0.00 H TER 13013 WAT 5833 ATOM 13013 O WAT 5834 84.277 83.915 149.937 1.00 0.00 O ATOM 13014 H1 WAT 5834 84.567 84.777 149.638 1.00 0.00 H ATOM 13015 H2 WAT 5834 85.012 83.333 149.742 1.00 0.00 H TER 13017 WAT 5834 ATOM 13017 O WAT 5835 62.649 66.172 139.548 1.00 0.00 O ATOM 13018 H1 WAT 5835 61.978 66.619 140.064 1.00 0.00 H ATOM 13019 H2 WAT 5835 62.190 65.438 139.140 1.00 0.00 H TER 13021 WAT 5835 ATOM 13021 O WAT 5836 134.623 144.906 158.556 1.00 0.00 O ATOM 13022 H1 WAT 5836 133.709 144.657 158.695 1.00 0.00 H ATOM 13023 H2 WAT 5836 134.617 145.382 157.725 1.00 0.00 H TER 13025 WAT 5836 ATOM 13025 O WAT 5837 106.545 143.510 22.335 1.00 0.00 O ATOM 13026 H1 WAT 5837 106.339 142.594 22.148 1.00 0.00 H ATOM 13027 H2 WAT 5837 107.179 143.756 21.661 1.00 0.00 H TER 13029 WAT 5837 ATOM 13029 O WAT 5838 45.313 70.582 105.510 1.00 0.00 O ATOM 13030 H1 WAT 5838 45.301 71.362 104.956 1.00 0.00 H ATOM 13031 H2 WAT 5838 46.229 70.304 105.512 1.00 0.00 H TER 13033 WAT 5838 ATOM 13033 O WAT 5839 4.185 68.623 123.115 1.00 0.00 O ATOM 13034 H1 WAT 5839 3.528 68.076 122.684 1.00 0.00 H ATOM 13035 H2 WAT 5839 4.584 68.049 123.768 1.00 0.00 H TER 13037 WAT 5839 ATOM 13037 O WAT 5840 23.442 12.774 14.439 1.00 0.00 O ATOM 13038 H1 WAT 5840 23.021 12.967 15.276 1.00 0.00 H ATOM 13039 H2 WAT 5840 23.920 13.573 14.221 1.00 0.00 H TER 13041 WAT 5840 ATOM 13041 O WAT 5841 58.037 57.164 107.791 1.00 0.00 O ATOM 13042 H1 WAT 5841 58.357 57.988 108.157 1.00 0.00 H ATOM 13043 H2 WAT 5841 58.545 56.488 108.240 1.00 0.00 H TER 13045 WAT 5841 ATOM 13045 O WAT 5842 116.244 128.642 153.116 1.00 0.00 O ATOM 13046 H1 WAT 5842 117.131 128.281 153.121 1.00 0.00 H ATOM 13047 H2 WAT 5842 115.750 128.055 152.543 1.00 0.00 H TER 13049 WAT 5842 ATOM 13049 O WAT 5843 136.534 60.969 78.545 1.00 0.00 O ATOM 13050 H1 WAT 5843 135.672 61.048 78.953 1.00 0.00 H ATOM 13051 H2 WAT 5843 137.137 60.855 79.280 1.00 0.00 H TER 13053 WAT 5843 ATOM 13053 O WAT 5844 82.519 118.045 139.522 1.00 0.00 O ATOM 13054 H1 WAT 5844 81.600 117.812 139.389 1.00 0.00 H ATOM 13055 H2 WAT 5844 82.840 118.265 138.647 1.00 0.00 H TER 13057 WAT 5844 ATOM 13057 O WAT 5845 29.999 25.248 125.215 1.00 0.00 O ATOM 13058 H1 WAT 5845 29.285 25.197 125.851 1.00 0.00 H ATOM 13059 H2 WAT 5845 30.420 24.389 125.259 1.00 0.00 H TER 13061 WAT 5845 ATOM 13061 O WAT 5846 14.204 38.064 135.817 1.00 0.00 O ATOM 13062 H1 WAT 5846 14.479 38.477 134.998 1.00 0.00 H ATOM 13063 H2 WAT 5846 13.679 37.312 135.541 1.00 0.00 H TER 13065 WAT 5846 ATOM 13065 O WAT 5847 44.560 76.818 68.249 1.00 0.00 O ATOM 13066 H1 WAT 5847 44.533 76.601 69.181 1.00 0.00 H ATOM 13067 H2 WAT 5847 43.656 77.043 68.029 1.00 0.00 H TER 13069 WAT 5847 ATOM 13069 O WAT 5848 136.774 33.076 9.543 1.00 0.00 O ATOM 13070 H1 WAT 5848 137.082 32.339 10.071 1.00 0.00 H ATOM 13071 H2 WAT 5848 135.910 33.281 9.900 1.00 0.00 H TER 13073 WAT 5848 ATOM 13073 O WAT 5849 90.249 48.038 1.088 1.00 0.00 O ATOM 13074 H1 WAT 5849 91.112 47.650 1.236 1.00 0.00 H ATOM 13075 H2 WAT 5849 89.652 47.290 1.063 1.00 0.00 H TER 13077 WAT 5849 ATOM 13077 O WAT 5850 79.559 98.099 92.542 1.00 0.00 O ATOM 13078 H1 WAT 5850 79.441 98.577 91.721 1.00 0.00 H ATOM 13079 H2 WAT 5850 80.486 97.861 92.549 1.00 0.00 H TER 13081 WAT 5850 ATOM 13081 O WAT 5851 64.188 125.143 70.830 1.00 0.00 O ATOM 13082 H1 WAT 5851 64.572 126.005 70.994 1.00 0.00 H ATOM 13083 H2 WAT 5851 63.693 125.252 70.018 1.00 0.00 H TER 13085 WAT 5851 ATOM 13085 O WAT 5852 40.259 28.174 149.514 1.00 0.00 O ATOM 13086 H1 WAT 5852 40.440 27.376 150.010 1.00 0.00 H ATOM 13087 H2 WAT 5852 39.428 28.000 149.074 1.00 0.00 H TER 13089 WAT 5852 ATOM 13089 O WAT 5853 8.669 138.999 69.842 1.00 0.00 O ATOM 13090 H1 WAT 5853 9.287 139.421 70.439 1.00 0.00 H ATOM 13091 H2 WAT 5853 8.256 139.724 69.373 1.00 0.00 H TER 13093 WAT 5853 ATOM 13093 O WAT 5854 144.471 78.158 61.047 1.00 0.00 O ATOM 13094 H1 WAT 5854 144.772 78.210 61.954 1.00 0.00 H ATOM 13095 H2 WAT 5854 144.097 79.020 60.869 1.00 0.00 H TER 13097 WAT 5854 ATOM 13097 O WAT 5855 39.594 92.790 87.562 1.00 0.00 O ATOM 13098 H1 WAT 5855 39.317 92.365 88.373 1.00 0.00 H ATOM 13099 H2 WAT 5855 38.826 93.285 87.277 1.00 0.00 H TER 13101 WAT 5855 ATOM 13101 O WAT 5856 70.583 54.635 141.259 1.00 0.00 O ATOM 13102 H1 WAT 5856 69.666 54.361 141.305 1.00 0.00 H ATOM 13103 H2 WAT 5856 71.010 53.954 140.739 1.00 0.00 H TER 13105 WAT 5856 ATOM 13105 O WAT 5857 40.713 131.890 110.853 1.00 0.00 O ATOM 13106 H1 WAT 5857 40.448 131.109 110.368 1.00 0.00 H ATOM 13107 H2 WAT 5857 41.435 131.593 111.407 1.00 0.00 H TER 13109 WAT 5857 ATOM 13109 O WAT 5858 63.058 101.148 7.657 1.00 0.00 O ATOM 13110 H1 WAT 5858 63.986 101.316 7.491 1.00 0.00 H ATOM 13111 H2 WAT 5858 62.789 100.565 6.947 1.00 0.00 H TER 13113 WAT 5858 ATOM 13113 O WAT 5859 98.819 9.046 60.450 1.00 0.00 O ATOM 13114 H1 WAT 5859 98.686 8.106 60.333 1.00 0.00 H ATOM 13115 H2 WAT 5859 99.211 9.337 59.627 1.00 0.00 H TER 13117 WAT 5859 ATOM 13117 O WAT 5860 67.162 137.973 124.202 1.00 0.00 O ATOM 13118 H1 WAT 5860 68.051 137.875 124.543 1.00 0.00 H ATOM 13119 H2 WAT 5860 66.698 138.466 124.879 1.00 0.00 H TER 13121 WAT 5860 ATOM 13121 O WAT 5861 92.511 138.264 123.594 1.00 0.00 O ATOM 13122 H1 WAT 5861 92.718 137.825 124.419 1.00 0.00 H ATOM 13123 H2 WAT 5861 93.145 138.979 123.538 1.00 0.00 H TER 13125 WAT 5861 ATOM 13125 O WAT 5862 26.021 119.660 17.679 1.00 0.00 O ATOM 13126 H1 WAT 5862 25.808 118.832 18.110 1.00 0.00 H ATOM 13127 H2 WAT 5862 26.586 119.410 16.948 1.00 0.00 H TER 13129 WAT 5862 ATOM 13129 O WAT 5863 32.135 137.912 93.179 1.00 0.00 O ATOM 13130 H1 WAT 5863 31.845 137.422 92.410 1.00 0.00 H ATOM 13131 H2 WAT 5863 32.407 138.762 92.832 1.00 0.00 H TER 13133 WAT 5863 ATOM 13133 O WAT 5864 85.714 56.905 95.717 1.00 0.00 O ATOM 13134 H1 WAT 5864 85.422 56.451 96.508 1.00 0.00 H ATOM 13135 H2 WAT 5864 86.016 57.758 96.029 1.00 0.00 H TER 13137 WAT 5864 ATOM 13137 O WAT 5865 71.836 12.920 74.973 1.00 0.00 O ATOM 13138 H1 WAT 5865 72.120 13.509 75.671 1.00 0.00 H ATOM 13139 H2 WAT 5865 72.625 12.767 74.452 1.00 0.00 H TER 13141 WAT 5865 ATOM 13141 O WAT 5866 35.224 45.757 80.916 1.00 0.00 O ATOM 13142 H1 WAT 5866 35.846 46.138 80.295 1.00 0.00 H ATOM 13143 H2 WAT 5866 34.931 44.948 80.496 1.00 0.00 H TER 13145 WAT 5866 ATOM 13145 O WAT 5867 135.670 74.371 100.969 1.00 0.00 O ATOM 13146 H1 WAT 5867 135.054 74.394 101.702 1.00 0.00 H ATOM 13147 H2 WAT 5867 135.853 73.440 100.841 1.00 0.00 H TER 13149 WAT 5867 ATOM 13149 O WAT 5868 6.344 42.706 20.310 1.00 0.00 O ATOM 13150 H1 WAT 5868 5.900 41.913 20.008 1.00 0.00 H ATOM 13151 H2 WAT 5868 6.489 43.217 19.513 1.00 0.00 H TER 13153 WAT 5868 ATOM 13153 O WAT 5869 45.311 10.956 117.140 1.00 0.00 O ATOM 13154 H1 WAT 5869 45.063 11.863 116.960 1.00 0.00 H ATOM 13155 H2 WAT 5869 45.855 10.703 116.394 1.00 0.00 H TER 13157 WAT 5869 ATOM 13157 O WAT 5870 84.777 55.387 112.740 1.00 0.00 O ATOM 13158 H1 WAT 5870 84.182 54.792 112.284 1.00 0.00 H ATOM 13159 H2 WAT 5870 85.588 55.349 112.234 1.00 0.00 H TER 13161 WAT 5870 ATOM 13161 O WAT 5871 31.098 95.948 115.499 1.00 0.00 O ATOM 13162 H1 WAT 5871 31.292 95.562 116.353 1.00 0.00 H ATOM 13163 H2 WAT 5871 30.565 95.289 115.055 1.00 0.00 H TER 13165 WAT 5871 ATOM 13165 O WAT 5872 67.538 64.989 155.660 1.00 0.00 O ATOM 13166 H1 WAT 5872 67.087 64.465 156.322 1.00 0.00 H ATOM 13167 H2 WAT 5872 67.392 64.517 154.840 1.00 0.00 H TER 13169 WAT 5872 ATOM 13169 O WAT 5873 89.190 99.365 149.456 1.00 0.00 O ATOM 13170 H1 WAT 5873 88.649 100.153 149.513 1.00 0.00 H ATOM 13171 H2 WAT 5873 90.086 99.680 149.575 1.00 0.00 H TER 13173 WAT 5873 ATOM 13173 O WAT 5874 139.874 129.209 66.397 1.00 0.00 O ATOM 13174 H1 WAT 5874 140.397 128.799 67.086 1.00 0.00 H ATOM 13175 H2 WAT 5874 139.373 128.488 66.014 1.00 0.00 H TER 13177 WAT 5874 ATOM 13177 O WAT 5875 83.595 49.945 63.258 1.00 0.00 O ATOM 13178 H1 WAT 5875 84.406 50.451 63.298 1.00 0.00 H ATOM 13179 H2 WAT 5875 82.985 50.507 62.781 1.00 0.00 H TER 13181 WAT 5875 ATOM 13181 O WAT 5876 65.617 78.643 140.333 1.00 0.00 O ATOM 13182 H1 WAT 5876 66.052 78.073 139.700 1.00 0.00 H ATOM 13183 H2 WAT 5876 64.772 78.846 139.932 1.00 0.00 H TER 13185 WAT 5876 ATOM 13185 O WAT 5877 42.850 133.778 136.503 1.00 0.00 O ATOM 13186 H1 WAT 5877 43.261 132.963 136.217 1.00 0.00 H ATOM 13187 H2 WAT 5877 43.132 133.883 137.411 1.00 0.00 H TER 13189 WAT 5877 ATOM 13189 O WAT 5878 12.421 135.487 143.764 1.00 0.00 O ATOM 13190 H1 WAT 5878 12.970 135.437 144.546 1.00 0.00 H ATOM 13191 H2 WAT 5878 11.563 135.755 144.091 1.00 0.00 H TER 13193 WAT 5878 ATOM 13193 O WAT 5879 121.957 56.574 67.361 1.00 0.00 O ATOM 13194 H1 WAT 5879 122.139 55.861 67.972 1.00 0.00 H ATOM 13195 H2 WAT 5879 121.650 56.137 66.566 1.00 0.00 H TER 13197 WAT 5879 ATOM 13197 O WAT 5880 89.575 66.788 103.450 1.00 0.00 O ATOM 13198 H1 WAT 5880 90.086 66.045 103.130 1.00 0.00 H ATOM 13199 H2 WAT 5880 88.783 66.784 102.913 1.00 0.00 H TER 13201 WAT 5880 ATOM 13201 O WAT 5881 114.778 61.946 108.319 1.00 0.00 O ATOM 13202 H1 WAT 5881 114.226 62.456 107.726 1.00 0.00 H ATOM 13203 H2 WAT 5881 114.581 61.034 108.104 1.00 0.00 H TER 13205 WAT 5881 ATOM 13205 O WAT 5882 41.326 14.013 5.066 1.00 0.00 O ATOM 13206 H1 WAT 5882 41.196 13.294 4.447 1.00 0.00 H ATOM 13207 H2 WAT 5882 42.113 14.459 4.753 1.00 0.00 H TER 13209 WAT 5882 ATOM 13209 O WAT 5883 48.811 51.945 107.336 1.00 0.00 O ATOM 13210 H1 WAT 5883 49.187 51.308 106.727 1.00 0.00 H ATOM 13211 H2 WAT 5883 48.711 51.462 108.156 1.00 0.00 H TER 13213 WAT 5883 ATOM 13213 O WAT 5884 127.956 19.162 60.946 1.00 0.00 O ATOM 13214 H1 WAT 5884 128.140 20.033 61.298 1.00 0.00 H ATOM 13215 H2 WAT 5884 128.817 18.806 60.726 1.00 0.00 H TER 13217 WAT 5884 ATOM 13217 O WAT 5885 5.837 84.100 125.321 1.00 0.00 O ATOM 13218 H1 WAT 5885 5.472 84.718 124.688 1.00 0.00 H ATOM 13219 H2 WAT 5885 5.244 83.350 125.292 1.00 0.00 H TER 13221 WAT 5885 ATOM 13221 O WAT 5886 100.515 133.070 64.067 1.00 0.00 O ATOM 13222 H1 WAT 5886 99.927 132.875 63.337 1.00 0.00 H ATOM 13223 H2 WAT 5886 101.370 132.751 63.778 1.00 0.00 H TER 13225 WAT 5886 ATOM 13225 O WAT 5887 10.473 27.008 128.371 1.00 0.00 O ATOM 13226 H1 WAT 5887 10.246 26.227 128.876 1.00 0.00 H ATOM 13227 H2 WAT 5887 10.636 27.681 129.032 1.00 0.00 H TER 13229 WAT 5887 ATOM 13229 O WAT 5888 73.369 28.109 14.162 1.00 0.00 O ATOM 13230 H1 WAT 5888 72.413 28.132 14.204 1.00 0.00 H ATOM 13231 H2 WAT 5888 73.563 27.821 13.270 1.00 0.00 H TER 13233 WAT 5888 ATOM 13233 O WAT 5889 9.380 22.575 94.695 1.00 0.00 O ATOM 13234 H1 WAT 5889 9.500 21.733 95.134 1.00 0.00 H ATOM 13235 H2 WAT 5889 9.811 22.466 93.847 1.00 0.00 H TER 13237 WAT 5889 ATOM 13237 O WAT 5890 59.993 94.740 4.245 1.00 0.00 O ATOM 13238 H1 WAT 5890 60.923 94.565 4.387 1.00 0.00 H ATOM 13239 H2 WAT 5890 59.782 95.437 4.866 1.00 0.00 H TER 13241 WAT 5890 ATOM 13241 O WAT 5891 130.331 36.705 146.156 1.00 0.00 O ATOM 13242 H1 WAT 5891 129.403 36.580 146.351 1.00 0.00 H ATOM 13243 H2 WAT 5891 130.500 37.622 146.374 1.00 0.00 H TER 13245 WAT 5891 ATOM 13245 O WAT 5892 105.266 138.951 126.522 1.00 0.00 O ATOM 13246 H1 WAT 5892 105.592 138.881 127.419 1.00 0.00 H ATOM 13247 H2 WAT 5892 105.499 139.840 126.251 1.00 0.00 H TER 13249 WAT 5892 ATOM 13249 O WAT 5893 91.301 88.150 111.897 1.00 0.00 O ATOM 13250 H1 WAT 5893 90.967 88.002 112.781 1.00 0.00 H ATOM 13251 H2 WAT 5893 92.113 87.646 111.860 1.00 0.00 H TER 13253 WAT 5893 ATOM 13253 O WAT 5894 74.106 125.089 107.304 1.00 0.00 O ATOM 13254 H1 WAT 5894 73.426 125.294 106.662 1.00 0.00 H ATOM 13255 H2 WAT 5894 74.361 124.189 107.103 1.00 0.00 H TER 13257 WAT 5894 ATOM 13257 O WAT 5895 19.209 94.952 68.785 1.00 0.00 O ATOM 13258 H1 WAT 5895 18.805 95.573 68.179 1.00 0.00 H ATOM 13259 H2 WAT 5895 19.984 94.635 68.323 1.00 0.00 H TER 13261 WAT 5895 ATOM 13261 O WAT 5896 127.635 113.239 10.878 1.00 0.00 O ATOM 13262 H1 WAT 5896 127.380 112.619 11.561 1.00 0.00 H ATOM 13263 H2 WAT 5896 128.583 113.132 10.799 1.00 0.00 H TER 13265 WAT 5896 ATOM 13265 O WAT 5897 60.996 32.897 20.442 1.00 0.00 O ATOM 13266 H1 WAT 5897 60.198 33.414 20.554 1.00 0.00 H ATOM 13267 H2 WAT 5897 61.187 32.560 21.318 1.00 0.00 H TER 13269 WAT 5897 ATOM 13269 O WAT 5898 39.451 45.366 102.742 1.00 0.00 O ATOM 13270 H1 WAT 5898 40.333 45.610 103.022 1.00 0.00 H ATOM 13271 H2 WAT 5898 39.306 45.870 101.941 1.00 0.00 H TER 13273 WAT 5898 ATOM 13273 O WAT 5899 78.229 138.758 58.687 1.00 0.00 O ATOM 13274 H1 WAT 5899 77.851 138.905 59.555 1.00 0.00 H ATOM 13275 H2 WAT 5899 77.943 137.876 58.448 1.00 0.00 H TER 13277 WAT 5899 ATOM 13277 O WAT 5900 97.147 91.975 143.279 1.00 0.00 O ATOM 13278 H1 WAT 5900 97.204 92.804 142.804 1.00 0.00 H ATOM 13279 H2 WAT 5900 97.960 91.518 143.062 1.00 0.00 H TER 13281 WAT 5900 ATOM 13281 O WAT 5901 81.631 110.710 106.232 1.00 0.00 O ATOM 13282 H1 WAT 5901 81.512 109.849 105.832 1.00 0.00 H ATOM 13283 H2 WAT 5901 82.550 110.924 106.073 1.00 0.00 H TER 13285 WAT 5901 ATOM 13285 O WAT 5902 95.967 28.243 4.905 1.00 0.00 O ATOM 13286 H1 WAT 5902 95.439 28.087 5.688 1.00 0.00 H ATOM 13287 H2 WAT 5902 96.046 29.196 4.855 1.00 0.00 H TER 13289 WAT 5902 ATOM 13289 O WAT 5903 44.918 61.457 91.381 1.00 0.00 O ATOM 13290 H1 WAT 5903 44.353 61.547 92.149 1.00 0.00 H ATOM 13291 H2 WAT 5903 45.787 61.281 91.743 1.00 0.00 H TER 13293 WAT 5903 ATOM 13293 O WAT 5904 6.759 24.925 90.665 1.00 0.00 O ATOM 13294 H1 WAT 5904 7.692 24.815 90.483 1.00 0.00 H ATOM 13295 H2 WAT 5904 6.717 25.098 91.605 1.00 0.00 H TER 13297 WAT 5904 ATOM 13297 O WAT 5905 72.339 129.391 75.231 1.00 0.00 O ATOM 13298 H1 WAT 5905 71.997 128.674 74.698 1.00 0.00 H ATOM 13299 H2 WAT 5905 71.976 129.235 76.103 1.00 0.00 H TER 13301 WAT 5905 ATOM 13301 O WAT 5906 140.970 54.440 24.182 1.00 0.00 O ATOM 13302 H1 WAT 5906 140.718 55.356 24.299 1.00 0.00 H ATOM 13303 H2 WAT 5906 140.770 54.028 25.023 1.00 0.00 H TER 13305 WAT 5906 ATOM 13305 O WAT 5907 35.045 8.447 65.149 1.00 0.00 O ATOM 13306 H1 WAT 5907 35.823 7.990 64.830 1.00 0.00 H ATOM 13307 H2 WAT 5907 34.390 8.311 64.466 1.00 0.00 H TER 13309 WAT 5907 ATOM 13309 O WAT 5908 44.447 101.566 158.201 1.00 0.00 O ATOM 13310 H1 WAT 5908 44.273 100.962 158.923 1.00 0.00 H ATOM 13311 H2 WAT 5908 44.098 102.405 158.502 1.00 0.00 H TER 13313 WAT 5908 ATOM 13313 O WAT 5909 82.261 18.929 131.251 1.00 0.00 O ATOM 13314 H1 WAT 5909 83.127 18.725 130.898 1.00 0.00 H ATOM 13315 H2 WAT 5909 81.798 19.347 130.526 1.00 0.00 H TER 13317 WAT 5909 ATOM 13317 O WAT 5910 116.757 40.331 86.725 1.00 0.00 O ATOM 13318 H1 WAT 5910 116.835 41.281 86.813 1.00 0.00 H ATOM 13319 H2 WAT 5910 115.829 40.152 86.876 1.00 0.00 H TER 13321 WAT 5910 ATOM 13321 O WAT 5911 136.892 4.767 110.775 1.00 0.00 O ATOM 13322 H1 WAT 5911 137.173 3.970 110.327 1.00 0.00 H ATOM 13323 H2 WAT 5911 137.582 5.404 110.588 1.00 0.00 H TER 13325 WAT 5911 ATOM 13325 O WAT 5912 99.513 84.505 27.170 1.00 0.00 O ATOM 13326 H1 WAT 5912 100.444 84.427 27.378 1.00 0.00 H ATOM 13327 H2 WAT 5912 99.087 84.622 28.020 1.00 0.00 H TER 13329 WAT 5912 ATOM 13329 O WAT 5913 38.539 105.449 76.833 1.00 0.00 O ATOM 13330 H1 WAT 5913 39.408 105.062 76.728 1.00 0.00 H ATOM 13331 H2 WAT 5913 38.378 105.423 77.776 1.00 0.00 H TER 13333 WAT 5913 ATOM 13333 O WAT 5914 17.597 14.786 147.814 1.00 0.00 O ATOM 13334 H1 WAT 5914 17.085 14.632 147.020 1.00 0.00 H ATOM 13335 H2 WAT 5914 17.090 15.431 148.305 1.00 0.00 H TER 13337 WAT 5914 ATOM 13337 O WAT 5915 142.137 74.298 93.086 1.00 0.00 O ATOM 13338 H1 WAT 5915 142.603 73.650 93.614 1.00 0.00 H ATOM 13339 H2 WAT 5915 142.106 75.079 93.638 1.00 0.00 H TER 13341 WAT 5915 ATOM 13341 O WAT 5916 114.393 131.540 10.915 1.00 0.00 O ATOM 13342 H1 WAT 5916 113.513 131.162 10.897 1.00 0.00 H ATOM 13343 H2 WAT 5916 114.272 132.440 10.613 1.00 0.00 H TER 13345 WAT 5916 ATOM 13345 O WAT 5917 100.416 121.955 106.551 1.00 0.00 O ATOM 13346 H1 WAT 5917 101.260 121.977 106.100 1.00 0.00 H ATOM 13347 H2 WAT 5917 100.405 121.107 106.995 1.00 0.00 H TER 13349 WAT 5917 ATOM 13349 O WAT 5918 5.164 106.262 5.602 1.00 0.00 O ATOM 13350 H1 WAT 5918 4.509 106.631 6.195 1.00 0.00 H ATOM 13351 H2 WAT 5918 5.031 106.729 4.777 1.00 0.00 H TER 13353 WAT 5918 ATOM 13353 O WAT 5919 47.011 58.222 92.665 1.00 0.00 O ATOM 13354 H1 WAT 5919 47.567 57.494 92.943 1.00 0.00 H ATOM 13355 H2 WAT 5919 46.141 57.835 92.568 1.00 0.00 H TER 13357 WAT 5919 ATOM 13357 O WAT 5920 56.171 94.182 140.725 1.00 0.00 O ATOM 13358 H1 WAT 5920 56.368 93.950 139.817 1.00 0.00 H ATOM 13359 H2 WAT 5920 57.028 94.334 141.124 1.00 0.00 H TER 13361 WAT 5920 ATOM 13361 O WAT 5921 69.252 47.634 2.959 1.00 0.00 O ATOM 13362 H1 WAT 5921 70.071 47.207 3.212 1.00 0.00 H ATOM 13363 H2 WAT 5921 69.110 48.298 3.634 1.00 0.00 H TER 13365 WAT 5921 ATOM 13365 O WAT 5922 138.886 16.275 119.873 1.00 0.00 O ATOM 13366 H1 WAT 5922 139.478 16.407 119.132 1.00 0.00 H ATOM 13367 H2 WAT 5922 138.043 16.610 119.569 1.00 0.00 H TER 13369 WAT 5922 ATOM 13369 O WAT 5923 128.654 141.575 92.682 1.00 0.00 O ATOM 13370 H1 WAT 5923 129.444 141.065 92.861 1.00 0.00 H ATOM 13371 H2 WAT 5923 128.844 142.032 91.863 1.00 0.00 H TER 13373 WAT 5923 ATOM 13373 O WAT 5924 85.750 135.298 145.953 1.00 0.00 O ATOM 13374 H1 WAT 5924 86.125 134.925 145.156 1.00 0.00 H ATOM 13375 H2 WAT 5924 86.190 136.142 146.053 1.00 0.00 H TER 13377 WAT 5924 ATOM 13377 O WAT 5925 40.423 12.324 64.710 1.00 0.00 O ATOM 13378 H1 WAT 5925 40.912 11.503 64.780 1.00 0.00 H ATOM 13379 H2 WAT 5925 41.096 12.993 64.581 1.00 0.00 H TER 13381 WAT 5925 ATOM 13381 O WAT 5926 67.939 38.111 5.468 1.00 0.00 O ATOM 13382 H1 WAT 5926 67.385 38.797 5.842 1.00 0.00 H ATOM 13383 H2 WAT 5926 67.425 37.310 5.564 1.00 0.00 H TER 13385 WAT 5926 ATOM 13385 O WAT 5927 10.941 140.448 75.956 1.00 0.00 O ATOM 13386 H1 WAT 5927 11.270 140.583 76.844 1.00 0.00 H ATOM 13387 H2 WAT 5927 10.589 139.557 75.964 1.00 0.00 H TER 13389 WAT 5927 ATOM 13389 O WAT 5928 52.248 6.353 83.271 1.00 0.00 O ATOM 13390 H1 WAT 5928 51.329 6.291 83.008 1.00 0.00 H ATOM 13391 H2 WAT 5928 52.466 7.278 83.160 1.00 0.00 H TER 13393 WAT 5928 ATOM 13393 O WAT 5929 74.714 110.678 11.654 1.00 0.00 O ATOM 13394 H1 WAT 5929 74.940 110.845 12.569 1.00 0.00 H ATOM 13395 H2 WAT 5929 73.886 110.199 11.696 1.00 0.00 H TER 13397 WAT 5929 ATOM 13397 O WAT 5930 119.359 52.816 57.366 1.00 0.00 O ATOM 13398 H1 WAT 5930 119.143 52.377 56.544 1.00 0.00 H ATOM 13399 H2 WAT 5930 119.266 52.134 58.032 1.00 0.00 H TER 13401 WAT 5930 ATOM 13401 O WAT 5931 16.470 24.991 102.079 1.00 0.00 O ATOM 13402 H1 WAT 5931 16.735 25.223 101.189 1.00 0.00 H ATOM 13403 H2 WAT 5931 17.278 24.698 102.501 1.00 0.00 H TER 13405 WAT 5931 ATOM 13405 O WAT 5932 121.289 81.470 5.295 1.00 0.00 O ATOM 13406 H1 WAT 5932 120.365 81.695 5.186 1.00 0.00 H ATOM 13407 H2 WAT 5932 121.286 80.736 5.909 1.00 0.00 H TER 13409 WAT 5932 ATOM 13409 O WAT 5933 98.759 64.695 94.656 1.00 0.00 O ATOM 13410 H1 WAT 5933 98.977 65.500 95.125 1.00 0.00 H ATOM 13411 H2 WAT 5933 97.815 64.595 94.776 1.00 0.00 H TER 13413 WAT 5933 ATOM 13413 O WAT 5934 101.834 25.107 66.924 1.00 0.00 O ATOM 13414 H1 WAT 5934 100.893 25.154 67.096 1.00 0.00 H ATOM 13415 H2 WAT 5934 101.897 24.770 66.030 1.00 0.00 H TER 13417 WAT 5934 ATOM 13417 O WAT 5935 91.991 38.578 157.152 1.00 0.00 O ATOM 13418 H1 WAT 5935 92.879 38.398 157.462 1.00 0.00 H ATOM 13419 H2 WAT 5935 92.111 39.195 156.430 1.00 0.00 H TER 13421 WAT 5935 ATOM 13421 O WAT 5936 76.842 116.043 134.863 1.00 0.00 O ATOM 13422 H1 WAT 5936 76.494 115.626 135.652 1.00 0.00 H ATOM 13423 H2 WAT 5936 76.128 116.599 134.551 1.00 0.00 H TER 13425 WAT 5936 ATOM 13425 O WAT 5937 42.458 42.833 6.969 1.00 0.00 O ATOM 13426 H1 WAT 5937 41.854 43.453 7.378 1.00 0.00 H ATOM 13427 H2 WAT 5937 43.002 42.517 7.691 1.00 0.00 H TER 13429 WAT 5937 ATOM 13429 O WAT 5938 83.729 62.820 82.332 1.00 0.00 O ATOM 13430 H1 WAT 5938 82.971 63.003 82.888 1.00 0.00 H ATOM 13431 H2 WAT 5938 83.608 63.385 81.569 1.00 0.00 H TER 13433 WAT 5938 ATOM 13433 O WAT 5939 5.258 84.183 65.966 1.00 0.00 O ATOM 13434 H1 WAT 5939 5.953 83.662 66.367 1.00 0.00 H ATOM 13435 H2 WAT 5939 5.426 85.077 66.265 1.00 0.00 H TER 13437 WAT 5939 ATOM 13437 O WAT 5940 16.339 132.364 88.528 1.00 0.00 O ATOM 13438 H1 WAT 5940 16.229 133.190 89.000 1.00 0.00 H ATOM 13439 H2 WAT 5940 16.770 131.785 89.157 1.00 0.00 H TER 13441 WAT 5940 ATOM 13441 O WAT 5941 73.647 66.949 109.554 1.00 0.00 O ATOM 13442 H1 WAT 5941 73.086 66.199 109.354 1.00 0.00 H ATOM 13443 H2 WAT 5941 73.423 67.181 110.456 1.00 0.00 H TER 13445 WAT 5941 ATOM 13445 O WAT 5942 24.289 32.445 66.442 1.00 0.00 O ATOM 13446 H1 WAT 5942 23.822 31.884 65.823 1.00 0.00 H ATOM 13447 H2 WAT 5942 25.099 31.971 66.630 1.00 0.00 H TER 13449 WAT 5942 ATOM 13449 O WAT 5943 102.054 9.492 6.646 1.00 0.00 O ATOM 13450 H1 WAT 5943 101.958 8.542 6.579 1.00 0.00 H ATOM 13451 H2 WAT 5943 102.941 9.666 6.332 1.00 0.00 H TER 13453 WAT 5943 ATOM 13453 O WAT 5944 54.178 23.097 83.457 1.00 0.00 O ATOM 13454 H1 WAT 5944 54.157 22.852 84.382 1.00 0.00 H ATOM 13455 H2 WAT 5944 54.966 23.632 83.369 1.00 0.00 H TER 13457 WAT 5944 ATOM 13457 O WAT 5945 133.296 18.795 139.501 1.00 0.00 O ATOM 13458 H1 WAT 5945 132.371 18.711 139.731 1.00 0.00 H ATOM 13459 H2 WAT 5945 133.627 19.476 140.086 1.00 0.00 H TER 13461 WAT 5945 ATOM 13461 O WAT 5946 59.410 0.442 93.833 1.00 0.00 O ATOM 13462 H1 WAT 5946 58.600 0.201 94.283 1.00 0.00 H ATOM 13463 H2 WAT 5946 59.490 -0.199 93.126 1.00 0.00 H TER 13465 WAT 5946 ATOM 13465 O WAT 5947 84.646 39.494 4.813 1.00 0.00 O ATOM 13466 H1 WAT 5947 84.321 39.321 5.697 1.00 0.00 H ATOM 13467 H2 WAT 5947 84.528 38.665 4.348 1.00 0.00 H TER 13469 WAT 5947 ATOM 13469 O WAT 5948 77.535 34.480 134.990 1.00 0.00 O ATOM 13470 H1 WAT 5948 77.188 33.597 134.862 1.00 0.00 H ATOM 13471 H2 WAT 5948 78.331 34.504 134.458 1.00 0.00 H TER 13473 WAT 5948 ATOM 13473 O WAT 5949 4.792 123.503 142.064 1.00 0.00 O ATOM 13474 H1 WAT 5949 5.638 123.278 142.453 1.00 0.00 H ATOM 13475 H2 WAT 5949 4.156 123.323 142.756 1.00 0.00 H TER 13477 WAT 5949 ATOM 13477 O WAT 5950 12.803 46.397 3.808 1.00 0.00 O ATOM 13478 H1 WAT 5950 12.370 46.843 3.080 1.00 0.00 H ATOM 13479 H2 WAT 5950 12.399 45.530 3.832 1.00 0.00 H TER 13481 WAT 5950 ATOM 13481 O WAT 5951 92.042 0.177 133.165 1.00 0.00 O ATOM 13482 H1 WAT 5951 91.610 0.121 132.313 1.00 0.00 H ATOM 13483 H2 WAT 5951 91.519 -0.386 133.736 1.00 0.00 H TER 13485 WAT 5951 ATOM 13485 O WAT 5952 103.113 76.914 150.054 1.00 0.00 O ATOM 13486 H1 WAT 5952 102.508 77.543 149.661 1.00 0.00 H ATOM 13487 H2 WAT 5952 103.744 77.454 150.531 1.00 0.00 H TER 13489 WAT 5952 ATOM 13489 O WAT 5953 10.570 13.667 94.039 1.00 0.00 O ATOM 13490 H1 WAT 5953 9.729 13.869 93.629 1.00 0.00 H ATOM 13491 H2 WAT 5953 10.536 14.110 94.887 1.00 0.00 H TER 13493 WAT 5953 ATOM 13493 O WAT 5954 36.393 138.868 75.557 1.00 0.00 O ATOM 13494 H1 WAT 5954 35.989 138.867 74.689 1.00 0.00 H ATOM 13495 H2 WAT 5954 35.948 138.164 76.029 1.00 0.00 H TER 13497 WAT 5954 ATOM 13497 O WAT 5955 87.221 123.032 126.797 1.00 0.00 O ATOM 13498 H1 WAT 5955 86.648 122.665 126.123 1.00 0.00 H ATOM 13499 H2 WAT 5955 87.002 123.963 126.816 1.00 0.00 H TER 13501 WAT 5955 ATOM 13501 O WAT 5956 28.438 104.406 18.567 1.00 0.00 O ATOM 13502 H1 WAT 5956 28.554 103.744 19.249 1.00 0.00 H ATOM 13503 H2 WAT 5956 27.730 104.962 18.891 1.00 0.00 H TER 13505 WAT 5956 ATOM 13505 O WAT 5957 106.820 23.401 60.206 1.00 0.00 O ATOM 13506 H1 WAT 5957 106.018 23.565 59.711 1.00 0.00 H ATOM 13507 H2 WAT 5957 107.018 22.479 60.043 1.00 0.00 H TER 13509 WAT 5957 ATOM 13509 O WAT 5958 43.676 137.462 131.137 1.00 0.00 O ATOM 13510 H1 WAT 5958 42.853 137.375 130.656 1.00 0.00 H ATOM 13511 H2 WAT 5958 44.223 138.012 130.576 1.00 0.00 H TER 13513 WAT 5958 ATOM 13513 O WAT 5959 95.468 144.988 85.611 1.00 0.00 O ATOM 13514 H1 WAT 5959 95.728 145.247 86.495 1.00 0.00 H ATOM 13515 H2 WAT 5959 95.596 145.776 85.083 1.00 0.00 H TER 13517 WAT 5959 ATOM 13517 O WAT 5960 39.993 104.426 64.693 1.00 0.00 O ATOM 13518 H1 WAT 5960 39.874 103.826 65.429 1.00 0.00 H ATOM 13519 H2 WAT 5960 40.530 103.937 64.069 1.00 0.00 H TER 13521 WAT 5960 ATOM 13521 O WAT 5961 33.270 0.569 153.202 1.00 0.00 O ATOM 13522 H1 WAT 5961 32.662 0.528 152.463 1.00 0.00 H ATOM 13523 H2 WAT 5961 33.764 -0.249 153.152 1.00 0.00 H TER 13525 WAT 5961 ATOM 13525 O WAT 5962 47.496 91.662 131.543 1.00 0.00 O ATOM 13526 H1 WAT 5962 47.607 90.980 130.881 1.00 0.00 H ATOM 13527 H2 WAT 5962 47.275 92.448 131.043 1.00 0.00 H TER 13529 WAT 5962 ATOM 13529 O WAT 5963 85.311 33.253 136.623 1.00 0.00 O ATOM 13530 H1 WAT 5963 85.814 33.310 135.811 1.00 0.00 H ATOM 13531 H2 WAT 5963 84.770 34.042 136.626 1.00 0.00 H TER 13533 WAT 5963 ATOM 13533 O WAT 5964 10.608 112.963 55.746 1.00 0.00 O ATOM 13534 H1 WAT 5964 10.869 112.535 56.561 1.00 0.00 H ATOM 13535 H2 WAT 5964 9.667 113.111 55.844 1.00 0.00 H TER 13537 WAT 5964 ATOM 13537 O WAT 5965 5.340 113.119 116.159 1.00 0.00 O ATOM 13538 H1 WAT 5965 5.276 112.302 115.665 1.00 0.00 H ATOM 13539 H2 WAT 5965 6.031 112.958 116.801 1.00 0.00 H TER 13541 WAT 5965 ATOM 13541 O WAT 5966 140.345 6.618 139.740 1.00 0.00 O ATOM 13542 H1 WAT 5966 140.343 7.557 139.552 1.00 0.00 H ATOM 13543 H2 WAT 5966 139.748 6.521 140.482 1.00 0.00 H TER 13545 WAT 5966 ATOM 13545 O WAT 5967 110.862 117.185 142.346 1.00 0.00 O ATOM 13546 H1 WAT 5967 111.698 117.033 142.787 1.00 0.00 H ATOM 13547 H2 WAT 5967 110.860 118.122 142.151 1.00 0.00 H TER 13549 WAT 5967 ATOM 13549 O WAT 5968 29.799 76.504 107.693 1.00 0.00 O ATOM 13550 H1 WAT 5968 29.235 76.312 108.442 1.00 0.00 H ATOM 13551 H2 WAT 5968 29.237 76.989 107.088 1.00 0.00 H TER 13553 WAT 5968 ATOM 13553 O WAT 5969 3.880 46.781 112.778 1.00 0.00 O ATOM 13554 H1 WAT 5969 4.153 46.078 112.188 1.00 0.00 H ATOM 13555 H2 WAT 5969 3.063 47.107 112.399 1.00 0.00 H TER 13557 WAT 5969 ATOM 13557 O WAT 5970 94.627 130.885 86.788 1.00 0.00 O ATOM 13558 H1 WAT 5970 95.380 130.498 86.342 1.00 0.00 H ATOM 13559 H2 WAT 5970 94.159 131.359 86.100 1.00 0.00 H TER 13561 WAT 5970 ATOM 13561 O WAT 5971 93.630 1.236 99.519 1.00 0.00 O ATOM 13562 H1 WAT 5971 94.053 0.991 100.342 1.00 0.00 H ATOM 13563 H2 WAT 5971 94.155 1.965 99.188 1.00 0.00 H TER 13565 WAT 5971 ATOM 13565 O WAT 5972 62.943 57.912 148.194 1.00 0.00 O ATOM 13566 H1 WAT 5972 62.130 57.492 148.476 1.00 0.00 H ATOM 13567 H2 WAT 5972 63.198 57.435 147.405 1.00 0.00 H TER 13569 WAT 5972 ATOM 13569 O WAT 5973 109.209 37.625 142.943 1.00 0.00 O ATOM 13570 H1 WAT 5973 109.235 36.680 143.093 1.00 0.00 H ATOM 13571 H2 WAT 5973 108.318 37.794 142.638 1.00 0.00 H TER 13573 WAT 5973 ATOM 13573 O WAT 5974 95.111 136.328 104.286 1.00 0.00 O ATOM 13574 H1 WAT 5974 95.770 136.522 103.619 1.00 0.00 H ATOM 13575 H2 WAT 5974 94.342 136.049 103.789 1.00 0.00 H TER 13577 WAT 5974 ATOM 13577 O WAT 5975 141.323 31.713 95.174 1.00 0.00 O ATOM 13578 H1 WAT 5975 140.666 32.408 95.229 1.00 0.00 H ATOM 13579 H2 WAT 5975 141.284 31.279 96.027 1.00 0.00 H TER 13581 WAT 5975 ATOM 13581 O WAT 5976 136.015 106.834 98.088 1.00 0.00 O ATOM 13582 H1 WAT 5976 136.261 107.394 97.352 1.00 0.00 H ATOM 13583 H2 WAT 5976 135.530 106.112 97.688 1.00 0.00 H TER 13585 WAT 5976 ATOM 13585 O WAT 5977 141.704 102.428 147.461 1.00 0.00 O ATOM 13586 H1 WAT 5977 141.560 101.611 147.938 1.00 0.00 H ATOM 13587 H2 WAT 5977 140.954 102.976 147.692 1.00 0.00 H TER 13589 WAT 5977 ATOM 13589 O WAT 5978 103.034 73.171 83.766 1.00 0.00 O ATOM 13590 H1 WAT 5978 102.920 73.767 83.026 1.00 0.00 H ATOM 13591 H2 WAT 5978 102.962 72.297 83.382 1.00 0.00 H TER 13593 WAT 5978 ATOM 13593 O WAT 5979 22.663 120.360 147.326 1.00 0.00 O ATOM 13594 H1 WAT 5979 21.738 120.265 147.097 1.00 0.00 H ATOM 13595 H2 WAT 5979 22.701 120.151 148.259 1.00 0.00 H TER 13597 WAT 5979 ATOM 13597 O WAT 5980 143.886 2.090 129.491 1.00 0.00 O ATOM 13598 H1 WAT 5980 143.580 1.214 129.254 1.00 0.00 H ATOM 13599 H2 WAT 5980 143.537 2.660 128.806 1.00 0.00 H TER 13601 WAT 5980 ATOM 13601 O WAT 5981 55.388 69.109 81.262 1.00 0.00 O ATOM 13602 H1 WAT 5981 55.446 69.224 82.211 1.00 0.00 H ATOM 13603 H2 WAT 5981 54.665 69.678 80.996 1.00 0.00 H TER 13605 WAT 5981 ATOM 13605 O WAT 5982 49.947 47.828 158.374 1.00 0.00 O ATOM 13606 H1 WAT 5982 50.025 48.617 157.838 1.00 0.00 H ATOM 13607 H2 WAT 5982 49.173 47.381 158.031 1.00 0.00 H TER 13609 WAT 5982 ATOM 13609 O WAT 5983 131.638 8.435 97.746 1.00 0.00 O ATOM 13610 H1 WAT 5983 132.147 8.754 97.001 1.00 0.00 H ATOM 13611 H2 WAT 5983 131.402 7.538 97.510 1.00 0.00 H TER 13613 WAT 5983 ATOM 13613 O WAT 5984 98.805 91.817 148.222 1.00 0.00 O ATOM 13614 H1 WAT 5984 99.702 91.599 148.474 1.00 0.00 H ATOM 13615 H2 WAT 5984 98.266 91.157 148.658 1.00 0.00 H TER 13617 WAT 5984 ATOM 13617 O WAT 5985 139.492 47.629 100.563 1.00 0.00 O ATOM 13618 H1 WAT 5985 139.510 48.577 100.433 1.00 0.00 H ATOM 13619 H2 WAT 5985 140.390 47.402 100.802 1.00 0.00 H TER 13621 WAT 5985 ATOM 13621 O WAT 5986 80.137 130.660 58.527 1.00 0.00 O ATOM 13622 H1 WAT 5986 80.147 131.479 59.022 1.00 0.00 H ATOM 13623 H2 WAT 5986 79.358 130.200 58.841 1.00 0.00 H TER 13625 WAT 5986 ATOM 13625 O WAT 5987 99.317 41.376 146.144 1.00 0.00 O ATOM 13626 H1 WAT 5987 99.955 41.541 145.449 1.00 0.00 H ATOM 13627 H2 WAT 5987 99.770 41.627 146.949 1.00 0.00 H TER 13629 WAT 5987 ATOM 13629 O WAT 5988 73.855 6.723 112.418 1.00 0.00 O ATOM 13630 H1 WAT 5988 74.793 6.821 112.586 1.00 0.00 H ATOM 13631 H2 WAT 5988 73.730 5.781 112.304 1.00 0.00 H TER 13633 WAT 5988 ATOM 13633 O WAT 5989 11.538 119.461 63.858 1.00 0.00 O ATOM 13634 H1 WAT 5989 12.187 119.250 64.529 1.00 0.00 H ATOM 13635 H2 WAT 5989 11.344 118.622 63.440 1.00 0.00 H TER 13637 WAT 5989 ATOM 13637 O WAT 5990 86.441 5.580 96.866 1.00 0.00 O ATOM 13638 H1 WAT 5990 86.337 4.691 96.524 1.00 0.00 H ATOM 13639 H2 WAT 5990 85.922 6.126 96.275 1.00 0.00 H TER 13641 WAT 5990 ATOM 13641 O WAT 5991 100.806 44.636 4.783 1.00 0.00 O ATOM 13642 H1 WAT 5991 100.743 44.901 5.700 1.00 0.00 H ATOM 13643 H2 WAT 5991 101.666 44.221 4.711 1.00 0.00 H TER 13645 WAT 5991 ATOM 13645 O WAT 5992 133.787 18.728 64.238 1.00 0.00 O ATOM 13646 H1 WAT 5992 133.365 18.723 63.379 1.00 0.00 H ATOM 13647 H2 WAT 5992 134.031 19.643 64.380 1.00 0.00 H TER 13649 WAT 5992 ATOM 13649 O WAT 5993 84.670 116.128 78.901 1.00 0.00 O ATOM 13650 H1 WAT 5993 84.244 115.274 78.827 1.00 0.00 H ATOM 13651 H2 WAT 5993 85.258 116.038 79.651 1.00 0.00 H TER 13653 WAT 5993 ATOM 13653 O WAT 5994 142.421 18.123 6.868 1.00 0.00 O ATOM 13654 H1 WAT 5994 143.184 17.932 6.322 1.00 0.00 H ATOM 13655 H2 WAT 5994 141.829 17.387 6.718 1.00 0.00 H TER 13657 WAT 5994 ATOM 13657 O WAT 5995 38.056 103.272 13.121 1.00 0.00 O ATOM 13658 H1 WAT 5995 38.618 104.017 13.334 1.00 0.00 H ATOM 13659 H2 WAT 5995 38.482 102.523 13.539 1.00 0.00 H TER 13661 WAT 5995 ATOM 13661 O WAT 5996 40.331 12.730 134.289 1.00 0.00 O ATOM 13662 H1 WAT 5996 41.108 12.404 134.744 1.00 0.00 H ATOM 13663 H2 WAT 5996 40.676 13.173 133.514 1.00 0.00 H TER 13665 WAT 5996 ATOM 13665 O WAT 5997 96.126 142.751 93.063 1.00 0.00 O ATOM 13666 H1 WAT 5997 96.200 142.990 93.987 1.00 0.00 H ATOM 13667 H2 WAT 5997 95.511 142.018 93.053 1.00 0.00 H TER 13669 WAT 5997 ATOM 13669 O WAT 5998 38.514 115.559 134.877 1.00 0.00 O ATOM 13670 H1 WAT 5998 38.894 114.812 135.339 1.00 0.00 H ATOM 13671 H2 WAT 5998 37.590 115.333 134.775 1.00 0.00 H TER 13673 WAT 5998 ATOM 13673 O WAT 5999 30.320 2.875 102.754 1.00 0.00 O ATOM 13674 H1 WAT 5999 30.129 3.110 101.846 1.00 0.00 H ATOM 13675 H2 WAT 5999 30.525 1.941 102.721 1.00 0.00 H TER 13677 WAT 5999 ATOM 13677 O WAT 6000 74.484 22.240 4.706 1.00 0.00 O ATOM 13678 H1 WAT 6000 74.837 22.901 5.301 1.00 0.00 H ATOM 13679 H2 WAT 6000 73.597 22.077 5.028 1.00 0.00 H TER 13681 WAT 6000 ATOM 13681 O WAT 6001 67.056 133.003 1.382 1.00 0.00 O ATOM 13682 H1 WAT 6001 66.781 132.271 1.933 1.00 0.00 H ATOM 13683 H2 WAT 6001 67.231 132.609 0.528 1.00 0.00 H TER 13685 WAT 6001 ATOM 13685 O WAT 6002 100.254 21.683 114.039 1.00 0.00 O ATOM 13686 H1 WAT 6002 100.617 21.951 113.195 1.00 0.00 H ATOM 13687 H2 WAT 6002 100.951 21.867 114.669 1.00 0.00 H TER 13689 WAT 6002 ATOM 13689 O WAT 6003 131.185 99.560 26.243 1.00 0.00 O ATOM 13690 H1 WAT 6003 131.175 100.176 26.976 1.00 0.00 H ATOM 13691 H2 WAT 6003 131.907 99.857 25.689 1.00 0.00 H TER 13693 WAT 6003 ATOM 13693 O WAT 6004 95.074 112.082 123.974 1.00 0.00 O ATOM 13694 H1 WAT 6004 95.225 112.979 124.274 1.00 0.00 H ATOM 13695 H2 WAT 6004 94.987 111.572 124.779 1.00 0.00 H TER 13697 WAT 6004 ATOM 13697 O WAT 6005 118.402 133.863 96.842 1.00 0.00 O ATOM 13698 H1 WAT 6005 117.941 133.031 96.730 1.00 0.00 H ATOM 13699 H2 WAT 6005 117.742 134.530 96.656 1.00 0.00 H TER 13701 WAT 6005 ATOM 13701 O WAT 6006 63.929 1.311 154.915 1.00 0.00 O ATOM 13702 H1 WAT 6006 63.074 1.615 154.611 1.00 0.00 H ATOM 13703 H2 WAT 6006 64.068 0.484 154.453 1.00 0.00 H TER 13705 WAT 6006 ATOM 13705 O WAT 6007 58.232 47.408 105.455 1.00 0.00 O ATOM 13706 H1 WAT 6007 58.927 46.761 105.573 1.00 0.00 H ATOM 13707 H2 WAT 6007 58.425 48.087 106.102 1.00 0.00 H TER 13709 WAT 6007 ATOM 13709 O WAT 6008 119.938 58.263 13.433 1.00 0.00 O ATOM 13710 H1 WAT 6008 120.282 57.566 13.991 1.00 0.00 H ATOM 13711 H2 WAT 6008 119.614 58.923 14.045 1.00 0.00 H TER 13713 WAT 6008 ATOM 13713 O WAT 6009 24.202 98.138 81.593 1.00 0.00 O ATOM 13714 H1 WAT 6009 23.823 98.765 80.976 1.00 0.00 H ATOM 13715 H2 WAT 6009 23.953 98.471 82.455 1.00 0.00 H TER 13717 WAT 6009 ATOM 13717 O WAT 6010 57.998 20.438 91.740 1.00 0.00 O ATOM 13718 H1 WAT 6010 57.176 20.478 91.252 1.00 0.00 H ATOM 13719 H2 WAT 6010 57.740 20.171 92.622 1.00 0.00 H TER 13721 WAT 6010 ATOM 13721 O WAT 6011 34.771 64.136 92.125 1.00 0.00 O ATOM 13722 H1 WAT 6011 34.386 63.751 91.338 1.00 0.00 H ATOM 13723 H2 WAT 6011 35.700 63.911 92.071 1.00 0.00 H TER 13725 WAT 6011 ATOM 13725 O WAT 6012 99.745 90.797 91.051 1.00 0.00 O ATOM 13726 H1 WAT 6012 99.215 90.001 91.013 1.00 0.00 H ATOM 13727 H2 WAT 6012 99.682 91.083 91.963 1.00 0.00 H TER 13729 WAT 6012 ATOM 13729 O WAT 6013 12.538 133.646 89.590 1.00 0.00 O ATOM 13730 H1 WAT 6013 12.394 133.477 90.521 1.00 0.00 H ATOM 13731 H2 WAT 6013 12.902 132.829 89.251 1.00 0.00 H TER 13733 WAT 6013 ATOM 13733 O WAT 6014 104.007 46.773 113.116 1.00 0.00 O ATOM 13734 H1 WAT 6014 103.851 47.711 113.223 1.00 0.00 H ATOM 13735 H2 WAT 6014 103.386 46.502 112.440 1.00 0.00 H TER 13737 WAT 6014 ATOM 13737 O WAT 6015 105.190 3.624 127.645 1.00 0.00 O ATOM 13738 H1 WAT 6015 105.550 3.459 128.516 1.00 0.00 H ATOM 13739 H2 WAT 6015 105.954 3.639 127.069 1.00 0.00 H TER 13741 WAT 6015 ATOM 13741 O WAT 6016 0.601 6.066 14.729 1.00 0.00 O ATOM 13742 H1 WAT 6016 0.417 5.660 13.882 1.00 0.00 H ATOM 13743 H2 WAT 6016 -0.126 6.672 14.868 1.00 0.00 H TER 13745 WAT 6016 ATOM 13745 O WAT 6017 48.263 132.468 88.111 1.00 0.00 O ATOM 13746 H1 WAT 6017 48.517 131.852 87.425 1.00 0.00 H ATOM 13747 H2 WAT 6017 47.643 131.980 88.654 1.00 0.00 H TER 13749 WAT 6017 ATOM 13749 O WAT 6018 62.326 9.126 134.496 1.00 0.00 O ATOM 13750 H1 WAT 6018 61.981 9.955 134.163 1.00 0.00 H ATOM 13751 H2 WAT 6018 61.667 8.477 134.251 1.00 0.00 H TER 13753 WAT 6018 ATOM 13753 O WAT 6019 28.526 120.285 5.509 1.00 0.00 O ATOM 13754 H1 WAT 6019 27.728 120.228 4.983 1.00 0.00 H ATOM 13755 H2 WAT 6019 29.206 120.539 4.885 1.00 0.00 H TER 13757 WAT 6019 ATOM 13757 O WAT 6020 66.818 11.726 72.049 1.00 0.00 O ATOM 13758 H1 WAT 6020 67.212 11.305 72.813 1.00 0.00 H ATOM 13759 H2 WAT 6020 67.561 12.090 71.566 1.00 0.00 H TER 13761 WAT 6020 ATOM 13761 O WAT 6021 94.206 35.793 27.820 1.00 0.00 O ATOM 13762 H1 WAT 6021 95.049 35.408 28.062 1.00 0.00 H ATOM 13763 H2 WAT 6021 94.395 36.312 27.038 1.00 0.00 H TER 13765 WAT 6021 ATOM 13765 O WAT 6022 143.494 91.353 108.858 1.00 0.00 O ATOM 13766 H1 WAT 6022 144.208 90.766 108.608 1.00 0.00 H ATOM 13767 H2 WAT 6022 143.744 91.679 109.723 1.00 0.00 H TER 13769 WAT 6022 ATOM 13769 O WAT 6023 94.830 54.722 66.553 1.00 0.00 O ATOM 13770 H1 WAT 6023 94.865 54.581 67.500 1.00 0.00 H ATOM 13771 H2 WAT 6023 95.299 55.545 66.416 1.00 0.00 H TER 13773 WAT 6023 ATOM 13773 O WAT 6024 72.923 63.951 88.428 1.00 0.00 O ATOM 13774 H1 WAT 6024 72.166 63.464 88.102 1.00 0.00 H ATOM 13775 H2 WAT 6024 72.564 64.527 89.103 1.00 0.00 H TER 13777 WAT 6024 ATOM 13777 O WAT 6025 41.193 35.993 135.030 1.00 0.00 O ATOM 13778 H1 WAT 6025 41.291 35.189 135.541 1.00 0.00 H ATOM 13779 H2 WAT 6025 40.269 36.225 135.123 1.00 0.00 H TER 13781 WAT 6025 ATOM 13781 O WAT 6026 78.991 143.148 68.483 1.00 0.00 O ATOM 13782 H1 WAT 6026 79.264 142.638 69.245 1.00 0.00 H ATOM 13783 H2 WAT 6026 78.618 143.949 68.852 1.00 0.00 H TER 13785 WAT 6026 ATOM 13785 O WAT 6027 93.942 77.136 114.561 1.00 0.00 O ATOM 13786 H1 WAT 6027 92.998 77.293 114.554 1.00 0.00 H ATOM 13787 H2 WAT 6027 94.327 77.976 114.309 1.00 0.00 H TER 13789 WAT 6027 ATOM 13789 O WAT 6028 28.562 43.481 52.655 1.00 0.00 O ATOM 13790 H1 WAT 6028 28.778 44.321 52.248 1.00 0.00 H ATOM 13791 H2 WAT 6028 29.389 43.001 52.667 1.00 0.00 H TER 13793 WAT 6028 ATOM 13793 O WAT 6029 6.824 91.596 139.689 1.00 0.00 O ATOM 13794 H1 WAT 6029 5.942 91.884 139.453 1.00 0.00 H ATOM 13795 H2 WAT 6029 7.008 90.873 139.090 1.00 0.00 H TER 13797 WAT 6029 ATOM 13797 O WAT 6030 73.993 71.031 74.781 1.00 0.00 O ATOM 13798 H1 WAT 6030 73.992 71.968 74.587 1.00 0.00 H ATOM 13799 H2 WAT 6030 74.359 70.969 75.663 1.00 0.00 H TER 13801 WAT 6030 ATOM 13801 O WAT 6031 99.610 72.612 60.668 1.00 0.00 O ATOM 13802 H1 WAT 6031 100.044 72.533 61.517 1.00 0.00 H ATOM 13803 H2 WAT 6031 99.071 73.399 60.746 1.00 0.00 H TER 13805 WAT 6031 ATOM 13805 O WAT 6032 96.305 2.344 131.065 1.00 0.00 O ATOM 13806 H1 WAT 6032 96.174 1.400 130.982 1.00 0.00 H ATOM 13807 H2 WAT 6032 95.537 2.731 130.646 1.00 0.00 H TER 13809 WAT 6032 ATOM 13809 O WAT 6033 57.443 88.187 79.671 1.00 0.00 O ATOM 13810 H1 WAT 6033 57.952 88.620 78.985 1.00 0.00 H ATOM 13811 H2 WAT 6033 56.932 88.890 80.071 1.00 0.00 H TER 13813 WAT 6033 ATOM 13813 O WAT 6034 128.604 95.132 86.829 1.00 0.00 O ATOM 13814 H1 WAT 6034 127.664 95.300 86.767 1.00 0.00 H ATOM 13815 H2 WAT 6034 128.672 94.341 87.363 1.00 0.00 H TER 13817 WAT 6034 ATOM 13817 O WAT 6035 89.127 5.000 121.707 1.00 0.00 O ATOM 13818 H1 WAT 6035 88.631 4.921 122.522 1.00 0.00 H ATOM 13819 H2 WAT 6035 88.950 5.890 121.404 1.00 0.00 H TER 13821 WAT 6035 ATOM 13821 O WAT 6036 57.557 74.096 110.055 1.00 0.00 O ATOM 13822 H1 WAT 6036 56.936 74.571 110.607 1.00 0.00 H ATOM 13823 H2 WAT 6036 58.086 73.590 110.671 1.00 0.00 H TER 13825 WAT 6036 ATOM 13825 O WAT 6037 67.253 36.785 13.909 1.00 0.00 O ATOM 13826 H1 WAT 6037 67.609 36.269 14.632 1.00 0.00 H ATOM 13827 H2 WAT 6037 66.459 36.319 13.650 1.00 0.00 H TER 13829 WAT 6037 ATOM 13829 O WAT 6038 15.853 124.730 102.290 1.00 0.00 O ATOM 13830 H1 WAT 6038 16.203 124.571 103.167 1.00 0.00 H ATOM 13831 H2 WAT 6038 16.626 124.886 101.748 1.00 0.00 H TER 13833 WAT 6038 ATOM 13833 O WAT 6039 0.817 15.594 157.609 1.00 0.00 O ATOM 13834 H1 WAT 6039 0.686 14.714 157.258 1.00 0.00 H ATOM 13835 H2 WAT 6039 1.138 16.104 156.865 1.00 0.00 H TER 13837 WAT 6039 ATOM 13837 O WAT 6040 60.873 123.545 91.913 1.00 0.00 O ATOM 13838 H1 WAT 6040 60.322 123.221 92.625 1.00 0.00 H ATOM 13839 H2 WAT 6040 60.385 123.334 91.117 1.00 0.00 H TER 13841 WAT 6040 ATOM 13841 O WAT 6041 96.914 27.988 81.507 1.00 0.00 O ATOM 13842 H1 WAT 6041 96.123 28.095 80.979 1.00 0.00 H ATOM 13843 H2 WAT 6041 97.200 27.091 81.331 1.00 0.00 H TER 13845 WAT 6041 ATOM 13845 O WAT 6042 44.117 77.629 109.390 1.00 0.00 O ATOM 13846 H1 WAT 6042 43.926 76.765 109.755 1.00 0.00 H ATOM 13847 H2 WAT 6042 43.930 78.237 110.105 1.00 0.00 H TER 13849 WAT 6042 ATOM 13849 O WAT 6043 61.834 108.744 7.661 1.00 0.00 O ATOM 13850 H1 WAT 6043 61.567 109.502 8.180 1.00 0.00 H ATOM 13851 H2 WAT 6043 62.645 108.444 8.072 1.00 0.00 H TER 13853 WAT 6043 ATOM 13853 O WAT 6044 112.802 75.485 83.106 1.00 0.00 O ATOM 13854 H1 WAT 6044 113.389 75.330 83.846 1.00 0.00 H ATOM 13855 H2 WAT 6044 112.665 74.618 82.724 1.00 0.00 H TER 13857 WAT 6044 ATOM 13857 O WAT 6045 67.364 11.955 94.024 1.00 0.00 O ATOM 13858 H1 WAT 6045 67.884 11.228 93.684 1.00 0.00 H ATOM 13859 H2 WAT 6045 67.969 12.441 94.584 1.00 0.00 H TER 13861 WAT 6045 ATOM 13861 O WAT 6046 50.289 46.928 125.657 1.00 0.00 O ATOM 13862 H1 WAT 6046 51.072 46.496 125.316 1.00 0.00 H ATOM 13863 H2 WAT 6046 49.788 46.224 126.070 1.00 0.00 H TER 13865 WAT 6046 ATOM 13865 O WAT 6047 80.577 77.094 150.784 1.00 0.00 O ATOM 13866 H1 WAT 6047 81.350 76.784 151.256 1.00 0.00 H ATOM 13867 H2 WAT 6047 80.523 78.026 150.997 1.00 0.00 H TER 13869 WAT 6047 ATOM 13869 O WAT 6048 113.031 35.341 146.317 1.00 0.00 O ATOM 13870 H1 WAT 6048 113.488 36.091 145.935 1.00 0.00 H ATOM 13871 H2 WAT 6048 113.676 34.634 146.300 1.00 0.00 H TER 13873 WAT 6048 ATOM 13873 O WAT 6049 144.909 121.981 121.536 1.00 0.00 O ATOM 13874 H1 WAT 6049 144.458 121.421 120.903 1.00 0.00 H ATOM 13875 H2 WAT 6049 144.219 122.271 122.132 1.00 0.00 H TER 13877 WAT 6049 ATOM 13877 O WAT 6050 69.474 125.937 10.762 1.00 0.00 O ATOM 13878 H1 WAT 6050 69.733 125.052 11.016 1.00 0.00 H ATOM 13879 H2 WAT 6050 69.349 126.398 11.591 1.00 0.00 H TER 13881 WAT 6050 ATOM 13881 O WAT 6051 18.842 87.221 133.458 1.00 0.00 O ATOM 13882 H1 WAT 6051 17.896 87.303 133.574 1.00 0.00 H ATOM 13883 H2 WAT 6051 18.955 86.402 132.975 1.00 0.00 H TER 13885 WAT 6051 ATOM 13885 O WAT 6052 51.146 90.031 148.010 1.00 0.00 O ATOM 13886 H1 WAT 6052 51.483 90.541 147.274 1.00 0.00 H ATOM 13887 H2 WAT 6052 50.536 90.621 148.452 1.00 0.00 H TER 13889 WAT 6052 ATOM 13889 O WAT 6053 115.668 23.288 157.125 1.00 0.00 O ATOM 13890 H1 WAT 6053 115.987 24.162 157.348 1.00 0.00 H ATOM 13891 H2 WAT 6053 116.265 22.693 157.580 1.00 0.00 H TER 13893 WAT 6053 ATOM 13893 O WAT 6054 128.556 37.252 20.599 1.00 0.00 O ATOM 13894 H1 WAT 6054 129.161 37.984 20.720 1.00 0.00 H ATOM 13895 H2 WAT 6054 128.363 37.254 19.661 1.00 0.00 H TER 13897 WAT 6054 ATOM 13897 O WAT 6055 134.051 10.879 9.505 1.00 0.00 O ATOM 13898 H1 WAT 6055 134.075 9.922 9.524 1.00 0.00 H ATOM 13899 H2 WAT 6055 133.753 11.128 10.379 1.00 0.00 H TER 13901 WAT 6055 ATOM 13901 O WAT 6056 20.994 124.915 107.830 1.00 0.00 O ATOM 13902 H1 WAT 6056 21.571 124.346 108.338 1.00 0.00 H ATOM 13903 H2 WAT 6056 20.623 124.343 107.158 1.00 0.00 H TER 13905 WAT 6056 ATOM 13905 O WAT 6057 37.258 9.929 57.808 1.00 0.00 O ATOM 13906 H1 WAT 6057 36.677 10.332 58.453 1.00 0.00 H ATOM 13907 H2 WAT 6057 38.029 10.496 57.794 1.00 0.00 H TER 13909 WAT 6057 ATOM 13909 O WAT 6058 113.593 10.558 148.575 1.00 0.00 O ATOM 13910 H1 WAT 6058 112.921 10.114 148.058 1.00 0.00 H ATOM 13911 H2 WAT 6058 113.253 10.548 149.470 1.00 0.00 H TER 13913 WAT 6058 ATOM 13913 O WAT 6059 78.865 105.458 113.626 1.00 0.00 O ATOM 13914 H1 WAT 6059 79.670 105.499 113.109 1.00 0.00 H ATOM 13915 H2 WAT 6059 78.632 104.530 113.633 1.00 0.00 H TER 13917 WAT 6059 ATOM 13917 O WAT 6060 115.965 34.447 109.546 1.00 0.00 O ATOM 13918 H1 WAT 6060 116.564 35.185 109.432 1.00 0.00 H ATOM 13919 H2 WAT 6060 115.224 34.812 110.029 1.00 0.00 H TER 13921 WAT 6060 ATOM 13921 O WAT 6061 104.902 135.380 64.345 1.00 0.00 O ATOM 13922 H1 WAT 6061 105.332 134.732 63.787 1.00 0.00 H ATOM 13923 H2 WAT 6061 104.052 134.991 64.552 1.00 0.00 H TER 13925 WAT 6061 ATOM 13925 O WAT 6062 101.880 126.593 102.293 1.00 0.00 O ATOM 13926 H1 WAT 6062 101.378 126.093 102.936 1.00 0.00 H ATOM 13927 H2 WAT 6062 102.204 127.351 102.779 1.00 0.00 H TER 13929 WAT 6062 ATOM 13929 O WAT 6063 75.905 32.142 119.469 1.00 0.00 O ATOM 13930 H1 WAT 6063 76.282 32.267 120.340 1.00 0.00 H ATOM 13931 H2 WAT 6063 76.233 32.883 118.958 1.00 0.00 H TER 13933 WAT 6063 ATOM 13933 O WAT 6064 67.537 123.023 112.291 1.00 0.00 O ATOM 13934 H1 WAT 6064 67.578 123.281 111.370 1.00 0.00 H ATOM 13935 H2 WAT 6064 68.317 123.415 112.684 1.00 0.00 H TER 13937 WAT 6064 ATOM 13937 O WAT 6065 62.023 140.608 65.911 1.00 0.00 O ATOM 13938 H1 WAT 6065 62.273 140.215 66.748 1.00 0.00 H ATOM 13939 H2 WAT 6065 61.212 140.161 65.670 1.00 0.00 H TER 13941 WAT 6065 ATOM 13941 O WAT 6066 119.810 61.929 96.080 1.00 0.00 O ATOM 13942 H1 WAT 6066 120.682 62.304 95.953 1.00 0.00 H ATOM 13943 H2 WAT 6066 119.416 61.938 95.208 1.00 0.00 H TER 13945 WAT 6066 ATOM 13945 O WAT 6067 120.407 97.807 132.594 1.00 0.00 O ATOM 13946 H1 WAT 6067 121.162 97.695 132.016 1.00 0.00 H ATOM 13947 H2 WAT 6067 119.674 97.973 132.001 1.00 0.00 H TER 13949 WAT 6067 ATOM 13949 O WAT 6068 21.673 28.063 119.462 1.00 0.00 O ATOM 13950 H1 WAT 6068 22.077 28.591 120.151 1.00 0.00 H ATOM 13951 H2 WAT 6068 21.592 27.190 119.846 1.00 0.00 H TER 13953 WAT 6068 ATOM 13953 O WAT 6069 116.248 58.693 103.309 1.00 0.00 O ATOM 13954 H1 WAT 6069 116.488 57.834 103.655 1.00 0.00 H ATOM 13955 H2 WAT 6069 115.506 58.520 102.730 1.00 0.00 H TER 13957 WAT 6069 ATOM 13957 O WAT 6070 131.412 87.117 133.927 1.00 0.00 O ATOM 13958 H1 WAT 6070 131.671 86.349 133.417 1.00 0.00 H ATOM 13959 H2 WAT 6070 131.186 86.766 134.789 1.00 0.00 H TER 13961 WAT 6070 ATOM 13961 O WAT 6071 66.979 133.989 144.823 1.00 0.00 O ATOM 13962 H1 WAT 6071 66.668 134.501 145.569 1.00 0.00 H ATOM 13963 H2 WAT 6071 66.561 133.134 144.928 1.00 0.00 H TER 13965 WAT 6071 ATOM 13965 O WAT 6072 6.516 133.092 10.280 1.00 0.00 O ATOM 13966 H1 WAT 6072 6.663 133.755 10.955 1.00 0.00 H ATOM 13967 H2 WAT 6072 5.952 133.524 9.639 1.00 0.00 H TER 13969 WAT 6072 ATOM 13969 O WAT 6073 101.027 0.263 102.467 1.00 0.00 O ATOM 13970 H1 WAT 6073 101.777 0.500 103.013 1.00 0.00 H ATOM 13971 H2 WAT 6073 100.908 1.014 101.885 1.00 0.00 H TER 13973 WAT 6073 ATOM 13973 O WAT 6074 8.296 120.742 119.098 1.00 0.00 O ATOM 13974 H1 WAT 6074 7.427 121.034 118.820 1.00 0.00 H ATOM 13975 H2 WAT 6074 8.161 119.843 119.398 1.00 0.00 H TER 13977 WAT 6074 ATOM 13977 O WAT 6075 34.998 47.473 72.372 1.00 0.00 O ATOM 13978 H1 WAT 6075 35.402 46.852 72.978 1.00 0.00 H ATOM 13979 H2 WAT 6075 34.442 46.933 71.810 1.00 0.00 H TER 13981 WAT 6075 ATOM 13981 O WAT 6076 118.933 1.878 9.949 1.00 0.00 O ATOM 13982 H1 WAT 6076 118.620 1.664 10.828 1.00 0.00 H ATOM 13983 H2 WAT 6076 119.611 2.539 10.091 1.00 0.00 H TER 13985 WAT 6076 ATOM 13985 O WAT 6077 8.985 24.306 78.065 1.00 0.00 O ATOM 13986 H1 WAT 6077 8.177 24.120 77.588 1.00 0.00 H ATOM 13987 H2 WAT 6077 8.944 25.244 78.250 1.00 0.00 H TER 13989 WAT 6077 ATOM 13989 O WAT 6078 8.539 135.241 56.023 1.00 0.00 O ATOM 13990 H1 WAT 6078 8.784 135.416 56.931 1.00 0.00 H ATOM 13991 H2 WAT 6078 7.722 134.746 56.086 1.00 0.00 H TER 13993 WAT 6078 ATOM 13993 O WAT 6079 107.098 122.741 75.469 1.00 0.00 O ATOM 13994 H1 WAT 6079 106.445 122.590 74.786 1.00 0.00 H ATOM 13995 H2 WAT 6079 106.664 123.327 76.090 1.00 0.00 H TER 13997 WAT 6079 ATOM 13997 O WAT 6080 47.268 99.548 139.749 1.00 0.00 O ATOM 13998 H1 WAT 6080 46.471 100.052 139.911 1.00 0.00 H ATOM 13999 H2 WAT 6080 46.957 98.712 139.401 1.00 0.00 H TER 14001 WAT 6080 ATOM 14001 O WAT 6081 78.610 87.809 119.658 1.00 0.00 O ATOM 14002 H1 WAT 6081 79.426 87.686 120.142 1.00 0.00 H ATOM 14003 H2 WAT 6081 78.815 88.483 119.010 1.00 0.00 H TER 14005 WAT 6081 ATOM 14005 O WAT 6082 91.358 36.016 98.827 1.00 0.00 O ATOM 14006 H1 WAT 6082 91.486 36.011 97.879 1.00 0.00 H ATOM 14007 H2 WAT 6082 90.409 35.962 98.941 1.00 0.00 H TER 14009 WAT 6082 ATOM 14009 O WAT 6083 39.149 23.609 130.321 1.00 0.00 O ATOM 14010 H1 WAT 6083 39.021 24.060 131.156 1.00 0.00 H ATOM 14011 H2 WAT 6083 39.350 24.308 129.699 1.00 0.00 H TER 14013 WAT 6083 ATOM 14013 O WAT 6084 7.999 62.239 89.823 1.00 0.00 O ATOM 14014 H1 WAT 6084 8.832 62.483 89.419 1.00 0.00 H ATOM 14015 H2 WAT 6084 8.022 62.650 90.688 1.00 0.00 H TER 14017 WAT 6084 ATOM 14017 O WAT 6085 72.120 97.672 156.293 1.00 0.00 O ATOM 14018 H1 WAT 6085 72.157 96.743 156.065 1.00 0.00 H ATOM 14019 H2 WAT 6085 72.165 98.126 155.451 1.00 0.00 H TER 14021 WAT 6085 ATOM 14021 O WAT 6086 48.784 16.865 69.640 1.00 0.00 O ATOM 14022 H1 WAT 6086 48.061 16.945 70.263 1.00 0.00 H ATOM 14023 H2 WAT 6086 48.364 16.609 68.819 1.00 0.00 H TER 14025 WAT 6086 ATOM 14025 O WAT 6087 80.246 30.762 9.086 1.00 0.00 O ATOM 14026 H1 WAT 6087 80.135 30.786 8.135 1.00 0.00 H ATOM 14027 H2 WAT 6087 80.481 29.854 9.277 1.00 0.00 H TER 14029 WAT 6087 ATOM 14029 O WAT 6088 35.261 73.925 15.460 1.00 0.00 O ATOM 14030 H1 WAT 6088 35.421 74.288 16.331 1.00 0.00 H ATOM 14031 H2 WAT 6088 35.081 74.688 14.911 1.00 0.00 H TER 14033 WAT 6088 ATOM 14033 O WAT 6089 15.487 44.458 134.392 1.00 0.00 O ATOM 14034 H1 WAT 6089 14.765 44.112 133.868 1.00 0.00 H ATOM 14035 H2 WAT 6089 15.135 44.508 135.281 1.00 0.00 H TER 14037 WAT 6089 ATOM 14037 O WAT 6090 136.800 30.279 66.544 1.00 0.00 O ATOM 14038 H1 WAT 6090 137.231 30.834 65.893 1.00 0.00 H ATOM 14039 H2 WAT 6090 136.456 29.542 66.040 1.00 0.00 H TER 14041 WAT 6090 ATOM 14041 O WAT 6091 109.659 65.017 7.084 1.00 0.00 O ATOM 14042 H1 WAT 6091 110.130 65.044 6.251 1.00 0.00 H ATOM 14043 H2 WAT 6091 110.120 64.354 7.598 1.00 0.00 H TER 14045 WAT 6091 ATOM 14045 O WAT 6092 128.331 8.202 12.644 1.00 0.00 O ATOM 14046 H1 WAT 6092 128.113 8.868 11.992 1.00 0.00 H ATOM 14047 H2 WAT 6092 128.038 8.575 13.475 1.00 0.00 H TER 14049 WAT 6092 ATOM 14049 O WAT 6093 65.015 70.507 96.881 1.00 0.00 O ATOM 14050 H1 WAT 6093 65.853 70.083 96.695 1.00 0.00 H ATOM 14051 H2 WAT 6093 64.422 70.169 96.210 1.00 0.00 H TER 14053 WAT 6093 ATOM 14053 O WAT 6094 13.670 122.596 21.462 1.00 0.00 O ATOM 14054 H1 WAT 6094 13.927 123.381 20.979 1.00 0.00 H ATOM 14055 H2 WAT 6094 14.345 122.495 22.132 1.00 0.00 H TER 14057 WAT 6094 ATOM 14057 O WAT 6095 0.762 140.492 86.713 1.00 0.00 O ATOM 14058 H1 WAT 6095 0.612 139.753 87.303 1.00 0.00 H ATOM 14059 H2 WAT 6095 0.569 141.265 87.243 1.00 0.00 H TER 14061 WAT 6095 ATOM 14061 O WAT 6096 25.344 90.154 7.380 1.00 0.00 O ATOM 14062 H1 WAT 6096 26.167 90.352 6.933 1.00 0.00 H ATOM 14063 H2 WAT 6096 25.481 90.453 8.279 1.00 0.00 H TER 14065 WAT 6096 ATOM 14065 O WAT 6097 74.455 82.930 82.654 1.00 0.00 O ATOM 14066 H1 WAT 6097 74.617 83.541 81.935 1.00 0.00 H ATOM 14067 H2 WAT 6097 73.630 82.503 82.424 1.00 0.00 H TER 14069 WAT 6097 ATOM 14069 O WAT 6098 50.253 19.488 137.721 1.00 0.00 O ATOM 14070 H1 WAT 6098 50.319 19.089 138.588 1.00 0.00 H ATOM 14071 H2 WAT 6098 51.124 19.849 137.556 1.00 0.00 H TER 14073 WAT 6098 ATOM 14073 O WAT 6099 38.506 130.719 95.593 1.00 0.00 O ATOM 14074 H1 WAT 6099 37.824 130.834 96.256 1.00 0.00 H ATOM 14075 H2 WAT 6099 39.103 131.453 95.733 1.00 0.00 H TER 14077 WAT 6099 ATOM 14077 O WAT 6100 102.573 73.800 74.149 1.00 0.00 O ATOM 14078 H1 WAT 6100 102.198 74.292 74.880 1.00 0.00 H ATOM 14079 H2 WAT 6100 103.351 74.299 73.899 1.00 0.00 H TER 14081 WAT 6100 ATOM 14081 O WAT 6101 26.533 110.376 72.966 1.00 0.00 O ATOM 14082 H1 WAT 6101 27.340 109.964 73.275 1.00 0.00 H ATOM 14083 H2 WAT 6101 26.246 109.823 72.239 1.00 0.00 H TER 14085 WAT 6101 ATOM 14085 O WAT 6102 143.367 58.555 157.837 1.00 0.00 O ATOM 14086 H1 WAT 6102 143.022 58.700 158.718 1.00 0.00 H ATOM 14087 H2 WAT 6102 142.884 57.795 157.512 1.00 0.00 H TER 14089 WAT 6102 ATOM 14089 O WAT 6103 15.074 90.713 16.307 1.00 0.00 O ATOM 14090 H1 WAT 6103 15.255 89.774 16.269 1.00 0.00 H ATOM 14091 H2 WAT 6103 15.782 91.073 16.842 1.00 0.00 H TER 14093 WAT 6103 ATOM 14093 O WAT 6104 25.976 49.214 16.224 1.00 0.00 O ATOM 14094 H1 WAT 6104 25.871 48.323 15.890 1.00 0.00 H ATOM 14095 H2 WAT 6104 26.907 49.282 16.436 1.00 0.00 H TER 14097 WAT 6104 ATOM 14097 O WAT 6105 119.024 139.569 120.174 1.00 0.00 O ATOM 14098 H1 WAT 6105 118.977 140.523 120.243 1.00 0.00 H ATOM 14099 H2 WAT 6105 119.435 139.410 119.324 1.00 0.00 H TER 14101 WAT 6105 ATOM 14101 O WAT 6106 137.269 145.838 85.250 1.00 0.00 O ATOM 14102 H1 WAT 6106 138.125 146.055 84.881 1.00 0.00 H ATOM 14103 H2 WAT 6106 136.972 145.085 84.738 1.00 0.00 H TER 14105 WAT 6106 ATOM 14105 O WAT 6107 93.571 42.230 63.118 1.00 0.00 O ATOM 14106 H1 WAT 6107 93.745 43.162 62.986 1.00 0.00 H ATOM 14107 H2 WAT 6107 94.428 41.851 63.313 1.00 0.00 H TER 14109 WAT 6107 ATOM 14109 O WAT 6108 0.854 137.021 156.406 1.00 0.00 O ATOM 14110 H1 WAT 6108 1.128 136.824 155.510 1.00 0.00 H ATOM 14111 H2 WAT 6108 -0.051 137.321 156.320 1.00 0.00 H TER 14113 WAT 6108 ATOM 14113 O WAT 6109 132.238 108.965 13.866 1.00 0.00 O ATOM 14114 H1 WAT 6109 132.491 108.481 14.652 1.00 0.00 H ATOM 14115 H2 WAT 6109 131.284 108.885 13.833 1.00 0.00 H TER 14117 WAT 6109 ATOM 14117 O WAT 6110 128.216 96.621 123.900 1.00 0.00 O ATOM 14118 H1 WAT 6110 129.065 96.524 124.331 1.00 0.00 H ATOM 14119 H2 WAT 6110 128.368 96.325 123.002 1.00 0.00 H TER 14121 WAT 6110 ATOM 14121 O WAT 6111 66.482 63.220 79.767 1.00 0.00 O ATOM 14122 H1 WAT 6111 66.266 64.075 80.138 1.00 0.00 H ATOM 14123 H2 WAT 6111 65.997 63.188 78.942 1.00 0.00 H TER 14125 WAT 6111 ATOM 14125 O WAT 6112 111.265 64.433 10.593 1.00 0.00 O ATOM 14126 H1 WAT 6112 111.698 64.343 9.744 1.00 0.00 H ATOM 14127 H2 WAT 6112 110.728 65.220 10.505 1.00 0.00 H TER 14129 WAT 6112 ATOM 14129 O WAT 6113 115.749 40.461 152.388 1.00 0.00 O ATOM 14130 H1 WAT 6113 116.314 39.735 152.652 1.00 0.00 H ATOM 14131 H2 WAT 6113 114.871 40.191 152.659 1.00 0.00 H TER 14133 WAT 6113 ATOM 14133 O WAT 6114 10.050 114.475 112.818 1.00 0.00 O ATOM 14134 H1 WAT 6114 10.673 115.184 112.659 1.00 0.00 H ATOM 14135 H2 WAT 6114 9.629 114.331 111.971 1.00 0.00 H TER 14137 WAT 6114 ATOM 14137 O WAT 6115 126.436 3.780 93.749 1.00 0.00 O ATOM 14138 H1 WAT 6115 126.182 4.593 94.187 1.00 0.00 H ATOM 14139 H2 WAT 6115 126.865 4.066 92.942 1.00 0.00 H TER 14141 WAT 6115 ATOM 14141 O WAT 6116 71.123 5.137 141.394 1.00 0.00 O ATOM 14142 H1 WAT 6116 70.222 5.394 141.592 1.00 0.00 H ATOM 14143 H2 WAT 6116 71.605 5.963 141.360 1.00 0.00 H TER 14145 WAT 6116 ATOM 14145 O WAT 6117 17.348 34.704 72.540 1.00 0.00 O ATOM 14146 H1 WAT 6117 16.488 34.351 72.314 1.00 0.00 H ATOM 14147 H2 WAT 6117 17.544 34.328 73.398 1.00 0.00 H TER 14149 WAT 6117 ATOM 14149 O WAT 6118 115.849 17.213 57.192 1.00 0.00 O ATOM 14150 H1 WAT 6118 116.219 18.027 57.535 1.00 0.00 H ATOM 14151 H2 WAT 6118 116.364 17.028 56.407 1.00 0.00 H TER 14153 WAT 6118 ATOM 14153 O WAT 6119 11.107 15.912 152.113 1.00 0.00 O ATOM 14154 H1 WAT 6119 11.780 15.468 151.596 1.00 0.00 H ATOM 14155 H2 WAT 6119 10.886 16.689 151.599 1.00 0.00 H TER 14157 WAT 6119 ATOM 14157 O WAT 6120 113.286 45.526 14.372 1.00 0.00 O ATOM 14158 H1 WAT 6120 112.831 46.098 13.754 1.00 0.00 H ATOM 14159 H2 WAT 6120 113.526 46.101 15.099 1.00 0.00 H TER 14161 WAT 6120 ATOM 14161 O WAT 6121 109.887 51.967 113.326 1.00 0.00 O ATOM 14162 H1 WAT 6121 110.391 52.484 112.697 1.00 0.00 H ATOM 14163 H2 WAT 6121 110.525 51.715 113.995 1.00 0.00 H TER 14165 WAT 6121 ATOM 14165 O WAT 6122 21.665 131.743 123.996 1.00 0.00 O ATOM 14166 H1 WAT 6122 20.714 131.652 124.048 1.00 0.00 H ATOM 14167 H2 WAT 6122 21.972 130.885 123.703 1.00 0.00 H TER 14169 WAT 6122 ATOM 14169 O WAT 6123 11.244 87.153 154.239 1.00 0.00 O ATOM 14170 H1 WAT 6123 11.492 86.501 154.895 1.00 0.00 H ATOM 14171 H2 WAT 6123 11.643 87.966 154.548 1.00 0.00 H TER 14173 WAT 6123 ATOM 14173 O WAT 6124 97.995 1.410 71.583 1.00 0.00 O ATOM 14174 H1 WAT 6124 97.862 0.470 71.705 1.00 0.00 H ATOM 14175 H2 WAT 6124 97.569 1.607 70.749 1.00 0.00 H TER 14177 WAT 6124 ATOM 14177 O WAT 6125 118.407 8.332 75.897 1.00 0.00 O ATOM 14178 H1 WAT 6125 118.492 8.148 76.832 1.00 0.00 H ATOM 14179 H2 WAT 6125 119.296 8.545 75.613 1.00 0.00 H TER 14181 WAT 6125 ATOM 14181 O WAT 6126 121.121 111.843 148.275 1.00 0.00 O ATOM 14182 H1 WAT 6126 121.089 110.965 147.895 1.00 0.00 H ATOM 14183 H2 WAT 6126 120.414 111.851 148.920 1.00 0.00 H TER 14185 WAT 6126 ATOM 14185 O WAT 6127 123.172 102.713 8.218 1.00 0.00 O ATOM 14186 H1 WAT 6127 122.976 102.861 7.293 1.00 0.00 H ATOM 14187 H2 WAT 6127 122.486 103.187 8.688 1.00 0.00 H TER 14189 WAT 6127 ATOM 14189 O WAT 6128 54.965 27.222 137.599 1.00 0.00 O ATOM 14190 H1 WAT 6128 55.918 27.240 137.686 1.00 0.00 H ATOM 14191 H2 WAT 6128 54.646 27.057 138.486 1.00 0.00 H TER 14193 WAT 6128 ATOM 14193 O WAT 6129 0.321 47.122 0.763 1.00 0.00 O ATOM 14194 H1 WAT 6129 0.204 46.301 0.286 1.00 0.00 H ATOM 14195 H2 WAT 6129 1.206 47.067 1.122 1.00 0.00 H TER 14197 WAT 6129 ATOM 14197 O WAT 6130 105.055 26.621 88.091 1.00 0.00 O ATOM 14198 H1 WAT 6130 105.408 26.067 87.395 1.00 0.00 H ATOM 14199 H2 WAT 6130 105.411 26.248 88.898 1.00 0.00 H TER 14201 WAT 6130 ATOM 14201 O WAT 6131 118.804 140.052 63.072 1.00 0.00 O ATOM 14202 H1 WAT 6131 118.592 140.890 62.661 1.00 0.00 H ATOM 14203 H2 WAT 6131 119.574 140.237 63.610 1.00 0.00 H TER 14205 WAT 6131 ATOM 14205 O WAT 6132 10.730 95.639 13.672 1.00 0.00 O ATOM 14206 H1 WAT 6132 10.124 95.281 13.023 1.00 0.00 H ATOM 14207 H2 WAT 6132 11.381 96.115 13.156 1.00 0.00 H TER 14209 WAT 6132 ATOM 14209 O WAT 6133 18.460 114.779 64.298 1.00 0.00 O ATOM 14210 H1 WAT 6133 18.020 114.338 65.025 1.00 0.00 H ATOM 14211 H2 WAT 6133 18.090 114.375 63.513 1.00 0.00 H TER 14213 WAT 6133 ATOM 14213 O WAT 6134 72.755 58.710 133.512 1.00 0.00 O ATOM 14214 H1 WAT 6134 72.514 57.790 133.400 1.00 0.00 H ATOM 14215 H2 WAT 6134 73.566 58.807 133.012 1.00 0.00 H TER 14217 WAT 6134 ATOM 14217 O WAT 6135 22.734 140.495 107.518 1.00 0.00 O ATOM 14218 H1 WAT 6135 23.224 141.288 107.300 1.00 0.00 H ATOM 14219 H2 WAT 6135 22.847 140.395 108.463 1.00 0.00 H TER 14221 WAT 6135 ATOM 14221 O WAT 6136 112.058 26.884 102.785 1.00 0.00 O ATOM 14222 H1 WAT 6136 112.251 25.947 102.802 1.00 0.00 H ATOM 14223 H2 WAT 6136 112.405 27.215 103.614 1.00 0.00 H TER 14225 WAT 6136 ATOM 14225 O WAT 6137 121.614 118.116 95.069 1.00 0.00 O ATOM 14226 H1 WAT 6137 122.196 117.364 94.962 1.00 0.00 H ATOM 14227 H2 WAT 6137 121.309 118.310 94.182 1.00 0.00 H TER 14229 WAT 6137 ATOM 14229 O WAT 6138 132.572 19.784 110.846 1.00 0.00 O ATOM 14230 H1 WAT 6138 131.688 19.471 110.656 1.00 0.00 H ATOM 14231 H2 WAT 6138 132.725 19.533 111.757 1.00 0.00 H TER 14233 WAT 6138 ATOM 14233 O WAT 6139 88.008 141.200 103.476 1.00 0.00 O ATOM 14234 H1 WAT 6139 87.735 141.108 104.388 1.00 0.00 H ATOM 14235 H2 WAT 6139 87.427 140.614 102.991 1.00 0.00 H TER 14237 WAT 6139 ATOM 14237 O WAT 6140 50.980 132.303 145.086 1.00 0.00 O ATOM 14238 H1 WAT 6140 51.399 133.013 145.571 1.00 0.00 H ATOM 14239 H2 WAT 6140 51.552 132.158 144.332 1.00 0.00 H TER 14241 WAT 6140 ATOM 14241 O WAT 6141 129.435 112.494 131.561 1.00 0.00 O ATOM 14242 H1 WAT 6141 129.938 111.724 131.823 1.00 0.00 H ATOM 14243 H2 WAT 6141 129.653 112.620 130.637 1.00 0.00 H TER 14245 WAT 6141 ATOM 14245 O WAT 6142 133.995 128.379 118.444 1.00 0.00 O ATOM 14246 H1 WAT 6142 134.414 127.538 118.259 1.00 0.00 H ATOM 14247 H2 WAT 6142 133.125 128.146 118.769 1.00 0.00 H TER 14249 WAT 6142 ATOM 14249 O WAT 6143 113.613 106.339 12.220 1.00 0.00 O ATOM 14250 H1 WAT 6143 113.158 106.853 11.553 1.00 0.00 H ATOM 14251 H2 WAT 6143 112.970 105.689 12.502 1.00 0.00 H TER 14253 WAT 6143 ATOM 14253 O WAT 6144 64.159 67.037 91.094 1.00 0.00 O ATOM 14254 H1 WAT 6144 64.901 67.321 91.627 1.00 0.00 H ATOM 14255 H2 WAT 6144 63.872 67.829 90.640 1.00 0.00 H TER 14257 WAT 6144 ATOM 14257 O WAT 6145 91.458 1.158 80.403 1.00 0.00 O ATOM 14258 H1 WAT 6145 92.082 0.752 81.005 1.00 0.00 H ATOM 14259 H2 WAT 6145 91.764 0.903 79.532 1.00 0.00 H TER 14261 WAT 6145 ATOM 14261 O WAT 6146 76.323 81.524 152.278 1.00 0.00 O ATOM 14262 H1 WAT 6146 75.905 82.327 151.966 1.00 0.00 H ATOM 14263 H2 WAT 6146 76.623 81.085 151.483 1.00 0.00 H TER 14265 WAT 6146 ATOM 14265 O WAT 6147 97.091 141.820 12.073 1.00 0.00 O ATOM 14266 H1 WAT 6147 97.908 141.667 12.546 1.00 0.00 H ATOM 14267 H2 WAT 6147 96.666 142.532 12.551 1.00 0.00 H TER 14269 WAT 6147 ATOM 14269 O WAT 6148 111.558 55.013 156.723 1.00 0.00 O ATOM 14270 H1 WAT 6148 111.201 55.867 156.965 1.00 0.00 H ATOM 14271 H2 WAT 6148 112.391 55.213 156.296 1.00 0.00 H TER 14273 WAT 6148 ATOM 14273 O WAT 6149 133.753 89.148 10.645 1.00 0.00 O ATOM 14274 H1 WAT 6149 133.984 90.059 10.463 1.00 0.00 H ATOM 14275 H2 WAT 6149 132.884 89.196 11.044 1.00 0.00 H TER 14277 WAT 6149 ATOM 14277 O WAT 6150 105.271 100.358 9.954 1.00 0.00 O ATOM 14278 H1 WAT 6150 105.177 99.412 10.068 1.00 0.00 H ATOM 14279 H2 WAT 6150 104.455 100.631 9.535 1.00 0.00 H TER 14281 WAT 6150 ATOM 14281 O WAT 6151 62.645 27.948 6.724 1.00 0.00 O ATOM 14282 H1 WAT 6151 62.807 28.734 7.247 1.00 0.00 H ATOM 14283 H2 WAT 6151 61.801 27.623 7.037 1.00 0.00 H TER 14285 WAT 6151 ATOM 14285 O WAT 6152 11.850 82.262 111.308 1.00 0.00 O ATOM 14286 H1 WAT 6152 12.555 82.018 110.708 1.00 0.00 H ATOM 14287 H2 WAT 6152 12.300 82.629 112.069 1.00 0.00 H TER 14289 WAT 6152 ATOM 14289 O WAT 6153 71.083 120.737 90.281 1.00 0.00 O ATOM 14290 H1 WAT 6153 70.610 120.064 89.791 1.00 0.00 H ATOM 14291 H2 WAT 6153 71.597 121.198 89.619 1.00 0.00 H TER 14293 WAT 6153 ATOM 14293 O WAT 6154 117.700 135.582 3.209 1.00 0.00 O ATOM 14294 H1 WAT 6154 118.052 134.885 2.655 1.00 0.00 H ATOM 14295 H2 WAT 6154 116.816 135.289 3.431 1.00 0.00 H TER 14297 WAT 6154 ATOM 14297 O WAT 6155 20.661 64.763 83.551 1.00 0.00 O ATOM 14298 H1 WAT 6155 20.527 63.826 83.690 1.00 0.00 H ATOM 14299 H2 WAT 6155 20.387 65.169 84.374 1.00 0.00 H TER 14301 WAT 6155 ATOM 14301 O WAT 6156 119.223 45.285 118.014 1.00 0.00 O ATOM 14302 H1 WAT 6156 118.553 45.892 117.700 1.00 0.00 H ATOM 14303 H2 WAT 6156 118.884 44.963 118.849 1.00 0.00 H TER 14305 WAT 6156 ATOM 14305 O WAT 6157 22.315 142.160 139.176 1.00 0.00 O ATOM 14306 H1 WAT 6157 23.199 142.528 139.177 1.00 0.00 H ATOM 14307 H2 WAT 6157 21.892 142.555 138.413 1.00 0.00 H TER 14309 WAT 6157 ATOM 14309 O WAT 6158 74.742 120.010 19.291 1.00 0.00 O ATOM 14310 H1 WAT 6158 75.193 119.283 18.863 1.00 0.00 H ATOM 14311 H2 WAT 6158 75.436 120.639 19.489 1.00 0.00 H TER 14313 WAT 6158 ATOM 14313 O WAT 6159 20.138 34.204 64.566 1.00 0.00 O ATOM 14314 H1 WAT 6159 20.386 33.541 65.210 1.00 0.00 H ATOM 14315 H2 WAT 6159 19.465 33.780 64.034 1.00 0.00 H TER 14317 WAT 6159 ATOM 14317 O WAT 6160 128.358 61.719 130.890 1.00 0.00 O ATOM 14318 H1 WAT 6160 128.009 61.026 131.451 1.00 0.00 H ATOM 14319 H2 WAT 6160 129.076 62.098 131.396 1.00 0.00 H TER 14321 WAT 6160 ATOM 14321 O WAT 6161 41.967 116.573 82.653 1.00 0.00 O ATOM 14322 H1 WAT 6161 42.612 117.012 83.207 1.00 0.00 H ATOM 14323 H2 WAT 6161 42.393 116.503 81.799 1.00 0.00 H TER 14325 WAT 6161 ATOM 14325 O WAT 6162 141.660 22.318 5.132 1.00 0.00 O ATOM 14326 H1 WAT 6162 142.449 22.185 4.606 1.00 0.00 H ATOM 14327 H2 WAT 6162 141.007 21.742 4.735 1.00 0.00 H TER 14329 WAT 6162 ATOM 14329 O WAT 6163 120.345 20.938 103.159 1.00 0.00 O ATOM 14330 H1 WAT 6163 121.068 20.447 102.767 1.00 0.00 H ATOM 14331 H2 WAT 6163 120.730 21.356 103.929 1.00 0.00 H TER 14333 WAT 6163 ATOM 14333 O WAT 6164 40.277 114.605 80.091 1.00 0.00 O ATOM 14334 H1 WAT 6164 40.995 115.233 80.172 1.00 0.00 H ATOM 14335 H2 WAT 6164 40.208 114.207 80.959 1.00 0.00 H TER 14337 WAT 6164 ATOM 14337 O WAT 6165 97.487 69.801 20.269 1.00 0.00 O ATOM 14338 H1 WAT 6165 97.362 68.852 20.264 1.00 0.00 H ATOM 14339 H2 WAT 6165 98.260 69.938 20.817 1.00 0.00 H TER 14341 WAT 6165 ATOM 14341 O WAT 6166 109.625 135.634 65.717 1.00 0.00 O ATOM 14342 H1 WAT 6166 110.258 135.088 66.184 1.00 0.00 H ATOM 14343 H2 WAT 6166 109.823 136.527 66.000 1.00 0.00 H TER 14345 WAT 6166 ATOM 14345 O WAT 6167 35.232 35.229 11.825 1.00 0.00 O ATOM 14346 H1 WAT 6167 35.167 35.057 12.765 1.00 0.00 H ATOM 14347 H2 WAT 6167 34.628 35.955 11.672 1.00 0.00 H TER 14349 WAT 6167 ATOM 14349 O WAT 6168 56.806 89.896 10.070 1.00 0.00 O ATOM 14350 H1 WAT 6168 56.099 89.315 10.348 1.00 0.00 H ATOM 14351 H2 WAT 6168 56.451 90.362 9.313 1.00 0.00 H TER 14353 WAT 6168 ATOM 14353 O WAT 6169 57.598 29.185 9.724 1.00 0.00 O ATOM 14354 H1 WAT 6169 58.057 28.345 9.724 1.00 0.00 H ATOM 14355 H2 WAT 6169 57.706 29.517 8.833 1.00 0.00 H TER 14357 WAT 6169 ATOM 14357 O WAT 6170 20.418 24.515 139.488 1.00 0.00 O ATOM 14358 H1 WAT 6170 20.231 25.134 140.195 1.00 0.00 H ATOM 14359 H2 WAT 6170 20.755 23.738 139.933 1.00 0.00 H TER 14361 WAT 6170 ATOM 14361 O WAT 6171 32.242 99.284 8.379 1.00 0.00 O ATOM 14362 H1 WAT 6171 32.085 100.159 8.734 1.00 0.00 H ATOM 14363 H2 WAT 6171 33.084 99.021 8.753 1.00 0.00 H TER 14365 WAT 6171 ATOM 14365 O WAT 6172 129.698 45.602 25.788 1.00 0.00 O ATOM 14366 H1 WAT 6172 129.490 45.811 24.877 1.00 0.00 H ATOM 14367 H2 WAT 6172 129.124 44.866 26.001 1.00 0.00 H TER 14369 WAT 6172 ATOM 14369 O WAT 6173 144.072 136.536 12.824 1.00 0.00 O ATOM 14370 H1 WAT 6173 144.912 136.393 13.260 1.00 0.00 H ATOM 14371 H2 WAT 6173 143.454 135.990 13.310 1.00 0.00 H TER 14373 WAT 6173 ATOM 14373 O WAT 6174 33.679 127.227 129.538 1.00 0.00 O ATOM 14374 H1 WAT 6174 34.225 127.228 130.324 1.00 0.00 H ATOM 14375 H2 WAT 6174 34.020 127.947 129.008 1.00 0.00 H TER 14377 WAT 6174 ATOM 14377 O WAT 6175 96.706 112.994 86.360 1.00 0.00 O ATOM 14378 H1 WAT 6175 97.299 113.326 85.686 1.00 0.00 H ATOM 14379 H2 WAT 6175 97.116 113.250 87.186 1.00 0.00 H TER 14381 WAT 6175 ATOM 14381 O WAT 6176 92.612 114.267 147.523 1.00 0.00 O ATOM 14382 H1 WAT 6176 93.553 114.372 147.666 1.00 0.00 H ATOM 14383 H2 WAT 6176 92.220 114.429 148.380 1.00 0.00 H TER 14385 WAT 6176 ATOM 14385 O WAT 6177 113.615 138.739 19.711 1.00 0.00 O ATOM 14386 H1 WAT 6177 112.829 138.499 19.221 1.00 0.00 H ATOM 14387 H2 WAT 6177 113.655 138.104 20.426 1.00 0.00 H TER 14389 WAT 6177 ATOM 14389 O WAT 6178 2.127 122.558 59.015 1.00 0.00 O ATOM 14390 H1 WAT 6178 2.035 122.711 58.075 1.00 0.00 H ATOM 14391 H2 WAT 6178 2.349 123.417 59.377 1.00 0.00 H TER 14393 WAT 6178 ATOM 14393 O WAT 6179 57.594 120.935 87.786 1.00 0.00 O ATOM 14394 H1 WAT 6179 58.198 120.789 87.059 1.00 0.00 H ATOM 14395 H2 WAT 6179 58.063 121.530 88.371 1.00 0.00 H TER 14397 WAT 6179 ATOM 14397 O WAT 6180 108.399 28.474 133.696 1.00 0.00 O ATOM 14398 H1 WAT 6180 108.498 27.696 133.149 1.00 0.00 H ATOM 14399 H2 WAT 6180 107.472 28.703 133.623 1.00 0.00 H TER 14401 WAT 6180 ATOM 14401 O WAT 6181 139.046 134.249 120.282 1.00 0.00 O ATOM 14402 H1 WAT 6181 139.959 134.217 120.565 1.00 0.00 H ATOM 14403 H2 WAT 6181 139.058 134.795 119.496 1.00 0.00 H TER 14405 WAT 6181 ATOM 14405 O WAT 6182 143.541 21.374 83.924 1.00 0.00 O ATOM 14406 H1 WAT 6182 143.373 20.711 83.254 1.00 0.00 H ATOM 14407 H2 WAT 6182 144.373 21.111 84.318 1.00 0.00 H TER 14409 WAT 6182 ATOM 14409 O WAT 6183 138.700 63.953 110.338 1.00 0.00 O ATOM 14410 H1 WAT 6183 138.642 63.451 111.151 1.00 0.00 H ATOM 14411 H2 WAT 6183 137.830 63.876 109.947 1.00 0.00 H TER 14413 WAT 6183 ATOM 14413 O WAT 6184 53.324 50.198 23.144 1.00 0.00 O ATOM 14414 H1 WAT 6184 52.460 50.527 23.392 1.00 0.00 H ATOM 14415 H2 WAT 6184 53.723 49.925 23.970 1.00 0.00 H TER 14417 WAT 6184 ATOM 14417 O WAT 6185 121.162 59.271 11.118 1.00 0.00 O ATOM 14418 H1 WAT 6185 120.702 58.935 11.888 1.00 0.00 H ATOM 14419 H2 WAT 6185 121.075 60.222 11.183 1.00 0.00 H TER 14421 WAT 6185 ATOM 14421 O WAT 6186 111.457 143.480 134.947 1.00 0.00 O ATOM 14422 H1 WAT 6186 110.524 143.279 134.866 1.00 0.00 H ATOM 14423 H2 WAT 6186 111.900 142.695 134.627 1.00 0.00 H TER 14425 WAT 6186 ATOM 14425 O WAT 6187 125.827 102.718 147.869 1.00 0.00 O ATOM 14426 H1 WAT 6187 125.263 102.005 148.168 1.00 0.00 H ATOM 14427 H2 WAT 6187 126.012 102.508 146.954 1.00 0.00 H TER 14429 WAT 6187 ATOM 14429 O WAT 6188 8.847 55.750 124.738 1.00 0.00 O ATOM 14430 H1 WAT 6188 9.261 56.604 124.614 1.00 0.00 H ATOM 14431 H2 WAT 6188 8.358 55.837 125.556 1.00 0.00 H TER 14433 WAT 6188 ATOM 14433 O WAT 6189 45.787 16.438 26.481 1.00 0.00 O ATOM 14434 H1 WAT 6189 45.258 17.235 26.450 1.00 0.00 H ATOM 14435 H2 WAT 6189 46.427 16.548 25.778 1.00 0.00 H TER 14437 WAT 6189 ATOM 14437 O WAT 6190 111.784 8.620 71.608 1.00 0.00 O ATOM 14438 H1 WAT 6190 111.992 9.486 71.258 1.00 0.00 H ATOM 14439 H2 WAT 6190 110.859 8.674 71.848 1.00 0.00 H TER 14441 WAT 6190 ATOM 14441 O WAT 6191 142.578 107.307 100.981 1.00 0.00 O ATOM 14442 H1 WAT 6191 143.519 107.335 101.150 1.00 0.00 H ATOM 14443 H2 WAT 6191 142.343 108.212 100.779 1.00 0.00 H TER 14445 WAT 6191 ATOM 14445 O WAT 6192 136.523 141.540 102.720 1.00 0.00 O ATOM 14446 H1 WAT 6192 136.859 142.418 102.896 1.00 0.00 H ATOM 14447 H2 WAT 6192 137.211 140.953 103.034 1.00 0.00 H TER 14449 WAT 6192 ATOM 14449 O WAT 6193 36.645 137.810 127.382 1.00 0.00 O ATOM 14450 H1 WAT 6193 35.816 137.705 126.916 1.00 0.00 H ATOM 14451 H2 WAT 6193 36.393 137.903 128.301 1.00 0.00 H TER 14453 WAT 6193 ATOM 14453 O WAT 6194 118.651 103.750 143.650 1.00 0.00 O ATOM 14454 H1 WAT 6194 118.394 104.502 144.183 1.00 0.00 H ATOM 14455 H2 WAT 6194 118.402 103.991 142.758 1.00 0.00 H TER 14457 WAT 6194 ATOM 14457 O WAT 6195 4.625 61.198 135.417 1.00 0.00 O ATOM 14458 H1 WAT 6195 5.379 61.732 135.667 1.00 0.00 H ATOM 14459 H2 WAT 6195 4.817 60.331 135.775 1.00 0.00 H TER 14461 WAT 6195 ATOM 14461 O WAT 6196 21.503 60.773 103.278 1.00 0.00 O ATOM 14462 H1 WAT 6196 21.476 61.121 102.386 1.00 0.00 H ATOM 14463 H2 WAT 6196 20.695 60.267 103.361 1.00 0.00 H TER 14465 WAT 6196 ATOM 14465 O WAT 6197 117.776 66.916 1.471 1.00 0.00 O ATOM 14466 H1 WAT 6197 117.512 66.618 2.341 1.00 0.00 H ATOM 14467 H2 WAT 6197 117.222 66.419 0.869 1.00 0.00 H TER 14469 WAT 6197 ATOM 14469 O WAT 6198 88.668 51.010 101.236 1.00 0.00 O ATOM 14470 H1 WAT 6198 88.517 50.779 102.153 1.00 0.00 H ATOM 14471 H2 WAT 6198 88.295 50.281 100.741 1.00 0.00 H TER 14473 WAT 6198 ATOM 14473 O WAT 6199 28.244 90.331 66.704 1.00 0.00 O ATOM 14474 H1 WAT 6199 29.015 90.673 67.156 1.00 0.00 H ATOM 14475 H2 WAT 6199 28.275 89.387 66.858 1.00 0.00 H TER 14477 WAT 6199 ATOM 14477 O WAT 6200 143.945 45.624 123.260 1.00 0.00 O ATOM 14478 H1 WAT 6200 144.458 46.184 122.677 1.00 0.00 H ATOM 14479 H2 WAT 6200 143.720 46.190 123.998 1.00 0.00 H TER 14481 WAT 6200 ATOM 14481 O WAT 6201 77.378 116.173 101.027 1.00 0.00 O ATOM 14482 H1 WAT 6201 77.563 116.503 100.148 1.00 0.00 H ATOM 14483 H2 WAT 6201 76.837 115.396 100.881 1.00 0.00 H TER 14485 WAT 6201 ATOM 14485 O WAT 6202 107.960 103.321 13.320 1.00 0.00 O ATOM 14486 H1 WAT 6202 107.292 103.046 12.693 1.00 0.00 H ATOM 14487 H2 WAT 6202 107.549 103.199 14.176 1.00 0.00 H TER 14489 WAT 6202 ATOM 14489 O WAT 6203 144.225 114.062 108.871 1.00 0.00 O ATOM 14490 H1 WAT 6203 144.557 113.630 108.084 1.00 0.00 H ATOM 14491 H2 WAT 6203 144.847 113.821 109.557 1.00 0.00 H TER 14493 WAT 6203 ATOM 14493 O WAT 6204 104.479 105.091 28.395 1.00 0.00 O ATOM 14494 H1 WAT 6204 103.914 104.365 28.131 1.00 0.00 H ATOM 14495 H2 WAT 6204 105.328 104.889 28.000 1.00 0.00 H TER 14497 WAT 6204 ATOM 14497 O WAT 6205 0.611 23.314 109.296 1.00 0.00 O ATOM 14498 H1 WAT 6205 1.449 23.343 109.757 1.00 0.00 H ATOM 14499 H2 WAT 6205 0.018 22.873 109.904 1.00 0.00 H TER 14501 WAT 6205 ATOM 14501 O WAT 6206 38.316 82.269 91.309 1.00 0.00 O ATOM 14502 H1 WAT 6206 37.449 82.015 91.624 1.00 0.00 H ATOM 14503 H2 WAT 6206 38.427 83.170 91.612 1.00 0.00 H TER 14505 WAT 6206 ATOM 14505 O WAT 6207 77.753 83.720 157.119 1.00 0.00 O ATOM 14506 H1 WAT 6207 78.707 83.719 157.046 1.00 0.00 H ATOM 14507 H2 WAT 6207 77.452 83.273 156.327 1.00 0.00 H TER 14509 WAT 6207 ATOM 14509 O WAT 6208 54.224 51.822 115.713 1.00 0.00 O ATOM 14510 H1 WAT 6208 54.369 52.571 116.291 1.00 0.00 H ATOM 14511 H2 WAT 6208 53.459 52.065 115.192 1.00 0.00 H TER 14513 WAT 6208 ATOM 14513 O WAT 6209 64.289 107.915 14.796 1.00 0.00 O ATOM 14514 H1 WAT 6209 64.137 108.741 15.254 1.00 0.00 H ATOM 14515 H2 WAT 6209 63.745 107.973 14.011 1.00 0.00 H TER 14517 WAT 6209 ATOM 14517 O WAT 6210 43.354 58.903 109.192 1.00 0.00 O ATOM 14518 H1 WAT 6210 42.980 58.198 108.663 1.00 0.00 H ATOM 14519 H2 WAT 6210 42.668 59.569 109.224 1.00 0.00 H TER 14521 WAT 6210 ATOM 14521 O WAT 6211 66.902 36.570 109.442 1.00 0.00 O ATOM 14522 H1 WAT 6211 67.722 36.505 108.953 1.00 0.00 H ATOM 14523 H2 WAT 6211 66.574 37.448 109.244 1.00 0.00 H TER 14525 WAT 6211 ATOM 14525 O WAT 6212 112.514 89.321 85.721 1.00 0.00 O ATOM 14526 H1 WAT 6212 111.735 88.796 85.537 1.00 0.00 H ATOM 14527 H2 WAT 6212 112.530 89.977 85.024 1.00 0.00 H TER 14529 WAT 6212 ATOM 14529 O WAT 6213 118.534 6.282 142.997 1.00 0.00 O ATOM 14530 H1 WAT 6213 117.748 5.840 143.316 1.00 0.00 H ATOM 14531 H2 WAT 6213 119.009 6.529 143.790 1.00 0.00 H TER 14533 WAT 6213 ATOM 14533 O WAT 6214 133.663 76.824 149.614 1.00 0.00 O ATOM 14534 H1 WAT 6214 133.495 77.631 149.128 1.00 0.00 H ATOM 14535 H2 WAT 6214 132.907 76.733 150.194 1.00 0.00 H TER 14537 WAT 6214 ATOM 14537 O WAT 6215 143.211 91.223 144.612 1.00 0.00 O ATOM 14538 H1 WAT 6215 143.450 90.301 144.518 1.00 0.00 H ATOM 14539 H2 WAT 6215 144.020 91.701 144.426 1.00 0.00 H TER 14541 WAT 6215 ATOM 14541 O WAT 6216 137.262 33.292 62.801 1.00 0.00 O ATOM 14542 H1 WAT 6216 137.494 34.050 63.337 1.00 0.00 H ATOM 14543 H2 WAT 6216 136.633 33.633 62.165 1.00 0.00 H TER 14545 WAT 6216 ATOM 14545 O WAT 6217 98.193 84.350 151.310 1.00 0.00 O ATOM 14546 H1 WAT 6217 98.266 83.436 151.034 1.00 0.00 H ATOM 14547 H2 WAT 6217 97.251 84.504 151.379 1.00 0.00 H TER 14549 WAT 6217 ATOM 14549 O WAT 6218 98.372 113.073 140.110 1.00 0.00 O ATOM 14550 H1 WAT 6218 97.512 112.679 140.253 1.00 0.00 H ATOM 14551 H2 WAT 6218 98.186 113.992 139.914 1.00 0.00 H TER 14553 WAT 6218 ATOM 14553 O WAT 6219 43.948 50.117 0.241 1.00 0.00 O ATOM 14554 H1 WAT 6219 44.025 49.163 0.205 1.00 0.00 H ATOM 14555 H2 WAT 6219 44.548 50.379 0.939 1.00 0.00 H TER 14557 WAT 6219 ATOM 14557 O WAT 6220 115.303 88.717 107.185 1.00 0.00 O ATOM 14558 H1 WAT 6220 115.547 87.810 107.001 1.00 0.00 H ATOM 14559 H2 WAT 6220 115.675 88.895 108.049 1.00 0.00 H TER 14561 WAT 6220 ATOM 14561 O WAT 6221 107.692 83.351 133.537 1.00 0.00 O ATOM 14562 H1 WAT 6221 107.856 84.204 133.135 1.00 0.00 H ATOM 14563 H2 WAT 6221 107.386 83.557 134.421 1.00 0.00 H TER 14565 WAT 6221 ATOM 14565 O WAT 6222 102.279 126.587 64.664 1.00 0.00 O ATOM 14566 H1 WAT 6222 101.558 126.067 65.017 1.00 0.00 H ATOM 14567 H2 WAT 6222 101.871 127.408 64.391 1.00 0.00 H TER 14569 WAT 6222 ATOM 14569 O WAT 6223 105.142 81.485 122.359 1.00 0.00 O ATOM 14570 H1 WAT 6223 105.344 81.443 123.294 1.00 0.00 H ATOM 14571 H2 WAT 6223 105.648 80.770 121.973 1.00 0.00 H TER 14573 WAT 6223 ATOM 14573 O WAT 6224 5.105 76.747 95.960 1.00 0.00 O ATOM 14574 H1 WAT 6224 4.153 76.837 95.918 1.00 0.00 H ATOM 14575 H2 WAT 6224 5.375 76.631 95.049 1.00 0.00 H TER 14577 WAT 6224 ATOM 14577 O WAT 6225 27.562 104.159 154.299 1.00 0.00 O ATOM 14578 H1 WAT 6225 27.227 103.387 154.754 1.00 0.00 H ATOM 14579 H2 WAT 6225 28.308 103.836 153.795 1.00 0.00 H TER 14581 WAT 6225 ATOM 14581 O WAT 6226 27.727 62.252 76.150 1.00 0.00 O ATOM 14582 H1 WAT 6226 27.622 63.203 76.136 1.00 0.00 H ATOM 14583 H2 WAT 6226 27.283 61.974 76.951 1.00 0.00 H TER 14585 WAT 6226 ATOM 14585 O WAT 6227 95.965 43.322 141.592 1.00 0.00 O ATOM 14586 H1 WAT 6227 95.805 42.456 141.218 1.00 0.00 H ATOM 14587 H2 WAT 6227 96.537 43.158 142.342 1.00 0.00 H TER 14589 WAT 6227 ATOM 14589 O WAT 6228 42.165 84.969 149.607 1.00 0.00 O ATOM 14590 H1 WAT 6228 43.080 84.931 149.327 1.00 0.00 H ATOM 14591 H2 WAT 6228 41.910 84.053 149.716 1.00 0.00 H TER 14593 WAT 6228 ATOM 14593 O WAT 6229 35.900 44.024 14.698 1.00 0.00 O ATOM 14594 H1 WAT 6229 35.079 44.484 14.522 1.00 0.00 H ATOM 14595 H2 WAT 6229 35.657 43.099 14.714 1.00 0.00 H TER 14597 WAT 6229 ATOM 14597 O WAT 6230 116.389 34.440 130.540 1.00 0.00 O ATOM 14598 H1 WAT 6230 116.051 33.704 131.051 1.00 0.00 H ATOM 14599 H2 WAT 6230 115.746 34.563 129.843 1.00 0.00 H TER 14601 WAT 6230 ATOM 14601 O WAT 6231 136.310 80.350 157.949 1.00 0.00 O ATOM 14602 H1 WAT 6231 137.146 80.816 157.935 1.00 0.00 H ATOM 14603 H2 WAT 6231 135.861 80.686 158.725 1.00 0.00 H TER 14605 WAT 6231 ATOM 14605 O WAT 6232 140.277 135.215 102.604 1.00 0.00 O ATOM 14606 H1 WAT 6232 139.451 135.132 102.128 1.00 0.00 H ATOM 14607 H2 WAT 6232 140.563 134.313 102.747 1.00 0.00 H TER 14609 WAT 6232 ATOM 14609 O WAT 6233 118.018 15.584 146.396 1.00 0.00 O ATOM 14610 H1 WAT 6233 118.716 16.151 146.071 1.00 0.00 H ATOM 14611 H2 WAT 6233 118.447 14.744 146.558 1.00 0.00 H TER 14613 WAT 6233 ATOM 14613 O WAT 6234 84.821 12.160 8.220 1.00 0.00 O ATOM 14614 H1 WAT 6234 85.198 12.708 8.908 1.00 0.00 H ATOM 14615 H2 WAT 6234 83.914 12.023 8.493 1.00 0.00 H TER 14617 WAT 6234 ATOM 14617 O WAT 6235 59.157 92.702 20.013 1.00 0.00 O ATOM 14618 H1 WAT 6235 59.170 93.593 20.363 1.00 0.00 H ATOM 14619 H2 WAT 6235 59.989 92.617 19.546 1.00 0.00 H TER 14621 WAT 6235 ATOM 14621 O WAT 6236 52.121 75.853 65.953 1.00 0.00 O ATOM 14622 H1 WAT 6236 51.755 76.267 65.171 1.00 0.00 H ATOM 14623 H2 WAT 6236 51.741 76.343 66.683 1.00 0.00 H TER 14625 WAT 6236 ATOM 14625 O WAT 6237 106.158 90.803 15.916 1.00 0.00 O ATOM 14626 H1 WAT 6237 106.592 90.255 16.570 1.00 0.00 H ATOM 14627 H2 WAT 6237 106.383 91.699 16.167 1.00 0.00 H TER 14629 WAT 6237 ATOM 14629 O WAT 6238 111.960 10.951 83.451 1.00 0.00 O ATOM 14630 H1 WAT 6238 111.680 11.866 83.485 1.00 0.00 H ATOM 14631 H2 WAT 6238 112.452 10.881 82.633 1.00 0.00 H TER 14633 WAT 6238 ATOM 14633 O WAT 6239 58.916 132.756 90.438 1.00 0.00 O ATOM 14634 H1 WAT 6239 58.098 132.432 90.062 1.00 0.00 H ATOM 14635 H2 WAT 6239 58.659 133.526 90.945 1.00 0.00 H TER 14637 WAT 6239 ATOM 14637 O WAT 6240 56.226 26.902 68.393 1.00 0.00 O ATOM 14638 H1 WAT 6240 55.917 27.434 67.660 1.00 0.00 H ATOM 14639 H2 WAT 6240 55.794 26.056 68.274 1.00 0.00 H TER 14641 WAT 6240 ATOM 14641 O WAT 6241 9.703 88.720 88.264 1.00 0.00 O ATOM 14642 H1 WAT 6241 9.202 89.040 89.014 1.00 0.00 H ATOM 14643 H2 WAT 6241 9.153 88.037 87.881 1.00 0.00 H TER 14645 WAT 6241 ATOM 14645 O WAT 6242 79.541 86.090 28.341 1.00 0.00 O ATOM 14646 H1 WAT 6242 80.382 86.328 28.733 1.00 0.00 H ATOM 14647 H2 WAT 6242 79.493 86.615 27.542 1.00 0.00 H TER 14649 WAT 6242 ATOM 14649 O WAT 6243 62.387 4.813 89.401 1.00 0.00 O ATOM 14650 H1 WAT 6243 62.381 5.117 88.493 1.00 0.00 H ATOM 14651 H2 WAT 6243 61.463 4.695 89.620 1.00 0.00 H TER 14653 WAT 6243 ATOM 14653 O WAT 6244 62.082 22.981 142.656 1.00 0.00 O ATOM 14654 H1 WAT 6244 62.570 22.912 141.835 1.00 0.00 H ATOM 14655 H2 WAT 6244 62.241 23.877 142.954 1.00 0.00 H TER 14657 WAT 6244 ATOM 14657 O WAT 6245 110.132 0.236 75.579 1.00 0.00 O ATOM 14658 H1 WAT 6245 110.583 0.696 76.287 1.00 0.00 H ATOM 14659 H2 WAT 6245 109.875 0.928 74.969 1.00 0.00 H TER 14661 WAT 6245 ATOM 14661 O WAT 6246 95.735 49.141 73.234 1.00 0.00 O ATOM 14662 H1 WAT 6246 95.836 48.355 73.772 1.00 0.00 H ATOM 14663 H2 WAT 6246 95.042 48.917 72.612 1.00 0.00 H TER 14665 WAT 6246 ATOM 14665 O WAT 6247 80.932 105.864 55.367 1.00 0.00 O ATOM 14666 H1 WAT 6247 81.633 105.557 55.942 1.00 0.00 H ATOM 14667 H2 WAT 6247 80.756 106.758 55.660 1.00 0.00 H TER 14669 WAT 6247 ATOM 14669 O WAT 6248 13.008 103.912 154.281 1.00 0.00 O ATOM 14670 H1 WAT 6248 13.591 103.225 154.605 1.00 0.00 H ATOM 14671 H2 WAT 6248 13.555 104.430 153.690 1.00 0.00 H TER 14673 WAT 6248 ATOM 14673 O WAT 6249 38.283 12.244 152.525 1.00 0.00 O ATOM 14674 H1 WAT 6249 38.507 11.589 151.864 1.00 0.00 H ATOM 14675 H2 WAT 6249 37.690 12.845 152.074 1.00 0.00 H TER 14677 WAT 6249 ATOM 14677 O WAT 6250 130.036 125.510 119.290 1.00 0.00 O ATOM 14678 H1 WAT 6250 129.186 125.593 119.723 1.00 0.00 H ATOM 14679 H2 WAT 6250 130.614 126.093 119.783 1.00 0.00 H TER 14681 WAT 6250 ATOM 14681 O WAT 6251 72.923 86.446 24.104 1.00 0.00 O ATOM 14682 H1 WAT 6251 73.555 87.165 24.111 1.00 0.00 H ATOM 14683 H2 WAT 6251 72.186 86.769 24.622 1.00 0.00 H TER 14685 WAT 6251 ATOM 14685 O WAT 6252 106.689 91.437 126.901 1.00 0.00 O ATOM 14686 H1 WAT 6252 106.153 91.170 127.648 1.00 0.00 H ATOM 14687 H2 WAT 6252 106.983 92.321 127.121 1.00 0.00 H TER 14689 WAT 6252 ATOM 14689 O WAT 6253 65.912 88.099 129.816 1.00 0.00 O ATOM 14690 H1 WAT 6253 65.831 87.509 130.565 1.00 0.00 H ATOM 14691 H2 WAT 6253 66.386 87.589 129.159 1.00 0.00 H TER 14693 WAT 6253 ATOM 14693 O WAT 6254 39.828 7.541 130.595 1.00 0.00 O ATOM 14694 H1 WAT 6254 39.761 7.408 131.541 1.00 0.00 H ATOM 14695 H2 WAT 6254 40.713 7.880 130.463 1.00 0.00 H TER 14697 WAT 6254 ATOM 14697 O WAT 6255 128.519 87.384 129.923 1.00 0.00 O ATOM 14698 H1 WAT 6255 128.668 88.149 130.478 1.00 0.00 H ATOM 14699 H2 WAT 6255 128.762 86.638 130.472 1.00 0.00 H TER 14701 WAT 6255 ATOM 14701 O WAT 6256 138.533 6.799 22.870 1.00 0.00 O ATOM 14702 H1 WAT 6256 138.097 7.473 22.349 1.00 0.00 H ATOM 14703 H2 WAT 6256 138.978 6.249 22.226 1.00 0.00 H TER 14705 WAT 6256 ATOM 14705 O WAT 6257 85.503 105.577 120.976 1.00 0.00 O ATOM 14706 H1 WAT 6257 85.314 105.664 120.042 1.00 0.00 H ATOM 14707 H2 WAT 6257 86.172 104.894 121.022 1.00 0.00 H TER 14709 WAT 6257 ATOM 14709 O WAT 6258 142.236 38.571 1.197 1.00 0.00 O ATOM 14710 H1 WAT 6258 142.220 39.358 1.742 1.00 0.00 H ATOM 14711 H2 WAT 6258 141.398 38.584 0.734 1.00 0.00 H TER 14713 WAT 6258 ATOM 14713 O WAT 6259 18.500 85.038 57.343 1.00 0.00 O ATOM 14714 H1 WAT 6259 18.675 85.215 56.419 1.00 0.00 H ATOM 14715 H2 WAT 6259 18.792 85.828 57.798 1.00 0.00 H TER 14717 WAT 6259 ATOM 14717 O WAT 6260 121.231 88.993 156.586 1.00 0.00 O ATOM 14718 H1 WAT 6260 122.087 88.661 156.317 1.00 0.00 H ATOM 14719 H2 WAT 6260 120.783 89.196 155.764 1.00 0.00 H TER 14721 WAT 6260 ATOM 14721 O WAT 6261 31.689 141.552 74.218 1.00 0.00 O ATOM 14722 H1 WAT 6261 31.246 141.977 74.952 1.00 0.00 H ATOM 14723 H2 WAT 6261 32.166 140.823 74.615 1.00 0.00 H TER 14725 WAT 6261 ATOM 14725 O WAT 6262 128.795 123.970 105.570 1.00 0.00 O ATOM 14726 H1 WAT 6262 129.695 123.967 105.246 1.00 0.00 H ATOM 14727 H2 WAT 6262 128.854 124.372 106.437 1.00 0.00 H TER 14729 WAT 6262 ATOM 14729 O WAT 6263 78.808 23.970 64.434 1.00 0.00 O ATOM 14730 H1 WAT 6263 78.891 23.503 63.602 1.00 0.00 H ATOM 14731 H2 WAT 6263 79.265 23.415 65.066 1.00 0.00 H TER 14733 WAT 6263 ATOM 14733 O WAT 6264 59.848 1.408 145.496 1.00 0.00 O ATOM 14734 H1 WAT 6264 60.478 2.006 145.899 1.00 0.00 H ATOM 14735 H2 WAT 6264 60.198 1.248 144.619 1.00 0.00 H TER 14737 WAT 6264 ATOM 14737 O WAT 6265 23.580 99.246 105.368 1.00 0.00 O ATOM 14738 H1 WAT 6265 23.179 100.000 104.936 1.00 0.00 H ATOM 14739 H2 WAT 6265 23.350 99.349 106.292 1.00 0.00 H TER 14741 WAT 6265 ATOM 14741 O WAT 6266 3.044 127.448 90.110 1.00 0.00 O ATOM 14742 H1 WAT 6266 2.819 128.211 90.644 1.00 0.00 H ATOM 14743 H2 WAT 6266 2.707 126.702 90.607 1.00 0.00 H TER 14745 WAT 6266 ATOM 14745 O WAT 6267 86.859 37.144 81.494 1.00 0.00 O ATOM 14746 H1 WAT 6267 86.827 36.416 80.874 1.00 0.00 H ATOM 14747 H2 WAT 6267 87.364 37.820 81.043 1.00 0.00 H TER 14749 WAT 6267 ATOM 14749 O WAT 6268 92.256 85.805 79.509 1.00 0.00 O ATOM 14750 H1 WAT 6268 93.153 86.080 79.697 1.00 0.00 H ATOM 14751 H2 WAT 6268 92.105 86.082 78.605 1.00 0.00 H TER 14753 WAT 6268 ATOM 14753 O WAT 6269 103.737 89.478 15.302 1.00 0.00 O ATOM 14754 H1 WAT 6269 103.521 89.023 16.116 1.00 0.00 H ATOM 14755 H2 WAT 6269 104.646 89.754 15.416 1.00 0.00 H TER 14757 WAT 6269 ATOM 14757 O WAT 6270 97.582 17.378 0.119 1.00 0.00 O ATOM 14758 H1 WAT 6270 96.659 17.593 -0.020 1.00 0.00 H ATOM 14759 H2 WAT 6270 97.975 18.196 0.422 1.00 0.00 H TER 14761 WAT 6270 ATOM 14761 O WAT 6271 36.592 96.647 124.919 1.00 0.00 O ATOM 14762 H1 WAT 6271 36.182 97.382 124.461 1.00 0.00 H ATOM 14763 H2 WAT 6271 37.078 96.182 124.238 1.00 0.00 H TER 14765 WAT 6271 ATOM 14765 O WAT 6272 103.444 31.247 153.244 1.00 0.00 O ATOM 14766 H1 WAT 6272 102.868 30.542 152.948 1.00 0.00 H ATOM 14767 H2 WAT 6272 103.173 31.414 154.147 1.00 0.00 H TER 14769 WAT 6272 ATOM 14769 O WAT 6273 31.240 11.423 136.566 1.00 0.00 O ATOM 14770 H1 WAT 6273 31.510 11.657 135.678 1.00 0.00 H ATOM 14771 H2 WAT 6273 31.272 10.466 136.581 1.00 0.00 H TER 14773 WAT 6273 ATOM 14773 O WAT 6274 28.048 22.703 152.996 1.00 0.00 O ATOM 14774 H1 WAT 6274 28.734 23.040 152.420 1.00 0.00 H ATOM 14775 H2 WAT 6274 27.230 22.965 152.573 1.00 0.00 H TER 14777 WAT 6274 ATOM 14777 O WAT 6275 23.160 123.077 83.236 1.00 0.00 O ATOM 14778 H1 WAT 6275 23.752 122.973 83.982 1.00 0.00 H ATOM 14779 H2 WAT 6275 23.622 122.664 82.506 1.00 0.00 H TER 14781 WAT 6275 ATOM 14781 O WAT 6276 109.325 12.226 112.443 1.00 0.00 O ATOM 14782 H1 WAT 6276 110.078 12.050 111.878 1.00 0.00 H ATOM 14783 H2 WAT 6276 109.068 13.122 112.226 1.00 0.00 H TER 14785 WAT 6276 ATOM 14785 O WAT 6277 93.835 126.856 158.071 1.00 0.00 O ATOM 14786 H1 WAT 6277 93.215 126.244 157.674 1.00 0.00 H ATOM 14787 H2 WAT 6277 94.058 126.458 158.912 1.00 0.00 H TER 14789 WAT 6277 ATOM 14789 O WAT 6278 91.587 107.664 23.088 1.00 0.00 O ATOM 14790 H1 WAT 6278 90.930 107.327 23.697 1.00 0.00 H ATOM 14791 H2 WAT 6278 92.091 108.294 23.603 1.00 0.00 H TER 14793 WAT 6278 ATOM 14793 O WAT 6279 131.080 119.318 155.338 1.00 0.00 O ATOM 14794 H1 WAT 6279 130.436 118.616 155.438 1.00 0.00 H ATOM 14795 H2 WAT 6279 130.875 119.713 154.491 1.00 0.00 H TER 14797 WAT 6279 ATOM 14797 O WAT 6280 80.025 49.814 91.114 1.00 0.00 O ATOM 14798 H1 WAT 6280 79.325 49.189 91.304 1.00 0.00 H ATOM 14799 H2 WAT 6280 80.826 49.366 91.385 1.00 0.00 H TER 14801 WAT 6280 ATOM 14801 O WAT 6281 19.264 76.004 95.893 1.00 0.00 O ATOM 14802 H1 WAT 6281 18.961 76.766 95.400 1.00 0.00 H ATOM 14803 H2 WAT 6281 18.669 75.950 96.641 1.00 0.00 H TER 14805 WAT 6281 ATOM 14805 O WAT 6282 120.200 113.952 81.308 1.00 0.00 O ATOM 14806 H1 WAT 6282 121.149 113.959 81.429 1.00 0.00 H ATOM 14807 H2 WAT 6282 119.989 114.839 81.016 1.00 0.00 H TER 14809 WAT 6282 ATOM 14809 O WAT 6283 50.399 88.199 2.739 1.00 0.00 O ATOM 14810 H1 WAT 6283 50.284 88.496 1.837 1.00 0.00 H ATOM 14811 H2 WAT 6283 51.284 88.477 2.972 1.00 0.00 H TER 14813 WAT 6283 ATOM 14813 O WAT 6284 75.161 7.219 90.327 1.00 0.00 O ATOM 14814 H1 WAT 6284 74.476 6.649 89.978 1.00 0.00 H ATOM 14815 H2 WAT 6284 75.494 7.689 89.563 1.00 0.00 H TER 14817 WAT 6284 ATOM 14817 O WAT 6285 81.907 117.939 61.719 1.00 0.00 O ATOM 14818 H1 WAT 6285 82.780 118.025 61.336 1.00 0.00 H ATOM 14819 H2 WAT 6285 81.493 117.236 61.217 1.00 0.00 H TER 14821 WAT 6285 ATOM 14821 O WAT 6286 139.015 100.973 136.115 1.00 0.00 O ATOM 14822 H1 WAT 6286 139.592 100.665 136.814 1.00 0.00 H ATOM 14823 H2 WAT 6286 138.438 101.606 136.542 1.00 0.00 H TER 14825 WAT 6286 ATOM 14825 O WAT 6287 128.901 18.352 112.870 1.00 0.00 O ATOM 14826 H1 WAT 6287 128.810 17.406 112.985 1.00 0.00 H ATOM 14827 H2 WAT 6287 129.142 18.460 111.950 1.00 0.00 H TER 14829 WAT 6287 ATOM 14829 O WAT 6288 143.747 126.387 92.301 1.00 0.00 O ATOM 14830 H1 WAT 6288 143.052 125.744 92.440 1.00 0.00 H ATOM 14831 H2 WAT 6288 143.385 127.208 92.636 1.00 0.00 H TER 14833 WAT 6288 ATOM 14833 O WAT 6289 71.137 83.005 6.184 1.00 0.00 O ATOM 14834 H1 WAT 6289 70.488 83.487 5.671 1.00 0.00 H ATOM 14835 H2 WAT 6289 70.635 82.618 6.901 1.00 0.00 H TER 14837 WAT 6289 ATOM 14837 O WAT 6290 125.196 2.068 88.137 1.00 0.00 O ATOM 14838 H1 WAT 6290 124.775 2.557 88.845 1.00 0.00 H ATOM 14839 H2 WAT 6290 126.073 2.446 88.073 1.00 0.00 H TER 14841 WAT 6290 ATOM 14841 O WAT 6291 11.579 64.342 126.667 1.00 0.00 O ATOM 14842 H1 WAT 6291 12.257 63.687 126.499 1.00 0.00 H ATOM 14843 H2 WAT 6291 11.441 64.766 125.820 1.00 0.00 H TER 14845 WAT 6291 ATOM 14845 O WAT 6292 106.089 12.917 86.828 1.00 0.00 O ATOM 14846 H1 WAT 6292 106.972 13.273 86.929 1.00 0.00 H ATOM 14847 H2 WAT 6292 105.609 13.599 86.357 1.00 0.00 H TER 14849 WAT 6292 ATOM 14849 O WAT 6293 19.100 45.233 147.729 1.00 0.00 O ATOM 14850 H1 WAT 6293 19.386 45.933 147.143 1.00 0.00 H ATOM 14851 H2 WAT 6293 18.802 45.688 148.517 1.00 0.00 H TER 14853 WAT 6293 ATOM 14853 O WAT 6294 69.718 9.289 10.909 1.00 0.00 O ATOM 14854 H1 WAT 6294 69.735 9.612 11.810 1.00 0.00 H ATOM 14855 H2 WAT 6294 69.177 8.501 10.947 1.00 0.00 H TER 14857 WAT 6294 ATOM 14857 O WAT 6295 112.402 73.903 12.831 1.00 0.00 O ATOM 14858 H1 WAT 6295 112.503 74.823 12.588 1.00 0.00 H ATOM 14859 H2 WAT 6295 113.224 73.679 13.268 1.00 0.00 H TER 14861 WAT 6295 ATOM 14861 O WAT 6296 49.287 101.611 90.671 1.00 0.00 O ATOM 14862 H1 WAT 6296 49.433 101.577 91.616 1.00 0.00 H ATOM 14863 H2 WAT 6296 48.574 100.991 90.516 1.00 0.00 H TER 14865 WAT 6296 ATOM 14865 O WAT 6297 74.541 119.499 15.666 1.00 0.00 O ATOM 14866 H1 WAT 6297 73.618 119.683 15.843 1.00 0.00 H ATOM 14867 H2 WAT 6297 74.922 120.355 15.470 1.00 0.00 H TER 14869 WAT 6297 ATOM 14869 O WAT 6298 59.343 14.954 75.300 1.00 0.00 O ATOM 14870 H1 WAT 6298 58.800 15.733 75.184 1.00 0.00 H ATOM 14871 H2 WAT 6298 58.920 14.470 76.009 1.00 0.00 H TER 14873 WAT 6298 ATOM 14873 O WAT 6299 87.094 82.575 85.088 1.00 0.00 O ATOM 14874 H1 WAT 6299 87.176 83.478 85.395 1.00 0.00 H ATOM 14875 H2 WAT 6299 87.028 82.055 85.889 1.00 0.00 H TER 14877 WAT 6299 ATOM 14877 O WAT 6300 133.971 106.818 155.673 1.00 0.00 O ATOM 14878 H1 WAT 6300 134.584 107.003 156.384 1.00 0.00 H ATOM 14879 H2 WAT 6300 134.197 107.451 154.991 1.00 0.00 H TER 14881 WAT 6300 ATOM 14881 O WAT 6301 96.539 72.895 84.543 1.00 0.00 O ATOM 14882 H1 WAT 6301 96.277 73.368 85.333 1.00 0.00 H ATOM 14883 H2 WAT 6301 97.068 73.524 84.052 1.00 0.00 H TER 14885 WAT 6301 ATOM 14885 O WAT 6302 97.724 134.278 140.418 1.00 0.00 O ATOM 14886 H1 WAT 6302 96.925 133.824 140.148 1.00 0.00 H ATOM 14887 H2 WAT 6302 98.306 133.581 140.719 1.00 0.00 H TER 14889 WAT 6302 ATOM 14889 O WAT 6303 109.468 80.929 12.160 1.00 0.00 O ATOM 14890 H1 WAT 6303 110.008 80.364 12.713 1.00 0.00 H ATOM 14891 H2 WAT 6303 108.591 80.867 12.539 1.00 0.00 H TER 14893 WAT 6303 ATOM 14893 O WAT 6304 33.408 82.622 1.056 1.00 0.00 O ATOM 14894 H1 WAT 6304 33.660 83.195 0.332 1.00 0.00 H ATOM 14895 H2 WAT 6304 34.100 82.740 1.707 1.00 0.00 H TER 14897 WAT 6304 ATOM 14897 O WAT 6305 52.674 39.141 69.217 1.00 0.00 O ATOM 14898 H1 WAT 6305 52.804 39.828 68.563 1.00 0.00 H ATOM 14899 H2 WAT 6305 52.737 38.324 68.722 1.00 0.00 H TER 14901 WAT 6305 ATOM 14901 O WAT 6306 114.761 103.960 112.650 1.00 0.00 O ATOM 14902 H1 WAT 6306 114.995 103.281 113.283 1.00 0.00 H ATOM 14903 H2 WAT 6306 113.852 103.770 112.420 1.00 0.00 H TER 14905 WAT 6306 ATOM 14905 O WAT 6307 108.144 76.602 69.998 1.00 0.00 O ATOM 14906 H1 WAT 6307 107.377 76.335 69.491 1.00 0.00 H ATOM 14907 H2 WAT 6307 108.041 77.547 70.109 1.00 0.00 H TER 14909 WAT 6307 ATOM 14909 O WAT 6308 23.572 26.253 148.755 1.00 0.00 O ATOM 14910 H1 WAT 6308 23.098 25.447 148.552 1.00 0.00 H ATOM 14911 H2 WAT 6308 22.906 26.838 149.117 1.00 0.00 H TER 14913 WAT 6308 ATOM 14913 O WAT 6309 68.686 63.795 71.698 1.00 0.00 O ATOM 14914 H1 WAT 6309 68.716 64.279 72.523 1.00 0.00 H ATOM 14915 H2 WAT 6309 68.231 64.382 71.094 1.00 0.00 H TER 14917 WAT 6309 ATOM 14917 O WAT 6310 36.060 63.462 66.690 1.00 0.00 O ATOM 14918 H1 WAT 6310 36.937 63.716 66.402 1.00 0.00 H ATOM 14919 H2 WAT 6310 36.191 63.100 67.566 1.00 0.00 H TER 14921 WAT 6310 ATOM 14921 O WAT 6311 35.237 144.468 154.552 1.00 0.00 O ATOM 14922 H1 WAT 6311 35.420 145.275 155.033 1.00 0.00 H ATOM 14923 H2 WAT 6311 36.051 143.968 154.603 1.00 0.00 H TER 14925 WAT 6311 ATOM 14925 O WAT 6312 59.889 24.143 67.733 1.00 0.00 O ATOM 14926 H1 WAT 6312 59.306 23.400 67.887 1.00 0.00 H ATOM 14927 H2 WAT 6312 59.431 24.891 68.118 1.00 0.00 H TER 14929 WAT 6312 ATOM 14929 O WAT 6313 38.147 23.293 73.844 1.00 0.00 O ATOM 14930 H1 WAT 6313 37.490 22.685 74.183 1.00 0.00 H ATOM 14931 H2 WAT 6313 38.419 22.911 73.009 1.00 0.00 H TER 14933 WAT 6313 ATOM 14933 O WAT 6314 46.181 27.791 118.814 1.00 0.00 O ATOM 14934 H1 WAT 6314 45.515 28.346 119.219 1.00 0.00 H ATOM 14935 H2 WAT 6314 45.818 27.568 117.957 1.00 0.00 H TER 14937 WAT 6314 ATOM 14937 O WAT 6315 68.883 19.609 135.658 1.00 0.00 O ATOM 14938 H1 WAT 6315 68.408 19.852 136.452 1.00 0.00 H ATOM 14939 H2 WAT 6315 69.097 18.684 135.781 1.00 0.00 H TER 14941 WAT 6315 ATOM 14941 O WAT 6316 82.381 141.021 92.475 1.00 0.00 O ATOM 14942 H1 WAT 6316 83.178 141.036 93.004 1.00 0.00 H ATOM 14943 H2 WAT 6316 81.745 140.550 93.013 1.00 0.00 H TER 14945 WAT 6316 ATOM 14945 O WAT 6317 74.694 10.516 109.195 1.00 0.00 O ATOM 14946 H1 WAT 6317 74.485 11.315 108.712 1.00 0.00 H ATOM 14947 H2 WAT 6317 75.003 9.905 108.526 1.00 0.00 H TER 14949 WAT 6317 ATOM 14949 O WAT 6318 126.882 75.980 71.490 1.00 0.00 O ATOM 14950 H1 WAT 6318 126.673 75.208 72.016 1.00 0.00 H ATOM 14951 H2 WAT 6318 126.086 76.150 70.987 1.00 0.00 H TER 14953 WAT 6318 ATOM 14953 O WAT 6319 9.738 53.323 118.376 1.00 0.00 O ATOM 14954 H1 WAT 6319 10.050 52.430 118.227 1.00 0.00 H ATOM 14955 H2 WAT 6319 9.546 53.658 117.500 1.00 0.00 H TER 14957 WAT 6319 ATOM 14957 O WAT 6320 114.892 37.934 140.023 1.00 0.00 O ATOM 14958 H1 WAT 6320 115.767 38.317 139.958 1.00 0.00 H ATOM 14959 H2 WAT 6320 115.014 37.146 140.553 1.00 0.00 H TER 14961 WAT 6320 ATOM 14961 O WAT 6321 136.053 66.278 108.079 1.00 0.00 O ATOM 14962 H1 WAT 6321 136.902 66.502 108.459 1.00 0.00 H ATOM 14963 H2 WAT 6321 135.774 67.075 107.629 1.00 0.00 H TER 14965 WAT 6321 ATOM 14965 O WAT 6322 97.376 120.796 154.163 1.00 0.00 O ATOM 14966 H1 WAT 6322 98.030 120.267 153.706 1.00 0.00 H ATOM 14967 H2 WAT 6322 96.541 120.377 153.955 1.00 0.00 H TER 14969 WAT 6322 ATOM 14969 O WAT 6323 70.130 137.372 80.979 1.00 0.00 O ATOM 14970 H1 WAT 6323 70.422 138.236 80.687 1.00 0.00 H ATOM 14971 H2 WAT 6323 69.196 137.352 80.769 1.00 0.00 H TER 14973 WAT 6323 ATOM 14973 O WAT 6324 119.876 75.807 96.856 1.00 0.00 O ATOM 14974 H1 WAT 6324 120.564 75.593 97.485 1.00 0.00 H ATOM 14975 H2 WAT 6324 119.070 75.494 97.266 1.00 0.00 H TER 14977 WAT 6324 ATOM 14977 O WAT 6325 81.733 99.979 127.367 1.00 0.00 O ATOM 14978 H1 WAT 6325 81.819 99.914 128.318 1.00 0.00 H ATOM 14979 H2 WAT 6325 81.672 100.919 127.195 1.00 0.00 H TER 14981 WAT 6325 ATOM 14981 O WAT 6326 77.458 99.235 93.869 1.00 0.00 O ATOM 14982 H1 WAT 6326 77.460 99.084 94.814 1.00 0.00 H ATOM 14983 H2 WAT 6326 78.200 98.726 93.543 1.00 0.00 H TER 14985 WAT 6326 ATOM 14985 O WAT 6327 63.224 13.756 118.167 1.00 0.00 O ATOM 14986 H1 WAT 6327 62.774 13.807 117.323 1.00 0.00 H ATOM 14987 H2 WAT 6327 62.651 14.226 118.773 1.00 0.00 H TER 14989 WAT 6327 ATOM 14989 O WAT 6328 42.011 31.426 10.622 1.00 0.00 O ATOM 14990 H1 WAT 6328 41.472 31.206 9.862 1.00 0.00 H ATOM 14991 H2 WAT 6328 41.426 31.314 11.371 1.00 0.00 H TER 14993 WAT 6328 ATOM 14993 O WAT 6329 120.450 100.873 140.176 1.00 0.00 O ATOM 14994 H1 WAT 6329 121.195 101.391 140.482 1.00 0.00 H ATOM 14995 H2 WAT 6329 120.766 99.970 140.188 1.00 0.00 H TER 14997 WAT 6329 ATOM 14997 O WAT 6330 133.309 102.553 131.707 1.00 0.00 O ATOM 14998 H1 WAT 6330 132.883 102.561 130.850 1.00 0.00 H ATOM 14999 H2 WAT 6330 134.116 102.057 131.569 1.00 0.00 H TER 15001 WAT 6330 ATOM 15001 O WAT 6331 120.583 6.648 0.689 1.00 0.00 O ATOM 15002 H1 WAT 6331 120.055 5.855 0.591 1.00 0.00 H ATOM 15003 H2 WAT 6331 120.236 7.072 1.473 1.00 0.00 H TER 15005 WAT 6331 ATOM 15005 O WAT 6332 118.275 1.643 110.896 1.00 0.00 O ATOM 15006 H1 WAT 6332 117.877 0.783 110.762 1.00 0.00 H ATOM 15007 H2 WAT 6332 117.660 2.107 111.464 1.00 0.00 H TER 15009 WAT 6332 ATOM 15009 O WAT 6333 81.903 107.532 137.544 1.00 0.00 O ATOM 15010 H1 WAT 6333 81.429 107.119 136.823 1.00 0.00 H ATOM 15011 H2 WAT 6333 82.186 108.377 137.193 1.00 0.00 H TER 15013 WAT 6333 ATOM 15013 O WAT 6334 55.877 137.297 134.385 1.00 0.00 O ATOM 15014 H1 WAT 6334 56.702 136.837 134.233 1.00 0.00 H ATOM 15015 H2 WAT 6334 56.090 138.221 134.249 1.00 0.00 H TER 15017 WAT 6334 ATOM 15017 O WAT 6335 22.129 54.076 81.870 1.00 0.00 O ATOM 15018 H1 WAT 6335 22.467 54.834 82.347 1.00 0.00 H ATOM 15019 H2 WAT 6335 22.107 54.359 80.956 1.00 0.00 H TER 15021 WAT 6335 ATOM 15021 O WAT 6336 36.318 45.802 125.068 1.00 0.00 O ATOM 15022 H1 WAT 6336 36.228 44.895 125.360 1.00 0.00 H ATOM 15023 H2 WAT 6336 35.507 46.226 125.350 1.00 0.00 H TER 15025 WAT 6336 ATOM 15025 O WAT 6337 103.260 64.028 118.315 1.00 0.00 O ATOM 15026 H1 WAT 6337 102.728 63.253 118.492 1.00 0.00 H ATOM 15027 H2 WAT 6337 104.146 63.687 118.191 1.00 0.00 H TER 15029 WAT 6337 ATOM 15029 O WAT 6338 54.813 76.505 66.762 1.00 0.00 O ATOM 15030 H1 WAT 6338 53.899 76.327 66.539 1.00 0.00 H ATOM 15031 H2 WAT 6338 55.314 76.131 66.038 1.00 0.00 H TER 15033 WAT 6338 ATOM 15033 O WAT 6339 44.976 25.173 155.250 1.00 0.00 O ATOM 15034 H1 WAT 6339 44.050 24.931 155.231 1.00 0.00 H ATOM 15035 H2 WAT 6339 45.429 24.417 154.878 1.00 0.00 H TER 15037 WAT 6339 ATOM 15037 O WAT 6340 109.025 89.708 110.666 1.00 0.00 O ATOM 15038 H1 WAT 6340 109.108 89.572 109.723 1.00 0.00 H ATOM 15039 H2 WAT 6340 108.516 90.514 110.749 1.00 0.00 H TER 15041 WAT 6340 ATOM 15041 O WAT 6341 37.596 61.568 155.594 1.00 0.00 O ATOM 15042 H1 WAT 6341 37.417 60.633 155.497 1.00 0.00 H ATOM 15043 H2 WAT 6341 38.427 61.701 155.138 1.00 0.00 H TER 15045 WAT 6341 ATOM 15045 O WAT 6342 118.993 1.682 91.835 1.00 0.00 O ATOM 15046 H1 WAT 6342 119.166 2.554 92.189 1.00 0.00 H ATOM 15047 H2 WAT 6342 119.059 1.791 90.886 1.00 0.00 H TER 15049 WAT 6342 ATOM 15049 O WAT 6343 47.836 114.445 121.067 1.00 0.00 O ATOM 15050 H1 WAT 6343 46.960 114.812 121.188 1.00 0.00 H ATOM 15051 H2 WAT 6343 48.404 115.000 121.601 1.00 0.00 H TER 15053 WAT 6343 ATOM 15053 O WAT 6344 108.185 30.176 147.835 1.00 0.00 O ATOM 15054 H1 WAT 6344 108.503 29.860 146.990 1.00 0.00 H ATOM 15055 H2 WAT 6344 108.195 29.402 148.399 1.00 0.00 H TER 15057 WAT 6344 ATOM 15057 O WAT 6345 55.338 30.527 72.410 1.00 0.00 O ATOM 15058 H1 WAT 6345 55.084 30.360 73.317 1.00 0.00 H ATOM 15059 H2 WAT 6345 55.653 29.682 72.089 1.00 0.00 H TER 15061 WAT 6345 ATOM 15061 O WAT 6346 28.547 -0.194 117.629 1.00 0.00 O ATOM 15062 H1 WAT 6346 27.682 0.156 117.413 1.00 0.00 H ATOM 15063 H2 WAT 6346 29.154 0.510 117.398 1.00 0.00 H TER 15065 WAT 6346 ATOM 15065 O WAT 6347 140.097 125.791 89.012 1.00 0.00 O ATOM 15066 H1 WAT 6347 139.712 126.267 89.748 1.00 0.00 H ATOM 15067 H2 WAT 6347 140.949 126.206 88.878 1.00 0.00 H TER 15069 WAT 6347 ATOM 15069 O WAT 6348 119.028 87.387 79.677 1.00 0.00 O ATOM 15070 H1 WAT 6348 119.548 87.317 78.877 1.00 0.00 H ATOM 15071 H2 WAT 6348 119.236 88.256 80.023 1.00 0.00 H TER 15073 WAT 6348 ATOM 15073 O WAT 6349 42.165 117.272 15.413 1.00 0.00 O ATOM 15074 H1 WAT 6349 41.937 118.185 15.585 1.00 0.00 H ATOM 15075 H2 WAT 6349 42.921 117.104 15.975 1.00 0.00 H TER 15077 WAT 6349 ATOM 15077 O WAT 6350 52.853 21.493 16.483 1.00 0.00 O ATOM 15078 H1 WAT 6350 53.548 22.151 16.474 1.00 0.00 H ATOM 15079 H2 WAT 6350 52.262 21.777 17.180 1.00 0.00 H TER 15081 WAT 6350 ATOM 15081 O WAT 6351 68.395 127.224 145.870 1.00 0.00 O ATOM 15082 H1 WAT 6351 68.952 126.933 145.148 1.00 0.00 H ATOM 15083 H2 WAT 6351 67.649 126.623 145.853 1.00 0.00 H TER 15085 WAT 6351 ATOM 15085 O WAT 6352 12.943 107.673 119.605 1.00 0.00 O ATOM 15086 H1 WAT 6352 12.502 107.155 118.931 1.00 0.00 H ATOM 15087 H2 WAT 6352 13.700 107.144 119.856 1.00 0.00 H TER 15089 WAT 6352 ATOM 15089 O WAT 6353 52.345 115.145 117.217 1.00 0.00 O ATOM 15090 H1 WAT 6353 52.045 115.544 116.401 1.00 0.00 H ATOM 15091 H2 WAT 6353 52.264 115.841 117.869 1.00 0.00 H TER 15093 WAT 6353 ATOM 15093 O WAT 6354 123.814 86.225 16.901 1.00 0.00 O ATOM 15094 H1 WAT 6354 123.428 85.742 16.170 1.00 0.00 H ATOM 15095 H2 WAT 6354 123.918 87.117 16.571 1.00 0.00 H TER 15097 WAT 6354 ATOM 15097 O WAT 6355 21.221 116.889 115.882 1.00 0.00 O ATOM 15098 H1 WAT 6355 21.809 117.621 116.069 1.00 0.00 H ATOM 15099 H2 WAT 6355 21.729 116.313 115.311 1.00 0.00 H TER 15101 WAT 6355 ATOM 15101 O WAT 6356 21.872 88.316 156.683 1.00 0.00 O ATOM 15102 H1 WAT 6356 22.327 88.165 157.512 1.00 0.00 H ATOM 15103 H2 WAT 6356 21.638 89.244 156.705 1.00 0.00 H TER 15105 WAT 6356 ATOM 15105 O WAT 6357 124.443 7.692 124.330 1.00 0.00 O ATOM 15106 H1 WAT 6357 124.954 8.110 125.023 1.00 0.00 H ATOM 15107 H2 WAT 6357 125.038 7.661 123.580 1.00 0.00 H TER 15109 WAT 6357 ATOM 15109 O WAT 6358 8.845 6.299 64.962 1.00 0.00 O ATOM 15110 H1 WAT 6358 9.570 5.952 64.441 1.00 0.00 H ATOM 15111 H2 WAT 6358 8.219 6.624 64.314 1.00 0.00 H TER 15113 WAT 6358 ATOM 15113 O WAT 6359 35.618 64.185 122.856 1.00 0.00 O ATOM 15114 H1 WAT 6359 35.384 64.423 123.753 1.00 0.00 H ATOM 15115 H2 WAT 6359 35.684 63.230 122.871 1.00 0.00 H TER 15117 WAT 6359 ATOM 15117 O WAT 6360 4.785 72.007 14.937 1.00 0.00 O ATOM 15118 H1 WAT 6360 4.974 71.594 14.095 1.00 0.00 H ATOM 15119 H2 WAT 6360 3.831 72.085 14.956 1.00 0.00 H TER 15121 WAT 6360 ATOM 15121 O WAT 6361 116.604 90.330 79.808 1.00 0.00 O ATOM 15122 H1 WAT 6361 116.341 90.074 80.692 1.00 0.00 H ATOM 15123 H2 WAT 6361 117.164 91.096 79.938 1.00 0.00 H TER 15125 WAT 6361 ATOM 15125 O WAT 6362 111.491 30.796 97.600 1.00 0.00 O ATOM 15126 H1 WAT 6362 110.793 31.430 97.761 1.00 0.00 H ATOM 15127 H2 WAT 6362 111.261 30.394 96.762 1.00 0.00 H TER 15129 WAT 6362 ATOM 15129 O WAT 6363 6.957 109.187 4.462 1.00 0.00 O ATOM 15130 H1 WAT 6363 6.750 110.016 4.031 1.00 0.00 H ATOM 15131 H2 WAT 6363 7.673 109.401 5.061 1.00 0.00 H TER 15133 WAT 6363 ATOM 15133 O WAT 6364 87.720 141.316 130.676 1.00 0.00 O ATOM 15134 H1 WAT 6364 88.261 141.195 129.896 1.00 0.00 H ATOM 15135 H2 WAT 6364 87.513 142.251 130.680 1.00 0.00 H TER 15137 WAT 6364 ATOM 15137 O WAT 6365 115.253 123.053 100.332 1.00 0.00 O ATOM 15138 H1 WAT 6365 115.364 122.279 100.884 1.00 0.00 H ATOM 15139 H2 WAT 6365 114.515 122.837 99.763 1.00 0.00 H TER 15141 WAT 6365 ATOM 15141 O WAT 6366 121.145 0.287 125.751 1.00 0.00 O ATOM 15142 H1 WAT 6366 121.523 0.867 125.091 1.00 0.00 H ATOM 15143 H2 WAT 6366 120.766 0.879 126.401 1.00 0.00 H TER 15145 WAT 6366 ATOM 15145 O WAT 6367 27.294 67.728 97.665 1.00 0.00 O ATOM 15146 H1 WAT 6367 28.058 68.249 97.911 1.00 0.00 H ATOM 15147 H2 WAT 6367 27.026 68.083 96.817 1.00 0.00 H TER 15149 WAT 6367 ATOM 15149 O WAT 6368 2.413 9.392 147.862 1.00 0.00 O ATOM 15150 H1 WAT 6368 2.251 8.458 147.996 1.00 0.00 H ATOM 15151 H2 WAT 6368 3.366 9.475 147.880 1.00 0.00 H TER 15153 WAT 6368 ATOM 15153 O WAT 6369 35.607 109.540 89.210 1.00 0.00 O ATOM 15154 H1 WAT 6369 35.554 109.455 88.258 1.00 0.00 H ATOM 15155 H2 WAT 6369 36.490 109.243 89.428 1.00 0.00 H TER 15157 WAT 6369 ATOM 15157 O WAT 6370 70.768 11.674 58.541 1.00 0.00 O ATOM 15158 H1 WAT 6370 71.379 12.114 57.950 1.00 0.00 H ATOM 15159 H2 WAT 6370 71.196 10.844 58.754 1.00 0.00 H TER 15161 WAT 6370 ATOM 15161 O WAT 6371 144.251 80.412 82.578 1.00 0.00 O ATOM 15162 H1 WAT 6371 144.869 79.845 83.039 1.00 0.00 H ATOM 15163 H2 WAT 6371 143.720 80.803 83.271 1.00 0.00 H TER 15165 WAT 6371 ATOM 15165 O WAT 6372 13.635 123.747 146.962 1.00 0.00 O ATOM 15166 H1 WAT 6372 14.219 124.464 146.713 1.00 0.00 H ATOM 15167 H2 WAT 6372 13.636 123.759 147.919 1.00 0.00 H TER 15169 WAT 6372 ATOM 15169 O WAT 6373 11.158 47.703 73.143 1.00 0.00 O ATOM 15170 H1 WAT 6373 11.518 46.863 72.859 1.00 0.00 H ATOM 15171 H2 WAT 6373 11.926 48.233 73.355 1.00 0.00 H TER 15173 WAT 6373 ATOM 15173 O WAT 6374 12.754 77.998 98.877 1.00 0.00 O ATOM 15174 H1 WAT 6374 13.177 78.218 98.047 1.00 0.00 H ATOM 15175 H2 WAT 6374 13.236 78.501 99.533 1.00 0.00 H TER 15177 WAT 6374 ATOM 15177 O WAT 6375 116.070 58.625 81.879 1.00 0.00 O ATOM 15178 H1 WAT 6375 116.617 57.855 82.031 1.00 0.00 H ATOM 15179 H2 WAT 6375 116.552 59.346 82.284 1.00 0.00 H TER 15181 WAT 6375 ATOM 15181 O WAT 6376 51.020 1.700 95.927 1.00 0.00 O ATOM 15182 H1 WAT 6376 50.748 2.595 96.129 1.00 0.00 H ATOM 15183 H2 WAT 6376 50.202 1.235 95.751 1.00 0.00 H TER 15185 WAT 6376 ATOM 15185 O WAT 6377 15.700 14.257 0.791 1.00 0.00 O ATOM 15186 H1 WAT 6377 15.603 14.792 0.003 1.00 0.00 H ATOM 15187 H2 WAT 6377 15.671 13.355 0.473 1.00 0.00 H TER 15189 WAT 6377 ATOM 15189 O WAT 6378 32.783 22.366 121.746 1.00 0.00 O ATOM 15190 H1 WAT 6378 32.595 23.228 122.117 1.00 0.00 H ATOM 15191 H2 WAT 6378 33.507 22.519 121.139 1.00 0.00 H TER 15193 WAT 6378 ATOM 15193 O WAT 6379 118.338 36.717 122.630 1.00 0.00 O ATOM 15194 H1 WAT 6379 117.438 36.520 122.889 1.00 0.00 H ATOM 15195 H2 WAT 6379 118.612 35.955 122.119 1.00 0.00 H TER 15197 WAT 6379 ATOM 15197 O WAT 6380 19.465 137.888 151.580 1.00 0.00 O ATOM 15198 H1 WAT 6380 19.564 137.655 150.657 1.00 0.00 H ATOM 15199 H2 WAT 6380 20.296 138.302 151.813 1.00 0.00 H TER 15201 WAT 6380 ATOM 15201 O WAT 6381 29.420 30.915 110.324 1.00 0.00 O ATOM 15202 H1 WAT 6381 29.834 30.523 109.555 1.00 0.00 H ATOM 15203 H2 WAT 6381 28.749 31.496 109.966 1.00 0.00 H TER 15205 WAT 6381 ATOM 15205 O WAT 6382 133.682 91.021 81.724 1.00 0.00 O ATOM 15206 H1 WAT 6382 134.392 91.286 81.139 1.00 0.00 H ATOM 15207 H2 WAT 6382 134.120 90.552 82.434 1.00 0.00 H TER 15209 WAT 6382 ATOM 15209 O WAT 6383 3.198 117.769 129.965 1.00 0.00 O ATOM 15210 H1 WAT 6383 2.445 117.613 129.395 1.00 0.00 H ATOM 15211 H2 WAT 6383 3.809 118.268 129.424 1.00 0.00 H TER 15213 WAT 6383 ATOM 15213 O WAT 6384 13.219 107.231 129.179 1.00 0.00 O ATOM 15214 H1 WAT 6384 12.622 106.747 128.609 1.00 0.00 H ATOM 15215 H2 WAT 6384 14.072 107.156 128.751 1.00 0.00 H TER 15217 WAT 6384 ATOM 15217 O WAT 6385 50.228 64.891 120.438 1.00 0.00 O ATOM 15218 H1 WAT 6385 49.967 64.108 120.923 1.00 0.00 H ATOM 15219 H2 WAT 6385 49.447 65.445 120.441 1.00 0.00 H TER 15221 WAT 6385 ATOM 15221 O WAT 6386 105.402 31.594 21.622 1.00 0.00 O ATOM 15222 H1 WAT 6386 104.835 32.042 22.249 1.00 0.00 H ATOM 15223 H2 WAT 6386 104.854 30.897 21.259 1.00 0.00 H TER 15225 WAT 6386 ATOM 15225 O WAT 6387 118.028 130.883 13.895 1.00 0.00 O ATOM 15226 H1 WAT 6387 118.551 130.849 13.094 1.00 0.00 H ATOM 15227 H2 WAT 6387 118.192 131.756 14.251 1.00 0.00 H TER 15229 WAT 6387 ATOM 15229 O WAT 6388 24.107 109.302 81.371 1.00 0.00 O ATOM 15230 H1 WAT 6388 23.973 110.201 81.669 1.00 0.00 H ATOM 15231 H2 WAT 6388 24.606 108.888 82.074 1.00 0.00 H TER 15233 WAT 6388 ATOM 15233 O WAT 6389 129.011 57.867 146.819 1.00 0.00 O ATOM 15234 H1 WAT 6389 129.346 57.115 147.308 1.00 0.00 H ATOM 15235 H2 WAT 6389 129.026 57.583 145.905 1.00 0.00 H TER 15237 WAT 6389 ATOM 15237 O WAT 6390 141.787 113.327 24.608 1.00 0.00 O ATOM 15238 H1 WAT 6390 142.180 112.483 24.831 1.00 0.00 H ATOM 15239 H2 WAT 6390 141.617 113.743 25.454 1.00 0.00 H TER 15241 WAT 6390 ATOM 15241 O WAT 6391 35.085 40.034 150.120 1.00 0.00 O ATOM 15242 H1 WAT 6391 35.456 39.162 150.252 1.00 0.00 H ATOM 15243 H2 WAT 6391 34.636 40.230 150.942 1.00 0.00 H TER 15245 WAT 6391 ATOM 15245 O WAT 6392 40.766 127.344 78.441 1.00 0.00 O ATOM 15246 H1 WAT 6392 40.286 127.377 79.268 1.00 0.00 H ATOM 15247 H2 WAT 6392 41.546 126.825 78.636 1.00 0.00 H TER 15249 WAT 6392 ATOM 15249 O WAT 6393 48.716 115.906 139.759 1.00 0.00 O ATOM 15250 H1 WAT 6393 47.957 116.472 139.902 1.00 0.00 H ATOM 15251 H2 WAT 6393 48.664 115.665 138.834 1.00 0.00 H TER 15253 WAT 6393 ATOM 15253 O WAT 6394 34.711 11.272 17.369 1.00 0.00 O ATOM 15254 H1 WAT 6394 35.394 10.645 17.609 1.00 0.00 H ATOM 15255 H2 WAT 6394 35.076 11.750 16.624 1.00 0.00 H TER 15257 WAT 6394 ATOM 15257 O WAT 6395 80.989 58.973 131.093 1.00 0.00 O ATOM 15258 H1 WAT 6395 80.083 59.008 130.785 1.00 0.00 H ATOM 15259 H2 WAT 6395 81.394 58.285 130.565 1.00 0.00 H TER 15261 WAT 6395 ATOM 15261 O WAT 6396 20.317 31.463 97.760 1.00 0.00 O ATOM 15262 H1 WAT 6396 20.185 30.516 97.727 1.00 0.00 H ATOM 15263 H2 WAT 6396 19.452 31.832 97.582 1.00 0.00 H TER 15265 WAT 6396 ATOM 15265 O WAT 6397 23.471 130.192 105.012 1.00 0.00 O ATOM 15266 H1 WAT 6397 24.419 130.060 105.031 1.00 0.00 H ATOM 15267 H2 WAT 6397 23.125 129.520 105.599 1.00 0.00 H TER 15269 WAT 6397 ATOM 15269 O WAT 6398 124.272 110.153 21.025 1.00 0.00 O ATOM 15270 H1 WAT 6398 123.928 110.158 21.919 1.00 0.00 H ATOM 15271 H2 WAT 6398 124.499 109.238 20.861 1.00 0.00 H TER 15273 WAT 6398 ATOM 15273 O WAT 6399 60.084 116.264 98.599 1.00 0.00 O ATOM 15274 H1 WAT 6399 59.703 115.985 97.766 1.00 0.00 H ATOM 15275 H2 WAT 6399 59.524 115.865 99.264 1.00 0.00 H TER 15277 WAT 6399 ATOM 15277 O WAT 6400 98.776 43.269 118.440 1.00 0.00 O ATOM 15278 H1 WAT 6400 97.963 43.576 118.842 1.00 0.00 H ATOM 15279 H2 WAT 6400 98.567 43.188 117.510 1.00 0.00 H TER 15281 WAT 6400 ATOM 15281 O WAT 6401 49.172 112.376 58.859 1.00 0.00 O ATOM 15282 H1 WAT 6401 49.992 112.140 59.292 1.00 0.00 H ATOM 15283 H2 WAT 6401 49.309 113.274 58.558 1.00 0.00 H TER 15285 WAT 6401 ATOM 15285 O WAT 6402 88.883 108.806 93.181 1.00 0.00 O ATOM 15286 H1 WAT 6402 89.521 109.474 93.435 1.00 0.00 H ATOM 15287 H2 WAT 6402 88.040 109.162 93.461 1.00 0.00 H TER 15289 WAT 6402 ATOM 15289 O WAT 6403 45.882 94.013 130.415 1.00 0.00 O ATOM 15290 H1 WAT 6403 46.277 94.178 129.558 1.00 0.00 H ATOM 15291 H2 WAT 6403 46.308 94.640 130.999 1.00 0.00 H TER 15293 WAT 6403 ATOM 15293 O WAT 6404 15.940 35.247 111.225 1.00 0.00 O ATOM 15294 H1 WAT 6404 16.579 35.676 111.795 1.00 0.00 H ATOM 15295 H2 WAT 6404 16.470 34.730 110.619 1.00 0.00 H TER 15297 WAT 6404 ATOM 15297 O WAT 6405 30.572 99.154 72.432 1.00 0.00 O ATOM 15298 H1 WAT 6405 29.978 99.288 73.171 1.00 0.00 H ATOM 15299 H2 WAT 6405 30.427 98.245 72.170 1.00 0.00 H TER 15301 WAT 6405 ATOM 15301 O WAT 6406 145.941 116.713 147.380 1.00 0.00 O ATOM 15302 H1 WAT 6406 146.048 117.602 147.042 1.00 0.00 H ATOM 15303 H2 WAT 6406 145.414 116.267 146.718 1.00 0.00 H TER 15305 WAT 6406 ATOM 15305 O WAT 6407 99.232 81.772 139.038 1.00 0.00 O ATOM 15306 H1 WAT 6407 98.810 82.574 138.729 1.00 0.00 H ATOM 15307 H2 WAT 6407 100.017 81.690 138.497 1.00 0.00 H TER 15309 WAT 6407 ATOM 15309 O WAT 6408 85.950 51.395 62.856 1.00 0.00 O ATOM 15310 H1 WAT 6408 86.293 50.504 62.926 1.00 0.00 H ATOM 15311 H2 WAT 6408 86.323 51.730 62.041 1.00 0.00 H TER 15313 WAT 6408 ATOM 15313 O WAT 6409 65.908 92.858 122.069 1.00 0.00 O ATOM 15314 H1 WAT 6409 66.611 92.307 121.726 1.00 0.00 H ATOM 15315 H2 WAT 6409 65.588 93.340 121.307 1.00 0.00 H TER 15317 WAT 6409 ATOM 15317 O WAT 6410 107.726 87.937 94.547 1.00 0.00 O ATOM 15318 H1 WAT 6410 107.391 88.807 94.330 1.00 0.00 H ATOM 15319 H2 WAT 6410 108.665 87.991 94.371 1.00 0.00 H TER 15321 WAT 6410 ATOM 15321 O WAT 6411 35.304 87.486 124.392 1.00 0.00 O ATOM 15322 H1 WAT 6411 34.793 86.967 123.770 1.00 0.00 H ATOM 15323 H2 WAT 6411 34.932 87.270 125.247 1.00 0.00 H TER 15325 WAT 6411 ATOM 15325 O WAT 6412 105.569 60.461 8.459 1.00 0.00 O ATOM 15326 H1 WAT 6412 105.550 59.559 8.779 1.00 0.00 H ATOM 15327 H2 WAT 6412 105.601 60.996 9.251 1.00 0.00 H TER 15329 WAT 6412 ATOM 15329 O WAT 6413 81.345 67.249 120.193 1.00 0.00 O ATOM 15330 H1 WAT 6413 80.443 67.541 120.325 1.00 0.00 H ATOM 15331 H2 WAT 6413 81.811 67.550 120.973 1.00 0.00 H TER 15333 WAT 6413 ATOM 15333 O WAT 6414 13.525 0.278 118.611 1.00 0.00 O ATOM 15334 H1 WAT 6414 12.988 -0.466 118.337 1.00 0.00 H ATOM 15335 H2 WAT 6414 13.430 0.304 119.563 1.00 0.00 H TER 15337 WAT 6414 ATOM 15337 O WAT 6415 67.736 124.946 57.902 1.00 0.00 O ATOM 15338 H1 WAT 6415 68.600 125.143 57.538 1.00 0.00 H ATOM 15339 H2 WAT 6415 67.260 124.536 57.180 1.00 0.00 H TER 15341 WAT 6415 ATOM 15341 O WAT 6416 90.326 106.606 151.346 1.00 0.00 O ATOM 15342 H1 WAT 6416 89.582 107.128 151.647 1.00 0.00 H ATOM 15343 H2 WAT 6416 90.263 105.791 151.844 1.00 0.00 H TER 15345 WAT 6416 ATOM 15345 O WAT 6417 80.663 116.006 148.037 1.00 0.00 O ATOM 15346 H1 WAT 6417 80.268 116.873 148.129 1.00 0.00 H ATOM 15347 H2 WAT 6417 80.015 115.408 148.408 1.00 0.00 H TER 15349 WAT 6417 ATOM 15349 O WAT 6418 37.334 35.985 99.271 1.00 0.00 O ATOM 15350 H1 WAT 6418 37.474 36.622 98.570 1.00 0.00 H ATOM 15351 H2 WAT 6418 38.210 35.813 99.617 1.00 0.00 H TER 15353 WAT 6418 ATOM 15353 O WAT 6419 11.458 108.797 116.045 1.00 0.00 O ATOM 15354 H1 WAT 6419 11.899 109.576 115.706 1.00 0.00 H ATOM 15355 H2 WAT 6419 10.702 109.138 116.522 1.00 0.00 H TER 15357 WAT 6419 ATOM 15357 O WAT 6420 145.557 109.022 109.436 1.00 0.00 O ATOM 15358 H1 WAT 6420 144.649 109.187 109.180 1.00 0.00 H ATOM 15359 H2 WAT 6420 145.546 108.135 109.797 1.00 0.00 H TER 15361 WAT 6420 ATOM 15361 O WAT 6421 103.795 23.119 151.143 1.00 0.00 O ATOM 15362 H1 WAT 6421 103.524 23.755 151.805 1.00 0.00 H ATOM 15363 H2 WAT 6421 103.280 22.336 151.338 1.00 0.00 H TER 15365 WAT 6421 ATOM 15365 O WAT 6422 104.326 90.311 64.395 1.00 0.00 O ATOM 15366 H1 WAT 6422 103.889 90.756 63.669 1.00 0.00 H ATOM 15367 H2 WAT 6422 104.202 89.379 64.214 1.00 0.00 H TER 15369 WAT 6422 ATOM 15369 O WAT 6423 19.984 106.168 143.679 1.00 0.00 O ATOM 15370 H1 WAT 6423 20.110 105.348 144.158 1.00 0.00 H ATOM 15371 H2 WAT 6423 19.665 106.784 144.338 1.00 0.00 H TER 15373 WAT 6423 ATOM 15373 O WAT 6424 73.919 4.941 103.559 1.00 0.00 O ATOM 15374 H1 WAT 6424 73.470 4.846 104.398 1.00 0.00 H ATOM 15375 H2 WAT 6424 73.364 4.473 102.935 1.00 0.00 H TER 15377 WAT 6424 ATOM 15377 O WAT 6425 26.202 59.909 108.654 1.00 0.00 O ATOM 15378 H1 WAT 6425 25.617 60.566 108.277 1.00 0.00 H ATOM 15379 H2 WAT 6425 26.997 60.395 108.877 1.00 0.00 H TER 15381 WAT 6425 ATOM 15381 O WAT 6426 129.001 71.994 133.662 1.00 0.00 O ATOM 15382 H1 WAT 6426 129.302 72.810 134.061 1.00 0.00 H ATOM 15383 H2 WAT 6426 128.086 71.918 133.932 1.00 0.00 H TER 15385 WAT 6426 ATOM 15385 O WAT 6427 80.045 35.870 100.714 1.00 0.00 O ATOM 15386 H1 WAT 6427 79.886 34.934 100.837 1.00 0.00 H ATOM 15387 H2 WAT 6427 79.210 36.285 100.931 1.00 0.00 H TER 15389 WAT 6427 ATOM 15389 O WAT 6428 26.593 109.780 7.171 1.00 0.00 O ATOM 15390 H1 WAT 6428 27.417 109.302 7.081 1.00 0.00 H ATOM 15391 H2 WAT 6428 26.039 109.438 6.469 1.00 0.00 H TER 15393 WAT 6428 ATOM 15393 O WAT 6429 77.877 138.684 143.373 1.00 0.00 O ATOM 15394 H1 WAT 6429 78.522 138.042 143.671 1.00 0.00 H ATOM 15395 H2 WAT 6429 78.183 138.945 142.504 1.00 0.00 H TER 15397 WAT 6429 ATOM 15397 O WAT 6430 87.229 72.622 105.928 1.00 0.00 O ATOM 15398 H1 WAT 6430 87.216 71.666 105.964 1.00 0.00 H ATOM 15399 H2 WAT 6430 86.312 72.879 106.026 1.00 0.00 H TER 15401 WAT 6430 ATOM 15401 O WAT 6431 104.445 66.797 153.326 1.00 0.00 O ATOM 15402 H1 WAT 6431 104.586 65.851 153.364 1.00 0.00 H ATOM 15403 H2 WAT 6431 105.112 67.162 153.908 1.00 0.00 H TER 15405 WAT 6431 ATOM 15405 O WAT 6432 83.221 22.023 139.697 1.00 0.00 O ATOM 15406 H1 WAT 6432 83.308 22.872 139.264 1.00 0.00 H ATOM 15407 H2 WAT 6432 82.596 22.178 140.405 1.00 0.00 H TER 15409 WAT 6432 ATOM 15409 O WAT 6433 58.967 66.448 15.767 1.00 0.00 O ATOM 15410 H1 WAT 6433 58.168 65.931 15.666 1.00 0.00 H ATOM 15411 H2 WAT 6433 58.658 67.320 16.015 1.00 0.00 H TER 15413 WAT 6433 ATOM 15413 O WAT 6434 43.427 86.301 90.645 1.00 0.00 O ATOM 15414 H1 WAT 6434 42.971 86.811 89.975 1.00 0.00 H ATOM 15415 H2 WAT 6434 44.353 86.380 90.417 1.00 0.00 H TER 15417 WAT 6434 ATOM 15417 O WAT 6435 5.073 36.081 134.358 1.00 0.00 O ATOM 15418 H1 WAT 6435 6.012 36.172 134.195 1.00 0.00 H ATOM 15419 H2 WAT 6435 4.676 36.808 133.878 1.00 0.00 H TER 15421 WAT 6435 ATOM 15421 O WAT 6436 142.054 143.667 142.677 1.00 0.00 O ATOM 15422 H1 WAT 6436 141.456 143.041 142.268 1.00 0.00 H ATOM 15423 H2 WAT 6436 141.829 143.640 143.607 1.00 0.00 H TER 15425 WAT 6436 ATOM 15425 O WAT 6437 27.122 112.132 125.757 1.00 0.00 O ATOM 15426 H1 WAT 6437 26.276 112.406 126.111 1.00 0.00 H ATOM 15427 H2 WAT 6437 27.489 112.928 125.372 1.00 0.00 H TER 15429 WAT 6437 ATOM 15429 O WAT 6438 26.637 121.096 68.562 1.00 0.00 O ATOM 15430 H1 WAT 6438 27.163 121.642 69.146 1.00 0.00 H ATOM 15431 H2 WAT 6438 26.624 120.237 68.983 1.00 0.00 H TER 15433 WAT 6438 ATOM 15433 O WAT 6439 98.077 30.249 13.844 1.00 0.00 O ATOM 15434 H1 WAT 6439 97.373 30.896 13.817 1.00 0.00 H ATOM 15435 H2 WAT 6439 98.050 29.830 12.983 1.00 0.00 H TER 15437 WAT 6439 ATOM 15437 O WAT 6440 70.444 91.819 138.556 1.00 0.00 O ATOM 15438 H1 WAT 6440 70.843 92.360 137.874 1.00 0.00 H ATOM 15439 H2 WAT 6440 70.426 92.383 139.329 1.00 0.00 H TER 15441 WAT 6440 ATOM 15441 O WAT 6441 29.365 17.185 4.694 1.00 0.00 O ATOM 15442 H1 WAT 6441 28.545 16.706 4.811 1.00 0.00 H ATOM 15443 H2 WAT 6441 29.995 16.518 4.422 1.00 0.00 H TER 15445 WAT 6441 ATOM 15445 O WAT 6442 83.460 75.225 104.239 1.00 0.00 O ATOM 15446 H1 WAT 6442 82.534 75.163 104.473 1.00 0.00 H ATOM 15447 H2 WAT 6442 83.458 75.497 103.322 1.00 0.00 H TER 15449 WAT 6442 ATOM 15449 O WAT 6443 102.565 21.724 14.438 1.00 0.00 O ATOM 15450 H1 WAT 6443 102.708 22.035 13.544 1.00 0.00 H ATOM 15451 H2 WAT 6443 103.445 21.639 14.805 1.00 0.00 H TER 15453 WAT 6443 ATOM 15453 O WAT 6444 42.661 20.183 103.513 1.00 0.00 O ATOM 15454 H1 WAT 6444 43.463 20.645 103.756 1.00 0.00 H ATOM 15455 H2 WAT 6444 42.189 20.800 102.954 1.00 0.00 H TER 15457 WAT 6444 ATOM 15457 O WAT 6445 82.641 69.661 96.394 1.00 0.00 O ATOM 15458 H1 WAT 6445 82.467 69.918 97.300 1.00 0.00 H ATOM 15459 H2 WAT 6445 81.776 69.472 96.029 1.00 0.00 H TER 15461 WAT 6445 ATOM 15461 O WAT 6446 127.777 125.592 148.753 1.00 0.00 O ATOM 15462 H1 WAT 6446 127.670 124.857 149.357 1.00 0.00 H ATOM 15463 H2 WAT 6446 128.060 125.189 147.933 1.00 0.00 H TER 15465 WAT 6446 ATOM 15465 O WAT 6447 79.490 141.605 5.315 1.00 0.00 O ATOM 15466 H1 WAT 6447 80.268 142.089 5.592 1.00 0.00 H ATOM 15467 H2 WAT 6447 79.786 140.698 5.241 1.00 0.00 H TER 15469 WAT 6447 ATOM 15469 O WAT 6448 105.696 76.395 151.454 1.00 0.00 O ATOM 15470 H1 WAT 6448 106.208 76.581 150.667 1.00 0.00 H ATOM 15471 H2 WAT 6448 105.756 75.445 151.559 1.00 0.00 H TER 15473 WAT 6448 ATOM 15473 O WAT 6449 28.280 97.124 137.759 1.00 0.00 O ATOM 15474 H1 WAT 6449 28.796 96.325 137.872 1.00 0.00 H ATOM 15475 H2 WAT 6449 28.589 97.494 136.932 1.00 0.00 H TER 15477 WAT 6449 ATOM 15477 O WAT 6450 45.624 108.782 77.067 1.00 0.00 O ATOM 15478 H1 WAT 6450 44.972 109.467 77.216 1.00 0.00 H ATOM 15479 H2 WAT 6450 45.827 108.842 76.134 1.00 0.00 H TER 15481 WAT 6450 ATOM 15481 O WAT 6451 95.488 55.386 123.002 1.00 0.00 O ATOM 15482 H1 WAT 6451 95.843 54.957 122.224 1.00 0.00 H ATOM 15483 H2 WAT 6451 96.186 55.319 123.653 1.00 0.00 H TER 15485 WAT 6451 ATOM 15485 O WAT 6452 128.992 87.238 98.642 1.00 0.00 O ATOM 15486 H1 WAT 6452 128.258 87.776 98.938 1.00 0.00 H ATOM 15487 H2 WAT 6452 129.131 86.611 99.351 1.00 0.00 H TER 15489 WAT 6452 ATOM 15489 O WAT 6453 117.216 56.035 141.470 1.00 0.00 O ATOM 15490 H1 WAT 6453 116.629 56.418 140.818 1.00 0.00 H ATOM 15491 H2 WAT 6453 117.385 55.149 141.149 1.00 0.00 H TER 15493 WAT 6453 ATOM 15493 O WAT 6454 98.991 55.198 136.615 1.00 0.00 O ATOM 15494 H1 WAT 6454 99.844 55.248 137.046 1.00 0.00 H ATOM 15495 H2 WAT 6454 98.659 56.096 136.636 1.00 0.00 H TER 15497 WAT 6454 ATOM 15497 O WAT 6455 140.013 75.637 103.414 1.00 0.00 O ATOM 15498 H1 WAT 6455 140.466 74.796 103.358 1.00 0.00 H ATOM 15499 H2 WAT 6455 139.198 75.502 102.930 1.00 0.00 H TER 15501 WAT 6455 ATOM 15501 O WAT 6456 92.485 108.244 111.873 1.00 0.00 O ATOM 15502 H1 WAT 6456 92.602 108.932 111.218 1.00 0.00 H ATOM 15503 H2 WAT 6456 91.705 108.508 112.361 1.00 0.00 H TER 15505 WAT 6456 ATOM 15505 O WAT 6457 38.249 71.356 124.139 1.00 0.00 O ATOM 15506 H1 WAT 6457 37.402 71.802 124.165 1.00 0.00 H ATOM 15507 H2 WAT 6457 38.885 72.057 124.001 1.00 0.00 H TER 15509 WAT 6457 ATOM 15509 O WAT 6458 12.899 75.375 22.642 1.00 0.00 O ATOM 15510 H1 WAT 6458 12.855 75.725 21.753 1.00 0.00 H ATOM 15511 H2 WAT 6458 13.711 75.733 23.001 1.00 0.00 H TER 15513 WAT 6458 ATOM 15513 O WAT 6459 104.668 3.498 149.404 1.00 0.00 O ATOM 15514 H1 WAT 6459 104.904 4.374 149.709 1.00 0.00 H ATOM 15515 H2 WAT 6459 105.270 3.328 148.679 1.00 0.00 H TER 15517 WAT 6459 ATOM 15517 O WAT 6460 133.287 104.892 64.879 1.00 0.00 O ATOM 15518 H1 WAT 6460 134.198 105.173 64.788 1.00 0.00 H ATOM 15519 H2 WAT 6460 133.314 104.205 65.545 1.00 0.00 H TER 15521 WAT 6460 ATOM 15521 O WAT 6461 145.270 130.791 71.622 1.00 0.00 O ATOM 15522 H1 WAT 6461 144.671 130.991 72.341 1.00 0.00 H ATOM 15523 H2 WAT 6461 146.096 131.201 71.878 1.00 0.00 H TER 15525 WAT 6461 ATOM 15525 O WAT 6462 30.430 117.931 22.255 1.00 0.00 O ATOM 15526 H1 WAT 6462 29.786 117.227 22.178 1.00 0.00 H ATOM 15527 H2 WAT 6462 30.063 118.649 21.739 1.00 0.00 H TER 15529 WAT 6462 ATOM 15529 O WAT 6463 54.447 106.552 132.231 1.00 0.00 O ATOM 15530 H1 WAT 6463 53.942 107.321 132.495 1.00 0.00 H ATOM 15531 H2 WAT 6463 54.936 106.305 133.016 1.00 0.00 H TER 15533 WAT 6463 ATOM 15533 O WAT 6464 129.057 106.983 88.732 1.00 0.00 O ATOM 15534 H1 WAT 6464 128.194 106.742 89.069 1.00 0.00 H ATOM 15535 H2 WAT 6464 129.366 106.196 88.284 1.00 0.00 H TER 15537 WAT 6464 ATOM 15537 O WAT 6465 102.985 132.818 67.647 1.00 0.00 O ATOM 15538 H1 WAT 6465 103.461 133.272 68.342 1.00 0.00 H ATOM 15539 H2 WAT 6465 103.507 132.036 67.469 1.00 0.00 H TER 15541 WAT 6465 ATOM 15541 O WAT 6466 145.498 125.218 155.234 1.00 0.00 O ATOM 15542 H1 WAT 6466 145.559 125.511 154.324 1.00 0.00 H ATOM 15543 H2 WAT 6466 144.564 125.062 155.372 1.00 0.00 H TER 15545 WAT 6466 ATOM 15545 O WAT 6467 116.082 45.626 106.187 1.00 0.00 O ATOM 15546 H1 WAT 6467 115.690 45.888 105.354 1.00 0.00 H ATOM 15547 H2 WAT 6467 116.792 46.252 106.325 1.00 0.00 H TER 15549 WAT 6467 ATOM 15549 O WAT 6468 48.182 66.977 145.485 1.00 0.00 O ATOM 15550 H1 WAT 6468 49.029 67.200 145.099 1.00 0.00 H ATOM 15551 H2 WAT 6468 47.539 67.371 144.896 1.00 0.00 H TER 15553 WAT 6468 ATOM 15553 O WAT 6469 91.841 52.801 110.100 1.00 0.00 O ATOM 15554 H1 WAT 6469 91.961 52.595 111.027 1.00 0.00 H ATOM 15555 H2 WAT 6469 91.515 51.987 109.714 1.00 0.00 H TER 15557 WAT 6469 ATOM 15557 O WAT 6470 63.823 70.244 69.383 1.00 0.00 O ATOM 15558 H1 WAT 6470 63.615 70.965 68.790 1.00 0.00 H ATOM 15559 H2 WAT 6470 63.700 70.610 70.259 1.00 0.00 H TER 15561 WAT 6470 ATOM 15561 O WAT 6471 110.213 104.644 15.467 1.00 0.00 O ATOM 15562 H1 WAT 6471 110.455 105.510 15.794 1.00 0.00 H ATOM 15563 H2 WAT 6471 111.014 104.308 15.064 1.00 0.00 H TER 15565 WAT 6471 ATOM 15565 O WAT 6472 28.220 14.739 110.283 1.00 0.00 O ATOM 15566 H1 WAT 6472 27.771 15.412 109.773 1.00 0.00 H ATOM 15567 H2 WAT 6472 27.560 14.426 110.902 1.00 0.00 H TER 15569 WAT 6472 ATOM 15569 O WAT 6473 47.431 127.128 80.228 1.00 0.00 O ATOM 15570 H1 WAT 6473 47.652 126.973 79.309 1.00 0.00 H ATOM 15571 H2 WAT 6473 47.392 126.253 80.615 1.00 0.00 H TER 15573 WAT 6473 ATOM 15573 O WAT 6474 103.592 87.653 13.323 1.00 0.00 O ATOM 15574 H1 WAT 6474 103.620 88.292 14.035 1.00 0.00 H ATOM 15575 H2 WAT 6474 103.754 88.168 12.532 1.00 0.00 H TER 15577 WAT 6474 ATOM 15577 O WAT 6475 87.077 78.296 94.028 1.00 0.00 O ATOM 15578 H1 WAT 6475 87.587 78.764 93.366 1.00 0.00 H ATOM 15579 H2 WAT 6475 86.504 78.964 94.405 1.00 0.00 H TER 15581 WAT 6475 ATOM 15581 O WAT 6476 8.842 6.015 106.993 1.00 0.00 O ATOM 15582 H1 WAT 6476 9.132 5.289 107.545 1.00 0.00 H ATOM 15583 H2 WAT 6476 8.914 5.680 106.099 1.00 0.00 H TER 15585 WAT 6476 ATOM 15585 O WAT 6477 117.599 114.122 94.507 1.00 0.00 O ATOM 15586 H1 WAT 6477 116.983 114.747 94.889 1.00 0.00 H ATOM 15587 H2 WAT 6477 118.104 114.638 93.878 1.00 0.00 H TER 15589 WAT 6477 ATOM 15589 O WAT 6478 138.644 30.547 77.560 1.00 0.00 O ATOM 15590 H1 WAT 6478 138.236 30.009 76.882 1.00 0.00 H ATOM 15591 H2 WAT 6478 138.006 31.239 77.733 1.00 0.00 H TER 15593 WAT 6478 ATOM 15593 O WAT 6479 86.847 140.152 90.914 1.00 0.00 O ATOM 15594 H1 WAT 6479 87.703 140.400 90.563 1.00 0.00 H ATOM 15595 H2 WAT 6479 86.559 140.921 91.406 1.00 0.00 H TER 15597 WAT 6479 ATOM 15597 O WAT 6480 70.331 101.365 140.203 1.00 0.00 O ATOM 15598 H1 WAT 6480 70.388 102.190 139.721 1.00 0.00 H ATOM 15599 H2 WAT 6480 70.876 100.757 139.703 1.00 0.00 H TER 15601 WAT 6480 ATOM 15601 O WAT 6481 111.585 121.428 77.903 1.00 0.00 O ATOM 15602 H1 WAT 6481 110.874 121.963 77.550 1.00 0.00 H ATOM 15603 H2 WAT 6481 111.213 120.549 77.971 1.00 0.00 H TER 15605 WAT 6481 ATOM 15605 O WAT 6482 43.174 23.636 66.679 1.00 0.00 O ATOM 15606 H1 WAT 6482 42.687 24.165 66.047 1.00 0.00 H ATOM 15607 H2 WAT 6482 43.955 23.353 66.203 1.00 0.00 H TER 15609 WAT 6482 ATOM 15609 O WAT 6483 13.317 141.797 131.641 1.00 0.00 O ATOM 15610 H1 WAT 6483 13.282 141.303 132.460 1.00 0.00 H ATOM 15611 H2 WAT 6483 13.870 142.552 131.840 1.00 0.00 H TER 15613 WAT 6483 ATOM 15613 O WAT 6484 66.063 58.315 127.172 1.00 0.00 O ATOM 15614 H1 WAT 6484 65.422 58.638 126.539 1.00 0.00 H ATOM 15615 H2 WAT 6484 66.082 57.368 127.032 1.00 0.00 H TER 15617 WAT 6484 ATOM 15617 O WAT 6485 51.966 79.635 15.701 1.00 0.00 O ATOM 15618 H1 WAT 6485 52.422 79.880 16.507 1.00 0.00 H ATOM 15619 H2 WAT 6485 51.093 79.372 15.991 1.00 0.00 H TER 15621 WAT 6485 ATOM 15621 O WAT 6486 46.218 95.476 155.482 1.00 0.00 O ATOM 15622 H1 WAT 6486 46.388 96.075 154.754 1.00 0.00 H ATOM 15623 H2 WAT 6486 45.587 94.848 155.132 1.00 0.00 H TER 15625 WAT 6486 ATOM 15625 O WAT 6487 55.840 26.074 114.522 1.00 0.00 O ATOM 15626 H1 WAT 6487 55.110 25.778 113.979 1.00 0.00 H ATOM 15627 H2 WAT 6487 56.539 26.270 113.898 1.00 0.00 H TER 15629 WAT 6487 ATOM 15629 O WAT 6488 49.601 104.608 80.075 1.00 0.00 O ATOM 15630 H1 WAT 6488 48.846 104.019 80.099 1.00 0.00 H ATOM 15631 H2 WAT 6488 50.353 104.029 79.950 1.00 0.00 H TER 15633 WAT 6488 ATOM 15633 O WAT 6489 57.165 87.772 125.509 1.00 0.00 O ATOM 15634 H1 WAT 6489 57.433 86.939 125.898 1.00 0.00 H ATOM 15635 H2 WAT 6489 56.910 88.313 126.256 1.00 0.00 H TER 15637 WAT 6489 ATOM 15637 O WAT 6490 96.506 104.132 28.339 1.00 0.00 O ATOM 15638 H1 WAT 6490 96.393 103.335 28.856 1.00 0.00 H ATOM 15639 H2 WAT 6490 96.785 104.792 28.974 1.00 0.00 H TER 15641 WAT 6490 ATOM 15641 O WAT 6491 59.362 137.670 95.399 1.00 0.00 O ATOM 15642 H1 WAT 6491 59.133 137.646 94.470 1.00 0.00 H ATOM 15643 H2 WAT 6491 59.080 136.820 95.738 1.00 0.00 H TER 15645 WAT 6491 ATOM 15645 O WAT 6492 10.076 107.777 93.131 1.00 0.00 O ATOM 15646 H1 WAT 6492 10.993 108.037 93.216 1.00 0.00 H ATOM 15647 H2 WAT 6492 10.060 107.203 92.364 1.00 0.00 H TER 15649 WAT 6492 ATOM 15649 O WAT 6493 55.794 13.993 52.461 1.00 0.00 O ATOM 15650 H1 WAT 6493 55.080 13.605 51.955 1.00 0.00 H ATOM 15651 H2 WAT 6493 55.720 14.934 52.297 1.00 0.00 H TER 15653 WAT 6493 ATOM 15653 O WAT 6494 65.740 101.675 64.926 1.00 0.00 O ATOM 15654 H1 WAT 6494 64.948 101.268 65.278 1.00 0.00 H ATOM 15655 H2 WAT 6494 65.640 102.606 65.126 1.00 0.00 H TER 15657 WAT 6494 ATOM 15657 O WAT 6495 55.709 77.397 141.964 1.00 0.00 O ATOM 15658 H1 WAT 6495 55.666 78.121 142.588 1.00 0.00 H ATOM 15659 H2 WAT 6495 56.025 76.655 142.479 1.00 0.00 H TER 15661 WAT 6495 ATOM 15661 O WAT 6496 30.919 75.227 79.839 1.00 0.00 O ATOM 15662 H1 WAT 6496 31.057 75.543 78.946 1.00 0.00 H ATOM 15663 H2 WAT 6496 30.722 76.016 80.344 1.00 0.00 H TER 15665 WAT 6496 ATOM 15665 O WAT 6497 143.033 137.598 72.380 1.00 0.00 O ATOM 15666 H1 WAT 6497 142.332 138.166 72.060 1.00 0.00 H ATOM 15667 H2 WAT 6497 143.093 136.900 71.727 1.00 0.00 H TER 15669 WAT 6497 ATOM 15669 O WAT 6498 63.209 18.880 95.137 1.00 0.00 O ATOM 15670 H1 WAT 6498 63.788 19.582 94.839 1.00 0.00 H ATOM 15671 H2 WAT 6498 62.419 18.979 94.605 1.00 0.00 H TER 15673 WAT 6498 ATOM 15673 O WAT 6499 95.227 10.857 98.708 1.00 0.00 O ATOM 15674 H1 WAT 6499 94.839 10.022 98.971 1.00 0.00 H ATOM 15675 H2 WAT 6499 95.082 11.435 99.457 1.00 0.00 H TER 15677 WAT 6499 ATOM 15677 O WAT 6500 54.003 42.278 103.578 1.00 0.00 O ATOM 15678 H1 WAT 6500 54.707 42.750 104.023 1.00 0.00 H ATOM 15679 H2 WAT 6500 53.681 42.894 102.920 1.00 0.00 H TER 15681 WAT 6500 ATOM 15681 O WAT 6501 54.439 56.071 75.609 1.00 0.00 O ATOM 15682 H1 WAT 6501 53.758 56.630 75.236 1.00 0.00 H ATOM 15683 H2 WAT 6501 54.823 55.625 74.854 1.00 0.00 H TER 15685 WAT 6501 ATOM 15685 O WAT 6502 51.545 142.466 93.376 1.00 0.00 O ATOM 15686 H1 WAT 6502 51.282 142.461 94.297 1.00 0.00 H ATOM 15687 H2 WAT 6502 52.299 143.055 93.346 1.00 0.00 H TER 15689 WAT 6502 ATOM 15689 O WAT 6503 96.215 41.091 63.381 1.00 0.00 O ATOM 15690 H1 WAT 6503 96.006 40.172 63.212 1.00 0.00 H ATOM 15691 H2 WAT 6503 96.478 41.436 62.528 1.00 0.00 H TER 15693 WAT 6503 ATOM 15693 O WAT 6504 87.919 89.698 138.254 1.00 0.00 O ATOM 15694 H1 WAT 6504 88.535 89.048 138.593 1.00 0.00 H ATOM 15695 H2 WAT 6504 87.387 89.217 137.620 1.00 0.00 H TER 15697 WAT 6504 ATOM 15697 O WAT 6505 21.340 122.355 112.390 1.00 0.00 O ATOM 15698 H1 WAT 6505 21.400 122.822 111.557 1.00 0.00 H ATOM 15699 H2 WAT 6505 22.246 122.286 112.692 1.00 0.00 H TER 15701 WAT 6505 ATOM 15701 O WAT 6506 63.966 130.575 86.173 1.00 0.00 O ATOM 15702 H1 WAT 6506 63.150 131.072 86.118 1.00 0.00 H ATOM 15703 H2 WAT 6506 64.363 130.858 86.998 1.00 0.00 H TER 15705 WAT 6506 ATOM 15705 O WAT 6507 106.942 124.973 114.020 1.00 0.00 O ATOM 15706 H1 WAT 6507 106.927 124.507 114.856 1.00 0.00 H ATOM 15707 H2 WAT 6507 106.038 124.934 113.707 1.00 0.00 H TER 15709 WAT 6507 ATOM 15709 O WAT 6508 24.331 64.347 113.901 1.00 0.00 O ATOM 15710 H1 WAT 6508 23.608 64.280 114.525 1.00 0.00 H ATOM 15711 H2 WAT 6508 24.483 63.446 113.614 1.00 0.00 H TER 15713 WAT 6508 ATOM 15713 O WAT 6509 75.210 1.061 123.939 1.00 0.00 O ATOM 15714 H1 WAT 6509 75.447 1.164 123.017 1.00 0.00 H ATOM 15715 H2 WAT 6509 75.501 0.178 124.164 1.00 0.00 H TER 15717 WAT 6509 ATOM 15717 O WAT 6510 24.030 20.704 3.487 1.00 0.00 O ATOM 15718 H1 WAT 6510 23.573 21.217 4.154 1.00 0.00 H ATOM 15719 H2 WAT 6510 23.769 21.103 2.657 1.00 0.00 H TER 15721 WAT 6510 ATOM 15721 O WAT 6511 91.185 42.962 87.557 1.00 0.00 O ATOM 15722 H1 WAT 6511 91.729 43.635 87.967 1.00 0.00 H ATOM 15723 H2 WAT 6511 90.689 42.581 88.281 1.00 0.00 H TER 15725 WAT 6511 ATOM 15725 O WAT 6512 116.442 129.437 138.866 1.00 0.00 O ATOM 15726 H1 WAT 6512 116.527 130.033 138.123 1.00 0.00 H ATOM 15727 H2 WAT 6512 117.311 129.426 139.266 1.00 0.00 H TER 15729 WAT 6512 ATOM 15729 O WAT 6513 93.905 87.646 70.418 1.00 0.00 O ATOM 15730 H1 WAT 6513 94.150 88.236 71.131 1.00 0.00 H ATOM 15731 H2 WAT 6513 93.130 88.051 70.029 1.00 0.00 H TER 15733 WAT 6513 ATOM 15733 O WAT 6514 100.064 139.230 52.420 1.00 0.00 O ATOM 15734 H1 WAT 6514 100.056 138.344 52.781 1.00 0.00 H ATOM 15735 H2 WAT 6514 100.993 139.437 52.315 1.00 0.00 H TER 15737 WAT 6514 ATOM 15737 O WAT 6515 7.110 74.414 126.241 1.00 0.00 O ATOM 15738 H1 WAT 6515 6.356 73.890 125.969 1.00 0.00 H ATOM 15739 H2 WAT 6515 7.642 73.815 126.763 1.00 0.00 H TER 15741 WAT 6515 ATOM 15741 O WAT 6516 72.186 67.392 133.256 1.00 0.00 O ATOM 15742 H1 WAT 6516 71.950 67.397 134.184 1.00 0.00 H ATOM 15743 H2 WAT 6516 72.469 68.289 133.077 1.00 0.00 H TER 15745 WAT 6516 ATOM 15745 O WAT 6517 138.348 24.553 97.845 1.00 0.00 O ATOM 15746 H1 WAT 6517 137.856 23.736 97.763 1.00 0.00 H ATOM 15747 H2 WAT 6517 139.126 24.314 98.350 1.00 0.00 H TER 15749 WAT 6517 ATOM 15749 O WAT 6518 116.494 74.298 66.554 1.00 0.00 O ATOM 15750 H1 WAT 6518 116.105 75.078 66.158 1.00 0.00 H ATOM 15751 H2 WAT 6518 116.658 74.547 67.464 1.00 0.00 H TER 15753 WAT 6518 ATOM 15753 O WAT 6519 127.540 82.176 19.385 1.00 0.00 O ATOM 15754 H1 WAT 6519 126.868 81.524 19.584 1.00 0.00 H ATOM 15755 H2 WAT 6519 127.126 83.016 19.588 1.00 0.00 H TER 15757 WAT 6519 ATOM 15757 O WAT 6520 87.173 134.284 143.764 1.00 0.00 O ATOM 15758 H1 WAT 6520 87.875 133.724 144.096 1.00 0.00 H ATOM 15759 H2 WAT 6520 87.627 135.026 143.365 1.00 0.00 H TER 15761 WAT 6520 ATOM 15761 O WAT 6521 89.783 126.610 56.114 1.00 0.00 O ATOM 15762 H1 WAT 6521 89.369 127.290 55.581 1.00 0.00 H ATOM 15763 H2 WAT 6521 89.166 125.879 56.090 1.00 0.00 H TER 15765 WAT 6521 ATOM 15765 O WAT 6522 48.395 120.703 118.415 1.00 0.00 O ATOM 15766 H1 WAT 6522 47.581 121.096 118.728 1.00 0.00 H ATOM 15767 H2 WAT 6522 49.081 121.133 118.926 1.00 0.00 H TER 15769 WAT 6522 ATOM 15769 O WAT 6523 84.717 135.317 84.335 1.00 0.00 O ATOM 15770 H1 WAT 6523 85.266 134.630 84.715 1.00 0.00 H ATOM 15771 H2 WAT 6523 85.171 136.132 84.550 1.00 0.00 H TER 15773 WAT 6523 ATOM 15773 O WAT 6524 13.732 2.668 100.353 1.00 0.00 O ATOM 15774 H1 WAT 6524 13.457 2.058 99.669 1.00 0.00 H ATOM 15775 H2 WAT 6524 13.386 2.292 101.163 1.00 0.00 H TER 15777 WAT 6524 ATOM 15777 O WAT 6525 123.220 76.214 157.518 1.00 0.00 O ATOM 15778 H1 WAT 6525 123.169 75.272 157.679 1.00 0.00 H ATOM 15779 H2 WAT 6525 122.317 76.476 157.340 1.00 0.00 H TER 15781 WAT 6525 ATOM 15781 O WAT 6526 52.317 28.529 137.228 1.00 0.00 O ATOM 15782 H1 WAT 6526 52.083 28.381 136.312 1.00 0.00 H ATOM 15783 H2 WAT 6526 53.221 28.222 137.297 1.00 0.00 H TER 15785 WAT 6526 ATOM 15785 O WAT 6527 37.072 133.989 62.233 1.00 0.00 O ATOM 15786 H1 WAT 6527 37.009 134.580 61.483 1.00 0.00 H ATOM 15787 H2 WAT 6527 37.717 134.401 62.809 1.00 0.00 H TER 15789 WAT 6527 ATOM 15789 O WAT 6528 145.360 9.817 136.899 1.00 0.00 O ATOM 15790 H1 WAT 6528 145.432 9.751 137.851 1.00 0.00 H ATOM 15791 H2 WAT 6528 144.514 9.417 136.695 1.00 0.00 H TER 15793 WAT 6528 ATOM 15793 O WAT 6529 78.809 38.252 83.985 1.00 0.00 O ATOM 15794 H1 WAT 6529 79.352 38.336 83.201 1.00 0.00 H ATOM 15795 H2 WAT 6529 77.966 37.935 83.660 1.00 0.00 H TER 15797 WAT 6529 ATOM 15797 O WAT 6530 130.458 107.672 90.897 1.00 0.00 O ATOM 15798 H1 WAT 6530 129.961 107.436 90.114 1.00 0.00 H ATOM 15799 H2 WAT 6530 131.353 107.393 90.706 1.00 0.00 H TER 15801 WAT 6530 ATOM 15801 O WAT 6531 96.522 38.211 114.389 1.00 0.00 O ATOM 15802 H1 WAT 6531 97.462 38.373 114.464 1.00 0.00 H ATOM 15803 H2 WAT 6531 96.301 38.487 113.500 1.00 0.00 H TER 15805 WAT 6531 ATOM 15805 O WAT 6532 47.064 141.836 61.773 1.00 0.00 O ATOM 15806 H1 WAT 6532 47.060 140.892 61.616 1.00 0.00 H ATOM 15807 H2 WAT 6532 47.636 142.190 61.092 1.00 0.00 H TER 15809 WAT 6532 ATOM 15809 O WAT 6533 17.088 104.136 67.282 1.00 0.00 O ATOM 15810 H1 WAT 6533 16.687 104.956 67.571 1.00 0.00 H ATOM 15811 H2 WAT 6533 16.765 104.013 66.390 1.00 0.00 H TER 15813 WAT 6533 ATOM 15813 O WAT 6534 109.556 127.152 9.575 1.00 0.00 O ATOM 15814 H1 WAT 6534 109.063 126.673 8.909 1.00 0.00 H ATOM 15815 H2 WAT 6534 109.590 126.556 10.323 1.00 0.00 H TER 15817 WAT 6534 ATOM 15817 O WAT 6535 25.769 37.707 141.800 1.00 0.00 O ATOM 15818 H1 WAT 6535 26.030 38.622 141.690 1.00 0.00 H ATOM 15819 H2 WAT 6535 26.230 37.241 141.102 1.00 0.00 H TER 15821 WAT 6535 ATOM 15821 O WAT 6536 13.474 58.574 80.871 1.00 0.00 O ATOM 15822 H1 WAT 6536 12.776 59.133 81.211 1.00 0.00 H ATOM 15823 H2 WAT 6536 14.244 58.810 81.387 1.00 0.00 H TER 15825 WAT 6536 ATOM 15825 O WAT 6537 81.312 128.531 108.689 1.00 0.00 O ATOM 15826 H1 WAT 6537 82.245 128.483 108.482 1.00 0.00 H ATOM 15827 H2 WAT 6537 80.877 128.162 107.920 1.00 0.00 H TER 15829 WAT 6537 ATOM 15829 O WAT 6538 89.633 68.265 156.712 1.00 0.00 O ATOM 15830 H1 WAT 6538 89.820 67.383 156.390 1.00 0.00 H ATOM 15831 H2 WAT 6538 88.838 68.526 156.247 1.00 0.00 H TER 15833 WAT 6538 ATOM 15833 O WAT 6539 18.638 114.059 125.016 1.00 0.00 O ATOM 15834 H1 WAT 6539 19.022 113.528 125.714 1.00 0.00 H ATOM 15835 H2 WAT 6539 18.211 113.425 124.441 1.00 0.00 H TER 15837 WAT 6539 ATOM 15837 O WAT 6540 50.760 80.135 89.762 1.00 0.00 O ATOM 15838 H1 WAT 6540 50.983 80.962 89.335 1.00 0.00 H ATOM 15839 H2 WAT 6540 49.868 80.265 90.084 1.00 0.00 H TER 15841 WAT 6540 ATOM 15841 O WAT 6541 73.437 145.227 94.877 1.00 0.00 O ATOM 15842 H1 WAT 6541 73.529 144.872 93.992 1.00 0.00 H ATOM 15843 H2 WAT 6541 74.323 145.492 95.122 1.00 0.00 H TER 15845 WAT 6541 ATOM 15845 O WAT 6542 80.410 72.550 83.830 1.00 0.00 O ATOM 15846 H1 WAT 6542 81.289 72.926 83.884 1.00 0.00 H ATOM 15847 H2 WAT 6542 80.284 72.113 84.672 1.00 0.00 H TER 15849 WAT 6542 ATOM 15849 O WAT 6543 129.921 69.467 76.861 1.00 0.00 O ATOM 15850 H1 WAT 6543 129.081 69.843 77.128 1.00 0.00 H ATOM 15851 H2 WAT 6543 129.933 69.559 75.909 1.00 0.00 H TER 15853 WAT 6543 ATOM 15853 O WAT 6544 129.816 61.069 88.881 1.00 0.00 O ATOM 15854 H1 WAT 6544 129.324 60.640 89.581 1.00 0.00 H ATOM 15855 H2 WAT 6544 130.011 61.940 89.226 1.00 0.00 H TER 15857 WAT 6544 ATOM 15857 O WAT 6545 141.289 19.343 145.516 1.00 0.00 O ATOM 15858 H1 WAT 6545 141.139 19.596 146.427 1.00 0.00 H ATOM 15859 H2 WAT 6545 141.750 20.089 145.133 1.00 0.00 H TER 15861 WAT 6545 ATOM 15861 O WAT 6546 134.320 39.111 105.422 1.00 0.00 O ATOM 15862 H1 WAT 6546 134.989 38.438 105.294 1.00 0.00 H ATOM 15863 H2 WAT 6546 133.670 38.934 104.742 1.00 0.00 H TER 15865 WAT 6546 ATOM 15865 O WAT 6547 132.645 92.778 78.042 1.00 0.00 O ATOM 15866 H1 WAT 6547 132.201 92.009 78.399 1.00 0.00 H ATOM 15867 H2 WAT 6547 131.984 93.469 78.065 1.00 0.00 H TER 15869 WAT 6547 ATOM 15869 O WAT 6548 48.264 66.839 120.739 1.00 0.00 O ATOM 15870 H1 WAT 6548 47.464 66.503 121.143 1.00 0.00 H ATOM 15871 H2 WAT 6548 48.403 67.690 121.154 1.00 0.00 H TER 15873 WAT 6548 ATOM 15873 O WAT 6549 69.730 127.530 66.467 1.00 0.00 O ATOM 15874 H1 WAT 6549 70.295 127.181 67.157 1.00 0.00 H ATOM 15875 H2 WAT 6549 70.023 127.089 65.670 1.00 0.00 H TER 15877 WAT 6549 ATOM 15877 O WAT 6550 84.002 129.334 57.706 1.00 0.00 O ATOM 15878 H1 WAT 6550 83.804 129.627 58.595 1.00 0.00 H ATOM 15879 H2 WAT 6550 83.884 128.384 57.735 1.00 0.00 H TER 15881 WAT 6550 ATOM 15881 O WAT 6551 11.817 9.153 13.436 1.00 0.00 O ATOM 15882 H1 WAT 6551 11.536 8.479 14.055 1.00 0.00 H ATOM 15883 H2 WAT 6551 12.492 9.643 13.905 1.00 0.00 H TER 15885 WAT 6551 ATOM 15885 O WAT 6552 1.433 76.884 149.054 1.00 0.00 O ATOM 15886 H1 WAT 6552 1.082 77.114 148.194 1.00 0.00 H ATOM 15887 H2 WAT 6552 0.883 77.364 149.674 1.00 0.00 H TER 15889 WAT 6552 ATOM 15889 O WAT 6553 130.468 31.337 84.197 1.00 0.00 O ATOM 15890 H1 WAT 6553 130.858 31.035 85.018 1.00 0.00 H ATOM 15891 H2 WAT 6553 130.314 32.272 84.334 1.00 0.00 H TER 15893 WAT 6553 ATOM 15893 O WAT 6554 30.844 133.301 105.130 1.00 0.00 O ATOM 15894 H1 WAT 6554 31.672 132.864 105.330 1.00 0.00 H ATOM 15895 H2 WAT 6554 31.002 134.222 105.338 1.00 0.00 H TER 15897 WAT 6554 ATOM 15897 O WAT 6555 99.877 61.040 109.582 1.00 0.00 O ATOM 15898 H1 WAT 6555 99.073 61.510 109.360 1.00 0.00 H ATOM 15899 H2 WAT 6555 100.436 61.146 108.813 1.00 0.00 H TER 15901 WAT 6555 ATOM 15901 O WAT 6556 44.037 4.762 83.498 1.00 0.00 O ATOM 15902 H1 WAT 6556 44.674 4.177 83.908 1.00 0.00 H ATOM 15903 H2 WAT 6556 43.783 4.314 82.692 1.00 0.00 H TER 15905 WAT 6556 ATOM 15905 O WAT 6557 36.743 100.293 146.676 1.00 0.00 O ATOM 15906 H1 WAT 6557 36.385 101.057 146.224 1.00 0.00 H ATOM 15907 H2 WAT 6557 37.668 100.283 146.433 1.00 0.00 H TER 15909 WAT 6557 ATOM 15909 O WAT 6558 135.993 61.670 84.988 1.00 0.00 O ATOM 15910 H1 WAT 6558 135.661 60.857 85.367 1.00 0.00 H ATOM 15911 H2 WAT 6558 135.220 62.093 84.614 1.00 0.00 H TER 15913 WAT 6558 ATOM 15913 O WAT 6559 131.000 110.157 131.811 1.00 0.00 O ATOM 15914 H1 WAT 6559 131.398 109.883 132.637 1.00 0.00 H ATOM 15915 H2 WAT 6559 130.350 109.480 131.622 1.00 0.00 H TER 15917 WAT 6559 ATOM 15917 O WAT 6560 60.742 9.964 7.901 1.00 0.00 O ATOM 15918 H1 WAT 6560 60.283 9.195 7.564 1.00 0.00 H ATOM 15919 H2 WAT 6560 60.704 9.868 8.853 1.00 0.00 H TER 15921 WAT 6560 ATOM 15921 O WAT 6561 52.533 74.289 153.153 1.00 0.00 O ATOM 15922 H1 WAT 6561 51.647 73.991 153.358 1.00 0.00 H ATOM 15923 H2 WAT 6561 52.425 74.851 152.385 1.00 0.00 H TER 15925 WAT 6561 ATOM 15925 O WAT 6562 59.544 142.993 125.140 1.00 0.00 O ATOM 15926 H1 WAT 6562 60.378 143.401 125.374 1.00 0.00 H ATOM 15927 H2 WAT 6562 59.748 142.454 124.376 1.00 0.00 H TER 15929 WAT 6562 ATOM 15929 O WAT 6563 30.988 85.324 122.551 1.00 0.00 O ATOM 15930 H1 WAT 6563 31.032 85.764 121.702 1.00 0.00 H ATOM 15931 H2 WAT 6563 31.740 84.731 122.552 1.00 0.00 H TER 15933 WAT 6563 ATOM 15933 O WAT 6564 85.491 99.825 111.379 1.00 0.00 O ATOM 15934 H1 WAT 6564 85.378 98.900 111.163 1.00 0.00 H ATOM 15935 H2 WAT 6564 85.601 100.258 110.532 1.00 0.00 H TER 15937 WAT 6564 ATOM 15937 O WAT 6565 134.711 100.909 122.768 1.00 0.00 O ATOM 15938 H1 WAT 6565 134.686 101.540 123.488 1.00 0.00 H ATOM 15939 H2 WAT 6565 134.083 101.249 122.131 1.00 0.00 H TER 15941 WAT 6565 ATOM 15941 O WAT 6566 104.374 133.906 152.258 1.00 0.00 O ATOM 15942 H1 WAT 6566 104.149 133.337 152.994 1.00 0.00 H ATOM 15943 H2 WAT 6566 104.751 133.315 151.605 1.00 0.00 H TER 15945 WAT 6566 ATOM 15945 O WAT 6567 11.959 20.578 133.511 1.00 0.00 O ATOM 15946 H1 WAT 6567 11.380 20.923 132.832 1.00 0.00 H ATOM 15947 H2 WAT 6567 12.716 21.165 133.501 1.00 0.00 H TER 15949 WAT 6567 ATOM 15949 O WAT 6568 27.557 140.012 106.096 1.00 0.00 O ATOM 15950 H1 WAT 6568 28.167 140.565 105.607 1.00 0.00 H ATOM 15951 H2 WAT 6568 27.814 140.123 107.011 1.00 0.00 H TER 15953 WAT 6568 ATOM 15953 O WAT 6569 72.432 37.472 65.913 1.00 0.00 O ATOM 15954 H1 WAT 6569 71.477 37.409 65.887 1.00 0.00 H ATOM 15955 H2 WAT 6569 72.675 37.087 66.755 1.00 0.00 H TER 15957 WAT 6569 ATOM 15957 O WAT 6570 58.385 85.715 120.292 1.00 0.00 O ATOM 15958 H1 WAT 6570 59.317 85.516 120.379 1.00 0.00 H ATOM 15959 H2 WAT 6570 58.085 85.856 121.190 1.00 0.00 H TER 15961 WAT 6570 ATOM 15961 O WAT 6571 121.601 38.029 123.466 1.00 0.00 O ATOM 15962 H1 WAT 6571 121.396 37.500 122.695 1.00 0.00 H ATOM 15963 H2 WAT 6571 121.182 38.872 123.297 1.00 0.00 H TER 15965 WAT 6571 ATOM 15965 O WAT 6572 145.052 75.031 65.671 1.00 0.00 O ATOM 15966 H1 WAT 6572 144.650 74.843 66.519 1.00 0.00 H ATOM 15967 H2 WAT 6572 145.115 74.177 65.241 1.00 0.00 H TER 15969 WAT 6572 ATOM 15969 O WAT 6573 42.676 116.986 141.369 1.00 0.00 O ATOM 15970 H1 WAT 6573 42.514 117.353 142.238 1.00 0.00 H ATOM 15971 H2 WAT 6573 42.401 116.072 141.441 1.00 0.00 H TER 15973 WAT 6573 ATOM 15973 O WAT 6574 107.871 21.645 94.591 1.00 0.00 O ATOM 15974 H1 WAT 6574 106.949 21.439 94.747 1.00 0.00 H ATOM 15975 H2 WAT 6574 108.024 21.385 93.683 1.00 0.00 H TER 15977 WAT 6574 ATOM 15977 O WAT 6575 45.610 30.887 7.982 1.00 0.00 O ATOM 15978 H1 WAT 6575 45.538 30.453 8.833 1.00 0.00 H ATOM 15979 H2 WAT 6575 45.887 30.194 7.383 1.00 0.00 H TER 15981 WAT 6575 ATOM 15981 O WAT 6576 65.080 4.440 4.009 1.00 0.00 O ATOM 15982 H1 WAT 6576 65.606 5.239 4.049 1.00 0.00 H ATOM 15983 H2 WAT 6576 64.809 4.379 3.093 1.00 0.00 H TER 15985 WAT 6576 ATOM 15985 O WAT 6577 64.081 5.416 149.027 1.00 0.00 O ATOM 15986 H1 WAT 6577 64.722 4.779 149.340 1.00 0.00 H ATOM 15987 H2 WAT 6577 63.387 5.402 149.686 1.00 0.00 H TER 15989 WAT 6577 ATOM 15989 O WAT 6578 112.618 43.109 149.509 1.00 0.00 O ATOM 15990 H1 WAT 6578 111.931 42.770 148.936 1.00 0.00 H ATOM 15991 H2 WAT 6578 112.454 42.690 150.354 1.00 0.00 H TER 15993 WAT 6578 ATOM 15993 O WAT 6579 27.001 131.341 86.752 1.00 0.00 O ATOM 15994 H1 WAT 6579 26.627 131.624 87.586 1.00 0.00 H ATOM 15995 H2 WAT 6579 26.241 131.156 86.200 1.00 0.00 H TER 15997 WAT 6579 ATOM 15997 O WAT 6580 55.782 58.332 132.174 1.00 0.00 O ATOM 15998 H1 WAT 6580 56.584 58.203 131.667 1.00 0.00 H ATOM 15999 H2 WAT 6580 55.633 57.490 132.605 1.00 0.00 H TER 16001 WAT 6580 ATOM 16001 O WAT 6581 10.065 2.229 138.564 1.00 0.00 O ATOM 16002 H1 WAT 6581 10.508 2.785 137.922 1.00 0.00 H ATOM 16003 H2 WAT 6581 10.258 2.637 139.408 1.00 0.00 H TER 16005 WAT 6581 ATOM 16005 O WAT 6582 68.620 115.412 13.031 1.00 0.00 O ATOM 16006 H1 WAT 6582 68.888 115.804 13.862 1.00 0.00 H ATOM 16007 H2 WAT 6582 67.689 115.620 12.956 1.00 0.00 H TER 16009 WAT 6582 ATOM 16009 O WAT 6583 17.721 111.596 109.360 1.00 0.00 O ATOM 16010 H1 WAT 6583 17.870 112.256 110.037 1.00 0.00 H ATOM 16011 H2 WAT 6583 17.138 110.958 109.771 1.00 0.00 H TER 16013 WAT 6583 ATOM 16013 O WAT 6584 9.049 70.842 122.515 1.00 0.00 O ATOM 16014 H1 WAT 6584 8.219 71.320 122.529 1.00 0.00 H ATOM 16015 H2 WAT 6584 8.810 69.941 122.730 1.00 0.00 H TER 16017 WAT 6584 ATOM 16017 O WAT 6585 59.246 57.043 72.634 1.00 0.00 O ATOM 16018 H1 WAT 6585 58.873 56.505 71.935 1.00 0.00 H ATOM 16019 H2 WAT 6585 60.185 57.061 72.447 1.00 0.00 H TER 16021 WAT 6585 ATOM 16021 O WAT 6586 46.531 35.400 104.411 1.00 0.00 O ATOM 16022 H1 WAT 6586 47.171 35.044 103.795 1.00 0.00 H ATOM 16023 H2 WAT 6586 46.799 36.311 104.535 1.00 0.00 H TER 16025 WAT 6586 ATOM 16025 O WAT 6587 144.939 40.988 154.095 1.00 0.00 O ATOM 16026 H1 WAT 6587 144.524 41.283 153.285 1.00 0.00 H ATOM 16027 H2 WAT 6587 144.485 40.173 154.314 1.00 0.00 H TER 16029 WAT 6587 ATOM 16029 O WAT 6588 141.815 99.959 111.110 1.00 0.00 O ATOM 16030 H1 WAT 6588 142.121 100.630 110.500 1.00 0.00 H ATOM 16031 H2 WAT 6588 140.904 99.805 110.859 1.00 0.00 H TER 16033 WAT 6588 ATOM 16033 O WAT 6589 124.680 22.552 101.425 1.00 0.00 O ATOM 16034 H1 WAT 6589 125.569 22.876 101.277 1.00 0.00 H ATOM 16035 H2 WAT 6589 124.657 22.337 102.357 1.00 0.00 H TER 16037 WAT 6589 ATOM 16037 O WAT 6590 68.721 86.585 156.146 1.00 0.00 O ATOM 16038 H1 WAT 6590 69.323 87.164 155.677 1.00 0.00 H ATOM 16039 H2 WAT 6590 69.164 86.399 156.974 1.00 0.00 H TER 16041 WAT 6590 ATOM 16041 O WAT 6591 31.261 8.529 155.648 1.00 0.00 O ATOM 16042 H1 WAT 6591 31.911 9.231 155.697 1.00 0.00 H ATOM 16043 H2 WAT 6591 30.613 8.847 155.019 1.00 0.00 H TER 16045 WAT 6591 ATOM 16045 O WAT 6592 61.973 103.630 136.728 1.00 0.00 O ATOM 16046 H1 WAT 6592 61.847 103.196 137.572 1.00 0.00 H ATOM 16047 H2 WAT 6592 61.792 102.950 136.080 1.00 0.00 H TER 16049 WAT 6592 ATOM 16049 O WAT 6593 98.094 113.968 109.718 1.00 0.00 O ATOM 16050 H1 WAT 6593 98.453 113.390 110.390 1.00 0.00 H ATOM 16051 H2 WAT 6593 98.861 114.303 109.254 1.00 0.00 H TER 16053 WAT 6593 ATOM 16053 O WAT 6594 67.731 7.314 53.149 1.00 0.00 O ATOM 16054 H1 WAT 6594 68.601 7.358 52.753 1.00 0.00 H ATOM 16055 H2 WAT 6594 67.140 7.635 52.468 1.00 0.00 H TER 16057 WAT 6594 ATOM 16057 O WAT 6595 54.972 110.153 114.592 1.00 0.00 O ATOM 16058 H1 WAT 6595 55.478 109.345 114.511 1.00 0.00 H ATOM 16059 H2 WAT 6595 55.565 110.839 114.285 1.00 0.00 H TER 16061 WAT 6595 ATOM 16061 O WAT 6596 13.510 134.248 85.549 1.00 0.00 O ATOM 16062 H1 WAT 6596 12.833 134.925 85.552 1.00 0.00 H ATOM 16063 H2 WAT 6596 13.732 134.136 84.625 1.00 0.00 H TER 16065 WAT 6596 ATOM 16065 O WAT 6597 101.828 9.527 69.123 1.00 0.00 O ATOM 16066 H1 WAT 6597 100.918 9.507 69.418 1.00 0.00 H ATOM 16067 H2 WAT 6597 102.341 9.391 69.919 1.00 0.00 H TER 16069 WAT 6597 ATOM 16069 O WAT 6598 16.917 119.797 18.237 1.00 0.00 O ATOM 16070 H1 WAT 6598 16.456 118.966 18.121 1.00 0.00 H ATOM 16071 H2 WAT 6598 16.341 120.313 18.803 1.00 0.00 H TER 16073 WAT 6598 ATOM 16073 O WAT 6599 142.992 102.795 151.702 1.00 0.00 O ATOM 16074 H1 WAT 6599 142.404 102.235 151.195 1.00 0.00 H ATOM 16075 H2 WAT 6599 143.850 102.673 151.294 1.00 0.00 H TER 16077 WAT 6599 ATOM 16077 O WAT 6600 112.488 45.977 152.916 1.00 0.00 O ATOM 16078 H1 WAT 6600 111.679 45.480 152.795 1.00 0.00 H ATOM 16079 H2 WAT 6600 112.832 45.676 153.757 1.00 0.00 H TER 16081 WAT 6600 ATOM 16081 O WAT 6601 23.417 92.840 138.978 1.00 0.00 O ATOM 16082 H1 WAT 6601 22.944 93.669 138.914 1.00 0.00 H ATOM 16083 H2 WAT 6601 23.266 92.547 139.877 1.00 0.00 H TER 16085 WAT 6601 ATOM 16085 O WAT 6602 142.869 77.258 107.308 1.00 0.00 O ATOM 16086 H1 WAT 6602 142.529 78.152 107.354 1.00 0.00 H ATOM 16087 H2 WAT 6602 142.618 76.864 108.144 1.00 0.00 H TER 16089 WAT 6602 ATOM 16089 O WAT 6603 20.329 69.943 142.040 1.00 0.00 O ATOM 16090 H1 WAT 6603 20.168 69.293 142.723 1.00 0.00 H ATOM 16091 H2 WAT 6603 20.924 69.507 141.429 1.00 0.00 H TER 16093 WAT 6603 ATOM 16093 O WAT 6604 28.311 129.546 101.700 1.00 0.00 O ATOM 16094 H1 WAT 6604 28.698 130.282 102.174 1.00 0.00 H ATOM 16095 H2 WAT 6604 27.479 129.385 102.145 1.00 0.00 H TER 16097 WAT 6604 ATOM 16097 O WAT 6605 34.151 138.470 70.460 1.00 0.00 O ATOM 16098 H1 WAT 6605 34.462 139.262 70.022 1.00 0.00 H ATOM 16099 H2 WAT 6605 34.367 137.761 69.854 1.00 0.00 H TER 16101 WAT 6605 ATOM 16101 O WAT 6606 134.268 49.111 114.933 1.00 0.00 O ATOM 16102 H1 WAT 6606 135.189 48.968 114.716 1.00 0.00 H ATOM 16103 H2 WAT 6606 133.789 48.538 114.335 1.00 0.00 H TER 16105 WAT 6606 ATOM 16105 O WAT 6607 57.516 94.134 133.276 1.00 0.00 O ATOM 16106 H1 WAT 6607 57.220 93.651 132.505 1.00 0.00 H ATOM 16107 H2 WAT 6607 56.851 93.956 133.941 1.00 0.00 H TER 16109 WAT 6607 ATOM 16109 O WAT 6608 91.555 52.952 154.282 1.00 0.00 O ATOM 16110 H1 WAT 6608 91.259 53.533 153.582 1.00 0.00 H ATOM 16111 H2 WAT 6608 92.255 53.439 154.718 1.00 0.00 H TER 16113 WAT 6608 ATOM 16113 O WAT 6609 72.427 91.324 120.359 1.00 0.00 O ATOM 16114 H1 WAT 6609 72.790 91.874 121.053 1.00 0.00 H ATOM 16115 H2 WAT 6609 73.061 91.391 119.644 1.00 0.00 H TER 16117 WAT 6609 ATOM 16117 O WAT 6610 104.071 102.155 6.494 1.00 0.00 O ATOM 16118 H1 WAT 6610 103.317 102.643 6.163 1.00 0.00 H ATOM 16119 H2 WAT 6610 104.001 102.222 7.446 1.00 0.00 H TER 16121 WAT 6610 ATOM 16121 O WAT 6611 140.698 57.071 129.760 1.00 0.00 O ATOM 16122 H1 WAT 6611 141.387 57.588 129.344 1.00 0.00 H ATOM 16123 H2 WAT 6611 140.649 56.271 129.236 1.00 0.00 H TER 16125 WAT 6611 ATOM 16125 O WAT 6612 104.366 57.481 11.898 1.00 0.00 O ATOM 16126 H1 WAT 6612 103.888 56.894 12.485 1.00 0.00 H ATOM 16127 H2 WAT 6612 105.038 57.878 12.452 1.00 0.00 H TER 16129 WAT 6612 ATOM 16129 O WAT 6613 107.725 69.551 145.885 1.00 0.00 O ATOM 16130 H1 WAT 6613 106.770 69.621 145.881 1.00 0.00 H ATOM 16131 H2 WAT 6613 107.904 68.747 146.374 1.00 0.00 H TER 16133 WAT 6613 ATOM 16133 O WAT 6614 62.364 73.637 117.299 1.00 0.00 O ATOM 16134 H1 WAT 6614 61.609 73.702 116.713 1.00 0.00 H ATOM 16135 H2 WAT 6614 63.111 73.887 116.755 1.00 0.00 H TER 16137 WAT 6614 ATOM 16137 O WAT 6615 77.303 77.774 83.462 1.00 0.00 O ATOM 16138 H1 WAT 6615 76.487 77.952 83.931 1.00 0.00 H ATOM 16139 H2 WAT 6615 77.030 77.295 82.680 1.00 0.00 H TER 16141 WAT 6615 ATOM 16141 O WAT 6616 138.504 9.485 9.714 1.00 0.00 O ATOM 16142 H1 WAT 6616 137.603 9.504 10.034 1.00 0.00 H ATOM 16143 H2 WAT 6616 138.711 10.399 9.522 1.00 0.00 H TER 16145 WAT 6616 ATOM 16145 O WAT 6617 73.722 134.394 7.773 1.00 0.00 O ATOM 16146 H1 WAT 6617 73.269 134.134 8.575 1.00 0.00 H ATOM 16147 H2 WAT 6617 73.651 133.631 7.200 1.00 0.00 H TER 16149 WAT 6617 ATOM 16149 O WAT 6618 118.378 35.800 129.340 1.00 0.00 O ATOM 16150 H1 WAT 6618 117.856 36.182 128.635 1.00 0.00 H ATOM 16151 H2 WAT 6618 117.857 35.058 129.649 1.00 0.00 H TER 16153 WAT 6618 ATOM 16153 O WAT 6619 81.567 142.351 110.341 1.00 0.00 O ATOM 16154 H1 WAT 6619 82.204 141.802 109.884 1.00 0.00 H ATOM 16155 H2 WAT 6619 82.097 142.922 110.897 1.00 0.00 H TER 16157 WAT 6619 ATOM 16157 O WAT 6620 53.948 87.585 13.964 1.00 0.00 O ATOM 16158 H1 WAT 6620 54.544 87.734 14.698 1.00 0.00 H ATOM 16159 H2 WAT 6620 53.127 87.312 14.373 1.00 0.00 H TER 16161 WAT 6620 ATOM 16161 O WAT 6621 82.657 140.822 6.956 1.00 0.00 O ATOM 16162 H1 WAT 6621 82.805 140.551 7.862 1.00 0.00 H ATOM 16163 H2 WAT 6621 82.923 141.741 6.935 1.00 0.00 H TER 16165 WAT 6621 ATOM 16165 O WAT 6622 73.166 86.297 59.454 1.00 0.00 O ATOM 16166 H1 WAT 6622 73.794 85.621 59.199 1.00 0.00 H ATOM 16167 H2 WAT 6622 73.421 86.535 60.346 1.00 0.00 H TER 16169 WAT 6622 ATOM 16169 O WAT 6623 25.076 65.090 58.373 1.00 0.00 O ATOM 16170 H1 WAT 6623 24.878 65.701 57.663 1.00 0.00 H ATOM 16171 H2 WAT 6623 25.868 64.637 58.085 1.00 0.00 H TER 16173 WAT 6623 ATOM 16173 O WAT 6624 117.728 107.105 129.696 1.00 0.00 O ATOM 16174 H1 WAT 6624 117.556 106.521 130.434 1.00 0.00 H ATOM 16175 H2 WAT 6624 116.862 107.311 129.346 1.00 0.00 H TER 16177 WAT 6624 ATOM 16177 O WAT 6625 83.145 52.079 152.231 1.00 0.00 O ATOM 16178 H1 WAT 6625 83.939 51.689 152.597 1.00 0.00 H ATOM 16179 H2 WAT 6625 82.789 52.610 152.943 1.00 0.00 H TER 16181 WAT 6625 ATOM 16181 O WAT 6626 81.279 48.422 71.294 1.00 0.00 O ATOM 16182 H1 WAT 6626 82.006 48.776 71.806 1.00 0.00 H ATOM 16183 H2 WAT 6626 81.243 48.976 70.514 1.00 0.00 H TER 16185 WAT 6626 ATOM 16185 O WAT 6627 39.184 4.084 115.017 1.00 0.00 O ATOM 16186 H1 WAT 6627 39.926 4.246 114.434 1.00 0.00 H ATOM 16187 H2 WAT 6627 39.402 4.558 115.819 1.00 0.00 H TER 16189 WAT 6627 ATOM 16189 O WAT 6628 34.111 96.063 123.689 1.00 0.00 O ATOM 16190 H1 WAT 6628 34.936 95.786 124.088 1.00 0.00 H ATOM 16191 H2 WAT 6628 33.482 96.060 124.410 1.00 0.00 H TER 16193 WAT 6628 ATOM 16193 O WAT 6629 24.156 1.024 63.336 1.00 0.00 O ATOM 16194 H1 WAT 6629 23.581 0.809 62.601 1.00 0.00 H ATOM 16195 H2 WAT 6629 23.760 0.582 64.087 1.00 0.00 H TER 16197 WAT 6629 ATOM 16197 O WAT 6630 61.796 25.485 89.405 1.00 0.00 O ATOM 16198 H1 WAT 6630 61.856 26.437 89.490 1.00 0.00 H ATOM 16199 H2 WAT 6630 62.531 25.152 89.920 1.00 0.00 H TER 16201 WAT 6630 ATOM 16201 O WAT 6631 118.383 84.336 156.542 1.00 0.00 O ATOM 16202 H1 WAT 6631 118.458 83.760 155.781 1.00 0.00 H ATOM 16203 H2 WAT 6631 119.122 84.092 157.100 1.00 0.00 H TER 16205 WAT 6631 ATOM 16205 O WAT 6632 39.603 57.905 9.220 1.00 0.00 O ATOM 16206 H1 WAT 6632 38.746 57.598 8.925 1.00 0.00 H ATOM 16207 H2 WAT 6632 39.418 58.725 9.680 1.00 0.00 H TER 16209 WAT 6632 ATOM 16209 O WAT 6633 139.465 122.143 22.437 1.00 0.00 O ATOM 16210 H1 WAT 6633 139.686 121.351 22.927 1.00 0.00 H ATOM 16211 H2 WAT 6633 140.310 122.545 22.238 1.00 0.00 H TER 16213 WAT 6633 ATOM 16213 O WAT 6634 91.400 6.060 94.290 1.00 0.00 O ATOM 16214 H1 WAT 6634 91.516 6.026 93.341 1.00 0.00 H ATOM 16215 H2 WAT 6634 90.653 6.645 94.419 1.00 0.00 H TER 16217 WAT 6634 ATOM 16217 O WAT 6635 6.155 134.175 57.289 1.00 0.00 O ATOM 16218 H1 WAT 6635 5.378 133.747 56.929 1.00 0.00 H ATOM 16219 H2 WAT 6635 6.328 133.709 58.107 1.00 0.00 H TER 16221 WAT 6635 ATOM 16221 O WAT 6636 134.854 57.446 62.839 1.00 0.00 O ATOM 16222 H1 WAT 6636 135.448 56.938 62.286 1.00 0.00 H ATOM 16223 H2 WAT 6636 134.585 58.182 62.289 1.00 0.00 H TER 16225 WAT 6636 ATOM 16225 O WAT 6637 125.589 118.528 20.252 1.00 0.00 O ATOM 16226 H1 WAT 6637 125.785 117.591 20.286 1.00 0.00 H ATOM 16227 H2 WAT 6637 124.781 118.622 20.757 1.00 0.00 H TER 16229 WAT 6637 ATOM 16229 O WAT 6638 49.681 133.807 73.413 1.00 0.00 O ATOM 16230 H1 WAT 6638 48.926 133.305 73.106 1.00 0.00 H ATOM 16231 H2 WAT 6638 49.743 134.542 72.803 1.00 0.00 H TER 16233 WAT 6638 ATOM 16233 O WAT 6639 34.344 136.464 123.217 1.00 0.00 O ATOM 16234 H1 WAT 6639 34.523 137.305 122.797 1.00 0.00 H ATOM 16235 H2 WAT 6639 35.128 135.941 123.049 1.00 0.00 H TER 16237 WAT 6639 ATOM 16237 O WAT 6640 82.434 100.264 14.187 1.00 0.00 O ATOM 16238 H1 WAT 6640 81.526 100.264 14.490 1.00 0.00 H ATOM 16239 H2 WAT 6640 82.915 99.802 14.873 1.00 0.00 H TER 16241 WAT 6640 ATOM 16241 O WAT 6641 107.859 105.385 112.225 1.00 0.00 O ATOM 16242 H1 WAT 6641 108.514 105.337 111.529 1.00 0.00 H ATOM 16243 H2 WAT 6641 107.059 105.047 111.825 1.00 0.00 H TER 16245 WAT 6641 ATOM 16245 O WAT 6642 57.826 57.895 24.588 1.00 0.00 O ATOM 16246 H1 WAT 6642 57.625 58.594 23.965 1.00 0.00 H ATOM 16247 H2 WAT 6642 58.743 57.682 24.420 1.00 0.00 H TER 16249 WAT 6642 ATOM 16249 O WAT 6643 13.711 79.510 129.864 1.00 0.00 O ATOM 16250 H1 WAT 6643 13.143 78.921 130.361 1.00 0.00 H ATOM 16251 H2 WAT 6643 13.517 80.381 130.211 1.00 0.00 H TER 16253 WAT 6643 ATOM 16253 O WAT 6644 126.954 115.154 149.117 1.00 0.00 O ATOM 16254 H1 WAT 6644 126.231 115.518 149.627 1.00 0.00 H ATOM 16255 H2 WAT 6644 126.543 114.498 148.553 1.00 0.00 H TER 16257 WAT 6644 ATOM 16257 O WAT 6645 10.389 45.801 67.516 1.00 0.00 O ATOM 16258 H1 WAT 6645 9.853 46.520 67.851 1.00 0.00 H ATOM 16259 H2 WAT 6645 10.954 46.209 66.859 1.00 0.00 H TER 16261 WAT 6645 ATOM 16261 O WAT 6646 100.225 140.862 11.753 1.00 0.00 O ATOM 16262 H1 WAT 6646 101.145 141.094 11.880 1.00 0.00 H ATOM 16263 H2 WAT 6646 100.120 140.035 12.224 1.00 0.00 H TER 16265 WAT 6646 ATOM 16265 O WAT 6647 134.846 76.247 94.088 1.00 0.00 O ATOM 16266 H1 WAT 6647 134.983 76.736 94.900 1.00 0.00 H ATOM 16267 H2 WAT 6647 135.095 75.349 94.304 1.00 0.00 H TER 16269 WAT 6647 ATOM 16269 O WAT 6648 67.087 11.453 50.657 1.00 0.00 O ATOM 16270 H1 WAT 6648 66.660 11.896 49.924 1.00 0.00 H ATOM 16271 H2 WAT 6648 66.554 11.682 51.419 1.00 0.00 H TER 16273 WAT 6648 ATOM 16273 O WAT 6649 16.990 108.075 129.984 1.00 0.00 O ATOM 16274 H1 WAT 6649 16.709 107.247 130.373 1.00 0.00 H ATOM 16275 H2 WAT 6649 16.324 108.706 130.255 1.00 0.00 H TER 16277 WAT 6649 ATOM 16277 O WAT 6650 103.210 28.188 125.462 1.00 0.00 O ATOM 16278 H1 WAT 6650 103.859 28.271 126.161 1.00 0.00 H ATOM 16279 H2 WAT 6650 103.301 28.994 124.954 1.00 0.00 H TER 16281 WAT 6650 ATOM 16281 O WAT 6651 119.985 79.018 136.431 1.00 0.00 O ATOM 16282 H1 WAT 6651 119.279 79.430 135.933 1.00 0.00 H ATOM 16283 H2 WAT 6651 119.743 79.155 137.347 1.00 0.00 H TER 16285 WAT 6651 ATOM 16285 O WAT 6652 138.733 58.223 91.196 1.00 0.00 O ATOM 16286 H1 WAT 6652 138.542 59.078 90.811 1.00 0.00 H ATOM 16287 H2 WAT 6652 137.876 57.874 91.443 1.00 0.00 H TER 16289 WAT 6652 ATOM 16289 O WAT 6653 73.444 91.405 61.551 1.00 0.00 O ATOM 16290 H1 WAT 6653 73.128 90.998 60.744 1.00 0.00 H ATOM 16291 H2 WAT 6653 72.747 91.247 62.187 1.00 0.00 H TER 16293 WAT 6653 ATOM 16293 O WAT 6654 146.074 134.693 153.805 1.00 0.00 O ATOM 16294 H1 WAT 6654 145.671 135.345 153.232 1.00 0.00 H ATOM 16295 H2 WAT 6654 145.368 134.419 154.390 1.00 0.00 H TER 16297 WAT 6654 ATOM 16297 O WAT 6655 51.242 67.378 126.185 1.00 0.00 O ATOM 16298 H1 WAT 6655 50.397 67.547 126.602 1.00 0.00 H ATOM 16299 H2 WAT 6655 51.773 68.144 126.402 1.00 0.00 H TER 16301 WAT 6655 ATOM 16301 O WAT 6656 98.072 139.965 93.985 1.00 0.00 O ATOM 16302 H1 WAT 6656 97.453 139.710 94.670 1.00 0.00 H ATOM 16303 H2 WAT 6656 98.621 140.634 94.395 1.00 0.00 H TER 16305 WAT 6656 ATOM 16305 O WAT 6657 69.406 1.501 143.143 1.00 0.00 O ATOM 16306 H1 WAT 6657 69.414 0.545 143.200 1.00 0.00 H ATOM 16307 H2 WAT 6657 68.667 1.767 143.690 1.00 0.00 H TER 16309 WAT 6657 ATOM 16309 O WAT 6658 5.461 100.296 60.222 1.00 0.00 O ATOM 16310 H1 WAT 6658 5.099 100.604 59.391 1.00 0.00 H ATOM 16311 H2 WAT 6658 4.777 100.481 60.865 1.00 0.00 H TER 16313 WAT 6658 ATOM 16313 O WAT 6659 81.222 54.260 120.970 1.00 0.00 O ATOM 16314 H1 WAT 6659 81.311 53.332 120.754 1.00 0.00 H ATOM 16315 H2 WAT 6659 82.118 54.596 120.957 1.00 0.00 H TER 16317 WAT 6659 ATOM 16317 O WAT 6660 50.974 71.199 28.318 1.00 0.00 O ATOM 16318 H1 WAT 6660 51.231 70.542 27.671 1.00 0.00 H ATOM 16319 H2 WAT 6660 50.663 71.939 27.798 1.00 0.00 H TER 16321 WAT 6660 ATOM 16321 O WAT 6661 3.848 101.282 10.007 1.00 0.00 O ATOM 16322 H1 WAT 6661 3.565 100.518 10.509 1.00 0.00 H ATOM 16323 H2 WAT 6661 3.253 101.310 9.258 1.00 0.00 H TER 16325 WAT 6661 ATOM 16325 O WAT 6662 0.793 106.813 1.878 1.00 0.00 O ATOM 16326 H1 WAT 6662 1.124 105.935 1.686 1.00 0.00 H ATOM 16327 H2 WAT 6662 0.729 107.237 1.022 1.00 0.00 H TER 16329 WAT 6662 ATOM 16329 O WAT 6663 74.257 110.715 63.659 1.00 0.00 O ATOM 16330 H1 WAT 6663 74.179 110.748 62.705 1.00 0.00 H ATOM 16331 H2 WAT 6663 73.361 110.583 63.968 1.00 0.00 H TER 16333 WAT 6663 ATOM 16333 O WAT 6664 82.710 136.487 100.547 1.00 0.00 O ATOM 16334 H1 WAT 6664 82.484 137.000 101.323 1.00 0.00 H ATOM 16335 H2 WAT 6664 82.650 135.576 100.836 1.00 0.00 H TER 16337 WAT 6664 ATOM 16337 O WAT 6665 82.654 44.422 120.365 1.00 0.00 O ATOM 16338 H1 WAT 6665 82.266 45.251 120.085 1.00 0.00 H ATOM 16339 H2 WAT 6665 83.599 44.566 120.301 1.00 0.00 H TER 16341 WAT 6665 ATOM 16341 O WAT 6666 36.495 27.737 126.295 1.00 0.00 O ATOM 16342 H1 WAT 6666 35.930 27.688 125.524 1.00 0.00 H ATOM 16343 H2 WAT 6666 37.373 27.879 125.940 1.00 0.00 H TER 16345 WAT 6666 ATOM 16345 O WAT 6667 81.123 28.203 120.696 1.00 0.00 O ATOM 16346 H1 WAT 6667 81.806 28.305 120.034 1.00 0.00 H ATOM 16347 H2 WAT 6667 80.700 29.060 120.738 1.00 0.00 H TER 16349 WAT 6667 ATOM 16349 O WAT 6668 117.220 0.939 131.876 1.00 0.00 O ATOM 16350 H1 WAT 6668 117.443 0.099 131.476 1.00 0.00 H ATOM 16351 H2 WAT 6668 118.059 1.293 132.172 1.00 0.00 H TER 16353 WAT 6668 ATOM 16353 O WAT 6669 104.648 117.614 157.481 1.00 0.00 O ATOM 16354 H1 WAT 6669 103.993 117.245 158.074 1.00 0.00 H ATOM 16355 H2 WAT 6669 105.487 117.342 157.853 1.00 0.00 H TER 16357 WAT 6669 ATOM 16357 O WAT 6670 71.857 140.873 52.955 1.00 0.00 O ATOM 16358 H1 WAT 6670 71.697 140.103 52.409 1.00 0.00 H ATOM 16359 H2 WAT 6670 71.541 140.620 53.823 1.00 0.00 H TER 16361 WAT 6670 ATOM 16361 O WAT 6671 135.535 19.658 114.749 1.00 0.00 O ATOM 16362 H1 WAT 6671 136.022 18.934 115.144 1.00 0.00 H ATOM 16363 H2 WAT 6671 135.722 20.408 115.313 1.00 0.00 H TER 16365 WAT 6671 ATOM 16365 O WAT 6672 19.901 126.587 124.857 1.00 0.00 O ATOM 16366 H1 WAT 6672 20.731 126.864 125.245 1.00 0.00 H ATOM 16367 H2 WAT 6672 19.535 127.386 124.478 1.00 0.00 H TER 16369 WAT 6672 ATOM 16369 O WAT 6673 119.175 117.311 88.182 1.00 0.00 O ATOM 16370 H1 WAT 6673 118.544 116.594 88.108 1.00 0.00 H ATOM 16371 H2 WAT 6673 120.029 116.888 88.095 1.00 0.00 H TER 16373 WAT 6673 ATOM 16373 O WAT 6674 39.006 135.322 9.868 1.00 0.00 O ATOM 16374 H1 WAT 6674 39.281 135.601 10.741 1.00 0.00 H ATOM 16375 H2 WAT 6674 38.106 135.017 9.986 1.00 0.00 H TER 16377 WAT 6674 ATOM 16377 O WAT 6675 58.494 41.008 27.379 1.00 0.00 O ATOM 16378 H1 WAT 6675 59.438 41.126 27.478 1.00 0.00 H ATOM 16379 H2 WAT 6675 58.298 41.363 26.511 1.00 0.00 H TER 16381 WAT 6675 ATOM 16381 O WAT 6676 40.832 39.798 135.589 1.00 0.00 O ATOM 16382 H1 WAT 6676 40.811 39.411 134.714 1.00 0.00 H ATOM 16383 H2 WAT 6676 41.654 39.488 135.969 1.00 0.00 H TER 16385 WAT 6676 ATOM 16385 O WAT 6677 43.002 91.469 155.833 1.00 0.00 O ATOM 16386 H1 WAT 6677 42.781 90.566 155.606 1.00 0.00 H ATOM 16387 H2 WAT 6677 42.165 91.866 156.076 1.00 0.00 H TER 16389 WAT 6677 ATOM 16389 O WAT 6678 52.123 42.936 60.844 1.00 0.00 O ATOM 16390 H1 WAT 6678 51.805 42.942 59.942 1.00 0.00 H ATOM 16391 H2 WAT 6678 53.009 43.294 60.789 1.00 0.00 H TER 16393 WAT 6678 ATOM 16393 O WAT 6679 16.467 11.159 148.210 1.00 0.00 O ATOM 16394 H1 WAT 6679 15.546 10.952 148.365 1.00 0.00 H ATOM 16395 H2 WAT 6679 16.947 10.449 148.636 1.00 0.00 H TER 16397 WAT 6679 ATOM 16397 O WAT 6680 88.808 28.130 133.798 1.00 0.00 O ATOM 16398 H1 WAT 6680 88.975 27.422 134.420 1.00 0.00 H ATOM 16399 H2 WAT 6680 89.060 27.768 132.949 1.00 0.00 H TER 16401 WAT 6680 ATOM 16401 O WAT 6681 115.291 46.872 21.440 1.00 0.00 O ATOM 16402 H1 WAT 6681 114.526 46.373 21.152 1.00 0.00 H ATOM 16403 H2 WAT 6681 115.014 47.283 22.258 1.00 0.00 H TER 16405 WAT 6681 ATOM 16405 O WAT 6682 117.442 24.607 86.527 1.00 0.00 O ATOM 16406 H1 WAT 6682 117.183 24.519 87.444 1.00 0.00 H ATOM 16407 H2 WAT 6682 117.537 23.706 86.217 1.00 0.00 H TER 16409 WAT 6682 ATOM 16409 O WAT 6683 97.104 99.307 122.799 1.00 0.00 O ATOM 16410 H1 WAT 6683 97.069 100.196 123.153 1.00 0.00 H ATOM 16411 H2 WAT 6683 97.938 98.957 123.113 1.00 0.00 H TER 16413 WAT 6683 ATOM 16413 O WAT 6684 81.620 93.204 7.255 1.00 0.00 O ATOM 16414 H1 WAT 6684 81.059 92.796 7.914 1.00 0.00 H ATOM 16415 H2 WAT 6684 81.010 93.581 6.621 1.00 0.00 H TER 16417 WAT 6684 ATOM 16417 O WAT 6685 48.154 45.824 123.455 1.00 0.00 O ATOM 16418 H1 WAT 6685 48.167 46.687 123.041 1.00 0.00 H ATOM 16419 H2 WAT 6685 47.386 45.391 123.083 1.00 0.00 H TER 16421 WAT 6685 ATOM 16421 O WAT 6686 70.833 7.009 152.538 1.00 0.00 O ATOM 16422 H1 WAT 6686 70.274 6.423 152.029 1.00 0.00 H ATOM 16423 H2 WAT 6686 71.712 6.640 152.449 1.00 0.00 H TER 16425 WAT 6686 ATOM 16425 O WAT 6687 140.828 17.503 72.576 1.00 0.00 O ATOM 16426 H1 WAT 6687 141.678 17.916 72.724 1.00 0.00 H ATOM 16427 H2 WAT 6687 141.033 16.580 72.425 1.00 0.00 H TER 16429 WAT 6687 ATOM 16429 O WAT 6688 7.867 65.028 108.081 1.00 0.00 O ATOM 16430 H1 WAT 6688 8.420 64.719 107.363 1.00 0.00 H ATOM 16431 H2 WAT 6688 8.308 64.720 108.873 1.00 0.00 H TER 16433 WAT 6688 ATOM 16433 O WAT 6689 21.883 70.301 3.025 1.00 0.00 O ATOM 16434 H1 WAT 6689 21.912 69.718 2.266 1.00 0.00 H ATOM 16435 H2 WAT 6689 22.762 70.679 3.070 1.00 0.00 H TER 16437 WAT 6689 ATOM 16437 O WAT 6690 142.497 80.368 0.772 1.00 0.00 O ATOM 16438 H1 WAT 6690 142.403 80.959 0.025 1.00 0.00 H ATOM 16439 H2 WAT 6690 142.548 80.949 1.531 1.00 0.00 H TER 16441 WAT 6690 ATOM 16441 O WAT 6691 43.587 104.225 0.744 1.00 0.00 O ATOM 16442 H1 WAT 6691 42.901 104.863 0.940 1.00 0.00 H ATOM 16443 H2 WAT 6691 44.169 104.680 0.134 1.00 0.00 H TER 16445 WAT 6691 ATOM 16445 O WAT 6692 23.330 31.438 9.457 1.00 0.00 O ATOM 16446 H1 WAT 6692 22.632 30.847 9.175 1.00 0.00 H ATOM 16447 H2 WAT 6692 23.098 31.670 10.357 1.00 0.00 H TER 16449 WAT 6692 ATOM 16449 O WAT 6693 72.652 76.017 75.499 1.00 0.00 O ATOM 16450 H1 WAT 6693 72.804 75.219 74.993 1.00 0.00 H ATOM 16451 H2 WAT 6693 71.700 76.069 75.584 1.00 0.00 H TER 16453 WAT 6693 ATOM 16453 O WAT 6694 33.218 97.791 106.376 1.00 0.00 O ATOM 16454 H1 WAT 6694 33.057 96.909 106.041 1.00 0.00 H ATOM 16455 H2 WAT 6694 34.151 97.799 106.590 1.00 0.00 H TER 16457 WAT 6694 ATOM 16457 O WAT 6695 31.923 127.780 157.951 1.00 0.00 O ATOM 16458 H1 WAT 6695 31.006 127.639 158.188 1.00 0.00 H ATOM 16459 H2 WAT 6695 31.897 128.017 157.024 1.00 0.00 H TER 16461 WAT 6695 ATOM 16461 O WAT 6696 46.636 28.876 109.247 1.00 0.00 O ATOM 16462 H1 WAT 6696 46.684 29.553 108.572 1.00 0.00 H ATOM 16463 H2 WAT 6696 45.853 28.372 109.024 1.00 0.00 H TER 16465 WAT 6696 ATOM 16465 O WAT 6697 145.404 115.391 68.832 1.00 0.00 O ATOM 16466 H1 WAT 6697 144.610 115.924 68.782 1.00 0.00 H ATOM 16467 H2 WAT 6697 146.019 115.822 68.237 1.00 0.00 H TER 16469 WAT 6697 ATOM 16469 O WAT 6698 66.939 53.466 3.661 1.00 0.00 O ATOM 16470 H1 WAT 6698 66.022 53.249 3.831 1.00 0.00 H ATOM 16471 H2 WAT 6698 66.933 54.408 3.487 1.00 0.00 H TER 16473 WAT 6698 ATOM 16473 O WAT 6699 17.513 135.258 122.474 1.00 0.00 O ATOM 16474 H1 WAT 6699 16.662 135.694 122.524 1.00 0.00 H ATOM 16475 H2 WAT 6699 17.516 134.652 123.215 1.00 0.00 H TER 16477 WAT 6699 ATOM 16477 O WAT 6700 112.012 122.623 132.326 1.00 0.00 O ATOM 16478 H1 WAT 6700 111.437 121.894 132.093 1.00 0.00 H ATOM 16479 H2 WAT 6700 111.652 123.373 131.852 1.00 0.00 H TER 16481 WAT 6700 ATOM 16481 O WAT 6701 45.221 65.242 81.523 1.00 0.00 O ATOM 16482 H1 WAT 6701 45.312 64.948 82.430 1.00 0.00 H ATOM 16483 H2 WAT 6701 44.537 65.912 81.557 1.00 0.00 H TER 16485 WAT 6701 ATOM 16485 O WAT 6702 14.887 96.745 107.499 1.00 0.00 O ATOM 16486 H1 WAT 6702 14.970 97.680 107.313 1.00 0.00 H ATOM 16487 H2 WAT 6702 15.780 96.407 107.431 1.00 0.00 H TER 16489 WAT 6702 ATOM 16489 O WAT 6703 12.482 128.735 95.543 1.00 0.00 O ATOM 16490 H1 WAT 6703 11.801 128.312 95.019 1.00 0.00 H ATOM 16491 H2 WAT 6703 12.889 129.361 94.945 1.00 0.00 H TER 16493 WAT 6703 ATOM 16493 O WAT 6704 19.211 56.374 94.801 1.00 0.00 O ATOM 16494 H1 WAT 6704 20.012 55.972 95.138 1.00 0.00 H ATOM 16495 H2 WAT 6704 19.508 56.929 94.079 1.00 0.00 H TER 16497 WAT 6704 ATOM 16497 O WAT 6705 42.003 4.150 18.920 1.00 0.00 O ATOM 16498 H1 WAT 6705 42.714 4.324 18.303 1.00 0.00 H ATOM 16499 H2 WAT 6705 42.358 3.488 19.514 1.00 0.00 H TER 16501 WAT 6705 ATOM 16501 O WAT 6706 117.574 43.067 65.900 1.00 0.00 O ATOM 16502 H1 WAT 6706 117.039 43.485 65.226 1.00 0.00 H ATOM 16503 H2 WAT 6706 117.078 43.188 66.709 1.00 0.00 H TER 16505 WAT 6706 ATOM 16505 O WAT 6707 118.290 7.110 58.622 1.00 0.00 O ATOM 16506 H1 WAT 6707 118.121 6.284 58.168 1.00 0.00 H ATOM 16507 H2 WAT 6707 118.032 7.785 57.995 1.00 0.00 H TER 16509 WAT 6707 ATOM 16509 O WAT 6708 139.533 42.118 113.906 1.00 0.00 O ATOM 16510 H1 WAT 6708 139.424 43.051 113.724 1.00 0.00 H ATOM 16511 H2 WAT 6708 138.660 41.746 113.779 1.00 0.00 H TER 16513 WAT 6708 ATOM 16513 O WAT 6709 142.076 77.139 99.582 1.00 0.00 O ATOM 16514 H1 WAT 6709 141.832 77.709 100.311 1.00 0.00 H ATOM 16515 H2 WAT 6709 141.257 76.991 99.110 1.00 0.00 H TER 16517 WAT 6709 ATOM 16517 O WAT 6710 33.200 28.472 119.507 1.00 0.00 O ATOM 16518 H1 WAT 6710 32.243 28.505 119.507 1.00 0.00 H ATOM 16519 H2 WAT 6710 33.470 29.372 119.322 1.00 0.00 H TER 16521 WAT 6710 ATOM 16521 O WAT 6711 95.533 140.146 89.189 1.00 0.00 O ATOM 16522 H1 WAT 6711 95.410 139.874 90.099 1.00 0.00 H ATOM 16523 H2 WAT 6711 94.835 140.782 89.033 1.00 0.00 H TER 16525 WAT 6711 ATOM 16525 O WAT 6712 12.885 67.343 65.470 1.00 0.00 O ATOM 16526 H1 WAT 6712 13.760 67.462 65.838 1.00 0.00 H ATOM 16527 H2 WAT 6712 12.808 66.398 65.336 1.00 0.00 H TER 16529 WAT 6712 ATOM 16529 O WAT 6713 36.908 125.971 124.751 1.00 0.00 O ATOM 16530 H1 WAT 6713 37.850 126.010 124.920 1.00 0.00 H ATOM 16531 H2 WAT 6713 36.797 125.201 124.193 1.00 0.00 H TER 16533 WAT 6713 ATOM 16533 O WAT 6714 87.803 29.606 16.518 1.00 0.00 O ATOM 16534 H1 WAT 6714 86.857 29.618 16.664 1.00 0.00 H ATOM 16535 H2 WAT 6714 88.132 28.950 17.133 1.00 0.00 H TER 16537 WAT 6714 ATOM 16537 O WAT 6715 4.333 27.082 89.037 1.00 0.00 O ATOM 16538 H1 WAT 6715 3.980 26.606 89.790 1.00 0.00 H ATOM 16539 H2 WAT 6715 4.900 26.448 88.598 1.00 0.00 H TER 16541 WAT 6715 ATOM 16541 O WAT 6716 67.143 90.622 130.329 1.00 0.00 O ATOM 16542 H1 WAT 6716 66.607 89.920 129.960 1.00 0.00 H ATOM 16543 H2 WAT 6716 67.676 90.927 129.594 1.00 0.00 H TER 16545 WAT 6716 ATOM 16545 O WAT 6717 32.675 102.378 82.859 1.00 0.00 O ATOM 16546 H1 WAT 6717 31.725 102.383 82.975 1.00 0.00 H ATOM 16547 H2 WAT 6717 32.874 103.228 82.466 1.00 0.00 H TER 16549 WAT 6717 ATOM 16549 O WAT 6718 144.482 55.242 92.321 1.00 0.00 O ATOM 16550 H1 WAT 6718 143.724 54.847 92.752 1.00 0.00 H ATOM 16551 H2 WAT 6718 144.256 56.169 92.241 1.00 0.00 H TER 16553 WAT 6718 ATOM 16553 O WAT 6719 136.535 57.128 112.542 1.00 0.00 O ATOM 16554 H1 WAT 6719 136.656 58.073 112.445 1.00 0.00 H ATOM 16555 H2 WAT 6719 136.567 56.978 113.487 1.00 0.00 H TER 16557 WAT 6719 ATOM 16557 O WAT 6720 38.208 143.223 12.286 1.00 0.00 O ATOM 16558 H1 WAT 6720 38.594 142.848 11.494 1.00 0.00 H ATOM 16559 H2 WAT 6720 38.315 144.168 12.180 1.00 0.00 H TER 16561 WAT 6720 ATOM 16561 O WAT 6721 34.434 27.567 88.628 1.00 0.00 O ATOM 16562 H1 WAT 6721 34.901 26.836 88.223 1.00 0.00 H ATOM 16563 H2 WAT 6721 33.631 27.652 88.114 1.00 0.00 H TER 16565 WAT 6721 ATOM 16565 O WAT 6722 143.487 91.360 84.100 1.00 0.00 O ATOM 16566 H1 WAT 6722 144.225 91.924 83.868 1.00 0.00 H ATOM 16567 H2 WAT 6722 142.876 91.452 83.369 1.00 0.00 H TER 16569 WAT 6722 ATOM 16569 O WAT 6723 77.845 28.118 151.449 1.00 0.00 O ATOM 16570 H1 WAT 6723 78.135 27.498 150.780 1.00 0.00 H ATOM 16571 H2 WAT 6723 78.604 28.225 152.022 1.00 0.00 H TER 16573 WAT 6723 ATOM 16573 O WAT 6724 64.991 16.340 83.923 1.00 0.00 O ATOM 16574 H1 WAT 6724 64.964 17.164 84.409 1.00 0.00 H ATOM 16575 H2 WAT 6724 64.363 16.462 83.211 1.00 0.00 H TER 16577 WAT 6724 ATOM 16577 O WAT 6725 56.809 113.084 149.332 1.00 0.00 O ATOM 16578 H1 WAT 6725 56.647 112.157 149.510 1.00 0.00 H ATOM 16579 H2 WAT 6725 57.413 113.083 148.590 1.00 0.00 H TER 16581 WAT 6725 ATOM 16581 O WAT 6726 92.108 81.862 0.877 1.00 0.00 O ATOM 16582 H1 WAT 6726 92.845 81.366 0.520 1.00 0.00 H ATOM 16583 H2 WAT 6726 92.163 81.724 1.823 1.00 0.00 H TER 16585 WAT 6726 ATOM 16585 O WAT 6727 12.693 56.355 6.735 1.00 0.00 O ATOM 16586 H1 WAT 6727 12.485 56.306 5.802 1.00 0.00 H ATOM 16587 H2 WAT 6727 13.063 55.498 6.943 1.00 0.00 H TER 16589 WAT 6727 ATOM 16589 O WAT 6728 62.569 19.774 7.805 1.00 0.00 O ATOM 16590 H1 WAT 6728 62.281 18.911 7.507 1.00 0.00 H ATOM 16591 H2 WAT 6728 61.787 20.322 7.746 1.00 0.00 H TER 16593 WAT 6728 ATOM 16593 O WAT 6729 124.556 46.872 123.280 1.00 0.00 O ATOM 16594 H1 WAT 6729 123.846 46.560 123.841 1.00 0.00 H ATOM 16595 H2 WAT 6729 125.293 47.000 123.877 1.00 0.00 H TER 16597 WAT 6729 ATOM 16597 O WAT 6730 104.136 106.425 117.051 1.00 0.00 O ATOM 16598 H1 WAT 6730 104.885 106.140 117.575 1.00 0.00 H ATOM 16599 H2 WAT 6730 103.578 105.650 116.990 1.00 0.00 H TER 16601 WAT 6730 ATOM 16601 O WAT 6731 45.441 97.295 103.139 1.00 0.00 O ATOM 16602 H1 WAT 6731 46.311 96.932 103.302 1.00 0.00 H ATOM 16603 H2 WAT 6731 45.571 98.243 103.152 1.00 0.00 H TER 16605 WAT 6731 ATOM 16605 O WAT 6732 105.602 46.995 69.888 1.00 0.00 O ATOM 16606 H1 WAT 6732 104.692 46.729 69.754 1.00 0.00 H ATOM 16607 H2 WAT 6732 105.968 46.317 70.456 1.00 0.00 H TER 16609 WAT 6732 ATOM 16609 O WAT 6733 111.524 143.832 74.617 1.00 0.00 O ATOM 16610 H1 WAT 6733 110.791 144.299 75.017 1.00 0.00 H ATOM 16611 H2 WAT 6733 111.829 144.414 73.921 1.00 0.00 H TER 16613 WAT 6733 ATOM 16613 O WAT 6734 26.409 72.509 94.435 1.00 0.00 O ATOM 16614 H1 WAT 6734 27.003 73.259 94.428 1.00 0.00 H ATOM 16615 H2 WAT 6734 25.812 72.669 93.704 1.00 0.00 H TER 16617 WAT 6734 ATOM 16617 O WAT 6735 124.512 27.762 114.466 1.00 0.00 O ATOM 16618 H1 WAT 6735 124.485 28.070 113.560 1.00 0.00 H ATOM 16619 H2 WAT 6735 124.828 26.860 114.403 1.00 0.00 H TER 16621 WAT 6735 ATOM 16621 O WAT 6736 113.798 89.254 103.186 1.00 0.00 O ATOM 16622 H1 WAT 6736 114.590 89.111 103.705 1.00 0.00 H ATOM 16623 H2 WAT 6736 114.119 89.433 102.303 1.00 0.00 H TER 16625 WAT 6736 ATOM 16625 O WAT 6737 39.012 93.208 102.479 1.00 0.00 O ATOM 16626 H1 WAT 6737 38.155 93.048 102.084 1.00 0.00 H ATOM 16627 H2 WAT 6737 38.827 93.760 103.238 1.00 0.00 H TER 16629 WAT 6737 ATOM 16629 O WAT 6738 116.906 19.971 10.495 1.00 0.00 O ATOM 16630 H1 WAT 6738 116.844 20.077 11.444 1.00 0.00 H ATOM 16631 H2 WAT 6738 116.030 20.181 10.172 1.00 0.00 H TER 16633 WAT 6738 ATOM 16633 O WAT 6739 26.288 108.018 60.158 1.00 0.00 O ATOM 16634 H1 WAT 6739 26.155 107.085 60.329 1.00 0.00 H ATOM 16635 H2 WAT 6739 26.819 108.323 60.894 1.00 0.00 H TER 16637 WAT 6739 ATOM 16637 O WAT 6740 119.424 59.441 104.754 1.00 0.00 O ATOM 16638 H1 WAT 6740 119.811 60.226 105.143 1.00 0.00 H ATOM 16639 H2 WAT 6740 119.100 59.730 103.902 1.00 0.00 H TER 16641 WAT 6740 ATOM 16641 O WAT 6741 119.773 114.129 13.118 1.00 0.00 O ATOM 16642 H1 WAT 6741 119.789 113.212 13.393 1.00 0.00 H ATOM 16643 H2 WAT 6741 120.651 114.289 12.772 1.00 0.00 H TER 16645 WAT 6741 ATOM 16645 O WAT 6742 82.833 83.122 121.160 1.00 0.00 O ATOM 16646 H1 WAT 6742 82.070 82.597 120.915 1.00 0.00 H ATOM 16647 H2 WAT 6742 82.933 82.975 122.100 1.00 0.00 H TER 16649 WAT 6742 ATOM 16649 O WAT 6743 89.440 126.427 132.960 1.00 0.00 O ATOM 16650 H1 WAT 6743 90.226 126.944 133.136 1.00 0.00 H ATOM 16651 H2 WAT 6743 89.247 126.592 132.037 1.00 0.00 H TER 16653 WAT 6743 ATOM 16653 O WAT 6744 121.578 136.232 104.532 1.00 0.00 O ATOM 16654 H1 WAT 6744 121.293 136.045 103.638 1.00 0.00 H ATOM 16655 H2 WAT 6744 122.215 135.545 104.729 1.00 0.00 H TER 16657 WAT 6744 ATOM 16657 O WAT 6745 43.031 79.029 84.852 1.00 0.00 O ATOM 16658 H1 WAT 6745 43.827 79.399 85.235 1.00 0.00 H ATOM 16659 H2 WAT 6745 43.265 78.852 83.940 1.00 0.00 H TER 16661 WAT 6745 ATOM 16661 O WAT 6746 39.999 137.665 54.873 1.00 0.00 O ATOM 16662 H1 WAT 6746 39.571 137.988 55.666 1.00 0.00 H ATOM 16663 H2 WAT 6746 39.278 137.470 54.274 1.00 0.00 H TER 16665 WAT 6746 ATOM 16665 O WAT 6747 22.261 109.767 7.108 1.00 0.00 O ATOM 16666 H1 WAT 6747 22.722 110.589 6.939 1.00 0.00 H ATOM 16667 H2 WAT 6747 21.799 109.917 7.932 1.00 0.00 H TER 16669 WAT 6747 ATOM 16669 O WAT 6748 12.484 82.998 144.079 1.00 0.00 O ATOM 16670 H1 WAT 6748 11.950 82.358 144.550 1.00 0.00 H ATOM 16671 H2 WAT 6748 12.374 83.811 144.573 1.00 0.00 H TER 16673 WAT 6748 ATOM 16673 O WAT 6749 65.575 75.466 151.267 1.00 0.00 O ATOM 16674 H1 WAT 6749 65.417 76.046 150.522 1.00 0.00 H ATOM 16675 H2 WAT 6749 65.630 76.054 152.021 1.00 0.00 H TER 16677 WAT 6749 ATOM 16677 O WAT 6750 39.892 138.490 7.458 1.00 0.00 O ATOM 16678 H1 WAT 6750 40.263 139.308 7.789 1.00 0.00 H ATOM 16679 H2 WAT 6750 40.622 137.870 7.479 1.00 0.00 H TER 16681 WAT 6750 ATOM 16681 O WAT 6751 41.019 113.734 55.208 1.00 0.00 O ATOM 16682 H1 WAT 6751 41.972 113.644 55.241 1.00 0.00 H ATOM 16683 H2 WAT 6751 40.870 114.676 55.126 1.00 0.00 H TER 16685 WAT 6751 ATOM 16685 O WAT 6752 133.999 129.358 76.366 1.00 0.00 O ATOM 16686 H1 WAT 6752 133.700 130.243 76.154 1.00 0.00 H ATOM 16687 H2 WAT 6752 134.510 129.464 77.168 1.00 0.00 H TER 16689 WAT 6752 ATOM 16689 O WAT 6753 47.974 10.872 60.833 1.00 0.00 O ATOM 16690 H1 WAT 6753 48.476 10.585 60.070 1.00 0.00 H ATOM 16691 H2 WAT 6753 47.370 10.149 61.007 1.00 0.00 H TER 16693 WAT 6753 ATOM 16693 O WAT 6754 116.418 115.075 158.114 1.00 0.00 O ATOM 16694 H1 WAT 6754 116.602 114.862 159.029 1.00 0.00 H ATOM 16695 H2 WAT 6754 116.765 115.960 158.000 1.00 0.00 H TER 16697 WAT 6754 ATOM 16697 O WAT 6755 40.145 130.907 90.571 1.00 0.00 O ATOM 16698 H1 WAT 6755 39.709 130.065 90.703 1.00 0.00 H ATOM 16699 H2 WAT 6755 39.472 131.468 90.185 1.00 0.00 H TER 16701 WAT 6755 ATOM 16701 O WAT 6756 72.518 120.417 126.631 1.00 0.00 O ATOM 16702 H1 WAT 6756 73.254 120.376 126.020 1.00 0.00 H ATOM 16703 H2 WAT 6756 72.227 119.509 126.716 1.00 0.00 H TER 16705 WAT 6756 ATOM 16705 O WAT 6757 45.796 89.350 31.147 1.00 0.00 O ATOM 16706 H1 WAT 6757 45.422 88.902 30.388 1.00 0.00 H ATOM 16707 H2 WAT 6757 45.627 90.278 30.985 1.00 0.00 H TER 16709 WAT 6757 ATOM 16709 O WAT 6758 120.392 89.551 94.882 1.00 0.00 O ATOM 16710 H1 WAT 6758 120.702 89.014 95.612 1.00 0.00 H ATOM 16711 H2 WAT 6758 120.213 88.922 94.182 1.00 0.00 H TER 16713 WAT 6758 ATOM 16713 O WAT 6759 129.093 53.887 74.690 1.00 0.00 O ATOM 16714 H1 WAT 6759 129.544 54.731 74.731 1.00 0.00 H ATOM 16715 H2 WAT 6759 129.109 53.563 75.590 1.00 0.00 H TER 16717 WAT 6759 ATOM 16717 O WAT 6760 69.728 29.542 153.962 1.00 0.00 O ATOM 16718 H1 WAT 6760 69.798 30.393 154.394 1.00 0.00 H ATOM 16719 H2 WAT 6760 70.346 29.591 153.233 1.00 0.00 H TER 16721 WAT 6760 ATOM 16721 O WAT 6761 138.781 56.853 27.074 1.00 0.00 O ATOM 16722 H1 WAT 6761 139.177 55.999 27.247 1.00 0.00 H ATOM 16723 H2 WAT 6761 138.269 56.722 26.276 1.00 0.00 H TER 16725 WAT 6761 ATOM 16725 O WAT 6762 32.630 119.273 140.844 1.00 0.00 O ATOM 16726 H1 WAT 6762 33.513 119.037 140.560 1.00 0.00 H ATOM 16727 H2 WAT 6762 32.144 119.408 140.031 1.00 0.00 H TER 16729 WAT 6762 ATOM 16729 O WAT 6763 97.049 105.359 80.576 1.00 0.00 O ATOM 16730 H1 WAT 6763 97.174 105.145 81.501 1.00 0.00 H ATOM 16731 H2 WAT 6763 96.110 105.529 80.495 1.00 0.00 H TER 16733 WAT 6763 ATOM 16733 O WAT 6764 89.410 52.397 87.438 1.00 0.00 O ATOM 16734 H1 WAT 6764 89.765 52.276 88.319 1.00 0.00 H ATOM 16735 H2 WAT 6764 88.881 53.192 87.500 1.00 0.00 H TER 16737 WAT 6764 ATOM 16737 O WAT 6765 7.851 89.222 127.279 1.00 0.00 O ATOM 16738 H1 WAT 6765 6.941 89.244 126.981 1.00 0.00 H ATOM 16739 H2 WAT 6765 8.231 88.468 126.829 1.00 0.00 H TER 16741 WAT 6765 ATOM 16741 O WAT 6766 53.303 48.131 88.234 1.00 0.00 O ATOM 16742 H1 WAT 6766 53.227 47.195 88.052 1.00 0.00 H ATOM 16743 H2 WAT 6766 54.166 48.372 87.898 1.00 0.00 H TER 16745 WAT 6766 ATOM 16745 O WAT 6767 47.298 6.386 154.086 1.00 0.00 O ATOM 16746 H1 WAT 6767 48.031 5.994 153.610 1.00 0.00 H ATOM 16747 H2 WAT 6767 47.537 6.298 155.008 1.00 0.00 H TER 16749 WAT 6767 ATOM 16749 O WAT 6768 53.377 21.084 62.192 1.00 0.00 O ATOM 16750 H1 WAT 6768 53.800 21.637 61.536 1.00 0.00 H ATOM 16751 H2 WAT 6768 52.966 21.701 62.797 1.00 0.00 H TER 16753 WAT 6768 ATOM 16753 O WAT 6769 70.269 78.073 75.016 1.00 0.00 O ATOM 16754 H1 WAT 6769 70.503 77.429 74.348 1.00 0.00 H ATOM 16755 H2 WAT 6769 69.428 77.769 75.357 1.00 0.00 H TER 16757 WAT 6769 ATOM 16757 O WAT 6770 145.877 52.841 145.581 1.00 0.00 O ATOM 16758 H1 WAT 6770 145.100 52.432 145.199 1.00 0.00 H ATOM 16759 H2 WAT 6770 145.979 52.414 146.431 1.00 0.00 H TER 16761 WAT 6770 ATOM 16761 O WAT 6771 34.259 113.115 132.793 1.00 0.00 O ATOM 16762 H1 WAT 6771 33.551 112.769 132.251 1.00 0.00 H ATOM 16763 H2 WAT 6771 35.002 112.539 132.613 1.00 0.00 H TER 16765 WAT 6771 ATOM 16765 O WAT 6772 19.350 107.926 55.608 1.00 0.00 O ATOM 16766 H1 WAT 6772 18.673 107.683 56.240 1.00 0.00 H ATOM 16767 H2 WAT 6772 20.073 108.251 56.145 1.00 0.00 H TER 16769 WAT 6772 ATOM 16769 O WAT 6773 37.461 94.376 71.859 1.00 0.00 O ATOM 16770 H1 WAT 6773 38.202 94.974 71.766 1.00 0.00 H ATOM 16771 H2 WAT 6773 37.056 94.623 72.691 1.00 0.00 H TER 16773 WAT 6773 ATOM 16773 O WAT 6774 39.326 71.936 83.112 1.00 0.00 O ATOM 16774 H1 WAT 6774 38.573 71.662 82.588 1.00 0.00 H ATOM 16775 H2 WAT 6774 39.129 72.839 83.360 1.00 0.00 H TER 16777 WAT 6774 ATOM 16777 O WAT 6775 104.990 6.716 88.062 1.00 0.00 O ATOM 16778 H1 WAT 6775 105.559 6.199 88.633 1.00 0.00 H ATOM 16779 H2 WAT 6775 105.125 7.620 88.345 1.00 0.00 H TER 16781 WAT 6775 ATOM 16781 O WAT 6776 33.392 65.165 117.007 1.00 0.00 O ATOM 16782 H1 WAT 6776 34.034 64.674 116.493 1.00 0.00 H ATOM 16783 H2 WAT 6776 33.108 65.869 116.424 1.00 0.00 H TER 16785 WAT 6776 ATOM 16785 O WAT 6777 93.826 85.159 139.246 1.00 0.00 O ATOM 16786 H1 WAT 6777 93.056 85.178 139.814 1.00 0.00 H ATOM 16787 H2 WAT 6777 93.472 85.241 138.360 1.00 0.00 H TER 16789 WAT 6777 ATOM 16789 O WAT 6778 54.495 66.311 15.110 1.00 0.00 O ATOM 16790 H1 WAT 6778 55.059 66.116 14.362 1.00 0.00 H ATOM 16791 H2 WAT 6778 55.002 66.031 15.872 1.00 0.00 H TER 16793 WAT 6778 ATOM 16793 O WAT 6779 38.174 60.134 96.592 1.00 0.00 O ATOM 16794 H1 WAT 6779 37.472 59.488 96.513 1.00 0.00 H ATOM 16795 H2 WAT 6779 38.908 59.750 96.113 1.00 0.00 H TER 16797 WAT 6779 ATOM 16797 O WAT 6780 69.818 68.965 15.855 1.00 0.00 O ATOM 16798 H1 WAT 6780 69.577 69.111 16.770 1.00 0.00 H ATOM 16799 H2 WAT 6780 69.375 68.150 15.618 1.00 0.00 H TER 16801 WAT 6780 ATOM 16801 O WAT 6781 17.446 39.688 107.633 1.00 0.00 O ATOM 16802 H1 WAT 6781 16.662 39.336 107.212 1.00 0.00 H ATOM 16803 H2 WAT 6781 17.291 40.632 107.677 1.00 0.00 H TER 16805 WAT 6781 ATOM 16805 O WAT 6782 12.614 111.242 23.423 1.00 0.00 O ATOM 16806 H1 WAT 6782 12.094 112.045 23.463 1.00 0.00 H ATOM 16807 H2 WAT 6782 13.513 111.546 23.298 1.00 0.00 H TER 16809 WAT 6782 ATOM 16809 O WAT 6783 18.980 107.946 152.096 1.00 0.00 O ATOM 16810 H1 WAT 6783 19.015 108.372 151.240 1.00 0.00 H ATOM 16811 H2 WAT 6783 18.556 108.587 152.666 1.00 0.00 H TER 16813 WAT 6783 ATOM 16813 O WAT 6784 96.468 92.795 155.852 1.00 0.00 O ATOM 16814 H1 WAT 6784 97.021 92.065 155.574 1.00 0.00 H ATOM 16815 H2 WAT 6784 96.851 93.083 156.681 1.00 0.00 H TER 16817 WAT 6784 ATOM 16817 O WAT 6785 23.469 7.573 108.583 1.00 0.00 O ATOM 16818 H1 WAT 6785 23.592 8.307 109.185 1.00 0.00 H ATOM 16819 H2 WAT 6785 23.234 7.982 107.751 1.00 0.00 H TER 16821 WAT 6785 ATOM 16821 O WAT 6786 62.225 46.633 26.867 1.00 0.00 O ATOM 16822 H1 WAT 6786 62.862 47.155 27.355 1.00 0.00 H ATOM 16823 H2 WAT 6786 61.964 47.194 26.136 1.00 0.00 H TER 16825 WAT 6786 ATOM 16825 O WAT 6787 110.428 35.894 102.971 1.00 0.00 O ATOM 16826 H1 WAT 6787 110.528 35.230 102.289 1.00 0.00 H ATOM 16827 H2 WAT 6787 111.189 36.465 102.863 1.00 0.00 H TER 16829 WAT 6787 ATOM 16829 O WAT 6788 4.095 32.037 70.393 1.00 0.00 O ATOM 16830 H1 WAT 6788 4.525 31.872 71.233 1.00 0.00 H ATOM 16831 H2 WAT 6788 3.713 31.194 70.150 1.00 0.00 H TER 16833 WAT 6788 ATOM 16833 O WAT 6789 44.179 125.573 17.752 1.00 0.00 O ATOM 16834 H1 WAT 6789 43.874 125.032 18.480 1.00 0.00 H ATOM 16835 H2 WAT 6789 44.132 126.470 18.084 1.00 0.00 H TER 16837 WAT 6789 ATOM 16837 O WAT 6790 81.256 57.254 128.595 1.00 0.00 O ATOM 16838 H1 WAT 6790 81.789 56.510 128.878 1.00 0.00 H ATOM 16839 H2 WAT 6790 80.670 56.890 127.932 1.00 0.00 H TER 16841 WAT 6790 ATOM 16841 O WAT 6791 65.872 34.451 122.498 1.00 0.00 O ATOM 16842 H1 WAT 6791 66.329 35.132 122.004 1.00 0.00 H ATOM 16843 H2 WAT 6791 65.529 33.859 121.829 1.00 0.00 H TER 16845 WAT 6791 ATOM 16845 O WAT 6792 29.087 101.438 156.297 1.00 0.00 O ATOM 16846 H1 WAT 6792 28.872 100.644 156.786 1.00 0.00 H ATOM 16847 H2 WAT 6792 29.770 101.862 156.816 1.00 0.00 H TER 16849 WAT 6792 ATOM 16849 O WAT 6793 10.268 133.602 141.501 1.00 0.00 O ATOM 16850 H1 WAT 6793 11.175 133.723 141.221 1.00 0.00 H ATOM 16851 H2 WAT 6793 9.942 132.886 140.956 1.00 0.00 H TER 16853 WAT 6793 ATOM 16853 O WAT 6794 106.865 94.741 109.611 1.00 0.00 O ATOM 16854 H1 WAT 6794 106.422 95.565 109.409 1.00 0.00 H ATOM 16855 H2 WAT 6794 106.972 94.755 110.562 1.00 0.00 H TER 16857 WAT 6794 ATOM 16857 O WAT 6795 32.708 23.808 155.700 1.00 0.00 O ATOM 16858 H1 WAT 6795 32.827 24.355 156.476 1.00 0.00 H ATOM 16859 H2 WAT 6795 32.892 22.919 156.003 1.00 0.00 H TER 16861 WAT 6795 ATOM 16861 O WAT 6796 60.234 117.905 156.792 1.00 0.00 O ATOM 16862 H1 WAT 6796 60.821 117.285 157.224 1.00 0.00 H ATOM 16863 H2 WAT 6796 60.793 118.648 156.566 1.00 0.00 H TER 16865 WAT 6796 ATOM 16865 O WAT 6797 108.213 50.803 129.430 1.00 0.00 O ATOM 16866 H1 WAT 6797 107.542 50.299 129.892 1.00 0.00 H ATOM 16867 H2 WAT 6797 108.925 50.891 130.064 1.00 0.00 H TER 16869 WAT 6797 ATOM 16869 O WAT 6798 53.576 131.997 113.353 1.00 0.00 O ATOM 16870 H1 WAT 6798 54.387 131.928 112.849 1.00 0.00 H ATOM 16871 H2 WAT 6798 53.170 131.134 113.274 1.00 0.00 H TER 16873 WAT 6798 ATOM 16873 O WAT 6799 68.777 73.829 121.014 1.00 0.00 O ATOM 16874 H1 WAT 6799 68.412 74.268 121.783 1.00 0.00 H ATOM 16875 H2 WAT 6799 68.036 73.742 120.415 1.00 0.00 H TER 16877 WAT 6799 ATOM 16877 O WAT 6800 64.591 6.160 16.636 1.00 0.00 O ATOM 16878 H1 WAT 6800 64.701 6.826 17.315 1.00 0.00 H ATOM 16879 H2 WAT 6800 64.024 5.501 17.036 1.00 0.00 H TER 16881 WAT 6800 ATOM 16881 O WAT 6801 107.037 97.056 70.321 1.00 0.00 O ATOM 16882 H1 WAT 6801 106.643 96.400 69.747 1.00 0.00 H ATOM 16883 H2 WAT 6801 107.820 96.631 70.670 1.00 0.00 H TER 16885 WAT 6801 ATOM 16885 O WAT 6802 50.101 36.509 136.325 1.00 0.00 O ATOM 16886 H1 WAT 6802 50.331 36.367 137.244 1.00 0.00 H ATOM 16887 H2 WAT 6802 49.165 36.314 136.280 1.00 0.00 H TER 16889 WAT 6802 ATOM 16889 O WAT 6803 25.113 78.573 152.240 1.00 0.00 O ATOM 16890 H1 WAT 6803 24.885 79.023 153.054 1.00 0.00 H ATOM 16891 H2 WAT 6803 24.540 77.806 152.222 1.00 0.00 H TER 16893 WAT 6803 ATOM 16893 O WAT 6804 124.738 20.443 15.907 1.00 0.00 O ATOM 16894 H1 WAT 6804 125.618 20.066 15.904 1.00 0.00 H ATOM 16895 H2 WAT 6804 124.881 21.383 16.025 1.00 0.00 H TER 16897 WAT 6804 ATOM 16897 O WAT 6805 102.689 108.276 23.935 1.00 0.00 O ATOM 16898 H1 WAT 6805 102.066 107.580 23.724 1.00 0.00 H ATOM 16899 H2 WAT 6805 102.362 109.041 23.462 1.00 0.00 H TER 16901 WAT 6805 ATOM 16901 O WAT 6806 136.938 29.350 75.325 1.00 0.00 O ATOM 16902 H1 WAT 6806 137.513 29.998 74.918 1.00 0.00 H ATOM 16903 H2 WAT 6806 136.420 29.001 74.599 1.00 0.00 H TER 16905 WAT 6806 ATOM 16905 O WAT 6807 124.765 43.245 16.153 1.00 0.00 O ATOM 16906 H1 WAT 6807 123.828 43.071 16.239 1.00 0.00 H ATOM 16907 H2 WAT 6807 125.097 42.517 15.629 1.00 0.00 H TER 16909 WAT 6807 ATOM 16909 O WAT 6808 12.934 86.688 66.128 1.00 0.00 O ATOM 16910 H1 WAT 6808 12.582 87.578 66.122 1.00 0.00 H ATOM 16911 H2 WAT 6808 13.275 86.560 65.243 1.00 0.00 H TER 16913 WAT 6808 ATOM 16913 O WAT 6809 137.354 102.421 13.312 1.00 0.00 O ATOM 16914 H1 WAT 6809 136.524 102.070 13.634 1.00 0.00 H ATOM 16915 H2 WAT 6809 137.100 103.097 12.683 1.00 0.00 H TER 16917 WAT 6809 ATOM 16917 O WAT 6810 79.293 60.831 134.402 1.00 0.00 O ATOM 16918 H1 WAT 6810 78.911 60.003 134.110 1.00 0.00 H ATOM 16919 H2 WAT 6810 80.213 60.625 134.566 1.00 0.00 H TER 16921 WAT 6810 ATOM 16921 O WAT 6811 107.683 89.521 123.106 1.00 0.00 O ATOM 16922 H1 WAT 6811 107.851 89.791 124.009 1.00 0.00 H ATOM 16923 H2 WAT 6811 107.192 90.249 122.725 1.00 0.00 H TER 16925 WAT 6811 ATOM 16925 O WAT 6812 117.227 125.512 58.237 1.00 0.00 O ATOM 16926 H1 WAT 6812 117.414 125.010 57.444 1.00 0.00 H ATOM 16927 H2 WAT 6812 117.988 126.083 58.344 1.00 0.00 H TER 16929 WAT 6812 ATOM 16929 O WAT 6813 37.759 22.339 102.805 1.00 0.00 O ATOM 16930 H1 WAT 6813 37.966 21.644 102.180 1.00 0.00 H ATOM 16931 H2 WAT 6813 37.948 21.954 103.661 1.00 0.00 H TER 16933 WAT 6813 ATOM 16933 O WAT 6814 135.030 72.092 80.736 1.00 0.00 O ATOM 16934 H1 WAT 6814 135.175 72.396 79.840 1.00 0.00 H ATOM 16935 H2 WAT 6814 135.760 72.460 81.235 1.00 0.00 H TER 16937 WAT 6814 ATOM 16937 O WAT 6815 60.143 8.203 80.126 1.00 0.00 O ATOM 16938 H1 WAT 6815 61.031 7.905 79.929 1.00 0.00 H ATOM 16939 H2 WAT 6815 59.622 7.915 79.377 1.00 0.00 H TER 16941 WAT 6815 ATOM 16941 O WAT 6816 95.463 14.787 76.134 1.00 0.00 O ATOM 16942 H1 WAT 6816 95.093 15.029 76.983 1.00 0.00 H ATOM 16943 H2 WAT 6816 96.213 14.232 76.349 1.00 0.00 H TER 16945 WAT 6816 ATOM 16945 O WAT 6817 26.647 93.621 23.263 1.00 0.00 O ATOM 16946 H1 WAT 6817 26.101 94.371 23.028 1.00 0.00 H ATOM 16947 H2 WAT 6817 27.543 93.917 23.104 1.00 0.00 H TER 16949 WAT 6817 ATOM 16949 O WAT 6818 130.104 136.111 16.304 1.00 0.00 O ATOM 16950 H1 WAT 6818 129.515 135.370 16.446 1.00 0.00 H ATOM 16951 H2 WAT 6818 129.697 136.607 15.594 1.00 0.00 H TER 16953 WAT 6818 ATOM 16953 O WAT 6819 4.531 137.233 132.116 1.00 0.00 O ATOM 16954 H1 WAT 6819 5.452 137.409 131.926 1.00 0.00 H ATOM 16955 H2 WAT 6819 4.083 138.054 131.911 1.00 0.00 H TER 16957 WAT 6819 ATOM 16957 O WAT 6820 31.462 49.208 135.723 1.00 0.00 O ATOM 16958 H1 WAT 6820 30.559 49.461 135.915 1.00 0.00 H ATOM 16959 H2 WAT 6820 31.994 49.898 136.118 1.00 0.00 H TER 16961 WAT 6820 ATOM 16961 O WAT 6821 82.635 27.178 7.569 1.00 0.00 O ATOM 16962 H1 WAT 6821 82.617 27.750 6.802 1.00 0.00 H ATOM 16963 H2 WAT 6821 83.200 27.632 8.194 1.00 0.00 H TER 16965 WAT 6821 ATOM 16965 O WAT 6822 90.786 35.563 96.061 1.00 0.00 O ATOM 16966 H1 WAT 6822 90.871 34.643 96.314 1.00 0.00 H ATOM 16967 H2 WAT 6822 89.851 35.749 96.147 1.00 0.00 H TER 16969 WAT 6822 ATOM 16969 O WAT 6823 21.788 7.094 99.233 1.00 0.00 O ATOM 16970 H1 WAT 6823 22.073 7.872 99.713 1.00 0.00 H ATOM 16971 H2 WAT 6823 21.134 7.420 98.615 1.00 0.00 H TER 16973 WAT 6823 ATOM 16973 O WAT 6824 6.195 9.900 15.514 1.00 0.00 O ATOM 16974 H1 WAT 6824 6.192 9.582 14.612 1.00 0.00 H ATOM 16975 H2 WAT 6824 6.939 9.457 15.922 1.00 0.00 H TER 16977 WAT 6824 ATOM 16977 O WAT 6825 71.675 87.155 125.855 1.00 0.00 O ATOM 16978 H1 WAT 6825 72.110 86.931 126.678 1.00 0.00 H ATOM 16979 H2 WAT 6825 70.904 87.657 126.121 1.00 0.00 H TER 16981 WAT 6825 ATOM 16981 O WAT 6826 133.927 31.744 121.379 1.00 0.00 O ATOM 16982 H1 WAT 6826 133.150 31.537 120.860 1.00 0.00 H ATOM 16983 H2 WAT 6826 133.683 32.526 121.875 1.00 0.00 H TER 16985 WAT 6826 ATOM 16985 O WAT 6827 27.904 74.807 10.453 1.00 0.00 O ATOM 16986 H1 WAT 6827 27.607 74.746 9.545 1.00 0.00 H ATOM 16987 H2 WAT 6827 28.154 75.725 10.561 1.00 0.00 H TER 16989 WAT 6827 ATOM 16989 O WAT 6828 24.021 23.811 141.729 1.00 0.00 O ATOM 16990 H1 WAT 6828 23.821 24.659 142.125 1.00 0.00 H ATOM 16991 H2 WAT 6828 24.855 23.948 141.279 1.00 0.00 H TER 16993 WAT 6828 ATOM 16993 O WAT 6829 27.937 38.997 12.482 1.00 0.00 O ATOM 16994 H1 WAT 6829 28.208 39.137 11.574 1.00 0.00 H ATOM 16995 H2 WAT 6829 28.714 38.638 12.911 1.00 0.00 H TER 16997 WAT 6829 ATOM 16997 O WAT 6830 44.450 76.412 0.412 1.00 0.00 O ATOM 16998 H1 WAT 6830 43.816 76.206 1.098 1.00 0.00 H ATOM 16999 H2 WAT 6830 45.114 76.943 0.851 1.00 0.00 H TER 17001 WAT 6830 ATOM 17001 O WAT 6831 104.469 61.699 93.247 1.00 0.00 O ATOM 17002 H1 WAT 6831 104.449 61.104 93.997 1.00 0.00 H ATOM 17003 H2 WAT 6831 104.648 62.559 93.629 1.00 0.00 H TER 17005 WAT 6831 ATOM 17005 O WAT 6832 144.211 18.123 12.968 1.00 0.00 O ATOM 17006 H1 WAT 6832 145.078 18.516 12.872 1.00 0.00 H ATOM 17007 H2 WAT 6832 143.602 18.835 12.775 1.00 0.00 H TER 17009 WAT 6832 ATOM 17009 O WAT 6833 22.569 12.466 89.314 1.00 0.00 O ATOM 17010 H1 WAT 6833 23.492 12.673 89.462 1.00 0.00 H ATOM 17011 H2 WAT 6833 22.369 12.859 88.464 1.00 0.00 H TER 17013 WAT 6833 ATOM 17013 O WAT 6834 94.249 46.969 24.298 1.00 0.00 O ATOM 17014 H1 WAT 6834 93.819 46.250 23.837 1.00 0.00 H ATOM 17015 H2 WAT 6834 93.974 47.755 23.826 1.00 0.00 H TER 17017 WAT 6834 ATOM 17017 O WAT 6835 124.215 117.960 8.810 1.00 0.00 O ATOM 17018 H1 WAT 6835 123.385 118.438 8.817 1.00 0.00 H ATOM 17019 H2 WAT 6835 124.071 117.240 8.196 1.00 0.00 H TER 17021 WAT 6835 ATOM 17021 O WAT 6836 130.676 30.697 113.951 1.00 0.00 O ATOM 17022 H1 WAT 6836 130.032 30.013 114.136 1.00 0.00 H ATOM 17023 H2 WAT 6836 131.178 30.778 114.762 1.00 0.00 H TER 17025 WAT 6836 ATOM 17025 O WAT 6837 119.751 113.645 118.657 1.00 0.00 O ATOM 17026 H1 WAT 6837 120.510 114.153 118.943 1.00 0.00 H ATOM 17027 H2 WAT 6837 119.070 114.299 118.498 1.00 0.00 H TER 17029 WAT 6837 ATOM 17029 O WAT 6838 115.696 60.463 22.350 1.00 0.00 O ATOM 17030 H1 WAT 6838 115.934 61.305 22.737 1.00 0.00 H ATOM 17031 H2 WAT 6838 116.527 60.092 22.053 1.00 0.00 H TER 17033 WAT 6838 ATOM 17033 O WAT 6839 96.033 74.765 129.868 1.00 0.00 O ATOM 17034 H1 WAT 6839 96.600 74.229 130.423 1.00 0.00 H ATOM 17035 H2 WAT 6839 95.149 74.446 130.050 1.00 0.00 H TER 17037 WAT 6839 ATOM 17037 O WAT 6840 138.211 74.353 141.286 1.00 0.00 O ATOM 17038 H1 WAT 6840 137.428 74.251 140.744 1.00 0.00 H ATOM 17039 H2 WAT 6840 138.847 74.777 140.710 1.00 0.00 H TER 17041 WAT 6840 ATOM 17041 O WAT 6841 116.329 137.654 13.630 1.00 0.00 O ATOM 17042 H1 WAT 6841 116.883 137.125 14.205 1.00 0.00 H ATOM 17043 H2 WAT 6841 115.666 137.043 13.308 1.00 0.00 H TER 17045 WAT 6841 ATOM 17045 O WAT 6842 31.610 128.895 53.806 1.00 0.00 O ATOM 17046 H1 WAT 6842 30.862 128.742 54.384 1.00 0.00 H ATOM 17047 H2 WAT 6842 32.372 128.844 54.383 1.00 0.00 H TER 17049 WAT 6842 ATOM 17049 O WAT 6843 66.235 105.581 94.115 1.00 0.00 O ATOM 17050 H1 WAT 6843 66.579 105.303 93.265 1.00 0.00 H ATOM 17051 H2 WAT 6843 65.423 106.041 93.906 1.00 0.00 H TER 17053 WAT 6843 ATOM 17053 O WAT 6844 29.801 32.439 86.380 1.00 0.00 O ATOM 17054 H1 WAT 6844 30.550 31.857 86.508 1.00 0.00 H ATOM 17055 H2 WAT 6844 29.490 32.628 87.265 1.00 0.00 H TER 17057 WAT 6844 ATOM 17057 O WAT 6845 67.159 122.395 0.469 1.00 0.00 O ATOM 17058 H1 WAT 6845 66.236 122.457 0.714 1.00 0.00 H ATOM 17059 H2 WAT 6845 67.406 121.498 0.693 1.00 0.00 H TER 17061 WAT 6845 ATOM 17061 O WAT 6846 48.754 25.068 101.196 1.00 0.00 O ATOM 17062 H1 WAT 6846 48.722 24.200 101.597 1.00 0.00 H ATOM 17063 H2 WAT 6846 49.560 25.064 100.679 1.00 0.00 H TER 17065 WAT 6846 ATOM 17065 O WAT 6847 77.961 128.844 145.445 1.00 0.00 O ATOM 17066 H1 WAT 6847 77.951 128.267 144.681 1.00 0.00 H ATOM 17067 H2 WAT 6847 77.700 129.699 145.104 1.00 0.00 H TER 17069 WAT 6847 ATOM 17069 O WAT 6848 82.519 13.437 19.204 1.00 0.00 O ATOM 17070 H1 WAT 6848 81.899 13.003 19.790 1.00 0.00 H ATOM 17071 H2 WAT 6848 82.874 14.158 19.724 1.00 0.00 H TER 17073 WAT 6848 ATOM 17073 O WAT 6849 111.755 82.189 112.163 1.00 0.00 O ATOM 17074 H1 WAT 6849 110.821 82.372 112.061 1.00 0.00 H ATOM 17075 H2 WAT 6849 112.088 82.922 112.682 1.00 0.00 H TER 17077 WAT 6849 ATOM 17077 O WAT 6850 36.629 46.676 78.415 1.00 0.00 O ATOM 17078 H1 WAT 6850 36.731 47.592 78.673 1.00 0.00 H ATOM 17079 H2 WAT 6850 35.959 46.692 77.732 1.00 0.00 H TER 17081 WAT 6850 ATOM 17081 O WAT 6851 57.517 0.377 121.258 1.00 0.00 O ATOM 17082 H1 WAT 6851 58.229 1.004 121.132 1.00 0.00 H ATOM 17083 H2 WAT 6851 57.214 0.179 120.372 1.00 0.00 H TER 17085 WAT 6851 ATOM 17085 O WAT 6852 72.174 89.253 6.963 1.00 0.00 O ATOM 17086 H1 WAT 6852 72.799 89.555 6.304 1.00 0.00 H ATOM 17087 H2 WAT 6852 71.553 88.711 6.475 1.00 0.00 H TER 17089 WAT 6852 ATOM 17089 O WAT 6853 119.469 38.592 109.091 1.00 0.00 O ATOM 17090 H1 WAT 6853 119.079 38.845 109.927 1.00 0.00 H ATOM 17091 H2 WAT 6853 119.161 37.698 108.943 1.00 0.00 H TER 17093 WAT 6853 ATOM 17093 O WAT 6854 36.238 21.406 74.362 1.00 0.00 O ATOM 17094 H1 WAT 6854 35.683 21.331 73.585 1.00 0.00 H ATOM 17095 H2 WAT 6854 36.779 20.616 74.346 1.00 0.00 H TER 17097 WAT 6854 ATOM 17097 O WAT 6855 27.421 93.670 113.910 1.00 0.00 O ATOM 17098 H1 WAT 6855 27.320 92.719 113.880 1.00 0.00 H ATOM 17099 H2 WAT 6855 26.524 94.006 113.914 1.00 0.00 H TER 17101 WAT 6855 ATOM 17101 O WAT 6856 115.988 81.605 18.054 1.00 0.00 O ATOM 17102 H1 WAT 6856 116.592 82.213 17.627 1.00 0.00 H ATOM 17103 H2 WAT 6856 115.824 80.929 17.397 1.00 0.00 H TER 17105 WAT 6856 ATOM 17105 O WAT 6857 75.536 65.036 113.260 1.00 0.00 O ATOM 17106 H1 WAT 6857 75.668 65.017 112.312 1.00 0.00 H ATOM 17107 H2 WAT 6857 75.629 65.959 113.496 1.00 0.00 H TER 17109 WAT 6857 ATOM 17109 O WAT 6858 25.257 129.204 121.058 1.00 0.00 O ATOM 17110 H1 WAT 6858 25.293 130.120 121.336 1.00 0.00 H ATOM 17111 H2 WAT 6858 25.265 128.706 121.875 1.00 0.00 H TER 17113 WAT 6858 ATOM 17113 O WAT 6859 140.829 99.523 147.811 1.00 0.00 O ATOM 17114 H1 WAT 6859 140.804 99.413 146.861 1.00 0.00 H ATOM 17115 H2 WAT 6859 140.276 98.818 148.149 1.00 0.00 H TER 17117 WAT 6859 ATOM 17117 O WAT 6860 124.342 33.560 60.955 1.00 0.00 O ATOM 17118 H1 WAT 6860 123.997 33.642 60.066 1.00 0.00 H ATOM 17119 H2 WAT 6860 123.703 34.016 61.503 1.00 0.00 H TER 17121 WAT 6860 ATOM 17121 O WAT 6861 1.635 6.175 120.300 1.00 0.00 O ATOM 17122 H1 WAT 6861 0.807 6.374 120.737 1.00 0.00 H ATOM 17123 H2 WAT 6861 2.069 5.550 120.881 1.00 0.00 H TER 17125 WAT 6861 ATOM 17125 O WAT 6862 141.906 109.581 143.956 1.00 0.00 O ATOM 17126 H1 WAT 6862 141.539 109.596 144.840 1.00 0.00 H ATOM 17127 H2 WAT 6862 141.899 108.657 143.709 1.00 0.00 H TER 17129 WAT 6862 ATOM 17129 O WAT 6863 118.844 32.969 132.263 1.00 0.00 O ATOM 17130 H1 WAT 6863 119.720 33.274 132.027 1.00 0.00 H ATOM 17131 H2 WAT 6863 118.679 33.357 133.123 1.00 0.00 H TER 17133 WAT 6863 ATOM 17133 O WAT 6864 116.527 48.439 96.646 1.00 0.00 O ATOM 17134 H1 WAT 6864 116.673 49.179 96.057 1.00 0.00 H ATOM 17135 H2 WAT 6864 117.124 48.595 97.378 1.00 0.00 H TER 17137 WAT 6864 ATOM 17137 O WAT 6865 142.248 90.055 69.151 1.00 0.00 O ATOM 17138 H1 WAT 6865 141.551 90.373 69.725 1.00 0.00 H ATOM 17139 H2 WAT 6865 142.688 90.849 68.846 1.00 0.00 H TER 17141 WAT 6865 ATOM 17141 O WAT 6866 66.421 64.136 129.477 1.00 0.00 O ATOM 17142 H1 WAT 6866 66.158 64.706 128.754 1.00 0.00 H ATOM 17143 H2 WAT 6866 65.728 64.242 130.129 1.00 0.00 H TER 17145 WAT 6866 ATOM 17145 O WAT 6867 19.782 122.671 128.310 1.00 0.00 O ATOM 17146 H1 WAT 6867 18.974 123.175 128.212 1.00 0.00 H ATOM 17147 H2 WAT 6867 19.488 121.775 128.471 1.00 0.00 H TER 17149 WAT 6867 ATOM 17149 O WAT 6868 9.202 102.346 156.953 1.00 0.00 O ATOM 17150 H1 WAT 6868 9.128 101.392 156.974 1.00 0.00 H ATOM 17151 H2 WAT 6868 8.921 102.588 156.070 1.00 0.00 H TER 17153 WAT 6868 ATOM 17153 O WAT 6869 110.674 40.137 14.822 1.00 0.00 O ATOM 17154 H1 WAT 6869 111.099 40.879 15.252 1.00 0.00 H ATOM 17155 H2 WAT 6869 109.771 40.424 14.687 1.00 0.00 H TER 17157 WAT 6869 ATOM 17157 O WAT 6870 17.435 72.798 84.665 1.00 0.00 O ATOM 17158 H1 WAT 6870 18.146 73.438 84.632 1.00 0.00 H ATOM 17159 H2 WAT 6870 17.196 72.754 85.591 1.00 0.00 H TER 17161 WAT 6870 ATOM 17161 O WAT 6871 121.040 14.694 73.234 1.00 0.00 O ATOM 17162 H1 WAT 6871 120.142 15.018 73.170 1.00 0.00 H ATOM 17163 H2 WAT 6871 121.148 14.469 74.158 1.00 0.00 H TER 17165 WAT 6871 ATOM 17165 O WAT 6872 143.975 126.803 152.973 1.00 0.00 O ATOM 17166 H1 WAT 6872 143.782 127.263 152.156 1.00 0.00 H ATOM 17167 H2 WAT 6872 143.121 126.516 153.295 1.00 0.00 H TER 17169 WAT 6872 ATOM 17169 O WAT 6873 77.797 143.707 16.797 1.00 0.00 O ATOM 17170 H1 WAT 6873 78.137 143.683 17.692 1.00 0.00 H ATOM 17171 H2 WAT 6873 77.551 142.800 16.611 1.00 0.00 H TER 17173 WAT 6873 ATOM 17173 O WAT 6874 82.246 115.671 54.891 1.00 0.00 O ATOM 17174 H1 WAT 6874 82.060 115.000 54.234 1.00 0.00 H ATOM 17175 H2 WAT 6874 82.369 116.474 54.386 1.00 0.00 H TER 17177 WAT 6874 ATOM 17177 O WAT 6875 4.982 18.503 90.148 1.00 0.00 O ATOM 17178 H1 WAT 6875 5.461 17.716 90.408 1.00 0.00 H ATOM 17179 H2 WAT 6875 5.037 18.511 89.192 1.00 0.00 H TER 17181 WAT 6875 ATOM 17181 O WAT 6876 13.668 84.340 75.763 1.00 0.00 O ATOM 17182 H1 WAT 6876 13.482 83.537 75.276 1.00 0.00 H ATOM 17183 H2 WAT 6876 13.044 84.329 76.489 1.00 0.00 H TER 17185 WAT 6876 ATOM 17185 O WAT 6877 33.701 90.513 90.727 1.00 0.00 O ATOM 17186 H1 WAT 6877 34.270 89.875 90.297 1.00 0.00 H ATOM 17187 H2 WAT 6877 32.821 90.149 90.636 1.00 0.00 H TER 17189 WAT 6877 ATOM 17189 O WAT 6878 50.555 123.208 138.482 1.00 0.00 O ATOM 17190 H1 WAT 6878 50.854 124.117 138.460 1.00 0.00 H ATOM 17191 H2 WAT 6878 51.285 122.706 138.119 1.00 0.00 H TER 17193 WAT 6878 ATOM 17193 O WAT 6879 45.508 62.387 19.316 1.00 0.00 O ATOM 17194 H1 WAT 6879 46.131 62.777 19.929 1.00 0.00 H ATOM 17195 H2 WAT 6879 44.666 62.431 19.769 1.00 0.00 H TER 17197 WAT 6879 ATOM 17197 O WAT 6880 58.572 103.730 146.680 1.00 0.00 O ATOM 17198 H1 WAT 6880 57.636 103.929 146.703 1.00 0.00 H ATOM 17199 H2 WAT 6880 58.615 102.810 146.419 1.00 0.00 H TER 17201 WAT 6880 ATOM 17201 O WAT 6881 74.293 13.102 116.261 1.00 0.00 O ATOM 17202 H1 WAT 6881 74.290 13.872 116.829 1.00 0.00 H ATOM 17203 H2 WAT 6881 75.193 12.777 116.301 1.00 0.00 H TER 17205 WAT 6881 ATOM 17205 O WAT 6882 126.277 108.700 141.198 1.00 0.00 O ATOM 17206 H1 WAT 6882 125.665 107.976 141.326 1.00 0.00 H ATOM 17207 H2 WAT 6882 126.072 109.038 140.327 1.00 0.00 H TER 17209 WAT 6882 ATOM 17209 O WAT 6883 42.896 23.173 100.962 1.00 0.00 O ATOM 17210 H1 WAT 6883 42.174 23.695 100.612 1.00 0.00 H ATOM 17211 H2 WAT 6883 43.311 23.743 101.609 1.00 0.00 H TER 17213 WAT 6883 ATOM 17213 O WAT 6884 58.072 26.049 85.201 1.00 0.00 O ATOM 17214 H1 WAT 6884 57.889 26.135 86.137 1.00 0.00 H ATOM 17215 H2 WAT 6884 59.025 26.116 85.137 1.00 0.00 H TER 17217 WAT 6884 ATOM 17217 O WAT 6885 133.485 12.120 94.346 1.00 0.00 O ATOM 17218 H1 WAT 6885 132.646 12.553 94.189 1.00 0.00 H ATOM 17219 H2 WAT 6885 133.606 12.171 95.295 1.00 0.00 H TER 17221 WAT 6885 ATOM 17221 O WAT 6886 30.375 130.856 112.536 1.00 0.00 O ATOM 17222 H1 WAT 6886 31.299 130.620 112.622 1.00 0.00 H ATOM 17223 H2 WAT 6886 30.082 131.007 113.434 1.00 0.00 H TER 17225 WAT 6886 ATOM 17225 O WAT 6887 48.725 55.732 89.301 1.00 0.00 O ATOM 17226 H1 WAT 6887 48.852 55.218 90.099 1.00 0.00 H ATOM 17227 H2 WAT 6887 48.356 56.560 89.606 1.00 0.00 H TER 17229 WAT 6887 ATOM 17229 O WAT 6888 144.861 20.892 109.076 1.00 0.00 O ATOM 17230 H1 WAT 6888 145.362 21.074 108.281 1.00 0.00 H ATOM 17231 H2 WAT 6888 145.525 20.691 109.736 1.00 0.00 H TER 17233 WAT 6888 ATOM 17233 O WAT 6889 144.079 16.911 93.432 1.00 0.00 O ATOM 17234 H1 WAT 6889 144.631 16.152 93.243 1.00 0.00 H ATOM 17235 H2 WAT 6889 143.501 16.617 94.136 1.00 0.00 H TER 17237 WAT 6889 ATOM 17237 O WAT 6890 29.268 59.729 52.308 1.00 0.00 O ATOM 17238 H1 WAT 6890 29.502 59.308 53.134 1.00 0.00 H ATOM 17239 H2 WAT 6890 30.106 59.985 51.923 1.00 0.00 H TER 17241 WAT 6890 ATOM 17241 O WAT 6891 12.879 87.813 122.554 1.00 0.00 O ATOM 17242 H1 WAT 6891 12.450 88.628 122.813 1.00 0.00 H ATOM 17243 H2 WAT 6891 13.522 87.650 123.243 1.00 0.00 H TER 17245 WAT 6891 ATOM 17245 O WAT 6892 49.338 80.619 114.362 1.00 0.00 O ATOM 17246 H1 WAT 6892 48.795 79.866 114.593 1.00 0.00 H ATOM 17247 H2 WAT 6892 50.088 80.241 113.903 1.00 0.00 H TER 17249 WAT 6892 ATOM 17249 O WAT 6893 51.839 56.175 11.832 1.00 0.00 O ATOM 17250 H1 WAT 6893 50.980 55.776 11.970 1.00 0.00 H ATOM 17251 H2 WAT 6893 51.836 56.437 10.911 1.00 0.00 H TER 17253 WAT 6893 ATOM 17253 O WAT 6894 61.901 24.936 62.604 1.00 0.00 O ATOM 17254 H1 WAT 6894 61.531 24.859 63.483 1.00 0.00 H ATOM 17255 H2 WAT 6894 62.841 24.807 62.727 1.00 0.00 H TER 17257 WAT 6894 ATOM 17257 O WAT 6895 20.238 14.250 142.305 1.00 0.00 O ATOM 17258 H1 WAT 6895 20.265 14.545 141.394 1.00 0.00 H ATOM 17259 H2 WAT 6895 19.402 14.577 142.637 1.00 0.00 H TER 17261 WAT 6895 ATOM 17261 O WAT 6896 136.045 103.483 147.615 1.00 0.00 O ATOM 17262 H1 WAT 6896 135.432 102.918 147.144 1.00 0.00 H ATOM 17263 H2 WAT 6896 135.607 104.332 147.654 1.00 0.00 H TER 17265 WAT 6896 ATOM 17265 O WAT 6897 132.104 24.859 10.027 1.00 0.00 O ATOM 17266 H1 WAT 6897 132.035 24.933 10.978 1.00 0.00 H ATOM 17267 H2 WAT 6897 131.351 24.326 9.773 1.00 0.00 H TER 17269 WAT 6897 ATOM 17269 O WAT 6898 13.021 98.154 7.466 1.00 0.00 O ATOM 17270 H1 WAT 6898 12.178 97.732 7.630 1.00 0.00 H ATOM 17271 H2 WAT 6898 13.667 97.462 7.606 1.00 0.00 H TER 17273 WAT 6898 ATOM 17273 O WAT 6899 24.140 6.506 122.644 1.00 0.00 O ATOM 17274 H1 WAT 6899 23.741 5.815 122.115 1.00 0.00 H ATOM 17275 H2 WAT 6899 24.944 6.733 122.176 1.00 0.00 H TER 17277 WAT 6899 ATOM 17277 O WAT 6900 119.170 88.814 134.545 1.00 0.00 O ATOM 17278 H1 WAT 6900 119.018 89.190 135.412 1.00 0.00 H ATOM 17279 H2 WAT 6900 119.824 88.131 134.692 1.00 0.00 H TER 17281 WAT 6900 ATOM 17281 O WAT 6901 130.252 19.869 93.540 1.00 0.00 O ATOM 17282 H1 WAT 6901 129.427 19.537 93.185 1.00 0.00 H ATOM 17283 H2 WAT 6901 130.150 20.821 93.532 1.00 0.00 H TER 17285 WAT 6901 ATOM 17285 O WAT 6902 75.933 139.523 111.254 1.00 0.00 O ATOM 17286 H1 WAT 6902 75.504 138.667 111.249 1.00 0.00 H ATOM 17287 H2 WAT 6902 75.765 139.881 110.382 1.00 0.00 H TER 17289 WAT 6902 ATOM 17289 O WAT 6903 20.290 137.776 101.575 1.00 0.00 O ATOM 17290 H1 WAT 6903 20.683 137.523 100.739 1.00 0.00 H ATOM 17291 H2 WAT 6903 20.413 137.012 102.138 1.00 0.00 H TER 17293 WAT 6903 ATOM 17293 O WAT 6904 33.416 20.728 63.313 1.00 0.00 O ATOM 17294 H1 WAT 6904 33.851 20.778 62.462 1.00 0.00 H ATOM 17295 H2 WAT 6904 33.586 19.836 63.617 1.00 0.00 H TER 17297 WAT 6904 ATOM 17297 O WAT 6905 3.275 121.859 124.370 1.00 0.00 O ATOM 17298 H1 WAT 6905 3.181 121.626 125.293 1.00 0.00 H ATOM 17299 H2 WAT 6905 4.111 122.323 124.324 1.00 0.00 H TER 17301 WAT 6905 ATOM 17301 O WAT 6906 30.885 94.400 70.178 1.00 0.00 O ATOM 17302 H1 WAT 6906 31.521 94.606 69.493 1.00 0.00 H ATOM 17303 H2 WAT 6906 30.573 93.522 69.959 1.00 0.00 H TER 17305 WAT 6906 ATOM 17305 O WAT 6907 76.021 81.832 139.887 1.00 0.00 O ATOM 17306 H1 WAT 6907 75.779 81.031 140.351 1.00 0.00 H ATOM 17307 H2 WAT 6907 76.449 82.374 140.550 1.00 0.00 H TER 17309 WAT 6907 ATOM 17309 O WAT 6908 73.299 38.646 142.771 1.00 0.00 O ATOM 17310 H1 WAT 6908 72.611 38.032 142.515 1.00 0.00 H ATOM 17311 H2 WAT 6908 73.245 39.349 142.124 1.00 0.00 H TER 17313 WAT 6908 ATOM 17313 O WAT 6909 68.265 78.359 82.143 1.00 0.00 O ATOM 17314 H1 WAT 6909 68.868 79.034 81.830 1.00 0.00 H ATOM 17315 H2 WAT 6909 67.840 78.032 81.350 1.00 0.00 H TER 17317 WAT 6909 ATOM 17317 O WAT 6910 35.549 76.236 145.558 1.00 0.00 O ATOM 17318 H1 WAT 6910 36.389 75.870 145.834 1.00 0.00 H ATOM 17319 H2 WAT 6910 34.955 75.486 145.538 1.00 0.00 H TER 17321 WAT 6910 ATOM 17321 O WAT 6911 58.356 100.983 82.435 1.00 0.00 O ATOM 17322 H1 WAT 6911 58.384 100.224 83.017 1.00 0.00 H ATOM 17323 H2 WAT 6911 58.510 100.621 81.562 1.00 0.00 H TER 17325 WAT 6911 ATOM 17325 O WAT 6912 132.004 56.642 80.976 1.00 0.00 O ATOM 17326 H1 WAT 6912 131.599 56.471 81.826 1.00 0.00 H ATOM 17327 H2 WAT 6912 132.420 57.498 81.076 1.00 0.00 H TER 17329 WAT 6912 ATOM 17329 O WAT 6913 48.432 126.737 142.141 1.00 0.00 O ATOM 17330 H1 WAT 6913 47.935 126.683 142.957 1.00 0.00 H ATOM 17331 H2 WAT 6913 49.317 126.981 142.415 1.00 0.00 H TER 17333 WAT 6913 ATOM 17333 O WAT 6914 43.270 33.064 17.740 1.00 0.00 O ATOM 17334 H1 WAT 6914 43.071 33.991 17.875 1.00 0.00 H ATOM 17335 H2 WAT 6914 42.413 32.647 17.649 1.00 0.00 H TER 17337 WAT 6914 ATOM 17337 O WAT 6915 13.991 91.856 4.651 1.00 0.00 O ATOM 17338 H1 WAT 6915 13.407 91.105 4.762 1.00 0.00 H ATOM 17339 H2 WAT 6915 13.613 92.347 3.922 1.00 0.00 H TER 17341 WAT 6915 ATOM 17341 O WAT 6916 24.038 111.479 137.140 1.00 0.00 O ATOM 17342 H1 WAT 6916 24.302 110.686 136.674 1.00 0.00 H ATOM 17343 H2 WAT 6916 23.147 111.296 137.438 1.00 0.00 H TER 17345 WAT 6916 ATOM 17345 O WAT 6917 55.523 0.864 23.815 1.00 0.00 O ATOM 17346 H1 WAT 6917 55.460 -0.073 24.001 1.00 0.00 H ATOM 17347 H2 WAT 6917 56.126 1.200 24.479 1.00 0.00 H TER 17349 WAT 6917 ATOM 17349 O WAT 6918 32.779 88.985 137.067 1.00 0.00 O ATOM 17350 H1 WAT 6918 32.473 89.617 136.416 1.00 0.00 H ATOM 17351 H2 WAT 6918 33.600 88.650 136.708 1.00 0.00 H TER 17353 WAT 6918 ATOM 17353 O WAT 6919 16.894 113.034 114.182 1.00 0.00 O ATOM 17354 H1 WAT 6919 17.843 113.158 114.206 1.00 0.00 H ATOM 17355 H2 WAT 6919 16.734 112.298 114.773 1.00 0.00 H TER 17357 WAT 6919 ATOM 17357 O WAT 6920 23.498 143.166 8.173 1.00 0.00 O ATOM 17358 H1 WAT 6920 23.566 144.118 8.104 1.00 0.00 H ATOM 17359 H2 WAT 6920 24.377 142.880 8.423 1.00 0.00 H TER 17361 WAT 6920 ATOM 17361 O WAT 6921 108.170 55.318 67.303 1.00 0.00 O ATOM 17362 H1 WAT 6921 108.109 55.669 68.191 1.00 0.00 H ATOM 17363 H2 WAT 6921 108.936 54.745 67.324 1.00 0.00 H TER 17365 WAT 6921 ATOM 17365 O WAT 6922 71.098 75.149 109.162 1.00 0.00 O ATOM 17366 H1 WAT 6922 71.870 74.594 109.268 1.00 0.00 H ATOM 17367 H2 WAT 6922 70.630 75.070 109.994 1.00 0.00 H TER 17369 WAT 6922 ATOM 17369 O WAT 6923 115.064 69.471 114.258 1.00 0.00 O ATOM 17370 H1 WAT 6923 114.177 69.118 114.324 1.00 0.00 H ATOM 17371 H2 WAT 6923 115.453 69.303 115.116 1.00 0.00 H TER 17373 WAT 6923 ATOM 17373 O WAT 6924 130.714 20.128 12.150 1.00 0.00 O ATOM 17374 H1 WAT 6924 130.330 20.990 12.312 1.00 0.00 H ATOM 17375 H2 WAT 6924 130.324 19.563 12.817 1.00 0.00 H TER 17377 WAT 6924 ATOM 17377 O WAT 6925 133.331 60.693 113.993 1.00 0.00 O ATOM 17378 H1 WAT 6925 132.404 60.926 114.050 1.00 0.00 H ATOM 17379 H2 WAT 6925 133.342 59.738 114.057 1.00 0.00 H TER 17381 WAT 6925 ATOM 17381 O WAT 6926 69.644 7.886 99.766 1.00 0.00 O ATOM 17382 H1 WAT 6926 68.994 7.620 100.416 1.00 0.00 H ATOM 17383 H2 WAT 6926 70.004 7.062 99.436 1.00 0.00 H TER 17385 WAT 6926 ATOM 17385 O WAT 6927 107.444 85.999 92.320 1.00 0.00 O ATOM 17386 H1 WAT 6927 108.106 85.668 92.927 1.00 0.00 H ATOM 17387 H2 WAT 6927 107.161 86.829 92.704 1.00 0.00 H TER 17389 WAT 6927 ATOM 17389 O WAT 6928 88.811 2.731 110.997 1.00 0.00 O ATOM 17390 H1 WAT 6928 89.388 2.301 110.366 1.00 0.00 H ATOM 17391 H2 WAT 6928 89.053 3.656 110.951 1.00 0.00 H TER 17393 WAT 6928 ATOM 17393 O WAT 6929 107.056 36.114 115.609 1.00 0.00 O ATOM 17394 H1 WAT 6929 107.101 36.981 115.205 1.00 0.00 H ATOM 17395 H2 WAT 6929 106.429 35.631 115.070 1.00 0.00 H TER 17397 WAT 6929 ATOM 17397 O WAT 6930 140.832 108.044 125.595 1.00 0.00 O ATOM 17398 H1 WAT 6930 141.323 108.662 125.053 1.00 0.00 H ATOM 17399 H2 WAT 6930 139.971 107.992 125.179 1.00 0.00 H TER 17401 WAT 6930 ATOM 17401 O WAT 6931 16.870 79.669 149.754 1.00 0.00 O ATOM 17402 H1 WAT 6931 16.354 79.391 150.511 1.00 0.00 H ATOM 17403 H2 WAT 6931 17.689 79.179 149.830 1.00 0.00 H TER 17405 WAT 6931 ATOM 17405 O WAT 6932 27.854 97.974 3.338 1.00 0.00 O ATOM 17406 H1 WAT 6932 28.083 98.817 3.730 1.00 0.00 H ATOM 17407 H2 WAT 6932 27.963 98.110 2.397 1.00 0.00 H TER 17409 WAT 6932 ATOM 17409 O WAT 6933 0.757 25.891 145.169 1.00 0.00 O ATOM 17410 H1 WAT 6933 -0.016 26.129 145.681 1.00 0.00 H ATOM 17411 H2 WAT 6933 1.466 26.406 145.552 1.00 0.00 H TER 17413 WAT 6933 ATOM 17413 O WAT 6934 91.187 97.731 106.811 1.00 0.00 O ATOM 17414 H1 WAT 6934 92.135 97.827 106.897 1.00 0.00 H ATOM 17415 H2 WAT 6934 91.067 97.266 105.983 1.00 0.00 H TER 17417 WAT 6934 ATOM 17417 O WAT 6935 15.960 116.101 97.920 1.00 0.00 O ATOM 17418 H1 WAT 6935 16.138 117.029 98.078 1.00 0.00 H ATOM 17419 H2 WAT 6935 15.006 116.031 97.959 1.00 0.00 H TER 17421 WAT 6935 ATOM 17421 O WAT 6936 83.386 131.244 135.381 1.00 0.00 O ATOM 17422 H1 WAT 6936 83.157 130.572 136.023 1.00 0.00 H ATOM 17423 H2 WAT 6936 84.316 131.100 135.205 1.00 0.00 H TER 17425 WAT 6936 ATOM 17425 O WAT 6937 121.418 104.878 3.241 1.00 0.00 O ATOM 17426 H1 WAT 6937 120.568 105.112 3.614 1.00 0.00 H ATOM 17427 H2 WAT 6937 121.990 105.612 3.468 1.00 0.00 H TER 17429 WAT 6937 ATOM 17429 O WAT 6938 125.289 29.478 143.750 1.00 0.00 O ATOM 17430 H1 WAT 6938 126.044 28.949 144.008 1.00 0.00 H ATOM 17431 H2 WAT 6938 124.853 28.961 143.073 1.00 0.00 H TER 17433 WAT 6938 ATOM 17433 O WAT 6939 38.107 120.528 79.902 1.00 0.00 O ATOM 17434 H1 WAT 6939 38.415 119.772 80.400 1.00 0.00 H ATOM 17435 H2 WAT 6939 37.201 120.314 79.677 1.00 0.00 H TER 17437 WAT 6939 ATOM 17437 O WAT 6940 46.642 111.248 99.315 1.00 0.00 O ATOM 17438 H1 WAT 6940 45.751 111.077 99.621 1.00 0.00 H ATOM 17439 H2 WAT 6940 46.923 112.015 99.813 1.00 0.00 H TER 17441 WAT 6940 ATOM 17441 O WAT 6941 141.576 69.078 129.624 1.00 0.00 O ATOM 17442 H1 WAT 6941 142.030 68.248 129.766 1.00 0.00 H ATOM 17443 H2 WAT 6941 141.507 69.153 128.672 1.00 0.00 H TER 17445 WAT 6941 ATOM 17445 O WAT 6942 73.991 7.633 109.760 1.00 0.00 O ATOM 17446 H1 WAT 6942 74.061 7.384 110.681 1.00 0.00 H ATOM 17447 H2 WAT 6942 73.083 7.437 109.527 1.00 0.00 H TER 17449 WAT 6942 ATOM 17449 O WAT 6943 131.572 64.147 8.885 1.00 0.00 O ATOM 17450 H1 WAT 6943 131.200 63.998 9.753 1.00 0.00 H ATOM 17451 H2 WAT 6943 132.517 64.184 9.033 1.00 0.00 H TER 17453 WAT 6943 ATOM 17453 O WAT 6944 67.187 93.990 76.130 1.00 0.00 O ATOM 17454 H1 WAT 6944 67.988 94.276 76.569 1.00 0.00 H ATOM 17455 H2 WAT 6944 67.105 93.064 76.361 1.00 0.00 H TER 17457 WAT 6944 ATOM 17457 O WAT 6945 102.024 57.539 112.310 1.00 0.00 O ATOM 17458 H1 WAT 6945 101.392 57.871 111.673 1.00 0.00 H ATOM 17459 H2 WAT 6945 102.186 56.636 112.038 1.00 0.00 H TER 17461 WAT 6945 ATOM 17461 O WAT 6946 66.706 119.586 84.063 1.00 0.00 O ATOM 17462 H1 WAT 6946 66.481 119.780 84.973 1.00 0.00 H ATOM 17463 H2 WAT 6946 66.870 118.643 84.052 1.00 0.00 H TER 17465 WAT 6946 ATOM 17465 O WAT 6947 1.044 99.983 92.838 1.00 0.00 O ATOM 17466 H1 WAT 6947 0.707 99.121 93.085 1.00 0.00 H ATOM 17467 H2 WAT 6947 1.980 99.842 92.699 1.00 0.00 H TER 17469 WAT 6947 ATOM 17469 O WAT 6948 6.073 87.038 109.195 1.00 0.00 O ATOM 17470 H1 WAT 6948 5.817 86.193 108.824 1.00 0.00 H ATOM 17471 H2 WAT 6948 6.792 86.829 109.792 1.00 0.00 H TER 17473 WAT 6948 ATOM 17473 O WAT 6949 67.733 58.290 109.164 1.00 0.00 O ATOM 17474 H1 WAT 6949 67.067 57.797 109.642 1.00 0.00 H ATOM 17475 H2 WAT 6949 68.561 58.026 109.565 1.00 0.00 H TER 17477 WAT 6949 ATOM 17477 O WAT 6950 141.902 20.885 108.499 1.00 0.00 O ATOM 17478 H1 WAT 6950 142.821 20.834 108.764 1.00 0.00 H ATOM 17479 H2 WAT 6950 141.908 21.446 107.723 1.00 0.00 H TER 17481 WAT 6950 ATOM 17481 O WAT 6951 3.959 29.311 7.762 1.00 0.00 O ATOM 17482 H1 WAT 6951 4.562 30.022 7.542 1.00 0.00 H ATOM 17483 H2 WAT 6951 4.529 28.587 8.020 1.00 0.00 H TER 17485 WAT 6951 ATOM 17485 O WAT 6952 23.517 42.079 142.093 1.00 0.00 O ATOM 17486 H1 WAT 6952 23.675 42.892 141.613 1.00 0.00 H ATOM 17487 H2 WAT 6952 23.205 42.364 142.951 1.00 0.00 H TER 17489 WAT 6952 ATOM 17489 O WAT 6953 45.433 18.728 136.955 1.00 0.00 O ATOM 17490 H1 WAT 6953 45.477 18.065 136.266 1.00 0.00 H ATOM 17491 H2 WAT 6953 44.789 18.387 137.575 1.00 0.00 H TER 17493 WAT 6953 ATOM 17493 O WAT 6954 31.204 16.004 86.412 1.00 0.00 O ATOM 17494 H1 WAT 6954 31.974 16.571 86.383 1.00 0.00 H ATOM 17495 H2 WAT 6954 30.513 16.516 85.993 1.00 0.00 H TER 17497 WAT 6954 ATOM 17497 O WAT 6955 46.579 80.735 149.266 1.00 0.00 O ATOM 17498 H1 WAT 6955 46.717 81.405 149.936 1.00 0.00 H ATOM 17499 H2 WAT 6955 45.805 81.031 148.787 1.00 0.00 H TER 17501 WAT 6955 ATOM 17501 O WAT 6956 133.726 39.696 142.615 1.00 0.00 O ATOM 17502 H1 WAT 6956 134.599 39.486 142.285 1.00 0.00 H ATOM 17503 H2 WAT 6956 133.302 40.161 141.893 1.00 0.00 H TER 17505 WAT 6956 ATOM 17505 O WAT 6957 28.083 43.027 85.300 1.00 0.00 O ATOM 17506 H1 WAT 6957 27.160 42.993 85.552 1.00 0.00 H ATOM 17507 H2 WAT 6957 28.501 43.539 85.992 1.00 0.00 H TER 17509 WAT 6957 ATOM 17509 O WAT 6958 34.509 78.395 110.352 1.00 0.00 O ATOM 17510 H1 WAT 6958 35.213 78.773 109.826 1.00 0.00 H ATOM 17511 H2 WAT 6958 34.959 77.849 110.997 1.00 0.00 H TER 17513 WAT 6958 ATOM 17513 O WAT 6959 86.855 24.484 85.600 1.00 0.00 O ATOM 17514 H1 WAT 6959 87.120 25.403 85.641 1.00 0.00 H ATOM 17515 H2 WAT 6959 86.251 24.441 84.859 1.00 0.00 H TER 17517 WAT 6959 ATOM 17517 O WAT 6960 96.241 36.767 4.765 1.00 0.00 O ATOM 17518 H1 WAT 6960 95.739 37.501 5.120 1.00 0.00 H ATOM 17519 H2 WAT 6960 97.096 37.142 4.553 1.00 0.00 H TER 17521 WAT 6960 ATOM 17521 O WAT 6961 106.653 122.545 157.918 1.00 0.00 O ATOM 17522 H1 WAT 6961 106.804 121.851 157.276 1.00 0.00 H ATOM 17523 H2 WAT 6961 105.704 122.555 158.041 1.00 0.00 H TER 17525 WAT 6961 ATOM 17525 O WAT 6962 22.281 123.478 124.298 1.00 0.00 O ATOM 17526 H1 WAT 6962 22.017 124.045 123.574 1.00 0.00 H ATOM 17527 H2 WAT 6962 21.461 123.103 124.620 1.00 0.00 H TER 17529 WAT 6962 ATOM 17529 O WAT 6963 5.071 121.989 26.275 1.00 0.00 O ATOM 17530 H1 WAT 6963 4.586 121.238 25.932 1.00 0.00 H ATOM 17531 H2 WAT 6963 4.589 122.752 25.956 1.00 0.00 H TER 17533 WAT 6963 ATOM 17533 O WAT 6964 109.246 123.310 7.649 1.00 0.00 O ATOM 17534 H1 WAT 6964 109.720 123.007 8.424 1.00 0.00 H ATOM 17535 H2 WAT 6964 108.323 123.267 7.902 1.00 0.00 H TER 17537 WAT 6964 ATOM 17537 O WAT 6965 129.872 124.079 9.616 1.00 0.00 O ATOM 17538 H1 WAT 6965 130.372 124.310 10.399 1.00 0.00 H ATOM 17539 H2 WAT 6965 129.797 123.126 9.653 1.00 0.00 H TER 17541 WAT 6965 ATOM 17541 O WAT 6966 65.898 10.948 0.385 1.00 0.00 O ATOM 17542 H1 WAT 6966 66.496 11.533 -0.080 1.00 0.00 H ATOM 17543 H2 WAT 6966 65.087 10.980 -0.123 1.00 0.00 H TER 17545 WAT 6966 ATOM 17545 O WAT 6967 126.727 81.943 16.601 1.00 0.00 O ATOM 17546 H1 WAT 6967 126.718 82.798 16.172 1.00 0.00 H ATOM 17547 H2 WAT 6967 126.941 82.135 17.514 1.00 0.00 H TER 17549 WAT 6967 ATOM 17549 O WAT 6968 50.921 17.898 131.752 1.00 0.00 O ATOM 17550 H1 WAT 6968 50.195 17.762 131.144 1.00 0.00 H ATOM 17551 H2 WAT 6968 50.659 17.435 132.547 1.00 0.00 H TER 17553 WAT 6968 ATOM 17553 O WAT 6969 97.189 96.730 144.438 1.00 0.00 O ATOM 17554 H1 WAT 6969 97.136 96.232 143.623 1.00 0.00 H ATOM 17555 H2 WAT 6969 96.403 96.480 144.923 1.00 0.00 H TER 17557 WAT 6969 ATOM 17557 O WAT 6970 87.434 58.763 147.241 1.00 0.00 O ATOM 17558 H1 WAT 6970 87.166 58.173 147.945 1.00 0.00 H ATOM 17559 H2 WAT 6970 86.657 59.292 147.062 1.00 0.00 H TER 17561 WAT 6970 ATOM 17561 O WAT 6971 119.965 131.458 150.054 1.00 0.00 O ATOM 17562 H1 WAT 6971 119.274 130.886 150.388 1.00 0.00 H ATOM 17563 H2 WAT 6971 120.395 130.942 149.372 1.00 0.00 H TER 17565 WAT 6971 ATOM 17565 O WAT 6972 18.588 85.138 4.173 1.00 0.00 O ATOM 17566 H1 WAT 6972 19.091 84.337 4.323 1.00 0.00 H ATOM 17567 H2 WAT 6972 18.529 85.549 5.035 1.00 0.00 H TER 17569 WAT 6972 ATOM 17569 O WAT 6973 137.300 100.819 7.377 1.00 0.00 O ATOM 17570 H1 WAT 6973 137.811 101.234 6.681 1.00 0.00 H ATOM 17571 H2 WAT 6973 137.148 101.519 8.012 1.00 0.00 H TER 17573 WAT 6973 ATOM 17573 O WAT 6974 49.971 128.084 137.651 1.00 0.00 O ATOM 17574 H1 WAT 6974 49.050 128.264 137.462 1.00 0.00 H ATOM 17575 H2 WAT 6974 50.336 128.934 137.896 1.00 0.00 H TER 17577 WAT 6974 ATOM 17577 O WAT 6975 96.931 100.320 0.070 1.00 0.00 O ATOM 17578 H1 WAT 6975 96.313 100.926 0.479 1.00 0.00 H ATOM 17579 H2 WAT 6975 97.591 100.160 0.744 1.00 0.00 H TER 17581 WAT 6975 ATOM 17581 O WAT 6976 127.175 139.943 136.811 1.00 0.00 O ATOM 17582 H1 WAT 6976 127.165 140.280 137.707 1.00 0.00 H ATOM 17583 H2 WAT 6976 128.068 140.103 136.505 1.00 0.00 H TER 17585 WAT 6976 ATOM 17585 O WAT 6977 11.588 110.460 106.324 1.00 0.00 O ATOM 17586 H1 WAT 6977 11.264 110.875 107.124 1.00 0.00 H ATOM 17587 H2 WAT 6977 12.075 111.152 105.876 1.00 0.00 H TER 17589 WAT 6977 ATOM 17589 O WAT 6978 112.543 81.888 72.739 1.00 0.00 O ATOM 17590 H1 WAT 6978 111.982 82.664 72.763 1.00 0.00 H ATOM 17591 H2 WAT 6978 112.697 81.675 73.659 1.00 0.00 H TER 17593 WAT 6978 ATOM 17593 O WAT 6979 53.733 33.561 89.690 1.00 0.00 O ATOM 17594 H1 WAT 6979 54.137 34.428 89.714 1.00 0.00 H ATOM 17595 H2 WAT 6979 54.453 32.966 89.482 1.00 0.00 H TER 17597 WAT 6979 ATOM 17597 O WAT 6980 88.772 61.620 82.327 1.00 0.00 O ATOM 17598 H1 WAT 6980 88.299 61.544 81.499 1.00 0.00 H ATOM 17599 H2 WAT 6980 89.568 61.106 82.197 1.00 0.00 H TER 17601 WAT 6980 ATOM 17601 O WAT 6981 126.944 126.676 119.189 1.00 0.00 O ATOM 17602 H1 WAT 6981 126.316 127.347 118.925 1.00 0.00 H ATOM 17603 H2 WAT 6981 126.405 125.914 119.403 1.00 0.00 H TER 17605 WAT 6981 ATOM 17605 O WAT 6982 138.060 52.887 125.477 1.00 0.00 O ATOM 17606 H1 WAT 6982 137.704 52.539 124.660 1.00 0.00 H ATOM 17607 H2 WAT 6982 137.289 53.123 125.994 1.00 0.00 H TER 17609 WAT 6982 ATOM 17609 O WAT 6983 54.312 42.459 143.101 1.00 0.00 O ATOM 17610 H1 WAT 6983 53.536 42.430 142.542 1.00 0.00 H ATOM 17611 H2 WAT 6983 55.045 42.545 142.491 1.00 0.00 H TER 17613 WAT 6983 ATOM 17613 O WAT 6984 84.870 78.988 149.736 1.00 0.00 O ATOM 17614 H1 WAT 6984 83.945 78.926 149.496 1.00 0.00 H ATOM 17615 H2 WAT 6984 85.048 78.179 150.215 1.00 0.00 H TER 17617 WAT 6984 ATOM 17617 O WAT 6985 129.824 20.320 142.545 1.00 0.00 O ATOM 17618 H1 WAT 6985 130.493 20.340 143.230 1.00 0.00 H ATOM 17619 H2 WAT 6985 129.592 21.239 142.410 1.00 0.00 H TER 17621 WAT 6985 ATOM 17621 O WAT 6986 58.917 94.804 66.806 1.00 0.00 O ATOM 17622 H1 WAT 6986 59.698 95.349 66.898 1.00 0.00 H ATOM 17623 H2 WAT 6986 58.282 95.190 67.410 1.00 0.00 H TER 17625 WAT 6986 ATOM 17625 O WAT 6987 142.631 24.842 137.977 1.00 0.00 O ATOM 17626 H1 WAT 6987 142.636 25.749 138.284 1.00 0.00 H ATOM 17627 H2 WAT 6987 142.791 24.322 138.764 1.00 0.00 H TER 17629 WAT 6987 ATOM 17629 O WAT 6988 127.816 4.198 133.682 1.00 0.00 O ATOM 17630 H1 WAT 6988 127.090 4.265 133.062 1.00 0.00 H ATOM 17631 H2 WAT 6988 127.403 4.266 134.543 1.00 0.00 H TER 17633 WAT 6988 ATOM 17633 O WAT 6989 81.463 106.389 155.078 1.00 0.00 O ATOM 17634 H1 WAT 6989 81.546 105.974 155.936 1.00 0.00 H ATOM 17635 H2 WAT 6989 80.763 105.902 154.642 1.00 0.00 H TER 17637 WAT 6989 ATOM 17637 O WAT 6990 53.535 53.084 7.601 1.00 0.00 O ATOM 17638 H1 WAT 6990 53.193 53.633 6.895 1.00 0.00 H ATOM 17639 H2 WAT 6990 52.897 52.375 7.684 1.00 0.00 H TER 17641 WAT 6990 ATOM 17641 O WAT 6991 53.347 82.080 26.454 1.00 0.00 O ATOM 17642 H1 WAT 6991 53.919 81.339 26.253 1.00 0.00 H ATOM 17643 H2 WAT 6991 52.467 81.704 26.475 1.00 0.00 H TER 17645 WAT 6991 ATOM 17645 O WAT 6992 100.148 112.701 78.839 1.00 0.00 O ATOM 17646 H1 WAT 6992 100.959 113.208 78.816 1.00 0.00 H ATOM 17647 H2 WAT 6992 100.311 112.017 79.488 1.00 0.00 H TER 17649 WAT 6992 ATOM 17649 O WAT 6993 142.159 119.118 89.395 1.00 0.00 O ATOM 17650 H1 WAT 6993 142.992 118.716 89.643 1.00 0.00 H ATOM 17651 H2 WAT 6993 142.356 119.600 88.592 1.00 0.00 H TER 17653 WAT 6993 ATOM 17653 O WAT 6994 96.438 22.114 78.883 1.00 0.00 O ATOM 17654 H1 WAT 6994 96.053 22.522 79.659 1.00 0.00 H ATOM 17655 H2 WAT 6994 96.591 21.205 79.141 1.00 0.00 H TER 17657 WAT 6994 ATOM 17657 O WAT 6995 15.818 89.781 131.813 1.00 0.00 O ATOM 17658 H1 WAT 6995 15.088 89.836 132.430 1.00 0.00 H ATOM 17659 H2 WAT 6995 16.179 90.667 131.790 1.00 0.00 H TER 17661 WAT 6995 ATOM 17661 O WAT 6996 37.039 40.299 56.720 1.00 0.00 O ATOM 17662 H1 WAT 6996 37.738 39.746 56.371 1.00 0.00 H ATOM 17663 H2 WAT 6996 36.767 39.861 57.527 1.00 0.00 H TER 17665 WAT 6996 ATOM 17665 O WAT 6997 48.365 110.830 132.539 1.00 0.00 O ATOM 17666 H1 WAT 6997 47.499 110.842 132.131 1.00 0.00 H ATOM 17667 H2 WAT 6997 48.572 109.901 132.635 1.00 0.00 H TER 17669 WAT 6997 ATOM 17669 O WAT 6998 7.982 21.385 68.378 1.00 0.00 O ATOM 17670 H1 WAT 6998 8.366 20.807 69.038 1.00 0.00 H ATOM 17671 H2 WAT 6998 7.326 21.892 68.856 1.00 0.00 H TER 17673 WAT 6998 ATOM 17673 O WAT 6999 51.295 27.752 152.316 1.00 0.00 O ATOM 17674 H1 WAT 6999 50.775 27.781 151.513 1.00 0.00 H ATOM 17675 H2 WAT 6999 52.123 27.352 152.052 1.00 0.00 H TER 17677 WAT 6999 ATOM 17677 O WAT 7000 55.005 81.838 64.478 1.00 0.00 O ATOM 17678 H1 WAT 7000 55.158 80.910 64.655 1.00 0.00 H ATOM 17679 H2 WAT 7000 54.244 82.062 65.015 1.00 0.00 H TER 17681 WAT 7000 ATOM 17681 O WAT 7001 31.996 122.127 64.603 1.00 0.00 O ATOM 17682 H1 WAT 7001 31.111 122.208 64.958 1.00 0.00 H ATOM 17683 H2 WAT 7001 32.087 122.876 64.013 1.00 0.00 H TER 17685 WAT 7001 ATOM 17685 O WAT 7002 66.932 44.446 67.488 1.00 0.00 O ATOM 17686 H1 WAT 7002 66.389 45.217 67.323 1.00 0.00 H ATOM 17687 H2 WAT 7002 67.809 44.706 67.207 1.00 0.00 H TER 17689 WAT 7002 ATOM 17689 O WAT 7003 70.891 134.965 135.293 1.00 0.00 O ATOM 17690 H1 WAT 7003 70.312 134.789 136.035 1.00 0.00 H ATOM 17691 H2 WAT 7003 70.352 134.791 134.522 1.00 0.00 H TER 17693 WAT 7003 ATOM 17693 O WAT 7004 126.679 134.600 149.127 1.00 0.00 O ATOM 17694 H1 WAT 7004 125.969 134.913 148.567 1.00 0.00 H ATOM 17695 H2 WAT 7004 126.239 134.099 149.814 1.00 0.00 H TER 17697 WAT 7004 ATOM 17697 O WAT 7005 50.884 22.403 105.890 1.00 0.00 O ATOM 17698 H1 WAT 7005 51.450 21.953 106.518 1.00 0.00 H ATOM 17699 H2 WAT 7005 50.403 21.699 105.455 1.00 0.00 H TER 17701 WAT 7005 ATOM 17701 O WAT 7006 4.161 37.108 10.148 1.00 0.00 O ATOM 17702 H1 WAT 7006 4.107 36.900 11.081 1.00 0.00 H ATOM 17703 H2 WAT 7006 4.629 36.367 9.764 1.00 0.00 H TER 17705 WAT 7006 ATOM 17705 O WAT 7007 123.132 28.600 153.237 1.00 0.00 O ATOM 17706 H1 WAT 7007 123.198 27.745 152.812 1.00 0.00 H ATOM 17707 H2 WAT 7007 124.017 28.961 153.187 1.00 0.00 H TER 17709 WAT 7007 ATOM 17709 O WAT 7008 48.368 52.793 57.959 1.00 0.00 O ATOM 17710 H1 WAT 7008 48.791 53.445 57.401 1.00 0.00 H ATOM 17711 H2 WAT 7008 49.093 52.326 58.374 1.00 0.00 H TER 17713 WAT 7008 ATOM 17713 O WAT 7009 85.658 92.791 146.819 1.00 0.00 O ATOM 17714 H1 WAT 7009 85.379 93.586 146.365 1.00 0.00 H ATOM 17715 H2 WAT 7009 85.041 92.120 146.527 1.00 0.00 H TER 17717 WAT 7009 ATOM 17717 O WAT 7010 82.250 107.756 7.731 1.00 0.00 O ATOM 17718 H1 WAT 7010 82.008 108.649 7.484 1.00 0.00 H ATOM 17719 H2 WAT 7010 83.206 107.771 7.776 1.00 0.00 H TER 17721 WAT 7010 ATOM 17721 O WAT 7011 18.053 59.417 119.430 1.00 0.00 O ATOM 17722 H1 WAT 7011 18.359 58.885 118.696 1.00 0.00 H ATOM 17723 H2 WAT 7011 18.270 60.315 119.182 1.00 0.00 H TER 17725 WAT 7011 ATOM 17725 O WAT 7012 137.736 31.668 96.098 1.00 0.00 O ATOM 17726 H1 WAT 7012 137.288 31.705 96.943 1.00 0.00 H ATOM 17727 H2 WAT 7012 137.047 31.450 95.471 1.00 0.00 H TER 17729 WAT 7012 ATOM 17729 O WAT 7013 41.795 85.145 140.705 1.00 0.00 O ATOM 17730 H1 WAT 7013 41.207 84.900 139.991 1.00 0.00 H ATOM 17731 H2 WAT 7013 41.283 84.993 141.500 1.00 0.00 H TER 17733 WAT 7013 ATOM 17733 O WAT 7014 86.647 82.994 7.435 1.00 0.00 O ATOM 17734 H1 WAT 7014 87.178 83.771 7.260 1.00 0.00 H ATOM 17735 H2 WAT 7014 87.253 82.261 7.327 1.00 0.00 H TER 17737 WAT 7014 ATOM 17737 O WAT 7015 72.078 54.936 146.956 1.00 0.00 O ATOM 17738 H1 WAT 7015 71.610 55.002 146.124 1.00 0.00 H ATOM 17739 H2 WAT 7015 72.497 54.076 146.927 1.00 0.00 H TER 17741 WAT 7015 ATOM 17741 O WAT 7016 4.068 137.849 105.486 1.00 0.00 O ATOM 17742 H1 WAT 7016 3.492 138.289 104.861 1.00 0.00 H ATOM 17743 H2 WAT 7016 3.911 136.916 105.341 1.00 0.00 H TER 17745 WAT 7016 ATOM 17745 O WAT 7017 4.515 138.587 85.392 1.00 0.00 O ATOM 17746 H1 WAT 7017 5.237 138.696 86.010 1.00 0.00 H ATOM 17747 H2 WAT 7017 4.776 137.845 84.846 1.00 0.00 H TER 17749 WAT 7017 ATOM 17749 O WAT 7018 61.885 88.186 155.233 1.00 0.00 O ATOM 17750 H1 WAT 7018 61.383 87.583 155.781 1.00 0.00 H ATOM 17751 H2 WAT 7018 62.795 88.051 155.498 1.00 0.00 H TER 17753 WAT 7018 ATOM 17753 O WAT 7019 28.472 53.290 152.051 1.00 0.00 O ATOM 17754 H1 WAT 7019 28.597 54.063 151.500 1.00 0.00 H ATOM 17755 H2 WAT 7019 27.692 53.489 152.569 1.00 0.00 H TER 17757 WAT 7019 ATOM 17757 O WAT 7020 128.242 119.752 98.842 1.00 0.00 O ATOM 17758 H1 WAT 7020 128.527 120.502 98.320 1.00 0.00 H ATOM 17759 H2 WAT 7020 128.501 119.971 99.737 1.00 0.00 H TER 17761 WAT 7020 ATOM 17761 O WAT 7021 22.933 66.887 92.154 1.00 0.00 O ATOM 17762 H1 WAT 7021 22.347 66.226 91.783 1.00 0.00 H ATOM 17763 H2 WAT 7021 22.615 67.013 93.048 1.00 0.00 H TER 17765 WAT 7021 ATOM 17765 O WAT 7022 44.898 2.591 149.058 1.00 0.00 O ATOM 17766 H1 WAT 7022 45.353 3.087 148.377 1.00 0.00 H ATOM 17767 H2 WAT 7022 44.343 1.978 148.577 1.00 0.00 H TER 17769 WAT 7022 ATOM 17769 O WAT 7023 40.208 33.401 118.404 1.00 0.00 O ATOM 17770 H1 WAT 7023 40.733 32.879 119.012 1.00 0.00 H ATOM 17771 H2 WAT 7023 40.256 32.923 117.576 1.00 0.00 H TER 17773 WAT 7023 ATOM 17773 O WAT 7024 74.157 125.438 150.992 1.00 0.00 O ATOM 17774 H1 WAT 7024 74.506 124.672 151.449 1.00 0.00 H ATOM 17775 H2 WAT 7024 74.040 125.145 150.088 1.00 0.00 H TER 17777 WAT 7024 ATOM 17777 O WAT 7025 108.020 96.893 124.476 1.00 0.00 O ATOM 17778 H1 WAT 7025 108.721 96.245 124.410 1.00 0.00 H ATOM 17779 H2 WAT 7025 107.228 96.413 124.234 1.00 0.00 H TER 17781 WAT 7025 ATOM 17781 O WAT 7026 26.777 29.425 13.888 1.00 0.00 O ATOM 17782 H1 WAT 7026 27.398 29.723 13.223 1.00 0.00 H ATOM 17783 H2 WAT 7026 26.543 28.538 13.617 1.00 0.00 H TER 17785 WAT 7026 ATOM 17785 O WAT 7027 42.883 118.680 2.637 1.00 0.00 O ATOM 17786 H1 WAT 7027 43.107 118.158 1.866 1.00 0.00 H ATOM 17787 H2 WAT 7027 41.934 118.590 2.720 1.00 0.00 H TER 17789 WAT 7027 ATOM 17789 O WAT 7028 42.449 128.135 2.370 1.00 0.00 O ATOM 17790 H1 WAT 7028 43.072 128.147 3.097 1.00 0.00 H ATOM 17791 H2 WAT 7028 42.934 128.507 1.634 1.00 0.00 H TER 17793 WAT 7028 ATOM 17793 O WAT 7029 128.672 93.524 71.741 1.00 0.00 O ATOM 17794 H1 WAT 7029 128.397 92.691 72.126 1.00 0.00 H ATOM 17795 H2 WAT 7029 128.140 94.182 72.188 1.00 0.00 H TER 17797 WAT 7029 ATOM 17797 O WAT 7030 82.519 91.050 4.023 1.00 0.00 O ATOM 17798 H1 WAT 7030 81.572 90.915 4.050 1.00 0.00 H ATOM 17799 H2 WAT 7030 82.797 90.983 4.937 1.00 0.00 H TER 17801 WAT 7030 ATOM 17801 O WAT 7031 17.272 39.362 13.252 1.00 0.00 O ATOM 17802 H1 WAT 7031 16.526 39.788 12.829 1.00 0.00 H ATOM 17803 H2 WAT 7031 17.376 38.536 12.780 1.00 0.00 H TER 17805 WAT 7031 ATOM 17805 O WAT 7032 27.618 81.115 82.207 1.00 0.00 O ATOM 17806 H1 WAT 7032 27.368 82.039 82.190 1.00 0.00 H ATOM 17807 H2 WAT 7032 26.949 80.676 81.682 1.00 0.00 H TER 17809 WAT 7032 ATOM 17809 O WAT 7033 64.426 83.489 58.012 1.00 0.00 O ATOM 17810 H1 WAT 7033 65.252 83.875 58.304 1.00 0.00 H ATOM 17811 H2 WAT 7033 63.843 83.571 58.766 1.00 0.00 H TER 17813 WAT 7033 ATOM 17813 O WAT 7034 64.625 2.553 136.897 1.00 0.00 O ATOM 17814 H1 WAT 7034 65.560 2.582 136.693 1.00 0.00 H ATOM 17815 H2 WAT 7034 64.309 1.761 136.463 1.00 0.00 H TER 17817 WAT 7034 ATOM 17817 O WAT 7035 58.908 66.060 152.224 1.00 0.00 O ATOM 17818 H1 WAT 7035 59.254 65.805 151.369 1.00 0.00 H ATOM 17819 H2 WAT 7035 59.658 66.441 152.682 1.00 0.00 H TER 17821 WAT 7035 ATOM 17821 O WAT 7036 42.391 82.794 84.381 1.00 0.00 O ATOM 17822 H1 WAT 7036 42.964 82.937 83.627 1.00 0.00 H ATOM 17823 H2 WAT 7036 42.990 82.704 85.122 1.00 0.00 H TER 17825 WAT 7036 ATOM 17825 O WAT 7037 34.577 81.266 133.731 1.00 0.00 O ATOM 17826 H1 WAT 7037 34.930 80.399 133.931 1.00 0.00 H ATOM 17827 H2 WAT 7037 34.627 81.742 134.560 1.00 0.00 H TER 17829 WAT 7037 ATOM 17829 O WAT 7038 43.585 88.095 69.054 1.00 0.00 O ATOM 17830 H1 WAT 7038 43.013 87.410 69.400 1.00 0.00 H ATOM 17831 H2 WAT 7038 44.033 88.444 69.824 1.00 0.00 H TER 17833 WAT 7038 ATOM 17833 O WAT 7039 4.603 140.659 18.947 1.00 0.00 O ATOM 17834 H1 WAT 7039 4.133 141.211 19.573 1.00 0.00 H ATOM 17835 H2 WAT 7039 5.425 141.124 18.790 1.00 0.00 H TER 17837 WAT 7039 ATOM 17837 O WAT 7040 113.785 59.386 128.007 1.00 0.00 O ATOM 17838 H1 WAT 7040 114.361 60.148 127.942 1.00 0.00 H ATOM 17839 H2 WAT 7040 114.353 58.640 127.814 1.00 0.00 H TER 17841 WAT 7040 ATOM 17841 O WAT 7041 23.264 136.018 60.786 1.00 0.00 O ATOM 17842 H1 WAT 7041 23.363 136.969 60.746 1.00 0.00 H ATOM 17843 H2 WAT 7041 23.959 135.729 61.378 1.00 0.00 H TER 17845 WAT 7041 ATOM 17845 O WAT 7042 91.174 34.200 2.550 1.00 0.00 O ATOM 17846 H1 WAT 7042 91.354 33.660 1.780 1.00 0.00 H ATOM 17847 H2 WAT 7042 92.005 34.226 3.024 1.00 0.00 H TER 17849 WAT 7042 ATOM 17849 O WAT 7043 15.857 74.361 124.393 1.00 0.00 O ATOM 17850 H1 WAT 7043 15.294 74.547 125.145 1.00 0.00 H ATOM 17851 H2 WAT 7043 16.700 74.121 124.779 1.00 0.00 H TER 17853 WAT 7043 ATOM 17853 O WAT 7044 71.592 86.043 10.783 1.00 0.00 O ATOM 17854 H1 WAT 7044 71.941 86.756 10.248 1.00 0.00 H ATOM 17855 H2 WAT 7044 71.924 86.218 11.663 1.00 0.00 H TER 17857 WAT 7044 ATOM 17857 O WAT 7045 88.383 84.712 80.659 1.00 0.00 O ATOM 17858 H1 WAT 7045 87.715 84.072 80.906 1.00 0.00 H ATOM 17859 H2 WAT 7045 88.174 84.939 79.753 1.00 0.00 H TER 17861 WAT 7045 ATOM 17861 O WAT 7046 38.678 60.090 149.998 1.00 0.00 O ATOM 17862 H1 WAT 7046 39.438 60.419 149.517 1.00 0.00 H ATOM 17863 H2 WAT 7046 38.496 59.238 149.603 1.00 0.00 H TER 17865 WAT 7046 ATOM 17865 O WAT 7047 87.206 116.491 106.195 1.00 0.00 O ATOM 17866 H1 WAT 7047 87.550 116.982 106.941 1.00 0.00 H ATOM 17867 H2 WAT 7047 86.307 116.803 106.097 1.00 0.00 H TER 17869 WAT 7047 ATOM 17869 O WAT 7048 44.852 100.382 129.216 1.00 0.00 O ATOM 17870 H1 WAT 7048 44.594 99.938 128.408 1.00 0.00 H ATOM 17871 H2 WAT 7048 45.144 101.247 128.931 1.00 0.00 H TER 17873 WAT 7048 ATOM 17873 O WAT 7049 76.242 120.994 22.032 1.00 0.00 O ATOM 17874 H1 WAT 7049 76.165 121.398 21.167 1.00 0.00 H ATOM 17875 H2 WAT 7049 76.892 120.301 21.916 1.00 0.00 H TER 17877 WAT 7049 ATOM 17877 O WAT 7050 103.549 74.063 4.204 1.00 0.00 O ATOM 17878 H1 WAT 7050 104.350 73.758 3.777 1.00 0.00 H ATOM 17879 H2 WAT 7050 103.500 74.993 3.985 1.00 0.00 H TER 17881 WAT 7050 ATOM 17881 O WAT 7051 134.049 29.632 97.952 1.00 0.00 O ATOM 17882 H1 WAT 7051 134.863 29.337 97.544 1.00 0.00 H ATOM 17883 H2 WAT 7051 133.642 28.830 98.281 1.00 0.00 H TER 17885 WAT 7051 ATOM 17885 O WAT 7052 121.543 140.180 148.023 1.00 0.00 O ATOM 17886 H1 WAT 7052 121.721 140.643 147.204 1.00 0.00 H ATOM 17887 H2 WAT 7052 121.210 139.326 147.748 1.00 0.00 H TER 17889 WAT 7052 ATOM 17889 O WAT 7053 24.642 109.055 119.914 1.00 0.00 O ATOM 17890 H1 WAT 7053 24.935 108.440 120.587 1.00 0.00 H ATOM 17891 H2 WAT 7053 23.700 108.900 119.844 1.00 0.00 H TER 17893 WAT 7053 ATOM 17893 O WAT 7054 73.859 142.946 99.047 1.00 0.00 O ATOM 17894 H1 WAT 7054 74.465 143.586 99.419 1.00 0.00 H ATOM 17895 H2 WAT 7054 73.039 143.089 99.521 1.00 0.00 H TER 17897 WAT 7054 ATOM 17897 O WAT 7055 10.956 89.227 130.545 1.00 0.00 O ATOM 17898 H1 WAT 7055 11.797 89.505 130.182 1.00 0.00 H ATOM 17899 H2 WAT 7055 10.319 89.829 130.162 1.00 0.00 H TER 17901 WAT 7055 ATOM 17901 O WAT 7056 124.579 5.613 144.018 1.00 0.00 O ATOM 17902 H1 WAT 7056 125.357 5.964 143.584 1.00 0.00 H ATOM 17903 H2 WAT 7056 124.648 4.665 143.903 1.00 0.00 H TER 17905 WAT 7056 ATOM 17905 O WAT 7057 26.717 44.399 135.219 1.00 0.00 O ATOM 17906 H1 WAT 7057 26.690 43.772 135.942 1.00 0.00 H ATOM 17907 H2 WAT 7057 25.797 44.548 134.996 1.00 0.00 H TER 17909 WAT 7057 ATOM 17909 O WAT 7058 93.926 145.155 73.532 1.00 0.00 O ATOM 17910 H1 WAT 7058 94.076 145.513 72.657 1.00 0.00 H ATOM 17911 H2 WAT 7058 92.977 145.201 73.651 1.00 0.00 H TER 17913 WAT 7058 ATOM 17913 O WAT 7059 89.981 30.812 96.859 1.00 0.00 O ATOM 17914 H1 WAT 7059 90.477 30.266 96.249 1.00 0.00 H ATOM 17915 H2 WAT 7059 90.010 30.334 97.687 1.00 0.00 H TER 17917 WAT 7059 ATOM 17917 O WAT 7060 127.023 38.654 61.262 1.00 0.00 O ATOM 17918 H1 WAT 7060 127.300 38.701 60.347 1.00 0.00 H ATOM 17919 H2 WAT 7060 126.277 38.055 61.257 1.00 0.00 H TER 17921 WAT 7060 ATOM 17921 O WAT 7061 58.692 108.098 75.004 1.00 0.00 O ATOM 17922 H1 WAT 7061 59.126 108.439 74.222 1.00 0.00 H ATOM 17923 H2 WAT 7061 58.279 108.865 75.402 1.00 0.00 H TER 17925 WAT 7061 ATOM 17925 O WAT 7062 53.344 119.313 72.413 1.00 0.00 O ATOM 17926 H1 WAT 7062 53.969 118.815 71.886 1.00 0.00 H ATOM 17927 H2 WAT 7062 53.846 119.590 73.180 1.00 0.00 H TER 17929 WAT 7062 ATOM 17929 O WAT 7063 74.103 84.533 127.583 1.00 0.00 O ATOM 17930 H1 WAT 7063 74.215 84.731 126.653 1.00 0.00 H ATOM 17931 H2 WAT 7063 74.854 83.982 127.802 1.00 0.00 H TER 17933 WAT 7063 ATOM 17933 O WAT 7064 49.844 34.911 116.842 1.00 0.00 O ATOM 17934 H1 WAT 7064 49.356 35.679 117.140 1.00 0.00 H ATOM 17935 H2 WAT 7064 50.004 35.074 115.913 1.00 0.00 H TER 17937 WAT 7064 ATOM 17937 O WAT 7065 108.729 112.508 71.091 1.00 0.00 O ATOM 17938 H1 WAT 7065 109.408 111.940 70.727 1.00 0.00 H ATOM 17939 H2 WAT 7065 108.831 112.426 72.039 1.00 0.00 H TER 17941 WAT 7065 ATOM 17941 O WAT 7066 75.811 4.126 93.862 1.00 0.00 O ATOM 17942 H1 WAT 7066 75.486 3.226 93.839 1.00 0.00 H ATOM 17943 H2 WAT 7066 75.022 4.665 93.903 1.00 0.00 H TER 17945 WAT 7066 ATOM 17945 O WAT 7067 98.774 25.085 70.232 1.00 0.00 O ATOM 17946 H1 WAT 7067 99.667 25.062 70.579 1.00 0.00 H ATOM 17947 H2 WAT 7067 98.843 24.680 69.368 1.00 0.00 H TER 17949 WAT 7067 ATOM 17949 O WAT 7068 37.645 0.732 107.738 1.00 0.00 O ATOM 17950 H1 WAT 7068 37.025 1.175 107.159 1.00 0.00 H ATOM 17951 H2 WAT 7068 38.501 1.074 107.480 1.00 0.00 H TER 17953 WAT 7068 ATOM 17953 O WAT 7069 39.046 90.269 154.697 1.00 0.00 O ATOM 17954 H1 WAT 7069 38.203 90.548 154.340 1.00 0.00 H ATOM 17955 H2 WAT 7069 39.205 89.415 154.295 1.00 0.00 H TER 17957 WAT 7069 ATOM 17957 O WAT 7070 109.017 22.996 134.354 1.00 0.00 O ATOM 17958 H1 WAT 7070 109.034 22.284 133.714 1.00 0.00 H ATOM 17959 H2 WAT 7070 109.939 23.167 134.546 1.00 0.00 H TER 17961 WAT 7070 ATOM 17961 O WAT 7071 118.158 22.064 67.593 1.00 0.00 O ATOM 17962 H1 WAT 7071 119.077 22.079 67.326 1.00 0.00 H ATOM 17963 H2 WAT 7071 117.669 22.086 66.770 1.00 0.00 H TER 17965 WAT 7071 ATOM 17965 O WAT 7072 131.061 26.954 4.010 1.00 0.00 O ATOM 17966 H1 WAT 7072 131.981 26.720 3.883 1.00 0.00 H ATOM 17967 H2 WAT 7072 131.057 27.487 4.804 1.00 0.00 H TER 17969 WAT 7072 ATOM 17969 O WAT 7073 138.035 59.829 140.121 1.00 0.00 O ATOM 17970 H1 WAT 7073 138.956 59.578 140.063 1.00 0.00 H ATOM 17971 H2 WAT 7073 137.639 59.474 139.325 1.00 0.00 H TER 17973 WAT 7073 ATOM 17973 O WAT 7074 59.132 107.497 127.630 1.00 0.00 O ATOM 17974 H1 WAT 7074 59.896 108.071 127.574 1.00 0.00 H ATOM 17975 H2 WAT 7074 58.559 107.792 126.922 1.00 0.00 H TER 17977 WAT 7074 ATOM 17977 O WAT 7075 19.020 43.215 105.847 1.00 0.00 O ATOM 17978 H1 WAT 7075 18.404 43.231 106.579 1.00 0.00 H ATOM 17979 H2 WAT 7075 19.881 43.304 106.255 1.00 0.00 H TER 17981 WAT 7075 ATOM 17981 O WAT 7076 80.803 34.819 93.364 1.00 0.00 O ATOM 17982 H1 WAT 7076 80.367 34.666 94.202 1.00 0.00 H ATOM 17983 H2 WAT 7076 80.092 34.831 92.723 1.00 0.00 H TER 17985 WAT 7076 ATOM 17985 O WAT 7077 112.190 63.623 156.191 1.00 0.00 O ATOM 17986 H1 WAT 7077 112.231 64.579 156.155 1.00 0.00 H ATOM 17987 H2 WAT 7077 112.472 63.404 157.079 1.00 0.00 H TER 17989 WAT 7077 ATOM 17989 O WAT 7078 47.549 139.970 91.462 1.00 0.00 O ATOM 17990 H1 WAT 7078 47.886 140.680 92.009 1.00 0.00 H ATOM 17991 H2 WAT 7078 46.670 139.803 91.801 1.00 0.00 H TER 17993 WAT 7078 ATOM 17993 O WAT 7079 25.004 79.888 67.629 1.00 0.00 O ATOM 17994 H1 WAT 7079 25.841 79.512 67.358 1.00 0.00 H ATOM 17995 H2 WAT 7079 25.111 80.830 67.500 1.00 0.00 H TER 17997 WAT 7079 ATOM 17997 O WAT 7080 3.736 11.066 121.605 1.00 0.00 O ATOM 17998 H1 WAT 7080 4.218 11.416 120.856 1.00 0.00 H ATOM 17999 H2 WAT 7080 3.398 11.840 122.055 1.00 0.00 H TER 18001 WAT 7080 ATOM 18001 O WAT 7081 115.368 36.764 57.944 1.00 0.00 O ATOM 18002 H1 WAT 7081 116.098 37.376 57.849 1.00 0.00 H ATOM 18003 H2 WAT 7081 114.987 36.708 57.068 1.00 0.00 H TER 18005 WAT 7081 ATOM 18005 O WAT 7082 101.798 65.025 108.850 1.00 0.00 O ATOM 18006 H1 WAT 7082 101.313 64.446 109.439 1.00 0.00 H ATOM 18007 H2 WAT 7082 101.122 65.460 108.331 1.00 0.00 H TER 18009 WAT 7082 ATOM 18009 O WAT 7083 112.343 122.712 157.657 1.00 0.00 O ATOM 18010 H1 WAT 7083 113.049 122.596 157.022 1.00 0.00 H ATOM 18011 H2 WAT 7083 112.637 122.233 158.432 1.00 0.00 H TER 18013 WAT 7083 ATOM 18013 O WAT 7084 143.370 132.720 147.833 1.00 0.00 O ATOM 18014 H1 WAT 7084 142.859 131.916 147.928 1.00 0.00 H ATOM 18015 H2 WAT 7084 143.878 132.589 147.033 1.00 0.00 H TER 18017 WAT 7084 ATOM 18017 O WAT 7085 113.216 18.226 81.367 1.00 0.00 O ATOM 18018 H1 WAT 7085 113.466 17.430 81.836 1.00 0.00 H ATOM 18019 H2 WAT 7085 112.665 17.917 80.648 1.00 0.00 H TER 18021 WAT 7085 ATOM 18021 O WAT 7086 97.225 137.445 118.846 1.00 0.00 O ATOM 18022 H1 WAT 7086 97.165 136.492 118.908 1.00 0.00 H ATOM 18023 H2 WAT 7086 97.328 137.738 119.751 1.00 0.00 H TER 18025 WAT 7086 ATOM 18025 O WAT 7087 6.327 97.859 81.817 1.00 0.00 O ATOM 18026 H1 WAT 7087 5.797 98.305 81.156 1.00 0.00 H ATOM 18027 H2 WAT 7087 5.722 97.248 82.236 1.00 0.00 H TER 18029 WAT 7087 ATOM 18029 O WAT 7088 20.509 101.053 157.256 1.00 0.00 O ATOM 18030 H1 WAT 7088 20.603 101.704 157.952 1.00 0.00 H ATOM 18031 H2 WAT 7088 20.858 100.246 157.634 1.00 0.00 H TER 18033 WAT 7088 ATOM 18033 O WAT 7089 14.380 12.520 135.817 1.00 0.00 O ATOM 18034 H1 WAT 7089 14.465 13.258 136.420 1.00 0.00 H ATOM 18035 H2 WAT 7089 14.579 11.751 136.350 1.00 0.00 H TER 18037 WAT 7089 ATOM 18037 O WAT 7090 30.235 117.355 55.449 1.00 0.00 O ATOM 18038 H1 WAT 7090 31.079 117.546 55.041 1.00 0.00 H ATOM 18039 H2 WAT 7090 29.613 117.919 54.989 1.00 0.00 H TER 18041 WAT 7090 ATOM 18041 O WAT 7091 104.396 98.244 103.811 1.00 0.00 O ATOM 18042 H1 WAT 7091 103.881 97.445 103.922 1.00 0.00 H ATOM 18043 H2 WAT 7091 105.305 97.945 103.813 1.00 0.00 H TER 18045 WAT 7091 ATOM 18045 O WAT 7092 102.103 137.936 5.583 1.00 0.00 O ATOM 18046 H1 WAT 7092 102.595 138.002 6.401 1.00 0.00 H ATOM 18047 H2 WAT 7092 101.513 138.689 5.597 1.00 0.00 H TER 18049 WAT 7092 ATOM 18049 O WAT 7093 55.923 141.046 116.199 1.00 0.00 O ATOM 18050 H1 WAT 7093 56.600 140.486 116.579 1.00 0.00 H ATOM 18051 H2 WAT 7093 55.207 140.446 115.987 1.00 0.00 H TER 18053 WAT 7093 ATOM 18053 O WAT 7094 36.169 111.900 83.598 1.00 0.00 O ATOM 18054 H1 WAT 7094 37.073 111.588 83.646 1.00 0.00 H ATOM 18055 H2 WAT 7094 36.149 112.457 82.820 1.00 0.00 H TER 18057 WAT 7094 ATOM 18057 O WAT 7095 9.839 82.689 137.771 1.00 0.00 O ATOM 18058 H1 WAT 7095 10.582 82.758 138.371 1.00 0.00 H ATOM 18059 H2 WAT 7095 10.200 82.274 136.988 1.00 0.00 H TER 18061 WAT 7095 ATOM 18061 O WAT 7096 130.208 86.045 105.037 1.00 0.00 O ATOM 18062 H1 WAT 7096 129.420 86.502 104.742 1.00 0.00 H ATOM 18063 H2 WAT 7096 130.910 86.403 104.494 1.00 0.00 H TER 18065 WAT 7096 ATOM 18065 O WAT 7097 46.493 125.159 135.102 1.00 0.00 O ATOM 18066 H1 WAT 7097 46.724 126.086 135.040 1.00 0.00 H ATOM 18067 H2 WAT 7097 46.060 124.963 134.271 1.00 0.00 H TER 18069 WAT 7097 ATOM 18069 O WAT 7098 35.416 21.980 0.748 1.00 0.00 O ATOM 18070 H1 WAT 7098 34.848 21.211 0.699 1.00 0.00 H ATOM 18071 H2 WAT 7098 36.027 21.872 0.019 1.00 0.00 H TER 18073 WAT 7098 ATOM 18073 O WAT 7099 74.141 84.276 124.721 1.00 0.00 O ATOM 18074 H1 WAT 7099 74.013 83.472 125.225 1.00 0.00 H ATOM 18075 H2 WAT 7099 75.049 84.524 124.892 1.00 0.00 H TER 18077 WAT 7099 ATOM 18077 O WAT 7100 139.865 69.114 144.945 1.00 0.00 O ATOM 18078 H1 WAT 7100 139.327 68.323 144.946 1.00 0.00 H ATOM 18079 H2 WAT 7100 140.363 69.064 144.129 1.00 0.00 H TER 18081 WAT 7100 ATOM 18081 O WAT 7101 43.465 104.404 87.342 1.00 0.00 O ATOM 18082 H1 WAT 7101 43.373 105.270 86.946 1.00 0.00 H ATOM 18083 H2 WAT 7101 42.830 103.859 86.876 1.00 0.00 H TER 18085 WAT 7101 ATOM 18085 O WAT 7102 53.950 98.794 17.151 1.00 0.00 O ATOM 18086 H1 WAT 7102 54.253 98.947 18.046 1.00 0.00 H ATOM 18087 H2 WAT 7102 53.750 97.858 17.124 1.00 0.00 H TER 18089 WAT 7102 ATOM 18089 O WAT 7103 98.252 94.896 27.469 1.00 0.00 O ATOM 18090 H1 WAT 7103 98.918 94.572 26.862 1.00 0.00 H ATOM 18091 H2 WAT 7103 97.627 94.175 27.545 1.00 0.00 H TER 18093 WAT 7103 ATOM 18093 O WAT 7104 12.524 111.039 134.850 1.00 0.00 O ATOM 18094 H1 WAT 7104 12.616 111.938 135.167 1.00 0.00 H ATOM 18095 H2 WAT 7104 13.319 110.597 135.149 1.00 0.00 H TER 18097 WAT 7104 ATOM 18097 O WAT 7105 48.857 103.349 134.946 1.00 0.00 O ATOM 18098 H1 WAT 7105 48.129 102.763 134.741 1.00 0.00 H ATOM 18099 H2 WAT 7105 49.375 103.379 134.142 1.00 0.00 H TER 18101 WAT 7105 ATOM 18101 O WAT 7106 110.533 21.457 123.465 1.00 0.00 O ATOM 18102 H1 WAT 7106 109.613 21.350 123.223 1.00 0.00 H ATOM 18103 H2 WAT 7106 110.507 21.778 124.366 1.00 0.00 H TER 18105 WAT 7106 ATOM 18105 O WAT 7107 33.363 33.004 101.776 1.00 0.00 O ATOM 18106 H1 WAT 7107 34.265 32.698 101.865 1.00 0.00 H ATOM 18107 H2 WAT 7107 33.217 33.048 100.831 1.00 0.00 H TER 18109 WAT 7107 ATOM 18109 O WAT 7108 55.307 123.370 96.736 1.00 0.00 O ATOM 18110 H1 WAT 7108 55.914 123.976 96.311 1.00 0.00 H ATOM 18111 H2 WAT 7108 55.870 122.762 97.213 1.00 0.00 H TER 18113 WAT 7108 ATOM 18113 O WAT 7109 132.258 77.619 24.695 1.00 0.00 O ATOM 18114 H1 WAT 7109 133.019 77.599 25.274 1.00 0.00 H ATOM 18115 H2 WAT 7109 131.578 77.148 25.176 1.00 0.00 H TER 18117 WAT 7109 ATOM 18117 O WAT 7110 45.742 18.265 23.537 1.00 0.00 O ATOM 18118 H1 WAT 7110 45.649 18.912 22.837 1.00 0.00 H ATOM 18119 H2 WAT 7110 46.461 18.595 24.075 1.00 0.00 H TER 18121 WAT 7110 ATOM 18121 O WAT 7111 99.949 52.912 16.494 1.00 0.00 O ATOM 18122 H1 WAT 7111 99.670 53.023 15.585 1.00 0.00 H ATOM 18123 H2 WAT 7111 100.161 51.981 16.567 1.00 0.00 H TER 18125 WAT 7111 ATOM 18125 O WAT 7112 77.441 3.077 4.837 1.00 0.00 O ATOM 18126 H1 WAT 7112 77.852 2.830 4.008 1.00 0.00 H ATOM 18127 H2 WAT 7112 77.917 3.859 5.116 1.00 0.00 H TER 18129 WAT 7112 ATOM 18129 O WAT 7113 63.100 68.602 121.102 1.00 0.00 O ATOM 18130 H1 WAT 7113 62.548 67.824 121.181 1.00 0.00 H ATOM 18131 H2 WAT 7113 63.675 68.568 121.866 1.00 0.00 H TER 18133 WAT 7113 ATOM 18133 O WAT 7114 19.148 109.547 25.270 1.00 0.00 O ATOM 18134 H1 WAT 7114 19.313 109.971 24.427 1.00 0.00 H ATOM 18135 H2 WAT 7114 18.293 109.881 25.542 1.00 0.00 H TER 18137 WAT 7114 ATOM 18137 O WAT 7115 104.973 32.456 98.455 1.00 0.00 O ATOM 18138 H1 WAT 7115 105.397 33.183 97.999 1.00 0.00 H ATOM 18139 H2 WAT 7115 104.371 32.877 99.068 1.00 0.00 H TER 18141 WAT 7115 ATOM 18141 O WAT 7116 114.293 141.628 99.624 1.00 0.00 O ATOM 18142 H1 WAT 7116 113.546 141.983 99.141 1.00 0.00 H ATOM 18143 H2 WAT 7116 113.970 140.808 99.996 1.00 0.00 H TER 18145 WAT 7116 ATOM 18145 O WAT 7117 104.463 61.547 149.940 1.00 0.00 O ATOM 18146 H1 WAT 7117 103.813 61.385 149.256 1.00 0.00 H ATOM 18147 H2 WAT 7117 105.235 61.056 149.658 1.00 0.00 H TER 18149 WAT 7117 ATOM 18149 O WAT 7118 137.714 101.365 115.327 1.00 0.00 O ATOM 18150 H1 WAT 7118 138.210 101.432 116.143 1.00 0.00 H ATOM 18151 H2 WAT 7118 136.980 101.969 115.441 1.00 0.00 H TER 18153 WAT 7118 ATOM 18153 O WAT 7119 140.321 53.347 131.345 1.00 0.00 O ATOM 18154 H1 WAT 7119 140.459 53.855 130.546 1.00 0.00 H ATOM 18155 H2 WAT 7119 139.446 52.974 131.243 1.00 0.00 H TER 18157 WAT 7119 ATOM 18157 O WAT 7120 15.932 25.461 105.136 1.00 0.00 O ATOM 18158 H1 WAT 7120 16.083 26.293 105.586 1.00 0.00 H ATOM 18159 H2 WAT 7120 15.020 25.247 105.329 1.00 0.00 H TER 18161 WAT 7120 ATOM 18161 O WAT 7121 27.148 143.011 -0.125 1.00 0.00 O ATOM 18162 H1 WAT 7121 27.881 143.626 -0.112 1.00 0.00 H ATOM 18163 H2 WAT 7121 26.546 143.341 0.542 1.00 0.00 H TER 18165 WAT 7121 ATOM 18165 O WAT 7122 93.424 36.106 135.521 1.00 0.00 O ATOM 18166 H1 WAT 7122 93.216 35.402 136.136 1.00 0.00 H ATOM 18167 H2 WAT 7122 93.021 35.832 134.698 1.00 0.00 H TER 18169 WAT 7122 ATOM 18169 O WAT 7123 71.687 48.286 98.017 1.00 0.00 O ATOM 18170 H1 WAT 7123 72.409 47.770 97.658 1.00 0.00 H ATOM 18171 H2 WAT 7123 71.892 49.188 97.770 1.00 0.00 H TER 18173 WAT 7123 ATOM 18173 O WAT 7124 2.160 108.262 3.708 1.00 0.00 O ATOM 18174 H1 WAT 7124 3.031 107.911 3.525 1.00 0.00 H ATOM 18175 H2 WAT 7124 1.631 107.995 2.956 1.00 0.00 H TER 18177 WAT 7124 ATOM 18177 O WAT 7125 85.808 34.221 103.608 1.00 0.00 O ATOM 18178 H1 WAT 7125 86.393 33.524 103.310 1.00 0.00 H ATOM 18179 H2 WAT 7125 84.997 33.769 103.840 1.00 0.00 H TER 18181 WAT 7125 ATOM 18181 O WAT 7126 131.427 50.000 155.847 1.00 0.00 O ATOM 18182 H1 WAT 7126 132.139 50.040 156.485 1.00 0.00 H ATOM 18183 H2 WAT 7126 131.208 50.916 155.675 1.00 0.00 H TER 18185 WAT 7126 ATOM 18185 O WAT 7127 63.317 114.251 8.484 1.00 0.00 O ATOM 18186 H1 WAT 7127 62.714 114.984 8.358 1.00 0.00 H ATOM 18187 H2 WAT 7127 63.792 114.467 9.286 1.00 0.00 H TER 18189 WAT 7127 ATOM 18189 O WAT 7128 50.024 89.614 97.961 1.00 0.00 O ATOM 18190 H1 WAT 7128 50.673 89.358 97.306 1.00 0.00 H ATOM 18191 H2 WAT 7128 49.186 89.346 97.585 1.00 0.00 H TER 18193 WAT 7128 ATOM 18193 O WAT 7129 79.128 103.674 73.769 1.00 0.00 O ATOM 18194 H1 WAT 7129 79.845 103.218 74.210 1.00 0.00 H ATOM 18195 H2 WAT 7129 78.476 102.994 73.606 1.00 0.00 H TER 18197 WAT 7129 ATOM 18197 O WAT 7130 140.822 94.548 78.511 1.00 0.00 O ATOM 18198 H1 WAT 7130 140.231 95.010 79.106 1.00 0.00 H ATOM 18199 H2 WAT 7130 141.376 94.020 79.086 1.00 0.00 H TER 18201 WAT 7130 ATOM 18201 O WAT 7131 122.184 54.335 25.008 1.00 0.00 O ATOM 18202 H1 WAT 7131 121.639 55.094 24.801 1.00 0.00 H ATOM 18203 H2 WAT 7131 121.619 53.581 24.837 1.00 0.00 H TER 18205 WAT 7131 ATOM 18205 O WAT 7132 138.137 58.332 102.369 1.00 0.00 O ATOM 18206 H1 WAT 7132 138.166 59.044 103.007 1.00 0.00 H ATOM 18207 H2 WAT 7132 137.579 58.662 101.665 1.00 0.00 H TER 18209 WAT 7132 ATOM 18209 O WAT 7133 38.844 127.651 71.670 1.00 0.00 O ATOM 18210 H1 WAT 7133 39.467 127.951 71.009 1.00 0.00 H ATOM 18211 H2 WAT 7133 39.370 127.127 72.275 1.00 0.00 H TER 18213 WAT 7133 ATOM 18213 O WAT 7134 26.606 18.003 117.255 1.00 0.00 O ATOM 18214 H1 WAT 7134 27.198 17.341 117.612 1.00 0.00 H ATOM 18215 H2 WAT 7134 26.935 18.168 116.372 1.00 0.00 H TER 18217 WAT 7134 ATOM 18217 O WAT 7135 27.215 67.804 134.240 1.00 0.00 O ATOM 18218 H1 WAT 7135 27.665 67.494 133.454 1.00 0.00 H ATOM 18219 H2 WAT 7135 26.432 68.244 133.909 1.00 0.00 H TER 18221 WAT 7135 ATOM 18221 O WAT 7136 70.797 59.752 85.859 1.00 0.00 O ATOM 18222 H1 WAT 7136 71.421 59.635 85.142 1.00 0.00 H ATOM 18223 H2 WAT 7136 70.908 60.664 86.126 1.00 0.00 H TER 18225 WAT 7136 ATOM 18225 O WAT 7137 5.501 60.221 22.722 1.00 0.00 O ATOM 18226 H1 WAT 7137 5.272 60.969 23.275 1.00 0.00 H ATOM 18227 H2 WAT 7137 4.874 60.256 22.000 1.00 0.00 H TER 18229 WAT 7137 ATOM 18229 O WAT 7138 60.467 47.946 22.163 1.00 0.00 O ATOM 18230 H1 WAT 7138 59.547 47.731 22.318 1.00 0.00 H ATOM 18231 H2 WAT 7138 60.558 47.936 21.210 1.00 0.00 H TER 18233 WAT 7138 ATOM 18233 O WAT 7139 87.918 123.919 84.709 1.00 0.00 O ATOM 18234 H1 WAT 7139 87.067 123.983 85.142 1.00 0.00 H ATOM 18235 H2 WAT 7139 88.033 124.769 84.283 1.00 0.00 H TER 18237 WAT 7139 ATOM 18237 O WAT 7140 32.486 8.407 57.853 1.00 0.00 O ATOM 18238 H1 WAT 7140 32.090 9.160 57.414 1.00 0.00 H ATOM 18239 H2 WAT 7140 33.112 8.791 58.467 1.00 0.00 H TER 18241 WAT 7140 ATOM 18241 O WAT 7141 110.415 61.414 28.474 1.00 0.00 O ATOM 18242 H1 WAT 7141 109.690 60.855 28.755 1.00 0.00 H ATOM 18243 H2 WAT 7141 110.045 62.296 28.458 1.00 0.00 H TER 18245 WAT 7141 ATOM 18245 O WAT 7142 97.877 79.502 139.590 1.00 0.00 O ATOM 18246 H1 WAT 7142 98.173 80.293 139.140 1.00 0.00 H ATOM 18247 H2 WAT 7142 96.955 79.669 139.787 1.00 0.00 H TER 18249 WAT 7142 ATOM 18249 O WAT 7143 61.626 137.153 138.652 1.00 0.00 O ATOM 18250 H1 WAT 7143 62.161 137.921 138.452 1.00 0.00 H ATOM 18251 H2 WAT 7143 61.025 137.451 139.336 1.00 0.00 H TER 18253 WAT 7143 ATOM 18253 O WAT 7144 102.675 13.139 122.144 1.00 0.00 O ATOM 18254 H1 WAT 7144 102.016 13.829 122.073 1.00 0.00 H ATOM 18255 H2 WAT 7144 102.658 12.885 123.067 1.00 0.00 H TER 18257 WAT 7144 ATOM 18257 O WAT 7145 31.533 89.958 141.240 1.00 0.00 O ATOM 18258 H1 WAT 7145 30.614 89.763 141.424 1.00 0.00 H ATOM 18259 H2 WAT 7145 31.883 90.270 142.075 1.00 0.00 H TER 18261 WAT 7145 ATOM 18261 O WAT 7146 123.553 81.525 9.703 1.00 0.00 O ATOM 18262 H1 WAT 7146 123.517 81.090 10.555 1.00 0.00 H ATOM 18263 H2 WAT 7146 123.327 82.436 9.891 1.00 0.00 H TER 18265 WAT 7146 ATOM 18265 O WAT 7147 50.970 106.019 56.566 1.00 0.00 O ATOM 18266 H1 WAT 7147 51.552 105.345 56.915 1.00 0.00 H ATOM 18267 H2 WAT 7147 50.389 105.548 55.969 1.00 0.00 H TER 18269 WAT 7147 ATOM 18269 O WAT 7148 0.549 78.618 146.827 1.00 0.00 O ATOM 18270 H1 WAT 7148 0.932 79.441 147.131 1.00 0.00 H ATOM 18271 H2 WAT 7148 1.181 78.280 146.192 1.00 0.00 H TER 18273 WAT 7148 ATOM 18273 O WAT 7149 74.795 61.659 134.377 1.00 0.00 O ATOM 18274 H1 WAT 7149 74.985 61.005 135.051 1.00 0.00 H ATOM 18275 H2 WAT 7149 75.642 62.065 134.193 1.00 0.00 H TER 18277 WAT 7149 ATOM 18277 O WAT 7150 138.178 24.160 13.053 1.00 0.00 O ATOM 18278 H1 WAT 7150 138.958 24.617 12.738 1.00 0.00 H ATOM 18279 H2 WAT 7150 137.479 24.810 12.993 1.00 0.00 H TER 18281 WAT 7150 ATOM 18281 O WAT 7151 12.028 41.833 136.006 1.00 0.00 O ATOM 18282 H1 WAT 7151 12.403 41.234 136.652 1.00 0.00 H ATOM 18283 H2 WAT 7151 11.147 42.017 136.334 1.00 0.00 H TER 18285 WAT 7151 ATOM 18285 O WAT 7152 100.019 6.330 138.888 1.00 0.00 O ATOM 18286 H1 WAT 7152 100.830 6.827 138.781 1.00 0.00 H ATOM 18287 H2 WAT 7152 99.904 6.261 139.835 1.00 0.00 H TER 18289 WAT 7152 ATOM 18289 O WAT 7153 85.300 131.373 130.695 1.00 0.00 O ATOM 18290 H1 WAT 7153 85.979 130.847 131.117 1.00 0.00 H ATOM 18291 H2 WAT 7153 85.479 132.269 130.980 1.00 0.00 H TER 18293 WAT 7153 ATOM 18293 O WAT 7154 51.580 133.548 114.045 1.00 0.00 O ATOM 18294 H1 WAT 7154 51.022 133.403 113.281 1.00 0.00 H ATOM 18295 H2 WAT 7154 52.380 133.058 113.854 1.00 0.00 H TER 18297 WAT 7154 ATOM 18297 O WAT 7155 89.448 47.822 148.144 1.00 0.00 O ATOM 18298 H1 WAT 7155 90.302 47.951 148.556 1.00 0.00 H ATOM 18299 H2 WAT 7155 89.285 48.637 147.669 1.00 0.00 H TER 18301 WAT 7155 ATOM 18301 O WAT 7156 32.253 73.242 69.018 1.00 0.00 O ATOM 18302 H1 WAT 7156 32.986 73.132 68.411 1.00 0.00 H ATOM 18303 H2 WAT 7156 31.934 74.128 68.850 1.00 0.00 H TER 18305 WAT 7156 ATOM 18305 O WAT 7157 23.292 109.001 20.947 1.00 0.00 O ATOM 18306 H1 WAT 7157 22.354 108.837 20.842 1.00 0.00 H ATOM 18307 H2 WAT 7157 23.346 109.922 21.202 1.00 0.00 H TER 18309 WAT 7157 ATOM 18309 O WAT 7158 133.449 15.430 131.100 1.00 0.00 O ATOM 18310 H1 WAT 7158 134.176 15.743 131.637 1.00 0.00 H ATOM 18311 H2 WAT 7158 132.781 16.111 131.181 1.00 0.00 H TER 18313 WAT 7158 ATOM 18313 O WAT 7159 62.094 105.966 94.888 1.00 0.00 O ATOM 18314 H1 WAT 7159 61.391 106.612 94.965 1.00 0.00 H ATOM 18315 H2 WAT 7159 61.854 105.441 94.125 1.00 0.00 H TER 18317 WAT 7159 ATOM 18317 O WAT 7160 139.460 39.904 57.644 1.00 0.00 O ATOM 18318 H1 WAT 7160 138.525 39.767 57.490 1.00 0.00 H ATOM 18319 H2 WAT 7160 139.508 40.242 58.538 1.00 0.00 H TER 18321 WAT 7160 ATOM 18321 O WAT 7161 0.182 106.754 151.855 1.00 0.00 O ATOM 18322 H1 WAT 7161 -0.314 106.248 151.211 1.00 0.00 H ATOM 18323 H2 WAT 7161 0.181 107.647 151.509 1.00 0.00 H TER 18325 WAT 7161 ATOM 18325 O WAT 7162 31.205 129.912 152.144 1.00 0.00 O ATOM 18326 H1 WAT 7162 30.802 130.641 151.672 1.00 0.00 H ATOM 18327 H2 WAT 7162 31.376 129.255 151.469 1.00 0.00 H TER 18329 WAT 7162 ATOM 18329 O WAT 7163 138.458 21.465 18.413 1.00 0.00 O ATOM 18330 H1 WAT 7163 138.831 20.592 18.293 1.00 0.00 H ATOM 18331 H2 WAT 7163 137.807 21.353 19.107 1.00 0.00 H TER 18333 WAT 7163 ATOM 18333 O WAT 7164 81.554 132.332 143.456 1.00 0.00 O ATOM 18334 H1 WAT 7164 80.928 131.642 143.238 1.00 0.00 H ATOM 18335 H2 WAT 7164 81.907 132.610 142.611 1.00 0.00 H TER 18337 WAT 7164 ATOM 18337 O WAT 7165 30.188 24.351 69.977 1.00 0.00 O ATOM 18338 H1 WAT 7165 29.868 24.121 69.104 1.00 0.00 H ATOM 18339 H2 WAT 7165 30.198 23.522 70.455 1.00 0.00 H TER 18341 WAT 7165 ATOM 18341 O WAT 7166 18.322 41.150 63.774 1.00 0.00 O ATOM 18342 H1 WAT 7166 18.285 40.630 62.971 1.00 0.00 H ATOM 18343 H2 WAT 7166 19.250 41.364 63.878 1.00 0.00 H TER 18345 WAT 7166 ATOM 18345 O WAT 7167 52.475 43.481 125.308 1.00 0.00 O ATOM 18346 H1 WAT 7167 52.556 44.319 124.853 1.00 0.00 H ATOM 18347 H2 WAT 7167 52.972 42.866 124.768 1.00 0.00 H TER 18349 WAT 7167 ATOM 18349 O WAT 7168 18.036 40.688 104.405 1.00 0.00 O ATOM 18350 H1 WAT 7168 18.336 41.431 104.928 1.00 0.00 H ATOM 18351 H2 WAT 7168 17.400 40.242 104.964 1.00 0.00 H TER 18353 WAT 7168 ATOM 18353 O WAT 7169 24.306 9.735 79.086 1.00 0.00 O ATOM 18354 H1 WAT 7169 24.620 9.053 78.492 1.00 0.00 H ATOM 18355 H2 WAT 7169 24.359 9.338 79.956 1.00 0.00 H TER 18357 WAT 7169 ATOM 18357 O WAT 7170 19.708 99.717 96.659 1.00 0.00 O ATOM 18358 H1 WAT 7170 20.502 99.536 97.161 1.00 0.00 H ATOM 18359 H2 WAT 7170 19.766 100.648 96.446 1.00 0.00 H TER 18361 WAT 7170 ATOM 18361 O WAT 7171 1.360 -0.154 72.718 1.00 0.00 O ATOM 18362 H1 WAT 7171 2.144 0.213 73.128 1.00 0.00 H ATOM 18363 H2 WAT 7171 1.303 0.290 71.872 1.00 0.00 H TER 18365 WAT 7171 ATOM 18365 O WAT 7172 70.014 74.743 154.652 1.00 0.00 O ATOM 18366 H1 WAT 7172 70.593 75.495 154.782 1.00 0.00 H ATOM 18367 H2 WAT 7172 70.602 73.988 154.634 1.00 0.00 H TER 18369 WAT 7172 ATOM 18369 O WAT 7173 124.818 13.988 70.649 1.00 0.00 O ATOM 18370 H1 WAT 7173 124.348 13.181 70.857 1.00 0.00 H ATOM 18371 H2 WAT 7173 124.284 14.682 71.036 1.00 0.00 H TER 18373 WAT 7173 ATOM 18373 O WAT 7174 57.530 63.043 150.477 1.00 0.00 O ATOM 18374 H1 WAT 7174 56.969 62.496 149.927 1.00 0.00 H ATOM 18375 H2 WAT 7174 57.941 63.655 149.866 1.00 0.00 H TER 18377 WAT 7174 ATOM 18377 O WAT 7175 121.178 64.626 90.518 1.00 0.00 O ATOM 18378 H1 WAT 7175 121.969 64.633 89.979 1.00 0.00 H ATOM 18379 H2 WAT 7175 121.015 65.548 90.717 1.00 0.00 H TER 18381 WAT 7175 ATOM 18381 O WAT 7176 20.593 15.721 16.085 1.00 0.00 O ATOM 18382 H1 WAT 7176 21.185 16.318 15.627 1.00 0.00 H ATOM 18383 H2 WAT 7176 21.162 15.025 16.413 1.00 0.00 H TER 18385 WAT 7176 ATOM 18385 O WAT 7177 128.836 89.640 10.770 1.00 0.00 O ATOM 18386 H1 WAT 7177 128.764 90.344 11.414 1.00 0.00 H ATOM 18387 H2 WAT 7177 129.165 90.070 9.980 1.00 0.00 H TER 18389 WAT 7177 ATOM 18389 O WAT 7178 139.770 42.131 13.580 1.00 0.00 O ATOM 18390 H1 WAT 7178 139.655 41.768 12.701 1.00 0.00 H ATOM 18391 H2 WAT 7178 138.956 41.918 14.035 1.00 0.00 H TER 18393 WAT 7178 ATOM 18393 O WAT 7179 31.891 128.454 15.209 1.00 0.00 O ATOM 18394 H1 WAT 7179 32.515 129.171 15.319 1.00 0.00 H ATOM 18395 H2 WAT 7179 32.429 127.706 14.948 1.00 0.00 H TER 18397 WAT 7179 ATOM 18397 O WAT 7180 140.881 108.599 154.298 1.00 0.00 O ATOM 18398 H1 WAT 7180 140.348 109.137 153.713 1.00 0.00 H ATOM 18399 H2 WAT 7180 141.782 108.767 154.022 1.00 0.00 H TER 18401 WAT 7180 ATOM 18401 O WAT 7181 85.606 110.662 18.979 1.00 0.00 O ATOM 18402 H1 WAT 7181 84.750 111.081 19.074 1.00 0.00 H ATOM 18403 H2 WAT 7181 85.666 110.068 19.727 1.00 0.00 H TER 18405 WAT 7181 ATOM 18405 O WAT 7182 110.393 107.089 126.840 1.00 0.00 O ATOM 18406 H1 WAT 7182 110.695 107.877 127.291 1.00 0.00 H ATOM 18407 H2 WAT 7182 109.603 107.367 126.375 1.00 0.00 H TER 18409 WAT 7182 ATOM 18409 O WAT 7183 75.200 108.432 116.145 1.00 0.00 O ATOM 18410 H1 WAT 7183 75.044 108.932 116.946 1.00 0.00 H ATOM 18411 H2 WAT 7183 75.413 109.093 115.487 1.00 0.00 H TER 18413 WAT 7183 ATOM 18413 O WAT 7184 32.950 27.381 155.651 1.00 0.00 O ATOM 18414 H1 WAT 7184 32.568 28.235 155.853 1.00 0.00 H ATOM 18415 H2 WAT 7184 32.764 26.846 156.423 1.00 0.00 H TER 18417 WAT 7184 ATOM 18417 O WAT 7185 124.483 103.549 110.132 1.00 0.00 O ATOM 18418 H1 WAT 7185 123.827 102.916 110.425 1.00 0.00 H ATOM 18419 H2 WAT 7185 125.272 103.027 109.990 1.00 0.00 H TER 18421 WAT 7185 ATOM 18421 O WAT 7186 95.602 13.135 113.544 1.00 0.00 O ATOM 18422 H1 WAT 7186 95.996 13.339 112.696 1.00 0.00 H ATOM 18423 H2 WAT 7186 95.705 13.939 114.054 1.00 0.00 H TER 18425 WAT 7186 ATOM 18425 O WAT 7187 62.195 0.243 119.350 1.00 0.00 O ATOM 18426 H1 WAT 7187 62.374 -0.621 119.721 1.00 0.00 H ATOM 18427 H2 WAT 7187 61.409 0.542 119.808 1.00 0.00 H TER 18429 WAT 7187 ATOM 18429 O WAT 7188 39.867 11.342 0.829 1.00 0.00 O ATOM 18430 H1 WAT 7188 38.962 11.096 0.637 1.00 0.00 H ATOM 18431 H2 WAT 7188 40.391 10.629 0.465 1.00 0.00 H TER 18433 WAT 7188 ATOM 18433 O WAT 7189 66.086 132.040 14.341 1.00 0.00 O ATOM 18434 H1 WAT 7189 66.786 131.393 14.425 1.00 0.00 H ATOM 18435 H2 WAT 7189 65.460 131.640 13.737 1.00 0.00 H TER 18437 WAT 7189 ATOM 18437 O WAT 7190 114.603 94.878 116.336 1.00 0.00 O ATOM 18438 H1 WAT 7190 114.820 94.465 117.172 1.00 0.00 H ATOM 18439 H2 WAT 7190 114.045 94.241 115.891 1.00 0.00 H TER 18441 WAT 7190 ATOM 18441 O WAT 7191 126.298 34.551 17.115 1.00 0.00 O ATOM 18442 H1 WAT 7191 125.900 33.683 17.181 1.00 0.00 H ATOM 18443 H2 WAT 7191 125.827 34.977 16.398 1.00 0.00 H TER 18445 WAT 7191 ATOM 18445 O WAT 7192 101.546 132.826 76.087 1.00 0.00 O ATOM 18446 H1 WAT 7192 100.891 132.326 76.574 1.00 0.00 H ATOM 18447 H2 WAT 7192 101.036 133.451 75.572 1.00 0.00 H TER 18449 WAT 7192 ATOM 18449 O WAT 7193 37.699 138.527 95.522 1.00 0.00 O ATOM 18450 H1 WAT 7193 37.207 137.811 95.121 1.00 0.00 H ATOM 18451 H2 WAT 7193 37.866 138.232 96.417 1.00 0.00 H TER 18453 WAT 7193 ATOM 18453 O WAT 7194 62.893 61.330 79.503 1.00 0.00 O ATOM 18454 H1 WAT 7194 62.587 62.225 79.356 1.00 0.00 H ATOM 18455 H2 WAT 7194 63.472 61.151 78.762 1.00 0.00 H TER 18457 WAT 7194 ATOM 18457 O WAT 7195 90.077 73.660 60.600 1.00 0.00 O ATOM 18458 H1 WAT 7195 89.632 73.935 61.402 1.00 0.00 H ATOM 18459 H2 WAT 7195 90.554 72.868 60.850 1.00 0.00 H TER 18461 WAT 7195 ATOM 18461 O WAT 7196 48.103 30.058 0.304 1.00 0.00 O ATOM 18462 H1 WAT 7196 47.542 29.284 0.244 1.00 0.00 H ATOM 18463 H2 WAT 7196 48.893 29.748 0.746 1.00 0.00 H TER 18465 WAT 7196 ATOM 18465 O WAT 7197 36.822 11.486 119.616 1.00 0.00 O ATOM 18466 H1 WAT 7197 37.701 11.122 119.717 1.00 0.00 H ATOM 18467 H2 WAT 7197 36.838 11.920 118.763 1.00 0.00 H TER 18469 WAT 7197 ATOM 18469 O WAT 7198 112.735 89.567 114.838 1.00 0.00 O ATOM 18470 H1 WAT 7198 112.643 89.026 115.622 1.00 0.00 H ATOM 18471 H2 WAT 7198 113.248 89.030 114.235 1.00 0.00 H TER 18473 WAT 7198 ATOM 18473 O WAT 7199 29.184 95.393 19.640 1.00 0.00 O ATOM 18474 H1 WAT 7199 29.648 96.229 19.604 1.00 0.00 H ATOM 18475 H2 WAT 7199 29.605 94.856 18.968 1.00 0.00 H TER 18477 WAT 7199 ATOM 18477 O WAT 7200 33.986 131.956 99.922 1.00 0.00 O ATOM 18478 H1 WAT 7200 34.688 132.183 100.531 1.00 0.00 H ATOM 18479 H2 WAT 7200 33.222 132.432 100.249 1.00 0.00 H TER 18481 WAT 7200 ATOM 18481 O WAT 7201 59.998 86.425 139.518 1.00 0.00 O ATOM 18482 H1 WAT 7201 60.686 86.549 140.172 1.00 0.00 H ATOM 18483 H2 WAT 7201 60.258 86.988 138.789 1.00 0.00 H TER 18485 WAT 7201 ATOM 18485 O WAT 7202 116.177 138.257 127.321 1.00 0.00 O ATOM 18486 H1 WAT 7202 115.475 137.778 127.761 1.00 0.00 H ATOM 18487 H2 WAT 7202 115.939 138.233 126.394 1.00 0.00 H TER 18489 WAT 7202 ATOM 18489 O WAT 7203 57.837 90.874 156.022 1.00 0.00 O ATOM 18490 H1 WAT 7203 57.023 91.348 156.188 1.00 0.00 H ATOM 18491 H2 WAT 7203 58.099 91.150 155.143 1.00 0.00 H TER 18493 WAT 7203 ATOM 18493 O WAT 7204 40.169 107.017 73.317 1.00 0.00 O ATOM 18494 H1 WAT 7204 40.310 107.964 73.326 1.00 0.00 H ATOM 18495 H2 WAT 7204 40.919 106.668 72.837 1.00 0.00 H TER 18497 WAT 7204 ATOM 18497 O WAT 7205 29.740 51.434 66.915 1.00 0.00 O ATOM 18498 H1 WAT 7205 30.394 50.774 66.684 1.00 0.00 H ATOM 18499 H2 WAT 7205 30.204 52.267 66.839 1.00 0.00 H TER 18501 WAT 7205 ATOM 18501 O WAT 7206 133.724 123.130 93.718 1.00 0.00 O ATOM 18502 H1 WAT 7206 134.382 122.540 94.087 1.00 0.00 H ATOM 18503 H2 WAT 7206 133.180 123.379 94.465 1.00 0.00 H TER 18505 WAT 7206 ATOM 18505 O WAT 7207 145.164 25.360 15.542 1.00 0.00 O ATOM 18506 H1 WAT 7207 145.149 24.798 16.317 1.00 0.00 H ATOM 18507 H2 WAT 7207 145.752 26.077 15.778 1.00 0.00 H TER 18509 WAT 7207 ATOM 18509 O WAT 7208 111.410 129.492 14.266 1.00 0.00 O ATOM 18510 H1 WAT 7208 111.734 128.593 14.327 1.00 0.00 H ATOM 18511 H2 WAT 7208 110.512 129.446 14.594 1.00 0.00 H TER 18513 WAT 7208 ATOM 18513 O WAT 7209 46.624 124.550 52.618 1.00 0.00 O ATOM 18514 H1 WAT 7209 46.502 125.402 52.199 1.00 0.00 H ATOM 18515 H2 WAT 7209 47.097 124.746 53.427 1.00 0.00 H TER 18517 WAT 7209 ATOM 18517 O WAT 7210 80.451 86.402 70.288 1.00 0.00 O ATOM 18518 H1 WAT 7210 79.563 86.177 70.011 1.00 0.00 H ATOM 18519 H2 WAT 7210 80.502 87.352 70.180 1.00 0.00 H TER 18521 WAT 7210 ATOM 18521 O WAT 7211 38.825 111.190 121.176 1.00 0.00 O ATOM 18522 H1 WAT 7211 38.359 111.385 120.363 1.00 0.00 H ATOM 18523 H2 WAT 7211 38.178 110.742 121.721 1.00 0.00 H TER 18525 WAT 7211 ATOM 18525 O WAT 7212 31.777 128.242 60.578 1.00 0.00 O ATOM 18526 H1 WAT 7212 31.687 128.889 59.879 1.00 0.00 H ATOM 18527 H2 WAT 7212 30.939 127.780 60.587 1.00 0.00 H TER 18529 WAT 7212 ATOM 18529 O WAT 7213 144.522 20.556 129.995 1.00 0.00 O ATOM 18530 H1 WAT 7213 143.677 20.295 130.359 1.00 0.00 H ATOM 18531 H2 WAT 7213 144.317 20.867 129.113 1.00 0.00 H TER 18533 WAT 7213 ATOM 18533 O WAT 7214 4.415 33.779 91.958 1.00 0.00 O ATOM 18534 H1 WAT 7214 5.205 33.892 92.487 1.00 0.00 H ATOM 18535 H2 WAT 7214 4.665 34.082 91.085 1.00 0.00 H TER 18537 WAT 7214 ATOM 18537 O WAT 7215 77.665 69.494 116.654 1.00 0.00 O ATOM 18538 H1 WAT 7215 77.832 68.685 117.138 1.00 0.00 H ATOM 18539 H2 WAT 7215 78.421 70.049 116.848 1.00 0.00 H TER 18541 WAT 7215 ATOM 18541 O WAT 7216 35.048 100.394 0.732 1.00 0.00 O ATOM 18542 H1 WAT 7216 35.244 99.899 1.527 1.00 0.00 H ATOM 18543 H2 WAT 7216 35.595 101.176 0.796 1.00 0.00 H TER 18545 WAT 7216 ATOM 18545 O WAT 7217 53.896 60.698 154.217 1.00 0.00 O ATOM 18546 H1 WAT 7217 53.290 60.134 153.736 1.00 0.00 H ATOM 18547 H2 WAT 7217 53.851 61.539 153.763 1.00 0.00 H TER 18549 WAT 7217 ATOM 18549 O WAT 7218 106.448 54.948 111.361 1.00 0.00 O ATOM 18550 H1 WAT 7218 106.295 55.329 110.496 1.00 0.00 H ATOM 18551 H2 WAT 7218 106.235 55.651 111.974 1.00 0.00 H TER 18553 WAT 7218 ATOM 18553 O WAT 7219 110.168 51.757 3.581 1.00 0.00 O ATOM 18554 H1 WAT 7219 110.191 51.365 4.454 1.00 0.00 H ATOM 18555 H2 WAT 7219 109.602 52.523 3.677 1.00 0.00 H TER 18557 WAT 7219 ATOM 18557 O WAT 7220 32.387 116.878 12.023 1.00 0.00 O ATOM 18558 H1 WAT 7220 33.121 116.407 11.627 1.00 0.00 H ATOM 18559 H2 WAT 7220 32.790 117.635 12.447 1.00 0.00 H TER 18561 WAT 7220 ATOM 18561 O WAT 7221 143.953 2.943 110.446 1.00 0.00 O ATOM 18562 H1 WAT 7221 143.629 2.880 109.547 1.00 0.00 H ATOM 18563 H2 WAT 7221 143.235 2.609 110.983 1.00 0.00 H TER 18565 WAT 7221 ATOM 18565 O WAT 7222 87.639 144.844 138.350 1.00 0.00 O ATOM 18566 H1 WAT 7222 88.052 145.659 138.067 1.00 0.00 H ATOM 18567 H2 WAT 7222 88.349 144.201 138.346 1.00 0.00 H TER 18569 WAT 7222 ATOM 18569 O WAT 7223 59.548 143.203 63.447 1.00 0.00 O ATOM 18570 H1 WAT 7223 58.871 143.839 63.215 1.00 0.00 H ATOM 18571 H2 WAT 7223 59.876 142.885 62.606 1.00 0.00 H TER 18573 WAT 7223 ATOM 18573 O WAT 7224 73.149 66.495 115.965 1.00 0.00 O ATOM 18574 H1 WAT 7224 73.316 67.394 115.681 1.00 0.00 H ATOM 18575 H2 WAT 7224 72.202 66.460 116.104 1.00 0.00 H TER 18577 WAT 7224 ATOM 18577 O WAT 7225 51.080 85.660 70.628 1.00 0.00 O ATOM 18578 H1 WAT 7225 51.328 86.284 69.946 1.00 0.00 H ATOM 18579 H2 WAT 7225 51.582 84.870 70.425 1.00 0.00 H TER 18581 WAT 7225 ATOM 18581 O WAT 7226 144.723 135.902 2.683 1.00 0.00 O ATOM 18582 H1 WAT 7226 143.983 135.457 2.270 1.00 0.00 H ATOM 18583 H2 WAT 7226 145.066 136.479 2.001 1.00 0.00 H TER 18585 WAT 7226 ATOM 18585 O WAT 7227 71.075 0.856 75.769 1.00 0.00 O ATOM 18586 H1 WAT 7227 71.475 1.711 75.610 1.00 0.00 H ATOM 18587 H2 WAT 7227 70.516 0.991 76.534 1.00 0.00 H TER 18589 WAT 7227 ATOM 18589 O WAT 7228 134.782 25.491 63.818 1.00 0.00 O ATOM 18590 H1 WAT 7228 135.697 25.652 64.047 1.00 0.00 H ATOM 18591 H2 WAT 7228 134.414 26.362 63.673 1.00 0.00 H TER 18593 WAT 7228 ATOM 18593 O WAT 7229 47.038 66.360 141.493 1.00 0.00 O ATOM 18594 H1 WAT 7229 47.417 65.832 142.197 1.00 0.00 H ATOM 18595 H2 WAT 7229 47.776 66.550 140.913 1.00 0.00 H TER 18597 WAT 7229 ATOM 18597 O WAT 7230 113.574 69.152 2.353 1.00 0.00 O ATOM 18598 H1 WAT 7230 112.800 69.109 1.791 1.00 0.00 H ATOM 18599 H2 WAT 7230 114.303 69.284 1.747 1.00 0.00 H TER 18601 WAT 7230 ATOM 18601 O WAT 7231 111.210 63.890 113.657 1.00 0.00 O ATOM 18602 H1 WAT 7231 111.758 63.194 114.020 1.00 0.00 H ATOM 18603 H2 WAT 7231 110.554 63.430 113.133 1.00 0.00 H TER 18605 WAT 7231 ATOM 18605 O WAT 7232 127.030 44.052 146.528 1.00 0.00 O ATOM 18606 H1 WAT 7232 127.813 44.071 147.078 1.00 0.00 H ATOM 18607 H2 WAT 7232 126.933 43.132 146.282 1.00 0.00 H TER 18609 WAT 7232 ATOM 18609 O WAT 7233 92.972 124.309 131.608 1.00 0.00 O ATOM 18610 H1 WAT 7233 93.715 123.796 131.292 1.00 0.00 H ATOM 18611 H2 WAT 7233 93.342 125.168 131.809 1.00 0.00 H TER 18613 WAT 7233 ATOM 18613 O WAT 7234 49.522 64.197 148.830 1.00 0.00 O ATOM 18614 H1 WAT 7234 49.638 63.535 149.511 1.00 0.00 H ATOM 18615 H2 WAT 7234 49.509 63.701 148.012 1.00 0.00 H TER 18617 WAT 7234 ATOM 18617 O WAT 7235 14.866 130.708 128.592 1.00 0.00 O ATOM 18618 H1 WAT 7235 14.048 130.727 128.096 1.00 0.00 H ATOM 18619 H2 WAT 7235 14.865 129.854 129.024 1.00 0.00 H TER 18621 WAT 7235 ATOM 18621 O WAT 7236 67.132 134.410 19.395 1.00 0.00 O ATOM 18622 H1 WAT 7236 66.211 134.229 19.581 1.00 0.00 H ATOM 18623 H2 WAT 7236 67.173 134.485 18.441 1.00 0.00 H TER 18625 WAT 7236 ATOM 18625 O WAT 7237 29.576 62.474 128.956 1.00 0.00 O ATOM 18626 H1 WAT 7237 29.331 63.059 129.673 1.00 0.00 H ATOM 18627 H2 WAT 7237 29.779 63.060 128.227 1.00 0.00 H TER 18629 WAT 7237 ATOM 18629 O WAT 7238 37.950 5.306 75.634 1.00 0.00 O ATOM 18630 H1 WAT 7238 38.716 5.864 75.761 1.00 0.00 H ATOM 18631 H2 WAT 7238 37.812 5.301 74.686 1.00 0.00 H TER 18633 WAT 7238 ATOM 18633 O WAT 7239 10.769 50.268 70.173 1.00 0.00 O ATOM 18634 H1 WAT 7239 10.423 50.320 71.064 1.00 0.00 H ATOM 18635 H2 WAT 7239 10.574 51.124 69.790 1.00 0.00 H TER 18637 WAT 7239 ATOM 18637 O WAT 7240 43.569 126.872 23.251 1.00 0.00 O ATOM 18638 H1 WAT 7240 43.977 127.463 22.618 1.00 0.00 H ATOM 18639 H2 WAT 7240 42.631 126.947 23.079 1.00 0.00 H TER 18641 WAT 7240 ATOM 18641 O WAT 7241 27.472 82.830 132.384 1.00 0.00 O ATOM 18642 H1 WAT 7241 28.026 82.051 132.435 1.00 0.00 H ATOM 18643 H2 WAT 7241 27.239 83.018 133.293 1.00 0.00 H TER 18645 WAT 7241 ATOM 18645 O WAT 7242 51.008 65.230 101.788 1.00 0.00 O ATOM 18646 H1 WAT 7242 51.854 65.188 102.234 1.00 0.00 H ATOM 18647 H2 WAT 7242 50.735 64.317 101.706 1.00 0.00 H TER 18649 WAT 7242 ATOM 18649 O WAT 7243 65.586 8.160 98.657 1.00 0.00 O ATOM 18650 H1 WAT 7243 65.642 8.729 99.425 1.00 0.00 H ATOM 18651 H2 WAT 7243 64.676 7.864 98.643 1.00 0.00 H TER 18653 WAT 7243 ATOM 18653 O WAT 7244 53.124 67.500 83.027 1.00 0.00 O ATOM 18654 H1 WAT 7244 54.042 67.635 83.261 1.00 0.00 H ATOM 18655 H2 WAT 7244 53.036 66.551 82.942 1.00 0.00 H TER 18657 WAT 7244 ATOM 18657 O WAT 7245 75.177 74.498 93.897 1.00 0.00 O ATOM 18658 H1 WAT 7245 74.482 73.926 93.572 1.00 0.00 H ATOM 18659 H2 WAT 7245 74.730 75.316 94.116 1.00 0.00 H TER 18661 WAT 7245 ATOM 18661 O WAT 7246 131.697 123.156 133.225 1.00 0.00 O ATOM 18662 H1 WAT 7246 132.585 123.370 133.509 1.00 0.00 H ATOM 18663 H2 WAT 7246 131.192 123.104 134.037 1.00 0.00 H TER 18665 WAT 7246 ATOM 18665 O WAT 7247 139.710 100.934 25.928 1.00 0.00 O ATOM 18666 H1 WAT 7247 140.129 101.750 25.656 1.00 0.00 H ATOM 18667 H2 WAT 7247 138.781 101.153 25.998 1.00 0.00 H TER 18669 WAT 7247 ATOM 18669 O WAT 7248 12.232 29.930 82.422 1.00 0.00 O ATOM 18670 H1 WAT 7248 11.791 30.775 82.500 1.00 0.00 H ATOM 18671 H2 WAT 7248 11.851 29.395 83.119 1.00 0.00 H TER 18673 WAT 7248 ATOM 18673 O WAT 7249 80.861 101.578 90.718 1.00 0.00 O ATOM 18674 H1 WAT 7249 80.348 100.796 90.513 1.00 0.00 H ATOM 18675 H2 WAT 7249 81.772 101.296 90.637 1.00 0.00 H TER 18677 WAT 7249 ATOM 18677 O WAT 7250 89.851 130.074 68.135 1.00 0.00 O ATOM 18678 H1 WAT 7250 90.601 129.851 68.687 1.00 0.00 H ATOM 18679 H2 WAT 7250 89.875 129.430 67.426 1.00 0.00 H TER 18681 WAT 7250 ATOM 18681 O WAT 7251 70.173 136.795 86.574 1.00 0.00 O ATOM 18682 H1 WAT 7251 69.239 136.970 86.689 1.00 0.00 H ATOM 18683 H2 WAT 7251 70.570 137.053 87.406 1.00 0.00 H TER 18685 WAT 7251 ATOM 18685 O WAT 7252 74.197 90.536 130.230 1.00 0.00 O ATOM 18686 H1 WAT 7252 73.337 90.627 130.642 1.00 0.00 H ATOM 18687 H2 WAT 7252 74.211 91.215 129.556 1.00 0.00 H TER 18689 WAT 7252 ATOM 18689 O WAT 7253 99.779 141.378 151.338 1.00 0.00 O ATOM 18690 H1 WAT 7253 98.911 141.226 150.965 1.00 0.00 H ATOM 18691 H2 WAT 7253 100.332 140.705 150.941 1.00 0.00 H TER 18693 WAT 7253 ATOM 18693 O WAT 7254 82.690 114.200 98.641 1.00 0.00 O ATOM 18694 H1 WAT 7254 81.874 113.700 98.653 1.00 0.00 H ATOM 18695 H2 WAT 7254 83.192 113.856 99.381 1.00 0.00 H TER 18697 WAT 7254 ATOM 18697 O WAT 7255 12.669 131.059 140.841 1.00 0.00 O ATOM 18698 H1 WAT 7255 11.884 130.544 140.655 1.00 0.00 H ATOM 18699 H2 WAT 7255 12.745 131.045 141.795 1.00 0.00 H TER 18701 WAT 7255 ATOM 18701 O WAT 7256 89.046 102.700 5.129 1.00 0.00 O ATOM 18702 H1 WAT 7256 89.696 102.251 4.587 1.00 0.00 H ATOM 18703 H2 WAT 7256 89.437 103.554 5.313 1.00 0.00 H TER 18705 WAT 7256 ATOM 18705 O WAT 7257 82.224 132.727 63.236 1.00 0.00 O ATOM 18706 H1 WAT 7257 81.766 133.565 63.171 1.00 0.00 H ATOM 18707 H2 WAT 7257 82.643 132.616 62.383 1.00 0.00 H TER 18709 WAT 7257 ATOM 18709 O WAT 7258 47.867 22.561 2.872 1.00 0.00 O ATOM 18710 H1 WAT 7258 48.583 22.926 2.352 1.00 0.00 H ATOM 18711 H2 WAT 7258 47.778 23.164 3.611 1.00 0.00 H TER 18713 WAT 7258 ATOM 18713 O WAT 7259 53.717 73.877 110.761 1.00 0.00 O ATOM 18714 H1 WAT 7259 52.761 73.844 110.795 1.00 0.00 H ATOM 18715 H2 WAT 7259 53.985 72.962 110.677 1.00 0.00 H TER 18717 WAT 7259 ATOM 18717 O WAT 7260 3.055 132.179 92.423 1.00 0.00 O ATOM 18718 H1 WAT 7260 3.292 132.697 93.193 1.00 0.00 H ATOM 18719 H2 WAT 7260 2.309 132.643 92.043 1.00 0.00 H TER 18721 WAT 7260 ATOM 18721 O WAT 7261 36.634 23.602 98.791 1.00 0.00 O ATOM 18722 H1 WAT 7261 36.505 24.058 99.623 1.00 0.00 H ATOM 18723 H2 WAT 7261 37.535 23.280 98.832 1.00 0.00 H TER 18725 WAT 7261 ATOM 18725 O WAT 7262 135.909 19.469 155.235 1.00 0.00 O ATOM 18726 H1 WAT 7262 136.746 19.437 154.772 1.00 0.00 H ATOM 18727 H2 WAT 7262 135.252 19.509 154.541 1.00 0.00 H TER 18729 WAT 7262 ATOM 18729 O WAT 7263 28.925 21.743 90.051 1.00 0.00 O ATOM 18730 H1 WAT 7263 29.342 21.977 89.221 1.00 0.00 H ATOM 18731 H2 WAT 7263 29.617 21.316 90.555 1.00 0.00 H TER 18733 WAT 7263 ATOM 18733 O WAT 7264 106.785 20.602 102.023 1.00 0.00 O ATOM 18734 H1 WAT 7264 107.068 20.913 101.163 1.00 0.00 H ATOM 18735 H2 WAT 7264 105.885 20.917 102.108 1.00 0.00 H TER 18737 WAT 7264 ATOM 18737 O WAT 7265 112.872 24.899 139.571 1.00 0.00 O ATOM 18738 H1 WAT 7265 112.141 25.388 139.949 1.00 0.00 H ATOM 18739 H2 WAT 7265 112.604 24.727 138.669 1.00 0.00 H TER 18741 WAT 7265 ATOM 18741 O WAT 7266 108.158 2.637 89.151 1.00 0.00 O ATOM 18742 H1 WAT 7266 108.906 2.411 88.599 1.00 0.00 H ATOM 18743 H2 WAT 7266 108.263 2.091 89.931 1.00 0.00 H TER 18745 WAT 7266 ATOM 18745 O WAT 7267 52.655 124.782 68.718 1.00 0.00 O ATOM 18746 H1 WAT 7267 53.550 125.048 68.511 1.00 0.00 H ATOM 18747 H2 WAT 7267 52.600 124.849 69.672 1.00 0.00 H TER 18749 WAT 7267 ATOM 18749 O WAT 7268 3.830 76.451 66.999 1.00 0.00 O ATOM 18750 H1 WAT 7268 3.344 75.859 66.426 1.00 0.00 H ATOM 18751 H2 WAT 7268 3.155 76.888 67.519 1.00 0.00 H TER 18753 WAT 7268 ATOM 18753 O WAT 7269 144.128 126.206 122.657 1.00 0.00 O ATOM 18754 H1 WAT 7269 144.664 125.903 123.389 1.00 0.00 H ATOM 18755 H2 WAT 7269 144.731 126.232 121.914 1.00 0.00 H TER 18757 WAT 7269 ATOM 18757 O WAT 7270 113.445 58.368 72.941 1.00 0.00 O ATOM 18758 H1 WAT 7270 114.378 58.541 73.065 1.00 0.00 H ATOM 18759 H2 WAT 7270 113.005 59.073 73.416 1.00 0.00 H TER 18761 WAT 7270 ATOM 18761 O WAT 7271 84.776 76.584 19.096 1.00 0.00 O ATOM 18762 H1 WAT 7271 85.501 76.827 19.671 1.00 0.00 H ATOM 18763 H2 WAT 7271 84.327 77.409 18.913 1.00 0.00 H TER 18765 WAT 7271 ATOM 18765 O WAT 7272 123.525 84.867 104.505 1.00 0.00 O ATOM 18766 H1 WAT 7272 123.241 85.315 105.302 1.00 0.00 H ATOM 18767 H2 WAT 7272 124.195 84.251 104.802 1.00 0.00 H TER 18769 WAT 7272 ATOM 18769 O WAT 7273 45.454 115.760 101.200 1.00 0.00 O ATOM 18770 H1 WAT 7273 45.284 115.472 102.097 1.00 0.00 H ATOM 18771 H2 WAT 7273 44.587 115.831 100.802 1.00 0.00 H TER 18773 WAT 7273 ATOM 18773 O WAT 7274 36.125 106.590 80.390 1.00 0.00 O ATOM 18774 H1 WAT 7274 35.781 107.147 79.691 1.00 0.00 H ATOM 18775 H2 WAT 7274 35.519 105.850 80.427 1.00 0.00 H TER 18777 WAT 7274 ATOM 18777 O WAT 7275 94.544 80.728 128.337 1.00 0.00 O ATOM 18778 H1 WAT 7275 95.501 80.713 128.327 1.00 0.00 H ATOM 18779 H2 WAT 7275 94.301 80.073 128.992 1.00 0.00 H TER 18781 WAT 7275 ATOM 18781 O WAT 7276 131.674 1.476 149.737 1.00 0.00 O ATOM 18782 H1 WAT 7276 131.681 2.424 149.866 1.00 0.00 H ATOM 18783 H2 WAT 7276 132.482 1.294 149.257 1.00 0.00 H TER 18785 WAT 7276 ATOM 18785 O WAT 7277 35.685 59.445 57.319 1.00 0.00 O ATOM 18786 H1 WAT 7277 36.051 60.327 57.255 1.00 0.00 H ATOM 18787 H2 WAT 7277 35.887 59.166 58.212 1.00 0.00 H TER 18789 WAT 7277 ATOM 18789 O WAT 7278 126.064 46.254 154.609 1.00 0.00 O ATOM 18790 H1 WAT 7278 126.975 46.324 154.321 1.00 0.00 H ATOM 18791 H2 WAT 7278 125.966 45.339 154.873 1.00 0.00 H TER 18793 WAT 7278 ATOM 18793 O WAT 7279 36.093 18.024 4.941 1.00 0.00 O ATOM 18794 H1 WAT 7279 36.802 17.675 4.400 1.00 0.00 H ATOM 18795 H2 WAT 7279 36.324 17.764 5.833 1.00 0.00 H TER 18797 WAT 7279 ATOM 18797 O WAT 7280 144.661 106.336 103.887 1.00 0.00 O ATOM 18798 H1 WAT 7280 143.712 106.331 103.762 1.00 0.00 H ATOM 18799 H2 WAT 7280 145.014 106.557 103.025 1.00 0.00 H TER 18801 WAT 7280 ATOM 18801 O WAT 7281 7.630 72.314 102.814 1.00 0.00 O ATOM 18802 H1 WAT 7281 7.861 71.714 103.523 1.00 0.00 H ATOM 18803 H2 WAT 7281 6.980 72.901 103.199 1.00 0.00 H TER 18805 WAT 7281 ATOM 18805 O WAT 7282 2.902 7.375 11.277 1.00 0.00 O ATOM 18806 H1 WAT 7282 2.740 8.227 11.682 1.00 0.00 H ATOM 18807 H2 WAT 7282 2.153 6.839 11.539 1.00 0.00 H TER 18809 WAT 7282 ATOM 18809 O WAT 7283 6.587 31.169 7.426 1.00 0.00 O ATOM 18810 H1 WAT 7283 6.686 30.316 7.003 1.00 0.00 H ATOM 18811 H2 WAT 7283 6.467 30.964 8.353 1.00 0.00 H TER 18813 WAT 7283 ATOM 18813 O WAT 7284 83.941 85.798 14.144 1.00 0.00 O ATOM 18814 H1 WAT 7284 84.070 86.731 14.318 1.00 0.00 H ATOM 18815 H2 WAT 7284 83.766 85.416 15.004 1.00 0.00 H TER 18817 WAT 7284 ATOM 18817 O WAT 7285 33.060 63.507 17.237 1.00 0.00 O ATOM 18818 H1 WAT 7285 33.121 64.404 17.564 1.00 0.00 H ATOM 18819 H2 WAT 7285 32.147 63.259 17.387 1.00 0.00 H TER 18821 WAT 7285 ATOM 18821 O WAT 7286 111.386 66.677 120.510 1.00 0.00 O ATOM 18822 H1 WAT 7286 111.121 66.584 119.595 1.00 0.00 H ATOM 18823 H2 WAT 7286 110.603 67.003 120.954 1.00 0.00 H TER 18825 WAT 7286 ATOM 18825 O WAT 7287 112.966 80.537 3.701 1.00 0.00 O ATOM 18826 H1 WAT 7287 112.312 80.021 3.231 1.00 0.00 H ATOM 18827 H2 WAT 7287 113.758 80.001 3.677 1.00 0.00 H TER 18829 WAT 7287 ATOM 18829 O WAT 7288 77.008 70.890 -0.212 1.00 0.00 O ATOM 18830 H1 WAT 7288 76.587 70.275 0.389 1.00 0.00 H ATOM 18831 H2 WAT 7288 77.077 71.703 0.288 1.00 0.00 H TER 18833 WAT 7288 ATOM 18833 O WAT 7289 27.078 144.446 130.358 1.00 0.00 O ATOM 18834 H1 WAT 7289 26.300 144.989 130.482 1.00 0.00 H ATOM 18835 H2 WAT 7289 27.623 144.629 131.123 1.00 0.00 H TER 18837 WAT 7289 ATOM 18837 O WAT 7290 11.002 133.412 21.649 1.00 0.00 O ATOM 18838 H1 WAT 7290 10.938 133.147 22.566 1.00 0.00 H ATOM 18839 H2 WAT 7290 11.136 134.359 21.681 1.00 0.00 H TER 18841 WAT 7290 ATOM 18841 O WAT 7291 138.947 9.852 83.487 1.00 0.00 O ATOM 18842 H1 WAT 7291 139.852 9.546 83.444 1.00 0.00 H ATOM 18843 H2 WAT 7291 138.533 9.285 84.138 1.00 0.00 H TER 18845 WAT 7291 ATOM 18845 O WAT 7292 31.485 65.243 130.782 1.00 0.00 O ATOM 18846 H1 WAT 7292 32.001 64.758 130.139 1.00 0.00 H ATOM 18847 H2 WAT 7292 30.920 65.811 130.258 1.00 0.00 H TER 18849 WAT 7292 ATOM 18849 O WAT 7293 9.512 125.205 105.982 1.00 0.00 O ATOM 18850 H1 WAT 7293 8.689 125.025 106.436 1.00 0.00 H ATOM 18851 H2 WAT 7293 10.021 125.722 106.607 1.00 0.00 H TER 18853 WAT 7293 ATOM 18853 O WAT 7294 102.952 136.324 73.995 1.00 0.00 O ATOM 18854 H1 WAT 7294 103.701 136.362 74.589 1.00 0.00 H ATOM 18855 H2 WAT 7294 102.577 137.205 74.026 1.00 0.00 H TER 18857 WAT 7294 ATOM 18857 O WAT 7295 41.919 31.474 74.994 1.00 0.00 O ATOM 18858 H1 WAT 7295 41.832 32.369 74.664 1.00 0.00 H ATOM 18859 H2 WAT 7295 41.853 30.924 74.213 1.00 0.00 H TER 18861 WAT 7295 ATOM 18861 O WAT 7296 4.433 52.962 79.840 1.00 0.00 O ATOM 18862 H1 WAT 7296 4.643 52.052 79.630 1.00 0.00 H ATOM 18863 H2 WAT 7296 5.200 53.280 80.316 1.00 0.00 H TER 18865 WAT 7296 ATOM 18865 O WAT 7297 14.064 87.699 6.424 1.00 0.00 O ATOM 18866 H1 WAT 7297 14.357 86.811 6.224 1.00 0.00 H ATOM 18867 H2 WAT 7297 14.835 88.129 6.794 1.00 0.00 H TER 18869 WAT 7297 ATOM 18869 O WAT 7298 87.061 82.451 125.785 1.00 0.00 O ATOM 18870 H1 WAT 7298 86.292 81.967 126.087 1.00 0.00 H ATOM 18871 H2 WAT 7298 87.094 82.284 124.843 1.00 0.00 H TER 18873 WAT 7298 ATOM 18873 O WAT 7299 49.198 43.390 132.526 1.00 0.00 O ATOM 18874 H1 WAT 7299 49.164 44.270 132.151 1.00 0.00 H ATOM 18875 H2 WAT 7299 48.684 42.853 131.922 1.00 0.00 H TER 18877 WAT 7299 ATOM 18877 O WAT 7300 58.198 125.926 69.143 1.00 0.00 O ATOM 18878 H1 WAT 7300 58.637 126.771 69.044 1.00 0.00 H ATOM 18879 H2 WAT 7300 57.899 125.916 70.052 1.00 0.00 H TER 18881 WAT 7300 ATOM 18881 O WAT 7301 19.090 103.746 145.086 1.00 0.00 O ATOM 18882 H1 WAT 7301 18.191 103.869 144.780 1.00 0.00 H ATOM 18883 H2 WAT 7301 19.136 104.245 145.902 1.00 0.00 H TER 18885 WAT 7301 ATOM 18885 O WAT 7302 106.968 123.272 142.514 1.00 0.00 O ATOM 18886 H1 WAT 7302 106.051 123.164 142.767 1.00 0.00 H ATOM 18887 H2 WAT 7302 107.348 123.804 143.213 1.00 0.00 H TER 18889 WAT 7302 ATOM 18889 O WAT 7303 28.530 24.409 3.326 1.00 0.00 O ATOM 18890 H1 WAT 7303 28.306 25.338 3.265 1.00 0.00 H ATOM 18891 H2 WAT 7303 27.884 24.047 3.933 1.00 0.00 H TER 18893 WAT 7303 ATOM 18893 O WAT 7304 69.035 1.549 100.274 1.00 0.00 O ATOM 18894 H1 WAT 7304 69.136 0.721 100.743 1.00 0.00 H ATOM 18895 H2 WAT 7304 69.706 1.523 99.593 1.00 0.00 H TER 18897 WAT 7304 ATOM 18897 O WAT 7305 143.389 26.797 120.894 1.00 0.00 O ATOM 18898 H1 WAT 7305 143.628 26.824 121.820 1.00 0.00 H ATOM 18899 H2 WAT 7305 142.678 26.157 120.848 1.00 0.00 H TER 18901 WAT 7305 ATOM 18901 O WAT 7306 19.762 8.553 149.549 1.00 0.00 O ATOM 18902 H1 WAT 7306 18.940 9.024 149.684 1.00 0.00 H ATOM 18903 H2 WAT 7306 20.428 9.240 149.514 1.00 0.00 H TER 18905 WAT 7306 ATOM 18905 O WAT 7307 49.086 96.947 12.504 1.00 0.00 O ATOM 18906 H1 WAT 7307 48.304 97.029 11.959 1.00 0.00 H ATOM 18907 H2 WAT 7307 48.755 96.667 13.358 1.00 0.00 H TER 18909 WAT 7307 ATOM 18909 O WAT 7308 121.613 112.436 4.617 1.00 0.00 O ATOM 18910 H1 WAT 7308 120.976 112.281 5.315 1.00 0.00 H ATOM 18911 H2 WAT 7308 122.150 113.159 4.939 1.00 0.00 H TER 18913 WAT 7308 ATOM 18913 O WAT 7309 107.845 85.286 0.181 1.00 0.00 O ATOM 18914 H1 WAT 7309 107.117 84.967 0.715 1.00 0.00 H ATOM 18915 H2 WAT 7309 107.574 85.113 -0.720 1.00 0.00 H TER 18917 WAT 7309 ATOM 18917 O WAT 7310 64.040 69.406 89.063 1.00 0.00 O ATOM 18918 H1 WAT 7310 63.248 69.943 89.052 1.00 0.00 H ATOM 18919 H2 WAT 7310 64.091 69.036 88.182 1.00 0.00 H TER 18921 WAT 7310 ATOM 18921 O WAT 7311 60.098 11.471 15.580 1.00 0.00 O ATOM 18922 H1 WAT 7311 60.813 10.835 15.609 1.00 0.00 H ATOM 18923 H2 WAT 7311 59.914 11.667 16.499 1.00 0.00 H TER 18925 WAT 7311 ATOM 18925 O WAT 7312 95.470 40.098 53.864 1.00 0.00 O ATOM 18926 H1 WAT 7312 94.533 40.106 54.059 1.00 0.00 H ATOM 18927 H2 WAT 7312 95.880 40.478 54.641 1.00 0.00 H TER 18929 WAT 7312 ATOM 18929 O WAT 7313 61.575 7.910 60.892 1.00 0.00 O ATOM 18930 H1 WAT 7313 61.160 7.303 61.505 1.00 0.00 H ATOM 18931 H2 WAT 7313 62.346 8.231 61.358 1.00 0.00 H TER 18933 WAT 7313 ATOM 18933 O WAT 7314 71.014 41.176 121.902 1.00 0.00 O ATOM 18934 H1 WAT 7314 71.393 41.543 121.104 1.00 0.00 H ATOM 18935 H2 WAT 7314 71.540 41.548 122.610 1.00 0.00 H TER 18937 WAT 7314 ATOM 18937 O WAT 7315 127.796 35.213 5.638 1.00 0.00 O ATOM 18938 H1 WAT 7315 127.504 35.785 4.928 1.00 0.00 H ATOM 18939 H2 WAT 7315 127.878 35.793 6.394 1.00 0.00 H TER 18941 WAT 7315 ATOM 18941 O WAT 7316 108.912 74.817 11.233 1.00 0.00 O ATOM 18942 H1 WAT 7316 108.995 73.874 11.096 1.00 0.00 H ATOM 18943 H2 WAT 7316 108.060 75.040 10.857 1.00 0.00 H TER 18945 WAT 7316 ATOM 18945 O WAT 7317 108.093 63.605 72.140 1.00 0.00 O ATOM 18946 H1 WAT 7317 107.887 62.853 72.696 1.00 0.00 H ATOM 18947 H2 WAT 7317 108.153 63.241 71.257 1.00 0.00 H TER 18949 WAT 7317 ATOM 18949 O WAT 7318 65.473 55.244 122.817 1.00 0.00 O ATOM 18950 H1 WAT 7318 65.388 55.273 121.864 1.00 0.00 H ATOM 18951 H2 WAT 7318 65.102 54.397 123.065 1.00 0.00 H TER 18953 WAT 7318 ATOM 18953 O WAT 7319 98.646 14.859 95.349 1.00 0.00 O ATOM 18954 H1 WAT 7319 98.029 15.582 95.466 1.00 0.00 H ATOM 18955 H2 WAT 7319 99.115 14.808 96.182 1.00 0.00 H TER 18957 WAT 7319 ATOM 18957 O WAT 7320 5.598 39.185 82.000 1.00 0.00 O ATOM 18958 H1 WAT 7320 6.294 39.593 81.484 1.00 0.00 H ATOM 18959 H2 WAT 7320 4.801 39.638 81.727 1.00 0.00 H TER 18961 WAT 7320 ATOM 18961 O WAT 7321 53.769 38.512 13.589 1.00 0.00 O ATOM 18962 H1 WAT 7321 53.976 38.087 12.756 1.00 0.00 H ATOM 18963 H2 WAT 7321 54.622 38.698 13.981 1.00 0.00 H TER 18965 WAT 7321 ATOM 18965 O WAT 7322 131.582 25.202 69.136 1.00 0.00 O ATOM 18966 H1 WAT 7322 131.710 25.929 69.745 1.00 0.00 H ATOM 18967 H2 WAT 7322 131.971 25.505 68.316 1.00 0.00 H TER 18969 WAT 7322 ATOM 18969 O WAT 7323 18.313 25.629 64.906 1.00 0.00 O ATOM 18970 H1 WAT 7323 18.109 25.731 63.976 1.00 0.00 H ATOM 18971 H2 WAT 7323 19.106 26.150 65.035 1.00 0.00 H TER 18973 WAT 7323 ATOM 18973 O WAT 7324 127.500 102.020 18.491 1.00 0.00 O ATOM 18974 H1 WAT 7324 127.166 102.902 18.331 1.00 0.00 H ATOM 18975 H2 WAT 7324 127.870 102.060 19.372 1.00 0.00 H TER 18977 WAT 7324 ATOM 18977 O WAT 7325 27.610 70.046 18.956 1.00 0.00 O ATOM 18978 H1 WAT 7325 27.467 70.597 19.725 1.00 0.00 H ATOM 18979 H2 WAT 7325 27.101 70.465 18.263 1.00 0.00 H TER 18981 WAT 7325 ATOM 18981 O WAT 7326 59.233 35.029 95.922 1.00 0.00 O ATOM 18982 H1 WAT 7326 59.291 34.074 95.891 1.00 0.00 H ATOM 18983 H2 WAT 7326 59.887 35.329 95.290 1.00 0.00 H TER 18985 WAT 7326 ATOM 18985 O WAT 7327 51.931 4.378 71.868 1.00 0.00 O ATOM 18986 H1 WAT 7327 52.612 4.257 72.530 1.00 0.00 H ATOM 18987 H2 WAT 7327 51.551 3.507 71.752 1.00 0.00 H TER 18989 WAT 7327 ATOM 18989 O WAT 7328 95.018 144.028 67.440 1.00 0.00 O ATOM 18990 H1 WAT 7328 95.702 143.390 67.236 1.00 0.00 H ATOM 18991 H2 WAT 7328 94.521 144.115 66.626 1.00 0.00 H TER 18993 WAT 7328 ATOM 18993 O WAT 7329 31.134 18.063 121.527 1.00 0.00 O ATOM 18994 H1 WAT 7329 30.508 17.608 122.090 1.00 0.00 H ATOM 18995 H2 WAT 7329 30.761 18.938 121.411 1.00 0.00 H TER 18997 WAT 7329 ATOM 18997 O WAT 7330 77.924 118.287 141.919 1.00 0.00 O ATOM 18998 H1 WAT 7330 78.578 118.940 141.672 1.00 0.00 H ATOM 18999 H2 WAT 7330 78.436 117.522 142.180 1.00 0.00 H TER 19001 WAT 7330 ATOM 19001 O WAT 7331 84.946 98.347 26.274 1.00 0.00 O ATOM 19002 H1 WAT 7331 85.621 97.701 26.482 1.00 0.00 H ATOM 19003 H2 WAT 7331 84.174 97.826 26.058 1.00 0.00 H TER 19005 WAT 7331 ATOM 19005 O WAT 7332 69.159 97.172 29.660 1.00 0.00 O ATOM 19006 H1 WAT 7332 69.513 98.030 29.425 1.00 0.00 H ATOM 19007 H2 WAT 7332 69.801 96.807 30.269 1.00 0.00 H TER 19009 WAT 7332 ATOM 19009 O WAT 7333 82.485 39.377 128.103 1.00 0.00 O ATOM 19010 H1 WAT 7333 83.178 39.487 128.754 1.00 0.00 H ATOM 19011 H2 WAT 7333 82.840 39.771 127.306 1.00 0.00 H TER 19013 WAT 7333 ATOM 19013 O WAT 7334 41.926 114.598 153.975 1.00 0.00 O ATOM 19014 H1 WAT 7334 41.517 114.951 154.766 1.00 0.00 H ATOM 19015 H2 WAT 7334 42.179 115.371 153.471 1.00 0.00 H TER 19017 WAT 7334 ATOM 19017 O WAT 7335 137.161 111.281 104.577 1.00 0.00 O ATOM 19018 H1 WAT 7335 137.447 112.125 104.927 1.00 0.00 H ATOM 19019 H2 WAT 7335 136.562 111.508 103.865 1.00 0.00 H TER 19021 WAT 7335 ATOM 19021 O WAT 7336 19.453 47.828 146.500 1.00 0.00 O ATOM 19022 H1 WAT 7336 19.662 48.105 145.608 1.00 0.00 H ATOM 19023 H2 WAT 7336 18.504 47.936 146.568 1.00 0.00 H TER 19025 WAT 7336 ATOM 19025 O WAT 7337 96.131 23.373 132.397 1.00 0.00 O ATOM 19026 H1 WAT 7337 96.122 24.074 133.049 1.00 0.00 H ATOM 19027 H2 WAT 7337 95.437 22.776 132.678 1.00 0.00 H TER 19029 WAT 7337 ATOM 19029 O WAT 7338 139.669 25.257 95.585 1.00 0.00 O ATOM 19030 H1 WAT 7338 140.308 25.784 96.064 1.00 0.00 H ATOM 19031 H2 WAT 7338 139.129 24.857 96.267 1.00 0.00 H TER 19033 WAT 7338 ATOM 19033 O WAT 7339 144.253 51.440 1.461 1.00 0.00 O ATOM 19034 H1 WAT 7339 143.655 51.648 2.180 1.00 0.00 H ATOM 19035 H2 WAT 7339 143.860 51.857 0.695 1.00 0.00 H TER 19037 WAT 7339 ATOM 19037 O WAT 7340 95.208 127.211 86.578 1.00 0.00 O ATOM 19038 H1 WAT 7340 96.150 127.161 86.412 1.00 0.00 H ATOM 19039 H2 WAT 7340 95.034 126.491 87.185 1.00 0.00 H TER 19041 WAT 7340 ATOM 19041 O WAT 7341 46.446 66.695 135.482 1.00 0.00 O ATOM 19042 H1 WAT 7341 45.594 66.294 135.655 1.00 0.00 H ATOM 19043 H2 WAT 7341 47.054 66.219 136.048 1.00 0.00 H TER 19045 WAT 7341 ATOM 19045 O WAT 7342 27.969 22.197 103.604 1.00 0.00 O ATOM 19046 H1 WAT 7342 28.576 22.688 103.051 1.00 0.00 H ATOM 19047 H2 WAT 7342 28.264 22.371 104.498 1.00 0.00 H TER 19049 WAT 7342 ATOM 19049 O WAT 7343 132.082 47.726 128.076 1.00 0.00 O ATOM 19050 H1 WAT 7343 132.205 47.073 128.765 1.00 0.00 H ATOM 19051 H2 WAT 7343 131.729 47.232 127.337 1.00 0.00 H TER 19053 WAT 7343 ATOM 19053 O WAT 7344 76.993 83.882 135.371 1.00 0.00 O ATOM 19054 H1 WAT 7344 76.053 83.839 135.197 1.00 0.00 H ATOM 19055 H2 WAT 7344 77.375 83.228 134.786 1.00 0.00 H TER 19057 WAT 7344 ATOM 19057 O WAT 7345 43.075 129.658 63.015 1.00 0.00 O ATOM 19058 H1 WAT 7345 43.475 130.461 62.682 1.00 0.00 H ATOM 19059 H2 WAT 7345 43.267 129.667 63.953 1.00 0.00 H TER 19061 WAT 7345 ATOM 19061 O WAT 7346 104.704 9.561 151.674 1.00 0.00 O ATOM 19062 H1 WAT 7346 105.019 10.452 151.523 1.00 0.00 H ATOM 19063 H2 WAT 7346 103.796 9.672 151.958 1.00 0.00 H TER 19065 WAT 7346 ATOM 19065 O WAT 7347 2.449 131.281 135.804 1.00 0.00 O ATOM 19066 H1 WAT 7347 2.102 130.828 136.573 1.00 0.00 H ATOM 19067 H2 WAT 7347 2.258 130.693 135.073 1.00 0.00 H TER 19069 WAT 7347 ATOM 19069 O WAT 7348 36.861 0.710 55.398 1.00 0.00 O ATOM 19070 H1 WAT 7348 36.941 1.385 56.072 1.00 0.00 H ATOM 19071 H2 WAT 7348 37.479 0.976 54.718 1.00 0.00 H TER 19073 WAT 7348 ATOM 19073 O WAT 7349 142.231 77.289 87.188 1.00 0.00 O ATOM 19074 H1 WAT 7349 142.957 77.012 86.630 1.00 0.00 H ATOM 19075 H2 WAT 7349 142.420 78.205 87.390 1.00 0.00 H TER 19077 WAT 7349 ATOM 19077 O WAT 7350 37.562 15.184 66.614 1.00 0.00 O ATOM 19078 H1 WAT 7350 37.584 15.886 65.963 1.00 0.00 H ATOM 19079 H2 WAT 7350 38.284 14.606 66.368 1.00 0.00 H TER 19081 WAT 7350 ATOM 19081 O WAT 7351 144.857 45.825 140.718 1.00 0.00 O ATOM 19082 H1 WAT 7351 145.227 45.317 141.440 1.00 0.00 H ATOM 19083 H2 WAT 7351 143.910 45.725 140.816 1.00 0.00 H TER 19085 WAT 7351 ATOM 19085 O WAT 7352 67.350 135.463 106.286 1.00 0.00 O ATOM 19086 H1 WAT 7352 67.525 136.007 105.518 1.00 0.00 H ATOM 19087 H2 WAT 7352 67.097 134.613 105.924 1.00 0.00 H TER 19089 WAT 7352 ATOM 19089 O WAT 7353 95.647 87.086 83.131 1.00 0.00 O ATOM 19090 H1 WAT 7353 94.970 86.608 83.610 1.00 0.00 H ATOM 19091 H2 WAT 7353 95.478 86.883 82.211 1.00 0.00 H TER 19093 WAT 7353 ATOM 19093 O WAT 7354 49.535 15.394 150.493 1.00 0.00 O ATOM 19094 H1 WAT 7354 49.259 16.300 150.356 1.00 0.00 H ATOM 19095 H2 WAT 7354 50.447 15.375 150.203 1.00 0.00 H TER 19097 WAT 7354 ATOM 19097 O WAT 7355 101.892 55.169 129.861 1.00 0.00 O ATOM 19098 H1 WAT 7355 102.644 55.234 130.448 1.00 0.00 H ATOM 19099 H2 WAT 7355 101.159 55.515 130.371 1.00 0.00 H TER 19101 WAT 7355 ATOM 19101 O WAT 7356 136.206 112.684 91.986 1.00 0.00 O ATOM 19102 H1 WAT 7356 136.001 111.852 91.559 1.00 0.00 H ATOM 19103 H2 WAT 7356 135.830 113.349 91.410 1.00 0.00 H TER 19105 WAT 7356 ATOM 19105 O WAT 7357 113.242 128.196 90.485 1.00 0.00 O ATOM 19106 H1 WAT 7357 113.964 128.790 90.690 1.00 0.00 H ATOM 19107 H2 WAT 7357 113.268 128.107 89.533 1.00 0.00 H TER 19109 WAT 7357 ATOM 19109 O WAT 7358 116.187 98.344 77.094 1.00 0.00 O ATOM 19110 H1 WAT 7358 116.196 99.039 77.753 1.00 0.00 H ATOM 19111 H2 WAT 7358 116.808 98.637 76.428 1.00 0.00 H TER 19113 WAT 7358 ATOM 19113 O WAT 7359 114.210 87.117 13.687 1.00 0.00 O ATOM 19114 H1 WAT 7359 114.719 87.912 13.530 1.00 0.00 H ATOM 19115 H2 WAT 7359 114.686 86.661 14.382 1.00 0.00 H TER 19117 WAT 7359 ATOM 19117 O WAT 7360 0.721 94.985 115.346 1.00 0.00 O ATOM 19118 H1 WAT 7360 0.093 94.389 114.939 1.00 0.00 H ATOM 19119 H2 WAT 7360 0.191 95.725 115.644 1.00 0.00 H TER 19121 WAT 7360 ATOM 19121 O WAT 7361 30.527 64.710 15.274 1.00 0.00 O ATOM 19122 H1 WAT 7361 31.344 64.541 14.806 1.00 0.00 H ATOM 19123 H2 WAT 7361 30.486 64.024 15.941 1.00 0.00 H TER 19125 WAT 7361 ATOM 19125 O WAT 7362 4.312 103.139 150.399 1.00 0.00 O ATOM 19126 H1 WAT 7362 4.532 103.490 151.262 1.00 0.00 H ATOM 19127 H2 WAT 7362 3.528 102.611 150.549 1.00 0.00 H TER 19129 WAT 7362 ATOM 19129 O WAT 7363 68.528 73.570 82.197 1.00 0.00 O ATOM 19130 H1 WAT 7363 69.266 73.067 82.539 1.00 0.00 H ATOM 19131 H2 WAT 7363 68.499 74.355 82.744 1.00 0.00 H TER 19133 WAT 7363 ATOM 19133 O WAT 7364 66.879 58.146 118.137 1.00 0.00 O ATOM 19134 H1 WAT 7364 67.632 57.660 117.801 1.00 0.00 H ATOM 19135 H2 WAT 7364 66.943 59.005 117.721 1.00 0.00 H TER 19137 WAT 7364 ATOM 19137 O WAT 7365 134.793 2.471 87.516 1.00 0.00 O ATOM 19138 H1 WAT 7365 133.896 2.674 87.253 1.00 0.00 H ATOM 19139 H2 WAT 7365 135.214 3.325 87.612 1.00 0.00 H TER 19141 WAT 7365 ATOM 19141 O WAT 7366 107.807 93.319 62.792 1.00 0.00 O ATOM 19142 H1 WAT 7366 107.594 93.886 62.051 1.00 0.00 H ATOM 19143 H2 WAT 7366 108.311 92.602 62.407 1.00 0.00 H TER 19145 WAT 7366 ATOM 19145 O WAT 7367 6.224 128.914 119.605 1.00 0.00 O ATOM 19146 H1 WAT 7367 6.868 129.422 120.100 1.00 0.00 H ATOM 19147 H2 WAT 7367 5.477 129.505 119.508 1.00 0.00 H TER 19149 WAT 7367 ATOM 19149 O WAT 7368 90.326 90.365 13.338 1.00 0.00 O ATOM 19150 H1 WAT 7368 89.516 90.789 13.053 1.00 0.00 H ATOM 19151 H2 WAT 7368 90.723 90.041 12.530 1.00 0.00 H TER 19153 WAT 7368 ATOM 19153 O WAT 7369 17.883 46.874 12.102 1.00 0.00 O ATOM 19154 H1 WAT 7369 17.769 47.744 12.485 1.00 0.00 H ATOM 19155 H2 WAT 7369 18.585 46.985 11.460 1.00 0.00 H TER 19157 WAT 7369 ATOM 19157 O WAT 7370 50.589 40.419 131.590 1.00 0.00 O ATOM 19158 H1 WAT 7370 49.740 40.770 131.322 1.00 0.00 H ATOM 19159 H2 WAT 7370 50.467 39.469 131.585 1.00 0.00 H TER 19161 WAT 7370 ATOM 19161 O WAT 7371 1.940 29.942 92.404 1.00 0.00 O ATOM 19162 H1 WAT 7371 1.016 30.073 92.191 1.00 0.00 H ATOM 19163 H2 WAT 7371 2.406 30.556 91.837 1.00 0.00 H TER 19165 WAT 7371 ATOM 19165 O WAT 7372 144.582 38.292 145.399 1.00 0.00 O ATOM 19166 H1 WAT 7372 144.695 39.174 145.045 1.00 0.00 H ATOM 19167 H2 WAT 7372 145.017 37.722 144.766 1.00 0.00 H TER 19169 WAT 7372 ATOM 19169 O WAT 7373 97.023 8.920 81.655 1.00 0.00 O ATOM 19170 H1 WAT 7373 97.355 9.368 82.433 1.00 0.00 H ATOM 19171 H2 WAT 7373 96.088 9.120 81.643 1.00 0.00 H TER 19173 WAT 7373 ATOM 19173 O WAT 7374 17.083 26.892 0.501 1.00 0.00 O ATOM 19174 H1 WAT 7374 16.435 27.591 0.583 1.00 0.00 H ATOM 19175 H2 WAT 7374 16.798 26.390 -0.263 1.00 0.00 H TER 19177 WAT 7374 ATOM 19177 O WAT 7375 114.042 90.136 150.266 1.00 0.00 O ATOM 19178 H1 WAT 7375 113.233 90.187 149.757 1.00 0.00 H ATOM 19179 H2 WAT 7375 114.739 90.243 149.618 1.00 0.00 H TER 19181 WAT 7375 ATOM 19181 O WAT 7376 53.467 139.265 103.586 1.00 0.00 O ATOM 19182 H1 WAT 7376 53.856 138.989 104.416 1.00 0.00 H ATOM 19183 H2 WAT 7376 53.339 138.450 103.099 1.00 0.00 H TER 19185 WAT 7376 ATOM 19185 O WAT 7377 53.652 83.581 151.403 1.00 0.00 O ATOM 19186 H1 WAT 7377 54.057 83.236 150.607 1.00 0.00 H ATOM 19187 H2 WAT 7377 54.116 83.143 152.117 1.00 0.00 H TER 19189 WAT 7377 ATOM 19189 O WAT 7378 108.339 83.220 65.711 1.00 0.00 O ATOM 19190 H1 WAT 7378 109.199 83.388 65.327 1.00 0.00 H ATOM 19191 H2 WAT 7378 108.385 82.314 66.016 1.00 0.00 H TER 19193 WAT 7378 ATOM 19193 O WAT 7379 72.038 99.261 154.037 1.00 0.00 O ATOM 19194 H1 WAT 7379 72.842 99.726 153.804 1.00 0.00 H ATOM 19195 H2 WAT 7379 71.807 98.772 153.248 1.00 0.00 H TER 19197 WAT 7379 ATOM 19197 O WAT 7380 108.050 89.813 150.438 1.00 0.00 O ATOM 19198 H1 WAT 7380 108.695 89.255 150.872 1.00 0.00 H ATOM 19199 H2 WAT 7380 107.959 90.570 151.017 1.00 0.00 H TER 19201 WAT 7380 ATOM 19201 O WAT 7381 39.988 42.413 20.717 1.00 0.00 O ATOM 19202 H1 WAT 7381 40.706 41.832 20.469 1.00 0.00 H ATOM 19203 H2 WAT 7381 39.386 41.855 21.209 1.00 0.00 H TER 19205 WAT 7381 ATOM 19205 O WAT 7382 67.912 15.189 2.146 1.00 0.00 O ATOM 19206 H1 WAT 7382 68.185 15.909 2.715 1.00 0.00 H ATOM 19207 H2 WAT 7382 67.376 14.630 2.708 1.00 0.00 H TER 19209 WAT 7382 ATOM 19209 O WAT 7383 127.630 30.649 102.387 1.00 0.00 O ATOM 19210 H1 WAT 7383 128.222 31.143 102.955 1.00 0.00 H ATOM 19211 H2 WAT 7383 127.300 31.297 101.765 1.00 0.00 H TER 19213 WAT 7383 ATOM 19213 O WAT 7384 134.882 36.450 137.920 1.00 0.00 O ATOM 19214 H1 WAT 7384 135.313 36.654 137.090 1.00 0.00 H ATOM 19215 H2 WAT 7384 134.365 37.231 138.119 1.00 0.00 H TER 19217 WAT 7384 ATOM 19217 O WAT 7385 61.789 49.567 156.135 1.00 0.00 O ATOM 19218 H1 WAT 7385 62.554 50.094 155.903 1.00 0.00 H ATOM 19219 H2 WAT 7385 61.653 48.996 155.379 1.00 0.00 H TER 19221 WAT 7385 ATOM 19221 O WAT 7386 120.223 78.737 154.451 1.00 0.00 O ATOM 19222 H1 WAT 7386 119.554 78.060 154.350 1.00 0.00 H ATOM 19223 H2 WAT 7386 119.762 79.471 154.857 1.00 0.00 H TER 19225 WAT 7386 ATOM 19225 O WAT 7387 47.160 34.882 59.218 1.00 0.00 O ATOM 19226 H1 WAT 7387 46.767 34.226 58.642 1.00 0.00 H ATOM 19227 H2 WAT 7387 47.056 35.708 58.746 1.00 0.00 H TER 19229 WAT 7387 ATOM 19229 O WAT 7388 18.607 117.022 118.940 1.00 0.00 O ATOM 19230 H1 WAT 7388 19.483 116.829 119.272 1.00 0.00 H ATOM 19231 H2 WAT 7388 18.734 117.172 118.003 1.00 0.00 H TER 19233 WAT 7388 ATOM 19233 O WAT 7389 74.388 16.598 59.959 1.00 0.00 O ATOM 19234 H1 WAT 7389 73.730 16.882 59.324 1.00 0.00 H ATOM 19235 H2 WAT 7389 74.818 15.853 59.540 1.00 0.00 H TER 19237 WAT 7389 ATOM 19237 O WAT 7390 78.068 9.668 139.238 1.00 0.00 O ATOM 19238 H1 WAT 7390 78.690 9.445 138.545 1.00 0.00 H ATOM 19239 H2 WAT 7390 77.402 10.198 138.800 1.00 0.00 H TER 19241 WAT 7390 ATOM 19241 O WAT 7391 0.940 74.120 150.109 1.00 0.00 O ATOM 19242 H1 WAT 7391 1.319 74.925 149.755 1.00 0.00 H ATOM 19243 H2 WAT 7391 -0.003 74.285 150.121 1.00 0.00 H TER 19245 WAT 7391 ATOM 19245 O WAT 7392 31.432 95.134 101.625 1.00 0.00 O ATOM 19246 H1 WAT 7392 31.460 94.214 101.889 1.00 0.00 H ATOM 19247 H2 WAT 7392 30.742 95.518 102.167 1.00 0.00 H TER 19249 WAT 7392 ATOM 19249 O WAT 7393 12.683 40.259 98.807 1.00 0.00 O ATOM 19250 H1 WAT 7393 13.097 39.403 98.910 1.00 0.00 H ATOM 19251 H2 WAT 7393 13.292 40.755 98.260 1.00 0.00 H TER 19253 WAT 7393 ATOM 19253 O WAT 7394 8.921 76.414 3.246 1.00 0.00 O ATOM 19254 H1 WAT 7394 8.045 76.601 2.908 1.00 0.00 H ATOM 19255 H2 WAT 7394 8.897 75.485 3.473 1.00 0.00 H TER 19257 WAT 7394 ATOM 19257 O WAT 7395 13.006 115.619 107.416 1.00 0.00 O ATOM 19258 H1 WAT 7395 13.161 116.372 107.986 1.00 0.00 H ATOM 19259 H2 WAT 7395 13.841 115.152 107.403 1.00 0.00 H TER 19261 WAT 7395 ATOM 19261 O WAT 7396 9.993 33.127 106.822 1.00 0.00 O ATOM 19262 H1 WAT 7396 10.706 33.351 106.224 1.00 0.00 H ATOM 19263 H2 WAT 7396 10.229 32.265 107.165 1.00 0.00 H TER 19265 WAT 7396 ATOM 19265 O WAT 7397 79.052 117.165 6.529 1.00 0.00 O ATOM 19266 H1 WAT 7397 78.876 116.265 6.804 1.00 0.00 H ATOM 19267 H2 WAT 7397 78.450 117.697 7.050 1.00 0.00 H TER 19269 WAT 7397 ATOM 19269 O WAT 7398 85.195 1.704 107.045 1.00 0.00 O ATOM 19270 H1 WAT 7398 86.032 2.100 107.285 1.00 0.00 H ATOM 19271 H2 WAT 7398 85.248 1.586 106.097 1.00 0.00 H TER 19273 WAT 7398 ATOM 19273 O WAT 7399 138.495 131.364 2.261 1.00 0.00 O ATOM 19274 H1 WAT 7399 138.524 130.562 1.740 1.00 0.00 H ATOM 19275 H2 WAT 7399 137.594 131.410 2.580 1.00 0.00 H TER 19277 WAT 7399 ATOM 19277 O WAT 7400 3.375 60.917 64.536 1.00 0.00 O ATOM 19278 H1 WAT 7400 3.978 60.245 64.217 1.00 0.00 H ATOM 19279 H2 WAT 7400 3.897 61.719 64.552 1.00 0.00 H TER 19281 WAT 7400 ATOM 19281 O WAT 7401 53.443 110.694 127.137 1.00 0.00 O ATOM 19282 H1 WAT 7401 53.174 109.943 126.609 1.00 0.00 H ATOM 19283 H2 WAT 7401 53.787 110.309 127.943 1.00 0.00 H TER 19285 WAT 7401 ATOM 19285 O WAT 7402 85.623 19.411 157.111 1.00 0.00 O ATOM 19286 H1 WAT 7402 86.514 19.492 156.771 1.00 0.00 H ATOM 19287 H2 WAT 7402 85.313 18.570 156.776 1.00 0.00 H TER 19289 WAT 7402 ATOM 19289 O WAT 7403 127.066 5.485 87.443 1.00 0.00 O ATOM 19290 H1 WAT 7403 126.941 6.104 88.161 1.00 0.00 H ATOM 19291 H2 WAT 7403 127.313 4.666 87.873 1.00 0.00 H TER 19293 WAT 7403 ATOM 19293 O WAT 7404 92.499 127.219 67.343 1.00 0.00 O ATOM 19294 H1 WAT 7404 92.854 126.846 68.150 1.00 0.00 H ATOM 19295 H2 WAT 7404 92.971 128.045 67.233 1.00 0.00 H TER 19297 WAT 7404 ATOM 19297 O WAT 7405 96.411 78.110 78.991 1.00 0.00 O ATOM 19298 H1 WAT 7405 96.647 77.212 79.223 1.00 0.00 H ATOM 19299 H2 WAT 7405 96.812 78.249 78.133 1.00 0.00 H TER 19301 WAT 7405 ATOM 19301 O WAT 7406 104.342 28.348 62.905 1.00 0.00 O ATOM 19302 H1 WAT 7406 104.084 27.652 62.301 1.00 0.00 H ATOM 19303 H2 WAT 7406 105.052 28.806 62.453 1.00 0.00 H TER 19305 WAT 7406 ATOM 19305 O WAT 7407 128.888 44.345 122.490 1.00 0.00 O ATOM 19306 H1 WAT 7407 128.104 44.876 122.629 1.00 0.00 H ATOM 19307 H2 WAT 7407 128.857 44.111 121.562 1.00 0.00 H TER 19309 WAT 7407 ATOM 19309 O WAT 7408 104.575 78.659 158.204 1.00 0.00 O ATOM 19310 H1 WAT 7408 103.737 78.973 157.862 1.00 0.00 H ATOM 19311 H2 WAT 7408 104.924 78.102 157.509 1.00 0.00 H TER 19313 WAT 7408 ATOM 19313 O WAT 7409 64.051 27.404 143.789 1.00 0.00 O ATOM 19314 H1 WAT 7409 64.377 27.700 142.939 1.00 0.00 H ATOM 19315 H2 WAT 7409 64.120 28.175 144.353 1.00 0.00 H TER 19317 WAT 7409 ATOM 19317 O WAT 7410 78.998 107.517 152.840 1.00 0.00 O ATOM 19318 H1 WAT 7410 79.747 108.097 152.978 1.00 0.00 H ATOM 19319 H2 WAT 7410 79.229 106.714 153.306 1.00 0.00 H TER 19321 WAT 7410 ATOM 19321 O WAT 7411 108.912 95.459 71.462 1.00 0.00 O ATOM 19322 H1 WAT 7411 108.280 95.062 72.062 1.00 0.00 H ATOM 19323 H2 WAT 7411 109.251 94.724 70.951 1.00 0.00 H TER 19325 WAT 7411 ATOM 19325 O WAT 7412 111.541 0.088 140.039 1.00 0.00 O ATOM 19326 H1 WAT 7412 111.175 0.970 139.972 1.00 0.00 H ATOM 19327 H2 WAT 7412 110.776 -0.485 140.094 1.00 0.00 H TER 19329 WAT 7412 ATOM 19329 O WAT 7413 128.282 101.147 91.978 1.00 0.00 O ATOM 19330 H1 WAT 7413 128.795 100.945 91.196 1.00 0.00 H ATOM 19331 H2 WAT 7413 127.410 101.361 91.644 1.00 0.00 H TER 19333 WAT 7413 ATOM 19333 O WAT 7414 69.897 140.469 84.572 1.00 0.00 O ATOM 19334 H1 WAT 7414 69.332 139.820 84.153 1.00 0.00 H ATOM 19335 H2 WAT 7414 70.306 139.997 85.298 1.00 0.00 H TER 19337 WAT 7414 ATOM 19337 O WAT 7415 41.387 135.532 146.146 1.00 0.00 O ATOM 19338 H1 WAT 7415 41.326 135.127 145.280 1.00 0.00 H ATOM 19339 H2 WAT 7415 41.948 134.941 146.648 1.00 0.00 H TER 19341 WAT 7415 ATOM 19341 O WAT 7416 68.421 57.267 96.398 1.00 0.00 O ATOM 19342 H1 WAT 7416 67.920 57.516 97.174 1.00 0.00 H ATOM 19343 H2 WAT 7416 68.110 57.858 95.712 1.00 0.00 H TER 19345 WAT 7416 ATOM 19345 O WAT 7417 70.008 112.524 101.771 1.00 0.00 O ATOM 19346 H1 WAT 7417 69.672 112.407 102.660 1.00 0.00 H ATOM 19347 H2 WAT 7417 69.274 112.899 101.285 1.00 0.00 H TER 19349 WAT 7417 ATOM 19349 O WAT 7418 86.402 65.994 157.318 1.00 0.00 O ATOM 19350 H1 WAT 7418 86.354 66.402 158.182 1.00 0.00 H ATOM 19351 H2 WAT 7418 85.789 65.260 157.365 1.00 0.00 H TER 19353 WAT 7418 ATOM 19353 O WAT 7419 23.912 21.085 114.869 1.00 0.00 O ATOM 19354 H1 WAT 7419 23.384 21.769 114.457 1.00 0.00 H ATOM 19355 H2 WAT 7419 24.063 21.403 115.760 1.00 0.00 H TER 19357 WAT 7419 ATOM 19357 O WAT 7420 116.936 12.015 137.708 1.00 0.00 O ATOM 19358 H1 WAT 7420 116.942 11.089 137.465 1.00 0.00 H ATOM 19359 H2 WAT 7420 117.595 12.416 137.141 1.00 0.00 H TER 19361 WAT 7420 ATOM 19361 O WAT 7421 116.323 11.874 22.610 1.00 0.00 O ATOM 19362 H1 WAT 7421 116.972 12.539 22.381 1.00 0.00 H ATOM 19363 H2 WAT 7421 115.872 12.232 23.375 1.00 0.00 H TER 19365 WAT 7421 ATOM 19365 O WAT 7422 125.964 72.470 86.863 1.00 0.00 O ATOM 19366 H1 WAT 7422 126.324 72.547 85.979 1.00 0.00 H ATOM 19367 H2 WAT 7422 126.649 72.027 87.363 1.00 0.00 H TER 19369 WAT 7422 ATOM 19369 O WAT 7423 117.008 58.076 133.295 1.00 0.00 O ATOM 19370 H1 WAT 7423 117.176 59.014 133.211 1.00 0.00 H ATOM 19371 H2 WAT 7423 116.055 57.998 133.248 1.00 0.00 H TER 19373 WAT 7423 ATOM 19373 O WAT 7424 18.758 97.820 4.703 1.00 0.00 O ATOM 19374 H1 WAT 7424 18.676 98.387 5.470 1.00 0.00 H ATOM 19375 H2 WAT 7424 19.697 97.797 4.521 1.00 0.00 H TER 19377 WAT 7424 ATOM 19377 O WAT 7425 50.784 127.597 10.986 1.00 0.00 O ATOM 19378 H1 WAT 7425 51.161 126.865 10.499 1.00 0.00 H ATOM 19379 H2 WAT 7425 51.521 127.967 11.471 1.00 0.00 H TER 19381 WAT 7425 ATOM 19381 O WAT 7426 140.412 49.108 15.388 1.00 0.00 O ATOM 19382 H1 WAT 7426 141.169 49.346 14.851 1.00 0.00 H ATOM 19383 H2 WAT 7426 140.763 49.030 16.275 1.00 0.00 H TER 19385 WAT 7426 ATOM 19385 O WAT 7427 18.270 3.554 97.467 1.00 0.00 O ATOM 19386 H1 WAT 7427 18.789 4.213 97.928 1.00 0.00 H ATOM 19387 H2 WAT 7427 17.441 3.523 97.945 1.00 0.00 H TER 19389 WAT 7427 ATOM 19389 O WAT 7428 122.640 47.107 140.642 1.00 0.00 O ATOM 19390 H1 WAT 7428 123.448 47.604 140.769 1.00 0.00 H ATOM 19391 H2 WAT 7428 122.659 46.850 139.720 1.00 0.00 H TER 19393 WAT 7428 ATOM 19393 O WAT 7429 44.594 40.511 128.937 1.00 0.00 O ATOM 19394 H1 WAT 7429 45.254 39.821 129.009 1.00 0.00 H ATOM 19395 H2 WAT 7429 44.981 41.151 128.340 1.00 0.00 H TER 19397 WAT 7429 ATOM 19397 O WAT 7430 95.536 100.746 91.215 1.00 0.00 O ATOM 19398 H1 WAT 7430 94.885 100.182 91.632 1.00 0.00 H ATOM 19399 H2 WAT 7430 96.367 100.288 91.343 1.00 0.00 H TER 19401 WAT 7430 ATOM 19401 O WAT 7431 37.878 132.279 152.625 1.00 0.00 O ATOM 19402 H1 WAT 7431 38.684 132.187 152.118 1.00 0.00 H ATOM 19403 H2 WAT 7431 37.213 132.515 151.978 1.00 0.00 H TER 19405 WAT 7431 ATOM 19405 O WAT 7432 97.767 7.307 78.908 1.00 0.00 O ATOM 19406 H1 WAT 7432 97.593 7.334 79.849 1.00 0.00 H ATOM 19407 H2 WAT 7432 97.867 6.375 78.710 1.00 0.00 H TER 19409 WAT 7432 ATOM 19409 O WAT 7433 47.974 3.196 93.317 1.00 0.00 O ATOM 19410 H1 WAT 7433 48.147 2.580 92.606 1.00 0.00 H ATOM 19411 H2 WAT 7433 48.816 3.623 93.474 1.00 0.00 H TER 19413 WAT 7433 ATOM 19413 O WAT 7434 12.787 62.194 147.305 1.00 0.00 O ATOM 19414 H1 WAT 7434 11.905 62.484 147.074 1.00 0.00 H ATOM 19415 H2 WAT 7434 13.022 61.570 146.618 1.00 0.00 H TER 19417 WAT 7434 ATOM 19417 O WAT 7435 104.524 56.419 87.562 1.00 0.00 O ATOM 19418 H1 WAT 7435 105.005 55.735 87.095 1.00 0.00 H ATOM 19419 H2 WAT 7435 104.543 56.143 88.478 1.00 0.00 H TER 19421 WAT 7435 ATOM 19421 O WAT 7436 121.814 110.763 1.036 1.00 0.00 O ATOM 19422 H1 WAT 7436 122.720 111.070 1.060 1.00 0.00 H ATOM 19423 H2 WAT 7436 121.873 109.826 1.221 1.00 0.00 H TER 19425 WAT 7436 ATOM 19425 O WAT 7437 77.129 121.692 125.793 1.00 0.00 O ATOM 19426 H1 WAT 7437 76.912 121.019 125.147 1.00 0.00 H ATOM 19427 H2 WAT 7437 76.635 122.462 125.512 1.00 0.00 H TER 19429 WAT 7437 ATOM 19429 O WAT 7438 34.789 53.574 140.163 1.00 0.00 O ATOM 19430 H1 WAT 7438 34.662 53.706 139.224 1.00 0.00 H ATOM 19431 H2 WAT 7438 35.024 54.440 140.497 1.00 0.00 H TER 19433 WAT 7438 ATOM 19433 O WAT 7439 130.907 98.256 80.562 1.00 0.00 O ATOM 19434 H1 WAT 7439 131.162 98.931 79.933 1.00 0.00 H ATOM 19435 H2 WAT 7439 131.478 97.515 80.364 1.00 0.00 H TER 19437 WAT 7439 ATOM 19437 O WAT 7440 6.419 33.119 87.972 1.00 0.00 O ATOM 19438 H1 WAT 7440 5.852 33.836 88.256 1.00 0.00 H ATOM 19439 H2 WAT 7440 6.609 32.631 88.773 1.00 0.00 H TER 19441 WAT 7440 ATOM 19441 O WAT 7441 59.234 130.840 137.131 1.00 0.00 O ATOM 19442 H1 WAT 7441 58.893 130.256 136.454 1.00 0.00 H ATOM 19443 H2 WAT 7441 60.168 130.636 137.175 1.00 0.00 H TER 19445 WAT 7441 ATOM 19445 O WAT 7442 135.056 34.779 54.348 1.00 0.00 O ATOM 19446 H1 WAT 7442 135.980 34.530 54.330 1.00 0.00 H ATOM 19447 H2 WAT 7442 134.584 33.961 54.190 1.00 0.00 H TER 19449 WAT 7442 ATOM 19449 O WAT 7443 17.343 7.065 75.519 1.00 0.00 O ATOM 19450 H1 WAT 7443 17.079 7.774 74.932 1.00 0.00 H ATOM 19451 H2 WAT 7443 18.282 7.198 75.648 1.00 0.00 H TER 19453 WAT 7443 ATOM 19453 O WAT 7444 57.914 17.591 148.652 1.00 0.00 O ATOM 19454 H1 WAT 7444 58.545 18.291 148.483 1.00 0.00 H ATOM 19455 H2 WAT 7444 57.850 17.121 147.820 1.00 0.00 H TER 19457 WAT 7444 ATOM 19457 O WAT 7445 75.637 105.542 3.576 1.00 0.00 O ATOM 19458 H1 WAT 7445 76.326 105.790 4.192 1.00 0.00 H ATOM 19459 H2 WAT 7445 75.715 106.175 2.862 1.00 0.00 H TER 19461 WAT 7445 ATOM 19461 O WAT 7446 51.322 86.701 98.370 1.00 0.00 O ATOM 19462 H1 WAT 7446 50.837 86.586 97.553 1.00 0.00 H ATOM 19463 H2 WAT 7446 51.920 85.954 98.401 1.00 0.00 H TER 19465 WAT 7446 ATOM 19465 O WAT 7447 41.891 85.231 26.071 1.00 0.00 O ATOM 19466 H1 WAT 7447 41.731 84.329 26.350 1.00 0.00 H ATOM 19467 H2 WAT 7447 41.071 85.504 25.660 1.00 0.00 H TER 19469 WAT 7447 ATOM 19469 O WAT 7448 5.735 106.572 9.527 1.00 0.00 O ATOM 19470 H1 WAT 7448 5.457 106.394 8.629 1.00 0.00 H ATOM 19471 H2 WAT 7448 4.932 106.506 10.044 1.00 0.00 H TER 19473 WAT 7448 ATOM 19473 O WAT 7449 106.174 103.478 19.544 1.00 0.00 O ATOM 19474 H1 WAT 7449 106.773 102.799 19.232 1.00 0.00 H ATOM 19475 H2 WAT 7449 106.730 104.246 19.675 1.00 0.00 H TER 19477 WAT 7449 ATOM 19477 O WAT 7450 45.499 54.245 83.390 1.00 0.00 O ATOM 19478 H1 WAT 7450 46.174 54.912 83.262 1.00 0.00 H ATOM 19479 H2 WAT 7450 45.988 53.437 83.548 1.00 0.00 H TER 19481 WAT 7450 ATOM 19481 O WAT 7451 39.290 6.445 91.548 1.00 0.00 O ATOM 19482 H1 WAT 7451 40.155 6.836 91.428 1.00 0.00 H ATOM 19483 H2 WAT 7451 39.322 5.632 91.044 1.00 0.00 H TER 19485 WAT 7451 ATOM 19485 O WAT 7452 35.255 13.711 125.858 1.00 0.00 O ATOM 19486 H1 WAT 7452 35.060 14.643 125.767 1.00 0.00 H ATOM 19487 H2 WAT 7452 36.012 13.568 125.289 1.00 0.00 H TER 19489 WAT 7452 ATOM 19489 O WAT 7453 70.084 144.347 68.461 1.00 0.00 O ATOM 19490 H1 WAT 7453 69.136 144.244 68.385 1.00 0.00 H ATOM 19491 H2 WAT 7453 70.413 143.455 68.576 1.00 0.00 H TER 19493 WAT 7453 ATOM 19493 O WAT 7454 89.767 127.401 119.942 1.00 0.00 O ATOM 19494 H1 WAT 7454 88.985 127.685 119.470 1.00 0.00 H ATOM 19495 H2 WAT 7454 89.816 126.459 119.780 1.00 0.00 H TER 19497 WAT 7454 ATOM 19497 O WAT 7455 104.710 75.017 63.909 1.00 0.00 O ATOM 19498 H1 WAT 7455 104.582 75.392 64.781 1.00 0.00 H ATOM 19499 H2 WAT 7455 105.556 74.573 63.962 1.00 0.00 H TER 19501 WAT 7455 ATOM 19501 O WAT 7456 101.635 92.295 23.593 1.00 0.00 O ATOM 19502 H1 WAT 7456 102.072 91.446 23.520 1.00 0.00 H ATOM 19503 H2 WAT 7456 102.302 92.877 23.956 1.00 0.00 H TER 19505 WAT 7456 ATOM 19505 O WAT 7457 143.086 115.681 13.452 1.00 0.00 O ATOM 19506 H1 WAT 7457 143.234 116.116 14.292 1.00 0.00 H ATOM 19507 H2 WAT 7457 143.140 114.747 13.653 1.00 0.00 H TER 19509 WAT 7457 ATOM 19509 O WAT 7458 40.685 98.852 86.322 1.00 0.00 O ATOM 19510 H1 WAT 7458 40.681 97.965 85.962 1.00 0.00 H ATOM 19511 H2 WAT 7458 39.988 99.306 85.849 1.00 0.00 H TER 19513 WAT 7458 ATOM 19513 O WAT 7459 77.638 40.760 84.601 1.00 0.00 O ATOM 19514 H1 WAT 7459 78.319 40.090 84.543 1.00 0.00 H ATOM 19515 H2 WAT 7459 77.488 40.869 85.540 1.00 0.00 H TER 19517 WAT 7459 ATOM 19517 O WAT 7460 105.693 132.469 126.892 1.00 0.00 O ATOM 19518 H1 WAT 7460 106.141 131.824 126.345 1.00 0.00 H ATOM 19519 H2 WAT 7460 106.357 133.134 127.073 1.00 0.00 H TER 19521 WAT 7460 ATOM 19521 O WAT 7461 113.073 92.122 127.319 1.00 0.00 O ATOM 19522 H1 WAT 7461 112.616 91.750 128.073 1.00 0.00 H ATOM 19523 H2 WAT 7461 113.957 91.759 127.372 1.00 0.00 H TER 19525 WAT 7461 ATOM 19525 O WAT 7462 100.987 82.274 111.340 1.00 0.00 O ATOM 19526 H1 WAT 7462 101.471 82.541 110.559 1.00 0.00 H ATOM 19527 H2 WAT 7462 100.572 81.447 111.093 1.00 0.00 H TER 19529 WAT 7462 ATOM 19529 O WAT 7463 57.748 33.521 9.228 1.00 0.00 O ATOM 19530 H1 WAT 7463 57.372 34.217 9.766 1.00 0.00 H ATOM 19531 H2 WAT 7463 58.525 33.238 9.711 1.00 0.00 H TER 19533 WAT 7463 ATOM 19533 O WAT 7464 68.981 3.919 114.975 1.00 0.00 O ATOM 19534 H1 WAT 7464 68.067 3.669 114.839 1.00 0.00 H ATOM 19535 H2 WAT 7464 69.361 3.924 114.096 1.00 0.00 H TER 19537 WAT 7464 ATOM 19537 O WAT 7465 54.851 136.117 92.325 1.00 0.00 O ATOM 19538 H1 WAT 7465 54.142 135.773 92.869 1.00 0.00 H ATOM 19539 H2 WAT 7465 55.373 136.652 92.923 1.00 0.00 H TER 19541 WAT 7465 ATOM 19541 O WAT 7466 92.474 87.373 142.970 1.00 0.00 O ATOM 19542 H1 WAT 7466 92.308 86.741 142.272 1.00 0.00 H ATOM 19543 H2 WAT 7466 93.377 87.203 143.238 1.00 0.00 H TER 19545 WAT 7466 ATOM 19545 O WAT 7467 11.699 143.746 105.092 1.00 0.00 O ATOM 19546 H1 WAT 7467 12.448 143.369 105.554 1.00 0.00 H ATOM 19547 H2 WAT 7467 11.798 144.691 105.208 1.00 0.00 H TER 19549 WAT 7467 ATOM 19549 O WAT 7468 9.989 84.823 16.021 1.00 0.00 O ATOM 19550 H1 WAT 7468 9.265 85.041 16.607 1.00 0.00 H ATOM 19551 H2 WAT 7468 10.104 85.604 15.480 1.00 0.00 H TER 19553 WAT 7468 ATOM 19553 O WAT 7469 25.692 104.798 4.275 1.00 0.00 O ATOM 19554 H1 WAT 7469 25.581 104.083 3.648 1.00 0.00 H ATOM 19555 H2 WAT 7469 25.206 104.515 5.049 1.00 0.00 H TER 19557 WAT 7469 ATOM 19557 O WAT 7470 111.667 134.980 0.766 1.00 0.00 O ATOM 19558 H1 WAT 7470 111.208 134.201 1.079 1.00 0.00 H ATOM 19559 H2 WAT 7470 112.027 135.380 1.557 1.00 0.00 H TER 19561 WAT 7470 ATOM 19561 O WAT 7471 118.069 11.125 115.042 1.00 0.00 O ATOM 19562 H1 WAT 7471 117.301 10.554 115.024 1.00 0.00 H ATOM 19563 H2 WAT 7471 117.723 11.999 114.863 1.00 0.00 H TER 19565 WAT 7471 ATOM 19565 O WAT 7472 98.749 76.659 132.226 1.00 0.00 O ATOM 19566 H1 WAT 7472 97.912 76.458 132.645 1.00 0.00 H ATOM 19567 H2 WAT 7472 98.942 77.557 132.496 1.00 0.00 H TER 19569 WAT 7472 ATOM 19569 O WAT 7473 20.899 71.512 129.455 1.00 0.00 O ATOM 19570 H1 WAT 7473 21.519 71.800 130.124 1.00 0.00 H ATOM 19571 H2 WAT 7473 20.531 72.323 129.103 1.00 0.00 H TER 19573 WAT 7473 ATOM 19573 O WAT 7474 20.028 36.544 78.589 1.00 0.00 O ATOM 19574 H1 WAT 7474 19.991 35.890 79.287 1.00 0.00 H ATOM 19575 H2 WAT 7474 20.202 36.038 77.796 1.00 0.00 H TER 19577 WAT 7474 ATOM 19577 O WAT 7475 48.751 75.152 68.607 1.00 0.00 O ATOM 19578 H1 WAT 7475 48.579 74.329 69.065 1.00 0.00 H ATOM 19579 H2 WAT 7475 49.447 75.567 69.115 1.00 0.00 H TER 19581 WAT 7475 ATOM 19581 O WAT 7476 11.539 41.150 147.076 1.00 0.00 O ATOM 19582 H1 WAT 7476 11.127 42.010 146.995 1.00 0.00 H ATOM 19583 H2 WAT 7476 12.374 41.240 146.615 1.00 0.00 H TER 19585 WAT 7476 ATOM 19585 O WAT 7477 124.417 1.171 145.578 1.00 0.00 O ATOM 19586 H1 WAT 7477 125.254 0.762 145.798 1.00 0.00 H ATOM 19587 H2 WAT 7477 123.934 1.187 146.404 1.00 0.00 H TER 19589 WAT 7477 ATOM 19589 O WAT 7478 58.444 51.189 25.634 1.00 0.00 O ATOM 19590 H1 WAT 7478 58.405 50.793 24.764 1.00 0.00 H ATOM 19591 H2 WAT 7478 57.594 51.615 25.742 1.00 0.00 H TER 19593 WAT 7478 ATOM 19593 O WAT 7479 125.163 39.610 12.591 1.00 0.00 O ATOM 19594 H1 WAT 7479 126.026 39.312 12.880 1.00 0.00 H ATOM 19595 H2 WAT 7479 124.607 38.833 12.658 1.00 0.00 H TER 19597 WAT 7479 ATOM 19597 O WAT 7480 13.106 25.110 105.765 1.00 0.00 O ATOM 19598 H1 WAT 7480 12.514 25.648 106.291 1.00 0.00 H ATOM 19599 H2 WAT 7480 13.040 24.236 106.148 1.00 0.00 H TER 19601 WAT 7480 ATOM 19601 O WAT 7481 23.302 109.460 149.830 1.00 0.00 O ATOM 19602 H1 WAT 7481 22.654 110.038 150.234 1.00 0.00 H ATOM 19603 H2 WAT 7481 22.929 108.583 149.921 1.00 0.00 H TER 19605 WAT 7481 ATOM 19605 O WAT 7482 45.516 131.151 92.962 1.00 0.00 O ATOM 19606 H1 WAT 7482 45.065 131.631 92.267 1.00 0.00 H ATOM 19607 H2 WAT 7482 46.303 131.666 93.137 1.00 0.00 H TER 19609 WAT 7482 ATOM 19609 O WAT 7483 44.338 15.000 11.129 1.00 0.00 O ATOM 19610 H1 WAT 7483 44.823 14.456 10.508 1.00 0.00 H ATOM 19611 H2 WAT 7483 44.907 15.051 11.897 1.00 0.00 H TER 19613 WAT 7483 ATOM 19613 O WAT 7484 142.539 78.132 54.994 1.00 0.00 O ATOM 19614 H1 WAT 7484 141.668 78.396 54.698 1.00 0.00 H ATOM 19615 H2 WAT 7484 143.140 78.677 54.486 1.00 0.00 H TER 19617 WAT 7484 ATOM 19617 O WAT 7485 50.184 88.665 94.073 1.00 0.00 O ATOM 19618 H1 WAT 7485 50.419 89.590 93.998 1.00 0.00 H ATOM 19619 H2 WAT 7485 49.228 88.663 94.107 1.00 0.00 H TER 19621 WAT 7485 ATOM 19621 O WAT 7486 130.662 113.041 11.062 1.00 0.00 O ATOM 19622 H1 WAT 7486 130.520 113.949 11.328 1.00 0.00 H ATOM 19623 H2 WAT 7486 131.415 112.755 11.579 1.00 0.00 H TER 19625 WAT 7486 ATOM 19625 O WAT 7487 40.201 5.306 107.925 1.00 0.00 O ATOM 19626 H1 WAT 7487 40.245 4.888 107.065 1.00 0.00 H ATOM 19627 H2 WAT 7487 39.811 4.642 108.494 1.00 0.00 H TER 19629 WAT 7487 ATOM 19629 O WAT 7488 139.924 22.820 111.612 1.00 0.00 O ATOM 19630 H1 WAT 7488 139.493 22.330 110.912 1.00 0.00 H ATOM 19631 H2 WAT 7488 140.786 22.411 111.696 1.00 0.00 H TER 19633 WAT 7488 ATOM 19633 O WAT 7489 114.345 68.845 133.680 1.00 0.00 O ATOM 19634 H1 WAT 7489 113.927 69.674 133.449 1.00 0.00 H ATOM 19635 H2 WAT 7489 115.184 68.863 133.219 1.00 0.00 H TER 19637 WAT 7489 ATOM 19637 O WAT 7490 89.647 76.153 76.508 1.00 0.00 O ATOM 19638 H1 WAT 7490 89.552 75.501 77.202 1.00 0.00 H ATOM 19639 H2 WAT 7490 90.474 75.931 76.082 1.00 0.00 H TER 19641 WAT 7490 ATOM 19641 O WAT 7491 58.395 143.682 121.700 1.00 0.00 O ATOM 19642 H1 WAT 7491 57.703 143.076 121.966 1.00 0.00 H ATOM 19643 H2 WAT 7491 57.937 144.503 121.518 1.00 0.00 H TER 19645 WAT 7491 ATOM 19645 O WAT 7492 30.166 86.854 148.074 1.00 0.00 O ATOM 19646 H1 WAT 7492 30.069 87.765 148.353 1.00 0.00 H ATOM 19647 H2 WAT 7492 29.915 86.859 147.150 1.00 0.00 H TER 19649 WAT 7492 ATOM 19649 O WAT 7493 22.305 89.175 97.259 1.00 0.00 O ATOM 19650 H1 WAT 7493 22.261 88.235 97.432 1.00 0.00 H ATOM 19651 H2 WAT 7493 23.240 89.378 97.277 1.00 0.00 H TER 19653 WAT 7493 ATOM 19653 O WAT 7494 1.507 89.647 110.531 1.00 0.00 O ATOM 19654 H1 WAT 7494 1.623 90.596 110.482 1.00 0.00 H ATOM 19655 H2 WAT 7494 2.263 89.289 110.066 1.00 0.00 H TER 19657 WAT 7494 ATOM 19657 O WAT 7495 8.284 49.358 107.376 1.00 0.00 O ATOM 19658 H1 WAT 7495 8.122 50.277 107.590 1.00 0.00 H ATOM 19659 H2 WAT 7495 9.046 49.378 106.797 1.00 0.00 H TER 19661 WAT 7495 ATOM 19661 O WAT 7496 48.760 112.657 101.245 1.00 0.00 O ATOM 19662 H1 WAT 7496 49.633 113.039 101.153 1.00 0.00 H ATOM 19663 H2 WAT 7496 48.865 111.979 101.913 1.00 0.00 H TER 19665 WAT 7496 ATOM 19665 O WAT 7497 11.880 106.238 101.819 1.00 0.00 O ATOM 19666 H1 WAT 7497 11.675 107.086 102.214 1.00 0.00 H ATOM 19667 H2 WAT 7497 12.808 106.296 101.594 1.00 0.00 H TER 19669 WAT 7497 ATOM 19669 O WAT 7498 140.182 127.957 11.074 1.00 0.00 O ATOM 19670 H1 WAT 7498 139.500 127.336 10.820 1.00 0.00 H ATOM 19671 H2 WAT 7498 140.238 127.876 12.026 1.00 0.00 H TER 19673 WAT 7498 ATOM 19673 O WAT 7499 8.309 83.234 153.252 1.00 0.00 O ATOM 19674 H1 WAT 7499 9.026 83.778 152.924 1.00 0.00 H ATOM 19675 H2 WAT 7499 8.149 83.557 154.138 1.00 0.00 H TER 19677 WAT 7499 ATOM 19677 O WAT 7500 65.926 55.803 151.025 1.00 0.00 O ATOM 19678 H1 WAT 7500 65.871 56.719 150.751 1.00 0.00 H ATOM 19679 H2 WAT 7500 65.014 55.517 151.087 1.00 0.00 H TER 19681 WAT 7500 ATOM 19681 O WAT 7501 120.365 99.831 101.430 1.00 0.00 O ATOM 19682 H1 WAT 7501 120.490 99.034 100.915 1.00 0.00 H ATOM 19683 H2 WAT 7501 119.959 99.530 102.243 1.00 0.00 H TER 19685 WAT 7501 ATOM 19685 O WAT 7502 102.686 11.186 89.232 1.00 0.00 O ATOM 19686 H1 WAT 7502 102.414 10.525 88.596 1.00 0.00 H ATOM 19687 H2 WAT 7502 101.884 11.407 89.705 1.00 0.00 H TER 19689 WAT 7502 ATOM 19689 O WAT 7503 43.850 108.027 10.721 1.00 0.00 O ATOM 19690 H1 WAT 7503 44.509 108.205 11.391 1.00 0.00 H ATOM 19691 H2 WAT 7503 43.034 107.917 11.210 1.00 0.00 H TER 19693 WAT 7503 ATOM 19693 O WAT 7504 45.547 36.518 70.076 1.00 0.00 O ATOM 19694 H1 WAT 7504 45.280 37.437 70.114 1.00 0.00 H ATOM 19695 H2 WAT 7504 46.001 36.366 70.904 1.00 0.00 H TER 19697 WAT 7504 ATOM 19697 O WAT 7505 132.323 91.542 141.931 1.00 0.00 O ATOM 19698 H1 WAT 7505 132.984 91.436 142.615 1.00 0.00 H ATOM 19699 H2 WAT 7505 132.070 90.648 141.701 1.00 0.00 H TER 19701 WAT 7505 ATOM 19701 O WAT 7506 92.699 5.971 120.719 1.00 0.00 O ATOM 19702 H1 WAT 7506 93.459 6.363 121.148 1.00 0.00 H ATOM 19703 H2 WAT 7506 92.265 6.704 120.283 1.00 0.00 H TER 19705 WAT 7506 ATOM 19705 O WAT 7507 63.417 93.551 86.430 1.00 0.00 O ATOM 19706 H1 WAT 7507 64.146 92.931 86.448 1.00 0.00 H ATOM 19707 H2 WAT 7507 63.799 94.379 86.719 1.00 0.00 H TER 19709 WAT 7507 ATOM 19709 O WAT 7508 47.995 71.451 108.326 1.00 0.00 O ATOM 19710 H1 WAT 7508 47.201 71.985 108.338 1.00 0.00 H ATOM 19711 H2 WAT 7508 48.149 71.271 107.399 1.00 0.00 H TER 19713 WAT 7508 ATOM 19713 O WAT 7509 84.377 66.744 153.936 1.00 0.00 O ATOM 19714 H1 WAT 7509 83.863 67.339 154.483 1.00 0.00 H ATOM 19715 H2 WAT 7509 84.264 65.886 154.344 1.00 0.00 H TER 19717 WAT 7509 ATOM 19717 O WAT 7510 133.485 27.026 13.692 1.00 0.00 O ATOM 19718 H1 WAT 7510 133.181 26.119 13.655 1.00 0.00 H ATOM 19719 H2 WAT 7510 133.087 27.443 12.928 1.00 0.00 H TER 19721 WAT 7510 ATOM 19721 O WAT 7511 119.919 133.340 154.298 1.00 0.00 O ATOM 19722 H1 WAT 7511 119.300 133.545 154.999 1.00 0.00 H ATOM 19723 H2 WAT 7511 119.642 132.481 153.979 1.00 0.00 H TER 19725 WAT 7511 ATOM 19725 O WAT 7512 17.307 109.130 157.459 1.00 0.00 O ATOM 19726 H1 WAT 7512 17.253 109.240 158.408 1.00 0.00 H ATOM 19727 H2 WAT 7512 16.403 108.980 157.183 1.00 0.00 H TER 19729 WAT 7512 ATOM 19729 O WAT 7513 108.857 32.250 155.364 1.00 0.00 O ATOM 19730 H1 WAT 7513 108.859 31.300 155.487 1.00 0.00 H ATOM 19731 H2 WAT 7513 109.030 32.370 154.430 1.00 0.00 H TER 19733 WAT 7513 ATOM 19733 O WAT 7514 69.140 97.556 77.910 1.00 0.00 O ATOM 19734 H1 WAT 7514 69.595 98.282 78.336 1.00 0.00 H ATOM 19735 H2 WAT 7514 68.309 97.932 77.619 1.00 0.00 H TER 19737 WAT 7514 ATOM 19737 O WAT 7515 102.775 117.841 11.460 1.00 0.00 O ATOM 19738 H1 WAT 7515 103.183 117.829 12.325 1.00 0.00 H ATOM 19739 H2 WAT 7515 103.480 117.600 10.859 1.00 0.00 H TER 19741 WAT 7515 ATOM 19741 O WAT 7516 1.654 64.196 146.707 1.00 0.00 O ATOM 19742 H1 WAT 7516 2.015 65.072 146.566 1.00 0.00 H ATOM 19743 H2 WAT 7516 1.142 64.018 145.918 1.00 0.00 H TER 19745 WAT 7516 ATOM 19745 O WAT 7517 86.873 1.844 122.136 1.00 0.00 O ATOM 19746 H1 WAT 7517 86.349 2.612 122.364 1.00 0.00 H ATOM 19747 H2 WAT 7517 87.569 2.187 121.576 1.00 0.00 H TER 19749 WAT 7517 ATOM 19749 O WAT 7518 104.579 82.139 112.995 1.00 0.00 O ATOM 19750 H1 WAT 7518 105.060 82.842 112.559 1.00 0.00 H ATOM 19751 H2 WAT 7518 104.876 82.173 113.904 1.00 0.00 H TER 19753 WAT 7518 ATOM 19753 O WAT 7519 105.884 11.512 98.231 1.00 0.00 O ATOM 19754 H1 WAT 7519 106.481 10.772 98.342 1.00 0.00 H ATOM 19755 H2 WAT 7519 106.454 12.281 98.222 1.00 0.00 H TER 19757 WAT 7519 ATOM 19757 O WAT 7520 114.961 12.436 62.235 1.00 0.00 O ATOM 19758 H1 WAT 7520 114.193 12.695 62.743 1.00 0.00 H ATOM 19759 H2 WAT 7520 115.615 12.201 62.893 1.00 0.00 H TER 19761 WAT 7520 ATOM 19761 O WAT 7521 48.419 145.125 58.465 1.00 0.00 O ATOM 19762 H1 WAT 7521 49.011 145.004 57.722 1.00 0.00 H ATOM 19763 H2 WAT 7521 47.575 145.336 58.066 1.00 0.00 H TER 19765 WAT 7521 ATOM 19765 O WAT 7522 143.922 111.848 93.064 1.00 0.00 O ATOM 19766 H1 WAT 7522 143.160 112.417 93.174 1.00 0.00 H ATOM 19767 H2 WAT 7522 144.652 112.356 93.418 1.00 0.00 H TER 19769 WAT 7522 ATOM 19769 O WAT 7523 28.172 91.358 98.935 1.00 0.00 O ATOM 19770 H1 WAT 7523 28.113 91.534 97.996 1.00 0.00 H ATOM 19771 H2 WAT 7523 27.749 92.112 99.347 1.00 0.00 H TER 19773 WAT 7523 ATOM 19773 O WAT 7524 19.376 22.552 26.875 1.00 0.00 O ATOM 19774 H1 WAT 7524 20.208 22.714 26.430 1.00 0.00 H ATOM 19775 H2 WAT 7524 19.392 23.136 27.633 1.00 0.00 H TER 19777 WAT 7524 ATOM 19777 O WAT 7525 106.556 41.754 114.056 1.00 0.00 O ATOM 19778 H1 WAT 7525 107.123 42.057 113.347 1.00 0.00 H ATOM 19779 H2 WAT 7525 106.793 40.835 114.175 1.00 0.00 H TER 19781 WAT 7525 ATOM 19781 O WAT 7526 141.347 38.687 148.441 1.00 0.00 O ATOM 19782 H1 WAT 7526 141.272 39.071 147.567 1.00 0.00 H ATOM 19783 H2 WAT 7526 141.329 37.742 148.289 1.00 0.00 H TER 19785 WAT 7526 ATOM 19785 O WAT 7527 106.099 37.055 112.132 1.00 0.00 O ATOM 19786 H1 WAT 7527 106.697 36.330 112.306 1.00 0.00 H ATOM 19787 H2 WAT 7527 105.315 36.847 112.641 1.00 0.00 H TER 19789 WAT 7527 ATOM 19789 O WAT 7528 78.721 74.425 3.006 1.00 0.00 O ATOM 19790 H1 WAT 7528 77.878 74.117 2.672 1.00 0.00 H ATOM 19791 H2 WAT 7528 79.309 73.678 2.896 1.00 0.00 H TER 19793 WAT 7528 ATOM 19793 O WAT 7529 0.857 50.843 3.920 1.00 0.00 O ATOM 19794 H1 WAT 7529 1.190 50.247 3.249 1.00 0.00 H ATOM 19795 H2 WAT 7529 1.367 50.633 4.702 1.00 0.00 H TER 19797 WAT 7529 ATOM 19797 O WAT 7530 132.929 78.839 75.900 1.00 0.00 O ATOM 19798 H1 WAT 7530 132.320 78.452 75.270 1.00 0.00 H ATOM 19799 H2 WAT 7530 133.796 78.657 75.538 1.00 0.00 H TER 19801 WAT 7530 ATOM 19801 O WAT 7531 64.013 110.776 147.852 1.00 0.00 O ATOM 19802 H1 WAT 7531 64.325 111.359 148.544 1.00 0.00 H ATOM 19803 H2 WAT 7531 64.784 110.267 147.601 1.00 0.00 H TER 19805 WAT 7531 ATOM 19805 O WAT 7532 131.025 82.192 128.679 1.00 0.00 O ATOM 19806 H1 WAT 7532 130.871 83.065 128.317 1.00 0.00 H ATOM 19807 H2 WAT 7532 130.679 82.237 129.570 1.00 0.00 H TER 19809 WAT 7532 ATOM 19809 O WAT 7533 130.846 144.874 126.574 1.00 0.00 O ATOM 19810 H1 WAT 7533 131.661 144.827 126.073 1.00 0.00 H ATOM 19811 H2 WAT 7533 130.274 145.434 126.048 1.00 0.00 H TER 19813 WAT 7533 ATOM 19813 O WAT 7534 48.295 30.111 130.256 1.00 0.00 O ATOM 19814 H1 WAT 7534 48.025 30.958 129.899 1.00 0.00 H ATOM 19815 H2 WAT 7534 49.249 30.164 130.304 1.00 0.00 H TER 19817 WAT 7534 ATOM 19817 O WAT 7535 120.431 54.363 113.059 1.00 0.00 O ATOM 19818 H1 WAT 7535 121.368 54.447 113.234 1.00 0.00 H ATOM 19819 H2 WAT 7535 120.302 54.808 112.222 1.00 0.00 H TER 19821 WAT 7535 ATOM 19821 O WAT 7536 111.778 56.942 131.270 1.00 0.00 O ATOM 19822 H1 WAT 7536 111.736 57.577 130.555 1.00 0.00 H ATOM 19823 H2 WAT 7536 112.548 56.410 131.074 1.00 0.00 H TER 19825 WAT 7536 ATOM 19825 O WAT 7537 93.264 54.472 131.641 1.00 0.00 O ATOM 19826 H1 WAT 7537 92.647 53.829 131.291 1.00 0.00 H ATOM 19827 H2 WAT 7537 93.404 55.085 130.919 1.00 0.00 H TER 19829 WAT 7537 ATOM 19829 O WAT 7538 108.634 22.832 145.534 1.00 0.00 O ATOM 19830 H1 WAT 7538 108.133 23.193 146.266 1.00 0.00 H ATOM 19831 H2 WAT 7538 108.311 21.936 145.442 1.00 0.00 H TER 19833 WAT 7538 ATOM 19833 O WAT 7539 87.478 75.070 75.196 1.00 0.00 O ATOM 19834 H1 WAT 7539 88.391 75.163 75.466 1.00 0.00 H ATOM 19835 H2 WAT 7539 86.994 74.973 76.016 1.00 0.00 H TER 19837 WAT 7539 ATOM 19837 O WAT 7540 127.678 18.796 75.602 1.00 0.00 O ATOM 19838 H1 WAT 7540 128.096 19.417 75.005 1.00 0.00 H ATOM 19839 H2 WAT 7540 128.397 18.455 76.134 1.00 0.00 H TER 19841 WAT 7540 ATOM 19841 O WAT 7541 9.489 65.751 145.901 1.00 0.00 O ATOM 19842 H1 WAT 7541 8.883 65.803 145.163 1.00 0.00 H ATOM 19843 H2 WAT 7541 9.388 66.588 146.354 1.00 0.00 H TER 19845 WAT 7541 ATOM 19845 O WAT 7542 88.434 47.496 150.982 1.00 0.00 O ATOM 19846 H1 WAT 7542 88.867 47.634 150.139 1.00 0.00 H ATOM 19847 H2 WAT 7542 88.275 48.378 151.317 1.00 0.00 H TER 19849 WAT 7542 ATOM 19849 O WAT 7543 89.717 118.783 2.391 1.00 0.00 O ATOM 19850 H1 WAT 7543 90.481 118.759 2.967 1.00 0.00 H ATOM 19851 H2 WAT 7543 88.977 118.583 2.965 1.00 0.00 H TER 19853 WAT 7543 ATOM 19853 O WAT 7544 83.063 17.837 6.070 1.00 0.00 O ATOM 19854 H1 WAT 7544 83.083 17.329 6.881 1.00 0.00 H ATOM 19855 H2 WAT 7544 83.477 18.670 6.299 1.00 0.00 H TER 19857 WAT 7544 ATOM 19857 O WAT 7545 137.747 54.309 151.290 1.00 0.00 O ATOM 19858 H1 WAT 7545 136.812 54.213 151.108 1.00 0.00 H ATOM 19859 H2 WAT 7545 137.961 55.191 150.983 1.00 0.00 H TER 19861 WAT 7545 ATOM 19861 O WAT 7546 25.706 108.041 89.263 1.00 0.00 O ATOM 19862 H1 WAT 7546 26.585 107.662 89.236 1.00 0.00 H ATOM 19863 H2 WAT 7546 25.135 107.345 88.938 1.00 0.00 H TER 19865 WAT 7546 ATOM 19865 O WAT 7547 92.559 92.840 82.681 1.00 0.00 O ATOM 19866 H1 WAT 7547 93.209 92.913 83.380 1.00 0.00 H ATOM 19867 H2 WAT 7547 92.722 91.981 82.291 1.00 0.00 H TER 19869 WAT 7547 ATOM 19869 O WAT 7548 36.110 90.831 112.609 1.00 0.00 O ATOM 19870 H1 WAT 7548 35.721 90.008 112.313 1.00 0.00 H ATOM 19871 H2 WAT 7548 35.377 91.445 112.643 1.00 0.00 H TER 19873 WAT 7548 ATOM 19873 O WAT 7549 29.275 46.118 0.676 1.00 0.00 O ATOM 19874 H1 WAT 7549 29.958 46.505 1.223 1.00 0.00 H ATOM 19875 H2 WAT 7549 29.753 45.629 0.006 1.00 0.00 H TER 19877 WAT 7549 ATOM 19877 O WAT 7550 60.130 14.172 105.863 1.00 0.00 O ATOM 19878 H1 WAT 7550 59.890 14.804 105.185 1.00 0.00 H ATOM 19879 H2 WAT 7550 59.673 14.476 106.647 1.00 0.00 H TER 19881 WAT 7550 ATOM 19881 O WAT 7551 114.456 84.633 119.751 1.00 0.00 O ATOM 19882 H1 WAT 7551 114.631 84.855 118.837 1.00 0.00 H ATOM 19883 H2 WAT 7551 114.290 85.476 120.174 1.00 0.00 H TER 19885 WAT 7551 ATOM 19885 O WAT 7552 37.194 134.103 130.228 1.00 0.00 O ATOM 19886 H1 WAT 7552 38.105 134.384 130.137 1.00 0.00 H ATOM 19887 H2 WAT 7552 36.838 134.154 129.341 1.00 0.00 H TER 19889 WAT 7552 ATOM 19889 O WAT 7553 97.775 49.191 121.638 1.00 0.00 O ATOM 19890 H1 WAT 7553 96.916 49.206 122.059 1.00 0.00 H ATOM 19891 H2 WAT 7553 97.612 48.812 120.774 1.00 0.00 H TER 19893 WAT 7553 ATOM 19893 O WAT 7554 0.872 145.558 111.532 1.00 0.00 O ATOM 19894 H1 WAT 7554 0.380 146.103 112.146 1.00 0.00 H ATOM 19895 H2 WAT 7554 0.909 144.698 111.951 1.00 0.00 H TER 19897 WAT 7554 ATOM 19897 O WAT 7555 138.621 144.834 0.694 1.00 0.00 O ATOM 19898 H1 WAT 7555 137.886 145.428 0.848 1.00 0.00 H ATOM 19899 H2 WAT 7555 138.401 144.386 -0.122 1.00 0.00 H TER 19901 WAT 7555 ATOM 19901 O WAT 7556 80.413 63.829 153.577 1.00 0.00 O ATOM 19902 H1 WAT 7556 80.237 64.289 152.755 1.00 0.00 H ATOM 19903 H2 WAT 7556 79.710 63.183 153.645 1.00 0.00 H TER 19905 WAT 7556 ATOM 19905 O WAT 7557 46.502 51.980 56.027 1.00 0.00 O ATOM 19906 H1 WAT 7557 47.180 52.099 56.692 1.00 0.00 H ATOM 19907 H2 WAT 7557 45.682 51.966 56.521 1.00 0.00 H TER 19909 WAT 7557 ATOM 19909 O WAT 7558 102.331 4.401 115.102 1.00 0.00 O ATOM 19910 H1 WAT 7558 102.603 5.000 114.407 1.00 0.00 H ATOM 19911 H2 WAT 7558 101.607 3.904 114.721 1.00 0.00 H TER 19913 WAT 7558 ATOM 19913 O WAT 7559 29.010 121.889 142.440 1.00 0.00 O ATOM 19914 H1 WAT 7559 28.394 122.061 141.728 1.00 0.00 H ATOM 19915 H2 WAT 7559 29.024 120.935 142.521 1.00 0.00 H TER 19917 WAT 7559 ATOM 19917 O WAT 7560 79.626 62.717 12.301 1.00 0.00 O ATOM 19918 H1 WAT 7560 79.437 62.569 13.227 1.00 0.00 H ATOM 19919 H2 WAT 7560 80.564 62.908 12.275 1.00 0.00 H TER 19921 WAT 7560 ATOM 19921 O WAT 7561 116.268 5.380 94.614 1.00 0.00 O ATOM 19922 H1 WAT 7561 115.817 4.726 95.149 1.00 0.00 H ATOM 19923 H2 WAT 7561 117.173 5.361 94.925 1.00 0.00 H TER 19925 WAT 7561 ATOM 19925 O WAT 7562 114.491 89.429 112.335 1.00 0.00 O ATOM 19926 H1 WAT 7562 114.675 89.460 111.397 1.00 0.00 H ATOM 19927 H2 WAT 7562 115.011 88.693 112.658 1.00 0.00 H TER 19929 WAT 7562 ATOM 19929 O WAT 7563 54.388 144.347 115.900 1.00 0.00 O ATOM 19930 H1 WAT 7563 55.021 144.140 115.212 1.00 0.00 H ATOM 19931 H2 WAT 7563 54.787 145.070 116.383 1.00 0.00 H TER 19933 WAT 7563 ATOM 19933 O WAT 7564 54.540 39.910 3.533 1.00 0.00 O ATOM 19934 H1 WAT 7564 55.277 39.357 3.792 1.00 0.00 H ATOM 19935 H2 WAT 7564 54.513 40.599 4.197 1.00 0.00 H TER 19937 WAT 7564 ATOM 19937 O WAT 7565 16.394 20.755 102.399 1.00 0.00 O ATOM 19938 H1 WAT 7565 15.484 21.039 102.477 1.00 0.00 H ATOM 19939 H2 WAT 7565 16.748 20.839 103.285 1.00 0.00 H TER 19941 WAT 7565 ATOM 19941 O WAT 7566 14.254 76.849 102.642 1.00 0.00 O ATOM 19942 H1 WAT 7566 14.295 77.338 103.464 1.00 0.00 H ATOM 19943 H2 WAT 7566 13.582 77.298 102.130 1.00 0.00 H TER 19945 WAT 7566 ATOM 19945 O WAT 7567 109.757 23.925 116.408 1.00 0.00 O ATOM 19946 H1 WAT 7567 110.358 23.429 116.963 1.00 0.00 H ATOM 19947 H2 WAT 7567 109.515 24.686 116.936 1.00 0.00 H TER 19949 WAT 7567 ATOM 19949 O WAT 7568 12.602 141.793 97.679 1.00 0.00 O ATOM 19950 H1 WAT 7568 12.239 141.862 98.562 1.00 0.00 H ATOM 19951 H2 WAT 7568 13.216 141.060 97.729 1.00 0.00 H TER 19953 WAT 7568 ATOM 19953 O WAT 7569 70.258 94.893 6.746 1.00 0.00 O ATOM 19954 H1 WAT 7569 71.008 95.177 7.269 1.00 0.00 H ATOM 19955 H2 WAT 7569 69.758 95.695 6.589 1.00 0.00 H TER 19957 WAT 7569 ATOM 19957 O WAT 7570 129.320 79.900 120.459 1.00 0.00 O ATOM 19958 H1 WAT 7570 130.125 79.530 120.096 1.00 0.00 H ATOM 19959 H2 WAT 7570 128.934 79.184 120.963 1.00 0.00 H TER 19961 WAT 7570 ATOM 19961 O WAT 7571 47.071 65.630 55.194 1.00 0.00 O ATOM 19962 H1 WAT 7571 46.843 65.038 55.911 1.00 0.00 H ATOM 19963 H2 WAT 7571 46.246 66.059 54.967 1.00 0.00 H TER 19965 WAT 7571 ATOM 19965 O WAT 7572 57.740 64.406 73.613 1.00 0.00 O ATOM 19966 H1 WAT 7572 58.044 65.100 74.198 1.00 0.00 H ATOM 19967 H2 WAT 7572 56.922 64.102 74.006 1.00 0.00 H TER 19969 WAT 7572 ATOM 19969 O WAT 7573 138.250 93.541 92.177 1.00 0.00 O ATOM 19970 H1 WAT 7573 137.824 94.345 92.472 1.00 0.00 H ATOM 19971 H2 WAT 7573 137.668 93.196 91.499 1.00 0.00 H TER 19973 WAT 7573 ATOM 19973 O WAT 7574 107.871 84.632 99.142 1.00 0.00 O ATOM 19974 H1 WAT 7574 107.106 85.202 99.218 1.00 0.00 H ATOM 19975 H2 WAT 7574 107.508 83.747 99.109 1.00 0.00 H TER 19977 WAT 7574 ATOM 19977 O WAT 7575 95.083 44.983 124.502 1.00 0.00 O ATOM 19978 H1 WAT 7575 94.745 44.141 124.809 1.00 0.00 H ATOM 19979 H2 WAT 7575 95.921 44.769 124.092 1.00 0.00 H TER 19981 WAT 7575 ATOM 19981 O WAT 7576 106.564 76.361 2.732 1.00 0.00 O ATOM 19982 H1 WAT 7576 106.325 76.628 1.845 1.00 0.00 H ATOM 19983 H2 WAT 7576 106.553 75.404 2.706 1.00 0.00 H TER 19985 WAT 7576 ATOM 19985 O WAT 7577 49.973 59.824 18.146 1.00 0.00 O ATOM 19986 H1 WAT 7577 49.988 60.272 18.992 1.00 0.00 H ATOM 19987 H2 WAT 7577 50.676 60.236 17.645 1.00 0.00 H TER 19989 WAT 7577 ATOM 19989 O WAT 7578 81.541 69.087 12.114 1.00 0.00 O ATOM 19990 H1 WAT 7578 81.977 69.697 11.518 1.00 0.00 H ATOM 19991 H2 WAT 7578 81.067 69.648 12.727 1.00 0.00 H TER 19993 WAT 7578 ATOM 19993 O WAT 7579 27.140 33.568 0.525 1.00 0.00 O ATOM 19994 H1 WAT 7579 27.886 33.879 0.013 1.00 0.00 H ATOM 19995 H2 WAT 7579 26.455 33.407 -0.124 1.00 0.00 H TER 19997 WAT 7579 ATOM 19997 O WAT 7580 110.753 131.320 96.852 1.00 0.00 O ATOM 19998 H1 WAT 7580 110.687 131.647 97.750 1.00 0.00 H ATOM 19999 H2 WAT 7580 111.486 130.705 96.875 1.00 0.00 H TER 20001 WAT 7580 ATOM 20001 O WAT 7581 105.082 96.170 147.212 1.00 0.00 O ATOM 20002 H1 WAT 7581 104.348 96.719 147.489 1.00 0.00 H ATOM 20003 H2 WAT 7581 104.719 95.615 146.522 1.00 0.00 H TER 20005 WAT 7581 ATOM 20005 O WAT 7582 21.655 30.313 151.782 1.00 0.00 O ATOM 20006 H1 WAT 7582 22.585 30.405 151.990 1.00 0.00 H ATOM 20007 H2 WAT 7582 21.527 30.860 151.007 1.00 0.00 H TER 20009 WAT 7582 ATOM 20009 O WAT 7583 107.567 53.473 61.034 1.00 0.00 O ATOM 20010 H1 WAT 7583 108.267 54.104 61.202 1.00 0.00 H ATOM 20011 H2 WAT 7583 107.483 53.456 60.081 1.00 0.00 H TER 20013 WAT 7583 ATOM 20013 O WAT 7584 14.389 116.821 127.604 1.00 0.00 O ATOM 20014 H1 WAT 7584 14.307 116.012 128.109 1.00 0.00 H ATOM 20015 H2 WAT 7584 13.498 117.170 127.566 1.00 0.00 H TER 20017 WAT 7584 ATOM 20017 O WAT 7585 101.248 95.829 79.006 1.00 0.00 O ATOM 20018 H1 WAT 7585 100.904 94.945 79.134 1.00 0.00 H ATOM 20019 H2 WAT 7585 101.818 95.756 78.241 1.00 0.00 H TER 20021 WAT 7585 ATOM 20021 O WAT 7586 77.465 60.310 64.390 1.00 0.00 O ATOM 20022 H1 WAT 7586 77.498 59.449 63.973 1.00 0.00 H ATOM 20023 H2 WAT 7586 78.349 60.662 64.283 1.00 0.00 H TER 20025 WAT 7586 ATOM 20025 O WAT 7587 86.773 143.347 78.963 1.00 0.00 O ATOM 20026 H1 WAT 7587 87.286 143.946 78.420 1.00 0.00 H ATOM 20027 H2 WAT 7587 85.934 143.271 78.509 1.00 0.00 H TER 20029 WAT 7587 ATOM 20029 O WAT 7588 120.467 108.983 6.450 1.00 0.00 O ATOM 20030 H1 WAT 7588 120.414 109.141 5.507 1.00 0.00 H ATOM 20031 H2 WAT 7588 119.840 109.597 6.831 1.00 0.00 H TER 20033 WAT 7588 ATOM 20033 O WAT 7589 58.321 117.238 10.037 1.00 0.00 O ATOM 20034 H1 WAT 7589 59.161 117.562 10.362 1.00 0.00 H ATOM 20035 H2 WAT 7589 58.486 116.321 9.820 1.00 0.00 H TER 20037 WAT 7589 ATOM 20037 O WAT 7590 22.933 67.010 14.700 1.00 0.00 O ATOM 20038 H1 WAT 7590 23.072 66.093 14.937 1.00 0.00 H ATOM 20039 H2 WAT 7590 22.612 67.419 15.504 1.00 0.00 H TER 20041 WAT 7590 ATOM 20041 O WAT 7591 19.518 39.836 89.948 1.00 0.00 O ATOM 20042 H1 WAT 7591 19.311 38.913 89.798 1.00 0.00 H ATOM 20043 H2 WAT 7591 19.440 40.243 89.085 1.00 0.00 H TER 20045 WAT 7591 ATOM 20045 O WAT 7592 111.286 90.868 52.815 1.00 0.00 O ATOM 20046 H1 WAT 7592 112.131 90.756 53.250 1.00 0.00 H ATOM 20047 H2 WAT 7592 110.787 91.433 53.404 1.00 0.00 H TER 20049 WAT 7592 ATOM 20049 O WAT 7593 122.272 33.036 141.165 1.00 0.00 O ATOM 20050 H1 WAT 7593 121.541 33.512 140.771 1.00 0.00 H ATOM 20051 H2 WAT 7593 122.857 33.720 141.489 1.00 0.00 H TER 20053 WAT 7593 ATOM 20053 O WAT 7594 136.058 129.473 82.600 1.00 0.00 O ATOM 20054 H1 WAT 7594 136.717 128.814 82.814 1.00 0.00 H ATOM 20055 H2 WAT 7594 135.278 128.967 82.371 1.00 0.00 H TER 20057 WAT 7594 ATOM 20057 O WAT 7595 111.212 95.516 73.348 1.00 0.00 O ATOM 20058 H1 WAT 7595 112.142 95.674 73.189 1.00 0.00 H ATOM 20059 H2 WAT 7595 110.807 95.570 72.483 1.00 0.00 H TER 20061 WAT 7595 ATOM 20061 O WAT 7596 124.197 48.409 137.473 1.00 0.00 O ATOM 20062 H1 WAT 7596 124.578 49.127 137.977 1.00 0.00 H ATOM 20063 H2 WAT 7596 124.735 48.359 136.683 1.00 0.00 H TER 20065 WAT 7596 ATOM 20065 O WAT 7597 114.946 85.719 79.395 1.00 0.00 O ATOM 20066 H1 WAT 7597 115.261 86.531 78.998 1.00 0.00 H ATOM 20067 H2 WAT 7597 115.202 85.035 78.776 1.00 0.00 H TER 20069 WAT 7597 ATOM 20069 O WAT 7598 87.875 13.826 123.875 1.00 0.00 O ATOM 20070 H1 WAT 7598 87.025 13.532 124.201 1.00 0.00 H ATOM 20071 H2 WAT 7598 88.471 13.699 124.613 1.00 0.00 H TER 20073 WAT 7598 ATOM 20073 O WAT 7599 120.252 106.629 76.032 1.00 0.00 O ATOM 20074 H1 WAT 7599 121.061 106.978 75.658 1.00 0.00 H ATOM 20075 H2 WAT 7599 119.623 106.659 75.311 1.00 0.00 H TER 20077 WAT 7599 ATOM 20077 O WAT 7600 121.876 112.466 103.592 1.00 0.00 O ATOM 20078 H1 WAT 7600 122.372 112.724 104.369 1.00 0.00 H ATOM 20079 H2 WAT 7600 122.541 112.333 102.917 1.00 0.00 H TER 20081 WAT 7600 ATOM 20081 O WAT 7601 134.280 28.100 129.461 1.00 0.00 O ATOM 20082 H1 WAT 7601 133.857 27.450 130.022 1.00 0.00 H ATOM 20083 H2 WAT 7601 134.005 28.943 129.821 1.00 0.00 H TER 20085 WAT 7601 ATOM 20085 O WAT 7602 12.913 62.977 156.997 1.00 0.00 O ATOM 20086 H1 WAT 7602 13.240 62.376 157.666 1.00 0.00 H ATOM 20087 H2 WAT 7602 12.047 62.637 156.772 1.00 0.00 H TER 20089 WAT 7602 ATOM 20089 O WAT 7603 119.025 94.888 102.372 1.00 0.00 O ATOM 20090 H1 WAT 7603 119.934 95.143 102.216 1.00 0.00 H ATOM 20091 H2 WAT 7603 119.034 93.931 102.327 1.00 0.00 H TER 20093 WAT 7603 ATOM 20093 O WAT 7604 51.399 51.292 141.812 1.00 0.00 O ATOM 20094 H1 WAT 7604 51.253 52.238 141.800 1.00 0.00 H ATOM 20095 H2 WAT 7604 52.281 51.191 142.170 1.00 0.00 H TER 20097 WAT 7604 ATOM 20097 O WAT 7605 92.105 100.382 0.163 1.00 0.00 O ATOM 20098 H1 WAT 7605 92.850 100.321 0.761 1.00 0.00 H ATOM 20099 H2 WAT 7605 91.699 99.516 0.197 1.00 0.00 H TER 20101 WAT 7605 ATOM 20101 O WAT 7606 22.959 117.378 98.717 1.00 0.00 O ATOM 20102 H1 WAT 7606 23.287 116.479 98.729 1.00 0.00 H ATOM 20103 H2 WAT 7606 22.622 117.521 99.601 1.00 0.00 H TER 20105 WAT 7606 ATOM 20105 O WAT 7607 38.951 45.997 91.119 1.00 0.00 O ATOM 20106 H1 WAT 7607 38.325 45.275 91.062 1.00 0.00 H ATOM 20107 H2 WAT 7607 39.396 45.996 90.272 1.00 0.00 H TER 20109 WAT 7607 ATOM 20109 O WAT 7608 77.935 40.144 109.995 1.00 0.00 O ATOM 20110 H1 WAT 7608 78.400 40.671 110.645 1.00 0.00 H ATOM 20111 H2 WAT 7608 77.662 40.774 109.327 1.00 0.00 H TER 20113 WAT 7608 ATOM 20113 O WAT 7609 18.050 66.432 154.892 1.00 0.00 O ATOM 20114 H1 WAT 7609 17.111 66.278 155.000 1.00 0.00 H ATOM 20115 H2 WAT 7609 18.465 65.814 155.494 1.00 0.00 H TER 20117 WAT 7609 ATOM 20117 O WAT 7610 59.402 59.252 109.231 1.00 0.00 O ATOM 20118 H1 WAT 7610 59.094 59.889 109.876 1.00 0.00 H ATOM 20119 H2 WAT 7610 59.881 59.774 108.588 1.00 0.00 H TER 20121 WAT 7610 ATOM 20121 O WAT 7611 110.839 68.226 0.784 1.00 0.00 O ATOM 20122 H1 WAT 7611 110.320 67.659 1.354 1.00 0.00 H ATOM 20123 H2 WAT 7611 110.990 67.702 -0.003 1.00 0.00 H TER 20125 WAT 7611 ATOM 20125 O WAT 7612 4.170 76.856 80.984 1.00 0.00 O ATOM 20126 H1 WAT 7612 4.214 77.265 81.849 1.00 0.00 H ATOM 20127 H2 WAT 7612 3.240 76.870 80.760 1.00 0.00 H TER 20129 WAT 7612 ATOM 20129 O WAT 7613 59.393 85.975 153.961 1.00 0.00 O ATOM 20130 H1 WAT 7613 59.325 86.713 153.355 1.00 0.00 H ATOM 20131 H2 WAT 7613 59.315 86.370 154.829 1.00 0.00 H TER 20133 WAT 7613 ATOM 20133 O WAT 7614 33.927 24.010 17.590 1.00 0.00 O ATOM 20134 H1 WAT 7614 33.400 23.743 18.343 1.00 0.00 H ATOM 20135 H2 WAT 7614 34.550 24.644 17.946 1.00 0.00 H TER 20137 WAT 7614 ATOM 20137 O WAT 7615 122.851 24.455 71.167 1.00 0.00 O ATOM 20138 H1 WAT 7615 122.355 23.642 71.069 1.00 0.00 H ATOM 20139 H2 WAT 7615 122.833 24.635 72.107 1.00 0.00 H TER 20141 WAT 7615 ATOM 20141 O WAT 7616 44.024 96.959 111.598 1.00 0.00 O ATOM 20142 H1 WAT 7616 43.068 97.002 111.579 1.00 0.00 H ATOM 20143 H2 WAT 7616 44.298 97.836 111.864 1.00 0.00 H TER 20145 WAT 7616 ATOM 20145 O WAT 7617 99.680 13.103 67.962 1.00 0.00 O ATOM 20146 H1 WAT 7617 99.810 12.972 68.901 1.00 0.00 H ATOM 20147 H2 WAT 7617 99.224 12.313 67.671 1.00 0.00 H TER 20149 WAT 7617 ATOM 20149 O WAT 7618 100.723 1.413 65.665 1.00 0.00 O ATOM 20150 H1 WAT 7618 99.990 1.207 66.244 1.00 0.00 H ATOM 20151 H2 WAT 7618 100.418 2.159 65.148 1.00 0.00 H TER 20153 WAT 7618 ATOM 20153 O WAT 7619 125.820 15.416 8.589 1.00 0.00 O ATOM 20154 H1 WAT 7619 125.426 16.253 8.832 1.00 0.00 H ATOM 20155 H2 WAT 7619 125.114 14.934 8.158 1.00 0.00 H TER 20157 WAT 7619 ATOM 20157 O WAT 7620 8.039 56.527 9.033 1.00 0.00 O ATOM 20158 H1 WAT 7620 8.440 55.929 8.403 1.00 0.00 H ATOM 20159 H2 WAT 7620 8.708 56.650 9.707 1.00 0.00 H TER 20161 WAT 7620 ATOM 20161 O WAT 7621 107.073 100.472 7.765 1.00 0.00 O ATOM 20162 H1 WAT 7621 107.449 99.608 7.599 1.00 0.00 H ATOM 20163 H2 WAT 7621 106.910 100.485 8.709 1.00 0.00 H TER 20165 WAT 7621 ATOM 20165 O WAT 7622 136.685 8.995 22.329 1.00 0.00 O ATOM 20166 H1 WAT 7622 137.369 9.610 22.596 1.00 0.00 H ATOM 20167 H2 WAT 7622 136.783 8.927 21.379 1.00 0.00 H TER 20169 WAT 7622 ATOM 20169 O WAT 7623 73.449 20.800 111.832 1.00 0.00 O ATOM 20170 H1 WAT 7623 73.142 21.527 111.290 1.00 0.00 H ATOM 20171 H2 WAT 7623 72.649 20.387 112.155 1.00 0.00 H TER 20173 WAT 7623 ATOM 20173 O WAT 7624 139.610 111.437 3.661 1.00 0.00 O ATOM 20174 H1 WAT 7624 139.966 110.600 3.361 1.00 0.00 H ATOM 20175 H2 WAT 7624 140.307 111.815 4.197 1.00 0.00 H TER 20177 WAT 7624 ATOM 20177 O WAT 7625 40.414 11.290 148.217 1.00 0.00 O ATOM 20178 H1 WAT 7625 40.097 12.046 147.724 1.00 0.00 H ATOM 20179 H2 WAT 7625 41.159 11.624 148.717 1.00 0.00 H TER 20181 WAT 7625 ATOM 20181 O WAT 7626 32.469 86.739 99.064 1.00 0.00 O ATOM 20182 H1 WAT 7626 31.957 86.587 98.269 1.00 0.00 H ATOM 20183 H2 WAT 7626 32.241 86.008 99.638 1.00 0.00 H TER 20185 WAT 7626 ATOM 20185 O WAT 7627 130.337 45.634 142.583 1.00 0.00 O ATOM 20186 H1 WAT 7627 129.932 44.951 143.118 1.00 0.00 H ATOM 20187 H2 WAT 7627 130.001 45.477 141.700 1.00 0.00 H TER 20189 WAT 7627 ATOM 20189 O WAT 7628 65.410 25.728 11.247 1.00 0.00 O ATOM 20190 H1 WAT 7628 66.011 25.704 10.503 1.00 0.00 H ATOM 20191 H2 WAT 7628 65.185 24.811 11.404 1.00 0.00 H TER 20193 WAT 7628 ATOM 20193 O WAT 7629 40.503 47.024 123.103 1.00 0.00 O ATOM 20194 H1 WAT 7629 40.947 47.214 122.277 1.00 0.00 H ATOM 20195 H2 WAT 7629 40.481 46.068 123.148 1.00 0.00 H TER 20197 WAT 7629 ATOM 20197 O WAT 7630 77.210 135.094 151.156 1.00 0.00 O ATOM 20198 H1 WAT 7630 76.597 134.580 150.630 1.00 0.00 H ATOM 20199 H2 WAT 7630 76.665 135.754 151.584 1.00 0.00 H TER 20201 WAT 7630 ATOM 20201 O WAT 7631 42.482 84.872 18.505 1.00 0.00 O ATOM 20202 H1 WAT 7631 41.992 84.990 19.318 1.00 0.00 H ATOM 20203 H2 WAT 7631 42.983 85.681 18.407 1.00 0.00 H TER 20205 WAT 7631 ATOM 20205 O WAT 7632 44.096 87.919 61.487 1.00 0.00 O ATOM 20206 H1 WAT 7632 44.527 88.353 60.751 1.00 0.00 H ATOM 20207 H2 WAT 7632 44.789 87.803 62.137 1.00 0.00 H TER 20209 WAT 7632 ATOM 20209 O WAT 7633 112.220 143.484 66.158 1.00 0.00 O ATOM 20210 H1 WAT 7633 112.627 142.920 65.500 1.00 0.00 H ATOM 20211 H2 WAT 7633 112.867 143.537 66.861 1.00 0.00 H TER 20213 WAT 7633 ATOM 20213 O WAT 7634 3.539 144.493 63.141 1.00 0.00 O ATOM 20214 H1 WAT 7634 3.928 145.207 63.647 1.00 0.00 H ATOM 20215 H2 WAT 7634 2.972 144.930 62.506 1.00 0.00 H TER 20217 WAT 7634 ATOM 20217 O WAT 7635 6.392 60.337 70.466 1.00 0.00 O ATOM 20218 H1 WAT 7635 5.898 59.731 69.914 1.00 0.00 H ATOM 20219 H2 WAT 7635 6.768 60.967 69.852 1.00 0.00 H TER 20221 WAT 7635 ATOM 20221 O WAT 7636 81.529 41.838 79.679 1.00 0.00 O ATOM 20222 H1 WAT 7636 81.083 41.045 79.975 1.00 0.00 H ATOM 20223 H2 WAT 7636 82.347 41.852 80.176 1.00 0.00 H TER 20225 WAT 7636 ATOM 20225 O WAT 7637 44.472 16.048 69.619 1.00 0.00 O ATOM 20226 H1 WAT 7637 44.373 16.096 68.668 1.00 0.00 H ATOM 20227 H2 WAT 7637 45.284 16.521 69.800 1.00 0.00 H TER 20229 WAT 7637 ATOM 20229 O WAT 7638 62.259 19.521 126.955 1.00 0.00 O ATOM 20230 H1 WAT 7638 62.974 18.967 126.644 1.00 0.00 H ATOM 20231 H2 WAT 7638 62.636 20.400 126.993 1.00 0.00 H TER 20233 WAT 7638 ATOM 20233 O WAT 7639 89.967 107.847 15.438 1.00 0.00 O ATOM 20234 H1 WAT 7639 89.488 107.057 15.187 1.00 0.00 H ATOM 20235 H2 WAT 7639 89.519 108.158 16.225 1.00 0.00 H TER 20237 WAT 7639 ATOM 20237 O WAT 7640 16.041 11.783 83.815 1.00 0.00 O ATOM 20238 H1 WAT 7640 16.657 11.742 84.546 1.00 0.00 H ATOM 20239 H2 WAT 7640 15.983 10.882 83.499 1.00 0.00 H TER 20241 WAT 7640 ATOM 20241 O WAT 7641 142.423 6.078 5.151 1.00 0.00 O ATOM 20242 H1 WAT 7641 142.838 5.235 5.334 1.00 0.00 H ATOM 20243 H2 WAT 7641 142.118 6.385 6.005 1.00 0.00 H TER 20245 WAT 7641 ATOM 20245 O WAT 7642 26.462 132.915 111.946 1.00 0.00 O ATOM 20246 H1 WAT 7642 25.592 132.568 111.748 1.00 0.00 H ATOM 20247 H2 WAT 7642 27.060 132.367 111.437 1.00 0.00 H TER 20249 WAT 7642 ATOM 20249 O WAT 7643 126.453 36.153 73.092 1.00 0.00 O ATOM 20250 H1 WAT 7643 126.577 35.293 73.493 1.00 0.00 H ATOM 20251 H2 WAT 7643 126.512 36.769 73.822 1.00 0.00 H TER 20253 WAT 7643 ATOM 20253 O WAT 7644 141.330 99.561 17.928 1.00 0.00 O ATOM 20254 H1 WAT 7644 141.919 99.478 18.678 1.00 0.00 H ATOM 20255 H2 WAT 7644 140.452 99.490 18.303 1.00 0.00 H TER 20257 WAT 7644 ATOM 20257 O WAT 7645 77.870 26.636 74.230 1.00 0.00 O ATOM 20258 H1 WAT 7645 77.274 25.973 73.882 1.00 0.00 H ATOM 20259 H2 WAT 7645 78.731 26.219 74.208 1.00 0.00 H TER 20261 WAT 7645 ATOM 20261 O WAT 7646 144.015 43.160 116.871 1.00 0.00 O ATOM 20262 H1 WAT 7646 143.437 42.434 117.108 1.00 0.00 H ATOM 20263 H2 WAT 7646 143.459 43.756 116.370 1.00 0.00 H TER 20265 WAT 7646 ATOM 20265 O WAT 7647 61.848 123.498 112.930 1.00 0.00 O ATOM 20266 H1 WAT 7647 61.967 123.890 113.795 1.00 0.00 H ATOM 20267 H2 WAT 7647 60.998 123.823 112.634 1.00 0.00 H TER 20269 WAT 7647 ATOM 20269 O WAT 7648 60.711 9.713 117.516 1.00 0.00 O ATOM 20270 H1 WAT 7648 59.813 9.800 117.834 1.00 0.00 H ATOM 20271 H2 WAT 7648 60.798 8.786 117.293 1.00 0.00 H TER 20273 WAT 7648 ATOM 20273 O WAT 7649 145.548 100.684 88.475 1.00 0.00 O ATOM 20274 H1 WAT 7649 145.172 100.812 87.604 1.00 0.00 H ATOM 20275 H2 WAT 7649 145.259 101.448 88.975 1.00 0.00 H TER 20277 WAT 7649 ATOM 20277 O WAT 7650 54.509 110.298 84.754 1.00 0.00 O ATOM 20278 H1 WAT 7650 55.103 110.221 85.501 1.00 0.00 H ATOM 20279 H2 WAT 7650 54.605 111.205 84.464 1.00 0.00 H TER 20281 WAT 7650 ATOM 20281 O WAT 7651 52.236 78.661 157.148 1.00 0.00 O ATOM 20282 H1 WAT 7651 52.889 78.478 156.473 1.00 0.00 H ATOM 20283 H2 WAT 7651 52.341 77.952 157.782 1.00 0.00 H TER 20285 WAT 7651 ATOM 20285 O WAT 7652 101.026 80.028 128.851 1.00 0.00 O ATOM 20286 H1 WAT 7652 100.205 79.627 129.138 1.00 0.00 H ATOM 20287 H2 WAT 7652 101.473 79.336 128.364 1.00 0.00 H TER 20289 WAT 7652 ATOM 20289 O WAT 7653 25.714 48.960 0.587 1.00 0.00 O ATOM 20290 H1 WAT 7653 25.627 49.380 1.443 1.00 0.00 H ATOM 20291 H2 WAT 7653 26.037 48.081 0.784 1.00 0.00 H TER 20293 WAT 7653 ATOM 20293 O WAT 7654 105.981 129.679 111.452 1.00 0.00 O ATOM 20294 H1 WAT 7654 106.923 129.547 111.562 1.00 0.00 H ATOM 20295 H2 WAT 7654 105.869 130.629 111.468 1.00 0.00 H TER 20297 WAT 7654 ATOM 20297 O WAT 7655 145.647 54.203 137.966 1.00 0.00 O ATOM 20298 H1 WAT 7655 146.474 54.598 137.691 1.00 0.00 H ATOM 20299 H2 WAT 7655 145.371 53.678 137.214 1.00 0.00 H TER 20301 WAT 7655 ATOM 20301 O WAT 7656 1.732 6.063 107.407 1.00 0.00 O ATOM 20302 H1 WAT 7656 1.027 6.626 107.726 1.00 0.00 H ATOM 20303 H2 WAT 7656 1.302 5.460 106.801 1.00 0.00 H TER 20305 WAT 7656 ATOM 20305 O WAT 7657 87.440 49.008 99.846 1.00 0.00 O ATOM 20306 H1 WAT 7657 87.504 48.621 98.973 1.00 0.00 H ATOM 20307 H2 WAT 7657 86.933 48.373 100.353 1.00 0.00 H TER 20309 WAT 7657 ATOM 20309 O WAT 7658 18.246 52.256 100.938 1.00 0.00 O ATOM 20310 H1 WAT 7658 18.625 52.875 101.563 1.00 0.00 H ATOM 20311 H2 WAT 7658 17.367 52.595 100.768 1.00 0.00 H TER 20313 WAT 7658 ATOM 20313 O WAT 7659 108.012 46.822 72.268 1.00 0.00 O ATOM 20314 H1 WAT 7659 107.735 47.546 71.706 1.00 0.00 H ATOM 20315 H2 WAT 7659 107.408 46.851 73.010 1.00 0.00 H TER 20317 WAT 7659 ATOM 20317 O WAT 7660 8.384 95.166 67.197 1.00 0.00 O ATOM 20318 H1 WAT 7660 7.737 94.561 67.559 1.00 0.00 H ATOM 20319 H2 WAT 7660 8.346 95.021 66.251 1.00 0.00 H TER 20321 WAT 7660 ATOM 20321 O WAT 7661 64.143 101.174 151.746 1.00 0.00 O ATOM 20322 H1 WAT 7661 64.623 101.304 150.928 1.00 0.00 H ATOM 20323 H2 WAT 7661 64.742 101.479 152.427 1.00 0.00 H TER 20325 WAT 7661 ATOM 20325 O WAT 7662 92.234 20.756 101.167 1.00 0.00 O ATOM 20326 H1 WAT 7662 91.921 21.594 100.825 1.00 0.00 H ATOM 20327 H2 WAT 7662 91.524 20.141 100.982 1.00 0.00 H TER 20329 WAT 7662 ATOM 20329 O WAT 7663 17.829 94.100 57.233 1.00 0.00 O ATOM 20330 H1 WAT 7663 18.086 94.330 56.340 1.00 0.00 H ATOM 20331 H2 WAT 7663 17.674 93.156 57.202 1.00 0.00 H TER 20333 WAT 7663 ATOM 20333 O WAT 7664 19.942 59.563 156.656 1.00 0.00 O ATOM 20334 H1 WAT 7664 19.426 59.452 155.858 1.00 0.00 H ATOM 20335 H2 WAT 7664 19.671 60.415 157.000 1.00 0.00 H TER 20337 WAT 7664 ATOM 20337 O WAT 7665 31.893 72.015 148.112 1.00 0.00 O ATOM 20338 H1 WAT 7665 31.477 71.522 148.820 1.00 0.00 H ATOM 20339 H2 WAT 7665 31.563 72.907 148.217 1.00 0.00 H TER 20341 WAT 7665 ATOM 20341 O WAT 7666 105.185 37.632 156.822 1.00 0.00 O ATOM 20342 H1 WAT 7666 105.764 37.612 157.583 1.00 0.00 H ATOM 20343 H2 WAT 7666 105.414 38.443 156.367 1.00 0.00 H TER 20345 WAT 7666 ATOM 20345 O WAT 7667 68.180 66.872 72.810 1.00 0.00 O ATOM 20346 H1 WAT 7667 67.251 67.019 72.634 1.00 0.00 H ATOM 20347 H2 WAT 7667 68.470 67.672 73.249 1.00 0.00 H TER 20349 WAT 7667 ATOM 20349 O WAT 7668 114.050 108.125 67.149 1.00 0.00 O ATOM 20350 H1 WAT 7668 113.519 108.437 67.882 1.00 0.00 H ATOM 20351 H2 WAT 7668 113.624 108.487 66.373 1.00 0.00 H TER 20353 WAT 7668 ATOM 20353 O WAT 7669 36.496 132.486 82.055 1.00 0.00 O ATOM 20354 H1 WAT 7669 36.456 133.125 81.343 1.00 0.00 H ATOM 20355 H2 WAT 7669 36.298 132.993 82.842 1.00 0.00 H TER 20357 WAT 7669 ATOM 20357 O WAT 7670 121.001 95.470 65.022 1.00 0.00 O ATOM 20358 H1 WAT 7670 121.275 95.552 64.109 1.00 0.00 H ATOM 20359 H2 WAT 7670 121.566 94.786 65.380 1.00 0.00 H TER 20361 WAT 7670 ATOM 20361 O WAT 7671 136.504 74.441 75.702 1.00 0.00 O ATOM 20362 H1 WAT 7671 136.771 75.178 76.252 1.00 0.00 H ATOM 20363 H2 WAT 7671 135.888 74.821 75.075 1.00 0.00 H TER 20365 WAT 7671 ATOM 20365 O WAT 7672 17.236 34.715 61.623 1.00 0.00 O ATOM 20366 H1 WAT 7672 17.459 35.602 61.906 1.00 0.00 H ATOM 20367 H2 WAT 7672 16.422 34.513 62.084 1.00 0.00 H TER 20369 WAT 7672 ATOM 20369 O WAT 7673 27.371 79.277 13.134 1.00 0.00 O ATOM 20370 H1 WAT 7673 28.043 79.454 13.793 1.00 0.00 H ATOM 20371 H2 WAT 7673 27.107 80.143 12.823 1.00 0.00 H TER 20373 WAT 7673 ATOM 20373 O WAT 7674 23.335 2.266 146.114 1.00 0.00 O ATOM 20374 H1 WAT 7674 23.066 2.057 147.008 1.00 0.00 H ATOM 20375 H2 WAT 7674 23.458 1.414 145.695 1.00 0.00 H TER 20377 WAT 7674 ATOM 20377 O WAT 7675 40.652 98.754 12.779 1.00 0.00 O ATOM 20378 H1 WAT 7675 39.713 98.770 12.592 1.00 0.00 H ATOM 20379 H2 WAT 7675 40.963 97.944 12.375 1.00 0.00 H TER 20381 WAT 7675 ATOM 20381 O WAT 7676 129.570 140.935 61.677 1.00 0.00 O ATOM 20382 H1 WAT 7676 130.216 140.919 60.970 1.00 0.00 H ATOM 20383 H2 WAT 7676 128.728 141.017 61.230 1.00 0.00 H TER 20385 WAT 7676 ATOM 20385 O WAT 7677 3.683 86.181 128.448 1.00 0.00 O ATOM 20386 H1 WAT 7677 3.953 85.284 128.643 1.00 0.00 H ATOM 20387 H2 WAT 7677 4.489 86.693 128.513 1.00 0.00 H TER 20389 WAT 7677 ATOM 20389 O WAT 7678 13.383 55.514 101.086 1.00 0.00 O ATOM 20390 H1 WAT 7678 13.232 54.936 101.833 1.00 0.00 H ATOM 20391 H2 WAT 7678 13.703 56.328 101.474 1.00 0.00 H TER 20393 WAT 7678 ATOM 20393 O WAT 7679 119.767 66.983 151.316 1.00 0.00 O ATOM 20394 H1 WAT 7679 120.423 67.677 151.388 1.00 0.00 H ATOM 20395 H2 WAT 7679 119.075 67.244 151.924 1.00 0.00 H TER 20397 WAT 7679 ATOM 20397 O WAT 7680 135.038 36.449 9.309 1.00 0.00 O ATOM 20398 H1 WAT 7680 134.659 37.058 9.942 1.00 0.00 H ATOM 20399 H2 WAT 7680 134.286 35.983 8.944 1.00 0.00 H TER 20401 WAT 7680 ATOM 20401 O WAT 7681 139.998 118.918 2.085 1.00 0.00 O ATOM 20402 H1 WAT 7681 139.964 118.003 1.805 1.00 0.00 H ATOM 20403 H2 WAT 7681 139.202 119.040 2.603 1.00 0.00 H TER 20405 WAT 7681 ATOM 20405 O WAT 7682 63.019 76.965 138.552 1.00 0.00 O ATOM 20406 H1 WAT 7682 62.209 77.149 138.076 1.00 0.00 H ATOM 20407 H2 WAT 7682 63.599 76.576 137.897 1.00 0.00 H TER 20409 WAT 7682 ATOM 20409 O WAT 7683 128.847 31.607 139.376 1.00 0.00 O ATOM 20410 H1 WAT 7683 128.951 30.699 139.662 1.00 0.00 H ATOM 20411 H2 WAT 7683 128.369 32.030 140.089 1.00 0.00 H TER 20413 WAT 7683 ATOM 20413 O WAT 7684 17.116 36.395 68.450 1.00 0.00 O ATOM 20414 H1 WAT 7684 17.306 35.654 69.025 1.00 0.00 H ATOM 20415 H2 WAT 7684 17.086 36.016 67.572 1.00 0.00 H TER 20417 WAT 7684 ATOM 20417 O WAT 7685 5.685 111.415 107.895 1.00 0.00 O ATOM 20418 H1 WAT 7685 6.597 111.219 107.681 1.00 0.00 H ATOM 20419 H2 WAT 7685 5.396 112.000 107.194 1.00 0.00 H TER 20421 WAT 7685 ATOM 20421 O WAT 7686 20.802 84.228 120.235 1.00 0.00 O ATOM 20422 H1 WAT 7686 20.392 85.086 120.126 1.00 0.00 H ATOM 20423 H2 WAT 7686 20.226 83.762 120.841 1.00 0.00 H TER 20425 WAT 7686 ATOM 20425 O WAT 7687 141.984 108.378 9.410 1.00 0.00 O ATOM 20426 H1 WAT 7687 141.551 109.231 9.371 1.00 0.00 H ATOM 20427 H2 WAT 7687 141.266 107.746 9.438 1.00 0.00 H TER 20429 WAT 7687 ATOM 20429 O WAT 7688 107.854 62.032 101.087 1.00 0.00 O ATOM 20430 H1 WAT 7688 107.546 61.161 100.839 1.00 0.00 H ATOM 20431 H2 WAT 7688 107.282 62.634 100.612 1.00 0.00 H TER 20433 WAT 7688 ATOM 20433 O WAT 7689 112.550 13.677 157.699 1.00 0.00 O ATOM 20434 H1 WAT 7689 112.248 13.127 158.422 1.00 0.00 H ATOM 20435 H2 WAT 7689 113.324 14.122 158.045 1.00 0.00 H TER 20437 WAT 7689 ATOM 20437 O WAT 7690 110.350 86.879 121.939 1.00 0.00 O ATOM 20438 H1 WAT 7690 109.802 86.668 121.183 1.00 0.00 H ATOM 20439 H2 WAT 7690 109.743 86.885 122.680 1.00 0.00 H TER 20441 WAT 7690 ATOM 20441 O WAT 7691 87.579 86.794 90.502 1.00 0.00 O ATOM 20442 H1 WAT 7691 88.377 86.481 90.076 1.00 0.00 H ATOM 20443 H2 WAT 7691 87.138 87.315 89.831 1.00 0.00 H TER 20445 WAT 7691 ATOM 20445 O WAT 7692 82.341 111.567 114.875 1.00 0.00 O ATOM 20446 H1 WAT 7692 82.148 110.641 115.022 1.00 0.00 H ATOM 20447 H2 WAT 7692 81.569 112.027 115.206 1.00 0.00 H TER 20449 WAT 7692 ATOM 20449 O WAT 7693 88.852 78.051 18.318 1.00 0.00 O ATOM 20450 H1 WAT 7693 88.179 78.246 17.667 1.00 0.00 H ATOM 20451 H2 WAT 7693 89.556 78.670 18.127 1.00 0.00 H TER 20453 WAT 7693 ATOM 20453 O WAT 7694 106.048 34.750 101.312 1.00 0.00 O ATOM 20454 H1 WAT 7694 106.715 35.387 101.568 1.00 0.00 H ATOM 20455 H2 WAT 7694 106.497 34.166 100.701 1.00 0.00 H TER 20457 WAT 7694 ATOM 20457 O WAT 7695 101.814 130.414 11.364 1.00 0.00 O ATOM 20458 H1 WAT 7695 101.769 131.135 11.992 1.00 0.00 H ATOM 20459 H2 WAT 7695 101.530 129.647 11.861 1.00 0.00 H TER 20461 WAT 7695 ATOM 20461 O WAT 7696 67.641 103.811 74.923 1.00 0.00 O ATOM 20462 H1 WAT 7696 68.104 104.415 75.503 1.00 0.00 H ATOM 20463 H2 WAT 7696 66.965 103.419 75.476 1.00 0.00 H TER 20465 WAT 7696 ATOM 20465 O WAT 7697 100.979 143.562 0.852 1.00 0.00 O ATOM 20466 H1 WAT 7697 101.376 143.792 0.012 1.00 0.00 H ATOM 20467 H2 WAT 7697 101.613 142.975 1.264 1.00 0.00 H TER 20469 WAT 7697 ATOM 20469 O WAT 7698 143.904 16.234 125.436 1.00 0.00 O ATOM 20470 H1 WAT 7698 144.506 15.712 125.966 1.00 0.00 H ATOM 20471 H2 WAT 7698 143.955 17.113 125.811 1.00 0.00 H TER 20473 WAT 7698 ATOM 20473 O WAT 7699 11.261 55.422 63.211 1.00 0.00 O ATOM 20474 H1 WAT 7699 10.793 55.735 63.985 1.00 0.00 H ATOM 20475 H2 WAT 7699 11.044 54.491 63.160 1.00 0.00 H TER 20477 WAT 7699 ATOM 20477 O WAT 7700 65.915 32.249 131.861 1.00 0.00 O ATOM 20478 H1 WAT 7700 65.934 32.001 130.937 1.00 0.00 H ATOM 20479 H2 WAT 7700 65.043 31.990 132.160 1.00 0.00 H TER 20481 WAT 7700 ATOM 20481 O WAT 7701 19.276 31.096 136.995 1.00 0.00 O ATOM 20482 H1 WAT 7701 18.506 31.275 137.534 1.00 0.00 H ATOM 20483 H2 WAT 7701 18.922 30.902 136.127 1.00 0.00 H TER 20485 WAT 7701 ATOM 20485 O WAT 7702 68.081 141.700 112.859 1.00 0.00 O ATOM 20486 H1 WAT 7702 68.391 142.003 112.006 1.00 0.00 H ATOM 20487 H2 WAT 7702 68.730 141.053 113.134 1.00 0.00 H TER 20489 WAT 7702 ATOM 20489 O WAT 7703 109.051 14.187 71.912 1.00 0.00 O ATOM 20490 H1 WAT 7703 109.028 13.351 72.378 1.00 0.00 H ATOM 20491 H2 WAT 7703 108.503 14.046 71.140 1.00 0.00 H TER 20493 WAT 7703 ATOM 20493 O WAT 7704 87.208 105.532 157.024 1.00 0.00 O ATOM 20494 H1 WAT 7704 86.582 106.164 157.378 1.00 0.00 H ATOM 20495 H2 WAT 7704 87.103 105.597 156.074 1.00 0.00 H TER 20497 WAT 7704 ATOM 20497 O WAT 7705 105.574 77.576 109.673 1.00 0.00 O ATOM 20498 H1 WAT 7705 105.513 78.213 110.385 1.00 0.00 H ATOM 20499 H2 WAT 7705 105.016 76.850 109.954 1.00 0.00 H TER 20501 WAT 7705 ATOM 20501 O WAT 7706 9.584 88.774 79.058 1.00 0.00 O ATOM 20502 H1 WAT 7706 10.126 89.421 78.606 1.00 0.00 H ATOM 20503 H2 WAT 7706 10.210 88.148 79.421 1.00 0.00 H TER 20505 WAT 7706 ATOM 20505 O WAT 7707 105.781 5.054 140.038 1.00 0.00 O ATOM 20506 H1 WAT 7707 106.393 5.343 140.714 1.00 0.00 H ATOM 20507 H2 WAT 7707 105.965 5.621 139.289 1.00 0.00 H TER 20509 WAT 7707 ATOM 20509 O WAT 7708 16.206 134.325 125.053 1.00 0.00 O ATOM 20510 H1 WAT 7708 15.410 134.847 124.954 1.00 0.00 H ATOM 20511 H2 WAT 7708 16.001 133.492 124.629 1.00 0.00 H TER 20513 WAT 7708 ATOM 20513 O WAT 7709 123.791 26.641 143.834 1.00 0.00 O ATOM 20514 H1 WAT 7709 123.031 26.066 143.920 1.00 0.00 H ATOM 20515 H2 WAT 7709 124.497 26.174 144.280 1.00 0.00 H TER 20517 WAT 7709 ATOM 20517 O WAT 7710 47.731 85.114 92.884 1.00 0.00 O ATOM 20518 H1 WAT 7710 47.188 85.524 92.210 1.00 0.00 H ATOM 20519 H2 WAT 7710 47.111 84.629 93.428 1.00 0.00 H TER 20521 WAT 7710 ATOM 20521 O WAT 7711 129.651 125.116 143.267 1.00 0.00 O ATOM 20522 H1 WAT 7711 128.981 125.773 143.458 1.00 0.00 H ATOM 20523 H2 WAT 7711 129.175 124.411 142.828 1.00 0.00 H TER 20525 WAT 7711 ATOM 20525 O WAT 7712 123.779 115.749 65.414 1.00 0.00 O ATOM 20526 H1 WAT 7712 123.785 116.692 65.574 1.00 0.00 H ATOM 20527 H2 WAT 7712 124.355 115.388 66.088 1.00 0.00 H TER 20529 WAT 7712 ATOM 20529 O WAT 7713 50.344 44.965 61.882 1.00 0.00 O ATOM 20530 H1 WAT 7713 50.911 44.228 61.656 1.00 0.00 H ATOM 20531 H2 WAT 7713 50.439 45.574 61.149 1.00 0.00 H TER 20533 WAT 7713 ATOM 20533 O WAT 7714 7.318 130.369 88.090 1.00 0.00 O ATOM 20534 H1 WAT 7714 8.044 130.753 87.598 1.00 0.00 H ATOM 20535 H2 WAT 7714 7.167 130.980 88.810 1.00 0.00 H TER 20537 WAT 7714 ATOM 20537 O WAT 7715 94.145 90.987 106.301 1.00 0.00 O ATOM 20538 H1 WAT 7715 93.592 90.614 105.614 1.00 0.00 H ATOM 20539 H2 WAT 7715 95.003 90.586 106.161 1.00 0.00 H TER 20541 WAT 7715 ATOM 20541 O WAT 7716 98.193 24.470 100.472 1.00 0.00 O ATOM 20542 H1 WAT 7716 98.375 25.245 99.941 1.00 0.00 H ATOM 20543 H2 WAT 7716 98.681 24.615 101.283 1.00 0.00 H TER 20545 WAT 7716 ATOM 20545 O WAT 7717 44.973 68.022 104.626 1.00 0.00 O ATOM 20546 H1 WAT 7717 44.966 68.892 105.025 1.00 0.00 H ATOM 20547 H2 WAT 7717 45.887 67.879 104.378 1.00 0.00 H TER 20549 WAT 7717 ATOM 20549 O WAT 7718 10.953 67.072 107.592 1.00 0.00 O ATOM 20550 H1 WAT 7718 10.813 66.483 106.851 1.00 0.00 H ATOM 20551 H2 WAT 7718 10.657 66.574 108.353 1.00 0.00 H TER 20553 WAT 7718 ATOM 20553 O WAT 7719 122.446 128.810 151.534 1.00 0.00 O ATOM 20554 H1 WAT 7719 122.968 128.064 151.241 1.00 0.00 H ATOM 20555 H2 WAT 7719 121.696 128.827 150.939 1.00 0.00 H TER 20557 WAT 7719 ATOM 20557 O WAT 7720 124.469 10.555 92.621 1.00 0.00 O ATOM 20558 H1 WAT 7720 124.171 10.039 91.871 1.00 0.00 H ATOM 20559 H2 WAT 7720 123.994 10.190 93.367 1.00 0.00 H TER 20561 WAT 7720 ATOM 20561 O WAT 7721 1.557 6.789 148.414 1.00 0.00 O ATOM 20562 H1 WAT 7721 1.367 6.480 149.300 1.00 0.00 H ATOM 20563 H2 WAT 7721 1.050 6.211 147.844 1.00 0.00 H TER 20565 WAT 7721 ATOM 20565 O WAT 7722 56.529 84.245 10.749 1.00 0.00 O ATOM 20566 H1 WAT 7722 57.017 83.607 10.228 1.00 0.00 H ATOM 20567 H2 WAT 7722 57.154 84.952 10.909 1.00 0.00 H TER 20569 WAT 7722 ATOM 20569 O WAT 7723 134.072 4.500 12.039 1.00 0.00 O ATOM 20570 H1 WAT 7723 134.073 3.545 12.111 1.00 0.00 H ATOM 20571 H2 WAT 7723 134.997 4.743 12.062 1.00 0.00 H TER 20573 WAT 7723 ATOM 20573 O WAT 7724 100.896 91.875 103.202 1.00 0.00 O ATOM 20574 H1 WAT 7724 101.764 92.177 103.467 1.00 0.00 H ATOM 20575 H2 WAT 7724 100.621 92.498 102.529 1.00 0.00 H TER 20577 WAT 7724 ATOM 20577 O WAT 7725 26.942 3.219 152.096 1.00 0.00 O ATOM 20578 H1 WAT 7725 27.717 2.658 152.041 1.00 0.00 H ATOM 20579 H2 WAT 7725 27.278 4.104 151.958 1.00 0.00 H TER 20581 WAT 7725 ATOM 20581 O WAT 7726 20.570 138.571 144.697 1.00 0.00 O ATOM 20582 H1 WAT 7726 21.045 138.102 145.383 1.00 0.00 H ATOM 20583 H2 WAT 7726 19.974 139.151 145.172 1.00 0.00 H TER 20585 WAT 7726 ATOM 20585 O WAT 7727 69.231 74.485 17.228 1.00 0.00 O ATOM 20586 H1 WAT 7727 69.302 73.552 17.432 1.00 0.00 H ATOM 20587 H2 WAT 7727 70.112 74.829 17.372 1.00 0.00 H TER 20589 WAT 7727 ATOM 20589 O WAT 7728 37.234 86.886 81.202 1.00 0.00 O ATOM 20590 H1 WAT 7728 36.751 86.272 80.648 1.00 0.00 H ATOM 20591 H2 WAT 7728 37.812 86.332 81.726 1.00 0.00 H TER 20593 WAT 7728 ATOM 20593 O WAT 7729 87.009 115.057 145.542 1.00 0.00 O ATOM 20594 H1 WAT 7729 87.885 115.033 145.928 1.00 0.00 H ATOM 20595 H2 WAT 7729 86.860 115.982 145.345 1.00 0.00 H TER 20597 WAT 7729 ATOM 20597 O WAT 7730 126.613 44.561 126.182 1.00 0.00 O ATOM 20598 H1 WAT 7730 125.782 45.020 126.061 1.00 0.00 H ATOM 20599 H2 WAT 7730 126.942 44.878 127.024 1.00 0.00 H TER 20601 WAT 7730 ATOM 20601 O WAT 7731 45.069 100.932 135.738 1.00 0.00 O ATOM 20602 H1 WAT 7731 45.951 100.729 136.049 1.00 0.00 H ATOM 20603 H2 WAT 7731 44.603 101.234 136.518 1.00 0.00 H TER 20605 WAT 7731 ATOM 20605 O WAT 7732 33.756 38.876 148.032 1.00 0.00 O ATOM 20606 H1 WAT 7732 34.201 39.132 148.840 1.00 0.00 H ATOM 20607 H2 WAT 7732 32.948 39.389 148.031 1.00 0.00 H TER 20609 WAT 7732 ATOM 20609 O WAT 7733 110.369 75.793 105.761 1.00 0.00 O ATOM 20610 H1 WAT 7733 110.199 75.990 104.840 1.00 0.00 H ATOM 20611 H2 WAT 7733 111.191 75.301 105.753 1.00 0.00 H TER 20613 WAT 7733 ATOM 20613 O WAT 7734 135.210 8.381 67.449 1.00 0.00 O ATOM 20614 H1 WAT 7734 134.585 7.782 67.042 1.00 0.00 H ATOM 20615 H2 WAT 7734 135.748 8.697 66.723 1.00 0.00 H TER 20617 WAT 7734 ATOM 20617 O WAT 7735 130.279 143.104 85.058 1.00 0.00 O ATOM 20618 H1 WAT 7735 129.342 143.302 85.054 1.00 0.00 H ATOM 20619 H2 WAT 7735 130.608 143.520 85.855 1.00 0.00 H TER 20621 WAT 7735 ATOM 20621 O WAT 7736 140.543 96.107 131.291 1.00 0.00 O ATOM 20622 H1 WAT 7736 140.909 95.635 130.543 1.00 0.00 H ATOM 20623 H2 WAT 7736 139.981 96.776 130.901 1.00 0.00 H TER 20625 WAT 7736 ATOM 20625 O WAT 7737 84.093 8.895 112.841 1.00 0.00 O ATOM 20626 H1 WAT 7737 84.419 8.602 111.990 1.00 0.00 H ATOM 20627 H2 WAT 7737 83.721 8.108 113.239 1.00 0.00 H TER 20629 WAT 7737 ATOM 20629 O WAT 7738 124.489 4.723 79.826 1.00 0.00 O ATOM 20630 H1 WAT 7738 124.453 3.809 79.544 1.00 0.00 H ATOM 20631 H2 WAT 7738 124.803 5.199 79.057 1.00 0.00 H TER 20633 WAT 7738 ATOM 20633 O WAT 7739 56.155 144.594 96.543 1.00 0.00 O ATOM 20634 H1 WAT 7739 56.939 144.387 97.051 1.00 0.00 H ATOM 20635 H2 WAT 7739 56.347 145.441 96.140 1.00 0.00 H TER 20637 WAT 7739 ATOM 20637 O WAT 7740 0.375 39.862 89.807 1.00 0.00 O ATOM 20638 H1 WAT 7740 -0.238 39.241 90.201 1.00 0.00 H ATOM 20639 H2 WAT 7740 -0.114 40.254 89.083 1.00 0.00 H TER 20641 WAT 7740 ATOM 20641 O WAT 7741 112.655 62.457 110.201 1.00 0.00 O ATOM 20642 H1 WAT 7741 113.356 62.120 109.643 1.00 0.00 H ATOM 20643 H2 WAT 7741 111.940 62.653 109.596 1.00 0.00 H TER 20645 WAT 7741 ATOM 20645 O WAT 7742 17.284 72.201 145.030 1.00 0.00 O ATOM 20646 H1 WAT 7742 16.871 72.693 144.321 1.00 0.00 H ATOM 20647 H2 WAT 7742 18.101 71.877 144.653 1.00 0.00 H TER 20649 WAT 7742 ATOM 20649 O WAT 7743 18.178 65.196 131.668 1.00 0.00 O ATOM 20650 H1 WAT 7743 18.739 65.466 132.395 1.00 0.00 H ATOM 20651 H2 WAT 7743 18.747 65.231 130.899 1.00 0.00 H TER 20653 WAT 7743 ATOM 20653 O WAT 7744 135.531 51.485 3.100 1.00 0.00 O ATOM 20654 H1 WAT 7744 134.627 51.300 2.845 1.00 0.00 H ATOM 20655 H2 WAT 7744 136.020 50.708 2.829 1.00 0.00 H TER 20657 WAT 7744 ATOM 20657 O WAT 7745 71.785 136.821 140.324 1.00 0.00 O ATOM 20658 H1 WAT 7745 72.695 137.037 140.121 1.00 0.00 H ATOM 20659 H2 WAT 7745 71.274 137.503 139.888 1.00 0.00 H TER 20661 WAT 7745 ATOM 20661 O WAT 7746 64.460 7.260 126.141 1.00 0.00 O ATOM 20662 H1 WAT 7746 64.209 8.098 126.529 1.00 0.00 H ATOM 20663 H2 WAT 7746 64.984 6.830 126.816 1.00 0.00 H TER 20665 WAT 7746 ATOM 20665 O WAT 7747 103.780 69.754 86.743 1.00 0.00 O ATOM 20666 H1 WAT 7747 102.924 70.168 86.851 1.00 0.00 H ATOM 20667 H2 WAT 7747 104.205 69.858 87.595 1.00 0.00 H TER 20669 WAT 7747 ATOM 20669 O WAT 7748 49.093 136.382 107.614 1.00 0.00 O ATOM 20670 H1 WAT 7748 49.419 136.001 106.799 1.00 0.00 H ATOM 20671 H2 WAT 7748 48.140 136.361 107.525 1.00 0.00 H TER 20673 WAT 7748 ATOM 20673 O WAT 7749 108.435 65.771 126.116 1.00 0.00 O ATOM 20674 H1 WAT 7749 108.699 65.600 127.021 1.00 0.00 H ATOM 20675 H2 WAT 7749 108.079 64.937 125.809 1.00 0.00 H TER 20677 WAT 7749 ATOM 20677 O WAT 7750 116.447 22.906 106.634 1.00 0.00 O ATOM 20678 H1 WAT 7750 116.614 21.983 106.826 1.00 0.00 H ATOM 20679 H2 WAT 7750 115.918 23.212 107.371 1.00 0.00 H TER 20681 WAT 7750 ATOM 20681 O WAT 7751 93.311 86.835 90.989 1.00 0.00 O ATOM 20682 H1 WAT 7751 92.697 87.565 90.911 1.00 0.00 H ATOM 20683 H2 WAT 7751 92.761 86.081 91.202 1.00 0.00 H TER 20685 WAT 7751 ATOM 20685 O WAT 7752 12.566 118.646 57.806 1.00 0.00 O ATOM 20686 H1 WAT 7752 12.802 117.939 57.204 1.00 0.00 H ATOM 20687 H2 WAT 7752 13.403 118.949 58.159 1.00 0.00 H TER 20689 WAT 7752 ATOM 20689 O WAT 7753 64.094 45.271 6.999 1.00 0.00 O ATOM 20690 H1 WAT 7753 64.118 46.182 7.292 1.00 0.00 H ATOM 20691 H2 WAT 7753 63.317 44.904 7.421 1.00 0.00 H TER 20693 WAT 7753 ATOM 20693 O WAT 7754 54.894 137.902 144.445 1.00 0.00 O ATOM 20694 H1 WAT 7754 54.832 137.535 145.326 1.00 0.00 H ATOM 20695 H2 WAT 7754 54.004 138.189 144.241 1.00 0.00 H TER 20697 WAT 7754 ATOM 20697 O WAT 7755 140.073 76.147 136.285 1.00 0.00 O ATOM 20698 H1 WAT 7755 140.747 76.533 136.844 1.00 0.00 H ATOM 20699 H2 WAT 7755 139.988 76.760 135.555 1.00 0.00 H TER 20701 WAT 7755 ATOM 20701 O WAT 7756 139.569 19.750 128.919 1.00 0.00 O ATOM 20702 H1 WAT 7756 139.376 20.637 128.615 1.00 0.00 H ATOM 20703 H2 WAT 7756 138.750 19.270 128.793 1.00 0.00 H TER 20705 WAT 7756 ATOM 20705 O WAT 7757 145.174 38.545 152.268 1.00 0.00 O ATOM 20706 H1 WAT 7757 146.071 38.763 152.523 1.00 0.00 H ATOM 20707 H2 WAT 7757 145.259 38.167 151.393 1.00 0.00 H TER 20709 WAT 7757 ATOM 20709 O WAT 7758 115.107 96.642 95.320 1.00 0.00 O ATOM 20710 H1 WAT 7758 114.385 96.483 94.712 1.00 0.00 H ATOM 20711 H2 WAT 7758 115.099 95.884 95.905 1.00 0.00 H TER 20713 WAT 7758 ATOM 20713 O WAT 7759 49.881 108.243 110.858 1.00 0.00 O ATOM 20714 H1 WAT 7759 50.540 108.884 111.124 1.00 0.00 H ATOM 20715 H2 WAT 7759 49.106 108.470 111.372 1.00 0.00 H TER 20717 WAT 7759 ATOM 20717 O WAT 7760 90.201 74.170 12.061 1.00 0.00 O ATOM 20718 H1 WAT 7760 90.180 74.865 12.718 1.00 0.00 H ATOM 20719 H2 WAT 7760 90.232 73.360 12.571 1.00 0.00 H TER 20721 WAT 7760 ATOM 20721 O WAT 7761 98.277 7.239 134.935 1.00 0.00 O ATOM 20722 H1 WAT 7761 98.648 6.555 135.493 1.00 0.00 H ATOM 20723 H2 WAT 7761 98.912 7.954 134.978 1.00 0.00 H TER 20725 WAT 7761 ATOM 20725 O WAT 7762 75.275 100.753 84.416 1.00 0.00 O ATOM 20726 H1 WAT 7762 75.410 99.938 84.899 1.00 0.00 H ATOM 20727 H2 WAT 7762 74.454 100.619 83.944 1.00 0.00 H TER 20729 WAT 7762 ATOM 20729 O WAT 7763 34.652 7.253 141.014 1.00 0.00 O ATOM 20730 H1 WAT 7763 34.405 6.995 141.902 1.00 0.00 H ATOM 20731 H2 WAT 7763 34.043 7.957 140.791 1.00 0.00 H TER 20733 WAT 7763 ATOM 20733 O WAT 7764 30.383 2.441 132.316 1.00 0.00 O ATOM 20734 H1 WAT 7764 30.439 2.356 131.364 1.00 0.00 H ATOM 20735 H2 WAT 7764 30.706 3.324 132.496 1.00 0.00 H TER 20737 WAT 7764 ATOM 20737 O WAT 7765 142.931 26.969 15.968 1.00 0.00 O ATOM 20738 H1 WAT 7765 143.049 27.587 16.689 1.00 0.00 H ATOM 20739 H2 WAT 7765 143.667 26.363 16.048 1.00 0.00 H TER 20741 WAT 7765 ATOM 20741 O WAT 7766 135.254 73.040 2.237 1.00 0.00 O ATOM 20742 H1 WAT 7766 135.015 73.162 3.156 1.00 0.00 H ATOM 20743 H2 WAT 7766 134.530 72.536 1.866 1.00 0.00 H TER 20745 WAT 7766 ATOM 20745 O WAT 7767 54.204 31.749 64.117 1.00 0.00 O ATOM 20746 H1 WAT 7767 54.253 32.171 63.260 1.00 0.00 H ATOM 20747 H2 WAT 7767 53.592 32.289 64.616 1.00 0.00 H TER 20749 WAT 7767 ATOM 20749 O WAT 7768 137.469 142.612 92.432 1.00 0.00 O ATOM 20750 H1 WAT 7768 137.501 142.650 93.388 1.00 0.00 H ATOM 20751 H2 WAT 7768 136.599 142.266 92.236 1.00 0.00 H TER 20753 WAT 7768 ATOM 20753 O WAT 7769 89.355 133.319 150.116 1.00 0.00 O ATOM 20754 H1 WAT 7769 88.512 133.032 149.767 1.00 0.00 H ATOM 20755 H2 WAT 7769 89.700 132.550 150.571 1.00 0.00 H TER 20757 WAT 7769 ATOM 20757 O WAT 7770 116.934 85.245 131.515 1.00 0.00 O ATOM 20758 H1 WAT 7770 117.879 85.094 131.510 1.00 0.00 H ATOM 20759 H2 WAT 7770 116.827 86.078 131.974 1.00 0.00 H TER 20761 WAT 7770 ATOM 20761 O WAT 7771 93.890 133.871 101.309 1.00 0.00 O ATOM 20762 H1 WAT 7771 93.775 134.578 101.944 1.00 0.00 H ATOM 20763 H2 WAT 7771 94.835 133.829 101.165 1.00 0.00 H TER 20765 WAT 7771 ATOM 20765 O WAT 7772 107.378 67.195 129.689 1.00 0.00 O ATOM 20766 H1 WAT 7772 107.141 66.995 130.595 1.00 0.00 H ATOM 20767 H2 WAT 7772 107.940 66.468 129.422 1.00 0.00 H TER 20769 WAT 7772 ATOM 20769 O WAT 7773 44.571 97.751 77.054 1.00 0.00 O ATOM 20770 H1 WAT 7773 45.035 98.588 77.073 1.00 0.00 H ATOM 20771 H2 WAT 7773 43.787 97.899 77.583 1.00 0.00 H TER 20773 WAT 7773 ATOM 20773 O WAT 7774 80.435 34.201 74.255 1.00 0.00 O ATOM 20774 H1 WAT 7774 80.992 34.189 75.034 1.00 0.00 H ATOM 20775 H2 WAT 7774 80.996 34.557 73.566 1.00 0.00 H TER 20777 WAT 7774 ATOM 20777 O WAT 7775 72.750 114.011 72.690 1.00 0.00 O ATOM 20778 H1 WAT 7775 72.202 114.305 73.417 1.00 0.00 H ATOM 20779 H2 WAT 7775 73.643 114.217 72.965 1.00 0.00 H TER 20781 WAT 7775 ATOM 20781 O WAT 7776 128.890 46.696 154.305 1.00 0.00 O ATOM 20782 H1 WAT 7776 129.629 46.707 154.914 1.00 0.00 H ATOM 20783 H2 WAT 7776 129.043 47.444 153.728 1.00 0.00 H TER 20785 WAT 7776 ATOM 20785 O WAT 7777 40.177 92.323 121.027 1.00 0.00 O ATOM 20786 H1 WAT 7777 39.373 92.269 120.511 1.00 0.00 H ATOM 20787 H2 WAT 7777 40.579 93.149 120.757 1.00 0.00 H TER 20789 WAT 7777 ATOM 20789 O WAT 7778 0.238 89.853 5.909 1.00 0.00 O ATOM 20790 H1 WAT 7778 0.757 90.656 5.942 1.00 0.00 H ATOM 20791 H2 WAT 7778 0.436 89.475 5.052 1.00 0.00 H TER 20793 WAT 7778 ATOM 20793 O WAT 7779 125.821 120.352 108.276 1.00 0.00 O ATOM 20794 H1 WAT 7779 126.674 120.552 108.661 1.00 0.00 H ATOM 20795 H2 WAT 7779 125.903 119.449 107.970 1.00 0.00 H TER 20797 WAT 7779 ATOM 20797 O WAT 7780 101.917 10.682 52.551 1.00 0.00 O ATOM 20798 H1 WAT 7780 102.011 11.581 52.234 1.00 0.00 H ATOM 20799 H2 WAT 7780 101.445 10.768 53.379 1.00 0.00 H TER 20801 WAT 7780 ATOM 20801 O WAT 7781 102.693 28.747 58.371 1.00 0.00 O ATOM 20802 H1 WAT 7781 102.808 27.816 58.563 1.00 0.00 H ATOM 20803 H2 WAT 7781 102.033 29.041 58.999 1.00 0.00 H TER 20805 WAT 7781 ATOM 20805 O WAT 7782 71.704 89.463 91.202 1.00 0.00 O ATOM 20806 H1 WAT 7782 71.735 90.234 90.635 1.00 0.00 H ATOM 20807 H2 WAT 7782 71.088 89.700 91.895 1.00 0.00 H TER 20809 WAT 7782 ATOM 20809 O WAT 7783 27.424 61.520 59.453 1.00 0.00 O ATOM 20810 H1 WAT 7783 28.272 61.207 59.767 1.00 0.00 H ATOM 20811 H2 WAT 7783 27.055 60.776 58.977 1.00 0.00 H TER 20813 WAT 7783 ATOM 20813 O WAT 7784 125.930 54.384 9.493 1.00 0.00 O ATOM 20814 H1 WAT 7784 125.743 55.083 8.866 1.00 0.00 H ATOM 20815 H2 WAT 7784 126.389 53.719 8.981 1.00 0.00 H TER 20817 WAT 7784 ATOM 20817 O WAT 7785 33.001 44.241 108.954 1.00 0.00 O ATOM 20818 H1 WAT 7785 32.350 44.312 109.652 1.00 0.00 H ATOM 20819 H2 WAT 7785 33.231 45.148 108.748 1.00 0.00 H TER 20821 WAT 7785 ATOM 20821 O WAT 7786 45.764 120.558 155.886 1.00 0.00 O ATOM 20822 H1 WAT 7786 45.584 119.723 155.454 1.00 0.00 H ATOM 20823 H2 WAT 7786 46.530 120.384 156.433 1.00 0.00 H TER 20825 WAT 7786 ATOM 20825 O WAT 7787 17.462 14.349 107.428 1.00 0.00 O ATOM 20826 H1 WAT 7787 18.270 14.669 107.027 1.00 0.00 H ATOM 20827 H2 WAT 7787 16.786 14.953 107.121 1.00 0.00 H TER 20829 WAT 7787 ATOM 20829 O WAT 7788 44.622 87.058 11.312 1.00 0.00 O ATOM 20830 H1 WAT 7788 44.181 86.354 11.786 1.00 0.00 H ATOM 20831 H2 WAT 7788 43.936 87.451 10.773 1.00 0.00 H TER 20833 WAT 7788 ATOM 20833 O WAT 7789 56.300 9.803 112.163 1.00 0.00 O ATOM 20834 H1 WAT 7789 56.236 9.228 112.926 1.00 0.00 H ATOM 20835 H2 WAT 7789 56.896 9.347 111.568 1.00 0.00 H TER 20837 WAT 7789 ATOM 20837 O WAT 7790 46.229 7.415 59.023 1.00 0.00 O ATOM 20838 H1 WAT 7790 45.912 6.513 59.073 1.00 0.00 H ATOM 20839 H2 WAT 7790 46.497 7.525 58.111 1.00 0.00 H TER 20841 WAT 7790 ATOM 20841 O WAT 7791 19.994 67.701 132.208 1.00 0.00 O ATOM 20842 H1 WAT 7791 20.032 68.493 131.671 1.00 0.00 H ATOM 20843 H2 WAT 7791 20.746 67.182 131.922 1.00 0.00 H TER 20845 WAT 7791 ATOM 20845 O WAT 7792 41.150 47.712 64.282 1.00 0.00 O ATOM 20846 H1 WAT 7792 41.522 47.061 64.876 1.00 0.00 H ATOM 20847 H2 WAT 7792 41.829 47.850 63.622 1.00 0.00 H TER 20849 WAT 7792 ATOM 20849 O WAT 7793 35.246 38.199 125.103 1.00 0.00 O ATOM 20850 H1 WAT 7793 35.585 37.384 124.732 1.00 0.00 H ATOM 20851 H2 WAT 7793 35.275 38.823 124.378 1.00 0.00 H TER 20853 WAT 7793 ATOM 20853 O WAT 7794 77.939 22.109 9.976 1.00 0.00 O ATOM 20854 H1 WAT 7794 78.500 21.340 10.072 1.00 0.00 H ATOM 20855 H2 WAT 7794 77.674 22.099 9.056 1.00 0.00 H TER 20857 WAT 7794 ATOM 20857 O WAT 7795 111.870 109.719 149.906 1.00 0.00 O ATOM 20858 H1 WAT 7795 111.067 109.209 149.796 1.00 0.00 H ATOM 20859 H2 WAT 7795 112.424 109.456 149.171 1.00 0.00 H TER 20861 WAT 7795 ATOM 20861 O WAT 7796 100.599 95.513 105.522 1.00 0.00 O ATOM 20862 H1 WAT 7796 101.029 95.452 106.376 1.00 0.00 H ATOM 20863 H2 WAT 7796 100.063 94.722 105.467 1.00 0.00 H TER 20865 WAT 7796 ATOM 20865 O WAT 7797 59.550 83.170 3.041 1.00 0.00 O ATOM 20866 H1 WAT 7797 59.096 83.818 3.580 1.00 0.00 H ATOM 20867 H2 WAT 7797 60.056 82.651 3.666 1.00 0.00 H TER 20869 WAT 7797 ATOM 20869 O WAT 7798 126.520 65.020 123.331 1.00 0.00 O ATOM 20870 H1 WAT 7798 126.779 64.178 123.706 1.00 0.00 H ATOM 20871 H2 WAT 7798 127.347 65.452 123.119 1.00 0.00 H TER 20873 WAT 7798 ATOM 20873 O WAT 7799 133.102 70.191 148.109 1.00 0.00 O ATOM 20874 H1 WAT 7799 133.654 70.932 148.360 1.00 0.00 H ATOM 20875 H2 WAT 7799 133.619 69.716 147.459 1.00 0.00 H TER 20877 WAT 7799 ATOM 20877 O WAT 7800 121.005 51.708 109.859 1.00 0.00 O ATOM 20878 H1 WAT 7800 121.294 50.975 109.316 1.00 0.00 H ATOM 20879 H2 WAT 7800 120.093 51.848 109.608 1.00 0.00 H TER 20881 WAT 7800 ATOM 20881 O WAT 7801 9.028 144.157 104.353 1.00 0.00 O ATOM 20882 H1 WAT 7801 8.953 144.997 104.805 1.00 0.00 H ATOM 20883 H2 WAT 7801 9.949 143.916 104.445 1.00 0.00 H TER 20885 WAT 7801 ATOM 20885 O WAT 7802 71.101 50.141 121.522 1.00 0.00 O ATOM 20886 H1 WAT 7802 70.997 50.848 122.158 1.00 0.00 H ATOM 20887 H2 WAT 7802 72.033 50.149 121.304 1.00 0.00 H TER 20889 WAT 7802 ATOM 20889 O WAT 7803 80.934 18.124 111.608 1.00 0.00 O ATOM 20890 H1 WAT 7803 81.244 18.860 112.135 1.00 0.00 H ATOM 20891 H2 WAT 7803 80.675 17.462 112.249 1.00 0.00 H TER 20893 WAT 7803 ATOM 20893 O WAT 7804 102.191 83.250 130.725 1.00 0.00 O ATOM 20894 H1 WAT 7804 101.992 84.064 131.188 1.00 0.00 H ATOM 20895 H2 WAT 7804 101.455 82.673 130.928 1.00 0.00 H TER 20897 WAT 7804 ATOM 20897 O WAT 7805 100.951 106.808 90.890 1.00 0.00 O ATOM 20898 H1 WAT 7805 101.388 106.784 91.742 1.00 0.00 H ATOM 20899 H2 WAT 7805 100.186 106.243 90.997 1.00 0.00 H TER 20901 WAT 7805 ATOM 20901 O WAT 7806 83.112 40.023 124.137 1.00 0.00 O ATOM 20902 H1 WAT 7806 83.672 39.619 124.801 1.00 0.00 H ATOM 20903 H2 WAT 7806 82.220 39.851 124.439 1.00 0.00 H TER 20905 WAT 7806 ATOM 20905 O WAT 7807 57.527 18.439 97.161 1.00 0.00 O ATOM 20906 H1 WAT 7807 56.970 19.210 97.057 1.00 0.00 H ATOM 20907 H2 WAT 7807 57.562 18.295 98.107 1.00 0.00 H TER 20909 WAT 7807 ATOM 20909 O WAT 7808 107.568 110.195 126.905 1.00 0.00 O ATOM 20910 H1 WAT 7808 107.673 109.300 126.582 1.00 0.00 H ATOM 20911 H2 WAT 7808 108.186 110.261 127.632 1.00 0.00 H TER 20913 WAT 7808 ATOM 20913 O WAT 7809 45.256 100.095 102.852 1.00 0.00 O ATOM 20914 H1 WAT 7809 44.377 99.871 102.546 1.00 0.00 H ATOM 20915 H2 WAT 7809 45.165 100.182 103.801 1.00 0.00 H TER 20917 WAT 7809 ATOM 20917 O WAT 7810 2.622 66.674 114.940 1.00 0.00 O ATOM 20918 H1 WAT 7810 3.538 66.394 114.942 1.00 0.00 H ATOM 20919 H2 WAT 7810 2.636 67.537 114.525 1.00 0.00 H TER 20921 WAT 7810 ATOM 20921 O WAT 7811 98.156 86.983 57.594 1.00 0.00 O ATOM 20922 H1 WAT 7811 97.301 86.657 57.876 1.00 0.00 H ATOM 20923 H2 WAT 7811 98.571 86.232 57.169 1.00 0.00 H TER 20925 WAT 7811 ATOM 20925 O WAT 7812 41.725 80.579 123.860 1.00 0.00 O ATOM 20926 H1 WAT 7812 41.255 79.759 123.712 1.00 0.00 H ATOM 20927 H2 WAT 7812 42.643 80.319 123.934 1.00 0.00 H TER 20929 WAT 7812 ATOM 20929 O WAT 7813 66.709 107.382 117.285 1.00 0.00 O ATOM 20930 H1 WAT 7813 65.867 107.358 116.831 1.00 0.00 H ATOM 20931 H2 WAT 7813 66.694 108.204 117.774 1.00 0.00 H TER 20933 WAT 7813 ATOM 20933 O WAT 7814 92.586 35.552 89.880 1.00 0.00 O ATOM 20934 H1 WAT 7814 93.113 35.542 90.678 1.00 0.00 H ATOM 20935 H2 WAT 7814 91.695 35.726 90.183 1.00 0.00 H TER 20937 WAT 7814 ATOM 20937 O WAT 7815 84.628 10.856 129.413 1.00 0.00 O ATOM 20938 H1 WAT 7815 84.113 10.429 128.728 1.00 0.00 H ATOM 20939 H2 WAT 7815 83.978 11.286 129.968 1.00 0.00 H TER 20941 WAT 7815 ATOM 20941 O WAT 7816 50.428 64.267 4.311 1.00 0.00 O ATOM 20942 H1 WAT 7816 49.653 64.765 4.052 1.00 0.00 H ATOM 20943 H2 WAT 7816 51.057 64.931 4.594 1.00 0.00 H TER 20945 WAT 7816 ATOM 20945 O WAT 7817 52.535 28.968 149.473 1.00 0.00 O ATOM 20946 H1 WAT 7817 51.810 29.586 149.563 1.00 0.00 H ATOM 20947 H2 WAT 7817 53.020 29.046 150.295 1.00 0.00 H TER 20949 WAT 7817 ATOM 20949 O WAT 7818 40.698 45.453 106.056 1.00 0.00 O ATOM 20950 H1 WAT 7818 39.920 45.116 105.611 1.00 0.00 H ATOM 20951 H2 WAT 7818 41.255 45.781 105.350 1.00 0.00 H TER 20953 WAT 7818 ATOM 20953 O WAT 7819 30.256 64.739 74.771 1.00 0.00 O ATOM 20954 H1 WAT 7819 30.727 65.552 74.954 1.00 0.00 H ATOM 20955 H2 WAT 7819 30.517 64.147 75.477 1.00 0.00 H TER 20957 WAT 7819 ATOM 20957 O WAT 7820 18.666 77.015 125.524 1.00 0.00 O ATOM 20958 H1 WAT 7820 18.210 77.287 124.727 1.00 0.00 H ATOM 20959 H2 WAT 7820 19.372 76.448 125.213 1.00 0.00 H TER 20961 WAT 7820 ATOM 20961 O WAT 7821 39.672 34.738 100.234 1.00 0.00 O ATOM 20962 H1 WAT 7821 39.378 34.618 101.137 1.00 0.00 H ATOM 20963 H2 WAT 7821 40.416 34.141 100.143 1.00 0.00 H TER 20965 WAT 7821 ATOM 20965 O WAT 7822 84.475 82.278 139.962 1.00 0.00 O ATOM 20966 H1 WAT 7822 84.476 83.235 139.983 1.00 0.00 H ATOM 20967 H2 WAT 7822 83.965 82.022 140.730 1.00 0.00 H TER 20969 WAT 7822 ATOM 20969 O WAT 7823 62.544 60.358 11.684 1.00 0.00 O ATOM 20970 H1 WAT 7823 61.742 60.546 11.196 1.00 0.00 H ATOM 20971 H2 WAT 7823 62.970 61.210 11.781 1.00 0.00 H TER 20973 WAT 7823 ATOM 20973 O WAT 7824 58.510 27.616 17.661 1.00 0.00 O ATOM 20974 H1 WAT 7824 59.234 27.917 18.210 1.00 0.00 H ATOM 20975 H2 WAT 7824 58.261 28.387 17.151 1.00 0.00 H TER 20977 WAT 7824 ATOM 20977 O WAT 7825 18.503 85.913 83.745 1.00 0.00 O ATOM 20978 H1 WAT 7825 18.939 85.859 84.595 1.00 0.00 H ATOM 20979 H2 WAT 7825 17.570 85.842 83.950 1.00 0.00 H TER 20981 WAT 7825 ATOM 20981 O WAT 7826 41.136 122.875 148.675 1.00 0.00 O ATOM 20982 H1 WAT 7826 40.300 122.502 148.954 1.00 0.00 H ATOM 20983 H2 WAT 7826 41.654 122.120 148.396 1.00 0.00 H TER 20985 WAT 7826 ATOM 20985 O WAT 7827 78.927 39.445 127.202 1.00 0.00 O ATOM 20986 H1 WAT 7827 78.234 40.012 126.864 1.00 0.00 H ATOM 20987 H2 WAT 7827 79.438 40.010 127.782 1.00 0.00 H TER 20989 WAT 7827 ATOM 20989 O WAT 7828 86.313 88.528 136.455 1.00 0.00 O ATOM 20990 H1 WAT 7828 86.206 87.582 136.554 1.00 0.00 H ATOM 20991 H2 WAT 7828 85.421 88.862 136.361 1.00 0.00 H TER 20993 WAT 7828 ATOM 20993 O WAT 7829 35.474 96.633 130.622 1.00 0.00 O ATOM 20994 H1 WAT 7829 35.024 96.983 129.853 1.00 0.00 H ATOM 20995 H2 WAT 7829 35.787 97.408 131.089 1.00 0.00 H TER 20997 WAT 7829 ATOM 20997 O WAT 7830 63.257 136.817 10.606 1.00 0.00 O ATOM 20998 H1 WAT 7830 62.361 136.542 10.413 1.00 0.00 H ATOM 20999 H2 WAT 7830 63.647 136.065 11.053 1.00 0.00 H TER 21001 WAT 7830 ATOM 21001 O WAT 7831 111.086 17.599 115.039 1.00 0.00 O ATOM 21002 H1 WAT 7831 110.983 16.734 115.434 1.00 0.00 H ATOM 21003 H2 WAT 7831 110.249 18.036 115.196 1.00 0.00 H TER 21005 WAT 7831 ATOM 21005 O WAT 7832 60.329 131.343 10.927 1.00 0.00 O ATOM 21006 H1 WAT 7832 60.126 131.714 11.786 1.00 0.00 H ATOM 21007 H2 WAT 7832 60.764 132.054 10.456 1.00 0.00 H TER 21009 WAT 7832 ATOM 21009 O WAT 7833 41.571 30.217 95.306 1.00 0.00 O ATOM 21010 H1 WAT 7833 41.553 31.101 95.672 1.00 0.00 H ATOM 21011 H2 WAT 7833 40.720 30.117 94.878 1.00 0.00 H TER 21013 WAT 7833 ATOM 21013 O WAT 7834 117.700 39.483 128.600 1.00 0.00 O ATOM 21014 H1 WAT 7834 117.759 40.438 128.573 1.00 0.00 H ATOM 21015 H2 WAT 7834 118.369 39.184 127.983 1.00 0.00 H TER 21017 WAT 7834 ATOM 21017 O WAT 7835 123.954 19.348 84.478 1.00 0.00 O ATOM 21018 H1 WAT 7835 123.122 19.803 84.609 1.00 0.00 H ATOM 21019 H2 WAT 7835 123.704 18.453 84.249 1.00 0.00 H TER 21021 WAT 7835 ATOM 21021 O WAT 7836 84.495 37.904 157.969 1.00 0.00 O ATOM 21022 H1 WAT 7836 83.967 37.705 158.742 1.00 0.00 H ATOM 21023 H2 WAT 7836 85.011 38.670 158.222 1.00 0.00 H TER 21025 WAT 7836 ATOM 21025 O WAT 7837 133.662 44.593 54.738 1.00 0.00 O ATOM 21026 H1 WAT 7837 134.404 44.059 55.022 1.00 0.00 H ATOM 21027 H2 WAT 7837 132.967 43.960 54.558 1.00 0.00 H TER 21029 WAT 7837 ATOM 21029 O WAT 7838 11.002 82.153 12.932 1.00 0.00 O ATOM 21030 H1 WAT 7838 10.238 81.857 13.427 1.00 0.00 H ATOM 21031 H2 WAT 7838 10.658 82.362 12.064 1.00 0.00 H TER 21033 WAT 7838 ATOM 21033 O WAT 7839 16.972 11.873 75.258 1.00 0.00 O ATOM 21034 H1 WAT 7839 17.136 12.755 74.925 1.00 0.00 H ATOM 21035 H2 WAT 7839 17.610 11.760 75.963 1.00 0.00 H TER 21037 WAT 7839 ATOM 21037 O WAT 7840 127.556 107.977 67.300 1.00 0.00 O ATOM 21038 H1 WAT 7840 128.190 107.538 66.733 1.00 0.00 H ATOM 21039 H2 WAT 7840 127.297 108.758 66.810 1.00 0.00 H TER 21041 WAT 7840 ATOM 21041 O WAT 7841 107.688 29.561 53.739 1.00 0.00 O ATOM 21042 H1 WAT 7841 106.874 29.243 53.349 1.00 0.00 H ATOM 21043 H2 WAT 7841 107.518 30.483 53.930 1.00 0.00 H TER 21045 WAT 7841 ATOM 21045 O WAT 7842 16.588 96.182 95.660 1.00 0.00 O ATOM 21046 H1 WAT 7842 16.441 96.127 96.604 1.00 0.00 H ATOM 21047 H2 WAT 7842 15.924 96.798 95.350 1.00 0.00 H TER 21049 WAT 7842 ATOM 21049 O WAT 7843 39.225 134.538 81.674 1.00 0.00 O ATOM 21050 H1 WAT 7843 39.166 133.598 81.846 1.00 0.00 H ATOM 21051 H2 WAT 7843 38.958 134.949 82.496 1.00 0.00 H TER 21053 WAT 7843 ATOM 21053 O WAT 7844 106.707 128.141 70.495 1.00 0.00 O ATOM 21054 H1 WAT 7844 106.111 127.642 69.937 1.00 0.00 H ATOM 21055 H2 WAT 7844 106.366 129.035 70.470 1.00 0.00 H TER 21057 WAT 7844 ATOM 21057 O WAT 7845 103.672 55.034 70.480 1.00 0.00 O ATOM 21058 H1 WAT 7845 104.258 54.327 70.210 1.00 0.00 H ATOM 21059 H2 WAT 7845 104.240 55.802 70.551 1.00 0.00 H TER 21061 WAT 7845 ATOM 21061 O WAT 7846 10.604 32.073 85.726 1.00 0.00 O ATOM 21062 H1 WAT 7846 11.491 31.779 85.934 1.00 0.00 H ATOM 21063 H2 WAT 7846 10.074 31.779 86.467 1.00 0.00 H TER 21065 WAT 7846 ATOM 21065 O WAT 7847 82.212 82.724 94.166 1.00 0.00 O ATOM 21066 H1 WAT 7847 81.456 83.289 94.324 1.00 0.00 H ATOM 21067 H2 WAT 7847 82.016 82.287 93.337 1.00 0.00 H TER 21069 WAT 7847 ATOM 21069 O WAT 7848 42.808 114.382 116.411 1.00 0.00 O ATOM 21070 H1 WAT 7848 41.868 114.277 116.263 1.00 0.00 H ATOM 21071 H2 WAT 7848 43.118 113.500 116.617 1.00 0.00 H TER 21073 WAT 7848 ATOM 21073 O WAT 7849 20.642 109.821 70.812 1.00 0.00 O ATOM 21074 H1 WAT 7849 21.361 110.444 70.913 1.00 0.00 H ATOM 21075 H2 WAT 7849 20.817 109.146 71.469 1.00 0.00 H TER 21077 WAT 7849 ATOM 21077 O WAT 7850 132.365 22.529 138.731 1.00 0.00 O ATOM 21078 H1 WAT 7850 133.094 22.784 138.166 1.00 0.00 H ATOM 21079 H2 WAT 7850 132.536 22.975 139.560 1.00 0.00 H TER 21081 WAT 7850 ATOM 21081 O WAT 7851 70.825 37.946 4.422 1.00 0.00 O ATOM 21082 H1 WAT 7851 69.876 38.056 4.474 1.00 0.00 H ATOM 21083 H2 WAT 7851 70.970 37.017 4.604 1.00 0.00 H TER 21085 WAT 7851 ATOM 21085 O WAT 7852 105.146 46.753 143.098 1.00 0.00 O ATOM 21086 H1 WAT 7852 105.203 46.845 144.049 1.00 0.00 H ATOM 21087 H2 WAT 7852 104.459 46.100 142.961 1.00 0.00 H TER 21089 WAT 7852 ATOM 21089 O WAT 7853 36.254 139.519 21.402 1.00 0.00 O ATOM 21090 H1 WAT 7853 35.862 139.139 20.617 1.00 0.00 H ATOM 21091 H2 WAT 7853 36.986 138.938 21.610 1.00 0.00 H TER 21093 WAT 7853 ATOM 21093 O WAT 7854 25.137 72.556 78.075 1.00 0.00 O ATOM 21094 H1 WAT 7854 25.132 73.457 77.752 1.00 0.00 H ATOM 21095 H2 WAT 7854 24.574 72.575 78.849 1.00 0.00 H TER 21097 WAT 7854 ATOM 21097 O WAT 7855 101.071 62.006 3.703 1.00 0.00 O ATOM 21098 H1 WAT 7855 100.318 62.367 4.170 1.00 0.00 H ATOM 21099 H2 WAT 7855 100.902 61.064 3.669 1.00 0.00 H TER 21101 WAT 7855 ATOM 21101 O WAT 7856 84.960 20.706 133.836 1.00 0.00 O ATOM 21102 H1 WAT 7856 84.109 20.581 134.256 1.00 0.00 H ATOM 21103 H2 WAT 7856 85.547 20.950 134.552 1.00 0.00 H TER 21105 WAT 7856 ATOM 21105 O WAT 7857 48.752 142.896 116.414 1.00 0.00 O ATOM 21106 H1 WAT 7857 49.436 142.673 117.047 1.00 0.00 H ATOM 21107 H2 WAT 7857 48.929 143.808 116.182 1.00 0.00 H TER 21109 WAT 7857 ATOM 21109 O WAT 7858 50.721 28.812 65.011 1.00 0.00 O ATOM 21110 H1 WAT 7858 49.823 29.143 64.980 1.00 0.00 H ATOM 21111 H2 WAT 7858 50.903 28.702 65.944 1.00 0.00 H TER 21113 WAT 7858 ATOM 21113 O WAT 7859 115.073 140.031 0.938 1.00 0.00 O ATOM 21114 H1 WAT 7859 114.130 139.990 1.096 1.00 0.00 H ATOM 21115 H2 WAT 7859 115.175 140.714 0.276 1.00 0.00 H TER 21117 WAT 7859 ATOM 21117 O WAT 7860 123.330 106.986 148.078 1.00 0.00 O ATOM 21118 H1 WAT 7860 123.912 106.808 147.339 1.00 0.00 H ATOM 21119 H2 WAT 7860 122.988 106.127 148.326 1.00 0.00 H TER 21121 WAT 7860 ATOM 21121 O WAT 7861 69.719 71.427 4.264 1.00 0.00 O ATOM 21122 H1 WAT 7861 69.247 71.503 3.435 1.00 0.00 H ATOM 21123 H2 WAT 7861 70.541 71.894 4.115 1.00 0.00 H TER 21125 WAT 7861 ATOM 21125 O WAT 7862 42.017 18.160 13.351 1.00 0.00 O ATOM 21126 H1 WAT 7862 42.326 17.463 13.931 1.00 0.00 H ATOM 21127 H2 WAT 7862 42.702 18.240 12.687 1.00 0.00 H TER 21129 WAT 7862 ATOM 21129 O WAT 7863 78.932 53.070 5.459 1.00 0.00 O ATOM 21130 H1 WAT 7863 79.088 53.340 6.364 1.00 0.00 H ATOM 21131 H2 WAT 7863 77.980 53.000 5.390 1.00 0.00 H TER 21133 WAT 7863 ATOM 21133 O WAT 7864 112.186 11.319 70.199 1.00 0.00 O ATOM 21134 H1 WAT 7864 111.469 10.985 69.660 1.00 0.00 H ATOM 21135 H2 WAT 7864 112.078 12.270 70.180 1.00 0.00 H TER 21137 WAT 7864 ATOM 21137 O WAT 7865 101.156 5.067 59.723 1.00 0.00 O ATOM 21138 H1 WAT 7865 101.250 4.627 58.878 1.00 0.00 H ATOM 21139 H2 WAT 7865 100.222 5.005 59.923 1.00 0.00 H TER 21141 WAT 7865 ATOM 21141 O WAT 7866 31.387 39.633 123.603 1.00 0.00 O ATOM 21142 H1 WAT 7866 30.977 38.768 123.597 1.00 0.00 H ATOM 21143 H2 WAT 7866 31.508 39.846 122.678 1.00 0.00 H TER 21145 WAT 7866 ATOM 21145 O WAT 7867 33.707 51.851 84.745 1.00 0.00 O ATOM 21146 H1 WAT 7867 33.127 51.813 83.985 1.00 0.00 H ATOM 21147 H2 WAT 7867 33.340 52.547 85.291 1.00 0.00 H TER 21149 WAT 7867 ATOM 21149 O WAT 7868 48.699 10.527 72.004 1.00 0.00 O ATOM 21150 H1 WAT 7868 49.552 10.659 71.590 1.00 0.00 H ATOM 21151 H2 WAT 7868 48.893 10.469 72.939 1.00 0.00 H TER 21153 WAT 7868 ATOM 21153 O WAT 7869 0.052 38.835 8.558 1.00 0.00 O ATOM 21154 H1 WAT 7869 0.295 38.186 7.897 1.00 0.00 H ATOM 21155 H2 WAT 7869 -0.269 39.582 8.053 1.00 0.00 H TER 21157 WAT 7869 ATOM 21157 O WAT 7870 67.496 83.701 10.812 1.00 0.00 O ATOM 21158 H1 WAT 7870 67.854 84.551 10.557 1.00 0.00 H ATOM 21159 H2 WAT 7870 67.915 83.506 11.651 1.00 0.00 H TER 21161 WAT 7870 ATOM 21161 O WAT 7871 142.969 44.251 78.935 1.00 0.00 O ATOM 21162 H1 WAT 7871 143.471 44.453 79.725 1.00 0.00 H ATOM 21163 H2 WAT 7871 142.369 44.991 78.837 1.00 0.00 H TER 21165 WAT 7871 ATOM 21165 O WAT 7872 118.846 127.732 153.276 1.00 0.00 O ATOM 21166 H1 WAT 7872 119.594 127.956 152.722 1.00 0.00 H ATOM 21167 H2 WAT 7872 119.232 127.301 154.038 1.00 0.00 H TER 21169 WAT 7872 ATOM 21169 O WAT 7873 2.762 101.831 156.812 1.00 0.00 O ATOM 21170 H1 WAT 7873 2.293 102.580 157.180 1.00 0.00 H ATOM 21171 H2 WAT 7873 2.756 101.986 155.867 1.00 0.00 H TER 21173 WAT 7873 ATOM 21173 O WAT 7874 4.140 15.512 5.966 1.00 0.00 O ATOM 21174 H1 WAT 7874 3.591 16.062 5.407 1.00 0.00 H ATOM 21175 H2 WAT 7874 3.686 15.498 6.809 1.00 0.00 H TER 21177 WAT 7874 ATOM 21177 O WAT 7875 41.654 103.268 2.779 1.00 0.00 O ATOM 21178 H1 WAT 7875 42.340 103.375 2.120 1.00 0.00 H ATOM 21179 H2 WAT 7875 41.955 103.786 3.525 1.00 0.00 H TER 21181 WAT 7875 ATOM 21181 O WAT 7876 112.058 5.658 90.701 1.00 0.00 O ATOM 21182 H1 WAT 7876 111.737 4.757 90.753 1.00 0.00 H ATOM 21183 H2 WAT 7876 112.847 5.662 91.243 1.00 0.00 H TER 21185 WAT 7876 ATOM 21185 O WAT 7877 100.742 112.570 134.400 1.00 0.00 O ATOM 21186 H1 WAT 7877 100.880 112.655 135.343 1.00 0.00 H ATOM 21187 H2 WAT 7877 101.624 112.541 134.031 1.00 0.00 H TER 21189 WAT 7877 ATOM 21189 O WAT 7878 64.168 95.303 116.393 1.00 0.00 O ATOM 21190 H1 WAT 7878 63.408 95.029 115.879 1.00 0.00 H ATOM 21191 H2 WAT 7878 63.960 95.035 117.289 1.00 0.00 H TER 21193 WAT 7878 ATOM 21193 O WAT 7879 109.047 53.206 142.971 1.00 0.00 O ATOM 21194 H1 WAT 7879 109.556 54.010 143.068 1.00 0.00 H ATOM 21195 H2 WAT 7879 108.989 52.851 143.858 1.00 0.00 H TER 21197 WAT 7879 ATOM 21197 O WAT 7880 132.098 83.354 125.007 1.00 0.00 O ATOM 21198 H1 WAT 7880 132.293 83.091 124.108 1.00 0.00 H ATOM 21199 H2 WAT 7880 131.144 83.430 125.033 1.00 0.00 H TER 21201 WAT 7880 ATOM 21201 O WAT 7881 12.973 41.352 109.661 1.00 0.00 O ATOM 21202 H1 WAT 7881 13.027 40.404 109.539 1.00 0.00 H ATOM 21203 H2 WAT 7881 12.743 41.462 110.584 1.00 0.00 H TER 21205 WAT 7881 ATOM 21205 O WAT 7882 0.505 136.407 110.802 1.00 0.00 O ATOM 21206 H1 WAT 7882 0.921 137.268 110.832 1.00 0.00 H ATOM 21207 H2 WAT 7882 -0.086 136.453 110.050 1.00 0.00 H TER 21209 WAT 7882 ATOM 21209 O WAT 7883 109.948 15.363 79.402 1.00 0.00 O ATOM 21210 H1 WAT 7883 110.424 14.616 79.765 1.00 0.00 H ATOM 21211 H2 WAT 7883 110.548 16.102 79.506 1.00 0.00 H TER 21213 WAT 7883 ATOM 21213 O WAT 7884 81.104 39.774 132.343 1.00 0.00 O ATOM 21214 H1 WAT 7884 80.193 40.069 132.374 1.00 0.00 H ATOM 21215 H2 WAT 7884 81.046 38.841 132.139 1.00 0.00 H TER 21217 WAT 7884 ATOM 21217 O WAT 7885 46.447 70.442 100.289 1.00 0.00 O ATOM 21218 H1 WAT 7885 47.105 69.839 100.636 1.00 0.00 H ATOM 21219 H2 WAT 7885 46.937 71.237 100.082 1.00 0.00 H TER 21221 WAT 7885 ATOM 21221 O WAT 7886 24.074 57.793 67.492 1.00 0.00 O ATOM 21222 H1 WAT 7886 23.246 57.833 67.013 1.00 0.00 H ATOM 21223 H2 WAT 7886 24.704 57.458 66.855 1.00 0.00 H TER 21225 WAT 7886 ATOM 21225 O WAT 7887 27.532 10.968 8.098 1.00 0.00 O ATOM 21226 H1 WAT 7887 27.555 11.649 7.426 1.00 0.00 H ATOM 21227 H2 WAT 7887 26.861 10.356 7.796 1.00 0.00 H TER 21229 WAT 7887 ATOM 21229 O WAT 7888 60.363 21.669 91.808 1.00 0.00 O ATOM 21230 H1 WAT 7888 60.782 21.801 90.958 1.00 0.00 H ATOM 21231 H2 WAT 7888 59.570 21.171 91.609 1.00 0.00 H TER 21233 WAT 7888 ATOM 21233 O WAT 7889 103.410 74.820 6.817 1.00 0.00 O ATOM 21234 H1 WAT 7889 104.271 74.490 7.073 1.00 0.00 H ATOM 21235 H2 WAT 7889 103.283 74.493 5.926 1.00 0.00 H TER 21237 WAT 7889 ATOM 21237 O WAT 7890 39.403 58.971 118.221 1.00 0.00 O ATOM 21238 H1 WAT 7890 39.229 59.870 118.502 1.00 0.00 H ATOM 21239 H2 WAT 7890 38.577 58.510 118.368 1.00 0.00 H TER 21241 WAT 7890 ATOM 21241 O WAT 7891 109.013 33.004 136.053 1.00 0.00 O ATOM 21242 H1 WAT 7891 109.811 33.337 136.464 1.00 0.00 H ATOM 21243 H2 WAT 7891 108.302 33.409 136.549 1.00 0.00 H TER 21245 WAT 7891 ATOM 21245 O WAT 7892 59.611 5.193 93.045 1.00 0.00 O ATOM 21246 H1 WAT 7892 60.503 5.504 93.202 1.00 0.00 H ATOM 21247 H2 WAT 7892 59.583 5.011 92.105 1.00 0.00 H TER 21249 WAT 7892 ATOM 21249 O WAT 7893 7.160 2.968 66.222 1.00 0.00 O ATOM 21250 H1 WAT 7893 7.425 3.230 65.340 1.00 0.00 H ATOM 21251 H2 WAT 7893 7.232 3.769 66.742 1.00 0.00 H TER 21253 WAT 7893 ATOM 21253 O WAT 7894 13.894 96.827 128.351 1.00 0.00 O ATOM 21254 H1 WAT 7894 14.001 95.892 128.177 1.00 0.00 H ATOM 21255 H2 WAT 7894 13.338 97.141 127.638 1.00 0.00 H TER 21257 WAT 7894 ATOM 21257 O WAT 7895 109.362 15.712 8.899 1.00 0.00 O ATOM 21258 H1 WAT 7895 109.068 15.815 7.993 1.00 0.00 H ATOM 21259 H2 WAT 7895 109.333 16.597 9.262 1.00 0.00 H TER 21261 WAT 7895 ATOM 21261 O WAT 7896 37.389 136.069 7.437 1.00 0.00 O ATOM 21262 H1 WAT 7896 38.128 135.830 7.997 1.00 0.00 H ATOM 21263 H2 WAT 7896 37.291 137.013 7.562 1.00 0.00 H TER 21265 WAT 7896 ATOM 21265 O WAT 7897 105.938 75.898 158.809 1.00 0.00 O ATOM 21266 H1 WAT 7897 105.331 75.945 158.071 1.00 0.00 H ATOM 21267 H2 WAT 7897 106.749 75.558 158.430 1.00 0.00 H TER 21269 WAT 7897 ATOM 21269 O WAT 7898 32.472 139.337 113.663 1.00 0.00 O ATOM 21270 H1 WAT 7898 32.791 140.223 113.493 1.00 0.00 H ATOM 21271 H2 WAT 7898 32.428 139.277 114.617 1.00 0.00 H TER 21273 WAT 7898 ATOM 21273 O WAT 7899 30.343 70.436 123.690 1.00 0.00 O ATOM 21274 H1 WAT 7899 30.180 71.291 123.292 1.00 0.00 H ATOM 21275 H2 WAT 7899 30.957 70.616 124.402 1.00 0.00 H TER 21277 WAT 7899 ATOM 21277 O WAT 7900 83.064 136.877 156.184 1.00 0.00 O ATOM 21278 H1 WAT 7900 83.349 137.791 156.184 1.00 0.00 H ATOM 21279 H2 WAT 7900 82.148 136.912 155.910 1.00 0.00 H TER 21281 WAT 7900 ATOM 21281 O WAT 7901 134.677 4.360 143.529 1.00 0.00 O ATOM 21282 H1 WAT 7901 134.223 3.627 143.945 1.00 0.00 H ATOM 21283 H2 WAT 7901 135.430 4.527 144.095 1.00 0.00 H TER 21285 WAT 7901 ATOM 21285 O WAT 7902 52.107 3.856 142.809 1.00 0.00 O ATOM 21286 H1 WAT 7902 51.982 3.119 143.406 1.00 0.00 H ATOM 21287 H2 WAT 7902 51.953 3.488 141.939 1.00 0.00 H TER 21289 WAT 7902 ATOM 21289 O WAT 7903 117.129 99.294 133.885 1.00 0.00 O ATOM 21290 H1 WAT 7903 116.580 98.655 134.339 1.00 0.00 H ATOM 21291 H2 WAT 7903 116.945 99.150 132.956 1.00 0.00 H TER 21293 WAT 7903 ATOM 21293 O WAT 7904 70.506 105.222 17.230 1.00 0.00 O ATOM 21294 H1 WAT 7904 71.106 105.677 17.820 1.00 0.00 H ATOM 21295 H2 WAT 7904 70.774 105.501 16.354 1.00 0.00 H TER 21297 WAT 7904 ATOM 21297 O WAT 7905 97.960 106.345 7.408 1.00 0.00 O ATOM 21298 H1 WAT 7905 98.582 105.734 7.014 1.00 0.00 H ATOM 21299 H2 WAT 7905 98.496 106.905 7.969 1.00 0.00 H TER 21301 WAT 7905 ATOM 21301 O WAT 7906 74.010 145.305 114.465 1.00 0.00 O ATOM 21302 H1 WAT 7906 73.426 144.574 114.263 1.00 0.00 H ATOM 21303 H2 WAT 7906 73.439 146.073 114.465 1.00 0.00 H TER 21305 WAT 7906 ATOM 21305 O WAT 7907 9.680 94.374 99.033 1.00 0.00 O ATOM 21306 H1 WAT 7907 8.843 93.997 98.761 1.00 0.00 H ATOM 21307 H2 WAT 7907 9.439 95.098 99.611 1.00 0.00 H TER 21309 WAT 7907 ATOM 21309 O WAT 7908 0.424 39.512 60.749 1.00 0.00 O ATOM 21310 H1 WAT 7908 -0.016 39.809 61.545 1.00 0.00 H ATOM 21311 H2 WAT 7908 0.669 38.606 60.934 1.00 0.00 H TER 21313 WAT 7908 ATOM 21313 O WAT 7909 11.452 31.015 21.881 1.00 0.00 O ATOM 21314 H1 WAT 7909 11.642 30.841 22.803 1.00 0.00 H ATOM 21315 H2 WAT 7909 12.308 30.992 21.452 1.00 0.00 H TER 21317 WAT 7909 ATOM 21317 O WAT 7910 135.310 134.568 109.694 1.00 0.00 O ATOM 21318 H1 WAT 7910 135.459 134.637 110.637 1.00 0.00 H ATOM 21319 H2 WAT 7910 134.510 134.049 109.615 1.00 0.00 H TER 21321 WAT 7910 ATOM 21321 O WAT 7911 38.715 115.264 124.814 1.00 0.00 O ATOM 21322 H1 WAT 7911 38.530 115.641 125.674 1.00 0.00 H ATOM 21323 H2 WAT 7911 38.202 115.794 124.205 1.00 0.00 H TER 21325 WAT 7911 ATOM 21325 O WAT 7912 67.392 117.763 81.388 1.00 0.00 O ATOM 21326 H1 WAT 7912 68.266 117.789 81.777 1.00 0.00 H ATOM 21327 H2 WAT 7912 67.349 118.546 80.839 1.00 0.00 H TER 21329 WAT 7912 ATOM 21329 O WAT 7913 125.647 128.536 135.375 1.00 0.00 O ATOM 21330 H1 WAT 7913 125.282 127.702 135.671 1.00 0.00 H ATOM 21331 H2 WAT 7913 126.593 128.433 135.479 1.00 0.00 H TER 21333 WAT 7913 ATOM 21333 O WAT 7914 79.631 116.388 25.596 1.00 0.00 O ATOM 21334 H1 WAT 7914 79.311 116.671 24.739 1.00 0.00 H ATOM 21335 H2 WAT 7914 79.492 117.145 26.165 1.00 0.00 H TER 21337 WAT 7914 ATOM 21337 O WAT 7915 36.749 69.036 116.509 1.00 0.00 O ATOM 21338 H1 WAT 7915 36.301 68.312 116.946 1.00 0.00 H ATOM 21339 H2 WAT 7915 37.611 68.684 116.285 1.00 0.00 H TER 21341 WAT 7915 ATOM 21341 O WAT 7916 73.536 34.796 17.005 1.00 0.00 O ATOM 21342 H1 WAT 7916 73.496 34.267 16.208 1.00 0.00 H ATOM 21343 H2 WAT 7916 74.363 35.273 16.935 1.00 0.00 H TER 21345 WAT 7916 ATOM 21345 O WAT 7917 35.095 139.205 132.279 1.00 0.00 O ATOM 21346 H1 WAT 7917 35.583 139.850 132.791 1.00 0.00 H ATOM 21347 H2 WAT 7917 34.838 138.539 132.916 1.00 0.00 H TER 21349 WAT 7917 ATOM 21349 O WAT 7918 128.595 63.771 56.411 1.00 0.00 O ATOM 21350 H1 WAT 7918 128.542 63.182 57.164 1.00 0.00 H ATOM 21351 H2 WAT 7918 128.850 63.205 55.682 1.00 0.00 H TER 21353 WAT 7918 ATOM 21353 O WAT 7919 28.076 140.329 119.560 1.00 0.00 O ATOM 21354 H1 WAT 7919 28.184 140.680 120.444 1.00 0.00 H ATOM 21355 H2 WAT 7919 28.952 140.372 119.177 1.00 0.00 H TER 21357 WAT 7919 ATOM 21357 O WAT 7920 55.255 54.237 105.447 1.00 0.00 O ATOM 21358 H1 WAT 7920 55.569 55.126 105.610 1.00 0.00 H ATOM 21359 H2 WAT 7920 55.853 53.890 104.785 1.00 0.00 H TER 21361 WAT 7920 ATOM 21361 O WAT 7921 128.781 47.572 108.904 1.00 0.00 O ATOM 21362 H1 WAT 7921 128.316 46.877 108.439 1.00 0.00 H ATOM 21363 H2 WAT 7921 128.547 48.373 108.435 1.00 0.00 H TER 21365 WAT 7921 ATOM 21365 O WAT 7922 136.342 20.701 112.091 1.00 0.00 O ATOM 21366 H1 WAT 7922 136.196 19.872 111.635 1.00 0.00 H ATOM 21367 H2 WAT 7922 136.169 20.502 113.011 1.00 0.00 H TER 21369 WAT 7922 ATOM 21369 O WAT 7923 28.656 138.755 109.061 1.00 0.00 O ATOM 21370 H1 WAT 7923 28.452 138.986 109.967 1.00 0.00 H ATOM 21371 H2 WAT 7923 28.574 137.802 109.032 1.00 0.00 H TER 21373 WAT 7923 ATOM 21373 O WAT 7924 9.249 5.343 5.368 1.00 0.00 O ATOM 21374 H1 WAT 7924 9.224 5.571 6.297 1.00 0.00 H ATOM 21375 H2 WAT 7924 10.012 4.772 5.281 1.00 0.00 H TER 21377 WAT 7924 ATOM 21377 O WAT 7925 29.508 107.217 9.804 1.00 0.00 O ATOM 21378 H1 WAT 7925 29.548 107.367 8.859 1.00 0.00 H ATOM 21379 H2 WAT 7925 30.054 107.908 10.179 1.00 0.00 H TER 21381 WAT 7925 ATOM 21381 O WAT 7926 27.509 15.024 87.509 1.00 0.00 O ATOM 21382 H1 WAT 7926 27.390 15.974 87.516 1.00 0.00 H ATOM 21383 H2 WAT 7926 28.362 14.887 87.920 1.00 0.00 H TER 21385 WAT 7926 ATOM 21385 O WAT 7927 72.017 60.327 70.177 1.00 0.00 O ATOM 21386 H1 WAT 7927 72.434 59.466 70.212 1.00 0.00 H ATOM 21387 H2 WAT 7927 72.716 60.941 70.402 1.00 0.00 H TER 21389 WAT 7927 ATOM 21389 O WAT 7928 101.469 138.658 91.818 1.00 0.00 O ATOM 21390 H1 WAT 7928 101.873 137.821 91.588 1.00 0.00 H ATOM 21391 H2 WAT 7928 100.528 138.487 91.786 1.00 0.00 H TER 21393 WAT 7928 ATOM 21393 O WAT 7929 34.562 113.567 142.876 1.00 0.00 O ATOM 21394 H1 WAT 7929 34.896 114.358 142.452 1.00 0.00 H ATOM 21395 H2 WAT 7929 33.864 113.880 143.451 1.00 0.00 H TER 21397 WAT 7929 ATOM 21397 O WAT 7930 122.639 29.998 72.388 1.00 0.00 O ATOM 21398 H1 WAT 7930 123.227 29.681 71.702 1.00 0.00 H ATOM 21399 H2 WAT 7930 121.870 29.433 72.324 1.00 0.00 H TER 21401 WAT 7930 ATOM 21401 O WAT 7931 91.858 114.638 17.674 1.00 0.00 O ATOM 21402 H1 WAT 7931 91.071 114.118 17.508 1.00 0.00 H ATOM 21403 H2 WAT 7931 91.949 114.638 18.627 1.00 0.00 H TER 21405 WAT 7931 ATOM 21405 O WAT 7932 117.872 60.996 88.859 1.00 0.00 O ATOM 21406 H1 WAT 7932 117.399 60.397 88.282 1.00 0.00 H ATOM 21407 H2 WAT 7932 118.443 60.429 89.378 1.00 0.00 H TER 21409 WAT 7932 ATOM 21409 O WAT 7933 38.381 115.597 148.688 1.00 0.00 O ATOM 21410 H1 WAT 7933 39.246 115.829 149.024 1.00 0.00 H ATOM 21411 H2 WAT 7933 37.806 115.643 149.452 1.00 0.00 H TER 21413 WAT 7933 ATOM 21413 O WAT 7934 57.239 118.454 70.154 1.00 0.00 O ATOM 21414 H1 WAT 7934 57.609 118.996 70.851 1.00 0.00 H ATOM 21415 H2 WAT 7934 57.745 117.642 70.187 1.00 0.00 H TER 21417 WAT 7934 ATOM 21417 O WAT 7935 3.557 110.007 8.274 1.00 0.00 O ATOM 21418 H1 WAT 7935 4.005 110.635 7.706 1.00 0.00 H ATOM 21419 H2 WAT 7935 4.241 109.684 8.860 1.00 0.00 H TER 21421 WAT 7935 ATOM 21421 O WAT 7936 21.374 25.276 120.593 1.00 0.00 O ATOM 21422 H1 WAT 7936 20.521 24.847 120.526 1.00 0.00 H ATOM 21423 H2 WAT 7936 21.555 25.303 121.532 1.00 0.00 H TER 21425 WAT 7936 ATOM 21425 O WAT 7937 13.036 1.178 71.693 1.00 0.00 O ATOM 21426 H1 WAT 7937 12.084 1.154 71.797 1.00 0.00 H ATOM 21427 H2 WAT 7937 13.185 0.884 70.794 1.00 0.00 H TER 21429 WAT 7937 ATOM 21429 O WAT 7938 9.858 144.168 101.710 1.00 0.00 O ATOM 21430 H1 WAT 7938 9.128 144.166 101.090 1.00 0.00 H ATOM 21431 H2 WAT 7938 9.441 144.196 102.571 1.00 0.00 H TER 21433 WAT 7938 ATOM 21433 O WAT 7939 34.590 63.837 143.250 1.00 0.00 O ATOM 21434 H1 WAT 7939 34.063 64.439 142.725 1.00 0.00 H ATOM 21435 H2 WAT 7939 35.403 64.313 143.417 1.00 0.00 H TER 21437 WAT 7939 ATOM 21437 O WAT 7940 123.972 94.271 141.700 1.00 0.00 O ATOM 21438 H1 WAT 7940 124.603 93.897 141.085 1.00 0.00 H ATOM 21439 H2 WAT 7940 123.652 93.520 142.201 1.00 0.00 H TER 21441 WAT 7940 ATOM 21441 O WAT 7941 44.074 27.051 57.570 1.00 0.00 O ATOM 21442 H1 WAT 7941 43.212 26.792 57.895 1.00 0.00 H ATOM 21443 H2 WAT 7941 44.090 28.003 57.667 1.00 0.00 H TER 21445 WAT 7941 ATOM 21445 O WAT 7942 37.645 33.480 113.870 1.00 0.00 O ATOM 21446 H1 WAT 7942 37.080 32.720 114.006 1.00 0.00 H ATOM 21447 H2 WAT 7942 37.192 34.000 113.207 1.00 0.00 H TER 21449 WAT 7942 ATOM 21449 O WAT 7943 94.052 52.822 108.330 1.00 0.00 O ATOM 21450 H1 WAT 7943 94.270 51.915 108.115 1.00 0.00 H ATOM 21451 H2 WAT 7943 93.346 52.754 108.972 1.00 0.00 H TER 21453 WAT 7943 ATOM 21453 O WAT 7944 68.168 110.232 122.981 1.00 0.00 O ATOM 21454 H1 WAT 7944 69.049 110.180 123.352 1.00 0.00 H ATOM 21455 H2 WAT 7944 67.708 110.856 123.542 1.00 0.00 H TER 21457 WAT 7944 ATOM 21457 O WAT 7945 71.725 9.413 59.379 1.00 0.00 O ATOM 21458 H1 WAT 7945 71.173 9.204 60.133 1.00 0.00 H ATOM 21459 H2 WAT 7945 71.454 8.790 58.704 1.00 0.00 H TER 21461 WAT 7945 ATOM 21461 O WAT 7946 105.469 90.396 19.458 1.00 0.00 O ATOM 21462 H1 WAT 7946 104.650 89.931 19.286 1.00 0.00 H ATOM 21463 H2 WAT 7946 105.788 90.023 20.279 1.00 0.00 H TER 21465 WAT 7946 ATOM 21465 O WAT 7947 9.947 44.869 82.448 1.00 0.00 O ATOM 21466 H1 WAT 7947 10.447 44.074 82.260 1.00 0.00 H ATOM 21467 H2 WAT 7947 10.543 45.585 82.229 1.00 0.00 H TER 21469 WAT 7947 ATOM 21469 O WAT 7948 10.137 118.334 139.121 1.00 0.00 O ATOM 21470 H1 WAT 7948 10.169 117.785 139.905 1.00 0.00 H ATOM 21471 H2 WAT 7948 9.349 118.865 139.233 1.00 0.00 H TER 21473 WAT 7948 ATOM 21473 O WAT 7949 60.213 39.312 55.324 1.00 0.00 O ATOM 21474 H1 WAT 7949 60.602 39.191 56.190 1.00 0.00 H ATOM 21475 H2 WAT 7949 60.943 39.196 54.715 1.00 0.00 H TER 21477 WAT 7949 ATOM 21477 O WAT 7950 43.461 15.667 67.072 1.00 0.00 O ATOM 21478 H1 WAT 7950 42.738 16.190 66.727 1.00 0.00 H ATOM 21479 H2 WAT 7950 43.044 14.876 67.412 1.00 0.00 H TER 21481 WAT 7950 ATOM 21481 O WAT 7951 89.087 144.243 154.063 1.00 0.00 O ATOM 21482 H1 WAT 7951 88.670 145.101 154.147 1.00 0.00 H ATOM 21483 H2 WAT 7951 88.413 143.686 153.674 1.00 0.00 H TER 21485 WAT 7951 ATOM 21485 O WAT 7952 25.786 69.052 116.664 1.00 0.00 O ATOM 21486 H1 WAT 7952 25.242 69.798 116.412 1.00 0.00 H ATOM 21487 H2 WAT 7952 25.187 68.306 116.656 1.00 0.00 H TER 21489 WAT 7952 ATOM 21489 O WAT 7953 88.558 130.917 147.213 1.00 0.00 O ATOM 21490 H1 WAT 7953 88.803 131.454 146.459 1.00 0.00 H ATOM 21491 H2 WAT 7953 87.958 131.467 147.715 1.00 0.00 H TER 21493 WAT 7953 ATOM 21493 O WAT 7954 38.831 91.632 133.336 1.00 0.00 O ATOM 21494 H1 WAT 7954 38.789 90.742 132.986 1.00 0.00 H ATOM 21495 H2 WAT 7954 39.422 91.568 134.085 1.00 0.00 H TER 21497 WAT 7954 ATOM 21497 O WAT 7955 119.406 120.156 131.605 1.00 0.00 O ATOM 21498 H1 WAT 7955 119.540 120.376 130.683 1.00 0.00 H ATOM 21499 H2 WAT 7955 119.225 119.217 131.603 1.00 0.00 H TER 21501 WAT 7955 ATOM 21501 O WAT 7956 62.628 127.760 131.754 1.00 0.00 O ATOM 21502 H1 WAT 7956 61.940 128.414 131.628 1.00 0.00 H ATOM 21503 H2 WAT 7956 63.435 128.271 131.820 1.00 0.00 H TER 21505 WAT 7956 ATOM 21505 O WAT 7957 52.785 33.646 65.844 1.00 0.00 O ATOM 21506 H1 WAT 7957 52.314 32.929 66.268 1.00 0.00 H ATOM 21507 H2 WAT 7957 53.471 33.884 66.468 1.00 0.00 H TER 21509 WAT 7957 ATOM 21509 O WAT 7958 38.828 115.281 129.345 1.00 0.00 O ATOM 21510 H1 WAT 7958 38.679 114.359 129.133 1.00 0.00 H ATOM 21511 H2 WAT 7958 38.500 115.377 130.239 1.00 0.00 H TER 21513 WAT 7958 ATOM 21513 O WAT 7959 29.822 121.027 138.268 1.00 0.00 O ATOM 21514 H1 WAT 7959 30.570 120.442 138.147 1.00 0.00 H ATOM 21515 H2 WAT 7959 30.064 121.825 137.799 1.00 0.00 H TER 21517 WAT 7959 ATOM 21517 O WAT 7960 87.272 44.827 102.681 1.00 0.00 O ATOM 21518 H1 WAT 7960 88.012 44.221 102.721 1.00 0.00 H ATOM 21519 H2 WAT 7960 87.582 45.613 103.131 1.00 0.00 H TER 21521 WAT 7960 ATOM 21521 O WAT 7961 133.126 144.308 102.244 1.00 0.00 O ATOM 21522 H1 WAT 7961 133.124 143.370 102.052 1.00 0.00 H ATOM 21523 H2 WAT 7961 132.665 144.705 101.505 1.00 0.00 H TER 21525 WAT 7961 ATOM 21525 O WAT 7962 80.209 19.867 141.157 1.00 0.00 O ATOM 21526 H1 WAT 7962 80.259 18.934 141.366 1.00 0.00 H ATOM 21527 H2 WAT 7962 79.452 20.182 141.652 1.00 0.00 H TER 21529 WAT 7962 ATOM 21529 O WAT 7963 22.799 36.139 74.164 1.00 0.00 O ATOM 21530 H1 WAT 7963 22.804 36.689 73.380 1.00 0.00 H ATOM 21531 H2 WAT 7963 22.836 35.244 73.829 1.00 0.00 H TER 21533 WAT 7963 ATOM 21533 O WAT 7964 60.556 21.614 24.088 1.00 0.00 O ATOM 21534 H1 WAT 7964 59.677 21.237 24.059 1.00 0.00 H ATOM 21535 H2 WAT 7964 60.591 22.199 23.331 1.00 0.00 H TER 21537 WAT 7964 ATOM 21537 O WAT 7965 14.880 126.981 4.565 1.00 0.00 O ATOM 21538 H1 WAT 7965 14.688 127.918 4.533 1.00 0.00 H ATOM 21539 H2 WAT 7965 14.438 126.673 5.356 1.00 0.00 H TER 21541 WAT 7965 ATOM 21541 O WAT 7966 69.707 111.272 91.324 1.00 0.00 O ATOM 21542 H1 WAT 7966 70.356 110.580 91.453 1.00 0.00 H ATOM 21543 H2 WAT 7966 69.400 111.480 92.206 1.00 0.00 H TER 21545 WAT 7966 ATOM 21545 O WAT 7967 58.533 97.406 148.174 1.00 0.00 O ATOM 21546 H1 WAT 7967 58.170 98.284 148.290 1.00 0.00 H ATOM 21547 H2 WAT 7967 58.377 97.201 147.253 1.00 0.00 H TER 21549 WAT 7967 ATOM 21549 O WAT 7968 36.954 67.995 101.750 1.00 0.00 O ATOM 21550 H1 WAT 7968 36.593 68.836 102.028 1.00 0.00 H ATOM 21551 H2 WAT 7968 37.691 67.843 102.342 1.00 0.00 H TER 21553 WAT 7968 ATOM 21553 O WAT 7969 67.753 26.510 56.197 1.00 0.00 O ATOM 21554 H1 WAT 7969 68.409 26.172 56.807 1.00 0.00 H ATOM 21555 H2 WAT 7969 68.163 27.284 55.810 1.00 0.00 H TER 21557 WAT 7969 ATOM 21557 O WAT 7970 15.165 88.094 120.612 1.00 0.00 O ATOM 21558 H1 WAT 7970 15.390 89.006 120.426 1.00 0.00 H ATOM 21559 H2 WAT 7970 14.650 88.133 121.418 1.00 0.00 H TER 21561 WAT 7970 ATOM 21561 O WAT 7971 24.767 60.979 146.129 1.00 0.00 O ATOM 21562 H1 WAT 7971 23.955 60.967 146.636 1.00 0.00 H ATOM 21563 H2 WAT 7971 25.455 61.104 146.783 1.00 0.00 H TER 21565 WAT 7971 ATOM 21565 O WAT 7972 109.014 82.872 15.244 1.00 0.00 O ATOM 21566 H1 WAT 7972 109.245 83.402 16.006 1.00 0.00 H ATOM 21567 H2 WAT 7972 108.263 83.322 14.858 1.00 0.00 H TER 21569 WAT 7972 ATOM 21569 O WAT 7973 120.229 111.450 13.681 1.00 0.00 O ATOM 21570 H1 WAT 7973 119.440 110.994 13.388 1.00 0.00 H ATOM 21571 H2 WAT 7973 120.951 110.899 13.377 1.00 0.00 H TER 21573 WAT 7973 ATOM 21573 O WAT 7974 114.445 135.921 12.233 1.00 0.00 O ATOM 21574 H1 WAT 7974 113.498 135.900 12.375 1.00 0.00 H ATOM 21575 H2 WAT 7974 114.580 135.399 11.442 1.00 0.00 H TER 21577 WAT 7974 ATOM 21577 O WAT 7975 77.939 47.383 130.612 1.00 0.00 O ATOM 21578 H1 WAT 7975 78.769 46.922 130.486 1.00 0.00 H ATOM 21579 H2 WAT 7975 78.017 47.783 131.478 1.00 0.00 H TER 21581 WAT 7975 ATOM 21581 O WAT 7976 42.902 48.139 124.489 1.00 0.00 O ATOM 21582 H1 WAT 7976 42.181 47.699 124.038 1.00 0.00 H ATOM 21583 H2 WAT 7976 43.393 47.430 124.904 1.00 0.00 H TER 21585 WAT 7976 ATOM 21585 O WAT 7977 13.656 27.657 22.414 1.00 0.00 O ATOM 21586 H1 WAT 7977 13.878 28.305 21.745 1.00 0.00 H ATOM 21587 H2 WAT 7977 13.981 26.829 22.061 1.00 0.00 H TER 21589 WAT 7977 ATOM 21589 O WAT 7978 48.755 102.022 113.814 1.00 0.00 O ATOM 21590 H1 WAT 7978 48.888 102.562 113.035 1.00 0.00 H ATOM 21591 H2 WAT 7978 47.926 102.331 114.180 1.00 0.00 H TER 21593 WAT 7978 ATOM 21593 O WAT 7979 119.408 53.320 7.955 1.00 0.00 O ATOM 21594 H1 WAT 7979 119.065 52.843 8.710 1.00 0.00 H ATOM 21595 H2 WAT 7979 119.853 54.079 8.333 1.00 0.00 H TER 21597 WAT 7979 ATOM 21597 O WAT 7980 70.046 81.987 122.272 1.00 0.00 O ATOM 21598 H1 WAT 7980 70.926 82.364 122.291 1.00 0.00 H ATOM 21599 H2 WAT 7980 69.862 81.857 121.342 1.00 0.00 H TER 21601 WAT 7980 ATOM 21601 O WAT 7981 4.883 27.963 152.508 1.00 0.00 O ATOM 21602 H1 WAT 7981 5.691 28.167 152.036 1.00 0.00 H ATOM 21603 H2 WAT 7981 4.734 28.726 153.067 1.00 0.00 H TER 21605 WAT 7981 ATOM 21605 O WAT 7982 133.646 59.200 144.028 1.00 0.00 O ATOM 21606 H1 WAT 7982 133.603 58.252 144.157 1.00 0.00 H ATOM 21607 H2 WAT 7982 132.825 59.528 144.395 1.00 0.00 H TER 21609 WAT 7982 ATOM 21609 O WAT 7983 45.302 34.246 95.718 1.00 0.00 O ATOM 21610 H1 WAT 7983 44.722 35.005 95.657 1.00 0.00 H ATOM 21611 H2 WAT 7983 46.158 34.576 95.445 1.00 0.00 H TER 21613 WAT 7983 ATOM 21613 O WAT 7984 21.810 108.538 99.448 1.00 0.00 O ATOM 21614 H1 WAT 7984 22.068 108.085 100.251 1.00 0.00 H ATOM 21615 H2 WAT 7984 22.124 107.973 98.742 1.00 0.00 H TER 21617 WAT 7984 ATOM 21617 O WAT 7985 111.365 107.053 16.081 1.00 0.00 O ATOM 21618 H1 WAT 7985 110.994 107.483 15.311 1.00 0.00 H ATOM 21619 H2 WAT 7985 112.070 107.635 16.364 1.00 0.00 H TER 21621 WAT 7985 ATOM 21621 O WAT 7986 78.256 102.998 109.674 1.00 0.00 O ATOM 21622 H1 WAT 7986 78.358 102.901 108.727 1.00 0.00 H ATOM 21623 H2 WAT 7986 79.113 103.296 109.978 1.00 0.00 H TER 21625 WAT 7986 ATOM 21625 O WAT 7987 102.972 63.539 133.353 1.00 0.00 O ATOM 21626 H1 WAT 7987 102.403 63.237 132.646 1.00 0.00 H ATOM 21627 H2 WAT 7987 102.371 63.784 134.057 1.00 0.00 H TER 21629 WAT 7987 ATOM 21629 O WAT 7988 78.647 63.861 5.249 1.00 0.00 O ATOM 21630 H1 WAT 7988 78.512 64.802 5.362 1.00 0.00 H ATOM 21631 H2 WAT 7988 77.823 63.544 4.879 1.00 0.00 H TER 21633 WAT 7988 ATOM 21633 O WAT 7989 20.794 70.669 10.890 1.00 0.00 O ATOM 21634 H1 WAT 7989 20.423 69.803 11.059 1.00 0.00 H ATOM 21635 H2 WAT 7989 20.779 70.753 9.936 1.00 0.00 H TER 21637 WAT 7989 ATOM 21637 O WAT 7990 37.404 32.152 93.248 1.00 0.00 O ATOM 21638 H1 WAT 7990 37.830 32.491 92.461 1.00 0.00 H ATOM 21639 H2 WAT 7990 36.801 31.482 92.925 1.00 0.00 H TER 21641 WAT 7990 ATOM 21641 O WAT 7991 56.273 134.954 105.576 1.00 0.00 O ATOM 21642 H1 WAT 7991 56.312 134.015 105.398 1.00 0.00 H ATOM 21643 H2 WAT 7991 56.390 135.024 106.523 1.00 0.00 H TER 21645 WAT 7991 ATOM 21645 O WAT 7992 87.674 82.984 17.770 1.00 0.00 O ATOM 21646 H1 WAT 7992 87.782 83.409 16.920 1.00 0.00 H ATOM 21647 H2 WAT 7992 87.281 82.136 17.566 1.00 0.00 H TER 21649 WAT 7992 ATOM 21649 O WAT 7993 101.237 48.310 158.321 1.00 0.00 O ATOM 21650 H1 WAT 7993 101.818 47.579 158.111 1.00 0.00 H ATOM 21651 H2 WAT 7993 100.355 47.963 158.183 1.00 0.00 H TER 21653 WAT 7993 ATOM 21653 O WAT 7994 79.451 10.671 115.609 1.00 0.00 O ATOM 21654 H1 WAT 7994 79.483 11.082 116.473 1.00 0.00 H ATOM 21655 H2 WAT 7994 79.499 9.732 115.789 1.00 0.00 H TER 21657 WAT 7994 ATOM 21657 O WAT 7995 16.120 136.007 80.333 1.00 0.00 O ATOM 21658 H1 WAT 7995 16.522 135.140 80.284 1.00 0.00 H ATOM 21659 H2 WAT 7995 16.858 136.609 80.422 1.00 0.00 H TER 21661 WAT 7995 ATOM 21661 O WAT 7996 32.189 141.481 70.312 1.00 0.00 O ATOM 21662 H1 WAT 7996 31.553 141.497 71.026 1.00 0.00 H ATOM 21663 H2 WAT 7996 33.031 141.644 70.737 1.00 0.00 H TER 21665 WAT 7996 ATOM 21665 O WAT 7997 101.504 125.402 158.151 1.00 0.00 O ATOM 21666 H1 WAT 7997 102.138 125.055 158.779 1.00 0.00 H ATOM 21667 H2 WAT 7997 101.230 124.639 157.642 1.00 0.00 H TER 21669 WAT 7997 ATOM 21669 O WAT 7998 137.314 91.025 73.423 1.00 0.00 O ATOM 21670 H1 WAT 7998 137.326 90.072 73.338 1.00 0.00 H ATOM 21671 H2 WAT 7998 136.647 91.313 72.800 1.00 0.00 H TER 21673 WAT 7998 ATOM 21673 O WAT 7999 51.705 37.082 119.619 1.00 0.00 O ATOM 21674 H1 WAT 7999 51.581 36.405 120.284 1.00 0.00 H ATOM 21675 H2 WAT 7999 52.497 36.817 119.152 1.00 0.00 H TER 21677 WAT 7999 ATOM 21677 O WAT 8000 143.879 60.184 63.446 1.00 0.00 O ATOM 21678 H1 WAT 8000 143.462 60.837 64.008 1.00 0.00 H ATOM 21679 H2 WAT 8000 144.652 60.627 63.097 1.00 0.00 H TER 21681 WAT 8000 ATOM 21681 O WAT 8001 18.963 55.667 108.103 1.00 0.00 O ATOM 21682 H1 WAT 8001 19.734 56.232 108.060 1.00 0.00 H ATOM 21683 H2 WAT 8001 18.432 56.038 108.807 1.00 0.00 H TER 21685 WAT 8001 ATOM 21685 O WAT 8002 116.272 51.992 90.866 1.00 0.00 O ATOM 21686 H1 WAT 8002 115.503 51.747 91.382 1.00 0.00 H ATOM 21687 H2 WAT 8002 117.006 51.579 91.320 1.00 0.00 H TER 21689 WAT 8002 ATOM 21689 O WAT 8003 4.322 116.604 152.016 1.00 0.00 O ATOM 21690 H1 WAT 8003 3.895 117.116 151.329 1.00 0.00 H ATOM 21691 H2 WAT 8003 3.830 115.784 152.043 1.00 0.00 H TER 21693 WAT 8003 ATOM 21693 O WAT 8004 47.465 140.182 10.941 1.00 0.00 O ATOM 21694 H1 WAT 8004 48.021 139.886 10.221 1.00 0.00 H ATOM 21695 H2 WAT 8004 46.891 140.839 10.547 1.00 0.00 H TER 21697 WAT 8004 ATOM 21697 O WAT 8005 124.502 2.490 114.390 1.00 0.00 O ATOM 21698 H1 WAT 8005 124.245 3.265 114.889 1.00 0.00 H ATOM 21699 H2 WAT 8005 125.308 2.190 114.811 1.00 0.00 H TER 21701 WAT 8005 ATOM 21701 O WAT 8006 1.182 104.536 68.662 1.00 0.00 O ATOM 21702 H1 WAT 8006 1.586 104.822 69.481 1.00 0.00 H ATOM 21703 H2 WAT 8006 1.920 104.376 68.074 1.00 0.00 H TER 21705 WAT 8006 ATOM 21705 O WAT 8007 30.680 102.754 16.647 1.00 0.00 O ATOM 21706 H1 WAT 8007 30.337 103.152 15.847 1.00 0.00 H ATOM 21707 H2 WAT 8007 31.476 102.302 16.366 1.00 0.00 H TER 21709 WAT 8007 ATOM 21709 O WAT 8008 87.215 51.898 82.614 1.00 0.00 O ATOM 21710 H1 WAT 8008 86.482 52.351 82.198 1.00 0.00 H ATOM 21711 H2 WAT 8008 87.746 52.598 82.994 1.00 0.00 H TER 21713 WAT 8008 ATOM 21713 O WAT 8009 60.418 15.540 92.547 1.00 0.00 O ATOM 21714 H1 WAT 8009 60.889 15.079 93.241 1.00 0.00 H ATOM 21715 H2 WAT 8009 61.089 16.064 92.109 1.00 0.00 H TER 21717 WAT 8009 ATOM 21717 O WAT 8010 94.676 134.335 151.902 1.00 0.00 O ATOM 21718 H1 WAT 8010 95.563 133.976 151.882 1.00 0.00 H ATOM 21719 H2 WAT 8010 94.723 135.055 152.531 1.00 0.00 H TER 21721 WAT 8010 ATOM 21721 O WAT 8011 57.203 4.090 75.389 1.00 0.00 O ATOM 21722 H1 WAT 8011 57.842 3.396 75.228 1.00 0.00 H ATOM 21723 H2 WAT 8011 57.732 4.877 75.518 1.00 0.00 H TER 21725 WAT 8011 ATOM 21725 O WAT 8012 45.575 69.308 11.581 1.00 0.00 O ATOM 21726 H1 WAT 8012 45.983 68.761 12.252 1.00 0.00 H ATOM 21727 H2 WAT 8012 45.377 70.130 12.030 1.00 0.00 H TER 21729 WAT 8012 ATOM 21729 O WAT 8013 136.555 67.893 142.598 1.00 0.00 O ATOM 21730 H1 WAT 8013 135.771 68.414 142.427 1.00 0.00 H ATOM 21731 H2 WAT 8013 136.244 66.988 142.609 1.00 0.00 H TER 21733 WAT 8013 ATOM 21733 O WAT 8014 19.673 105.185 129.305 1.00 0.00 O ATOM 21734 H1 WAT 8014 20.036 105.975 129.705 1.00 0.00 H ATOM 21735 H2 WAT 8014 20.410 104.792 128.838 1.00 0.00 H TER 21737 WAT 8014 ATOM 21737 O WAT 8015 86.738 72.081 134.670 1.00 0.00 O ATOM 21738 H1 WAT 8015 87.532 72.605 134.569 1.00 0.00 H ATOM 21739 H2 WAT 8015 86.403 72.319 135.535 1.00 0.00 H TER 21741 WAT 8015 ATOM 21741 O WAT 8016 45.800 23.646 65.664 1.00 0.00 O ATOM 21742 H1 WAT 8016 46.102 22.924 65.113 1.00 0.00 H ATOM 21743 H2 WAT 8016 46.376 24.377 65.440 1.00 0.00 H TER 21745 WAT 8016 ATOM 21745 O WAT 8017 71.352 122.050 144.831 1.00 0.00 O ATOM 21746 H1 WAT 8017 71.624 121.417 145.495 1.00 0.00 H ATOM 21747 H2 WAT 8017 72.003 122.749 144.885 1.00 0.00 H TER 21749 WAT 8017 ATOM 21749 O WAT 8018 58.034 69.148 16.379 1.00 0.00 O ATOM 21750 H1 WAT 8018 58.769 69.751 16.482 1.00 0.00 H ATOM 21751 H2 WAT 8018 57.680 69.347 15.512 1.00 0.00 H TER 21753 WAT 8018 ATOM 21753 O WAT 8019 23.576 70.242 145.508 1.00 0.00 O ATOM 21754 H1 WAT 8019 22.896 70.534 146.115 1.00 0.00 H ATOM 21755 H2 WAT 8019 24.232 70.939 145.530 1.00 0.00 H TER 21757 WAT 8019 ATOM 21757 O WAT 8020 7.243 137.368 130.581 1.00 0.00 O ATOM 21758 H1 WAT 8020 8.024 137.911 130.689 1.00 0.00 H ATOM 21759 H2 WAT 8020 6.772 137.769 129.850 1.00 0.00 H TER 21761 WAT 8020 ATOM 21761 O WAT 8021 117.312 101.759 109.697 1.00 0.00 O ATOM 21762 H1 WAT 8021 117.043 102.667 109.841 1.00 0.00 H ATOM 21763 H2 WAT 8021 117.047 101.570 108.797 1.00 0.00 H TER 21765 WAT 8021 ATOM 21765 O WAT 8022 132.944 111.904 85.954 1.00 0.00 O ATOM 21766 H1 WAT 8022 132.534 111.356 86.624 1.00 0.00 H ATOM 21767 H2 WAT 8022 133.763 112.197 86.353 1.00 0.00 H TER 21769 WAT 8022 ATOM 21769 O WAT 8023 3.024 67.782 73.088 1.00 0.00 O ATOM 21770 H1 WAT 8023 3.694 67.911 73.760 1.00 0.00 H ATOM 21771 H2 WAT 8023 3.355 67.061 72.553 1.00 0.00 H TER 21773 WAT 8023 ATOM 21773 O WAT 8024 11.988 9.899 114.369 1.00 0.00 O ATOM 21774 H1 WAT 8024 12.299 10.545 115.003 1.00 0.00 H ATOM 21775 H2 WAT 8024 12.602 9.169 114.450 1.00 0.00 H TER 21777 WAT 8024 ATOM 21777 O WAT 8025 46.353 136.038 111.483 1.00 0.00 O ATOM 21778 H1 WAT 8025 47.167 136.498 111.689 1.00 0.00 H ATOM 21779 H2 WAT 8025 46.616 135.124 111.371 1.00 0.00 H TER 21781 WAT 8025 ATOM 21781 O WAT 8026 56.554 105.086 10.588 1.00 0.00 O ATOM 21782 H1 WAT 8026 56.412 104.489 9.853 1.00 0.00 H ATOM 21783 H2 WAT 8026 55.982 105.831 10.405 1.00 0.00 H TER 21785 WAT 8026 ATOM 21785 O WAT 8027 123.096 139.994 155.204 1.00 0.00 O ATOM 21786 H1 WAT 8027 122.917 140.915 155.016 1.00 0.00 H ATOM 21787 H2 WAT 8027 122.702 139.843 156.063 1.00 0.00 H TER 21789 WAT 8027 ATOM 21789 O WAT 8028 20.904 31.385 158.312 1.00 0.00 O ATOM 21790 H1 WAT 8028 21.232 30.826 157.608 1.00 0.00 H ATOM 21791 H2 WAT 8028 21.687 31.637 158.802 1.00 0.00 H TER 21793 WAT 8028 ATOM 21793 O WAT 8029 25.576 41.328 129.854 1.00 0.00 O ATOM 21794 H1 WAT 8029 25.623 40.384 130.002 1.00 0.00 H ATOM 21795 H2 WAT 8029 26.416 41.550 129.452 1.00 0.00 H TER 21797 WAT 8029 ATOM 21797 O WAT 8030 34.274 144.757 3.308 1.00 0.00 O ATOM 21798 H1 WAT 8030 34.966 145.318 2.960 1.00 0.00 H ATOM 21799 H2 WAT 8030 33.941 145.231 4.070 1.00 0.00 H TER 21801 WAT 8030 ATOM 21801 O WAT 8031 50.914 113.059 3.350 1.00 0.00 O ATOM 21802 H1 WAT 8031 51.481 112.345 3.641 1.00 0.00 H ATOM 21803 H2 WAT 8031 50.370 112.668 2.665 1.00 0.00 H TER 21805 WAT 8031 ATOM 21805 O WAT 8032 63.350 49.576 96.466 1.00 0.00 O ATOM 21806 H1 WAT 8032 64.241 49.417 96.154 1.00 0.00 H ATOM 21807 H2 WAT 8032 62.889 48.753 96.304 1.00 0.00 H TER 21809 WAT 8032 ATOM 21809 O WAT 8033 93.457 62.835 150.835 1.00 0.00 O ATOM 21810 H1 WAT 8033 92.952 63.289 150.160 1.00 0.00 H ATOM 21811 H2 WAT 8033 94.361 62.874 150.524 1.00 0.00 H TER 21813 WAT 8033 ATOM 21813 O WAT 8034 7.883 7.856 135.403 1.00 0.00 O ATOM 21814 H1 WAT 8034 7.864 8.687 134.928 1.00 0.00 H ATOM 21815 H2 WAT 8034 8.643 7.395 135.049 1.00 0.00 H TER 21817 WAT 8034 ATOM 21817 O WAT 8035 131.280 134.211 100.217 1.00 0.00 O ATOM 21818 H1 WAT 8035 131.224 133.581 99.499 1.00 0.00 H ATOM 21819 H2 WAT 8035 130.466 134.712 100.160 1.00 0.00 H TER 21821 WAT 8035 ATOM 21821 O WAT 8036 119.605 56.198 1.572 1.00 0.00 O ATOM 21822 H1 WAT 8036 119.991 56.538 0.765 1.00 0.00 H ATOM 21823 H2 WAT 8036 119.481 56.971 2.123 1.00 0.00 H TER 21825 WAT 8036 ATOM 21825 O WAT 8037 143.550 76.912 29.735 1.00 0.00 O ATOM 21826 H1 WAT 8037 142.790 77.461 29.925 1.00 0.00 H ATOM 21827 H2 WAT 8037 143.212 76.225 29.160 1.00 0.00 H TER 21829 WAT 8037 ATOM 21829 O WAT 8038 90.020 66.667 2.401 1.00 0.00 O ATOM 21830 H1 WAT 8038 90.962 66.625 2.238 1.00 0.00 H ATOM 21831 H2 WAT 8038 89.706 67.358 1.817 1.00 0.00 H TER 21833 WAT 8038 ATOM 21833 O WAT 8039 17.246 10.374 97.505 1.00 0.00 O ATOM 21834 H1 WAT 8039 17.157 11.254 97.140 1.00 0.00 H ATOM 21835 H2 WAT 8039 16.693 9.826 96.948 1.00 0.00 H TER 21837 WAT 8039 ATOM 21837 O WAT 8040 110.277 104.154 136.873 1.00 0.00 O ATOM 21838 H1 WAT 8040 110.867 104.542 136.226 1.00 0.00 H ATOM 21839 H2 WAT 8040 110.831 103.996 137.638 1.00 0.00 H TER 21841 WAT 8040 ATOM 21841 O WAT 8041 132.633 83.574 93.389 1.00 0.00 O ATOM 21842 H1 WAT 8041 133.447 84.048 93.562 1.00 0.00 H ATOM 21843 H2 WAT 8041 132.042 84.236 93.033 1.00 0.00 H TER 21845 WAT 8041 ATOM 21845 O WAT 8042 84.116 98.188 121.906 1.00 0.00 O ATOM 21846 H1 WAT 8042 84.531 98.148 121.045 1.00 0.00 H ATOM 21847 H2 WAT 8042 83.803 97.297 122.064 1.00 0.00 H TER 21849 WAT 8042 ATOM 21849 O WAT 8043 63.015 49.643 119.112 1.00 0.00 O ATOM 21850 H1 WAT 8043 62.673 50.506 119.347 1.00 0.00 H ATOM 21851 H2 WAT 8043 63.790 49.534 119.663 1.00 0.00 H TER 21853 WAT 8043 ATOM 21853 O WAT 8044 104.346 65.709 158.035 1.00 0.00 O ATOM 21854 H1 WAT 8044 105.017 66.031 157.432 1.00 0.00 H ATOM 21855 H2 WAT 8044 103.575 66.242 157.841 1.00 0.00 H TER 21857 WAT 8044 ATOM 21857 O WAT 8045 60.063 123.669 139.396 1.00 0.00 O ATOM 21858 H1 WAT 8045 60.105 124.305 138.681 1.00 0.00 H ATOM 21859 H2 WAT 8045 60.978 123.458 139.583 1.00 0.00 H TER 21861 WAT 8045 ATOM 21861 O WAT 8046 111.355 134.878 72.406 1.00 0.00 O ATOM 21862 H1 WAT 8046 111.307 135.760 72.039 1.00 0.00 H ATOM 21863 H2 WAT 8046 112.292 134.682 72.438 1.00 0.00 H TER 21865 WAT 8046 ATOM 21865 O WAT 8047 66.209 31.261 62.718 1.00 0.00 O ATOM 21866 H1 WAT 8047 65.278 31.366 62.524 1.00 0.00 H ATOM 21867 H2 WAT 8047 66.388 30.337 62.543 1.00 0.00 H TER 21869 WAT 8047 ATOM 21869 O WAT 8048 62.913 62.672 7.657 1.00 0.00 O ATOM 21870 H1 WAT 8048 62.426 63.079 8.374 1.00 0.00 H ATOM 21871 H2 WAT 8048 62.939 63.343 6.975 1.00 0.00 H TER 21873 WAT 8048 ATOM 21873 O WAT 8049 64.283 1.389 157.788 1.00 0.00 O ATOM 21874 H1 WAT 8049 64.784 0.657 158.148 1.00 0.00 H ATOM 21875 H2 WAT 8049 64.075 1.121 156.893 1.00 0.00 H TER 21877 WAT 8049 ATOM 21877 O WAT 8050 119.363 66.354 65.508 1.00 0.00 O ATOM 21878 H1 WAT 8050 119.290 66.886 64.715 1.00 0.00 H ATOM 21879 H2 WAT 8050 120.300 66.342 65.702 1.00 0.00 H TER 21881 WAT 8050 ATOM 21881 O WAT 8051 48.577 121.425 137.972 1.00 0.00 O ATOM 21882 H1 WAT 8051 49.169 120.684 137.844 1.00 0.00 H ATOM 21883 H2 WAT 8051 49.105 122.076 138.435 1.00 0.00 H TER 21885 WAT 8051 ATOM 21885 O WAT 8052 111.642 131.620 157.317 1.00 0.00 O ATOM 21886 H1 WAT 8052 112.389 131.946 157.820 1.00 0.00 H ATOM 21887 H2 WAT 8052 111.963 130.818 156.906 1.00 0.00 H TER 21889 WAT 8052 ATOM 21889 O WAT 8053 129.198 25.219 62.391 1.00 0.00 O ATOM 21890 H1 WAT 8053 128.745 24.394 62.220 1.00 0.00 H ATOM 21891 H2 WAT 8053 130.126 25.010 62.285 1.00 0.00 H TER 21893 WAT 8053 ATOM 21893 O WAT 8054 1.189 1.020 70.240 1.00 0.00 O ATOM 21894 H1 WAT 8054 1.350 0.416 69.515 1.00 0.00 H ATOM 21895 H2 WAT 8054 0.748 1.767 69.836 1.00 0.00 H TER 21897 WAT 8054 ATOM 21897 O WAT 8055 37.541 50.803 151.338 1.00 0.00 O ATOM 21898 H1 WAT 8055 37.491 50.449 150.450 1.00 0.00 H ATOM 21899 H2 WAT 8055 36.719 51.280 151.452 1.00 0.00 H TER 21901 WAT 8055 ATOM 21901 O WAT 8056 29.765 117.239 13.253 1.00 0.00 O ATOM 21902 H1 WAT 8056 30.586 116.930 12.870 1.00 0.00 H ATOM 21903 H2 WAT 8056 29.908 117.190 14.198 1.00 0.00 H TER 21905 WAT 8056 ATOM 21905 O WAT 8057 111.818 19.829 55.592 1.00 0.00 O ATOM 21906 H1 WAT 8057 112.652 20.299 55.587 1.00 0.00 H ATOM 21907 H2 WAT 8057 111.596 19.747 56.520 1.00 0.00 H TER 21909 WAT 8057 ATOM 21909 O WAT 8058 14.363 1.388 154.195 1.00 0.00 O ATOM 21910 H1 WAT 8058 13.934 2.064 153.669 1.00 0.00 H ATOM 21911 H2 WAT 8058 14.706 0.767 153.552 1.00 0.00 H TER 21913 WAT 8058 ATOM 21913 O WAT 8059 20.002 26.576 26.152 1.00 0.00 O ATOM 21914 H1 WAT 8059 20.910 26.819 26.335 1.00 0.00 H ATOM 21915 H2 WAT 8059 19.984 26.410 25.209 1.00 0.00 H TER 21917 WAT 8059 ATOM 21917 O WAT 8060 74.933 60.983 152.822 1.00 0.00 O ATOM 21918 H1 WAT 8060 75.020 60.147 152.364 1.00 0.00 H ATOM 21919 H2 WAT 8060 75.461 60.878 153.613 1.00 0.00 H TER 21921 WAT 8060 ATOM 21921 O WAT 8061 3.898 29.836 66.586 1.00 0.00 O ATOM 21922 H1 WAT 8061 4.235 29.771 65.692 1.00 0.00 H ATOM 21923 H2 WAT 8061 3.237 30.526 66.542 1.00 0.00 H TER 21925 WAT 8061 ATOM 21925 O WAT 8062 9.452 94.677 90.360 1.00 0.00 O ATOM 21926 H1 WAT 8062 9.709 95.498 89.940 1.00 0.00 H ATOM 21927 H2 WAT 8062 9.289 94.916 91.273 1.00 0.00 H TER 21929 WAT 8062 ATOM 21929 O WAT 8063 137.820 58.351 133.251 1.00 0.00 O ATOM 21930 H1 WAT 8063 137.686 57.752 133.985 1.00 0.00 H ATOM 21931 H2 WAT 8063 137.557 59.207 133.590 1.00 0.00 H TER 21933 WAT 8063 ATOM 21933 O WAT 8064 99.536 124.490 10.831 1.00 0.00 O ATOM 21934 H1 WAT 8064 98.987 125.265 10.949 1.00 0.00 H ATOM 21935 H2 WAT 8064 100.125 124.721 10.113 1.00 0.00 H TER 21937 WAT 8064 ATOM 21937 O WAT 8065 46.952 135.329 97.671 1.00 0.00 O ATOM 21938 H1 WAT 8065 46.237 134.718 97.491 1.00 0.00 H ATOM 21939 H2 WAT 8065 47.735 134.881 97.351 1.00 0.00 H TER 21941 WAT 8065 ATOM 21941 O WAT 8066 75.746 74.203 118.392 1.00 0.00 O ATOM 21942 H1 WAT 8066 74.831 73.931 118.458 1.00 0.00 H ATOM 21943 H2 WAT 8066 76.047 73.831 117.563 1.00 0.00 H TER 21945 WAT 8066 ATOM 21945 O WAT 8067 61.901 104.021 14.769 1.00 0.00 O ATOM 21946 H1 WAT 8067 61.475 104.736 15.241 1.00 0.00 H ATOM 21947 H2 WAT 8067 61.243 103.724 14.140 1.00 0.00 H TER 21949 WAT 8067 ATOM 21949 O WAT 8068 37.684 19.026 74.671 1.00 0.00 O ATOM 21950 H1 WAT 8068 37.404 18.509 73.916 1.00 0.00 H ATOM 21951 H2 WAT 8068 38.638 18.949 74.673 1.00 0.00 H TER 21953 WAT 8068 ATOM 21953 O WAT 8069 125.111 27.460 81.341 1.00 0.00 O ATOM 21954 H1 WAT 8069 125.663 26.968 81.948 1.00 0.00 H ATOM 21955 H2 WAT 8069 124.327 26.920 81.240 1.00 0.00 H TER 21957 WAT 8069 ATOM 21957 O WAT 8070 24.761 52.053 77.810 1.00 0.00 O ATOM 21958 H1 WAT 8070 25.032 52.962 77.678 1.00 0.00 H ATOM 21959 H2 WAT 8070 24.237 51.845 77.036 1.00 0.00 H TER 21961 WAT 8070 ATOM 21961 O WAT 8071 139.413 77.115 98.675 1.00 0.00 O ATOM 21962 H1 WAT 8071 139.266 77.663 97.905 1.00 0.00 H ATOM 21963 H2 WAT 8071 139.417 76.220 98.335 1.00 0.00 H TER 21965 WAT 8071 ATOM 21965 O WAT 8072 56.709 49.591 128.551 1.00 0.00 O ATOM 21966 H1 WAT 8072 57.332 50.270 128.812 1.00 0.00 H ATOM 21967 H2 WAT 8072 57.150 48.768 128.759 1.00 0.00 H TER 21969 WAT 8072 ATOM 21969 O WAT 8073 140.703 85.709 152.314 1.00 0.00 O ATOM 21970 H1 WAT 8073 139.925 85.808 152.863 1.00 0.00 H ATOM 21971 H2 WAT 8073 140.757 86.530 151.825 1.00 0.00 H TER 21973 WAT 8073 ATOM 21973 O WAT 8074 144.796 33.736 91.491 1.00 0.00 O ATOM 21974 H1 WAT 8074 145.376 34.313 91.987 1.00 0.00 H ATOM 21975 H2 WAT 8074 143.968 33.759 91.971 1.00 0.00 H TER 21977 WAT 8074 ATOM 21977 O WAT 8075 61.709 108.076 66.783 1.00 0.00 O ATOM 21978 H1 WAT 8075 62.463 107.857 66.236 1.00 0.00 H ATOM 21979 H2 WAT 8075 60.951 107.913 66.221 1.00 0.00 H TER 21981 WAT 8075 ATOM 21981 O WAT 8076 93.331 7.558 156.191 1.00 0.00 O ATOM 21982 H1 WAT 8076 92.605 7.457 155.575 1.00 0.00 H ATOM 21983 H2 WAT 8076 94.059 7.871 155.655 1.00 0.00 H TER 21985 WAT 8076 ATOM 21985 O WAT 8077 47.473 120.855 143.990 1.00 0.00 O ATOM 21986 H1 WAT 8077 46.590 120.492 143.928 1.00 0.00 H ATOM 21987 H2 WAT 8077 47.382 121.760 143.690 1.00 0.00 H TER 21989 WAT 8077 ATOM 21989 O WAT 8078 139.808 86.513 56.505 1.00 0.00 O ATOM 21990 H1 WAT 8078 139.984 86.077 57.338 1.00 0.00 H ATOM 21991 H2 WAT 8078 140.368 87.289 56.518 1.00 0.00 H TER 21993 WAT 8078 ATOM 21993 O WAT 8079 6.681 47.331 142.446 1.00 0.00 O ATOM 21994 H1 WAT 8079 6.618 46.714 141.718 1.00 0.00 H ATOM 21995 H2 WAT 8079 5.891 47.868 142.374 1.00 0.00 H TER 21997 WAT 8079 ATOM 21997 O WAT 8080 82.757 82.171 117.533 1.00 0.00 O ATOM 21998 H1 WAT 8080 83.475 82.802 117.482 1.00 0.00 H ATOM 21999 H2 WAT 8080 82.068 82.630 118.013 1.00 0.00 H TER 22001 WAT 8080 ATOM 22001 O WAT 8081 136.658 83.855 60.035 1.00 0.00 O ATOM 22002 H1 WAT 8081 136.389 84.743 60.269 1.00 0.00 H ATOM 22003 H2 WAT 8081 137.028 83.939 59.156 1.00 0.00 H TER 22005 WAT 8081 ATOM 22005 O WAT 8082 38.567 17.998 99.851 1.00 0.00 O ATOM 22006 H1 WAT 8082 38.660 17.224 99.296 1.00 0.00 H ATOM 22007 H2 WAT 8082 37.768 18.423 99.539 1.00 0.00 H TER 22009 WAT 8082 ATOM 22009 O WAT 8083 40.090 71.699 137.243 1.00 0.00 O ATOM 22010 H1 WAT 8083 40.657 71.924 137.980 1.00 0.00 H ATOM 22011 H2 WAT 8083 39.485 72.437 137.171 1.00 0.00 H TER 22013 WAT 8083 ATOM 22013 O WAT 8084 75.759 39.302 95.941 1.00 0.00 O ATOM 22014 H1 WAT 8084 76.395 38.794 95.437 1.00 0.00 H ATOM 22015 H2 WAT 8084 75.901 39.031 96.848 1.00 0.00 H TER 22017 WAT 8084 ATOM 22017 O WAT 8085 81.549 20.823 145.836 1.00 0.00 O ATOM 22018 H1 WAT 8085 82.052 20.792 145.022 1.00 0.00 H ATOM 22019 H2 WAT 8085 80.645 20.661 145.566 1.00 0.00 H TER 22021 WAT 8085 ATOM 22021 O WAT 8086 127.233 30.509 13.285 1.00 0.00 O ATOM 22022 H1 WAT 8086 127.994 30.266 12.757 1.00 0.00 H ATOM 22023 H2 WAT 8086 127.392 30.102 14.136 1.00 0.00 H TER 22025 WAT 8086 ATOM 22025 O WAT 8087 40.278 105.769 146.683 1.00 0.00 O ATOM 22026 H1 WAT 8087 39.711 105.143 147.134 1.00 0.00 H ATOM 22027 H2 WAT 8087 39.716 106.163 146.016 1.00 0.00 H TER 22029 WAT 8087 ATOM 22029 O WAT 8088 145.485 62.569 72.856 1.00 0.00 O ATOM 22030 H1 WAT 8088 145.490 63.091 73.659 1.00 0.00 H ATOM 22031 H2 WAT 8088 144.782 62.947 72.329 1.00 0.00 H TER 22033 WAT 8088 ATOM 22033 O WAT 8089 81.742 140.360 81.272 1.00 0.00 O ATOM 22034 H1 WAT 8089 80.973 140.885 81.053 1.00 0.00 H ATOM 22035 H2 WAT 8089 82.353 140.517 80.552 1.00 0.00 H TER 22037 WAT 8089 ATOM 22037 O WAT 8090 99.012 64.636 71.008 1.00 0.00 O ATOM 22038 H1 WAT 8090 99.269 65.183 70.265 1.00 0.00 H ATOM 22039 H2 WAT 8090 99.835 64.428 71.448 1.00 0.00 H TER 22041 WAT 8090 ATOM 22041 O WAT 8091 143.961 99.571 80.836 1.00 0.00 O ATOM 22042 H1 WAT 8091 143.663 98.775 81.277 1.00 0.00 H ATOM 22043 H2 WAT 8091 143.376 99.661 80.083 1.00 0.00 H TER 22045 WAT 8091 ATOM 22045 O WAT 8092 45.355 110.166 62.998 1.00 0.00 O ATOM 22046 H1 WAT 8092 45.548 111.091 62.842 1.00 0.00 H ATOM 22047 H2 WAT 8092 45.696 109.995 63.876 1.00 0.00 H TER 22049 WAT 8092 ATOM 22049 O WAT 8093 128.242 104.303 22.261 1.00 0.00 O ATOM 22050 H1 WAT 8093 127.587 104.908 21.913 1.00 0.00 H ATOM 22051 H2 WAT 8093 129.078 104.747 22.118 1.00 0.00 H TER 22053 WAT 8093 ATOM 22053 O WAT 8094 123.909 63.057 117.489 1.00 0.00 O ATOM 22054 H1 WAT 8094 124.013 63.781 118.106 1.00 0.00 H ATOM 22055 H2 WAT 8094 122.977 63.062 117.269 1.00 0.00 H TER 22057 WAT 8094 ATOM 22057 O WAT 8095 25.427 93.789 19.547 1.00 0.00 O ATOM 22058 H1 WAT 8095 25.659 94.668 19.845 1.00 0.00 H ATOM 22059 H2 WAT 8095 26.173 93.245 19.801 1.00 0.00 H TER 22061 WAT 8095 ATOM 22061 O WAT 8096 50.357 51.913 5.092 1.00 0.00 O ATOM 22062 H1 WAT 8096 49.429 52.128 5.007 1.00 0.00 H ATOM 22063 H2 WAT 8096 50.620 51.638 4.213 1.00 0.00 H TER 22065 WAT 8096 ATOM 22065 O WAT 8097 134.484 68.482 83.354 1.00 0.00 O ATOM 22066 H1 WAT 8097 133.715 68.965 83.052 1.00 0.00 H ATOM 22067 H2 WAT 8097 135.144 68.635 82.677 1.00 0.00 H TER 22069 WAT 8097 ATOM 22069 O WAT 8098 15.325 3.730 65.339 1.00 0.00 O ATOM 22070 H1 WAT 8098 15.647 4.579 65.037 1.00 0.00 H ATOM 22071 H2 WAT 8098 14.761 3.938 66.083 1.00 0.00 H TER 22073 WAT 8098 ATOM 22073 O WAT 8099 144.552 26.135 97.585 1.00 0.00 O ATOM 22074 H1 WAT 8099 144.581 25.931 98.520 1.00 0.00 H ATOM 22075 H2 WAT 8099 143.659 25.917 97.320 1.00 0.00 H TER 22077 WAT 8099 ATOM 22077 O WAT 8100 132.004 98.893 29.963 1.00 0.00 O ATOM 22078 H1 WAT 8100 132.393 98.594 30.785 1.00 0.00 H ATOM 22079 H2 WAT 8100 131.061 98.885 30.128 1.00 0.00 H TER 22081 WAT 8100 ATOM 22081 O WAT 8101 53.711 117.751 3.307 1.00 0.00 O ATOM 22082 H1 WAT 8101 54.371 117.762 2.614 1.00 0.00 H ATOM 22083 H2 WAT 8101 53.999 117.058 3.901 1.00 0.00 H TER 22085 WAT 8101 ATOM 22085 O WAT 8102 83.715 141.892 69.359 1.00 0.00 O ATOM 22086 H1 WAT 8102 83.128 141.683 68.633 1.00 0.00 H ATOM 22087 H2 WAT 8102 83.590 142.830 69.506 1.00 0.00 H TER 22089 WAT 8102 ATOM 22089 O WAT 8103 23.777 144.819 127.015 1.00 0.00 O ATOM 22090 H1 WAT 8103 23.164 144.439 127.644 1.00 0.00 H ATOM 22091 H2 WAT 8103 24.621 144.428 127.237 1.00 0.00 H TER 22093 WAT 8103 ATOM 22093 O WAT 8104 130.518 92.796 22.153 1.00 0.00 O ATOM 22094 H1 WAT 8104 130.660 92.638 23.086 1.00 0.00 H ATOM 22095 H2 WAT 8104 131.259 92.370 21.722 1.00 0.00 H TER 22097 WAT 8104 ATOM 22097 O WAT 8105 29.538 57.654 126.279 1.00 0.00 O ATOM 22098 H1 WAT 8105 29.852 56.763 126.128 1.00 0.00 H ATOM 22099 H2 WAT 8105 29.930 58.169 125.574 1.00 0.00 H TER 22101 WAT 8105 ATOM 22101 O WAT 8106 22.903 49.435 3.694 1.00 0.00 O ATOM 22102 H1 WAT 8106 22.595 48.764 3.085 1.00 0.00 H ATOM 22103 H2 WAT 8106 23.806 49.184 3.890 1.00 0.00 H TER 22105 WAT 8106 ATOM 22105 O WAT 8107 73.774 30.562 76.475 1.00 0.00 O ATOM 22106 H1 WAT 8107 72.992 30.958 76.089 1.00 0.00 H ATOM 22107 H2 WAT 8107 73.626 29.620 76.402 1.00 0.00 H TER 22109 WAT 8107 ATOM 22109 O WAT 8108 44.730 52.510 125.392 1.00 0.00 O ATOM 22110 H1 WAT 8108 44.056 51.935 125.754 1.00 0.00 H ATOM 22111 H2 WAT 8108 44.965 52.106 124.557 1.00 0.00 H TER 22113 WAT 8108 ATOM 22113 O WAT 8109 135.013 92.731 104.629 1.00 0.00 O ATOM 22114 H1 WAT 8109 134.142 92.381 104.820 1.00 0.00 H ATOM 22115 H2 WAT 8109 135.246 92.344 103.785 1.00 0.00 H TER 22117 WAT 8109 ATOM 22117 O WAT 8110 94.763 100.089 154.013 1.00 0.00 O ATOM 22118 H1 WAT 8110 93.969 100.624 153.998 1.00 0.00 H ATOM 22119 H2 WAT 8110 95.376 100.586 154.554 1.00 0.00 H TER 22121 WAT 8110 ATOM 22121 O WAT 8111 22.192 82.489 5.330 1.00 0.00 O ATOM 22122 H1 WAT 8111 21.859 83.374 5.475 1.00 0.00 H ATOM 22123 H2 WAT 8111 22.629 82.533 4.480 1.00 0.00 H TER 22125 WAT 8111 ATOM 22125 O WAT 8112 10.722 -0.057 76.855 1.00 0.00 O ATOM 22126 H1 WAT 8112 10.107 -0.015 77.587 1.00 0.00 H ATOM 22127 H2 WAT 8112 11.056 0.836 76.771 1.00 0.00 H TER 22129 WAT 8112 ATOM 22129 O WAT 8113 13.106 95.816 93.013 1.00 0.00 O ATOM 22130 H1 WAT 8113 13.726 96.475 92.700 1.00 0.00 H ATOM 22131 H2 WAT 8113 13.050 95.968 93.956 1.00 0.00 H TER 22133 WAT 8113 ATOM 22133 O WAT 8114 31.608 85.971 92.783 1.00 0.00 O ATOM 22134 H1 WAT 8114 31.142 86.556 92.186 1.00 0.00 H ATOM 22135 H2 WAT 8114 31.348 85.092 92.508 1.00 0.00 H TER 22137 WAT 8114 ATOM 22137 O WAT 8115 119.377 33.257 60.098 1.00 0.00 O ATOM 22138 H1 WAT 8115 120.124 32.667 59.998 1.00 0.00 H ATOM 22139 H2 WAT 8115 118.674 32.839 59.601 1.00 0.00 H TER 22141 WAT 8115 ATOM 22141 O WAT 8116 117.442 7.743 97.169 1.00 0.00 O ATOM 22142 H1 WAT 8116 116.701 7.140 97.120 1.00 0.00 H ATOM 22143 H2 WAT 8116 118.141 7.231 97.576 1.00 0.00 H TER 22145 WAT 8116 ATOM 22145 O WAT 8117 28.513 125.717 90.559 1.00 0.00 O ATOM 22146 H1 WAT 8117 27.606 125.720 90.865 1.00 0.00 H ATOM 22147 H2 WAT 8117 29.004 126.144 91.261 1.00 0.00 H TER 22149 WAT 8117 ATOM 22149 O WAT 8118 43.309 15.707 8.321 1.00 0.00 O ATOM 22150 H1 WAT 8118 42.697 15.721 9.056 1.00 0.00 H ATOM 22151 H2 WAT 8118 43.862 14.942 8.484 1.00 0.00 H TER 22153 WAT 8118 ATOM 22153 O WAT 8119 80.696 105.313 105.362 1.00 0.00 O ATOM 22154 H1 WAT 8119 81.265 104.543 105.356 1.00 0.00 H ATOM 22155 H2 WAT 8119 80.096 105.162 106.093 1.00 0.00 H TER 22157 WAT 8119 ATOM 22157 O WAT 8120 81.316 67.485 114.751 1.00 0.00 O ATOM 22158 H1 WAT 8120 81.513 67.683 115.666 1.00 0.00 H ATOM 22159 H2 WAT 8120 80.419 67.151 114.765 1.00 0.00 H TER 22161 WAT 8120 ATOM 22161 O WAT 8121 57.418 29.496 15.616 1.00 0.00 O ATOM 22162 H1 WAT 8121 58.225 30.000 15.519 1.00 0.00 H ATOM 22163 H2 WAT 8121 56.810 30.097 16.047 1.00 0.00 H TER 22165 WAT 8121 ATOM 22165 O WAT 8122 42.752 84.817 92.943 1.00 0.00 O ATOM 22166 H1 WAT 8122 42.984 85.134 92.071 1.00 0.00 H ATOM 22167 H2 WAT 8122 42.370 83.953 92.791 1.00 0.00 H TER 22169 WAT 8122 ATOM 22169 O WAT 8123 135.994 136.962 125.569 1.00 0.00 O ATOM 22170 H1 WAT 8123 136.211 136.968 124.637 1.00 0.00 H ATOM 22171 H2 WAT 8123 136.256 136.091 125.870 1.00 0.00 H TER 22173 WAT 8123 ATOM 22173 O WAT 8124 97.398 41.545 123.337 1.00 0.00 O ATOM 22174 H1 WAT 8124 97.726 40.649 123.259 1.00 0.00 H ATOM 22175 H2 WAT 8124 96.445 41.453 123.332 1.00 0.00 H TER 22177 WAT 8124 ATOM 22177 O WAT 8125 85.088 23.541 146.944 1.00 0.00 O ATOM 22178 H1 WAT 8125 85.996 23.238 146.941 1.00 0.00 H ATOM 22179 H2 WAT 8125 84.976 23.973 146.097 1.00 0.00 H TER 22181 WAT 8125 ATOM 22181 O WAT 8126 100.525 31.604 151.276 1.00 0.00 O ATOM 22182 H1 WAT 8126 100.609 32.053 150.435 1.00 0.00 H ATOM 22183 H2 WAT 8126 100.545 30.673 151.053 1.00 0.00 H TER 22185 WAT 8126 ATOM 22185 O WAT 8127 112.229 42.602 16.240 1.00 0.00 O ATOM 22186 H1 WAT 8127 112.279 42.857 15.319 1.00 0.00 H ATOM 22187 H2 WAT 8127 111.812 43.347 16.673 1.00 0.00 H TER 22189 WAT 8127 ATOM 22189 O WAT 8128 133.177 21.003 60.663 1.00 0.00 O ATOM 22190 H1 WAT 8128 132.912 21.151 59.755 1.00 0.00 H ATOM 22191 H2 WAT 8128 133.925 21.587 60.792 1.00 0.00 H TER 22193 WAT 8128 ATOM 22193 O WAT 8129 118.504 68.497 74.529 1.00 0.00 O ATOM 22194 H1 WAT 8129 118.636 67.975 75.321 1.00 0.00 H ATOM 22195 H2 WAT 8129 118.547 69.405 74.831 1.00 0.00 H TER 22197 WAT 8129 ATOM 22197 O WAT 8130 90.121 144.784 114.798 1.00 0.00 O ATOM 22198 H1 WAT 8130 89.949 145.505 114.192 1.00 0.00 H ATOM 22199 H2 WAT 8130 89.256 144.530 115.120 1.00 0.00 H TER 22201 WAT 8130 ATOM 22201 O WAT 8131 52.307 81.860 65.695 1.00 0.00 O ATOM 22202 H1 WAT 8131 52.425 81.213 66.391 1.00 0.00 H ATOM 22203 H2 WAT 8131 51.777 82.549 66.096 1.00 0.00 H TER 22205 WAT 8131 ATOM 22205 O WAT 8132 49.685 82.975 26.475 1.00 0.00 O ATOM 22206 H1 WAT 8132 48.929 82.761 25.929 1.00 0.00 H ATOM 22207 H2 WAT 8132 50.097 82.131 26.655 1.00 0.00 H TER 22209 WAT 8132 ATOM 22209 O WAT 8133 55.636 30.469 75.256 1.00 0.00 O ATOM 22210 H1 WAT 8133 55.013 30.036 75.840 1.00 0.00 H ATOM 22211 H2 WAT 8133 56.479 30.389 75.704 1.00 0.00 H TER 22213 WAT 8133 ATOM 22213 O WAT 8134 81.242 53.804 98.678 1.00 0.00 O ATOM 22214 H1 WAT 8134 81.399 54.227 97.834 1.00 0.00 H ATOM 22215 H2 WAT 8134 82.117 53.614 99.017 1.00 0.00 H TER 22217 WAT 8134 ATOM 22217 O WAT 8135 52.842 92.140 158.609 1.00 0.00 O ATOM 22218 H1 WAT 8135 53.448 91.484 158.955 1.00 0.00 H ATOM 22219 H2 WAT 8135 52.848 91.995 157.663 1.00 0.00 H TER 22221 WAT 8135 ATOM 22221 O WAT 8136 70.018 78.652 52.100 1.00 0.00 O ATOM 22222 H1 WAT 8136 70.879 78.323 52.360 1.00 0.00 H ATOM 22223 H2 WAT 8136 69.487 77.866 51.981 1.00 0.00 H TER 22225 WAT 8136 ATOM 22225 O WAT 8137 37.932 98.441 70.897 1.00 0.00 O ATOM 22226 H1 WAT 8137 38.609 97.777 71.033 1.00 0.00 H ATOM 22227 H2 WAT 8137 37.225 97.974 70.451 1.00 0.00 H TER 22229 WAT 8137 ATOM 22229 O WAT 8138 134.042 26.900 7.190 1.00 0.00 O ATOM 22230 H1 WAT 8138 134.727 26.803 7.851 1.00 0.00 H ATOM 22231 H2 WAT 8138 133.783 27.819 7.246 1.00 0.00 H TER 22233 WAT 8138 ATOM 22233 O WAT 8139 136.738 81.721 20.491 1.00 0.00 O ATOM 22234 H1 WAT 8139 136.886 81.803 21.433 1.00 0.00 H ATOM 22235 H2 WAT 8139 136.460 82.594 20.215 1.00 0.00 H TER 22237 WAT 8139 ATOM 22237 O WAT 8140 133.109 89.538 151.980 1.00 0.00 O ATOM 22238 H1 WAT 8140 133.763 90.096 151.559 1.00 0.00 H ATOM 22239 H2 WAT 8140 132.904 89.986 152.800 1.00 0.00 H TER 22241 WAT 8140 ATOM 22241 O WAT 8141 86.736 36.249 138.927 1.00 0.00 O ATOM 22242 H1 WAT 8141 86.758 36.528 138.012 1.00 0.00 H ATOM 22243 H2 WAT 8141 86.894 35.306 138.894 1.00 0.00 H TER 22245 WAT 8141 ATOM 22245 O WAT 8142 94.060 137.320 152.622 1.00 0.00 O ATOM 22246 H1 WAT 8142 93.122 137.512 152.617 1.00 0.00 H ATOM 22247 H2 WAT 8142 94.388 137.747 153.413 1.00 0.00 H TER 22249 WAT 8142 ATOM 22249 O WAT 8143 119.604 75.610 2.848 1.00 0.00 O ATOM 22250 H1 WAT 8143 119.523 76.433 2.366 1.00 0.00 H ATOM 22251 H2 WAT 8143 120.444 75.249 2.567 1.00 0.00 H TER 22253 WAT 8143 ATOM 22253 O WAT 8144 113.271 90.898 154.058 1.00 0.00 O ATOM 22254 H1 WAT 8144 113.615 90.179 153.528 1.00 0.00 H ATOM 22255 H2 WAT 8144 113.506 91.688 153.571 1.00 0.00 H TER 22257 WAT 8144 ATOM 22257 O WAT 8145 16.239 66.498 114.244 1.00 0.00 O ATOM 22258 H1 WAT 8145 15.473 66.864 114.686 1.00 0.00 H ATOM 22259 H2 WAT 8145 16.686 67.257 113.871 1.00 0.00 H TER 22261 WAT 8145 ATOM 22261 O WAT 8146 71.578 66.228 72.907 1.00 0.00 O ATOM 22262 H1 WAT 8146 71.325 65.435 72.435 1.00 0.00 H ATOM 22263 H2 WAT 8146 72.201 66.664 72.326 1.00 0.00 H TER 22265 WAT 8146 ATOM 22265 O WAT 8147 138.449 3.386 118.463 1.00 0.00 O ATOM 22266 H1 WAT 8147 138.859 4.249 118.419 1.00 0.00 H ATOM 22267 H2 WAT 8147 138.588 3.100 119.365 1.00 0.00 H TER 22269 WAT 8147 ATOM 22269 O WAT 8148 40.179 136.063 86.376 1.00 0.00 O ATOM 22270 H1 WAT 8148 40.584 136.930 86.385 1.00 0.00 H ATOM 22271 H2 WAT 8148 39.438 136.138 86.977 1.00 0.00 H TER 22273 WAT 8148 ATOM 22273 O WAT 8149 47.462 2.902 100.540 1.00 0.00 O ATOM 22274 H1 WAT 8149 46.530 2.732 100.405 1.00 0.00 H ATOM 22275 H2 WAT 8149 47.553 3.001 101.487 1.00 0.00 H TER 22277 WAT 8149 ATOM 22277 O WAT 8150 50.444 43.270 119.191 1.00 0.00 O ATOM 22278 H1 WAT 8150 50.670 42.394 119.506 1.00 0.00 H ATOM 22279 H2 WAT 8150 51.229 43.570 118.733 1.00 0.00 H TER 22281 WAT 8150 ATOM 22281 O WAT 8151 122.915 92.356 9.563 1.00 0.00 O ATOM 22282 H1 WAT 8151 122.203 92.389 10.202 1.00 0.00 H ATOM 22283 H2 WAT 8151 122.554 91.861 8.828 1.00 0.00 H TER 22285 WAT 8151 ATOM 22285 O WAT 8152 11.851 52.942 59.877 1.00 0.00 O ATOM 22286 H1 WAT 8152 12.615 53.411 60.213 1.00 0.00 H ATOM 22287 H2 WAT 8152 11.639 53.386 59.056 1.00 0.00 H TER 22289 WAT 8152 ATOM 22289 O WAT 8153 99.619 137.388 82.622 1.00 0.00 O ATOM 22290 H1 WAT 8153 99.123 138.015 83.148 1.00 0.00 H ATOM 22291 H2 WAT 8153 99.010 137.119 81.934 1.00 0.00 H TER 22293 WAT 8153 ATOM 22293 O WAT 8154 47.765 123.374 12.148 1.00 0.00 O ATOM 22294 H1 WAT 8154 48.442 122.940 12.668 1.00 0.00 H ATOM 22295 H2 WAT 8154 47.330 122.661 11.680 1.00 0.00 H TER 22297 WAT 8154 ATOM 22297 O WAT 8155 133.001 129.408 129.223 1.00 0.00 O ATOM 22298 H1 WAT 8155 133.235 130.153 128.670 1.00 0.00 H ATOM 22299 H2 WAT 8155 132.615 128.774 128.620 1.00 0.00 H TER 22301 WAT 8155 ATOM 22301 O WAT 8156 81.226 119.273 126.154 1.00 0.00 O ATOM 22302 H1 WAT 8156 80.483 119.579 126.675 1.00 0.00 H ATOM 22303 H2 WAT 8156 81.959 119.819 126.439 1.00 0.00 H TER 22305 WAT 8156 ATOM 22305 O WAT 8157 53.764 138.736 2.054 1.00 0.00 O ATOM 22306 H1 WAT 8157 54.708 138.613 2.160 1.00 0.00 H ATOM 22307 H2 WAT 8157 53.455 137.908 1.687 1.00 0.00 H TER 22309 WAT 8157 ATOM 22309 O WAT 8158 57.002 138.621 15.544 1.00 0.00 O ATOM 22310 H1 WAT 8158 57.658 138.065 15.964 1.00 0.00 H ATOM 22311 H2 WAT 8158 56.367 138.807 16.235 1.00 0.00 H TER 22313 WAT 8158 ATOM 22313 O WAT 8159 17.644 80.204 153.839 1.00 0.00 O ATOM 22314 H1 WAT 8159 17.940 81.111 153.910 1.00 0.00 H ATOM 22315 H2 WAT 8159 17.369 79.971 154.726 1.00 0.00 H TER 22317 WAT 8159 ATOM 22317 O WAT 8160 132.352 91.248 109.099 1.00 0.00 O ATOM 22318 H1 WAT 8160 131.571 90.965 108.623 1.00 0.00 H ATOM 22319 H2 WAT 8160 132.071 91.294 110.013 1.00 0.00 H TER 22321 WAT 8160 ATOM 22321 O WAT 8161 54.619 74.791 154.974 1.00 0.00 O ATOM 22322 H1 WAT 8161 55.135 73.994 155.096 1.00 0.00 H ATOM 22323 H2 WAT 8161 53.898 74.525 154.403 1.00 0.00 H TER 22325 WAT 8161 ATOM 22325 O WAT 8162 35.324 108.647 92.853 1.00 0.00 O ATOM 22326 H1 WAT 8162 34.624 108.886 92.246 1.00 0.00 H ATOM 22327 H2 WAT 8162 35.590 109.477 93.251 1.00 0.00 H TER 22329 WAT 8162 ATOM 22329 O WAT 8163 19.978 140.517 100.869 1.00 0.00 O ATOM 22330 H1 WAT 8163 20.417 141.256 101.292 1.00 0.00 H ATOM 22331 H2 WAT 8163 20.343 139.744 101.300 1.00 0.00 H TER 22333 WAT 8163 ATOM 22333 O WAT 8164 81.259 130.642 118.015 1.00 0.00 O ATOM 22334 H1 WAT 8164 82.189 130.533 118.212 1.00 0.00 H ATOM 22335 H2 WAT 8164 81.179 130.399 117.093 1.00 0.00 H TER 22337 WAT 8164 ATOM 22337 O WAT 8165 112.372 94.962 106.712 1.00 0.00 O ATOM 22338 H1 WAT 8165 111.909 95.569 106.134 1.00 0.00 H ATOM 22339 H2 WAT 8165 113.186 94.764 106.247 1.00 0.00 H TER 22341 WAT 8165 ATOM 22341 O WAT 8166 138.389 89.890 143.729 1.00 0.00 O ATOM 22342 H1 WAT 8166 138.657 88.971 143.716 1.00 0.00 H ATOM 22343 H2 WAT 8166 138.817 90.275 142.965 1.00 0.00 H TER 22345 WAT 8166 ATOM 22345 O WAT 8167 121.707 63.856 70.268 1.00 0.00 O ATOM 22346 H1 WAT 8167 121.583 63.631 69.346 1.00 0.00 H ATOM 22347 H2 WAT 8167 122.179 64.689 70.249 1.00 0.00 H TER 22349 WAT 8167 ATOM 22349 O WAT 8168 130.548 5.895 96.656 1.00 0.00 O ATOM 22350 H1 WAT 8168 130.186 5.686 95.794 1.00 0.00 H ATOM 22351 H2 WAT 8168 131.496 5.829 96.539 1.00 0.00 H TER 22353 WAT 8168 ATOM 22353 O WAT 8169 7.109 102.355 21.332 1.00 0.00 O ATOM 22354 H1 WAT 8169 7.383 102.610 22.213 1.00 0.00 H ATOM 22355 H2 WAT 8169 6.248 102.759 21.223 1.00 0.00 H TER 22357 WAT 8169 ATOM 22357 O WAT 8170 100.792 88.544 88.680 1.00 0.00 O ATOM 22358 H1 WAT 8170 100.315 87.858 88.212 1.00 0.00 H ATOM 22359 H2 WAT 8170 100.241 88.746 89.436 1.00 0.00 H TER 22361 WAT 8170 ATOM 22361 O WAT 8171 24.973 86.064 122.569 1.00 0.00 O ATOM 22362 H1 WAT 8171 24.144 86.498 122.770 1.00 0.00 H ATOM 22363 H2 WAT 8171 25.629 86.758 122.635 1.00 0.00 H TER 22365 WAT 8171 ATOM 22365 O WAT 8172 13.135 135.370 105.639 1.00 0.00 O ATOM 22366 H1 WAT 8172 12.347 135.846 105.898 1.00 0.00 H ATOM 22367 H2 WAT 8172 13.393 135.769 104.808 1.00 0.00 H TER 22369 WAT 8172 ATOM 22369 O WAT 8173 126.246 21.832 87.623 1.00 0.00 O ATOM 22370 H1 WAT 8173 125.825 21.738 86.768 1.00 0.00 H ATOM 22371 H2 WAT 8173 127.141 21.523 87.484 1.00 0.00 H TER 22373 WAT 8173 ATOM 22373 O WAT 8174 64.694 1.475 111.631 1.00 0.00 O ATOM 22374 H1 WAT 8174 65.506 1.311 112.110 1.00 0.00 H ATOM 22375 H2 WAT 8174 64.666 2.426 111.527 1.00 0.00 H TER 22377 WAT 8174 ATOM 22377 O WAT 8175 130.745 116.933 139.089 1.00 0.00 O ATOM 22378 H1 WAT 8175 130.062 116.262 139.089 1.00 0.00 H ATOM 22379 H2 WAT 8175 130.329 117.700 138.697 1.00 0.00 H TER 22381 WAT 8175 ATOM 22381 O WAT 8176 50.317 114.894 14.383 1.00 0.00 O ATOM 22382 H1 WAT 8176 50.792 115.688 14.630 1.00 0.00 H ATOM 22383 H2 WAT 8176 50.424 114.308 15.133 1.00 0.00 H TER 22385 WAT 8176 ATOM 22385 O WAT 8177 85.669 36.994 127.230 1.00 0.00 O ATOM 22386 H1 WAT 8177 85.314 36.523 127.983 1.00 0.00 H ATOM 22387 H2 WAT 8177 86.484 37.381 127.551 1.00 0.00 H TER 22389 WAT 8177 ATOM 22389 O WAT 8178 9.286 5.572 10.551 1.00 0.00 O ATOM 22390 H1 WAT 8178 8.736 5.076 11.158 1.00 0.00 H ATOM 22391 H2 WAT 8178 9.223 6.477 10.857 1.00 0.00 H TER 22393 WAT 8178 ATOM 22393 O WAT 8179 24.255 10.203 67.462 1.00 0.00 O ATOM 22394 H1 WAT 8179 24.459 9.560 66.782 1.00 0.00 H ATOM 22395 H2 WAT 8179 24.747 10.984 67.209 1.00 0.00 H TER 22397 WAT 8179 ATOM 22397 O WAT 8180 -0.030 27.059 73.675 1.00 0.00 O ATOM 22398 H1 WAT 8180 0.923 26.974 73.717 1.00 0.00 H ATOM 22399 H2 WAT 8180 -0.178 27.836 73.135 1.00 0.00 H TER 22401 WAT 8180 ATOM 22401 O WAT 8181 15.117 34.048 63.495 1.00 0.00 O ATOM 22402 H1 WAT 8181 14.205 34.235 63.270 1.00 0.00 H ATOM 22403 H2 WAT 8181 15.205 34.343 64.401 1.00 0.00 H TER 22405 WAT 8181 ATOM 22405 O WAT 8182 71.176 135.070 77.754 1.00 0.00 O ATOM 22406 H1 WAT 8182 71.660 135.494 78.463 1.00 0.00 H ATOM 22407 H2 WAT 8182 71.506 134.172 77.743 1.00 0.00 H TER 22409 WAT 8182 ATOM 22409 O WAT 8183 26.657 75.187 126.560 1.00 0.00 O ATOM 22410 H1 WAT 8183 26.410 75.137 127.484 1.00 0.00 H ATOM 22411 H2 WAT 8183 25.862 75.481 126.116 1.00 0.00 H TER 22413 WAT 8183 ATOM 22413 O WAT 8184 117.822 143.412 0.258 1.00 0.00 O ATOM 22414 H1 WAT 8184 116.953 143.017 0.179 1.00 0.00 H ATOM 22415 H2 WAT 8184 118.428 142.677 0.170 1.00 0.00 H TER 22417 WAT 8184 ATOM 22417 O WAT 8185 66.458 126.083 113.572 1.00 0.00 O ATOM 22418 H1 WAT 8185 66.256 125.164 113.751 1.00 0.00 H ATOM 22419 H2 WAT 8185 65.795 126.355 112.937 1.00 0.00 H TER 22421 WAT 8185 ATOM 22421 O WAT 8186 2.133 65.817 102.256 1.00 0.00 O ATOM 22422 H1 WAT 8186 2.044 64.874 102.396 1.00 0.00 H ATOM 22423 H2 WAT 8186 2.938 65.908 101.746 1.00 0.00 H TER 22425 WAT 8186 ATOM 22425 O WAT 8187 95.773 14.241 110.701 1.00 0.00 O ATOM 22426 H1 WAT 8187 95.652 13.392 110.276 1.00 0.00 H ATOM 22427 H2 WAT 8187 96.619 14.552 110.378 1.00 0.00 H TER 22429 WAT 8187 ATOM 22429 O WAT 8188 19.763 81.971 77.184 1.00 0.00 O ATOM 22430 H1 WAT 8188 19.748 82.912 77.359 1.00 0.00 H ATOM 22431 H2 WAT 8188 18.984 81.633 77.625 1.00 0.00 H TER 22433 WAT 8188 ATOM 22433 O WAT 8189 128.664 90.779 24.151 1.00 0.00 O ATOM 22434 H1 WAT 8189 128.247 91.550 24.536 1.00 0.00 H ATOM 22435 H2 WAT 8189 127.986 90.392 23.597 1.00 0.00 H TER 22437 WAT 8189 ATOM 22437 O WAT 8190 116.888 19.716 137.080 1.00 0.00 O ATOM 22438 H1 WAT 8190 117.208 20.364 136.452 1.00 0.00 H ATOM 22439 H2 WAT 8190 116.181 19.264 136.619 1.00 0.00 H TER 22441 WAT 8190 ATOM 22441 O WAT 8191 128.043 69.983 18.110 1.00 0.00 O ATOM 22442 H1 WAT 8191 128.297 70.666 18.730 1.00 0.00 H ATOM 22443 H2 WAT 8191 127.867 69.217 18.657 1.00 0.00 H TER 22445 WAT 8191 ATOM 22445 O WAT 8192 68.424 27.568 151.869 1.00 0.00 O ATOM 22446 H1 WAT 8192 67.807 27.244 151.213 1.00 0.00 H ATOM 22447 H2 WAT 8192 68.178 28.484 151.998 1.00 0.00 H TER 22449 WAT 8192 ATOM 22449 O WAT 8193 29.144 116.802 123.864 1.00 0.00 O ATOM 22450 H1 WAT 8193 29.285 115.930 124.232 1.00 0.00 H ATOM 22451 H2 WAT 8193 28.898 117.342 124.615 1.00 0.00 H TER 22453 WAT 8193 ATOM 22453 O WAT 8194 35.293 122.792 145.678 1.00 0.00 O ATOM 22454 H1 WAT 8194 35.952 123.018 146.334 1.00 0.00 H ATOM 22455 H2 WAT 8194 35.102 123.620 145.236 1.00 0.00 H TER 22457 WAT 8194 ATOM 22457 O WAT 8195 102.482 42.909 94.512 1.00 0.00 O ATOM 22458 H1 WAT 8195 103.371 42.684 94.235 1.00 0.00 H ATOM 22459 H2 WAT 8195 102.588 43.253 95.399 1.00 0.00 H TER 22461 WAT 8195 ATOM 22461 O WAT 8196 0.711 88.803 24.794 1.00 0.00 O ATOM 22462 H1 WAT 8196 0.949 89.109 23.919 1.00 0.00 H ATOM 22463 H2 WAT 8196 0.337 89.572 25.224 1.00 0.00 H TER 22465 WAT 8196 ATOM 22465 O WAT 8197 89.277 6.872 1.898 1.00 0.00 O ATOM 22466 H1 WAT 8197 89.911 7.477 1.513 1.00 0.00 H ATOM 22467 H2 WAT 8197 89.688 6.011 1.816 1.00 0.00 H TER 22469 WAT 8197 ATOM 22469 O WAT 8198 62.397 90.738 53.800 1.00 0.00 O ATOM 22470 H1 WAT 8198 61.708 90.148 53.493 1.00 0.00 H ATOM 22471 H2 WAT 8198 62.439 90.586 54.744 1.00 0.00 H TER 22473 WAT 8198 ATOM 22473 O WAT 8199 79.874 146.078 124.949 1.00 0.00 O ATOM 22474 H1 WAT 8199 80.733 145.936 125.347 1.00 0.00 H ATOM 22475 H2 WAT 8199 79.353 145.324 125.226 1.00 0.00 H TER 22477 WAT 8199 ATOM 22477 O WAT 8200 34.966 97.843 97.335 1.00 0.00 O ATOM 22478 H1 WAT 8200 35.813 98.124 97.682 1.00 0.00 H ATOM 22479 H2 WAT 8200 34.832 98.388 96.560 1.00 0.00 H TER 22481 WAT 8200 ATOM 22481 O WAT 8201 19.136 97.543 140.929 1.00 0.00 O ATOM 22482 H1 WAT 8201 20.040 97.276 141.092 1.00 0.00 H ATOM 22483 H2 WAT 8201 19.139 98.492 141.059 1.00 0.00 H TER 22485 WAT 8201 ATOM 22485 O WAT 8202 117.992 39.034 66.615 1.00 0.00 O ATOM 22486 H1 WAT 8202 118.445 39.798 66.259 1.00 0.00 H ATOM 22487 H2 WAT 8202 117.669 39.324 67.468 1.00 0.00 H TER 22489 WAT 8202 ATOM 22489 O WAT 8203 115.632 131.266 126.444 1.00 0.00 O ATOM 22490 H1 WAT 8203 115.055 131.400 125.692 1.00 0.00 H ATOM 22491 H2 WAT 8203 115.700 132.129 126.851 1.00 0.00 H TER 22493 WAT 8203 ATOM 22493 O WAT 8204 8.361 14.371 106.943 1.00 0.00 O ATOM 22494 H1 WAT 8204 8.020 13.552 107.302 1.00 0.00 H ATOM 22495 H2 WAT 8204 8.064 14.376 106.033 1.00 0.00 H TER 22497 WAT 8204 ATOM 22497 O WAT 8205 97.494 19.859 14.810 1.00 0.00 O ATOM 22498 H1 WAT 8205 98.353 20.122 15.141 1.00 0.00 H ATOM 22499 H2 WAT 8205 97.039 20.684 14.642 1.00 0.00 H TER 22501 WAT 8205 ATOM 22501 O WAT 8206 28.337 2.238 52.407 1.00 0.00 O ATOM 22502 H1 WAT 8206 28.981 1.714 52.884 1.00 0.00 H ATOM 22503 H2 WAT 8206 28.689 3.128 52.430 1.00 0.00 H TER 22505 WAT 8206 ATOM 22505 O WAT 8207 85.088 138.524 95.754 1.00 0.00 O ATOM 22506 H1 WAT 8207 85.422 139.259 96.268 1.00 0.00 H ATOM 22507 H2 WAT 8207 85.759 138.370 95.090 1.00 0.00 H TER 22509 WAT 8207 ATOM 22509 O WAT 8208 122.211 52.075 10.526 1.00 0.00 O ATOM 22510 H1 WAT 8208 122.257 51.579 11.343 1.00 0.00 H ATOM 22511 H2 WAT 8208 123.009 51.837 10.056 1.00 0.00 H TER 22513 WAT 8208 ATOM 22513 O WAT 8209 41.260 82.648 119.035 1.00 0.00 O ATOM 22514 H1 WAT 8209 41.596 83.469 118.677 1.00 0.00 H ATOM 22515 H2 WAT 8209 40.525 82.421 118.466 1.00 0.00 H TER 22517 WAT 8209 ATOM 22517 O WAT 8210 56.191 99.881 10.182 1.00 0.00 O ATOM 22518 H1 WAT 8210 55.741 100.676 10.465 1.00 0.00 H ATOM 22519 H2 WAT 8210 55.881 99.735 9.289 1.00 0.00 H TER 22521 WAT 8210 ATOM 22521 O WAT 8211 65.259 98.398 63.639 1.00 0.00 O ATOM 22522 H1 WAT 8211 66.056 98.467 64.164 1.00 0.00 H ATOM 22523 H2 WAT 8211 65.194 99.241 63.190 1.00 0.00 H TER 22525 WAT 8211 ATOM 22525 O WAT 8212 125.226 109.589 122.300 1.00 0.00 O ATOM 22526 H1 WAT 8212 125.946 109.511 121.674 1.00 0.00 H ATOM 22527 H2 WAT 8212 124.464 109.248 121.831 1.00 0.00 H TER 22529 WAT 8212 ATOM 22529 O WAT 8213 38.203 96.815 15.047 1.00 0.00 O ATOM 22530 H1 WAT 8213 37.278 96.821 15.295 1.00 0.00 H ATOM 22531 H2 WAT 8213 38.630 96.296 15.729 1.00 0.00 H TER 22533 WAT 8213 ATOM 22533 O WAT 8214 50.989 59.890 127.469 1.00 0.00 O ATOM 22534 H1 WAT 8214 51.243 60.794 127.277 1.00 0.00 H ATOM 22535 H2 WAT 8214 51.736 59.366 127.179 1.00 0.00 H TER 22537 WAT 8214 ATOM 22537 O WAT 8215 99.997 19.509 120.887 1.00 0.00 O ATOM 22538 H1 WAT 8215 100.416 19.104 121.646 1.00 0.00 H ATOM 22539 H2 WAT 8215 99.542 20.272 121.243 1.00 0.00 H TER 22541 WAT 8215 ATOM 22541 O WAT 8216 22.848 68.503 133.273 1.00 0.00 O ATOM 22542 H1 WAT 8216 22.417 69.059 133.923 1.00 0.00 H ATOM 22543 H2 WAT 8216 23.765 68.776 133.295 1.00 0.00 H TER 22545 WAT 8216 ATOM 22545 O WAT 8217 118.104 32.447 146.147 1.00 0.00 O ATOM 22546 H1 WAT 8217 117.581 32.179 145.391 1.00 0.00 H ATOM 22547 H2 WAT 8217 118.120 31.676 146.713 1.00 0.00 H TER 22549 WAT 8217 ATOM 22549 O WAT 8218 68.802 84.616 17.976 1.00 0.00 O ATOM 22550 H1 WAT 8218 68.931 85.020 17.118 1.00 0.00 H ATOM 22551 H2 WAT 8218 68.188 83.900 17.814 1.00 0.00 H TER 22553 WAT 8218 ATOM 22553 O WAT 8219 35.918 31.205 113.501 1.00 0.00 O ATOM 22554 H1 WAT 8219 36.564 30.563 113.796 1.00 0.00 H ATOM 22555 H2 WAT 8219 35.156 31.053 114.060 1.00 0.00 H TER 22557 WAT 8219 ATOM 22557 O WAT 8220 28.453 86.633 83.027 1.00 0.00 O ATOM 22558 H1 WAT 8220 29.030 85.978 83.421 1.00 0.00 H ATOM 22559 H2 WAT 8220 28.945 87.452 83.087 1.00 0.00 H TER 22561 WAT 8220 ATOM 22561 O WAT 8221 31.339 67.522 93.081 1.00 0.00 O ATOM 22562 H1 WAT 8221 32.217 67.857 93.265 1.00 0.00 H ATOM 22563 H2 WAT 8221 30.824 67.766 93.850 1.00 0.00 H TER 22565 WAT 8221 ATOM 22565 O WAT 8222 77.607 53.111 102.361 1.00 0.00 O ATOM 22566 H1 WAT 8222 78.384 53.614 102.120 1.00 0.00 H ATOM 22567 H2 WAT 8222 76.879 53.720 102.237 1.00 0.00 H TER 22569 WAT 8222 ATOM 22569 O WAT 8223 109.142 31.112 63.955 1.00 0.00 O ATOM 22570 H1 WAT 8223 108.631 31.880 63.695 1.00 0.00 H ATOM 22571 H2 WAT 8223 110.048 31.351 63.761 1.00 0.00 H TER 22573 WAT 8223 ATOM 22573 O WAT 8224 83.181 128.892 13.543 1.00 0.00 O ATOM 22574 H1 WAT 8224 83.978 129.417 13.613 1.00 0.00 H ATOM 22575 H2 WAT 8224 83.494 128.002 13.379 1.00 0.00 H TER 22577 WAT 8224 ATOM 22577 O WAT 8225 123.593 9.699 140.486 1.00 0.00 O ATOM 22578 H1 WAT 8225 123.735 9.339 141.362 1.00 0.00 H ATOM 22579 H2 WAT 8225 123.975 9.050 139.895 1.00 0.00 H TER 22581 WAT 8225 ATOM 22581 O WAT 8226 20.609 30.446 79.607 1.00 0.00 O ATOM 22582 H1 WAT 8226 20.669 29.490 79.607 1.00 0.00 H ATOM 22583 H2 WAT 8226 21.507 30.742 79.752 1.00 0.00 H TER 22585 WAT 8226 ATOM 22585 O WAT 8227 140.842 57.425 146.648 1.00 0.00 O ATOM 22586 H1 WAT 8227 141.194 56.990 145.871 1.00 0.00 H ATOM 22587 H2 WAT 8227 140.817 58.352 146.412 1.00 0.00 H TER 22589 WAT 8227 ATOM 22589 O WAT 8228 143.914 27.179 87.160 1.00 0.00 O ATOM 22590 H1 WAT 8228 144.557 27.751 86.741 1.00 0.00 H ATOM 22591 H2 WAT 8228 143.384 27.767 87.698 1.00 0.00 H TER 22593 WAT 8228 ATOM 22593 O WAT 8229 124.830 111.378 72.972 1.00 0.00 O ATOM 22594 H1 WAT 8229 124.501 111.316 73.869 1.00 0.00 H ATOM 22595 H2 WAT 8229 125.228 110.524 72.804 1.00 0.00 H TER 22597 WAT 8229 ATOM 22597 O WAT 8230 94.010 146.052 154.889 1.00 0.00 O ATOM 22598 H1 WAT 8230 94.910 146.195 154.596 1.00 0.00 H ATOM 22599 H2 WAT 8230 93.885 145.105 154.826 1.00 0.00 H TER 22601 WAT 8230 ATOM 22601 O WAT 8231 40.285 13.608 106.018 1.00 0.00 O ATOM 22602 H1 WAT 8231 39.650 14.283 106.260 1.00 0.00 H ATOM 22603 H2 WAT 8231 39.852 12.783 106.238 1.00 0.00 H TER 22605 WAT 8231 ATOM 22605 O WAT 8232 20.851 134.004 109.848 1.00 0.00 O ATOM 22606 H1 WAT 8232 20.230 134.359 109.212 1.00 0.00 H ATOM 22607 H2 WAT 8232 20.320 133.814 110.621 1.00 0.00 H TER 22609 WAT 8232 ATOM 22609 O WAT 8233 36.923 23.787 13.870 1.00 0.00 O ATOM 22610 H1 WAT 8233 37.062 24.562 13.325 1.00 0.00 H ATOM 22611 H2 WAT 8233 35.976 23.648 13.849 1.00 0.00 H TER 22613 WAT 8233 ATOM 22613 O WAT 8234 82.910 73.928 11.636 1.00 0.00 O ATOM 22614 H1 WAT 8234 83.462 73.586 12.339 1.00 0.00 H ATOM 22615 H2 WAT 8234 83.468 74.555 11.177 1.00 0.00 H TER 22617 WAT 8234 ATOM 22617 O WAT 8235 8.691 14.960 13.555 1.00 0.00 O ATOM 22618 H1 WAT 8235 8.795 15.567 14.288 1.00 0.00 H ATOM 22619 H2 WAT 8235 8.088 14.293 13.881 1.00 0.00 H TER 22621 WAT 8235 ATOM 22621 O WAT 8236 53.226 136.142 0.993 1.00 0.00 O ATOM 22622 H1 WAT 8236 54.085 135.780 1.212 1.00 0.00 H ATOM 22623 H2 WAT 8236 53.261 136.288 0.048 1.00 0.00 H TER 22625 WAT 8236 ATOM 22625 O WAT 8237 101.635 28.129 15.858 1.00 0.00 O ATOM 22626 H1 WAT 8237 101.656 27.726 16.726 1.00 0.00 H ATOM 22627 H2 WAT 8237 101.413 27.410 15.266 1.00 0.00 H TER 22629 WAT 8237 ATOM 22629 O WAT 8238 40.093 95.536 82.653 1.00 0.00 O ATOM 22630 H1 WAT 8238 40.802 96.031 82.242 1.00 0.00 H ATOM 22631 H2 WAT 8238 40.268 94.626 82.416 1.00 0.00 H TER 22633 WAT 8238 ATOM 22633 O WAT 8239 103.383 9.158 126.617 1.00 0.00 O ATOM 22634 H1 WAT 8239 104.226 9.606 126.545 1.00 0.00 H ATOM 22635 H2 WAT 8239 102.745 9.863 126.726 1.00 0.00 H TER 22637 WAT 8239 ATOM 22637 O WAT 8240 82.071 123.573 2.093 1.00 0.00 O ATOM 22638 H1 WAT 8240 81.415 122.911 1.876 1.00 0.00 H ATOM 22639 H2 WAT 8240 82.264 123.425 3.019 1.00 0.00 H TER 22641 WAT 8240 ATOM 22641 O WAT 8241 8.062 129.436 110.084 1.00 0.00 O ATOM 22642 H1 WAT 8241 8.391 128.597 110.406 1.00 0.00 H ATOM 22643 H2 WAT 8241 7.692 129.234 109.224 1.00 0.00 H TER 22645 WAT 8241 ATOM 22645 O WAT 8242 44.748 90.900 147.842 1.00 0.00 O ATOM 22646 H1 WAT 8242 44.357 90.783 146.976 1.00 0.00 H ATOM 22647 H2 WAT 8242 44.575 90.075 148.296 1.00 0.00 H TER 22649 WAT 8242 ATOM 22649 O WAT 8243 11.656 99.816 53.496 1.00 0.00 O ATOM 22650 H1 WAT 8243 12.228 100.231 54.142 1.00 0.00 H ATOM 22651 H2 WAT 8243 12.250 99.518 52.806 1.00 0.00 H TER 22653 WAT 8243 ATOM 22653 O WAT 8244 13.028 20.377 68.112 1.00 0.00 O ATOM 22654 H1 WAT 8244 13.575 19.748 68.583 1.00 0.00 H ATOM 22655 H2 WAT 8244 13.430 20.444 67.246 1.00 0.00 H TER 22657 WAT 8244 ATOM 22657 O WAT 8245 17.256 132.423 140.564 1.00 0.00 O ATOM 22658 H1 WAT 8245 17.816 131.705 140.269 1.00 0.00 H ATOM 22659 H2 WAT 8245 17.772 132.870 141.235 1.00 0.00 H TER 22661 WAT 8245 ATOM 22661 O WAT 8246 145.474 126.786 66.348 1.00 0.00 O ATOM 22662 H1 WAT 8246 145.734 127.442 65.701 1.00 0.00 H ATOM 22663 H2 WAT 8246 144.700 126.369 65.969 1.00 0.00 H TER 22665 WAT 8246 ATOM 22665 O WAT 8247 139.967 62.636 125.429 1.00 0.00 O ATOM 22666 H1 WAT 8247 139.729 63.543 125.621 1.00 0.00 H ATOM 22667 H2 WAT 8247 139.596 62.133 126.154 1.00 0.00 H TER 22669 WAT 8247 ATOM 22669 O WAT 8248 30.925 36.113 102.212 1.00 0.00 O ATOM 22670 H1 WAT 8248 30.934 35.171 102.045 1.00 0.00 H ATOM 22671 H2 WAT 8248 31.750 36.429 101.843 1.00 0.00 H TER 22673 WAT 8248 ATOM 22673 O WAT 8249 89.148 112.274 138.644 1.00 0.00 O ATOM 22674 H1 WAT 8249 88.966 112.804 139.420 1.00 0.00 H ATOM 22675 H2 WAT 8249 88.670 112.711 137.938 1.00 0.00 H TER 22677 WAT 8249 ATOM 22677 O WAT 8250 21.966 139.857 81.523 1.00 0.00 O ATOM 22678 H1 WAT 8250 21.730 138.981 81.218 1.00 0.00 H ATOM 22679 H2 WAT 8250 22.225 139.730 82.436 1.00 0.00 H TER 22681 WAT 8250 ATOM 22681 O WAT 8251 62.774 47.442 148.798 1.00 0.00 O ATOM 22682 H1 WAT 8251 63.208 48.251 149.070 1.00 0.00 H ATOM 22683 H2 WAT 8251 62.999 46.809 149.479 1.00 0.00 H TER 22685 WAT 8251 ATOM 22685 O WAT 8252 62.783 67.460 76.098 1.00 0.00 O ATOM 22686 H1 WAT 8252 62.477 67.872 76.906 1.00 0.00 H ATOM 22687 H2 WAT 8252 62.014 67.003 75.757 1.00 0.00 H TER 22689 WAT 8252 ATOM 22689 O WAT 8253 33.790 142.797 131.622 1.00 0.00 O ATOM 22690 H1 WAT 8253 33.365 142.060 131.182 1.00 0.00 H ATOM 22691 H2 WAT 8253 33.310 143.567 131.318 1.00 0.00 H TER 22693 WAT 8253 ATOM 22693 O WAT 8254 52.361 115.647 124.470 1.00 0.00 O ATOM 22694 H1 WAT 8254 52.388 115.662 123.513 1.00 0.00 H ATOM 22695 H2 WAT 8254 53.041 115.022 124.719 1.00 0.00 H TER 22697 WAT 8254 ATOM 22697 O WAT 8255 18.580 25.161 104.191 1.00 0.00 O ATOM 22698 H1 WAT 8255 17.629 25.076 104.244 1.00 0.00 H ATOM 22699 H2 WAT 8255 18.740 26.104 104.241 1.00 0.00 H TER 22701 WAT 8255 ATOM 22701 O WAT 8256 53.610 25.231 112.817 1.00 0.00 O ATOM 22702 H1 WAT 8256 52.734 24.876 112.966 1.00 0.00 H ATOM 22703 H2 WAT 8256 53.458 26.092 112.428 1.00 0.00 H TER 22705 WAT 8256 ATOM 22705 O WAT 8257 53.538 3.324 2.718 1.00 0.00 O ATOM 22706 H1 WAT 8257 54.186 2.688 3.023 1.00 0.00 H ATOM 22707 H2 WAT 8257 53.514 3.205 1.769 1.00 0.00 H TER 22709 WAT 8257 ATOM 22709 O WAT 8258 74.247 89.156 58.282 1.00 0.00 O ATOM 22710 H1 WAT 8258 74.003 88.328 58.696 1.00 0.00 H ATOM 22711 H2 WAT 8258 74.776 89.606 58.940 1.00 0.00 H TER 22713 WAT 8258 ATOM 22713 O WAT 8259 0.859 143.500 100.911 1.00 0.00 O ATOM 22714 H1 WAT 8259 1.813 143.518 100.989 1.00 0.00 H ATOM 22715 H2 WAT 8259 0.611 142.623 101.204 1.00 0.00 H TER 22717 WAT 8259 ATOM 22717 O WAT 8260 130.948 13.331 111.549 1.00 0.00 O ATOM 22718 H1 WAT 8260 130.734 12.399 111.597 1.00 0.00 H ATOM 22719 H2 WAT 8260 131.712 13.431 112.116 1.00 0.00 H TER 22721 WAT 8260 ATOM 22721 O WAT 8261 97.840 128.802 7.691 1.00 0.00 O ATOM 22722 H1 WAT 8261 97.954 129.361 6.922 1.00 0.00 H ATOM 22723 H2 WAT 8261 97.904 127.910 7.350 1.00 0.00 H TER 22725 WAT 8261 ATOM 22725 O WAT 8262 135.665 124.943 138.125 1.00 0.00 O ATOM 22726 H1 WAT 8262 135.468 125.864 138.299 1.00 0.00 H ATOM 22727 H2 WAT 8262 136.399 124.968 137.512 1.00 0.00 H TER 22729 WAT 8262 ATOM 22729 O WAT 8263 28.923 94.444 11.266 1.00 0.00 O ATOM 22730 H1 WAT 8263 29.003 93.498 11.387 1.00 0.00 H ATOM 22731 H2 WAT 8263 29.157 94.588 10.349 1.00 0.00 H TER 22733 WAT 8263 ATOM 22733 O WAT 8264 126.595 27.558 131.810 1.00 0.00 O ATOM 22734 H1 WAT 8264 126.800 27.479 130.878 1.00 0.00 H ATOM 22735 H2 WAT 8264 125.639 27.538 131.848 1.00 0.00 H TER 22737 WAT 8264 ATOM 22737 O WAT 8265 39.570 126.980 74.294 1.00 0.00 O ATOM 22738 H1 WAT 8265 39.627 127.797 74.789 1.00 0.00 H ATOM 22739 H2 WAT 8265 39.431 126.306 74.959 1.00 0.00 H TER 22741 WAT 8265 ATOM 22741 O WAT 8266 24.452 46.285 97.890 1.00 0.00 O ATOM 22742 H1 WAT 8266 24.096 45.879 97.100 1.00 0.00 H ATOM 22743 H2 WAT 8266 23.839 46.039 98.583 1.00 0.00 H TER 22745 WAT 8266 ATOM 22745 O WAT 8267 89.445 50.826 115.531 1.00 0.00 O ATOM 22746 H1 WAT 8267 89.529 51.764 115.702 1.00 0.00 H ATOM 22747 H2 WAT 8267 89.107 50.775 114.636 1.00 0.00 H TER 22749 WAT 8267 ATOM 22749 O WAT 8268 136.325 45.261 101.319 1.00 0.00 O ATOM 22750 H1 WAT 8268 136.767 45.352 100.475 1.00 0.00 H ATOM 22751 H2 WAT 8268 136.355 46.138 101.701 1.00 0.00 H TER 22753 WAT 8268 ATOM 22753 O WAT 8269 123.791 107.107 98.560 1.00 0.00 O ATOM 22754 H1 WAT 8269 124.563 107.119 97.994 1.00 0.00 H ATOM 22755 H2 WAT 8269 123.145 107.639 98.095 1.00 0.00 H TER 22757 WAT 8269 ATOM 22757 O WAT 8270 16.217 141.028 59.474 1.00 0.00 O ATOM 22758 H1 WAT 8270 16.187 141.985 59.451 1.00 0.00 H ATOM 22759 H2 WAT 8270 15.971 140.759 58.589 1.00 0.00 H TER 22761 WAT 8270 ATOM 22761 O WAT 8271 137.127 15.146 22.214 1.00 0.00 O ATOM 22762 H1 WAT 8271 136.499 15.728 21.786 1.00 0.00 H ATOM 22763 H2 WAT 8271 137.197 15.484 23.107 1.00 0.00 H TER 22765 WAT 8271 ATOM 22765 O WAT 8272 141.534 33.718 79.462 1.00 0.00 O ATOM 22766 H1 WAT 8272 141.082 33.875 78.632 1.00 0.00 H ATOM 22767 H2 WAT 8272 140.995 33.065 79.908 1.00 0.00 H TER 22769 WAT 8272 ATOM 22769 O WAT 8273 60.522 114.885 5.209 1.00 0.00 O ATOM 22770 H1 WAT 8273 59.725 114.358 5.138 1.00 0.00 H ATOM 22771 H2 WAT 8273 61.194 114.363 4.770 1.00 0.00 H TER 22773 WAT 8273 ATOM 22773 O WAT 8274 140.267 106.166 154.657 1.00 0.00 O ATOM 22774 H1 WAT 8274 140.741 106.955 154.396 1.00 0.00 H ATOM 22775 H2 WAT 8274 139.362 106.457 154.770 1.00 0.00 H TER 22777 WAT 8274 ATOM 22777 O WAT 8275 83.157 16.821 8.622 1.00 0.00 O ATOM 22778 H1 WAT 8275 82.614 16.048 8.470 1.00 0.00 H ATOM 22779 H2 WAT 8275 82.700 17.304 9.310 1.00 0.00 H TER 22781 WAT 8275 ATOM 22781 O WAT 8276 128.688 89.035 5.868 1.00 0.00 O ATOM 22782 H1 WAT 8276 128.264 89.562 5.191 1.00 0.00 H ATOM 22783 H2 WAT 8276 128.072 89.044 6.600 1.00 0.00 H TER 22785 WAT 8276 ATOM 22785 O WAT 8277 90.370 103.665 100.977 1.00 0.00 O ATOM 22786 H1 WAT 8277 90.295 103.165 101.790 1.00 0.00 H ATOM 22787 H2 WAT 8277 89.499 103.616 100.584 1.00 0.00 H TER 22789 WAT 8277 ATOM 22789 O WAT 8278 122.165 28.650 8.597 1.00 0.00 O ATOM 22790 H1 WAT 8278 121.368 28.997 8.996 1.00 0.00 H ATOM 22791 H2 WAT 8278 122.858 28.861 9.223 1.00 0.00 H TER 22793 WAT 8278 ATOM 22793 O WAT 8279 125.595 89.455 150.557 1.00 0.00 O ATOM 22794 H1 WAT 8279 126.098 89.053 149.849 1.00 0.00 H ATOM 22795 H2 WAT 8279 126.175 89.414 151.317 1.00 0.00 H TER 22797 WAT 8279 ATOM 22797 O WAT 8280 13.458 133.383 120.445 1.00 0.00 O ATOM 22798 H1 WAT 8280 12.684 133.323 119.885 1.00 0.00 H ATOM 22799 H2 WAT 8280 13.804 134.260 120.283 1.00 0.00 H TER 22801 WAT 8280 ATOM 22801 O WAT 8281 100.263 47.945 66.985 1.00 0.00 O ATOM 22802 H1 WAT 8281 100.705 47.356 66.374 1.00 0.00 H ATOM 22803 H2 WAT 8281 99.689 47.375 67.496 1.00 0.00 H TER 22805 WAT 8281 ATOM 22805 O WAT 8282 71.434 117.744 133.827 1.00 0.00 O ATOM 22806 H1 WAT 8282 72.119 118.388 134.005 1.00 0.00 H ATOM 22807 H2 WAT 8282 71.882 116.899 133.874 1.00 0.00 H TER 22809 WAT 8282 ATOM 22809 O WAT 8283 131.868 125.095 91.446 1.00 0.00 O ATOM 22810 H1 WAT 8283 131.032 125.261 91.010 1.00 0.00 H ATOM 22811 H2 WAT 8283 132.496 124.999 90.731 1.00 0.00 H TER 22813 WAT 8283 ATOM 22813 O WAT 8284 40.163 31.390 103.436 1.00 0.00 O ATOM 22814 H1 WAT 8284 39.558 31.383 102.695 1.00 0.00 H ATOM 22815 H2 WAT 8284 40.825 30.735 103.213 1.00 0.00 H TER 22817 WAT 8284 ATOM 22817 O WAT 8285 90.678 145.599 58.695 1.00 0.00 O ATOM 22818 H1 WAT 8285 90.577 145.136 57.863 1.00 0.00 H ATOM 22819 H2 WAT 8285 89.882 146.125 58.774 1.00 0.00 H TER 22821 WAT 8285 ATOM 22821 O WAT 8286 32.286 14.333 154.716 1.00 0.00 O ATOM 22822 H1 WAT 8286 31.631 13.780 155.142 1.00 0.00 H ATOM 22823 H2 WAT 8286 31.774 14.965 154.211 1.00 0.00 H TER 22825 WAT 8286 ATOM 22825 O WAT 8287 131.484 71.914 122.177 1.00 0.00 O ATOM 22826 H1 WAT 8287 131.945 72.719 122.413 1.00 0.00 H ATOM 22827 H2 WAT 8287 130.569 72.089 122.395 1.00 0.00 H TER 22829 WAT 8287 ATOM 22829 O WAT 8288 98.847 91.556 17.214 1.00 0.00 O ATOM 22830 H1 WAT 8288 99.726 91.358 17.539 1.00 0.00 H ATOM 22831 H2 WAT 8288 98.995 92.088 16.432 1.00 0.00 H TER 22833 WAT 8288 ATOM 22833 O WAT 8289 17.718 95.860 138.895 1.00 0.00 O ATOM 22834 H1 WAT 8289 17.349 95.093 139.333 1.00 0.00 H ATOM 22835 H2 WAT 8289 18.079 96.391 139.606 1.00 0.00 H TER 22837 WAT 8289 ATOM 22837 O WAT 8290 17.422 65.367 89.621 1.00 0.00 O ATOM 22838 H1 WAT 8290 18.038 66.047 89.349 1.00 0.00 H ATOM 22839 H2 WAT 8290 16.959 65.129 88.818 1.00 0.00 H TER 22841 WAT 8290 ATOM 22841 O WAT 8291 108.597 58.296 74.886 1.00 0.00 O ATOM 22842 H1 WAT 8291 108.020 59.028 75.106 1.00 0.00 H ATOM 22843 H2 WAT 8291 109.465 58.582 75.171 1.00 0.00 H TER 22845 WAT 8291 ATOM 22845 O WAT 8292 73.568 97.947 115.352 1.00 0.00 O ATOM 22846 H1 WAT 8292 74.041 98.780 115.338 1.00 0.00 H ATOM 22847 H2 WAT 8292 72.831 98.100 115.942 1.00 0.00 H TER 22849 WAT 8292 ATOM 22849 O WAT 8293 72.291 5.537 138.102 1.00 0.00 O ATOM 22850 H1 WAT 8293 73.112 5.982 137.893 1.00 0.00 H ATOM 22851 H2 WAT 8293 72.552 4.796 138.648 1.00 0.00 H TER 22853 WAT 8293 ATOM 22853 O WAT 8294 81.087 78.589 91.339 1.00 0.00 O ATOM 22854 H1 WAT 8294 81.991 78.310 91.484 1.00 0.00 H ATOM 22855 H2 WAT 8294 80.719 77.917 90.766 1.00 0.00 H TER 22857 WAT 8294 ATOM 22857 O WAT 8295 127.663 37.022 7.916 1.00 0.00 O ATOM 22858 H1 WAT 8295 126.958 37.261 8.518 1.00 0.00 H ATOM 22859 H2 WAT 8295 127.772 37.792 7.358 1.00 0.00 H TER 22861 WAT 8295 ATOM 22861 O WAT 8296 37.875 136.502 87.982 1.00 0.00 O ATOM 22862 H1 WAT 8296 37.572 137.147 87.342 1.00 0.00 H ATOM 22863 H2 WAT 8296 37.120 136.357 88.551 1.00 0.00 H TER 22865 WAT 8296 ATOM 22865 O WAT 8297 27.771 102.693 112.937 1.00 0.00 O ATOM 22866 H1 WAT 8297 28.096 102.158 113.661 1.00 0.00 H ATOM 22867 H2 WAT 8297 26.822 102.570 112.955 1.00 0.00 H TER 22869 WAT 8297 ATOM 22869 O WAT 8298 13.483 45.345 76.594 1.00 0.00 O ATOM 22870 H1 WAT 8298 14.362 45.024 76.795 1.00 0.00 H ATOM 22871 H2 WAT 8298 13.627 46.100 76.023 1.00 0.00 H TER 22873 WAT 8298 ATOM 22873 O WAT 8299 140.059 120.829 90.416 1.00 0.00 O ATOM 22874 H1 WAT 8299 140.306 121.754 90.431 1.00 0.00 H ATOM 22875 H2 WAT 8299 140.868 120.368 90.195 1.00 0.00 H TER 22877 WAT 8299 ATOM 22877 O WAT 8300 81.045 113.394 145.497 1.00 0.00 O ATOM 22878 H1 WAT 8300 81.342 113.565 146.391 1.00 0.00 H ATOM 22879 H2 WAT 8300 80.427 114.100 145.310 1.00 0.00 H TER 22881 WAT 8300 ATOM 22881 O WAT 8301 129.710 131.535 126.189 1.00 0.00 O ATOM 22882 H1 WAT 8301 130.560 131.187 126.460 1.00 0.00 H ATOM 22883 H2 WAT 8301 129.726 132.450 126.470 1.00 0.00 H TER 22885 WAT 8301 ATOM 22885 O WAT 8302 72.092 30.317 107.788 1.00 0.00 O ATOM 22886 H1 WAT 8302 72.737 29.815 108.286 1.00 0.00 H ATOM 22887 H2 WAT 8302 72.604 30.995 107.348 1.00 0.00 H TER 22889 WAT 8302 ATOM 22889 O WAT 8303 28.171 133.041 82.937 1.00 0.00 O ATOM 22890 H1 WAT 8303 27.374 133.477 82.633 1.00 0.00 H ATOM 22891 H2 WAT 8303 28.262 133.318 83.849 1.00 0.00 H TER 22893 WAT 8303 ATOM 22893 O WAT 8304 33.115 25.851 106.897 1.00 0.00 O ATOM 22894 H1 WAT 8304 33.988 26.217 106.756 1.00 0.00 H ATOM 22895 H2 WAT 8304 32.657 26.515 107.412 1.00 0.00 H TER 22897 WAT 8304 ATOM 22897 O WAT 8305 52.010 9.208 93.029 1.00 0.00 O ATOM 22898 H1 WAT 8305 52.631 9.876 93.319 1.00 0.00 H ATOM 22899 H2 WAT 8305 51.153 9.554 93.279 1.00 0.00 H TER 22901 WAT 8305 ATOM 22901 O WAT 8306 67.945 40.336 112.818 1.00 0.00 O ATOM 22902 H1 WAT 8306 67.119 40.371 113.302 1.00 0.00 H ATOM 22903 H2 WAT 8306 67.822 39.627 112.186 1.00 0.00 H TER 22905 WAT 8306 ATOM 22905 O WAT 8307 31.775 120.703 67.835 1.00 0.00 O ATOM 22906 H1 WAT 8307 31.580 121.531 68.273 1.00 0.00 H ATOM 22907 H2 WAT 8307 31.806 120.059 68.542 1.00 0.00 H TER 22909 WAT 8307 ATOM 22909 O WAT 8308 29.639 100.617 153.631 1.00 0.00 O ATOM 22910 H1 WAT 8308 29.122 99.842 153.412 1.00 0.00 H ATOM 22911 H2 WAT 8308 29.442 100.784 154.553 1.00 0.00 H TER 22913 WAT 8308 ATOM 22913 O WAT 8309 44.868 65.862 117.908 1.00 0.00 O ATOM 22914 H1 WAT 8309 45.668 66.301 118.197 1.00 0.00 H ATOM 22915 H2 WAT 8309 44.259 66.576 117.719 1.00 0.00 H TER 22917 WAT 8309 ATOM 22917 O WAT 8310 99.373 73.930 109.444 1.00 0.00 O ATOM 22918 H1 WAT 8310 99.474 73.459 110.272 1.00 0.00 H ATOM 22919 H2 WAT 8310 98.479 74.273 109.472 1.00 0.00 H TER 22921 WAT 8310 ATOM 22921 O WAT 8311 69.884 5.894 10.018 1.00 0.00 O ATOM 22922 H1 WAT 8311 70.383 5.702 10.812 1.00 0.00 H ATOM 22923 H2 WAT 8311 69.060 6.263 10.336 1.00 0.00 H TER 22925 WAT 8311 ATOM 22925 O WAT 8312 129.860 114.450 73.461 1.00 0.00 O ATOM 22926 H1 WAT 8312 129.738 113.536 73.719 1.00 0.00 H ATOM 22927 H2 WAT 8312 130.799 114.528 73.294 1.00 0.00 H TER 22929 WAT 8312 ATOM 22929 O WAT 8313 120.339 101.663 154.732 1.00 0.00 O ATOM 22930 H1 WAT 8313 119.760 102.350 155.061 1.00 0.00 H ATOM 22931 H2 WAT 8313 120.959 101.510 155.445 1.00 0.00 H TER 22933 WAT 8313 ATOM 22933 O WAT 8314 74.968 31.059 58.496 1.00 0.00 O ATOM 22934 H1 WAT 8314 74.975 31.981 58.752 1.00 0.00 H ATOM 22935 H2 WAT 8314 74.187 30.699 58.916 1.00 0.00 H TER 22937 WAT 8314 ATOM 22937 O WAT 8315 99.921 118.605 14.995 1.00 0.00 O ATOM 22938 H1 WAT 8315 100.114 118.820 14.082 1.00 0.00 H ATOM 22939 H2 WAT 8315 99.873 119.452 15.436 1.00 0.00 H TER 22941 WAT 8315 ATOM 22941 O WAT 8316 65.723 130.574 155.898 1.00 0.00 O ATOM 22942 H1 WAT 8316 65.215 130.556 155.087 1.00 0.00 H ATOM 22943 H2 WAT 8316 65.521 131.424 156.288 1.00 0.00 H TER 22945 WAT 8316 ATOM 22945 O WAT 8317 29.302 11.185 3.458 1.00 0.00 O ATOM 22946 H1 WAT 8317 29.240 10.423 4.034 1.00 0.00 H ATOM 22947 H2 WAT 8317 28.394 11.457 3.323 1.00 0.00 H TER 22949 WAT 8317 ATOM 22949 O WAT 8318 33.439 52.318 88.891 1.00 0.00 O ATOM 22950 H1 WAT 8318 32.523 52.379 88.621 1.00 0.00 H ATOM 22951 H2 WAT 8318 33.679 51.407 88.721 1.00 0.00 H TER 22953 WAT 8318 ATOM 22953 O WAT 8319 108.836 64.495 132.370 1.00 0.00 O ATOM 22954 H1 WAT 8319 108.627 65.298 132.847 1.00 0.00 H ATOM 22955 H2 WAT 8319 109.619 64.155 132.804 1.00 0.00 H TER 22957 WAT 8319 ATOM 22957 O WAT 8320 116.913 0.490 67.140 1.00 0.00 O ATOM 22958 H1 WAT 8320 116.621 0.202 66.275 1.00 0.00 H ATOM 22959 H2 WAT 8320 116.103 0.666 67.619 1.00 0.00 H TER 22961 WAT 8320 ATOM 22961 O WAT 8321 55.094 72.503 95.639 1.00 0.00 O ATOM 22962 H1 WAT 8321 54.461 72.893 95.036 1.00 0.00 H ATOM 22963 H2 WAT 8321 55.601 73.246 95.967 1.00 0.00 H TER 22965 WAT 8321 ATOM 22965 O WAT 8322 88.648 120.707 124.205 1.00 0.00 O ATOM 22966 H1 WAT 8322 89.558 120.985 124.103 1.00 0.00 H ATOM 22967 H2 WAT 8322 88.562 119.949 123.626 1.00 0.00 H TER 22969 WAT 8322 ATOM 22969 O WAT 8323 50.734 99.175 89.794 1.00 0.00 O ATOM 22970 H1 WAT 8323 50.393 98.569 90.452 1.00 0.00 H ATOM 22971 H2 WAT 8323 51.685 99.088 89.858 1.00 0.00 H TER 22973 WAT 8323 ATOM 22973 O WAT 8324 96.974 103.701 15.262 1.00 0.00 O ATOM 22974 H1 WAT 8324 96.654 104.563 14.997 1.00 0.00 H ATOM 22975 H2 WAT 8324 97.732 103.544 14.700 1.00 0.00 H TER 22977 WAT 8324 ATOM 22977 O WAT 8325 142.452 113.180 2.737 1.00 0.00 O ATOM 22978 H1 WAT 8325 141.999 112.889 1.945 1.00 0.00 H ATOM 22979 H2 WAT 8325 141.822 113.749 3.178 1.00 0.00 H TER 22981 WAT 8325 ATOM 22981 O WAT 8326 36.391 10.526 82.696 1.00 0.00 O ATOM 22982 H1 WAT 8326 35.885 11.116 83.254 1.00 0.00 H ATOM 22983 H2 WAT 8326 37.268 10.526 83.079 1.00 0.00 H TER 22985 WAT 8326 ATOM 22985 O WAT 8327 104.350 143.125 77.315 1.00 0.00 O ATOM 22986 H1 WAT 8327 104.184 144.018 77.014 1.00 0.00 H ATOM 22987 H2 WAT 8327 104.902 142.741 76.634 1.00 0.00 H TER 22989 WAT 8327 ATOM 22989 O WAT 8328 135.562 25.940 125.063 1.00 0.00 O ATOM 22990 H1 WAT 8328 134.964 26.039 124.322 1.00 0.00 H ATOM 22991 H2 WAT 8328 135.860 25.032 125.010 1.00 0.00 H TER 22993 WAT 8328 ATOM 22993 O WAT 8329 47.987 12.773 109.820 1.00 0.00 O ATOM 22994 H1 WAT 8329 48.740 13.297 109.547 1.00 0.00 H ATOM 22995 H2 WAT 8329 47.981 12.030 109.217 1.00 0.00 H TER 22997 WAT 8329 ATOM 22997 O WAT 8330 83.639 24.451 138.241 1.00 0.00 O ATOM 22998 H1 WAT 8330 82.882 25.035 138.187 1.00 0.00 H ATOM 22999 H2 WAT 8330 84.395 25.037 138.214 1.00 0.00 H TER 23001 WAT 8330 ATOM 23001 O WAT 8331 69.390 25.394 123.707 1.00 0.00 O ATOM 23002 H1 WAT 8331 69.344 25.767 122.827 1.00 0.00 H ATOM 23003 H2 WAT 8331 68.584 25.685 124.133 1.00 0.00 H TER 23005 WAT 8331 ATOM 23005 O WAT 8332 106.639 45.209 11.597 1.00 0.00 O ATOM 23006 H1 WAT 8332 105.715 45.203 11.351 1.00 0.00 H ATOM 23007 H2 WAT 8332 106.777 44.369 12.034 1.00 0.00 H TER 23009 WAT 8332 ATOM 23009 O WAT 8333 134.988 62.458 120.929 1.00 0.00 O ATOM 23010 H1 WAT 8333 135.175 63.345 121.237 1.00 0.00 H ATOM 23011 H2 WAT 8333 134.788 61.965 121.724 1.00 0.00 H TER 23013 WAT 8333 ATOM 23013 O WAT 8334 26.456 144.795 133.360 1.00 0.00 O ATOM 23014 H1 WAT 8334 27.237 144.408 133.754 1.00 0.00 H ATOM 23015 H2 WAT 8334 25.726 144.316 133.752 1.00 0.00 H TER 23017 WAT 8334 ATOM 23017 O WAT 8335 78.008 135.669 1.233 1.00 0.00 O ATOM 23018 H1 WAT 8335 78.639 135.321 1.863 1.00 0.00 H ATOM 23019 H2 WAT 8335 77.154 135.501 1.632 1.00 0.00 H TER 23021 WAT 8335 ATOM 23021 O WAT 8336 42.544 34.859 99.253 1.00 0.00 O ATOM 23022 H1 WAT 8336 42.386 34.327 98.473 1.00 0.00 H ATOM 23023 H2 WAT 8336 43.364 34.521 99.611 1.00 0.00 H TER 23025 WAT 8336 ATOM 23025 O WAT 8337 29.791 129.119 105.405 1.00 0.00 O ATOM 23026 H1 WAT 8337 30.640 128.799 105.710 1.00 0.00 H ATOM 23027 H2 WAT 8337 29.671 129.952 105.860 1.00 0.00 H TER 23029 WAT 8337 ATOM 23029 O WAT 8338 73.881 77.573 143.030 1.00 0.00 O ATOM 23030 H1 WAT 8338 74.244 78.286 142.504 1.00 0.00 H ATOM 23031 H2 WAT 8338 74.261 77.700 143.899 1.00 0.00 H TER 23033 WAT 8338 ATOM 23033 O WAT 8339 80.663 145.154 66.860 1.00 0.00 O ATOM 23034 H1 WAT 8339 79.773 145.348 66.564 1.00 0.00 H ATOM 23035 H2 WAT 8339 80.556 144.432 67.479 1.00 0.00 H TER 23037 WAT 8339 ATOM 23037 O WAT 8340 125.718 60.883 145.871 1.00 0.00 O ATOM 23038 H1 WAT 8340 125.428 59.971 145.913 1.00 0.00 H ATOM 23039 H2 WAT 8340 124.909 61.393 145.911 1.00 0.00 H TER 23041 WAT 8340 ATOM 23041 O WAT 8341 1.486 52.431 0.319 1.00 0.00 O ATOM 23042 H1 WAT 8341 2.272 52.917 0.068 1.00 0.00 H ATOM 23043 H2 WAT 8341 0.863 53.105 0.588 1.00 0.00 H TER 23045 WAT 8341 ATOM 23045 O WAT 8342 61.039 89.543 142.773 1.00 0.00 O ATOM 23046 H1 WAT 8342 60.254 89.180 142.363 1.00 0.00 H ATOM 23047 H2 WAT 8342 61.297 88.887 143.420 1.00 0.00 H TER 23049 WAT 8342 ATOM 23049 O WAT 8343 9.904 11.221 24.492 1.00 0.00 O ATOM 23050 H1 WAT 8343 9.266 11.220 23.778 1.00 0.00 H ATOM 23051 H2 WAT 8343 10.733 11.452 24.072 1.00 0.00 H TER 23053 WAT 8343 ATOM 23053 O WAT 8344 18.286 41.215 147.013 1.00 0.00 O ATOM 23054 H1 WAT 8344 18.993 41.574 147.551 1.00 0.00 H ATOM 23055 H2 WAT 8344 17.552 41.812 147.154 1.00 0.00 H TER 23057 WAT 8344 ATOM 23057 O WAT 8345 137.833 137.946 127.453 1.00 0.00 O ATOM 23058 H1 WAT 8345 137.379 138.021 128.292 1.00 0.00 H ATOM 23059 H2 WAT 8345 137.178 137.579 126.858 1.00 0.00 H TER 23061 WAT 8345 ATOM 23061 O WAT 8346 71.630 119.535 76.622 1.00 0.00 O ATOM 23062 H1 WAT 8346 72.204 120.107 77.131 1.00 0.00 H ATOM 23063 H2 WAT 8346 71.923 119.646 75.718 1.00 0.00 H TER 23065 WAT 8346 ATOM 23065 O WAT 8347 114.439 55.368 118.573 1.00 0.00 O ATOM 23066 H1 WAT 8347 114.326 54.419 118.519 1.00 0.00 H ATOM 23067 H2 WAT 8347 114.035 55.610 119.406 1.00 0.00 H TER 23069 WAT 8347 ATOM 23069 O WAT 8348 8.159 42.249 126.080 1.00 0.00 O ATOM 23070 H1 WAT 8348 8.369 42.983 125.503 1.00 0.00 H ATOM 23071 H2 WAT 8348 8.776 42.332 126.808 1.00 0.00 H TER 23073 WAT 8348 ATOM 23073 O WAT 8349 43.892 20.425 101.063 1.00 0.00 O ATOM 23074 H1 WAT 8349 43.500 19.990 101.820 1.00 0.00 H ATOM 23075 H2 WAT 8349 43.554 21.320 101.099 1.00 0.00 H TER 23077 WAT 8349 ATOM 23077 O WAT 8350 82.967 4.150 61.728 1.00 0.00 O ATOM 23078 H1 WAT 8350 83.578 3.431 61.887 1.00 0.00 H ATOM 23079 H2 WAT 8350 83.366 4.904 62.161 1.00 0.00 H TER 23081 WAT 8350 ATOM 23081 O WAT 8351 125.735 32.176 101.119 1.00 0.00 O ATOM 23082 H1 WAT 8351 125.725 33.133 101.133 1.00 0.00 H ATOM 23083 H2 WAT 8351 125.076 31.920 101.764 1.00 0.00 H TER 23085 WAT 8351 ATOM 23085 O WAT 8352 139.788 90.770 83.831 1.00 0.00 O ATOM 23086 H1 WAT 8352 140.152 91.285 84.551 1.00 0.00 H ATOM 23087 H2 WAT 8352 139.959 89.861 84.075 1.00 0.00 H TER 23089 WAT 8352 ATOM 23089 O WAT 8353 103.407 133.202 114.183 1.00 0.00 O ATOM 23090 H1 WAT 8353 104.359 133.305 114.170 1.00 0.00 H ATOM 23091 H2 WAT 8353 103.107 133.659 113.397 1.00 0.00 H TER 23093 WAT 8353 ATOM 23093 O WAT 8354 70.916 109.836 136.866 1.00 0.00 O ATOM 23094 H1 WAT 8354 71.790 109.927 137.245 1.00 0.00 H ATOM 23095 H2 WAT 8354 70.359 109.592 137.605 1.00 0.00 H TER 23097 WAT 8354 ATOM 23097 O WAT 8355 13.510 49.225 81.120 1.00 0.00 O ATOM 23098 H1 WAT 8355 12.668 49.681 81.137 1.00 0.00 H ATOM 23099 H2 WAT 8355 13.925 49.459 81.951 1.00 0.00 H TER 23101 WAT 8355 ATOM 23101 O WAT 8356 81.445 99.349 27.290 1.00 0.00 O ATOM 23102 H1 WAT 8356 81.980 100.140 27.221 1.00 0.00 H ATOM 23103 H2 WAT 8356 82.052 98.633 27.107 1.00 0.00 H TER 23105 WAT 8356 ATOM 23105 O WAT 8357 64.982 47.459 93.912 1.00 0.00 O ATOM 23106 H1 WAT 8357 65.427 48.023 94.544 1.00 0.00 H ATOM 23107 H2 WAT 8357 64.907 46.614 94.355 1.00 0.00 H TER 23109 WAT 8357 ATOM 23109 O WAT 8358 105.352 12.193 131.746 1.00 0.00 O ATOM 23110 H1 WAT 8358 105.188 11.874 132.633 1.00 0.00 H ATOM 23111 H2 WAT 8358 104.752 11.690 131.195 1.00 0.00 H TER 23113 WAT 8358 ATOM 23113 O WAT 8359 99.861 62.434 93.513 1.00 0.00 O ATOM 23114 H1 WAT 8359 99.119 61.880 93.275 1.00 0.00 H ATOM 23115 H2 WAT 8359 99.467 63.185 93.957 1.00 0.00 H TER 23117 WAT 8359 ATOM 23117 O WAT 8360 134.035 50.225 73.393 1.00 0.00 O ATOM 23118 H1 WAT 8360 134.277 50.298 72.470 1.00 0.00 H ATOM 23119 H2 WAT 8360 134.810 50.523 73.869 1.00 0.00 H TER 23121 WAT 8360 ATOM 23121 O WAT 8361 99.705 119.615 73.572 1.00 0.00 O ATOM 23122 H1 WAT 8361 99.086 118.996 73.184 1.00 0.00 H ATOM 23123 H2 WAT 8361 100.506 119.504 73.060 1.00 0.00 H TER 23125 WAT 8361 ATOM 23125 O WAT 8362 16.104 55.008 76.477 1.00 0.00 O ATOM 23126 H1 WAT 8362 15.653 55.109 75.638 1.00 0.00 H ATOM 23127 H2 WAT 8362 15.410 54.780 77.095 1.00 0.00 H TER 23129 WAT 8362 ATOM 23129 O WAT 8363 141.425 58.776 90.180 1.00 0.00 O ATOM 23130 H1 WAT 8363 141.396 59.088 89.276 1.00 0.00 H ATOM 23131 H2 WAT 8363 140.517 58.554 90.386 1.00 0.00 H TER 23133 WAT 8363 ATOM 23133 O WAT 8364 117.576 38.132 63.429 1.00 0.00 O ATOM 23134 H1 WAT 8364 116.741 38.112 63.897 1.00 0.00 H ATOM 23135 H2 WAT 8364 117.553 37.359 62.865 1.00 0.00 H TER 23137 WAT 8364 ATOM 23137 O WAT 8365 142.558 51.517 81.700 1.00 0.00 O ATOM 23138 H1 WAT 8365 143.293 50.906 81.651 1.00 0.00 H ATOM 23139 H2 WAT 8365 141.791 50.959 81.826 1.00 0.00 H TER 23141 WAT 8365 ATOM 23141 O WAT 8366 52.460 20.393 9.854 1.00 0.00 O ATOM 23142 H1 WAT 8366 51.665 20.195 9.359 1.00 0.00 H ATOM 23143 H2 WAT 8366 52.408 19.832 10.628 1.00 0.00 H TER 23145 WAT 8366 ATOM 23145 O WAT 8367 120.262 54.792 78.901 1.00 0.00 O ATOM 23146 H1 WAT 8367 119.583 55.418 79.153 1.00 0.00 H ATOM 23147 H2 WAT 8367 120.999 54.994 79.477 1.00 0.00 H TER 23149 WAT 8367 ATOM 23149 O WAT 8368 30.592 2.548 146.647 1.00 0.00 O ATOM 23150 H1 WAT 8368 29.851 2.705 147.232 1.00 0.00 H ATOM 23151 H2 WAT 8368 31.362 2.613 147.212 1.00 0.00 H TER 23153 WAT 8368 ATOM 23153 O WAT 8369 100.894 63.593 110.991 1.00 0.00 O ATOM 23154 H1 WAT 8369 101.391 63.776 111.788 1.00 0.00 H ATOM 23155 H2 WAT 8369 100.824 62.639 110.967 1.00 0.00 H TER 23157 WAT 8369 ATOM 23157 O WAT 8370 106.674 1.670 144.076 1.00 0.00 O ATOM 23158 H1 WAT 8370 105.983 1.800 143.427 1.00 0.00 H ATOM 23159 H2 WAT 8370 107.022 2.548 144.234 1.00 0.00 H TER 23161 WAT 8370 ATOM 23161 O WAT 8371 102.075 85.709 132.232 1.00 0.00 O ATOM 23162 H1 WAT 8371 102.814 86.026 132.751 1.00 0.00 H ATOM 23163 H2 WAT 8371 101.308 85.874 132.781 1.00 0.00 H TER 23165 WAT 8371 ATOM 23165 O WAT 8372 143.796 12.635 4.636 1.00 0.00 O ATOM 23166 H1 WAT 8372 143.499 13.406 4.153 1.00 0.00 H ATOM 23167 H2 WAT 8372 144.626 12.904 5.029 1.00 0.00 H TER 23169 WAT 8372 ATOM 23169 O WAT 8373 106.078 127.945 2.502 1.00 0.00 O ATOM 23170 H1 WAT 8373 106.661 127.190 2.431 1.00 0.00 H ATOM 23171 H2 WAT 8373 106.253 128.458 1.713 1.00 0.00 H TER 23173 WAT 8373 ATOM 23173 O WAT 8374 83.738 44.554 89.161 1.00 0.00 O ATOM 23174 H1 WAT 8374 83.002 43.944 89.117 1.00 0.00 H ATOM 23175 H2 WAT 8374 83.792 44.929 88.282 1.00 0.00 H TER 23177 WAT 8374 ATOM 23177 O WAT 8375 24.418 136.949 12.082 1.00 0.00 O ATOM 23178 H1 WAT 8375 23.695 137.288 11.554 1.00 0.00 H ATOM 23179 H2 WAT 8375 25.193 137.071 11.534 1.00 0.00 H TER 23181 WAT 8375 ATOM 23181 O WAT 8376 23.418 116.522 138.257 1.00 0.00 O ATOM 23182 H1 WAT 8376 23.146 115.619 138.094 1.00 0.00 H ATOM 23183 H2 WAT 8376 23.683 116.851 137.398 1.00 0.00 H TER 23185 WAT 8376 ATOM 23185 O WAT 8377 82.530 48.625 139.750 1.00 0.00 O ATOM 23186 H1 WAT 8377 81.678 48.201 139.856 1.00 0.00 H ATOM 23187 H2 WAT 8377 82.563 49.275 140.452 1.00 0.00 H TER 23189 WAT 8377 ATOM 23189 O WAT 8378 92.861 66.979 1.871 1.00 0.00 O ATOM 23190 H1 WAT 8378 93.276 67.063 2.730 1.00 0.00 H ATOM 23191 H2 WAT 8378 93.379 66.312 1.420 1.00 0.00 H TER 23193 WAT 8378 ATOM 23193 O WAT 8379 42.966 139.769 114.038 1.00 0.00 O ATOM 23194 H1 WAT 8379 42.138 139.432 113.696 1.00 0.00 H ATOM 23195 H2 WAT 8379 43.631 139.187 113.672 1.00 0.00 H TER 23197 WAT 8379 ATOM 23197 O WAT 8380 56.052 44.145 97.422 1.00 0.00 O ATOM 23198 H1 WAT 8380 55.644 43.664 98.143 1.00 0.00 H ATOM 23199 H2 WAT 8380 56.963 43.853 97.425 1.00 0.00 H TER 23201 WAT 8380 ATOM 23201 O WAT 8381 20.351 17.423 59.923 1.00 0.00 O ATOM 23202 H1 WAT 8381 20.998 17.898 59.402 1.00 0.00 H ATOM 23203 H2 WAT 8381 20.055 16.716 59.350 1.00 0.00 H TER 23205 WAT 8381 ATOM 23205 O WAT 8382 112.000 50.183 17.073 1.00 0.00 O ATOM 23206 H1 WAT 8382 111.624 50.920 17.554 1.00 0.00 H ATOM 23207 H2 WAT 8382 111.914 49.439 17.669 1.00 0.00 H TER 23209 WAT 8382 ATOM 23209 O WAT 8383 97.296 99.309 82.995 1.00 0.00 O ATOM 23210 H1 WAT 8383 97.765 99.555 82.198 1.00 0.00 H ATOM 23211 H2 WAT 8383 97.877 98.686 83.432 1.00 0.00 H TER 23213 WAT 8383 ATOM 23213 O WAT 8384 53.888 49.243 4.614 1.00 0.00 O ATOM 23214 H1 WAT 8384 53.237 48.694 4.178 1.00 0.00 H ATOM 23215 H2 WAT 8384 54.483 48.621 5.034 1.00 0.00 H TER 23217 WAT 8384 ATOM 23217 O WAT 8385 50.013 67.680 10.478 1.00 0.00 O ATOM 23218 H1 WAT 8385 50.396 67.280 9.697 1.00 0.00 H ATOM 23219 H2 WAT 8385 49.144 67.286 10.548 1.00 0.00 H TER 23221 WAT 8385 ATOM 23221 O WAT 8386 71.626 131.895 66.578 1.00 0.00 O ATOM 23222 H1 WAT 8386 71.098 131.414 65.941 1.00 0.00 H ATOM 23223 H2 WAT 8386 72.448 132.074 66.121 1.00 0.00 H TER 23225 WAT 8386 ATOM 23225 O WAT 8387 20.545 19.047 0.368 1.00 0.00 O ATOM 23226 H1 WAT 8387 20.253 18.291 0.878 1.00 0.00 H ATOM 23227 H2 WAT 8387 19.988 19.766 0.665 1.00 0.00 H TER 23229 WAT 8387 ATOM 23229 O WAT 8388 29.955 55.089 75.492 1.00 0.00 O ATOM 23230 H1 WAT 8388 29.640 54.912 74.606 1.00 0.00 H ATOM 23231 H2 WAT 8388 29.710 54.311 75.993 1.00 0.00 H TER 23233 WAT 8388 ATOM 23233 O WAT 8389 132.969 46.814 95.313 1.00 0.00 O ATOM 23234 H1 WAT 8389 133.574 46.380 95.915 1.00 0.00 H ATOM 23235 H2 WAT 8389 133.008 47.738 95.560 1.00 0.00 H TER 23237 WAT 8389 ATOM 23237 O WAT 8390 16.166 11.826 17.726 1.00 0.00 O ATOM 23238 H1 WAT 8390 15.337 12.147 18.079 1.00 0.00 H ATOM 23239 H2 WAT 8390 16.565 12.593 17.314 1.00 0.00 H TER 23241 WAT 8390 ATOM 23241 O WAT 8391 49.285 2.624 128.690 1.00 0.00 O ATOM 23242 H1 WAT 8391 49.404 1.677 128.622 1.00 0.00 H ATOM 23243 H2 WAT 8391 48.401 2.779 128.358 1.00 0.00 H TER 23245 WAT 8391 ATOM 23245 O WAT 8392 53.259 61.778 146.237 1.00 0.00 O ATOM 23246 H1 WAT 8392 53.538 61.540 147.121 1.00 0.00 H ATOM 23247 H2 WAT 8392 52.754 61.023 145.934 1.00 0.00 H TER 23249 WAT 8392 ATOM 23249 O WAT 8393 61.106 5.014 158.479 1.00 0.00 O ATOM 23250 H1 WAT 8393 60.994 5.632 157.757 1.00 0.00 H ATOM 23251 H2 WAT 8393 60.223 4.890 158.828 1.00 0.00 H TER 23253 WAT 8393 ATOM 23253 O WAT 8394 63.001 115.206 131.175 1.00 0.00 O ATOM 23254 H1 WAT 8394 63.179 115.942 130.589 1.00 0.00 H ATOM 23255 H2 WAT 8394 63.837 115.038 131.610 1.00 0.00 H TER 23257 WAT 8394 ATOM 23257 O WAT 8395 24.717 38.263 21.156 1.00 0.00 O ATOM 23258 H1 WAT 8395 25.163 38.609 20.383 1.00 0.00 H ATOM 23259 H2 WAT 8395 23.785 38.330 20.945 1.00 0.00 H TER 23261 WAT 8395 ATOM 23261 O WAT 8396 26.261 109.973 57.535 1.00 0.00 O ATOM 23262 H1 WAT 8396 25.951 109.532 56.744 1.00 0.00 H ATOM 23263 H2 WAT 8396 25.553 109.856 58.168 1.00 0.00 H TER 23265 WAT 8396 ATOM 23265 O WAT 8397 49.302 45.075 57.797 1.00 0.00 O ATOM 23266 H1 WAT 8397 49.327 45.737 58.487 1.00 0.00 H ATOM 23267 H2 WAT 8397 49.799 45.461 57.076 1.00 0.00 H TER 23269 WAT 8397 ATOM 23269 O WAT 8398 15.287 116.187 147.395 1.00 0.00 O ATOM 23270 H1 WAT 8398 15.189 115.800 146.525 1.00 0.00 H ATOM 23271 H2 WAT 8398 16.233 116.218 147.538 1.00 0.00 H TER 23273 WAT 8398 ATOM 23273 O WAT 8399 102.796 44.478 24.889 1.00 0.00 O ATOM 23274 H1 WAT 8399 102.846 43.754 25.513 1.00 0.00 H ATOM 23275 H2 WAT 8399 103.636 44.928 24.975 1.00 0.00 H TER 23277 WAT 8399 ATOM 23277 O WAT 8400 7.875 93.238 111.956 1.00 0.00 O ATOM 23278 H1 WAT 8400 7.739 92.763 111.136 1.00 0.00 H ATOM 23279 H2 WAT 8400 7.691 94.152 111.737 1.00 0.00 H TER 23281 WAT 8400 ATOM 23281 O WAT 8401 25.239 24.798 121.303 1.00 0.00 O ATOM 23282 H1 WAT 8401 25.761 24.324 121.951 1.00 0.00 H ATOM 23283 H2 WAT 8401 24.621 24.147 120.971 1.00 0.00 H TER 23285 WAT 8401 ATOM 23285 O WAT 8402 89.546 27.714 149.462 1.00 0.00 O ATOM 23286 H1 WAT 8402 89.676 28.653 149.330 1.00 0.00 H ATOM 23287 H2 WAT 8402 89.727 27.576 150.392 1.00 0.00 H TER 23289 WAT 8402 ATOM 23289 O WAT 8403 48.942 72.568 69.812 1.00 0.00 O ATOM 23290 H1 WAT 8403 48.734 72.101 69.003 1.00 0.00 H ATOM 23291 H2 WAT 8403 48.205 72.379 70.394 1.00 0.00 H TER 23293 WAT 8403 ATOM 23293 O WAT 8404 22.777 121.194 18.755 1.00 0.00 O ATOM 23294 H1 WAT 8404 22.447 120.313 18.931 1.00 0.00 H ATOM 23295 H2 WAT 8404 22.355 121.744 19.415 1.00 0.00 H TER 23297 WAT 8404 ATOM 23297 O WAT 8405 102.402 13.904 10.585 1.00 0.00 O ATOM 23298 H1 WAT 8405 102.340 12.998 10.280 1.00 0.00 H ATOM 23299 H2 WAT 8405 101.745 14.374 10.072 1.00 0.00 H TER 23301 WAT 8405 ATOM 23301 O WAT 8406 114.824 49.118 136.620 1.00 0.00 O ATOM 23302 H1 WAT 8406 115.016 48.222 136.343 1.00 0.00 H ATOM 23303 H2 WAT 8406 115.577 49.628 136.320 1.00 0.00 H TER 23305 WAT 8406 ATOM 23305 O WAT 8407 60.488 109.339 105.082 1.00 0.00 O ATOM 23306 H1 WAT 8407 60.863 110.217 105.151 1.00 0.00 H ATOM 23307 H2 WAT 8407 61.104 108.858 104.530 1.00 0.00 H TER 23309 WAT 8407 ATOM 23309 O WAT 8408 22.262 76.235 68.859 1.00 0.00 O ATOM 23310 H1 WAT 8408 22.848 76.565 68.178 1.00 0.00 H ATOM 23311 H2 WAT 8408 21.626 75.697 68.388 1.00 0.00 H TER 23313 WAT 8408 ATOM 23313 O WAT 8409 2.372 29.480 130.794 1.00 0.00 O ATOM 23314 H1 WAT 8409 2.361 29.231 129.870 1.00 0.00 H ATOM 23315 H2 WAT 8409 3.261 29.281 131.085 1.00 0.00 H TER 23317 WAT 8409 ATOM 23317 O WAT 8410 145.208 136.492 7.256 1.00 0.00 O ATOM 23318 H1 WAT 8410 145.494 136.526 8.169 1.00 0.00 H ATOM 23319 H2 WAT 8410 144.420 135.949 7.271 1.00 0.00 H TER 23321 WAT 8410 ATOM 23321 O WAT 8411 118.910 95.954 139.390 1.00 0.00 O ATOM 23322 H1 WAT 8411 119.737 95.642 139.756 1.00 0.00 H ATOM 23323 H2 WAT 8411 118.818 96.844 139.731 1.00 0.00 H TER 23325 WAT 8411 ATOM 23325 O WAT 8412 73.948 1.493 19.780 1.00 0.00 O ATOM 23326 H1 WAT 8412 73.234 0.872 19.635 1.00 0.00 H ATOM 23327 H2 WAT 8412 74.318 1.238 20.625 1.00 0.00 H TER 23329 WAT 8412 ATOM 23329 O WAT 8413 129.989 115.091 16.213 1.00 0.00 O ATOM 23330 H1 WAT 8413 130.273 114.181 16.125 1.00 0.00 H ATOM 23331 H2 WAT 8413 129.059 115.074 15.988 1.00 0.00 H TER 23333 WAT 8413 ATOM 23333 O WAT 8414 48.095 3.827 106.396 1.00 0.00 O ATOM 23334 H1 WAT 8414 47.398 4.482 106.425 1.00 0.00 H ATOM 23335 H2 WAT 8414 47.647 2.994 106.540 1.00 0.00 H TER 23337 WAT 8414 ATOM 23337 O WAT 8415 52.466 60.432 77.354 1.00 0.00 O ATOM 23338 H1 WAT 8415 51.551 60.290 77.114 1.00 0.00 H ATOM 23339 H2 WAT 8415 52.426 60.854 78.212 1.00 0.00 H TER 23341 WAT 8415 ATOM 23341 O WAT 8416 141.295 20.794 85.186 1.00 0.00 O ATOM 23342 H1 WAT 8416 142.149 21.039 84.830 1.00 0.00 H ATOM 23343 H2 WAT 8416 140.829 21.624 85.285 1.00 0.00 H TER 23345 WAT 8416 ATOM 23345 O WAT 8417 50.252 138.781 135.758 1.00 0.00 O ATOM 23346 H1 WAT 8417 50.916 138.682 135.075 1.00 0.00 H ATOM 23347 H2 WAT 8417 49.606 138.102 135.564 1.00 0.00 H TER 23349 WAT 8417 ATOM 23349 O WAT 8418 123.758 84.139 130.783 1.00 0.00 O ATOM 23350 H1 WAT 8418 123.551 84.394 129.884 1.00 0.00 H ATOM 23351 H2 WAT 8418 123.312 83.301 130.903 1.00 0.00 H TER 23353 WAT 8418 ATOM 23353 O WAT 8419 96.962 84.596 144.384 1.00 0.00 O ATOM 23354 H1 WAT 8419 97.147 84.236 145.251 1.00 0.00 H ATOM 23355 H2 WAT 8419 97.632 85.268 144.255 1.00 0.00 H TER 23357 WAT 8419 ATOM 23357 O WAT 8420 26.385 124.940 143.979 1.00 0.00 O ATOM 23358 H1 WAT 8420 26.637 124.018 144.032 1.00 0.00 H ATOM 23359 H2 WAT 8420 25.624 125.014 144.555 1.00 0.00 H TER 23361 WAT 8420 ATOM 23361 O WAT 8421 91.187 50.734 124.351 1.00 0.00 O ATOM 23362 H1 WAT 8421 91.530 51.279 125.059 1.00 0.00 H ATOM 23363 H2 WAT 8421 91.389 51.223 123.553 1.00 0.00 H TER 23365 WAT 8421 ATOM 23365 O WAT 8422 86.613 13.348 135.609 1.00 0.00 O ATOM 23366 H1 WAT 8422 86.075 13.154 134.841 1.00 0.00 H ATOM 23367 H2 WAT 8422 87.022 12.512 135.832 1.00 0.00 H TER 23369 WAT 8422 ATOM 23369 O WAT 8423 106.564 105.272 71.505 1.00 0.00 O ATOM 23370 H1 WAT 8423 106.022 104.789 72.130 1.00 0.00 H ATOM 23371 H2 WAT 8423 106.505 104.765 70.695 1.00 0.00 H TER 23373 WAT 8423 ATOM 23373 O WAT 8424 4.388 71.749 141.789 1.00 0.00 O ATOM 23374 H1 WAT 8424 4.663 72.586 141.415 1.00 0.00 H ATOM 23375 H2 WAT 8424 3.800 71.989 142.505 1.00 0.00 H TER 23377 WAT 8424 ATOM 23377 O WAT 8425 54.614 107.995 94.930 1.00 0.00 O ATOM 23378 H1 WAT 8425 54.556 107.649 95.821 1.00 0.00 H ATOM 23379 H2 WAT 8425 53.943 107.517 94.443 1.00 0.00 H TER 23381 WAT 8425 ATOM 23381 O WAT 8426 67.400 29.788 107.200 1.00 0.00 O ATOM 23382 H1 WAT 8426 67.231 29.121 107.865 1.00 0.00 H ATOM 23383 H2 WAT 8426 67.017 29.430 106.399 1.00 0.00 H TER 23385 WAT 8426 ATOM 23385 O WAT 8427 26.256 90.879 30.655 1.00 0.00 O ATOM 23386 H1 WAT 8427 27.001 91.468 30.538 1.00 0.00 H ATOM 23387 H2 WAT 8427 26.645 90.005 30.698 1.00 0.00 H TER 23389 WAT 8427 ATOM 23389 O WAT 8428 61.562 26.116 140.489 1.00 0.00 O ATOM 23390 H1 WAT 8428 62.234 25.449 140.624 1.00 0.00 H ATOM 23391 H2 WAT 8428 62.014 26.822 140.027 1.00 0.00 H TER 23393 WAT 8428 ATOM 23393 O WAT 8429 128.880 137.948 14.245 1.00 0.00 O ATOM 23394 H1 WAT 8429 128.050 138.163 14.671 1.00 0.00 H ATOM 23395 H2 WAT 8429 129.090 138.724 13.726 1.00 0.00 H TER 23397 WAT 8429 ATOM 23397 O WAT 8430 141.449 112.852 92.977 1.00 0.00 O ATOM 23398 H1 WAT 8430 140.674 112.411 92.627 1.00 0.00 H ATOM 23399 H2 WAT 8430 141.124 113.343 93.732 1.00 0.00 H TER 23401 WAT 8430 ATOM 23401 O WAT 8431 92.810 135.861 102.815 1.00 0.00 O ATOM 23402 H1 WAT 8431 92.376 136.555 102.319 1.00 0.00 H ATOM 23403 H2 WAT 8431 92.180 135.624 103.496 1.00 0.00 H TER 23405 WAT 8431 ATOM 23405 O WAT 8432 36.408 141.606 129.492 1.00 0.00 O ATOM 23406 H1 WAT 8432 36.340 142.527 129.744 1.00 0.00 H ATOM 23407 H2 WAT 8432 35.502 141.297 129.469 1.00 0.00 H TER 23409 WAT 8432 ATOM 23409 O WAT 8433 85.527 36.343 124.303 1.00 0.00 O ATOM 23410 H1 WAT 8433 86.136 37.009 123.982 1.00 0.00 H ATOM 23411 H2 WAT 8433 85.785 36.202 125.214 1.00 0.00 H TER 23413 WAT 8433 ATOM 23413 O WAT 8434 16.811 77.811 82.121 1.00 0.00 O ATOM 23414 H1 WAT 8434 16.816 77.362 82.966 1.00 0.00 H ATOM 23415 H2 WAT 8434 16.386 78.651 82.298 1.00 0.00 H TER 23417 WAT 8434 ATOM 23417 O WAT 8435 25.669 132.660 0.758 1.00 0.00 O ATOM 23418 H1 WAT 8435 25.371 133.061 1.574 1.00 0.00 H ATOM 23419 H2 WAT 8435 26.181 131.901 1.037 1.00 0.00 H TER 23421 WAT 8435 ATOM 23421 O WAT 8436 25.222 54.911 77.112 1.00 0.00 O ATOM 23422 H1 WAT 8436 26.078 55.153 77.463 1.00 0.00 H ATOM 23423 H2 WAT 8436 24.637 55.612 77.402 1.00 0.00 H TER 23425 WAT 8436 ATOM 23425 O WAT 8437 107.132 37.648 0.987 1.00 0.00 O ATOM 23426 H1 WAT 8437 106.744 37.627 1.862 1.00 0.00 H ATOM 23427 H2 WAT 8437 107.415 38.555 0.872 1.00 0.00 H TER 23429 WAT 8437 ATOM 23429 O WAT 8438 77.254 54.077 158.051 1.00 0.00 O ATOM 23430 H1 WAT 8438 77.709 53.339 157.644 1.00 0.00 H ATOM 23431 H2 WAT 8438 77.947 54.707 158.247 1.00 0.00 H TER 23433 WAT 8438 ATOM 23433 O WAT 8439 100.210 49.663 1.763 1.00 0.00 O ATOM 23434 H1 WAT 8439 100.450 48.990 1.126 1.00 0.00 H ATOM 23435 H2 WAT 8439 100.054 50.447 1.237 1.00 0.00 H TER 23437 WAT 8439 ATOM 23437 O WAT 8440 11.217 130.032 106.936 1.00 0.00 O ATOM 23438 H1 WAT 8440 11.463 130.190 106.025 1.00 0.00 H ATOM 23439 H2 WAT 8440 12.044 130.062 107.416 1.00 0.00 H TER 23441 WAT 8440 ATOM 23441 O WAT 8441 25.886 42.814 115.935 1.00 0.00 O ATOM 23442 H1 WAT 8441 26.558 43.461 115.719 1.00 0.00 H ATOM 23443 H2 WAT 8441 25.059 43.256 115.745 1.00 0.00 H TER 23445 WAT 8441 ATOM 23445 O WAT 8442 106.612 71.317 99.902 1.00 0.00 O ATOM 23446 H1 WAT 8442 105.662 71.284 100.012 1.00 0.00 H ATOM 23447 H2 WAT 8442 106.901 71.987 100.523 1.00 0.00 H TER 23449 WAT 8442 ATOM 23449 O WAT 8443 99.570 110.199 138.164 1.00 0.00 O ATOM 23450 H1 WAT 8443 100.261 110.439 138.781 1.00 0.00 H ATOM 23451 H2 WAT 8443 100.033 110.011 137.347 1.00 0.00 H TER 23453 WAT 8443 ATOM 23453 O WAT 8444 116.128 24.087 13.009 1.00 0.00 O ATOM 23454 H1 WAT 8444 115.641 23.505 12.425 1.00 0.00 H ATOM 23455 H2 WAT 8444 116.843 24.425 12.470 1.00 0.00 H TER 23457 WAT 8444 ATOM 23457 O WAT 8445 133.078 13.254 122.921 1.00 0.00 O ATOM 23458 H1 WAT 8445 133.565 13.707 123.608 1.00 0.00 H ATOM 23459 H2 WAT 8445 133.059 13.874 122.192 1.00 0.00 H TER 23461 WAT 8445 ATOM 23461 O WAT 8446 77.761 101.992 93.804 1.00 0.00 O ATOM 23462 H1 WAT 8446 76.905 102.410 93.711 1.00 0.00 H ATOM 23463 H2 WAT 8446 77.562 101.068 93.953 1.00 0.00 H TER 23465 WAT 8446 ATOM 23465 O WAT 8447 72.327 102.239 114.880 1.00 0.00 O ATOM 23466 H1 WAT 8447 72.324 102.994 114.291 1.00 0.00 H ATOM 23467 H2 WAT 8447 71.567 101.723 114.613 1.00 0.00 H TER 23469 WAT 8447 ATOM 23469 O WAT 8448 101.108 120.211 92.328 1.00 0.00 O ATOM 23470 H1 WAT 8448 101.647 119.631 92.865 1.00 0.00 H ATOM 23471 H2 WAT 8448 100.255 120.216 92.762 1.00 0.00 H TER 23473 WAT 8448 ATOM 23473 O WAT 8449 129.201 51.378 146.125 1.00 0.00 O ATOM 23474 H1 WAT 8449 129.359 52.287 145.872 1.00 0.00 H ATOM 23475 H2 WAT 8449 129.300 51.373 147.077 1.00 0.00 H TER 23477 WAT 8449 ATOM 23477 O WAT 8450 63.100 61.913 21.943 1.00 0.00 O ATOM 23478 H1 WAT 8450 62.462 61.734 22.633 1.00 0.00 H ATOM 23479 H2 WAT 8450 63.921 62.069 22.410 1.00 0.00 H TER 23481 WAT 8450 ATOM 23481 O WAT 8451 126.406 16.409 66.571 1.00 0.00 O ATOM 23482 H1 WAT 8451 126.286 16.008 65.710 1.00 0.00 H ATOM 23483 H2 WAT 8451 125.528 16.692 66.827 1.00 0.00 H TER 23485 WAT 8451 ATOM 23485 O WAT 8452 42.562 43.359 149.641 1.00 0.00 O ATOM 23486 H1 WAT 8452 43.073 43.800 148.962 1.00 0.00 H ATOM 23487 H2 WAT 8452 42.711 42.426 149.486 1.00 0.00 H TER 23489 WAT 8452 ATOM 23489 O WAT 8453 108.088 82.255 148.578 1.00 0.00 O ATOM 23490 H1 WAT 8453 108.322 83.057 149.046 1.00 0.00 H ATOM 23491 H2 WAT 8453 107.707 82.561 147.755 1.00 0.00 H TER 23493 WAT 8453 ATOM 23493 O WAT 8454 5.880 141.789 13.103 1.00 0.00 O ATOM 23494 H1 WAT 8454 5.246 142.498 13.213 1.00 0.00 H ATOM 23495 H2 WAT 8454 6.251 141.933 12.233 1.00 0.00 H TER 23497 WAT 8454 ATOM 23497 O WAT 8455 109.093 117.946 122.801 1.00 0.00 O ATOM 23498 H1 WAT 8455 109.551 118.605 122.279 1.00 0.00 H ATOM 23499 H2 WAT 8455 108.239 118.336 122.984 1.00 0.00 H TER 23501 WAT 8455 ATOM 23501 O WAT 8456 31.585 135.979 108.275 1.00 0.00 O ATOM 23502 H1 WAT 8456 32.249 135.337 108.523 1.00 0.00 H ATOM 23503 H2 WAT 8456 31.591 135.973 107.318 1.00 0.00 H TER 23505 WAT 8456 ATOM 23505 O WAT 8457 22.414 131.267 55.292 1.00 0.00 O ATOM 23506 H1 WAT 8457 23.286 131.549 55.019 1.00 0.00 H ATOM 23507 H2 WAT 8457 21.849 131.482 54.550 1.00 0.00 H TER 23509 WAT 8457 ATOM 23509 O WAT 8458 107.913 14.746 81.202 1.00 0.00 O ATOM 23510 H1 WAT 8458 107.830 15.498 81.788 1.00 0.00 H ATOM 23511 H2 WAT 8458 108.711 14.918 80.702 1.00 0.00 H TER 23513 WAT 8458 ATOM 23513 O WAT 8459 25.753 126.011 157.712 1.00 0.00 O ATOM 23514 H1 WAT 8459 24.882 125.953 158.105 1.00 0.00 H ATOM 23515 H2 WAT 8459 26.300 126.397 158.396 1.00 0.00 H TER 23517 WAT 8459 ATOM 23517 O WAT 8460 87.729 53.631 68.590 1.00 0.00 O ATOM 23518 H1 WAT 8460 87.509 54.341 69.194 1.00 0.00 H ATOM 23519 H2 WAT 8460 88.513 53.939 68.135 1.00 0.00 H TER 23521 WAT 8460 ATOM 23521 O WAT 8461 88.685 9.918 96.727 1.00 0.00 O ATOM 23522 H1 WAT 8461 88.254 10.449 97.397 1.00 0.00 H ATOM 23523 H2 WAT 8461 88.972 10.550 96.068 1.00 0.00 H TER 23525 WAT 8461 ATOM 23525 O WAT 8462 107.894 52.837 28.466 1.00 0.00 O ATOM 23526 H1 WAT 8462 106.937 52.805 28.477 1.00 0.00 H ATOM 23527 H2 WAT 8462 108.166 51.953 28.711 1.00 0.00 H TER 23529 WAT 8462 ATOM 23529 O WAT 8463 73.041 93.765 142.430 1.00 0.00 O ATOM 23530 H1 WAT 8463 73.159 94.681 142.180 1.00 0.00 H ATOM 23531 H2 WAT 8463 73.530 93.271 141.772 1.00 0.00 H TER 23533 WAT 8463 ATOM 23533 O WAT 8464 97.098 100.063 10.785 1.00 0.00 O ATOM 23534 H1 WAT 8464 97.460 100.809 11.263 1.00 0.00 H ATOM 23535 H2 WAT 8464 97.160 100.316 9.864 1.00 0.00 H TER 23537 WAT 8464 ATOM 23537 O WAT 8465 24.425 80.775 141.506 1.00 0.00 O ATOM 23538 H1 WAT 8465 23.912 81.264 140.863 1.00 0.00 H ATOM 23539 H2 WAT 8465 24.609 79.938 141.080 1.00 0.00 H TER 23541 WAT 8465 ATOM 23541 O WAT 8466 117.365 12.898 153.755 1.00 0.00 O ATOM 23542 H1 WAT 8466 116.699 13.348 154.275 1.00 0.00 H ATOM 23543 H2 WAT 8466 117.981 12.552 154.401 1.00 0.00 H TER 23545 WAT 8466 ATOM 23545 O WAT 8467 122.196 103.898 115.115 1.00 0.00 O ATOM 23546 H1 WAT 8467 122.227 103.656 116.041 1.00 0.00 H ATOM 23547 H2 WAT 8467 123.066 104.254 114.932 1.00 0.00 H TER 23549 WAT 8467 ATOM 23549 O WAT 8468 32.239 62.639 24.086 1.00 0.00 O ATOM 23550 H1 WAT 8468 32.596 63.050 23.299 1.00 0.00 H ATOM 23551 H2 WAT 8468 32.807 61.885 24.241 1.00 0.00 H TER 23553 WAT 8468 ATOM 23553 O WAT 8469 12.076 94.353 134.545 1.00 0.00 O ATOM 23554 H1 WAT 8469 11.609 94.204 135.368 1.00 0.00 H ATOM 23555 H2 WAT 8469 12.121 95.305 134.465 1.00 0.00 H TER 23557 WAT 8469 ATOM 23557 O WAT 8470 44.891 27.857 122.739 1.00 0.00 O ATOM 23558 H1 WAT 8470 43.961 27.914 122.957 1.00 0.00 H ATOM 23559 H2 WAT 8470 45.276 27.355 123.458 1.00 0.00 H TER 23561 WAT 8470 ATOM 23561 O WAT 8471 49.377 53.974 0.464 1.00 0.00 O ATOM 23562 H1 WAT 8471 49.048 53.910 -0.432 1.00 0.00 H ATOM 23563 H2 WAT 8471 49.224 53.106 0.838 1.00 0.00 H TER 23565 WAT 8471 ATOM 23565 O WAT 8472 118.709 64.665 122.005 1.00 0.00 O ATOM 23566 H1 WAT 8472 119.578 65.039 122.150 1.00 0.00 H ATOM 23567 H2 WAT 8472 118.226 64.861 122.808 1.00 0.00 H TER 23569 WAT 8472 ATOM 23569 O WAT 8473 55.790 23.504 124.431 1.00 0.00 O ATOM 23570 H1 WAT 8473 56.246 23.831 125.207 1.00 0.00 H ATOM 23571 H2 WAT 8473 55.261 24.244 124.134 1.00 0.00 H TER 23573 WAT 8473 ATOM 23573 O WAT 8474 121.744 19.956 145.380 1.00 0.00 O ATOM 23574 H1 WAT 8474 122.063 19.434 144.643 1.00 0.00 H ATOM 23575 H2 WAT 8474 122.260 20.761 145.343 1.00 0.00 H TER 23577 WAT 8474 ATOM 23577 O WAT 8475 144.943 28.442 68.140 1.00 0.00 O ATOM 23578 H1 WAT 8475 144.626 29.289 67.826 1.00 0.00 H ATOM 23579 H2 WAT 8475 145.806 28.345 67.739 1.00 0.00 H TER 23581 WAT 8475 ATOM 23581 O WAT 8476 11.930 69.374 104.696 1.00 0.00 O ATOM 23582 H1 WAT 8476 10.983 69.334 104.830 1.00 0.00 H ATOM 23583 H2 WAT 8476 12.031 69.551 103.760 1.00 0.00 H TER 23585 WAT 8476 ATOM 23585 O WAT 8477 100.134 40.159 18.064 1.00 0.00 O ATOM 23586 H1 WAT 8477 100.580 39.319 18.174 1.00 0.00 H ATOM 23587 H2 WAT 8477 99.271 39.928 17.720 1.00 0.00 H TER 23589 WAT 8477 ATOM 23589 O WAT 8478 1.610 122.459 137.721 1.00 0.00 O ATOM 23590 H1 WAT 8478 0.661 122.538 137.812 1.00 0.00 H ATOM 23591 H2 WAT 8478 1.961 123.181 138.242 1.00 0.00 H TER 23593 WAT 8478 ATOM 23593 O WAT 8479 25.154 72.920 130.442 1.00 0.00 O ATOM 23594 H1 WAT 8479 25.741 73.350 131.064 1.00 0.00 H ATOM 23595 H2 WAT 8479 24.365 72.729 130.949 1.00 0.00 H TER 23597 WAT 8479 ATOM 23597 O WAT 8480 106.742 18.676 93.281 1.00 0.00 O ATOM 23598 H1 WAT 8480 106.984 18.819 94.196 1.00 0.00 H ATOM 23599 H2 WAT 8480 107.277 17.932 93.005 1.00 0.00 H TER 23601 WAT 8480 ATOM 23601 O WAT 8481 80.314 16.776 153.075 1.00 0.00 O ATOM 23602 H1 WAT 8481 80.760 16.453 153.858 1.00 0.00 H ATOM 23603 H2 WAT 8481 79.385 16.758 153.305 1.00 0.00 H TER 23605 WAT 8481 ATOM 23605 O WAT 8482 103.885 120.251 109.082 1.00 0.00 O ATOM 23606 H1 WAT 8482 104.382 119.939 109.839 1.00 0.00 H ATOM 23607 H2 WAT 8482 103.925 121.205 109.147 1.00 0.00 H TER 23609 WAT 8482 ATOM 23609 O WAT 8483 141.033 64.305 83.699 1.00 0.00 O ATOM 23610 H1 WAT 8483 140.435 63.710 84.151 1.00 0.00 H ATOM 23611 H2 WAT 8483 141.232 64.982 84.345 1.00 0.00 H TER 23613 WAT 8483 ATOM 23613 O WAT 8484 88.183 111.680 17.463 1.00 0.00 O ATOM 23614 H1 WAT 8484 88.764 112.073 18.115 1.00 0.00 H ATOM 23615 H2 WAT 8484 87.379 111.487 17.944 1.00 0.00 H TER 23617 WAT 8484 ATOM 23617 O WAT 8485 111.065 24.589 72.023 1.00 0.00 O ATOM 23618 H1 WAT 8485 111.790 25.162 72.271 1.00 0.00 H ATOM 23619 H2 WAT 8485 111.295 23.737 72.395 1.00 0.00 H TER 23621 WAT 8485 ATOM 23621 O WAT 8486 132.357 44.686 112.981 1.00 0.00 O ATOM 23622 H1 WAT 8486 131.548 44.440 112.533 1.00 0.00 H ATOM 23623 H2 WAT 8486 133.032 44.631 112.304 1.00 0.00 H TER 23625 WAT 8486 ATOM 23625 O WAT 8487 104.358 137.297 62.677 1.00 0.00 O ATOM 23626 H1 WAT 8487 104.662 136.674 63.337 1.00 0.00 H ATOM 23627 H2 WAT 8487 104.633 136.916 61.843 1.00 0.00 H TER 23629 WAT 8487 ATOM 23629 O WAT 8488 136.489 4.743 77.336 1.00 0.00 O ATOM 23630 H1 WAT 8488 137.011 4.859 76.543 1.00 0.00 H ATOM 23631 H2 WAT 8488 135.625 5.084 77.106 1.00 0.00 H TER 23633 WAT 8488 ATOM 23633 O WAT 8489 25.263 26.967 13.689 1.00 0.00 O ATOM 23634 H1 WAT 8489 25.047 26.759 12.780 1.00 0.00 H ATOM 23635 H2 WAT 8489 25.767 26.213 13.995 1.00 0.00 H TER 23637 WAT 8489 ATOM 23637 O WAT 8490 90.348 3.969 80.232 1.00 0.00 O ATOM 23638 H1 WAT 8490 90.389 4.687 80.863 1.00 0.00 H ATOM 23639 H2 WAT 8490 90.624 3.198 80.729 1.00 0.00 H TER 23641 WAT 8490 ATOM 23641 O WAT 8491 145.454 85.789 63.464 1.00 0.00 O ATOM 23642 H1 WAT 8491 145.505 86.729 63.290 1.00 0.00 H ATOM 23643 H2 WAT 8491 144.527 85.576 63.359 1.00 0.00 H TER 23645 WAT 8491 ATOM 23645 O WAT 8492 50.529 20.814 97.071 1.00 0.00 O ATOM 23646 H1 WAT 8492 50.762 20.703 97.993 1.00 0.00 H ATOM 23647 H2 WAT 8492 51.324 21.158 96.664 1.00 0.00 H TER 23649 WAT 8492 ATOM 23649 O WAT 8493 128.284 117.396 102.864 1.00 0.00 O ATOM 23650 H1 WAT 8493 127.710 118.150 102.733 1.00 0.00 H ATOM 23651 H2 WAT 8493 129.119 117.776 103.137 1.00 0.00 H TER 23653 WAT 8493 ATOM 23653 O WAT 8494 51.950 129.918 5.929 1.00 0.00 O ATOM 23654 H1 WAT 8494 51.112 130.328 6.146 1.00 0.00 H ATOM 23655 H2 WAT 8494 52.515 130.119 6.675 1.00 0.00 H TER 23657 WAT 8494 ATOM 23657 O WAT 8495 35.830 145.861 104.828 1.00 0.00 O ATOM 23658 H1 WAT 8495 35.579 145.210 105.484 1.00 0.00 H ATOM 23659 H2 WAT 8495 35.545 145.484 103.995 1.00 0.00 H TER 23661 WAT 8495 ATOM 23661 O WAT 8496 118.100 84.895 104.710 1.00 0.00 O ATOM 23662 H1 WAT 8496 118.760 85.486 104.348 1.00 0.00 H ATOM 23663 H2 WAT 8496 117.351 85.460 104.901 1.00 0.00 H TER 23665 WAT 8496 ATOM 23665 O WAT 8497 140.507 9.753 80.060 1.00 0.00 O ATOM 23666 H1 WAT 8497 140.859 9.547 80.926 1.00 0.00 H ATOM 23667 H2 WAT 8497 141.267 9.725 79.479 1.00 0.00 H TER 23669 WAT 8497 ATOM 23669 O WAT 8498 61.220 4.206 51.009 1.00 0.00 O ATOM 23670 H1 WAT 8498 61.215 3.425 50.455 1.00 0.00 H ATOM 23671 H2 WAT 8498 60.394 4.163 51.491 1.00 0.00 H TER 23673 WAT 8498 ATOM 23673 O WAT 8499 18.097 74.601 152.990 1.00 0.00 O ATOM 23674 H1 WAT 8499 17.839 73.772 153.393 1.00 0.00 H ATOM 23675 H2 WAT 8499 18.646 75.027 153.648 1.00 0.00 H TER 23677 WAT 8499 ATOM 23677 O WAT 8500 135.606 24.452 118.979 1.00 0.00 O ATOM 23678 H1 WAT 8500 135.448 24.715 118.072 1.00 0.00 H ATOM 23679 H2 WAT 8500 135.740 25.276 119.447 1.00 0.00 H TER 23681 WAT 8500 ATOM 23681 O WAT 8501 27.310 113.686 123.170 1.00 0.00 O ATOM 23682 H1 WAT 8501 27.892 112.926 123.153 1.00 0.00 H ATOM 23683 H2 WAT 8501 27.150 113.886 122.248 1.00 0.00 H TER 23685 WAT 8501 ATOM 23685 O WAT 8502 106.685 139.032 113.277 1.00 0.00 O ATOM 23686 H1 WAT 8502 105.750 139.239 113.272 1.00 0.00 H ATOM 23687 H2 WAT 8502 107.066 139.634 112.638 1.00 0.00 H TER 23689 WAT 8502 ATOM 23689 O WAT 8503 9.007 79.673 145.880 1.00 0.00 O ATOM 23690 H1 WAT 8503 9.355 78.805 146.084 1.00 0.00 H ATOM 23691 H2 WAT 8503 8.153 79.696 146.313 1.00 0.00 H TER 23693 WAT 8503 ATOM 23693 O WAT 8504 77.001 31.778 134.377 1.00 0.00 O ATOM 23694 H1 WAT 8504 76.432 31.352 135.018 1.00 0.00 H ATOM 23695 H2 WAT 8504 77.447 31.056 133.935 1.00 0.00 H TER 23697 WAT 8504 ATOM 23697 O WAT 8505 65.232 111.482 90.318 1.00 0.00 O ATOM 23698 H1 WAT 8505 65.826 112.233 90.323 1.00 0.00 H ATOM 23699 H2 WAT 8505 65.750 110.765 90.684 1.00 0.00 H TER 23701 WAT 8505 ATOM 23701 O WAT 8506 125.156 114.773 119.709 1.00 0.00 O ATOM 23702 H1 WAT 8506 124.388 114.762 119.138 1.00 0.00 H ATOM 23703 H2 WAT 8506 125.899 114.681 119.112 1.00 0.00 H TER 23705 WAT 8506 ATOM 23705 O WAT 8507 139.628 139.181 87.371 1.00 0.00 O ATOM 23706 H1 WAT 8507 140.320 139.832 87.489 1.00 0.00 H ATOM 23707 H2 WAT 8507 140.080 138.410 87.028 1.00 0.00 H TER 23709 WAT 8507 ATOM 23709 O WAT 8508 80.625 50.965 100.155 1.00 0.00 O ATOM 23710 H1 WAT 8508 79.714 50.990 100.449 1.00 0.00 H ATOM 23711 H2 WAT 8508 81.132 51.209 100.930 1.00 0.00 H TER 23713 WAT 8508 ATOM 23713 O WAT 8509 36.684 39.783 25.920 1.00 0.00 O ATOM 23714 H1 WAT 8509 35.901 40.034 25.430 1.00 0.00 H ATOM 23715 H2 WAT 8509 37.404 39.907 25.302 1.00 0.00 H TER 23717 WAT 8509 ATOM 23717 O WAT 8510 77.466 97.315 10.760 1.00 0.00 O ATOM 23718 H1 WAT 8510 77.674 98.191 10.436 1.00 0.00 H ATOM 23719 H2 WAT 8510 78.094 97.165 11.467 1.00 0.00 H TER 23721 WAT 8510 ATOM 23721 O WAT 8511 32.858 20.767 155.826 1.00 0.00 O ATOM 23722 H1 WAT 8511 32.867 20.299 156.661 1.00 0.00 H ATOM 23723 H2 WAT 8511 32.391 20.183 155.229 1.00 0.00 H TER 23725 WAT 8511 ATOM 23725 O WAT 8512 2.341 137.922 138.425 1.00 0.00 O ATOM 23726 H1 WAT 8512 1.561 138.477 138.417 1.00 0.00 H ATOM 23727 H2 WAT 8512 2.651 137.958 139.329 1.00 0.00 H TER 23729 WAT 8512 ATOM 23729 O WAT 8513 11.386 60.100 95.820 1.00 0.00 O ATOM 23730 H1 WAT 8513 11.798 59.664 96.566 1.00 0.00 H ATOM 23731 H2 WAT 8513 11.557 61.031 95.963 1.00 0.00 H TER 23733 WAT 8513 ATOM 23733 O WAT 8514 0.522 82.156 4.097 1.00 0.00 O ATOM 23734 H1 WAT 8514 0.894 81.529 3.476 1.00 0.00 H ATOM 23735 H2 WAT 8514 0.270 82.906 3.559 1.00 0.00 H TER 23737 WAT 8514 ATOM 23737 O WAT 8515 48.004 33.590 147.142 1.00 0.00 O ATOM 23738 H1 WAT 8515 48.159 33.178 147.992 1.00 0.00 H ATOM 23739 H2 WAT 8515 47.681 34.466 147.355 1.00 0.00 H TER 23741 WAT 8515 ATOM 23741 O WAT 8516 68.558 121.512 125.075 1.00 0.00 O ATOM 23742 H1 WAT 8516 68.777 122.426 125.256 1.00 0.00 H ATOM 23743 H2 WAT 8516 68.722 121.058 125.901 1.00 0.00 H TER 23745 WAT 8516 ATOM 23745 O WAT 8517 71.858 72.438 87.872 1.00 0.00 O ATOM 23746 H1 WAT 8517 71.678 73.373 87.774 1.00 0.00 H ATOM 23747 H2 WAT 8517 72.738 72.402 88.248 1.00 0.00 H TER 23749 WAT 8517 ATOM 23749 O WAT 8518 88.038 59.253 16.377 1.00 0.00 O ATOM 23750 H1 WAT 8518 87.617 60.030 16.746 1.00 0.00 H ATOM 23751 H2 WAT 8518 88.883 59.204 16.824 1.00 0.00 H TER 23753 WAT 8518 ATOM 23753 O WAT 8519 110.557 143.528 124.829 1.00 0.00 O ATOM 23754 H1 WAT 8519 111.348 144.062 124.749 1.00 0.00 H ATOM 23755 H2 WAT 8519 109.847 144.111 124.563 1.00 0.00 H TER 23757 WAT 8519 ATOM 23757 O WAT 8520 75.575 63.628 118.250 1.00 0.00 O ATOM 23758 H1 WAT 8520 76.121 63.105 117.662 1.00 0.00 H ATOM 23759 H2 WAT 8520 76.082 63.685 119.060 1.00 0.00 H TER 23761 WAT 8520 ATOM 23761 O WAT 8521 9.918 129.157 133.887 1.00 0.00 O ATOM 23762 H1 WAT 8521 9.235 128.514 134.079 1.00 0.00 H ATOM 23763 H2 WAT 8521 9.753 129.872 134.501 1.00 0.00 H TER 23765 WAT 8521 ATOM 23765 O WAT 8522 35.279 37.425 134.833 1.00 0.00 O ATOM 23766 H1 WAT 8522 35.719 36.674 135.231 1.00 0.00 H ATOM 23767 H2 WAT 8522 35.904 37.754 134.187 1.00 0.00 H TER 23769 WAT 8522 ATOM 23769 O WAT 8523 126.888 56.831 133.814 1.00 0.00 O ATOM 23770 H1 WAT 8523 127.486 56.299 134.339 1.00 0.00 H ATOM 23771 H2 WAT 8523 126.705 56.294 133.043 1.00 0.00 H TER 23773 WAT 8523 ATOM 23773 O WAT 8524 137.515 21.261 13.539 1.00 0.00 O ATOM 23774 H1 WAT 8524 137.135 21.996 13.058 1.00 0.00 H ATOM 23775 H2 WAT 8524 138.394 21.165 13.174 1.00 0.00 H TER 23777 WAT 8524 ATOM 23777 O WAT 8525 137.866 118.863 83.657 1.00 0.00 O ATOM 23778 H1 WAT 8525 138.439 118.714 84.409 1.00 0.00 H ATOM 23779 H2 WAT 8525 137.007 119.039 84.043 1.00 0.00 H TER 23781 WAT 8525 ATOM 23781 O WAT 8526 116.681 136.579 76.187 1.00 0.00 O ATOM 23782 H1 WAT 8526 117.605 136.670 75.953 1.00 0.00 H ATOM 23783 H2 WAT 8526 116.506 135.641 76.109 1.00 0.00 H TER 23785 WAT 8526 ATOM 23785 O WAT 8527 70.077 88.396 82.037 1.00 0.00 O ATOM 23786 H1 WAT 8527 70.880 88.134 82.488 1.00 0.00 H ATOM 23787 H2 WAT 8527 69.779 87.598 81.599 1.00 0.00 H TER 23789 WAT 8527 ATOM 23789 O WAT 8528 103.672 103.061 124.434 1.00 0.00 O ATOM 23790 H1 WAT 8528 103.608 102.267 123.904 1.00 0.00 H ATOM 23791 H2 WAT 8528 104.282 103.621 123.954 1.00 0.00 H TER 23793 WAT 8528 ATOM 23793 O WAT 8529 87.060 70.929 101.775 1.00 0.00 O ATOM 23794 H1 WAT 8529 87.460 70.329 102.405 1.00 0.00 H ATOM 23795 H2 WAT 8529 86.328 71.322 102.251 1.00 0.00 H TER 23797 WAT 8529 ATOM 23797 O WAT 8530 49.477 104.216 155.617 1.00 0.00 O ATOM 23798 H1 WAT 8530 50.178 104.486 156.211 1.00 0.00 H ATOM 23799 H2 WAT 8530 48.678 104.294 156.138 1.00 0.00 H TER 23801 WAT 8530 ATOM 23801 O WAT 8531 105.479 57.142 71.070 1.00 0.00 O ATOM 23802 H1 WAT 8531 105.470 58.098 71.023 1.00 0.00 H ATOM 23803 H2 WAT 8531 106.264 56.885 70.586 1.00 0.00 H TER 23805 WAT 8531 ATOM 23805 O WAT 8532 62.471 9.634 147.579 1.00 0.00 O ATOM 23806 H1 WAT 8532 62.774 9.412 146.699 1.00 0.00 H ATOM 23807 H2 WAT 8532 62.783 8.914 148.128 1.00 0.00 H TER 23809 WAT 8532 ATOM 23809 O WAT 8533 74.301 100.455 65.595 1.00 0.00 O ATOM 23810 H1 WAT 8533 73.749 101.184 65.877 1.00 0.00 H ATOM 23811 H2 WAT 8533 75.064 100.873 65.196 1.00 0.00 H TER 23813 WAT 8533 ATOM 23813 O WAT 8534 16.301 54.946 69.907 1.00 0.00 O ATOM 23814 H1 WAT 8534 15.896 55.651 70.412 1.00 0.00 H ATOM 23815 H2 WAT 8534 17.166 55.285 69.675 1.00 0.00 H TER 23817 WAT 8534 ATOM 23817 O WAT 8535 139.173 11.923 79.392 1.00 0.00 O ATOM 23818 H1 WAT 8535 139.651 11.124 79.612 1.00 0.00 H ATOM 23819 H2 WAT 8535 139.124 12.408 80.216 1.00 0.00 H TER 23821 WAT 8535 ATOM 23821 O WAT 8536 43.094 19.815 19.066 1.00 0.00 O ATOM 23822 H1 WAT 8536 42.371 19.559 19.639 1.00 0.00 H ATOM 23823 H2 WAT 8536 43.312 19.016 18.585 1.00 0.00 H TER 23825 WAT 8536 ATOM 23825 O WAT 8537 48.450 12.870 70.477 1.00 0.00 O ATOM 23826 H1 WAT 8537 48.265 12.223 71.158 1.00 0.00 H ATOM 23827 H2 WAT 8537 47.661 13.411 70.440 1.00 0.00 H TER 23829 WAT 8537 ATOM 23829 O WAT 8538 95.590 6.325 58.617 1.00 0.00 O ATOM 23830 H1 WAT 8538 95.240 7.195 58.426 1.00 0.00 H ATOM 23831 H2 WAT 8538 95.101 5.738 58.039 1.00 0.00 H TER 23833 WAT 8538 ATOM 23833 O WAT 8539 68.390 21.271 95.963 1.00 0.00 O ATOM 23834 H1 WAT 8539 68.163 20.354 95.810 1.00 0.00 H ATOM 23835 H2 WAT 8539 68.912 21.258 96.765 1.00 0.00 H TER 23837 WAT 8539 ATOM 23837 O WAT 8540 120.355 35.643 77.964 1.00 0.00 O ATOM 23838 H1 WAT 8540 119.539 35.232 78.249 1.00 0.00 H ATOM 23839 H2 WAT 8540 120.283 35.684 77.011 1.00 0.00 H TER 23841 WAT 8540 ATOM 23841 O WAT 8541 63.096 11.004 118.328 1.00 0.00 O ATOM 23842 H1 WAT 8541 63.036 11.944 118.497 1.00 0.00 H ATOM 23843 H2 WAT 8541 62.191 10.729 118.183 1.00 0.00 H TER 23845 WAT 8541 ATOM 23845 O WAT 8542 145.301 91.598 149.407 1.00 0.00 O ATOM 23846 H1 WAT 8542 145.327 92.497 149.079 1.00 0.00 H ATOM 23847 H2 WAT 8542 145.868 91.110 148.811 1.00 0.00 H TER 23849 WAT 8542 ATOM 23849 O WAT 8543 63.855 34.163 25.966 1.00 0.00 O ATOM 23850 H1 WAT 8543 63.119 34.336 25.379 1.00 0.00 H ATOM 23851 H2 WAT 8543 64.629 34.243 25.409 1.00 0.00 H TER 23853 WAT 8543 ATOM 23853 O WAT 8544 100.943 41.581 131.722 1.00 0.00 O ATOM 23854 H1 WAT 8544 100.242 40.932 131.776 1.00 0.00 H ATOM 23855 H2 WAT 8544 101.017 41.928 132.611 1.00 0.00 H TER 23857 WAT 8544 ATOM 23857 O WAT 8545 114.500 131.749 110.966 1.00 0.00 O ATOM 23858 H1 WAT 8545 114.232 130.906 110.601 1.00 0.00 H ATOM 23859 H2 WAT 8545 114.138 132.397 110.362 1.00 0.00 H TER 23861 WAT 8545 ATOM 23861 O WAT 8546 80.926 80.180 112.660 1.00 0.00 O ATOM 23862 H1 WAT 8546 80.740 80.332 111.734 1.00 0.00 H ATOM 23863 H2 WAT 8546 81.604 80.819 112.877 1.00 0.00 H TER 23865 WAT 8546 ATOM 23865 O WAT 8547 83.717 120.643 115.116 1.00 0.00 O ATOM 23866 H1 WAT 8547 83.297 121.473 114.890 1.00 0.00 H ATOM 23867 H2 WAT 8547 83.106 119.974 114.810 1.00 0.00 H TER 23869 WAT 8547 ATOM 23869 O WAT 8548 26.393 99.428 115.447 1.00 0.00 O ATOM 23870 H1 WAT 8548 26.510 98.563 115.053 1.00 0.00 H ATOM 23871 H2 WAT 8548 27.282 99.772 115.537 1.00 0.00 H TER 23873 WAT 8548 ATOM 23873 O WAT 8549 25.663 64.995 68.816 1.00 0.00 O ATOM 23874 H1 WAT 8549 25.951 64.118 69.070 1.00 0.00 H ATOM 23875 H2 WAT 8549 25.638 64.971 67.859 1.00 0.00 H TER 23877 WAT 8549 ATOM 23877 O WAT 8550 104.606 86.279 80.966 1.00 0.00 O ATOM 23878 H1 WAT 8550 104.914 87.002 81.512 1.00 0.00 H ATOM 23879 H2 WAT 8550 104.266 85.637 81.589 1.00 0.00 H TER 23881 WAT 8550 ATOM 23881 O WAT 8551 78.807 69.196 103.404 1.00 0.00 O ATOM 23882 H1 WAT 8551 79.203 69.773 102.751 1.00 0.00 H ATOM 23883 H2 WAT 8551 77.971 69.612 103.615 1.00 0.00 H TER 23885 WAT 8551 ATOM 23885 O WAT 8552 56.344 61.593 22.852 1.00 0.00 O ATOM 23886 H1 WAT 8552 56.603 61.548 23.772 1.00 0.00 H ATOM 23887 H2 WAT 8552 56.756 60.828 22.450 1.00 0.00 H TER 23889 WAT 8552 ATOM 23889 O WAT 8553 58.911 140.064 82.782 1.00 0.00 O ATOM 23890 H1 WAT 8553 59.100 140.570 83.572 1.00 0.00 H ATOM 23891 H2 WAT 8553 59.524 140.401 82.129 1.00 0.00 H TER 23893 WAT 8553 ATOM 23893 O WAT 8554 108.500 96.453 22.727 1.00 0.00 O ATOM 23894 H1 WAT 8554 108.182 95.681 22.259 1.00 0.00 H ATOM 23895 H2 WAT 8554 109.064 96.101 23.415 1.00 0.00 H TER 23897 WAT 8554 ATOM 23897 O WAT 8555 58.014 46.338 142.944 1.00 0.00 O ATOM 23898 H1 WAT 8555 57.621 46.449 142.079 1.00 0.00 H ATOM 23899 H2 WAT 8555 58.835 45.875 142.776 1.00 0.00 H TER 23901 WAT 8555 ATOM 23901 O WAT 8556 13.458 128.086 6.968 1.00 0.00 O ATOM 23902 H1 WAT 8556 13.910 128.770 7.462 1.00 0.00 H ATOM 23903 H2 WAT 8556 13.271 128.487 6.119 1.00 0.00 H TER 23905 WAT 8556 ATOM 23905 O WAT 8557 76.014 43.627 3.255 1.00 0.00 O ATOM 23906 H1 WAT 8557 75.746 42.709 3.301 1.00 0.00 H ATOM 23907 H2 WAT 8557 76.894 43.601 2.879 1.00 0.00 H TER 23909 WAT 8557 ATOM 23909 O WAT 8558 63.777 105.598 6.761 1.00 0.00 O ATOM 23910 H1 WAT 8558 63.307 105.077 6.110 1.00 0.00 H ATOM 23911 H2 WAT 8558 64.656 105.219 6.780 1.00 0.00 H TER 23913 WAT 8558 ATOM 23913 O WAT 8559 123.197 47.138 17.991 1.00 0.00 O ATOM 23914 H1 WAT 8559 123.120 47.794 17.299 1.00 0.00 H ATOM 23915 H2 WAT 8559 122.437 47.291 18.552 1.00 0.00 H TER 23917 WAT 8559 ATOM 23917 O WAT 8560 44.581 47.256 1.961 1.00 0.00 O ATOM 23918 H1 WAT 8560 44.558 46.361 2.299 1.00 0.00 H ATOM 23919 H2 WAT 8560 45.265 47.688 2.474 1.00 0.00 H TER 23921 WAT 8560 ATOM 23921 O WAT 8561 23.320 55.562 63.912 1.00 0.00 O ATOM 23922 H1 WAT 8561 22.772 55.081 63.292 1.00 0.00 H ATOM 23923 H2 WAT 8561 24.145 55.077 63.929 1.00 0.00 H TER 23925 WAT 8561 ATOM 23925 O WAT 8562 15.208 140.616 84.960 1.00 0.00 O ATOM 23926 H1 WAT 8562 15.779 139.953 85.347 1.00 0.00 H ATOM 23927 H2 WAT 8562 15.742 141.410 84.938 1.00 0.00 H TER 23929 WAT 8562 ATOM 23929 O WAT 8563 140.313 4.680 100.944 1.00 0.00 O ATOM 23930 H1 WAT 8563 141.200 4.396 100.722 1.00 0.00 H ATOM 23931 H2 WAT 8563 139.784 3.885 100.880 1.00 0.00 H TER 23933 WAT 8563 ATOM 23933 O WAT 8564 56.485 32.370 104.697 1.00 0.00 O ATOM 23934 H1 WAT 8564 55.954 31.652 105.041 1.00 0.00 H ATOM 23935 H2 WAT 8564 57.308 32.314 105.183 1.00 0.00 H TER 23937 WAT 8564 ATOM 23937 O WAT 8565 138.265 25.768 17.902 1.00 0.00 O ATOM 23938 H1 WAT 8565 137.686 26.445 17.551 1.00 0.00 H ATOM 23939 H2 WAT 8565 138.033 24.978 17.414 1.00 0.00 H TER 23941 WAT 8565 ATOM 23941 O WAT 8566 93.482 90.453 127.482 1.00 0.00 O ATOM 23942 H1 WAT 8566 94.187 89.925 127.106 1.00 0.00 H ATOM 23943 H2 WAT 8566 93.540 91.291 127.022 1.00 0.00 H TER 23945 WAT 8566 ATOM 23945 O WAT 8567 9.273 71.134 23.235 1.00 0.00 O ATOM 23946 H1 WAT 8567 9.029 72.059 23.231 1.00 0.00 H ATOM 23947 H2 WAT 8567 10.214 71.135 23.406 1.00 0.00 H TER 23949 WAT 8567 ATOM 23949 O WAT 8568 121.658 17.536 107.944 1.00 0.00 O ATOM 23950 H1 WAT 8568 121.562 18.354 107.458 1.00 0.00 H ATOM 23951 H2 WAT 8568 121.650 16.855 107.271 1.00 0.00 H TER 23953 WAT 8568 ATOM 23953 O WAT 8569 63.837 88.654 86.264 1.00 0.00 O ATOM 23954 H1 WAT 8569 64.277 89.221 86.898 1.00 0.00 H ATOM 23955 H2 WAT 8569 63.119 88.256 86.756 1.00 0.00 H TER 23957 WAT 8569 ATOM 23957 O WAT 8570 60.857 19.185 141.748 1.00 0.00 O ATOM 23958 H1 WAT 8570 60.498 20.036 141.497 1.00 0.00 H ATOM 23959 H2 WAT 8570 61.747 19.379 142.042 1.00 0.00 H TER 23961 WAT 8570 ATOM 23961 O WAT 8571 25.784 98.438 92.184 1.00 0.00 O ATOM 23962 H1 WAT 8571 26.404 98.115 91.530 1.00 0.00 H ATOM 23963 H2 WAT 8571 24.928 98.355 91.765 1.00 0.00 H TER 23965 WAT 8571 ATOM 23965 O WAT 8572 136.084 30.755 151.361 1.00 0.00 O ATOM 23966 H1 WAT 8572 136.779 30.562 150.733 1.00 0.00 H ATOM 23967 H2 WAT 8572 136.118 31.705 151.471 1.00 0.00 H TER 23969 WAT 8572 ATOM 23969 O WAT 8573 138.629 45.546 84.364 1.00 0.00 O ATOM 23970 H1 WAT 8573 137.920 46.120 84.073 1.00 0.00 H ATOM 23971 H2 WAT 8573 139.191 45.451 83.595 1.00 0.00 H TER 23973 WAT 8573 ATOM 23973 O WAT 8574 4.376 39.122 61.874 1.00 0.00 O ATOM 23974 H1 WAT 8574 4.910 39.431 62.606 1.00 0.00 H ATOM 23975 H2 WAT 8574 5.007 38.744 61.261 1.00 0.00 H TER 23977 WAT 8574 ATOM 23977 O WAT 8575 36.625 3.182 153.190 1.00 0.00 O ATOM 23978 H1 WAT 8575 37.140 2.620 152.611 1.00 0.00 H ATOM 23979 H2 WAT 8575 37.089 3.151 154.027 1.00 0.00 H TER 23981 WAT 8575 ATOM 23981 O WAT 8576 41.968 95.842 64.359 1.00 0.00 O ATOM 23982 H1 WAT 8576 41.229 96.421 64.171 1.00 0.00 H ATOM 23983 H2 WAT 8576 41.586 95.120 64.858 1.00 0.00 H TER 23985 WAT 8576 ATOM 23985 O WAT 8577 63.011 37.121 108.157 1.00 0.00 O ATOM 23986 H1 WAT 8577 63.451 36.935 107.328 1.00 0.00 H ATOM 23987 H2 WAT 8577 62.108 37.321 107.910 1.00 0.00 H TER 23989 WAT 8577 ATOM 23989 O WAT 8578 53.944 99.360 86.819 1.00 0.00 O ATOM 23990 H1 WAT 8578 53.516 100.214 86.879 1.00 0.00 H ATOM 23991 H2 WAT 8578 53.357 98.836 86.274 1.00 0.00 H TER 23993 WAT 8578 ATOM 23993 O WAT 8579 80.964 91.452 18.134 1.00 0.00 O ATOM 23994 H1 WAT 8579 81.384 91.210 17.308 1.00 0.00 H ATOM 23995 H2 WAT 8579 81.175 90.733 18.730 1.00 0.00 H TER 23997 WAT 8579 ATOM 23997 O WAT 8580 90.547 130.923 151.119 1.00 0.00 O ATOM 23998 H1 WAT 8580 91.476 130.752 150.964 1.00 0.00 H ATOM 23999 H2 WAT 8580 90.110 130.108 150.874 1.00 0.00 H TER 24001 WAT 8580 ATOM 24001 O WAT 8581 106.950 25.866 92.461 1.00 0.00 O ATOM 24002 H1 WAT 8581 107.010 24.999 92.060 1.00 0.00 H ATOM 24003 H2 WAT 8581 106.538 25.710 93.310 1.00 0.00 H TER 24005 WAT 8581 ATOM 24005 O WAT 8582 60.865 68.274 155.435 1.00 0.00 O ATOM 24006 H1 WAT 8582 59.948 68.033 155.563 1.00 0.00 H ATOM 24007 H2 WAT 8582 61.158 67.723 154.709 1.00 0.00 H TER 24009 WAT 8582 ATOM 24009 O WAT 8583 114.019 73.060 64.553 1.00 0.00 O ATOM 24010 H1 WAT 8583 113.558 73.895 64.623 1.00 0.00 H ATOM 24011 H2 WAT 8583 114.239 72.832 65.456 1.00 0.00 H TER 24013 WAT 8583 ATOM 24013 O WAT 8584 9.962 106.915 139.271 1.00 0.00 O ATOM 24014 H1 WAT 8584 10.805 106.494 139.440 1.00 0.00 H ATOM 24015 H2 WAT 8584 9.620 106.463 138.500 1.00 0.00 H TER 24017 WAT 8584 ATOM 24017 O WAT 8585 135.435 30.875 16.971 1.00 0.00 O ATOM 24018 H1 WAT 8585 135.028 30.474 16.203 1.00 0.00 H ATOM 24019 H2 WAT 8585 135.234 31.808 16.888 1.00 0.00 H TER 24021 WAT 8585 ATOM 24021 O WAT 8586 32.382 12.754 74.294 1.00 0.00 O ATOM 24022 H1 WAT 8586 31.813 12.125 74.736 1.00 0.00 H ATOM 24023 H2 WAT 8586 32.118 12.711 73.375 1.00 0.00 H TER 24025 WAT 8586 ATOM 24025 O WAT 8587 46.493 111.942 73.747 1.00 0.00 O ATOM 24026 H1 WAT 8587 46.751 111.746 72.846 1.00 0.00 H ATOM 24027 H2 WAT 8587 46.658 112.880 73.844 1.00 0.00 H TER 24029 WAT 8587 ATOM 24029 O WAT 8588 119.957 16.663 88.088 1.00 0.00 O ATOM 24030 H1 WAT 8588 120.433 17.383 88.502 1.00 0.00 H ATOM 24031 H2 WAT 8588 119.764 16.059 88.806 1.00 0.00 H TER 24033 WAT 8588 ATOM 24033 O WAT 8589 14.438 42.336 94.949 1.00 0.00 O ATOM 24034 H1 WAT 8589 14.328 42.901 94.183 1.00 0.00 H ATOM 24035 H2 WAT 8589 15.384 42.207 95.017 1.00 0.00 H TER 24037 WAT 8589 ATOM 24037 O WAT 8590 106.025 124.746 77.212 1.00 0.00 O ATOM 24038 H1 WAT 8590 106.550 125.513 76.985 1.00 0.00 H ATOM 24039 H2 WAT 8590 105.418 125.060 77.882 1.00 0.00 H TER 24041 WAT 8590 ATOM 24041 O WAT 8591 101.116 144.779 87.471 1.00 0.00 O ATOM 24042 H1 WAT 8591 101.008 145.400 86.751 1.00 0.00 H ATOM 24043 H2 WAT 8591 101.013 145.308 88.262 1.00 0.00 H TER 24045 WAT 8591 ATOM 24045 O WAT 8592 89.534 84.739 85.137 1.00 0.00 O ATOM 24046 H1 WAT 8592 89.727 83.859 84.815 1.00 0.00 H ATOM 24047 H2 WAT 8592 89.684 84.687 86.081 1.00 0.00 H TER 24049 WAT 8592 ATOM 24049 O WAT 8593 35.832 53.236 3.922 1.00 0.00 O ATOM 24050 H1 WAT 8593 36.496 53.923 3.862 1.00 0.00 H ATOM 24051 H2 WAT 8593 35.009 53.709 4.044 1.00 0.00 H TER 24053 WAT 8593 ATOM 24053 O WAT 8594 9.590 90.607 22.966 1.00 0.00 O ATOM 24054 H1 WAT 8594 10.475 90.252 22.876 1.00 0.00 H ATOM 24055 H2 WAT 8594 9.604 91.417 22.456 1.00 0.00 H TER 24057 WAT 8594 ATOM 24057 O WAT 8595 22.047 42.209 87.547 1.00 0.00 O ATOM 24058 H1 WAT 8595 22.454 41.495 87.056 1.00 0.00 H ATOM 24059 H2 WAT 8595 21.112 42.004 87.538 1.00 0.00 H TER 24061 WAT 8595 ATOM 24061 O WAT 8596 71.775 79.682 76.776 1.00 0.00 O ATOM 24062 H1 WAT 8596 71.312 78.917 76.434 1.00 0.00 H ATOM 24063 H2 WAT 8596 71.900 79.490 77.706 1.00 0.00 H TER 24065 WAT 8596 ATOM 24065 O WAT 8597 145.661 52.151 90.729 1.00 0.00 O ATOM 24066 H1 WAT 8597 145.548 51.423 90.118 1.00 0.00 H ATOM 24067 H2 WAT 8597 145.200 52.882 90.318 1.00 0.00 H TER 24069 WAT 8597 ATOM 24069 O WAT 8598 124.382 111.954 123.696 1.00 0.00 O ATOM 24070 H1 WAT 8598 124.653 111.126 123.299 1.00 0.00 H ATOM 24071 H2 WAT 8598 124.897 112.012 124.501 1.00 0.00 H TER 24073 WAT 8598 ATOM 24073 O WAT 8599 41.815 43.145 155.408 1.00 0.00 O ATOM 24074 H1 WAT 8599 41.534 42.345 155.852 1.00 0.00 H ATOM 24075 H2 WAT 8599 42.060 42.857 154.528 1.00 0.00 H TER 24077 WAT 8599 ATOM 24077 O WAT 8600 -0.036 119.761 104.404 1.00 0.00 O ATOM 24078 H1 WAT 8600 -0.275 120.601 104.011 1.00 0.00 H ATOM 24079 H2 WAT 8600 0.546 119.354 103.762 1.00 0.00 H TER 24081 WAT 8600 ATOM 24081 O WAT 8601 46.328 122.201 83.664 1.00 0.00 O ATOM 24082 H1 WAT 8601 46.917 121.858 82.992 1.00 0.00 H ATOM 24083 H2 WAT 8601 45.746 122.797 83.192 1.00 0.00 H TER 24085 WAT 8601 ATOM 24085 O WAT 8602 89.022 14.267 146.664 1.00 0.00 O ATOM 24086 H1 WAT 8602 88.086 14.204 146.854 1.00 0.00 H ATOM 24087 H2 WAT 8602 89.159 13.669 145.929 1.00 0.00 H TER 24089 WAT 8602 ATOM 24089 O WAT 8603 62.006 113.345 53.546 1.00 0.00 O ATOM 24090 H1 WAT 8603 61.611 114.176 53.811 1.00 0.00 H ATOM 24091 H2 WAT 8603 62.058 113.399 52.592 1.00 0.00 H TER 24093 WAT 8603 ATOM 24093 O WAT 8604 130.208 23.610 148.779 1.00 0.00 O ATOM 24094 H1 WAT 8604 129.364 23.973 149.048 1.00 0.00 H ATOM 24095 H2 WAT 8604 130.839 24.304 148.969 1.00 0.00 H TER 24097 WAT 8604 ATOM 24097 O WAT 8605 70.339 43.846 15.838 1.00 0.00 O ATOM 24098 H1 WAT 8605 69.952 43.251 16.480 1.00 0.00 H ATOM 24099 H2 WAT 8605 70.335 43.351 15.019 1.00 0.00 H TER 24101 WAT 8605 ATOM 24101 O WAT 8606 11.608 89.819 20.389 1.00 0.00 O ATOM 24102 H1 WAT 8606 11.855 90.616 19.919 1.00 0.00 H ATOM 24103 H2 WAT 8606 10.685 89.690 20.175 1.00 0.00 H TER 24105 WAT 8606 ATOM 24105 O WAT 8607 92.260 86.941 6.580 1.00 0.00 O ATOM 24106 H1 WAT 8607 92.208 87.821 6.208 1.00 0.00 H ATOM 24107 H2 WAT 8607 92.160 87.072 7.523 1.00 0.00 H TER 24109 WAT 8607 ATOM 24109 O WAT 8608 90.099 29.031 76.681 1.00 0.00 O ATOM 24110 H1 WAT 8608 89.459 29.741 76.635 1.00 0.00 H ATOM 24111 H2 WAT 8608 90.038 28.712 77.582 1.00 0.00 H TER 24113 WAT 8608 ATOM 24113 O WAT 8609 115.581 7.383 75.768 1.00 0.00 O ATOM 24114 H1 WAT 8609 115.254 7.787 74.964 1.00 0.00 H ATOM 24115 H2 WAT 8609 116.265 7.979 76.074 1.00 0.00 H TER 24117 WAT 8609 ATOM 24117 O WAT 8610 23.404 107.378 5.995 1.00 0.00 O ATOM 24118 H1 WAT 8610 22.731 106.941 5.474 1.00 0.00 H ATOM 24119 H2 WAT 8610 22.951 108.117 6.401 1.00 0.00 H TER 24121 WAT 8610 ATOM 24121 O WAT 8611 45.010 28.026 2.380 1.00 0.00 O ATOM 24122 H1 WAT 8611 45.834 28.090 1.898 1.00 0.00 H ATOM 24123 H2 WAT 8611 44.791 28.930 2.602 1.00 0.00 H TER 24125 WAT 8611 ATOM 24125 O WAT 8612 116.448 70.671 118.397 1.00 0.00 O ATOM 24126 H1 WAT 8612 115.824 70.219 118.965 1.00 0.00 H ATOM 24127 H2 WAT 8612 116.006 71.484 118.155 1.00 0.00 H TER 24129 WAT 8612 ATOM 24129 O WAT 8613 110.026 59.534 99.563 1.00 0.00 O ATOM 24130 H1 WAT 8613 109.096 59.520 99.791 1.00 0.00 H ATOM 24131 H2 WAT 8613 110.423 58.880 100.139 1.00 0.00 H TER 24133 WAT 8613 ATOM 24133 O WAT 8614 21.860 35.898 87.169 1.00 0.00 O ATOM 24134 H1 WAT 8614 21.389 35.772 87.992 1.00 0.00 H ATOM 24135 H2 WAT 8614 22.664 35.388 87.272 1.00 0.00 H TER 24137 WAT 8614 ATOM 24137 O WAT 8615 41.044 18.629 135.815 1.00 0.00 O ATOM 24138 H1 WAT 8615 40.167 18.641 135.432 1.00 0.00 H ATOM 24139 H2 WAT 8615 41.106 17.777 136.247 1.00 0.00 H TER 24141 WAT 8615 ATOM 24141 O WAT 8616 119.279 94.820 137.074 1.00 0.00 O ATOM 24142 H1 WAT 8616 118.892 95.378 137.749 1.00 0.00 H ATOM 24143 H2 WAT 8616 119.229 95.342 136.274 1.00 0.00 H TER 24145 WAT 8616 ATOM 24145 O WAT 8617 22.225 142.428 98.556 1.00 0.00 O ATOM 24146 H1 WAT 8617 21.383 142.760 98.866 1.00 0.00 H ATOM 24147 H2 WAT 8617 22.613 142.005 99.321 1.00 0.00 H TER 24149 WAT 8617 ATOM 24149 O WAT 8618 85.400 129.729 155.004 1.00 0.00 O ATOM 24150 H1 WAT 8618 85.612 130.407 155.645 1.00 0.00 H ATOM 24151 H2 WAT 8618 84.951 130.197 154.299 1.00 0.00 H TER 24153 WAT 8618 ATOM 24153 O WAT 8619 67.761 120.638 134.023 1.00 0.00 O ATOM 24154 H1 WAT 8619 68.103 121.126 134.772 1.00 0.00 H ATOM 24155 H2 WAT 8619 67.862 121.235 133.282 1.00 0.00 H TER 24157 WAT 8619 ATOM 24157 O WAT 8620 9.845 9.185 74.961 1.00 0.00 O ATOM 24158 H1 WAT 8620 10.167 9.993 75.360 1.00 0.00 H ATOM 24159 H2 WAT 8620 10.478 8.990 74.270 1.00 0.00 H TER 24161 WAT 8620 ATOM 24161 O WAT 8621 65.055 111.091 52.379 1.00 0.00 O ATOM 24162 H1 WAT 8621 64.243 110.622 52.568 1.00 0.00 H ATOM 24163 H2 WAT 8621 64.783 111.834 51.840 1.00 0.00 H TER 24165 WAT 8621 ATOM 24165 O WAT 8622 137.499 51.307 137.191 1.00 0.00 O ATOM 24166 H1 WAT 8622 136.578 51.263 136.935 1.00 0.00 H ATOM 24167 H2 WAT 8622 137.773 50.392 137.259 1.00 0.00 H TER 24169 WAT 8622 ATOM 24169 O WAT 8623 109.874 122.056 5.511 1.00 0.00 O ATOM 24170 H1 WAT 8623 109.244 122.351 4.854 1.00 0.00 H ATOM 24171 H2 WAT 8623 109.670 122.576 6.289 1.00 0.00 H TER 24173 WAT 8623 ATOM 24173 O WAT 8624 32.031 96.414 55.918 1.00 0.00 O ATOM 24174 H1 WAT 8624 32.886 96.440 56.346 1.00 0.00 H ATOM 24175 H2 WAT 8624 31.522 97.095 56.358 1.00 0.00 H TER 24177 WAT 8624 ATOM 24177 O WAT 8625 37.549 57.004 109.309 1.00 0.00 O ATOM 24178 H1 WAT 8625 37.118 56.206 109.003 1.00 0.00 H ATOM 24179 H2 WAT 8625 38.003 57.342 108.538 1.00 0.00 H TER 24181 WAT 8625 ATOM 24181 O WAT 8626 135.169 103.352 138.496 1.00 0.00 O ATOM 24182 H1 WAT 8626 134.840 102.669 137.911 1.00 0.00 H ATOM 24183 H2 WAT 8626 134.532 104.063 138.416 1.00 0.00 H TER 24185 WAT 8626 ATOM 24185 O WAT 8627 96.775 119.774 107.917 1.00 0.00 O ATOM 24186 H1 WAT 8627 96.996 120.677 107.689 1.00 0.00 H ATOM 24187 H2 WAT 8627 95.821 119.771 107.990 1.00 0.00 H TER 24189 WAT 8627 ATOM 24189 O WAT 8628 25.042 122.235 85.269 1.00 0.00 O ATOM 24190 H1 WAT 8628 25.071 121.920 86.172 1.00 0.00 H ATOM 24191 H2 WAT 8628 25.104 121.442 84.737 1.00 0.00 H TER 24193 WAT 8628 ATOM 24193 O WAT 8629 25.785 139.298 62.765 1.00 0.00 O ATOM 24194 H1 WAT 8629 25.836 138.917 61.888 1.00 0.00 H ATOM 24195 H2 WAT 8629 26.633 139.098 63.162 1.00 0.00 H TER 24197 WAT 8629 ATOM 24197 O WAT 8630 8.667 66.855 72.307 1.00 0.00 O ATOM 24198 H1 WAT 8630 8.303 66.407 73.071 1.00 0.00 H ATOM 24199 H2 WAT 8630 7.960 67.423 72.002 1.00 0.00 H TER 24201 WAT 8630 ATOM 24201 O WAT 8631 18.290 73.944 8.449 1.00 0.00 O ATOM 24202 H1 WAT 8631 18.193 73.923 7.497 1.00 0.00 H ATOM 24203 H2 WAT 8631 19.227 73.817 8.597 1.00 0.00 H TER 24205 WAT 8631 ATOM 24205 O WAT 8632 23.486 112.924 17.716 1.00 0.00 O ATOM 24206 H1 WAT 8632 23.545 111.991 17.919 1.00 0.00 H ATOM 24207 H2 WAT 8632 23.228 112.954 16.795 1.00 0.00 H TER 24209 WAT 8632 ATOM 24209 O WAT 8633 1.061 134.328 1.347 1.00 0.00 O ATOM 24210 H1 WAT 8633 1.701 135.038 1.292 1.00 0.00 H ATOM 24211 H2 WAT 8633 0.246 134.760 1.603 1.00 0.00 H TER 24213 WAT 8633 ATOM 24213 O WAT 8634 78.084 84.460 147.522 1.00 0.00 O ATOM 24214 H1 WAT 8634 78.199 85.349 147.186 1.00 0.00 H ATOM 24215 H2 WAT 8634 77.391 84.539 148.177 1.00 0.00 H TER 24217 WAT 8634 ATOM 24217 O WAT 8635 30.943 54.941 126.149 1.00 0.00 O ATOM 24218 H1 WAT 8635 30.607 54.212 125.628 1.00 0.00 H ATOM 24219 H2 WAT 8635 31.855 54.708 126.326 1.00 0.00 H TER 24221 WAT 8635 ATOM 24221 O WAT 8636 94.509 38.759 144.642 1.00 0.00 O ATOM 24222 H1 WAT 8636 93.593 38.838 144.376 1.00 0.00 H ATOM 24223 H2 WAT 8636 94.497 38.902 145.588 1.00 0.00 H TER 24225 WAT 8636 ATOM 24225 O WAT 8637 3.306 64.300 123.778 1.00 0.00 O ATOM 24226 H1 WAT 8637 3.604 64.748 122.986 1.00 0.00 H ATOM 24227 H2 WAT 8637 3.968 64.510 124.436 1.00 0.00 H TER 24229 WAT 8637 ATOM 24229 O WAT 8638 107.576 113.087 16.219 1.00 0.00 O ATOM 24230 H1 WAT 8638 106.667 112.861 16.022 1.00 0.00 H ATOM 24231 H2 WAT 8638 107.513 113.805 16.849 1.00 0.00 H TER 24233 WAT 8638 ATOM 24233 O WAT 8639 97.046 122.816 99.430 1.00 0.00 O ATOM 24234 H1 WAT 8639 96.947 122.110 100.069 1.00 0.00 H ATOM 24235 H2 WAT 8639 97.398 123.549 99.935 1.00 0.00 H TER 24237 WAT 8639 ATOM 24237 O WAT 8640 7.408 113.164 6.916 1.00 0.00 O ATOM 24238 H1 WAT 8640 6.705 112.552 6.701 1.00 0.00 H ATOM 24239 H2 WAT 8640 7.613 113.595 6.086 1.00 0.00 H TER 24241 WAT 8640 ATOM 24241 O WAT 8641 124.143 99.308 6.821 1.00 0.00 O ATOM 24242 H1 WAT 8641 124.192 100.185 6.443 1.00 0.00 H ATOM 24243 H2 WAT 8641 123.408 99.351 7.433 1.00 0.00 H TER 24245 WAT 8641 ATOM 24245 O WAT 8642 40.792 74.498 118.365 1.00 0.00 O ATOM 24246 H1 WAT 8642 41.692 74.216 118.200 1.00 0.00 H ATOM 24247 H2 WAT 8642 40.786 74.752 119.288 1.00 0.00 H TER 24249 WAT 8642 ATOM 24249 O WAT 8643 39.460 10.760 117.708 1.00 0.00 O ATOM 24250 H1 WAT 8643 40.113 11.460 117.725 1.00 0.00 H ATOM 24251 H2 WAT 8643 39.428 10.441 118.610 1.00 0.00 H TER 24253 WAT 8643 ATOM 24253 O WAT 8644 100.175 67.529 111.311 1.00 0.00 O ATOM 24254 H1 WAT 8644 100.147 68.133 110.570 1.00 0.00 H ATOM 24255 H2 WAT 8644 101.022 67.090 111.230 1.00 0.00 H TER 24257 WAT 8644 ATOM 24257 O WAT 8645 62.865 141.477 76.389 1.00 0.00 O ATOM 24258 H1 WAT 8645 63.178 141.421 75.486 1.00 0.00 H ATOM 24259 H2 WAT 8645 63.650 141.667 76.902 1.00 0.00 H TER 24261 WAT 8645 ATOM 24261 O WAT 8646 82.774 116.267 146.231 1.00 0.00 O ATOM 24262 H1 WAT 8646 83.444 115.601 146.386 1.00 0.00 H ATOM 24263 H2 WAT 8646 82.161 116.165 146.959 1.00 0.00 H TER 24265 WAT 8646 ATOM 24265 O WAT 8647 37.921 135.423 114.561 1.00 0.00 O ATOM 24266 H1 WAT 8647 38.365 135.222 115.385 1.00 0.00 H ATOM 24267 H2 WAT 8647 37.168 134.833 114.545 1.00 0.00 H TER 24269 WAT 8647 ATOM 24269 O WAT 8648 100.087 128.269 132.799 1.00 0.00 O ATOM 24270 H1 WAT 8648 99.340 128.296 132.201 1.00 0.00 H ATOM 24271 H2 WAT 8648 100.007 127.426 133.245 1.00 0.00 H TER 24273 WAT 8648 ATOM 24273 O WAT 8649 102.228 135.584 83.127 1.00 0.00 O ATOM 24274 H1 WAT 8649 101.513 135.831 83.713 1.00 0.00 H ATOM 24275 H2 WAT 8649 102.236 136.267 82.457 1.00 0.00 H TER 24277 WAT 8649 ATOM 24277 O WAT 8650 112.238 21.228 150.495 1.00 0.00 O ATOM 24278 H1 WAT 8650 112.233 20.655 151.261 1.00 0.00 H ATOM 24279 H2 WAT 8650 112.397 20.639 149.757 1.00 0.00 H TER 24281 WAT 8650 ATOM 24281 O WAT 8651 118.915 114.104 18.331 1.00 0.00 O ATOM 24282 H1 WAT 8651 119.242 113.263 18.649 1.00 0.00 H ATOM 24283 H2 WAT 8651 119.351 114.227 17.488 1.00 0.00 H TER 24285 WAT 8651 ATOM 24285 O WAT 8652 103.293 115.003 94.103 1.00 0.00 O ATOM 24286 H1 WAT 8652 104.203 114.831 93.860 1.00 0.00 H ATOM 24287 H2 WAT 8652 103.073 115.814 93.644 1.00 0.00 H TER 24289 WAT 8652 ATOM 24289 O WAT 8653 20.374 116.040 123.186 1.00 0.00 O ATOM 24290 H1 WAT 8653 19.815 115.854 123.940 1.00 0.00 H ATOM 24291 H2 WAT 8653 21.202 115.604 123.388 1.00 0.00 H TER 24293 WAT 8653 ATOM 24293 O WAT 8654 126.235 96.758 94.933 1.00 0.00 O ATOM 24294 H1 WAT 8654 126.933 97.020 94.333 1.00 0.00 H ATOM 24295 H2 WAT 8654 126.242 95.802 94.905 1.00 0.00 H TER 24297 WAT 8654 ATOM 24297 O WAT 8655 97.102 34.991 18.917 1.00 0.00 O ATOM 24298 H1 WAT 8655 96.491 34.532 18.341 1.00 0.00 H ATOM 24299 H2 WAT 8655 96.646 35.799 19.155 1.00 0.00 H TER 24301 WAT 8655 ATOM 24301 O WAT 8656 89.044 27.697 109.249 1.00 0.00 O ATOM 24302 H1 WAT 8656 89.032 27.200 108.430 1.00 0.00 H ATOM 24303 H2 WAT 8656 88.121 27.832 109.461 1.00 0.00 H TER 24305 WAT 8656 ATOM 24305 O WAT 8657 10.153 2.205 82.761 1.00 0.00 O ATOM 24306 H1 WAT 8657 10.843 2.853 82.622 1.00 0.00 H ATOM 24307 H2 WAT 8657 9.816 2.398 83.636 1.00 0.00 H TER 24309 WAT 8657 ATOM 24309 O WAT 8658 137.995 102.703 97.273 1.00 0.00 O ATOM 24310 H1 WAT 8658 138.900 102.802 97.569 1.00 0.00 H ATOM 24311 H2 WAT 8658 137.907 103.336 96.560 1.00 0.00 H TER 24313 WAT 8658 ATOM 24313 O WAT 8659 128.791 125.233 108.009 1.00 0.00 O ATOM 24314 H1 WAT 8659 128.452 126.125 108.081 1.00 0.00 H ATOM 24315 H2 WAT 8659 128.089 124.682 108.357 1.00 0.00 H TER 24317 WAT 8659 ATOM 24317 O WAT 8660 70.426 53.482 95.417 1.00 0.00 O ATOM 24318 H1 WAT 8660 69.547 53.859 95.467 1.00 0.00 H ATOM 24319 H2 WAT 8660 70.827 53.910 94.661 1.00 0.00 H TER 24321 WAT 8660 ATOM 24321 O WAT 8661 45.319 70.190 132.495 1.00 0.00 O ATOM 24322 H1 WAT 8661 45.433 69.259 132.306 1.00 0.00 H ATOM 24323 H2 WAT 8661 45.406 70.254 133.446 1.00 0.00 H TER 24325 WAT 8661 ATOM 24325 O WAT 8662 28.710 52.204 138.182 1.00 0.00 O ATOM 24326 H1 WAT 8662 27.775 52.404 138.227 1.00 0.00 H ATOM 24327 H2 WAT 8662 29.066 52.861 137.584 1.00 0.00 H TER 24329 WAT 8662 ATOM 24329 O WAT 8663 40.579 7.821 100.392 1.00 0.00 O ATOM 24330 H1 WAT 8663 40.529 8.685 99.984 1.00 0.00 H ATOM 24331 H2 WAT 8663 40.274 7.218 99.714 1.00 0.00 H TER 24333 WAT 8663 ATOM 24333 O WAT 8664 16.294 112.825 105.210 1.00 0.00 O ATOM 24334 H1 WAT 8664 16.139 113.535 105.832 1.00 0.00 H ATOM 24335 H2 WAT 8664 16.847 113.216 104.533 1.00 0.00 H TER 24337 WAT 8664 ATOM 24337 O WAT 8665 93.652 77.328 95.817 1.00 0.00 O ATOM 24338 H1 WAT 8665 92.791 77.709 95.989 1.00 0.00 H ATOM 24339 H2 WAT 8665 93.508 76.382 95.857 1.00 0.00 H TER 24341 WAT 8665 ATOM 24341 O WAT 8666 109.671 122.502 111.718 1.00 0.00 O ATOM 24342 H1 WAT 8666 108.758 122.271 111.891 1.00 0.00 H ATOM 24343 H2 WAT 8666 109.782 123.361 112.125 1.00 0.00 H TER 24345 WAT 8666 ATOM 24345 O WAT 8667 145.179 33.419 23.347 1.00 0.00 O ATOM 24346 H1 WAT 8667 145.734 33.321 24.120 1.00 0.00 H ATOM 24347 H2 WAT 8667 144.839 32.539 23.183 1.00 0.00 H TER 24349 WAT 8667 ATOM 24349 O WAT 8668 59.783 22.437 63.494 1.00 0.00 O ATOM 24350 H1 WAT 8668 59.576 22.382 64.426 1.00 0.00 H ATOM 24351 H2 WAT 8668 59.541 21.580 63.143 1.00 0.00 H TER 24353 WAT 8668 ATOM 24353 O WAT 8669 35.133 63.325 156.230 1.00 0.00 O ATOM 24354 H1 WAT 8669 36.016 63.630 156.437 1.00 0.00 H ATOM 24355 H2 WAT 8669 34.569 63.786 156.851 1.00 0.00 H TER 24357 WAT 8669 ATOM 24357 O WAT 8670 27.468 60.222 112.820 1.00 0.00 O ATOM 24358 H1 WAT 8670 28.418 60.171 112.921 1.00 0.00 H ATOM 24359 H2 WAT 8670 27.255 59.521 112.204 1.00 0.00 H TER 24361 WAT 8670 ATOM 24361 O WAT 8671 13.709 126.799 88.765 1.00 0.00 O ATOM 24362 H1 WAT 8671 14.398 126.347 89.251 1.00 0.00 H ATOM 24363 H2 WAT 8671 12.958 126.802 89.359 1.00 0.00 H TER 24365 WAT 8671 ATOM 24365 O WAT 8672 136.079 126.686 70.886 1.00 0.00 O ATOM 24366 H1 WAT 8672 135.812 126.277 70.064 1.00 0.00 H ATOM 24367 H2 WAT 8672 135.279 127.091 71.223 1.00 0.00 H TER 24369 WAT 8672 ATOM 24369 O WAT 8673 11.241 74.853 130.086 1.00 0.00 O ATOM 24370 H1 WAT 8673 11.933 74.230 130.307 1.00 0.00 H ATOM 24371 H2 WAT 8673 11.475 75.172 129.214 1.00 0.00 H TER 24373 WAT 8673 ATOM 24373 O WAT 8674 30.363 136.972 94.967 1.00 0.00 O ATOM 24374 H1 WAT 8674 30.976 137.341 94.332 1.00 0.00 H ATOM 24375 H2 WAT 8674 30.015 136.190 94.539 1.00 0.00 H TER 24377 WAT 8674 ATOM 24377 O WAT 8675 23.647 76.208 16.776 1.00 0.00 O ATOM 24378 H1 WAT 8675 23.165 75.448 17.101 1.00 0.00 H ATOM 24379 H2 WAT 8675 23.137 76.512 16.026 1.00 0.00 H TER 24381 WAT 8675 ATOM 24381 O WAT 8676 34.925 115.115 11.307 1.00 0.00 O ATOM 24382 H1 WAT 8676 34.780 114.234 10.961 1.00 0.00 H ATOM 24383 H2 WAT 8676 34.578 115.082 12.199 1.00 0.00 H TER 24385 WAT 8676 ATOM 24385 O WAT 8677 126.540 2.504 158.146 1.00 0.00 O ATOM 24386 H1 WAT 8677 126.369 1.727 158.678 1.00 0.00 H ATOM 24387 H2 WAT 8677 125.696 2.952 158.098 1.00 0.00 H TER 24389 WAT 8677 ATOM 24389 O WAT 8678 115.111 139.083 85.722 1.00 0.00 O ATOM 24390 H1 WAT 8678 115.239 140.026 85.825 1.00 0.00 H ATOM 24391 H2 WAT 8678 114.243 138.917 86.089 1.00 0.00 H TER 24393 WAT 8678 ATOM 24393 O WAT 8679 99.670 47.800 99.438 1.00 0.00 O ATOM 24394 H1 WAT 8679 100.130 48.463 99.953 1.00 0.00 H ATOM 24395 H2 WAT 8679 99.882 48.013 98.529 1.00 0.00 H TER 24397 WAT 8679 ATOM 24397 O WAT 8680 0.284 129.899 4.688 1.00 0.00 O ATOM 24398 H1 WAT 8680 -0.103 130.109 3.838 1.00 0.00 H ATOM 24399 H2 WAT 8680 1.226 130.000 4.554 1.00 0.00 H TER 24401 WAT 8680 ATOM 24401 O WAT 8681 30.109 134.587 121.829 1.00 0.00 O ATOM 24402 H1 WAT 8681 30.786 135.228 121.616 1.00 0.00 H ATOM 24403 H2 WAT 8681 30.254 133.870 121.212 1.00 0.00 H TER 24405 WAT 8681 ATOM 24405 O WAT 8682 107.238 10.368 139.968 1.00 0.00 O ATOM 24406 H1 WAT 8682 107.816 9.605 139.939 1.00 0.00 H ATOM 24407 H2 WAT 8682 107.717 11.012 140.489 1.00 0.00 H TER 24409 WAT 8682 ATOM 24409 O WAT 8683 16.041 30.565 118.574 1.00 0.00 O ATOM 24410 H1 WAT 8683 16.098 30.075 119.395 1.00 0.00 H ATOM 24411 H2 WAT 8683 15.108 30.753 118.472 1.00 0.00 H TER 24413 WAT 8683 ATOM 24413 O WAT 8684 25.003 107.329 67.505 1.00 0.00 O ATOM 24414 H1 WAT 8684 24.622 107.445 66.634 1.00 0.00 H ATOM 24415 H2 WAT 8684 24.370 107.734 68.098 1.00 0.00 H TER 24417 WAT 8684 ATOM 24417 O WAT 8685 3.106 22.816 142.339 1.00 0.00 O ATOM 24418 H1 WAT 8685 2.689 23.266 143.074 1.00 0.00 H ATOM 24419 H2 WAT 8685 3.739 23.448 142.000 1.00 0.00 H TER 24421 WAT 8685 ATOM 24421 O WAT 8686 133.880 35.541 151.401 1.00 0.00 O ATOM 24422 H1 WAT 8686 133.577 36.202 152.024 1.00 0.00 H ATOM 24423 H2 WAT 8686 134.780 35.355 151.668 1.00 0.00 H TER 24425 WAT 8686 ATOM 24425 O WAT 8687 20.621 34.028 59.949 1.00 0.00 O ATOM 24426 H1 WAT 8687 20.746 34.890 60.348 1.00 0.00 H ATOM 24427 H2 WAT 8687 20.861 33.409 60.638 1.00 0.00 H TER 24429 WAT 8687 ATOM 24429 O WAT 8688 142.151 40.512 120.779 1.00 0.00 O ATOM 24430 H1 WAT 8688 142.398 40.456 119.856 1.00 0.00 H ATOM 24431 H2 WAT 8688 142.847 41.032 121.182 1.00 0.00 H TER 24433 WAT 8688 ATOM 24433 O WAT 8689 85.966 141.227 147.086 1.00 0.00 O ATOM 24434 H1 WAT 8689 85.853 142.176 147.051 1.00 0.00 H ATOM 24435 H2 WAT 8689 86.644 141.090 147.748 1.00 0.00 H TER 24437 WAT 8689 ATOM 24437 O WAT 8690 22.692 95.640 139.124 1.00 0.00 O ATOM 24438 H1 WAT 8690 22.179 96.198 138.540 1.00 0.00 H ATOM 24439 H2 WAT 8690 22.230 95.682 139.962 1.00 0.00 H TER 24441 WAT 8690 ATOM 24441 O WAT 8691 21.932 16.256 104.358 1.00 0.00 O ATOM 24442 H1 WAT 8691 21.539 16.131 103.495 1.00 0.00 H ATOM 24443 H2 WAT 8691 21.200 16.512 104.920 1.00 0.00 H TER 24445 WAT 8691 ATOM 24445 O WAT 8692 59.673 19.563 70.419 1.00 0.00 O ATOM 24446 H1 WAT 8692 59.127 19.550 71.205 1.00 0.00 H ATOM 24447 H2 WAT 8692 59.343 20.304 69.911 1.00 0.00 H TER 24449 WAT 8692 ATOM 24449 O WAT 8693 32.444 50.160 56.079 1.00 0.00 O ATOM 24450 H1 WAT 8693 32.289 50.847 55.431 1.00 0.00 H ATOM 24451 H2 WAT 8693 31.646 49.631 56.065 1.00 0.00 H TER 24453 WAT 8693 ATOM 24453 O WAT 8694 32.691 123.390 146.198 1.00 0.00 O ATOM 24454 H1 WAT 8694 33.562 122.996 146.243 1.00 0.00 H ATOM 24455 H2 WAT 8694 32.814 124.282 146.524 1.00 0.00 H TER 24457 WAT 8694 ATOM 24457 O WAT 8695 84.463 28.352 137.477 1.00 0.00 O ATOM 24458 H1 WAT 8695 84.557 29.174 137.957 1.00 0.00 H ATOM 24459 H2 WAT 8695 84.018 28.598 136.665 1.00 0.00 H TER 24461 WAT 8695 ATOM 24461 O WAT 8696 136.550 40.303 66.972 1.00 0.00 O ATOM 24462 H1 WAT 8696 136.132 39.600 67.468 1.00 0.00 H ATOM 24463 H2 WAT 8696 136.027 41.080 67.170 1.00 0.00 H TER 24465 WAT 8696 ATOM 24465 O WAT 8697 143.635 76.400 125.637 1.00 0.00 O ATOM 24466 H1 WAT 8697 143.398 76.370 126.564 1.00 0.00 H ATOM 24467 H2 WAT 8697 143.159 75.667 125.245 1.00 0.00 H TER 24469 WAT 8697 ATOM 24469 O WAT 8698 136.352 61.856 54.091 1.00 0.00 O ATOM 24470 H1 WAT 8698 135.744 61.522 53.431 1.00 0.00 H ATOM 24471 H2 WAT 8698 135.958 61.606 54.927 1.00 0.00 H TER 24473 WAT 8698 ATOM 24473 O WAT 8699 78.980 28.411 154.729 1.00 0.00 O ATOM 24474 H1 WAT 8699 78.788 27.484 154.870 1.00 0.00 H ATOM 24475 H2 WAT 8699 79.891 28.425 154.437 1.00 0.00 H TER 24477 WAT 8699 ATOM 24477 O WAT 8700 44.913 25.821 86.797 1.00 0.00 O ATOM 24478 H1 WAT 8700 45.595 25.688 86.139 1.00 0.00 H ATOM 24479 H2 WAT 8700 44.427 26.586 86.487 1.00 0.00 H TER 24481 WAT 8700 ATOM 24481 O WAT 8701 98.837 13.949 145.732 1.00 0.00 O ATOM 24482 H1 WAT 8701 99.031 13.058 146.024 1.00 0.00 H ATOM 24483 H2 WAT 8701 99.683 14.298 145.450 1.00 0.00 H TER 24485 WAT 8701 ATOM 24485 O WAT 8702 81.464 63.690 83.942 1.00 0.00 O ATOM 24486 H1 WAT 8702 81.330 64.256 83.182 1.00 0.00 H ATOM 24487 H2 WAT 8702 81.736 64.286 84.640 1.00 0.00 H TER 24489 WAT 8702 ATOM 24489 O WAT 8703 101.704 140.753 116.607 1.00 0.00 O ATOM 24490 H1 WAT 8703 101.053 140.336 116.044 1.00 0.00 H ATOM 24491 H2 WAT 8703 102.054 141.471 116.079 1.00 0.00 H TER 24493 WAT 8703 ATOM 24493 O WAT 8704 15.558 66.974 66.230 1.00 0.00 O ATOM 24494 H1 WAT 8704 15.890 67.180 65.356 1.00 0.00 H ATOM 24495 H2 WAT 8704 15.379 66.034 66.202 1.00 0.00 H TER 24497 WAT 8704 ATOM 24497 O WAT 8705 46.689 41.931 18.803 1.00 0.00 O ATOM 24498 H1 WAT 8705 45.813 41.828 19.175 1.00 0.00 H ATOM 24499 H2 WAT 8705 46.955 42.814 19.057 1.00 0.00 H TER 24501 WAT 8705 ATOM 24501 O WAT 8706 90.148 68.737 122.050 1.00 0.00 O ATOM 24502 H1 WAT 8706 89.271 69.110 121.959 1.00 0.00 H ATOM 24503 H2 WAT 8706 90.228 68.132 121.312 1.00 0.00 H TER 24505 WAT 8706 ATOM 24505 O WAT 8707 121.827 96.671 13.401 1.00 0.00 O ATOM 24506 H1 WAT 8707 121.023 96.874 12.924 1.00 0.00 H ATOM 24507 H2 WAT 8707 122.340 97.479 13.361 1.00 0.00 H TER 24509 WAT 8707 ATOM 24509 O WAT 8708 44.776 85.761 105.212 1.00 0.00 O ATOM 24510 H1 WAT 8708 44.290 85.995 104.421 1.00 0.00 H ATOM 24511 H2 WAT 8708 44.392 86.306 105.899 1.00 0.00 H TER 24513 WAT 8708 ATOM 24513 O WAT 8709 52.702 122.300 60.157 1.00 0.00 O ATOM 24514 H1 WAT 8709 53.574 121.975 60.380 1.00 0.00 H ATOM 24515 H2 WAT 8709 52.627 122.158 59.214 1.00 0.00 H TER 24517 WAT 8709 ATOM 24517 O WAT 8710 92.745 140.444 82.672 1.00 0.00 O ATOM 24518 H1 WAT 8710 92.289 140.840 83.415 1.00 0.00 H ATOM 24519 H2 WAT 8710 92.153 140.572 81.931 1.00 0.00 H TER 24521 WAT 8710 ATOM 24521 O WAT 8711 20.212 126.025 78.073 1.00 0.00 O ATOM 24522 H1 WAT 8711 20.770 126.661 78.519 1.00 0.00 H ATOM 24523 H2 WAT 8711 19.377 126.069 78.540 1.00 0.00 H TER 24525 WAT 8711 ATOM 24525 O WAT 8712 111.973 119.536 66.911 1.00 0.00 O ATOM 24526 H1 WAT 8712 112.681 119.252 67.489 1.00 0.00 H ATOM 24527 H2 WAT 8712 111.365 119.999 67.487 1.00 0.00 H TER 24529 WAT 8712 ATOM 24529 O WAT 8713 130.111 54.666 69.760 1.00 0.00 O ATOM 24530 H1 WAT 8713 130.903 54.152 69.914 1.00 0.00 H ATOM 24531 H2 WAT 8713 129.560 54.490 70.523 1.00 0.00 H TER 24533 WAT 8713 ATOM 24533 O WAT 8714 99.646 137.273 105.333 1.00 0.00 O ATOM 24534 H1 WAT 8714 99.308 137.821 104.624 1.00 0.00 H ATOM 24535 H2 WAT 8714 98.872 137.039 105.845 1.00 0.00 H TER 24537 WAT 8714 ATOM 24537 O WAT 8715 0.594 95.402 119.728 1.00 0.00 O ATOM 24538 H1 WAT 8715 0.617 94.626 119.169 1.00 0.00 H ATOM 24539 H2 WAT 8715 0.697 95.061 120.617 1.00 0.00 H TER 24541 WAT 8715 ATOM 24541 O WAT 8716 105.777 52.286 79.458 1.00 0.00 O ATOM 24542 H1 WAT 8716 105.283 52.805 78.824 1.00 0.00 H ATOM 24543 H2 WAT 8716 105.818 51.411 79.072 1.00 0.00 H TER 24545 WAT 8716 ATOM 24545 O WAT 8717 87.851 54.240 3.459 1.00 0.00 O ATOM 24546 H1 WAT 8717 88.480 54.847 3.849 1.00 0.00 H ATOM 24547 H2 WAT 8717 88.081 54.222 2.530 1.00 0.00 H TER 24549 WAT 8717 ATOM 24549 O WAT 8718 101.708 85.909 124.890 1.00 0.00 O ATOM 24550 H1 WAT 8718 101.327 85.371 124.196 1.00 0.00 H ATOM 24551 H2 WAT 8718 102.649 85.739 124.835 1.00 0.00 H TER 24553 WAT 8718 ATOM 24553 O WAT 8719 6.465 122.888 144.851 1.00 0.00 O ATOM 24554 H1 WAT 8719 7.251 123.434 144.853 1.00 0.00 H ATOM 24555 H2 WAT 8719 5.799 123.426 145.280 1.00 0.00 H TER 24557 WAT 8719 ATOM 24557 O WAT 8720 85.396 99.563 125.824 1.00 0.00 O ATOM 24558 H1 WAT 8720 86.101 100.109 125.475 1.00 0.00 H ATOM 24559 H2 WAT 8720 85.538 98.705 125.424 1.00 0.00 H TER 24561 WAT 8720 ATOM 24561 O WAT 8721 106.170 118.949 5.773 1.00 0.00 O ATOM 24562 H1 WAT 8721 107.122 118.933 5.870 1.00 0.00 H ATOM 24563 H2 WAT 8721 105.901 118.040 5.908 1.00 0.00 H TER 24565 WAT 8721 ATOM 24565 O WAT 8722 117.187 48.859 75.232 1.00 0.00 O ATOM 24566 H1 WAT 8722 117.974 49.402 75.204 1.00 0.00 H ATOM 24567 H2 WAT 8722 116.498 49.417 74.870 1.00 0.00 H TER 24569 WAT 8722 ATOM 24569 O WAT 8723 87.596 107.988 67.213 1.00 0.00 O ATOM 24570 H1 WAT 8723 87.937 108.455 67.976 1.00 0.00 H ATOM 24571 H2 WAT 8723 88.364 107.564 66.830 1.00 0.00 H TER 24573 WAT 8723 ATOM 24573 O WAT 8724 48.299 5.432 130.251 1.00 0.00 O ATOM 24574 H1 WAT 8724 49.027 4.903 130.578 1.00 0.00 H ATOM 24575 H2 WAT 8724 47.868 5.760 131.040 1.00 0.00 H TER 24577 WAT 8724 ATOM 24577 O WAT 8725 19.403 125.634 84.723 1.00 0.00 O ATOM 24578 H1 WAT 8725 19.274 126.540 84.444 1.00 0.00 H ATOM 24579 H2 WAT 8725 19.547 125.151 83.909 1.00 0.00 H TER 24581 WAT 8725 ATOM 24581 O WAT 8726 28.923 75.569 124.736 1.00 0.00 O ATOM 24582 H1 WAT 8726 28.407 75.758 125.520 1.00 0.00 H ATOM 24583 H2 WAT 8726 28.491 76.065 124.040 1.00 0.00 H TER 24585 WAT 8726 ATOM 24585 O WAT 8727 21.744 94.021 66.967 1.00 0.00 O ATOM 24586 H1 WAT 8727 22.289 93.639 67.655 1.00 0.00 H ATOM 24587 H2 WAT 8727 21.355 93.267 66.524 1.00 0.00 H TER 24589 WAT 8727 ATOM 24589 O WAT 8728 88.760 71.515 138.601 1.00 0.00 O ATOM 24590 H1 WAT 8728 88.953 71.417 137.669 1.00 0.00 H ATOM 24591 H2 WAT 8728 88.820 72.457 138.760 1.00 0.00 H TER 24593 WAT 8728 ATOM 24593 O WAT 8729 34.841 83.110 152.467 1.00 0.00 O ATOM 24594 H1 WAT 8729 35.716 82.740 152.585 1.00 0.00 H ATOM 24595 H2 WAT 8729 34.993 84.044 152.321 1.00 0.00 H TER 24597 WAT 8729 ATOM 24597 O WAT 8730 117.172 6.012 147.623 1.00 0.00 O ATOM 24598 H1 WAT 8730 116.338 6.353 147.947 1.00 0.00 H ATOM 24599 H2 WAT 8730 117.666 5.800 148.415 1.00 0.00 H TER 24601 WAT 8730 ATOM 24601 O WAT 8731 58.808 56.154 132.218 1.00 0.00 O ATOM 24602 H1 WAT 8731 58.579 56.651 131.433 1.00 0.00 H ATOM 24603 H2 WAT 8731 58.878 56.814 132.908 1.00 0.00 H TER 24605 WAT 8731 ATOM 24605 O WAT 8732 109.337 71.888 152.756 1.00 0.00 O ATOM 24606 H1 WAT 8732 108.826 71.129 152.472 1.00 0.00 H ATOM 24607 H2 WAT 8732 108.924 72.632 152.319 1.00 0.00 H TER 24609 WAT 8732 ATOM 24609 O WAT 8733 97.510 34.522 64.320 1.00 0.00 O ATOM 24610 H1 WAT 8733 96.979 35.278 64.572 1.00 0.00 H ATOM 24611 H2 WAT 8733 97.001 34.090 63.634 1.00 0.00 H TER 24613 WAT 8733 ATOM 24613 O WAT 8734 131.719 56.925 137.477 1.00 0.00 O ATOM 24614 H1 WAT 8734 131.564 56.155 138.023 1.00 0.00 H ATOM 24615 H2 WAT 8734 132.611 56.811 137.149 1.00 0.00 H TER 24617 WAT 8734 ATOM 24617 O WAT 8735 128.828 132.707 102.028 1.00 0.00 O ATOM 24618 H1 WAT 8735 127.923 132.922 101.805 1.00 0.00 H ATOM 24619 H2 WAT 8735 129.219 132.426 101.201 1.00 0.00 H TER 24621 WAT 8735 ATOM 24621 O WAT 8736 118.246 49.275 5.467 1.00 0.00 O ATOM 24622 H1 WAT 8736 118.029 48.366 5.261 1.00 0.00 H ATOM 24623 H2 WAT 8736 118.624 49.237 6.346 1.00 0.00 H TER 24625 WAT 8736 ATOM 24625 O WAT 8737 115.486 53.494 146.572 1.00 0.00 O ATOM 24626 H1 WAT 8737 115.090 53.485 147.443 1.00 0.00 H ATOM 24627 H2 WAT 8737 114.742 53.448 145.971 1.00 0.00 H TER 24629 WAT 8737 ATOM 24629 O WAT 8738 69.593 9.423 13.635 1.00 0.00 O ATOM 24630 H1 WAT 8738 69.605 10.366 13.801 1.00 0.00 H ATOM 24631 H2 WAT 8738 68.684 9.165 13.790 1.00 0.00 H TER 24633 WAT 8738 ATOM 24633 O WAT 8739 1.919 51.199 124.294 1.00 0.00 O ATOM 24634 H1 WAT 8739 2.118 51.198 125.230 1.00 0.00 H ATOM 24635 H2 WAT 8739 2.050 52.108 124.023 1.00 0.00 H TER 24637 WAT 8739 ATOM 24637 O WAT 8740 31.582 139.378 88.418 1.00 0.00 O ATOM 24638 H1 WAT 8740 30.921 140.006 88.708 1.00 0.00 H ATOM 24639 H2 WAT 8740 31.558 138.684 89.077 1.00 0.00 H TER 24641 WAT 8740 ATOM 24641 O WAT 8741 98.611 90.490 85.298 1.00 0.00 O ATOM 24642 H1 WAT 8741 99.129 90.710 84.523 1.00 0.00 H ATOM 24643 H2 WAT 8741 98.312 89.594 85.139 1.00 0.00 H TER 24645 WAT 8741 ATOM 24645 O WAT 8742 75.965 0.165 16.069 1.00 0.00 O ATOM 24646 H1 WAT 8742 75.620 0.993 16.401 1.00 0.00 H ATOM 24647 H2 WAT 8742 76.864 0.132 16.394 1.00 0.00 H TER 24649 WAT 8742 ATOM 24649 O WAT 8743 74.524 34.814 124.650 1.00 0.00 O ATOM 24650 H1 WAT 8743 75.250 34.637 124.052 1.00 0.00 H ATOM 24651 H2 WAT 8743 74.875 34.616 125.518 1.00 0.00 H TER 24653 WAT 8743 ATOM 24653 O WAT 8744 109.984 111.290 0.990 1.00 0.00 O ATOM 24654 H1 WAT 8744 110.688 111.086 0.375 1.00 0.00 H ATOM 24655 H2 WAT 8744 109.238 110.778 0.679 1.00 0.00 H TER 24657 WAT 8744 ATOM 24657 O WAT 8745 46.575 37.376 61.708 1.00 0.00 O ATOM 24658 H1 WAT 8745 47.130 38.028 61.279 1.00 0.00 H ATOM 24659 H2 WAT 8745 45.796 37.323 61.153 1.00 0.00 H TER 24661 WAT 8745 ATOM 24661 O WAT 8746 29.781 48.391 12.113 1.00 0.00 O ATOM 24662 H1 WAT 8746 30.239 48.748 11.352 1.00 0.00 H ATOM 24663 H2 WAT 8746 28.915 48.796 12.083 1.00 0.00 H TER 24665 WAT 8746 ATOM 24665 O WAT 8747 85.908 94.949 22.911 1.00 0.00 O ATOM 24666 H1 WAT 8747 86.647 94.953 23.520 1.00 0.00 H ATOM 24667 H2 WAT 8747 86.174 95.541 22.208 1.00 0.00 H TER 24669 WAT 8747 ATOM 24669 O WAT 8748 1.938 135.195 98.440 1.00 0.00 O ATOM 24670 H1 WAT 8748 1.846 134.949 99.361 1.00 0.00 H ATOM 24671 H2 WAT 8748 1.240 135.833 98.292 1.00 0.00 H TER 24673 WAT 8748 ATOM 24673 O WAT 8749 135.925 63.458 110.342 1.00 0.00 O ATOM 24674 H1 WAT 8749 135.752 63.003 111.167 1.00 0.00 H ATOM 24675 H2 WAT 8749 135.887 64.387 110.569 1.00 0.00 H TER 24677 WAT 8749 ATOM 24677 O WAT 8750 4.838 116.031 144.615 1.00 0.00 O ATOM 24678 H1 WAT 8750 4.354 115.273 144.286 1.00 0.00 H ATOM 24679 H2 WAT 8750 5.012 115.823 145.533 1.00 0.00 H TER 24681 WAT 8750 ATOM 24681 O WAT 8751 78.466 74.454 79.844 1.00 0.00 O ATOM 24682 H1 WAT 8751 78.388 73.565 80.190 1.00 0.00 H ATOM 24683 H2 WAT 8751 79.213 74.828 80.311 1.00 0.00 H TER 24685 WAT 8751 ATOM 24685 O WAT 8752 123.955 29.840 124.598 1.00 0.00 O ATOM 24686 H1 WAT 8752 123.873 30.204 123.717 1.00 0.00 H ATOM 24687 H2 WAT 8752 124.829 29.450 124.616 1.00 0.00 H TER 24689 WAT 8752 ATOM 24689 O WAT 8753 137.006 32.524 6.862 1.00 0.00 O ATOM 24690 H1 WAT 8753 137.001 32.731 7.797 1.00 0.00 H ATOM 24691 H2 WAT 8753 137.927 32.361 6.658 1.00 0.00 H TER 24693 WAT 8753 ATOM 24693 O WAT 8754 117.977 140.908 130.999 1.00 0.00 O ATOM 24694 H1 WAT 8754 118.883 140.833 131.299 1.00 0.00 H ATOM 24695 H2 WAT 8754 118.019 141.511 130.257 1.00 0.00 H TER 24697 WAT 8754 ATOM 24697 O WAT 8755 11.806 36.700 18.329 1.00 0.00 O ATOM 24698 H1 WAT 8755 11.784 37.442 18.933 1.00 0.00 H ATOM 24699 H2 WAT 8755 10.979 36.242 18.482 1.00 0.00 H TER 24701 WAT 8755 ATOM 24701 O WAT 8756 76.564 62.722 110.733 1.00 0.00 O ATOM 24702 H1 WAT 8756 76.352 63.656 110.729 1.00 0.00 H ATOM 24703 H2 WAT 8756 75.931 62.335 111.336 1.00 0.00 H TER 24705 WAT 8756 ATOM 24705 O WAT 8757 137.434 104.999 131.347 1.00 0.00 O ATOM 24706 H1 WAT 8757 136.488 104.905 131.456 1.00 0.00 H ATOM 24707 H2 WAT 8757 137.799 104.738 132.192 1.00 0.00 H TER 24709 WAT 8757 ATOM 24709 O WAT 8758 67.217 126.469 102.398 1.00 0.00 O ATOM 24710 H1 WAT 8758 67.285 125.601 102.000 1.00 0.00 H ATOM 24711 H2 WAT 8758 68.124 126.753 102.508 1.00 0.00 H TER 24713 WAT 8758 ATOM 24713 O WAT 8759 47.892 76.487 87.500 1.00 0.00 O ATOM 24714 H1 WAT 8759 47.198 76.854 86.953 1.00 0.00 H ATOM 24715 H2 WAT 8759 47.504 76.432 88.373 1.00 0.00 H TER 24717 WAT 8759 ATOM 24717 O WAT 8760 57.290 100.776 114.244 1.00 0.00 O ATOM 24718 H1 WAT 8760 57.163 100.045 113.639 1.00 0.00 H ATOM 24719 H2 WAT 8760 57.929 100.453 114.879 1.00 0.00 H TER 24721 WAT 8760 ATOM 24721 O WAT 8761 8.814 116.707 104.098 1.00 0.00 O ATOM 24722 H1 WAT 8761 8.282 117.423 103.752 1.00 0.00 H ATOM 24723 H2 WAT 8761 9.715 116.952 103.884 1.00 0.00 H TER 24725 WAT 8761 ATOM 24725 O WAT 8762 58.134 34.554 150.334 1.00 0.00 O ATOM 24726 H1 WAT 8762 57.568 35.318 150.443 1.00 0.00 H ATOM 24727 H2 WAT 8762 58.836 34.857 149.758 1.00 0.00 H TER 24729 WAT 8762 ATOM 24729 O WAT 8763 95.892 131.902 75.957 1.00 0.00 O ATOM 24730 H1 WAT 8763 95.189 131.341 76.284 1.00 0.00 H ATOM 24731 H2 WAT 8763 96.496 131.301 75.522 1.00 0.00 H TER 24733 WAT 8763 ATOM 24733 O WAT 8764 67.504 53.427 13.875 1.00 0.00 O ATOM 24734 H1 WAT 8764 66.949 53.474 14.653 1.00 0.00 H ATOM 24735 H2 WAT 8764 67.471 52.507 13.611 1.00 0.00 H TER 24737 WAT 8764 ATOM 24737 O WAT 8765 57.019 53.832 143.813 1.00 0.00 O ATOM 24738 H1 WAT 8765 56.637 53.211 144.433 1.00 0.00 H ATOM 24739 H2 WAT 8765 57.857 53.439 143.567 1.00 0.00 H TER 24741 WAT 8765 ATOM 24741 O WAT 8766 22.660 129.732 126.523 1.00 0.00 O ATOM 24742 H1 WAT 8766 21.979 130.291 126.896 1.00 0.00 H ATOM 24743 H2 WAT 8766 23.029 130.249 125.806 1.00 0.00 H TER 24745 WAT 8766 ATOM 24745 O WAT 8767 4.783 103.798 113.603 1.00 0.00 O ATOM 24746 H1 WAT 8767 4.095 104.440 113.776 1.00 0.00 H ATOM 24747 H2 WAT 8767 4.766 103.217 114.364 1.00 0.00 H TER 24749 WAT 8767 ATOM 24749 O WAT 8768 52.362 10.195 66.056 1.00 0.00 O ATOM 24750 H1 WAT 8768 51.630 9.623 66.285 1.00 0.00 H ATOM 24751 H2 WAT 8768 52.939 9.645 65.526 1.00 0.00 H TER 24753 WAT 8768 ATOM 24753 O WAT 8769 15.782 18.693 156.775 1.00 0.00 O ATOM 24754 H1 WAT 8769 16.551 18.748 156.208 1.00 0.00 H ATOM 24755 H2 WAT 8769 15.896 17.873 157.254 1.00 0.00 H TER 24757 WAT 8769 ATOM 24757 O WAT 8770 82.635 40.113 142.895 1.00 0.00 O ATOM 24758 H1 WAT 8770 82.609 39.273 142.436 1.00 0.00 H ATOM 24759 H2 WAT 8770 82.983 40.727 142.249 1.00 0.00 H TER 24761 WAT 8770 ATOM 24761 O WAT 8771 109.872 82.498 155.825 1.00 0.00 O ATOM 24762 H1 WAT 8771 110.532 82.104 155.254 1.00 0.00 H ATOM 24763 H2 WAT 8771 110.208 83.375 156.009 1.00 0.00 H TER 24765 WAT 8771 ATOM 24765 O WAT 8772 79.283 84.183 98.098 1.00 0.00 O ATOM 24766 H1 WAT 8772 79.026 85.007 98.511 1.00 0.00 H ATOM 24767 H2 WAT 8772 79.125 84.324 97.164 1.00 0.00 H TER 24769 WAT 8772 ATOM 24769 O WAT 8773 80.521 141.061 73.574 1.00 0.00 O ATOM 24770 H1 WAT 8773 79.727 140.729 73.993 1.00 0.00 H ATOM 24771 H2 WAT 8773 81.197 140.424 73.804 1.00 0.00 H TER 24773 WAT 8773 ATOM 24773 O WAT 8774 124.072 64.350 157.187 1.00 0.00 O ATOM 24774 H1 WAT 8774 123.309 64.063 157.687 1.00 0.00 H ATOM 24775 H2 WAT 8774 124.640 64.769 157.834 1.00 0.00 H TER 24777 WAT 8774 ATOM 24777 O WAT 8775 128.600 22.171 5.162 1.00 0.00 O ATOM 24778 H1 WAT 8775 128.675 22.546 4.285 1.00 0.00 H ATOM 24779 H2 WAT 8775 129.013 22.817 5.735 1.00 0.00 H TER 24781 WAT 8775 ATOM 24781 O WAT 8776 65.615 81.107 74.485 1.00 0.00 O ATOM 24782 H1 WAT 8776 65.053 80.512 74.981 1.00 0.00 H ATOM 24783 H2 WAT 8776 65.064 81.413 73.764 1.00 0.00 H TER 24785 WAT 8776 ATOM 24785 O WAT 8777 101.733 108.147 12.199 1.00 0.00 O ATOM 24786 H1 WAT 8777 102.672 108.126 12.383 1.00 0.00 H ATOM 24787 H2 WAT 8777 101.660 108.624 11.373 1.00 0.00 H TER 24789 WAT 8777 ATOM 24789 O WAT 8778 36.754 20.511 140.564 1.00 0.00 O ATOM 24790 H1 WAT 8778 36.983 19.901 141.264 1.00 0.00 H ATOM 24791 H2 WAT 8778 36.724 21.367 140.991 1.00 0.00 H TER 24793 WAT 8778 ATOM 24793 O WAT 8779 40.826 122.113 20.539 1.00 0.00 O ATOM 24794 H1 WAT 8779 41.050 122.620 21.320 1.00 0.00 H ATOM 24795 H2 WAT 8779 41.299 121.288 20.646 1.00 0.00 H TER 24797 WAT 8779 ATOM 24797 O WAT 8780 83.283 42.739 19.319 1.00 0.00 O ATOM 24798 H1 WAT 8780 82.639 43.427 19.487 1.00 0.00 H ATOM 24799 H2 WAT 8780 83.546 42.874 18.409 1.00 0.00 H TER 24801 WAT 8780 ATOM 24801 O WAT 8781 91.260 70.443 79.039 1.00 0.00 O ATOM 24802 H1 WAT 8781 91.943 70.277 79.689 1.00 0.00 H ATOM 24803 H2 WAT 8781 90.774 69.620 78.988 1.00 0.00 H TER 24805 WAT 8781 ATOM 24805 O WAT 8782 129.783 55.221 61.858 1.00 0.00 O ATOM 24806 H1 WAT 8782 130.095 55.167 62.762 1.00 0.00 H ATOM 24807 H2 WAT 8782 128.937 55.665 61.924 1.00 0.00 H TER 24809 WAT 8782 ATOM 24809 O WAT 8783 12.678 117.276 148.465 1.00 0.00 O ATOM 24810 H1 WAT 8783 13.453 117.117 147.927 1.00 0.00 H ATOM 24811 H2 WAT 8783 12.388 118.153 148.214 1.00 0.00 H TER 24813 WAT 8783 ATOM 24813 O WAT 8784 60.736 4.506 129.521 1.00 0.00 O ATOM 24814 H1 WAT 8784 60.728 5.450 129.679 1.00 0.00 H ATOM 24815 H2 WAT 8784 60.605 4.117 130.386 1.00 0.00 H TER 24817 WAT 8784 ATOM 24817 O WAT 8785 84.321 21.500 125.364 1.00 0.00 O ATOM 24818 H1 WAT 8785 84.527 21.439 124.431 1.00 0.00 H ATOM 24819 H2 WAT 8785 83.426 21.839 125.390 1.00 0.00 H TER 24821 WAT 8785 ATOM 24821 O WAT 8786 36.145 48.805 131.654 1.00 0.00 O ATOM 24822 H1 WAT 8786 36.638 49.271 130.979 1.00 0.00 H ATOM 24823 H2 WAT 8786 36.770 48.175 132.013 1.00 0.00 H TER 24825 WAT 8786 ATOM 24825 O WAT 8787 132.452 145.504 56.850 1.00 0.00 O ATOM 24826 H1 WAT 8787 132.108 146.397 56.859 1.00 0.00 H ATOM 24827 H2 WAT 8787 132.548 145.275 57.774 1.00 0.00 H TER 24829 WAT 8787 ATOM 24829 O WAT 8788 38.758 129.157 64.642 1.00 0.00 O ATOM 24830 H1 WAT 8788 37.801 129.148 64.602 1.00 0.00 H ATOM 24831 H2 WAT 8788 39.035 128.670 63.866 1.00 0.00 H TER 24833 WAT 8788 ATOM 24833 O WAT 8789 71.653 52.314 74.788 1.00 0.00 O ATOM 24834 H1 WAT 8789 70.699 52.302 74.874 1.00 0.00 H ATOM 24835 H2 WAT 8789 71.808 52.248 73.845 1.00 0.00 H TER 24837 WAT 8789 ATOM 24837 O WAT 8790 47.430 55.241 16.226 1.00 0.00 O ATOM 24838 H1 WAT 8790 47.295 55.240 17.174 1.00 0.00 H ATOM 24839 H2 WAT 8790 48.343 55.504 16.114 1.00 0.00 H TER 24841 WAT 8790 ATOM 24841 O WAT 8791 80.126 10.877 72.469 1.00 0.00 O ATOM 24842 H1 WAT 8791 79.555 11.470 71.980 1.00 0.00 H ATOM 24843 H2 WAT 8791 79.816 10.002 72.239 1.00 0.00 H TER 24845 WAT 8791 ATOM 24845 O WAT 8792 37.229 90.937 146.501 1.00 0.00 O ATOM 24846 H1 WAT 8792 38.005 90.922 145.941 1.00 0.00 H ATOM 24847 H2 WAT 8792 37.129 91.857 146.746 1.00 0.00 H TER 24849 WAT 8792 ATOM 24849 O WAT 8793 88.597 128.462 54.630 1.00 0.00 O ATOM 24850 H1 WAT 8793 87.752 128.694 54.246 1.00 0.00 H ATOM 24851 H2 WAT 8793 89.018 129.302 54.811 1.00 0.00 H TER 24853 WAT 8793 ATOM 24853 O WAT 8794 60.513 50.068 111.999 1.00 0.00 O ATOM 24854 H1 WAT 8794 61.007 49.323 112.341 1.00 0.00 H ATOM 24855 H2 WAT 8794 59.601 49.777 112.011 1.00 0.00 H TER 24857 WAT 8794 ATOM 24857 O WAT 8795 58.677 111.872 152.434 1.00 0.00 O ATOM 24858 H1 WAT 8795 59.092 111.518 151.648 1.00 0.00 H ATOM 24859 H2 WAT 8795 57.866 112.270 152.117 1.00 0.00 H TER 24861 WAT 8795 ATOM 24861 O WAT 8796 56.597 1.107 57.094 1.00 0.00 O ATOM 24862 H1 WAT 8796 56.762 0.931 58.020 1.00 0.00 H ATOM 24863 H2 WAT 8796 55.643 1.127 57.019 1.00 0.00 H TER 24865 WAT 8796 ATOM 24865 O WAT 8797 138.299 57.092 142.852 1.00 0.00 O ATOM 24866 H1 WAT 8797 139.233 56.911 142.740 1.00 0.00 H ATOM 24867 H2 WAT 8797 137.964 56.333 143.329 1.00 0.00 H TER 24869 WAT 8797 ATOM 24869 O WAT 8798 30.790 103.354 91.405 1.00 0.00 O ATOM 24870 H1 WAT 8798 30.743 102.399 91.449 1.00 0.00 H ATOM 24871 H2 WAT 8798 30.812 103.550 90.469 1.00 0.00 H TER 24873 WAT 8798 ATOM 24873 O WAT 8799 138.257 53.782 55.268 1.00 0.00 O ATOM 24874 H1 WAT 8799 138.786 53.073 55.634 1.00 0.00 H ATOM 24875 H2 WAT 8799 137.363 53.440 55.270 1.00 0.00 H TER 24877 WAT 8799 ATOM 24877 O WAT 8800 30.509 2.445 139.170 1.00 0.00 O ATOM 24878 H1 WAT 8800 31.389 2.293 138.827 1.00 0.00 H ATOM 24879 H2 WAT 8800 30.237 1.595 139.518 1.00 0.00 H TER 24881 WAT 8800 ATOM 24881 O WAT 8801 100.442 42.512 84.341 1.00 0.00 O ATOM 24882 H1 WAT 8801 100.424 41.565 84.201 1.00 0.00 H ATOM 24883 H2 WAT 8801 99.921 42.870 83.622 1.00 0.00 H TER 24885 WAT 8801 ATOM 24885 O WAT 8802 93.953 117.429 88.388 1.00 0.00 O ATOM 24886 H1 WAT 8802 94.454 116.913 87.757 1.00 0.00 H ATOM 24887 H2 WAT 8802 93.039 117.207 88.207 1.00 0.00 H TER 24889 WAT 8802 ATOM 24889 O WAT 8803 103.377 59.374 97.801 1.00 0.00 O ATOM 24890 H1 WAT 8803 103.598 59.473 96.875 1.00 0.00 H ATOM 24891 H2 WAT 8803 102.917 58.536 97.849 1.00 0.00 H TER 24893 WAT 8803 ATOM 24893 O WAT 8804 53.413 114.297 84.618 1.00 0.00 O ATOM 24894 H1 WAT 8804 53.908 114.193 85.431 1.00 0.00 H ATOM 24895 H2 WAT 8804 53.939 113.845 83.958 1.00 0.00 H TER 24897 WAT 8804 ATOM 24897 O WAT 8805 62.724 55.585 86.938 1.00 0.00 O ATOM 24898 H1 WAT 8805 62.764 55.949 86.054 1.00 0.00 H ATOM 24899 H2 WAT 8805 62.852 54.645 86.817 1.00 0.00 H TER 24901 WAT 8805 ATOM 24901 O WAT 8806 134.473 117.277 118.586 1.00 0.00 O ATOM 24902 H1 WAT 8806 134.107 117.061 119.444 1.00 0.00 H ATOM 24903 H2 WAT 8806 133.768 117.742 118.135 1.00 0.00 H TER 24905 WAT 8806 ATOM 24905 O WAT 8807 5.276 63.603 12.269 1.00 0.00 O ATOM 24906 H1 WAT 8807 4.478 63.688 11.748 1.00 0.00 H ATOM 24907 H2 WAT 8807 5.161 64.227 12.986 1.00 0.00 H TER 24909 WAT 8807 ATOM 24909 O WAT 8808 51.017 13.469 6.516 1.00 0.00 O ATOM 24910 H1 WAT 8808 51.557 13.496 7.306 1.00 0.00 H ATOM 24911 H2 WAT 8808 51.647 13.452 5.796 1.00 0.00 H TER 24913 WAT 8808 ATOM 24913 O WAT 8809 128.941 52.372 17.861 1.00 0.00 O ATOM 24914 H1 WAT 8809 128.792 52.430 18.805 1.00 0.00 H ATOM 24915 H2 WAT 8809 128.142 52.726 17.471 1.00 0.00 H TER 24917 WAT 8809 ATOM 24917 O WAT 8810 15.012 112.787 117.656 1.00 0.00 O ATOM 24918 H1 WAT 8810 15.837 112.564 118.089 1.00 0.00 H ATOM 24919 H2 WAT 8810 15.221 113.555 117.124 1.00 0.00 H TER 24921 WAT 8810 ATOM 24921 O WAT 8811 63.557 20.090 142.159 1.00 0.00 O ATOM 24922 H1 WAT 8811 64.125 20.835 142.356 1.00 0.00 H ATOM 24923 H2 WAT 8811 63.883 19.755 141.324 1.00 0.00 H TER 24925 WAT 8811 ATOM 24925 O WAT 8812 87.275 51.902 60.608 1.00 0.00 O ATOM 24926 H1 WAT 8812 88.163 51.638 60.850 1.00 0.00 H ATOM 24927 H2 WAT 8812 87.017 51.278 59.930 1.00 0.00 H TER 24929 WAT 8812 ATOM 24929 O WAT 8813 40.396 44.605 7.992 1.00 0.00 O ATOM 24930 H1 WAT 8813 39.877 44.500 8.789 1.00 0.00 H ATOM 24931 H2 WAT 8813 40.608 45.539 7.965 1.00 0.00 H TER 24933 WAT 8813 ATOM 24933 O WAT 8814 13.071 7.531 95.241 1.00 0.00 O ATOM 24934 H1 WAT 8814 13.652 6.894 95.657 1.00 0.00 H ATOM 24935 H2 WAT 8814 13.355 7.552 94.327 1.00 0.00 H TER 24937 WAT 8814 ATOM 24937 O WAT 8815 46.760 124.709 1.217 1.00 0.00 O ATOM 24938 H1 WAT 8815 46.988 125.444 0.648 1.00 0.00 H ATOM 24939 H2 WAT 8815 46.918 125.034 2.103 1.00 0.00 H TER 24941 WAT 8815 ATOM 24941 O WAT 8816 29.830 18.165 97.008 1.00 0.00 O ATOM 24942 H1 WAT 8816 29.903 18.983 96.515 1.00 0.00 H ATOM 24943 H2 WAT 8816 29.857 18.436 97.926 1.00 0.00 H TER 24945 WAT 8816 ATOM 24945 O WAT 8817 74.647 109.868 90.723 1.00 0.00 O ATOM 24946 H1 WAT 8817 73.854 109.828 91.258 1.00 0.00 H ATOM 24947 H2 WAT 8817 74.672 110.769 90.400 1.00 0.00 H TER 24949 WAT 8817 ATOM 24949 O WAT 8818 145.503 117.404 2.311 1.00 0.00 O ATOM 24950 H1 WAT 8818 146.126 117.196 3.008 1.00 0.00 H ATOM 24951 H2 WAT 8818 145.105 118.231 2.584 1.00 0.00 H TER 24953 WAT 8818 ATOM 24953 O WAT 8819 10.375 22.362 70.625 1.00 0.00 O ATOM 24954 H1 WAT 8819 10.087 21.451 70.571 1.00 0.00 H ATOM 24955 H2 WAT 8819 10.814 22.424 71.474 1.00 0.00 H TER 24957 WAT 8819 ATOM 24957 O WAT 8820 42.366 46.699 111.102 1.00 0.00 O ATOM 24958 H1 WAT 8820 42.018 46.365 110.275 1.00 0.00 H ATOM 24959 H2 WAT 8820 42.775 47.533 110.870 1.00 0.00 H TER 24961 WAT 8820 ATOM 24961 O WAT 8821 101.638 125.628 80.031 1.00 0.00 O ATOM 24962 H1 WAT 8821 100.922 125.117 80.407 1.00 0.00 H ATOM 24963 H2 WAT 8821 101.211 126.214 79.406 1.00 0.00 H TER 24965 WAT 8821 ATOM 24965 O WAT 8822 124.624 72.939 76.477 1.00 0.00 O ATOM 24966 H1 WAT 8822 124.205 72.369 77.122 1.00 0.00 H ATOM 24967 H2 WAT 8822 125.045 72.337 75.863 1.00 0.00 H TER 24969 WAT 8822 ATOM 24969 O WAT 8823 72.426 46.072 10.347 1.00 0.00 O ATOM 24970 H1 WAT 8823 73.114 46.344 10.954 1.00 0.00 H ATOM 24971 H2 WAT 8823 72.121 46.888 9.950 1.00 0.00 H TER 24973 WAT 8823 ATOM 24973 O WAT 8824 2.306 37.465 61.326 1.00 0.00 O ATOM 24974 H1 WAT 8824 2.982 38.088 61.590 1.00 0.00 H ATOM 24975 H2 WAT 8824 2.676 37.017 60.565 1.00 0.00 H TER 24977 WAT 8824 ATOM 24977 O WAT 8825 105.463 113.629 2.512 1.00 0.00 O ATOM 24978 H1 WAT 8825 106.068 112.904 2.358 1.00 0.00 H ATOM 24979 H2 WAT 8825 104.982 113.720 1.690 1.00 0.00 H TER 24981 WAT 8825 ATOM 24981 O WAT 8826 47.532 8.196 120.309 1.00 0.00 O ATOM 24982 H1 WAT 8826 47.304 7.371 119.881 1.00 0.00 H ATOM 24983 H2 WAT 8826 48.489 8.197 120.333 1.00 0.00 H TER 24985 WAT 8826 ATOM 24985 O WAT 8827 60.888 9.416 93.635 1.00 0.00 O ATOM 24986 H1 WAT 8827 61.786 9.092 93.709 1.00 0.00 H ATOM 24987 H2 WAT 8827 60.825 9.742 92.737 1.00 0.00 H TER 24989 WAT 8827 ATOM 24989 O WAT 8828 127.052 143.570 132.059 1.00 0.00 O ATOM 24990 H1 WAT 8828 127.179 144.453 132.408 1.00 0.00 H ATOM 24991 H2 WAT 8828 127.866 143.377 131.594 1.00 0.00 H TER 24993 WAT 8828 ATOM 24993 O WAT 8829 19.142 73.829 61.806 1.00 0.00 O ATOM 24994 H1 WAT 8829 19.351 73.971 62.729 1.00 0.00 H ATOM 24995 H2 WAT 8829 19.237 74.692 61.403 1.00 0.00 H TER 24997 WAT 8829 ATOM 24997 O WAT 8830 136.142 28.877 94.344 1.00 0.00 O ATOM 24998 H1 WAT 8830 135.462 28.561 93.749 1.00 0.00 H ATOM 24999 H2 WAT 8830 136.899 28.321 94.158 1.00 0.00 H TER 25001 WAT 8830 ATOM 25001 O WAT 8831 33.755 52.959 76.147 1.00 0.00 O ATOM 25002 H1 WAT 8831 33.479 52.855 77.057 1.00 0.00 H ATOM 25003 H2 WAT 8831 34.054 52.087 75.887 1.00 0.00 H TER 25005 WAT 8831 ATOM 25005 O WAT 8832 53.980 5.090 158.493 1.00 0.00 O ATOM 25006 H1 WAT 8832 53.719 4.257 158.100 1.00 0.00 H ATOM 25007 H2 WAT 8832 54.740 4.872 159.032 1.00 0.00 H TER 25009 WAT 8832 ATOM 25009 O WAT 8833 9.517 97.780 110.522 1.00 0.00 O ATOM 25010 H1 WAT 8833 9.869 98.660 110.660 1.00 0.00 H ATOM 25011 H2 WAT 8833 8.755 97.913 109.958 1.00 0.00 H TER 25013 WAT 8833 ATOM 25013 O WAT 8834 145.330 61.431 155.942 1.00 0.00 O ATOM 25014 H1 WAT 8834 145.530 60.500 156.035 1.00 0.00 H ATOM 25015 H2 WAT 8834 144.379 61.482 156.036 1.00 0.00 H TER 25017 WAT 8834 ATOM 25017 O WAT 8835 47.905 83.112 99.202 1.00 0.00 O ATOM 25018 H1 WAT 8835 48.696 82.899 99.696 1.00 0.00 H ATOM 25019 H2 WAT 8835 47.875 82.457 98.504 1.00 0.00 H TER 25021 WAT 8835 ATOM 25021 O WAT 8836 130.203 58.661 82.735 1.00 0.00 O ATOM 25022 H1 WAT 8836 130.335 58.351 81.839 1.00 0.00 H ATOM 25023 H2 WAT 8836 130.507 59.569 82.722 1.00 0.00 H TER 25025 WAT 8836 ATOM 25025 O WAT 8837 76.584 108.124 67.760 1.00 0.00 O ATOM 25026 H1 WAT 8837 76.972 108.434 68.578 1.00 0.00 H ATOM 25027 H2 WAT 8837 75.646 108.073 67.944 1.00 0.00 H TER 25029 WAT 8837 ATOM 25029 O WAT 8838 57.549 142.413 149.813 1.00 0.00 O ATOM 25030 H1 WAT 8838 57.504 141.936 150.641 1.00 0.00 H ATOM 25031 H2 WAT 8838 58.291 142.021 149.351 1.00 0.00 H TER 25033 WAT 8838 ATOM 25033 O WAT 8839 135.510 22.226 3.594 1.00 0.00 O ATOM 25034 H1 WAT 8839 135.229 21.471 3.076 1.00 0.00 H ATOM 25035 H2 WAT 8839 135.642 21.875 4.475 1.00 0.00 H TER 25037 WAT 8839 ATOM 25037 O WAT 8840 9.125 6.769 119.394 1.00 0.00 O ATOM 25038 H1 WAT 8840 9.829 6.295 119.836 1.00 0.00 H ATOM 25039 H2 WAT 8840 9.321 7.692 119.553 1.00 0.00 H TER 25041 WAT 8840 ATOM 25041 O WAT 8841 16.107 18.849 152.160 1.00 0.00 O ATOM 25042 H1 WAT 8841 15.873 19.760 151.982 1.00 0.00 H ATOM 25043 H2 WAT 8841 15.463 18.558 152.805 1.00 0.00 H TER 25045 WAT 8841 ATOM 25045 O WAT 8842 54.906 36.516 113.517 1.00 0.00 O ATOM 25046 H1 WAT 8842 54.303 36.133 112.880 1.00 0.00 H ATOM 25047 H2 WAT 8842 54.337 36.876 114.198 1.00 0.00 H TER 25049 WAT 8842 ATOM 25049 O WAT 8843 95.920 132.264 84.003 1.00 0.00 O ATOM 25050 H1 WAT 8843 95.444 133.038 84.305 1.00 0.00 H ATOM 25051 H2 WAT 8843 95.243 131.691 83.644 1.00 0.00 H TER 25053 WAT 8843 ATOM 25053 O WAT 8844 97.840 42.419 153.851 1.00 0.00 O ATOM 25054 H1 WAT 8844 98.280 43.268 153.889 1.00 0.00 H ATOM 25055 H2 WAT 8844 97.699 42.265 152.917 1.00 0.00 H TER 25057 WAT 8844 ATOM 25057 O WAT 8845 68.266 142.120 96.244 1.00 0.00 O ATOM 25058 H1 WAT 8845 68.126 142.993 95.877 1.00 0.00 H ATOM 25059 H2 WAT 8845 67.385 141.764 96.357 1.00 0.00 H TER 25061 WAT 8845 ATOM 25061 O WAT 8846 76.073 72.638 9.291 1.00 0.00 O ATOM 25062 H1 WAT 8846 76.521 73.341 8.820 1.00 0.00 H ATOM 25063 H2 WAT 8846 76.753 72.247 9.840 1.00 0.00 H TER 25065 WAT 8846 ATOM 25065 O WAT 8847 119.164 80.379 148.982 1.00 0.00 O ATOM 25066 H1 WAT 8847 118.505 79.965 149.539 1.00 0.00 H ATOM 25067 H2 WAT 8847 118.670 80.998 148.444 1.00 0.00 H TER 25069 WAT 8847 ATOM 25069 O WAT 8848 0.445 120.246 100.157 1.00 0.00 O ATOM 25070 H1 WAT 8848 0.291 120.973 99.553 1.00 0.00 H ATOM 25071 H2 WAT 8848 -0.431 119.936 100.386 1.00 0.00 H TER 25073 WAT 8848 ATOM 25073 O WAT 8849 43.166 144.923 84.450 1.00 0.00 O ATOM 25074 H1 WAT 8849 43.029 145.585 83.773 1.00 0.00 H ATOM 25075 H2 WAT 8849 42.887 144.103 84.042 1.00 0.00 H TER 25077 WAT 8849 ATOM 25077 O WAT 8850 25.714 9.647 138.807 1.00 0.00 O ATOM 25078 H1 WAT 8850 24.909 9.738 138.298 1.00 0.00 H ATOM 25079 H2 WAT 8850 25.523 8.953 139.438 1.00 0.00 H TER 25081 WAT 8850 ATOM 25081 O WAT 8851 116.808 1.739 138.127 1.00 0.00 O ATOM 25082 H1 WAT 8851 117.101 0.828 138.127 1.00 0.00 H ATOM 25083 H2 WAT 8851 115.864 1.686 137.976 1.00 0.00 H TER 25085 WAT 8851 ATOM 25085 O WAT 8852 80.320 136.831 155.233 1.00 0.00 O ATOM 25086 H1 WAT 8852 80.829 136.410 154.541 1.00 0.00 H ATOM 25087 H2 WAT 8852 79.776 136.130 155.591 1.00 0.00 H TER 25089 WAT 8852 ATOM 25089 O WAT 8853 129.801 70.373 135.877 1.00 0.00 O ATOM 25090 H1 WAT 8853 129.570 70.567 134.968 1.00 0.00 H ATOM 25091 H2 WAT 8853 129.326 71.026 136.390 1.00 0.00 H TER 25093 WAT 8853 ATOM 25093 O WAT 8854 108.673 26.055 132.003 1.00 0.00 O ATOM 25094 H1 WAT 8854 108.288 25.187 131.885 1.00 0.00 H ATOM 25095 H2 WAT 8854 109.274 26.153 131.264 1.00 0.00 H TER 25097 WAT 8854 ATOM 25097 O WAT 8855 5.773 44.122 91.976 1.00 0.00 O ATOM 25098 H1 WAT 8855 5.417 43.244 92.110 1.00 0.00 H ATOM 25099 H2 WAT 8855 5.396 44.644 92.685 1.00 0.00 H TER 25101 WAT 8855 ATOM 25101 O WAT 8856 26.027 137.248 105.867 1.00 0.00 O ATOM 25102 H1 WAT 8856 25.677 137.107 106.747 1.00 0.00 H ATOM 25103 H2 WAT 8856 26.432 138.114 105.907 1.00 0.00 H TER 25105 WAT 8856 ATOM 25105 O WAT 8857 113.183 76.706 4.016 1.00 0.00 O ATOM 25106 H1 WAT 8857 113.783 76.636 4.758 1.00 0.00 H ATOM 25107 H2 WAT 8857 113.168 75.827 3.637 1.00 0.00 H TER 25109 WAT 8857 ATOM 25109 O WAT 8858 55.332 127.865 146.600 1.00 0.00 O ATOM 25110 H1 WAT 8858 55.505 128.063 147.520 1.00 0.00 H ATOM 25111 H2 WAT 8858 56.098 127.366 146.314 1.00 0.00 H TER 25113 WAT 8858 ATOM 25113 O WAT 8859 88.409 81.205 83.006 1.00 0.00 O ATOM 25114 H1 WAT 8859 87.889 81.587 83.713 1.00 0.00 H ATOM 25115 H2 WAT 8859 89.225 81.706 83.012 1.00 0.00 H TER 25117 WAT 8859 ATOM 25117 O WAT 8860 42.692 48.882 90.361 1.00 0.00 O ATOM 25118 H1 WAT 8860 43.006 48.439 91.149 1.00 0.00 H ATOM 25119 H2 WAT 8860 42.907 48.282 89.647 1.00 0.00 H TER 25121 WAT 8860 ATOM 25121 O WAT 8861 37.549 103.396 75.303 1.00 0.00 O ATOM 25122 H1 WAT 8861 37.824 104.017 75.977 1.00 0.00 H ATOM 25123 H2 WAT 8861 36.595 103.375 75.370 1.00 0.00 H TER 25125 WAT 8861 ATOM 25125 O WAT 8862 11.561 117.603 127.444 1.00 0.00 O ATOM 25126 H1 WAT 8862 11.260 118.310 126.873 1.00 0.00 H ATOM 25127 H2 WAT 8862 11.229 117.838 128.311 1.00 0.00 H TER 25129 WAT 8862 ATOM 25129 O WAT 8863 67.703 83.450 61.283 1.00 0.00 O ATOM 25130 H1 WAT 8863 67.030 83.694 61.918 1.00 0.00 H ATOM 25131 H2 WAT 8863 67.390 83.811 60.453 1.00 0.00 H TER 25133 WAT 8863 ATOM 25133 O WAT 8864 88.442 126.162 97.517 1.00 0.00 O ATOM 25134 H1 WAT 8864 87.871 126.730 97.000 1.00 0.00 H ATOM 25135 H2 WAT 8864 88.822 125.559 96.877 1.00 0.00 H TER 25137 WAT 8864 ATOM 25137 O WAT 8865 144.920 14.755 82.131 1.00 0.00 O ATOM 25138 H1 WAT 8865 144.006 14.928 82.359 1.00 0.00 H ATOM 25139 H2 WAT 8865 145.343 15.613 82.172 1.00 0.00 H TER 25141 WAT 8865 ATOM 25141 O WAT 8866 24.741 32.401 100.878 1.00 0.00 O ATOM 25142 H1 WAT 8866 24.846 33.348 100.974 1.00 0.00 H ATOM 25143 H2 WAT 8866 23.993 32.302 100.289 1.00 0.00 H TER 25145 WAT 8866 ATOM 25145 O WAT 8867 106.380 138.060 105.714 1.00 0.00 O ATOM 25146 H1 WAT 8867 105.660 137.504 105.418 1.00 0.00 H ATOM 25147 H2 WAT 8867 106.375 137.972 106.667 1.00 0.00 H TER 25149 WAT 8867 ATOM 25149 O WAT 8868 36.575 87.927 77.669 1.00 0.00 O ATOM 25150 H1 WAT 8868 36.745 87.670 76.763 1.00 0.00 H ATOM 25151 H2 WAT 8868 35.869 88.570 77.607 1.00 0.00 H TER 25153 WAT 8868 ATOM 25153 O WAT 8869 82.552 113.345 66.343 1.00 0.00 O ATOM 25154 H1 WAT 8869 82.086 113.996 65.819 1.00 0.00 H ATOM 25155 H2 WAT 8869 83.472 113.601 66.281 1.00 0.00 H TER 25157 WAT 8869 ATOM 25157 O WAT 8870 82.723 112.237 13.267 1.00 0.00 O ATOM 25158 H1 WAT 8870 83.540 111.787 13.053 1.00 0.00 H ATOM 25159 H2 WAT 8870 82.873 112.604 14.138 1.00 0.00 H TER 25161 WAT 8870 ATOM 25161 O WAT 8871 21.931 79.862 16.237 1.00 0.00 O ATOM 25162 H1 WAT 8871 21.345 80.613 16.153 1.00 0.00 H ATOM 25163 H2 WAT 8871 21.346 79.115 16.364 1.00 0.00 H TER 25165 WAT 8871 ATOM 25165 O WAT 8872 51.963 25.555 102.538 1.00 0.00 O ATOM 25166 H1 WAT 8872 51.915 26.357 102.018 1.00 0.00 H ATOM 25167 H2 WAT 8872 51.062 25.400 102.822 1.00 0.00 H TER 25169 WAT 8872 ATOM 25169 O WAT 8873 83.162 144.377 64.133 1.00 0.00 O ATOM 25170 H1 WAT 8873 83.813 144.525 64.818 1.00 0.00 H ATOM 25171 H2 WAT 8873 82.767 143.534 64.356 1.00 0.00 H TER 25173 WAT 8873 ATOM 25173 O WAT 8874 7.811 93.535 26.780 1.00 0.00 O ATOM 25174 H1 WAT 8874 7.459 92.741 27.182 1.00 0.00 H ATOM 25175 H2 WAT 8874 7.235 94.235 27.090 1.00 0.00 H TER 25177 WAT 8874 ATOM 25177 O WAT 8875 130.495 63.627 3.789 1.00 0.00 O ATOM 25178 H1 WAT 8875 130.673 63.524 4.724 1.00 0.00 H ATOM 25179 H2 WAT 8875 131.323 63.935 3.421 1.00 0.00 H TER 25181 WAT 8875 ATOM 25181 O WAT 8876 115.512 5.317 16.133 1.00 0.00 O ATOM 25182 H1 WAT 8876 116.171 5.483 15.459 1.00 0.00 H ATOM 25183 H2 WAT 8876 115.615 4.389 16.346 1.00 0.00 H TER 25185 WAT 8876 ATOM 25185 O WAT 8877 29.836 9.095 60.219 1.00 0.00 O ATOM 25186 H1 WAT 8877 30.470 9.711 60.586 1.00 0.00 H ATOM 25187 H2 WAT 8877 29.059 9.195 60.769 1.00 0.00 H TER 25189 WAT 8877 ATOM 25189 O WAT 8878 107.285 19.688 120.195 1.00 0.00 O ATOM 25190 H1 WAT 8878 107.540 20.231 120.941 1.00 0.00 H ATOM 25191 H2 WAT 8878 106.337 19.589 120.284 1.00 0.00 H TER 25193 WAT 8878 ATOM 25193 O WAT 8879 30.948 6.839 3.726 1.00 0.00 O ATOM 25194 H1 WAT 8879 31.315 6.686 2.855 1.00 0.00 H ATOM 25195 H2 WAT 8879 31.060 6.005 4.182 1.00 0.00 H TER 25197 WAT 8879 ATOM 25197 O WAT 8880 2.196 100.240 17.352 1.00 0.00 O ATOM 25198 H1 WAT 8880 2.889 100.900 17.348 1.00 0.00 H ATOM 25199 H2 WAT 8880 1.947 100.149 16.432 1.00 0.00 H TER 25201 WAT 8880 ATOM 25201 O WAT 8881 37.688 20.648 109.147 1.00 0.00 O ATOM 25202 H1 WAT 8881 37.786 20.115 108.358 1.00 0.00 H ATOM 25203 H2 WAT 8881 37.110 20.135 109.712 1.00 0.00 H TER 25205 WAT 8881 ATOM 25205 O WAT 8882 1.196 21.925 114.005 1.00 0.00 O ATOM 25206 H1 WAT 8882 1.137 22.276 114.894 1.00 0.00 H ATOM 25207 H2 WAT 8882 0.917 21.013 114.088 1.00 0.00 H TER 25209 WAT 8882 ATOM 25209 O WAT 8883 89.892 72.276 67.477 1.00 0.00 O ATOM 25210 H1 WAT 8883 90.781 72.587 67.649 1.00 0.00 H ATOM 25211 H2 WAT 8883 89.448 72.341 68.323 1.00 0.00 H TER 25213 WAT 8883 ATOM 25213 O WAT 8884 91.073 49.587 138.515 1.00 0.00 O ATOM 25214 H1 WAT 8884 91.237 50.335 137.940 1.00 0.00 H ATOM 25215 H2 WAT 8884 90.355 49.872 139.079 1.00 0.00 H TER 25217 WAT 8884 ATOM 25217 O WAT 8885 105.663 1.520 153.389 1.00 0.00 O ATOM 25218 H1 WAT 8885 105.145 2.325 153.412 1.00 0.00 H ATOM 25219 H2 WAT 8885 105.012 0.817 153.392 1.00 0.00 H TER 25221 WAT 8885 ATOM 25221 O WAT 8886 72.935 112.402 106.993 1.00 0.00 O ATOM 25222 H1 WAT 8886 73.611 112.698 107.603 1.00 0.00 H ATOM 25223 H2 WAT 8886 73.291 111.599 106.612 1.00 0.00 H TER 25225 WAT 8886 ATOM 25225 O WAT 8887 112.416 11.866 122.899 1.00 0.00 O ATOM 25226 H1 WAT 8887 113.370 11.952 122.905 1.00 0.00 H ATOM 25227 H2 WAT 8887 112.261 10.936 122.733 1.00 0.00 H TER 25229 WAT 8887 ATOM 25229 O WAT 8888 2.720 115.649 154.891 1.00 0.00 O ATOM 25230 H1 WAT 8888 2.870 115.111 154.113 1.00 0.00 H ATOM 25231 H2 WAT 8888 2.238 115.077 155.488 1.00 0.00 H TER 25233 WAT 8888 ATOM 25233 O WAT 8889 1.765 35.240 96.777 1.00 0.00 O ATOM 25234 H1 WAT 8889 2.364 34.664 96.302 1.00 0.00 H ATOM 25235 H2 WAT 8889 2.321 35.696 97.408 1.00 0.00 H TER 25237 WAT 8889 ATOM 25237 O WAT 8890 142.844 63.788 120.656 1.00 0.00 O ATOM 25238 H1 WAT 8890 142.175 63.103 120.644 1.00 0.00 H ATOM 25239 H2 WAT 8890 142.352 64.604 120.565 1.00 0.00 H TER 25241 WAT 8890 ATOM 25241 O WAT 8891 115.685 70.918 107.549 1.00 0.00 O ATOM 25242 H1 WAT 8891 115.648 71.676 106.965 1.00 0.00 H ATOM 25243 H2 WAT 8891 116.596 70.884 107.839 1.00 0.00 H TER 25245 WAT 8891 ATOM 25245 O WAT 8892 9.014 74.241 135.170 1.00 0.00 O ATOM 25246 H1 WAT 8892 8.487 74.653 134.485 1.00 0.00 H ATOM 25247 H2 WAT 8892 8.399 74.092 135.888 1.00 0.00 H TER 25249 WAT 8892 ATOM 25249 O WAT 8893 63.356 91.197 5.747 1.00 0.00 O ATOM 25250 H1 WAT 8893 62.975 90.346 5.967 1.00 0.00 H ATOM 25251 H2 WAT 8893 63.024 91.388 4.870 1.00 0.00 H TER 25253 WAT 8893 ATOM 25253 O WAT 8894 89.541 105.413 85.704 1.00 0.00 O ATOM 25254 H1 WAT 8894 90.327 104.928 85.451 1.00 0.00 H ATOM 25255 H2 WAT 8894 89.867 106.267 85.986 1.00 0.00 H TER 25257 WAT 8894 ATOM 25257 O WAT 8895 94.769 76.670 14.402 1.00 0.00 O ATOM 25258 H1 WAT 8895 94.911 77.350 13.744 1.00 0.00 H ATOM 25259 H2 WAT 8895 94.474 77.145 15.179 1.00 0.00 H TER 25261 WAT 8895 ATOM 25261 O WAT 8896 83.813 95.816 9.034 1.00 0.00 O ATOM 25262 H1 WAT 8896 83.345 96.466 8.509 1.00 0.00 H ATOM 25263 H2 WAT 8896 83.393 95.855 9.893 1.00 0.00 H TER 25265 WAT 8896 ATOM 25265 O WAT 8897 17.837 48.177 124.349 1.00 0.00 O ATOM 25266 H1 WAT 8897 17.975 49.120 124.442 1.00 0.00 H ATOM 25267 H2 WAT 8897 17.009 48.010 124.799 1.00 0.00 H TER 25269 WAT 8897 ATOM 25269 O WAT 8898 19.920 119.799 0.196 1.00 0.00 O ATOM 25270 H1 WAT 8898 20.689 119.608 -0.342 1.00 0.00 H ATOM 25271 H2 WAT 8898 19.917 119.111 0.862 1.00 0.00 H TER 25273 WAT 8898 ATOM 25273 O WAT 8899 80.341 77.285 19.218 1.00 0.00 O ATOM 25274 H1 WAT 8899 80.471 77.446 20.153 1.00 0.00 H ATOM 25275 H2 WAT 8899 79.650 77.897 18.964 1.00 0.00 H TER 25277 WAT 8899 ATOM 25277 O WAT 8900 100.012 73.917 120.538 1.00 0.00 O ATOM 25278 H1 WAT 8900 99.091 73.715 120.703 1.00 0.00 H ATOM 25279 H2 WAT 8900 100.183 73.561 119.666 1.00 0.00 H TER 25281 WAT 8900 ATOM 25281 O WAT 8901 44.338 119.316 60.117 1.00 0.00 O ATOM 25282 H1 WAT 8901 44.929 118.791 59.577 1.00 0.00 H ATOM 25283 H2 WAT 8901 43.467 119.132 59.767 1.00 0.00 H TER 25285 WAT 8901 ATOM 25285 O WAT 8902 115.162 11.131 70.853 1.00 0.00 O ATOM 25286 H1 WAT 8902 115.092 10.229 70.542 1.00 0.00 H ATOM 25287 H2 WAT 8902 114.271 11.475 70.794 1.00 0.00 H TER 25289 WAT 8902 ATOM 25289 O WAT 8903 23.063 126.612 9.469 1.00 0.00 O ATOM 25290 H1 WAT 8903 23.238 127.120 10.261 1.00 0.00 H ATOM 25291 H2 WAT 8903 23.929 126.361 9.149 1.00 0.00 H TER 25293 WAT 8903 ATOM 25293 O WAT 8904 34.727 47.783 92.001 1.00 0.00 O ATOM 25294 H1 WAT 8904 35.408 48.351 92.361 1.00 0.00 H ATOM 25295 H2 WAT 8904 34.356 48.284 91.275 1.00 0.00 H TER 25297 WAT 8904 ATOM 25297 O WAT 8905 64.113 132.021 105.894 1.00 0.00 O ATOM 25298 H1 WAT 8905 63.283 132.218 105.460 1.00 0.00 H ATOM 25299 H2 WAT 8905 64.036 132.433 106.755 1.00 0.00 H TER 25301 WAT 8905 ATOM 25301 O WAT 8906 28.463 139.682 78.180 1.00 0.00 O ATOM 25302 H1 WAT 8906 29.165 139.120 77.852 1.00 0.00 H ATOM 25303 H2 WAT 8906 27.664 139.175 78.037 1.00 0.00 H TER 25305 WAT 8906 ATOM 25305 O WAT 8907 109.937 96.733 81.942 1.00 0.00 O ATOM 25306 H1 WAT 8907 109.749 96.736 82.880 1.00 0.00 H ATOM 25307 H2 WAT 8907 109.150 96.365 81.541 1.00 0.00 H TER 25309 WAT 8907 ATOM 25309 O WAT 8908 13.052 136.672 103.298 1.00 0.00 O ATOM 25310 H1 WAT 8908 12.552 137.455 103.527 1.00 0.00 H ATOM 25311 H2 WAT 8908 12.421 136.106 102.855 1.00 0.00 H TER 25313 WAT 8908 ATOM 25313 O WAT 8909 19.421 12.829 9.394 1.00 0.00 O ATOM 25314 H1 WAT 8909 19.081 12.408 10.183 1.00 0.00 H ATOM 25315 H2 WAT 8909 18.754 13.474 9.160 1.00 0.00 H TER 25317 WAT 8909 ATOM 25317 O WAT 8910 68.120 114.771 134.648 1.00 0.00 O ATOM 25318 H1 WAT 8910 67.936 114.044 135.244 1.00 0.00 H ATOM 25319 H2 WAT 8910 68.758 115.309 135.116 1.00 0.00 H TER 25321 WAT 8910 ATOM 25321 O WAT 8911 37.699 100.131 136.233 1.00 0.00 O ATOM 25322 H1 WAT 8911 36.942 100.715 136.187 1.00 0.00 H ATOM 25323 H2 WAT 8911 38.447 100.718 136.341 1.00 0.00 H TER 25325 WAT 8911 ATOM 25325 O WAT 8912 84.553 140.209 71.446 1.00 0.00 O ATOM 25326 H1 WAT 8912 84.206 140.548 72.272 1.00 0.00 H ATOM 25327 H2 WAT 8912 84.406 140.915 70.817 1.00 0.00 H TER 25329 WAT 8912 ATOM 25329 O WAT 8913 67.512 79.043 70.203 1.00 0.00 O ATOM 25330 H1 WAT 8913 67.889 78.163 70.207 1.00 0.00 H ATOM 25331 H2 WAT 8913 66.944 79.064 70.973 1.00 0.00 H TER 25333 WAT 8913 ATOM 25333 O WAT 8914 117.625 109.382 150.796 1.00 0.00 O ATOM 25334 H1 WAT 8914 117.004 108.710 150.514 1.00 0.00 H ATOM 25335 H2 WAT 8914 118.268 108.908 151.323 1.00 0.00 H TER 25337 WAT 8914 ATOM 25337 O WAT 8915 40.025 120.216 105.745 1.00 0.00 O ATOM 25338 H1 WAT 8915 40.188 120.920 105.117 1.00 0.00 H ATOM 25339 H2 WAT 8915 39.341 119.685 105.337 1.00 0.00 H TER 25341 WAT 8915 ATOM 25341 O WAT 8916 53.299 36.940 19.221 1.00 0.00 O ATOM 25342 H1 WAT 8916 52.546 37.299 19.691 1.00 0.00 H ATOM 25343 H2 WAT 8916 53.936 36.739 19.906 1.00 0.00 H TER 25345 WAT 8916 ATOM 25345 O WAT 8917 14.331 0.711 11.253 1.00 0.00 O ATOM 25346 H1 WAT 8917 14.816 0.335 10.519 1.00 0.00 H ATOM 25347 H2 WAT 8917 14.599 0.190 12.010 1.00 0.00 H TER 25349 WAT 8917 ATOM 25349 O WAT 8918 65.617 10.248 13.552 1.00 0.00 O ATOM 25350 H1 WAT 8918 65.351 9.806 12.745 1.00 0.00 H ATOM 25351 H2 WAT 8918 65.015 10.988 13.629 1.00 0.00 H TER 25353 WAT 8918 ATOM 25353 O WAT 8919 35.706 82.673 108.338 1.00 0.00 O ATOM 25354 H1 WAT 8919 34.848 82.568 108.750 1.00 0.00 H ATOM 25355 H2 WAT 8919 35.509 82.864 107.421 1.00 0.00 H TER 25357 WAT 8919 ATOM 25357 O WAT 8920 120.188 95.112 118.898 1.00 0.00 O ATOM 25358 H1 WAT 8920 119.490 95.709 118.630 1.00 0.00 H ATOM 25359 H2 WAT 8920 120.294 95.272 119.836 1.00 0.00 H TER 25361 WAT 8920 ATOM 25361 O WAT 8921 136.477 5.668 13.740 1.00 0.00 O ATOM 25362 H1 WAT 8921 137.421 5.808 13.667 1.00 0.00 H ATOM 25363 H2 WAT 8921 136.391 4.924 14.337 1.00 0.00 H TER 25365 WAT 8921 ATOM 25365 O WAT 8922 85.467 35.408 24.686 1.00 0.00 O ATOM 25366 H1 WAT 8922 84.817 35.787 24.094 1.00 0.00 H ATOM 25367 H2 WAT 8922 85.095 35.534 25.560 1.00 0.00 H TER 25369 WAT 8922 ATOM 25369 O WAT 8923 83.509 108.146 155.553 1.00 0.00 O ATOM 25370 H1 WAT 8923 83.088 108.767 156.149 1.00 0.00 H ATOM 25371 H2 WAT 8923 82.799 107.571 155.266 1.00 0.00 H TER 25373 WAT 8923 ATOM 25373 O WAT 8924 96.607 113.686 74.996 1.00 0.00 O ATOM 25374 H1 WAT 8924 95.744 113.317 74.806 1.00 0.00 H ATOM 25375 H2 WAT 8924 96.866 113.280 75.823 1.00 0.00 H TER 25377 WAT 8924 ATOM 25377 O WAT 8925 22.008 12.063 126.065 1.00 0.00 O ATOM 25378 H1 WAT 8925 22.025 13.015 125.967 1.00 0.00 H ATOM 25379 H2 WAT 8925 21.518 11.914 126.874 1.00 0.00 H TER 25381 WAT 8925 ATOM 25381 O WAT 8926 44.914 82.310 147.848 1.00 0.00 O ATOM 25382 H1 WAT 8926 44.117 81.867 147.557 1.00 0.00 H ATOM 25383 H2 WAT 8926 45.416 82.453 147.046 1.00 0.00 H TER 25385 WAT 8926 ATOM 25385 O WAT 8927 46.821 134.346 126.786 1.00 0.00 O ATOM 25386 H1 WAT 8927 47.301 133.670 126.307 1.00 0.00 H ATOM 25387 H2 WAT 8927 46.655 133.958 127.645 1.00 0.00 H TER 25389 WAT 8927 ATOM 25389 O WAT 8928 80.337 141.576 154.670 1.00 0.00 O ATOM 25390 H1 WAT 8928 79.414 141.785 154.527 1.00 0.00 H ATOM 25391 H2 WAT 8928 80.749 142.420 154.851 1.00 0.00 H TER 25393 WAT 8928 ATOM 25393 O WAT 8929 110.071 94.872 124.128 1.00 0.00 O ATOM 25394 H1 WAT 8929 110.912 94.932 123.675 1.00 0.00 H ATOM 25395 H2 WAT 8929 110.121 94.053 124.620 1.00 0.00 H TER 25397 WAT 8929 ATOM 25397 O WAT 8930 126.147 24.920 142.201 1.00 0.00 O ATOM 25398 H1 WAT 8930 126.940 25.434 142.351 1.00 0.00 H ATOM 25399 H2 WAT 8930 125.960 24.516 143.048 1.00 0.00 H TER 25401 WAT 8930 ATOM 25401 O WAT 8931 25.338 26.595 3.027 1.00 0.00 O ATOM 25402 H1 WAT 8931 24.677 26.028 2.629 1.00 0.00 H ATOM 25403 H2 WAT 8931 24.862 27.392 3.259 1.00 0.00 H TER 25405 WAT 8931 ATOM 25405 O WAT 8932 0.422 86.036 59.043 1.00 0.00 O ATOM 25406 H1 WAT 8932 -0.135 86.081 58.266 1.00 0.00 H ATOM 25407 H2 WAT 8932 0.798 86.913 59.119 1.00 0.00 H TER 25409 WAT 8932 ATOM 25409 O WAT 8933 140.497 28.557 66.998 1.00 0.00 O ATOM 25410 H1 WAT 8933 141.130 28.034 67.491 1.00 0.00 H ATOM 25411 H2 WAT 8933 141.010 29.286 66.648 1.00 0.00 H TER 25413 WAT 8933 ATOM 25413 O WAT 8934 81.888 42.733 148.907 1.00 0.00 O ATOM 25414 H1 WAT 8934 81.624 42.922 148.006 1.00 0.00 H ATOM 25415 H2 WAT 8934 81.611 41.829 149.053 1.00 0.00 H TER 25417 WAT 8934 ATOM 25417 O WAT 8935 140.850 113.377 131.943 1.00 0.00 O ATOM 25418 H1 WAT 8935 140.312 112.585 131.932 1.00 0.00 H ATOM 25419 H2 WAT 8935 140.405 113.977 131.345 1.00 0.00 H TER 25421 WAT 8935 ATOM 25421 O WAT 8936 87.238 3.491 139.948 1.00 0.00 O ATOM 25422 H1 WAT 8936 86.753 3.348 139.135 1.00 0.00 H ATOM 25423 H2 WAT 8936 87.496 2.614 140.231 1.00 0.00 H TER 25425 WAT 8936 ATOM 25425 O WAT 8937 31.349 137.804 135.690 1.00 0.00 O ATOM 25426 H1 WAT 8937 31.702 138.284 136.439 1.00 0.00 H ATOM 25427 H2 WAT 8937 31.288 138.458 134.993 1.00 0.00 H TER 25429 WAT 8937 ATOM 25429 O WAT 8938 37.062 120.124 137.221 1.00 0.00 O ATOM 25430 H1 WAT 8938 37.183 119.890 136.301 1.00 0.00 H ATOM 25431 H2 WAT 8938 37.558 119.463 137.703 1.00 0.00 H TER 25433 WAT 8938 ATOM 25433 O WAT 8939 92.511 42.557 111.545 1.00 0.00 O ATOM 25434 H1 WAT 8939 92.883 42.042 110.828 1.00 0.00 H ATOM 25435 H2 WAT 8939 91.596 42.279 111.588 1.00 0.00 H TER 25437 WAT 8939 ATOM 25437 O WAT 8940 36.777 96.525 1.056 1.00 0.00 O ATOM 25438 H1 WAT 8940 37.724 96.656 1.103 1.00 0.00 H ATOM 25439 H2 WAT 8940 36.526 96.265 1.942 1.00 0.00 H TER 25441 WAT 8940 ATOM 25441 O WAT 8941 5.451 45.220 99.179 1.00 0.00 O ATOM 25442 H1 WAT 8941 4.653 44.763 98.914 1.00 0.00 H ATOM 25443 H2 WAT 8941 6.162 44.673 98.847 1.00 0.00 H TER 25445 WAT 8941 ATOM 25445 O WAT 8942 47.184 140.884 113.109 1.00 0.00 O ATOM 25446 H1 WAT 8942 46.913 141.697 112.681 1.00 0.00 H ATOM 25447 H2 WAT 8942 48.110 141.017 113.311 1.00 0.00 H TER 25449 WAT 8942 ATOM 25449 O WAT 8943 35.491 128.004 59.804 1.00 0.00 O ATOM 25450 H1 WAT 8943 34.700 127.501 59.608 1.00 0.00 H ATOM 25451 H2 WAT 8943 35.828 127.614 60.611 1.00 0.00 H TER 25453 WAT 8943 ATOM 25453 O WAT 8944 104.934 33.848 143.577 1.00 0.00 O ATOM 25454 H1 WAT 8944 105.764 33.602 143.985 1.00 0.00 H ATOM 25455 H2 WAT 8944 104.553 33.019 143.288 1.00 0.00 H TER 25457 WAT 8944 ATOM 25457 O WAT 8945 143.984 73.829 16.729 1.00 0.00 O ATOM 25458 H1 WAT 8945 143.156 74.206 17.027 1.00 0.00 H ATOM 25459 H2 WAT 8945 144.579 73.942 17.470 1.00 0.00 H TER 25461 WAT 8945 ATOM 25461 O WAT 8946 31.281 19.386 143.484 1.00 0.00 O ATOM 25462 H1 WAT 8946 31.492 18.923 142.673 1.00 0.00 H ATOM 25463 H2 WAT 8946 30.333 19.287 143.576 1.00 0.00 H TER 25465 WAT 8946 ATOM 25465 O WAT 8947 98.511 51.573 77.470 1.00 0.00 O ATOM 25466 H1 WAT 8947 98.652 50.893 76.811 1.00 0.00 H ATOM 25467 H2 WAT 8947 98.925 52.354 77.101 1.00 0.00 H TER 25469 WAT 8947 ATOM 25469 O WAT 8948 130.300 127.916 106.778 1.00 0.00 O ATOM 25470 H1 WAT 8948 131.252 127.973 106.696 1.00 0.00 H ATOM 25471 H2 WAT 8948 129.977 128.024 105.883 1.00 0.00 H TER 25473 WAT 8948 ATOM 25473 O WAT 8949 21.805 96.985 141.622 1.00 0.00 O ATOM 25474 H1 WAT 8949 22.259 97.801 141.412 1.00 0.00 H ATOM 25475 H2 WAT 8949 22.370 96.556 142.265 1.00 0.00 H TER 25477 WAT 8949 ATOM 25477 O WAT 8950 53.011 70.749 80.708 1.00 0.00 O ATOM 25478 H1 WAT 8950 52.444 71.098 81.396 1.00 0.00 H ATOM 25479 H2 WAT 8950 52.522 70.894 79.898 1.00 0.00 H TER 25481 WAT 8950 ATOM 25481 O WAT 8951 115.907 130.304 157.757 1.00 0.00 O ATOM 25482 H1 WAT 8951 115.465 129.666 157.196 1.00 0.00 H ATOM 25483 H2 WAT 8951 116.370 129.773 158.404 1.00 0.00 H TER 25485 WAT 8951 ATOM 25485 O WAT 8952 21.329 49.300 126.242 1.00 0.00 O ATOM 25486 H1 WAT 8952 21.334 49.062 125.315 1.00 0.00 H ATOM 25487 H2 WAT 8952 22.218 49.109 126.543 1.00 0.00 H TER 25489 WAT 8952 ATOM 25489 O WAT 8953 128.648 50.259 61.833 1.00 0.00 O ATOM 25490 H1 WAT 8953 128.850 51.123 61.474 1.00 0.00 H ATOM 25491 H2 WAT 8953 128.217 49.796 61.114 1.00 0.00 H TER 25493 WAT 8953 ATOM 25493 O WAT 8954 93.025 26.607 20.366 1.00 0.00 O ATOM 25494 H1 WAT 8954 93.625 27.306 20.627 1.00 0.00 H ATOM 25495 H2 WAT 8954 92.318 27.058 19.905 1.00 0.00 H TER 25497 WAT 8954 ATOM 25497 O WAT 8955 80.391 49.929 8.570 1.00 0.00 O ATOM 25498 H1 WAT 8955 80.452 50.276 7.680 1.00 0.00 H ATOM 25499 H2 WAT 8955 80.639 50.664 9.131 1.00 0.00 H TER 25501 WAT 8955 ATOM 25501 O WAT 8956 21.906 32.523 83.057 1.00 0.00 O ATOM 25502 H1 WAT 8956 21.027 32.154 82.974 1.00 0.00 H ATOM 25503 H2 WAT 8956 21.892 33.301 82.500 1.00 0.00 H TER 25505 WAT 8956 ATOM 25505 O WAT 8957 109.229 80.464 99.450 1.00 0.00 O ATOM 25506 H1 WAT 8957 108.841 81.229 99.027 1.00 0.00 H ATOM 25507 H2 WAT 8957 108.489 79.880 99.615 1.00 0.00 H TER 25509 WAT 8957 ATOM 25509 O WAT 8958 134.846 65.924 89.526 1.00 0.00 O ATOM 25510 H1 WAT 8958 135.001 66.352 90.369 1.00 0.00 H ATOM 25511 H2 WAT 8958 134.893 66.634 88.885 1.00 0.00 H TER 25513 WAT 8958 ATOM 25513 O WAT 8959 7.899 77.578 143.398 1.00 0.00 O ATOM 25514 H1 WAT 8959 7.933 76.836 142.794 1.00 0.00 H ATOM 25515 H2 WAT 8959 8.012 77.187 144.264 1.00 0.00 H TER 25517 WAT 8959 ATOM 25517 O WAT 8960 54.952 123.674 57.203 1.00 0.00 O ATOM 25518 H1 WAT 8960 55.580 123.101 57.644 1.00 0.00 H ATOM 25519 H2 WAT 8960 55.354 124.542 57.238 1.00 0.00 H TER 25521 WAT 8960 ATOM 25521 O WAT 8961 93.066 91.541 92.568 1.00 0.00 O ATOM 25522 H1 WAT 8961 92.957 90.659 92.924 1.00 0.00 H ATOM 25523 H2 WAT 8961 92.809 91.461 91.649 1.00 0.00 H TER 25525 WAT 8961 ATOM 25525 O WAT 8962 59.944 24.882 112.776 1.00 0.00 O ATOM 25526 H1 WAT 8962 59.210 25.482 112.642 1.00 0.00 H ATOM 25527 H2 WAT 8962 60.291 25.117 113.636 1.00 0.00 H TER 25529 WAT 8962 ATOM 25529 O WAT 8963 4.638 34.621 89.384 1.00 0.00 O ATOM 25530 H1 WAT 8963 4.784 35.566 89.430 1.00 0.00 H ATOM 25531 H2 WAT 8963 3.738 34.533 89.068 1.00 0.00 H TER 25533 WAT 8963 ATOM 25533 O WAT 8964 95.524 88.531 130.063 1.00 0.00 O ATOM 25534 H1 WAT 8964 94.870 88.586 129.366 1.00 0.00 H ATOM 25535 H2 WAT 8964 95.401 89.332 130.571 1.00 0.00 H TER 25537 WAT 8964 ATOM 25537 O WAT 8965 89.109 0.152 0.765 1.00 0.00 O ATOM 25538 H1 WAT 8965 88.986 -0.732 1.111 1.00 0.00 H ATOM 25539 H2 WAT 8965 88.708 0.723 1.420 1.00 0.00 H TER 25541 WAT 8965 ATOM 25541 O WAT 8966 134.944 104.287 21.172 1.00 0.00 O ATOM 25542 H1 WAT 8966 134.138 103.821 21.394 1.00 0.00 H ATOM 25543 H2 WAT 8966 135.175 104.760 21.971 1.00 0.00 H TER 25545 WAT 8966 ATOM 25545 O WAT 8967 72.746 136.449 109.430 1.00 0.00 O ATOM 25546 H1 WAT 8967 73.094 135.563 109.332 1.00 0.00 H ATOM 25547 H2 WAT 8967 73.207 136.806 110.188 1.00 0.00 H TER 25549 WAT 8967 ATOM 25549 O WAT 8968 101.809 39.400 90.641 1.00 0.00 O ATOM 25550 H1 WAT 8968 100.941 39.615 90.982 1.00 0.00 H ATOM 25551 H2 WAT 8968 101.892 39.927 89.847 1.00 0.00 H TER 25553 WAT 8968 ATOM 25553 O WAT 8969 97.781 81.139 127.661 1.00 0.00 O ATOM 25554 H1 WAT 8969 97.476 81.842 127.087 1.00 0.00 H ATOM 25555 H2 WAT 8969 98.336 81.579 128.305 1.00 0.00 H TER 25557 WAT 8969 ATOM 25557 O WAT 8970 116.832 12.335 131.675 1.00 0.00 O ATOM 25558 H1 WAT 8970 117.104 11.568 131.171 1.00 0.00 H ATOM 25559 H2 WAT 8970 116.458 12.929 131.023 1.00 0.00 H TER 25561 WAT 8970 ATOM 25561 O WAT 8971 17.534 119.509 8.864 1.00 0.00 O ATOM 25562 H1 WAT 8971 16.699 119.049 8.785 1.00 0.00 H ATOM 25563 H2 WAT 8971 17.502 119.916 9.730 1.00 0.00 H TER 25565 WAT 8971 ATOM 25565 O WAT 8972 75.895 3.257 73.670 1.00 0.00 O ATOM 25566 H1 WAT 8972 76.235 3.807 74.376 1.00 0.00 H ATOM 25567 H2 WAT 8972 76.636 3.144 73.076 1.00 0.00 H TER 25569 WAT 8972 ATOM 25569 O WAT 8973 130.454 36.041 158.256 1.00 0.00 O ATOM 25570 H1 WAT 8973 131.025 36.365 158.952 1.00 0.00 H ATOM 25571 H2 WAT 8973 130.488 36.719 157.582 1.00 0.00 H TER 25573 WAT 8973 ATOM 25573 O WAT 8974 41.358 19.461 146.910 1.00 0.00 O ATOM 25574 H1 WAT 8974 41.958 18.726 146.783 1.00 0.00 H ATOM 25575 H2 WAT 8974 41.371 19.927 146.074 1.00 0.00 H TER 25577 WAT 8974 ATOM 25577 O WAT 8975 50.033 44.077 122.288 1.00 0.00 O ATOM 25578 H1 WAT 8975 49.983 44.227 121.344 1.00 0.00 H ATOM 25579 H2 WAT 8975 49.284 44.554 122.647 1.00 0.00 H TER 25581 WAT 8975 ATOM 25581 O WAT 8976 6.955 13.255 79.686 1.00 0.00 O ATOM 25582 H1 WAT 8976 7.246 14.159 79.809 1.00 0.00 H ATOM 25583 H2 WAT 8976 7.761 12.739 79.708 1.00 0.00 H TER 25585 WAT 8976 ATOM 25585 O WAT 8977 125.331 83.652 114.351 1.00 0.00 O ATOM 25586 H1 WAT 8977 124.580 84.164 114.651 1.00 0.00 H ATOM 25587 H2 WAT 8977 125.966 83.719 115.065 1.00 0.00 H TER 25589 WAT 8977 ATOM 25589 O WAT 8978 70.246 38.991 139.121 1.00 0.00 O ATOM 25590 H1 WAT 8978 70.774 38.367 139.620 1.00 0.00 H ATOM 25591 H2 WAT 8978 70.882 39.612 138.765 1.00 0.00 H TER 25593 WAT 8978 ATOM 25593 O WAT 8979 5.158 121.602 59.044 1.00 0.00 O ATOM 25594 H1 WAT 8979 5.637 122.209 59.609 1.00 0.00 H ATOM 25595 H2 WAT 8979 5.825 120.995 58.725 1.00 0.00 H TER 25597 WAT 8979 ATOM 25597 O WAT 8980 48.172 102.502 63.853 1.00 0.00 O ATOM 25598 H1 WAT 8980 48.101 102.132 62.972 1.00 0.00 H ATOM 25599 H2 WAT 8980 47.393 103.049 63.947 1.00 0.00 H TER 25601 WAT 8980 ATOM 25601 O WAT 8981 105.555 29.606 9.129 1.00 0.00 O ATOM 25602 H1 WAT 8981 105.395 30.455 9.542 1.00 0.00 H ATOM 25603 H2 WAT 8981 106.374 29.724 8.648 1.00 0.00 H TER 25605 WAT 8981 ATOM 25605 O WAT 8982 116.731 123.304 157.373 1.00 0.00 O ATOM 25606 H1 WAT 8982 116.163 123.746 158.004 1.00 0.00 H ATOM 25607 H2 WAT 8982 116.560 122.372 157.508 1.00 0.00 H TER 25609 WAT 8982 ATOM 25609 O WAT 8983 143.934 79.066 98.207 1.00 0.00 O ATOM 25610 H1 WAT 8983 143.408 78.376 98.611 1.00 0.00 H ATOM 25611 H2 WAT 8983 144.824 78.712 98.195 1.00 0.00 H TER 25613 WAT 8983 ATOM 25613 O WAT 8984 42.839 103.906 100.502 1.00 0.00 O ATOM 25614 H1 WAT 8984 42.553 103.018 100.286 1.00 0.00 H ATOM 25615 H2 WAT 8984 42.944 104.337 99.653 1.00 0.00 H TER 25617 WAT 8984 ATOM 25617 O WAT 8985 104.808 127.834 156.721 1.00 0.00 O ATOM 25618 H1 WAT 8985 105.216 128.411 157.367 1.00 0.00 H ATOM 25619 H2 WAT 8985 103.880 127.832 156.954 1.00 0.00 H TER 25621 WAT 8985 ATOM 25621 O WAT 8986 83.341 109.525 99.232 1.00 0.00 O ATOM 25622 H1 WAT 8986 84.210 109.895 99.393 1.00 0.00 H ATOM 25623 H2 WAT 8986 83.252 109.529 98.279 1.00 0.00 H TER 25625 WAT 8986 ATOM 25625 O WAT 8987 62.298 96.931 97.012 1.00 0.00 O ATOM 25626 H1 WAT 8987 62.539 97.805 96.704 1.00 0.00 H ATOM 25627 H2 WAT 8987 61.861 96.525 96.264 1.00 0.00 H TER 25629 WAT 8987 ATOM 25629 O WAT 8988 113.728 4.989 4.997 1.00 0.00 O ATOM 25630 H1 WAT 8988 113.040 4.758 5.621 1.00 0.00 H ATOM 25631 H2 WAT 8988 113.684 4.306 4.328 1.00 0.00 H TER 25633 WAT 8988 ATOM 25633 O WAT 8989 118.791 82.239 4.273 1.00 0.00 O ATOM 25634 H1 WAT 8989 118.618 82.413 5.198 1.00 0.00 H ATOM 25635 H2 WAT 8989 118.025 82.585 3.816 1.00 0.00 H TER 25637 WAT 8989 ATOM 25637 O WAT 8990 58.883 134.766 59.392 1.00 0.00 O ATOM 25638 H1 WAT 8990 58.412 135.311 60.023 1.00 0.00 H ATOM 25639 H2 WAT 8990 58.199 134.248 58.966 1.00 0.00 H TER 25641 WAT 8990 ATOM 25641 O WAT 8991 55.987 73.959 119.727 1.00 0.00 O ATOM 25642 H1 WAT 8991 56.002 73.258 120.378 1.00 0.00 H ATOM 25643 H2 WAT 8991 55.875 74.760 120.239 1.00 0.00 H TER 25645 WAT 8991 ATOM 25645 O WAT 8992 104.115 41.022 86.733 1.00 0.00 O ATOM 25646 H1 WAT 8992 104.565 40.986 87.577 1.00 0.00 H ATOM 25647 H2 WAT 8992 104.637 40.462 86.159 1.00 0.00 H TER 25649 WAT 8992 ATOM 25649 O WAT 8993 123.516 25.961 147.153 1.00 0.00 O ATOM 25650 H1 WAT 8993 124.072 25.492 146.531 1.00 0.00 H ATOM 25651 H2 WAT 8993 123.452 26.847 146.796 1.00 0.00 H TER 25653 WAT 8993 ATOM 25653 O WAT 8994 138.756 8.108 131.302 1.00 0.00 O ATOM 25654 H1 WAT 8994 139.319 8.451 130.608 1.00 0.00 H ATOM 25655 H2 WAT 8994 139.202 8.349 132.113 1.00 0.00 H TER 25657 WAT 8994 ATOM 25657 O WAT 8995 50.560 56.386 112.983 1.00 0.00 O ATOM 25658 H1 WAT 8995 51.227 55.965 113.524 1.00 0.00 H ATOM 25659 H2 WAT 8995 50.950 56.426 112.110 1.00 0.00 H TER 25661 WAT 8995 ATOM 25661 O WAT 8996 92.068 90.720 133.823 1.00 0.00 O ATOM 25662 H1 WAT 8996 91.268 90.700 134.348 1.00 0.00 H ATOM 25663 H2 WAT 8996 91.878 90.155 133.075 1.00 0.00 H TER 25665 WAT 8996 ATOM 25665 O WAT 8997 5.212 82.763 78.276 1.00 0.00 O ATOM 25666 H1 WAT 8997 4.853 83.510 77.797 1.00 0.00 H ATOM 25667 H2 WAT 8997 5.002 82.005 77.732 1.00 0.00 H TER 25669 WAT 8997 ATOM 25669 O WAT 8998 114.141 27.442 14.709 1.00 0.00 O ATOM 25670 H1 WAT 8998 113.428 27.092 15.243 1.00 0.00 H ATOM 25671 H2 WAT 8998 113.998 27.065 13.841 1.00 0.00 H TER 25673 WAT 8998 ATOM 25673 O WAT 8999 139.071 59.501 11.816 1.00 0.00 O ATOM 25674 H1 WAT 8999 138.183 59.341 11.495 1.00 0.00 H ATOM 25675 H2 WAT 8999 139.605 58.834 11.384 1.00 0.00 H TER 25677 WAT 8999 ATOM 25677 O WAT 9000 32.755 101.480 15.539 1.00 0.00 O ATOM 25678 H1 WAT 9000 33.205 101.934 14.826 1.00 0.00 H ATOM 25679 H2 WAT 9000 33.455 101.042 16.023 1.00 0.00 H TER 25681 WAT 9000 ATOM 25681 O WAT 9001 112.807 88.680 63.604 1.00 0.00 O ATOM 25682 H1 WAT 9001 112.940 88.902 62.683 1.00 0.00 H ATOM 25683 H2 WAT 9001 112.410 87.810 63.586 1.00 0.00 H TER 25685 WAT 9001 ATOM 25685 O WAT 9002 116.535 134.355 140.272 1.00 0.00 O ATOM 25686 H1 WAT 9002 116.293 133.896 141.077 1.00 0.00 H ATOM 25687 H2 WAT 9002 116.517 133.679 139.596 1.00 0.00 H TER 25689 WAT 9002 ATOM 25689 O WAT 9003 43.725 11.242 147.294 1.00 0.00 O ATOM 25690 H1 WAT 9003 44.612 11.567 147.449 1.00 0.00 H ATOM 25691 H2 WAT 9003 43.341 11.168 148.168 1.00 0.00 H TER 25693 WAT 9003 ATOM 25693 O WAT 9004 51.926 111.840 64.650 1.00 0.00 O ATOM 25694 H1 WAT 9004 52.482 111.140 64.993 1.00 0.00 H ATOM 25695 H2 WAT 9004 51.086 111.415 64.475 1.00 0.00 H TER 25697 WAT 9004 ATOM 25697 O WAT 9005 44.386 45.074 140.234 1.00 0.00 O ATOM 25698 H1 WAT 9005 45.170 45.376 139.775 1.00 0.00 H ATOM 25699 H2 WAT 9005 43.918 45.877 140.463 1.00 0.00 H TER 25701 WAT 9005 ATOM 25701 O WAT 9006 115.170 53.552 88.514 1.00 0.00 O ATOM 25702 H1 WAT 9006 115.754 53.127 89.142 1.00 0.00 H ATOM 25703 H2 WAT 9006 114.867 54.340 88.965 1.00 0.00 H TER 25705 WAT 9006 ATOM 25705 O WAT 9007 131.206 103.978 79.956 1.00 0.00 O ATOM 25706 H1 WAT 9007 131.910 103.330 79.962 1.00 0.00 H ATOM 25707 H2 WAT 9007 130.912 104.020 80.866 1.00 0.00 H TER 25709 WAT 9007 ATOM 25709 O WAT 9008 80.455 91.147 10.590 1.00 0.00 O ATOM 25710 H1 WAT 9008 80.705 90.240 10.767 1.00 0.00 H ATOM 25711 H2 WAT 9008 80.521 91.584 11.438 1.00 0.00 H TER 25713 WAT 9008 ATOM 25713 O WAT 9009 17.470 27.489 16.387 1.00 0.00 O ATOM 25714 H1 WAT 9009 17.814 27.313 17.263 1.00 0.00 H ATOM 25715 H2 WAT 9009 17.921 26.864 15.821 1.00 0.00 H TER 25717 WAT 9009 ATOM 25717 O WAT 9010 141.615 114.712 108.694 1.00 0.00 O ATOM 25718 H1 WAT 9010 141.430 114.939 107.782 1.00 0.00 H ATOM 25719 H2 WAT 9010 142.554 114.527 108.708 1.00 0.00 H TER 25721 WAT 9010 ATOM 25721 O WAT 9011 21.243 78.278 110.054 1.00 0.00 O ATOM 25722 H1 WAT 9011 21.845 77.540 109.954 1.00 0.00 H ATOM 25723 H2 WAT 9011 20.377 77.903 109.895 1.00 0.00 H TER 25725 WAT 9011 ATOM 25725 O WAT 9012 79.594 40.016 139.729 1.00 0.00 O ATOM 25726 H1 WAT 9012 78.700 39.923 139.400 1.00 0.00 H ATOM 25727 H2 WAT 9012 80.147 39.907 138.955 1.00 0.00 H TER 25729 WAT 9012 ATOM 25729 O WAT 9013 130.351 25.226 143.844 1.00 0.00 O ATOM 25730 H1 WAT 9013 130.290 25.567 142.952 1.00 0.00 H ATOM 25731 H2 WAT 9013 131.265 24.957 143.936 1.00 0.00 H TER 25733 WAT 9013 ATOM 25733 O WAT 9014 124.105 132.203 69.355 1.00 0.00 O ATOM 25734 H1 WAT 9014 124.454 131.406 69.755 1.00 0.00 H ATOM 25735 H2 WAT 9014 123.212 132.269 69.694 1.00 0.00 H TER 25737 WAT 9014 ATOM 25737 O WAT 9015 30.180 12.964 145.116 1.00 0.00 O ATOM 25738 H1 WAT 9015 30.290 13.714 145.699 1.00 0.00 H ATOM 25739 H2 WAT 9015 31.039 12.541 145.105 1.00 0.00 H TER 25741 WAT 9015 ATOM 25741 O WAT 9016 20.536 12.302 22.236 1.00 0.00 O ATOM 25742 H1 WAT 9016 20.002 12.930 22.723 1.00 0.00 H ATOM 25743 H2 WAT 9016 20.642 11.563 22.835 1.00 0.00 H TER 25745 WAT 9016 ATOM 25745 O WAT 9017 106.196 76.944 96.825 1.00 0.00 O ATOM 25746 H1 WAT 9017 105.532 76.303 97.077 1.00 0.00 H ATOM 25747 H2 WAT 9017 106.093 77.036 95.878 1.00 0.00 H TER 25749 WAT 9017 ATOM 25749 O WAT 9018 5.227 93.871 156.229 1.00 0.00 O ATOM 25750 H1 WAT 9018 5.968 93.267 156.169 1.00 0.00 H ATOM 25751 H2 WAT 9018 4.930 93.977 155.325 1.00 0.00 H TER 25753 WAT 9018 ATOM 25753 O WAT 9019 46.190 104.610 87.139 1.00 0.00 O ATOM 25754 H1 WAT 9019 45.288 104.358 86.939 1.00 0.00 H ATOM 25755 H2 WAT 9019 46.105 105.404 87.667 1.00 0.00 H TER 25757 WAT 9019 ATOM 25757 O WAT 9020 114.020 35.450 128.935 1.00 0.00 O ATOM 25758 H1 WAT 9020 113.512 35.635 129.725 1.00 0.00 H ATOM 25759 H2 WAT 9020 114.180 36.311 128.547 1.00 0.00 H TER 25761 WAT 9020 ATOM 25761 O WAT 9021 57.680 81.687 138.795 1.00 0.00 O ATOM 25762 H1 WAT 9021 58.043 82.564 138.670 1.00 0.00 H ATOM 25763 H2 WAT 9021 57.290 81.711 139.669 1.00 0.00 H TER 25765 WAT 9021 ATOM 25765 O WAT 9022 53.977 135.243 103.883 1.00 0.00 O ATOM 25766 H1 WAT 9022 54.297 134.547 103.309 1.00 0.00 H ATOM 25767 H2 WAT 9022 54.633 135.301 104.577 1.00 0.00 H TER 25769 WAT 9022 ATOM 25769 O WAT 9023 98.258 139.558 4.707 1.00 0.00 O ATOM 25770 H1 WAT 9023 98.856 139.095 4.119 1.00 0.00 H ATOM 25771 H2 WAT 9023 98.209 140.444 4.349 1.00 0.00 H TER 25773 WAT 9023 ATOM 25773 O WAT 9024 37.700 77.666 10.033 1.00 0.00 O ATOM 25774 H1 WAT 9024 38.434 78.279 10.048 1.00 0.00 H ATOM 25775 H2 WAT 9024 37.611 77.377 10.941 1.00 0.00 H TER 25777 WAT 9024 ATOM 25777 O WAT 9025 93.162 58.372 78.069 1.00 0.00 O ATOM 25778 H1 WAT 9025 93.603 57.669 78.547 1.00 0.00 H ATOM 25779 H2 WAT 9025 93.843 58.743 77.508 1.00 0.00 H TER 25781 WAT 9025 ATOM 25781 O WAT 9026 90.565 87.574 145.085 1.00 0.00 O ATOM 25782 H1 WAT 9026 90.967 87.303 144.260 1.00 0.00 H ATOM 25783 H2 WAT 9026 89.683 87.204 145.055 1.00 0.00 H TER 25785 WAT 9026 ATOM 25785 O WAT 9027 73.904 91.456 138.002 1.00 0.00 O ATOM 25786 H1 WAT 9027 74.067 91.864 138.852 1.00 0.00 H ATOM 25787 H2 WAT 9027 73.324 90.720 138.197 1.00 0.00 H TER 25789 WAT 9027 ATOM 25789 O WAT 9028 22.733 116.723 141.565 1.00 0.00 O ATOM 25790 H1 WAT 9028 23.595 116.460 141.243 1.00 0.00 H ATOM 25791 H2 WAT 9028 22.242 116.952 140.776 1.00 0.00 H TER 25793 WAT 9028 ATOM 25793 O WAT 9029 24.333 75.966 80.683 1.00 0.00 O ATOM 25794 H1 WAT 9029 25.217 75.767 80.374 1.00 0.00 H ATOM 25795 H2 WAT 9029 24.129 76.816 80.293 1.00 0.00 H TER 25797 WAT 9029 ATOM 25797 O WAT 9030 90.051 9.341 14.767 1.00 0.00 O ATOM 25798 H1 WAT 9030 89.406 9.656 14.133 1.00 0.00 H ATOM 25799 H2 WAT 9030 89.865 9.836 15.565 1.00 0.00 H TER 25801 WAT 9030 ATOM 25801 O WAT 9031 58.005 48.916 3.049 1.00 0.00 O ATOM 25802 H1 WAT 9031 57.865 49.773 3.453 1.00 0.00 H ATOM 25803 H2 WAT 9031 57.132 48.631 2.782 1.00 0.00 H TER 25805 WAT 9031 ATOM 25805 O WAT 9032 73.334 71.580 78.496 1.00 0.00 O ATOM 25806 H1 WAT 9032 73.943 70.842 78.459 1.00 0.00 H ATOM 25807 H2 WAT 9032 72.909 71.497 79.350 1.00 0.00 H TER 25809 WAT 9032 ATOM 25809 O WAT 9033 13.633 74.740 137.660 1.00 0.00 O ATOM 25810 H1 WAT 9033 13.610 74.379 138.546 1.00 0.00 H ATOM 25811 H2 WAT 9033 13.185 75.583 137.734 1.00 0.00 H TER 25813 WAT 9033 ATOM 25813 O WAT 9034 101.494 86.928 67.610 1.00 0.00 O ATOM 25814 H1 WAT 9034 100.801 87.545 67.372 1.00 0.00 H ATOM 25815 H2 WAT 9034 101.291 86.137 67.111 1.00 0.00 H TER 25817 WAT 9034 ATOM 25817 O WAT 9035 67.742 134.427 70.420 1.00 0.00 O ATOM 25818 H1 WAT 9035 67.655 133.806 69.697 1.00 0.00 H ATOM 25819 H2 WAT 9035 68.687 134.532 70.533 1.00 0.00 H TER 25821 WAT 9035 ATOM 25821 O WAT 9036 79.227 14.003 114.034 1.00 0.00 O ATOM 25822 H1 WAT 9036 79.451 13.353 113.368 1.00 0.00 H ATOM 25823 H2 WAT 9036 78.271 13.980 114.079 1.00 0.00 H TER 25825 WAT 9036 ATOM 25825 O WAT 9037 100.895 140.313 5.526 1.00 0.00 O ATOM 25826 H1 WAT 9037 99.965 140.118 5.642 1.00 0.00 H ATOM 25827 H2 WAT 9037 101.102 140.923 6.234 1.00 0.00 H TER 25829 WAT 9037 ATOM 25829 O WAT 9038 108.921 79.771 96.323 1.00 0.00 O ATOM 25830 H1 WAT 9038 108.607 79.382 97.140 1.00 0.00 H ATOM 25831 H2 WAT 9038 109.502 79.109 95.950 1.00 0.00 H TER 25833 WAT 9038 ATOM 25833 O WAT 9039 12.268 30.014 15.730 1.00 0.00 O ATOM 25834 H1 WAT 9039 13.170 30.324 15.653 1.00 0.00 H ATOM 25835 H2 WAT 9039 12.170 29.790 16.655 1.00 0.00 H TER 25837 WAT 9039 ATOM 25837 O WAT 9040 129.537 124.893 56.644 1.00 0.00 O ATOM 25838 H1 WAT 9040 130.336 124.586 56.215 1.00 0.00 H ATOM 25839 H2 WAT 9040 129.085 124.093 56.910 1.00 0.00 H TER 25841 WAT 9040 ATOM 25841 O WAT 9041 120.533 25.858 126.060 1.00 0.00 O ATOM 25842 H1 WAT 9041 120.124 26.643 126.424 1.00 0.00 H ATOM 25843 H2 WAT 9041 121.439 25.895 126.369 1.00 0.00 H TER 25845 WAT 9041 ATOM 25845 O WAT 9042 119.952 119.848 147.389 1.00 0.00 O ATOM 25846 H1 WAT 9042 119.629 120.666 147.766 1.00 0.00 H ATOM 25847 H2 WAT 9042 120.357 119.389 148.124 1.00 0.00 H TER 25849 WAT 9042 ATOM 25849 O WAT 9043 119.524 33.564 11.700 1.00 0.00 O ATOM 25850 H1 WAT 9043 120.163 34.149 12.107 1.00 0.00 H ATOM 25851 H2 WAT 9043 119.710 32.705 12.080 1.00 0.00 H TER 25853 WAT 9043 ATOM 25853 O WAT 9044 77.380 68.667 22.611 1.00 0.00 O ATOM 25854 H1 WAT 9044 78.033 68.109 22.188 1.00 0.00 H ATOM 25855 H2 WAT 9044 77.871 69.150 23.275 1.00 0.00 H TER 25857 WAT 9044 ATOM 25857 O WAT 9045 39.876 105.988 3.297 1.00 0.00 O ATOM 25858 H1 WAT 9045 39.311 105.305 2.936 1.00 0.00 H ATOM 25859 H2 WAT 9045 39.984 105.749 4.218 1.00 0.00 H TER 25861 WAT 9045 ATOM 25861 O WAT 9046 32.863 67.495 98.875 1.00 0.00 O ATOM 25862 H1 WAT 9046 32.832 68.155 98.183 1.00 0.00 H ATOM 25863 H2 WAT 9046 33.392 66.787 98.507 1.00 0.00 H TER 25865 WAT 9046 ATOM 25865 O WAT 9047 73.038 97.743 112.577 1.00 0.00 O ATOM 25866 H1 WAT 9047 72.107 97.551 112.465 1.00 0.00 H ATOM 25867 H2 WAT 9047 73.154 97.826 113.523 1.00 0.00 H TER 25869 WAT 9047 ATOM 25869 O WAT 9048 3.314 55.064 84.200 1.00 0.00 O ATOM 25870 H1 WAT 9048 3.492 54.759 85.089 1.00 0.00 H ATOM 25871 H2 WAT 9048 3.795 54.456 83.637 1.00 0.00 H TER 25873 WAT 9048 ATOM 25873 O WAT 9049 116.463 11.643 144.511 1.00 0.00 O ATOM 25874 H1 WAT 9049 115.948 11.141 145.143 1.00 0.00 H ATOM 25875 H2 WAT 9049 116.304 12.558 144.746 1.00 0.00 H TER 25877 WAT 9049 ATOM 25877 O WAT 9050 56.366 68.098 113.936 1.00 0.00 O ATOM 25878 H1 WAT 9050 56.110 67.501 114.638 1.00 0.00 H ATOM 25879 H2 WAT 9050 55.607 68.669 113.818 1.00 0.00 H TER 25881 WAT 9050 ATOM 25881 O WAT 9051 0.699 52.252 141.967 1.00 0.00 O ATOM 25882 H1 WAT 9051 1.108 52.913 142.526 1.00 0.00 H ATOM 25883 H2 WAT 9051 0.052 51.829 142.531 1.00 0.00 H TER 25885 WAT 9051 ATOM 25885 O WAT 9052 33.556 88.570 105.831 1.00 0.00 O ATOM 25886 H1 WAT 9052 33.201 89.258 106.393 1.00 0.00 H ATOM 25887 H2 WAT 9052 33.709 87.832 106.422 1.00 0.00 H TER 25889 WAT 9052 ATOM 25889 O WAT 9053 21.100 23.768 72.273 1.00 0.00 O ATOM 25890 H1 WAT 9053 21.561 23.347 72.998 1.00 0.00 H ATOM 25891 H2 WAT 9053 21.769 23.882 71.597 1.00 0.00 H TER 25893 WAT 9053 ATOM 25893 O WAT 9054 105.747 11.802 124.215 1.00 0.00 O ATOM 25894 H1 WAT 9054 105.786 12.687 123.854 1.00 0.00 H ATOM 25895 H2 WAT 9054 105.759 11.229 123.448 1.00 0.00 H TER 25897 WAT 9054 ATOM 25897 O WAT 9055 22.796 54.409 153.063 1.00 0.00 O ATOM 25898 H1 WAT 9055 21.860 54.224 153.147 1.00 0.00 H ATOM 25899 H2 WAT 9055 22.878 55.336 153.287 1.00 0.00 H TER 25901 WAT 9055 ATOM 25901 O WAT 9056 1.236 25.748 57.996 1.00 0.00 O ATOM 25902 H1 WAT 9056 1.613 26.396 58.591 1.00 0.00 H ATOM 25903 H2 WAT 9056 0.291 25.890 58.054 1.00 0.00 H TER 25905 WAT 9056 ATOM 25905 O WAT 9057 93.191 56.576 95.944 1.00 0.00 O ATOM 25906 H1 WAT 9057 93.009 56.466 96.877 1.00 0.00 H ATOM 25907 H2 WAT 9057 93.358 57.513 95.841 1.00 0.00 H TER 25909 WAT 9057 ATOM 25909 O WAT 9058 23.666 29.283 12.387 1.00 0.00 O ATOM 25910 H1 WAT 9058 23.766 29.059 13.312 1.00 0.00 H ATOM 25911 H2 WAT 9058 23.241 28.518 11.999 1.00 0.00 H TER 25913 WAT 9058 ATOM 25913 O WAT 9059 99.233 89.094 139.907 1.00 0.00 O ATOM 25914 H1 WAT 9059 100.186 89.024 139.948 1.00 0.00 H ATOM 25915 H2 WAT 9059 98.941 88.924 140.802 1.00 0.00 H TER 25917 WAT 9059 ATOM 25917 O WAT 9060 81.362 55.647 0.342 1.00 0.00 O ATOM 25918 H1 WAT 9060 81.604 55.220 1.164 1.00 0.00 H ATOM 25919 H2 WAT 9060 81.935 56.411 0.291 1.00 0.00 H TER 25921 WAT 9060 ATOM 25921 O WAT 9061 94.829 3.805 98.392 1.00 0.00 O ATOM 25922 H1 WAT 9061 95.196 3.237 97.714 1.00 0.00 H ATOM 25923 H2 WAT 9061 94.066 4.209 97.978 1.00 0.00 H TER 25925 WAT 9061 ATOM 25925 O WAT 9062 109.446 0.797 67.576 1.00 0.00 O ATOM 25926 H1 WAT 9062 108.820 0.905 66.860 1.00 0.00 H ATOM 25927 H2 WAT 9062 110.292 0.688 67.140 1.00 0.00 H TER 25929 WAT 9062 ATOM 25929 O WAT 9063 104.479 141.150 123.714 1.00 0.00 O ATOM 25930 H1 WAT 9063 105.206 140.605 123.414 1.00 0.00 H ATOM 25931 H2 WAT 9063 104.872 142.009 123.871 1.00 0.00 H TER 25933 WAT 9063 ATOM 25933 O WAT 9064 141.348 139.051 16.555 1.00 0.00 O ATOM 25934 H1 WAT 9064 141.951 138.338 16.766 1.00 0.00 H ATOM 25935 H2 WAT 9064 141.140 139.446 17.402 1.00 0.00 H TER 25937 WAT 9064 ATOM 25937 O WAT 9065 95.116 54.055 69.402 1.00 0.00 O ATOM 25938 H1 WAT 9065 95.823 54.493 69.875 1.00 0.00 H ATOM 25939 H2 WAT 9065 95.387 53.138 69.359 1.00 0.00 H TER 25941 WAT 9065 ATOM 25941 O WAT 9066 34.668 95.033 140.197 1.00 0.00 O ATOM 25942 H1 WAT 9066 34.985 95.297 141.061 1.00 0.00 H ATOM 25943 H2 WAT 9066 34.517 95.858 139.735 1.00 0.00 H TER 25945 WAT 9066 ATOM 25945 O WAT 9067 113.176 135.136 80.154 1.00 0.00 O ATOM 25946 H1 WAT 9067 113.282 136.069 79.965 1.00 0.00 H ATOM 25947 H2 WAT 9067 113.990 134.736 79.850 1.00 0.00 H TER 25949 WAT 9067 ATOM 25949 O WAT 9068 7.273 78.594 77.686 1.00 0.00 O ATOM 25950 H1 WAT 9068 6.792 78.648 76.860 1.00 0.00 H ATOM 25951 H2 WAT 9068 6.600 78.676 78.361 1.00 0.00 H TER 25953 WAT 9068 ATOM 25953 O WAT 9069 88.110 41.295 132.238 1.00 0.00 O ATOM 25954 H1 WAT 9069 87.612 41.906 132.781 1.00 0.00 H ATOM 25955 H2 WAT 9069 87.711 40.442 132.410 1.00 0.00 H TER 25957 WAT 9069 ATOM 25957 O WAT 9070 108.979 54.163 133.622 1.00 0.00 O ATOM 25958 H1 WAT 9070 109.300 54.370 132.745 1.00 0.00 H ATOM 25959 H2 WAT 9070 108.195 53.634 133.471 1.00 0.00 H TER 25961 WAT 9070 ATOM 25961 O WAT 9071 16.650 62.021 156.964 1.00 0.00 O ATOM 25962 H1 WAT 9071 16.342 61.215 157.378 1.00 0.00 H ATOM 25963 H2 WAT 9071 16.357 62.719 157.550 1.00 0.00 H TER 25965 WAT 9071 ATOM 25965 O WAT 9072 106.598 96.585 131.383 1.00 0.00 O ATOM 25966 H1 WAT 9072 106.528 96.853 130.467 1.00 0.00 H ATOM 25967 H2 WAT 9072 105.730 96.752 131.749 1.00 0.00 H TER 25969 WAT 9072 ATOM 25969 O WAT 9073 96.643 54.542 120.423 1.00 0.00 O ATOM 25970 H1 WAT 9073 96.750 54.128 119.567 1.00 0.00 H ATOM 25971 H2 WAT 9073 96.297 55.413 120.226 1.00 0.00 H TER 25973 WAT 9073 ATOM 25973 O WAT 9074 33.816 118.754 13.275 1.00 0.00 O ATOM 25974 H1 WAT 9074 34.003 119.557 13.761 1.00 0.00 H ATOM 25975 H2 WAT 9074 33.814 119.025 12.357 1.00 0.00 H TER 25977 WAT 9074 ATOM 25977 O WAT 9075 113.022 32.450 143.353 1.00 0.00 O ATOM 25978 H1 WAT 9075 112.896 31.715 142.754 1.00 0.00 H ATOM 25979 H2 WAT 9075 112.933 32.066 144.225 1.00 0.00 H TER 25981 WAT 9075 ATOM 25981 O WAT 9076 2.719 128.596 79.216 1.00 0.00 O ATOM 25982 H1 WAT 9076 2.304 128.548 78.355 1.00 0.00 H ATOM 25983 H2 WAT 9076 2.814 129.533 79.385 1.00 0.00 H TER 25985 WAT 9076 ATOM 25985 O WAT 9077 33.867 75.272 116.285 1.00 0.00 O ATOM 25986 H1 WAT 9077 33.727 75.617 115.403 1.00 0.00 H ATOM 25987 H2 WAT 9077 32.993 75.031 116.591 1.00 0.00 H TER 25989 WAT 9077 ATOM 25989 O WAT 9078 94.215 114.588 129.864 1.00 0.00 O ATOM 25990 H1 WAT 9078 93.428 114.188 130.232 1.00 0.00 H ATOM 25991 H2 WAT 9078 94.939 114.133 130.294 1.00 0.00 H TER 25993 WAT 9078 ATOM 25993 O WAT 9079 52.548 87.239 64.356 1.00 0.00 O ATOM 25994 H1 WAT 9079 52.526 87.504 63.436 1.00 0.00 H ATOM 25995 H2 WAT 9079 52.902 86.350 64.341 1.00 0.00 H TER 25997 WAT 9079 ATOM 25997 O WAT 9080 80.916 60.251 20.733 1.00 0.00 O ATOM 25998 H1 WAT 9080 81.686 60.613 21.172 1.00 0.00 H ATOM 25999 H2 WAT 9080 81.248 59.491 20.256 1.00 0.00 H TER 26001 WAT 9080 ATOM 26001 O WAT 9081 0.651 133.401 136.128 1.00 0.00 O ATOM 26002 H1 WAT 9081 0.963 133.568 137.017 1.00 0.00 H ATOM 26003 H2 WAT 9081 1.130 132.620 135.849 1.00 0.00 H TER 26005 WAT 9081 ATOM 26005 O WAT 9082 67.960 86.805 128.257 1.00 0.00 O ATOM 26006 H1 WAT 9082 67.709 86.451 127.404 1.00 0.00 H ATOM 26007 H2 WAT 9082 68.265 86.045 128.752 1.00 0.00 H TER 26009 WAT 9082 ATOM 26009 O WAT 9083 96.826 140.932 106.788 1.00 0.00 O ATOM 26010 H1 WAT 9083 97.162 141.742 106.404 1.00 0.00 H ATOM 26011 H2 WAT 9083 97.580 140.343 106.802 1.00 0.00 H TER 26013 WAT 9083 ATOM 26013 O WAT 9084 129.659 134.589 62.147 1.00 0.00 O ATOM 26014 H1 WAT 9084 130.586 134.509 61.925 1.00 0.00 H ATOM 26015 H2 WAT 9084 129.370 133.689 62.296 1.00 0.00 H TER 26017 WAT 9084 ATOM 26017 O WAT 9085 4.971 75.208 100.620 1.00 0.00 O ATOM 26018 H1 WAT 9085 5.334 75.085 101.497 1.00 0.00 H ATOM 26019 H2 WAT 9085 5.518 74.663 100.055 1.00 0.00 H TER 26021 WAT 9085 ATOM 26021 O WAT 9086 124.433 86.028 83.666 1.00 0.00 O ATOM 26022 H1 WAT 9086 125.302 86.398 83.510 1.00 0.00 H ATOM 26023 H2 WAT 9086 123.956 86.187 82.852 1.00 0.00 H TER 26025 WAT 9086 ATOM 26025 O WAT 9087 121.198 140.464 6.738 1.00 0.00 O ATOM 26026 H1 WAT 9087 121.520 139.812 6.115 1.00 0.00 H ATOM 26027 H2 WAT 9087 121.221 141.290 6.255 1.00 0.00 H TER 26029 WAT 9087 ATOM 26029 O WAT 9088 36.583 128.994 88.360 1.00 0.00 O ATOM 26030 H1 WAT 9088 37.526 129.105 88.484 1.00 0.00 H ATOM 26031 H2 WAT 9088 36.241 128.851 89.242 1.00 0.00 H TER 26033 WAT 9088 ATOM 26033 O WAT 9089 131.651 48.033 88.655 1.00 0.00 O ATOM 26034 H1 WAT 9089 130.784 47.711 88.906 1.00 0.00 H ATOM 26035 H2 WAT 9089 131.473 48.751 88.048 1.00 0.00 H TER 26037 WAT 9089 ATOM 26037 O WAT 9090 96.244 54.752 143.933 1.00 0.00 O ATOM 26038 H1 WAT 9090 97.077 54.583 144.374 1.00 0.00 H ATOM 26039 H2 WAT 9090 95.698 53.998 144.154 1.00 0.00 H TER 26041 WAT 9090 ATOM 26041 O WAT 9091 14.170 2.748 60.685 1.00 0.00 O ATOM 26042 H1 WAT 9091 13.597 2.310 60.055 1.00 0.00 H ATOM 26043 H2 WAT 9091 14.960 2.954 60.186 1.00 0.00 H TER 26045 WAT 9091 ATOM 26045 O WAT 9092 115.096 74.973 90.109 1.00 0.00 O ATOM 26046 H1 WAT 9092 115.210 75.706 89.503 1.00 0.00 H ATOM 26047 H2 WAT 9092 114.768 74.259 89.562 1.00 0.00 H TER 26049 WAT 9092 ATOM 26049 O WAT 9093 79.860 4.408 111.423 1.00 0.00 O ATOM 26050 H1 WAT 9093 80.015 4.062 110.544 1.00 0.00 H ATOM 26051 H2 WAT 9093 80.244 5.285 111.406 1.00 0.00 H TER 26053 WAT 9093 ATOM 26053 O WAT 9094 86.610 5.634 90.615 1.00 0.00 O ATOM 26054 H1 WAT 9094 85.873 5.363 91.162 1.00 0.00 H ATOM 26055 H2 WAT 9094 86.552 5.073 89.841 1.00 0.00 H TER 26057 WAT 9094 ATOM 26057 O WAT 9095 100.169 14.115 85.793 1.00 0.00 O ATOM 26058 H1 WAT 9095 100.164 14.351 86.721 1.00 0.00 H ATOM 26059 H2 WAT 9095 100.428 13.194 85.782 1.00 0.00 H TER 26061 WAT 9095 ATOM 26061 O WAT 9096 97.126 82.065 108.438 1.00 0.00 O ATOM 26062 H1 WAT 9096 96.488 81.352 108.457 1.00 0.00 H ATOM 26063 H2 WAT 9096 96.615 82.836 108.191 1.00 0.00 H TER 26065 WAT 9096 ATOM 26065 O WAT 9097 105.917 117.260 82.554 1.00 0.00 O ATOM 26066 H1 WAT 9097 105.348 117.796 83.106 1.00 0.00 H ATOM 26067 H2 WAT 9097 106.787 117.643 82.664 1.00 0.00 H TER 26069 WAT 9097 ATOM 26069 O WAT 9098 30.282 29.368 83.399 1.00 0.00 O ATOM 26070 H1 WAT 9098 29.849 29.745 84.165 1.00 0.00 H ATOM 26071 H2 WAT 9098 29.830 28.537 83.253 1.00 0.00 H TER 26073 WAT 9098 ATOM 26073 O WAT 9099 122.329 75.024 8.629 1.00 0.00 O ATOM 26074 H1 WAT 9099 121.505 74.756 9.034 1.00 0.00 H ATOM 26075 H2 WAT 9099 122.386 75.964 8.800 1.00 0.00 H TER 26077 WAT 9099 ATOM 26077 O WAT 9100 14.744 73.698 7.578 1.00 0.00 O ATOM 26078 H1 WAT 9100 15.407 73.270 8.120 1.00 0.00 H ATOM 26079 H2 WAT 9100 14.936 74.633 7.658 1.00 0.00 H TER 26081 WAT 9100 ATOM 26081 O WAT 9101 47.493 100.870 133.699 1.00 0.00 O ATOM 26082 H1 WAT 9101 46.909 100.111 133.714 1.00 0.00 H ATOM 26083 H2 WAT 9101 48.296 100.546 133.291 1.00 0.00 H TER 26085 WAT 9101 ATOM 26085 O WAT 9102 99.683 118.985 98.512 1.00 0.00 O ATOM 26086 H1 WAT 9102 99.590 119.475 99.330 1.00 0.00 H ATOM 26087 H2 WAT 9102 100.626 118.971 98.348 1.00 0.00 H TER 26089 WAT 9102 ATOM 26089 O WAT 9103 53.478 15.047 56.519 1.00 0.00 O ATOM 26090 H1 WAT 9103 53.827 15.737 57.083 1.00 0.00 H ATOM 26091 H2 WAT 9103 52.752 14.674 57.019 1.00 0.00 H TER 26093 WAT 9103 ATOM 26093 O WAT 9104 88.793 108.748 156.204 1.00 0.00 O ATOM 26094 H1 WAT 9104 89.036 108.698 157.129 1.00 0.00 H ATOM 26095 H2 WAT 9104 89.236 108.002 155.799 1.00 0.00 H TER 26097 WAT 9104 ATOM 26097 O WAT 9105 34.762 104.555 106.919 1.00 0.00 O ATOM 26098 H1 WAT 9105 35.709 104.619 106.794 1.00 0.00 H ATOM 26099 H2 WAT 9105 34.419 105.380 106.575 1.00 0.00 H TER 26101 WAT 9105 ATOM 26101 O WAT 9106 57.351 62.068 32.166 1.00 0.00 O ATOM 26102 H1 WAT 9106 58.178 62.484 31.923 1.00 0.00 H ATOM 26103 H2 WAT 9106 56.682 62.709 31.927 1.00 0.00 H TER 26105 WAT 9106 ATOM 26105 O WAT 9107 20.068 110.098 154.921 1.00 0.00 O ATOM 26106 H1 WAT 9107 19.761 109.238 155.207 1.00 0.00 H ATOM 26107 H2 WAT 9107 20.699 109.908 154.227 1.00 0.00 H TER 26109 WAT 9107 ATOM 26109 O WAT 9108 41.140 45.741 76.425 1.00 0.00 O ATOM 26110 H1 WAT 9108 40.212 45.805 76.653 1.00 0.00 H ATOM 26111 H2 WAT 9108 41.232 44.869 76.040 1.00 0.00 H TER 26113 WAT 9108 ATOM 26113 O WAT 9109 92.454 80.462 89.712 1.00 0.00 O ATOM 26114 H1 WAT 9109 93.230 80.179 89.229 1.00 0.00 H ATOM 26115 H2 WAT 9109 92.649 81.362 89.973 1.00 0.00 H TER 26117 WAT 9109 ATOM 26117 O WAT 9110 80.364 37.671 143.853 1.00 0.00 O ATOM 26118 H1 WAT 9110 80.266 37.826 142.913 1.00 0.00 H ATOM 26119 H2 WAT 9110 79.643 38.159 144.252 1.00 0.00 H TER 26121 WAT 9110 ATOM 26121 O WAT 9111 57.642 114.920 142.322 1.00 0.00 O ATOM 26122 H1 WAT 9111 56.945 115.093 141.690 1.00 0.00 H ATOM 26123 H2 WAT 9111 58.353 115.505 142.062 1.00 0.00 H TER 26125 WAT 9111 ATOM 26125 O WAT 9112 139.258 122.587 94.777 1.00 0.00 O ATOM 26126 H1 WAT 9112 140.011 122.085 94.463 1.00 0.00 H ATOM 26127 H2 WAT 9112 139.195 123.327 94.173 1.00 0.00 H TER 26129 WAT 9112 ATOM 26129 O WAT 9113 142.049 123.604 92.246 1.00 0.00 O ATOM 26130 H1 WAT 9113 141.133 123.867 92.340 1.00 0.00 H ATOM 26131 H2 WAT 9113 142.256 123.779 91.328 1.00 0.00 H TER 26133 WAT 9113 ATOM 26133 O WAT 9114 27.096 37.584 153.024 1.00 0.00 O ATOM 26134 H1 WAT 9114 27.236 36.702 153.368 1.00 0.00 H ATOM 26135 H2 WAT 9114 26.983 37.459 152.082 1.00 0.00 H TER 26137 WAT 9114 ATOM 26137 O WAT 9115 137.732 92.743 115.891 1.00 0.00 O ATOM 26138 H1 WAT 9115 138.401 93.067 115.288 1.00 0.00 H ATOM 26139 H2 WAT 9115 137.052 92.382 115.323 1.00 0.00 H TER 26141 WAT 9115 ATOM 26141 O WAT 9116 27.278 106.965 129.101 1.00 0.00 O ATOM 26142 H1 WAT 9116 26.513 107.420 129.453 1.00 0.00 H ATOM 26143 H2 WAT 9116 27.232 106.088 129.482 1.00 0.00 H TER 26145 WAT 9116 ATOM 26145 O WAT 9117 96.319 49.342 132.852 1.00 0.00 O ATOM 26146 H1 WAT 9117 96.941 50.018 132.583 1.00 0.00 H ATOM 26147 H2 WAT 9117 95.552 49.490 132.299 1.00 0.00 H TER 26149 WAT 9117 ATOM 26149 O WAT 9118 20.402 126.453 117.965 1.00 0.00 O ATOM 26150 H1 WAT 9118 19.721 126.052 117.424 1.00 0.00 H ATOM 26151 H2 WAT 9118 21.134 125.837 117.923 1.00 0.00 H TER 26153 WAT 9118 ATOM 26153 O WAT 9119 41.719 4.653 76.975 1.00 0.00 O ATOM 26154 H1 WAT 9119 42.576 4.850 77.353 1.00 0.00 H ATOM 26155 H2 WAT 9119 41.251 4.191 77.670 1.00 0.00 H TER 26157 WAT 9119 ATOM 26157 O WAT 9120 96.739 43.524 17.954 1.00 0.00 O ATOM 26158 H1 WAT 9120 96.350 44.388 17.817 1.00 0.00 H ATOM 26159 H2 WAT 9120 96.789 43.142 17.078 1.00 0.00 H TER 26161 WAT 9120 ATOM 26161 O WAT 9121 86.330 92.996 77.717 1.00 0.00 O ATOM 26162 H1 WAT 9121 86.568 93.906 77.895 1.00 0.00 H ATOM 26163 H2 WAT 9121 87.169 92.544 77.621 1.00 0.00 H TER 26165 WAT 9121 ATOM 26165 O WAT 9122 23.273 128.951 109.236 1.00 0.00 O ATOM 26166 H1 WAT 9122 22.836 129.802 109.240 1.00 0.00 H ATOM 26167 H2 WAT 9122 24.191 129.152 109.421 1.00 0.00 H TER 26169 WAT 9122 ATOM 26169 O WAT 9123 101.981 88.513 59.834 1.00 0.00 O ATOM 26170 H1 WAT 9123 101.894 89.307 59.306 1.00 0.00 H ATOM 26171 H2 WAT 9123 101.080 88.218 59.972 1.00 0.00 H TER 26173 WAT 9123 ATOM 26173 O WAT 9124 53.367 42.554 97.089 1.00 0.00 O ATOM 26174 H1 WAT 9124 54.266 42.852 96.947 1.00 0.00 H ATOM 26175 H2 WAT 9124 52.958 43.255 97.596 1.00 0.00 H TER 26177 WAT 9124 ATOM 26177 O WAT 9125 129.197 127.142 138.132 1.00 0.00 O ATOM 26178 H1 WAT 9125 128.589 127.874 138.024 1.00 0.00 H ATOM 26179 H2 WAT 9125 129.289 126.776 137.253 1.00 0.00 H TER 26181 WAT 9125 ATOM 26181 O WAT 9126 23.899 72.815 123.318 1.00 0.00 O ATOM 26182 H1 WAT 9126 23.469 73.022 122.488 1.00 0.00 H ATOM 26183 H2 WAT 9126 24.788 72.561 123.071 1.00 0.00 H TER 26185 WAT 9126 ATOM 26185 O WAT 9127 29.112 116.912 66.286 1.00 0.00 O ATOM 26186 H1 WAT 9127 28.854 116.090 66.704 1.00 0.00 H ATOM 26187 H2 WAT 9127 28.577 116.956 65.493 1.00 0.00 H TER 26189 WAT 9127 ATOM 26189 O WAT 9128 7.351 82.815 67.596 1.00 0.00 O ATOM 26190 H1 WAT 9128 7.747 82.437 68.381 1.00 0.00 H ATOM 26191 H2 WAT 9128 7.701 82.290 66.876 1.00 0.00 H TER 26193 WAT 9128 ATOM 26193 O WAT 9129 88.805 76.096 95.442 1.00 0.00 O ATOM 26194 H1 WAT 9129 88.382 75.662 96.183 1.00 0.00 H ATOM 26195 H2 WAT 9129 88.166 76.745 95.148 1.00 0.00 H TER 26197 WAT 9129 ATOM 26197 O WAT 9130 67.645 109.621 12.288 1.00 0.00 O ATOM 26198 H1 WAT 9130 66.927 110.178 12.589 1.00 0.00 H ATOM 26199 H2 WAT 9130 68.426 109.998 12.692 1.00 0.00 H TER 26201 WAT 9130 ATOM 26201 O WAT 9131 90.809 2.076 64.685 1.00 0.00 O ATOM 26202 H1 WAT 9131 90.401 2.212 63.829 1.00 0.00 H ATOM 26203 H2 WAT 9131 91.618 2.585 64.648 1.00 0.00 H TER 26205 WAT 9131 ATOM 26205 O WAT 9132 54.892 95.538 154.498 1.00 0.00 O ATOM 26206 H1 WAT 9132 54.181 96.162 154.644 1.00 0.00 H ATOM 26207 H2 WAT 9132 55.609 95.861 155.045 1.00 0.00 H TER 26209 WAT 9132 ATOM 26209 O WAT 9133 106.418 8.647 104.517 1.00 0.00 O ATOM 26210 H1 WAT 9133 107.090 8.242 105.065 1.00 0.00 H ATOM 26211 H2 WAT 9133 105.660 8.735 105.094 1.00 0.00 H TER 26213 WAT 9133 ATOM 26213 O WAT 9134 129.981 33.201 86.778 1.00 0.00 O ATOM 26214 H1 WAT 9134 129.770 32.333 87.123 1.00 0.00 H ATOM 26215 H2 WAT 9134 129.410 33.796 87.264 1.00 0.00 H TER 26217 WAT 9134 ATOM 26217 O WAT 9135 139.686 30.413 133.439 1.00 0.00 O ATOM 26218 H1 WAT 9135 140.547 30.354 133.025 1.00 0.00 H ATOM 26219 H2 WAT 9135 139.554 31.350 133.584 1.00 0.00 H TER 26221 WAT 9135 ATOM 26221 O WAT 9136 96.471 59.301 19.169 1.00 0.00 O ATOM 26222 H1 WAT 9136 95.816 59.984 19.027 1.00 0.00 H ATOM 26223 H2 WAT 9136 96.193 58.866 19.975 1.00 0.00 H TER 26225 WAT 9136 ATOM 26225 O WAT 9137 102.140 15.610 84.192 1.00 0.00 O ATOM 26226 H1 WAT 9137 101.947 15.227 83.336 1.00 0.00 H ATOM 26227 H2 WAT 9137 101.776 14.987 84.821 1.00 0.00 H TER 26229 WAT 9137 ATOM 26229 O WAT 9138 134.311 72.312 16.297 1.00 0.00 O ATOM 26230 H1 WAT 9138 133.648 71.815 15.818 1.00 0.00 H ATOM 26231 H2 WAT 9138 134.344 73.158 15.850 1.00 0.00 H TER 26233 WAT 9138 ATOM 26233 O WAT 9139 104.668 125.050 9.003 1.00 0.00 O ATOM 26234 H1 WAT 9139 104.973 125.466 8.197 1.00 0.00 H ATOM 26235 H2 WAT 9139 103.732 124.908 8.861 1.00 0.00 H TER 26237 WAT 9139 ATOM 26237 O WAT 9140 80.733 8.569 98.498 1.00 0.00 O ATOM 26238 H1 WAT 9140 80.109 8.437 99.212 1.00 0.00 H ATOM 26239 H2 WAT 9140 81.590 8.414 98.896 1.00 0.00 H TER 26241 WAT 9140 ATOM 26241 O WAT 9141 115.644 3.112 157.467 1.00 0.00 O ATOM 26242 H1 WAT 9141 115.244 2.578 156.780 1.00 0.00 H ATOM 26243 H2 WAT 9141 115.581 2.573 158.256 1.00 0.00 H TER 26245 WAT 9141 ATOM 26245 O WAT 9142 106.117 43.788 22.764 1.00 0.00 O ATOM 26246 H1 WAT 9142 105.685 44.189 23.518 1.00 0.00 H ATOM 26247 H2 WAT 9142 105.418 43.671 22.121 1.00 0.00 H TER 26249 WAT 9142 ATOM 26249 O WAT 9143 81.890 25.059 123.638 1.00 0.00 O ATOM 26250 H1 WAT 9143 81.147 24.942 123.046 1.00 0.00 H ATOM 26251 H2 WAT 9143 82.660 24.921 123.086 1.00 0.00 H TER 26253 WAT 9143 ATOM 26253 O WAT 9144 24.211 5.550 85.043 1.00 0.00 O ATOM 26254 H1 WAT 9144 23.595 5.074 85.600 1.00 0.00 H ATOM 26255 H2 WAT 9144 23.692 6.261 84.667 1.00 0.00 H TER 26257 WAT 9144 ATOM 26257 O WAT 9145 22.383 125.513 129.304 1.00 0.00 O ATOM 26258 H1 WAT 9145 23.243 125.612 129.712 1.00 0.00 H ATOM 26259 H2 WAT 9145 22.036 124.700 129.670 1.00 0.00 H TER 26261 WAT 9145 ATOM 26261 O WAT 9146 63.971 25.069 91.331 1.00 0.00 O ATOM 26262 H1 WAT 9146 64.399 25.843 90.968 1.00 0.00 H ATOM 26263 H2 WAT 9146 63.897 25.253 92.268 1.00 0.00 H TER 26265 WAT 9146 ATOM 26265 O WAT 9147 143.872 66.794 84.743 1.00 0.00 O ATOM 26266 H1 WAT 9147 143.409 66.777 83.905 1.00 0.00 H ATOM 26267 H2 WAT 9147 144.314 65.946 84.790 1.00 0.00 H TER 26269 WAT 9147 ATOM 26269 O WAT 9148 42.303 41.581 2.292 1.00 0.00 O ATOM 26270 H1 WAT 9148 43.038 41.981 1.827 1.00 0.00 H ATOM 26271 H2 WAT 9148 42.695 41.207 3.081 1.00 0.00 H TER 26273 WAT 9148 ATOM 26273 O WAT 9149 140.183 124.699 72.246 1.00 0.00 O ATOM 26274 H1 WAT 9149 140.221 125.240 71.457 1.00 0.00 H ATOM 26275 H2 WAT 9149 140.070 123.807 71.919 1.00 0.00 H TER 26277 WAT 9149 ATOM 26277 O WAT 9150 86.679 58.308 81.565 1.00 0.00 O ATOM 26278 H1 WAT 9150 87.031 58.283 82.454 1.00 0.00 H ATOM 26279 H2 WAT 9150 86.469 59.230 81.416 1.00 0.00 H TER 26281 WAT 9150 ATOM 26281 O WAT 9151 94.991 107.721 96.103 1.00 0.00 O ATOM 26282 H1 WAT 9151 95.023 108.369 95.399 1.00 0.00 H ATOM 26283 H2 WAT 9151 95.909 107.520 96.285 1.00 0.00 H TER 26285 WAT 9151 ATOM 26285 O WAT 9152 142.944 88.308 95.103 1.00 0.00 O ATOM 26286 H1 WAT 9152 142.809 87.371 95.241 1.00 0.00 H ATOM 26287 H2 WAT 9152 142.079 88.697 95.237 1.00 0.00 H TER 26289 WAT 9152 ATOM 26289 O WAT 9153 81.248 42.931 122.229 1.00 0.00 O ATOM 26290 H1 WAT 9153 82.073 43.173 121.807 1.00 0.00 H ATOM 26291 H2 WAT 9153 80.769 43.756 122.309 1.00 0.00 H TER 26293 WAT 9153 ATOM 26293 O WAT 9154 107.175 81.756 4.367 1.00 0.00 O ATOM 26294 H1 WAT 9154 107.557 82.491 3.886 1.00 0.00 H ATOM 26295 H2 WAT 9154 107.865 81.481 4.971 1.00 0.00 H TER 26297 WAT 9154 ATOM 26297 O WAT 9155 109.495 115.618 84.653 1.00 0.00 O ATOM 26298 H1 WAT 9155 109.777 116.525 84.766 1.00 0.00 H ATOM 26299 H2 WAT 9155 109.920 115.144 85.368 1.00 0.00 H TER 26301 WAT 9155 ATOM 26301 O WAT 9156 125.917 126.151 152.226 1.00 0.00 O ATOM 26302 H1 WAT 9156 125.119 125.951 151.736 1.00 0.00 H ATOM 26303 H2 WAT 9156 125.611 126.637 152.992 1.00 0.00 H TER 26305 WAT 9156 ATOM 26305 O WAT 9157 42.960 92.707 24.651 1.00 0.00 O ATOM 26306 H1 WAT 9157 42.030 92.911 24.743 1.00 0.00 H ATOM 26307 H2 WAT 9157 43.303 92.743 25.544 1.00 0.00 H TER 26309 WAT 9157 ATOM 26309 O WAT 9158 6.189 107.544 120.861 1.00 0.00 O ATOM 26310 H1 WAT 9158 6.923 107.285 121.418 1.00 0.00 H ATOM 26311 H2 WAT 9158 6.491 108.337 120.419 1.00 0.00 H TER 26313 WAT 9158 ATOM 26313 O WAT 9159 109.017 9.682 96.171 1.00 0.00 O ATOM 26314 H1 WAT 9159 108.807 8.800 95.863 1.00 0.00 H ATOM 26315 H2 WAT 9159 108.358 9.864 96.841 1.00 0.00 H TER 26317 WAT 9159 ATOM 26317 O WAT 9160 49.082 15.537 95.927 1.00 0.00 O ATOM 26318 H1 WAT 9160 49.823 16.139 95.999 1.00 0.00 H ATOM 26319 H2 WAT 9160 49.443 14.683 96.166 1.00 0.00 H TER 26321 WAT 9160 ATOM 26321 O WAT 9161 99.528 37.113 20.795 1.00 0.00 O ATOM 26322 H1 WAT 9161 99.665 37.479 21.669 1.00 0.00 H ATOM 26323 H2 WAT 9161 99.096 36.273 20.953 1.00 0.00 H TER 26325 WAT 9161 ATOM 26325 O WAT 9162 109.178 105.894 122.589 1.00 0.00 O ATOM 26326 H1 WAT 9162 109.393 105.821 123.519 1.00 0.00 H ATOM 26327 H2 WAT 9162 109.462 105.062 122.211 1.00 0.00 H TER 26329 WAT 9162 ATOM 26329 O WAT 9163 96.791 108.937 104.697 1.00 0.00 O ATOM 26330 H1 WAT 9163 96.454 109.810 104.493 1.00 0.00 H ATOM 26331 H2 WAT 9163 97.467 108.781 104.038 1.00 0.00 H TER 26333 WAT 9163 ATOM 26333 O WAT 9164 77.632 132.786 119.108 1.00 0.00 O ATOM 26334 H1 WAT 9164 77.759 131.865 119.336 1.00 0.00 H ATOM 26335 H2 WAT 9164 77.626 133.242 119.950 1.00 0.00 H TER 26337 WAT 9164 ATOM 26337 O WAT 9165 116.783 63.405 14.297 1.00 0.00 O ATOM 26338 H1 WAT 9165 116.569 64.244 14.705 1.00 0.00 H ATOM 26339 H2 WAT 9165 116.971 63.624 13.384 1.00 0.00 H TER 26341 WAT 9165 ATOM 26341 O WAT 9166 54.290 94.777 101.966 1.00 0.00 O ATOM 26342 H1 WAT 9166 54.690 93.985 101.607 1.00 0.00 H ATOM 26343 H2 WAT 9166 53.380 94.740 101.674 1.00 0.00 H TER 26345 WAT 9166 ATOM 26345 O WAT 9167 48.922 87.926 78.281 1.00 0.00 O ATOM 26346 H1 WAT 9167 48.985 87.192 77.670 1.00 0.00 H ATOM 26347 H2 WAT 9167 49.828 88.102 78.538 1.00 0.00 H TER 26349 WAT 9167 ATOM 26349 O WAT 9168 34.248 27.043 113.590 1.00 0.00 O ATOM 26350 H1 WAT 9168 34.890 26.334 113.571 1.00 0.00 H ATOM 26351 H2 WAT 9168 34.419 27.499 114.414 1.00 0.00 H TER 26353 WAT 9168 ATOM 26353 O WAT 9169 106.772 59.294 61.534 1.00 0.00 O ATOM 26354 H1 WAT 9169 106.444 59.107 60.654 1.00 0.00 H ATOM 26355 H2 WAT 9169 107.307 58.533 61.757 1.00 0.00 H TER 26357 WAT 9169 ATOM 26357 O WAT 9170 124.942 5.636 70.167 1.00 0.00 O ATOM 26358 H1 WAT 9170 124.807 6.017 69.300 1.00 0.00 H ATOM 26359 H2 WAT 9170 124.172 5.085 70.309 1.00 0.00 H TER 26361 WAT 9170 ATOM 26361 O WAT 9171 12.452 71.410 140.967 1.00 0.00 O ATOM 26362 H1 WAT 9171 11.873 70.658 140.838 1.00 0.00 H ATOM 26363 H2 WAT 9171 13.111 71.101 141.588 1.00 0.00 H TER 26365 WAT 9171 ATOM 26365 O WAT 9172 103.965 70.457 151.417 1.00 0.00 O ATOM 26366 H1 WAT 9172 103.983 70.040 150.556 1.00 0.00 H ATOM 26367 H2 WAT 9172 104.757 70.142 151.852 1.00 0.00 H TER 26369 WAT 9172 ATOM 26369 O WAT 9173 77.788 97.717 65.670 1.00 0.00 O ATOM 26370 H1 WAT 9173 77.010 97.932 66.185 1.00 0.00 H ATOM 26371 H2 WAT 9173 78.067 96.863 66.002 1.00 0.00 H TER 26373 WAT 9173 ATOM 26373 O WAT 9174 24.009 28.715 24.158 1.00 0.00 O ATOM 26374 H1 WAT 9174 24.701 28.054 24.162 1.00 0.00 H ATOM 26375 H2 WAT 9174 23.954 28.999 23.246 1.00 0.00 H TER 26377 WAT 9174 ATOM 26377 O WAT 9175 4.531 70.142 90.373 1.00 0.00 O ATOM 26378 H1 WAT 9175 5.380 69.702 90.332 1.00 0.00 H ATOM 26379 H2 WAT 9175 4.615 70.883 89.773 1.00 0.00 H TER 26381 WAT 9175 ATOM 26381 O WAT 9176 10.256 104.248 132.016 1.00 0.00 O ATOM 26382 H1 WAT 9176 11.039 103.997 132.506 1.00 0.00 H ATOM 26383 H2 WAT 9176 10.312 103.747 131.202 1.00 0.00 H TER 26385 WAT 9176 END